smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Cc1nc(C(F)(F)N2CCC[C@H]3CN(Cc4ccccc4)C[C@H]32)nc(Cl)c1C ZINC001164621080 719085739 /nfs/dbraw/zinc/08/57/39/719085739.db2.gz GXFQOTUOQOODBS-ZWKOTPCHSA-N 0 3 406.908 4.393 20 0 HIADHN CC(C)N(C)Cc1nn(C(F)(F)c2cccc3ccnc(Cl)c32)c2c1CCNC2 ZINC001164682613 719626656 /nfs/dbraw/zinc/62/66/56/719626656.db2.gz OMUFUDGKEZLXLC-UHFFFAOYSA-N 0 3 419.907 4.168 20 0 HIADHN Cc1nc(CN2CCCC23CCN(c2ncnc4c2ccn4C(C)C)CC3)cs1 ZINC001164692629 719812624 /nfs/dbraw/zinc/81/26/24/719812624.db2.gz PSNYKXROKGVUAH-UHFFFAOYSA-N 0 3 410.591 4.412 20 0 HIADHN Clc1cccc2c1nc(Cl)nc2N1CC[C@@H]2[C@@H]1CCN2Cc1cccnc1 ZINC001164726535 720372656 /nfs/dbraw/zinc/37/26/56/720372656.db2.gz PDINAJOIEJTJCV-SJORKVTESA-N 0 3 400.313 4.185 20 0 HIADHN COc1cc2c(cc1F)cc(Cl)nc2N1CC[C@@H]2[C@@H]1CCN2Cc1cccnc1 ZINC001164724150 720488664 /nfs/dbraw/zinc/48/86/64/720488664.db2.gz DYRWQFXLIDNLQI-MOPGFXCFSA-N 0 3 412.896 4.284 20 0 HIADHN c1ccc(-c2cc(N3CCN4C[C@H](Oc5cncnc5)C[C@@H]4C3)nc3ccccc32)cc1 ZINC001164737191 720755559 /nfs/dbraw/zinc/75/55/59/720755559.db2.gz AMWKNJRJMAQHJI-NHCUHLMSSA-N 0 3 423.520 4.034 20 0 HIADHN Clc1cc(-c2ccccc2)cc(N2CCN3C[C@@H](OCc4cccnc4)C[C@H]3C2)n1 ZINC001164863453 721085520 /nfs/dbraw/zinc/08/55/20/721085520.db2.gz CIFXWCIJBGOLQK-VXKWHMMOSA-N 0 3 420.944 4.277 20 0 HIADHN Cn1cc(CN2CC[C@H]3CN(c4c(Cl)ccc5ccc(Cl)nc54)C[C@H]3C2)cn1 ZINC001164768940 721235023 /nfs/dbraw/zinc/23/50/23/721235023.db2.gz YXGUHAWHZRUYJM-DLBZAZTESA-N 0 3 416.356 4.233 20 0 HIADHN Cc1nc2ccccc2c(N2CCC(F)(F)[C@@]3(CCN(Cc4ccccn4)C3)C2)n1 ZINC001164907410 721692820 /nfs/dbraw/zinc/69/28/20/721692820.db2.gz SJSPEETWLVTMEZ-JOCHJYFZSA-N 0 3 409.484 4.071 20 0 HIADHN COc1ccc2ccnc(N3CCC(F)(F)[C@]4(CCN(Cc5ccccn5)C4)C3)c2c1 ZINC001164904971 721717731 /nfs/dbraw/zinc/71/77/31/721717731.db2.gz GAFFYMGKCWUUHA-QHCPKHFHSA-N 0 3 424.495 4.376 20 0 HIADHN Clc1cccc2ccc(N3CC[C@@H]4CN(Cc5cccnc5)CCO[C@@H]4C3)nc12 ZINC001164976509 722110734 /nfs/dbraw/zinc/11/07/34/722110734.db2.gz LSFXSNYCLFPYAN-TZIWHRDSSA-N 0 3 408.933 4.011 20 0 HIADHN COc1cc2ncc(N3CCC[C@@]4(CCN4Cc4cccc(F)c4)C3)nc2cc1OC ZINC001164994521 722199070 /nfs/dbraw/zinc/19/90/70/722199070.db2.gz NMSNNJBVOIVGKG-XMMPIXPASA-N 0 3 422.504 4.031 20 0 HIADHN COc1cc(C)c2ncnc(N3CCC[C@@]4(CCN4Cc4cccc(F)c4)C3)c2c1 ZINC001164995470 722214056 /nfs/dbraw/zinc/21/40/56/722214056.db2.gz JAJBTZADUHMSTA-XMMPIXPASA-N 0 3 406.505 4.331 20 0 HIADHN CCCC(O)(CCC)CC(=O)Nc1cc(C)nn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000436010840 861301543 /nfs/dbraw/zinc/30/15/43/861301543.db2.gz MKHYUGLTMZCWLO-NRFANRHFSA-N 0 3 412.578 4.298 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)C1(c2ccc(C(F)(F)F)cc2)CC1 ZINC000436095462 861377242 /nfs/dbraw/zinc/37/72/42/861377242.db2.gz AOZXAYONBMCBNT-UHFFFAOYSA-N 0 3 402.460 4.302 20 0 HIADHN OCC[C@H](NCc1ccc(I)c(Cl)c1)c1ccccc1 ZINC000436132847 861424741 /nfs/dbraw/zinc/42/47/41/861424741.db2.gz WMIVNDHLPJCGIZ-INIZCTEOSA-N 0 3 401.675 4.158 20 0 HIADHN CC(C)c1ccc(-n2ccnc2SCC(=O)NCc2ccccc2CN(C)C)cc1 ZINC000007030715 845237265 /nfs/dbraw/zinc/23/72/65/845237265.db2.gz JEMXQIRWERBBSA-UHFFFAOYSA-N 0 3 422.598 4.466 20 0 HIADHN Cc1c(Cl)cccc1NC(=O)CCNCc1cnn(Cc2ccc(F)cc2)c1 ZINC000436239306 861548483 /nfs/dbraw/zinc/54/84/83/861548483.db2.gz NQKCJEDQVQZMBR-UHFFFAOYSA-N 0 3 400.885 4.151 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)CN(C)Cc3ccc4ccccc4c3)cc2)CC1 ZINC000007218911 845287375 /nfs/dbraw/zinc/28/73/75/845287375.db2.gz DRLGKQPMBLUPGV-UHFFFAOYSA-N 0 3 416.569 4.052 20 0 HIADHN C=CCn1c(SCC(=O)C(C#N)c2nc(C)cs2)nnc1-c1ccc(F)cc1 ZINC000007833921 845425951 /nfs/dbraw/zinc/42/59/51/845425951.db2.gz GSDIJOPMLSUIHS-HNNXBMFYSA-N 0 3 413.503 4.004 20 0 HIADHN Cc1c(Cl)cccc1NC(=O)CNC(=O)CN[C@@H](C)c1cccc2ccccc21 ZINC000007920219 845447685 /nfs/dbraw/zinc/44/76/85/845447685.db2.gz JWLKZAPHOJZWEE-INIZCTEOSA-N 0 3 409.917 4.207 20 0 HIADHN O=C(N[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)N[C@H]1CCN(C2CC2)C1 ZINC000436261532 861573376 /nfs/dbraw/zinc/57/33/76/861573376.db2.gz PDIMLYGDYBACIM-DZGCQCFKSA-N 0 3 409.374 4.235 20 0 HIADHN O=C(CCN(Cc1cccs1)Cc1cccs1)NC(=O)NCc1ccccc1 ZINC000010226361 845634405 /nfs/dbraw/zinc/63/44/05/845634405.db2.gz MHYIYFCYEUAFKI-UHFFFAOYSA-N 0 3 413.568 4.228 20 0 HIADHN CCOC(=O)c1c(C)[nH]c(C(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)c1C ZINC000014071827 845923153 /nfs/dbraw/zinc/92/31/53/845923153.db2.gz XQBBMYPFQBVOBS-QGZVFWFLSA-N 0 3 417.575 4.073 20 0 HIADHN O=S(=O)(c1ccc(CNCc2ccc(C(F)(F)F)cc2)cc1)N1CCCCC1 ZINC000017317605 846244378 /nfs/dbraw/zinc/24/43/78/846244378.db2.gz GLSLBNANRMZIBX-UHFFFAOYSA-N 0 3 412.477 4.170 20 0 HIADHN COc1ccc([C@H](CNC(=O)CCc2nc3ccccc3s2)N2CCCC2)cc1 ZINC000017911549 846276774 /nfs/dbraw/zinc/27/67/74/846276774.db2.gz WLHATHQIMOYKAJ-FQEVSTJZSA-N 0 3 409.555 4.191 20 0 HIADHN COc1ccc([C@H](CNC(=O)c2ccc(OC)c3ccccc23)N2CCCC2)cc1 ZINC000017911685 846276801 /nfs/dbraw/zinc/27/68/01/846276801.db2.gz OMTNIQXMERUMAY-QHCPKHFHSA-N 0 3 404.510 4.424 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cc(-c2csc(C)n2)c[nH]1)c1cccc(OC)c1 ZINC000021071885 846402921 /nfs/dbraw/zinc/40/29/21/846402921.db2.gz OXLYASRPIDLYEA-NRFANRHFSA-N 0 3 412.559 4.268 20 0 HIADHN S=c1n(CN2CCN(Cc3cccc4ccccc43)CC2)nc2n1CCCCC2 ZINC000023475254 846704590 /nfs/dbraw/zinc/70/45/90/846704590.db2.gz MGYWDTWJSMJHBF-UHFFFAOYSA-N 0 3 407.587 4.069 20 0 HIADHN CC[C@@H](NCC(=O)N1CCC(C(=O)Nc2ccccc2)CC1)c1ccc(Cl)cc1 ZINC000024255755 846806844 /nfs/dbraw/zinc/80/68/44/846806844.db2.gz ZPGDAMJVYALKRK-OAQYLSRUSA-N 0 3 413.949 4.258 20 0 HIADHN CC[C@H](NCC(=O)N1CCC(C(=O)Nc2ccccc2)CC1)c1ccc(Cl)cc1 ZINC000024255760 846806892 /nfs/dbraw/zinc/80/68/92/846806892.db2.gz ZPGDAMJVYALKRK-NRFANRHFSA-N 0 3 413.949 4.258 20 0 HIADHN Cc1c(C(=O)NC2CCN(Cc3ccccc3)CC2)cnn1-c1cccc(Cl)c1 ZINC000024541575 846835604 /nfs/dbraw/zinc/83/56/04/846835604.db2.gz WVGNPTVUYPMGNK-UHFFFAOYSA-N 0 3 408.933 4.229 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)/C=C/c3ccc4ccccc4n3)c(C)c2)CC1 ZINC000025186296 846938696 /nfs/dbraw/zinc/93/86/96/846938696.db2.gz NWXFQUJVURUCFA-JLHYYAGUSA-N 0 3 400.526 4.337 20 0 HIADHN CC(C)[C@@H](CNC(=O)c1cccc(OC[C@H]2CCCO2)c1)N1CCc2ccccc2C1 ZINC000025540599 846996597 /nfs/dbraw/zinc/99/65/97/846996597.db2.gz LWUFOVFVLKNZAH-JWQCQUIFSA-N 0 3 422.569 4.057 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)C(C)(C)Oc1ccc(F)cc1)c1cccc(OC)c1 ZINC000025860342 847047026 /nfs/dbraw/zinc/04/70/26/847047026.db2.gz PNIBVKLWNMLJNB-NRFANRHFSA-N 0 3 402.510 4.191 20 0 HIADHN COc1ccc(C(=O)C2CCN(CCC(=O)Nc3ccccc3SC)CC2)cc1 ZINC000025947167 847061154 /nfs/dbraw/zinc/06/11/54/847061154.db2.gz BMEJBWHZVANLSS-UHFFFAOYSA-N 0 3 412.555 4.341 20 0 HIADHN CN(Cc1ccc(OC(F)F)cc1)C(=O)NCC(C)(C)N1CCc2ccccc2C1 ZINC000026165361 847096992 /nfs/dbraw/zinc/09/69/92/847096992.db2.gz JEAIMCWKLGCLHX-UHFFFAOYSA-N 0 3 417.500 4.266 20 0 HIADHN CC(C)C(=O)NCCNCc1cccc(NC(=O)c2ccc(Cl)cc2Cl)c1 ZINC000026309381 847122677 /nfs/dbraw/zinc/12/26/77/847122677.db2.gz YUEQNIAOAXTUPW-UHFFFAOYSA-N 0 3 408.329 4.108 20 0 HIADHN CC(C)[C@@H](NCc1cc2c(c(Br)c1)OCO2)c1ccc2c(c1)OCCO2 ZINC000026312719 847122953 /nfs/dbraw/zinc/12/29/53/847122953.db2.gz XCCBKVVMPMRTET-LJQANCHMSA-N 0 3 420.303 4.436 20 0 HIADHN COc1ccc(CN(C)CCC(=O)N[C@@H]2CCCc3ccccc32)cc1OC(F)F ZINC000026453589 847152494 /nfs/dbraw/zinc/15/24/94/847152494.db2.gz ZLMDZHMYGBAQFB-LJQANCHMSA-N 0 3 418.484 4.312 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)COc3ccc(Cl)cc3C)c(C)c2)CC1 ZINC000026908819 847220940 /nfs/dbraw/zinc/22/09/40/847220940.db2.gz NMFZTJAPIJQRNW-UHFFFAOYSA-N 0 3 401.938 4.116 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cc(-c4csc(C)n4)c[nH]3)c(C)c2)CC1 ZINC000026908957 847221296 /nfs/dbraw/zinc/22/12/96/847221296.db2.gz YIERBHWVZWDOIO-UHFFFAOYSA-N 0 3 409.559 4.149 20 0 HIADHN Cc1cc(NC(=O)CN(C)[C@H](c2ccccc2C)C(C)C)n(-c2nc(C)cc(C)n2)n1 ZINC000436419173 861774268 /nfs/dbraw/zinc/77/42/68/861774268.db2.gz BGLFNKZMOALINS-QHCPKHFHSA-N 0 3 420.561 4.164 20 0 HIADHN CCOc1ccc(/C=C(\C#N)C(=O)N2CCCN(Cc3ccccc3C)CC2)cc1 ZINC000027390052 847294943 /nfs/dbraw/zinc/29/49/43/847294943.db2.gz XLQNTXBZRZBTNJ-HAVVHWLPSA-N 0 3 403.526 4.035 20 0 HIADHN COc1cc(CNC[C@@H]2COc3ccccc3O2)cc(OC)c1OCc1ccccc1 ZINC000027397917 847297398 /nfs/dbraw/zinc/29/73/98/847297398.db2.gz QKZXZVWAPHFIPI-HXUWFJFHSA-N 0 3 421.493 4.212 20 0 HIADHN Cc1cccc(-c2nnc(-c3ccc(C(=O)N[C@@H](C)CN4CCCCC4)cc3)o2)c1 ZINC000027762972 847348485 /nfs/dbraw/zinc/34/84/85/847348485.db2.gz QOERFKLMCPYYTP-SFHVURJKSA-N 0 3 404.514 4.316 20 0 HIADHN Cc1ccc(NC(=O)NC(=O)[C@@H](C)N[C@@H](C)c2ccc(NC(=O)C3CC3)cc2)c(C)c1 ZINC000028349104 847409571 /nfs/dbraw/zinc/40/95/71/847409571.db2.gz YSPZFXIDVBNZMT-DLBZAZTESA-N 0 3 422.529 4.039 20 0 HIADHN c1cnn(Cc2ccccc2CNCc2cn(-c3ccccc3)nc2-c2cccnc2)c1 ZINC000028817277 847464896 /nfs/dbraw/zinc/46/48/96/847464896.db2.gz GLDKKJHWQBTRMY-UHFFFAOYSA-N 0 3 420.520 4.469 20 0 HIADHN O=C(CN[C@H](CCCc1ccccc1)c1ccccc1)Nc1ccc2[nH]c(=O)[nH]c2c1 ZINC000029148331 847514906 /nfs/dbraw/zinc/51/49/06/847514906.db2.gz YLYGDRWAFOZIBX-OAQYLSRUSA-N 0 3 414.509 4.149 20 0 HIADHN Cc1noc2nc(C3CC3)cc(C(=O)NC[C@H](C(C)C)N3CCc4ccccc4C3)c12 ZINC000029174393 847520902 /nfs/dbraw/zinc/52/09/02/847520902.db2.gz UHMVEZDPKAEAGN-JOCHJYFZSA-N 0 3 418.541 4.221 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)CCC(=O)c3cc(C)sc3C)c(C)c2)CC1 ZINC000029376563 847555521 /nfs/dbraw/zinc/55/55/21/847555521.db2.gz NMUBTUGNOCXDCE-UHFFFAOYSA-N 0 3 413.587 4.417 20 0 HIADHN COc1ccc(CCNC(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)cc1 ZINC000029655170 847598057 /nfs/dbraw/zinc/59/80/57/847598057.db2.gz BFUAHGRHQRSULV-HXUWFJFHSA-N 0 3 401.576 4.072 20 0 HIADHN CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H](c2ccccc2)c2ccc(C)cc2)cc1 ZINC000029700998 847603723 /nfs/dbraw/zinc/60/37/23/847603723.db2.gz XHHGIPHQYBTOHL-NOZRDPDXSA-N 0 3 404.510 4.072 20 0 HIADHN Cc1cccc(-c2nc(CC(=O)NCCCN3CCc4ccccc4C3)cs2)c1 ZINC000029839790 847630002 /nfs/dbraw/zinc/63/00/02/847630002.db2.gz LVAUYFXTPKGBLB-UHFFFAOYSA-N 0 3 405.567 4.226 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cc(-c2ccccc2F)on1)c1cccc(OC)c1 ZINC000030037587 847676486 /nfs/dbraw/zinc/67/64/86/847676486.db2.gz FKMYGHLRZMZLEP-NRFANRHFSA-N 0 3 411.477 4.302 20 0 HIADHN CC(=O)Nc1ccc(OC[C@@H](O)CN(Cc2ccccc2)Cc2ccccc2)cc1 ZINC000030529752 847729033 /nfs/dbraw/zinc/72/90/33/847729033.db2.gz YHVVCCVTEQKEAR-DEOSSOPVSA-N 0 3 404.510 4.087 20 0 HIADHN COc1cc(CNCc2ccccc2Cn2cccn2)ccc1OCc1ccncc1 ZINC000030629097 847747096 /nfs/dbraw/zinc/74/70/96/847747096.db2.gz QFKKEYLFXXTEOT-UHFFFAOYSA-N 0 3 414.509 4.204 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2CNCc2ccc(Cn3cncn3)cc2)o1 ZINC000030634291 847748898 /nfs/dbraw/zinc/74/88/98/847748898.db2.gz SNKYFTLHAMXLTD-UHFFFAOYSA-N 0 3 424.508 4.370 20 0 HIADHN Clc1ccccc1COc1cccc(CNCc2ccc(N3CCOCC3)nc2)c1 ZINC000030637030 847750189 /nfs/dbraw/zinc/75/01/89/847750189.db2.gz VQPUDGJZDJLVKM-UHFFFAOYSA-N 0 3 423.944 4.440 20 0 HIADHN Cc1ccc(S(=O)(=O)N2CCC(NCc3c(Cl)cccc3Cl)CC2)cc1 ZINC000030653425 847753653 /nfs/dbraw/zinc/75/36/53/847753653.db2.gz YSXPHYISEZCEIO-UHFFFAOYSA-N 0 3 413.370 4.245 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)[C@@H](C)Oc3ccc(Cl)cc3C)cc2)CC1 ZINC000030669658 847755231 /nfs/dbraw/zinc/75/52/31/847755231.db2.gz RLKFBJWTPDUSRR-QGZVFWFLSA-N 0 3 401.938 4.196 20 0 HIADHN c1cnn(-c2ncccc2CNCc2cn(-c3ccccc3)nc2-c2ccccc2)c1 ZINC000030902247 847796320 /nfs/dbraw/zinc/79/63/20/847796320.db2.gz CCLADGSKXCGAFL-UHFFFAOYSA-N 0 3 406.493 4.410 20 0 HIADHN O=C(NCc1ccc(OC(F)(F)F)cc1)NC[C@@H](c1cccs1)N1CCCC1 ZINC000030989123 847805950 /nfs/dbraw/zinc/80/59/50/847805950.db2.gz ONOFDZKNCYBANT-INIZCTEOSA-N 0 3 413.465 4.283 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N(C)Cc1cnn(-c2ccccc2)c1)c1ccsc1 ZINC000031194004 847840672 /nfs/dbraw/zinc/84/06/72/847840672.db2.gz UMAGIVJQXPGJCJ-NRFANRHFSA-N 0 3 411.575 4.158 20 0 HIADHN C[C@H](NC(=O)c1ccccc1NC(=O)CN([C@@H](C)C1CC1)C1CC1)c1ccccc1 ZINC000031654507 847922919 /nfs/dbraw/zinc/92/29/19/847922919.db2.gz WZFDQENLBWRZGD-ROUUACIJSA-N 0 3 405.542 4.379 20 0 HIADHN COc1ccc2cc(C(=O)N3CCCN(Cc4ccccc4C)CC3)c(C)nc2c1 ZINC000031765725 847944605 /nfs/dbraw/zinc/94/46/05/847944605.db2.gz ASAYSWOCCOWSMA-UHFFFAOYSA-N 0 3 403.526 4.208 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1ccc(Cl)c(N2CCCC2=O)c1)c1ccsc1 ZINC000031986182 847974952 /nfs/dbraw/zinc/97/49/52/847974952.db2.gz XLFUOPXEDNYGNJ-IBGZPJMESA-N 0 3 419.978 4.341 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cc(Cl)c2c(c1)OCCCO2)c1ccsc1 ZINC000031986511 847975629 /nfs/dbraw/zinc/97/56/29/847975629.db2.gz MVKPJJZVRQKBMY-QGZVFWFLSA-N 0 3 408.951 4.376 20 0 HIADHN Cc1nc(COc2cccc(C(=O)NCCCN3CCc4ccccc4C3)c2)cs1 ZINC000032400492 848018937 /nfs/dbraw/zinc/01/89/37/848018937.db2.gz JQBLCYNYAQDSKN-UHFFFAOYSA-N 0 3 421.566 4.209 20 0 HIADHN Cc1ccc(C(=O)NC[C@@H](c2ccccc2)N(C)C)cc1NC(=O)c1ccccc1F ZINC000032480435 848037124 /nfs/dbraw/zinc/03/71/24/848037124.db2.gz AJNJJGUBTGWBHC-QHCPKHFHSA-N 0 3 419.500 4.419 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)CCOc3cccc(Cl)c3)c(C)c2)CC1 ZINC000032710747 848066690 /nfs/dbraw/zinc/06/66/90/848066690.db2.gz XFPAGTVDBYEXKE-UHFFFAOYSA-N 0 3 401.938 4.198 20 0 HIADHN O=C(c1cc(CCc2ccccc2)ccc1[O-])N1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000436599375 861864287 /nfs/dbraw/zinc/86/42/87/861864287.db2.gz AVGQPUIXBJVDFF-XUZZJYLKSA-N 0 3 404.554 4.266 20 0 HIADHN O=C(c1cc(CCc2ccccc2)ccc1[O-])N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000436599375 861864288 /nfs/dbraw/zinc/86/42/88/861864288.db2.gz AVGQPUIXBJVDFF-XUZZJYLKSA-N 0 3 404.554 4.266 20 0 HIADHN O=C(Nc1ccc(F)cc1)[C@H](NCCc1ccc2c(c1)OCCO2)c1ccccc1 ZINC000038433333 848178250 /nfs/dbraw/zinc/17/82/50/848178250.db2.gz KPBBTRXELKKFFU-HSZRJFAPSA-N 0 3 406.457 4.109 20 0 HIADHN COC(=O)c1cn(CC(=O)C(C#N)c2nc(-c3ccccc3)cs2)c2ccccc12 ZINC000041534296 848227609 /nfs/dbraw/zinc/22/76/09/848227609.db2.gz KWDLKXZSASDXNE-KRWDZBQOSA-N 0 3 415.474 4.428 20 0 HIADHN Cc1nc2c3ccccc3nn2c(C)c1CCC(=O)C(C#N)c1nc2ccccc2o1 ZINC000041542317 848229000 /nfs/dbraw/zinc/22/90/00/848229000.db2.gz TZAYJOHBLHCSOL-GOSISDBHSA-N 0 3 409.449 4.450 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=S)Nc3ccc(F)cc3F)CC2)c1 ZINC000041741254 848241629 /nfs/dbraw/zinc/24/16/29/848241629.db2.gz WJJFOQWINWGIHP-UHFFFAOYSA-N 0 3 418.557 4.162 20 0 HIADHN O=C(c1ccc(CNCc2ccc(OCc3ccncc3)cc2)cc1)N1CCCC1 ZINC000042187201 848298462 /nfs/dbraw/zinc/29/84/62/848298462.db2.gz WEUBIKIWEWGUII-UHFFFAOYSA-N 0 3 401.510 4.186 20 0 HIADHN COc1cc([C@@H](C)NCc2cc(OC)c3c(c2)OCCO3)ccc1OCC(C)C ZINC000042201786 848300036 /nfs/dbraw/zinc/30/00/36/848300036.db2.gz DDLJUNBDJREJTE-MRXNPFEDSA-N 0 3 401.503 4.361 20 0 HIADHN O[C@@H](COc1cc(Cl)ccc1Cl)CN1CCC([C@@H](O)c2ccccc2)CC1 ZINC000042657705 848340555 /nfs/dbraw/zinc/34/05/55/848340555.db2.gz ILDADSSZZDBLRT-NQIIRXRSSA-N 0 3 410.341 4.179 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)N1CCC(c2nc3ccccc3[nH]2)CC1 ZINC000042813082 848356698 /nfs/dbraw/zinc/35/66/98/848356698.db2.gz PGSQXSRPGCUURX-QHCPKHFHSA-N 0 3 417.557 4.289 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N1CCc2[nH]c3ccc(F)cc3c2C1 ZINC000043231459 848397879 /nfs/dbraw/zinc/39/78/79/848397879.db2.gz BXHRFGDDLZCVIN-HXUWFJFHSA-N 0 3 412.534 4.273 20 0 HIADHN Cc1ccccc1CN1CCCN(C(=O)N[C@@H](c2ccccc2)c2ccccn2)CC1 ZINC000043295208 848405111 /nfs/dbraw/zinc/40/51/11/848405111.db2.gz OORGWSGWNFPTGR-VWLOTQADSA-N 0 3 414.553 4.397 20 0 HIADHN O=C(N[C@@H](c1ccccc1)c1ccccn1)N1CCCN(Cc2ccccc2)CC1 ZINC000043296490 848406796 /nfs/dbraw/zinc/40/67/96/848406796.db2.gz HFSVOEOIVPGTEB-DEOSSOPVSA-N 0 3 400.526 4.089 20 0 HIADHN CCN(CC)C(=O)c1cccc(NC(=O)NC[C@H](c2ccsc2)N(CC)CC)c1 ZINC000043498146 848432304 /nfs/dbraw/zinc/43/23/04/848432304.db2.gz GKKGBQYVZCWADI-HXUWFJFHSA-N 0 3 416.591 4.435 20 0 HIADHN COc1ccc(-c2nc(C(=O)N3c4ccccc4CC[C@@H]3CN(C)C)cs2)cc1 ZINC000436725382 861910335 /nfs/dbraw/zinc/91/03/35/861910335.db2.gz QPDSIMNWHXFPTG-GOSISDBHSA-N 0 3 407.539 4.342 20 0 HIADHN CN(C)C[C@@H]1CCc2ccccc2N1C(=O)c1cnc(-c2ccc3c(c2)OCO3)s1 ZINC000436724331 861911412 /nfs/dbraw/zinc/91/14/12/861911412.db2.gz NPUIORHZDSUWOT-KRWDZBQOSA-N 0 3 421.522 4.062 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1ccc(CC(=O)NC(C)C)cc1)c1ccsc1 ZINC000044149069 848522132 /nfs/dbraw/zinc/52/21/32/848522132.db2.gz HVVHCCNVGQABSV-HXUWFJFHSA-N 0 3 416.591 4.020 20 0 HIADHN CN(C)CCN(CCc1ccccc1)C(=S)Nc1ccc(OC(F)(F)F)cc1 ZINC000044158198 848523835 /nfs/dbraw/zinc/52/38/35/848523835.db2.gz DIBOCDFXWQXNLE-UHFFFAOYSA-N 0 3 411.493 4.388 20 0 HIADHN CNC(=O)c1ccc(C)c(NC(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)c1 ZINC000044182367 848527156 /nfs/dbraw/zinc/52/71/56/848527156.db2.gz CKLDYQFGFKLKFO-LJQANCHMSA-N 0 3 414.575 4.011 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3oc(Br)cc3C)c(C)c2)CC1 ZINC000044313537 848544425 /nfs/dbraw/zinc/54/44/25/848544425.db2.gz XTKFQWUJWBAATK-UHFFFAOYSA-N 0 3 406.324 4.053 20 0 HIADHN CCN(Cc1cccc(NC(=O)NC[C@H](c2ccccc2)N2CCCC2)c1)C(C)=O ZINC000044381025 848554193 /nfs/dbraw/zinc/55/41/93/848554193.db2.gz BISKBQGBUWBUGZ-HSZRJFAPSA-N 0 3 408.546 4.014 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N[C@@H](C)c1nc2ccccc2[nH]1)c1cccc(OC)c1 ZINC000045595656 848698277 /nfs/dbraw/zinc/69/82/77/848698277.db2.gz GSDNTYPSMNGPOG-KKSFZXQISA-N 0 3 409.534 4.015 20 0 HIADHN COc1cc(-c2noc(CCCCCN[C@@H](C)c3csc(C)n3)n2)ccc1O ZINC000436764325 861955132 /nfs/dbraw/zinc/95/51/32/861955132.db2.gz QLAWTFFRHGCWSO-ZDUSSCGKSA-N 0 3 402.520 4.279 20 0 HIADHN CN(C)Cc1ccccc1NC(=O)[C@H]1CCCN(c2ncccc2C(F)(F)F)C1 ZINC000046787854 848933956 /nfs/dbraw/zinc/93/39/56/848933956.db2.gz IZGRVEGPJASFDE-INIZCTEOSA-N 0 3 406.452 4.017 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)N(C)C3CCCCCC3)CC2)c1 ZINC000046867878 848950578 /nfs/dbraw/zinc/95/05/78/848950578.db2.gz RFMNFDJLOBNTMP-UHFFFAOYSA-N 0 3 400.611 4.261 20 0 HIADHN C[C@H](c1nc2ccccc2s1)N(C)C(=O)NCC1(N2CCSCC2)CCCC1 ZINC000047008904 848971721 /nfs/dbraw/zinc/97/17/21/848971721.db2.gz QGDJNIPBAWXNOP-MRXNPFEDSA-N 0 3 418.632 4.360 20 0 HIADHN CN(C)Cc1cccc(NC(=O)c2cnn(-c3ccc(F)cc3)c2C(F)(F)F)c1 ZINC000047454050 849050766 /nfs/dbraw/zinc/05/07/66/849050766.db2.gz ZCXZISTYCLKBKK-UHFFFAOYSA-N 0 3 406.383 4.344 20 0 HIADHN O=C(C[C@H]1C=CCC1)NCCCCN1CCN(c2cccc(C(F)(F)F)c2)CC1 ZINC000047460954 849051827 /nfs/dbraw/zinc/05/18/27/849051827.db2.gz OEMUBXZUPCUZKP-SFHVURJKSA-N 0 3 409.496 4.080 20 0 HIADHN CC(C)(C)NC(=O)c1cccc(NC(=O)NC[C@@H](c2ccccc2)N2CCCC2)c1 ZINC000047586442 849078711 /nfs/dbraw/zinc/07/87/11/849078711.db2.gz BIPMMTHGXLMFQS-NRFANRHFSA-N 0 3 408.546 4.174 20 0 HIADHN CC[NH+]1CCC(n2nccc2NC(=O)c2cc(Cc3ccccc3)ccc2[O-])CC1 ZINC000436789130 861981251 /nfs/dbraw/zinc/98/12/51/861981251.db2.gz CMCYLLCZBSLUCW-UHFFFAOYSA-N 0 3 404.514 4.089 20 0 HIADHN COCCOc1cc(C)ccc1NC(=O)N1CCCN(Cc2ccccc2C)CC1 ZINC000047854575 849127161 /nfs/dbraw/zinc/12/71/61/849127161.db2.gz LRAVCYBECJVYKX-UHFFFAOYSA-N 0 3 411.546 4.068 20 0 HIADHN CCC(CC)(CNC(=O)c1cc(OC)c([O-])c(OC)c1)[NH2+][C@H](C)c1ccccc1 ZINC000436788973 861982478 /nfs/dbraw/zinc/98/24/78/861982478.db2.gz ALGMBGMOBHWUDC-MRXNPFEDSA-N 0 3 400.519 4.049 20 0 HIADHN COc1cccc([C@H](CNC(=O)Nc2cccc(OC(F)F)c2)N2CCCC2)c1 ZINC000047906762 849135298 /nfs/dbraw/zinc/13/52/98/849135298.db2.gz HIQNINANGGZQMN-IBGZPJMESA-N 0 3 405.445 4.255 20 0 HIADHN COC(=O)c1cc(NC(=O)NC[C@H](c2cccs2)N2CCCC2)ccc1Cl ZINC000048128031 849174981 /nfs/dbraw/zinc/17/49/81/849174981.db2.gz RIWVLGOFPKSUMI-MRXNPFEDSA-N 0 3 407.923 4.147 20 0 HIADHN C[C@H](Sc1ccc(Br)cc1)C(=O)NCc1ccccc1CN(C)C ZINC000048269417 849201560 /nfs/dbraw/zinc/20/15/60/849201560.db2.gz NZBOHUDZFYQYNK-AWEZNQCLSA-N 0 3 407.377 4.308 20 0 HIADHN CC[C@@H](NCc1cccc(Br)c1)c1ccccc1OCC(=O)N(C)C ZINC000048750585 849263891 /nfs/dbraw/zinc/26/38/91/849263891.db2.gz BXESJANPQUYOMO-GOSISDBHSA-N 0 3 405.336 4.157 20 0 HIADHN CC[C@@H](NCc1ccc(-n2ccnc2)cc1)c1ccccc1OCC(=O)N1CCCC1 ZINC000048750469 849264676 /nfs/dbraw/zinc/26/46/76/849264676.db2.gz FWEUFZDLMQVKFD-HSZRJFAPSA-N 0 3 418.541 4.114 20 0 HIADHN N#CC(C(=O)C1CCN(C(=O)CCc2ccccc2)CC1)c1ccc2ccccc2n1 ZINC000048857231 849276338 /nfs/dbraw/zinc/27/63/38/849276338.db2.gz KXAIVFGWDUHPMM-QFIPXVFZSA-N 0 3 411.505 4.282 20 0 HIADHN C[C@H]([NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1)c1ccc(Br)s1 ZINC000436828850 862010146 /nfs/dbraw/zinc/01/01/46/862010146.db2.gz NWBFGBKIHAVCGO-LBPRGKRZSA-N 0 3 409.349 4.172 20 0 HIADHN O=C(NC[C@@H]1CCCN(Cc2cccs2)C1)c1ccn(-c2ccccc2Cl)n1 ZINC000050631525 849400821 /nfs/dbraw/zinc/40/08/21/849400821.db2.gz RZBXMRRKQBYOMW-INIZCTEOSA-N 0 3 414.962 4.229 20 0 HIADHN O=C(c1ccccc1[O-])N1CCC([NH2+][C@H]2CCCOc3ccc(Cl)cc32)CC1 ZINC000436833713 862014315 /nfs/dbraw/zinc/01/43/15/862014315.db2.gz YSUZQLMJEARUIV-IBGZPJMESA-N 0 3 400.906 4.154 20 0 HIADHN C[C@@H](c1nc2ccccc2s1)[C@H](C)[NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1 ZINC000436833772 862015680 /nfs/dbraw/zinc/01/56/80/862015680.db2.gz ZADBQSAKOXBXFG-CVEARBPZSA-N 0 3 409.555 4.388 20 0 HIADHN COCCN(CCC(=O)Nc1ccc(Br)cc1F)Cc1cccs1 ZINC000051283058 849452508 /nfs/dbraw/zinc/45/25/08/849452508.db2.gz JSXIAPQORUUOCA-UHFFFAOYSA-N 0 3 415.328 4.127 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2ccc(C(=O)NCC(C)C)cc2C)N(C)C)cc1 ZINC000051645817 849495768 /nfs/dbraw/zinc/49/57/68/849495768.db2.gz QKLPZOBDSXBWLG-JOCHJYFZSA-N 0 3 410.562 4.114 20 0 HIADHN O=C(NCCc1c[nH]c2cc(F)ccc12)NC[C@@H](c1cccs1)N1CCCC1 ZINC000051753586 849512524 /nfs/dbraw/zinc/51/25/24/849512524.db2.gz VTQQJJXZAYHHLI-IBGZPJMESA-N 0 3 400.523 4.047 20 0 HIADHN O=C(NCCc1c[nH]c2cc(F)ccc12)NC[C@H](c1cccs1)N1CCCC1 ZINC000051753583 849512682 /nfs/dbraw/zinc/51/26/82/849512682.db2.gz VTQQJJXZAYHHLI-LJQANCHMSA-N 0 3 400.523 4.047 20 0 HIADHN Cc1cc([C@H]([NH2+]C2CCN(C(=O)c3ccccc3[O-])CC2)c2cccnc2)ccc1F ZINC000436853742 862032067 /nfs/dbraw/zinc/03/20/67/862032067.db2.gz DEUPGQMCCVMIGG-DEOSSOPVSA-N 0 3 419.500 4.219 20 0 HIADHN Cc1ccc(NC(=O)CNC2(c3ccc(Br)cc3)CCOCC2)c(C)c1 ZINC000052833889 849633390 /nfs/dbraw/zinc/63/33/90/849633390.db2.gz PTHRXAVRPVHZOH-UHFFFAOYSA-N 0 3 417.347 4.300 20 0 HIADHN O[C@@H](COc1ccc(F)cc1)CN1CCC(c2nc3cc(Cl)ccc3o2)CC1 ZINC000052993717 849653139 /nfs/dbraw/zinc/65/31/39/849653139.db2.gz XWCABZCMHRKJSP-QGZVFWFLSA-N 0 3 404.869 4.240 20 0 HIADHN O=C(NCc1ccc(F)cc1)C1CCN(Cc2ccc(OC(F)(F)F)cc2)CC1 ZINC000053049955 849658951 /nfs/dbraw/zinc/65/89/51/849658951.db2.gz VKEQBANQMBAAFK-UHFFFAOYSA-N 0 3 410.411 4.253 20 0 HIADHN CN(C)Cc1cccc(NC(=O)[C@H]2CCN(c3cc(Cl)ccc3Cl)C2=O)c1 ZINC000053477352 849718143 /nfs/dbraw/zinc/71/81/43/849718143.db2.gz OPWQHIKOYFLUGQ-MRXNPFEDSA-N 0 3 406.313 4.047 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)N1CCC(OCc2ccccc2)CC1 ZINC000053548377 849731233 /nfs/dbraw/zinc/73/12/33/849731233.db2.gz GCZDXPYTYPKHHE-NRFANRHFSA-N 0 3 413.587 4.276 20 0 HIADHN Cc1nc(-c2ccc(CNC(=O)NC[C@@H](c3ccccc3)N3CCCC3)o2)cs1 ZINC000054043567 849804273 /nfs/dbraw/zinc/80/42/73/849804273.db2.gz VFVGXRRZCBQCJO-FQEVSTJZSA-N 0 3 410.543 4.348 20 0 HIADHN CCOc1cc(-c2noc([C@@H]3CN(Cc4ccccc4)CCC3(F)F)n2)ccc1O ZINC000436880596 862058712 /nfs/dbraw/zinc/05/87/12/862058712.db2.gz RXNXILCRDYTKCZ-KRWDZBQOSA-N 0 3 415.440 4.466 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(C)c1C(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000054225436 849828996 /nfs/dbraw/zinc/82/89/96/849828996.db2.gz ZYTMIKAQSDUGGJ-LAUBAEHRSA-N 0 3 406.505 4.194 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)CCCc2nnc(-c3ccccc3)o2)C1 ZINC000054223148 849829132 /nfs/dbraw/zinc/82/91/32/849829132.db2.gz QEXRLRYJXQQPDW-NQIIRXRSSA-N 0 3 404.514 4.011 20 0 HIADHN Cc1cc(C)cc(NC(=O)CNC2(c3ccc(Br)cc3)CCOCC2)c1 ZINC000054394278 849859022 /nfs/dbraw/zinc/85/90/22/849859022.db2.gz AOLQDMFRQCLVOY-UHFFFAOYSA-N 0 3 417.347 4.300 20 0 HIADHN CCN(Cc1ccccc1NC(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1)C(C)=O ZINC000054409481 849862581 /nfs/dbraw/zinc/86/25/81/849862581.db2.gz QZCRMAACHMCAEW-PGRDOPGGSA-N 0 3 408.546 4.012 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)Nc2cccc(C(=O)NC(C)(C)C)c2)C1 ZINC000054434955 849867456 /nfs/dbraw/zinc/86/74/56/849867456.db2.gz DSEDQVKRORPUID-UTKZUKDTSA-N 0 3 408.546 4.172 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)cc1 ZINC000054478653 849876195 /nfs/dbraw/zinc/87/61/95/849876195.db2.gz PGNGASNAIHEFII-SPEDKVCISA-N 0 3 408.546 4.172 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N2CC=C(c3c[nH]c4ncccc34)CC2)C1 ZINC000054717493 849912603 /nfs/dbraw/zinc/91/26/03/849912603.db2.gz VNCKFVSDTMEWDP-NQIIRXRSSA-N 0 3 415.541 4.197 20 0 HIADHN Cc1ccc(NC(=O)CNC2(c3cccc(Br)c3)CCOCC2)c(C)c1 ZINC000055055616 849965299 /nfs/dbraw/zinc/96/52/99/849965299.db2.gz PYDOPQDBVPRWPI-UHFFFAOYSA-N 0 3 417.347 4.300 20 0 HIADHN Cc1c(C(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)cnn1-c1ccc(F)cc1F ZINC000056168572 850268533 /nfs/dbraw/zinc/26/85/33/850268533.db2.gz IYIQRIGQEAJYGW-KXBFYZLASA-N 0 3 410.468 4.024 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1C(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000056168366 850268950 /nfs/dbraw/zinc/26/89/50/850268950.db2.gz ZNMBTTHPEQKMFC-CVDCTZTESA-N 0 3 402.542 4.114 20 0 HIADHN CC(=O)Nc1ccc(Cl)c(NC(=O)NC[C@H](c2cccs2)N2CCCC2)c1 ZINC000056693115 850443456 /nfs/dbraw/zinc/44/34/56/850443456.db2.gz ZLFRGJQVDJXRSM-QGZVFWFLSA-N 0 3 406.939 4.319 20 0 HIADHN CCOc1ccc([C@@H](C)NC(=O)N(CCN(C)C)Cc2ccc(F)cc2)cc1OC ZINC000056881112 850509473 /nfs/dbraw/zinc/50/94/73/850509473.db2.gz PTYHHSXIYXYUGS-QGZVFWFLSA-N 0 3 417.525 4.067 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)c1cc(Cl)sc1Cl ZINC000057113515 850548778 /nfs/dbraw/zinc/54/87/78/850548778.db2.gz UICSNXFWNLKSBD-UHFFFAOYSA-N 0 3 412.386 4.387 20 0 HIADHN O=C(Cc1csc(-c2ccc(Cl)s2)n1)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000057383354 850621483 /nfs/dbraw/zinc/62/14/83/850621483.db2.gz MLDCQPXNNVWUDY-OAHLLOKOSA-N 0 3 417.987 4.458 20 0 HIADHN COc1c(Br)cc(Br)cc1CNCCc1nc(C)cs1 ZINC000057399101 850631221 /nfs/dbraw/zinc/63/12/21/850631221.db2.gz QOULPAJTMDXGBX-UHFFFAOYSA-N 0 3 420.170 4.317 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)N[C@H]1CCSc2ccc(F)cc21 ZINC000057514211 850657004 /nfs/dbraw/zinc/65/70/04/850657004.db2.gz FWGUGLHZCKMJTD-KRWDZBQOSA-N 0 3 409.596 4.023 20 0 HIADHN COc1ccc(CN(CC(=O)N(C)Cc2ccc(OC)c(F)c2)[C@H](C)C2CC2)cc1 ZINC000057602192 850678016 /nfs/dbraw/zinc/67/80/16/850678016.db2.gz DIJVPGKPAJFAKO-QGZVFWFLSA-N 0 3 414.521 4.102 20 0 HIADHN C[C@@H](CNC(=O)C(=O)Nc1ccc(Sc2ccc(Cl)cc2)cc1)N1CCCC1 ZINC000057940530 850745469 /nfs/dbraw/zinc/74/54/69/850745469.db2.gz TZERQKHLYABQOP-HNNXBMFYSA-N 0 3 417.962 4.030 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1cccc(Cn2cccn2)c1)c1cccc(OC)c1 ZINC000058054152 850758301 /nfs/dbraw/zinc/75/83/01/850758301.db2.gz XSMDLJDPILUIKL-HSZRJFAPSA-N 0 3 421.545 4.145 20 0 HIADHN CCN(CC)Cc1ccc(C(=O)NN=C2CCN(Cc3ccccc3Cl)CC2)o1 ZINC000058199018 850780690 /nfs/dbraw/zinc/78/06/90/850780690.db2.gz OWNNIQMZQMVNEV-UHFFFAOYSA-N 0 3 416.953 4.157 20 0 HIADHN C[C@@H]1CC[C@H](C)[N@H+]1[C@@H]1CCCN(C(=O)c2cc(OCc3ccccc3)ccc2[O-])C1 ZINC000436989278 862167606 /nfs/dbraw/zinc/16/76/06/862167606.db2.gz NTPJYYDILFFCIW-SVFBPWRDSA-N 0 3 408.542 4.449 20 0 HIADHN C[C@@H]1CC[C@H](C)[N@@H+]1[C@@H]1CCCN(C(=O)c2cc(OCc3ccccc3)ccc2[O-])C1 ZINC000436989278 862167614 /nfs/dbraw/zinc/16/76/14/862167614.db2.gz NTPJYYDILFFCIW-SVFBPWRDSA-N 0 3 408.542 4.449 20 0 HIADHN O=C(CCSc1ccccc1F)NCCCCN1CCN(c2ccccc2)CC1 ZINC000058490059 850837360 /nfs/dbraw/zinc/83/73/60/850837360.db2.gz UFSXVSKJWFUBHM-UHFFFAOYSA-N 0 3 415.578 4.027 20 0 HIADHN Cc1cc2occ(CC(=O)NCCCCN3CCN(c4ccccc4)CC3)c2cc1C ZINC000058489909 850837653 /nfs/dbraw/zinc/83/76/53/850837653.db2.gz XAEUEHKTIXTESY-UHFFFAOYSA-N 0 3 419.569 4.311 20 0 HIADHN COc1ccccc1C[C@H]1CCCN1Cc1cn2cc(Br)ccc2n1 ZINC000058525482 850846711 /nfs/dbraw/zinc/84/67/11/850846711.db2.gz XEQHSZRQGAJPBX-GOSISDBHSA-N 0 3 400.320 4.313 20 0 HIADHN CCN(CCNC(=O)Nc1ccc(N2CCN(CC)CC2)cc1C)c1ccccc1C ZINC000058533574 850848070 /nfs/dbraw/zinc/84/80/70/850848070.db2.gz FUBNMQIVLSFTQN-UHFFFAOYSA-N 0 3 423.605 4.093 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)Nc1ccc(OCC(F)(F)F)nc1 ZINC000059037891 850981978 /nfs/dbraw/zinc/98/19/78/850981978.db2.gz ZJKJLTIMFGLHAB-CQSZACIVSA-N 0 3 414.453 4.043 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)Nc1ccc(C(=O)NC2CCCC2)cc1 ZINC000059351039 850999570 /nfs/dbraw/zinc/99/95/70/850999570.db2.gz UNVOJDGZPXMKOJ-QHCPKHFHSA-N 0 3 420.557 4.318 20 0 HIADHN O=C(CN(CC1CCCCC1)C1CC1)N1c2ccccc2NC(=O)C[C@@H]1C(F)(F)F ZINC000059391126 851003297 /nfs/dbraw/zinc/00/32/97/851003297.db2.gz FORRHJPNQFNMLB-LJQANCHMSA-N 0 3 423.479 4.337 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)c1ccc(Br)cc1Cl ZINC000059403848 851004407 /nfs/dbraw/zinc/00/44/07/851004407.db2.gz GDZDBHBBZQUUPM-UHFFFAOYSA-N 0 3 417.800 4.194 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)Nc3ccccc3OCC(F)(F)F)cc2)CC1 ZINC000060219941 851053580 /nfs/dbraw/zinc/05/35/80/851053580.db2.gz GHJISQALRFQVLL-UHFFFAOYSA-N 0 3 421.463 4.410 20 0 HIADHN O=C(c1ccc(-c2ccc(Br)cc2)s1)N1CC[C@@H](N2CCCC2)C1 ZINC000060373953 851082021 /nfs/dbraw/zinc/08/20/21/851082021.db2.gz IXXYHEPUZXAYJO-MRXNPFEDSA-N 0 3 405.361 4.488 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)CSCc2coc(-c3ccccc3)n2)o1 ZINC000060407150 851089417 /nfs/dbraw/zinc/08/94/17/851089417.db2.gz SAMKVTNWNBCFER-UHFFFAOYSA-N 0 3 413.543 4.067 20 0 HIADHN Cc1ccccc1OC[C@@H](O)CN1CCC(c2nc3cc(Cl)ccc3o2)CC1 ZINC000060477731 851113814 /nfs/dbraw/zinc/11/38/14/851113814.db2.gz FPBOYFZCKGZFBZ-SFHVURJKSA-N 0 3 400.906 4.409 20 0 HIADHN CCCc1noc2nc(C3CC3)cc(C(=O)NCCCN3CCc4ccccc4C3)c12 ZINC000060505447 851125003 /nfs/dbraw/zinc/12/50/03/851125003.db2.gz FUQZPAMNBYTXQZ-UHFFFAOYSA-N 0 3 418.541 4.231 20 0 HIADHN CCCc1c(C(=O)NCCCN2CCc3ccccc3C2)cnn1Cc1ccccc1 ZINC000060626479 851171672 /nfs/dbraw/zinc/17/16/72/851171672.db2.gz KDBFOVVQDZYBAQ-UHFFFAOYSA-N 0 3 416.569 4.062 20 0 HIADHN COc1cc(CNCc2ccc(-c3ccc4c(c3)CCO4)cc2)cc2c1OCCO2 ZINC000060970935 851263021 /nfs/dbraw/zinc/26/30/21/851263021.db2.gz PEVQVTZJGTYEJQ-UHFFFAOYSA-N 0 3 403.478 4.358 20 0 HIADHN O=S(=O)(c1ccc(CNCc2ccc(-c3ccccc3)cc2)cc1)N1CCCC1 ZINC000061108860 851295245 /nfs/dbraw/zinc/29/52/45/851295245.db2.gz CSFRSSBYDRJVNV-UHFFFAOYSA-N 0 3 406.551 4.428 20 0 HIADHN Cc1cc(C)n(Cc2ccc(C(=O)N3c4ccc(C)cc4[C@@H]4CN(C)CC[C@H]43)cc2)n1 ZINC000061135801 851301848 /nfs/dbraw/zinc/30/18/48/851301848.db2.gz OTNTUCOOCMIYQP-UKILVPOCSA-N 0 3 414.553 4.305 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)Nc3cccc(OCC(F)(F)F)c3)cc2)CC1 ZINC000061158872 851306887 /nfs/dbraw/zinc/30/68/87/851306887.db2.gz QHMDLDXTLDQZSE-UHFFFAOYSA-N 0 3 421.463 4.410 20 0 HIADHN CC[C@@H](NC(=O)NC[C@H](Cc1ccccc1)N(C)C)c1ccccc1OC(F)F ZINC000061195854 851314674 /nfs/dbraw/zinc/31/46/74/851314674.db2.gz JCWMHPYQNBJXBX-PKOBYXMFSA-N 0 3 405.489 4.211 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)Nc3cccc(COCC4CC4)c3)cc2)CC1 ZINC000061196266 851316362 /nfs/dbraw/zinc/31/63/62/851316362.db2.gz OWKAFTKZWQMSPZ-UHFFFAOYSA-N 0 3 407.558 4.396 20 0 HIADHN CCc1ccc([C@H](CNC(=O)NCc2ccc(N3CCCCCC3)nc2)N(C)C)cc1 ZINC000061222531 851320494 /nfs/dbraw/zinc/32/04/94/851320494.db2.gz JVTJHICHCXHMIE-QHCPKHFHSA-N 0 3 423.605 4.127 20 0 HIADHN C[C@@H](OCCCNC(=O)NC[C@H](c1cccs1)N1CCCC1)c1ccccc1 ZINC000061231535 851324027 /nfs/dbraw/zinc/32/40/27/851324027.db2.gz ZJAQJRGVFKCJAV-UYAOXDASSA-N 0 3 401.576 4.352 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)c1ccc(Br)s1 ZINC000061289316 851339289 /nfs/dbraw/zinc/33/92/89/851339289.db2.gz QGITXEFYFZMGFC-UHFFFAOYSA-N 0 3 411.390 4.354 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1cnc2c(cnn2C(C)C)c1)c1cccc(OC)c1 ZINC000061353505 851355416 /nfs/dbraw/zinc/35/54/16/851355416.db2.gz LTLFDIAJVZIAIM-NRFANRHFSA-N 0 3 424.549 4.225 20 0 HIADHN C=CCc1cc(C(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)cc(OC)c1OC ZINC000061503034 851391127 /nfs/dbraw/zinc/39/11/27/851391127.db2.gz TWNUXYXIPRYSAT-JOCHJYFZSA-N 0 3 408.542 4.308 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2ccc(Br)cc2F)N2CCCC2)cc1 ZINC000061503110 851391306 /nfs/dbraw/zinc/39/13/06/851391306.db2.gz FRAMSHKQLCGCBL-LJQANCHMSA-N 0 3 405.311 4.464 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2ccc(N3CCOCC3)cc2C)N2CCCC2)cc1 ZINC000061750704 851440059 /nfs/dbraw/zinc/44/00/59/851440059.db2.gz BGGVROJPMGAAFR-DEOSSOPVSA-N 0 3 422.573 4.099 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2cc(N3CCCC3=O)ccc2F)N2CCCC2)cc1 ZINC000061774793 851446577 /nfs/dbraw/zinc/44/65/77/851446577.db2.gz ZRECRDOZAMEEFP-QFIPXVFZSA-N 0 3 424.520 4.220 20 0 HIADHN O=C(NCCCOCc1ccccc1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000061792993 851455350 /nfs/dbraw/zinc/45/53/50/851455350.db2.gz LPBZJYHLBIQJHU-UHFFFAOYSA-N 0 3 413.587 4.006 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)C(=O)Nc1cccc(OC2CCCC2)c1)c1ccccc1 ZINC000061878871 851467767 /nfs/dbraw/zinc/46/77/67/851467767.db2.gz VBPJCLCRKQDVBD-QHCPKHFHSA-N 0 3 423.557 4.146 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCc1ccnc(OC2CCCC2)c1)c1ccsc1 ZINC000061898481 851469614 /nfs/dbraw/zinc/46/96/14/851469614.db2.gz XZZURSJAPAEKHK-FQEVSTJZSA-N 0 3 416.591 4.347 20 0 HIADHN C[C@@H](NC(=O)NCCCN1CCc2ccccc2C1)c1cccc(OC(F)F)c1 ZINC000061960176 851479694 /nfs/dbraw/zinc/47/96/94/851479694.db2.gz ARBJFNMSBIPYKU-MRXNPFEDSA-N 0 3 403.473 4.097 20 0 HIADHN O=C(NC[C@H]1CCCCN1Cc1ccccc1)c1cccc(OCc2cccnc2)c1 ZINC000062228126 851511258 /nfs/dbraw/zinc/51/12/58/851511258.db2.gz VYRJZAGRPUOKPK-XMMPIXPASA-N 0 3 415.537 4.445 20 0 HIADHN COC(=O)N1CCC(N[C@H](C(=O)Nc2ccc(C)c(Cl)c2)c2ccccc2)CC1 ZINC000062245433 851516171 /nfs/dbraw/zinc/51/61/71/851516171.db2.gz QHIUGUQMODXGNK-FQEVSTJZSA-N 0 3 415.921 4.149 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)Nc1ccccc1N1CCCC1 ZINC000062377090 851533833 /nfs/dbraw/zinc/53/38/33/851533833.db2.gz RXMIKBWKJCLOHB-UHFFFAOYSA-N 0 3 402.489 4.161 20 0 HIADHN CC(C)C(=O)Nc1cccc(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2F)c1 ZINC000062385420 851538304 /nfs/dbraw/zinc/53/83/04/851538304.db2.gz DDTQUBHUYCJWDM-UHFFFAOYSA-N 0 3 418.488 4.155 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)Nc1cccc(Cl)c1-n1cccn1 ZINC000062400501 851542065 /nfs/dbraw/zinc/54/20/65/851542065.db2.gz PEBYJPQNPKIXBV-UHFFFAOYSA-N 0 3 415.900 4.261 20 0 HIADHN CCCOc1ccc(CN[C@@H](C)c2cccc(NS(C)(=O)=O)c2)cc1OCC ZINC000062421268 851549095 /nfs/dbraw/zinc/54/90/95/851549095.db2.gz OPYZRILCSNSDAN-INIZCTEOSA-N 0 3 406.548 4.096 20 0 HIADHN C[C@H](NCc1cccc(OCc2ccccc2)c1)c1cccc(NS(C)(=O)=O)c1 ZINC000062421065 851549228 /nfs/dbraw/zinc/54/92/28/851549228.db2.gz MIRMWGBCOPFIEV-SFHVURJKSA-N 0 3 410.539 4.488 20 0 HIADHN COc1ccc([C@@H](C)NC(=O)N(CCN(C)C)Cc2cccc(Cl)c2)cc1F ZINC000062475932 851559064 /nfs/dbraw/zinc/55/90/64/851559064.db2.gz NYTXVONBVOMWLJ-OAHLLOKOSA-N 0 3 407.917 4.322 20 0 HIADHN CN(CCOc1ccc(Cl)cc1)C(=S)NC1CCN(Cc2ccccc2)CC1 ZINC000063143972 851620505 /nfs/dbraw/zinc/62/05/05/851620505.db2.gz WZXDJRQUJVSVSJ-UHFFFAOYSA-N 0 3 418.006 4.190 20 0 HIADHN Cc1cccc(NC(=O)[C@@H]2CCCN(Cc3ccccc3Oc3cccnc3)C2)n1 ZINC000063518176 851706244 /nfs/dbraw/zinc/70/62/44/851706244.db2.gz XMEWYMNBDCQKPT-HXUWFJFHSA-N 0 3 402.498 4.428 20 0 HIADHN COc1ccc2ccccc2c1CNC[C@@H](O)COc1cccc(C(F)(F)F)c1 ZINC000063548600 851712106 /nfs/dbraw/zinc/71/21/06/851712106.db2.gz BQFSCVIEJOEBGW-QGZVFWFLSA-N 0 3 405.416 4.397 20 0 HIADHN COc1ccc(C(C)(C)CNC(=S)NC2CCN(Cc3ccccc3)CC2)cc1 ZINC000063566794 851715514 /nfs/dbraw/zinc/71/55/14/851715514.db2.gz SEAKCNFAPWJQCB-UHFFFAOYSA-N 0 3 411.615 4.102 20 0 HIADHN O=C(Nc1cccc(NC(=O)c2cccc(CN3CCCC3)c2)c1)c1ccncc1 ZINC000064026625 851817578 /nfs/dbraw/zinc/81/75/78/851817578.db2.gz BRYWVCQMTWTHAF-UHFFFAOYSA-N 0 3 400.482 4.182 20 0 HIADHN COc1ccc(C)cc1C1(CNC(=O)c2cccc(CN3CCCC3)c2)CCOCC1 ZINC000064027891 851817804 /nfs/dbraw/zinc/81/78/04/851817804.db2.gz VEQCETFAGLIOQJ-UHFFFAOYSA-N 0 3 422.569 4.078 20 0 HIADHN O=C(OCc1csc([N+](=O)[O-])c1)C1CCN(c2cc(Cl)ccc2Cl)C1=O ZINC000064072398 851824364 /nfs/dbraw/zinc/82/43/64/851824364.db2.gz OGFLSXFPXRXEJT-NSHDSACASA-N 0 3 415.254 4.059 20 0 HIADHN CCn1c(CNC(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)nc2ccccc21 ZINC000064237511 851855291 /nfs/dbraw/zinc/85/52/91/851855291.db2.gz SNGOBEOCIHHROT-QFIPXVFZSA-N 0 3 405.546 4.001 20 0 HIADHN C[C@@H](CC(=O)Nc1ccc(NC(=O)C2CC2)cc1)N[C@@H]1CCOc2c(F)cccc21 ZINC000437102946 862291891 /nfs/dbraw/zinc/29/18/91/862291891.db2.gz HUXOQXQMOMOSAK-VBKZILBWSA-N 0 3 411.477 4.005 20 0 HIADHN COc1cccc(CN(CCC(=O)Nc2ccccc2Cl)C[C@@H]2CCCO2)c1 ZINC000064400237 851889308 /nfs/dbraw/zinc/88/93/08/851889308.db2.gz BWLUBYVHPJTTTA-IBGZPJMESA-N 0 3 402.922 4.358 20 0 HIADHN O=C(CN1CCC[C@H]1c1cccc2ccccc21)Nc1ccc(N2CCOCC2)cc1 ZINC000064637285 851944294 /nfs/dbraw/zinc/94/42/94/851944294.db2.gz NVSWKCTXNWYUPZ-VWLOTQADSA-N 0 3 415.537 4.452 20 0 HIADHN CC[C@H](C)[C@H](C)N(CC(=O)N1c2ccccc2NC(=O)C[C@@H]1C(F)(F)F)C1CC1 ZINC000064809212 851989598 /nfs/dbraw/zinc/98/95/98/851989598.db2.gz QQKHEURALLMHFF-SUNYJGFJSA-N 0 3 411.468 4.192 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)Cc2ccc(F)c(Br)c2)C1 ZINC000065141089 852076563 /nfs/dbraw/zinc/07/65/63/852076563.db2.gz VCBYYUKIZXZGKD-WMLDXEAASA-N 0 3 405.311 4.082 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)C1 ZINC000065141009 852076618 /nfs/dbraw/zinc/07/66/18/852076618.db2.gz QSODWMUUTWIGIO-ICSRJNTNSA-N 0 3 422.529 4.150 20 0 HIADHN O=C(NC1CCCC1)c1ccc(NC(=O)N2CCN(CC3CCCCC3)CC2)cc1 ZINC000065413179 852123816 /nfs/dbraw/zinc/12/38/16/852123816.db2.gz LDPOQKBPSSCMRZ-UHFFFAOYSA-N 0 3 412.578 4.089 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2ccc(C(=O)NC3CCCCC3)cc2)N(C)C)cc1 ZINC000065416590 852125448 /nfs/dbraw/zinc/12/54/48/852125448.db2.gz VYFBOJJRVPBULR-HSZRJFAPSA-N 0 3 422.573 4.482 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2ccc(C(=O)NC3CCCC3)cc2C)N(C)C)cc1 ZINC000065419504 852127134 /nfs/dbraw/zinc/12/71/34/852127134.db2.gz ISXVZBJVAOZZKG-HSZRJFAPSA-N 0 3 422.573 4.400 20 0 HIADHN COc1ccc(OC)c([C@@H]2CCCN2C(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)c1 ZINC000065521827 852166802 /nfs/dbraw/zinc/16/68/02/852166802.db2.gz HYCYWMDKVUEKJZ-LEDOBFOHSA-N 0 3 423.557 4.386 20 0 HIADHN C[C@@H]1CCCN(C(C)(C)CNC(=O)N2CCC(C(=O)c3cc(F)ccc3F)CC2)C1 ZINC000065550012 852174402 /nfs/dbraw/zinc/17/44/02/852174402.db2.gz FCRORBZNQUKTHF-MRXNPFEDSA-N 0 3 421.532 4.080 20 0 HIADHN CC(C)[C@@H](NC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1)c1nc2ccccc2[nH]1 ZINC000065865526 852290450 /nfs/dbraw/zinc/29/04/50/852290450.db2.gz BSZOMUANWDQMNE-XMSQKQJNSA-N 0 3 408.521 4.428 20 0 HIADHN CCCC(=O)Nc1cccc(CNC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)c1 ZINC000065868323 852292510 /nfs/dbraw/zinc/29/25/10/852292510.db2.gz VSYQHAITGUEMAE-HXUWFJFHSA-N 0 3 411.521 4.093 20 0 HIADHN CCOc1cc(CNCCn2cncn2)ccc1OCc1c(Cl)cccc1Cl ZINC000065934499 852323299 /nfs/dbraw/zinc/32/32/99/852323299.db2.gz NEPOKIQQVVIKCP-UHFFFAOYSA-N 0 3 421.328 4.352 20 0 HIADHN COc1c(Cl)cc(Cl)cc1CNC[C@H](c1cccc(F)c1)N1CCOCC1 ZINC000065933876 852323413 /nfs/dbraw/zinc/32/34/13/852323413.db2.gz DHDXHBFUVFAHSC-LJQANCHMSA-N 0 3 413.320 4.304 20 0 HIADHN CN1CCN(c2ncccc2CNCc2ccc(Oc3cc(F)cc(F)c3)cc2)CC1 ZINC000065933873 852323742 /nfs/dbraw/zinc/32/37/42/852323742.db2.gz COPVHGYDHZCOHQ-UHFFFAOYSA-N 0 3 424.495 4.194 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)c1cc(-c2ccccc2Cl)n[nH]1 ZINC000065937836 852326759 /nfs/dbraw/zinc/32/67/59/852326759.db2.gz FLVAFHQTDFFRDG-UHFFFAOYSA-N 0 3 418.875 4.212 20 0 HIADHN CCN1CCC[C@@H]1CNC(=O)c1cccnc1Sc1ccc(Br)cc1 ZINC000068712525 852367868 /nfs/dbraw/zinc/36/78/68/852367868.db2.gz SFTYHUBXQMIOCF-OAHLLOKOSA-N 0 3 420.376 4.209 20 0 HIADHN O=C(COC(c1ccccc1)c1ccccc1)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000069369185 852393324 /nfs/dbraw/zinc/39/33/24/852393324.db2.gz JNRDZEIDFQOCRF-XMMPIXPASA-N 0 3 400.522 4.183 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1ccc(Br)s1)c1cccc(OC)c1 ZINC000071812075 852408663 /nfs/dbraw/zinc/40/86/63/852408663.db2.gz WFGLCDGRZHBFJV-HNNXBMFYSA-N 0 3 411.365 4.332 20 0 HIADHN COc1ccc(Br)c(C(=O)N[C@@H](CN2CCCC2)c2ccccc2)c1 ZINC000071851428 852418589 /nfs/dbraw/zinc/41/85/89/852418589.db2.gz CMELVVPVQYNCTL-IBGZPJMESA-N 0 3 403.320 4.025 20 0 HIADHN CN1CCN(Cc2ccc(CNC(=O)Nc3cc(Cl)ccc3Cl)cc2)CC1 ZINC000071927197 852433539 /nfs/dbraw/zinc/43/35/39/852433539.db2.gz YZKFSNOYDJEGFO-UHFFFAOYSA-N 0 3 407.345 4.063 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)c1cccc(NC(=O)OC(C)(C)C)c1 ZINC000072013261 852465507 /nfs/dbraw/zinc/46/55/07/852465507.db2.gz HBWVZDYNLUOVMF-UHFFFAOYSA-N 0 3 415.509 4.377 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2ccccc2-c2nc(C(C)(C)C)no2)N(C)C)cc1 ZINC000078494595 852516092 /nfs/dbraw/zinc/51/60/92/852516092.db2.gz MUWIYHOKGDSSGE-HXUWFJFHSA-N 0 3 406.530 4.375 20 0 HIADHN CC(C)(C)c1csc(CCNC(=O)NC[C@@H](c2cccs2)N2CCCC2)n1 ZINC000078550719 852518805 /nfs/dbraw/zinc/51/88/05/852518805.db2.gz FSLDTDJEPFUEOW-HNNXBMFYSA-N 0 3 406.621 4.181 20 0 HIADHN C[C@@H](CN1CCCCC1)NC(=O)c1ccc(COc2cccc(Br)c2)o1 ZINC000078957066 852536264 /nfs/dbraw/zinc/53/62/64/852536264.db2.gz XQRYYBWEFWVLOZ-HNNXBMFYSA-N 0 3 421.335 4.225 20 0 HIADHN CC[C@@H]1CCCCN1CCNC(=O)c1sc(-c2ccc(OC)c(OC)c2)nc1C ZINC000079095746 852539883 /nfs/dbraw/zinc/53/98/83/852539883.db2.gz HADPEUJACNFPRL-QGZVFWFLSA-N 0 3 417.575 4.130 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)C(=O)Nc3ccccc3C(C)(C)C)c(C)c2)CC1 ZINC000437178287 862371271 /nfs/dbraw/zinc/37/12/71/862371271.db2.gz DKBSWVDDIAABEH-UHFFFAOYSA-N 0 3 422.573 4.012 20 0 HIADHN CC[C@@H](CNC(=O)c1cc(C)n(Cc2ccccn2)c1C)N1CCc2ccccc2C1 ZINC000097286221 852596419 /nfs/dbraw/zinc/59/64/19/852596419.db2.gz CUYRLGVJERSTRV-DEOSSOPVSA-N 0 3 416.569 4.115 20 0 HIADHN CCOc1c(Br)cc(CNC[C@@H](O)c2ccco2)cc1Br ZINC000097287524 852597844 /nfs/dbraw/zinc/59/78/44/852597844.db2.gz FOBMSEBLLCPBSL-CYBMUJFWSA-N 0 3 419.113 4.027 20 0 HIADHN CCc1cccc(Oc2ccc(NC(=O)N(CCN(C)C)C[C@H]3CCCO3)cn2)c1 ZINC000097577468 852638270 /nfs/dbraw/zinc/63/82/70/852638270.db2.gz AGFWGSBXUHRCQW-OAQYLSRUSA-N 0 3 412.534 4.011 20 0 HIADHN Cc1ccc([C@H]2CCCN2CC(=O)N2CCC(C(=O)Nc3ccccc3)CC2)cc1 ZINC000105732497 852725201 /nfs/dbraw/zinc/72/52/01/852725201.db2.gz AUFLVDLXCQVHFI-HSZRJFAPSA-N 0 3 405.542 4.009 20 0 HIADHN O=C(CCCc1nc(-c2ccc(Cl)cc2)no1)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000106118107 852755462 /nfs/dbraw/zinc/75/54/62/852755462.db2.gz HGGXQQXQXMUCDG-FQEVSTJZSA-N 0 3 424.932 4.103 20 0 HIADHN COc1cccc(CO[C@H](C)C(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)c1 ZINC000106287010 852768101 /nfs/dbraw/zinc/76/81/01/852768101.db2.gz ZJGJOORMPFNDQW-NQIIRXRSSA-N 0 3 416.587 4.251 20 0 HIADHN COc1cccc(CO[C@H](C)C(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)c1 ZINC000106287013 852768171 /nfs/dbraw/zinc/76/81/71/852768171.db2.gz ZJGJOORMPFNDQW-WIYYLYMNSA-N 0 3 416.587 4.251 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)c3ccc4nc(Cl)ccc4c3)cc2)CC1 ZINC000108144213 852825846 /nfs/dbraw/zinc/82/58/46/852825846.db2.gz YHKUSGBPKWTNCP-UHFFFAOYSA-N 0 3 408.933 4.278 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)c1cccc(C(F)(F)F)c1 ZINC000108223940 852830384 /nfs/dbraw/zinc/83/03/84/852830384.db2.gz FYAKWXOKOGNMSC-UHFFFAOYSA-N 0 3 405.464 4.038 20 0 HIADHN Cc1ccc2c(CC(=O)NCCCCN3CCN(c4ccccc4)CC3)coc2c1C ZINC000108222777 852830427 /nfs/dbraw/zinc/83/04/27/852830427.db2.gz GCWKEFSAUAHNJN-UHFFFAOYSA-N 0 3 419.569 4.311 20 0 HIADHN O=C(CCSc1ccc(Br)cc1)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000108751341 852877678 /nfs/dbraw/zinc/87/76/78/852877678.db2.gz DSLYNVMITVVOPA-SFHVURJKSA-N 0 3 419.388 4.322 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)CCc2ncc(-c3ccccc3F)o2)C1 ZINC000108817486 852882321 /nfs/dbraw/zinc/88/23/21/852882321.db2.gz SLGRPKODHWTOPM-HKUYNNGSSA-N 0 3 407.489 4.365 20 0 HIADHN Cc1ccccc1C(=O)N[C@H](CC(C)C)C(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000108820636 852882400 /nfs/dbraw/zinc/88/24/00/852882400.db2.gz NTXBBNJMIYUZEC-BGWNEDDSSA-N 0 3 421.585 4.091 20 0 HIADHN O=C(NCC1(c2cccc(Cl)c2)CCOCC1)c1cccc(CN2CCCC2)c1 ZINC000108965515 852899366 /nfs/dbraw/zinc/89/93/66/852899366.db2.gz KLUFUQVVJUVKGL-UHFFFAOYSA-N 0 3 412.961 4.414 20 0 HIADHN CN(CCCc1cc(-c2ccccc2)n[nH]1)C(=O)c1cccc(CN2CCCC2)c1 ZINC000108965660 852899542 /nfs/dbraw/zinc/89/95/42/852899542.db2.gz HILNUIKGDXELRI-UHFFFAOYSA-N 0 3 402.542 4.377 20 0 HIADHN COc1ccc(CNC(=O)CN2CCC[C@H]2c2cccc3ccccc32)cc1OC ZINC000108982269 852902813 /nfs/dbraw/zinc/90/28/13/852902813.db2.gz PCZIGXWGJJGHGK-QFIPXVFZSA-N 0 3 404.510 4.310 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)CCc1ncc(-c2ccccc2F)o1 ZINC000109358247 852958022 /nfs/dbraw/zinc/95/80/22/852958022.db2.gz YNZUQXQIGLKKOE-UHFFFAOYSA-N 0 3 413.468 4.143 20 0 HIADHN COc1ccc(-c2cnc(CCC(=O)N[C@@H]3CCCN(Cc4ccccc4)C3)o2)cc1 ZINC000109423029 852969400 /nfs/dbraw/zinc/96/94/00/852969400.db2.gz KSFCWRHACZDJOX-OAQYLSRUSA-N 0 3 419.525 4.064 20 0 HIADHN Cc1nc2cc(F)cc(C(=O)Nc3ccc(CCN4CCSCC4)cc3)c2nc1C ZINC000109486143 852976228 /nfs/dbraw/zinc/97/62/28/852976228.db2.gz PDBJAPPAGPHZKQ-UHFFFAOYSA-N 0 3 424.545 4.229 20 0 HIADHN COc1cc(C(=O)Nc2ccc(CCN3CCSCC3)cc2)ccc1OC(C)C ZINC000109528484 852980601 /nfs/dbraw/zinc/98/06/01/852980601.db2.gz HIDSIVOECMRRFM-UHFFFAOYSA-N 0 3 414.571 4.326 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)[C@H]1C[C@H]1c1ccc(Br)cc1 ZINC000109770650 853012392 /nfs/dbraw/zinc/01/23/92/853012392.db2.gz IGVKFHUJLPXETN-PMACEKPBSA-N 0 3 419.338 4.282 20 0 HIADHN COc1ccc2c(c1)CCC[C@@H]2CC(=O)N(C)C1CCN(CCc2ccccn2)CC1 ZINC000109808808 853017263 /nfs/dbraw/zinc/01/72/63/853017263.db2.gz DOBKOLHOOKGONP-OAQYLSRUSA-N 0 3 421.585 4.066 20 0 HIADHN CCN1CCC[C@H]1CNC(=O)c1oc2ccccc2c1CSc1nnc(C)s1 ZINC000109827878 853019788 /nfs/dbraw/zinc/01/97/88/853019788.db2.gz KZEZNVNKZFWRCB-AWEZNQCLSA-N 0 3 416.572 4.099 20 0 HIADHN CSc1ccc(Cl)c(C(=O)Nc2ccccc2CN2CCC[C@@H](C(N)=O)C2)c1 ZINC000109855798 853023700 /nfs/dbraw/zinc/02/37/00/853023700.db2.gz SMNAWJBVAZWBIN-OAHLLOKOSA-N 0 3 417.962 4.012 20 0 HIADHN CSc1ccc(Cl)c(C(=O)Nc2ccccc2CN2CCC[C@H](C(N)=O)C2)c1 ZINC000109855795 853023742 /nfs/dbraw/zinc/02/37/42/853023742.db2.gz SMNAWJBVAZWBIN-HNNXBMFYSA-N 0 3 417.962 4.012 20 0 HIADHN CCN(CC(=O)Nc1cccc(CN2CCSCC2)c1)[C@@H](C)c1ccc(F)cc1 ZINC000110177342 853068278 /nfs/dbraw/zinc/06/82/78/853068278.db2.gz JNCWBQIFPDVHQX-SFHVURJKSA-N 0 3 415.578 4.396 20 0 HIADHN CCC(CC)(NCC(=O)Nc1cccc(C(=O)N(C)C)c1)c1ccc(Cl)cc1 ZINC000110336192 853089197 /nfs/dbraw/zinc/08/91/97/853089197.db2.gz LTOGKWHPTNTKJM-UHFFFAOYSA-N 0 3 401.938 4.285 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)c1nccc2ccccc21 ZINC000110348179 853090302 /nfs/dbraw/zinc/09/03/02/853090302.db2.gz FLOSIJBDBPIPQZ-UHFFFAOYSA-N 0 3 401.432 4.458 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)c3cccc4c5c([nH]c43)CCCC5)CC2)C[C@H](C)O1 ZINC000110451202 853100882 /nfs/dbraw/zinc/10/08/82/853100882.db2.gz BJLDAPFDSWCRKZ-HDICACEKSA-N 0 3 409.574 4.008 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)Cc3coc4ccc5ccccc5c34)CC2)C[C@H](C)O1 ZINC000110453743 853101299 /nfs/dbraw/zinc/10/12/99/853101299.db2.gz QKWWRZXKSJPPQD-OALUTQOASA-N 0 3 420.553 4.476 20 0 HIADHN Cc1c2cc(Cl)ccc2oc1C(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000110456867 853102291 /nfs/dbraw/zinc/10/22/91/853102291.db2.gz WWWMBQJIJUJOIP-HUUCEWRRSA-N 0 3 404.938 4.356 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)c3cc4c(s3)CCCCCC4)CC2)C[C@H](C)O1 ZINC000110456897 853102392 /nfs/dbraw/zinc/10/23/92/853102392.db2.gz JXRNYLNHCKNRIP-HDICACEKSA-N 0 3 404.620 4.369 20 0 HIADHN COc1ccc(C)c2c1N(C(=O)c1ccc(N3CCN(C(C)C)CC3)cc1)CCC2 ZINC000110610259 853127586 /nfs/dbraw/zinc/12/75/86/853127586.db2.gz KRPFJJCGLDPVRR-UHFFFAOYSA-N 0 3 407.558 4.127 20 0 HIADHN Cc1cc(NC(=O)N2CCC(CN3C[C@@H](C)O[C@H](C)C3)CC2)ccc1Br ZINC000110717471 853144224 /nfs/dbraw/zinc/14/42/24/853144224.db2.gz GHOGHEULDQTRGZ-HZPDHXFCSA-N 0 3 424.383 4.111 20 0 HIADHN COc1ccccc1NC(=O)[C@H](C)N(C)CCCc1cc(-c2ccc(F)cc2)n[nH]1 ZINC000111039581 853191097 /nfs/dbraw/zinc/19/10/97/853191097.db2.gz ZCOYYBQBBVTFSK-INIZCTEOSA-N 0 3 410.493 4.116 20 0 HIADHN O=C(CNc1cccc(C(F)(F)F)c1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000111099351 853201669 /nfs/dbraw/zinc/20/16/69/853201669.db2.gz HEWFRUKHUZZCOD-UHFFFAOYSA-N 0 3 423.504 4.347 20 0 HIADHN COc1ccc([C@@H]2CCCN2C[C@H](O)COc2cccc3ccccc32)c(OC)c1 ZINC000115336932 853249587 /nfs/dbraw/zinc/24/95/87/853249587.db2.gz IVLIBZBRVCYRBP-CVDCTZTESA-N 0 3 407.510 4.434 20 0 HIADHN CN(CCCc1cc(-c2ccccc2)n(C)n1)C(=O)[C@@H]1CCCN1Cc1ccccc1 ZINC000115784352 853264706 /nfs/dbraw/zinc/26/47/06/853264706.db2.gz KJNIJOVLPLCBHK-DEOSSOPVSA-N 0 3 416.569 4.143 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)[C@H]2CCCN(c3nc4ccccc4s3)C2)N(C)C)cc1 ZINC000116026844 853280292 /nfs/dbraw/zinc/28/02/92/853280292.db2.gz YGWYTZZPYIAHSR-PZJWPPBQSA-N 0 3 422.598 4.240 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)c1cnn(-c2ccc(Cl)cc2)c1 ZINC000116072739 853281153 /nfs/dbraw/zinc/28/11/53/853281153.db2.gz RSMBTXHBOREQSD-UHFFFAOYSA-N 0 3 418.875 4.008 20 0 HIADHN CN(C)CCN(C(=O)CSc1nnc(-c2ccc(Cl)cc2)o1)c1ccccc1 ZINC000116123863 853284333 /nfs/dbraw/zinc/28/43/33/853284333.db2.gz BPCIFUASHMVCRY-UHFFFAOYSA-N 0 3 416.934 4.077 20 0 HIADHN CC[C@H](CNC(=O)c1cc(C)n(CC(F)(F)F)c1C)N1CCc2ccccc2C1 ZINC000116898069 853337017 /nfs/dbraw/zinc/33/70/17/853337017.db2.gz IRDQJTZNXLAILS-LJQANCHMSA-N 0 3 407.480 4.234 20 0 HIADHN COc1ccc(C(=O)NC[C@@H](C(C)C)N2CCc3ccccc3C2)cc1OC(F)F ZINC000117174573 853347256 /nfs/dbraw/zinc/34/72/56/853347256.db2.gz AJSSGSZDBBIZJS-IBGZPJMESA-N 0 3 418.484 4.109 20 0 HIADHN COCCN1CCC(NC(=O)CCc2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)CC1 ZINC000138578371 853391695 /nfs/dbraw/zinc/39/16/95/853391695.db2.gz QYOIZXVZQBFCQX-UHFFFAOYSA-N 0 3 418.622 4.147 20 0 HIADHN Cc1cc(Br)oc1C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000138676719 853394428 /nfs/dbraw/zinc/39/44/28/853394428.db2.gz OHCRBPDSRPMGHO-UHFFFAOYSA-N 0 3 409.349 4.194 20 0 HIADHN O=C(NC1CCN(Cc2ccc(OCc3ccncc3)cc2)CC1)c1ccc(F)cc1 ZINC000139227966 853406088 /nfs/dbraw/zinc/40/60/88/853406088.db2.gz LFLPODOATSSFKI-UHFFFAOYSA-N 0 3 419.500 4.194 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N(C)Cc1cscn1)c1ccc(C(F)(F)F)cc1 ZINC000139682456 853418356 /nfs/dbraw/zinc/41/83/56/853418356.db2.gz XOOAJHONBQBUOG-KRWDZBQOSA-N 0 3 414.497 4.386 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(N2CCOCC2)cc1)C(=O)Nc1ccc2ccccc2c1 ZINC000140202764 853437537 /nfs/dbraw/zinc/43/75/37/853437537.db2.gz ZWYVDJLTZIUBIN-RTBURBONSA-N 0 3 403.526 4.354 20 0 HIADHN Cc1c(Cl)cccc1NC(=O)[C@@H](C)N[C@H](C)c1ccc(N2CCOCC2)cc1 ZINC000140200891 853437582 /nfs/dbraw/zinc/43/75/82/853437582.db2.gz FKFUOUFRTNBLDH-IAGOWNOFSA-N 0 3 401.938 4.163 20 0 HIADHN Cc1ccc(NC(=O)[C@@H](C)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c(Cl)c1 ZINC000140190216 853437848 /nfs/dbraw/zinc/43/78/48/853437848.db2.gz MDUZFUWAXYIVRS-DLBZAZTESA-N 0 3 401.938 4.163 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(N2CCOCC2)cc1)C(=O)Nc1cccc2ccccc21 ZINC000140206576 853437935 /nfs/dbraw/zinc/43/79/35/853437935.db2.gz ZBZLUVGZMJMSKA-RBUKOAKNSA-N 0 3 403.526 4.354 20 0 HIADHN Cc1ccc([C@H]2CCCN2CC(=O)N2CCC(C(=O)Nc3ccccc3)CC2)cc1C ZINC000140638899 853448870 /nfs/dbraw/zinc/44/88/70/853448870.db2.gz NUMSTNXWPCXBQE-XMMPIXPASA-N 0 3 419.569 4.318 20 0 HIADHN Cc1c(C(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)cnn1C(C)(C)C ZINC000140892833 853456321 /nfs/dbraw/zinc/45/63/21/853456321.db2.gz MVBZOPYVAOBVSV-UHFFFAOYSA-N 0 3 410.484 4.169 20 0 HIADHN Cc1ccc2nc([C@@H]3CCCN3C(=O)NC[C@H](c3ccc(F)cc3)N(C)C)[nH]c2c1 ZINC000140958895 853458743 /nfs/dbraw/zinc/45/87/43/853458743.db2.gz KMVIIDKCSOPXAT-LEWJYISDSA-N 0 3 409.509 4.160 20 0 HIADHN Cc1ccc([C@H](CNC(=O)COCc2nc3ccccc3s2)N2CCCC2)cc1 ZINC000143218518 853510967 /nfs/dbraw/zinc/51/09/67/853510967.db2.gz VDOFDSVSEXOBKG-FQEVSTJZSA-N 0 3 409.555 4.075 20 0 HIADHN O=C(Nc1ccccc1)NC1CCN(Cc2ccc(OCc3ccncc3)cc2)CC1 ZINC000143482571 853515970 /nfs/dbraw/zinc/51/59/70/853515970.db2.gz KXICCCFEBJUYHY-UHFFFAOYSA-N 0 3 416.525 4.447 20 0 HIADHN Cc1nn(C(F)F)c(C)c1CC(=O)N[C@@H](CN1CCc2ccccc2C1)C(C)(C)C ZINC000144882132 853542357 /nfs/dbraw/zinc/54/23/57/853542357.db2.gz LJOUPADOSOVEOV-FQEVSTJZSA-N 0 3 418.532 4.027 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=S)Nc2ccc(Oc3ccccc3)cc2)CC1 ZINC000145288305 853549299 /nfs/dbraw/zinc/54/92/99/853549299.db2.gz IYFLQHBTXAEYRB-LJQANCHMSA-N 0 3 412.603 4.039 20 0 HIADHN Fc1ccc2c(c1)[C@H](NC(=S)NC1CCN(Cc3ccccc3)CC1)CCS2 ZINC000145505402 853552387 /nfs/dbraw/zinc/55/23/87/853552387.db2.gz YJLZKZMPJGJKKZ-HXUWFJFHSA-N 0 3 415.603 4.491 20 0 HIADHN COc1ccc(CCCC(=O)C(C#N)C(=O)Nc2ccc(OC)c(Cl)c2)cc1 ZINC000147139767 853582825 /nfs/dbraw/zinc/58/28/25/853582825.db2.gz USRNAMPZIWOOPN-QGZVFWFLSA-N 0 3 400.862 4.027 20 0 HIADHN Cc1c(CN2CCSCC2)cccc1NC(=O)[C@H]1CCCN1Cc1ccccc1 ZINC000147365341 853586418 /nfs/dbraw/zinc/58/64/18/853586418.db2.gz QNWAVGPPNZSPPI-HSZRJFAPSA-N 0 3 409.599 4.147 20 0 HIADHN COc1cc(C(=O)N(Cc2ccco2)C2CCN(C)CC2)ccc1OCC(C)C ZINC000195593249 853702352 /nfs/dbraw/zinc/70/23/52/853702352.db2.gz WUFPTFWQPCAKCA-UHFFFAOYSA-N 0 3 400.519 4.060 20 0 HIADHN O=C(c1cccc(CN2CCCC2)c1)N1CCC(Oc2ccc(F)cc2F)CC1 ZINC000195651827 853738506 /nfs/dbraw/zinc/73/85/06/853738506.db2.gz AAJHXYRLTKROLC-UHFFFAOYSA-N 0 3 400.469 4.244 20 0 HIADHN O=C(C1CCN(Cc2ccc(OCC(F)(F)F)cc2)CC1)N1CCc2ccccc21 ZINC000195684912 853757065 /nfs/dbraw/zinc/75/70/65/853757065.db2.gz KWFDXLYICIAWQB-UHFFFAOYSA-N 0 3 418.459 4.429 20 0 HIADHN COCCN1CCC(NC(=O)c2ccccc2Nc2cccc(C(F)(F)F)c2)CC1 ZINC000195687895 853759120 /nfs/dbraw/zinc/75/91/20/853759120.db2.gz HCOLPYJDCOHAST-UHFFFAOYSA-N 0 3 421.463 4.290 20 0 HIADHN O=C([C@H]1CCCN(Cc2cccc(F)c2)C1)N1CCc2[nH]c3ccc(F)cc3c2C1 ZINC000195722622 853778270 /nfs/dbraw/zinc/77/82/70/853778270.db2.gz WAQPVVROEFUFBQ-KRWDZBQOSA-N 0 3 409.480 4.243 20 0 HIADHN O=C(Nc1cccc(N2CCCCC2=O)c1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000195722628 853778298 /nfs/dbraw/zinc/77/82/98/853778298.db2.gz XSLUSDWGWLELAE-LJQANCHMSA-N 0 3 409.505 4.193 20 0 HIADHN Cc1ccc(-c2cc(C(=O)N(CCN(C)C)Cc3cccc(C(F)(F)F)c3)[nH]n2)o1 ZINC000195724836 853779382 /nfs/dbraw/zinc/77/93/82/853779382.db2.gz DBMYGUNUBCMICO-UHFFFAOYSA-N 0 3 420.435 4.201 20 0 HIADHN CCNC(=O)COc1ccc(CN[C@H](C)c2ccc3cc(OC)ccc3c2)cc1OC ZINC000195733333 853784908 /nfs/dbraw/zinc/78/49/08/853784908.db2.gz LUROJSUWGHEXRM-QGZVFWFLSA-N 0 3 422.525 4.223 20 0 HIADHN CCc1ccc(-c2nn(-c3ccccc3)cc2C(=O)N(C)C2CCN(C)CC2)cc1 ZINC000215835929 853838706 /nfs/dbraw/zinc/83/87/06/853838706.db2.gz CZPFRAVCKRBNGA-UHFFFAOYSA-N 0 3 402.542 4.268 20 0 HIADHN Cc1cc(NC(=O)CN[C@@H](C)c2cccc3ccccc32)n(-c2nc(C)cc(C)n2)n1 ZINC000216624165 853857976 /nfs/dbraw/zinc/85/79/76/853857976.db2.gz ZBTOATALGCLHQY-SFHVURJKSA-N 0 3 414.513 4.030 20 0 HIADHN c1cnn(-c2ccccc2CNCc2cn(Cc3ccccc3)nc2-c2cccnc2)c1 ZINC000236581262 853899741 /nfs/dbraw/zinc/89/97/41/853899741.db2.gz YJAWJGPXSKVMBL-UHFFFAOYSA-N 0 3 420.520 4.469 20 0 HIADHN c1cnn(Cc2cccc(CNCc3cn(-c4ccccc4)nc3-c3ccncc3)c2)c1 ZINC000236584968 853900821 /nfs/dbraw/zinc/90/08/21/853900821.db2.gz JYPKVPJDKRPFSL-UHFFFAOYSA-N 0 3 420.520 4.469 20 0 HIADHN CC(C)NC(=O)CCNCc1cc(Br)ccc1OCc1ccccc1 ZINC000236633712 853905673 /nfs/dbraw/zinc/90/56/73/853905673.db2.gz MRZULLHQIFPYMI-UHFFFAOYSA-N 0 3 405.336 4.032 20 0 HIADHN CC(C)(CNCc1cccc2cc[nH]c21)S(=O)(=O)c1ccc(Br)cc1 ZINC000236737791 853917363 /nfs/dbraw/zinc/91/73/63/853917363.db2.gz PHTNNFDHDNZAMM-UHFFFAOYSA-N 0 3 421.360 4.273 20 0 HIADHN CC(C)C(=O)N1CCC(NCc2csc(-c3cccc(Br)c3)n2)CC1 ZINC000236783487 853922434 /nfs/dbraw/zinc/92/24/34/853922434.db2.gz TYGCLQBPOMRNMT-UHFFFAOYSA-N 0 3 422.392 4.309 20 0 HIADHN CCOc1cc(CNCc2ccc3ccccc3c2)ccc1O[C@H](C)C(=O)N(C)C ZINC000236871233 853930999 /nfs/dbraw/zinc/93/09/99/853930999.db2.gz GYCZMITZKJXJPV-GOSISDBHSA-N 0 3 406.526 4.384 20 0 HIADHN CCOc1cc(CN[C@H](C)c2ccc(-n3cncn3)cc2)ccc1OCC(F)(F)F ZINC000236905517 853934958 /nfs/dbraw/zinc/93/49/58/853934958.db2.gz CGADLTJMHZWEPH-OAHLLOKOSA-N 0 3 420.435 4.458 20 0 HIADHN CCOc1ccc(C(=O)N2CCC(NCc3cc([N+](=O)[O-])ccc3Cl)CC2)cc1 ZINC000236954594 853942702 /nfs/dbraw/zinc/94/27/02/853942702.db2.gz KWINWVURTGYJPI-UHFFFAOYSA-N 0 3 417.893 4.041 20 0 HIADHN CCS(=O)(=O)C[C@@H](C)NCc1ccc(-c2ccccc2Br)s1 ZINC000237006976 853950285 /nfs/dbraw/zinc/95/02/85/853950285.db2.gz YMPUJAUNGUJXRR-GFCCVEGCSA-N 0 3 402.379 4.090 20 0 HIADHN Cc1nn(-c2ccc(Br)cc2)c(C)c1CNC[C@H](c1ccco1)N(C)C ZINC000237026506 853953531 /nfs/dbraw/zinc/95/35/31/853953531.db2.gz HQCMYCXHULYOMC-LJQANCHMSA-N 0 3 417.351 4.237 20 0 HIADHN COc1ccc(Br)cc1CNCCc1nc(-c2cccc(Cl)c2)no1 ZINC000237132533 853969623 /nfs/dbraw/zinc/96/96/23/853969623.db2.gz FITSZDPASBXZKO-UHFFFAOYSA-N 0 3 422.710 4.493 20 0 HIADHN COc1cc(CNCCNC(=O)c2ccco2)ccc1OCc1ccc(Cl)cc1 ZINC000237175369 853975522 /nfs/dbraw/zinc/97/55/22/853975522.db2.gz WSMXZFAFRNOMFE-UHFFFAOYSA-N 0 3 414.889 4.040 20 0 HIADHN CN(CCC#N)c1ccc(C[NH2+][C@H]2CCCN(Cc3cc(Cl)ccc3[O-])C2)cc1 ZINC000237210606 853983582 /nfs/dbraw/zinc/98/35/82/853983582.db2.gz OQFAWSUCLICGSO-NRFANRHFSA-N 0 3 412.965 4.150 20 0 HIADHN COc1cc(CNCc2ccccc2CN2C[C@H](C)O[C@@H](C)C2)ccc1OC(F)F ZINC000237216036 853984704 /nfs/dbraw/zinc/98/47/04/853984704.db2.gz BCUMESJZDUVYPD-IRXDYDNUSA-N 0 3 420.500 4.196 20 0 HIADHN CNC(=O)c1ccc(CN[C@@H](C)c2ccc(OCc3ccccc3)c(OC)c2)cc1 ZINC000237226264 853986800 /nfs/dbraw/zinc/98/68/00/853986800.db2.gz NBCDUHAWANNICP-SFHVURJKSA-N 0 3 404.510 4.485 20 0 HIADHN COc1cc(CNC[C@@H](O)c2c(Cl)cccc2Cl)cc(Br)c1O ZINC000237229282 853986930 /nfs/dbraw/zinc/98/69/30/853986930.db2.gz KJVOKJMZEDAETN-CYBMUJFWSA-N 0 3 421.118 4.293 20 0 HIADHN COc1cc(Br)cc(C[NH2+]C[C@H](c2ccco2)N2CCCCC2)c1[O-] ZINC000237243126 853990194 /nfs/dbraw/zinc/99/01/94/853990194.db2.gz DJDBQBPKBGFWFQ-MRXNPFEDSA-N 0 3 409.324 4.073 20 0 HIADHN COc1ccc(CCNCc2nc(-c3ccc(Br)cc3)c[nH]2)cc1OC ZINC000237263683 853993415 /nfs/dbraw/zinc/99/34/15/853993415.db2.gz WMMBGFKZGJIZKW-UHFFFAOYSA-N 0 3 416.319 4.189 20 0 HIADHN COc1cc(CNCc2ccc(-n3cccn3)cc2)ccc1OCc1c(C)noc1C ZINC000237266662 853993821 /nfs/dbraw/zinc/99/38/21/853993821.db2.gz SNKWHBUDDVZVTD-UHFFFAOYSA-N 0 3 418.497 4.355 20 0 HIADHN COc1cc(CNCc2ccc(-n3cncn3)cc2)ccc1OCc1cccs1 ZINC000237270105 853994571 /nfs/dbraw/zinc/99/45/71/853994571.db2.gz TXXJKFWKQJXCQU-UHFFFAOYSA-N 0 3 406.511 4.206 20 0 HIADHN COc1cc(CNC[C@H](O)c2cccc(C(F)(F)F)c2)c(SC)cc1OC ZINC000237273425 853995488 /nfs/dbraw/zinc/99/54/88/853995488.db2.gz ITHHGCSSQGHFNC-HNNXBMFYSA-N 0 3 401.450 4.268 20 0 HIADHN COc1ccc(NC(=O)C[C@H](C)NCc2oc3ccc(F)cc3c2C)c(OC)c1 ZINC000237305088 854002431 /nfs/dbraw/zinc/00/24/31/854002431.db2.gz RNVIMMLAWOYOEA-ZDUSSCGKSA-N 0 3 400.450 4.404 20 0 HIADHN COc1ccc([C@@H](C)NCc2cn(C)nc2-c2ccc3c(c2)OCCCO3)cc1F ZINC000237317887 854005885 /nfs/dbraw/zinc/00/58/85/854005885.db2.gz BUOXWJPQKPTXMA-OAHLLOKOSA-N 0 3 411.477 4.247 20 0 HIADHN COc1cccc([C@H](O)CNCc2cccc(NC(=O)c3ccc(Cl)cc3)c2)c1 ZINC000237325277 854006978 /nfs/dbraw/zinc/00/69/78/854006978.db2.gz WZVRNHSGDBTEFO-JOCHJYFZSA-N 0 3 410.901 4.424 20 0 HIADHN COc1ccccc1-c1ccc(CN[C@@H](C)c2ccc(S(=O)(=O)N(C)C)cc2)cc1 ZINC000237342686 854009698 /nfs/dbraw/zinc/00/96/98/854009698.db2.gz MDGJOCSFTZVPRH-SFHVURJKSA-N 0 3 424.566 4.463 20 0 HIADHN COc1cc(CN[C@H](c2ccc(Cl)cc2)[C@@H]2C[C@@H]2C)cc(Cl)c1OCC(N)=O ZINC000237341453 854009765 /nfs/dbraw/zinc/00/97/65/854009765.db2.gz LAEVGEXAVBCNRX-BXJCWQANSA-N 0 3 423.340 4.353 20 0 HIADHN CSC[C@](C)(O)CNCc1c(C)nn(Cc2c(Cl)cccc2Cl)c1Cl ZINC000237370652 854016579 /nfs/dbraw/zinc/01/65/79/854016579.db2.gz FODQQSNFUYOFEF-QGZVFWFLSA-N 0 3 422.809 4.404 20 0 HIADHN COc1ccc(OC)c(CN[C@@H]2CCN(c3ncc(C(F)(F)F)cc3Cl)C2)c1 ZINC000237388338 854020718 /nfs/dbraw/zinc/02/07/18/854020718.db2.gz DRQNFMUOFYZFTD-CQSZACIVSA-N 0 3 415.843 4.140 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2CNCc2ccc(F)c(Br)c2)C[C@@H](C)O1 ZINC000237412148 854026920 /nfs/dbraw/zinc/02/69/20/854026920.db2.gz MFWOKCQZTOGXCT-HZPDHXFCSA-N 0 3 421.354 4.487 20 0 HIADHN COc1ccc(-c2ccc(CNC[C@@H](O)c3ccc(Cl)cc3)o2)c([N+](=O)[O-])c1 ZINC000237428893 854031114 /nfs/dbraw/zinc/03/11/14/854031114.db2.gz ZDCFJXCFSQCEEE-LJQANCHMSA-N 0 3 402.834 4.340 20 0 HIADHN C[C@@](O)(CNCc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1)c1ccco1 ZINC000237469840 854039131 /nfs/dbraw/zinc/03/91/31/854039131.db2.gz QOZQEOIGQIPFTC-GOSISDBHSA-N 0 3 421.247 4.208 20 0 HIADHN C[C@@H](NCc1cn(-c2ccccc2)nc1-c1cccnc1)c1ccc(NC(N)=O)cc1 ZINC000237470942 854040422 /nfs/dbraw/zinc/04/04/22/854040422.db2.gz LTKBHHWNKLSXFP-QGZVFWFLSA-N 0 3 412.497 4.276 20 0 HIADHN C[C@@H](NCc1ccc(Br)c([N+](=O)[O-])c1)c1cccc(-n2cccn2)c1 ZINC000237471702 854040496 /nfs/dbraw/zinc/04/04/96/854040496.db2.gz JAEGYZZZCRIOHB-CYBMUJFWSA-N 0 3 401.264 4.394 20 0 HIADHN C[C@H]1CN(C(=O)c2ccc(CNCc3cccc(OC(F)(F)F)c3)cc2)C[C@H](C)O1 ZINC000237548629 854052960 /nfs/dbraw/zinc/05/29/60/854052960.db2.gz GDEANTWJDNSXTJ-HOTGVXAUSA-N 0 3 422.447 4.124 20 0 HIADHN COc1ccc(CN[C@@H](c2ccc3c(c2)OCCO3)C2CC2)cc1Br ZINC000237550377 854053376 /nfs/dbraw/zinc/05/33/76/854053376.db2.gz UTWOMNWJDRHIRV-HXUWFJFHSA-N 0 3 404.304 4.470 20 0 HIADHN C[C@@H]1CN(Cc2cccc(CNCc3ccccc3OCc3cccnc3)c2)CCO1 ZINC000237581452 854058658 /nfs/dbraw/zinc/05/86/58/854058658.db2.gz LFLSPIIOBRSGIG-OAQYLSRUSA-N 0 3 417.553 4.171 20 0 HIADHN Cc1nc(COc2ccc(CN[C@H]3CCc4c3cccc4Br)cc2)no1 ZINC000237671318 854072861 /nfs/dbraw/zinc/07/28/61/854072861.db2.gz UKVSBQZBXBDXLN-IBGZPJMESA-N 0 3 414.303 4.497 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)c(C)c1CNCCNC(=O)c1ccccc1Cl ZINC000237721390 854083046 /nfs/dbraw/zinc/08/30/46/854083046.db2.gz YOSAWUKSBLQZAK-UHFFFAOYSA-N 0 3 417.340 4.316 20 0 HIADHN O=C(CCNCc1cc(Cl)ccc1OCc1cccnc1)NCc1ccccc1 ZINC000237762749 854090815 /nfs/dbraw/zinc/09/08/15/854090815.db2.gz VZTOFJMWRNREFI-UHFFFAOYSA-N 0 3 409.917 4.110 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(Cl)c1CNCCCc1nnc2n1CCCCC2 ZINC000237773858 854093457 /nfs/dbraw/zinc/09/34/57/854093457.db2.gz RNYYNZXWVBXEBS-UHFFFAOYSA-N 0 3 416.932 4.014 20 0 HIADHN Cn1cc(CNCc2ccc(NC(=O)c3ccc(F)cc3)cc2)c(-c2ccncc2)n1 ZINC000237776836 854095224 /nfs/dbraw/zinc/09/52/24/854095224.db2.gz KTIHSFLQOFYKHA-UHFFFAOYSA-N 0 3 415.472 4.163 20 0 HIADHN Fc1ccc(N2CCN(c3cc(CNCc4cccc5[nH]ccc54)ccn3)CC2)cc1 ZINC000237786154 854096965 /nfs/dbraw/zinc/09/69/65/854096965.db2.gz NAAFKGONFGNMPE-UHFFFAOYSA-N 0 3 415.516 4.318 20 0 HIADHN Cc1nn(-c2cccc(C(F)(F)F)c2)c(Cl)c1CNCCCc1cnn(C)c1 ZINC000237808333 854101151 /nfs/dbraw/zinc/10/11/51/854101151.db2.gz HNUFAUDHHDXZBT-UHFFFAOYSA-N 0 3 411.859 4.309 20 0 HIADHN Fc1ccc(C2(NCc3cc(Br)c4c(c3)OCCO4)CCOCC2)cc1 ZINC000237829438 854105685 /nfs/dbraw/zinc/10/56/85/854105685.db2.gz JDHUKPAOPBVKCZ-UHFFFAOYSA-N 0 3 422.294 4.155 20 0 HIADHN C[C@@H]1Cc2ccccc2N1Cc1occc1C(=O)NC[C@H](c1ccccc1)N(C)C ZINC000248031868 854174703 /nfs/dbraw/zinc/17/47/03/854174703.db2.gz TZWDNYJWDQCDTQ-WZONZLPQSA-N 0 3 403.526 4.264 20 0 HIADHN CN(Cc1ccccc1)C[C@H](O)CSc1nnc(-c2ccccc2F)n1C1CC1 ZINC000261395398 854246277 /nfs/dbraw/zinc/24/62/77/854246277.db2.gz BCUQDGAMVVCMAM-SFHVURJKSA-N 0 3 412.534 4.004 20 0 HIADHN O=C(NC1CC1)c1cc(NC[C@@H](c2ccco2)N2CCCCC2)nc2ccccc21 ZINC000301080083 854289546 /nfs/dbraw/zinc/28/95/46/854289546.db2.gz SNTZLMDFVBFOPQ-NRFANRHFSA-N 0 3 404.514 4.359 20 0 HIADHN Cc1nc2ccc(Br)cc2c(N[C@@H]2CCC[C@H](S(C)(=O)=O)C2)c1C ZINC000301407914 854385584 /nfs/dbraw/zinc/38/55/84/854385584.db2.gz VZPQOVXWAWKUCJ-CABCVRRESA-N 0 3 411.365 4.382 20 0 HIADHN COc1ccccc1[C@H](CNc1nc(-c2cccnc2)nc(C)c1C)N1CCCC1 ZINC000301495878 854408093 /nfs/dbraw/zinc/40/80/93/854408093.db2.gz AWZOIGWWNVUASI-NRFANRHFSA-N 0 3 403.530 4.413 20 0 HIADHN Cc1ccccc1[C@@H](C)NCC(=O)Nc1cc(C(F)(F)F)ccc1N1CCOCC1 ZINC000301508216 854409564 /nfs/dbraw/zinc/40/95/64/854409564.db2.gz OXWKNGDFVIYNRS-MRXNPFEDSA-N 0 3 421.463 4.140 20 0 HIADHN Cc1c2nnc(C(F)(F)F)n2nc(NC[C@@H](c2ccc(Cl)cc2)N(C)C)c1C ZINC000301733718 854454258 /nfs/dbraw/zinc/45/42/58/854454258.db2.gz GFMKBUUYXTTWSH-AWEZNQCLSA-N 0 3 412.847 4.128 20 0 HIADHN COc1ccc([C@H](CNc2ccc3nnc(-c4ccsc4)n3n2)N2CCCC2)cc1 ZINC000302290390 854560174 /nfs/dbraw/zinc/56/01/74/854560174.db2.gz LDXMBPLLWWYTJM-IBGZPJMESA-N 0 3 420.542 4.110 20 0 HIADHN CN(C)[C@H](CNc1ncc(Cn2cc(Br)cn2)s1)c1cccc(F)c1 ZINC000302449989 854572345 /nfs/dbraw/zinc/57/23/45/854572345.db2.gz PASBHYALXOMLHE-MRXNPFEDSA-N 0 3 424.343 4.004 20 0 HIADHN CCS(=O)(=O)c1ccc(NCC2CCN(Cc3ccccc3Cl)CC2)cc1 ZINC000302718432 854612406 /nfs/dbraw/zinc/61/24/06/854612406.db2.gz NZLYLLSOHYUKLE-UHFFFAOYSA-N 0 3 406.979 4.458 20 0 HIADHN CN(C)[C@@H](CNC(=O)c1c2c(sc1-n1cccc1)CSCC2)c1ccccc1 ZINC000302831103 854647173 /nfs/dbraw/zinc/64/71/73/854647173.db2.gz AGUVEWHJXVEAKB-SFHVURJKSA-N 0 3 411.596 4.361 20 0 HIADHN C[C@@H](C1CC1)N(CC(=O)N1CCC[C@@H]1c1ccc2c(c1)OCCO2)Cc1ccccc1 ZINC000302839632 854651565 /nfs/dbraw/zinc/65/15/65/854651565.db2.gz XZCDNNVOCJOFCQ-WMZHIEFXSA-N 0 3 420.553 4.422 20 0 HIADHN COc1ccc([C@H](CNC(=O)C2=Cc3cc(Cl)ccc3OC2)N2CCCC2)cc1 ZINC000302845621 854654476 /nfs/dbraw/zinc/65/44/76/854654476.db2.gz MVOJRGBJKBCSSA-NRFANRHFSA-N 0 3 412.917 4.078 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1c(C)nn(-c2ccccc2)c1C)c1cccc(OC)c1 ZINC000302878856 854665349 /nfs/dbraw/zinc/66/53/49/854665349.db2.gz LWBJVBMWMLFCGX-HSZRJFAPSA-N 0 3 420.557 4.311 20 0 HIADHN CS(=O)(=O)N1CCC(CNc2ccnc3ccc(Oc4ccccc4)cc32)CC1 ZINC000302880161 854665417 /nfs/dbraw/zinc/66/54/17/854665417.db2.gz HJTZGVRJZNECRM-UHFFFAOYSA-N 0 3 411.527 4.111 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)NC[C@@H](c2ccc(C)cc2)N(C)C)c(C(F)(F)F)c1 ZINC000302941724 854689952 /nfs/dbraw/zinc/68/99/52/854689952.db2.gz ATGSEGMMHYDDEW-IBGZPJMESA-N 0 3 422.451 4.397 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)c1sccc1Br ZINC000303007457 854720291 /nfs/dbraw/zinc/72/02/91/854720291.db2.gz PSUZPNBQCGJMAH-UHFFFAOYSA-N 0 3 401.757 4.368 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)c1cc2cc(Br)ccc2[nH]1 ZINC000303038606 854734057 /nfs/dbraw/zinc/73/40/57/854734057.db2.gz ZCOSQVQJJGKJRY-UHFFFAOYSA-N 0 3 418.310 4.274 20 0 HIADHN O=C(NC[C@@H]1CCCCN1Cc1ccccc1)c1ccccc1OC[C@H]1CCCO1 ZINC000303073511 854748771 /nfs/dbraw/zinc/74/87/71/854748771.db2.gz QDGCSRVMUHPDLK-FCHUYYIVSA-N 0 3 408.542 4.029 20 0 HIADHN CN(C[C@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)c1cccc(Cl)c1Cl ZINC000437330683 862601032 /nfs/dbraw/zinc/60/10/32/862601032.db2.gz ZOKMIWLPZAKLHL-MRXNPFEDSA-N 0 3 413.370 4.136 20 0 HIADHN Cc1cc(O[C@H](C)C(=O)N2CCC(CN3C[C@@H](C)O[C@H](C)C3)CC2)ccc1C(C)C ZINC000303139654 854780401 /nfs/dbraw/zinc/78/04/01/854780401.db2.gz KKJLSFIXNSZJEQ-NJDAHSKKSA-N 0 3 416.606 4.234 20 0 HIADHN Cc1sc(-c2ccco2)nc1C(=O)N1CCCN(CCCc2ccccc2)CC1 ZINC000303182263 854805217 /nfs/dbraw/zinc/80/52/17/854805217.db2.gz XNCWICFOUORFID-UHFFFAOYSA-N 0 3 409.555 4.492 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)c2nn(-c3ccccc3F)c3c2CCC3)c1 ZINC000303188594 854808706 /nfs/dbraw/zinc/80/87/06/854808706.db2.gz LRZWLFLYDJRKRI-UHFFFAOYSA-N 0 3 420.532 4.013 20 0 HIADHN Cc1nc(CCC(=O)N(CCN(C)C)Cc2cccc(C)c2)oc1-c1ccccc1 ZINC000303256141 854837659 /nfs/dbraw/zinc/83/76/59/854837659.db2.gz BYLHNKLLLBHENN-UHFFFAOYSA-N 0 3 405.542 4.481 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Cc1ccccc1C(F)(F)F)c1cccc(OC)c1 ZINC000303254520 854837760 /nfs/dbraw/zinc/83/77/60/854837760.db2.gz NZEGQYVXPZVMRS-HXUWFJFHSA-N 0 3 408.464 4.456 20 0 HIADHN C[C@@H](NC(=O)CN(Cc1ccccc1)CC1CCOCC1)c1ccc(Cl)cc1 ZINC000303460504 854960329 /nfs/dbraw/zinc/96/03/29/854960329.db2.gz LITPKYZLTDDTSB-GOSISDBHSA-N 0 3 400.950 4.446 20 0 HIADHN CCS[C@@H]1CCCCN(C(=O)Nc2ccc(CCN3CCSCC3)cc2)C1 ZINC000303460855 854961072 /nfs/dbraw/zinc/96/10/72/854961072.db2.gz ODIUGBJWBIYIQG-HXUWFJFHSA-N 0 3 407.649 4.417 20 0 HIADHN Cc1cnc2c(cccc2S(=O)(=O)NC2C[C@H]3CC[C@@H](C2)N3Cc2ccccc2)c1 ZINC000303467130 854965168 /nfs/dbraw/zinc/96/51/68/854965168.db2.gz MUJCHTMMKJEKMG-FRIKZZABSA-N 0 3 421.566 4.017 20 0 HIADHN CSc1ccc(C(=O)NC2CCN(CCOc3ccc(Cl)cc3)CC2)cc1 ZINC000303748685 855170815 /nfs/dbraw/zinc/17/08/15/855170815.db2.gz HATOFSVNVRWSIO-UHFFFAOYSA-N 0 3 404.963 4.335 20 0 HIADHN Cc1cnc2c(cccc2S(=O)(=O)N(C)[C@H]2CCN(Cc3ccccc3)[C@@H](C)C2)c1 ZINC000303801475 855205420 /nfs/dbraw/zinc/20/54/20/855205420.db2.gz LSNNTWKSLBZNRM-UGKGYDQZSA-N 0 3 423.582 4.217 20 0 HIADHN Cc1ccc(C(=O)NC2CCN(CCOc3ccc(Br)cc3)CC2)cc1 ZINC000303810732 855214568 /nfs/dbraw/zinc/21/45/68/855214568.db2.gz VFQPIMRVISZBIU-UHFFFAOYSA-N 0 3 417.347 4.031 20 0 HIADHN Cc1ccc(S(=O)(=O)N(C)[C@@H]2CCN(Cc3ccccc3)[C@H](C)C2)c2cccnc12 ZINC000303817781 855220455 /nfs/dbraw/zinc/22/04/55/855220455.db2.gz OPYBHXAJNVBQDO-TZIWHRDSSA-N 0 3 423.582 4.217 20 0 HIADHN CCc1ccc([C@@H]2COCCN2C(=O)NC[C@@H](c2ccsc2)N(CC)CC)o1 ZINC000303828268 855228454 /nfs/dbraw/zinc/22/84/54/855228454.db2.gz ZCMVLRQSOQWSKF-OALUTQOASA-N 0 3 405.564 4.070 20 0 HIADHN CN(C)[C@H](CNC(=O)c1cc(NC(=O)NC(C)(C)C)ccc1Cl)c1ccccc1 ZINC000303843651 855241281 /nfs/dbraw/zinc/24/12/81/855241281.db2.gz DLQPHRKORNEGEC-LJQANCHMSA-N 0 3 416.953 4.293 20 0 HIADHN CCc1c(C(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)cnn1-c1ccc(F)cc1 ZINC000303867085 855260184 /nfs/dbraw/zinc/26/01/84/855260184.db2.gz QEJWTRIVCFXKRL-IBGZPJMESA-N 0 3 420.532 4.310 20 0 HIADHN Cc1nc(-c2cccc(NC(=O)N3CCCN(Cc4ccccc4)C[C@@H]3C)c2)no1 ZINC000303879809 855266306 /nfs/dbraw/zinc/26/63/06/855266306.db2.gz OGUVJNIBBPQHKW-KRWDZBQOSA-N 0 3 405.502 4.173 20 0 HIADHN CCc1ccc([C@H]2COCCN2C(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)o1 ZINC000303880253 855266475 /nfs/dbraw/zinc/26/64/75/855266475.db2.gz QYIHWWCAENXXMJ-FCHUYYIVSA-N 0 3 411.546 4.070 20 0 HIADHN CN(C(=O)[C@@H]1C[C@@H]1c1c(F)cccc1Cl)C1CCN(CCc2ccccn2)CC1 ZINC000303902362 855278331 /nfs/dbraw/zinc/27/83/31/855278331.db2.gz STVKWKIKUDVJGI-RBUKOAKNSA-N 0 3 415.940 4.143 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)CCc3c[nH]c4c3cccc4C)c(C)c2)CC1 ZINC000303908780 855283167 /nfs/dbraw/zinc/28/31/67/855283167.db2.gz QXSUFPFWAUSVRE-UHFFFAOYSA-N 0 3 404.558 4.498 20 0 HIADHN CC(=O)N1C=Cc2ccccc2[C@H]1CC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C ZINC000303944833 855309973 /nfs/dbraw/zinc/30/99/73/855309973.db2.gz ZCDYYVNKYVYPCP-NBGIEHNGSA-N 0 3 417.553 4.074 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2ccc(CN(C)C(=O)C(C)C)cc2)N2CCCC2)cc1 ZINC000303969887 855329527 /nfs/dbraw/zinc/32/95/27/855329527.db2.gz ZQNHZPAFQKOQQV-DEOSSOPVSA-N 0 3 421.585 4.176 20 0 HIADHN CN(C)CCN(C(=O)c1ccc(Br)c(C(F)(F)F)c1)C1CCCC1 ZINC000325364683 855402620 /nfs/dbraw/zinc/40/26/20/855402620.db2.gz IOBPCOUGICRHQN-UHFFFAOYSA-N 0 3 407.274 4.414 20 0 HIADHN FC(F)(F)Oc1ccc(CNCc2ccc3c(c2)OCCO3)cc1Br ZINC000327558561 855418015 /nfs/dbraw/zinc/41/80/15/855418015.db2.gz BMSNXLZDIUCIFE-UHFFFAOYSA-N 0 3 418.209 4.409 20 0 HIADHN CN(C)Cc1ccccc1CNC(=O)c1ccc(Br)cc1C(F)(F)F ZINC000327907411 855421318 /nfs/dbraw/zinc/42/13/18/855421318.db2.gz JHYPYZPLPJVYLD-UHFFFAOYSA-N 0 3 415.253 4.460 20 0 HIADHN CC(C)(C)OC(=O)N1CCC[C@H](NCc2cc(F)ccc2Br)CC1 ZINC000382710092 855433769 /nfs/dbraw/zinc/43/37/69/855433769.db2.gz ZYLCLVIIDSQTMQ-HNNXBMFYSA-N 0 3 401.320 4.467 20 0 HIADHN CC(C)(C)OC(=O)N1CCC[C@@H](NCc2cccc(F)c2Br)CC1 ZINC000382763346 855434424 /nfs/dbraw/zinc/43/44/24/855434424.db2.gz RUKCMIIESSYBQY-CQSZACIVSA-N 0 3 401.320 4.467 20 0 HIADHN COc1ccc(C(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)cc1Br ZINC000383017161 855434545 /nfs/dbraw/zinc/43/45/45/855434545.db2.gz KGVFRUKGKIBPMI-MRXNPFEDSA-N 0 3 417.347 4.194 20 0 HIADHN CC(C)(C)OC(=O)N1CCCC[C@H]1CNCc1ccc(Br)cc1F ZINC000382730373 855434834 /nfs/dbraw/zinc/43/48/34/855434834.db2.gz BSQYNCZDPFPGIW-HNNXBMFYSA-N 0 3 401.320 4.467 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)c1cnc(Cl)c(Br)c1 ZINC000383033679 855434873 /nfs/dbraw/zinc/43/48/73/855434873.db2.gz BPCQYIQEHRUFHH-CQSZACIVSA-N 0 3 422.754 4.234 20 0 HIADHN Cc1ccc(Br)cc1C(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000388835214 855449156 /nfs/dbraw/zinc/44/91/56/855449156.db2.gz MRROHMHQZYHOAP-LJQANCHMSA-N 0 3 401.348 4.494 20 0 HIADHN Cc1ccc(Br)cc1C(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000388835211 855449318 /nfs/dbraw/zinc/44/93/18/855449318.db2.gz MRROHMHQZYHOAP-IBGZPJMESA-N 0 3 401.348 4.494 20 0 HIADHN Cc1nnc(CCN[C@@H](C)c2ccc(Br)cc2Br)s1 ZINC000391834188 855460811 /nfs/dbraw/zinc/46/08/11/855460811.db2.gz RCKGHVHSGCWAFX-QMMMGPOBSA-N 0 3 405.159 4.265 20 0 HIADHN Cc1ccc(-c2noc(CCC(=O)N[C@H]3CCN([C@H](C)c4ccccc4)C3)n2)cc1F ZINC000409456056 855488557 /nfs/dbraw/zinc/48/85/57/855488557.db2.gz ZTSPPUHIWKKWFR-XLIONFOSSA-N 0 3 422.504 4.068 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)NC[C@@H]3CCCC(F)(F)C3)CC2)c1 ZINC000409636578 855574989 /nfs/dbraw/zinc/57/49/89/855574989.db2.gz HAGFYZPPEKWANG-HXUWFJFHSA-N 0 3 422.564 4.022 20 0 HIADHN COc1ccc(CN(CC2CC2)C(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)c(OC)c1 ZINC000409734788 855627180 /nfs/dbraw/zinc/62/71/80/855627180.db2.gz SAUGVHLOQFAQSF-VWNXMTODSA-N 0 3 423.557 4.071 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)c1cccc(-c2noc(C3CC3)n2)c1 ZINC000409745008 855632207 /nfs/dbraw/zinc/63/22/07/855632207.db2.gz GALSNVBTRIYRKA-UHFFFAOYSA-N 0 3 418.541 4.251 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)Nc1ccc(OC(F)F)cc1 ZINC000409760814 855640033 /nfs/dbraw/zinc/64/00/33/855640033.db2.gz WINRBQKKANAXAS-UHFFFAOYSA-N 0 3 418.488 4.012 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)CCc2cc(Br)cs2)C1 ZINC000409851189 855688057 /nfs/dbraw/zinc/68/80/57/855688057.db2.gz YVKQQMJMWRQNKY-YOEHRIQHSA-N 0 3 407.377 4.395 20 0 HIADHN C[C@H](C(=O)N(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1)c1ccc(C(F)(F)F)cc1 ZINC000409957354 855744634 /nfs/dbraw/zinc/74/46/34/855744634.db2.gz FFBQGFYODKLJBM-QSFXBCCZSA-N 0 3 405.464 4.355 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)[C@@H]1CCCC(F)(F)C1 ZINC000410092863 855815576 /nfs/dbraw/zinc/81/55/76/855815576.db2.gz CZVQBVAFWKMOIK-MOPGFXCFSA-N 0 3 402.489 4.403 20 0 HIADHN O=C(NCc1ccc(F)cc1C(F)(F)F)NCC1(N2CCSCC2)CCCC1 ZINC000410145552 855837882 /nfs/dbraw/zinc/83/78/82/855837882.db2.gz NEXZZEXTTOLEEZ-UHFFFAOYSA-N 0 3 419.488 4.005 20 0 HIADHN C[C@H](Cc1ccc(F)c(Br)c1)C(=O)NCc1ccccc1CN(C)C ZINC000410225452 855869285 /nfs/dbraw/zinc/86/92/85/855869285.db2.gz ULCCOXNVABVXPR-CQSZACIVSA-N 0 3 407.327 4.145 20 0 HIADHN O=C(NCc1cccc(NC(=O)C2CCC2)c1)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000410273849 855895236 /nfs/dbraw/zinc/89/52/36/855895236.db2.gz AMOXRRUQUQFEBJ-QHCPKHFHSA-N 0 3 420.557 4.062 20 0 HIADHN CC(C)C[C@H](NC(=O)NCc1ccc(CN2CCN(C)CC2)cc1)c1ccccc1 ZINC000410374250 855958838 /nfs/dbraw/zinc/95/88/38/855958838.db2.gz MRDAKOJWQLROKF-DEOSSOPVSA-N 0 3 408.590 4.021 20 0 HIADHN Cc1ccc2cc([C@@H](C)NCc3ccc(CS(=O)(=O)NC(C)C)cc3)oc2c1 ZINC000425933590 856007814 /nfs/dbraw/zinc/00/78/14/856007814.db2.gz ZZKWGANGJXMMJT-QGZVFWFLSA-N 0 3 400.544 4.420 20 0 HIADHN CC[C@@H](C)[C@@H](NC(=O)N1CCN(C2CCOCC2)C[C@H]1C)c1ccc(Cl)cc1 ZINC000426025254 856054331 /nfs/dbraw/zinc/05/43/31/856054331.db2.gz YSIGQGRLKYPCFO-CBGDNZLLSA-N 0 3 407.986 4.322 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)N[C@@H]2CCCc3sc(Cl)cc32)cc1 ZINC000426053111 856074898 /nfs/dbraw/zinc/07/48/98/856074898.db2.gz VGCYFKXRSFKBFW-IAGOWNOFSA-N 0 3 407.967 4.390 20 0 HIADHN COc1ccc(NC(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)c2cccnc12 ZINC000426104852 856110389 /nfs/dbraw/zinc/11/03/89/856110389.db2.gz ZHPWDHBYGDENAI-GOSISDBHSA-N 0 3 404.514 4.372 20 0 HIADHN Cc1c(NC(=O)N[C@H]2CCN(Cc3ccccc3)C[C@@H]2CO)cccc1C(F)(F)F ZINC000426143026 856136644 /nfs/dbraw/zinc/13/66/44/856136644.db2.gz KXJWNPFNBJXCQL-XLIONFOSSA-N 0 3 421.463 4.018 20 0 HIADHN CC(C)Sc1ccccc1NC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1CO ZINC000426153784 856142593 /nfs/dbraw/zinc/14/25/93/856142593.db2.gz ONWBOCCOELXJAB-VQTJNVASSA-N 0 3 413.587 4.192 20 0 HIADHN Cc1cccc2nc(CCC(=O)NC[C@@H](c3cccc(Cl)c3)N3CCCC3)[nH]c21 ZINC000426162911 856147114 /nfs/dbraw/zinc/14/71/14/856147114.db2.gz UFBPKSHEGRELQP-FQEVSTJZSA-N 0 3 410.949 4.411 20 0 HIADHN COc1ccc([C@@H](C)CC(=O)NCCCCN2CCN(c3cccc(C)c3)CC2)cc1 ZINC000426177575 856156441 /nfs/dbraw/zinc/15/64/41/856156441.db2.gz GVFIWQPSIYJBFZ-QFIPXVFZSA-N 0 3 423.601 4.216 20 0 HIADHN COc1ccccc1[C@H](NC(=O)NC[C@H](c1ccc(C)cc1)N(C)C)c1ccco1 ZINC000426314799 856239854 /nfs/dbraw/zinc/23/98/54/856239854.db2.gz YGKWLJUREDQLCH-OFNKIYASSA-N 0 3 407.514 4.288 20 0 HIADHN C[C@H](N[C@@H]1c2cc(Br)ccc2CC1(C)C)c1ccc(S(N)(=O)=O)cc1 ZINC000426333532 856249540 /nfs/dbraw/zinc/24/95/40/856249540.db2.gz IEURMXOWKLJQRZ-KPZWWZAWSA-N 0 3 423.376 4.071 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)N[C@@H]1CCOC2(CCCCC2)C1 ZINC000426521413 856331811 /nfs/dbraw/zinc/33/18/11/856331811.db2.gz HHMIXOROKKQANE-HXUWFJFHSA-N 0 3 407.986 4.295 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)N[C@H]1CCCC(F)(F)C1 ZINC000426605801 856370325 /nfs/dbraw/zinc/37/03/25/856370325.db2.gz PXDZBOMQFPXZRC-INIZCTEOSA-N 0 3 407.427 4.357 20 0 HIADHN Cc1cccc(-c2cncc(C(=O)N3CCC(CCN4C[C@@H](C)O[C@H](C)C4)CC3)c2)c1 ZINC000426657606 856396760 /nfs/dbraw/zinc/39/67/60/856396760.db2.gz QDZXHZDKRLMREG-NHCUHLMSSA-N 0 3 421.585 4.409 20 0 HIADHN CC(C)Oc1ccc(CN(C)[C@@H](C)c2cccc(N3CCCS3(=O)=O)c2)cc1 ZINC000426747721 856451476 /nfs/dbraw/zinc/45/14/76/856451476.db2.gz RKXUGHANNQGUJY-SFHVURJKSA-N 0 3 402.560 4.207 20 0 HIADHN C[C@@H](C(=O)N(Cc1ccccc1Br)C1CCN(C)CC1)c1ccccn1 ZINC000426784531 856476780 /nfs/dbraw/zinc/47/67/80/856476780.db2.gz MXZYKGLNONINTM-MRXNPFEDSA-N 0 3 416.363 4.071 20 0 HIADHN C[C@@H](CC(=O)NC1CCN(CCOc2ccc(F)cc2)CC1)c1c[nH]c2ccccc21 ZINC000426880671 856524850 /nfs/dbraw/zinc/52/48/50/856524850.db2.gz AQSMDHDRUQPMAU-SFHVURJKSA-N 0 3 423.532 4.460 20 0 HIADHN C[C@@H](C(=O)Nc1cccc(-c2cn(Cc3ccccc3)nn2)c1)N1[C@H](C)CC[C@@H]1C ZINC000426957087 856562668 /nfs/dbraw/zinc/56/26/68/856562668.db2.gz WQZWQCXZBHWDQA-OTWHNJEPSA-N 0 3 403.530 4.193 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)N[C@H]2CCC[C@@H]2OCc2ccccc2)CC1 ZINC000426980075 856577290 /nfs/dbraw/zinc/57/72/90/856577290.db2.gz HUWCVMGCPQJLDU-DQEYMECFSA-N 0 3 421.585 4.430 20 0 HIADHN CN(C(=O)CCCCCc1ccc(F)cc1)C1CCN(CCc2ccccn2)CC1 ZINC000427129673 856657926 /nfs/dbraw/zinc/65/79/26/856657926.db2.gz ZNPNZWLZIMCSKY-UHFFFAOYSA-N 0 3 411.565 4.489 20 0 HIADHN C[C@@H]1CCN(C(=O)c2ccc(N3CCCCCC3)nc2)CCN1Cc1ccccc1 ZINC000437467610 862830033 /nfs/dbraw/zinc/83/00/33/862830033.db2.gz AAULFRKIWUVBTK-OAQYLSRUSA-N 0 3 406.574 4.199 20 0 HIADHN CC[C@H](C)Oc1ccc(C(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)cc1 ZINC000427286055 856751257 /nfs/dbraw/zinc/75/12/57/856751257.db2.gz CCVONROMCAZJBF-SLFFLAALSA-N 0 3 402.579 4.215 20 0 HIADHN CCSCc1ccc(C(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)cc1 ZINC000427288297 856754122 /nfs/dbraw/zinc/75/41/22/856754122.db2.gz OVTIVJIZQSHZBQ-OALUTQOASA-N 0 3 404.620 4.291 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)[C@@H]3CCC[C@@H](C(F)(F)F)C3)CC2)C[C@@H](C)O1 ZINC000427297431 856758262 /nfs/dbraw/zinc/75/82/62/856758262.db2.gz STPGAAYSAJAXTN-PSBWJHGTSA-N 0 3 404.517 4.093 20 0 HIADHN C[C@@H]1C[C@@H]1C(=O)Nc1ccc(C(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)cc1 ZINC000437471775 862833042 /nfs/dbraw/zinc/83/30/42/862833042.db2.gz XDEBKWZMQFQROO-PWHSHALESA-N 0 3 405.542 4.018 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3[nH]c4ccccc4c3Cl)CC2)C[C@@H](C)O1 ZINC000427299467 856759963 /nfs/dbraw/zinc/75/99/63/856759963.db2.gz NDXRFZXXFHCLPN-HZPDHXFCSA-N 0 3 403.954 4.173 20 0 HIADHN Cc1ccc(C(C)(C)CC(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)cc1 ZINC000427307744 856763020 /nfs/dbraw/zinc/76/30/20/856763020.db2.gz JOWNJTJRUHLZFJ-NHCUHLMSSA-N 0 3 400.607 4.401 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)Cc3c[nH]c4ccc(Cl)cc34)CC2)C[C@H](C)O1 ZINC000427318843 856768933 /nfs/dbraw/zinc/76/89/33/856768933.db2.gz BYRNTRKURNFAPE-IRXDYDNUSA-N 0 3 417.981 4.102 20 0 HIADHN COc1ccc(Cl)cc1NCCC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC000437473089 862834223 /nfs/dbraw/zinc/83/42/23/862834223.db2.gz NRCREZMUEPXUDN-GOSISDBHSA-N 0 3 415.965 4.274 20 0 HIADHN COc1ccc(CCCCC(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)cc1 ZINC000427323255 856771662 /nfs/dbraw/zinc/77/16/62/856771662.db2.gz WXJDHLYREIGTMI-NHCUHLMSSA-N 0 3 416.606 4.146 20 0 HIADHN C[C@H](CCc1cccc(F)c1)C(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000427343803 856783093 /nfs/dbraw/zinc/78/30/93/856783093.db2.gz YFQPBUHRGCTFOF-VAMGGRTRSA-N 0 3 404.570 4.132 20 0 HIADHN CCc1c(NC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)cnn1CCC(C)C ZINC000427416083 856811719 /nfs/dbraw/zinc/81/17/19/856811719.db2.gz VDOVNQJVKCYSDQ-IBGZPJMESA-N 0 3 400.542 4.481 20 0 HIADHN CCc1c(NC(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)cnn1CCC(C)C ZINC000427425030 856815243 /nfs/dbraw/zinc/81/52/43/856815243.db2.gz SOXXHSMIFZPDJU-UHFFFAOYSA-N 0 3 411.594 4.274 20 0 HIADHN C[C@H]1CN(Cc2cccc(CN[C@@H]3CCCc4ncc(C(F)(F)F)cc43)c2)CCO1 ZINC000427617929 856889190 /nfs/dbraw/zinc/88/91/90/856889190.db2.gz LNHRBVDECQTQBS-HRAATJIYSA-N 0 3 419.491 4.488 20 0 HIADHN C[C@H]1CN(Cc2cccc(CN[C@H]3CCCc4ncc(C(F)(F)F)cc43)c2)CCO1 ZINC000427617932 856889466 /nfs/dbraw/zinc/88/94/66/856889466.db2.gz LNHRBVDECQTQBS-KKSFZXQISA-N 0 3 419.491 4.488 20 0 HIADHN CCn1ncc(C(=O)Nc2cccc(CN3CCC(CO)CC3)c2)c1-c1ccccc1 ZINC000427634860 856893247 /nfs/dbraw/zinc/89/32/47/856893247.db2.gz YBYJFMXYTRGCAL-UHFFFAOYSA-N 0 3 418.541 4.027 20 0 HIADHN COCCCN(C(=O)c1ccc(-c2nc3ccccc3s2)o1)C1CCN(C)CC1 ZINC000427793947 856957816 /nfs/dbraw/zinc/95/78/16/856957816.db2.gz QDYUWYWLXNIFNI-UHFFFAOYSA-N 0 3 413.543 4.129 20 0 HIADHN Cc1cc2c(cc1C)[C@H](NCc1ccc(N3CCCS3(=O)=O)c(F)c1)CCS2 ZINC000427841911 856977432 /nfs/dbraw/zinc/97/74/32/856977432.db2.gz JETUGWBJLZNASX-LJQANCHMSA-N 0 3 420.575 4.309 20 0 HIADHN CCSc1cc(CN[C@@H](C)CC(=O)Nc2ccc(NC(=O)C3CC3)cc2)ccn1 ZINC000427869080 856988573 /nfs/dbraw/zinc/98/85/73/856988573.db2.gz FTBWWHAZKSOIQX-HNNXBMFYSA-N 0 3 412.559 4.049 20 0 HIADHN Fc1cc(Br)ccc1[C@H](N[C@@H]1CCn2ccnc2C1)c1ccccc1 ZINC000427886086 856993654 /nfs/dbraw/zinc/99/36/54/856993654.db2.gz YIDWFDIEDMSTPC-OXQOHEQNSA-N 0 3 400.295 4.479 20 0 HIADHN Cc1ccc([C@@H](NC[C@@H]2CCC(C)(C)O2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000427979816 857030813 /nfs/dbraw/zinc/03/08/13/857030813.db2.gz QGPQTUMOTGZNAK-UGKGYDQZSA-N 0 3 401.572 4.344 20 0 HIADHN Cn1ccnc1C[C@H]1CCCN(Cc2cnn(Cc3ccc(C(F)(F)F)cc3)c2)C1 ZINC000428076832 857064208 /nfs/dbraw/zinc/06/42/08/857064208.db2.gz NVOFYPOJJNRTLT-GOSISDBHSA-N 0 3 417.479 4.138 20 0 HIADHN COc1ccccc1/C=C\CNC1(C(=O)Nc2ccc(OC)c(OC)c2)CCCC1 ZINC000428368150 857177377 /nfs/dbraw/zinc/17/73/77/857177377.db2.gz BZGCIWWJEIOWEZ-NTMALXAHSA-N 0 3 410.514 4.267 20 0 HIADHN CC[C@]1(CO)CCCN(Cc2c(C)nn(-c3ccc(Br)cc3)c2C)C1 ZINC000428453978 857207898 /nfs/dbraw/zinc/20/78/98/857207898.db2.gz QHSCFFAQNLRFFA-FQEVSTJZSA-N 0 3 406.368 4.236 20 0 HIADHN C[C@@H](c1cccc(N2CCCS2(=O)=O)c1)N(C)Cc1ccc2c(c1)CC(C)(C)O2 ZINC000428477656 857217550 /nfs/dbraw/zinc/21/75/50/857217550.db2.gz GTNAKCYKCZERIF-KRWDZBQOSA-N 0 3 414.571 4.133 20 0 HIADHN C[C@H](Oc1ccc(Cl)cc1)C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000428513466 857234014 /nfs/dbraw/zinc/23/40/14/857234014.db2.gz DMGSECDSETVAKY-FXAWDEMLSA-N 0 3 424.932 4.390 20 0 HIADHN Cc1ccccc1-n1ncc(C(=O)Nc2cccc(CN3CC[C@@H](O)C3)c2)c1C(C)C ZINC000428533228 857245972 /nfs/dbraw/zinc/24/59/72/857245972.db2.gz MUZRYGAKXPZLFT-OAQYLSRUSA-N 0 3 418.541 4.123 20 0 HIADHN O=C(Cc1csc2ccc(Cl)cc12)Nc1cccc(CN2CC[C@H](O)C2)c1 ZINC000428540492 857252996 /nfs/dbraw/zinc/25/29/96/857252996.db2.gz RUMMDSBGFCRFAN-SFHVURJKSA-N 0 3 400.931 4.303 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)C1(Cc2ccc(C(F)(F)F)cc2)CC1 ZINC000428542470 857254733 /nfs/dbraw/zinc/25/47/33/857254733.db2.gz FVPPRCPIMBNZQO-FQEVSTJZSA-N 0 3 418.459 4.233 20 0 HIADHN Cc1cc(C(=O)Nc2cccc(CN3CC[C@H](O)C3)c2)cc(Cl)c1Br ZINC000428550690 857260760 /nfs/dbraw/zinc/26/07/60/857260760.db2.gz SAABXOUGUIFLQJ-INIZCTEOSA-N 0 3 423.738 4.230 20 0 HIADHN C[C@H](Cc1ccccc1)n1cccc1C(=O)Nc1cccc(CN2CC[C@H](O)C2)c1 ZINC000428553920 857262727 /nfs/dbraw/zinc/26/27/27/857262727.db2.gz YHNZUGHFKLBPAN-XXBNENTESA-N 0 3 403.526 4.111 20 0 HIADHN O=C(Cc1cc2c(ccc3ccccc23)o1)Nc1cccc(CN2CC[C@@H](O)C2)c1 ZINC000428552463 857262801 /nfs/dbraw/zinc/26/28/01/857262801.db2.gz MPEQMHYELKKYHL-HXUWFJFHSA-N 0 3 400.478 4.334 20 0 HIADHN FC(F)(F)c1ccc(-c2nc(CNC3CCN(c4cccnn4)CC3)cs2)cc1 ZINC000428565529 857267981 /nfs/dbraw/zinc/26/79/81/857267981.db2.gz KXSSUYMAQPQCTB-UHFFFAOYSA-N 0 3 419.476 4.378 20 0 HIADHN CCN1CCCN(C(=O)N[C@@H](c2cccc(OC)c2)c2ccccc2Cl)CC1 ZINC000428691536 857298113 /nfs/dbraw/zinc/29/81/13/857298113.db2.gz VSLNIMAVQNLXMS-NRFANRHFSA-N 0 3 401.938 4.175 20 0 HIADHN CCN1CCCN(C(=O)NC[C@@H](c2c[nH]c3ccccc32)c2ccc(OC)cc2)CC1 ZINC000428703931 857302349 /nfs/dbraw/zinc/30/23/49/857302349.db2.gz VWDZEXHRBTWFAS-JOCHJYFZSA-N 0 3 420.557 4.046 20 0 HIADHN CCOC(=O)Cn1nc(C)c(CN(Cc2ccc(Br)cc2)C(C)C)c1C ZINC000437577616 862895898 /nfs/dbraw/zinc/89/58/98/862895898.db2.gz FAOKRUSYCDEHDK-UHFFFAOYSA-N 0 3 422.367 4.236 20 0 HIADHN CN(Cc1c[nH]nc1-c1ccsc1)C[C@H](O)COc1ccc(C(F)(F)F)cc1 ZINC000437580942 862897159 /nfs/dbraw/zinc/89/71/59/862897159.db2.gz RHKYIPYNRUODJM-INIZCTEOSA-N 0 3 411.449 4.029 20 0 HIADHN COC(=O)[C@]1(c2ccccc2)CCN(Cc2cccc(C(=O)Nc3ccccc3)c2)C1 ZINC000428791442 857341477 /nfs/dbraw/zinc/34/14/77/857341477.db2.gz ZWYDJIYXSAFBMQ-AREMUKBSSA-N 0 3 414.505 4.256 20 0 HIADHN c1ccc(CN2CCC[C@@H](N(Cc3nc(C4CC4)no3)Cc3ccncc3)C2)cc1 ZINC000428793478 857342732 /nfs/dbraw/zinc/34/27/32/857342732.db2.gz KQKSYNUWPXJWID-JOCHJYFZSA-N 0 3 403.530 4.009 20 0 HIADHN CCCCc1noc(CN(Cc2ccncc2)[C@H]2CCCN(Cc3ccccc3)C2)n1 ZINC000428798811 857347858 /nfs/dbraw/zinc/34/78/58/857347858.db2.gz USNRRHAIZLFLGM-QHCPKHFHSA-N 0 3 419.573 4.474 20 0 HIADHN C[C@H]1C[C@H](NC(=O)N2CCC(c3ncccc3Cl)CC2)CN1Cc1ccccc1 ZINC000428809624 857354137 /nfs/dbraw/zinc/35/41/37/857354137.db2.gz VZVYNURRNOWJNT-PXNSSMCTSA-N 0 3 412.965 4.287 20 0 HIADHN Cc1nc2ccccc2n1CCCCCN(Cc1ccc(C(N)=O)cc1F)C1CC1 ZINC000428813405 857357269 /nfs/dbraw/zinc/35/72/69/857357269.db2.gz CXUYUWWBYULRAG-UHFFFAOYSA-N 0 3 408.521 4.418 20 0 HIADHN C[C@H](CC(=O)Nc1cccc(CN2CC[C@H](O)C2)c1)c1ccc(Br)cc1 ZINC000428821713 857360311 /nfs/dbraw/zinc/36/03/11/857360311.db2.gz LWWJAABXQVKJTA-QRWLVFNGSA-N 0 3 417.347 4.148 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)NCC(C)(C)c3ccc(F)cc3)CC2)C[C@H](C)O1 ZINC000428830319 857364446 /nfs/dbraw/zinc/36/44/46/857364446.db2.gz RMUHLCGTMAKDJC-KDURUIRLSA-N 0 3 419.585 4.024 20 0 HIADHN Cc1cc(Br)cn2cc(CCNCc3nc4ccc(F)cc4s3)nc12 ZINC000428858698 857374757 /nfs/dbraw/zinc/37/47/57/857374757.db2.gz FEQOESGOIXQEPD-UHFFFAOYSA-N 0 3 419.323 4.486 20 0 HIADHN Cc1ccccc1C(=O)NC1CCN(C(=O)CN(C(C)C)[C@@H](C)c2ccccc2)CC1 ZINC000428873612 857381167 /nfs/dbraw/zinc/38/11/67/857381167.db2.gz VITLXQYZEYMXDJ-NRFANRHFSA-N 0 3 421.585 4.187 20 0 HIADHN CCn1cnnc1-c1ccccc1NC(=O)NC[C@@H](c1ccc(C)cc1)N1CCCC1 ZINC000428885139 857389243 /nfs/dbraw/zinc/38/92/43/857389243.db2.gz TYGKMXLWAIXYMS-QFIPXVFZSA-N 0 3 418.545 4.232 20 0 HIADHN CN(C[C@]1(O)CCN(Cc2ccccc2)C1)C(=O)c1sccc1-c1ccccc1 ZINC000428968230 857438755 /nfs/dbraw/zinc/43/87/55/857438755.db2.gz OJRYNRDQBMSPJC-XMMPIXPASA-N 0 3 406.551 4.124 20 0 HIADHN Cc1c2cc(Cl)ccc2oc1C(=O)N(C)C[C@@]1(O)CCN(Cc2ccccc2)C1 ZINC000428974801 857441262 /nfs/dbraw/zinc/44/12/62/857441262.db2.gz DTXLFTDQNAOZAU-QHCPKHFHSA-N 0 3 412.917 4.104 20 0 HIADHN CCN(Cc1cccc(Cl)c1)C(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000429040583 857470540 /nfs/dbraw/zinc/47/05/40/857470540.db2.gz LYLOZUFPSAOZKI-QFIPXVFZSA-N 0 3 415.965 4.163 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)Nc3cccc(N4CCCC4)c3)CC2)C[C@H](C)O1 ZINC000429042522 857471329 /nfs/dbraw/zinc/47/13/29/857471329.db2.gz CEIYEMBPNHKBQN-PMACEKPBSA-N 0 3 414.594 4.030 20 0 HIADHN C[C@@H]1CCN(C(=O)NC[C@@H]2CN(Cc3ccccc3)CCCO2)[C@H](c2ccco2)C1 ZINC000429044710 857473054 /nfs/dbraw/zinc/47/30/54/857473054.db2.gz RPIISRKATDDJBP-FCEUIQTBSA-N 0 3 411.546 4.053 20 0 HIADHN CC(C)Oc1ccc(F)cc1NC(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000429064555 857488277 /nfs/dbraw/zinc/48/82/77/857488277.db2.gz NWKBYMRAGHZQNY-HDICACEKSA-N 0 3 421.557 4.356 20 0 HIADHN CSCCc1ccc(NC(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)cc1 ZINC000429075319 857496116 /nfs/dbraw/zinc/49/61/16/857496116.db2.gz DRYBYLKGPRNCBT-KDURUIRLSA-N 0 3 419.635 4.335 20 0 HIADHN CSCCc1ccc(NC(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)cc1 ZINC000429075321 857496145 /nfs/dbraw/zinc/49/61/45/857496145.db2.gz DRYBYLKGPRNCBT-RTBURBONSA-N 0 3 419.635 4.335 20 0 HIADHN C[C@H](NCC[S@](=O)c1cc(Cl)ccc1Cl)[C@@H]1OCCc2sccc21 ZINC000429168788 857539806 /nfs/dbraw/zinc/53/98/06/857539806.db2.gz QUZPPTZKOCXELJ-LTUUMAEBSA-N 0 3 404.384 4.455 20 0 HIADHN COc1c(C)ccc(NC(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)c1C ZINC000429253335 857575098 /nfs/dbraw/zinc/57/50/98/857575098.db2.gz HYSOJOTUZLTCMK-HDICACEKSA-N 0 3 403.567 4.055 20 0 HIADHN COc1ccc2cc(CN(C)C(=O)[C@H](C)N3CCC[C@H](CSC)C3)ccc2c1 ZINC000429272878 857585328 /nfs/dbraw/zinc/58/53/28/857585328.db2.gz LMRBRUUTTOXARZ-HKUYNNGSSA-N 0 3 400.588 4.270 20 0 HIADHN O=C(CN[C@H]1Cc2cccc(O)c2C1)Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000429295505 857595229 /nfs/dbraw/zinc/59/52/29/857595229.db2.gz BBRIYSICBIZKBC-ZDUSSCGKSA-N 0 3 418.337 4.125 20 0 HIADHN C[C@H](N[C@H]1Cc2cccc(O)c2C1)C(=O)Nc1cccc(CSc2ccccn2)c1 ZINC000429313761 857599790 /nfs/dbraw/zinc/59/97/90/857599790.db2.gz YFXDREYDKJEEES-JXFKEZNVSA-N 0 3 419.550 4.164 20 0 HIADHN CCC1(CC)[C@H](NCC(=O)Nc2c(F)cc(F)cc2Br)[C@@H](C)[C@@H]1OC ZINC000429316801 857601149 /nfs/dbraw/zinc/60/11/49/857601149.db2.gz WYWLUNQURXKFHE-LWNYNHHKSA-N 0 3 419.310 4.095 20 0 HIADHN COc1ccccc1NC(=O)c1ccc(NC(=O)CCN(C)Cc2occc2C)cc1 ZINC000429379154 857632445 /nfs/dbraw/zinc/63/24/45/857632445.db2.gz RHWUNQWOXKORJH-UHFFFAOYSA-N 0 3 421.497 4.310 20 0 HIADHN Cn1ccc([C@H](NC[C@@H]2CN(Cc3ccccc3)CCCO2)c2ccc(Cl)cc2)n1 ZINC000429413607 857652927 /nfs/dbraw/zinc/65/29/27/857652927.db2.gz VNLQVMLFXVZEKK-ISKFKSNPSA-N 0 3 424.976 4.044 20 0 HIADHN C[C@H](NC[C@H](CO)Cc1ccc(Br)cc1)c1nc2c(s1)CCCC2 ZINC000429412953 857652991 /nfs/dbraw/zinc/65/29/91/857652991.db2.gz RDSUFEOQPSKYIQ-DZGCQCFKSA-N 0 3 409.393 4.286 20 0 HIADHN COCCS(=O)(=O)c1ccc(CN[C@@H](C)c2ccc3cc(OC)ccc3c2)cc1 ZINC000429419232 857656735 /nfs/dbraw/zinc/65/67/35/857656735.db2.gz SKZJENOVGHFZNN-KRWDZBQOSA-N 0 3 413.539 4.119 20 0 HIADHN C[C@@H](NC[C@H]1CN(Cc2ccccc2)CCCO1)c1nc2ccc(Cl)cc2n1C ZINC000429430456 857663917 /nfs/dbraw/zinc/66/39/17/857663917.db2.gz LVPBLSNOOGEMCX-XLIONFOSSA-N 0 3 412.965 4.168 20 0 HIADHN CN(C(=O)NC[C@@H](c1ccccc1)C(C)(C)CO)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000437621054 862937729 /nfs/dbraw/zinc/93/77/29/862937729.db2.gz CLRYFJPCJFXKKE-ZEQRLZLVSA-N 0 3 423.601 4.095 20 0 HIADHN Cc1cccc([C@H](C)CNC(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)c1 ZINC000429460491 857683098 /nfs/dbraw/zinc/68/30/98/857683098.db2.gz YYARLBZMZGSWLJ-NJDAHSKKSA-N 0 3 401.595 4.019 20 0 HIADHN Cc1ccc([C@H](C)CNC(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)cc1 ZINC000429504240 857702832 /nfs/dbraw/zinc/70/28/32/857702832.db2.gz PDVNAIXLSQPBAR-NJDAHSKKSA-N 0 3 401.595 4.019 20 0 HIADHN C[C@@H]1CC[C@H](N(C)CC(=O)N(Cc2nnc(-c3ccccc3Cl)o2)C2CC2)C1 ZINC000429570270 857756650 /nfs/dbraw/zinc/75/66/50/857756650.db2.gz UPEJVSAKBUEWGQ-ZBFHGGJFSA-N 0 3 402.926 4.001 20 0 HIADHN Cc1noc(-c2ccccc2)c1NC(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000429602463 857785366 /nfs/dbraw/zinc/78/53/66/857785366.db2.gz PFDMCWJTLINJDO-NRFANRHFSA-N 0 3 420.513 4.063 20 0 HIADHN O=C(NC[C@H]1CN(Cc2ccccc2)CCCO1)Nc1c(F)cc(Cl)cc1F ZINC000429613688 857794933 /nfs/dbraw/zinc/79/49/33/857794933.db2.gz USXUKHPHELJGCB-INIZCTEOSA-N 0 3 409.864 4.031 20 0 HIADHN COc1ccc([C@@H](NC[C@@H]2CN(Cc3ccccc3)CCCO2)C(F)(F)F)cc1 ZINC000429684816 857833774 /nfs/dbraw/zinc/83/37/74/857833774.db2.gz LEDHCKFWHPEZSG-NHCUHLMSSA-N 0 3 408.464 4.179 20 0 HIADHN CC(C)(c1ccc(NC(=O)N2CCN(CC3CCOCC3)CC2)cc1)C(F)(F)F ZINC000429706321 857843739 /nfs/dbraw/zinc/84/37/39/857843739.db2.gz VQCBFKBJWHOWFC-UHFFFAOYSA-N 0 3 413.484 4.103 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)c1cc(Br)c(F)cc1F ZINC000429717866 857848861 /nfs/dbraw/zinc/84/88/61/857848861.db2.gz DDPKOEGWLHQYMY-GOSISDBHSA-N 0 3 409.274 4.294 20 0 HIADHN Clc1ccc([C@@H]2CN(C[C@H]3CN(Cc4ccccc4)CCCO3)CCO2)cc1 ZINC000429720094 857849913 /nfs/dbraw/zinc/84/99/13/857849913.db2.gz DNYNVOKBFINTFW-PKTZIBPZSA-N 0 3 400.950 4.004 20 0 HIADHN O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)Nc1ccc2nc(C3CC3)oc2c1 ZINC000429774186 857880545 /nfs/dbraw/zinc/88/05/45/857880545.db2.gz SOCIDLIFQNDFKL-HXUWFJFHSA-N 0 3 420.513 4.118 20 0 HIADHN Cc1ccc([C@@H](NCCC(=O)Nc2ccc(C(N)=O)c(Cl)c2)c2ccccc2)cc1 ZINC000437633942 862960220 /nfs/dbraw/zinc/96/02/20/862960220.db2.gz KFPQCEFDNJNULA-QHCPKHFHSA-N 0 3 421.928 4.455 20 0 HIADHN CCO[C@H]1C[C@@H](NCC(=O)Nc2c(C)nn(-c3ccc(C)cc3)c2C)C12CCCCC2 ZINC000429792769 857885703 /nfs/dbraw/zinc/88/57/03/857885703.db2.gz UWCIGQGJSMHXTP-YADHBBJMSA-N 0 3 424.589 4.454 20 0 HIADHN CCO[C@H]1C[C@H](NCC(=O)Nc2cc3c(cc2Cl)OCCCO3)C12CCCCC2 ZINC000429794656 857887554 /nfs/dbraw/zinc/88/75/54/857887554.db2.gz XPEPOIQTCLJEGN-PMACEKPBSA-N 0 3 422.953 4.157 20 0 HIADHN Cc1nc([C@H]2CCCOC2)sc1C(=O)N(CCN(C)C)Cc1cccc(Cl)c1 ZINC000429814351 857895035 /nfs/dbraw/zinc/89/50/35/857895035.db2.gz ZIJJDPUCJYCCGP-KRWDZBQOSA-N 0 3 421.994 4.203 20 0 HIADHN C[C@@H](CN1CCCCC1)NC(=O)C(C)(C)c1csc(-c2c(F)cccc2F)n1 ZINC000429830446 857900351 /nfs/dbraw/zinc/90/03/51/857900351.db2.gz NOYUWUIYTRLWBQ-AWEZNQCLSA-N 0 3 407.530 4.357 20 0 HIADHN C[C@@H]1CCCCN1CCNC(=O)C(C)(C)c1csc(-c2c(F)cccc2F)n1 ZINC000429834285 857902614 /nfs/dbraw/zinc/90/26/14/857902614.db2.gz YVOJJEAXILUZJI-CQSZACIVSA-N 0 3 407.530 4.357 20 0 HIADHN Cc1cc(C(=O)Nc2cccc(CN(C)C)c2)nn1-c1ccc(Br)cc1 ZINC000429959233 857969165 /nfs/dbraw/zinc/96/91/65/857969165.db2.gz ADHQVKWVVNXRJQ-UHFFFAOYSA-N 0 3 413.319 4.257 20 0 HIADHN COC(=O)[C@@H]1CCO[C@H]1C1CCN(Cc2ccc(-c3cccc(F)c3F)o2)CC1 ZINC000430109505 858035879 /nfs/dbraw/zinc/03/58/79/858035879.db2.gz YJUFQVMTFNRATL-UTKZUKDTSA-N 0 3 405.441 4.015 20 0 HIADHN Cc1ccc(NC(=O)C[C@H](C)N[C@@H](CO)c2ccc(Br)c(F)c2)c(C)c1 ZINC000430125249 858043006 /nfs/dbraw/zinc/04/30/06/858043006.db2.gz MGOCZPDZAAIGRQ-LIRRHRJNSA-N 0 3 423.326 4.245 20 0 HIADHN CCc1ccccc1NC(=O)C[C@@H](C)N[C@H](CO)c1ccc(Br)c(F)c1 ZINC000430147566 858053107 /nfs/dbraw/zinc/05/31/07/858053107.db2.gz LQIDVGCCDASMEH-BFUOFWGJSA-N 0 3 423.326 4.191 20 0 HIADHN COC(=O)c1ccccc1CC1CCN(Cc2cnc(-c3ccccn3)s2)CC1 ZINC000430182067 858069940 /nfs/dbraw/zinc/06/99/40/858069940.db2.gz XEXQYFZSJJBQOX-UHFFFAOYSA-N 0 3 407.539 4.446 20 0 HIADHN CCSc1cc(CNC(=O)N(CCN(C)C)Cc2cccc(Cl)c2)ccn1 ZINC000430200848 858078913 /nfs/dbraw/zinc/07/89/13/858078913.db2.gz XUYXHZFRQYXGGL-UHFFFAOYSA-N 0 3 406.983 4.120 20 0 HIADHN Cc1[nH+]ccn1CCCCNC(=O)c1cnc2ccc(Oc3ccccc3)cc2c1[O-] ZINC000430652809 858250249 /nfs/dbraw/zinc/25/02/49/858250249.db2.gz OESAVMWQIGMLIU-UHFFFAOYSA-N 0 3 416.481 4.036 20 0 HIADHN Cc1ccccc1[C@H](N[C@H](C)c1ccc(Br)c(S(N)(=O)=O)c1)C1CC1 ZINC000430725947 858279906 /nfs/dbraw/zinc/27/99/06/858279906.db2.gz YVSCTSABBGYMLL-BFUOFWGJSA-N 0 3 423.376 4.207 20 0 HIADHN CO[C@@H](C)c1nc(CN2CCCN(CCSCc3ccccc3)CC2)cs1 ZINC000430743709 858284896 /nfs/dbraw/zinc/28/48/96/858284896.db2.gz PJYNMFUEYGOMSW-SFHVURJKSA-N 0 3 405.633 4.292 20 0 HIADHN CCN(CC)[C@H](CN1C(=O)CN(Cc2ccc(Cl)cc2)C1=O)c1ccsc1 ZINC000430865957 858344611 /nfs/dbraw/zinc/34/46/11/858344611.db2.gz PHUYEAGUEWWQPF-GOSISDBHSA-N 0 3 405.951 4.249 20 0 HIADHN CCN(CC)[C@@H](CN1C(=O)N[C@H](c2ccc(OC)c(Cl)c2)C1=O)c1ccsc1 ZINC000430870821 858347933 /nfs/dbraw/zinc/34/79/33/858347933.db2.gz VLZUVSNELKDXSF-FUHWJXTLSA-N 0 3 421.950 4.086 20 0 HIADHN CCN(CC)[C@H](CN1C(=O)[C@@H](Cc2ccccc2)N(C2CC2)C1=O)c1ccsc1 ZINC000430874466 858349844 /nfs/dbraw/zinc/34/98/44/858349844.db2.gz DEASDQQIZGJAJF-NHCUHLMSSA-N 0 3 411.571 4.169 20 0 HIADHN CCN(CC)[C@@H](CN1C(=O)[C@@H](Cc2ccccc2)N(C2CC2)C1=O)c1ccsc1 ZINC000430874467 858349924 /nfs/dbraw/zinc/34/99/24/858349924.db2.gz DEASDQQIZGJAJF-RTWAWAEBSA-N 0 3 411.571 4.169 20 0 HIADHN CN(C(=O)[C@H]1CCN(Cc2ccc(OCC(F)(F)F)c(F)c2)C1)c1ccccc1 ZINC000430881002 858352900 /nfs/dbraw/zinc/35/29/00/858352900.db2.gz XFJXRFDEUKRQGG-INIZCTEOSA-N 0 3 410.411 4.252 20 0 HIADHN C[C@@H]1CCN(C(=O)NCc2c(F)cc(F)c(F)c2F)CCN1Cc1ccccc1 ZINC000430935525 858374231 /nfs/dbraw/zinc/37/42/31/858374231.db2.gz QJURIKNJWCIVPC-CQSZACIVSA-N 0 3 409.427 4.049 20 0 HIADHN CC1CCN([C@H](CN2C(=O)CN(Cc3ccc(F)cc3)C2=O)c2cccs2)CC1 ZINC000430944629 858378672 /nfs/dbraw/zinc/37/86/72/858378672.db2.gz NBYUJTJQGDGAOM-LJQANCHMSA-N 0 3 415.534 4.125 20 0 HIADHN CC[C@H](c1ccccc1)N1CC(=O)N(C[C@H](c2cccc(OC)c2)N2CCCC2)C1=O ZINC000430955512 858381355 /nfs/dbraw/zinc/38/13/55/858381355.db2.gz AUGQIFWPFYXELL-DHIUTWEWSA-N 0 3 421.541 4.248 20 0 HIADHN CN(C)[C@H](CN1C(=O)[C@H](c2ccc(Cl)c(Cl)c2)N(C)C1=O)c1ccccc1 ZINC000430970610 858386308 /nfs/dbraw/zinc/38/63/08/858386308.db2.gz HVFACJBMMGSJLP-MSOLQXFVSA-N 0 3 406.313 4.231 20 0 HIADHN O=C1N[C@H](C[C@H]2CCCc3ccccc32)C(=O)N1C[C@H](c1cccs1)N1CCCC1 ZINC000430979102 858390252 /nfs/dbraw/zinc/39/02/52/858390252.db2.gz TUNRGQJEQZZXKN-HMXCVIKNSA-N 0 3 423.582 4.316 20 0 HIADHN CN(C(=O)N[C@H]1CC[C@H](c2ccccc2F)C1)C1CCN(CCc2ccccn2)CC1 ZINC000431058880 858424899 /nfs/dbraw/zinc/42/48/99/858424899.db2.gz AHGVYKPGAOETIC-FPOVZHCZSA-N 0 3 424.564 4.205 20 0 HIADHN CCc1noc(-c2ccc(C)c(NC(=O)NC[C@H](C)N(C)Cc3ccccc3)c2)n1 ZINC000431118916 858455002 /nfs/dbraw/zinc/45/50/02/858455002.db2.gz HFYRXTSFWVXCMP-KRWDZBQOSA-N 0 3 407.518 4.249 20 0 HIADHN C[C@H](c1ccccc1)N1CCC(NS(=O)(=O)Cc2cc(Cl)ccc2F)CC1 ZINC000431276900 858543097 /nfs/dbraw/zinc/54/30/97/858543097.db2.gz SVYFSTKDCUDIAY-OAHLLOKOSA-N 0 3 410.942 4.124 20 0 HIADHN O=C(Cc1c[nH]c2cccc(Cl)c12)NCCCCN1CCN(c2ccccc2)CC1 ZINC000431327593 858567028 /nfs/dbraw/zinc/56/70/28/858567028.db2.gz HYRUNZSIWFPUJP-UHFFFAOYSA-N 0 3 424.976 4.082 20 0 HIADHN O=C(NC[C@H]1CCCN1Cc1ccccc1)N[C@H]1C[C@@H]1c1ccccc1OC(F)F ZINC000437723612 863054262 /nfs/dbraw/zinc/05/42/62/863054262.db2.gz KTBRFGQXIMSXDU-RLLQIKCJSA-N 0 3 415.484 4.108 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)C2(Cc3ccc(F)cc3)CCOCC2)N(C)C)cc1 ZINC000431665648 858724329 /nfs/dbraw/zinc/72/43/29/858724329.db2.gz GFBRFYPTVHWOPJ-HSZRJFAPSA-N 0 3 412.549 4.147 20 0 HIADHN CCC(CC)n1nccc1C(=O)N(CCN(C)C)Cc1ccc(C(F)(F)F)cc1 ZINC000431783865 858810020 /nfs/dbraw/zinc/81/00/20/858810020.db2.gz JUONVXVXXDZIGV-UHFFFAOYSA-N 0 3 410.484 4.467 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)c3c(Cl)cc(F)cc3Cl)CC2)C[C@H](C)O1 ZINC000431832386 858831970 /nfs/dbraw/zinc/83/19/70/858831970.db2.gz GEBFLGVVVDQPLX-KBPBESRZSA-N 0 3 417.352 4.484 20 0 HIADHN C[C@H](NC(=O)[C@H]1CCCCN1C1CCCC1)c1noc(-c2ccc(Cl)cc2)n1 ZINC000431865366 858844792 /nfs/dbraw/zinc/84/47/92/858844792.db2.gz POQTZPRUHSOOSG-KBXCAEBGSA-N 0 3 402.926 4.364 20 0 HIADHN COc1ccc(NC(=O)[C@H]2CCCCN2C2CCCC2)cc1OCc1cccnc1 ZINC000431901893 858862789 /nfs/dbraw/zinc/86/27/89/858862789.db2.gz MWFCTKRSEZJKTF-OAQYLSRUSA-N 0 3 409.530 4.405 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N1CCC[C@H](c2ccccc2)C1 ZINC000431917631 858870512 /nfs/dbraw/zinc/87/05/12/858870512.db2.gz YQDCFZPEAKBVEW-KKXNLOMOSA-N 0 3 409.496 4.381 20 0 HIADHN COc1cnccc1N1CCN(C(=O)Nc2ccccc2COc2ccccc2)CC1 ZINC000431990669 858908244 /nfs/dbraw/zinc/90/82/44/858908244.db2.gz HWGOZKGQINVXGN-UHFFFAOYSA-N 0 3 418.497 4.023 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N[C@@H](c3ccc(F)cc3)C(F)(F)F)cc2)CC1 ZINC000467554862 881378261 /nfs/dbraw/zinc/37/82/61/881378261.db2.gz RJWPFESOPNFZQO-IBGZPJMESA-N 0 3 409.427 4.001 20 0 HIADHN CCOc1cc(CN2CCCO[C@@H](CC)C2)ccc1OCc1ccc(C(=O)OC)o1 ZINC000467566877 881389411 /nfs/dbraw/zinc/38/94/11/881389411.db2.gz XWUBRDJXZICJSM-SFHVURJKSA-N 0 3 417.502 4.045 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)C2(Cc3cccc(F)c3)CCOCC2)C1 ZINC000432881283 859404960 /nfs/dbraw/zinc/40/49/60/859404960.db2.gz QOOQBXLBOYRHTM-CVDCTZTESA-N 0 3 410.533 4.117 20 0 HIADHN C[C@H](SCCN(C)Cc1ccccc1)C(=O)Nc1ccc(N2CCCC2=O)cc1 ZINC000433033391 859491108 /nfs/dbraw/zinc/49/11/08/859491108.db2.gz PLVUUDJMTYBKPT-SFHVURJKSA-N 0 3 411.571 4.006 20 0 HIADHN CN(CCSCC(=O)Nc1ccc(Br)cc1F)Cc1ccccc1 ZINC000433033085 859491193 /nfs/dbraw/zinc/49/11/93/859491193.db2.gz DADHKSMUMSQIDD-UHFFFAOYSA-N 0 3 411.340 4.392 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)NCCC1CC(OC(C)(C)C)C1 ZINC000433045843 859496773 /nfs/dbraw/zinc/49/67/73/859496773.db2.gz NKOMEGPUWWTHNJ-JSRJAPPDSA-N 0 3 401.595 4.276 20 0 HIADHN COc1ccc(-c2nc3c(s2)[C@H](NCc2ccc(NC(C)=O)nc2)CCC3)cc1 ZINC000433097531 859520411 /nfs/dbraw/zinc/52/04/11/859520411.db2.gz NKYYYZPWKPENTI-GOSISDBHSA-N 0 3 408.527 4.339 20 0 HIADHN Cc1cnc(C2CCN(CCC(=O)Nc3c(C)nn(-c4ccccc4)c3C)CC2)s1 ZINC000433161475 859547324 /nfs/dbraw/zinc/54/73/24/859547324.db2.gz JZZGRKVZRASLPA-UHFFFAOYSA-N 0 3 423.586 4.462 20 0 HIADHN Cc1cnc(C2CCN(C[C@@H](O)COc3ccccc3C(F)(F)F)CC2)s1 ZINC000433163758 859548299 /nfs/dbraw/zinc/54/82/99/859548299.db2.gz PIADBZZVAZKLMU-OAHLLOKOSA-N 0 3 400.466 4.090 20 0 HIADHN COc1ccccc1-c1noc(C2CCN(CCC(=O)Nc3ccccc3F)CC2)n1 ZINC000433165070 859549675 /nfs/dbraw/zinc/54/96/75/859549675.db2.gz AZAZGDWZKKOAEJ-UHFFFAOYSA-N 0 3 424.476 4.093 20 0 HIADHN COc1ccc(OCCN2CCC(c3nc(-c4ccccc4OC)no3)CC2)cc1 ZINC000433169865 859551501 /nfs/dbraw/zinc/55/15/01/859551501.db2.gz YTZMSIDBMBZABY-UHFFFAOYSA-N 0 3 409.486 4.012 20 0 HIADHN COc1cc(Br)c(CNCC2(CO)CC(c3ccccc3)C2)cc1OC ZINC000433177066 859555287 /nfs/dbraw/zinc/55/52/87/859555287.db2.gz RUUFEBZPZDHNJL-UHFFFAOYSA-N 0 3 420.347 4.112 20 0 HIADHN CCn1cccc(CNCc2cn(Cc3ccccc3)nc2-c2cccc(C)c2)c1=O ZINC000433182838 859558000 /nfs/dbraw/zinc/55/80/00/859558000.db2.gz PXTPRCLPXPJYGG-UHFFFAOYSA-N 0 3 412.537 4.378 20 0 HIADHN O=C(Nc1cccc(CNC[C@H]2CCCC(=O)N2)c1)c1ccc(Cl)cc1Cl ZINC000433196666 859563100 /nfs/dbraw/zinc/56/31/00/859563100.db2.gz LSNMVIQQFXTFGR-MRXNPFEDSA-N 0 3 406.313 4.004 20 0 HIADHN CN(CCC(=O)Nc1ccc(N2CCCC2=O)cc1)Cc1ccc(F)c(Cl)c1 ZINC000433249265 859590693 /nfs/dbraw/zinc/59/06/93/859590693.db2.gz RNALKTYCGFMZQE-UHFFFAOYSA-N 0 3 403.885 4.067 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2cccc(F)c2Br)N2CCCC2)cc1 ZINC000433249109 859591024 /nfs/dbraw/zinc/59/10/24/859591024.db2.gz VNMVGSSIAUEJTG-SFHVURJKSA-N 0 3 405.311 4.464 20 0 HIADHN COc1ccc(-c2cncc(C(=O)N(Cc3ccccc3)C3CCN(C)CC3)c2)cc1 ZINC000467646235 881441448 /nfs/dbraw/zinc/44/14/48/881441448.db2.gz JUCYWYXYXJYFRJ-UHFFFAOYSA-N 0 3 415.537 4.494 20 0 HIADHN C[C@H](NCCNC(=O)CC1CCCC1)c1ccc(OC[C@@H]2CCCCO2)c(F)c1 ZINC000433369867 859661864 /nfs/dbraw/zinc/66/18/64/859661864.db2.gz ANYVRDUKKQYXCS-PXNSSMCTSA-N 0 3 406.542 4.121 20 0 HIADHN C[C@@H](NCc1ccc(NC(N)=O)cc1)c1ccc(OC[C@@H]2CCCCO2)c(F)c1 ZINC000433395541 859674731 /nfs/dbraw/zinc/67/47/31/859674731.db2.gz ABWDDLDSCDCIAW-BEFAXECRSA-N 0 3 401.482 4.115 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Nc1cc(-c2ccc(F)cc2F)nn1C ZINC000433403759 859680511 /nfs/dbraw/zinc/68/05/11/859680511.db2.gz QWTVXFZRQWQDCZ-UHFFFAOYSA-N 0 3 419.501 4.023 20 0 HIADHN O=C(NCc1ccccc1)[C@H](N[C@H]1CCOC2(CCSCC2)C1)c1ccccc1 ZINC000433460959 859713755 /nfs/dbraw/zinc/71/37/55/859713755.db2.gz COBRVEMJDFETBF-FCHUYYIVSA-N 0 3 410.583 4.079 20 0 HIADHN CCNC(=O)N(C)c1cccc(NC(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)c1 ZINC000433477770 859720924 /nfs/dbraw/zinc/72/09/24/859720924.db2.gz NSYSMQXSTYUMLC-QFIPXVFZSA-N 0 3 423.561 4.119 20 0 HIADHN C[C@@H](NC(=O)NC[C@H]1CCCCN1C1CC1)c1cccc(OCc2ccccn2)c1 ZINC000433553298 859772717 /nfs/dbraw/zinc/77/27/17/859772717.db2.gz DYNFYIQSMLXQDP-XMSQKQJNSA-N 0 3 408.546 4.038 20 0 HIADHN CCNC(=O)Nc1cccc(NC(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)c1C ZINC000433744654 859871233 /nfs/dbraw/zinc/87/12/33/859871233.db2.gz LQILZVJEMHSFBL-PKOBYXMFSA-N 0 3 409.534 4.093 20 0 HIADHN CCNC(=O)Nc1cccc(NC(=O)N(Cc2ccccc2)C2CCN(C)CC2)c1C ZINC000433754771 859877278 /nfs/dbraw/zinc/87/72/78/859877278.db2.gz ZAFREPWOXBTUAD-UHFFFAOYSA-N 0 3 423.561 4.265 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)Nc1ccccc1CN(C)c1ccccc1 ZINC000433772799 859886555 /nfs/dbraw/zinc/88/65/55/859886555.db2.gz ZLRDZEMYVYOIRL-UHFFFAOYSA-N 0 3 417.557 4.314 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)Nc1c2c(ccc1Cl)OCC2 ZINC000433784545 859891678 /nfs/dbraw/zinc/89/16/78/859891678.db2.gz DNZUQLVGJUEWTR-UHFFFAOYSA-N 0 3 401.938 4.303 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)Nc2ccc(F)cc2-c2cnn(C)c2)CN1Cc1ccccc1 ZINC000433803523 859900489 /nfs/dbraw/zinc/90/04/89/859900489.db2.gz UPZSFMUQFQQPQK-OXJNMPFZSA-N 0 3 407.493 4.011 20 0 HIADHN CC(C)(C)OC(=O)CCC(=O)N[C@@H](c1ccc(F)c(F)c1)C(C)(C)N1CCCC1 ZINC000433870508 859944488 /nfs/dbraw/zinc/94/44/88/859944488.db2.gz QYFUCCXSSUWOTL-FQEVSTJZSA-N 0 3 410.505 4.118 20 0 HIADHN CC(C)n1ncc2c1nc(C1CC1)cc2C(=O)N[C@H]1C[C@H](C)N(Cc2ccccc2)C1 ZINC000467690540 881483082 /nfs/dbraw/zinc/48/30/82/881483082.db2.gz GNPCXJCBELVTLD-PXNSSMCTSA-N 0 3 417.557 4.282 20 0 HIADHN Cc1c(NC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)noc1-c1ccccc1F ZINC000433915553 859968021 /nfs/dbraw/zinc/96/80/21/859968021.db2.gz QQTWAORMFHTEEG-KRWDZBQOSA-N 0 3 422.504 4.917 20 0 HIADHN C[C@@H](NC(=O)NC[C@H]1CCCCN1C1CC1)c1cccc(NC(=O)c2ccccc2)c1 ZINC000433940184 859988638 /nfs/dbraw/zinc/98/86/38/859988638.db2.gz KDTYMPDCINCUFM-WZONZLPQSA-N 0 3 420.557 4.316 20 0 HIADHN CN(C(=O)c1ccc(-c2nc(C3CC3)no2)cc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000433971774 860010138 /nfs/dbraw/zinc/01/01/38/860010138.db2.gz KDEQWCBJFOWQHG-QFIPXVFZSA-N 0 3 416.525 4.351 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)N(CCCO)Cc1cccc(Cl)c1 ZINC000434076068 860085335 /nfs/dbraw/zinc/08/53/35/860085335.db2.gz VEFKJWIOVMYTJZ-QFIPXVFZSA-N 0 3 415.965 4.071 20 0 HIADHN CCCN(C(=O)c1ccc(NC(C)=O)c(F)c1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000434114676 860117106 /nfs/dbraw/zinc/11/71/06/860117106.db2.gz NRRLSEOYHMENAM-NRFANRHFSA-N 0 3 411.521 4.301 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)c1ccc(-c2nc(C3CC3)no2)cc1 ZINC000434118206 860119709 /nfs/dbraw/zinc/11/97/09/860119709.db2.gz AAQVBWVHUIIJSS-NRFANRHFSA-N 0 3 402.498 4.008 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)Nc1cccc2c1CCO2 ZINC000434150841 860146998 /nfs/dbraw/zinc/14/69/98/860146998.db2.gz OIFHVTPWQHKJJI-UHFFFAOYSA-N 0 3 407.436 4.236 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)NC[C@H]2CCCN(c3ccccc3)C2)C1 ZINC000434263791 860239833 /nfs/dbraw/zinc/23/98/33/860239833.db2.gz KODZPAXHGKQTHY-XPNTWCBSSA-N 0 3 406.574 4.038 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)C[C@H](C)c1cccnc1 ZINC000434315601 860275601 /nfs/dbraw/zinc/27/56/01/860275601.db2.gz CZWDPKXJNGTMAB-PGRDOPGGSA-N 0 3 403.530 4.166 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1ccc2ccccc2n1 ZINC000434334817 860296021 /nfs/dbraw/zinc/29/60/21/860296021.db2.gz SKNSDYRYYCWPME-NRFANRHFSA-N 0 3 411.509 4.439 20 0 HIADHN CCCNc1ccc(CNC(=O)NC[C@H](c2cccc(OC)c2)N2CCCC2)cc1 ZINC000434458806 860360240 /nfs/dbraw/zinc/36/02/40/860360240.db2.gz HNZMKSVHWZMRBS-HSZRJFAPSA-N 0 3 410.562 4.153 20 0 HIADHN COCCN(C)CCOc1cccc(CNC(=O)Nc2c(Cl)ccc(C)c2C)c1 ZINC000434489666 860370640 /nfs/dbraw/zinc/37/06/40/860370640.db2.gz UEMDJMVUWWKTDS-UHFFFAOYSA-N 0 3 419.953 4.236 20 0 HIADHN COc1ccc(CN2CC[C@H](n3c(C)nc4c3CCCC4)C2)cc1Br ZINC000434495416 860373317 /nfs/dbraw/zinc/37/33/17/860373317.db2.gz VQDOFBYOJBSJJJ-INIZCTEOSA-N 0 3 404.352 4.288 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)NC[C@@H]2CCCN(c3ccccc3)C2)CC1 ZINC000434507478 860379402 /nfs/dbraw/zinc/37/94/02/860379402.db2.gz ZQQYLQFSSMFYDT-QHCPKHFHSA-N 0 3 420.601 4.209 20 0 HIADHN COc1ccc(-c2noc([C@H](C)N3CCC(c4ncc5n4CCCC5)CC3)n2)cc1 ZINC000434672051 860453899 /nfs/dbraw/zinc/45/38/99/860453899.db2.gz LHZCNBKOSRKGCU-INIZCTEOSA-N 0 3 407.518 4.219 20 0 HIADHN C[C@H](NC(=O)[C@H](C)N1CCC(c2ncc3n2CCCC3)CC1)c1cc2ccccc2o1 ZINC000434685071 860459571 /nfs/dbraw/zinc/45/95/71/860459571.db2.gz MGCYMKRDZUKIEF-ROUUACIJSA-N 0 3 420.557 4.411 20 0 HIADHN C[C@@H](C(=O)N1c2ccccc2CC[C@H]1C)N1CCC(c2ncc3n2CCCC3)CC1 ZINC000434686903 860460305 /nfs/dbraw/zinc/46/03/05/860460305.db2.gz BKJGUVYQYSOQAB-MOPGFXCFSA-N 0 3 406.574 4.155 20 0 HIADHN C[C@@H](NC(=O)CN1CCC(c2ncc3n2CCCC3)CC1)c1ccc2ccccc2c1 ZINC000434688675 860461672 /nfs/dbraw/zinc/46/16/72/860461672.db2.gz ORCVBJJEWUTTLW-LJQANCHMSA-N 0 3 416.569 4.429 20 0 HIADHN CCCNc1ccc(CNCc2ccc(Br)cc2N2CCOCC2)cc1 ZINC000434762046 860485176 /nfs/dbraw/zinc/48/51/76/860485176.db2.gz FRHZIZAGADWFMX-UHFFFAOYSA-N 0 3 418.379 4.397 20 0 HIADHN Cc1nc(-c2cccc(Cl)c2)sc1C(=O)NCCCCN1C[C@H](C)O[C@@H](C)C1 ZINC000434782522 860493658 /nfs/dbraw/zinc/49/36/58/860493658.db2.gz DMFUXFQFESYZQG-GJZGRUSLSA-N 0 3 421.994 4.391 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)NCc1cc(F)c(Cl)cc1F ZINC000434858859 860526160 /nfs/dbraw/zinc/52/61/60/860526160.db2.gz BSZVPHDYBPOQKK-UHFFFAOYSA-N 0 3 417.834 4.170 20 0 HIADHN C[C@H]1[C@@H](c2ccccc2)CCN1CC(=O)Nc1cccc(CN2CCSCC2)c1 ZINC000434897597 860542129 /nfs/dbraw/zinc/54/21/29/860542129.db2.gz XAFHRNJJXBRJNR-CVDCTZTESA-N 0 3 409.599 4.052 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CNC(=O)CN1CC[C@H](c2ccccc2)[C@@H]1C ZINC000434898225 860543261 /nfs/dbraw/zinc/54/32/61/860543261.db2.gz UKDYCXRULURKJR-RDPSFJRHSA-N 0 3 416.569 4.042 20 0 HIADHN CN(C)CCN(CC1CCCCC1)C(=O)c1ccc(NC(=O)N(C)C)cc1Cl ZINC000435021778 860602746 /nfs/dbraw/zinc/60/27/46/860602746.db2.gz RWYSLRKBSOKOTG-UHFFFAOYSA-N 0 3 408.974 4.018 20 0 HIADHN Brc1cccc(NC2CCN(Cc3c[nH]nc3-c3cccnc3)CC2)c1 ZINC000435035043 860609705 /nfs/dbraw/zinc/60/97/05/860609705.db2.gz OQVMVGYGKFOMAB-UHFFFAOYSA-N 0 3 412.335 4.311 20 0 HIADHN CN(CCN1CCOC(C)(C)C1)Cc1cccc(NC(=O)c2ccccc2Cl)c1 ZINC000435057041 860619003 /nfs/dbraw/zinc/61/90/03/860619003.db2.gz ARLXFNRONKVVHK-UHFFFAOYSA-N 0 3 415.965 4.135 20 0 HIADHN CC(C)c1cc(C(=O)N(Cc2ccco2)C2CCN(C)CC2)nn1-c1ccccc1 ZINC000435148604 860666281 /nfs/dbraw/zinc/66/62/81/860666281.db2.gz PEIMVGBVQSSSKO-UHFFFAOYSA-N 0 3 406.530 4.325 20 0 HIADHN Cc1cc(NC(=O)CSCCC(C)C)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435269510 860709193 /nfs/dbraw/zinc/70/91/93/860709193.db2.gz RSVLXUWTPPLTSH-FQEVSTJZSA-N 0 3 400.592 4.356 20 0 HIADHN CC[C@H](OC1CCCC1)C(=O)Nc1cc(C)nn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435268655 860709573 /nfs/dbraw/zinc/70/95/73/860709573.db2.gz PFNMBVASXHWSJL-UNMCSNQZSA-N 0 3 410.562 4.315 20 0 HIADHN Cc1cc(NC(=O)c2c(C)noc2C(C)C)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435275816 860713288 /nfs/dbraw/zinc/71/32/88/860713288.db2.gz VKFAAKVYGWSACL-LJQANCHMSA-N 0 3 407.518 4.311 20 0 HIADHN Cc1cc(NC(=O)[C@H]2Cc3ccccc3S2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435277317 860713930 /nfs/dbraw/zinc/71/39/30/860713930.db2.gz BGMIEZLVXMFSMI-RBBKRZOGSA-N 0 3 418.566 4.294 20 0 HIADHN Cc1cc(NC(=O)C2(c3ccccc3F)CC2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435277066 860714578 /nfs/dbraw/zinc/71/45/78/860714578.db2.gz AGVVGWQGUJHFNF-HXUWFJFHSA-N 0 3 418.516 4.448 20 0 HIADHN Cc1cc(NC(=O)[C@H](C)Oc2ccc(C)cc2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435278411 860714860 /nfs/dbraw/zinc/71/48/60/860714860.db2.gz FXGGLXSZMALAKQ-UNMCSNQZSA-N 0 3 418.541 4.353 20 0 HIADHN CC(=O)c1ccc(CC(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000435284969 860719260 /nfs/dbraw/zinc/71/92/60/860719260.db2.gz MMBKRBJXARRNGB-HSZRJFAPSA-N 0 3 416.525 4.022 20 0 HIADHN Cc1cc(NC(=O)c2ccc(C(C)C)nc2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435287723 860719781 /nfs/dbraw/zinc/71/97/81/860719781.db2.gz APTYKRFMVSACHM-NRFANRHFSA-N 0 3 403.530 4.409 20 0 HIADHN Cc1cc(NC(=O)CCO[C@H](C)CC(C)C)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435286758 860720094 /nfs/dbraw/zinc/72/00/94/860720094.db2.gz DNWBEWKVFBLECT-IRLDBZIGSA-N 0 3 412.578 4.418 20 0 HIADHN Cc1cc(NC(=O)[C@@H](C)Oc2cccc(F)c2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435292782 860722104 /nfs/dbraw/zinc/72/21/04/860722104.db2.gz ZXBYQINKFWWBSA-NQIIRXRSSA-N 0 3 422.504 4.184 20 0 HIADHN Cc1ccc(OCCC(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)c(C)c1 ZINC000435368421 860766310 /nfs/dbraw/zinc/76/63/10/860766310.db2.gz HXPUOHNEMXGZHZ-JOCHJYFZSA-N 0 3 418.541 4.355 20 0 HIADHN CC(C)Oc1cccc(CC(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000435372815 860770357 /nfs/dbraw/zinc/77/03/57/860770357.db2.gz KYRKADUIEPEQRH-JOCHJYFZSA-N 0 3 418.541 4.299 20 0 HIADHN C[C@@H](Sc1ccccc1)C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435374097 860771831 /nfs/dbraw/zinc/77/18/31/860771831.db2.gz WGQDNRVYRNYFSS-QUCCMNQESA-N 0 3 406.555 4.449 20 0 HIADHN CC(C)(C)c1nc(C(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)cs1 ZINC000435375445 860772703 /nfs/dbraw/zinc/77/27/03/860772703.db2.gz VGFOHDLNHCQKRF-KRWDZBQOSA-N 0 3 409.559 4.336 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)[C@@H]1C[C@H]1c1cc(F)ccc1F ZINC000435378136 860774703 /nfs/dbraw/zinc/77/47/03/860774703.db2.gz CDDKUFVRSCSMCF-SVFBPWRDSA-N 0 3 422.479 4.351 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)[C@H]1C[C@]12CCc1ccccc12 ZINC000435377970 860775027 /nfs/dbraw/zinc/77/50/27/860775027.db2.gz BQGHLKUCRLAOFE-HNVPCBRESA-N 0 3 412.537 4.173 20 0 HIADHN CC[C@H](Oc1cccc(C)c1)C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435382036 860778084 /nfs/dbraw/zinc/77/80/84/860778084.db2.gz XETOEGXKUIXIOH-GMAHTHKFSA-N 0 3 418.541 4.435 20 0 HIADHN COc1cccc([C@@H](C)CC(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000435381606 860778176 /nfs/dbraw/zinc/77/81/76/860778176.db2.gz UXOCIDIAPDJXOA-SIKLNZKXSA-N 0 3 418.541 4.471 20 0 HIADHN CC(C)[C@@H](C(=O)NC1CCN(CCOc2ccc(Cl)cc2)CC1)c1cccnc1 ZINC000435456825 860805482 /nfs/dbraw/zinc/80/54/82/860805482.db2.gz IGLOYWLYUAOENQ-JOCHJYFZSA-N 0 3 415.965 4.134 20 0 HIADHN Cc1cc(NC(=O)N(C)C(C2CC2)C2CC2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435513780 860833093 /nfs/dbraw/zinc/83/30/93/860833093.db2.gz KSEZWWPZKFBVGF-OAQYLSRUSA-N 0 3 407.562 4.291 20 0 HIADHN Cc1cc(NC(=O)N(C)C(C2CC2)C2CC2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435513779 860833244 /nfs/dbraw/zinc/83/32/44/860833244.db2.gz KSEZWWPZKFBVGF-NRFANRHFSA-N 0 3 407.562 4.291 20 0 HIADHN Cc1cc(NC(=O)N[C@H](C)Cc2cccs2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435518084 860836331 /nfs/dbraw/zinc/83/63/31/860836331.db2.gz SHDMCBCPMXBZPR-XLIONFOSSA-N 0 3 423.586 4.453 20 0 HIADHN Cc1cc(NC(=O)N[C@H]2CCc3ccccc32)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435526827 860843775 /nfs/dbraw/zinc/84/37/75/860843775.db2.gz JRHYOKBOMFZNQL-GGAORHGYSA-N 0 3 415.541 4.448 20 0 HIADHN Cc1cc(NC(=O)NCc2sccc2C)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435529593 860845895 /nfs/dbraw/zinc/84/58/95/860845895.db2.gz GLEMATZYAPHDIV-IBGZPJMESA-N 0 3 409.559 4.330 20 0 HIADHN Cc1c(NC(=O)NC[C@H](c2cccs2)N2CCCC2)cnn1-c1ccccc1F ZINC000435545111 860859617 /nfs/dbraw/zinc/85/96/17/860859617.db2.gz UQLWEJVTRHLANV-LJQANCHMSA-N 0 3 413.522 4.340 20 0 HIADHN COc1ccc([C@@H](CNC(=O)Nc2cnn(-c3ccccc3)c2C)N2CCCC2)cc1 ZINC000435547580 860862967 /nfs/dbraw/zinc/86/29/67/860862967.db2.gz HLMDYOUTCAZFJO-HSZRJFAPSA-N 0 3 419.529 4.148 20 0 HIADHN Cc1c(NC(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)cnn1-c1ccccc1F ZINC000435555792 860874091 /nfs/dbraw/zinc/87/40/91/860874091.db2.gz ZKUVFIMYWDEOKI-SFHVURJKSA-N 0 3 421.520 4.448 20 0 HIADHN CC(C)c1nn(-c2ccc(Br)cc2)cc1CNCC1([S@](C)=O)CCC1 ZINC000435727026 861010776 /nfs/dbraw/zinc/01/07/76/861010776.db2.gz CKQOGICGPFFGHJ-VWLOTQADSA-N 0 3 424.408 4.149 20 0 HIADHN COc1ccc(-c2ncc(C(=O)N(CCN(C)C)c3ccccc3)s2)cc1OC ZINC000435762425 861041617 /nfs/dbraw/zinc/04/16/17/861041617.db2.gz SKCDIKXFKXXIGB-UHFFFAOYSA-N 0 3 411.527 4.036 20 0 HIADHN O=C(Nc1ccc(F)cc1)[C@@H](N[C@H]1CC[C@@H](C(=O)N2CCCCC2)C1)c1ccccc1 ZINC000435784313 861058658 /nfs/dbraw/zinc/05/86/58/861058658.db2.gz CIWMJSYXIHGLQX-OIBXWCBGSA-N 0 3 423.532 4.276 20 0 HIADHN CN(c1ccccc1)c1ccc(CNCc2ccc(CN3CCCC3=O)cc2)cn1 ZINC000435792935 861064593 /nfs/dbraw/zinc/06/45/93/861064593.db2.gz XRTNLWROTIMJDO-UHFFFAOYSA-N 0 3 400.526 4.262 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)c1cc(Cl)cc(Br)c1F ZINC000435820636 861085417 /nfs/dbraw/zinc/08/54/17/861085417.db2.gz YHRRHZCHXHRCRY-UHFFFAOYSA-N 0 3 403.679 4.039 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@H](C)N[C@@H](C)c2ccc(Br)cc2)cc1F ZINC000435904780 861162873 /nfs/dbraw/zinc/16/28/73/861162873.db2.gz ZGXMJFOIFRWDHB-KBPBESRZSA-N 0 3 423.326 4.295 20 0 HIADHN CN(C(=O)c1ccc(Cl)cc1)c1ccc(NC(=O)N2CC[C@H](N3CC=CC3)C2)cc1 ZINC000437837261 863191692 /nfs/dbraw/zinc/19/16/92/863191692.db2.gz RLCDJWMNMDTPTL-NRFANRHFSA-N 0 3 424.932 4.095 20 0 HIADHN CCN(Cc1cccc(NC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)c1)C(C)=O ZINC000437915364 863292550 /nfs/dbraw/zinc/29/25/50/863292550.db2.gz MKAYAGXWDUYZOE-FQEVSTJZSA-N 0 3 422.573 4.183 20 0 HIADHN Cc1cccc2c(CCNC(=O)Nc3ccc(CCN4CCSCC4)cc3)c[nH]c21 ZINC000438106590 863519849 /nfs/dbraw/zinc/51/98/49/863519849.db2.gz UFKCJJYFKNTMJO-UHFFFAOYSA-N 0 3 422.598 4.432 20 0 HIADHN CC(=O)Nc1ccc(C)c(C(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)c1 ZINC000467835212 881669134 /nfs/dbraw/zinc/66/91/34/881669134.db2.gz PRGQZFFCVQOGFO-UHFFFAOYSA-N 0 3 421.463 4.176 20 0 HIADHN O=C(Nc1cc2c(cc1Sc1ccccc1)OCCO2)N1CC[C@H](N2CC=CC2)C1 ZINC000438127258 863547829 /nfs/dbraw/zinc/54/78/29/863547829.db2.gz CXUQGEPRWOVLIY-KRWDZBQOSA-N 0 3 423.538 4.087 20 0 HIADHN CCOc1cccc2[nH]cc(CC(=O)NC[C@H](c3ccc(C)cc3)N3CCCC3)c21 ZINC000467840504 881677860 /nfs/dbraw/zinc/67/78/60/881677860.db2.gz HXFXLZWSLDZWTN-JOCHJYFZSA-N 0 3 405.542 4.371 20 0 HIADHN CC(=O)N1CCCc2cc(NC(=O)N3CC[C@H](C)N(Cc4ccccc4)CC3)ccc21 ZINC000438193691 863620749 /nfs/dbraw/zinc/62/07/49/863620749.db2.gz UQGJSWNJCLZMHS-IBGZPJMESA-N 0 3 420.557 4.114 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)Nc2cccc(Cl)c2SC(C)C)CC1 ZINC000438269651 863737547 /nfs/dbraw/zinc/73/75/47/863737547.db2.gz KZMJILCOKQXBNN-INIZCTEOSA-N 0 3 413.031 4.236 20 0 HIADHN CCCn1ccc2ccc(NC(=O)N3CCC(CN4C[C@H](C)O[C@@H](C)C4)CC3)cc21 ZINC000438282642 863754948 /nfs/dbraw/zinc/75/49/48/863754948.db2.gz NJJYSXNUNOXHPX-OALUTQOASA-N 0 3 412.578 4.404 20 0 HIADHN Cc1ccc(SCC(F)(F)F)c(NC(=O)N(CCN(C)C)C[C@@H]2CCCO2)c1 ZINC000438316961 863796244 /nfs/dbraw/zinc/79/62/44/863796244.db2.gz XKJBBKMCSXDDHE-HNNXBMFYSA-N 0 3 419.513 4.224 20 0 HIADHN CN(C)CCN(C[C@H]1CCCO1)C(=O)Nc1cccc(Cl)c1SCC(F)F ZINC000438332215 863807919 /nfs/dbraw/zinc/80/79/19/863807919.db2.gz CPENUOQLLLFMHZ-CYBMUJFWSA-N 0 3 421.941 4.272 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)Nc2ccccc2C(=O)N2CCCC2)CC1 ZINC000438339045 863812249 /nfs/dbraw/zinc/81/22/49/863812249.db2.gz GHFPDVPJIZRFNF-UHFFFAOYSA-N 0 3 420.557 4.051 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)N[C@@H]2C[C@H]2c2c(F)cccc2Cl)CC1 ZINC000438354990 863821948 /nfs/dbraw/zinc/82/19/48/863821948.db2.gz HEHXCSKXWLVIOM-VQIMIIECSA-N 0 3 405.901 4.234 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)Nc3c(F)cccc3Br)cc2)CC1 ZINC000438420978 863858526 /nfs/dbraw/zinc/85/85/26/863858526.db2.gz TYHOZVRLNCILCS-UHFFFAOYSA-N 0 3 420.326 4.371 20 0 HIADHN CC[C@@H](CNC(=O)Nc1ccc(C(C)(C)C(=O)OC)cc1)N1CCc2ccccc2C1 ZINC000438443352 863869409 /nfs/dbraw/zinc/86/94/09/863869409.db2.gz DYZORPFVEFTYOZ-QFIPXVFZSA-N 0 3 423.557 4.096 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)[C@H]1C[C@H]1c1cccc(Br)c1 ZINC000438462292 863885433 /nfs/dbraw/zinc/88/54/33/863885433.db2.gz SSYGYMBHWYEAOX-ROUUACIJSA-N 0 3 407.377 4.205 20 0 HIADHN CC(C)c1cc(C(=O)N(CCN(C)C)Cc2cccs2)c2cnn(C(C)C)c2n1 ZINC000438472075 863890488 /nfs/dbraw/zinc/89/04/88/863890488.db2.gz NSSKKOJZQZAXKY-UHFFFAOYSA-N 0 3 413.591 4.401 20 0 HIADHN CCCc1ccc(-c2ccc(NC(=O)NC[C@H](C)CN3CCN(C)CC3)cc2)cc1 ZINC000438475672 863894103 /nfs/dbraw/zinc/89/41/03/863894103.db2.gz CPYMKSLQCOOIJC-FQEVSTJZSA-N 0 3 408.590 4.311 20 0 HIADHN CC[C@H]1CCN(CC(=O)NC[C@H](c2c[nH]c3ccccc32)c2ccc(OC)cc2)C1 ZINC000438508669 863932871 /nfs/dbraw/zinc/93/28/71/863932871.db2.gz MVHPGKGTNKOOSY-AVRDEDQJSA-N 0 3 405.542 4.157 20 0 HIADHN Cc1cc(C(=O)N(CCN(C)C)Cc2cccs2)ccc1NC(=O)CC(C)C ZINC000438532723 863959311 /nfs/dbraw/zinc/95/93/11/863959311.db2.gz KGQAKJDXGHQWAI-UHFFFAOYSA-N 0 3 401.576 4.245 20 0 HIADHN C[C@H](SCC(=O)N(CCN(C)C)Cc1cccs1)c1nc2ccccc2[nH]1 ZINC000438542002 863970664 /nfs/dbraw/zinc/97/06/64/863970664.db2.gz UJBFEGJJDUJCLI-HNNXBMFYSA-N 0 3 402.589 4.009 20 0 HIADHN CCOc1ccc(OCCCC(=O)N(Cc2ccccc2)C2CCN(C)CC2)cc1 ZINC000438554623 863985449 /nfs/dbraw/zinc/98/54/49/863985449.db2.gz VDXXMWBBOAOIJC-UHFFFAOYSA-N 0 3 410.558 4.367 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3cccc(CC(F)(F)F)c3)CC2)C[C@@H](C)O1 ZINC000438571661 864005853 /nfs/dbraw/zinc/00/58/53/864005853.db2.gz ZUBMNWLXANTIBB-HZPDHXFCSA-N 0 3 413.484 4.145 20 0 HIADHN COc1ccc(NC(=O)N(CCN(C)C)Cc2cccs2)c(Br)c1 ZINC000438586268 864016478 /nfs/dbraw/zinc/01/64/78/864016478.db2.gz IXUKPCMPULESCY-UHFFFAOYSA-N 0 3 412.353 4.115 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)Nc1ccc(F)c(Br)c1 ZINC000438586853 864017363 /nfs/dbraw/zinc/01/73/63/864017363.db2.gz KRHKFHQLBJPBOX-UHFFFAOYSA-N 0 3 406.299 4.158 20 0 HIADHN COc1ccc2cc(NC(=O)N(Cc3ccccc3)C3CCN(C)CC3)ccc2n1 ZINC000438599739 864026894 /nfs/dbraw/zinc/02/68/94/864026894.db2.gz MOCVYEMELLPHJH-UHFFFAOYSA-N 0 3 404.514 4.372 20 0 HIADHN CCN(C(=O)C(=O)Nc1ccc(SC)cc1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000438656490 864099673 /nfs/dbraw/zinc/09/96/73/864099673.db2.gz PTCSCLSVSIPATM-PXNSSMCTSA-N 0 3 411.571 4.031 20 0 HIADHN CCCOc1ccccc1NC(=O)C(=O)N(CC)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000438656523 864100512 /nfs/dbraw/zinc/10/05/12/864100512.db2.gz OMHIBVSUOOOOPZ-CTNGQTDRSA-N 0 3 423.557 4.098 20 0 HIADHN CCN(C(=O)C(=O)Nc1cc(Cl)ccc1F)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000438661845 864111324 /nfs/dbraw/zinc/11/13/24/864111324.db2.gz VAYMXMWQAYSBAL-QAPCUYQASA-N 0 3 417.912 4.102 20 0 HIADHN CCN(C(=O)C(=O)Nc1ccccc1OC(C)C)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000438664791 864115902 /nfs/dbraw/zinc/11/59/02/864115902.db2.gz JWBFEOBTUQHREN-FPOVZHCZSA-N 0 3 423.557 4.096 20 0 HIADHN CCN(C(=O)C(=O)Nc1ccc(OC(C)C)cc1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000438668626 864127752 /nfs/dbraw/zinc/12/77/52/864127752.db2.gz YSDPUSKYBOERDW-SIKLNZKXSA-N 0 3 423.557 4.096 20 0 HIADHN CCN(Cc1cccc(NC(=O)N(Cc2ccccc2)C2CCN(C)CC2)c1)C(C)=O ZINC000438691159 864158911 /nfs/dbraw/zinc/15/89/11/864158911.db2.gz DLLBOIGXETWPBN-UHFFFAOYSA-N 0 3 422.573 4.183 20 0 HIADHN C[C@H]1CCC[C@@H](OCc2cccc(NC(=O)C(=O)Nc3cccc(CN(C)C)c3)c2)C1 ZINC000438713197 864194553 /nfs/dbraw/zinc/19/45/53/864194553.db2.gz GCKPXJLUNAQPKE-FDDCHVKYSA-N 0 3 423.557 4.421 20 0 HIADHN COc1cc2c(cc1OC)[C@H](c1ccccc1)N(CCC(=O)N1CCC[C@H]1C)CC2 ZINC000438790640 864283118 /nfs/dbraw/zinc/28/31/18/864283118.db2.gz LIPMNKVNTWRMOI-CJAUYULYSA-N 0 3 408.542 4.052 20 0 HIADHN CC[C@@H](C)[C@@H]1CN(Cc2ccc(C)nc2)CCN1C(=O)Nc1cccc(CN(C)C)c1 ZINC000439074683 864527534 /nfs/dbraw/zinc/52/75/34/864527534.db2.gz YQKHTHQCDRNLRY-DVECYGJZSA-N 0 3 423.605 4.216 20 0 HIADHN COC(=O)COc1cccc(CN[C@H](c2ccc(Br)s2)C2CC2)c1 ZINC000439139331 864572313 /nfs/dbraw/zinc/57/23/13/864572313.db2.gz YFAQEYAIQASMGO-SFHVURJKSA-N 0 3 410.333 4.303 20 0 HIADHN CCN(C[C@@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)c1ccc(C)cc1Cl ZINC000439223889 864640680 /nfs/dbraw/zinc/64/06/80/864640680.db2.gz NDOVNJTZDFSBNV-LJQANCHMSA-N 0 3 406.979 4.181 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)[C@H](CC)OC3CCCC3)c(OCC)c2)CC1 ZINC000439286653 864705087 /nfs/dbraw/zinc/70/50/87/864705087.db2.gz NMTWIVVRPGGFDZ-QFIPXVFZSA-N 0 3 417.594 4.294 20 0 HIADHN Cn1cc(-c2cc(CN3CCC(c4cccc(Br)c4)CC3)on2)cn1 ZINC000439318215 864754425 /nfs/dbraw/zinc/75/44/25/864754425.db2.gz MCYRKGRAQJNUQB-UHFFFAOYSA-N 0 3 401.308 4.217 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)NCc1ccc(Oc2ccccc2)nc1 ZINC000439334300 864772710 /nfs/dbraw/zinc/77/27/10/864772710.db2.gz ZNPXCXJURTZZIF-UHFFFAOYSA-N 0 3 410.543 4.209 20 0 HIADHN CSc1ccc([C@@H](C)NCC(=O)Nc2cccc(CN3CCSCC3)c2)cc1 ZINC000439483535 864847834 /nfs/dbraw/zinc/84/78/34/864847834.db2.gz LBCBGISRXNSSOP-QGZVFWFLSA-N 0 3 415.628 4.247 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)NC[C@@H]2CCC[C@H](C(F)(F)F)C2)CC1 ZINC000439580982 864903150 /nfs/dbraw/zinc/90/31/50/864903150.db2.gz KVMXKVMPPJCUNS-CVEARBPZSA-N 0 3 401.473 4.254 20 0 HIADHN CN(Cc1ccco1)Cc1ccccc1CN[C@@H]1CCCN(c2cccc(F)c2)C1=O ZINC000439599149 864919768 /nfs/dbraw/zinc/91/97/68/864919768.db2.gz ROFJLVWSAFXBML-XMMPIXPASA-N 0 3 421.516 4.336 20 0 HIADHN C[C@H](NCc1ccccc1CN(C)Cc1ccco1)C(=O)Nc1c(F)cccc1F ZINC000439597276 864921351 /nfs/dbraw/zinc/92/13/51/864921351.db2.gz NRKBGHHMIJULRY-INIZCTEOSA-N 0 3 413.468 4.307 20 0 HIADHN C[C@@H](NCc1ccccc1CN(C)Cc1ccco1)C(=O)N1CCc2sccc2C1 ZINC000439600190 864923865 /nfs/dbraw/zinc/92/38/65/864923865.db2.gz YAMRNSDSAPXXTN-GOSISDBHSA-N 0 3 423.582 4.036 20 0 HIADHN Cc1ccc(F)cc1NC(=O)[C@@H](C)NCc1ccccc1CN(C)Cc1ccco1 ZINC000439608688 864930209 /nfs/dbraw/zinc/93/02/09/864930209.db2.gz BABPMSYVXKQKFH-GOSISDBHSA-N 0 3 409.505 4.476 20 0 HIADHN CC(C)N(CCN(C)C)C(=O)c1ccc(Oc2cccc(Br)c2)nc1 ZINC000439619009 864943489 /nfs/dbraw/zinc/94/34/89/864943489.db2.gz PVYFWZHSSMZSPQ-UHFFFAOYSA-N 0 3 406.324 4.049 20 0 HIADHN C[C@H](NC(=O)N(Cc1ccccc1)C1CCN(C)CC1)[C@@H]1Oc2ccccc2[C@@H]1C ZINC000439635061 864960429 /nfs/dbraw/zinc/96/04/29/864960429.db2.gz RODHEKDKFPVPGX-AXHZCLLHSA-N 0 3 407.558 4.246 20 0 HIADHN C[C@H](NC(=O)N(Cc1ccccc1)C1CCN(C)CC1)[C@H]1Oc2ccccc2[C@@H]1C ZINC000439635064 864961664 /nfs/dbraw/zinc/96/16/64/864961664.db2.gz RODHEKDKFPVPGX-JXQFQVJHSA-N 0 3 407.558 4.246 20 0 HIADHN COc1ccc(C)cc1NC(=O)[C@@H](NCC1(SC)CCOCC1)c1ccccc1 ZINC000439634478 864961744 /nfs/dbraw/zinc/96/17/44/864961744.db2.gz PPMGZNYRFUOOGC-NRFANRHFSA-N 0 3 414.571 4.185 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)[C@H](C)Oc2ccccc2C(F)(F)F)CC1 ZINC000439732838 865064307 /nfs/dbraw/zinc/06/43/07/865064307.db2.gz BLLMCRUPVJJQOR-CVEARBPZSA-N 0 3 421.463 4.210 20 0 HIADHN COc1cccc(C2(C(=O)NC3CCN([C@H](C)c4ccncc4)CC3)CCCC2)c1 ZINC000439765081 865090370 /nfs/dbraw/zinc/09/03/70/865090370.db2.gz DUDDIDMYLLXVCJ-LJQANCHMSA-N 0 3 407.558 4.244 20 0 HIADHN C[C@@H](Oc1cc(Cl)cc(Cl)c1)C(=O)NC1CCN([C@@H](C)c2ccncc2)CC1 ZINC000439764991 865090465 /nfs/dbraw/zinc/09/04/65/865090465.db2.gz FZWILRWVJNDTAY-LSDHHAIUSA-N 0 3 422.356 4.498 20 0 HIADHN CCCOc1ccc(C(=O)NC2CCN([C@H](C)c3ccncc3)CC2)cc1OCC ZINC000439767199 865092046 /nfs/dbraw/zinc/09/20/46/865092046.db2.gz BGXSVIFVAKYGEU-GOSISDBHSA-N 0 3 411.546 4.225 20 0 HIADHN CCCOc1ccc(C(=O)NC2CCN([C@@H](C)c3ccncc3)CC2)cc1OCC ZINC000439767200 865092410 /nfs/dbraw/zinc/09/24/10/865092410.db2.gz BGXSVIFVAKYGEU-SFHVURJKSA-N 0 3 411.546 4.225 20 0 HIADHN CCc1cccc2c(C3CCN(C(=O)CC4(N5CCOCC5)CCCC4)CC3)c[nH]c21 ZINC000467986305 881834719 /nfs/dbraw/zinc/83/47/19/881834719.db2.gz WHNWKIMYHCXGEG-UHFFFAOYSA-N 0 3 423.601 4.471 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)Nc3ccc(F)c(C4CC4)c3)CC2)C[C@H](C)O1 ZINC000439787129 865108571 /nfs/dbraw/zinc/10/85/71/865108571.db2.gz YVCQBDIZJQEVTB-IRXDYDNUSA-N 0 3 403.542 4.446 20 0 HIADHN CCOc1c(Br)cc(Br)cc1CN(C)[C@H]1CC[C@H](O)CC1 ZINC000439796030 865115791 /nfs/dbraw/zinc/11/57/91/865115791.db2.gz WMTYOHJATIZXFL-HDJSIYSDSA-N 0 3 421.173 4.346 20 0 HIADHN CCc1ccccc1CC(=O)Nc1c(C)cnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000467991528 881837754 /nfs/dbraw/zinc/83/77/54/881837754.db2.gz AGEAUNZGUIZBCD-QHCPKHFHSA-N 0 3 402.542 4.382 20 0 HIADHN CCn1ncc(NC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)c1C(F)(F)F ZINC000439910884 865219731 /nfs/dbraw/zinc/21/97/31/865219731.db2.gz RVKYVQYJDSKLEM-OAHLLOKOSA-N 0 3 409.456 4.050 20 0 HIADHN CC(C)C1CCC(N2CCN(C(=O)CCCc3nc4ccccc4c(=O)[nH]3)CC2)CC1 ZINC000439982295 865285680 /nfs/dbraw/zinc/28/56/80/865285680.db2.gz SVKVSDYDHBVTBH-UHFFFAOYSA-N 0 3 424.589 4.017 20 0 HIADHN Cc1ccc(-c2ccnn2C)cc1NC(=O)N(CCN(C)C)Cc1ccc(F)cc1 ZINC000439986427 865293507 /nfs/dbraw/zinc/29/35/07/865293507.db2.gz IKKBWAUFEFFPHP-UHFFFAOYSA-N 0 3 409.509 4.130 20 0 HIADHN COc1cc(-c2nnc(CN[C@H]3CCCC[C@H]3C(C)(C)C)o2)cc(OC)c1OC ZINC000440047757 865326506 /nfs/dbraw/zinc/32/65/06/865326506.db2.gz CDOKTHAGNPSXPG-CVEARBPZSA-N 0 3 403.523 4.457 20 0 HIADHN CC[C@H](CNC(=O)N(Cc1ccccc1)C1CCN(C)CC1)Oc1cccc(F)c1 ZINC000440184401 865409028 /nfs/dbraw/zinc/40/90/28/865409028.db2.gz OMXYCXSUDDJDFT-JOCHJYFZSA-N 0 3 413.537 4.289 20 0 HIADHN CC(C)C1CCC(N2CCN(C(=O)Nc3ccc(NC(=O)C4CC4)cc3)CC2)CC1 ZINC000440237292 865472035 /nfs/dbraw/zinc/47/20/35/865472035.db2.gz BKAICZOQTOYUQY-UHFFFAOYSA-N 0 3 412.578 4.399 20 0 HIADHN COc1ccccc1[C@H](NC(=O)N(CCN(C)C)C(C)C)c1ccccc1Cl ZINC000440249073 865488367 /nfs/dbraw/zinc/48/83/67/865488367.db2.gz OUUIZDJEBKGCHR-OAQYLSRUSA-N 0 3 403.954 4.420 20 0 HIADHN CCc1nc(C)c([C@@H](C)N[C@@H]2CC(=O)N(Cc3ccccc3C(F)(F)F)C2)s1 ZINC000468050020 881876460 /nfs/dbraw/zinc/87/64/60/881876460.db2.gz WQHLJKCOOHMOMZ-IUODEOHRSA-N 0 3 411.493 4.484 20 0 HIADHN COc1ccccc1[C@@H](C)NC(=O)[C@@H](C)N1CCN(C2CCC(C(C)C)CC2)CC1 ZINC000440310479 865574807 /nfs/dbraw/zinc/57/48/07/865574807.db2.gz AFILITLIILLQFV-JTVPBKEVSA-N 0 3 415.622 4.093 20 0 HIADHN O=C(CNC1(c2ccc(Cl)cc2)CCOCC1)NCCCSc1ccccc1 ZINC000440313168 865579156 /nfs/dbraw/zinc/57/91/56/865579156.db2.gz JQIBJVUQRXWHPD-UHFFFAOYSA-N 0 3 418.990 4.234 20 0 HIADHN C[C@H]1C[C@H](NC(=O)c2ccccc2CSc2nc3ccccc3[nH]2)CN1C1CC1 ZINC000440924159 866019948 /nfs/dbraw/zinc/01/99/48/866019948.db2.gz MJAHDVHQWWHSGM-RDJZCZTQSA-N 0 3 406.555 4.210 20 0 HIADHN Cc1cccc(-c2nnc(-c3ccc(C(=O)N[C@H]4C[C@@H](C)N(C5CC5)C4)cc3)o2)c1 ZINC000440925164 866021762 /nfs/dbraw/zinc/02/17/62/866021762.db2.gz LGIBKEGAKSXXDS-UZLBHIALSA-N 0 3 402.498 4.067 20 0 HIADHN CC(=O)CCc1ccc(OCc2cccc(C(=O)N[C@H]3C[C@H](C)N(C4CC4)C3)c2)cc1 ZINC000440931902 866028925 /nfs/dbraw/zinc/02/89/25/866028925.db2.gz LRZCDDCTGZGZFJ-MBSDFSHPSA-N 0 3 420.553 4.142 20 0 HIADHN CCC[C@@H](NC(=O)NCCN1CCN(C)C(C)(C)C1)c1ccc(Cl)c(Cl)c1 ZINC000440978261 866062882 /nfs/dbraw/zinc/06/28/82/866062882.db2.gz GCOZHRCEZVCOCV-GOSISDBHSA-N 0 3 415.409 4.160 20 0 HIADHN CC(=O)Nc1cccc(C(=O)N[C@H](CN2CCc3ccccc3C2)C(C)(C)C)c1C ZINC000468116238 881941800 /nfs/dbraw/zinc/94/18/00/881941800.db2.gz WNYAKQPYYZPNEB-HSZRJFAPSA-N 0 3 407.558 4.156 20 0 HIADHN C[C@H]1[C@H](c2ccccc2)c2ccccc2CCN1Cc1csc(CC(=O)N(C)C)n1 ZINC000441071131 866158411 /nfs/dbraw/zinc/15/84/11/866158411.db2.gz QDEOTNJNJSZBDD-AVRWGWEMSA-N 0 3 419.594 4.353 20 0 HIADHN Cc1ccnc(Oc2ccc(NC(=O)NC[C@H](C)N(C)Cc3ccccc3)cc2)n1 ZINC000441087513 866181290 /nfs/dbraw/zinc/18/12/90/866181290.db2.gz HMIPQJXYIUJCJB-SFHVURJKSA-N 0 3 405.502 4.219 20 0 HIADHN CN(C)[C@@H](CNC(=O)N1CCC[C@@H]1c1nc2ccc(Cl)cc2[nH]1)c1ccsc1 ZINC000441242696 866316855 /nfs/dbraw/zinc/31/68/55/866316855.db2.gz GCFXKLFIYXCFEY-MSOLQXFVSA-N 0 3 417.966 4.427 20 0 HIADHN Cc1ccc([C@@H]2CCC[C@H]2N(C)Cc2ccc(S(=O)(=O)N3CCCC3)o2)cc1 ZINC000441360035 866429870 /nfs/dbraw/zinc/42/98/70/866429870.db2.gz XKJBXGYYCMZRDD-LEWJYISDSA-N 0 3 402.560 4.141 20 0 HIADHN COc1ccc(CN(C)C(=O)CN(C)[C@@H]2CCC[C@H]2c2ccc(C)cc2)cc1OC ZINC000441361465 866431306 /nfs/dbraw/zinc/43/13/06/866431306.db2.gz SVFILEOIATZZDE-FCHUYYIVSA-N 0 3 410.558 4.239 20 0 HIADHN C[C@@H](C1CC1)N(Cc1ccccc1)C(=O)CN1CC[C@H](COCc2ccccc2)C1 ZINC000441364511 866433703 /nfs/dbraw/zinc/43/37/03/866433703.db2.gz ZFWDQAJGSZMUIG-URXFXBBRSA-N 0 3 406.570 4.352 20 0 HIADHN C[C@H]1CCCN1C(=O)CCN1CCc2c(cccc2NC(=O)Nc2ccccc2F)C1 ZINC000441395770 866469595 /nfs/dbraw/zinc/46/95/95/866469595.db2.gz PNURJSPYUJNDBS-KRWDZBQOSA-N 0 3 424.520 4.229 20 0 HIADHN CN(C(=O)c1cc(F)c(F)cc1Br)[C@H]1CCN(Cc2ccccc2)C1 ZINC000441447576 866523262 /nfs/dbraw/zinc/52/32/62/866523262.db2.gz DRXOXKUPNLUPDK-AWEZNQCLSA-N 0 3 409.274 4.074 20 0 HIADHN COCCOc1ccc(C(F)(F)F)cc1NC(=O)CN1[C@H](C)C[C@H]2CCCC[C@@H]21 ZINC000441459029 866534554 /nfs/dbraw/zinc/53/45/54/866534554.db2.gz QYNQWYDYPUDMPY-RKVPGOIHSA-N 0 3 414.468 4.322 20 0 HIADHN COc1ccc([C@H]2CCN([C@H]3CCCN(c4ccc(OC(F)F)cc4)C3=O)C2)cc1 ZINC000441529759 866606413 /nfs/dbraw/zinc/60/64/13/866606413.db2.gz AYWZBUZSFLNYSI-UWJYYQICSA-N 0 3 416.468 4.282 20 0 HIADHN C[C@H](C(=O)N(Cc1cccc(Br)c1)C1CCOCC1)N1CCCCCC1 ZINC000468145669 882003283 /nfs/dbraw/zinc/00/32/83/882003283.db2.gz JVVJFEDBLGMHLL-QGZVFWFLSA-N 0 3 423.395 4.221 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)CC(C)(C)CC(=O)c3ccccc3)c2)CC1 ZINC000441608509 866703031 /nfs/dbraw/zinc/70/30/31/866703031.db2.gz BWNWLQRHCQVDCP-UHFFFAOYSA-N 0 3 407.558 4.456 20 0 HIADHN C[C@H](NC(=O)C(=O)Nc1cccc(-c2cccs2)c1)[C@@H](c1ccccc1)N(C)C ZINC000441682683 866803568 /nfs/dbraw/zinc/80/35/68/866803568.db2.gz BIFGACXQXYRRSU-KKSFZXQISA-N 0 3 407.539 4.161 20 0 HIADHN CC(C)Sc1c(Cl)cccc1NC(=O)C(=O)N[C@@H](C)CN1CCC[C@@H](C)C1 ZINC000441739304 866828375 /nfs/dbraw/zinc/82/83/75/866828375.db2.gz QOGLHIGNGSXCGM-CABCVRRESA-N 0 3 411.999 4.016 20 0 HIADHN Cc1nn(C(C)(C)C)cc1[C@H](C)NC(=O)N(CCN(C)C)Cc1cccc(Cl)c1 ZINC000468161497 882029848 /nfs/dbraw/zinc/02/98/48/882029848.db2.gz WGFQEVXOTLYOGA-INIZCTEOSA-N 0 3 420.001 4.434 20 0 HIADHN Cc1ncsc1CN(C)C[C@H]1CCN(C(=O)Nc2cc(Cl)cc(F)c2F)C1 ZINC000442180826 867203470 /nfs/dbraw/zinc/20/34/70/867203470.db2.gz IVDQHJMTTWGUID-GFCCVEGCSA-N 0 3 414.909 4.369 20 0 HIADHN C[S@](=O)C1(CN[C@H](Cc2ccccc2F)c2ccccc2Br)CC1 ZINC000442826693 867690109 /nfs/dbraw/zinc/69/01/09/867690109.db2.gz XQQRDIDGQIRYAY-KOSHJBKYSA-N 0 3 410.352 4.373 20 0 HIADHN COCCC[C@H](NCC(=O)Nc1cccc(Br)c1)c1ccc(F)cc1 ZINC000442856656 867700408 /nfs/dbraw/zinc/70/04/08/867700408.db2.gz OOLWGUQVADOIDK-SFHVURJKSA-N 0 3 409.299 4.284 20 0 HIADHN CN(CCCc1ccncc1)Cc1cccc(Br)c1OC[C@H]1CCCO1 ZINC000442882406 867714254 /nfs/dbraw/zinc/71/42/54/867714254.db2.gz DNVMFYSMLTVMCN-LJQANCHMSA-N 0 3 419.363 4.467 20 0 HIADHN CCN(Cc1cc(C(F)(F)F)n[nH]1)C1CCN(c2cc(C)nc(C(C)C)n2)CC1 ZINC000442886013 867717369 /nfs/dbraw/zinc/71/73/69/867717369.db2.gz PKOMEFFCRJEEGH-UHFFFAOYSA-N 0 3 410.488 4.141 20 0 HIADHN Cc1cc(C(F)(F)F)ccc1CNCc1ccc(CS(=O)(=O)NC(C)C)cc1 ZINC000443003607 867789490 /nfs/dbraw/zinc/78/94/90/867789490.db2.gz QZONJNYHQCHULB-UHFFFAOYSA-N 0 3 414.493 4.131 20 0 HIADHN COc1ccc2c(c1)CCC[C@@H]2CNC(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000468229991 882121006 /nfs/dbraw/zinc/12/10/06/882121006.db2.gz JRIOKMJAOARPBL-JOCHJYFZSA-N 0 3 421.585 4.421 20 0 HIADHN CC(C)NC(=O)Nc1ccc([C@H](C)N[C@H]2CCCN(C3CCCCC3)C2=O)cc1 ZINC000443102714 867819132 /nfs/dbraw/zinc/81/91/32/867819132.db2.gz MRYCQEYOVSGQCD-UWJYYQICSA-N 0 3 400.567 4.191 20 0 HIADHN C[C@H](CCc1cccc(F)c1)C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000443343533 867916503 /nfs/dbraw/zinc/91/65/03/867916503.db2.gz PJXZZBUHKANWRU-GOSISDBHSA-N 0 3 416.512 4.193 20 0 HIADHN Cc1cc(NC(=O)Nc2ccc(O)c(C)c2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000443596605 868150521 /nfs/dbraw/zinc/15/05/21/868150521.db2.gz WYYVOTVKUIDERP-HXUWFJFHSA-N 0 3 405.502 4.297 20 0 HIADHN Cc1cc(CN2CCC(C(=O)N[C@@H](C)C(C)C)CC2)nc(-c2ccc(Cl)cc2)n1 ZINC000443631788 868208371 /nfs/dbraw/zinc/20/83/71/868208371.db2.gz ROUNYHMYQPWGJI-KRWDZBQOSA-N 0 3 414.981 4.478 20 0 HIADHN Cc1ccc(OCc2ccc(C(=O)NCCCCN3C[C@H](C)O[C@@H](C)C3)o2)c(C)c1 ZINC000443666288 868270819 /nfs/dbraw/zinc/27/08/19/868270819.db2.gz LFWATCAELOOBGZ-PMACEKPBSA-N 0 3 414.546 4.095 20 0 HIADHN O=C([C@H]1CCCN(Cc2cccc(F)c2)C1)N1CC(Cc2ccc(F)c(F)c2)C1 ZINC000443666010 868272480 /nfs/dbraw/zinc/27/24/80/868272480.db2.gz JYTRHIYIMLXLCR-IBGZPJMESA-N 0 3 402.460 4.017 20 0 HIADHN CCOC(=O)c1c2c(sc1NC(=O)CCC1CCOCC1)C(C)(C)NC(C)(C)C2 ZINC000443817661 868350006 /nfs/dbraw/zinc/35/00/06/868350006.db2.gz RMKDAEJXPKVSGQ-UHFFFAOYSA-N 0 3 422.591 4.230 20 0 HIADHN Cc1ccccc1[C@H]([C@H](C)NC(=O)C(=O)Nc1ccccc1OC1CCCC1)N(C)C ZINC000443846609 868377960 /nfs/dbraw/zinc/37/79/60/868377960.db2.gz ZXJJXCFVKYSKDS-MBSDFSHPSA-N 0 3 423.557 4.063 20 0 HIADHN Cc1ccc(C(F)(F)F)cc1NC(=O)C(=O)N[C@H](C)[C@H](c1ccccc1C)N(C)C ZINC000443848166 868379439 /nfs/dbraw/zinc/37/94/39/868379439.db2.gz ZXQCTRDNSMBSOJ-DNVCBOLYSA-N 0 3 421.463 4.068 20 0 HIADHN COC(=O)c1c(CN2CCC[C@H]2C[C@@H](C)O)nc2ccccc2c1-c1ccccc1 ZINC000443873212 868404786 /nfs/dbraw/zinc/40/47/86/868404786.db2.gz GBAJGVIXHBLMCW-MJGOQNOKSA-N 0 3 404.510 4.424 20 0 HIADHN Cc1cc(Cl)c(NC(=O)N[C@H]2CCN(Cc3ccccc3)C[C@@H]2CO)cc1Cl ZINC000443942499 868478909 /nfs/dbraw/zinc/47/89/09/868478909.db2.gz QLDCJHDDQYVWCR-APWZRJJASA-N 0 3 422.356 4.306 20 0 HIADHN CN(C)S(=O)(=O)c1ccc(CNCc2ccc(Oc3cccc(F)c3)cc2)cc1 ZINC000443968437 868499009 /nfs/dbraw/zinc/49/90/09/868499009.db2.gz PQBADCBEHPMYMB-UHFFFAOYSA-N 0 3 414.502 4.158 20 0 HIADHN CCOc1c(OC)cc(CNC2(c3ccc(OC)c(F)c3)CCOCC2)cc1OC ZINC000444008789 868531631 /nfs/dbraw/zinc/53/16/31/868531631.db2.gz HVGVPSVUTZUFPD-UHFFFAOYSA-N 0 3 419.493 4.046 20 0 HIADHN COc1ccc(C2(NCc3ccc(Br)s3)CCOCC2)cc1F ZINC000444020270 868547142 /nfs/dbraw/zinc/54/71/42/868547142.db2.gz ZAVHJUFVXBSEGM-UHFFFAOYSA-N 0 3 400.313 4.454 20 0 HIADHN CCCN(CC(=O)N(CC)c1nc2ccccc2s1)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000444231924 868680145 /nfs/dbraw/zinc/68/01/45/868680145.db2.gz LACQKQPJNRBXCV-CWFSZBLJSA-N 0 3 401.576 4.175 20 0 HIADHN COC(=O)c1ccc2c(c1)nc(CN(C)[C@H]1CCC[C@H]1c1ccc(C)cc1)[nH]c2=O ZINC000444236504 868685809 /nfs/dbraw/zinc/68/58/09/868685809.db2.gz IHLHXCSLJBBBEX-RXVVDRJESA-N 0 3 405.498 4.199 20 0 HIADHN Cc1ccc([C@@H]2CCC[C@H]2N(C)CC(=O)Nc2cccc(C(=O)NC3CC3)c2)cc1 ZINC000444240912 868689398 /nfs/dbraw/zinc/68/93/98/868689398.db2.gz MRHCDYLJVCYKSZ-XZOQPEGZSA-N 0 3 405.542 4.094 20 0 HIADHN O=C(Nc1cnn(CC(F)F)c1)N1CCN(Cc2ccccc2)C2(CCCCC2)C1 ZINC000444400249 868811978 /nfs/dbraw/zinc/81/19/78/868811978.db2.gz VSILIAPEEWMONM-UHFFFAOYSA-N 0 3 417.504 4.201 20 0 HIADHN COc1ccc(CN(C)C[C@@H](O)CO[C@@H](c2ccccc2)c2ccc(C)cc2)cc1O ZINC000444401477 868812256 /nfs/dbraw/zinc/81/22/56/868812256.db2.gz GQJJVQXCJYXQCG-BVAGGSTKSA-N 0 3 421.537 4.308 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)[C@H]1C[C@@H]1c1cccc(C(F)(F)F)c1 ZINC000444447879 868832230 /nfs/dbraw/zinc/83/22/30/868832230.db2.gz AQIJFGVOGCVYTM-RTWAWAEBSA-N 0 3 418.459 4.404 20 0 HIADHN COc1cc(C2(C(=O)Nc3cccc(CN4CCC(O)CC4)c3)CCC2)ccc1C ZINC000444453473 868833693 /nfs/dbraw/zinc/83/36/93/868833693.db2.gz IICGMRVCPWSHTR-UHFFFAOYSA-N 0 3 408.542 4.021 20 0 HIADHN O=C(CCOc1cccc(Cl)c1Cl)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000444455327 868834948 /nfs/dbraw/zinc/83/49/48/868834948.db2.gz SEHOQCCFPASZAV-UHFFFAOYSA-N 0 3 423.340 4.358 20 0 HIADHN CCCCOc1ccc(C(=O)Nc2cccc(CN3CCC(O)CC3)c2)cc1OC ZINC000444459068 868835847 /nfs/dbraw/zinc/83/58/47/868835847.db2.gz HRZNXTXXZAWHQL-UHFFFAOYSA-N 0 3 412.530 4.083 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)c1csc(CCc2ccccc2)n1 ZINC000444463156 868838695 /nfs/dbraw/zinc/83/86/95/868838695.db2.gz WSMZJOTWQBCKBE-UHFFFAOYSA-N 0 3 421.566 4.137 20 0 HIADHN CN(C)CCN(C(=O)NCc1ccc(Oc2cccc(F)c2)nc1)C1CCCC1 ZINC000468307808 882234523 /nfs/dbraw/zinc/23/45/23/882234523.db2.gz JNDKVTRSGFZREG-UHFFFAOYSA-N 0 3 400.498 4.029 20 0 HIADHN O=C(Cc1ccc(Cl)c(Cl)c1)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000444540066 868874108 /nfs/dbraw/zinc/87/41/08/868874108.db2.gz GHOLFTBPHAKGOK-UHFFFAOYSA-N 0 3 407.341 4.379 20 0 HIADHN COc1ccc2cc(C(=O)Nc3cccc(CN4CCC(CO)CC4)c3)c(C)nc2c1 ZINC000444558139 868881545 /nfs/dbraw/zinc/88/15/45/868881545.db2.gz YFGPPJRRPCTIIR-UHFFFAOYSA-N 0 3 419.525 4.008 20 0 HIADHN O=C(Cc1c[nH]c2cc(Cl)ccc12)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000444562481 868882988 /nfs/dbraw/zinc/88/29/88/868882988.db2.gz USISLOWRXDIPSH-UHFFFAOYSA-N 0 3 411.933 4.207 20 0 HIADHN Cc1ccc(C(=O)NCCN2CCCC(C)(C)C2)cc1NC(=O)c1ccccc1F ZINC000444608725 868904240 /nfs/dbraw/zinc/90/42/40/868904240.db2.gz MFUGJUFFYRVLGB-UHFFFAOYSA-N 0 3 411.521 4.238 20 0 HIADHN CN(C(=O)NCc1cccc(-c2cccnc2)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000468313438 882240790 /nfs/dbraw/zinc/24/07/90/882240790.db2.gz URWITZXHJLFIBD-XMMPIXPASA-N 0 3 400.526 4.165 20 0 HIADHN CC(C)(C)[C@H](CO)NCC(=O)Nc1nc(-c2ccc(Cl)c(Cl)c2)cs1 ZINC000444694703 868961375 /nfs/dbraw/zinc/96/13/75/868961375.db2.gz CUJHMABTUXIWFZ-AWEZNQCLSA-N 0 3 402.347 4.052 20 0 HIADHN O=C(NCc1nccn1C(F)F)N1CCN(Cc2ccccc2)C2(CCCCC2)C1 ZINC000444693562 868961413 /nfs/dbraw/zinc/96/14/13/868961413.db2.gz AMUVLMLFUCJQRM-UHFFFAOYSA-N 0 3 417.504 4.009 20 0 HIADHN Cc1cccc2nc(C3CCN(C[C@@H](O)COc4cccc5[nH]ccc54)CC3)oc21 ZINC000444766042 868992546 /nfs/dbraw/zinc/99/25/46/868992546.db2.gz KNKIEOXHAWVCTK-GOSISDBHSA-N 0 3 405.498 4.237 20 0 HIADHN Cc1cc(OC[C@H](O)CN2CCC[C@H](c3nccn3C)C2)c(C(C)C)cc1Cl ZINC000444789301 869006587 /nfs/dbraw/zinc/00/65/87/869006587.db2.gz DKVXKGBIDWDKRP-ZWKOTPCHSA-N 0 3 405.970 4.125 20 0 HIADHN CN(C)CCN(C(=O)NCc1ccc(Oc2ccc(F)cc2)nc1)C1CCCC1 ZINC000468323166 882252372 /nfs/dbraw/zinc/25/23/72/882252372.db2.gz WSCVZIAXBQQXCR-UHFFFAOYSA-N 0 3 400.498 4.029 20 0 HIADHN Cc1cc(NC(=O)Nc2c(C)noc2C2CC2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000444877214 869072510 /nfs/dbraw/zinc/07/25/10/869072510.db2.gz OZGFNXYQPQHXAC-LJQANCHMSA-N 0 3 420.517 4.456 20 0 HIADHN COc1ccc([C@@H](CNC(=O)N[C@H](CC(F)(F)F)C(C)C)N2CCCC2)cc1 ZINC000445547053 869604550 /nfs/dbraw/zinc/60/45/50/869604550.db2.gz FLVYCERMYBWZNL-QZTJIDSGSA-N 0 3 401.473 4.108 20 0 HIADHN FC(F)(F)[C@]1(c2nc(-c3ccc4cc[nH]c4n3)no2)CCN(Cc2ccccc2)C1 ZINC000445580679 869639769 /nfs/dbraw/zinc/63/97/69/869639769.db2.gz TVDQEIBZHKGHLT-HXUWFJFHSA-N 0 3 413.403 4.319 20 0 HIADHN COc1cc(F)c(NC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)cc1F ZINC000468385676 882329756 /nfs/dbraw/zinc/32/97/56/882329756.db2.gz XACUPXYPBXRNNQ-IBGZPJMESA-N 0 3 414.374 4.367 20 0 HIADHN COc1ccc([C@H](CNC(=O)c2c[nH]nc2-c2ccccc2Cl)N2CCCC2)cc1 ZINC000445644852 869715775 /nfs/dbraw/zinc/71/57/75/869715775.db2.gz KKCVTZFRRAIAQJ-NRFANRHFSA-N 0 3 424.932 4.306 20 0 HIADHN COc1ccc([C@@H](CNC(=O)CCCc2ccc(F)c(F)c2)N2CCCC2)cc1 ZINC000445644585 869715832 /nfs/dbraw/zinc/71/58/32/869715832.db2.gz HUFRJXCTADNCCE-JOCHJYFZSA-N 0 3 402.485 4.249 20 0 HIADHN CC(C)(C)n1cc(-c2noc([C@]3(C(F)(F)F)CCN(Cc4ccccc4)C3)n2)cn1 ZINC000445647138 869716912 /nfs/dbraw/zinc/71/69/12/869716912.db2.gz KVKWVTNXHDOBOC-FQEVSTJZSA-N 0 3 419.451 4.394 20 0 HIADHN O=C(CN1CCN(CC2CCC(C(F)(F)F)CC2)CC1)Nc1ccccc1Cl ZINC000468391414 882336477 /nfs/dbraw/zinc/33/64/77/882336477.db2.gz DOTRFCJODRPPBC-UHFFFAOYSA-N 0 3 417.903 4.265 20 0 HIADHN CCO[C@H](c1noc(-c2ccc(N3CCN(C(C)C)CC3)cc2)n1)c1ccccc1 ZINC000445776820 869818140 /nfs/dbraw/zinc/81/81/40/869818140.db2.gz NICINBRRQYETPY-QFIPXVFZSA-N 0 3 406.530 4.393 20 0 HIADHN O=C(CCC(=O)N1CCC[C@@H]1CN1CCCCC1)c1cc(Cl)sc1Cl ZINC000445789044 869824750 /nfs/dbraw/zinc/82/47/50/869824750.db2.gz DRCHUMHRHFJYRS-CYBMUJFWSA-N 0 3 403.375 4.495 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)CCSc1ccccn1 ZINC000445802257 869830797 /nfs/dbraw/zinc/83/07/97/869830797.db2.gz LGPQEBHFSJEHFX-UHFFFAOYSA-N 0 3 411.493 4.173 20 0 HIADHN CSc1cccc(N(C(=O)c2cc(NC(C)=O)ccc2C)C2CCN(C)CC2)c1 ZINC000445830487 869850005 /nfs/dbraw/zinc/85/00/05/869850005.db2.gz VQDHYZCVGXHRMU-UHFFFAOYSA-N 0 3 411.571 4.416 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)c3cc(F)cc(C(F)(F)F)c3)CC2)C[C@H](C)O1 ZINC000445946384 869907633 /nfs/dbraw/zinc/90/76/33/869907633.db2.gz JGCVSJPUZFXVKJ-GJZGRUSLSA-N 0 3 416.459 4.196 20 0 HIADHN Cn1c(CN[C@@H]2CCC[C@@H]2c2ccc(C(F)(F)F)cc2)nc2ccccc2c1=O ZINC000445982332 869946846 /nfs/dbraw/zinc/94/68/46/869946846.db2.gz MTHZJRPKZOJJTK-SJLPKXTDSA-N 0 3 401.432 4.378 20 0 HIADHN CCOC(=O)c1sc2nc(CN[C@@H]3CCC[C@@H]3c3ccccc3)nc(N)c2c1C ZINC000445987532 869951531 /nfs/dbraw/zinc/95/15/31/869951531.db2.gz GHIGMDXLWRFRPH-HZPDHXFCSA-N 0 3 410.543 4.185 20 0 HIADHN COC1CCN(C(C)(C)CNC(=O)c2cc(-c3ccc(F)cc3)c(C)s2)CC1 ZINC000446054514 870016059 /nfs/dbraw/zinc/01/60/59/870016059.db2.gz QHOKGTWCZAHTJO-UHFFFAOYSA-N 0 3 404.551 4.482 20 0 HIADHN Cc1c2cc(C)ccc2sc1C(=O)Nc1cccc(CN2CCC(C(N)=O)CC2)c1 ZINC000446108312 870055449 /nfs/dbraw/zinc/05/54/49/870055449.db2.gz MYTZRIGAUPOBIX-UHFFFAOYSA-N 0 3 421.566 4.468 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CCC(Oc2ccncc2C)CC1)c1ccsc1 ZINC000446237805 870178225 /nfs/dbraw/zinc/17/82/25/870178225.db2.gz QDHBHBQDKDBQGO-FQEVSTJZSA-N 0 3 416.591 4.087 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Nc1cc(-c2cc(F)cc(F)c2)nn1C ZINC000446406210 870309758 /nfs/dbraw/zinc/30/97/58/870309758.db2.gz PYFDLVXPODVSJN-UHFFFAOYSA-N 0 3 419.501 4.023 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)Nc1cccn(Cc2ccc(F)cc2)c1=O ZINC000446439327 870358655 /nfs/dbraw/zinc/35/86/55/870358655.db2.gz RAKVPKWALWCOFC-UHFFFAOYSA-N 0 3 419.456 4.096 20 0 HIADHN Cc1nn(-c2ccccc2)c2sc(C(=O)N(CCN(C)C)Cc3ccco3)cc12 ZINC000446442152 870362153 /nfs/dbraw/zinc/36/21/53/870362153.db2.gz KLAXYQLTJRHHDW-UHFFFAOYSA-N 0 3 408.527 4.192 20 0 HIADHN Cc1ccc(-c2ncccc2NC(=O)NC2CCN(CCOC(C)C)CC2)s1 ZINC000446592664 870501363 /nfs/dbraw/zinc/50/13/63/870501363.db2.gz XROQWVXWSHPFAL-UHFFFAOYSA-N 0 3 402.564 4.129 20 0 HIADHN COc1ccc2c(c1)[C@H](NCc1ccc(N3C[C@@H](C)O[C@H](C)C3)nc1)CCCS2 ZINC000446746189 870652067 /nfs/dbraw/zinc/65/20/67/870652067.db2.gz SOBDRNJDBABYAV-CBGDNZLLSA-N 0 3 413.587 4.421 20 0 HIADHN Cc1ccc(CNC(=O)N(Cc2ccco2)C2CCN(C)CC2)c(OCC2CC2)c1 ZINC000446778370 870695597 /nfs/dbraw/zinc/69/55/97/870695597.db2.gz WGXGLPGWGOLKPT-UHFFFAOYSA-N 0 3 411.546 4.183 20 0 HIADHN C[S@](=O)c1ccc(CNC2(c3cccc(OC(F)(F)F)c3)CCOCC2)cc1 ZINC000446825178 870741067 /nfs/dbraw/zinc/74/10/67/870741067.db2.gz AZHQLCMARMKLBZ-NDEPHWFRSA-N 0 3 413.461 4.118 20 0 HIADHN COc1ccc(CNC2(c3cccc(OC(F)(F)F)c3)CCOCC2)cc1OC ZINC000446826601 870742717 /nfs/dbraw/zinc/74/27/17/870742717.db2.gz JNKDENYBFOKZCU-UHFFFAOYSA-N 0 3 411.420 4.398 20 0 HIADHN COc1ccc(-c2ccncc2)cc1CN(C[C@@H](O)COc1ccccc1)C(C)C ZINC000446832366 870749408 /nfs/dbraw/zinc/74/94/08/870749408.db2.gz BFSQAAHUKJJDLT-HSZRJFAPSA-N 0 3 406.526 4.408 20 0 HIADHN CC(C)n1ccc(C[C@H](C)NCc2ccc(Cl)cc2I)n1 ZINC000446835321 870753333 /nfs/dbraw/zinc/75/33/33/870753333.db2.gz NONAGWZMDWRZJB-LBPRGKRZSA-N 0 3 417.722 4.443 20 0 HIADHN FC(F)(F)Oc1cccc(C2(NCc3cc(-c4cccnc4)n[nH]3)CCOCC2)c1 ZINC000446836554 870754993 /nfs/dbraw/zinc/75/49/93/870754993.db2.gz VFCXLBVVLPCITN-UHFFFAOYSA-N 0 3 418.419 4.166 20 0 HIADHN OCC1(Cc2ccccc2)CCN(Cc2ccccc2OCc2ccncc2)CC1 ZINC000446843922 870763831 /nfs/dbraw/zinc/76/38/31/870763831.db2.gz QNHUDWZKIKONKF-UHFFFAOYSA-N 0 3 402.538 4.478 20 0 HIADHN COc1ccc([C@H](CCn2cncn2)NCc2ccccc2N2CCCCC2)cc1 ZINC000446889372 870808289 /nfs/dbraw/zinc/80/82/89/870808289.db2.gz WFJXMWWEHSAEPV-QHCPKHFHSA-N 0 3 405.546 4.198 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1cc(Cl)ccc1N1CCSCC1 ZINC000446906877 870825536 /nfs/dbraw/zinc/82/55/36/870825536.db2.gz SGVWWSYYCNGMBR-UHFFFAOYSA-N 0 3 422.982 4.082 20 0 HIADHN CC[C@H](C)C(=O)Nc1cccc(CN[C@H](CCn2cncn2)c2ccc(C)cc2)c1 ZINC000446922699 870836203 /nfs/dbraw/zinc/83/62/03/870836203.db2.gz NPMJNYIPPHSOCH-WMZHIEFXSA-N 0 3 405.546 4.492 20 0 HIADHN Cc1cc(CN2CCC[C@@H]([C@@H](O)C(F)(F)F)C2)cc(C)c1OCc1ccccn1 ZINC000446974532 870872565 /nfs/dbraw/zinc/87/25/65/870872565.db2.gz JFWCDEQVCARULT-WIYYLYMNSA-N 0 3 408.464 4.413 20 0 HIADHN COC[C@@H](C)OC[C@@H](O)CN(C)C(c1ccc(Cl)cc1)c1ccc(Cl)cc1 ZINC000447008553 870888696 /nfs/dbraw/zinc/88/86/96/870888696.db2.gz WCMXILAEEGEAQB-QRWLVFNGSA-N 0 3 412.357 4.427 20 0 HIADHN COC[C@@H](C)OC[C@H](O)CN(C)C(c1ccc(Cl)cc1)c1ccc(Cl)cc1 ZINC000447008551 870888773 /nfs/dbraw/zinc/88/87/73/870888773.db2.gz WCMXILAEEGEAQB-FOIQADDNSA-N 0 3 412.357 4.427 20 0 HIADHN COC(=O)[C@](C)(CN[C@@H](C)C(=O)Nc1c(C)cc(C)cc1Cl)c1ccc(F)cc1 ZINC000447033038 870909067 /nfs/dbraw/zinc/90/90/67/870909067.db2.gz CVBUEXDMXBZMPW-OYHNWAKOSA-N 0 3 420.912 4.143 20 0 HIADHN Cc1sc([C@H](C)NC(=O)N2CC[C@@H](N3CC=CC3)C2)nc1-c1ccc(Cl)cc1 ZINC000447118965 871021391 /nfs/dbraw/zinc/02/13/91/871021391.db2.gz HXPYOEXKUIJXMI-KBXCAEBGSA-N 0 3 416.978 4.489 20 0 HIADHN C[C@@H](NC(=O)N(CCN(C)C)Cc1ccccc1F)c1cccc(N2CCCC2)c1 ZINC000447221899 871107424 /nfs/dbraw/zinc/10/74/24/871107424.db2.gz JUSBNAQJLQCAFO-LJQANCHMSA-N 0 3 412.553 4.260 20 0 HIADHN C[C@H](NC(=O)N(CCN(C)C)Cc1cccs1)c1cccc(N2CCCC2)c1 ZINC000447228359 871114371 /nfs/dbraw/zinc/11/43/71/871114371.db2.gz VTNBVUMNPBLTKU-SFHVURJKSA-N 0 3 400.592 4.183 20 0 HIADHN CN1CCCC(C)(C)[C@@H]1CNC(=O)c1ccc(Br)cc1C(F)(F)F ZINC000468493668 882479899 /nfs/dbraw/zinc/47/98/99/882479899.db2.gz YAKAGAWPGVPOIP-AWEZNQCLSA-N 0 3 407.274 4.318 20 0 HIADHN Cc1nc2ccccn2c1CNC1(c2cccc(OC(F)(F)F)c2)CCOCC1 ZINC000447328018 871220576 /nfs/dbraw/zinc/22/05/76/871220576.db2.gz XCMUGEHOQGXSIR-UHFFFAOYSA-N 0 3 405.420 4.337 20 0 HIADHN CSc1ccccc1NC(=O)CCN1CCN(c2cccc3cnccc32)C[C@H]1C ZINC000447402455 871312626 /nfs/dbraw/zinc/31/26/26/871312626.db2.gz JNJMQCBIEVAQKX-GOSISDBHSA-N 0 3 420.582 4.496 20 0 HIADHN O=C(CCN1CCN(c2ccccc2)CC1)Nc1ccc(-c2cnc(C3CC3)o2)cc1 ZINC000468505796 882503343 /nfs/dbraw/zinc/50/33/43/882503343.db2.gz HASHYCBNZWBKGC-UHFFFAOYSA-N 0 3 416.525 4.370 20 0 HIADHN COc1ccc([C@@H](N[C@H]2CCCN(c3cc(C)nn3C)C2)c2ccc(F)cc2)cc1 ZINC000447560241 871449232 /nfs/dbraw/zinc/44/92/32/871449232.db2.gz WEEYAJNSGRCHEZ-URXFXBBRSA-N 0 3 408.521 4.224 20 0 HIADHN Cc1ccc(CN[C@@H]2C[C@H](C)c3c2cccc3Br)cc1S(C)(=O)=O ZINC000447582731 871484764 /nfs/dbraw/zinc/48/47/64/871484764.db2.gz YBMCFTDMMATGKA-SUMWQHHRSA-N 0 3 408.361 4.499 20 0 HIADHN C[C@H](O)C[C@@H]1CCCCN1CC(=O)NC[C@H](c1c[nH]c2ccccc21)c1ccccc1 ZINC000447831076 871759212 /nfs/dbraw/zinc/75/92/12/871759212.db2.gz KGCLCVRPEKVBIE-RRPUWOKSSA-N 0 3 419.569 4.041 20 0 HIADHN Brc1cccc(N2CC[C@@H](CNCc3nc(-c4ccccc4)c[nH]3)C2)c1 ZINC000447853658 871772800 /nfs/dbraw/zinc/77/28/00/871772800.db2.gz HLYATZQRFRYTLZ-INIZCTEOSA-N 0 3 411.347 4.455 20 0 HIADHN Cc1nn(C)c(CNC[C@@H](c2cccs2)N2CCC(C)CC2)c1Br ZINC000447933674 871817532 /nfs/dbraw/zinc/81/75/32/871817532.db2.gz UXBKZMGNAGNXEQ-HNNXBMFYSA-N 0 3 411.413 4.115 20 0 HIADHN Cc1nn(C)c(CNC[C@H](c2ccccc2)N2CCC(C)CC2)c1Br ZINC000447940453 871818687 /nfs/dbraw/zinc/81/86/87/871818687.db2.gz OJDXEWRUTNRQLR-GOSISDBHSA-N 0 3 405.384 4.054 20 0 HIADHN CC[C@H](CNC(=O)Nc1cccc2c1OCC[C@H]2OC)N1CCc2ccccc2C1 ZINC000448045351 871876842 /nfs/dbraw/zinc/87/68/42/871876842.db2.gz QKWMCXSVEMKILJ-DENIHFKCSA-N 0 3 409.530 4.115 20 0 HIADHN CO[C@H]1CCOc2c(NC(=O)N(Cc3ccccc3)C3CCN(C)CC3)cccc21 ZINC000448046068 871877628 /nfs/dbraw/zinc/87/76/28/871877628.db2.gz WLFKEUBTQSHCBZ-QFIPXVFZSA-N 0 3 409.530 4.285 20 0 HIADHN C[C@H](CSCc1ccccc1)C(=O)N(C)C1CCN(CCc2ccccn2)CC1 ZINC000448157992 872035692 /nfs/dbraw/zinc/03/56/92/872035692.db2.gz JTSNETOZZYMKPL-HXUWFJFHSA-N 0 3 411.615 4.116 20 0 HIADHN CN(C)CCN(C(=O)Nc1cnn(-c2ccc(C(F)(F)F)cc2)c1)C1CCCC1 ZINC000448290999 872223375 /nfs/dbraw/zinc/22/33/75/872223375.db2.gz UIXVFDVOUWCNBN-UHFFFAOYSA-N 0 3 409.456 4.229 20 0 HIADHN CSc1cccc(N(C(=O)COC(C)(C)C(F)(F)F)C2CCN(C)CC2)c1 ZINC000448353066 872300932 /nfs/dbraw/zinc/30/09/32/872300932.db2.gz WVAWAVRURIHZGZ-UHFFFAOYSA-N 0 3 404.498 4.193 20 0 HIADHN Cc1[nH]nc2ncc(CN3CCC[C@@H](Nc4cccc(Br)c4)C3)cc12 ZINC000448353725 872303432 /nfs/dbraw/zinc/30/34/32/872303432.db2.gz HDSCGLOIWGRNRM-QGZVFWFLSA-N 0 3 400.324 4.105 20 0 HIADHN CC[C@H](C)[C@H](C)NC(=O)N(Cc1ccccc1Br)C1CCN(C)CC1 ZINC000460121927 872592479 /nfs/dbraw/zinc/59/24/79/872592479.db2.gz VIAPPSLXDOECTC-HOTGVXAUSA-N 0 3 410.400 4.490 20 0 HIADHN CCC(=O)Nc1ccc(C)c(NC(=O)N(CC)[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000460132492 872619589 /nfs/dbraw/zinc/61/95/89/872619589.db2.gz JQENGNDRWJWAFJ-NRFANRHFSA-N 0 3 408.546 4.472 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)[C@H]2CCSc3ccccc32)cc1)[C@@H]1CCCN(C)C1 ZINC000460214078 872800134 /nfs/dbraw/zinc/80/01/34/872800134.db2.gz GGIGTSZOQAHZDC-CTNGQTDRSA-N 0 3 423.582 4.071 20 0 HIADHN Cc1cc(NC(=O)N2CC[C@@H](N3CCN(C)CC3)[C@H](C)C2)ccc1-c1ccccc1 ZINC000460229583 872816266 /nfs/dbraw/zinc/81/62/66/872816266.db2.gz HSUDGLZFIULYJC-HYBUGGRVSA-N 0 3 406.574 4.152 20 0 HIADHN CCCN(CCN1CCN(CC)CC1)C(=O)N[C@@H](C)c1cc2ccccc2s1 ZINC000460277485 872865511 /nfs/dbraw/zinc/86/55/11/872865511.db2.gz RRABEXRDWPFYFP-SFHVURJKSA-N 0 3 402.608 4.021 20 0 HIADHN Cc1ccc(CNCc2cccc(OCc3ccccn3)c2)c(-n2cc(Cl)cn2)n1 ZINC000468597244 882692885 /nfs/dbraw/zinc/69/28/85/882692885.db2.gz JDBMZLKRZSZZKQ-UHFFFAOYSA-N 0 3 419.916 4.493 20 0 HIADHN CCCN(CCN1CCN(CC)CC1)C(=O)N[C@H](c1cccc(C)c1)C(C)(C)C ZINC000460497204 873183913 /nfs/dbraw/zinc/18/39/13/873183913.db2.gz MEVLVEBZEGIVIR-JOCHJYFZSA-N 0 3 402.627 4.141 20 0 HIADHN Cc1ccc(CC[C@H](C)NC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)o1 ZINC000460508339 873195044 /nfs/dbraw/zinc/19/50/44/873195044.db2.gz FDNPWHHLYPCHRB-HRAATJIYSA-N 0 3 408.464 4.480 20 0 HIADHN CC(C)Cn1c(Cc2ccccn2)nnc1N1C[C@@H](C)N(Cc2ccccc2)C[C@H]1C ZINC000460604031 873346247 /nfs/dbraw/zinc/34/62/47/873346247.db2.gz TYTWXLGPFZCPRC-NHCUHLMSSA-N 0 3 418.589 4.019 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)[C@@H]3CCSc4ccccc43)CC2)c1 ZINC000460717144 873511010 /nfs/dbraw/zinc/51/10/10/873511010.db2.gz PGSBGMPHEGCILV-HSZRJFAPSA-N 0 3 423.626 4.293 20 0 HIADHN O=C(NCc1cccc(-c2cccnc2)c1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000468616964 882733279 /nfs/dbraw/zinc/73/32/79/882733279.db2.gz DERCESMFNNPRBM-QHCPKHFHSA-N 0 3 403.501 4.416 20 0 HIADHN C[C@H]1CC[C@H](CNC(=O)N(Cc2ccccc2Br)C2CCN(C)CC2)C1 ZINC000460743912 873572326 /nfs/dbraw/zinc/57/23/26/873572326.db2.gz XVBFILOHIIHJTN-IRXDYDNUSA-N 0 3 422.411 4.491 20 0 HIADHN CCOCCCn1c([C@H](CC)c2ccccc2)nnc1N1C[C@H](C)N(CC)C[C@H]1C ZINC000460765527 873608674 /nfs/dbraw/zinc/60/86/74/873608674.db2.gz ALOHMGVCNDLUCR-TUNNFDKTSA-N 0 3 413.610 4.166 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)c1c[nH]cc1-c1ccc2c(c1)OCCO2 ZINC000460785388 873645328 /nfs/dbraw/zinc/64/53/28/873645328.db2.gz XCJYGEMMOCNCST-IBGZPJMESA-N 0 3 423.538 4.081 20 0 HIADHN CCCN(CCN1CCN(CC)CC1)C(=O)NCc1ccc(-c2ccccc2)c(C)c1 ZINC000460828075 873714615 /nfs/dbraw/zinc/71/46/15/873714615.db2.gz JBUQCXCFWKREED-UHFFFAOYSA-N 0 3 422.617 4.221 20 0 HIADHN C[C@@H]1CC[C@@H](NC(=O)N(Cc2ccccc2Br)C2CCN(C)CC2)C1 ZINC000460840683 873729159 /nfs/dbraw/zinc/72/91/59/873729159.db2.gz PMCBNXTYCGCKOR-NVXWUHKLSA-N 0 3 408.384 4.244 20 0 HIADHN CC(C)C[C@H](C)NC(=O)N(Cc1ccccc1Br)C1CCN(C)CC1 ZINC000460943821 873842731 /nfs/dbraw/zinc/84/27/31/873842731.db2.gz AYYRNJVLGYMMHQ-INIZCTEOSA-N 0 3 410.400 4.490 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2ccc(OC3CCOCC3)cc2)N2CCCC2)cc1 ZINC000460954710 873852524 /nfs/dbraw/zinc/85/25/24/873852524.db2.gz WGBYZRARZGRSQC-DEOSSOPVSA-N 0 3 408.542 4.120 20 0 HIADHN CSC1(CNC(=O)c2ccccc2C(=O)c2cc(C)ccc2C)CCN(C)CC1 ZINC000460957984 873855421 /nfs/dbraw/zinc/85/54/21/873855421.db2.gz NRHUTYLVTMYHHS-UHFFFAOYSA-N 0 3 410.583 4.092 20 0 HIADHN Cc1ccccc1[C@@H](NCc1ccc(N2CCCS2(=O)=O)cc1)c1ccccc1 ZINC000461083884 873996059 /nfs/dbraw/zinc/99/60/59/873996059.db2.gz KYGDAHGWBJFGCZ-DEOSSOPVSA-N 0 3 406.551 4.414 20 0 HIADHN CCOc1ccc(CN(C(=O)c2ccc(N3CCN(CC)CC3)cc2)C(C)C)cc1 ZINC000468678590 882806591 /nfs/dbraw/zinc/80/65/91/882806591.db2.gz XMLRTJUZRCVBNS-UHFFFAOYSA-N 0 3 409.574 4.278 20 0 HIADHN CC[C@H]1Cc2ccccc2CN1Cc1ccc(OCC(=O)N2CCCC2)c(OC)c1 ZINC000468686000 882811265 /nfs/dbraw/zinc/81/12/65/882811265.db2.gz BSLYQPYGZAYJRJ-QFIPXVFZSA-N 0 3 408.542 4.033 20 0 HIADHN COc1ccc([C@H](Cc2ccccc2C)NC(=O)CN2[C@@H](C)CC[C@@H]2C)cc1OC ZINC000468704484 882822527 /nfs/dbraw/zinc/82/25/27/882822527.db2.gz VIQMLTBEKDSBLB-IPJJNNNSSA-N 0 3 410.558 4.285 20 0 HIADHN Cc1cccnc1C(C)(C)CNC(=O)NC[C@H](c1ccc(OC(C)C)cc1)N(C)C ZINC000461416913 874437355 /nfs/dbraw/zinc/43/73/55/874437355.db2.gz IKRRARMXIPCYNJ-OAQYLSRUSA-N 0 3 412.578 4.057 20 0 HIADHN O=C(CCC(=O)N1C[C@@H]2CCN(Cc3ccccc3)C[C@H]2C1)c1ccc(Cl)cc1 ZINC000461433325 874482098 /nfs/dbraw/zinc/48/20/98/874482098.db2.gz VUHWDZIURIATOA-SFTDATJTSA-N 0 3 410.945 4.283 20 0 HIADHN COc1ccc(C(=O)CCCC(=O)N2C[C@H]3CCN(Cc4ccccc4)C[C@H]3C2)cc1 ZINC000461433250 874482529 /nfs/dbraw/zinc/48/25/29/874482529.db2.gz WLOJSLGSNKSKIZ-PKTZIBPZSA-N 0 3 420.553 4.029 20 0 HIADHN COCc1nc2n(n1)C[C@@H](NCc1ccccc1Oc1ccc(F)cc1Cl)CC2 ZINC000461433763 874482967 /nfs/dbraw/zinc/48/29/67/874482967.db2.gz XAJBTTPCXSJXNO-INIZCTEOSA-N 0 3 416.884 4.114 20 0 HIADHN O=C(NCc1nc2c(s1)C[C@H](c1ccccc1)CC2)[C@H]1CCCN1C1CCCC1 ZINC000468731978 882832833 /nfs/dbraw/zinc/83/28/33/882832833.db2.gz BUKXHODADZLIHK-WIYYLYMNSA-N 0 3 409.599 4.439 20 0 HIADHN COc1ccccc1-c1ccc(CNCc2ccc(N3CCCS3(=O)=O)cc2)cc1 ZINC000461440588 874496106 /nfs/dbraw/zinc/49/61/06/874496106.db2.gz YLFPNIGVFNRCDC-UHFFFAOYSA-N 0 3 422.550 4.192 20 0 HIADHN O=C(C[C@H]1CCCc2ccccc21)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000461447356 874506226 /nfs/dbraw/zinc/50/62/26/874506226.db2.gz LSOVUHYJGNRDBG-HXUWFJFHSA-N 0 3 410.533 4.295 20 0 HIADHN O=C(CC1(N2CCOCC2)CCCC1)N1Cc2ccccc2C[C@H]1c1ccccc1 ZINC000468791515 882862021 /nfs/dbraw/zinc/86/20/21/882862021.db2.gz CGQNEIGWQKAFIH-DEOSSOPVSA-N 0 3 404.554 4.348 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)N(C)[C@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000461710859 874859758 /nfs/dbraw/zinc/85/97/58/874859758.db2.gz ULPSLFDULKVVDY-LEOXJPRUSA-N 0 3 413.537 4.208 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)N(Cc1ccccc1)CC1CCOCC1 ZINC000461725758 874872515 /nfs/dbraw/zinc/87/25/15/874872515.db2.gz LDXORPZIYBDFDG-OAQYLSRUSA-N 0 3 409.574 4.145 20 0 HIADHN CN(C)C[C@H](NC(=O)NC[C@H]1CC[C@H](c2ccccc2)O1)c1ccc(Cl)cc1 ZINC000461773420 874902414 /nfs/dbraw/zinc/90/24/14/874902414.db2.gz OTVXACKVDUTVDQ-QHAWAJNXSA-N 0 3 401.938 4.162 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)c2ccnc(Oc3ccc(F)cc3F)c2)o1 ZINC000468836983 882883871 /nfs/dbraw/zinc/88/38/71/882883871.db2.gz DXVHBFAUCCTHQN-UHFFFAOYSA-N 0 3 415.440 4.258 20 0 HIADHN CC(C)c1nnc(N2C[C@H](C)N(Cc3ccccc3)C[C@H]2C)n1C[C@H]1CCCCO1 ZINC000461874944 875028943 /nfs/dbraw/zinc/02/89/43/875028943.db2.gz MBZSREWPJGZTMP-TUNNFDKTSA-N 0 3 411.594 4.070 20 0 HIADHN CC(C)c1nc(CN(C)[C@@H]2CCN(CCOc3cccc(C(C)(C)C)c3)C2)no1 ZINC000461902734 875047905 /nfs/dbraw/zinc/04/79/05/875047905.db2.gz LBVUVKVRYNHHHQ-LJQANCHMSA-N 0 3 400.567 4.076 20 0 HIADHN Cc1cccc(F)c1NC(=O)N(CCN(C)C)Cc1ccc(Br)cc1 ZINC000461915035 875057301 /nfs/dbraw/zinc/05/73/01/875057301.db2.gz KZSWPYQSBINOOQ-UHFFFAOYSA-N 0 3 408.315 4.492 20 0 HIADHN C[C@@H](NC(=O)CCN1CCN(c2ccccc2)CC1)c1ccc(C(F)(F)F)cc1 ZINC000462038820 875151824 /nfs/dbraw/zinc/15/18/24/875151824.db2.gz LXHXURHIMFCQKO-QGZVFWFLSA-N 0 3 405.464 4.095 20 0 HIADHN Cc1ccccc1-c1cc(NC(=O)N(CCN(C)C)Cc2cccc(F)c2)n(C)n1 ZINC000462088468 875198734 /nfs/dbraw/zinc/19/87/34/875198734.db2.gz DTCIRJUDCNBWBP-UHFFFAOYSA-N 0 3 409.509 4.130 20 0 HIADHN C[C@@H](NC(=O)N1CC[C@H](CN(C)Cc2cccnc2)C1)c1ccc(C(F)(F)F)cc1 ZINC000462164241 875259896 /nfs/dbraw/zinc/25/98/96/875259896.db2.gz ZIBLNABAVMMRBM-SJLPKXTDSA-N 0 3 420.479 4.325 20 0 HIADHN Cc1nc(COc2cccc(C(=O)N[C@@H]3CN(Cc4ccccc4)C[C@H]3C)c2)cs1 ZINC000462166203 875263071 /nfs/dbraw/zinc/26/30/71/875263071.db2.gz FAXKTBKSUZXPQX-UZUQRXQVSA-N 0 3 421.566 4.281 20 0 HIADHN C[C@@H]1CCCN(c2cc(C(=O)N3CC[C@@H](C)N(Cc4ccccc4)CC3)ccn2)C1 ZINC000462176247 875274958 /nfs/dbraw/zinc/27/49/58/875274958.db2.gz BWAQTHCTPURBCM-NHCUHLMSSA-N 0 3 406.574 4.055 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C)c1nc(C(C)(C)C)cs1 ZINC000462191426 875298894 /nfs/dbraw/zinc/29/88/94/875298894.db2.gz SINFKXCLEBEZKS-SOLBZPMBSA-N 0 3 400.592 4.321 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)NC[C@H](Cc1ccccc1)C(F)(F)F ZINC000462224550 875333281 /nfs/dbraw/zinc/33/32/81/875333281.db2.gz NFGBECBFGCAELW-KRWDZBQOSA-N 0 3 413.509 4.243 20 0 HIADHN CC(C)CC(=O)Nc1ccc(NC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)cc1 ZINC000462241417 875357445 /nfs/dbraw/zinc/35/74/45/875357445.db2.gz ODOAAKPLKLRKAJ-PGRDOPGGSA-N 0 3 408.546 4.313 20 0 HIADHN C[C@@H](C(=O)NC1CCN([C@H](C)c2ccncc2)CC1)c1cccc(Br)c1 ZINC000462247279 875364691 /nfs/dbraw/zinc/36/46/91/875364691.db2.gz OMIJNKUVPROOHP-HZPDHXFCSA-N 0 3 416.363 4.289 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)Nc1cc2c(cc1Cl)OCCCO2 ZINC000462247363 875366702 /nfs/dbraw/zinc/36/67/02/875366702.db2.gz NTBMMPSFCNZLDH-BEFAXECRSA-N 0 3 415.921 4.143 20 0 HIADHN COc1ccc(Br)c(NC(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)c1 ZINC000462253587 875375823 /nfs/dbraw/zinc/37/58/23/875375823.db2.gz IEHBOGPSKOFJHJ-KUHUBIRLSA-N 0 3 418.335 4.100 20 0 HIADHN CC(C)[C@H](Oc1ccc(Cl)cc1)C(=O)NC1CCN([C@H](C)c2ccncc2)CC1 ZINC000462256924 875380223 /nfs/dbraw/zinc/38/02/23/875380223.db2.gz UTRVDGNUKLUBLP-VGSWGCGISA-N 0 3 415.965 4.480 20 0 HIADHN CCCC(=O)Nc1cccc(NC(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)c1C ZINC000462272143 875400334 /nfs/dbraw/zinc/40/03/34/875400334.db2.gz QMOQXXJDZWHLDU-JTSKRJEESA-N 0 3 408.546 4.376 20 0 HIADHN CCCC(=O)Nc1cccc(NC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)c1C ZINC000462272144 875400394 /nfs/dbraw/zinc/40/03/94/875400394.db2.gz QMOQXXJDZWHLDU-VGOFRKELSA-N 0 3 408.546 4.376 20 0 HIADHN CC(C)Cn1ncc(NC(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)c1C(F)F ZINC000462273317 875401827 /nfs/dbraw/zinc/40/18/27/875401827.db2.gz BQYPDQZARSVQFD-QAPCUYQASA-N 0 3 405.493 4.119 20 0 HIADHN CC(C)Cn1cc(NC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)c(C(F)F)n1 ZINC000462281227 875407550 /nfs/dbraw/zinc/40/75/50/875407550.db2.gz YTZCQMWTAXKBGL-NVXWUHKLSA-N 0 3 405.493 4.119 20 0 HIADHN CC(C)Cn1cc(NC(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)c(C(F)F)n1 ZINC000462281228 875407754 /nfs/dbraw/zinc/40/77/54/875407754.db2.gz YTZCQMWTAXKBGL-RDJZCZTQSA-N 0 3 405.493 4.119 20 0 HIADHN CCCN1c2ccc(NC(=O)N[C@H]3CN(Cc4ccccc4)C[C@H]3C)cc2CCC1=O ZINC000462287325 875411320 /nfs/dbraw/zinc/41/13/20/875411320.db2.gz CVNDGHPVHGPQDZ-GCJKJVERSA-N 0 3 420.557 4.018 20 0 HIADHN C[C@@H](NCC(=O)NCCCN1CCCCCC1=O)c1ccc(Cl)c2ccccc21 ZINC000462452157 875559372 /nfs/dbraw/zinc/55/93/72/875559372.db2.gz AIELXGVPMYNSAP-QGZVFWFLSA-N 0 3 415.965 4.053 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)[C@H](C)c3cccc(Br)c3)c2)CC1 ZINC000462487200 875598375 /nfs/dbraw/zinc/59/83/75/875598375.db2.gz DBCGMZNEQXHWFX-MRXNPFEDSA-N 0 3 416.363 4.333 20 0 HIADHN COc1ccc(OCc2nc(CN[C@@H]3CN(Cc4ccccc4)C[C@H]3C)cs2)cc1 ZINC000462553033 875677845 /nfs/dbraw/zinc/67/78/45/875677845.db2.gz PPGHHFXMXDNOPJ-WZONZLPQSA-N 0 3 423.582 4.341 20 0 HIADHN Cc1cc(CN[C@@H]2CC(=O)N([C@H]3C[C@H]3c3ccccc3)C2)ccc1Oc1cccnc1 ZINC000462744388 875814110 /nfs/dbraw/zinc/81/41/10/875814110.db2.gz GHXGUOVDBLJRFI-NHTMILBNSA-N 0 3 413.521 4.429 20 0 HIADHN CO[C@@H](CNCc1cc(Br)c2c(c1)OCCO2)c1cccc(Cl)c1 ZINC000462756471 875820973 /nfs/dbraw/zinc/82/09/73/875820973.db2.gz NKPJULKZTNFJQJ-KRWDZBQOSA-N 0 3 412.711 4.351 20 0 HIADHN COc1ccccc1[C@@H](CNc1ncccc1C(=O)N1CCCCC1)N1CCCCC1 ZINC000462778084 875835067 /nfs/dbraw/zinc/83/50/67/875835067.db2.gz QZDHDBXOFWSOGI-JOCHJYFZSA-N 0 3 422.573 4.355 20 0 HIADHN Cc1ccccc1C(=O)NC1CCN(Cc2ccc(C(=O)OC(C)(C)C)cc2)CC1 ZINC000462788982 875841960 /nfs/dbraw/zinc/84/19/60/875841960.db2.gz BZJDZBFYJVDVCM-UHFFFAOYSA-N 0 3 408.542 4.345 20 0 HIADHN C[C@H]1CN(Cc2cccc(CNCc3ccc(C(=O)OC(C)(C)C)cc3)c2)CCO1 ZINC000462796203 875846084 /nfs/dbraw/zinc/84/60/84/875846084.db2.gz KTSSNNBMOLGNGJ-IBGZPJMESA-N 0 3 410.558 4.152 20 0 HIADHN Cc1noc(C)c1COc1ccccc1C(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C ZINC000462812404 875856320 /nfs/dbraw/zinc/85/63/20/875856320.db2.gz NLTRRXCTDXCXPN-HXOBKFHXSA-N 0 3 419.525 4.121 20 0 HIADHN C=Cc1ccc(CCN[C@H]2CCS(=O)(=O)c3ccc(Br)cc32)cc1 ZINC000462818941 875858757 /nfs/dbraw/zinc/85/87/57/875858757.db2.gz LPKHXJLCHIDMKB-SFHVURJKSA-N 0 3 406.345 4.143 20 0 HIADHN O=C(c1cccnc1N[C@H]1CCCN(Cc2ccccc2)C1)N1CCc2ccccc21 ZINC000462924510 875952653 /nfs/dbraw/zinc/95/26/53/875952653.db2.gz GEFDYHRDSOVFKR-QFIPXVFZSA-N 0 3 412.537 4.361 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N[C@H]2CCO[C@H](c3ccccc3)C2)N2CCCC2)cc1 ZINC000463018251 876036147 /nfs/dbraw/zinc/03/61/47/876036147.db2.gz BXRKUXFRFAAVLO-HJOGWXRNSA-N 0 3 407.558 4.351 20 0 HIADHN COc1cc(CN(C)C(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)ccc1SC ZINC000463023248 876041859 /nfs/dbraw/zinc/04/18/59/876041859.db2.gz UQNPYNRKGMENCL-PXNSSMCTSA-N 0 3 413.587 4.079 20 0 HIADHN CN(Cc1nc2ccc(Br)cc2o1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000463114732 876154894 /nfs/dbraw/zinc/15/48/94/876154894.db2.gz VAJFDZQIKLMEIY-KRWDZBQOSA-N 0 3 400.320 4.297 20 0 HIADHN C[C@@H](CCc1ccccc1F)C(=O)NCCCCN1CCN(c2ccccc2)CC1 ZINC000463127473 876172567 /nfs/dbraw/zinc/17/25/67/876172567.db2.gz NPRSTJSETGVFLT-NRFANRHFSA-N 0 3 411.565 4.113 20 0 HIADHN O=C(CCCc1ccc([O-])c(F)c1)N1CC[C@H]2[C@@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000468936219 883001902 /nfs/dbraw/zinc/00/19/02/883001902.db2.gz MFDUMEDESIBZPK-GMAHTHKFSA-N 0 3 410.533 4.367 20 0 HIADHN O=C(CCCc1ccc([O-])c(F)c1)N1CC[C@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000468936219 883001920 /nfs/dbraw/zinc/00/19/20/883001920.db2.gz MFDUMEDESIBZPK-GMAHTHKFSA-N 0 3 410.533 4.367 20 0 HIADHN C[C@@H](C(=O)N(CCN(C)C)Cc1ccccc1F)c1ccc(Br)s1 ZINC000463153759 876206362 /nfs/dbraw/zinc/20/63/62/876206362.db2.gz SXPRLJRURLCPIE-CYBMUJFWSA-N 0 3 413.356 4.344 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)c2cccc(-c3noc(C4CC4)n3)c2)C1 ZINC000463155165 876208389 /nfs/dbraw/zinc/20/83/89/876208389.db2.gz HFJHGHAGXBFGLE-IERDGZPVSA-N 0 3 402.498 4.179 20 0 HIADHN O=C(CN1CCCC[C@@H]1[C@@H]1CCCC[C@@H]1O)N[C@@H](c1cccs1)c1ccccc1 ZINC000463200222 876261261 /nfs/dbraw/zinc/26/12/61/876261261.db2.gz AWOXEZXUMKTBMP-SEDAZVQISA-N 0 3 412.599 4.359 20 0 HIADHN OC[C@@H]1CN(Cc2nc3ccc(Br)cc3o2)C[C@H]1c1ccc(Cl)cc1 ZINC000463209791 876270558 /nfs/dbraw/zinc/27/05/58/876270558.db2.gz AOTSHYOFCQESAV-BBRMVZONSA-N 0 3 421.722 4.452 20 0 HIADHN C[C@@H]1CC[C@H](O)[C@H]([C@@H]2CCCCN2Cc2nc3ccc(Br)cc3n2C)C1 ZINC000463214389 876273559 /nfs/dbraw/zinc/27/35/59/876273559.db2.gz PVSOPDGRHLTBNT-CQEAQJRCSA-N 0 3 420.395 4.487 20 0 HIADHN C[C@@H]1CC[C@H](O)[C@@H]([C@H]2CCCCN2Cc2nc3ccc(Br)cc3n2C)C1 ZINC000463214390 876273640 /nfs/dbraw/zinc/27/36/40/876273640.db2.gz PVSOPDGRHLTBNT-ODZKNYGOSA-N 0 3 420.395 4.487 20 0 HIADHN Nc1c(Br)cc(Br)cc1CNCCOCc1ccccc1 ZINC000463243384 876300403 /nfs/dbraw/zinc/30/04/03/876300403.db2.gz REANDUJIYXLHGU-UHFFFAOYSA-N 0 3 414.141 4.100 20 0 HIADHN COc1ccccc1[C@H](NC(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C)c1ccco1 ZINC000463272976 876330787 /nfs/dbraw/zinc/33/07/87/876330787.db2.gz WGLQXUICONEZMP-ZHRMCQFGSA-N 0 3 419.525 4.197 20 0 HIADHN COC(=O)CCCN1CCC(Nc2ccc(-c3cn4cccc(C)c4n3)cc2)CC1 ZINC000463290568 876350601 /nfs/dbraw/zinc/35/06/01/876350601.db2.gz KUEWDGNZGVWCBS-UHFFFAOYSA-N 0 3 406.530 4.139 20 0 HIADHN Cc1cc(OC[C@H](O)CN2CC[C@](CO)(c3ccccc3)C2)c(C(C)C)cc1Cl ZINC000463440519 876497144 /nfs/dbraw/zinc/49/71/44/876497144.db2.gz FUCDQSDSPDYSPO-YKSBVNFPSA-N 0 3 417.977 4.148 20 0 HIADHN COc1ccc(-c2ncc(C(=O)N(CCN(C)C)Cc3cccc(F)c3)s2)cc1 ZINC000463529345 876602909 /nfs/dbraw/zinc/60/29/09/876602909.db2.gz XZUDMGGCXFRLLQ-UHFFFAOYSA-N 0 3 413.518 4.162 20 0 HIADHN Cc1cc(Br)cc(C(=O)N(Cc2ccccc2)C2CCN(C)CC2)c1 ZINC000463574985 876671809 /nfs/dbraw/zinc/67/18/09/876671809.db2.gz QJAVRYXTCQMNIB-UHFFFAOYSA-N 0 3 401.348 4.494 20 0 HIADHN COc1ccc(Cn2nc(C)c(CNC[C@@H](c3ccco3)N3CCCC3)c2C)cc1 ZINC000463745739 876867671 /nfs/dbraw/zinc/86/76/71/876867671.db2.gz OCTPHSBTESKTKG-QHCPKHFHSA-N 0 3 408.546 4.077 20 0 HIADHN O=C1[C@@H](NCc2cccc(-c3ccccn3)c2)CCCN1Cc1ccc(F)cc1F ZINC000469006779 883074894 /nfs/dbraw/zinc/07/48/94/883074894.db2.gz NVLQARCDRFVLMH-QHCPKHFHSA-N 0 3 407.464 4.308 20 0 HIADHN C[C@@H](CC(=O)c1ccccc1F)C(=O)NC1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1 ZINC000463826712 876942799 /nfs/dbraw/zinc/94/27/99/876942799.db2.gz KDJNRVOGMKHFDP-XSLAUPDRSA-N 0 3 408.517 4.346 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)c2cc(NC(=O)C(C)(C)C)ccc2F)CC1 ZINC000463828074 876944450 /nfs/dbraw/zinc/94/44/50/876944450.db2.gz QTWYGCMXTZNORO-UHFFFAOYSA-N 0 3 415.509 4.140 20 0 HIADHN C[C@@H](CNC(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1)Oc1ccccc1F ZINC000463929484 877049118 /nfs/dbraw/zinc/04/91/18/877049118.db2.gz VUKGLXMXADUKSK-HRAATJIYSA-N 0 3 424.438 4.164 20 0 HIADHN COc1ccc2[nH]c(C(=O)Nc3ccnn3[C@H]3CCN(Cc4ccccc4)C3)cc2c1 ZINC000469029221 883097703 /nfs/dbraw/zinc/09/77/03/883097703.db2.gz QWOKFYMCZJNVSO-IBGZPJMESA-N 0 3 415.497 4.072 20 0 HIADHN CCN1CCCN(C(=O)Nc2ccc(NC(=O)c3cccc(Cl)c3)c(F)c2)CC1 ZINC000463992578 877127002 /nfs/dbraw/zinc/12/70/02/877127002.db2.gz OCRDFOVPAHFLNU-UHFFFAOYSA-N 0 3 418.900 4.291 20 0 HIADHN Cc1cc(Br)cc(C(=O)Nc2cccc3c2CCN(CC(C)(C)O)C3)c1 ZINC000464134089 877295250 /nfs/dbraw/zinc/29/52/50/877295250.db2.gz OENHSDUKRWQQPO-UHFFFAOYSA-N 0 3 417.347 4.139 20 0 HIADHN Cc1nn(C(C)(C)C)cc1[C@@H](C)NC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C ZINC000464144478 877310885 /nfs/dbraw/zinc/31/08/85/877310885.db2.gz DSYVESLAZVDYTA-RBUKOAKNSA-N 0 3 411.594 4.314 20 0 HIADHN O=C(Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)c1cnnc(-c2ccccc2)c1 ZINC000464203669 877373661 /nfs/dbraw/zinc/37/36/61/877373661.db2.gz IEBHRXIDVBVAFD-QFIPXVFZSA-N 0 3 424.508 4.039 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)N2Cc3ccc(O)cc3C3(CC3)C2)N(C)C)cc1 ZINC000464394068 877595426 /nfs/dbraw/zinc/59/54/26/877595426.db2.gz VYZGEHQSQIETMO-HSZRJFAPSA-N 0 3 423.557 4.039 20 0 HIADHN CC[C@@H]1CCCC[C@@H]1OCC(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000464405694 877609410 /nfs/dbraw/zinc/60/94/10/877609410.db2.gz NGJTUKCEXOOFBD-FSSWDIPSSA-N 0 3 410.562 4.254 20 0 HIADHN COc1cc([C@H](C)NCCCS(=O)(=O)c2cccc(C)c2)ccc1OC(C)C ZINC000464481026 877701276 /nfs/dbraw/zinc/70/12/76/877701276.db2.gz NSQBIQUCZDNIJI-SFHVURJKSA-N 0 3 405.560 4.305 20 0 HIADHN COc1ccccc1S(=O)(=O)CCCN[C@@H](C)c1ccccc1C(F)(F)F ZINC000464490266 877708650 /nfs/dbraw/zinc/70/86/50/877708650.db2.gz LHYGZKSIXIAKDV-AWEZNQCLSA-N 0 3 401.450 4.229 20 0 HIADHN O=C(N1CCC(C(F)(F)F)CC1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000464510653 877734988 /nfs/dbraw/zinc/73/49/88/877734988.db2.gz UJLXEDVBQPRJSQ-QGZVFWFLSA-N 0 3 408.386 4.242 20 0 HIADHN O=C(CN(CCCOc1ccccc1)C1CCOCC1)N1CCC[C@@H]2CCCC[C@@H]21 ZINC000464575294 877797802 /nfs/dbraw/zinc/79/78/02/877797802.db2.gz FVDMNFGSMNUNPQ-URXFXBBRSA-N 0 3 414.590 4.118 20 0 HIADHN CCCN(CC(F)(F)F)C(=O)[C@@H]1CCCN(Cc2cc(-c3ccccc3)no2)C1 ZINC000464727245 877962330 /nfs/dbraw/zinc/96/23/30/877962330.db2.gz BEBLSXAGOLTPSX-QGZVFWFLSA-N 0 3 409.452 4.355 20 0 HIADHN C[C@@H](C(=O)NCCc1c[nH]c2ccccc12)N1CC[C@@H](CSc2ccccc2)C1 ZINC000464754051 877991983 /nfs/dbraw/zinc/99/19/83/877991983.db2.gz CTFVIUXHZVFXIP-RBUKOAKNSA-N 0 3 407.583 4.329 20 0 HIADHN CCS[C@@H]1CC[C@@H](N(C)CC(=O)N[C@H](c2ccc3c(c2)OCCCO3)C(C)C)C1 ZINC000464766541 878011363 /nfs/dbraw/zinc/01/13/63/878011363.db2.gz ALKSAJHDZNHPTI-PWHSHALESA-N 0 3 420.619 4.267 20 0 HIADHN CC(C)[C@@H](Cc1ccc(F)cc1)N(C)CC(=O)Nc1ccc2c(c1)OCCCO2 ZINC000464791891 878037937 /nfs/dbraw/zinc/03/79/37/878037937.db2.gz NVRRRKDSHVIBTI-HXUWFJFHSA-N 0 3 400.494 4.125 20 0 HIADHN CN(Cc1nc2c3ccccc3oc2c(=O)[n-]1)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000464840249 878106708 /nfs/dbraw/zinc/10/67/08/878106708.db2.gz TVAHDXSWRSYZOS-SFHVURJKSA-N 0 3 402.498 4.036 20 0 HIADHN CN(Cc1nc2c3ccccc3oc2c(=O)[n-]1)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000464840249 878106727 /nfs/dbraw/zinc/10/67/27/878106727.db2.gz TVAHDXSWRSYZOS-SFHVURJKSA-N 0 3 402.498 4.036 20 0 HIADHN C[C@H]1CCN(Cc2nc3c4ccccc4oc3c(=O)[n-]2)CC[N@@H+]1Cc1ccccc1 ZINC000464842143 878112886 /nfs/dbraw/zinc/11/28/86/878112886.db2.gz YSDYSKRCROWDBN-KRWDZBQOSA-N 0 3 402.498 4.178 20 0 HIADHN C[C@H]1CCN(Cc2nc3c4ccccc4oc3c(=O)[n-]2)CC[N@H+]1Cc1ccccc1 ZINC000464842143 878112891 /nfs/dbraw/zinc/11/28/91/878112891.db2.gz YSDYSKRCROWDBN-KRWDZBQOSA-N 0 3 402.498 4.178 20 0 HIADHN CCN(Cc1ccc(OCc2ccccc2)cc1)C(=O)CN1CCC[C@@H]2COCC[C@@H]21 ZINC000464851552 878129943 /nfs/dbraw/zinc/12/99/43/878129943.db2.gz PRMDJVRPJNLDLQ-NOZRDPDXSA-N 0 3 422.569 4.115 20 0 HIADHN CCN(Cc1ccc(OCc2ccccc2)cc1)C(=O)CN1CCC[C@@H]2COCC[C@H]21 ZINC000464851551 878130583 /nfs/dbraw/zinc/13/05/83/878130583.db2.gz PRMDJVRPJNLDLQ-ILBGXUMGSA-N 0 3 422.569 4.115 20 0 HIADHN COC(=O)c1cc(CN2CCC[C@H](c3nc(-c4cccc(F)c4)no3)C2)c(C)s1 ZINC000464863873 878145267 /nfs/dbraw/zinc/14/52/67/878145267.db2.gz BFAOKWQCSZDSRC-HNNXBMFYSA-N 0 3 415.490 4.412 20 0 HIADHN COC(=O)c1ccc(CN2CCC[C@@H](c3nc(-c4ccc(F)cc4)no3)C2)cc1F ZINC000464864173 878145372 /nfs/dbraw/zinc/14/53/72/878145372.db2.gz HQJCPCKQFIPRJZ-MRXNPFEDSA-N 0 3 413.424 4.181 20 0 HIADHN COc1ccccc1NC(=O)c1ccc(NC(=O)[C@H](C)N2C[C@H]3CCC[C@@H]3C2)cc1 ZINC000464885994 878182248 /nfs/dbraw/zinc/18/22/48/878182248.db2.gz ADDYXMFRIZZWGJ-QXAKKESOSA-N 0 3 407.514 4.006 20 0 HIADHN C[C@@H]1CCN(C(=O)c2ccnc(OCc3ccccc3)c2)CCN1Cc1ccccc1 ZINC000464889264 878189816 /nfs/dbraw/zinc/18/98/16/878189816.db2.gz GHDHPEAQLAIDJX-OAQYLSRUSA-N 0 3 415.537 4.397 20 0 HIADHN COCCc1ccc(OCCCC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)cc1 ZINC000464893541 878196133 /nfs/dbraw/zinc/19/61/33/878196133.db2.gz NGKLPHNJOTUUEC-QFIPXVFZSA-N 0 3 424.585 4.158 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(C)c1C(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1 ZINC000464896759 878201986 /nfs/dbraw/zinc/20/19/86/878201986.db2.gz OJZHTJLJLFBOPB-SFHVURJKSA-N 0 3 420.532 4.365 20 0 HIADHN C[C@@H]1CCN(C(=O)Cc2csc(-c3ccccc3)n2)CCN1Cc1ccccc1 ZINC000464899502 878207956 /nfs/dbraw/zinc/20/79/56/878207956.db2.gz JLANGGYJTRSMPP-LJQANCHMSA-N 0 3 405.567 4.476 20 0 HIADHN Cc1oc(-c2cccs2)nc1CC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC000464909181 878224980 /nfs/dbraw/zinc/22/49/80/878224980.db2.gz XCFQQPHHJNMLRB-QGZVFWFLSA-N 0 3 409.555 4.377 20 0 HIADHN Cc1ccc([C@H](NC(=O)N[C@@H](CN(C)C)c2ccc(F)cc2)c2ccccn2)cc1 ZINC000503363765 912340206 /nfs/dbraw/zinc/34/02/06/912340206.db2.gz BHBJZARBFFVKCG-GOTSBHOMSA-N 0 3 406.505 4.221 20 0 HIADHN CO[C@]1(C)C[C@@H](N[C@H](C)C(=O)Nc2cccc(CSc3ccccn3)c2)C1(C)C ZINC000465405459 878841556 /nfs/dbraw/zinc/84/15/56/878841556.db2.gz JIICHGODKPDCJM-ZDWFVDTJSA-N 0 3 413.587 4.494 20 0 HIADHN O=C(NCc1c(F)cccc1OC(F)F)NC[C@H](c1cccs1)N1CCCC1 ZINC000465424535 878854266 /nfs/dbraw/zinc/85/42/66/878854266.db2.gz UIEZOAYCZJLRTK-OAHLLOKOSA-N 0 3 413.465 4.125 20 0 HIADHN O=C(NCc1ccc(-c2cccnc2)cc1)NC[C@@H](c1cccs1)N1CCCC1 ZINC000465425217 878854483 /nfs/dbraw/zinc/85/44/83/878854483.db2.gz QQFVSEHSYQMNTL-NRFANRHFSA-N 0 3 406.555 4.446 20 0 HIADHN CCc1ccc([C@H](COC)NC(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)o1 ZINC000465426679 878855900 /nfs/dbraw/zinc/85/59/00/878855900.db2.gz DGWKNARDBRJTQE-OALUTQOASA-N 0 3 419.591 4.363 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)N[C@@H](C)c2nc(C3CCCCC3)no2)N(C)C)cc1 ZINC000465431220 878863243 /nfs/dbraw/zinc/86/32/43/878863243.db2.gz JYAXTHNUPRGFKC-OXJNMPFZSA-N 0 3 413.566 4.343 20 0 HIADHN CO[C@H](CNC(=O)NC[C@@H](c1ccccc1)N1CCCC1)c1cccc(Cl)c1 ZINC000465432628 878864849 /nfs/dbraw/zinc/86/48/49/878864849.db2.gz YANFPAFTENMXEF-LEWJYISDSA-N 0 3 401.938 4.164 20 0 HIADHN COc1ccc([C@@H](C)CCNC(=O)NC[C@H](c2cccs2)N2CCCC2)cc1 ZINC000465433611 878865376 /nfs/dbraw/zinc/86/53/76/878865376.db2.gz NXKLAMUZKNOQLY-FXAWDEMLSA-N 0 3 401.576 4.387 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@@H]2CNC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000465439730 878871600 /nfs/dbraw/zinc/87/16/00/878871600.db2.gz YRCDCBBARGWMPP-SMIHKQSGSA-N 0 3 407.558 4.036 20 0 HIADHN CN(C)[C@H](CNC(=O)NCc1ccccc1CN(C)Cc1ccco1)c1ccccc1 ZINC000465449924 878880821 /nfs/dbraw/zinc/88/08/21/878880821.db2.gz WGRGBKAHCIFCRB-XMMPIXPASA-N 0 3 420.557 4.014 20 0 HIADHN COc1cccc([C@@H](CNC(=O)N[C@H](c2nc(C)cs2)C2CC2)N2CCCC2)c1 ZINC000465464581 878897377 /nfs/dbraw/zinc/89/73/77/878897377.db2.gz DJGVSNYHDHHIDJ-UXHICEINSA-N 0 3 414.575 4.048 20 0 HIADHN CN(C)CCN(C[C@@H]1CCCO1)C(=O)N[C@H](c1ccccc1)c1ccc(Cl)cc1 ZINC000465471673 878908310 /nfs/dbraw/zinc/90/83/10/878908310.db2.gz GHNZRFFGPYFTTH-FCHUYYIVSA-N 0 3 415.965 4.182 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N[C@H](C)c1ccc(-n2cccn2)cc1)c1ccsc1 ZINC000465533813 878992756 /nfs/dbraw/zinc/99/27/56/878992756.db2.gz MIIRRBRJTFZAAL-UTKZUKDTSA-N 0 3 411.575 4.377 20 0 HIADHN C[C@H](NC(=O)N[C@H](CN1CCCC1)c1ccccc1)c1ccc(-n2cccn2)cc1 ZINC000465588073 879068550 /nfs/dbraw/zinc/06/85/50/879068550.db2.gz BKIJGYMLEZPDBQ-WMZHIEFXSA-N 0 3 403.530 4.070 20 0 HIADHN C[C@@H](NC(=O)N[C@@H](CN1CCCC1)c1ccccc1)c1nc(C2CCCCC2)no1 ZINC000465595588 879081625 /nfs/dbraw/zinc/08/16/25/879081625.db2.gz JACSQIAGYYNVSR-XLIONFOSSA-N 0 3 411.550 4.315 20 0 HIADHN CC[C@@H](Cc1ccccc1)N(C)C(=O)NCCCN1CCN(C)C[C@@H]1c1ccccc1 ZINC000465610606 879106320 /nfs/dbraw/zinc/10/63/20/879106320.db2.gz WOEFEYANHSHHTM-LOSJGSFVSA-N 0 3 422.617 4.028 20 0 HIADHN CC(C)(C)c1ccc(OC[C@H](O)CN2CCC[C@H](c3ncc4n3CCCC4)C2)cc1 ZINC000503430446 912427662 /nfs/dbraw/zinc/42/76/62/912427662.db2.gz CWATYLRZMCICNY-SIKLNZKXSA-N 0 3 411.590 4.136 20 0 HIADHN CCO[C@@H](C)c1nc(CN(C)C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)cs1 ZINC000465688682 879238412 /nfs/dbraw/zinc/23/84/12/879238412.db2.gz JKHPWMMICOOEDD-HKUYNNGSSA-N 0 3 416.591 4.047 20 0 HIADHN O=C(NC1CCCCC1)C1CCN(Cc2ccccc2OCc2ccncc2)CC1 ZINC000512370460 921111324 /nfs/dbraw/zinc/11/13/24/921111324.db2.gz RKTQKPZPVSARAZ-UHFFFAOYSA-N 0 3 407.558 4.322 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N[C@@H](C)c2nc(C3CCCCC3)no2)C1 ZINC000465753994 879344734 /nfs/dbraw/zinc/34/47/34/879344734.db2.gz LEISNVDMDMDCQZ-QKLQHJQFSA-N 0 3 411.550 4.313 20 0 HIADHN CCO[C@H](C)c1nc(CN(C)C(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)cs1 ZINC000465760004 879354386 /nfs/dbraw/zinc/35/43/86/879354386.db2.gz QJEBPJOSVUMEDB-YQVWRLOYSA-N 0 3 416.591 4.218 20 0 HIADHN C[C@H](NC(=O)NC[C@H]1CCCCN1Cc1ccccc1)c1ccc(-n2cccn2)cc1 ZINC000465790698 879398832 /nfs/dbraw/zinc/39/88/32/879398832.db2.gz RQGQSOKRAYVFCU-GBXCKJPGSA-N 0 3 417.557 4.287 20 0 HIADHN C[C@H]1CCN(C(=O)NCCc2c[nH]c3cc(F)ccc23)CCN1Cc1ccccc1 ZINC000465805024 879418865 /nfs/dbraw/zinc/41/88/65/879418865.db2.gz DZFHOQVHALPTKW-SFHVURJKSA-N 0 3 408.521 4.156 20 0 HIADHN COc1ccc(CC[C@@H](C)NC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)cc1 ZINC000465818354 879442400 /nfs/dbraw/zinc/44/24/00/879442400.db2.gz PVBBHNIYWJPBFZ-NHCUHLMSSA-N 0 3 409.574 4.322 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)N[C@@H](C)c2ccc(Oc3ccccc3)cc2)CC1 ZINC000465823459 879452126 /nfs/dbraw/zinc/45/21/26/879452126.db2.gz WHJUYPJBPZAWCT-SFTDATJTSA-N 0 3 424.589 4.113 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)N[C@@H](C)c2ccc(Oc3ccccc3)cc2)CC1 ZINC000465823458 879452543 /nfs/dbraw/zinc/45/25/43/879452543.db2.gz WHJUYPJBPZAWCT-RTWAWAEBSA-N 0 3 424.589 4.113 20 0 HIADHN CCC[C@@H](NC(=O)N(CCN(C)C)C[C@@H]1CCCO1)c1cccc(C(F)(F)F)c1 ZINC000465844948 879484700 /nfs/dbraw/zinc/48/47/00/879484700.db2.gz MUHWWKUBKNQDDT-RBUKOAKNSA-N 0 3 415.500 4.299 20 0 HIADHN C[C@H](CNC(=O)NC(C)(C)c1nc(C(F)(F)F)cs1)N(C)Cc1ccccc1 ZINC000465880629 879535744 /nfs/dbraw/zinc/53/57/44/879535744.db2.gz SORBHVKTYCOKKU-CYBMUJFWSA-N 0 3 414.497 4.217 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)N[C@H](c2ccc(Cl)cc2)C2CCCC2)CC1 ZINC000465903910 879565018 /nfs/dbraw/zinc/56/50/18/879565018.db2.gz XURFZDGZQHBXBT-GCJKJVERSA-N 0 3 421.029 4.144 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)N[C@@H](c2ccc(Cl)cc2)C2CCCC2)CC1 ZINC000465903911 879565836 /nfs/dbraw/zinc/56/58/36/879565836.db2.gz XURFZDGZQHBXBT-PGRDOPGGSA-N 0 3 421.029 4.144 20 0 HIADHN Cc1c2ccccc2oc1[C@H](NC(=O)N(CCN(C)C)C[C@H]1CCCO1)C(C)C ZINC000465924710 879587926 /nfs/dbraw/zinc/58/79/26/879587926.db2.gz SLDPYRJKNQPKPL-WIYYLYMNSA-N 0 3 401.551 4.191 20 0 HIADHN COc1cccc([C@@H](Cc2cc(C)cc(C)c2)NC(=O)N[C@H]2CCN(C3CC3)C2)c1 ZINC000466011099 879690502 /nfs/dbraw/zinc/69/05/02/879690502.db2.gz CBZQWCYUPNCLOA-XUZZJYLKSA-N 0 3 407.558 4.132 20 0 HIADHN CSc1cccc([C@@H](NC(=O)N[C@@H]2CCN(C3CC3)C2)c2ccc(F)c(F)c2)c1 ZINC000466023454 879710064 /nfs/dbraw/zinc/71/00/64/879710064.db2.gz SVNSCDYMRBXBNE-IIBYNOLFSA-N 0 3 417.525 4.312 20 0 HIADHN CSc1cccc([C@H](NC(=O)N[C@H]2CCN(C3CC3)C2)c2cc(F)ccc2F)c1 ZINC000466026330 879713674 /nfs/dbraw/zinc/71/36/74/879713674.db2.gz OAXADTOSXHZIMK-KKSFZXQISA-N 0 3 417.525 4.312 20 0 HIADHN COc1cccc([C@H](Cc2cc(C)cc(C)c2)NC(=O)N2CCN(C)CC[C@H]2C)c1 ZINC000466036677 879725115 /nfs/dbraw/zinc/72/51/15/879725115.db2.gz OVLVCRURDXOFCX-YKSBVNFPSA-N 0 3 409.574 4.331 20 0 HIADHN COc1ccccc1[C@]1(C)C[C@H]1NC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C ZINC000466046370 879736640 /nfs/dbraw/zinc/73/66/40/879736640.db2.gz FTPFOJSTOOSEAB-CYSDGLOUSA-N 0 3 407.558 4.031 20 0 HIADHN CC[C@H](C)[C@@H](NC(=O)N1CCN(CC2CCOCC2)CC1)c1ccc(Cl)cc1 ZINC000466062666 879759406 /nfs/dbraw/zinc/75/94/06/879759406.db2.gz CFJPJDCGQUTDDI-LAUBAEHRSA-N 0 3 407.986 4.181 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)NC3CC(c4cccc(Cl)c4)C3)CC2)C[C@@H](C)O1 ZINC000466106832 879823104 /nfs/dbraw/zinc/82/31/04/879823104.db2.gz KNNWPZJVOIUUBK-UNQDTOCMSA-N 0 3 419.997 4.117 20 0 HIADHN COc1cccc(F)c1[C@@H](C)NC(=O)N(CCN(C)C)Cc1cccc(Cl)c1 ZINC000466131541 879842885 /nfs/dbraw/zinc/84/28/85/879842885.db2.gz LZOHIUHSAQXQHK-OAHLLOKOSA-N 0 3 407.917 4.322 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)NCCc2c[nH]c3ccc(Cl)cc23)CC1 ZINC000466161959 879864690 /nfs/dbraw/zinc/86/46/90/879864690.db2.gz IMBLOICUXQFEFN-UHFFFAOYSA-N 0 3 414.937 4.263 20 0 HIADHN C[C@@H]1CCN(C)CCN1C(=O)N[C@@H](c1ccccc1Cl)c1cc(F)ccc1F ZINC000466236994 879944528 /nfs/dbraw/zinc/94/45/28/879944528.db2.gz ANMKQWDXRCGJEN-VLIAUNLRSA-N 0 3 407.892 4.443 20 0 HIADHN COc1ccc(CNC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1OC1CCCC1 ZINC000503474468 912514821 /nfs/dbraw/zinc/51/48/21/912514821.db2.gz QOMLQMWQMPQUTF-OAQYLSRUSA-N 0 3 423.557 4.090 20 0 HIADHN COc1ccc(C(C)(C)C(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)cc1OC ZINC000466249669 879967024 /nfs/dbraw/zinc/96/70/24/879967024.db2.gz YHQPSVSAESLSIL-OAQYLSRUSA-N 0 3 410.558 4.104 20 0 HIADHN Cc1nc(-c2ccc(CNC(=O)N[C@@H]3C[C@H](C)N(Cc4ccccc4)C3)o2)cs1 ZINC000466253327 879975622 /nfs/dbraw/zinc/97/56/22/879975622.db2.gz OPBZWNCGTWZRQS-MAUKXSAKSA-N 0 3 410.543 4.174 20 0 HIADHN C[C@H](CNC(=O)N(CCN(C)C)Cc1ccc(F)cc1F)Sc1ccccc1 ZINC000466317840 880071829 /nfs/dbraw/zinc/07/18/29/880071829.db2.gz NRZBMTVIWLAMEM-MRXNPFEDSA-N 0 3 407.530 4.219 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)[C@@H]1CCO[C@H]1c1ccc(Cl)c(F)c1 ZINC000466330033 880082420 /nfs/dbraw/zinc/08/24/20/880082420.db2.gz DKMSGDZRNGADLF-ALALXSPKSA-N 0 3 416.924 4.193 20 0 HIADHN CN1CCCC(C)(C)[C@H]1CNC(=O)c1c(Br)cccc1Br ZINC000466353463 880110794 /nfs/dbraw/zinc/11/07/94/880110794.db2.gz TYZUNJIBQBNVAH-CYBMUJFWSA-N 0 3 418.173 4.062 20 0 HIADHN COc1ccc(C(=O)Nc2ccc(C(=O)Nc3cccc(CN(C)C)c3)s2)cc1 ZINC000466396598 880160515 /nfs/dbraw/zinc/16/05/15/880160515.db2.gz AHCMCSJEHLNJNT-UHFFFAOYSA-N 0 3 409.511 4.323 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cncc(-c4ccccc4)c3)c(C)c2)CC1 ZINC000466409855 880176824 /nfs/dbraw/zinc/17/68/24/880176824.db2.gz OSZYYGWYONWHPH-UHFFFAOYSA-N 0 3 400.526 4.451 20 0 HIADHN COc1ccc([C@@H](CNC(=O)NCCc2c[nH]c3cccc(C)c23)N2CCCC2)cc1 ZINC000503492735 912539574 /nfs/dbraw/zinc/53/95/74/912539574.db2.gz IXGIEYDGXUQQFP-HSZRJFAPSA-N 0 3 420.557 4.164 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NC[C@@H](C)c3ccc(F)cc3F)c(C)c2)CC1 ZINC000466423934 880196235 /nfs/dbraw/zinc/19/62/35/880196235.db2.gz BRNWODLXOITNMX-QGZVFWFLSA-N 0 3 416.516 4.340 20 0 HIADHN CO[C@H](C)[C@H](C)N[C@@H](C)C(=O)N1N=C(c2ccc(Cl)cc2)C[C@@H]1c1ccco1 ZINC000466429028 880204243 /nfs/dbraw/zinc/20/42/43/880204243.db2.gz UQKNZWADXORXEN-XTDOFWJNSA-N 0 3 403.910 4.012 20 0 HIADHN C[C@@H](CNC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1)c1ccc(F)cc1F ZINC000466430134 880205885 /nfs/dbraw/zinc/20/58/85/880205885.db2.gz CXFVEZKROMXBEX-ZWKOTPCHSA-N 0 3 401.501 4.374 20 0 HIADHN O=C1C[C@H](NCc2ccc(F)c3cccnc23)CN1Cc1ccccc1C(F)(F)F ZINC000466451014 880230173 /nfs/dbraw/zinc/23/01/73/880230173.db2.gz CMYXWEGXFAVSJM-INIZCTEOSA-N 0 3 417.406 4.283 20 0 HIADHN C[C@@H](C(=O)Nc1ccc(NC(=O)c2cccs2)cc1)N(C)CCC1CCOCC1 ZINC000466489008 880267203 /nfs/dbraw/zinc/26/72/03/880267203.db2.gz PZKQHUJLQZBBMG-INIZCTEOSA-N 0 3 415.559 4.076 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)N(C)Cc2ccccc2N2CCCC2)CN1Cc1ccccc1 ZINC000466511456 880285372 /nfs/dbraw/zinc/28/53/72/880285372.db2.gz BOWCEHVCNZDACK-OFNKIYASSA-N 0 3 406.574 4.091 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)NCc2ccc(-c3cccnc3)cc2)CN1Cc1ccccc1 ZINC000466511360 880286395 /nfs/dbraw/zinc/28/63/95/880286395.db2.gz AJBBJCIOHLETNX-NTKDMRAZSA-N 0 3 400.526 4.211 20 0 HIADHN Cc1cccc(Oc2cc(CNC(=O)N3CCN(C4CCCC4)CC3)ccn2)c1C ZINC000466521408 880297654 /nfs/dbraw/zinc/29/76/54/880297654.db2.gz YCPIOSJIUSKYIV-UHFFFAOYSA-N 0 3 408.546 4.261 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)N2CCC(c3c[nH]c4ncccc34)CC2)CN1Cc1ccccc1 ZINC000466523154 880299188 /nfs/dbraw/zinc/29/91/88/880299188.db2.gz UFVVJMXRWNTDEG-WIYYLYMNSA-N 0 3 417.557 4.115 20 0 HIADHN C[C@H](NC(=O)N[C@H]1C[C@@H](C)N(Cc2ccccc2)C1)c1nc(C2CCCCC2)no1 ZINC000466533826 880308249 /nfs/dbraw/zinc/30/82/49/880308249.db2.gz KDQLTYUIDCBMOC-UWVAXJGDSA-N 0 3 411.550 4.141 20 0 HIADHN COCCOc1ccc(NC(=O)N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)cc1Cl ZINC000466537786 880312853 /nfs/dbraw/zinc/31/28/53/880312853.db2.gz BPNGCSUBULEHMS-VQIMIIECSA-N 0 3 417.937 4.150 20 0 HIADHN CN(C(=O)NCc1ccc(OC(C)(C)C)cc1C(F)(F)F)[C@H]1CCN(C2CC2)C1 ZINC000466601365 880371932 /nfs/dbraw/zinc/37/19/32/880371932.db2.gz QKSYNCJSVWLYTL-INIZCTEOSA-N 0 3 413.484 4.261 20 0 HIADHN CN(C(=O)NCC1(Cc2ccccc2)CCC1)C1CCN(CCc2ccccn2)CC1 ZINC000466604760 880374278 /nfs/dbraw/zinc/37/42/78/880374278.db2.gz SGNSCIYAAMDNJG-UHFFFAOYSA-N 0 3 420.601 4.143 20 0 HIADHN CCc1c(NC(=O)N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)cnn1-c1ccccc1 ZINC000466653739 880430736 /nfs/dbraw/zinc/43/07/36/880430736.db2.gz DHRDWUJHQICLAP-ICSRJNTNSA-N 0 3 403.530 4.219 20 0 HIADHN COC(=O)c1ccc(C(C)C)c(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2)c1 ZINC000466657631 880436807 /nfs/dbraw/zinc/43/68/07/880436807.db2.gz SKYFMUSDPYZGPU-UHFFFAOYSA-N 0 3 415.509 4.331 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3cc(Cl)c(Cl)cn3)CC2)C[C@H](C)O1 ZINC000466664213 880446229 /nfs/dbraw/zinc/44/62/29/880446229.db2.gz KFHMXFJWUOZKPK-OKILXGFUSA-N 0 3 415.365 4.132 20 0 HIADHN CC[C@H](NC(=O)N(CCN(C)C)Cc1ccc(C)o1)c1nc(C(F)(F)F)cs1 ZINC000466705374 880496150 /nfs/dbraw/zinc/49/61/50/880496150.db2.gz UGSWSNZKIJBXHS-AWEZNQCLSA-N 0 3 418.485 4.288 20 0 HIADHN FC(F)(F)Oc1ccc(OCCN2CCC[C@@H](c3nnc4n3CCCCC4)C2)cc1 ZINC000466739074 880522498 /nfs/dbraw/zinc/52/24/98/880522498.db2.gz FXXQMTQYLTZGOG-MRXNPFEDSA-N 0 3 424.467 4.162 20 0 HIADHN Cc1cc(C(F)(F)F)ccc1CN[C@@H](Cc1ccc(C(F)(F)F)cc1)C(N)=O ZINC000466747897 880529720 /nfs/dbraw/zinc/52/97/20/880529720.db2.gz PRZYWDKTVPFCGW-INIZCTEOSA-N 0 3 404.354 4.219 20 0 HIADHN CCN(C(=O)c1ccc(C(=O)NC(C)C)cc1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000503530932 912585908 /nfs/dbraw/zinc/58/59/08/912585908.db2.gz OUKGJCXTUDXKSD-WMZHIEFXSA-N 0 3 407.558 4.122 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)N[C@H](C)c2ccc(SC)cc2)c1 ZINC000466845077 880614606 /nfs/dbraw/zinc/61/46/06/880614606.db2.gz XZKUPGSTJKLGHR-QGZVFWFLSA-N 0 3 401.576 4.252 20 0 HIADHN COCCc1ccccc1NC(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1 ZINC000466930529 880698232 /nfs/dbraw/zinc/69/82/32/880698232.db2.gz IRWJLEPVYPAGBH-UHFFFAOYSA-N 0 3 423.479 4.490 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N(C)CC[C@H]1CCCO1)c1ccc(C(F)(F)F)cc1 ZINC000466973170 880775881 /nfs/dbraw/zinc/77/58/81/880775881.db2.gz CATPVSBXJFKUSK-MOPGFXCFSA-N 0 3 415.500 4.299 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N(C)CC[C@@H]1CCCO1)c1ccc(C(F)(F)F)cc1 ZINC000466973171 880777206 /nfs/dbraw/zinc/77/72/06/880777206.db2.gz CATPVSBXJFKUSK-OALUTQOASA-N 0 3 415.500 4.299 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)C2(c3cccc(Cl)c3)CCOCC2)CN1Cc1ccccc1 ZINC000467029353 880828825 /nfs/dbraw/zinc/82/88/25/880828825.db2.gz SSFYPZISPXIIRZ-PGRDOPGGSA-N 0 3 412.961 4.167 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)c2cccc(OCc3cccnc3)c2)CN1Cc1ccccc1 ZINC000467030674 880829243 /nfs/dbraw/zinc/82/92/43/880829243.db2.gz CHLMGSJYEAKJCK-WMZHIEFXSA-N 0 3 401.510 4.053 20 0 HIADHN C[C@@H](NC(=O)N(CCN(C)C)Cc1cccc(F)c1)c1nc(C2CCCCC2)no1 ZINC000467056173 880845256 /nfs/dbraw/zinc/84/52/56/880845256.db2.gz GNJLMXIIKXHONG-MRXNPFEDSA-N 0 3 417.529 4.091 20 0 HIADHN C[C@H]1CCN(C)CCN1C(=O)NCc1csc(-c2ccc(C(F)(F)F)cc2)n1 ZINC000467060688 880846897 /nfs/dbraw/zinc/84/68/97/880846897.db2.gz ZDTAOZZIRJPGGS-ZDUSSCGKSA-N 0 3 412.481 4.065 20 0 HIADHN CC[C@@H]1CCCCN1CCNC(=O)c1ccc(NC(=O)c2ccc(OC)cc2)s1 ZINC000467108418 880867353 /nfs/dbraw/zinc/86/73/53/880867353.db2.gz BCRMVDXIYZFDMH-QGZVFWFLSA-N 0 3 415.559 4.003 20 0 HIADHN COc1ccc(Br)c(NC(=O)N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)c1 ZINC000467110854 880869485 /nfs/dbraw/zinc/86/94/85/880869485.db2.gz PCVYBDKPVVHSIY-GDBMZVCRSA-N 0 3 418.335 4.242 20 0 HIADHN COc1ccc(C(=O)Nc2ccc(C(=O)NCC(C)(C)N3CCCCC3)s2)cc1 ZINC000467113872 880871802 /nfs/dbraw/zinc/87/18/02/880871802.db2.gz HEYCVSHEEFIEBH-UHFFFAOYSA-N 0 3 415.559 4.003 20 0 HIADHN COC[C@@H]1CCCCN(CC(=O)NC[C@@H](c2c[nH]c3ccccc32)c2ccccc2)C1 ZINC000467121179 880876588 /nfs/dbraw/zinc/87/65/88/880876588.db2.gz VCDGSWOHXSVGSZ-NFBKMPQASA-N 0 3 419.569 4.165 20 0 HIADHN COC(=O)COc1ccc([C@H](C)N[C@@H](C)C(=O)Nc2ccc(C(C)(C)C)cc2)cc1 ZINC000467189910 880916639 /nfs/dbraw/zinc/91/66/39/880916639.db2.gz CMPPGKWRSAZDLI-IRXDYDNUSA-N 0 3 412.530 4.214 20 0 HIADHN COc1ccc(C(=O)Nc2ccc(C(=O)NCCN3[C@@H](C)CCC[C@@H]3C)s2)cc1 ZINC000467192180 880920579 /nfs/dbraw/zinc/92/05/79/880920579.db2.gz SMCIBNRJGXPAET-HOTGVXAUSA-N 0 3 415.559 4.002 20 0 HIADHN CO[C@@H](C)c1nc(CN2CCCN(C[C@@H]3CCC4(CCCCC4)O3)CC2)cs1 ZINC000467200430 880930321 /nfs/dbraw/zinc/93/03/21/880930321.db2.gz HWHKBQNOMLOIHC-ICSRJNTNSA-N 0 3 407.624 4.240 20 0 HIADHN COCC[C@H]1CCCCN(CC(=O)N[C@H](c2cccs2)c2ccc(F)cc2)C1 ZINC000467272708 881013698 /nfs/dbraw/zinc/01/36/98/881013698.db2.gz HAOIZWBURXZBFP-VGSWGCGISA-N 0 3 404.551 4.231 20 0 HIADHN Cc1c(F)cccc1NC(=O)N(CCN(C)C)Cc1ccc(Br)cc1 ZINC000467356222 881119047 /nfs/dbraw/zinc/11/90/47/881119047.db2.gz UKGQIXOHUHTBNN-UHFFFAOYSA-N 0 3 408.315 4.492 20 0 HIADHN C[C@@H](NC[C@@H](O)COc1cccc(Cl)c1Cl)c1ccnn1-c1ccccc1 ZINC000467382988 881162648 /nfs/dbraw/zinc/16/26/48/881162648.db2.gz CMCIXBUOTJPFPL-GDBMZVCRSA-N 0 3 406.313 4.270 20 0 HIADHN COc1ccc2c(c1)[C@H](N[C@H]1CC(=O)N(C)[C@@H]1c1ccc(F)c(F)c1)CCS2 ZINC000467394020 881178508 /nfs/dbraw/zinc/17/85/08/881178508.db2.gz BGASBNATLWXEFH-LVCYWYKZSA-N 0 3 404.482 4.072 20 0 HIADHN CC(C)(C)CCN1CCN(C(=O)Nc2ccccc2CC(=O)OC(C)(C)C)CC1 ZINC000467402999 881188177 /nfs/dbraw/zinc/18/81/77/881188177.db2.gz UPLFETPQQPWXSG-UHFFFAOYSA-N 0 3 403.567 4.157 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2ccccc2CC(=O)OC(C)(C)C)N(C)C)cc1 ZINC000467407211 881192266 /nfs/dbraw/zinc/19/22/66/881192266.db2.gz RWUUVYQWOWBQOK-OAQYLSRUSA-N 0 3 411.546 4.304 20 0 HIADHN CCS(=O)(=O)c1cccc(CN[C@@H]2CCc3cc(Br)cc(C)c32)c1 ZINC000467409748 881197151 /nfs/dbraw/zinc/19/71/51/881197151.db2.gz ADSHFVNPVQVCKY-GOSISDBHSA-N 0 3 408.361 4.328 20 0 HIADHN COc1ccc2c(c1)[C@H](N[C@H](C)c1ccc(OCC(=O)NC3CC3)cc1)CCS2 ZINC000467425325 881214819 /nfs/dbraw/zinc/21/48/19/881214819.db2.gz YTPQCGXHZNGOAY-QVKFZJNVSA-N 0 3 412.555 4.240 20 0 HIADHN Cc1cc(NC(=O)N[C@H](C)CC(F)(F)F)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000467437481 881236923 /nfs/dbraw/zinc/23/69/23/881236923.db2.gz BKFXRDQOVBRFTK-WBVHZDCISA-N 0 3 409.456 4.101 20 0 HIADHN C[C@H]1C[C@H](NC(=O)Nc2ccccc2CC(=O)OC(C)(C)C)CN1Cc1ccccc1 ZINC000467462413 881271919 /nfs/dbraw/zinc/27/19/19/881271919.db2.gz YUMCPDVJJPSCOS-RXVVDRJESA-N 0 3 423.557 4.355 20 0 HIADHN Cc1cc(NC(=O)N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)ccc1OC1CCOCC1 ZINC000467466192 881280393 /nfs/dbraw/zinc/28/03/93/881280393.db2.gz BZLNHDQDEHSVBK-KNQAVFIVSA-N 0 3 423.557 4.337 20 0 HIADHN CC(=O)N(Cc1ccc(NC(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)cc1)C(C)C ZINC000467476114 881294305 /nfs/dbraw/zinc/29/43/05/881294305.db2.gz NGGHDIYRBANGIY-YADARESESA-N 0 3 422.573 4.228 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)[C@H]1C[C@@H]1c1ccc(F)cc1 ZINC000467476093 881294497 /nfs/dbraw/zinc/29/44/97/881294497.db2.gz NASYOAHUBYKCEC-VSKRKVRLSA-N 0 3 404.489 4.211 20 0 HIADHN Cc1ccc([C@@H](CCn2cncn2)NCc2ccc(C)nc2-n2cc(Cl)cn2)cc1 ZINC000469056785 883130591 /nfs/dbraw/zinc/13/05/91/883130591.db2.gz UFBMNQPOWIQEPR-OAQYLSRUSA-N 0 3 421.936 4.050 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)CC1(O)CCCCC1)c1ccc(C(F)(F)F)cc1 ZINC000469065189 883141575 /nfs/dbraw/zinc/14/15/75/883141575.db2.gz QRVWWZAFZOVXGD-SFHVURJKSA-N 0 3 400.485 4.290 20 0 HIADHN COc1cc(CN[C@H](CC2CC2)c2ccc(Cl)cc2)ccc1OCC(=O)N(C)C ZINC000469079002 883164486 /nfs/dbraw/zinc/16/44/86/883164486.db2.gz XQOFRQBQEZECQA-HXUWFJFHSA-N 0 3 416.949 4.447 20 0 HIADHN COc1cc(C)c([C@@H](C)NCc2ccc(C)nc2-n2cc(Cl)cn2)cc1OC ZINC000469162239 883259028 /nfs/dbraw/zinc/25/90/28/883259028.db2.gz UJLRTTJJDOUFNF-OAHLLOKOSA-N 0 3 400.910 4.406 20 0 HIADHN CN(C)Cc1cccc(C(=O)N(Cc2cccs2)c2ccc3c(c2)OCCO3)c1 ZINC000469289087 883385401 /nfs/dbraw/zinc/38/54/01/883385401.db2.gz PSYUMAXRNSAQAG-UHFFFAOYSA-N 0 3 408.523 4.428 20 0 HIADHN CCN(C(=O)c1ccc(O[C@@H]2CCOC2)cc1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000469320163 883425826 /nfs/dbraw/zinc/42/58/26/883425826.db2.gz SIYQTHLBYGTJMV-BPUDTRNYSA-N 0 3 408.542 4.152 20 0 HIADHN CCN1CC[C@@H](N(C)S(=O)(=O)c2cc(Cl)ccc2OCC2CCC2)C[C@@H]1C ZINC000469338998 883450920 /nfs/dbraw/zinc/45/09/20/883450920.db2.gz SOVXSLBUJVNBHQ-MAUKXSAKSA-N 0 3 414.999 4.012 20 0 HIADHN Cc1cc(C(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)nn1-c1c(F)cccc1F ZINC000469388330 883536742 /nfs/dbraw/zinc/53/67/42/883536742.db2.gz JYKUDEIMHVUVFC-SFHVURJKSA-N 0 3 424.495 4.196 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)N[C@@H](c1ccccc1)[C@H]1CCOC1 ZINC000469428906 883613465 /nfs/dbraw/zinc/61/34/65/883613465.db2.gz WZNHFIDEVOFEEK-HJOGWXRNSA-N 0 3 409.574 4.220 20 0 HIADHN Cc1cc(C)c(NC(=O)CNC(=O)N[C@@H](CN(C)Cc2ccccc2)C(C)C)c(C)c1 ZINC000469431935 883616954 /nfs/dbraw/zinc/61/69/54/883616954.db2.gz LZDFALRROFTDSQ-QFIPXVFZSA-N 0 3 424.589 4.006 20 0 HIADHN Cc1cnc([C@@H](NC(=O)N[C@@H](CN(C)Cc2ccccc2)C(C)C)C2CC2)s1 ZINC000469438756 883626119 /nfs/dbraw/zinc/62/61/19/883626119.db2.gz OHDBVKJYATXOQN-PMACEKPBSA-N 0 3 400.592 4.358 20 0 HIADHN O=C(CCN1CCC(=Cc2ccc(F)c(F)c2)CC1)Nc1ccc2c(c1)OCO2 ZINC000469446566 883642580 /nfs/dbraw/zinc/64/25/80/883642580.db2.gz PQEKJGIHUKQIOS-UHFFFAOYSA-N 0 3 400.425 4.202 20 0 HIADHN COc1ccc(-c2nc(C)c(C(=O)N3CCCN(C4CCCC4)CC3)s2)c(F)c1 ZINC000503632403 912732543 /nfs/dbraw/zinc/73/25/43/912732543.db2.gz AYQKXXWFXLCNMO-UHFFFAOYSA-N 0 3 417.550 4.357 20 0 HIADHN CCNC(=O)c1ccc(NC(=O)N[C@H](CN(C)Cc2ccccc2)C(C)C)c(C)c1 ZINC000469472957 883701422 /nfs/dbraw/zinc/70/14/22/883701422.db2.gz SLUUSGSBXSFCMW-JOCHJYFZSA-N 0 3 410.562 4.023 20 0 HIADHN CC(=O)c1ccc(SCC(=O)N[C@@H](CN(C)Cc2ccccc2)C(C)C)cc1F ZINC000469478412 883710081 /nfs/dbraw/zinc/71/00/81/883710081.db2.gz RPFZBOXBSXXKEN-QFIPXVFZSA-N 0 3 416.562 4.393 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)c1ccc2c(c1)NC(=O)CCS2 ZINC000469480944 883713354 /nfs/dbraw/zinc/71/33/54/883713354.db2.gz BAFBNNCQDWETRR-HXUWFJFHSA-N 0 3 411.571 4.007 20 0 HIADHN Cn1cc(-c2cc(CN3CCC[C@@H](c4nc(-c5ccc(Cl)cc5)no4)C3)on2)cn1 ZINC000469520006 883786045 /nfs/dbraw/zinc/78/60/45/883786045.db2.gz BWCXFRIRTKNDMV-OAHLLOKOSA-N 0 3 424.892 4.158 20 0 HIADHN Cc1ccc(F)c(C(=O)N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)c1Br ZINC000469584439 883823970 /nfs/dbraw/zinc/82/39/70/883823970.db2.gz GQUDRPMISOHYBT-GDBMZVCRSA-N 0 3 405.311 4.289 20 0 HIADHN CCN(C(=O)c1cccc(CN(C)C)c1)C1CCN(c2cc(C)nc(C(C)C)n2)CC1 ZINC000469683666 883868864 /nfs/dbraw/zinc/86/88/64/883868864.db2.gz YCHOUMOOPYNXMH-UHFFFAOYSA-N 0 3 423.605 4.101 20 0 HIADHN COc1ccc([C@H](NCCOCC(F)F)c2ccccc2)cc1Br ZINC000469713397 883882852 /nfs/dbraw/zinc/88/28/52/883882852.db2.gz OGVHDKVBLIQAAV-GOSISDBHSA-N 0 3 400.263 4.418 20 0 HIADHN C[C@H](N[C@@H]1CCN(c2ccc(C(F)(F)F)cc2)C1=O)c1cccc(-n2ccnc2)c1 ZINC000469778092 883952713 /nfs/dbraw/zinc/95/27/13/883952713.db2.gz YPPXUZQBBZMEII-MGPUTAFESA-N 0 3 414.431 4.347 20 0 HIADHN CCN(C[C@H]1CCN(Cc2ccccc2)C1)C(=O)CCC(=O)c1ccc(Cl)cn1 ZINC000469815199 883992559 /nfs/dbraw/zinc/99/25/59/883992559.db2.gz BEILLNWBLVRDRI-IBGZPJMESA-N 0 3 413.949 4.069 20 0 HIADHN C[C@H](C(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1)c1ccc2ccccc2c1 ZINC000469862083 884050290 /nfs/dbraw/zinc/05/02/90/884050290.db2.gz LKIIEYCCLDZFTJ-CPJSRVTESA-N 0 3 402.538 4.351 20 0 HIADHN CC1CCN([C@H](CNC(=O)N2CC[C@@H](C)[C@@H](n3ccnc3)C2)c2cccs2)CC1 ZINC000469863824 884052052 /nfs/dbraw/zinc/05/20/52/884052052.db2.gz SYJYWSBUGMXJME-AQNXPRMDSA-N 0 3 415.607 4.010 20 0 HIADHN O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)C1(Cc2ccc(Cl)cc2)CC1 ZINC000469864710 884053060 /nfs/dbraw/zinc/05/30/60/884053060.db2.gz LMVZZFTYGCDUSE-JOCHJYFZSA-N 0 3 412.961 4.070 20 0 HIADHN O=C(C[C@@H](c1ccccc1)C(F)(F)F)NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000469873745 884063193 /nfs/dbraw/zinc/06/31/93/884063193.db2.gz SLPQGPQWWDASOY-RTWAWAEBSA-N 0 3 420.475 4.130 20 0 HIADHN CCC[C@@H]1C[C@@H](C(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)CCO1 ZINC000503678461 912784612 /nfs/dbraw/zinc/78/46/12/912784612.db2.gz GEALXJNUWYQBFE-BHDDXSALSA-N 0 3 410.562 4.172 20 0 HIADHN C[C@H](CO)N1CCCN(C(=O)Nc2cc(Cl)ccc2Sc2ccccc2)CC1 ZINC000469931343 884124913 /nfs/dbraw/zinc/12/49/13/884124913.db2.gz XMBGFLANYHEZRC-MRXNPFEDSA-N 0 3 419.978 4.412 20 0 HIADHN Cc1ccc([C@H]2OCCC[C@@H]2NC(=O)N(CCN(C)C)Cc2ccccc2F)cc1 ZINC000470029882 884260633 /nfs/dbraw/zinc/26/06/33/884260633.db2.gz NUYUVSNHGFUKPT-XZOQPEGZSA-N 0 3 413.537 4.128 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@H]2NC(=O)N[C@H](CN2CCCC2)c2ccccc2)cc1 ZINC000470077553 884334896 /nfs/dbraw/zinc/33/48/96/884334896.db2.gz YLAPNZYKPBKSHV-SMIHKQSGSA-N 0 3 407.558 4.351 20 0 HIADHN C[C@@H](NC(=O)Nc1ccc(OC(F)(F)F)c(Br)c1)C1=CCN(C)CC1 ZINC000470112360 884373217 /nfs/dbraw/zinc/37/32/17/884373217.db2.gz NBDMOLRCRFWAEZ-SNVBAGLBSA-N 0 3 422.245 4.120 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)Nc1ccc(-c2nc3ccccc3o2)cc1 ZINC000503761976 912817717 /nfs/dbraw/zinc/81/77/17/912817717.db2.gz YFPWLNVCZPDVAL-UHFFFAOYSA-N 0 3 415.497 4.486 20 0 HIADHN CC(C)[C@H]1CCC[C@H](NC(=O)NCc2ccccc2CN2CCC(O)CC2)CC1 ZINC000470163882 884440453 /nfs/dbraw/zinc/44/04/53/884440453.db2.gz PCZQKXCRPSCFSN-UGKGYDQZSA-N 0 3 401.595 4.047 20 0 HIADHN CC(C)Cn1ncc(C(=O)N[C@H](CN(C)Cc2ccccc2)C(C)C)c1C(F)F ZINC000470168195 884445796 /nfs/dbraw/zinc/44/57/96/884445796.db2.gz HZHUPFSCYFADJY-LJQANCHMSA-N 0 3 406.521 4.363 20 0 HIADHN C[C@H](CCNC(=O)CC1(N2CCOCC2)CCCC1)c1cccc(C(F)(F)F)c1 ZINC000470224466 884551274 /nfs/dbraw/zinc/55/12/74/884551274.db2.gz RZMLAXFBFMPEJM-QGZVFWFLSA-N 0 3 412.496 4.350 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)NCc1nnc(-c2ccccc2)s1 ZINC000470281178 884644846 /nfs/dbraw/zinc/64/48/46/884644846.db2.gz VJDHMKYPRYVFMH-HXUWFJFHSA-N 0 3 423.586 4.161 20 0 HIADHN Cc1cccc(-n2ncc(C(=O)NCCN3CCCC(C)(C)C3)c2C(F)(F)F)c1 ZINC000470296661 884672861 /nfs/dbraw/zinc/67/28/61/884672861.db2.gz MLQZKURAQGIDJC-UHFFFAOYSA-N 0 3 408.468 4.051 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)N(CCc1nccs1)C(C)C ZINC000470300479 884675024 /nfs/dbraw/zinc/67/50/24/884675024.db2.gz YFSGBTUHQIJMEU-HXUWFJFHSA-N 0 3 402.608 4.262 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N3CC[C@H](c4c(F)cccc4F)C3)cc2)CC1 ZINC000470343977 884734486 /nfs/dbraw/zinc/73/44/86/884734486.db2.gz JMTDHIWIXQTPQT-IBGZPJMESA-N 0 3 413.512 4.125 20 0 HIADHN Brc1cc2cccnc2c(CN2CCC(c3nnc4ccccn43)CC2)c1 ZINC000470362565 884757600 /nfs/dbraw/zinc/75/76/00/884757600.db2.gz FDUGPKVPMRWRHQ-UHFFFAOYSA-N 0 3 422.330 4.420 20 0 HIADHN C[C@@H](CO)N1CCCN(C(=O)Nc2cccc(CSC3CCCCC3)c2)CC1 ZINC000470366838 884763133 /nfs/dbraw/zinc/76/31/33/884763133.db2.gz HYFBPYXZGVMCJH-SFHVURJKSA-N 0 3 405.608 4.173 20 0 HIADHN O=C(CN[C@H]1CCCc2c(Br)cccc21)N[C@@H]1CCOc2ccccc21 ZINC000503910562 912861479 /nfs/dbraw/zinc/86/14/79/912861479.db2.gz MNQWEDWYHUACPR-RBUKOAKNSA-N 0 3 415.331 4.056 20 0 HIADHN CC[C@@H](NCC(=O)N[C@H]1CCOc2ccccc21)c1cccc(Br)c1 ZINC000503918623 912863911 /nfs/dbraw/zinc/86/39/11/912863911.db2.gz ALJQEBBXXZGCFN-MSOLQXFVSA-N 0 3 403.320 4.130 20 0 HIADHN C[C@H](CO)N1CCCN(C(=O)Nc2ccc([C@@H](C)Sc3ccccc3)cc2)CC1 ZINC000470409000 884812430 /nfs/dbraw/zinc/81/24/30/884812430.db2.gz PEJRDNMSZYNVMX-RTBURBONSA-N 0 3 413.587 4.460 20 0 HIADHN C[C@@H](NC(=O)NC[C@@H](Cc1ccccc1)N(C)C)c1ccc(-c2ccncc2)cc1 ZINC000470471260 884862478 /nfs/dbraw/zinc/86/24/78/884862478.db2.gz VWGOFTUKLWXIFJ-NTKDMRAZSA-N 0 3 402.542 4.282 20 0 HIADHN CCN1CCN(c2ccc(C(=O)NC[C@H]3CCCO[C@@H]3c3ccc(C)cc3)cc2)CC1 ZINC000470542091 884948711 /nfs/dbraw/zinc/94/87/11/884948711.db2.gz DWLOLCNVXJVVIR-ILBGXUMGSA-N 0 3 421.585 4.035 20 0 HIADHN C[C@@H](CO)N1CCCN(C(=O)Nc2ccc(Oc3ccccc3Cl)cc2)CC1 ZINC000470608546 885035581 /nfs/dbraw/zinc/03/55/81/885035581.db2.gz VHYINUISWJBATA-INIZCTEOSA-N 0 3 403.910 4.053 20 0 HIADHN CCN(CC)CCN(Cc1cccs1)C(=O)c1ccc(C(=O)c2cc[nH]c2)cc1 ZINC000470628995 885054686 /nfs/dbraw/zinc/05/46/86/885054686.db2.gz VMMZCBOYZXQRSS-UHFFFAOYSA-N 0 3 409.555 4.291 20 0 HIADHN Cc1c(C(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)cnn1-c1ccccc1C ZINC000470656411 885079180 /nfs/dbraw/zinc/07/91/80/885079180.db2.gz NERMIODQIORKMD-JOCHJYFZSA-N 0 3 402.542 4.226 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)N[C@@H]2CCSc3c(F)cccc32)CC1 ZINC000503985325 912896763 /nfs/dbraw/zinc/89/67/63/912896763.db2.gz ICWCJOPVNGGSQS-LJQANCHMSA-N 0 3 403.523 4.262 20 0 HIADHN CN(C(=O)CN[C@H](c1ccccc1)C(F)(F)F)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470669709 885097729 /nfs/dbraw/zinc/09/77/29/885097729.db2.gz SFNONCAYUUPVCE-IFMALSPDSA-N 0 3 419.491 4.003 20 0 HIADHN Cc1cc(C)n(Cc2cccc(C(=O)N(C)[C@H]3CCCN(Cc4ccccc4)C3)c2)n1 ZINC000470672634 885103382 /nfs/dbraw/zinc/10/33/82/885103382.db2.gz MICXMZWKDPCDOH-VWLOTQADSA-N 0 3 416.569 4.285 20 0 HIADHN CC(=O)CCc1ccc(O[C@@H](C)C(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000470678145 885108891 /nfs/dbraw/zinc/10/88/91/885108891.db2.gz JIWYZNPQUVWGHE-XUZZJYLKSA-N 0 3 422.569 4.099 20 0 HIADHN C[C@H](COc1ccc(F)cc1F)NC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470731073 885183779 /nfs/dbraw/zinc/18/37/79/885183779.db2.gz BTYAEOGDYYAKCN-YLJYHZDGSA-N 0 3 417.500 4.038 20 0 HIADHN CCCC(=O)Nc1ccc(CNC(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000470748363 885212941 /nfs/dbraw/zinc/21/29/41/885212941.db2.gz VXAWXSMXLVDURD-QHCPKHFHSA-N 0 3 422.573 4.231 20 0 HIADHN CN(C(=O)NCc1cccnc1OC1CCCC1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470752223 885218100 /nfs/dbraw/zinc/21/81/00/885218100.db2.gz VZEIOAHQKOBHRM-QFIPXVFZSA-N 0 3 422.573 4.209 20 0 HIADHN CCc1c(C(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)cnn1Cc1ccccc1 ZINC000470814300 885302393 /nfs/dbraw/zinc/30/23/93/885302393.db2.gz YRPJSWAKTRUGRZ-HSZRJFAPSA-N 0 3 416.569 4.230 20 0 HIADHN CN(C(=O)c1cn(C)nc1-c1ccccc1Cl)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470824484 885313388 /nfs/dbraw/zinc/31/33/88/885313388.db2.gz HEDBKWUVZWGCDL-LJQANCHMSA-N 0 3 422.960 4.477 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2)o1 ZINC000504027946 912931732 /nfs/dbraw/zinc/93/17/32/912931732.db2.gz ZIRPLMVLIYKZDP-UHFFFAOYSA-N 0 3 405.498 4.044 20 0 HIADHN CCCN(Cc1csc(-c2c(C)c(C)nn(C)c2=O)n1)[C@H]1CCc2ccccc2C1 ZINC000470959381 885457657 /nfs/dbraw/zinc/45/76/57/885457657.db2.gz LKSHOLMNLXCHGO-NRFANRHFSA-N 0 3 422.598 4.290 20 0 HIADHN O=C(Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)c1ccn(C2CCCCC2)n1 ZINC000471050929 885563436 /nfs/dbraw/zinc/56/34/36/885563436.db2.gz AUUXYKSTMOGHAS-NRFANRHFSA-N 0 3 418.545 4.284 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)NCCc2ccc3[nH]ccc3c2)N(C)C)cc1 ZINC000504043404 912950806 /nfs/dbraw/zinc/95/08/06/912950806.db2.gz QNLCULCJUAYVLN-HSZRJFAPSA-N 0 3 408.546 4.100 20 0 HIADHN COC(=O)c1c(CN2CCC[C@](C)(O)CC2)nc2ccccc2c1-c1ccccc1 ZINC000471067809 885585386 /nfs/dbraw/zinc/58/53/86/885585386.db2.gz YEUJIUPVRGLIQJ-VWLOTQADSA-N 0 3 404.510 4.425 20 0 HIADHN CN(C(=O)NCc1nnc(-c2ccccc2)s1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000471078577 885603485 /nfs/dbraw/zinc/60/34/85/885603485.db2.gz YBCFHPGGBKNDRA-HXUWFJFHSA-N 0 3 421.570 4.011 20 0 HIADHN O=C(Nc1ccc(Br)cc1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000471122282 885658833 /nfs/dbraw/zinc/65/88/33/885658833.db2.gz XMCKSKFLCSIWTI-UHFFFAOYSA-N 0 3 420.273 4.376 20 0 HIADHN Cc1noc(C)c1CSc1ncccc1C(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C ZINC000471141169 885685126 /nfs/dbraw/zinc/68/51/26/885685126.db2.gz UKUPLLBRJWRLHD-HRAATJIYSA-N 0 3 424.570 4.400 20 0 HIADHN CC(=O)Nc1cc(C(=O)N[C@@H](CN2CCCC2)c2ccccc2)cc(C(F)(F)F)c1 ZINC000471149076 885695230 /nfs/dbraw/zinc/69/52/30/885695230.db2.gz YABLILHUPIDXOJ-FQEVSTJZSA-N 0 3 419.447 4.231 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3ccc(C(C)=O)cc3)c(OCC)c2)CC1 ZINC000471168532 885726274 /nfs/dbraw/zinc/72/62/74/885726274.db2.gz IAHPAXZKPOUWSO-UHFFFAOYSA-N 0 3 409.530 4.072 20 0 HIADHN CN(C)c1c(Cl)cccc1NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000471216438 885790423 /nfs/dbraw/zinc/79/04/23/885790423.db2.gz PUAGTTIXIOXFLS-UHFFFAOYSA-N 0 3 418.891 4.333 20 0 HIADHN CN(CCCCOc1cccc(C(F)(F)F)c1)[C@H]1CCCC[C@@H]1S(C)(=O)=O ZINC000471241286 885818321 /nfs/dbraw/zinc/81/83/21/885818321.db2.gz FHWLBRNVKHUURX-ROUUACIJSA-N 0 3 407.498 4.152 20 0 HIADHN CN(CCCCOc1ccccc1C(F)(F)F)[C@@H]1CCCC[C@H]1S(C)(=O)=O ZINC000471241250 885818340 /nfs/dbraw/zinc/81/83/40/885818340.db2.gz DTBALQVFPNAQOG-SJLPKXTDSA-N 0 3 407.498 4.152 20 0 HIADHN COc1c(Cl)cccc1NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000471246229 885822880 /nfs/dbraw/zinc/82/28/80/885822880.db2.gz UGHLEUDDTJGVIM-UHFFFAOYSA-N 0 3 405.848 4.275 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)c1cc(C(F)(F)F)ccc1F ZINC000471339817 885946412 /nfs/dbraw/zinc/94/64/12/885946412.db2.gz GKCDYGYXCCYZEP-UHFFFAOYSA-N 0 3 423.454 4.177 20 0 HIADHN Cc1c(NC(=O)N(C)C)cccc1NC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C ZINC000471351757 885968435 /nfs/dbraw/zinc/96/84/35/885968435.db2.gz KIMBODRAOLAKLC-SFHVURJKSA-N 0 3 423.561 4.217 20 0 HIADHN Cc1c(NC(=O)N(C)C)cccc1NC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C ZINC000471351756 885968844 /nfs/dbraw/zinc/96/88/44/885968844.db2.gz KIMBODRAOLAKLC-GOSISDBHSA-N 0 3 423.561 4.217 20 0 HIADHN CCN(CC)C(=O)c1ccc(NC(=O)CCN2CCc3ccccc3C2)cc1Cl ZINC000471412151 886063908 /nfs/dbraw/zinc/06/39/08/886063908.db2.gz GJXSZRYBKZCDHP-UHFFFAOYSA-N 0 3 413.949 4.209 20 0 HIADHN C[C@H](NC(=O)N(CCCc1ccccc1)CCN(C)C)c1ccccc1-n1cccn1 ZINC000471493833 886194241 /nfs/dbraw/zinc/19/42/41/886194241.db2.gz UCSFXOUKGCLTLY-NRFANRHFSA-N 0 3 419.573 4.139 20 0 HIADHN C[C@H](NC(=O)CSCc1coc(-c2ccccc2)n1)[C@@H](c1ccccc1)N(C)C ZINC000471557107 886265588 /nfs/dbraw/zinc/26/55/88/886265588.db2.gz WIRYSNJNARCRSG-JTSKRJEESA-N 0 3 409.555 4.382 20 0 HIADHN C[C@@H](NC(=O)CCSc1ccc2c(c1)OCCCO2)[C@@H](c1ccccc1)N(C)C ZINC000471564608 886274936 /nfs/dbraw/zinc/27/49/36/886274936.db2.gz UFIKUQXUISCQNL-HXOBKFHXSA-N 0 3 414.571 4.138 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3cc(F)cc(F)c3OC)c(C)c2)CC1 ZINC000471566713 886276002 /nfs/dbraw/zinc/27/60/02/886276002.db2.gz MEVUYFLHLBDGJA-UHFFFAOYSA-N 0 3 404.461 4.068 20 0 HIADHN C[C@H](NC(=O)[C@@H]1C[C@@H]1c1ccccc1OC(F)(F)F)[C@H](c1ccccc1)N(C)C ZINC000471575714 886287149 /nfs/dbraw/zinc/28/71/49/886287149.db2.gz ZFIGMAIRZKZCKY-LMVHDODDSA-N 0 3 406.448 4.496 20 0 HIADHN Cc1ccc(C)c2c1CCC[C@H]2NCc1ccccc1OCC(=O)NC[C@H]1CCCO1 ZINC000471576726 886287286 /nfs/dbraw/zinc/28/72/86/886287286.db2.gz DZMIQHVQYGORBB-FYYLOGMGSA-N 0 3 422.569 4.145 20 0 HIADHN O=C(NCCc1cccc2ccccc21)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000471593522 886306146 /nfs/dbraw/zinc/30/61/46/886306146.db2.gz LGZXKZKBOWFJJA-UHFFFAOYSA-N 0 3 419.491 4.487 20 0 HIADHN Cc1ccc([C@@H](NC(=O)NCC2(N3CCSCC3)CCCC2)c2ccccn2)cc1 ZINC000471677649 886386574 /nfs/dbraw/zinc/38/65/74/886386574.db2.gz ILGVDINYKMABED-JOCHJYFZSA-N 0 3 424.614 4.140 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CCC[C@](C)(O)CC1)c1ccc(C(F)(F)F)cc1 ZINC000471721586 886433736 /nfs/dbraw/zinc/43/37/36/886433736.db2.gz WBKWOFINEYRPRT-ICSRJNTNSA-N 0 3 415.500 4.035 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)Nc1ccnc(-c2ccccc2)c1 ZINC000504149319 913046148 /nfs/dbraw/zinc/04/61/48/913046148.db2.gz NSOKIBSUDXMGKC-UHFFFAOYSA-N 0 3 416.525 4.027 20 0 HIADHN Cc1c(CN(Cc2cccc(Br)c2)CC2(O)CCCCC2)cnn1C ZINC000471802710 886540417 /nfs/dbraw/zinc/54/04/17/886540417.db2.gz CKIFANZPYNMDMM-UHFFFAOYSA-N 0 3 406.368 4.188 20 0 HIADHN O=C(NCCc1ccccc1OC(F)F)NC[C@H](c1cccs1)N1CCCC1 ZINC000471832551 886584349 /nfs/dbraw/zinc/58/43/49/886584349.db2.gz AOVWFKKFXIAVOP-MRXNPFEDSA-N 0 3 409.502 4.028 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)c(OC)c1 ZINC000504176146 913060136 /nfs/dbraw/zinc/06/01/36/913060136.db2.gz JREJMJALMITETG-RFWXGWTQSA-N 0 3 423.557 4.386 20 0 HIADHN Cc1cn([C@H](C)c2ccccc2)nc1NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000471914369 886701818 /nfs/dbraw/zinc/70/18/18/886701818.db2.gz HLPIZOBRDZMGPI-DENIHFKCSA-N 0 3 403.530 4.197 20 0 HIADHN CN1CC[C@H](NC(=O)N[C@@H](c2c(F)cccc2F)C(F)(F)F)[C@@H]1c1ccccc1 ZINC000471933002 886726650 /nfs/dbraw/zinc/72/66/50/886726650.db2.gz ZELONHLPCXFVKZ-SZMVWBNQSA-N 0 3 413.390 4.313 20 0 HIADHN C[C@@H](NC(=O)NC[C@H](Cc1ccccc1)N(C)C)c1nc(-c2ccccc2)cs1 ZINC000504191615 913074485 /nfs/dbraw/zinc/07/44/85/913074485.db2.gz VYZFIUZYJGZNTE-XLIONFOSSA-N 0 3 408.571 4.343 20 0 HIADHN CCCc1c(NC(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)cnn1-c1ccccc1 ZINC000471968989 886800683 /nfs/dbraw/zinc/80/06/83/886800683.db2.gz HYPCCPPVWNSTIS-NZQKXSOJSA-N 0 3 403.530 4.392 20 0 HIADHN Cc1cccc2c(CCNC(=O)NC3CC(N4CCC(C(F)(F)F)CC4)C3)c[nH]c21 ZINC000471973272 886804823 /nfs/dbraw/zinc/80/48/23/886804823.db2.gz ONYMYPSEUSBYLH-UHFFFAOYSA-N 0 3 422.495 4.123 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2ccc(OCc3ccccn3)c(F)c2)[C@H]1c1ccccc1 ZINC000471996363 886821784 /nfs/dbraw/zinc/82/17/84/886821784.db2.gz WYMCKYMCVWOEPS-JTHBVZDNSA-N 0 3 420.488 4.367 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2cccc(-c3noc(C4CC4)n3)c2)[C@H]1c1ccccc1 ZINC000472010215 886833486 /nfs/dbraw/zinc/83/34/86/886833486.db2.gz CJEMSSOPRBWHSX-WOJBJXKFSA-N 0 3 403.486 4.181 20 0 HIADHN COc1ccccc1[C@H](CNCc1cc2c(cc1SC)OCCO2)OC(C)C ZINC000472038014 886857120 /nfs/dbraw/zinc/85/71/20/886857120.db2.gz LMWZZCUJGMMCHO-NRFANRHFSA-N 0 3 403.544 4.444 20 0 HIADHN CCn1nc(CN[C@H](C)c2cc(F)ccc2N2CCN(CC)CC2)c2ccccc21 ZINC000472052796 886865495 /nfs/dbraw/zinc/86/54/95/886865495.db2.gz NHXSCCVBSJMNGZ-GOSISDBHSA-N 0 3 409.553 4.188 20 0 HIADHN Cc1cc(S(=O)(=O)NCC2CCN(Cc3cccs3)CC2)c(Cl)cc1F ZINC000472103296 886893832 /nfs/dbraw/zinc/89/38/32/886893832.db2.gz CNEFKZGSCWQMSQ-UHFFFAOYSA-N 0 3 416.971 4.040 20 0 HIADHN CCN(CC)[C@H](CNC(=O)[C@H]1C[C@H]1c1cc(OC)ccc1OC)c1ccsc1 ZINC000472120184 886906452 /nfs/dbraw/zinc/90/64/52/886906452.db2.gz NKZCVQDSYGBACO-YSIASYRMSA-N 0 3 402.560 4.068 20 0 HIADHN Cc1cc(C(=O)N[C@H](C)CCN2CCN(C)CC2)sc1-c1cccc(Cl)c1 ZINC000472119943 886907420 /nfs/dbraw/zinc/90/74/20/886907420.db2.gz KQSAOOBCEDRRKU-MRXNPFEDSA-N 0 3 405.995 4.133 20 0 HIADHN CC1CCN([C@@H](CNC(=O)N2CCO[C@H](c3cccs3)C2)c2cccs2)CC1 ZINC000472149404 886947138 /nfs/dbraw/zinc/94/71/38/886947138.db2.gz CPEMWQVSOOOZTE-ROUUACIJSA-N 0 3 419.616 4.366 20 0 HIADHN C[C@@H]1CC[C@@H](C)N1[C@@H]1CCCN(CCS(=O)(=O)c2ccc(C(C)(C)C)cc2)C1 ZINC000472263140 887076363 /nfs/dbraw/zinc/07/63/63/887076363.db2.gz YUKVKKZWBGVNAJ-SFHLNBCPSA-N 0 3 406.636 4.095 20 0 HIADHN CC[C@@H]1CN(C(C)=O)[C@H](CC)CN1CCC(=O)Nc1ccccc1-c1ccccc1 ZINC000472344450 887179213 /nfs/dbraw/zinc/17/92/13/887179213.db2.gz TUXQIOIMQDAYHF-FGZHOGPDSA-N 0 3 407.558 4.404 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)c1cc(O)c2ccccc2c1 ZINC000472351175 887185953 /nfs/dbraw/zinc/18/59/53/887185953.db2.gz VZFJXEDENHQMMA-OAQYLSRUSA-N 0 3 412.493 4.441 20 0 HIADHN Cc1cc2c(cc1C)[C@@H](C(=O)Nc1ccnn1[C@H]1CCN(Cc3ccccc3)C1)CO2 ZINC000472353534 887188638 /nfs/dbraw/zinc/18/86/38/887188638.db2.gz RZWNJNOIXQWOFF-UNMCSNQZSA-N 0 3 416.525 4.062 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N1CC2(CCC2)c2ccccc21 ZINC000472447674 887300336 /nfs/dbraw/zinc/30/03/36/887300336.db2.gz CZHOTBYAICXOOK-UHFFFAOYSA-N 0 3 407.480 4.443 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N1CCc2c1cccc2Cl ZINC000472450543 887304502 /nfs/dbraw/zinc/30/45/02/887304502.db2.gz SVWVYIAFJGURJX-UHFFFAOYSA-N 0 3 401.860 4.217 20 0 HIADHN COCCCC[C@@H](NC(=O)N(Cc1ccco1)C1CCN(C)CC1)c1ccccc1 ZINC000472453383 887307445 /nfs/dbraw/zinc/30/74/45/887307445.db2.gz ZVZXKTOWTXEESK-HSZRJFAPSA-N 0 3 413.562 4.443 20 0 HIADHN COCCC[C@@H](Cc1ccccc1)NC(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000472455412 887309347 /nfs/dbraw/zinc/30/93/47/887309347.db2.gz QCLAMLBDYNKUSF-DEOSSOPVSA-N 0 3 423.601 4.330 20 0 HIADHN CN(C(=O)Nc1cccc(OC[C@H]2CCCO2)c1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000472687353 887542046 /nfs/dbraw/zinc/54/20/46/887542046.db2.gz YULVJTJQWKSZFS-LADGPHEKSA-N 0 3 423.557 4.373 20 0 HIADHN CCN(CC)C(=O)c1ccc(NC(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000472774690 887619967 /nfs/dbraw/zinc/61/99/67/887619967.db2.gz UANMNIUDNCHZDX-QHCPKHFHSA-N 0 3 422.573 4.297 20 0 HIADHN COc1cc(NC(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)ccc1Br ZINC000472863286 887718752 /nfs/dbraw/zinc/71/87/52/887718752.db2.gz NDLUVAWOWUJBHK-YOEHRIQHSA-N 0 3 418.335 4.415 20 0 HIADHN C[C@H](CCN1CCN(C)CC1)NC(=O)N[C@H](c1cccc(Cl)c1)C1CCCCC1 ZINC000472905783 887752531 /nfs/dbraw/zinc/75/25/31/887752531.db2.gz WPKDMUSJJBCHCW-GCJKJVERSA-N 0 3 421.029 4.287 20 0 HIADHN OC1(Cc2cccc(F)c2)CCN(Cc2ccccc2OCc2ccncc2)CC1 ZINC000473073357 887891447 /nfs/dbraw/zinc/89/14/47/887891447.db2.gz BDDLZQLJUZDKLO-UHFFFAOYSA-N 0 3 406.501 4.369 20 0 HIADHN C[C@H]1CCc2c(sc3nc(CCN4CC[C@@]5(C4)OCc4ccccc45)nc(N)c23)C1 ZINC000473178278 887958331 /nfs/dbraw/zinc/95/83/31/887958331.db2.gz WAAIWHFJKKOZST-OWJWWREXSA-N 0 3 420.582 4.072 20 0 HIADHN COc1ccc(C(=O)CCCC(=O)N[C@H]2[C@H](C)CN(Cc3ccccc3)C[C@@H]2C)cc1 ZINC000473269746 888029605 /nfs/dbraw/zinc/02/96/05/888029605.db2.gz MZLFSQRFKWRJSJ-WAQNLRHXSA-N 0 3 422.569 4.321 20 0 HIADHN CCC[C@H]([NH2+]C(C)C)C(=O)Nc1ccc(C)c(S(=O)(=O)[N-]c2ccccc2F)c1 ZINC000473358396 888083287 /nfs/dbraw/zinc/08/32/87/888083287.db2.gz FQUMIDAMPMPMPT-IBGZPJMESA-N 0 3 421.538 4.040 20 0 HIADHN Cc1cccc(Oc2ccc(NC(=O)NC(C)(C)CCN3CCN(C)CC3)cc2)c1 ZINC000473495521 888218938 /nfs/dbraw/zinc/21/89/38/888218938.db2.gz DDOQPLFBWYULCR-UHFFFAOYSA-N 0 3 410.562 4.325 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1ccc(Br)s1 ZINC000473511768 888240885 /nfs/dbraw/zinc/24/08/85/888240885.db2.gz IROOXLLWGJWWKA-UHFFFAOYSA-N 0 3 411.287 4.046 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)[C@H]1CCCC[C@@H]1C(F)(F)F ZINC000473512304 888241826 /nfs/dbraw/zinc/24/18/26/888241826.db2.gz JZKXVTRTQFJSQU-WUCCLRPBSA-N 0 3 400.407 4.277 20 0 HIADHN COc1cccc(C2(C(=O)NC3CC(N4CCC(C(F)(F)F)CC4)C3)CCCC2)c1 ZINC000473517045 888248214 /nfs/dbraw/zinc/24/82/14/888248214.db2.gz GJNDNBSNTPKMHJ-UHFFFAOYSA-N 0 3 424.507 4.429 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)[C@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000473517997 888249853 /nfs/dbraw/zinc/24/98/53/888249853.db2.gz KIXSMRBFQZJABA-MWTAGDMHSA-N 0 3 400.407 4.277 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)[C@H]1C[C@H]1c1ccccc1Cl ZINC000473519185 888252444 /nfs/dbraw/zinc/25/24/44/888252444.db2.gz BCSYOGHHEKLVNN-LCSXWQTCSA-N 0 3 400.872 4.365 20 0 HIADHN CCC(CC)n1ncc(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)c1C ZINC000473521310 888254656 /nfs/dbraw/zinc/25/46/56/888254656.db2.gz QZECBPUVTVOMFR-UHFFFAOYSA-N 0 3 400.489 4.088 20 0 HIADHN C[C@H](CCc1ccccc1F)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473520775 888255062 /nfs/dbraw/zinc/25/50/62/888255062.db2.gz DCFASIZGOGPSIX-RWBZWWBESA-N 0 3 400.460 4.316 20 0 HIADHN C[C@H]1CCc2sc(C(=O)NC3CC(N4CCC(C(F)(F)F)CC4)C3)cc2C1 ZINC000473522374 888256321 /nfs/dbraw/zinc/25/63/21/888256321.db2.gz FWXVOGHBKKXWME-JQRITLKVSA-N 0 3 400.510 4.408 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)[C@@H]1C[C@H]1c1cccc(Cl)c1 ZINC000473527730 888265137 /nfs/dbraw/zinc/26/51/37/888265137.db2.gz RXEKGALQIZKUFF-ZGUYJTEBSA-N 0 3 400.872 4.365 20 0 HIADHN Cc1ccc(-c2nc(C(=O)NC3CC(N4CCC(C(F)(F)F)CC4)C3)cs2)o1 ZINC000473532850 888270410 /nfs/dbraw/zinc/27/04/10/888270410.db2.gz VYWVEWATSXLKQS-UHFFFAOYSA-N 0 3 413.465 4.247 20 0 HIADHN O=C(CCC(=O)N1C[C@H]2CN(Cc3ccccc3)C[C@H]2C1)c1csc2ccccc12 ZINC000473578375 888320472 /nfs/dbraw/zinc/32/04/72/888320472.db2.gz XKUHLBWXAOPFEK-BGYRXZFFSA-N 0 3 418.562 4.455 20 0 HIADHN CCc1nc2cc(CNC(=O)NC[C@@H](N[C@@H](C)CC)c3ccco3)ccc2n1C1CC1 ZINC000504417825 913233792 /nfs/dbraw/zinc/23/37/92/913233792.db2.gz FNEOBVQISFNCGB-OXJNMPFZSA-N 0 3 423.561 4.455 20 0 HIADHN CC(C)(C)[C@@H](CN1CCc2ccccc2C1)NC(=O)c1occc1Br ZINC000473596637 888340398 /nfs/dbraw/zinc/34/03/98/888340398.db2.gz CLLQDCPKZKTQFR-QGZVFWFLSA-N 0 3 405.336 4.245 20 0 HIADHN CCCN(C(=O)NCCC1CC(OCC)C1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000473599521 888344006 /nfs/dbraw/zinc/34/40/06/888344006.db2.gz SUPCDHHAAWOGTA-KOENEWCDSA-N 0 3 401.595 4.278 20 0 HIADHN C[C@H]1[C@@H](C(=O)Nc2ccc(CCN3CCSCC3)cc2)CCN1c1ccccc1 ZINC000473609398 888350340 /nfs/dbraw/zinc/35/03/40/888350340.db2.gz VZAATEPJJPHJRI-CVDCTZTESA-N 0 3 409.599 4.131 20 0 HIADHN Cc1ccc(CC(=O)N(Cc2ccco2)C2CCN(C)CC2)cc1Br ZINC000473623559 888363986 /nfs/dbraw/zinc/36/39/86/888363986.db2.gz YGQVDPHOIPLMSO-UHFFFAOYSA-N 0 3 405.336 4.016 20 0 HIADHN CC(=O)Nc1ccc(C)c(C(=O)N[C@H](CN2CCc3ccccc3C2)C(C)(C)C)c1 ZINC000473647098 888394895 /nfs/dbraw/zinc/39/48/95/888394895.db2.gz XMPKHJRVBJHYOW-HSZRJFAPSA-N 0 3 407.558 4.156 20 0 HIADHN COc1ccc(C(=O)N2CCCN(CCCc3ccccc3)CC2)c(OC(F)F)c1 ZINC000473697325 888473719 /nfs/dbraw/zinc/47/37/19/888473719.db2.gz JDPPALBHENSIDF-UHFFFAOYSA-N 0 3 418.484 4.077 20 0 HIADHN COc1c(CNC(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)oc2ccccc21 ZINC000473712545 888488774 /nfs/dbraw/zinc/48/87/74/888488774.db2.gz CZJMOLAXPVNHIM-LJQANCHMSA-N 0 3 407.514 4.247 20 0 HIADHN Cc1nc(CNC(=O)N(CCN(C)C)Cc2ccco2)oc1-c1ccc(Cl)cc1 ZINC000473735709 888514547 /nfs/dbraw/zinc/51/45/47/888514547.db2.gz KLRIZJVRMLGPEN-UHFFFAOYSA-N 0 3 416.909 4.170 20 0 HIADHN CC(C)CC[C@H]1CCCCN1C(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000473751781 888539233 /nfs/dbraw/zinc/53/92/33/888539233.db2.gz SITGAMVSRNAWOA-JOCHJYFZSA-N 0 3 401.595 4.144 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CCC[C@](C)(c4ccccc4)C3)c2)CC1 ZINC000473822011 888653761 /nfs/dbraw/zinc/65/37/61/888653761.db2.gz ZLVUVMJIPIDYCT-VWLOTQADSA-N 0 3 406.574 4.414 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@H](c3ccc(OC)cc3)C3CC3)c2)CC1 ZINC000473828003 888660223 /nfs/dbraw/zinc/66/02/23/888660223.db2.gz INGFEIFMHNSPRN-QHCPKHFHSA-N 0 3 408.546 4.110 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N(Cc3ccccc3)CC(F)F)c2)CC1 ZINC000473829557 888663362 /nfs/dbraw/zinc/66/33/62/888663362.db2.gz MIGWNHDATAGYRA-UHFFFAOYSA-N 0 3 402.489 4.128 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CCC[C@@H]3CCc3ccccc3)c2)CC1 ZINC000473829519 888663689 /nfs/dbraw/zinc/66/36/89/888663689.db2.gz NWLFWXNWIYBBIH-HSZRJFAPSA-N 0 3 406.574 4.458 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N(C)[C@H](C)c3sc(C)nc3C)c2)CC1 ZINC000473833297 888668364 /nfs/dbraw/zinc/66/83/64/888668364.db2.gz BYKCIYKVTBXGEM-MRXNPFEDSA-N 0 3 401.580 4.127 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@H](c3ccccc3)c3ccccn3)c2)CC1 ZINC000473834070 888670152 /nfs/dbraw/zinc/67/01/52/888670152.db2.gz DPMBIHVGRORQMV-XMMPIXPASA-N 0 3 415.541 4.135 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)NC(C)(C)c3ccc(F)c(F)c3)c2)CC1 ZINC000473835736 888672119 /nfs/dbraw/zinc/67/21/19/888672119.db2.gz LLYNZHRKEVTRAL-UHFFFAOYSA-N 0 3 402.489 4.164 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@@H]3CCCOc4cc(F)ccc43)c2)CC1 ZINC000473835834 888672250 /nfs/dbraw/zinc/67/22/50/888672250.db2.gz FDBUBJFDPBAAIC-OAQYLSRUSA-N 0 3 412.509 4.003 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)NC3(CCOCc4ccccc4)CC3)c2)CC1 ZINC000473838937 888678534 /nfs/dbraw/zinc/67/85/34/888678534.db2.gz ZIVAMYVOEGQPRP-UHFFFAOYSA-N 0 3 422.573 4.090 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@@H]3CCCO[C@H]3c3ccc(C)cc3)c2)CC1 ZINC000473839138 888678850 /nfs/dbraw/zinc/67/88/50/888678850.db2.gz YQMQHXJKSRFVNC-RPWUZVMVSA-N 0 3 422.573 4.179 20 0 HIADHN Cc1cc2c(o1)c(C(=O)NC1CCN(CCOC(C)C)CC1)ccc2Br ZINC000473850135 888699131 /nfs/dbraw/zinc/69/91/31/888699131.db2.gz MTZMFZBSNOJCHG-UHFFFAOYSA-N 0 3 423.351 4.123 20 0 HIADHN C[C@@H](NC(=O)NC(C)(C)CCN1CCN(C)CC1)c1ccc(Oc2ccccc2)cc1 ZINC000473934156 888813303 /nfs/dbraw/zinc/81/33/03/888813303.db2.gz VKCDLJZCRJIFLN-HXUWFJFHSA-N 0 3 424.589 4.255 20 0 HIADHN C[C@@H](NC(=O)NC(C)(C)CCN1CCN(C)CC1)c1ccccc1Oc1ccccc1 ZINC000473937417 888815731 /nfs/dbraw/zinc/81/57/31/888815731.db2.gz MLIAZCCDVUIIMP-HXUWFJFHSA-N 0 3 424.589 4.255 20 0 HIADHN CCCOc1ccc(CNC(=O)N(C)C[C@@H]2CCN(C)[C@H]2c2cccnc2)c(C)c1 ZINC000473964529 888833967 /nfs/dbraw/zinc/83/39/67/888833967.db2.gz OUFIPARFULBPCK-GMAHTHKFSA-N 0 3 410.562 4.013 20 0 HIADHN C[C@@H](NC(=O)N1CCSC[C@@H]1c1cccc(C(F)(F)F)c1)C1=CCN(C)CC1 ZINC000473998864 888858091 /nfs/dbraw/zinc/85/80/91/888858091.db2.gz CEHPFIIRQFTOML-RDTXWAMCSA-N 0 3 413.509 4.155 20 0 HIADHN FC(F)(F)OCCNCc1cc(Br)ccc1OCc1ccccn1 ZINC000474011629 888868548 /nfs/dbraw/zinc/86/85/48/888868548.db2.gz DWUCOJGNTGZJSC-UHFFFAOYSA-N 0 3 405.214 4.049 20 0 HIADHN COc1ccc2c(c1)C(C)(C)C[C@@H]2NCc1ccc(C(=O)N2C[C@@H](C)O[C@H](C)C2)cc1 ZINC000474026965 888877003 /nfs/dbraw/zinc/87/70/03/888877003.db2.gz BCTCRGCZURVBES-GGUMNFRJSA-N 0 3 422.569 4.457 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N[C@@H]1C[C@H]1c1cnn(-c2ccccc2)c1)c1ccsc1 ZINC000474034284 888880485 /nfs/dbraw/zinc/88/04/85/888880485.db2.gz MHYIAHAITAPWRU-BDTNDASRSA-N 0 3 423.586 4.172 20 0 HIADHN C[C@H](NC(=O)N[C@H](CN1CCCC1)c1ccccc1)c1ccc(Br)cn1 ZINC000474034488 888880547 /nfs/dbraw/zinc/88/05/47/888880547.db2.gz PPKSSNWMRHXPHB-HNAYVOBHSA-N 0 3 417.351 4.041 20 0 HIADHN COc1ccc2c(c1)C(C)(C)C[C@H]2NCc1cccc(C(=O)NC[C@H]2CCCO2)c1 ZINC000474054875 888893409 /nfs/dbraw/zinc/89/34/09/888893409.db2.gz IQSFRBQORFCSFB-NFBKMPQASA-N 0 3 408.542 4.116 20 0 HIADHN Cc1ccccc1NC(=O)C[C@@H](C)N[C@@H]1CCN(c2ccc(Cl)cc2Cl)C1=O ZINC000474099231 888921902 /nfs/dbraw/zinc/92/19/02/888921902.db2.gz RPRWSEALSCERKY-RDTXWAMCSA-N 0 3 420.340 4.414 20 0 HIADHN CCOc1ccc(CCC2CCN(Cc3cnc(-c4cnn(C)c4)nc3)CC2)cc1 ZINC000474109484 888931375 /nfs/dbraw/zinc/93/13/75/888931375.db2.gz DAUGPZKKDQDGSH-UHFFFAOYSA-N 0 3 405.546 4.121 20 0 HIADHN CN1CC[C@H](NC(=O)C2(c3cc(F)cc(C(F)(F)F)c3)CC2)[C@@H]1c1ccccc1 ZINC000474258474 889115793 /nfs/dbraw/zinc/11/57/93/889115793.db2.gz LDBPVSMMNZPKDC-OALUTQOASA-N 0 3 406.423 4.438 20 0 HIADHN C[C@@H]1C[C@@H](c2ccc(C(F)(F)F)cc2)N(Cc2cnc(-c3cnn(C)c3)nc2)C1 ZINC000474260218 889118055 /nfs/dbraw/zinc/11/80/55/889118055.db2.gz QYIXZODQIKGDOE-KUHUBIRLSA-N 0 3 401.436 4.479 20 0 HIADHN COc1ccc2nc(CNC[C@@H](c3cccc(Cl)c3)N3CCOCC3)sc2c1 ZINC000474350654 889228971 /nfs/dbraw/zinc/22/89/71/889228971.db2.gz ZMJHFEUGHQXZJA-IBGZPJMESA-N 0 3 417.962 4.121 20 0 HIADHN COc1ccc2nc(CNC[C@H](CO)Cc3ccccc3C(F)(F)F)sc2c1 ZINC000474366974 889246283 /nfs/dbraw/zinc/24/62/83/889246283.db2.gz GMZIXTNAJNBWFN-CYBMUJFWSA-N 0 3 410.461 4.265 20 0 HIADHN Cc1ccc(CCCNc2ccccc2N2CCN(CCc3ccncc3)CC2)cn1 ZINC000474391235 889262687 /nfs/dbraw/zinc/26/26/87/889262687.db2.gz SNOGSQOAUKGCIX-UHFFFAOYSA-N 0 3 415.585 4.194 20 0 HIADHN COCCOc1c(Cl)cccc1NC(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C ZINC000474428761 889294842 /nfs/dbraw/zinc/29/48/42/889294842.db2.gz DFULEYAIGOXGTH-KXBFYZLASA-N 0 3 405.926 4.178 20 0 HIADHN COCc1c(Br)cccc1NC(=O)N[C@H](C)[C@H](c1ccccc1)N(C)C ZINC000474431809 889297735 /nfs/dbraw/zinc/29/77/35/889297735.db2.gz LFOIESUNHRGUKS-AUUYWEPGSA-N 0 3 420.351 4.408 20 0 HIADHN CCc1cnc(CN(C)C(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)s1 ZINC000474463310 889328900 /nfs/dbraw/zinc/32/89/00/889328900.db2.gz YONBHLIZVMIHHD-IBGZPJMESA-N 0 3 411.493 4.119 20 0 HIADHN CCOC(=O)C1(C)CCC(NCc2nnc3c(Cl)cc(C(F)(F)F)cn23)CC1 ZINC000474484038 889345024 /nfs/dbraw/zinc/34/50/24/889345024.db2.gz DQEIIPZXHMHXFC-UHFFFAOYSA-N 0 3 418.847 4.003 20 0 HIADHN CC(C)(C)CC(=O)N1CCC(N[C@H]2COc3cc(F)c(Br)cc32)CC1 ZINC000504575601 913341957 /nfs/dbraw/zinc/34/19/57/913341957.db2.gz PMVFDJRKZYBJOF-INIZCTEOSA-N 0 3 413.331 4.039 20 0 HIADHN CC1CCN(CC(=O)N2CCc3c(cccc3NC(=O)Nc3ccc(F)cc3)C2)CC1 ZINC000474709982 889568530 /nfs/dbraw/zinc/56/85/30/889568530.db2.gz YHZABWCFFQCCLO-UHFFFAOYSA-N 0 3 424.520 4.086 20 0 HIADHN CN(C(=O)Nc1ccccc1OCC(F)(F)F)[C@H]1CCN(Cc2ccccc2)C1 ZINC000474712274 889570432 /nfs/dbraw/zinc/57/04/32/889570432.db2.gz UPVZWFGLXMKERG-KRWDZBQOSA-N 0 3 407.436 4.366 20 0 HIADHN CC1CCN(CC(=O)N2CCc3c(cccc3NC(=O)Nc3ccccc3F)C2)CC1 ZINC000474720270 889576860 /nfs/dbraw/zinc/57/68/60/889576860.db2.gz QFRUNQFKIMXCKO-UHFFFAOYSA-N 0 3 424.520 4.086 20 0 HIADHN COc1ccc([C@@H](N[C@@H](C)C2CCS(=O)(=O)CC2)c2ccccc2Cl)cc1 ZINC000474797982 889651754 /nfs/dbraw/zinc/65/17/54/889651754.db2.gz WAEIYANGQXMUCI-YCRPNKLZSA-N 0 3 407.963 4.241 20 0 HIADHN Cc1ccccc1Sc1ccc(C(=O)NC(C)(C)CCN2CCN(C)CC2)cc1 ZINC000474808776 889661854 /nfs/dbraw/zinc/66/18/54/889661854.db2.gz HGENDALKTUZYCO-UHFFFAOYSA-N 0 3 411.615 4.292 20 0 HIADHN C[C@H](CN1CCC[C@@H](C)C1)NC(=O)c1ccc(NC(=O)Nc2ccccc2)s1 ZINC000474826929 889682877 /nfs/dbraw/zinc/68/28/77/889682877.db2.gz YPTBEZNGMALWDB-HZPDHXFCSA-N 0 3 400.548 4.242 20 0 HIADHN CC(C)n1nccc1CNc1cccc(N2CCN(CCc3ccccc3)CC2)c1 ZINC000474873059 889727786 /nfs/dbraw/zinc/72/77/86/889727786.db2.gz OYNKEYOVOMTCPK-UHFFFAOYSA-N 0 3 403.574 4.441 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)c2cc(Br)cc3ccccc32)CC1 ZINC000474876100 889730587 /nfs/dbraw/zinc/73/05/87/889730587.db2.gz JIHZGAKJNWQLSM-UHFFFAOYSA-N 0 3 419.363 4.222 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)c2cn(Cc3ccccc3)c3ccccc23)CC1 ZINC000474884054 889740965 /nfs/dbraw/zinc/74/09/65/889740965.db2.gz BYEIGTOJYGJENP-UHFFFAOYSA-N 0 3 419.569 4.309 20 0 HIADHN Cc1c(COC(C)(C)C)cccc1NC(=O)CCN1CCN(c2ccccc2)CC1 ZINC000474914776 889775871 /nfs/dbraw/zinc/77/58/71/889775871.db2.gz ZBNJCHSTKLZABA-UHFFFAOYSA-N 0 3 409.574 4.461 20 0 HIADHN CCOC(=O)CCc1ccc(NC(=O)N(CC)[C@@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000474998036 889848888 /nfs/dbraw/zinc/84/88/88/889848888.db2.gz BCWXQCJBXGZFFT-HSZRJFAPSA-N 0 3 423.557 4.311 20 0 HIADHN CCN(C(=O)Nc1ccc2c(c1)CCCN2C(C)=O)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000474998759 889850760 /nfs/dbraw/zinc/85/07/60/889850760.db2.gz FBMWDMSUAWNMJS-HSZRJFAPSA-N 0 3 420.557 4.114 20 0 HIADHN CCc1nnc(-c2ccc(NC(=O)N(CC)[C@H]3CCN(Cc4ccccc4)C3)cc2)o1 ZINC000474999032 889850785 /nfs/dbraw/zinc/85/07/85/889850785.db2.gz BHKUVBOVTPSKCB-NRFANRHFSA-N 0 3 419.529 4.427 20 0 HIADHN CCN(C(=O)Nc1cccc(OCCCOC)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475005812 889857633 /nfs/dbraw/zinc/85/76/33/889857633.db2.gz ZMLAAZGGDFUFIA-JOCHJYFZSA-N 0 3 411.546 4.230 20 0 HIADHN CCN(C(=O)N[C@@H](c1ccc(OC)cc1)C1CC1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475006884 889858935 /nfs/dbraw/zinc/85/89/35/889858935.db2.gz AOTRUTDZZMCOPC-LADGPHEKSA-N 0 3 407.558 4.452 20 0 HIADHN CCN(C(=O)Nc1ccc(OC[C@H]2CCCO2)cc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475008337 889862544 /nfs/dbraw/zinc/86/25/44/889862544.db2.gz FYPKTMUYBIWOFL-LADGPHEKSA-N 0 3 423.557 4.373 20 0 HIADHN CCN(C(=O)Nc1ccc(C(=O)NC(C)C)c(C)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475011636 889865095 /nfs/dbraw/zinc/86/50/95/889865095.db2.gz ZDQCBNGYOLHUBO-JOCHJYFZSA-N 0 3 422.573 4.262 20 0 HIADHN CN(Cc1c[nH]nc1-c1ccc(Cl)cc1)C[C@@H]1C[C@H](F)CN1Cc1nccs1 ZINC000475101887 889949083 /nfs/dbraw/zinc/94/90/83/889949083.db2.gz PRNGHLGHPYSUKT-ROUUACIJSA-N 0 3 419.957 4.231 20 0 HIADHN CCN(C(=O)c1ncccc1Br)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000475105577 889954553 /nfs/dbraw/zinc/95/45/53/889954553.db2.gz DRMHQROJORRICB-WBVHZDCISA-N 0 3 402.336 4.142 20 0 HIADHN C[C@H](NC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1)c1ncc(-c2ccccc2)o1 ZINC000475114386 889966723 /nfs/dbraw/zinc/96/67/23/889966723.db2.gz HMRNPFYVMNKHKF-RXVVDRJESA-N 0 3 404.514 4.319 20 0 HIADHN CN(C(=O)NCc1ccc(OCC(F)(F)F)cc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475127201 889988304 /nfs/dbraw/zinc/98/83/04/889988304.db2.gz BIYYAEOGQOWUBA-IBGZPJMESA-N 0 3 421.463 4.044 20 0 HIADHN CC(C)[C@@H](CCO)NCC(=O)Nc1nc(-c2ccc(Cl)c(Cl)c2)cs1 ZINC000475129640 889992964 /nfs/dbraw/zinc/99/29/64/889992964.db2.gz KUBFYJYBBWBNTN-CQSZACIVSA-N 0 3 402.347 4.052 20 0 HIADHN CC[C@H](C)C(=O)Nc1cccc(CNC(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000475131505 889994543 /nfs/dbraw/zinc/99/45/43/889994543.db2.gz DFJBMQUARDIVRK-CVDCTZTESA-N 0 3 422.573 4.087 20 0 HIADHN CN(C(=O)NCc1cc(Br)ccc1F)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475138476 890003982 /nfs/dbraw/zinc/00/39/82/890003982.db2.gz KYLKOFDBTSLQHA-SFHVURJKSA-N 0 3 420.326 4.004 20 0 HIADHN CC1CCN([C@@H](CNC(=O)N2CCC[C@@]3(CCCOC3)C2)c2cccs2)CC1 ZINC000475148692 890015646 /nfs/dbraw/zinc/01/56/46/890015646.db2.gz ZLSHCEAHJDHYGE-SIKLNZKXSA-N 0 3 405.608 4.123 20 0 HIADHN CCN(C(=O)N[C@H](c1ccccc1)[C@H]1CCCO1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475161585 890027670 /nfs/dbraw/zinc/02/76/70/890027670.db2.gz JVUDZCZQKCSRTN-WXFUMESZSA-N 0 3 407.558 4.213 20 0 HIADHN CCN(C(=O)N[C@H](C[C@H]1CCOC1)c1ccccc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475166004 890029914 /nfs/dbraw/zinc/02/99/14/890029914.db2.gz UPQHCIMZHUBWTK-QLBJFCOMSA-N 0 3 421.585 4.460 20 0 HIADHN CCN(C(=O)N[C@@H](C)c1cccc(-n2cccn2)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475172761 890040784 /nfs/dbraw/zinc/04/07/84/890040784.db2.gz IOOJNGKGLFYCRK-GBXCKJPGSA-N 0 3 417.557 4.239 20 0 HIADHN CCN(C(=O)NCCc1csc(C(C)(C)C)n1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475174556 890041404 /nfs/dbraw/zinc/04/14/04/890041404.db2.gz KUTZNBYJLDTJGZ-FQEVSTJZSA-N 0 3 414.619 4.289 20 0 HIADHN CCN(C(=O)N[C@H](C)c1ccc(-n2cccn2)cc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475176129 890043882 /nfs/dbraw/zinc/04/38/82/890043882.db2.gz OIAZHGBBADAZOV-HYBUGGRVSA-N 0 3 417.557 4.239 20 0 HIADHN CCN(C(=O)NC[C@@H](c1ccccc1)C(C)(C)CO)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475176085 890044041 /nfs/dbraw/zinc/04/40/41/890044041.db2.gz YWQRFJAAIQEUSW-RPWUZVMVSA-N 0 3 423.601 4.095 20 0 HIADHN CC1CCN([C@H](CNC(=O)Nc2ccc(-c3ncn(C)n3)cc2)c2ccccc2)CC1 ZINC000475188140 890058914 /nfs/dbraw/zinc/05/89/14/890058914.db2.gz YDTDPOLMMQSJDY-JOCHJYFZSA-N 0 3 418.545 4.077 20 0 HIADHN COC1CCC(C)(CNCc2ncc(Br)cc2Br)CC1 ZINC000475221134 890090892 /nfs/dbraw/zinc/09/08/92/890090892.db2.gz UAYTWNUXPBDOJY-UHFFFAOYSA-N 0 3 406.162 4.292 20 0 HIADHN CCOc1cc(CN2CCC[C@@](C)(OC)C2)ccc1OCC(=O)N(C(C)C)C(C)C ZINC000475288996 890191449 /nfs/dbraw/zinc/19/14/49/890191449.db2.gz WPNMMTAAIDRYQW-XMMPIXPASA-N 0 3 420.594 4.110 20 0 HIADHN CCCN(CCC)C(=O)c1cccc(C(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000475297142 890203882 /nfs/dbraw/zinc/20/38/82/890203882.db2.gz LQZMRDYDFFRVLD-DEOSSOPVSA-N 0 3 421.585 4.295 20 0 HIADHN CN(C(=O)c1cccc(OCc2cccnc2)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475302324 890210048 /nfs/dbraw/zinc/21/00/48/890210048.db2.gz FHFBNDWVRMIXGL-QHCPKHFHSA-N 0 3 401.510 4.007 20 0 HIADHN Cc1noc(CSc2ccccc2C(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000475306118 890216314 /nfs/dbraw/zinc/21/63/14/890216314.db2.gz RCWLQMSVJSNXIL-LJQANCHMSA-N 0 3 422.554 4.017 20 0 HIADHN CC(=O)Nc1cc(C(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)cc(C(F)(F)F)c1 ZINC000475307439 890217941 /nfs/dbraw/zinc/21/79/41/890217941.db2.gz CSABGRDNSLXMEO-HXUWFJFHSA-N 0 3 419.447 4.010 20 0 HIADHN CN(C(=O)CCc1nc(-c2ccc(Cl)cc2)no1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475307561 890218636 /nfs/dbraw/zinc/21/86/36/890218636.db2.gz DKKRRDYHTYZTSK-HXUWFJFHSA-N 0 3 424.932 4.056 20 0 HIADHN CO[C@H]1CCC[C@H](CC(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)C1 ZINC000475312589 890227547 /nfs/dbraw/zinc/22/75/47/890227547.db2.gz BYHGABPYQCKCCU-HKUYNNGSSA-N 0 3 400.485 4.191 20 0 HIADHN COCCC[C@H](Cc1ccccc1)[NH2+]Cc1cc(Br)c([O-])c(OC)c1 ZINC000475332754 890253010 /nfs/dbraw/zinc/25/30/10/890253010.db2.gz LKEUBQFJIMRRQH-QGZVFWFLSA-N 0 3 408.336 4.291 20 0 HIADHN Fc1cccc(Br)c1CNC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000475356982 890282319 /nfs/dbraw/zinc/28/23/19/890282319.db2.gz PDUAVUOYNLXULU-UHFFFAOYSA-N 0 3 409.265 4.483 20 0 HIADHN COc1cc(NC(=O)CCN2CCc3c(cccc3C(C)C)C2)cc(OC)c1OC ZINC000475388311 890314919 /nfs/dbraw/zinc/31/49/19/890314919.db2.gz MTFFLICKVXHUTA-UHFFFAOYSA-N 0 3 412.530 4.223 20 0 HIADHN CS(=O)(=O)C1(CNCc2ccc(-c3cccc(Br)c3)s2)CCC1 ZINC000475431794 890351628 /nfs/dbraw/zinc/35/16/28/890351628.db2.gz OSGUCTVGGIUJIX-UHFFFAOYSA-N 0 3 414.390 4.235 20 0 HIADHN C[C@H](Cc1ccc(C(F)(F)F)cc1)N[C@H](C(N)=O)c1cccc(Br)c1 ZINC000475434648 890354705 /nfs/dbraw/zinc/35/47/05/890354705.db2.gz OWASKXVUYJPBEY-BZNIZROVSA-N 0 3 415.253 4.215 20 0 HIADHN Cc1cc(CN2CCSCC2)ccc1NC(=O)[C@@H]1CCc2nc(C(C)C)[nH]c2C1 ZINC000475463667 890373499 /nfs/dbraw/zinc/37/34/99/890373499.db2.gz WDNLZFDOKSIYSE-GOSISDBHSA-N 0 3 412.603 4.134 20 0 HIADHN Cc1cc(CN2CCSCC2)ccc1NC(=O)[C@@H]1CCc2[nH]c(C(C)C)nc2C1 ZINC000475463667 890373514 /nfs/dbraw/zinc/37/35/14/890373514.db2.gz WDNLZFDOKSIYSE-GOSISDBHSA-N 0 3 412.603 4.134 20 0 HIADHN Cc1nc(CC(C)C)oc1C(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1 ZINC000475506694 890421404 /nfs/dbraw/zinc/42/14/04/890421404.db2.gz IHQRNRBOUZUTND-UHFFFAOYSA-N 0 3 411.468 4.404 20 0 HIADHN Cc1nc2ccccc2n1C1CCN(Cc2ccc(Cl)cc2-n2cncn2)CC1 ZINC000475509018 890426146 /nfs/dbraw/zinc/42/61/46/890426146.db2.gz BPMZSXXLTDAYCP-UHFFFAOYSA-N 0 3 406.921 4.416 20 0 HIADHN CN(C(=O)N[C@@H]1CC[C@@H](c2cccc(F)c2)C1)C1CCN(CCc2ccccn2)CC1 ZINC000475522455 890444617 /nfs/dbraw/zinc/44/46/17/890444617.db2.gz IFOSFMKDQPINGB-NFBKMPQASA-N 0 3 424.564 4.205 20 0 HIADHN COc1ccc(CN(CCc2ccccn2)Cc2cn(C)nc2-c2cccnc2)cc1 ZINC000475544525 890468204 /nfs/dbraw/zinc/46/82/04/890468204.db2.gz GPAVWQOLPBZVOA-UHFFFAOYSA-N 0 3 413.525 4.131 20 0 HIADHN CN(C(=O)c1cccc(CSc2nccn2C)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475553889 890479450 /nfs/dbraw/zinc/47/94/50/890479450.db2.gz GVBAIDIYXDRWEC-JOCHJYFZSA-N 0 3 420.582 4.059 20 0 HIADHN CCN(C(=O)c1ccnc(N2CC[C@H](C)C2)c1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000475648101 890591767 /nfs/dbraw/zinc/59/17/67/890591767.db2.gz GFIXNDMBAUSLFY-JTAQYXEDSA-N 0 3 406.574 4.225 20 0 HIADHN CCN(C(=O)c1ccc(OCCCOC)cc1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000475656976 890602773 /nfs/dbraw/zinc/60/27/73/890602773.db2.gz RRKXBGPWUOOPOF-NFBKMPQASA-N 0 3 410.558 4.400 20 0 HIADHN CC(C)(NCC(=O)N1CCC[C@@H](C(F)(F)F)C1)c1ccc(OC(F)(F)F)cc1 ZINC000475701474 890639892 /nfs/dbraw/zinc/63/98/92/890639892.db2.gz MBMFJMNQOXOXSE-CYBMUJFWSA-N 0 3 412.374 4.211 20 0 HIADHN CCc1cccc(Cl)c1CN1CCC(C(=O)NCc2ccc(OC)cc2)CC1 ZINC000475713290 890651649 /nfs/dbraw/zinc/65/16/49/890651649.db2.gz BXOPPJRLOHADQO-UHFFFAOYSA-N 0 3 400.950 4.439 20 0 HIADHN C[C@H](c1ccc([S@@](C)=O)cc1)N(C)CCc1nc(-c2cccc(Cl)c2)no1 ZINC000475725627 890663829 /nfs/dbraw/zinc/66/38/29/890663829.db2.gz DBBYACQSILGDSO-LOKFHWFJSA-N 0 3 403.935 4.363 20 0 HIADHN COc1ccc(CNC(=O)CN(C)[C@@H](C)[C@@H](C)c2ccc(Cl)cc2)cc1OC ZINC000475739845 890680813 /nfs/dbraw/zinc/68/08/13/890680813.db2.gz PNIYBLDSAZFASU-CVEARBPZSA-N 0 3 404.938 4.097 20 0 HIADHN COc1ccc(CNC(=O)CN(C)[C@H](C)[C@@H](C)c2ccc(Cl)cc2)cc1OC ZINC000475739849 890682187 /nfs/dbraw/zinc/68/21/87/890682187.db2.gz PNIYBLDSAZFASU-HZPDHXFCSA-N 0 3 404.938 4.097 20 0 HIADHN Cc1cccc2nc(CN(Cc3cccc(Br)c3)CC3CC3)cc(=O)n12 ZINC000475742339 890683921 /nfs/dbraw/zinc/68/39/21/890683921.db2.gz OOKABZHNIIOYCS-UHFFFAOYSA-N 0 3 412.331 4.178 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)CCN(C)[C@H](C)c1ccc([S@@](C)=O)cc1 ZINC000475743715 890685966 /nfs/dbraw/zinc/68/59/66/890685966.db2.gz KJZCXSHWKZPXGH-LOKFHWFJSA-N 0 3 408.951 4.108 20 0 HIADHN O=C(N[C@H](c1ccccc1)C1CCCC1)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1CO ZINC000475894151 890826752 /nfs/dbraw/zinc/82/67/52/890826752.db2.gz ZTRZZGKOBYJQOM-ISJGIBHGSA-N 0 3 421.585 4.100 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N[C@@H](c2ccc(F)cc2)C2CCCC2)CC1 ZINC000475906517 890836020 /nfs/dbraw/zinc/83/60/20/890836020.db2.gz CFLJPRDTLOXEJI-JOCHJYFZSA-N 0 3 405.558 4.246 20 0 HIADHN O=C(Cc1cnc2ccccc2c1)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475912325 890840134 /nfs/dbraw/zinc/84/01/34/890840134.db2.gz RQOUBCFZMAXQNR-JOCHJYFZSA-N 0 3 411.509 4.060 20 0 HIADHN CC(C)C[C@H](NC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1CO)c1cccs1 ZINC000475916823 890844710 /nfs/dbraw/zinc/84/47/10/890844710.db2.gz ONBQESMKYLLBED-ACRUOGEOSA-N 0 3 415.603 4.018 20 0 HIADHN COc1ccc(C(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)c(OC(F)F)c1 ZINC000475945658 890868416 /nfs/dbraw/zinc/86/84/16/890868416.db2.gz MKYIBNXLVXSNDS-QGZVFWFLSA-N 0 3 404.457 4.033 20 0 HIADHN CN(Cc1nc2c(s1)CCCC2)C(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000475960689 890881098 /nfs/dbraw/zinc/88/10/98/890881098.db2.gz SOFDEBCSKFRFLU-MRXNPFEDSA-N 0 3 404.605 4.062 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N[C@H](C)c2cccc(Cl)c2Cl)CC1 ZINC000476006721 890935170 /nfs/dbraw/zinc/93/51/70/890935170.db2.gz CGPIGGSBYLQPFI-CQSZACIVSA-N 0 3 402.366 4.243 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N[C@H](C)c2nc(-c3ccccc3)cs2)CC1 ZINC000476038336 890968674 /nfs/dbraw/zinc/96/86/74/890968674.db2.gz AUQMREFLMHFTIT-QGZVFWFLSA-N 0 3 416.591 4.060 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)NCc2cccc(Oc3ccccc3)c2)CC1 ZINC000476060803 890989628 /nfs/dbraw/zinc/98/96/28/890989628.db2.gz KUIKAGQOXQLCGI-UHFFFAOYSA-N 0 3 411.546 4.168 20 0 HIADHN Cc1nc(C(=O)N(CCN(C)C)c2ccccc2)nn1-c1c(Cl)cccc1Cl ZINC000476132806 891055926 /nfs/dbraw/zinc/05/59/26/891055926.db2.gz CXNVTVHAFSEUGD-UHFFFAOYSA-N 0 3 418.328 4.091 20 0 HIADHN COCCN1CCC[C@H]1CNC(=O)N[C@@H](C)c1ccc(Oc2ccccc2)c(F)c1 ZINC000476178966 891109971 /nfs/dbraw/zinc/10/99/71/891109971.db2.gz XQTNUDMHAOQSQL-HKUYNNGSSA-N 0 3 415.509 4.089 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)c2ccc3nc(-c4ccccc4)oc3c2)C[C@@H](C)O1 ZINC000476305060 891217273 /nfs/dbraw/zinc/21/72/73/891217273.db2.gz IWQHWRZRBUHDNE-QZTJIDSGSA-N 0 3 407.514 4.114 20 0 HIADHN CCc1onc(-c2ccccc2)c1C(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000476308879 891220370 /nfs/dbraw/zinc/22/03/70/891220370.db2.gz WWIFUEXDGFHWEM-UHFFFAOYSA-N 0 3 419.525 4.361 20 0 HIADHN COc1ccc(C(=O)CCCCCC(=O)N[C@H]2CN(C)C[C@@H]2c2ccccc2)cc1 ZINC000476333167 891236312 /nfs/dbraw/zinc/23/63/12/891236312.db2.gz HMFCKRLAMQAWPP-PKTZIBPZSA-N 0 3 408.542 4.042 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2c(F)cc(F)cc2Br)N(C)C)cc1 ZINC000476351596 891255610 /nfs/dbraw/zinc/25/56/10/891255610.db2.gz DSFQRLKKBOFOLU-MRXNPFEDSA-N 0 3 412.278 4.460 20 0 HIADHN CC(C)(CNC(=O)c1cn(C2CC2)c2cc(Cl)c(F)cc2c1=O)N1CCCCC1 ZINC000476416552 891329608 /nfs/dbraw/zinc/32/96/08/891329608.db2.gz GNWNAGUQHKPRCW-UHFFFAOYSA-N 0 3 419.928 4.123 20 0 HIADHN C[C@@H]1CO[C@@H](c2ccccc2Cl)CN1C(=O)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000476657575 891604278 /nfs/dbraw/zinc/60/42/78/891604278.db2.gz PTQSBRQVKUMXSS-SFGWALBWSA-N 0 3 413.949 4.086 20 0 HIADHN Cc1nc2c(s1)[C@@H](N(C)C(=O)NC[C@H](c1cccs1)N1CCCC1)CCC2 ZINC000476687506 891639589 /nfs/dbraw/zinc/63/95/89/891639589.db2.gz VOVOIOSLGMLEIS-DLBZAZTESA-N 0 3 404.605 4.369 20 0 HIADHN C[C@H](CNC(=O)c1cn(C2CC2)c2cc(Cl)c(F)cc2c1=O)N1CCCC[C@H]1C ZINC000476763682 891738043 /nfs/dbraw/zinc/73/80/43/891738043.db2.gz NKAYUAMFNCUIPE-ZIAGYGMSSA-N 0 3 419.928 4.122 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)NCc1ccc(-c2csc(C)n2)o1)c1ccco1 ZINC000476813568 891800456 /nfs/dbraw/zinc/80/04/56/891800456.db2.gz JOTOELSQEUREAP-CJNGLKHVSA-N 0 3 402.520 4.233 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N(Cc2ccccc2)CC2CCOCC2)C1 ZINC000476816886 891802598 /nfs/dbraw/zinc/80/25/98/891802598.db2.gz OKJGPEHAYZSTNC-PXDATVDWSA-N 0 3 421.585 4.460 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)N(CCCO)[C@@H]1CCCc2ccccc21 ZINC000476833875 891814403 /nfs/dbraw/zinc/81/44/03/891814403.db2.gz WKHNZXMIFFOUHX-LOSJGSFVSA-N 0 3 421.585 4.295 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CNC(=O)N[C@H](C)[C@H](c1ccccc1)N(C)C ZINC000476950972 891887843 /nfs/dbraw/zinc/88/78/43/891887843.db2.gz IVQDCMSEDMEKCI-NTKDMRAZSA-N 0 3 419.573 4.039 20 0 HIADHN NC(=O)c1ccc(NC(=O)CCN2CCc3cc(-c4ccccc4)oc3C2)cc1Cl ZINC000477058289 891991437 /nfs/dbraw/zinc/99/14/37/891991437.db2.gz QNEWGMNTVCKTOW-UHFFFAOYSA-N 0 3 423.900 4.086 20 0 HIADHN COc1ccc(NC(=O)[C@H](NCCc2ccc(OC)c(F)c2)c2ccccc2)cc1 ZINC000477103214 892035314 /nfs/dbraw/zinc/03/53/14/892035314.db2.gz VAVWSXBKJNOUOM-HSZRJFAPSA-N 0 3 408.473 4.355 20 0 HIADHN COCc1nnc(NC[C@@H]2CCCN(C)[C@H]2c2ccc(C(F)(F)F)cc2)s1 ZINC000477117981 892048803 /nfs/dbraw/zinc/04/88/03/892048803.db2.gz GETCOYLQQXJBMK-BBRMVZONSA-N 0 3 400.470 4.198 20 0 HIADHN CCO[C@@H]1C[C@H](N[C@H](C)c2c(C)nn(CC(F)(F)F)c2C)[C@H]1Oc1ccccc1 ZINC000477489306 892486397 /nfs/dbraw/zinc/48/63/97/892486397.db2.gz BIPJLFBPISYFGX-WGGKBWNUSA-N 0 3 411.468 4.338 20 0 HIADHN CCC(CC)[C@@H]1C[C@@H](NC(=O)Nc2ccc(CCN3CCSCC3)cc2)CCO1 ZINC000477536653 892570883 /nfs/dbraw/zinc/57/08/83/892570883.db2.gz YIRRQWNXEDQUGW-VXKWHMMOSA-N 0 3 419.635 4.383 20 0 HIADHN CCC(CC)[C@H]1C[C@H](NC(=O)Nc2ccc(CCN3CCSCC3)cc2)CCO1 ZINC000477536652 892572174 /nfs/dbraw/zinc/57/21/74/892572174.db2.gz YIRRQWNXEDQUGW-FGZHOGPDSA-N 0 3 419.635 4.383 20 0 HIADHN O=C(CN1CCC[C@@H]1C1CCC1)N(Cc1cccs1)c1ccc2c(c1)OCCO2 ZINC000477618394 892719410 /nfs/dbraw/zinc/71/94/10/892719410.db2.gz VEPFSMWEIZUFAM-HXUWFJFHSA-N 0 3 412.555 4.317 20 0 HIADHN COC1CCN(C(C)(C)CNC(=O)c2c(C)cc(Br)cc2Cl)CC1 ZINC000477636383 892756727 /nfs/dbraw/zinc/75/67/27/892756727.db2.gz JALSETCWFJEOHT-UHFFFAOYSA-N 0 3 417.775 4.030 20 0 HIADHN Cc1n[nH]c(C)c1NC(=O)CNC1(c2cccc(Br)c2)CCCCC1 ZINC000477665601 892801783 /nfs/dbraw/zinc/80/17/83/892801783.db2.gz SGCKZKDYAYLBSE-UHFFFAOYSA-N 0 3 405.340 4.177 20 0 HIADHN Cn1cc(-c2cc(F)ccc2NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)cn1 ZINC000477670870 892803338 /nfs/dbraw/zinc/80/33/38/892803338.db2.gz GZVJGNXBIYZLDL-QGZVFWFLSA-N 0 3 410.468 4.216 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1ccc2ccc(Cl)cc2n1 ZINC000477725920 892828150 /nfs/dbraw/zinc/82/81/50/892828150.db2.gz OARMVXPBAGWSQE-UHFFFAOYSA-N 0 3 409.917 4.345 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCC[C@H]1c1ccc2c(c1)OCO2)c1ccsc1 ZINC000477744963 892839658 /nfs/dbraw/zinc/83/96/58/892839658.db2.gz CWWVBRXJXZNHAL-RBUKOAKNSA-N 0 3 415.559 4.406 20 0 HIADHN CC(C)[C@@H]1CC[C@@H](C)C[C@H]1OCC(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000477749513 892842363 /nfs/dbraw/zinc/84/23/63/892842363.db2.gz ZPGYQMNOGGDKQE-VEXUSMLFSA-N 0 3 416.606 4.307 20 0 HIADHN Cc1c(NC(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)cnn1CCC(C)C ZINC000477823310 892889232 /nfs/dbraw/zinc/88/92/32/892889232.db2.gz LJURGWYVGYTNQT-JOCHJYFZSA-N 0 3 415.582 4.449 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)N[C@H](C)CCc2ccc(O)cc2)N(C)C)cc1 ZINC000477903482 892973875 /nfs/dbraw/zinc/97/38/75/892973875.db2.gz CGSXGTFDEIYAOC-JPYJTQIMSA-N 0 3 413.562 4.103 20 0 HIADHN CC(C)Cc1ccc([C@H](CNC(=O)Nc2ccn(CC(F)(F)F)n2)N(C)C)cc1 ZINC000477908427 892982571 /nfs/dbraw/zinc/98/25/71/892982571.db2.gz LAWOCWGNASLVCL-KRWDZBQOSA-N 0 3 411.472 4.068 20 0 HIADHN O=C(Nc1ccc(OCC(F)(F)F)c(F)c1)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000504977766 913720813 /nfs/dbraw/zinc/72/08/13/913720813.db2.gz VFSACAUATUHDGQ-INIZCTEOSA-N 0 3 411.399 4.163 20 0 HIADHN CC(C)[C@@H](NCc1ccc(S(=O)(=O)CCO)cc1)c1ccc(Cl)c(Cl)c1 ZINC000477923722 893008980 /nfs/dbraw/zinc/00/89/80/893008980.db2.gz BNNCILFDOJWDSU-LJQANCHMSA-N 0 3 416.370 4.246 20 0 HIADHN CCOC[C@H]1CCN(C(=O)NC[C@H](c2ccc(C(F)(F)F)cc2)N(CC)CC)C1 ZINC000477922653 893010170 /nfs/dbraw/zinc/01/01/70/893010170.db2.gz ZKOAFJQZXSPYSC-QFBILLFUSA-N 0 3 415.500 4.156 20 0 HIADHN CCOc1ccc([C@H](CC)N[C@H]2CCN(Cc3ccc(F)cc3)C2=O)cc1OCC ZINC000477925448 893014018 /nfs/dbraw/zinc/01/40/18/893014018.db2.gz IQVIWLVBEGWHRW-SFTDATJTSA-N 0 3 414.521 4.465 20 0 HIADHN O=C(Nc1ccc(NC(=O)c2cccc(CN3CCCC3)c2)nc1)c1ccccc1 ZINC000477928757 893017275 /nfs/dbraw/zinc/01/72/75/893017275.db2.gz UEIYOXZHTYQXKU-UHFFFAOYSA-N 0 3 400.482 4.182 20 0 HIADHN C[C@@H](C(=O)Nc1cccc2c1CCN(CC(C)(C)O)C2)c1cn(C)c2ccccc12 ZINC000478245199 893412535 /nfs/dbraw/zinc/41/25/35/893412535.db2.gz ANJKGSVJXKLMHR-QGZVFWFLSA-N 0 3 405.542 4.050 20 0 HIADHN CCCN(C(=O)CCCNC(=O)c1ccccc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000505024703 913766758 /nfs/dbraw/zinc/76/67/58/913766758.db2.gz VLKYDHLEIAZXHN-XMMPIXPASA-N 0 3 421.585 4.100 20 0 HIADHN Cc1noc(C)c1COc1cc2ccccc2cc1C(=O)NCCN1CCC(C)CC1 ZINC000478310710 893535211 /nfs/dbraw/zinc/53/52/11/893535211.db2.gz HTMAKQSATUZAQN-UHFFFAOYSA-N 0 3 421.541 4.485 20 0 HIADHN CC[C@H](C)n1ncc(C(=O)Nc2c(C)cnn2[C@H]2CCN(Cc3ccccc3)C2)c1C ZINC000478328322 893559956 /nfs/dbraw/zinc/55/99/56/893559956.db2.gz GXYHHGJYMCYXNF-RXVVDRJESA-N 0 3 420.561 4.367 20 0 HIADHN CCOc1c(Cl)cccc1CC(=O)Nc1ccc(N2CCN(CC)CC2)cc1C ZINC000478400677 893683520 /nfs/dbraw/zinc/68/35/20/893683520.db2.gz RBPOMTHZYLYUGN-UHFFFAOYSA-N 0 3 415.965 4.370 20 0 HIADHN CCCN(CCN(C)C)C(=O)c1ccc(COc2ccc(Br)cc2)o1 ZINC000478426481 893724163 /nfs/dbraw/zinc/72/41/63/893724163.db2.gz KNQCODIDNGSWAO-UHFFFAOYSA-N 0 3 409.324 4.035 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N1CC2(CCOCC2)c2ccccc21 ZINC000478428729 893726911 /nfs/dbraw/zinc/72/69/11/893726911.db2.gz JKSOEOCWNDXDTQ-HXUWFJFHSA-N 0 3 411.571 4.163 20 0 HIADHN CCCN(CCN(C)C)C(=O)c1ccc(Oc2cccc(Br)c2)nc1 ZINC000478447297 893761577 /nfs/dbraw/zinc/76/15/77/893761577.db2.gz HFTJIWFFUZCBHH-UHFFFAOYSA-N 0 3 406.324 4.050 20 0 HIADHN COc1cnccc1N1CCN(C(=O)c2cc(-c3ccc(F)cc3)c(C)s2)CC1 ZINC000478450718 893767931 /nfs/dbraw/zinc/76/79/31/893767931.db2.gz WSPQCORBPOPGME-UHFFFAOYSA-N 0 3 411.502 4.229 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)c3csc(Br)c3C)c2)CC1 ZINC000478597113 893866220 /nfs/dbraw/zinc/86/62/20/893866220.db2.gz SNVRQJLXUVBEAG-UHFFFAOYSA-N 0 3 408.365 4.213 20 0 HIADHN Cc1c(C(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)nnn1-c1ccccc1Cl ZINC000505099911 913816504 /nfs/dbraw/zinc/81/65/04/913816504.db2.gz XLNFIYBJPMVMKZ-OAQYLSRUSA-N 0 3 423.948 4.104 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1cnccc1Oc1ccccc1 ZINC000505104926 913819633 /nfs/dbraw/zinc/81/96/33/913819633.db2.gz PRJXDEJHUBKYBY-UHFFFAOYSA-N 0 3 419.447 4.409 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@H]2CN[C@H](C(N)=O)c2cccc(Br)c2)cc1 ZINC000478799298 894074037 /nfs/dbraw/zinc/07/40/37/894074037.db2.gz ITAGELSDGZEEQR-IHPCNDPISA-N 0 3 417.347 4.041 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccc(F)c2)C1)N1CCO[C@H](c2ccccc2Cl)C1 ZINC000505155406 913847103 /nfs/dbraw/zinc/84/71/03/913847103.db2.gz UBKYPEVGPDFDOF-GCJKJVERSA-N 0 3 416.924 4.291 20 0 HIADHN O=C([C@H]1CCCN(Cc2cccc(F)c2)C1)N1CCO[C@H](c2ccccc2Cl)C1 ZINC000505155405 913847309 /nfs/dbraw/zinc/84/73/09/913847309.db2.gz UBKYPEVGPDFDOF-AVRDEDQJSA-N 0 3 416.924 4.291 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2cc(C)c(Cl)cc2OC)c1 ZINC000478967475 894247137 /nfs/dbraw/zinc/24/71/37/894247137.db2.gz BEKDVJHJGFXCHL-UHFFFAOYSA-N 0 3 405.926 4.261 20 0 HIADHN C[C@@H](NCC(C)(C)c1ccc(F)cc1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479053097 894312538 /nfs/dbraw/zinc/31/25/38/894312538.db2.gz CAWZUUMHPGXUNI-LLVKDONJSA-N 0 3 419.349 4.408 20 0 HIADHN C[C@@H](CCc1ccc(O)cc1)N[C@@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479058167 894318390 /nfs/dbraw/zinc/31/83/90/894318390.db2.gz JUKMQZZDPUHJFV-RYUDHWBXSA-N 0 3 417.358 4.018 20 0 HIADHN COCCSc1ccc([C@H](C)N[C@@H](C)c2cc(S(N)(=O)=O)c(C)cc2C)cc1 ZINC000479060490 894320914 /nfs/dbraw/zinc/32/09/14/894320914.db2.gz AHPYSAJNMCLCRG-IRXDYDNUSA-N 0 3 422.616 4.101 20 0 HIADHN COc1cc2c(cc1OC)[C@@H](NCc1ccc(NC(=O)c3ccncc3)cc1)CC2 ZINC000479062292 894322009 /nfs/dbraw/zinc/32/20/09/894322009.db2.gz ORYLTWGIJDJRKB-NRFANRHFSA-N 0 3 403.482 4.128 20 0 HIADHN C[C@@H](NC(=O)Nc1cccc2c1CN(c1ccccn1)C2)[C@H](c1ccccc1)N(C)C ZINC000479062995 894323511 /nfs/dbraw/zinc/32/35/11/894323511.db2.gz YYLVQGCCDQZHAU-HOYKHHGWSA-N 0 3 415.541 4.415 20 0 HIADHN CCS[C@@H]1CCCC[C@@H]1N[C@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479064521 894326008 /nfs/dbraw/zinc/32/60/08/894326008.db2.gz FQHWLULFNPVDEV-WKPIXPDZSA-N 0 3 411.420 4.356 20 0 HIADHN C[C@H](NC[C@H]1CCCO[C@@H]1C(C)(C)C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479080965 894347155 /nfs/dbraw/zinc/34/71/55/894347155.db2.gz OTOBLFKCBRLYSP-JKDFXYPNSA-N 0 3 423.406 4.133 20 0 HIADHN Cc1ccc(C[NH+](C)C)cc1[N-]S(=O)(=O)c1cc(Br)c(F)cc1C ZINC000479138428 894407892 /nfs/dbraw/zinc/40/78/92/894407892.db2.gz XAUDHQQQNWUKPF-UHFFFAOYSA-N 0 3 415.328 4.067 20 0 HIADHN O=C(N[C@H]1CCN(Cc2ccccc2)C1)[C@@H]1C[C@H]1c1ccc(OC(F)(F)F)cc1 ZINC000479158332 894427234 /nfs/dbraw/zinc/42/72/34/894427234.db2.gz HCZSQXHJLVOZDF-YSIASYRMSA-N 0 3 404.432 4.079 20 0 HIADHN Cc1c2ccccc2oc1[C@@H](C)NC(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000479232658 894494091 /nfs/dbraw/zinc/49/40/91/894494091.db2.gz VKNNGDNNOPXUCF-ZIFCJYIRSA-N 0 3 413.562 4.333 20 0 HIADHN CCOc1ccc([C@H](C)NC(=O)NC[C@@H](c2ccccc2)N2CCCC2)cc1OC ZINC000505205970 913883178 /nfs/dbraw/zinc/88/31/78/913883178.db2.gz WAHIHAXQUGVSOC-RXVVDRJESA-N 0 3 411.546 4.291 20 0 HIADHN C[C@@H](N[C@@H](C)CCc1ccccc1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479333296 894625413 /nfs/dbraw/zinc/62/54/13/894625413.db2.gz WMGRTRZEAHZNQO-QWHCGFSZSA-N 0 3 401.359 4.313 20 0 HIADHN Cc1c2ccccc2oc1[C@H](C)NC(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000479363840 894662727 /nfs/dbraw/zinc/66/27/27/894662727.db2.gz VKNNGDNNOPXUCF-LMMKCTJWSA-N 0 3 413.562 4.333 20 0 HIADHN COc1c(Br)cccc1CNCCc1nc(-c2cccc(Cl)c2)no1 ZINC000479392131 894695477 /nfs/dbraw/zinc/69/54/77/894695477.db2.gz ZIVNCVNWQSBVNO-UHFFFAOYSA-N 0 3 422.710 4.493 20 0 HIADHN CCC(CC)[C@@H](CCN[C@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl)OC ZINC000479421836 894732625 /nfs/dbraw/zinc/73/26/25/894732625.db2.gz SJBPRXNUFCTXHO-BDJLRTHQSA-N 0 3 411.395 4.133 20 0 HIADHN COc1ccc(-c2ccncc2)cc1CN[C@H]1CCN(C(=O)CCc2ccccc2)C1 ZINC000479431282 894745538 /nfs/dbraw/zinc/74/55/38/894745538.db2.gz YNUFKIUKOJZFFY-DEOSSOPVSA-N 0 3 415.537 4.081 20 0 HIADHN CCN1CCN(c2ccccc2NCc2cccc(Br)c2OC)CC1 ZINC000479469185 894792373 /nfs/dbraw/zinc/79/23/73/894792373.db2.gz GIJXASTUCCXNTC-UHFFFAOYSA-N 0 3 404.352 4.212 20 0 HIADHN CC1CCC(C)(CN[C@@H]2CCS(=O)(=O)c3ccc(Br)cc32)CC1 ZINC000479477410 894801525 /nfs/dbraw/zinc/80/15/25/894801525.db2.gz CQZSGVUIIZXVRY-CRPOECCBSA-N 0 3 400.382 4.474 20 0 HIADHN Cn1cc([C@@H](NC2CC(N3CCC(C(F)(F)F)CC3)C2)c2cccc(F)c2)cn1 ZINC000479481451 894804389 /nfs/dbraw/zinc/80/43/89/894804389.db2.gz HJHDKKNFRUFJFY-MHJFOBGBSA-N 0 3 410.459 4.044 20 0 HIADHN CCc1ccc([C@H](NC[C@@H](C)N(CC)CC)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000479484247 894807047 /nfs/dbraw/zinc/80/70/47/894807047.db2.gz AIUYMBPOXYXHAD-JPYJTQIMSA-N 0 3 402.604 4.062 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(-c2ccc(C(F)(F)F)cc2)s1)C(=O)N1CCNC1=O ZINC000479502103 894818568 /nfs/dbraw/zinc/81/85/68/894818568.db2.gz MIQJTBUJPXQUQO-VXGBXAGGSA-N 0 3 411.449 4.025 20 0 HIADHN C[C@@H](NCCCc1ccccc1F)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479510895 894824856 /nfs/dbraw/zinc/82/48/56/894824856.db2.gz NNADWMOWFJGPLX-LLVKDONJSA-N 0 3 405.322 4.063 20 0 HIADHN O=S1(=O)CC[C@@H](NCCCc2ccccc2F)c2cc(Br)ccc21 ZINC000479546985 894847361 /nfs/dbraw/zinc/84/73/61/894847361.db2.gz UFJASXSIOJWMMI-QGZVFWFLSA-N 0 3 412.324 4.029 20 0 HIADHN CCS(=O)(=O)c1c(Cl)cccc1CNC[C@@H]1CCCO[C@@H]1c1ccccc1 ZINC000479557018 894855371 /nfs/dbraw/zinc/85/53/71/894855371.db2.gz SBHMGBJGIUZWAO-FXAWDEMLSA-N 0 3 407.963 4.391 20 0 HIADHN CCS(=O)(=O)c1c(Cl)cccc1CNCc1ccccc1CN(C)C(C)C ZINC000479565560 894861725 /nfs/dbraw/zinc/86/17/25/894861725.db2.gz KSCDTAJLMUAJGN-UHFFFAOYSA-N 0 3 408.995 4.264 20 0 HIADHN CC(C)CCOc1ccc(CNCc2ccc(N3CCCS3(=O)=O)c(F)c2)cc1 ZINC000479593706 894875482 /nfs/dbraw/zinc/87/54/82/894875482.db2.gz SUGDOIDJQKQGSO-UHFFFAOYSA-N 0 3 420.550 4.080 20 0 HIADHN COCC[C@H](NC(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1)c1ccc(C)o1 ZINC000479680421 894963798 /nfs/dbraw/zinc/96/37/98/894963798.db2.gz XKPQQZUDWHUZHR-GHTZIAJQSA-N 0 3 424.463 4.236 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)NC[C@H]2CCC[C@H](C(F)(F)F)C2)c1 ZINC000479680178 894963930 /nfs/dbraw/zinc/96/39/30/894963930.db2.gz VUSNSIQYHSJBOQ-WMZOPIPTSA-N 0 3 415.500 4.137 20 0 HIADHN CC[C@@H](NC(=O)N[C@H](CN(C)C)c1ccc(OC)cc1)c1ccccc1OC(F)F ZINC000479760643 895061407 /nfs/dbraw/zinc/06/14/07/895061407.db2.gz UBGWDTQPOJGTJU-RTBURBONSA-N 0 3 421.488 4.350 20 0 HIADHN C[C@H](NC(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C)c1ccc(NC(=O)C2CC2)cc1 ZINC000479760450 895061728 /nfs/dbraw/zinc/06/17/28/895061728.db2.gz SHSQWXZVHFRUNK-PNLZDCPESA-N 0 3 408.546 4.087 20 0 HIADHN COc1ccc(CCN[C@H](C)c2nnn(-c3cccc(Cl)c3)c2C)cc1OC ZINC000479768251 895068823 /nfs/dbraw/zinc/06/88/23/895068823.db2.gz OXLLQLVJGIATEW-CQSZACIVSA-N 0 3 400.910 4.140 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)N[C@H](C)c2cc3cccc(F)c3o2)c1 ZINC000479777885 895080759 /nfs/dbraw/zinc/08/07/59/895080759.db2.gz PJDQZENCZCWTAJ-MRXNPFEDSA-N 0 3 413.493 4.415 20 0 HIADHN COc1ccc([C@@H](C)NC(=O)N[C@@H](CN2CCCC2)c2ccccc2)c(C)c1OC ZINC000479791678 895096450 /nfs/dbraw/zinc/09/64/50/895096450.db2.gz WOLJVVQLNZSZGO-NQIIRXRSSA-N 0 3 411.546 4.210 20 0 HIADHN C[C@@H](CN1CCCCCC1)NC(=O)c1cn(C2CC2)c2cc(Cl)c(F)cc2c1=O ZINC000479794542 895099177 /nfs/dbraw/zinc/09/91/77/895099177.db2.gz GWFSTMDVCMKTEB-AWEZNQCLSA-N 0 3 419.928 4.123 20 0 HIADHN COc1ccccc1[C@@H](CN[C@@H](C)c1nnn(-c2ccccc2)c1C)N1CCCC1 ZINC000479875098 895216827 /nfs/dbraw/zinc/21/68/27/895216827.db2.gz PPYFKCMYDWGANI-PGRDOPGGSA-N 0 3 405.546 4.072 20 0 HIADHN CC[C@H](NC[C@@H](c1ccc(OC)c(OC)c1)N1CCOCC1)c1cc(F)ccc1F ZINC000479888726 895234680 /nfs/dbraw/zinc/23/46/80/895234680.db2.gz PJOUDUVBGAWCFC-SFTDATJTSA-N 0 3 420.500 4.096 20 0 HIADHN CC(C)CCOc1ccccc1CNC(=O)N(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1 ZINC000479962273 895314787 /nfs/dbraw/zinc/31/47/87/895314787.db2.gz JUDFLCXSEZRDIK-UPVQGACJSA-N 0 3 424.589 4.341 20 0 HIADHN O=C(CCc1ccc(-c2ccccc2)o1)NCc1ccccc1CN1CCC(O)CC1 ZINC000479979577 895332950 /nfs/dbraw/zinc/33/29/50/895332950.db2.gz BIEDOTFHNREFJI-UHFFFAOYSA-N 0 3 418.537 4.152 20 0 HIADHN COCCN1CCC(NC(=O)N(C)[C@H](c2ccc(Cl)cc2)C2CCCC2)CC1 ZINC000479992801 895345340 /nfs/dbraw/zinc/34/53/40/895345340.db2.gz VSWSMNKSHWDSKG-NRFANRHFSA-N 0 3 407.986 4.324 20 0 HIADHN C[C@@H](N[C@@H](C)c1cccc2ccccc21)c1cccc(S(=O)(=O)N2CCOCC2)c1 ZINC000480098889 895464352 /nfs/dbraw/zinc/46/43/52/895464352.db2.gz YASSNQXUOJRDFN-MOPGFXCFSA-N 0 3 424.566 4.273 20 0 HIADHN C[C@@H](NC[C@H](c1cccs1)N(C)C)c1ccccc1I ZINC000480099360 895466390 /nfs/dbraw/zinc/46/63/90/895466390.db2.gz ZCNXRTNKIPCXGB-IUODEOHRSA-N 0 3 400.329 4.306 20 0 HIADHN Brc1ccc([C@@H](NCCc2c[nH]c3ncccc23)c2cncnc2)cc1 ZINC000480212589 895616391 /nfs/dbraw/zinc/61/63/91/895616391.db2.gz HPMJNEJTWBMOCA-LJQANCHMSA-N 0 3 408.303 4.037 20 0 HIADHN O=S1(=O)CC[C@@H](NCC2(c3ccccc3)CCC2)c2cc(Br)ccc21 ZINC000480231388 895636359 /nfs/dbraw/zinc/63/63/59/895636359.db2.gz XOIKGTDZZXTCSH-GOSISDBHSA-N 0 3 420.372 4.379 20 0 HIADHN COc1ccc2c(c1)[C@H](NCc1ccc(CN3C[C@@H](C)O[C@@H](C)C3)cc1)CCCO2 ZINC000480241887 895652356 /nfs/dbraw/zinc/65/23/56/895652356.db2.gz QQJCKUBKMOBFOG-YDIMBITNSA-N 0 3 410.558 4.308 20 0 HIADHN CN(C)C[C@@H](NC(=O)Nc1cc(C(C)(C)C)nn1-c1ccccn1)c1ccc(F)cc1 ZINC000480266231 895675835 /nfs/dbraw/zinc/67/58/35/895675835.db2.gz NYTSZIFGVQBBIS-GOSISDBHSA-N 0 3 424.524 4.128 20 0 HIADHN CCN1CC[C@@H](NCc2ccc(Br)o2)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000480304355 895708934 /nfs/dbraw/zinc/70/89/34/895708934.db2.gz ACKNIXODJAZQMV-PBHICJAKSA-N 0 3 403.242 4.385 20 0 HIADHN COCCN(C)c1ccc(CNCc2ccc(-c3ccc4c(c3)CCO4)cc2)cn1 ZINC000480336362 895740370 /nfs/dbraw/zinc/74/03/70/895740370.db2.gz OFPXIUHLDHFNIE-UHFFFAOYSA-N 0 3 403.526 4.056 20 0 HIADHN FC(F)(F)c1ccc(CN2CC[C@H](NCc3nccn3-c3ccccc3)C2)cc1 ZINC000480339419 895743963 /nfs/dbraw/zinc/74/39/63/895743963.db2.gz WMGXWBKUIDOKFA-IBGZPJMESA-N 0 3 400.448 4.255 20 0 HIADHN CC(C)N(C)c1ccc(CNCCOc2ncc(C(F)(F)F)cc2Cl)cn1 ZINC000480341250 895744714 /nfs/dbraw/zinc/74/47/14/895744714.db2.gz CPZYLLVBGIGJLN-UHFFFAOYSA-N 0 3 402.848 4.162 20 0 HIADHN COCCN(C)c1ccc(CNC2(c3cccc(Br)c3)CCC2)cn1 ZINC000480388731 895795068 /nfs/dbraw/zinc/79/50/68/895795068.db2.gz ZIZLTOPRXWGOHN-UHFFFAOYSA-N 0 3 404.352 4.096 20 0 HIADHN Cc1cccc(Oc2ccccc2NC(=O)N2CC[C@H](N3CCN(C)CC3)[C@@H](C)C2)c1 ZINC000480408986 895809531 /nfs/dbraw/zinc/80/95/31/895809531.db2.gz VIXZZWRZCBEECQ-REWPJTCUSA-N 0 3 422.573 4.277 20 0 HIADHN COc1ccc([C@H](C)N[C@@H](CN2CCOCC2)c2ccccc2)cc1Br ZINC000480437659 895829480 /nfs/dbraw/zinc/82/94/80/895829480.db2.gz PGONZOQDTPERSP-JXFKEZNVSA-N 0 3 419.363 4.182 20 0 HIADHN COC(=O)c1csc(-c2cccc(CNCc3c[nH]nc3-c3ccsc3)c2)n1 ZINC000480447909 895836432 /nfs/dbraw/zinc/83/64/32/895836432.db2.gz UKGMXHFHHMKPTB-UHFFFAOYSA-N 0 3 410.524 4.338 20 0 HIADHN Cc1ccc([C@@H](CN2CCOCC2)N[C@H](C)c2ccc(NC(=O)NC(C)C)cc2)cc1 ZINC000480458412 895844865 /nfs/dbraw/zinc/84/48/65/895844865.db2.gz CUMRSPKDZIXIHI-HYBUGGRVSA-N 0 3 424.589 4.249 20 0 HIADHN COC(=O)c1csc(-c2cccc(CNCc3cnc(-c4ccncc4)s3)c2)n1 ZINC000480458675 895845008 /nfs/dbraw/zinc/84/50/08/895845008.db2.gz DYRXWWVWKCGNHW-UHFFFAOYSA-N 0 3 422.535 4.405 20 0 HIADHN COC(=O)c1csc(-c2cccc(CNCc3cnc(-c4ccccc4)[nH]3)c2)n1 ZINC000480471258 895853541 /nfs/dbraw/zinc/85/35/41/895853541.db2.gz PBBMRFKMEMVQLE-UHFFFAOYSA-N 0 3 404.495 4.277 20 0 HIADHN C[C@@H](NCc1cccnc1N1CCOCC1)[C@H](C)Oc1ccc(Cl)cc1Cl ZINC000480533929 895895925 /nfs/dbraw/zinc/89/59/25/895895925.db2.gz CYUCYLUPSZVMJH-CABCVRRESA-N 0 3 410.345 4.171 20 0 HIADHN CCc1cc(NC2CC(N3CCC(C(F)(F)F)CC3)C2)nc(-c2ccccn2)n1 ZINC000480547470 895907163 /nfs/dbraw/zinc/90/71/63/895907163.db2.gz AHSNVDLJHLXNHL-UHFFFAOYSA-N 0 3 405.468 4.318 20 0 HIADHN CC[C@@H](NCc1ccc(N2CCO[C@@H](C)C2)nc1)c1cccc(Br)c1 ZINC000480619715 895987692 /nfs/dbraw/zinc/98/76/92/895987692.db2.gz XTORBYNMBRVTHI-HNAYVOBHSA-N 0 3 404.352 4.310 20 0 HIADHN C[C@@H]1CN(C(=O)c2ccc(CNCc3ccc(OCC4CC4)cc3)cc2)C[C@@H](C)O1 ZINC000480641615 896011026 /nfs/dbraw/zinc/01/10/26/896011026.db2.gz XFISMVMRQMQBQU-RTBURBONSA-N 0 3 408.542 4.015 20 0 HIADHN Cc1ccc([C@H](CNCc2ccc(-c3cccc(F)c3F)o2)N2CCOCC2)o1 ZINC000480660778 896027311 /nfs/dbraw/zinc/02/73/11/896027311.db2.gz HFYNBXIJURQEGS-IBGZPJMESA-N 0 3 402.441 4.289 20 0 HIADHN Fc1cccc(-c2ccc(CNC[C@@H](c3cccs3)N3CCOCC3)o2)c1F ZINC000480674104 896038681 /nfs/dbraw/zinc/03/86/81/896038681.db2.gz TXHYDALRJZGEKN-SFHVURJKSA-N 0 3 404.482 4.449 20 0 HIADHN CC[C@H](NCc1ccc(N2CCCS2(=O)=O)c(F)c1)c1ccc(Cl)s1 ZINC000480678118 896041732 /nfs/dbraw/zinc/04/17/32/896041732.db2.gz SDPGDEGFKHGBRC-AWEZNQCLSA-N 0 3 402.944 4.321 20 0 HIADHN Cc1cccc(CCCN2CCN(CCCc3nc(-c4cccs4)no3)CC2)c1 ZINC000480702763 896063799 /nfs/dbraw/zinc/06/37/99/896063799.db2.gz NNCFUEFYMIVZPM-UHFFFAOYSA-N 0 3 410.587 4.290 20 0 HIADHN COCCOc1ccc([C@@H](C)NCc2ccc(N3CCC(C)CC3)nc2)cc1OC ZINC000480703518 896065064 /nfs/dbraw/zinc/06/50/64/896065064.db2.gz ZTNBPCGRRRGKGK-LJQANCHMSA-N 0 3 413.562 4.203 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2ccc(-c3n[nH]c(C4CC4)n3)cc2)N2CCCC2)cc1 ZINC000480710905 896071957 /nfs/dbraw/zinc/07/19/57/896071957.db2.gz FMPOPIMIQNZYCD-JOCHJYFZSA-N 0 3 415.541 4.224 20 0 HIADHN CN(CCCc1cc(-c2ccccc2)no1)C(=O)[C@H]1CCCN1Cc1ccccc1 ZINC000505369698 914031154 /nfs/dbraw/zinc/03/11/54/914031154.db2.gz CCDWFNXBDVOLEU-XMMPIXPASA-N 0 3 403.526 4.397 20 0 HIADHN C[C@@H](NCc1ccc(N2CCC(C)CC2)nc1)c1ccc(OCc2nccn2C)cc1 ZINC000480724096 896085412 /nfs/dbraw/zinc/08/54/12/896085412.db2.gz AKSDLTLMDCVWRR-HXUWFJFHSA-N 0 3 419.573 4.481 20 0 HIADHN CCN1CCN(c2ccc(CN[C@H](C)c3cc(Cl)ccc3OC(F)F)cn2)CC1 ZINC000480733350 896093473 /nfs/dbraw/zinc/09/34/73/896093473.db2.gz SVEVMKLWUFSPSD-OAHLLOKOSA-N 0 3 424.923 4.329 20 0 HIADHN CCN1CCN(c2ccc(CN[C@@H](C)c3nc(-c4ccccc4)cs3)cn2)CC1 ZINC000480733222 896093747 /nfs/dbraw/zinc/09/37/47/896093747.db2.gz SWPCLHRBSDKMGX-SFHVURJKSA-N 0 3 407.587 4.198 20 0 HIADHN CCCOc1ccc([C@@H](C)N[C@@H](C)c2ccc(S(=O)(=O)N(C)C)cc2)cc1OC ZINC000480737265 896097029 /nfs/dbraw/zinc/09/70/29/896097029.db2.gz CSNUGXJZDWIUGZ-DLBZAZTESA-N 0 3 420.575 4.146 20 0 HIADHN COc1ccc([C@@H](C)N[C@H](C)c2ccc(NC(=O)NC3CC3)cc2)cc1NC(C)=O ZINC000480739062 896099175 /nfs/dbraw/zinc/09/91/75/896099175.db2.gz RRAJAMWQMXNMTI-HUUCEWRRSA-N 0 3 410.518 4.349 20 0 HIADHN CCCOc1ccc([C@H](C)N[C@H](C)c2cccc(NS(C)(=O)=O)c2)cc1OC ZINC000480742674 896105304 /nfs/dbraw/zinc/10/53/04/896105304.db2.gz RVZQMJNZRYLETL-CVEARBPZSA-N 0 3 406.548 4.267 20 0 HIADHN CCN(C[C@@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)Cc1ccc(Cl)c(F)c1 ZINC000480752608 896114857 /nfs/dbraw/zinc/11/48/57/896114857.db2.gz AFMUUHNQZHCHBV-LJQANCHMSA-N 0 3 424.969 4.153 20 0 HIADHN C[C@H](NCc1cccc(NC(=O)Cn2cccn2)c1)c1cccc(-c2ccncc2)c1 ZINC000480875001 896233735 /nfs/dbraw/zinc/23/37/35/896233735.db2.gz GHENAQOIYBJYLO-IBGZPJMESA-N 0 3 411.509 4.435 20 0 HIADHN C[C@@H](NCc1ccc(OCc2ccccc2F)nc1)c1ccc(-n2ccnn2)cc1 ZINC000480878883 896235913 /nfs/dbraw/zinc/23/59/13/896235913.db2.gz SKCJTSJDAGDJCQ-QGZVFWFLSA-N 0 3 403.461 4.231 20 0 HIADHN C[C@@H](NCc1cccc(NC(=O)c2ccccn2)c1)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000480892714 896251028 /nfs/dbraw/zinc/25/10/28/896251028.db2.gz YYFAAAOWPHZLMX-MRXNPFEDSA-N 0 3 414.509 4.414 20 0 HIADHN C[C@@H](NCc1ccc(CS(C)(=O)=O)cc1)c1ccc(OCC(F)(F)F)cc1 ZINC000480902646 896259594 /nfs/dbraw/zinc/25/95/94/896259594.db2.gz CHNWXTGCOQTQDY-CQSZACIVSA-N 0 3 401.450 4.023 20 0 HIADHN C[C@H](NCc1cccc(Cn2cccn2)c1)c1ccc(S(=O)(=O)C2CCCC2)cc1 ZINC000480915594 896274576 /nfs/dbraw/zinc/27/45/76/896274576.db2.gz ZDBMWSGKASNSAZ-IBGZPJMESA-N 0 3 423.582 4.499 20 0 HIADHN COc1cc(CN[C@H](C)c2csc(-c3csc(C)n3)c2)ccc1OCCO ZINC000480920529 896278794 /nfs/dbraw/zinc/27/87/94/896278794.db2.gz LQXUFMYBDWLICP-CYBMUJFWSA-N 0 3 404.557 4.411 20 0 HIADHN CNS(=O)(=O)c1cccc(CN[C@@H](Cc2ccc(C)cc2)c2ccc(C)cc2)c1 ZINC000481017478 896347192 /nfs/dbraw/zinc/34/71/92/896347192.db2.gz CZWSRPBVMGWFDD-DEOSSOPVSA-N 0 3 408.567 4.285 20 0 HIADHN COc1ccc2ccccc2c1-c1cc(CN2CCC[C@H](Cn3ccnn3)C2)on1 ZINC000481076598 896395307 /nfs/dbraw/zinc/39/53/07/896395307.db2.gz PAPJBCGGKGGJDA-KRWDZBQOSA-N 0 3 403.486 4.007 20 0 HIADHN CCS[C@H]1CCCCN(CC(=O)N2CCC[C@H]2c2ccc3c(c2)OCCCO3)C1 ZINC000481078264 896397973 /nfs/dbraw/zinc/39/79/73/896397973.db2.gz QWIRCSBYUBPQQA-PMACEKPBSA-N 0 3 418.603 4.119 20 0 HIADHN COc1cc2nc(CN[C@@H]3CCCC[C@@H]3Cc3ccccc3)[nH]c(=O)c2cc1OC ZINC000481168973 896502559 /nfs/dbraw/zinc/50/25/59/896502559.db2.gz FGYVIULLEVCYRV-IEBWSBKVSA-N 0 3 407.514 4.244 20 0 HIADHN COc1cc([C@@H](C)N[C@@H]2CCc3cc(Br)ccc32)ccc1OCCO ZINC000481173799 896508677 /nfs/dbraw/zinc/50/86/77/896508677.db2.gz GXUQWHPWGHAGFT-FZKQIMNGSA-N 0 3 406.320 4.167 20 0 HIADHN Cc1cc(NC(=O)CN[C@@H](CC2CCC2)c2ccccc2)n(-c2nc(C)cc(C)n2)n1 ZINC000481230306 896582028 /nfs/dbraw/zinc/58/20/28/896582028.db2.gz PDWXNDGVPGPORD-NRFANRHFSA-N 0 3 418.545 4.047 20 0 HIADHN CN1CCN(c2ncccc2CN[C@H](CCc2ccccc2)c2ccccc2)CC1 ZINC000481242020 896591795 /nfs/dbraw/zinc/59/17/95/896591795.db2.gz MNQHOQSPCZYYGO-RUZDIDTESA-N 0 3 400.570 4.297 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1ccc(-c2cncnc2)cc1F)c1cccc(OC)c1 ZINC000481303913 896650487 /nfs/dbraw/zinc/65/04/87/896650487.db2.gz GOADDZPUEMXIDC-HSZRJFAPSA-N 0 3 422.504 4.104 20 0 HIADHN COc1cccc(Oc2ccc(CN[C@H](C)c3ccc(-n4cncn4)cc3)cn2)c1 ZINC000481307708 896654543 /nfs/dbraw/zinc/65/45/43/896654543.db2.gz KCXXHMBMAVUDRA-QGZVFWFLSA-N 0 3 401.470 4.314 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(OCC(=O)NC2CC2)cc1)c1cnn(Cc2ccccc2)c1 ZINC000481309314 896656410 /nfs/dbraw/zinc/65/64/10/896656410.db2.gz OOQDRZFFSBDPBF-RTBURBONSA-N 0 3 418.541 4.001 20 0 HIADHN COCCOc1cccc(CN[C@H](C)c2ccc(I)cc2)c1 ZINC000481309334 896656697 /nfs/dbraw/zinc/65/66/97/896656697.db2.gz OTHURQPOJIDKGF-CQSZACIVSA-N 0 3 411.283 4.167 20 0 HIADHN C[C@H](NCc1ccc(N2CCc3ccccc3C2)nc1)c1ccc2c(c1)OCCO2 ZINC000481309318 896656812 /nfs/dbraw/zinc/65/68/12/896656812.db2.gz OPAPDOOSNDXSDX-SFHVURJKSA-N 0 3 401.510 4.266 20 0 HIADHN CCS(=O)(=O)Nc1ccc([C@@H](C)NCc2ccc(OC3CCCC3)nc2)cc1 ZINC000481310055 896658854 /nfs/dbraw/zinc/65/88/54/896658854.db2.gz PDHYLSKFMHAIKL-MRXNPFEDSA-N 0 3 403.548 4.015 20 0 HIADHN Cc1cc(C)n(-c2ccc(CN[C@@H](C)c3ccc(OCc4nccn4C)cc3)cn2)n1 ZINC000481315890 896667406 /nfs/dbraw/zinc/66/74/06/896667406.db2.gz ZEGGYURGBJSHTA-IBGZPJMESA-N 0 3 416.529 4.047 20 0 HIADHN Fc1cc(Br)cc2c1CC[C@@H]2NCc1cccc(CN2CCOCC2)c1 ZINC000481319821 896673154 /nfs/dbraw/zinc/67/31/54/896673154.db2.gz HDKGLHGQOXAQKD-NRFANRHFSA-N 0 3 419.338 4.198 20 0 HIADHN CCS(=O)(=O)Nc1ccc([C@@H](C)NCc2cc(Br)cs2)cc1 ZINC000481323930 896681597 /nfs/dbraw/zinc/68/15/97/896681597.db2.gz QBOBVGBLMYJCPT-LLVKDONJSA-N 0 3 403.367 4.123 20 0 HIADHN CC[C@@H](c1ccccc1OC)N(C)C(=O)Nc1cccc(N2CCN(CC)CC2)c1 ZINC000481387370 896787596 /nfs/dbraw/zinc/78/75/96/896787596.db2.gz BLDVPXPOPMRNGE-QFIPXVFZSA-N 0 3 410.562 4.452 20 0 HIADHN Cc1cc(C)cc(-c2nnc(NC(=O)N(C)CCCN(C)Cc3ccco3)s2)c1 ZINC000481388941 896791427 /nfs/dbraw/zinc/79/14/27/896791427.db2.gz GCUIDHSTWUMWTP-UHFFFAOYSA-N 0 3 413.547 4.401 20 0 HIADHN Cc1nc(C(C)C)sc1[C@@H](C)NCc1cccc(OCCN2CCOCC2)c1 ZINC000481418848 896821787 /nfs/dbraw/zinc/82/17/87/896821787.db2.gz UTZLGEDPSSJNPT-QGZVFWFLSA-N 0 3 403.592 4.137 20 0 HIADHN COC(=O)[C@H]1CCCCCC[C@H]1NCC(=O)Nc1c(Cl)cccc1C(F)(F)F ZINC000481430374 896830885 /nfs/dbraw/zinc/83/08/85/896830885.db2.gz GJRRJCZKJDKXDE-SWLSCSKDSA-N 0 3 420.859 4.399 20 0 HIADHN COc1cc(C(C)=O)ccc1OC[C@@H](O)CN1CCC[C@H](c2ccc(F)cc2)CC1 ZINC000481496809 896872403 /nfs/dbraw/zinc/87/24/03/896872403.db2.gz PVYLOUWQZJAQSD-AVRDEDQJSA-N 0 3 415.505 4.046 20 0 HIADHN CC(C)C[C@@H](C)n1nccc1NC(=O)N(CCN(C)C)Cc1ccc(F)cc1F ZINC000481500110 896873439 /nfs/dbraw/zinc/87/34/39/896873439.db2.gz FKTQKEVNOSBXTH-MRXNPFEDSA-N 0 3 407.509 4.364 20 0 HIADHN CCCOc1ccc([C@H](C)NCc2ccc(S(=O)(=O)N(C)C(C)C)cc2)cc1 ZINC000481544127 896904643 /nfs/dbraw/zinc/90/46/43/896904643.db2.gz AKZOSSBDJKZLJB-SFHVURJKSA-N 0 3 404.576 4.355 20 0 HIADHN CSc1ccc(CN[C@@H](C)c2ccc(S(=O)(=O)N3CCCCC3)cc2)cc1 ZINC000481560664 896935457 /nfs/dbraw/zinc/93/54/57/896935457.db2.gz VSCYMEZGWYXBPJ-KRWDZBQOSA-N 0 3 404.601 4.434 20 0 HIADHN COc1cc(OC)c([C@H](C)NCc2cccc(CN3CCO[C@@H](C)C3)c2)cc1Cl ZINC000481560374 896936126 /nfs/dbraw/zinc/93/61/26/896936126.db2.gz UZJYNOXGYKKWGN-IRXDYDNUSA-N 0 3 418.965 4.429 20 0 HIADHN C[C@H](NCc1cccc(CN2CCO[C@@H](C)C2)c1)c1ccc(F)cc1OC(F)F ZINC000481561483 896938164 /nfs/dbraw/zinc/93/81/64/896938164.db2.gz ZRNZUEANHYRMNL-HOTGVXAUSA-N 0 3 408.464 4.499 20 0 HIADHN O[C@H](CN[C@H]1CCSc2c(F)cccc21)COc1ccc(C(F)(F)F)cc1 ZINC000481567943 896946200 /nfs/dbraw/zinc/94/62/00/896946200.db2.gz BNABYPJWJHRIIW-DYVFJYSZSA-N 0 3 401.425 4.411 20 0 HIADHN C[C@H](NCc1ccccc1-n1ccnc1)c1ccc(S(=O)(=O)C2CCCC2)cc1 ZINC000481572872 896951883 /nfs/dbraw/zinc/95/18/83/896951883.db2.gz NFTNCMDTGYIQKF-SFHVURJKSA-N 0 3 409.555 4.439 20 0 HIADHN COc1cc([C@H](C)NCc2cccc(CN3CCO[C@H](C)C3)c2)ccc1OC(F)F ZINC000481585340 896964301 /nfs/dbraw/zinc/96/43/01/896964301.db2.gz VAZQRMXFEDIFLZ-SJORKVTESA-N 0 3 420.500 4.368 20 0 HIADHN Cc1cc(NC(=O)c2occc2Br)cc(N2CCN(C(C)C)CC2)c1 ZINC000481627948 897012596 /nfs/dbraw/zinc/01/25/96/897012596.db2.gz GXZYSVFSRWXUPB-UHFFFAOYSA-N 0 3 406.324 4.133 20 0 HIADHN COc1ccc2c(c1)OC[C@@H]2CC(=O)Nc1cc(C)cc(N2CCN(C(C)C)CC2)c1 ZINC000481631763 897016564 /nfs/dbraw/zinc/01/65/64/897016564.db2.gz TXCVBGKMZUXHKW-IBGZPJMESA-N 0 3 423.557 4.039 20 0 HIADHN COc1cc(C)c(C(=O)Nc2cc(C)cc(N3CCN(C(C)C)CC3)c2)cc1OC ZINC000481663066 897046970 /nfs/dbraw/zinc/04/69/70/897046970.db2.gz FFALNHGRSNKXSY-UHFFFAOYSA-N 0 3 411.546 4.103 20 0 HIADHN CCCC[C@@H](N[C@@H]1C[C@H]1c1ccc(Br)s1)C(=O)Nc1cc(C)on1 ZINC000481684822 897069020 /nfs/dbraw/zinc/06/90/20/897069020.db2.gz IFAAXWLPJIXBBI-JHJVBQTASA-N 0 3 412.353 4.450 20 0 HIADHN CC[C@H](CN(CC)CC(=O)NCc1ccc(C(=O)N2CCCC2)cc1)c1ccccc1 ZINC000481769457 897155111 /nfs/dbraw/zinc/15/51/11/897155111.db2.gz TVHUYEBKXNKWIN-JOCHJYFZSA-N 0 3 421.585 4.055 20 0 HIADHN CC(C)C[C@H]1OCCC[C@@H]1NCC(=O)Nc1cccc(CSc2ccccn2)c1 ZINC000481769986 897155598 /nfs/dbraw/zinc/15/55/98/897155598.db2.gz VYBKGBJAIUFOJB-LEWJYISDSA-N 0 3 413.587 4.496 20 0 HIADHN COC(=O)c1ccccc1-c1ccc(CN2CCC(C(=O)N3CCC(C)CC3)CC2)o1 ZINC000481905485 897286545 /nfs/dbraw/zinc/28/65/45/897286545.db2.gz QDTXXBJJKGSBKB-UHFFFAOYSA-N 0 3 424.541 4.204 20 0 HIADHN CC[C@H](N[C@@H](CC)c1ccc(Cl)c(S(=O)(=O)NC)c1)c1ccc(OC)cc1 ZINC000481912019 897294607 /nfs/dbraw/zinc/29/46/07/897294607.db2.gz IAOKLHOEHWHJKY-OALUTQOASA-N 0 3 410.967 4.449 20 0 HIADHN COc1ccc(-c2ccncc2)cc1CN1CCC(NC(=O)CC2CCCC2)CC1 ZINC000481995589 897392284 /nfs/dbraw/zinc/39/22/84/897392284.db2.gz WHGQDZDCXLWLRK-UHFFFAOYSA-N 0 3 407.558 4.418 20 0 HIADHN COc1ccc(CNC(=O)C2CCN(Cc3cc4c(cc(C)cc4C)[nH]3)CC2)cc1 ZINC000482008941 897407188 /nfs/dbraw/zinc/40/71/88/897407188.db2.gz OCQAWOSQQYWYEN-UHFFFAOYSA-N 0 3 405.542 4.322 20 0 HIADHN CCc1c(C(=O)Nc2cc(C)cc(N3CCN(C(C)C)CC3)c2)[nH]c(C)c1C(C)=O ZINC000482010474 897409147 /nfs/dbraw/zinc/40/91/47/897409147.db2.gz ACWMIBNAXXXYQZ-UHFFFAOYSA-N 0 3 410.562 4.179 20 0 HIADHN COc1ccc(CN[C@H](C)c2cccc(N3CCOCC3)c2)cc1Br ZINC000482015768 897416854 /nfs/dbraw/zinc/41/68/54/897416854.db2.gz KGMHSCLONFCYDZ-OAHLLOKOSA-N 0 3 405.336 4.145 20 0 HIADHN CC(=O)N1CCN(c2ccccc2CN[C@@H](C)c2ccc(-c3ccncc3)cc2)CC1 ZINC000482018819 897422407 /nfs/dbraw/zinc/42/24/07/897422407.db2.gz TXHLRFWAPCTOBZ-FQEVSTJZSA-N 0 3 414.553 4.268 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N3CC[C@@H](C(F)(F)F)C(C)(C)C3)cc2)CC1 ZINC000482029993 897439530 /nfs/dbraw/zinc/43/95/30/897439530.db2.gz FAMBIHYCJOYTKD-LJQANCHMSA-N 0 3 411.512 4.268 20 0 HIADHN CC[C@H](NCc1ccccc1N1CCN(C(C)=O)CC1)c1ccc(OC(F)F)cc1 ZINC000482036485 897450830 /nfs/dbraw/zinc/45/08/30/897450830.db2.gz NTQRLSVAAROVSL-NRFANRHFSA-N 0 3 417.500 4.197 20 0 HIADHN COc1ccc(CCN[C@H](C)c2nnn(-c3ccc(F)cc3)c2C)cc1OC(F)F ZINC000482042561 897461816 /nfs/dbraw/zinc/46/18/16/897461816.db2.gz NXLJYTZDUBCDTH-CYBMUJFWSA-N 0 3 420.435 4.218 20 0 HIADHN C[C@H](NCC(=O)NCC(F)F)c1ccc(-c2ccccc2Br)s1 ZINC000482066118 897499877 /nfs/dbraw/zinc/49/98/77/897499877.db2.gz MCMTWRKOMPVXQG-JTQLQIEISA-N 0 3 403.292 4.210 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)Nc1ccc(OC(F)F)c2cccnc12 ZINC000482077869 897516888 /nfs/dbraw/zinc/51/68/88/897516888.db2.gz FKQHIWHPHCJCKY-UHFFFAOYSA-N 0 3 414.456 4.432 20 0 HIADHN Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)NC(=O)c1cccc(CN2CCCC2)c1 ZINC000482078884 897518302 /nfs/dbraw/zinc/51/83/02/897518302.db2.gz QNRBHBXVRLTCFI-CQSZACIVSA-N 0 3 408.468 4.149 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCCC1)Nc1nc(C(F)(F)F)cs1 ZINC000482081700 897520868 /nfs/dbraw/zinc/52/08/68/897520868.db2.gz JNJRCEHIFGTQDU-UHFFFAOYSA-N 0 3 408.515 4.035 20 0 HIADHN C[C@H](C(=O)NCCCN1CCN(C)C[C@@H]1c1ccccc1)c1cc2ccccc2o1 ZINC000482101642 897549512 /nfs/dbraw/zinc/54/95/12/897549512.db2.gz HXSWRBCRQXWFNR-SIKLNZKXSA-N 0 3 405.542 4.031 20 0 HIADHN CCS(=O)(=O)Nc1ccc([C@@H](C)NCc2ccc(OC)cc2C(F)(F)F)cc1 ZINC000482102781 897550666 /nfs/dbraw/zinc/55/06/66/897550666.db2.gz KLUSZPSLWKYHFL-CYBMUJFWSA-N 0 3 416.465 4.326 20 0 HIADHN C[C@H](N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)c1cccc(OC(F)(F)F)c1 ZINC000482109604 897560318 /nfs/dbraw/zinc/56/03/18/897560318.db2.gz LPOFKPSXFVHUPC-JXFKEZNVSA-N 0 3 406.448 4.470 20 0 HIADHN Cc1nc(C(C)(C)C)sc1[C@@H](C)NCCC(=O)N1CCN(c2ccccc2)CC1 ZINC000482115772 897567597 /nfs/dbraw/zinc/56/75/97/897567597.db2.gz SQVVAJMTONWLDH-QGZVFWFLSA-N 0 3 414.619 4.139 20 0 HIADHN COc1ccc(CN[C@H](C)c2ccc(I)cc2)cc1NC(C)=O ZINC000482117007 897569382 /nfs/dbraw/zinc/56/93/82/897569382.db2.gz YMPFZCGRUVZSJD-GFCCVEGCSA-N 0 3 424.282 4.109 20 0 HIADHN COc1ccc(CN[C@@H](C)c2ccc(I)cc2)cc1NC(C)=O ZINC000482117008 897569658 /nfs/dbraw/zinc/56/96/58/897569658.db2.gz YMPFZCGRUVZSJD-LBPRGKRZSA-N 0 3 424.282 4.109 20 0 HIADHN O=C([C@@H](Cc1ccccc1)N[C@H]1CCc2cc(Br)ccc21)N1CCCC1 ZINC000482121702 897576485 /nfs/dbraw/zinc/57/64/85/897576485.db2.gz OAEFYJVXVUCBSU-LEWJYISDSA-N 0 3 413.359 4.260 20 0 HIADHN CCO[C@@H]1C[C@@H](N[C@H](C)C(=O)Nc2c(C)nn(-c3ccccc3)c2C)C1(CC)CC ZINC000482142246 897601796 /nfs/dbraw/zinc/60/17/96/897601796.db2.gz WFFBNFDQLFRDNQ-DUXKGJEZSA-N 0 3 412.578 4.390 20 0 HIADHN COc1ccc(-c2ccncc2)cc1CN1CCC2(C[C@H]2C(=O)N2CCCCC2)CC1 ZINC000482142557 897601985 /nfs/dbraw/zinc/60/19/85/897601985.db2.gz XAXDDJWLKKUJOX-QHCPKHFHSA-N 0 3 419.569 4.372 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N[C@@H](c2ccc(Cl)cc2)C(F)(F)F)CC1 ZINC000482159542 897622542 /nfs/dbraw/zinc/62/25/42/897622542.db2.gz XNPCMGQMWQHBOW-KRWDZBQOSA-N 0 3 421.891 4.132 20 0 HIADHN Cc1cc(F)c(Br)cc1NC(=O)N[C@@H](CN(C)C)c1ccc(F)cc1 ZINC000482159786 897623030 /nfs/dbraw/zinc/62/30/30/897623030.db2.gz QLWUCYJOQZVIJU-KRWDZBQOSA-N 0 3 412.278 4.460 20 0 HIADHN Cc1nc(COc2ccccc2C(=O)NCCCN2CCc3ccccc3C2)cs1 ZINC000482182367 897651276 /nfs/dbraw/zinc/65/12/76/897651276.db2.gz GIBIWZPRZKOERO-UHFFFAOYSA-N 0 3 421.566 4.209 20 0 HIADHN CCC[C@H](N[C@H](C)c1cc(OC)c(OC)cc1C)C(=O)N1CCc2sccc2C1 ZINC000482237475 897717907 /nfs/dbraw/zinc/71/79/07/897717907.db2.gz DLOWVLACFNEAAZ-APWZRJJASA-N 0 3 416.587 4.478 20 0 HIADHN CCC[C@@H](N[C@H](C)c1ccc(OCCOC)cc1)C(=O)N1CCc2sccc2C1 ZINC000482236646 897718792 /nfs/dbraw/zinc/71/87/92/897718792.db2.gz BADGKYVGDRYDFE-DYESRHJHSA-N 0 3 416.587 4.178 20 0 HIADHN CCCN(C)[C@H](CNC(=O)Nc1cnn(C)c1C(F)(F)F)c1ccc(Cl)cc1 ZINC000482286633 897781831 /nfs/dbraw/zinc/78/18/31/897781831.db2.gz MKWHBNXJIANODZ-OAHLLOKOSA-N 0 3 417.863 4.297 20 0 HIADHN COc1ccc([C@@H](NC(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)C(F)(F)F)cc1 ZINC000482329600 897832804 /nfs/dbraw/zinc/83/28/04/897832804.db2.gz UGBARVDDXHNGPM-AZUAARDMSA-N 0 3 421.463 4.215 20 0 HIADHN COc1ccc([C@@H](NC(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)C(F)(F)F)cc1 ZINC000482330046 897834286 /nfs/dbraw/zinc/83/42/86/897834286.db2.gz UGBARVDDXHNGPM-UYAOXDASSA-N 0 3 421.463 4.215 20 0 HIADHN COc1ccc([C@H](NC(=O)N[C@H](CN2CCCC2)c2ccccc2)C(F)(F)F)cc1 ZINC000482364309 897882326 /nfs/dbraw/zinc/88/23/26/897882326.db2.gz VICOTQWJTWBQDH-UXHICEINSA-N 0 3 421.463 4.435 20 0 HIADHN CC(C)N(C(=O)CNC1(c2ccc(Br)cc2)CCOCC1)C1CCCC1 ZINC000505508723 914199564 /nfs/dbraw/zinc/19/95/64/914199564.db2.gz ZTRGXHMUJJLRPO-UHFFFAOYSA-N 0 3 423.395 4.224 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)N[C@H](c1c(F)cccc1F)C(F)(F)F ZINC000482372084 897894559 /nfs/dbraw/zinc/89/45/59/897894559.db2.gz MFXMDRLULQBVOZ-GOSISDBHSA-N 0 3 415.406 4.342 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)c2cc(Oc3ccccc3)ccn2)c1 ZINC000482387470 897918520 /nfs/dbraw/zinc/91/85/20/897918520.db2.gz NJYPFPGARLZRKD-UHFFFAOYSA-N 0 3 405.498 4.087 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)c2coc(-c3ccccc3Cl)n2)c1 ZINC000482392242 897925777 /nfs/dbraw/zinc/92/57/77/897925777.db2.gz CFKBPXCORXVSNA-UHFFFAOYSA-N 0 3 413.905 4.208 20 0 HIADHN COc1ccc(CN[C@H](C)c2cccc(NS(C)(=O)=O)c2)cc1OC1CCCC1 ZINC000482443735 898007136 /nfs/dbraw/zinc/00/71/36/898007136.db2.gz ZNOQCRQZPQJCQV-MRXNPFEDSA-N 0 3 418.559 4.239 20 0 HIADHN CCN(Cc1cnc(-c2cnn(C)c2)nc1)[C@H](C)Cc1ccccc1C(F)(F)F ZINC000482463377 898037903 /nfs/dbraw/zinc/03/79/03/898037903.db2.gz ZAKKSKHSSPZOGU-OAHLLOKOSA-N 0 3 403.452 4.349 20 0 HIADHN CCO[C@@H]1C[C@@H](NCc2ccccc2OCc2cccnc2)[C@@H]1Oc1ccccc1 ZINC000482495498 898076280 /nfs/dbraw/zinc/07/62/80/898076280.db2.gz OUAMJDSQIPUWCH-GPXOXTDOSA-N 0 3 404.510 4.375 20 0 HIADHN CCO[C@@H]1C[C@H](NCc2cc(OC)c(OC)cc2SC)[C@H]1Oc1ccccc1 ZINC000482513181 898099275 /nfs/dbraw/zinc/09/92/75/898099275.db2.gz RZQOSVZPXWAFFZ-UCNVEGJOSA-N 0 3 403.544 4.140 20 0 HIADHN Cc1nc(Cc2ccccc2)sc1[C@@H](C)NC[C@H](O)COc1ccc(F)c(F)c1 ZINC000482538192 898125757 /nfs/dbraw/zinc/12/57/57/898125757.db2.gz PTGOEWBICRDOND-PBHICJAKSA-N 0 3 418.509 4.411 20 0 HIADHN C[C@@H](N[C@H](C)c1cc(F)ccc1N1CCN(C)CC1)c1ccc(-n2cccn2)cc1 ZINC000482542729 898131530 /nfs/dbraw/zinc/13/15/30/898131530.db2.gz YQQFFRUBAAGWQU-RTBURBONSA-N 0 3 407.537 4.175 20 0 HIADHN COCCNc1ccc(CN[C@@H](C)c2ccc(S(=O)(=O)C3CCCC3)cc2)cc1 ZINC000482547133 898136743 /nfs/dbraw/zinc/13/67/43/898136743.db2.gz AHQCPWVMKBDUDK-SFHVURJKSA-N 0 3 416.587 4.312 20 0 HIADHN COc1cc(F)c([C@H](C)N[C@@H](C)c2cc(F)ccc2N2CCN(C)CC2)cc1OC ZINC000482558433 898150725 /nfs/dbraw/zinc/15/07/25/898150725.db2.gz SVXAZGXSORINRS-HOTGVXAUSA-N 0 3 419.516 4.146 20 0 HIADHN Cc1cc(NC(=O)c2ccc(N(C)C)cc2F)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000505530835 914225275 /nfs/dbraw/zinc/22/52/75/914225275.db2.gz VSJSXWCAAUNISG-FQEVSTJZSA-N 0 3 421.520 4.096 20 0 HIADHN CC[C@H](C)C(=O)Nc1cccc(CNC(=O)N[C@H]2CCN(Cc3ccccc3)[C@@H]2C)c1 ZINC000482583837 898180832 /nfs/dbraw/zinc/18/08/32/898180832.db2.gz UYKKGDOYXMMBIT-YYDVJCTNSA-N 0 3 422.573 4.133 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccccc1 ZINC000482586803 898184519 /nfs/dbraw/zinc/18/45/19/898184519.db2.gz MXKBQMSJUBFINB-XMMPIXPASA-N 0 3 415.537 4.036 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)c1cnn(-c2ccccc2F)c1-n1cccc1 ZINC000482606888 898207485 /nfs/dbraw/zinc/20/74/85/898207485.db2.gz HIOGLHCNUZXSCY-UHFFFAOYSA-N 0 3 417.488 4.424 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)c1ccccc1 ZINC000482630376 898232680 /nfs/dbraw/zinc/23/26/80/898232680.db2.gz PUBMNOIFRGLNKK-JRFVFWCSSA-N 0 3 419.569 4.469 20 0 HIADHN CC(C)(C)c1nn(Cc2ccccc2)cc1CNCCNC(=O)c1ccccc1Cl ZINC000482677355 898278899 /nfs/dbraw/zinc/27/88/99/898278899.db2.gz HLQSCEDBPDCEOG-UHFFFAOYSA-N 0 3 424.976 4.402 20 0 HIADHN CN1C(=O)C[C@H](NCc2cc(Cl)cc3cccnc32)[C@H]1c1ccc(F)c(F)c1 ZINC000482702026 898302017 /nfs/dbraw/zinc/30/20/17/898302017.db2.gz AOXTZIUYMRTERB-GHTZIAJQSA-N 0 3 401.844 4.228 20 0 HIADHN CSc1nc(C(C)C)nc(C)c1C(=O)NCC1(N2CCSCC2)CCCCC1 ZINC000482710655 898309719 /nfs/dbraw/zinc/30/97/19/898309719.db2.gz QXFCWBBPJARXJO-UHFFFAOYSA-N 0 3 422.664 4.112 20 0 HIADHN CC(C)c1nn(-c2ccc(Br)cc2)cc1CN[C@@H](C)CC[S@](C)=O ZINC000482753196 898359163 /nfs/dbraw/zinc/35/91/63/898359163.db2.gz OMDOSLRHMKQLTI-BSEYFRJRSA-N 0 3 412.397 4.005 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCCC1)c1occc1COc1ccccc1 ZINC000482764594 898372632 /nfs/dbraw/zinc/37/26/32/898372632.db2.gz TXCMIJIINLPEBL-UHFFFAOYSA-N 0 3 414.571 4.340 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CC=C(COC)CC1)c1ccc(C(F)(F)F)cc1 ZINC000482877691 898490035 /nfs/dbraw/zinc/49/00/35/898490035.db2.gz RTVZRAXXVHFPRM-IBGZPJMESA-N 0 3 413.484 4.076 20 0 HIADHN CN1CCN(C)[C@H](CN[C@@H](Cc2cccc(F)c2)c2ccc(Cl)c(Cl)c2)C1 ZINC000482886454 898500552 /nfs/dbraw/zinc/50/05/52/898500552.db2.gz NXVLKKSJVABYOR-NQIIRXRSSA-N 0 3 410.364 4.252 20 0 HIADHN C[C@H]1CN(C(=O)Nc2ccc3c(c2)oc2ccccc23)CC[C@H]1N1CCN(C)CC1 ZINC000482908411 898527559 /nfs/dbraw/zinc/52/75/59/898527559.db2.gz PNADYJSFYAAPQM-LAUBAEHRSA-N 0 3 406.530 4.076 20 0 HIADHN COc1cccc2c1CC[C@@H]2NCc1cccc(NC(=O)NCc2ccncc2)c1 ZINC000482943591 898566437 /nfs/dbraw/zinc/56/64/37/898566437.db2.gz CZUCWMUNYKHBCS-QFIPXVFZSA-N 0 3 402.498 4.189 20 0 HIADHN C[C@H](NCCOc1ccc(OC(F)(F)F)cc1)c1ccc(Br)cn1 ZINC000482976540 898612659 /nfs/dbraw/zinc/61/26/59/898612659.db2.gz INLHRYBBCXMILM-NSHDSACASA-N 0 3 405.214 4.472 20 0 HIADHN CC(C)N1CCC[C@@H](N2CCC(C(=O)Nc3ccc(Cl)c(Cl)c3)CC2)C1=O ZINC000483065399 898745532 /nfs/dbraw/zinc/74/55/32/898745532.db2.gz CXGNHGVCFJGEPZ-GOSISDBHSA-N 0 3 412.361 4.043 20 0 HIADHN Cc1ccc(C[C@@H](N[C@@H](C)c2ccc(NS(C)(=O)=O)cc2)c2ccccn2)cc1 ZINC000483134883 898815943 /nfs/dbraw/zinc/81/59/43/898815943.db2.gz NJVCIOXFULJTNB-FDDCHVKYSA-N 0 3 409.555 4.396 20 0 HIADHN C[C@H](NC(=O)c1c[nH]c2cccc(Br)c12)[C@H](c1ccccc1)N(C)C ZINC000505580676 914286850 /nfs/dbraw/zinc/28/68/50/914286850.db2.gz HPXALCGQAIGFJV-ORAYPTAESA-N 0 3 400.320 4.352 20 0 HIADHN CC(C)CN(C(=O)NC1CCN(CCOC(C)C)CC1)[C@H]1CCCc2cccnc21 ZINC000483144629 898824029 /nfs/dbraw/zinc/82/40/29/898824029.db2.gz CDURHGYNCMVUFQ-QFIPXVFZSA-N 0 3 416.610 4.016 20 0 HIADHN Cc1cccc(N2CCC(N[C@@H](C)c3ccccc3I)CC2)n1 ZINC000483201740 898855610 /nfs/dbraw/zinc/85/56/10/898855610.db2.gz OSACHRLOOZLPBJ-HNNXBMFYSA-N 0 3 421.326 4.314 20 0 HIADHN O=C(Nc1c(F)cc(Br)cc1F)N1CCN(C2CCCCC2)CC1 ZINC000483213136 898862043 /nfs/dbraw/zinc/86/20/43/898862043.db2.gz UGUXSSXSQCXRAS-UHFFFAOYSA-N 0 3 402.283 4.210 20 0 HIADHN COc1cnccc1N1CCN([C@H](C)c2cccc(NC(=O)c3ccccc3)c2)CC1 ZINC000483215346 898862581 /nfs/dbraw/zinc/86/25/81/898862581.db2.gz HJBXWXVHDYTUAW-LJQANCHMSA-N 0 3 416.525 4.226 20 0 HIADHN C[C@H](NC(=O)NCc1ccccc1OCC(F)(F)F)[C@@H](c1ccccc1)N(C)C ZINC000483276574 898915412 /nfs/dbraw/zinc/91/54/12/898915412.db2.gz NZEUHMFYMLNBDQ-KXBFYZLASA-N 0 3 409.452 4.118 20 0 HIADHN C[C@H](NC(=O)Cc1ccc(OCc2ccccn2)cc1)[C@@H](c1ccccc1)N(C)C ZINC000505588909 914295702 /nfs/dbraw/zinc/29/57/02/914295702.db2.gz WGKXELRDASBBST-DFBJGRDBSA-N 0 3 403.526 4.011 20 0 HIADHN COC1(CN2CCN(CCOC(c3ccccc3)c3ccccc3)CC2)CCCC1 ZINC000483292572 898926432 /nfs/dbraw/zinc/92/64/32/898926432.db2.gz SXFKMFUPGYQKLU-UHFFFAOYSA-N 0 3 408.586 4.369 20 0 HIADHN CC(C)N(C)c1ccc(CN2CCC[C@@H](c3nc(-c4cccc(F)c4)no3)C2)cn1 ZINC000483295522 898929654 /nfs/dbraw/zinc/92/96/54/898929654.db2.gz YUYNREFJAWEIGP-LJQANCHMSA-N 0 3 409.509 4.495 20 0 HIADHN CC1(C(=O)Nc2cc(Br)ccc2[O-])CC[NH+](Cc2ccccc2)CC1 ZINC000483341361 898972650 /nfs/dbraw/zinc/97/26/50/898972650.db2.gz UWHWEIHTWGIDIY-UHFFFAOYSA-N 0 3 403.320 4.396 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)NCc1nc(-c2cc3ccccc3o2)cs1 ZINC000483368232 899005563 /nfs/dbraw/zinc/00/55/63/899005563.db2.gz QXAXFNBDYSSHBW-UHFFFAOYSA-N 0 3 424.526 4.423 20 0 HIADHN CC(C)CN(CCN(C)C)C(=O)NCc1nc(-c2cc3ccccc3o2)cs1 ZINC000483375612 899010610 /nfs/dbraw/zinc/01/06/10/899010610.db2.gz ZIEWRVMKBXJCSY-UHFFFAOYSA-N 0 3 400.548 4.286 20 0 HIADHN CS[C@H]1CN(C(=O)c2sc(-c3ccc(C)cc3C)nc2C)C[C@H]1N1CCCC1 ZINC000483391137 899025411 /nfs/dbraw/zinc/02/54/11/899025411.db2.gz DNTWGYSHLJOBMC-MOPGFXCFSA-N 0 3 415.628 4.387 20 0 HIADHN CS[C@H]1CN(C(=O)c2sc(-c3ccc(Cl)cc3)nc2C)C[C@H]1N1CCCC1 ZINC000483390977 899026190 /nfs/dbraw/zinc/02/61/90/899026190.db2.gz FCYLDJVJJPGOGR-SJORKVTESA-N 0 3 422.019 4.424 20 0 HIADHN CS[C@@H]1CN(C(=O)c2csc(-c3ccccc3Cl)n2)C[C@H]1N1CCCC1 ZINC000483392187 899028129 /nfs/dbraw/zinc/02/81/29/899028129.db2.gz HKFBFLAOKOVZME-IAGOWNOFSA-N 0 3 407.992 4.115 20 0 HIADHN CS[C@@H]1CN(C(=O)c2sc(-c3cccc(Cl)c3)nc2C)C[C@@H]1N1CCCC1 ZINC000483398272 899031753 /nfs/dbraw/zinc/03/17/53/899031753.db2.gz XJHWELYZNLHERU-DLBZAZTESA-N 0 3 422.019 4.424 20 0 HIADHN Cc1ccc2c(C(=O)Nc3ccccc3CN3CCC[C@@H](C(N)=O)C3)csc2c1 ZINC000483427738 899058287 /nfs/dbraw/zinc/05/82/87/899058287.db2.gz AZWPECCESVUJKZ-QGZVFWFLSA-N 0 3 407.539 4.159 20 0 HIADHN COc1ccccc1-c1nc(C2CCN(CC3=Cc4ccccc4OC3)CC2)no1 ZINC000483442257 899076969 /nfs/dbraw/zinc/07/69/69/899076969.db2.gz UJIQKHQSLVEBPA-UHFFFAOYSA-N 0 3 403.482 4.401 20 0 HIADHN C[C@H](NC(=O)CCc1nnc(-c2cc3ccccc3o2)o1)[C@@H](c1ccccc1)N(C)C ZINC000505608299 914312243 /nfs/dbraw/zinc/31/22/43/914312243.db2.gz MWLLVOAUIUIXOZ-HJPURHCSSA-N 0 3 418.497 4.223 20 0 HIADHN O=C(CN1CCN(C2CCCCC2)CC1)N[C@@H](c1cccs1)c1ccc(F)cc1 ZINC000483487080 899138519 /nfs/dbraw/zinc/13/85/19/899138519.db2.gz QPLKYOBIEDRWMB-HSZRJFAPSA-N 0 3 415.578 4.043 20 0 HIADHN Cc1nc(COc2ccccc2C(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)cs1 ZINC000505614199 914318081 /nfs/dbraw/zinc/31/80/81/914318081.db2.gz TZDWGAFWLAYROO-OPAMFIHVSA-N 0 3 409.555 4.452 20 0 HIADHN CN(CCCc1cc(-c2ccc(F)cc2)n(C)n1)[C@@H]1CCc2ccccc2NC1=O ZINC000483572335 899225459 /nfs/dbraw/zinc/22/54/59/899225459.db2.gz XKPQFTZFGOPGGK-JOCHJYFZSA-N 0 3 406.505 4.044 20 0 HIADHN CN(C)C[C@@H](NC(=O)Nc1cc(-c2ccc(Cl)s2)nn1C)c1ccc(F)cc1 ZINC000483573012 899227040 /nfs/dbraw/zinc/22/70/40/899227040.db2.gz HUOYRNUUKQFUAC-OAHLLOKOSA-N 0 3 421.929 4.366 20 0 HIADHN C[C@H](NCc1cccc(OCC(N)=O)c1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000483635978 899291039 /nfs/dbraw/zinc/29/10/39/899291039.db2.gz IZAHMAMOOLEUDJ-NSHDSACASA-N 0 3 420.353 4.439 20 0 HIADHN Cc1ccc(NC(=O)[C@H]2CCCN(C(=O)c3ccc(Cl)cc3)C2)c(CN(C)C)c1 ZINC000505636325 914335773 /nfs/dbraw/zinc/33/57/73/914335773.db2.gz PXTWUKBPBBYADV-SFHVURJKSA-N 0 3 413.949 4.201 20 0 HIADHN COCCC1(CNC(=O)N(Cc2ccccc2)C2CCN(C)CC2)CCCCC1 ZINC000483686743 899345401 /nfs/dbraw/zinc/34/54/01/899345401.db2.gz VOZAUOQDGFDJSA-UHFFFAOYSA-N 0 3 401.595 4.279 20 0 HIADHN Cc1nc2c(s1)[C@H](NCc1cc(C(F)(F)F)ccc1N1CCN(C)CC1)CCC2 ZINC000483739984 899402010 /nfs/dbraw/zinc/40/20/10/899402010.db2.gz HAYUWRQPROCEJU-QGZVFWFLSA-N 0 3 424.536 4.389 20 0 HIADHN C[C@@H](CNC(=O)Nc1cccc(CN(C)C)c1)Oc1ccccc1Br ZINC000483833158 899512514 /nfs/dbraw/zinc/51/25/14/899512514.db2.gz NTEARKAKJCAOQI-AWEZNQCLSA-N 0 3 406.324 4.100 20 0 HIADHN C[C@@H](NCc1ccc(-c2cccnc2)cc1)c1cccc(N2CCCS2(=O)=O)c1 ZINC000483844665 899524305 /nfs/dbraw/zinc/52/43/05/899524305.db2.gz ALBJIEOHSUPHAU-GOSISDBHSA-N 0 3 407.539 4.139 20 0 HIADHN CC[C@H](NCc1cc(N(C)C)nc2ccccc12)c1ccccc1OCC(=O)N(C)C ZINC000483864742 899546317 /nfs/dbraw/zinc/54/63/17/899546317.db2.gz DWUZKTVOZSUZQG-NRFANRHFSA-N 0 3 420.557 4.009 20 0 HIADHN CC[C@@H]1Oc2cc([C@H](C)N[C@@H](C)c3cccc(N4CCCC4=O)c3)ccc2NC1=O ZINC000483868223 899549327 /nfs/dbraw/zinc/54/93/27/899549327.db2.gz GPTRULJKPZXURD-QYWGDWMGSA-N 0 3 407.514 4.335 20 0 HIADHN CC[C@H](CNC(=O)N(Cc1ccco1)C1CCN(C)CC1)Oc1ccccc1Cl ZINC000483994970 899635605 /nfs/dbraw/zinc/63/56/05/899635605.db2.gz RQNFVOCODJYFET-GOSISDBHSA-N 0 3 419.953 4.396 20 0 HIADHN Cc1ccc(C(=O)N2CCN(C3CCCCC3)CC2)cc1NC(=O)c1ccccc1 ZINC000484123108 899745016 /nfs/dbraw/zinc/74/50/16/899745016.db2.gz MSMVUWZXGZZSSA-UHFFFAOYSA-N 0 3 405.542 4.338 20 0 HIADHN CCCCCOc1ccc(C(=O)CCC(=O)N2CC[C@@]3(C2)CCCN(C)C3)cc1 ZINC000505688016 914378599 /nfs/dbraw/zinc/37/85/99/914378599.db2.gz LYOZUNOODYZNHI-DEOSSOPVSA-N 0 3 400.563 4.163 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)NC[C@@H](C)c1c(Cl)cccc1Cl ZINC000484164870 899784096 /nfs/dbraw/zinc/78/40/96/899784096.db2.gz NMSXUEOIVMZSJD-CQSZACIVSA-N 0 3 422.356 4.222 20 0 HIADHN Cc1c([C@@H](C)NCC2CCN(C(=O)c3ccccc3)CC2)nnn1-c1ccc(C)cc1 ZINC000484171380 899790891 /nfs/dbraw/zinc/79/08/91/899790891.db2.gz URFBGRRTFYZFEH-LJQANCHMSA-N 0 3 417.557 4.087 20 0 HIADHN Cc1c(CSC(C)C)cccc1NC(=O)N1CC[C@@H](N2CCN(C)CC2)[C@H](C)C1 ZINC000484280455 899849754 /nfs/dbraw/zinc/84/97/54/899849754.db2.gz MSOFMGUMLYZZHM-XMSQKQJNSA-N 0 3 418.651 4.126 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N[C@@H](c1ccc(F)cc1)[C@@H]1CCCO1)c1ccco1 ZINC000484293489 899857633 /nfs/dbraw/zinc/85/76/33/899857633.db2.gz HRVVWPALZVJMLF-MTOHEIAKSA-N 0 3 403.498 4.067 20 0 HIADHN CC[C@H](N[C@H](C)c1sc(-c2ccc(Cl)cc2)nc1C)C(=O)N1CCOCC1 ZINC000484305010 899864789 /nfs/dbraw/zinc/86/47/89/899864789.db2.gz UJKDPRKCPHBURF-DYVFJYSZSA-N 0 3 407.967 4.060 20 0 HIADHN Cc1cccn2c(=O)cc(CN[C@](C)(c3ccc(Br)cc3)C(C)C)nc12 ZINC000484326446 899880621 /nfs/dbraw/zinc/88/06/21/899880621.db2.gz DJPMCXKXDKUEOS-NRFANRHFSA-N 0 3 414.347 4.426 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)NCc1cc(F)ccc1Br)c1ccco1 ZINC000484337968 899889927 /nfs/dbraw/zinc/88/99/27/899889927.db2.gz INVDRNPDRKJAJR-LRDDRELGSA-N 0 3 412.303 4.110 20 0 HIADHN COc1ccc(CC(=O)N(c2cccc(SC)c2)C2CCN(C)CC2)cc1OC ZINC000484404884 899928812 /nfs/dbraw/zinc/92/88/12/899928812.db2.gz NMIBPKHJOLAKGS-UHFFFAOYSA-N 0 3 414.571 4.096 20 0 HIADHN COCCOc1cccc(C(=O)N(c2cccc(SC)c2)C2CCN(C)CC2)c1 ZINC000484412051 899933485 /nfs/dbraw/zinc/93/34/85/899933485.db2.gz WJNJLXTYNXOJOK-UHFFFAOYSA-N 0 3 414.571 4.175 20 0 HIADHN COc1ccc(O[C@H](C)C(=O)N(c2cccc(SC)c2)C2CCN(C)CC2)cc1 ZINC000484414000 899933678 /nfs/dbraw/zinc/93/36/78/899933678.db2.gz ZDLSKNSQHYCAOB-QGZVFWFLSA-N 0 3 414.571 4.312 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)CCN[C@@H](C)c1cnn(Cc2ccccc2)c1 ZINC000484466801 899960644 /nfs/dbraw/zinc/96/06/44/899960644.db2.gz LVTCWMPGFQGUNA-INIZCTEOSA-N 0 3 412.921 4.273 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)CCN[C@H](C)c1cnn(Cc2ccccc2)c1 ZINC000484466803 899961475 /nfs/dbraw/zinc/96/14/75/899961475.db2.gz LVTCWMPGFQGUNA-MRXNPFEDSA-N 0 3 412.921 4.273 20 0 HIADHN CCc1cc(N2CCC(N[C@H](C)c3ccc(F)cc3Br)CC2)ncn1 ZINC000484470648 899963913 /nfs/dbraw/zinc/96/39/13/899963913.db2.gz GJMLCOWFDPNBRW-CYBMUJFWSA-N 0 3 407.331 4.260 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)c3ccccc3NCc3ccco3)cc2)CC1 ZINC000484476514 899969380 /nfs/dbraw/zinc/96/93/80/899969380.db2.gz UTCDNIQDMUMSES-UHFFFAOYSA-N 0 3 418.541 4.282 20 0 HIADHN CC[C@@H](CN[C@H](C)c1cccc(S(=O)(=O)N(C)C)c1)Oc1ccccc1Cl ZINC000484483709 899975594 /nfs/dbraw/zinc/97/55/94/899975594.db2.gz AQQDMPWLTUIWGU-WBVHZDCISA-N 0 3 410.967 4.099 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2cccnc2-c2ccccc2)c1 ZINC000484497605 899988131 /nfs/dbraw/zinc/98/81/31/899988131.db2.gz CTHRXDHXRLXCOL-UHFFFAOYSA-N 0 3 404.514 4.353 20 0 HIADHN CCCOc1cc(F)ccc1NC(=O)N(CCN(C)C)Cc1cccc(OC)c1 ZINC000484497977 899988200 /nfs/dbraw/zinc/98/82/00/899988200.db2.gz JUSVZCJGHHAVNV-UHFFFAOYSA-N 0 3 403.498 4.219 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(OCC2CC2)c(F)c1)c1ccc(NS(C)(=O)=O)cc1 ZINC000484500129 899991064 /nfs/dbraw/zinc/99/10/64/899991064.db2.gz HCANUTGUROAYMA-GJZGRUSLSA-N 0 3 406.523 4.398 20 0 HIADHN C[C@@H](N[C@H]1CCN(C(=O)CCc2ccccc2)C1)c1ccccc1OC(F)(F)F ZINC000484509088 900000928 /nfs/dbraw/zinc/00/09/28/900000928.db2.gz YTCJZTLFZJRDIF-AEFFLSMTSA-N 0 3 406.448 4.470 20 0 HIADHN CC(C)n1cc([C@H](C)N[C@@H]2CCN(c3ncc(C(F)(F)F)cc3Cl)C2)cn1 ZINC000484523630 900012029 /nfs/dbraw/zinc/01/20/29/900012029.db2.gz VVHYJGZRJPDGDC-SWLSCSKDSA-N 0 3 401.864 4.461 20 0 HIADHN CCCOc1ccc(O[C@H]2CCCC[C@H]2NCc2cc(=O)n3ccsc3n2)cc1 ZINC000484621538 900074894 /nfs/dbraw/zinc/07/48/94/900074894.db2.gz ACHNQGPORQBQMY-UXHICEINSA-N 0 3 413.543 4.025 20 0 HIADHN Brc1ccc(-c2nccc(CN[C@H]3CCCC[C@@H]3n3cccn3)n2)cc1 ZINC000484626360 900079214 /nfs/dbraw/zinc/07/92/14/900079214.db2.gz IRZOOIRZGMGNGK-OALUTQOASA-N 0 3 412.335 4.376 20 0 HIADHN Cc1nn(C)c(=O)c(-c2nc(CN[C@H]3CCCC[C@@H]3c3ccccc3)cs2)c1C ZINC000484640914 900088729 /nfs/dbraw/zinc/08/87/29/900088729.db2.gz AANMJHHTMIZJOJ-UXHICEINSA-N 0 3 408.571 4.337 20 0 HIADHN C[C@H](NC(=O)NCCN(C)Cc1ccccc1)c1ccc(Oc2cccnc2)cc1 ZINC000484671521 900113302 /nfs/dbraw/zinc/11/33/02/900113302.db2.gz SQWIYJWESGVNEM-IBGZPJMESA-N 0 3 404.514 4.366 20 0 HIADHN CCc1nnc(C2CCN(Cc3ncc(-c4ccccc4Br)o3)CC2)[nH]1 ZINC000484735453 900160697 /nfs/dbraw/zinc/16/06/97/900160697.db2.gz JQDIWHKEXDQXOJ-UHFFFAOYSA-N 0 3 416.323 4.164 20 0 HIADHN COc1ccc([C@H](C)NC(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)c(C)c1OC ZINC000484742723 900165515 /nfs/dbraw/zinc/16/55/15/900165515.db2.gz ZCVWGHOUYGOBLQ-CMKODMSKSA-N 0 3 411.546 4.208 20 0 HIADHN CN(CCNc1ncc(C(=O)N2CCCCC2)cc1Cl)Cc1ccc(F)cc1 ZINC000484825984 900229568 /nfs/dbraw/zinc/22/95/68/900229568.db2.gz ADBAVPAUSWOZGZ-UHFFFAOYSA-N 0 3 404.917 4.044 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)NCC1(c2ccccc2C)CCOCC1)c1ccco1 ZINC000484948942 900316943 /nfs/dbraw/zinc/31/69/43/900316943.db2.gz UQDSRPSFCPMZEG-TZIWHRDSSA-N 0 3 413.562 4.065 20 0 HIADHN Cc1cccc(C)c1NC(=O)CCCN1CCCN(C(=O)c2ccccc2F)CC1 ZINC000484978914 900335270 /nfs/dbraw/zinc/33/52/70/900335270.db2.gz IDXPTOWSKHQJCL-UHFFFAOYSA-N 0 3 411.521 4.009 20 0 HIADHN Cc1cccc(C)c1NC(=O)CCCN1CCCN(C(=O)c2cccc(F)c2)CC1 ZINC000484980908 900337908 /nfs/dbraw/zinc/33/79/08/900337908.db2.gz OEJNOEJDXQXLHK-UHFFFAOYSA-N 0 3 411.521 4.009 20 0 HIADHN Cc1cccc(CN2CCN(CCC(=O)Nc3ccccc3C(F)(F)F)CC2)c1 ZINC000484983855 900339720 /nfs/dbraw/zinc/33/97/20/900339720.db2.gz CHVCYPQVVVASAN-UHFFFAOYSA-N 0 3 405.464 4.160 20 0 HIADHN CCOc1cc(CN(Cc2ccccc2)CC2CCC2)nc2nc(C(F)(F)F)nn21 ZINC000485025255 900369433 /nfs/dbraw/zinc/36/94/33/900369433.db2.gz OKXQNKOLRULVOO-UHFFFAOYSA-N 0 3 419.451 4.344 20 0 HIADHN CC(C)c1c(NC(=O)N2CC[C@H]3CCN(C)C[C@H]32)cnn1-c1ccccc1Cl ZINC000485144101 900444607 /nfs/dbraw/zinc/44/46/07/900444607.db2.gz IWLHCQFMPIXONJ-DNVCBOLYSA-N 0 3 401.942 4.207 20 0 HIADHN CCc1c(NC(=O)N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)cnn1C(CC)CC ZINC000485210113 900500084 /nfs/dbraw/zinc/50/00/84/900500084.db2.gz RDEUYMKWQMOBGC-HDICACEKSA-N 0 3 419.614 4.160 20 0 HIADHN C[C@@H]1[C@H](NC(=O)NC[C@@H]2CCCO[C@@H]2c2ccccc2)CCN1Cc1ccccc1 ZINC000485267310 900548584 /nfs/dbraw/zinc/54/85/84/900548584.db2.gz BHMOBEVZLLNAOK-OYYPCOLYSA-N 0 3 407.558 4.117 20 0 HIADHN C[C@@H]1[C@H](NC(=O)NC[C@H]2CCCO[C@H]2c2ccccc2)CCN1Cc1ccccc1 ZINC000485267302 900548845 /nfs/dbraw/zinc/54/88/45/900548845.db2.gz BHMOBEVZLLNAOK-CDIGIKMISA-N 0 3 407.558 4.117 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NC[C@@H]1CCOC[C@@H]1C)c1ccc(C(F)(F)F)cc1 ZINC000485335273 900621670 /nfs/dbraw/zinc/62/16/70/900621670.db2.gz ZXAMLAOOVNNBSA-VDZJLULYSA-N 0 3 415.500 4.060 20 0 HIADHN CCc1c(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2)cnn1-c1ccccc1C ZINC000485367991 900665077 /nfs/dbraw/zinc/66/50/77/900665077.db2.gz WZFDQINYERDTLD-UHFFFAOYSA-N 0 3 423.536 4.478 20 0 HIADHN COc1ccc(NC(=O)CCN2CCC[C@H]2CC(=O)c2cccs2)cc1Cl ZINC000485410628 900708195 /nfs/dbraw/zinc/70/81/95/900708195.db2.gz QVMRAPQXLZXYRU-HNNXBMFYSA-N 0 3 406.935 4.476 20 0 HIADHN Clc1ccc2c(c1)nccc2SCCN1CCN(CC2CCOCC2)CC1 ZINC000485554398 900828577 /nfs/dbraw/zinc/82/85/77/900828577.db2.gz VRSBYVCKCSSOME-UHFFFAOYSA-N 0 3 405.995 4.025 20 0 HIADHN COc1cc(OC)c(NC(=O)N(Cc2ccccc2)C2CCN(C)CC2)cc1Cl ZINC000485589656 900852209 /nfs/dbraw/zinc/85/22/09/900852209.db2.gz JJOSCHUPCYLAIW-UHFFFAOYSA-N 0 3 417.937 4.486 20 0 HIADHN COc1cc(C(=O)N2CCN(Cc3ccccc3)C3(CCCCC3)C2)cc(OC)c1O ZINC000485588377 900852376 /nfs/dbraw/zinc/85/23/76/900852376.db2.gz CLIQXVVUBUBOBB-UHFFFAOYSA-N 0 3 424.541 4.070 20 0 HIADHN Cc1ccc(-c2ccc(C(=O)N3CC[C@H](N4CCN(C)CC4)[C@H](C)C3)c(F)c2)cc1C ZINC000485783499 901037866 /nfs/dbraw/zinc/03/78/66/901037866.db2.gz HBWHHRRJWZUQPL-NLFFAJNJSA-N 0 3 423.576 4.208 20 0 HIADHN Cn1c2cc(Br)ccc2nc1CN1CCCN(Cc2ccccc2)CC1 ZINC000485816727 901065845 /nfs/dbraw/zinc/06/58/45/901065845.db2.gz JRCCCYSSNFEVBX-UHFFFAOYSA-N 0 3 413.363 4.044 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@H](C)N[C@H](C)c2ccc3ncsc3c2)cc1F ZINC000485820786 901068206 /nfs/dbraw/zinc/06/82/06/901068206.db2.gz UUIQSFCJDHYPDC-KGLIPLIRSA-N 0 3 401.507 4.142 20 0 HIADHN CC[C@H](NC[C@@H](O)COc1cccc(C(C)=O)c1)c1cc(F)cc(Br)c1 ZINC000485848244 901092657 /nfs/dbraw/zinc/09/26/57/901092657.db2.gz VGTZGIWHBYAWIK-QUCCMNQESA-N 0 3 424.310 4.271 20 0 HIADHN Cc1cc(NC(=O)CC2CC(OC(C)(C)C)C2)cc(N2CCN(C(C)C)CC2)c1 ZINC000485974388 901191662 /nfs/dbraw/zinc/19/16/62/901191662.db2.gz GKMVNULHKXVVEI-UHFFFAOYSA-N 0 3 401.595 4.448 20 0 HIADHN O=C(N[C@@H](c1cccc(Cl)c1)c1ccccn1)N1CCN(C2CCCCC2)CC1 ZINC000486006088 901220033 /nfs/dbraw/zinc/22/00/33/901220033.db2.gz RMJROZPPKXYVGC-QFIPXVFZSA-N 0 3 412.965 4.484 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)c1ccc(Oc2ccc(F)c(F)c2)cc1 ZINC000486011625 901221222 /nfs/dbraw/zinc/22/12/22/901221222.db2.gz ZRWNFBKHUFTHPY-UHFFFAOYSA-N 0 3 411.452 4.356 20 0 HIADHN COc1cc([C@@H](C)NC[C@@H](c2ccccc2)C(F)(F)F)ccc1S(C)(=O)=O ZINC000486062860 901257826 /nfs/dbraw/zinc/25/78/26/901257826.db2.gz RUZFVWZTFQQFLM-CJNGLKHVSA-N 0 3 401.450 4.095 20 0 HIADHN CCCOc1cn(-c2ccccc2)nc1C(=O)N(CCN(C)C)Cc1ccc(F)cc1 ZINC000486128102 901314986 /nfs/dbraw/zinc/31/49/86/901314986.db2.gz ZMPABQSWYBXHRC-UHFFFAOYSA-N 0 3 424.520 4.004 20 0 HIADHN C[C@H](C(=O)N(c1nccs1)C1CCCCC1)N1CCN(C2CCCCC2)CC1 ZINC000486239425 901422052 /nfs/dbraw/zinc/42/20/52/901422052.db2.gz AFGHKRBMFVYHFU-GOSISDBHSA-N 0 3 404.624 4.148 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)c1nc2ccccc2cc1Cl ZINC000486269890 901452739 /nfs/dbraw/zinc/45/27/39/901452739.db2.gz WIAMKFMDSQGOOU-LJQANCHMSA-N 0 3 408.933 4.410 20 0 HIADHN CCN(CCOc1ccc(Br)cc1)C(=O)c1ccccc1CN(C)C ZINC000486482801 901640673 /nfs/dbraw/zinc/64/06/73/901640673.db2.gz ARSJZFIDMNODFT-UHFFFAOYSA-N 0 3 405.336 4.052 20 0 HIADHN CC(C)[C@H](Oc1ccc(Cl)cc1)C(=O)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000486564647 901710210 /nfs/dbraw/zinc/71/02/10/901710210.db2.gz JLZPXZDMBOLLQM-QFIPXVFZSA-N 0 3 416.949 4.339 20 0 HIADHN COc1ccc(NC(=O)N2CCN(C3CCOCC3)C[C@H]2C)cc1Cc1ccccc1 ZINC000486656601 901778581 /nfs/dbraw/zinc/77/85/81/901778581.db2.gz ZRGKWPKIUGWISU-LJQANCHMSA-N 0 3 423.557 4.003 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CC(=O)NC[C@H](c1ccc(C)cc1)N1CCCC1 ZINC000486664394 901782623 /nfs/dbraw/zinc/78/26/23/901782623.db2.gz LESARSDJVIWGSS-RUZDIDTESA-N 0 3 416.569 4.293 20 0 HIADHN O=C(NCc1coc(-c2cccs2)n1)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000505921883 914567760 /nfs/dbraw/zinc/56/77/60/914567760.db2.gz CGQDCHZVYQXONS-QGZVFWFLSA-N 0 3 417.481 4.177 20 0 HIADHN CCOc1ncc(C(=O)N(CC)[C@H]2CCN([C@@H](C)c3ccccc3)C2)cc1Cl ZINC000486739272 901823273 /nfs/dbraw/zinc/82/32/73/901823273.db2.gz YWZNBMZNULTIQH-LPHOPBHVSA-N 0 3 401.938 4.431 20 0 HIADHN CC(C)[C@H](CNC(=O)c1c(F)cccc1Br)N1CCc2ccccc2C1 ZINC000486754390 901830713 /nfs/dbraw/zinc/83/07/13/901830713.db2.gz ZRLWUZLNBDEFER-IBGZPJMESA-N 0 3 419.338 4.401 20 0 HIADHN Cc1csc(Nc2ccc(C(=O)N(CCN(C)C)Cc3cccc(O)c3)cc2)n1 ZINC000486757504 901834160 /nfs/dbraw/zinc/83/41/60/901834160.db2.gz BXAWBGJNZQKFKU-UHFFFAOYSA-N 0 3 410.543 4.105 20 0 HIADHN C[C@@H](c1ccc(F)c(Cl)c1)N1C[C@H]2CCC[C@@]2(c2nc(-c3cnccn3)no2)C1 ZINC000486832661 901884009 /nfs/dbraw/zinc/88/40/09/901884009.db2.gz NOJSOQPAXFOLQS-QDUSTFBWSA-N 0 3 413.884 4.434 20 0 HIADHN CC[C@H]1CCCCN1C(=O)[C@@H](C)N1C[C@H]2CCC[C@@]2(c2nc(-c3ccccc3)no2)C1 ZINC000486851676 901898226 /nfs/dbraw/zinc/89/82/26/901898226.db2.gz BDVZVZLGAHEUJD-MASGSYHESA-N 0 3 422.573 4.270 20 0 HIADHN Cc1nc2sc(-c3ccccc3)cc2c(NC[C@@H](C(C)C)N2CCN(C)CC2)n1 ZINC000486863138 901908611 /nfs/dbraw/zinc/90/86/11/901908611.db2.gz IBPHWWWQLOPJFF-FQEVSTJZSA-N 0 3 409.603 4.351 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)Nc3cc(C(C)(C)C)nn3-c3cccc(Cl)c3)[C@@H]2C1 ZINC000486895654 901939072 /nfs/dbraw/zinc/93/90/72/901939072.db2.gz OLNBKMLNXWEUOT-MAUKXSAKSA-N 0 3 415.969 4.381 20 0 HIADHN C[C@H]1CN([C@@H](CNCc2scnc2C2CC2)c2c(F)cccc2Cl)CCO1 ZINC000486925310 901967376 /nfs/dbraw/zinc/96/73/76/901967376.db2.gz FDPGRWKBIPSQNO-GUYCJALGSA-N 0 3 409.958 4.365 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)Nc2nnc(/C=C\c3ccco3)s2)CN1Cc1ccccc1 ZINC000486942135 901979567 /nfs/dbraw/zinc/97/95/67/901979567.db2.gz LGTKWQHPPCLYHY-WKPOEDDGSA-N 0 3 409.515 4.086 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)Nc1ccc(C(=O)C2CCC2)cc1 ZINC000487021301 902019980 /nfs/dbraw/zinc/01/99/80/902019980.db2.gz SAXMPRKHVKOSTL-UHFFFAOYSA-N 0 3 401.576 4.153 20 0 HIADHN O=C(Nc1c(F)cc(F)cc1Br)N1CCN(C2CCCCC2)CC1 ZINC000487238180 902109573 /nfs/dbraw/zinc/10/95/73/902109573.db2.gz ZYJULGCVEUTUMP-UHFFFAOYSA-N 0 3 402.283 4.210 20 0 HIADHN CC[C@H](C)c1nc([C@H](C)NC(=O)NC[C@@H](c2cccc(Cl)c2)N2CCCC2)n[nH]1 ZINC000487349019 902156668 /nfs/dbraw/zinc/15/66/68/902156668.db2.gz AEQJFXNCIPEGNO-MPGHIAIKSA-N 0 3 418.973 4.169 20 0 HIADHN CCCN(CC(=O)Nc1cc(C)ccc1-c1n[nH]c(C)n1)[C@@H]1CCc2ccccc2C1 ZINC000487377316 902169113 /nfs/dbraw/zinc/16/91/13/902169113.db2.gz IMXDDJNJYVBEIH-OAQYLSRUSA-N 0 3 417.557 4.297 20 0 HIADHN CCN(Cc1nc(-c2ccc(F)c(F)c2)no1)CC1CCN(c2ccccn2)CC1 ZINC000487398096 902181144 /nfs/dbraw/zinc/18/11/44/902181144.db2.gz PHCNKADMARXWDF-UHFFFAOYSA-N 0 3 413.472 4.148 20 0 HIADHN CCCN(CC(=O)Nc1cc(C)ccc1-c1n[nH]c(C)n1)[C@@H]1CCc2ccccc21 ZINC000487408158 902189901 /nfs/dbraw/zinc/18/99/01/902189901.db2.gz JABGLYIZENIYPE-JOCHJYFZSA-N 0 3 403.530 4.427 20 0 HIADHN CN(CCN1CCCC1)C(=O)[C@H](Oc1ccccc1Br)c1ccccc1 ZINC000487533784 902238351 /nfs/dbraw/zinc/23/83/51/902238351.db2.gz HYGHOSSWQMDGEZ-HXUWFJFHSA-N 0 3 417.347 4.123 20 0 HIADHN CCCc1ccc([C@H](NC(=O)N2CC[C@H](N3CCN(C)CC3)[C@H](C)C2)C(C)C)cc1 ZINC000487869037 902414548 /nfs/dbraw/zinc/41/45/48/902414548.db2.gz FIOPNRBZJCTNSU-FGCOXFRFSA-N 0 3 414.638 4.004 20 0 HIADHN COc1cccc(CNC(=O)[C@@H](C)N[C@@H](C)c2ccc(Oc3cccnc3)cc2)c1 ZINC000487890551 902432900 /nfs/dbraw/zinc/43/29/00/902432900.db2.gz BMSWWGXOFCPGCD-ZWKOTPCHSA-N 0 3 405.498 4.238 20 0 HIADHN CC(=O)N(c1nc(CN2CCN(C)[C@@H](C(C)C)C2)cs1)c1ccc(Cl)cc1 ZINC000487973966 902498664 /nfs/dbraw/zinc/49/86/64/902498664.db2.gz UHFVNWVKPNKVRS-LJQANCHMSA-N 0 3 406.983 4.253 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(Oc2cccnc2)cc1)C(=O)NC(=O)Nc1ccccc1 ZINC000488008239 902528892 /nfs/dbraw/zinc/52/88/92/902528892.db2.gz QYGCRGGLEYYNIE-IRXDYDNUSA-N 0 3 404.470 4.261 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CC(C)(C)[C@@H]1c1cccnc1)c1cccc(OC)c1 ZINC000488146424 902640992 /nfs/dbraw/zinc/64/09/92/902640992.db2.gz VJBXUKSQOHKIMY-YADHBBJMSA-N 0 3 410.562 4.266 20 0 HIADHN C[C@H]1CC[C@H](CN2CCC(c3nc(-c4ccccc4Br)no3)CC2)O1 ZINC000488171827 902661288 /nfs/dbraw/zinc/66/12/88/902661288.db2.gz UHRNZYASFXKSBY-DZGCQCFKSA-N 0 3 406.324 4.246 20 0 HIADHN CN(Cc1cncc(OCc2ccccc2)c1)C1CCN(C(=O)c2ccccc2)CC1 ZINC000488230373 902708587 /nfs/dbraw/zinc/70/85/87/902708587.db2.gz YPMWCBWPLYUNEB-UHFFFAOYSA-N 0 3 415.537 4.397 20 0 HIADHN CC(C)[C@@H]1C[C@H](N[C@@H](CN2CCCC2=O)c2cccc(C(F)(F)F)c2)CS1 ZINC000488426114 902821475 /nfs/dbraw/zinc/82/14/75/902821475.db2.gz VKHNMPBZQHOLHI-BZSNNMDCSA-N 0 3 400.510 4.489 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)NC12CCC(C(F)(F)F)(CC1)CC2 ZINC000488438654 902826486 /nfs/dbraw/zinc/82/64/86/902826486.db2.gz MJZHGFZEDQXBAD-UHFFFAOYSA-N 0 3 423.523 4.360 20 0 HIADHN CC(=O)c1cccc(OCCCC(=O)N(Cc2ccccc2)C2CCN(C)CC2)c1 ZINC000488662031 902926829 /nfs/dbraw/zinc/92/68/29/902926829.db2.gz UFYBRJQQOMBYQA-UHFFFAOYSA-N 0 3 408.542 4.171 20 0 HIADHN C[C@@H](Sc1ccccc1Cl)C(=O)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000488665606 902929009 /nfs/dbraw/zinc/92/90/09/902929009.db2.gz MXVSHRKWKXMQKI-OAHLLOKOSA-N 0 3 404.963 4.416 20 0 HIADHN C[C@@H]1CN(C2CCOCC2)CCN1Cc1coc(-c2ccc(C(F)(F)F)cc2)n1 ZINC000488694487 902948398 /nfs/dbraw/zinc/94/83/98/902948398.db2.gz GHVLAEKWNQFMEM-OAHLLOKOSA-N 0 3 409.452 4.046 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cscc1Br)c1cccc(OC)c1 ZINC000506000034 914672734 /nfs/dbraw/zinc/67/27/34/914672734.db2.gz SXVBSIGDSMWDNH-QGZVFWFLSA-N 0 3 411.365 4.332 20 0 HIADHN COc1ccc([C@@H](C)NC(=O)[C@H]2CN(Cc3ccccc3)CCC2(F)F)cc1F ZINC000506011091 914683927 /nfs/dbraw/zinc/68/39/27/914683927.db2.gz XHVRCOPAAWMNST-CRAIPNDOSA-N 0 3 406.448 4.169 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)Nc1ccccc1OC1CCCC1 ZINC000489007057 903116654 /nfs/dbraw/zinc/11/66/54/903116654.db2.gz FYNMGCJUGNHXAU-UHFFFAOYSA-N 0 3 423.557 4.286 20 0 HIADHN COCCCOc1ccccc1NC(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000489025697 903130815 /nfs/dbraw/zinc/13/08/15/903130815.db2.gz INMMDMSIIDIUKK-UHFFFAOYSA-N 0 3 411.546 4.230 20 0 HIADHN Cc1ccc(NC(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)cc1C(=O)N(C)C(C)C ZINC000489124838 903215350 /nfs/dbraw/zinc/21/53/50/903215350.db2.gz QHZOCTDACRAZQR-XXBNENTESA-N 0 3 422.573 4.117 20 0 HIADHN CCCOc1c(Br)cc(Br)cc1CNC[C@@H](O)CCC ZINC000489132373 903223065 /nfs/dbraw/zinc/22/30/65/903223065.db2.gz XOADIQTYEADHLF-ZDUSSCGKSA-N 0 3 409.162 4.251 20 0 HIADHN COc1ccc(OC)c(NC(=O)[C@H](C)N[C@@H](COc2ccccc2F)C(C)(C)C)c1 ZINC000489143257 903228510 /nfs/dbraw/zinc/22/85/10/903228510.db2.gz XYSAJVCRBHFPHD-BTYIYWSLSA-N 0 3 418.509 4.253 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)N[C@H](c2ccccc2)[C@H]2CCCO2)CC1 ZINC000489147112 903232603 /nfs/dbraw/zinc/23/26/03/903232603.db2.gz DGJTUPVNTYQRHI-DNQXCXABSA-N 0 3 407.558 4.213 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)N[C@H](c2ccccc2)[C@@H]2CCCO2)CC1 ZINC000489147111 903232927 /nfs/dbraw/zinc/23/29/27/903232927.db2.gz DGJTUPVNTYQRHI-BJKOFHAPSA-N 0 3 407.558 4.213 20 0 HIADHN Cc1csc(CCCCNC(=O)N(Cc2ccccc2)C2CCN(C)CC2)n1 ZINC000489191729 903250781 /nfs/dbraw/zinc/25/07/81/903250781.db2.gz ZJSDRMWPMPPNAE-UHFFFAOYSA-N 0 3 400.592 4.080 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)NCc2ccc(Br)cc2)CC1 ZINC000489192368 903253136 /nfs/dbraw/zinc/25/31/36/903253136.db2.gz CUTQOANPJMYUMS-UHFFFAOYSA-N 0 3 416.363 4.255 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)N[C@@H](c1ccccc1)C1CCCC1 ZINC000489270612 903298675 /nfs/dbraw/zinc/29/86/75/903298675.db2.gz OCBMCXCYIURZCV-VWLOTQADSA-N 0 3 421.585 4.374 20 0 HIADHN C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000489401842 903369520 /nfs/dbraw/zinc/36/95/20/903369520.db2.gz YLTRNNWDHBMYMI-LJQANCHMSA-N 0 3 423.557 4.042 20 0 HIADHN CC(C)c1ccc2c(c1)[C@H](NCCOc1ccc(S(C)(=O)=O)cc1)CCCO2 ZINC000489467412 903400734 /nfs/dbraw/zinc/40/07/34/903400734.db2.gz UGQBOLGBMNGSKC-OAQYLSRUSA-N 0 3 403.544 4.096 20 0 HIADHN CCO[C@H](CCNC(=O)N(Cc1ccccc1)C1CCN(C)CC1)C1CCCC1 ZINC000489474749 903405571 /nfs/dbraw/zinc/40/55/71/903405571.db2.gz LAMPEPVLVWBCNT-HSZRJFAPSA-N 0 3 401.595 4.278 20 0 HIADHN CO[C@H](CNC(=O)N(Cc1ccccc1)C1CCN(C)CC1)c1ccc(Cl)cc1 ZINC000489507709 903430211 /nfs/dbraw/zinc/43/02/11/903430211.db2.gz JDBQOQCXTORLKW-JOCHJYFZSA-N 0 3 415.965 4.334 20 0 HIADHN C[C@@H](N[C@H]1CCN(C(=O)CCc2ccccc2)C1)c1ccc(Br)c(F)c1 ZINC000489552940 903460589 /nfs/dbraw/zinc/46/05/89/903460589.db2.gz NQXPLUQKHDCSJE-QAPCUYQASA-N 0 3 419.338 4.473 20 0 HIADHN C[C@H](NCc1cccc(CN2CCOCC2)c1)c1ccc(Br)c(F)c1 ZINC000489565769 903468182 /nfs/dbraw/zinc/46/81/82/903468182.db2.gz GDFOYAXMUZFRDL-HNNXBMFYSA-N 0 3 407.327 4.271 20 0 HIADHN C[C@@H](c1ccc(S(N)(=O)=O)cc1)N(C)Cc1ccc(-c2ccccc2F)s1 ZINC000506035773 914721073 /nfs/dbraw/zinc/72/10/73/914721073.db2.gz SPTWRRQHHUTBGC-AWEZNQCLSA-N 0 3 404.532 4.395 20 0 HIADHN CC[C@H](NC(=O)NCc1ccccc1CN1CCC(O)CC1)C(C)(C)c1ccccc1 ZINC000489587328 903480205 /nfs/dbraw/zinc/48/02/05/903480205.db2.gz QMPXJVAHMZJNQB-DEOSSOPVSA-N 0 3 423.601 4.199 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)[C@@H]3CCCC(F)(F)C3)c(OCC)c2)CC1 ZINC000506038614 914726201 /nfs/dbraw/zinc/72/62/01/914726201.db2.gz OFDWUILRNRLVQC-QGZVFWFLSA-N 0 3 409.521 4.381 20 0 HIADHN Cc1c(C(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)nnn1-c1cccc(Cl)c1 ZINC000489619138 903500460 /nfs/dbraw/zinc/50/04/60/903500460.db2.gz GTMXSEQCULIBII-OAQYLSRUSA-N 0 3 423.948 4.104 20 0 HIADHN CC[C@@H](C)Oc1ccc(NC(=O)NCc2ccccc2CN2CCC(O)CC2)cc1 ZINC000489789261 903600219 /nfs/dbraw/zinc/60/02/19/903600219.db2.gz JITVTUYZMWQMBA-GOSISDBHSA-N 0 3 411.546 4.142 20 0 HIADHN CC(C)CCN(CCC(C)C)C(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000489809238 903607337 /nfs/dbraw/zinc/60/73/37/903607337.db2.gz VERSPTNFQOUNON-UHFFFAOYSA-N 0 3 403.611 4.247 20 0 HIADHN C[C@H](OCCCNC(=O)N(Cc1ccccc1)C1CCN(C)CC1)c1ccccc1 ZINC000489881292 903649913 /nfs/dbraw/zinc/64/99/13/903649913.db2.gz HHPNMMJMINSFFS-NRFANRHFSA-N 0 3 409.574 4.460 20 0 HIADHN CC(C)n1ncc(C(=O)Nc2cccc(CN3CCC(O)CC3)c2)c1-c1ccccc1 ZINC000490012698 903723292 /nfs/dbraw/zinc/72/32/92/903723292.db2.gz ZCGDHPKUCQICKM-UHFFFAOYSA-N 0 3 418.541 4.340 20 0 HIADHN CC(C)C[C@@H](CN[C@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1)N(C)C ZINC000490135135 903783586 /nfs/dbraw/zinc/78/35/86/903783586.db2.gz FGSDKCOWMWQGBV-RBBKRZOGSA-N 0 3 423.022 4.399 20 0 HIADHN CC(C)C[C@@H](CN[C@@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1)N(C)C ZINC000490135136 903783944 /nfs/dbraw/zinc/78/39/44/903783944.db2.gz FGSDKCOWMWQGBV-UNMCSNQZSA-N 0 3 423.022 4.399 20 0 HIADHN COc1cccc(Oc2ccc(CN[C@@H]3CCN(C(C)=O)Cc4ccccc43)cn2)c1 ZINC000490143707 903789436 /nfs/dbraw/zinc/78/94/36/903789436.db2.gz NCCVPEFTTKTTAB-XMMPIXPASA-N 0 3 417.509 4.466 20 0 HIADHN CCN1CCN([C@H](C)CN[C@@H](c2ccccc2Cl)c2cc(F)ccc2F)CC1 ZINC000490168445 903806745 /nfs/dbraw/zinc/80/67/45/903806745.db2.gz VRIPSZYJSKZSFJ-ZHRRBRCNSA-N 0 3 407.936 4.323 20 0 HIADHN Cc1ccc([C@H](NCCc2nccs2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000490171707 903809181 /nfs/dbraw/zinc/80/91/81/903809181.db2.gz HJGUKJNVGVFBKE-OAQYLSRUSA-N 0 3 400.569 4.085 20 0 HIADHN CC(C)[C@@H](CN[C@H](c1ccc(F)cc1)c1cccc(S(C)(=O)=O)c1)N1CCCC1 ZINC000490173557 903810325 /nfs/dbraw/zinc/81/03/25/903810325.db2.gz WIGGNQZDVAYOTP-DHIUTWEWSA-N 0 3 418.578 4.029 20 0 HIADHN CC(C)[C@H](CN[C@@H](c1ccc(F)cc1)c1cccc(S(C)(=O)=O)c1)N1CCCC1 ZINC000490173558 903810499 /nfs/dbraw/zinc/81/04/99/903810499.db2.gz WIGGNQZDVAYOTP-GOTSBHOMSA-N 0 3 418.578 4.029 20 0 HIADHN C[C@@H](CN[C@@H](c1ccc(F)cc1)c1cccc(S(C)(=O)=O)c1)N1CCC[C@@H](C)C1 ZINC000490184769 903814815 /nfs/dbraw/zinc/81/48/15/903814815.db2.gz OEUPEBUKSFPWJR-STSQHVNTSA-N 0 3 418.578 4.029 20 0 HIADHN C[C@@H](c1nnc(-c2cccc(Cl)c2)o1)N1CCC(CCCN2CCOCC2)CC1 ZINC000506052872 914751914 /nfs/dbraw/zinc/75/19/14/914751914.db2.gz ZYTXMEAMXWPOGD-KRWDZBQOSA-N 0 3 418.969 4.275 20 0 HIADHN CCC(CC)[C@@H](CN[C@@H](c1ccc(F)cc1)c1cccc(S(C)(=O)=O)c1)N(C)C ZINC000490190401 903817337 /nfs/dbraw/zinc/81/73/37/903817337.db2.gz IRMBOYMQQYXZLH-PKTZIBPZSA-N 0 3 420.594 4.275 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)NCc1ccc(Oc2ccccc2)nc1)c1ccco1 ZINC000490218449 903833645 /nfs/dbraw/zinc/83/36/45/903833645.db2.gz SZYOCEOWZVBYGF-YLJYHZDGSA-N 0 3 408.502 4.396 20 0 HIADHN C[C@@H](c1ccc(S(N)(=O)=O)cc1)N(C)Cc1ccc(-c2cccc(F)c2)s1 ZINC000506054972 914755114 /nfs/dbraw/zinc/75/51/14/914755114.db2.gz GEXQYVMSOIZCJH-AWEZNQCLSA-N 0 3 404.532 4.395 20 0 HIADHN Cc1ccc(-c2cc(C(=O)Nc3cccc([C@@H](C)N4CCOCC4)c3)[nH]n2)c(C)c1 ZINC000490294441 903882939 /nfs/dbraw/zinc/88/29/39/903882939.db2.gz RTOBOULWWYDGEP-GOSISDBHSA-N 0 3 404.514 4.339 20 0 HIADHN COc1ccc(NC(=O)NC[C@H](c2ccccc2)N2CCCC2)cc1Br ZINC000490302798 903891449 /nfs/dbraw/zinc/89/14/49/903891449.db2.gz YOPUZZIKMRTRFM-GOSISDBHSA-N 0 3 418.335 4.416 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2ccc(C(=O)NC(C)C)cc2C)N2CCCC2)cc1 ZINC000490311708 903893423 /nfs/dbraw/zinc/89/34/23/903893423.db2.gz AGURMKYKNMNWOZ-HSZRJFAPSA-N 0 3 422.573 4.400 20 0 HIADHN O=C1C[C@H]([C@@H]2CCCCN2Cc2nc3cc(Cl)ccc3n2Cc2ccccc2)CN1 ZINC000490674249 904168071 /nfs/dbraw/zinc/16/80/71/904168071.db2.gz OLDZZZDXYCYEIB-RXVVDRJESA-N 0 3 422.960 4.229 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2ccc(CC(=O)NC(C)C)cc2)N2CCCC2)cc1 ZINC000490684973 904172957 /nfs/dbraw/zinc/17/29/57/904172957.db2.gz ROUOJZJLJNNECK-HSZRJFAPSA-N 0 3 422.573 4.021 20 0 HIADHN Cc1ccc(-c2nc(CCNC(=O)N[C@H]3CCN(Cc4ccccc4)[C@@H]3C)co2)cc1 ZINC000490715969 904189121 /nfs/dbraw/zinc/18/91/21/904189121.db2.gz FWYUDSXHZJCPFE-XXBNENTESA-N 0 3 418.541 4.155 20 0 HIADHN Cc1[nH]nc2ncc(CN(C[C@H](O)COc3cccc4ccccc43)C(C)C)cc12 ZINC000506086670 914793358 /nfs/dbraw/zinc/79/33/58/914793358.db2.gz QNQCMDPUJQJMHG-FQEVSTJZSA-N 0 3 404.514 4.070 20 0 HIADHN Cc1ccc(NC(=O)Nc2ccccc2)cc1NC(=O)N1CC[C@@H]2CCN(C)C[C@@H]21 ZINC000490805607 904253915 /nfs/dbraw/zinc/25/39/15/904253915.db2.gz LYMCGFCPQQUAMV-UWJYYQICSA-N 0 3 407.518 4.197 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)N[C@H](c1c[nH]c2ccccc21)C(F)(F)F ZINC000490846999 904283768 /nfs/dbraw/zinc/28/37/68/904283768.db2.gz BFHHNUFQTSFITN-GOSISDBHSA-N 0 3 408.424 4.138 20 0 HIADHN CCC(C)(C)OCc1cccc(NC(=O)C(=O)NC[C@@H](C)N2CCCC[C@H]2C)c1C ZINC000490854521 904288100 /nfs/dbraw/zinc/28/81/00/904288100.db2.gz VENBUXQXSOLNJO-QZTJIDSGSA-N 0 3 417.594 4.018 20 0 HIADHN O=C(NCc1nccc2ccccc21)Nc1ccc(CCN2CCSCC2)cc1 ZINC000490942870 904328218 /nfs/dbraw/zinc/32/82/18/904328218.db2.gz YCBZFIXYBXKRNI-UHFFFAOYSA-N 0 3 406.555 4.148 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2CN2CCC(C(=O)N(C)C)CC2)c(C)c1 ZINC000506101739 914803869 /nfs/dbraw/zinc/80/38/69/914803869.db2.gz TUQBXJFCPCIHRD-UHFFFAOYSA-N 0 3 416.569 4.456 20 0 HIADHN C[C@H](C[C@@H]1CCCO1)N[C@@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000491024594 904375679 /nfs/dbraw/zinc/37/56/79/904375679.db2.gz ULTARPVNEHBNTC-JJXUHFIVSA-N 0 3 407.963 4.380 20 0 HIADHN C[C@H](C[C@H]1CCCO1)N[C@@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000491024597 904375970 /nfs/dbraw/zinc/37/59/70/904375970.db2.gz ULTARPVNEHBNTC-VMRPVKRXSA-N 0 3 407.963 4.380 20 0 HIADHN CC[C@@H](C)C(=O)Nc1cccc(CNC(=O)NC[C@@H](c2ccccc2)N2CCCC2)c1 ZINC000506120022 914811084 /nfs/dbraw/zinc/81/10/84/914811084.db2.gz PUKMJSDOBJXPCI-XXBNENTESA-N 0 3 422.573 4.308 20 0 HIADHN CC[C@@H](C)C(=O)Nc1cccc(CNC(=O)NC[C@H](c2ccccc2)N2CCCC2)c1 ZINC000506120012 914811193 /nfs/dbraw/zinc/81/11/93/914811193.db2.gz PUKMJSDOBJXPCI-AUSIDOKSSA-N 0 3 422.573 4.308 20 0 HIADHN CN1CC[C@H](NC(=O)C2(Cc3ccccc3Br)CC2)[C@H]1c1ccccc1 ZINC000491135526 904447869 /nfs/dbraw/zinc/44/78/69/904447869.db2.gz YBBKRDSRHCOHBV-VQTJNVASSA-N 0 3 413.359 4.333 20 0 HIADHN Cc1ccccc1[C@H](NC(=O)N(C)C1CCN(CCc2ccccn2)CC1)C1CC1 ZINC000491146930 904456699 /nfs/dbraw/zinc/45/66/99/904456699.db2.gz PITAQBWTDRIMQD-XMMPIXPASA-N 0 3 406.574 4.190 20 0 HIADHN CCN1CC[C@H](NCc2cnnn2Cc2ccccc2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000491271195 904513204 /nfs/dbraw/zinc/51/32/04/904513204.db2.gz LZEZVMGITMMQLQ-FCHUYYIVSA-N 0 3 413.928 4.044 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)Nc1cc(F)c(OC(F)F)cc1F ZINC000491281211 904517243 /nfs/dbraw/zinc/51/72/43/904517243.db2.gz DMJXUPGLKRZCAK-AWEZNQCLSA-N 0 3 411.399 4.352 20 0 HIADHN CC(C)(C)c1n[nH]cc1CN1CCC[C@@H](c2nnc3ccc(C(F)(F)F)cn32)C1 ZINC000506136540 914818464 /nfs/dbraw/zinc/81/84/64/914818464.db2.gz KZERCJUHYZWOCT-CYBMUJFWSA-N 0 3 406.456 4.148 20 0 HIADHN COc1ccc(OC)c(CN2CCC[C@@H](c3nnc4ccc(C(F)(F)F)cn43)C2)c1 ZINC000506136990 914819247 /nfs/dbraw/zinc/81/92/47/914819247.db2.gz NDAQJIXAPNHGJF-CQSZACIVSA-N 0 3 420.435 4.145 20 0 HIADHN Cc1ccc(NC(=O)C2(CN(C)C)CCCCC2)cc1S(=O)(=O)C1CCCC1 ZINC000491357112 904555312 /nfs/dbraw/zinc/55/53/12/904555312.db2.gz VWCZSQNQCOSNCB-UHFFFAOYSA-N 0 3 406.592 4.162 20 0 HIADHN CC(C)COCCCN[C@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000491368135 904562381 /nfs/dbraw/zinc/56/23/81/904562381.db2.gz PATYVLOXXNTBLM-OAQYLSRUSA-N 0 3 409.979 4.485 20 0 HIADHN CCc1ccc([C@H](NCCc2csc(C)n2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000491367489 904562428 /nfs/dbraw/zinc/56/24/28/904562428.db2.gz MNLGRJBKTZGASS-QFIPXVFZSA-N 0 3 414.596 4.339 20 0 HIADHN COC(=O)c1ccc(NC(=O)N(CCN(C)C)Cc2cccc(Cl)c2)cc1C ZINC000491419827 904586533 /nfs/dbraw/zinc/58/65/33/904586533.db2.gz BZAPQJSUAOGIRW-UHFFFAOYSA-N 0 3 403.910 4.031 20 0 HIADHN CN(C(=O)Nc1cc(F)c(OC(F)F)cc1F)[C@H]1CCN(Cc2ccccc2)C1 ZINC000491444879 904599991 /nfs/dbraw/zinc/59/99/91/904599991.db2.gz HMJMQHJWZGZBOJ-AWEZNQCLSA-N 0 3 411.399 4.304 20 0 HIADHN Cn1c2ccccc2cc(CNCc2ccc(Br)c3cccnc23)c1=O ZINC000491446922 904602449 /nfs/dbraw/zinc/60/24/49/904602449.db2.gz NMGVEUHMMJTWGD-UHFFFAOYSA-N 0 3 408.299 4.139 20 0 HIADHN CC(=O)Nc1cc(NC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)ccc1F ZINC000491520624 904634098 /nfs/dbraw/zinc/63/40/98/904634098.db2.gz GUVCTMAJHCYVHS-HXUWFJFHSA-N 0 3 423.410 4.177 20 0 HIADHN O=C(NCC1(c2ccccc2)CC1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000491533410 904640701 /nfs/dbraw/zinc/64/07/01/904640701.db2.gz ZEOHTBBGELVQEG-QFIPXVFZSA-N 0 3 402.460 4.289 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)Nc2cccc(C(=O)N3CCCCC3)c2)c1 ZINC000491538848 904641643 /nfs/dbraw/zinc/64/16/43/904641643.db2.gz SHMRSMMMGFARDI-UHFFFAOYSA-N 0 3 422.573 4.217 20 0 HIADHN COc1ccc(NC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)cc1OC ZINC000491551770 904645474 /nfs/dbraw/zinc/64/54/74/904645474.db2.gz AVZOJDGKVXDVRY-HXUWFJFHSA-N 0 3 408.420 4.097 20 0 HIADHN CN(Cc1c[nH]nc1-c1ccc2c(c1)OCCO2)Cc1cccc(Br)c1 ZINC000506178306 914835040 /nfs/dbraw/zinc/83/50/40/914835040.db2.gz JMABLHRIBXRMQC-UHFFFAOYSA-N 0 3 414.303 4.242 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)Nc2cc3c(cc2Cl)OCCCO3)c1 ZINC000491920170 904731469 /nfs/dbraw/zinc/73/14/69/904731469.db2.gz GNWYUEFWZSBAHP-UHFFFAOYSA-N 0 3 417.937 4.405 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)Nc3ccc(Cl)c(C(=O)Nc4ccccc4)c3)[C@@H]2C1 ZINC000492049098 904773705 /nfs/dbraw/zinc/77/37/05/904773705.db2.gz WXURZBOQCJGUSI-MGPUTAFESA-N 0 3 412.921 4.150 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)Nc3ccc(Cl)c(C(=O)Nc4ccccc4)c3)[C@H]2C1 ZINC000492049100 904774551 /nfs/dbraw/zinc/77/45/51/904774551.db2.gz WXURZBOQCJGUSI-QRWLVFNGSA-N 0 3 412.921 4.150 20 0 HIADHN O=C(Nc1nc2c(s1)CCCCCC2)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000492075097 904787537 /nfs/dbraw/zinc/78/75/37/904787537.db2.gz ANHJRZOWUXGRQU-UHFFFAOYSA-N 0 3 413.587 4.259 20 0 HIADHN CCCCN(C)CCN[C@H](c1cccc(S(C)(=O)=O)c1)c1ccc(C)cc1C ZINC000492119964 904801575 /nfs/dbraw/zinc/80/15/75/904801575.db2.gz AGKXDRGNBUZGJG-HSZRJFAPSA-N 0 3 402.604 4.118 20 0 HIADHN CCCCN(C)CCN[C@@H](c1cccc(S(C)(=O)=O)c1)c1ccc(C)cc1C ZINC000492119965 904801979 /nfs/dbraw/zinc/80/19/79/904801979.db2.gz AGKXDRGNBUZGJG-QHCPKHFHSA-N 0 3 402.604 4.118 20 0 HIADHN CN(C)C(=O)c1ccc(CNC[C@H](OCc2ccccc2)c2ccc(Cl)cc2)[nH]1 ZINC000492175930 904809634 /nfs/dbraw/zinc/80/96/34/904809634.db2.gz OFNVEMSBELXZAN-QFIPXVFZSA-N 0 3 411.933 4.418 20 0 HIADHN CCc1ccc([C@H](NC[C@@H]2CCCCN2CC)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000492194458 904812835 /nfs/dbraw/zinc/81/28/35/904812835.db2.gz FTCNUHWGASFBSJ-UPVQGACJSA-N 0 3 414.615 4.206 20 0 HIADHN Cc1nc(C)c(CCN[C@H](c2ccc(F)cc2)c2cccc(S(C)(=O)=O)c2)s1 ZINC000492195716 904813091 /nfs/dbraw/zinc/81/30/91/904813091.db2.gz KWIIJBCGYHQLMF-OAQYLSRUSA-N 0 3 418.559 4.224 20 0 HIADHN C[C@H](NCc1cc(Br)c2c(c1)OCCO2)[C@@H]1OCCc2sccc21 ZINC000492194051 904813300 /nfs/dbraw/zinc/81/33/00/904813300.db2.gz QCJLPHKPIWPKNV-GTNSWQLSSA-N 0 3 410.333 4.074 20 0 HIADHN CCSc1cccc(CNCc2ccc(OCCN3CCOCC3)c(Cl)c2)c1 ZINC000492207463 904815046 /nfs/dbraw/zinc/81/50/46/904815046.db2.gz FXEPPQCIRFQTFJ-UHFFFAOYSA-N 0 3 421.006 4.453 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)Nc3ccc(OCc4cccc(F)c4)c(F)c3)[C@H]2C1 ZINC000492236283 904820655 /nfs/dbraw/zinc/82/06/55/904820655.db2.gz DWVCVRPTZQDQDT-JXFKEZNVSA-N 0 3 401.457 4.102 20 0 HIADHN COCCc1ccc(Oc2ccc(NC(=O)N3CC[C@H]4CCN(C)C[C@@H]43)cc2)cc1 ZINC000492236726 904821621 /nfs/dbraw/zinc/82/16/21/904821621.db2.gz KTKBFHMGUMLLEZ-XXBNENTESA-N 0 3 409.530 4.226 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(CNCCc3nnc(C(C)C)s3)c2)cc1 ZINC000492359298 904838779 /nfs/dbraw/zinc/83/87/79/904838779.db2.gz WMRISWNEANGGES-UHFFFAOYSA-N 0 3 410.543 4.255 20 0 HIADHN O[C@H](CO[C@@H]1CCCc2ccccc21)CN1CCC2(CC1)OCCc1ccsc12 ZINC000492379660 904842179 /nfs/dbraw/zinc/84/21/79/904842179.db2.gz YLZUFRWFZDKUOB-RBBKRZOGSA-N 0 3 413.583 4.067 20 0 HIADHN CCCc1nc(C)c(CNC2CCN(Cc3ccccc3Br)CC2)o1 ZINC000492397697 904842904 /nfs/dbraw/zinc/84/29/04/904842904.db2.gz KUIMSZUJWSUHMK-UHFFFAOYSA-N 0 3 406.368 4.452 20 0 HIADHN CCCN(C)[C@H](CNC(=O)C(=O)Nc1ncc(C(C)C)s1)c1ccc(Cl)cc1 ZINC000506234345 914856924 /nfs/dbraw/zinc/85/69/24/914856924.db2.gz QIKDGEZUJJRGGR-MRXNPFEDSA-N 0 3 422.982 4.058 20 0 HIADHN CO[C@@H]1C[C@@H](N[C@H](c2cccc(S(C)(=O)=O)c2)c2ccc(C)cc2C)C1(C)C ZINC000493009056 904984893 /nfs/dbraw/zinc/98/48/93/904984893.db2.gz MBKJKAAOQUXQIZ-YPAWHYETSA-N 0 3 401.572 4.199 20 0 HIADHN CCc1ccc([C@H](N[C@H]2C[C@H](OC)C2(C)C)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000493011008 904987636 /nfs/dbraw/zinc/98/76/36/904987636.db2.gz SEQRPGCNPZFLSR-FKBYEOEOSA-N 0 3 401.572 4.145 20 0 HIADHN Cc1ccc([C@@H](NC[C@@](C)(O)CCC(C)C)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000493037844 905000906 /nfs/dbraw/zinc/00/09/06/905000906.db2.gz RZGTVDKGUGLSLC-PKTZIBPZSA-N 0 3 403.588 4.265 20 0 HIADHN CCCN(CC)CCN[C@@H](c1cccc(S(C)(=O)=O)c1)c1ccc(C)cc1C ZINC000493207082 905050235 /nfs/dbraw/zinc/05/02/35/905050235.db2.gz RVPFLTXCUWMZLB-QHCPKHFHSA-N 0 3 402.604 4.118 20 0 HIADHN Cc1ccc([C@H](NC[C@@H](CCO)c2ccccc2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000493275957 905073611 /nfs/dbraw/zinc/07/36/11/905073611.db2.gz DPENNUSBMUFQHE-NOZRDPDXSA-N 0 3 423.578 4.244 20 0 HIADHN CCOc1cc(CN(C)[C@H](C)c2ccc(F)cc2)ccc1O[C@@H](C)C(=O)N(C)C ZINC000506259352 914869089 /nfs/dbraw/zinc/86/90/89/914869089.db2.gz OJCDRQGTQWGDQZ-SJORKVTESA-N 0 3 402.510 4.273 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)CCc3c4cc(F)ccc4[nH]c3-c3ccccc3)[C@@H]2C1 ZINC000493462436 905125931 /nfs/dbraw/zinc/12/59/31/905125931.db2.gz JFILEJBZTRKXGB-UZUQRXQVSA-N 0 3 405.517 4.459 20 0 HIADHN COc1cc(-c2nnc(CN[C@H]3CCC[C@H]3CCC(C)C)o2)cc(OC)c1OC ZINC000493604268 905173107 /nfs/dbraw/zinc/17/31/07/905173107.db2.gz LCLUBAIFSLWBAB-RDJZCZTQSA-N 0 3 403.523 4.457 20 0 HIADHN COc1ccc([C@H](CNC(=O)c2c[nH]cc2-c2ccccc2F)N2CCCC2)cc1 ZINC000493634270 905178011 /nfs/dbraw/zinc/17/80/11/905178011.db2.gz JBEXLZJYBDWGDC-QHCPKHFHSA-N 0 3 407.489 4.396 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)NCc2nc(C(C)(C)C)cs2)N(C)C)cc1 ZINC000493864645 905235194 /nfs/dbraw/zinc/23/51/94/905235194.db2.gz PCECWIMINPAEOD-GOSISDBHSA-N 0 3 418.607 4.330 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](N[C@H]2CCc3ccccc3OC2)c2ccccc2)c1 ZINC000493892639 905249968 /nfs/dbraw/zinc/24/99/68/905249968.db2.gz XUWIGRSQHZMFSS-URXFXBBRSA-N 0 3 407.535 4.163 20 0 HIADHN Cc1cc(Br)cc2c1[C@H](NCc1cccc(CS(C)(=O)=O)c1)CC2 ZINC000493895592 905252530 /nfs/dbraw/zinc/25/25/30/905252530.db2.gz YMMAWKHVHYYPHI-GOSISDBHSA-N 0 3 408.361 4.079 20 0 HIADHN C[C@@H]1[C@H](NC(=O)c2ccc(-c3noc(C(F)F)n3)cc2)CCN1Cc1ccccc1 ZINC000494007170 905348618 /nfs/dbraw/zinc/34/86/18/905348618.db2.gz OSZPKBULPWFYAS-RDTXWAMCSA-N 0 3 412.440 4.067 20 0 HIADHN C[C@H]1[C@@H](NC(=O)C2(c3ccccc3Cl)CCOCC2)CCN1Cc1ccccc1 ZINC000494017677 905354986 /nfs/dbraw/zinc/35/49/86/905354986.db2.gz NNLFHDGWBQNMHO-AVRDEDQJSA-N 0 3 412.961 4.167 20 0 HIADHN Cn1cc([C@@H](NC[C@@H](CO)Cc2ccc(C(F)(F)F)cc2)c2cccc(F)c2)cn1 ZINC000494037535 905378122 /nfs/dbraw/zinc/37/81/22/905378122.db2.gz HEZKIMSTPNIROS-KKSFZXQISA-N 0 3 421.438 4.108 20 0 HIADHN CC(C)c1ccc([C@@H](NC(=O)N2CCN(C3CCOCC3)C[C@@H]2C)C(C)C)cc1 ZINC000494215733 905547036 /nfs/dbraw/zinc/54/70/36/905547036.db2.gz KCXILBDUSLIGPG-CVDCTZTESA-N 0 3 401.595 4.402 20 0 HIADHN O=C(Nc1cccc(OC2CCCC2)c1)N[C@H]1CCN(Cc2ccccc2)C[C@H]1CO ZINC000494263117 905587130 /nfs/dbraw/zinc/58/71/30/905587130.db2.gz VLYIASMBEQYUTC-RDPSFJRHSA-N 0 3 423.557 4.013 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)c3c[nH]cc3-c3ccccc3F)cc2)CC1 ZINC000494275216 905600028 /nfs/dbraw/zinc/60/00/28/905600028.db2.gz XMBPKJQZIGYBOU-UHFFFAOYSA-N 0 3 406.505 4.211 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1nc(C2CCOCC2)cs1 ZINC000494387557 905684601 /nfs/dbraw/zinc/68/46/01/905684601.db2.gz UQKGXQKRDOJHQN-KRWDZBQOSA-N 0 3 414.575 4.165 20 0 HIADHN COc1cc(CN2CCC[C@@H](CNC(=O)C(C)C)C2)ccc1OCc1ccccc1 ZINC000512449031 921168980 /nfs/dbraw/zinc/16/89/80/921168980.db2.gz ARPKMMFXFJMDGX-QFIPXVFZSA-N 0 3 410.558 4.258 20 0 HIADHN COc1ccccc1[C@@H](NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1)c1ccco1 ZINC000494424463 905713092 /nfs/dbraw/zinc/71/30/92/905713092.db2.gz ITGFCEIHVFFZCC-GBXCKJPGSA-N 0 3 419.525 4.341 20 0 HIADHN COC[C@H](NC(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1)c1ccc(Cl)cc1 ZINC000494426366 905714540 /nfs/dbraw/zinc/71/45/40/905714540.db2.gz AVYVUQADDPFGSR-HBGVWJBISA-N 0 3 401.938 4.162 20 0 HIADHN Cc1nn(Cc2ccc(Cl)cc2)c(C)c1CN1CCC[C@@H](CNC(=O)C(C)C)C1 ZINC000512455196 921173257 /nfs/dbraw/zinc/17/32/57/921173257.db2.gz BGLDWJWUEJTMCU-FQEVSTJZSA-N 0 3 416.997 4.186 20 0 HIADHN COC[C@@H](N[C@@H](C)CC(=O)Nc1cc(OC)ccc1OC)c1ccc(Cl)cc1 ZINC000494480506 905761570 /nfs/dbraw/zinc/76/15/70/905761570.db2.gz ZSWIKPXZNWJPPJ-IFXJQAMLSA-N 0 3 406.910 4.052 20 0 HIADHN COc1ccc(N(CC(C)C)C(=O)c2ccc(CN3CCC(CO)CC3)cc2)cc1 ZINC000494480601 905761645 /nfs/dbraw/zinc/76/16/45/905761645.db2.gz WNDJSFCTPYFJER-UHFFFAOYSA-N 0 3 410.558 4.202 20 0 HIADHN O=C1[C@H](N[C@H]2CCO[C@H]2c2ccc(Cl)c(F)c2)CCCN1c1ccccc1F ZINC000494492201 905777600 /nfs/dbraw/zinc/77/76/00/905777600.db2.gz HFVRCVGYAKRXBY-NSHGMRRFSA-N 0 3 406.860 4.233 20 0 HIADHN CCSc1cc(CNC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)ccn1 ZINC000494500782 905790865 /nfs/dbraw/zinc/79/08/65/905790865.db2.gz AXXZZGVBHRGVMF-HXUWFJFHSA-N 0 3 423.504 4.264 20 0 HIADHN C[C@@H](NCc1ccnc(Oc2ccccc2F)c1)c1ccc(NS(C)(=O)=O)cc1 ZINC000494527341 905812686 /nfs/dbraw/zinc/81/26/86/905812686.db2.gz NDNXSYZUILWXLW-OAHLLOKOSA-N 0 3 415.490 4.235 20 0 HIADHN CCSc1ccc([C@@H](C)NC(=O)N[C@@H](CN(C)C)c2ccc(OC)cc2)cc1 ZINC000494599680 905856090 /nfs/dbraw/zinc/85/60/90/905856090.db2.gz HRORIEYCWXUAIC-IERDGZPVSA-N 0 3 401.576 4.470 20 0 HIADHN Cc1ccc([C@H](NC(=O)CN2CCCCC[C@@H]2C[C@@H](C)O)c2cccs2)cc1 ZINC000512473732 921185509 /nfs/dbraw/zinc/18/55/09/921185509.db2.gz FPPAGAHJPQSFKB-XQFWAAQXSA-N 0 3 400.588 4.278 20 0 HIADHN Cc1cc(NC(=O)Nc2cc(CC(C)C)[nH]n2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000494645057 905879734 /nfs/dbraw/zinc/87/97/34/905879734.db2.gz BUHVVRBGZGUGGI-FQEVSTJZSA-N 0 3 421.549 4.204 20 0 HIADHN Cc1cc(NC(=O)Nc2cc([C@@H]3C[C@H]3C)[nH]n2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000494648145 905881015 /nfs/dbraw/zinc/88/10/15/905881015.db2.gz KKHGJRHGVMTDJA-AYOQOUSVSA-N 0 3 419.533 4.129 20 0 HIADHN C[C@@H]1[C@H](NC(=O)N[C@H](c2nccs2)c2ccccc2)CCN1Cc1ccccc1 ZINC000494652638 905885437 /nfs/dbraw/zinc/88/54/37/905885437.db2.gz XYMZWLUVLSGIBN-UIFIKXQLSA-N 0 3 406.555 4.195 20 0 HIADHN CC(C)[C@H](O)C(C)(C)CN[C@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000494711388 905914111 /nfs/dbraw/zinc/91/41/11/905914111.db2.gz BDGCNOHDLSEDBO-RTWAWAEBSA-N 0 3 424.006 4.466 20 0 HIADHN CC(C)c1ccc(O[C@H](C)CNC(=O)N(Cc2ccco2)C2CCN(C)CC2)cc1 ZINC000512482485 921190826 /nfs/dbraw/zinc/19/08/26/921190826.db2.gz FKGTWKFGOZJBOS-LJQANCHMSA-N 0 3 413.562 4.476 20 0 HIADHN CCOCCC1(CN[C@@H](c2ccc(F)cc2)c2cccc(S(C)(=O)=O)c2)CC1 ZINC000494728505 905930151 /nfs/dbraw/zinc/93/01/51/905930151.db2.gz DKYIZCVOODHBLU-NRFANRHFSA-N 0 3 405.535 4.115 20 0 HIADHN COc1cc(C)c(CN2CCC[C@H](CNC(=O)Nc3cccc(F)c3)C2)cc1OC ZINC000512481713 921191190 /nfs/dbraw/zinc/19/11/90/921191190.db2.gz XIUWXFHAFXXKEO-QGZVFWFLSA-N 0 3 415.509 4.185 20 0 HIADHN COc1cc(C)c(NC(=O)NCCCCN2CCN(c3ccccc3)CC2)c(C)c1C ZINC000494744302 905942515 /nfs/dbraw/zinc/94/25/15/905942515.db2.gz CYLQJIXBKCHXLR-UHFFFAOYSA-N 0 3 424.589 4.344 20 0 HIADHN CC1CCN(CCNC(=O)c2ccccc2CSc2nc3ccccc3[nH]2)CC1 ZINC000512484320 921192418 /nfs/dbraw/zinc/19/24/18/921192418.db2.gz BTDWXYSWYMHOMO-UHFFFAOYSA-N 0 3 408.571 4.317 20 0 HIADHN CN(C)CCN(Cc1cccc(O)c1)C(=O)c1ccc(Br)cc1Cl ZINC000494770332 905967598 /nfs/dbraw/zinc/96/75/98/905967598.db2.gz ZXJIOVDMJRRCCE-UHFFFAOYSA-N 0 3 411.727 4.012 20 0 HIADHN CC(C)Sc1ccc([C@@H](C)NC(=O)N2CCN(C3CCOCC3)C[C@H]2C)cc1 ZINC000494922834 906095863 /nfs/dbraw/zinc/09/58/63/906095863.db2.gz XXLUMUDUSKMDBJ-QZTJIDSGSA-N 0 3 405.608 4.143 20 0 HIADHN C[C@@H](N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1)c1ccc(C(=O)N(C)C)cc1 ZINC000494929504 906101445 /nfs/dbraw/zinc/10/14/45/906101445.db2.gz ITZFCLFSISNREP-NTKDMRAZSA-N 0 3 415.537 4.289 20 0 HIADHN C[C@H](NC(=O)N[C@H](CN(C)C)c1ccc(Cl)cc1)[C@@H]1OCCc2sccc21 ZINC000494959292 906129933 /nfs/dbraw/zinc/12/99/33/906129933.db2.gz MTUKXRRCZGNSIX-IRWQIABSSA-N 0 3 407.967 4.006 20 0 HIADHN COc1ccc([C@H](NC[C@@H]2C[C@@H](O)CN2Cc2ccccc2)c2ccccc2)cc1 ZINC000494968874 906137705 /nfs/dbraw/zinc/13/77/05/906137705.db2.gz LMHLKQYBKIULHH-BFLUCZKCSA-N 0 3 402.538 4.010 20 0 HIADHN CCN(CC(F)(F)F)C(=O)[C@H]1CCCN(Cc2cnc(-c3ccco3)s2)C1 ZINC000494970298 906139542 /nfs/dbraw/zinc/13/95/42/906139542.db2.gz GZTUVLXUHZICCN-ZDUSSCGKSA-N 0 3 401.454 4.026 20 0 HIADHN O=C(Nc1ccc(Br)cc1)C1CCN(Cc2ccc3c(c2)CCO3)CC1 ZINC000512516203 921209382 /nfs/dbraw/zinc/20/93/82/921209382.db2.gz BWPGVTKJMXMZTG-UHFFFAOYSA-N 0 3 415.331 4.235 20 0 HIADHN O=S1(=O)CC[C@@H](NC[C@H]2CCCCC(F)(F)C2)c2cc(Br)ccc21 ZINC000494996437 906159313 /nfs/dbraw/zinc/15/93/13/906159313.db2.gz ILFXEFZMXDLDSW-SWLSCSKDSA-N 0 3 422.335 4.473 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)Nc3ccc(Oc4cccnc4)cc3)CC2)c1 ZINC000495014933 906173119 /nfs/dbraw/zinc/17/31/19/906173119.db2.gz DCFFIDFGICJSDT-UHFFFAOYSA-N 0 3 416.525 4.333 20 0 HIADHN Fc1ccc([C@H](C[C@@H]2CCOC2)NCc2cc(F)ccc2N2CCOCC2)cc1 ZINC000495041732 906198058 /nfs/dbraw/zinc/19/80/58/906198058.db2.gz VDYGRFWNFGPPKQ-JTSKRJEESA-N 0 3 402.485 4.059 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(C(=O)N(C)C)cc1)c1ccc(NC(=O)c2ccncc2)cc1 ZINC000495046810 906202425 /nfs/dbraw/zinc/20/24/25/906202425.db2.gz HCOPUVAXXYEVIJ-ZWKOTPCHSA-N 0 3 416.525 4.448 20 0 HIADHN CCN(C(=O)c1ccc2c(c1)C(C)(C)C(=O)N2)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000495060096 906212028 /nfs/dbraw/zinc/21/20/28/906212028.db2.gz PTPIJTLXFWMKQO-PXNSSMCTSA-N 0 3 405.542 4.214 20 0 HIADHN Cc1ccc2cccc(NC(=O)NCCCCN3CCN(c4ccccc4)CC3)c2n1 ZINC000512528290 921217251 /nfs/dbraw/zinc/21/72/51/921217251.db2.gz FDZTWACYBSEPGO-UHFFFAOYSA-N 0 3 417.557 4.267 20 0 HIADHN FC(F)COc1ccc(CN2CCC(c3nc(-c4ccccn4)no3)CC2)cc1 ZINC000512536267 921221760 /nfs/dbraw/zinc/22/17/60/921221760.db2.gz HIGGPWNCAMZFJM-UHFFFAOYSA-N 0 3 400.429 4.155 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N[C@H](C)c2nc(C(F)(F)F)cs2)N(C)C)cc1 ZINC000495178463 906288906 /nfs/dbraw/zinc/28/89/06/906288906.db2.gz QMRHXKHOLOKIBX-OCCSQVGLSA-N 0 3 400.470 4.133 20 0 HIADHN C[C@H]1CCCN(CCNC(=O)c2ccc(COc3cccc(Br)c3)o2)C1 ZINC000495309080 906369237 /nfs/dbraw/zinc/36/92/37/906369237.db2.gz YVQDRLDTRQXGCV-HNNXBMFYSA-N 0 3 421.335 4.083 20 0 HIADHN COc1cc(NC(=O)NCC2(N3CCSCC3)CCCC2)cc(OC)c1C(C)C ZINC000495332789 906381071 /nfs/dbraw/zinc/38/10/71/906381071.db2.gz QQJCKHXCXFKOSQ-UHFFFAOYSA-N 0 3 421.607 4.310 20 0 HIADHN O=C(c1ccc(CN2CCC(CO)CC2)cc1)N1CC2(CCCC2)c2ccccc21 ZINC000495399815 906427105 /nfs/dbraw/zinc/42/71/05/906427105.db2.gz MCHVLKMZNURPCG-UHFFFAOYSA-N 0 3 404.554 4.363 20 0 HIADHN CCC[C@@H](C)NC(=O)[C@H]1CCCN(Cc2cn(C)nc2-c2ccccc2Cl)C1 ZINC000512557298 921235166 /nfs/dbraw/zinc/23/51/66/921235166.db2.gz OTVVQMROEUAFHT-SJORKVTESA-N 0 3 402.970 4.257 20 0 HIADHN Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)NC(=O)N1CCN2CCC1CC2 ZINC000495421261 906441126 /nfs/dbraw/zinc/44/11/26/906441126.db2.gz PCELKANGQCYZOX-CQSZACIVSA-N 0 3 404.967 4.323 20 0 HIADHN C[C@H](NC(=O)N[C@H]1CCN(Cc2ccccc2)[C@@H]1C)c1nc(C(C)(C)C)cs1 ZINC000495449172 906455553 /nfs/dbraw/zinc/45/55/53/906455553.db2.gz ATLICNNYVWLQCJ-JZXOWHBKSA-N 0 3 400.592 4.464 20 0 HIADHN O=C(COc1ccccc1CN1CCC(OC2CCCCC2)CC1)N1CCCC1 ZINC000512562132 921238362 /nfs/dbraw/zinc/23/83/62/921238362.db2.gz PWGWCPFHOQJNTA-UHFFFAOYSA-N 0 3 400.563 4.002 20 0 HIADHN O=C(Nc1cccc(-c2ccccc2)c1)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1CO ZINC000495580148 906508245 /nfs/dbraw/zinc/50/82/45/906508245.db2.gz ZGBFILKNOZNADQ-ILBGXUMGSA-N 0 3 415.537 4.358 20 0 HIADHN CS[C@@H]1CN(C(=O)c2csc(-c3ccc(Cl)cc3Cl)n2)C[C@H]1N(C)C ZINC000495728402 906535320 /nfs/dbraw/zinc/53/53/20/906535320.db2.gz NNNVLPRXDWMXPA-HUUCEWRRSA-N 0 3 416.399 4.235 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)[C@H](C)Sc1ccc(OC)cc1 ZINC000496228467 906633971 /nfs/dbraw/zinc/63/39/71/906633971.db2.gz ZDIOCBNFZFYPGL-ICSRJNTNSA-N 0 3 413.587 4.084 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)c1ccc(Br)s1 ZINC000496272515 906644278 /nfs/dbraw/zinc/64/42/78/906644278.db2.gz OHRHWIDSULCAHE-OAHLLOKOSA-N 0 3 408.365 4.032 20 0 HIADHN O=C(Nc1ccc(O)cc1)C1CCN(Cc2ccccc2OCc2ccncc2)CC1 ZINC000512599971 921255190 /nfs/dbraw/zinc/25/51/90/921255190.db2.gz MVNKOFMGYARHNF-UHFFFAOYSA-N 0 3 417.509 4.217 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)c1cccc(Oc2ccncc2)c1 ZINC000496396432 906673671 /nfs/dbraw/zinc/67/36/71/906673671.db2.gz SVAFUUDWXAQUBL-UHFFFAOYSA-N 0 3 411.452 4.356 20 0 HIADHN Cc1cc(Cl)ccc1Cc1cnc(NC(=O)N2CC[C@H]3CCN(C)C[C@@H]32)s1 ZINC000496445559 906681362 /nfs/dbraw/zinc/68/13/62/906681362.db2.gz AOKNLCGXEDVUOL-KDOFPFPSSA-N 0 3 404.967 4.254 20 0 HIADHN Cc1cc(Cl)ccc1Cc1cnc(NC(=O)N[C@H](C)C2=CCN(C)CC2)s1 ZINC000496450488 906686243 /nfs/dbraw/zinc/68/62/43/906686243.db2.gz SXIHKSHQTHLGJN-CQSZACIVSA-N 0 3 404.967 4.468 20 0 HIADHN O=C(CSCc1ccncc1)N(CCN1CCCC1)Cc1ccc(Cl)cc1 ZINC000496862771 906769074 /nfs/dbraw/zinc/76/90/74/906769074.db2.gz DBSLJNXEDXXVNP-UHFFFAOYSA-N 0 3 403.979 4.093 20 0 HIADHN CCOc1cc(CN2CCC(C(=O)N[C@H](C)C(C)C)CC2)ccc1OCC(C)C ZINC000512623695 921266333 /nfs/dbraw/zinc/26/63/33/921266333.db2.gz UFCCBLHQQGFMRQ-LJQANCHMSA-N 0 3 404.595 4.493 20 0 HIADHN CN1CCN(Cc2ccc(CNC(=O)Nc3cc(C(F)F)ccc3Cl)cc2)CC1 ZINC000497363275 906853895 /nfs/dbraw/zinc/85/38/95/906853895.db2.gz GVTOAHCKEQQDSF-UHFFFAOYSA-N 0 3 422.907 4.347 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)[C@@H](C)Oc2ccc(C)cc2Br)o1 ZINC000497380008 906866829 /nfs/dbraw/zinc/86/68/29/906866829.db2.gz AQHPTBQVBQCRIK-MRXNPFEDSA-N 0 3 423.351 4.017 20 0 HIADHN O[C@@H](COc1ccc(Br)cc1)CN1CCC(OC2CCCCC2)CC1 ZINC000497386259 906871611 /nfs/dbraw/zinc/87/16/11/906871611.db2.gz KDXURYSFPNQYCH-QGZVFWFLSA-N 0 3 412.368 4.003 20 0 HIADHN CN1C[C@@H](c2ccccc2)[C@H](NC(=O)c2ccc(NC(=O)Nc3ccccc3)cc2)C1 ZINC000497388571 906874175 /nfs/dbraw/zinc/87/41/75/906874175.db2.gz UNBHLFMYOSHWAW-XZOQPEGZSA-N 0 3 414.509 4.158 20 0 HIADHN C[C@H](CC(=O)N[C@@H]1CN(C)C[C@H]1c1ccccc1)c1ccc(Br)cc1 ZINC000497413600 906889606 /nfs/dbraw/zinc/88/96/06/906889606.db2.gz BKHUQBYXGMLGLW-UIAACRFSSA-N 0 3 401.348 4.157 20 0 HIADHN C[C@H](CC(=O)N[C@H]1CN(C)C[C@H]1c1ccccc1)c1ccc(Br)cc1 ZINC000497413602 906889773 /nfs/dbraw/zinc/88/97/73/906889773.db2.gz BKHUQBYXGMLGLW-XPGWFJOJSA-N 0 3 401.348 4.157 20 0 HIADHN CCC[C@@H](C)NC(=O)[C@@H]1CCCN(Cc2cccc(C(=O)Nc3ccccc3)c2)C1 ZINC000497448283 906923872 /nfs/dbraw/zinc/92/38/72/906923872.db2.gz YJDWDRXVTLGUEI-DENIHFKCSA-N 0 3 407.558 4.456 20 0 HIADHN COc1cc(F)c([C@H](C)NC(=O)NC[C@H](c2cccs2)N2CCCC2)cc1OC ZINC000512678123 921284744 /nfs/dbraw/zinc/28/47/44/921284744.db2.gz OQNMHGHUIAEZCU-WMLDXEAASA-N 0 3 421.538 4.102 20 0 HIADHN Cc1ccc(Cl)c(S(=O)(=O)NC2C[C@H]3CC[C@@H](C2)N3Cc2ccccc2)c1 ZINC000497542330 907033838 /nfs/dbraw/zinc/03/38/38/907033838.db2.gz ORZDYSYPDPBCRT-YQQQUEKLSA-N 0 3 404.963 4.122 20 0 HIADHN NC(=O)CC[C@@H]1CCCN(Cc2cn(Cc3ccccc3)nc2-c2cccs2)C1 ZINC000512690817 921288318 /nfs/dbraw/zinc/28/83/18/921288318.db2.gz PKLSATNVMGFFKQ-IBGZPJMESA-N 0 3 408.571 4.137 20 0 HIADHN O[C@@H](COc1ccc(Cl)cc1Cl)CN1CCC[C@H]1c1ccc2c(c1)OCCO2 ZINC000497587819 907069299 /nfs/dbraw/zinc/06/92/99/907069299.db2.gz WTQNHUXGOXBNPE-AEFFLSMTSA-N 0 3 424.324 4.341 20 0 HIADHN COc1cc(C)c([C@H](C)NC(=O)N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)cc1OC ZINC000497608899 907086620 /nfs/dbraw/zinc/08/66/20/907086620.db2.gz SJKDOLNUQNHHLI-HBFSDRIKSA-N 0 3 411.546 4.035 20 0 HIADHN CC(C)(C)c1nn(-c2ccccc2Cl)cc1CN1CCC[C@@H](CCC(N)=O)C1 ZINC000512706208 921293400 /nfs/dbraw/zinc/29/34/00/921293400.db2.gz WTSBRLYEHMLSFS-INIZCTEOSA-N 0 3 402.970 4.301 20 0 HIADHN Cc1cccc(COc2ccc([C@H](C)NC(=O)N3CC[C@H]4CCN(C)C[C@@H]43)cc2)c1 ZINC000497627814 907109296 /nfs/dbraw/zinc/10/92/96/907109296.db2.gz NSCNFGGUDNHZKL-KWOQKUFVSA-N 0 3 407.558 4.371 20 0 HIADHN Cc1cccnc1[C@H](NC(=O)NC[C@H](c1ccc(OC(C)C)cc1)N(C)C)C(C)C ZINC000497629907 907110620 /nfs/dbraw/zinc/11/06/20/907110620.db2.gz UQINSEWDZTZNKN-FGZHOGPDSA-N 0 3 412.578 4.476 20 0 HIADHN CC(C)(C)[C@H](CN1CCc2ccccc2C1)NC(=O)N1CCCC[C@@H]1c1cn[nH]c1 ZINC000497657388 907147648 /nfs/dbraw/zinc/14/76/48/907147648.db2.gz MPVAXXKCLGIMBL-YADHBBJMSA-N 0 3 409.578 4.119 20 0 HIADHN CS[C@H]1CN(C(=O)Nc2cc(C)ccc2SCC(F)(F)F)C[C@H]1N(C)C ZINC000497671541 907172710 /nfs/dbraw/zinc/17/27/10/907172710.db2.gz YSDSTTRJTYUHLC-HIFRSBDPSA-N 0 3 407.527 4.159 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)N[C@@H](C)c2ncc(-c3ccccc3)o2)cc1 ZINC000497697519 907202037 /nfs/dbraw/zinc/20/20/37/907202037.db2.gz QPNHIFXKJFGSCQ-OXJNMPFZSA-N 0 3 408.502 4.013 20 0 HIADHN Brc1cccc(-c2ccc(CN[C@@H]3CCCN(c4ncccn4)C3)o2)c1 ZINC000512795625 921312532 /nfs/dbraw/zinc/31/25/32/921312532.db2.gz XETPMXXYGKRFBZ-QGZVFWFLSA-N 0 3 413.319 4.258 20 0 HIADHN C[C@@H]1CN(CCCN[C@H](c2ccco2)c2ccc(Br)cc2)C[C@H](C)O1 ZINC000497830167 907312234 /nfs/dbraw/zinc/31/22/34/907312234.db2.gz YGXNVGVFIPHVLG-YRNRMSPPSA-N 0 3 407.352 4.220 20 0 HIADHN C[C@@H](CCn1cccn1)N[C@@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000497851960 907332708 /nfs/dbraw/zinc/33/27/08/907332708.db2.gz GXYDKXGNOBGHCL-KKSFZXQISA-N 0 3 417.962 4.098 20 0 HIADHN CCN(C(=O)c1ccc2c(c1)NC(=O)[C@H](C)S2)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000497956545 907426077 /nfs/dbraw/zinc/42/60/77/907426077.db2.gz CQMZLAWKHKPLPJ-UWVAXJGDSA-N 0 3 423.582 4.417 20 0 HIADHN CCCCN1C(=O)C[C@H](C(=O)Nc2cccc(CN(C)C)c2)[C@@H]1c1ccc(OC)cc1 ZINC000497972267 907442181 /nfs/dbraw/zinc/44/21/81/907442181.db2.gz XTSCFQCNPYNYFI-UPVQGACJSA-N 0 3 423.557 4.085 20 0 HIADHN COc1ccc([C@@H](CNC(=O)C[C@H]2CCCc3cc(OC)ccc32)N2CCCC2)cc1 ZINC000497994547 907475021 /nfs/dbraw/zinc/47/50/21/907475021.db2.gz QQGAEFBHZAKOEE-PXDATVDWSA-N 0 3 422.569 4.467 20 0 HIADHN COc1ccc([C@H](CNC(=O)Cn2ccc3ccc(Cl)cc32)N2CCCC2)cc1 ZINC000497996975 907480224 /nfs/dbraw/zinc/48/02/24/907480224.db2.gz WEULWCPDSUUAEO-QFIPXVFZSA-N 0 3 411.933 4.257 20 0 HIADHN CCN(C(=O)c1ccn(-c2ccc(F)cc2)n1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000498020075 907517985 /nfs/dbraw/zinc/51/79/85/907517985.db2.gz WDRUUBGOXDHXPW-PGRDOPGGSA-N 0 3 406.505 4.309 20 0 HIADHN CCN(C(=O)c1ccn(-c2ccc(F)cc2)n1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000498020074 907518870 /nfs/dbraw/zinc/51/88/70/907518870.db2.gz WDRUUBGOXDHXPW-GCJKJVERSA-N 0 3 406.505 4.309 20 0 HIADHN Cc1cnc([C@@H](NC(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)C2CC2)s1 ZINC000498105590 907615564 /nfs/dbraw/zinc/61/55/64/907615564.db2.gz CEGKDPZUOVDXJI-UXHICEINSA-N 0 3 416.591 4.292 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)NC[C@H](c3c[nH]c4ccccc43)c3ccccc3)[C@@H]2C1 ZINC000498112521 907623298 /nfs/dbraw/zinc/62/32/98/907623298.db2.gz ARUKLOFYIWFXAV-NHCICSSKSA-N 0 3 402.542 4.035 20 0 HIADHN CN1CCN(CCCNC(=O)Cc2ccc(Cl)c(Cl)c2)[C@H](c2ccccc2)C1 ZINC000498136582 907656321 /nfs/dbraw/zinc/65/63/21/907656321.db2.gz UPQLMPNQSYZHGX-NRFANRHFSA-N 0 3 420.384 4.031 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N[C@H](c2cccc(F)c2)c2ccccn2)N(C)C)cc1 ZINC000498250051 907787023 /nfs/dbraw/zinc/78/70/23/907787023.db2.gz HEWIGQIYRQXRBB-XZOQPEGZSA-N 0 3 406.505 4.221 20 0 HIADHN CC[C@H](NCc1ccc(Br)c(Br)c1)[C@@H](O)C(F)(F)F ZINC000498352848 907854158 /nfs/dbraw/zinc/85/41/58/907854158.db2.gz IVDQZVVEFXVEJJ-WDEREUQCSA-N 0 3 405.052 4.003 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)c2ccccc2Nc2cccc(C)c2C)CC1 ZINC000498436372 907902905 /nfs/dbraw/zinc/90/29/05/907902905.db2.gz PAENQGNBTVBJPB-IBGZPJMESA-N 0 3 408.590 4.050 20 0 HIADHN Cc1sc2ncnc(SCCC(=O)N(CCN(C)C)C3CCCC3)c2c1C ZINC000498451491 907915729 /nfs/dbraw/zinc/91/57/29/907915729.db2.gz JCUXDSLZHOPADD-UHFFFAOYSA-N 0 3 406.621 4.123 20 0 HIADHN Cc1ccc(C(=O)N(CCN(C)C)C2CCCC2)cc1NC(=O)c1ccccc1F ZINC000498454178 907917412 /nfs/dbraw/zinc/91/74/12/907917412.db2.gz MAUBMMKRBPVAOY-UHFFFAOYSA-N 0 3 411.521 4.333 20 0 HIADHN Cc1c(C(=O)N(CCN(C)C)C2CCCC2)nnn1-c1ccc(-c2ccccc2)cc1 ZINC000498456069 907919464 /nfs/dbraw/zinc/91/94/64/907919464.db2.gz ZTWBUJVGURTWSU-UHFFFAOYSA-N 0 3 417.557 4.189 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)NCc2ccccc2N2CCCCC2)CC1 ZINC000498462355 907927913 /nfs/dbraw/zinc/92/79/13/907927913.db2.gz IWXFHLDQOPDFGZ-UHFFFAOYSA-N 0 3 420.601 4.483 20 0 HIADHN CN(C)CCN(C(=O)CCCc1nc(-c2ccc(Cl)cc2)no1)C1CCCC1 ZINC000498468401 907937301 /nfs/dbraw/zinc/93/73/01/907937301.db2.gz YSEOOZMEJLARMU-UHFFFAOYSA-N 0 3 404.942 4.046 20 0 HIADHN CCN1CCN(CCNC(=O)c2ccccc2Oc2ccc(Cl)cc2Cl)CC1 ZINC000498513326 907985326 /nfs/dbraw/zinc/98/53/26/907985326.db2.gz HLVKKAZFSWAQHA-UHFFFAOYSA-N 0 3 422.356 4.153 20 0 HIADHN CC[C@H](NCc1cc(Br)c(O)c(OC)c1)c1ccc(OC)c(OC)c1 ZINC000512885346 921380411 /nfs/dbraw/zinc/38/04/11/921380411.db2.gz OHZMSPBXPHRKMO-HNNXBMFYSA-N 0 3 410.308 4.421 20 0 HIADHN Cc1nc(Cc2ccccc2)sc1C(=O)N(CCN(C)C)Cc1ccccc1F ZINC000498713951 908140506 /nfs/dbraw/zinc/14/05/06/908140506.db2.gz YPFMSGAKGBWQIW-UHFFFAOYSA-N 0 3 411.546 4.385 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)c1cc(Br)cs1 ZINC000498729876 908155938 /nfs/dbraw/zinc/15/59/38/908155938.db2.gz QRCCQFNCPKSOLJ-MRXNPFEDSA-N 0 3 408.365 4.032 20 0 HIADHN COc1ccc(CN(C)C(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)cc1C ZINC000512897777 921389891 /nfs/dbraw/zinc/38/98/91/921389891.db2.gz UQLPDBQFUFYAHC-QFIPXVFZSA-N 0 3 413.562 4.235 20 0 HIADHN FC(F)(F)Oc1cccc([C@H](NCc2cnc(N3CCOCC3)s2)C2CC2)c1 ZINC000512904379 921396130 /nfs/dbraw/zinc/39/61/30/921396130.db2.gz SJFOQWYSVWJYPH-QGZVFWFLSA-N 0 3 413.465 4.119 20 0 HIADHN O=C(CCc1ccc(OC(F)F)cc1)NC[C@@H]1CCCCN1Cc1ccccc1 ZINC000498903159 908310320 /nfs/dbraw/zinc/31/03/20/908310320.db2.gz FGBQSQZFKMDHLK-FQEVSTJZSA-N 0 3 402.485 4.392 20 0 HIADHN O=C(Nc1ccccc1)c1cccc(CN2CCC[C@H](c3nnc(C4CC4)[nH]3)C2)c1 ZINC000498927668 908336650 /nfs/dbraw/zinc/33/66/50/908336650.db2.gz VEIGCXOGMHZPKE-FQEVSTJZSA-N 0 3 401.514 4.314 20 0 HIADHN C[C@H](c1nc(Cc2ccc(Cl)cc2)no1)N1CCC[C@@H](c2n[nH]c(C3CC3)n2)C1 ZINC000498936997 908343383 /nfs/dbraw/zinc/34/33/83/908343383.db2.gz PDUMGNJAUJEKJD-CZUORRHYSA-N 0 3 412.925 4.250 20 0 HIADHN C[C@H](c1nc(Cc2ccc(Cl)cc2)no1)N1CCC[C@H](c2n[nH]c(C3CC3)n2)C1 ZINC000498936996 908344290 /nfs/dbraw/zinc/34/42/90/908344290.db2.gz PDUMGNJAUJEKJD-CJNGLKHVSA-N 0 3 412.925 4.250 20 0 HIADHN CCN1C[C@H](C)N(CC(=O)Nc2nc(-c3cc(C)c(C)cc3C)cs2)C[C@H]1C ZINC000498944128 908349286 /nfs/dbraw/zinc/34/92/86/908349286.db2.gz ZMQACYRMPKIZIM-MSOLQXFVSA-N 0 3 400.592 4.088 20 0 HIADHN COc1cc(CNCC2(C(F)(F)F)CC2)cc(Br)c1OC(F)F ZINC000512912322 921405431 /nfs/dbraw/zinc/40/54/31/921405431.db2.gz COYOJBWQDBLAHZ-UHFFFAOYSA-N 0 3 404.173 4.491 20 0 HIADHN Cc1cccc([C@@H](NC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)c2ccccn2)c1 ZINC000499013368 908389121 /nfs/dbraw/zinc/38/91/21/908389121.db2.gz LSRXPOUVIKVBDD-ISKFKSNPSA-N 0 3 400.526 4.053 20 0 HIADHN Cc1cccc([C@H](NC(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)c2ccccn2)c1 ZINC000499026674 908401693 /nfs/dbraw/zinc/40/16/93/908401693.db2.gz KPJDFBDCXHIZLV-NOZRDPDXSA-N 0 3 414.553 4.395 20 0 HIADHN COc1ccc([C@H](C)N(C)C(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)cc1 ZINC000512918552 921412290 /nfs/dbraw/zinc/41/22/90/921412290.db2.gz QQXRHYJWGNCWIS-FDDCHVKYSA-N 0 3 413.562 4.488 20 0 HIADHN CCCOc1c(Cl)cc(C(=O)NC[C@@H](c2ccc(C)cc2)N(C)C)cc1OC ZINC000499135418 908491420 /nfs/dbraw/zinc/49/14/20/908491420.db2.gz RIAMBBKVHNSRGQ-IBGZPJMESA-N 0 3 404.938 4.479 20 0 HIADHN Cc1cc(NC(=O)NC[C@H](Cc2ccccc2)N(C)C)ccc1Oc1cccnc1 ZINC000512921259 921415665 /nfs/dbraw/zinc/41/56/65/921415665.db2.gz MEIPFKTZOLPVFO-NRFANRHFSA-N 0 3 404.514 4.477 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2nc(C3CC3)n(-c3ccccc3Cl)n2)N(C)C)cc1 ZINC000499158539 908514819 /nfs/dbraw/zinc/51/48/19/908514819.db2.gz RBRMRALZNUWTJW-FQEVSTJZSA-N 0 3 423.948 4.139 20 0 HIADHN C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)N1CCc2nc(-c3ccccc3Cl)sc2C1 ZINC000499194195 908548563 /nfs/dbraw/zinc/54/85/63/908548563.db2.gz SAFMRMPPMGDYPL-FZKQIMNGSA-N 0 3 416.978 4.014 20 0 HIADHN CC(C)(C)[C@H]1CCN(Cc2cn(Cc3ccccc3)nc2-c2cccnc2)C[C@@H]1O ZINC000499254392 908629414 /nfs/dbraw/zinc/62/94/14/908629414.db2.gz KRXJXHTVKHEAAA-GOTSBHOMSA-N 0 3 404.558 4.222 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3ccc(N(C)CC(C)C)cc3)c(C)c2)CC1 ZINC000499304865 908677622 /nfs/dbraw/zinc/67/76/22/908677622.db2.gz DOEHDNPTMFFLGZ-UHFFFAOYSA-N 0 3 408.590 4.481 20 0 HIADHN Cc1cccnc1[C@H](NC(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F)C(C)C ZINC000512944575 921429723 /nfs/dbraw/zinc/42/97/23/921429723.db2.gz FHGWWBDGSNOKPT-VQTJNVASSA-N 0 3 401.501 4.361 20 0 HIADHN C[C@@H](NC(=O)NCCc1csc(-c2ccccc2)n1)[C@H](c1ccccc1)N(C)C ZINC000499333215 908708908 /nfs/dbraw/zinc/70/89/08/908708908.db2.gz CRPNIFBQYMNUER-DYESRHJHSA-N 0 3 408.571 4.343 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2nn(-c3ccccc3)c3c2CCC3)N2CCCC2)cc1 ZINC000499419416 908786171 /nfs/dbraw/zinc/78/61/71/908786171.db2.gz UTTIXCKPSYGJMY-DEOSSOPVSA-N 0 3 414.553 4.236 20 0 HIADHN CN(C(=O)c1cnn(-c2ccccc2)c1C1CC1)C1CCN(Cc2ccccc2)CC1 ZINC000499507418 908821673 /nfs/dbraw/zinc/82/16/73/908821673.db2.gz CMTMXYIFJUSZSN-UHFFFAOYSA-N 0 3 414.553 4.486 20 0 HIADHN Cc1nn(-c2ccccc2)c(Oc2cccc(F)c2)c1CNCCn1ccnc1C ZINC000499663748 908869581 /nfs/dbraw/zinc/86/95/81/908869581.db2.gz LWZOSHDRNZXHQG-UHFFFAOYSA-N 0 3 405.477 4.407 20 0 HIADHN Cc1nn(-c2ccccc2)c(Oc2cccc(F)c2)c1CN[C@@H](C)CC[S@](C)=O ZINC000499709310 908884465 /nfs/dbraw/zinc/88/44/65/908884465.db2.gz WVVGXHKFFNOLRI-OFJJUDJNSA-N 0 3 415.534 4.359 20 0 HIADHN Cc1nn(-c2ccccc2)c(Oc2cccc(F)c2)c1CN[C@H](C)CC[S@@](C)=O ZINC000499709309 908884503 /nfs/dbraw/zinc/88/45/03/908884503.db2.gz WVVGXHKFFNOLRI-HYDGNGQDSA-N 0 3 415.534 4.359 20 0 HIADHN O=C(NCc1ccnc(OC2CCCC2)c1)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000499739465 908894981 /nfs/dbraw/zinc/89/49/81/908894981.db2.gz APBCCWPWMGPFBR-QFIPXVFZSA-N 0 3 408.546 4.039 20 0 HIADHN CCOc1cc(CNCC2(S(C)(=O)=O)CCCC2)ccc1OCc1ccccc1 ZINC000512991784 921460613 /nfs/dbraw/zinc/46/06/13/921460613.db2.gz HGGBTEYJIVCOAP-UHFFFAOYSA-N 0 3 417.571 4.111 20 0 HIADHN CCOc1cc(CN2CCC[C@@H](CNC(=O)c3ccccc3)C2)ccc1OC(F)F ZINC000513028195 921488251 /nfs/dbraw/zinc/48/82/51/921488251.db2.gz WOMJYDQXBXGELI-SFHVURJKSA-N 0 3 418.484 4.329 20 0 HIADHN CNC(=O)COc1cccc(CNCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c1 ZINC000513040790 921499757 /nfs/dbraw/zinc/49/97/57/921499757.db2.gz KZWPVMUXYMKONE-UHFFFAOYSA-N 0 3 420.353 4.139 20 0 HIADHN CCc1nnc(NC(=O)[C@@H](C)[C@H](C)NCc2ccc(-c3ccncc3)cc2F)s1 ZINC000513040993 921500171 /nfs/dbraw/zinc/50/01/71/921500171.db2.gz MJEXMWNLVVHLOE-KBPBESRZSA-N 0 3 413.522 4.055 20 0 HIADHN CC(C)(C)OC(=O)c1cccc(CN2CCC(C(=O)NC3CCCCC3)CC2)c1 ZINC000500104173 909588028 /nfs/dbraw/zinc/58/80/28/909588028.db2.gz NDDMXTVMKGZYAP-UHFFFAOYSA-N 0 3 400.563 4.303 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)N[C@H]2CCOC3(CCCCC3)C2)N(C)C)cc1 ZINC000500148001 909624188 /nfs/dbraw/zinc/62/41/88/909624188.db2.gz OJYXGTRDNWEGAT-UNMCSNQZSA-N 0 3 417.594 4.258 20 0 HIADHN CN(CCNC(=O)CCc1nc2cc(C(F)(F)F)ccc2s1)Cc1ccccc1 ZINC000500158218 909639447 /nfs/dbraw/zinc/63/94/47/909639447.db2.gz WUPIWCHMOADWFC-UHFFFAOYSA-N 0 3 421.488 4.496 20 0 HIADHN O=C(NCc1ccc(Oc2ccc(F)cc2)nc1)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000500165833 909648821 /nfs/dbraw/zinc/64/88/21/909648821.db2.gz VQGBCIJEEFORON-OAQYLSRUSA-N 0 3 420.488 4.087 20 0 HIADHN CCN(Cc1ccc(OC)c(OC)c1)C(=O)CN1CCC[C@@H]1Cc1ccc(C)cc1 ZINC000500232294 909721593 /nfs/dbraw/zinc/72/15/93/909721593.db2.gz DIKDXXACRIPTSW-JOCHJYFZSA-N 0 3 410.558 4.068 20 0 HIADHN CC(=O)Nc1ccc(OC[C@@H](O)CN(C)[C@@H](c2ccccc2Cl)C(C)C)cc1 ZINC000500237487 909726942 /nfs/dbraw/zinc/72/69/42/909726942.db2.gz NSXHRQZFXZMTRF-PGRDOPGGSA-N 0 3 404.938 4.367 20 0 HIADHN Cc1nn(-c2ccccc2)c(Oc2cccc(F)c2)c1CNCCCNC(=O)C(C)C ZINC000500244353 909732598 /nfs/dbraw/zinc/73/25/98/909732598.db2.gz FRHLTKGIZIKPTP-UHFFFAOYSA-N 0 3 424.520 4.364 20 0 HIADHN COc1cc(CN[C@H]2CCCc3cc(F)ccc32)ccc1OCC(=O)N1CCCC1 ZINC000500252710 909740186 /nfs/dbraw/zinc/74/01/86/909740186.db2.gz VHFSGQJFEOXOSB-NRFANRHFSA-N 0 3 412.505 4.003 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCCc1nc2c(cccc2C)o1)c1cccc(OC)c1 ZINC000500270911 909750407 /nfs/dbraw/zinc/75/04/07/909750407.db2.gz VNVOQPYTSVTOQE-FQEVSTJZSA-N 0 3 424.545 4.070 20 0 HIADHN C[C@@H](NC(=O)N[C@H](CN1CCCC1)c1ccccc1)c1ccccc1OC(F)F ZINC000500381763 909826800 /nfs/dbraw/zinc/82/68/00/909826800.db2.gz GFLTYJGQGZIDCX-VQIMIIECSA-N 0 3 403.473 4.485 20 0 HIADHN CS(=O)(=O)c1ccc(F)c(CNCC(c2ccc(F)cc2)c2ccc(F)cc2)c1 ZINC000500397406 909834414 /nfs/dbraw/zinc/83/44/14/909834414.db2.gz BMMUPQYCWISACA-UHFFFAOYSA-N 0 3 419.468 4.429 20 0 HIADHN C[C@H](C(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1)c1cn(C)c2ccccc12 ZINC000500396947 909834957 /nfs/dbraw/zinc/83/49/57/909834957.db2.gz OXUQYEQAJHAWKT-AQNXPRMDSA-N 0 3 411.590 4.020 20 0 HIADHN C[C@@H](NC(=O)NCC1(N2CCSCC2)CCCC1)c1ccccc1OC(F)F ZINC000500400551 909836043 /nfs/dbraw/zinc/83/60/43/909836043.db2.gz TVVYCBYYFJECHF-OAHLLOKOSA-N 0 3 413.534 4.010 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N[C@H](c1ccccn1)c1ccccc1OC)c1ccco1 ZINC000500534485 909910985 /nfs/dbraw/zinc/91/09/85/909910985.db2.gz HKXFWPNYVBGAPP-WGGBDISSSA-N 0 3 422.529 4.201 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N[C@@H](c1ccccn1)c1ccccc1OC)c1ccco1 ZINC000500534483 909911375 /nfs/dbraw/zinc/91/13/75/909911375.db2.gz HKXFWPNYVBGAPP-KPDCDPCYSA-N 0 3 422.529 4.201 20 0 HIADHN C[C@@H]1[C@H](NC(=O)N[C@@H](C[C@H]2CCOC2)c2ccccc2)CCN1Cc1ccccc1 ZINC000500589509 909950244 /nfs/dbraw/zinc/95/02/44/909950244.db2.gz IBHDTDIQVZQOJX-LPHRJVMESA-N 0 3 407.558 4.117 20 0 HIADHN COC(=O)[C@H](CNC(=O)Nc1cccc(CN(C)C)c1)Cc1ccc2ccccc2c1 ZINC000500744054 910053994 /nfs/dbraw/zinc/05/39/94/910053994.db2.gz DJINCVYKAYJAIR-QFIPXVFZSA-N 0 3 419.525 4.055 20 0 HIADHN COc1ccc(CN(C)Cc2cn(C)nc2-c2ccc3c(c2)OCCCO3)cc1C ZINC000513095952 921545364 /nfs/dbraw/zinc/54/53/64/921545364.db2.gz RMIONQITKOMIOE-UHFFFAOYSA-N 0 3 407.514 4.197 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)c2ccc(-c3noc(C(F)F)n3)cc2)CN1Cc1ccccc1 ZINC000500855037 910127861 /nfs/dbraw/zinc/12/78/61/910127861.db2.gz CKMGOMJLEVLRRJ-KDOFPFPSSA-N 0 3 412.440 4.067 20 0 HIADHN CN1CCN(CCC(C)(C)NC(=O)c2csc(-c3ccc(Cl)cc3)c2)CC1 ZINC000500904002 910173908 /nfs/dbraw/zinc/17/39/08/910173908.db2.gz COFBQBOTBBAZLG-UHFFFAOYSA-N 0 3 405.995 4.214 20 0 HIADHN CN(C)[C@H](CNC(=O)NC[C@@H](c1cccc(Cl)c1)N1CCCC1)c1ccccc1 ZINC000501023035 910240671 /nfs/dbraw/zinc/24/06/71/910240671.db2.gz LTSFZAAVJNLJDQ-YADHBBJMSA-N 0 3 414.981 4.079 20 0 HIADHN Cc1nn(-c2ccc(Br)cc2)c(C)c1CN1CCC[C@@H](n2cccn2)C1 ZINC000513116840 921563312 /nfs/dbraw/zinc/56/33/12/921563312.db2.gz MAVYTMOEPDQQJB-LJQANCHMSA-N 0 3 414.351 4.285 20 0 HIADHN C[C@@]1(c2ccccc2)CCCN(C(=O)CCCN2CCN(c3ccccc3)CC2)C1 ZINC000501134832 910315096 /nfs/dbraw/zinc/31/50/96/910315096.db2.gz OHDIUHPDCSSBJX-AREMUKBSSA-N 0 3 405.586 4.169 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1ccc(CN2CCCC2=O)cc1)c1ccsc1 ZINC000501186147 910352948 /nfs/dbraw/zinc/35/29/48/910352948.db2.gz IUMINYKWFMJTBN-HXUWFJFHSA-N 0 3 414.575 4.075 20 0 HIADHN Cc1noc(CSc2ccccc2C(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)n1 ZINC000501228595 910387636 /nfs/dbraw/zinc/38/76/36/910387636.db2.gz OFINCRQTOWQKCR-LPHOPBHVSA-N 0 3 422.554 4.236 20 0 HIADHN Cc1[nH]nc2ncc(CN3CCC[C@@H](c4nc(-c5ccc(Cl)cc5)no4)C3)cc12 ZINC000513129606 921573667 /nfs/dbraw/zinc/57/36/67/921573667.db2.gz ZVOQTIOUYONZQF-MRXNPFEDSA-N 0 3 408.893 4.349 20 0 HIADHN CC1CCN([C@H](CNC(=O)C2(c3cccc(F)c3)CCOCC2)c2ccccc2)CC1 ZINC000501344812 910481362 /nfs/dbraw/zinc/48/13/62/910481362.db2.gz SGHRLRSQGCRTFZ-XMMPIXPASA-N 0 3 424.560 4.463 20 0 HIADHN CC[C@H](CNC(=O)N1CCC[C@@H]1c1ccc(OC)cc1)N1CCc2ccccc2C1 ZINC000501378830 910507170 /nfs/dbraw/zinc/50/71/70/910507170.db2.gz SPELEEYTRKDYEA-ISKFKSNPSA-N 0 3 407.558 4.379 20 0 HIADHN CC(C)(Oc1ccc(F)cc1)C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000501389610 910521157 /nfs/dbraw/zinc/52/11/57/910521157.db2.gz CKYSPINEGDRYGH-UHFFFAOYSA-N 0 3 402.535 4.213 20 0 HIADHN CCCN(CCN1CCCCC1)Cc1nnc(-c2ccccc2Br)o1 ZINC000513145032 921583258 /nfs/dbraw/zinc/58/32/58/921583258.db2.gz PIIMLXSYSUXFLP-UHFFFAOYSA-N 0 3 407.356 4.197 20 0 HIADHN O=C(CCc1ccc(OC(F)F)cc1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000501414724 910547844 /nfs/dbraw/zinc/54/78/44/910547844.db2.gz ARAWBTUBUXUHHT-UHFFFAOYSA-N 0 3 420.525 4.451 20 0 HIADHN COc1ccccc1N1CC[C@H](CNCc2c(F)ccc(Br)c2F)C1 ZINC000501449716 910576501 /nfs/dbraw/zinc/57/65/01/910576501.db2.gz ZQVBCFSUBYVZMV-CYBMUJFWSA-N 0 3 411.290 4.352 20 0 HIADHN O=C(NCc1nc(CN[C@H]2CCC[C@H](c3cccnc3)C2)cs1)c1ccccc1 ZINC000501474624 910590352 /nfs/dbraw/zinc/59/03/52/910590352.db2.gz QVSKGDHRZGIIMS-ICSRJNTNSA-N 0 3 406.555 4.284 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1cccc([C@@H]2CCCOC2)c1 ZINC000501495516 910609040 /nfs/dbraw/zinc/60/90/40/910609040.db2.gz ICTWAFZORVOBNU-HSZRJFAPSA-N 0 3 408.542 4.037 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N[C@@H]1CCO[C@H]1c1ccc(Cl)c(F)c1)c1ccco1 ZINC000501585910 910691376 /nfs/dbraw/zinc/69/13/76/910691376.db2.gz RKIDPOQEJNYULA-QHMHNIQBSA-N 0 3 423.916 4.331 20 0 HIADHN CNC(=O)CC[C@H]1CCCCN1CC(=O)N1CCC[C@H]1c1ccc(C(C)(C)C)cc1 ZINC000513177705 921602344 /nfs/dbraw/zinc/60/23/44/921602344.db2.gz IMGKIGLHQMMKGG-YADHBBJMSA-N 0 3 413.606 4.028 20 0 HIADHN Cc1ccc(OC2CCN(C(=O)NCCCN3CCc4ccccc4C3)CC2)cc1C ZINC000501710047 910778709 /nfs/dbraw/zinc/77/87/09/910778709.db2.gz NYMFXCRGZAPSII-UHFFFAOYSA-N 0 3 421.585 4.305 20 0 HIADHN CN(C)Cc1cccc(C(=O)N(Cc2nnc(-c3ccc(Cl)cc3)o2)C2CC2)c1 ZINC000501740500 910801395 /nfs/dbraw/zinc/80/13/95/910801395.db2.gz UZGNVDOUJPAYMB-UHFFFAOYSA-N 0 3 410.905 4.256 20 0 HIADHN C[C@H](c1ccccc1)N(C)C(=O)CN[C@]1(Cc2ccc(C(F)(F)F)cc2)CCOC1 ZINC000513181425 921606043 /nfs/dbraw/zinc/60/60/43/921606043.db2.gz AMRUGGVWMMSPPN-VGSWGCGISA-N 0 3 420.475 4.216 20 0 HIADHN CCCn1nc(C)c(CN2CCC[C@H](c3n[nH]cc3NC(=O)c3ccccc3)C2)c1C ZINC000501767941 910823439 /nfs/dbraw/zinc/82/34/39/910823439.db2.gz SXNVVWBFIZEFTM-FQEVSTJZSA-N 0 3 420.561 4.265 20 0 HIADHN O=C(Nc1ccccc1C(=O)N1CCCCC1)N[C@H](CN1CCCC1)c1ccccc1 ZINC000501796802 910848932 /nfs/dbraw/zinc/84/89/32/910848932.db2.gz HKZHPYMBEVBEDL-HSZRJFAPSA-N 0 3 420.557 4.271 20 0 HIADHN O=C(Nc1ccc(NC(=O)c2ccco2)cc1)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000501829255 910871045 /nfs/dbraw/zinc/87/10/45/910871045.db2.gz NBXQNYKYZQDFER-NRFANRHFSA-N 0 3 418.497 4.491 20 0 HIADHN COc1ccc2cc(CN(C)C(=O)CN[C@H](C)c3ccc4n[nH]cc4c3)ccc2c1 ZINC000513193124 921612940 /nfs/dbraw/zinc/61/29/40/921612940.db2.gz YOHNUHCQQWAVEJ-MRXNPFEDSA-N 0 3 402.498 4.034 20 0 HIADHN C[C@H](NC(=O)N[C@@H](CN1CCCC1)c1ccccc1)c1ccc(NC(=O)C2CC2)cc1 ZINC000501834880 910876359 /nfs/dbraw/zinc/87/63/59/910876359.db2.gz ZTDXPSUOXJQLTH-MBSDFSHPSA-N 0 3 420.557 4.232 20 0 HIADHN CCN(C(=O)c1cc(Br)cn1C)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000501952529 910940256 /nfs/dbraw/zinc/94/02/56/910940256.db2.gz FTQJLMMWAZLFOS-MAUKXSAKSA-N 0 3 404.352 4.085 20 0 HIADHN CN(C)Cc1cccc(C(=O)N2CCCN(c3ccc(Cl)c(Cl)c3)CC2)c1 ZINC000501966189 910951401 /nfs/dbraw/zinc/95/14/01/910951401.db2.gz ZOJYAZYYLNWKTH-UHFFFAOYSA-N 0 3 406.357 4.408 20 0 HIADHN C[C@H]1[C@H](NC(=O)NCc2cccc(-c3cccnc3)c2)CCN1Cc1ccccc1 ZINC000502145344 911068888 /nfs/dbraw/zinc/06/88/88/911068888.db2.gz FJGWUWQGJXOQTN-YADARESESA-N 0 3 400.526 4.211 20 0 HIADHN CC(C)(C)c1noc(-c2ccccc2C(=O)NC[C@@H]2CCCN2Cc2ccccc2)n1 ZINC000513218045 921633696 /nfs/dbraw/zinc/63/36/96/921633696.db2.gz NAHDNJOUEWWPPE-IBGZPJMESA-N 0 3 418.541 4.429 20 0 HIADHN CC[C@@H](C)n1ncc2c1nc(C)cc2C(=O)NC[C@H]1CCCN1Cc1ccccc1 ZINC000513223093 921637484 /nfs/dbraw/zinc/63/74/84/921637484.db2.gz KJTFGSSUWSSHOL-UYAOXDASSA-N 0 3 405.546 4.105 20 0 HIADHN OC1CCN(Cc2ccccc2NCc2c(F)ccc(Br)c2F)CC1 ZINC000502251777 911205872 /nfs/dbraw/zinc/20/58/72/911205872.db2.gz JVQPUIKPSKPZQZ-UHFFFAOYSA-N 0 3 411.290 4.296 20 0 HIADHN COc1cccc([C@@H](CNC(=O)C[C@@H](C)c2ccc(F)cc2F)N2CCCC2)c1 ZINC000502269637 911218026 /nfs/dbraw/zinc/21/80/26/911218026.db2.gz PIQXNKHSISCBEA-OPAMFIHVSA-N 0 3 402.485 4.420 20 0 HIADHN CCc1cc(OC)ccc1CN1CCCN(Cc2csc([C@@H](C)OC)n2)CC1 ZINC000502276812 911225627 /nfs/dbraw/zinc/22/56/27/911225627.db2.gz ACUHADBSANUYEN-QGZVFWFLSA-N 0 3 403.592 4.129 20 0 HIADHN COc1cc(C)c([C@H](C)NC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)cc1OC ZINC000502282100 911234119 /nfs/dbraw/zinc/23/41/19/911234119.db2.gz JCMNRASKWWXQDM-AZUAARDMSA-N 0 3 411.546 4.037 20 0 HIADHN Cc1ccc(NC(=O)CNC(C)(C)COc2ccc(C(F)(F)F)cn2)c(Cl)c1 ZINC000502290925 911244577 /nfs/dbraw/zinc/24/45/77/911244577.db2.gz OJMAYOPBLOAXRT-UHFFFAOYSA-N 0 3 415.843 4.448 20 0 HIADHN Cc1c(C(=O)NC[C@@H]2CCCN2Cc2ccccc2)cnn1-c1cccc(Cl)c1 ZINC000513233942 921646881 /nfs/dbraw/zinc/64/68/81/921646881.db2.gz QCTPSBWGCWBWOC-NRFANRHFSA-N 0 3 408.933 4.229 20 0 HIADHN Cc1noc(CSc2ccc(C(=O)NC[C@@H]3CCCN3Cc3ccccc3)cc2)n1 ZINC000513233426 921647199 /nfs/dbraw/zinc/64/71/99/921647199.db2.gz MCQRCTWFARBVFS-FQEVSTJZSA-N 0 3 422.554 4.065 20 0 HIADHN C[C@H](NC(=O)NCC(C)(C)N1CCc2ccccc2C1)c1ccc(OC(F)F)cc1 ZINC000502308714 911273346 /nfs/dbraw/zinc/27/33/46/911273346.db2.gz ITWYUMLABAVIPI-INIZCTEOSA-N 0 3 417.500 4.485 20 0 HIADHN O=C(Nc1c[nH]nc1[C@H]1CCCN(CCOC2CCCCCC2)C1)C1CCCC1 ZINC000502312199 911279310 /nfs/dbraw/zinc/27/93/10/911279310.db2.gz USUPRSUCSQYSOU-IBGZPJMESA-N 0 3 402.583 4.457 20 0 HIADHN O=C(Nc1c[nH]nc1[C@@H]1CCCN(CCOC2CCCCCC2)C1)C1CCCC1 ZINC000502312200 911279833 /nfs/dbraw/zinc/27/98/33/911279833.db2.gz USUPRSUCSQYSOU-LJQANCHMSA-N 0 3 402.583 4.457 20 0 HIADHN Cc1cccc(OCCN2CCC[C@@H](c3n[nH]cc3NC(=O)c3ccccc3)C2)c1 ZINC000502348967 911330195 /nfs/dbraw/zinc/33/01/95/911330195.db2.gz PZAGIBBVWSNTOL-HXUWFJFHSA-N 0 3 404.514 4.229 20 0 HIADHN CN1CCN(CCCNC(=O)N2CCC[C@H]2c2ccc(F)cc2)[C@@H](c2ccccc2)C1 ZINC000502353125 911333663 /nfs/dbraw/zinc/33/36/63/911333663.db2.gz JRUNURYKAMXTTK-BJKOFHAPSA-N 0 3 424.564 4.051 20 0 HIADHN CC(=O)Nc1c[nH]nc1[C@H]1CCCN([C@H]2CCCc3ccc(Br)cc32)C1 ZINC000502356861 911339254 /nfs/dbraw/zinc/33/92/54/911339254.db2.gz CSWSOCPACQOSJX-KXBFYZLASA-N 0 3 417.351 4.388 20 0 HIADHN C/C=C\COc1ccc(CC[C@@H](C)NCc2cc(S(C)(=O)=O)ccc2F)cc1 ZINC000502368826 911355030 /nfs/dbraw/zinc/35/50/30/911355030.db2.gz GPHBPDPZGFBPGV-VGOKWCNXSA-N 0 3 405.535 4.295 20 0 HIADHN Cc1oc(-c2cccs2)nc1CC(=O)N(CCCc1ccccc1)CCN(C)C ZINC000502374672 911360451 /nfs/dbraw/zinc/36/04/51/911360451.db2.gz ZLLGJEYDQVUYMJ-UHFFFAOYSA-N 0 3 411.571 4.277 20 0 HIADHN Cc1noc2nc(C(C)C)cc(C(=O)N(CCCc3ccccc3)CCN(C)C)c12 ZINC000502398609 911384513 /nfs/dbraw/zinc/38/45/13/911384513.db2.gz PTQWGLSAIDQCEJ-UHFFFAOYSA-N 0 3 408.546 4.291 20 0 HIADHN COCC[C@@H]1CCC[C@H]1N[C@H](c1cccc(S(C)(=O)=O)c1)c1ccc(F)c(F)c1 ZINC000502404595 911387582 /nfs/dbraw/zinc/38/75/82/911387582.db2.gz QOAMPKFGHHDXSD-ITEAAPOESA-N 0 3 423.525 4.253 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)NCc2ccc(C(F)(F)F)cc2C)cc1 ZINC000502420423 911399258 /nfs/dbraw/zinc/39/92/58/911399258.db2.gz ZMEOGFDPKVQCMM-LJQANCHMSA-N 0 3 409.452 4.125 20 0 HIADHN CC(C)[C@@H](N[C@@H](C)C(=O)N[C@H](C)c1ccc2c(c1)OCCO2)c1ccc(F)cc1 ZINC000502507319 911512151 /nfs/dbraw/zinc/51/21/51/911512151.db2.gz GTICGSRJCZHNAI-ZMPRRUGASA-N 0 3 400.494 4.150 20 0 HIADHN CCN(CC)[C@H](CNC(=O)[C@H]1Cc2ccccc2O1)c1ccc(C(F)(F)F)cc1 ZINC000502515626 911519496 /nfs/dbraw/zinc/51/94/96/911519496.db2.gz JSUHCHCURWXKFW-UYAOXDASSA-N 0 3 406.448 4.208 20 0 HIADHN Cc1cc(C)n(-c2ccc(C(=O)NC[C@@H]3CCCN3Cc3ccccc3)cc2F)n1 ZINC000513263917 921667948 /nfs/dbraw/zinc/66/79/48/921667948.db2.gz TVCAMVLPXQOORK-NRFANRHFSA-N 0 3 406.505 4.023 20 0 HIADHN CCOC(=O)c1c2c(sc1NC(=O)[C@H]1CCO[C@H](CC)C1)C(C)(C)NC(C)(C)C2 ZINC000502519088 911524206 /nfs/dbraw/zinc/52/42/06/911524206.db2.gz MAODJOBHHUZJRS-UONOGXRCSA-N 0 3 422.591 4.228 20 0 HIADHN COCCN1CCC(NC(=O)N[C@H](c2ccccc2)[C@H]2CCCc3ccccc32)CC1 ZINC000502564206 911570917 /nfs/dbraw/zinc/57/09/17/911570917.db2.gz UJVXKYGMJWTWIL-LOSJGSFVSA-N 0 3 421.585 4.258 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@H](C)N[C@H](c2ccc(F)cc2)C(C)C)cc1OC ZINC000502581898 911587884 /nfs/dbraw/zinc/58/78/84/911587884.db2.gz NSKVBUMNHSDRFY-AOMKIAJQSA-N 0 3 402.510 4.177 20 0 HIADHN O=C(CN[C@@H]1CCCC[C@H]1OC(F)F)Nc1c(Cl)cccc1C(F)(F)F ZINC000502593526 911594409 /nfs/dbraw/zinc/59/44/09/911594409.db2.gz IKLPBLXBDGIRKA-VXGBXAGGSA-N 0 3 400.775 4.437 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)c2cccc(Br)c2Cl)CC1 ZINC000502652457 911695582 /nfs/dbraw/zinc/69/55/82/911695582.db2.gz PDLKZVCZMQOMFK-UHFFFAOYSA-N 0 3 411.727 4.432 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)c3cc(Br)cs3)c2)CC1 ZINC000502869773 911875827 /nfs/dbraw/zinc/87/58/27/911875827.db2.gz PPFPNOBDYCVCNW-UHFFFAOYSA-N 0 3 408.365 4.293 20 0 HIADHN O=C(CCc1cc2ccccc2[nH]c1=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000502962957 911945119 /nfs/dbraw/zinc/94/51/19/911945119.db2.gz XREATBGKDWOFHD-UHFFFAOYSA-N 0 3 421.566 4.103 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)c1csc(Cc2cccc(F)c2)n1 ZINC000503068154 912034264 /nfs/dbraw/zinc/03/42/64/912034264.db2.gz JFLPMOJXRAFNOC-UHFFFAOYSA-N 0 3 415.509 4.216 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)c1csc(Cc2cccc(F)c2)n1 ZINC000503069402 912035254 /nfs/dbraw/zinc/03/52/54/912035254.db2.gz ROFVBSRFBDDZMI-UHFFFAOYSA-N 0 3 415.509 4.216 20 0 HIADHN Cc1nc(CCN2CCC(C(=O)Nc3ccc(Br)cc3)CC2)cs1 ZINC000503074318 912043803 /nfs/dbraw/zinc/04/38/03/912043803.db2.gz QVJUSCBDZQEQTA-UHFFFAOYSA-N 0 3 408.365 4.107 20 0 HIADHN Cc1nccn1CCCN(C)CC(=O)N1CCC[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000503076824 912047766 /nfs/dbraw/zinc/04/77/66/912047766.db2.gz RCIJJNRTHANYEA-IBGZPJMESA-N 0 3 409.361 4.184 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)N3C[C@@H](C)c4ccccc43)CC2)c1 ZINC000503203041 912182508 /nfs/dbraw/zinc/18/25/08/912182508.db2.gz APYCWJZODCCNDJ-OAQYLSRUSA-N 0 3 406.574 4.231 20 0 HIADHN COc1c(C)ccc(NC(=O)NCCCCN2CCN(c3cccc(C)c3)CC2)c1C ZINC000503218107 912200890 /nfs/dbraw/zinc/20/08/90/912200890.db2.gz QLDPHDRATFWNFL-UHFFFAOYSA-N 0 3 424.589 4.344 20 0 HIADHN Cc1cccc(NC(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)c1C(=O)N1CCCC1 ZINC000506281010 914882207 /nfs/dbraw/zinc/88/22/07/914882207.db2.gz KMRUPTQERNEAAM-TZIWHRDSSA-N 0 3 420.557 4.188 20 0 HIADHN CCN(CC)C(=O)c1ccc(NC(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)cc1 ZINC000506294326 914889689 /nfs/dbraw/zinc/88/96/89/914889689.db2.gz IVZLFEATRYMNFN-AVRDEDQJSA-N 0 3 408.546 4.126 20 0 HIADHN Cc1ncsc1CCN[C@H](c1ccc(C)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000506294958 914890678 /nfs/dbraw/zinc/89/06/78/914890678.db2.gz NJGFQSFQNPKSRC-OAQYLSRUSA-N 0 3 400.569 4.085 20 0 HIADHN CCN(Cc1ccccc1NC(=O)N[C@H]1CCN([C@H](C)c2ccccc2)C1)C(C)=O ZINC000506310512 914899962 /nfs/dbraw/zinc/89/99/62/914899962.db2.gz QZCRMAACHMCAEW-GCJKJVERSA-N 0 3 408.546 4.012 20 0 HIADHN Ic1ccccc1[C@H]1CCCN1CCCCCn1cccn1 ZINC000506475218 915075892 /nfs/dbraw/zinc/07/58/92/915075892.db2.gz TWVJUBJYFFFTMZ-GOSISDBHSA-N 0 3 409.315 4.495 20 0 HIADHN COc1ccc(Br)c(NC(=O)NC[C@H](c2cccs2)N2CCCC2)c1 ZINC000506510679 915135922 /nfs/dbraw/zinc/13/59/22/915135922.db2.gz HORPIIFLHPNHPA-MRXNPFEDSA-N 0 3 424.364 4.478 20 0 HIADHN CCOc1cc(Cl)ccc1CNC(=O)N(Cc1ccco1)C1CCN(C)CC1 ZINC000506573102 915221428 /nfs/dbraw/zinc/22/14/28/915221428.db2.gz JTKZWBQUINIVTL-UHFFFAOYSA-N 0 3 405.926 4.138 20 0 HIADHN FC(F)(F)COCCCN1CCC[C@H]1c1ccccc1I ZINC000506591160 915240972 /nfs/dbraw/zinc/24/09/72/915240972.db2.gz GELFSWJKBYXTEQ-AWEZNQCLSA-N 0 3 413.221 4.397 20 0 HIADHN CC[C@H](N[C@@H](C)C(=O)N1CCSc2ccccc21)c1ccc(OC)c(OC)c1 ZINC000506601900 915256169 /nfs/dbraw/zinc/25/61/69/915256169.db2.gz MQJZWRDBETVGGY-RDJZCZTQSA-N 0 3 400.544 4.272 20 0 HIADHN COc1ccccc1O[C@@H]1CCCN(CCC(=O)Nc2ccccc2SC)C1 ZINC000513387079 921760288 /nfs/dbraw/zinc/76/02/88/921760288.db2.gz VJLBGSJYDHGZMX-QGZVFWFLSA-N 0 3 400.544 4.289 20 0 HIADHN CCCN(C(=O)NC[C@H](C)c1c(C)noc1C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000506644904 915314519 /nfs/dbraw/zinc/31/45/19/915314519.db2.gz FLTRVBSGIVKGMX-AVRDEDQJSA-N 0 3 412.578 4.481 20 0 HIADHN CCCNC(=O)C1CCN(Cc2ccc(Oc3cc(OC)cc(OC)c3)cc2)CC1 ZINC000506668268 915345460 /nfs/dbraw/zinc/34/54/60/915345460.db2.gz HZLWQJHOBXXEHK-UHFFFAOYSA-N 0 3 412.530 4.234 20 0 HIADHN Cc1noc([C@@H]2CCCCN2C(=O)NC[C@H](c2ccc(CC(C)C)cc2)N(C)C)n1 ZINC000513396166 921766095 /nfs/dbraw/zinc/76/60/95/921766095.db2.gz PHZIZFNELUKTAF-LEWJYISDSA-N 0 3 413.566 4.116 20 0 HIADHN CN(Cc1c[nH]nc1-c1ccc2c(c1)OCCO2)Cc1ccc(Br)cc1 ZINC000506748662 915439306 /nfs/dbraw/zinc/43/93/06/915439306.db2.gz UVFDUMSWSNKCEE-UHFFFAOYSA-N 0 3 414.303 4.242 20 0 HIADHN CCCCCNC(=O)C1CCN(Cc2c(C)nn(Cc3ccc(C)cc3)c2C)CC1 ZINC000506892068 915687612 /nfs/dbraw/zinc/68/76/12/915687612.db2.gz DNGSFTUKPVCHBY-UHFFFAOYSA-N 0 3 410.606 4.375 20 0 HIADHN Cc1ccc(-c2n[nH]cc2CN2CCC(C(=O)NCc3ccc(F)cc3)CC2)cc1 ZINC000507014476 915822271 /nfs/dbraw/zinc/82/22/71/915822271.db2.gz WJAVUVLLJNZQMD-UHFFFAOYSA-N 0 3 406.505 4.053 20 0 HIADHN O=C(NCCN1CCCCC1)[C@@H](Oc1ccccc1Br)c1ccccc1 ZINC000507038058 915835408 /nfs/dbraw/zinc/83/54/08/915835408.db2.gz VLCURTACUOZAEB-FQEVSTJZSA-N 0 3 417.347 4.171 20 0 HIADHN CCN(CC)[C@H](CNC(=O)CSc1nc2ccccc2n1CC)c1ccsc1 ZINC000507051425 915842216 /nfs/dbraw/zinc/84/22/16/915842216.db2.gz JEMQKPPOGYDHJK-LJQANCHMSA-N 0 3 416.616 4.409 20 0 HIADHN COc1ccc(-c2nc(C)c([C@H](C)NC(=O)N(CCN(C)C)CC(C)C)s2)cc1 ZINC000507077197 915856291 /nfs/dbraw/zinc/85/62/91/915856291.db2.gz LNPAWXIXOUFLPC-KRWDZBQOSA-N 0 3 418.607 4.417 20 0 HIADHN CCCN(C(=O)NC[C@@H](c1ccccc1)N(C)C)[C@H](C)CC(=O)Nc1ccccc1 ZINC000507087369 915861500 /nfs/dbraw/zinc/86/15/00/915861500.db2.gz JZGYWZFAXUMPON-KNQAVFIVSA-N 0 3 410.562 4.128 20 0 HIADHN CCCN(C(=O)NC[C@@H](c1ccccc1)N(C)C)[C@@H](C)CC(=O)Nc1ccccc1 ZINC000507087373 915861628 /nfs/dbraw/zinc/86/16/28/915861628.db2.gz JZGYWZFAXUMPON-UGKGYDQZSA-N 0 3 410.562 4.128 20 0 HIADHN COc1cc(CN(Cc2cccc(Cl)c2)C(C)C)cc(Cl)c1OCC(N)=O ZINC000507119496 915877432 /nfs/dbraw/zinc/87/74/32/915877432.db2.gz HVPMKKOMDGXABL-UHFFFAOYSA-N 0 3 411.329 4.277 20 0 HIADHN Cc1cc(C(=O)N2CCCN(CCCc3ccccc3)CC2)c2c(n1)onc2C(C)C ZINC000507125121 915879661 /nfs/dbraw/zinc/87/96/61/915879661.db2.gz GCJDZOOUCCAFOE-UHFFFAOYSA-N 0 3 420.557 4.435 20 0 HIADHN CCOCCCNC(=O)C1CCN(Cc2c(OC(F)F)ccc3ccccc32)CC1 ZINC000507131638 915882049 /nfs/dbraw/zinc/88/20/49/915882049.db2.gz DICZINDANXDCDY-UHFFFAOYSA-N 0 3 420.500 4.196 20 0 HIADHN O=C(c1cccn1Cc1cccs1)N1CCCN(CCCc2ccccc2)CC1 ZINC000507150913 915892680 /nfs/dbraw/zinc/89/26/80/915892680.db2.gz WGJWVHBIFQPAMU-UHFFFAOYSA-N 0 3 407.583 4.379 20 0 HIADHN COCCN(Cc1cn(-c2ccccc2)nc1-c1cc(OC)ccc1OC)C1CC1 ZINC000507162838 915900639 /nfs/dbraw/zinc/90/06/39/915900639.db2.gz WLHHERNDLGWZRU-UHFFFAOYSA-N 0 3 407.514 4.167 20 0 HIADHN O=C(N[C@H](c1nccs1)c1ccccc1)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000507322033 916084505 /nfs/dbraw/zinc/08/45/05/916084505.db2.gz ZBPOLQFLXJUVOW-RTWAWAEBSA-N 0 3 406.555 4.196 20 0 HIADHN Cc1cc(N2CCCCCC2)ccc1NC(=O)C(=O)Nc1cccc(CN(C)C)c1 ZINC000507421654 916192340 /nfs/dbraw/zinc/19/23/40/916192340.db2.gz OIDMNFMQQCRXSN-UHFFFAOYSA-N 0 3 408.546 4.014 20 0 HIADHN CC[C@@H](CSc1ccccc1)NC(=O)N(Cc1ccco1)C1CCN(C)CC1 ZINC000507436413 916207393 /nfs/dbraw/zinc/20/73/93/916207393.db2.gz URSQUDZRMPHBDB-SFHVURJKSA-N 0 3 401.576 4.456 20 0 HIADHN CCCN1CCN(c2ccccc2CN(C)CC(=O)Nc2c(C)cc(C)cc2C)CC1 ZINC000507462660 916230764 /nfs/dbraw/zinc/23/07/64/916230764.db2.gz ZTCNAGPAEGRESW-UHFFFAOYSA-N 0 3 422.617 4.214 20 0 HIADHN Cc1nc(-c2ccc(Br)cc2)sc1[C@H](C)N[C@H]1CCCCNC1=O ZINC000507482355 916248934 /nfs/dbraw/zinc/24/89/34/916248934.db2.gz QSALJHKDWHHCFY-NHYWBVRUSA-N 0 3 408.365 4.200 20 0 HIADHN COc1ccc(OC)c([C@@H](C)NC(=O)[C@@H](C)N[C@H](C)c2ccc(SC)cc2)c1 ZINC000507486846 916253991 /nfs/dbraw/zinc/25/39/91/916253991.db2.gz PUMVZRQSQCKMJW-BZUAXINKSA-N 0 3 402.560 4.342 20 0 HIADHN CCOC(=O)C1CCN(C(=O)[C@@H](C)N[C@@H](C)c2ccc(SC(C)C)cc2)CC1 ZINC000507487852 916254240 /nfs/dbraw/zinc/25/42/40/916254240.db2.gz SKXOZMSPAWYMAL-DLBZAZTESA-N 0 3 406.592 4.028 20 0 HIADHN COc1cccc(NC(=O)[C@H](NCCc2ccc(NC(C)=O)cc2)c2ccccc2)c1 ZINC000507506004 916270352 /nfs/dbraw/zinc/27/03/52/916270352.db2.gz MGVZYUFCOXRRMP-XMMPIXPASA-N 0 3 417.509 4.166 20 0 HIADHN COCCSc1ccc([C@H](C)N[C@@H](C)C(=O)N(C)Cc2ccccc2C)cc1 ZINC000507567038 916323318 /nfs/dbraw/zinc/32/33/18/916323318.db2.gz MLZRSALVUFZWSC-OALUTQOASA-N 0 3 400.588 4.431 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1[C@H]1OCC[C@@H]1C(=O)Nc1cccc(CN(C)C)c1 ZINC000507566304 916323453 /nfs/dbraw/zinc/32/34/53/916323453.db2.gz IIDCCTKIIVZIFW-UPVQGACJSA-N 0 3 418.541 4.267 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)CO[C@H]3CCCC[C@@H]3C)c(OCC)c2)CC1 ZINC000507605339 916361055 /nfs/dbraw/zinc/36/10/55/916361055.db2.gz JXIVYXVQADKLNK-UGKGYDQZSA-N 0 3 417.594 4.151 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)C[C@H]3CCO[C@H](CC)C3)c(OCC)c2)CC1 ZINC000507605555 916362586 /nfs/dbraw/zinc/36/25/86/916362586.db2.gz YKXXDLXHTYGKAS-PZJWPPBQSA-N 0 3 417.594 4.151 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3cncc4ccccc43)c(OCC)c2)CC1 ZINC000507612179 916370487 /nfs/dbraw/zinc/37/04/87/916370487.db2.gz YTHABLVHNDTXCW-UHFFFAOYSA-N 0 3 418.541 4.418 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)c2cc3cc(Br)ccc3[nH]2)C1 ZINC000507614822 916372057 /nfs/dbraw/zinc/37/20/57/916372057.db2.gz WSLQOOCLEOKAAL-KSSFIOAISA-N 0 3 412.331 4.496 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)c2ccc(OCc3ccncc3)cc2)C1 ZINC000507615683 916374514 /nfs/dbraw/zinc/37/45/14/916374514.db2.gz ZLXAGYVHDVWAPT-AUSIDOKSSA-N 0 3 401.510 4.226 20 0 HIADHN CCc1ccc([C@@H](NCC[C@H]2CCCCO2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000507618087 916375153 /nfs/dbraw/zinc/37/51/53/916375153.db2.gz IADUQWGAWBMTHC-FYYLOGMGSA-N 0 3 401.572 4.291 20 0 HIADHN C[C@@H](C(=O)N(C)Cc1cccc(F)c1)N(C)CCCc1cc(-c2ccccc2)n[nH]1 ZINC000507646361 916403976 /nfs/dbraw/zinc/40/39/76/916403976.db2.gz XEBNBRSRDPUKJA-SFHVURJKSA-N 0 3 408.521 4.127 20 0 HIADHN Cc1noc(C2CCN(C[C@H](O)CO[C@H](c3ccccc3)c3ccc(C)cc3)CC2)n1 ZINC000507717470 916510569 /nfs/dbraw/zinc/51/05/69/916510569.db2.gz JSDLYONZCXPCCX-BJKOFHAPSA-N 0 3 421.541 4.033 20 0 HIADHN CC[C@H]1C[C@H](CN2CCN(Cc3csc(-c4ccc(F)cc4)n3)CC2)CCO1 ZINC000507802838 916588513 /nfs/dbraw/zinc/58/85/13/916588513.db2.gz IMBMEEKXOQOCMU-UTKZUKDTSA-N 0 3 403.567 4.272 20 0 HIADHN CCN(CC)[C@@H](CN[C@H](c1nccn1C)c1cccc(F)c1)c1cccc(OC)c1 ZINC000507808886 916597232 /nfs/dbraw/zinc/59/72/32/916597232.db2.gz XAHJYONSVQOTPD-GOTSBHOMSA-N 0 3 410.537 4.330 20 0 HIADHN CC(C)[C@H](CN[C@@H](c1nccn1C)c1cccc(F)c1)N1CCc2ccccc2C1 ZINC000507812977 916605440 /nfs/dbraw/zinc/60/54/40/916605440.db2.gz IXQJOKOSBRDASH-BJKOFHAPSA-N 0 3 406.549 4.321 20 0 HIADHN CC(C)Sc1cc(Br)ccc1CN1CC[C@H](CN2CCOCC2)C1 ZINC000507817401 916610681 /nfs/dbraw/zinc/61/06/81/916610681.db2.gz ZCJAKEXOPPGDJE-MRXNPFEDSA-N 0 3 413.425 4.104 20 0 HIADHN CN1C(=O)C[C@H](NCc2cccc(OCc3ccccn3)c2)[C@@H]1c1ccc(Cl)cc1 ZINC000507818825 916616172 /nfs/dbraw/zinc/61/61/72/916616172.db2.gz JYBVIWGCHJLUDQ-UPVQGACJSA-N 0 3 421.928 4.376 20 0 HIADHN c1ncn(Cc2ccc(-c3ccccc3CNCc3cccc4c3OCCO4)cc2)n1 ZINC000507847707 916664519 /nfs/dbraw/zinc/66/45/19/916664519.db2.gz YHOMIHNZTKKVLT-UHFFFAOYSA-N 0 3 412.493 4.054 20 0 HIADHN c1ncn(Cc2ccc(-c3ccccc3CNCc3cnn(-c4ccccc4)c3)cc2)n1 ZINC000507853270 916675514 /nfs/dbraw/zinc/67/55/14/916675514.db2.gz UJYNLKNEADTTKS-UHFFFAOYSA-N 0 3 420.520 4.469 20 0 HIADHN COc1ccc(CNCc2ccccc2-c2ccc(Cn3cncn3)cc2)c(OC)c1 ZINC000507860809 916690092 /nfs/dbraw/zinc/69/00/92/916690092.db2.gz PZRYTUNYSKREFN-UHFFFAOYSA-N 0 3 414.509 4.300 20 0 HIADHN Fc1ccc(-c2nnc3n2C[C@@H](NCc2cc(C(F)(F)F)ccc2F)CC3)cc1 ZINC000507874188 916711795 /nfs/dbraw/zinc/71/17/95/916711795.db2.gz JLSILNMMENBFQE-INIZCTEOSA-N 0 3 408.374 4.347 20 0 HIADHN Fc1ccc(-c2nnc3n2C[C@@H](NCc2ccc(Br)cc2F)CC3)cc1 ZINC000507883455 916725667 /nfs/dbraw/zinc/72/56/67/916725667.db2.gz ZSCPBKKYFSZYFY-INIZCTEOSA-N 0 3 419.273 4.090 20 0 HIADHN COc1ccc(-c2noc([C@H]3CN(Cc4ccccc4)CCC3(F)F)n2)cc1OC ZINC000507995748 916836571 /nfs/dbraw/zinc/83/65/71/916836571.db2.gz XFQUWSJVNDDAKH-QGZVFWFLSA-N 0 3 415.440 4.379 20 0 HIADHN Cc1ccc(NC(=O)[C@@H]2CCCN(Cc3c[nH]nc3-c3cccc(Cl)c3)C2)nc1 ZINC000508007549 916847718 /nfs/dbraw/zinc/84/77/18/916847718.db2.gz DROLZXDRLRMMDP-QGZVFWFLSA-N 0 3 409.921 4.284 20 0 HIADHN COc1ccc(S[C@@H](C)C(=O)Nc2cccc(CN3CCC(CO)CC3)c2)cc1 ZINC000508069114 916891826 /nfs/dbraw/zinc/89/18/26/916891826.db2.gz HEWDFHLLWCNCEF-KRWDZBQOSA-N 0 3 414.571 4.019 20 0 HIADHN COCc1c(Br)cccc1NC(=O)NC[C@@H](c1ccccc1)N(C)C ZINC000508176852 916996093 /nfs/dbraw/zinc/99/60/93/916996093.db2.gz MSDHSQKNEBATAE-SFHVURJKSA-N 0 3 406.324 4.020 20 0 HIADHN Cn1c(=O)oc2cc(CN(CCCO)C(c3ccccc3)c3ccccc3)ccc21 ZINC000508191306 917012259 /nfs/dbraw/zinc/01/22/59/917012259.db2.gz ODOGGYAFDVHHAL-UHFFFAOYSA-N 0 3 402.494 4.106 20 0 HIADHN Cc1c2cccc(Cl)c2sc1CN1CCC(CC(=O)N2CCN(C)CC2)CC1 ZINC000508257565 917074484 /nfs/dbraw/zinc/07/44/84/917074484.db2.gz OMVXWUSLYNFMBP-UHFFFAOYSA-N 0 3 420.022 4.239 20 0 HIADHN CN(C)C(=O)Nc1ccc(C(=O)NCCN2CCC3(CCCCC3)CC2)c(Cl)c1 ZINC000508302591 917111333 /nfs/dbraw/zinc/11/13/33/917111333.db2.gz UADRHUQVVCFGOX-UHFFFAOYSA-N 0 3 420.985 4.210 20 0 HIADHN Cn1c(CSc2ccc(Cl)cc2)nnc1N1CCN(C2CCCCC2)CC1 ZINC000508443819 917229581 /nfs/dbraw/zinc/22/95/81/917229581.db2.gz RVEMIMAHIUZFLO-UHFFFAOYSA-N 0 3 405.999 4.216 20 0 HIADHN CN(C(=O)c1ccc(NCc2cscc2Br)cc1)[C@@H]1CCCN(C)C1 ZINC000508505735 917291572 /nfs/dbraw/zinc/29/15/72/917291572.db2.gz QIYMILFGMHRPIU-QGZVFWFLSA-N 0 3 422.392 4.289 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N2CCC(n3cc(Cl)cn3)CC2)N2CCCC2)cc1 ZINC000508546708 917325310 /nfs/dbraw/zinc/32/53/10/917325310.db2.gz ITKVELBOWGUPAI-NRFANRHFSA-N 0 3 415.969 4.029 20 0 HIADHN Cc1cccc(-c2nn(-c3ccc(F)cc3)cc2CN(C)CCc2cnccn2)c1 ZINC000508680831 917443891 /nfs/dbraw/zinc/44/38/91/917443891.db2.gz UDJARIQWKVYNGX-UHFFFAOYSA-N 0 3 401.489 4.451 20 0 HIADHN Clc1cccc([C@@H](Cc2cccnc2)NCc2ccccc2Cn2cncn2)c1 ZINC000508735656 917494852 /nfs/dbraw/zinc/49/48/52/917494852.db2.gz XATJRNLCZVXCBC-HSZRJFAPSA-N 0 3 403.917 4.448 20 0 HIADHN CC(=O)Nc1cccc(NC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)c1C ZINC000508805104 917560496 /nfs/dbraw/zinc/56/04/96/917560496.db2.gz XJKNTUHIVYWLNV-OAQYLSRUSA-N 0 3 419.447 4.347 20 0 HIADHN C[C@H](NC(=O)N(C)Cc1ccc(Br)s1)[C@H](c1ccccc1)N(C)C ZINC000508851436 917604663 /nfs/dbraw/zinc/60/46/63/917604663.db2.gz HGJDIRRWJZRDSE-SUMWQHHRSA-N 0 3 410.381 4.343 20 0 HIADHN C[C@H](NC(=O)N(Cc1cccs1)C[C@H]1CCCO1)[C@H](c1ccccc1)N(C)C ZINC000508852892 917605717 /nfs/dbraw/zinc/60/57/17/917605717.db2.gz OLBVUAONZUMBNZ-FBBABVLZSA-N 0 3 401.576 4.130 20 0 HIADHN C[C@H](NC(=O)N(Cc1cccs1)C[C@H]1CCCO1)[C@@H](c1ccccc1)N(C)C ZINC000508852891 917605964 /nfs/dbraw/zinc/60/59/64/917605964.db2.gz OLBVUAONZUMBNZ-DSKINZAPSA-N 0 3 401.576 4.130 20 0 HIADHN C[C@@H](NC(=O)NC(C)(C)c1nc(C(F)(F)F)cs1)[C@H](c1ccccc1)N(C)C ZINC000508856675 917609696 /nfs/dbraw/zinc/60/96/96/917609696.db2.gz VZFPTFOIAGPVSX-IUODEOHRSA-N 0 3 414.497 4.388 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)c(C(F)(F)F)c1 ZINC000508876577 917630790 /nfs/dbraw/zinc/63/07/90/917630790.db2.gz DGKIUDKVSIMZOM-BFUOFWGJSA-N 0 3 422.451 4.477 20 0 HIADHN C[C@@H](NC(=O)N(C)Cc1csc(Br)c1)[C@H](c1ccccc1)N(C)C ZINC000508896559 917651264 /nfs/dbraw/zinc/65/12/64/917651264.db2.gz IEERTWUQQJFQOT-CXAGYDPISA-N 0 3 410.381 4.343 20 0 HIADHN C[C@@H](NC(=O)N(C)Cc1ccccc1Br)[C@H](c1ccccc1)N(C)C ZINC000508898518 917655121 /nfs/dbraw/zinc/65/51/21/917655121.db2.gz LQVZAZCQWBIKCW-DNVCBOLYSA-N 0 3 404.352 4.282 20 0 HIADHN C[C@H](NC(=O)N(C)[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1)[C@H](c1ccccc1)N(C)C ZINC000508901218 917656624 /nfs/dbraw/zinc/65/66/24/917656624.db2.gz BCXRYLWSAVWELP-XCYUPCBOSA-N 0 3 413.537 4.379 20 0 HIADHN O=C(NCc1ccc(Cl)s1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000508941568 917698710 /nfs/dbraw/zinc/69/87/10/917698710.db2.gz IPDDENJZBYUPKM-KRWDZBQOSA-N 0 3 402.869 4.472 20 0 HIADHN COCc1ccccc1/C=C(\C)CN1CCc2cc(OC)c(OC)c(OC)c2CC1 ZINC000508969927 917725129 /nfs/dbraw/zinc/72/51/29/917725129.db2.gz ZJNGJTVLQBIYCF-NBVRZTHBSA-N 0 3 411.542 4.363 20 0 HIADHN CCOc1cccc(CNC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)c1 ZINC000508974121 917728875 /nfs/dbraw/zinc/72/88/75/917728875.db2.gz AVLGUBJECSEMMU-OAQYLSRUSA-N 0 3 406.448 4.156 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)N1CCCC2(CCOCC2)C1)c1ccc(Cl)cc1 ZINC000509039660 917794092 /nfs/dbraw/zinc/79/40/92/917794092.db2.gz QFPCQCCOXSJDLB-FQEVSTJZSA-N 0 3 407.986 4.325 20 0 HIADHN CCCN(C)[C@H](CNC(=O)N1CCCC[C@H]1c1nc(C)no1)c1ccc(Cl)cc1 ZINC000509041360 917795266 /nfs/dbraw/zinc/79/52/66/917795266.db2.gz VRTBUNQKDADHCY-RBUKOAKNSA-N 0 3 419.957 4.351 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)N1CCCC[C@H]1c1nc(C)no1)c1ccc(Cl)cc1 ZINC000509041359 917795798 /nfs/dbraw/zinc/79/57/98/917795798.db2.gz VRTBUNQKDADHCY-OALUTQOASA-N 0 3 419.957 4.351 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1ccccc1Oc1cnn(C)c1)c1cccc(OC)c1 ZINC000509127520 917859741 /nfs/dbraw/zinc/85/97/41/917859741.db2.gz XZPKJFYVADBLIJ-QFIPXVFZSA-N 0 3 422.529 4.034 20 0 HIADHN O=C(NCc1nccc2ccccc21)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000509334857 918003696 /nfs/dbraw/zinc/00/36/96/918003696.db2.gz NSBBZQGWDDWUDW-JOCHJYFZSA-N 0 3 413.443 4.306 20 0 HIADHN COc1ccc(C(=O)CCN2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)cc1 ZINC000509341182 918007513 /nfs/dbraw/zinc/00/75/13/918007513.db2.gz IIZRNHMPGBIWSN-UHFFFAOYSA-N 0 3 418.896 4.411 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)N[C@H](c1nccs1)c1ccccc1 ZINC000509346982 918012566 /nfs/dbraw/zinc/01/25/66/918012566.db2.gz ZWXJJSNXXLIOGQ-SFTDATJTSA-N 0 3 406.555 4.369 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)N1CCO[C@@H](c2ccccc2Cl)C1 ZINC000509348395 918013361 /nfs/dbraw/zinc/01/33/61/918013361.db2.gz OPEVVDGRIYKVLE-FCHUYYIVSA-N 0 3 413.949 4.260 20 0 HIADHN CCOc1cc(CN2CCC(c3nncn3C)CC2)ccc1OCc1ccccc1 ZINC000509390894 918056341 /nfs/dbraw/zinc/05/63/41/918056341.db2.gz WYWHKAVSXPGFPM-UHFFFAOYSA-N 0 3 406.530 4.172 20 0 HIADHN Cn1cnnc1C1CCN(Cc2ccc(-c3cccc(Br)c3)o2)CC1 ZINC000509402513 918067502 /nfs/dbraw/zinc/06/75/02/918067502.db2.gz NFPGCGGBZZWPSS-UHFFFAOYSA-N 0 3 401.308 4.217 20 0 HIADHN CCOc1ccccc1CN(C)C(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000509404556 918069555 /nfs/dbraw/zinc/06/95/55/918069555.db2.gz OCGOVAXSJSVKOT-JOCHJYFZSA-N 0 3 420.475 4.498 20 0 HIADHN O=C([C@@H]1CCC[C@@H]2CCCC[C@H]12)N1CCC[C@H](CN2CCN(c3ccccn3)CC2)C1 ZINC000509519743 918169118 /nfs/dbraw/zinc/16/91/18/918169118.db2.gz MAMMPLVTZMCIES-NAVOZUGXSA-N 0 3 424.633 4.049 20 0 HIADHN CN(C)C(=O)COc1ccccc1CN1CC=C(c2c[nH]c3cc(F)ccc32)CC1 ZINC000509538330 918186889 /nfs/dbraw/zinc/18/68/89/918186889.db2.gz FHPKFLITRSZCIP-UHFFFAOYSA-N 0 3 407.489 4.063 20 0 HIADHN COc1ccccc1NC(=O)C1CCN(Cc2c[nH]nc2-c2ccc(C)cc2)CC1 ZINC000509548977 918198973 /nfs/dbraw/zinc/19/89/73/918198973.db2.gz LEVCYILOFWMKLM-UHFFFAOYSA-N 0 3 404.514 4.244 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(C)c1CN1CCC(C(=O)N2CCC[C@@H](C)C2)CC1 ZINC000509554984 918205214 /nfs/dbraw/zinc/20/52/14/918205214.db2.gz IJSNMHAEYRWDDI-QGZVFWFLSA-N 0 3 412.553 4.099 20 0 HIADHN CC(C)Cc1cccc([C@@H](C)C(=O)Nc2ccccc2CN2CCC[C@@H](C(N)=O)C2)c1 ZINC000509563439 918212190 /nfs/dbraw/zinc/21/21/90/918212190.db2.gz GQPIULACWCSWBN-AUSIDOKSSA-N 0 3 421.585 4.325 20 0 HIADHN C[C@@H]1CCCN(C(=O)C2CCN(Cc3c[nH]nc3-c3ccc(Cl)cc3)CC2)C1 ZINC000509563614 918213169 /nfs/dbraw/zinc/21/31/69/918213169.db2.gz HQUXHBRSTFRTSF-MRXNPFEDSA-N 0 3 400.954 4.201 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N(Cc1cccs1)C[C@H]1CCCO1)c1ccco1 ZINC000509565773 918215865 /nfs/dbraw/zinc/21/58/65/918215865.db2.gz BCPIAMMGOSQDMF-YQVWRLOYSA-N 0 3 405.564 4.161 20 0 HIADHN CCOc1cc(CN(CC)[C@@H](C)c2cccc(O)c2)ccc1O[C@@H](C)C(=O)N(C)C ZINC000509579835 918228354 /nfs/dbraw/zinc/22/83/54/918228354.db2.gz NSEZVSDRJIPDDB-ROUUACIJSA-N 0 3 414.546 4.230 20 0 HIADHN COc1ccc(C[C@@H](NCc2cnn(CC(F)F)c2)c2ccc(OC)cc2)cc1 ZINC000509583565 918232506 /nfs/dbraw/zinc/23/25/06/918232506.db2.gz LAISRGQLNCPBPM-OAQYLSRUSA-N 0 3 401.457 4.239 20 0 HIADHN CCN1CCC[C@@H](CN(C)c2nc(C)nc3sc4c(c32)CCC4)[C@@H]1c1cnn(C)c1 ZINC000509616657 918264665 /nfs/dbraw/zinc/26/46/65/918264665.db2.gz HSHOWXPGLNTCCY-HRAATJIYSA-N 0 3 424.618 4.131 20 0 HIADHN c1csc([C@H](CNCc2ccc(Sc3ccccn3)o2)N2CCOCC2)c1 ZINC000509638021 918281238 /nfs/dbraw/zinc/28/12/38/918281238.db2.gz BATOYCUCENZLGQ-KRWDZBQOSA-N 0 3 401.557 4.050 20 0 HIADHN CN1CCCN(C(=O)c2cn(CCOc3ccccc3Cl)c3ccccc23)CC1 ZINC000509642646 918282438 /nfs/dbraw/zinc/28/24/38/918282438.db2.gz YNNNAUOQRYUDMT-UHFFFAOYSA-N 0 3 411.933 4.151 20 0 HIADHN CC[C@H](CNC(=O)c1c[nH]cc1-c1cccc(OC)c1)N1CCc2ccccc2C1 ZINC000509700421 918331025 /nfs/dbraw/zinc/33/10/25/918331025.db2.gz KHZDOLBVPKJLTC-OAQYLSRUSA-N 0 3 403.526 4.257 20 0 HIADHN COCCN(C)CCNC(=O)N(Cc1ccc(-c2cccc(F)c2)s1)C(C)C ZINC000509712462 918341099 /nfs/dbraw/zinc/34/10/99/918341099.db2.gz MFUUEEDABMUMGB-UHFFFAOYSA-N 0 3 407.555 4.052 20 0 HIADHN CC[C@H](CNC(=O)N[C@@H](C[C@@H]1CCOC1)c1ccccc1)N1CCc2ccccc2C1 ZINC000509752889 918370832 /nfs/dbraw/zinc/37/08/32/918370832.db2.gz WDEPZRYHJPJRJH-AMDXRBSFSA-N 0 3 421.585 4.290 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1c2ccccc2nc2c1CN(C)CC2)c1ccsc1 ZINC000509812242 918415415 /nfs/dbraw/zinc/41/54/15/918415415.db2.gz SKUNVCRYMKZBNZ-QFIPXVFZSA-N 0 3 422.598 4.097 20 0 HIADHN CN(C)CCN(C(=O)c1cnn(-c2ccc(C(F)(F)F)cc2)c1)c1ccccc1 ZINC000509820761 918422444 /nfs/dbraw/zinc/42/24/44/918422444.db2.gz QUTFYCGYERFJDO-UHFFFAOYSA-N 0 3 402.420 4.100 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)NCC3([NH+]4CCCCC4)CCCCC3)cc2)cc(=O)[n-]1 ZINC000509872758 918473694 /nfs/dbraw/zinc/47/36/94/918473694.db2.gz XQOAISIBTFXABR-UHFFFAOYSA-N 0 3 423.561 4.468 20 0 HIADHN CC(C)CN(C(=O)c1nc(-c2cccs2)n(-c2ccccc2)n1)C1CCN(C)CC1 ZINC000509923270 918522906 /nfs/dbraw/zinc/52/29/06/918522906.db2.gz ICMUPEGYEGPWAG-UHFFFAOYSA-N 0 3 423.586 4.188 20 0 HIADHN Cc1ccc2sc(N(Cc3ccccc3)C(=O)CN3CCCN(C)CC3)nc2c1C ZINC000509929552 918529127 /nfs/dbraw/zinc/52/91/27/918529127.db2.gz URLRDAPUPBKENI-UHFFFAOYSA-N 0 3 422.598 4.084 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)c(C)c1CC(=O)N(CC(C)C)C1CCN(C)CC1 ZINC000509939119 918536505 /nfs/dbraw/zinc/53/65/05/918536505.db2.gz SNZOSODVUGBAGH-UHFFFAOYSA-N 0 3 416.997 4.264 20 0 HIADHN CCOc1cccc(CN[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)c1OC(F)F ZINC000509945132 918541019 /nfs/dbraw/zinc/54/10/19/918541019.db2.gz RRSLSCKYSUHSAP-LJQANCHMSA-N 0 3 418.484 4.010 20 0 HIADHN Cn1cc2c(n1)CCC[C@@H]2NCc1ccc(OC(F)(F)[C@H](F)C(F)(F)F)cc1 ZINC000509956790 918549525 /nfs/dbraw/zinc/54/95/25/918549525.db2.gz IUYJEIBWEQOAKB-GOEBONIOSA-N 0 3 407.358 4.459 20 0 HIADHN O=C(Nc1ccccc1)N1CC[C@H](NCc2ccccc2OCc2cccnc2)C1 ZINC000509963180 918553687 /nfs/dbraw/zinc/55/36/87/918553687.db2.gz HYETWVFCOLGRGT-QFIPXVFZSA-N 0 3 402.498 4.057 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3sc(C)cc3OC(F)F)c(C)c2)CC1 ZINC000510106676 918669538 /nfs/dbraw/zinc/66/95/38/918669538.db2.gz QWMNMSNHDIMXEP-UHFFFAOYSA-N 0 3 409.502 4.361 20 0 HIADHN COc1ccc([C@H](CNC(=O)c2cc(C)ccc2-n2ccnc2)N2CCCCC2)cc1 ZINC000510183563 918732142 /nfs/dbraw/zinc/73/21/42/918732142.db2.gz VGGANPQRZMWNPJ-DEOSSOPVSA-N 0 3 418.541 4.146 20 0 HIADHN CC[C@H](NCC(=O)N(C)Cc1c(F)cccc1Cl)c1ccc(OC)c(OC)c1 ZINC000510199443 918749830 /nfs/dbraw/zinc/74/98/30/918749830.db2.gz MKEYZKMGYXXQKB-SFHVURJKSA-N 0 3 408.901 4.196 20 0 HIADHN CN(Cc1cc(F)cc2cccnc21)C[C@H](O)COc1ccc(C(F)(F)F)cc1 ZINC000510224365 918767160 /nfs/dbraw/zinc/76/71/60/918767160.db2.gz UVYCOOHNZJJQGZ-SFHVURJKSA-N 0 3 408.395 4.264 20 0 HIADHN Cc1cc([C@H](C)NCc2cccc(NS(C)(=O)=O)c2)sc1Br ZINC000510246228 918783162 /nfs/dbraw/zinc/78/31/62/918783162.db2.gz WTQYXWKOMKEVSI-NSHDSACASA-N 0 3 403.367 4.041 20 0 HIADHN CC[C@@H](NCc1cccc(C(=O)NCc2ccco2)c1)c1ccc(OC)c(OC)c1 ZINC000510266921 918796575 /nfs/dbraw/zinc/79/65/75/918796575.db2.gz JWGSJRXPXOVHPO-OAQYLSRUSA-N 0 3 408.498 4.468 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3ccc4c(c3)OC3(CCCC3)O4)cc2)CC1 ZINC000510354268 918848804 /nfs/dbraw/zinc/84/88/04/918848804.db2.gz OQXQRSGDEMGJCO-UHFFFAOYSA-N 0 3 407.514 4.122 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)Nc1cccc(C(=O)Nc2ccccn2)c1 ZINC000510389439 918867857 /nfs/dbraw/zinc/86/78/57/918867857.db2.gz QEENMXBVYGGTFX-UHFFFAOYSA-N 0 3 414.465 4.394 20 0 HIADHN O=C(NCc1ccco1)c1cccc(CN2CC[C@@H](n3ncc4ccccc43)C2)c1 ZINC000510406875 918878544 /nfs/dbraw/zinc/87/85/44/918878544.db2.gz OALOEEKFTUXDTJ-OAQYLSRUSA-N 0 3 400.482 4.006 20 0 HIADHN C[C@H](c1ncc(-c2ccc(Cl)cc2Cl)o1)N1CC[C@H](CN2CCOCC2)C1 ZINC000510431575 918894290 /nfs/dbraw/zinc/89/42/90/918894290.db2.gz WVISGHQUBCSHKR-HUUCEWRRSA-N 0 3 410.345 4.364 20 0 HIADHN Cc1n[nH]c(C)c1[C@@H]1CCCCCN1C(=O)NCC(C)(C)N1CCc2ccccc2C1 ZINC000510488889 918939013 /nfs/dbraw/zinc/93/90/13/918939013.db2.gz IPQPUANCQBHRTM-QFIPXVFZSA-N 0 3 423.605 4.490 20 0 HIADHN CCOC(=O)c1cnn(C2CCN(C[C@H](OC)c3ccc(Cl)cc3)CC2)c1C ZINC000510634162 919075331 /nfs/dbraw/zinc/07/53/31/919075331.db2.gz OQCWIKLELQLNKK-FQEVSTJZSA-N 0 3 405.926 4.046 20 0 HIADHN C[C@@H]1CN(c2ccc(CN[C@H]3CCc4ccc(Br)cc43)cn2)C[C@@H](C)O1 ZINC000510668472 919109988 /nfs/dbraw/zinc/10/99/88/919109988.db2.gz JNIDFTGAPJCUNH-SXGZJXTBSA-N 0 3 416.363 4.235 20 0 HIADHN Cc1nc(C)c([C@@H](C)N(C)C(=O)[C@@H]2CN(Cc3ccccc3)CCC2(F)F)s1 ZINC000510705550 919144172 /nfs/dbraw/zinc/14/41/72/919144172.db2.gz WBKCBAHHIBSBRU-QAPCUYQASA-N 0 3 407.530 4.437 20 0 HIADHN COc1cc([C@H](C)N[C@@H]2CCc3ccc(Br)cc32)ccc1OCCO ZINC000510732281 919178151 /nfs/dbraw/zinc/17/81/51/919178151.db2.gz HLEUNBCIZUWVIW-SCLBCKFNSA-N 0 3 406.320 4.167 20 0 HIADHN COc1cc([C@H](C)N[C@H]2CCc3ccc(Br)cc32)ccc1OCCO ZINC000510732282 919178539 /nfs/dbraw/zinc/17/85/39/919178539.db2.gz HLEUNBCIZUWVIW-UGSOOPFHSA-N 0 3 406.320 4.167 20 0 HIADHN Cc1ccc(NC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)c(OC[C@@H]2CCCO2)c1 ZINC000510736401 919182115 /nfs/dbraw/zinc/18/21/15/919182115.db2.gz PWGWATSBDAYEKM-YADHBBJMSA-N 0 3 423.557 4.339 20 0 HIADHN CO[C@@]1(C)CCCN([C@@H]2CCCN(c3c(C)cc(Br)cc3C)C2=O)CC1 ZINC000510814953 919291702 /nfs/dbraw/zinc/29/17/02/919291702.db2.gz URXWLIRUUBVVLR-NQIIRXRSSA-N 0 3 423.395 4.452 20 0 HIADHN CO[C@@]1(C)CCCN([C@H]2CCCN(c3c(C)cc(Br)cc3C)C2=O)CC1 ZINC000510814954 919292029 /nfs/dbraw/zinc/29/20/29/919292029.db2.gz URXWLIRUUBVVLR-RXVVDRJESA-N 0 3 423.395 4.452 20 0 HIADHN C[C@H](NC(=O)c1oc2ccccc2c1CN(C)C)c1cccc(N2CCCC2=O)c1 ZINC000510816187 919292808 /nfs/dbraw/zinc/29/28/08/919292808.db2.gz SGMODLSBJUPXEM-INIZCTEOSA-N 0 3 405.498 4.112 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)NCC2(C(F)(F)F)CCC2)N(C)C)cc1 ZINC000510864037 919354377 /nfs/dbraw/zinc/35/43/77/919354377.db2.gz CRAGHQQOVPTPEZ-KRWDZBQOSA-N 0 3 401.473 4.108 20 0 HIADHN COc1ccc(C[C@H](C)C(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)cc1OC ZINC000510883601 919379750 /nfs/dbraw/zinc/37/97/50/919379750.db2.gz YQMNBAZERWBVDW-PMACEKPBSA-N 0 3 410.558 4.005 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)C1CCC(NC(=O)C2CCCC2)CC1)c1ccsc1 ZINC000510885475 919381896 /nfs/dbraw/zinc/38/18/96/919381896.db2.gz YDOZZLPUEMCNTQ-MNLRITNHSA-N 0 3 419.635 4.112 20 0 HIADHN COC[C@@H](N[C@H]1CCN(C(=O)Nc2ccccc2)C1)c1cccc(C(F)(F)F)c1 ZINC000510970411 919515669 /nfs/dbraw/zinc/51/56/69/919515669.db2.gz VAFIJMLDOHJVGS-RBUKOAKNSA-N 0 3 407.436 4.289 20 0 HIADHN CCOc1cccc2cc([C@@H](C)N[C@@H]3CCN(C(=O)COc4ccccc4)C3)oc21 ZINC000511013418 919579539 /nfs/dbraw/zinc/57/95/39/919579539.db2.gz JEMANEXWGVJMQQ-IEBWSBKVSA-N 0 3 408.498 4.162 20 0 HIADHN CCOc1cccc2cc([C@H](C)N[C@@H]3CCN(C(=O)COc4ccccc4)C3)oc21 ZINC000511014232 919580357 /nfs/dbraw/zinc/58/03/57/919580357.db2.gz JEMANEXWGVJMQQ-PKOBYXMFSA-N 0 3 408.498 4.162 20 0 HIADHN COc1ccccc1OCc1ccc(C(=O)N(CC(C)C)C2CCN(C)CC2)o1 ZINC000511034828 919617268 /nfs/dbraw/zinc/61/72/68/919617268.db2.gz VNDABAQPBKAGFB-UHFFFAOYSA-N 0 3 400.519 4.060 20 0 HIADHN CC[C@@H](C)n1ncc2c1nc(C)cc2C(=O)NC[C@H](c1ccccc1)N1CCCC1 ZINC000511075771 919677468 /nfs/dbraw/zinc/67/74/68/919677468.db2.gz JAYTXOKZFSQRIE-XMSQKQJNSA-N 0 3 405.546 4.278 20 0 HIADHN C[C@@H]1CN(c2ccccc2NC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)C[C@@H](C)O1 ZINC000511080039 919681421 /nfs/dbraw/zinc/68/14/21/919681421.db2.gz MOTDLXQTLFQYDB-SJBKTWHCSA-N 0 3 422.573 4.086 20 0 HIADHN Cc1cc(Br)cc2cc(C(=O)NCCCCN3C[C@@H](C)O[C@@H](C)C3)oc21 ZINC000511125926 919738170 /nfs/dbraw/zinc/73/81/70/919738170.db2.gz NZHVMZSRSWSBGV-GASCZTMLSA-N 0 3 423.351 4.123 20 0 HIADHN COc1ccc(-c2nc(C)c([C@@H](C)NCc3ccc4c(c3)oc(=O)n4C)s2)cc1 ZINC000511151653 919771940 /nfs/dbraw/zinc/77/19/40/919771940.db2.gz GZFJGIPSYZPDJG-CYBMUJFWSA-N 0 3 409.511 4.423 20 0 HIADHN COc1ccc(-c2nc(C)c([C@H](C)NCc3ccc4c(c3)oc(=O)n4C)s2)cc1 ZINC000511151654 919772181 /nfs/dbraw/zinc/77/21/81/919772181.db2.gz GZFJGIPSYZPDJG-ZDUSSCGKSA-N 0 3 409.511 4.423 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)Nc1cc(C2CC2)nn1-c1ccccc1 ZINC000511221492 919830172 /nfs/dbraw/zinc/83/01/72/919830172.db2.gz IOMGXAIVIKXBSX-UHFFFAOYSA-N 0 3 421.520 4.485 20 0 HIADHN C[C@@H](NC(=O)Nc1cccc(COCCOc2ccccc2)c1)C1=CCN(C)CC1 ZINC000511245525 919845775 /nfs/dbraw/zinc/84/57/75/919845775.db2.gz BNWRJMGKTQAACD-LJQANCHMSA-N 0 3 409.530 4.054 20 0 HIADHN C[C@H](NC(=O)N[C@@H](c1ccccc1)c1ccc2c(c1)CCCO2)C1=CCN(C)CC1 ZINC000511275020 919871773 /nfs/dbraw/zinc/87/17/73/919871773.db2.gz UCQQWTXWMNISCN-UUOWRZLLSA-N 0 3 405.542 4.051 20 0 HIADHN CCN(C(=O)Cc1ccc(NC(=O)N[C@H](C)C2=CCN(C)CC2)cc1)c1ccccc1 ZINC000511276301 919873132 /nfs/dbraw/zinc/87/31/32/919873132.db2.gz YPSFANFDWIIUDV-LJQANCHMSA-N 0 3 420.557 4.054 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)c1ccc2c(c1)[nH]c(=O)n2C1CCCC1 ZINC000511279191 919875677 /nfs/dbraw/zinc/87/56/77/919875677.db2.gz CCLLFJWSMJTRIU-UHFFFAOYSA-N 0 3 418.541 4.035 20 0 HIADHN CC(C)N(Cc1cc(Br)ccc1F)C(=O)N[C@H](C)C1=CCN(C)CC1 ZINC000511286600 919881717 /nfs/dbraw/zinc/88/17/17/919881717.db2.gz MAXGEVHSDREEMR-CQSZACIVSA-N 0 3 412.347 4.159 20 0 HIADHN COc1ccc2c(c1)CN(C(=O)N[C@@H](C)C1=CCN(C)CC1)[C@H](c1ccccc1)C2 ZINC000511296770 919893176 /nfs/dbraw/zinc/89/31/76/919893176.db2.gz ZHPHMEVOQDRLLL-UUOWRZLLSA-N 0 3 405.542 4.155 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)N[C@@H](c3ccc(F)cc3)C3CCC3)CC2)C[C@H](C)O1 ZINC000511349215 919943925 /nfs/dbraw/zinc/94/39/25/919943925.db2.gz CSCWPLSAIBTENP-IEGUWTFLSA-N 0 3 417.569 4.198 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)N[C@H](c3ccc(F)cc3)C3CCC3)CC2)C[C@H](C)O1 ZINC000511349216 919944378 /nfs/dbraw/zinc/94/43/78/919944378.db2.gz CSCWPLSAIBTENP-IXFSTUDKSA-N 0 3 417.569 4.198 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)c1ccc(OCc2ccccc2)nc1 ZINC000511353848 919948122 /nfs/dbraw/zinc/94/81/22/919948122.db2.gz RMEBYOMQNSFTSF-HSZRJFAPSA-N 0 3 401.510 4.228 20 0 HIADHN CC[C@@H](C)n1ncc2c1nc(C)cc2C(=O)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000511354673 919949384 /nfs/dbraw/zinc/94/93/84/919949384.db2.gz FRSRCPUGHBUGKA-GCJKJVERSA-N 0 3 405.546 4.278 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)N[C@H](C[C@H]1CCOC1)c1ccccc1 ZINC000511372113 919966347 /nfs/dbraw/zinc/96/63/47/919966347.db2.gz GEWFQLWYSRXYFD-AUSIDOKSSA-N 0 3 413.537 4.067 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)N[C@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000511373125 919970244 /nfs/dbraw/zinc/97/02/44/919970244.db2.gz MTCBNAKHAYCMMF-TUACAJSNSA-N 0 3 407.558 4.291 20 0 HIADHN CN(C)CCN(C[C@@H]1CCCO1)C(=O)c1ccc(-c2cccc3cccnc32)cc1 ZINC000511379625 919980580 /nfs/dbraw/zinc/98/05/80/919980580.db2.gz OWLSHFNMXHBWEH-QFIPXVFZSA-N 0 3 403.526 4.085 20 0 HIADHN CCCS(=O)(=O)[N-]c1ccccc1C(=O)Nc1cccc2c1C[N@H+](CC(C)C)C2 ZINC000511395005 920006407 /nfs/dbraw/zinc/00/64/07/920006407.db2.gz FLJPFPKWCLDCHD-UHFFFAOYSA-N 0 3 415.559 4.062 20 0 HIADHN CCCS(=O)(=O)[N-]c1ccccc1C(=O)Nc1cccc2c1C[N@@H+](CC(C)C)C2 ZINC000511395005 920006428 /nfs/dbraw/zinc/00/64/28/920006428.db2.gz FLJPFPKWCLDCHD-UHFFFAOYSA-N 0 3 415.559 4.062 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)Cc3cc4c(ccc5ccccc45)o3)CC2)C[C@H](C)O1 ZINC000511479320 920089542 /nfs/dbraw/zinc/08/95/42/920089542.db2.gz AQTIPJNCCMCSOM-OALUTQOASA-N 0 3 420.553 4.476 20 0 HIADHN CC[C@H](C)n1ncc2c1nc(C)cc2C(=O)NC1CCN(Cc2ccccc2)CC1 ZINC000511493795 920104355 /nfs/dbraw/zinc/10/43/55/920104355.db2.gz SQJRWLOFUHUSOB-SFHVURJKSA-N 0 3 405.546 4.105 20 0 HIADHN COc1ccc(C[C@H](C)C(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)cc1OC ZINC000511530737 920151508 /nfs/dbraw/zinc/15/15/08/920151508.db2.gz FZHSHEXZZKFURS-UGKGYDQZSA-N 0 3 410.558 4.144 20 0 HIADHN O=C(Nc1ccc(C(=O)N2CCCCCC2)cc1)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000511563921 920206158 /nfs/dbraw/zinc/20/61/58/920206158.db2.gz CVXUTEPEHQTBQJ-HSZRJFAPSA-N 0 3 420.557 4.099 20 0 HIADHN Cc1nn(C)c(C)c1NC(=O)[C@H](C)N[C@H](c1cccc(OC(F)(F)F)c1)C1CC1 ZINC000511571555 920216495 /nfs/dbraw/zinc/21/64/95/920216495.db2.gz BDYZXTRSSUZTPL-SGTLLEGYSA-N 0 3 410.440 4.003 20 0 HIADHN O=C(CN[C@@H](c1cccc(OC(F)(F)F)c1)C1CC1)N[C@H]1CCOc2ccccc21 ZINC000511584076 920229429 /nfs/dbraw/zinc/22/94/29/920229429.db2.gz GSQKATPXDQVJEQ-GHTZIAJQSA-N 0 3 420.431 4.266 20 0 HIADHN Cn1nc(C(C)(C)C)cc1NC(=O)CN[C@@H](c1cccc(OC(F)(F)F)c1)C1CC1 ZINC000511592171 920239596 /nfs/dbraw/zinc/23/95/96/920239596.db2.gz IQIRZYZIQWIYTB-LJQANCHMSA-N 0 3 424.467 4.296 20 0 HIADHN Oc1ccc(F)c(CNC2CCN(Cc3ccc(Br)cc3)CC2)c1F ZINC000511607687 920257006 /nfs/dbraw/zinc/25/70/06/920257006.db2.gz YLFLSCBLIDWNEJ-UHFFFAOYSA-N 0 3 411.290 4.187 20 0 HIADHN O=C(CCN1CC[C@H](C(F)(F)F)[C@@H](CO)C1)Nc1ccccc1Oc1ccccc1 ZINC000511640916 920304301 /nfs/dbraw/zinc/30/43/01/920304301.db2.gz PHAMDEDPQPYRCX-AEFFLSMTSA-N 0 3 422.447 4.300 20 0 HIADHN CCOc1cc(CN(C)C[C@H]2CCCCO2)ccc1OCC(=O)Nc1ccccc1 ZINC000511656966 920323329 /nfs/dbraw/zinc/32/33/29/920323329.db2.gz PHUSGKUMRAGMFU-OAQYLSRUSA-N 0 3 412.530 4.104 20 0 HIADHN O=C(CCN1CC[C@H](C(F)(F)F)[C@@H](CO)C1)Nc1ccc(Oc2ccccc2)cc1 ZINC000511663076 920327158 /nfs/dbraw/zinc/32/71/58/920327158.db2.gz BVIHNEMWRIUCNR-UZLBHIALSA-N 0 3 422.447 4.300 20 0 HIADHN C[C@H](Sc1ccc(Br)cc1)C(=O)NC[C@@H](c1ccccc1)N(C)C ZINC000511711508 920376771 /nfs/dbraw/zinc/37/67/71/920376771.db2.gz BNOOLBBIHIQFPM-KSSFIOAISA-N 0 3 407.377 4.349 20 0 HIADHN CSc1nccn1-c1ccc(C(=O)NC[C@@H](c2cccs2)N2CCCC2)cc1 ZINC000511755124 920434181 /nfs/dbraw/zinc/43/41/81/920434181.db2.gz QJYCMQDUNAVMJQ-SFHVURJKSA-N 0 3 412.584 4.223 20 0 HIADHN CS(=O)(=O)c1ccc(CNC/C=C/c2ccc(F)c(F)c2)cc1C(F)(F)F ZINC000511765823 920451981 /nfs/dbraw/zinc/45/19/81/920451981.db2.gz XEAYJXFUWTWAEQ-NSCUHMNNSA-N 0 3 405.388 4.190 20 0 HIADHN CCOc1ccccc1[C@H](CC)NC(=O)CN1C[C@H](c2ccccc2)[C@@H]2COCC[C@@H]21 ZINC000511779067 920469069 /nfs/dbraw/zinc/46/90/69/920469069.db2.gz DVLPMHFTMKKASZ-SBFWRKJZSA-N 0 3 422.569 4.157 20 0 HIADHN O=C(NC1CCN(Cc2c[nH]nc2-c2ccc(Cl)cc2)CC1)c1ccsc1 ZINC000511781308 920473067 /nfs/dbraw/zinc/47/30/67/920473067.db2.gz MESJDXJHYUMQRK-UHFFFAOYSA-N 0 3 400.935 4.186 20 0 HIADHN CC1(C)CN(Cc2ccccc2)CC[C@@H]1NC(=O)CSCC(=O)c1ccccc1 ZINC000511782417 920475645 /nfs/dbraw/zinc/47/56/45/920475645.db2.gz AYKIGRTWYBXDNJ-QFIPXVFZSA-N 0 3 410.583 4.019 20 0 HIADHN C[C@@H]1CCN(C(=O)CN2C[C@H](c3ccccc3)[C@@H]3COCC[C@H]32)c2ccccc2S1 ZINC000511794267 920487811 /nfs/dbraw/zinc/48/78/11/920487811.db2.gz SKFORIQOPRNVCM-PSWRPDDJSA-N 0 3 422.594 4.408 20 0 HIADHN COCc1ccccc1/C=C(\C)CN[C@@H]1CC(=O)N(C)[C@@H]1c1ccc(F)c(F)c1 ZINC000511800098 920494802 /nfs/dbraw/zinc/49/48/02/920494802.db2.gz TZULGGUDGMZGRZ-VPPFLTFOSA-N 0 3 400.469 4.076 20 0 HIADHN CN(C)C(=O)Cc1nc(CN[C@@H]2CCC[C@H]2c2cccc(C(F)(F)F)c2)cs1 ZINC000511804565 920499615 /nfs/dbraw/zinc/49/96/15/920499615.db2.gz DFDJIKRKFGCAAW-DLBZAZTESA-N 0 3 411.493 4.219 20 0 HIADHN O=C(N[C@@H]1CN(Cc2ccccc2)C[C@H]1c1ccccc1)c1scnc1C1CC1 ZINC000511803721 920500078 /nfs/dbraw/zinc/50/00/78/920500078.db2.gz AZLWHPWQWHPHRQ-LEWJYISDSA-N 0 3 403.551 4.419 20 0 HIADHN O=C(CN1C[C@H](c2ccccc2)[C@H]2CCC[C@H]21)Nc1ccccc1N1CCCC1=O ZINC000511830016 920530792 /nfs/dbraw/zinc/53/07/92/920530792.db2.gz NRQIZNXPXTYPBI-KCZVDYSFSA-N 0 3 403.526 4.020 20 0 HIADHN Cc1cc(Br)ccc1NC(=O)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000511866909 920593418 /nfs/dbraw/zinc/59/34/18/920593418.db2.gz ASCUDYIBXWDSPN-UHFFFAOYSA-N 0 3 417.347 4.214 20 0 HIADHN CC(C)CC(=O)Nc1ccc(NC(=O)c2ccc(CN3CCC(CO)CC3)cc2)cc1 ZINC000511869172 920595336 /nfs/dbraw/zinc/59/53/36/920595336.db2.gz UVTAAAGCIOSERG-UHFFFAOYSA-N 0 3 423.557 4.128 20 0 HIADHN Cc1nn(C)c(=O)c(-c2nc(CN3C[C@H](c4ccccc4)[C@H]4CCC[C@H]43)cs2)c1C ZINC000511869717 920597630 /nfs/dbraw/zinc/59/76/30/920597630.db2.gz AGHWWDQLKYXUOQ-NJDAHSKKSA-N 0 3 420.582 4.289 20 0 HIADHN COc1cc(F)c([C@H](C)NC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)cc1OC ZINC000511915121 920659248 /nfs/dbraw/zinc/65/92/48/920659248.db2.gz DRKLQDUQQGOQIQ-RDJZCZTQSA-N 0 3 418.484 4.071 20 0 HIADHN Cc1cc([C@H](C)N[C@@H]2CCCN(Cc3ccccn3)C2=O)sc1Br ZINC000511924656 920670550 /nfs/dbraw/zinc/67/05/50/920670550.db2.gz BDAGCJWHVHBOAP-DZGCQCFKSA-N 0 3 408.365 4.056 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2cc3c(cccc3Br)[nH]2)N(C)C)cc1 ZINC000511959815 920721368 /nfs/dbraw/zinc/72/13/68/920721368.db2.gz HRRPBMLBZALQOU-IBGZPJMESA-N 0 3 400.320 4.272 20 0 HIADHN COc1cc(F)c([C@H](C)NC(=O)NC[C@@H](c2ccccc2)N2CCCC2)cc1OC ZINC000512024505 920800460 /nfs/dbraw/zinc/80/04/60/920800460.db2.gz FGUDEZMVYDACKI-JXFKEZNVSA-N 0 3 415.509 4.040 20 0 HIADHN COc1cc(NCCNCc2cnn(-c3ccc(C(F)(F)F)cc3)c2)cc(OC)c1 ZINC000512054582 920824016 /nfs/dbraw/zinc/82/40/16/920824016.db2.gz WMXMZAUOPCVFCC-UHFFFAOYSA-N 0 3 420.435 4.110 20 0 HIADHN Ic1cnc(CNC[C@@H]2CCCO[C@H]2c2ccccc2)s1 ZINC000512082905 920846365 /nfs/dbraw/zinc/84/63/65/920846365.db2.gz MIBQBLPJFTUZEC-BBRMVZONSA-N 0 3 414.312 4.005 20 0 HIADHN Cc1ccc2nc([C@@H]3CCCN3C(=O)c3ccc(CN4CCSCC4)cc3)[nH]c2c1 ZINC000512088983 920853253 /nfs/dbraw/zinc/85/32/53/920853253.db2.gz KYPQOIOFUZGXCI-QFIPXVFZSA-N 0 3 420.582 4.397 20 0 HIADHN Cc1cc([C@@H](C)NCCCS(=O)(=O)c2ccccc2)sc1Br ZINC000512146999 920890060 /nfs/dbraw/zinc/89/00/60/920890060.db2.gz RVEHUQVKLAYLNN-CYBMUJFWSA-N 0 3 402.379 4.334 20 0 HIADHN COc1cc(F)c([C@H](C)NC(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)cc1OC ZINC000512197213 920943892 /nfs/dbraw/zinc/94/38/92/920943892.db2.gz ATBSUVBONSAUTK-JZXOWHBKSA-N 0 3 415.509 4.039 20 0 HIADHN CCOc1cc(CN2CCC(C(=O)N(CC)CC)CC2)ccc1OCC(F)(F)F ZINC000512241687 920998640 /nfs/dbraw/zinc/99/86/40/920998640.db2.gz FQBGNDKIIZKRLP-UHFFFAOYSA-N 0 3 416.484 4.107 20 0 HIADHN C[C@@H](C(=O)Nc1ccc(CC(=O)N2CCc3ccccc32)cc1)N1[C@H](C)CC[C@@H]1C ZINC000512295278 921051921 /nfs/dbraw/zinc/05/19/21/921051921.db2.gz ONDQTQSILJBKQN-OTWHNJEPSA-N 0 3 405.542 4.018 20 0 HIADHN Cc1nn(-c2ccccc2)cc1CN[C@H](C)CC(=O)N(C)Cc1ccccc1Cl ZINC000512323535 921073645 /nfs/dbraw/zinc/07/36/45/921073645.db2.gz NFTSYQUKSCJMOX-QGZVFWFLSA-N 0 3 410.949 4.361 20 0 HIADHN COc1cc(CN[C@H]2CCO[C@@H]2c2ccnn2C(C)C)ccc1OCc1ccncc1 ZINC000512354898 921099747 /nfs/dbraw/zinc/09/97/47/921099747.db2.gz MRCJNYYLHIWFFG-RDPSFJRHSA-N 0 3 422.529 4.066 20 0 HIADHN O=C(NCCc1cccs1)C1CCN(Cc2cccc(OC(F)(F)F)c2)CC1 ZINC000512354597 921100119 /nfs/dbraw/zinc/10/01/19/921100119.db2.gz GTMZMWZMJACPBZ-UHFFFAOYSA-N 0 3 412.477 4.218 20 0 HIADHN O[C@H](CN[C@H]1CCSc2ccc(Br)cc21)COc1ccc(F)cc1 ZINC000513472478 921831524 /nfs/dbraw/zinc/83/15/24/921831524.db2.gz FXPVWPXRFRRFNG-PBHICJAKSA-N 0 3 412.324 4.155 20 0 HIADHN CN(C(=O)c1ccc(NCc2conc2Cc2ccccc2)cc1)[C@@H]1CCCN(C)C1 ZINC000513606027 921936924 /nfs/dbraw/zinc/93/69/24/921936924.db2.gz HJPHWUAGQGYSIF-HSZRJFAPSA-N 0 3 418.541 4.044 20 0 HIADHN CN(C(=O)c1ccc(NCc2conc2Cc2ccccc2)cc1)[C@H]1CCCN(C)C1 ZINC000513606028 921937820 /nfs/dbraw/zinc/93/78/20/921937820.db2.gz HJPHWUAGQGYSIF-QHCPKHFHSA-N 0 3 418.541 4.044 20 0 HIADHN COc1cc(OC)cc(Oc2ccc(CNCc3ccc4c(c3)oc(=O)n4C)cc2)c1 ZINC000513624494 921952581 /nfs/dbraw/zinc/95/25/81/921952581.db2.gz LJYHQYUIVXAANA-UHFFFAOYSA-N 0 3 420.465 4.231 20 0 HIADHN COc1ccc2[nH]cc(C3CCN([C@@H](C)C(=O)N(C)Cc4ccccc4)CC3)c2c1 ZINC000513624938 921953192 /nfs/dbraw/zinc/95/31/92/921953192.db2.gz PFVFBJVRKIQWIN-SFHVURJKSA-N 0 3 405.542 4.403 20 0 HIADHN CC(C)(C)c1nn(Cc2ccccc2)cc1CN1CCC[C@@H](c2nnc3n2CCC3)C1 ZINC000513646788 921969642 /nfs/dbraw/zinc/96/96/42/921969642.db2.gz BPGJJSGBOURPKY-HXUWFJFHSA-N 0 3 418.589 4.146 20 0 HIADHN COc1ccc([C@@H](Cc2ccncc2)NCc2ccccc2N2CCOCC2)cc1 ZINC000513668367 921991356 /nfs/dbraw/zinc/99/13/56/921991356.db2.gz XMSCHGIFRFQPSA-XMMPIXPASA-N 0 3 403.526 4.000 20 0 HIADHN COc1ccc2[nH]cc(C3CCN([C@@H](C)C(=O)NCCc4ccccc4C)CC3)c2c1 ZINC000513671678 921993550 /nfs/dbraw/zinc/99/35/50/921993550.db2.gz FHFKRWOVZLPXLH-IBGZPJMESA-N 0 3 419.569 4.412 20 0 HIADHN Cc1nn(Cc2ccc(Cl)cc2)c(C)c1CN1CCC[C@@H](c2nnc3n2CCC3)C1 ZINC000513691245 922012610 /nfs/dbraw/zinc/01/26/10/922012610.db2.gz SUBXUQTYTWGQQO-LJQANCHMSA-N 0 3 424.980 4.119 20 0 HIADHN CNC(=O)c1ccc(CN(C)[C@@H]2CCSc3ccc(Br)cc32)cc1 ZINC000513725638 922044580 /nfs/dbraw/zinc/04/45/80/922044580.db2.gz RMBQNUGDSMMSNU-QGZVFWFLSA-N 0 3 405.361 4.478 20 0 HIADHN CC(C)(C)O[C@H](C(=O)NCCCCN1CCN(c2ccccc2)CC1)c1ccccc1 ZINC000513724227 922045301 /nfs/dbraw/zinc/04/53/01/922045301.db2.gz ZUPSUFLFBQZHRZ-DEOSSOPVSA-N 0 3 423.601 4.261 20 0 HIADHN COc1cccc(OC)c1OC1CCN(Cc2ccc(O)c3nc(C)ccc23)CC1 ZINC000513888521 922215972 /nfs/dbraw/zinc/21/59/72/922215972.db2.gz AQPFQGXIUGVRQU-UHFFFAOYSA-N 0 3 408.498 4.309 20 0 HIADHN Cc1noc(C)c1[C@@H](C)CC(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000513929530 922250446 /nfs/dbraw/zinc/25/04/46/922250446.db2.gz IPDVIMOKRBQYKH-JXFKEZNVSA-N 0 3 407.518 4.067 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)Nc3ccc4scnc4c3)CC2)c1 ZINC000513968332 922286913 /nfs/dbraw/zinc/28/69/13/922286913.db2.gz BAQAIEYKPUBGQL-UHFFFAOYSA-N 0 3 423.586 4.329 20 0 HIADHN O=C(NCCCCN1CCN(Cc2ccccc2)CC1)Nc1ccc2scnc2c1 ZINC000513972592 922291511 /nfs/dbraw/zinc/29/15/11/922291511.db2.gz GHQAIJQTUSZHHO-UHFFFAOYSA-N 0 3 423.586 4.016 20 0 HIADHN CSc1cc2c(cc1NC(=O)NC[C@H](c1cccs1)N1CCCC1)OCCO2 ZINC000513974780 922294787 /nfs/dbraw/zinc/29/47/87/922294787.db2.gz SKLLRHKAIOWDRK-OAHLLOKOSA-N 0 3 419.572 4.200 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)Cc1c[nH]c2cccc(Br)c12 ZINC000514006796 922330794 /nfs/dbraw/zinc/33/07/94/922330794.db2.gz RTKTWDLTYRQHRF-UHFFFAOYSA-N 0 3 400.320 4.482 20 0 HIADHN COc1ccc(CCCC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)c(OC)c1 ZINC000514007271 922332774 /nfs/dbraw/zinc/33/27/74/922332774.db2.gz DOTZEDBMWUIVNF-FQEVSTJZSA-N 0 3 410.558 4.150 20 0 HIADHN COc1ccc2cccc(CC(=O)NC3CCN([C@@H](C)c4ccncc4)CC3)c2c1 ZINC000514044218 922365609 /nfs/dbraw/zinc/36/56/09/922365609.db2.gz GODOKVUBZUYGGC-SFHVURJKSA-N 0 3 403.526 4.128 20 0 HIADHN Clc1ccccc1[C@@H](CN[C@H](c1ncc[nH]1)C1CCCCC1)N1CCOCC1 ZINC000514081935 922404749 /nfs/dbraw/zinc/40/47/49/922404749.db2.gz DVQAMTWYHCSJMC-RTWAWAEBSA-N 0 3 402.970 4.348 20 0 HIADHN CC(C)(C)N(CC(=O)Nc1ccc(F)cc1)C[C@@H]1CCN(C(=O)c2ccccc2)C1 ZINC000514114477 922446208 /nfs/dbraw/zinc/44/62/08/922446208.db2.gz HBECYQSGCTVBPV-GOSISDBHSA-N 0 3 411.521 4.027 20 0 HIADHN Cc1cccc(CN(C)C(=O)NCCCCN2CCN(c3cccc(C)c3)CC2)c1 ZINC000514133949 922469397 /nfs/dbraw/zinc/46/93/97/922469397.db2.gz FQYQQUWQHGWYTD-UHFFFAOYSA-N 0 3 408.590 4.047 20 0 HIADHN CC[C@H](NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1)c1nc(-c2ccccc2)c[nH]1 ZINC000514148634 922483403 /nfs/dbraw/zinc/48/34/03/922483403.db2.gz GQEYEHOJDDXEFJ-RTWAWAEBSA-N 0 3 403.530 4.102 20 0 HIADHN CC(C)COC[C@H](NC(=O)NC[C@@H](c1cccs1)N1CCCC1)c1ccco1 ZINC000514150167 922487224 /nfs/dbraw/zinc/48/72/24/922487224.db2.gz YEOBEFBNKXXVBR-ROUUACIJSA-N 0 3 405.564 4.191 20 0 HIADHN CCOc1cccc([C@H](C)NC(=O)NC[C@@H](c2cccc(OC)c2)N2CCCC2)c1 ZINC000514154321 922491719 /nfs/dbraw/zinc/49/17/19/922491719.db2.gz SBKUSWHTVMUONF-MBSDFSHPSA-N 0 3 411.546 4.291 20 0 HIADHN CCn1c2ccccc2nc1[C@@H]1CCCN1C(=O)NC[C@@H](Cc1ccccc1)N(C)C ZINC000514161505 922500637 /nfs/dbraw/zinc/50/06/37/922500637.db2.gz BEWKHYXQCNINPA-OFNKIYASSA-N 0 3 419.573 4.076 20 0 HIADHN O=C(NCc1cccc(Br)c1)NC[C@@H](c1cccs1)N1CCCC1 ZINC000514176680 922514716 /nfs/dbraw/zinc/51/47/16/922514716.db2.gz UHNDEVRHWWWGCZ-INIZCTEOSA-N 0 3 408.365 4.147 20 0 HIADHN CC1CCN([C@@H](CNC(=O)NCc2cccc(N(C)C)c2)c2cccs2)CC1 ZINC000514182143 922521616 /nfs/dbraw/zinc/52/16/16/922521616.db2.gz JDWWHJGRLXSXMU-FQEVSTJZSA-N 0 3 400.592 4.087 20 0 HIADHN Cc1ccc(-c2ccc(C(=O)N3CCC(CN4C[C@H](C)O[C@@H](C)C4)CC3)s2)o1 ZINC000514219788 922554418 /nfs/dbraw/zinc/55/44/18/922554418.db2.gz VNXBJXJYHRBINC-IRXDYDNUSA-N 0 3 402.560 4.278 20 0 HIADHN Cc1cccc(NC(=O)N[C@H](CN2CCCC2)c2ccccc2)c1C(=O)N1CCCC1 ZINC000514225255 922560957 /nfs/dbraw/zinc/56/09/57/922560957.db2.gz BCJLYGWTRLDVRK-JOCHJYFZSA-N 0 3 420.557 4.190 20 0 HIADHN CN1CCCN(C(=O)NC[C@@H](c2c[nH]c3ccccc32)c2ccccc2Cl)CC1 ZINC000514563885 922701888 /nfs/dbraw/zinc/70/18/88/922701888.db2.gz BHDLZVDQGJAEKG-LJQANCHMSA-N 0 3 410.949 4.300 20 0 HIADHN O=C(CC(F)(F)F)NC[C@@H]1CCCN(Cc2c[nH]nc2-c2cccc(Cl)c2)C1 ZINC000514694279 922760411 /nfs/dbraw/zinc/76/04/11/922760411.db2.gz YQQVILHUVSDVIA-ZDUSSCGKSA-N 0 3 414.859 4.011 20 0 HIADHN CSc1cccc(N(C(=O)c2ccnc(OCC(F)F)c2)C2CCN(C)CC2)c1 ZINC000514742403 922775686 /nfs/dbraw/zinc/77/56/86/922775686.db2.gz NWWFAVZKSIVHRV-UHFFFAOYSA-N 0 3 421.513 4.188 20 0 HIADHN CN(Cc1ccccc1N1CCCC1)C[C@@H](O)COc1cc(Cl)ccc1Cl ZINC000514854896 922825379 /nfs/dbraw/zinc/82/53/79/922825379.db2.gz SCGJQIRLSAYVFS-GOSISDBHSA-N 0 3 409.357 4.465 20 0 HIADHN C[C@@H](CCN1CCN(C)CC1)NC(=O)Nc1ccc(Oc2ccc(Cl)cc2)cc1 ZINC000514973848 922861614 /nfs/dbraw/zinc/86/16/14/922861614.db2.gz FIPMLZYSICNEJQ-KRWDZBQOSA-N 0 3 416.953 4.280 20 0 HIADHN CCOc1ccccc1NC(=O)[C@H](C)N[C@H]1CCN(C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000514976638 922862710 /nfs/dbraw/zinc/86/27/10/922862710.db2.gz WJDZEBWUXSOODW-JBYOLUDKSA-N 0 3 419.928 4.240 20 0 HIADHN CC(C)[C@H]([NH2+]CC(Cc1ccccc1)Cc1ccccc1)c1nc(-c2nc[n-]n2)no1 ZINC000514976969 922864337 /nfs/dbraw/zinc/86/43/37/922864337.db2.gz HNGSRMHQJOJCDW-NRFANRHFSA-N 0 3 416.529 4.243 20 0 HIADHN Cc1cccc(C)c1NC(=O)CNC(=O)[C@@H](C)N[C@@H](C)c1ccc(F)c2ccccc21 ZINC000515090130 922902401 /nfs/dbraw/zinc/90/24/01/922902401.db2.gz RXMPPCMMMMJIOD-ZWKOTPCHSA-N 0 3 421.516 4.390 20 0 HIADHN CN(C)c1ccc(C(F)(F)F)cc1NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000515112492 922927019 /nfs/dbraw/zinc/92/70/19/922927019.db2.gz KVISFJLMQREUNT-QGZVFWFLSA-N 0 3 406.452 4.167 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1ccc(-n2cccn2)cc1)c1cccc(OC)c1 ZINC000515119780 922932846 /nfs/dbraw/zinc/93/28/46/922932846.db2.gz WLMKINFCQHVRLZ-QFIPXVFZSA-N 0 3 407.518 4.086 20 0 HIADHN CCN(CC)[C@H](CNC(=O)C(=O)Nc1cc(Cl)cc2cccnc21)c1ccccc1 ZINC000515150563 922952202 /nfs/dbraw/zinc/95/22/02/922952202.db2.gz ABVOLYGZBLCZKJ-HXUWFJFHSA-N 0 3 424.932 4.026 20 0 HIADHN Cc1ccc(CNC(=O)C2CCN(CCOc3cccc(Cl)c3)CC2)cc1F ZINC000515256260 923021754 /nfs/dbraw/zinc/02/17/54/923021754.db2.gz FATBXQZBAHHYOA-UHFFFAOYSA-N 0 3 404.913 4.195 20 0 HIADHN COc1cccc([C@H](CNC(=O)Nc2cccc(Cl)c2N(C)C)N2CCCC2)c1 ZINC000515263222 923025221 /nfs/dbraw/zinc/02/52/21/923025221.db2.gz XAVHJYMAFBYCKI-FQEVSTJZSA-N 0 3 416.953 4.373 20 0 HIADHN CCOC(=O)C1CCC(N(CC)C(=O)NC[C@@H](c2cccs2)N2CCCC2)CC1 ZINC000515489887 923131651 /nfs/dbraw/zinc/13/16/51/923131651.db2.gz IHQUXTUFSQOFTE-ACBHZAAOSA-N 0 3 421.607 4.038 20 0 HIADHN Cc1ccccc1CN1CCC(NS(=O)(=O)c2cc(Cl)ccc2Cl)CC1 ZINC000515513823 923145479 /nfs/dbraw/zinc/14/54/79/923145479.db2.gz JVGXHBAQHIRNDP-UHFFFAOYSA-N 0 3 413.370 4.245 20 0 HIADHN CCOc1ccc(NC(=O)NC[C@H](c2ccc(OC)cc2)N2CCCC2)cc1F ZINC000515808237 923364098 /nfs/dbraw/zinc/36/40/98/923364098.db2.gz UYQPIOPQBYFUSE-HXUWFJFHSA-N 0 3 401.482 4.192 20 0 HIADHN CC(C)Oc1cccc([C@@H](C)NC(=O)N(CCN(C)C)Cc2ccccc2F)c1 ZINC000515835740 923383716 /nfs/dbraw/zinc/38/37/16/923383716.db2.gz YFZYQGNHQDFJRB-GOSISDBHSA-N 0 3 401.526 4.447 20 0 HIADHN COc1cccc([C@H](CNC(=O)NCc2cc3c(s2)CCCC3)N2CCCC2)c1 ZINC000515842100 923388272 /nfs/dbraw/zinc/38/82/72/923388272.db2.gz SPJRFOJJMUKPDG-NRFANRHFSA-N 0 3 413.587 4.272 20 0 HIADHN Cc1ccc([C@H](NC(=O)NCCCCN2CCN(c3ccccc3)CC2)C2CC2)cc1 ZINC000515902450 923421216 /nfs/dbraw/zinc/42/12/16/923421216.db2.gz CSQDYDKCEZVTFB-VWLOTQADSA-N 0 3 420.601 4.348 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)N1CCC[C@@H]1C1CCCCC1 ZINC000515903313 923421331 /nfs/dbraw/zinc/42/13/31/923421331.db2.gz GFAAAHAGSAVJAV-XMMPIXPASA-N 0 3 412.622 4.343 20 0 HIADHN COCCOc1ccc(NC(=O)NC[C@@H](c2ccccc2)N2CCCC2)cc1Cl ZINC000516086182 923537285 /nfs/dbraw/zinc/53/72/85/923537285.db2.gz JJEAQLMBNKXYFM-FQEVSTJZSA-N 0 3 417.937 4.324 20 0 HIADHN CCS(=O)(=O)c1ccc([C@@H](C)N[C@H](C)CC(=O)Nc2cccc(Cl)c2)cc1 ZINC000516199496 923594610 /nfs/dbraw/zinc/59/46/10/923594610.db2.gz IVKAWJWNPVPTFL-HUUCEWRRSA-N 0 3 408.951 4.202 20 0 HIADHN COc1ccc(-c2ccncc2)cc1CN(C)CCc1nc(-c2ccccc2)no1 ZINC000516215184 923606402 /nfs/dbraw/zinc/60/64/02/923606402.db2.gz JLRZFTGZOKDBPX-UHFFFAOYSA-N 0 3 400.482 4.482 20 0 HIADHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)NCc1ccc(Cl)cc1 ZINC000516232126 923618687 /nfs/dbraw/zinc/61/86/87/923618687.db2.gz ACNTUSOVNBXNSK-UHFFFAOYSA-N 0 3 424.770 4.376 20 0 HIADHN COc1cccc(CNC[C@@H](c2ccc(Cl)cc2)N(C)CCC(F)(F)F)n1 ZINC000516266223 923636717 /nfs/dbraw/zinc/63/67/17/923636717.db2.gz WVYRXMYJLFLFLP-KRWDZBQOSA-N 0 3 401.860 4.459 20 0 HIADHN CCCN(CC(=O)Nc1ccnn1Cc1cccs1)[C@H]1CCc2ccccc2C1 ZINC000516299244 923652649 /nfs/dbraw/zinc/65/26/49/923652649.db2.gz SVBIACLYFZTMDA-FQEVSTJZSA-N 0 3 408.571 4.201 20 0 HIADHN CN(C)Cc1cccc(NC(=O)C(=O)N[C@H](c2ccccc2)c2cccc(Cl)c2)c1 ZINC000516434177 923730271 /nfs/dbraw/zinc/73/02/71/923730271.db2.gz PZSAFWKVTZATGI-JOCHJYFZSA-N 0 3 421.928 4.246 20 0 HIADHN CC[C@@H](N[C@@H](C)c1ccc(OC)c(OC)c1C)c1ccccc1OCC(=O)N(C)C ZINC000516498484 923761069 /nfs/dbraw/zinc/76/10/69/923761069.db2.gz BJHGVPHINQNFMX-FXAWDEMLSA-N 0 3 414.546 4.281 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2CN2CC[C@H](N3CCCC3=O)C2)cc1C ZINC000516579488 923800098 /nfs/dbraw/zinc/80/00/98/923800098.db2.gz GPLLDCBJYHKIMK-DEOSSOPVSA-N 0 3 414.553 4.353 20 0 HIADHN CC[C@H](C)C(=O)Nc1cccc(CNC(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)c1 ZINC000516578863 923800340 /nfs/dbraw/zinc/80/03/40/923800340.db2.gz UZGMCZQOLHIUGI-YDHSSHFGSA-N 0 3 422.573 4.306 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)NCc2ccc(F)cc2C(F)(F)F)C1 ZINC000516578895 923800973 /nfs/dbraw/zinc/80/09/73/923800973.db2.gz YJIDRGMPCBNMJK-RDTXWAMCSA-N 0 3 409.427 4.479 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)CCCc3ccccc3Cl)CC2)C[C@H](C)O1 ZINC000516607796 923814279 /nfs/dbraw/zinc/81/42/79/923814279.db2.gz BHLBKRQILGMHFI-OALUTQOASA-N 0 3 406.998 4.401 20 0 HIADHN Cc1nn(-c2ccccc2C)c(C)c1CN(C)C(=O)NC[C@H](c1ccccc1)N(C)C ZINC000516657694 923831010 /nfs/dbraw/zinc/83/10/10/923831010.db2.gz JYQZFKXXUVBOFS-XMMPIXPASA-N 0 3 419.573 4.242 20 0 HIADHN COC(=O)c1ccccc1N(C)C(=O)CN1CCC[C@H]1c1cccc2ccccc21 ZINC000516746967 923873891 /nfs/dbraw/zinc/87/38/91/923873891.db2.gz XILQVVTYOVRATG-QHCPKHFHSA-N 0 3 402.494 4.426 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1cc(F)ccc1OC[C@H]1CCCO1)c1ccco1 ZINC000516885567 923925601 /nfs/dbraw/zinc/92/56/01/923925601.db2.gz OBBZJHCUOMCVOG-WDYCEAGBSA-N 0 3 419.497 4.227 20 0 HIADHN C[C@H]1[C@H](NC(=O)N2CCC(Nc3ccc(F)cc3)CC2)CCN1Cc1ccccc1 ZINC000516989899 923954181 /nfs/dbraw/zinc/95/41/81/923954181.db2.gz SSPLUKXPRYTSOI-FDDCHVKYSA-N 0 3 410.537 4.075 20 0 HIADHN O=C(Nc1ccc2[nH]c(-c3ccccc3)nc2c1)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000517006480 923963604 /nfs/dbraw/zinc/96/36/04/923963604.db2.gz KGBLUPDYBCKWIX-HXUWFJFHSA-N 0 3 411.509 4.476 20 0 HIADHN C[C@H](NCC(=O)NC[C@H]1CCN(c2ccccc2)C1)c1ccc(F)c2ccccc21 ZINC000517053295 923976340 /nfs/dbraw/zinc/97/63/40/923976340.db2.gz AKFPNIJJDQYNBB-RBUKOAKNSA-N 0 3 405.517 4.272 20 0 HIADHN CCOc1ccc(CNC(=O)N(CCN(C)C)Cc2cccc(Cl)c2)cc1F ZINC000517325945 924103448 /nfs/dbraw/zinc/10/34/48/924103448.db2.gz VGUOETGKDBXDTQ-UHFFFAOYSA-N 0 3 407.917 4.151 20 0 HIADHN CC(C)Sc1ccc(Cl)cc1NC(=O)C(=O)NCCN1[C@H](C)CCC[C@@H]1C ZINC000517423353 924174388 /nfs/dbraw/zinc/17/43/88/924174388.db2.gz VSWLTXKCFSSNBV-GASCZTMLSA-N 0 3 411.999 4.158 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2CNC[C@@H](O)COc2ccc(F)cc2)o1 ZINC000517549072 924259515 /nfs/dbraw/zinc/25/95/15/924259515.db2.gz WLFGHBVDXJPXGK-OAQYLSRUSA-N 0 3 421.472 4.109 20 0 HIADHN FC(F)(F)Oc1ccc(CN2CCC(n3cc(Br)cn3)CC2)cc1 ZINC000517599634 926708346 /nfs/dbraw/zinc/70/83/46/926708346.db2.gz DWLNYDKRKQKRKG-UHFFFAOYSA-N 0 3 404.230 4.381 20 0 HIADHN COCCn1ccc2ccc(NC(=O)N[C@@H]3CCN(Cc4ccccc4)[C@@H]3C)cc21 ZINC000517620426 926729061 /nfs/dbraw/zinc/72/90/61/926729061.db2.gz XKYCMWUEHFYNSC-XMSQKQJNSA-N 0 3 406.530 4.072 20 0 HIADHN CCN(Cc1ccc(Cl)s1)C(=O)CCCN1CCN(c2ccccc2)CC1 ZINC000517639265 926747499 /nfs/dbraw/zinc/74/74/99/926747499.db2.gz GTYOOSZJIXSPNF-UHFFFAOYSA-N 0 3 405.995 4.352 20 0 HIADHN CCN(C(=O)CCCN1CCN(c2ccccc2)CC1)[C@@H](C)Cc1ccc(OC)cc1 ZINC000517646202 926754734 /nfs/dbraw/zinc/75/47/34/926754734.db2.gz SYEMDYIDQOVMKE-QFIPXVFZSA-N 0 3 423.601 4.077 20 0 HIADHN COc1cccc([C@H](CNC(=O)Cc2ccccc2C(F)(F)F)N2CCCC2)c1 ZINC000517802144 926842343 /nfs/dbraw/zinc/84/23/43/926842343.db2.gz WJFFGCSKFWBZNC-FQEVSTJZSA-N 0 3 406.448 4.210 20 0 HIADHN CCN(C)C(=O)c1cccc(C(=O)N(CC)[C@H]2CCN([C@@H](C)c3ccccc3)C2)c1 ZINC000517823903 926853020 /nfs/dbraw/zinc/85/30/20/926853020.db2.gz JAUBHNLCYOCEAF-CVDCTZTESA-N 0 3 407.558 4.076 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccc(F)c2)C1)N1CCC[C@@H]1c1ccc2c(c1)OCCO2 ZINC000517889122 926876624 /nfs/dbraw/zinc/87/66/24/926876624.db2.gz SGNKWKUASBYIHQ-IFMALSPDSA-N 0 3 424.516 4.173 20 0 HIADHN CCCN1CCC[C@@H]1C(=O)NCc1cn(Cc2ccccc2)nc1-c1ccccc1 ZINC000517891915 926878557 /nfs/dbraw/zinc/87/85/57/926878557.db2.gz FKBHHGBNGBXMFJ-HSZRJFAPSA-N 0 3 402.542 4.089 20 0 HIADHN CC(C)Sc1ccc(Cl)cc1NC(=O)C(=O)NC[C@H](C)N1CCC[C@@H](C)C1 ZINC000517951610 926899809 /nfs/dbraw/zinc/89/98/09/926899809.db2.gz YPNFWLRFPJPEBS-CABCVRRESA-N 0 3 411.999 4.016 20 0 HIADHN COc1ccc(C(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)cc1OC(F)F ZINC000517981417 926927452 /nfs/dbraw/zinc/92/74/52/926927452.db2.gz CZBYMJMLSLBNJV-GOSISDBHSA-N 0 3 422.472 4.117 20 0 HIADHN COc1ccc(C(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)cc1OC(F)F ZINC000517981418 926928490 /nfs/dbraw/zinc/92/84/90/926928490.db2.gz CZBYMJMLSLBNJV-SFHVURJKSA-N 0 3 422.472 4.117 20 0 HIADHN O=C([C@H](Sc1ccc(F)c(F)c1)c1ccccc1)N1CC[C@H](N2CCCC2)C1 ZINC000517990325 926933922 /nfs/dbraw/zinc/93/39/22/926933922.db2.gz AKEHQIBAELNDAN-LAUBAEHRSA-N 0 3 402.510 4.495 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)[C@@H]1CCO[C@H]1c1ccc(Cl)c(F)c1)c1ccco1 ZINC000517993030 926935556 /nfs/dbraw/zinc/93/55/56/926935556.db2.gz XNGACOMEWNCEKA-YSCXQKKWSA-N 0 3 408.901 4.395 20 0 HIADHN COc1ccc([C@@H](CNC(=O)CCOc2cccc(Cl)c2)N2CCCC2)cc1 ZINC000517996579 926939384 /nfs/dbraw/zinc/93/93/84/926939384.db2.gz SKIWKPIQZVWQBZ-OAQYLSRUSA-N 0 3 402.922 4.071 20 0 HIADHN Cc1nc(CCC(=O)N(CCN(C)C)Cc2ccc(F)cc2)oc1-c1ccccc1 ZINC000518016135 926954712 /nfs/dbraw/zinc/95/47/12/926954712.db2.gz FIKMNEISTFMQMB-UHFFFAOYSA-N 0 3 409.505 4.312 20 0 HIADHN C[C@H](NC(=O)NCC1(N2CCSCC2)CCCC1)c1nc(C(C)(C)C)cs1 ZINC000518021763 926962311 /nfs/dbraw/zinc/96/23/11/926962311.db2.gz BMHFZRPQXCEZAJ-HNNXBMFYSA-N 0 3 410.653 4.162 20 0 HIADHN C[C@H](NC(=O)N(CCN(C)C)Cc1cccc(F)c1)c1nc(C(C)(C)C)cs1 ZINC000518030607 926967588 /nfs/dbraw/zinc/96/75/88/926967588.db2.gz PTYPMPOCAUZLHD-HNNXBMFYSA-N 0 3 406.571 4.414 20 0 HIADHN Cc1cc(NCC2CCN(Cc3ccccc3Cl)CC2)nc(-c2ccncc2)n1 ZINC000518040712 926978977 /nfs/dbraw/zinc/97/89/77/926978977.db2.gz LRBKTBQTDYRWLO-UHFFFAOYSA-N 0 3 407.949 4.246 20 0 HIADHN C[C@@H]1CCC[C@H](C)N1CCNC(=O)CSc1nnc(-c2ccc3ccccc3c2)o1 ZINC000518070694 927005712 /nfs/dbraw/zinc/00/57/12/927005712.db2.gz LWSGCKZYRQQWNE-CALCHBBNSA-N 0 3 424.570 4.361 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1ccc(C(=O)NC(C)C)cc1C)c1ccsc1 ZINC000518171590 927061854 /nfs/dbraw/zinc/06/18/54/927061854.db2.gz BEQSDGRNXKVUFE-HXUWFJFHSA-N 0 3 416.591 4.399 20 0 HIADHN C[C@@H](C1CC1)N(Cc1ccccc1)C(=O)NCC1(N2CCSCC2)CCCC1 ZINC000518224363 927089279 /nfs/dbraw/zinc/08/92/79/927089279.db2.gz VJZMAHLBZSXQER-IBGZPJMESA-N 0 3 401.620 4.358 20 0 HIADHN COc1c(Br)cc(Br)cc1CNC[C@@H](O)C1CCCCC1 ZINC000518278634 927135027 /nfs/dbraw/zinc/13/50/27/927135027.db2.gz GOOSGNUARPFDMY-OAHLLOKOSA-N 0 3 421.173 4.251 20 0 HIADHN COc1ccc(CNCCOc2ccc3cc(Br)ccc3c2)cc1O ZINC000518290379 927148028 /nfs/dbraw/zinc/14/80/28/927148028.db2.gz VAIOYTXDBHBZCJ-UHFFFAOYSA-N 0 3 402.288 4.485 20 0 HIADHN CC(=O)Nc1cccc([C@@H](C)NC(=O)[C@@H](C)N2CCC(Cc3ccccc3)CC2)c1 ZINC000518389244 927234986 /nfs/dbraw/zinc/23/49/86/927234986.db2.gz KVVZYHXMUZHPSA-RTBURBONSA-N 0 3 407.558 4.165 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N(C)Cc2ccc(Br)cc2)C1 ZINC000518403408 927244241 /nfs/dbraw/zinc/24/42/41/927244241.db2.gz NUCSCSQIVWTNCU-UZLBHIALSA-N 0 3 416.363 4.426 20 0 HIADHN COc1ccc2cc(CNC(=O)N[C@@H]3CCN([C@H](C)c4ccccc4)C3)ccc2c1 ZINC000518409556 927250068 /nfs/dbraw/zinc/25/00/68/927250068.db2.gz CWACKNXHBVZWLX-WZONZLPQSA-N 0 3 403.526 4.483 20 0 HIADHN Cc1cccc(C(=O)N2CCCC2)c1NC(=O)N[C@@H]1CCN(Cc2ccccc2)[C@H]1C ZINC000518506698 927316178 /nfs/dbraw/zinc/31/61/78/927316178.db2.gz JPDJNMOCYOXLFH-SIKLNZKXSA-N 0 3 420.557 4.016 20 0 HIADHN C[C@H](C(=O)Nc1cccc(N2CCCC2=O)c1)N1CCC[C@H](Cc2ccccc2)C1 ZINC000518514983 927319432 /nfs/dbraw/zinc/31/94/32/927319432.db2.gz HHWHMTFHJIBJHL-TZIWHRDSSA-N 0 3 405.542 4.095 20 0 HIADHN O[C@@H](CN(Cc1ccc(-c2ccccc2C(F)(F)F)o1)C1CC1)Cn1cccn1 ZINC000518578200 927358465 /nfs/dbraw/zinc/35/84/65/927358465.db2.gz XAEMTBZJSBBCOI-INIZCTEOSA-N 0 3 405.420 4.187 20 0 HIADHN O=C(C[C@@H]1CCCc2ccccc21)NCCCCN1CCN(Cc2ccccc2)CC1 ZINC000518645462 927400723 /nfs/dbraw/zinc/40/07/23/927400723.db2.gz GLJHIBRKCXTUMD-VWLOTQADSA-N 0 3 419.613 4.211 20 0 HIADHN O=C(N[C@H]1CCN(C2CC2)C1)c1cn(-c2ccccc2)nc1-c1ccc(Cl)cc1 ZINC000518648174 927403370 /nfs/dbraw/zinc/40/33/70/927403370.db2.gz HYNMYQRVBFSYCP-SFHVURJKSA-N 0 3 406.917 4.159 20 0 HIADHN COc1cccc(CNC[C@@H](c2ccc(Cl)cc2)N2CCOCC2)c1OC(C)C ZINC000518785915 927489681 /nfs/dbraw/zinc/48/96/81/927489681.db2.gz BNRLGKZGGYZCEK-NRFANRHFSA-N 0 3 418.965 4.299 20 0 HIADHN O=C1C[C@H](NCc2ccc(OCc3ccncc3)cc2)CN1c1ccccc1Cl ZINC000518791949 927494382 /nfs/dbraw/zinc/49/43/82/927494382.db2.gz MSSQPVCJXVVYMZ-IBGZPJMESA-N 0 3 407.901 4.209 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Cc1cn2ccsc2n1)c1ccc(C(F)(F)F)cc1 ZINC000518917779 927626279 /nfs/dbraw/zinc/62/62/79/927626279.db2.gz RJSCOVQBFKQFQF-QGZVFWFLSA-N 0 3 424.492 4.156 20 0 HIADHN COc1ccc(OCc2nc(CN[C@H]3CCN(Cc4ccccc4)[C@@H]3C)cs2)cc1 ZINC000519025441 927701196 /nfs/dbraw/zinc/70/11/96/927701196.db2.gz RXBINAYUTHTOJV-JPYJTQIMSA-N 0 3 423.582 4.483 20 0 HIADHN CCCN(CC)C(=O)c1ccc(C(=O)NC[C@H](c2ccc(CC)cc2)N(C)C)cc1 ZINC000519085171 927758407 /nfs/dbraw/zinc/75/84/07/927758407.db2.gz OQWKAFTYLDYHSY-HSZRJFAPSA-N 0 3 409.574 4.154 20 0 HIADHN CC(C)COC1CCN(C(=O)NC[C@H](c2ccccc2)N2CCC(C)CC2)CC1 ZINC000519187356 927817048 /nfs/dbraw/zinc/81/70/48/927817048.db2.gz BMDDXVCPADIJRW-HSZRJFAPSA-N 0 3 401.595 4.306 20 0 HIADHN CC(C)N(C)C(=O)c1ccc(Cl)c(NC(=O)NC[C@H](c2ccccc2)N(C)C)c1 ZINC000519192720 927819458 /nfs/dbraw/zinc/81/94/58/927819458.db2.gz NCVQQZUAJHFDDA-HXUWFJFHSA-N 0 3 416.953 4.245 20 0 HIADHN COc1ccc(C(=O)N(c2cccc(SC)c2)C2CCN(C)CC2)c(C)c1OC ZINC000519220414 927834252 /nfs/dbraw/zinc/83/42/52/927834252.db2.gz GSEKTSYQSYKKKJ-UHFFFAOYSA-N 0 3 414.571 4.475 20 0 HIADHN Cc1ccc(OC2CCN(C(=O)N[C@@H]3CCN(Cc4ccccc4)C3)CC2)cc1C ZINC000519250703 927847162 /nfs/dbraw/zinc/84/71/62/927847162.db2.gz IWSZWCLCYHAEMF-JOCHJYFZSA-N 0 3 407.558 4.131 20 0 HIADHN Cc1ccc(OC2CCN(C(=O)N[C@H]3CCN(Cc4ccccc4)C3)CC2)cc1C ZINC000519250704 927847194 /nfs/dbraw/zinc/84/71/94/927847194.db2.gz IWSZWCLCYHAEMF-QFIPXVFZSA-N 0 3 407.558 4.131 20 0 HIADHN CCCNC(=O)c1ccc(NC(=O)NC[C@@H](c2ccc(C)cc2)N(C)C)cc1Cl ZINC000519259085 927851581 /nfs/dbraw/zinc/85/15/81/927851581.db2.gz DMLSOPLUTHCPKW-FQEVSTJZSA-N 0 3 416.953 4.213 20 0 HIADHN CC[C@@H](CNC(=O)N(C)[C@H](C)c1sc(C)nc1C)N1CCc2ccccc2C1 ZINC000519293814 927866615 /nfs/dbraw/zinc/86/66/15/927866615.db2.gz RNGJDQKBSNSSPQ-UZLBHIALSA-N 0 3 400.592 4.299 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)c1cccc(NC(=O)C2CCCCC2)c1 ZINC000519413526 927932438 /nfs/dbraw/zinc/93/24/38/927932438.db2.gz FCUYFNBTTONPLF-UHFFFAOYSA-N 0 3 407.558 4.409 20 0 HIADHN COc1ccccc1[C@@H](NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1)c1ccccc1 ZINC000519440470 927949781 /nfs/dbraw/zinc/94/97/81/927949781.db2.gz IJYVZGNZFPDNRR-RDGATRHJSA-N 0 3 415.537 4.358 20 0 HIADHN COCCN(CCCc1ccccc1)C(=O)N[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000519488739 927986127 /nfs/dbraw/zinc/98/61/27/927986127.db2.gz LNHSSKJWSAGQSO-QPPBQGQZSA-N 0 3 409.574 4.113 20 0 HIADHN Cn1c(CC(C)(C)C)nnc1N1CCCN(Cc2ccc(C(F)(F)F)cc2)CC1 ZINC000519733216 928062635 /nfs/dbraw/zinc/06/26/35/928062635.db2.gz XUBNJRFQXWMAMN-UHFFFAOYSA-N 0 3 409.500 4.135 20 0 HIADHN CN1CCN(CC2=Cc3cc(Br)ccc3OC2)C[C@@H]1Cc1ccccc1 ZINC000519773078 928070897 /nfs/dbraw/zinc/07/08/97/928070897.db2.gz SINVXGWXDZHJOW-NRFANRHFSA-N 0 3 413.359 4.084 20 0 HIADHN Cc1noc(C)c1COc1ccccc1C(=O)N[C@@H]1CCN(Cc2ccccc2)[C@@H]1C ZINC000519787469 928075033 /nfs/dbraw/zinc/07/50/33/928075033.db2.gz FHRNSUHSQFMAJQ-WZONZLPQSA-N 0 3 419.525 4.263 20 0 HIADHN Cc1nc2ccccn2c(=O)c1CCN(Cc1csc(Br)c1)C1CC1 ZINC000519852084 928096230 /nfs/dbraw/zinc/09/62/30/928096230.db2.gz SNMKUYOCZWPCJN-UHFFFAOYSA-N 0 3 418.360 4.034 20 0 HIADHN CC(=O)Nc1ccc(OC[C@H](O)CN(C)[C@@H](C)c2cccc(C(F)(F)F)c2)cc1 ZINC000519903515 928138312 /nfs/dbraw/zinc/13/83/12/928138312.db2.gz JPBKBLCEYDJSBT-IFXJQAMLSA-N 0 3 410.436 4.097 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N2CCO[C@@H](c3ccc(F)cc3)C2)N2CCCC2)cc1 ZINC000519936008 928169317 /nfs/dbraw/zinc/16/93/17/928169317.db2.gz ZUECQXUIZQQVHQ-XZOQPEGZSA-N 0 3 411.521 4.054 20 0 HIADHN CC(C)(CNC(=O)N[C@H]1CCCOc2ccc(F)cc21)N1CCc2ccccc2C1 ZINC000519970507 928197570 /nfs/dbraw/zinc/19/75/70/928197570.db2.gz QYARFLGWZCLCQQ-NRFANRHFSA-N 0 3 411.521 4.176 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)N[C@@H]1CCOc2c(Cl)cccc21 ZINC000520058138 928281906 /nfs/dbraw/zinc/28/19/06/928281906.db2.gz QFWORWNBGROJBD-OAQYLSRUSA-N 0 3 415.965 4.370 20 0 HIADHN CC(=O)Nc1ccc(Cl)c(NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)c1 ZINC000520111724 928316846 /nfs/dbraw/zinc/31/68/46/928316846.db2.gz OYRHEKZOUBJPTE-MRXNPFEDSA-N 0 3 403.885 4.288 20 0 HIADHN CN(C)CCN(C(=O)c1cccc(NC(=O)c2ccc(F)cc2)c1)c1ccccc1 ZINC000520166770 928356913 /nfs/dbraw/zinc/35/69/13/928356913.db2.gz TXTVHLURGMXFPH-UHFFFAOYSA-N 0 3 405.473 4.286 20 0 HIADHN COc1ccc(C[C@@](C)(O)CN[C@H](C)c2nc(-c3ccccc3)cs2)cc1OC ZINC000520212396 928390899 /nfs/dbraw/zinc/39/08/99/928390899.db2.gz HGYBQHOZFIIKSJ-WAIKUNEKSA-N 0 3 412.555 4.472 20 0 HIADHN O[C@@H](CNCc1ccccc1OC(F)(F)F)COc1ccc(C(F)(F)F)cc1 ZINC000520215888 928393322 /nfs/dbraw/zinc/39/33/22/928393322.db2.gz YLEJJIXISQIURK-AWEZNQCLSA-N 0 3 409.326 4.134 20 0 HIADHN Brc1ccc2c(c1)C=C(CNCc1ccc3c(c1)OCCCO3)CO2 ZINC000520218868 928395165 /nfs/dbraw/zinc/39/51/65/928395165.db2.gz YLEKSXLPKSEUTR-UHFFFAOYSA-N 0 3 402.288 4.176 20 0 HIADHN CCn1c(Cc2ccccc2)nnc1SC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000520261097 928425091 /nfs/dbraw/zinc/42/50/91/928425091.db2.gz OEWGVSXZQGQGLN-JOCHJYFZSA-N 0 3 422.598 4.272 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)Nc1ccc(-c2nccs2)cc1 ZINC000520306931 928468544 /nfs/dbraw/zinc/46/85/44/928468544.db2.gz LOMGOLKZCNKGKU-UHFFFAOYSA-N 0 3 406.555 4.351 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2Cl)c(C)c1CC(=O)N(C)[C@H]1CCN(C2CC2)C1 ZINC000520318159 928480190 /nfs/dbraw/zinc/48/01/90/928480190.db2.gz AMNGRGLTELWQEO-KRWDZBQOSA-N 0 3 421.372 4.034 20 0 HIADHN CN(C(=O)Cc1csc(-c2cccc(C(F)(F)F)c2)n1)[C@@H]1CCN(C2CC2)C1 ZINC000520319691 928482308 /nfs/dbraw/zinc/48/23/08/928482308.db2.gz WWWUMBIGPHCRRR-QGZVFWFLSA-N 0 3 409.477 4.067 20 0 HIADHN CCN1CCCN(C(=O)c2ccccc2OCc2ccc(Br)cc2)CC1 ZINC000520352417 928514886 /nfs/dbraw/zinc/51/48/86/928514886.db2.gz ZRWVWUWOBQIUMD-UHFFFAOYSA-N 0 3 417.347 4.196 20 0 HIADHN COc1cccc(CN(C[C@@H](O)COc2cccc3ccccc32)C[C@H]2CCCO2)c1 ZINC000520386901 928539497 /nfs/dbraw/zinc/53/94/97/928539497.db2.gz HTNDDFSBYDCWMR-ISKFKSNPSA-N 0 3 421.537 4.269 20 0 HIADHN COc1cccc(CN(C[C@@H](O)COc2cccc3ccccc32)C[C@@H]2CCCO2)c1 ZINC000520386903 928539643 /nfs/dbraw/zinc/53/96/43/928539643.db2.gz HTNDDFSBYDCWMR-VWNXMTODSA-N 0 3 421.537 4.269 20 0 HIADHN COc1ccc(C)cc1CCNCc1nc(-c2cccc(Br)c2)c[nH]1 ZINC000520388391 928540883 /nfs/dbraw/zinc/54/08/83/928540883.db2.gz RPTMBSITEKDMLS-UHFFFAOYSA-N 0 3 400.320 4.489 20 0 HIADHN CC[C@@H](CNC(=O)Cc1coc(-c2ccc(Cl)cc2)n1)N1CCc2ccccc2C1 ZINC000520511443 928611026 /nfs/dbraw/zinc/61/10/26/928611026.db2.gz ZDNIMKFFSYAKAM-QFIPXVFZSA-N 0 3 423.944 4.491 20 0 HIADHN COc1ccccc1COC[C@H](O)CN1CCC[C@@H]1Cc1c(F)cccc1Cl ZINC000520523814 928617494 /nfs/dbraw/zinc/61/74/94/928617494.db2.gz JEUMWOPADVHHFU-QZTJIDSGSA-N 0 3 407.913 4.072 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)Nc1cccc(OC[C@H]2CCCO2)c1 ZINC000520536031 928627092 /nfs/dbraw/zinc/62/70/92/928627092.db2.gz PBGBFEYUXVVWKD-UXHICEINSA-N 0 3 415.559 4.265 20 0 HIADHN CC(C)(C)c1csc(CCNC(=O)N[C@@H](CN2CCCC2)c2ccccc2)n1 ZINC000520560985 928642143 /nfs/dbraw/zinc/64/21/43/928642143.db2.gz ZYEZTHDKKURZIB-SFHVURJKSA-N 0 3 400.592 4.119 20 0 HIADHN CC[C@@H](C)NC(=O)c1ccc(NC(=O)N[C@H](CN2CCCC2)c2ccccc2)c(C)c1 ZINC000520600916 928665004 /nfs/dbraw/zinc/66/50/04/928665004.db2.gz UWBVTDWAPTXEMQ-AUSIDOKSSA-N 0 3 422.573 4.482 20 0 HIADHN COCc1cccc2sc(NC(=O)N(CCN(C)C)Cc3cccc(C)c3)nc21 ZINC000520603297 928668862 /nfs/dbraw/zinc/66/88/62/928668862.db2.gz CXTHBMROADOXPK-UHFFFAOYSA-N 0 3 412.559 4.347 20 0 HIADHN COc1cccc(OC)c1OC[C@@H](O)CN(C)[C@H](C)c1ccc(Cl)c(Cl)c1 ZINC000520695052 928742055 /nfs/dbraw/zinc/74/20/55/928742055.db2.gz MENAOKOWQACWPM-HIFRSBDPSA-N 0 3 414.329 4.443 20 0 HIADHN C[C@@H](NC(=O)NC[C@@H]1CCCCN1C1CC1)c1ccc(OCc2cccnc2)cc1 ZINC000520706553 928753904 /nfs/dbraw/zinc/75/39/04/928753904.db2.gz WMQADKQUXPXHHR-GCJKJVERSA-N 0 3 408.546 4.038 20 0 HIADHN O=C(N[C@@H](c1ccc(F)cc1)[C@@H]1CCCO1)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000520753945 928802292 /nfs/dbraw/zinc/80/22/92/928802292.db2.gz RCXSDJFNQBNBCX-VJBWXMMDSA-N 0 3 411.521 4.010 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)[C@@H]3C[C@@H]3c3cccc4ccccc43)CC2)C[C@H](C)O1 ZINC000520762368 928806240 /nfs/dbraw/zinc/80/62/40/928806240.db2.gz TVFWEEKAGBYOMO-APTYZTEPSA-N 0 3 406.570 4.291 20 0 HIADHN Cn1c2ccccc2nc1[C@@H]1CCCN1C(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000520813444 928830144 /nfs/dbraw/zinc/83/01/44/928830144.db2.gz GQRQQXNEXNYRCS-XXBNENTESA-N 0 3 420.532 4.288 20 0 HIADHN C[C@H]1CN(c2ccccc2NC(=O)N2CCN(CC3CCCCC3)CC2)C[C@H](C)O1 ZINC000520826917 928834683 /nfs/dbraw/zinc/83/46/83/928834683.db2.gz XTXCOZSKDDYVHL-PMACEKPBSA-N 0 3 414.594 4.030 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2ccccc2OC[C@H]2CCCCO2)N(C)C)cc1 ZINC000520831226 928836267 /nfs/dbraw/zinc/83/62/67/928836267.db2.gz XTEHVIYCQKXRTN-IRLDBZIGSA-N 0 3 411.546 4.367 20 0 HIADHN CCOc1cc(CN2CC[C@H](CO)C[C@@H]2C)ccc1OCCOc1ccc(F)cc1 ZINC000520895235 928864214 /nfs/dbraw/zinc/86/42/14/928864214.db2.gz ZOWMAUBZXHGJJP-ICSRJNTNSA-N 0 3 417.521 4.275 20 0 HIADHN Cc1cc(C)n(-c2ccc(CC(=O)N(CCN(C)C)Cc3cccc(Cl)c3)cc2)n1 ZINC000520990419 928908088 /nfs/dbraw/zinc/90/80/88/928908088.db2.gz MYGQGQJDYAPYHR-UHFFFAOYSA-N 0 3 424.976 4.275 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3cccc(-c4nccs4)c3)CC2)C[C@H](C)O1 ZINC000521007348 928922564 /nfs/dbraw/zinc/92/25/64/928922564.db2.gz KBWBIXFZLPYZCL-CALCHBBNSA-N 0 3 414.575 4.163 20 0 HIADHN O=C(NCc1cc(F)cc(Br)c1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000521011975 928928857 /nfs/dbraw/zinc/92/88/57/928928857.db2.gz SMBJSDJEXMEDNI-INIZCTEOSA-N 0 3 423.301 4.256 20 0 HIADHN C[C@@H](NCC1(Sc2ccccc2)CCCC1)C(=O)N1CC(=O)Nc2ccccc21 ZINC000521012350 928929519 /nfs/dbraw/zinc/92/95/19/928929519.db2.gz DRKPFULPOYVLGV-QGZVFWFLSA-N 0 3 409.555 4.055 20 0 HIADHN O=C(NC[C@@H]1CCCO[C@@H]1c1ccccc1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000521014498 928931232 /nfs/dbraw/zinc/93/12/32/928931232.db2.gz WEZCJWAAONDNSZ-WPFOTENUSA-N 0 3 410.533 4.322 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)NCCc1csc2ccccc12 ZINC000521070140 928971678 /nfs/dbraw/zinc/97/16/78/928971678.db2.gz IBMOARIRYPFDQG-UHFFFAOYSA-N 0 3 417.525 4.495 20 0 HIADHN C[C@H](CNC(=O)c1cccc(NC(=O)C2CCCCC2)c1)N(C)Cc1ccccc1 ZINC000521096405 928992184 /nfs/dbraw/zinc/99/21/84/928992184.db2.gz IKXFDKANHIFLLG-LJQANCHMSA-N 0 3 407.558 4.456 20 0 HIADHN CC(C)c1ccc(-c2noc(CCC(=O)N(CCN(C)C)c3ccccc3)n2)cc1 ZINC000521182673 929048417 /nfs/dbraw/zinc/04/84/17/929048417.db2.gz WYOSAJYUINSNOF-UHFFFAOYSA-N 0 3 406.530 4.387 20 0 HIADHN Cc1ccc(NC(=O)NC[C@@H](c2cccs2)N2CCCC2)cc1C(=O)NC(C)C ZINC000521303788 929113994 /nfs/dbraw/zinc/11/39/94/929113994.db2.gz LDIGMKZOQCRVCR-IBGZPJMESA-N 0 3 414.575 4.153 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NC[C@@H](C)COCc3ccccc3)c(C)c2)CC1 ZINC000521424081 929215565 /nfs/dbraw/zinc/21/55/65/929215565.db2.gz UPPWFZBKHVVJLS-HXUWFJFHSA-N 0 3 424.589 4.111 20 0 HIADHN Cc1cc(I)ccc1NC(=O)[C@@H](C(C)C)N1CCCCC1 ZINC000521442196 929223968 /nfs/dbraw/zinc/22/39/68/929223968.db2.gz ULWWGDLKFMLEAJ-MRXNPFEDSA-N 0 3 400.304 4.049 20 0 HIADHN CC(C)[C@H](C(=O)Nc1ccc(C(=O)N2CCc3ccccc32)cc1)N1CCCCC1 ZINC000521462220 929232129 /nfs/dbraw/zinc/23/21/29/929232129.db2.gz CVNYYLFUIKSWFL-HSZRJFAPSA-N 0 3 405.542 4.339 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2ccc(C(=O)N3CCCC[C@H]3C)cc2)N(C)C)cc1 ZINC000521468105 929235058 /nfs/dbraw/zinc/23/50/58/929235058.db2.gz QVWUHDOSHWDSHU-AUSIDOKSSA-N 0 3 422.573 4.434 20 0 HIADHN CSc1cc(C(=O)NC[C@H]2CCCCN2Cc2ccccc2)ccc1NC(C)=O ZINC000521479272 929242579 /nfs/dbraw/zinc/24/25/79/929242579.db2.gz LQQQDHPKCJWOMP-HXUWFJFHSA-N 0 3 411.571 4.151 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)c2cc(-c3ccccc3)nc3onc(C)c32)o1 ZINC000521700856 929375982 /nfs/dbraw/zinc/37/59/82/929375982.db2.gz GKMZWVXUXSUCQG-UHFFFAOYSA-N 0 3 418.497 4.304 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCc1cccc2cccnc21)c1cccc(OC)c1 ZINC000521715361 929383804 /nfs/dbraw/zinc/38/38/04/929383804.db2.gz NQCSJXPFMURWDH-QFIPXVFZSA-N 0 3 406.530 4.126 20 0 HIADHN CC[C@H](NC(=O)NCC1(N2CCOC(C)(C)C2)CCCCC1)c1nc(C)cs1 ZINC000521781381 929440450 /nfs/dbraw/zinc/44/04/50/929440450.db2.gz YHALGZYIKMYTHX-KRWDZBQOSA-N 0 3 408.612 4.016 20 0 HIADHN CCN(C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1)[C@H](C)Cc1ccc(OC)cc1 ZINC000521811298 929469589 /nfs/dbraw/zinc/46/95/89/929469589.db2.gz BPPACVDCIKFQIK-NFBKMPQASA-N 0 3 409.574 4.322 20 0 HIADHN CCN(C(=O)N[C@H]1CCCN(Cc2ccccc2)C1)[C@H](C)Cc1ccc(OC)cc1 ZINC000521811300 929470038 /nfs/dbraw/zinc/47/00/38/929470038.db2.gz BPPACVDCIKFQIK-OFNKIYASSA-N 0 3 409.574 4.322 20 0 HIADHN CCN(C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1)[C@@H](C)Cc1ccc(OC)cc1 ZINC000521811299 929470198 /nfs/dbraw/zinc/47/01/98/929470198.db2.gz BPPACVDCIKFQIK-NZQKXSOJSA-N 0 3 409.574 4.322 20 0 HIADHN CC[C@@H](C)[C@H](NCc1cnc2n[nH]c(C)c2c1)C(=O)Nc1cccc(N2CCCC2)c1 ZINC000521831627 929483809 /nfs/dbraw/zinc/48/38/09/929483809.db2.gz BLZUYESTHBYQHQ-ZHRRBRCNSA-N 0 3 420.561 4.010 20 0 HIADHN COc1ccccc1C[C@H]1CCCN1C(=O)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000521893241 929540098 /nfs/dbraw/zinc/54/00/98/929540098.db2.gz GBRZDMAIHLMOLI-PKTZIBPZSA-N 0 3 407.558 4.249 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)NCC1(c2ccc(Cl)cc2)CC1 ZINC000521955496 929591174 /nfs/dbraw/zinc/59/11/74/929591174.db2.gz JIYOYNREYAWFKT-UHFFFAOYSA-N 0 3 411.977 4.090 20 0 HIADHN O=S(=O)(CCCNCc1cc(Cl)cc2cccnc21)c1ccc(Cl)cc1 ZINC000522017685 929619260 /nfs/dbraw/zinc/61/92/60/929619260.db2.gz SCUAPRNTBSZKGQ-UHFFFAOYSA-N 0 3 409.338 4.495 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)C[C@@H]1OCCc2ccccc21 ZINC000524488384 929634887 /nfs/dbraw/zinc/63/48/87/929634887.db2.gz PZMFXGJPLNZKQH-NRFANRHFSA-N 0 3 420.475 4.300 20 0 HIADHN CCN1CCN(C[C@@H](C)CNc2ncnc3scc(-c4ccc(F)cc4)c32)CC1 ZINC000524491331 929638763 /nfs/dbraw/zinc/63/87/63/929638763.db2.gz NCEOGDKIPLVAKU-INIZCTEOSA-N 0 3 413.566 4.183 20 0 HIADHN CCCCN(CCCC)S(=O)(=O)N(C)[C@@H]1CCN(Cc2ccccc2)[C@H](C)C1 ZINC000524585837 929700430 /nfs/dbraw/zinc/70/04/30/929700430.db2.gz APTFGQCOCLRARO-IFMALSPDSA-N 0 3 409.640 4.118 20 0 HIADHN CCOc1ccc(S(=O)(=O)N(C)[C@@H]2CCN(Cc3ccccc3)[C@H](C)C2)c(C)c1 ZINC000524587705 929701154 /nfs/dbraw/zinc/70/11/54/929701154.db2.gz XZXLDGLPLLGLHA-TZIWHRDSSA-N 0 3 416.587 4.067 20 0 HIADHN C[C@H](CNC(=O)c1ccccc1C(=O)c1ccc(Cl)c(Cl)c1)N(C)C1CC1 ZINC000524596162 929705266 /nfs/dbraw/zinc/70/52/66/929705266.db2.gz MPNSJSIAFBVFSK-CYBMUJFWSA-N 0 3 405.325 4.437 20 0 HIADHN C[C@@H](SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)NCCN1CC[C@@H](C)C1 ZINC000524720407 929809043 /nfs/dbraw/zinc/80/90/43/929809043.db2.gz PCGMXINHHFSPSZ-HUUCEWRRSA-N 0 3 407.967 4.075 20 0 HIADHN C[C@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)NCCCCN1CCN(C)CC1 ZINC000524785949 929828753 /nfs/dbraw/zinc/82/87/53/929828753.db2.gz AZUORSBTQKJINR-OAQYLSRUSA-N 0 3 408.590 4.084 20 0 HIADHN CC[C@@H](C)n1ncc2c1nc(C)cc2C(=O)N1CCCN(Cc2ccccc2)C[C@H]1C ZINC000524866851 929865376 /nfs/dbraw/zinc/86/53/76/929865376.db2.gz JZCWNYMSBVVKNK-WOJBJXKFSA-N 0 3 419.573 4.447 20 0 HIADHN Cc1[nH]c2ccccc2c1CCNC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C ZINC000524882918 929871114 /nfs/dbraw/zinc/87/11/14/929871114.db2.gz OKCKOHDKLZDUDM-IBGZPJMESA-N 0 3 404.558 4.325 20 0 HIADHN Cc1ccc(NC(=O)C2CC2)cc1NC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C ZINC000524896342 929877318 /nfs/dbraw/zinc/87/73/18/929877318.db2.gz QZWNDOPXHYVTNO-IBGZPJMESA-N 0 3 420.557 4.472 20 0 HIADHN O=C(CC1CCCC1)NC1CCN(CCc2nc(-c3ccc(Cl)cc3)no2)CC1 ZINC000524906090 929882819 /nfs/dbraw/zinc/88/28/19/929882819.db2.gz ABHUONWZQLDQAN-UHFFFAOYSA-N 0 3 416.953 4.093 20 0 HIADHN CN(CCN1CCCC1)C(=O)c1cccc(Sc2cccc(Br)c2)n1 ZINC000525055077 930006918 /nfs/dbraw/zinc/00/69/18/930006918.db2.gz PKMVBQYQRCJZLW-UHFFFAOYSA-N 0 3 420.376 4.163 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)C[C@@H]2CCCc3ccccc32)cc1)[C@@H]1CCCN(C)C1 ZINC000525065780 930013586 /nfs/dbraw/zinc/01/35/86/930013586.db2.gz TUYUDZWJHDHPLZ-JTHBVZDNSA-N 0 3 419.569 4.302 20 0 HIADHN CCc1ccc([C@H](CNC(=O)c2ccc(C(=O)NCC(C)(C)C)cc2)N(C)C)cc1 ZINC000525071531 930017335 /nfs/dbraw/zinc/01/73/35/930017335.db2.gz WZFRNVCZZNMMBP-QFIPXVFZSA-N 0 3 409.574 4.058 20 0 HIADHN C[C@@H]1CN(C(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)C[C@@H](c2ccc(F)cc2)O1 ZINC000525095995 930032443 /nfs/dbraw/zinc/03/24/43/930032443.db2.gz OKAWYIPHCORQAH-LLBVYWAGSA-N 0 3 414.496 4.165 20 0 HIADHN COC(=O)c1cc2cc(CN(Cc3ccc(C(=O)NC4CC4)cc3)C3CC3)ccc2o1 ZINC000525120355 930048205 /nfs/dbraw/zinc/04/82/05/930048205.db2.gz ONACJHXFKHQUFF-UHFFFAOYSA-N 0 3 418.493 4.276 20 0 HIADHN C[C@@H]1CN(CC(=O)N2CCC[C@@H]2c2ccc3c(c2)OCCO3)CC[C@@H]1c1ccccc1 ZINC000525121981 930049119 /nfs/dbraw/zinc/04/91/19/930049119.db2.gz OAQXUYCSGPCEQQ-WTIAFYNJSA-N 0 3 420.553 4.247 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@H](C)N2CC[C@H](c3ccccc3)[C@@H](C)C2)cc1OC ZINC000525126130 930050589 /nfs/dbraw/zinc/05/05/89/930050589.db2.gz PXLJYBQCHMJNTB-IPJJNNNSSA-N 0 3 410.558 4.176 20 0 HIADHN CSc1cccc(N(C(=O)[C@H](C)Cc2c(C)nn(C)c2C)C2CCN(C)CC2)c1 ZINC000525136692 930056156 /nfs/dbraw/zinc/05/61/56/930056156.db2.gz AKIXYDCMIITZRA-MRXNPFEDSA-N 0 3 414.619 4.065 20 0 HIADHN COc1ccc(Br)cc1CC(=O)N(CCN1CCCC1)c1ccccc1 ZINC000525165591 930073362 /nfs/dbraw/zinc/07/33/62/930073362.db2.gz JXRXCWSHARMPAK-UHFFFAOYSA-N 0 3 417.347 4.129 20 0 HIADHN CCN1CCN(c2ccc(C(=O)NCc3sc(-c4ccccc4)nc3C)cc2)CC1 ZINC000525243386 930102043 /nfs/dbraw/zinc/10/20/43/930102043.db2.gz MQKJCUMGUISJBQ-UHFFFAOYSA-N 0 3 420.582 4.190 20 0 HIADHN FC(F)(F)COc1ccccc1CN1CCC(n2cc(Br)cn2)CC1 ZINC000525271942 930122064 /nfs/dbraw/zinc/12/20/64/930122064.db2.gz WNRAQNSCAVLKKI-UHFFFAOYSA-N 0 3 418.257 4.424 20 0 HIADHN CC(C)c1ccc([C@@H]2C[C@H]2C(=O)Nc2ccccc2CN2CCC[C@@H](C(N)=O)C2)cc1 ZINC000525314599 930152772 /nfs/dbraw/zinc/15/27/72/930152772.db2.gz QADOBDBGDOVCIV-XPWALMASSA-N 0 3 419.569 4.250 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)NCC1(c2cccc(F)c2)CC1 ZINC000525318827 930157741 /nfs/dbraw/zinc/15/77/41/930157741.db2.gz ZAZFPGWFVJHFIE-UHFFFAOYSA-N 0 3 403.929 4.284 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)Nc1ccc(F)cc1OCC1CC1 ZINC000525356638 930193612 /nfs/dbraw/zinc/19/36/12/930193612.db2.gz FHZGMQOJQZFQBZ-UHFFFAOYSA-N 0 3 411.521 4.155 20 0 HIADHN Cc1ccc(C(=O)NC[C@H]2CCCN2Cc2ccccc2)cc1NC(=O)NC(C)(C)C ZINC000525375610 930204656 /nfs/dbraw/zinc/20/46/56/930204656.db2.gz WRUVLHDBAHLWHK-OAQYLSRUSA-N 0 3 422.573 4.309 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)Cc1ccc(Br)s1 ZINC000525383003 930210362 /nfs/dbraw/zinc/21/03/62/930210362.db2.gz ODWBZGAYPNMUGD-OAHLLOKOSA-N 0 3 407.377 4.176 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)NCCCCN(C)c1ccccc1 ZINC000525398736 930218883 /nfs/dbraw/zinc/21/88/83/930218883.db2.gz LELMZATUBRITTM-QFIPXVFZSA-N 0 3 408.590 4.209 20 0 HIADHN C[C@H](COc1ccc(F)cc1F)NC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C ZINC000525416265 930228699 /nfs/dbraw/zinc/22/86/99/930228699.db2.gz LMUORETUDYKCEF-MSOLQXFVSA-N 0 3 417.500 4.038 20 0 HIADHN CC[C@H](NC(=O)N(CCN(C)C)Cc1ccc(F)cc1F)c1cc(F)ccc1F ZINC000525441379 930241905 /nfs/dbraw/zinc/24/19/05/930241905.db2.gz KOPMNPBCTYVRLO-FQEVSTJZSA-N 0 3 411.443 4.468 20 0 HIADHN COc1ccc(-c2[nH]c3ccccc3c2CCC(=O)N(C)[C@@H]2CCCN(C)C2)cc1 ZINC000525524201 930301581 /nfs/dbraw/zinc/30/15/81/930301581.db2.gz LDLOUIKXXYOWAA-LJQANCHMSA-N 0 3 405.542 4.329 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cnc(-c2ccncc2)s1)c1cccc(OC)c1 ZINC000525579048 930341545 /nfs/dbraw/zinc/34/15/45/930341545.db2.gz XCSICACACWWLRA-IBGZPJMESA-N 0 3 410.543 4.027 20 0 HIADHN CCN(CC)[C@H](CNC(=O)[C@@H]1C[C@H]1c1cccc(F)c1F)c1cccc(OC)c1 ZINC000525578727 930341554 /nfs/dbraw/zinc/34/15/54/930341554.db2.gz DNAAGZVSSDVPMY-QKNQBKEWSA-N 0 3 402.485 4.276 20 0 HIADHN CCN(CC)[C@H](CNC(=O)[C@@H]1C[C@@H]1c1cccc(F)c1F)c1cccc(OC)c1 ZINC000525578728 930341978 /nfs/dbraw/zinc/34/19/78/930341978.db2.gz DNAAGZVSSDVPMY-SFHLNBCPSA-N 0 3 402.485 4.276 20 0 HIADHN O=C1COc2ccccc2N1CCCNCc1csc(-c2ccc(Cl)cc2)n1 ZINC000525708442 930412330 /nfs/dbraw/zinc/41/23/30/930412330.db2.gz PHAQYWWIURGHOA-UHFFFAOYSA-N 0 3 413.930 4.369 20 0 HIADHN CC(C)(C)CCN1CCN(C(=O)Nc2cccc(CC(=O)OC(C)(C)C)c2)CC1 ZINC000525741457 930423559 /nfs/dbraw/zinc/42/35/59/930423559.db2.gz CQPAUSWREWQHKF-UHFFFAOYSA-N 0 3 403.567 4.157 20 0 HIADHN Fc1cc(Br)cc(OCCN2CCC(OC[C@H]3CCCCO3)CC2)c1 ZINC000525834132 930460307 /nfs/dbraw/zinc/46/03/07/930460307.db2.gz ZAHNDNSVXWUCTJ-GOSISDBHSA-N 0 3 416.331 4.017 20 0 HIADHN CN(CCc1ccccn1)Cc1cc(Br)ccc1OCc1ccccn1 ZINC000525867492 930472383 /nfs/dbraw/zinc/47/23/83/930472383.db2.gz GJEUEAFGKPUMKZ-UHFFFAOYSA-N 0 3 412.331 4.493 20 0 HIADHN C[C@@H](CN[C@@H](C(N)=O)c1ccc(Br)cc1)c1ccc(C(F)(F)F)cc1 ZINC000525951892 930492709 /nfs/dbraw/zinc/49/27/09/930492709.db2.gz ISLHTVOLDINLFQ-MEDUHNTESA-N 0 3 415.253 4.388 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)N[C@@H](C)[C@@H](c3ccccc3C)[NH+](C)C)cc2)cc(=O)[n-]1 ZINC000525955521 930493934 /nfs/dbraw/zinc/49/39/34/930493934.db2.gz ALBKLTAOOMJXSH-HJPURHCSSA-N 0 3 419.529 4.279 20 0 HIADHN COCCOc1ccc(CN[C@H]2CC(C)(C)c3ccc(Br)cc32)cn1 ZINC000526041560 930512597 /nfs/dbraw/zinc/51/25/97/930512597.db2.gz NEKFMBURKFOXJF-SFHVURJKSA-N 0 3 405.336 4.382 20 0 HIADHN COc1cc(CN(C)Cc2ccc(Cl)cc2-n2cncn2)ccc1OC(F)F ZINC000526969679 930559926 /nfs/dbraw/zinc/55/99/26/930559926.db2.gz LPKNBRSUVNTPFI-UHFFFAOYSA-N 0 3 408.836 4.163 20 0 HIADHN Cc1ccc(C)c(NC(=O)[C@H](N[C@@H]2CCCC[C@@H]2N2CCOCC2)c2ccccc2)c1 ZINC000530366634 930697184 /nfs/dbraw/zinc/69/71/84/930697184.db2.gz PTCJYDBURUFRKC-PZUNEJSGSA-N 0 3 421.585 4.216 20 0 HIADHN CCC(C)(C)NC(=O)c1ccc(NC(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)cc1 ZINC000530409368 930703127 /nfs/dbraw/zinc/70/31/27/930703127.db2.gz XDGXEZMKEGEUAY-NHCUHLMSSA-N 0 3 408.546 4.172 20 0 HIADHN Cc1cc(C)n(-c2ccc(NC(=O)N[C@H]3CCN(C)[C@@H]3c3ccccc3)cc2F)n1 ZINC000530409928 930705407 /nfs/dbraw/zinc/70/54/07/930705407.db2.gz ZVYVVFSXRVUJOM-RBBKRZOGSA-N 0 3 407.493 4.195 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2cnn(Cc3ccc(Cl)cc3)c2)[C@H]1c1ccccc1 ZINC000530512910 930732455 /nfs/dbraw/zinc/73/24/55/930732455.db2.gz OVYFXQSNTGAXAD-LEWJYISDSA-N 0 3 409.921 4.152 20 0 HIADHN CCCNC(=O)c1ccc(NC(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)cc1Cl ZINC000530515314 930735045 /nfs/dbraw/zinc/73/50/45/930735045.db2.gz WCGKBJCSUHYIML-UXHICEINSA-N 0 3 414.937 4.047 20 0 HIADHN O=C([C@@H]1CCCCN1Cc1ccccc1)N1CC=C(c2c[nH]c3ncccc23)CC1 ZINC000530565512 930750332 /nfs/dbraw/zinc/75/03/32/930750332.db2.gz ROWBONMFQPQTQO-QHCPKHFHSA-N 0 3 400.526 4.233 20 0 HIADHN C[C@H](NC(=O)[C@H]1CCCN(Cc2cccnc2)C1)c1ccc(-c2ccncc2)cc1 ZINC000530580326 930757539 /nfs/dbraw/zinc/75/75/39/930757539.db2.gz OTDHZMCERXIQKL-CYFREDJKSA-N 0 3 400.526 4.233 20 0 HIADHN CN(C(=O)NCc1ncc(-c2ccccc2)o1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000530587049 930760159 /nfs/dbraw/zinc/76/01/59/930760159.db2.gz JKTMUMIICJMBKR-OAQYLSRUSA-N 0 3 404.514 4.148 20 0 HIADHN CN(CC(=O)N(Cc1ccc(F)cc1)C12CC3CC(CC(C3)C1)C2)C1CCOCC1 ZINC000530627450 930778118 /nfs/dbraw/zinc/77/81/18/930778118.db2.gz YQBZBGVGKNDSLT-UHFFFAOYSA-N 0 3 414.565 4.234 20 0 HIADHN CN(C)Cc1ccc(-c2noc([C@@H]3CCCN(C(=O)c4ccc(Cl)cc4)C3)n2)cc1 ZINC000530632709 930780507 /nfs/dbraw/zinc/78/05/07/930780507.db2.gz FBFFOHZFKCMUJW-LJQANCHMSA-N 0 3 424.932 4.471 20 0 HIADHN COc1cc(C)c(CN[C@H](Cc2ccccc2)C(=O)NCc2ccccc2)cc1OC ZINC000530722978 930808483 /nfs/dbraw/zinc/80/84/83/930808483.db2.gz DURIIIAIRNCWKQ-HSZRJFAPSA-N 0 3 418.537 4.030 20 0 HIADHN Cc1ccc2cccc(S(=O)(=O)N(C)[C@@H]3CCN(Cc4ccccc4)[C@@H](C)C3)c2n1 ZINC000530771919 930820441 /nfs/dbraw/zinc/82/04/41/930820441.db2.gz OMJSEONZFGGYSG-SIKLNZKXSA-N 0 3 423.582 4.217 20 0 HIADHN Cc1cccc(Oc2ccc(NC(=O)[C@@]3(O)CCN(Cc4ccccc4)C3)cn2)c1C ZINC000530823909 930832436 /nfs/dbraw/zinc/83/24/36/930832436.db2.gz VVBDVWMKQWVGAV-RUZDIDTESA-N 0 3 417.509 4.066 20 0 HIADHN O=C(c1c[nH]nc1-c1cccnc1)N1CCN(Cc2ccccc2)C2(CCCCC2)C1 ZINC000530881306 930848323 /nfs/dbraw/zinc/84/83/23/930848323.db2.gz OAWBDYKBOCVWSY-UHFFFAOYSA-N 0 3 415.541 4.133 20 0 HIADHN O=C(CN(Cc1ccccc1)Cc1ccccc1)NCCc1nc2ccc(F)cc2[nH]1 ZINC000530893242 930852056 /nfs/dbraw/zinc/85/20/56/930852056.db2.gz AGIUZGKVNCCJAH-UHFFFAOYSA-N 0 3 416.500 4.063 20 0 HIADHN COC(=O)c1cc2c(o1)c(OC)ccc2CNCc1cccc(Br)c1 ZINC000530904507 930855215 /nfs/dbraw/zinc/85/52/15/930855215.db2.gz VUVQCIYGJNFNEH-UHFFFAOYSA-N 0 3 404.260 4.280 20 0 HIADHN C[C@H](NC(=O)NC[C@H](c1ccccc1)N1CCCC1)c1cccc(N2CCCC2)c1 ZINC000531027879 930890030 /nfs/dbraw/zinc/89/00/30/930890030.db2.gz FBIGDZSCRDWWFN-GBXCKJPGSA-N 0 3 406.574 4.484 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)CN[C@@H](c2ccccc2)C(F)(F)F)N2CCCC2)cc1 ZINC000531049057 930897278 /nfs/dbraw/zinc/89/72/78/930897278.db2.gz LRJAPWZWTUVHAU-IRLDBZIGSA-N 0 3 419.491 4.141 20 0 HIADHN COc1cc(C[NH2+][C@H]2CCCO[C@H]2c2ccc(C)cc2)cc(Br)c1[O-] ZINC000531094314 930917563 /nfs/dbraw/zinc/91/75/63/930917563.db2.gz AMCYNHHECWCONV-PXNSSMCTSA-N 0 3 406.320 4.482 20 0 HIADHN COc1cc(C[NH2+]C[C@@H](OC)c2ccc(Cl)cc2)cc(Br)c1[O-] ZINC000531094224 930918050 /nfs/dbraw/zinc/91/80/50/930918050.db2.gz PDPXIHZPHHOEAK-MRXNPFEDSA-N 0 3 400.700 4.294 20 0 HIADHN CC(C)n1cc([C@H](C)NC(=O)N[C@@H](CN2CCc3ccccc3C2)C(C)(C)C)cn1 ZINC000531107859 930922088 /nfs/dbraw/zinc/92/20/88/930922088.db2.gz ABWLLRBRZIHPAE-AVRDEDQJSA-N 0 3 411.594 4.297 20 0 HIADHN CS(=O)(=O)c1ccc(OCCCN[C@@H](c2cccs2)c2ccc(F)cc2)cc1 ZINC000531141944 930942076 /nfs/dbraw/zinc/94/20/76/930942076.db2.gz ZAPSUHOSRCWSJI-OAQYLSRUSA-N 0 3 419.543 4.439 20 0 HIADHN CCOc1ccccc1OCCCC(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000531157120 930948070 /nfs/dbraw/zinc/94/80/70/930948070.db2.gz SPOMTHOSLMVAHT-UHFFFAOYSA-N 0 3 410.558 4.367 20 0 HIADHN Cc1[nH]c(=O)c(C(=O)N(CCCc2ccccc2)CCN(C)C)cc1-c1ccccc1 ZINC000531175731 930953457 /nfs/dbraw/zinc/95/34/57/930953457.db2.gz XKKAFJWCQPRYBS-UHFFFAOYSA-N 0 3 417.553 4.399 20 0 HIADHN CCCN1CCC[C@H]1C(=O)Nc1ccc(Cl)c(-c2nnc3n2CCCCC3)c1 ZINC000531305937 931009517 /nfs/dbraw/zinc/00/95/17/931009517.db2.gz BFUQUXXRMLEMGI-SFHVURJKSA-N 0 3 401.942 4.138 20 0 HIADHN CC(C)n1ncc2cc(NC(=O)N(C)[C@H]3CCCN(Cc4ccccc4)C3)cnc21 ZINC000531314778 931013997 /nfs/dbraw/zinc/01/39/97/931013997.db2.gz XYKDWPJRODGSIP-NRFANRHFSA-N 0 3 406.534 4.141 20 0 HIADHN CC(C)n1ncc2cc(NC(=O)N(C)[C@@H]3CCCN(Cc4ccccc4)C3)cnc21 ZINC000531314779 931014424 /nfs/dbraw/zinc/01/44/24/931014424.db2.gz XYKDWPJRODGSIP-OAQYLSRUSA-N 0 3 406.534 4.141 20 0 HIADHN CN(C)Cc1ccc(-c2noc(-c3cnc(-c4ccc5c(c4)OCO5)s3)n2)cc1 ZINC000531348841 931026434 /nfs/dbraw/zinc/02/64/34/931026434.db2.gz JZXYNLRJIUWHTF-UHFFFAOYSA-N 0 3 406.467 4.317 20 0 HIADHN CN(C)Cc1ccc(-c2noc(CCCCCNC(=O)NC3CCCCC3)n2)cc1 ZINC000531348428 931026932 /nfs/dbraw/zinc/02/69/32/931026932.db2.gz HFAUMNIKYOUTMI-UHFFFAOYSA-N 0 3 413.566 4.143 20 0 HIADHN CC(C)n1ncc2cc(NC(=O)N(Cc3ccccc3)C3CCN(C)CC3)cnc21 ZINC000531461683 931065976 /nfs/dbraw/zinc/06/59/76/931065976.db2.gz JMNRLZKEHGFGMD-UHFFFAOYSA-N 0 3 406.534 4.141 20 0 HIADHN C[C@@H](NC(=O)N(CCN(C)C)Cc1ccco1)c1ccc(OCc2cccnc2)cc1 ZINC000531522790 931091517 /nfs/dbraw/zinc/09/15/17/931091517.db2.gz XWLRGZPCDBPIAG-LJQANCHMSA-N 0 3 422.529 4.088 20 0 HIADHN CS(=O)(=O)Cc1ccccc1CNCC1=Cc2cc(Cl)cc(Cl)c2OC1 ZINC000531535279 931095658 /nfs/dbraw/zinc/09/56/58/931095658.db2.gz DPOMPEYSMNMGLL-UHFFFAOYSA-N 0 3 412.338 4.104 20 0 HIADHN COc1cc(CNCc2cccc(-c3ccc(C)cc3)c2)cc(Cl)c1OCC(N)=O ZINC000531566614 931105586 /nfs/dbraw/zinc/10/55/86/931105586.db2.gz MEGZCVNKTJCOAZ-UHFFFAOYSA-N 0 3 424.928 4.478 20 0 HIADHN CC[C@@H](NCc1ccc(OCCN2CCOCC2)c(Cl)c1)c1ccc(OC)cc1 ZINC000531583784 931110085 /nfs/dbraw/zinc/11/00/85/931110085.db2.gz FKTBUWHQMSMUDR-JOCHJYFZSA-N 0 3 418.965 4.301 20 0 HIADHN COc1cccc(C=C2CCN(C(=O)[C@H]3CCCN(Cc4cccnc4)C3)CC2)c1 ZINC000531616339 931128072 /nfs/dbraw/zinc/12/80/72/931128072.db2.gz MGXFCXDLEOMMKX-QHCPKHFHSA-N 0 3 405.542 4.008 20 0 HIADHN COc1cccc(CNc2cc(NCc3cccc(OC)c3OC)nc(C)n2)c1OC ZINC000531680012 931149924 /nfs/dbraw/zinc/14/99/24/931149924.db2.gz BOIFFGXHDLSVSY-UHFFFAOYSA-N 0 3 424.501 4.044 20 0 HIADHN CCCNC(=O)c1cccc(CN[C@H](C)CC(=O)Nc2cccc(C(F)(F)F)c2)c1 ZINC000531682599 931150800 /nfs/dbraw/zinc/15/08/00/931150800.db2.gz YGDKTFOGCNAIIL-OAHLLOKOSA-N 0 3 421.463 4.352 20 0 HIADHN C[C@H](NCc1ccc(COCC(F)(F)F)cc1)c1ccc(S(C)(=O)=O)cc1 ZINC000531687950 931152715 /nfs/dbraw/zinc/15/27/15/931152715.db2.gz PNEDHSUTEMLMTC-AWEZNQCLSA-N 0 3 401.450 4.020 20 0 HIADHN C[C@@H](NCc1ccc(N2CCOCC2)nc1)c1cccc(OCc2ccccc2)c1 ZINC000531689263 931153837 /nfs/dbraw/zinc/15/38/37/931153837.db2.gz AACYYMHJEOPSNU-HXUWFJFHSA-N 0 3 403.526 4.348 20 0 HIADHN C[C@@H](NC[C@@H](O)COc1cccc(C(F)(F)F)c1)c1cnn(Cc2ccccc2)c1 ZINC000531695693 931158976 /nfs/dbraw/zinc/15/89/76/931158976.db2.gz QJLHVJJAQGDIPG-OXQOHEQNSA-N 0 3 419.447 4.041 20 0 HIADHN Cc1nc(-c2ccc(CN[C@H](C)c3cccc(NS(C)(=O)=O)c3)cc2)cs1 ZINC000531698223 931161499 /nfs/dbraw/zinc/16/14/99/931161499.db2.gz PCABUQMMUIWNMM-CQSZACIVSA-N 0 3 401.557 4.341 20 0 HIADHN C[C@@H](NCc1ccc(C(=O)N2CCOCC2)cc1)c1cccc(-c2ccncc2)c1 ZINC000531698709 931162975 /nfs/dbraw/zinc/16/29/75/931162975.db2.gz PJDLPHYENFFQHU-LJQANCHMSA-N 0 3 401.510 4.072 20 0 HIADHN Fc1ccc(N2CCN(c3cc(CN[C@H]4CCc5ccccc54)ccn3)CC2)cc1 ZINC000531699740 931163683 /nfs/dbraw/zinc/16/36/83/931163683.db2.gz FLITYSNYKTYMMD-DEOSSOPVSA-N 0 3 402.517 4.324 20 0 HIADHN C[C@H](N[C@@H](CN1CCN(C)CC1)c1ccccc1)c1cc(Br)ccc1F ZINC000531703586 931165936 /nfs/dbraw/zinc/16/59/36/931165936.db2.gz MAVXPXVMJKIETJ-KKSFZXQISA-N 0 3 420.370 4.228 20 0 HIADHN COc1ccc(NC(=O)C[C@H](C)N[C@H](c2ccc(F)cc2)[C@H]2CCCO2)c(OC)c1 ZINC000531706790 931167400 /nfs/dbraw/zinc/16/74/00/931167400.db2.gz HXGOLXJTQDSJFO-UYGSHGSRSA-N 0 3 416.493 4.070 20 0 HIADHN C[C@H]1C[C@H](NCc2cccc(CS(C)(=O)=O)c2)c2cccc(Br)c21 ZINC000531707570 931167982 /nfs/dbraw/zinc/16/79/82/931167982.db2.gz FKIXJMUSFPJXLG-UGSOOPFHSA-N 0 3 408.361 4.332 20 0 HIADHN CCC[C@@H](N[C@@H](C)c1ccc2c(c1)CCC(=O)N2)C(=O)N1CCc2sccc2C1 ZINC000531710017 931168911 /nfs/dbraw/zinc/16/89/11/931168911.db2.gz IBFSNTOBNRUQBA-MGPUTAFESA-N 0 3 411.571 4.037 20 0 HIADHN C[C@@H](NC(=O)N(CCN(C)C)C1CCCC1)c1ccc(OCc2cccnc2)cc1 ZINC000531818958 931207471 /nfs/dbraw/zinc/20/74/71/931207471.db2.gz SXLPHVYZJCOBSO-LJQANCHMSA-N 0 3 410.562 4.237 20 0 HIADHN CCN(C(=O)Nc1ncn(Cc2ccccc2)n1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000531875216 931231649 /nfs/dbraw/zinc/23/16/49/931231649.db2.gz VJHVDOBSZADXCY-SIKLNZKXSA-N 0 3 418.545 4.016 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccnc2)C1)N(CCc1ccccc1F)C1CCCC1 ZINC000531895370 931236307 /nfs/dbraw/zinc/23/63/07/931236307.db2.gz VRTXIHLXAVAQOA-JOCHJYFZSA-N 0 3 409.549 4.447 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@@H](C)N[C@@H]2CCc3ccc(OC)cc32)cc1 ZINC000531931029 931250048 /nfs/dbraw/zinc/25/00/48/931250048.db2.gz DPJOYQJWKCAYBZ-OPAMFIHVSA-N 0 3 402.560 4.064 20 0 HIADHN C[C@H](CC(=O)Nc1ccccc1C(F)(F)F)NCc1cccc(N2CCCC2=O)c1 ZINC000531937830 931253599 /nfs/dbraw/zinc/25/35/99/931253599.db2.gz MGFAXJQOWOLAPG-OAHLLOKOSA-N 0 3 419.447 4.339 20 0 HIADHN C[C@@H](CC(=O)Nc1ccccc1C(F)(F)F)NCc1cnn(-c2ccccc2)c1 ZINC000531943104 931256121 /nfs/dbraw/zinc/25/61/21/931256121.db2.gz MOLSKIMGLGGAIU-HNNXBMFYSA-N 0 3 402.420 4.398 20 0 HIADHN C[C@H](NCc1ccc(OCc2ccccc2)cc1)c1cccc(NS(C)(=O)=O)c1 ZINC000531946913 931259089 /nfs/dbraw/zinc/25/90/89/931259089.db2.gz QPVIAFYYHTXTHA-SFHVURJKSA-N 0 3 410.539 4.488 20 0 HIADHN C[C@H](NCc1ccc(-n2ccc(C(F)(F)F)n2)cc1)c1ccc([S@@](C)=O)cc1 ZINC000531948705 931259670 /nfs/dbraw/zinc/25/96/70/931259670.db2.gz FYIJDGMXKRNBQQ-HJFSHJIFSA-N 0 3 407.461 4.479 20 0 HIADHN CC[C@@H](N[C@H](C)c1ccc(-n2ccnc2C)cc1)c1ccccc1OCC(=O)N(C)C ZINC000531955574 931263816 /nfs/dbraw/zinc/26/38/16/931263816.db2.gz AJJZZPLAZUMDQF-WZONZLPQSA-N 0 3 420.557 4.450 20 0 HIADHN CC(C)NS(=O)(=O)Cc1ccccc1CN[C@@H]1c2cccc(F)c2CC[C@@H]1C ZINC000531958218 931264538 /nfs/dbraw/zinc/26/45/38/931264538.db2.gz TZEUQFLQCSVYEK-AOMKIAJQSA-N 0 3 404.551 4.067 20 0 HIADHN CCS(=O)(=O)Nc1ccc([C@H](C)N[C@H](c2ccc(F)cc2)[C@@H]2CCCO2)cc1 ZINC000531962133 931266304 /nfs/dbraw/zinc/26/63/04/931266304.db2.gz NIZQATWCWBCDKG-ONGXBYRLSA-N 0 3 406.523 4.158 20 0 HIADHN CC[C@@H](N[C@H](C)c1cccc(S(=O)(=O)NC)c1)c1ccc(Br)cc1 ZINC000531965530 931268339 /nfs/dbraw/zinc/26/83/39/931268339.db2.gz HYZRVUZOCTYNAC-FZKQIMNGSA-N 0 3 411.365 4.159 20 0 HIADHN C[C@H](N[C@@H](CN1CCN(C)CC1)c1ccccc1)c1ccc(F)cc1Br ZINC000531965886 931268503 /nfs/dbraw/zinc/26/85/03/931268503.db2.gz RCDCTZZCKAZMST-KKSFZXQISA-N 0 3 420.370 4.228 20 0 HIADHN C[C@@H](NCc1ccccc1CN(C)Cc1ccco1)c1ccc(S(C)(=O)=O)cc1 ZINC000531980882 931274555 /nfs/dbraw/zinc/27/45/55/931274555.db2.gz ZNNXBRMJQDGGCX-GOSISDBHSA-N 0 3 412.555 4.166 20 0 HIADHN COc1cc(C[C@@H](CO)CN[C@H](C)c2sccc2Br)cc(OC)c1 ZINC000531994813 931279610 /nfs/dbraw/zinc/27/96/10/931279610.db2.gz QJZGZPVNZZWDTB-TZMCWYRMSA-N 0 3 414.365 4.030 20 0 HIADHN CCCN1CCN(c2ccccc2CNc2ccc3oc(CCOC)nc3c2)CC1 ZINC000532041295 931295471 /nfs/dbraw/zinc/29/54/71/931295471.db2.gz FMHFMWNFCGCXDE-UHFFFAOYSA-N 0 3 408.546 4.161 20 0 HIADHN Cc1nc2c(c(C(F)(F)F)n1)C[C@H](c1nc(-c3ccc(CN(C)C)cc3)no1)CC2 ZINC000532079974 931304525 /nfs/dbraw/zinc/30/45/25/931304525.db2.gz AZEWNJZKWQTNRP-OAHLLOKOSA-N 0 3 417.435 4.188 20 0 HIADHN Cc1cccnc1[C@@H](NCc1ccc(OCCN2CCOCC2)c(Cl)c1)C(C)C ZINC000532092410 931308774 /nfs/dbraw/zinc/30/87/74/931308774.db2.gz YSGNJMXGXKSDME-QFIPXVFZSA-N 0 3 417.981 4.241 20 0 HIADHN Cc1cc(CNCc2ccccc2CN2C(=O)NC3(CCCCC3)C2=O)c(C)s1 ZINC000532122558 931321615 /nfs/dbraw/zinc/32/16/15/931321615.db2.gz ULUSCVLNSKNPTB-UHFFFAOYSA-N 0 3 411.571 4.409 20 0 HIADHN C[C@H]1C[C@@H](c2ccccc2)CN1CC(=O)NCc1cccc(COCc2ccco2)c1 ZINC000532159884 931332979 /nfs/dbraw/zinc/33/29/79/931332979.db2.gz NZAWKACBWQYSGG-GBXCKJPGSA-N 0 3 418.537 4.491 20 0 HIADHN COCC(=O)Nc1cccc(CN[C@@H](Cc2cccc(OC)c2)c2ccccc2)c1 ZINC000532197592 931345500 /nfs/dbraw/zinc/34/55/00/931345500.db2.gz WUOGVLBHSZXPJW-DEOSSOPVSA-N 0 3 404.510 4.354 20 0 HIADHN CC(C)OCc1ccccc1CN[C@H](C)c1cccc(N2CCCS2(=O)=O)c1 ZINC000532204456 931349045 /nfs/dbraw/zinc/34/90/45/931349045.db2.gz KZTWBSYQBXBSGH-GOSISDBHSA-N 0 3 402.560 4.002 20 0 HIADHN C[C@@H](NC[C@@H](c1ccccc1Cl)N1CCCC1)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000532204377 931349382 /nfs/dbraw/zinc/34/93/82/931349382.db2.gz ZFLOPOVWKKASNA-QRWLVFNGSA-N 0 3 424.969 4.370 20 0 HIADHN COCc1ccc(CNCc2ccccc2CN2CCN(c3ccccc3)CC2)o1 ZINC000532212295 931354999 /nfs/dbraw/zinc/35/49/99/931354999.db2.gz HIFIASCARRMUJG-UHFFFAOYSA-N 0 3 405.542 4.038 20 0 HIADHN CC[C@@H](N[C@H](CN1CCN(C)CC1)c1ccccc1)c1cc(Cl)ccc1OC ZINC000532221226 931359209 /nfs/dbraw/zinc/35/92/09/931359209.db2.gz DOKGDEJRDQIBTN-FGZHOGPDSA-N 0 3 401.982 4.378 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N[C@H](C)Cc3nc4ccccc4s3)cc2)CC1 ZINC000532314435 931395652 /nfs/dbraw/zinc/39/56/52/931395652.db2.gz HDJRYBQKSKBCSI-GOSISDBHSA-N 0 3 422.598 4.188 20 0 HIADHN CC(C)N1CCN([C@H]2CCN(C(=O)CCCc3cc(Cl)sc3Cl)C2)CC1 ZINC000532347965 931403086 /nfs/dbraw/zinc/40/30/86/931403086.db2.gz VPSAUZGNVZRGEQ-INIZCTEOSA-N 0 3 418.434 4.005 20 0 HIADHN CC(C)N1CCN([C@H]2CCN(C(=O)Nc3ccc(OC4CCCCC4)cc3)C2)CC1 ZINC000532351086 931404380 /nfs/dbraw/zinc/40/43/80/931404380.db2.gz IVNKPPDMXPQSRQ-NRFANRHFSA-N 0 3 414.594 4.030 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)N1CCC[C@@H](CC(=O)OC(C)(C)C)C1 ZINC000532385793 931418778 /nfs/dbraw/zinc/41/87/78/931418778.db2.gz FCNOFHDLZYYFCA-INIZCTEOSA-N 0 3 400.519 4.078 20 0 HIADHN CCOc1cccc(CNCc2ccccc2CN2CCN(c3ccccc3)CC2)n1 ZINC000532422654 931429771 /nfs/dbraw/zinc/42/97/71/931429771.db2.gz KPHFBJRXCQZONK-UHFFFAOYSA-N 0 3 416.569 4.092 20 0 HIADHN Cc1c([C@H](C)N[C@@H](C)CC(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)cnn1C ZINC000532448014 931438231 /nfs/dbraw/zinc/43/82/31/931438231.db2.gz DKJKAOGTALZLER-QWRGUYRKSA-N 0 3 402.848 4.469 20 0 HIADHN C[C@H](COc1ccc2cc(Br)ccc2c1)NCc1cccc(C(N)=O)c1 ZINC000532452929 931441324 /nfs/dbraw/zinc/44/13/24/931441324.db2.gz LAACOZXUTTUSGJ-CQSZACIVSA-N 0 3 413.315 4.258 20 0 HIADHN C[C@@H]1CSc2ccc(Br)cc2[C@@H]1NCc1ccc2c(c1)nnn2C ZINC000532479125 931454680 /nfs/dbraw/zinc/45/46/80/931454680.db2.gz DSIJURNPQFVJRW-ADLMAVQZSA-N 0 3 403.349 4.304 20 0 HIADHN C[C@@H](N(C)CC(=O)N(Cc1nnc(-c2ccccc2Cl)o1)C1CC1)C(C)(C)C ZINC000532489123 931458167 /nfs/dbraw/zinc/45/81/67/931458167.db2.gz MGTDPWJMNYEMEW-CQSZACIVSA-N 0 3 404.942 4.247 20 0 HIADHN Cc1cc(NC(=O)N[C@H](C)Cc2ccsc2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000532507759 931467881 /nfs/dbraw/zinc/46/78/81/931467881.db2.gz NKIODVNOFXZTPE-UTKZUKDTSA-N 0 3 423.586 4.453 20 0 HIADHN Cc1ccc(NC(=O)C[C@H](C)NCc2ccnc(OC3CCOCC3)c2)c(Cl)c1 ZINC000532511725 931468717 /nfs/dbraw/zinc/46/87/17/931468717.db2.gz QUEBRFGQKALUOB-INIZCTEOSA-N 0 3 417.937 4.108 20 0 HIADHN CCN(CC(=O)N1CCc2[nH]c3ccccc3c2C1)[C@@H](C)Cc1ccc(OC)cc1 ZINC000532554329 931520840 /nfs/dbraw/zinc/52/08/40/931520840.db2.gz GQYKLFZQIWUCJJ-SFHVURJKSA-N 0 3 405.542 4.014 20 0 HIADHN Cc1c(NC(=O)[C@H]2CCCN(Cc3cccnc3)C2)cnn1-c1cc(C)ccc1C ZINC000532614167 931554690 /nfs/dbraw/zinc/55/46/90/931554690.db2.gz BEMDLUVNPDRQMY-NRFANRHFSA-N 0 3 403.530 4.043 20 0 HIADHN Cc1cccn2c(=O)cc(CNC3(c4ccc(Br)cc4)CCCC3)nc12 ZINC000532656591 931571721 /nfs/dbraw/zinc/57/17/21/931571721.db2.gz ACOWXUPVPGMCDV-UHFFFAOYSA-N 0 3 412.331 4.325 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CNC(=O)CN[C@@H](c1ccccc1)C1CCC1 ZINC000532687582 931585288 /nfs/dbraw/zinc/58/52/88/931585288.db2.gz FGQLBMMRXGVTGY-VWLOTQADSA-N 0 3 402.542 4.236 20 0 HIADHN CCN(CC(=O)N(CC(C)C)C(C)C)C1CCN(c2cc(C)nc(C(C)C)n2)CC1 ZINC000532734164 931617051 /nfs/dbraw/zinc/61/70/51/931617051.db2.gz HEGNARPHLLQNEG-UHFFFAOYSA-N 0 3 417.642 4.092 20 0 HIADHN CC(C)[C@@H](NCC(=O)NCCc1cnn(-c2ccccc2)c1)c1ccc(Cl)cc1 ZINC000532769251 931627432 /nfs/dbraw/zinc/62/74/32/931627432.db2.gz BPTLIKBOFIYARR-HSZRJFAPSA-N 0 3 410.949 4.171 20 0 HIADHN COc1ccc(CCNC(=O)CN[C@@H](c2ccc(Cl)cc2)C(C)C)cc1OC ZINC000532770104 931627654 /nfs/dbraw/zinc/62/76/54/931627654.db2.gz FAPNCXWXBXWEGU-JOCHJYFZSA-N 0 3 404.938 4.003 20 0 HIADHN CCCN(Cc1ccc(C)cc1)Cc1cc(OCC)n2nc(C(F)(F)F)nc2n1 ZINC000532902130 931685405 /nfs/dbraw/zinc/68/54/05/931685405.db2.gz WWDHNXCPWDSKFF-UHFFFAOYSA-N 0 3 407.440 4.262 20 0 HIADHN CCc1cccc(OCC(=O)Nc2c(C)cnn2[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000532910490 931688764 /nfs/dbraw/zinc/68/87/64/931688764.db2.gz FIZUWEHZPVBVTG-QFIPXVFZSA-N 0 3 418.541 4.218 20 0 HIADHN CCC(=O)N1CCCN(CCCC(=O)Nc2c(CC)ccc(Cl)c2CC)CC1 ZINC000532924712 931697429 /nfs/dbraw/zinc/69/74/29/931697429.db2.gz GLDVBWQQPOLFLP-UHFFFAOYSA-N 0 3 407.986 4.128 20 0 HIADHN COc1cc([C@@H](C)N[C@@H]2CCCN(CC(F)(F)F)C2=O)ccc1OCCC(C)C ZINC000532990078 931729130 /nfs/dbraw/zinc/72/91/30/931729130.db2.gz RBQVAZCAGRDBIW-NVXWUHKLSA-N 0 3 416.484 4.324 20 0 HIADHN O=C(CN[C@H](c1ccccc1)C1CCC1)Nc1ccccc1I ZINC000533045311 931751183 /nfs/dbraw/zinc/75/11/83/931751183.db2.gz DDPSVYNYBROSSQ-LJQANCHMSA-N 0 3 420.294 4.361 20 0 HIADHN CC(C)(Cc1ccc(Br)cc1)NCc1csc(-c2ncccn2)n1 ZINC000533062086 931758459 /nfs/dbraw/zinc/75/84/59/931758459.db2.gz UZPIQHIPNJVJNH-UHFFFAOYSA-N 0 3 403.349 4.474 20 0 HIADHN CCCN(Cc1ccn(-c2ccccc2)n1)C1CCN(c2cc(C)nc(C)n2)CC1 ZINC000533061084 931759100 /nfs/dbraw/zinc/75/91/00/931759100.db2.gz SFCNVGFPSBCRPX-UHFFFAOYSA-N 0 3 404.562 4.160 20 0 HIADHN C[C@H](c1ccc(F)cc1)N(C)C(=O)CNC1(c2ccc(Cl)cc2)CCOCC1 ZINC000533063133 931759820 /nfs/dbraw/zinc/75/98/20/931759820.db2.gz AKJURWZWOUZHHR-MRXNPFEDSA-N 0 3 404.913 4.294 20 0 HIADHN COc1ncc(CNC2(c3ccc(Br)cc3)CCOCC2)cc1Cl ZINC000533098688 931769804 /nfs/dbraw/zinc/76/98/04/931769804.db2.gz AHDBAPOWNHIYRT-UHFFFAOYSA-N 0 3 411.727 4.302 20 0 HIADHN C[C@]1(c2ccc(CNCc3ccc(Sc4ccccc4)cc3)cc2)NC(=O)NC1=O ZINC000533125520 931776273 /nfs/dbraw/zinc/77/62/73/931776273.db2.gz MIGHHXVGMMRTQL-XMMPIXPASA-N 0 3 417.534 4.182 20 0 HIADHN CCN(CCC(=O)Nc1ccccc1C(=O)c1ccccc1)CCc1nccs1 ZINC000533142920 931782905 /nfs/dbraw/zinc/78/29/05/931782905.db2.gz FBJRDZGOSUIOMB-UHFFFAOYSA-N 0 3 407.539 4.267 20 0 HIADHN CCOC(=O)c1cc2cc(NC(=O)[C@H]3CCCN(Cc4cccnc4)C3)ccc2s1 ZINC000533145932 931784343 /nfs/dbraw/zinc/78/43/43/931784343.db2.gz SUEVJECCJBKISE-KRWDZBQOSA-N 0 3 423.538 4.324 20 0 HIADHN COc1ccc(NC(=O)[C@H](N[C@@H]2[C@H]3CCO[C@H]3C23CCCC3)c2ccccc2)cc1 ZINC000533177152 931802777 /nfs/dbraw/zinc/80/27/77/931802777.db2.gz WSPMHXAQFCXHSA-SSGKUCQKSA-N 0 3 406.526 4.312 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccnc2)C1)N1CCC[C@@H](c2nc3c(s2)CCCC3)C1 ZINC000533192546 931806072 /nfs/dbraw/zinc/80/60/72/931806072.db2.gz MJQSROWTJXCYNE-WOJBJXKFSA-N 0 3 424.614 4.035 20 0 HIADHN CCCN1CCN(c2ccccc2CNc2ccc(C)c(C(=O)NC(C)C)c2)CC1 ZINC000533213655 931811605 /nfs/dbraw/zinc/81/16/05/931811605.db2.gz DIDCXCQDANMHAP-UHFFFAOYSA-N 0 3 408.590 4.277 20 0 HIADHN O=C(CCN1CCC(NC(=O)c2ccccc2)CC1)Nc1c(Cl)cccc1Cl ZINC000533228773 931814581 /nfs/dbraw/zinc/81/45/81/931814581.db2.gz KZKZCTBKXRQSRP-UHFFFAOYSA-N 0 3 420.340 4.216 20 0 HIADHN CN(CCC(=O)Nc1ccccc1-c1ccccc1)C[C@H]1COc2ccccc2O1 ZINC000533231997 931815395 /nfs/dbraw/zinc/81/53/95/931815395.db2.gz RDNQABQXSHNSKR-FQEVSTJZSA-N 0 3 402.494 4.454 20 0 HIADHN CCN(CC(=O)N[C@H](c1nccs1)c1ccccc1)[C@@H](C)Cc1ccc(OC)cc1 ZINC000533282441 931827533 /nfs/dbraw/zinc/82/75/33/931827533.db2.gz UMUWLYDTZGBYPN-MBSDFSHPSA-N 0 3 423.582 4.310 20 0 HIADHN Cc1ccc(NC(=O)CNC2(c3ccc(Br)cc3)CCOCC2)cc1F ZINC000533351597 931846147 /nfs/dbraw/zinc/84/61/47/931846147.db2.gz CVENROBZYYNROX-UHFFFAOYSA-N 0 3 421.310 4.131 20 0 HIADHN CN(CC(=O)Nc1ccccc1Cl)C(=O)CN[C@H](c1ccccc1)C(C)(C)C ZINC000533351641 931846263 /nfs/dbraw/zinc/84/62/63/931846263.db2.gz MWZOKHQGKGPNKD-OAQYLSRUSA-N 0 3 401.938 4.114 20 0 HIADHN CCN(CC)C(=O)c1ccc(NC(=O)CN[C@@H](c2ccc(F)cc2)C2CCC2)cc1 ZINC000533367628 931850287 /nfs/dbraw/zinc/85/02/87/931850287.db2.gz CXGCRXUFSKYSDS-HSZRJFAPSA-N 0 3 411.521 4.377 20 0 HIADHN COc1ccc(OC)c([C@H](C)NC(=O)CNC2(c3ccc(F)cc3)CCCC2)c1 ZINC000533374110 931852024 /nfs/dbraw/zinc/85/20/24/931852024.db2.gz ZIKYHXRMIAZUFI-INIZCTEOSA-N 0 3 400.494 4.079 20 0 HIADHN Cc1occc1C(=O)NC1CCN(CCC(=O)Nc2cc(Cl)ccc2Cl)CC1 ZINC000533401237 931858809 /nfs/dbraw/zinc/85/88/09/931858809.db2.gz YNTMMWSUBUJOGX-UHFFFAOYSA-N 0 3 424.328 4.118 20 0 HIADHN CC(=O)Nc1ccc(OC[C@H](O)CN(Cc2ccc(F)cc2F)C2CCCC2)cc1 ZINC000533486181 931882754 /nfs/dbraw/zinc/88/27/54/931882754.db2.gz RTPISOLPLUOPOP-OAQYLSRUSA-N 0 3 418.484 4.108 20 0 HIADHN C[C@@H](NC(=O)CNC1(c2ccccc2)CCOCC1)c1ccc(Cl)cc1Cl ZINC000533517239 931891873 /nfs/dbraw/zinc/89/18/73/931891873.db2.gz DNBNHPFCSZULOD-OAHLLOKOSA-N 0 3 407.341 4.466 20 0 HIADHN O=C1c2ccccc2C(=O)N1[C@H]1CCCC[C@@H](NCc2ncoc2-c2ccccc2)C1 ZINC000533547664 931898352 /nfs/dbraw/zinc/89/83/52/931898352.db2.gz MUUBIFYNHPJVII-MOPGFXCFSA-N 0 3 415.493 4.429 20 0 HIADHN COc1ccc(C(=O)N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)cc1-c1ccccn1 ZINC000533650424 931946476 /nfs/dbraw/zinc/94/64/76/931946476.db2.gz WZSCICKKTBEEME-RXVVDRJESA-N 0 3 401.510 4.150 20 0 HIADHN COc1ccc(C(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)cc1-c1ccccn1 ZINC000533651244 931946800 /nfs/dbraw/zinc/94/68/00/931946800.db2.gz TZVXUAFQDXSGKV-OAQYLSRUSA-N 0 3 401.510 4.104 20 0 HIADHN COc1cccc(-c2nc(C)c(C(=O)N(CCCc3ccccc3)CCN(C)C)[nH]2)c1 ZINC000533709329 931982625 /nfs/dbraw/zinc/98/26/25/931982625.db2.gz NADLIFQLYPYJFZ-UHFFFAOYSA-N 0 3 420.557 4.030 20 0 HIADHN COc1cccc(-c2nc(C)c(C(=O)Nc3cccc(CN4CCSCC4)c3)[nH]2)c1 ZINC000533715253 931986716 /nfs/dbraw/zinc/98/67/16/931986716.db2.gz DWLZGOXKUHDUPO-UHFFFAOYSA-N 0 3 422.554 4.195 20 0 HIADHN CC[C@H](NCc1cc2c(cc1OC)C[C@@H](C)O2)[C@@H](c1ccc(C)cc1)n1cncn1 ZINC000533741801 932003224 /nfs/dbraw/zinc/00/32/24/932003224.db2.gz KNSMCSSXOKGJFW-QATBIIFWSA-N 0 3 406.530 4.076 20 0 HIADHN Cc1nc2ccccc2n1C[C@H]1CCCN1CC(=O)N(C)[C@H](C)c1ccc(F)cc1 ZINC000533760781 932016062 /nfs/dbraw/zinc/01/60/62/932016062.db2.gz HDJKJDNTFXOEIM-DYESRHJHSA-N 0 3 408.521 4.168 20 0 HIADHN CSc1cccc(N(C(=O)c2csc([C@H]3CCCO3)n2)C2CCN(C)CC2)c1 ZINC000533762960 932016896 /nfs/dbraw/zinc/01/68/96/932016896.db2.gz RBHMZUXYCPCJMA-LJQANCHMSA-N 0 3 417.600 4.458 20 0 HIADHN CC(=O)c1ccc2c(c1)CCN(CCC(=O)Nc1ccccc1Br)CC2 ZINC000533767297 932021093 /nfs/dbraw/zinc/02/10/93/932021093.db2.gz PAJSGKNUXLRREE-UHFFFAOYSA-N 0 3 415.331 4.081 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)c2ccc(C(=O)Nc3ccccc3)cc2)o1 ZINC000533892821 932086073 /nfs/dbraw/zinc/08/60/73/932086073.db2.gz MQRYCHGEFQHBIH-UHFFFAOYSA-N 0 3 405.498 4.044 20 0 HIADHN CN1CC[C@H](NC(=O)N2CCO[C@H](c3ccc(F)c(Cl)c3)C2)[C@H]1c1ccccc1 ZINC000533948761 932122193 /nfs/dbraw/zinc/12/21/93/932122193.db2.gz IXEDDUDFPLAVTR-PCCBWWKXSA-N 0 3 417.912 4.007 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)c2ccccc2CS(=O)(=O)c2ccccc2)c1 ZINC000533969372 932147031 /nfs/dbraw/zinc/14/70/31/932147031.db2.gz UIDDVKHJJDBKRN-UHFFFAOYSA-N 0 3 422.550 4.283 20 0 HIADHN CN1CC[C@@H](NC(=O)c2cccc(-n3nccc3C(F)(F)F)c2)[C@H]1c1ccccc1 ZINC000534018417 932199516 /nfs/dbraw/zinc/19/95/16/932199516.db2.gz DENPDOCUBAGLAA-UYAOXDASSA-N 0 3 414.431 4.066 20 0 HIADHN CN1CC[C@H](NC(=O)CCc2ncc(-c3ccccc3Cl)o2)[C@H]1c1ccccc1 ZINC000534018319 932199825 /nfs/dbraw/zinc/19/98/25/932199825.db2.gz CGICVGDNUJYYLT-WMZHIEFXSA-N 0 3 409.917 4.489 20 0 HIADHN CN(C(=O)Nc1cc2c(cc1Cl)OCO2)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000534027992 932208255 /nfs/dbraw/zinc/20/82/55/932208255.db2.gz WJIJRJSVMOFOIW-MRXNPFEDSA-N 0 3 401.894 4.197 20 0 HIADHN CN(C)C(=O)c1cccc(CCN[C@H]2CCc3c2c(Br)ccc3F)c1 ZINC000534058938 932237737 /nfs/dbraw/zinc/23/77/37/932237737.db2.gz JGJLHWVULAEIEK-SFHVURJKSA-N 0 3 405.311 4.110 20 0 HIADHN O=C(N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1CO)c1ccc(-c2ccccc2Cl)o1 ZINC000534181868 932319314 /nfs/dbraw/zinc/31/93/14/932319314.db2.gz PEIGWQFIRUAJNW-WIYYLYMNSA-N 0 3 424.928 4.213 20 0 HIADHN COc1ccc(C[C@@H](C)CN(C)C(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)cc1 ZINC000534205591 932331117 /nfs/dbraw/zinc/33/11/17/932331117.db2.gz KUPGMVZIEXKEGE-OAQYLSRUSA-N 0 3 423.601 4.176 20 0 HIADHN Cc1nccn1CCCN1CCc2c(cccc2NC(=O)Nc2ccc(F)cc2)C1 ZINC000534219576 932338481 /nfs/dbraw/zinc/33/84/81/932338481.db2.gz BDAACJISMWBXTE-UHFFFAOYSA-N 0 3 407.493 4.423 20 0 HIADHN COc1ccc(C)cc1NC(=O)[C@H](c1ccccc1)N1CC[C@@H](C2CCOCC2)C1 ZINC000534381740 932408142 /nfs/dbraw/zinc/40/81/42/932408142.db2.gz CWDJUYLVAKQJAS-QPPBQGQZSA-N 0 3 408.542 4.432 20 0 HIADHN CCOc1ccc(-c2nc(CN3CC[C@@H](C4CCOCC4)C3)cs2)cc1OC ZINC000534381419 932408822 /nfs/dbraw/zinc/40/88/22/932408822.db2.gz UTWOHTBOJFOOIQ-GOSISDBHSA-N 0 3 402.560 4.466 20 0 HIADHN C[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000534415789 932435471 /nfs/dbraw/zinc/43/54/71/932435471.db2.gz TXVHIUOOKMSAAZ-GUDVDZBRSA-N 0 3 406.998 4.257 20 0 HIADHN CN(C)[C@@H](CNC(=O)Nc1cc(F)ccc1SCC(F)F)Cc1ccccc1 ZINC000534526684 932545672 /nfs/dbraw/zinc/54/56/72/932545672.db2.gz DCURDFWMNKKUQV-MRXNPFEDSA-N 0 3 411.493 4.477 20 0 HIADHN O=C(Nc1ccccc1)c1cccc(CN2CCC[C@@H](c3nncn3C3CC3)C2)c1 ZINC000534537696 932551229 /nfs/dbraw/zinc/55/12/29/932551229.db2.gz LNPUIGOXDZWODO-HXUWFJFHSA-N 0 3 401.514 4.245 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2ccc(C(=O)N(C)c3ccccc3)cc2)N(C)C)cc1 ZINC000534564554 932566824 /nfs/dbraw/zinc/56/68/24/932566824.db2.gz AUIPOCYRZMXXRV-XMMPIXPASA-N 0 3 415.537 4.304 20 0 HIADHN Cc1nc(-c2cccc(C(F)(F)F)c2)[nH]c1C(=O)Nc1cc(CN(C)C)ccn1 ZINC000534567051 932570222 /nfs/dbraw/zinc/57/02/22/932570222.db2.gz CKLTXPUNSRZPPF-UHFFFAOYSA-N 0 3 403.408 4.113 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCc1ccccc1-c1cnn(C)c1)c1ccsc1 ZINC000534610151 932593848 /nfs/dbraw/zinc/59/38/48/932593848.db2.gz GKDPICADCKGOSS-NRFANRHFSA-N 0 3 411.575 4.031 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCc1ccccc1-c1cnn(C)c1)c1ccsc1 ZINC000534610152 932594116 /nfs/dbraw/zinc/59/41/16/932594116.db2.gz GKDPICADCKGOSS-OAQYLSRUSA-N 0 3 411.575 4.031 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2ccc(C(=O)Nc3ccccc3)cc2)N(C)C)cc1 ZINC000534610576 932595119 /nfs/dbraw/zinc/59/51/19/932595119.db2.gz CJXRCKRWKNBXCI-HSZRJFAPSA-N 0 3 401.510 4.280 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)c2nc(C3CC3)n(-c3ccccc3Cl)n2)c1 ZINC000534706071 932676869 /nfs/dbraw/zinc/67/68/69/932676869.db2.gz LYTBKNJMAUFBML-UHFFFAOYSA-N 0 3 409.921 4.420 20 0 HIADHN COc1cc(C(=O)Nc2cc(C)cc(CN(C)C)c2)cc(OC)c1Br ZINC000534708302 932678418 /nfs/dbraw/zinc/67/84/18/932678418.db2.gz DLWKTCKHISMREP-UHFFFAOYSA-N 0 3 407.308 4.089 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)Nc1ccc2[nH]c(C(F)F)nc2c1 ZINC000534707305 932678691 /nfs/dbraw/zinc/67/86/91/932678691.db2.gz WVSFIIOSVTWCDL-UHFFFAOYSA-N 0 3 413.472 4.041 20 0 HIADHN CN1CC[C@H](NC(=O)N2CCn3cccc3[C@@H]2c2ccccc2)[C@@H]1c1ccccc1 ZINC000534721030 932688455 /nfs/dbraw/zinc/68/84/55/932688455.db2.gz ITTJXYBGNXTISH-XWGVYQGASA-N 0 3 400.526 4.048 20 0 HIADHN Cc1ccc(-c2ncco2)cc1NC(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000534739322 932709174 /nfs/dbraw/zinc/70/91/74/932709174.db2.gz QPWQKFMMFJMEHS-HDICACEKSA-N 0 3 412.534 4.003 20 0 HIADHN CN1CC[C@H](NC(=O)CCCc2ccccc2Br)[C@@H]1c1ccccc1 ZINC000534756164 932733350 /nfs/dbraw/zinc/73/33/50/932733350.db2.gz PDPRHZBGSPPFKG-FPOVZHCZSA-N 0 3 401.348 4.333 20 0 HIADHN CN(C(=O)[C@H](OC1CCOCC1)c1ccccc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000534774599 932754541 /nfs/dbraw/zinc/75/45/41/932754541.db2.gz BCDGSRLCWHTEGP-UKILVPOCSA-N 0 3 422.569 4.046 20 0 HIADHN Clc1cc2c(c(Br)c1)CC[C@H]2NCc1cccc(-n2cncn2)c1 ZINC000534792673 932774014 /nfs/dbraw/zinc/77/40/14/932774014.db2.gz ASTPERQUBNGHCB-GOSISDBHSA-N 0 3 403.711 4.460 20 0 HIADHN CC(C)Cn1ncc(NC(=O)NC[C@H]2CCCN2Cc2ccccc2)c1C(F)F ZINC000534822633 932793838 /nfs/dbraw/zinc/79/38/38/932793838.db2.gz JPKODNCQCVYXOF-QGZVFWFLSA-N 0 3 405.493 4.263 20 0 HIADHN CC(C)Cn1ncc(NC(=O)NC[C@@H](c2cccs2)N2CCCC2)c1C(F)F ZINC000534825269 932796014 /nfs/dbraw/zinc/79/60/14/932796014.db2.gz AIGNYIPINQLRPT-HNNXBMFYSA-N 0 3 411.522 4.497 20 0 HIADHN COc1ccccc1[C@@H](NC(=O)N(CCN(C)C)CC1CCCCC1)c1ccccn1 ZINC000534843024 932803465 /nfs/dbraw/zinc/80/34/65/932803465.db2.gz FOUZIYJCQBIMKN-XMMPIXPASA-N 0 3 424.589 4.333 20 0 HIADHN CCC(=O)c1ccc(OCCCCC(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)cc1 ZINC000534845384 932804883 /nfs/dbraw/zinc/80/48/83/932804883.db2.gz CPXYOGKDYQYEFX-WIOPSUGQSA-N 0 3 408.542 4.390 20 0 HIADHN COc1cccc([C@H](CNC(=O)CCCc2cc(F)ccc2F)N2CCCC2)c1 ZINC000534877155 932818815 /nfs/dbraw/zinc/81/88/15/932818815.db2.gz OHURMPHXCZOVIQ-QFIPXVFZSA-N 0 3 402.485 4.249 20 0 HIADHN O=C(Nc1ccc2nc(C(F)F)[nH]c2c1)NC1CCN(Cc2ccc(F)cc2)CC1 ZINC000534933934 932845157 /nfs/dbraw/zinc/84/51/57/932845157.db2.gz FIJBCNCTMDTOKG-UHFFFAOYSA-N 0 3 417.435 4.426 20 0 HIADHN COc1cc(CN(C)Cc2ccc(OC[C@@H]3CCCO3)cc2)ccc1OC(F)F ZINC000535066007 932896471 /nfs/dbraw/zinc/89/64/71/932896471.db2.gz ALJUPFOZJKCMAK-IBGZPJMESA-N 0 3 407.457 4.486 20 0 HIADHN CC(C)N(Cc1ccccn1)C(=O)N[C@@H](CN1CCc2ccccc2C1)C(C)(C)C ZINC000535082013 932899418 /nfs/dbraw/zinc/89/94/18/932899418.db2.gz GSKGJGYIYISFHL-QHCPKHFHSA-N 0 3 408.590 4.475 20 0 HIADHN CC[C@H](NCc1ccc(OC)c(OC)c1Cl)[C@H](c1ccc(C)cc1)n1cncn1 ZINC000535185805 933001865 /nfs/dbraw/zinc/00/18/65/933001865.db2.gz MNBQVXIERAFDIF-RXVVDRJESA-N 0 3 414.937 4.415 20 0 HIADHN CC1CCN(S(=O)(=O)Cc2ccccc2CNCc2cccc(Cl)c2)CC1 ZINC000535201074 933010423 /nfs/dbraw/zinc/01/04/23/933010423.db2.gz LRFAIKRPVBIRKC-UHFFFAOYSA-N 0 3 406.979 4.192 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CCc2ccc(C(C)=O)cc2CC1)c1ccsc1 ZINC000535215847 933021240 /nfs/dbraw/zinc/02/12/40/933021240.db2.gz KLYHHAYGHYQCHX-QFIPXVFZSA-N 0 3 413.587 4.144 20 0 HIADHN CN(C)[C@@H](CNC(=O)c1ccc(N2CCc3ccccc3C2)cc1)Cc1ccccc1 ZINC000535257761 933039977 /nfs/dbraw/zinc/03/99/77/933039977.db2.gz NIVMZEOMGFQDLT-AREMUKBSSA-N 0 3 413.565 4.152 20 0 HIADHN COc1ccccc1[C@H](NC(=O)NC[C@H](Cc1ccccc1)N(C)C)c1ccccc1 ZINC000535260914 933040541 /nfs/dbraw/zinc/04/05/41/933040541.db2.gz IEDDOYKDWMQNPV-WIOPSUGQSA-N 0 3 417.553 4.257 20 0 HIADHN Cc1ccc(C[C@@H](NC(=O)NC[C@H](Cc2ccccc2)N(C)C)c2ccccn2)cc1 ZINC000535263391 933041425 /nfs/dbraw/zinc/04/14/25/933041425.db2.gz YTOVBHIGCVFFBN-UKILVPOCSA-N 0 3 416.569 4.146 20 0 HIADHN O=C(NC[C@H]1CCCN(Cc2cccs2)C1)c1ccn(-c2ccc(Cl)cc2)n1 ZINC000535300636 933058822 /nfs/dbraw/zinc/05/88/22/933058822.db2.gz ZVPSSQXGFKUKCC-MRXNPFEDSA-N 0 3 414.962 4.229 20 0 HIADHN COc1ccc(OCc2ccccn2)c(CNCc2ccccc2-c2cnn(C)c2)c1 ZINC000535341549 933082947 /nfs/dbraw/zinc/08/29/47/933082947.db2.gz VCGFDRSGHLZAOZ-UHFFFAOYSA-N 0 3 414.509 4.360 20 0 HIADHN CCN(C(=O)c1ccnc(OCC(F)F)c1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000535368174 933096122 /nfs/dbraw/zinc/09/61/22/933096122.db2.gz UJQSTZCKQOHQDP-APWZRJJASA-N 0 3 403.473 4.023 20 0 HIADHN Cc1ccc(-c2nc(C(=O)NC[C@@H]3CCCN(C)[C@@H]3c3cccs3)cs2)n1C ZINC000535388186 933108411 /nfs/dbraw/zinc/10/84/11/933108411.db2.gz JQSGZXWSJMXRAD-KXBFYZLASA-N 0 3 414.600 4.331 20 0 HIADHN Cc1ccc(-c2nc(C(=O)NC[C@H]3CCCN(C)[C@H]3c3cccs3)cs2)n1C ZINC000535388184 933108899 /nfs/dbraw/zinc/10/88/99/933108899.db2.gz JQSGZXWSJMXRAD-DNVCBOLYSA-N 0 3 414.600 4.331 20 0 HIADHN CN1CC[C@H](NC(=O)N(CCc2ccccc2)Cc2ccncc2)[C@H]1c1ccccc1 ZINC000535436663 933134546 /nfs/dbraw/zinc/13/45/46/933134546.db2.gz NXGJKZWQNBVUBM-LOSJGSFVSA-N 0 3 414.553 4.281 20 0 HIADHN CN1CC[C@@H](NC(=O)c2cccc(NC(=O)c3ccc(F)cc3)c2)[C@@H]1c1ccccc1 ZINC000535467048 933156790 /nfs/dbraw/zinc/15/67/90/933156790.db2.gz APKLOPMXHFUUAK-PKTZIBPZSA-N 0 3 417.484 4.253 20 0 HIADHN CC(C)c1ccc(-c2noc(CCC(=O)N[C@H]3CCN(C)[C@H]3c3ccccc3)n2)cc1 ZINC000535470020 933159680 /nfs/dbraw/zinc/15/96/80/933159680.db2.gz RTWODNRJUZVRFX-URXFXBBRSA-N 0 3 418.541 4.354 20 0 HIADHN CC1CCN([C@@H](CNC(=O)Nc2cccc3c2OCCO3)c2cccs2)CC1 ZINC000535471480 933162108 /nfs/dbraw/zinc/16/21/08/933162108.db2.gz HYYFVPVAHZUSOL-KRWDZBQOSA-N 0 3 401.532 4.114 20 0 HIADHN CC[C@H](C)n1ncc(C(=O)Nc2ccc(N3CCN(CC)CC3)cc2C)c1C1CC1 ZINC000535482118 933173026 /nfs/dbraw/zinc/17/30/26/933173026.db2.gz YICOQSSYJHXDSD-SFHVURJKSA-N 0 3 409.578 4.434 20 0 HIADHN CC(C)Cn1ncc(NC(=O)CCCN2CCN(c3ccccc3)CC2)c1C(F)F ZINC000535568972 933246309 /nfs/dbraw/zinc/24/63/09/933246309.db2.gz GPBGCUIXWOBJHU-UHFFFAOYSA-N 0 3 419.520 4.018 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)CCCc3cc(F)ccc3F)CC2)C[C@@H](C)O1 ZINC000535608853 933265349 /nfs/dbraw/zinc/26/53/49/933265349.db2.gz GPMJISDIMTUFAJ-QZTJIDSGSA-N 0 3 408.533 4.025 20 0 HIADHN CC[C@@H](c1ccc(Br)cc1)N1CCN(CCCn2ccnc2C)CC1 ZINC000535668744 933313733 /nfs/dbraw/zinc/31/37/33/933313733.db2.gz ZCZGNSBWJMZCIG-FQEVSTJZSA-N 0 3 405.384 4.113 20 0 HIADHN CC[C@H](c1ccc(Br)cc1)N1CCN(CCCn2ccnc2C)CC1 ZINC000535668745 933314279 /nfs/dbraw/zinc/31/42/79/933314279.db2.gz ZCZGNSBWJMZCIG-HXUWFJFHSA-N 0 3 405.384 4.113 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)Cn2c3ccccc3nc2-c2cscn2)c1 ZINC000535733950 933370421 /nfs/dbraw/zinc/37/04/21/933370421.db2.gz WQFYHFDDGXYJMT-UHFFFAOYSA-N 0 3 405.527 4.169 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(CN(Cc3ccccc3)C[C@@H](C)O)c2)cc1 ZINC000535799752 933395530 /nfs/dbraw/zinc/39/55/30/933395530.db2.gz XAMXLJYUSBWEQN-LJQANCHMSA-N 0 3 404.510 4.331 20 0 HIADHN CC(C)(C)n1cc(CN2CCC[C@H](Cn3ccnn3)C2)c(-c2ccccc2Cl)n1 ZINC000535806020 933400983 /nfs/dbraw/zinc/40/09/83/933400983.db2.gz AOCBLDMVTKUZSP-KRWDZBQOSA-N 0 3 412.969 4.462 20 0 HIADHN CN(C)Cc1cccc(NC(=O)N[C@@H]2CCN(C)[C@H]2c2ccc(Cl)c(F)c2)c1 ZINC000535839375 933424599 /nfs/dbraw/zinc/42/45/99/933424599.db2.gz YGJDJIKXEYFKEB-UXHICEINSA-N 0 3 404.917 4.108 20 0 HIADHN Cc1ccc(C(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)c(Br)c1 ZINC000535857574 933440290 /nfs/dbraw/zinc/44/02/90/933440290.db2.gz ZZSQNEZRTVJVSV-CALCHBBNSA-N 0 3 423.395 4.109 20 0 HIADHN C[C@H](C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)N1CC[C@@H](C2CCOCC2)C1 ZINC000535870355 933452024 /nfs/dbraw/zinc/45/20/24/933452024.db2.gz LZLKHIGMPDVGFJ-TZMCWYRMSA-N 0 3 404.860 4.434 20 0 HIADHN Cc1cc(C)c(CC(C(=O)N(CCC(N)=O)c2ccccc2)C(F)(F)F)c(C)c1 ZINC000535879012 933459668 /nfs/dbraw/zinc/45/96/68/933459668.db2.gz BIABDRLXKHAZIS-LJQANCHMSA-N 0 3 406.448 4.241 20 0 HIADHN Cc1nc2ccccc2n1C[C@@H]1CCCN1CC(=O)N(Cc1ccccc1)C1CC1 ZINC000535962021 933527486 /nfs/dbraw/zinc/52/74/86/933527486.db2.gz CTMOZLQJRGJWFI-QFIPXVFZSA-N 0 3 402.542 4.000 20 0 HIADHN CC1(C)CCC[C@@H](CC(=O)N2CCC[C@@H](CN3CCN(c4ccccn4)CC3)C2)C1 ZINC000535966556 933529414 /nfs/dbraw/zinc/52/94/14/933529414.db2.gz IYQBULOSOKGPSI-VXKWHMMOSA-N 0 3 412.622 4.049 20 0 HIADHN CC(=O)CCc1ccc2oc(C(=O)NC[C@@H](Cc3ccccc3)N(C)C)c(C)c2c1 ZINC000536012419 933571452 /nfs/dbraw/zinc/57/14/52/933571452.db2.gz GAHKJXOLEYOEBI-OAQYLSRUSA-N 0 3 406.526 4.166 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccc(O)cc1)C(=O)c1ccc(Br)s1 ZINC000536035943 933584570 /nfs/dbraw/zinc/58/45/70/933584570.db2.gz OIDSKEDFGNBLDV-OAHLLOKOSA-N 0 3 423.376 4.343 20 0 HIADHN CCCN1CCN(c2ccccc2CNc2cccc(C(=O)NC(C)(C)C)c2)CC1 ZINC000536103214 933655985 /nfs/dbraw/zinc/65/59/85/933655985.db2.gz OPMWNANDEUVPMD-UHFFFAOYSA-N 0 3 408.590 4.359 20 0 HIADHN CN(C(=O)CN[C@H](c1ccc2c(c1)OCCO2)C1CC1)[C@@H]1CCCc2ccccc21 ZINC000537288182 933698870 /nfs/dbraw/zinc/69/88/70/933698870.db2.gz MDWIGIUIFNXSIY-BWKNWUBXSA-N 0 3 406.526 4.035 20 0 HIADHN CC(C)(C)[C@@H](COc1ccccc1F)NCC(=O)Nc1ccccc1OC(F)F ZINC000537290098 933699527 /nfs/dbraw/zinc/69/95/27/933699527.db2.gz HBPGNKYRJWPDOW-GOSISDBHSA-N 0 3 410.436 4.449 20 0 HIADHN C[C@@]1(CCCO)CCCN1CC(=O)N[C@H](c1ccccc1)c1ccc(Cl)cc1 ZINC000537409807 933762733 /nfs/dbraw/zinc/76/27/33/933762733.db2.gz AKNJJCKWSVBFTG-PKTZIBPZSA-N 0 3 400.950 4.173 20 0 HIADHN C[C@]1(CCCO)CCCN1CC(=O)N[C@@H](c1ccccc1)c1ccc(Cl)cc1 ZINC000537409808 933762879 /nfs/dbraw/zinc/76/28/79/933762879.db2.gz AKNJJCKWSVBFTG-XZOQPEGZSA-N 0 3 400.950 4.173 20 0 HIADHN Cc1cc(C(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)nn1[C@H](C)C1CC1 ZINC000537420258 933768873 /nfs/dbraw/zinc/76/88/73/933768873.db2.gz LLGRUAZBWJZKBP-MRXNPFEDSA-N 0 3 422.495 4.385 20 0 HIADHN C[C@@H](NC1(c2ccc3c(c2)OCO3)CC1)c1ccc(I)cc1 ZINC000537449223 933777403 /nfs/dbraw/zinc/77/74/03/933777403.db2.gz XEUPEGOCFGWRRQ-GFCCVEGCSA-N 0 3 407.251 4.360 20 0 HIADHN CC(C)N1CC[C@H](NC(=O)N[C@H]2CCCc3cn[nH]c32)[C@H]1c1ccc(Cl)c(F)c1 ZINC000537453964 933779812 /nfs/dbraw/zinc/77/98/12/933779812.db2.gz HMTPPWVECDRUCJ-CMKODMSKSA-N 0 3 419.932 4.103 20 0 HIADHN O=c1cc(CN2CC[C@@H](c3cccc(Cl)c3)C2)nc2ccc(Br)cn12 ZINC000562427750 945074607 /nfs/dbraw/zinc/07/46/07/945074607.db2.gz WCIHJFSRTIKFOB-CQSZACIVSA-N 0 3 418.722 4.100 20 0 HIADHN CC(C)N1CCC[C@@H](NC2(c3ccc(OCc4ccccc4)cc3)CCOCC2)C1=O ZINC000562619950 945108830 /nfs/dbraw/zinc/10/88/30/945108830.db2.gz UXEHIFQXINVNPE-XMMPIXPASA-N 0 3 422.569 4.260 20 0 HIADHN CC(C)n1ncc2cc(CN3CCC[C@H](c4nc(-c5ccccc5)n[nH]4)C3)cnc21 ZINC000537560502 938324508 /nfs/dbraw/zinc/32/45/08/938324508.db2.gz GNFXZSKCOJPAQT-IBGZPJMESA-N 0 3 401.518 4.177 20 0 HIADHN COc1cccc(CN(Cc2cc3c(cc2OC)C[C@H](C)O3)C2CCC(O)CC2)c1 ZINC000537614407 938333429 /nfs/dbraw/zinc/33/34/29/938333429.db2.gz QCOBJUNUFVUTAA-YTXWROIDSA-N 0 3 411.542 4.333 20 0 HIADHN CCO[C@H]1C[C@@H](O)C12CCN(Cc1ccc(-c3ccc(Br)cc3)o1)CC2 ZINC000537617127 938334752 /nfs/dbraw/zinc/33/47/52/938334752.db2.gz QIZSJUHYHYIKIK-UXHICEINSA-N 0 3 420.347 4.461 20 0 HIADHN Cn1cc(CN2CCC[C@H](c3nc(C(F)(F)F)cs3)C2)c(-c2cccnc2)n1 ZINC000537622395 938337454 /nfs/dbraw/zinc/33/74/54/938337454.db2.gz XNLIPZYVCXXARN-AWEZNQCLSA-N 0 3 407.465 4.337 20 0 HIADHN CCCN1CCN(c2ccccc2CN(C)Cc2nccn2Cc2ccccc2)CC1 ZINC000537629074 938339698 /nfs/dbraw/zinc/33/96/98/938339698.db2.gz KSGPLMLHVJGBKH-UHFFFAOYSA-N 0 3 417.601 4.095 20 0 HIADHN CCCN(CC(F)(F)F)C(=O)[C@H]1CCCN(Cc2ccc(OC)c(OCC)c2)C1 ZINC000537649589 938346711 /nfs/dbraw/zinc/34/67/11/938346711.db2.gz PHMXZBNCHNCBOI-KRWDZBQOSA-N 0 3 416.484 4.107 20 0 HIADHN CC[C@H]1c2ccsc2CCN1C(=O)CN1CCC[C@@H]1Cn1cnc2ccccc21 ZINC000537678898 938352478 /nfs/dbraw/zinc/35/24/78/938352478.db2.gz WCWKUIWXMPAHRX-XLIONFOSSA-N 0 3 408.571 4.098 20 0 HIADHN CCOc1cc(CN2CCC(Cn3ccnn3)CC2)ccc1OCc1ccccc1 ZINC000537698986 938358357 /nfs/dbraw/zinc/35/83/57/938358357.db2.gz BKBNHEWNNWLOJF-UHFFFAOYSA-N 0 3 406.530 4.168 20 0 HIADHN COCCn1ccc2ccc(NC(=O)N[C@@H](CN3CCCC3)c3ccccc3)cc21 ZINC000537801575 938379588 /nfs/dbraw/zinc/37/95/88/938379588.db2.gz KGPGPMADJMVEOF-QFIPXVFZSA-N 0 3 406.530 4.246 20 0 HIADHN O=C([C@@H]1CC12CCN(CCOc1ccccc1C(F)(F)F)CC2)N1CCCCC1 ZINC000537804181 938380405 /nfs/dbraw/zinc/38/04/05/938380405.db2.gz VMKYOIUGBZKWGW-SFHVURJKSA-N 0 3 410.480 4.199 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)Nc1ccc2[nH]c(C(F)F)nc2c1 ZINC000537883720 938399304 /nfs/dbraw/zinc/39/93/04/938399304.db2.gz OTOZOFCHNVMLJV-UHFFFAOYSA-N 0 3 423.414 4.374 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)N[C@H](c2ccccc2)[C@H]2CCOC2)CC1 ZINC000537895078 938403082 /nfs/dbraw/zinc/40/30/82/938403082.db2.gz SFNLYDPGMQEXML-LADGPHEKSA-N 0 3 407.558 4.070 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1cccc(-c2ccc3c(c2)CCO3)c1 ZINC000537912877 938410306 /nfs/dbraw/zinc/41/03/06/938410306.db2.gz YOMKETDDMQTLQD-UHFFFAOYSA-N 0 3 405.498 4.477 20 0 HIADHN CC[C@H](N[C@H](C)c1ccc(NC(C)=O)cc1OC)[C@@H](c1ccc(C)cc1)n1cncn1 ZINC000537948964 938428501 /nfs/dbraw/zinc/42/85/01/938428501.db2.gz NEUSXZLCJQLALV-OUPRXKBMSA-N 0 3 421.545 4.272 20 0 HIADHN C[C@@H]1C[C@H](N[C@@H]2CCCN(CC(F)(F)F)C2=O)c2cccc(Br)c21 ZINC000537948297 938428655 /nfs/dbraw/zinc/42/86/55/938428655.db2.gz GMLSZXOWECMRSV-HONMWMINSA-N 0 3 405.258 4.140 20 0 HIADHN Cc1ccc(S(=O)(=O)NCCN[C@@H](C)c2sc(-c3ccccc3)nc2C)s1 ZINC000537950554 938429900 /nfs/dbraw/zinc/42/99/00/938429900.db2.gz CHCSIVIQMHZCLH-AWEZNQCLSA-N 0 3 421.613 4.118 20 0 HIADHN Cc1cc([C@@H](N[C@@H](C)c2cccc(N3CCCS3(=O)=O)c2)C2CC2)ccc1F ZINC000537952757 938430475 /nfs/dbraw/zinc/43/04/75/938430475.db2.gz RXYZSTOCCCNRIH-AOMKIAJQSA-N 0 3 402.535 4.476 20 0 HIADHN CC(C)C[C@@H](N[C@H](C)c1ccc(NC(=O)NC(C)C)cc1)C(=O)Nc1nccs1 ZINC000537952594 938430646 /nfs/dbraw/zinc/43/06/46/938430646.db2.gz MBFKIQKYAIAQCK-CRAIPNDOSA-N 0 3 417.579 4.377 20 0 HIADHN CC1CCN(S(=O)(=O)Cc2ccccc2CN[C@@H]2CCc3cc(F)ccc32)CC1 ZINC000537953999 938431540 /nfs/dbraw/zinc/43/15/40/938431540.db2.gz QCVXGPINAZQOCS-HSZRJFAPSA-N 0 3 416.562 4.165 20 0 HIADHN CC(C)CC[C@H](NC[C@@H](O)CS(=O)(=O)c1cccs1)c1ccc(Cl)cc1 ZINC000537953940 938431784 /nfs/dbraw/zinc/43/17/84/938431784.db2.gz NUGINISTCNLCJH-MSOLQXFVSA-N 0 3 416.008 4.303 20 0 HIADHN C[C@H]1Cc2ccc(F)cc2[C@@H]1NCc1ccc(Br)cc1N1CCOCC1 ZINC000537960614 938435408 /nfs/dbraw/zinc/43/54/08/938435408.db2.gz BNYISQPYRKBBDS-LHSJRXKWSA-N 0 3 419.338 4.448 20 0 HIADHN CCSc1ccc([C@H](C)NCc2ccc(CS(=O)(=O)NC(C)C)cc2)cc1 ZINC000537965495 938437768 /nfs/dbraw/zinc/43/77/68/938437768.db2.gz ONLOSUKLZCLBJE-KRWDZBQOSA-N 0 3 406.617 4.477 20 0 HIADHN C[C@@H](NCc1cccc(NS(C)(=O)=O)c1)c1cccc(OCc2ccccc2)c1 ZINC000537972781 938441949 /nfs/dbraw/zinc/44/19/49/938441949.db2.gz CAKMOLKXNQMMAB-GOSISDBHSA-N 0 3 410.539 4.488 20 0 HIADHN O=C1CCCN1Cc1cccc(CN[C@@H]2CCc3c2cc(Br)cc3F)c1 ZINC000537974869 938443855 /nfs/dbraw/zinc/44/38/55/938443855.db2.gz RWGAPLWZYGUWLD-HXUWFJFHSA-N 0 3 417.322 4.488 20 0 HIADHN O=C1[C@@H](N[C@@H]2CCCc3nc(-c4ccc(F)cc4)sc32)CCN1CC(F)(F)F ZINC000537978014 938444483 /nfs/dbraw/zinc/44/44/83/938444483.db2.gz DIUODQSWBWBMHX-HIFRSBDPSA-N 0 3 413.440 4.079 20 0 HIADHN O=C(NCCN[C@@H]1CCc2c1cc(Br)cc2F)c1ccccc1Cl ZINC000537979227 938445268 /nfs/dbraw/zinc/44/52/68/938445268.db2.gz YOGYOXXUTBXGED-QGZVFWFLSA-N 0 3 411.702 4.249 20 0 HIADHN COc1ccc(-c2ccc(CN[C@H](C)c3ccc(S(=O)(=O)N(C)C)cc3)cc2)cc1 ZINC000537986262 938449223 /nfs/dbraw/zinc/44/92/23/938449223.db2.gz GSEFFBSFPYFPFD-GOSISDBHSA-N 0 3 424.566 4.463 20 0 HIADHN C[C@@H]1C[C@H](NCc2ccc(S(=O)(=O)N(C)C)cc2)c2cccc(Br)c21 ZINC000537987844 938450087 /nfs/dbraw/zinc/45/00/87/938450087.db2.gz QVVWETPZHGZRBA-ACJLOTCBSA-N 0 3 423.376 4.038 20 0 HIADHN CCC[C@@H](NCc1ccc(S(=O)(=O)N2CCCC2)cc1)c1ccc(OC)cc1 ZINC000537990997 938452271 /nfs/dbraw/zinc/45/22/71/938452271.db2.gz PMSOAUZPWIHDDH-JOCHJYFZSA-N 0 3 402.560 4.111 20 0 HIADHN CS(=O)(=O)Nc1ccc(OCCNCc2ccc(-c3ccc(Cl)cc3)o2)cc1 ZINC000538001891 938458118 /nfs/dbraw/zinc/45/81/18/938458118.db2.gz GCLTUNJEKGCUIJ-UHFFFAOYSA-N 0 3 420.918 4.140 20 0 HIADHN COc1ccc(C[C@H](NCCc2ncn(C)n2)c2cc(Cl)ccc2Cl)cc1 ZINC000538020415 938465799 /nfs/dbraw/zinc/46/57/99/938465799.db2.gz FPIOMIOGJXUGCK-IBGZPJMESA-N 0 3 405.329 4.247 20 0 HIADHN CO[C@@H](c1ccc(Br)cc1)[C@@H](C)NCc1cc(-c2cccnc2)n[nH]1 ZINC000538022237 938466642 /nfs/dbraw/zinc/46/66/42/938466642.db2.gz GERWQJRXTXILQZ-BFUOFWGJSA-N 0 3 401.308 4.100 20 0 HIADHN CCOc1ccc([C@H](N[C@H](C)c2cccc(S(N)(=O)=O)c2)C(C)C)cc1OCC ZINC000538061505 938491625 /nfs/dbraw/zinc/49/16/25/938491625.db2.gz UHNFCTBKKCQSIF-OPAMFIHVSA-N 0 3 420.575 4.179 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)N[C@@H]1CCO[C@H]1c1ccc(Cl)c(F)c1 ZINC000538116091 938506021 /nfs/dbraw/zinc/50/60/21/938506021.db2.gz IEUYTJKNRYDLMQ-RTWAWAEBSA-N 0 3 419.928 4.083 20 0 HIADHN COc1cc([C@H](C)NCc2ccc3c(c2)ncn3C)ccc1OCc1ccncc1 ZINC000538119595 938507842 /nfs/dbraw/zinc/50/78/42/938507842.db2.gz DAZWAMAJPZPXCM-KRWDZBQOSA-N 0 3 402.498 4.407 20 0 HIADHN Cc1ccc(OC[C@@H](O)CN[C@H](C)c2cccc(NC(=O)c3ccccc3)c2)cc1 ZINC000538128965 938513978 /nfs/dbraw/zinc/51/39/78/938513978.db2.gz VZSDQGYHWNGGIN-XXBNENTESA-N 0 3 404.510 4.338 20 0 HIADHN CCC(=O)Nc1ccc(S(=O)(=O)[N-]c2ccc(C[N@@H+]3CCCC[C@@H]3C)cc2)cc1 ZINC000538133235 938515618 /nfs/dbraw/zinc/51/56/18/938515618.db2.gz JWGLSAAVGLKFSK-KRWDZBQOSA-N 0 3 415.559 4.210 20 0 HIADHN CCC(=O)Nc1ccc(S(=O)(=O)[N-]c2ccc(C[N@H+]3CCCC[C@@H]3C)cc2)cc1 ZINC000538133235 938515622 /nfs/dbraw/zinc/51/56/22/938515622.db2.gz JWGLSAAVGLKFSK-KRWDZBQOSA-N 0 3 415.559 4.210 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)Nc1ccc2c(c1)OCCCO2)c1ccc(Br)cc1 ZINC000538142393 938518824 /nfs/dbraw/zinc/51/88/24/938518824.db2.gz AJDHSJNGAXLJFH-KGLIPLIRSA-N 0 3 419.319 4.288 20 0 HIADHN CC[C@H](NCCO[C@@H]1CCCC[C@H]1C)c1ccccc1OCC(=O)N1CCCC1 ZINC000538149783 938522158 /nfs/dbraw/zinc/52/21/58/938522158.db2.gz DMOGMNVVZZNQSU-BAGYTPMASA-N 0 3 402.579 4.324 20 0 HIADHN COc1ccc(CNC(=O)CN[C@@H](CC(C)(C)C)c2ccc(F)cc2)cc1OC ZINC000538151156 938522827 /nfs/dbraw/zinc/52/28/27/938522827.db2.gz ORXIEURZNQRKSQ-IBGZPJMESA-N 0 3 402.510 4.226 20 0 HIADHN CC(C)[C@@H](NCC(=O)Nc1ccc(C(=O)N(C)C)cc1)c1cccc(C(F)(F)F)c1 ZINC000538159956 938529795 /nfs/dbraw/zinc/52/97/95/938529795.db2.gz WTKCETWIUYYYQD-HXUWFJFHSA-N 0 3 421.463 4.333 20 0 HIADHN C[C@@H](NCCN1C(=O)NC2(CCCC2)C1=O)c1ccc(Oc2ccccc2)c(F)c1 ZINC000538166241 938532512 /nfs/dbraw/zinc/53/25/12/938532512.db2.gz OCQMLTLVTONFGT-MRXNPFEDSA-N 0 3 411.477 4.133 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(NC(=O)c2ccncc2)cc1)C(=O)NC1CCC(C)CC1 ZINC000538187868 938544007 /nfs/dbraw/zinc/54/40/07/938544007.db2.gz JTXFSWVIVQXINL-BKVYSMKUSA-N 0 3 408.546 4.068 20 0 HIADHN C[C@@H](N[C@@H](C)c1cccc(-n2cccn2)c1)C(=O)N(C)Cc1c(F)cccc1Cl ZINC000538187396 938544039 /nfs/dbraw/zinc/54/40/39/938544039.db2.gz HBYRMTBQXZYGNC-JKSUJKDBSA-N 0 3 414.912 4.363 20 0 HIADHN CCOc1ccc([C@@H]2CCCN2C(=O)CN[C@H](c2ccccc2)[C@@H]2CCOC2)cc1 ZINC000538189559 938545869 /nfs/dbraw/zinc/54/58/69/938545869.db2.gz GFJJFVHDVYLPGD-NMVJMZGASA-N 0 3 408.542 4.116 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)N[C@H]1CCO[C@H]1c1ccc(Cl)cc1 ZINC000538191584 938547106 /nfs/dbraw/zinc/54/71/06/938547106.db2.gz PILRWRWCQGVNJO-OALUTQOASA-N 0 3 407.967 4.005 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(NC(=O)c2ccncc2)cc1)C(=O)N(C)Cc1ccccc1 ZINC000538194806 938548447 /nfs/dbraw/zinc/54/84/47/938548447.db2.gz LQCFEEQOUPHANB-RTBURBONSA-N 0 3 416.525 4.032 20 0 HIADHN C[C@H](NCc1ccc(I)cc1)c1cccc(N2CCCC2=O)c1 ZINC000538208590 938556249 /nfs/dbraw/zinc/55/62/49/938556249.db2.gz RMOHHQJEHUITNK-AWEZNQCLSA-N 0 3 420.294 4.269 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)Nc2cccc(SC)c2C)CC1 ZINC000538212586 938558407 /nfs/dbraw/zinc/55/84/07/938558407.db2.gz PCXGJLMRTJDWNI-UHFFFAOYSA-N 0 3 412.603 4.176 20 0 HIADHN O=C(CNC1(c2cccc(Cl)c2)CCCC1)Nc1cccc(C(=O)NC2CC2)c1 ZINC000538223186 938563393 /nfs/dbraw/zinc/56/33/93/938563393.db2.gz HTMOJZBRHXBQGD-UHFFFAOYSA-N 0 3 411.933 4.230 20 0 HIADHN Cc1cc(Br)ccc1NC(=O)CN[C@@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000538225594 938564837 /nfs/dbraw/zinc/56/48/37/938564837.db2.gz HJLGIMWTXHBPFT-JXFKEZNVSA-N 0 3 417.347 4.454 20 0 HIADHN Cc1cc(Br)ccc1NC(=O)CN[C@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000538225599 938564913 /nfs/dbraw/zinc/56/49/13/938564913.db2.gz HJLGIMWTXHBPFT-OXJNMPFZSA-N 0 3 417.347 4.454 20 0 HIADHN COc1cc2c(cc1OC)CN(C(=O)CN[C@@H](c1cccc(F)c1)C(C)(C)C)CC2 ZINC000538225213 938564997 /nfs/dbraw/zinc/56/49/97/938564997.db2.gz QFJKGXYZHMLXFT-QHCPKHFHSA-N 0 3 414.521 4.105 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)N[C@@H](C)C(=O)Nc2ccccc2OC(F)F)cc1 ZINC000538262286 938577886 /nfs/dbraw/zinc/57/78/86/938577886.db2.gz QXKRFOIGXNNREP-GJZGRUSLSA-N 0 3 414.456 4.460 20 0 HIADHN C[C@H](CS(=O)(=O)c1ccccc1)NCCc1csc(-c2ccc(Cl)cc2)n1 ZINC000538308101 938589283 /nfs/dbraw/zinc/58/92/83/938589283.db2.gz KTTWQQAMENHXEF-OAHLLOKOSA-N 0 3 420.987 4.458 20 0 HIADHN Cc1nc(-c2ccc(C)cc2NC(=O)CN[C@@H](c2ccc(F)c(C)c2)C2CC2)n[nH]1 ZINC000538321295 938591671 /nfs/dbraw/zinc/59/16/71/938591671.db2.gz YVQVRUFUOZNUQG-JOCHJYFZSA-N 0 3 407.493 4.215 20 0 HIADHN CC[C@H]1c2ccsc2CCN1C(=O)CN[C@@H](c1ccc2c(c1)OCCO2)C1CC1 ZINC000538390178 938608921 /nfs/dbraw/zinc/60/89/21/938608921.db2.gz ODKNVKGCCBJTOP-FDDCHVKYSA-N 0 3 412.555 4.096 20 0 HIADHN CCc1c2cc(C)ccc2oc1[C@@H](C)NC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2 ZINC000538396942 938610789 /nfs/dbraw/zinc/61/07/89/938610789.db2.gz JWZVHPUCRVWDJU-SJLPKXTDSA-N 0 3 422.525 4.279 20 0 HIADHN Cc1cc(F)ccc1CNCc1ccccc1CN1C(=O)NC2(CCCCC2)C1=O ZINC000538400785 938611722 /nfs/dbraw/zinc/61/17/22/938611722.db2.gz CJKHCEPJEZNBRQ-UHFFFAOYSA-N 0 3 409.505 4.179 20 0 HIADHN CC[C@H](N[C@@H](C)[C@@H](OC)c1ccccc1F)c1ccccc1OCC(=O)N(C)C ZINC000538406423 938613078 /nfs/dbraw/zinc/61/30/78/938613078.db2.gz DNVNCJUGRTUDPJ-ITSWEJNFSA-N 0 3 402.510 4.110 20 0 HIADHN CCNC(=O)COc1cccc(CN[C@H](CC)c2cc(F)cc(Br)c2)c1 ZINC000538409638 938613351 /nfs/dbraw/zinc/61/33/51/938613351.db2.gz SYVGBEBXFZONAO-LJQANCHMSA-N 0 3 423.326 4.344 20 0 HIADHN CC[C@@H](C)Oc1cc(CNC(=O)N(Cc2ccccc2)C2CCN(C)CC2)ccn1 ZINC000538646991 938672281 /nfs/dbraw/zinc/67/22/81/938672281.db2.gz KVXVXNFOQFQXTG-LJQANCHMSA-N 0 3 410.562 4.065 20 0 HIADHN CCCOc1c(Br)cc(CN2CC[C@H](C3CCOCC3)C2)cc1OC ZINC000538723938 938692282 /nfs/dbraw/zinc/69/22/82/938692282.db2.gz HPMLXYHXDGWJGD-KRWDZBQOSA-N 0 3 412.368 4.495 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)cc1CN1CCC[C@H](CNC(=O)C(C)(C)C)C1 ZINC000538733372 938696653 /nfs/dbraw/zinc/69/66/53/938696653.db2.gz LELUHGYMQKLXFT-QGZVFWFLSA-N 0 3 402.970 4.208 20 0 HIADHN C/C(=C\c1ccccc1)CN1CCC(C(=O)c2ccc3c(c2)NC(=O)[C@H](C)O3)CC1 ZINC000538739617 938697532 /nfs/dbraw/zinc/69/75/32/938697532.db2.gz INTVNIBWZUHDOQ-UMADGWCESA-N 0 3 404.510 4.404 20 0 HIADHN COc1ccc(CN2CCC(CN3CCCCC3=O)CC2)cc1OCc1ccccc1 ZINC000538737851 938697544 /nfs/dbraw/zinc/69/75/44/938697544.db2.gz GPJXLQQESYYWET-UHFFFAOYSA-N 0 3 422.569 4.499 20 0 HIADHN CC(C)(C)OC(=O)C1CCC(N[C@@H](C(=O)N2CCCCC2)c2ccccc2)CC1 ZINC000538755023 938703238 /nfs/dbraw/zinc/70/32/38/938703238.db2.gz VAJCRAQQWYPDDP-XVAXZDLZSA-N 0 3 400.563 4.230 20 0 HIADHN COc1cc2c(c(OC)c1OC)CCN(Cc1cnc(-c3ccccc3)s1)CC2 ZINC000538761414 938704068 /nfs/dbraw/zinc/70/40/68/938704068.db2.gz CFWONYSELGNBES-UHFFFAOYSA-N 0 3 410.539 4.437 20 0 HIADHN Cc1ccc(Cn2cc(CN3CCC(OCCO)CC3)c(-c3ccc(C)cc3)n2)cc1 ZINC000538762805 938704929 /nfs/dbraw/zinc/70/49/29/938704929.db2.gz LERHJVMULTVHNA-UHFFFAOYSA-N 0 3 419.569 4.189 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)Cc2cccc(C(F)(F)F)c2)cc1 ZINC000538830950 938721733 /nfs/dbraw/zinc/72/17/33/938721733.db2.gz ZAQUOFHUJOPCDR-HXUWFJFHSA-N 0 3 406.448 4.210 20 0 HIADHN CN(C)Cc1ccc(C(N)=O)cc1NCc1cn(Cc2ccccc2)nc1C(C)(C)C ZINC000538833427 938722370 /nfs/dbraw/zinc/72/23/70/938722370.db2.gz BZINAHPQMKKBRU-UHFFFAOYSA-N 0 3 419.573 4.002 20 0 HIADHN COCCn1ccc2ccc(NC(=O)N[C@@H]3C[C@@H](C)N(Cc4ccccc4)C3)cc21 ZINC000538903150 938734497 /nfs/dbraw/zinc/73/44/97/938734497.db2.gz SYYPTWJCNRHLHI-XMSQKQJNSA-N 0 3 406.530 4.072 20 0 HIADHN CC(C)Cn1cc(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2)c(C(F)F)n1 ZINC000539014444 938769071 /nfs/dbraw/zinc/76/90/71/938769071.db2.gz PQLLEDSJQCGUJS-UHFFFAOYSA-N 0 3 411.472 4.212 20 0 HIADHN CCc1ccc([C@@H](CO)N[C@H](C)CC(=O)Nc2ccc(Br)cc2)cc1 ZINC000539041897 938778682 /nfs/dbraw/zinc/77/86/82/938778682.db2.gz UKWMEYSUNNHKCT-AUUYWEPGSA-N 0 3 405.336 4.052 20 0 HIADHN C[C@H](N[C@@H]1CC(=O)N(C)[C@@H]1c1ccc(Cl)cc1)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000539049410 938782676 /nfs/dbraw/zinc/78/26/76/938782676.db2.gz QLGZXMVIPCRYAC-DRWCTHJISA-N 0 3 411.933 4.192 20 0 HIADHN Cc1c([C@@H](C)NCCNC(=O)c2ccccc2F)cnn1-c1cccc(Cl)c1 ZINC000539063388 938789433 /nfs/dbraw/zinc/78/94/33/938789433.db2.gz CBDFSABOTJGTDI-CQSZACIVSA-N 0 3 400.885 4.054 20 0 HIADHN C[C@@H](N[C@@H](C)c1nc(-c2ccncc2)cs1)[C@H](c1ccccc1)N1CCOCC1 ZINC000539070181 938793071 /nfs/dbraw/zinc/79/30/71/938793071.db2.gz IFDFTHQOJOACPE-KGVIQGDOSA-N 0 3 408.571 4.318 20 0 HIADHN Cc1nc(-c2ccccc2F)sc1[C@@H](C)NCc1cccc(NS(C)(=O)=O)c1 ZINC000539071799 938793934 /nfs/dbraw/zinc/79/39/34/938793934.db2.gz DIRIQIXPVWVMOI-CYBMUJFWSA-N 0 3 419.547 4.480 20 0 HIADHN COc1ccc([C@H](C)NCc2ccc(C(=O)N3C[C@H](C)O[C@@H](C)C3)cc2)cc1Cl ZINC000539093456 938801760 /nfs/dbraw/zinc/80/17/60/938801760.db2.gz LQIIWYNMQRHLRT-ULQDDVLXSA-N 0 3 416.949 4.449 20 0 HIADHN Brc1ccc(N2CC[C@@H](CNCc3ccn(-c4ccccc4)n3)C2)cc1 ZINC000539105104 938803733 /nfs/dbraw/zinc/80/37/33/938803733.db2.gz NNQRJCGUHSXRET-KRWDZBQOSA-N 0 3 411.347 4.251 20 0 HIADHN COc1cccc(C[C@@H](NCc2ccccc2CS(C)(=O)=O)c2ccccc2)c1 ZINC000539120748 938805743 /nfs/dbraw/zinc/80/57/43/938805743.db2.gz VKLWEULEZXIGOT-XMMPIXPASA-N 0 3 409.551 4.313 20 0 HIADHN COc1cc(OC)c(CCN[C@@H](C)c2nc3ccc(Cl)cc3n2C)c(OC)c1 ZINC000539201706 938818744 /nfs/dbraw/zinc/81/87/44/938818744.db2.gz DWGGBUOAXNTPRM-ZDUSSCGKSA-N 0 3 403.910 4.146 20 0 HIADHN CCc1cnccc1[C@@H](C)N[C@H](C)c1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000539216304 938820108 /nfs/dbraw/zinc/82/01/08/938820108.db2.gz UDNLFYBNLHTHCY-QZTJIDSGSA-N 0 3 401.576 4.230 20 0 HIADHN CCCCn1cc(CN[C@@H](C)CC(=O)Nc2cccc(Br)c2)c(C)n1 ZINC000539217752 938820234 /nfs/dbraw/zinc/82/02/34/938820234.db2.gz MFYXKHQPIALNMR-AWEZNQCLSA-N 0 3 407.356 4.261 20 0 HIADHN CC(C)[C@@H](N[C@@H](C)c1cccc(S(N)(=O)=O)c1)c1ccc(C(F)(F)F)cc1 ZINC000539217395 938820264 /nfs/dbraw/zinc/82/02/64/938820264.db2.gz NUMCHEVJNGVFBL-SCLBCKFNSA-N 0 3 400.466 4.401 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@H](C)N[C@@H](C)c2cccc(OC(C)C)c2)cc1OC ZINC000539226130 938821780 /nfs/dbraw/zinc/82/17/80/938821780.db2.gz LFTUCWDVGSWSQQ-ROUUACIJSA-N 0 3 414.546 4.189 20 0 HIADHN COc1ccc(NC(=O)[C@H](NC[C@H]2CCC[C@H]2OC)c2ccccc2)cc1Cl ZINC000539239475 938823554 /nfs/dbraw/zinc/82/35/54/938823554.db2.gz OLGZXQWTJIUWSA-OZOXKJRCSA-N 0 3 402.922 4.433 20 0 HIADHN CC[C@@H](NCC(=O)N(C)Cc1ccccc1Br)c1ccc(OC)cc1 ZINC000539242968 938824498 /nfs/dbraw/zinc/82/44/98/938824498.db2.gz CYXJULMWBBDHAH-LJQANCHMSA-N 0 3 405.336 4.157 20 0 HIADHN COc1ccc(C[C@H](NCC(=O)N2CCc3ccccc32)c2ccccc2)cc1OC ZINC000539259839 938828670 /nfs/dbraw/zinc/82/86/70/938828670.db2.gz ZMOBWDZDIUFVKD-QFIPXVFZSA-N 0 3 416.521 4.167 20 0 HIADHN CC(C)[C@@H](NCc1cccc(S(=O)(=O)N(C)C)c1)c1cccc(C(F)(F)F)c1 ZINC000539260622 938828886 /nfs/dbraw/zinc/82/88/86/938828886.db2.gz PUJYCZGTEPBHKB-LJQANCHMSA-N 0 3 414.493 4.443 20 0 HIADHN C[C@H](N[C@@H](C)c1ccccc1-n1cccn1)C(=O)N(C)Cc1c(F)cccc1Cl ZINC000539259887 938828987 /nfs/dbraw/zinc/82/89/87/938828987.db2.gz BYWSOWTZZCNSNX-HOTGVXAUSA-N 0 3 414.912 4.363 20 0 HIADHN C[C@@H](N[C@H](C)c1ccccc1-n1cccn1)C(=O)N(C)Cc1nc2ccccc2s1 ZINC000539261452 938829111 /nfs/dbraw/zinc/82/91/11/938829111.db2.gz PCLNSJPZMLBTPU-IAGOWNOFSA-N 0 3 419.554 4.180 20 0 HIADHN CC[C@H](N[C@@H](C)C(=O)N1CCC[C@@H]1c1cccs1)c1ccc2c(c1)OCCO2 ZINC000539276855 938831959 /nfs/dbraw/zinc/83/19/59/938831959.db2.gz QTOZIXWIVMVIBV-RYQLBKOJSA-N 0 3 400.544 4.312 20 0 HIADHN CC[C@@H](NCC(=O)N(CC)[C@@H](C)c1ccc(F)cc1)c1ccc2c(c1)OCCO2 ZINC000539278603 938832155 /nfs/dbraw/zinc/83/21/55/938832155.db2.gz DKUKBYDFRFQDFD-OXJNMPFZSA-N 0 3 400.494 4.247 20 0 HIADHN Cc1cccc([C@@H](C)NCC(=O)N2CCC[C@@H]2c2ccc3c(c2)OCCCO3)c1C ZINC000539286320 938833640 /nfs/dbraw/zinc/83/36/40/938833640.db2.gz HYZLHXWONIQTLH-DENIHFKCSA-N 0 3 408.542 4.479 20 0 HIADHN C[C@@H](N[C@H](C)c1cccc(-n2cccn2)c1)C(=O)Nc1cccc(Br)c1 ZINC000539289062 938834154 /nfs/dbraw/zinc/83/41/54/938834154.db2.gz NSMMDUWKARQIQW-HUUCEWRRSA-N 0 3 413.319 4.313 20 0 HIADHN COc1ccc(-c2csc(NC(=O)CN[C@@H](c3ccccc3)[C@H]3CCOC3)n2)cc1 ZINC000539289384 938834266 /nfs/dbraw/zinc/83/42/66/938834266.db2.gz MWUYXUUTPZGUJU-AVRDEDQJSA-N 0 3 423.538 4.125 20 0 HIADHN COc1ccc2cc(CN(C)C(=O)CN[C@H](c3ccccc3)[C@@H]3CCOC3)ccc2c1 ZINC000539288889 938834272 /nfs/dbraw/zinc/83/42/72/938834272.db2.gz GWKSEKZMXBOHFT-ZEQKJWHPSA-N 0 3 418.537 4.174 20 0 HIADHN CC(C)C[C@@H](NCC(=O)Nc1ccccc1SCC(N)=O)c1ccc(Cl)cc1 ZINC000539296916 938835922 /nfs/dbraw/zinc/83/59/22/938835922.db2.gz GITOXRFQQWOURK-GOSISDBHSA-N 0 3 419.978 4.233 20 0 HIADHN Cc1ccccc1NC(=O)[C@H](C)N[C@H](C)c1ccc(NC(=O)c2ccncc2)cc1 ZINC000539297325 938836010 /nfs/dbraw/zinc/83/60/10/938836010.db2.gz QSJJLBDMHRHBCA-MSOLQXFVSA-N 0 3 402.498 4.320 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)NCCC1=CCCCC1)c1ccc(NC(=O)c2ccncc2)cc1 ZINC000539298305 938836145 /nfs/dbraw/zinc/83/61/45/938836145.db2.gz ORVGMPYXQKPQTF-MOPGFXCFSA-N 0 3 420.557 4.380 20 0 HIADHN COc1cc(C(C)=O)ccc1OC[C@H](O)CN[C@H](c1ccccc1F)C1CCCC1 ZINC000539325705 938841730 /nfs/dbraw/zinc/84/17/30/938841730.db2.gz OXVHYWJECNRAJR-DVECYGJZSA-N 0 3 415.505 4.298 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1NC(=O)CN[C@H](C[C@H]1CCOC1)c1ccccc1 ZINC000539326894 938842025 /nfs/dbraw/zinc/84/20/25/938842025.db2.gz ZFHKHENHMXXSTF-NFBKMPQASA-N 0 3 418.541 4.185 20 0 HIADHN COCc1cccc(CNC(=O)CN[C@@H](c2ccc(C(F)(F)F)cc2)C(C)C)c1 ZINC000539326126 938842070 /nfs/dbraw/zinc/84/20/70/938842070.db2.gz NPILDRFXYODPLB-OAQYLSRUSA-N 0 3 408.464 4.455 20 0 HIADHN COc1cc(NC(=O)CN[C@H](C[C@@H]2CCOC2)c2ccccc2)c(OC)cc1Cl ZINC000539334509 938843581 /nfs/dbraw/zinc/84/35/81/938843581.db2.gz ZMTVDHPFIFDOHW-MAUKXSAKSA-N 0 3 418.921 4.053 20 0 HIADHN C[C@@H](NCC(=O)N(C)CCOc1ccccc1F)c1ccc(-c2ccncc2)cc1 ZINC000539337559 938844327 /nfs/dbraw/zinc/84/43/27/938844327.db2.gz CIGJGDBIYUTJRX-GOSISDBHSA-N 0 3 407.489 4.076 20 0 HIADHN COc1ccc(NC(=O)[C@@H](C)N[C@@H](C)c2ccc(-c3ccncc3)cc2)c(OC)c1 ZINC000539338428 938844690 /nfs/dbraw/zinc/84/46/90/938844690.db2.gz QKGPSFMVVYTJAK-DLBZAZTESA-N 0 3 405.498 4.444 20 0 HIADHN CS(=O)(=O)C[C@H](NCC/C=C\c1ccc(Br)cc1)c1ccccc1 ZINC000539378987 938851841 /nfs/dbraw/zinc/85/18/41/938851841.db2.gz NFNBUIIPIRABCK-WPGJWXSHSA-N 0 3 408.361 4.228 20 0 HIADHN Fc1cccc(F)c1-c1n[nH]cc1CNCc1cc(Cl)c2c(c1)OCCCO2 ZINC000539418765 938857671 /nfs/dbraw/zinc/85/76/71/938857671.db2.gz DLBFEIQWZUYCBV-UHFFFAOYSA-N 0 3 405.832 4.459 20 0 HIADHN CCc1ccc(CNCc2ccnc(N3CCN(c4ccc(F)cc4)CC3)c2)s1 ZINC000539427419 938859107 /nfs/dbraw/zinc/85/91/07/938859107.db2.gz YKZPSPUREVICRP-UHFFFAOYSA-N 0 3 410.562 4.461 20 0 HIADHN CC[C@H](N[C@H](C)Cn1ncc2ccccc2c1=O)c1cc(F)cc(Br)c1 ZINC000539507087 938870322 /nfs/dbraw/zinc/87/03/22/938870322.db2.gz CCPWATYMHLHNON-YJYMSZOUSA-N 0 3 418.310 4.428 20 0 HIADHN COc1cc(CN[C@H](C)c2ccc(-n3ccnn3)cc2)ccc1OCC(F)(F)F ZINC000539520755 938872830 /nfs/dbraw/zinc/87/28/30/938872830.db2.gz TWNKZPZOBKPLRC-CQSZACIVSA-N 0 3 406.408 4.068 20 0 HIADHN CS(=O)(=O)[C@H]1CCC[C@@H](NCc2cccc(NC(=O)c3ccc(Cl)cc3)c2)C1 ZINC000539520185 938872838 /nfs/dbraw/zinc/87/28/38/938872838.db2.gz XHNDHBOBWHMUTM-QUCCMNQESA-N 0 3 420.962 4.038 20 0 HIADHN CO[C@H](c1ccc(Br)cc1)[C@H](C)NCc1c(C)nc2sc(C)nn12 ZINC000539545549 938877509 /nfs/dbraw/zinc/87/75/09/938877509.db2.gz VDVSCNRNZQIFJR-ZBEGNZNMSA-N 0 3 409.353 4.036 20 0 HIADHN CCOC(=O)c1c2c(sc1NC(=O)[C@@H]1CCC(=O)C[C@@H]1C)C(C)(C)NC(C)(C)C2 ZINC000539550224 938878692 /nfs/dbraw/zinc/87/86/92/938878692.db2.gz CJCITCFANRTUSF-GXTWGEPZSA-N 0 3 420.575 4.028 20 0 HIADHN Cc1cc(C(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)nn1-c1ccccc1Cl ZINC000539564807 938880955 /nfs/dbraw/zinc/88/09/55/938880955.db2.gz WTOTUSPEDSYYBS-IBGZPJMESA-N 0 3 408.933 4.181 20 0 HIADHN Cc1cc(NC(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)nn1-c1cccc(F)c1 ZINC000539591682 938884716 /nfs/dbraw/zinc/88/47/16/938884716.db2.gz HUNFMQZBPVTYIH-LJQANCHMSA-N 0 3 421.520 4.448 20 0 HIADHN CCO[C@H]1C[C@H](O)C12CCN(Cc1ccc(OCc3cccs3)c(OC)c1)CC2 ZINC000539819821 938942997 /nfs/dbraw/zinc/94/29/97/938942997.db2.gz VSKYCOFRYMTCNP-VXKWHMMOSA-N 0 3 417.571 4.088 20 0 HIADHN COc1cc(CN2CCC[C@@](C)(O)C2)ccc1OCCOc1ccccc1Cl ZINC000539819020 938943908 /nfs/dbraw/zinc/94/39/08/938943908.db2.gz VUMXJXXAQDDCLF-JOCHJYFZSA-N 0 3 405.922 4.153 20 0 HIADHN COC(=O)[C@H]1CC12CCN(Cc1ccc(OCc3ccc(F)cc3)c(OC)c1)CC2 ZINC000539827440 938948399 /nfs/dbraw/zinc/94/83/99/938948399.db2.gz ANJDDWRGYNWCLA-HXUWFJFHSA-N 0 3 413.489 4.188 20 0 HIADHN CCOc1cc(CN2CCS[C@@H](C(C)C)C2)ccc1OCC(=O)N1CCCCC1 ZINC000539828348 938949407 /nfs/dbraw/zinc/94/94/07/938949407.db2.gz DWSFCUPHYOCHCU-JOCHJYFZSA-N 0 3 420.619 4.050 20 0 HIADHN CC(=O)N1C[C@@H]2CCC[C@H](N[C@H](C)c3nc(-c4cccc(C(F)(F)F)c4)no3)[C@H]2C1 ZINC000563566199 945218160 /nfs/dbraw/zinc/21/81/60/945218160.db2.gz SRWJVFKBCQXRQM-VFAJRCTISA-N 0 3 422.451 4.053 20 0 HIADHN CCO[C@H]1C[C@H](O)C12CCN(Cc1ccc(OC)c(OCc3ccccc3)c1)CC2 ZINC000539838492 938953917 /nfs/dbraw/zinc/95/39/17/938953917.db2.gz SHCSIHVGBQLVRK-ZEQRLZLVSA-N 0 3 411.542 4.026 20 0 HIADHN COCCOc1cccc(CN2CCC([C@H]3C(=O)Nc4cc(Cl)ccc43)CC2)c1 ZINC000539840335 938954371 /nfs/dbraw/zinc/95/43/71/938954371.db2.gz GSLHJQGDRCNWST-JOCHJYFZSA-N 0 3 414.933 4.313 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)CCn1c2ccccc2nc1C1CC1 ZINC000539844422 938955697 /nfs/dbraw/zinc/95/56/97/938955697.db2.gz SAJKYUAPROFSCL-UHFFFAOYSA-N 0 3 408.521 4.033 20 0 HIADHN COCc1cccc(OCC2(CN3CCCN(C(=O)CC4CCCC4)CC3)CC2)c1 ZINC000539880679 938964920 /nfs/dbraw/zinc/96/49/20/938964920.db2.gz BOFZHGUBWYRXQP-UHFFFAOYSA-N 0 3 414.590 4.107 20 0 HIADHN CCCN(C(=O)c1cccs1)C1CCN(Cc2ccc(-n3cncn3)c(C)c2)CC1 ZINC000539898534 938971809 /nfs/dbraw/zinc/97/18/09/938971809.db2.gz VFCUYANZZFBGLH-UHFFFAOYSA-N 0 3 423.586 4.154 20 0 HIADHN COC(=O)[C@H](O)C1CCN(Cc2ccc(-c3ccc(C(F)(F)F)cc3)s2)CC1 ZINC000539902544 938974013 /nfs/dbraw/zinc/97/40/13/938974013.db2.gz SYOVWLLABNCINP-GOSISDBHSA-N 0 3 413.461 4.180 20 0 HIADHN O=C(Nc1cccc(CN2CCS[C@H]3COCC[C@@H]32)c1)c1ccccc1Cl ZINC000539909606 938976328 /nfs/dbraw/zinc/97/63/28/938976328.db2.gz FNVWFAKRISDFTD-PMACEKPBSA-N 0 3 402.947 4.299 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCC(Cc2cccnc2)CC1)c1cccc(OC)c1 ZINC000539946906 938980492 /nfs/dbraw/zinc/98/04/92/938980492.db2.gz ROVPQZFUQKJCSB-XMMPIXPASA-N 0 3 424.589 4.137 20 0 HIADHN CC(C)Cn1cc(NC(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)c(C(F)F)n1 ZINC000540114040 939077659 /nfs/dbraw/zinc/07/76/59/939077659.db2.gz HTWSJGNGORFZMA-DOTOQJQBSA-N 0 3 405.493 4.434 20 0 HIADHN C[C@H](NCc1ccccc1CS(=O)(=O)N1CCCC1)c1ccc2c(c1)CCCC2 ZINC000540143817 939089343 /nfs/dbraw/zinc/08/93/43/939089343.db2.gz SMHQENJSDBVDRM-IBGZPJMESA-N 0 3 412.599 4.342 20 0 HIADHN CC(C)Oc1ccc([C@@H](C)N[C@H](C)c2cccc(N3CCCS3(=O)=O)c2)cc1 ZINC000540144013 939089860 /nfs/dbraw/zinc/08/98/60/939089860.db2.gz LHSCSKSNVWDMFS-QZTJIDSGSA-N 0 3 402.560 4.426 20 0 HIADHN CCC[C@@H](NC[C@H](O)CS(=O)(=O)c1cccs1)c1ccc(Cl)c(Cl)c1 ZINC000540149576 939092130 /nfs/dbraw/zinc/09/21/30/939092130.db2.gz VZHABCNYUMAPDW-XJKSGUPXSA-N 0 3 422.399 4.321 20 0 HIADHN COCCSc1ccc([C@H](C)N[C@@H](C)c2cccc(NS(C)(=O)=O)c2)cc1 ZINC000540173666 939103719 /nfs/dbraw/zinc/10/37/19/939103719.db2.gz HOWUGHCGSZXWJZ-HOTGVXAUSA-N 0 3 408.589 4.208 20 0 HIADHN Cc1nc(-c2ccccc2)sc1[C@@H](C)NCc1cccc(NS(C)(=O)=O)c1 ZINC000540175682 939104473 /nfs/dbraw/zinc/10/44/73/939104473.db2.gz KKSRIAROKRURQU-CQSZACIVSA-N 0 3 401.557 4.341 20 0 HIADHN O=C(NCCN[C@@H]1CCCOc2ccc(Br)cc21)c1ccccc1Cl ZINC000540174412 939104611 /nfs/dbraw/zinc/10/46/11/939104611.db2.gz KVZKDQHVQVKPFP-QGZVFWFLSA-N 0 3 423.738 4.336 20 0 HIADHN COc1cc([C@H](C)NCCOc2cccc(C(C)(C)C)c2)ccc1S(C)(=O)=O ZINC000540183703 939109489 /nfs/dbraw/zinc/10/94/89/939109489.db2.gz SPNDKUCPOLAZGW-INIZCTEOSA-N 0 3 405.560 4.126 20 0 HIADHN COc1ccc(CN2CC[C@@H](N[C@@H](C)c3ccc(OCC(F)(F)F)cc3)C2=O)cc1 ZINC000540183832 939110064 /nfs/dbraw/zinc/11/00/64/939110064.db2.gz ULDXPWJAYUTCEQ-MGPUTAFESA-N 0 3 422.447 4.088 20 0 HIADHN C[C@@H]1CN(C(=O)c2ccc(CN[C@@H]3c4cccc(F)c4CC[C@@H]3C)cc2)C[C@@H](C)O1 ZINC000540190278 939114774 /nfs/dbraw/zinc/11/47/74/939114774.db2.gz FQSCUZUEVOHNGC-MXEPURNFSA-N 0 3 410.533 4.488 20 0 HIADHN COc1ccc2c(c1)CCC[C@@H]2NCc1ccc(C(=O)N2C[C@@H](C)O[C@H](C)C2)cc1 ZINC000540191439 939115416 /nfs/dbraw/zinc/11/54/16/939115416.db2.gz OAUFKTRRLOXLPV-GGUMNFRJSA-N 0 3 408.542 4.112 20 0 HIADHN COc1ccc2c(c1)CCC[C@H]2NCc1ccc(C(=O)N2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000540191440 939116018 /nfs/dbraw/zinc/11/60/18/939116018.db2.gz OAUFKTRRLOXLPV-NXMSCROESA-N 0 3 408.542 4.112 20 0 HIADHN Cc1cc2c(cc1C)[C@H](N[C@@H](C)c1ccc(S(=O)(=O)N(C)C)cc1)CCCO2 ZINC000540191464 939116212 /nfs/dbraw/zinc/11/62/12/939116212.db2.gz PKAREXMEQVTPME-LAUBAEHRSA-N 0 3 402.560 4.118 20 0 HIADHN CC[C@H](NCc1ccccc1OCC(=O)NC[C@@H]1CCCO1)c1cccc(Cl)c1 ZINC000540191546 939116232 /nfs/dbraw/zinc/11/62/32/939116232.db2.gz PXNZBQSXHSSGKY-SFTDATJTSA-N 0 3 416.949 4.255 20 0 HIADHN CCN1CCN(Cc2ccc(CNC(=O)c3ccccc3COC(C)(C)C)cc2)CC1 ZINC000540211763 939130775 /nfs/dbraw/zinc/13/07/75/939130775.db2.gz ZBNMDIURGVBCPW-UHFFFAOYSA-N 0 3 423.601 4.069 20 0 HIADHN Cc1n[nH]c(C)c1[C@H]1CCCN1C(=O)NC[C@H](c1cccs1)N1CCC(C)CC1 ZINC000540293281 939185301 /nfs/dbraw/zinc/18/53/01/939185301.db2.gz TXEMAIVWDIEEJD-RTBURBONSA-N 0 3 415.607 4.408 20 0 HIADHN C[C@H](NCc1ccc(-c2ccc3c(c2)CCCO3)cc1)c1ccc(S(N)(=O)=O)cc1 ZINC000540301753 939186930 /nfs/dbraw/zinc/18/69/30/939186930.db2.gz MGOCHUOHUPTNGO-KRWDZBQOSA-N 0 3 422.550 4.177 20 0 HIADHN O=C1CCCN1C[C@H](NCCOc1ccccc1F)c1cccc(C(F)(F)F)c1 ZINC000540322765 939194261 /nfs/dbraw/zinc/19/42/61/939194261.db2.gz PSQBSKNPUCQAQI-SFHVURJKSA-N 0 3 410.411 4.177 20 0 HIADHN Cc1ccc(S(=O)(=O)CCCN(C)[C@@H]2CCN(Cc3ccccc3)[C@@H](C)C2)cc1 ZINC000540345693 939201731 /nfs/dbraw/zinc/20/17/31/939201731.db2.gz DANOXGYHNJSIKS-JTHBVZDNSA-N 0 3 414.615 4.144 20 0 HIADHN COc1ccc([C@H](Cc2ccc(F)cc2)NCC(=O)Nc2cccc(OC)c2)cc1 ZINC000540375172 939215601 /nfs/dbraw/zinc/21/56/01/939215601.db2.gz XBTBCUHITGOLMU-QHCPKHFHSA-N 0 3 408.473 4.355 20 0 HIADHN CN(C)C(=O)c1ccc(NC(=O)CN[C@@H](CCc2ccccc2)c2ccccc2)cc1 ZINC000540377265 939217602 /nfs/dbraw/zinc/21/76/02/939217602.db2.gz XRQGEUUBTLLSMV-DEOSSOPVSA-N 0 3 415.537 4.291 20 0 HIADHN C[C@@H](N[C@H](C)c1cccc(-n2cccn2)c1)C(=O)Nc1ccc(Br)cc1 ZINC000540388639 939225356 /nfs/dbraw/zinc/22/53/56/939225356.db2.gz RYIGVUZRNHHLBY-HUUCEWRRSA-N 0 3 413.319 4.313 20 0 HIADHN Cc1cc(Br)ccc1NC(=O)CN[C@@H](c1ccccc1)[C@H]1CCOC1 ZINC000540389786 939227201 /nfs/dbraw/zinc/22/72/01/939227201.db2.gz TTWMKIIYDKUTPA-JXFKEZNVSA-N 0 3 403.320 4.063 20 0 HIADHN CC(C)[C@H](NCCC(=O)Nc1ccc(C(N)=O)c(Cl)c1)c1ccccc1Cl ZINC000540389594 939227711 /nfs/dbraw/zinc/22/77/11/939227711.db2.gz POFZIMIZXKSXNT-IBGZPJMESA-N 0 3 408.329 4.408 20 0 HIADHN COc1cc(C(C)=O)ccc1OC[C@H](O)CN[C@@H](c1ccccc1Cl)C(C)C ZINC000540390387 939228546 /nfs/dbraw/zinc/22/85/46/939228546.db2.gz QDPNYZNLWSTFLW-VGOFRKELSA-N 0 3 405.922 4.278 20 0 HIADHN O=C(CN[C@@H](c1ccccc1)[C@@H]1CCOC1)Nc1ccc2c(c1)OC1(CCCC1)O2 ZINC000540390490 939229316 /nfs/dbraw/zinc/22/93/16/939229316.db2.gz YXQDFVSCZSDUQL-JPYJTQIMSA-N 0 3 408.498 4.034 20 0 HIADHN O=C(CN[C@H](c1ccccc1)[C@@H]1CCOC1)N[C@@H](c1cccs1)c1ccccc1 ZINC000540395208 939232713 /nfs/dbraw/zinc/23/27/13/939232713.db2.gz QZNCCAGOYXXYRI-AGILITTLSA-N 0 3 406.551 4.321 20 0 HIADHN COc1ccc([C@@H](NC2CCN(C(=O)N(C)C)CC2)c2ccccc2Cl)c(C)c1 ZINC000540416409 939240582 /nfs/dbraw/zinc/24/05/82/939240582.db2.gz DSWNEJHDCVDNDP-JOCHJYFZSA-N 0 3 415.965 4.482 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)Nc1ccc(Br)cc1)c1ccc(-n2cccn2)cc1 ZINC000540434954 939247252 /nfs/dbraw/zinc/24/72/52/939247252.db2.gz KPVXWOKVBPTDDU-CABCVRRESA-N 0 3 413.319 4.313 20 0 HIADHN O=C(CN[C@@H](C[C@H]1CCOC1)c1ccccc1)N(Cc1ccccc1)CC(F)(F)F ZINC000540434784 939247325 /nfs/dbraw/zinc/24/73/25/939247325.db2.gz ULPSVNUQPHKWAL-CTNGQTDRSA-N 0 3 420.475 4.335 20 0 HIADHN CCN(C(=O)CN[C@H](C[C@@H]1CCOC1)c1ccccc1)c1nc2ccccc2s1 ZINC000540434779 939247379 /nfs/dbraw/zinc/24/73/79/939247379.db2.gz UHUQGXRDNHLKDW-FXAWDEMLSA-N 0 3 409.555 4.407 20 0 HIADHN COc1cc(NC(=O)CN[C@H](c2cccc(C)c2)C(C)(C)C)cc(OC)c1OC ZINC000540438643 939249311 /nfs/dbraw/zinc/24/93/11/939249311.db2.gz MUCXUVWCAJKZGK-JOCHJYFZSA-N 0 3 400.519 4.336 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)NCC(=O)Nc2ccccc2C(F)(F)F)cc1 ZINC000540460410 939261295 /nfs/dbraw/zinc/26/12/95/939261295.db2.gz KXJIKALYVHWJRG-CQSZACIVSA-N 0 3 402.420 4.489 20 0 HIADHN C[C@@H](NCC(=O)N[C@@H](c1nccs1)c1ccccc1)c1cccc(N2CCCC2)c1 ZINC000540477298 939268146 /nfs/dbraw/zinc/26/81/46/939268146.db2.gz LRNOZRVNXPHJEP-WZONZLPQSA-N 0 3 420.582 4.300 20 0 HIADHN C[C@H](CCO)C1(CNC(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)CCC1 ZINC000540492942 939273464 /nfs/dbraw/zinc/27/34/64/939273464.db2.gz QZHPWTHVEIJEGZ-MOPGFXCFSA-N 0 3 407.624 4.009 20 0 HIADHN COCc1cccc(OCC2(CN3CCCN(C(=O)c4ccccc4)CC3)CCC2)c1 ZINC000540560710 939305967 /nfs/dbraw/zinc/30/59/67/939305967.db2.gz SBVNSCSBYZWEOG-UHFFFAOYSA-N 0 3 422.569 4.230 20 0 HIADHN Cc1c([C@@H](C)NCC2([C@@H](C)CCO)CCC2)nnn1-c1cccc(Br)c1 ZINC000540607778 939318174 /nfs/dbraw/zinc/31/81/74/939318174.db2.gz MMEGLOXMCSGEDJ-LSDHHAIUSA-N 0 3 421.383 4.178 20 0 HIADHN CC(C)[C@@H]1C[C@@H](N[C@@H](c2cccc(S(C)(=O)=O)c2)c2ccc(F)c(F)c2)CCO1 ZINC000540705195 939344204 /nfs/dbraw/zinc/34/42/04/939344204.db2.gz CQZLFUIPSRKGHV-HSQYWUDLSA-N 0 3 423.525 4.251 20 0 HIADHN C[C@@H](N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1)c1ccc(-n2ccnc2)cc1 ZINC000540754653 939360682 /nfs/dbraw/zinc/36/06/82/939360682.db2.gz WGXMZTVVTAAMFM-QFQXNSOFSA-N 0 3 424.548 4.451 20 0 HIADHN C[C@H](N[C@@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O)c1cccc(CO)c1 ZINC000540778035 939369057 /nfs/dbraw/zinc/36/90/57/939369057.db2.gz ACDMKHAENMQAKJ-MGPUTAFESA-N 0 3 406.448 4.040 20 0 HIADHN C[C@H](N[C@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O)c1cccc(CO)c1 ZINC000540778037 939369086 /nfs/dbraw/zinc/36/90/86/939369086.db2.gz ACDMKHAENMQAKJ-YWZLYKJASA-N 0 3 406.448 4.040 20 0 HIADHN Cc1nc([C@H]2CCCN([C@@H](C)c3nnc(-c4ccc(Cl)c(Cl)c4)o3)C2)n[nH]1 ZINC000540862507 939400005 /nfs/dbraw/zinc/40/00/05/939400005.db2.gz QXBJSAZHLPVBJO-GWCFXTLKSA-N 0 3 407.305 4.411 20 0 HIADHN Cc1n[nH]c([C@H]2CCCN([C@@H](C)c3nnc(-c4ccc(Cl)c(Cl)c4)o3)C2)n1 ZINC000540862507 939400011 /nfs/dbraw/zinc/40/00/11/939400011.db2.gz QXBJSAZHLPVBJO-GWCFXTLKSA-N 0 3 407.305 4.411 20 0 HIADHN Cc1nnc([C@H]2CCCN([C@@H](C)c3nnc(-c4ccc(Cl)c(Cl)c4)o3)C2)[nH]1 ZINC000540862507 939400018 /nfs/dbraw/zinc/40/00/18/939400018.db2.gz QXBJSAZHLPVBJO-GWCFXTLKSA-N 0 3 407.305 4.411 20 0 HIADHN Cc1nnc([C@H]2CCCN([C@@H](C)c3nc(-c4cccc(C(F)(F)F)c4)no3)C2)[nH]1 ZINC000540862692 939400725 /nfs/dbraw/zinc/40/07/25/939400725.db2.gz HZNDOMJKWZMVNV-FZMZJTMJSA-N 0 3 406.412 4.123 20 0 HIADHN COc1ccc(-c2noc(CN3CCC[C@H](c4nc(C5CCCCC5)n[nH]4)C3)n2)cc1 ZINC000540864869 939402020 /nfs/dbraw/zinc/40/20/20/939402020.db2.gz OZYCEDRKMRUBIB-SFHVURJKSA-N 0 3 422.533 4.291 20 0 HIADHN COc1ccc(-c2noc(CN3CCC[C@H](c4n[nH]c(C5CCCCC5)n4)C3)n2)cc1 ZINC000540864869 939402029 /nfs/dbraw/zinc/40/20/29/939402029.db2.gz OZYCEDRKMRUBIB-SFHVURJKSA-N 0 3 422.533 4.291 20 0 HIADHN Cn1c(CN2CCC[C@H](c3n[nH]c(C4CCCCC4)n3)C2)nnc1-c1ccccc1 ZINC000540866153 939403974 /nfs/dbraw/zinc/40/39/74/939403974.db2.gz ZODAESXBDRSNDY-IBGZPJMESA-N 0 3 405.550 4.028 20 0 HIADHN C[C@H](C[C@@H]1CCCO1)N[C@@H](c1cccc(S(C)(=O)=O)c1)c1ccc(F)c(F)c1 ZINC000540913931 939416376 /nfs/dbraw/zinc/41/63/76/939416376.db2.gz NKTLVUTTYDYHGZ-FNXXIHLHSA-N 0 3 409.498 4.005 20 0 HIADHN CS(=O)(=O)[C@@H]1CCC[C@@H](NCc2ccc(-c3cccc(C(F)(F)F)c3)o2)C1 ZINC000540979875 939424186 /nfs/dbraw/zinc/42/41/86/939424186.db2.gz SBGAJLWEUGPBRF-NVXWUHKLSA-N 0 3 401.450 4.411 20 0 HIADHN CSC[C@H](NC[C@H](O)COc1ccc(F)cc1)c1ccc(C(F)(F)F)cc1 ZINC000540987883 939425668 /nfs/dbraw/zinc/42/56/68/939425668.db2.gz BJXSGOGJAIRMGB-WMZOPIPTSA-N 0 3 403.441 4.278 20 0 HIADHN CC(C)[C@H](NC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2)c1ccc(Cl)cc1F ZINC000540990896 939426668 /nfs/dbraw/zinc/42/66/68/939426668.db2.gz XOVYYWQHBVEKPU-ZHRRBRCNSA-N 0 3 420.912 4.090 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)NCC(=O)N[C@@H](c2ccc(C)cc2)C2CC2)cc1 ZINC000541026130 939434628 /nfs/dbraw/zinc/43/46/28/939434628.db2.gz SGFUMQGRDISFGH-CJAUYULYSA-N 0 3 402.542 4.407 20 0 HIADHN CCOc1ccc(NC(=O)CN[C@@H](C)c2ccc(-n3ccnc3C)cc2)cc1OCC ZINC000541027179 939434858 /nfs/dbraw/zinc/43/48/58/939434858.db2.gz OYYCDBFUVBTKJZ-KRWDZBQOSA-N 0 3 422.529 4.267 20 0 HIADHN COc1cc(C(C)=O)ccc1OC[C@@H](O)CN[C@@H](c1ccc(Cl)cc1F)C(C)C ZINC000541059412 939445058 /nfs/dbraw/zinc/44/50/58/939445058.db2.gz IVHZBZLUJWLDPW-HTAPYJJXSA-N 0 3 423.912 4.417 20 0 HIADHN Cc1oc(-c2cccc(C(F)(F)F)c2)nc1C(=O)N(CCN(C)C)Cc1ccco1 ZINC000541068962 939448864 /nfs/dbraw/zinc/44/88/64/939448864.db2.gz PIGQZUBVWWVTFM-UHFFFAOYSA-N 0 3 421.419 4.466 20 0 HIADHN CCN1CC[C@H](NCc2ccc(OC)c(OC)c2OC)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000541084515 939454309 /nfs/dbraw/zinc/45/43/09/939454309.db2.gz LNOXYMZIOIUSDG-FXAWDEMLSA-N 0 3 424.463 4.055 20 0 HIADHN O=C(CCN1CCC[C@@H](n2ccc(C(F)(F)F)n2)C1)Nc1ccc(Cl)cc1F ZINC000541086434 939455062 /nfs/dbraw/zinc/45/50/62/939455062.db2.gz PABUWQURJPHDJU-CYBMUJFWSA-N 0 3 418.822 4.360 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)c1cc(-c2cnn(C)c2)ccc1F ZINC000541096299 939458965 /nfs/dbraw/zinc/45/89/65/939458965.db2.gz SUHGWQOFPMRJDD-UHFFFAOYSA-N 0 3 414.912 4.084 20 0 HIADHN C[C@H](CCc1n[nH]c2ccccc21)N[C@H](CCO)c1ccccc1Br ZINC000541153022 939478086 /nfs/dbraw/zinc/47/80/86/939478086.db2.gz DEUAVJKARMCAOK-RDTXWAMCSA-N 0 3 402.336 4.360 20 0 HIADHN NC(=O)[C@H](Cc1ccc(C(F)(F)F)cc1)N[C@H]1C[C@H]1c1c(F)cccc1Cl ZINC000541301682 939490073 /nfs/dbraw/zinc/49/00/73/939490073.db2.gz KGRMHMZACZQKBO-KCXAZCMYSA-N 0 3 400.803 4.040 20 0 HIADHN NC(=O)[C@@H](Cc1ccc(F)cc1)NCc1ccccc1COc1ccccc1Cl ZINC000541302924 939490148 /nfs/dbraw/zinc/49/01/48/939490148.db2.gz OLQAKVYBIDNPQY-OAQYLSRUSA-N 0 3 412.892 4.244 20 0 HIADHN Cc1nn(C(C)(C)C)cc1C(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1 ZINC000541398504 939505419 /nfs/dbraw/zinc/50/54/19/939505419.db2.gz KIVLAXRIRHMGLZ-UHFFFAOYSA-N 0 3 410.484 4.169 20 0 HIADHN CN1CC[C@H](NC(=O)[C@H]2CCn3c(cnc3C3CCCCC3)C2)[C@H]1c1ccccc1 ZINC000541454465 939520872 /nfs/dbraw/zinc/52/08/72/939520872.db2.gz NBBOZEODVXITAT-ACIOBRDBSA-N 0 3 406.574 4.055 20 0 HIADHN COC(=O)COc1ccccc1[C@H](C)NCc1ccc(-n2cnc3ccccc32)cc1 ZINC000541545006 939549214 /nfs/dbraw/zinc/54/92/14/939549214.db2.gz CMGQVALZTHPROE-SFHVURJKSA-N 0 3 415.493 4.428 20 0 HIADHN Cc1cc([C@@H](NC[C@@H](c2cccc(F)c2)N2CCOCC2)c2cccnc2)ccc1F ZINC000541547123 939550828 /nfs/dbraw/zinc/55/08/28/939550828.db2.gz AHXPRPDPOWGAPE-LOSJGSFVSA-N 0 3 423.507 4.421 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)Cc1nc(-c2ccc(F)cc2)cs1 ZINC000541573681 939558404 /nfs/dbraw/zinc/55/84/04/939558404.db2.gz OLEOXHQJWBFVRT-UHFFFAOYSA-N 0 3 415.509 4.221 20 0 HIADHN Cc1ccc(-c2nc(CC(=O)N(Cc3ccccc3)C3CCN(C)CC3)cs2)o1 ZINC000563703409 945257557 /nfs/dbraw/zinc/25/75/57/945257557.db2.gz QCLGRHHEAXFOQG-UHFFFAOYSA-N 0 3 409.555 4.377 20 0 HIADHN CN(C)CCn1cc(NC(=O)c2cc(Cl)ccc2SC2CCCC2)ccc1=O ZINC000541598433 939563511 /nfs/dbraw/zinc/56/35/11/939563511.db2.gz OIRNAEPMUORQLB-UHFFFAOYSA-N 0 3 419.978 4.350 20 0 HIADHN COc1cc(-c2noc(CN[C@H](C)[C@H](C)C3CCCCC3)n2)cc(OC)c1OC ZINC000541600315 939564761 /nfs/dbraw/zinc/56/47/61/939564761.db2.gz CTHXUHDLLADASD-LSDHHAIUSA-N 0 3 403.523 4.457 20 0 HIADHN CC(C)C[C@H](NCc1cc(=O)n2cc(Br)ccc2n1)c1cccs1 ZINC000541626296 939574124 /nfs/dbraw/zinc/57/41/24/939574124.db2.gz XRLLMOMCKRNAGA-HNNXBMFYSA-N 0 3 406.349 4.396 20 0 HIADHN COc1ccc2oc([C@@H](C)NCCCS(=O)(=O)c3ccc(F)cc3)c(C)c2c1 ZINC000541651122 939587708 /nfs/dbraw/zinc/58/77/08/939587708.db2.gz LXMRPXYBONKWEM-OAHLLOKOSA-N 0 3 405.491 4.404 20 0 HIADHN CN(CC(=O)NCCCSc1ccccc1)[C@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000541700823 939608477 /nfs/dbraw/zinc/60/84/77/939608477.db2.gz DJQBZMXRLJMSGS-RBBKRZOGSA-N 0 3 416.562 4.276 20 0 HIADHN CC(C)Oc1cccc(CNC(=O)CN(C)[C@H]2CCO[C@@H](c3ccc(F)cc3)C2)c1 ZINC000541700110 939608648 /nfs/dbraw/zinc/60/86/48/939608648.db2.gz TWQMMAROFQNEOM-JTHBVZDNSA-N 0 3 414.521 4.081 20 0 HIADHN Cn1ccc([C@@H](NCC2(N3CCSCC3)CCCC2)c2ccc(Cl)cc2)n1 ZINC000541746151 939619307 /nfs/dbraw/zinc/61/93/07/939619307.db2.gz FRBWSSGMBLACQM-FQEVSTJZSA-N 0 3 405.011 4.114 20 0 HIADHN COC[C@@](C)(CC(=O)OC)NCc1ccc(-c2ccccc2Br)s1 ZINC000541760340 939622993 /nfs/dbraw/zinc/62/29/93/939622993.db2.gz HGZKFFDOJUKGJW-GOSISDBHSA-N 0 3 412.349 4.235 20 0 HIADHN Cc1cc(Br)ccc1NC(=O)CCNCc1cnc([C@@H]2CCCO2)s1 ZINC000541763344 939624321 /nfs/dbraw/zinc/62/43/21/939624321.db2.gz LRVOOCPEOVREHA-INIZCTEOSA-N 0 3 424.364 4.184 20 0 HIADHN O=C(NC[C@]1(O)CCN(Cc2ccccc2)C1)Nc1cccc(C(F)F)c1Cl ZINC000541793026 939632763 /nfs/dbraw/zinc/63/27/63/939632763.db2.gz MBGDUSKCLMCOQI-HXUWFJFHSA-N 0 3 409.864 4.036 20 0 HIADHN CC(C)[C@H](NCc1ccc([C@@]2(C)NC(=O)NC2=O)cc1)c1ccc(Cl)cc1F ZINC000541917237 939653226 /nfs/dbraw/zinc/65/32/26/939653226.db2.gz HETWGXLWDYRUQG-GHTZIAJQSA-N 0 3 403.885 4.021 20 0 HIADHN CC(C)[C@@H]1C[C@H](CC(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)CCO1 ZINC000541959435 939662829 /nfs/dbraw/zinc/66/28/29/939662829.db2.gz ZSAYLEZIGJGNCO-FSSWDIPSSA-N 0 3 410.562 4.110 20 0 HIADHN COC(=O)c1ccc(-c2nc(CN3CCC[C@H]3Cc3ccccc3OC)co2)cc1 ZINC000541997128 939674770 /nfs/dbraw/zinc/67/47/70/939674770.db2.gz UOJRBCAAUZJSBX-NRFANRHFSA-N 0 3 406.482 4.344 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3CC=C(c4ccccc4F)C3)c(C)c2)CC1 ZINC000542058290 939701089 /nfs/dbraw/zinc/70/10/89/939701089.db2.gz LAUFWJYRVKEPSR-UHFFFAOYSA-N 0 3 408.521 4.207 20 0 HIADHN C[C@H](N[C@@H]1CCCN(Cc2nccn2C)C1=O)c1ccc(SC2CCCC2)cc1 ZINC000542159831 939737296 /nfs/dbraw/zinc/73/72/96/939737296.db2.gz DWZHYROLPHKJAA-LAUBAEHRSA-N 0 3 412.603 4.297 20 0 HIADHN CC(C)N1CCC(N(C)C(=O)c2ccccc2C(=O)c2ccc(F)c(F)c2)CC1 ZINC000542175342 939744493 /nfs/dbraw/zinc/74/44/93/939744493.db2.gz QCYFKWYDQMYECG-UHFFFAOYSA-N 0 3 400.469 4.141 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)N(CC=C(C)C)Cc2ccc(Cl)cc2)CC1 ZINC000542179884 939746931 /nfs/dbraw/zinc/74/69/31/939746931.db2.gz UOJASMGHXKMGEZ-FQEVSTJZSA-N 0 3 421.029 4.091 20 0 HIADHN COC(=O)c1ccc(CN[C@H]2CCCc3c(Br)cccc32)cc1OC ZINC000542185388 939748819 /nfs/dbraw/zinc/74/88/19/939748819.db2.gz GTMPTOBMNNKYGB-SFHVURJKSA-N 0 3 404.304 4.412 20 0 HIADHN CC[C@@H](N[C@@H]1CCCN(Cc2ccccn2)C1=O)c1ccc(Br)cc1 ZINC000542209637 939757371 /nfs/dbraw/zinc/75/73/71/939757371.db2.gz UVFFMOPDYRIGDP-RTBURBONSA-N 0 3 402.336 4.076 20 0 HIADHN Cc1nn(-c2ccncc2)cc1CNCc1cc(Br)ccc1OC(F)F ZINC000542248830 939772257 /nfs/dbraw/zinc/77/22/57/939772257.db2.gz XOARRHDGVBJBAO-UHFFFAOYSA-N 0 3 423.261 4.229 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@H](C)NCc2cc(C)c3ncccc3c2)cc1 ZINC000542318836 939799067 /nfs/dbraw/zinc/79/90/67/939799067.db2.gz HEIVFRSVHQLFRM-SFHVURJKSA-N 0 3 411.571 4.425 20 0 HIADHN Cc1cn(C2CCCCC2)nc1NC(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000542370313 939808987 /nfs/dbraw/zinc/80/89/87/939808987.db2.gz PWHYTPXRRIEFRR-KDURUIRLSA-N 0 3 417.598 4.050 20 0 HIADHN CN(C)[C@H](CNC(=O)N1CCC[C@H](c2nnc(C3CCCCC3)[nH]2)C1)c1ccccc1 ZINC000542376526 939810342 /nfs/dbraw/zinc/81/03/42/939810342.db2.gz NTVUSGVQOYCYBS-LEWJYISDSA-N 0 3 424.593 4.044 20 0 HIADHN O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)c1cccc(CN2CCCC2)c1 ZINC000542442042 939823835 /nfs/dbraw/zinc/82/38/35/939823835.db2.gz ZIOPEJBTXNNEBG-UHFFFAOYSA-N 0 3 413.949 4.020 20 0 HIADHN Cc1ccc([C@@H](CN[C@@H](c2ccc(F)cc2)c2cccnc2)N2CCOCC2)cc1 ZINC000542477143 939829733 /nfs/dbraw/zinc/82/97/33/939829733.db2.gz DOTAZKYPLQZGFP-RPBOFIJWSA-N 0 3 405.517 4.282 20 0 HIADHN CCOc1cc(CN2CCC(OC[C@@H]3CCOC3)CC2)ccc1OCC(F)(F)F ZINC000542485071 939831640 /nfs/dbraw/zinc/83/16/40/939831640.db2.gz HTHSQGGFEQNWCY-QGZVFWFLSA-N 0 3 417.468 4.044 20 0 HIADHN COC(=O)COc1ccccc1[C@H](C)N[C@H]1CCO[C@@H]1c1ccc(Cl)c(F)c1 ZINC000542493473 939832609 /nfs/dbraw/zinc/83/26/09/939832609.db2.gz CVOBRCXBQBLFOY-LTBCBRHQSA-N 0 3 407.869 4.212 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(N[C@@H](C[NH+]3CCCC3)c3ccc(OC)cc3)nc2)n1 ZINC000542505625 939834000 /nfs/dbraw/zinc/83/40/00/939834000.db2.gz JYGFUPYMWUQLLP-NRFANRHFSA-N 0 3 419.529 4.064 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)CN[C@@H](c2cccs2)C2CC2)cc1OC ZINC000542510777 939834804 /nfs/dbraw/zinc/83/48/04/939834804.db2.gz NKEWHDRWDANONV-HTAPYJJXSA-N 0 3 400.544 4.170 20 0 HIADHN CC(C)[C@@H]1OCCC[C@H]1CNCc1ncc(Br)cc1Br ZINC000542518205 939836229 /nfs/dbraw/zinc/83/62/29/939836229.db2.gz UCWLAEQFVAMIMZ-NHYWBVRUSA-N 0 3 406.162 4.147 20 0 HIADHN CC(C)[C@@H]1OCCC[C@@H]1CNCc1ncc(Br)cc1Br ZINC000542518177 939836358 /nfs/dbraw/zinc/83/63/58/939836358.db2.gz UCWLAEQFVAMIMZ-ABAIWWIYSA-N 0 3 406.162 4.147 20 0 HIADHN COc1cc(CN(C)C[C@H](O)COc2cc(C)ccc2Cl)ccc1OC(F)F ZINC000542522648 939836978 /nfs/dbraw/zinc/83/69/78/939836978.db2.gz YCGFCMUNXUZNKJ-HNNXBMFYSA-N 0 3 415.864 4.130 20 0 HIADHN C[S@@](=O)C[C@@H](NCCOc1ccc(Cl)cc1Br)c1ccccc1 ZINC000542539072 939840281 /nfs/dbraw/zinc/84/02/81/939840281.db2.gz UECOYSQFGKJKFU-WAIKUNEKSA-N 0 3 416.768 4.191 20 0 HIADHN CC[C@H](NCC(=O)N1N=C(c2cccs2)C[C@H]1c1cccs1)[C@H]1CCCO1 ZINC000542566810 939844602 /nfs/dbraw/zinc/84/46/02/939844602.db2.gz NJEJQMLKHQRHPD-BHYGNILZSA-N 0 3 403.573 4.035 20 0 HIADHN C[C@H](N[C@@H](C)[C@@H]1COc2ccccc21)C(=O)Nc1nc(-c2ccc(F)cc2)cs1 ZINC000542618064 939849177 /nfs/dbraw/zinc/84/91/77/939849177.db2.gz BDZINHSCKQNKQD-DEYYWGMASA-N 0 3 411.502 4.431 20 0 HIADHN C[C@H](NCc1cc2c(cc1Br)OCCCO2)[C@H]1COc2ccccc21 ZINC000542627886 939850110 /nfs/dbraw/zinc/85/01/10/939850110.db2.gz SCTYFEKDJTVVHY-XJKSGUPXSA-N 0 3 404.304 4.265 20 0 HIADHN C[C@@H]1N(CC(=O)NCCC(c2ccccc2)c2ccccc2)CCC12CCOCC2 ZINC000542650165 939851651 /nfs/dbraw/zinc/85/16/51/939851651.db2.gz SXQCBFCBOYSMBO-NRFANRHFSA-N 0 3 406.570 4.216 20 0 HIADHN COc1ccccc1O[C@H](C)CN[C@H]1CCCC[C@H]1S(=O)(=O)c1ccc(C)cc1 ZINC000542664023 939852388 /nfs/dbraw/zinc/85/23/88/939852388.db2.gz CAGHSSZGIRXJCY-QMHWCDLVSA-N 0 3 417.571 4.146 20 0 HIADHN CS(=O)(=O)c1cccc(Cl)c1CNC1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1 ZINC000542722232 939856720 /nfs/dbraw/zinc/85/67/20/939856720.db2.gz MEPVBAHBYSJUKA-YQQQUEKLSA-N 0 3 418.990 4.029 20 0 HIADHN CC(C)c1nn(-c2ccc(Br)cc2)cc1CN1CCC[C@H]([C@@H](C)O)C1 ZINC000542820556 939861411 /nfs/dbraw/zinc/86/14/11/939861411.db2.gz RZVKMAYLRIBEOT-CVEARBPZSA-N 0 3 406.368 4.351 20 0 HIADHN CC(C)NS(=O)(=O)Cc1ccc(CN[C@H](c2ccc(F)c(F)c2)C(C)C)cc1 ZINC000542846264 939862660 /nfs/dbraw/zinc/86/26/60/939862660.db2.gz LKOYEECQONQSFG-NRFANRHFSA-N 0 3 410.530 4.280 20 0 HIADHN CCN1CC[C@@H](NC(=O)Nc2cccc(CN(C)C)c2)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000542936199 939881796 /nfs/dbraw/zinc/88/17/96/939881796.db2.gz MIXTXFLXFRQONW-TZIWHRDSSA-N 0 3 420.479 4.123 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)Nc1ccc(NC(=O)c2ccco2)cc1 ZINC000563747535 945280563 /nfs/dbraw/zinc/28/05/63/945280563.db2.gz PLUGPEFUXUBWFC-QGZVFWFLSA-N 0 3 406.486 4.174 20 0 HIADHN COC(=O)c1cccc(NC(=O)C[C@H](C)N[C@H]2CCSc3ccc(F)cc32)c1 ZINC000543068145 939921448 /nfs/dbraw/zinc/92/14/48/939921448.db2.gz UEWBGAXZVVWBFF-UGSOOPFHSA-N 0 3 402.491 4.156 20 0 HIADHN CCOC(=O)c1c(C)c(C)sc1NC(=O)C[C@H](C)NCc1ccnc(SC)c1 ZINC000543115785 939954040 /nfs/dbraw/zinc/95/40/40/939954040.db2.gz WCMLIBLCPHSOPD-LBPRGKRZSA-N 0 3 421.588 4.165 20 0 HIADHN C[C@@H](CN(C)C(=O)NC[C@H](c1ccccc1)N1CCC(C)CC1)c1nccs1 ZINC000543201514 939993668 /nfs/dbraw/zinc/99/36/68/939993668.db2.gz ZDJHPRJHEBUDGW-AZUAARDMSA-N 0 3 400.592 4.361 20 0 HIADHN C[N@H+](CCCC(=O)OC(C)(C)C)Cc1cccc([N-]S(=O)(=O)c2ccccc2)c1 ZINC000543208037 939996665 /nfs/dbraw/zinc/99/66/65/939996665.db2.gz JVLMVNAEKQMBGH-UHFFFAOYSA-N 0 3 418.559 4.041 20 0 HIADHN C[N@@H+](CCCC(=O)OC(C)(C)C)Cc1cccc([N-]S(=O)(=O)c2ccccc2)c1 ZINC000543208037 939996676 /nfs/dbraw/zinc/99/66/76/939996676.db2.gz JVLMVNAEKQMBGH-UHFFFAOYSA-N 0 3 418.559 4.041 20 0 HIADHN Oc1ccc(Br)c(CNCCCc2nc(-c3ccc(F)cc3)no2)c1 ZINC000543238251 940004839 /nfs/dbraw/zinc/00/48/39/940004839.db2.gz IRGHQMYLQMLFGI-UHFFFAOYSA-N 0 3 406.255 4.066 20 0 HIADHN COc1ccc(Oc2ccc(CNCc3ccc(N4CCOCC4)nc3)cc2)cc1 ZINC000543250071 940008152 /nfs/dbraw/zinc/00/81/52/940008152.db2.gz PTCALWAEENCSFT-UHFFFAOYSA-N 0 3 405.498 4.009 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)[C@H](C)c1c(C)n[nH]c1C)c1ccc(C(F)(F)F)cc1 ZINC000543251595 940008767 /nfs/dbraw/zinc/00/87/67/940008767.db2.gz PPCLELYQEYJHCQ-ACJLOTCBSA-N 0 3 410.484 4.348 20 0 HIADHN Cc1ccc(C(=O)N2CC[C@H](N3CCN(C(C)C)CC3)C2)c(Sc2ccccc2)c1 ZINC000543331728 940033239 /nfs/dbraw/zinc/03/32/39/940033239.db2.gz DFXNUFHBDMIWHO-NRFANRHFSA-N 0 3 423.626 4.387 20 0 HIADHN Cc1ccc(C(=O)N2CC[C@@H](N3CCN(C(C)C)CC3)C2)c(Sc2ccccc2)c1 ZINC000543331736 940033258 /nfs/dbraw/zinc/03/32/58/940033258.db2.gz DFXNUFHBDMIWHO-OAQYLSRUSA-N 0 3 423.626 4.387 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1cn(C(C)(C)C)nc1C ZINC000543371641 940045133 /nfs/dbraw/zinc/04/51/33/940045133.db2.gz GECKQPKNZBDYTH-FQEVSTJZSA-N 0 3 420.561 4.151 20 0 HIADHN O=C(Nc1cccc(CN2CCOCC3(CCOCC3)C2)c1)c1ccccc1Cl ZINC000543394560 940050048 /nfs/dbraw/zinc/05/00/48/940050048.db2.gz VOXFYZYRSUVBDI-UHFFFAOYSA-N 0 3 414.933 4.221 20 0 HIADHN Cc1ccc(S(=O)(=O)NC[C@H]2CCCN(Cc3cc(C)c4ncccc4c3)C2)cc1 ZINC000543396668 940051112 /nfs/dbraw/zinc/05/11/12/940051112.db2.gz LPDIIXSVMRGTOI-HXUWFJFHSA-N 0 3 423.582 4.042 20 0 HIADHN CCN1CCN(Cc2ccccc2CN[C@H](c2ccccc2)c2ccc(F)cn2)CC1 ZINC000543406807 940054752 /nfs/dbraw/zinc/05/47/52/940054752.db2.gz LVOYHNOQDMKHPT-AREMUKBSSA-N 0 3 418.560 4.237 20 0 HIADHN COCCN1CC[C@@H](N[C@@H](c2ccc(OC)cc2)c2ccc(C(F)(F)F)cc2)C1 ZINC000543414361 940057819 /nfs/dbraw/zinc/05/78/19/940057819.db2.gz SDZFSRKQUYHSLX-TZIWHRDSSA-N 0 3 408.464 4.114 20 0 HIADHN Cc1ccc(-n2cc(CN3CCC(OC[C@@H]4CCOC4)CC3)c(C(C)(C)C)n2)cc1 ZINC000543414568 940058048 /nfs/dbraw/zinc/05/80/48/940058048.db2.gz HBWZDPRULFGKHA-HXUWFJFHSA-N 0 3 411.590 4.496 20 0 HIADHN O=S1(=O)CCCC[C@@H]1CNCc1ccc(-c2ccc(C(F)(F)F)cc2)s1 ZINC000543412720 940058075 /nfs/dbraw/zinc/05/80/75/940058075.db2.gz NMWRHHOMEMYDRM-MRXNPFEDSA-N 0 3 403.491 4.491 20 0 HIADHN COCCC1(CNCc2ncc(Br)cc2Br)CCCC1 ZINC000543445879 940065666 /nfs/dbraw/zinc/06/56/66/940065666.db2.gz IVYGLQUHBPNAFT-UHFFFAOYSA-N 0 3 406.162 4.293 20 0 HIADHN COC[C@H](Cc1ccccc1)N[C@H](CN1CCCC1=O)c1cccc(C(F)(F)F)c1 ZINC000543446606 940065915 /nfs/dbraw/zinc/06/59/15/940065915.db2.gz ISLWRYHVWPBQHB-LEWJYISDSA-N 0 3 420.475 4.216 20 0 HIADHN COc1ccc(C2(C(=O)N[C@@H]3CCN([C@H](C)c4ccccc4)C3)CCC2)cc1OC ZINC000543470780 940074854 /nfs/dbraw/zinc/07/48/54/940074854.db2.gz LDZMDQSVLNEWJB-WIYYLYMNSA-N 0 3 408.542 4.077 20 0 HIADHN Cc1csc([C@H](C)CNC(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)n1 ZINC000543483870 940079084 /nfs/dbraw/zinc/07/90/84/940079084.db2.gz AJHVIXZIBNEXJR-WBVHZDCISA-N 0 3 406.621 4.389 20 0 HIADHN CC[C@H](NCC(=O)N1N=C(c2cc3ccccc3o2)C[C@@H]1c1ccco1)[C@H]1CCCO1 ZINC000543494516 940084051 /nfs/dbraw/zinc/08/40/51/940084051.db2.gz KNZDDWLHQSBEKW-FBBABVLZSA-N 0 3 421.497 4.251 20 0 HIADHN CCOc1ccc(CN(C)C(=O)CN(C)[C@@H]2CCO[C@@H](c3ccc(F)cc3)C2)cc1 ZINC000543559832 940108618 /nfs/dbraw/zinc/10/86/18/940108618.db2.gz UGWHFUWHCVAHRX-FYYLOGMGSA-N 0 3 414.521 4.035 20 0 HIADHN C[C@@H](N[C@@H]1CCN(c2cnn(C)c2)C1=O)c1ccc(-c2ccc(Cl)cc2F)s1 ZINC000543599895 940126461 /nfs/dbraw/zinc/12/64/61/940126461.db2.gz JUACIGQJWPJMQQ-SJKOYZFVSA-N 0 3 418.925 4.397 20 0 HIADHN COc1cc(C[NH2+][C@H]2CCO[C@H](c3ccc(F)cc3)C2)cc(Br)c1[O-] ZINC000543641757 940146368 /nfs/dbraw/zinc/14/63/68/940146368.db2.gz JDKQYSDYYRNMCC-RDJZCZTQSA-N 0 3 410.283 4.312 20 0 HIADHN C[C@@H](CNC(=O)N[C@@H](CN1CCc2ccccc2C1)C(C)(C)C)c1nccs1 ZINC000543673565 940157557 /nfs/dbraw/zinc/15/75/57/940157557.db2.gz CZHCGTRZLXBWRO-LPHOPBHVSA-N 0 3 400.592 4.019 20 0 HIADHN CSC[C@H](N[C@@H](C)Cn1ncc2ccccc2c1=O)c1ccc(C(F)(F)F)cc1 ZINC000543774792 940181725 /nfs/dbraw/zinc/18/17/25/940181725.db2.gz DPJRUSXMDKESCL-LIRRHRJNSA-N 0 3 421.488 4.498 20 0 HIADHN CC[C@@H](N[C@H](C)c1ccc(NC(C)=O)cc1)c1ccccc1OCC(=O)N1CCCC1 ZINC000543773903 940181783 /nfs/dbraw/zinc/18/17/83/940181783.db2.gz IDLLDSKSLMWWJD-WZONZLPQSA-N 0 3 423.557 4.448 20 0 HIADHN CC(=O)Nc1ccc([C@@H](C)N[C@H](Cc2ccccc2)C(=O)NCc2ccccc2)cc1 ZINC000543776986 940183805 /nfs/dbraw/zinc/18/38/05/940183805.db2.gz HZLMUGDXYBUYMT-KBMIEXCESA-N 0 3 415.537 4.223 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)N[C@H](C)C(=O)NC(=O)Nc2ccc(C)cc2C)cc1 ZINC000543812969 940195231 /nfs/dbraw/zinc/19/52/31/940195231.db2.gz WCTLWCVBVAZMMT-ZWKOTPCHSA-N 0 3 419.529 4.185 20 0 HIADHN CCN(CC)C(=O)CCC1CCN(CCc2cc(Cl)c3c(c2)OCCCO3)CC1 ZINC000543906082 940236022 /nfs/dbraw/zinc/23/60/22/940236022.db2.gz SOYICCBLOABRNH-UHFFFAOYSA-N 0 3 422.997 4.404 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCC(c2ccc(C)nc2)CC1)c1ccsc1 ZINC000543965449 940274247 /nfs/dbraw/zinc/27/42/47/940274247.db2.gz TVHZMBVGXJBTSS-OAQYLSRUSA-N 0 3 400.592 4.424 20 0 HIADHN C[C@H](N[C@H](Cc1ccc(C(F)(F)F)cc1)C(N)=O)c1ccc(OC(F)F)cc1 ZINC000544095792 940325049 /nfs/dbraw/zinc/32/50/49/940325049.db2.gz BVMDMBUPKMTDHD-MEDUHNTESA-N 0 3 402.363 4.054 20 0 HIADHN O=C(NC1CC1)c1ccc(-c2noc([C@H]3CCCN(Cc4cccc(F)c4)C3)n2)cc1 ZINC000544108307 940328640 /nfs/dbraw/zinc/32/86/40/940328640.db2.gz GADXCZHEXLEGLZ-IBGZPJMESA-N 0 3 420.488 4.148 20 0 HIADHN CC1CCN([C@H](CNC(=O)c2cnn(CCC(F)(F)F)c2)c2ccccc2)CC1 ZINC000544197284 940350680 /nfs/dbraw/zinc/35/06/80/940350680.db2.gz LLUAOLMVBOXXDS-LJQANCHMSA-N 0 3 408.468 4.039 20 0 HIADHN CN(C)Cc1cc(CNC(=O)c2cccc(CN(C)Cc3ccccc3)c2)ccc1F ZINC000544223889 940359858 /nfs/dbraw/zinc/35/98/58/940359858.db2.gz UDFWQUQGBLQURA-UHFFFAOYSA-N 0 3 419.544 4.449 20 0 HIADHN Cc1ccc(C(=O)N2CC[C@H](N3CCN(C)CC3)[C@@H](C)C2)c(Sc2ccccc2)c1 ZINC000544260174 940370993 /nfs/dbraw/zinc/37/09/93/940370993.db2.gz ZZEKOPNVKVEIPT-REWPJTCUSA-N 0 3 423.626 4.244 20 0 HIADHN C[C@H]1CCN(C(=O)c2cccc(CN(C)Cc3ccccc3)c2)C[C@@H]1n1ccnc1 ZINC000544278098 940377182 /nfs/dbraw/zinc/37/71/82/940377182.db2.gz LZJXKSJCWWLBGJ-RDPSFJRHSA-N 0 3 402.542 4.238 20 0 HIADHN CC(C)([C@H](NC(=O)[C@@H]1COc2ccccc21)c1ccc(F)c(F)c1)N1CCCC1 ZINC000544358572 940400664 /nfs/dbraw/zinc/40/06/64/940400664.db2.gz QWVPXSZUCRTYOA-DYESRHJHSA-N 0 3 400.469 4.173 20 0 HIADHN COc1ccc(CN2CCC(OC[C@@H]3CCOC3)CC2)cc1OCc1ccccc1 ZINC000544372280 940404450 /nfs/dbraw/zinc/40/44/50/940404450.db2.gz YBEQNPHXYCHZKZ-JOCHJYFZSA-N 0 3 411.542 4.292 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2CN2CCC(OC[C@H]3CCOC3)CC2)o1 ZINC000544372298 940404508 /nfs/dbraw/zinc/40/45/08/940404508.db2.gz YYEGKVHEDAIDFC-FQEVSTJZSA-N 0 3 421.541 4.458 20 0 HIADHN Cc1nc(-c2ccccc2F)sc1[C@@H](C)N[C@@H]1CCCN(Cc2ccccn2)C1=O ZINC000544386024 940408282 /nfs/dbraw/zinc/40/82/82/940408282.db2.gz RKERHIPPCOQCND-FOIQADDNSA-N 0 3 424.545 4.494 20 0 HIADHN Cc1ccc(Cl)c(OC[C@@H](O)CN2CCC(OCCc3ccccc3)CC2)c1 ZINC000544395597 940410831 /nfs/dbraw/zinc/41/08/31/940410831.db2.gz VQPVMFLVDSAUOU-FQEVSTJZSA-N 0 3 403.950 4.112 20 0 HIADHN O=C(CN[C@@H](Cc1ccccc1)c1cccs1)Nc1ccccc1N1CCCC1=O ZINC000544412644 940416726 /nfs/dbraw/zinc/41/67/26/940416726.db2.gz NTGFNEXGYHEMMH-FQEVSTJZSA-N 0 3 419.550 4.387 20 0 HIADHN O=C(CN[C@@H](Cc1ccccc1)c1cccs1)N1CCO[C@H](c2ccc(F)cc2)C1 ZINC000544415151 940417062 /nfs/dbraw/zinc/41/70/62/940417062.db2.gz HRMXFHMAOJDTQY-VXKWHMMOSA-N 0 3 424.541 4.361 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(COc4ccc(C(C)(C)C)cc4)n3)cn2)CC1 ZINC000544419859 940419408 /nfs/dbraw/zinc/41/94/08/940419408.db2.gz PXBCQVFNZRDEGP-UHFFFAOYSA-N 0 3 421.545 4.150 20 0 HIADHN C[C@H]1N(CC(=O)N2CCc3sccc3[C@H]2c2ccccc2)CCC12CCOCC2 ZINC000544546408 940476259 /nfs/dbraw/zinc/47/62/59/940476259.db2.gz HTVRLBSGDHUMMC-WZONZLPQSA-N 0 3 410.583 4.113 20 0 HIADHN CN1CCN(Cc2ccc(CNC(=O)Nc3cccc(C(F)F)c3Cl)cc2)CC1 ZINC000544631632 940494657 /nfs/dbraw/zinc/49/46/57/940494657.db2.gz WEUYQNWIULPRCR-UHFFFAOYSA-N 0 3 422.907 4.347 20 0 HIADHN CCCN1CCN(c2ccccc2CNc2ccc3c(c2)CCC(=O)N3CC)CC1 ZINC000544711007 940505618 /nfs/dbraw/zinc/50/56/18/940505618.db2.gz YRLZIZCPRZCMNV-UHFFFAOYSA-N 0 3 406.574 4.130 20 0 HIADHN CS[C@H]1CN(C(=O)Nc2ccc(C)c(Oc3cc(C)ccn3)c2)C[C@@H]1N(C)C ZINC000544792750 940514484 /nfs/dbraw/zinc/51/44/84/940514484.db2.gz IQOUHCQRVSFTDI-HKUYNNGSSA-N 0 3 400.548 4.000 20 0 HIADHN COC(=O)[C@H](C)Cc1ccc(NC(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000544802049 940515681 /nfs/dbraw/zinc/51/56/81/940515681.db2.gz XEUICUNSQNEAOX-AUSIDOKSSA-N 0 3 423.557 4.167 20 0 HIADHN CCC(CC)(CN[C@@H](c1ccc(C)cc1)c1cccc(S(C)(=O)=O)c1)C(=O)OC ZINC000544833548 940518271 /nfs/dbraw/zinc/51/82/71/940518271.db2.gz WJZWVPHFFCDBGK-NRFANRHFSA-N 0 3 417.571 4.057 20 0 HIADHN CCN(C(=O)Cc1nc(-c2cccs2)oc1C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000544849227 940519119 /nfs/dbraw/zinc/51/91/19/940519119.db2.gz PSJXJFKKHDIGEE-IBGZPJMESA-N 0 3 409.555 4.377 20 0 HIADHN CO[C@H](c1noc(-c2ccc(N3CCN(C(C)C)CC3)cc2)n1)c1ccc(F)cc1 ZINC000545091669 940541716 /nfs/dbraw/zinc/54/17/16/940541716.db2.gz YBUGRQCGXNZTFQ-NRFANRHFSA-N 0 3 410.493 4.142 20 0 HIADHN C(=Cc1ccc(OCc2ccccn2)cc1)c1nc(CC2=N[C@@H]3CCCC[C@@H]3N2)no1 ZINC000545125732 940545581 /nfs/dbraw/zinc/54/55/81/940545581.db2.gz DHOMHFFLCURYOA-COWUTYSCSA-N 0 3 415.497 4.069 20 0 HIADHN O=S(=O)(CCCNC1(c2cccc(Br)c2)CCC1)c1ccccc1 ZINC000545222833 940557015 /nfs/dbraw/zinc/55/70/15/940557015.db2.gz XTDCSVMWDSHZFB-UHFFFAOYSA-N 0 3 408.361 4.282 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)NCc3ccccc3COC(C)C)c2)CC1 ZINC000545331361 940562164 /nfs/dbraw/zinc/56/21/64/940562164.db2.gz NQZSPEVMITXJRD-UHFFFAOYSA-N 0 3 410.562 4.075 20 0 HIADHN CCc1nc2c(s1)[C@H](N(C)C(=O)N[C@H]1CCN(Cc3ccccc3)[C@@H]1C)CCC2 ZINC000563963755 945331792 /nfs/dbraw/zinc/33/17/92/945331792.db2.gz IKBXQKFQMSOANB-IMFGXOCKSA-N 0 3 412.603 4.387 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1oc(C2CC2)nc1C ZINC000545344006 940563377 /nfs/dbraw/zinc/56/33/77/940563377.db2.gz LAAGCKQJYCMPOF-LJQANCHMSA-N 0 3 405.502 4.065 20 0 HIADHN COC(=O)[C@H](C)Cc1ccc(NC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)cc1 ZINC000545428545 940569379 /nfs/dbraw/zinc/56/93/79/940569379.db2.gz LOFDLVBALUUORQ-UXHICEINSA-N 0 3 423.557 4.167 20 0 HIADHN COc1cc([C@H](C)N[C@@H](C)[C@@H](OC)c2ccccc2Cl)ccc1S(C)(=O)=O ZINC000545460614 940570982 /nfs/dbraw/zinc/57/09/82/940570982.db2.gz RNJMFEAQFYPWTD-PJSUUKDQSA-N 0 3 411.951 4.179 20 0 HIADHN COc1ccc(C(=O)C(=O)N(C)[C@H]2CCN(Cc3ccccc3)[C@@H](C)C2)cc1Cl ZINC000545475269 940571321 /nfs/dbraw/zinc/57/13/21/940571321.db2.gz FLFOWEZBLBHDFK-LPHOPBHVSA-N 0 3 414.933 4.043 20 0 HIADHN CCN(C(=O)c1cccc(NC(=O)[C@@H]2C[C@H]2C)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000545476608 940571416 /nfs/dbraw/zinc/57/14/16/940571416.db2.gz DXFZOSFOYKESFX-YFXJRYMSSA-N 0 3 405.542 4.018 20 0 HIADHN CCN(C(=O)Cc1csc(-c2ccccc2)n1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000545475841 940571446 /nfs/dbraw/zinc/57/14/46/940571446.db2.gz PSNRHEAZMREHIM-QFIPXVFZSA-N 0 3 405.567 4.476 20 0 HIADHN C[C@@H](NCC(=O)N1CCC(OCc2ccccc2)CC1)c1ccc2c(c1)CCCC2 ZINC000545506424 940572388 /nfs/dbraw/zinc/57/23/88/940572388.db2.gz DXWNMAFAZYYCCJ-HXUWFJFHSA-N 0 3 406.570 4.424 20 0 HIADHN CCN(Cc1nc(-c2cc(F)c(F)c(F)c2)no1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000545517413 940572894 /nfs/dbraw/zinc/57/28/94/940572894.db2.gz YDYCDHCVKFOGLD-QGZVFWFLSA-N 0 3 416.447 4.250 20 0 HIADHN CC(C)(C)[C@@H](CCO)NCC(=O)N1N=C(c2cc3ccccc3o2)C[C@@H]1c1ccco1 ZINC000545517311 940572909 /nfs/dbraw/zinc/57/29/09/940572909.db2.gz KVTFDZLCIYQQAM-XMSQKQJNSA-N 0 3 423.513 4.090 20 0 HIADHN Cc1ccc(C(C)C)cc1OCc1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1 ZINC000545655668 940579134 /nfs/dbraw/zinc/57/91/34/940579134.db2.gz APHCHTKNKIRJGC-UHFFFAOYSA-N 0 3 421.545 4.284 20 0 HIADHN C[C@@H](NCCCS(=O)(=O)c1ccccc1)c1cccc(NC(=O)c2ccccc2)c1 ZINC000545922660 940658324 /nfs/dbraw/zinc/65/83/24/940658324.db2.gz YXMCCDMQPWMASX-LJQANCHMSA-N 0 3 422.550 4.454 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)C(C)(C)Cc1nc2ccccc2[nH]1)c1cccc(OC)c1 ZINC000545964805 940667183 /nfs/dbraw/zinc/66/71/83/940667183.db2.gz KKZDPFSQEGMXMU-QFIPXVFZSA-N 0 3 422.573 4.340 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@@H](c3ccccc3)C(F)(F)F)c2)CC1 ZINC000546038122 940679237 /nfs/dbraw/zinc/67/92/37/940679237.db2.gz HQDGAKUNKNWAHB-IBGZPJMESA-N 0 3 406.452 4.254 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)N[C@@H](CC(C)(C)C)C(F)(F)F)CC2)C[C@H](C)O1 ZINC000546110711 940702568 /nfs/dbraw/zinc/70/25/68/940702568.db2.gz OFIRMRTVDZXLIL-JZXOWHBKSA-N 0 3 421.548 4.274 20 0 HIADHN CCN(C(=O)c1cc2cnn(C(C)C)c2nc1C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000546182507 940723531 /nfs/dbraw/zinc/72/35/31/940723531.db2.gz DYSJTEDEENFGML-NRFANRHFSA-N 0 3 405.546 4.057 20 0 HIADHN CCN(CCC1CC1)[C@@H](C)C(=O)Nc1ccc(C(=O)Nc2ccccc2OC)cc1 ZINC000546223266 940734289 /nfs/dbraw/zinc/73/42/89/940734289.db2.gz FBCNWVCTECWKTB-KRWDZBQOSA-N 0 3 409.530 4.397 20 0 HIADHN O=C1CCCN1c1cccc(-c2noc(-c3ccc(CN4CCSCC4)cc3)n2)c1 ZINC000546280287 940760889 /nfs/dbraw/zinc/76/08/89/940760889.db2.gz SSYGRNMKUGCSER-UHFFFAOYSA-N 0 3 420.538 4.079 20 0 HIADHN CN(C)C[C@H](NC(=O)c1cc2sc(N3CCCC3)nc2s1)c1ccc(F)cc1 ZINC000564021683 945352217 /nfs/dbraw/zinc/35/22/17/945352217.db2.gz KKDMFJKIXBKVIG-HNNXBMFYSA-N 0 3 418.563 4.130 20 0 HIADHN COc1cccc(OC)c1OCc1noc(C2CCN(Cc3ccccc3)CC2)n1 ZINC000546491640 940835388 /nfs/dbraw/zinc/83/53/88/940835388.db2.gz JVPCUCGQMPMUDK-UHFFFAOYSA-N 0 3 409.486 4.045 20 0 HIADHN CN(C)C[C@@H](NC(=O)c1ccc(COc2ccc(F)cc2)o1)c1ccc(F)cc1 ZINC000564022009 945352917 /nfs/dbraw/zinc/35/29/17/945352917.db2.gz BLISPRHHQNTXAZ-HXUWFJFHSA-N 0 3 400.425 4.170 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@H](C)c3ccccc3OC(C)C)c2)CC1 ZINC000546744518 940875235 /nfs/dbraw/zinc/87/52/35/940875235.db2.gz OSSDJWZFVRHPNM-LJQANCHMSA-N 0 3 410.562 4.498 20 0 HIADHN O=C(NCc1nc2ccccc2n1C1CC1)NC[C@H](c1cccs1)N1CCCC1 ZINC000546824922 940889164 /nfs/dbraw/zinc/88/91/64/940889164.db2.gz JEQFSLAFBGIJPI-LJQANCHMSA-N 0 3 409.559 4.069 20 0 HIADHN O=C(NCc1nc2ccccc2n1C1CC1)NC[C@H](c1ccccc1)N1CCCC1 ZINC000546848932 940894412 /nfs/dbraw/zinc/89/44/12/940894412.db2.gz SPDAASJIRFEPED-JOCHJYFZSA-N 0 3 403.530 4.008 20 0 HIADHN COc1ccc(C(=O)CCCCC(=O)Nc2cccc(CN3CCC(O)CC3)c2)cc1 ZINC000546853971 940895618 /nfs/dbraw/zinc/89/56/18/940895618.db2.gz KSUHTCLYKNNZNT-UHFFFAOYSA-N 0 3 424.541 4.034 20 0 HIADHN CCN(C(=O)c1cc(C)n(-c2cccc(F)c2)n1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000546888472 940902976 /nfs/dbraw/zinc/90/29/76/940902976.db2.gz CPUCGLVYJIQUSO-QFIPXVFZSA-N 0 3 406.505 4.056 20 0 HIADHN CCN(C(=O)c1cnn(-c2ccccc2F)c1C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000546914362 940911477 /nfs/dbraw/zinc/91/14/77/940911477.db2.gz BYNBRUFEOTZGFU-FQEVSTJZSA-N 0 3 406.505 4.056 20 0 HIADHN COc1ccc2nc(-c3noc([C@H]4CCCN(Cc5cccnc5)C4)n3)ccc2c1 ZINC000547043062 940972106 /nfs/dbraw/zinc/97/21/06/940972106.db2.gz HOVAUXSZOSAEJF-SFHVURJKSA-N 0 3 401.470 4.068 20 0 HIADHN C/C(=C/c1ccc(Cl)cc1)c1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1 ZINC000547061812 940978997 /nfs/dbraw/zinc/97/89/97/940978997.db2.gz AEAQZDJEHLODKN-PEZBUJJGSA-N 0 3 409.921 4.487 20 0 HIADHN COCc1cccc(OCC2(CN3CCC([C@](C)(O)C(F)(F)F)CC3)CC2)c1 ZINC000547344734 941057305 /nfs/dbraw/zinc/05/73/05/941057305.db2.gz UWSVIARIMCMBND-IBGZPJMESA-N 0 3 401.469 4.017 20 0 HIADHN COc1cc(Br)ccc1CCCN1CCC([C@](C)(O)C(F)(F)F)CC1 ZINC000547346363 941057518 /nfs/dbraw/zinc/05/75/18/941057518.db2.gz HLICSGDREIWCMC-KRWDZBQOSA-N 0 3 424.301 4.416 20 0 HIADHN CCN(C(=O)Nc1ccc(-n2cccn2)c(F)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000547465096 941064243 /nfs/dbraw/zinc/06/42/43/941064243.db2.gz UATAZDLUJNEYHH-FQEVSTJZSA-N 0 3 407.493 4.140 20 0 HIADHN CN1CCN(C[C@@H](N[C@@H]2CCCc3ncc(C(F)(F)F)cc32)c2ccccc2)CC1 ZINC000547654103 941070563 /nfs/dbraw/zinc/07/05/63/941070563.db2.gz STLDFQARWKOBPY-FGZHOGPDSA-N 0 3 418.507 4.056 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1cc(=O)[nH]c(C(C)C)c1 ZINC000547864699 941079244 /nfs/dbraw/zinc/07/92/44/941079244.db2.gz PXVUVIMUPOYUEN-HXUWFJFHSA-N 0 3 419.529 4.115 20 0 HIADHN CC(C)CN(C(=O)[C@H]1CCCN(Cc2cccnc2)C1)[C@@H]1CCCc2cccnc21 ZINC000548147912 941088934 /nfs/dbraw/zinc/08/89/34/941088934.db2.gz LHPUPFQQGBSQLU-XZOQPEGZSA-N 0 3 406.574 4.251 20 0 HIADHN COc1ccnc2c(NC(=O)NC3CC(N4CCC(C(F)(F)F)CC4)C3)cccc12 ZINC000548417582 941102020 /nfs/dbraw/zinc/10/20/20/941102020.db2.gz DUEPPHOULBSFDY-UHFFFAOYSA-N 0 3 422.451 4.170 20 0 HIADHN O=C(Nc1ccc(OC(F)F)c2cccnc12)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000548476573 941106578 /nfs/dbraw/zinc/10/65/78/941106578.db2.gz TWRBTUUXZYUZQC-INIZCTEOSA-N 0 3 412.440 4.082 20 0 HIADHN O[C@@H](CNCc1ccc(-c2ccccc2)o1)COc1ccc(Br)cc1 ZINC000548925423 941129767 /nfs/dbraw/zinc/12/97/67/941129767.db2.gz DLEPFPBBJXEEHH-KRWDZBQOSA-N 0 3 402.288 4.239 20 0 HIADHN CCOC(=O)C1CCC(N(CC)CC(=O)Nc2ccc(C(F)(F)F)cc2)CC1 ZINC000548939636 941131389 /nfs/dbraw/zinc/13/13/89/941131389.db2.gz HYAMMMMHNPBGTR-UHFFFAOYSA-N 0 3 400.441 4.088 20 0 HIADHN CN(C)C[C@@H](NC(=O)Nc1ccc(NC(=O)C2CC2)cc1)c1ccc(Cl)cc1 ZINC000548947563 941132325 /nfs/dbraw/zinc/13/23/25/941132325.db2.gz YUCCUGOVBBEASG-LJQANCHMSA-N 0 3 400.910 4.113 20 0 HIADHN O=C(Nc1cccc(Br)c1Cl)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000549086718 941155567 /nfs/dbraw/zinc/15/55/67/941155567.db2.gz PHFQNBFYCVESPU-CQSZACIVSA-N 0 3 408.727 4.499 20 0 HIADHN COc1cccc([C@H]2[C@@H](NCC(=O)Nc3ccc(Cl)cc3C)CCN2C2CC2)c1 ZINC000549111516 941160691 /nfs/dbraw/zinc/16/06/91/941160691.db2.gz CNAPBTQITVLGEF-GMAHTHKFSA-N 0 3 413.949 4.163 20 0 HIADHN CCOc1ccccc1NC(=O)CN[C@@H]1CCN(CC)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000549111301 941160795 /nfs/dbraw/zinc/16/07/95/941160795.db2.gz PCIUABXBEQWARJ-DENIHFKCSA-N 0 3 419.928 4.241 20 0 HIADHN Cc1ccc(NC(=O)C2CC2)cc1NC(=O)N[C@@H](CN(C)C)c1ccc(Cl)cc1 ZINC000549197348 941170424 /nfs/dbraw/zinc/17/04/24/941170424.db2.gz RZBHSGQJEZQUAA-FQEVSTJZSA-N 0 3 414.937 4.421 20 0 HIADHN CC(C)c1nnc2ccc(NC(=O)N(CCN(C)C)Cc3cccc(Cl)c3)cn21 ZINC000549281913 941176699 /nfs/dbraw/zinc/17/66/99/941176699.db2.gz ZJUKTJWGNQTXLN-UHFFFAOYSA-N 0 3 414.941 4.102 20 0 HIADHN COc1ccccc1CNC(=O)[C@H](C)N[C@@H](c1cccc(C(F)(F)F)c1)C1CC1 ZINC000549409983 941187143 /nfs/dbraw/zinc/18/71/43/941187143.db2.gz YDIJSSKMGGKMPL-VBKZILBWSA-N 0 3 406.448 4.460 20 0 HIADHN COc1cccc([C@H]2[C@@H](NCC(=O)N(c3ccccc3)C(C)C)CCN2C2CC2)c1 ZINC000549473355 941193854 /nfs/dbraw/zinc/19/38/54/941193854.db2.gz SUHCKTNSUDEQFR-ZCYQVOJMSA-N 0 3 407.558 4.004 20 0 HIADHN CCc1cccc(CC)c1NC(=O)CN[C@H]1CCN(C2CC2)[C@H]1c1cccc(OC)c1 ZINC000549477371 941194619 /nfs/dbraw/zinc/19/46/19/941194619.db2.gz JQBZVLZOPNDZCB-OZXSUGGESA-N 0 3 421.585 4.326 20 0 HIADHN CCN1CC[C@H](NCC(=O)Nc2cc(C)cc(C)c2)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000549483174 941195282 /nfs/dbraw/zinc/19/52/82/941195282.db2.gz QQNCUBDSFACRRK-UGKGYDQZSA-N 0 3 405.464 4.084 20 0 HIADHN CCC[C@H]1CN(c2nnc(C3CCC3)n2C[C@@H]2CCOC2)CCN1Cc1ccccc1 ZINC000549594392 941200703 /nfs/dbraw/zinc/20/07/03/941200703.db2.gz GNKTVQJFOWRRKD-GMAHTHKFSA-N 0 3 423.605 4.073 20 0 HIADHN CCc1sc(-c2nnc(CN[C@H](C)C3CCN(CC(F)(F)F)CC3)o2)cc1C ZINC000549613385 941201361 /nfs/dbraw/zinc/20/13/61/941201361.db2.gz OBXMUJOWAVMRFI-CYBMUJFWSA-N 0 3 416.513 4.421 20 0 HIADHN CC[C@H]1CN(c2nnc(C3CCCC3)n2C[C@H]2CCOC2)CCN1Cc1ccccc1 ZINC000549678418 941204144 /nfs/dbraw/zinc/20/41/44/941204144.db2.gz NKFHLNWRJFPSOR-GGAORHGYSA-N 0 3 423.605 4.073 20 0 HIADHN CCc1nc(CNC2(Cc3ccc(F)cc3Br)CCOCC2)cs1 ZINC000549750257 941206367 /nfs/dbraw/zinc/20/63/67/941206367.db2.gz YJXDNWGUNKCXKV-UHFFFAOYSA-N 0 3 413.356 4.489 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2ccc(-c3noc(C(F)F)n3)cc2)N(C)C)cc1 ZINC000549802982 941207755 /nfs/dbraw/zinc/20/77/55/941207755.db2.gz UHWIQTRZIVFUDR-KRWDZBQOSA-N 0 3 415.444 4.407 20 0 HIADHN CCOc1cc(CN2CCC(C)=C(c3ccco3)C2)ccc1O[C@H](C)C(=O)N(C)C ZINC000549810639 941208095 /nfs/dbraw/zinc/20/80/95/941208095.db2.gz VEBIZBVNMJDDQI-GOSISDBHSA-N 0 3 412.530 4.213 20 0 HIADHN CCOc1cc(CN2CCC(C)=C(c3ccco3)C2)ccc1O[C@@H](C)C(=O)N(C)C ZINC000549810640 941208103 /nfs/dbraw/zinc/20/81/03/941208103.db2.gz VEBIZBVNMJDDQI-SFHVURJKSA-N 0 3 412.530 4.213 20 0 HIADHN Cc1nn(Cc2ccccc2)c2sc(C(=O)N3CCCN(CC4CCC4)CC3)cc12 ZINC000549846027 941213631 /nfs/dbraw/zinc/21/36/31/941213631.db2.gz UQZZAADHGBSZBO-UHFFFAOYSA-N 0 3 422.598 4.403 20 0 HIADHN C[C@H]1CCO[C@H]1c1nnc(N2CCN(CCC(C)(C)C)CC2)n1Cc1cccs1 ZINC000549956279 941249184 /nfs/dbraw/zinc/24/91/84/941249184.db2.gz BPONZLWRSUAUNA-PKOBYXMFSA-N 0 3 417.623 4.044 20 0 HIADHN CC(C)(C)CCN1CCN(C(=O)Nc2ccc(-c3noc(C(F)F)n3)cc2)CC1 ZINC000550196823 941296774 /nfs/dbraw/zinc/29/67/74/941296774.db2.gz TYRRRQIXDKCVND-UHFFFAOYSA-N 0 3 407.465 4.260 20 0 HIADHN Cc1cc2c(o1)CC(C)(C)C[C@H]2NC(=O)N(C)C1CCN(CCc2ccccn2)CC1 ZINC000550228710 941301566 /nfs/dbraw/zinc/30/15/66/941301566.db2.gz MDDVDRQTDLZGLW-JOCHJYFZSA-N 0 3 424.589 4.345 20 0 HIADHN CC[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)N(CCN(C)C)Cc1ccccn1 ZINC000550311249 941313003 /nfs/dbraw/zinc/31/30/03/941313003.db2.gz ONYSJLDQHRPUEH-GOSISDBHSA-N 0 3 407.480 4.260 20 0 HIADHN NC(=O)[C@H](NCCCCc1ccc(Cl)s1)c1cccc(Br)c1 ZINC000551002829 941393162 /nfs/dbraw/zinc/39/31/62/941393162.db2.gz CWCOYZXACIYQLL-OAHLLOKOSA-N 0 3 401.757 4.303 20 0 HIADHN CC[C@H](NCc1ccc(NC(=O)c2ccncc2)cc1)c1ccc(C(=O)OC)cc1 ZINC000551029439 941397660 /nfs/dbraw/zinc/39/76/60/941397660.db2.gz DPMXTQJGTXMTQI-QFIPXVFZSA-N 0 3 403.482 4.361 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2ccc(C(C)(F)F)cc2)cc1)[C@H]1CCCN(C)C1 ZINC000551056399 941401899 /nfs/dbraw/zinc/40/18/99/941401899.db2.gz JOSYNZUQTMYTGA-FQEVSTJZSA-N 0 3 415.484 4.217 20 0 HIADHN Cc1c(Cl)cccc1NC(=O)[C@H](C)N[C@@H]1CCN(C)[C@H]1c1ccc(F)c(F)c1 ZINC000551093637 941408939 /nfs/dbraw/zinc/40/89/39/941408939.db2.gz PMKKZFMEXGXXHD-SVIJTADQSA-N 0 3 407.892 4.289 20 0 HIADHN CN1CC[C@H](NCC(=O)Nc2cc(Cl)ccc2Cl)[C@@H]1c1ccc(F)c(F)c1 ZINC000551097703 941409297 /nfs/dbraw/zinc/40/92/97/941409297.db2.gz QRKZWVLJWXNALG-LPHOPBHVSA-N 0 3 414.283 4.245 20 0 HIADHN OC[C@@H](N[C@H]1COc2ccccc2C1)c1ccc(Br)cc1C(F)(F)F ZINC000551174482 941422077 /nfs/dbraw/zinc/42/20/77/941422077.db2.gz COACREDBHZETLJ-CZUORRHYSA-N 0 3 416.237 4.095 20 0 HIADHN CC1CCN([C@H](CNC(=O)NCc2ccnc(OC(F)F)c2)c2cccs2)CC1 ZINC000551218521 941430027 /nfs/dbraw/zinc/43/00/27/941430027.db2.gz SLQVSRFLWLVVML-MRXNPFEDSA-N 0 3 424.517 4.017 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CCC(CC(F)(F)F)CC1)c1cccc(OC)c1 ZINC000551269475 941440441 /nfs/dbraw/zinc/44/04/41/941440441.db2.gz SBXUOAFXAMBSLU-IBGZPJMESA-N 0 3 415.500 4.452 20 0 HIADHN COc1ccc([C@H](C)N[C@H]2CCCN([C@@H](C)c3ccc(F)cc3)C2=O)cc1OC ZINC000551275057 941441495 /nfs/dbraw/zinc/44/14/95/941441495.db2.gz YNXJDUBPRZPCKC-FTRWYGJKSA-N 0 3 400.494 4.246 20 0 HIADHN CCc1ccc(-c2noc([C@H](C)NC[C@H]3CN(Cc4ccccc4)CCCO3)n2)cc1 ZINC000551394863 941468951 /nfs/dbraw/zinc/46/89/51/941468951.db2.gz IDGOENUPXZEDCW-CVDCTZTESA-N 0 3 420.557 4.241 20 0 HIADHN Cn1c2ccccc2nc1[C@H]1CCCN1C[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000551396128 941468958 /nfs/dbraw/zinc/46/89/58/941468958.db2.gz PMUMTUNRLGVNNE-XUZZJYLKSA-N 0 3 404.558 4.001 20 0 HIADHN C[C@H](NCc1cccc(I)c1)c1cccc(N2CCCC2=O)c1 ZINC000551538266 941497599 /nfs/dbraw/zinc/49/75/99/941497599.db2.gz TZVGJNRMGGECMW-AWEZNQCLSA-N 0 3 420.294 4.269 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)CCc2nc(C)c(-c3ccccc3)o2)cc1 ZINC000551537308 941497756 /nfs/dbraw/zinc/49/77/56/941497756.db2.gz OQRXOSPDBVRRBK-OAQYLSRUSA-N 0 3 407.514 4.010 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)[C@H]2C[C@H]2c2ccc(C(F)(F)F)cc2)cc1 ZINC000551540916 941498079 /nfs/dbraw/zinc/49/80/79/941498079.db2.gz SMMLFSYGEBCGBJ-UFYCRDLUSA-N 0 3 406.448 4.237 20 0 HIADHN COc1ccc([C@H](NCc2cccc(N3C(=O)N[C@@](C)(C4CC4)C3=O)c2)C2CC2)cc1 ZINC000551572773 941505078 /nfs/dbraw/zinc/50/50/78/941505078.db2.gz KDMDKLUJOVDJTQ-RDGATRHJSA-N 0 3 419.525 4.161 20 0 HIADHN CC(C)n1ncc2cc(CN[C@@H](c3cncc(Br)c3)C3CC3)cnc21 ZINC000551615001 941512828 /nfs/dbraw/zinc/51/28/28/941512828.db2.gz LEACZACJAAIANA-GOSISDBHSA-N 0 3 400.324 4.411 20 0 HIADHN C[C@H]1CN(C2CC2)C[C@H]1NC(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000551641373 941517168 /nfs/dbraw/zinc/51/71/68/941517168.db2.gz YBFKUUWSPOZXSZ-MEDUHNTESA-N 0 3 423.401 4.348 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)[C@@H]1CCc2cccc(O)c21 ZINC000551704902 941530066 /nfs/dbraw/zinc/53/00/66/941530066.db2.gz FZDNPRZKURWHMS-NHCUHLMSSA-N 0 3 416.525 4.013 20 0 HIADHN COC(=O)[C@H](Cc1ccccc1)[C@H](C)N[C@@H](C)C(=O)Nc1cc(Cl)ccc1Cl ZINC000551718114 941532602 /nfs/dbraw/zinc/53/26/02/941532602.db2.gz OPPBREDQUIUBSG-GRDNDAEWSA-N 0 3 423.340 4.330 20 0 HIADHN Cc1n[nH]cc1C1CCN(Cc2ccnc(-c3ccc(Br)cc3)n2)CC1 ZINC000551724894 941533806 /nfs/dbraw/zinc/53/38/06/941533806.db2.gz YGYGXGQNBXNAEL-UHFFFAOYSA-N 0 3 412.335 4.317 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)c2cc(Br)ccc2Cl)cc1 ZINC000551794244 941546179 /nfs/dbraw/zinc/54/61/79/941546179.db2.gz OIDSJERLXOSPDT-QGZVFWFLSA-N 0 3 411.727 4.144 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)[C@@H]2C[C@@H]2c2cccc(C(F)(F)F)c2)cc1 ZINC000551794280 941546302 /nfs/dbraw/zinc/54/63/02/941546302.db2.gz QGOKZURWZJJKFW-AQNXPRMDSA-N 0 3 406.448 4.237 20 0 HIADHN C[C@@H](NCc1cccc(N2C(=O)N[C@@](C)(C3CC3)C2=O)c1)c1cc2c(s1)CCC2 ZINC000551818522 941552186 /nfs/dbraw/zinc/55/21/86/941552186.db2.gz VNCIMALCTWXZNV-FATZIPQQSA-N 0 3 409.555 4.313 20 0 HIADHN Cc1cc(OC(F)F)c(C(=O)N2CCN(c3ccnc4ccccc43)CC2)s1 ZINC000552008762 941567921 /nfs/dbraw/zinc/56/79/21/941567921.db2.gz ZAMCQSKAHOERTM-UHFFFAOYSA-N 0 3 403.454 4.169 20 0 HIADHN OCC1(c2ccccc2)CCN(Cc2cnn(-c3ccc(C(F)(F)F)cc3)c2)CC1 ZINC000552072678 941579384 /nfs/dbraw/zinc/57/93/84/941579384.db2.gz WSMMZMIYBWRJQZ-UHFFFAOYSA-N 0 3 415.459 4.417 20 0 HIADHN COc1cc(CN2CCC(O[C@H]3CCOC3)CC2)ccc1OCc1cccs1 ZINC000552080241 941581295 /nfs/dbraw/zinc/58/12/95/941581295.db2.gz XMSSCALUQIIYTF-IBGZPJMESA-N 0 3 403.544 4.106 20 0 HIADHN Cc1ccc(C2CCN(C(=O)[C@H]3CN(Cc4ccccc4)CCC3(F)F)CC2)cn1 ZINC000552142004 941592738 /nfs/dbraw/zinc/59/27/38/941592738.db2.gz FOKNUJJIAFHPIY-JOCHJYFZSA-N 0 3 413.512 4.253 20 0 HIADHN Cc1nc([C@H]2CCCN2C(=O)[C@H]2CN(Cc3ccccc3)CCC2(F)F)cs1 ZINC000552170118 941596567 /nfs/dbraw/zinc/59/65/67/941596567.db2.gz ZTLKOSXMRMCSET-IEBWSBKVSA-N 0 3 405.514 4.272 20 0 HIADHN CC(C)(C)c1nn(-c2ccccc2Cl)cc1CN1CCC(Cn2ccnn2)CC1 ZINC000552181177 941597415 /nfs/dbraw/zinc/59/74/15/941597415.db2.gz KOHSJRMANCJXSI-UHFFFAOYSA-N 0 3 412.969 4.327 20 0 HIADHN O=C(NCCCN[C@H](c1ncc[nH]1)C1CCCCC1)c1ccc(Br)cc1 ZINC000552252648 941614683 /nfs/dbraw/zinc/61/46/83/941614683.db2.gz SKMOGCAZWRUFJD-SFHVURJKSA-N 0 3 419.367 4.203 20 0 HIADHN COc1ccc([C@@H](Cc2ccncc2)N[C@@H]2CCN(C(C)=O)c3ccccc32)cc1 ZINC000552277002 941620906 /nfs/dbraw/zinc/62/09/06/941620906.db2.gz ODWRRGJOQKCELA-DNQXCXABSA-N 0 3 401.510 4.462 20 0 HIADHN Fc1cc(CN2CCC[C@H](c3nc(C(F)(F)F)cs3)C2)ccc1-n1cncn1 ZINC000552304677 941627963 /nfs/dbraw/zinc/62/79/63/941627963.db2.gz XJQOVODAGDYZRV-ZDUSSCGKSA-N 0 3 411.428 4.261 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc2n[nH]cc2c1)c1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000552335099 941635057 /nfs/dbraw/zinc/63/50/57/941635057.db2.gz ISCAYPYQVUQIPU-IAGOWNOFSA-N 0 3 412.559 4.149 20 0 HIADHN Cc1nc(COc2cccc(C(=O)N(C)CCCN(C)Cc3ccncc3)c2)cs1 ZINC000552360483 941644564 /nfs/dbraw/zinc/64/45/64/941644564.db2.gz IBVYDVKILGGRRE-UHFFFAOYSA-N 0 3 424.570 4.020 20 0 HIADHN CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc(Oc3ccc(F)cc3)cc2)c1 ZINC000552501862 941689624 /nfs/dbraw/zinc/68/96/24/941689624.db2.gz GJYKHPAOSGPYCB-NRFANRHFSA-N 0 3 409.457 4.350 20 0 HIADHN C[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)Nc1cccc(CN2CC[C@H](O)C2)c1 ZINC000552516078 941692137 /nfs/dbraw/zinc/69/21/37/941692137.db2.gz IMMMGXYIVYHMDE-YWZLYKJASA-N 0 3 406.448 4.089 20 0 HIADHN Nc1c(C(=O)N2CCCN(CCCc3ccccc3)CC2)ccnc1-c1ccccc1 ZINC000552545936 941703912 /nfs/dbraw/zinc/70/39/12/941703912.db2.gz HJZWCEKDIFVOOV-UHFFFAOYSA-N 0 3 414.553 4.112 20 0 HIADHN Cc1c(NC(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)cccc1-c1ncco1 ZINC000552708766 941742470 /nfs/dbraw/zinc/74/24/70/941742470.db2.gz NGTXVKWQSLIUAL-UHFFFAOYSA-N 0 3 404.514 4.433 20 0 HIADHN COc1ccc(C(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)c(C)c1OC ZINC000552725825 941746197 /nfs/dbraw/zinc/74/61/97/941746197.db2.gz INETZDRTZHDAIZ-SFHVURJKSA-N 0 3 402.560 4.277 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)Cc2csc(-c3ccc(C)cc3)n2)cc1 ZINC000552815263 941774819 /nfs/dbraw/zinc/77/48/19/941774819.db2.gz JWAHKDHBHMCULP-NRFANRHFSA-N 0 3 409.555 4.089 20 0 HIADHN O[C@H](CNCc1cc2ccccc2o1)COc1ccc(Cl)cc1Br ZINC000552853165 941788766 /nfs/dbraw/zinc/78/87/66/941788766.db2.gz ODXQFCZRBRCULA-CQSZACIVSA-N 0 3 410.695 4.378 20 0 HIADHN O=C(CCc1ccoc1)N(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000553196549 941847384 /nfs/dbraw/zinc/84/73/84/941847384.db2.gz SMYMFVBOLFTJKC-DEOSSOPVSA-N 0 3 403.526 4.301 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)c1ccc(-c2noc(C(F)F)n2)cc1 ZINC000553238443 941854843 /nfs/dbraw/zinc/85/48/43/941854843.db2.gz JEBAXUGCWKKACQ-UHFFFAOYSA-N 0 3 418.419 4.017 20 0 HIADHN CN1CCC[C@@H](CNc2nnc(-c3ccon3)s2)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000553440073 941885358 /nfs/dbraw/zinc/88/53/58/941885358.db2.gz YHKKLCIRYMLRNJ-BBRMVZONSA-N 0 3 423.464 4.707 20 0 HIADHN CN1CCC[C@H](CNc2nnc(-c3ccon3)s2)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000553440074 941885382 /nfs/dbraw/zinc/88/53/82/941885382.db2.gz YHKKLCIRYMLRNJ-CJNGLKHVSA-N 0 3 423.464 4.707 20 0 HIADHN Cc1cc2ncn(C[C@H](O)CNCc3cc(Cl)ccc3OC(F)F)c2cc1C ZINC000553454749 941887623 /nfs/dbraw/zinc/88/76/23/941887623.db2.gz RIYYVZXVBOENFY-MRXNPFEDSA-N 0 3 409.864 4.059 20 0 HIADHN Cc1ccc(S[C@@H](C)C(=O)N2CCC[C@@H](c3n[nH]cc3CN3CCCC3)C2)cc1 ZINC000553512607 941900174 /nfs/dbraw/zinc/90/01/74/941900174.db2.gz GEFXELHGRFQDAK-RBUKOAKNSA-N 0 3 412.603 4.201 20 0 HIADHN CCOc1cc(CNC[C@H](O)C(F)F)ccc1OCc1c(F)cccc1Cl ZINC000553517788 941900890 /nfs/dbraw/zinc/90/08/90/941900890.db2.gz SOUKSIMAMSCHDN-INIZCTEOSA-N 0 3 403.828 4.172 20 0 HIADHN Cc1ccc(-n2ncc(C(=O)N3CCN(C4CCC4)C[C@H](C)C3)c2C(F)(F)F)cc1 ZINC000553528582 941903740 /nfs/dbraw/zinc/90/37/40/941903740.db2.gz RWJZMBOBNLVBEN-INIZCTEOSA-N 0 3 420.479 4.146 20 0 HIADHN Cc1ccccc1-n1ncc(C(=O)N2CCN(C3CCC3)C[C@@H](C)C2)c1C(F)(F)F ZINC000553528318 941903988 /nfs/dbraw/zinc/90/39/88/941903988.db2.gz NKRVRBYUJVIHDA-OAHLLOKOSA-N 0 3 420.479 4.146 20 0 HIADHN CCN1CC[C@H](N(C)C(=O)Nc2ccc(Cl)cc2C(=O)c2ccc[nH]2)C[C@H]1C ZINC000553614946 941921590 /nfs/dbraw/zinc/92/15/90/941921590.db2.gz BPTODVCSZPHMGM-ZBFHGGJFSA-N 0 3 402.926 4.236 20 0 HIADHN Cc1cc(C(=O)N2CCN([C@@H]3C[C@H]3C)C[C@H](C)C2)nn1-c1ccc(Cl)c(Cl)c1 ZINC000553782638 941967568 /nfs/dbraw/zinc/96/75/68/941967568.db2.gz CRFKZRIZZBJEFL-LRDNONRASA-N 0 3 421.372 4.290 20 0 HIADHN Cc1cccc(-n2ncc(C(=O)N3CCN([C@@H]4C[C@@H]4C)C[C@@H](C)C3)c2C(F)(F)F)c1 ZINC000553783447 941967891 /nfs/dbraw/zinc/96/78/91/941967891.db2.gz VNBSEXNIKCWHDI-JTDSTZFVSA-N 0 3 420.479 4.002 20 0 HIADHN Cc1cccc(CN(CC(=O)NCc2ccc(C(=O)N3CCCC3)cc2)CC(C)C)c1 ZINC000553851142 941983309 /nfs/dbraw/zinc/98/33/09/941983309.db2.gz SZQIXKOICSHZKY-UHFFFAOYSA-N 0 3 421.585 4.005 20 0 HIADHN C[C@@H]1CN(C(=O)c2ccn(-c3ccc(Cl)cc3Cl)n2)CCN(C2CCC2)C1 ZINC000553862508 941986254 /nfs/dbraw/zinc/98/62/54/941986254.db2.gz CQNSNZISUPYBHA-AWEZNQCLSA-N 0 3 407.345 4.126 20 0 HIADHN COc1cc(CNC[C@@H](O)C(F)F)ccc1OCc1cccc(C(F)(F)F)c1 ZINC000553866851 941987496 /nfs/dbraw/zinc/98/74/96/941987496.db2.gz KCMRSYWQRRAMJN-OAHLLOKOSA-N 0 3 405.363 4.009 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)[C@H]2C[C@H]2c2cc(F)ccc2F)N(C)C)cc1 ZINC000554015498 942019680 /nfs/dbraw/zinc/01/96/80/942019680.db2.gz XQCUWJPCNYSPBQ-VCOUNFBDSA-N 0 3 402.485 4.275 20 0 HIADHN C[C@@H]1CCc2c(sc3nc(CCN(C)C[C@@H]4OCCc5ccccc54)nc(N)c32)C1 ZINC000554030536 942022282 /nfs/dbraw/zinc/02/22/82/942022282.db2.gz ICXGOYFZVOPCRE-BEFAXECRSA-N 0 3 422.598 4.187 20 0 HIADHN CCOc1cc2c(cc1NC(=O)NC[C@H](N[C@@H](C)CC)c1ccco1)O[C@H](C)C2 ZINC000554068047 942029180 /nfs/dbraw/zinc/02/91/80/942029180.db2.gz SFMGQVUUXJQJSO-DAYGRLMNSA-N 0 3 401.507 4.253 20 0 HIADHN CC(C)Cc1ccc([C@H](CNC(=O)Cc2csc(-c3ccccn3)n2)N(C)C)cc1 ZINC000554078119 942031155 /nfs/dbraw/zinc/03/11/55/942031155.db2.gz DMVBNWOXWOKULX-QFIPXVFZSA-N 0 3 422.598 4.365 20 0 HIADHN CCCN(C)[C@H](CNC(=O)Nc1ccc(C(=O)N(C)C)cc1)c1ccc(Cl)cc1 ZINC000554109383 942038225 /nfs/dbraw/zinc/03/82/25/942038225.db2.gz STUULWUHSSQMRH-HXUWFJFHSA-N 0 3 416.953 4.246 20 0 HIADHN CCc1nc(-c2ccc(Cl)cc2)[nH]c1C(=O)N1CCN([C@@H]2C[C@@H]2C)C[C@@H](C)C1 ZINC000554113348 942039223 /nfs/dbraw/zinc/03/92/23/942039223.db2.gz MMESCRWTMJPGGS-ZRGWGRIASA-N 0 3 400.954 4.095 20 0 HIADHN Cc1cc(OC[C@H](O)CN2CC[C@H](OCc3ccncc3)C2)c(C(C)C)cc1Cl ZINC000554248145 942077252 /nfs/dbraw/zinc/07/72/52/942077252.db2.gz SCWMMWSAVYQTHL-UXHICEINSA-N 0 3 418.965 4.198 20 0 HIADHN CN(C)C[C@@H](NC(=O)Nc1c(F)cc(Br)cc1F)c1ccc(F)cc1 ZINC000554259197 942081804 /nfs/dbraw/zinc/08/18/04/942081804.db2.gz CMGULFYRFSENEP-OAHLLOKOSA-N 0 3 416.241 4.291 20 0 HIADHN C[C@H](NC(=O)Nc1nc(CN2CCC[C@@H](C)C2)cs1)[C@@H](c1ccccc1)N(C)C ZINC000554385606 942121508 /nfs/dbraw/zinc/12/15/08/942121508.db2.gz FNQJGNQRNCBJIP-UWVAXJGDSA-N 0 3 415.607 4.188 20 0 HIADHN Cc1nn(C)c2sc([C@H](C)N[C@H]3CC(=O)N(C)[C@H]3c3ccc(Cl)c(F)c3)cc12 ZINC000554385129 942121782 /nfs/dbraw/zinc/12/17/82/942121782.db2.gz RNYVRPAFDFUKFQ-UTLVKMTRSA-N 0 3 420.941 4.358 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)Nc2ccc(NC(=O)C3CC3)cc2)N(C)C)cc1 ZINC000554399548 942126910 /nfs/dbraw/zinc/12/69/10/942126910.db2.gz WAXSWCFUWBFDAQ-QFIPXVFZSA-N 0 3 424.545 4.247 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1ccc(-n2nc(C)cc2C)c(F)c1)c1ccco1 ZINC000554409861 942131560 /nfs/dbraw/zinc/13/15/60/942131560.db2.gz UBBRAGYUZVPHQR-LIRRHRJNSA-N 0 3 413.497 4.472 20 0 HIADHN CCOCCOc1c(Cl)cccc1NC(=O)N[C@H](CN(C)C)c1ccc(F)cc1 ZINC000554425417 942137955 /nfs/dbraw/zinc/13/79/55/942137955.db2.gz BHICLNORNVPSSC-LJQANCHMSA-N 0 3 423.916 4.319 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)N1Cc2cccc(Cl)c2C1 ZINC000554428597 942140161 /nfs/dbraw/zinc/14/01/61/942140161.db2.gz UAESQQTVYYPVDB-UHFFFAOYSA-N 0 3 401.963 4.479 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1ccc(C)cc1OC[C@H]1CCCO1)c1ccco1 ZINC000554433116 942141011 /nfs/dbraw/zinc/14/10/11/942141011.db2.gz SNKFVMHOXBOIEQ-NSHGMRRFSA-N 0 3 415.534 4.397 20 0 HIADHN CC(=O)N(Cc1ccc(NC(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)cc1)C(C)C ZINC000554476414 942156404 /nfs/dbraw/zinc/15/64/04/942156404.db2.gz VXIKEMKCECRLNT-WZONZLPQSA-N 0 3 410.562 4.256 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)c1ccc(-c2noc(C(F)F)n2)cc1)c1ccco1 ZINC000554633712 942180860 /nfs/dbraw/zinc/18/08/60/942180860.db2.gz ZENRCLXHDPGMPZ-DOMZBBRYSA-N 0 3 404.417 4.126 20 0 HIADHN COC[C@H](NC(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1)c1cccc(Cl)c1 ZINC000554692645 942200828 /nfs/dbraw/zinc/20/08/28/942200828.db2.gz ZLCDWHWXMGGXDH-HBGVWJBISA-N 0 3 401.938 4.162 20 0 HIADHN O=C([C@H]1CCCN(Cc2cccnc2)C1)N1CC[C@@](F)(c2cccc(Cl)c2)C1 ZINC000554811347 942254836 /nfs/dbraw/zinc/25/48/36/942254836.db2.gz BCQXNSXZRFUQRW-AVRDEDQJSA-N 0 3 401.913 4.044 20 0 HIADHN O=C([C@H]1CCCN(Cc2cccnc2)C1)N1CC[C@](F)(c2cccc(Cl)c2)C1 ZINC000554811349 942255347 /nfs/dbraw/zinc/25/53/47/942255347.db2.gz BCQXNSXZRFUQRW-PGRDOPGGSA-N 0 3 401.913 4.044 20 0 HIADHN FC1(F)CCN(Cc2ccccc2)C[C@@H]1c1nc(-c2nnc(-c3ccccc3)o2)no1 ZINC000554832381 942270861 /nfs/dbraw/zinc/27/08/61/942270861.db2.gz PFHRFVUYGBVTQI-QGZVFWFLSA-N 0 3 423.423 4.411 20 0 HIADHN COC(=O)[C@@H](C)Cc1ccc(NC(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)cc1 ZINC000554914997 942317829 /nfs/dbraw/zinc/31/78/29/942317829.db2.gz JHQLZIOXMVUAHC-YWZLYKJASA-N 0 3 417.937 4.116 20 0 HIADHN Cc1cnc(NC(=O)N(Cc2ccccc2Br)C2CCN(C)CC2)s1 ZINC000554920603 942320334 /nfs/dbraw/zinc/32/03/34/942320334.db2.gz YQZCINMVDFMLCS-UHFFFAOYSA-N 0 3 423.380 4.342 20 0 HIADHN COc1ccc(CCN(Cc2ccsc2)Cc2c[nH]c3nccnc23)cc1OC ZINC000555094382 942383612 /nfs/dbraw/zinc/38/36/12/942383612.db2.gz LYKUNIXYYCEBGI-UHFFFAOYSA-N 0 3 408.527 4.233 20 0 HIADHN CCN1CC[C@@H](NCC(=O)Nc2ccc(F)cc2F)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000555124755 942392025 /nfs/dbraw/zinc/39/20/25/942392025.db2.gz AWROAQYGDSXGJG-QUCCMNQESA-N 0 3 411.855 4.121 20 0 HIADHN CCN1CC[C@H](NCC(=O)N(C)[C@H](C)c2ccccc2)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000555129057 942394829 /nfs/dbraw/zinc/39/48/29/942394829.db2.gz JPXYUJDFRZPBOR-XLHILCRZSA-N 0 3 419.491 4.048 20 0 HIADHN Cn1nccc1C1=C[C@H]2CC[C@@H](C1)N2CCC(=O)Nc1cc(Cl)ccc1Cl ZINC000555130305 942395965 /nfs/dbraw/zinc/39/59/65/942395965.db2.gz BRIGLMDLRBUFOL-CVEARBPZSA-N 0 3 405.329 4.376 20 0 HIADHN CCN1CC[C@@H](NCC(=O)Nc2ccc(C)cc2F)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000555131658 942396488 /nfs/dbraw/zinc/39/64/88/942396488.db2.gz PEHJKULYAAIVCE-CTNGQTDRSA-N 0 3 407.892 4.290 20 0 HIADHN C[C@@H]1CC(C(=O)N(Cc2ccccc2Br)C2CCN(C)CC2)C[C@@H](C)O1 ZINC000555162368 942411531 /nfs/dbraw/zinc/41/15/31/942411531.db2.gz JGWRXRZAKJQPSH-HZPDHXFCSA-N 0 3 423.395 4.076 20 0 HIADHN CC(C)(C)OC(=O)c1cccc(NC2CCN(CCOc3ccc(F)cc3)CC2)n1 ZINC000555168957 942413762 /nfs/dbraw/zinc/41/37/62/942413762.db2.gz RSEMVTOSCCWNND-UHFFFAOYSA-N 0 3 415.509 4.131 20 0 HIADHN C[C@@H](NC(=O)N[C@H](CN(C)C)c1ccc(Cl)cc1)c1nc(C(F)(F)F)cs1 ZINC000555206533 942431618 /nfs/dbraw/zinc/43/16/18/942431618.db2.gz ISSGMICMRKMOAX-ZWNOBZJWSA-N 0 3 420.888 4.478 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@H](C)C1NS(=O)(=O)Cc1ccc(C(F)F)cc1 ZINC000555320817 942475099 /nfs/dbraw/zinc/47/50/99/942475099.db2.gz WHHIPDWHZLMVDN-IRXDYDNUSA-N 0 3 422.541 4.200 20 0 HIADHN c1ncn(-c2ccc(CN(Cc3cccc(OCc4ccccn4)c3)C3CC3)cc2)n1 ZINC000555365483 942497034 /nfs/dbraw/zinc/49/70/34/942497034.db2.gz NAKYNXBSSGMSFG-UHFFFAOYSA-N 0 3 411.509 4.406 20 0 HIADHN CC(C)c1nnc(N2CCN(Cc3cccc4ccccc43)CC2)n1C[C@@H]1CCCO1 ZINC000555386170 942506525 /nfs/dbraw/zinc/50/65/25/942506525.db2.gz MNOIOTRLNWKSHZ-QFIPXVFZSA-N 0 3 419.573 4.056 20 0 HIADHN CC[C@H](C)c1nnc(N2CCN(Cc3ccccc3)[C@@H](CC)C2)n1C[C@H]1CCCO1 ZINC000555400933 942516709 /nfs/dbraw/zinc/51/67/09/942516709.db2.gz TZIVJQYJBRZZBO-ILWGZMRPSA-N 0 3 411.594 4.071 20 0 HIADHN O=C(NCCN1CCCC1)c1ccc(NCc2csc(-c3ccc(F)cc3)n2)cc1 ZINC000555506421 942609014 /nfs/dbraw/zinc/60/90/14/942609014.db2.gz QGTITAFOHFAZES-UHFFFAOYSA-N 0 3 424.545 4.387 20 0 HIADHN COc1cc(CN[C@@H]2CCC[C@@H]2F)ccc1OCC(=O)Nc1ccccc1Cl ZINC000555644685 942685280 /nfs/dbraw/zinc/68/52/80/942685280.db2.gz KFQMQNADGPYOGN-FUHWJXTLSA-N 0 3 406.885 4.346 20 0 HIADHN CCO[C@@H]1C[C@H](NCc2ccc(Br)cc2C(F)(F)F)[C@H]1n1cccn1 ZINC000555647445 942686137 /nfs/dbraw/zinc/68/61/37/942686137.db2.gz CCGVCJOTWIASDL-ARFHVFGLSA-N 0 3 418.257 4.173 20 0 HIADHN CCO[C@@H]1C[C@H](NCc2cc(Br)cc(C(F)(F)F)c2)[C@H]1n1cccn1 ZINC000555648453 942687210 /nfs/dbraw/zinc/68/72/10/942687210.db2.gz NDXNJDPOYRFWOI-ARFHVFGLSA-N 0 3 418.257 4.173 20 0 HIADHN O=C(NC1CC1)[C@@H](NC1(Cc2ccc(F)cc2Cl)CCOCC1)c1ccccc1 ZINC000555696410 942703566 /nfs/dbraw/zinc/70/35/66/942703566.db2.gz CPTMKNWYIAVXTA-NRFANRHFSA-N 0 3 416.924 4.180 20 0 HIADHN Clc1cccc(-n2cc(-c3noc([C@H]4CCCN(Cc5cccnc5)C4)n3)cn2)c1 ZINC000556007971 942784861 /nfs/dbraw/zinc/78/48/61/942784861.db2.gz GRGUAZTUKVONHU-KRWDZBQOSA-N 0 3 420.904 4.350 20 0 HIADHN CN1CC[C@H](NC(=O)C(C)(C)c2ccc(Br)cc2)[C@@H]1c1ccccc1 ZINC000556187550 942815963 /nfs/dbraw/zinc/81/59/63/942815963.db2.gz GECAFKDBJBVVAB-OALUTQOASA-N 0 3 401.348 4.288 20 0 HIADHN CNC(=O)COc1cccc(CNCc2ccc(Oc3cc(F)cc(F)c3)cc2)c1 ZINC000556223892 942821424 /nfs/dbraw/zinc/82/14/24/942821424.db2.gz PBHRDXRIXBPDET-UHFFFAOYSA-N 0 3 412.436 4.172 20 0 HIADHN NC(=O)[C@H](Cc1ccc(C(F)(F)F)cc1)NCc1ccc(OC2CCCC2)cc1 ZINC000556291790 942833993 /nfs/dbraw/zinc/83/39/93/942833993.db2.gz BELHPJKBXCAKEJ-FQEVSTJZSA-N 0 3 406.448 4.213 20 0 HIADHN CN(C(=O)c1ccc(NCc2ccc(OC(F)F)cc2)cc1)[C@H]1CCCN(C)C1 ZINC000556338575 942845150 /nfs/dbraw/zinc/84/51/50/942845150.db2.gz ADYOCYOSWCVDIJ-IBGZPJMESA-N 0 3 403.473 4.066 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)c1cc(F)cc2cccnc21 ZINC000556442985 942867919 /nfs/dbraw/zinc/86/79/19/942867919.db2.gz BRHLAANQWSIXRB-HXUWFJFHSA-N 0 3 415.472 4.270 20 0 HIADHN COC(=O)[C@H](Cc1ccccc1)[C@H](C)N[C@@H](C)C(=O)Nc1cccc(Cl)c1Cl ZINC000556522604 942891485 /nfs/dbraw/zinc/89/14/85/942891485.db2.gz KFHNOSVEMCUKOV-OFQRWUPVSA-N 0 3 423.340 4.330 20 0 HIADHN Cc1ccccc1C[C@H](NCc1csc(CNC(=O)c2ccccc2)n1)C1CC1 ZINC000556584931 942907364 /nfs/dbraw/zinc/90/73/64/942907364.db2.gz BAMLTBSGICRJFZ-QFIPXVFZSA-N 0 3 405.567 4.492 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)c2ccc(Cl)cc2Br)cc1 ZINC000556591108 942908184 /nfs/dbraw/zinc/90/81/84/942908184.db2.gz HEHWAZPHZDISDC-QGZVFWFLSA-N 0 3 411.727 4.144 20 0 HIADHN COc1c(N[C@H]2CCCN(Cc3ccccc3)C2)cc(Cl)cc1C(=O)N(C)C ZINC000556607159 942913250 /nfs/dbraw/zinc/91/32/50/942913250.db2.gz AFLLPXZGWSOJIX-SFHVURJKSA-N 0 3 401.938 4.127 20 0 HIADHN OC[C@H](CN[C@@H](c1ncc[nH]1)C1CCCCC1)Cc1ccccc1Br ZINC000556880102 942948830 /nfs/dbraw/zinc/94/88/30/942948830.db2.gz JFIIRURULOBPLG-HNAYVOBHSA-N 0 3 406.368 4.234 20 0 HIADHN O=C(N[C@H](c1ccccc1)[C@@H]1CCOC1)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000556951462 942978386 /nfs/dbraw/zinc/97/83/86/942978386.db2.gz PCLFIGJTHPLIOS-BHIFYINESA-N 0 3 414.496 4.038 20 0 HIADHN Cc1cccc(-c2nnc(-c3ccc(C(=O)N4[C@@H]5CC[C@H]4CCN(C)C5)cc3)o2)c1 ZINC000556965170 942981001 /nfs/dbraw/zinc/98/10/01/942981001.db2.gz SQFAKZPELWHDNL-LEWJYISDSA-N 0 3 402.498 4.021 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)C1c2ccccc2Oc2ccccc21 ZINC000557023500 942997110 /nfs/dbraw/zinc/99/71/10/942997110.db2.gz KFXQUWYHPNAIIA-IBGZPJMESA-N 0 3 400.478 4.130 20 0 HIADHN CCCN(C)[C@H](CNC(=O)c1ccc2c(c1)CCC(=O)N2C)c1ccc(Cl)cc1 ZINC000557058647 943007709 /nfs/dbraw/zinc/00/77/09/943007709.db2.gz GSQOGXLCQUUWMJ-OAQYLSRUSA-N 0 3 413.949 4.062 20 0 HIADHN CCCN(C)[C@H](CNC(=O)c1ncccc1Br)c1ccc(Cl)cc1 ZINC000557058643 943007781 /nfs/dbraw/zinc/00/77/81/943007781.db2.gz GNIXTNDPPABAAK-MRXNPFEDSA-N 0 3 410.743 4.310 20 0 HIADHN Cc1cc(Br)c(NC(=O)CN(C)[C@@H](C)C2CC2)c(Br)c1 ZINC000557218209 943054189 /nfs/dbraw/zinc/05/41/89/943054189.db2.gz YNQVUHJIXIUMLE-JTQLQIEISA-N 0 3 404.146 4.189 20 0 HIADHN O=C(COc1ccccc1)N(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000557447690 943132305 /nfs/dbraw/zinc/13/23/05/943132305.db2.gz CNDNWZNCIJFYLI-XMMPIXPASA-N 0 3 415.537 4.154 20 0 HIADHN COCCC[C@@H](C)C(=O)N(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000557449270 943133984 /nfs/dbraw/zinc/13/39/84/943133984.db2.gz SKKHIWVBFFMLHB-ZJSXRUAMSA-N 0 3 409.574 4.138 20 0 HIADHN Cc1ccc(CN2CC[C@@H](CN(C)C(=O)CCC(=O)c3ccc(F)cc3)C2)s1 ZINC000557497194 943168828 /nfs/dbraw/zinc/16/88/28/943168828.db2.gz ZNGBQQHNLBEDSU-KRWDZBQOSA-N 0 3 402.535 4.139 20 0 HIADHN COc1ccccc1NC(=O)CN[C@@H](Cc1ccc(OC)c(OC)c1)c1ccccc1 ZINC000557502058 943171945 /nfs/dbraw/zinc/17/19/45/943171945.db2.gz RDWIRHDRFLAMQA-NRFANRHFSA-N 0 3 420.509 4.225 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)Nc1cccc(-c2noc(C3CC3)n2)c1 ZINC000557506646 943174962 /nfs/dbraw/zinc/17/49/62/943174962.db2.gz QYVCONNXGOTJMD-MRXNPFEDSA-N 0 3 405.502 4.256 20 0 HIADHN COCCOc1ccc(C(F)(F)F)cc1NC(=O)[C@H](C)N[C@H](C)c1ccccc1 ZINC000557521741 943187831 /nfs/dbraw/zinc/18/78/31/943187831.db2.gz LPZXYYOTKYENOP-CABCVRRESA-N 0 3 410.436 4.408 20 0 HIADHN NS(=O)(=O)c1ccc2c(c1)[C@H](N[C@@H](c1ccc(F)cc1)C1CCCC1)CCC2 ZINC000557531383 943193327 /nfs/dbraw/zinc/19/33/27/943193327.db2.gz XKZWSTOOFUTZJV-FGZHOGPDSA-N 0 3 402.535 4.372 20 0 HIADHN COc1ccccc1-c1ccc(CN(Cc2cc(=O)n3nccc3[nH]2)C(C)C)cc1 ZINC000557548544 943203508 /nfs/dbraw/zinc/20/35/08/943203508.db2.gz LLHMSXOXBKNJGJ-UHFFFAOYSA-N 0 3 402.498 4.109 20 0 HIADHN COc1ccc(CN(C)C(=O)CN[C@H](C)c2ccc(-c3ccncc3)cc2)cc1OC ZINC000557560493 943208790 /nfs/dbraw/zinc/20/87/90/943208790.db2.gz SJYZIDLMVUQYKR-GOSISDBHSA-N 0 3 419.525 4.075 20 0 HIADHN C[C@@H]1C[C@H]1C(=O)Nc1ccc(F)cc1C(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1 ZINC000557561193 943209532 /nfs/dbraw/zinc/20/95/32/943209532.db2.gz GTFRXUCDBYGVBN-LVCYWYKZSA-N 0 3 423.532 4.157 20 0 HIADHN C[C@@H]1C[C@H]1C(=O)Nc1ccc(F)cc1C(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC000557561192 943209975 /nfs/dbraw/zinc/20/99/75/943209975.db2.gz GTFRXUCDBYGVBN-DBXWQHBBSA-N 0 3 423.532 4.157 20 0 HIADHN Cc1nc(COc2ccc(Cl)cc2)sc1C(=O)N1C[C@@H](N2CCCC2)C[C@@H]1C ZINC000557599705 943226171 /nfs/dbraw/zinc/22/61/71/943226171.db2.gz HZZCRTHLRZVZRN-YOEHRIQHSA-N 0 3 419.978 4.383 20 0 HIADHN CC(C)CN(C)c1ccc(C(=O)N2CCC[C@H](c3n[nH]cc3CN3CCCC3)C2)cc1 ZINC000557648215 943247978 /nfs/dbraw/zinc/24/79/78/943247978.db2.gz YVZOVTVIWCUKQR-NRFANRHFSA-N 0 3 423.605 4.118 20 0 HIADHN Clc1ccc2nc(CN[C@H]3CCN(c4cccc(Br)c4)C3)cn2c1 ZINC000557678956 943256914 /nfs/dbraw/zinc/25/69/14/943256914.db2.gz AZNLMHXNHHCTDI-HNNXBMFYSA-N 0 3 405.727 4.119 20 0 HIADHN CC[C@@H](C)N[C@@H](CNc1cc(C(F)(F)F)nc(-c2ccncc2)n1)c1ccco1 ZINC000557695094 943261397 /nfs/dbraw/zinc/26/13/97/943261397.db2.gz SUMKJDYAJPJRGI-HIFRSBDPSA-N 0 3 405.424 4.114 20 0 HIADHN C[C@@H]1C[C@H]1[C@@H](NCC(=O)Nc1cccc(C(=O)NC2CC2)c1)c1ccc(Cl)cc1 ZINC000557710285 943264629 /nfs/dbraw/zinc/26/46/29/943264629.db2.gz UIKKZEWEZMGHID-ZFGLAFRWSA-N 0 3 411.933 4.158 20 0 HIADHN C[C@H](NC(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1)c1ccc2n[nH]cc2c1 ZINC000557720186 943268245 /nfs/dbraw/zinc/26/82/45/943268245.db2.gz ODMFXASQXIVHSE-BTYIYWSLSA-N 0 3 416.447 4.195 20 0 HIADHN CC1CCN([C@@H](CNC(=O)N2CCC=C(c3ccncc3)C2)c2cccs2)CC1 ZINC000557751510 943279162 /nfs/dbraw/zinc/27/91/62/943279162.db2.gz RQYBKZMBNPJDKW-NRFANRHFSA-N 0 3 410.587 4.415 20 0 HIADHN CC[C@@H](NCc1ccc(Cn2cncn2)cc1)c1cc(F)cc(Br)c1 ZINC000557768265 943286014 /nfs/dbraw/zinc/28/60/14/943286014.db2.gz ISQZVUIGHRJZCU-LJQANCHMSA-N 0 3 403.299 4.469 20 0 HIADHN CC[C@@H](NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1)c1ccc(OC)c(OC)c1 ZINC000557800957 943295647 /nfs/dbraw/zinc/29/56/47/943295647.db2.gz CTTDHFDPUFFBME-LEWJYISDSA-N 0 3 411.546 4.119 20 0 HIADHN C[C@H]1[C@@H](NC(=O)N2CCC(c3ncccc3Cl)CC2)CCN1Cc1ccccc1 ZINC000557880330 943318801 /nfs/dbraw/zinc/31/88/01/943318801.db2.gz CRGCHKOCBGUDDM-UWJYYQICSA-N 0 3 412.965 4.287 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)[C@@H](C)Oc1cccc(Br)c1)c1ccco1 ZINC000557911282 943326584 /nfs/dbraw/zinc/32/65/84/943326584.db2.gz DNPIBHQGDWEIPE-VBQJREDUSA-N 0 3 409.324 4.055 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)c1sc(C)c(Br)c1OC)c1ccco1 ZINC000557911273 943326783 /nfs/dbraw/zinc/32/67/83/943326783.db2.gz DHCKKLVQKMGUBH-JQWIXIFHSA-N 0 3 415.353 4.280 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)[C@H](C)Oc1cccc(Br)c1)c1ccco1 ZINC000557911283 943326820 /nfs/dbraw/zinc/32/68/20/943326820.db2.gz DNPIBHQGDWEIPE-ZQIUZPCESA-N 0 3 409.324 4.055 20 0 HIADHN CN(C)C[C@@H](NC(=O)c1cccc(C(=O)Nc2ccccc2)c1)c1ccc(F)cc1 ZINC000557924200 943330364 /nfs/dbraw/zinc/33/03/64/943330364.db2.gz PBAYYKBQRIYUHA-JOCHJYFZSA-N 0 3 405.473 4.111 20 0 HIADHN CN(C)C[C@@H](NC(=O)c1cccc(NC(=O)c2ccc(F)cc2)c1)c1ccc(F)cc1 ZINC000557955848 943339579 /nfs/dbraw/zinc/33/95/79/943339579.db2.gz QYIYDZHIZAQREN-JOCHJYFZSA-N 0 3 423.463 4.250 20 0 HIADHN COc1cc(C(=O)N2CCN([C@@H]3C[C@@H]3C)C[C@@H](C)C2)cc(Cl)c1OCC(C)C ZINC000558026433 943359413 /nfs/dbraw/zinc/35/94/13/943359413.db2.gz RCJGQEUFTDNMES-JTDSTZFVSA-N 0 3 408.970 4.186 20 0 HIADHN COc1cc(C(=O)N2CCN([C@@H]3C[C@H]3C)C[C@H](C)C2)cc(Cl)c1OCC(C)C ZINC000558026428 943359794 /nfs/dbraw/zinc/35/97/94/943359794.db2.gz RCJGQEUFTDNMES-FRQCXROJSA-N 0 3 408.970 4.186 20 0 HIADHN COCCCNC(=O)C1CCN(Cc2cccc(SCc3ccccc3)c2)CC1 ZINC000558082281 943376241 /nfs/dbraw/zinc/37/62/41/943376241.db2.gz GZIPUPLTOKDECX-UHFFFAOYSA-N 0 3 412.599 4.344 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)N(C)CCc1ncc(C)s1)c1ccc(Cl)cc1 ZINC000558106335 943381114 /nfs/dbraw/zinc/38/11/14/943381114.db2.gz BNHNJHATSRFGOY-SFHVURJKSA-N 0 3 408.999 4.372 20 0 HIADHN Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)N[C@@H](Cc1ccc(F)cc1)C(N)=O ZINC000558122686 943386485 /nfs/dbraw/zinc/38/64/85/943386485.db2.gz QTDUVBQWAGYZBD-XIKOKIGWSA-N 0 3 401.482 4.144 20 0 HIADHN OC[C@H]1C=C[C@@H](N(Cc2cccs2)C[C@H](O)Cc2ccccc2C(F)(F)F)C1 ZINC000558139035 943394245 /nfs/dbraw/zinc/39/42/45/943394245.db2.gz LAIYNBNQCUPAQU-CGTJXYLNSA-N 0 3 411.489 4.110 20 0 HIADHN CC(C)n1cnnc1-c1ccccc1NC(=O)N[C@H]1CCN(Cc2ccccc2)[C@@H]1C ZINC000558199441 943428738 /nfs/dbraw/zinc/42/87/38/943428738.db2.gz CXIXUSNDXJEXGE-NQIIRXRSSA-N 0 3 418.545 4.311 20 0 HIADHN CCN1CCN(Cc2ccccc2CN[C@H](COC)c2cccc(Cl)c2F)CC1 ZINC000558225898 943445099 /nfs/dbraw/zinc/44/50/99/943445099.db2.gz KYJJSYXEKFVQQP-JOCHJYFZSA-N 0 3 419.972 4.094 20 0 HIADHN FC(F)(F)[C@H]1C[C@H](NCc2ccc(Cl)cc2I)CCO1 ZINC000558254171 943460657 /nfs/dbraw/zinc/46/06/57/943460657.db2.gz AVGJBWABBWIDRF-ZYHUDNBSSA-N 0 3 419.612 4.144 20 0 HIADHN CC(C)Cc1ccc([C@H](CNC(=O)Nc2cccc(C(=O)N(C)C)c2)N(C)C)cc1 ZINC000558276746 943477487 /nfs/dbraw/zinc/47/74/87/943477487.db2.gz FHTUSKYGAREJMW-QFIPXVFZSA-N 0 3 410.562 4.011 20 0 HIADHN Cc1cc(C)n(-c2ccc(NC(=O)N[C@@H](CN(C)C)c3ccc(F)cc3)cc2F)n1 ZINC000558298813 943491657 /nfs/dbraw/zinc/49/16/57/943491657.db2.gz SRAMGEDEEJVYBB-FQEVSTJZSA-N 0 3 413.472 4.192 20 0 HIADHN CC(=O)Nc1ccc(C)c(NC(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)c1 ZINC000558311224 943498595 /nfs/dbraw/zinc/49/85/95/943498595.db2.gz KBPYZNKOKQXVTE-JOCHJYFZSA-N 0 3 412.534 4.165 20 0 HIADHN Cc1ccc(NC(=O)C(C)C)cc1NC(=O)N[C@@H](CN(C)C)c1ccc(F)cc1 ZINC000558312253 943499347 /nfs/dbraw/zinc/49/93/47/943499347.db2.gz UMIRZRVLXRKLID-FQEVSTJZSA-N 0 3 400.498 4.153 20 0 HIADHN COC(=O)COc1ccccc1[C@H](C)N[C@@H]1CCc2c1cccc2Br ZINC000558342685 943518195 /nfs/dbraw/zinc/51/81/95/943518195.db2.gz QULHEXXUXCEWQQ-SCLBCKFNSA-N 0 3 404.304 4.339 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)Nc1ccc(F)cc1-c1nc(C2CC2)no1 ZINC000558349398 943521468 /nfs/dbraw/zinc/52/14/68/943521468.db2.gz PVJONQCIBMQWSJ-UHFFFAOYSA-N 0 3 415.513 4.483 20 0 HIADHN CCCN(C)[C@H](CNC(=O)Nc1cnn(CC(F)(F)F)c1)c1ccc(Cl)cc1 ZINC000558377231 943533622 /nfs/dbraw/zinc/53/36/22/943533622.db2.gz LLKACIYYBNVMOS-MRXNPFEDSA-N 0 3 417.863 4.303 20 0 HIADHN CC(=O)N(Cc1ccc(NC(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)cc1)C1CC1 ZINC000558389923 943541624 /nfs/dbraw/zinc/54/16/24/943541624.db2.gz CICSNCKAIQKBJT-GAJHUEQPSA-N 0 3 408.546 4.010 20 0 HIADHN COC(=O)c1cccc(NC2CCN(Cc3c[nH]nc3-c3cccc(C)c3)CC2)c1 ZINC000558417840 943553476 /nfs/dbraw/zinc/55/34/76/943553476.db2.gz INNVHJCXFOXCAA-UHFFFAOYSA-N 0 3 404.514 4.248 20 0 HIADHN O=C(Nc1nncs1)C1CCN(Cc2ccc(-c3ccccc3Cl)o2)CC1 ZINC000558416155 943553857 /nfs/dbraw/zinc/55/38/57/943553857.db2.gz KOHGOOBXJXUGGV-UHFFFAOYSA-N 0 3 402.907 4.302 20 0 HIADHN COC(=O)c1ccc(CNCc2ccc(OCc3cn4cccc(C)c4n3)cc2)cc1 ZINC000558418720 943554412 /nfs/dbraw/zinc/55/44/12/943554412.db2.gz FGNACIVGRUXJMH-UHFFFAOYSA-N 0 3 415.493 4.298 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)N[C@H]1c2ccccc2CC12CCOCC2 ZINC000558606394 943616148 /nfs/dbraw/zinc/61/61/48/943616148.db2.gz FHKZMGFZKJNGOA-RPWUZVMVSA-N 0 3 419.569 4.217 20 0 HIADHN C[C@@H](c1nnc(-c2ccccc2F)s1)N1CCC(CCCN2CCOCC2)CC1 ZINC000558722286 943632888 /nfs/dbraw/zinc/63/28/88/943632888.db2.gz ASRSEGADLFGGOX-KRWDZBQOSA-N 0 3 418.582 4.230 20 0 HIADHN C[C@@H](c1cccc(NC(=O)c2ccccc2)c1)N1CCC[C@H](c2nc(N(C)C)no2)C1 ZINC000558743643 943638053 /nfs/dbraw/zinc/63/80/53/943638053.db2.gz VYFBNXJCULVEMY-PXNSSMCTSA-N 0 3 419.529 4.329 20 0 HIADHN CC(C)OCc1ccccc1CNC(=O)N[C@@H](CN(C)C)c1ccc(Cl)cc1 ZINC000558894874 943726849 /nfs/dbraw/zinc/72/68/49/943726849.db2.gz DYHQQEUEFZVYNO-NRFANRHFSA-N 0 3 403.954 4.367 20 0 HIADHN CC(C)N1CC[C@H](NCC(=O)N(C2CC2)C2CCCC2)[C@@H]1c1ccc(F)c(F)c1 ZINC000558895645 943728672 /nfs/dbraw/zinc/72/86/72/943728672.db2.gz KRHHXHUKXACIDY-GMAHTHKFSA-N 0 3 405.533 4.012 20 0 HIADHN CCN1CC[C@H](N[C@@H](C)c2cc(C)c(C(=O)OC)o2)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000558897420 943732754 /nfs/dbraw/zinc/73/27/54/943732754.db2.gz PTLORBUYMNGRAE-UVIMBBFXSA-N 0 3 410.436 4.278 20 0 HIADHN COc1ccc([C@H](OC)[C@H](C)NC(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)cc1 ZINC000558908460 943740837 /nfs/dbraw/zinc/74/08/37/943740837.db2.gz SXZLXUFFDSKESB-ONGXBYRLSA-N 0 3 419.953 4.027 20 0 HIADHN c1[nH]c2ccccc2c1-c1nnc(N2CCN(CC3CC3)CC2)n1Cc1ccccc1 ZINC000558912575 943743572 /nfs/dbraw/zinc/74/35/72/943743572.db2.gz HJZSORXQRMBWBE-UHFFFAOYSA-N 0 3 412.541 4.007 20 0 HIADHN CC(=O)CCc1ccc(O[C@H](C)C(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)cc1 ZINC000558973578 943777242 /nfs/dbraw/zinc/77/72/42/943777242.db2.gz QRFDZUSJFPHTDX-VGSWGCGISA-N 0 3 416.949 4.048 20 0 HIADHN COc1ccc(CCCC(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)c(OC)c1 ZINC000558972562 943777388 /nfs/dbraw/zinc/77/73/88/943777388.db2.gz BSSDHFMABAYSSQ-FQEVSTJZSA-N 0 3 404.938 4.099 20 0 HIADHN C[C@H](NCc1nnc(-c2cccc(Cl)c2)o1)C1CCN(CC(F)(F)F)CC1 ZINC000559233168 943882173 /nfs/dbraw/zinc/88/21/73/943882173.db2.gz XRANZKMMGMSLLW-LBPRGKRZSA-N 0 3 402.848 4.142 20 0 HIADHN Cn1c(CNCCc2cc(C(F)(F)F)ccn2)nc2cc(C(F)(F)F)ccc21 ZINC000559329670 943897151 /nfs/dbraw/zinc/89/71/51/943897151.db2.gz FCVMNQSZKVVJKZ-UHFFFAOYSA-N 0 3 402.342 4.338 20 0 HIADHN COc1ccc(OCc2ccccn2)c(CNCCc2cc(C(F)(F)F)ccn2)c1 ZINC000559331671 943897974 /nfs/dbraw/zinc/89/79/74/943897974.db2.gz UAGRXRNVJXRTCA-UHFFFAOYSA-N 0 3 417.431 4.415 20 0 HIADHN Cc1ccc(Br)c(C)c1C(=O)N1CCC(CN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000559449283 943957464 /nfs/dbraw/zinc/95/74/64/943957464.db2.gz QGMHMKZPLHKBGG-HOTGVXAUSA-N 0 3 423.395 4.027 20 0 HIADHN C[C@@H](Cc1cccc(O)c1)NC(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1 ZINC000559547657 944001546 /nfs/dbraw/zinc/00/15/46/944001546.db2.gz PNLCFNSXHCWCIT-INIZCTEOSA-N 0 3 423.479 4.115 20 0 HIADHN Cc1cc(C(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)c2nccc(C)c2c1 ZINC000559555985 944003103 /nfs/dbraw/zinc/00/31/03/944003103.db2.gz PUQJLPVFBJTHBT-BGYRXZFFSA-N 0 3 409.574 4.203 20 0 HIADHN Brc1cc2c(s1)CC[C@H]2NCc1cccc(CN2CCOCC2)c1 ZINC000559739563 944041308 /nfs/dbraw/zinc/04/13/08/944041308.db2.gz KSDZXINPUFIYEH-QGZVFWFLSA-N 0 3 407.377 4.120 20 0 HIADHN O[C@H](CNCc1cc(F)cc(Br)c1)CO[C@@H]1CCCc2ccccc21 ZINC000559739300 944041984 /nfs/dbraw/zinc/04/19/84/944041984.db2.gz DOVGRWANXANCIL-UYAOXDASSA-N 0 3 408.311 4.133 20 0 HIADHN C[C@H](N[C@@H]1CCCN([C@@H](C)c2ccccc2F)C1=O)c1ccc(-n2ccnc2)cc1 ZINC000559878520 944072982 /nfs/dbraw/zinc/07/29/82/944072982.db2.gz PIGUNDXDZYGYJF-IUKKYPGJSA-N 0 3 406.505 4.414 20 0 HIADHN C[C@H](N[C@H]1CCCN([C@@H](C)c2ccccc2F)C1=O)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000559878657 944073212 /nfs/dbraw/zinc/07/32/12/944073212.db2.gz NAADDFAOPIBJFR-WCJKSRRJSA-N 0 3 423.532 4.458 20 0 HIADHN COCCOc1ccc([C@H](C)N[C@H]2CCCN([C@@H](C)c3ccc(F)cc3)C2=O)cc1 ZINC000559899151 944080044 /nfs/dbraw/zinc/08/00/44/944080044.db2.gz KSWDFZAZPJNAKL-BSRJHKFKSA-N 0 3 414.521 4.254 20 0 HIADHN C[C@H](NCCCS(=O)(=O)c1ccc(Cl)cc1)c1ccccc1OC(F)F ZINC000559918093 944084806 /nfs/dbraw/zinc/08/48/06/944084806.db2.gz RQCRVJAOYOLEBA-ZDUSSCGKSA-N 0 3 403.878 4.456 20 0 HIADHN COc1ccc2oc(CNc3ccc(C(=O)N(C)[C@H]4CCCN(C)C4)cc3)cc2c1 ZINC000559996692 944118979 /nfs/dbraw/zinc/11/89/79/944118979.db2.gz OSTFJBYEENFVDR-FQEVSTJZSA-N 0 3 407.514 4.220 20 0 HIADHN CN(C)CCN(Cc1cccc(O)c1)C(=O)c1cc2c(s1)-c1ccccc1OC2 ZINC000560172874 944186329 /nfs/dbraw/zinc/18/63/29/944186329.db2.gz XHAVXGOCRJENOO-UHFFFAOYSA-N 0 3 408.523 4.217 20 0 HIADHN Cc1n[nH]cc1C1CCN(C[C@H](O)COc2ccc(Oc3ccccc3)cc2)CC1 ZINC000560184219 944190590 /nfs/dbraw/zinc/19/05/90/944190590.db2.gz OQNITVYTJBZUHC-FQEVSTJZSA-N 0 3 407.514 4.130 20 0 HIADHN Cc1ccccc1CNC(=O)CN[C@@H](c1cccc(C(F)(F)F)c1)C1CCOCC1 ZINC000560205803 944195835 /nfs/dbraw/zinc/19/58/35/944195835.db2.gz JARWDNVWYYAVJO-JOCHJYFZSA-N 0 3 420.475 4.388 20 0 HIADHN CC(C)Oc1ccc([C@H](C)NCc2ccc(S(=O)(=O)N(C)C)cc2)cc1Cl ZINC000560243597 944205716 /nfs/dbraw/zinc/20/57/16/944205716.db2.gz MXULKUDZQCDURJ-HNNXBMFYSA-N 0 3 410.967 4.228 20 0 HIADHN CC(C)([C@@H](NC(=O)[C@@H]1CCc2cccc(O)c21)c1ccc(F)c(F)c1)N1CCCC1 ZINC000560366999 944228257 /nfs/dbraw/zinc/22/82/57/944228257.db2.gz YRKXYQCBXRFQGG-VGSWGCGISA-N 0 3 414.496 4.432 20 0 HIADHN COc1ccc([C@@H](C)N[C@H](C)c2cc(F)ccc2N2CCN(C)CC2)c(C)c1OC ZINC000560528593 944243646 /nfs/dbraw/zinc/24/36/46/944243646.db2.gz JEEAAROPGJRKMS-QZTJIDSGSA-N 0 3 415.553 4.315 20 0 HIADHN COc1ccc([C@H](C)N[C@H](C)c2cc(F)ccc2N2CCN(C)CC2)c(C)c1OC ZINC000560528595 944243957 /nfs/dbraw/zinc/24/39/57/944243957.db2.gz JEEAAROPGJRKMS-ZWKOTPCHSA-N 0 3 415.553 4.315 20 0 HIADHN Cc1cccc(CCCN[C@H](c2ccc(F)cc2)c2cccc(S(C)(=O)=O)c2)n1 ZINC000560569348 944257206 /nfs/dbraw/zinc/25/72/06/944257206.db2.gz CSFAPAYJGCCANB-HSZRJFAPSA-N 0 3 412.530 4.244 20 0 HIADHN CNS(=O)(=O)c1cccc([C@@H](C)NC[C@H](OCC2CC2)c2ccc(Cl)cc2)c1 ZINC000560570532 944257669 /nfs/dbraw/zinc/25/76/69/944257669.db2.gz RIKFMWWPVHZAGA-VFNWGFHPSA-N 0 3 422.978 4.067 20 0 HIADHN Cc1c([C@H](C)N[C@H]2CCCN(C(=O)N3CCCC3)C2)cnn1-c1cccc(Cl)c1 ZINC000560573066 944259428 /nfs/dbraw/zinc/25/94/28/944259428.db2.gz DHWGPCXLOIHLIN-LPHOPBHVSA-N 0 3 415.969 4.165 20 0 HIADHN CSC[C@H](NCCn1cc(Br)cn1)c1ccc(C(F)(F)F)cc1 ZINC000560579587 944262054 /nfs/dbraw/zinc/26/20/54/944262054.db2.gz CFOGURLAXMLMFK-AWEZNQCLSA-N 0 3 408.287 4.358 20 0 HIADHN O=C(N[C@@H]1CCO[C@H](c2ccccc2)C1)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000560632495 944281316 /nfs/dbraw/zinc/28/13/16/944281316.db2.gz NRFBQDHNSUCZMX-FSSWDIPSSA-N 0 3 414.496 4.180 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)Cc1ccc(NC(C)=O)cc1)c1ccc(Cl)cc1 ZINC000560709239 944303918 /nfs/dbraw/zinc/30/39/18/944303918.db2.gz TYEKXUVEEXZYNZ-NRFANRHFSA-N 0 3 401.938 4.040 20 0 HIADHN COc1ccc(C[C@H](NCC(=O)N(C)Cc2cccs2)c2ccc(OC)cc2)cc1 ZINC000560839438 944352682 /nfs/dbraw/zinc/35/26/82/944352682.db2.gz CFNQIXFKHKUSRZ-QHCPKHFHSA-N 0 3 424.566 4.297 20 0 HIADHN COc1ccc([C@H](CNC(=O)CCc2ccc3ccccc3n2)N2CCCC2)cc1 ZINC000560863342 944361228 /nfs/dbraw/zinc/36/12/28/944361228.db2.gz HZJGXTUNPKFSFG-DEOSSOPVSA-N 0 3 403.526 4.129 20 0 HIADHN C[C@H](N[C@H](CO)Cc1ccc(F)cc1)c1ccc(OC(F)F)cc1OC(F)F ZINC000560908975 944368754 /nfs/dbraw/zinc/36/87/54/944368754.db2.gz MQFSXAOPNZVDKG-FZMZJTMJSA-N 0 3 405.363 4.283 20 0 HIADHN O=S(=O)(Cc1ccccc1CN[C@H]1CCc2ccc(Cl)cc21)N1CCCC1 ZINC000560908857 944368800 /nfs/dbraw/zinc/36/88/00/944368800.db2.gz KVJNASRNYGYULR-NRFANRHFSA-N 0 3 404.963 4.043 20 0 HIADHN COc1ccc(Br)cc1CNCc1ccc(C)cc1-c1ccnn1C ZINC000560984947 944385720 /nfs/dbraw/zinc/38/57/20/944385720.db2.gz SHSULRMZWAZKEE-UHFFFAOYSA-N 0 3 400.320 4.456 20 0 HIADHN O=C(CC[C@@H]1CCCO1)N(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000561075661 944430777 /nfs/dbraw/zinc/43/07/77/944430777.db2.gz UEVBANLXWWGQIS-RPWUZVMVSA-N 0 3 407.558 4.034 20 0 HIADHN CC(C)OCCCC(=O)N(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000561075284 944430930 /nfs/dbraw/zinc/43/09/30/944430930.db2.gz RBODLRBZHQAGNE-DEOSSOPVSA-N 0 3 409.574 4.280 20 0 HIADHN C[C@@H](C(=O)N(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1)C1CCOCC1 ZINC000561077322 944432524 /nfs/dbraw/zinc/43/25/24/944432524.db2.gz SSPMOCXZGTWGFH-PXDATVDWSA-N 0 3 421.585 4.138 20 0 HIADHN C[C@H](C(=O)N(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1)C1CCOCC1 ZINC000561077319 944432617 /nfs/dbraw/zinc/43/26/17/944432617.db2.gz SSPMOCXZGTWGFH-OFVILXPXSA-N 0 3 421.585 4.138 20 0 HIADHN CC(C)(C)N1C[C@@H](C(=O)Nc2nc(-c3cccc(O)c3)cs2)[C@H](C(F)(F)F)C1 ZINC000561257807 944530284 /nfs/dbraw/zinc/53/02/84/944530284.db2.gz ISMYYUIJKYHUDA-ZIAGYGMSSA-N 0 3 413.465 4.363 20 0 HIADHN O=C(c1cc(F)ccc1-c1ccoc1)N1CCC[C@H](c2n[nH]cc2CN2CCCC2)C1 ZINC000561285284 944540393 /nfs/dbraw/zinc/54/03/93/944540393.db2.gz GBHHTXQSYYQAHD-KRWDZBQOSA-N 0 3 422.504 4.424 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Cc1c(C)nn(-c2ccc(F)cc2)c1C)c1ccco1 ZINC000561370780 944564588 /nfs/dbraw/zinc/56/45/88/944564588.db2.gz ZGLDPBKEVUQRFX-YCRPNKLZSA-N 0 3 412.509 4.009 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2[nH]c3ccccc3c2Br)N(C)C)cc1 ZINC000561377704 944568080 /nfs/dbraw/zinc/56/80/80/944568080.db2.gz AYCDDRSSJKVUPH-QGZVFWFLSA-N 0 3 400.320 4.272 20 0 HIADHN COc1ccc(OC)c([C@H](C)NC(=O)[C@H](C)N2C[C@H](c3ccc(F)cc3)C[C@@H]2C)c1 ZINC000561391292 944574633 /nfs/dbraw/zinc/57/46/33/944574633.db2.gz AQPUMWVHQOMUSD-LSTDLKDCSA-N 0 3 414.521 4.287 20 0 HIADHN COc1ccc(OC)c([C@H](C)NC(=O)[C@H](C)N2C[C@@H](c3ccc(F)cc3)C[C@@H]2C)c1 ZINC000561391291 944574737 /nfs/dbraw/zinc/57/47/37/944574737.db2.gz AQPUMWVHQOMUSD-DWRORGKVSA-N 0 3 414.521 4.287 20 0 HIADHN C[C@H](NC(=O)NC[C@H](c1cccs1)N1CCC(C)CC1)c1c(F)cncc1F ZINC000561434802 944596058 /nfs/dbraw/zinc/59/60/58/944596058.db2.gz MUNTYRKVHDQRJP-WMLDXEAASA-N 0 3 408.518 4.255 20 0 HIADHN C[C@@H]1CN(C(=O)CSCc2ccc(Br)cc2)CCN(C2CCC2)C1 ZINC000561532633 944659070 /nfs/dbraw/zinc/65/90/70/944659070.db2.gz ZUZBBGISHFMGBD-HNNXBMFYSA-N 0 3 411.409 4.015 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)C(=O)Nc1cncc2ccccc21)c1ccc(Cl)cc1 ZINC000561536219 944660769 /nfs/dbraw/zinc/66/07/69/944660769.db2.gz KFIVNCIXXBWWHH-NRFANRHFSA-N 0 3 424.932 4.026 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)CSc1ncnc2sc(C)c(C)c21)c1ccco1 ZINC000561610312 944705656 /nfs/dbraw/zinc/70/56/56/944705656.db2.gz KLSWZPPGSUMBPM-DOMZBBRYSA-N 0 3 418.588 4.239 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)c1cc2cc(Br)ccc2[nH]1)c1ccco1 ZINC000561609549 944705679 /nfs/dbraw/zinc/70/56/79/944705679.db2.gz BXBPTIDOKUEVJK-SJCJKPOMSA-N 0 3 404.308 4.383 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)[C@@H]2C[C@@H]2c2cc(F)c(F)c(F)c2)N(C)C)cc1 ZINC000561650630 944728844 /nfs/dbraw/zinc/72/88/44/944728844.db2.gz JNXKCVSBDVRYLV-OPYAIIAOSA-N 0 3 420.475 4.414 20 0 HIADHN CCO[C@@H](C)c1ncc(C(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)s1 ZINC000561651584 944728978 /nfs/dbraw/zinc/72/89/78/944728978.db2.gz KTPDCBRRQQNDFF-YJBOKZPZSA-N 0 3 405.564 4.061 20 0 HIADHN O=C(NC[C@]1(O)CN2CCC1CC2)c1sc2cc(Cl)cc(Cl)c2c1Cl ZINC000561693269 944749001 /nfs/dbraw/zinc/74/90/01/944749001.db2.gz XBVLXTWLPKWIGK-KRWDZBQOSA-N 0 3 419.761 4.048 20 0 HIADHN C[C@@H]1C[C@@H]1N1CCN(C(=O)c2occc2CN2c3ccccc3C[C@@H]2C)C[C@@H](C)C1 ZINC000561765953 944786398 /nfs/dbraw/zinc/78/63/98/944786398.db2.gz XUZOONLESOIWOG-YWNPBTLJSA-N 0 3 407.558 4.033 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccnc2)C1)N1CC[C@H](Sc2cccc(Cl)c2)C1 ZINC000561888117 944838587 /nfs/dbraw/zinc/83/85/87/944838587.db2.gz ORUXIALLVJPLBL-NQIIRXRSSA-N 0 3 415.990 4.340 20 0 HIADHN C[C@@H](C(=O)N1CCC(F)(c2ccccn2)CC1)N1CCC(Cc2ccccc2)CC1 ZINC000561957091 944875480 /nfs/dbraw/zinc/87/54/80/944875480.db2.gz ODDFHOVCIAMVJE-FQEVSTJZSA-N 0 3 409.549 4.212 20 0 HIADHN CC[C@@H]1CN(C(=O)Nc2ccccc2CN(C)C2CCCCC2)C[C@@H](C)[S@]1=O ZINC000562018645 944896965 /nfs/dbraw/zinc/89/69/65/944896965.db2.gz CCSDXSJKFVEMNR-ROERJRBBSA-N 0 3 405.608 4.214 20 0 HIADHN C[C@H](N[C@H]1CCCN(c2ccn(C)n2)C1=O)c1ccc(-c2c(F)cccc2F)cc1 ZINC000562089246 944932382 /nfs/dbraw/zinc/93/23/82/944932382.db2.gz RWICRZPATKYKNF-YWZLYKJASA-N 0 3 410.468 4.212 20 0 HIADHN COC(=O)c1c(F)ccc(NC(=O)N(Cc2ccccc2)C2CCN(C)CC2)c1C ZINC000562104603 944941633 /nfs/dbraw/zinc/94/16/33/944941633.db2.gz XDFCAQYFYSWGRJ-UHFFFAOYSA-N 0 3 413.493 4.049 20 0 HIADHN CCCNC(=O)c1ccc(NC(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)cc1Cl ZINC000562140006 944968253 /nfs/dbraw/zinc/96/82/53/944968253.db2.gz OJBFBUMNOLKYFT-MGPUTAFESA-N 0 3 416.953 4.293 20 0 HIADHN C[C@@H](NC(=O)Nc1ccc(CCN2CCSCC2)cc1)c1ccc2n[nH]cc2c1 ZINC000562141540 944969615 /nfs/dbraw/zinc/96/96/15/944969615.db2.gz ABHJSBQNOIRGJL-MRXNPFEDSA-N 0 3 409.559 4.037 20 0 HIADHN O=C(c1cccc(Cn2ccnc2)c1)N1CCC[C@@H](c2n[nH]c(C3CCCCC3)n2)C1 ZINC000562175421 945002683 /nfs/dbraw/zinc/00/26/83/945002683.db2.gz ZNGPYWOJRWLFOZ-OAQYLSRUSA-N 0 3 418.545 4.117 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)CCCn1c(C)cc(=O)cc1C)c1ccc(Cl)cc1 ZINC000562177628 945004237 /nfs/dbraw/zinc/00/42/37/945004237.db2.gz ZIIFCWKWXPDRHH-QFIPXVFZSA-N 0 3 417.981 4.098 20 0 HIADHN COc1ccc(NC(=O)N[C@H](CN(C)C)c2ccc(F)cc2)c(Br)c1 ZINC000562193771 945013416 /nfs/dbraw/zinc/01/34/16/945013416.db2.gz UJQMNZITKHSNFC-QGZVFWFLSA-N 0 3 410.287 4.021 20 0 HIADHN CCCN(C)[C@H](CNC(=O)Nc1cnn(-c2ccccn2)c1)c1ccc(Cl)cc1 ZINC000562199809 945016332 /nfs/dbraw/zinc/01/63/32/945016332.db2.gz MAEFBYFDLJHSGA-LJQANCHMSA-N 0 3 412.925 4.125 20 0 HIADHN COCCCN(C(=O)c1cc2c(s1)CC[C@H](C(C)(C)C)C2)C1CCN(C)CC1 ZINC000562252797 945044692 /nfs/dbraw/zinc/04/46/92/945044692.db2.gz OCFBXKFCXDBEAJ-SFHVURJKSA-N 0 3 406.636 4.472 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)NCCc1c[nH]c2ncccc12)c1ccc(Cl)cc1 ZINC000564114235 945383303 /nfs/dbraw/zinc/38/33/03/945383303.db2.gz XTIYDRKJEOMMPF-FQEVSTJZSA-N 0 3 413.953 4.141 20 0 HIADHN Cc1ccc(CN[C@H]2CCCc3c4cc(Br)ccc4[nH]c32)c(=O)n1C ZINC000564152548 945403071 /nfs/dbraw/zinc/40/30/71/945403071.db2.gz OJKYVRFODUZZRV-SFHVURJKSA-N 0 3 400.320 4.105 20 0 HIADHN FC1(F)CCN(Cc2ccccc2)C[C@H]1c1nc(-c2ccc(-c3nnco3)cc2)no1 ZINC000564273872 945487285 /nfs/dbraw/zinc/48/72/85/945487285.db2.gz XSJSHSKMIKEUAQ-SFHVURJKSA-N 0 3 423.423 4.411 20 0 HIADHN Cc1c2ccccc2oc1[C@H](NC(=O)N1CCN(CC2CCOCC2)CC1)C(C)C ZINC000564287809 945499075 /nfs/dbraw/zinc/49/90/75/945499075.db2.gz PCGOALFLYCMASV-JOCHJYFZSA-N 0 3 413.562 4.192 20 0 HIADHN COc1ccc(C[C@H](CO)CNCc2csc(-c3ccc(Cl)cc3)n2)cc1O ZINC000564322150 945514147 /nfs/dbraw/zinc/51/41/47/945514147.db2.gz CRJVZQSSBJEPMN-HNNXBMFYSA-N 0 3 418.946 4.119 20 0 HIADHN COc1ccc2c(c1)C1(CC1)CN(CCC(=O)Nc1ccc(OC)c(Cl)c1)C2 ZINC000564403557 945558381 /nfs/dbraw/zinc/55/83/81/945558381.db2.gz QLWHQYRTLLRWAS-UHFFFAOYSA-N 0 3 400.906 4.233 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@H]2NC[C@]2(C)OCCc3sccc32)cc1 ZINC000564438474 945587222 /nfs/dbraw/zinc/58/72/22/945587222.db2.gz JUKBDSWNKGWJPV-FCEUIQTBSA-N 0 3 419.612 4.219 20 0 HIADHN COC(=O)[C@@H](C)Cc1ccc(NC(=O)NC[C@H](c2cccs2)N2CCCC2)cc1 ZINC000564455793 945599427 /nfs/dbraw/zinc/59/94/27/945599427.db2.gz WCJLSHQCBHUPQG-QFBILLFUSA-N 0 3 415.559 4.058 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)[C@@H]1CCn2c(cnc2C2CCCCC2)C1)c1ccco1 ZINC000564678466 945725962 /nfs/dbraw/zinc/72/59/62/945725962.db2.gz BMEZKXZRNIZRGN-FBBABVLZSA-N 0 3 412.578 4.332 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1ccccc1OC1CC1 ZINC000564683087 945727771 /nfs/dbraw/zinc/72/77/71/945727771.db2.gz MOOYZGDVEPGEKU-FQEVSTJZSA-N 0 3 416.525 4.432 20 0 HIADHN Cc1cc(NC(=O)N(C)Cc2ccc(C)o2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000565077543 945769087 /nfs/dbraw/zinc/76/90/87/945769087.db2.gz YRWUXDYFQRVHHR-FQEVSTJZSA-N 0 3 407.518 4.204 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@@H]2NCc2ccccc2Cn2ccnc2)cc1 ZINC000565369421 945817759 /nfs/dbraw/zinc/81/77/59/945817759.db2.gz XHQXHFMVHXSWTB-BJKOFHAPSA-N 0 3 423.582 4.115 20 0 HIADHN CCN(CC)C(=O)[C@@H](NCCCc1nc(-c2ccc(F)cc2)no1)c1ccccc1 ZINC000565442543 945830177 /nfs/dbraw/zinc/83/01/77/945830177.db2.gz ANGPSLRCPZZRIZ-NRFANRHFSA-N 0 3 410.493 4.008 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3cc(Cl)c4ccccc4n3)CC2)C[C@H](C)O1 ZINC000565553341 945846470 /nfs/dbraw/zinc/84/64/70/945846470.db2.gz JINUXFIHRATTSB-CALCHBBNSA-N 0 3 415.965 4.240 20 0 HIADHN COCCOc1ccc(C(=O)NC[C@H](c2ccc(SC)cc2)N(C)C)c(Cl)c1 ZINC000565678653 945864980 /nfs/dbraw/zinc/86/49/80/945864980.db2.gz OWANEEZDYDLJKE-HXUWFJFHSA-N 0 3 422.978 4.120 20 0 HIADHN CCOC(=O)[C@H]1CC[C@@H](NCc2ccc(C(=O)N(CC)CC)cc2)c2ccccc21 ZINC000566392767 946019468 /nfs/dbraw/zinc/01/94/68/946019468.db2.gz ROJIVAUPEWWXNU-XZOQPEGZSA-N 0 3 408.542 4.440 20 0 HIADHN COCCOc1ccc(NC(=O)N[C@@H]2CCN(Cc3ccccc3)[C@H]2C)cc1Cl ZINC000566522488 946028843 /nfs/dbraw/zinc/02/88/43/946028843.db2.gz PNJFEVCVJPKVKY-OXJNMPFZSA-N 0 3 417.937 4.150 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)N[C@H](C)c1ccncc1OC)c1ccc(Cl)cc1 ZINC000566553833 946039018 /nfs/dbraw/zinc/03/90/18/946039018.db2.gz YGESXGSFHZBPJG-BEFAXECRSA-N 0 3 404.942 4.187 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)C2(c3cccc(Cl)c3)CCOCC2)CCN1Cc1ccccc1 ZINC000566580738 946045363 /nfs/dbraw/zinc/04/53/63/946045363.db2.gz CCZYGIMGAZVSQF-GCJKJVERSA-N 0 3 412.961 4.167 20 0 HIADHN CN(Cc1ccc(Cl)s1)C(=O)CN[C@H]1c2ccccc2CC12CCOCC2 ZINC000566590677 946051252 /nfs/dbraw/zinc/05/12/52/946051252.db2.gz HEOQIJXWULGKKI-FQEVSTJZSA-N 0 3 404.963 4.044 20 0 HIADHN CC[C@](C)(COc1ncccc1Cl)NCC(=O)N(C)[C@H](C)c1ccccc1OC ZINC000566669765 946068992 /nfs/dbraw/zinc/06/89/92/946068992.db2.gz MGTUVXZULMOQHY-OPAMFIHVSA-N 0 3 419.953 4.100 20 0 HIADHN CC(=O)N1C[C@@H]2CCC[C@H](NCc3csc(COc4ccc(Cl)cc4)n3)[C@@H]2C1 ZINC000566877791 946146296 /nfs/dbraw/zinc/14/62/96/946146296.db2.gz BGHIBDPZMWQUDR-BEVDRBHNSA-N 0 3 419.978 4.112 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)NCc1ccc(-c2ccncc2)cc1 ZINC000567003017 946212368 /nfs/dbraw/zinc/21/23/68/946212368.db2.gz REQSIQJYQDPYLN-UHFFFAOYSA-N 0 3 406.505 4.161 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)c1ccc(C(=O)Nc2ccccc2)cc1)c1ccco1 ZINC000567016314 946217991 /nfs/dbraw/zinc/21/79/91/946217991.db2.gz UYNIKEMTPUANPD-LAUBAEHRSA-N 0 3 405.498 4.391 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(Oc2cccnc2)cc1)C(=O)N1CCc2ccccc2C1 ZINC000567021477 946219118 /nfs/dbraw/zinc/21/91/18/946219118.db2.gz XEFADHOZFXAQOJ-OALUTQOASA-N 0 3 401.510 4.498 20 0 HIADHN COc1nc2ccccc2cc1CN1C[C@H]2CCC[C@@]2(c2nc(CC3CC3)no2)C1 ZINC000567047824 946226235 /nfs/dbraw/zinc/22/62/35/946226235.db2.gz FGRZHTVOPWDSQJ-NTKDMRAZSA-N 0 3 404.514 4.133 20 0 HIADHN CSc1ccc([C@H](CNC(=O)Cc2ccc(-n3nc(C)cc3C)cc2)N(C)C)cc1 ZINC000567140637 946250035 /nfs/dbraw/zinc/25/00/35/946250035.db2.gz BAPRHTCCDWCEIR-QHCPKHFHSA-N 0 3 422.598 4.173 20 0 HIADHN C[C@H](NCC(=O)Nc1ccccc1C(=O)c1ccccc1)[C@H]1COc2ccccc21 ZINC000567147551 946252803 /nfs/dbraw/zinc/25/28/03/946252803.db2.gz QVILZGODXBWQPL-LAUBAEHRSA-N 0 3 400.478 4.010 20 0 HIADHN Cc1cc(Br)cn2cc(CCNCc3nc(-c4ccccc4)c[nH]3)nc12 ZINC000567321421 946311310 /nfs/dbraw/zinc/31/13/10/946311310.db2.gz ZQMFENWSSDQGLA-UHFFFAOYSA-N 0 3 410.319 4.128 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)c1nn(-c2ccccc2Cl)cc1C)c1ccco1 ZINC000567420787 946332273 /nfs/dbraw/zinc/33/22/73/946332273.db2.gz ZRJHQUSBGGSNQV-DOTOQJQBSA-N 0 3 400.910 4.286 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1ccc(CN(C(C)=O)C2CC2)cc1)c1ccco1 ZINC000567480237 946346851 /nfs/dbraw/zinc/34/68/51/946346851.db2.gz ABDYWLFPYBVFOA-HRAATJIYSA-N 0 3 412.534 4.041 20 0 HIADHN C[C@H](NC[C@H](Cc1ccccc1)C(F)(F)F)c1cccc(S(=O)(=O)N(C)C)c1 ZINC000567576764 946380403 /nfs/dbraw/zinc/38/04/03/946380403.db2.gz STCGDGNXKJLHGS-YJBOKZPZSA-N 0 3 414.493 4.009 20 0 HIADHN COc1ccc([C@H](CNC(=O)CN(C)[C@@H](C)C2CC2)c2c[nH]c3ccccc32)cc1 ZINC000567718810 946397956 /nfs/dbraw/zinc/39/79/56/946397956.db2.gz UMOVYCDLPONFCZ-JTSKRJEESA-N 0 3 405.542 4.155 20 0 HIADHN CCn1nccc1N1CCC[C@@H](NC/C(C)=C/c2cccc(C(F)(F)F)c2)C1=O ZINC000568132106 946474580 /nfs/dbraw/zinc/47/45/80/946474580.db2.gz LEFUDGVHQWNKCS-NKAIQICCSA-N 0 3 406.452 4.110 20 0 HIADHN COC(=O)c1cc(NC(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)cc2[nH]ccc21 ZINC000568321857 946505771 /nfs/dbraw/zinc/50/57/71/946505771.db2.gz CUYDDWYNCGCBOY-LJQANCHMSA-N 0 3 420.513 4.083 20 0 HIADHN O=C([C@@H]1C[C@@H]1c1ccccc1Cl)N1CCC[C@H](c2n[nH]cc2CN2CCCC2)C1 ZINC000568612347 946624427 /nfs/dbraw/zinc/62/44/27/946624427.db2.gz GZVZYXUQXHUECN-PWIZWCRZSA-N 0 3 412.965 4.169 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)c1ccccc1OCc1csc(C)n1)c1ccco1 ZINC000568642143 946632064 /nfs/dbraw/zinc/63/20/64/946632064.db2.gz XZKJBUXNFGTTTE-BEFAXECRSA-N 0 3 413.543 4.483 20 0 HIADHN COc1ccc(CN[C@@H](Cc2ccccc2)C(=O)Nc2ccccc2)c(C)c1OC ZINC000568676021 946649813 /nfs/dbraw/zinc/64/98/13/946649813.db2.gz BXZUJPHEJFXUNC-QFIPXVFZSA-N 0 3 404.510 4.352 20 0 HIADHN Cc1ccccc1[C@H](OC[C@H](O)CN1CC2(CCC2)[C@@H]1[C@@H]1CCCO1)c1ccccc1 ZINC000568697997 946665699 /nfs/dbraw/zinc/66/56/99/946665699.db2.gz FHHGHNFAGPFSML-DSYNPFFXSA-N 0 3 421.581 4.495 20 0 HIADHN CC[C@@H](NC(=O)c1ccccc1)c1noc([C@H]2CCCN(Cc3cccc(F)c3)C2)n1 ZINC000568799259 946699683 /nfs/dbraw/zinc/69/96/83/946699683.db2.gz HYNBZJLTXWCCSP-PZJWPPBQSA-N 0 3 422.504 4.469 20 0 HIADHN Cc1cc(N2CCCC2)ccc1NC(=O)CN[C@H]1c2ccccc2CC12CCOCC2 ZINC000568817280 946714911 /nfs/dbraw/zinc/71/49/11/946714911.db2.gz HTEXJKWAOJKPJA-VWLOTQADSA-N 0 3 419.569 4.218 20 0 HIADHN COc1cccc2c1CCC[C@@H]2NCc1cc(Br)c2c(c1)OCCO2 ZINC000568833379 946723295 /nfs/dbraw/zinc/72/32/95/946723295.db2.gz GZKCSZBJBUGHTG-KRWDZBQOSA-N 0 3 404.304 4.396 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)NCc1cccc(NC(C)=O)c1)c1ccc(Cl)cc1 ZINC000568914538 946748974 /nfs/dbraw/zinc/74/89/74/946748974.db2.gz FJXYJWAUNXDJGL-NRFANRHFSA-N 0 3 416.953 4.181 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)c1cccc(OCc2csc(C)n2)c1)c1ccco1 ZINC000569025667 946801924 /nfs/dbraw/zinc/80/19/24/946801924.db2.gz WHGPHVCAAKLYPB-MGPUTAFESA-N 0 3 413.543 4.483 20 0 HIADHN Cc1cnccc1OC1CCN(C[C@@H](O)CO[C@H](C)c2ccc(Cl)cc2)CC1 ZINC000569055021 946812321 /nfs/dbraw/zinc/81/23/21/946812321.db2.gz WNIFSOSYGQJYNJ-YLJYHZDGSA-N 0 3 404.938 4.025 20 0 HIADHN CC(C)[C@@H](NC(=O)NCCCCN1CCN(C)CC1)c1ccc(C(C)(C)C)cc1 ZINC000569140707 946821228 /nfs/dbraw/zinc/82/12/28/946821228.db2.gz ROTWAAVAJBRBKV-JOCHJYFZSA-N 0 3 402.627 4.008 20 0 HIADHN COc1ccc(S(=O)(=O)N(C)[C@@H]2CCN(Cc3ccccc3)[C@H](C)C2)c(Cl)c1 ZINC000569284809 946849936 /nfs/dbraw/zinc/84/99/36/946849936.db2.gz QAWLTFPXHJTTIV-SJLPKXTDSA-N 0 3 422.978 4.022 20 0 HIADHN CN(CCc1nc(-c2ccccc2)no1)Cc1ccc(OCC(F)(F)F)c(F)c1 ZINC000569290859 946852354 /nfs/dbraw/zinc/85/23/54/946852354.db2.gz IULBBIVAFQRFPQ-UHFFFAOYSA-N 0 3 409.383 4.491 20 0 HIADHN FC(F)(F)c1ccc(-c2nc(CN[C@@H]3CCCC[C@H]3N3CCOCC3)co2)cc1 ZINC000569431562 946874414 /nfs/dbraw/zinc/87/44/14/946874414.db2.gz XOXYPMTWRMZKGQ-RTBURBONSA-N 0 3 409.452 4.093 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)Nc1ccccc1CN1C[C@@H](C)O[C@H](C)C1 ZINC000569837922 947015757 /nfs/dbraw/zinc/01/57/57/947015757.db2.gz MBPVAXRVFYYJMK-NHCUHLMSSA-N 0 3 416.610 4.026 20 0 HIADHN COC(C)(C)c1nc(C)c(C(=O)NC[C@H]2CCCN(C)[C@@H]2c2cccs2)s1 ZINC000569892882 947039383 /nfs/dbraw/zinc/03/93/83/947039383.db2.gz LVMKUWYBIJHYOE-ZBFHGGJFSA-N 0 3 407.605 4.207 20 0 HIADHN CCOC(=O)c1oc2ccccc2c1CN1CC[C@@](CO)(Cc2ccc(F)cc2)C1 ZINC000569963443 947054748 /nfs/dbraw/zinc/05/47/48/947054748.db2.gz FTGQODNVRSYDDU-XMMPIXPASA-N 0 3 411.473 4.176 20 0 HIADHN Cc1ccnc(Oc2ccc(NC(=O)N[C@@H]3CCN(Cc4ccccc4)[C@H]3C)cc2)n1 ZINC000570033394 947078010 /nfs/dbraw/zinc/07/80/10/947078010.db2.gz SQUXMFOZVQEJKX-PGRDOPGGSA-N 0 3 417.513 4.362 20 0 HIADHN CCOC(=O)c1c(C)c(C)sc1NC(=O)C[C@@H](C)N[C@@H](C)c1cnn(C(C)C)c1 ZINC000570195149 947133293 /nfs/dbraw/zinc/13/32/93/947133293.db2.gz WQPUVENMVKRGND-HIFRSBDPSA-N 0 3 420.579 4.387 20 0 HIADHN COCCS(=O)(=O)c1ccc(CN[C@H]2CCCc3c4cc(C)ccc4[nH]c32)cc1 ZINC000570218885 947147368 /nfs/dbraw/zinc/14/73/68/947147368.db2.gz DJJJVYRMQXSZAZ-QFIPXVFZSA-N 0 3 412.555 4.064 20 0 HIADHN C[C@@]1(C2CC2)NC(=O)N(c2cccc(CN[C@@H](c3ccc(F)cc3)C3CC3)c2)C1=O ZINC000570299053 947182843 /nfs/dbraw/zinc/18/28/43/947182843.db2.gz CUXGZDFWVQILLO-QPPBQGQZSA-N 0 3 407.489 4.292 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)[C@@H](C)Cc2ccc(C(F)(F)F)cc2)cc1 ZINC000570309996 947189434 /nfs/dbraw/zinc/18/94/34/947189434.db2.gz URFGBAAAPLJLRE-MGPUTAFESA-N 0 3 408.464 4.312 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)[C@@H](C)Cc2ccc(C(F)(F)F)cc2)cc1 ZINC000570310000 947189593 /nfs/dbraw/zinc/18/95/93/947189593.db2.gz URFGBAAAPLJLRE-YWZLYKJASA-N 0 3 408.464 4.312 20 0 HIADHN CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC/C(C)=C\c1ccccc1OC(F)F ZINC000570321755 947200518 /nfs/dbraw/zinc/20/05/18/947200518.db2.gz SZNIHFWHAITIJD-HFZJLKNISA-N 0 3 413.468 4.120 20 0 HIADHN CCOc1cc(CN(C)[C@H]2CCCc3ccccc32)nc2nc(C(F)(F)F)nn21 ZINC000570453591 947251392 /nfs/dbraw/zinc/25/13/92/947251392.db2.gz CDYCOUYCEUGEHG-INIZCTEOSA-N 0 3 405.424 4.051 20 0 HIADHN Clc1ccc(CN[C@H](c2cncc(Br)c2)C2CC2)c(-n2cncn2)c1 ZINC000570468964 947256412 /nfs/dbraw/zinc/25/64/12/947256412.db2.gz PBSKTRNUWAVZGC-SFHVURJKSA-N 0 3 418.726 4.319 20 0 HIADHN C[C@H](N[C@H]1CCN(C)[C@H]1c1ccc(F)c(F)c1)C(=O)Nc1ccc(F)cc1Cl ZINC000570487426 947264047 /nfs/dbraw/zinc/26/40/47/947264047.db2.gz CGWHZCDXBKGMLJ-BKOMCJNNSA-N 0 3 411.855 4.119 20 0 HIADHN COc1cc(CNCc2cc(OC)c(OCC(F)F)c(OC)c2)c2ccccc2n1 ZINC000570547326 947287661 /nfs/dbraw/zinc/28/76/61/947287661.db2.gz YMJWMOMXFDJMJC-UHFFFAOYSA-N 0 3 418.440 4.194 20 0 HIADHN Cc1nc2ccccn2c(=O)c1CCN1CCC[C@H]1c1cccc(Br)c1 ZINC000570647066 947321476 /nfs/dbraw/zinc/32/14/76/947321476.db2.gz FBCNJHLLKXQWLN-IBGZPJMESA-N 0 3 412.331 4.145 20 0 HIADHN CN1CC[C@@H](NCC(=O)Nc2ccc(OCc3ccccc3)cc2)[C@@H]1c1ccccc1 ZINC000570762961 947350140 /nfs/dbraw/zinc/35/01/40/947350140.db2.gz XCSDGSUGRBTDMQ-RSXGOPAZSA-N 0 3 415.537 4.239 20 0 HIADHN Cc1cc(NC(=O)[C@H]2CCCN(Cc3cccnc3)C2)ccc1Oc1ccncc1 ZINC000570776305 947355026 /nfs/dbraw/zinc/35/50/26/947355026.db2.gz ZZKWANSWLAXZOP-FQEVSTJZSA-N 0 3 402.498 4.428 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3sccc3COC)c(OCC)c2)CC1 ZINC000570965030 947399867 /nfs/dbraw/zinc/39/98/67/947399867.db2.gz FBJSQZKHFGXGIG-UHFFFAOYSA-N 0 3 417.575 4.078 20 0 HIADHN CN1CC[C@@H](NCC(=O)Nc2ccccc2C(C)(C)C)[C@H]1c1ccc(F)c(F)c1 ZINC000570976492 947407097 /nfs/dbraw/zinc/40/70/97/947407097.db2.gz UZQCGCPAHHEYFV-IFMALSPDSA-N 0 3 401.501 4.236 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)Nc1ccc(-n2cccn2)c(Cl)c1)c1ccco1 ZINC000571114811 947509995 /nfs/dbraw/zinc/50/99/95/947509995.db2.gz OJMOWMWLDUWCMO-RHSMWYFYSA-N 0 3 401.898 4.370 20 0 HIADHN C[C@@H](c1ccc(F)c(F)c1)N(C)C(=O)CN[C@H]1c2ccccc2CC12CCOCC2 ZINC000571210496 947548547 /nfs/dbraw/zinc/54/85/47/947548547.db2.gz GMAIOBJBVSVYCW-HJPURHCSSA-N 0 3 414.496 4.168 20 0 HIADHN Fc1cccc(OC(F)(F)F)c1CNCCCCn1cc(Br)cn1 ZINC000571349967 947612284 /nfs/dbraw/zinc/61/22/84/947612284.db2.gz DVZLIDQAHUUMOM-UHFFFAOYSA-N 0 3 410.209 4.253 20 0 HIADHN Cc1noc(-c2ccc(C)c(NC(=O)N[C@@H]3CCN(Cc4ccccc4)[C@@H]3C)c2)n1 ZINC000571474334 947664688 /nfs/dbraw/zinc/66/46/88/947664688.db2.gz MUPFTXHGNSNBIY-OXQOHEQNSA-N 0 3 405.502 4.138 20 0 HIADHN Cc1nc(Cc2ccccc2)sc1[C@@H](C)NCCn1cc(Br)cn1 ZINC000571588330 947717025 /nfs/dbraw/zinc/71/70/25/947717025.db2.gz HOKWLSYCXWTUBG-CYBMUJFWSA-N 0 3 405.365 4.352 20 0 HIADHN O=C(N[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000571622381 947732118 /nfs/dbraw/zinc/73/21/18/947732118.db2.gz BVJSDTJOJJMICX-MOXGXCLJSA-N 0 3 404.341 4.273 20 0 HIADHN C[C@@H]1CN(c2ccc(CN[C@H]3CCc4c3cccc4Br)cn2)C[C@H](C)O1 ZINC000571666432 947740360 /nfs/dbraw/zinc/74/03/60/947740360.db2.gz CRVZQDPUOGUTLT-MDOVXXIYSA-N 0 3 416.363 4.235 20 0 HIADHN Cc1cccc(S(=O)(=O)CCCN[C@@H](c2cncc(Br)c2)C2CC2)c1 ZINC000571706368 947755634 /nfs/dbraw/zinc/75/56/34/947755634.db2.gz FQFGDXYUZQXPHD-LJQANCHMSA-N 0 3 423.376 4.057 20 0 HIADHN NS(=O)(=O)c1ccc2c(c1)[C@@H](N[C@H](Cc1ccccc1)c1ccccc1)CCC2 ZINC000571725230 947765226 /nfs/dbraw/zinc/76/52/26/947765226.db2.gz WEKSIONBWLFICB-BJKOFHAPSA-N 0 3 406.551 4.285 20 0 HIADHN CC(C)n1ncc2cc(CN3CCC[C@H](c4nc(C(F)(F)F)cn4C)C3)cnc21 ZINC000571805459 947791127 /nfs/dbraw/zinc/79/11/27/947791127.db2.gz CYYVGCKXCQXUBL-HNNXBMFYSA-N 0 3 406.456 4.144 20 0 HIADHN C[C@@H](C1CC1)N(Cc1ccccc1)C(=O)CN[C@H]1c2ccccc2CC12CCOCC2 ZINC000571930947 947815037 /nfs/dbraw/zinc/81/50/37/947815037.db2.gz QSUDDYGXUABUIS-FNZWTVRRSA-N 0 3 418.581 4.498 20 0 HIADHN Cc1ccc(-c2noc([C@@H]3CCCN(Cc4cccnc4)C3)n2)cc1N1CCCC1 ZINC000572025630 947829898 /nfs/dbraw/zinc/82/98/98/947829898.db2.gz WSHBUVNSKQELTK-OAQYLSRUSA-N 0 3 403.530 4.420 20 0 HIADHN C/C(=C/c1ccccc1OC(F)F)CN[C@@H]1CCN(Cc2ccc(F)cc2)C1=O ZINC000572084105 947842918 /nfs/dbraw/zinc/84/29/18/947842918.db2.gz YXLWHBHHQPKFME-LJQBUTKESA-N 0 3 404.432 4.221 20 0 HIADHN CCN1CCN(Cc2ccc(CN[C@H](COC)c3cccc(Cl)c3F)cc2)CC1 ZINC000572164850 947853967 /nfs/dbraw/zinc/85/39/67/947853967.db2.gz BSVAWYGDYFLVIJ-JOCHJYFZSA-N 0 3 419.972 4.094 20 0 HIADHN CN(C)c1cc(Cl)cc(Cl)c1CNC1CCN(C(=O)c2ccccc2)CC1 ZINC000572170932 947855979 /nfs/dbraw/zinc/85/59/79/947855979.db2.gz PDESPCDLNAXUQV-UHFFFAOYSA-N 0 3 406.357 4.454 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1)c1nccn1-c1ccccc1 ZINC000572193029 947860541 /nfs/dbraw/zinc/86/05/41/947860541.db2.gz GFENNTDILQGYFL-IRFCIJBXSA-N 0 3 403.530 4.068 20 0 HIADHN CCn1nccc1N1CCC[C@H](N[C@@H](C)c2ccc(OC(C)C)c(Cl)c2)C1=O ZINC000572264303 947871099 /nfs/dbraw/zinc/87/10/99/947871099.db2.gz HRIKSIATXGJODM-YJBOKZPZSA-N 0 3 404.942 4.190 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2ccc(-c3ccccn3)cc2)c1 ZINC000572291907 947877059 /nfs/dbraw/zinc/87/70/59/947877059.db2.gz ICGWUKSVOUKTDZ-UHFFFAOYSA-N 0 3 404.514 4.353 20 0 HIADHN O=C(Nc1ccc(Br)cn1)C1CCN(Cc2ccc3occc3c2)CC1 ZINC000572406737 947895942 /nfs/dbraw/zinc/89/59/42/947895942.db2.gz NUWSUKISGZRCIQ-UHFFFAOYSA-N 0 3 414.303 4.441 20 0 HIADHN CC(C)Cc1ccc([C@H](CNC(=O)CCc2nnc(C3CCCC3)o2)N(C)C)cc1 ZINC000572432800 947902608 /nfs/dbraw/zinc/90/26/08/947902608.db2.gz URYMPBSGDRZNEH-NRFANRHFSA-N 0 3 412.578 4.277 20 0 HIADHN C/C(=C/c1cccc(C(F)(F)F)c1)CNCc1cccnc1N1CCN(C)CC1 ZINC000572439183 947904611 /nfs/dbraw/zinc/90/46/11/947904611.db2.gz OJEOEVHOBFOJKT-LGMDPLHJSA-N 0 3 404.480 4.045 20 0 HIADHN CCOC(=O)c1ccn(-c2cccc(CNCc3cnc(C4CCCC4)s3)c2)n1 ZINC000572764458 948003760 /nfs/dbraw/zinc/00/37/60/948003760.db2.gz WIBWAYQTHAGBRY-UHFFFAOYSA-N 0 3 410.543 4.453 20 0 HIADHN CN(CCCN(C)C(=O)Cc1csc2ccc(Cl)cc12)Cc1ccncc1 ZINC000572796086 948012928 /nfs/dbraw/zinc/01/29/28/948012928.db2.gz ZSVYQJKFHRAPDT-UHFFFAOYSA-N 0 3 401.963 4.473 20 0 HIADHN CSc1cccc(N(C(=O)COc2cccc3cccnc32)C2CCN(C)CC2)c1 ZINC000572886353 948029877 /nfs/dbraw/zinc/02/98/77/948029877.db2.gz KJPLBJJIXFJRRV-UHFFFAOYSA-N 0 3 421.566 4.463 20 0 HIADHN CCN1CC[C@@H](NCc2cc(C(=O)OC)sc2C)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000573147830 948091056 /nfs/dbraw/zinc/09/10/56/948091056.db2.gz PAIOAKXRLZNMFL-VQIMIIECSA-N 0 3 412.477 4.186 20 0 HIADHN CCc1nn(-c2ccccc2)c(CC)c1CN[C@H](C)c1ccccc1-n1ccnn1 ZINC000573228869 948113864 /nfs/dbraw/zinc/11/38/64/948113864.db2.gz CTSZNDQRQYEIAW-GOSISDBHSA-N 0 3 400.530 4.429 20 0 HIADHN Cc1cc(C)c(CC(C(=O)Nc2cccc3c2OCC(=O)N3)C(F)(F)F)c(C)c1 ZINC000573231479 948116129 /nfs/dbraw/zinc/11/61/29/948116129.db2.gz KSJMDWNQFGDBMW-OAHLLOKOSA-N 0 3 406.404 4.302 20 0 HIADHN O[C@H](CNCc1ccc(Oc2ccccc2F)c(F)c1)COc1ccc(F)cc1 ZINC000573271393 948133679 /nfs/dbraw/zinc/13/36/79/948133679.db2.gz JRRXFCDQAZAFMU-QGZVFWFLSA-N 0 3 403.400 4.426 20 0 HIADHN CCOc1ccc(C(=O)NC[C@H](c2ccc(SC)cc2)N(C)C)cc1OCC ZINC000573359513 948166103 /nfs/dbraw/zinc/16/61/03/948166103.db2.gz WQCHCUYZWBOOBD-LJQANCHMSA-N 0 3 402.560 4.239 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)CCc2nnc(-c3ccc(Cl)cc3)o2)CCN1Cc1ccccc1 ZINC000573552110 948238963 /nfs/dbraw/zinc/23/89/63/948238963.db2.gz VEGBTJAFDZVFLN-UZLBHIALSA-N 0 3 424.932 4.102 20 0 HIADHN O=S(=O)(Cc1ccccc1CN[C@@H]1CCCc2c3ccccc3[nH]c21)N1CCCC1 ZINC000573758472 948290906 /nfs/dbraw/zinc/29/09/06/948290906.db2.gz FIVDIOKOKCLBBY-HSZRJFAPSA-N 0 3 423.582 4.261 20 0 HIADHN CN(C(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1)C1CCC(F)(F)CC1 ZINC000573841245 948307612 /nfs/dbraw/zinc/30/76/12/948307612.db2.gz CJXKKBPWDIWLGG-SFHVURJKSA-N 0 3 404.423 4.477 20 0 HIADHN C[C@H](NC1CCN(Cc2ccc(Br)cc2)CC1)c1cn2ccccc2n1 ZINC000574025931 948351530 /nfs/dbraw/zinc/35/15/30/948351530.db2.gz JNNLDJYYVJBKLJ-INIZCTEOSA-N 0 3 413.363 4.412 20 0 HIADHN Brc1ccc(-n2cc(CN3CCC(C4CCOCC4)CC3)cn2)cc1 ZINC000574106694 948365529 /nfs/dbraw/zinc/36/55/29/948365529.db2.gz ITTZEYHALPWENT-UHFFFAOYSA-N 0 3 404.352 4.273 20 0 HIADHN CC(C)N1C[C@H](c2noc(-c3cccc(CN(C)Cc4ccccc4)c3)n2)CC1=O ZINC000574299147 948405122 /nfs/dbraw/zinc/40/51/22/948405122.db2.gz ZYPSDPDJSHQFEL-OAQYLSRUSA-N 0 3 404.514 4.093 20 0 HIADHN COCc1ccc(CNC(=O)CNC(C)(C)c2ccc(Br)c(C)c2)cc1 ZINC000574368763 948426081 /nfs/dbraw/zinc/42/60/81/948426081.db2.gz QZWYMEMZVNPHQF-UHFFFAOYSA-N 0 3 419.363 4.045 20 0 HIADHN CCCN(C)[C@H](CNC(=O)Cc1cc(F)cc2c1OCOC2)c1ccc(Cl)cc1 ZINC000574421825 948434554 /nfs/dbraw/zinc/43/45/54/948434554.db2.gz GOJHGAQCUZPSRE-HXUWFJFHSA-N 0 3 420.912 4.087 20 0 HIADHN Cc1cccc(Br)c1C(=O)N1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000574435456 948440641 /nfs/dbraw/zinc/44/06/41/948440641.db2.gz GZKIYTWFEDADOK-IRXDYDNUSA-N 0 3 423.395 4.109 20 0 HIADHN CCCN(C)[C@H](CNC(=O)NCc1ccccc1NC(C)=O)c1ccc(Cl)cc1 ZINC000574553593 948470187 /nfs/dbraw/zinc/47/01/87/948470187.db2.gz KLYSHXIOCOGWJL-OAQYLSRUSA-N 0 3 416.953 4.181 20 0 HIADHN Cc1nc(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2)sc1C(F)(F)F ZINC000574774374 948522461 /nfs/dbraw/zinc/52/24/61/948522461.db2.gz PHIVWYCEDWJCCR-UHFFFAOYSA-N 0 3 404.433 4.205 20 0 HIADHN C/C=C/c1ccc(OC[C@H](O)CNCc2cc(Br)cs2)c(OC)c1 ZINC000574772532 948522728 /nfs/dbraw/zinc/52/27/28/948522728.db2.gz QTXJMHGKDSTPCS-NHZBNJEXSA-N 0 3 412.349 4.082 20 0 HIADHN COc1cccc([C@@H]2[C@H](NCc3nc4cc(Cl)ccc4n3C)CCN2C2CC2)c1 ZINC000574827384 948537157 /nfs/dbraw/zinc/53/71/57/948537157.db2.gz YJXJFQHYULWPAI-AUSIDOKSSA-N 0 3 410.949 4.303 20 0 HIADHN COc1cc(CN2CC[C@H](C(F)(F)F)[C@@H](CO)C2)c(-c2ccccc2)cc1OC ZINC000574844527 948542725 /nfs/dbraw/zinc/54/27/25/948542725.db2.gz LWANTBDRRBGNRU-MJGOQNOKSA-N 0 3 409.448 4.364 20 0 HIADHN COc1cccc(C2(NC(=O)Nc3ccc(CCN4CCSCC4)cc3)CC2)c1 ZINC000575068351 948584046 /nfs/dbraw/zinc/58/40/46/948584046.db2.gz FGORPRGHMYCWHU-UHFFFAOYSA-N 0 3 411.571 4.097 20 0 HIADHN O=C(NC[C@]1(O)CCN(Cc2ccccc2)C1)Nc1cccc(Oc2ccccc2)c1 ZINC000575224273 948637180 /nfs/dbraw/zinc/63/71/80/948637180.db2.gz WLRQWZOYZBBBGW-RUZDIDTESA-N 0 3 417.509 4.237 20 0 HIADHN CCn1c(CN(C)C2CCN(Cc3ncc(C)c(OC)c3C)CC2)nc2ccccc21 ZINC000575239599 948639635 /nfs/dbraw/zinc/63/96/35/948639635.db2.gz KWTLWWAANRMPFR-UHFFFAOYSA-N 0 3 421.589 4.173 20 0 HIADHN O[C@@H](COc1ccccc1C(F)(F)F)CN1CCC(OC2CCCCC2)CC1 ZINC000575356832 948653400 /nfs/dbraw/zinc/65/34/00/948653400.db2.gz VGGFWPFYYMCGBP-MRXNPFEDSA-N 0 3 401.469 4.259 20 0 HIADHN COc1ccc(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2F)c2ncccc12 ZINC000575637043 948689247 /nfs/dbraw/zinc/68/92/47/948689247.db2.gz DFJZHJLUINNTLI-UHFFFAOYSA-N 0 3 414.456 4.117 20 0 HIADHN CC(C)c1ccc(C(=O)N(CCN(C)C)Cc2ccc(Br)cc2)nc1 ZINC000575843151 948739291 /nfs/dbraw/zinc/73/92/91/948739291.db2.gz BUESABPRSGUDQI-UHFFFAOYSA-N 0 3 404.352 4.172 20 0 HIADHN Fc1ccc([C@H](NCC2(c3cccc(Cl)c3)CCOCC2)c2nnc[nH]2)cc1 ZINC000575886852 948755492 /nfs/dbraw/zinc/75/54/92/948755492.db2.gz CPTSNXKSRSUGLE-IBGZPJMESA-N 0 3 400.885 4.025 20 0 HIADHN Cc1nc2ccccn2c1CNCc1cccc(-c2nc(CC(F)(F)F)no2)c1 ZINC000575910836 948778851 /nfs/dbraw/zinc/77/88/51/948778851.db2.gz KOLUIEMPDYMEJD-UHFFFAOYSA-N 0 3 401.392 4.087 20 0 HIADHN CC(C)c1ccc(-c2cc(C(F)(F)N3CC[C@H]4NCCO[C@@H]4C3)c(Cl)nn2)cc1 ZINC001164389310 718826006 /nfs/dbraw/zinc/82/60/06/718826006.db2.gz HIQXMGYGKHGPEP-IEBWSBKVSA-N 0 3 422.907 4.032 20 0 HIADHN FC(F)(c1cnc(Cl)c(-c2ccc(Cl)cc2)c1)N1CC[C@@H]2NCCO[C@H]2C1 ZINC001164391781 718826553 /nfs/dbraw/zinc/82/65/53/718826553.db2.gz XGGHSIYUKMYPTA-IRXDYDNUSA-N 0 3 414.283 4.167 20 0 HIADHN FC(F)(c1nc(Cl)cc(Cl)n1)N1CCC[C@H]2CN(Cc3ccccc3)C[C@@H]21 ZINC001164623703 719059280 /nfs/dbraw/zinc/05/92/80/719059280.db2.gz KPAKRRMIUQECQE-GJZGRUSLSA-N 0 3 413.299 4.429 20 0 HIADHN Cc1nc(CN2CCCC23CCN(c2nccc4c5c([nH]c42)CCC5)CC3)cs1 ZINC001164697853 719816428 /nfs/dbraw/zinc/81/64/28/719816428.db2.gz BGDOPYWWLIWWJT-UHFFFAOYSA-N 0 3 407.587 4.452 20 0 HIADHN CC(C)(c1ccnc(Cl)c1)N1CCC2(CC1)CN(Cc1cccs1)CCO2 ZINC001164707297 719908755 /nfs/dbraw/zinc/90/87/55/719908755.db2.gz OVNGOVAIOPOULQ-UHFFFAOYSA-N 0 3 405.995 4.399 20 0 HIADHN Clc1cc2ncnc(N3CC[C@@H]4[C@H]3CCN4Cc3cccnc3)c2cc1Cl ZINC001164732422 720414341 /nfs/dbraw/zinc/41/43/41/720414341.db2.gz NGTBPGYIJZLBMK-RTBURBONSA-N 0 3 400.313 4.185 20 0 HIADHN Fc1ccc(-c2ccc(Cl)nn2)c(N2CC[C@H]3[C@H]2CCN3Cc2cccnc2)c1 ZINC001164727888 720456611 /nfs/dbraw/zinc/45/66/11/720456611.db2.gz FEBQGABTSORZJK-VQTJNVASSA-N 0 3 409.896 4.184 20 0 HIADHN FC1(F)CCN(c2nc3[nH]ccc3cc2Cl)C[C@]12CCN(Cc1ccccn1)C2 ZINC001164908755 721711497 /nfs/dbraw/zinc/71/14/97/721711497.db2.gz YVWDNELXVVPGLD-HXUWFJFHSA-N 0 3 417.891 4.301 20 0 HIADHN Cc1cc2ncnc(N3CCC(F)(F)[C@]4(CCN(Cc5ccccn5)C4)C3)c2s1 ZINC001164906185 721719584 /nfs/dbraw/zinc/71/95/84/721719584.db2.gz KROOBSHNGWFVFP-FQEVSTJZSA-N 0 3 415.513 4.132 20 0 HIADHN Cc1ccc(F)c2cc(C)c(N3CC[C@H]4CN(Cc5cccnc5)CCO[C@H]4C3)nc12 ZINC001164976455 722128006 /nfs/dbraw/zinc/12/80/06/722128006.db2.gz LOSMSEHBZJDKKZ-REWPJTCUSA-N 0 3 420.532 4.113 20 0 HIADHN Fc1cccc(CN2CC[C@]23CCCN(c2ncnc4[nH]c5ccccc5c42)C3)c1 ZINC001164994913 722201509 /nfs/dbraw/zinc/20/15/09/722201509.db2.gz JTQUEVMGZRWZNT-DEOSSOPVSA-N 0 3 401.489 4.495 20 0 HIADHN CC(C)[C@@H]1CC[C@@H](NCc2nnc3n2CCOC3)[C@H](Cc2ccc(Cl)cc2)C1 ZINC000436100220 861383987 /nfs/dbraw/zinc/38/39/87/861383987.db2.gz MMHLGZNBQOMWCB-QWFCFKBJSA-N 0 3 402.970 4.235 20 0 HIADHN Cc1cc(NC(=O)[C@@H](c2cccnc2)C(C)C)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000436151166 861449117 /nfs/dbraw/zinc/44/91/17/861449117.db2.gz KXNHSVUGDOMBBB-ISKFKSNPSA-N 0 3 417.557 4.412 20 0 HIADHN CC[C@H](C)c1ccc(S(=O)(=O)Nc2ccc(N3CCN(CC)CC3)cc2)cc1 ZINC000007109454 845254580 /nfs/dbraw/zinc/25/45/80/845254580.db2.gz GGEDDNYTBFRBQP-SFHVURJKSA-N 0 3 401.576 4.143 20 0 HIADHN Cc1c(Cl)cccc1NC(=O)CNC(=O)CN[C@H](C)c1cccc2ccccc21 ZINC000007920221 845447633 /nfs/dbraw/zinc/44/76/33/845447633.db2.gz JWLKZAPHOJZWEE-MRXNPFEDSA-N 0 3 409.917 4.207 20 0 HIADHN Cc1nn(Cc2ccccc2)c2sc(C(=O)NCc3ccccc3CN(C)C)cc12 ZINC000007923984 845448149 /nfs/dbraw/zinc/44/81/49/845448149.db2.gz WXXRVKGSDLNFEJ-UHFFFAOYSA-N 0 3 418.566 4.446 20 0 HIADHN Cc1ccsc1-c1nnc(NC(=O)CN[C@@H]2CCCC[C@H]2OCCC(C)C)o1 ZINC000436262166 861573539 /nfs/dbraw/zinc/57/35/39/861573539.db2.gz QOGQVCAAUNRLJQ-HZPDHXFCSA-N 0 3 406.552 4.009 20 0 HIADHN O=C(Cc1csc(-c2ccccc2Cl)n1)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000008367064 845519938 /nfs/dbraw/zinc/51/99/38/845519938.db2.gz XPDFEMATCRZZCM-QGZVFWFLSA-N 0 3 411.958 4.397 20 0 HIADHN COc1cccc([C@H]2CCCN2C[C@H](O)COc2ccc(Br)cc2)c1 ZINC000009903189 845602478 /nfs/dbraw/zinc/60/24/78/845602478.db2.gz SHTXEBQPCORRFI-FXAWDEMLSA-N 0 3 406.320 4.035 20 0 HIADHN Cc1nn(Cc2ccc(C)cc2)c(Cl)c1C(=O)NCc1ccccc1CN(C)C ZINC000009917060 845603862 /nfs/dbraw/zinc/60/38/62/845603862.db2.gz YACMUMLEKKPGTL-UHFFFAOYSA-N 0 3 410.949 4.193 20 0 HIADHN Cc1cc(C)n(-c2ccc(C(=O)N3c4ccc(C)cc4[C@H]4CN(C)CC[C@@H]43)cc2)n1 ZINC000010045402 845615143 /nfs/dbraw/zinc/61/51/43/845615143.db2.gz SUFSPQISZYFFPF-VWNXMTODSA-N 0 3 400.526 4.246 20 0 HIADHN CCOc1c(Cl)cc(C(=O)Nc2ccc(N3CCN(CC)CC3)cc2)cc1OC ZINC000011872717 845838929 /nfs/dbraw/zinc/83/89/29/845838929.db2.gz BPRVMWSPGLBVAQ-UHFFFAOYSA-N 0 3 417.937 4.142 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Cc3csc(-c4cccs4)n3)cc2)CC1 ZINC000011949813 845842761 /nfs/dbraw/zinc/84/27/61/845842761.db2.gz NSQGCRVIGHZHGM-UHFFFAOYSA-N 0 3 412.584 4.195 20 0 HIADHN CN(CC(=O)Nc1ccc(N2CCN(Cc3ccccc3)CC2)cc1)c1ccccc1 ZINC000015376460 846041917 /nfs/dbraw/zinc/04/19/17/846041917.db2.gz BQTZXGXKGZDJII-UHFFFAOYSA-N 0 3 414.553 4.084 20 0 HIADHN CCOc1ccc(NC(=S)NC[C@@H](c2cccc(OC)c2)N(CC)CC)cc1 ZINC000017516615 846255979 /nfs/dbraw/zinc/25/59/79/846255979.db2.gz NSZZVZDINMIQQE-NRFANRHFSA-N 0 3 401.576 4.463 20 0 HIADHN CCCn1c(SCC(=O)C(C#N)c2nc(C)cs2)nnc1-c1cccc(C)c1 ZINC000020067517 846378950 /nfs/dbraw/zinc/37/89/50/846378950.db2.gz TYYPDDTUKIDUCF-MRXNPFEDSA-N 0 3 411.556 4.397 20 0 HIADHN CCOc1ccc(C(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)cc1OC ZINC000022680746 846602631 /nfs/dbraw/zinc/60/26/31/846602631.db2.gz AINNSNNFSZFEDO-SFHVURJKSA-N 0 3 402.560 4.358 20 0 HIADHN CC1CCN([C@H](CNC(=O)c2c[nH]nc2-c2ccc(F)cc2)c2cccs2)CC1 ZINC000022681467 846602822 /nfs/dbraw/zinc/60/28/22/846602822.db2.gz OAJCTSRPQFUKLH-LJQANCHMSA-N 0 3 412.534 4.480 20 0 HIADHN CCOc1cc(CNCc2ccc(C(F)(F)F)cc2)ccc1O[C@H](C)C(=O)N(C)C ZINC000022744400 846613589 /nfs/dbraw/zinc/61/35/89/846613589.db2.gz WLFTVJKCHILSHD-OAHLLOKOSA-N 0 3 424.463 4.249 20 0 HIADHN CCOc1cc(CNCc2cccc(C(F)(F)F)c2)ccc1O[C@H](C)C(=O)N(C)C ZINC000022774399 846619228 /nfs/dbraw/zinc/61/92/28/846619228.db2.gz HQWSAIHGZWHTAR-OAHLLOKOSA-N 0 3 424.463 4.249 20 0 HIADHN CCNC(=O)COc1ccc(CN[C@H](C)c2cccc(C(F)(F)F)c2)cc1OC ZINC000022784556 846620611 /nfs/dbraw/zinc/62/06/11/846620611.db2.gz PJOSKHKLKFICID-CQSZACIVSA-N 0 3 410.436 4.080 20 0 HIADHN Cc1c(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)cnn1-c1cccc(Cl)c1 ZINC000024556120 846837200 /nfs/dbraw/zinc/83/72/00/846837200.db2.gz VLHQEXQWLWCRRW-QFIPXVFZSA-N 0 3 408.933 4.401 20 0 HIADHN CN(C)Cc1ccccc1NC(=O)C1CCN(c2ccc(C(F)(F)F)cn2)CC1 ZINC000024811006 846871543 /nfs/dbraw/zinc/87/15/43/846871543.db2.gz KFHLRSGLGXGPLV-UHFFFAOYSA-N 0 3 406.452 4.017 20 0 HIADHN O[C@@H](COc1cc(Cl)ccc1Cl)CN1CCC[C@@H]1c1ccc2c(c1)OCCO2 ZINC000025227991 846944769 /nfs/dbraw/zinc/94/47/69/846944769.db2.gz UFVHFZPLLCCBHD-SJLPKXTDSA-N 0 3 424.324 4.341 20 0 HIADHN CCCc1ccc([C@H](NCC(=O)Nc2oc(C)c3c2c(=O)[nH]nc3C)C(C)C)cc1 ZINC000025817377 847041458 /nfs/dbraw/zinc/04/14/58/847041458.db2.gz JCFVBKBGPOALMM-OAQYLSRUSA-N 0 3 410.518 4.011 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cc(F)ccc1Br)c1cccc(OC)c1 ZINC000025861362 847047472 /nfs/dbraw/zinc/04/74/72/847047472.db2.gz HTARWGVCDMMTRS-IBGZPJMESA-N 0 3 423.326 4.410 20 0 HIADHN COc1ccc(OC)c([C@@H](C)NC[C@H](O)COc2ccc(-c3ccccc3)cc2)c1 ZINC000026715161 847190137 /nfs/dbraw/zinc/19/01/37/847190137.db2.gz DSFCTOMVUIIWAY-NQIIRXRSSA-N 0 3 407.510 4.461 20 0 HIADHN Cc1nc(COc2ccc(CN[C@@H](C)c3ccc4c(c3)NC(=O)CO4)cc2)cs1 ZINC000027221551 847268559 /nfs/dbraw/zinc/26/85/59/847268559.db2.gz FRZHNLVKECADIN-AWEZNQCLSA-N 0 3 409.511 4.212 20 0 HIADHN COc1ccc(OC)c([C@@H]2CCCN2C[C@@H](O)COc2cccc3ccccc32)c1 ZINC000027279807 847277398 /nfs/dbraw/zinc/27/73/98/847277398.db2.gz NJYICBNSXXBZBE-XXBNENTESA-N 0 3 407.510 4.434 20 0 HIADHN COc1cccc([C@H](CNC(=O)CCc2ncc(-c3ccccc3)o2)N2CCCC2)c1 ZINC000027342964 847286342 /nfs/dbraw/zinc/28/63/42/847286342.db2.gz RQDOVPUZVHUNMS-QFIPXVFZSA-N 0 3 419.525 4.236 20 0 HIADHN CC(C)c1c(C(=O)N[C@@H](C)CN2CCCCC2)cnn1-c1ccc(C(F)(F)F)cn1 ZINC000027766693 847348835 /nfs/dbraw/zinc/34/88/35/847348835.db2.gz TVUCVEAXDHDVBS-HNNXBMFYSA-N 0 3 423.483 4.014 20 0 HIADHN Fc1cc(CN2CCCN(Cc3ccc(C(F)(F)F)cc3)CC2)c2c(c1)COCO2 ZINC000028260365 847399585 /nfs/dbraw/zinc/39/95/85/847399585.db2.gz HMMZQSMNOWJRJE-UHFFFAOYSA-N 0 3 424.438 4.419 20 0 HIADHN C[C@H](NC(=O)NCCCN1CCc2ccccc2C1)c1ccc(Br)cc1 ZINC000028353069 847410683 /nfs/dbraw/zinc/41/06/83/847410683.db2.gz LEXBOQAINBLLBS-INIZCTEOSA-N 0 3 416.363 4.258 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)COc3cc(Cl)ccc3Cl)c(C)c2)CC1 ZINC000028779185 847459357 /nfs/dbraw/zinc/45/93/57/847459357.db2.gz UWBPISMMRYGMQH-UHFFFAOYSA-N 0 3 422.356 4.461 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)c1cccc(OCc2cscn2)c1 ZINC000029178949 847520963 /nfs/dbraw/zinc/52/09/63/847520963.db2.gz QQYLDADYNVWWHV-QFIPXVFZSA-N 0 3 407.539 4.289 20 0 HIADHN O=C(Cc1csc(-c2cccc(F)c2)n1)N[C@H](CN1CCCC1)c1ccccc1 ZINC000029178793 847520983 /nfs/dbraw/zinc/52/09/83/847520983.db2.gz VLNBWOUCSSRECV-OAQYLSRUSA-N 0 3 409.530 4.445 20 0 HIADHN O=C(COc1ccc(Oc2ccccn2)cc1)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000029179704 847522184 /nfs/dbraw/zinc/52/21/84/847522184.db2.gz RGBNJEQIGUEYNQ-QHCPKHFHSA-N 0 3 417.509 4.206 20 0 HIADHN Cc1nc(-c2ccc(CNC(=O)N[C@H](CN3CCCC3)c3ccccc3)o2)cs1 ZINC000029326537 847545641 /nfs/dbraw/zinc/54/56/41/847545641.db2.gz PEKIJERUTFOHRL-LJQANCHMSA-N 0 3 410.543 4.348 20 0 HIADHN O=C(CCCc1ccc(Br)s1)NCCCN1CCc2ccccc2C1 ZINC000029840498 847631190 /nfs/dbraw/zinc/63/11/90/847631190.db2.gz KEJBPHSFPUAVLK-UHFFFAOYSA-N 0 3 421.404 4.398 20 0 HIADHN Cc1cc(Br)c(NC(=O)CN(C)[C@@H](C)C(C)C)c(Br)c1 ZINC000030148670 847681988 /nfs/dbraw/zinc/68/19/88/847681988.db2.gz GHELPKNRPHTPTA-NSHDSACASA-N 0 3 406.162 4.435 20 0 HIADHN COc1cc(CN2CCC(C(=O)Nc3ccc(Br)cn3)CC2)ccc1C ZINC000436483330 861820268 /nfs/dbraw/zinc/82/02/68/861820268.db2.gz DOGUTHAENHHSDN-UHFFFAOYSA-N 0 3 418.335 4.012 20 0 HIADHN CC[C@H](CNC(=O)Cc1csc(Cc2ccccc2)n1)N1CCc2ccccc2C1 ZINC000030642171 847750751 /nfs/dbraw/zinc/75/07/51/847750751.db2.gz KSTLTIPZWYMJRZ-HSZRJFAPSA-N 0 3 419.594 4.230 20 0 HIADHN O=C(CNCc1ccc(-c2cccc(Br)c2)s1)NCc1ccco1 ZINC000030641845 847751397 /nfs/dbraw/zinc/75/13/97/847751397.db2.gz CLEISFRJGCDWQS-UHFFFAOYSA-N 0 3 405.317 4.177 20 0 HIADHN COc1ccc(CNCc2ccccc2Cn2ccnc2)cc1OCc1cccnc1 ZINC000030651541 847752068 /nfs/dbraw/zinc/75/20/68/847752068.db2.gz NNRLLKSOBDGUJJ-UHFFFAOYSA-N 0 3 414.509 4.204 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2CNCc2cccnc2-n2cccn2)o1 ZINC000030902238 847795095 /nfs/dbraw/zinc/79/50/95/847795095.db2.gz COJLLLSMKBWCHV-UHFFFAOYSA-N 0 3 410.481 4.311 20 0 HIADHN C[C@H](NC(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1)c1ccc2c(c1)OCO2 ZINC000031101869 847823419 /nfs/dbraw/zinc/82/34/19/847823419.db2.gz DCADKESHFNJXSJ-WMZOPIPTSA-N 0 3 415.559 4.310 20 0 HIADHN Cc1ccccc1CN1CCCN(C(=O)c2cc3c(cccc3OC(F)F)[nH]2)CC1 ZINC000031417247 847881681 /nfs/dbraw/zinc/88/16/81/847881681.db2.gz IPMWXLPYORCSGW-UHFFFAOYSA-N 0 3 413.468 4.426 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)c1cccc(OCc2cccs2)c1 ZINC000031957541 847970674 /nfs/dbraw/zinc/97/06/74/847970674.db2.gz UIMIVFBRHKYDRM-UHFFFAOYSA-N 0 3 416.612 4.419 20 0 HIADHN CC(C)(C)OC(=O)Nc1cccc(C(=O)NCC2(N3CCSCC3)CCCC2)c1 ZINC000031959698 847972253 /nfs/dbraw/zinc/97/22/53/847972253.db2.gz HFHGDKUKUKDKJD-UHFFFAOYSA-N 0 3 419.591 4.125 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cccc(NC(=O)NC(C)C)c1)c1ccsc1 ZINC000031982998 847974709 /nfs/dbraw/zinc/97/47/09/847974709.db2.gz BHYQISQDFSLHSV-IBGZPJMESA-N 0 3 402.564 4.091 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)CCc1c(C)nc(SC)nc1C)c1ccsc1 ZINC000031986414 847975977 /nfs/dbraw/zinc/97/59/77/847975977.db2.gz WMBTUFJCOKOJPF-SFHVURJKSA-N 0 3 406.621 4.009 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)c3ccc4ccccc4c3)CC2)c1 ZINC000032067650 847985320 /nfs/dbraw/zinc/98/53/20/847985320.db2.gz QZCLKDTVPYFPSZ-UHFFFAOYSA-N 0 3 401.554 4.480 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)COc3ccccc3C(F)(F)F)c(C)c2)CC1 ZINC000032235477 847992465 /nfs/dbraw/zinc/99/24/65/847992465.db2.gz LSSWUZJJKDXCHG-UHFFFAOYSA-N 0 3 421.463 4.173 20 0 HIADHN Cc1ccc(-c2nc(CC(=O)NCC(C)(C)N3CCc4ccccc4C3)cs2)o1 ZINC000032369318 848014217 /nfs/dbraw/zinc/01/42/17/848014217.db2.gz BRELYEXOXZPQJP-UHFFFAOYSA-N 0 3 409.555 4.207 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)c1ccc(COc2ccc(F)cc2)o1 ZINC000032401009 848020124 /nfs/dbraw/zinc/02/01/24/848020124.db2.gz HQEAMSDMHZCYQO-UHFFFAOYSA-N 0 3 408.473 4.176 20 0 HIADHN CC[C@@H](CNC(=O)Cc1csc(-c2cccc(F)c2)n1)N1CCc2ccccc2C1 ZINC000032446895 848028115 /nfs/dbraw/zinc/02/81/15/848028115.db2.gz ZQWCKSZEHMKWEB-QFIPXVFZSA-N 0 3 423.557 4.445 20 0 HIADHN CC[C@H](CNC(=O)CCc1ncc(-c2ccccc2F)o1)N1CCc2ccccc2C1 ZINC000032447174 848028562 /nfs/dbraw/zinc/02/85/62/848028562.db2.gz PXDUFQVPSSBNKK-HXUWFJFHSA-N 0 3 421.516 4.366 20 0 HIADHN O=C(Cn1c2ccccc2nc1C(F)(F)F)NC[C@H](c1cccs1)N1CCCC1 ZINC000032761287 848072617 /nfs/dbraw/zinc/07/26/17/848072617.db2.gz OYRKLCBKBUZUCT-MRXNPFEDSA-N 0 3 422.476 4.070 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)C1(c2ccc(Br)cc2)CC1 ZINC000032762605 848073439 /nfs/dbraw/zinc/07/34/39/848073439.db2.gz SAZMWYVZQDPHAM-KRWDZBQOSA-N 0 3 419.388 4.496 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)c2cc(Cc3ccccc3)ccc2O)CC1 ZINC000436601925 861865220 /nfs/dbraw/zinc/86/52/20/861865220.db2.gz IPCUWQLAEOSDQV-IBGZPJMESA-N 0 3 415.537 4.333 20 0 HIADHN Cc1ccc(-n2ncc(C(=O)NCc3ccccc3CN(C)C)c2C(F)(F)F)cc1 ZINC000036714492 848156779 /nfs/dbraw/zinc/15/67/79/848156779.db2.gz JCNUSAFVOPLADB-UHFFFAOYSA-N 0 3 416.447 4.191 20 0 HIADHN CCOc1c(Cl)cc(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)cc1OC ZINC000036883715 848171787 /nfs/dbraw/zinc/17/17/87/848171787.db2.gz SQHOQXPDQVKMPX-IBGZPJMESA-N 0 3 402.922 4.314 20 0 HIADHN CN(C)c1ccc([C@@H](CNC(=O)C(c2ccccc2)c2ccccc2)N(C)C)cc1 ZINC000038635283 848179293 /nfs/dbraw/zinc/17/92/93/848179293.db2.gz XWVAHDBAHPFILL-XMMPIXPASA-N 0 3 401.554 4.304 20 0 HIADHN O=C1NCN(c2ccccc2)C12CCN(Cc1ccccc1Oc1ccccc1)CC2 ZINC000038877240 848180637 /nfs/dbraw/zinc/18/06/37/848180637.db2.gz BADZXTZXACNNFI-UHFFFAOYSA-N 0 3 413.521 4.407 20 0 HIADHN N#CC(C(=O)CCCc1nc(-c2ccc(Cl)cc2)no1)c1nc2ccccc2[nH]1 ZINC000041494184 848221480 /nfs/dbraw/zinc/22/14/80/848221480.db2.gz OISDKJDUEYZWSN-HNNXBMFYSA-N 0 3 405.845 4.465 20 0 HIADHN CC(C)NS(=O)(=O)Cc1ccc(CNCc2ccc(Cl)c(Cl)c2)cc1 ZINC000042564716 848328528 /nfs/dbraw/zinc/32/85/28/848328528.db2.gz XDKCXVBAUSVBRW-UHFFFAOYSA-N 0 3 401.359 4.111 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)N(Cc1cccs1)C[C@@H]1CCCO1 ZINC000042813351 848356339 /nfs/dbraw/zinc/35/63/39/848356339.db2.gz FBJFVSQTLXIZHY-UNMCSNQZSA-N 0 3 413.587 4.276 20 0 HIADHN CC(C)CN1CCN(Cn2nc(-c3cccs3)n(-c3ccccc3)c2=S)CC1 ZINC000042912149 848364918 /nfs/dbraw/zinc/36/49/18/848364918.db2.gz BRHLCMLWIWTSOK-UHFFFAOYSA-N 0 3 413.616 4.363 20 0 HIADHN CN(C)Cc1cccc(NC(=O)c2cc(Cl)ccc2I)c1 ZINC000043039829 848377695 /nfs/dbraw/zinc/37/76/95/848377695.db2.gz RSVLKRUHDGQZIV-UHFFFAOYSA-N 0 3 414.674 4.259 20 0 HIADHN CC(C)[C@@H](NC(=O)NC[C@H](c1cccs1)N1CCCC1)c1nc2ccccc2[nH]1 ZINC000043107357 848385892 /nfs/dbraw/zinc/38/58/92/848385892.db2.gz GVRALBWLNQYFSI-UYAOXDASSA-N 0 3 411.575 4.458 20 0 HIADHN CN(Cc1ccc(Br)o1)C(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000043231253 848397382 /nfs/dbraw/zinc/39/73/82/848397382.db2.gz WEKAGZRXLZBUBW-AWEZNQCLSA-N 0 3 412.353 4.082 20 0 HIADHN COc1ccc(NC(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)cc1OC ZINC000043268134 848401134 /nfs/dbraw/zinc/40/11/34/848401134.db2.gz RPCRJXPLMNWMQI-QGZVFWFLSA-N 0 3 403.548 4.360 20 0 HIADHN CCOc1cc(NC(=O)NC[C@H](c2cccc(OC)c2)N2CCCC2)ccc1OC ZINC000043306872 848407732 /nfs/dbraw/zinc/40/77/32/848407732.db2.gz ZTEBMZOALHGHFV-HXUWFJFHSA-N 0 3 413.518 4.061 20 0 HIADHN CCN(CC)C(=O)c1cccc(NC(=O)NC[C@H](c2cccs2)N2CCCC2)c1 ZINC000043499214 848432296 /nfs/dbraw/zinc/43/22/96/848432296.db2.gz RNGJFDDPFLXBIX-LJQANCHMSA-N 0 3 414.575 4.189 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCc3ccc(OC(C)C)cc3)c(C)c2)CC1 ZINC000043522307 848434822 /nfs/dbraw/zinc/43/48/22/848434822.db2.gz GIHYHYORFOLCBQ-UHFFFAOYSA-N 0 3 410.562 4.246 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N[C@H]3CCSc4ccccc43)c(C)c2)CC1 ZINC000043522048 848435059 /nfs/dbraw/zinc/43/50/59/848435059.db2.gz LZUJPVITXQLCDD-NRFANRHFSA-N 0 3 410.587 4.496 20 0 HIADHN CC[N@@H+]1CCC[C@H]1CNC(=S)Nc1ccc([O-])c(-c2nc3ccccc3s2)c1 ZINC000043563171 848439843 /nfs/dbraw/zinc/43/98/43/848439843.db2.gz LMNQNWYMOBQIHW-HNNXBMFYSA-N 0 3 412.584 4.440 20 0 HIADHN CC[N@H+]1CCC[C@H]1CNC(=S)Nc1ccc([O-])c(-c2nc3ccccc3s2)c1 ZINC000043563171 848439848 /nfs/dbraw/zinc/43/98/48/848439848.db2.gz LMNQNWYMOBQIHW-HNNXBMFYSA-N 0 3 412.584 4.440 20 0 HIADHN CC[C@H](CNC(=O)Nc1ccc(NC(=O)C(C)C)cc1)N1CCc2ccccc2C1 ZINC000043674226 848447937 /nfs/dbraw/zinc/44/79/37/848447937.db2.gz VOCIKUPVSOHLPN-JOCHJYFZSA-N 0 3 408.546 4.240 20 0 HIADHN CN(C)C[C@@H]1CCc2ccccc2N1C(=O)CCc1nc(-c2ccc(Cl)cc2)no1 ZINC000436727230 861910540 /nfs/dbraw/zinc/91/05/40/861910540.db2.gz YPGPEWCUWDHFHH-IBGZPJMESA-N 0 3 424.932 4.232 20 0 HIADHN C[C@H](c1ccccc1Cl)N1CCN(C(=O)Nc2cccc(CN(C)C)c2)CC1 ZINC000044277003 848539642 /nfs/dbraw/zinc/53/96/42/848539642.db2.gz PNICAXDAXJFSRG-QGZVFWFLSA-N 0 3 400.954 4.312 20 0 HIADHN CCN(Cc1ccccc1NC(=O)NC[C@H](c1ccsc1)N(CC)CC)C(C)=O ZINC000044383912 848555018 /nfs/dbraw/zinc/55/50/18/848555018.db2.gz IRLVVDFXKBVXQH-OAQYLSRUSA-N 0 3 416.591 4.321 20 0 HIADHN CC(C)CN(CCN(C)C)C(=O)N[C@@H](C)c1cccc(NC(=O)c2ccccc2)c1 ZINC000045721692 848717868 /nfs/dbraw/zinc/71/78/68/848717868.db2.gz BZRMBICCUOOGII-IBGZPJMESA-N 0 3 410.562 4.229 20 0 HIADHN CC(C)CN(CCN(C)C)C(=O)N[C@H](C)c1cccc(NC(=O)c2ccccc2)c1 ZINC000045721694 848718171 /nfs/dbraw/zinc/71/81/71/848718171.db2.gz BZRMBICCUOOGII-LJQANCHMSA-N 0 3 410.562 4.229 20 0 HIADHN C[C@H](C(=O)Nc1ccc2c(c1)OC1(CCCCC1)O2)N1CCN(C2CCCC2)CC1 ZINC000045769248 848724902 /nfs/dbraw/zinc/72/49/02/848724902.db2.gz GGHIAPBFHDEXQQ-GOSISDBHSA-N 0 3 413.562 4.005 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(NC(=O)C2CC2)cc1)C(=O)Nc1ccc(OC(F)F)cc1 ZINC000045812664 848733787 /nfs/dbraw/zinc/73/37/87/848733787.db2.gz NHDBZLLQZIIYNC-UONOGXRCSA-N 0 3 417.456 4.314 20 0 HIADHN C=CCNc1nnc(SCC(=O)C(C#N)c2nc(-c3ccccc3)cs2)s1 ZINC000046581817 848879096 /nfs/dbraw/zinc/87/90/96/848879096.db2.gz GAJKXALFSXNROW-ZDUSSCGKSA-N 0 3 413.553 4.228 20 0 HIADHN Cc1ccc(C(=O)N(CCc2ccccc2)CCN(C)C)cc1NC(=O)c1ccco1 ZINC000046917371 848958975 /nfs/dbraw/zinc/95/89/75/848958975.db2.gz AFTBTSPBNBUFEJ-UHFFFAOYSA-N 0 3 419.525 4.087 20 0 HIADHN Cc1nn(Cc2ccccc2Cl)c(Cl)c1C(=O)NCCN1CCC[C@H](C)C1 ZINC000047148453 848993270 /nfs/dbraw/zinc/99/32/70/848993270.db2.gz LEVSWNBWRQCNON-AWEZNQCLSA-N 0 3 409.361 4.008 20 0 HIADHN CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)/C=C/c1ccc2ccc(Cl)cc2n1 ZINC000047234443 849009561 /nfs/dbraw/zinc/00/95/61/849009561.db2.gz LDRANTXXYSKGHB-VAWYXSNFSA-N 0 3 418.928 4.363 20 0 HIADHN CN(C)Cc1cccc(NC(=O)C2CCN(C(=O)c3cccc4ccccc43)CC2)c1 ZINC000047453698 849051069 /nfs/dbraw/zinc/05/10/69/849051069.db2.gz WYTACJLIXCQTKT-UHFFFAOYSA-N 0 3 415.537 4.392 20 0 HIADHN CC(C)c1ccc(-n2cnnc2SCC(=O)Nc2cccc(CN(C)C)c2)cc1 ZINC000047460353 849051893 /nfs/dbraw/zinc/05/18/93/849051893.db2.gz YTXASJAEEKYEQW-UHFFFAOYSA-N 0 3 409.559 4.183 20 0 HIADHN CCOC(=O)Nc1ccc(NC(=O)NC[C@@H](CC)N2CCc3ccccc3C2)cc1 ZINC000047945926 849141626 /nfs/dbraw/zinc/14/16/26/849141626.db2.gz BCEISYSBLRKRPO-OAQYLSRUSA-N 0 3 410.518 4.213 20 0 HIADHN CCOc1ccc([C@@H](C)NC(=O)NC[C@H](c2cccs2)N2CCCC2)cc1OC ZINC000047956430 849143676 /nfs/dbraw/zinc/14/36/76/849143676.db2.gz YQLGQGKLCSFWSV-SJLPKXTDSA-N 0 3 417.575 4.353 20 0 HIADHN COc1ccc(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2)c(C(F)(F)F)c1 ZINC000048083327 849161360 /nfs/dbraw/zinc/16/13/60/849161360.db2.gz UWCDOZQIRYWJHK-UHFFFAOYSA-N 0 3 413.415 4.449 20 0 HIADHN CN(C)[C@H](CNC(=O)Nc1cccc(NC(=O)c2ccccc2)c1)Cc1ccccc1 ZINC000048481389 849230744 /nfs/dbraw/zinc/23/07/44/849230744.db2.gz WZQDHHWIDBBEGI-QHCPKHFHSA-N 0 3 416.525 4.233 20 0 HIADHN Cc1cc([C@H]2CCCN2C(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)on1 ZINC000049790442 849330155 /nfs/dbraw/zinc/33/01/55/849330155.db2.gz OYZBXCJUXIXDST-MSOLQXFVSA-N 0 3 402.564 4.364 20 0 HIADHN C[C@H]([NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1)c1cccc(-c2ccncc2)c1 ZINC000436826698 862007235 /nfs/dbraw/zinc/00/72/35/862007235.db2.gz IFSVRTYCSWPJPC-SFHVURJKSA-N 0 3 401.510 4.410 20 0 HIADHN C[C@@H]([NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1)c1ccc(OC(F)(F)F)cc1 ZINC000436825310 862007254 /nfs/dbraw/zinc/00/72/54/862007254.db2.gz CVHQTBDGIBIUKI-CQSZACIVSA-N 0 3 408.420 4.246 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2ccc(N3C[C@@H](C)O[C@H](C)C3)cc2)N(C)C)cc1 ZINC000050080070 849350385 /nfs/dbraw/zinc/35/03/85/849350385.db2.gz MWJRWKOCTBJVLE-PWHSHALESA-N 0 3 410.562 4.033 20 0 HIADHN Cc1ccc(C(=O)NC2CCN(C[C@H](O)c3ccc(C(F)(F)F)cc3)CC2)s1 ZINC000051098212 849432130 /nfs/dbraw/zinc/43/21/30/849432130.db2.gz VUZSOALGPRYQBP-KRWDZBQOSA-N 0 3 412.477 4.003 20 0 HIADHN Cc1cc2ncn(C[C@H](O)CN3CCC[C@@H]3c3nc4ccccc4s3)c2cc1C ZINC000051117915 849433547 /nfs/dbraw/zinc/43/35/47/849433547.db2.gz WLECEMGLMPGSRK-YLJYHZDGSA-N 0 3 406.555 4.461 20 0 HIADHN COc1ccc(CN(C)C[C@H](O)c2ccc(C(F)(F)F)cc2)cc1OC(F)F ZINC000051323762 849457942 /nfs/dbraw/zinc/45/79/42/849457942.db2.gz HBTDVBPNRSRQEH-HNNXBMFYSA-N 0 3 405.363 4.481 20 0 HIADHN COc1ccc(C(=O)NC[C@@H]2CCC[N@H+](C)[C@H]2c2ccc(C(F)(F)F)cc2)c([O-])c1 ZINC000436848527 862025816 /nfs/dbraw/zinc/02/58/16/862025816.db2.gz AJFGZLMIEQQXSA-YWZLYKJASA-N 0 3 422.447 4.233 20 0 HIADHN COc1ccc(C(=O)NC[C@@H]2CCC[N@@H+](C)[C@H]2c2ccc(C(F)(F)F)cc2)c([O-])c1 ZINC000436848527 862025835 /nfs/dbraw/zinc/02/58/35/862025835.db2.gz AJFGZLMIEQQXSA-YWZLYKJASA-N 0 3 422.447 4.233 20 0 HIADHN CN(C)Cc1cccc(NC(=O)Nc2ccc(CS(=O)(=O)C(C)(C)C)cc2)c1 ZINC000052139118 849553877 /nfs/dbraw/zinc/55/38/77/849553877.db2.gz QKCQKPQRCWQWDK-UHFFFAOYSA-N 0 3 403.548 4.106 20 0 HIADHN C[C@@H](CNC(=O)N1CCC(C(=O)c2ccc(Cl)cc2)CC1)N1CCC[C@H](C)C1 ZINC000052525289 849592386 /nfs/dbraw/zinc/59/23/86/849592386.db2.gz YFUNAPKVXHDRCK-IRXDYDNUSA-N 0 3 405.970 4.065 20 0 HIADHN Cc1ccc2c(CN3CCC[C@H](C(=O)Nc4ccc(Cl)cn4)C3)cc(=O)oc2c1 ZINC000052829615 849631374 /nfs/dbraw/zinc/63/13/74/849631374.db2.gz UYDFBAFGRHLZDF-HNNXBMFYSA-N 0 3 411.889 4.001 20 0 HIADHN CCOC(=O)N[C@H]1CCCN(CCC(=O)Nc2ccccc2Oc2ccccc2)C1 ZINC000052869861 849636206 /nfs/dbraw/zinc/63/62/06/849636206.db2.gz NWSAHNJTUYYLQF-SFHVURJKSA-N 0 3 411.502 4.018 20 0 HIADHN CC(C)CN(C(=O)CCc1nc(-c2ccc(C(C)C)cc2)no1)C1CCN(C)CC1 ZINC000053231541 849682329 /nfs/dbraw/zinc/68/23/29/849682329.db2.gz SVIMMNSTQXUMSE-UHFFFAOYSA-N 0 3 412.578 4.371 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)COc2ccc(Oc3ccccn3)cc2)C1 ZINC000054223758 849828878 /nfs/dbraw/zinc/82/88/78/849828878.db2.gz ACKMOYHAFQWKFC-CTNGQTDRSA-N 0 3 417.509 4.204 20 0 HIADHN Cc1ccc(C)c(NC(=O)CNC2(c3ccc(Br)cc3)CCOCC2)c1 ZINC000054394240 849858966 /nfs/dbraw/zinc/85/89/66/849858966.db2.gz QQNHLJCMWOAXHW-UHFFFAOYSA-N 0 3 417.347 4.300 20 0 HIADHN COC(=O)c1ccc(CNC2(c3ccc(Br)cc3)CCOCC2)cc1 ZINC000054394339 849859265 /nfs/dbraw/zinc/85/92/65/849859265.db2.gz BVZCIDWEVKSMJE-UHFFFAOYSA-N 0 3 404.304 4.031 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)Nc2cccc(OC[C@@H]3CCCO3)c2)C1 ZINC000054408915 849861813 /nfs/dbraw/zinc/86/18/13/849861813.db2.gz PQNNMPCZDZPBKZ-JZWVFAODSA-N 0 3 409.530 4.201 20 0 HIADHN COc1ccc2ccc([O-])c(C[NH+]3CCC(NC(=O)c4ccccc4C)CC3)c2c1 ZINC000054491707 849878827 /nfs/dbraw/zinc/87/88/27/849878827.db2.gz UCCHVKUSIMUJCH-UHFFFAOYSA-N 0 3 404.510 4.257 20 0 HIADHN CCOC(=O)N(C)c1ccc(NC(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)cc1 ZINC000054529504 849884043 /nfs/dbraw/zinc/88/40/43/849884043.db2.gz FILDVGMLTWFWNY-PXNSSMCTSA-N 0 3 410.518 4.236 20 0 HIADHN CCOC(=O)N(C)c1ccc(NC(=O)NC[C@@H](c2cccs2)N2CCCC2)cc1 ZINC000054529060 849884167 /nfs/dbraw/zinc/88/41/67/849884167.db2.gz LTHPIFMJLIBQNX-SFHVURJKSA-N 0 3 416.547 4.299 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)N(C)Cc2ccc(Br)o2)C1 ZINC000054719805 849912654 /nfs/dbraw/zinc/91/26/54/849912654.db2.gz MCLGNTGGJIGZQD-HOCLYGCPSA-N 0 3 406.324 4.019 20 0 HIADHN Cc1cc(C)cc(C(=O)N2CCC[C@@H](C(=O)C(C#N)c3nc4ccccc4o3)C2)c1 ZINC000054735695 849915725 /nfs/dbraw/zinc/91/57/25/849915725.db2.gz RMLTXMHRQSORGX-MJGOQNOKSA-N 0 3 401.466 4.173 20 0 HIADHN C[C@H](NC(=O)NCCN(C)Cc1ccccc1)c1ccc(OCc2cccnc2)cc1 ZINC000054764078 849919087 /nfs/dbraw/zinc/91/90/87/849919087.db2.gz FJRFHIBDATWXNA-FQEVSTJZSA-N 0 3 418.541 4.153 20 0 HIADHN Cc1ccc(C(=O)C2CCN(CCC(=O)N3CCc4sccc4C3)CC2)c(C)c1 ZINC000055902170 850201617 /nfs/dbraw/zinc/20/16/17/850201617.db2.gz KHZPFILYLTTWAA-UHFFFAOYSA-N 0 3 410.583 4.235 20 0 HIADHN Cc1ccc(NC(=O)[C@H](C)N2CCN(CCC(C)(C)C)CC2)c(Br)c1 ZINC000055934439 850210243 /nfs/dbraw/zinc/21/02/43/850210243.db2.gz YCFIICWEJKWDKP-INIZCTEOSA-N 0 3 410.400 4.138 20 0 HIADHN Cc1ccc(CNC(=O)[C@H](C)N[C@H](C)c2ccc(OCc3cccnc3)cc2)cc1 ZINC000056144237 850253652 /nfs/dbraw/zinc/25/36/52/850253652.db2.gz ORPGDBLRTRYECA-UXHICEINSA-N 0 3 403.526 4.325 20 0 HIADHN CCN1CCN(c2ccc(N[C@@H](C)C(=O)Nc3cccc(SC)c3)c(C)c2)CC1 ZINC000056170364 850269743 /nfs/dbraw/zinc/26/97/43/850269743.db2.gz GVVAFJMLJYOGLZ-SFHVURJKSA-N 0 3 412.603 4.298 20 0 HIADHN Cc1ccc(NC(=O)[C@H](NC2CCN(Cc3ccncc3)CC2)c2ccccc2)cc1 ZINC000056195789 850280164 /nfs/dbraw/zinc/28/01/64/850280164.db2.gz UPILYFXHPDLMFG-RUZDIDTESA-N 0 3 414.553 4.324 20 0 HIADHN CCc1ccc([C@H](CNC(=O)Nc2ccccc2C(=O)N(CC)CC)N(C)C)cc1 ZINC000056554314 850392043 /nfs/dbraw/zinc/39/20/43/850392043.db2.gz CNFJCDKJMNFSSL-QFIPXVFZSA-N 0 3 410.562 4.155 20 0 HIADHN CC(=O)Nc1ccc(Cl)c(NC(=O)N2CCCN(Cc3ccccc3C)CC2)c1 ZINC000056692717 850441639 /nfs/dbraw/zinc/44/16/39/850441639.db2.gz PSZUWNGKUGVSME-UHFFFAOYSA-N 0 3 414.937 4.347 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)NCc2ccnc(Oc3ccccc3)c2)o1 ZINC000056848338 850501890 /nfs/dbraw/zinc/50/18/90/850501890.db2.gz YJXTYCVLCRNOII-UHFFFAOYSA-N 0 3 408.502 4.049 20 0 HIADHN COc1cc([C@@H](C)NC(=O)N(CCN(C)C)Cc2ccc(C)o2)ccc1OC(C)C ZINC000056867347 850506281 /nfs/dbraw/zinc/50/62/81/850506281.db2.gz RNQVXUVAZNIJAP-GOSISDBHSA-N 0 3 417.550 4.218 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)[C@@H](C)Cc1ccccc1 ZINC000436959530 862140621 /nfs/dbraw/zinc/14/06/21/862140621.db2.gz AGVFGVLEDDBJQE-CVDCTZTESA-N 0 3 402.542 4.456 20 0 HIADHN CN1CCN(CCCNC(=O)c2ccc(-c3ccc(Cl)c(Cl)c3)s2)CC1 ZINC000058067167 850760422 /nfs/dbraw/zinc/76/04/22/850760422.db2.gz HHEXYELZWKHWKM-UHFFFAOYSA-N 0 3 412.386 4.089 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1ccccc1NC(=O)NC(C)C)c1ccsc1 ZINC000058132392 850770143 /nfs/dbraw/zinc/77/01/43/850770143.db2.gz DDRXSGAINWLCPJ-IBGZPJMESA-N 0 3 402.564 4.091 20 0 HIADHN CCN(CC)Cc1ccc(C(=O)NN=C2CCN(Cc3ccc(Cl)cc3)CC2)o1 ZINC000058199097 850781287 /nfs/dbraw/zinc/78/12/87/850781287.db2.gz YABUAFFOLKAKTK-UHFFFAOYSA-N 0 3 416.953 4.157 20 0 HIADHN C[C@@H]1CC[C@@H](C)[NH+]1[C@H]1CCCN(C(=O)c2cc(OCc3ccccc3)ccc2[O-])C1 ZINC000436989276 862168046 /nfs/dbraw/zinc/16/80/46/862168046.db2.gz NTPJYYDILFFCIW-SBHAEUEKSA-N 0 3 408.542 4.449 20 0 HIADHN CN(C)CCN(C(=O)c1n[nH]c(-c2ccccc2)c1Br)c1ccccc1 ZINC000058296779 850794746 /nfs/dbraw/zinc/79/47/46/850794746.db2.gz KBPWDYFGBRFQST-UHFFFAOYSA-N 0 3 413.319 4.048 20 0 HIADHN CN(C)CCN(C(=O)c1nc(-c2ccccc2)n2c1CCCCC2)c1ccccc1 ZINC000058297514 850796188 /nfs/dbraw/zinc/79/61/88/850796188.db2.gz BOPJJOZDFRSUEV-UHFFFAOYSA-N 0 3 402.542 4.485 20 0 HIADHN CC[C@H](c1ccccc1)[C@@H]1CCCN1CC(=O)Nc1cccc(C(=O)NC2CC2)c1 ZINC000058959195 850969565 /nfs/dbraw/zinc/96/95/65/850969565.db2.gz DWEDSZOKOKMUJT-PKTZIBPZSA-N 0 3 405.542 4.176 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)c1cccc(NC(=O)OC(C)(C)C)c1 ZINC000059001917 850976484 /nfs/dbraw/zinc/97/64/84/850976484.db2.gz YKZRNWFMMIMCKY-UHFFFAOYSA-N 0 3 415.509 4.377 20 0 HIADHN CC(C)(CNC(=O)Cc1ccc(F)c(Br)c1)N1CCc2ccccc2C1 ZINC000059590670 851008191 /nfs/dbraw/zinc/00/81/91/851008191.db2.gz XEIVFMKYSKZMII-UHFFFAOYSA-N 0 3 419.338 4.084 20 0 HIADHN Cc1cccc(Cn2nccc2NC(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)c1 ZINC000060107799 851043602 /nfs/dbraw/zinc/04/36/02/851043602.db2.gz DJECUCYQVKYNLL-UHFFFAOYSA-N 0 3 417.557 4.023 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2nn(-c3ccccc3C)c3c2CCC3)N(C)C)cc1 ZINC000060155535 851045225 /nfs/dbraw/zinc/04/52/25/851045225.db2.gz GPVFPOAULFKFTF-QHCPKHFHSA-N 0 3 402.542 4.011 20 0 HIADHN CCc1ccc([C@H](CNC(=O)CC2CCN(C(=O)OC(C)(C)C)CC2)N(C)C)cc1 ZINC000060143380 851045617 /nfs/dbraw/zinc/04/56/17/851045617.db2.gz NIBNUSQXDSLIJR-NRFANRHFSA-N 0 3 417.594 4.005 20 0 HIADHN C[C@@H](Oc1cccc(Cl)c1)C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000060221007 851053497 /nfs/dbraw/zinc/05/34/97/851053497.db2.gz NTCOYRFERRDRNP-MRXNPFEDSA-N 0 3 404.963 4.337 20 0 HIADHN COc1ccc(C)cc1-n1ccc(C(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)n1 ZINC000060238618 851054555 /nfs/dbraw/zinc/05/45/55/851054555.db2.gz LVBHJZDCIPRUIX-QHCPKHFHSA-N 0 3 418.541 4.065 20 0 HIADHN O=C(c1ccccc1Br)N1CCCN(CCCc2ccccc2)CC1 ZINC000060355416 851076284 /nfs/dbraw/zinc/07/62/84/851076284.db2.gz RZZDHBIFSYEFJF-UHFFFAOYSA-N 0 3 401.348 4.230 20 0 HIADHN CCN(C(=O)c1cnn(-c2ccccc2F)c1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000060480310 851113731 /nfs/dbraw/zinc/11/37/31/851113731.db2.gz QGYHKXAEFXJSDW-RXVVDRJESA-N 0 3 406.505 4.309 20 0 HIADHN CCOc1ccc(-c2nc(C(=O)N(CCc3ccccc3)CCN(C)C)cs2)cc1 ZINC000060536671 851137882 /nfs/dbraw/zinc/13/78/82/851137882.db2.gz ZRFXMJXLTCJCPI-UHFFFAOYSA-N 0 3 423.582 4.455 20 0 HIADHN C[C@H](C(=O)Nc1ccc(OC(F)(F)F)cc1)N1CCN(CC2CCCCC2)CC1 ZINC000060569238 851151190 /nfs/dbraw/zinc/15/11/90/851151190.db2.gz RLWYETHXWUHQPA-MRXNPFEDSA-N 0 3 413.484 4.110 20 0 HIADHN CN(C)Cc1cccc(NC(=O)C(=O)N2CC=C(c3cccc4ccccc43)CC2)c1 ZINC000060684402 851187785 /nfs/dbraw/zinc/18/77/85/851187785.db2.gz CKSDSLUQDSPWQJ-UHFFFAOYSA-N 0 3 413.521 4.156 20 0 HIADHN CC[C@@H](NC(=O)NC[C@@H](c1ccc(OC)cc1)N1CCCC1)c1ccccc1OC ZINC000061024578 851276944 /nfs/dbraw/zinc/27/69/44/851276944.db2.gz VVQSTDUHFJLYEW-YADHBBJMSA-N 0 3 411.546 4.291 20 0 HIADHN CN(Cc1cc(Br)cs1)C[C@H](O)CO[C@@H]1CCCc2ccccc21 ZINC000061042137 851282106 /nfs/dbraw/zinc/28/21/06/851282106.db2.gz WXEDHKVFJIYDLJ-QFBILLFUSA-N 0 3 410.377 4.398 20 0 HIADHN COc1ccccc1CN(C(=O)c1ccc(N2CCN(C(C)C)CC2)cc1)C1CC1 ZINC000061166855 851309056 /nfs/dbraw/zinc/30/90/56/851309056.db2.gz OTUNQUKIAWVCHT-UHFFFAOYSA-N 0 3 407.558 4.030 20 0 HIADHN CCc1ccc([C@H](CNC(=O)NCc2ccc(Br)s2)N(C)C)cc1 ZINC000061223064 851321563 /nfs/dbraw/zinc/32/15/63/851321563.db2.gz QIHGSRIZENLVJJ-INIZCTEOSA-N 0 3 410.381 4.175 20 0 HIADHN CC(C)Oc1ccc(CCNC(=O)NC[C@H](c2cccs2)N2CCCC2)cc1 ZINC000061231472 851324357 /nfs/dbraw/zinc/32/43/57/851324357.db2.gz WEVBCDIEGOJUDP-HXUWFJFHSA-N 0 3 401.576 4.214 20 0 HIADHN O=C(CCOc1ccc(F)cc1Cl)Nc1ccc(CCN2CCSCC2)cc1 ZINC000061287638 851339838 /nfs/dbraw/zinc/33/98/38/851339838.db2.gz OQHFRCNOBMEMEK-UHFFFAOYSA-N 0 3 422.953 4.478 20 0 HIADHN O=C(Cc1ccc(C(F)(F)F)cc1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000061288443 851340147 /nfs/dbraw/zinc/34/01/47/851340147.db2.gz JIKKTYDNVYNDNK-UHFFFAOYSA-N 0 3 408.489 4.478 20 0 HIADHN Cc1nn(C(C)(C)C)c(C)c1C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000061572098 851408372 /nfs/dbraw/zinc/40/83/72/851408372.db2.gz GDZFLCGUINLMMR-UHFFFAOYSA-N 0 3 400.592 4.099 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2cccc(C(=O)N3CCCC3)c2)N2CCCC2)cc1 ZINC000061749659 851438884 /nfs/dbraw/zinc/43/88/84/851438884.db2.gz HSHNSVYAGJGZDD-QHCPKHFHSA-N 0 3 420.557 4.190 20 0 HIADHN O=C(NCc1ncc(-c2ccccc2)o1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000061792065 851453663 /nfs/dbraw/zinc/45/36/63/851453663.db2.gz LNAVSCWLZDJVRG-UHFFFAOYSA-N 0 3 422.554 4.255 20 0 HIADHN CC(C)Oc1cccc(CNC(=O)Nc2ccc(CCN3CCSCC3)cc2)c1 ZINC000061791961 851453716 /nfs/dbraw/zinc/45/37/16/851453716.db2.gz KXIHBXFOYCQNLW-UHFFFAOYSA-N 0 3 413.587 4.387 20 0 HIADHN COc1cc(CN[C@H]2CCc3c2cccc3Cl)ccc1OCC(=O)N1CCCC1 ZINC000062258198 851518412 /nfs/dbraw/zinc/51/84/12/851518412.db2.gz UJODEUSNRGEBRA-FQEVSTJZSA-N 0 3 414.933 4.127 20 0 HIADHN COc1cc(C)c(NC(=O)N(CCN(C)C)Cc2cccc(Cl)c2)cc1OC ZINC000062375744 851532777 /nfs/dbraw/zinc/53/27/77/851532777.db2.gz PNXQWUYGDWFQLU-UHFFFAOYSA-N 0 3 405.926 4.261 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)Nc1cc2c(cc1Cl)OCCCO2 ZINC000062380343 851536199 /nfs/dbraw/zinc/53/61/99/851536199.db2.gz LROMNQIWJLNYGZ-UHFFFAOYSA-N 0 3 421.900 4.236 20 0 HIADHN COc1ccc(NC(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)cc1F ZINC000062393717 851539989 /nfs/dbraw/zinc/53/99/89/851539989.db2.gz VVUPGBMOPVNCJE-UHFFFAOYSA-N 0 3 413.415 4.449 20 0 HIADHN COCCOc1ccc(NC(=O)N(CCN(C)C)Cc2cccc(Cl)c2)c(C)c1 ZINC000062401205 851541537 /nfs/dbraw/zinc/54/15/37/851541537.db2.gz VONQYWWVQXRYQY-UHFFFAOYSA-N 0 3 419.953 4.269 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)Nc1ccc2c(c1)OC(C)(C)O2 ZINC000062411457 851545616 /nfs/dbraw/zinc/54/56/16/851545616.db2.gz OTCSDLDGZFGELT-UHFFFAOYSA-N 0 3 405.445 4.068 20 0 HIADHN CCN(CC)[C@H](CNCc1cc(OC)c(OC)cc1Br)c1ccco1 ZINC000062423794 851549287 /nfs/dbraw/zinc/54/92/87/851549287.db2.gz MNIJAQHFBJDVNH-MRXNPFEDSA-N 0 3 411.340 4.232 20 0 HIADHN C#CCN(Cc1ccc(F)cc1)C(=O)NC[C@H](c1cccc(OC)c1)N(CC)CC ZINC000062476835 851559993 /nfs/dbraw/zinc/55/99/93/851559993.db2.gz LXJDPJXGNNMKCV-HSZRJFAPSA-N 0 3 411.521 4.062 20 0 HIADHN CC(C)Oc1cccc([C@H](C)NC(=O)N(CCN(C)C)Cc2cccc(F)c2)c1 ZINC000062486152 851562925 /nfs/dbraw/zinc/56/29/25/851562925.db2.gz UCKFUUXYCFEFTL-SFHVURJKSA-N 0 3 401.526 4.447 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)N[C@@H](c1ccccc1)C(F)(F)F ZINC000062487121 851564257 /nfs/dbraw/zinc/56/42/57/851564257.db2.gz XCOWVPWGHABZAF-SFHVURJKSA-N 0 3 415.406 4.342 20 0 HIADHN S=C(N[C@H](c1ccco1)c1ccccc1)NC1CCN(Cc2ccccc2)CC1 ZINC000063145457 851621314 /nfs/dbraw/zinc/62/13/14/851621314.db2.gz OEZGDMFQMNDUTO-QHCPKHFHSA-N 0 3 405.567 4.498 20 0 HIADHN S=C(NC1CCN(Cc2ccccc2)CC1)N(Cc1ccco1)Cc1cccnc1 ZINC000063146963 851621369 /nfs/dbraw/zinc/62/13/69/851621369.db2.gz KHPHQGVODWCPKP-UHFFFAOYSA-N 0 3 420.582 4.216 20 0 HIADHN COCCCOc1ccccc1NC(=S)NC1CCN(Cc2ccccc2)CC1 ZINC000063150750 851623596 /nfs/dbraw/zinc/62/35/96/851623596.db2.gz YMENXSLRXQAQGF-UHFFFAOYSA-N 0 3 413.587 4.053 20 0 HIADHN FC(F)(F)c1ccccc1CCNC(=S)NC1CCN(Cc2ccccc2)CC1 ZINC000063150761 851623791 /nfs/dbraw/zinc/62/37/91/851623791.db2.gz KHSNRWJCGDFLBI-UHFFFAOYSA-N 0 3 421.532 4.377 20 0 HIADHN O[C@@H](COc1cccc(C(F)(F)F)c1)CN1CCC[C@@H]1c1ccc2c(c1)OCCO2 ZINC000063482695 851701184 /nfs/dbraw/zinc/70/11/84/851701184.db2.gz CIDOECDULUNTHT-IEBWSBKVSA-N 0 3 423.431 4.053 20 0 HIADHN Cc1cc(NC(=O)c2ccccc2Cl)sc1C(=O)NC[C@H](C)N1CCCC1 ZINC000063732704 851749988 /nfs/dbraw/zinc/74/99/88/851749988.db2.gz BQMHWELTADEFSU-AWEZNQCLSA-N 0 3 405.951 4.176 20 0 HIADHN COc1ccc(CCNCc2c(C)nn(Cc3ccc(F)cc3)c2Cl)c(OC)c1 ZINC000063776343 851760651 /nfs/dbraw/zinc/76/06/51/851760651.db2.gz XVXCEINTMNKVFD-UHFFFAOYSA-N 0 3 417.912 4.382 20 0 HIADHN COc1cccc(NC(=S)N(CCN(C)C)Cc2ccc(Br)cc2)c1 ZINC000063790073 851764986 /nfs/dbraw/zinc/76/49/86/851764986.db2.gz GSANUJBYOWXZNO-UHFFFAOYSA-N 0 3 422.392 4.218 20 0 HIADHN O=C(OCc1cccc(F)c1F)C1CCN(c2cc(Cl)ccc2Cl)C1=O ZINC000064072091 851824382 /nfs/dbraw/zinc/82/43/82/851824382.db2.gz LESFPSARJSERFR-LBPRGKRZSA-N 0 3 400.208 4.368 20 0 HIADHN Cc1cc(CNC(=O)N(CCN2CCCC2)Cc2ccc(Cl)c(Cl)c2)on1 ZINC000064230217 851852799 /nfs/dbraw/zinc/85/27/99/851852799.db2.gz VABMNQHEFSREAM-UHFFFAOYSA-N 0 3 411.333 4.097 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N(Cc2ccco2)C[C@@H]2CCCO2)N2CCCC2)cc1 ZINC000064236935 851855020 /nfs/dbraw/zinc/85/50/20/851855020.db2.gz WAICKNHHBJWHNT-GOTSBHOMSA-N 0 3 411.546 4.116 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)cc1 ZINC000064316604 851869394 /nfs/dbraw/zinc/86/93/94/851869394.db2.gz VKKWKYZOAHTQOO-HXUWFJFHSA-N 0 3 405.420 4.038 20 0 HIADHN COc1ccc(CNC(=O)CNCc2ccc(-c3ccc(Cl)cc3)s2)cc1 ZINC000064410938 851891252 /nfs/dbraw/zinc/89/12/52/851891252.db2.gz MWYFCDSFNUKNDQ-UHFFFAOYSA-N 0 3 400.931 4.483 20 0 HIADHN CC(C)OCc1cccc(NC(=O)NCCCCN2CCN(c3ccccc3)CC2)c1 ZINC000064534111 851923509 /nfs/dbraw/zinc/92/35/09/851923509.db2.gz OEWRPPLXMZPSNY-UHFFFAOYSA-N 0 3 424.589 4.336 20 0 HIADHN CC(C)OCc1cccc(NC(=O)NCCCN2CCN(C)C[C@@H]2c2ccccc2)c1 ZINC000064544067 851925268 /nfs/dbraw/zinc/92/52/68/851925268.db2.gz LNQULLPKXPOVQY-XMMPIXPASA-N 0 3 424.589 4.112 20 0 HIADHN Cc1nc(-c2cccc(NC(=O)NCC(C)(C)N3CCc4ccccc4C3)c2)no1 ZINC000064545281 851925526 /nfs/dbraw/zinc/92/55/26/851925526.db2.gz MRXMINVFHVJAIP-UHFFFAOYSA-N 0 3 405.502 4.003 20 0 HIADHN COc1cccc(CN(C[C@@H]2CCCO2)C(=O)c2cccc(CN3CCCC3)c2)c1 ZINC000064867079 852008617 /nfs/dbraw/zinc/00/86/17/852008617.db2.gz WPVJAEPTXCNWFD-DEOSSOPVSA-N 0 3 408.542 4.112 20 0 HIADHN COc1cc(CNCc2ccc3[nH]c(C)c(C)c3c2)ccc1OCC(=O)N1CCCC1 ZINC000065013591 852039069 /nfs/dbraw/zinc/03/90/69/852039069.db2.gz WDLWKDWQKUSWNL-UHFFFAOYSA-N 0 3 421.541 4.084 20 0 HIADHN CN(C)c1nc2sc(C(=O)N3CCCN(CC4CCCCC4)CC3)cc2s1 ZINC000065089983 852060805 /nfs/dbraw/zinc/06/08/05/852060805.db2.gz QQFHKFMAWMRELA-UHFFFAOYSA-N 0 3 406.621 4.152 20 0 HIADHN CN1CCC(NC(=S)N[C@@H](c2ccccc2)c2ccc(Br)cc2)CC1 ZINC000065222810 852089316 /nfs/dbraw/zinc/08/93/16/852089316.db2.gz GQQFROASKKHEKK-IBGZPJMESA-N 0 3 418.404 4.097 20 0 HIADHN Brc1ccc(OCc2ccccn2)c(CNCCc2nccs2)c1 ZINC000065276406 852096657 /nfs/dbraw/zinc/09/66/57/852096657.db2.gz KEPLOYBGZNSZAH-UHFFFAOYSA-N 0 3 404.333 4.212 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)Nc1ccc(C(C)(C)C)cc1)c1ccc(N2CCOCC2)cc1 ZINC000065278434 852097785 /nfs/dbraw/zinc/09/77/85/852097785.db2.gz OEADVNHQLNRJLE-MOPGFXCFSA-N 0 3 409.574 4.499 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N(Cc2cccc(F)c2)C[C@@H]2CCCO2)N(C)C)cc1 ZINC000065382970 852118609 /nfs/dbraw/zinc/11/86/09/852118609.db2.gz HORMEHXZKJJXTO-GOTSBHOMSA-N 0 3 413.537 4.128 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)Nc2nnc(Cc3ccccc3)s2)C1 ZINC000065437870 852132858 /nfs/dbraw/zinc/13/28/58/852132858.db2.gz PPZXIFRTRGEKIE-LPHOPBHVSA-N 0 3 407.543 4.086 20 0 HIADHN C[C@H]1C[C@H](C)CN(C(=O)c2ccccc2NC(=O)NCCN(C)Cc2ccccc2)C1 ZINC000065443652 852134955 /nfs/dbraw/zinc/13/49/55/852134955.db2.gz FSKOCBTVOSHMDA-PMACEKPBSA-N 0 3 422.573 4.058 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1cc(F)c(F)cc1F ZINC000437132777 862324304 /nfs/dbraw/zinc/32/43/04/862324304.db2.gz RCBIZMGYUWWDCO-MRXNPFEDSA-N 0 3 414.431 4.308 20 0 HIADHN CC[C@@H](C)NC(=O)c1ccc(NC(=O)N2CCCN(Cc3ccccc3C)CC2)cc1 ZINC000065458255 852142067 /nfs/dbraw/zinc/14/20/67/852142067.db2.gz GJRMIAUQJUEEDM-HXUWFJFHSA-N 0 3 422.573 4.263 20 0 HIADHN COc1cccc(CN2CCC(NC(=O)Cc3coc4cc5c(cc34)CCC5)CC2)c1 ZINC000065506167 852160431 /nfs/dbraw/zinc/16/04/31/852160431.db2.gz HXNMJMMARQCPGM-UHFFFAOYSA-N 0 3 418.537 4.253 20 0 HIADHN Cc1ccccc1-n1nc(C(=O)NC2CCN(Cc3ccccc3)CC2)c2c1CCC2 ZINC000065545273 852172708 /nfs/dbraw/zinc/17/27/08/852172708.db2.gz AYCNSWUSLDJTCM-UHFFFAOYSA-N 0 3 414.553 4.064 20 0 HIADHN Cc1ccccc1-n1nc(C(=O)N(CCN(C)C)Cc2ccccc2F)c2c1CCC2 ZINC000065620996 852202199 /nfs/dbraw/zinc/20/21/99/852202199.db2.gz ASBOHOZPYYZRGY-UHFFFAOYSA-N 0 3 420.532 4.013 20 0 HIADHN COc1ccc(-n2ccc(C(=O)NC[C@@H](c3ccccc3)N3CCC(C)CC3)n2)cc1 ZINC000065662975 852212216 /nfs/dbraw/zinc/21/22/16/852212216.db2.gz WLQMIKSDVICHHT-DEOSSOPVSA-N 0 3 418.541 4.084 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N(C)Cc1cc(C)on1)c1ccc(C(F)(F)F)cc1 ZINC000065697622 852222972 /nfs/dbraw/zinc/22/29/72/852222972.db2.gz ZRPYUDCMBHBLAW-GOSISDBHSA-N 0 3 412.456 4.226 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=S)Nc1ccc(OC(F)(F)F)cc1 ZINC000065704474 852226179 /nfs/dbraw/zinc/22/61/79/852226179.db2.gz IGKDXFWNCJGRMO-UHFFFAOYSA-N 0 3 415.456 4.485 20 0 HIADHN COc1ccc(NC(=S)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)cc1 ZINC000065704461 852226633 /nfs/dbraw/zinc/22/66/33/852226633.db2.gz KTTJONOTBWWMIK-UHFFFAOYSA-N 0 3 411.493 4.475 20 0 HIADHN CN(C)CCN(Cc1cccc(C#N)c1)C(=S)Nc1cccc(Br)c1 ZINC000065850274 852283401 /nfs/dbraw/zinc/28/34/01/852283401.db2.gz LQVZOOUOWRIZFU-UHFFFAOYSA-N 0 3 417.376 4.081 20 0 HIADHN O=C(NCc1ccc(Br)s1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000065866095 852290232 /nfs/dbraw/zinc/29/02/32/852290232.db2.gz RENPZOJKLRHTIU-AWEZNQCLSA-N 0 3 411.340 4.178 20 0 HIADHN O=C(NC1CCCC1)c1ccc(NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)cc1 ZINC000065873186 852296179 /nfs/dbraw/zinc/29/61/79/852296179.db2.gz HUCRAYKJFAXGMQ-HXUWFJFHSA-N 0 3 423.532 4.349 20 0 HIADHN CN(C)CCN(Cc1cccc(C#N)c1)C(=O)c1ccc(C2SCCS2)cc1 ZINC000065930024 852321003 /nfs/dbraw/zinc/32/10/03/852321003.db2.gz CCSHYNRCIADGFH-UHFFFAOYSA-N 0 3 411.596 4.241 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)Cc1ccc(Br)cc1 ZINC000065937229 852324447 /nfs/dbraw/zinc/32/44/47/852324447.db2.gz JFOKGRGODBXGJX-UHFFFAOYSA-N 0 3 409.755 4.235 20 0 HIADHN C[C@H]1C[C@H]1C(=O)Nc1cccc(C(=O)N(CCN(C)C)Cc2cccc(Cl)c2)c1 ZINC000065936730 852325198 /nfs/dbraw/zinc/32/51/98/852325198.db2.gz JLRJKFYOWAOAEB-HRAATJIYSA-N 0 3 413.949 4.139 20 0 HIADHN COCc1c2ccccc2oc1C(=O)N(CCN(C)C)Cc1ccc(F)cc1F ZINC000065937960 852326537 /nfs/dbraw/zinc/32/65/37/852326537.db2.gz AKSNBESJFBVEMH-UHFFFAOYSA-N 0 3 402.441 4.061 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)c1ccc(OC(F)(F)F)cc1 ZINC000065938249 852326851 /nfs/dbraw/zinc/32/68/51/852326851.db2.gz QORFWXQCLAMDTB-UHFFFAOYSA-N 0 3 402.363 4.067 20 0 HIADHN CCOc1ccc(SCC(=O)N(CCN(C)C)Cc2ccc(F)cc2F)cc1 ZINC000065938082 852327027 /nfs/dbraw/zinc/32/70/27/852327027.db2.gz OVEQXTDCIOULNP-UHFFFAOYSA-N 0 3 408.514 4.046 20 0 HIADHN COc1ccc(O[C@H](C)C(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)cc1 ZINC000065938976 852327784 /nfs/dbraw/zinc/32/77/84/852327784.db2.gz JFUPWFDNEGXWME-MRXNPFEDSA-N 0 3 424.463 4.072 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)CCc1ccccc1Br ZINC000065939415 852328223 /nfs/dbraw/zinc/32/82/23/852328223.db2.gz ZGPSEMRZYUUEFG-UHFFFAOYSA-N 0 3 407.327 4.111 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)c1ccc(NC(=O)c2ccccc2)cc1 ZINC000065939732 852329505 /nfs/dbraw/zinc/32/95/05/852329505.db2.gz CNEPNQGOKLVISV-UHFFFAOYSA-N 0 3 419.500 4.282 20 0 HIADHN O=C(NC1CCN(Cc2ccc(OCc3ccccn3)cc2)CC1)C1CCCCC1 ZINC000065962806 852332306 /nfs/dbraw/zinc/33/23/06/852332306.db2.gz BFCOODSNBOVFPA-UHFFFAOYSA-N 0 3 407.558 4.322 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N[C@H](C)c2ccc(N3CCCC3=O)cc2)N(C)C)cc1 ZINC000065995135 852349286 /nfs/dbraw/zinc/34/92/86/852349286.db2.gz RBVKVRHZLBXJJY-JPYJTQIMSA-N 0 3 422.573 4.039 20 0 HIADHN COc1cc(NC(=O)CN(Cc2ccccc2)C2CCCCC2)cc(OC)c1OC ZINC000071941648 852439804 /nfs/dbraw/zinc/43/98/04/852439804.db2.gz FYOZNIZBNDFQTA-UHFFFAOYSA-N 0 3 412.530 4.486 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N(CCC(F)(F)F)CC3CC3)c(C)c2)CC1 ZINC000437163981 862358184 /nfs/dbraw/zinc/35/81/84/862358184.db2.gz JAYKWBMQXNRWFF-UHFFFAOYSA-N 0 3 412.500 4.333 20 0 HIADHN CC1CCN([C@@H](CNC(=O)Cc2csc(-c3cccnc3)n2)c2ccccc2)CC1 ZINC000072006577 852461971 /nfs/dbraw/zinc/46/19/71/852461971.db2.gz OHFZTVSWCPNRRY-QFIPXVFZSA-N 0 3 420.582 4.337 20 0 HIADHN CCOc1cc(C(=O)N2CCN(CC3CCCCC3)CC2)cc(OCC)c1OCC ZINC000072041145 852482308 /nfs/dbraw/zinc/48/23/08/852482308.db2.gz OMKYYKOBMNGDTF-UHFFFAOYSA-N 0 3 418.578 4.221 20 0 HIADHN COc1ccc(OC)c([C@@H]2CCCN2C(=O)NC[C@H](c2ccc(C)cc2)N(C)C)c1 ZINC000072044333 852484581 /nfs/dbraw/zinc/48/45/81/852484581.db2.gz VZGBYTASOCBGAD-FCHUYYIVSA-N 0 3 411.546 4.162 20 0 HIADHN COc1ccc(OC)c([C@H]2CCCN2C(=O)NC[C@@H](c2ccc(C)cc2)N(C)C)c1 ZINC000072044332 852484775 /nfs/dbraw/zinc/48/47/75/852484775.db2.gz VZGBYTASOCBGAD-YADHBBJMSA-N 0 3 411.546 4.162 20 0 HIADHN C[C@@H](CN1CCCCC1)NC(=O)c1ccc(Oc2cccc(Br)c2)nc1 ZINC000078956903 852536828 /nfs/dbraw/zinc/53/68/28/852536828.db2.gz QHSQPTGLUFEIOU-HNNXBMFYSA-N 0 3 418.335 4.241 20 0 HIADHN CN(C)[C@@H](CNC(=O)N1CCC(c2c[nH]c3ccccc32)CC1)Cc1ccccc1 ZINC000097025797 852574002 /nfs/dbraw/zinc/57/40/02/852574002.db2.gz YHPBOUUQAIZSNG-OAQYLSRUSA-N 0 3 404.558 4.230 20 0 HIADHN O=C(NCc1ccc(Br)s1)N[C@H](CN1CCCC1)c1ccccc1 ZINC000097206258 852589744 /nfs/dbraw/zinc/58/97/44/852589744.db2.gz XKZFHVJOKFGBQF-MRXNPFEDSA-N 0 3 408.365 4.147 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000097261430 852593789 /nfs/dbraw/zinc/59/37/89/852593789.db2.gz UGLVFNSQTKJVJR-ZWKOTPCHSA-N 0 3 412.521 4.287 20 0 HIADHN CCc1ccc([C@H](CNC(=O)c2cc(C)n(Cc3ccccn3)c2C)N(C)C)cc1 ZINC000097285725 852596674 /nfs/dbraw/zinc/59/66/74/852596674.db2.gz ADDBBACZUBLLBP-DEOSSOPVSA-N 0 3 404.558 4.143 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cc(C)n(-c2nccs2)c1C)c1ccsc1 ZINC000097491245 852618378 /nfs/dbraw/zinc/61/83/78/852618378.db2.gz HMSCZHGEKDKHTH-SFHVURJKSA-N 0 3 402.589 4.425 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N[C@H](C)[C@H]3Oc4ccccc4[C@H]3C)c(C)c2)CC1 ZINC000437183747 862375695 /nfs/dbraw/zinc/37/56/95/862375695.db2.gz WPWOKAZJINFBLX-IECBHUPTSA-N 0 3 422.573 4.212 20 0 HIADHN Cc1cc(C)n(-c2ccc(Cl)c(C(=O)NC[C@H](c3ccccc3)N3CCCC3)n2)n1 ZINC000098076461 852655504 /nfs/dbraw/zinc/65/55/04/852655504.db2.gz PDXMZDNMAXFEEB-HXUWFJFHSA-N 0 3 423.948 4.104 20 0 HIADHN CN(C)[C@H](CNC(=O)CCCc1nc(-c2ccc(Cl)cc2)no1)c1ccccc1 ZINC000106118292 852755626 /nfs/dbraw/zinc/75/56/26/852755626.db2.gz MVHGGDMIOLDUFA-LJQANCHMSA-N 0 3 412.921 4.132 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)CSc3ccccc3Cl)cc2)CC1 ZINC000106188780 852761117 /nfs/dbraw/zinc/76/11/17/852761117.db2.gz AKSRQHGRUWKQRL-UHFFFAOYSA-N 0 3 403.979 4.208 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)C3(c4cccc(F)c4)CCC3)CC2)c1 ZINC000106217825 852762908 /nfs/dbraw/zinc/76/29/08/852762908.db2.gz GBNQIZABBKSRIB-UHFFFAOYSA-N 0 3 423.576 4.274 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Nc1ncc(Cc2ccccc2)s1 ZINC000437203592 862394056 /nfs/dbraw/zinc/39/40/56/862394056.db2.gz TYBUBURXQUTFBW-UHFFFAOYSA-N 0 3 400.573 4.391 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cc(C2CC2)n(C(C)(C)C)n1)c1cccc(OC)c1 ZINC000107821577 852800969 /nfs/dbraw/zinc/80/09/69/852800969.db2.gz SELQDSIMJVJVOC-QFIPXVFZSA-N 0 3 412.578 4.337 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)CCc1ncc(-c2ccccc2F)o1 ZINC000108680516 852871545 /nfs/dbraw/zinc/87/15/45/852871545.db2.gz PGYFIQHZGZXOMK-UHFFFAOYSA-N 0 3 413.468 4.143 20 0 HIADHN COc1ccc2[nH]cc(C3CCN([C@H](C)C(=O)N4CCc5sccc5C4)CC3)c2c1 ZINC000108971016 852901650 /nfs/dbraw/zinc/90/16/50/852901650.db2.gz MDUQSJNPNFKIAN-MRXNPFEDSA-N 0 3 423.582 4.391 20 0 HIADHN CCN(CC)[C@H](CNC(=O)CC1CCN(C(=O)OC(C)(C)C)CC1)c1ccsc1 ZINC000109292968 852948425 /nfs/dbraw/zinc/94/84/25/852948425.db2.gz IOOBURNCQALRHS-LJQANCHMSA-N 0 3 423.623 4.284 20 0 HIADHN O=C(NCc1ccnc(OC2CCCC2)c1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000109347217 852956917 /nfs/dbraw/zinc/95/69/17/852956917.db2.gz BWIQJXRJCMKUAP-FQEVSTJZSA-N 0 3 411.521 4.071 20 0 HIADHN COc1ccc2cc(C(=O)N(CCN(C)C)Cc3cccc(C(F)(F)F)c3)[nH]c2c1 ZINC000109357797 852957669 /nfs/dbraw/zinc/95/76/69/852957669.db2.gz NWFQVTBEKXXQFI-UHFFFAOYSA-N 0 3 419.447 4.399 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2ccc(F)cc2Br)N2CCCC2)cc1 ZINC000109505555 852978061 /nfs/dbraw/zinc/97/80/61/852978061.db2.gz YHIPBGIWSHMGNG-IBGZPJMESA-N 0 3 405.311 4.464 20 0 HIADHN Cc1oc(-c2ccccc2)nc1C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000109500368 852978132 /nfs/dbraw/zinc/97/81/32/852978132.db2.gz HGIUFYJGNSFNCA-UHFFFAOYSA-N 0 3 407.539 4.494 20 0 HIADHN O=C(CCc1nc2ccccc2s1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000109500523 852978567 /nfs/dbraw/zinc/97/85/67/852978567.db2.gz QSDARXLOSPHXMF-UHFFFAOYSA-N 0 3 411.596 4.459 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)[C@@H]1C[C@@H]1c1cccc(Br)c1 ZINC000109557931 852983737 /nfs/dbraw/zinc/98/37/37/852983737.db2.gz XQZZJWLHOMUNLG-NHCUHLMSSA-N 0 3 413.359 4.117 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)[C@@H]1C[C@H]1c1cccc(Br)c1 ZINC000109566225 852986287 /nfs/dbraw/zinc/98/62/87/852986287.db2.gz WKJXVZRHVSTFOY-RBUKOAKNSA-N 0 3 419.338 4.282 20 0 HIADHN CN(C)[C@H](CNC(=O)c1csc(-c2cnn(-c3ccccc3)c2)n1)c1ccccc1 ZINC000109879553 853028189 /nfs/dbraw/zinc/02/81/89/853028189.db2.gz QYFODBTYXVCDHN-OAQYLSRUSA-N 0 3 417.538 4.029 20 0 HIADHN Cc1[nH]c2ccc(CNC(=O)c3ccc(N4CCN(C(C)C)CC4)cc3)cc2c1C ZINC000109897319 853031564 /nfs/dbraw/zinc/03/15/64/853031564.db2.gz YJQKFLXLJYAKBG-UHFFFAOYSA-N 0 3 404.558 4.245 20 0 HIADHN Cc1cc(N(C)C)ccc1NC(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000110119855 853061283 /nfs/dbraw/zinc/06/12/83/853061283.db2.gz HVVATHVMJWKSRX-NRFANRHFSA-N 0 3 405.464 4.454 20 0 HIADHN CSc1cc2c(cc1NC(=O)[C@@H]1CCCN(Cc3cccc(F)c3)C1)OCCO2 ZINC000110156449 853067561 /nfs/dbraw/zinc/06/75/61/853067561.db2.gz GHPYFYDEPKHLDW-MRXNPFEDSA-N 0 3 416.518 4.170 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)c3cc4c(s3)-c3ccccc3CC4)CC2)C[C@H](C)O1 ZINC000110414566 853097699 /nfs/dbraw/zinc/09/76/99/853097699.db2.gz QNBXQZQEFYJGIN-HDICACEKSA-N 0 3 424.610 4.475 20 0 HIADHN Fc1cccc(-c2noc([C@@H]3CCCN(CCOCCOc4ccccc4)C3)n2)c1 ZINC000110476599 853106144 /nfs/dbraw/zinc/10/61/44/853106144.db2.gz MYTUDPSNONIGDZ-LJQANCHMSA-N 0 3 411.477 4.151 20 0 HIADHN Cc1nc(-c2ccc(C(F)(F)F)cc2)sc1C(=O)N1CC[C@@H](N2CCCC2)C1 ZINC000110521586 853112785 /nfs/dbraw/zinc/11/27/85/853112785.db2.gz KRDBVKLGKSQSNH-MRXNPFEDSA-N 0 3 409.477 4.448 20 0 HIADHN COc1ccc(CNCc2ccc(-n3cccn3)cc2)cc1OCc1cccnc1 ZINC000110568419 853119335 /nfs/dbraw/zinc/11/93/35/853119335.db2.gz FEZZBFOMFWZHCD-UHFFFAOYSA-N 0 3 400.482 4.145 20 0 HIADHN CCCN(Cc1csc(-c2ncccn2)n1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000110880082 853161404 /nfs/dbraw/zinc/16/14/04/853161404.db2.gz WFGWDUAGMTVCBG-OAQYLSRUSA-N 0 3 407.587 4.477 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)[C@H](c1ccccc1)N1CCCCC1=O)c1ccsc1 ZINC000110934607 853170470 /nfs/dbraw/zinc/17/04/70/853170470.db2.gz BKPKKQJVXSCFTK-UNMCSNQZSA-N 0 3 413.587 4.001 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)c3ccc(Cl)c(C(F)(F)F)c3)CC2)C[C@H](C)O1 ZINC000437233308 862437114 /nfs/dbraw/zinc/43/71/14/862437114.db2.gz FSZHRVIBAWIWFT-KBPBESRZSA-N 0 3 418.887 4.320 20 0 HIADHN CCN(CC)[C@@H](C(=O)NC[C@@H](c1ccccc1OC)N1CCCC1)c1ccccc1 ZINC000111075248 853197901 /nfs/dbraw/zinc/19/79/01/853197901.db2.gz KKEHNWTXOMPPQS-LADGPHEKSA-N 0 3 409.574 4.031 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)c3ccc(Cl)c(C(F)(F)F)c3)CC2)C[C@H](C)O1 ZINC000437233310 862438229 /nfs/dbraw/zinc/43/82/29/862438229.db2.gz FSZHRVIBAWIWFT-OKILXGFUSA-N 0 3 418.887 4.320 20 0 HIADHN C[C@@H]1Cc2ccccc2N1Cc1occc1C(=O)NCc1ccccc1CN(C)C ZINC000111151012 853211629 /nfs/dbraw/zinc/21/16/29/853211629.db2.gz YTLSUTROTBVXPJ-GOSISDBHSA-N 0 3 403.526 4.222 20 0 HIADHN Cc1nc(C(F)(F)F)ccc1C(=O)N1CCCN(CCCc2ccccc2)CC1 ZINC000116597466 853317939 /nfs/dbraw/zinc/31/79/39/853317939.db2.gz VFLXZGHGRBIIEY-UHFFFAOYSA-N 0 3 405.464 4.190 20 0 HIADHN CCn1c2ccccc2nc1[C@@H]1CCCN1C(=O)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000116596167 853317991 /nfs/dbraw/zinc/31/79/91/853317991.db2.gz BOFWDOSWAHVCOO-OFNKIYASSA-N 0 3 417.557 4.027 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)c1ccc(-c2ccccc2F)o1 ZINC000117485800 853358740 /nfs/dbraw/zinc/35/87/40/853358740.db2.gz FYCJUDRHVADFDL-UHFFFAOYSA-N 0 3 421.516 4.418 20 0 HIADHN COc1cc(Br)c(CNC2CCN(c3ccccc3)CC2)cc1OC ZINC000139854866 853423853 /nfs/dbraw/zinc/42/38/53/853423853.db2.gz TWXPVUVXZWZSBY-UHFFFAOYSA-N 0 3 405.336 4.225 20 0 HIADHN C[C@@H](NCc1cccc(OCc2ccccn2)c1)c1cccc(N2CCOC2=O)c1 ZINC000142693334 853497512 /nfs/dbraw/zinc/49/75/12/853497512.db2.gz FNBRLWRADDRCFO-GOSISDBHSA-N 0 3 403.482 4.468 20 0 HIADHN C[C@H](NCc1cccc(OCc2ccccn2)c1)c1ccc(N2CCOC2=O)cc1 ZINC000142724742 853498482 /nfs/dbraw/zinc/49/84/82/853498482.db2.gz TUCBZIWKGHCHOU-SFHVURJKSA-N 0 3 403.482 4.468 20 0 HIADHN CN(C)C(=O)c1cccc(NC(=O)CN2CCC[C@@H]2c2cccc3ccccc32)c1 ZINC000142725063 853498903 /nfs/dbraw/zinc/49/89/03/853498903.db2.gz SIUWWMSACTUKSS-HSZRJFAPSA-N 0 3 401.510 4.317 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)c1ccc(-c2noc(C(F)(F)F)n2)cc1 ZINC000142988135 853505254 /nfs/dbraw/zinc/50/52/54/853505254.db2.gz RESDVUQVZOJNSO-CQSZACIVSA-N 0 3 418.419 4.006 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2ccc(-n3cc[nH]c3=S)cc2)N2CCCC2)cc1 ZINC000143069558 853507629 /nfs/dbraw/zinc/50/76/29/853507629.db2.gz XEUWLQNBCZJDFJ-OAQYLSRUSA-N 0 3 406.555 4.410 20 0 HIADHN Cc1cccc(NC(=O)[C@@H]2CCCN(Cc3ccc(OCc4ccncc4)cc3)C2)n1 ZINC000143403346 853514221 /nfs/dbraw/zinc/51/42/21/853514221.db2.gz DJAILCLXIBAIEH-JOCHJYFZSA-N 0 3 416.525 4.215 20 0 HIADHN S=C(N[C@@H](c1ccccc1)c1ccncc1)NC1CCN(Cc2ccccc2)CC1 ZINC000145493288 853552737 /nfs/dbraw/zinc/55/27/37/853552737.db2.gz RKHKREVUFCAGFR-DEOSSOPVSA-N 0 3 416.594 4.300 20 0 HIADHN Cc1c(CN2CCSCC2)cccc1NC(=O)[C@@H]1CCCN1Cc1ccccc1 ZINC000147365129 853587081 /nfs/dbraw/zinc/58/70/81/853587081.db2.gz QNWAVGPPNZSPPI-QHCPKHFHSA-N 0 3 409.599 4.147 20 0 HIADHN O=C(OCc1nc2ccccc2o1)C1CCN(c2ccc(Cl)c(Cl)c2)C1=O ZINC000147895778 853595998 /nfs/dbraw/zinc/59/59/98/853595998.db2.gz WNPDZYFFYFUMNR-LBPRGKRZSA-N 0 3 405.237 4.231 20 0 HIADHN O=C(NCc1ccccc1OCC(F)(F)F)N[C@H](CN1CCCC1)c1ccccc1 ZINC000195545507 853676128 /nfs/dbraw/zinc/67/61/28/853676128.db2.gz UYHKLLMZUHTZCL-LJQANCHMSA-N 0 3 421.463 4.264 20 0 HIADHN C[C@@H](CNC(=O)NC[C@H](c1cccs1)N1CCCC1)COCc1ccccc1 ZINC000195615811 853716274 /nfs/dbraw/zinc/71/62/74/853716274.db2.gz VJTOIIJKGUINIG-AZUAARDMSA-N 0 3 401.576 4.037 20 0 HIADHN Cc1ccccc1OC[C@@H](O)CN[C@H](C)c1cccc(NC(=O)c2ccccc2)c1 ZINC000195662319 853744644 /nfs/dbraw/zinc/74/46/44/853744644.db2.gz IAKSDTANHGWULX-XXBNENTESA-N 0 3 404.510 4.338 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3ccc(OC(F)F)cc3)c(C)c2)CC1 ZINC000195700931 853767355 /nfs/dbraw/zinc/76/73/55/853767355.db2.gz SVQPGKMDKDZPDN-UHFFFAOYSA-N 0 3 404.461 4.382 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)c1cc(-c2ccc(Cl)cc2)on1 ZINC000195724798 853779407 /nfs/dbraw/zinc/77/94/07/853779407.db2.gz RARSOLKEUCADMU-UHFFFAOYSA-N 0 3 419.859 4.477 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)N1CCCN(c2ccccc2)CC1 ZINC000195746292 853792030 /nfs/dbraw/zinc/79/20/30/853792030.db2.gz IRBGKDHDCQNMQW-UHFFFAOYSA-N 0 3 424.614 4.022 20 0 HIADHN CC[C@@H](N[C@H](C)C(=O)Nc1cccc(C(=O)N(CC)CC)c1)c1ccc(OC)cc1 ZINC000218854456 853863986 /nfs/dbraw/zinc/86/39/86/853863986.db2.gz DSOITZYPYKTVHV-VGOFRKELSA-N 0 3 411.546 4.245 20 0 HIADHN c1cn(-c2ccccc2CNCc2cn(-c3ccccc3)nc2-c2cccnc2)cn1 ZINC000236583004 853899374 /nfs/dbraw/zinc/89/93/74/853899374.db2.gz PHAOMHPWPGQMGA-UHFFFAOYSA-N 0 3 406.493 4.410 20 0 HIADHN CC(=O)Nc1ccc(CCNCc2nc(-c3ccc(Br)cc3)c[nH]2)cc1 ZINC000236599073 853901542 /nfs/dbraw/zinc/90/15/42/853901542.db2.gz SDGHRGXGWLNFDF-UHFFFAOYSA-N 0 3 413.319 4.130 20 0 HIADHN Brc1cccc(-c2c[nH]c(CNCCCc3nc4ccccc4[nH]3)n2)c1 ZINC000236661008 853908411 /nfs/dbraw/zinc/90/84/11/853908411.db2.gz FGPMHENHBQGACX-UHFFFAOYSA-N 0 3 410.319 4.438 20 0 HIADHN Brc1cccc(-c2c[nH]c(CNCCc3ccc(-n4cccn4)cc3)n2)c1 ZINC000236661409 853908483 /nfs/dbraw/zinc/90/84/83/853908483.db2.gz GDOYKJFPBSWKAU-UHFFFAOYSA-N 0 3 422.330 4.357 20 0 HIADHN O=C(NCCNCc1cnc(-c2ccccc2)s1)c1cccc(Br)c1 ZINC000236771249 853920549 /nfs/dbraw/zinc/92/05/49/853920549.db2.gz FWUNIJZRSAVVRL-UHFFFAOYSA-N 0 3 416.344 4.092 20 0 HIADHN Cc1ccc([C@@H](CNCc2cc3cnn(C(C)C)c3nc2Cl)N2CCCC2)o1 ZINC000236842802 853927683 /nfs/dbraw/zinc/92/76/83/853927683.db2.gz FQGNNIALDHIFHM-GOSISDBHSA-N 0 3 401.942 4.494 20 0 HIADHN CCCOCc1ccccc1CNCc1cn(C)nc1-c1ccc2c(c1)OCCCO2 ZINC000236894728 853933893 /nfs/dbraw/zinc/93/38/93/853933893.db2.gz QUXNWZJMHBBOFH-UHFFFAOYSA-N 0 3 421.541 4.465 20 0 HIADHN CCOc1cc(CN[C@H]2CCc3c2cccc3Cl)ccc1O[C@@H](C)C(=O)N(C)C ZINC000236913578 853937123 /nfs/dbraw/zinc/93/71/23/853937123.db2.gz SNDIVTSSMFQBFI-YWZLYKJASA-N 0 3 416.949 4.371 20 0 HIADHN CCSc1ccc([C@H](C)NCc2cc(Cl)c(OCC(N)=O)c(OC)c2)cc1 ZINC000236943220 853940250 /nfs/dbraw/zinc/94/02/50/853940250.db2.gz ZASVFKVQXYWSEV-ZDUSSCGKSA-N 0 3 408.951 4.176 20 0 HIADHN CCOc1ccc(CNCC2=Cc3cc(Br)ccc3OC2)cc1OC ZINC000236987521 853947582 /nfs/dbraw/zinc/94/75/82/853947582.db2.gz JLRHTGXLQYTTRH-UHFFFAOYSA-N 0 3 404.304 4.422 20 0 HIADHN CN(C)[C@H](CNCc1nc(-c2ccc(Br)cc2)c[nH]1)c1cccs1 ZINC000237040186 853955496 /nfs/dbraw/zinc/95/54/96/853955496.db2.gz XEMSQNSAQCQUIV-MRXNPFEDSA-N 0 3 405.365 4.293 20 0 HIADHN CN(C)C(=O)c1ccc(CNC2(c3cccc(Br)c3)CCCCC2)[nH]1 ZINC000237065690 853958866 /nfs/dbraw/zinc/95/88/66/853958866.db2.gz OUDALPMWVKXTEM-UHFFFAOYSA-N 0 3 404.352 4.428 20 0 HIADHN CN(C)C(=O)c1ccc(CNCCCN2c3ccccc3Sc3ccccc32)[nH]1 ZINC000237076142 853960899 /nfs/dbraw/zinc/96/08/99/853960899.db2.gz PPIKBGDPZZXURW-UHFFFAOYSA-N 0 3 406.555 4.499 20 0 HIADHN CN(C(=O)c1ccncc1)c1ccc(CNCc2ccc3c(c2)CC(C)(C)O3)cc1 ZINC000237097761 853964182 /nfs/dbraw/zinc/96/41/82/853964182.db2.gz BHWXICGAWOGWEJ-UHFFFAOYSA-N 0 3 401.510 4.362 20 0 HIADHN COc1c(C)cc(CNCc2cccc(NC(=O)NCc3ccncc3)c2)cc1C ZINC000237191199 853978371 /nfs/dbraw/zinc/97/83/71/853978371.db2.gz OCKKKMZHGDPSCB-UHFFFAOYSA-N 0 3 404.514 4.319 20 0 HIADHN COc1cc(CN[C@H](C)c2ccc(NC(N)=O)cc2)ccc1OCc1c(C)noc1C ZINC000237221706 853985905 /nfs/dbraw/zinc/98/59/05/853985905.db2.gz HAQJZKOMTVSLQX-CQSZACIVSA-N 0 3 424.501 4.220 20 0 HIADHN CNC(=O)c1ccc(CN[C@H](C)c2ccc(OCc3ccccc3)c(OC)c2)cc1 ZINC000237228695 853986709 /nfs/dbraw/zinc/98/67/09/853986709.db2.gz NBCDUHAWANNICP-GOSISDBHSA-N 0 3 404.510 4.485 20 0 HIADHN COc1cc(CNCc2ccc(F)c(CN(C)C)c2)ccc1OCC(F)(F)F ZINC000237315346 854005066 /nfs/dbraw/zinc/00/50/66/854005066.db2.gz CMLGWKODJHIGMX-UHFFFAOYSA-N 0 3 400.416 4.127 20 0 HIADHN CNS(=O)(=O)Cc1ccc(CNCc2ccc(-c3cc(C)cc(C)c3)cc2)cc1 ZINC000237331131 854007751 /nfs/dbraw/zinc/00/77/51/854007751.db2.gz NCIMOHLVRVFZAG-UHFFFAOYSA-N 0 3 408.567 4.309 20 0 HIADHN COc1cc(CN[C@H](c2ccc(F)cc2)C2CCCC2)cc(Cl)c1OCC(N)=O ZINC000237336287 854008331 /nfs/dbraw/zinc/00/83/31/854008331.db2.gz DYNUZRKQXFHLRC-NRFANRHFSA-N 0 3 420.912 4.373 20 0 HIADHN COc1cc(CNC2(c3cccc(Br)c3)CCC2)cc2c1OCCO2 ZINC000237343376 854009528 /nfs/dbraw/zinc/00/95/28/854009528.db2.gz WJHUPKLTAYLBAP-UHFFFAOYSA-N 0 3 404.304 4.398 20 0 HIADHN COc1cc(CN[C@@H]2CCSc3ccccc32)ccc1OCC(=O)N1CCCC1 ZINC000237356616 854012345 /nfs/dbraw/zinc/01/23/45/854012345.db2.gz FAUXSMJGOZUZHK-LJQANCHMSA-N 0 3 412.555 4.023 20 0 HIADHN COc1ccc(OC(F)F)c(CNCCc2nc(-c3ccc(Cl)cc3)no2)c1 ZINC000237366961 854015594 /nfs/dbraw/zinc/01/55/94/854015594.db2.gz GQOGHFXYUIXXRX-UHFFFAOYSA-N 0 3 409.820 4.332 20 0 HIADHN COc1cc([C@@H](C)NCc2cnc3c(C)cccn23)ccc1OCc1ccncc1 ZINC000237380827 854018659 /nfs/dbraw/zinc/01/86/59/854018659.db2.gz WMRGTJZYPMATTM-GOSISDBHSA-N 0 3 402.498 4.476 20 0 HIADHN COc1cc([C@@H](C)NCc2ccc3c(c2)OCCO3)ccc1OCc1ccncc1 ZINC000237385334 854019274 /nfs/dbraw/zinc/01/92/74/854019274.db2.gz PTBBBKAWOMRIFD-QGZVFWFLSA-N 0 3 406.482 4.291 20 0 HIADHN COc1ccc(OC)c(NC(=O)C[C@H](C)N[C@@H](c2ccccc2)c2ccncc2)c1 ZINC000237402596 854024485 /nfs/dbraw/zinc/02/44/85/854024485.db2.gz IWTJYUAKQXBCOJ-XDHUDOTRSA-N 0 3 405.498 4.195 20 0 HIADHN COc1cc(CN[C@@H]2c3ccccc3C[C@@H]2C)cc(I)c1OC ZINC000237424765 854030827 /nfs/dbraw/zinc/03/08/27/854030827.db2.gz FSSCAPUFOZMTMV-SGTLLEGYSA-N 0 3 423.294 4.332 20 0 HIADHN COc1ccc(-c2ccc(CNC[C@H](O)c3ccccc3Cl)o2)c([N+](=O)[O-])c1 ZINC000237430350 854031163 /nfs/dbraw/zinc/03/11/63/854031163.db2.gz IGDKXQLXWUGWHJ-IBGZPJMESA-N 0 3 402.834 4.340 20 0 HIADHN COc1ccc(OCc2ccccn2)c(CNCCOc2ccc(F)c(F)c2)c1 ZINC000237434683 854032703 /nfs/dbraw/zinc/03/27/03/854032703.db2.gz QKPFIWNUXFYRJF-UHFFFAOYSA-N 0 3 400.425 4.116 20 0 HIADHN Cc1ccc(NC(=O)C[C@@H](C)NCc2cccc(C(=O)NCc3ccco3)c2)c(C)c1 ZINC000237453344 854036294 /nfs/dbraw/zinc/03/62/94/854036294.db2.gz MZGHDNRATPHREP-LJQANCHMSA-N 0 3 419.525 4.333 20 0 HIADHN COc1cc(CNCc2c[nH]nc2-c2ccc(C)o2)cc(Br)c1OC ZINC000237469147 854039460 /nfs/dbraw/zinc/03/94/60/854039460.db2.gz UDDPSGFAIZFZFH-UHFFFAOYSA-N 0 3 406.280 4.048 20 0 HIADHN Cc1nn(Cc2ccc(F)cc2)c(Cl)c1CNC[C@H]1CCN(CC(F)(F)F)C1 ZINC000237614077 854062852 /nfs/dbraw/zinc/06/28/52/854062852.db2.gz CQEBQMYMIUCMRT-OAHLLOKOSA-N 0 3 418.866 4.006 20 0 HIADHN Cc1ccc([C@H](CNCc2cc(Cl)ccc2OC(F)F)N2CCOCC2)o1 ZINC000237629215 854064957 /nfs/dbraw/zinc/06/49/57/854064957.db2.gz VESGPDGXLKHPBJ-INIZCTEOSA-N 0 3 400.853 4.006 20 0 HIADHN Cc1cc(CNCc2ccc(CS(C)(=O)=O)cc2)cc(C)c1OCc1ccccn1 ZINC000237635483 854065681 /nfs/dbraw/zinc/06/56/81/854065681.db2.gz HOXVQMRCYGZKHD-UHFFFAOYSA-N 0 3 424.566 4.112 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CNC[C@@H](O)c1cccc(C(F)(F)F)c1 ZINC000237632981 854065727 /nfs/dbraw/zinc/06/57/27/854065727.db2.gz VKFDJUWZVKVILC-OAQYLSRUSA-N 0 3 403.448 4.390 20 0 HIADHN Cc1nn(Cc2ccccc2Cl)c(C)c1CNCc1ccnc(-n2ccnc2)c1 ZINC000237680012 854074016 /nfs/dbraw/zinc/07/40/16/854074016.db2.gz DMFNEIHATGWYQU-UHFFFAOYSA-N 0 3 406.921 4.072 20 0 HIADHN Cc1nn(Cc2ccccc2Cl)c(C)c1CNC[C@](C)(O)c1ccc(F)cc1F ZINC000237677753 854074165 /nfs/dbraw/zinc/07/41/65/854074165.db2.gz ONWLHFOOPQRULV-QFIPXVFZSA-N 0 3 419.903 4.477 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)c(C)c1CNCc1ccccc1CN1CCOCC1 ZINC000237723973 854084015 /nfs/dbraw/zinc/08/40/15/854084015.db2.gz JALISQQUAOSNKQ-UHFFFAOYSA-N 0 3 424.976 4.265 20 0 HIADHN O=C(CCNCc1cc(Cl)ccc1OCc1cccnc1)N1CCCCCC1 ZINC000237762657 854090765 /nfs/dbraw/zinc/09/07/65/854090765.db2.gz UTNWQGJDCPRTLR-UHFFFAOYSA-N 0 3 401.938 4.196 20 0 HIADHN Cc1cccc(OC[C@H](O)CNCc2cccc(NC(=O)c3ccccc3Cl)c2)c1 ZINC000237774111 854093845 /nfs/dbraw/zinc/09/38/45/854093845.db2.gz ZRZIZVGOHFSBDW-HXUWFJFHSA-N 0 3 424.928 4.430 20 0 HIADHN NC(=O)c1cccc(CNC2(c3ccc(OCc4ccccc4)cc3)CCOCC2)c1 ZINC000237779885 854095787 /nfs/dbraw/zinc/09/57/87/854095787.db2.gz DIDKRMWAONWXIB-UHFFFAOYSA-N 0 3 416.521 4.160 20 0 HIADHN O=C(Nc1cccc(CNCc2ccc(-n3cncn3)cc2)c1)c1ccccc1Cl ZINC000237863820 854110631 /nfs/dbraw/zinc/11/06/31/854110631.db2.gz BLXNREYEXSMLBK-UHFFFAOYSA-N 0 3 417.900 4.463 20 0 HIADHN O=[N+]([O-])c1ccc(Cl)cc1CNC[C@@H](c1cccc(Cl)c1)N1CCOCC1 ZINC000237880728 854113869 /nfs/dbraw/zinc/11/38/69/854113869.db2.gz QVQFOYLKNRYXFB-IBGZPJMESA-N 0 3 410.301 4.065 20 0 HIADHN Cc1cc([C@](C)(O)CNCc2cccc3c2N(C(=O)OC(C)(C)C)CC3)c(C)o1 ZINC000237879734 854113928 /nfs/dbraw/zinc/11/39/28/854113928.db2.gz BWFFQIXRMJDQTN-HSZRJFAPSA-N 0 3 400.519 4.191 20 0 HIADHN NC(=O)Nc1ccc(CNCc2ccc(OC(F)(F)[C@H](F)C(F)(F)F)cc2)cc1 ZINC000237901191 854117151 /nfs/dbraw/zinc/11/71/51/854117151.db2.gz SLTJKGSHHKGRCR-OAHLLOKOSA-N 0 3 421.341 4.339 20 0 HIADHN O=S(=O)(c1ccc(CNCc2cccc(-c3ccccc3)c2)cc1)N1CCCC1 ZINC000238028886 854135776 /nfs/dbraw/zinc/13/57/76/854135776.db2.gz VPIIWCKYYOKOOS-UHFFFAOYSA-N 0 3 406.551 4.428 20 0 HIADHN COc1ccc(CNC(=O)[C@@H](C)N[C@H](Cc2ccccc2)c2ccccc2)cc1OC ZINC000248237739 854186913 /nfs/dbraw/zinc/18/69/13/854186913.db2.gz FJZGRDMRXZSKMB-AUSIDOKSSA-N 0 3 418.537 4.282 20 0 HIADHN O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)N(Cc1cccs1)C[C@H]1CCCO1 ZINC000255957015 854229913 /nfs/dbraw/zinc/22/99/13/854229913.db2.gz FCUXBCRKTGTHNN-NHCUHLMSSA-N 0 3 413.587 4.103 20 0 HIADHN Cc1cc(F)ccc1-c1ccc(CN[C@H](CN2CCN(C)CC2)c2ccccc2)o1 ZINC000261471660 854274291 /nfs/dbraw/zinc/27/42/91/854274291.db2.gz XXTDSCKWYOVVSI-XMMPIXPASA-N 0 3 407.533 4.472 20 0 HIADHN CN1CCN(C[C@@H](Nc2nc(-c3cccnc3)nc3ccccc32)c2ccccc2)CC1 ZINC000301141154 854309426 /nfs/dbraw/zinc/30/94/26/854309426.db2.gz BMCIMACQYZFPLT-XMMPIXPASA-N 0 3 424.552 4.092 20 0 HIADHN Cc1noc(-c2cccnc2N[C@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)n1 ZINC000301392043 854380548 /nfs/dbraw/zinc/38/05/48/854380548.db2.gz HUJWRARKBVEVQK-INIZCTEOSA-N 0 3 403.408 4.145 20 0 HIADHN O=S(=O)(c1ccc(N2CC[C@@H]3[C@H](CCCN3Cc3ccccc3)C2)cc1)C(F)F ZINC000301660366 854439216 /nfs/dbraw/zinc/43/92/16/854439216.db2.gz CLSBFJRUIUYFOQ-WIYYLYMNSA-N 0 3 420.525 4.174 20 0 HIADHN CCN1CCN([C@@H](C)CNc2ccc3c(Br)ccc(Cl)c3n2)CC1 ZINC000302013130 854516328 /nfs/dbraw/zinc/51/63/28/854516328.db2.gz ZSEVCAGWVOWRNW-ZDUSSCGKSA-N 0 3 411.775 4.089 20 0 HIADHN COc1ccc(Br)c(CN[C@H]2CCN(C(=O)OC(C)(C)C)[C@H](C)C2)c1 ZINC000302062873 854524582 /nfs/dbraw/zinc/52/45/82/854524582.db2.gz XDGIIPONRRYPPH-HIFRSBDPSA-N 0 3 413.356 4.335 20 0 HIADHN CC(C)[C@@H](CNc1nn2cc(-c3cccnc3)nc2s1)N1CCc2ccccc2C1 ZINC000302076874 854527053 /nfs/dbraw/zinc/52/70/53/854527053.db2.gz HKIJEYSBTCXHAJ-OAQYLSRUSA-N 0 3 418.570 4.348 20 0 HIADHN Cc1cccc2c1ncc(C)c2N1CCCN(c2nnc(C(F)(F)F)s2)CC1 ZINC000302730836 854615351 /nfs/dbraw/zinc/61/53/51/854615351.db2.gz VUJVCWRUEXXACR-UHFFFAOYSA-N 0 3 407.465 4.439 20 0 HIADHN CN(C)[C@@H](CNC(=O)c1ccc(NC(=O)Nc2ccccc2)cc1)c1ccccc1 ZINC000302811836 854642841 /nfs/dbraw/zinc/64/28/41/854642841.db2.gz DKVFKFQJLVFCNV-QFIPXVFZSA-N 0 3 402.498 4.363 20 0 HIADHN Cc1noc(CN2CCN(c3ccnc4ccc(Oc5ccccc5)cc43)CC2)n1 ZINC000302884955 854666324 /nfs/dbraw/zinc/66/63/24/854666324.db2.gz KNJJTULOWLEMJT-UHFFFAOYSA-N 0 3 401.470 4.041 20 0 HIADHN COCc1nc2n(n1)C[C@H](Nc1ccnc3ccc(Oc4ccccc4)cc31)CC2 ZINC000302901759 854671895 /nfs/dbraw/zinc/67/18/95/854671895.db2.gz QSAMZYJKVGKEMU-MRXNPFEDSA-N 0 3 401.470 4.192 20 0 HIADHN COc1cccc([C@H](CNC(=O)N[C@H](C)c2ccc(F)cc2F)N2CCCC2)c1 ZINC000302900664 854672380 /nfs/dbraw/zinc/67/23/80/854672380.db2.gz QIDSVSMTIAVRRJ-VFNWGFHPSA-N 0 3 403.473 4.171 20 0 HIADHN CC1CCN([C@H](CNC(=O)Nc2ccc3c(c2)OCCO3)c2cccs2)CC1 ZINC000302913190 854677574 /nfs/dbraw/zinc/67/75/74/854677574.db2.gz SBOFJXLJYVVKBF-QGZVFWFLSA-N 0 3 401.532 4.114 20 0 HIADHN Clc1ccc(CN2CCC[C@@H](CN3CCN(c4ccccn4)CC3)C2)cc1Cl ZINC000302965856 854699287 /nfs/dbraw/zinc/69/92/87/854699287.db2.gz AHKXBRXPYYIUNT-IBGZPJMESA-N 0 3 419.400 4.423 20 0 HIADHN CN(C)Cc1ccccc1CNC(=O)c1cc2c(cc(Br)cc2F)[nH]1 ZINC000302974089 854704431 /nfs/dbraw/zinc/70/44/31/854704431.db2.gz IOTKTWAJDAUAGR-UHFFFAOYSA-N 0 3 404.283 4.061 20 0 HIADHN COc1ccccc1C[C@H]1CCCN1C(=O)N[C@H](CN1CCCC1)c1ccccc1 ZINC000303003372 854718375 /nfs/dbraw/zinc/71/83/75/854718375.db2.gz OSTKKVIAIOETCF-DHIUTWEWSA-N 0 3 407.558 4.249 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)/C=C/c1nc2ccccc2s1 ZINC000303013133 854722621 /nfs/dbraw/zinc/72/26/21/854722621.db2.gz RJJLKEJCAXJYFC-MDZDMXLPSA-N 0 3 401.482 4.178 20 0 HIADHN CN(C)CCN(C[C@@H]1CCCO1)C(=O)Nc1ccc(N(C)C2CCCCC2)c(F)c1 ZINC000303025964 854729298 /nfs/dbraw/zinc/72/92/98/854729298.db2.gz ODXJBJCBCLIQBG-FQEVSTJZSA-N 0 3 420.573 4.169 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N[C@@H]3CCOc4c(Cl)cccc43)cc2)CC1 ZINC000303029910 854731262 /nfs/dbraw/zinc/73/12/62/854731262.db2.gz WYQBFHNTJOLFLD-OAQYLSRUSA-N 0 3 413.949 4.124 20 0 HIADHN COc1ccc2cc(CN(C)C(=O)CN(C[C@@H]3CCCO3)C3CCCC3)ccc2c1 ZINC000303034224 854732962 /nfs/dbraw/zinc/73/29/62/854732962.db2.gz OOTZVJZKSNUJAA-DEOSSOPVSA-N 0 3 410.558 4.230 20 0 HIADHN Cc1cc(C)n(Cc2ccc(C(=O)N[C@H](CN3CCCC3)c3ccccc3)cc2)n1 ZINC000303039211 854734455 /nfs/dbraw/zinc/73/44/55/854734455.db2.gz ZIKKKVSFUJYUTP-XMMPIXPASA-N 0 3 402.542 4.115 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)c2cc3c(cc(Br)cc3F)[nH]2)o1 ZINC000303118818 854769029 /nfs/dbraw/zinc/76/90/29/854769029.db2.gz PHOSSCGZPFWEHL-UHFFFAOYSA-N 0 3 422.298 4.175 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)NC[C@@H]2CCN(c3ccc(F)cc3)C2)N2CCCC2)cc1 ZINC000303120258 854769700 /nfs/dbraw/zinc/76/97/00/854769700.db2.gz IFWIJUHAJGZTHG-GBXCKJPGSA-N 0 3 424.564 4.097 20 0 HIADHN Cc1cc(O[C@H](C)C(=O)N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)ccc1C(C)C ZINC000303139661 854780470 /nfs/dbraw/zinc/78/04/70/854780470.db2.gz KKJLSFIXNSZJEQ-QHAWAJNXSA-N 0 3 416.606 4.234 20 0 HIADHN Cc1cc(O[C@H](C)C(=O)N2CCC(CN3C[C@H](C)O[C@@H](C)C3)CC2)ccc1C(C)C ZINC000303139657 854780560 /nfs/dbraw/zinc/78/05/60/854780560.db2.gz KKJLSFIXNSZJEQ-PCCBWWKXSA-N 0 3 416.606 4.234 20 0 HIADHN O=C(NC[C@@H]1CCCCN1C(=O)c1cccc(CN2CCCC2)c1)Nc1ccccc1 ZINC000303204116 854815143 /nfs/dbraw/zinc/81/51/43/854815143.db2.gz YGEIEMZSRGMMFC-QHCPKHFHSA-N 0 3 420.557 4.099 20 0 HIADHN COc1ccc(OC)c(CNC[C@@H](c2c(F)cccc2Cl)N2CCO[C@@H](C)C2)c1 ZINC000303225178 854825032 /nfs/dbraw/zinc/82/50/32/854825032.db2.gz WKGDOZJGBBFXCT-YWZLYKJASA-N 0 3 422.928 4.048 20 0 HIADHN COc1cccc([C@H](CNC(=O)C[C@H](C)Cc2ccccc2OC)N2CCCC2)c1 ZINC000303288909 854854224 /nfs/dbraw/zinc/85/42/24/854854224.db2.gz KHUGXUPCFULFDE-XXBNENTESA-N 0 3 410.558 4.226 20 0 HIADHN O=C(CCc1cc(Br)cs1)NCCCN1CCc2ccccc2C1 ZINC000303336959 854880025 /nfs/dbraw/zinc/88/00/25/854880025.db2.gz UVFIBKYLPHTDIL-UHFFFAOYSA-N 0 3 407.377 4.008 20 0 HIADHN O=C(NC[C@H](O)c1ccc2ccccc2c1)N[C@H](CN1CCCC1)c1ccccc1 ZINC000303345760 854884724 /nfs/dbraw/zinc/88/47/24/854884724.db2.gz DVJWVGSLNINTAA-RPWUZVMVSA-N 0 3 403.526 4.010 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)NCc1ccc(Br)cc1 ZINC000303345998 854884762 /nfs/dbraw/zinc/88/47/62/854884762.db2.gz XDESZGPUWYVYBY-UHFFFAOYSA-N 0 3 418.379 4.155 20 0 HIADHN COc1ccc(NC(=O)CN(Cc2ccccc2)CC2CCOCC2)cc1Cl ZINC000303427035 854928298 /nfs/dbraw/zinc/92/82/98/854928298.db2.gz AXARQRVQJGRXQR-UHFFFAOYSA-N 0 3 402.922 4.216 20 0 HIADHN Cc1nn(Cc2ccccc2)c(Cl)c1C(=O)NC[C@@H](C)N(C)Cc1ccccc1 ZINC000303445000 854944699 /nfs/dbraw/zinc/94/46/99/854944699.db2.gz ILZGDQGGDFOUGG-QGZVFWFLSA-N 0 3 410.949 4.144 20 0 HIADHN C[C@H](CNC(=O)[C@H]1C[C@@H]1c1ccc(Br)cc1)N(C)Cc1ccccc1 ZINC000303450937 854949500 /nfs/dbraw/zinc/94/95/00/854949500.db2.gz JMVOPINLYXHVIG-YSGRDPCXSA-N 0 3 401.348 4.189 20 0 HIADHN C[C@H](CNC(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1)N(C)Cc1ccccc1 ZINC000303450935 854949609 /nfs/dbraw/zinc/94/96/09/854949609.db2.gz JMVOPINLYXHVIG-UIAACRFSSA-N 0 3 401.348 4.189 20 0 HIADHN O=C(CN(Cc1ccccc1)CC1CCOCC1)Nc1ccc(OC(F)F)cc1 ZINC000303455376 854955690 /nfs/dbraw/zinc/95/56/90/854955690.db2.gz JTJAUUUZKYQGOB-UHFFFAOYSA-N 0 3 404.457 4.155 20 0 HIADHN C[C@@H](CNC(=O)c1ccc(NC(=O)c2cccs2)cc1)N(C)Cc1ccccc1 ZINC000303457030 854957590 /nfs/dbraw/zinc/95/75/90/854957590.db2.gz KURZSBHJHINWGA-KRWDZBQOSA-N 0 3 407.539 4.251 20 0 HIADHN C[C@@H](CNC(=O)NCc1ccc(Oc2cccnc2)c(F)c1)N(C)Cc1ccccc1 ZINC000303513051 855001560 /nfs/dbraw/zinc/00/15/60/855001560.db2.gz XGVBQQVMBGZTSP-SFHVURJKSA-N 0 3 422.504 4.333 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)Nc1cccc(C(=O)N2CCCCC2)c1 ZINC000303515206 855003076 /nfs/dbraw/zinc/00/30/76/855003076.db2.gz DBKZSKUEUYNQIC-UHFFFAOYSA-N 0 3 405.498 4.373 20 0 HIADHN CCn1c2ccccc2nc1[C@@H]1CCCN1C(=O)NC[C@H](C)N(C)Cc1ccccc1 ZINC000303523102 855009755 /nfs/dbraw/zinc/00/97/55/855009755.db2.gz ZOCRJCRTRLQUKC-CVDCTZTESA-N 0 3 419.573 4.423 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)c2cccc(COc3ccc(C)nc3)c2)o1 ZINC000303594596 855067358 /nfs/dbraw/zinc/06/73/58/855067358.db2.gz WDSJVTSBXZFOFD-UHFFFAOYSA-N 0 3 407.514 4.074 20 0 HIADHN CC(C)(C)c1ccc([C@H](O)CNC(=O)N[C@H](CN2CCCC2)c2ccccc2)cc1 ZINC000303635682 855092104 /nfs/dbraw/zinc/09/21/04/855092104.db2.gz GSELMSZAIUOREN-DHIUTWEWSA-N 0 3 409.574 4.154 20 0 HIADHN CN(C)CCN(C[C@@H]1CCCO1)C(=O)Nc1cc(F)ccc1Oc1ccccc1 ZINC000303725034 855152496 /nfs/dbraw/zinc/15/24/96/855152496.db2.gz SOCZXZIJUUXBCM-IBGZPJMESA-N 0 3 401.482 4.193 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)N[C@@H](C)c2cccc(C)c2C)CC1 ZINC000303728660 855155967 /nfs/dbraw/zinc/15/59/67/855155967.db2.gz UGAJDHGOBJLSGZ-NRFANRHFSA-N 0 3 408.590 4.001 20 0 HIADHN O=C(CCN1CCC[C@@H](C(=O)c2ccc(F)cc2)C1)NCc1ccccc1Cl ZINC000303763359 855182394 /nfs/dbraw/zinc/18/23/94/855182394.db2.gz PBXISTIYZLDLNL-GOSISDBHSA-N 0 3 402.897 4.080 20 0 HIADHN CC(C)c1ccc([C@@H](C)CC(=O)Nc2ccc3oc(=O)n(CCN(C)C)c3c2)cc1 ZINC000303776634 855192147 /nfs/dbraw/zinc/19/21/47/855192147.db2.gz KEBFIFSGXZNYSX-KRWDZBQOSA-N 0 3 409.530 4.412 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)NCc1cccc(OCC(F)F)c1 ZINC000303787640 855198664 /nfs/dbraw/zinc/19/86/64/855198664.db2.gz DUYAHWRJERKBLD-GOSISDBHSA-N 0 3 417.500 4.137 20 0 HIADHN Cc1ccc(S(=O)(=O)N(C)[C@@H]2CCN(Cc3ccccc3)[C@@H](C)C2)cc1Cl ZINC000303788860 855199321 /nfs/dbraw/zinc/19/93/21/855199321.db2.gz JNKHGUQBAIALIH-PKOBYXMFSA-N 0 3 406.979 4.322 20 0 HIADHN Cc1cnc2c(cccc2S(=O)(=O)N(C)[C@@H]2CCN(Cc3ccccc3)[C@@H](C)C2)c1 ZINC000303801473 855205673 /nfs/dbraw/zinc/20/56/73/855205673.db2.gz LSNNTWKSLBZNRM-SIKLNZKXSA-N 0 3 423.582 4.217 20 0 HIADHN Cc1c(C(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)cnn1-c1ccc(F)cc1 ZINC000303819518 855221507 /nfs/dbraw/zinc/22/15/07/855221507.db2.gz JURWBZDZZJUCQS-SFHVURJKSA-N 0 3 406.505 4.056 20 0 HIADHN Cc1c(C(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)cnn1-c1ccc(F)cc1 ZINC000303819515 855221764 /nfs/dbraw/zinc/22/17/64/855221764.db2.gz JURWBZDZZJUCQS-GOSISDBHSA-N 0 3 406.505 4.056 20 0 HIADHN COc1ccc2cc(NC(=O)N3CCCN(Cc4ccccc4)C[C@H]3C)ccc2n1 ZINC000303822210 855223844 /nfs/dbraw/zinc/22/38/44/855223844.db2.gz FTWFNSFXYCPXOL-GOSISDBHSA-N 0 3 404.514 4.372 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)c1cc(Cl)nc(N2CCCC2)c1 ZINC000303831971 855231415 /nfs/dbraw/zinc/23/14/15/855231415.db2.gz LQHYWNFYQCBOLY-SFHVURJKSA-N 0 3 412.965 4.072 20 0 HIADHN Cc1ccc(Cl)cc1S(=O)(=O)N(C)[C@H]1CCN(Cc2ccccc2)[C@H](C)C1 ZINC000303848719 855245298 /nfs/dbraw/zinc/24/52/98/855245298.db2.gz UQXXKYMMYIWGJI-XLIONFOSSA-N 0 3 406.979 4.322 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2cccc(Cl)c2Cl)cc1)[C@@H]1CCCN(C)C1 ZINC000303853055 855248772 /nfs/dbraw/zinc/24/87/72/855248772.db2.gz FYZDGUMHDCILAF-MRXNPFEDSA-N 0 3 420.340 4.412 20 0 HIADHN CC(C)COC[C@H](NC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C)c1ccco1 ZINC000303858925 855253700 /nfs/dbraw/zinc/25/37/00/855253700.db2.gz PGPVPCYBOFFNJM-IRLDBZIGSA-N 0 3 413.562 4.299 20 0 HIADHN CN(C)Cc1cccc(C(=O)Nc2cccc(OCc3cn4ccccc4n3)c2)c1 ZINC000303884389 855269565 /nfs/dbraw/zinc/26/95/65/855269565.db2.gz OTOMHDLFCQRBGO-UHFFFAOYSA-N 0 3 400.482 4.227 20 0 HIADHN C[C@@H]1C[C@H]1C(=O)Nc1cccc(C(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)c1 ZINC000303950392 855313241 /nfs/dbraw/zinc/31/32/41/855313241.db2.gz ZUIPORLBZPFUDS-SELNLUPBSA-N 0 3 405.542 4.018 20 0 HIADHN CC(C)[C@@H](Cc1ccccc1)C(=O)Nc1ccc(C(=O)N(C)[C@@H]2CCCN(C)C2)cc1 ZINC000303963652 855325384 /nfs/dbraw/zinc/32/53/84/855325384.db2.gz XMDOMTIKEKPACV-DNQXCXABSA-N 0 3 421.585 4.306 20 0 HIADHN COc1ccc(Br)c(CN[C@](C)(CNC(=O)OC(C)(C)C)C(C)C)c1 ZINC000310602197 855366598 /nfs/dbraw/zinc/36/65/98/855366598.db2.gz OLCCIDJPAJMZAS-LJQANCHMSA-N 0 3 415.372 4.487 20 0 HIADHN CN(C(=O)c1c(F)cccc1Br)C1CCN(Cc2ccccc2)CC1 ZINC000310770247 855367823 /nfs/dbraw/zinc/36/78/23/855367823.db2.gz OYJQXSOIXZLHKL-UHFFFAOYSA-N 0 3 405.311 4.325 20 0 HIADHN COc1ccc(C(=O)N2CCN(Cc3ccccc3)C[C@@H](C)C2)cc1Br ZINC000324070336 855397624 /nfs/dbraw/zinc/39/76/24/855397624.db2.gz XXNXLASJTQGFRJ-MRXNPFEDSA-N 0 3 417.347 4.052 20 0 HIADHN FC(F)(F)Oc1ccc(CNC[C@@H]2COc3ccccc3O2)cc1Br ZINC000327840115 855420747 /nfs/dbraw/zinc/42/07/47/855420747.db2.gz QZIFHLFRZIKGMV-GFCCVEGCSA-N 0 3 418.209 4.277 20 0 HIADHN CC(C)(C)OC(=O)N1CCC[C@H](NCc2cccc(F)c2Br)CC1 ZINC000382763345 855434721 /nfs/dbraw/zinc/43/47/21/855434721.db2.gz RUKCMIIESSYBQY-AWEZNQCLSA-N 0 3 401.320 4.467 20 0 HIADHN Cc1c(Br)cccc1C(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC000383048230 855435566 /nfs/dbraw/zinc/43/55/66/855435566.db2.gz FXPKLWWCCXDCLV-MRXNPFEDSA-N 0 3 401.348 4.494 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)c1cc(F)ccc1Br ZINC000383056895 855436948 /nfs/dbraw/zinc/43/69/48/855436948.db2.gz OPDNHROVNVHHDB-HNNXBMFYSA-N 0 3 405.311 4.325 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1cccc(Br)c1Cl ZINC000389851801 855452764 /nfs/dbraw/zinc/45/27/64/855452764.db2.gz WBFWFTMOHBJIQY-SUMWQHHRSA-N 0 3 407.739 4.353 20 0 HIADHN Cc1cc(-c2noc(CCC(=O)N[C@@H]3CCN([C@H](C)c4ccccc4)C3)n2)ccc1F ZINC000409453697 855486152 /nfs/dbraw/zinc/48/61/52/855486152.db2.gz PYGLKGWEXONGLX-YLJYHZDGSA-N 0 3 422.504 4.068 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(CN[C@@H]3CCCc4[nH]c(=O)ccc43)c2)cc1 ZINC000409478902 855502087 /nfs/dbraw/zinc/50/20/87/855502087.db2.gz IFSXZFUIPMDTDE-OAQYLSRUSA-N 0 3 403.482 4.215 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(CN[C@H]3CCCc4[nH]c(=O)ccc43)c2)cc1 ZINC000409478899 855502219 /nfs/dbraw/zinc/50/22/19/855502219.db2.gz IFSXZFUIPMDTDE-NRFANRHFSA-N 0 3 403.482 4.215 20 0 HIADHN O=C(NCC1CCOCC1)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000409606720 855562049 /nfs/dbraw/zinc/56/20/49/855562049.db2.gz GTDJZFVJVWKLMX-UHFFFAOYSA-N 0 3 414.377 4.027 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2ccc3c(c2)nc(C(F)F)n3C)N2CCCC2)cc1 ZINC000409608473 855562886 /nfs/dbraw/zinc/56/28/86/855562886.db2.gz OLPORKVNRKXNCJ-FQEVSTJZSA-N 0 3 412.484 4.386 20 0 HIADHN C[C@H](C(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1)c1ccc(C(F)(F)F)cc1 ZINC000409646731 855581535 /nfs/dbraw/zinc/58/15/35/855581535.db2.gz FLFALLGRYRJBMV-ZACQAIPSSA-N 0 3 412.496 4.157 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)NCCCCN1CCN(c2ccccc2)CC1 ZINC000409680046 855598401 /nfs/dbraw/zinc/59/84/01/855598401.db2.gz LGODFRVPDDBXJG-UHFFFAOYSA-N 0 3 416.953 4.073 20 0 HIADHN Cc1ccc(NC(=O)NCCCCN2CCN(Cc3ccccc3)CC2)c(Cl)c1 ZINC000409696049 855606047 /nfs/dbraw/zinc/60/60/47/855606047.db2.gz KZTBZQBQWHNJAG-UHFFFAOYSA-N 0 3 414.981 4.368 20 0 HIADHN Cc1cc(C(=O)N(CCCc2ccccc2)CCN(C)C)c(C)n1Cc1ccccn1 ZINC000409705113 855612362 /nfs/dbraw/zinc/61/23/62/855612362.db2.gz AWZSRSNDHBIGIP-UHFFFAOYSA-N 0 3 418.585 4.185 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)c1ccc2c(c1)nc(C(F)F)n2C ZINC000409739416 855628881 /nfs/dbraw/zinc/62/88/81/855628881.db2.gz IMJJMXHCHKZDLJ-UHFFFAOYSA-N 0 3 414.500 4.148 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)CCCC1CCOCC1 ZINC000409837162 855680417 /nfs/dbraw/zinc/68/04/17/855680417.db2.gz FAGRJDVIRCVFAR-JOCHJYFZSA-N 0 3 410.562 4.174 20 0 HIADHN CC(C)n1ncc2c1nc(C1CC1)cc2C(=O)N[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000409848423 855685524 /nfs/dbraw/zinc/68/55/24/855685524.db2.gz JJVAAFXEABRMGH-XLIONFOSSA-N 0 3 417.557 4.455 20 0 HIADHN CCN1CCC[C@@H](CN(C)C(=O)CC2CC(c3ccccc3)C2)[C@@H]1c1cnn(C)c1 ZINC000409962913 855747517 /nfs/dbraw/zinc/74/75/17/855747517.db2.gz PXCUDCGHAWYVDV-KXBVSRLSSA-N 0 3 408.590 4.235 20 0 HIADHN C[C@@H](CNC(=O)C(=O)Nc1ccccc1-c1ccc(-c2ccccc2)cc1)N(C)C ZINC000410320730 855926412 /nfs/dbraw/zinc/92/64/12/855926412.db2.gz GNTOZQWSCLIVKF-SFHVURJKSA-N 0 3 401.510 4.025 20 0 HIADHN CS(=O)(=O)Nc1ccc(CN[C@H](Cc2cccnc2)c2cccc(Cl)c2)cc1 ZINC000425937556 856008845 /nfs/dbraw/zinc/00/88/45/856008845.db2.gz SBKCUVZKKLHVTC-OAQYLSRUSA-N 0 3 415.946 4.180 20 0 HIADHN Cc1ccc([C@H]2C[C@@H](C)N(C(=O)NCc3ccccc3CN3CCC(O)CC3)C2)cc1 ZINC000426041628 856066507 /nfs/dbraw/zinc/06/65/07/856066507.db2.gz GNDRFGPVCGZRKN-YKSBVNFPSA-N 0 3 421.585 4.039 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1C[C@@H](C)N(Cc2ccccc2)C1)c1nc(C(F)(F)F)cs1 ZINC000426053204 856075559 /nfs/dbraw/zinc/07/55/59/856075559.db2.gz AWUJJYCHEVGUEQ-VNHYZAJKSA-N 0 3 412.481 4.185 20 0 HIADHN Cc1ccc(CNC(=O)N2CCN(C3CCOCC3)C[C@@H]2C)c(Oc2ccccc2)c1 ZINC000426069874 856086024 /nfs/dbraw/zinc/08/60/24/856086024.db2.gz MERVNJUOAIAEIS-FQEVSTJZSA-N 0 3 423.557 4.182 20 0 HIADHN C[C@H](CCCC(F)(F)F)NC(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000426093469 856103860 /nfs/dbraw/zinc/10/38/60/856103860.db2.gz XCDMBTRVFPKGTP-BRWVUGGUSA-N 0 3 407.521 4.028 20 0 HIADHN CCCn1ccc2cc(NC(=O)N[C@@H]3CCN(Cc4ccccc4)C[C@@H]3CO)ccc21 ZINC000426106578 856111306 /nfs/dbraw/zinc/11/13/06/856111306.db2.gz PBEPPMDWLUVWQG-FYYLOGMGSA-N 0 3 420.557 4.056 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)N[C@H]1CCOC2(CCCCC2)C1 ZINC000426114836 856115821 /nfs/dbraw/zinc/11/58/21/856115821.db2.gz QHTWQBVNKYWINY-NRFANRHFSA-N 0 3 417.619 4.281 20 0 HIADHN C[C@@H](C(=O)NCCCCN1CCN(Cc2ccccc2)CC1)c1ccc(Cl)s1 ZINC000426146954 856138578 /nfs/dbraw/zinc/13/85/78/856138578.db2.gz BCFZTJOQTLDBNR-GOSISDBHSA-N 0 3 420.022 4.219 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C)c1nc(C(F)(F)F)cs1 ZINC000426238910 856195138 /nfs/dbraw/zinc/19/51/38/856195138.db2.gz MJZKBJMKFNHNRC-KCQAQPDRSA-N 0 3 412.481 4.043 20 0 HIADHN COc1cccc([C@H](CNC(=O)N[C@@H]2CCOC3(CCCCC3)C2)N2CCCC2)c1 ZINC000426242395 856197671 /nfs/dbraw/zinc/19/76/71/856197671.db2.gz XEKHCSQEUSFVPB-IRLDBZIGSA-N 0 3 415.578 4.013 20 0 HIADHN CC(C)[C@@H](NC(=O)N1CCN(C2CCOCC2)C[C@@H]1C)c1ccc(Cl)cc1F ZINC000426255738 856204928 /nfs/dbraw/zinc/20/49/28/856204928.db2.gz MAGFPCMUTUBIHK-MGPUTAFESA-N 0 3 411.949 4.071 20 0 HIADHN Cc1nc(CCCC(=O)NC2CCN(CCOc3ccc(Cl)cc3)CC2)cs1 ZINC000426321094 856244369 /nfs/dbraw/zinc/24/43/69/856244369.db2.gz BPWKPJOWKKBMLU-UHFFFAOYSA-N 0 3 421.994 4.087 20 0 HIADHN COc1cc(CN(C)C/C(C)=C\c2ccccc2)ccc1OCC(=O)N1CCCC1 ZINC000426379423 856265583 /nfs/dbraw/zinc/26/55/83/856265583.db2.gz JDDBCZMKJSWOAU-HKWRFOASSA-N 0 3 408.542 4.232 20 0 HIADHN CCOc1cc(CN2CCS[C@@H](C)CC2)ccc1OCC(=O)N(C(C)C)C(C)C ZINC000426385663 856269156 /nfs/dbraw/zinc/26/91/56/856269156.db2.gz PVWSVPGLYUHQOX-IBGZPJMESA-N 0 3 422.635 4.437 20 0 HIADHN Cc1cccc(C)c1NC(=O)Cc1noc([C@@H]2CN(C(C)(C)C)C[C@H]2C(F)(F)F)n1 ZINC000426427359 856285680 /nfs/dbraw/zinc/28/56/80/856285680.db2.gz DDWPLFGPSNTXLC-HUUCEWRRSA-N 0 3 424.467 4.244 20 0 HIADHN CC(C)N(CC(=O)N(C)[C@@]1(c2ccccc2Cl)CCCCC1=O)C1CCOCC1 ZINC000426452779 856298767 /nfs/dbraw/zinc/29/87/67/856298767.db2.gz ZHJPGWYJAGVPQR-HSZRJFAPSA-N 0 3 420.981 4.026 20 0 HIADHN C[C@H](CCCOc1ccccc1C(N)=O)N[C@H](C)c1nc(C(F)(F)F)cs1 ZINC000426528667 856335449 /nfs/dbraw/zinc/33/54/49/856335449.db2.gz GIZOGHJFXPBDHG-VXGBXAGGSA-N 0 3 401.454 4.159 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)Nc3ccccc3C(F)(F)F)CC2)C[C@H](C)O1 ZINC000426646656 856392496 /nfs/dbraw/zinc/39/24/96/856392496.db2.gz MJOSHESUNJNGDM-HOTGVXAUSA-N 0 3 413.484 4.449 20 0 HIADHN CC(=O)N(C)c1ccc(C(=O)N2CCN(Cc3ccccc3)C3(CCCCC3)C2)cc1 ZINC000426763824 856464942 /nfs/dbraw/zinc/46/49/42/856464942.db2.gz DWSHKTNWTFGQIY-UHFFFAOYSA-N 0 3 419.569 4.330 20 0 HIADHN Cc1cc(C)c(NC(=O)CN2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)c(Cl)c1 ZINC000426777842 856473296 /nfs/dbraw/zinc/47/32/96/856473296.db2.gz RBKJNUGDUYPNMS-RTBURBONSA-N 0 3 422.013 4.107 20 0 HIADHN O=C(CN1C[C@@H]2CCCC[C@H]2C1)N(Cc1nnc(-c2ccccc2Cl)o1)C1CC1 ZINC000426790025 856480524 /nfs/dbraw/zinc/48/05/24/856480524.db2.gz ZUDGPQSBEZXNOC-HOTGVXAUSA-N 0 3 414.937 4.003 20 0 HIADHN CO[C@@H](C)c1noc(CN2CCCN(CCCSc3ccccc3Cl)CC2)n1 ZINC000426809954 856491115 /nfs/dbraw/zinc/49/11/15/856491115.db2.gz GZNZCQAKLCUUPL-INIZCTEOSA-N 0 3 424.998 4.121 20 0 HIADHN FC(F)(F)Oc1ccc(OCCN2CCC(OC[C@@H]3CCCCO3)CC2)cc1 ZINC000426835879 856506372 /nfs/dbraw/zinc/50/63/72/856506372.db2.gz SVKXUWKEEOUWRQ-IBGZPJMESA-N 0 3 403.441 4.014 20 0 HIADHN C[C@@H](NC(=O)N(CCN(C)C)CC1CCCCC1)c1nc(C(F)(F)F)cs1 ZINC000426899975 856532830 /nfs/dbraw/zinc/53/28/30/856532830.db2.gz ASIDSMDWVVJWDA-CYBMUJFWSA-N 0 3 406.518 4.376 20 0 HIADHN C[C@@H](NC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1)c1nc(C(F)(F)F)cs1 ZINC000426901928 856534700 /nfs/dbraw/zinc/53/47/00/856534700.db2.gz YTDOLOPRFGLEAA-UKRRQHHQSA-N 0 3 412.481 4.139 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)N[C@@H]2CCC[C@@H]2OCc2ccccc2)CC1 ZINC000426963208 856565557 /nfs/dbraw/zinc/56/55/57/856565557.db2.gz GTADRSODFBZHIZ-PKTZIBPZSA-N 0 3 411.546 4.023 20 0 HIADHN Cc1ccc(-c2c[nH]cc2C(=O)N2CCC(CN3C[C@@H](C)O[C@H](C)C3)CC2)s1 ZINC000427125799 856654668 /nfs/dbraw/zinc/65/46/68/856654668.db2.gz HNVGUYSMVRVELB-HZPDHXFCSA-N 0 3 401.576 4.013 20 0 HIADHN Cc1nc(C)n(Cc2cccc(NC(=O)c3oc4ccccc4c3CN(C)C)c2)n1 ZINC000427175788 856691699 /nfs/dbraw/zinc/69/16/99/856691699.db2.gz SQNRHSLJBXXWMP-UHFFFAOYSA-N 0 3 403.486 4.003 20 0 HIADHN CCSCc1ccc(C(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)cc1 ZINC000427288296 856753562 /nfs/dbraw/zinc/75/35/62/856753562.db2.gz OVTIVJIZQSHZBQ-KDURUIRLSA-N 0 3 404.620 4.291 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3c4c(nc5ccccc53)CCC4)CC2)C[C@H](C)O1 ZINC000427298555 856758895 /nfs/dbraw/zinc/75/88/95/856758895.db2.gz DGXGFBWWCMSRNF-KDURUIRLSA-N 0 3 421.585 4.075 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)c3ccc(-c4ccccc4F)o3)CC2)C[C@H](C)O1 ZINC000427311674 856764580 /nfs/dbraw/zinc/76/45/80/856764580.db2.gz DKKXSZDVBGYZHC-ROUUACIJSA-N 0 3 414.521 4.437 20 0 HIADHN Cc1cc(C(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)cc(C)c1OC(F)F ZINC000427312446 856764676 /nfs/dbraw/zinc/76/46/76/856764676.db2.gz JKDDMCDPFAPMRA-HDICACEKSA-N 0 3 424.532 4.256 20 0 HIADHN Cc1onc(-c2ccccc2)c1C(=O)N1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000427310192 856764707 /nfs/dbraw/zinc/76/47/07/856764707.db2.gz XVDIAASJWYUJCQ-ROUUACIJSA-N 0 3 411.546 4.002 20 0 HIADHN CSCc1cc(C(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)ccc1F ZINC000427322960 856771681 /nfs/dbraw/zinc/77/16/81/856771681.db2.gz VZMWJOWIARRHHP-IRXDYDNUSA-N 0 3 408.583 4.040 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)CCCOc3ccc(Cl)cc3)CC2)C[C@H](C)O1 ZINC000427335660 856778207 /nfs/dbraw/zinc/77/82/07/856778207.db2.gz OBUSBWXWOIILOV-OALUTQOASA-N 0 3 422.997 4.237 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)CCCOc3ccc(Cl)cc3)CC2)C[C@@H](C)O1 ZINC000427335661 856778453 /nfs/dbraw/zinc/77/84/53/856778453.db2.gz OBUSBWXWOIILOV-RTBURBONSA-N 0 3 422.997 4.237 20 0 HIADHN Cc1ccc(-c2ocnc2C(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)cc1 ZINC000427343360 856783060 /nfs/dbraw/zinc/78/30/60/856783060.db2.gz WINDGOCRIBSZLL-RTBURBONSA-N 0 3 411.546 4.002 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)CCCc3c[nH]c4ccccc34)CC2)C[C@@H](C)O1 ZINC000427352269 856788731 /nfs/dbraw/zinc/78/87/31/856788731.db2.gz MUXJCTJKWTUYCL-WOJBJXKFSA-N 0 3 411.590 4.229 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)[C@@H]3C[C@H]3c3ccccc3Cl)CC2)C[C@@H](C)O1 ZINC000427362489 856794265 /nfs/dbraw/zinc/79/42/65/856794265.db2.gz MUGDVJOEXZHEKK-SGLNWRHMSA-N 0 3 404.982 4.181 20 0 HIADHN CC1(C)CCCN(CCNC(=O)Cc2csc(Cc3cccc(Cl)c3)n2)C1 ZINC000427422759 856813801 /nfs/dbraw/zinc/81/38/01/856813801.db2.gz XOBIJDKOYIUTIR-UHFFFAOYSA-N 0 3 405.995 4.168 20 0 HIADHN CCOc1ccc(C(=O)N2CCCCC2)cc1NC(=O)c1cccc(CN(C)C)c1 ZINC000427444331 856822822 /nfs/dbraw/zinc/82/28/22/856822822.db2.gz PNKROHHTFPJVHR-UHFFFAOYSA-N 0 3 409.530 4.025 20 0 HIADHN C[C@H]1CCN(C(=O)c2ccc(C(=O)NCC(C)(C)C)cc2)CCN1Cc1ccccc1 ZINC000437483140 862841200 /nfs/dbraw/zinc/84/12/00/862841200.db2.gz LFWHRUDIUZSFCB-FQEVSTJZSA-N 0 3 421.585 4.199 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)NCc1ccc(-c2ccccc2)c(C)c1 ZINC000427507370 856844427 /nfs/dbraw/zinc/84/44/27/856844427.db2.gz TVXRRZSUXGKJQL-UHFFFAOYSA-N 0 3 415.537 4.287 20 0 HIADHN COc1cc([C@H](C)N[C@H]2CCCc3ncc(C(F)(F)F)cc32)ccc1OCCO ZINC000427583930 856877703 /nfs/dbraw/zinc/87/77/03/856877703.db2.gz SDZYQGFKGONXGG-UGSOOPFHSA-N 0 3 410.436 4.208 20 0 HIADHN Cc1ccc([C@@H](NCc2ccccc2OCC(=O)NC[C@@H]2CCCO2)C2CCC2)cc1 ZINC000427608275 856887025 /nfs/dbraw/zinc/88/70/25/856887025.db2.gz GAKVKWOKQNDVHT-OZXSUGGESA-N 0 3 422.569 4.300 20 0 HIADHN Cc1cc2c(cc1C)[C@H](NCc1cccc(N3CCCS3(=O)=O)c1)CCS2 ZINC000427840061 856977243 /nfs/dbraw/zinc/97/72/43/856977243.db2.gz FUFRXLUWHJDWDL-HXUWFJFHSA-N 0 3 402.585 4.170 20 0 HIADHN Fc1cc(Br)ccc1[C@@H](N[C@H]1CCn2ccnc2C1)c1ccccc1 ZINC000427886084 856993623 /nfs/dbraw/zinc/99/36/23/856993623.db2.gz YIDWFDIEDMSTPC-JXFKEZNVSA-N 0 3 400.295 4.479 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)c3cnc(C)c(Cl)c3Cl)cc2)CC1 ZINC000427906798 857001426 /nfs/dbraw/zinc/00/14/26/857001426.db2.gz RLKBLRGWPCGHPQ-UHFFFAOYSA-N 0 3 407.345 4.087 20 0 HIADHN C[C@@H](C(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1)c1ccc2c(c1)OCO2 ZINC000428006580 857038541 /nfs/dbraw/zinc/03/85/41/857038541.db2.gz PCAADJKLESDHNB-AEFFLSMTSA-N 0 3 400.544 4.170 20 0 HIADHN Cc1ccc(NC(=O)c2cccc(CN3CCCC3)c2)cc1C(=O)N1CCCCC1 ZINC000428025503 857046900 /nfs/dbraw/zinc/04/69/00/857046900.db2.gz SIYWTLHTISBWIX-UHFFFAOYSA-N 0 3 405.542 4.469 20 0 HIADHN CO[C@H](C)c1nc(CN2CCCN(CCCOc3cccc(Cl)c3)CC2)cs1 ZINC000437522943 862865383 /nfs/dbraw/zinc/86/53/83/862865383.db2.gz BVVOUHYWZINLMJ-QGZVFWFLSA-N 0 3 424.010 4.481 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1sc([C@H]2CCCOC2)nc1C)c1ccsc1 ZINC000428179697 857099441 /nfs/dbraw/zinc/09/94/41/857099441.db2.gz YUWAWKFXZQQQPB-DOTOQJQBSA-N 0 3 407.605 4.220 20 0 HIADHN COc1ccc(NC(=O)C2(NCc3ccc(SC)cc3)CCCC2)cc1OC ZINC000428401824 857192168 /nfs/dbraw/zinc/19/21/68/857192168.db2.gz HEBZYTTTXDVAHF-UHFFFAOYSA-N 0 3 400.544 4.467 20 0 HIADHN CCOc1cc(CN2CC[C@H](O)[C@H](C)C2)ccc1OCCOc1cccc(Cl)c1 ZINC000428480107 857219117 /nfs/dbraw/zinc/21/91/17/857219117.db2.gz BJMDCFZSUGIXFD-UTKZUKDTSA-N 0 3 419.949 4.399 20 0 HIADHN CCCOc1ccc(C(=O)Nc2cccc(CN3CC[C@H](O)C3)c2)c(OCCC)c1 ZINC000428536489 857249906 /nfs/dbraw/zinc/24/99/06/857249906.db2.gz LTZFLBSFMMMDAV-FQEVSTJZSA-N 0 3 412.530 4.083 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)c1cnc2ccccc2c1C(F)(F)F ZINC000428542566 857254061 /nfs/dbraw/zinc/25/40/61/857254061.db2.gz GGHJWKKGRSHDOE-INIZCTEOSA-N 0 3 415.415 4.073 20 0 HIADHN CCCn1c2ccccc2nc1CNC[C@@H](CO)Cc1cccc(Br)c1 ZINC000428545883 857256631 /nfs/dbraw/zinc/25/66/31/857256631.db2.gz WLORNSPDFAGCPY-KRWDZBQOSA-N 0 3 416.363 4.150 20 0 HIADHN O=C(C(=O)N1CC[C@@]2(C1)CCCN(Cc1ccccc1)C2)c1ccc(Cl)s1 ZINC000428648146 857289009 /nfs/dbraw/zinc/28/90/09/857289009.db2.gz PRQKUOACTGXMON-NRFANRHFSA-N 0 3 402.947 4.099 20 0 HIADHN CCN1CCCN(C(=O)N[C@H](c2ccccc2Cl)c2ccccc2OC)CC1 ZINC000428683740 857296569 /nfs/dbraw/zinc/29/65/69/857296569.db2.gz GHPIARUSZKGASA-OAQYLSRUSA-N 0 3 401.938 4.175 20 0 HIADHN CCN1CCCN(C(=O)N[C@H](c2cccc(OC)c2)c2ccccc2Cl)CC1 ZINC000428691537 857298829 /nfs/dbraw/zinc/29/88/29/857298829.db2.gz VSLNIMAVQNLXMS-OAQYLSRUSA-N 0 3 401.938 4.175 20 0 HIADHN CC[C@@H](c1ccc(Br)cc1)N1CCC([C@@H]2OCC[C@H]2C(=O)OC)CC1 ZINC000428727798 857312020 /nfs/dbraw/zinc/31/20/20/857312020.db2.gz ZFLXEQGBTOVAKZ-QYZOEREBSA-N 0 3 410.352 4.190 20 0 HIADHN C[C@@H](NC(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1)c1cc2ccccc2o1 ZINC000428760505 857323531 /nfs/dbraw/zinc/32/35/31/857323531.db2.gz SVCXPSJMIYWUAE-NQIIRXRSSA-N 0 3 407.514 4.084 20 0 HIADHN C[C@H](NC(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1)C(C)(C)c1ccccc1 ZINC000428814038 857357426 /nfs/dbraw/zinc/35/74/26/857357426.db2.gz CAVCXARYLUHITM-NJYVYQBISA-N 0 3 415.622 4.274 20 0 HIADHN C[C@@H](CC(=O)Nc1cccc(CN2CC[C@H](O)C2)c1)c1ccc(Br)cc1 ZINC000428821714 857360367 /nfs/dbraw/zinc/36/03/67/857360367.db2.gz LWWJAABXQVKJTA-YWZLYKJASA-N 0 3 417.347 4.148 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3ccc(C(=O)C(C)(C)C)cc3)CC2)C[C@@H](C)O1 ZINC000428878587 857384836 /nfs/dbraw/zinc/38/48/36/857384836.db2.gz AKGYGBUQKWRMJH-QZTJIDSGSA-N 0 3 415.578 4.269 20 0 HIADHN Cc1ccc(CNC(=O)C2CCN(Cc3c[nH]nc3-c3ccsc3)CC2)cc1F ZINC000437594096 862907667 /nfs/dbraw/zinc/90/76/67/862907667.db2.gz PHUCCAMMTQGPSQ-UHFFFAOYSA-N 0 3 412.534 4.114 20 0 HIADHN CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)C(=O)c1ccc(-c2ccccc2Cl)o1 ZINC000428956939 857435234 /nfs/dbraw/zinc/43/52/34/857435234.db2.gz ZFQOQTWAEBSSTO-DEOSSOPVSA-N 0 3 424.928 4.309 20 0 HIADHN Cc1c2cc(F)ccc2sc1C(=O)N(C)C[C@]1(O)CCN(Cc2ccccc2)C1 ZINC000428969152 857438155 /nfs/dbraw/zinc/43/81/55/857438155.db2.gz VBGUBDRZCSWVCB-HSZRJFAPSA-N 0 3 412.530 4.058 20 0 HIADHN CCN(Cc1ccc(Cl)cc1)C(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000428993564 857448894 /nfs/dbraw/zinc/44/88/94/857448894.db2.gz DGSZAUYYDLYYBE-QFIPXVFZSA-N 0 3 415.965 4.163 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N1CCC(c2ncccc2Cl)CC1 ZINC000429013229 857457383 /nfs/dbraw/zinc/45/73/83/857457383.db2.gz WIILPWKAXSMCPU-DYESRHJHSA-N 0 3 412.965 4.145 20 0 HIADHN O=C(NC[C@H]1CN(Cc2ccccc2)CCCO1)Nc1ccc(-c2nccs2)cc1 ZINC000429036919 857469259 /nfs/dbraw/zinc/46/92/59/857469259.db2.gz VOWRHQVJSTVBCG-NRFANRHFSA-N 0 3 422.554 4.223 20 0 HIADHN COc1c(Cl)cccc1NC(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000429044255 857473467 /nfs/dbraw/zinc/47/34/67/857473467.db2.gz JFEUETUCRXQKLT-IYBDPMFKSA-N 0 3 409.958 4.092 20 0 HIADHN C[C@@H]1CCN(C(=O)NC[C@H]2CN(Cc3ccccc3)CCCO2)[C@H](c2ccco2)C1 ZINC000429044711 857473529 /nfs/dbraw/zinc/47/35/29/857473529.db2.gz RPIISRKATDDJBP-HJNYFJLDSA-N 0 3 411.546 4.053 20 0 HIADHN C[C@@H](C1CC1)N(Cc1ccccc1)C(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000429054201 857479836 /nfs/dbraw/zinc/47/98/36/857479836.db2.gz PKXMWNIDQGHOFP-OFVILXPXSA-N 0 3 421.585 4.288 20 0 HIADHN Cc1ccc(C(=O)Nc2cccc(CNC(=O)NC[C@H]3CCCCN3C3CC3)c2)cc1 ZINC000429091158 857505229 /nfs/dbraw/zinc/50/52/29/857505229.db2.gz DXXQSXZXJXCTNC-HSZRJFAPSA-N 0 3 420.557 4.063 20 0 HIADHN C[C@@H](NC(=O)N(CCN(C)C)Cc1ccc(C(F)(F)F)cc1)c1cccc(O)c1 ZINC000429114621 857516631 /nfs/dbraw/zinc/51/66/31/857516631.db2.gz HGLLPVAAPBLEJS-OAHLLOKOSA-N 0 3 409.452 4.245 20 0 HIADHN CC(=O)N1CCC(N(CCn2ccc3cc(Cl)ccc32)Cc2cncs2)CC1 ZINC000429153030 857533404 /nfs/dbraw/zinc/53/34/04/857533404.db2.gz CIIQEBFVTALAED-UHFFFAOYSA-N 0 3 416.978 4.264 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)N[C@@H]3CCC[C@H](C(F)(F)F)C3)CC2)C[C@@H](C)O1 ZINC000429211632 857557380 /nfs/dbraw/zinc/55/73/80/857557380.db2.gz DVVSQFVKULMUAH-ZAWLATJESA-N 0 3 419.532 4.028 20 0 HIADHN COc1ccc2cc(CN(C)C(=O)[C@@H](C)N3CCC[C@H](CSC)C3)ccc2c1 ZINC000429272887 857585081 /nfs/dbraw/zinc/58/50/81/857585081.db2.gz LMRBRUUTTOXARZ-MJGOQNOKSA-N 0 3 400.588 4.270 20 0 HIADHN FC(F)(F)Cn1nnnc1CN[C@H](Cc1ccc(Cl)cc1)C1CCCCC1 ZINC000429328853 857604694 /nfs/dbraw/zinc/60/46/94/857604694.db2.gz PELPHDPQQCYAFH-MRXNPFEDSA-N 0 3 401.864 4.170 20 0 HIADHN FC(F)(F)Cn1nnnc1CN[C@@H](Cc1ccc(Cl)cc1)C1CCCCC1 ZINC000429328847 857604757 /nfs/dbraw/zinc/60/47/57/857604757.db2.gz PELPHDPQQCYAFH-INIZCTEOSA-N 0 3 401.864 4.170 20 0 HIADHN COC(=O)[C@H]1CCN(Cc2ncc(-c3ccc(Br)cc3)o2)[C@H]1C(C)C ZINC000429392869 857639003 /nfs/dbraw/zinc/63/90/03/857639003.db2.gz JKDVLAPXEDKVKX-YJBOKZPZSA-N 0 3 407.308 4.124 20 0 HIADHN Cc1nn(C)c(C)c1NC(=O)[C@@H](C)N[C@H]1c2cccc(Br)c2CC1(C)C ZINC000429407329 857649526 /nfs/dbraw/zinc/64/95/26/857649526.db2.gz LHBKEWPDORQVRC-XIKOKIGWSA-N 0 3 419.367 4.040 20 0 HIADHN CC(C)n1nccc1NC(=O)[C@@H](C)N[C@@H]1c2cccc(Br)c2CC1(C)C ZINC000429412305 857651813 /nfs/dbraw/zinc/65/18/13/857651813.db2.gz ZREYCKMJVIIAPC-FZKQIMNGSA-N 0 3 419.367 4.467 20 0 HIADHN Cn1ccc([C@@H](NC[C@H]2CN(Cc3ccccc3)CCCO2)c2ccc(Cl)cc2)n1 ZINC000429413609 857653158 /nfs/dbraw/zinc/65/31/58/857653158.db2.gz VNLQVMLFXVZEKK-UPVQGACJSA-N 0 3 424.976 4.044 20 0 HIADHN Fc1ccc([C@@H](NC[C@H]2CN(Cc3ccccc3)CCCO2)c2ccccc2)nc1 ZINC000429413962 857653171 /nfs/dbraw/zinc/65/31/71/857653171.db2.gz AQPHMVFXDNSUOQ-ZCYQVOJMSA-N 0 3 405.517 4.191 20 0 HIADHN Cc1cnc([C@@H](C)NC(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)s1 ZINC000429419823 857656290 /nfs/dbraw/zinc/65/62/90/857656290.db2.gz RELIRFAMQBOLDF-CQSZACIVSA-N 0 3 414.497 4.305 20 0 HIADHN COc1cc(F)c([C@@H](C)NC[C@H]2CSCCN2Cc2ccccc2)cc1OC ZINC000429446044 857673808 /nfs/dbraw/zinc/67/38/08/857673808.db2.gz GJKWDJDOJYDCBV-AEFFLSMTSA-N 0 3 404.551 4.111 20 0 HIADHN Cn1cc([C@H](NC[C@@]2(Cc3ccc(F)cc3)CCC[C@@H]2O)c2cccc(F)c2)cn1 ZINC000429453480 857678631 /nfs/dbraw/zinc/67/86/31/857678631.db2.gz OYZWZUXPCIQDNT-VXNXHJTFSA-N 0 3 411.496 4.151 20 0 HIADHN Cc1noc(C[C@H](N[C@@H](C)c2ccc(NC(=O)NC3CC3)cc2)c2ccccc2)n1 ZINC000429474815 857687885 /nfs/dbraw/zinc/68/78/85/857687885.db2.gz RXALJQARXXZZOS-BTYIYWSLSA-N 0 3 405.502 4.297 20 0 HIADHN Cc1noc(C[C@H](N[C@@H](C)c2ccc(OCc3nccn3C)cc2)c2ccccc2)n1 ZINC000429478480 857688904 /nfs/dbraw/zinc/68/89/04/857688904.db2.gz YNZBLEPQIDJVTI-JTSKRJEESA-N 0 3 417.513 4.325 20 0 HIADHN Cc1cccnc1[C@H](NC(=O)N1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1)C(C)C ZINC000429499417 857699437 /nfs/dbraw/zinc/69/94/37/857699437.db2.gz UDVXJTGNLROJNA-JAXLGGSGSA-N 0 3 416.610 4.008 20 0 HIADHN Cc1cc([C@H]2CCCN2C(=O)N[C@H](CN2CCc3ccccc3C2)C(C)(C)C)on1 ZINC000429502492 857701304 /nfs/dbraw/zinc/70/13/04/857701304.db2.gz JXLGSAOXRLMDEY-IFMALSPDSA-N 0 3 410.562 4.303 20 0 HIADHN CN(C)CCN(C(=O)Nc1ccnn1Cc1ccc(C(F)(F)F)cc1)C1CCCC1 ZINC000429513292 857708768 /nfs/dbraw/zinc/70/87/68/857708768.db2.gz ALEFIGYZWUWAAB-UHFFFAOYSA-N 0 3 423.483 4.288 20 0 HIADHN CN(C)C(=O)COc1cccc(CN[C@@H](Cc2ccccc2F)c2ccccc2)c1 ZINC000429519105 857712907 /nfs/dbraw/zinc/71/29/07/857712907.db2.gz JPJMBFUSMPVOIC-DEOSSOPVSA-N 0 3 406.501 4.366 20 0 HIADHN CN1CCN(c2ncccc2CN[C@@H](Cc2ccccc2F)c2ccccc2)CC1 ZINC000429520276 857713735 /nfs/dbraw/zinc/71/37/35/857713735.db2.gz XKTOIBABWCTSSL-DEOSSOPVSA-N 0 3 404.533 4.046 20 0 HIADHN Cc1noc(C[C@@H](NC[C@@H](O)COc2ccc(C(C)(C)C)cc2C)c2ccccc2)n1 ZINC000429530833 857723221 /nfs/dbraw/zinc/72/32/21/857723221.db2.gz QNBYIAOENRFLKC-FGZHOGPDSA-N 0 3 423.557 4.297 20 0 HIADHN CCOC(=O)c1csc(C2CCN(CCC(=O)Nc3ccccc3Cl)CC2)n1 ZINC000429589258 857772723 /nfs/dbraw/zinc/77/27/23/857772723.db2.gz IKTVJBJJHZJYPT-UHFFFAOYSA-N 0 3 421.950 4.181 20 0 HIADHN c1csc(CN(C[C@H]2CCCO2)C[C@@H]2CN(Cc3ccccc3)CCCO2)c1 ZINC000429732844 857855913 /nfs/dbraw/zinc/85/59/13/857855913.db2.gz YYOJJKFBZNXLHL-YADHBBJMSA-N 0 3 400.588 4.020 20 0 HIADHN C[C@@H](Oc1ccccc1NC(=O)C(=O)N(CCN(C)C)C1CCCC1)c1ccccc1 ZINC000429779640 857881975 /nfs/dbraw/zinc/88/19/75/857881975.db2.gz NVXNNCLTNBCWEH-LJQANCHMSA-N 0 3 423.557 4.098 20 0 HIADHN CCO[C@H]1C[C@H](NCC(=O)Nc2c(C)nn(-c3ccc(C)cc3)c2C)C12CCCCC2 ZINC000429792766 857886410 /nfs/dbraw/zinc/88/64/10/857886410.db2.gz UWCIGQGJSMHXTP-VXKWHMMOSA-N 0 3 424.589 4.454 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCc3c(F)cc(F)c(F)c3F)c(C)c2)CC1 ZINC000429802539 857889709 /nfs/dbraw/zinc/88/97/09/857889709.db2.gz KTZSBAGRMIESKO-UHFFFAOYSA-N 0 3 424.442 4.015 20 0 HIADHN Cc1nn(C(C)C)c(C)c1CC(=O)N[C@H](CN1CCc2ccccc2C1)C(C)(C)C ZINC000429899560 857935781 /nfs/dbraw/zinc/93/57/81/857935781.db2.gz ZJJFHSIRUOSXIX-HSZRJFAPSA-N 0 3 410.606 4.213 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)Nc1cccc(-c2ncc3n2CCCC3)c1 ZINC000429955826 857968483 /nfs/dbraw/zinc/96/84/83/857968483.db2.gz ZECATCCKJSTIDN-UHFFFAOYSA-N 0 3 417.557 4.482 20 0 HIADHN Cc1ccc(-c2c[nH]cc2C(=O)NC[C@H]2CN(Cc3ccccc3)CCCO2)s1 ZINC000430105458 858034104 /nfs/dbraw/zinc/03/41/04/858034104.db2.gz LMLXZTBQIWSZHL-IBGZPJMESA-N 0 3 409.555 4.073 20 0 HIADHN Clc1cccc(-n2cnnc2SC[C@@H]2CN(Cc3ccccc3)CCCO2)c1 ZINC000430129714 858045299 /nfs/dbraw/zinc/04/52/99/858045299.db2.gz ZTZUJDPRCHXFHQ-FQEVSTJZSA-N 0 3 414.962 4.304 20 0 HIADHN O=C(N[C@H]1CCc2ccc(-c3ccccc3)cc21)N1CCN(CC2CCOCC2)CC1 ZINC000430210656 858083509 /nfs/dbraw/zinc/08/35/09/858083509.db2.gz UUMMCBCLLZFNGM-VWLOTQADSA-N 0 3 419.569 4.095 20 0 HIADHN C[C@H]1CCN(C)CCN1C(=O)N[C@H](CC1CC1)c1cc(F)cc(Br)c1 ZINC000430289778 858109647 /nfs/dbraw/zinc/10/96/47/858109647.db2.gz LMFILFHHSVLYLH-SCLBCKFNSA-N 0 3 412.347 4.165 20 0 HIADHN Cc1cc(NC(=O)c2cc3sccc3[nH]2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000430298568 858113717 /nfs/dbraw/zinc/11/37/17/858113717.db2.gz KDGFZUCYVNWFAZ-QGZVFWFLSA-N 0 3 405.527 4.434 20 0 HIADHN CN(C)Cc1cccc(NC(=O)N(CCn2ccnc2)Cc2cccc(Cl)c2)c1 ZINC000430389908 858143096 /nfs/dbraw/zinc/14/30/96/858143096.db2.gz RGVNIYZZORCFOX-UHFFFAOYSA-N 0 3 411.937 4.332 20 0 HIADHN Cc1cc(NC(=O)C(C)(C)c2c(C)noc2C)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000430786709 858304814 /nfs/dbraw/zinc/30/48/14/858304814.db2.gz RJGXQDPHLWQFLI-FQEVSTJZSA-N 0 3 421.545 4.160 20 0 HIADHN CC[NH+](CC)C[C@@H]1CCCC[C@H]1NC(=O)Nc1ccc(-c2cc(=O)[n-]c(C)n2)cc1 ZINC000431078529 858437012 /nfs/dbraw/zinc/43/70/12/858437012.db2.gz UKDMIMYXOSQFHI-AZUAARDMSA-N 0 3 411.550 4.180 20 0 HIADHN Cc1ccc([C@@H](CN2C(=O)CN(Cc3ccc(Cl)cc3)C2=O)N2CCCC2)cc1 ZINC000431085543 858440440 /nfs/dbraw/zinc/44/04/40/858440440.db2.gz OFXWSCULCAYOJN-OAQYLSRUSA-N 0 3 411.933 4.250 20 0 HIADHN C[C@@H]1CCN(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)CCN1Cc1ccccc1 ZINC000437685865 863024975 /nfs/dbraw/zinc/02/49/75/863024975.db2.gz ICLCKOOFYGWKNM-HXUWFJFHSA-N 0 3 420.557 4.051 20 0 HIADHN Cc1ccc([C@H](OC[C@H](O)CN2CC[C@H](Oc3ccncc3)C2)c2ccccc2)cc1 ZINC000431129368 858459767 /nfs/dbraw/zinc/45/97/67/858459767.db2.gz PYFLXZOABLCDIG-DMTNHVFBSA-N 0 3 418.537 4.010 20 0 HIADHN COCCCOc1cccc(NC(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)c1 ZINC000431138966 858465928 /nfs/dbraw/zinc/46/59/28/858465928.db2.gz PFZPTBSNUHPUCT-HSZRJFAPSA-N 0 3 411.546 4.369 20 0 HIADHN Cc1ccccc1[C@H](OC[C@H](O)CN1CC[C@@H](Oc2ccncc2)C1)c1ccccc1 ZINC000431166372 858481649 /nfs/dbraw/zinc/48/16/49/858481649.db2.gz IUTDIDXULRYOPB-QIGHUWCUSA-N 0 3 418.537 4.010 20 0 HIADHN CC[C@@H](c1ccccc1)N1CC(=O)N(C[C@@H]2CCCN(Cc3cccs3)C2)C1=O ZINC000431172476 858486067 /nfs/dbraw/zinc/48/60/67/858486067.db2.gz XKIZQJKLUKEHFH-NQIIRXRSSA-N 0 3 411.571 4.376 20 0 HIADHN C[C@@H]1C[C@@H](N(C)S(=O)(=O)Cc2cc(Cl)ccc2F)CCN1Cc1ccccc1 ZINC000431284761 858546121 /nfs/dbraw/zinc/54/61/21/858546121.db2.gz WIXXLHYUNLDLEG-UZLBHIALSA-N 0 3 424.969 4.294 20 0 HIADHN CCN(C[C@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)Cc1cc(Cl)ccc1F ZINC000431312541 858558751 /nfs/dbraw/zinc/55/87/51/858558751.db2.gz JJIBQEGSFVHREH-SFHVURJKSA-N 0 3 424.969 4.153 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)c1ccc(-c2cc[nH]n2)s1 ZINC000431499037 858644468 /nfs/dbraw/zinc/64/44/68/858644468.db2.gz CBZITSABALMCBN-UHFFFAOYSA-N 0 3 422.476 4.361 20 0 HIADHN COCCCOc1cccc(NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)c1 ZINC000431593560 858681341 /nfs/dbraw/zinc/68/13/41/858681341.db2.gz AALJREAEMFDPRY-LJQANCHMSA-N 0 3 400.494 4.092 20 0 HIADHN CCc1ccc([C@H](CNC(=O)C2(Cc3ccc(F)cc3)CCOCC2)N(C)C)cc1 ZINC000431665651 858724299 /nfs/dbraw/zinc/72/42/99/858724299.db2.gz GFBRFYPTVHWOPJ-QHCPKHFHSA-N 0 3 412.549 4.147 20 0 HIADHN C[C@@H](NC(=O)NC[C@H](c1ccccc1)N(C)C)c1noc(-c2ccc(Cl)cc2)n1 ZINC000431723020 858763869 /nfs/dbraw/zinc/76/38/69/858763869.db2.gz IQZRKWFTKODRAB-RDTXWAMCSA-N 0 3 413.909 4.053 20 0 HIADHN COc1cnccc1N1CCN(C(=O)Nc2ccc(-c3ncc(C(C)C)o3)cc2)CC1 ZINC000432124343 859002763 /nfs/dbraw/zinc/00/27/63/859002763.db2.gz JKPFPHMQKGNFCS-UHFFFAOYSA-N 0 3 421.501 4.223 20 0 HIADHN COc1ccc(Nc2nc(C(=O)N(CC(C)C)C3CCN(C)CC3)cs2)cc1 ZINC000467554362 881376481 /nfs/dbraw/zinc/37/64/81/881376481.db2.gz NUOMHILRDHBJSI-UHFFFAOYSA-N 0 3 402.564 4.088 20 0 HIADHN COc1ccc([C@H](CNCc2csc(Cl)c2Cl)N2CCOCC2)cc1 ZINC000432238195 859062534 /nfs/dbraw/zinc/06/25/34/859062534.db2.gz OCPLYYNRGHMONW-INIZCTEOSA-N 0 3 401.359 4.227 20 0 HIADHN O=C(NCc1ccccc1)[C@H](NC[C@@H]1CCO[C@H]1c1ccccc1)c1ccccc1 ZINC000432241127 859063760 /nfs/dbraw/zinc/06/37/60/859063760.db2.gz HZSWBTWACOBCTJ-GVAUOCQISA-N 0 3 400.522 4.412 20 0 HIADHN CCOc1cc(CN2CCCO[C@@H](CC)C2)ccc1OCC(=O)Nc1ccccc1 ZINC000467562735 881386735 /nfs/dbraw/zinc/38/67/35/881386735.db2.gz CQVAICNNOKNOHW-NRFANRHFSA-N 0 3 412.530 4.104 20 0 HIADHN CC(C)(CNC(=O)Cc1cscc1Br)N1CCc2ccccc2C1 ZINC000432400469 859145263 /nfs/dbraw/zinc/14/52/63/859145263.db2.gz KLQABKBXIAOYDA-UHFFFAOYSA-N 0 3 407.377 4.006 20 0 HIADHN COCCn1cc2c(n1)[C@@H](NC1CC(c3cccc(Br)c3)C1)CCC2 ZINC000432441863 859166226 /nfs/dbraw/zinc/16/62/26/859166226.db2.gz KYSHTHBZFGNGKI-KVZIAJEVSA-N 0 3 404.352 4.205 20 0 HIADHN Cc1cc(OCc2cccc(F)c2)ccc1NC(=O)[C@H]1CCCN1C1CCOCC1 ZINC000432490964 859190451 /nfs/dbraw/zinc/19/04/51/859190451.db2.gz QOORSVQABDCZGD-HSZRJFAPSA-N 0 3 412.505 4.295 20 0 HIADHN CC1(C)CN(C(=O)Nc2ccc(CCN3CCSCC3)cc2)[C@H]1c1cccnc1 ZINC000432766697 859346397 /nfs/dbraw/zinc/34/63/97/859346397.db2.gz IFTFXZOGFACOJR-NRFANRHFSA-N 0 3 410.587 4.288 20 0 HIADHN Cc1ccc(-c2cccnc2)cc1NC(=O)N1CCC(CN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000432792421 859362339 /nfs/dbraw/zinc/36/23/39/859362339.db2.gz KPYBFBLOXSWFNU-PMACEKPBSA-N 0 3 422.573 4.410 20 0 HIADHN CN(CCNC(=O)C(C)(C)c1csc(-c2ccccc2F)n1)Cc1ccccc1 ZINC000432875561 859402302 /nfs/dbraw/zinc/40/23/02/859402302.db2.gz ZJVJTBHULTZRSC-UHFFFAOYSA-N 0 3 411.546 4.475 20 0 HIADHN CN(C)[C@@H]1CCOc2c(Nc3cc(C(F)(F)F)nc(-c4ccncc4)n3)cccc21 ZINC000432914670 859427986 /nfs/dbraw/zinc/42/79/86/859427986.db2.gz AYHFGLINSOHYNK-MRXNPFEDSA-N 0 3 415.419 4.108 20 0 HIADHN O=S1(=O)CCCN1[C@H]1CCCN(c2ccnc3ccc(Oc4ccccc4)cc32)C1 ZINC000432922766 859432442 /nfs/dbraw/zinc/43/24/42/859432442.db2.gz BLVDGOIEPLZHHX-SFHVURJKSA-N 0 3 423.538 4.031 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1NC(=O)CSCCN(C)Cc1ccccc1 ZINC000433038496 859494466 /nfs/dbraw/zinc/49/44/66/859494466.db2.gz JWVXLQSWWIIRAU-UHFFFAOYSA-N 0 3 408.571 4.293 20 0 HIADHN COC(=O)COc1c(C)cc(CN2CCC(c3ncccc3Cl)CC2)cc1C ZINC000433041599 859496032 /nfs/dbraw/zinc/49/60/32/859496032.db2.gz VGCFBHZJQPCLLB-UHFFFAOYSA-N 0 3 402.922 4.283 20 0 HIADHN CC(=O)Nc1ccc(CN[C@@H](c2cccc(Br)c2)C2CCOCC2)cn1 ZINC000433064145 859506076 /nfs/dbraw/zinc/50/60/76/859506076.db2.gz WBNXXENOCSKRJW-HXUWFJFHSA-N 0 3 418.335 4.060 20 0 HIADHN c1cc(CN2CCC(Nc3ccc(Cc4nnc5n4CCCCC5)cc3)CC2)ccn1 ZINC000467638189 881435187 /nfs/dbraw/zinc/43/51/87/881435187.db2.gz FPAXTAACBTWFQH-UHFFFAOYSA-N 0 3 416.573 4.067 20 0 HIADHN CCn1cccc(CNCc2cn(Cc3ccccc3)nc2-c2ccc(C)cc2)c1=O ZINC000433178735 859556585 /nfs/dbraw/zinc/55/65/85/859556585.db2.gz SHSCXPXWRITWCF-UHFFFAOYSA-N 0 3 412.537 4.378 20 0 HIADHN CN(C)Cc1ccccc1C(=O)Nc1nccn1Cc1ccc(Br)cc1 ZINC000433368475 859659874 /nfs/dbraw/zinc/65/98/74/859659874.db2.gz XZYCVASDSGQLAT-UHFFFAOYSA-N 0 3 413.319 4.008 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)N[C@@H](c1cc(F)ccc1F)C(F)F ZINC000433612573 859809952 /nfs/dbraw/zinc/80/99/52/859809952.db2.gz NELFVLYQACHVQL-RDJZCZTQSA-N 0 3 415.456 4.469 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)N[C@@H](c2cc(F)ccc2F)C(F)F)c1 ZINC000433657300 859826721 /nfs/dbraw/zinc/82/67/21/859826721.db2.gz UXEDHWTZFJOMFU-IBGZPJMESA-N 0 3 411.443 4.353 20 0 HIADHN C[C@H]1[C@@H](NC(=O)Nc2ccc(Oc3ncc(Cl)cn3)c(Cl)c2)CCCN1C ZINC000433670225 859832848 /nfs/dbraw/zinc/83/28/48/859832848.db2.gz QBSARNPWSOLLQW-NHYWBVRUSA-N 0 3 410.305 4.180 20 0 HIADHN CC(C)(O)CN1CCc2c(cccc2NC(=O)Cc2cccc(Cl)c2Cl)C1 ZINC000433702633 859844308 /nfs/dbraw/zinc/84/43/08/859844308.db2.gz KIHNEKXMCUEEFW-UHFFFAOYSA-N 0 3 407.341 4.304 20 0 HIADHN C[C@@H]1CN(C2CCOCC2)CCN1C(=O)Nc1ccccc1CN(C)c1ccccc1 ZINC000433769731 859885005 /nfs/dbraw/zinc/88/50/05/859885005.db2.gz WZWAXHAHZNSRIP-HXUWFJFHSA-N 0 3 422.573 4.040 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)Nc3ccc(-c4csc(C(F)(F)F)n4)cc3)[C@H]2C1 ZINC000433794674 859895759 /nfs/dbraw/zinc/89/57/59/859895759.db2.gz ZIELZGXHMNSFPD-BBRMVZONSA-N 0 3 410.465 4.387 20 0 HIADHN O=C(Cc1cc(F)ccc1Br)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000433868582 859943208 /nfs/dbraw/zinc/94/32/08/859943208.db2.gz OEMUEFFZIMSYLL-IBGZPJMESA-N 0 3 405.311 4.084 20 0 HIADHN CC(C)n1ncc2c1nc(C1CC1)cc2C(=O)N[C@H]1C[C@@H](C)N(Cc2ccccc2)C1 ZINC000467690541 881484160 /nfs/dbraw/zinc/48/41/60/881484160.db2.gz GNPCXJCBELVTLD-XLIONFOSSA-N 0 3 417.557 4.282 20 0 HIADHN CC(C)CC(=O)Nc1ccc(C(=O)N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)cc1F ZINC000467694412 881489496 /nfs/dbraw/zinc/48/94/96/881489496.db2.gz AABQUPMOOBBDQW-YLJYHZDGSA-N 0 3 411.521 4.203 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NC[C@H](c3cccnc3)C(C)C)c(C)c2)CC1 ZINC000433994948 860025512 /nfs/dbraw/zinc/02/55/12/860025512.db2.gz VZNMUCZXXVHQKE-QFIPXVFZSA-N 0 3 409.578 4.093 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)c1cc(C2CC2)nc2ccc(Cl)cc21 ZINC000433999294 860029401 /nfs/dbraw/zinc/02/94/01/860029401.db2.gz MIXPYUXOGRFEEU-UHFFFAOYSA-N 0 3 408.933 4.365 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)Cc2cc(F)ccc2Br)CC1 ZINC000434034184 860053269 /nfs/dbraw/zinc/05/32/69/860053269.db2.gz BSEHFEBGWRPBTH-UHFFFAOYSA-N 0 3 419.338 4.254 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)Nc1cccc(-c2noc(C3CC3)n2)c1 ZINC000434064841 860074718 /nfs/dbraw/zinc/07/47/18/860074718.db2.gz ZNGQQXBHBAQFBA-UHFFFAOYSA-N 0 3 423.492 4.349 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)N(CCCO)Cc1cccc(Cl)c1 ZINC000434078984 860087400 /nfs/dbraw/zinc/08/74/00/860087400.db2.gz MYXUYCHAWOGXPY-JOCHJYFZSA-N 0 3 415.965 4.071 20 0 HIADHN Cc1cc(NC(=O)NC2CCC3(CC3)CC2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000434212525 860198964 /nfs/dbraw/zinc/19/89/64/860198964.db2.gz VHGOGNNNTDLWFU-OAQYLSRUSA-N 0 3 407.562 4.483 20 0 HIADHN C[C@H]1CN(C2CC2)C[C@H]1NC(=O)c1ccc(CSc2nc3ccccc3[nH]2)cc1 ZINC000467714206 881511362 /nfs/dbraw/zinc/51/13/62/881511362.db2.gz PCWXBLFITQUPGO-YCRPNKLZSA-N 0 3 406.555 4.068 20 0 HIADHN Cc1ccc(-c2ccc(Cl)cc2NC(=O)N[C@@H](C)CCN2CCN(C)CC2)o1 ZINC000434220915 860206259 /nfs/dbraw/zinc/20/62/59/860206259.db2.gz QSLWJQHNRDFBMF-HNNXBMFYSA-N 0 3 404.942 4.056 20 0 HIADHN CSc1cccc(N(C(=O)c2ccc(NC(C)=O)c(F)c2)C2CCN(C)CC2)c1 ZINC000434244369 860225503 /nfs/dbraw/zinc/22/55/03/860225503.db2.gz HPSRVIOPPRESBB-UHFFFAOYSA-N 0 3 415.534 4.247 20 0 HIADHN C[C@H]1CCCN1C(=O)CCN(C)Cc1cn(-c2ccccc2)nc1-c1cccs1 ZINC000434290208 860255918 /nfs/dbraw/zinc/25/59/18/860255918.db2.gz XQRVZUKQWKEARX-SFHVURJKSA-N 0 3 408.571 4.434 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)CCOc1cccc(C)c1 ZINC000434317070 860278057 /nfs/dbraw/zinc/27/80/57/860278057.db2.gz ORJYYWHSIAFQGH-JOCHJYFZSA-N 0 3 418.541 4.355 20 0 HIADHN CCCCS[C@H](C)C(=O)Nc1c(C)cnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000434322098 860282016 /nfs/dbraw/zinc/28/20/16/860282016.db2.gz TXWNYNUWNXEMOI-UYAOXDASSA-N 0 3 400.592 4.499 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1csc(C(C)C)n1 ZINC000434321288 860282032 /nfs/dbraw/zinc/28/20/32/860282032.db2.gz LUSRSEKBFMRKNK-SFHVURJKSA-N 0 3 409.559 4.471 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)[C@@H]1Cc2ccccc2S1 ZINC000434327733 860288844 /nfs/dbraw/zinc/28/88/44/860288844.db2.gz RRIGRAFIHNIXQF-UNMCSNQZSA-N 0 3 418.566 4.294 20 0 HIADHN CCc1ccc(OCC(=O)Nc2c(C)cnn2[C@@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000434328693 860290649 /nfs/dbraw/zinc/29/06/49/860290649.db2.gz VRXSSYIWKJBXOD-JOCHJYFZSA-N 0 3 418.541 4.218 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)[C@H](C)COc1ccccc1 ZINC000434333171 860295104 /nfs/dbraw/zinc/29/51/04/860295104.db2.gz DOKIQNXMJPJTJS-IFMALSPDSA-N 0 3 418.541 4.292 20 0 HIADHN CCOc1ccccc1C(=O)Nc1c(C)cnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000434334628 860296649 /nfs/dbraw/zinc/29/66/49/860296649.db2.gz RLTPBUIRLNADDB-FQEVSTJZSA-N 0 3 404.514 4.290 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)CNc1c(C)cccc1C ZINC000434358881 860310260 /nfs/dbraw/zinc/31/02/60/860310260.db2.gz SAXBTPAJVKEOPN-JOCHJYFZSA-N 0 3 417.557 4.306 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1nccc2ccccc21 ZINC000434412601 860338452 /nfs/dbraw/zinc/33/84/52/860338452.db2.gz PHNQJZUXKCBWJW-OAQYLSRUSA-N 0 3 411.509 4.439 20 0 HIADHN Cc1ccc(C(=O)NC[C@@H]2CCCCN2C2CC2)cc1NC(=O)Nc1ccccc1 ZINC000434445139 860355148 /nfs/dbraw/zinc/35/51/48/860355148.db2.gz MYOZVBNWYIRILI-NRFANRHFSA-N 0 3 406.530 4.386 20 0 HIADHN CSC1(CNC(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)CCC1 ZINC000434547883 860396111 /nfs/dbraw/zinc/39/61/11/860396111.db2.gz RBYVQTPRGOQUBB-UHFFFAOYSA-N 0 3 403.514 4.064 20 0 HIADHN CCOC(=O)CC1(NCC(=O)Nc2cc(C(F)(F)F)ccc2Cl)CCCC1 ZINC000434622224 860435301 /nfs/dbraw/zinc/43/53/01/860435301.db2.gz BWHYGLOGEGCHJM-UHFFFAOYSA-N 0 3 406.832 4.153 20 0 HIADHN Cc1c(Cl)cccc1NC(=O)[C@@H](C)N1CCC(c2ncc3n2CCCC3)CC1 ZINC000434686606 860460491 /nfs/dbraw/zinc/46/04/91/860460491.db2.gz AFPQVCGPWXCMLF-MRXNPFEDSA-N 0 3 400.954 4.388 20 0 HIADHN O[C@@H](COc1ccc(Cl)cc1Cl)CN1CCC(c2ncc3n2CCCC3)CC1 ZINC000434688059 860461960 /nfs/dbraw/zinc/46/19/60/860461960.db2.gz HUORSOZKBFERBR-GOSISDBHSA-N 0 3 424.372 4.146 20 0 HIADHN CSc1ccccc1NC(=O)CCN1CCC(C(=O)c2ccc(F)cc2)CC1 ZINC000434690182 860462813 /nfs/dbraw/zinc/46/28/13/860462813.db2.gz FBUHTPKEIVROID-UHFFFAOYSA-N 0 3 400.519 4.471 20 0 HIADHN Cc1noc([C@H]2CCCN(CCC(=O)Nc3ccc(Oc4ccccc4)cc3)C2)n1 ZINC000434729936 860474279 /nfs/dbraw/zinc/47/42/79/860474279.db2.gz ZZHUGABZJHXYER-SFHVURJKSA-N 0 3 406.486 4.379 20 0 HIADHN CC(C)c1ccc([C@@H](NC(=O)CN(C)C2CCN(c3cnccn3)CC2)C(C)C)cc1 ZINC000434736898 860476478 /nfs/dbraw/zinc/47/64/78/860476478.db2.gz NKUOGMCHXNDBNF-VWLOTQADSA-N 0 3 423.605 4.014 20 0 HIADHN C[C@H](NC(=O)[C@H](C)N1CCC(c2ncc3n2CCCC3)CC1)c1ccc(Cl)cc1 ZINC000434751233 860480780 /nfs/dbraw/zinc/48/07/80/860480780.db2.gz CUUHZBQCOCDYFC-IRXDYDNUSA-N 0 3 414.981 4.318 20 0 HIADHN C[C@H](NC(=O)CN1CCC(c2ncc3n2CCCC3)CC1)c1ccc2c(c1)CCCC2 ZINC000434760202 860484146 /nfs/dbraw/zinc/48/41/46/860484146.db2.gz YPBSIZOGKWMCLU-IBGZPJMESA-N 0 3 420.601 4.155 20 0 HIADHN COc1cccc(NC(=O)CCN2CCC[C@@H](c3nc(C(F)(F)F)cs3)C2)c1 ZINC000434883108 860533855 /nfs/dbraw/zinc/53/38/55/860533855.db2.gz LFKIYCGKSPCMPS-CYBMUJFWSA-N 0 3 413.465 4.379 20 0 HIADHN O[C@H](COc1cccc(C(F)(F)F)c1)CN1CCC(OCC2CCCC2)CC1 ZINC000434907555 860550109 /nfs/dbraw/zinc/55/01/09/860550109.db2.gz YEWVNWKZUOBCPQ-SFHVURJKSA-N 0 3 401.469 4.116 20 0 HIADHN C/C=C/c1ccc(OC[C@H](O)CN2CCC(OCC3CCCC3)CC2)c(OC)c1 ZINC000434909722 860550794 /nfs/dbraw/zinc/55/07/94/860550794.db2.gz PMWHVHSFXQIXJL-YIEJHSOVSA-N 0 3 403.563 4.139 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1ccn(C(C)C)n1)c1ccc(C(F)(F)F)cc1 ZINC000435076504 860630327 /nfs/dbraw/zinc/63/03/27/860630327.db2.gz ISJDVVYEZROAPI-QGZVFWFLSA-N 0 3 411.472 4.687 20 0 HIADHN Cc1cccc(-c2cc(Cl)ccc2NC(=O)N2CCCN([C@H](C)CO)CC2)c1 ZINC000435185844 860685167 /nfs/dbraw/zinc/68/51/67/860685167.db2.gz YTWDZWBNMKCBMP-QGZVFWFLSA-N 0 3 401.938 4.236 20 0 HIADHN CC[C@@H](OC1CCCC1)C(=O)Nc1cc(C)nn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435268654 860709874 /nfs/dbraw/zinc/70/98/74/860709874.db2.gz PFNMBVASXHWSJL-RBBKRZOGSA-N 0 3 410.562 4.315 20 0 HIADHN Cc1cc(NC(=O)Cc2ccc(F)c(F)c2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435279843 860715521 /nfs/dbraw/zinc/71/55/21/860715521.db2.gz QKBVELDAUNOEBO-LJQANCHMSA-N 0 3 410.468 4.098 20 0 HIADHN Cc1cc(NC(=O)Cc2ccccc2Cl)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435280062 860716185 /nfs/dbraw/zinc/71/61/85/860716185.db2.gz MKKFKOHAJYJNAD-FQEVSTJZSA-N 0 3 408.933 4.473 20 0 HIADHN Cc1cc(NC(=O)c2ccnn2C2CCCC2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435282949 860717244 /nfs/dbraw/zinc/71/72/44/860717244.db2.gz VOXFZQAIETZSPR-OAQYLSRUSA-N 0 3 418.545 4.202 20 0 HIADHN CCOc1ccc(C(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000435296643 860724854 /nfs/dbraw/zinc/72/48/54/860724854.db2.gz SOYVTZXAFSRMQQ-OAQYLSRUSA-N 0 3 404.514 4.290 20 0 HIADHN Cc1cc(NC(=O)c2cc3c(s2)CCOC3)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435298439 860726050 /nfs/dbraw/zinc/72/60/50/860726050.db2.gz LXNIMMFVHDUROK-LJQANCHMSA-N 0 3 422.554 4.025 20 0 HIADHN Cc1cc(NC(=O)CCc2cc(F)ccc2F)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435299629 860726905 /nfs/dbraw/zinc/72/69/05/860726905.db2.gz PWHHMUWZQFGVFE-OAQYLSRUSA-N 0 3 424.495 4.488 20 0 HIADHN Cc1cc(NC(=O)[C@H](C)Oc2cccc(C)c2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435303609 860728381 /nfs/dbraw/zinc/72/83/81/860728381.db2.gz ZNSWFQZAESEBCL-RBBKRZOGSA-N 0 3 418.541 4.353 20 0 HIADHN O=C(CCSc1ccccc1)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435370495 860767960 /nfs/dbraw/zinc/76/79/60/860767960.db2.gz ISUMWVAPGVIAML-HXUWFJFHSA-N 0 3 406.555 4.451 20 0 HIADHN O=C(Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)c1cccc(OC(F)F)c1 ZINC000435371006 860768313 /nfs/dbraw/zinc/76/83/13/860768313.db2.gz KWYRNGFSHMIWAV-SFHVURJKSA-N 0 3 412.440 4.184 20 0 HIADHN COc1ccc([C@@H](C)CC(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000435371615 860769554 /nfs/dbraw/zinc/76/95/54/860769554.db2.gz NZSLIKDTCFDUSN-SIKLNZKXSA-N 0 3 418.541 4.471 20 0 HIADHN O=C(COc1ccc(Cl)cc1)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435372292 860770176 /nfs/dbraw/zinc/77/01/76/860770176.db2.gz QYQMZYGCDVTBAO-LJQANCHMSA-N 0 3 410.905 4.001 20 0 HIADHN O=C(Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)c1ccccc1OC(F)F ZINC000435372653 860770652 /nfs/dbraw/zinc/77/06/52/860770652.db2.gz AZHWOELTKZDYRX-KRWDZBQOSA-N 0 3 412.440 4.184 20 0 HIADHN CCC(CC)c1cc(C(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)on1 ZINC000435372942 860770729 /nfs/dbraw/zinc/77/07/29/860770729.db2.gz LMSZYHSGYACDGH-IBGZPJMESA-N 0 3 407.518 4.474 20 0 HIADHN O=C(CCOc1ccccc1Cl)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435372390 860770802 /nfs/dbraw/zinc/77/08/02/860770802.db2.gz ANIXFVOZKWDCLQ-LJQANCHMSA-N 0 3 424.932 4.391 20 0 HIADHN Cc1ccc(O[C@@H](C)C(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000435373521 860771681 /nfs/dbraw/zinc/77/16/81/860771681.db2.gz DVXUAKUMJRXGFC-FPOVZHCZSA-N 0 3 404.514 4.045 20 0 HIADHN C[C@@H](Oc1ccccc1Cl)C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435375301 860772674 /nfs/dbraw/zinc/77/26/74/860772674.db2.gz LRGDOFVGCCONLT-MJGOQNOKSA-N 0 3 424.932 4.390 20 0 HIADHN O=C(CCc1nc2ccccc2o1)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435380445 860776705 /nfs/dbraw/zinc/77/67/05/860776705.db2.gz RKNKMPZVCIZFDZ-IBGZPJMESA-N 0 3 415.497 4.043 20 0 HIADHN Cc1nc(CCCC(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)cs1 ZINC000435380311 860776921 /nfs/dbraw/zinc/77/69/21/860776921.db2.gz NJMQIRKAGPLXFT-HXUWFJFHSA-N 0 3 409.559 4.056 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)[C@@H]1C[C@H]1c1cccc(F)c1F ZINC000435381458 860777815 /nfs/dbraw/zinc/77/78/15/860777815.db2.gz TZYKEULKFGNYJX-YZGWKJHDSA-N 0 3 422.479 4.351 20 0 HIADHN CC[C@H](OC1CCCCC1)C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435381729 860778128 /nfs/dbraw/zinc/77/81/28/860778128.db2.gz XPINQQMVKIARGZ-UNMCSNQZSA-N 0 3 410.562 4.397 20 0 HIADHN CC[C@H](Oc1cccc(C)c1)C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435382035 860778236 /nfs/dbraw/zinc/77/82/36/860778236.db2.gz XETOEGXKUIXIOH-GGAORHGYSA-N 0 3 418.541 4.435 20 0 HIADHN Cc1cc(NC(=O)NCCc2ccc(C)cc2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435525554 860841929 /nfs/dbraw/zinc/84/19/29/860841929.db2.gz FAIVORQHHMCUEO-QHCPKHFHSA-N 0 3 417.557 4.311 20 0 HIADHN Cc1cc(NC(=O)Nc2cnn(CC(C)C)c2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435537365 860851160 /nfs/dbraw/zinc/85/11/60/860851160.db2.gz PGBJWFAREKVUET-NRFANRHFSA-N 0 3 421.549 4.135 20 0 HIADHN Cc1cc(NC(=O)N[C@@H](C)c2ncc(C)s2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435538878 860852479 /nfs/dbraw/zinc/85/24/79/860852479.db2.gz ZNGQHRWOYZHYEC-HKUYNNGSSA-N 0 3 424.574 4.286 20 0 HIADHN Cc1c(NC(=O)NCC(C)(C)N2CCc3ccccc3C2)cnn1-c1ccccc1 ZINC000435548023 860862570 /nfs/dbraw/zinc/86/25/70/860862570.db2.gz LWSFBAZZGNMSEM-UHFFFAOYSA-N 0 3 403.530 4.139 20 0 HIADHN Cc1ccccc1NCCC(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435636839 860928594 /nfs/dbraw/zinc/92/85/94/860928594.db2.gz OECCPPCCIJWXAX-OAQYLSRUSA-N 0 3 403.530 4.079 20 0 HIADHN Cc1ccccc1NCCC(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435636838 860929147 /nfs/dbraw/zinc/92/91/47/860929147.db2.gz OECCPPCCIJWXAX-NRFANRHFSA-N 0 3 403.530 4.079 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)c1cc2c(cccc2F)[nH]1 ZINC000435647626 860933036 /nfs/dbraw/zinc/93/30/36/860933036.db2.gz SBFKIALJGIROJI-QGZVFWFLSA-N 0 3 403.461 4.203 20 0 HIADHN CCOc1c(Cl)cc(NC(=O)N(CCN(C)C)Cc2ccccn2)cc1Cl ZINC000467777696 881597453 /nfs/dbraw/zinc/59/74/53/881597453.db2.gz MRJOYSBWZPTIHZ-UHFFFAOYSA-N 0 3 411.333 4.383 20 0 HIADHN CC(C)C[C@H]1CCCN1CC(=O)N(Cc1nnc(-c2ccccc2Cl)o1)C1CC1 ZINC000435677986 860958047 /nfs/dbraw/zinc/95/80/47/860958047.db2.gz KYPGKOIMQNSDCW-QGZVFWFLSA-N 0 3 416.953 4.392 20 0 HIADHN COc1cccc(CCC(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000435690139 860972116 /nfs/dbraw/zinc/97/21/16/860972116.db2.gz BKXXSOPSAJYUCU-QFIPXVFZSA-N 0 3 418.541 4.218 20 0 HIADHN C[C@@H]1[C@@H](C(=O)NC2CCN(CCOc3ccc(Cl)cc3)CC2)[C@H]1c1ccccc1 ZINC000435706500 860989402 /nfs/dbraw/zinc/98/94/02/860989402.db2.gz ONKFLMQKTFYPED-JJEOQYAHSA-N 0 3 412.961 4.349 20 0 HIADHN CCCN(C(=O)Cc1ccccc1NC(C)=O)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000435719503 861004967 /nfs/dbraw/zinc/00/49/67/861004967.db2.gz NGGZZYRSEKLNTG-QHCPKHFHSA-N 0 3 407.558 4.091 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N[C@H]3C[C@H](c4cccc(F)c4)C3)c(C)c2)CC1 ZINC000435730629 861013811 /nfs/dbraw/zinc/01/38/11/861013811.db2.gz GJRNGYJWUBGQRV-XUTJKUGGSA-N 0 3 410.537 4.344 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N[C@@H]3C[C@H]3c3cccc(Cl)c3)c(C)c2)CC1 ZINC000435737478 861019208 /nfs/dbraw/zinc/01/92/08/861019208.db2.gz IJQYPNFVNOVTRJ-RBBKRZOGSA-N 0 3 412.965 4.468 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N1CC(Cc2ccc(F)c(F)c2)C1 ZINC000435858718 861117397 /nfs/dbraw/zinc/11/73/97/861117397.db2.gz RMNRJSNSHJLBMO-LJQANCHMSA-N 0 3 405.514 4.047 20 0 HIADHN CCc1nc(CN(C(C)=O)[C@@H]2CCN(Cc3ccc(-c4ccc(C)cc4)s3)C2)no1 ZINC000435885145 861142134 /nfs/dbraw/zinc/14/21/34/861142134.db2.gz GBHSBUTVAYQIQB-LJQANCHMSA-N 0 3 424.570 4.292 20 0 HIADHN Cc1ccc([C@@H](NCCCc2ccccc2Br)[C@@H](C)S(C)(=O)=O)cc1 ZINC000435895201 861151366 /nfs/dbraw/zinc/15/13/66/861151366.db2.gz XMUCYQKLXLCZHE-UZLBHIALSA-N 0 3 424.404 4.454 20 0 HIADHN Cc1ccc([C@H](NCCCC(=O)Nc2c(C)cccc2C)[C@@H](C)S(C)(=O)=O)cc1 ZINC000435903110 861160416 /nfs/dbraw/zinc/16/04/16/861160416.db2.gz PMWBHRYWZPCCMD-AUSIDOKSSA-N 0 3 416.587 4.095 20 0 HIADHN Cc1ccc([C@H](NCCc2cccc(OC(F)(F)F)c2)[C@H](C)S(C)(=O)=O)cc1 ZINC000435906741 861167342 /nfs/dbraw/zinc/16/73/42/861167342.db2.gz HVSZUJZYBXSNLH-HNAYVOBHSA-N 0 3 415.477 4.200 20 0 HIADHN C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)[C@@](C)(Cc1nc2ccccc2s1)c1ccccc1 ZINC000467803098 881628926 /nfs/dbraw/zinc/62/89/26/881628926.db2.gz MZJPHKDNXVBNBF-ZIYZLLSTSA-N 0 3 419.594 4.396 20 0 HIADHN C[C@H]1CCN(C(=O)Nc2ccc(-n3cccn3)c(F)c2)CCN1Cc1ccccc1 ZINC000437811492 863139932 /nfs/dbraw/zinc/13/99/32/863139932.db2.gz RIYMZYKMKBITGO-SFHVURJKSA-N 0 3 407.493 4.140 20 0 HIADHN Cc1cccc(Oc2ncccc2NC(=O)N(CCN(C)C)C[C@H]2CCCO2)c1C ZINC000437879449 863240846 /nfs/dbraw/zinc/24/08/46/863240846.db2.gz BEEWYKDZIZEXPH-LJQANCHMSA-N 0 3 412.534 4.065 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N[C@@H]2C[C@H]2c2ccc(Cl)cc2Cl)CC1 ZINC000437883348 863247826 /nfs/dbraw/zinc/24/78/26/863247826.db2.gz NDWKESRRUPFKJG-PKOBYXMFSA-N 0 3 414.377 4.038 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)N[C@H]2C[C@@H]2c2ccccc2OC(F)F)CN1Cc1ccccc1 ZINC000438016728 863377047 /nfs/dbraw/zinc/37/70/47/863377047.db2.gz WIGIUWRWVDKIHO-VUBSUSDNSA-N 0 3 415.484 4.106 20 0 HIADHN C[C@H](CN1CCCCC1)NC(=O)c1cc(COc2c(Cl)cccc2Cl)on1 ZINC000467827028 881659350 /nfs/dbraw/zinc/65/93/50/881659350.db2.gz QXYDSJFNPFRBJV-CYBMUJFWSA-N 0 3 412.317 4.165 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)c1ncsc1-c1ccccc1 ZINC000438053432 863420730 /nfs/dbraw/zinc/42/07/30/863420730.db2.gz KLOCAXYGKSMJMO-UHFFFAOYSA-N 0 3 420.582 4.142 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)Nc2ccc(OCC3CCCCC3)cc2)CC1 ZINC000438186453 863612617 /nfs/dbraw/zinc/61/26/17/863612617.db2.gz FJKAOAHFTSXGHL-FQEVSTJZSA-N 0 3 416.610 4.041 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Nc1cc(C(F)(F)F)ccc1N(C)C ZINC000438367443 863828725 /nfs/dbraw/zinc/82/87/25/863828725.db2.gz NLBVTUKRIQARKT-UHFFFAOYSA-N 0 3 414.497 4.429 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)N[C@H]2C[C@@H]2c2ccccc2OC(F)F)CC1 ZINC000438399831 863848241 /nfs/dbraw/zinc/84/82/41/863848241.db2.gz WKCHSEATYNZGMV-MOPGFXCFSA-N 0 3 419.472 4.043 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)c1ccc(-c2noc(C(F)(F)F)n2)cc1 ZINC000438461547 863884122 /nfs/dbraw/zinc/88/41/22/863884122.db2.gz FSTQLBAVTSZEAL-UHFFFAOYSA-N 0 3 424.448 4.021 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)CCc1ccc(OC(F)(F)F)cc1 ZINC000438464093 863886231 /nfs/dbraw/zinc/88/62/31/863886231.db2.gz VPILGKGMYNDXCN-UHFFFAOYSA-N 0 3 400.466 4.170 20 0 HIADHN COc1ccc(-c2ncc(C(=O)N(CCN(C)C)Cc3cccs3)s2)cc1 ZINC000438466341 863888670 /nfs/dbraw/zinc/88/86/70/863888670.db2.gz MQMDXSHJZFQZMO-UHFFFAOYSA-N 0 3 401.557 4.084 20 0 HIADHN COc1ccccc1NC(=O)c1ccc(NC(=O)[C@@H](C)N2CC[C@H](C(C)C)C2)cc1 ZINC000438487770 863904590 /nfs/dbraw/zinc/90/45/90/863904590.db2.gz UISHRCADNCWTIZ-MJGOQNOKSA-N 0 3 409.530 4.252 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)c1cccc(NC(=O)C2CCCCC2)c1 ZINC000438534316 863960715 /nfs/dbraw/zinc/96/07/15/863960715.db2.gz OXMXGPAILGKXPG-UHFFFAOYSA-N 0 3 413.587 4.471 20 0 HIADHN Cc1noc2nc(-c3ccccc3)cc(C(=O)N(CCN(C)C)Cc3cccs3)c12 ZINC000438540863 863967806 /nfs/dbraw/zinc/96/78/06/863967806.db2.gz NPJNRMVKJOEXKY-UHFFFAOYSA-N 0 3 420.538 4.464 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)c2ccnc(OCc3ccccc3)c2)CC1 ZINC000438554768 863985882 /nfs/dbraw/zinc/98/58/82/863985882.db2.gz TYWWOAGIEHZGRY-UHFFFAOYSA-N 0 3 415.537 4.397 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)Nc1ccc(F)c(Br)c1 ZINC000438590858 864019011 /nfs/dbraw/zinc/01/90/11/864019011.db2.gz XHNSYZLPVZZWBU-UHFFFAOYSA-N 0 3 412.278 4.323 20 0 HIADHN CCN(C(=O)C(=O)Nc1ccsc1Cl)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000438653457 864095109 /nfs/dbraw/zinc/09/51/09/864095109.db2.gz FKGXWGOMKGUWCU-HOCLYGCPSA-N 0 3 405.951 4.024 20 0 HIADHN CCN(C(=O)C(=O)Nc1cc2[nH]ccc2cc1C)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000438666640 864120528 /nfs/dbraw/zinc/12/05/28/864120528.db2.gz VIFULAGCGPKDHH-WIYYLYMNSA-N 0 3 418.541 4.099 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)C(=O)Nc1cccc(Oc2ccccc2)c1 ZINC000438746162 864235033 /nfs/dbraw/zinc/23/50/33/864235033.db2.gz PLUZJTYIRVWWRH-UHFFFAOYSA-N 0 3 423.538 4.069 20 0 HIADHN Cc1cccc2nc(CNC3(c4ccc(Br)cc4)CCCC3)cc(=O)n12 ZINC000438761608 864255944 /nfs/dbraw/zinc/25/59/44/864255944.db2.gz RGKGXFSWYYOTMI-UHFFFAOYSA-N 0 3 412.331 4.325 20 0 HIADHN Cc1cc(C(=O)N2CCCC[C@@H]2C)ccc1NC(=O)N(CCN(C)C)C1CCCC1 ZINC000467899172 881761943 /nfs/dbraw/zinc/76/19/43/881761943.db2.gz MEYDCYOTTCCIAS-IBGZPJMESA-N 0 3 414.594 4.348 20 0 HIADHN CCCN(C(=O)c1cccc(C(=O)NC2CC2)c1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000439120642 864556931 /nfs/dbraw/zinc/55/69/31/864556931.db2.gz VQVUFTNFKLWPAC-DEOSSOPVSA-N 0 3 419.569 4.096 20 0 HIADHN C[C@H]1CN(c2ccc(CN[C@@H](c3ccc(Br)s3)C3CC3)cn2)CCO1 ZINC000439141573 864573639 /nfs/dbraw/zinc/57/36/39/864573639.db2.gz OEOIOPRQVOJOTO-ORAYPTAESA-N 0 3 422.392 4.372 20 0 HIADHN C[C@@H](Cc1cccc(Br)c1)NC(=O)N(CCN(C)C)Cc1cccs1 ZINC000439164511 864595456 /nfs/dbraw/zinc/59/54/56/864595456.db2.gz BXEJFLIVPLKDHT-HNNXBMFYSA-N 0 3 424.408 4.215 20 0 HIADHN O=C(NC[C@H]1CCC[C@@H](C(F)(F)F)C1)NCC1(N2CCSCC2)CCCC1 ZINC000439243527 864660871 /nfs/dbraw/zinc/66/08/71/864660871.db2.gz CNFMYCSYWKVRFK-JKSUJKDBSA-N 0 3 407.546 4.016 20 0 HIADHN Cc1ccsc1[C@@H]1C[C@H]1C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000439286678 864705250 /nfs/dbraw/zinc/70/52/50/864705250.db2.gz NUTXWGYSGYBVKZ-XUVXKRRUSA-N 0 3 406.555 4.442 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)N[C@@H]1COc2c1ccc(Cl)c2Cl ZINC000439327877 864766519 /nfs/dbraw/zinc/76/65/19/864766519.db2.gz WCRJUKBFAVNYET-OAHLLOKOSA-N 0 3 414.358 4.262 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)Nc1cc(F)ccc1Br ZINC000467925504 881800186 /nfs/dbraw/zinc/80/01/86/881800186.db2.gz BOBCZFFDIFOKBL-UHFFFAOYSA-N 0 3 416.360 4.071 20 0 HIADHN COc1cccc([C@@H](CNCc2cc(Cl)ccc2OC[C@H]2CCCO2)N(C)C)c1 ZINC000439480609 864846367 /nfs/dbraw/zinc/84/63/67/864846367.db2.gz VLIRIAPGJPTNPI-FGZHOGPDSA-N 0 3 418.965 4.299 20 0 HIADHN CC(C)C(C)(C)C(=O)NC1CCN(CCOc2ccc(Br)cc2)CC1 ZINC000439509037 864857698 /nfs/dbraw/zinc/85/76/98/864857698.db2.gz XHLSSQXBKHOWPA-UHFFFAOYSA-N 0 3 411.384 4.091 20 0 HIADHN COc1ccc(NC(=O)[C@@H](NC2CCC(c3nc(C)no3)CC2)c2ccccc2)cc1 ZINC000439517830 864860501 /nfs/dbraw/zinc/86/05/01/864860501.db2.gz GJBFCEDHTYODMQ-AJTFCVKESA-N 0 3 420.513 4.382 20 0 HIADHN CCCN(C(=O)c1cccc(NC(C)=O)c1C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000467944057 881813577 /nfs/dbraw/zinc/81/35/77/881813577.db2.gz SPVWYAWBHDAXEE-JOCHJYFZSA-N 0 3 407.558 4.470 20 0 HIADHN C[C@@H](NCc1ccccc1CN(C)Cc1ccco1)C(=O)N1CCCc2ccccc21 ZINC000439593941 864915118 /nfs/dbraw/zinc/91/51/18/864915118.db2.gz HKTAIXQKPQBPIU-HXUWFJFHSA-N 0 3 417.553 4.369 20 0 HIADHN COc1ccccc1NC(=O)[C@H](C)NCc1ccccc1CN(C)Cc1ccco1 ZINC000439595505 864918790 /nfs/dbraw/zinc/91/87/90/864918790.db2.gz KCUUMASURTZPIA-SFHVURJKSA-N 0 3 407.514 4.037 20 0 HIADHN CN(C)C(=O)c1cccc(CCN[C@H](C(=O)Nc2ccc(F)cc2)c2ccccc2)c1 ZINC000439607905 864929974 /nfs/dbraw/zinc/92/99/74/864929974.db2.gz RQFHRYFWJQRWIS-QHCPKHFHSA-N 0 3 419.500 4.040 20 0 HIADHN CC(C)(C)c1cnc(NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)s1 ZINC000467956397 881820141 /nfs/dbraw/zinc/82/01/41/881820141.db2.gz DVVGTQHJLQFTMA-UHFFFAOYSA-N 0 3 404.502 4.367 20 0 HIADHN C[C@H](NCC(C)(C)c1c(F)cccc1Cl)C(=O)NC(=O)Nc1ccccc1F ZINC000439636147 864963087 /nfs/dbraw/zinc/96/30/87/864963087.db2.gz BYTJDABRCVSZJT-LBPRGKRZSA-N 0 3 409.864 4.222 20 0 HIADHN C[C@@H](NCC(C)(C)c1c(F)cccc1Cl)C(=O)NC(=O)Nc1ccccc1F ZINC000439636146 864963676 /nfs/dbraw/zinc/96/36/76/864963676.db2.gz BYTJDABRCVSZJT-GFCCVEGCSA-N 0 3 409.864 4.222 20 0 HIADHN COc1ccc(NC(=O)[C@H](C)NCC(C)(C)c2c(F)cccc2Cl)cc1OC ZINC000439648285 864973816 /nfs/dbraw/zinc/97/38/16/864973816.db2.gz WPWWKLAAPUWRLL-ZDUSSCGKSA-N 0 3 408.901 4.391 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)CCCc2nc3ccccc3s2)CC1 ZINC000439731333 865064692 /nfs/dbraw/zinc/06/46/92/865064692.db2.gz NDSRZNJVSRBCIU-KRWDZBQOSA-N 0 3 408.571 4.356 20 0 HIADHN C[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)NC1CCN([C@@H](C)c2ccncc2)CC1 ZINC000439741092 865072807 /nfs/dbraw/zinc/07/28/07/865072807.db2.gz FGMUUARBWMWTFB-RBUKOAKNSA-N 0 3 409.574 4.488 20 0 HIADHN COc1ccc(C2(C(=O)NC3CCN([C@H](C)c4ccncc4)CC3)CCCC2)cc1 ZINC000439742421 865073928 /nfs/dbraw/zinc/07/39/28/865073928.db2.gz USIHXNRLBHXAOT-LJQANCHMSA-N 0 3 407.558 4.244 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)c2cc3c(cccc3OC(F)F)[nH]2)CC1 ZINC000439744298 865076482 /nfs/dbraw/zinc/07/64/82/865076482.db2.gz YIAGMHWBEVCANZ-AWEZNQCLSA-N 0 3 414.456 4.120 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)COc2cc(Cl)ccc2Cl)CC1 ZINC000439763691 865089047 /nfs/dbraw/zinc/08/90/47/865089047.db2.gz AVAOUXMJLUJFFS-CQSZACIVSA-N 0 3 408.329 4.109 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)C[C@@H](c2ccccc2)C(F)(F)F)CC1 ZINC000439763322 865089266 /nfs/dbraw/zinc/08/92/66/865089266.db2.gz HSKZUBOFGDFWMO-UZLBHIALSA-N 0 3 405.464 4.459 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)[C@@H]2C[C@@H]2c2ccccc2OC(F)F)CC1 ZINC000439770280 865095293 /nfs/dbraw/zinc/09/52/93/865095293.db2.gz QEMAQHVPPYOKLW-CDHQVMDDSA-N 0 3 415.484 4.128 20 0 HIADHN CCc1ccccc1CC(=O)Nc1c(C)cnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000467991527 881837613 /nfs/dbraw/zinc/83/76/13/881837613.db2.gz AGEAUNZGUIZBCD-HSZRJFAPSA-N 0 3 402.542 4.382 20 0 HIADHN COc1cc(C)c(NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cc1F ZINC000467998165 881841571 /nfs/dbraw/zinc/84/15/71/881841571.db2.gz KRJBCNFLGDNMEF-UHFFFAOYSA-N 0 3 403.420 4.070 20 0 HIADHN Cc1ccc(NC(=O)NC[C@@H]2CCCN([C@H](C)C(=O)N3[C@@H](C)CCC[C@@H]3C)C2)cc1 ZINC000439885177 865197654 /nfs/dbraw/zinc/19/76/54/865197654.db2.gz CCTMAIUIKFLXNX-BURNTYAHSA-N 0 3 414.594 4.007 20 0 HIADHN CCn1ncc(NC(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)c1C(F)(F)F ZINC000439894413 865207139 /nfs/dbraw/zinc/20/71/39/865207139.db2.gz CPPOGADLYHCNJH-OAHLLOKOSA-N 0 3 409.456 4.050 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3cc(Cl)c(Cl)cc3F)CC2)C[C@@H](C)O1 ZINC000439967188 865258487 /nfs/dbraw/zinc/25/84/87/865258487.db2.gz WIZSUEMBEUGWBT-CHWSQXEVSA-N 0 3 418.340 4.486 20 0 HIADHN CC[C@H](C)NC(=O)[C@@H]1C[C@H](C)N(Cc2ccsc2C(=O)OC)[C@H]2CCCC[C@H]12 ZINC000439982173 865283814 /nfs/dbraw/zinc/28/38/14/865283814.db2.gz IURQXRGKZJBIOS-OBQKDBCYSA-N 0 3 406.592 4.219 20 0 HIADHN COCCc1nc2cc(NC(=O)[C@H]3CCCN(Cc4cccc(F)c4)C3)ccc2o1 ZINC000439988915 865296915 /nfs/dbraw/zinc/29/69/15/865296915.db2.gz OYQQWEUNAGHGSG-KRWDZBQOSA-N 0 3 411.477 4.007 20 0 HIADHN COc1ccc([C@H](Cc2ccc(F)cc2)NC(=O)N(CCN(C)C)C(C)C)cc1 ZINC000440069364 865336566 /nfs/dbraw/zinc/33/65/66/865336566.db2.gz HDKOTPNXQFGXDS-QFIPXVFZSA-N 0 3 401.526 4.100 20 0 HIADHN COc1ccc(OC)c(NC(=O)C[C@H](C)N[C@H](C)c2cn(C(C)(C)C)nc2C)c1 ZINC000468042248 881871424 /nfs/dbraw/zinc/87/14/24/881871424.db2.gz KNMIUUDJRYOMBO-LSDHHAIUSA-N 0 3 402.539 4.032 20 0 HIADHN O=C(NCc1cccc(-c2ccccn2)c1)NC[C@H](c1ccccc1)N1CCCC1 ZINC000440214162 865450119 /nfs/dbraw/zinc/45/01/19/865450119.db2.gz KTHHUCNXRVYZOZ-XMMPIXPASA-N 0 3 400.526 4.385 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)NCc2cccc(-c3ccccn3)c2)c1 ZINC000440250180 865490277 /nfs/dbraw/zinc/49/02/77/865490277.db2.gz ZNMYQTIIQCGSNB-UHFFFAOYSA-N 0 3 402.542 4.330 20 0 HIADHN COc1cc([C@@H](C)NC(=O)N(CCN(C)C)C2CCCC2)ccc1OCC(C)C ZINC000468056343 881879547 /nfs/dbraw/zinc/87/95/47/881879547.db2.gz GTFOZMDQUQFLEU-GOSISDBHSA-N 0 3 405.583 4.307 20 0 HIADHN COc1cc(C(C)=O)ccc1OC[C@H](O)CN1CCC[C@]2(CCCc3ccccc32)C1 ZINC000440327252 865601942 /nfs/dbraw/zinc/60/19/42/865601942.db2.gz QJDXERZDANAXOF-ATIYNZHBSA-N 0 3 423.553 4.008 20 0 HIADHN COC[C@H](C)n1c(C)cc(C(=O)CN(C)C2CCN(Cc3ccccc3)CC2)c1C ZINC000440447957 865751613 /nfs/dbraw/zinc/75/16/13/865751613.db2.gz DQFGBQRJNLFFJQ-FQEVSTJZSA-N 0 3 411.590 4.091 20 0 HIADHN CCn1ncc2cc(C(=O)N(c3cccc(SC)c3)C3CCN(C)CC3)c(C)nc21 ZINC000440471430 865777320 /nfs/dbraw/zinc/77/73/20/865777320.db2.gz QMUIPCJYTRWUDG-UHFFFAOYSA-N 0 3 423.586 4.223 20 0 HIADHN OC[C@@]1(NCCSc2ccnc3cc(Cl)ccc32)CCOc2ccccc21 ZINC000440484239 865787942 /nfs/dbraw/zinc/78/79/42/865787942.db2.gz ZVDREWCNZUKUMS-NRFANRHFSA-N 0 3 400.931 4.240 20 0 HIADHN C[C@@H](NC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1)c1ccc(-n2cccn2)cc1 ZINC000440596660 865829747 /nfs/dbraw/zinc/82/97/47/865829747.db2.gz ABXRBANDDNVAMY-WIYYLYMNSA-N 0 3 406.505 4.101 20 0 HIADHN Cc1ccc(-c2nnc(-c3ccc(C(=O)N[C@H]4C[C@H](C)N(C5CC5)C4)cc3)o2)cc1 ZINC000440917068 866012428 /nfs/dbraw/zinc/01/24/28/866012428.db2.gz ZGIQZTOEVFOFFI-JXFKEZNVSA-N 0 3 402.498 4.067 20 0 HIADHN O=C(CCN1CCc2ccccc2[C@H]1CO)Nc1ccccc1Oc1ccccc1 ZINC000440918898 866013960 /nfs/dbraw/zinc/01/39/60/866013960.db2.gz QFRUDHUKQWRBND-HSZRJFAPSA-N 0 3 402.494 4.399 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)c2cnn(-c3cccc(C(F)(F)F)c3)c2C2CC2)CN1C1CC1 ZINC000440924996 866021064 /nfs/dbraw/zinc/02/10/64/866021064.db2.gz VXGIZSHXLCYWCJ-CJNGLKHVSA-N 0 3 418.463 4.124 20 0 HIADHN C[C@H]1C[C@H](NC(=O)Cc2csc(-c3ccc(Cl)cc3Cl)n2)CN1C1CC1 ZINC000440930229 866026208 /nfs/dbraw/zinc/02/62/08/866026208.db2.gz GEETXYOWEJEMDM-AAEUAGOBSA-N 0 3 410.370 4.401 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)Cc2csc(-c3ccc(Cl)cc3Cl)n2)CN1C1CC1 ZINC000440930231 866027240 /nfs/dbraw/zinc/02/72/40/866027240.db2.gz GEETXYOWEJEMDM-WCQYABFASA-N 0 3 410.370 4.401 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)c2cn(C(C)(C)C)nc2-c2ccccc2Cl)CN1C1CC1 ZINC000440933925 866032210 /nfs/dbraw/zinc/03/22/10/866032210.db2.gz RNAVMRFWGXYMNQ-CABCVRRESA-N 0 3 400.954 4.314 20 0 HIADHN Cc1ccc([C@H](OC[C@@H](O)CN2CCc3ccccc3[C@@H]2CO)c2ccccc2)cc1 ZINC000440935420 866033641 /nfs/dbraw/zinc/03/36/41/866033641.db2.gz KYHHWUXYGWENSQ-DOEKTCAHSA-N 0 3 417.549 4.054 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)[C@H](c2c(F)cccc2Cl)N(C)C)C1 ZINC000468115490 881938752 /nfs/dbraw/zinc/93/87/52/881938752.db2.gz PNTBCSPBDWFEMP-KUDFPVQQSA-N 0 3 403.929 4.034 20 0 HIADHN COCc1nc(C(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)c(-c2ccccc2)s1 ZINC000441058234 866137912 /nfs/dbraw/zinc/13/79/12/866137912.db2.gz AFCBVGQLUOOYSN-HXUWFJFHSA-N 0 3 421.566 4.303 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)c1cc(F)c(F)cc1Br ZINC000441314155 866385973 /nfs/dbraw/zinc/38/59/73/866385973.db2.gz HVDWAONHEOVZHT-SFHVURJKSA-N 0 3 409.274 4.294 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3ccccc3OC[C@@H]3CCCCO3)cc2)CC1 ZINC000468130221 881972126 /nfs/dbraw/zinc/97/21/26/881972126.db2.gz FLMWBKRAUVPQLO-QFIPXVFZSA-N 0 3 423.557 4.029 20 0 HIADHN COc1cc(CN[C@]2(CO)CCCc3ccccc32)ccc1OCc1c(C)noc1C ZINC000441339572 866410558 /nfs/dbraw/zinc/41/05/58/866410558.db2.gz ZCBGDAFFNSOQLA-VWLOTQADSA-N 0 3 422.525 4.193 20 0 HIADHN Cc1nn(C)c(N2CCOCC2)c1CNCc1sc2ccc(Cl)cc2c1C ZINC000441355525 866425569 /nfs/dbraw/zinc/42/55/69/866425569.db2.gz KBFBKVLVUAWBMP-UHFFFAOYSA-N 0 3 404.967 4.031 20 0 HIADHN CCN(CC(F)(F)F)C(=O)[C@@H]1CCCN(Cc2c(C)cc(C)c(C(C)=O)c2C)C1 ZINC000441364030 866432363 /nfs/dbraw/zinc/43/23/63/866432363.db2.gz YUDDFNXWWXBETI-GOSISDBHSA-N 0 3 412.496 4.437 20 0 HIADHN COc1cc(-c2nnc(CN3CCC[C@@H]3Cc3ccccc3C)o2)cc(OC)c1OC ZINC000441386678 866459109 /nfs/dbraw/zinc/45/91/09/866459109.db2.gz QMMFPZOIHVTYAF-LJQANCHMSA-N 0 3 423.513 4.278 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)N(C)CCCCCc2cc(-c3ccccc3)no2)CN1C1CC1 ZINC000441394337 866466595 /nfs/dbraw/zinc/46/65/95/866466595.db2.gz OJMYVRPRBQAWQX-AZUAARDMSA-N 0 3 410.562 4.321 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N(Cc1ccccc1)[C@@H](C)C(C)(C)C ZINC000441400521 866475030 /nfs/dbraw/zinc/47/50/30/866475030.db2.gz GOTLUNLGBCJBCB-IBGZPJMESA-N 0 3 409.574 4.459 20 0 HIADHN CC1CCC(N(CC(=O)N(Cc2ccco2)CC(F)(F)F)C[C@H]2CCCO2)CC1 ZINC000441443527 866520231 /nfs/dbraw/zinc/52/02/31/866520231.db2.gz BEYXSAQPMSVVMY-DAWZGUTISA-N 0 3 416.484 4.230 20 0 HIADHN CC[C@H](CNC(=O)N(Cc1ccco1)C1CCN(C)CC1)Oc1cccc(Cl)c1 ZINC000441493322 866576072 /nfs/dbraw/zinc/57/60/72/866576072.db2.gz SHOMETFAILQOKO-LJQANCHMSA-N 0 3 419.953 4.396 20 0 HIADHN COc1ccc(Br)cc1-c1nc(CN2CC[C@H]([C@@H]3CCOC3)C2)cs1 ZINC000441658709 866774103 /nfs/dbraw/zinc/77/41/03/866774103.db2.gz WOZDIWMIZMMIJF-UONOGXRCSA-N 0 3 423.376 4.440 20 0 HIADHN Cc1cc(Cl)c(NC(=O)C(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)cc1Cl ZINC000441706472 866814640 /nfs/dbraw/zinc/81/46/40/866814640.db2.gz XHXMPDLCHZWISK-ACJLOTCBSA-N 0 3 408.329 4.048 20 0 HIADHN CC(C)Sc1c(Cl)cccc1NC(=O)C(=O)N[C@H](C)CN1CCC[C@H](C)C1 ZINC000441739313 866828619 /nfs/dbraw/zinc/82/86/19/866828619.db2.gz QOGLHIGNGSXCGM-LSDHHAIUSA-N 0 3 411.999 4.016 20 0 HIADHN Cc1nn(C(C)(C)C)cc1[C@H](C)NC(=O)N(CCN(C)C)Cc1ccc(F)c(F)c1 ZINC000468157840 882022314 /nfs/dbraw/zinc/02/23/14/882022314.db2.gz JXDVBTYOCLPZOI-HNNXBMFYSA-N 0 3 421.536 4.059 20 0 HIADHN C[C@@H](Sc1ccccc1)c1ccc(NC(=O)C(=O)N(C)CCN(C)C2CC2)cc1 ZINC000441943823 867009845 /nfs/dbraw/zinc/00/98/45/867009845.db2.gz UUDTYTRYVYTFLV-QGZVFWFLSA-N 0 3 411.571 4.031 20 0 HIADHN CN(C(=O)N[C@@H]1CCCc2sc(-c3ccc(F)cc3)nc21)[C@H]1CCN(C2CC2)C1 ZINC000468167390 882043650 /nfs/dbraw/zinc/04/36/50/882043650.db2.gz AELPUAAQSIJALG-ZWKOTPCHSA-N 0 3 414.550 4.205 20 0 HIADHN CN(C(=O)N[C@H]1CCCc2sc(-c3ccc(F)cc3)nc21)[C@@H]1CCN(C2CC2)C1 ZINC000468167387 882043876 /nfs/dbraw/zinc/04/38/76/882043876.db2.gz AELPUAAQSIJALG-MSOLQXFVSA-N 0 3 414.550 4.205 20 0 HIADHN Cc1ccc([C@H](Cn2ccnc2)NC(=O)c2cccc(CN3CCCC3)c2)c(C)c1 ZINC000442187627 867209931 /nfs/dbraw/zinc/20/99/31/867209931.db2.gz KSASPTVJPJRHCM-DEOSSOPVSA-N 0 3 402.542 4.267 20 0 HIADHN Cc1c(NC(=O)N(CCN(C)C)Cc2cccc(Cl)c2)cnn1CCC(C)C ZINC000442228007 867258189 /nfs/dbraw/zinc/25/81/89/867258189.db2.gz HRHZSMCQYWSBMB-UHFFFAOYSA-N 0 3 405.974 4.487 20 0 HIADHN Cc1ccc([C@@H](Cn2ccnc2)NC(=O)N(CCN(C)C)Cc2ccccc2)c(C)c1 ZINC000442233504 867268697 /nfs/dbraw/zinc/26/86/97/867268697.db2.gz DXRWYAFYDOQGAY-XMMPIXPASA-N 0 3 419.573 4.015 20 0 HIADHN CCN(C(=O)c1cc2cnn(CC)c2nc1C)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000442306756 867317637 /nfs/dbraw/zinc/31/76/37/867317637.db2.gz QNFPJLSGNYAUBC-NQIIRXRSSA-N 0 3 405.546 4.057 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N2CCc3c2cccc3-c2ccccc2)CC1 ZINC000468195447 882073301 /nfs/dbraw/zinc/07/33/01/882073301.db2.gz FRFVGJSYUWGQSO-UHFFFAOYSA-N 0 3 407.558 4.315 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3ccncc3Oc3ccccc3)CC2)C[C@@H](C)O1 ZINC000442693568 867628607 /nfs/dbraw/zinc/62/86/07/867628607.db2.gz PPFVDEUAGQKAOQ-WOJBJXKFSA-N 0 3 423.557 4.225 20 0 HIADHN Cc1sc(Br)c(C(=O)N(C)C[C@@H]2CCN(C)[C@H]2c2cccnc2)c1C ZINC000442744275 867661582 /nfs/dbraw/zinc/66/15/82/867661582.db2.gz GXENSEAHZDZGGV-RDJZCZTQSA-N 0 3 422.392 4.287 20 0 HIADHN CC(C)(Cc1ccc(C(F)(F)F)cc1)NCC(=O)N1CCC(c2ccccc2)=N1 ZINC000442790309 867676001 /nfs/dbraw/zinc/67/60/01/867676001.db2.gz ZXTZMLYCLVXRSU-UHFFFAOYSA-N 0 3 403.448 4.253 20 0 HIADHN C[C@H]1CN(C2CCOCC2)CCN1C(=O)c1[nH]ccc1-c1c(Cl)cccc1Cl ZINC000442808497 867682700 /nfs/dbraw/zinc/68/27/00/867682700.db2.gz HPJIFOHLFDDVHT-AWEZNQCLSA-N 0 3 422.356 4.314 20 0 HIADHN CCO[C@H]1C[C@H](NCc2nc(COC)sc2-c2ccccc2)C12CCOCC2 ZINC000442856513 867700908 /nfs/dbraw/zinc/70/09/08/867700908.db2.gz LPOUDRLSBNWCIA-OALUTQOASA-N 0 3 402.560 4.020 20 0 HIADHN CN1CCN(CCN[C@@H](c2ccccc2Cl)c2cc(F)ccc2F)CC1(C)C ZINC000442874813 867710067 /nfs/dbraw/zinc/71/00/67/867710067.db2.gz NYOUOMHUWCBPOY-NRFANRHFSA-N 0 3 407.936 4.323 20 0 HIADHN C[C@H](CC(=O)N1CCCCCC1)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1 ZINC000443092096 867816365 /nfs/dbraw/zinc/81/63/65/867816365.db2.gz GDVRLWWHAFAILZ-NFBKMPQASA-N 0 3 407.558 4.007 20 0 HIADHN C[C@@H](NC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1)c1ccc(Br)s1 ZINC000443166796 867854279 /nfs/dbraw/zinc/85/42/79/867854279.db2.gz JLQHRPJADBDAFC-HACGYAERSA-N 0 3 408.365 4.316 20 0 HIADHN COc1cc(-c2noc([C@H](C)N3[C@H](C)CC[C@H]3C)n2)ccc1OC[C@H]1CCCO1 ZINC000443194215 867869091 /nfs/dbraw/zinc/86/90/91/867869091.db2.gz IDXTUKLXHJSZRN-XLMAVXFVSA-N 0 3 401.507 4.237 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(NS(C)(=O)=O)cc1)c1ccc(Br)s1 ZINC000443196643 867871653 /nfs/dbraw/zinc/87/16/53/867871653.db2.gz OCIXPTFCUCZFKC-GHMZBOCLSA-N 0 3 403.367 4.294 20 0 HIADHN C[C@@H](c1nc(-c2cc(C(F)(F)F)ccc2-n2cncn2)no1)N1[C@H](C)CC[C@@H]1C ZINC000443213680 867878755 /nfs/dbraw/zinc/87/87/55/867878755.db2.gz RQGCQONUKSIZRZ-XQQFMLRXSA-N 0 3 406.412 4.270 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(F)cc2)CC1)c1c[nH]cc1-c1ccccc1 ZINC000443334289 867908219 /nfs/dbraw/zinc/90/82/19/867908219.db2.gz SIRNXCZCSJYFFE-UHFFFAOYSA-N 0 3 407.489 4.094 20 0 HIADHN Cc1ccc2[nH]cc(CCC(=O)NC3CCN(CCOc4ccc(F)cc4)CC3)c2c1 ZINC000443339024 867912070 /nfs/dbraw/zinc/91/20/70/867912070.db2.gz YVFZQWCLYNJGRD-UHFFFAOYSA-N 0 3 423.532 4.208 20 0 HIADHN Cc1cc(F)cc2[nH]c(C(=O)NC3CCN(CCOc4ccc(F)cc4)CC3)cc21 ZINC000443339228 867912420 /nfs/dbraw/zinc/91/24/20/867912420.db2.gz BRXZUNOPIQSJPG-UHFFFAOYSA-N 0 3 413.468 4.028 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(F)cc2)CC1)[C@@H]1CCSc2ccccc21 ZINC000443342820 867914314 /nfs/dbraw/zinc/91/43/14/867914314.db2.gz IBFQELHTTDXDRQ-OAQYLSRUSA-N 0 3 414.546 4.065 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(F)cc2)CC1)[C@@H]1C[C@@]12CCCc1ccccc12 ZINC000443341789 867914379 /nfs/dbraw/zinc/91/43/79/867914379.db2.gz JHEVLONZWQFHBO-AZGAKELHSA-N 0 3 422.544 4.079 20 0 HIADHN Cc1ccc(CCCC(=O)NC2CCN(CCOc3ccc(F)cc3)CC2)s1 ZINC000443353558 867922567 /nfs/dbraw/zinc/92/25/67/867922567.db2.gz CTZUJPVQVMXNBV-UHFFFAOYSA-N 0 3 404.551 4.178 20 0 HIADHN CC[C@@]1(C)Oc2ccc(NC(=O)N(CCN(C)C)Cc3ccc(F)c(F)c3)cc2O1 ZINC000443375499 867937163 /nfs/dbraw/zinc/93/71/63/867937163.db2.gz SQTFJDVVOIALHD-QFIPXVFZSA-N 0 3 419.472 4.458 20 0 HIADHN CO[C@@H](C)c1noc(CN2CCCN([C@H](C)c3ccc(C(F)(F)F)cc3)CC2)n1 ZINC000468239355 882136506 /nfs/dbraw/zinc/13/65/06/882136506.db2.gz FOIAFAHREHPNJK-CABCVRRESA-N 0 3 412.456 4.065 20 0 HIADHN Cc1cc(CN2CCC[C@H](CNC(=O)C(C)(C)C)C2)nc(-c2ccc(Cl)cc2)n1 ZINC000443603252 868162473 /nfs/dbraw/zinc/16/24/73/868162473.db2.gz JULULTVIFWEMEQ-QGZVFWFLSA-N 0 3 414.981 4.480 20 0 HIADHN Cc1cc(CN2CCC[C@H](CNC(=O)C(C)C)C2)nc(-c2ccc(Cl)cc2)n1 ZINC000443619673 868184924 /nfs/dbraw/zinc/18/49/24/868184924.db2.gz BWIUNJUKXGSYIS-QGZVFWFLSA-N 0 3 400.954 4.090 20 0 HIADHN Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)NCCCCN1C[C@@H](C)O[C@H](C)C1 ZINC000443669257 868277051 /nfs/dbraw/zinc/27/70/51/868277051.db2.gz XTWOOQXNYZTVNF-HUUCEWRRSA-N 0 3 421.994 4.391 20 0 HIADHN COc1ccc(-c2cc(C(=O)NCCCCN3C[C@@H](C)O[C@H](C)C3)sc2C)cc1 ZINC000443671616 868278051 /nfs/dbraw/zinc/27/80/51/868278051.db2.gz CQCBZCFILAKRTJ-IAGOWNOFSA-N 0 3 416.587 4.351 20 0 HIADHN C[C@H]1CN(CCCCNC(=O)c2csc(-c3ccccc3Cl)n2)C[C@H](C)O1 ZINC000443671787 868278479 /nfs/dbraw/zinc/27/84/79/868278479.db2.gz DLSSDXADGKCKBK-GJZGRUSLSA-N 0 3 407.967 4.083 20 0 HIADHN C[C@@H](NC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1)c1ccc(Br)s1 ZINC000443734969 868314143 /nfs/dbraw/zinc/31/41/43/868314143.db2.gz VDEJTDJIPXLQRA-ZBFHGGJFSA-N 0 3 422.392 4.488 20 0 HIADHN CCOC(=O)c1c(NC(=O)[C@@H](C)C(F)(F)F)sc2c1CC(C)(C)NC2(C)C ZINC000443819353 868351423 /nfs/dbraw/zinc/35/14/23/868351423.db2.gz YIFPDBYYPIWFCA-SECBINFHSA-N 0 3 406.470 4.221 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N3CC(Cc4ccccc4Cl)C3)cc2)CC1 ZINC000443834111 868365278 /nfs/dbraw/zinc/36/52/78/868365278.db2.gz YIIOENNMGYVXOS-UHFFFAOYSA-N 0 3 411.977 4.185 20 0 HIADHN Cc1ccccc1[C@H]([C@H](C)NC(=O)C(=O)Nc1ccccc1SC(C)C)N(C)C ZINC000443834731 868366516 /nfs/dbraw/zinc/36/65/16/868366516.db2.gz NOBCRFRUUCUAMK-UWJYYQICSA-N 0 3 413.587 4.242 20 0 HIADHN CSc1ccc(Cl)cc1NC(=O)C(=O)N[C@@H](C)[C@H](c1ccccc1C)N(C)C ZINC000443840919 868371211 /nfs/dbraw/zinc/37/12/11/868371211.db2.gz YTRRGJRZKAZZRO-IFXJQAMLSA-N 0 3 419.978 4.116 20 0 HIADHN Cc1ccccc1[C@@H]([C@H](C)NC(=O)C(=O)Nc1ccc(Cl)c(Cl)c1)N(C)C ZINC000443841271 868372627 /nfs/dbraw/zinc/37/26/27/868372627.db2.gz JRRAYOOEZMPFMN-SCLBCKFNSA-N 0 3 408.329 4.048 20 0 HIADHN Cc1ccccc1[C@@H]([C@H](C)NC(=O)C(=O)Nc1ccc(C(F)(F)F)c(C)c1)N(C)C ZINC000443846508 868375810 /nfs/dbraw/zinc/37/58/10/868375810.db2.gz WAOSFULIRHOHPU-HNAYVOBHSA-N 0 3 421.463 4.068 20 0 HIADHN Cc1ccccc1[C@@H]([C@H](C)NC(=O)C(=O)Nc1ccccc1OC1CCCC1)N(C)C ZINC000443846607 868377357 /nfs/dbraw/zinc/37/73/57/868377357.db2.gz ZXJJXCFVKYSKDS-FDDCHVKYSA-N 0 3 423.557 4.063 20 0 HIADHN O=C1[C@H](NCc2ccc(Oc3cccc(F)c3)cc2)CCCN1Cc1ccccn1 ZINC000443986938 868510846 /nfs/dbraw/zinc/51/08/46/868510846.db2.gz IXMNMXFPWADPER-HSZRJFAPSA-N 0 3 405.473 4.294 20 0 HIADHN COc1ccc(CN[C@@H]2CCN(c3ncccc3Cl)C2)c(OCc2cccnc2)c1 ZINC000444000511 868520616 /nfs/dbraw/zinc/52/06/16/868520616.db2.gz GVMWIRJGWVMLEF-LJQANCHMSA-N 0 3 424.932 4.086 20 0 HIADHN C[C@H](C(=O)Nc1cccc(C(=O)Nc2ccc(Cl)cn2)c1)N1[C@H](C)CC[C@@H]1C ZINC000444002580 868522747 /nfs/dbraw/zinc/52/27/47/868522747.db2.gz JZRZFBBVNWZDTA-QLFBSQMISA-N 0 3 400.910 4.187 20 0 HIADHN C[C@H](NC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(Br)s1 ZINC000444107180 868622542 /nfs/dbraw/zinc/62/25/42/868622542.db2.gz VDEJTDJIPXLQRA-GOEBONIOSA-N 0 3 422.392 4.488 20 0 HIADHN Cc1oc(-c2ccccc2)c(C(=O)NCc2ccccc2CN2CCC(O)CC2)c1C ZINC000444128059 868631918 /nfs/dbraw/zinc/63/19/18/868631918.db2.gz XQXCPPMIURQAGZ-UHFFFAOYSA-N 0 3 418.537 4.450 20 0 HIADHN C[C@@H](Oc1cccc2ccccc21)C(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000444299661 868730645 /nfs/dbraw/zinc/73/06/45/868730645.db2.gz CNDMQZAQIXGNKM-LJQANCHMSA-N 0 3 418.537 4.450 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)[C@H]1C[C@H]1c1cccc(C(F)(F)F)c1 ZINC000444447881 868831723 /nfs/dbraw/zinc/83/17/23/868831723.db2.gz AQIJFGVOGCVYTM-SFTDATJTSA-N 0 3 418.459 4.404 20 0 HIADHN COc1ccc(CCCCCC(=O)Nc2cccc(CN3CCC(O)CC3)c2)cc1 ZINC000444453775 868834136 /nfs/dbraw/zinc/83/41/36/868834136.db2.gz KDOWUMXROXZGJC-UHFFFAOYSA-N 0 3 410.558 4.394 20 0 HIADHN Cc1cccc(-c2nc(CC(=O)Nc3cccc(CN4CCC(O)CC4)c3)cs2)c1 ZINC000444461119 868837028 /nfs/dbraw/zinc/83/70/28/868837028.db2.gz OUGLDMAHSALXBZ-UHFFFAOYSA-N 0 3 421.566 4.256 20 0 HIADHN COc1cccc(C2(C(=O)Nc3cccc(CN4CCC(CO)CC4)c3)CCCC2)c1 ZINC000444535009 868872458 /nfs/dbraw/zinc/87/24/58/868872458.db2.gz KJFNGWVVGHPKCT-UHFFFAOYSA-N 0 3 422.569 4.350 20 0 HIADHN CCOc1cc(N2CCOC(C)(C)C2)ccc1NC(=O)[C@H]1CCCN1C1CCCC1 ZINC000444545207 868876988 /nfs/dbraw/zinc/87/69/88/868876988.db2.gz LBVJPTMRGXMRPD-OAQYLSRUSA-N 0 3 415.578 4.046 20 0 HIADHN Cc1ccc(C(C)C)c(OCC(=O)Nc2cccc(CN3CCC(CO)CC3)c2)c1 ZINC000444549217 868878265 /nfs/dbraw/zinc/87/82/65/868878265.db2.gz PHQKUTQURCJPFD-UHFFFAOYSA-N 0 3 410.558 4.340 20 0 HIADHN CCn1cc(CC(=O)Nc2cccc(CN3CCC(CO)CC3)c2)c2ccccc21 ZINC000444552469 868879497 /nfs/dbraw/zinc/87/94/97/868879497.db2.gz TYCPGNWEUZWLDY-UHFFFAOYSA-N 0 3 405.542 4.047 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N[C@@H](C)c3ccc(Br)s3)cc2)CC1 ZINC000444562291 868883330 /nfs/dbraw/zinc/88/33/30/868883330.db2.gz TUUDADRMGPUMJA-AWEZNQCLSA-N 0 3 422.392 4.144 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)NC(=O)NC[C@@H](c2ccc(C)cc2)N(C)C)cc1 ZINC000444581693 868889137 /nfs/dbraw/zinc/88/91/37/868889137.db2.gz HFJZDJQPCHSRAZ-JPYJTQIMSA-N 0 3 405.546 4.152 20 0 HIADHN Cc1ccccc1-n1ncc(C(=O)NCCN2CCCC(C)(C)C2)c1C(F)(F)F ZINC000444626641 868917998 /nfs/dbraw/zinc/91/79/98/868917998.db2.gz AJVNGYXIYQEVNQ-UHFFFAOYSA-N 0 3 408.468 4.051 20 0 HIADHN CC1(C)CCCN(CCNC(=O)c2ccccc2SCc2cn3ccccc3n2)C1 ZINC000444632768 868921167 /nfs/dbraw/zinc/92/11/67/868921167.db2.gz HFPGCJXZTYTWIY-UHFFFAOYSA-N 0 3 422.598 4.478 20 0 HIADHN CCOC(=O)c1c(C)oc2nc(CN[C@H]3CCCC[C@H]3c3ccccc3)nc(N)c21 ZINC000444648212 868928263 /nfs/dbraw/zinc/92/82/63/868928263.db2.gz XQEPPSUZVHLJJT-IRXDYDNUSA-N 0 3 408.502 4.106 20 0 HIADHN CCc1ccc(Cl)c(CC)c1NC(=O)CCCN1CCCN(C(=O)C2CC2)CC1 ZINC000444684180 868958181 /nfs/dbraw/zinc/95/81/81/868958181.db2.gz IMAFYXFMNKHUDA-UHFFFAOYSA-N 0 3 419.997 4.128 20 0 HIADHN COCCN1CCC[C@@H]1CNC(=O)N([C@@H](C)c1cccc(C(F)(F)F)c1)C1CC1 ZINC000444718662 868973601 /nfs/dbraw/zinc/97/36/01/868973601.db2.gz WHQJEHHYOWZHGL-HNAYVOBHSA-N 0 3 413.484 4.051 20 0 HIADHN COc1ccc(-c2csc(NC(=O)CN(CC3CCC3)C(C)C)n2)c(OC)c1 ZINC000444779684 868999695 /nfs/dbraw/zinc/99/96/95/868999695.db2.gz YUOPGGGUKCQVEV-UHFFFAOYSA-N 0 3 403.548 4.276 20 0 HIADHN Cc1cc(OC[C@@H](O)CN2CCC[C@H](c3nccn3C)C2)c(C(C)C)cc1Cl ZINC000444789300 869005395 /nfs/dbraw/zinc/00/53/95/869005395.db2.gz DKVXKGBIDWDKRP-ROUUACIJSA-N 0 3 405.970 4.125 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)NCc2cccc(-c3cccnc3)c2)CC1 ZINC000468324715 882254844 /nfs/dbraw/zinc/25/48/44/882254844.db2.gz YSQLKXMWJRLBLO-UHFFFAOYSA-N 0 3 404.514 4.148 20 0 HIADHN Cc1cccc(NC(=O)Cc2noc([C@@H]3CCCN(Cc4cccc(F)c4)C3)n2)c1 ZINC000445314897 869370249 /nfs/dbraw/zinc/37/02/49/869370249.db2.gz HHEPTVPTPQGATR-GOSISDBHSA-N 0 3 408.477 4.078 20 0 HIADHN O=C(N1CCO[C@H](c2ccsc2)C1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000468361512 882302401 /nfs/dbraw/zinc/30/24/01/882302401.db2.gz ZODBAHXHSVBPQN-AZUAARDMSA-N 0 3 424.488 4.103 20 0 HIADHN Fc1ccc(Oc2ccc(-c3noc([C@H]4CCCN4C4CCOCC4)n3)cn2)cc1 ZINC000445563178 869620618 /nfs/dbraw/zinc/62/06/18/869620618.db2.gz IZDHOHAJTRQEFS-LJQANCHMSA-N 0 3 410.449 4.379 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)CCc3cn(C)c4ccccc34)c(C)c2)CC1 ZINC000445648406 869718877 /nfs/dbraw/zinc/71/88/77/869718877.db2.gz QSWHNCARPQDZCN-UHFFFAOYSA-N 0 3 404.558 4.200 20 0 HIADHN COc1cccc([C@H](CNC(=O)CCCc2ccc(F)c(F)c2)N2CCCC2)c1 ZINC000445652531 869723877 /nfs/dbraw/zinc/72/38/77/869723877.db2.gz KQMCCJHKCHEGMZ-QFIPXVFZSA-N 0 3 402.485 4.249 20 0 HIADHN CC(C)[C@H](CC(F)(F)F)NCC(=O)N[C@H](c1ccc2c(c1)OCCCO2)C(C)C ZINC000445878766 869869480 /nfs/dbraw/zinc/86/94/80/869869480.db2.gz WAMWAADMHLMOGI-JXFKEZNVSA-N 0 3 416.484 4.228 20 0 HIADHN CC(C)[C@@H](CC(F)(F)F)NCC(=O)N[C@@H](c1ccc2c(c1)OCCCO2)C(C)C ZINC000445878768 869869621 /nfs/dbraw/zinc/86/96/21/869869621.db2.gz WAMWAADMHLMOGI-OXQOHEQNSA-N 0 3 416.484 4.228 20 0 HIADHN C[C@@H](NC(=O)CN1[C@H](C)CC[C@@H]1C)c1cccc(NC(=O)Cc2ccccc2F)c1 ZINC000468414288 882357833 /nfs/dbraw/zinc/35/78/33/882357833.db2.gz HLYRZJKUUMVQKW-FGTMMUONSA-N 0 3 411.521 4.057 20 0 HIADHN COc1cc(C)c(NC(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)cc1C ZINC000446367852 870278490 /nfs/dbraw/zinc/27/84/90/870278490.db2.gz ADKOXBLLOPPENB-RTBURBONSA-N 0 3 403.567 4.055 20 0 HIADHN CCCCOc1ccc(OC)cc1NC(=O)c1ccc(N2CCN(CC)CC2)cc1 ZINC000468452739 882391253 /nfs/dbraw/zinc/39/12/53/882391253.db2.gz VRCKIYQQSCITIX-UHFFFAOYSA-N 0 3 411.546 4.268 20 0 HIADHN COc1ccc([C@@H](CNC(=O)Nc2ccc(SC)cc2OC)N2CCCC2)cc1 ZINC000446410895 870317027 /nfs/dbraw/zinc/31/70/27/870317027.db2.gz LSNILVDTMHZOCG-HXUWFJFHSA-N 0 3 415.559 4.384 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Cc1csc(-c2ccccc2Cl)n1 ZINC000446427995 870343860 /nfs/dbraw/zinc/34/38/60/870343860.db2.gz NBSGOETZABORKQ-UHFFFAOYSA-N 0 3 403.935 4.189 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Cc1csc(-c2ccc(Cl)cc2)n1 ZINC000446428163 870345213 /nfs/dbraw/zinc/34/52/13/870345213.db2.gz PSVNOAYFRUCZMQ-UHFFFAOYSA-N 0 3 403.935 4.189 20 0 HIADHN CCOc1ccc(-c2nc(C)c(C(=O)N(CCN(C)C)Cc3ccco3)s2)cc1 ZINC000446433365 870350613 /nfs/dbraw/zinc/35/06/13/870350613.db2.gz SDURJIHJVAKVQF-UHFFFAOYSA-N 0 3 413.543 4.314 20 0 HIADHN COc1ccc2c(c1)[C@H](N[C@@H](C)c1ccc(S(=O)(=O)N(C)C)cc1)CCCS2 ZINC000446749903 870658767 /nfs/dbraw/zinc/65/87/67/870658767.db2.gz CTSMQNKYANKVFV-MGPUTAFESA-N 0 3 420.600 4.223 20 0 HIADHN COc1ccc([C@@H](CCn2cncn2)NCc2cc(F)cc(Br)c2)cc1 ZINC000446751693 870660230 /nfs/dbraw/zinc/66/02/30/870660230.db2.gz DWUKNYXFBQZGKK-LJQANCHMSA-N 0 3 419.298 4.110 20 0 HIADHN CC[C@H](C)NC(=O)c1cccc(CN[C@H](CCn2cncn2)c2ccc(C)cc2)c1 ZINC000446757429 870670756 /nfs/dbraw/zinc/67/07/56/870670756.db2.gz UEAYJQCRVSMQRV-WMZHIEFXSA-N 0 3 405.546 4.036 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1cccc(C(=O)Nc2cccc(F)c2)c1 ZINC000446822112 870737666 /nfs/dbraw/zinc/73/76/66/870737666.db2.gz VDQOLIYUQVCEEU-UHFFFAOYSA-N 0 3 424.476 4.267 20 0 HIADHN Cc1ccc([C@@H](NCc2cccnc2N2CCC(C(N)=O)CC2)C2CCCC2)cc1 ZINC000446845410 870763032 /nfs/dbraw/zinc/76/30/32/870763032.db2.gz ZRONCVKRERJITI-QHCPKHFHSA-N 0 3 406.574 4.113 20 0 HIADHN Cc1ccc([C@H](NCc2cccnc2N2CCC(C(N)=O)CC2)C2CCCC2)cc1 ZINC000446845409 870763083 /nfs/dbraw/zinc/76/30/83/870763083.db2.gz ZRONCVKRERJITI-HSZRJFAPSA-N 0 3 406.574 4.113 20 0 HIADHN C[C@@]1(c2ccccc2)CCN(C(=O)Nc2ccc(CCN3CCSCC3)cc2)C1 ZINC000446911255 870828493 /nfs/dbraw/zinc/82/84/93/870828493.db2.gz QHSWHLWORUSICQ-XMMPIXPASA-N 0 3 409.599 4.473 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1cccc(NC(=O)c2cccs2)c1 ZINC000446940558 870851297 /nfs/dbraw/zinc/85/12/97/870851297.db2.gz VMCAPKMXKTWIGX-UHFFFAOYSA-N 0 3 412.515 4.189 20 0 HIADHN O[C@H]([C@@H]1CCCN(Cc2ccc(-n3ccc(C(F)(F)F)n3)cc2)C1)C(F)(F)F ZINC000446976219 870873487 /nfs/dbraw/zinc/87/34/87/870873487.db2.gz VUKIZPVBDPMFHS-CZUORRHYSA-N 0 3 407.358 4.026 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N[C@H](c1ccccc1)c1cccc(F)c1 ZINC000447039537 870915595 /nfs/dbraw/zinc/91/55/95/870915595.db2.gz PDEWXOHAHFSXLF-HSZRJFAPSA-N 0 3 419.500 4.040 20 0 HIADHN COC(=O)c1cc(CN2CCC[C@H](c3nc(-c4ccccc4OC)cs3)C2)c[nH]1 ZINC000447061895 870941840 /nfs/dbraw/zinc/94/18/40/870941840.db2.gz YZXSENLYXRRVTC-INIZCTEOSA-N 0 3 411.527 4.313 20 0 HIADHN COC1(CO)CCN(Cc2cn(Cc3ccc(C)cc3)nc2-c2ccc(C)cc2)CC1 ZINC000447074749 870957192 /nfs/dbraw/zinc/95/71/92/870957192.db2.gz CKPDXZLHOTWBBF-UHFFFAOYSA-N 0 3 419.569 4.189 20 0 HIADHN CCOc1cc(CN[C@@]2(CCO)CCOC2)ccc1OCc1c(F)cccc1Cl ZINC000447073730 870957279 /nfs/dbraw/zinc/95/72/79/870957279.db2.gz YJMMBAQHGHUYHM-QFIPXVFZSA-N 0 3 423.912 4.088 20 0 HIADHN COC(=O)[C@](C)(CNCc1ccccc1OCc1ccncc1)c1ccc(F)cc1 ZINC000447087072 870978027 /nfs/dbraw/zinc/97/80/27/870978027.db2.gz NRTOKNJYMDWPKZ-XMMPIXPASA-N 0 3 408.473 4.020 20 0 HIADHN C[C@H](NC(=O)N(CCN(C)C)Cc1ccc(F)cc1)c1cccc(N2CCCC2)c1 ZINC000447226732 871112612 /nfs/dbraw/zinc/11/26/12/871112612.db2.gz MMRWADBQSUEYTH-IBGZPJMESA-N 0 3 412.553 4.260 20 0 HIADHN Cc1ccc(CN[C@@H]2CCCc3c(Br)cccc32)cc1S(C)(=O)=O ZINC000447582795 871487150 /nfs/dbraw/zinc/48/71/50/871487150.db2.gz YKTPJILCBFKNEY-GOSISDBHSA-N 0 3 408.361 4.328 20 0 HIADHN CCOC(=O)c1oc2c(c1C)[C@H](N[C@H]1CCN(c3ncccc3Cl)C1)CCC2 ZINC000447587463 871492798 /nfs/dbraw/zinc/49/27/98/871492798.db2.gz QKIWYXHOIOLJJG-GOEBONIOSA-N 0 3 403.910 4.059 20 0 HIADHN Cc1ccc([C@H](NC[C@H]2CCCCN2C2CC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000447593383 871500699 /nfs/dbraw/zinc/50/06/99/871500699.db2.gz RNODBTUEKDXSMK-VWNXMTODSA-N 0 3 412.599 4.094 20 0 HIADHN CN(Cc1ccccc1NC(=O)CC1(N2CCOCC2)CCCC1)c1ccccc1 ZINC000447698098 871640057 /nfs/dbraw/zinc/64/00/57/871640057.db2.gz JMCQGYZOAFVHNZ-UHFFFAOYSA-N 0 3 407.558 4.297 20 0 HIADHN COc1ccccc1-c1ccc(CN(C(C)C)[C@H]2CCN(C3CCOCC3)C2=O)cc1 ZINC000447853761 871773928 /nfs/dbraw/zinc/77/39/28/871773928.db2.gz IJMULODOJKJKJH-DEOSSOPVSA-N 0 3 422.569 4.353 20 0 HIADHN C[C@H](N[C@@H](C[C@@H]1CCOC1)c1ccccc1)C(=O)Nc1ccc(OC(F)F)cc1 ZINC000447885920 871801095 /nfs/dbraw/zinc/80/10/95/871801095.db2.gz LQRLWXZXGZLILI-FTRWYGJKSA-N 0 3 404.457 4.373 20 0 HIADHN O=C1[C@H](N[C@H](C[C@@H]2CCOC2)c2ccccc2)CCN1c1ccc(Cl)c(F)c1 ZINC000447887860 871801986 /nfs/dbraw/zinc/80/19/86/871801986.db2.gz GXUKWWDWEQECNY-IWMITWMQSA-N 0 3 402.897 4.342 20 0 HIADHN Cc1cc(Br)cn2cc(CCNCc3ncc(C(C)(C)C)s3)nc12 ZINC000447893358 871805428 /nfs/dbraw/zinc/80/54/28/871805428.db2.gz LZWNRQFYCXGNAY-UHFFFAOYSA-N 0 3 407.381 4.492 20 0 HIADHN Cc1nn(C)c(CNC[C@H](c2cccs2)N2CCC(C)CC2)c1Br ZINC000447933675 871817311 /nfs/dbraw/zinc/81/73/11/871817311.db2.gz UXBKZMGNAGNXEQ-OAHLLOKOSA-N 0 3 411.413 4.115 20 0 HIADHN Cc1oc2ccccc2c1CNC(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000468530723 882553305 /nfs/dbraw/zinc/55/33/05/882553305.db2.gz ROFBFZLGZLKLHV-HDICACEKSA-N 0 3 413.562 4.162 20 0 HIADHN Cc1ccc([C@@H](NC[C@@H]2N(C)CCCC2(C)C)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000448020353 871863927 /nfs/dbraw/zinc/86/39/27/871863927.db2.gz BOMQEDNNUSTZAP-XZOQPEGZSA-N 0 3 414.615 4.198 20 0 HIADHN Cc1ccc([C@H](NC[C@H]2N(C)CCCC2(C)C)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000448020352 871864235 /nfs/dbraw/zinc/86/42/35/871864235.db2.gz BOMQEDNNUSTZAP-PKTZIBPZSA-N 0 3 414.615 4.198 20 0 HIADHN CN1CCCC(C)(C)[C@H]1CN[C@@H](c1ccc(F)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000448025211 871864869 /nfs/dbraw/zinc/86/48/69/871864869.db2.gz CFAVPAXMFVQGKN-YADHBBJMSA-N 0 3 418.578 4.029 20 0 HIADHN CN1CCCC(C)(C)[C@@H]1CNC(=O)N1CCC[C@@H](c2nc(C(F)(F)F)cs2)C1 ZINC000448028222 871867254 /nfs/dbraw/zinc/86/72/54/871867254.db2.gz CNKJUVKWCFITJA-HIFRSBDPSA-N 0 3 418.529 4.171 20 0 HIADHN CO[C@H]1CCOc2c(NC(=O)N(CCN(C)C)Cc3ccc(F)cc3F)cccc21 ZINC000448047212 871879167 /nfs/dbraw/zinc/87/91/67/871879167.db2.gz DKILLVQEPXKNRJ-FQEVSTJZSA-N 0 3 419.472 4.031 20 0 HIADHN CO[C@@H]1CCOc2c(NC(=O)NC[C@H](c3ccc(C)cc3)N3CCCC3)cccc21 ZINC000448050739 871881314 /nfs/dbraw/zinc/88/13/14/871881314.db2.gz OUGGSVQYPIMYQH-FGZHOGPDSA-N 0 3 409.530 4.424 20 0 HIADHN CC1CCN([C@@H](CNC(=O)Nc2cccc(N3CCC3=O)c2)c2cccs2)CC1 ZINC000448056017 871885528 /nfs/dbraw/zinc/88/55/28/871885528.db2.gz KRQZNJOTLKSZMZ-IBGZPJMESA-N 0 3 412.559 4.080 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)c2ccc3cc(Br)ccc3c2)C[C@H](C)O1 ZINC000448239426 872152648 /nfs/dbraw/zinc/15/26/48/872152648.db2.gz LDNXGPLYMGDEHE-IYBDPMFKSA-N 0 3 419.363 4.222 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1cnc(C(C)C)s1 ZINC000448247714 872163511 /nfs/dbraw/zinc/16/35/11/872163511.db2.gz GGUYGRHTMZWSRT-SFHVURJKSA-N 0 3 409.559 4.471 20 0 HIADHN c1nc([C@@H]2CCCO2)sc1CN(CCCOc1ccccc1)C1CCOCC1 ZINC000468548864 882591744 /nfs/dbraw/zinc/59/17/44/882591744.db2.gz QPPJZTOISCCWPC-NRFANRHFSA-N 0 3 402.560 4.445 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)N(C)[C@@H](C)c3cc(F)ccc3F)CC2)c1 ZINC000468554718 882600225 /nfs/dbraw/zinc/60/02/25/882600225.db2.gz OFMXGDRSQZCXSC-SFHVURJKSA-N 0 3 401.501 4.005 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)C(=O)Nc3ccc(C(C)(C)CC)cc3)c2)CC1 ZINC000448404893 872356365 /nfs/dbraw/zinc/35/63/65/872356365.db2.gz NLIPNWLXRBKJQK-UHFFFAOYSA-N 0 3 422.573 4.093 20 0 HIADHN CN(C)Cc1cccc(C(=O)N2CCC[C@H](Nc3cccc(Br)c3)C2)c1 ZINC000468557762 882607904 /nfs/dbraw/zinc/60/79/04/882607904.db2.gz ZIICDXGEYJABEQ-FQEVSTJZSA-N 0 3 416.363 4.227 20 0 HIADHN CCCCn1ncc(NC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)c1C ZINC000448458667 872413296 /nfs/dbraw/zinc/41/32/96/872413296.db2.gz IBBMBVQEXBJPGY-FQEVSTJZSA-N 0 3 408.468 4.385 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N2CCCC[C@H]2c2nnc(C3CCC3)o2)C1 ZINC000460115000 872581708 /nfs/dbraw/zinc/58/17/08/872581708.db2.gz LWMYPMQMDQHHFX-QMMLZNLJSA-N 0 3 423.561 4.409 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)N1CCCC[C@@H]1c1nnc(C2CCC2)o1 ZINC000460163060 872709020 /nfs/dbraw/zinc/70/90/20/872709020.db2.gz BEKDXBRYWNFDRH-NHCUHLMSSA-N 0 3 423.561 4.411 20 0 HIADHN CCn1c(-c2ccc[nH]2)nnc1N1CCCN(Cc2ccc(C(F)(F)F)cc2)CC1 ZINC000460236865 872825608 /nfs/dbraw/zinc/82/56/08/872825608.db2.gz KEJGWSHCWOBERR-UHFFFAOYSA-N 0 3 418.467 4.024 20 0 HIADHN CCCN(CCN1CCN(CC)CC1)C(=O)N[C@H](c1ccccc1Cl)C(C)C ZINC000460340460 872949475 /nfs/dbraw/zinc/94/94/75/872949475.db2.gz SJTTVUYZDXIHQW-NRFANRHFSA-N 0 3 409.018 4.096 20 0 HIADHN Cc1ccc(CN(CC(=O)NC[C@@H](c2ccccc2)N(C)C)Cc2ccco2)s1 ZINC000460383262 873024738 /nfs/dbraw/zinc/02/47/38/873024738.db2.gz HHBGQNBCLSZTQY-QFIPXVFZSA-N 0 3 411.571 4.071 20 0 HIADHN COc1cccc(F)c1[C@H](C)NC(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000460479328 873166689 /nfs/dbraw/zinc/16/66/89/873166689.db2.gz KEUFQRGGDDIDHC-YCRPNKLZSA-N 0 3 424.438 4.466 20 0 HIADHN CCCN(CCN1CCN(CC)CC1)C(=O)N[C@@H](C)c1ccc(Cl)cc1Cl ZINC000460679772 873429120 /nfs/dbraw/zinc/42/91/20/873429120.db2.gz VDKDILHMSQPMFE-INIZCTEOSA-N 0 3 415.409 4.114 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)c3ncoc3-c3ccc(C)cc3)cc2)CC1 ZINC000460711276 873497728 /nfs/dbraw/zinc/49/77/28/873497728.db2.gz WTKLWEWMABQACN-UHFFFAOYSA-N 0 3 404.514 4.040 20 0 HIADHN Cc1ccc(CNCc2cccc(C(=O)OC(C)(C)C)c2)c(-n2cc(Cl)cn2)n1 ZINC000468619030 882735927 /nfs/dbraw/zinc/73/59/27/882735927.db2.gz FZEDXJBZLQQLMM-UHFFFAOYSA-N 0 3 412.921 4.474 20 0 HIADHN C[C@H]1CC[C@@H](CNC(=O)N(Cc2ccccc2Br)C2CCN(C)CC2)C1 ZINC000460743910 873572883 /nfs/dbraw/zinc/57/28/83/873572883.db2.gz XVBFILOHIIHJTN-DLBZAZTESA-N 0 3 422.411 4.491 20 0 HIADHN CC(C)CC(=O)Nc1ccc(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)cc1F ZINC000460806725 873682679 /nfs/dbraw/zinc/68/26/79/873682679.db2.gz QAGDABUTKSYGQU-QFIPXVFZSA-N 0 3 411.521 4.377 20 0 HIADHN Cc1nc2ccccc2n1CCc1noc(C2CCN(Cc3ccccc3)CC2)n1 ZINC000460825037 873708760 /nfs/dbraw/zinc/70/87/60/873708760.db2.gz UBYUTNREYACCKX-UHFFFAOYSA-N 0 3 401.514 4.350 20 0 HIADHN CCCN(C(=O)c1ccc(-n2cncn2)cc1C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000460884075 873796701 /nfs/dbraw/zinc/79/67/01/873796701.db2.gz PBKHQWOJSRQAKS-HSZRJFAPSA-N 0 3 417.557 4.093 20 0 HIADHN Cc1ccc(C(=O)NC[C@H]2CCCN2C)cc1OCc1csc(Br)c1 ZINC000460985738 873874114 /nfs/dbraw/zinc/87/41/14/873874114.db2.gz GPEFBVAHMWRGEA-MRXNPFEDSA-N 0 3 423.376 4.222 20 0 HIADHN C[C@H](NC(=O)NC[C@@H](Cc1ccccc1)C(F)(F)F)[C@@H](c1ccccc1)N(C)C ZINC000461214979 874218372 /nfs/dbraw/zinc/21/83/72/874218372.db2.gz AMULWBYNOTYIDG-DBVUQKKJSA-N 0 3 407.480 4.398 20 0 HIADHN C[C@H](NC(=O)N[C@H]1c2ccccc2CC12CCOCC2)[C@H](c1ccccc1)N(C)C ZINC000461226310 874227771 /nfs/dbraw/zinc/22/77/71/874227771.db2.gz MIAHDOXYZFVORH-NMNUPHIUSA-N 0 3 407.558 4.071 20 0 HIADHN CN(c1nnc(C(C)(C)c2ccccc2)n1Cc1cccs1)[C@@H]1CCN(C2CC2)C1 ZINC000461508941 874586274 /nfs/dbraw/zinc/58/62/74/874586274.db2.gz CCFNZPJSYUAHNK-HXUWFJFHSA-N 0 3 421.614 4.387 20 0 HIADHN CCCn1c(C(=O)N(C)C2CCN(CCc3ccccn3)CC2)cc2ccccc21 ZINC000468796161 882863644 /nfs/dbraw/zinc/86/36/44/882863644.db2.gz CWBYCJZDKOEZQT-UHFFFAOYSA-N 0 3 404.558 4.225 20 0 HIADHN CC[C@H](C(=O)N(CC(=O)Nc1ccccc1C(F)(F)F)C(C)C)N(CC)CC ZINC000461646728 874803784 /nfs/dbraw/zinc/80/37/84/874803784.db2.gz BLFMMQSYQLCQBW-QGZVFWFLSA-N 0 3 401.473 4.001 20 0 HIADHN C[C@@H]1CCN(C(=O)CN[C@@H](c2ccccc2)C(F)(F)F)CCN1Cc1ccccc1 ZINC000468800346 882865377 /nfs/dbraw/zinc/86/53/77/882865377.db2.gz BYGJXYUGPQERTC-GCJKJVERSA-N 0 3 419.491 4.003 20 0 HIADHN Cc1c2cc(C)ccc2sc1C(=O)Nc1ccccc1CN1CCC[C@@H](C(N)=O)C1 ZINC000468803691 882867139 /nfs/dbraw/zinc/86/71/39/882867139.db2.gz CHAOYMIAGNGRDS-GOSISDBHSA-N 0 3 421.566 4.468 20 0 HIADHN C[C@@H](CC(=O)NCc1ccccc1CN(C)C)c1ccc(F)c(Br)c1 ZINC000461738629 874883271 /nfs/dbraw/zinc/88/32/71/874883271.db2.gz AALXOPVGIHBELC-AWEZNQCLSA-N 0 3 407.327 4.460 20 0 HIADHN CC[C@@H](Cc1ccccc1)N(CC)Cc1nc2c(cnn2-c2ccccc2)c(=O)[nH]1 ZINC000468829558 882879613 /nfs/dbraw/zinc/87/96/13/882879613.db2.gz DOZTZOJEWJRQRG-IBGZPJMESA-N 0 3 401.514 4.364 20 0 HIADHN CC[C@@H](Cc1ccccc1)[N@H+](CC)Cc1nc2c(cnn2-c2ccccc2)c(=O)[n-]1 ZINC000468829558 882879615 /nfs/dbraw/zinc/87/96/15/882879615.db2.gz DOZTZOJEWJRQRG-IBGZPJMESA-N 0 3 401.514 4.364 20 0 HIADHN CC[C@@H](Cc1ccccc1)[N@@H+](CC)Cc1nc2c(cnn2-c2ccccc2)c(=O)[n-]1 ZINC000468829558 882879616 /nfs/dbraw/zinc/87/96/16/882879616.db2.gz DOZTZOJEWJRQRG-IBGZPJMESA-N 0 3 401.514 4.364 20 0 HIADHN Cc1csc(Nc2ccc(NC(=O)CC3(N4CCOCC4)CCCC3)cc2)n1 ZINC000468843667 882886630 /nfs/dbraw/zinc/88/66/30/882886630.db2.gz FESQSRHRZVBVKP-UHFFFAOYSA-N 0 3 400.548 4.169 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)N[C@H]2CCCc3cn(C4CCCC4)nc32)CN1Cc1ccccc1 ZINC000461965262 875090868 /nfs/dbraw/zinc/09/08/68/875090868.db2.gz MYKSSXFBMJIPGO-JZWVFAODSA-N 0 3 421.589 4.338 20 0 HIADHN Cc1ccccc1-c1cc(NC(=O)N[C@H](CN2CCCC2)c2ccccc2)n(C)n1 ZINC000462086175 875195290 /nfs/dbraw/zinc/19/52/90/875195290.db2.gz WNTZXJGMWYOIAO-JOCHJYFZSA-N 0 3 403.530 4.354 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)[C@@H]1C[C@H]1c1ccccc1OC(F)F ZINC000462156378 875252472 /nfs/dbraw/zinc/25/24/72/875252472.db2.gz CPLCKQKQHUPHKT-NMLACTOBSA-N 0 3 400.469 4.028 20 0 HIADHN CC(C)c1noc(-c2ccccc2C(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)n1 ZINC000462161470 875257456 /nfs/dbraw/zinc/25/74/56/875257456.db2.gz DQMSPDXXROVLFQ-UWJYYQICSA-N 0 3 404.514 4.110 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)C1(c2ccccc2Cl)CCOCC1 ZINC000462174300 875273271 /nfs/dbraw/zinc/27/32/71/875273271.db2.gz GKTLBSSMOIGUPP-XMSQKQJNSA-N 0 3 412.961 4.025 20 0 HIADHN C[C@H]1CCCN(c2cc(C(=O)N3CC[C@@H](C)N(Cc4ccccc4)CC3)ccn2)C1 ZINC000462176246 875274062 /nfs/dbraw/zinc/27/40/62/875274062.db2.gz BWAQTHCTPURBCM-LEWJYISDSA-N 0 3 406.574 4.055 20 0 HIADHN Cc1nc(CCC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)oc1-c1ccccc1 ZINC000462180888 875280349 /nfs/dbraw/zinc/28/03/49/875280349.db2.gz OIVNXEALLPVGQP-XMSQKQJNSA-N 0 3 403.526 4.219 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1ccccc1-c1nc(C(C)(C)C)no1 ZINC000462182542 875282752 /nfs/dbraw/zinc/28/27/52/875282752.db2.gz PPXUJUQJOSTYRW-DYESRHJHSA-N 0 3 418.541 4.284 20 0 HIADHN COc1ccc(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)cc1-c1ccccn1 ZINC000462190838 875295789 /nfs/dbraw/zinc/29/57/89/875295789.db2.gz OXHOIGRTZRJSOE-WZONZLPQSA-N 0 3 401.510 4.008 20 0 HIADHN Cc1noc(C)c1COc1cccc(C(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)c1 ZINC000462194995 875301763 /nfs/dbraw/zinc/30/17/63/875301763.db2.gz YFXKTFYWFVGQHH-OSPHWJPCSA-N 0 3 419.525 4.121 20 0 HIADHN Cc1noc(C)c1COc1cccc(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)c1 ZINC000462194993 875303064 /nfs/dbraw/zinc/30/30/64/875303064.db2.gz YFXKTFYWFVGQHH-BXKMTCNYSA-N 0 3 419.525 4.121 20 0 HIADHN C[C@H]1CCCN(c2cc(C(=O)N(C)[C@@H]3CCCN(Cc4ccccc4)C3)ccn2)C1 ZINC000462196790 875305376 /nfs/dbraw/zinc/30/53/76/875305376.db2.gz BGTPZNZABHHBJI-NZQKXSOJSA-N 0 3 406.574 4.055 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Nc1cccc(OCc2cccnc2)c1 ZINC000462241605 875356738 /nfs/dbraw/zinc/35/67/38/875356738.db2.gz AIRVYAZBNJIQTL-YADARESESA-N 0 3 416.525 4.303 20 0 HIADHN CC(C)CC(=O)Nc1ccc(NC(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)cc1 ZINC000462241416 875356862 /nfs/dbraw/zinc/35/68/62/875356862.db2.gz ODOAAKPLKLRKAJ-GCJKJVERSA-N 0 3 408.546 4.313 20 0 HIADHN CC(C)(C)c1nc2ccc(S(=O)(=O)N3CCCC[C@H](N4CCCC4)C3)cc2s1 ZINC000462293729 875416683 /nfs/dbraw/zinc/41/66/83/875416683.db2.gz QXCBQGAFOWOCRJ-INIZCTEOSA-N 0 3 421.632 4.233 20 0 HIADHN Cc1c(NC(=O)[C@H](C)N2CC[C@@H](C)C3(CCCCC3)C2)c(=O)n(-c2ccccc2)n1C ZINC000462467524 875575925 /nfs/dbraw/zinc/57/59/25/875575925.db2.gz VEYXFNCSBZQJKH-QUCCMNQESA-N 0 3 424.589 4.104 20 0 HIADHN CC[C@H](CNC(=O)N[C@H]1CCO[C@@H](c2ccccc2)C1)N1CCc2ccccc2C1 ZINC000462529912 875648891 /nfs/dbraw/zinc/64/88/91/875648891.db2.gz RWSLNCVKRXCAPD-RBZQAINGSA-N 0 3 407.558 4.043 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2CNCc2sccc2Br)C[C@H](C)O1 ZINC000462537392 875658429 /nfs/dbraw/zinc/65/84/29/875658429.db2.gz VSNDFYYXVNKYBA-GASCZTMLSA-N 0 3 409.393 4.410 20 0 HIADHN C[C@H](CN1CCOCC1)N(Cc1ccccc1)Cc1ccc2c(c1)COC(C)(C)O2 ZINC000468899913 882953004 /nfs/dbraw/zinc/95/30/04/882953004.db2.gz HNPCCFGRPDWZNW-HXUWFJFHSA-N 0 3 410.558 4.055 20 0 HIADHN CCOC(=O)[C@](C)(CN[C@@H](C)C(=O)Nc1cccc(Cl)c1C)c1ccccc1 ZINC000468903347 882958144 /nfs/dbraw/zinc/95/81/44/882958144.db2.gz HRDMVWUBYWYXGT-KSFYIVLOSA-N 0 3 402.922 4.086 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)Nc1ccc(OCC2CCOCC2)cc1 ZINC000462685850 875778623 /nfs/dbraw/zinc/77/86/23/875778623.db2.gz VZHBMAUZGMGOSC-DVECYGJZSA-N 0 3 423.557 4.134 20 0 HIADHN C[C@H]1C[C@@H](NCc2ccc(-n3ccc(C(F)(F)F)n3)cc2)C(=O)N1c1ccccc1 ZINC000462737757 875810330 /nfs/dbraw/zinc/81/03/30/875810330.db2.gz WNHARKFVSWOHFE-HNAYVOBHSA-N 0 3 414.431 4.175 20 0 HIADHN COc1cccc(Cl)c1CNC[C@@H](CO)Cc1cccc(OC(F)(F)F)c1 ZINC000462739989 875811469 /nfs/dbraw/zinc/81/14/69/875811469.db2.gz QPLJFUZJEHGEPU-AWEZNQCLSA-N 0 3 403.828 4.188 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)c2ccc(-c3ccc(C)c(C)c3)cc2F)CC1 ZINC000503236651 912217244 /nfs/dbraw/zinc/21/72/44/912217244.db2.gz YNFQSDZOKIFXPF-SFHVURJKSA-N 0 3 411.565 4.113 20 0 HIADHN C[C@@H]1C[C@H]1N1C[C@@H](NCc2cn(C(C)(C)C)nc2-c2ccccc2Cl)CC1=O ZINC000462747400 875815464 /nfs/dbraw/zinc/81/54/64/875815464.db2.gz VCQFFEYUQLPKCQ-SIXWZSSISA-N 0 3 400.954 4.057 20 0 HIADHN C[C@@H]1C[C@@H]1N1C[C@H](NCc2cn(C(C)(C)C)nc2-c2ccccc2Cl)CC1=O ZINC000462747399 875815622 /nfs/dbraw/zinc/81/56/22/875815622.db2.gz VCQFFEYUQLPKCQ-OGWOLHLISA-N 0 3 400.954 4.057 20 0 HIADHN COc1cc(CN[C@@H]2CC(=O)N([C@@H]3C[C@@H]3C)C2)ccc1OCc1ccc(Cl)cc1 ZINC000462755384 875819562 /nfs/dbraw/zinc/81/95/62/875819562.db2.gz KLVHKBNUMCPFGY-CWFSZBLJSA-N 0 3 414.933 4.027 20 0 HIADHN CC(C)NS(=O)(=O)Cc1ccccc1CNCc1ccc(C2CCCC2)cc1 ZINC000462777802 875834967 /nfs/dbraw/zinc/83/49/67/875834967.db2.gz NFMXZBZIBDWGOB-UHFFFAOYSA-N 0 3 400.588 4.462 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(OCCNCc3cc(F)ccc3OC)c2)cc1 ZINC000462781623 875835806 /nfs/dbraw/zinc/83/58/06/875835806.db2.gz YZTVAVIVMWOREQ-UHFFFAOYSA-N 0 3 424.472 4.264 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@@H](C)N[C@@H]2CCCc3c(O)cccc32)cc1 ZINC000462815860 875857668 /nfs/dbraw/zinc/85/76/68/875857668.db2.gz JRXBXCUYJRGQKL-IIBYNOLFSA-N 0 3 402.560 4.151 20 0 HIADHN C[C@H](CS(=O)(=O)c1ccccc1)N[C@H]1C[C@H](c2ccc(Br)cc2)C1 ZINC000462815097 875857721 /nfs/dbraw/zinc/85/77/21/875857721.db2.gz CCNIORCNZXGCMJ-QGPMSJSTSA-N 0 3 408.361 4.147 20 0 HIADHN CCOc1ccc([C@@H](CC)NCc2cnc(N3CCOCC3)c(F)c2)cc1OCC ZINC000462831645 875867016 /nfs/dbraw/zinc/86/70/16/875867016.db2.gz FBOOWRHQEQMSAW-HXUWFJFHSA-N 0 3 417.525 4.096 20 0 HIADHN O=S1(=O)CCCN1c1cccc(CN[C@@H]2CCc3c2ccc(Cl)c3Cl)c1 ZINC000462832759 875867485 /nfs/dbraw/zinc/86/74/85/875867485.db2.gz HOPOEVHDUCOFLZ-GOSISDBHSA-N 0 3 411.354 4.310 20 0 HIADHN C[C@@H](NCc1cccc(N2CCCS2(=O)=O)c1)c1ccc(-c2ccncc2)cc1 ZINC000462844236 875879325 /nfs/dbraw/zinc/87/93/25/875879325.db2.gz YBWRPWJKTSZDNG-GOSISDBHSA-N 0 3 407.539 4.139 20 0 HIADHN O=S1(=O)CCCN1c1cccc(CN[C@@H](c2cccc(C(F)(F)F)c2)C2CC2)c1 ZINC000462846959 875881892 /nfs/dbraw/zinc/88/18/92/875881892.db2.gz CWTACTJGGFHCBT-HXUWFJFHSA-N 0 3 424.488 4.486 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)Nc2c(C)cc(Cl)c3ccccc32)CC1 ZINC000462849910 875884544 /nfs/dbraw/zinc/88/45/44/875884544.db2.gz GAZRFHUMWWDBTQ-MRXNPFEDSA-N 0 3 402.970 4.197 20 0 HIADHN CC[C@@H](CO)N1CCN(c2nc(C3CC3)nc3scc(-c4ccccc4)c32)CC1 ZINC000462937894 875962312 /nfs/dbraw/zinc/96/23/12/875962312.db2.gz HNHGTGMXXCMIHV-SFHVURJKSA-N 0 3 408.571 4.129 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N[C@@H](CC(F)(F)F)c1ccccc1 ZINC000463004013 876018979 /nfs/dbraw/zinc/01/89/79/876018979.db2.gz WDPSZOFHTPGLCR-UXPWSPDFSA-N 0 3 405.464 4.500 20 0 HIADHN Cc1cccc([C@H](NC(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)c2ccccn2)c1 ZINC000463023740 876042100 /nfs/dbraw/zinc/04/21/00/876042100.db2.gz YYQZINWKZCBSIH-YNJKOYDBSA-N 0 3 414.553 4.299 20 0 HIADHN OC[C@]1(c2ccccc2)CCN(Cc2cnn(-c3ccc(C(F)(F)F)cc3)c2)C1 ZINC000463045669 876072163 /nfs/dbraw/zinc/07/21/63/876072163.db2.gz XBAONRTUYAUCPU-NRFANRHFSA-N 0 3 401.432 4.027 20 0 HIADHN Cc1nc2ccccc2n1CCCCCN1CCCN(C(=O)c2ccccc2)CC1 ZINC000463079889 876111106 /nfs/dbraw/zinc/11/11/06/876111106.db2.gz MCFNFRJXYANSTG-UHFFFAOYSA-N 0 3 404.558 4.363 20 0 HIADHN COCC1(CN2CCN(CCOC(c3ccccc3)c3ccccc3)CC2)CCC1 ZINC000463087453 876120008 /nfs/dbraw/zinc/12/00/08/876120008.db2.gz LTTVQCJPXUXTCJ-UHFFFAOYSA-N 0 3 408.586 4.227 20 0 HIADHN Cc1nc2c(n1[C@@H]1CCN(Cc3nc4ccc(Br)cc4o3)C1)CCCC2 ZINC000463199888 876259928 /nfs/dbraw/zinc/25/99/28/876259928.db2.gz ZYBMZQPSNSOSPT-OAHLLOKOSA-N 0 3 415.335 4.421 20 0 HIADHN O=C(CN1CCCC[C@@H]1[C@H]1CCCC[C@H]1O)NCc1ccccc1OC1CCCC1 ZINC000463201618 876261992 /nfs/dbraw/zinc/26/19/92/876261992.db2.gz MGKQOLYYBRIDEG-DNVJHFABSA-N 0 3 414.590 4.030 20 0 HIADHN COC(=O)c1ccc(-c2nc(CN3CCCC[C@@H]3[C@@H]3C[C@H](C)CC[C@H]3O)co2)cc1 ZINC000463208411 876267417 /nfs/dbraw/zinc/26/74/17/876267417.db2.gz XMPUXGVTHNZLAY-IDZYALCFSA-N 0 3 412.530 4.280 20 0 HIADHN Cc1cc(N2CCCC2)ccc1NC(=O)CN1CCCC[C@@H]1[C@@H]1C[C@H](C)CC[C@H]1O ZINC000463217885 876276610 /nfs/dbraw/zinc/27/66/10/876276610.db2.gz GUZPJQIZVRFSGC-XVFIICMOSA-N 0 3 413.606 4.185 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)NCc3ccc(C(F)F)cc3)CC2)C[C@@H](C)O1 ZINC000463219794 876278160 /nfs/dbraw/zinc/27/81/60/876278160.db2.gz AFRLRDNFBZMKNN-IAGOWNOFSA-N 0 3 409.521 4.045 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)N[C@@H]1CCO[C@H](c2ccccc2)C1 ZINC000463229401 876285797 /nfs/dbraw/zinc/28/57/97/876285797.db2.gz XUJOAHFHFZYVNR-YADHBBJMSA-N 0 3 415.965 4.334 20 0 HIADHN CC(C)(C)C(=O)Nc1ccc(F)c(C(=O)NC2CCN(Cc3ccccc3)CC2)c1 ZINC000463245648 876302559 /nfs/dbraw/zinc/30/25/59/876302559.db2.gz MSYIUBRHLROKAH-UHFFFAOYSA-N 0 3 411.521 4.205 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](NCCCC2CCOCC2)c2ccc(F)c(F)c2)c1 ZINC000463246122 876303497 /nfs/dbraw/zinc/30/34/97/876303497.db2.gz HDCOVWCSORVQHC-QFIPXVFZSA-N 0 3 423.525 4.254 20 0 HIADHN C[C@@H]1CCCc2ccccc2[C@@H]1NC(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000463261722 876320359 /nfs/dbraw/zinc/32/03/59/876320359.db2.gz IRASLBWTUIWYPX-KBMIEXCESA-N 0 3 421.585 4.156 20 0 HIADHN O=C(Nc1ccccc1)C1(NC2CCN(Cc3c(F)cccc3Cl)CC2)CC1 ZINC000463274127 876330751 /nfs/dbraw/zinc/33/07/51/876330751.db2.gz CXCIBYRLHUBAEB-UHFFFAOYSA-N 0 3 401.913 4.204 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N[C@@H]1CCOc2c(F)ccc(F)c21)c1ccsc1 ZINC000463320012 876377689 /nfs/dbraw/zinc/37/76/89/876377689.db2.gz MPOUTUSMPDQERK-SJORKVTESA-N 0 3 409.502 4.232 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)[C@H]3SCCc4sccc43)c(C)c2)CC1 ZINC000463330340 876385752 /nfs/dbraw/zinc/38/57/52/876385752.db2.gz ZTSMGOVHUXXCNL-FQEVSTJZSA-N 0 3 401.601 4.168 20 0 HIADHN O=C(c1cccc(CN2CCC[C@@](CO)(Cc3ccccc3)C2)c1)N1CCCCC1 ZINC000463437144 876494013 /nfs/dbraw/zinc/49/40/13/876494013.db2.gz DIQBWYTYOFSNFW-AREMUKBSSA-N 0 3 406.570 4.130 20 0 HIADHN Cc1nn(C)c(Sc2ccccc2)c1C(=O)NC1CCN(Cc2ccccc2)CC1 ZINC000463513165 876577176 /nfs/dbraw/zinc/57/71/76/876577176.db2.gz NZFNSCBSCJTXCK-UHFFFAOYSA-N 0 3 420.582 4.274 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(Cl)cc2)CC1)c1cccc(F)c1Cl ZINC000463668577 876791561 /nfs/dbraw/zinc/79/15/61/876791561.db2.gz VUFPZWZIYMELAH-UHFFFAOYSA-N 0 3 411.304 4.406 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2cccc(-c3ncc4n3CCCC4)c2)[C@@H]1c1ccccc1 ZINC000463704399 876823767 /nfs/dbraw/zinc/82/37/67/876823767.db2.gz QGQCZIVJCBORLR-GOTSBHOMSA-N 0 3 415.541 4.453 20 0 HIADHN CN(C)[C@H]1Cc2ccccc2N(C(=O)c2cc(-c3ccccc3C(F)(F)F)on2)C1 ZINC000463776237 876896764 /nfs/dbraw/zinc/89/67/64/876896764.db2.gz OYDOGXZKZPPMSB-HNNXBMFYSA-N 0 3 415.415 4.494 20 0 HIADHN CN(C(=O)C1(c2cccc(Br)c2)CCCCC1)[C@@H]1CCN(C2CC2)C1 ZINC000463841408 876962348 /nfs/dbraw/zinc/96/23/48/876962348.db2.gz MZVYUTNVBCUCLA-LJQANCHMSA-N 0 3 405.380 4.346 20 0 HIADHN Cc1cc(N2CC[C@H](N[C@@H](Cc3ccc(Cl)cc3)c3ccccc3)C2=O)n(C)n1 ZINC000463885294 877005950 /nfs/dbraw/zinc/00/59/50/877005950.db2.gz AHOWEZKZFYRYDN-SFTDATJTSA-N 0 3 408.933 4.061 20 0 HIADHN Cn1ccc(N2CCC[C@@H](N[C@H](CCCc3ccccc3)c3ccccc3)C2=O)n1 ZINC000463885985 877007549 /nfs/dbraw/zinc/00/75/49/877007549.db2.gz CNBOTZXCFWOIOI-DHIUTWEWSA-N 0 3 402.542 4.269 20 0 HIADHN Cc1cc(N2CC[C@@H](N[C@H](CCCc3ccccc3)c3ccccc3)C2=O)n(C)n1 ZINC000463898734 877021454 /nfs/dbraw/zinc/02/14/54/877021454.db2.gz UEWLXYNCBZWMRG-DHIUTWEWSA-N 0 3 402.542 4.188 20 0 HIADHN COc1ccc([C@@H](CNC(=O)N[C@H](C)c2c(F)cccc2OC)N2CCCC2)cc1 ZINC000463956131 877078755 /nfs/dbraw/zinc/07/87/55/877078755.db2.gz WYYAWEQYOVWJFJ-OXQOHEQNSA-N 0 3 415.509 4.040 20 0 HIADHN COCCOc1ccc([C@H](C)NCc2ccc(C)nc2-n2cc(Cl)cn2)cc1 ZINC000469031206 883099496 /nfs/dbraw/zinc/09/94/96/883099496.db2.gz SNSWRUVTVFGOIH-INIZCTEOSA-N 0 3 400.910 4.105 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1cccc2cccnc21 ZINC000464182323 877354138 /nfs/dbraw/zinc/35/41/38/877354138.db2.gz AGFPVDFMVRXXFH-OAQYLSRUSA-N 0 3 411.509 4.439 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1cnn(C(C)(C)C)c1C ZINC000464190951 877362255 /nfs/dbraw/zinc/36/22/55/877362255.db2.gz XGRUWOBGLBWOKL-FQEVSTJZSA-N 0 3 420.561 4.151 20 0 HIADHN Cc1cc(NC(=O)c2ncsc2C(C)C)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000464209417 877379004 /nfs/dbraw/zinc/37/90/04/877379004.db2.gz VWVXIZIKFSOVFH-SFHVURJKSA-N 0 3 409.559 4.471 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)N(Cc2ccccc2)[C@@H](C)c2ccccc2)CC1 ZINC000464254361 877432201 /nfs/dbraw/zinc/43/22/01/877432201.db2.gz PZWKPKXVZTVLFX-GOTSBHOMSA-N 0 3 422.617 4.233 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1ccn(-c2ccc(F)cc2F)n1)c1ccsc1 ZINC000464320944 877511975 /nfs/dbraw/zinc/51/19/75/877511975.db2.gz UUJSWBHKEUJDDU-IBGZPJMESA-N 0 3 404.486 4.025 20 0 HIADHN O=C(CN(CCCOc1ccccc1)C1CCOCC1)NC1(c2ccccc2)CCC1 ZINC000464585675 877811164 /nfs/dbraw/zinc/81/11/64/877811164.db2.gz NNXGQMZLXBMTLQ-UHFFFAOYSA-N 0 3 422.569 4.132 20 0 HIADHN C/C=C/c1ccc(OC[C@H](O)CN[C@H](C)c2cn(C(C)(C)C)nc2C)c(OC)c1 ZINC000464600016 877827336 /nfs/dbraw/zinc/82/73/36/877827336.db2.gz FNHJPIQJPFTCFO-UHMOSQCASA-N 0 3 401.551 4.079 20 0 HIADHN Cc1nn(C(C)(C)C)cc1[C@H](C)NC[C@H](O)COc1c(Cl)cccc1Cl ZINC000464600981 877828828 /nfs/dbraw/zinc/82/88/28/877828828.db2.gz GMZCWFSSFIHWHS-JSGCOSHPSA-N 0 3 400.350 4.344 20 0 HIADHN COCCCN(C(=O)c1ccc(Oc2ccc(F)c(F)c2)cc1)C1CCN(C)CC1 ZINC000464711846 877936621 /nfs/dbraw/zinc/93/66/21/877936621.db2.gz NHINOEYSMSRTCZ-UHFFFAOYSA-N 0 3 418.484 4.330 20 0 HIADHN COCCCN(C(=O)c1ccc(Oc2ccc(C(C)=O)cc2)cc1)C1CCN(C)CC1 ZINC000464724597 877955241 /nfs/dbraw/zinc/95/52/41/877955241.db2.gz SSGPPUJNYFHWBA-UHFFFAOYSA-N 0 3 424.541 4.254 20 0 HIADHN CCCN(CC(F)(F)F)C(=O)[C@H]1CCCN(CCOc2ccccc2Cl)C1 ZINC000464732484 877968837 /nfs/dbraw/zinc/96/88/37/877968837.db2.gz OHGMWPADYMMFRP-HNNXBMFYSA-N 0 3 406.876 4.232 20 0 HIADHN O=C(CN1CC[C@H](CSc2ccccc2)C1)N1CCC(OCc2ccccc2)CC1 ZINC000464759302 877999644 /nfs/dbraw/zinc/99/96/44/877999644.db2.gz XDSDGBJHRWQWPA-QFIPXVFZSA-N 0 3 424.610 4.308 20 0 HIADHN CN(Cc1ccc(OC(F)F)cc1)C(=O)CN1CC[C@@H](CSc2ccccc2)C1 ZINC000464761897 878004200 /nfs/dbraw/zinc/00/42/00/878004200.db2.gz RIRQDMQYPYIWOE-GOSISDBHSA-N 0 3 420.525 4.361 20 0 HIADHN COc1ccc(CN(C(=O)CN2CC[C@H](CSc3ccccc3)C2)C2CC2)cc1 ZINC000464767544 878009139 /nfs/dbraw/zinc/00/91/39/878009139.db2.gz GLSWJIJRRXCDIU-FQEVSTJZSA-N 0 3 410.583 4.300 20 0 HIADHN CCS[C@H]1CC[C@@H](N(C)CC(=O)Nc2ccc3nc(C(F)(F)F)[nH]c3c2)C1 ZINC000464780630 878023477 /nfs/dbraw/zinc/02/34/77/878023477.db2.gz VXIYHEXDUNTBHE-OLZOCXBDSA-N 0 3 400.470 4.126 20 0 HIADHN CCS[C@@H]1CC[C@H](N(C)CC(=O)Nc2ccc3nc(C(F)(F)F)[nH]c3c2)C1 ZINC000464780633 878024070 /nfs/dbraw/zinc/02/40/70/878024070.db2.gz VXIYHEXDUNTBHE-QWHCGFSZSA-N 0 3 400.470 4.126 20 0 HIADHN CCN(CC(=O)Nc1cccc(C(=O)N(C)C)c1)[C@H](Cc1ccc(F)cc1)C(C)C ZINC000464791933 878037366 /nfs/dbraw/zinc/03/73/66/878037366.db2.gz TUSBMRGXJUKXEQ-JOCHJYFZSA-N 0 3 413.537 4.055 20 0 HIADHN CCN(CC(=O)Nc1cccc(C(F)(F)F)c1)CC1CCN(c2ccccn2)CC1 ZINC000464810460 878060194 /nfs/dbraw/zinc/06/01/94/878060194.db2.gz PJUBGKYPCLEIAM-UHFFFAOYSA-N 0 3 420.479 4.277 20 0 HIADHN COc1ccc([C@@H](CNC(=O)CN2C[C@@H]3CCC[C@@H]3C2)c2c[nH]c3ccccc32)cc1 ZINC000464877355 878168208 /nfs/dbraw/zinc/16/82/08/878168208.db2.gz JEJLCGCAZJIAJN-ZRCGQRJVSA-N 0 3 417.553 4.157 20 0 HIADHN COc1ccccc1NC(=O)c1ccc(NC(=O)[C@@H](C)N2C[C@@H]3CCC[C@@H]3C2)cc1 ZINC000464885993 878182126 /nfs/dbraw/zinc/18/21/26/878182126.db2.gz ADDYXMFRIZZWGJ-QRQLOZEOSA-N 0 3 407.514 4.006 20 0 HIADHN COc1cc(C(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)ccc1OC(F)F ZINC000464910691 878227924 /nfs/dbraw/zinc/22/79/24/878227924.db2.gz OQESKIMKIIUULH-INIZCTEOSA-N 0 3 404.457 4.033 20 0 HIADHN Cc1ccc([C@@H](NC(=O)N[C@@H](CN(C)C)c2ccc(F)cc2)c2ccccn2)cc1 ZINC000503363767 912340430 /nfs/dbraw/zinc/34/04/30/912340430.db2.gz BHBJZARBFFVKCG-XZOQPEGZSA-N 0 3 406.505 4.221 20 0 HIADHN COc1cccc([C@@H](CNC(=O)CCc2c[nH]c3cc(C)ccc23)N2CCCC2)c1 ZINC000465053080 878416199 /nfs/dbraw/zinc/41/61/99/878416199.db2.gz OTFVJVJAAZSTES-XMMPIXPASA-N 0 3 405.542 4.371 20 0 HIADHN Cc1nc(C)c(NC(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)s1 ZINC000465242086 878661490 /nfs/dbraw/zinc/66/14/90/878661490.db2.gz LUFLJXPNAAMEHX-UHFFFAOYSA-N 0 3 400.470 4.374 20 0 HIADHN CC(C)c1noc(-c2ccc(NC(=O)NCCCN3CCc4ccccc4C3)cc2)n1 ZINC000503389547 912371528 /nfs/dbraw/zinc/37/15/28/912371528.db2.gz SLXPZUIGLQYITO-UHFFFAOYSA-N 0 3 419.529 4.430 20 0 HIADHN CC(C)N(Cc1ccccc1)C(=O)[C@@H](C)N1CCC[C@H](c2ncc3n2CCCC3)C1 ZINC000503388449 912371984 /nfs/dbraw/zinc/37/19/84/912371984.db2.gz CNJWJONJRDTMGY-IRLDBZIGSA-N 0 3 408.590 4.225 20 0 HIADHN O=C([C@H](c1ccccc1)N1CCC[C@@H](c2ncc3n2CCCC3)C1)N1CCCCC1 ZINC000503407983 912388455 /nfs/dbraw/zinc/38/84/55/912388455.db2.gz GUTGYMQDZDDFBU-GGAORHGYSA-N 0 3 406.574 4.153 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)N1CC[C@@H](COCc2ccccc2)C1 ZINC000465419893 878850711 /nfs/dbraw/zinc/85/07/11/878850711.db2.gz CBIVMIAJDYEGJL-RTWAWAEBSA-N 0 3 413.587 4.133 20 0 HIADHN C[C@@H](NC(=O)NC[C@@H](c1cccs1)N1CCCC1)c1ccc(-n2cccn2)cc1 ZINC000465422364 878853103 /nfs/dbraw/zinc/85/31/03/878853103.db2.gz NKZOTZYNPZFEAN-XLIONFOSSA-N 0 3 409.559 4.131 20 0 HIADHN CCc1ccc([C@@H](COC)NC(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)o1 ZINC000465426678 878856211 /nfs/dbraw/zinc/85/62/11/878856211.db2.gz DGWKNARDBRJTQE-MOPGFXCFSA-N 0 3 419.591 4.363 20 0 HIADHN C[C@H](NC(=O)NC[C@H](c1cccs1)N1CCCC1)c1cccc(-n2cccn2)c1 ZINC000465426138 878856442 /nfs/dbraw/zinc/85/64/42/878856442.db2.gz RLVPELTUZLOIIG-FXAWDEMLSA-N 0 3 409.559 4.131 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)N2CC[C@@H](COCc3ccccc3)C2)N(C)C)cc1 ZINC000465429597 878859518 /nfs/dbraw/zinc/85/95/18/878859518.db2.gz HVBSUKRJDGUJJT-ISKFKSNPSA-N 0 3 409.574 4.100 20 0 HIADHN Cc1ccc(-c2nc(CNC(=O)NC[C@H](c3ccccc3)N3CCCC3)co2)cc1 ZINC000465438211 878869695 /nfs/dbraw/zinc/86/96/95/878869695.db2.gz HPARHHLJKOSUOD-JOCHJYFZSA-N 0 3 404.514 4.286 20 0 HIADHN Cc1c(NCC(C)(C)C)cccc1C(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000465449287 878880709 /nfs/dbraw/zinc/88/07/09/878880709.db2.gz XXJZFMBSNHXDNG-UHFFFAOYSA-N 0 3 423.601 4.340 20 0 HIADHN COc1cccc(OC)c1CC(=O)N(c1cccc(SC)c1)C1CCN(C)CC1 ZINC000465459241 878889358 /nfs/dbraw/zinc/88/93/58/878889358.db2.gz LCIHAGDLGIOPIH-UHFFFAOYSA-N 0 3 414.571 4.096 20 0 HIADHN C[C@@H]1CCN(C(=O)NCCc2cccc3cccnc32)CCN1Cc1ccccc1 ZINC000465482330 878922131 /nfs/dbraw/zinc/92/21/31/878922131.db2.gz HJLABAAVNDZQEC-HXUWFJFHSA-N 0 3 402.542 4.083 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCC(C(F)(F)F)CC1)c1cccc(OC)c1 ZINC000465499748 878938159 /nfs/dbraw/zinc/93/81/59/878938159.db2.gz IXEQMCUEWWMSDH-GOSISDBHSA-N 0 3 401.473 4.062 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccc(F)c2)C1)N1CC(c2nc3ccccc3s2)C1 ZINC000465509915 878949271 /nfs/dbraw/zinc/94/92/71/878949271.db2.gz XOXJZFPVZFVIAY-QGZVFWFLSA-N 0 3 409.530 4.273 20 0 HIADHN COc1ccc(C2CCN(C(=O)NCCCN3CCc4ccccc4C3)CC2)cc1 ZINC000465533735 878991662 /nfs/dbraw/zinc/99/16/62/878991662.db2.gz YSIXDMKEOKNODB-UHFFFAOYSA-N 0 3 407.558 4.033 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N[C@@H](C)c1ccc(-n2cccn2)cc1)c1ccsc1 ZINC000465533814 878992502 /nfs/dbraw/zinc/99/25/02/878992502.db2.gz MIIRRBRJTFZAAL-UWJYYQICSA-N 0 3 411.575 4.377 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1C[C@@H](c2ccc(F)cc2)O[C@@H](C)C1)c1ccsc1 ZINC000465534462 878994298 /nfs/dbraw/zinc/99/42/98/878994298.db2.gz QUIBLSJILREHKE-DQLDELGASA-N 0 3 419.566 4.442 20 0 HIADHN C[C@H](NC(=O)N[C@H](CN1CCCC1)c1ccccc1)c1nc(C2CCCCC2)no1 ZINC000465595582 879081672 /nfs/dbraw/zinc/08/16/72/879081672.db2.gz JACSQIAGYYNVSR-FXAWDEMLSA-N 0 3 411.550 4.315 20 0 HIADHN Cc1ccc(OCCCCNC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)cc1 ZINC000465605491 879096382 /nfs/dbraw/zinc/09/63/82/879096382.db2.gz QAULZOXAWQPHCV-JOCHJYFZSA-N 0 3 409.574 4.460 20 0 HIADHN Cc1ccc(OCCCCNC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)cc1 ZINC000465605514 879096587 /nfs/dbraw/zinc/09/65/87/879096587.db2.gz QAULZOXAWQPHCV-QFIPXVFZSA-N 0 3 409.574 4.460 20 0 HIADHN C[C@@H]1CN(C(=O)N[C@@H](CN2CCCC2)c2ccccc2)C[C@H](c2ccc(F)cc2)O1 ZINC000465605993 879098689 /nfs/dbraw/zinc/09/86/89/879098689.db2.gz QJISIEGHFFUCHV-YFXJRYMSSA-N 0 3 411.521 4.134 20 0 HIADHN Cc1ccc(-c2nc(CNC(=O)N[C@@H](CN3CCCC3)c3ccccc3)co2)cc1 ZINC000465612100 879110083 /nfs/dbraw/zinc/11/00/83/879110083.db2.gz XTCSOFBIOWRSMB-QFIPXVFZSA-N 0 3 404.514 4.286 20 0 HIADHN CC(C)(C)c1ccc(OC[C@H](O)CN2CCC[C@@H](c3ncc4n3CCCC4)C2)cc1 ZINC000503430444 912429327 /nfs/dbraw/zinc/42/93/27/912429327.db2.gz CWATYLRZMCICNY-DENIHFKCSA-N 0 3 411.590 4.136 20 0 HIADHN COc1ccc(C2CCN(C(=O)NCC(C)(C)N3CCc4ccccc4C3)CC2)cc1 ZINC000465685414 879232477 /nfs/dbraw/zinc/23/24/77/879232477.db2.gz FXOFSFYUARFJHL-UHFFFAOYSA-N 0 3 421.585 4.421 20 0 HIADHN C[C@H](COc1ccc(F)cc1F)NC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1 ZINC000465742899 879328219 /nfs/dbraw/zinc/32/82/19/879328219.db2.gz VFMHARCCHPDHIA-MSOLQXFVSA-N 0 3 417.500 4.038 20 0 HIADHN C[C@@H](COc1ccc(F)cc1F)NC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1 ZINC000465742901 879330331 /nfs/dbraw/zinc/33/03/31/879330331.db2.gz VFMHARCCHPDHIA-ROUUACIJSA-N 0 3 417.500 4.038 20 0 HIADHN Cc1ccccc1[C@@H]1CN(C(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)[C@H](C)CO1 ZINC000465752714 879341353 /nfs/dbraw/zinc/34/13/53/879341353.db2.gz JWNDBHUJTVEDPM-RKONGDRVSA-N 0 3 407.558 4.302 20 0 HIADHN CCO[C@H](C)c1nc(CN(C)C(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)cs1 ZINC000465760002 879355677 /nfs/dbraw/zinc/35/56/77/879355677.db2.gz QJEBPJOSVUMEDB-LMMKCTJWSA-N 0 3 416.591 4.218 20 0 HIADHN C[C@H](NC(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1)c1ccc(-n2cccn2)cc1 ZINC000465767187 879365392 /nfs/dbraw/zinc/36/53/92/879365392.db2.gz YWDIVGJZDZAFLQ-IPJJNNNSSA-N 0 3 403.530 4.068 20 0 HIADHN C[C@@H](NC(=O)N(CCN(C)C)C[C@H]1CCCO1)c1ccc(Oc2ccccc2)cc1 ZINC000465816864 879439631 /nfs/dbraw/zinc/43/96/31/879439631.db2.gz PHORXHCADCAHOR-AUSIDOKSSA-N 0 3 411.546 4.292 20 0 HIADHN CCC[C@H](NC(=O)NC[C@@H](C)CN1CCN(C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000465824984 879453657 /nfs/dbraw/zinc/45/36/57/879453657.db2.gz AMWAUNFANAVXIV-BEFAXECRSA-N 0 3 415.409 4.017 20 0 HIADHN CC(C)c1nc(CCNC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)cs1 ZINC000465849521 879492192 /nfs/dbraw/zinc/49/21/92/879492192.db2.gz ZKRIWMUALWEFGU-SFHVURJKSA-N 0 3 400.592 4.115 20 0 HIADHN Cc1ccc(COc2ccc(C[C@H](C)NC(=O)N3CC[C@@H](N4CC=CC4)C3)cc2)cc1 ZINC000465851393 879493827 /nfs/dbraw/zinc/49/38/27/879493827.db2.gz UPYABSATKHYZMZ-XUZZJYLKSA-N 0 3 419.569 4.161 20 0 HIADHN CCC(CC)c1cc(CNC(=O)NCC2(N3CCOC(C)(C)C3)CCCCC2)on1 ZINC000465865066 879515140 /nfs/dbraw/zinc/51/51/40/879515140.db2.gz DITZUIUZLBDKLK-UHFFFAOYSA-N 0 3 420.598 4.191 20 0 HIADHN CN(C)CCN(C[C@@H]1CCCO1)C(=O)NCc1ccccc1Sc1ccccc1 ZINC000465900805 879561918 /nfs/dbraw/zinc/56/19/18/879561918.db2.gz BIZCTVGMKKFSIY-FQEVSTJZSA-N 0 3 413.587 4.090 20 0 HIADHN C[C@@H](NC(=O)N1CC[C@@H](N2CC=CC2)C1)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000465939943 879605872 /nfs/dbraw/zinc/60/58/72/879605872.db2.gz JARMLPXKEIMJRV-XMSQKQJNSA-N 0 3 409.505 4.121 20 0 HIADHN CC[C@H](NC(=O)N(CCN(C)C)Cc1ccc(Br)cc1)c1ccncc1 ZINC000465951005 879618976 /nfs/dbraw/zinc/61/89/76/879618976.db2.gz FFQJOJIZGJEOBH-IBGZPJMESA-N 0 3 419.367 4.069 20 0 HIADHN CC[C@H](NC(=O)N(CCN(C)C)Cc1ccc(C(F)(F)F)cc1)c1ccncc1 ZINC000465961479 879628902 /nfs/dbraw/zinc/62/89/02/879628902.db2.gz USUYPMYBMKHUFK-IBGZPJMESA-N 0 3 408.468 4.325 20 0 HIADHN CC(C)C[C@H](NC(=O)N1CCN(CC2CCOCC2)CC1)c1ccc(Cl)cc1 ZINC000465966308 879634713 /nfs/dbraw/zinc/63/47/13/879634713.db2.gz HJVIVMBXUBQBIH-NRFANRHFSA-N 0 3 407.986 4.181 20 0 HIADHN Cc1cccc2c(CCNC(=O)N3CCCN(Cc4ccccc4)C[C@@H]3C)c[nH]c21 ZINC000465990456 879665249 /nfs/dbraw/zinc/66/52/49/879665249.db2.gz DALXYZSUWYOIKU-FQEVSTJZSA-N 0 3 404.558 4.325 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCCc3c[nH]c4c3cccc4C)c(C)c2)CC1 ZINC000465997371 879673690 /nfs/dbraw/zinc/67/36/90/879673690.db2.gz VYLRCVSUDZFOMB-UHFFFAOYSA-N 0 3 419.573 4.291 20 0 HIADHN COc1ccccc1C[C@@H](C)N(Cc1ccccc1)C(=O)N[C@@H]1CCN(C2CC2)C1 ZINC000466021112 879706490 /nfs/dbraw/zinc/70/64/90/879706490.db2.gz WWOPGDGKHRTVMA-DENIHFKCSA-N 0 3 407.558 4.075 20 0 HIADHN COc1cccc([C@H](NC(=O)N(C)[C@@H]2CCN(C3CC3)C2)c2ccccc2Cl)c1 ZINC000466031467 879718363 /nfs/dbraw/zinc/71/83/63/879718363.db2.gz GBKMORBAXAXEIO-GCJKJVERSA-N 0 3 413.949 4.316 20 0 HIADHN COc1cccc([C@H](NC(=O)N2CCN(C)CC[C@@H]2C)c2ccccc2Cl)c1 ZINC000466041228 879729725 /nfs/dbraw/zinc/72/97/25/879729725.db2.gz OPUSVGKWQGFXHA-KKSFZXQISA-N 0 3 401.938 4.174 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)N[C@@H]1CCc2c1cccc2O ZINC000466091187 879809139 /nfs/dbraw/zinc/80/91/39/879809139.db2.gz IQVYPTPYWQBNKB-LJQANCHMSA-N 0 3 421.463 4.172 20 0 HIADHN CCCN(C(=O)NCc1sc(C)nc1C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000466115819 879829354 /nfs/dbraw/zinc/82/93/54/879829354.db2.gz ZEGVUSIHPWDVES-HXUWFJFHSA-N 0 3 400.592 4.346 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)N(Cc2ccccc2Cl)C2CCCC2)CC1 ZINC000466136747 879847397 /nfs/dbraw/zinc/84/73/97/879847397.db2.gz RENFCMAJWLPTJB-LJQANCHMSA-N 0 3 421.029 4.068 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)N[C@@H](c2ccccc2)c2ccccn2)CN1Cc1ccccc1 ZINC000466140083 879850234 /nfs/dbraw/zinc/85/02/34/879850234.db2.gz FRKRSWDEVBBBTF-UCFCWBNQSA-N 0 3 400.526 4.133 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccc(O)cc1)C(=O)CCC(=O)c1ccc(C)s1 ZINC000503470905 912505490 /nfs/dbraw/zinc/50/54/90/912505490.db2.gz PFOLMQJLGYKEDY-LJQANCHMSA-N 0 3 414.571 4.238 20 0 HIADHN COc1cc(CNC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)c2ccccc2n1 ZINC000466208765 879898559 /nfs/dbraw/zinc/89/85/59/879898559.db2.gz PFZINIDAIDXNKY-IBGZPJMESA-N 0 3 418.541 4.049 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)N[C@@H](c1ccccc1)c1cccnc1 ZINC000503471833 912508382 /nfs/dbraw/zinc/50/83/82/912508382.db2.gz IWIXSWMRDTVNSR-RPWUZVMVSA-N 0 3 400.526 4.307 20 0 HIADHN CCN(c1ccccc1)c1ccc(CNC(=O)N(CCN(C)C)C[C@@H]2CCCO2)cc1 ZINC000466235137 879939219 /nfs/dbraw/zinc/93/92/19/879939219.db2.gz JBAHSIASEUEGLS-DEOSSOPVSA-N 0 3 424.589 4.097 20 0 HIADHN COc1ccc([C@H](CNC(=O)NCc2ccc3ccccc3c2)N2CCCC2)cc1 ZINC000503475773 912517784 /nfs/dbraw/zinc/51/77/84/912517784.db2.gz UWDUQWIEFDKPQL-DEOSSOPVSA-N 0 3 403.526 4.485 20 0 HIADHN COc1ccc(-c2cncc(C(=O)N[C@@H]3CCN([C@H](C)c4ccccc4)C3)c2)cc1 ZINC000466303864 880053688 /nfs/dbraw/zinc/05/36/88/880053688.db2.gz ZKNXUALARXZCEB-WZONZLPQSA-N 0 3 401.510 4.323 20 0 HIADHN C[C@@H](CNC(=O)N(CCN(C)C)Cc1ccc(F)cc1F)Sc1ccccc1 ZINC000466317839 880071633 /nfs/dbraw/zinc/07/16/33/880071633.db2.gz NRZBMTVIWLAMEM-INIZCTEOSA-N 0 3 407.530 4.219 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)[C@@H]1CCO[C@H]1c1ccc(Cl)c(F)c1 ZINC000466330038 880083161 /nfs/dbraw/zinc/08/31/61/880083161.db2.gz DKMSGDZRNGADLF-XSLZUNGDSA-N 0 3 416.924 4.193 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)[C@@H]1CCO[C@H]1c1ccc(Cl)c(F)c1 ZINC000466330036 880083299 /nfs/dbraw/zinc/08/32/99/880083299.db2.gz DKMSGDZRNGADLF-SPRUFDBQSA-N 0 3 416.924 4.193 20 0 HIADHN CC(C)(C)OC(=O)c1ccc(CNC(=O)N2CCCN(Cc3ccccc3)CC2)cc1 ZINC000466334802 880088791 /nfs/dbraw/zinc/08/87/91/880088791.db2.gz NVEJKKXKOAIIPU-UHFFFAOYSA-N 0 3 423.557 4.059 20 0 HIADHN CCC(CC)(CNC(=O)N(C)C1CCN(CCc2ccccn2)CC1)c1ccccc1 ZINC000466360238 880117084 /nfs/dbraw/zinc/11/70/84/880117084.db2.gz ZXWUUUHWRCSYHU-UHFFFAOYSA-N 0 3 422.617 4.488 20 0 HIADHN COc1cc(C)c(CNCc2ccc(I)c(C)c2)cc1OC ZINC000466363341 880122527 /nfs/dbraw/zinc/12/25/27/880122527.db2.gz CQTOEWDIFJHTDB-UHFFFAOYSA-N 0 3 411.283 4.215 20 0 HIADHN CCOc1cc(CNCc2ccc(I)c(C)c2)ccc1OC ZINC000466364809 880123502 /nfs/dbraw/zinc/12/35/02/880123502.db2.gz OOOBZWQRDYUIMJ-UHFFFAOYSA-N 0 3 411.283 4.297 20 0 HIADHN Cc1ncc(CNCc2ccc(I)c(C)c2)n1-c1ccccc1 ZINC000466365946 880124646 /nfs/dbraw/zinc/12/46/46/880124646.db2.gz YSCVMNWPLBAQAK-UHFFFAOYSA-N 0 3 417.294 4.384 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2cccc3ccsc32)cc1)[C@H]1CCCN(C)C1 ZINC000466435336 880210612 /nfs/dbraw/zinc/21/06/12/880210612.db2.gz SCVFXZQOYBDZDA-IBGZPJMESA-N 0 3 407.539 4.320 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccc(O)cc1)C(=O)c1cc(F)c(F)c(F)c1F ZINC000503495706 912543411 /nfs/dbraw/zinc/54/34/11/912543411.db2.gz GNTRWAZCPWLFKW-CQSZACIVSA-N 0 3 410.411 4.075 20 0 HIADHN CO[C@H](c1ccc(Br)cc1)[C@@H](C)NCc1cncc(Br)c1 ZINC000466448709 880225624 /nfs/dbraw/zinc/22/56/24/880225624.db2.gz IKZZKCUWVJGMPD-BZNIZROVSA-N 0 3 414.141 4.472 20 0 HIADHN CO[C@@H](c1ccc(Br)cc1)[C@@H](C)NCc1cncc(Br)c1 ZINC000466448708 880226169 /nfs/dbraw/zinc/22/61/69/880226169.db2.gz IKZZKCUWVJGMPD-BDJLRTHQSA-N 0 3 414.141 4.472 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)Nc2ccc(OC[C@@H]3CCCO3)cc2)CN1Cc1ccccc1 ZINC000466514315 880287844 /nfs/dbraw/zinc/28/78/44/880287844.db2.gz KXSFVRZVDDGNHO-AAIMPIBUSA-N 0 3 409.530 4.029 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)Nc2cc3c(cc2Cl)OCCCO3)CN1Cc1ccccc1 ZINC000466514362 880288755 /nfs/dbraw/zinc/28/87/55/880288755.db2.gz LHPREAHBQVJFGB-DOTOQJQBSA-N 0 3 415.921 4.286 20 0 HIADHN Cc1ccc(-c2nc(CNC(=O)N[C@@H]3C[C@H](C)N(Cc4ccccc4)C3)co2)cc1 ZINC000466516133 880290617 /nfs/dbraw/zinc/29/06/17/880290617.db2.gz QJAYRYATTJKHHO-GHTZIAJQSA-N 0 3 404.514 4.112 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)N(Cc2cccs2)C[C@H]2CCCO2)CN1Cc1ccccc1 ZINC000466516745 880291068 /nfs/dbraw/zinc/29/10/68/880291068.db2.gz SIZAVIJRCWWOIN-HLAWJBBLSA-N 0 3 413.587 4.102 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)N(C)Cc2ccc(OC(F)F)cc2)CN1Cc1ccccc1 ZINC000466526953 880302651 /nfs/dbraw/zinc/30/26/51/880302651.db2.gz KXPBNXRFDQXFGK-APWZRJJASA-N 0 3 403.473 4.092 20 0 HIADHN CCO[C@H](C)c1nc(CN(C)C(=O)N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)cs1 ZINC000466537157 880310540 /nfs/dbraw/zinc/31/05/40/880310540.db2.gz VOGWPVCOLWNVGG-SCTDSRPQSA-N 0 3 416.591 4.045 20 0 HIADHN CCO[C@H](C)c1nc(CN(C)C(=O)N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)cs1 ZINC000466537156 880310890 /nfs/dbraw/zinc/31/08/90/880310890.db2.gz VOGWPVCOLWNVGG-LMMKCTJWSA-N 0 3 416.591 4.045 20 0 HIADHN COCCOc1ccc(NC(=O)N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)cc1Cl ZINC000466537784 880312094 /nfs/dbraw/zinc/31/20/94/880312094.db2.gz BPNGCSUBULEHMS-LPHOPBHVSA-N 0 3 417.937 4.150 20 0 HIADHN C[C@H]1C[C@H](NC(=O)Nc2cccc(OCc3cccnc3)c2)CN1Cc1ccccc1 ZINC000466540473 880314117 /nfs/dbraw/zinc/31/41/17/880314117.db2.gz OYHNWLRAQPYDSU-CVDCTZTESA-N 0 3 416.525 4.445 20 0 HIADHN CCCN(C(=O)NCC1(CC)CCOCC1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000466628599 880400044 /nfs/dbraw/zinc/40/00/44/880400044.db2.gz XZPXMAJQMVVJSM-QFIPXVFZSA-N 0 3 401.595 4.279 20 0 HIADHN C[C@H](NC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C)c1cccc(-n2cccn2)c1 ZINC000466663293 880444632 /nfs/dbraw/zinc/44/46/32/880444632.db2.gz DHRYHHCJNOYXPB-RTWAWAEBSA-N 0 3 417.557 4.239 20 0 HIADHN Cc1ncsc1CN(C)C[C@H]1CCN(C(=O)Nc2cc(Cl)c(Cl)cn2)C1 ZINC000466672688 880458152 /nfs/dbraw/zinc/45/81/52/880458152.db2.gz YLIXDCUFESLGRB-GFCCVEGCSA-N 0 3 414.362 4.139 20 0 HIADHN CCc1c(NC(=O)NC[C@@H](c2ccccc2)N2CCCC2)cnn1-c1ccccc1 ZINC000466690723 880480602 /nfs/dbraw/zinc/48/06/02/880480602.db2.gz RJIXNEYWBGGYLZ-QHCPKHFHSA-N 0 3 403.530 4.393 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)NCc2cc(Cl)ccc2OC(F)F)o1 ZINC000466757796 880537388 /nfs/dbraw/zinc/53/73/88/880537388.db2.gz IRMUOVAWUXARFQ-UHFFFAOYSA-N 0 3 415.868 4.116 20 0 HIADHN Cc1ccc(-c2nc(CNC(=O)N(CCN(C)C)Cc3cccc(C)c3)co2)cc1 ZINC000466768192 880548744 /nfs/dbraw/zinc/54/87/44/880548744.db2.gz NOTBFQSZIILIIB-UHFFFAOYSA-N 0 3 406.530 4.232 20 0 HIADHN CSc1ccc(F)cc1CNC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC000466812156 880587069 /nfs/dbraw/zinc/58/70/69/880587069.db2.gz BAIDLYBHJLZZFT-QGZVFWFLSA-N 0 3 401.551 4.354 20 0 HIADHN CN(Cc1cccc(Br)c1)C(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000503531684 912586684 /nfs/dbraw/zinc/58/66/84/912586684.db2.gz CLGWGMHJZRYXJP-SFHVURJKSA-N 0 3 419.338 4.459 20 0 HIADHN CSc1ccc([C@@H](C)NC(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)cc1 ZINC000466848000 880616981 /nfs/dbraw/zinc/61/69/81/880616981.db2.gz VNIWKGIWGBJOOK-GUDVDZBRSA-N 0 3 419.635 4.390 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@H]2CNC(=O)N2CCCN(Cc3ccccc3)CC2)cc1 ZINC000466955010 880736787 /nfs/dbraw/zinc/73/67/87/880736787.db2.gz PKHONRDYJLRUCM-DQEYMECFSA-N 0 3 421.585 4.380 20 0 HIADHN COCc1ccc([C@H]2CCCN2CCC(=O)Nc2ccccc2Br)o1 ZINC000467022988 880824165 /nfs/dbraw/zinc/82/41/65/880824165.db2.gz JZYFDEYISPQQOK-QGZVFWFLSA-N 0 3 407.308 4.354 20 0 HIADHN C[C@H](C(=O)N[C@@H]1C[C@@H](C)N(Cc2ccccc2)C1)c1ccc(Br)s1 ZINC000467025072 880826199 /nfs/dbraw/zinc/82/61/99/880826199.db2.gz QYHCCNGYEZZGKJ-IJEWVQPXSA-N 0 3 407.377 4.393 20 0 HIADHN Cc1ccc(-c2cnc(CCC(=O)N[C@@H]3C[C@@H](C)N(Cc4ccccc4)C3)o2)cc1 ZINC000467033928 880831582 /nfs/dbraw/zinc/83/15/82/880831582.db2.gz CYCDUZNTBGVQFB-DENIHFKCSA-N 0 3 403.526 4.362 20 0 HIADHN Cc1c(NC(=O)N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)cccc1C(=O)N1CCCC1 ZINC000467118360 880875759 /nfs/dbraw/zinc/87/57/59/880875759.db2.gz WKBMAUXDTJZGGN-RXVVDRJESA-N 0 3 420.557 4.016 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N[C@H](C)c1nc(C(F)(F)F)cs1)c1ccco1 ZINC000503551464 912619244 /nfs/dbraw/zinc/61/92/44/912619244.db2.gz MYPWFEWBWDARCB-QJPTWQEYSA-N 0 3 404.458 4.245 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)c1cncc(-c2ccccc2)c1 ZINC000467196193 880925072 /nfs/dbraw/zinc/92/50/72/880925072.db2.gz PBGANUXCWYGCPN-XMMPIXPASA-N 0 3 400.526 4.270 20 0 HIADHN COCC[C@@H]1CCCCN(CC(=O)N[C@H](c2cccs2)c2ccc(C)cc2)C1 ZINC000467278453 881022910 /nfs/dbraw/zinc/02/29/10/881022910.db2.gz KSEWNLXNZHEDRD-CVDCTZTESA-N 0 3 400.588 4.401 20 0 HIADHN COCCOc1ccc([C@H](C)NCc2cc(Cl)ccc2N2CCOCC2)cc1 ZINC000467334130 881081958 /nfs/dbraw/zinc/08/19/58/881081958.db2.gz FYJSAOQDBZIKQR-KRWDZBQOSA-N 0 3 404.938 4.053 20 0 HIADHN COc1ccc(CN2CCCN(c3nnc(C(F)(F)F)s3)CC2)c2ccccc12 ZINC000467355231 881116698 /nfs/dbraw/zinc/11/66/98/881116698.db2.gz GLPNQJUDTMUPCO-UHFFFAOYSA-N 0 3 422.476 4.431 20 0 HIADHN CN(CC[C@@H]1CCCO1)Cc1cc(Br)ccc1OCc1ccccn1 ZINC000467371433 881146054 /nfs/dbraw/zinc/14/60/54/881146054.db2.gz VHKILGNQPFYYTM-IBGZPJMESA-N 0 3 405.336 4.424 20 0 HIADHN CN(C)Cc1ccc(NC2CCN(CCC(F)(F)F)CC2)cc1Br ZINC000467378817 881155304 /nfs/dbraw/zinc/15/53/04/881155304.db2.gz XTBYQSQJEKWROI-UHFFFAOYSA-N 0 3 408.306 4.339 20 0 HIADHN Cc1cc(CN[C@@H](C)c2ccc([S@](C)=O)cc2)ccc1I ZINC000467380179 881157609 /nfs/dbraw/zinc/15/76/09/881157609.db2.gz CQCJPXZQOGYJAS-ZSEKCTLFSA-N 0 3 413.324 4.188 20 0 HIADHN Cc1ccccc1C[C@@H](CO)N[C@@H](C)c1ccc(OC(F)F)cc1OC(F)F ZINC000467393265 881176852 /nfs/dbraw/zinc/17/68/52/881176852.db2.gz KNKZLSIDPDINPZ-ZFWWWQNUSA-N 0 3 401.400 4.452 20 0 HIADHN O=C1c2ccccc2CCN1CCN[C@H]1CCSc2ccc(Br)cc21 ZINC000467402022 881185559 /nfs/dbraw/zinc/18/55/59/881185559.db2.gz PZOMZFNGZAJAGS-SFHVURJKSA-N 0 3 417.372 4.274 20 0 HIADHN CCS(=O)(=O)c1cccc(CN[C@H]2CCCc3c(Br)cccc32)c1 ZINC000467416912 881205546 /nfs/dbraw/zinc/20/55/46/881205546.db2.gz DAGXVRMWMYYRPB-IBGZPJMESA-N 0 3 408.361 4.410 20 0 HIADHN C[C@H]1C[C@H](C)CN(C(=O)c2ccccc2NC(=O)N(CCN(C)C)C2CCCC2)C1 ZINC000467437291 881234135 /nfs/dbraw/zinc/23/41/35/881234135.db2.gz GSTBKXQEYWMXRG-OALUTQOASA-N 0 3 414.594 4.143 20 0 HIADHN C[C@@H]1C[C@@H](C)CN(C(=O)c2ccccc2NC(=O)N(CCN(C)C)C2CCCC2)C1 ZINC000467437292 881234534 /nfs/dbraw/zinc/23/45/34/881234534.db2.gz GSTBKXQEYWMXRG-RTBURBONSA-N 0 3 414.594 4.143 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)Nc2cccc(-c3noc(C4CC4)n3)c2)CN1Cc1ccccc1 ZINC000467455679 881262062 /nfs/dbraw/zinc/26/20/62/881262062.db2.gz DALKRHCMWOFILB-HRAATJIYSA-N 0 3 417.513 4.399 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)Nc2ccc(OCc3ccncc3)cc2)CN1Cc1ccccc1 ZINC000467464872 881276609 /nfs/dbraw/zinc/27/66/09/881276609.db2.gz QSPPASWLHLNZNM-XXBNENTESA-N 0 3 416.525 4.445 20 0 HIADHN C[C@H]1C[C@H](NC(=O)Nc2ccc(OCC3CCOCC3)cc2)CN1Cc1ccccc1 ZINC000467476124 881295421 /nfs/dbraw/zinc/29/54/21/881295421.db2.gz NKPQOBCPBQARLC-CVDCTZTESA-N 0 3 423.557 4.277 20 0 HIADHN Cc1c(C(=O)NCc2ccccc2CN2CCC(O)CC2)oc2c1c(C)ccc2C ZINC000467492272 881309696 /nfs/dbraw/zinc/30/96/96/881309696.db2.gz BSDQFFNMUNZXNP-UHFFFAOYSA-N 0 3 406.526 4.245 20 0 HIADHN Cc1c2cccc(Cl)c2oc1C(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000467507062 881321896 /nfs/dbraw/zinc/32/18/96/881321896.db2.gz YKDSPFUQSBLKLX-UHFFFAOYSA-N 0 3 412.917 4.281 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)c2cc(Br)c(F)cc2F)C1 ZINC000469051668 883125286 /nfs/dbraw/zinc/12/52/86/883125286.db2.gz SACDHTIEWSFLLU-JSGCOSHPSA-N 0 3 409.274 4.293 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)c1cccc(Br)c1F ZINC000469100516 883191285 /nfs/dbraw/zinc/19/12/85/883191285.db2.gz VUIRPDPCAKAMRH-INIZCTEOSA-N 0 3 420.326 4.110 20 0 HIADHN COc1cc(C)c([C@H](C)NCc2ccc(C)nc2-n2cc(Cl)cn2)cc1OC ZINC000469162106 883258765 /nfs/dbraw/zinc/25/87/65/883258765.db2.gz UJLRTTJJDOUFNF-HNNXBMFYSA-N 0 3 400.910 4.406 20 0 HIADHN CSc1nc(C2CC2)nc(C)c1C(=O)NC[C@@H](c1ccc(C)cc1)N1CCCC1 ZINC000469169039 883268386 /nfs/dbraw/zinc/26/83/86/883268386.db2.gz OZSOPHBSNNJWCS-IBGZPJMESA-N 0 3 410.587 4.260 20 0 HIADHN CCN(C(=O)c1nnn(CC2CCCC2)c1C)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000469187698 883286913 /nfs/dbraw/zinc/28/69/13/883286913.db2.gz CSMYVRWVFHNPSM-PGRDOPGGSA-N 0 3 409.578 4.074 20 0 HIADHN C[C@H]1CN(Cc2cccc(NC(=O)c3ccc(Nc4ccncc4)cc3)c2)C[C@H](C)O1 ZINC000469253766 883350737 /nfs/dbraw/zinc/35/07/37/883350737.db2.gz RCIGQSYERFCGFM-OALUTQOASA-N 0 3 416.525 4.109 20 0 HIADHN Cc1cccc(CNC(=O)N(Cc2ccco2)C2CCN(C)CC2)c1Br ZINC000469293275 883390069 /nfs/dbraw/zinc/39/00/69/883390069.db2.gz RTFMOQZFFFDEFU-UHFFFAOYSA-N 0 3 420.351 4.157 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Cc3cccc(Cl)c3Cl)CC2)C[C@H](C)O1 ZINC000469307876 883408392 /nfs/dbraw/zinc/40/83/92/883408392.db2.gz VTOJJIQILJDCNG-IYBDPMFKSA-N 0 3 413.389 4.274 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)N[C@H]1CCO[C@@H](c2ccccc2)C1 ZINC000469439550 883629098 /nfs/dbraw/zinc/62/90/98/883629098.db2.gz XXFULBWNZBBYCC-KMDXXIMOSA-N 0 3 409.574 4.363 20 0 HIADHN Cc1csc([C@@H](NC(=O)N[C@H](CN(C)Cc2ccccc2)C(C)C)C2CC2)n1 ZINC000469439956 883629197 /nfs/dbraw/zinc/62/91/97/883629197.db2.gz CSLGHORKVONIJM-UXHICEINSA-N 0 3 400.592 4.358 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)N1CCC(n2cc(Cl)cn2)CC1 ZINC000469441408 883632774 /nfs/dbraw/zinc/63/27/74/883632774.db2.gz VAESEEHEWCDLEX-NRFANRHFSA-N 0 3 417.985 4.040 20 0 HIADHN C[C@H](N(CC(=O)Nc1ccccc1SCC(N)=O)Cc1ccccc1)C(C)(C)C ZINC000469446583 883640881 /nfs/dbraw/zinc/64/08/81/883640881.db2.gz PWLHNCMBEDYZOE-KRWDZBQOSA-N 0 3 413.587 4.139 20 0 HIADHN CCN(Cc1cccc(NC(=O)N[C@H](CN(C)Cc2ccccc2)C(C)C)c1)C(C)=O ZINC000469464739 883682115 /nfs/dbraw/zinc/68/21/15/883682115.db2.gz MPHOSGMEGHXZIS-XMMPIXPASA-N 0 3 424.589 4.333 20 0 HIADHN COc1ccccc1COC[C@H](O)CN1CCC(=Cc2ccc(F)c(F)c2)CC1 ZINC000469471477 883696491 /nfs/dbraw/zinc/69/64/91/883696491.db2.gz YTBHEYFPOOOXQS-HXUWFJFHSA-N 0 3 403.469 4.030 20 0 HIADHN CSc1cc(C(=O)N[C@H](CN(C)Cc2ccccc2)C(C)C)ccc1NC(C)=O ZINC000469507279 883759602 /nfs/dbraw/zinc/75/96/02/883759602.db2.gz UZJNHNZOWKKGFH-OAQYLSRUSA-N 0 3 413.587 4.253 20 0 HIADHN CC(C)n1c2ccccc2nc1[C@H]1CCCN(Cc2cc(-c3cnn(C)c3)no2)C1 ZINC000469518666 883782169 /nfs/dbraw/zinc/78/21/69/883782169.db2.gz HTUFEKAFEIORBA-KRWDZBQOSA-N 0 3 404.518 4.385 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)C3CCC(C(F)(F)F)CC3)CC2)C[C@H](C)O1 ZINC000469530931 883802243 /nfs/dbraw/zinc/80/22/43/883802243.db2.gz KJBJCAGYXYSBJH-XYCLOBBJSA-N 0 3 404.517 4.093 20 0 HIADHN CN(C)[C@H](CNCc1nccn1Cc1ccccc1)c1cccc(C(F)(F)F)c1 ZINC000469553589 883812059 /nfs/dbraw/zinc/81/20/59/883812059.db2.gz FGUUUXUIRGRPIY-HXUWFJFHSA-N 0 3 402.464 4.343 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)Nc1ccccc1O[C@H]1CCOC1 ZINC000469661243 883855429 /nfs/dbraw/zinc/85/54/29/883855429.db2.gz MAKHTGLSTFOHPB-RBBKRZOGSA-N 0 3 411.546 4.132 20 0 HIADHN CCOc1cc(Cl)ccc1NC(=O)N1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000469671398 883862248 /nfs/dbraw/zinc/86/22/48/883862248.db2.gz RGZFWCFNCPRDJD-IRXDYDNUSA-N 0 3 423.985 4.482 20 0 HIADHN COc1ccc([C@@H](NC[C@@H](O)CC(F)(F)F)c2ccccc2)cc1Br ZINC000469712678 883883135 /nfs/dbraw/zinc/88/31/35/883883135.db2.gz JRWNGIFAPATANK-YOEHRIQHSA-N 0 3 418.253 4.450 20 0 HIADHN COC(=O)c1cccc(NC(=O)CN[C@H](CC(C)(C)C)c2ccc(Cl)cc2)n1 ZINC000469759986 883925651 /nfs/dbraw/zinc/92/56/51/883925651.db2.gz FZQORBWWVHRICI-QGZVFWFLSA-N 0 3 403.910 4.227 20 0 HIADHN CC(C)(C)OC1CCN(C(=O)N[C@H](CN2CCc3ccccc3C2)C(C)(C)C)CC1 ZINC000469763503 883932156 /nfs/dbraw/zinc/93/21/56/883932156.db2.gz KGZDSGSFUDESNG-JOCHJYFZSA-N 0 3 415.622 4.449 20 0 HIADHN C[C@@H](N[C@@H]1CCN(c2ccc(C(F)(F)F)cc2)C1=O)c1cccc(-n2ccnc2)c1 ZINC000469778090 883953989 /nfs/dbraw/zinc/95/39/89/883953989.db2.gz YPPXUZQBBZMEII-FOIQADDNSA-N 0 3 414.431 4.347 20 0 HIADHN CN(C)[C@H](CN[C@H](c1ccccc1)c1cncnc1)c1cccc(C(F)(F)F)c1 ZINC000469789594 883964395 /nfs/dbraw/zinc/96/43/95/883964395.db2.gz FSCOJIDZTZSQQO-NHCUHLMSSA-N 0 3 400.448 4.477 20 0 HIADHN C[C@H]1C[C@H](N(C)C(=O)CCC(=O)c2ccc(Cl)cn2)CCN1Cc1ccccc1 ZINC000469808645 883982623 /nfs/dbraw/zinc/98/26/23/883982623.db2.gz KIOBLXGTKVMPKA-FXAWDEMLSA-N 0 3 413.949 4.209 20 0 HIADHN CCN1CCN(CCC(=O)N2CCC[C@H]2c2nc(-c3ccccc3)c(C(C)C)o2)CC1 ZINC000469830716 884011760 /nfs/dbraw/zinc/01/17/60/884011760.db2.gz NFSNGOCHMCMDHI-NRFANRHFSA-N 0 3 424.589 4.156 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)N[C@H](C)c2ccc(OCC3CC3)c(F)c2)o1 ZINC000469833242 884013021 /nfs/dbraw/zinc/01/30/21/884013021.db2.gz XPVYIWLRFOKUMP-QGZVFWFLSA-N 0 3 417.525 4.350 20 0 HIADHN O=C(CCc1cccc(C(F)(F)F)c1)NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000469845672 884028646 /nfs/dbraw/zinc/02/86/46/884028646.db2.gz XZSQEGZTTNTDEG-NRFANRHFSA-N 0 3 420.475 4.045 20 0 HIADHN Cc1nc2c(s1)CCC[C@@H]2C(=O)Nc1cc(C)cc(N2CCN(C(C)C)CC2)c1 ZINC000469849583 884032814 /nfs/dbraw/zinc/03/28/14/884032814.db2.gz BDLRRAXQXVJSOL-FQEVSTJZSA-N 0 3 412.603 4.349 20 0 HIADHN O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)c1sccc1-c1ccccc1 ZINC000469856168 884041206 /nfs/dbraw/zinc/04/12/06/884041206.db2.gz MBCNDDWDHCSQMM-OAQYLSRUSA-N 0 3 406.551 4.436 20 0 HIADHN CC(C)[C@H](NC(=O)NC[C@@H](c1ccccc1)N1CCCC1)c1nc2ccccc2[nH]1 ZINC000503687325 912791518 /nfs/dbraw/zinc/79/15/18/912791518.db2.gz ZTHBXECOYFAIBI-VXKWHMMOSA-N 0 3 405.546 4.396 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N[C@H](C)Cc3ccc(C(F)(F)F)cc3)cc2)CC1 ZINC000469984707 884200602 /nfs/dbraw/zinc/20/06/02/884200602.db2.gz LYYMSOUEJBMWER-QGZVFWFLSA-N 0 3 419.491 4.208 20 0 HIADHN CCCN(C(=O)N[C@@H](CC)C1CCOCC1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470026679 884247725 /nfs/dbraw/zinc/24/77/25/884247725.db2.gz GNSJPYLOWBVOMD-GOTSBHOMSA-N 0 3 401.595 4.278 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N1CC[C@@H](c2c(F)cccc2F)C1 ZINC000470042079 884284289 /nfs/dbraw/zinc/28/42/89/884284289.db2.gz BOOICWTZHPAZFO-CRAIPNDOSA-N 0 3 405.514 4.362 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@@H]2NC(=O)N2CCCN(Cc3ccccc3)CC2)cc1 ZINC000470052605 884299814 /nfs/dbraw/zinc/29/98/14/884299814.db2.gz BZEJDJWWOBKIQG-ZEQRLZLVSA-N 0 3 407.558 4.133 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)N[C@H](c1nc(C2CC2)no1)C(C)C ZINC000470062167 884314026 /nfs/dbraw/zinc/31/40/26/884314026.db2.gz MVRGVUHJYUZQGT-PMACEKPBSA-N 0 3 413.566 4.100 20 0 HIADHN C[C@@H](NC(=O)N[C@H](CN1CCCC1)c1ccccc1)c1ccccc1-n1cccn1 ZINC000470063203 884315576 /nfs/dbraw/zinc/31/55/76/884315576.db2.gz VWAWRWHUXOMLLT-DENIHFKCSA-N 0 3 403.530 4.070 20 0 HIADHN C[C@H](NC(=O)N[C@@H](CN1CCCC1)c1ccccc1)c1ccccc1-n1cccn1 ZINC000470063206 884315917 /nfs/dbraw/zinc/31/59/17/884315917.db2.gz VWAWRWHUXOMLLT-UGKGYDQZSA-N 0 3 403.530 4.070 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)c3cn(C)nc3C3CCCCC3)c2)CC1 ZINC000503769917 912820232 /nfs/dbraw/zinc/82/02/32/912820232.db2.gz MBFCNMCJWHKPJN-UHFFFAOYSA-N 0 3 409.578 4.251 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N2CCC(=Cc3ccc(F)c(F)c3)CC2)CC1 ZINC000470166890 884443883 /nfs/dbraw/zinc/44/38/83/884443883.db2.gz YKHDHAYYOYRQGL-UHFFFAOYSA-N 0 3 421.532 4.043 20 0 HIADHN CCO[C@H](CCNC(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1)C(C)C ZINC000470190520 884489530 /nfs/dbraw/zinc/48/95/30/884489530.db2.gz NCDVXPAOGJVVKE-UYAOXDASSA-N 0 3 400.485 4.008 20 0 HIADHN CC[C@H]1CN(C(=O)c2ccc(N3CCN(CC)CC3)cc2)CC[C@@H]1c1ccccc1 ZINC000470192862 884496152 /nfs/dbraw/zinc/49/61/52/884496152.db2.gz CWWSXDIUYHECBX-OFVILXPXSA-N 0 3 405.586 4.484 20 0 HIADHN O=C(CN[C@H]1CCCc2cc(Br)ccc21)N[C@@H]1CCOc2ccccc21 ZINC000503852911 912840902 /nfs/dbraw/zinc/84/09/02/912840902.db2.gz BBGXUQPDYSJOHL-RBUKOAKNSA-N 0 3 415.331 4.056 20 0 HIADHN O=C(CN[C@H](c1ccc(Br)cc1)C1CC1)N[C@@H]1CCOc2ccccc21 ZINC000503852867 912841226 /nfs/dbraw/zinc/84/12/26/912841226.db2.gz ANTVOLHXYRXHIJ-NQIIRXRSSA-N 0 3 415.331 4.130 20 0 HIADHN CC(C)[C@@H](CNC(=O)Nc1ccccc1O[C@@H]1CCOC1)N1CCc2ccccc2C1 ZINC000470261406 884604303 /nfs/dbraw/zinc/60/43/03/884604303.db2.gz PTBMSVXOPDIMGL-FYYLOGMGSA-N 0 3 423.557 4.059 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)Nc1cc(F)ccc1OC(F)F ZINC000470286550 884656442 /nfs/dbraw/zinc/65/64/42/884656442.db2.gz NITRZUFKKPBDJK-UHFFFAOYSA-N 0 3 417.378 4.301 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1ccccc1O[C@@H]1CCOC1)c1ccsc1 ZINC000470300269 884674539 /nfs/dbraw/zinc/67/45/39/884674539.db2.gz YSIHAOIUAQLJMD-MJGOQNOKSA-N 0 3 403.548 4.120 20 0 HIADHN C[C@H](NCc1ccc(I)c(Cl)c1)c1cccc(CO)c1 ZINC000503891405 912853225 /nfs/dbraw/zinc/85/32/25/912853225.db2.gz IQIHNHPQMVIFKG-NSHDSACASA-N 0 3 401.675 4.288 20 0 HIADHN C[C@@H](CO)N1CCCN(C(=O)Nc2cccc(Sc3ccc(Cl)cc3)c2)CC1 ZINC000470386773 884787751 /nfs/dbraw/zinc/78/77/51/884787751.db2.gz APWLWRZWRQPIFA-INIZCTEOSA-N 0 3 419.978 4.412 20 0 HIADHN CCCN1CCC[C@H]1C(=O)N1CCC[C@H](c2nc(-c3ccccc3OC)cs2)C1 ZINC000470417760 884820808 /nfs/dbraw/zinc/82/08/08/884820808.db2.gz HUAFZZHTZSJGLE-PXNSSMCTSA-N 0 3 413.587 4.399 20 0 HIADHN COc1ccc(NC(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)c(C)n1 ZINC000470425360 884826685 /nfs/dbraw/zinc/82/66/85/884826685.db2.gz OLCKJALVKZBONI-UHFFFAOYSA-N 0 3 410.440 4.013 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)Nc2ccc(Br)cc2Cl)C[C@H](C)O1 ZINC000470438796 884836550 /nfs/dbraw/zinc/83/65/50/884836550.db2.gz PROUFYNHCQIYLM-BETUJISGSA-N 0 3 418.763 4.113 20 0 HIADHN CC(C)[C@H](NC(=O)N(CCN(C)C)Cc1ccc(Br)cc1)C(F)(F)F ZINC000470454539 884849820 /nfs/dbraw/zinc/84/98/20/884849820.db2.gz ASQSAZNKPIBUOK-HNNXBMFYSA-N 0 3 424.305 4.109 20 0 HIADHN C[C@@H](NC(=O)N[C@H]1CCN(Cc2ccccc2)C1)c1ccc(-c2ccncc2)cc1 ZINC000470480922 884868953 /nfs/dbraw/zinc/86/89/53/884868953.db2.gz ZIYVWYUGUBNJPZ-DVECYGJZSA-N 0 3 400.526 4.383 20 0 HIADHN C[C@H]1CN(C2CCOCC2)CCN1C(=O)C[C@@H](Cc1ccccc1)c1ccccc1 ZINC000470490500 884877650 /nfs/dbraw/zinc/87/76/50/884877650.db2.gz UBLVUFNFCVJAGQ-XUZZJYLKSA-N 0 3 406.570 4.115 20 0 HIADHN CCc1ccccc1NC(=O)C[C@@H](C)N[C@H](Cn1ccccc1=O)c1ccccc1 ZINC000503937326 912872582 /nfs/dbraw/zinc/87/25/82/912872582.db2.gz MIJDBIWOTQISCG-AUSIDOKSSA-N 0 3 403.526 4.159 20 0 HIADHN COC[C@H](C)Oc1ccc(Cl)cc1NC(=O)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000470519379 884909898 /nfs/dbraw/zinc/90/98/98/884909898.db2.gz LTFXLJAMEAZYHG-LPHOPBHVSA-N 0 3 417.937 4.150 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N(C)[C@@H](Cc3ccc(F)cc3)C(C)C)cc2)CC1 ZINC000470546824 884956558 /nfs/dbraw/zinc/95/65/58/884956558.db2.gz MLRRAWMZVPTIAY-DEOSSOPVSA-N 0 3 411.565 4.307 20 0 HIADHN CN(C(=O)c1cccc(OCc2cccnc2)c1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470656174 885078519 /nfs/dbraw/zinc/07/85/19/885078519.db2.gz MGGMHILLRHMWBI-DEOSSOPVSA-N 0 3 415.537 4.397 20 0 HIADHN CN(C(=O)c1ccc(CNC(=O)C(C)(C)C)cc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470657785 885081292 /nfs/dbraw/zinc/08/12/92/885081292.db2.gz UTCZGDGDOTWCIP-HSZRJFAPSA-N 0 3 421.585 4.086 20 0 HIADHN CN(C(=O)c1ccc(N2CCCCCC2)nc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470662871 885088633 /nfs/dbraw/zinc/08/86/33/885088633.db2.gz MMWQVJWQQOGEAK-HSZRJFAPSA-N 0 3 406.574 4.199 20 0 HIADHN C[C@@H]1C[C@H]1C(=O)Nc1cccc(C(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000470665716 885092206 /nfs/dbraw/zinc/09/22/06/885092206.db2.gz GKDJSHOMPIRVRF-YFXJRYMSSA-N 0 3 405.542 4.018 20 0 HIADHN Cc1cc(C(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)c(C)n1Cc1ccccn1 ZINC000470665690 885092538 /nfs/dbraw/zinc/09/25/38/885092538.db2.gz GCQGHJBFKMXVNS-DEOSSOPVSA-N 0 3 416.569 4.285 20 0 HIADHN CN(C(=O)Cc1ccc(Br)cc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470669213 885098127 /nfs/dbraw/zinc/09/81/27/885098127.db2.gz RFAFCHVTBWUHSO-HXUWFJFHSA-N 0 3 401.348 4.115 20 0 HIADHN CC(C)N1CCC[C@@H](NC(=O)c2cnn(-c3ccc(Cl)cc3)c2C(F)(F)F)C1 ZINC000470678453 885110242 /nfs/dbraw/zinc/11/02/42/885110242.db2.gz OJGAPEBQIIYEPG-CQSZACIVSA-N 0 3 414.859 4.147 20 0 HIADHN Cc1oc(-c2cccs2)nc1CC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470681306 885114369 /nfs/dbraw/zinc/11/43/69/885114369.db2.gz XZMKTZQFHCISCU-LJQANCHMSA-N 0 3 409.555 4.377 20 0 HIADHN Cc1noc2nc(C3CC3)cc(C(=O)N(C)[C@H]3CCCN(Cc4ccccc4)C3)c12 ZINC000470681473 885114659 /nfs/dbraw/zinc/11/46/59/885114659.db2.gz ICTQIUULNMUWLN-IBGZPJMESA-N 0 3 404.514 4.145 20 0 HIADHN CN(C(=O)c1cnn(-c2ccc(Cl)cc2)c1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470683046 885116386 /nfs/dbraw/zinc/11/63/86/885116386.db2.gz OSBMOXZBTOVBCN-JOCHJYFZSA-N 0 3 408.933 4.262 20 0 HIADHN CC(C)c1c(C(=O)N[C@H]2CCCN(C(C)C)C2)cnn1-c1ccc(C(F)(F)F)cn1 ZINC000470695401 885132713 /nfs/dbraw/zinc/13/27/13/885132713.db2.gz XCNYJZAHIXNJBR-INIZCTEOSA-N 0 3 423.483 4.012 20 0 HIADHN CN(C(=O)NCC1(c2ccccc2)CCOCC1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470730644 885184040 /nfs/dbraw/zinc/18/40/40/885184040.db2.gz WIMVLYOGRFDWQE-DEOSSOPVSA-N 0 3 421.585 4.041 20 0 HIADHN CN(C(=O)NCc1ccc(Br)s1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470734660 885189770 /nfs/dbraw/zinc/18/97/70/885189770.db2.gz XNNFGRQPKLGKJE-INIZCTEOSA-N 0 3 422.392 4.317 20 0 HIADHN C[C@@H](OCCCNC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1)c1ccccc1 ZINC000470740442 885201036 /nfs/dbraw/zinc/20/10/36/885201036.db2.gz MEEQFUHJUOBFEO-ZJSXRUAMSA-N 0 3 409.574 4.460 20 0 HIADHN COc1ccc([C@H](NC(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)C2CC2)cc1 ZINC000470740994 885202241 /nfs/dbraw/zinc/20/22/41/885202241.db2.gz RXFPIZXMBVPEHP-LADGPHEKSA-N 0 3 407.558 4.452 20 0 HIADHN CN(Cc1nc(C(F)(F)F)cs1)C(=O)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000470744445 885207519 /nfs/dbraw/zinc/20/75/19/885207519.db2.gz PAWIBSWZJMQBBD-HNNXBMFYSA-N 0 3 412.481 4.140 20 0 HIADHN Cc1ccc(Oc2ccc(NC(=O)N(CCN(C)C)Cc3ccccn3)cn2)cc1 ZINC000504021722 912927042 /nfs/dbraw/zinc/92/70/42/912927042.db2.gz OGAIWGKRTUHHQL-UHFFFAOYSA-N 0 3 405.502 4.173 20 0 HIADHN CC[C@@H]1CN(C[C@@H](O)COc2ccc(C(C)=O)cc2OC)CC[C@H]1c1ccccc1 ZINC000470872748 885361441 /nfs/dbraw/zinc/36/14/41/885361441.db2.gz KPUHZAAOYUBLOS-UEVCKROQSA-N 0 3 411.542 4.153 20 0 HIADHN C[C@H](CNC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1)c1ccc(F)cc1F ZINC000470884014 885378705 /nfs/dbraw/zinc/37/87/05/885378705.db2.gz TWBGXBGSFVCYOY-XLIONFOSSA-N 0 3 401.501 4.374 20 0 HIADHN COc1cc(CNC(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)c2ccccc2n1 ZINC000470895062 885392688 /nfs/dbraw/zinc/39/26/88/885392688.db2.gz QRZMLRRBKQHDQG-OAQYLSRUSA-N 0 3 418.541 4.049 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCc1nnc(-c2ccccc2)s1)c1ccsc1 ZINC000470905660 885410679 /nfs/dbraw/zinc/41/06/79/885410679.db2.gz HOAJGKPHSJNNIY-QGZVFWFLSA-N 0 3 415.588 4.149 20 0 HIADHN COc1cccc(CNC[C@H](c2ccc(Cl)cc2)N2CCOC(C)(C)C2)c1OC ZINC000504029892 912932584 /nfs/dbraw/zinc/93/25/84/912932584.db2.gz DYGGGMNUUSHYNC-HXUWFJFHSA-N 0 3 418.965 4.299 20 0 HIADHN Cc1nc2ccc(C(=O)N(CCN(C)C)Cc3ccc(C(F)(F)F)cc3)cc2o1 ZINC000470932413 885436898 /nfs/dbraw/zinc/43/68/98/885436898.db2.gz ODQWQQYXHMNOEK-UHFFFAOYSA-N 0 3 405.420 4.359 20 0 HIADHN Cc1ccc(C)c(NC(=O)Cc2nc(CN3CCN(C4CCCC4)CC3)cs2)c1 ZINC000470978962 885480605 /nfs/dbraw/zinc/48/06/05/885480605.db2.gz XFQLYOWVAVIIIC-UHFFFAOYSA-N 0 3 412.603 4.001 20 0 HIADHN C[C@@H]1CCN(C(=O)NCc2nnc(-c3ccccc3)s2)CCN1Cc1ccccc1 ZINC000471077635 885602258 /nfs/dbraw/zinc/60/22/58/885602258.db2.gz FXNSGZQFJSUVRV-GOSISDBHSA-N 0 3 421.570 4.011 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)[C@@H](C)c3cccs3)c(OCC)c2)CC1 ZINC000471163371 885720167 /nfs/dbraw/zinc/72/01/67/885720167.db2.gz VCOYREDPRSXGLS-KRWDZBQOSA-N 0 3 401.576 4.421 20 0 HIADHN C[C@H](CNC(=O)Nc1cc(-c2ccccc2)ccc1Cl)CN1CCN(C)CC1 ZINC000471412073 886064459 /nfs/dbraw/zinc/06/44/59/886064459.db2.gz FTGCGVVYZRKTMD-QGZVFWFLSA-N 0 3 400.954 4.012 20 0 HIADHN O[C@@H](COc1cccc2[nH]ccc21)CN1CCC(c2nc3ccccc3s2)CC1 ZINC000471432095 886090545 /nfs/dbraw/zinc/09/05/45/886090545.db2.gz QUJMQDKEDZXFSU-QGZVFWFLSA-N 0 3 407.539 4.397 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)N[C@H]2C[C@@H]2c2ccccc2OC(F)F)CCN1Cc1ccccc1 ZINC000504103816 913012410 /nfs/dbraw/zinc/01/24/10/913012410.db2.gz MTPOLWAODZDSOX-XCLNPWKQSA-N 0 3 415.484 4.106 20 0 HIADHN C[C@H](NC(=O)N(Cc1ccccc1)C1CCN(C)CC1)c1ccccc1-n1cccn1 ZINC000471489544 886188765 /nfs/dbraw/zinc/18/87/65/886188765.db2.gz VOVMOFCZZCNLRI-FQEVSTJZSA-N 0 3 417.557 4.239 20 0 HIADHN C[C@H](NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1ccc(F)c(F)c1 ZINC000471493967 886195079 /nfs/dbraw/zinc/19/50/79/886195079.db2.gz WCIVCQUDPDHWKK-QGLTVNCISA-N 0 3 405.411 4.130 20 0 HIADHN Cc1ccc(C(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)cc1NC(=O)c1ccco1 ZINC000471527650 886231848 /nfs/dbraw/zinc/23/18/48/886231848.db2.gz CXQFSTJUGPBSQX-VGOFRKELSA-N 0 3 405.498 4.262 20 0 HIADHN COc1ccc(CCC(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)cc1Br ZINC000471543120 886249392 /nfs/dbraw/zinc/24/93/92/886249392.db2.gz XDDLFEPJGPNDEB-QVKFZJNVSA-N 0 3 419.363 4.198 20 0 HIADHN Cc1ccc(I)c(C(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)c1 ZINC000471569382 886279846 /nfs/dbraw/zinc/27/98/46/886279846.db2.gz GUYQRTCBQVBZBR-KSSFIOAISA-N 0 3 422.310 4.021 20 0 HIADHN CCCOc1ccc(CNC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cc1 ZINC000471589429 886300074 /nfs/dbraw/zinc/30/00/74/886300074.db2.gz PUKWSJBLLVPIKH-UHFFFAOYSA-N 0 3 413.484 4.080 20 0 HIADHN C[C@@H](CCCCN1C(=O)c2ccccc2C1=O)NCc1coc(-c2cccs2)n1 ZINC000471606675 886320737 /nfs/dbraw/zinc/32/07/37/886320737.db2.gz PGQKYONZHLVNGL-HNNXBMFYSA-N 0 3 409.511 4.348 20 0 HIADHN Cc1ccc([C@@H](NC2CC(OC(C)C)C2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000471612865 886327601 /nfs/dbraw/zinc/32/76/01/886327601.db2.gz HDNPVQWIADJTLG-XPJNUEMQSA-N 0 3 401.572 4.342 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)[C@H]3C[C@@H]3c3ccccc3OC(F)F)c2)CC1 ZINC000471621587 886339692 /nfs/dbraw/zinc/33/96/92/886339692.db2.gz NQDNKXUHJRFOOP-UXHICEINSA-N 0 3 415.484 4.172 20 0 HIADHN CCc1ccc([C@H](CNC(=O)c2cc3c(C(F)F)nn(C)c3s2)N(C)C)cc1 ZINC000471639504 886357524 /nfs/dbraw/zinc/35/75/24/886357524.db2.gz PCQXDKZROAMVDB-HNNXBMFYSA-N 0 3 406.502 4.168 20 0 HIADHN C[C@H](NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1c(F)cccc1F ZINC000471647258 886362959 /nfs/dbraw/zinc/36/29/59/886362959.db2.gz FWMDDBUAZGNSMV-XGNXJENSSA-N 0 3 405.411 4.130 20 0 HIADHN CSc1ccc(CNC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cc1 ZINC000471721062 886431581 /nfs/dbraw/zinc/43/15/81/886431581.db2.gz PQRXIIWZKQYHBW-UHFFFAOYSA-N 0 3 401.498 4.013 20 0 HIADHN C[C@@H](CNC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1ccc(F)cc1 ZINC000471721549 886432204 /nfs/dbraw/zinc/43/22/04/886432204.db2.gz VSRHPBBJMQFWKY-TZYSRNFLSA-N 0 3 401.448 4.034 20 0 HIADHN CCc1c(C(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)cnn1-c1ccc(OC)cc1 ZINC000471739653 886462739 /nfs/dbraw/zinc/46/27/39/886462739.db2.gz VNWYSBGWUHFYMT-ICSRJNTNSA-N 0 3 418.541 4.009 20 0 HIADHN C[C@H](SCC(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1)c1nc2ccccc2[nH]1 ZINC000471800485 886536482 /nfs/dbraw/zinc/53/64/82/886536482.db2.gz RPCREMGFRFLFED-LNLFQRSKSA-N 0 3 408.571 4.309 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)N(C)Cc2ccccc2N2CCCC2)C1 ZINC000504178290 913060954 /nfs/dbraw/zinc/06/09/54/913060954.db2.gz XUZXBJXUVMCALE-NZQKXSOJSA-N 0 3 406.574 4.264 20 0 HIADHN Cc1ccc(C[C@@H](C)NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)c(C)c1 ZINC000471860139 886633643 /nfs/dbraw/zinc/63/36/43/886633643.db2.gz LVNBNSHQWNQQTM-PBPGXSGUSA-N 0 3 411.512 4.339 20 0 HIADHN COc1ccc(OC)c(NC(=O)[C@H](C)N[C@H]2C[C@@H](OCc3ccccc3)C2(C)C)c1 ZINC000471860755 886635874 /nfs/dbraw/zinc/63/58/74/886635874.db2.gz YIWUIQZVBRMOLR-WQTXXOFMSA-N 0 3 412.530 4.004 20 0 HIADHN Cc1ccc([C@H](NC(=O)NC[C@H]2CCCN2Cc2ccccc2)c2ccccn2)cc1 ZINC000471924241 886714565 /nfs/dbraw/zinc/71/45/65/886714565.db2.gz SCVLAVWWJBKABP-NOZRDPDXSA-N 0 3 414.553 4.443 20 0 HIADHN Cc1ccnc(Oc2ccc(NC(=O)N[C@@H]3CCN(C)[C@H]3c3ccccc3)cc2)n1 ZINC000471986626 886814228 /nfs/dbraw/zinc/81/42/28/886814228.db2.gz YJYGLBDGZXWHCZ-RTWAWAEBSA-N 0 3 403.486 4.144 20 0 HIADHN Cc1ccc2[nH]c(CNc3ccc4nc(CCN5CCOCC5)[nH]c4c3)cc2c1C ZINC000472062259 886871322 /nfs/dbraw/zinc/87/13/22/886871322.db2.gz IDTNZMWBRUIZHR-UHFFFAOYSA-N 0 3 403.530 4.148 20 0 HIADHN C[C@@H](CCCCN1C(=O)c2ccccc2C1=O)NCc1nc(C(F)(F)F)cs1 ZINC000472140215 886935135 /nfs/dbraw/zinc/93/51/35/886935135.db2.gz MNXKEADXYNDKHK-LBPRGKRZSA-N 0 3 411.449 4.107 20 0 HIADHN COc1ccc(OC)c([C@@H]2C[C@H]2C(=O)N(CCN(C)C)Cc2cccc(Cl)c2)c1 ZINC000472217971 887018829 /nfs/dbraw/zinc/01/88/29/887018829.db2.gz ZZYUXIIYPHASPN-PZJWPPBQSA-N 0 3 416.949 4.051 20 0 HIADHN O=C(CCc1cnc2ccccc2c1)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000472253723 887063087 /nfs/dbraw/zinc/06/30/87/887063087.db2.gz BABWSKWRFQADBZ-UHFFFAOYSA-N 0 3 403.526 4.010 20 0 HIADHN O=C(NC[C@@H]1CCCCN1CCc1nc(-c2ccc(Cl)cc2)no1)c1ccccc1 ZINC000472268266 887083908 /nfs/dbraw/zinc/08/39/08/887083908.db2.gz GIDWQVOHKFTQFQ-FQEVSTJZSA-N 0 3 424.932 4.217 20 0 HIADHN Cc1cccc(Oc2ccccc2CNC(=O)N(CCN(C)C)Cc2ccccn2)c1 ZINC000504247828 913113952 /nfs/dbraw/zinc/11/39/52/913113952.db2.gz QUEPPPZMYWNETH-UHFFFAOYSA-N 0 3 418.541 4.456 20 0 HIADHN COCc1c(Br)cccc1NC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000472314089 887143993 /nfs/dbraw/zinc/14/39/93/887143993.db2.gz LYVDFMMKNHOGFP-RTBURBONSA-N 0 3 418.335 4.162 20 0 HIADHN COc1cc(-c2nnc(CN3CC[C@@H](Cc4ccccc4)[C@@H]3C)o2)cc(OC)c1OC ZINC000472324830 887159027 /nfs/dbraw/zinc/15/90/27/887159027.db2.gz ILXCZHJRKZSWBA-WMZOPIPTSA-N 0 3 423.513 4.216 20 0 HIADHN Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000472328850 887162664 /nfs/dbraw/zinc/16/26/64/887162664.db2.gz OXDUPPYNDNNDOM-PKTZIBPZSA-N 0 3 420.557 4.234 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2ccc(F)cc2OCC(F)(F)F)[C@@H]1c1ccccc1 ZINC000472342088 887176045 /nfs/dbraw/zinc/17/60/45/887176045.db2.gz YBBUSHKUGANBHG-WMZOPIPTSA-N 0 3 411.399 4.334 20 0 HIADHN CO[C@@H]1CC[C@H](NC(=O)N(CCN2CCCC2)Cc2ccc(Cl)c(Cl)c2)C1 ZINC000472346497 887180578 /nfs/dbraw/zinc/18/05/78/887180578.db2.gz JFGFOHXDQRSSNJ-DLBZAZTESA-N 0 3 414.377 4.168 20 0 HIADHN Cc1ccccc1[C@H]1CCN(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)C1 ZINC000472453612 887307740 /nfs/dbraw/zinc/30/77/40/887307740.db2.gz FLGSSOFVVDEFTD-IVMQYODDSA-N 0 3 409.496 4.299 20 0 HIADHN CN(Cc1c(F)cccc1Cl)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472461945 887320020 /nfs/dbraw/zinc/32/00/20/887320020.db2.gz DXWJKLCMHDJGLA-UHFFFAOYSA-N 0 3 421.866 4.426 20 0 HIADHN COCCC[C@H](Cc1ccccc1)NC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000472461515 887320106 /nfs/dbraw/zinc/32/01/06/887320106.db2.gz IDHPTWNDVJLWGC-JWQCQUIFSA-N 0 3 423.601 4.330 20 0 HIADHN Cc1cc(N2CCCC2)ccc1NC(=O)CN(C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000472472994 887333709 /nfs/dbraw/zinc/33/37/09/887333709.db2.gz AQVJZITYXJCLFT-XMMPIXPASA-N 0 3 420.601 4.130 20 0 HIADHN Cc1ccc([C@H](NC(=O)N(CCN(C)C)Cc2ccc(F)cc2)c2ccccn2)cc1 ZINC000472474312 887335149 /nfs/dbraw/zinc/33/51/49/887335149.db2.gz BXPKPHNUZKTYNL-DEOSSOPVSA-N 0 3 420.532 4.392 20 0 HIADHN CN(C(=O)Nc1cc2c(cc1Cl)OCCO2)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000472683715 887537756 /nfs/dbraw/zinc/53/77/56/887537756.db2.gz DFQARJFDHATMNP-QGZVFWFLSA-N 0 3 415.921 4.240 20 0 HIADHN CCN(C(=O)NC[C@@H](c1cccs1)N1CCCC1)[C@@H](COC)Cc1ccccc1 ZINC000472916400 887762643 /nfs/dbraw/zinc/76/26/43/887762643.db2.gz DVTQHCZMWLDNPC-RTWAWAEBSA-N 0 3 415.603 4.174 20 0 HIADHN O[C@H](COc1ccc(Oc2ccccc2)cc1)CN1CC[C@]2(C1)OCc1ccccc12 ZINC000473159361 887938426 /nfs/dbraw/zinc/93/84/26/887938426.db2.gz HJWNDKYHEAIHPF-HFZDXXHNSA-N 0 3 417.505 4.350 20 0 HIADHN CCOc1ccc(CNC(=O)N(CCN(C)C)Cc2ccc(F)cc2)cc1Cl ZINC000504361291 913193570 /nfs/dbraw/zinc/19/35/70/913193570.db2.gz CDNKPFYZGMNOTA-UHFFFAOYSA-N 0 3 407.917 4.151 20 0 HIADHN CN(C(=O)c1ccc(C(F)(F)F)c(F)c1)C1CCN(CCc2ccccn2)CC1 ZINC000473180904 887959780 /nfs/dbraw/zinc/95/97/80/887959780.db2.gz HJRHKDVSNIRDEK-UHFFFAOYSA-N 0 3 409.427 4.019 20 0 HIADHN C[C@H](CC(=O)c1ccccc1F)C(=O)N[C@H]1[C@H](C)CN(Cc2ccccc2)C[C@@H]1C ZINC000473277003 888033337 /nfs/dbraw/zinc/03/33/37/888033337.db2.gz NAPGGLRUAOLGLY-FVJVTNMWSA-N 0 3 410.533 4.307 20 0 HIADHN COc1ccc(-c2csc(CNC(=O)CC3(N4CCOCC4)CCCC3)c2)cc1 ZINC000473464768 888188250 /nfs/dbraw/zinc/18/82/50/888188250.db2.gz TZBCWSMDIXLYJW-UHFFFAOYSA-N 0 3 414.571 4.075 20 0 HIADHN C[C@H](CCN1CCN(C)CC1)NC(=O)Nc1cc(Cl)ccc1Oc1ccccc1 ZINC000473493715 888214942 /nfs/dbraw/zinc/21/49/42/888214942.db2.gz WVUUQWKVYMUDQB-QGZVFWFLSA-N 0 3 416.953 4.280 20 0 HIADHN CC(C)c1cc(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)nn1C(C)(C)C ZINC000473518305 888249717 /nfs/dbraw/zinc/24/97/17/888249717.db2.gz CWOXQZHUJZLBDF-UHFFFAOYSA-N 0 3 414.516 4.297 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1ccc(Cl)c2cccnc12 ZINC000473517977 888249962 /nfs/dbraw/zinc/24/99/62/888249962.db2.gz CICPHYMXIHANLH-UHFFFAOYSA-N 0 3 411.855 4.423 20 0 HIADHN Cc1nc(CC(C)C)c(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)s1 ZINC000473520592 888255147 /nfs/dbraw/zinc/25/51/47/888255147.db2.gz INNFTCOQTQDQIF-UHFFFAOYSA-N 0 3 403.514 4.185 20 0 HIADHN O=C(CCCOc1ccc2c(c1)CCC2)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473524560 888259591 /nfs/dbraw/zinc/25/95/91/888259591.db2.gz OVCRZHJDSAKEBW-UHFFFAOYSA-N 0 3 424.507 4.256 20 0 HIADHN C[C@@H]1C[C@@H]1c1ccc([C@@H]2C[C@H]2C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)o1 ZINC000473523926 888260359 /nfs/dbraw/zinc/26/03/59/888260359.db2.gz HJJYCHBYBFTXHI-VNYZSGJOSA-N 0 3 410.480 4.428 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)[C@H]1C[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000473523952 888260699 /nfs/dbraw/zinc/26/06/99/888260699.db2.gz HNNROOZKKJORCF-CVSAEHQPSA-N 0 3 420.397 4.129 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1ccc(Br)cc1F ZINC000473526733 888263924 /nfs/dbraw/zinc/26/39/24/888263924.db2.gz SCRAGNFZUCMQJN-UHFFFAOYSA-N 0 3 423.248 4.123 20 0 HIADHN Cc1cccc(C)c1Oc1ccccc1NC(=O)N[C@H](C)CCN1CCN(C)CC1 ZINC000473671803 888432323 /nfs/dbraw/zinc/43/23/23/888432323.db2.gz XGVYYLUWDMTYLI-HXUWFJFHSA-N 0 3 410.562 4.243 20 0 HIADHN CCOCCC1(CNC(=O)N(Cc2ccccc2)C2CCN(C)CC2)CCCC1 ZINC000473680099 888446982 /nfs/dbraw/zinc/44/69/82/888446982.db2.gz VHUKMLMIYUYCIO-UHFFFAOYSA-N 0 3 401.595 4.279 20 0 HIADHN O=C(c1ncoc1-c1ccc(F)cc1)N1CCCN(CCCc2ccccc2)CC1 ZINC000473721118 888497797 /nfs/dbraw/zinc/49/77/97/888497797.db2.gz LFMKOTXNVKGBNA-UHFFFAOYSA-N 0 3 407.489 4.261 20 0 HIADHN C[C@H](Oc1ccccc1NC(=O)NC(C)(C)CCN1CCN(C)CC1)c1ccccc1 ZINC000473723526 888500946 /nfs/dbraw/zinc/50/09/46/888500946.db2.gz OBGWXCBTSHDBDC-FQEVSTJZSA-N 0 3 424.589 4.364 20 0 HIADHN CCN(C(=O)Nc1nnc(C(F)(F)F)s1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000473737482 888517815 /nfs/dbraw/zinc/51/78/15/888517815.db2.gz BSYKWMWZMVVOJP-OCCSQVGLSA-N 0 3 413.469 4.246 20 0 HIADHN CCN(C(=O)Nc1nnc(-c2ccco2)s1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000473777928 888581203 /nfs/dbraw/zinc/58/12/03/888581203.db2.gz XLJQBYIXOMLBMY-RDJZCZTQSA-N 0 3 411.531 4.487 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@H]3CCCOc4ccc(F)cc43)c2)CC1 ZINC000473803293 888624916 /nfs/dbraw/zinc/62/49/16/888624916.db2.gz CNTQZVYZEUDWBE-NRFANRHFSA-N 0 3 412.509 4.003 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N(Cc3ccccc3)C[C@@H]3CCCO3)c2)CC1 ZINC000473806940 888630617 /nfs/dbraw/zinc/63/06/17/888630617.db2.gz LSLJPHBFLJMYEX-DEOSSOPVSA-N 0 3 422.573 4.042 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CCC(OC4CCCCC4)CC3)c2)CC1 ZINC000473816084 888643829 /nfs/dbraw/zinc/64/38/29/888643829.db2.gz GJEYYWXCGMKCDG-UHFFFAOYSA-N 0 3 414.594 4.174 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CC[C@@H](CSc4ccccc4)C3)c2)CC1 ZINC000473819901 888650493 /nfs/dbraw/zinc/65/04/93/888650493.db2.gz UCQGYFLGILILJT-HXUWFJFHSA-N 0 3 424.614 4.475 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)NCCCc3c[nH]c4ccccc34)c2)CC1 ZINC000473828756 888662042 /nfs/dbraw/zinc/66/20/42/888662042.db2.gz LWMNUPAOFXVDSU-UHFFFAOYSA-N 0 3 405.546 4.064 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@@H](c3nccs3)c3ccccc3)c2)CC1 ZINC000473833632 888668864 /nfs/dbraw/zinc/66/88/64/888668864.db2.gz XZWGYDJZDCRJNP-OAQYLSRUSA-N 0 3 421.570 4.196 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@@H](c3ccccc3)c3ccccn3)c2)CC1 ZINC000473834068 888670630 /nfs/dbraw/zinc/67/06/30/888670630.db2.gz DPMBIHVGRORQMV-DEOSSOPVSA-N 0 3 415.541 4.135 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)Nc3ccccc3OCC(F)F)c2)CC1 ZINC000473837348 888676597 /nfs/dbraw/zinc/67/65/97/888676597.db2.gz QYBKZMGCRFXPCI-UHFFFAOYSA-N 0 3 404.461 4.116 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@H]3CCCO[C@@H]3c3ccc(C)cc3)c2)CC1 ZINC000473839136 888678698 /nfs/dbraw/zinc/67/86/98/888678698.db2.gz YQMQHXJKSRFVNC-BJKOFHAPSA-N 0 3 422.573 4.179 20 0 HIADHN COc1ccc([C@H]2CCN(CC(=O)Nc3ccc4nc(C(F)(F)F)[nH]c4c3)C2)cc1 ZINC000504488476 913279433 /nfs/dbraw/zinc/27/94/33/913279433.db2.gz LRCXIYMMCLPGSC-AWEZNQCLSA-N 0 3 418.419 4.018 20 0 HIADHN CC(C)Cc1ccc([C@H](NC(=O)NC(C)(C)CCN2CCN(C)CC2)C2CC2)cc1 ZINC000473932597 888812308 /nfs/dbraw/zinc/81/23/08/888812308.db2.gz MEEXWSQIRMYIJS-QHCPKHFHSA-N 0 3 414.638 4.052 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N2CCSC[C@H]2c2nccs2)N2CCCC2)cc1 ZINC000473942057 888819161 /nfs/dbraw/zinc/81/91/61/888819161.db2.gz DKOSDSGXMJRNBI-MOPGFXCFSA-N 0 3 416.616 4.088 20 0 HIADHN COc1ccc2c(c1)C(C)(C)C[C@H]2NCc1ccc(C(=O)N2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000474026966 888877195 /nfs/dbraw/zinc/87/71/95/888877195.db2.gz BCTCRGCZURVBES-NXMSCROESA-N 0 3 422.569 4.457 20 0 HIADHN COc1ccc2c(c1)C(C)(C)C[C@H]2NCc1ccc(S(=O)(=O)N(C)C(C)C)cc1 ZINC000474048416 888888290 /nfs/dbraw/zinc/88/82/90/888888290.db2.gz SADVEZATYNBJTC-JOCHJYFZSA-N 0 3 416.587 4.236 20 0 HIADHN C[C@@H](N[C@@H]1CCN(c2ccc(Cl)cc2Cl)C1=O)c1ccc(-n2cncn2)cc1 ZINC000474090165 888916693 /nfs/dbraw/zinc/91/66/93/888916693.db2.gz RKBGWQCFGHMXFQ-FZKQIMNGSA-N 0 3 416.312 4.030 20 0 HIADHN COc1cc(C(C)=O)ccc1OC[C@H](O)CN(Cc1ccc(F)cc1)C(C)(C)C ZINC000474159688 888995585 /nfs/dbraw/zinc/99/55/85/888995585.db2.gz OAMSZQPNPFNRCJ-HXUWFJFHSA-N 0 3 403.494 4.077 20 0 HIADHN Cc1nc2ccccc2n1C1CCN(C(=O)NC[C@H](c2ccc(C)cc2)N(C)C)CC1 ZINC000474251770 889104760 /nfs/dbraw/zinc/10/47/60/889104760.db2.gz YMPDYGQVMXOTTA-XMMPIXPASA-N 0 3 419.573 4.303 20 0 HIADHN COc1ccc(/C=C2\CCc3c2nc2ccccc2c3C(=O)N(C)CCN(C)C)cc1 ZINC000474253883 889108388 /nfs/dbraw/zinc/10/83/88/889108388.db2.gz UJZVXNYRQUQIIK-HTXNQAPBSA-N 0 3 415.537 4.364 20 0 HIADHN COc1ccc(C(=O)CCCCCC(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)cc1 ZINC000474259719 889118636 /nfs/dbraw/zinc/11/86/36/889118636.db2.gz QUHRKZLSSANERO-RCZVLFRGSA-N 0 3 408.542 4.390 20 0 HIADHN CC(C)n1c2ccccc2nc1[C@@H]1CCCN(Cc2cnc(-c3cnn(C)c3)nc2)C1 ZINC000474266780 889127575 /nfs/dbraw/zinc/12/75/75/889127575.db2.gz LKLLLZFYVRAXJK-LJQANCHMSA-N 0 3 415.545 4.187 20 0 HIADHN COc1cc(OC)c(NC(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)cc1Cl ZINC000474335266 889207098 /nfs/dbraw/zinc/20/70/98/889207098.db2.gz WEMOGPIQOSHBDS-MRXNPFEDSA-N 0 3 403.910 4.095 20 0 HIADHN CO[C@]1(C)CCCN(C(=O)N[C@H](CN2CCc3ccccc3C2)C(C)(C)C)CC1 ZINC000474361915 889240763 /nfs/dbraw/zinc/24/07/63/889240763.db2.gz GLQHHOJHZRLDRL-ZJSXRUAMSA-N 0 3 401.595 4.060 20 0 HIADHN C[C@@H](CS(=O)(=O)c1ccccc1)N[C@@H]1CCN(c2ccc(Cl)cc2Cl)C1 ZINC000474423078 889287401 /nfs/dbraw/zinc/28/74/01/889287401.db2.gz ZFPPBQSRCUIJCP-GOEBONIOSA-N 0 3 413.370 4.024 20 0 HIADHN Cc1cc(Oc2ncccn2)ccc1NC(=O)N[C@H](C)[C@H](c1ccccc1)N(C)C ZINC000474427371 889292476 /nfs/dbraw/zinc/29/24/76/889292476.db2.gz AJSIGEJADDEZKR-DYESRHJHSA-N 0 3 405.502 4.390 20 0 HIADHN C[C@H](NC(=O)Nc1nnc(Cc2cccc(F)c2)s1)[C@H](c1ccccc1)N(C)C ZINC000474434110 889300271 /nfs/dbraw/zinc/30/02/71/889300271.db2.gz XCIWQBKJGPMLKH-IFXJQAMLSA-N 0 3 413.522 4.081 20 0 HIADHN C[C@@H](N[C@@H](C)CCc1ccc(I)cc1)c1nnc2ccccn21 ZINC000474484058 889344695 /nfs/dbraw/zinc/34/46/95/889344695.db2.gz DXCZJUZBOAVTFQ-UONOGXRCSA-N 0 3 420.298 4.006 20 0 HIADHN C[C@@H](CCc1ccc(I)cc1)N[C@@H](C)c1nnc2ccccn21 ZINC000474484056 889344973 /nfs/dbraw/zinc/34/49/73/889344973.db2.gz DXCZJUZBOAVTFQ-KBPBESRZSA-N 0 3 420.298 4.006 20 0 HIADHN C[C@H](NC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1)c1noc(-c2ccccc2)n1 ZINC000474508326 889370858 /nfs/dbraw/zinc/37/08/58/889370858.db2.gz BZFNCIADMIOUNO-MOPGFXCFSA-N 0 3 419.529 4.104 20 0 HIADHN CN1CCN(CCCNC(=O)c2c(Cl)cccc2Cl)[C@H](c2ccccc2)C1 ZINC000474510129 889374019 /nfs/dbraw/zinc/37/40/19/889374019.db2.gz JOCODISXGRKCFK-IBGZPJMESA-N 0 3 406.357 4.102 20 0 HIADHN CSc1nc(-c2ccco2)nc(C)c1C(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000474555503 889432616 /nfs/dbraw/zinc/43/26/16/889432616.db2.gz YHVNBFFIVXNDKF-WMZOPIPTSA-N 0 3 422.554 4.332 20 0 HIADHN Cc1ccccc1-n1nccc1CN[C@@H](C)CC(=O)Nc1cccc(N2CCCC2)c1 ZINC000474598415 889466231 /nfs/dbraw/zinc/46/62/31/889466231.db2.gz PFFRWWLADOZSFY-FQEVSTJZSA-N 0 3 417.557 4.288 20 0 HIADHN Cc1ccccc1-n1nccc1CNCc1ccccc1CN1C[C@@H](C)O[C@H](C)C1 ZINC000474610879 889474809 /nfs/dbraw/zinc/47/48/09/889474809.db2.gz DOIGNAAHUOKSEA-NHCUHLMSSA-N 0 3 404.558 4.080 20 0 HIADHN CCc1noc(-c2ccc(C)c(NC(=O)N(C)[C@H]3CCN(Cc4ccccc4)C3)c2)n1 ZINC000474611912 889477089 /nfs/dbraw/zinc/47/70/89/889477089.db2.gz FEFKBESYIPFMJU-FQEVSTJZSA-N 0 3 419.529 4.346 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)c(C)c1 ZINC000474729375 889585010 /nfs/dbraw/zinc/58/50/10/889585010.db2.gz GJGHJUAXVREISJ-UGKGYDQZSA-N 0 3 422.573 4.262 20 0 HIADHN Cc1ccc(NC(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)c(OC[C@@H]2CCCO2)c1 ZINC000474740648 889596504 /nfs/dbraw/zinc/59/65/04/889596504.db2.gz ZHUPPQZRPTYJOZ-YADHBBJMSA-N 0 3 423.557 4.291 20 0 HIADHN CN(C(=O)Nc1cccc(C(=O)N2CCCCC2)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000474742074 889597526 /nfs/dbraw/zinc/59/75/26/889597526.db2.gz IFUSTPAWDOPIHO-HSZRJFAPSA-N 0 3 420.557 4.051 20 0 HIADHN Cc1ccc(Br)cc1NC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000474749119 889606804 /nfs/dbraw/zinc/60/68/04/889606804.db2.gz KOUQRVLLAIVCPI-SFHVURJKSA-N 0 3 402.336 4.496 20 0 HIADHN COc1cc(Cl)c(C)cc1NC(=O)CCNCc1ccnn1-c1ccc(F)cc1 ZINC000474797331 889650399 /nfs/dbraw/zinc/65/03/99/889650399.db2.gz ZAWQMJGEAMAMSU-UHFFFAOYSA-N 0 3 416.884 4.100 20 0 HIADHN Cc1ccc(-c2ccc(C(=O)NC(C)(C)CCN3CCN(C)CC3)c(F)c2)cc1C ZINC000474803632 889656879 /nfs/dbraw/zinc/65/68/79/889656879.db2.gz FJJWDYSLWCCHNF-UHFFFAOYSA-N 0 3 411.565 4.255 20 0 HIADHN CN1CCN(CCC(C)(C)NC(=O)CCCCc2ccc(Cl)c(Cl)c2)CC1 ZINC000474825384 889679446 /nfs/dbraw/zinc/67/94/46/889679446.db2.gz ZVYZPKJAGQOZFF-UHFFFAOYSA-N 0 3 414.421 4.239 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)c3c[nH]nc3-c3ccccc3Cl)c2)CC1 ZINC000474844150 889701481 /nfs/dbraw/zinc/70/14/81/889701481.db2.gz PFVXSTVBCGPQMP-UHFFFAOYSA-N 0 3 409.921 4.124 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)C[C@@H](C)c2cccc(C(F)(F)F)c2)CC1 ZINC000474871241 889724542 /nfs/dbraw/zinc/72/45/42/889724542.db2.gz FBHRQJOQTKRTDS-MRXNPFEDSA-N 0 3 400.485 4.205 20 0 HIADHN C[C@H]([NH2+][C@@H](c1nc(-c2nc[n-]n2)no1)C(C)(C)C)C1CCC(C(F)(F)F)CC1 ZINC000474882100 889737246 /nfs/dbraw/zinc/73/72/46/889737246.db2.gz KEHUCGVOLSGCPZ-WTIISPKJSA-N 0 3 400.449 4.289 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)C[C@H](C)c2ccc(C(F)(F)F)cc2)CC1 ZINC000474883090 889739185 /nfs/dbraw/zinc/73/91/85/889739185.db2.gz UQSSHTORTVDRAI-INIZCTEOSA-N 0 3 400.485 4.205 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)[C@@H](C)Oc2ccc(-c3ccccc3)cc2)CC1 ZINC000474889312 889746926 /nfs/dbraw/zinc/74/69/26/889746926.db2.gz GDZFIMHZLUPYGX-HXUWFJFHSA-N 0 3 410.558 4.127 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)[C@H](C)Cc2ccc(Cl)cc2Cl)CC1 ZINC000474890872 889748895 /nfs/dbraw/zinc/74/88/95/889748895.db2.gz BNTRMLWVEBQAJY-OAHLLOKOSA-N 0 3 401.378 4.178 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)C2(Cc3cccc(Cl)c3)CCCC2)CC1 ZINC000474899182 889759084 /nfs/dbraw/zinc/75/90/84/889759084.db2.gz ZETJIKRKQGRGLK-UHFFFAOYSA-N 0 3 406.998 4.449 20 0 HIADHN CCN(C(=O)Nc1ccc(C(C)(C)C(=O)OC)cc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000474996396 889847880 /nfs/dbraw/zinc/84/78/80/889847880.db2.gz CGFUOJMSGVMLSW-JOCHJYFZSA-N 0 3 423.557 4.266 20 0 HIADHN CCN(C(=O)N[C@H](c1ccccc1)c1ccccn1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475008476 889861974 /nfs/dbraw/zinc/86/19/74/889861974.db2.gz NZWRJDSOUIRZNS-ILBGXUMGSA-N 0 3 414.553 4.477 20 0 HIADHN CCN(C(=O)N[C@H](c1ccccc1)c1ccccn1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475008478 889862223 /nfs/dbraw/zinc/86/22/23/889862223.db2.gz NZWRJDSOUIRZNS-UKILVPOCSA-N 0 3 414.553 4.477 20 0 HIADHN CC(C)[C@H](NC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1)c1nc2ccccc2[nH]1 ZINC000475012268 889864981 /nfs/dbraw/zinc/86/49/81/889864981.db2.gz GMIUTQFYCFUARZ-KNQAVFIVSA-N 0 3 405.546 4.176 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)Nc2ccc(Br)cc2Cl)CC1 ZINC000475022665 889875429 /nfs/dbraw/zinc/87/54/29/889875429.db2.gz KHHLDDGBQCBFBT-UHFFFAOYSA-N 0 3 418.763 4.113 20 0 HIADHN Cc1cc(F)ccc1-c1ccc(CN(C)C[C@@H]2C[C@H](F)CN2Cc2ncccn2)o1 ZINC000475080694 889925680 /nfs/dbraw/zinc/92/56/80/889925680.db2.gz FKKRPOVUXXNBCA-OALUTQOASA-N 0 3 412.484 4.229 20 0 HIADHN Cc1nnc(N2C[C@@H](F)C[C@H]2CN(C)Cc2cc(Cl)cc(C(F)(F)F)c2)o1 ZINC000475085572 889932968 /nfs/dbraw/zinc/93/29/68/889932968.db2.gz OKHWXANGAYKBCN-GJZGRUSLSA-N 0 3 406.811 4.099 20 0 HIADHN Cc1cc(CN(C)C[C@@H]2C[C@H](F)CN2Cc2nccs2)sc1Br ZINC000475089981 889937609 /nfs/dbraw/zinc/93/76/09/889937609.db2.gz LXPZFCCFXLESFJ-STQMWFEESA-N 0 3 418.401 4.320 20 0 HIADHN Cc1ccc(-c2nc(CCNC(=O)N(C)[C@@H]3CCN(Cc4ccccc4)C3)co2)cc1 ZINC000475102025 889949061 /nfs/dbraw/zinc/94/90/61/889949061.db2.gz FZDSJKHRXNGFBY-HSZRJFAPSA-N 0 3 418.541 4.108 20 0 HIADHN Cc1nc(-c2ccc(CNC(=O)N(C)[C@@H]3CCN(Cc4ccccc4)C3)o2)cs1 ZINC000475112240 889963073 /nfs/dbraw/zinc/96/30/73/889963073.db2.gz RZHUUTHIMAVFKV-GOSISDBHSA-N 0 3 410.543 4.127 20 0 HIADHN C[C@@H](NC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1)c1ccccc1OC(F)F ZINC000475146381 890013672 /nfs/dbraw/zinc/01/36/72/890013672.db2.gz OBXUEXFUACJHSJ-SJLPKXTDSA-N 0 3 403.473 4.265 20 0 HIADHN CCc1cnc(CN(C)C(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)s1 ZINC000475148089 890015814 /nfs/dbraw/zinc/01/58/14/890015814.db2.gz XKFSXUJJLIYQQO-QGZVFWFLSA-N 0 3 406.621 4.382 20 0 HIADHN CCN(C(=O)N[C@H](C)c1cn(C(C)(C)C)nc1C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475166901 890032957 /nfs/dbraw/zinc/03/29/57/890032957.db2.gz XZYJHKUHQDVXNB-WIYYLYMNSA-N 0 3 411.594 4.314 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Cc1ccc2n[nH]cc2c1)c1ccc(C(F)(F)F)cc1 ZINC000475184013 890054379 /nfs/dbraw/zinc/05/43/79/890054379.db2.gz SCGLOHQVVCCSEH-HXUWFJFHSA-N 0 3 418.463 4.324 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)NC(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000475278517 890175798 /nfs/dbraw/zinc/17/57/98/890175798.db2.gz HNHJSIPGVWYPMW-NTKDMRAZSA-N 0 3 417.557 4.158 20 0 HIADHN Cc1ccc(-c2nc(CNC(=O)N(C)[C@H]3CCN(Cc4ccccc4)C3)co2)cc1 ZINC000475281904 890180005 /nfs/dbraw/zinc/18/00/05/890180005.db2.gz QLRZTDZYWACQAU-QFIPXVFZSA-N 0 3 404.514 4.066 20 0 HIADHN CCC1(c2ccc(Cl)cc2)CCN(Cc2c(C)nn(C)c2N2CCOCC2)CC1 ZINC000475294986 890202189 /nfs/dbraw/zinc/20/21/89/890202189.db2.gz ZICPXADWKSWUOY-UHFFFAOYSA-N 0 3 416.997 4.162 20 0 HIADHN Cc1cccc(-c2nc(CC(=O)N(C)[C@H]3CCN(Cc4ccccc4)C3)cs2)c1 ZINC000475306084 890216464 /nfs/dbraw/zinc/21/64/64/890216464.db2.gz QORNZUCHRJTEQF-QFIPXVFZSA-N 0 3 405.567 4.394 20 0 HIADHN CN(C(=O)CCc1nc(-c2ccc(Cl)cc2)no1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475307560 890219360 /nfs/dbraw/zinc/21/93/60/890219360.db2.gz DKKRRDYHTYZTSK-FQEVSTJZSA-N 0 3 424.932 4.056 20 0 HIADHN CN(C(=O)C1(c2ccc(Cl)cc2)CCOCC1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475322060 890241276 /nfs/dbraw/zinc/24/12/76/890241276.db2.gz YXMXGIYOWLUHAV-QFIPXVFZSA-N 0 3 412.961 4.121 20 0 HIADHN CC(C)c1nn(-c2ccc(Br)cc2)cc1CNCc1ncccc1O ZINC000475359684 890285667 /nfs/dbraw/zinc/28/56/67/890285667.db2.gz XKJNQTPBPGISOA-UHFFFAOYSA-N 0 3 401.308 4.149 20 0 HIADHN C[C@@H](Cc1ccc(C(F)(F)F)cc1)N[C@H](C(N)=O)c1cccc(Br)c1 ZINC000475434650 890354093 /nfs/dbraw/zinc/35/40/93/890354093.db2.gz OWASKXVUYJPBEY-ZBEGNZNMSA-N 0 3 415.253 4.215 20 0 HIADHN C[C@@H](N[C@H](C(N)=O)c1cccc(Br)c1)C1CCC(C(F)(F)F)CC1 ZINC000475442472 890360214 /nfs/dbraw/zinc/36/02/14/890360214.db2.gz QQFUQROAAIBOJR-FIOSSMJISA-N 0 3 407.274 4.322 20 0 HIADHN Fc1ccc2c(c1)[C@@H](NCc1ccc(OCCN3CCOCC3)c(Cl)c1)CCC2 ZINC000475485317 890391665 /nfs/dbraw/zinc/39/16/65/890391665.db2.gz GWOPFSOZNNIIAU-QFIPXVFZSA-N 0 3 418.940 4.357 20 0 HIADHN CCCN1CCN(c2ccccc2CNc2cccc(-n3cc(C)[nH]c3=O)c2)CC1 ZINC000475509025 890426514 /nfs/dbraw/zinc/42/65/14/890426514.db2.gz BRINSLLJUNTVLL-UHFFFAOYSA-N 0 3 405.546 4.030 20 0 HIADHN COc1cccc([C@H](CNC(=O)N[C@@H](C)c2cc(F)ccc2OC)N2CCCC2)c1 ZINC000504716643 913451504 /nfs/dbraw/zinc/45/15/04/913451504.db2.gz NSDOYNQUTFWYBD-KKSFZXQISA-N 0 3 415.509 4.040 20 0 HIADHN Cc1nc(CN(C)[C@H]2CCCN(Cc3cc(C)c(C)cc3OC(F)F)CC2)no1 ZINC000475618881 890552113 /nfs/dbraw/zinc/55/21/13/890552113.db2.gz BQGXMZFXWBBPIG-SFHVURJKSA-N 0 3 408.493 4.083 20 0 HIADHN CC1CCN([C@@H](CNC(=O)Nc2ccc([S@@](C)=O)cc2)c2cccs2)CC1 ZINC000475626029 890563704 /nfs/dbraw/zinc/56/37/04/890563704.db2.gz PSIAOKMTANIJTM-XRHLQHRESA-N 0 3 405.589 4.080 20 0 HIADHN Cc1ccc(-n2cccn2)cc1NC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC000475637201 890578048 /nfs/dbraw/zinc/57/80/48/890578048.db2.gz XUQPRFLZAACGAF-HXUWFJFHSA-N 0 3 403.530 4.309 20 0 HIADHN C[C@@H](CC(=O)Nc1ccccc1)N[C@@H](CO)c1ccc(Cl)cc1C(F)(F)F ZINC000475638462 890579487 /nfs/dbraw/zinc/57/94/87/890579487.db2.gz PECYSAVIIMIIPJ-SJCJKPOMSA-N 0 3 400.828 4.399 20 0 HIADHN COc1ccc([C@@H](CNC(=O)Nc2cc(-n3cccn3)ccc2C)N2CCCC2)cc1 ZINC000475639592 890580620 /nfs/dbraw/zinc/58/06/20/890580620.db2.gz BYRLYDWWXSIWDM-HSZRJFAPSA-N 0 3 419.529 4.148 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)Nc2cc(Cl)ccc2N2CCCCC2)CC1 ZINC000475648080 890591065 /nfs/dbraw/zinc/59/10/65/890591065.db2.gz FZYNCIOSCKCPJP-UHFFFAOYSA-N 0 3 423.001 4.341 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)Nc2ccc(Oc3ccc(F)cc3)nc2)CC1 ZINC000475659817 890606441 /nfs/dbraw/zinc/60/64/41/890606441.db2.gz GVAHNYYUUDKWPM-UHFFFAOYSA-N 0 3 416.497 4.024 20 0 HIADHN COc1ccc(CN(C)C(=O)CNC(C)(C)c2ccc(OC(F)(F)F)cc2)cc1 ZINC000475697625 890636747 /nfs/dbraw/zinc/63/67/47/890636747.db2.gz HDEYQGSGMUTIJC-UHFFFAOYSA-N 0 3 410.436 4.077 20 0 HIADHN CC(C)(CNC(=O)Nc1cccc(OC[C@@H]2CCCO2)c1)N1CCc2ccccc2C1 ZINC000504736457 913472599 /nfs/dbraw/zinc/47/25/99/913472599.db2.gz CPWFVFIGKDJZRV-QHCPKHFHSA-N 0 3 423.557 4.203 20 0 HIADHN CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)N[C@H]1C[C@H](c2ccc(Cl)cc2)C1 ZINC000475707842 890646940 /nfs/dbraw/zinc/64/69/40/890646940.db2.gz VLHMGUQXXBKIRV-LGGPRVQUSA-N 0 3 412.965 4.315 20 0 HIADHN CCc1nnc(-c2ccc(NC(=O)N(CCN(C)C)Cc3cccc(C)c3)cc2)o1 ZINC000475715046 890653451 /nfs/dbraw/zinc/65/34/51/890653451.db2.gz KVCDWAGXKBJJOI-UHFFFAOYSA-N 0 3 407.518 4.203 20 0 HIADHN C[C@@H]1C[C@H](C)[C@@H](C)N(CC(=O)N(Cc2nnc(-c3ccccc3Cl)o2)C2CC2)C1 ZINC000475732793 890672342 /nfs/dbraw/zinc/67/23/42/890672342.db2.gz RNNXOBWUCHGMIZ-OWCLPIDISA-N 0 3 416.953 4.247 20 0 HIADHN C[C@H](c1ccc([S@](C)=O)cc1)N(C)CCC(=O)Nc1ccc(Br)cc1 ZINC000475745517 890689560 /nfs/dbraw/zinc/68/95/60/890689560.db2.gz DMQHGNPYHYHQTQ-PWECECGKSA-N 0 3 423.376 4.208 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)NCc2ccccc2Oc2ccccc2)CC1 ZINC000475888791 890822257 /nfs/dbraw/zinc/82/22/57/890822257.db2.gz QCVSNNLWBBTFNP-UHFFFAOYSA-N 0 3 411.546 4.168 20 0 HIADHN Cn1cc(C(=O)NC[C@@H]2CCCN2Cc2ccccc2)c(-c2ccc(Cl)s2)n1 ZINC000475941270 890864991 /nfs/dbraw/zinc/86/49/91/890864991.db2.gz UEYRHSOSBMHKAP-INIZCTEOSA-N 0 3 414.962 4.196 20 0 HIADHN CSc1ccc(NC(=O)N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)cc1Cl ZINC000475971133 890889200 /nfs/dbraw/zinc/88/92/00/890889200.db2.gz ZRWOWDKFQZCEDB-GASCZTMLSA-N 0 3 411.999 4.415 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N[C@@H](Cc2ccccc2)c2ccccc2)CC1 ZINC000475985036 890900723 /nfs/dbraw/zinc/90/07/23/890900723.db2.gz ALDADQLQUUEOAH-DEOSSOPVSA-N 0 3 409.574 4.159 20 0 HIADHN CC[C@@H](NC(=O)N[C@H](CN1CCc2ccccc2C1)C(C)(C)C)c1nccs1 ZINC000476037220 890968484 /nfs/dbraw/zinc/96/84/84/890968484.db2.gz YXGQWBYRJMOVLT-RTBURBONSA-N 0 3 400.592 4.366 20 0 HIADHN CC(C)(CNC(=O)Nc1ccccc1Br)N1CCc2ccccc2C1 ZINC000504785507 913512469 /nfs/dbraw/zinc/51/24/69/913512469.db2.gz JWQAXBHMSQKFMJ-UHFFFAOYSA-N 0 3 402.336 4.408 20 0 HIADHN CSc1cnn(-c2ccccc2)c1NC(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C ZINC000476131224 891053187 /nfs/dbraw/zinc/05/31/87/891053187.db2.gz CYTRKRMLKRFINL-OXJNMPFZSA-N 0 3 409.559 4.407 20 0 HIADHN Cc1ccc(Cn2cccc(NC(=O)N[C@H](C)[C@H](c3ccccc3)N(C)C)c2=O)cc1 ZINC000476140123 891062399 /nfs/dbraw/zinc/06/23/99/891062399.db2.gz IIEYZQIBKKRYSE-AUSIDOKSSA-N 0 3 418.541 4.018 20 0 HIADHN CCCN(CCN1CCCC1)C(=O)Nc1nc(SCc2ccccc2)ns1 ZINC000476142018 891063626 /nfs/dbraw/zinc/06/36/26/891063626.db2.gz HVAOPLGGMLGCSW-UHFFFAOYSA-N 0 3 405.593 4.170 20 0 HIADHN CN(C(=O)N[C@@H](c1ccc(Br)cc1)C1CCC1)[C@H]1CCN(C2CC2)C1 ZINC000476154426 891079274 /nfs/dbraw/zinc/07/92/74/891079274.db2.gz MZDKWPMHHQLWCG-RBUKOAKNSA-N 0 3 406.368 4.168 20 0 HIADHN CCNc1ccc(Cl)cc1C(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000476245110 891168851 /nfs/dbraw/zinc/16/88/51/891168851.db2.gz FCAAOHJHMOGTDE-CALCHBBNSA-N 0 3 407.986 4.123 20 0 HIADHN COc1ccc(C(=O)Nc2cc(C)cc(CN(C)C)c2)c(OCCOC(C)C)c1 ZINC000476308435 891219721 /nfs/dbraw/zinc/21/97/21/891219721.db2.gz JNBAHBVQOSVZEB-UHFFFAOYSA-N 0 3 400.519 4.121 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1cc2[nH]ccc2s1 ZINC000476414542 891327389 /nfs/dbraw/zinc/32/73/89/891327389.db2.gz XJVKJHQGMAMEPZ-KRWDZBQOSA-N 0 3 405.527 4.434 20 0 HIADHN COCCN1CCC[C@H]1CNC(=O)N[C@@H](c1cccs1)c1ccc(C(C)C)cc1 ZINC000476414712 891327584 /nfs/dbraw/zinc/32/75/84/891327584.db2.gz YPYKFPCPGKLIRT-RBBKRZOGSA-N 0 3 415.603 4.371 20 0 HIADHN Cc1ccc([C@H]2[C@@H](C)CCCN2C(=O)NC2CCN(CCOC(C)C)CC2)cc1 ZINC000476455772 891368439 /nfs/dbraw/zinc/36/84/39/891368439.db2.gz XRHSFQJZZOCSOB-NZQKXSOJSA-N 0 3 401.595 4.367 20 0 HIADHN C[C@@H]1CC[C@H](C)N1CC(=O)N[C@H](Cc1ccccn1)c1ccc(Br)cc1 ZINC000476538115 891449551 /nfs/dbraw/zinc/44/95/51/891449551.db2.gz GVHARADHTATJPK-GQIGUUNPSA-N 0 3 416.363 4.117 20 0 HIADHN C[C@H]1CCC[C@H](C)N1CCNC(=O)c1cn(C2CC2)c2cc(Cl)c(F)cc2c1=O ZINC000476540767 891454650 /nfs/dbraw/zinc/45/46/50/891454650.db2.gz FZYFZWKKHFSOAM-KBPBESRZSA-N 0 3 419.928 4.122 20 0 HIADHN CCC[C@@H]1CN(C(=O)[C@@H]2CCc3nc(C(C)C)[nH]c3C2)CCN1Cc1ccccc1 ZINC000476589501 891521549 /nfs/dbraw/zinc/52/15/49/891521549.db2.gz SBRQADXZPHIBNZ-NHCUHLMSSA-N 0 3 408.590 4.151 20 0 HIADHN CCC[C@@H]1CN(C(=O)[C@@H]2CCc3[nH]c(C(C)C)nc3C2)CCN1Cc1ccccc1 ZINC000476589501 891521572 /nfs/dbraw/zinc/52/15/72/891521572.db2.gz SBRQADXZPHIBNZ-NHCUHLMSSA-N 0 3 408.590 4.151 20 0 HIADHN CN(C(=O)NC[C@@H](c1c[nH]c2ccccc21)c1ccccc1)[C@@H]1CCN(C2CC2)C1 ZINC000476654284 891597981 /nfs/dbraw/zinc/59/79/81/891597981.db2.gz LCCUEKSIVLDFKB-IFMALSPDSA-N 0 3 402.542 4.178 20 0 HIADHN CN(C(=O)NC[C@H](c1c[nH]c2ccccc21)c1ccccc1)[C@H]1CCN(C2CC2)C1 ZINC000476654287 891598328 /nfs/dbraw/zinc/59/83/28/891598328.db2.gz LCCUEKSIVLDFKB-UNMCSNQZSA-N 0 3 402.542 4.178 20 0 HIADHN CCc1onc(-c2ccccc2Cl)c1C(=O)N1C[C@@H](N2CCCC2)[C@@H](SC)C1 ZINC000476670026 891617149 /nfs/dbraw/zinc/61/71/49/891617149.db2.gz AESPGQGLFBWCQA-AEFFLSMTSA-N 0 3 419.978 4.209 20 0 HIADHN Cc1cc(Br)ccc1CNC(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000476684851 891635765 /nfs/dbraw/zinc/63/57/65/891635765.db2.gz YKMVKOVPVXUTQV-QGZVFWFLSA-N 0 3 422.392 4.455 20 0 HIADHN CCN(Cc1ccc(OC)cc1OC)C(=O)NC[C@H](c1ccccc1)N1CCCC1 ZINC000476820426 891805360 /nfs/dbraw/zinc/80/53/60/891805360.db2.gz HCLGAEIXLRNVDS-JOCHJYFZSA-N 0 3 411.546 4.072 20 0 HIADHN O=C(Nc1ccc(OC[C@@H]2CCCO2)cc1)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000504877514 913605435 /nfs/dbraw/zinc/60/54/35/913605435.db2.gz UVSRVHPLTCHFSZ-GMAHTHKFSA-N 0 3 409.530 4.031 20 0 HIADHN COc1cc(OC)c(NC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)cc1Cl ZINC000504880623 913609327 /nfs/dbraw/zinc/60/93/27/913609327.db2.gz CRMAREZHKQEZRL-INIZCTEOSA-N 0 3 403.910 4.143 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)Nc1cccc(-c2noc(C3CC3)n2)c1)c1ccco1 ZINC000477031480 891957051 /nfs/dbraw/zinc/95/70/51/891957051.db2.gz GAJSFQLZEWDJDC-RDTXWAMCSA-N 0 3 409.490 4.458 20 0 HIADHN O=C(CN1CCC[C@@]2(CCCOC2)C1)N1Cc2ccccc2[C@H](c2ccccc2)C1 ZINC000477049639 891978162 /nfs/dbraw/zinc/97/81/62/891978162.db2.gz OUUALPNTMNGWEX-AZGAKELHSA-N 0 3 404.554 4.053 20 0 HIADHN COc1cccc(Cl)c1-c1noc(C)c1C(=O)NC[C@@H]1N(C)CCCC1(C)C ZINC000477153608 892077351 /nfs/dbraw/zinc/07/73/51/892077351.db2.gz USTBBNSHMJBWLR-INIZCTEOSA-N 0 3 405.926 4.162 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1ccccc1-c1nncn1C(C)C)c1ccco1 ZINC000477184787 892107203 /nfs/dbraw/zinc/10/72/03/892107203.db2.gz CYPBMUDWDHNUIN-QFBILLFUSA-N 0 3 410.522 4.370 20 0 HIADHN C[C@H](C(=O)N(C)Cc1ccc(Br)cc1)N1CC[C@@H](c2ccccc2)C1 ZINC000477242228 892191520 /nfs/dbraw/zinc/19/15/20/892191520.db2.gz HELZMCPRBACXOW-VQIMIIECSA-N 0 3 401.348 4.286 20 0 HIADHN Cc1nc([C@H](C)N2CCC[C@@H](CN3CCOCC3)C2)oc1-c1ccc(Cl)cc1 ZINC000477290798 892250373 /nfs/dbraw/zinc/25/03/73/892250373.db2.gz JEQWIIRLGVFYMW-ROUUACIJSA-N 0 3 403.954 4.409 20 0 HIADHN COc1ccc([C@H](N[C@H](C)C(=O)N[C@H](C)c2cc(OC)ccc2OC)C2CC2)cc1 ZINC000477326737 892292724 /nfs/dbraw/zinc/29/27/24/892292724.db2.gz WHBBAICGRFRELY-CKNGIIGNSA-N 0 3 412.530 4.019 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3CCC[C@@H](Nc4ccccc4)C3)c(C)c2)CC1 ZINC000477333924 892301789 /nfs/dbraw/zinc/30/17/89/892301789.db2.gz UVVMFZLJSITFRV-JOCHJYFZSA-N 0 3 421.589 4.245 20 0 HIADHN C[C@H](NC(=O)N(C)[C@@H]1CCN(C2CC2)C1)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000477445372 892396932 /nfs/dbraw/zinc/39/69/32/892396932.db2.gz PMQBTAUZLFCKBX-HTAPYJJXSA-N 0 3 411.521 4.344 20 0 HIADHN C/C=C\c1ccc(OC[C@H](O)CN2CCC[C@H]2c2ccc3c(c2)OCO3)c(OC)c1 ZINC000477465036 892435890 /nfs/dbraw/zinc/43/58/90/892435890.db2.gz PFSCEEKDIWADTJ-NGVGMHDOSA-N 0 3 411.498 4.034 20 0 HIADHN CCO[C@@H]1C[C@H](N[C@H](C)c2c(C)nn(CC(F)(F)F)c2C)[C@@H]1Oc1ccccc1 ZINC000477489303 892487070 /nfs/dbraw/zinc/48/70/70/892487070.db2.gz BIPJLFBPISYFGX-DDDRJPGCSA-N 0 3 411.468 4.338 20 0 HIADHN COc1ccc(CN(C)CCC(=O)NC(c2ccccc2)c2ccccc2)c(OC)c1 ZINC000477544276 892585795 /nfs/dbraw/zinc/58/57/95/892585795.db2.gz VINOKIQUUJAKQU-UHFFFAOYSA-N 0 3 418.537 4.432 20 0 HIADHN COCCN(CCN(C)C)C(=O)N[C@H](c1ccccc1)c1cccc2ccccc21 ZINC000477585450 892655103 /nfs/dbraw/zinc/65/51/03/892655103.db2.gz HXWJRKHEXHRGTB-XMMPIXPASA-N 0 3 405.542 4.149 20 0 HIADHN Cc1ccc(Br)cc1NC(=O)NCC1(N2CCSCC2)CCCC1 ZINC000504960401 913697605 /nfs/dbraw/zinc/69/76/05/913697605.db2.gz XLBMOZNQQFYLOY-UHFFFAOYSA-N 0 3 412.397 4.241 20 0 HIADHN O=c1cc(CNC2(c3cccc(Br)c3)CCCCC2)nc2ccccn12 ZINC000477656379 892785398 /nfs/dbraw/zinc/78/53/98/892785398.db2.gz AKLQCVXKPTZARU-UHFFFAOYSA-N 0 3 412.331 4.406 20 0 HIADHN O=C(CCCOc1ccc(Cl)cc1)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000477726700 892828522 /nfs/dbraw/zinc/82/85/22/892828522.db2.gz TYRQRVBXIBJLMS-UHFFFAOYSA-N 0 3 416.949 4.342 20 0 HIADHN CCc1ccc([C@H](C)NC(=O)[C@@H](C)N2CC[C@@H](CN(CC)CC(F)(F)F)C2)cc1 ZINC000477729575 892830162 /nfs/dbraw/zinc/83/01/62/892830162.db2.gz YZWPKOZOEMGZRB-SCTDSRPQSA-N 0 3 413.528 4.021 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1ccc(-n2cccc2)c(F)c1 ZINC000477735568 892833668 /nfs/dbraw/zinc/83/36/68/892833668.db2.gz ATFOKVXJHUSNSM-UHFFFAOYSA-N 0 3 407.489 4.073 20 0 HIADHN CCN(C[C@@H]1CCN(CC(=O)N(Cc2ccccc2)C(C)(C)C)C1)CC(F)(F)F ZINC000477759218 892849295 /nfs/dbraw/zinc/84/92/95/892849295.db2.gz FIFUKWMMBLYKAW-IBGZPJMESA-N 0 3 413.528 4.020 20 0 HIADHN Cc1nc(CCNC(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)sc1C ZINC000477814578 892884054 /nfs/dbraw/zinc/88/40/54/892884054.db2.gz AAKWXMZJKZYTFE-QGZVFWFLSA-N 0 3 406.621 4.136 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCc1nc(C(C)C)cs1)c1cccc(OC)c1 ZINC000477819869 892887440 /nfs/dbraw/zinc/88/74/40/892887440.db2.gz JTRDQKSXLUGAAN-IBGZPJMESA-N 0 3 404.580 4.157 20 0 HIADHN C[C@@H](NC(=O)N[C@H](CN(C)C)c1ccc(F)cc1)c1nc2ccccc2n1C(F)F ZINC000477849535 892907395 /nfs/dbraw/zinc/90/73/95/892907395.db2.gz TXFVDZGOGBMCSW-CXAGYDPISA-N 0 3 419.451 4.234 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)N[C@H](C)CCc2ccc(O)cc2)N(C)C)cc1 ZINC000477903484 892974902 /nfs/dbraw/zinc/97/49/02/892974902.db2.gz CGSXGTFDEIYAOC-WZONZLPQSA-N 0 3 413.562 4.103 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)Nc1ccc(OCC(F)(F)F)cc1 ZINC000504977149 913719594 /nfs/dbraw/zinc/71/95/94/913719594.db2.gz NELDCNNEYABXGT-UHFFFAOYSA-N 0 3 417.497 4.111 20 0 HIADHN CCOC[C@@H]1CCN(C(=O)NC[C@@H](c2ccc(C(F)(F)F)cc2)N(CC)CC)C1 ZINC000477922651 893009707 /nfs/dbraw/zinc/00/97/07/893009707.db2.gz ZKOAFJQZXSPYSC-APWZRJJASA-N 0 3 415.500 4.156 20 0 HIADHN C[C@H](NCc1ccc(S(=O)(=O)CCO)cc1)c1ccc(-c2ccc(F)cc2)s1 ZINC000477929032 893017233 /nfs/dbraw/zinc/01/72/33/893017233.db2.gz QIQALZXMLCNMRT-HNNXBMFYSA-N 0 3 419.543 4.171 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)c1ccc(-c2cncnc2)cc1F ZINC000477929470 893018472 /nfs/dbraw/zinc/01/84/72/893018472.db2.gz XGGXPCWQPHHGKY-QHCPKHFHSA-N 0 3 406.505 4.169 20 0 HIADHN Cc1ccc([C@H](Cc2ccccc2)NCc2ccc(S(=O)(=O)CCO)cc2)cc1C ZINC000477951994 893042598 /nfs/dbraw/zinc/04/25/98/893042598.db2.gz XZNCQTVDBSEZRN-VWLOTQADSA-N 0 3 423.578 4.143 20 0 HIADHN CCCN(C(=O)CCc1nc(-c2ccco2)no1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000504984126 913728094 /nfs/dbraw/zinc/72/80/94/913728094.db2.gz YWWMHADPJRLWLL-FQEVSTJZSA-N 0 3 422.529 4.165 20 0 HIADHN CC[C@H](C)n1ncc(C(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)c1C ZINC000478333468 893568003 /nfs/dbraw/zinc/56/80/03/893568003.db2.gz DWRBGSFSLMEOMF-RXVVDRJESA-N 0 3 420.561 4.367 20 0 HIADHN COc1cnccc1N1CCN(C(=O)CCCc2ccc(Cl)c(Cl)c2)CC1 ZINC000478440723 893745474 /nfs/dbraw/zinc/74/54/74/893745474.db2.gz AGBBABOOGLIAKR-UHFFFAOYSA-N 0 3 408.329 4.069 20 0 HIADHN CCc1c(C(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)cnn1C(CC)CC ZINC000478477341 893802603 /nfs/dbraw/zinc/80/26/03/893802603.db2.gz FIHSGUOBCTTYMX-OALUTQOASA-N 0 3 418.626 4.158 20 0 HIADHN CC(C)[C@H](C(=O)N[C@H](C)c1nc(-c2ccc(Br)cc2)cs1)N(C)C ZINC000478503068 893816952 /nfs/dbraw/zinc/81/69/52/893816952.db2.gz DQCGXWJGZANFMX-MLGOLLRUSA-N 0 3 410.381 4.336 20 0 HIADHN O=C(NCCc1cccc(OCC(F)(F)F)c1)c1cccc(CN2CCCC2)c1 ZINC000478516083 893823805 /nfs/dbraw/zinc/82/38/05/893823805.db2.gz NIAYEGMOPOIIGV-UHFFFAOYSA-N 0 3 406.448 4.196 20 0 HIADHN C[C@@H](Cc1ccc(C(F)(F)F)cc1)NC(=O)N(CCN(C)C)Cc1ccccc1 ZINC000478632658 893886578 /nfs/dbraw/zinc/88/65/78/893886578.db2.gz QNIHYSOESHMBOP-KRWDZBQOSA-N 0 3 407.480 4.410 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2ccc(Br)cc2C)c1 ZINC000478788008 894063529 /nfs/dbraw/zinc/06/35/29/894063529.db2.gz LTNIKWAHUDFUEC-UHFFFAOYSA-N 0 3 420.351 4.362 20 0 HIADHN CC1CCN([C@H](CNC(=O)c2cccc(Nc3cnn(C)c3)c2)c2cccs2)CC1 ZINC000478790202 894067340 /nfs/dbraw/zinc/06/73/40/894067340.db2.gz VFMGVOVJDZZCBM-OAQYLSRUSA-N 0 3 423.586 4.428 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)c1ccccc1NCc1cccnc1 ZINC000478797527 894071859 /nfs/dbraw/zinc/07/18/59/894071859.db2.gz MJQPFAKDVVZUAN-XMMPIXPASA-N 0 3 400.526 4.261 20 0 HIADHN COc1ccccc1C[C@@H]1CCCN1C(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000478920019 894201658 /nfs/dbraw/zinc/20/16/58/894201658.db2.gz CCIACOQRBHUOPQ-GGAORHGYSA-N 0 3 410.533 4.280 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1cccc2c1CN(c1ccccn1)C2)c1ccco1 ZINC000479019446 894286109 /nfs/dbraw/zinc/28/61/09/894286109.db2.gz PYFKWNDXAUAZSF-UWJYYQICSA-N 0 3 419.529 4.446 20 0 HIADHN Cc1ccccc1C[C@@H](C)N[C@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479064327 894326031 /nfs/dbraw/zinc/32/60/31/894326031.db2.gz QHOPHQDHSIXXBP-CHWSQXEVSA-N 0 3 401.359 4.231 20 0 HIADHN Cc1ccccc1C1(CN[C@H](C)c2cc(S(N)(=O)=O)c(Cl)cc2Cl)CC1 ZINC000479064685 894327325 /nfs/dbraw/zinc/32/73/25/894327325.db2.gz HNOVIEXGUWELPF-CYBMUJFWSA-N 0 3 413.370 4.332 20 0 HIADHN C[C@H](NCC(C)(C)c1ccccc1F)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479065826 894328088 /nfs/dbraw/zinc/32/80/88/894328088.db2.gz SNUWPGCZTUIXLV-NSHDSACASA-N 0 3 419.349 4.408 20 0 HIADHN O=C([C@H]1CCCN(Cc2cccc(F)c2)C1)N1CCC(N2CCc3ccccc32)CC1 ZINC000505168692 913858566 /nfs/dbraw/zinc/85/85/66/913858566.db2.gz ZNYDFRMUSVIVFR-QFIPXVFZSA-N 0 3 421.560 4.091 20 0 HIADHN Cc1ccc(CC[C@@H](C)N[C@H](C)c2cc(S(N)(=O)=O)c(Cl)cc2Cl)o1 ZINC000479074325 894340338 /nfs/dbraw/zinc/34/03/38/894340338.db2.gz ZZSVEAACMZTRIS-ZYHUDNBSSA-N 0 3 405.347 4.214 20 0 HIADHN C[C@@H](NCC(C)(C)c1cccs1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479076476 894341614 /nfs/dbraw/zinc/34/16/14/894341614.db2.gz FCDIMKPUWAQEAU-SNVBAGLBSA-N 0 3 407.388 4.331 20 0 HIADHN C[C@H](NC(=O)Nc1cccc2c1CN(c1nccs1)C2)[C@H](c1ccccc1)N(C)C ZINC000479082258 894346872 /nfs/dbraw/zinc/34/68/72/894346872.db2.gz ASMSWDJUWMCICP-HRAATJIYSA-N 0 3 421.570 4.476 20 0 HIADHN CC[C@H](C)NC(=O)[C@@H]1C[C@H](C)N(CC(=O)N[C@H](C)c2cccs2)[C@H]2CCCC[C@@H]12 ZINC000479111038 894378770 /nfs/dbraw/zinc/37/87/70/894378770.db2.gz VLPYRQJLEDTQRE-GXUNQHPWSA-N 0 3 419.635 4.109 20 0 HIADHN CCCN1CCC[C@@H]1C(=O)Nc1cccc(CNC(=O)Nc2ccccc2Cl)c1 ZINC000479200736 894466086 /nfs/dbraw/zinc/46/60/86/894466086.db2.gz WAHXRBIZPCGJFQ-HXUWFJFHSA-N 0 3 414.937 4.475 20 0 HIADHN O=S(=O)(c1ccc(CN[C@H]2CCc3ccc(Cl)cc32)cc1)N1CCCCC1 ZINC000479255045 894521265 /nfs/dbraw/zinc/52/12/65/894521265.db2.gz NGVHFCVEJXIXSZ-NRFANRHFSA-N 0 3 404.963 4.292 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)N[C@H]1CCN(c2ccc(F)c(Cl)c2)C1 ZINC000479307679 894593077 /nfs/dbraw/zinc/59/30/77/894593077.db2.gz GNSMIZXLRYEOPM-AWEZNQCLSA-N 0 3 415.896 4.296 20 0 HIADHN CC[C@H](NC(=O)N(CCN(C)C)Cc1cccc(OC)c1)c1cc(F)ccc1F ZINC000479314230 894600993 /nfs/dbraw/zinc/60/09/93/894600993.db2.gz LHNGEWTVZGXTGY-NRFANRHFSA-N 0 3 405.489 4.198 20 0 HIADHN C[C@@H](NCCc1cccc(Cl)c1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479356239 894652290 /nfs/dbraw/zinc/65/22/90/894652290.db2.gz FPUMGZQPSNLMGL-SNVBAGLBSA-N 0 3 407.750 4.188 20 0 HIADHN Cn1cc2c(n1)CCC[C@H]2NCc1ccc(NC(=O)CCCOc2ccccc2)cc1 ZINC000479357733 894656897 /nfs/dbraw/zinc/65/68/97/894656897.db2.gz IZXSNNNMSKIJND-HSZRJFAPSA-N 0 3 418.541 4.385 20 0 HIADHN O[C@@H](COC(c1ccccc1)c1ccccc1)CN1CCC[C@H](c2nccs2)C1 ZINC000505233466 913895940 /nfs/dbraw/zinc/89/59/40/913895940.db2.gz NYOWFFHTPPKCFL-FCHUYYIVSA-N 0 3 408.567 4.490 20 0 HIADHN CCC(CC)[C@H](CCN[C@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl)OC ZINC000479421839 894733012 /nfs/dbraw/zinc/73/30/12/894733012.db2.gz SJBPRXNUFCTXHO-BZNIZROVSA-N 0 3 411.395 4.133 20 0 HIADHN COc1ccc(CN2CCCN(Cc3cc(OC)c(OC)cc3SC)CC2)cc1 ZINC000505242423 913900553 /nfs/dbraw/zinc/90/05/53/913900553.db2.gz KSIWMXGPRJSEMO-UHFFFAOYSA-N 0 3 416.587 4.142 20 0 HIADHN OC[C@@H](CC(F)F)N[C@H]1CCCc2c(Br)cc(Br)cc21 ZINC000479452204 894771025 /nfs/dbraw/zinc/77/10/25/894771025.db2.gz IJBHEBBARZBQND-RNCFNFMXSA-N 0 3 413.100 4.195 20 0 HIADHN CCS(=O)(=O)c1c(Cl)cccc1CN[C@@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000479458447 894779854 /nfs/dbraw/zinc/77/98/54/894779854.db2.gz XSBMWPFRJQLVMK-MJGOQNOKSA-N 0 3 411.926 4.283 20 0 HIADHN C[C@H](NCC1(S(C)(=O)=O)CC1)c1ccc(-c2ccccc2Br)s1 ZINC000479473711 894796797 /nfs/dbraw/zinc/79/67/97/894796797.db2.gz XHCLTIUMGXPGGK-LBPRGKRZSA-N 0 3 414.390 4.405 20 0 HIADHN COc1cccc(NC(=O)[C@@H](N[C@@H]2CCc3cnn(C(C)C)c3C2)c2ccccc2)c1 ZINC000479484284 894806730 /nfs/dbraw/zinc/80/67/30/894806730.db2.gz AUNQBLRBHZHHRU-QPPBQGQZSA-N 0 3 418.541 4.300 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N(C)Cc2nc(-c3ccccc3)c[nH]2)N2CCCC2)cc1 ZINC000479499191 894816958 /nfs/dbraw/zinc/81/69/58/894816958.db2.gz SYPOHUYGVCJHPC-QHCPKHFHSA-N 0 3 417.557 4.364 20 0 HIADHN CCS(=O)(=O)c1c(Cl)cccc1CNC1CCN(Cc2ccccc2C)CC1 ZINC000479548418 894848769 /nfs/dbraw/zinc/84/87/69/894848769.db2.gz ZIGHQYYJUKYUQK-UHFFFAOYSA-N 0 3 421.006 4.196 20 0 HIADHN COc1ccc(-c2ccncc2)cc1CNCc1cccc(CN2CCO[C@H](C)C2)c1 ZINC000479550338 894850064 /nfs/dbraw/zinc/85/00/64/894850064.db2.gz BESYYWHCCBTABL-HXUWFJFHSA-N 0 3 417.553 4.268 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3CC[C@](C)(c4ccc(F)cc4)C3)c(C)c2)CC1 ZINC000479617256 894887393 /nfs/dbraw/zinc/88/73/93/894887393.db2.gz VHHWWDIIAZKCNI-VWLOTQADSA-N 0 3 424.564 4.472 20 0 HIADHN C[C@H](OC[C@@H](O)CN1CCC[C@H]1c1ccc2c(c1)OCO2)c1ccc(Cl)cc1 ZINC000479617293 894887469 /nfs/dbraw/zinc/88/74/69/894887469.db2.gz LOKIJIUPVNAQDT-YSSFQJQWSA-N 0 3 403.906 4.344 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)N[C@H](C)c2c(F)cccc2Cl)c1 ZINC000479683244 894969268 /nfs/dbraw/zinc/96/92/68/894969268.db2.gz FIFFJYWTMQVKRJ-OAHLLOKOSA-N 0 3 407.917 4.322 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)NC[C@H]2CCCC[C@H]2C(F)(F)F)c1 ZINC000479708828 895003980 /nfs/dbraw/zinc/00/39/80/895003980.db2.gz XBMDXLSPQNEZCZ-IEBWSBKVSA-N 0 3 415.500 4.137 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)NCc1ncoc1-c1ccccc1 ZINC000479734131 895033639 /nfs/dbraw/zinc/03/36/39/895033639.db2.gz IEWQLYQWXBXMJU-UHFFFAOYSA-N 0 3 412.921 4.268 20 0 HIADHN CN(C(=O)NCc1ncoc1-c1ccccc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000479742372 895041062 /nfs/dbraw/zinc/04/10/62/895041062.db2.gz HVEORUMISBYARC-NRFANRHFSA-N 0 3 404.514 4.148 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1CCN(Cc2ccccc2)[C@@H]1C)c1ccc(NC(=O)C2CC2)cc1 ZINC000479819192 895133975 /nfs/dbraw/zinc/13/39/75/895133975.db2.gz SGORATXMNXFJMN-YZZKKUAISA-N 0 3 420.557 4.058 20 0 HIADHN CN(C)C(=O)c1ccc(C(=O)N2CCN(Cc3ccccc3)C3(CCCCC3)C2)cc1 ZINC000479856883 895191229 /nfs/dbraw/zinc/19/12/29/895191229.db2.gz BSGLJBSYVAZJBU-UHFFFAOYSA-N 0 3 419.569 4.049 20 0 HIADHN COc1cc2c(cc1OC)CN(C(=O)CN[C@H](c1ccc(Cl)cc1)C(C)C)CC2 ZINC000505286592 913944095 /nfs/dbraw/zinc/94/40/95/913944095.db2.gz CVQUBPYVWDNOKP-QHCPKHFHSA-N 0 3 416.949 4.229 20 0 HIADHN COc1cccc([C@@H](CN[C@H](C)c2nnn(-c3ccc(Cl)cc3)c2C)N(C)C)c1 ZINC000479870720 895212782 /nfs/dbraw/zinc/21/27/82/895212782.db2.gz FBESLVHJHCEJQJ-QVKFZJNVSA-N 0 3 413.953 4.191 20 0 HIADHN CS(=O)(=O)CCCCN[C@@H](c1ccccc1)c1ccc(Br)cc1F ZINC000479951655 895304744 /nfs/dbraw/zinc/30/47/44/895304744.db2.gz CUOARIPOKKJSTE-SFHVURJKSA-N 0 3 414.340 4.092 20 0 HIADHN Cc1csc(C(=O)Nc2ccc(C(=O)N(C)[C@@H]3CCCN(C)C3)cc2)c1Cl ZINC000480025721 895374713 /nfs/dbraw/zinc/37/47/13/895374713.db2.gz YCLPJLXAINQRQM-MRXNPFEDSA-N 0 3 405.951 4.128 20 0 HIADHN CC(C)c1c(C(=O)N2CC[C@H](N3CCCCC3)C2)cnn1-c1ccccc1Cl ZINC000480083213 895442975 /nfs/dbraw/zinc/44/29/75/895442975.db2.gz PQTMGRMXKRXBHS-KRWDZBQOSA-N 0 3 400.954 4.350 20 0 HIADHN C[C@H](N[C@@H](C)c1cccc2ccccc21)c1cccc(S(=O)(=O)N2CCOCC2)c1 ZINC000480098891 895463087 /nfs/dbraw/zinc/46/30/87/895463087.db2.gz YASSNQXUOJRDFN-OALUTQOASA-N 0 3 424.566 4.273 20 0 HIADHN C[C@H](NC[C@@H](c1cccs1)N(C)C)c1ccccc1I ZINC000480099362 895466209 /nfs/dbraw/zinc/46/62/09/895466209.db2.gz ZCNXRTNKIPCXGB-WFASDCNBSA-N 0 3 400.329 4.306 20 0 HIADHN C[C@H](NCCCn1cnc2ccccc21)c1ccccc1I ZINC000480166542 895556205 /nfs/dbraw/zinc/55/62/05/895556205.db2.gz PCWBAGOLBAPJIJ-AWEZNQCLSA-N 0 3 405.283 4.382 20 0 HIADHN C[C@H](CN[C@H]1CCS(=O)(=O)c2ccc(Br)cc21)c1ccc(F)cc1 ZINC000480169543 895560408 /nfs/dbraw/zinc/56/04/08/895560408.db2.gz VKPPJQCETAJQQT-PXAZEXFGSA-N 0 3 412.324 4.200 20 0 HIADHN Cc1ccc(CC[C@@H](C)N[C@H]2CCS(=O)(=O)c3ccc(Br)cc32)o1 ZINC000480186380 895580010 /nfs/dbraw/zinc/58/00/10/895580010.db2.gz XTIWRKJSWPRMIS-PXAZEXFGSA-N 0 3 412.349 4.180 20 0 HIADHN Cc1ccc(CC[C@@H](C)N[C@@H]2CCS(=O)(=O)c3ccc(Br)cc32)o1 ZINC000480186389 895580268 /nfs/dbraw/zinc/58/02/68/895580268.db2.gz XTIWRKJSWPRMIS-SJKOYZFVSA-N 0 3 412.349 4.180 20 0 HIADHN Cc1cccc(C)c1CCN[C@H]1CCS(=O)(=O)c2ccc(Br)cc21 ZINC000480186676 895582895 /nfs/dbraw/zinc/58/28/95/895582895.db2.gz WQTAPQFTIZPLJJ-SFHVURJKSA-N 0 3 408.361 4.117 20 0 HIADHN CC(C)CSCCCN[C@@H]1CCS(=O)(=O)c2ccc(Br)cc21 ZINC000480187916 895583647 /nfs/dbraw/zinc/58/36/47/895583647.db2.gz DEAPVLQJHCPSSW-OAHLLOKOSA-N 0 3 406.411 4.037 20 0 HIADHN Cc1ccc(C[C@H](C)N[C@@H]2CCS(=O)(=O)c3ccc(Br)cc32)s1 ZINC000480206931 895609149 /nfs/dbraw/zinc/60/91/49/895609149.db2.gz BXPLVCVBOSYMFU-MEDUHNTESA-N 0 3 414.390 4.258 20 0 HIADHN Cc1ccccc1C1(CN[C@H]2CCS(=O)(=O)c3ccc(Br)cc32)CC1 ZINC000480240928 895651845 /nfs/dbraw/zinc/65/18/45/895651845.db2.gz KTCGDMNMKZOLSY-SFHVURJKSA-N 0 3 420.372 4.297 20 0 HIADHN COCCC[C@H](NCc1cccc(C(=O)N(C)C)c1)c1ccc(Br)cc1 ZINC000480278414 895684321 /nfs/dbraw/zinc/68/43/21/895684321.db2.gz MWQLOJJNKJHOSP-FQEVSTJZSA-N 0 3 419.363 4.408 20 0 HIADHN Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)C(=O)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000480407494 895809154 /nfs/dbraw/zinc/80/91/54/895809154.db2.gz VURNOMLQQWKVMQ-KXBFYZLASA-N 0 3 422.495 4.119 20 0 HIADHN CC(C)[C@@](C)(NCc1cnc(N2CCOCC2)s1)c1ccc(Br)cc1 ZINC000480463971 895847444 /nfs/dbraw/zinc/84/74/44/895847444.db2.gz AZESHSYMSIEQLB-LJQANCHMSA-N 0 3 424.408 4.403 20 0 HIADHN COC(=O)c1csc(-c2cccc(CNCc3c[nH]nc3-c3cccs3)c2)n1 ZINC000480468990 895852336 /nfs/dbraw/zinc/85/23/36/895852336.db2.gz ORIBBQLLKMHGQU-UHFFFAOYSA-N 0 3 410.524 4.338 20 0 HIADHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)CC(C)(C)C(F)(F)F ZINC000480492911 895865162 /nfs/dbraw/zinc/86/51/62/895865162.db2.gz IYHACHJLLBLAAO-UHFFFAOYSA-N 0 3 409.290 4.318 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(NC[C@@H](C3CC3)[N@H+](C)Cc3ccccc3)nc2)n1 ZINC000480500122 895869712 /nfs/dbraw/zinc/86/97/12/895869712.db2.gz KHWODHBECPGWIL-NRFANRHFSA-N 0 3 403.530 4.129 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(NC[C@@H](C3CC3)[N@@H+](C)Cc3ccccc3)nc2)n1 ZINC000480500122 895869713 /nfs/dbraw/zinc/86/97/13/895869713.db2.gz KHWODHBECPGWIL-NRFANRHFSA-N 0 3 403.530 4.129 20 0 HIADHN COCc1cc(NC2CC(N3CCC(C(F)(F)F)CC3)C2)nc(C(C)(C)C)n1 ZINC000480552269 895913261 /nfs/dbraw/zinc/91/32/61/895913261.db2.gz JPLYZJVYBQMHGC-UHFFFAOYSA-N 0 3 400.489 4.138 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)NCc1cc(Br)ccc1F)c1ccco1 ZINC000480594534 895957416 /nfs/dbraw/zinc/95/74/16/895957416.db2.gz IHBXIYFJBIMOQO-LRDDRELGSA-N 0 3 412.303 4.110 20 0 HIADHN COCc1cccc(CN[C@@H]2CCCOc3ccc(I)cc32)c1 ZINC000480615834 895982147 /nfs/dbraw/zinc/98/21/47/895982147.db2.gz TZXYKCYERAUMKF-GOSISDBHSA-N 0 3 423.294 4.441 20 0 HIADHN C[C@@H](NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)nc1)c1cccc(OC(F)(F)F)c1 ZINC000480623895 895992739 /nfs/dbraw/zinc/99/27/39/895992739.db2.gz XRWPTRVUBZAUPX-BZUAXINKSA-N 0 3 409.452 4.445 20 0 HIADHN CC[C@H](NCc1ccc(N2CCO[C@H](C)C2)nc1)c1ccc(Br)cc1 ZINC000480629213 895996697 /nfs/dbraw/zinc/99/66/97/895996697.db2.gz DKFOXWJEPMRUPF-BEFAXECRSA-N 0 3 404.352 4.310 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@@H](C)NCc2ccc(OCC3CC3)cc2)cc1 ZINC000480639924 896008588 /nfs/dbraw/zinc/00/85/88/896008588.db2.gz UJIAKZRIBUAMEU-GOSISDBHSA-N 0 3 416.587 4.357 20 0 HIADHN FC(F)(F)c1ccc(N2CCC(NCc3nccn3-c3ccccc3)CC2)nc1 ZINC000480651654 896020042 /nfs/dbraw/zinc/02/00/42/896020042.db2.gz KGNGKRFOTRYUTQ-UHFFFAOYSA-N 0 3 401.436 4.045 20 0 HIADHN CS[C@@H](CN[C@@H]1CCS(=O)(=O)c2ccc(Br)cc21)C(C)(C)C ZINC000480657769 896025671 /nfs/dbraw/zinc/02/56/71/896025671.db2.gz AYNSCMPLFMFOGE-HIFRSBDPSA-N 0 3 406.411 4.035 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N2CCC[C@@H]2c2ccc3c(c2)OCO3)N(C)C)cc1 ZINC000480679522 896042718 /nfs/dbraw/zinc/04/27/18/896042718.db2.gz BFBFVOHMSUDTIW-RTWAWAEBSA-N 0 3 409.530 4.127 20 0 HIADHN CCCN1C(=O)CCc2cc(NC(=O)NC[C@@H](N[C@@H](C)CC)c3ccco3)ccc21 ZINC000480684903 896048051 /nfs/dbraw/zinc/04/80/51/896048051.db2.gz PXSQYRZUYUUHHQ-QFBILLFUSA-N 0 3 412.534 4.220 20 0 HIADHN Cc1ccccc1NC(=O)C[C@@H](C)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1=O ZINC000480694786 896056559 /nfs/dbraw/zinc/05/65/59/896056559.db2.gz PWHCZRSMJSZEJW-CRAIPNDOSA-N 0 3 419.447 4.126 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N1CCC[C@@H]1c1ccc2c(c1)OCO2 ZINC000480701608 896063406 /nfs/dbraw/zinc/06/34/06/896063406.db2.gz KPDAAFBIZKHCNS-QZTJIDSGSA-N 0 3 413.543 4.160 20 0 HIADHN CC(C)Oc1ccc([C@H](C)NCc2ccc(N3CCCS3(=O)=O)c(F)c2)cc1 ZINC000480703981 896065737 /nfs/dbraw/zinc/06/57/37/896065737.db2.gz FUICPEIBDRENIN-INIZCTEOSA-N 0 3 406.523 4.004 20 0 HIADHN C[C@H](NCc1ccnc(N2CCN(C)CC2)c1)c1ccc(SCC(F)F)cc1 ZINC000480713134 896074264 /nfs/dbraw/zinc/07/42/64/896074264.db2.gz VHRPHTRBHVCYDG-INIZCTEOSA-N 0 3 406.546 4.041 20 0 HIADHN COc1cc(F)c([C@@H](C)NCCCNc2ccc(C(F)(F)F)cn2)cc1OC ZINC000480741819 896102963 /nfs/dbraw/zinc/10/29/63/896102963.db2.gz AWUSHDNAPUAYEJ-GFCCVEGCSA-N 0 3 401.404 4.410 20 0 HIADHN C[C@@H](N[C@@H](c1cc(F)cc(Br)c1)C1CC1)c1ccc(-n2cnnn2)cc1 ZINC000480758377 896120493 /nfs/dbraw/zinc/12/04/93/896120493.db2.gz NMRQMZIORGWIEL-CWTRNNRKSA-N 0 3 416.298 4.366 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)N[C@@H](c1cncc(Br)c1)C1CC1 ZINC000505372303 914036069 /nfs/dbraw/zinc/03/60/69/914036069.db2.gz IRBDIZMRWQATLC-LJQANCHMSA-N 0 3 423.399 4.203 20 0 HIADHN COCCOc1ccc(CN[C@H]2CCCOc3cc(Br)ccc32)cc1 ZINC000480764829 896127140 /nfs/dbraw/zinc/12/71/40/896127140.db2.gz XOWPHXSCWWHOKI-IBGZPJMESA-N 0 3 406.320 4.478 20 0 HIADHN C[C@@H](NC[C@@H]1CCN(c2ccccc2)C1)c1ccccc1I ZINC000480774767 896138129 /nfs/dbraw/zinc/13/81/29/896138129.db2.gz VVKODHFEWAZNJR-CVEARBPZSA-N 0 3 406.311 4.468 20 0 HIADHN CCCS(=O)(=O)N1CCC(N[C@H]2CCCc3c(Cl)sc(Cl)c32)CC1 ZINC000480774414 896138377 /nfs/dbraw/zinc/13/83/77/896138377.db2.gz ASANMKIZQLCMJG-ZDUSSCGKSA-N 0 3 411.420 4.226 20 0 HIADHN C[C@@H](NC[C@@H](O)CN1CCc2ccccc2C1)c1cc(Cl)ccc1OC(F)F ZINC000480785514 896150943 /nfs/dbraw/zinc/15/09/43/896150943.db2.gz LFUJHHNKMUVVJW-RDTXWAMCSA-N 0 3 410.892 4.011 20 0 HIADHN Cc1nc(C(C)C)sc1[C@@H](C)NCCNC(=O)c1ccc(Br)cc1 ZINC000480876389 896234703 /nfs/dbraw/zinc/23/47/03/896234703.db2.gz IXUKZRIUZPSPTH-GFCCVEGCSA-N 0 3 410.381 4.418 20 0 HIADHN O=C1CCCN1Cc1ccc(CN[C@@H]2CCc3c2cc(Br)cc3F)cc1 ZINC000480896597 896251911 /nfs/dbraw/zinc/25/19/11/896251911.db2.gz JXQIWHZDVWFGOY-HXUWFJFHSA-N 0 3 417.322 4.488 20 0 HIADHN C[C@@H](NCCCS(=O)(=O)Cc1ccccc1)c1ccc(F)c(Br)c1 ZINC000480900204 896255041 /nfs/dbraw/zinc/25/50/41/896255041.db2.gz MZFIEPGIMWKOBB-CQSZACIVSA-N 0 3 414.340 4.244 20 0 HIADHN C[C@@H](NCc1cccc(NC(=O)c2ccccn2)c1)c1cccc(N2CCOCC2)c1 ZINC000480901748 896257050 /nfs/dbraw/zinc/25/70/50/896257050.db2.gz ADXLMOYABDORMF-LJQANCHMSA-N 0 3 416.525 4.021 20 0 HIADHN C[C@H](NCCCS(=O)(=O)Cc1ccccc1)c1ccc(OC(F)(F)F)cc1 ZINC000480900323 896257170 /nfs/dbraw/zinc/25/71/70/896257170.db2.gz ROJJUYFUCDTLEV-HNNXBMFYSA-N 0 3 401.450 4.241 20 0 HIADHN C[C@@H](NCCCS(=O)(=O)Cc1ccccc1)c1ccc(Br)s1 ZINC000480903813 896258932 /nfs/dbraw/zinc/25/89/32/896258932.db2.gz DMSORZGPHWNFNU-CYBMUJFWSA-N 0 3 402.379 4.166 20 0 HIADHN CCc1ccc([C@H](CC)NCc2cccc(NC(=O)CCN3CCOCC3)c2)cc1 ZINC000480905238 896261130 /nfs/dbraw/zinc/26/11/30/896261130.db2.gz HOXKSODZGXNHGR-DEOSSOPVSA-N 0 3 409.574 4.151 20 0 HIADHN CC(C)C[C@H](NCc1cccc(NC(=O)CCN2CCOCC2)c1)c1cccs1 ZINC000480916839 896275601 /nfs/dbraw/zinc/27/56/01/896275601.db2.gz WQDIQFWNQVJTLG-NRFANRHFSA-N 0 3 415.603 4.286 20 0 HIADHN CCc1onc(C)c1NC(=O)Nc1cc(C)nn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000481010486 896341040 /nfs/dbraw/zinc/34/10/40/896341040.db2.gz QQMCKZLZICKXNM-GOSISDBHSA-N 0 3 408.506 4.141 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)NCc1csc(Br)c1)c1ccco1 ZINC000481092819 896413881 /nfs/dbraw/zinc/41/38/81/896413881.db2.gz NISLSNZVVCNJKD-WCQYABFASA-N 0 3 400.342 4.032 20 0 HIADHN COc1ccc2ccccc2c1-c1cc(CN2CCCC[C@H]2CN2CCOCC2)on1 ZINC000481109817 896433967 /nfs/dbraw/zinc/43/39/67/896433967.db2.gz OOWJLIGFRJUAQC-FQEVSTJZSA-N 0 3 421.541 4.190 20 0 HIADHN COc1ccc([C@@H](C)NC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)c(C)c1OC ZINC000481124459 896452098 /nfs/dbraw/zinc/45/20/98/896452098.db2.gz ZGTKCSXHRRJOBZ-QUCCMNQESA-N 0 3 411.546 4.037 20 0 HIADHN COc1cc2nc(CN[C@@H]3CCCC[C@H]3Cc3ccccc3)[nH]c(=O)c2cc1OC ZINC000481168981 896504910 /nfs/dbraw/zinc/50/49/10/896504910.db2.gz FGYVIULLEVCYRV-PKOBYXMFSA-N 0 3 407.514 4.244 20 0 HIADHN Cc1nn(C)c(=O)c(-c2nc(CN[C@H]3CCCC[C@@H]3Cc3ccccc3)cs2)c1C ZINC000481183520 896526396 /nfs/dbraw/zinc/52/63/96/896526396.db2.gz QXWYDHGZZIDDLS-CTNGQTDRSA-N 0 3 422.598 4.412 20 0 HIADHN O=C(CN[C@H](CC1CCC1)c1ccccc1)NCc1ccccc1Cn1cccn1 ZINC000481223640 896574953 /nfs/dbraw/zinc/57/49/53/896574953.db2.gz FXGGNRBIRNUASQ-XMMPIXPASA-N 0 3 402.542 4.069 20 0 HIADHN Cc1nc(-c2cccnc2)sc1[C@@H](C)NCCCS(=O)(=O)c1ccccc1 ZINC000481242291 896593463 /nfs/dbraw/zinc/59/34/63/896593463.db2.gz NLVLLGNHLJVMNL-OAHLLOKOSA-N 0 3 401.557 4.028 20 0 HIADHN O=S(=O)(CCCN[C@H]1CCc2c1cc(Br)cc2F)c1ccccc1 ZINC000481243173 896594371 /nfs/dbraw/zinc/59/43/71/896594371.db2.gz SINYQDNKDVQFPE-SFHVURJKSA-N 0 3 412.324 4.029 20 0 HIADHN O=S(=O)(CCCN[C@@H]1CCCOc2cc(Br)ccc21)c1ccccc1 ZINC000481246064 896597527 /nfs/dbraw/zinc/59/75/27/896597527.db2.gz KQQZCYOUBSUWRW-GOSISDBHSA-N 0 3 424.360 4.116 20 0 HIADHN COCCN1CCC(NC(=O)N(Cc2ccccc2)[C@@H](C)c2cccs2)CC1 ZINC000481299123 896643930 /nfs/dbraw/zinc/64/39/30/896643930.db2.gz DNFUSCRAGNWOGI-SFHVURJKSA-N 0 3 401.576 4.132 20 0 HIADHN C[C@@H](N[C@H]1CCSc2c(F)cccc21)c1ccc(OCC(=O)NC2CC2)cc1 ZINC000481313716 896662642 /nfs/dbraw/zinc/66/26/42/896662642.db2.gz SUIURCQRWIXYEL-VLIAUNLRSA-N 0 3 400.519 4.371 20 0 HIADHN CC[C@H](N[C@@H](C)c1ccccc1-n1cccn1)c1ccccc1OCC(=O)N(C)C ZINC000481324370 896680841 /nfs/dbraw/zinc/68/08/41/896680841.db2.gz YNPZYVAPQWZNBC-RXVVDRJESA-N 0 3 406.530 4.141 20 0 HIADHN Clc1ccc2c(c1)[C@H](NCc1cccc(OCCN3CCOCC3)c1)CCCO2 ZINC000481415392 896818644 /nfs/dbraw/zinc/81/86/44/896818644.db2.gz OAQXKTNARYKHTD-JOCHJYFZSA-N 0 3 416.949 4.055 20 0 HIADHN CC(C)C[C@@H](C)n1nccc1NC(=O)N(C)C1CCN(CCc2ccccn2)CC1 ZINC000481482154 896864921 /nfs/dbraw/zinc/86/49/21/896864921.db2.gz WSDBDAOWGYIIBF-LJQANCHMSA-N 0 3 412.582 4.056 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Cc2c[nH]c3cc(Br)ccc23)N(C)C)cc1 ZINC000481483128 896865839 /nfs/dbraw/zinc/86/58/39/896865839.db2.gz ZBZGBNMSWYGUGQ-FQEVSTJZSA-N 0 3 414.347 4.200 20 0 HIADHN COc1ccc(C)cc1C1(CN[C@@H](C)c2nnn(-c3ccccc3)c2C)CCOCC1 ZINC000481544844 896904459 /nfs/dbraw/zinc/90/44/59/896904459.db2.gz BVUIJQJNIRAORR-IBGZPJMESA-N 0 3 420.557 4.292 20 0 HIADHN C[C@@H](NCc1cccc(CN2CCO[C@H](C)C2)c1)c1ccc(F)cc1OC(F)F ZINC000481561486 896937669 /nfs/dbraw/zinc/93/76/69/896937669.db2.gz ZRNZUEANHYRMNL-HZPDHXFCSA-N 0 3 408.464 4.499 20 0 HIADHN CCC[C@@H](NCc1ccc(S(=O)(=O)N(C)C(C)C)cc1)c1ccc(OC)cc1 ZINC000481563554 896939551 /nfs/dbraw/zinc/93/95/51/896939551.db2.gz OBJUFEFJRYABOH-JOCHJYFZSA-N 0 3 404.576 4.355 20 0 HIADHN COCCOc1ccc([C@@H](C)NCc2cc3c(c(Br)c2)OCO3)cc1 ZINC000481578730 896957613 /nfs/dbraw/zinc/95/76/13/896957613.db2.gz GWMNFDAPQYQIAF-CYBMUJFWSA-N 0 3 408.292 4.054 20 0 HIADHN COc1ccccc1NC(=O)c1ccc(NC(=O)[C@H](C)N2CCCC[C@H](C)C2)cc1 ZINC000481579789 896959636 /nfs/dbraw/zinc/95/96/36/896959636.db2.gz IPPIUMXVNXNOBA-ROUUACIJSA-N 0 3 409.530 4.397 20 0 HIADHN C[C@H](NC[C@@H](O)COc1ccc(C(F)(F)F)cc1)c1ccccc1OC(F)F ZINC000481580362 896961503 /nfs/dbraw/zinc/96/15/03/896961503.db2.gz XWBXCVYMDJMHDU-GXTWGEPZSA-N 0 3 405.363 4.397 20 0 HIADHN Cc1cc(NC(=O)CCc2nc3ccccc3o2)cc(N2CCN(C(C)C)CC2)c1 ZINC000481654179 897038070 /nfs/dbraw/zinc/03/80/70/897038070.db2.gz CNCPBQGLIHKTGL-UHFFFAOYSA-N 0 3 406.530 4.238 20 0 HIADHN Cc1cc(NC(=O)CCC(=O)c2cccc(F)c2)cc(N2CCN(C(C)C)CC2)c1 ZINC000481658156 897042103 /nfs/dbraw/zinc/04/21/03/897042103.db2.gz GSEDHLZKVOXIOE-UHFFFAOYSA-N 0 3 411.521 4.266 20 0 HIADHN CC(C)NS(=O)(=O)Cc1ccccc1CN[C@H]1CCC(C)(C)c2ccccc21 ZINC000481660868 897045512 /nfs/dbraw/zinc/04/55/12/897045512.db2.gz KTBKTISPBOFOBF-QFIPXVFZSA-N 0 3 400.588 4.417 20 0 HIADHN CCOC(=O)C[C@@](C)(NCc1ccnc(-c2ccc(Br)cc2)n1)C(C)C ZINC000481716446 897110030 /nfs/dbraw/zinc/11/00/30/897110030.db2.gz GTYWYPOXRBXTGT-HXUWFJFHSA-N 0 3 420.351 4.364 20 0 HIADHN COc1ccc([C@@H](CNC(=O)Nc2cc(F)c(OC)cc2C)N2CCCC2)cc1 ZINC000481725462 897119348 /nfs/dbraw/zinc/11/93/48/897119348.db2.gz KMJCMXPUZAEUPR-HXUWFJFHSA-N 0 3 401.482 4.110 20 0 HIADHN CC(C)C[C@H]1OCCC[C@@H]1NCC(=O)Nc1ccc(NC(=O)c2cccs2)cc1 ZINC000481738616 897133436 /nfs/dbraw/zinc/13/34/36/897133436.db2.gz FBXDFUCFEAJFEU-RBUKOAKNSA-N 0 3 415.559 4.122 20 0 HIADHN COc1ccc([C@H](C)N[C@H](C)c2ccc(S(=O)(=O)NCc3ccco3)cc2)cc1 ZINC000481738581 897133561 /nfs/dbraw/zinc/13/35/61/897133561.db2.gz QVIMZPTWZGXKFE-DLBZAZTESA-N 0 3 414.527 4.179 20 0 HIADHN O=C1[C@@H](N[C@H](c2cc(F)cc(Br)c2)C2CC2)CCCN1CC(F)(F)F ZINC000481768587 897153987 /nfs/dbraw/zinc/15/39/87/897153987.db2.gz PZQSOMMMSTYFEZ-GJZGRUSLSA-N 0 3 423.248 4.182 20 0 HIADHN COc1ccc(-c2ccncc2)cc1CN1CCC[C@H](C(=O)Nc2ccc(C)cn2)C1 ZINC000481913516 897295984 /nfs/dbraw/zinc/29/59/84/897295984.db2.gz NSEZRBQLXMZUDG-NRFANRHFSA-N 0 3 416.525 4.311 20 0 HIADHN CC(C)Oc1ccc(CN[C@H](C)c2ccc(-n3cnnn3)cc2)c(C(F)(F)F)c1 ZINC000481949294 897338094 /nfs/dbraw/zinc/33/80/94/897338094.db2.gz UTDRFGGTKBFQGV-CQSZACIVSA-N 0 3 405.424 4.319 20 0 HIADHN COC(=O)c1ccc(-c2ccc(CN3CCC(C(=O)N[C@H](C)C(C)C)CC3)o2)cc1 ZINC000481981488 897375771 /nfs/dbraw/zinc/37/57/71/897375771.db2.gz CMRUICZVDWMKAJ-QGZVFWFLSA-N 0 3 412.530 4.106 20 0 HIADHN CC(C)C[C@H](N[C@H](C)Cc1ccccc1C(F)(F)F)c1nc(-c2nc[nH]n2)no1 ZINC000481982365 897376056 /nfs/dbraw/zinc/37/60/56/897376056.db2.gz FPAIEDHFHOYQQC-DOMZBBRYSA-N 0 3 408.428 4.182 20 0 HIADHN CC[C@@H](N[C@@H](CC(F)(F)F)C(C)C)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000481992464 897387964 /nfs/dbraw/zinc/38/79/64/897387964.db2.gz OJPCHYDLFANPSW-KGLIPLIRSA-N 0 3 400.894 4.266 20 0 HIADHN C[C@@H]1CCC[C@H](CN[C@H]2CCS(=O)(=O)c3ccc(Br)cc32)[C@@H]1C ZINC000481994214 897389332 /nfs/dbraw/zinc/38/93/32/897389332.db2.gz WEDGUTIRPNOGSD-WBOJAVRRSA-N 0 3 400.382 4.330 20 0 HIADHN C[C@@H]1CCC[C@H](CN[C@H]2CCS(=O)(=O)c3ccc(Br)cc32)[C@H]1C ZINC000481994208 897390416 /nfs/dbraw/zinc/39/04/16/897390416.db2.gz WEDGUTIRPNOGSD-OEUWWYETSA-N 0 3 400.382 4.330 20 0 HIADHN COc1ccc(-c2ccncc2)cc1CN1CCC(C(=O)Nc2ccc(O)cc2)CC1 ZINC000481995734 897391234 /nfs/dbraw/zinc/39/12/34/897391234.db2.gz XCMOWMBRNQDWEJ-UHFFFAOYSA-N 0 3 417.509 4.314 20 0 HIADHN C[C@@H](Cc1ccccc1C(F)(F)F)N[C@@H](c1nc(-c2nc[nH]n2)no1)C(C)(C)C ZINC000482001840 897399714 /nfs/dbraw/zinc/39/97/14/897399714.db2.gz YCMRLJMTTMJUFH-FZMZJTMJSA-N 0 3 408.428 4.182 20 0 HIADHN Cc1cc(NC(=O)c2cnn(C)c2-c2ccccc2)cc(N2CCN(C(C)C)CC2)c1 ZINC000482010637 897408532 /nfs/dbraw/zinc/40/85/32/897408532.db2.gz BZQDYUDBGSOHRG-UHFFFAOYSA-N 0 3 417.557 4.178 20 0 HIADHN Cc1onc(-c2ccccn2)c1C(=O)Nc1cc(C)cc(N2CCN(C(C)C)CC2)c1 ZINC000482029952 897439459 /nfs/dbraw/zinc/43/94/59/897439459.db2.gz CXEOAFDMBOMGRE-UHFFFAOYSA-N 0 3 419.529 4.136 20 0 HIADHN COC(=O)c1ccccc1-c1ccc(CNCCc2nnc(-c3ccccc3)o2)o1 ZINC000482030739 897439867 /nfs/dbraw/zinc/43/98/67/897439867.db2.gz KLJJSOLTMUFMBX-UHFFFAOYSA-N 0 3 403.438 4.116 20 0 HIADHN COc1ccccc1C1(C(=O)Nc2cc(C)cc(N3CCN(C(C)C)CC3)c2)CC1 ZINC000482035124 897448997 /nfs/dbraw/zinc/44/89/97/897448997.db2.gz TXLXOZFIMUOJNP-UHFFFAOYSA-N 0 3 407.558 4.204 20 0 HIADHN CO[C@@H](C)c1nc(C)c(C(=O)Nc2cc(C)cc(N3CCN(C(C)C)CC3)c2)s1 ZINC000482054745 897481628 /nfs/dbraw/zinc/48/16/28/897481628.db2.gz JPLOIHMFVDGCFV-KRWDZBQOSA-N 0 3 416.591 4.250 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Nc1ccc(OC(F)F)c2cccnc12 ZINC000482061276 897491332 /nfs/dbraw/zinc/49/13/32/897491332.db2.gz MREWWYCTTLNCIA-UHFFFAOYSA-N 0 3 420.485 4.493 20 0 HIADHN Cc1c2cc(C)ccc2[nH]c1C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000482076045 897512761 /nfs/dbraw/zinc/51/27/61/897512761.db2.gz CKDZBMSIUVEMKJ-UHFFFAOYSA-N 0 3 409.505 4.197 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)NC[C@H]1CCO[C@@H]1c1ccccc1 ZINC000482081900 897521646 /nfs/dbraw/zinc/52/16/46/897521646.db2.gz OCBWQIWKNGDHDW-AGILITTLSA-N 0 3 407.558 4.070 20 0 HIADHN CN(C)[C@@H](CNC(=O)Nc1ccc(OC(F)F)c2cccnc12)c1ccccc1 ZINC000482091329 897534237 /nfs/dbraw/zinc/53/42/37/897534237.db2.gz VBLCYGUXPUMWAR-KRWDZBQOSA-N 0 3 400.429 4.261 20 0 HIADHN C[C@H](NCc1ccc(OC2CCCCC2)cc1)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000482109472 897560084 /nfs/dbraw/zinc/56/00/84/897560084.db2.gz STFQLKAULVOOLY-SFHVURJKSA-N 0 3 416.587 4.499 20 0 HIADHN COc1ccc([C@@H](C)NCc2ccc(NC(=O)c3cccnc3)cc2)cc1NC(C)=O ZINC000482110938 897561528 /nfs/dbraw/zinc/56/15/28/897561528.db2.gz BGDCOHGXGNNIEQ-MRXNPFEDSA-N 0 3 418.497 4.152 20 0 HIADHN COCCOc1ccc([C@H](C)NCc2ccc(NC(=O)c3ccncc3)cc2)cc1 ZINC000482117690 897569551 /nfs/dbraw/zinc/56/95/51/897569551.db2.gz DXUSDGRVNHZMCZ-SFHVURJKSA-N 0 3 405.498 4.210 20 0 HIADHN O=C([C@H](Cc1ccccc1)N[C@H]1CCc2cc(Br)ccc21)N1CCCC1 ZINC000482121705 897576315 /nfs/dbraw/zinc/57/63/15/897576315.db2.gz OAEFYJVXVUCBSU-SFTDATJTSA-N 0 3 413.359 4.260 20 0 HIADHN Cc1nc(-c2ccccc2)ncc1C(=O)N(C)C1CCN(Cc2ccccc2)CC1 ZINC000482204210 897682054 /nfs/dbraw/zinc/68/20/54/897682054.db2.gz BSKRSHXIKQWSOB-UHFFFAOYSA-N 0 3 400.526 4.189 20 0 HIADHN COC(=O)c1ccc(-c2ccc(CN[C@@H](Cc3ccccc3)[C@H](O)C(F)F)o2)cc1 ZINC000482206458 897685103 /nfs/dbraw/zinc/68/51/03/897685103.db2.gz FIROKFWETXKZDL-FPOVZHCZSA-N 0 3 415.436 4.060 20 0 HIADHN CCC[C@H](N[C@@H]1CCCc2nc(CC)sc21)C(=O)N1CCc2sccc2C1 ZINC000482239549 897722405 /nfs/dbraw/zinc/72/24/05/897722405.db2.gz BGGWNUGUPBJMOQ-WBVHZDCISA-N 0 3 403.617 4.488 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)c2sc(-c3cccs3)nc2C)c1 ZINC000482340824 897848151 /nfs/dbraw/zinc/84/81/51/897848151.db2.gz BVQJYKOFDFTMLO-UHFFFAOYSA-N 0 3 415.584 4.393 20 0 HIADHN CN(C)CCN(C[C@H]1CCCO1)C(=O)N[C@H](c1cccc2ccccc21)C(F)(F)F ZINC000482401976 897941388 /nfs/dbraw/zinc/94/13/88/897941388.db2.gz GMNMPMFTORZVTN-YLJYHZDGSA-N 0 3 423.479 4.195 20 0 HIADHN O=C(N[C@@H](c1ccccc1OC(F)F)C(F)(F)F)N1CCN(C2CCCC2)CC1 ZINC000482435010 897995014 /nfs/dbraw/zinc/99/50/14/897995014.db2.gz HOSCSJTZZJHWNF-INIZCTEOSA-N 0 3 421.410 4.161 20 0 HIADHN CCCOc1cn(-c2ccccc2)nc1C(=O)NC1CCN(Cc2ccccc2)CC1 ZINC000482438350 897998265 /nfs/dbraw/zinc/99/82/65/897998265.db2.gz QMPZFUDAFHXOER-UHFFFAOYSA-N 0 3 418.541 4.056 20 0 HIADHN CN(C)[C@H](CNC(=O)N[C@@H](c1cccc(F)c1F)C(F)(F)F)c1ccccc1 ZINC000482439821 897999671 /nfs/dbraw/zinc/99/96/71/897999671.db2.gz MVDMWEDNGAGSKI-WBVHZDCISA-N 0 3 401.379 4.170 20 0 HIADHN C[C@H](NC(=O)Nc1cccc2c1CN(CC(F)(F)F)C2)[C@@H](c1ccccc1)N(C)C ZINC000482475213 898051398 /nfs/dbraw/zinc/05/13/98/898051398.db2.gz JIPMWBZQAQNUJG-YWZLYKJASA-N 0 3 420.479 4.377 20 0 HIADHN Cc1c(C(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)cnn1-c1ccccc1Cl ZINC000482486520 898067017 /nfs/dbraw/zinc/06/70/17/898067017.db2.gz VXUPJZGFQOKSAX-QFBILLFUSA-N 0 3 408.933 4.399 20 0 HIADHN COC(=O)c1ccc(-c2ccc(CN3CCC(c4nnc5n4CCCC5)CC3)o2)cc1 ZINC000482493878 898074205 /nfs/dbraw/zinc/07/42/05/898074205.db2.gz BDCMWUQTCCYJOJ-UHFFFAOYSA-N 0 3 420.513 4.041 20 0 HIADHN COc1cc(CN2CCC([C@@H](C)NC(C)=O)CC2)ccc1OCc1ccc(F)cc1 ZINC000482501237 898083310 /nfs/dbraw/zinc/08/33/10/898083310.db2.gz IYVHAHLURDFYEQ-QGZVFWFLSA-N 0 3 414.521 4.150 20 0 HIADHN O=C(N[C@H]1CCN(c2ccc(F)c(Cl)c2)C1)c1cccc(CN2CCCC2)c1 ZINC000482527269 898114791 /nfs/dbraw/zinc/11/47/91/898114791.db2.gz DBAIYTQQISPQMX-SFHVURJKSA-N 0 3 401.913 4.084 20 0 HIADHN CC(=O)N[C@H](C)C1CCN(Cc2cn(-c3ccccc3)nc2-c2cccs2)CC1 ZINC000482526642 898115187 /nfs/dbraw/zinc/11/51/87/898115187.db2.gz UBDMAAKEYODHHP-QGZVFWFLSA-N 0 3 408.571 4.337 20 0 HIADHN C[C@H](N[C@@H](C)c1cc(F)ccc1N1CCN(C)CC1)c1cnn(Cc2ccccc2)c1 ZINC000482550198 898140002 /nfs/dbraw/zinc/14/00/02/898140002.db2.gz PNRHHNODOBAWEH-PMACEKPBSA-N 0 3 421.564 4.234 20 0 HIADHN Cn1c(CNC[C@@H](CO)Cc2ccccc2C(F)(F)F)nc2ccc(Cl)cc21 ZINC000482581753 898178905 /nfs/dbraw/zinc/17/89/05/898178905.db2.gz QRKHJEURMMVIAP-ZDUSSCGKSA-N 0 3 411.855 4.186 20 0 HIADHN Cc1nnc(SCC(=O)Nc2cc(CN(C)C)ccc2C)n1-c1cc(C)ccc1C ZINC000482586696 898184600 /nfs/dbraw/zinc/18/46/00/898184600.db2.gz MHTWJUWFEKAGFV-UHFFFAOYSA-N 0 3 423.586 4.293 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)c1ccc(-c2noc(C(F)(F)F)n2)cc1 ZINC000482612139 898213648 /nfs/dbraw/zinc/21/36/48/898213648.db2.gz GXZBQQBUTWELEB-UHFFFAOYSA-N 0 3 404.392 4.378 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)Cc1csc(-c2ccc3c(c2)OCO3)n1 ZINC000482621309 898224195 /nfs/dbraw/zinc/22/41/95/898224195.db2.gz WVNVMQAUQNOWPK-UHFFFAOYSA-N 0 3 409.511 4.090 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C[C@H]1Sc2ccc(Cl)cc2NC1=O ZINC000482634739 898239103 /nfs/dbraw/zinc/23/91/03/898239103.db2.gz ZZHWOZYQHFHKAH-GOSISDBHSA-N 0 3 403.935 4.152 20 0 HIADHN CC[C@H](C)C(=O)Nc1cccc(CNC(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)c1 ZINC000482638439 898241625 /nfs/dbraw/zinc/24/16/25/898241625.db2.gz XDDYIFQILKKEMF-NJNPRVFISA-N 0 3 410.562 4.162 20 0 HIADHN COc1ccc([C@@H](CCO)NCc2ccc(-n3ccc(C(F)(F)F)n3)cc2)cc1 ZINC000482637564 898241873 /nfs/dbraw/zinc/24/18/73/898241873.db2.gz RIOQHWBBFFDTIM-LJQANCHMSA-N 0 3 405.420 4.113 20 0 HIADHN Cc1nc(-c2cc([C@@H](C)NCCOc3ccc(S(C)(=O)=O)cc3)cs2)cs1 ZINC000482653670 898256449 /nfs/dbraw/zinc/25/64/49/898256449.db2.gz YIAYBPKACWWPIL-CYBMUJFWSA-N 0 3 422.597 4.313 20 0 HIADHN COc1ccccc1OC[C@H](C)CNCc1csc(-c2ccc3c(c2)OCO3)n1 ZINC000482662224 898265927 /nfs/dbraw/zinc/26/59/27/898265927.db2.gz KKRDTOXBENCLEM-OAHLLOKOSA-N 0 3 412.511 4.352 20 0 HIADHN Cc1c([C@H](C)NC(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)cnn1-c1ccc(F)cc1 ZINC000482667056 898270265 /nfs/dbraw/zinc/27/02/65/898270265.db2.gz BDXPSWFLSKZFIS-HKARXFIJSA-N 0 3 423.536 4.371 20 0 HIADHN CN1C(=O)C[C@H](NCc2cc(Cl)cc3cccnc32)[C@@H]1c1ccc(F)c(F)c1 ZINC000482702030 898302498 /nfs/dbraw/zinc/30/24/98/898302498.db2.gz AOXTZIUYMRTERB-RXVVDRJESA-N 0 3 401.844 4.228 20 0 HIADHN CN1C(=O)C[C@H](NCc2cccc(OCc3ccccn3)c2)[C@@H]1c1ccc(F)c(F)c1 ZINC000482719582 898321439 /nfs/dbraw/zinc/32/14/39/898321439.db2.gz CIYIBDXTVFCJRL-UPVQGACJSA-N 0 3 423.463 4.000 20 0 HIADHN Cc1nc(-c2ccc(C)c(NC(=O)[C@H]3CCCN(Cc4cccc(F)c4)C3)c2)n[nH]1 ZINC000482765910 898373674 /nfs/dbraw/zinc/37/36/74/898373674.db2.gz IWCPXQLYJKTUKS-IBGZPJMESA-N 0 3 407.493 4.078 20 0 HIADHN CCN1CCN(CCC(=O)N(C)[C@@H](c2ccc(F)cc2)c2ccc(Cl)cc2)CC1 ZINC000482770542 898378918 /nfs/dbraw/zinc/37/89/18/898378918.db2.gz VKZBSEAWPPXRHA-HSZRJFAPSA-N 0 3 417.956 4.055 20 0 HIADHN Cc1cc(C(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)nn1-c1ccc(F)cc1F ZINC000505552332 914253889 /nfs/dbraw/zinc/25/38/89/914253889.db2.gz YPOYJZXYBVWDLV-GOSISDBHSA-N 0 3 424.495 4.196 20 0 HIADHN COc1ccc(-c2nc(C)c([C@@H](C)N[C@H](Cc3ccccc3)C(=O)N(C)C)s2)cc1 ZINC000482864793 898475887 /nfs/dbraw/zinc/47/58/87/898475887.db2.gz IVUAZIDTNWWMHC-IIBYNOLFSA-N 0 3 423.582 4.477 20 0 HIADHN CCN(Cc1ccccc1)C(=O)[C@@H](C)N1CCC(n2c(C)nc3ccccc32)CC1 ZINC000482885156 898498942 /nfs/dbraw/zinc/49/89/42/898498942.db2.gz GTICURQLDSFNCN-LJQANCHMSA-N 0 3 404.558 4.419 20 0 HIADHN COc1cc([C@@H](C)NCc2cccc(COC3CCOCC3)c2)cc(OC)c1OC ZINC000482887138 898502364 /nfs/dbraw/zinc/50/23/64/898502364.db2.gz HKHNEGVZHLHGTB-QGZVFWFLSA-N 0 3 415.530 4.259 20 0 HIADHN Cc1nc2ccccc2n1C1CCN(CCC(=O)c2ccc3c(c2)OCCO3)CC1 ZINC000482889468 898506113 /nfs/dbraw/zinc/50/61/13/898506113.db2.gz OLCVJCFWDOJZRD-UHFFFAOYSA-N 0 3 405.498 4.026 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc([S@@](C)=O)cc1)c1ccc(NC(=O)c2ccncc2)cc1 ZINC000482941958 898564853 /nfs/dbraw/zinc/56/48/53/898564853.db2.gz AZJIRIUDCKJTDC-LPNVONKKSA-N 0 3 407.539 4.483 20 0 HIADHN C[C@H](NC[C@H](O)Cc1ccc(C(F)(F)F)cc1)c1ccc(Br)cn1 ZINC000482946203 898571141 /nfs/dbraw/zinc/57/11/41/898571141.db2.gz IKYYQXJFHJRUCP-XHDPSFHLSA-N 0 3 403.242 4.117 20 0 HIADHN C[C@H](NCc1ccc(-c2nc3ccccc3[nH]2)cc1)c1ccc(NS(C)(=O)=O)cc1 ZINC000482951908 898579038 /nfs/dbraw/zinc/57/90/38/898579038.db2.gz ZLJDZFUCIVWFRS-INIZCTEOSA-N 0 3 420.538 4.452 20 0 HIADHN C[C@@H](NCc1cccc(NC(=O)NCc2ccncc2)c1)c1ccc2c(c1)COC2 ZINC000482959356 898590276 /nfs/dbraw/zinc/59/02/76/898590276.db2.gz LDRSNBJICFUAFJ-QGZVFWFLSA-N 0 3 402.498 4.284 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(NC(N)=O)cc1)c1ccc(S(=O)(=O)C2CCCC2)cc1 ZINC000482969024 898601983 /nfs/dbraw/zinc/60/19/83/898601983.db2.gz ZWKVILBGYCESGC-JKSUJKDBSA-N 0 3 415.559 4.305 20 0 HIADHN CO[C@@]1(C)CCCN(CC(=O)N[C@@H](c2ccccc2)c2ccc(Cl)cc2)CC1 ZINC000483028576 898690692 /nfs/dbraw/zinc/69/06/92/898690692.db2.gz QTNGVESRHALOHY-GOTSBHOMSA-N 0 3 400.950 4.437 20 0 HIADHN CC(C)c1ccc(NC(=O)N2CC[C@H](N3CCN(C)CC3)[C@H](C)C2)c(C(C)C)c1 ZINC000483040013 898707635 /nfs/dbraw/zinc/70/76/35/898707635.db2.gz KMHBJQLPYULGCR-XXBNENTESA-N 0 3 400.611 4.423 20 0 HIADHN Cc1ccccc1[C@H](N[C@H](C)c1cccc(S(=O)(=O)N2CCOCC2)c1)C(C)C ZINC000483117024 898805914 /nfs/dbraw/zinc/80/59/14/898805914.db2.gz WVOIDOLKEHWULU-AUSIDOKSSA-N 0 3 416.587 4.064 20 0 HIADHN CN(C)C[C@H](NC(=O)Nc1ccc(OCC(F)(F)F)c(F)c1)c1ccc(F)cc1 ZINC000483138782 898818561 /nfs/dbraw/zinc/81/85/61/898818561.db2.gz ZJTQXJUWZRDPKD-INIZCTEOSA-N 0 3 417.378 4.330 20 0 HIADHN COCC[C@](C)(O)CN[C@H](Cc1ccccc1F)c1ccccc1Br ZINC000483138640 898818598 /nfs/dbraw/zinc/81/85/98/898818598.db2.gz WQBSCMZEFJKYLT-UXHICEINSA-N 0 3 410.327 4.249 20 0 HIADHN C[C@H](N[C@@H](CO)Cc1c[nH]c2ccccc12)c1ccccc1I ZINC000483142734 898821603 /nfs/dbraw/zinc/82/16/03/898821603.db2.gz MVIALBMUQUOFBF-DZGCQCFKSA-N 0 3 420.294 4.027 20 0 HIADHN C[C@H](NC(=O)c1ccc(-c2noc(C(F)F)n2)cc1)[C@H](c1ccccc1)N(C)C ZINC000505591236 914297172 /nfs/dbraw/zinc/29/71/72/914297172.db2.gz MAPSVULZQCMUJJ-SUMWQHHRSA-N 0 3 400.429 4.095 20 0 HIADHN COc1ccc(OC)c(-c2csc(NC(=O)CN(CC3CC3)C3CCC3)n2)c1 ZINC000483292618 898926522 /nfs/dbraw/zinc/92/65/22/898926522.db2.gz KVUHSUHZOWKWRL-UHFFFAOYSA-N 0 3 401.532 4.030 20 0 HIADHN C[C@@H](NC(=O)c1cccc(-c2noc(C(F)(F)F)n2)c1)[C@H](c1ccccc1)N(C)C ZINC000505590129 914297631 /nfs/dbraw/zinc/29/76/31/914297631.db2.gz DXKHAQVNDOKJRM-CXAGYDPISA-N 0 3 418.419 4.177 20 0 HIADHN CCCN(C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C)[C@H]1CCCc2cccnc21 ZINC000483313440 898940118 /nfs/dbraw/zinc/94/01/18/898940118.db2.gz WWLOIWWHXJPSLA-PTUXOGIPSA-N 0 3 406.574 4.401 20 0 HIADHN C[C@@H](NC(=O)c1cc(OC(F)F)cc(OC(F)F)c1)[C@H](c1ccccc1)N(C)C ZINC000505592939 914299736 /nfs/dbraw/zinc/29/97/36/914299736.db2.gz WBTFRUBNHUGZSE-SJKOYZFVSA-N 0 3 414.399 4.311 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)Nc3cc(C(F)(F)F)ccc3Br)[C@H]2C1 ZINC000483330829 898960381 /nfs/dbraw/zinc/96/03/81/898960381.db2.gz CGPNTFDMDJOZDS-YGRLFVJLSA-N 0 3 406.246 4.026 20 0 HIADHN Cc1cc(Sc2ncccn2)ccc1NC(=O)N1CCN(C2CCCCC2)CC1 ZINC000483335852 898965692 /nfs/dbraw/zinc/96/56/92/898965692.db2.gz GQGQJXRCSJEIIP-UHFFFAOYSA-N 0 3 411.575 4.418 20 0 HIADHN O=C(NCc1nc(-c2cc3ccccc3o2)cs1)N1CCN(C2CCCC2)CC1 ZINC000483390665 899024284 /nfs/dbraw/zinc/02/42/84/899024284.db2.gz ZVLYIKLFSPZWNS-UHFFFAOYSA-N 0 3 410.543 4.326 20 0 HIADHN CS[C@H]1CN(C(=O)c2csc(-c3ccc(C)cc3C)n2)C[C@@H]1N1CCCC1 ZINC000483392530 899027957 /nfs/dbraw/zinc/02/79/57/899027957.db2.gz IAVXJVHZEKQCRL-OALUTQOASA-N 0 3 401.601 4.079 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2CN2CC[C@@H](N3CCCC3=O)C2)cc1 ZINC000483429639 899059763 /nfs/dbraw/zinc/05/97/63/899059763.db2.gz GNCIXIFBESKFKR-HSZRJFAPSA-N 0 3 400.526 4.044 20 0 HIADHN Cc1ccccc1-c1nn(-c2ccccc2)cc1CN1CC[C@H](N2CCCC2=O)C1 ZINC000483441221 899074380 /nfs/dbraw/zinc/07/43/80/899074380.db2.gz PHWFZOHKPRMENH-QFIPXVFZSA-N 0 3 400.526 4.044 20 0 HIADHN Cc1occc1-c1cc(NC(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)no1 ZINC000483445045 899080399 /nfs/dbraw/zinc/08/03/99/899080399.db2.gz JOMKQHIJNAWKIA-IBGZPJMESA-N 0 3 412.490 4.455 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1cc(O)ccc1Cl ZINC000483466987 899108878 /nfs/dbraw/zinc/10/88/78/899108878.db2.gz GRPVPNNHXKSIII-QGZVFWFLSA-N 0 3 410.905 4.250 20 0 HIADHN CCn1c2ccc(Br)cc2nc1CN[C@@H](C)Cc1ccn(C(C)C)n1 ZINC000483489417 899142105 /nfs/dbraw/zinc/14/21/05/899142105.db2.gz XAYCFCKMEXSTIY-AWEZNQCLSA-N 0 3 404.356 4.317 20 0 HIADHN CCc1cccc(CC(=O)Nc2c(C)cnn2[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000505616659 914319330 /nfs/dbraw/zinc/31/93/30/914319330.db2.gz BLLURRABZSYWKB-QHCPKHFHSA-N 0 3 402.542 4.382 20 0 HIADHN Brc1csc(-c2noc(CN3CCN(C4CCCCC4)CC3)n2)c1 ZINC000483495393 899152206 /nfs/dbraw/zinc/15/22/06/899152206.db2.gz CKHWGBFSDSDOSH-UHFFFAOYSA-N 0 3 411.369 4.011 20 0 HIADHN CCCCCn1nc(C)cc1NC(=O)Nc1ccc(N2CCN(CC)CC2)cc1C ZINC000483505226 899165737 /nfs/dbraw/zinc/16/57/37/899165737.db2.gz PBXPRWGJZNVGCQ-UHFFFAOYSA-N 0 3 412.582 4.476 20 0 HIADHN Cc1cc(-n2ccnc2)ccc1CN1CCCN(C(=O)c2ccc(Cl)cc2)CC1 ZINC000483537739 899200654 /nfs/dbraw/zinc/20/06/54/899200654.db2.gz JKYRZEYFAKERJY-UHFFFAOYSA-N 0 3 408.933 4.182 20 0 HIADHN COc1ccccc1-c1noc([C@H](C)N[C@@H]2C[C@H](C)CN(Cc3ccccc3)C2)n1 ZINC000483645569 899301762 /nfs/dbraw/zinc/30/17/62/899301762.db2.gz ASQRQWCWNSJGMG-CMKODMSKSA-N 0 3 406.530 4.306 20 0 HIADHN C[C@](CO)(CNCc1nc(-c2cccc(Br)c2)c[nH]1)Cc1ccccc1 ZINC000483647726 899305333 /nfs/dbraw/zinc/30/53/33/899305333.db2.gz NAAIGGRGRHILLC-OAQYLSRUSA-N 0 3 414.347 4.170 20 0 HIADHN CO[C@@H]1CCCC[C@@H]1NCC(=O)N1N=C(c2cc3ccccc3o2)C[C@@H]1c1ccco1 ZINC000483723538 899381954 /nfs/dbraw/zinc/38/19/54/899381954.db2.gz KTEHKBDQHFCWAA-FBBABVLZSA-N 0 3 421.497 4.251 20 0 HIADHN CN(C(=O)N[C@H]1CCN(C2CC2)C1)[C@@H](c1ccc(F)cc1)c1ccc(Cl)cc1 ZINC000483812681 899490461 /nfs/dbraw/zinc/49/04/61/899490461.db2.gz ZDYUWWLFGHBCTO-PZJWPPBQSA-N 0 3 401.913 4.447 20 0 HIADHN CC[C@@H]1Oc2cc([C@@H](C)N[C@@H](C)c3ccc(NC(=O)NC4CC4)cc3)ccc2NC1=O ZINC000483848385 899529140 /nfs/dbraw/zinc/52/91/40/899529140.db2.gz KWRZGADCCOBWNF-ZSDSOXJFSA-N 0 3 422.529 4.492 20 0 HIADHN CC[C@@H](NCc1ccc(-c2cccnc2)cc1)c1ccccc1OCC(=O)N(C)C ZINC000483861143 899545198 /nfs/dbraw/zinc/54/51/98/899545198.db2.gz IVRJEUUOBCUGRG-HSZRJFAPSA-N 0 3 403.526 4.457 20 0 HIADHN Cc1ccc(NC(=O)CCc2c(C)nc3c4ccccc4nn3c2C)c(CN(C)C)c1 ZINC000505661418 914359470 /nfs/dbraw/zinc/35/94/70/914359470.db2.gz UECMLHGPLMKOML-UHFFFAOYSA-N 0 3 415.541 4.441 20 0 HIADHN Cc1ccc(NC(=O)C[C@@H]2Sc3ccc(Cl)cc3NC2=O)c(CN(C)C)c1 ZINC000505663285 914360606 /nfs/dbraw/zinc/36/06/06/914360606.db2.gz YJGJFIDDQAISTE-SFHVURJKSA-N 0 3 403.935 4.152 20 0 HIADHN COC(=O)c1ccc(C(=O)N(c2cccc(SC)c2)C2CCN(C)CC2)c(F)c1 ZINC000484052377 899684173 /nfs/dbraw/zinc/68/41/73/899684173.db2.gz XAODZLLRRRZLOJ-UHFFFAOYSA-N 0 3 416.518 4.075 20 0 HIADHN Cc1c(C(=O)N(CCN(C)C)Cc2ccc(F)cc2)cnn1-c1ccccc1Cl ZINC000484142757 899762366 /nfs/dbraw/zinc/76/23/66/899762366.db2.gz XPBGKTDIMDVPDQ-UHFFFAOYSA-N 0 3 414.912 4.177 20 0 HIADHN O=C(Nc1nnc(/C=C/c2ccco2)s1)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000484160657 899781018 /nfs/dbraw/zinc/78/10/18/899781018.db2.gz HIBUZEFABRFXGK-ZGKFYVQTSA-N 0 3 409.515 4.260 20 0 HIADHN Cc1c(CSC(C)C)cccc1NC(=O)N1CC[C@H](N2CCN(C)CC2)[C@@H](C)C1 ZINC000484280452 899849812 /nfs/dbraw/zinc/84/98/12/899849812.db2.gz MSOFMGUMLYZZHM-AVRDEDQJSA-N 0 3 418.651 4.126 20 0 HIADHN C[C@H](N[C@H]1c2cccc(F)c2CC[C@@H]1C)c1cccc(N2CCCS2(=O)=O)c1 ZINC000484287126 899853235 /nfs/dbraw/zinc/85/32/35/899853235.db2.gz FPOZMYRNCKPIBA-PONJGIIJSA-N 0 3 402.535 4.340 20 0 HIADHN COc1cc([C@@H](C)NCc2ccc(C)cc2N2CCOCC2)ccc1OC(F)F ZINC000484291197 899856760 /nfs/dbraw/zinc/85/67/60/899856760.db2.gz ASBISVNDJHEIOI-MRXNPFEDSA-N 0 3 406.473 4.292 20 0 HIADHN CSc1cccc(N(C(=O)c2cnn(Cc3ccccc3)c2)C2CCN(C)CC2)c1 ZINC000484293995 899857579 /nfs/dbraw/zinc/85/75/79/899857579.db2.gz IGBXZTLMVMTFKH-UHFFFAOYSA-N 0 3 420.582 4.394 20 0 HIADHN CC[C@H](N[C@@H]1CCCc2nc(-c3ccc(Cl)cc3)sc21)C(=O)N1CCOCC1 ZINC000484314608 899874016 /nfs/dbraw/zinc/87/40/16/899874016.db2.gz XDLGWMVKACJYOL-DLBZAZTESA-N 0 3 419.978 4.068 20 0 HIADHN Cc1ccc2nc(CN[C@](C)(c3ccc(Br)cc3)C(C)C)cc(=O)n2c1 ZINC000484330686 899884048 /nfs/dbraw/zinc/88/40/48/899884048.db2.gz NEFYSLXPQWQVPI-NRFANRHFSA-N 0 3 414.347 4.426 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)NCc1cc(F)ccc1Br)c1ccco1 ZINC000484337969 899889727 /nfs/dbraw/zinc/88/97/27/899889727.db2.gz INVDRNPDRKJAJR-MLGOLLRUSA-N 0 3 412.303 4.110 20 0 HIADHN CC(C)[C@](C)(N[C@@H]1CCN(CC(F)(F)F)C1=O)c1ccc(Br)cc1 ZINC000484343358 899893327 /nfs/dbraw/zinc/89/33/27/899893327.db2.gz RLCNOAHPQKXCNP-ZBFHGGJFSA-N 0 3 407.274 4.073 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2cc(F)c(SC)c(F)c2)c1 ZINC000484350920 899899309 /nfs/dbraw/zinc/89/93/09/899899309.db2.gz HAULVZFEFJDGMA-UHFFFAOYSA-N 0 3 409.502 4.291 20 0 HIADHN CSc1cccc(N(C(=O)[C@@H](C)Oc2ccccc2F)C2CCN(C)CC2)c1 ZINC000484397900 899924784 /nfs/dbraw/zinc/92/47/84/899924784.db2.gz ASNJYRZBOHONDW-MRXNPFEDSA-N 0 3 402.535 4.442 20 0 HIADHN CCc1ccccc1NC(=O)C[C@@H](C)NCC(=O)N1CCC(Cc2ccccc2)CC1 ZINC000484482735 899974764 /nfs/dbraw/zinc/97/47/64/899974764.db2.gz KFVKHBIYYRGVDU-HXUWFJFHSA-N 0 3 421.585 4.037 20 0 HIADHN CNS(=O)(=O)c1ccc([C@@H](C)NCc2cc(-c3ccc(OC)cc3)cs2)cc1 ZINC000484483628 899975472 /nfs/dbraw/zinc/97/54/72/899975472.db2.gz AESFJZKZESWVRF-OAHLLOKOSA-N 0 3 416.568 4.183 20 0 HIADHN COc1cc(OC)cc(N2CC[C@H](N[C@@H](C)c3cc(Cl)c(OC)cc3OC)C2)c1 ZINC000484489970 899981226 /nfs/dbraw/zinc/98/12/26/899981226.db2.gz KALBRWQWZLCYEM-GJZGRUSLSA-N 0 3 420.937 4.304 20 0 HIADHN C[C@H](N[C@H]1CCN(C(=O)CCc2ccccc2)C1)c1ccc(F)cc1OC(F)F ZINC000484501927 899992543 /nfs/dbraw/zinc/99/25/43/899992543.db2.gz MVBLTGHRCKHRRJ-YJBOKZPZSA-N 0 3 406.448 4.311 20 0 HIADHN C[C@H](O)C[C@H](CN[C@@H](C)c1ccccc1I)c1ccccc1 ZINC000484502894 899993594 /nfs/dbraw/zinc/99/35/94/899993594.db2.gz QJBWTNRMYYSRSW-YQQAZPJKSA-N 0 3 409.311 4.497 20 0 HIADHN O=C(C1CCCCC1)N1CC[C@@H](N[C@@H]2CCCOc3cc(Br)ccc32)C1 ZINC000484520754 900008938 /nfs/dbraw/zinc/00/89/38/900008938.db2.gz URUYNNMZJQNATO-IEBWSBKVSA-N 0 3 421.379 4.434 20 0 HIADHN O=C(C1CCCCC1)N1CC[C@H](N[C@@H]2CCCOc3cc(Br)ccc32)C1 ZINC000484520756 900009100 /nfs/dbraw/zinc/00/91/00/900009100.db2.gz URUYNNMZJQNATO-PKOBYXMFSA-N 0 3 421.379 4.434 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2cc(C)ccc2-n2cc(C)cn2)c1 ZINC000484528905 900015895 /nfs/dbraw/zinc/01/58/95/900015895.db2.gz PJJXXIXARPCPLN-UHFFFAOYSA-N 0 3 421.545 4.093 20 0 HIADHN CC(C)Cc1ccc([C@H](CNC(=O)Nc2ccc(N3CCC3=O)cc2)N(C)C)cc1 ZINC000484547038 900028173 /nfs/dbraw/zinc/02/81/73/900028173.db2.gz WKXZJQIPSXDOLZ-QFIPXVFZSA-N 0 3 408.546 4.046 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N(C[C@@H](C)c2ccccc2)[C@@H](C)CO)C1 ZINC000484692100 900129299 /nfs/dbraw/zinc/12/92/99/900129299.db2.gz WPSWMBHQLSMEQO-OOICKAIWSA-N 0 3 409.574 4.018 20 0 HIADHN C[C@H](CN(C(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1)[C@@H](C)CO)c1ccccc1 ZINC000484692098 900129567 /nfs/dbraw/zinc/12/95/67/900129567.db2.gz WPSWMBHQLSMEQO-MDAIXWLXSA-N 0 3 409.574 4.018 20 0 HIADHN CCOc1cc(CNC(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)ccc1OC(F)F ZINC000484764337 900178713 /nfs/dbraw/zinc/17/87/13/900178713.db2.gz PSCDGOSAOVIILC-MGPUTAFESA-N 0 3 421.488 4.177 20 0 HIADHN CCc1c(NC(=O)N2CC[C@@H]3CCN(C)C[C@@H]32)cnn1-c1ccc(C(F)(F)F)cc1 ZINC000484816885 900220026 /nfs/dbraw/zinc/22/00/26/900220026.db2.gz AKTGWWDYZVPGGY-LIRRHRJNSA-N 0 3 421.467 4.011 20 0 HIADHN CCOc1c(Cl)cc(CNC(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)cc1OC ZINC000484840128 900240439 /nfs/dbraw/zinc/24/04/39/900240439.db2.gz WDDBIOYZWQJOGR-QRWLVFNGSA-N 0 3 419.953 4.238 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)NCC1(c2ccccc2C)CCOCC1)c1ccco1 ZINC000484948938 900316959 /nfs/dbraw/zinc/31/69/59/900316959.db2.gz UQDSRPSFCPMZEG-PZJWPPBQSA-N 0 3 413.562 4.065 20 0 HIADHN Cc1csc(C2(NC(=O)Nc3ccc(CCN4CCSCC4)cc3)CCC2)n1 ZINC000485018906 900365599 /nfs/dbraw/zinc/36/55/99/900365599.db2.gz RXZJEBWOFQIIIU-UHFFFAOYSA-N 0 3 416.616 4.244 20 0 HIADHN CCCOCc1ccccc1CNC(=O)Nc1ccc(N2CCN(CC)CC2)cc1C ZINC000505768613 914437815 /nfs/dbraw/zinc/43/78/15/914437815.db2.gz YBOASEBWWOZGQX-UHFFFAOYSA-N 0 3 424.589 4.385 20 0 HIADHN CCOc1cc(CN2CCC[C@@H]2CCc2ccccc2)nc2nc(C(F)(F)F)nn21 ZINC000485036457 900375352 /nfs/dbraw/zinc/37/53/52/900375352.db2.gz SWZDJQWWYBIVIE-QGZVFWFLSA-N 0 3 419.451 4.139 20 0 HIADHN Cc1cc(C)c(NC(=O)CCCN2CCCN(C(=O)c3ccsc3)CC2)c(C)c1 ZINC000485043186 900380120 /nfs/dbraw/zinc/38/01/20/900380120.db2.gz SFZANNOLGHJQFC-UHFFFAOYSA-N 0 3 413.587 4.240 20 0 HIADHN C[C@@H]1CC(C)(C)C[C@](CO)(NCC(=O)Nc2c(Cl)cccc2C(F)(F)F)C1 ZINC000485056674 900386597 /nfs/dbraw/zinc/38/65/97/900386597.db2.gz CMKXRYZKHFSMGN-KZULUSFZSA-N 0 3 406.876 4.464 20 0 HIADHN CCCN(Cc1cc(OCC)n2nc(C(F)(F)F)nc2n1)[C@@H]1CCc2ccccc21 ZINC000485073314 900393498 /nfs/dbraw/zinc/39/34/98/900393498.db2.gz PIDUPTYKMZGPPE-QGZVFWFLSA-N 0 3 419.451 4.441 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N(C)[C@H]3CCCC[C@H]3C(F)(F)F)cc2)CC1 ZINC000485076006 900395695 /nfs/dbraw/zinc/39/56/95/900395695.db2.gz SFXSXYSYJPEKII-UXHICEINSA-N 0 3 411.512 4.410 20 0 HIADHN CC(C)c1c(NC(=O)N2CC[C@@H]3CCN(C)C[C@H]32)cnn1-c1ccccc1Cl ZINC000485144104 900444343 /nfs/dbraw/zinc/44/43/43/900444343.db2.gz IWLHCQFMPIXONJ-HNAYVOBHSA-N 0 3 401.942 4.207 20 0 HIADHN CS[C@H]1CN(C(=O)Nc2cnn(-c3ccc(Cl)cc3)c2C(C)C)C[C@@H]1N(C)C ZINC000485199683 900492595 /nfs/dbraw/zinc/49/25/95/900492595.db2.gz ZJYOKWXMZOBXOO-ROUUACIJSA-N 0 3 421.998 4.158 20 0 HIADHN CC(C)c1c(NC(=O)N[C@@H](C)C2=CCN(C)CC2)cnn1-c1ccc(Cl)cc1 ZINC000485200131 900492605 /nfs/dbraw/zinc/49/26/05/900492605.db2.gz HMRWFBNWBKRGPJ-HNNXBMFYSA-N 0 3 401.942 4.421 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3cccc(NCC(F)(F)F)c3)cc2)CC1 ZINC000505791488 914457313 /nfs/dbraw/zinc/45/73/13/914457313.db2.gz VUEXODDFPNKUGT-UHFFFAOYSA-N 0 3 406.452 4.055 20 0 HIADHN C[C@@H](c1ccc([S@](C)=O)cc1)N(C)CCC(=O)Nc1cccc(C(F)(F)F)c1 ZINC000485410339 900708104 /nfs/dbraw/zinc/70/81/04/900708104.db2.gz UWTHFTTUVGLJAS-POXGOYDTSA-N 0 3 412.477 4.464 20 0 HIADHN Cc1cccc2c1ncc(C)c2N1C[C@H]2CCC[C@@]2(c2nc(-c3cnccn3)no2)C1 ZINC000485425205 900723072 /nfs/dbraw/zinc/72/30/72/900723072.db2.gz ZKSVIIBILOFDOU-MZNJEOGPSA-N 0 3 412.497 4.250 20 0 HIADHN CC(C)[C@@H](CC(=O)Nc1ccc(C(=O)NCCN2CCCC2)cc1)c1ccccc1 ZINC000485473819 900766605 /nfs/dbraw/zinc/76/66/05/900766605.db2.gz JWDGKYWMCIDGRT-HSZRJFAPSA-N 0 3 407.558 4.281 20 0 HIADHN CC[C@@H](NC[C@H](O)COc1ccc(C(C)=O)cc1)c1cc(F)cc(Br)c1 ZINC000485830123 901076666 /nfs/dbraw/zinc/07/66/66/901076666.db2.gz DISZIYLACUQJER-AZUAARDMSA-N 0 3 424.310 4.271 20 0 HIADHN C[C@@H](CNC(=O)c1ccc(NC(=O)Nc2ccccc2)s1)N1CCCC[C@@H]1C ZINC000485914601 901140437 /nfs/dbraw/zinc/14/04/37/901140437.db2.gz CAGBRKMMVQLJCQ-HOTGVXAUSA-N 0 3 400.548 4.385 20 0 HIADHN CC[C@@H](N[C@H](C)c1ccc(S(N)(=O)=O)cc1)c1cc(F)cc(Br)c1 ZINC000486095476 901283194 /nfs/dbraw/zinc/28/31/94/901283194.db2.gz NHNJTRYJHFAYEB-PIGZYNQJSA-N 0 3 415.328 4.038 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)c2ccccc2CCC(F)(F)F)c1 ZINC000486119834 901306346 /nfs/dbraw/zinc/30/63/46/901306346.db2.gz VLXWKURFNYQYDE-UHFFFAOYSA-N 0 3 408.464 4.394 20 0 HIADHN C[C@@H]1CN(C(=O)c2ccc(-c3ccc(C(C)(C)C)cc3)o2)CC[C@H]1N1CCN(C)CC1 ZINC000486154703 901342523 /nfs/dbraw/zinc/34/25/23/901342523.db2.gz SOKONRICHYUGDX-DENIHFKCSA-N 0 3 423.601 4.342 20 0 HIADHN CC(C)(C)c1cc(NC(=O)CN2CCN(C3CCCCC3)CC2)n(-c2ccccc2)n1 ZINC000486228517 901411500 /nfs/dbraw/zinc/41/15/00/901411500.db2.gz FKVHOKDJVIJKTM-UHFFFAOYSA-N 0 3 423.605 4.059 20 0 HIADHN Cc1ccc(-c2csc(NC(=O)[C@H](C)N3CCN(C4CCCCC4)CC3)n2)cc1 ZINC000486253340 901435796 /nfs/dbraw/zinc/43/57/96/901435796.db2.gz PZTZKUSOMPVJOH-SFHVURJKSA-N 0 3 412.603 4.396 20 0 HIADHN Cc1nc2c(s1)CCC[C@@H]2C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000486302669 901482661 /nfs/dbraw/zinc/48/26/61/901482661.db2.gz FJLOQFJSQRKCKL-OALUTQOASA-N 0 3 421.570 4.154 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)c1cccc(COC2CCOCC2)c1 ZINC000486455559 901614874 /nfs/dbraw/zinc/61/48/74/901614874.db2.gz LOCXHJBIWGMCGB-OAQYLSRUSA-N 0 3 414.571 4.011 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)c1cccc(COC2CCOCC2)c1 ZINC000486455557 901615305 /nfs/dbraw/zinc/61/53/05/901615305.db2.gz LOCXHJBIWGMCGB-NRFANRHFSA-N 0 3 414.571 4.011 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@H](C)c3ccc4ncsc4c3)c2)CC1 ZINC000486517060 901668088 /nfs/dbraw/zinc/66/80/88/901668088.db2.gz IERRKSVACFFHSK-MRXNPFEDSA-N 0 3 409.559 4.321 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)NC[C@H](c3ccccc3)C(F)(F)F)c2)CC1 ZINC000486541662 901690426 /nfs/dbraw/zinc/69/04/26/901690426.db2.gz RFVNUJWOMCKJSU-HXUWFJFHSA-N 0 3 420.479 4.296 20 0 HIADHN CCOc1ncc(C(=O)N(CC)[C@@H]2CCN([C@@H](C)c3ccccc3)C2)cc1Cl ZINC000486739276 901823224 /nfs/dbraw/zinc/82/32/24/901823224.db2.gz YWZNBMZNULTIQH-QFBILLFUSA-N 0 3 401.938 4.431 20 0 HIADHN COCCSCCCN1CCc2cc(OC)c(OC)cc2[C@@H]1c1ccccc1 ZINC000486810897 901868800 /nfs/dbraw/zinc/86/88/00/901868800.db2.gz KECPEYJBJBGQQE-QHCPKHFHSA-N 0 3 401.572 4.421 20 0 HIADHN Fc1ccc(-c2cc(CN3C[C@H]4CCC[C@@]4(c4nc(CC5CC5)no4)C3)on2)cc1 ZINC000486858649 901903722 /nfs/dbraw/zinc/90/37/22/901903722.db2.gz VCPNFVPYHYHCCL-UZUQRXQVSA-N 0 3 408.477 4.370 20 0 HIADHN CCCC(=O)Nc1ccc(Cl)c(NC(=O)NC[C@H](Cc2ccccc2)N(C)C)c1 ZINC000486873229 901918369 /nfs/dbraw/zinc/91/83/69/901918369.db2.gz YBMKTPOJEKTALF-SFHVURJKSA-N 0 3 416.953 4.373 20 0 HIADHN C[C@H](NC(=O)N(CCN(C)C)Cc1ccc(F)cc1)c1ccc2ncsc2c1 ZINC000486902339 901947684 /nfs/dbraw/zinc/94/76/84/901947684.db2.gz XKJXZAIPIVMBGJ-HNNXBMFYSA-N 0 3 400.523 4.270 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)CCc2ccc3ccccc3n2)cc1 ZINC000486903855 901948983 /nfs/dbraw/zinc/94/89/83/901948983.db2.gz NPXJUVFTPVOHCT-XMMPIXPASA-N 0 3 403.526 4.129 20 0 HIADHN Cc1ccc(Cc2cnc(NC(=O)N3CC[C@H]4CCN(C)C[C@H]43)s2)cc1Cl ZINC000486905212 901952021 /nfs/dbraw/zinc/95/20/21/901952021.db2.gz DSLHROJXFCKAKP-CRAIPNDOSA-N 0 3 404.967 4.254 20 0 HIADHN C[C@@H](NC(=O)N(CCN(C)C)Cc1cccc(F)c1)c1ccc2ncsc2c1 ZINC000487019048 902017808 /nfs/dbraw/zinc/01/78/08/902017808.db2.gz CUMXJMVHVORVHX-OAHLLOKOSA-N 0 3 400.523 4.270 20 0 HIADHN Brc1cccc(N2CC[C@H](NCc3cnc([C@@H]4CCCO4)s3)C2)c1 ZINC000487176578 902087253 /nfs/dbraw/zinc/08/72/53/902087253.db2.gz YLBILLDAGBFWEO-YOEHRIQHSA-N 0 3 408.365 4.126 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)N[C@@H](c1ccc(F)cc1)C(F)(F)F ZINC000487178597 902088506 /nfs/dbraw/zinc/08/85/06/902088506.db2.gz GWLWGHMXKGABRX-SFHVURJKSA-N 0 3 415.406 4.342 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)[C@@H]3CCCCCC(=O)C3)c(OCC)c2)CC1 ZINC000487350012 902156628 /nfs/dbraw/zinc/15/66/28/902156628.db2.gz CIXPAMLVEHCQKO-LJQANCHMSA-N 0 3 415.578 4.095 20 0 HIADHN C[C@H](c1cccc(N2CCCS2(=O)=O)c1)N(C)Cc1ccc(C(F)(F)F)cc1 ZINC000487425735 902204269 /nfs/dbraw/zinc/20/42/69/902204269.db2.gz GHKKRTHRHMQOSQ-OAHLLOKOSA-N 0 3 412.477 4.438 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2ccccc2COC2CCOCC2)N2CCCC2)cc1 ZINC000487435020 902209742 /nfs/dbraw/zinc/20/97/42/902209742.db2.gz DKSLNAQOZPUTNO-RUZDIDTESA-N 0 3 422.569 4.258 20 0 HIADHN Cc1cc(NC(=O)NC[C@@H]2CN(Cc3ccccc3)CCCO2)c(Cl)cc1F ZINC000487454760 902216315 /nfs/dbraw/zinc/21/63/15/902216315.db2.gz JZGFPGWACCCCJV-QGZVFWFLSA-N 0 3 405.901 4.200 20 0 HIADHN Cc1noc(C)c1COc1cccc(C(=O)N(CCN(C)C)Cc2cccc(C)c2)c1 ZINC000487530399 902236477 /nfs/dbraw/zinc/23/64/77/902236477.db2.gz BHYGJBWGKQJQTN-UHFFFAOYSA-N 0 3 421.541 4.383 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)NCc2cccc3cccnc32)N(C)C)cc1 ZINC000487778667 902359179 /nfs/dbraw/zinc/35/91/79/902359179.db2.gz CPPGLGDTTLAWGT-QFIPXVFZSA-N 0 3 406.530 4.124 20 0 HIADHN COc1cccc(CNC(=O)[C@H](C)N[C@@H](C)c2ccc(Oc3cccnc3)cc2)c1 ZINC000487890549 902432672 /nfs/dbraw/zinc/43/26/72/902432672.db2.gz BMSWWGXOFCPGCD-ROUUACIJSA-N 0 3 405.498 4.238 20 0 HIADHN COc1ccccc1CNC(=O)[C@@H](C)N[C@H](C)c1ccc(Oc2cccnc2)cc1 ZINC000487937405 902467992 /nfs/dbraw/zinc/46/79/92/902467992.db2.gz XZKISVVQCLRVDX-QZTJIDSGSA-N 0 3 405.498 4.238 20 0 HIADHN CC(=O)N(c1nc(CN2CCN(C)[C@H](C(C)C)C2)cs1)c1ccc(Cl)cc1 ZINC000487973965 902498412 /nfs/dbraw/zinc/49/84/12/902498412.db2.gz UHFVNWVKPNKVRS-IBGZPJMESA-N 0 3 406.983 4.253 20 0 HIADHN CC(C)[C@H]1CN(CC(=O)Nc2ccc(Oc3ccccc3Cl)cc2)CCN1C ZINC000487997479 902520083 /nfs/dbraw/zinc/52/00/83/902520083.db2.gz FMNCATMOCDTIJE-HXUWFJFHSA-N 0 3 401.938 4.343 20 0 HIADHN CC(C)c1cnc(-c2ccc(NC(=O)N3CCN(C4CCOCC4)C[C@H]3C)cc2)o1 ZINC000488508059 902861771 /nfs/dbraw/zinc/86/17/71/902861771.db2.gz RVVBJTDGKHERPG-QGZVFWFLSA-N 0 3 412.534 4.182 20 0 HIADHN c1sc(-c2ccc3c(c2)OCO3)nc1CN[C@H]1CCCN(Cc2ccccc2)C1 ZINC000488511019 902862952 /nfs/dbraw/zinc/86/29/52/902862952.db2.gz CRIXRRPWARKINT-IBGZPJMESA-N 0 3 407.539 4.293 20 0 HIADHN Cc1c(C(=O)N[C@H]2CCN(Cc3ccccc3)C[C@@H]2C)[nH]c2c1C(=O)CC(C)(C)C2 ZINC000488516554 902866327 /nfs/dbraw/zinc/86/63/27/902866327.db2.gz NLRACEUOCQHOQF-LPHOPBHVSA-N 0 3 407.558 4.119 20 0 HIADHN Cc1cc(OCc2ccccc2)ccc1NC(=O)N1CCN(C2CCOCC2)C[C@H]1C ZINC000488550231 902879960 /nfs/dbraw/zinc/87/99/60/902879960.db2.gz WWHHRRRYKJRZLV-HXUWFJFHSA-N 0 3 423.557 4.291 20 0 HIADHN CC(C)(C)n1ncc(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)c1-c1ccccc1 ZINC000488577304 902889699 /nfs/dbraw/zinc/88/96/99/902889699.db2.gz OUIGFBLLENIJNP-NRFANRHFSA-N 0 3 402.542 4.309 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)NC[C@H]3CCCO[C@H]3c3ccccc3)cc2)CC1 ZINC000488627543 902906905 /nfs/dbraw/zinc/90/69/05/902906905.db2.gz MPAMDUWSEPSYOO-NOZRDPDXSA-N 0 3 421.585 4.115 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)NC[C@@H]3CCCO[C@@H]3c3ccccc3)cc2)CC1 ZINC000488627545 902907394 /nfs/dbraw/zinc/90/73/94/902907394.db2.gz MPAMDUWSEPSYOO-UKILVPOCSA-N 0 3 421.585 4.115 20 0 HIADHN COC(=O)c1cc2cc(NC(=O)c3ccc(N4CCN(C(C)C)CC4)cc3)ccc2o1 ZINC000488639593 902914411 /nfs/dbraw/zinc/91/44/11/902914411.db2.gz BKJSKSRIKZBYDU-UHFFFAOYSA-N 0 3 421.497 4.002 20 0 HIADHN CN(CCCc1cc(-c2cccc(F)c2)n[nH]1)[C@H]1CCN(c2ccccc2F)C1=O ZINC000488659625 902923750 /nfs/dbraw/zinc/92/37/50/902923750.db2.gz ZMZRNTLZSWFOSP-QFIPXVFZSA-N 0 3 410.468 4.025 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)C(c1ccccc1)c1ccccc1 ZINC000488693995 902949000 /nfs/dbraw/zinc/94/90/00/902949000.db2.gz FCPAAUGHZYHXMS-UHFFFAOYSA-N 0 3 400.522 4.414 20 0 HIADHN CC(C)c1ccc(/C=C/CC(=O)Nc2ccc3oc(=O)n(CCN(C)C)c3c2)cc1 ZINC000488700138 902950114 /nfs/dbraw/zinc/95/01/14/902950114.db2.gz MTGVLNAMLNRGLL-AATRIKPKSA-N 0 3 407.514 4.322 20 0 HIADHN Cc1c(COC(C)(C)C)cccc1NC(=O)N1CCN(C2CCOCC2)C[C@H]1C ZINC000488893718 903063248 /nfs/dbraw/zinc/06/32/48/903063248.db2.gz HIRJPFDNAJMALG-QGZVFWFLSA-N 0 3 403.567 4.027 20 0 HIADHN c1sc(CCc2ccccc2)nc1CN1CCC(CCCN2CCOCC2)CC1 ZINC000506011445 914684103 /nfs/dbraw/zinc/68/41/03/914684103.db2.gz BDKCBGRCKVMCQT-UHFFFAOYSA-N 0 3 413.631 4.253 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)Nc2cccc(OC[C@H]3CCCO3)c2)CC1 ZINC000489007014 903117232 /nfs/dbraw/zinc/11/72/32/903117232.db2.gz FWGQGVGXQHVBGS-XMMPIXPASA-N 0 3 423.557 4.373 20 0 HIADHN C[C@H](N[C@@H](COc1ccccc1F)C(C)(C)C)C(=O)N[C@@H]1CCOc2ccccc21 ZINC000489025282 903127960 /nfs/dbraw/zinc/12/79/60/903127960.db2.gz DATSINFKAAXSMI-NBCNXNJRSA-N 0 3 414.521 4.237 20 0 HIADHN CCCOc1c(Br)cc(Br)cc1CNC[C@H](O)CCC ZINC000489132371 903222313 /nfs/dbraw/zinc/22/23/13/903222313.db2.gz XOADIQTYEADHLF-CYBMUJFWSA-N 0 3 409.162 4.251 20 0 HIADHN COc1ccc(OC)c(NC(=O)[C@H](C)N[C@H](COc2ccccc2F)C(C)(C)C)c1 ZINC000489143260 903228090 /nfs/dbraw/zinc/22/80/90/903228090.db2.gz XYSAJVCRBHFPHD-YCRPNKLZSA-N 0 3 418.509 4.253 20 0 HIADHN C[C@@H](C(=O)NC1CCN(CCOc2ccc(Cl)cc2)CC1)c1c(F)cccc1F ZINC000489196414 903257461 /nfs/dbraw/zinc/25/74/61/903257461.db2.gz NAEQHFQRXRCFNS-OAHLLOKOSA-N 0 3 422.903 4.381 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)NCc1sccc1Br)c1ccco1 ZINC000489199167 903259340 /nfs/dbraw/zinc/25/93/40/903259340.db2.gz RNBFWFHEHJGHEU-WCQYABFASA-N 0 3 400.342 4.032 20 0 HIADHN CN(CCN(Cc1ccccc1)C(=O)NCc1ccc(O)cc1)Cc1ccccc1 ZINC000489258436 903294161 /nfs/dbraw/zinc/29/41/61/903294161.db2.gz DBKQITXZJMDQEQ-UHFFFAOYSA-N 0 3 403.526 4.236 20 0 HIADHN O=C(Nc1cnn(-c2ncc(Cl)cc2Cl)c1)c1cccc(CN2CCCC2)c1 ZINC000489334130 903336334 /nfs/dbraw/zinc/33/63/34/903336334.db2.gz GUNADPYZIVSLCB-UHFFFAOYSA-N 0 3 416.312 4.422 20 0 HIADHN Cc1c([C@H](C)NC(=O)N(CCN(C)Cc2ccccc2)Cc2ccccc2)cnn1C ZINC000489355053 903343794 /nfs/dbraw/zinc/34/37/94/903343794.db2.gz SIVNYARDBIIWJE-FQEVSTJZSA-N 0 3 419.573 4.133 20 0 HIADHN CCN(CC1CCN(c2ccccn2)CC1)[C@H](C)C(=O)Nc1cc(Cl)ccc1F ZINC000489387307 903358935 /nfs/dbraw/zinc/35/89/35/903358935.db2.gz HEIUQTDWIFEQNE-MRXNPFEDSA-N 0 3 418.944 4.440 20 0 HIADHN CC[C@H](C)c1ccccc1NC(=O)[C@H](C)N1CCC(CCCN2CCOCC2)CC1 ZINC000506032019 914715698 /nfs/dbraw/zinc/71/56/98/914715698.db2.gz OISBKLWLUQOZCC-SFTDATJTSA-N 0 3 415.622 4.352 20 0 HIADHN C[C@H](N[C@H]1CCN(C(=O)CCc2ccccc2)C1)c1ccc(Br)c(F)c1 ZINC000489552941 903460264 /nfs/dbraw/zinc/46/02/64/903460264.db2.gz NQXPLUQKHDCSJE-YJBOKZPZSA-N 0 3 419.338 4.473 20 0 HIADHN Cc1ccc(NC(=O)N2CCC(CN3C[C@H](C)O[C@@H](C)C3)CC2)cc1OC(C)C ZINC000489576616 903474039 /nfs/dbraw/zinc/47/40/39/903474039.db2.gz JFKGHZAENFBGHT-OALUTQOASA-N 0 3 403.567 4.135 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)NCc2ccccc2OC2CCC2)CC1 ZINC000489626338 903504622 /nfs/dbraw/zinc/50/46/22/903504622.db2.gz VOAKTYRRNSTUNG-UHFFFAOYSA-N 0 3 407.558 4.424 20 0 HIADHN COc1cc(C)cc(NC(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)c1C ZINC000489701479 903548138 /nfs/dbraw/zinc/54/81/38/903548138.db2.gz KAWIKHMDLBUPIJ-ROUUACIJSA-N 0 3 403.567 4.055 20 0 HIADHN CC[C@@H](c1ccccc1)N(CC)C(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000489788687 903600303 /nfs/dbraw/zinc/60/03/03/903600303.db2.gz HUXIZMMUUNTBFH-DEOSSOPVSA-N 0 3 409.574 4.326 20 0 HIADHN CC(C)c1ccc([C@H](NC(=O)N2CC[C@H](N3CCN(C)CC3)[C@H](C)C2)C(C)C)cc1 ZINC000489867536 903640031 /nfs/dbraw/zinc/64/00/31/903640031.db2.gz AXJJDRKMSMELJP-FGCOXFRFSA-N 0 3 414.638 4.175 20 0 HIADHN Cc1nc(-c2ccc(C)cc2NC(=O)CN2C[C@@H](c3ccc(C)cc3)C[C@H]2C)n[nH]1 ZINC000490063430 903753003 /nfs/dbraw/zinc/75/30/03/903753003.db2.gz ZQSMLUZIEKTVSP-XLIONFOSSA-N 0 3 403.530 4.213 20 0 HIADHN Cc1ccc([C@H](NC[C@H](CC(C)C)N(C)C)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000490139046 903788299 /nfs/dbraw/zinc/78/82/99/903788299.db2.gz YEEUBMXXMVOWBQ-XUZZJYLKSA-N 0 3 416.631 4.362 20 0 HIADHN COc1ccc(CN[C@@H]2CCN(C(C)=O)Cc3ccccc32)cc1Br ZINC000490144894 903790979 /nfs/dbraw/zinc/79/09/79/903790979.db2.gz RBCSJFRPXZFWOV-LJQANCHMSA-N 0 3 403.320 4.041 20 0 HIADHN CCc1ccc([C@H](NCCc2ccc(O)cc2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000490145157 903791270 /nfs/dbraw/zinc/79/12/70/903791270.db2.gz SCCNRRYYANLEJR-DEOSSOPVSA-N 0 3 409.551 4.280 20 0 HIADHN CCN1CCN(c2ccc(CN[C@@H](c3ccccc3)c3ccc(C)cc3)cn2)CC1 ZINC000490158441 903799939 /nfs/dbraw/zinc/79/99/39/903799939.db2.gz RTZGKCYRFCFJND-SANMLTNESA-N 0 3 400.570 4.411 20 0 HIADHN Cc1ccc([C@H](NCCCOC2CCCC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000490164545 903804974 /nfs/dbraw/zinc/80/49/74/903804974.db2.gz OMARATMBZZILAS-QHCPKHFHSA-N 0 3 401.572 4.427 20 0 HIADHN Cc1occc1-c1cc(NC(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)no1 ZINC000490180428 903812895 /nfs/dbraw/zinc/81/28/95/903812895.db2.gz JSFXNCKSSDZLAG-UHFFFAOYSA-N 0 3 404.417 4.117 20 0 HIADHN COc1ccc(Oc2cc(CN[C@@H]3CCN(C(C)=O)Cc4ccccc43)ccn2)cc1 ZINC000490184913 903814609 /nfs/dbraw/zinc/81/46/09/903814609.db2.gz PQJVCKUHUBTFRP-XMMPIXPASA-N 0 3 417.509 4.466 20 0 HIADHN COc1cccc(C(=O)NC[C@H](c2ccccc2)N2CCC(C)CC2)c1OC(F)F ZINC000490261449 903860553 /nfs/dbraw/zinc/86/05/53/903860553.db2.gz YVFFGPMMSVIFAF-LJQANCHMSA-N 0 3 418.484 4.500 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)Nc1cc(CCOC)ccn1)c1ccc(Cl)cc1 ZINC000490263574 903861504 /nfs/dbraw/zinc/86/15/04/903861504.db2.gz YGBGXIJQNNNQIV-IBGZPJMESA-N 0 3 404.942 4.129 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)N[C@@H]1CCN(c2ccc(Cl)c(F)c2)C1 ZINC000490272111 903867975 /nfs/dbraw/zinc/86/79/75/903867975.db2.gz KQQUKVPTLDKBOI-CQSZACIVSA-N 0 3 415.896 4.296 20 0 HIADHN CC[C@H](CNC(=O)N[C@@H](c1ccccc1)c1cccnc1)N1CCc2ccccc2C1 ZINC000490285450 903875133 /nfs/dbraw/zinc/87/51/33/903875133.db2.gz JTLZCFUUOHYSDT-RPBOFIJWSA-N 0 3 414.553 4.307 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)cc1 ZINC000490315531 903897002 /nfs/dbraw/zinc/89/70/02/903897002.db2.gz UVHVQAWAAUYXGO-WMZHIEFXSA-N 0 3 422.573 4.482 20 0 HIADHN COc1cc(C)ccc1Oc1ccc(F)cc1NC(=O)N1CC[C@H]2CCN(C)C[C@H]21 ZINC000490339316 903930584 /nfs/dbraw/zinc/93/05/84/903930584.db2.gz IEGHCBKSWCGUDN-VQIMIIECSA-N 0 3 413.493 4.493 20 0 HIADHN COc1ccc(NC(=O)NC[C@@H](c2ccc(C)cc2)N(C)C)cc1Br ZINC000490356465 903949517 /nfs/dbraw/zinc/94/95/17/903949517.db2.gz WGGYWBDEIODKQL-KRWDZBQOSA-N 0 3 406.324 4.191 20 0 HIADHN Brc1ccc(CN2CCC[C@@H](c3nnc(C4CC4)[nH]3)C2)c2ncccc12 ZINC000490405074 903988953 /nfs/dbraw/zinc/98/89/53/903988953.db2.gz VEOWIEFSIVUUKI-OAHLLOKOSA-N 0 3 412.335 4.372 20 0 HIADHN C[C@@H](CN1CCCCC1)NC(=O)C(=O)Nc1ccc(Oc2cccc(Cl)c2)cc1 ZINC000490549048 904092035 /nfs/dbraw/zinc/09/20/35/904092035.db2.gz UACLFNHGRNTKFF-INIZCTEOSA-N 0 3 415.921 4.061 20 0 HIADHN O=C1C[C@H]([C@@H]2CCCCN2Cc2csc(-c3cccc(Br)c3)n2)CN1 ZINC000490668646 904164084 /nfs/dbraw/zinc/16/40/84/904164084.db2.gz CKYPCJDQKMSZSB-YOEHRIQHSA-N 0 3 420.376 4.063 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)NC[C@H]3CCCCC(F)(F)C3)CC2)C[C@@H](C)O1 ZINC000490716866 904189587 /nfs/dbraw/zinc/18/95/87/904189587.db2.gz CGTFLHQSGOLTTM-GGPKGHCWSA-N 0 3 415.569 4.123 20 0 HIADHN Cc1nc(COc2ccc(CN3CCC[C@H]3c3ccc4c(c3)OCCO4)cc2)no1 ZINC000506085744 914792169 /nfs/dbraw/zinc/79/21/69/914792169.db2.gz MBQOSGGBMVGCRA-FQEVSTJZSA-N 0 3 407.470 4.065 20 0 HIADHN CN(CCNC(=O)N[C@H](c1c[nH]c2ccccc21)C(F)(F)F)Cc1ccccc1 ZINC000490804776 904252077 /nfs/dbraw/zinc/25/20/77/904252077.db2.gz JXJPZZNCDQODMP-LJQANCHMSA-N 0 3 404.436 4.203 20 0 HIADHN CN(C)C(=O)C1CCN(Cc2cn(-c3ccccc3)nc2-c2cccc(Cl)c2)CC1 ZINC000506087428 914796054 /nfs/dbraw/zinc/79/60/54/914796054.db2.gz XPXXHFNPVNLSKE-UHFFFAOYSA-N 0 3 422.960 4.493 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)NC1CCN(c2ccccc2)CC1 ZINC000490981093 904349090 /nfs/dbraw/zinc/34/90/90/904349090.db2.gz TYPDTIPXBYKZAE-UHFFFAOYSA-N 0 3 424.614 4.068 20 0 HIADHN CCc1ccc([C@H](N[C@H](C)CN(CC)CC)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000491035347 904387774 /nfs/dbraw/zinc/38/77/74/904387774.db2.gz JJMOXPKKQDEDOF-JPYJTQIMSA-N 0 3 402.604 4.062 20 0 HIADHN CC[C@H](C)N(C)CCN[C@@H](c1cccc(S(C)(=O)=O)c1)c1ccc(C)cc1C ZINC000491050404 904395750 /nfs/dbraw/zinc/39/57/50/904395750.db2.gz HPJUCVGRTOTHFS-CVDCTZTESA-N 0 3 402.604 4.116 20 0 HIADHN Cc1ccccc1[C@@H](NC(=O)N(C)C1CCN(CCc2ccccn2)CC1)C1CC1 ZINC000491146926 904456492 /nfs/dbraw/zinc/45/64/92/904456492.db2.gz PITAQBWTDRIMQD-DEOSSOPVSA-N 0 3 406.574 4.190 20 0 HIADHN CC(C)N1CCC(N(C)S(=O)(=O)c2cc(Cl)ccc2OCCC2CC2)CC1 ZINC000491153281 904460227 /nfs/dbraw/zinc/46/02/27/904460227.db2.gz CMDUNHUFOLYLLH-UHFFFAOYSA-N 0 3 414.999 4.012 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](NC2CCN(C3CC3)CC2)c2ccc(Cl)cc2)c1 ZINC000491260922 904508080 /nfs/dbraw/zinc/50/80/80/904508080.db2.gz RHSVOYLPUKHBEB-JOCHJYFZSA-N 0 3 418.990 4.049 20 0 HIADHN Cc1cccn2c(CN3CCC[C@@H](c4nnc5ccc(C(F)(F)F)cn54)C3)cnc12 ZINC000506137730 914819116 /nfs/dbraw/zinc/81/91/16/914819116.db2.gz PPTMVZWDSBQSQZ-OAHLLOKOSA-N 0 3 414.435 4.084 20 0 HIADHN COc1ccc(CN2CCC[C@H](c3nnc4ccc(C(F)(F)F)cn43)C2)cc1OC ZINC000506138562 914819619 /nfs/dbraw/zinc/81/96/19/914819619.db2.gz SLLBJPMUGDSBAP-HNNXBMFYSA-N 0 3 420.435 4.145 20 0 HIADHN COc1ccc(CCN[C@H](c2ccc(C)cc2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000491384656 904570971 /nfs/dbraw/zinc/57/09/71/904570971.db2.gz UTUYHCCNEGAJDH-XMMPIXPASA-N 0 3 409.551 4.329 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1ccc2c(c1)CCCC(=O)N2)c1cccc(OC)c1 ZINC000491394313 904575514 /nfs/dbraw/zinc/57/55/14/904575514.db2.gz IMJKFUAZJHCBMD-JOCHJYFZSA-N 0 3 424.545 4.175 20 0 HIADHN c1csc(-c2noc(CCCN3CCN(Cc4cccc5cc[nH]c54)CC3)n2)c1 ZINC000506154408 914827085 /nfs/dbraw/zinc/82/70/85/914827085.db2.gz YQTCIGPEGITWPQ-UHFFFAOYSA-N 0 3 407.543 4.030 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)Nc2cccc(OC[C@H]3CCCO3)c2)c1 ZINC000491527191 904637418 /nfs/dbraw/zinc/63/74/18/904637418.db2.gz YLSUULOEHJNKFN-HSZRJFAPSA-N 0 3 411.546 4.149 20 0 HIADHN COCC1(CNCc2csc(-c3cccc(Br)c3)n2)CCOCC1 ZINC000491580448 904660737 /nfs/dbraw/zinc/66/07/37/904660737.db2.gz BPOYUIFSZKDXEB-UHFFFAOYSA-N 0 3 411.365 4.105 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)Nc2ccc(F)cc2Br)c1 ZINC000491685401 904684253 /nfs/dbraw/zinc/68/42/53/904684253.db2.gz NRDYCVXXSKJKBX-UHFFFAOYSA-N 0 3 408.315 4.492 20 0 HIADHN Cc1cc(C)n(-c2cccc(NC(=O)N(CCN(C)C)Cc3cccc(C)c3)c2)n1 ZINC000491757762 904693567 /nfs/dbraw/zinc/69/35/67/904693567.db2.gz PPARZTMAIUZXBT-UHFFFAOYSA-N 0 3 405.546 4.393 20 0 HIADHN COc1cc(OC)c(NC(=O)N(CCN(C)C)Cc2cccc(C)c2)cc1Cl ZINC000491832835 904706142 /nfs/dbraw/zinc/70/61/42/904706142.db2.gz BORCPYZQIHGVEF-UHFFFAOYSA-N 0 3 405.926 4.261 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)Nc3cc(Br)cc(C(F)(F)F)c3)[C@H]2C1 ZINC000491998159 904755298 /nfs/dbraw/zinc/75/52/98/904755298.db2.gz KKDMFIMBAZZUSI-YGRLFVJLSA-N 0 3 406.246 4.026 20 0 HIADHN O=S(=O)(c1ccc(CN[C@H]2CCc3cc(Cl)ccc32)cc1)N1CCCCC1 ZINC000506192758 914840114 /nfs/dbraw/zinc/84/01/14/914840114.db2.gz VBXHZGONKKVZFG-NRFANRHFSA-N 0 3 404.963 4.292 20 0 HIADHN Cc1nn(-c2ccc(Cl)c(Cl)c2)c(NC(=O)N2CC[C@@H]3CCN(C)C[C@H]32)c1C ZINC000492019231 904760863 /nfs/dbraw/zinc/76/08/63/904760863.db2.gz GYHGOSOMKHVXBW-KBXCAEBGSA-N 0 3 422.360 4.354 20 0 HIADHN Cc1cc(-c2nc3cc(F)ccc3n2C)ccc1NC(=O)N1CC[C@@H]2CCN(C)C[C@H]21 ZINC000492067491 904784527 /nfs/dbraw/zinc/78/45/27/904784527.db2.gz MAJSSDXZPAPFIA-KSFYIVLOSA-N 0 3 421.520 4.246 20 0 HIADHN CN(C)[C@@H](CNC(=O)NCc1ccnc(Oc2ccccc2F)c1)c1ccccc1 ZINC000492137365 904804046 /nfs/dbraw/zinc/80/40/46/904804046.db2.gz XQVPADDXIISVAZ-FQEVSTJZSA-N 0 3 408.477 4.115 20 0 HIADHN CC[C@H]1CCc2nc(NC(=O)c3ccc(CN4CCC(CO)CC4)cc3)sc2C1 ZINC000492179568 904810681 /nfs/dbraw/zinc/81/06/81/904810681.db2.gz DBPVTELAGWIYSF-INIZCTEOSA-N 0 3 413.587 4.115 20 0 HIADHN CC[C@H](C)[C@](C)(O)CN[C@H](c1cccc(S(C)(=O)=O)c1)c1ccc(C)cc1C ZINC000492227157 904819809 /nfs/dbraw/zinc/81/98/09/904819809.db2.gz YFXNJOLCGLIVPR-CDNPAEQRSA-N 0 3 403.588 4.183 20 0 HIADHN CC[C@H](C)[C@@](C)(O)CN[C@@H](c1cccc(S(C)(=O)=O)c1)c1ccc(C)cc1C ZINC000492227163 904820084 /nfs/dbraw/zinc/82/00/84/904820084.db2.gz YFXNJOLCGLIVPR-TZYHBYERSA-N 0 3 403.588 4.183 20 0 HIADHN CCCN(C)[C@H](CNC(=O)C(=O)Nc1nc(C(C)C)cs1)c1ccc(Cl)cc1 ZINC000506214327 914848082 /nfs/dbraw/zinc/84/80/82/914848082.db2.gz INCDHDASMXDCNR-QGZVFWFLSA-N 0 3 422.982 4.058 20 0 HIADHN Cc1ccc([C@H](NC[C@](C)(O)CCC(C)C)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000493037845 904999682 /nfs/dbraw/zinc/99/96/82/904999682.db2.gz RZGTVDKGUGLSLC-XZOQPEGZSA-N 0 3 403.588 4.265 20 0 HIADHN CCc1ccc([C@H](NC2CCN(C(C)C)CC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000493134394 905030034 /nfs/dbraw/zinc/03/00/34/905030034.db2.gz ZDDSWIMLKZWCES-DEOSSOPVSA-N 0 3 414.615 4.204 20 0 HIADHN CCC[C@H](CCO)CN[C@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000493177305 905040546 /nfs/dbraw/zinc/04/05/46/905040546.db2.gz PVDKJNLZMQVOGG-IIBYNOLFSA-N 0 3 409.979 4.221 20 0 HIADHN CC[C@@H]1CCCCN1CCN[C@H](c1ccc(C)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000493178421 905041625 /nfs/dbraw/zinc/04/16/25/905041625.db2.gz SRZUJYIJKOWIFV-ISKFKSNPSA-N 0 3 414.615 4.342 20 0 HIADHN C[C@]1(CN[C@@H](c2ccc(Cl)cc2)c2cccc(S(C)(=O)=O)c2)CCCC[C@H]1O ZINC000493180065 905042149 /nfs/dbraw/zinc/04/21/49/905042149.db2.gz XQJXJPOVGMATMV-BHIFYINESA-N 0 3 421.990 4.364 20 0 HIADHN CCc1cnc(CCN[C@H](c2ccc(C)cc2)c2cccc(S(C)(=O)=O)c2)s1 ZINC000493202486 905045731 /nfs/dbraw/zinc/04/57/31/905045731.db2.gz GQYCOSKAZZLKPZ-JOCHJYFZSA-N 0 3 414.596 4.339 20 0 HIADHN Fc1ccccc1[C@@H](NCCCO[C@H]1CCOC1)c1ccc(Br)cc1 ZINC000493250896 905066493 /nfs/dbraw/zinc/06/64/93/905066493.db2.gz SSJJYZGNWQBEDD-PXNSSMCTSA-N 0 3 408.311 4.463 20 0 HIADHN COc1ccc(OC)c(-c2nn(-c3ccccc3)cc2CN2CCC(OC)CC2)c1 ZINC000506259918 914868554 /nfs/dbraw/zinc/86/85/54/914868554.db2.gz UORSGMCPJLAJOJ-UHFFFAOYSA-N 0 3 407.514 4.167 20 0 HIADHN Fc1cccc([C@H](NCCCO[C@H]2CCOC2)c2cccc(Br)c2)c1 ZINC000493275677 905071211 /nfs/dbraw/zinc/07/12/11/905071211.db2.gz AVSRSEONBOJSPM-VQTJNVASSA-N 0 3 408.311 4.463 20 0 HIADHN CNC(=O)C1CCN(Cc2cn(Cc3ccccc3)nc2-c2ccc(Cl)cc2)CC1 ZINC000506259996 914868814 /nfs/dbraw/zinc/86/88/14/914868814.db2.gz SXFBEKKUVKHYQX-UHFFFAOYSA-N 0 3 422.960 4.210 20 0 HIADHN Cc1cc(-c2cc(C(=O)N3CC[C@H]4CCN(C)C[C@@H]43)c3c(C)noc3n2)c(C)s1 ZINC000493467104 905128913 /nfs/dbraw/zinc/12/89/13/905128913.db2.gz RVIKMKVHOUXUJR-BEFAXECRSA-N 0 3 410.543 4.043 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2CN2CCC(C(=O)N3CCCC3)CC2)o1 ZINC000506273943 914876265 /nfs/dbraw/zinc/87/62/65/914876265.db2.gz SUNHVCLPFSJKPQ-UHFFFAOYSA-N 0 3 418.541 4.275 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)c3ccc(Oc4ccc(C(F)(F)F)cn4)cc3)[C@@H]2C1 ZINC000493558001 905160349 /nfs/dbraw/zinc/16/03/49/905160349.db2.gz SNODRDHFBYBPFH-RDTXWAMCSA-N 0 3 405.420 4.059 20 0 HIADHN Cc1nn(-c2ccc(Br)cc2)c(C)c1CN1CCC(c2ncc[nH]2)CC1 ZINC000512389359 921126066 /nfs/dbraw/zinc/12/60/66/921126066.db2.gz KNKYPQRPOKZHAD-UHFFFAOYSA-N 0 3 414.351 4.354 20 0 HIADHN C[C@H](NCc1ccc(N2C[C@@H](C)O[C@@H](C)C2)nc1)c1cc(Br)cs1 ZINC000493735440 905206177 /nfs/dbraw/zinc/20/61/77/905206177.db2.gz HURZLFFSFAVBOU-MJBXVCDLSA-N 0 3 410.381 4.370 20 0 HIADHN COc1ccc(CCN(Cc2nc3oc(C)c(C)c3c(N)n2)CC(C)C)cc1OC ZINC000493742364 905211640 /nfs/dbraw/zinc/21/16/40/905211640.db2.gz ZRHXXNHRSWILGO-UHFFFAOYSA-N 0 3 412.534 4.140 20 0 HIADHN CNS(=O)(=O)c1cccc([C@H](C)N[C@@H]2CCc3cc(Br)cc(C)c32)c1 ZINC000493918512 905269894 /nfs/dbraw/zinc/26/98/94/905269894.db2.gz ZBOQRVWMYZIBFO-SCLBCKFNSA-N 0 3 423.376 4.004 20 0 HIADHN COc1ccccc1COc1cccc(NC(=O)N2CC[C@@H]3CCN(C)C[C@H]32)c1C ZINC000493920068 905272344 /nfs/dbraw/zinc/27/23/44/905272344.db2.gz MXIBVVRCAYDKML-GHTZIAJQSA-N 0 3 409.530 4.141 20 0 HIADHN COc1cccc(COc2cccc(NC(=O)N3CC[C@@H]4CCN(C)C[C@@H]43)c2C)c1 ZINC000493920772 905273420 /nfs/dbraw/zinc/27/34/20/905273420.db2.gz RFSKEPOLZACRIF-UGKGYDQZSA-N 0 3 409.530 4.141 20 0 HIADHN O=C(c1cccc(CN[C@H]2CCO[C@H]2c2ccc(F)c(F)c2)c1)N1CCCCC1 ZINC000493960938 905308482 /nfs/dbraw/zinc/30/84/82/905308482.db2.gz NTYZRLKVUHFZBQ-VXKWHMMOSA-N 0 3 400.469 4.211 20 0 HIADHN COc1cccc(Cn2ccc3ccc(NC(=O)N4CC[C@H]5CCN(C)C[C@H]54)cc32)c1 ZINC000493965845 905314960 /nfs/dbraw/zinc/31/49/60/905314960.db2.gz XAVYOQUZPIVEOP-HYBUGGRVSA-N 0 3 418.541 4.256 20 0 HIADHN Cc1cc(C[C@@H](C)N[C@@H](c2ccc(Cl)cc2)c2cccc(S(C)(=O)=O)c2)[nH]n1 ZINC000493989322 905331693 /nfs/dbraw/zinc/33/16/93/905331693.db2.gz KPNFMJLNDCLWNN-SZNDQCEHSA-N 0 3 417.962 4.085 20 0 HIADHN Cc1cc(C[C@@H](C)N[C@@H](c2ccc(Cl)cc2)c2cccc(S(C)(=O)=O)c2)n[nH]1 ZINC000493989322 905331710 /nfs/dbraw/zinc/33/17/10/905331710.db2.gz KPNFMJLNDCLWNN-SZNDQCEHSA-N 0 3 417.962 4.085 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](N[C@H]2CCOC3(CCC3)C2)c2ccc(F)c(F)c2)c1 ZINC000493989588 905333880 /nfs/dbraw/zinc/33/38/80/905333880.db2.gz LYBXTYCHNOPAQH-UWJYYQICSA-N 0 3 421.509 4.149 20 0 HIADHN C[C@H]1[C@H](NC(=O)c2cccc(CSc3nccn3C)c2)CCN1Cc1ccccc1 ZINC000493997762 905339259 /nfs/dbraw/zinc/33/92/59/905339259.db2.gz BCVLNVPQRQHFJB-PGRDOPGGSA-N 0 3 420.582 4.105 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)c2ccccc2OCc2cscn2)CCN1Cc1ccccc1 ZINC000494006250 905346026 /nfs/dbraw/zinc/34/60/26/905346026.db2.gz HFKPGDCOLROMFT-UTKZUKDTSA-N 0 3 407.539 4.115 20 0 HIADHN Cc1nc(COc2ccccc2C(=O)N[C@@H]2CCN(Cc3ccccc3)[C@H]2C)cs1 ZINC000494005599 905346127 /nfs/dbraw/zinc/34/61/27/905346127.db2.gz AUEQRMBMEBQADZ-HTAPYJJXSA-N 0 3 421.566 4.423 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)c2[nH]c3ccccc3c2Br)CCN1Cc1ccccc1 ZINC000494006864 905347768 /nfs/dbraw/zinc/34/77/68/905347768.db2.gz MEZQWPKZQRIAKF-PBHICJAKSA-N 0 3 412.331 4.323 20 0 HIADHN C[C@H]1[C@H](NC(=O)c2[nH]c3ccccc3c2Br)CCN1Cc1ccccc1 ZINC000494006866 905349570 /nfs/dbraw/zinc/34/95/70/905349570.db2.gz MEZQWPKZQRIAKF-WMLDXEAASA-N 0 3 412.331 4.323 20 0 HIADHN C[C@@H]1[C@H](NC(=O)C2(c3ccccc3Cl)CCOCC2)CCN1Cc1ccccc1 ZINC000494017696 905355227 /nfs/dbraw/zinc/35/52/27/905355227.db2.gz NNLFHDGWBQNMHO-XMSQKQJNSA-N 0 3 412.961 4.167 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)Cc2csc(Cc3ccccc3)n2)CCN1Cc1ccccc1 ZINC000494019972 905358850 /nfs/dbraw/zinc/35/88/50/905358850.db2.gz WQGWVABRKKBHAX-GCJKJVERSA-N 0 3 405.567 4.056 20 0 HIADHN C[C@@H](O)CC(C)(C)CN[C@@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000494021785 905363339 /nfs/dbraw/zinc/36/33/39/905363339.db2.gz ZVNMNVCJWIIXME-QRWLVFNGSA-N 0 3 409.979 4.220 20 0 HIADHN C[C@@H]1C[C@@H](N2CCOCC2)CN1Cc1c(-c2ccc(Cl)cc2)nc2sccn12 ZINC000512408215 921141049 /nfs/dbraw/zinc/14/10/49/921141049.db2.gz CJUUIIOSFZEIIN-CRAIPNDOSA-N 0 3 416.978 4.011 20 0 HIADHN CCCC(=O)NC[C@@H]1CCCN(Cc2c(C)nn(Cc3ccc(Cl)cc3)c2C)C1 ZINC000512409775 921142360 /nfs/dbraw/zinc/14/23/60/921142360.db2.gz OXZCGMAIGWJXPL-FQEVSTJZSA-N 0 3 416.997 4.330 20 0 HIADHN Cc1ccc(NC(=O)c2ccc(CN3CCC(CO)CC3)cc2)cc1Br ZINC000494047703 905387026 /nfs/dbraw/zinc/38/70/26/905387026.db2.gz ILNAZHIRIZUZTP-UHFFFAOYSA-N 0 3 417.347 4.214 20 0 HIADHN CCc1noc(-c2ccc(CCN[C@H](c3cnn(C)c3)c3cccc(F)c3)cc2)n1 ZINC000494056759 905395996 /nfs/dbraw/zinc/39/59/96/905395996.db2.gz RKKRKLWLKONKOY-QFIPXVFZSA-N 0 3 405.477 4.093 20 0 HIADHN CC(C)(C)N1C[C@@H](C(=O)Nc2nnc(/C=C/c3ccco3)s2)[C@H](C(F)(F)F)C1 ZINC000494121728 905466550 /nfs/dbraw/zinc/46/65/50/905466550.db2.gz KZAICXBBHKKQMD-AMRKSYTLSA-N 0 3 414.453 4.149 20 0 HIADHN C[C@@H](NC(=O)NC[C@@H](c1cccs1)N1CCCC1)c1nc(C(F)(F)F)cs1 ZINC000494219162 905548696 /nfs/dbraw/zinc/54/86/96/905548696.db2.gz HVMVUHPSEFXVMQ-NEPJUHHUSA-N 0 3 418.510 4.421 20 0 HIADHN CN(CCC(=O)N1CCc2sccc2C1)Cc1ccc(Br)c(F)c1 ZINC000494245165 905572032 /nfs/dbraw/zinc/57/20/32/905572032.db2.gz OTASMTXYNPLAFF-UHFFFAOYSA-N 0 3 411.340 4.057 20 0 HIADHN COC[C@H](NC(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1)c1ccc(Cl)cc1 ZINC000494426368 905714145 /nfs/dbraw/zinc/71/41/45/905714145.db2.gz AVYVUQADDPFGSR-NDXORKPFSA-N 0 3 401.938 4.162 20 0 HIADHN COc1ccccc1[C@H](C)NC(=O)[C@H](C)N[C@@H]1CCO[C@@H]1c1ccc(Cl)cc1 ZINC000494462727 905744542 /nfs/dbraw/zinc/74/45/42/905744542.db2.gz HDSFDLGZLCYUBI-LMOYHYAASA-N 0 3 402.922 4.034 20 0 HIADHN C[C@H](N[C@H]1CCO[C@@H]1c1ccc(Cl)cc1)C(=O)N1CCSc2ccccc21 ZINC000494476176 905757553 /nfs/dbraw/zinc/75/75/53/905757553.db2.gz UYLSMIKOYBBLJB-GZRFBZBPSA-N 0 3 402.947 4.287 20 0 HIADHN CC(C)S(=O)(=O)c1ccc(CN[C@@H]2CCO[C@@H]2c2ccc(Cl)c(F)c2)cc1 ZINC000494478078 905759003 /nfs/dbraw/zinc/75/90/03/905759003.db2.gz RWALYPPOGNPCJD-WOJBJXKFSA-N 0 3 411.926 4.281 20 0 HIADHN C[C@H](N[C@H]1CCO[C@@H]1c1ccc(Cl)cc1)C(=O)Nc1ccc(OC(F)F)cc1 ZINC000494493896 905781666 /nfs/dbraw/zinc/78/16/66/905781666.db2.gz JVHPYLBCSPOLAA-UYHISHBKSA-N 0 3 410.848 4.388 20 0 HIADHN O=C(CCNCc1cnn(Cc2ccc(C(F)(F)F)cc2)c1)Nc1ccccc1 ZINC000494582899 905848796 /nfs/dbraw/zinc/84/87/96/905848796.db2.gz QGEQBTQJKHUQRB-UHFFFAOYSA-N 0 3 402.420 4.069 20 0 HIADHN O=C(Nc1cccc(Oc2ccccn2)c1)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000494647299 905881418 /nfs/dbraw/zinc/88/14/18/905881418.db2.gz KBGKXUQVHXHHMX-UHFFFAOYSA-N 0 3 417.509 4.331 20 0 HIADHN COC[C@@H](c1ccc(Cl)cc1)N(C)C(=O)NCCCN1CCc2ccccc2C1 ZINC000494660725 905888072 /nfs/dbraw/zinc/88/80/72/905888072.db2.gz HBVFLGSIJQDWPS-QFIPXVFZSA-N 0 3 415.965 4.117 20 0 HIADHN CC(C)n1ncc2cc(CN3CCC[C@@H](CNC(=O)Nc4cccc(F)c4)C3)cnc21 ZINC000512478179 921188693 /nfs/dbraw/zinc/18/86/93/921188693.db2.gz BKSOCMRMHMQAMM-KRWDZBQOSA-N 0 3 424.524 4.185 20 0 HIADHN CC(C)[C@H](NCCC=Cc1ccc(Br)cc1)c1nc(-c2nc[nH]n2)no1 ZINC000494690119 905901791 /nfs/dbraw/zinc/90/17/91/905901791.db2.gz ZIRFSPYYGKJBCJ-QTLSWZBMSA-N 0 3 417.311 4.007 20 0 HIADHN CCOc1cc(C[NH2+]CCCN2CCc3ccccc32)cc(Br)c1[O-] ZINC000494711785 905916716 /nfs/dbraw/zinc/91/67/16/905916716.db2.gz BYAOXLRBQJJULM-UHFFFAOYSA-N 0 3 405.336 4.096 20 0 HIADHN CCc1ccc([C@H](NCC(C)(C)[C@@H](O)C(C)C)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000494716313 905918413 /nfs/dbraw/zinc/91/84/13/905918413.db2.gz WIOPLKOWIAGYSV-GOTSBHOMSA-N 0 3 417.615 4.375 20 0 HIADHN CN(C)CCN(CC1CCCCC1)C(=O)c1ccnc(SCC(F)(F)F)c1 ZINC000494715443 905918471 /nfs/dbraw/zinc/91/84/71/905918471.db2.gz PPZZNDGFFZCGLV-UHFFFAOYSA-N 0 3 403.514 4.320 20 0 HIADHN CN(C)CCN(Cc1cccc(O)c1)C(=O)c1cc(Br)ccc1Cl ZINC000494777898 905974369 /nfs/dbraw/zinc/97/43/69/905974369.db2.gz FBAIDQCOCFNEHH-UHFFFAOYSA-N 0 3 411.727 4.012 20 0 HIADHN C[C@@H](CC(=O)N(CCN(C)C)Cc1cccc(O)c1)c1cccc(C(F)(F)F)c1 ZINC000494777813 905975083 /nfs/dbraw/zinc/97/50/83/905975083.db2.gz DDSTXRJBMBNSSQ-INIZCTEOSA-N 0 3 408.464 4.495 20 0 HIADHN CN1CCN(CC(=O)N2Cc3ccccc3[C@H](c3ccccc3)C2)C2(CCCCC2)C1 ZINC000494893807 906068740 /nfs/dbraw/zinc/06/87/40/906068740.db2.gz QHQKPFLDBIWURI-VWLOTQADSA-N 0 3 417.597 4.111 20 0 HIADHN O=C(CN[C@H](C[C@H]1CCOC1)c1ccc(F)cc1)Nc1ccc(Br)cc1 ZINC000494905777 906081001 /nfs/dbraw/zinc/08/10/01/906081001.db2.gz FGJRQFLPMCSHGN-AUUYWEPGSA-N 0 3 421.310 4.284 20 0 HIADHN O=C(Nc1cccc(Br)c1)C1CCN(C/C=C/c2ccncc2)CC1 ZINC000494927783 906099739 /nfs/dbraw/zinc/09/97/39/906099739.db2.gz BCYGUNLRKRCXFR-NSCUHMNNSA-N 0 3 400.320 4.208 20 0 HIADHN CC(C)C(=O)NC[C@@H]1CCCN(Cc2c[nH]nc2-c2ccc(C(F)(F)F)cc2)C1 ZINC000494949500 906121504 /nfs/dbraw/zinc/12/15/04/906121504.db2.gz DQANVBYGMPWMME-HNNXBMFYSA-N 0 3 408.468 4.080 20 0 HIADHN COc1ccccc1CC(C)(C)C(=O)NCC1(N2CCSCC2)CCCCC1 ZINC000494949260 906121922 /nfs/dbraw/zinc/12/19/22/906121922.db2.gz KDRNOCDPTZXOBT-UHFFFAOYSA-N 0 3 404.620 4.132 20 0 HIADHN COc1ccc([C@H](NC[C@H]2C[C@H](O)CN2Cc2ccccc2)c2ccccc2)cc1 ZINC000494968882 906137294 /nfs/dbraw/zinc/13/72/94/906137294.db2.gz LMHLKQYBKIULHH-RMTZWNOUSA-N 0 3 402.538 4.010 20 0 HIADHN C[C@H](NC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C)[C@H]1OCCc2sccc21 ZINC000494986369 906150149 /nfs/dbraw/zinc/15/01/49/906150149.db2.gz PTRDLDBMTICCPP-NPPFBWRTSA-N 0 3 413.587 4.056 20 0 HIADHN C[C@H](CNC(=O)N[C@H](C)c1nc(C(F)(F)F)cs1)N(C)Cc1ccccc1 ZINC000494996483 906158886 /nfs/dbraw/zinc/15/88/86/906158886.db2.gz IPWNNJWKPUXVDB-CHWSQXEVSA-N 0 3 400.470 4.043 20 0 HIADHN Cc1c2ccccc2oc1[C@H](NC(=O)N1CCN(C2CCOCC2)C[C@H]1C)C(C)C ZINC000495036213 906190488 /nfs/dbraw/zinc/19/04/88/906190488.db2.gz LPQBCLVJTGETQM-VGOFRKELSA-N 0 3 413.562 4.333 20 0 HIADHN CN(C)[C@H](CNC(=O)N(C)Cc1ccc(Br)c(F)c1)c1ccccc1 ZINC000495039245 906195020 /nfs/dbraw/zinc/19/50/20/906195020.db2.gz PQPYRMWIZFQAHW-GOSISDBHSA-N 0 3 408.315 4.033 20 0 HIADHN O=C(Nc1ccnc(-c2ccccc2)c1)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000495040063 906196408 /nfs/dbraw/zinc/19/64/08/906196408.db2.gz LCBWPVQMGYFJOM-UHFFFAOYSA-N 0 3 401.510 4.205 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(NC(=O)c2ccncc2)cc1)c1ccc(C(=O)N(C)C)cc1 ZINC000495046805 906201746 /nfs/dbraw/zinc/20/17/46/906201746.db2.gz HCOPUVAXXYEVIJ-MSOLQXFVSA-N 0 3 416.525 4.448 20 0 HIADHN Brc1ccccc1N1CC[C@H](N[C@@H](c2nc[nH]n2)C2CCCCC2)C1 ZINC000495074207 906222039 /nfs/dbraw/zinc/22/20/39/906222039.db2.gz ZWXGCEBUYDKOPP-MAUKXSAKSA-N 0 3 404.356 4.057 20 0 HIADHN CCN1CCN(c2ccccc2CNCc2ccncc2OCc2ccccc2)CC1 ZINC000512532981 921219817 /nfs/dbraw/zinc/21/98/17/921219817.db2.gz XYWXSFCCFHBQJI-UHFFFAOYSA-N 0 3 416.569 4.092 20 0 HIADHN C[C@@H](C(=O)NCCCN1CCN(C)C[C@@H]1c1ccccc1)c1ccc(Cl)s1 ZINC000495182640 906291701 /nfs/dbraw/zinc/29/17/01/906291701.db2.gz HVICHHIHZSCPIL-SJLPKXTDSA-N 0 3 405.995 4.000 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Nc1ccn(-c2ccccc2Cl)n1 ZINC000495205784 906306629 /nfs/dbraw/zinc/30/66/29/906306629.db2.gz XHTAZFJUDDERKB-UHFFFAOYSA-N 0 3 403.939 4.183 20 0 HIADHN COc1cccc(C(=O)CCCC(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)c1 ZINC000495365512 906407082 /nfs/dbraw/zinc/40/70/82/906407082.db2.gz GTXIKYBVQNIVEJ-UHFFFAOYSA-N 0 3 423.557 4.217 20 0 HIADHN CC(C)[C@@H](NCC(=O)Nc1cccc(Br)c1)c1ccc2[nH]c(=O)oc2c1 ZINC000495369100 906409064 /nfs/dbraw/zinc/40/90/64/906409064.db2.gz NYLRZNSPNVSZJU-GOSISDBHSA-N 0 3 418.291 4.221 20 0 HIADHN O=S(=O)(NCc1cccc(F)c1)c1cccc(CN[C@@H]2CCCc3ccccc32)c1 ZINC000495513639 906493518 /nfs/dbraw/zinc/49/35/18/906493518.db2.gz IGEHWDDLGFJILA-XMMPIXPASA-N 0 3 424.541 4.471 20 0 HIADHN CS[C@@H]1CN(C(=O)c2ccc(-c3nc4ccccc4s3)s2)C[C@H]1N(C)C ZINC000495608651 906512850 /nfs/dbraw/zinc/51/28/50/906512850.db2.gz UQQKJMZPCXLGEI-CXAGYDPISA-N 0 3 403.598 4.142 20 0 HIADHN O=C(Nc1ccc(O)cc1)C1CCN(Cc2ccc(OCC(F)(F)F)cc2)CC1 ZINC000512580864 921247817 /nfs/dbraw/zinc/24/78/17/921247817.db2.gz DWSIORNVNUYJOF-UHFFFAOYSA-N 0 3 408.420 4.184 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)[C@H]1C[C@H]1c1ccc(Br)cc1 ZINC000496000391 906594860 /nfs/dbraw/zinc/59/48/60/906594860.db2.gz UHGMXDOMHDCXMD-PMACEKPBSA-N 0 3 401.348 4.143 20 0 HIADHN CC(C)N(CCN(C)C)C(=O)c1nn(-c2ccc(Cl)cc2Cl)c2c1CCC2 ZINC000496015238 906598043 /nfs/dbraw/zinc/59/80/43/906598043.db2.gz SPORLKPCSJVIOB-UHFFFAOYSA-N 0 3 409.361 4.080 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)c1cc(Br)ccc1F ZINC000496224154 906632625 /nfs/dbraw/zinc/63/26/25/906632625.db2.gz FWXZNPBIFGWTGI-QGZVFWFLSA-N 0 3 420.326 4.110 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)CSCc1cccc(Cl)c1 ZINC000496242166 906636777 /nfs/dbraw/zinc/63/67/77/906636777.db2.gz DNYJUZSIKFYGOD-NRFANRHFSA-N 0 3 418.006 4.481 20 0 HIADHN O=C(COc1ccc(Cl)cc1)NC1CCC(N[C@@H]2COc3ccc(F)cc32)CC1 ZINC000512595220 921253753 /nfs/dbraw/zinc/25/37/53/921253753.db2.gz LLNLAVMGQKIURY-LBXVMSDZSA-N 0 3 418.896 4.009 20 0 HIADHN CC(C)(CCCc1ccccc1)C(=O)Nc1ccc(C(=O)NCCN2CCCC2)cc1 ZINC000496313697 906654372 /nfs/dbraw/zinc/65/43/72/906654372.db2.gz PMXAJZPUPXBIFP-UHFFFAOYSA-N 0 3 421.585 4.500 20 0 HIADHN Cc1nn(-c2ccc(F)cc2F)c(C)c1CN1CCC(C(=O)N[C@@H](C)C(C)C)CC1 ZINC000512599570 921255141 /nfs/dbraw/zinc/25/51/41/921255141.db2.gz FUSOAQLYJSBMCN-HNNXBMFYSA-N 0 3 418.532 4.140 20 0 HIADHN CC(C)[C@@H](C)NC(=O)C1CCN(CC2=Cc3cc(Br)ccc3OC2)CC1 ZINC000512599484 921255260 /nfs/dbraw/zinc/25/52/60/921255260.db2.gz DLIPHNIOBYAVQE-OAHLLOKOSA-N 0 3 421.379 4.098 20 0 HIADHN Cc1c(C(=O)N(CCN(C)C)Cc2ccccc2F)cnn1-c1ccc(Cl)cc1 ZINC000496356726 906664645 /nfs/dbraw/zinc/66/46/45/906664645.db2.gz KZDYFXAGUWOQIJ-UHFFFAOYSA-N 0 3 414.912 4.177 20 0 HIADHN Cc1cc(C)n(Cc2cccc(C(=O)NC[C@@H](c3cccs3)N3CCCC3)c2)n1 ZINC000496534213 906705855 /nfs/dbraw/zinc/70/58/55/906705855.db2.gz MMZJQMPGPKFSHR-NRFANRHFSA-N 0 3 408.571 4.177 20 0 HIADHN CCOc1cc(CN2CC[C@H](CO)C2)ccc1OCCOc1cccc(Cl)c1 ZINC000512616047 921262256 /nfs/dbraw/zinc/26/22/56/921262256.db2.gz APEHEWHBNMTLTF-SFHVURJKSA-N 0 3 405.922 4.011 20 0 HIADHN Cc1noc(C)c1CSCC(=O)N(CCN1CCCC1)Cc1ccc(Cl)cc1 ZINC000496816636 906760676 /nfs/dbraw/zinc/76/06/76/906760676.db2.gz MCEFUXNPGFBEFI-UHFFFAOYSA-N 0 3 421.994 4.303 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)COc2ccccc2-c2ccccc2)CC1 ZINC000497355905 906848971 /nfs/dbraw/zinc/84/89/71/906848971.db2.gz IPALVGHRUCKONA-UHFFFAOYSA-N 0 3 404.510 4.448 20 0 HIADHN Cc1noc(C)c1COc1cccc(C(=O)N(Cc2ccco2)C2CCN(C)CC2)c1 ZINC000497356405 906849233 /nfs/dbraw/zinc/84/92/33/906849233.db2.gz YLQZKNRICQSMEE-UHFFFAOYSA-N 0 3 423.513 4.200 20 0 HIADHN CC(C)c1nc(C(=O)NC[C@@H](c2ccccc2)N(C)C)nn1-c1ccccc1Cl ZINC000497374964 906862791 /nfs/dbraw/zinc/86/27/91/906862791.db2.gz SPCGFWVUSDUHKI-IBGZPJMESA-N 0 3 411.937 4.077 20 0 HIADHN COc1cc([C@H](C)NC(=O)N2CC[C@H]3CCN(C)C[C@@H]32)ccc1OCc1ccccc1 ZINC000497375717 906863998 /nfs/dbraw/zinc/86/39/98/906863998.db2.gz CABYOJXXVAOOCK-DWLFOUALSA-N 0 3 423.557 4.071 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)CCc2nc(-c3ccc(C(C)C)cc3)no2)o1 ZINC000497379194 906866979 /nfs/dbraw/zinc/86/69/79/906866979.db2.gz WHZLKOLSCPYENN-UHFFFAOYSA-N 0 3 424.545 4.284 20 0 HIADHN CN1C[C@H](NC(=O)Cc2csc(-c3ccc(Cl)s3)n2)[C@@H](c2ccccc2)C1 ZINC000497413275 906889569 /nfs/dbraw/zinc/88/95/69/906889569.db2.gz AQJIGMNNJGECKN-CVEARBPZSA-N 0 3 417.987 4.282 20 0 HIADHN Cc1cc(C(=O)N[C@@H]2CN(C)C[C@H]2c2ccccc2)ccc1NC(=O)c1cccs1 ZINC000497416821 906891808 /nfs/dbraw/zinc/89/18/08/906891808.db2.gz LLOALBYXTNYFGT-PZJWPPBQSA-N 0 3 419.550 4.136 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)Nc2cc(C)c(Br)cc2F)cc1 ZINC000497451436 906927512 /nfs/dbraw/zinc/92/75/12/906927512.db2.gz OZRUXZAYJJTTOW-SFHVURJKSA-N 0 3 424.314 4.330 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCCC1CCOCC1)c1ccc(C(F)(F)F)cc1 ZINC000512670887 921282786 /nfs/dbraw/zinc/28/27/86/921282786.db2.gz CLDZKWRJUZAICG-IBGZPJMESA-N 0 3 415.500 4.204 20 0 HIADHN CCCCOc1ccc(CN2CCC(C(=O)NCc3ccc(OC)cc3)CC2)cc1 ZINC000512687368 921287370 /nfs/dbraw/zinc/28/73/70/921287370.db2.gz QLAMJSNEUBLFQI-UHFFFAOYSA-N 0 3 410.558 4.403 20 0 HIADHN O=C(Nc1ccccc1)C1CCN(C[C@@H](O)COc2ccc(Cl)cc2Cl)CC1 ZINC000497586177 907066165 /nfs/dbraw/zinc/06/61/65/907066165.db2.gz XYZGDQHBEDKRFR-GOSISDBHSA-N 0 3 423.340 4.084 20 0 HIADHN O[C@H](COc1cc(Cl)ccc1Cl)CN1CCC[C@H]1c1ccc2c(c1)OCCO2 ZINC000497587614 907068776 /nfs/dbraw/zinc/06/87/76/907068776.db2.gz UFVHFZPLLCCBHD-WMZOPIPTSA-N 0 3 424.324 4.341 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)c2cc3ccc(Br)cc3[nH]2)C1 ZINC000512704255 921292820 /nfs/dbraw/zinc/29/28/20/921292820.db2.gz YFZUJRVENYVCDT-RDTXWAMCSA-N 0 3 412.331 4.496 20 0 HIADHN CC(C)(C)[C@H](CN1CCc2ccccc2C1)NC(=O)N1CCCC[C@H]1c1cn[nH]c1 ZINC000497657387 907148347 /nfs/dbraw/zinc/14/83/47/907148347.db2.gz MPVAXXKCLGIMBL-VXKWHMMOSA-N 0 3 409.578 4.119 20 0 HIADHN CN1CCC[C@H](CNC(=O)c2occ3c2CCOC3)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000512745226 921300577 /nfs/dbraw/zinc/30/05/77/921300577.db2.gz WOCUJADMJODVSM-BEFAXECRSA-N 0 3 422.447 4.184 20 0 HIADHN C[C@@H]1CN(CCCN[C@H](c2ccco2)c2ccc(Br)cc2)C[C@@H](C)O1 ZINC000497830166 907311468 /nfs/dbraw/zinc/31/14/68/907311468.db2.gz YGXNVGVFIPHVLG-QINHECLXSA-N 0 3 407.352 4.220 20 0 HIADHN OCCn1nccc1C1CCN(Cc2cccc(OCCCc3ccccc3)c2)CC1 ZINC000512801079 921314097 /nfs/dbraw/zinc/31/40/97/921314097.db2.gz JGOQYIHECHQRCP-UHFFFAOYSA-N 0 3 419.569 4.267 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)N2CCC(c3ccncc3)CC2)N(C)C)cc1 ZINC000512809805 921315904 /nfs/dbraw/zinc/31/59/04/921315904.db2.gz WFRCXKAIAPQULU-HSZRJFAPSA-N 0 3 410.562 4.061 20 0 HIADHN CN(C)Cc1cccc(NC(=O)Cc2ccc(OCCOc3ccccc3)cc2)c1 ZINC000497894476 907368262 /nfs/dbraw/zinc/36/82/62/907368262.db2.gz ONFQNJWQDJIROZ-UHFFFAOYSA-N 0 3 404.510 4.387 20 0 HIADHN CN(C)Cc1cccc(NC(=O)c2cnn(-c3ccccc3F)c2C(F)(F)F)c1 ZINC000497933645 907398629 /nfs/dbraw/zinc/39/86/29/907398629.db2.gz JYJUBHDNBOTHCF-UHFFFAOYSA-N 0 3 406.383 4.344 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)[C@@H](C)Cc3cccc(F)c3)CC2)c1 ZINC000497940486 907407726 /nfs/dbraw/zinc/40/77/26/907407726.db2.gz UBIWZPYBNBRWSW-NRFANRHFSA-N 0 3 411.565 4.031 20 0 HIADHN CCN(C(=O)c1cnn(Cc2ccccc2)c1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000497950113 907418950 /nfs/dbraw/zinc/41/89/50/907418950.db2.gz HCPYFSINQHXHAD-HYBUGGRVSA-N 0 3 402.542 4.229 20 0 HIADHN CCN(C(=O)c1ccc(NC(=O)C2CC2)cc1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000497950633 907420898 /nfs/dbraw/zinc/42/08/98/907420898.db2.gz JMHTXWRISUQLGY-FDDCHVKYSA-N 0 3 405.542 4.333 20 0 HIADHN CCOC1CC2(C1)CCN([C@@H]1CCCN(Cc3cccc(C(F)(F)F)c3)C1=O)C2 ZINC000512818539 921322763 /nfs/dbraw/zinc/32/27/63/921322763.db2.gz VETCOJXNGIVTMF-OBXNSHGQSA-N 0 3 410.480 4.087 20 0 HIADHN CCN(C(=O)c1ccc(N2CCCC2=O)cc1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000497966880 907434251 /nfs/dbraw/zinc/43/42/51/907434251.db2.gz SAVYVEQXZHRHRC-XXBNENTESA-N 0 3 405.542 4.111 20 0 HIADHN C[C@@H](NC(=O)CC1CCCCC1)C(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1 ZINC000497993401 907471695 /nfs/dbraw/zinc/47/16/95/907471695.db2.gz NRIDPKUFUJUDAR-QUCCMNQESA-N 0 3 419.635 4.112 20 0 HIADHN Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)N[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000497995638 907474063 /nfs/dbraw/zinc/47/40/63/907474063.db2.gz CVWUWCZMCHLHCW-KNQAVFIVSA-N 0 3 422.573 4.338 20 0 HIADHN Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000497995636 907474316 /nfs/dbraw/zinc/47/43/16/907474316.db2.gz CVWUWCZMCHLHCW-DENIHFKCSA-N 0 3 422.573 4.338 20 0 HIADHN CCN(C(=O)CSCc1c(C)noc1C)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000498004708 907490086 /nfs/dbraw/zinc/49/00/86/907490086.db2.gz PMVIDYAUHCWNTC-XLIONFOSSA-N 0 3 401.576 4.209 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)[C@H]1C[C@@H]1c1ccccc1C(F)(F)F ZINC000498054856 907565601 /nfs/dbraw/zinc/56/56/01/907565601.db2.gz NHIORKGCPNQFDK-UXHICEINSA-N 0 3 402.460 4.374 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)c3cc(NCc4ccccc4)nc4ccccc43)[C@H]2C1 ZINC000498105422 907613069 /nfs/dbraw/zinc/61/30/69/907613069.db2.gz KLIUAGIIKXEYLK-XXBNENTESA-N 0 3 400.526 4.013 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)NC[C@@H](c3c[nH]c4ccccc43)c3ccccc3)[C@@H]2C1 ZINC000498112522 907622811 /nfs/dbraw/zinc/62/28/11/907622811.db2.gz ARUKLOFYIWFXAV-ZILOHOTNSA-N 0 3 402.542 4.035 20 0 HIADHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)c1cccc2ncccc21 ZINC000498126335 907641955 /nfs/dbraw/zinc/64/19/55/907641955.db2.gz NOPUGMZJDJEIAK-UHFFFAOYSA-N 0 3 412.331 4.201 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)[C@H](C)Oc3ccc(F)cc3Cl)cc2)CC1 ZINC000498201494 907734444 /nfs/dbraw/zinc/73/44/44/907734444.db2.gz NJDHZRQTPVSIBD-INIZCTEOSA-N 0 3 419.928 4.023 20 0 HIADHN Cc1cccc([C@@H](NC(=O)NC[C@@H](C)N(C)Cc2ccccc2)c2ccccn2)c1 ZINC000498237956 907772348 /nfs/dbraw/zinc/77/23/48/907772348.db2.gz HHLPZPNKPVAJBD-HYBUGGRVSA-N 0 3 402.542 4.299 20 0 HIADHN O=C(NC[C@H]1CCCN1Cc1ccccc1)N[C@@H](c1cccc(F)c1)c1ccccn1 ZINC000498241921 907777573 /nfs/dbraw/zinc/77/75/73/907777573.db2.gz CEDZXCOQOPYJGZ-VWNXMTODSA-N 0 3 418.516 4.274 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)C(=O)Nc2cc(C(F)F)ccc2Cl)c1 ZINC000498253962 907789734 /nfs/dbraw/zinc/78/97/34/907789734.db2.gz ORIQAHOBTJVQKF-UHFFFAOYSA-N 0 3 423.891 4.115 20 0 HIADHN C[C@H](SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)NCCN1CCC[C@H](C)C1 ZINC000498344424 907849816 /nfs/dbraw/zinc/84/98/16/907849816.db2.gz MTROSQXORSGYFC-HOTGVXAUSA-N 0 3 421.994 4.465 20 0 HIADHN CC[C@H](NCc1ccc(OCc2ccc(F)cc2)c(OC)c1)[C@@H](O)C(F)(F)F ZINC000498353210 907853899 /nfs/dbraw/zinc/85/38/99/907853899.db2.gz LQTPQMJPJACDGT-QFBILLFUSA-N 0 3 401.400 4.205 20 0 HIADHN CC[C@@H](NCc1ccc(OCc2cn3cccc(C)c3n2)cc1)[C@H](O)C(F)(F)F ZINC000498369929 907861439 /nfs/dbraw/zinc/86/14/39/907861439.db2.gz YCDRBKBWHLJFEJ-MOPGFXCFSA-N 0 3 407.436 4.013 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)[C@H]1CCO[C@@H]1c1ccnn1Cc1ccccc1 ZINC000512854081 921358856 /nfs/dbraw/zinc/35/88/56/921358856.db2.gz GZSREWLBZIGLHE-URXFXBBRSA-N 0 3 418.541 4.018 20 0 HIADHN CNC(=O)[C@@H]1CCC[C@@H]1NCc1cc(Br)ccc1OCc1ccccc1 ZINC000498376355 907866192 /nfs/dbraw/zinc/86/61/92/907866192.db2.gz SJVCFTYJBGDSTD-MOPGFXCFSA-N 0 3 417.347 4.032 20 0 HIADHN CC(C)(C)[C@@H](NCc1ccc([C@@]2(C)NC(=O)NC2=O)cc1)c1cc2ccccc2o1 ZINC000498433465 907898850 /nfs/dbraw/zinc/89/88/50/907898850.db2.gz DWDUTIARPFOSME-GBXCKJPGSA-N 0 3 405.498 4.364 20 0 HIADHN CC(C)(C)[C@H](NCc1ccc([C@]2(C)NC(=O)NC2=O)cc1)c1cc2ccccc2o1 ZINC000498433470 907899202 /nfs/dbraw/zinc/89/92/02/907899202.db2.gz DWDUTIARPFOSME-YKSBVNFPSA-N 0 3 405.498 4.364 20 0 HIADHN CN(C)CCN(C(=O)c1oc2ccccc2c1CSc1ncccn1)C1CCCC1 ZINC000498456038 907919620 /nfs/dbraw/zinc/91/96/20/907919620.db2.gz ZHSKRCHVQCLRSN-UHFFFAOYSA-N 0 3 424.570 4.462 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)c2cccc(NC(=O)c3cccs3)c2)CC1 ZINC000498465594 907933660 /nfs/dbraw/zinc/93/36/60/907933660.db2.gz SJOIWTXBGBOMIO-UHFFFAOYSA-N 0 3 423.538 4.330 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCc2sccc2C1)c1n[nH]c2ccccc21 ZINC000498480904 907950521 /nfs/dbraw/zinc/95/05/21/907950521.db2.gz LKGVREOQSXGOGA-FQEVSTJZSA-N 0 3 402.523 4.154 20 0 HIADHN O=C(CCCCc1nc2ccccc2s1)NCC1(N2CCSCC2)CCCC1 ZINC000498495220 907967628 /nfs/dbraw/zinc/96/76/28/907967628.db2.gz HXPSSSBLNMZZMO-UHFFFAOYSA-N 0 3 417.644 4.487 20 0 HIADHN C[C@@H]1CC[C@H](C)N1CC(=O)NCc1cn(Cc2ccccc2)nc1-c1ccccc1 ZINC000498606912 908054780 /nfs/dbraw/zinc/05/47/80/908054780.db2.gz OYTLWJSWYFEFQS-BGYRXZFFSA-N 0 3 402.542 4.087 20 0 HIADHN COc1cc(C(=O)N2CCN(C)CC[C@H]2C)ccc1OCc1ccc(Cl)cc1 ZINC000498703156 908127142 /nfs/dbraw/zinc/12/71/42/908127142.db2.gz ABFSRPSJHQHZBH-MRXNPFEDSA-N 0 3 402.922 4.094 20 0 HIADHN Cc1ccccc1-c1cc(C(=O)N2CCN(C)CC[C@@H]2C)c2cnn(C(C)C)c2n1 ZINC000498711290 908136214 /nfs/dbraw/zinc/13/62/14/908136214.db2.gz SUYSRUACMQPWLC-SFHVURJKSA-N 0 3 405.546 4.154 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)[C@@H]1C[C@@H]1c1cccc(Br)c1 ZINC000498724822 908152272 /nfs/dbraw/zinc/15/22/72/908152272.db2.gz NGIONQGHEWSGAQ-WOJBJXKFSA-N 0 3 419.338 4.282 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)c1sc(C(C)(C)C)nc1C ZINC000498731574 908158812 /nfs/dbraw/zinc/15/88/12/908158812.db2.gz ZPSZRMQJVQDKKS-SFHVURJKSA-N 0 3 400.592 4.271 20 0 HIADHN C[C@@H](NCc1ccc(-c2ccc(Br)cc2)s1)C1(S(C)(=O)=O)CC1 ZINC000512890472 921384934 /nfs/dbraw/zinc/38/49/34/921384934.db2.gz LAQZUKMLNSUKSQ-GFCCVEGCSA-N 0 3 414.390 4.233 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)N2CC[C@H](CC(F)(F)F)C2)N(C)C)cc1 ZINC000512900936 921393168 /nfs/dbraw/zinc/39/31/68/921393168.db2.gz GARLAMPURDUEJE-QAPCUYQASA-N 0 3 401.473 4.060 20 0 HIADHN CCc1cccc(C)c1NC(=O)N1CCC[C@@H](CN2CCN(c3ccccn3)CC2)C1 ZINC000498846204 908250590 /nfs/dbraw/zinc/25/05/90/908250590.db2.gz WTHYKXITJDIGGG-NRFANRHFSA-N 0 3 421.589 4.019 20 0 HIADHN Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)N[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000498857722 908261297 /nfs/dbraw/zinc/26/12/97/908261297.db2.gz STTPKHJTPRGVIP-KNQAVFIVSA-N 0 3 420.557 4.188 20 0 HIADHN FC(F)(F)Oc1cccc([C@@H](NCc2cnc(N3CCOCC3)s2)C2CC2)c1 ZINC000512904378 921396617 /nfs/dbraw/zinc/39/66/17/921396617.db2.gz SJFOQWYSVWJYPH-KRWDZBQOSA-N 0 3 413.465 4.119 20 0 HIADHN C[C@H](NC(=O)NCc1nccn1CCCc1ccccc1)[C@H](c1ccccc1)N(C)C ZINC000498891171 908295966 /nfs/dbraw/zinc/29/59/66/908295966.db2.gz MHKAZJCOMAVTDB-GBXCKJPGSA-N 0 3 419.573 4.007 20 0 HIADHN Clc1cccc(Cl)c1-c1nnc(CN2CCC[C@@H](c3nc(C4CC4)n[nH]3)C2)o1 ZINC000498921086 908330552 /nfs/dbraw/zinc/33/05/52/908330552.db2.gz ASDRVWRFNRMIGI-GFCCVEGCSA-N 0 3 419.316 4.419 20 0 HIADHN Clc1cccc(Cl)c1-c1nnc(CN2CCC[C@@H](c3n[nH]c(C4CC4)n3)C2)o1 ZINC000498921086 908330566 /nfs/dbraw/zinc/33/05/66/908330566.db2.gz ASDRVWRFNRMIGI-GFCCVEGCSA-N 0 3 419.316 4.419 20 0 HIADHN CCN1C[C@H](C)N(CC(=O)Nc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C[C@H]1C ZINC000498924054 908333683 /nfs/dbraw/zinc/33/36/83/908333683.db2.gz JVRSOPRJYMNIDR-NEPJUHHUSA-N 0 3 411.390 4.077 20 0 HIADHN Cc1cc(C(=O)[C@H](C)N2CCC[C@@H](c3nc(C4CC4)n[nH]3)C2)c(C)n1Cc1ccco1 ZINC000498928982 908338269 /nfs/dbraw/zinc/33/82/69/908338269.db2.gz LSEWYXOVYDYFGS-PKOBYXMFSA-N 0 3 421.545 4.193 20 0 HIADHN Cc1cc(C(=O)[C@H](C)N2CCC[C@@H](c3n[nH]c(C4CC4)n3)C2)c(C)n1Cc1ccco1 ZINC000498928982 908338283 /nfs/dbraw/zinc/33/82/83/908338283.db2.gz LSEWYXOVYDYFGS-PKOBYXMFSA-N 0 3 421.545 4.193 20 0 HIADHN CCN1C[C@H](C)N(Cc2csc(N(C(C)=O)c3ccc(C)cc3C)n2)C[C@@H]1C ZINC000498928542 908338680 /nfs/dbraw/zinc/33/86/80/908338680.db2.gz YDIQJFMUWRBDCD-ROUUACIJSA-N 0 3 400.592 4.359 20 0 HIADHN Cc1cccc([C@@H](NC(=O)N(CCN(C)C)Cc2ccc(F)cc2)c2ccccn2)c1 ZINC000499010907 908387645 /nfs/dbraw/zinc/38/76/45/908387645.db2.gz BPDTVBFQBDXVIL-XMMPIXPASA-N 0 3 420.532 4.392 20 0 HIADHN COc1ccc(COCc2cccc(NC(=O)N[C@@H](C)C3=CCN(C)CC3)c2)cc1 ZINC000512916011 921410086 /nfs/dbraw/zinc/41/00/86/921410086.db2.gz AITAYRPVTUJJDI-SFHVURJKSA-N 0 3 409.530 4.184 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)N(C)[C@H](C)Cc2ccc(O)cc2)N(C)C)cc1 ZINC000512916615 921410795 /nfs/dbraw/zinc/41/07/95/921410795.db2.gz DXDKNMYGDWZLPI-WZONZLPQSA-N 0 3 413.562 4.055 20 0 HIADHN CC(C)(C)c1nc(CCNC(=O)NC[C@H](c2cccs2)N2CCCC2)cs1 ZINC000499092979 908455804 /nfs/dbraw/zinc/45/58/04/908455804.db2.gz WAECEOWMJQQZBI-MRXNPFEDSA-N 0 3 406.621 4.181 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N2CCC[C@@H]2[C@@H]2C[C@@H](C)CC[C@H]2O)N2CCCC2)cc1 ZINC000499140497 908497333 /nfs/dbraw/zinc/49/73/33/908497333.db2.gz HKDSSGICGSQABI-SMQFJCFBSA-N 0 3 413.606 4.103 20 0 HIADHN C[C@H]1CN(C(=O)NCC2(C3CCCCC3)CCCCC2)CC[C@@H]1N1CCN(C)CC1 ZINC000499148667 908508303 /nfs/dbraw/zinc/50/83/03/908508303.db2.gz FZJWWVYFDSMGKR-GMAHTHKFSA-N 0 3 418.670 4.185 20 0 HIADHN C[C@H](NC(=O)Nc1ccc(OCc2ccccn2)c(Cl)c1)C1=CCN(C)CC1 ZINC000512923278 921416571 /nfs/dbraw/zinc/41/65/71/921416571.db2.gz RWZCIXHKBJWRMB-HNNXBMFYSA-N 0 3 400.910 4.086 20 0 HIADHN O=C(N[C@H](c1cccc(F)c1)c1ccccn1)N1CCCN(Cc2ccccc2)CC1 ZINC000499323703 908698876 /nfs/dbraw/zinc/69/88/76/908698876.db2.gz LZYHXGIVPWTGSO-XMMPIXPASA-N 0 3 418.516 4.228 20 0 HIADHN C[C@@H](OCc1ccccc1)C(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1 ZINC000499360418 908729414 /nfs/dbraw/zinc/72/94/14/908729414.db2.gz MDHWLDWFBDCVDP-QGZVFWFLSA-N 0 3 408.464 4.201 20 0 HIADHN CN(C)c1cc(C(=O)N(CCN2CCCC2)Cc2ccc(Cl)c(Cl)c2)ccn1 ZINC000499374070 908742436 /nfs/dbraw/zinc/74/24/36/908742436.db2.gz DZAJPEUUKSZGEU-UHFFFAOYSA-N 0 3 421.372 4.193 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2ccc(OC[C@@H]3CCCO3)cc2)N2CCCC2)cc1 ZINC000499395713 908755207 /nfs/dbraw/zinc/75/52/07/908755207.db2.gz BPXOAPRNOHNHAL-ZEQRLZLVSA-N 0 3 408.542 4.120 20 0 HIADHN CSc1nc(C(C)C)nc(C)c1C(=O)N(C)C1CCN(Cc2ccccc2)CC1 ZINC000499529163 908831213 /nfs/dbraw/zinc/83/12/13/908831213.db2.gz KFLNXPRANORMIB-UHFFFAOYSA-N 0 3 412.603 4.367 20 0 HIADHN C[C@@H]1C[C@@H](NCc2nnc3c(Cl)cc(C(F)(F)F)cn23)CN1Cc1ccccc1 ZINC000499661582 908867963 /nfs/dbraw/zinc/86/79/63/908867963.db2.gz DAKUIVWVAAJCAW-CZUORRHYSA-N 0 3 423.870 4.154 20 0 HIADHN CC1CCN([C@H](CNC(=O)Cc2cccc(OC(F)F)c2)c2cccs2)CC1 ZINC000499682742 908876003 /nfs/dbraw/zinc/87/60/03/908876003.db2.gz ZUYBXFGZCDJLHT-GOSISDBHSA-N 0 3 408.514 4.481 20 0 HIADHN COc1cccc2c1CC[C@@H]2NC(=O)NC[C@H](c1ccc(OC(C)C)cc1)N(C)C ZINC000499700179 908881376 /nfs/dbraw/zinc/88/13/76/908881376.db2.gz WCARSEIWCHQXJF-FCHUYYIVSA-N 0 3 411.546 4.072 20 0 HIADHN CC[C@@H]1CCCCN1CCNC(=O)CSc1nnc(-c2ccc3ccccc3c2)o1 ZINC000499704358 908882819 /nfs/dbraw/zinc/88/28/19/908882819.db2.gz AMRRPFLSDSCQPW-HXUWFJFHSA-N 0 3 424.570 4.363 20 0 HIADHN CC(C)(C)CC(=O)N1CCC(NCc2cc(F)c(F)cc2Br)CC1 ZINC000513007259 921471473 /nfs/dbraw/zinc/47/14/73/921471473.db2.gz MCOXOBNBWULCEM-UHFFFAOYSA-N 0 3 403.311 4.244 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N[C@H](C)Cc1cc(C)nn1-c1ccccc1)c1ccco1 ZINC000499968087 909409990 /nfs/dbraw/zinc/40/99/90/909409990.db2.gz JSZCAYKQQFAKHH-NJNPRVFISA-N 0 3 423.561 4.133 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N[C@@H](C)Cc1cc(C)nn1-c1ccccc1)c1ccco1 ZINC000499968088 909410403 /nfs/dbraw/zinc/41/04/03/909410403.db2.gz JSZCAYKQQFAKHH-NPPFBWRTSA-N 0 3 423.561 4.133 20 0 HIADHN CN(C(=O)Nc1nc2c(ccc(F)c2F)s1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000499968482 909412013 /nfs/dbraw/zinc/41/20/13/909412013.db2.gz QSOULHGUQIBIPY-CQSZACIVSA-N 0 3 402.470 4.313 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)C(C)(C)COCc3ccccc3)c(C)c2)CC1 ZINC000499976907 909420955 /nfs/dbraw/zinc/42/09/55/909420955.db2.gz FWPILDRPANQFEB-UHFFFAOYSA-N 0 3 409.574 4.318 20 0 HIADHN CCN(C(=O)c1cc(C)n(-c2ccccc2)n1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000499998902 909450699 /nfs/dbraw/zinc/45/06/99/909450699.db2.gz HIHOXHSZUUYQGO-OFNKIYASSA-N 0 3 402.542 4.478 20 0 HIADHN O=C(NC[C@H]1CCCN(Cc2ccc(OCc3ccccn3)cc2)C1)c1ccccc1 ZINC000513045524 921504937 /nfs/dbraw/zinc/50/49/37/921504937.db2.gz FQIRDANNVOJPSM-JOCHJYFZSA-N 0 3 415.537 4.303 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N[C@@H]1CC(C)(C)Oc2cc(F)ccc21)c1ccco1 ZINC000500152912 909630096 /nfs/dbraw/zinc/63/00/96/909630096.db2.gz CUJAYFZOJZTOEO-BMGDILEWSA-N 0 3 403.498 4.450 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Cn1ncc2ccccc21)c1ccc(C(F)(F)F)cc1 ZINC000500195936 909686290 /nfs/dbraw/zinc/68/62/90/909686290.db2.gz YZVFYWUWDIYBFW-FQEVSTJZSA-N 0 3 418.463 4.254 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@H](C)N[C@@H](C)c2ccc(SC)cc2)cc1OC ZINC000500226488 909717116 /nfs/dbraw/zinc/71/71/16/909717116.db2.gz QCNWGIJUAKIWAW-HOTGVXAUSA-N 0 3 402.560 4.123 20 0 HIADHN C[C@@H](NC(=O)N[C@@H](CN1CCCC1)c1ccccc1)c1ccccc1OC(F)F ZINC000500381752 909826613 /nfs/dbraw/zinc/82/66/13/909826613.db2.gz GFLTYJGQGZIDCX-APWZRJJASA-N 0 3 403.473 4.485 20 0 HIADHN CC[C@@H](NCc1cccc2cccnc21)c1ccccc1OCC(=O)N1CCCC1 ZINC000513075713 921529172 /nfs/dbraw/zinc/52/91/72/921529172.db2.gz OHIPPHGVNSXKAO-JOCHJYFZSA-N 0 3 403.526 4.477 20 0 HIADHN C/C(=C\c1ccccc1C(F)(F)F)CNCC(=O)N[C@H]1CCOc2ccccc21 ZINC000500527362 909908136 /nfs/dbraw/zinc/90/81/36/909908136.db2.gz KMTIOGKMPQVHJI-QZEGLACASA-N 0 3 404.432 4.338 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N[C@H](c1ccccn1)c1ccccc1OC)c1ccco1 ZINC000500534484 909911595 /nfs/dbraw/zinc/91/15/95/909911595.db2.gz HKXFWPNYVBGAPP-NYDSKATKSA-N 0 3 422.529 4.201 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)C1CCC(OC[C@H]2CCCO2)CC1 ZINC000500583236 909944570 /nfs/dbraw/zinc/94/45/70/909944570.db2.gz OUADTLSTFHKQCS-ZQHBMWIYSA-N 0 3 416.606 4.014 20 0 HIADHN CCN1CCN(Cc2ccc(CNC(=O)N[C@H](c3ccc(C)cc3)C3CC3)cc2)CC1 ZINC000500637218 909983672 /nfs/dbraw/zinc/98/36/72/909983672.db2.gz CXUCNTYPVNQBMJ-RUZDIDTESA-N 0 3 420.601 4.083 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)N[C@@H](C)c2ccccc2Cl)CC1 ZINC000500656370 909999239 /nfs/dbraw/zinc/99/92/39/909999239.db2.gz UVMNTOAJCRRJGK-SFHVURJKSA-N 0 3 414.981 4.038 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)N[C@@H](C)c2cc3ccccc3o2)CC1 ZINC000500657037 910000862 /nfs/dbraw/zinc/00/08/62/910000862.db2.gz WHTIRDYYQFWOCN-IBGZPJMESA-N 0 3 420.557 4.131 20 0 HIADHN CC(C)CN(C(=O)CSCc1cc(-c2cccs2)on1)C1CCN(C)CC1 ZINC000500684699 910019482 /nfs/dbraw/zinc/01/94/82/910019482.db2.gz YCTJDKHGENNYPJ-UHFFFAOYSA-N 0 3 407.605 4.215 20 0 HIADHN C[C@@H](NC(=O)C(=O)Nc1cc(C(F)F)ccc1Cl)[C@@H](c1ccccc1)N(C)C ZINC000500689508 910024407 /nfs/dbraw/zinc/02/44/07/910024407.db2.gz WYOLEVOFLHNRAJ-PXAZEXFGSA-N 0 3 409.864 4.024 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)N2CCC[C@H]2c2ccc(F)cc2)CC1 ZINC000500702366 910031824 /nfs/dbraw/zinc/03/18/24/910031824.db2.gz VRZRTEAPJIGGHJ-DEOSSOPVSA-N 0 3 424.564 4.010 20 0 HIADHN CC[C@H](C)c1ccccc1N1C[C@@H](C(=O)N(CC(C)C)C2CCN(C)CC2)CC1=O ZINC000500720043 910039885 /nfs/dbraw/zinc/03/98/85/910039885.db2.gz KKILNOKAXRRPFK-PMACEKPBSA-N 0 3 413.606 4.132 20 0 HIADHN CC1(C)CN(Cc2ccccc2)CC[C@H]1NC(=O)CCC(=O)c1ccc(F)c(F)c1 ZINC000513093209 921543119 /nfs/dbraw/zinc/54/31/19/921543119.db2.gz XWRANDUVWNCMQG-JOCHJYFZSA-N 0 3 414.496 4.345 20 0 HIADHN C[C@H](Sc1cc(Cl)ccc1Cl)C(=O)N(CCN(C)C)Cc1ccccn1 ZINC000500762259 910066300 /nfs/dbraw/zinc/06/63/00/910066300.db2.gz NMGGIPIXXPFAMW-AWEZNQCLSA-N 0 3 412.386 4.459 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)CCCOc1ccc(Cl)cc1Cl ZINC000500761223 910066352 /nfs/dbraw/zinc/06/63/52/910066352.db2.gz DLCLUWSUWCQGDE-UHFFFAOYSA-N 0 3 410.345 4.138 20 0 HIADHN CCN(Cc1ccccc1)c1ccc(C(=O)N(CCN(C)C)Cc2ccccn2)cc1 ZINC000500778375 910074299 /nfs/dbraw/zinc/07/42/99/910074299.db2.gz VYJMVDGXDQGUFM-UHFFFAOYSA-N 0 3 416.569 4.312 20 0 HIADHN O=C(NC[C@H]1CCCN(Cc2ccc(OCC(F)(F)F)cc2)C1)c1ccccc1 ZINC000513101544 921549767 /nfs/dbraw/zinc/54/97/67/921549767.db2.gz SFIWWAOOJLIPNS-GOSISDBHSA-N 0 3 406.448 4.270 20 0 HIADHN COc1cc(CNCc2ccc(C[S@](C)=O)cc2)ccc1OCc1ccccc1 ZINC000513102542 921550462 /nfs/dbraw/zinc/55/04/62/921550462.db2.gz ZUEHVBAMSNUMKR-LJAQVGFWSA-N 0 3 409.551 4.443 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)c2ccc(-c3noc(C(F)F)n3)cc2)CN1Cc1ccccc1 ZINC000500855036 910128420 /nfs/dbraw/zinc/12/84/20/910128420.db2.gz CKMGOMJLEVLRRJ-KBXCAEBGSA-N 0 3 412.440 4.067 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)Cc2ccc(F)c(Br)c2)C1 ZINC000500870267 910142800 /nfs/dbraw/zinc/14/28/00/910142800.db2.gz VCBYYUKIZXZGKD-PBHICJAKSA-N 0 3 405.311 4.082 20 0 HIADHN Cc1cc(C)n(Cc2ccc(C(=O)N[C@H]3CCN([C@H](C)c4ccccc4)C3)cc2)n1 ZINC000500876845 910149992 /nfs/dbraw/zinc/14/99/92/910149992.db2.gz SQUGHITUBINRMK-YKSBVNFPSA-N 0 3 402.542 4.114 20 0 HIADHN Cc1nn(Cc2ccccc2Cl)c(C)c1CNCCNC(=O)CC1CCCCC1 ZINC000500886503 910159841 /nfs/dbraw/zinc/15/98/41/910159841.db2.gz JDQNPVJAQWIWJR-UHFFFAOYSA-N 0 3 416.997 4.378 20 0 HIADHN O=C(NC[C@H]1CCCN(Cc2ccc(OCc3cccnc3)cc2)C1)c1ccccc1 ZINC000513105680 921553261 /nfs/dbraw/zinc/55/32/61/921553261.db2.gz AAXPARWMJDDYKQ-JOCHJYFZSA-N 0 3 415.537 4.303 20 0 HIADHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)[C@@H]1Cc2ccccc2S1 ZINC000500956671 910206557 /nfs/dbraw/zinc/20/65/57/910206557.db2.gz XNUCTQBCQCIKGB-IBGZPJMESA-N 0 3 419.388 4.056 20 0 HIADHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)c1ccc2ccccc2n1 ZINC000500961107 910208173 /nfs/dbraw/zinc/20/81/73/910208173.db2.gz TVHUABKHTNLEKV-UHFFFAOYSA-N 0 3 412.331 4.201 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CCO[C@H](c2ccc(F)cc2)C1)c1ccsc1 ZINC000501132734 910313948 /nfs/dbraw/zinc/31/39/48/910313948.db2.gz IOTZKODRBJKNKO-PMACEKPBSA-N 0 3 405.539 4.053 20 0 HIADHN O=C([C@H]1CC12CCN(Cc1ccccc1OCc1cccnc1)CC2)N1CCCCC1 ZINC000501141672 910321119 /nfs/dbraw/zinc/32/11/19/910321119.db2.gz JGDLYCUQVARRJM-HSZRJFAPSA-N 0 3 419.569 4.275 20 0 HIADHN CC[C@@H](CNC(=O)Nc1ccccc1Br)N1CCc2ccccc2C1 ZINC000501353693 910488535 /nfs/dbraw/zinc/48/85/35/910488535.db2.gz ZALIXSMTTWRSFZ-KRWDZBQOSA-N 0 3 402.336 4.408 20 0 HIADHN O=C1COc2ccc(CN(Cc3cccc(Br)c3)CC3CC3)cc2N1 ZINC000513145312 921582693 /nfs/dbraw/zinc/58/26/93/921582693.db2.gz QVMVWTQMGUTDKD-UHFFFAOYSA-N 0 3 401.304 4.192 20 0 HIADHN COc1cccc(CN(Cc2cc(OC)cc3c2O[C@@H](C)C3)C2CCC(O)CC2)c1 ZINC000513144630 921583405 /nfs/dbraw/zinc/58/34/05/921583405.db2.gz MMHJBBBLNYQQMP-YTXWROIDSA-N 0 3 411.542 4.333 20 0 HIADHN CCCN(CCN1CCCCC1)Cc1nnc(-c2c(C)onc2-c2ccccc2)o1 ZINC000513158413 921590541 /nfs/dbraw/zinc/59/05/41/921590541.db2.gz HLBBQLKSQGERRD-UHFFFAOYSA-N 0 3 409.534 4.398 20 0 HIADHN CCCN(CCN1CCCCC1)CC(=O)Nc1c(Cl)cccc1C(F)(F)F ZINC000513162196 921593756 /nfs/dbraw/zinc/59/37/56/921593756.db2.gz WVOMZTSJCAXPCH-UHFFFAOYSA-N 0 3 405.892 4.495 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)N[C@H]2CCCOc3cc(Cl)ccc32)cc1 ZINC000501555163 910657836 /nfs/dbraw/zinc/65/78/36/910657836.db2.gz NNOYDCFZFHESJH-VQTJNVASSA-N 0 3 417.937 4.164 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N[C@H]1CCO[C@H]1c1ccc(Cl)cc1)c1ccco1 ZINC000501562396 910670293 /nfs/dbraw/zinc/67/02/93/910670293.db2.gz ASTSNZAUIXIDQO-DEYWJSPQSA-N 0 3 405.926 4.192 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N[C@@H]1CCO[C@@H]1c1ccc(Cl)c(F)c1)c1ccco1 ZINC000501585908 910691879 /nfs/dbraw/zinc/69/18/79/910691879.db2.gz RKIDPOQEJNYULA-DOFJYSBOSA-N 0 3 423.916 4.331 20 0 HIADHN Cn1ccnc1SCc1cccc(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)c1 ZINC000501692256 910762269 /nfs/dbraw/zinc/76/22/69/910762269.db2.gz VHQHAPTXJJAAMS-QFIPXVFZSA-N 0 3 420.582 4.279 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)NCc2ccc(-c3csc(C)n3)o2)N(C)C)cc1 ZINC000501709877 910777189 /nfs/dbraw/zinc/77/71/89/910777189.db2.gz NHPNOGPGYKGHNG-HXUWFJFHSA-N 0 3 412.559 4.376 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1CCCc2cn(C3CCCC3)nc21)[C@H](c1ccccc1)N(C)C ZINC000501766713 910821953 /nfs/dbraw/zinc/82/19/53/910821953.db2.gz HJHONABRDFVFJZ-AMHTUMDSSA-N 0 3 409.578 4.366 20 0 HIADHN CN(Cc1ccccc1C(F)(F)F)C(=O)NCCCN1CCc2ccccc2C1 ZINC000501778720 910832938 /nfs/dbraw/zinc/83/29/38/910832938.db2.gz VGTNLAVURNQKDS-UHFFFAOYSA-N 0 3 405.464 4.295 20 0 HIADHN CCN(C(=O)CN[C@@]1(Cc2ccc(C(F)(F)F)cc2)CCOC1)c1ccccc1 ZINC000513197741 921616269 /nfs/dbraw/zinc/61/62/69/921616269.db2.gz YEHHGMGCRUIQSW-OAQYLSRUSA-N 0 3 406.448 4.050 20 0 HIADHN C[C@H](NC(=O)N1CCc2nc(-c3ccccc3Cl)sc2C1)C1=CCN(C)CC1 ZINC000501819202 910867086 /nfs/dbraw/zinc/86/70/86/910867086.db2.gz BQOSVVVFLUGWJV-AWEZNQCLSA-N 0 3 416.978 4.182 20 0 HIADHN Cc1cc(C)n(-c2ccccc2NC(=O)N[C@H](CN2CCCC2)c2ccccc2)n1 ZINC000501838241 910879139 /nfs/dbraw/zinc/87/91/39/910879139.db2.gz XCWPOHPCNFVLEZ-JOCHJYFZSA-N 0 3 403.530 4.448 20 0 HIADHN CCSc1ccc(CC(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)cc1 ZINC000501874006 910897608 /nfs/dbraw/zinc/89/76/08/910897608.db2.gz PVVMIKMKWVDTLK-OALUTQOASA-N 0 3 404.620 4.079 20 0 HIADHN C[C@@H]1[C@H](NC(=O)N[C@@H]2CCO[C@H](c3ccc(F)cc3)C2)CCN1Cc1ccccc1 ZINC000501949092 910936676 /nfs/dbraw/zinc/93/66/76/910936676.db2.gz NHZMAGHNNDVAGZ-LUGPXAIHSA-N 0 3 411.521 4.008 20 0 HIADHN CCN(C(=O)c1cc(Br)cn1C)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000501952528 910939667 /nfs/dbraw/zinc/93/96/67/910939667.db2.gz FTQJLMMWAZLFOS-CRAIPNDOSA-N 0 3 404.352 4.085 20 0 HIADHN CCN(C(=O)[C@H](C)Oc1cccc(C(C)=O)c1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000501954018 910941013 /nfs/dbraw/zinc/94/10/13/910941013.db2.gz DCSONAVMYROUJL-RFWXGWTQSA-N 0 3 408.542 4.341 20 0 HIADHN CC(=O)Nc1cccc(NC(=O)[C@H](C)NCC2(c3c(F)cccc3F)CCCC2)c1 ZINC000501977319 910958236 /nfs/dbraw/zinc/95/82/36/910958236.db2.gz DTDKMHUMECHCSW-HNNXBMFYSA-N 0 3 415.484 4.352 20 0 HIADHN COc1ccc(NC(=O)[C@@H](C)NCC2(c3c(F)cccc3F)CCCC2)c(OC)c1 ZINC000501987246 910965917 /nfs/dbraw/zinc/96/59/17/910965917.db2.gz VGNCCRNPABAWNF-OAHLLOKOSA-N 0 3 418.484 4.411 20 0 HIADHN COc1ccc(O[C@@H](C)C(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)cc1 ZINC000502013377 910977467 /nfs/dbraw/zinc/97/74/67/910977467.db2.gz IXUVVURVMZAZAT-INIZCTEOSA-N 0 3 424.463 4.072 20 0 HIADHN CCCN(CCC)C(=O)c1cccc(C(=O)NC[C@H]2CCCN2Cc2ccccc2)c1 ZINC000513216469 921631341 /nfs/dbraw/zinc/63/13/41/921631341.db2.gz CQITYKRSENAKJD-XMMPIXPASA-N 0 3 421.585 4.343 20 0 HIADHN COc1cc(C(=O)NC[C@@H]2CCCN2Cc2ccccc2)ccc1OC1CCCC1 ZINC000513217310 921631947 /nfs/dbraw/zinc/63/19/47/921631947.db2.gz KMKDRUJNMXRMKM-NRFANRHFSA-N 0 3 408.542 4.411 20 0 HIADHN Cn1cc(NC(=O)N2CCCN(CCCc3ccccc3)CC2)c(-c2ccccc2)n1 ZINC000502173393 911095936 /nfs/dbraw/zinc/09/59/36/911095936.db2.gz KCUXUVKTEBVDLT-UHFFFAOYSA-N 0 3 417.557 4.260 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N[C@H](C)c2cc(OC)c(OC)cc2C)N(C)C)cc1 ZINC000502270591 911218569 /nfs/dbraw/zinc/21/85/69/911218569.db2.gz RIDBWLNRRGKRGX-UTKZUKDTSA-N 0 3 413.562 4.238 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N[C@@H](C)c2cc(OC)c(OC)cc2C)N(C)C)cc1 ZINC000502270592 911219339 /nfs/dbraw/zinc/21/93/39/911219339.db2.gz RIDBWLNRRGKRGX-UWJYYQICSA-N 0 3 413.562 4.238 20 0 HIADHN C[C@H](NC(=O)N(Cc1ccco1)C1CCN(C)CC1)c1ccc(OC(F)F)cc1 ZINC000502308344 911273711 /nfs/dbraw/zinc/27/37/11/911273711.db2.gz GNRUSAUEOPVWHZ-HNNXBMFYSA-N 0 3 407.461 4.248 20 0 HIADHN COc1cccc(NC(=O)C[C@@H](C)N[C@@H]2CCOc3c(Br)cccc32)c1 ZINC000502320719 911294079 /nfs/dbraw/zinc/29/40/79/911294079.db2.gz VKDQAZHPRRRYQR-FZKQIMNGSA-N 0 3 419.319 4.288 20 0 HIADHN C[C@@H](CC(=O)Nc1cccc(F)c1)N[C@H]1CCOc2c(Br)cccc21 ZINC000502346453 911327260 /nfs/dbraw/zinc/32/72/60/911327260.db2.gz PTYBLWLULWABBI-SJCJKPOMSA-N 0 3 407.283 4.419 20 0 HIADHN Cc1cccc(OCCN2CCC[C@H](c3n[nH]cc3NC(=O)c3ccccc3)C2)c1 ZINC000502348966 911329150 /nfs/dbraw/zinc/32/91/50/911329150.db2.gz PZAGIBBVWSNTOL-FQEVSTJZSA-N 0 3 404.514 4.229 20 0 HIADHN CN(C)CCN(C(=O)c1cccc(-n2nccc2C(F)(F)F)c1)c1ccccc1 ZINC000502356569 911339028 /nfs/dbraw/zinc/33/90/28/911339028.db2.gz CJYMYQGFVUUDBL-UHFFFAOYSA-N 0 3 402.420 4.100 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)[C@@H]1C[C@H]1c1cccc(Br)c1 ZINC000513258238 921662550 /nfs/dbraw/zinc/66/25/50/921662550.db2.gz YDTPWENZYBOPRF-PCCBWWKXSA-N 0 3 413.359 4.333 20 0 HIADHN COc1cc(CCNC(=O)CN2C[C@@H](C)C[C@@H]2c2ccccc2)ccc1OC(F)F ZINC000513259365 921664072 /nfs/dbraw/zinc/66/40/72/921664072.db2.gz AZDMTDLMGDZINQ-QFBILLFUSA-N 0 3 418.484 4.038 20 0 HIADHN O=C(CN[C@@H]1CCCC[C@H]1OC(F)F)N1N=C(c2cccs2)C[C@@H]1c1ccco1 ZINC000502482043 911476349 /nfs/dbraw/zinc/47/63/49/911476349.db2.gz PBNSXRBLJVCCTR-FVQBIDKESA-N 0 3 423.485 4.159 20 0 HIADHN COc1ccc(NC(=O)C[C@H](C)N[C@@H](C)c2ccccc2OC(F)F)c(OC)c1 ZINC000502501281 911503898 /nfs/dbraw/zinc/50/38/98/911503898.db2.gz LOLQITDYYDQWNU-KBPBESRZSA-N 0 3 408.445 4.373 20 0 HIADHN COc1ccc(NC(=O)C[C@@H](C)N[C@H](C)c2ccccc2OC(F)F)c(OC)c1 ZINC000502501287 911505490 /nfs/dbraw/zinc/50/54/90/911505490.db2.gz LOLQITDYYDQWNU-ZIAGYGMSSA-N 0 3 408.445 4.373 20 0 HIADHN COc1cc(Cl)c(C)cc1NC(=O)CN[C@@]1(Cc2ccc(Cl)cc2)CCOC1 ZINC000502542075 911549361 /nfs/dbraw/zinc/54/93/61/911549361.db2.gz MKQVOVSDCKBJNE-OAQYLSRUSA-N 0 3 423.340 4.240 20 0 HIADHN C[C@H](c1ccc(F)c(F)c1)N(C)C(=O)CN[C@]1(Cc2ccc(Cl)cc2)CCOC1 ZINC000502553404 911562661 /nfs/dbraw/zinc/56/26/61/911562661.db2.gz SJNWJNLIODUZTR-QRQCRPRQSA-N 0 3 422.903 4.129 20 0 HIADHN Cc1cccc(Cc2cnc(NC(=O)CN[C@@H]3CCCC[C@H]3OC(F)F)s2)c1 ZINC000502565128 911571805 /nfs/dbraw/zinc/57/18/05/911571805.db2.gz ZBWDMPSZXDITDJ-IAGOWNOFSA-N 0 3 409.502 4.121 20 0 HIADHN O=S1(=O)CC[C@@H](NC[C@@H]2CCCC(F)(F)C2)c2cc(Br)ccc21 ZINC000502573044 911578471 /nfs/dbraw/zinc/57/84/71/911578471.db2.gz CTJRKJZKEPMCLD-BXUZGUMPSA-N 0 3 408.308 4.083 20 0 HIADHN CC(C)[C@H](NCC(=O)N1CCC[C@H]1c1ccc2c(c1)OCCO2)c1ccc(F)cc1 ZINC000502593657 911597391 /nfs/dbraw/zinc/59/73/91/911597391.db2.gz TXBWDQSPNUPJOP-RDPSFJRHSA-N 0 3 412.505 4.247 20 0 HIADHN CC[C@@H]1c2ccsc2CCN1C(=O)CN[C@@]1(Cc2ccc(Cl)cc2)CCOC1 ZINC000502597354 911600639 /nfs/dbraw/zinc/60/06/39/911600639.db2.gz USYGKGDTKGAZHD-DENIHFKCSA-N 0 3 418.990 4.229 20 0 HIADHN CC[C@@H](NC(=O)N[C@H]1CCN(Cc2ccccc2)C1)c1ccccc1OC(F)F ZINC000502646234 911682592 /nfs/dbraw/zinc/68/25/92/911682592.db2.gz BHQVCRPEQRZFMD-PKOBYXMFSA-N 0 3 403.473 4.313 20 0 HIADHN CC[C@H](NC(=O)NC[C@H](Cc1ccccc1)N(C)C)c1ccccc1OC(F)F ZINC000502648199 911688176 /nfs/dbraw/zinc/68/81/76/911688176.db2.gz JCWMHPYQNBJXBX-HKUYNNGSSA-N 0 3 405.489 4.211 20 0 HIADHN CCN1CC[C@H]2OCCN(C(=O)c3ccc(Oc4ccc(C(C)(C)C)cc4)nc3)[C@H]2C1 ZINC000502719830 911750984 /nfs/dbraw/zinc/75/09/84/911750984.db2.gz DAJRDMPRPWMDOB-FCHUYYIVSA-N 0 3 423.557 4.107 20 0 HIADHN Cc1ccc(-c2nc(CC(=O)NC[C@H]3CCCN3Cc3ccccc3)cs2)cc1 ZINC000513294283 921691660 /nfs/dbraw/zinc/69/16/60/921691660.db2.gz PDCPBIFCPUPFIY-JOCHJYFZSA-N 0 3 405.567 4.442 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)c3cc4ccccc4nc3C)CC2)c1 ZINC000513300631 921696469 /nfs/dbraw/zinc/69/64/69/921696469.db2.gz MEYNNUZSDCOKEX-UHFFFAOYSA-N 0 3 416.569 4.184 20 0 HIADHN COc1ccc(S[C@@H](C)C(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)cc1 ZINC000502882039 911882891 /nfs/dbraw/zinc/88/28/91/911882891.db2.gz TXPPLCZEXBKVTN-SFHVURJKSA-N 0 3 413.587 4.345 20 0 HIADHN CCO[C@H](C)c1ncc(C(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)s1 ZINC000502904249 911893120 /nfs/dbraw/zinc/89/31/20/911893120.db2.gz NDUYRUYOMPFYSU-MRXNPFEDSA-N 0 3 402.564 4.023 20 0 HIADHN CC1(C)CN(C(=O)NC[C@H]2CN(Cc3ccccc3)CCCO2)[C@@H]1c1cccs1 ZINC000502910236 911897331 /nfs/dbraw/zinc/89/73/31/911897331.db2.gz KKJFHISILIPQEZ-PZJWPPBQSA-N 0 3 413.587 4.132 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)C(C)(C)c2csc(-c3cccs3)n2)C[C@H](C)O1 ZINC000503022058 911993630 /nfs/dbraw/zinc/99/36/30/911993630.db2.gz JZZCJLUXGCVKIZ-IYBDPMFKSA-N 0 3 421.632 4.155 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N[C@@H](c1ccccc1)c1ccncc1 ZINC000503026347 911997412 /nfs/dbraw/zinc/99/74/12/911997412.db2.gz SOBARIHZASJVPQ-IRLDBZIGSA-N 0 3 406.555 4.369 20 0 HIADHN CCc1ccc([C@@H](NC(=O)CN(C)CCCn2ccnc2C)c2cccs2)cc1 ZINC000503062044 912025751 /nfs/dbraw/zinc/02/57/51/912025751.db2.gz IROPCFXHOOAAFN-HSZRJFAPSA-N 0 3 410.587 4.043 20 0 HIADHN CCN(C(=O)CSc1nccn1C(C)(C)C)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000503158725 912124899 /nfs/dbraw/zinc/12/48/99/912124899.db2.gz VFIMFDZNYIFJGE-QUCCMNQESA-N 0 3 414.619 4.414 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)N(C)[C@H]3CCC[C@@H](C)C3)CC2)c1 ZINC000503200640 912180330 /nfs/dbraw/zinc/18/03/30/912180330.db2.gz BZTWKXQJUXEGEO-IRLDBZIGSA-N 0 3 400.611 4.117 20 0 HIADHN C[C@H](CCSc1ccccc1)N1CCN(Cc2nc3ccccc3c(=O)[nH]2)CC1 ZINC000513342371 921726716 /nfs/dbraw/zinc/72/67/16/921726716.db2.gz DRXKBSJOYJUSRT-GOSISDBHSA-N 0 3 408.571 4.024 20 0 HIADHN FC(F)(F)Cn1cc(CN2CCCN(Cc3ccc(C(F)(F)F)cc3)CC2)cn1 ZINC000506294803 914889531 /nfs/dbraw/zinc/88/95/31/914889531.db2.gz LACGKLYAUXQMNP-UHFFFAOYSA-N 0 3 420.401 4.172 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)Nc2ccccc2N2C[C@@H](C)O[C@@H](C)C2)C1 ZINC000506295440 914890744 /nfs/dbraw/zinc/89/07/44/914890744.db2.gz QQNNTPJZPIGZTI-CUXKYVRBSA-N 0 3 422.573 4.257 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)Nc2cccc(OC[C@H]3CCCO3)c2)C1 ZINC000506295303 914890783 /nfs/dbraw/zinc/89/07/83/914890783.db2.gz PQNNMPCZDZPBKZ-JMUQELJHSA-N 0 3 409.530 4.201 20 0 HIADHN CCN(Cc1ccccc1NC(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1)C(C)=O ZINC000506310513 914899718 /nfs/dbraw/zinc/89/97/18/914899718.db2.gz QZCRMAACHMCAEW-XMSQKQJNSA-N 0 3 408.546 4.012 20 0 HIADHN CCOc1cc(CN(C)[C@@H](C)c2ccc(OC)cc2)ccc1O[C@@H](C)C(=O)N(C)C ZINC000506326673 914934240 /nfs/dbraw/zinc/93/42/40/914934240.db2.gz QEHAEIRHBYSJEA-ROUUACIJSA-N 0 3 414.546 4.142 20 0 HIADHN CCC(=O)Nc1ccc(NC(=O)[C@@H]2CN(Cc3ccccc3)CCC2(F)F)cc1 ZINC000506340025 914958195 /nfs/dbraw/zinc/95/81/95/914958195.db2.gz KFCMGLOFRDGDBS-IBGZPJMESA-N 0 3 401.457 4.131 20 0 HIADHN Cc1cccc(C2(NCC(=O)NCC(=O)Nc3c(C)cc(C)cc3C)CCCC2)c1 ZINC000506463129 915061678 /nfs/dbraw/zinc/06/16/78/915061678.db2.gz MBKAEFOJYKDUNF-UHFFFAOYSA-N 0 3 407.558 4.034 20 0 HIADHN Ic1ccccc1[C@@H]1CCCN1CCCCCn1cccn1 ZINC000506475219 915073887 /nfs/dbraw/zinc/07/38/87/915073887.db2.gz TWVJUBJYFFFTMZ-SFHVURJKSA-N 0 3 409.315 4.495 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)CCN1CCC[C@H](Oc2ccccc2OC)C1 ZINC000513378163 921751093 /nfs/dbraw/zinc/75/10/93/921751093.db2.gz ZPUIKSDDTVOZIB-KRWDZBQOSA-N 0 3 418.921 4.229 20 0 HIADHN CCc1c(C(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)cnn1Cc1ccccc1 ZINC000513375360 921749692 /nfs/dbraw/zinc/74/96/92/921749692.db2.gz BJBPIBSBCJRDMD-KNQAVFIVSA-N 0 3 402.542 4.059 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CN1CCC[C@@H](c2nnc3n2CCCCC3)C1 ZINC000506652941 915325548 /nfs/dbraw/zinc/32/55/48/915325548.db2.gz IIECEXCMLUJDSP-HXUWFJFHSA-N 0 3 404.562 4.187 20 0 HIADHN CN(CCNC(=O)Nc1ccc(C(=O)Nc2ccccc2)cc1)Cc1ccccc1 ZINC000506661144 915335090 /nfs/dbraw/zinc/33/50/90/915335090.db2.gz KQNFALVUNGRGQR-UHFFFAOYSA-N 0 3 402.498 4.192 20 0 HIADHN Cc1ccc([C@@H](CNc2cc(C(=O)NC3CC3)c3ccccc3n2)N2CCCC2)o1 ZINC000506741094 915429371 /nfs/dbraw/zinc/42/93/71/915429371.db2.gz GJDIBQABKKKHDC-OAQYLSRUSA-N 0 3 404.514 4.277 20 0 HIADHN C[C@@H](NCC(=O)N1CCc2sccc2[C@@H]1c1ccccc1)c1ccc2n[nH]cc2c1 ZINC000513410814 921778128 /nfs/dbraw/zinc/77/81/28/921778128.db2.gz HIOBFPCKAICBAZ-GYCJOSAFSA-N 0 3 416.550 4.449 20 0 HIADHN Cc1nc(COc2ccc(CN(C)Cc3ccc(Br)cc3)cc2)no1 ZINC000506808063 915557277 /nfs/dbraw/zinc/55/72/77/915557277.db2.gz VNHBGPFECZOYTB-UHFFFAOYSA-N 0 3 402.292 4.352 20 0 HIADHN CC(C)OCCCNC(=O)C1CCN(Cc2ccc(-c3ccccc3F)o2)CC1 ZINC000506848476 915627816 /nfs/dbraw/zinc/62/78/16/915627816.db2.gz JFUTVYVFMLFLOH-UHFFFAOYSA-N 0 3 402.510 4.229 20 0 HIADHN COc1cc(CN2CC[C@@H](n3ncc4ccccc43)C2)ccc1OCc1ccncc1 ZINC000513416708 921785277 /nfs/dbraw/zinc/78/52/77/921785277.db2.gz WAQFRLPLZXALKX-JOCHJYFZSA-N 0 3 414.509 4.466 20 0 HIADHN CCSc1cccc(NC(=O)N2CCN(CCN(C)Cc3ccccc3)CC2)c1 ZINC000506860709 915646673 /nfs/dbraw/zinc/64/66/73/915646673.db2.gz STXHNZBJAVSDJT-UHFFFAOYSA-N 0 3 412.603 4.080 20 0 HIADHN CC(=O)Nc1cccc(CN2CCCN(Cc3ccc(C(F)(F)F)cc3)CC2)c1 ZINC000506902152 915701479 /nfs/dbraw/zinc/70/14/79/915701479.db2.gz BSHKTEHDAXCBLA-UHFFFAOYSA-N 0 3 405.464 4.372 20 0 HIADHN COC(=O)C1(c2ccccc2)CCN(CCC(=O)Nc2ccc(Cl)cc2F)CC1 ZINC000506954762 915760518 /nfs/dbraw/zinc/76/05/18/915760518.db2.gz KUHHUKUTLSNYCC-UHFFFAOYSA-N 0 3 418.896 4.015 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)N1CCC(N2CCc3ccccc32)CC1 ZINC000507074069 915853855 /nfs/dbraw/zinc/85/38/55/915853855.db2.gz PVHQJAPGEKPQFX-QFIPXVFZSA-N 0 3 424.614 4.122 20 0 HIADHN Cc1ccccc1C1(C(=O)N2CCCN(CCCc3ccccc3)CC2)CCOCC1 ZINC000507147187 915889624 /nfs/dbraw/zinc/88/96/24/915889624.db2.gz AVWKARAJHIULFL-UHFFFAOYSA-N 0 3 420.597 4.210 20 0 HIADHN C[C@@H]1C[C@@H]1C(=O)Nc1ccc(C(=O)N2CCCN(CCCc3ccccc3)CC2)cc1 ZINC000507147663 915890317 /nfs/dbraw/zinc/89/03/17/915890317.db2.gz CPUKZIZHAIASBD-YKSBVNFPSA-N 0 3 419.569 4.062 20 0 HIADHN CC(C)(C)c1noc2ncc(C(=O)N3CCCN(CCCc4ccccc4)CC3)cc21 ZINC000507159347 915897891 /nfs/dbraw/zinc/89/78/91/915897891.db2.gz WGEFBCDPSSUBEO-UHFFFAOYSA-N 0 3 420.557 4.301 20 0 HIADHN C[C@H](N[C@@H]1CSC[C@@H]1C)C(=O)N1N=C(c2ccc(Cl)cc2)C[C@H]1c1ccco1 ZINC000507252136 916013104 /nfs/dbraw/zinc/01/31/04/916013104.db2.gz LSTZKLDXJBAQPS-QAMTZSDWSA-N 0 3 417.962 4.340 20 0 HIADHN COc1ccc(NC(=O)[C@H](NC[C@@H]2CCOC[C@@H]2C)c2ccccc2)cc1Cl ZINC000507269283 916030603 /nfs/dbraw/zinc/03/06/03/916030603.db2.gz WXPMNJRCMWPMPQ-HZUJVAHNSA-N 0 3 402.922 4.291 20 0 HIADHN CCNC(=O)COc1ccc(CN(C)[C@@H](C)c2ccc(C(F)(F)F)cc2)cc1OC ZINC000507331006 916088845 /nfs/dbraw/zinc/08/88/45/916088845.db2.gz DHQDIHZOLZLKDL-HNNXBMFYSA-N 0 3 424.463 4.422 20 0 HIADHN Cc1cc(I)ccc1NC(=O)CNC(C)(C)c1ccccc1 ZINC000507363202 916120474 /nfs/dbraw/zinc/12/04/74/916120474.db2.gz VEULKPWWNCGZPD-UHFFFAOYSA-N 0 3 408.283 4.063 20 0 HIADHN CCOC(=O)c1ccc(N2CCCN([C@H](C)c3ccc(OC(F)F)cc3)CC2)nc1 ZINC000507382230 916140999 /nfs/dbraw/zinc/14/09/99/916140999.db2.gz PTFXHTFSHKHBPX-MRXNPFEDSA-N 0 3 419.472 4.133 20 0 HIADHN COCCSc1ccc([C@@H](C)N[C@H](C)C(=O)Nc2cccc(NC(C)=O)c2)cc1 ZINC000507451860 916221460 /nfs/dbraw/zinc/22/14/60/916221460.db2.gz SBGRLLRJQBWTTH-HZPDHXFCSA-N 0 3 415.559 4.061 20 0 HIADHN COCCSc1ccc([C@H](C)N[C@H](C)C(=O)N[C@H](C)c2ccc(F)cc2)cc1 ZINC000507468362 916238891 /nfs/dbraw/zinc/23/88/91/916238891.db2.gz ZRKCYPKCXWTREU-GVDBMIGSSA-N 0 3 404.551 4.481 20 0 HIADHN Cc1onc(-c2cccnc2)c1C(=O)NC[C@H](c1ccccc1)N1CCC(C)CC1 ZINC000507483797 916251281 /nfs/dbraw/zinc/25/12/81/916251281.db2.gz HZOIPTWHGNMTHQ-OAQYLSRUSA-N 0 3 404.514 4.248 20 0 HIADHN COc1cccc(NC(=O)[C@@H](NCCc2ccc(NC(C)=O)cc2)c2ccccc2)c1 ZINC000507506003 916270445 /nfs/dbraw/zinc/27/04/45/916270445.db2.gz MGVZYUFCOXRRMP-DEOSSOPVSA-N 0 3 417.509 4.166 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3ccc(F)c(F)c3F)c(OCC)c2)CC1 ZINC000507592917 916345480 /nfs/dbraw/zinc/34/54/80/916345480.db2.gz IGGWVTUDYQVJGB-UHFFFAOYSA-N 0 3 421.463 4.287 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3ccc(C(C)=O)s3)c(OCC)c2)CC1 ZINC000507605031 916360523 /nfs/dbraw/zinc/36/05/23/916360523.db2.gz XDXFYHKJGHLPIY-UHFFFAOYSA-N 0 3 415.559 4.134 20 0 HIADHN COc1ccc(Cl)cc1[C@H](C)N[C@@H]1CCc2nnc(-c3ccc(F)cc3)n2C1 ZINC000507609053 916366434 /nfs/dbraw/zinc/36/64/34/916366434.db2.gz BWXXMJMIMJCLDN-SUMWQHHRSA-N 0 3 400.885 4.412 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)CCCc2nc(-c3ccc(F)cc3)no2)C1 ZINC000507616995 916375453 /nfs/dbraw/zinc/37/54/53/916375453.db2.gz MWUDGBXXIIWNMD-UTKZUKDTSA-N 0 3 422.504 4.150 20 0 HIADHN CN(CCC1CCCCC1)CC(=O)N1CCC[C@@H]1c1ccc2c(c1)OCCCO2 ZINC000507649278 916411455 /nfs/dbraw/zinc/41/14/55/916411455.db2.gz FVZSISQBAQPXRW-OAQYLSRUSA-N 0 3 400.563 4.414 20 0 HIADHN CC[C@@H](C)N(CC(=O)N1CCC(NC(=O)c2ccccc2C)CC1)Cc1ccccc1 ZINC000507678441 916448407 /nfs/dbraw/zinc/44/84/07/916448407.db2.gz OLMISOHGMSUJIF-OAQYLSRUSA-N 0 3 421.585 4.017 20 0 HIADHN C[C@H](OC[C@@H](O)CN(Cc1ccccc1)C[C@@H]1CCCO1)c1ccc(Cl)cc1 ZINC000507702027 916485148 /nfs/dbraw/zinc/48/51/48/916485148.db2.gz LVRJPJJJVIEVTO-TZYHBYERSA-N 0 3 403.950 4.460 20 0 HIADHN Cc1noc(C2CCN(C[C@@H](O)CO[C@@H](c3ccccc3)c3ccc(C)cc3)CC2)n1 ZINC000507717471 916510976 /nfs/dbraw/zinc/51/09/76/916510976.db2.gz JSDLYONZCXPCCX-RPWUZVMVSA-N 0 3 421.541 4.033 20 0 HIADHN O=C(CCN1CCC[C@@H]1c1cccc(Br)c1)Nc1ccc2c(c1)OCO2 ZINC000507727094 916521280 /nfs/dbraw/zinc/52/12/80/916521280.db2.gz RTZPKKGEXHAXNV-QGZVFWFLSA-N 0 3 417.303 4.344 20 0 HIADHN O=C(CCNCc1csc(Br)c1)Nc1ccc(Br)cc1 ZINC000507776603 916561089 /nfs/dbraw/zinc/56/10/89/916561089.db2.gz DMVRYFIZHDZIPZ-UHFFFAOYSA-N 0 3 418.154 4.392 20 0 HIADHN CN1C(=O)C[C@@H](NCc2ccc(OCc3cccnc3)cc2)[C@@H]1c1ccc(Cl)cc1 ZINC000507819924 916614311 /nfs/dbraw/zinc/61/43/11/916614311.db2.gz VDDFDKBZXQUWMB-VWNXMTODSA-N 0 3 421.928 4.376 20 0 HIADHN CCOc1ccc(Br)cc1CN(CCC(=O)NC1CCCC1)C1CC1 ZINC000507819440 916615734 /nfs/dbraw/zinc/61/57/34/916615734.db2.gz PUKYALWRGDJKKP-UHFFFAOYSA-N 0 3 409.368 4.261 20 0 HIADHN CN1C(=O)C[C@H](NCc2ccc(OCc3cccnc3)cc2)[C@H]1c1ccc(Cl)cc1 ZINC000507819922 916615866 /nfs/dbraw/zinc/61/58/66/916615866.db2.gz VDDFDKBZXQUWMB-LADGPHEKSA-N 0 3 421.928 4.376 20 0 HIADHN CCCN(C(=O)N[C@@H]1CCCC12CCOCC2)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000508065938 916888750 /nfs/dbraw/zinc/88/87/50/916888750.db2.gz XWQFXTDXGHVFPI-XZOQPEGZSA-N 0 3 413.606 4.422 20 0 HIADHN Cc1cc(Br)cc2cc(C(=O)N(CCN(C)C)Cc3ccccn3)oc21 ZINC000508090953 916908337 /nfs/dbraw/zinc/90/83/37/916908337.db2.gz YVIRUHZZMVJMCJ-UHFFFAOYSA-N 0 3 416.319 4.103 20 0 HIADHN Cc1cc(C(=O)N(Cc2ccco2)C2CCN(C)CC2)nc(-c2ccc(Cl)cc2)n1 ZINC000508146347 916965980 /nfs/dbraw/zinc/96/59/80/916965980.db2.gz FNODPWHCTJJCLE-UHFFFAOYSA-N 0 3 424.932 4.435 20 0 HIADHN CSc1cc(Br)ccc1CNCc1ccccc1Cn1cncn1 ZINC000508723613 917486252 /nfs/dbraw/zinc/48/62/52/917486252.db2.gz KEWBYHAYKKKQOT-UHFFFAOYSA-N 0 3 403.349 4.101 20 0 HIADHN C[C@H](NCc1ccccc1Cn1cncn1)c1ccc(OC[C@H]2CCCCO2)c(F)c1 ZINC000508731252 917491613 /nfs/dbraw/zinc/49/16/13/917491613.db2.gz VUAATYDQNJWRTB-PGRDOPGGSA-N 0 3 424.520 4.264 20 0 HIADHN C[C@H](NC(=O)N(C)Cc1ccc(Br)s1)[C@@H](c1ccccc1)N(C)C ZINC000508851435 917604454 /nfs/dbraw/zinc/60/44/54/917604454.db2.gz HGJDIRRWJZRDSE-GUYCJALGSA-N 0 3 410.381 4.343 20 0 HIADHN C[C@@H](NC(=O)NC(C)(C)c1nc(C(F)(F)F)cs1)[C@@H](c1ccccc1)N(C)C ZINC000508856674 917609912 /nfs/dbraw/zinc/60/99/12/917609912.db2.gz VZFPTFOIAGPVSX-DOMZBBRYSA-N 0 3 414.497 4.388 20 0 HIADHN C[C@H](NC(=O)N1CCn2cccc2[C@H]1c1ccccc1)[C@@H](c1ccccc1)N(C)C ZINC000508873354 917627153 /nfs/dbraw/zinc/62/71/53/917627153.db2.gz TUGYBERRIIEZAG-WDJPJFJCSA-N 0 3 402.542 4.294 20 0 HIADHN C[C@@H](NC(=O)Nc1ccccc1N1C[C@@H](C)O[C@@H](C)C1)[C@H](c1ccccc1)N(C)C ZINC000508895260 917651060 /nfs/dbraw/zinc/65/10/60/917651060.db2.gz LFKYKZVBHFWNHZ-ISJRUSPKSA-N 0 3 410.562 4.113 20 0 HIADHN C[C@H](NC(=O)N(C)[C@@H]1CCO[C@H](c2ccc(F)cc2)C1)[C@H](c1ccccc1)N(C)C ZINC000508901217 917656822 /nfs/dbraw/zinc/65/68/22/917656822.db2.gz BCXRYLWSAVWELP-VQROGVPDSA-N 0 3 413.537 4.379 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)NCc2c(F)cccc2N2CCCC2)c1 ZINC000509030325 917785098 /nfs/dbraw/zinc/78/50/98/917785098.db2.gz HMXSSQHSWZJZBH-UHFFFAOYSA-N 0 3 412.553 4.008 20 0 HIADHN CCCN(C)[C@H](CNC(=O)N1CCCC[C@@H]1c1cc[nH]n1)c1ccc(Cl)cc1 ZINC000509050885 917801515 /nfs/dbraw/zinc/80/15/15/917801515.db2.gz NHNYFPFOSDCPGX-WOJBJXKFSA-N 0 3 403.958 4.383 20 0 HIADHN CN(C)[C@@H](CNC(=O)c1cccc(NC(=O)C2CCCCC2)c1)Cc1ccccc1 ZINC000509098147 917838408 /nfs/dbraw/zinc/83/84/08/917838408.db2.gz QADLJEXEFFLGOD-HSZRJFAPSA-N 0 3 407.558 4.108 20 0 HIADHN O=C(N1CC[C@H](c2ccccc2)C1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000509142374 917868161 /nfs/dbraw/zinc/86/81/61/917868161.db2.gz VHYAYCNBXXWFOA-RBBKRZOGSA-N 0 3 402.460 4.457 20 0 HIADHN CCCN(C(=O)c1ccccc1OCCOC)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000509179638 917890818 /nfs/dbraw/zinc/89/08/18/917890818.db2.gz APUISLMRTHRYAD-QFIPXVFZSA-N 0 3 410.558 4.229 20 0 HIADHN CC(C)c1nc(CCNC(=O)[C@H]2CN(Cc3ccccc3)CCC2(F)F)cs1 ZINC000509245066 917938446 /nfs/dbraw/zinc/93/84/46/917938446.db2.gz FBVXETQXVQSHJP-GOSISDBHSA-N 0 3 407.530 4.083 20 0 HIADHN Brc1ccc2oc(CN3CCCN(Cc4ccccc4)CC3)nc2c1 ZINC000509250066 917944038 /nfs/dbraw/zinc/94/40/38/917944038.db2.gz VQSTXBNGNNHLAE-UHFFFAOYSA-N 0 3 400.320 4.298 20 0 HIADHN CCN(C(=O)c1nn(-c2ccc(F)cc2)cc1C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000509314608 917990705 /nfs/dbraw/zinc/99/07/05/917990705.db2.gz QFPOQEGOMMNEPE-QFIPXVFZSA-N 0 3 406.505 4.056 20 0 HIADHN Cc1nn(C(C)(C)C)c(C)c1CN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1 ZINC000509348426 918014889 /nfs/dbraw/zinc/01/48/89/918014889.db2.gz PCENYPYZQYUSLQ-UHFFFAOYSA-N 0 3 403.958 4.154 20 0 HIADHN Cc1noc([C@H]2CCCN(Cc3ccc(OCc4cn5cccc(C)c5n4)cc3)C2)n1 ZINC000509359618 918025664 /nfs/dbraw/zinc/02/56/64/918025664.db2.gz SVGNLCGIPKUTSX-FQEVSTJZSA-N 0 3 417.513 4.293 20 0 HIADHN O=C(Nc1ccc(Br)cn1)C1CCN(Cc2cc3ccccc3o2)CC1 ZINC000509386829 918052161 /nfs/dbraw/zinc/05/21/61/918052161.db2.gz KPJXAFUYTVZWCI-UHFFFAOYSA-N 0 3 414.303 4.441 20 0 HIADHN CC(C)c1c(NC(=O)[C@@H]2CCCN(Cc3cccnc3)C2)cnn1-c1ccccc1 ZINC000562353811 945063936 /nfs/dbraw/zinc/06/39/36/945063936.db2.gz VRXGNQRBZNKKHI-HXUWFJFHSA-N 0 3 403.530 4.241 20 0 HIADHN O=C(NCc1cccc(OC(F)F)c1)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000509488032 918133374 /nfs/dbraw/zinc/13/33/74/918133374.db2.gz KHXLUEZLZZJHBK-SFHVURJKSA-N 0 3 410.411 4.062 20 0 HIADHN Cn1cc(-c2ccc(CNCc3cccc(NC(=O)c4ccncc4)c3)s2)cn1 ZINC000509534768 918183241 /nfs/dbraw/zinc/18/32/41/918183241.db2.gz YWVIXNXFBUCAMA-UHFFFAOYSA-N 0 3 403.511 4.086 20 0 HIADHN C[C@@H]1CCCN(C(=O)C2CCN(Cc3ccc(OCc4ccncc4)cc3)CC2)C1 ZINC000509564234 918213978 /nfs/dbraw/zinc/21/39/78/918213978.db2.gz LZQXEDKYRTYVMC-HXUWFJFHSA-N 0 3 407.558 4.131 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N(C)Cc1cccc(OC(F)(F)F)c1)c1ccco1 ZINC000509568069 918217800 /nfs/dbraw/zinc/21/78/00/918217800.db2.gz KSUQKRKJBLTEBZ-YOEHRIQHSA-N 0 3 413.440 4.449 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N(C)Cc1ccc(Br)cc1)c1ccco1 ZINC000509576069 918224524 /nfs/dbraw/zinc/22/45/24/918224524.db2.gz CPTRVPIZJRITGD-YOEHRIQHSA-N 0 3 408.340 4.313 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N1CCC[C@H]1c1ccc(OC)c(OC)c1)c1ccco1 ZINC000509576272 918225182 /nfs/dbraw/zinc/22/51/82/918225182.db2.gz DUEKSKZVACLMBM-UHOSZYNNSA-N 0 3 415.534 4.273 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N1CCO[C@@H](c2ccccc2Cl)C1)c1ccco1 ZINC000509597168 918247114 /nfs/dbraw/zinc/24/71/14/918247114.db2.gz YKAFIRPUCXJVQQ-QKYXUNIQSA-N 0 3 405.926 4.145 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)N1CCC(c2nc3ccccc3[nH]2)CC1)c1ccco1 ZINC000509597834 918248811 /nfs/dbraw/zinc/24/88/11/918248811.db2.gz ATYCMAGAZAUVKJ-OXQOHEQNSA-N 0 3 409.534 4.174 20 0 HIADHN Cc1ccc(-c2noc([C@H](C)NCCCN3CCN(c4ccccc4)CC3)n2)cc1F ZINC000509605163 918253771 /nfs/dbraw/zinc/25/37/71/918253771.db2.gz OVAKAKPITFGWGA-IBGZPJMESA-N 0 3 423.536 4.047 20 0 HIADHN CCN1CCC[C@@H](CN(C)c2ncc(C(F)(F)F)cc2Cl)[C@@H]1c1cnn(C)c1 ZINC000509607625 918254980 /nfs/dbraw/zinc/25/49/80/918254980.db2.gz IFIMBQHIICDAPN-SUMWQHHRSA-N 0 3 415.891 4.397 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N1CCO[C@H](c2ccc(F)cc2Cl)C1)c1ccco1 ZINC000509613655 918260537 /nfs/dbraw/zinc/26/05/37/918260537.db2.gz NUIFNMFSIYVMBH-DCPHZVHLSA-N 0 3 423.916 4.284 20 0 HIADHN O=C(NCCCCN1CCN(Cc2ccccc2)CC1)Nc1cccc(Cl)c1F ZINC000509615257 918265131 /nfs/dbraw/zinc/26/51/31/918265131.db2.gz DMIMPKAHSKQLMD-UHFFFAOYSA-N 0 3 418.944 4.199 20 0 HIADHN CC[C@@H](NC(=O)N(CCN(C)C)Cc1cccc(F)c1)c1ccc(OC)c(OC)c1 ZINC000509702773 918332557 /nfs/dbraw/zinc/33/25/57/918332557.db2.gz QVJVGWBNQUSIAC-HXUWFJFHSA-N 0 3 417.525 4.067 20 0 HIADHN Cc1ccc(NC(=O)[C@@H](NC(=O)c2ccccc2Cl)C(C)C)c(CN(C)C)c1 ZINC000509757708 918373982 /nfs/dbraw/zinc/37/39/82/918373982.db2.gz YYLHMYBPVQKTDZ-FQEVSTJZSA-N 0 3 401.938 4.103 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1c2ccccc2nc2c1CN(C)CC2)c1ccsc1 ZINC000509812240 918415456 /nfs/dbraw/zinc/41/54/56/918415456.db2.gz SKUNVCRYMKZBNZ-JOCHJYFZSA-N 0 3 422.598 4.097 20 0 HIADHN Cc1cn(-c2ccc(F)cc2)nc1C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000509830290 918430678 /nfs/dbraw/zinc/43/06/78/918430678.db2.gz GIXKPJFWEGFPRK-UHFFFAOYSA-N 0 3 424.545 4.163 20 0 HIADHN CCOc1cc(CN[C@H]2CCN(C(=O)Nc3ccccc3)C2)ccc1OC(F)F ZINC000509964756 918555470 /nfs/dbraw/zinc/55/54/70/918555470.db2.gz XNUFMRNVHDQTQW-KRWDZBQOSA-N 0 3 405.445 4.083 20 0 HIADHN O=C(Nc1ccccc1)N1CC[C@H](NCc2ccccc2OCc2ccccn2)C1 ZINC000509971582 918561755 /nfs/dbraw/zinc/56/17/55/918561755.db2.gz MCHMFQCKPQIPJL-NRFANRHFSA-N 0 3 402.498 4.057 20 0 HIADHN Cc1cn(-c2ccc(F)cc2)nc1C(=O)NC[C@@H]1CCCN(C)[C@H]1c1cccs1 ZINC000509977037 918566442 /nfs/dbraw/zinc/56/64/42/918566442.db2.gz KGIOJUBSWWKPCU-HRAATJIYSA-N 0 3 412.534 4.194 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)c1ccn(-c2cccc(Cl)c2)n1 ZINC000509983107 918570334 /nfs/dbraw/zinc/57/03/34/918570334.db2.gz QLYBGTILNJMSMI-UHFFFAOYSA-N 0 3 410.949 4.162 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1cnc2c(F)ccc(F)c2c1 ZINC000509988355 918575278 /nfs/dbraw/zinc/57/52/78/918575278.db2.gz WVWBZZIBTZTIIT-UHFFFAOYSA-N 0 3 413.390 4.048 20 0 HIADHN CSc1cccc(S(=O)(=O)N(C)[C@H]2CCN(Cc3ccccc3)[C@@H](C)C2)c1 ZINC000510180604 918731218 /nfs/dbraw/zinc/73/12/18/918731218.db2.gz KDXFEMQLEQEUOR-HKUYNNGSSA-N 0 3 404.601 4.082 20 0 HIADHN CC[C@@H](NCC(=O)N(C)Cc1c(F)cccc1Cl)c1ccc(OC)c(OC)c1 ZINC000510199442 918749158 /nfs/dbraw/zinc/74/91/58/918749158.db2.gz MKEYZKMGYXXQKB-GOSISDBHSA-N 0 3 408.901 4.196 20 0 HIADHN O=C(Nc1ccc(C(=O)NC2CCCC2)cc1)N[C@H](CN1CCCC1)c1ccccc1 ZINC000510214200 918760820 /nfs/dbraw/zinc/76/08/20/918760820.db2.gz SQLUTMNCJXJUKA-HSZRJFAPSA-N 0 3 420.557 4.318 20 0 HIADHN Fc1ccc(NC2CCN(Cc3c[nH]nc3-c3ccc4c(c3)OCCO4)CC2)cc1 ZINC000510214854 918762556 /nfs/dbraw/zinc/76/25/56/918762556.db2.gz RPCBTJQEILMPHE-UHFFFAOYSA-N 0 3 408.477 4.064 20 0 HIADHN CN(Cc1ccc(F)c2cccnc12)C[C@@H](O)COc1ccc(C(F)(F)F)cc1 ZINC000510226470 918768234 /nfs/dbraw/zinc/76/82/34/918768234.db2.gz ZTZVEKQUNUFSQI-MRXNPFEDSA-N 0 3 408.395 4.264 20 0 HIADHN CC[C@@H](NCC(=O)N(CC)[C@H](C)c1ccc(F)cc1)c1ccc(OC)c(OC)c1 ZINC000510245068 918781757 /nfs/dbraw/zinc/78/17/57/918781757.db2.gz UEEXUVCAGXTCFU-OXQOHEQNSA-N 0 3 402.510 4.493 20 0 HIADHN Cc1cc(C)n(-c2ccc(CCNC(=O)c3oc4ccccc4c3CN(C)C)cc2)n1 ZINC000510324181 918831548 /nfs/dbraw/zinc/83/15/48/918831548.db2.gz OPUIYUDXAHCOGG-UHFFFAOYSA-N 0 3 416.525 4.269 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3cccc(-c4nc(C)c(C)o4)c3)cc2)CC1 ZINC000510405877 918877078 /nfs/dbraw/zinc/87/70/78/918877078.db2.gz IIFWABMJLBSHKP-UHFFFAOYSA-N 0 3 404.514 4.353 20 0 HIADHN O[C@@H](COc1c(Cl)cccc1Cl)CN1CC[C@H](n2ncc3ccccc32)C1 ZINC000510419055 918886219 /nfs/dbraw/zinc/88/62/19/918886219.db2.gz CFQKOMMQSDKSJR-JKSUJKDBSA-N 0 3 406.313 4.030 20 0 HIADHN CCN(Cc1ccc(OCC(=O)N2CCCC2)c(OC)c1)[C@@H](C)c1ccc(F)cc1 ZINC000510461435 918916415 /nfs/dbraw/zinc/91/64/15/918916415.db2.gz ZVYAGUHYRNVNCG-SFHVURJKSA-N 0 3 414.521 4.419 20 0 HIADHN Cc1cc(C(=O)N(Cc2ccccc2)C2CCN(C)CC2)nn1-c1ccc(F)cc1F ZINC000510475569 918929415 /nfs/dbraw/zinc/92/94/15/918929415.db2.gz HTRZPBPEAWLORQ-UHFFFAOYSA-N 0 3 424.495 4.196 20 0 HIADHN CC[C@@H](CNC(=O)Nc1cccc(C(=O)NC(C)(C)C)c1)N1CCc2ccccc2C1 ZINC000510494729 918941970 /nfs/dbraw/zinc/94/19/70/918941970.db2.gz ATFVVORTXLEZPJ-QFIPXVFZSA-N 0 3 422.573 4.173 20 0 HIADHN COc1cc([C@H](C)NC(=O)N[C@H](C)C2=CCN(C)CC2)ccc1OC1CCCC1 ZINC000510499700 918947763 /nfs/dbraw/zinc/94/77/63/918947763.db2.gz ITNXCGKBJCIHRK-SJORKVTESA-N 0 3 401.551 4.027 20 0 HIADHN Cc1nn(-c2ccc(Br)cc2)cc1CN1CCC[C@H](c2ncc[nH]2)C1 ZINC000510522477 918967585 /nfs/dbraw/zinc/96/75/85/918967585.db2.gz IHBWFECNWZCLHY-HNNXBMFYSA-N 0 3 400.324 4.046 20 0 HIADHN C[C@H]1CN(C2CCN(Cc3cn(-c4ccccc4)nc3-c3cccs3)CC2)CCO1 ZINC000510524245 918969615 /nfs/dbraw/zinc/96/96/15/918969615.db2.gz WZYXIQPQODZVEI-IBGZPJMESA-N 0 3 422.598 4.286 20 0 HIADHN Cc1n[nH]c(C)c1[C@H]1CCCCCN1C(=O)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000510526751 918972667 /nfs/dbraw/zinc/97/26/67/918972667.db2.gz UMOGFHUVOWUWGC-YADHBBJMSA-N 0 3 409.578 4.490 20 0 HIADHN Cc1n[nH]c(C)c1[C@@H]1CCCCCN1C(=O)NC[C@H](c1ccccc1)N1CCCC1 ZINC000510526747 918973064 /nfs/dbraw/zinc/97/30/64/918973064.db2.gz UMOGFHUVOWUWGC-FCHUYYIVSA-N 0 3 409.578 4.490 20 0 HIADHN COc1cc([C@H](C)NC(=O)N[C@H](C)C2=CCN(C)CC2)ccc1OCCC(C)C ZINC000510528527 918974604 /nfs/dbraw/zinc/97/46/04/918974604.db2.gz XJTNKGUJHZDEQS-MSOLQXFVSA-N 0 3 403.567 4.131 20 0 HIADHN COc1cc(CN2CCC(N3CCO[C@@H](C)C3)CC2)ccc1OCc1cccs1 ZINC000510557770 919001258 /nfs/dbraw/zinc/00/12/58/919001258.db2.gz GIENJZAKYFKWHB-SFHVURJKSA-N 0 3 416.587 4.021 20 0 HIADHN COc1c(C)ccc(NC(=O)NCCCCN2CCN(Cc3ccccc3)CC2)c1C ZINC000510606625 919049267 /nfs/dbraw/zinc/04/92/67/919049267.db2.gz RKCSGCSBKOTHLW-UHFFFAOYSA-N 0 3 424.589 4.032 20 0 HIADHN CC(C)CNC(=O)c1ccc(NC(=O)N[C@H](CN2CCCC2)c2ccccc2)cc1 ZINC000510652918 919094276 /nfs/dbraw/zinc/09/42/76/919094276.db2.gz QGYGYKYRJQWLKI-JOCHJYFZSA-N 0 3 408.546 4.031 20 0 HIADHN Cc1csc2nc(CN3CCC[C@H](c4nc5ccccc5n4C(C)C)C3)cc(=O)n12 ZINC000510656607 919097660 /nfs/dbraw/zinc/09/76/60/919097660.db2.gz GIJWCQYXSJYTJX-KRWDZBQOSA-N 0 3 421.570 4.375 20 0 HIADHN CCCC(=O)Nc1cccc(NC(=O)NC[C@@H](CC)N2CCc3ccccc3C2)c1 ZINC000510693801 919131935 /nfs/dbraw/zinc/13/19/35/919131935.db2.gz DMEZNARSPSULSS-JOCHJYFZSA-N 0 3 408.546 4.384 20 0 HIADHN COc1ccc(-c2nc3c(s2)[C@H](NCc2ccc4c(c2)NC(=O)CO4)CCC3)cc1 ZINC000510718783 919160490 /nfs/dbraw/zinc/16/04/90/919160490.db2.gz NFSAIVCMRKKMJX-QGZVFWFLSA-N 0 3 421.522 4.317 20 0 HIADHN CC[C@@H](CC1CCCC1)C(=O)N1CCC[C@@H](CN2CCN(c3ccccn3)CC2)C1 ZINC000510785183 919248762 /nfs/dbraw/zinc/24/87/62/919248762.db2.gz ZDUHJEXLUYFXGU-GOTSBHOMSA-N 0 3 412.622 4.049 20 0 HIADHN CN(CCc1nccs1)C[C@@H](O)COC(c1ccc(F)cc1)c1ccc(F)cc1 ZINC000510806734 919282618 /nfs/dbraw/zinc/28/26/18/919282618.db2.gz OLYXRYCSBILSRL-HXUWFJFHSA-N 0 3 418.509 4.063 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N[C@@H](CC(F)(F)F)c2ccc(F)cc2)CC1 ZINC000510952845 919486445 /nfs/dbraw/zinc/48/64/45/919486445.db2.gz RKZGYWOAAJQAIU-SFHVURJKSA-N 0 3 419.463 4.008 20 0 HIADHN CC[C@@H](C)n1ncc2c1nc(C)cc2C(=O)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000511075769 919677096 /nfs/dbraw/zinc/67/70/96/919677096.db2.gz JAYTXOKZFSQRIE-GCJKJVERSA-N 0 3 405.546 4.278 20 0 HIADHN CCc1ccc([C@H](CNC(=O)Nc2ccccc2N2C[C@H](C)O[C@@H](C)C2)N(C)C)cc1 ZINC000511085101 919685957 /nfs/dbraw/zinc/68/59/57/919685957.db2.gz IWOBMHFRBVQNML-JXQFQVJHSA-N 0 3 424.589 4.287 20 0 HIADHN CC[C@H](C)n1ncc2c1nc(C)cc2C(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000511087067 919690472 /nfs/dbraw/zinc/69/04/72/919690472.db2.gz XGEBQWYKBHAVLN-QFBILLFUSA-N 0 3 411.575 4.339 20 0 HIADHN C[C@@H]1CN(c2ccccc2NC(=O)N[C@@H](CN2CCCC2)c2ccccc2)C[C@H](C)O1 ZINC000511111953 919721705 /nfs/dbraw/zinc/72/17/05/919721705.db2.gz ZKKDKHSIROPTLM-MZKRTTBSSA-N 0 3 422.573 4.259 20 0 HIADHN C[C@@H]1CN(c2ccccc2NC(=O)N[C@@H](CN2CCCC2)c2ccccc2)C[C@@H](C)O1 ZINC000511111955 919722558 /nfs/dbraw/zinc/72/25/58/919722558.db2.gz ZKKDKHSIROPTLM-VIZSFHNOSA-N 0 3 422.573 4.259 20 0 HIADHN Cc1cc(OC[C@H](O)CN2CCC[C@@H](c3ccnn3C)C2)c(C(C)C)cc1Cl ZINC000511137882 919755414 /nfs/dbraw/zinc/75/54/14/919755414.db2.gz QQEVVOCWGHTMSH-QZTJIDSGSA-N 0 3 405.970 4.125 20 0 HIADHN Cc1cccc2nc(CN3CCC(C)(c4nc5ccccc5s4)CC3)cc(=O)n12 ZINC000511144947 919763585 /nfs/dbraw/zinc/76/35/85/919763585.db2.gz UQQLZPRVCTWBEW-UHFFFAOYSA-N 0 3 404.539 4.166 20 0 HIADHN Cc1ccc(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2)cc1Br ZINC000511193414 919809577 /nfs/dbraw/zinc/80/95/77/919809577.db2.gz XSVOMLSAJBYKJR-UHFFFAOYSA-N 0 3 408.315 4.492 20 0 HIADHN CC(C)Cc1ccc(C(=O)C2CCN(C(=O)N[C@@H](C)C3=CCN(C)CC3)CC2)cc1 ZINC000511232361 919836684 /nfs/dbraw/zinc/83/66/84/919836684.db2.gz VXGJTHNJXXJLSW-IBGZPJMESA-N 0 3 411.590 4.140 20 0 HIADHN Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)NC(=O)N[C@@H](C)C1=CCN(C)CC1 ZINC000511271287 919868921 /nfs/dbraw/zinc/86/89/21/919868921.db2.gz VKSVDTIGVHYWGL-DZGCQCFKSA-N 0 3 402.539 4.268 20 0 HIADHN C[C@H](NC(=O)N(Cc1ccc2c(c1)OCO2)C1CCC(C)CC1)C1=CCN(C)CC1 ZINC000511285233 919880394 /nfs/dbraw/zinc/88/03/94/919880394.db2.gz JJIAXVIKUAABGT-WBTXTPOCSA-N 0 3 413.562 4.156 20 0 HIADHN Cc1cc(Br)ccc1NC(=O)N(CCN(C)C)Cc1ccc(F)cc1 ZINC000511288867 919885872 /nfs/dbraw/zinc/88/58/72/919885872.db2.gz VFLUWKSOAQJBBU-UHFFFAOYSA-N 0 3 408.315 4.492 20 0 HIADHN C[C@H]1CCCCN1C(=O)c1ccc(NC(=O)NC[C@H](c2ccccc2)N(C)C)cc1 ZINC000511297249 919893003 /nfs/dbraw/zinc/89/30/03/919893003.db2.gz NMRNAIDTPGSWSS-PGRDOPGGSA-N 0 3 408.546 4.126 20 0 HIADHN COc1ccc([C@H](NC(=O)N[C@H](C)C2=CCN(C)CC2)c2ccccc2Cl)cc1 ZINC000511304706 919897477 /nfs/dbraw/zinc/89/74/77/919897477.db2.gz FPERBQILRGRVDT-ZHRRBRCNSA-N 0 3 413.949 4.388 20 0 HIADHN COc1ccccc1[C@H](NC(=O)N[C@@H](C)C1=CCN(C)CC1)c1ccccc1Cl ZINC000511309487 919902557 /nfs/dbraw/zinc/90/25/57/919902557.db2.gz RPIFJTLBZARWOQ-KSFYIVLOSA-N 0 3 413.949 4.388 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)Nc1cc2ccc(Br)cn2n1 ZINC000511325288 919916569 /nfs/dbraw/zinc/91/65/69/919916569.db2.gz YKSZWFMDACVMAN-UHFFFAOYSA-N 0 3 413.275 4.157 20 0 HIADHN Cc1nc(CNC2CCC(NC(=O)COc3ccc(Cl)cc3)CC2)sc1C ZINC000511360086 919954653 /nfs/dbraw/zinc/95/46/53/919954653.db2.gz MYQQJMVCUVPXSE-UHFFFAOYSA-N 0 3 407.967 4.009 20 0 HIADHN Cc1ccc([C@H](CN[C@@H](c2ccc(Cl)cc2)[C@H]2CN(C)CCO2)N2CCCC2)o1 ZINC000511367143 919958906 /nfs/dbraw/zinc/95/89/06/919958906.db2.gz MSITVWDCVXBQGM-WWNPGLIZSA-N 0 3 417.981 4.040 20 0 HIADHN CCc1cccc2c3c([nH]c21)[C@@](CC)(CC(=O)N[C@@H](C)C1=CCN(C)CC1)OCC3 ZINC000511368903 919962207 /nfs/dbraw/zinc/96/22/07/919962207.db2.gz IWHJAROQLIKRFP-SSOJOUAXSA-N 0 3 409.574 4.065 20 0 HIADHN CN1CCO[C@H]([C@H](NC[C@@H](c2cccs2)N2CCCC2)c2ccc(Cl)cc2)C1 ZINC000511383530 919985063 /nfs/dbraw/zinc/98/50/63/919985063.db2.gz YFEQIJCLAJNZRK-JAXLGGSGSA-N 0 3 420.022 4.200 20 0 HIADHN COc1ccc(CCC(=O)N(CCN(C)C)C2CCCCC2)cc1Br ZINC000511389822 919997444 /nfs/dbraw/zinc/99/74/44/919997444.db2.gz DULPQAJEPNLFHF-UHFFFAOYSA-N 0 3 411.384 4.113 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)N[C@@H](C[C@@H]2CCOC2)c2ccccc2)CN1Cc1ccccc1 ZINC000511392515 920000419 /nfs/dbraw/zinc/00/04/19/920000419.db2.gz WCQDRKFIXCQDNJ-NMTNEYKDSA-N 0 3 407.558 4.117 20 0 HIADHN Cc1n[nH]c(C)c1[C@@H]1CCCCCN1C(=O)N[C@H]1C[C@H](C)N(Cc2ccccc2)C1 ZINC000511415545 920028888 /nfs/dbraw/zinc/02/88/88/920028888.db2.gz BGMRUCGMZIABAN-HSQYWUDLSA-N 0 3 409.578 4.316 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N2CC[C@H](n3ncc4ccccc43)C2)N2CCCC2)cc1 ZINC000511417852 920031306 /nfs/dbraw/zinc/03/13/06/920031306.db2.gz JUXCNUAFYIRBGY-UPVQGACJSA-N 0 3 417.557 4.138 20 0 HIADHN CN(C)CCN(C(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1)C1CCCCC1 ZINC000511420483 920035201 /nfs/dbraw/zinc/03/52/01/920035201.db2.gz DSGSUUPZDFLHOL-UHFFFAOYSA-N 0 3 417.557 4.271 20 0 HIADHN Cc1nn(C)c(C)c1NC(=O)[C@H](C)N[C@@H](c1cccc(OC(F)(F)F)c1)C1CC1 ZINC000511571553 920215200 /nfs/dbraw/zinc/21/52/00/920215200.db2.gz BDYZXTRSSUZTPL-KPZWWZAWSA-N 0 3 410.440 4.003 20 0 HIADHN COc1cccc(CN(C)C(=O)CN[C@H](c2cccc(OC(F)(F)F)c2)C2CC2)c1 ZINC000511593347 920239358 /nfs/dbraw/zinc/23/93/58/920239358.db2.gz LPPQPXSIZDFWRB-NRFANRHFSA-N 0 3 422.447 4.293 20 0 HIADHN O=C(CN[C@H](c1cccc(OC(F)(F)F)c1)C1CC1)N1CCc2sccc2C1 ZINC000511625747 920284878 /nfs/dbraw/zinc/28/48/78/920284878.db2.gz SHJHJEWNNOZUCM-IBGZPJMESA-N 0 3 410.461 4.272 20 0 HIADHN CC(=O)NCC1CCN(Cc2cn(Cc3ccccc3)nc2-c2cccs2)CC1 ZINC000511658407 920325444 /nfs/dbraw/zinc/32/54/44/920325444.db2.gz YGYWTMPKFIDBPV-UHFFFAOYSA-N 0 3 408.571 4.008 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)Cc2cn3cc(Cl)cc(Cl)c3n2)C1 ZINC000511660307 920326003 /nfs/dbraw/zinc/32/60/03/920326003.db2.gz FLVVYXNLHTXSKK-YOEHRIQHSA-N 0 3 417.340 4.135 20 0 HIADHN C[C@@H](Sc1ccc(Br)cc1)C(=O)NC[C@@H](c1ccccc1)N(C)C ZINC000511711507 920377208 /nfs/dbraw/zinc/37/72/08/920377208.db2.gz BNOOLBBIHIQFPM-KDOFPFPSSA-N 0 3 407.377 4.349 20 0 HIADHN CS(=O)(=O)c1ccc(CNC/C=C\c2ccc(F)c(F)c2)cc1C(F)(F)F ZINC000511765822 920451518 /nfs/dbraw/zinc/45/15/18/920451518.db2.gz XEAYJXFUWTWAEQ-IHWYPQMZSA-N 0 3 405.388 4.190 20 0 HIADHN OC[C@@H](CNCc1cscc1Br)Cc1ccccc1Br ZINC000511787852 920481623 /nfs/dbraw/zinc/48/16/23/920481623.db2.gz RUVBYKUUVOIURE-LLVKDONJSA-N 0 3 419.182 4.214 20 0 HIADHN Cc1ccc([C@H](NC(=O)CN2C[C@H](c3ccccc3)[C@H]3COCC[C@H]32)C2CC2)cc1 ZINC000511795937 920489608 /nfs/dbraw/zinc/48/96/08/920489608.db2.gz JITNOSHCRSXKID-GWZVJQKXSA-N 0 3 404.554 4.067 20 0 HIADHN O=c1[nH]c(CN2C[C@H](c3ccccc3)[C@H]3COCC[C@@H]32)nc2c3ccccc3oc21 ZINC000511797607 920490872 /nfs/dbraw/zinc/49/08/72/920490872.db2.gz PAHYZARLGRDTIP-QRVBRYPASA-N 0 3 401.466 4.086 20 0 HIADHN C[C@@H](CC(=O)Nc1cc(C(F)(F)F)ccc1Cl)N[C@@H](CO)c1ccsc1 ZINC000511921638 920665515 /nfs/dbraw/zinc/66/55/15/920665515.db2.gz IJOHMBCMDZKKPU-BONVTDFDSA-N 0 3 406.857 4.461 20 0 HIADHN CC(C)N1CC[C@H](NCc2ncc(CN(C)C)s2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000511925353 920672077 /nfs/dbraw/zinc/67/20/77/920672077.db2.gz YBGXKVDRYLDDNY-ICSRJNTNSA-N 0 3 410.990 4.311 20 0 HIADHN COCCNc1ccc(CNCc2cnn(-c3ccc(C(F)(F)F)cc3)c2)cc1 ZINC000512023398 920798119 /nfs/dbraw/zinc/79/81/19/920798119.db2.gz KDKYXPPLGOTIMF-UHFFFAOYSA-N 0 3 404.436 4.239 20 0 HIADHN COc1cc2c(cc1OC)CCN(Cc1ccccc1OCc1ccncc1)CC2 ZINC000512043960 920814068 /nfs/dbraw/zinc/81/40/68/920814068.db2.gz APUYAGTWWXLHSD-UHFFFAOYSA-N 0 3 404.510 4.279 20 0 HIADHN CCNC(=O)COc1cccc(CN[C@H](C)c2cc(C)c(Br)s2)c1 ZINC000512046329 920816554 /nfs/dbraw/zinc/81/65/54/920816554.db2.gz SREGIWIHWUEKMN-CYBMUJFWSA-N 0 3 411.365 4.185 20 0 HIADHN Cc1cc([C@H](C)NCCNC(=O)c2c(F)cccc2F)sc1Br ZINC000512055720 920825892 /nfs/dbraw/zinc/82/58/92/920825892.db2.gz ZJKMJFKLFAJMBU-JTQLQIEISA-N 0 3 403.292 4.178 20 0 HIADHN Brc1ccc(CNCc2ccc3occc3c2)c(N2CCOCC2)c1 ZINC000512067406 920833969 /nfs/dbraw/zinc/83/39/69/920833969.db2.gz KXGPVYQEZLZKEQ-UHFFFAOYSA-N 0 3 401.304 4.322 20 0 HIADHN Cc1cc(CN2CCN(CCCOCC(F)(F)F)CC2)ccc1Oc1cccnc1 ZINC000512067594 920835427 /nfs/dbraw/zinc/83/54/27/920835427.db2.gz MLWZSWQXBHPGAN-UHFFFAOYSA-N 0 3 423.479 4.269 20 0 HIADHN C[C@@H]1CN(C[C@H]2CCCN2CC2=Cc3cc(Cl)cc(Cl)c3OC2)C[C@@H](C)O1 ZINC000512072350 920838435 /nfs/dbraw/zinc/83/84/35/920838435.db2.gz NKFVKUPSQVOSDJ-SPYBWZPUSA-N 0 3 411.373 4.343 20 0 HIADHN C[C@@H](CN1CCN(CCCOCC(F)(F)F)CC1)c1cccc(Br)c1 ZINC000512082703 920846716 /nfs/dbraw/zinc/84/67/16/920846716.db2.gz KXRUBJNCMSRMPJ-HNNXBMFYSA-N 0 3 423.317 4.139 20 0 HIADHN Cc1nn(C)cc1[C@H](C)N[C@H](C)CC(=O)Nc1cc(C(F)(F)F)ccc1Cl ZINC000512087347 920851172 /nfs/dbraw/zinc/85/11/72/920851172.db2.gz IRTZVDXFJWEKCQ-MNOVXSKESA-N 0 3 402.848 4.469 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)NCc2ccsc2Br)C1 ZINC000512112523 920868562 /nfs/dbraw/zinc/86/85/62/920868562.db2.gz OBPZMJROINVTKR-XJKSGUPXSA-N 0 3 408.365 4.145 20 0 HIADHN C[C@H](NC(=O)c1ccc(Cl)c(NC(=O)c2cccs2)c1)C1=CCN(C)CC1 ZINC000512131662 920880408 /nfs/dbraw/zinc/88/04/08/920880408.db2.gz HIYRHXROYXOVGK-ZDUSSCGKSA-N 0 3 403.935 4.034 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)c2sc(C(=O)N[C@H](C)C3=CCN(C)CC3)cc12 ZINC000512137695 920884088 /nfs/dbraw/zinc/88/40/88/920884088.db2.gz JQXOGSWWMACBNY-CYBMUJFWSA-N 0 3 414.962 4.429 20 0 HIADHN OCC[C@@H](NC[C@H](O)COCc1ccccc1Cl)c1ccc(Cl)c(Cl)c1 ZINC000512192810 920936246 /nfs/dbraw/zinc/93/62/46/920936246.db2.gz FLTBFHRJWMJCBV-HNAYVOBHSA-N 0 3 418.748 4.238 20 0 HIADHN O=C(CN1CCC[C@@]2(CC=CCC2)C1)N1CCC[C@@H]1c1ccc2c(c1)OCCCO2 ZINC000512208769 920954615 /nfs/dbraw/zinc/95/46/15/920954615.db2.gz HLJVUPJIECKFSC-BWKNWUBXSA-N 0 3 410.558 4.334 20 0 HIADHN COc1ccc(NC(=O)[C@H](NCCc2ccc3c(c2)CCO3)c2ccccc2)cc1 ZINC000512232052 920984639 /nfs/dbraw/zinc/98/46/39/920984639.db2.gz AAXUMEBPAIPWQZ-XMMPIXPASA-N 0 3 402.494 4.142 20 0 HIADHN Cc1cccc(-c2n[nH]cc2CN2CCC(C(=O)N3CCc4ccccc43)CC2)c1 ZINC000512274156 921029786 /nfs/dbraw/zinc/02/97/86/921029786.db2.gz AWHRXRMKHNWLHT-UHFFFAOYSA-N 0 3 400.526 4.186 20 0 HIADHN Cc1cc(CN2CCSCC2)ccc1NC(=O)c1cccc(Cn2ccnc2)c1 ZINC000512282758 921036363 /nfs/dbraw/zinc/03/63/63/921036363.db2.gz UJWOKTOHLVZCEZ-UHFFFAOYSA-N 0 3 406.555 4.041 20 0 HIADHN CCn1ccnc1[C@H]1OCC[C@@H]1NCc1cc(Br)cc(C(F)(F)F)c1 ZINC000512355018 921100137 /nfs/dbraw/zinc/10/01/37/921100137.db2.gz OVMNJPMPNNEHFT-GJZGRUSLSA-N 0 3 418.257 4.304 20 0 HIADHN O=C(NC1CCN(Cc2c[nH]nc2-c2cccc(Cl)c2)CC1)C1CCCCC1 ZINC000512360163 921103108 /nfs/dbraw/zinc/10/31/08/921103108.db2.gz SVHXMYZKBGTKDV-UHFFFAOYSA-N 0 3 400.954 4.391 20 0 HIADHN COC(=O)[C@H](NC1CCN([C@H](C)c2ccncc2)CC1)c1cccc(Cl)c1Cl ZINC000513456989 921821880 /nfs/dbraw/zinc/82/18/80/921821880.db2.gz HAZIVMNMVPIHHV-JLTOFOAXSA-N 0 3 422.356 4.418 20 0 HIADHN COc1cc(CN2CCC[C@@H]2c2ccc(C)s2)ccc1OCC(=O)N1CCCC1 ZINC000513479633 921836697 /nfs/dbraw/zinc/83/66/97/921836697.db2.gz PAGQJOVJKSHNAK-LJQANCHMSA-N 0 3 414.571 4.403 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2CN[C@H](Cc2ccccn2)c2cccnc2)C[C@H](C)O1 ZINC000513498532 921848822 /nfs/dbraw/zinc/84/88/22/921848822.db2.gz AMTIQPGAEIPMCR-YZIHRLCOSA-N 0 3 416.569 4.159 20 0 HIADHN CN(Cc1cccc(F)c1)C[C@H](O)COc1ccc(Cl)cc1Br ZINC000513502789 921852555 /nfs/dbraw/zinc/85/25/55/921852555.db2.gz FSBSMDVMVBXJQL-HNNXBMFYSA-N 0 3 402.691 4.113 20 0 HIADHN O[C@H](CN[C@@H](Cc1ccccn1)c1cccnc1)COc1cccc(Cl)c1Cl ZINC000513546446 921883299 /nfs/dbraw/zinc/88/32/99/921883299.db2.gz XWKPLYFSGBEMAP-MJGOQNOKSA-N 0 3 418.324 4.097 20 0 HIADHN O[C@H](CN[C@H](Cc1ccccn1)c1cccnc1)COc1cccc(Cl)c1Cl ZINC000513546445 921883501 /nfs/dbraw/zinc/88/35/01/921883501.db2.gz XWKPLYFSGBEMAP-IEBWSBKVSA-N 0 3 418.324 4.097 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2CNCc2csc(Br)c2)C[C@H](C)O1 ZINC000513587810 921920326 /nfs/dbraw/zinc/92/03/26/921920326.db2.gz BDXBUJRLPSNQIZ-GASCZTMLSA-N 0 3 409.393 4.410 20 0 HIADHN COc1ccc2[nH]cc(C3CCN([C@H](C)C(=O)N4CCc5ccccc54)CC3)c2c1 ZINC000513624547 921953555 /nfs/dbraw/zinc/95/35/55/921953555.db2.gz MHXPIKDMXPITDS-QGZVFWFLSA-N 0 3 403.526 4.334 20 0 HIADHN O=C1COc2ccc(CN[C@@H](c3cccc(C(F)(F)F)c3)C3CCOCC3)cc2N1 ZINC000513632631 921958022 /nfs/dbraw/zinc/95/80/22/921958022.db2.gz DSSYKZPYVZHGKJ-OAQYLSRUSA-N 0 3 420.431 4.294 20 0 HIADHN Cc1nn(Cc2ccc(Cl)cc2)c(C)c1CN1CCC[C@H](c2nnc3n2CCC3)C1 ZINC000513691244 922011629 /nfs/dbraw/zinc/01/16/29/922011629.db2.gz SUBXUQTYTWGQQO-IBGZPJMESA-N 0 3 424.980 4.119 20 0 HIADHN COc1cc(Cl)c(C(=O)NC[C@H](C(C)C)N2CCc3ccccc3C2)cc1OC ZINC000513692926 922013666 /nfs/dbraw/zinc/01/36/66/922013666.db2.gz WXSKVFKYZNZWPK-HXUWFJFHSA-N 0 3 416.949 4.170 20 0 HIADHN Cc1ccccc1-c1nn(-c2ccccc2)cc1CN1CCC(N2CCCC2=O)CC1 ZINC000513737216 922058078 /nfs/dbraw/zinc/05/80/78/922058078.db2.gz XHHYJGDQZAIFBD-UHFFFAOYSA-N 0 3 414.553 4.435 20 0 HIADHN CN(CCCC(=O)OC(C)(C)C)Cc1cn(-c2ccccc2)nc1-c1cccnc1 ZINC000513759513 922077361 /nfs/dbraw/zinc/07/73/61/922077361.db2.gz FWROYURIXDYLQC-UHFFFAOYSA-N 0 3 406.530 4.488 20 0 HIADHN C[C@@]1(c2ccc(CN[C@@H]3CC4(CCCCC4)Oc4ccccc43)cc2)NC(=O)NC1=O ZINC000513789264 922116903 /nfs/dbraw/zinc/11/69/03/922116903.db2.gz FLZAWKXMOLGTGI-YKSBVNFPSA-N 0 3 419.525 4.058 20 0 HIADHN COc1ccc(CCC(=O)N2CCCN(CCCOc3cc(C)cc(C)c3)CC2)cc1 ZINC000513816491 922140339 /nfs/dbraw/zinc/14/03/39/922140339.db2.gz OTIQTGUNWHJQQH-UHFFFAOYSA-N 0 3 424.585 4.248 20 0 HIADHN Cc1ccc(NC(=O)[C@@H](c2ccccc2)N2CCC(CCN3CCOCC3)CC2)cc1 ZINC000513819630 922143574 /nfs/dbraw/zinc/14/35/74/922143574.db2.gz AEWJUZDISSVWLV-RUZDIDTESA-N 0 3 421.585 4.109 20 0 HIADHN CN(C)CCN(C(=O)Cc1c[nH]c2cccc(Br)c12)c1ccccc1 ZINC000513830844 922157847 /nfs/dbraw/zinc/15/78/47/922157847.db2.gz FGIUEVJLCYGTNX-UHFFFAOYSA-N 0 3 400.320 4.068 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)c1ccccc1Oc1ccncc1 ZINC000513835823 922163166 /nfs/dbraw/zinc/16/31/66/922163166.db2.gz UZGZTFJKLRIXSK-UHFFFAOYSA-N 0 3 403.482 4.083 20 0 HIADHN O=C(Nc1cccc(CN[C@H]2CCc3c2cccc3Br)c1)[C@H]1CCCO1 ZINC000513873516 922202581 /nfs/dbraw/zinc/20/25/81/922202581.db2.gz ZELFQAJBFAHEOE-VQTJNVASSA-N 0 3 415.331 4.344 20 0 HIADHN C[C@H](NC(=O)NC[C@@H](c1ccccc1)N1CCCC1)c1cccc(N2CCCC2=O)c1 ZINC000513889250 922217303 /nfs/dbraw/zinc/21/73/03/922217303.db2.gz PLLONRXODLATPX-CVDCTZTESA-N 0 3 420.557 4.011 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)Nc1cccc(C(F)F)c1 ZINC000513904703 922226133 /nfs/dbraw/zinc/22/61/33/922226133.db2.gz AEUFNXBCMJOZAW-UHFFFAOYSA-N 0 3 402.489 4.348 20 0 HIADHN O=C(NCc1ccccc1Br)NC[C@H](c1ccccc1)N1CCCC1 ZINC000513929007 922250412 /nfs/dbraw/zinc/25/04/12/922250412.db2.gz APGRJMQTIVVWNV-LJQANCHMSA-N 0 3 402.336 4.085 20 0 HIADHN Cc1noc(C)c1[C@H](C)CC(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000513929532 922250849 /nfs/dbraw/zinc/25/08/49/922250849.db2.gz IPDVIMOKRBQYKH-OXQOHEQNSA-N 0 3 407.518 4.067 20 0 HIADHN COc1ccc(CCCC(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)c(OC)c1 ZINC000513946934 922264234 /nfs/dbraw/zinc/26/42/34/922264234.db2.gz RKPQQQGTDHRFDO-FQEVSTJZSA-N 0 3 410.558 4.150 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1cc2c(cc1SC)OCCO2)c1ccsc1 ZINC000513976194 922296749 /nfs/dbraw/zinc/29/67/49/922296749.db2.gz SBUAOPQXGIVZJB-INIZCTEOSA-N 0 3 421.588 4.446 20 0 HIADHN CCC[C@H](Cc1ccccc1)N(CCC)Cc1cnn([C@@]2(C)CCS(=O)(=O)C2)c1 ZINC000514087033 922410866 /nfs/dbraw/zinc/41/08/66/922410866.db2.gz FLQSUMWXYDHBHR-PKTZIBPZSA-N 0 3 417.619 4.040 20 0 HIADHN CCc1nn(C)c(CC)c1CN1CCC([C@H]2c3ccc(Cl)cc3NC2=O)CC1 ZINC000514091533 922413614 /nfs/dbraw/zinc/41/36/14/922413614.db2.gz ZLGBFJAEDWFHIG-NRFANRHFSA-N 0 3 400.954 4.146 20 0 HIADHN Cn1cc(CN(CCCO)C(c2ccccc2)c2ccccc2)c(-c2ccncc2)n1 ZINC000514091474 922414705 /nfs/dbraw/zinc/41/47/05/922414705.db2.gz ZCCIGGFHBHNXNA-UHFFFAOYSA-N 0 3 412.537 4.456 20 0 HIADHN Cc1cc(C(=O)NC2CCN(Cc3c[nH]nc3-c3ccc(Cl)cc3)CC2)c(C)o1 ZINC000514104271 922433036 /nfs/dbraw/zinc/43/30/36/922433036.db2.gz IPLVXXSWSQBXCK-UHFFFAOYSA-N 0 3 412.921 4.334 20 0 HIADHN CCN1CCN(CCC(=O)NCc2ccc(Oc3cccc4ccccc43)cc2)CC1 ZINC000514126283 922458759 /nfs/dbraw/zinc/45/87/59/922458759.db2.gz GLDCAVMZONVGRC-UHFFFAOYSA-N 0 3 417.553 4.276 20 0 HIADHN CCCOc1ccc([C@H](C)NC(=O)NC[C@@H](c2ccc(C)cc2)N(C)C)cc1OC ZINC000514126763 922459557 /nfs/dbraw/zinc/45/95/57/922459557.db2.gz LUHYAVYJPISKIA-RXVVDRJESA-N 0 3 413.562 4.456 20 0 HIADHN CC(C)[C@@H]1C[C@@H](CC(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)CCO1 ZINC000514188724 922529292 /nfs/dbraw/zinc/52/92/92/922529292.db2.gz HCOHFNXMNDTQDB-ICSRJNTNSA-N 0 3 414.512 4.437 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N3CC[C@H](C(F)(F)F)C4(CCC4)C3)cc2)CC1 ZINC000514193840 922534282 /nfs/dbraw/zinc/53/42/82/922534282.db2.gz UKHYUEDMUKUCTO-IBGZPJMESA-N 0 3 409.496 4.023 20 0 HIADHN CC[C@H](NC(=O)NCCCN1CCc2ccccc2C1)c1nc(-c2ccccc2)c[nH]1 ZINC000514206918 922543782 /nfs/dbraw/zinc/54/37/82/922543782.db2.gz WOQZAZYBHDZMJO-QFIPXVFZSA-N 0 3 417.557 4.275 20 0 HIADHN CC(=O)Nc1ccc(S(=O)(=O)CCCN(Cc2ccccc2)[C@@H](C)C2CC2)cc1 ZINC000514230707 922567469 /nfs/dbraw/zinc/56/74/69/922567469.db2.gz MJTQXIHUEACIBO-SFHVURJKSA-N 0 3 414.571 4.110 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@@H]1CCCOc2ccc(F)cc21)c1ccsc1 ZINC000514242474 922582046 /nfs/dbraw/zinc/58/20/46/922582046.db2.gz SFHHLXQMKXTLNN-RTBURBONSA-N 0 3 405.539 4.483 20 0 HIADHN CCCN(C(=O)NCc1cccc(COC)c1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000514247665 922589629 /nfs/dbraw/zinc/58/96/29/922589629.db2.gz DRJVEXQEFFVQCS-XMMPIXPASA-N 0 3 409.574 4.419 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)Nc2cc(Cl)c(OC)cc2OC)N(C)C)cc1 ZINC000514508213 922660912 /nfs/dbraw/zinc/66/09/12/922660912.db2.gz AJRPTVKGNQVXHF-GOSISDBHSA-N 0 3 405.926 4.344 20 0 HIADHN COc1cccc([C@@H]2CCCN2C[C@@H](O)COc2ccc(Br)cc2)c1 ZINC000514523157 922672636 /nfs/dbraw/zinc/67/26/36/922672636.db2.gz SHTXEBQPCORRFI-XLIONFOSSA-N 0 3 406.320 4.035 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@@H](C)c1ccc(OC)c(F)c1)c1cccc(OC)c1 ZINC000514535917 922683008 /nfs/dbraw/zinc/68/30/08/922683008.db2.gz KOVRSPUWBXIGBJ-HRAATJIYSA-N 0 3 417.525 4.286 20 0 HIADHN COc1ccc(OC)c([C@H]2CCCN2C[C@H](O)COCc2ccccc2Cl)c1 ZINC000514710877 922770737 /nfs/dbraw/zinc/77/07/37/922770737.db2.gz MHTQNGOEKSEIDG-LAUBAEHRSA-N 0 3 405.922 4.072 20 0 HIADHN COc1ccc(C[C@@](C)(O)CN[C@H](C)c2sccc2Br)cc1OC ZINC000514892754 922835573 /nfs/dbraw/zinc/83/55/73/922835573.db2.gz AVEIZRAUYIQQIE-KZULUSFZSA-N 0 3 414.365 4.172 20 0 HIADHN COc1ccc([C@@H](Cc2ccccc2)NCc2ccc(N3CCO[C@H](C)C3)nc2)cc1 ZINC000515257045 923021808 /nfs/dbraw/zinc/02/18/08/923021808.db2.gz JKOLYQLJGZXTDU-CJFMBICVSA-N 0 3 417.553 4.389 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc(CN[C@H]2CCCc3c4ccccc4[nH]c32)cc1 ZINC000515304672 923042042 /nfs/dbraw/zinc/04/20/42/923042042.db2.gz RPTZWCMASLMSGO-QFIPXVFZSA-N 0 3 411.571 4.366 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)Nc2cc3c(cc2Cl)OCCCO3)N(C)C)cc1 ZINC000515387372 923074811 /nfs/dbraw/zinc/07/48/11/923074811.db2.gz APTTUALSSFTWHG-LJQANCHMSA-N 0 3 417.937 4.488 20 0 HIADHN NC(=O)CC1CCN(Cc2cn(-c3ccccc3)nc2-c2ccc(Cl)cc2)CC1 ZINC000515415477 923090695 /nfs/dbraw/zinc/09/06/95/923090695.db2.gz OPTRZIBAKXBAAP-UHFFFAOYSA-N 0 3 408.933 4.280 20 0 HIADHN CC(C)(CN[C@@H](C(=O)NC1CC1)c1ccccc1)c1ccc(Br)cc1 ZINC000515519931 923151414 /nfs/dbraw/zinc/15/14/14/923151414.db2.gz ZXQFKDCCBOTHFX-LJQANCHMSA-N 0 3 401.348 4.336 20 0 HIADHN CCSCc1ccc(C(=O)NCc2ccccc2CN2CCN(CC)CC2)cc1 ZINC000515744768 923318856 /nfs/dbraw/zinc/31/88/56/923318856.db2.gz PUXXKSAZBMWSGW-UHFFFAOYSA-N 0 3 411.615 4.007 20 0 HIADHN Cc1ccc(C)n1-c1nc(CC(=O)N[C@H](CN2CCCC2)c2ccccc2)cs1 ZINC000515774640 923342385 /nfs/dbraw/zinc/34/23/85/923342385.db2.gz BJPHXMNVCCKXBF-OAQYLSRUSA-N 0 3 408.571 4.046 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)N[C@H](C)c2nc3ccccc3n2C(F)F)o1 ZINC000515787709 923350058 /nfs/dbraw/zinc/35/00/58/923350058.db2.gz KRYSSKJXLONNJA-OAHLLOKOSA-N 0 3 419.476 4.167 20 0 HIADHN O=C(CCc1cc2ccccc2o1)NCCCCN1CCN(c2ccccc2)CC1 ZINC000515809715 923366619 /nfs/dbraw/zinc/36/66/19/923366619.db2.gz PGBOKRLPOLCRCX-UHFFFAOYSA-N 0 3 405.542 4.084 20 0 HIADHN Cc1ccc(S[C@@H](C)C(=O)NCCCCN2CCN(c3ccccc3)CC2)cc1 ZINC000515814234 923369354 /nfs/dbraw/zinc/36/93/54/923369354.db2.gz UBURRILUTXKUKD-NRFANRHFSA-N 0 3 411.615 4.194 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N(C)Cc2ccccc2N2CCCC2)N(C)C)cc1 ZINC000515841352 923386098 /nfs/dbraw/zinc/38/60/98/923386098.db2.gz RFZUFVGBYAGPKQ-DEOSSOPVSA-N 0 3 408.590 4.294 20 0 HIADHN COc1ccc([C@H](CNC(=O)NCc2ccccc2OC(C)C)N2CCCC2)cc1 ZINC000515868433 923400995 /nfs/dbraw/zinc/40/09/95/923400995.db2.gz MFGLYIXAABOYNB-QFIPXVFZSA-N 0 3 411.546 4.119 20 0 HIADHN Cc1ccc(-n2ncc(C(=O)N3CCN([C@@H]4C[C@H]4C)C[C@H](C)C3)c2C(F)(F)F)cc1 ZINC000515891518 923415769 /nfs/dbraw/zinc/41/57/69/923415769.db2.gz RPYHKWVCQYKJEI-FRQCXROJSA-N 0 3 420.479 4.002 20 0 HIADHN Cc1c(Br)c2ccccc2n1CC(=O)Nc1cccc(CN(C)C)c1 ZINC000516071673 923527155 /nfs/dbraw/zinc/52/71/55/923527155.db2.gz PBDSTBBDRZBKCI-UHFFFAOYSA-N 0 3 400.320 4.413 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)c2cccc(NC(=O)C3CCCCC3)c2)cc1 ZINC000516190231 923591254 /nfs/dbraw/zinc/59/12/54/923591254.db2.gz PNRHLTHZUZCAPQ-QHCPKHFHSA-N 0 3 423.557 4.247 20 0 HIADHN COc1ccc2cc(C(=O)N3CCN(c4ccnc5ccccc54)CC3)c(C)nc2c1 ZINC000516200450 923594585 /nfs/dbraw/zinc/59/45/85/923594585.db2.gz HUWUIMGYNVOCKP-UHFFFAOYSA-N 0 3 412.493 4.062 20 0 HIADHN COc1ccc([C@H](CNC(=O)N[C@H]2CCc3c2cccc3Cl)N2CCCC2)cc1 ZINC000516226050 923613737 /nfs/dbraw/zinc/61/37/37/923613737.db2.gz RIJKTPWZBKKGJC-VXKWHMMOSA-N 0 3 413.949 4.472 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N[C@@H](C)COc3c(C)cccc3C)c(C)c2)CC1 ZINC000516232834 923619105 /nfs/dbraw/zinc/61/91/05/923619105.db2.gz CPOUZUFQOKDSPV-NRFANRHFSA-N 0 3 424.589 4.343 20 0 HIADHN Cc1cc(NC(=O)c2ccc(F)cc2Cl)sc1C(=O)NC[C@@H](C)N1CCCC1 ZINC000516389707 923706708 /nfs/dbraw/zinc/70/67/08/923706708.db2.gz ABOYZNVAVWVFJW-CYBMUJFWSA-N 0 3 423.941 4.315 20 0 HIADHN CCOc1cc(CN2CCC[C@H](CCNC(C)=O)C2)ccc1OCc1ccccc1 ZINC000516514535 923773863 /nfs/dbraw/zinc/77/38/63/923773863.db2.gz XPZHKFDZKKYFFT-OAQYLSRUSA-N 0 3 410.558 4.403 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1)c1ccccc1OC(F)F ZINC000516579726 923800614 /nfs/dbraw/zinc/80/06/14/923800614.db2.gz MPDIQKIYHZYRKE-XYJFISCASA-N 0 3 403.473 4.484 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N[C@@H](C)c2ccccc2OC(F)F)C1 ZINC000516579725 923800915 /nfs/dbraw/zinc/80/09/15/923800915.db2.gz MPDIQKIYHZYRKE-LZLYRXPVSA-N 0 3 403.473 4.484 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)N(C)Cc2cc(Br)cs2)C1 ZINC000516581381 923802311 /nfs/dbraw/zinc/80/23/11/923802311.db2.gz IGDZRTNMCSHMRB-WMLDXEAASA-N 0 3 422.392 4.488 20 0 HIADHN CC1CCN([C@H](CNC(=O)N2CC(C)(C)[C@@H]2[C@H]2CCCO2)c2cccs2)CC1 ZINC000516610658 923815535 /nfs/dbraw/zinc/81/55/35/923815535.db2.gz ZNUPCEHSLCFQRE-GGPKGHCWSA-N 0 3 405.608 4.120 20 0 HIADHN C[C@@H](CN1C[C@H](C)C[C@H](C)C1)NC(=O)N1CCC(C(=O)c2ccc(Cl)cc2)CC1 ZINC000516683803 923844140 /nfs/dbraw/zinc/84/41/40/923844140.db2.gz SNYZKHWEIXKWJG-KSZLIROESA-N 0 3 419.997 4.311 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)NCCSCc2ccccc2F)C1 ZINC000516708153 923856091 /nfs/dbraw/zinc/85/60/91/923856091.db2.gz AFUUTGOSBXCHHI-XLIONFOSSA-N 0 3 401.551 4.194 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N(C)Cc2csc(Br)c2)C1 ZINC000516709000 923857491 /nfs/dbraw/zinc/85/74/91/923857491.db2.gz RTOZJLDHSGXSKB-RHSMWYFYSA-N 0 3 422.392 4.488 20 0 HIADHN CCCN(C)[C@H](CNC(=O)NCc1csc([C@@H](C)OC)n1)c1ccc(Cl)cc1 ZINC000516798865 923891152 /nfs/dbraw/zinc/89/11/52/923891152.db2.gz CJMINCAVDSRWCM-RDTXWAMCSA-N 0 3 424.998 4.386 20 0 HIADHN Cc1cc(=O)[nH]c2cc(C(=O)NC[C@H](c3ccc(OC(C)C)cc3)N(C)C)ccc12 ZINC000516810705 923897608 /nfs/dbraw/zinc/89/76/08/923897608.db2.gz NJCHVMJGQWYCOB-JOCHJYFZSA-N 0 3 407.514 4.069 20 0 HIADHN CC(C)[C@H](NC[C@H](O)CS(=O)(=O)c1cccs1)c1ccc(C(C)(C)C)cc1 ZINC000517045621 923971432 /nfs/dbraw/zinc/97/14/32/923971432.db2.gz FFRJKFGWNJLJGW-ICSRJNTNSA-N 0 3 409.617 4.167 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)Cc1coc(-c2ccc(Cl)cc2)n1 ZINC000517080302 923987068 /nfs/dbraw/zinc/98/70/68/923987068.db2.gz MRHIDLGOZIAGIT-UHFFFAOYSA-N 0 3 415.896 4.267 20 0 HIADHN CC(C)Oc1ccc(CC[C@@H](C)N[C@H](C(N)=O)c2ccc(Br)cc2)cc1 ZINC000517166579 924034144 /nfs/dbraw/zinc/03/41/44/924034144.db2.gz MLAQGSVJSKVMNZ-QRWLVFNGSA-N 0 3 419.363 4.374 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)N(Cc2cccs2)C[C@@H]2CCCO2)CCN1Cc1ccccc1 ZINC000517255490 924063675 /nfs/dbraw/zinc/06/36/75/924063675.db2.gz LUKITIPFQJFXKE-CBQOVEMMSA-N 0 3 413.587 4.102 20 0 HIADHN Cc1sc2nc(C)nc(SCC(=O)NC[C@@H](C)N3CCCC[C@H]3C)c2c1C ZINC000517347191 924121205 /nfs/dbraw/zinc/12/12/05/924121205.db2.gz ALOBPJACUYZTGD-CHWSQXEVSA-N 0 3 406.621 4.088 20 0 HIADHN C[C@@H](NC(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1)c1nc(C(C)(C)C)cs1 ZINC000517373111 924141773 /nfs/dbraw/zinc/14/17/73/924141773.db2.gz HSZXZFXCKAXSTO-BRWVUGGUSA-N 0 3 422.639 4.032 20 0 HIADHN COc1ccccc1[C@@H](C)CC(=O)NCC1(N2CCOC(C)(C)C2)CCCCC1 ZINC000517481999 924221430 /nfs/dbraw/zinc/22/14/30/924221430.db2.gz CIYIMRDGHASEAK-IBGZPJMESA-N 0 3 402.579 4.119 20 0 HIADHN C[C@H](CNC(=O)N1CCC(C(=O)c2ccc(Cl)cc2)CC1)N1CCC[C@@H](C)C1 ZINC000517523449 924244528 /nfs/dbraw/zinc/24/45/28/924244528.db2.gz YFUNAPKVXHDRCK-IAGOWNOFSA-N 0 3 405.970 4.065 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)N[C@@H](CC(F)(F)F)c1ccccc1 ZINC000517654791 926761908 /nfs/dbraw/zinc/76/19/08/926761908.db2.gz DUNXSYDHCMIGAS-NRFANRHFSA-N 0 3 419.491 4.399 20 0 HIADHN Cc1cc(Cl)ccc1OCCCNC(=O)N(Cc1ccco1)C1CCN(C)CC1 ZINC000517686898 926790766 /nfs/dbraw/zinc/79/07/66/926790766.db2.gz JDJVIISSWFWURA-UHFFFAOYSA-N 0 3 419.953 4.316 20 0 HIADHN COc1ccc(OCCCNCc2nc(-c3cccc(Br)c3)c[nH]2)cc1 ZINC000517709670 926807790 /nfs/dbraw/zinc/80/77/90/926807790.db2.gz PFPAMSIULOCHGW-UHFFFAOYSA-N 0 3 416.319 4.407 20 0 HIADHN c1nc(-c2ccncc2)sc1CN1CCC[C@@H](c2nc(-c3ccccc3)n[nH]2)C1 ZINC000517726259 926816145 /nfs/dbraw/zinc/81/61/45/926816145.db2.gz FNKCCHRQRUBFNB-GOSISDBHSA-N 0 3 402.527 4.370 20 0 HIADHN Cc1cc(C)c(NC(=O)CN(C)C(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)c(C)c1 ZINC000517789197 926837206 /nfs/dbraw/zinc/83/72/06/926837206.db2.gz HLEQPEAVKJYJOG-IFMALSPDSA-N 0 3 422.573 4.027 20 0 HIADHN COc1ccc(-c2nc(C)c(C(=O)NCCN3[C@H](C)CCC[C@@H]3C)s2)cc1OC ZINC000518070973 927005136 /nfs/dbraw/zinc/00/51/36/927005136.db2.gz ZUOJAPKSNYZBJK-GASCZTMLSA-N 0 3 417.575 4.128 20 0 HIADHN C[C@H]1CCC[C@H](C)N1CCNC(=O)CSc1nnc(-c2ccc3ccccc3c2)o1 ZINC000518070696 927005293 /nfs/dbraw/zinc/00/52/93/927005293.db2.gz LWSGCKZYRQQWNE-IRXDYDNUSA-N 0 3 424.570 4.361 20 0 HIADHN COC1CCN(C(C)(C)CNC(=O)c2ccccc2SCc2cscn2)CC1 ZINC000518083332 927011605 /nfs/dbraw/zinc/01/16/05/927011605.db2.gz XZNGKKFSMFUSBZ-UHFFFAOYSA-N 0 3 419.616 4.055 20 0 HIADHN C[C@H](c1ccc(Cl)cc1Cl)N(C)C(=O)C(=O)Nc1cccc(CN(C)C)c1 ZINC000518090241 927015984 /nfs/dbraw/zinc/01/59/84/927015984.db2.gz VYLLVLDPKLGEMI-CYBMUJFWSA-N 0 3 408.329 4.213 20 0 HIADHN COc1ccc([C@H](CNC(=O)Nc2ccc(C(F)(F)F)nc2)N2CCCC2)cc1 ZINC000518146314 927045627 /nfs/dbraw/zinc/04/56/27/927045627.db2.gz GPBVDHKKUZJBRP-KRWDZBQOSA-N 0 3 408.424 4.068 20 0 HIADHN O=C(Nc1ccc(OC(F)F)c2ncccc12)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000518171592 927061973 /nfs/dbraw/zinc/06/19/73/927061973.db2.gz BIVRGKFJCMMUGG-INIZCTEOSA-N 0 3 412.440 4.232 20 0 HIADHN CN(C)c1ccc(CNCc2ccc(OC(F)(F)[C@@H](F)C(F)(F)F)cc2)cn1 ZINC000518267946 927125824 /nfs/dbraw/zinc/12/58/24/927125824.db2.gz AVJNRJDPVOOBPS-INIZCTEOSA-N 0 3 407.358 4.309 20 0 HIADHN COc1ccc2ccccc2c1CNC[C@H](O)COc1cccc(C(F)(F)F)c1 ZINC000518276562 927133556 /nfs/dbraw/zinc/13/35/56/927133556.db2.gz BQFSCVIEJOEBGW-KRWDZBQOSA-N 0 3 405.416 4.397 20 0 HIADHN COc1c(Br)cc(Br)cc1CNC[C@H](O)C1CCCCC1 ZINC000518278630 927134742 /nfs/dbraw/zinc/13/47/42/927134742.db2.gz GOOSGNUARPFDMY-HNNXBMFYSA-N 0 3 421.173 4.251 20 0 HIADHN COCCN(C)CCNC(=O)c1c2c(nc3ccccc31)/C(=C\c1cccs1)CC2 ZINC000518288819 927149377 /nfs/dbraw/zinc/14/93/77/927149377.db2.gz QZJRXNSSNMQEFQ-MSUUIHNZSA-N 0 3 421.566 4.091 20 0 HIADHN Cc1ccccc1CCNC(=O)[C@H](C)N(C)CCCc1cc(-c2cccc(F)c2)n[nH]1 ZINC000518316747 927180435 /nfs/dbraw/zinc/18/04/35/927180435.db2.gz TUHLKZNRHICREZ-IBGZPJMESA-N 0 3 422.548 4.136 20 0 HIADHN C[C@@H](CNC(=O)c1ccc2c(c1)[nH]c(=O)n2C1CCCC1)N(C)Cc1ccccc1 ZINC000518435951 927269504 /nfs/dbraw/zinc/26/95/04/927269504.db2.gz UUNWSWMKKQGXAF-KRWDZBQOSA-N 0 3 406.530 4.107 20 0 HIADHN C[C@@H](CNC(=O)NCc1cccc(NC(=O)C2CCCC2)c1)N(C)Cc1ccccc1 ZINC000518452590 927286444 /nfs/dbraw/zinc/28/64/44/927286444.db2.gz MXLJWMPEPZTLRS-IBGZPJMESA-N 0 3 422.573 4.135 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)N1CCC[C@@H]1CCc1ccccc1 ZINC000518457697 927288830 /nfs/dbraw/zinc/28/88/30/927288830.db2.gz JWADODJCCYTGJT-RUZDIDTESA-N 0 3 405.586 4.213 20 0 HIADHN CCc1ccc([C@H](CNC(=O)Nc2cc(-c3nc(C)no3)ccc2C)N(C)C)cc1 ZINC000518459354 927289972 /nfs/dbraw/zinc/28/99/72/927289972.db2.gz WPWIRQNQPRCYPA-NRFANRHFSA-N 0 3 407.518 4.340 20 0 HIADHN Cc1cccc(C(=O)N2CCCC2)c1NC(=O)N[C@H]1CCN(Cc2ccccc2)[C@H]1C ZINC000518506699 927315484 /nfs/dbraw/zinc/31/54/84/927315484.db2.gz JPDJNMOCYOXLFH-UGKGYDQZSA-N 0 3 420.557 4.016 20 0 HIADHN C[C@@H](C(=O)Nc1cccc(N2CCCC2=O)c1)N1CCC[C@H](Cc2ccccc2)C1 ZINC000518514982 927320132 /nfs/dbraw/zinc/32/01/32/927320132.db2.gz HHWHMTFHJIBJHL-PZJWPPBQSA-N 0 3 405.542 4.095 20 0 HIADHN COc1ccccc1[C@H](NC(=O)[C@H]1CCCN(Cc2cccnc2)C1)c1ccccc1 ZINC000518657515 927411193 /nfs/dbraw/zinc/41/11/93/927411193.db2.gz MJYMLKMZPROLAW-WIOPSUGQSA-N 0 3 415.537 4.208 20 0 HIADHN C[C@@H]1CN([C@H](CNCC2=Cc3ccccc3OC2)c2c(F)cccc2Cl)CCO1 ZINC000518765551 927482867 /nfs/dbraw/zinc/48/28/67/927482867.db2.gz LMRGWGGIUNWTSK-IIBYNOLFSA-N 0 3 416.924 4.307 20 0 HIADHN C[C@@H](c1ccc(OC(F)(F)F)cc1)N1CCN(CCCOCC(F)(F)F)CC1 ZINC000518827149 927523666 /nfs/dbraw/zinc/52/36/66/927523666.db2.gz OVLHHNNGHPHOAU-AWEZNQCLSA-N 0 3 414.390 4.233 20 0 HIADHN CCCCOc1ccccc1NC(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000518838987 927537106 /nfs/dbraw/zinc/53/71/06/927537106.db2.gz ZVVNYDZLSDLJCF-KDURUIRLSA-N 0 3 403.567 4.219 20 0 HIADHN CCN(CC)[C@@H](CNc1ncc(C(=O)N2CCCCC2)cc1Cl)c1ccco1 ZINC000518842137 927542831 /nfs/dbraw/zinc/54/28/31/927542831.db2.gz IFCIRTDAWRYWCC-SFHVURJKSA-N 0 3 404.942 4.449 20 0 HIADHN C[C@H](Cc1ccsc1)NC(=O)N(CCN(C)C)Cc1ccc(C(F)(F)F)cc1 ZINC000518862576 927567474 /nfs/dbraw/zinc/56/74/74/927567474.db2.gz SRFBBIRRWCMKNK-OAHLLOKOSA-N 0 3 413.509 4.471 20 0 HIADHN COc1cccc([C@H]2CCCN2C(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)c1 ZINC000518904103 927614168 /nfs/dbraw/zinc/61/41/68/927614168.db2.gz ODMGSPRTJIQIRJ-XMMPIXPASA-N 0 3 407.558 4.203 20 0 HIADHN C[C@H](C(=O)N(C)CCCc1nc2ccccc2[nH]1)N1CCC(Cc2ccccc2)CC1 ZINC000518917238 927625425 /nfs/dbraw/zinc/62/54/25/927625425.db2.gz JAEBJCRGEQYPCL-HXUWFJFHSA-N 0 3 418.585 4.297 20 0 HIADHN CN(C)Cc1ccc(C(=O)Nc2nnc(-c3cccc(Br)c3)s2)cc1 ZINC000518984249 927675943 /nfs/dbraw/zinc/67/59/43/927675943.db2.gz LWGLIUAFTGDKCG-UHFFFAOYSA-N 0 3 417.332 4.282 20 0 HIADHN O=C(CN[C@H](c1cccc(C(F)(F)F)c1)C1CCOCC1)NC(C1CC1)C1CC1 ZINC000519008452 927688583 /nfs/dbraw/zinc/68/85/83/927688583.db2.gz GYTMRAROVNWODR-FQEVSTJZSA-N 0 3 410.480 4.068 20 0 HIADHN COc1cc(CN(C)C(=O)N[C@@H]2CCN(Cc3ccccc3)[C@@H]2C)ccc1SC ZINC000519020278 927698108 /nfs/dbraw/zinc/69/81/08/927698108.db2.gz AFWOGNNVUDMITE-YLJYHZDGSA-N 0 3 413.587 4.222 20 0 HIADHN COc1ccc(-c2nsc(NC(=O)NC[C@@H](c3ccccc3)N3CCCC3)n2)cc1 ZINC000519035161 927711287 /nfs/dbraw/zinc/71/12/87/927711287.db2.gz MXEKFJUJNRVEDG-IBGZPJMESA-N 0 3 423.542 4.172 20 0 HIADHN CSc1ccc([C@@H](CNC(=O)c2cc(C)n(Cc3ccncc3)c2C)N(C)C)cc1 ZINC000519219098 927833225 /nfs/dbraw/zinc/83/32/25/927833225.db2.gz HQQVWIQURIRAAW-HSZRJFAPSA-N 0 3 422.598 4.303 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N[C@@H](c2ccc(F)cc2)[C@@H]2CCCO2)N(C)C)cc1 ZINC000519250875 927847053 /nfs/dbraw/zinc/84/70/53/927847053.db2.gz OALAAJDCAZDPDT-VABKMULXSA-N 0 3 413.537 4.210 20 0 HIADHN CC(=O)Nc1ccc(Cl)c(NC(=O)N(CCCc2ccccc2)CCN(C)C)c1 ZINC000519252534 927847816 /nfs/dbraw/zinc/84/78/16/927847816.db2.gz NTELSOHAAULBSX-UHFFFAOYSA-N 0 3 416.953 4.327 20 0 HIADHN C[C@@H](NC(=O)N1CCN(CC2CCCCC2)CC1)c1nc2ccccc2n1C(F)F ZINC000519260293 927852529 /nfs/dbraw/zinc/85/25/29/927852529.db2.gz ZHCDUBIVZNAOFE-MRXNPFEDSA-N 0 3 419.520 4.400 20 0 HIADHN Cc1c([C@@H](C)NC(=O)NC[C@@H](c2ccc(C)cc2)N(C)C)cnn1-c1ccc(F)cc1 ZINC000519342660 927889811 /nfs/dbraw/zinc/88/98/11/927889811.db2.gz GJAVGDRSUGUJJQ-HXOBKFHXSA-N 0 3 423.536 4.291 20 0 HIADHN CCOc1ccc(C(=O)CCC(=O)N2CCC(N3CCc4ccccc4C3)CC2)cc1 ZINC000519413348 927931488 /nfs/dbraw/zinc/93/14/88/927931488.db2.gz QIRIDOUOGLCWEG-UHFFFAOYSA-N 0 3 420.553 4.098 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@H](C)c1n[nH]c(C(C)C)n1)c1ccccc1Cl ZINC000519651437 928035006 /nfs/dbraw/zinc/03/50/06/928035006.db2.gz GKVWJIQPEWKPCH-RHSMWYFYSA-N 0 3 406.962 4.025 20 0 HIADHN Cc1ccc(-c2ccnn2C)cc1NC(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000519816610 928085578 /nfs/dbraw/zinc/08/55/78/928085578.db2.gz XTKLHJXBXGMAPN-HXUWFJFHSA-N 0 3 424.495 4.491 20 0 HIADHN CC[C@H](c1ccccc1)N(CC)CC(=O)N1CCC(C(=O)Nc2ccccc2)CC1 ZINC000519909391 928143905 /nfs/dbraw/zinc/14/39/05/928143905.db2.gz VNVFGMZLBQPDEF-HSZRJFAPSA-N 0 3 407.558 4.337 20 0 HIADHN Cc1ccc(C(=O)C2CCN(C(=O)[C@@H]3CCCN(Cc4ccccc4)C3)CC2)cc1 ZINC000519920253 928152223 /nfs/dbraw/zinc/15/22/23/928152223.db2.gz MEJCFADSOLGWTQ-XMMPIXPASA-N 0 3 404.554 4.329 20 0 HIADHN Cc1cc(C(=O)NC[C@@H]2CCCCN2Cc2ccccc2)c(C)n1-c1nccs1 ZINC000520058660 928283731 /nfs/dbraw/zinc/28/37/31/928283731.db2.gz ROXKWGRNBHKAER-FQEVSTJZSA-N 0 3 408.571 4.335 20 0 HIADHN Cc1ccc(OCc2nc(CC(=O)NC[C@H](c3ccc(C)cc3)N(C)C)cs2)cc1 ZINC000520065054 928289158 /nfs/dbraw/zinc/28/91/58/928289158.db2.gz YRGZYFBWBGWEPU-JOCHJYFZSA-N 0 3 423.582 4.301 20 0 HIADHN C[C@@H](Cc1cccc(Br)c1)NC(=O)N(CCN(C)C)Cc1ccccc1 ZINC000520086304 928302493 /nfs/dbraw/zinc/30/24/93/928302493.db2.gz IEOQFNSXYUMJEG-KRWDZBQOSA-N 0 3 418.379 4.154 20 0 HIADHN O=C(NCc1cc(F)ccc1Br)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000520112136 928318644 /nfs/dbraw/zinc/31/86/44/928318644.db2.gz GEUDKIJJDPVHPM-HNNXBMFYSA-N 0 3 423.301 4.256 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)Nc1nc(C(F)(F)F)cs1 ZINC000520129559 928327256 /nfs/dbraw/zinc/32/72/56/928327256.db2.gz WCUFTRSWVYRLAN-UHFFFAOYSA-N 0 3 406.861 4.411 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCc3cccc4cccnc43)c(C)c2)CC1 ZINC000520136649 928333286 /nfs/dbraw/zinc/33/32/86/928333286.db2.gz MHVCCRYYWQMLEP-UHFFFAOYSA-N 0 3 403.530 4.007 20 0 HIADHN CCN(Cc1ccc(OC)cc1OC)C(=O)N[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000520153800 928345336 /nfs/dbraw/zinc/34/53/36/928345336.db2.gz XVFNUDCCACLVCB-NQIIRXRSSA-N 0 3 411.546 4.071 20 0 HIADHN CCCN(CC(=O)N1CCc2cc(OC)c(OC)cc2C1)[C@H](CC)c1ccccc1 ZINC000520172733 928363071 /nfs/dbraw/zinc/36/30/71/928363071.db2.gz WSXJOLHXAPWUQH-JOCHJYFZSA-N 0 3 410.558 4.452 20 0 HIADHN CCc1ccc(-c2nn(-c3ccccc3)cc2C(=O)N[C@H]2CCN(C3CC3)C2)cc1 ZINC000520184754 928374018 /nfs/dbraw/zinc/37/40/18/928374018.db2.gz UGFPLPBARHGAKI-FQEVSTJZSA-N 0 3 400.526 4.068 20 0 HIADHN COc1ccc(C[C@](C)(O)CN[C@@H](C)c2nc(-c3ccccc3)cs2)cc1OC ZINC000520212393 928391065 /nfs/dbraw/zinc/39/10/65/928391065.db2.gz HGYBQHOZFIIKSJ-HJPURHCSSA-N 0 3 412.555 4.472 20 0 HIADHN COc1ccc(C[C@](C)(O)CN[C@H](C)c2nc(-c3ccccc3)cs2)cc1OC ZINC000520212394 928391134 /nfs/dbraw/zinc/39/11/34/928391134.db2.gz HGYBQHOZFIIKSJ-MWTRTKDXSA-N 0 3 412.555 4.472 20 0 HIADHN O=C(C[C@@H]1C=CCC1)Nc1ccccc1NC(=O)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000520272191 928437664 /nfs/dbraw/zinc/43/76/64/928437664.db2.gz PTZSIWAWMKGANZ-CTNGQTDRSA-N 0 3 418.541 4.227 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N(Cc2ccco2)C[C@H]2CCCO2)N2CCCC2)cc1 ZINC000520285844 928448337 /nfs/dbraw/zinc/44/83/37/928448337.db2.gz WAICKNHHBJWHNT-DHIUTWEWSA-N 0 3 411.546 4.116 20 0 HIADHN C[C@@H]1CN(c2nnc(C3CCCC3)n2C[C@H]2CCOC2)[C@@H](C)CN1Cc1ccccc1 ZINC000520301025 928463331 /nfs/dbraw/zinc/46/33/31/928463331.db2.gz BHCNTPRFVCEHRQ-RZUBCFFCSA-N 0 3 423.605 4.071 20 0 HIADHN COc1ccc(CCNCc2nc(-c3cccc(Br)c3)c[nH]2)cc1F ZINC000520391666 928542581 /nfs/dbraw/zinc/54/25/81/928542581.db2.gz HZEIKCFKDDSLJM-UHFFFAOYSA-N 0 3 404.283 4.319 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)c1cncc(-c2ccc(N(C)C)cc2)c1)c1ccco1 ZINC000520448626 928570885 /nfs/dbraw/zinc/57/08/85/928570885.db2.gz MOXXEKOJEYNLDJ-VGOFRKELSA-N 0 3 406.530 4.267 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)N[C@H](CN2CCCC2)c2ccccc2)c(C)c1 ZINC000520600918 928665072 /nfs/dbraw/zinc/66/50/72/928665072.db2.gz UWBVTDWAPTXEMQ-WMZHIEFXSA-N 0 3 422.573 4.482 20 0 HIADHN CN1CCN(CCCNC(=O)N(Cc2ccco2)C2CCCC2)[C@@H](c2ccccc2)C1 ZINC000520622076 928679634 /nfs/dbraw/zinc/67/96/34/928679634.db2.gz WMSACEHHLVIZPF-XMMPIXPASA-N 0 3 424.589 4.113 20 0 HIADHN COc1ccc([C@H](Cc2ccc(F)cc2)NC(=O)N(CCN(C)C)CC(C)C)cc1 ZINC000520658067 928704811 /nfs/dbraw/zinc/70/48/11/928704811.db2.gz PGEHEBUZIOZEKD-QHCPKHFHSA-N 0 3 415.553 4.347 20 0 HIADHN O=C(NCc1ccc(Br)cc1)NC[C@@H](c1cccs1)N1CCCC1 ZINC000520702269 928748997 /nfs/dbraw/zinc/74/89/97/928748997.db2.gz WLGZPZZUVSCAOR-INIZCTEOSA-N 0 3 408.365 4.147 20 0 HIADHN O=C(NCc1ccc(Br)cc1)NC[C@H](c1cccs1)N1CCCC1 ZINC000520702270 928749138 /nfs/dbraw/zinc/74/91/38/928749138.db2.gz WLGZPZZUVSCAOR-MRXNPFEDSA-N 0 3 408.365 4.147 20 0 HIADHN O=C([C@H](Sc1cc(F)ccc1F)c1ccccc1)N1CC[C@@H](N2CCCC2)C1 ZINC000520734531 928784269 /nfs/dbraw/zinc/78/42/69/928784269.db2.gz FPLLHKXNDNTLIT-WIYYLYMNSA-N 0 3 402.510 4.495 20 0 HIADHN COc1ccc(-c2ccc(C(=O)N3CC[C@@H](N4CCCCC4)C3)c(F)c2)c(F)c1 ZINC000520770158 928808669 /nfs/dbraw/zinc/80/86/69/928808669.db2.gz UUANPIMRHIATEM-QGZVFWFLSA-N 0 3 400.469 4.341 20 0 HIADHN CCC[C@@H](CNC(=O)CN(C)C[C@H]1CCCOC1)c1ccc(Cl)cc1Cl ZINC000520783836 928815413 /nfs/dbraw/zinc/81/54/13/928815413.db2.gz VDNNXYVLKOPHFC-CVEARBPZSA-N 0 3 401.378 4.352 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)CCOc1ccc(C)cc1Br ZINC000520835512 928837731 /nfs/dbraw/zinc/83/77/31/928837731.db2.gz HBXKMWBFGLTVCA-UHFFFAOYSA-N 0 3 421.335 4.235 20 0 HIADHN Cc1cc(NC(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)ccc1C(=O)NC(C)C ZINC000520903774 928868065 /nfs/dbraw/zinc/86/80/65/928868065.db2.gz XFBXLYMUVKQYGC-WIYYLYMNSA-N 0 3 408.546 4.090 20 0 HIADHN CCc1nc(CNCCCN2CCN(c3cccc(C(F)(F)F)c3)CC2)cs1 ZINC000520951678 928886894 /nfs/dbraw/zinc/88/68/94/928886894.db2.gz HGTSCLZJZSBHGE-UHFFFAOYSA-N 0 3 412.525 4.026 20 0 HIADHN O=C(NC[C@@H]1CCCO[C@@H]1c1ccccc1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000521014497 928930078 /nfs/dbraw/zinc/93/00/78/928930078.db2.gz WEZCJWAAONDNSZ-WMTXJRDZSA-N 0 3 410.533 4.322 20 0 HIADHN Cc1ccc(NC(=O)N(CCN(C)C)Cc2cccc(F)c2)cc1Br ZINC000521064279 928969410 /nfs/dbraw/zinc/96/94/10/928969410.db2.gz DIAGSZIDZJGPDP-UHFFFAOYSA-N 0 3 408.315 4.492 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)NCCc1csc2ccccc12 ZINC000521089330 928986756 /nfs/dbraw/zinc/98/67/56/928986756.db2.gz JHQMZCQQEYKGEI-UHFFFAOYSA-N 0 3 407.583 4.162 20 0 HIADHN CN(C)C[C@@H](NC(=O)N[C@H](c1ccccc1)c1ccccn1)c1ccc(Cl)cc1 ZINC000521276167 929095060 /nfs/dbraw/zinc/09/50/60/929095060.db2.gz WPJZDNDBHHUBQG-FGZHOGPDSA-N 0 3 408.933 4.427 20 0 HIADHN O=C(NC[C@H]1CCN(C2CC2)C1)c1ccccc1C(=O)c1ccc(Cl)c(Cl)c1 ZINC000521294386 929108221 /nfs/dbraw/zinc/10/82/21/929108221.db2.gz ZHNOBTRDWVUMPF-CQSZACIVSA-N 0 3 417.336 4.439 20 0 HIADHN CC1(C)CN(C2(CNC(=O)N[C@@H]3CCCOc4ccccc43)CCCCC2)CCO1 ZINC000521301417 929112095 /nfs/dbraw/zinc/11/20/95/929112095.db2.gz PEAFKOVQPVOKCV-HXUWFJFHSA-N 0 3 415.578 4.013 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)Nc2ccc(C)c(C(=O)NC(C)C)c2)N(C)C)cc1 ZINC000521305395 929113796 /nfs/dbraw/zinc/11/37/96/929113796.db2.gz QSZVPWJFGODYDG-JOCHJYFZSA-N 0 3 410.562 4.120 20 0 HIADHN Cc1nc(NC(=O)N(Cc2ccccc2Br)C2CCN(C)CC2)oc1C ZINC000521319057 929132466 /nfs/dbraw/zinc/13/24/66/929132466.db2.gz ZEYYVTOJADXYTB-UHFFFAOYSA-N 0 3 421.339 4.182 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2ccc(C(=O)N3CCCC[C@H]3C)cc2)N(C)C)cc1 ZINC000521468108 929234732 /nfs/dbraw/zinc/23/47/32/929234732.db2.gz QVWUHDOSHWDSHU-XXBNENTESA-N 0 3 422.573 4.434 20 0 HIADHN CN(C(=O)Nc1ccccc1OC(F)(F)F)C1CCN(CCc2ccccn2)CC1 ZINC000521560907 929296874 /nfs/dbraw/zinc/29/68/74/929296874.db2.gz ICRSMZIECZJQOU-UHFFFAOYSA-N 0 3 422.451 4.151 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)Nc1nnc(C(C)(C)c2ccccc2)s1 ZINC000521654675 929347918 /nfs/dbraw/zinc/34/79/18/929347918.db2.gz RXSIBFSMKKLYHS-UHFFFAOYSA-N 0 3 423.586 4.460 20 0 HIADHN CN(CCN1CCN(CCOc2cc(Cl)ccc2Cl)CC1)Cc1ccccc1 ZINC000521784478 929444430 /nfs/dbraw/zinc/44/44/30/929444430.db2.gz VZGLUTBOMSQKHT-UHFFFAOYSA-N 0 3 422.400 4.122 20 0 HIADHN CCCN(CC(=O)N(CC)Cc1ccc(OC)c(OC)c1)[C@@H]1CCc2ccccc21 ZINC000521819907 929477424 /nfs/dbraw/zinc/47/74/24/929477424.db2.gz MMWPVRPBJNMKDL-JOCHJYFZSA-N 0 3 410.558 4.452 20 0 HIADHN COc1cc(OC)cc(Oc2ccc(CNCc3ccc(NC(N)=O)cc3)cc2)c1 ZINC000521819370 929477504 /nfs/dbraw/zinc/47/75/04/929477504.db2.gz BKCMUCOSAZKFEE-UHFFFAOYSA-N 0 3 407.470 4.277 20 0 HIADHN CC[C@@H]1CCCCN1C(=O)[C@H](C)N(C)CCCc1cc(-c2cccc(F)c2)n[nH]1 ZINC000521879223 929526877 /nfs/dbraw/zinc/52/68/77/929526877.db2.gz ZUPXPVWNHYJMEL-LAUBAEHRSA-N 0 3 400.542 4.260 20 0 HIADHN COc1cccc([C@H](CNC(=O)Nc2cccc(N(C)C(C)C)c2)N2CCCC2)c1 ZINC000521898681 929542506 /nfs/dbraw/zinc/54/25/06/929542506.db2.gz WPIVVERZLVBGEN-QHCPKHFHSA-N 0 3 410.562 4.498 20 0 HIADHN CCN1CCCN(C(=O)c2ccc(COc3ccccc3Br)cc2)CC1 ZINC000521992754 929615211 /nfs/dbraw/zinc/61/52/11/929615211.db2.gz OZMWACZGHFQHBF-UHFFFAOYSA-N 0 3 417.347 4.196 20 0 HIADHN CC(C)(C)c1ccc(S(=O)(=O)NC2C[C@H]3CC[C@@H](C2)N3Cc2ccccc2)cc1 ZINC000522055984 929625450 /nfs/dbraw/zinc/62/54/50/929625450.db2.gz SMNNYCYSIBZOBG-FRIKZZABSA-N 0 3 412.599 4.458 20 0 HIADHN Cc1cccc(NC(=O)NC[C@@H]2CCCN2Cc2ccccc2)c1C(=O)N1CCCC1 ZINC000524481040 929630599 /nfs/dbraw/zinc/63/05/99/929630599.db2.gz GIHVLPDHUGAMCZ-NRFANRHFSA-N 0 3 420.557 4.017 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)Nc1cccc(C(=O)N2CCCCC2)c1 ZINC000524484357 929632456 /nfs/dbraw/zinc/63/24/56/929632456.db2.gz VRRAONVKLJKHIT-QHCPKHFHSA-N 0 3 420.557 4.099 20 0 HIADHN CC[C@@H](NC(=O)NC[C@H](c1cccc(OC)c1)N(CC)CC)c1nc(C)cs1 ZINC000524555348 929684220 /nfs/dbraw/zinc/68/42/20/929684220.db2.gz OFJFJJVFHUXTFT-RTBURBONSA-N 0 3 404.580 4.294 20 0 HIADHN CCCCN(CCCC)S(=O)(=O)N(C)[C@H]1CCN(Cc2ccccc2)[C@H](C)C1 ZINC000524585838 929700075 /nfs/dbraw/zinc/70/00/75/929700075.db2.gz APTFGQCOCLRARO-IRLDBZIGSA-N 0 3 409.640 4.118 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3CCc4cccc(F)c4[C@H]3C)c(C)c2)CC1 ZINC000524595319 929705032 /nfs/dbraw/zinc/70/50/32/929705032.db2.gz JAQIVUYMWJKXCV-GOSISDBHSA-N 0 3 410.537 4.427 20 0 HIADHN C[C@H](NC(=O)NCCCN1CCc2ccccc2C1)c1ncc(-c2ccccc2)o1 ZINC000524611592 929721702 /nfs/dbraw/zinc/72/17/02/929721702.db2.gz BFNOPXLCAJOPED-SFHVURJKSA-N 0 3 404.514 4.150 20 0 HIADHN Cc1cc(NC(=O)c2cccc(F)c2)sc1C(=O)NCCN1[C@H](C)CCC[C@H]1C ZINC000524673152 929788110 /nfs/dbraw/zinc/78/81/10/929788110.db2.gz CJOQJDLTAAANTF-HZPDHXFCSA-N 0 3 417.550 4.441 20 0 HIADHN CCCN(C(=O)c1cc2c([nH]c1=O)CCCC2)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000524688816 929800657 /nfs/dbraw/zinc/80/06/57/929800657.db2.gz AZFVJUBXBTURJJ-OAQYLSRUSA-N 0 3 407.558 4.183 20 0 HIADHN CN(C(=O)[C@H](Oc1ccc(F)c(Cl)c1)c1ccccc1)[C@H]1CCN(C2CC2)C1 ZINC000524694262 929802087 /nfs/dbraw/zinc/80/20/87/929802087.db2.gz FYAQTZRROCLTAR-LAUBAEHRSA-N 0 3 402.897 4.294 20 0 HIADHN CC(C)[C@@H](C(=O)Nc1ccc(F)c(NC(=O)Cc2ccccc2)c1)N1CCCCC1 ZINC000524707461 929806202 /nfs/dbraw/zinc/80/62/02/929806202.db2.gz QRYJHAQTIZLMTG-QHCPKHFHSA-N 0 3 411.521 4.456 20 0 HIADHN COc1ccc([C@H]2CCCN2C(=O)CN2CCCC3(CCCCC3)C2)c(OC)c1 ZINC000524755950 929820312 /nfs/dbraw/zinc/82/03/12/929820312.db2.gz AMXBSMQZOGUGFQ-OAQYLSRUSA-N 0 3 400.563 4.414 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)N1CCC(OCC2CCCCC2)CC1 ZINC000524777919 929826559 /nfs/dbraw/zinc/82/65/59/929826559.db2.gz NPBWKQWYKWNVRK-UHFFFAOYSA-N 0 3 423.667 4.119 20 0 HIADHN COc1ccc([C@H](CNC(=O)NCc2ccccc2OCC2CC2)N2CCCC2)cc1 ZINC000524806161 929836367 /nfs/dbraw/zinc/83/63/67/929836367.db2.gz HTRVDILJIXNMIM-QHCPKHFHSA-N 0 3 423.557 4.120 20 0 HIADHN CC(C)COc1cccc(C(=O)NC2CCN(CCOc3ccc(F)cc3)CC2)c1 ZINC000524835454 929852446 /nfs/dbraw/zinc/85/24/46/929852446.db2.gz HRIKMOJUFVZHGQ-UHFFFAOYSA-N 0 3 414.521 4.134 20 0 HIADHN CC(C)C[C@H](C(=O)Nc1cccc(CN2CCC(C(N)=O)CC2)c1)c1ccccc1 ZINC000524855193 929859657 /nfs/dbraw/zinc/85/96/57/929859657.db2.gz HCJJNETVHFADOQ-QHCPKHFHSA-N 0 3 407.558 4.152 20 0 HIADHN COc1ccc(CCC(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)cc1Cl ZINC000524864308 929863939 /nfs/dbraw/zinc/86/39/39/929863939.db2.gz KOOUHDDPDUGQJZ-GOSISDBHSA-N 0 3 400.950 4.404 20 0 HIADHN C[C@@H](c1ccccc1)N(CC(=O)NC[C@@H]1CCN(c2ccccc2)C1)CC1CCC1 ZINC000524893745 929876730 /nfs/dbraw/zinc/87/67/30/929876730.db2.gz LFFVDHYMBDFMKL-GMAHTHKFSA-N 0 3 405.586 4.492 20 0 HIADHN C[C@@H]1CN(CC(=O)N2CCC[C@H]2c2ccc3c(c2)OCCO3)CC[C@H]1c1ccccc1 ZINC000525121979 930049023 /nfs/dbraw/zinc/04/90/23/930049023.db2.gz OAQXUYCSGPCEQQ-PTUXOGIPSA-N 0 3 420.553 4.247 20 0 HIADHN COc1ccc(OC)c([C@@H]2CCCN2C(=O)CN2CC[C@H](c3ccccc3)[C@H](C)C2)c1 ZINC000525122301 930049190 /nfs/dbraw/zinc/04/91/90/930049190.db2.gz DKNNKMBDMFZDJO-UCFCWBNQSA-N 0 3 422.569 4.493 20 0 HIADHN Cc1ccc(CCN(Cc2ccco2)C(=O)[C@H]2CCCN(Cc3cccnc3)C2)cc1 ZINC000525168995 930074907 /nfs/dbraw/zinc/07/49/07/930074907.db2.gz JFWOGMUKKIZBQN-DEOSSOPVSA-N 0 3 417.553 4.467 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2cccc(CC(=O)OC(C)(C)C)c2)N(C)C)cc1 ZINC000525228182 930093788 /nfs/dbraw/zinc/09/37/88/930093788.db2.gz YACPQMRZPIOYIL-OAQYLSRUSA-N 0 3 411.546 4.304 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)Nc1c(F)cc(Br)cc1F ZINC000525228997 930094506 /nfs/dbraw/zinc/09/45/06/930094506.db2.gz BZTHJWZTOKMZTM-UHFFFAOYSA-N 0 3 424.289 4.297 20 0 HIADHN C[C@@H](CC(=O)c1cccc(Br)c1)C(=O)NCC(C)(C)N1CCC[C@@H](C)C1 ZINC000525241149 930101351 /nfs/dbraw/zinc/10/13/51/930101351.db2.gz SJKFOMKIPVBOAC-CVEARBPZSA-N 0 3 423.395 4.285 20 0 HIADHN CCN1CCCC[C@@H]1C(=O)NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1 ZINC000525258309 930112854 /nfs/dbraw/zinc/11/28/54/930112854.db2.gz LMBOOTMLGZGRRO-JOCHJYFZSA-N 0 3 406.505 4.169 20 0 HIADHN COc1cc(-c2nnc(CN3C[C@H](c4ccccc4)C[C@@H]3C)o2)cc(OC)c1OC ZINC000525273053 930125343 /nfs/dbraw/zinc/12/53/43/930125343.db2.gz OWKRBPFCGBNYDQ-MAUKXSAKSA-N 0 3 409.486 4.140 20 0 HIADHN COc1ccc([C@H](CNC(=O)NCCc2cc3ccccc3o2)N2CCCC2)cc1 ZINC000525317818 930156273 /nfs/dbraw/zinc/15/62/73/930156273.db2.gz KMBXJZUAEHJQTA-QFIPXVFZSA-N 0 3 407.514 4.120 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)NCc2ccc(-c3ccncc3)cc2)CC1 ZINC000525320997 930160367 /nfs/dbraw/zinc/16/03/67/930160367.db2.gz XABFUFKXMNGCIV-UHFFFAOYSA-N 0 3 404.514 4.148 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(F)cc2)CC1)c1cc2ccc(Cl)cc2[nH]1 ZINC000525335141 930170358 /nfs/dbraw/zinc/17/03/58/930170358.db2.gz RGHCBHXEZGJXJQ-UHFFFAOYSA-N 0 3 415.896 4.234 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)NCCCCOCCc1ccccc1 ZINC000525399017 930218228 /nfs/dbraw/zinc/21/82/28/930218228.db2.gz WIRAKKGPNDYWBW-HSZRJFAPSA-N 0 3 423.601 4.332 20 0 HIADHN CC(=O)N1CCCc2cc(NC(=O)N3CCCN(Cc4ccccc4)C[C@@H]3C)ccc21 ZINC000525414700 930227264 /nfs/dbraw/zinc/22/72/64/930227264.db2.gz GFIVGZFRILKYDQ-IBGZPJMESA-N 0 3 420.557 4.114 20 0 HIADHN Cc1cccc2[nH]cc(CCNC(=O)N3CCCN(Cc4ccccc4)C[C@@H]3C)c21 ZINC000525437333 930239641 /nfs/dbraw/zinc/23/96/41/930239641.db2.gz KLKBYBARNUJLBE-FQEVSTJZSA-N 0 3 404.558 4.325 20 0 HIADHN CN(C)C[C@@H]1CN(C(=O)N[C@@H](c2ccc(Cl)cc2)c2ccccc2Cl)CCO1 ZINC000525444804 930243329 /nfs/dbraw/zinc/24/33/29/930243329.db2.gz PHNFOLUVMDAILL-XLIONFOSSA-N 0 3 422.356 4.055 20 0 HIADHN CN(C)C[C@@H]1CN(C(=O)N[C@H](c2ccc(Cl)cc2)c2ccccc2Cl)CCO1 ZINC000525444805 930243719 /nfs/dbraw/zinc/24/37/19/930243719.db2.gz PHNFOLUVMDAILL-YLJYHZDGSA-N 0 3 422.356 4.055 20 0 HIADHN CCOc1cc(CN[C@@H](C)[C@H]2CN(Cc3ccccc3)CCO2)cc(Cl)c1OC ZINC000525461659 930254400 /nfs/dbraw/zinc/25/44/00/930254400.db2.gz CUJYXSSSLVJYBI-HTAPYJJXSA-N 0 3 418.965 4.126 20 0 HIADHN O=C(N[C@@H]1CCN(Cc2ccccc2)C1)[C@H]1C[C@H]1c1ccccc1OC(F)(F)F ZINC000525474506 930264684 /nfs/dbraw/zinc/26/46/84/930264684.db2.gz CLAWPHIQWVNYJF-NEWSRXKRSA-N 0 3 404.432 4.079 20 0 HIADHN CC(=O)Nc1ccc(CNC2(c3cccc(Br)c3)CCOCC2)cc1 ZINC000525484539 930272585 /nfs/dbraw/zinc/27/25/85/930272585.db2.gz XDUFDBONSXXOOJ-UHFFFAOYSA-N 0 3 403.320 4.203 20 0 HIADHN CN(C)Cc1cccc(C(=O)Nc2nnc(-c3cccc(Br)c3)s2)c1 ZINC000525494880 930281497 /nfs/dbraw/zinc/28/14/97/930281497.db2.gz UDMHIHWOJKLYCL-UHFFFAOYSA-N 0 3 417.332 4.282 20 0 HIADHN CCC(CC)[C@@H](NC(=O)NC[C@@]1(O)CCN(Cc2ccccc2)C1)c1cccs1 ZINC000525497380 930283566 /nfs/dbraw/zinc/28/35/66/930283566.db2.gz PIMDKOJAEAKQQE-GGAORHGYSA-N 0 3 415.603 4.162 20 0 HIADHN O=C(NC[C@@]1(O)CCN(Cc2ccccc2)C1)Nc1ccc(OC2CCCCC2)cc1 ZINC000525515959 930296059 /nfs/dbraw/zinc/29/60/59/930296059.db2.gz RLUUVPCZHRZHML-VWLOTQADSA-N 0 3 423.557 4.157 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)[C@@H]1C[C@@H]1c1cccc(F)c1F ZINC000525542261 930315538 /nfs/dbraw/zinc/31/55/38/930315538.db2.gz HOHFPZFRDYVEPT-RTBURBONSA-N 0 3 402.510 4.298 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)CC(C)(C)c2ccccc2)cc1)[C@H]1CCCN(C)C1 ZINC000525579124 930342035 /nfs/dbraw/zinc/34/20/35/930342035.db2.gz AVBJUIFISDWQHF-QFIPXVFZSA-N 0 3 407.558 4.159 20 0 HIADHN Cc1ccccc1[C@H](C)CC(=O)Nc1ccc(C(=O)N(C)[C@@H]2CCCN(C)C2)cc1 ZINC000525612143 930362418 /nfs/dbraw/zinc/36/24/18/930362418.db2.gz GNWHEMPZVKRUNN-DENIHFKCSA-N 0 3 407.558 4.294 20 0 HIADHN CCCN(CC(=O)Nc1cccc(NC(C)=O)c1)[C@@H]1C[C@@H](OCC)C12CCCCC2 ZINC000525640054 930377578 /nfs/dbraw/zinc/37/75/78/930377578.db2.gz NMKUPZLFHLRARD-FGZHOGPDSA-N 0 3 415.578 4.423 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCCC1)c1ncoc1-c1ccccc1Cl ZINC000525650672 930382698 /nfs/dbraw/zinc/38/26/98/930382698.db2.gz HVXBHNDTIGCPAA-UHFFFAOYSA-N 0 3 419.978 4.477 20 0 HIADHN CC(C)=CCOc1cccc(C(=O)Nc2ccc(C(=O)NCCN3CCCC3)cc2)c1 ZINC000525651473 930383587 /nfs/dbraw/zinc/38/35/87/930383587.db2.gz SCGNEOILKWACBY-UHFFFAOYSA-N 0 3 421.541 4.110 20 0 HIADHN CCOc1cc(CN[C@@H](CC)c2ccncc2)ccc1OCC(=O)N1CCCCC1 ZINC000525697380 930408250 /nfs/dbraw/zinc/40/82/50/930408250.db2.gz QZUKJPPUEBOIDX-NRFANRHFSA-N 0 3 411.546 4.113 20 0 HIADHN CCOc1cc(CCCNC(=O)c2oc3ccccc3c2CN(C)C)ccc1OC ZINC000525760356 930434101 /nfs/dbraw/zinc/43/41/01/930434101.db2.gz ILZLFXSWSCVSRJ-UHFFFAOYSA-N 0 3 410.514 4.264 20 0 HIADHN COCCOc1ccc(CN[C@@H]2CC(C)(C)c3ccc(Br)cc32)cn1 ZINC000526041559 930512834 /nfs/dbraw/zinc/51/28/34/930512834.db2.gz NEKFMBURKFOXJF-GOSISDBHSA-N 0 3 405.336 4.382 20 0 HIADHN COc1ccc([C@H](CCn2cncn2)NCc2c(C)nn(-c3ccccc3)c2C)cc1 ZINC000526107008 930536400 /nfs/dbraw/zinc/53/64/00/930536400.db2.gz ZMOWNNROJFSSLN-DEOSSOPVSA-N 0 3 416.529 4.010 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)NCCc1ccc2c(c1)OCCO2)c1cc2ccccc2s1 ZINC000526944756 930554325 /nfs/dbraw/zinc/55/43/25/930554325.db2.gz OTIWBFPRQWWUJP-CVEARBPZSA-N 0 3 410.539 4.071 20 0 HIADHN C[C@H](CNC(=O)[C@@H]1CCCN(Cc2cccnc2)C1)c1ccc(C(F)(F)F)cc1 ZINC000526956105 930557550 /nfs/dbraw/zinc/55/75/50/930557550.db2.gz GJBUUTQCRQDJAW-VQIMIIECSA-N 0 3 405.464 4.232 20 0 HIADHN CS(=O)(=O)[C@@H]1CCC[C@H](N[C@@H](c2ccc(Br)cc2Cl)C2CC2)C1 ZINC000527109283 930592337 /nfs/dbraw/zinc/59/23/37/930592337.db2.gz IKSLMHNZSDSKCE-JJRVBVJISA-N 0 3 420.800 4.499 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)C(=O)N1CCCC[C@@H]1c1cccc(C)c1C ZINC000527146217 930601912 /nfs/dbraw/zinc/60/19/12/930601912.db2.gz VZDNTVAOYGLQAM-JOCHJYFZSA-N 0 3 423.557 4.066 20 0 HIADHN O=C(NCC1CCN(c2ccccc2)CC1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000527185685 930608334 /nfs/dbraw/zinc/60/83/34/930608334.db2.gz WAFYLAHIRWFORL-JOCHJYFZSA-N 0 3 409.549 4.071 20 0 HIADHN C[C@@H](NCC(=O)N1CCC(C(=O)Nc2ccccc2)CC1)c1cc2ccccc2s1 ZINC000527193862 930609404 /nfs/dbraw/zinc/60/94/04/930609404.db2.gz ZZJCGHHJNOCRRU-QGZVFWFLSA-N 0 3 421.566 4.429 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)c1csc(C(F)(F)F)n1 ZINC000527250747 930620326 /nfs/dbraw/zinc/62/03/26/930620326.db2.gz OYEMVDXIPSVVRW-CQSZACIVSA-N 0 3 421.448 4.058 20 0 HIADHN Cc1cc(C(=O)N(CCN2CCCC2)c2ccccc2)nn1-c1c(F)cccc1F ZINC000527295191 930628462 /nfs/dbraw/zinc/62/84/62/930628462.db2.gz WOBNRTMJQUZVBW-UHFFFAOYSA-N 0 3 410.468 4.202 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CN[C@H](CCn1cncn1)c1ccc(C)cc1 ZINC000527349057 930643369 /nfs/dbraw/zinc/64/33/69/930643369.db2.gz OWACUTIHQMNHHF-RUZDIDTESA-N 0 3 414.557 4.369 20 0 HIADHN CC(C)[C@H](CNC(=O)c1cc(O)ccc1C(F)(F)F)N1CCc2ccccc2C1 ZINC000527521298 930673990 /nfs/dbraw/zinc/67/39/90/930673990.db2.gz YBJNPCUUTVQFCS-FQEVSTJZSA-N 0 3 406.448 4.224 20 0 HIADHN CCCNC(=O)c1ccc(NC(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)cc1Cl ZINC000530515315 930734036 /nfs/dbraw/zinc/73/40/36/930734036.db2.gz WCGKBJCSUHYIML-VQTJNVASSA-N 0 3 414.937 4.047 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2ccc(C(=O)NC3CCCCC3)cc2)[C@H]1c1ccccc1 ZINC000530515309 930734739 /nfs/dbraw/zinc/73/47/39/930734739.db2.gz VZWJLEHPDWVRFR-DHIUTWEWSA-N 0 3 420.557 4.316 20 0 HIADHN CN(C)Cc1ccc(-c2noc(Cc3cn4cc(Cl)cc(Cl)c4n3)n2)cc1 ZINC000530632159 930778676 /nfs/dbraw/zinc/77/86/76/930778676.db2.gz JBNCRHRAMNZTAI-UHFFFAOYSA-N 0 3 402.285 4.344 20 0 HIADHN CN(C)Cc1ccc(-c2noc(C3=Cc4cc(Br)ccc4OC3)n2)cc1 ZINC000530632444 930779960 /nfs/dbraw/zinc/77/99/60/930779960.db2.gz VFHJXDNAGDPUKC-UHFFFAOYSA-N 0 3 412.287 4.494 20 0 HIADHN Cc1cccc2ncc(CNC3(c4ccc(Br)cc4)CCOCC3)n21 ZINC000530664686 930791023 /nfs/dbraw/zinc/79/10/23/930791023.db2.gz ZVWKDJAXVYYHFA-UHFFFAOYSA-N 0 3 400.320 4.201 20 0 HIADHN CC[C@H](C)[C@H](NCc1cnc2cccc(C)n12)C(=O)Nc1cccc(N2CCCC2)c1 ZINC000530665103 930792379 /nfs/dbraw/zinc/79/23/79/930792379.db2.gz WUADWRZEFBXCAP-UUOWRZLLSA-N 0 3 419.573 4.386 20 0 HIADHN Cc1[nH]c(=O)c(C(=O)NC[C@@H](c2cccs2)N2CCCC2)cc1-c1ccccc1 ZINC000530700390 930801502 /nfs/dbraw/zinc/80/15/02/930801502.db2.gz ZECDPQHWHYWNPS-FQEVSTJZSA-N 0 3 407.539 4.391 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)N[C@H]1C[C@H]1c1cccc(Br)c1 ZINC000530752860 930816865 /nfs/dbraw/zinc/81/68/65/930816865.db2.gz UKEZTKFDFYKRQL-ROUUACIJSA-N 0 3 422.392 4.140 20 0 HIADHN O=C(CC1(N2CCOCC2)CCCC1)N[C@@H]1CCOc2c(-c3ccccc3)cccc21 ZINC000530817962 930830942 /nfs/dbraw/zinc/83/09/42/930830942.db2.gz GUIPMFJJPNHXIO-HSZRJFAPSA-N 0 3 420.553 4.329 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2c(Cl)cccc2Cl)cc1)[C@@H]1CCCN(C)C1 ZINC000530859590 930842023 /nfs/dbraw/zinc/84/20/23/930842023.db2.gz SSXQAIGCTANLPA-MRXNPFEDSA-N 0 3 420.340 4.412 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)NC(Cc2ccccc2)Cc2ccccc2)CC1 ZINC000530868379 930844314 /nfs/dbraw/zinc/84/43/14/930844314.db2.gz UBKYSGCFLNIUGW-UHFFFAOYSA-N 0 3 423.601 4.029 20 0 HIADHN COC(=O)c1cc2c(o1)c(OC)ccc2CNCc1ccc(Br)cc1 ZINC000530904129 930855105 /nfs/dbraw/zinc/85/51/05/930855105.db2.gz AIXKPRKVKGMEQS-UHFFFAOYSA-N 0 3 404.260 4.280 20 0 HIADHN CCN(CC)C(=O)c1cccc(NC(=O)[C@H](C)N[C@H](C)[C@@H]2Oc3ccccc3[C@H]2C)c1 ZINC000530972901 930872686 /nfs/dbraw/zinc/87/26/86/930872686.db2.gz KCKGDPOGFXDUBR-PRHHBONVSA-N 0 3 423.557 4.038 20 0 HIADHN Cc1cc(C)n(-c2ccc(CC(=O)N(Cc3ccccc3)C3CCN(C)CC3)cc2)n1 ZINC000530983526 930876170 /nfs/dbraw/zinc/87/61/70/930876170.db2.gz UUNWRURLRNKYJK-UHFFFAOYSA-N 0 3 416.569 4.155 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)N(C)CCCCCc2cc(-c3ccccc3)n[nH]2)CN1C1CC1 ZINC000531006940 930882649 /nfs/dbraw/zinc/88/26/49/930882649.db2.gz QYLJPRVVTBKGLI-GHTZIAJQSA-N 0 3 409.578 4.056 20 0 HIADHN CCN(C(=O)c1cccc(-c2nnc(C)o2)c1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000531047040 930896685 /nfs/dbraw/zinc/89/66/85/930896685.db2.gz PVQTZPOLTYVIPZ-VGSWGCGISA-N 0 3 404.514 4.343 20 0 HIADHN O=C(CC1(N2CCOCC2)CCCC1)Nc1ccc(COCc2ccccc2)cc1 ZINC000531058848 930901676 /nfs/dbraw/zinc/90/16/76/930901676.db2.gz SBTMIKLJWHRPRG-UHFFFAOYSA-N 0 3 408.542 4.377 20 0 HIADHN COc1cc(C[NH2+][C@@H]2CCCO[C@@H]2c2ccc(C)cc2)cc(Br)c1[O-] ZINC000531094316 930917972 /nfs/dbraw/zinc/91/79/72/930917972.db2.gz AMCYNHHECWCONV-YLJYHZDGSA-N 0 3 406.320 4.482 20 0 HIADHN COC(=O)c1cc2c(o1)c(OC)ccc2CNCc1ccc(Br)c(F)c1 ZINC000531142329 930943299 /nfs/dbraw/zinc/94/32/99/930943299.db2.gz ZHFZYWLNGDIGGL-UHFFFAOYSA-N 0 3 422.250 4.419 20 0 HIADHN Cc1ccsc1[C@@H](CO)NCc1ccc(OCc2cn3cccc(C)c3n2)cc1 ZINC000531206946 930965624 /nfs/dbraw/zinc/96/56/24/930965624.db2.gz UXKXDIDGHDKUIF-OAQYLSRUSA-N 0 3 407.539 4.415 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)Nc1cnc(-c2ccccc2)nc1 ZINC000531341623 931023208 /nfs/dbraw/zinc/02/32/08/931023208.db2.gz LKQRAKGTOQQZEX-UHFFFAOYSA-N 0 3 411.456 4.018 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)c2cc(-c3ccccc3)c(C)[nH]c2=O)c1 ZINC000531411720 931047675 /nfs/dbraw/zinc/04/76/75/931047675.db2.gz BHVQOBBMXPMZEK-UHFFFAOYSA-N 0 3 403.526 4.275 20 0 HIADHN Fc1ccc(OCc2noc([C@]3(C(F)(F)F)CCN(Cc4ccccc4)C3)n2)cc1 ZINC000531687794 931152876 /nfs/dbraw/zinc/15/28/76/931152876.db2.gz NCTVSYSWPPADQH-FQEVSTJZSA-N 0 3 421.394 4.494 20 0 HIADHN C[C@H](NC1CCN(CC(=O)Nc2ccccc2)CC1)c1sccc1Br ZINC000531687863 931153021 /nfs/dbraw/zinc/15/30/21/931153021.db2.gz YSAGSCIBSJDRFX-AWEZNQCLSA-N 0 3 422.392 4.264 20 0 HIADHN Cc1ccc(NC(=O)c2cccc(I)c2C)c(CN(C)C)c1 ZINC000531866201 931227287 /nfs/dbraw/zinc/22/72/87/931227287.db2.gz RCQMITHXXOLBOZ-UHFFFAOYSA-N 0 3 408.283 4.222 20 0 HIADHN Cn1c(CNCCCC(=O)N2CCc3ccccc32)nc2cc(C(F)(F)F)ccc21 ZINC000531866253 931227343 /nfs/dbraw/zinc/22/73/43/931227343.db2.gz BNQPLTLIVDNGIX-UHFFFAOYSA-N 0 3 416.447 4.051 20 0 HIADHN COCC(=O)Nc1cccc(CN[C@@H]2C[C@@H](C)c3c2cccc3Br)c1 ZINC000531943182 931255753 /nfs/dbraw/zinc/25/57/53/931255753.db2.gz WKVYQGHSCWDRAC-FZKQIMNGSA-N 0 3 403.320 4.372 20 0 HIADHN C[C@@H]1C[C@@H](NCc2ccc(N3CCOCC3)nc2)c2cccc(Br)c21 ZINC000531945275 931257852 /nfs/dbraw/zinc/25/78/52/931257852.db2.gz UFDOVOWSTVYIMW-RDTXWAMCSA-N 0 3 402.336 4.019 20 0 HIADHN C[C@@H](N[C@H](C)c1cccc(NS(C)(=O)=O)c1)c1ccc(OCC(F)(F)F)cc1 ZINC000531950760 931260810 /nfs/dbraw/zinc/26/08/10/931260810.db2.gz ZBYZTIZDMDTAPJ-ZIAGYGMSSA-N 0 3 416.465 4.411 20 0 HIADHN CSc1ccc([C@@H](C)NCc2ccc(CS(=O)(=O)NC(C)C)cc2)cc1F ZINC000531951839 931262000 /nfs/dbraw/zinc/26/20/00/931262000.db2.gz NZRJDUHSIOGJEO-OAHLLOKOSA-N 0 3 410.580 4.226 20 0 HIADHN COc1ccc([C@H](C)NCc2ccc(NC(=O)c3ccco3)cc2)cc1NC(C)=O ZINC000531953410 931262536 /nfs/dbraw/zinc/26/25/36/931262536.db2.gz NPJRFOCQECJBTG-HNNXBMFYSA-N 0 3 407.470 4.350 20 0 HIADHN C[C@@H](N[C@@H](CN1CCN(C)CC1)c1ccccc1)c1ccccc1Br ZINC000531965890 931268401 /nfs/dbraw/zinc/26/84/01/931268401.db2.gz RKZKSHNUMFFANM-UTKZUKDTSA-N 0 3 402.380 4.088 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(S(=O)(=O)N(C)C)cc1)c1ccc(-c2ccncc2)cc1 ZINC000531984720 931275694 /nfs/dbraw/zinc/27/56/94/931275694.db2.gz TYJNVYPBPJYSNS-ROUUACIJSA-N 0 3 409.555 4.411 20 0 HIADHN Brc1ccc(C2(NCc3cc(-c4cccnc4)n[nH]3)CCOCC2)cc1 ZINC000532067945 931302051 /nfs/dbraw/zinc/30/20/51/931302051.db2.gz QTGCKIJOWDKJDU-UHFFFAOYSA-N 0 3 413.319 4.030 20 0 HIADHN Cc1ccc2c(c1)CC[C@@H]2NCc1ccc(OCCN2CCOCC2)c(Cl)c1 ZINC000532092300 931308443 /nfs/dbraw/zinc/30/84/43/931308443.db2.gz DLOCMRAAGCYYNN-QFIPXVFZSA-N 0 3 400.950 4.137 20 0 HIADHN CC(C)N1CCN([C@H]2CCN(C(=O)C3(c4cccc(Cl)c4)CCCCC3)C2)CC1 ZINC000532093876 931309781 /nfs/dbraw/zinc/30/97/81/931309781.db2.gz MOXUREMRNLXIGK-QFIPXVFZSA-N 0 3 418.025 4.169 20 0 HIADHN Cc1nn(-c2ccc(F)cc2F)c(C)c1CN[C@H]1CCN(C(=O)C2CCCCC2)C1 ZINC000532120685 931320909 /nfs/dbraw/zinc/32/09/09/931320909.db2.gz XPJBVQZWRNOKIJ-IBGZPJMESA-N 0 3 416.516 4.038 20 0 HIADHN O=C(CN1CCC[C@@H]1Cc1ccccc1)NCc1cccc(COCc2ccco2)c1 ZINC000532159588 931332793 /nfs/dbraw/zinc/33/27/93/931332793.db2.gz LZEZBFPPRNBDHX-XMMPIXPASA-N 0 3 418.537 4.320 20 0 HIADHN C[C@H](NC[C@@H](c1c(F)cccc1Cl)N1CCCC1)c1ccc(S(C)(=O)=O)cc1 ZINC000532196086 931345009 /nfs/dbraw/zinc/34/50/09/931345009.db2.gz YGQSUITTWXPSNW-YWZLYKJASA-N 0 3 424.969 4.370 20 0 HIADHN Cc1nn(C)c(C)c1CN[C@H](C)CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 ZINC000532205354 931349311 /nfs/dbraw/zinc/34/93/11/931349311.db2.gz SAMIXSPBKPMZCI-SNVBAGLBSA-N 0 3 402.848 4.216 20 0 HIADHN COc1ccc2oc([C@@H](C)N[C@H](CN3CCN(C)CC3)c3ccccc3)c(C)c2c1 ZINC000532213670 931354710 /nfs/dbraw/zinc/35/47/10/931354710.db2.gz UJBQRROKERCPGK-AUSIDOKSSA-N 0 3 407.558 4.389 20 0 HIADHN CC(C)NS(=O)(=O)Cc1ccccc1CN[C@@H](C)c1ccc2c(c1)CCCC2 ZINC000532213858 931355147 /nfs/dbraw/zinc/35/51/47/931355147.db2.gz IUTMUUSLTUPWGM-SFHVURJKSA-N 0 3 400.588 4.244 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)N[C@@H](C)c2cccc(N3CCCS3(=O)=O)c2)cc1 ZINC000532233022 931365039 /nfs/dbraw/zinc/36/50/39/931365039.db2.gz JSAYGSLCYAFPFJ-ROUUACIJSA-N 0 3 424.570 4.132 20 0 HIADHN COc1cc(-c2noc(CN3CC[C@H](C)[C@H]4CCCC[C@@H]43)n2)cc(OC)c1OC ZINC000532266927 931376165 /nfs/dbraw/zinc/37/61/65/931376165.db2.gz QAPYPVRWQDUGPK-UAGQMJEPSA-N 0 3 401.507 4.163 20 0 HIADHN CC(C)N1CCN([C@H]2CCN(C(=O)c3ccc(-c4ccc(Cl)cc4)s3)C2)CC1 ZINC000532342254 931401079 /nfs/dbraw/zinc/40/10/79/931401079.db2.gz RYWZESFXGCOTEG-IBGZPJMESA-N 0 3 418.006 4.309 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@@H](C)N[C@@H]2CCCc3ccc(OC)cc32)cc1 ZINC000532441349 931435516 /nfs/dbraw/zinc/43/55/16/931435516.db2.gz CAEOWNCDEGHSFB-UZUQRXQVSA-N 0 3 416.587 4.454 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@@H](C)N[C@H](C)c2ccc3c(c2)COC3)cc1 ZINC000532441174 931435820 /nfs/dbraw/zinc/43/58/20/931435820.db2.gz WDCSDRFCHIOLCV-IAGOWNOFSA-N 0 3 402.560 4.159 20 0 HIADHN C[C@@H](NCc1ccc(Cn2ccnc2)cc1)c1ccc(S(=O)(=O)C2CCCC2)cc1 ZINC000532451107 931439350 /nfs/dbraw/zinc/43/93/50/931439350.db2.gz BIKHUDVNURSGBO-LJQANCHMSA-N 0 3 423.582 4.499 20 0 HIADHN C[C@@H](Oc1ccc(Cl)cc1Cl)[C@H](C)NCCS(=O)(=O)c1ccccc1 ZINC000532465013 931446503 /nfs/dbraw/zinc/44/65/03/931446503.db2.gz CXQPPJPNJHBRLK-UONOGXRCSA-N 0 3 402.343 4.213 20 0 HIADHN O[C@@H](CN[C@@H]1CCSc2c(F)cccc21)COc1cccc(C(F)(F)F)c1 ZINC000532465555 931447466 /nfs/dbraw/zinc/44/74/66/931447466.db2.gz UAKIVBXNTNZTOT-SUMWQHHRSA-N 0 3 401.425 4.411 20 0 HIADHN Cn1nnc2cc(CNCc3ccc(OCCOc4ccc(Cl)cc4)cc3)ccc21 ZINC000532470997 931450583 /nfs/dbraw/zinc/45/05/83/931450583.db2.gz UZZJSEAXFHEPGF-UHFFFAOYSA-N 0 3 422.916 4.369 20 0 HIADHN C[C@H](N[C@@H](CN1CCN(C)CC1)c1ccccc1)c1ccc(F)cc1OC(F)F ZINC000532497425 931462168 /nfs/dbraw/zinc/46/21/68/931462168.db2.gz XEHPVDUJZLNLKY-JXFKEZNVSA-N 0 3 407.480 4.066 20 0 HIADHN C[C@H](N[C@H](CN1CCN(C)CC1)c1ccccc1)c1ccccc1OC(F)(F)F ZINC000532497770 931462732 /nfs/dbraw/zinc/46/27/32/931462732.db2.gz OHXUJWUQSJOONX-FXAWDEMLSA-N 0 3 407.480 4.225 20 0 HIADHN COc1ccccc1C[C@H](C)N[C@H](c1ccccc1)c1cccc(S(C)(=O)=O)c1 ZINC000532537624 931515011 /nfs/dbraw/zinc/51/50/11/931515011.db2.gz LBJSHVPVTRBEOO-MHECFPHRSA-N 0 3 409.551 4.409 20 0 HIADHN CCN(Cc1csc(-c2ccc(C(N)=O)cc2)n1)[C@H](C)Cc1ccc(OC)cc1 ZINC000532561174 931524849 /nfs/dbraw/zinc/52/48/49/931524849.db2.gz PKQHWFUSUMNLRO-MRXNPFEDSA-N 0 3 409.555 4.371 20 0 HIADHN Cc1ccc(S(=O)(=O)c2ccc(CN3CCCN(C4CCCC4)CC3)cc2)cc1 ZINC000532587389 931545203 /nfs/dbraw/zinc/54/52/03/931545203.db2.gz YXFUUYPVHCUHOZ-UHFFFAOYSA-N 0 3 412.599 4.278 20 0 HIADHN O=C(CNC1(c2ccc(Br)cc2)CCOCC1)Nc1ccc(Cl)cc1 ZINC000532658572 931571051 /nfs/dbraw/zinc/57/10/51/931571051.db2.gz LIMVZXXRDCVHPQ-UHFFFAOYSA-N 0 3 423.738 4.337 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@H](C)N[C@H](c2ccc(F)cc2)C2CCC2)cc1OC ZINC000532687614 931584951 /nfs/dbraw/zinc/58/49/51/931584951.db2.gz GTOINTXSZVFTET-HJPURHCSSA-N 0 3 414.521 4.321 20 0 HIADHN COc1cc(CN[C@@H]2CC(C)(C)c3ccccc32)ccc1OCC(=O)N1CCCC1 ZINC000532705120 931598456 /nfs/dbraw/zinc/59/84/56/931598456.db2.gz MEIVFYWYYRWOAM-OAQYLSRUSA-N 0 3 408.542 4.209 20 0 HIADHN FC(F)(F)c1ccn(-c2ccc(CNC3(c4ccc5c(c4)OCO5)CC3)cc2)n1 ZINC000532707389 931598833 /nfs/dbraw/zinc/59/88/33/931598833.db2.gz DUISLTVAJHOPIK-UHFFFAOYSA-N 0 3 401.388 4.399 20 0 HIADHN CCCCN(CC/C=C\c1ccc(Br)cc1)[C@H]1CCS(=O)(=O)C1 ZINC000532712193 931602925 /nfs/dbraw/zinc/60/29/25/931602925.db2.gz DARYMKXKJBEKIA-SUZKBHRPSA-N 0 3 400.382 4.142 20 0 HIADHN CSc1ccc(CNCc2ccc(Br)cc2N2CCOCC2)cc1 ZINC000532724572 931610427 /nfs/dbraw/zinc/61/04/27/931610427.db2.gz NERYWAQRIGOAPE-UHFFFAOYSA-N 0 3 407.377 4.297 20 0 HIADHN COc1cccc(CN(C)C(=O)CN[C@H](c2ccc(Cl)cc2)C(C)C)c1OC ZINC000532758452 931624179 /nfs/dbraw/zinc/62/41/79/931624179.db2.gz YYDSOAWBCCGAID-NRFANRHFSA-N 0 3 404.938 4.303 20 0 HIADHN CC(C)CCNC(=O)C1CCN(C(=O)CN[C@@H](c2ccc(Cl)cc2)C(C)C)CC1 ZINC000532770312 931627370 /nfs/dbraw/zinc/62/73/70/931627370.db2.gz CVOCEJUHAABROW-JOCHJYFZSA-N 0 3 422.013 4.028 20 0 HIADHN CCCN1CCN(c2ccccc2CNc2cccc(C(=O)N3CCCCC3)c2)CC1 ZINC000532888685 931680370 /nfs/dbraw/zinc/68/03/70/931680370.db2.gz UHNMSBXDHDQYBZ-UHFFFAOYSA-N 0 3 420.601 4.457 20 0 HIADHN COc1ccc(CNc2ccc3nc(CCN4CCOCC4)[nH]c3c2)c2ccccc12 ZINC000532889929 931681246 /nfs/dbraw/zinc/68/12/46/931681246.db2.gz YBHNUTLTWWFGPB-UHFFFAOYSA-N 0 3 416.525 4.212 20 0 HIADHN COc1ccc([C@H]2CCCN2C(=O)CN(C)CCCCc2ccccc2)cc1OC ZINC000532919364 931694644 /nfs/dbraw/zinc/69/46/44/931694644.db2.gz YAECJOSGCBWLNP-JOCHJYFZSA-N 0 3 410.558 4.322 20 0 HIADHN Cc1cccn2c(=O)cc(CN(Cc3cccc(Br)c3)C(C)C)nc12 ZINC000532925446 931696850 /nfs/dbraw/zinc/69/68/50/931696850.db2.gz GZHJKWHNJOCRNL-UHFFFAOYSA-N 0 3 400.320 4.176 20 0 HIADHN CCN(CC(=O)N1CCC(OCc2ccccc2)CC1)[C@H](C)Cc1ccc(OC)cc1 ZINC000532960797 931713912 /nfs/dbraw/zinc/71/39/12/931713912.db2.gz FVKWFQRMYAHEHK-OAQYLSRUSA-N 0 3 424.585 4.156 20 0 HIADHN Cc1ccccc1Sc1ccc(C(=O)N2CC[C@H](N3CCN(C(C)C)CC3)C2)cc1 ZINC000532993474 931730564 /nfs/dbraw/zinc/73/05/64/931730564.db2.gz VAKJSSGWLMUUTM-QFIPXVFZSA-N 0 3 423.626 4.387 20 0 HIADHN CCN(C(=O)CNC1(c2cccc(Br)c2)CCOCC1)c1ccccc1 ZINC000533027393 931743622 /nfs/dbraw/zinc/74/36/22/931743622.db2.gz POAVHJROSDUQFL-UHFFFAOYSA-N 0 3 417.347 4.098 20 0 HIADHN O=C(CCN1CCC([C@H](O)C(F)(F)F)CC1)Nc1ccc(Oc2ccccc2)cc1 ZINC000533025136 931744074 /nfs/dbraw/zinc/74/40/74/931744074.db2.gz LIYKGPSYKZFHKZ-NRFANRHFSA-N 0 3 422.447 4.443 20 0 HIADHN COc1cccc(OC)c1OC[C@@H](O)CN(Cc1ccc(F)cc1F)C1CCCC1 ZINC000533027759 931745304 /nfs/dbraw/zinc/74/53/04/931745304.db2.gz DYIOXWVCQMIGFS-IBGZPJMESA-N 0 3 421.484 4.167 20 0 HIADHN Cc1ccccc1C(=O)NC1CCN(Cc2cccc(OCC(F)(F)F)c2)CC1 ZINC000533032131 931746769 /nfs/dbraw/zinc/74/67/69/931746769.db2.gz JGELQRCFWCJTNX-UHFFFAOYSA-N 0 3 406.448 4.331 20 0 HIADHN O=C(Nc1cccc(Cl)c1)N1CCCN(Cc2ccc(-n3ccnc3)cc2)CC1 ZINC000533037061 931748733 /nfs/dbraw/zinc/74/87/33/931748733.db2.gz SLGFZIHZDODXBU-UHFFFAOYSA-N 0 3 409.921 4.266 20 0 HIADHN CN(CC(=O)Nc1ccccc1Cl)C(=O)CN[C@@H](c1ccccc1)C1CCCC1 ZINC000533062577 931759555 /nfs/dbraw/zinc/75/95/55/931759555.db2.gz SUTSJSYMEYWWEU-QHCPKHFHSA-N 0 3 413.949 4.258 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccnc2)C1)N1CCC[C@H](Oc2ccccc2Cl)C1 ZINC000533109538 931772970 /nfs/dbraw/zinc/77/29/70/931772970.db2.gz BEBINNPOQUXLPU-UXHICEINSA-N 0 3 413.949 4.017 20 0 HIADHN CC(C)CCn1cccc1CNCc1ccc(Br)cc1N1CCOCC1 ZINC000533208014 931808898 /nfs/dbraw/zinc/80/88/98/931808898.db2.gz QDHSMVAVQCKDHR-UHFFFAOYSA-N 0 3 420.395 4.423 20 0 HIADHN CCCN1CCN(c2ccccc2CNc2cccc(-c3nnc(CC)o3)c2)CC1 ZINC000533217234 931811943 /nfs/dbraw/zinc/81/19/43/931811943.db2.gz FMFQABPPPJZXAT-UHFFFAOYSA-N 0 3 405.546 4.443 20 0 HIADHN c1sc(-c2ccc3c(c2)OCO3)nc1CN[C@@H]1CCOC2(CCSCC2)C1 ZINC000533226717 931814472 /nfs/dbraw/zinc/81/44/72/931814472.db2.gz NKQMLXJWZWTLIB-OAHLLOKOSA-N 0 3 404.557 4.073 20 0 HIADHN CN(CCC(=O)Nc1ccccc1-c1ccccc1)C[C@@H]1COc2ccccc2O1 ZINC000533231998 931815421 /nfs/dbraw/zinc/81/54/21/931815421.db2.gz RDNQABQXSHNSKR-HXUWFJFHSA-N 0 3 402.494 4.454 20 0 HIADHN O=c1nc(CN2CCN(CC3CCCCC3)CC2)[nH]c2scc(-c3ccco3)c21 ZINC000533248043 931818768 /nfs/dbraw/zinc/81/87/68/931818768.db2.gz PIBKYJHGUIMRTA-UHFFFAOYSA-N 0 3 412.559 4.355 20 0 HIADHN CCc1cccc(OCC(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000533261117 931821417 /nfs/dbraw/zinc/82/14/17/931821417.db2.gz HTWUMWBDAWEYRK-QFIPXVFZSA-N 0 3 418.541 4.218 20 0 HIADHN Cc1cc(NC(=O)N(C)Cc2cccc(O)c2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000533258660 931821627 /nfs/dbraw/zinc/82/16/27/931821627.db2.gz ZBTHLUUDNKYFGA-NRFANRHFSA-N 0 3 419.529 4.008 20 0 HIADHN FC(F)(F)c1cccnc1OCCNCc1ccccc1OCc1ccncc1 ZINC000533329455 931839936 /nfs/dbraw/zinc/83/99/36/931839936.db2.gz MOPRUARCGLGSDZ-UHFFFAOYSA-N 0 3 403.404 4.243 20 0 HIADHN COc1ccc(CNC(C)(C)COc2ccc(C(F)(F)F)cn2)c(OC)c1OC ZINC000533330662 931840194 /nfs/dbraw/zinc/84/01/94/931840194.db2.gz PZFKBJOKPWPYCA-UHFFFAOYSA-N 0 3 414.424 4.073 20 0 HIADHN COc1ccc(OC)c([C@@H](C)NC(=O)CNC2(c3ccc(F)cc3)CCCC2)c1 ZINC000533374111 931852096 /nfs/dbraw/zinc/85/20/96/931852096.db2.gz ZIKYHXRMIAZUFI-MRXNPFEDSA-N 0 3 400.494 4.079 20 0 HIADHN O=C(Nc1ccc(Cl)c(Cl)c1)C1CCN(C[C@H](O)COc2ccccc2)CC1 ZINC000533396373 931857405 /nfs/dbraw/zinc/85/74/05/931857405.db2.gz VENIEFKQAWGJIG-KRWDZBQOSA-N 0 3 423.340 4.084 20 0 HIADHN Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)N[C@H]1CCCN(CC(F)(F)F)C1=O ZINC000533448982 931872507 /nfs/dbraw/zinc/87/25/07/931872507.db2.gz MDRZWUBIVNSODX-ABAIWWIYSA-N 0 3 415.456 4.462 20 0 HIADHN Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)N[C@H]1CCCN(CC(F)(F)F)C1=O ZINC000533448984 931872659 /nfs/dbraw/zinc/87/26/59/931872659.db2.gz MDRZWUBIVNSODX-NHYWBVRUSA-N 0 3 415.456 4.462 20 0 HIADHN CN(CCn1cncn1)[C@@H](c1ccc(Cl)cc1)c1ccc(Br)cc1 ZINC000533484612 931881882 /nfs/dbraw/zinc/88/18/82/931881882.db2.gz MOWJNAAMBSJQRA-GOSISDBHSA-N 0 3 405.727 4.415 20 0 HIADHN COc1ccc(CN(C)C(=O)CN[C@H](Cc2ccccc2)c2ccccc2)cc1OC ZINC000533494168 931884549 /nfs/dbraw/zinc/88/45/49/931884549.db2.gz IMZYFSXIQMHKEC-HSZRJFAPSA-N 0 3 418.537 4.236 20 0 HIADHN Cc1cccc(NC2CCN(C[C@H](O)COc3ccc(Br)cc3)CC2)c1 ZINC000533531537 931895584 /nfs/dbraw/zinc/89/55/84/931895584.db2.gz LTUAWRALMDZJPR-FQEVSTJZSA-N 0 3 419.363 4.074 20 0 HIADHN O=C1c2ccccc2C(=O)N1[C@@H]1CCCC[C@H](NCc2ncoc2-c2ccccc2)C1 ZINC000533547666 931898130 /nfs/dbraw/zinc/89/81/30/931898130.db2.gz MUUBIFYNHPJVII-RBUKOAKNSA-N 0 3 415.493 4.429 20 0 HIADHN O=C1c2ccccc2C(=O)N1[C@@H]1CCCC[C@@H](NCc2csc(-c3ccco3)n2)C1 ZINC000533547941 931898208 /nfs/dbraw/zinc/89/82/08/931898208.db2.gz HGOHUCBIOSSNQK-NVXWUHKLSA-N 0 3 421.522 4.490 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3cccc(-c4ncco4)c3)CC2)C[C@@H](C)O1 ZINC000533594108 931910782 /nfs/dbraw/zinc/91/07/82/931910782.db2.gz DMNROLDMNFFAKI-QZTJIDSGSA-N 0 3 412.534 4.085 20 0 HIADHN C[C@H](NC(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1)[C@H]1COc2ccccc21 ZINC000533657594 931951751 /nfs/dbraw/zinc/95/17/51/931951751.db2.gz ANJLWJICCBKWSL-DKZVUGQWSA-N 0 3 418.459 4.122 20 0 HIADHN CCc1ccc([C@@H](NC(=O)CN2CC[C@H](C3CCOCC3)C2)c2cccs2)cc1 ZINC000533670332 931961013 /nfs/dbraw/zinc/96/10/13/931961013.db2.gz LBUNOMNFVJKECM-XUZZJYLKSA-N 0 3 412.599 4.265 20 0 HIADHN CC[C@H](NCc1cc(OC)cc2c1O[C@H](C)C2)[C@H](c1ccc(C)cc1)n1cncn1 ZINC000533742927 932003212 /nfs/dbraw/zinc/00/32/12/932003212.db2.gz LFPMRVMQQZNQOB-VSDWSMLSSA-N 0 3 406.530 4.076 20 0 HIADHN C[C@@H](CC(=O)Nc1cccc(N2CCCC2)c1)NCc1cnc([C@@H]2CCCO2)s1 ZINC000533753826 932010553 /nfs/dbraw/zinc/01/05/53/932010553.db2.gz CPCHRFZNXZZQSN-JXFKEZNVSA-N 0 3 414.575 4.102 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccc(F)c2)C1)N(Cc1ccco1)Cc1cccnc1 ZINC000533805031 932039958 /nfs/dbraw/zinc/03/99/58/932039958.db2.gz MRJHEBXESZRCEV-OAQYLSRUSA-N 0 3 407.489 4.255 20 0 HIADHN CN1Cc2ccccc2[C@@H](NCc2cn(Cc3ccccc3)nc2-c2cccnc2)C1 ZINC000533820053 932045596 /nfs/dbraw/zinc/04/55/96/932045596.db2.gz RJPWSYHDXRMMPG-VWLOTQADSA-N 0 3 409.537 4.270 20 0 HIADHN C[C@@H](CNC(=O)Nc1cccc2c1CN(c1ccccn1)C2)N(C)Cc1ccccc1 ZINC000533881793 932078668 /nfs/dbraw/zinc/07/86/68/932078668.db2.gz NWGRMRCUJZQSAG-IBGZPJMESA-N 0 3 415.541 4.244 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2cnn(CC(C)C)c2C(F)F)N2CCCC2)cc1 ZINC000533903280 932091130 /nfs/dbraw/zinc/09/11/30/932091130.db2.gz HPFVQSCZLQGMCI-LJQANCHMSA-N 0 3 404.505 4.352 20 0 HIADHN COCc1nc(C)c(C(=O)N(CCN(C)Cc2ccccc2)Cc2ccccc2)s1 ZINC000533927276 932104020 /nfs/dbraw/zinc/10/40/20/932104020.db2.gz ACUMXYDYKHNELM-UHFFFAOYSA-N 0 3 423.582 4.372 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)Cc2csc(NC(=O)c3cccs3)n2)c1 ZINC000533970334 932147175 /nfs/dbraw/zinc/14/71/75/932147175.db2.gz BJGMQDHUDXDPIU-UHFFFAOYSA-N 0 3 414.556 4.008 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)c2cc(C)nc3c2cnn3Cc2cccs2)c1 ZINC000533970871 932149853 /nfs/dbraw/zinc/14/98/53/932149853.db2.gz XSICMZQUMOEGKD-UHFFFAOYSA-N 0 3 419.554 4.472 20 0 HIADHN COc1cc(C(=O)N2C[C@@H]3CCCN3Cc3ccccc32)sc1Br ZINC000533999368 932180681 /nfs/dbraw/zinc/18/06/81/932180681.db2.gz FQDCTSDAYUMTMC-ZDUSSCGKSA-N 0 3 407.333 4.144 20 0 HIADHN CN1CC[C@H](NC(=O)c2ccc(NC(=O)c3cccs3)cc2)[C@H]1c1ccccc1 ZINC000534017283 932198236 /nfs/dbraw/zinc/19/82/36/932198236.db2.gz DEFALFMHLXEEKP-PZJWPPBQSA-N 0 3 405.523 4.176 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)c(C)c1CC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000534018903 932200775 /nfs/dbraw/zinc/20/07/75/932200775.db2.gz LYEVZNRUVZZLHP-LADGPHEKSA-N 0 3 422.960 4.247 20 0 HIADHN O=C(c1ccco1)N1CCC(N[C@@H]2CCc3c2c(Br)ccc3F)CC1 ZINC000534060015 932239366 /nfs/dbraw/zinc/23/93/66/932239366.db2.gz VZAPLFLRYNEAGM-MRXNPFEDSA-N 0 3 407.283 4.063 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)c1cc(N2CCCC2=O)ccc1Cl ZINC000534060721 932239527 /nfs/dbraw/zinc/23/95/27/932239527.db2.gz OZPBZHFEQQKCDM-OAQYLSRUSA-N 0 3 411.933 4.034 20 0 HIADHN CCN(C(=O)c1cccc(OCC(F)F)n1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000534077617 932256259 /nfs/dbraw/zinc/25/62/59/932256259.db2.gz LCMNGJULHUVXPC-FUHWJXTLSA-N 0 3 403.473 4.023 20 0 HIADHN CC(=O)c1ccc(Oc2ccc(C(=O)N(CCN(C)C)Cc3ccccn3)cc2)cc1 ZINC000534080140 932259329 /nfs/dbraw/zinc/25/93/29/932259329.db2.gz KNUNJODWXYKMHA-UHFFFAOYSA-N 0 3 417.509 4.281 20 0 HIADHN CC(C)Cn1ncc(NC(=O)N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)c1C(F)F ZINC000534089631 932268894 /nfs/dbraw/zinc/26/88/94/932268894.db2.gz QFANRTWHWJWSFH-NVXWUHKLSA-N 0 3 405.493 4.261 20 0 HIADHN CCCN(Cc1nnc(-c2cc(C)oc2C)o1)C1CCN(c2cc(C)nc(C)n2)CC1 ZINC000534106422 932281184 /nfs/dbraw/zinc/28/11/84/932281184.db2.gz PJZHZPROEHEZRB-UHFFFAOYSA-N 0 3 424.549 4.234 20 0 HIADHN COc1cccc(C(=O)Nc2c(C)cnn2[C@@H]2CCN(Cc3ccccc3)C2)c1F ZINC000534153456 932305165 /nfs/dbraw/zinc/30/51/65/932305165.db2.gz MORJEXGRWAOORM-GOSISDBHSA-N 0 3 408.477 4.039 20 0 HIADHN CCN(C(=O)c1ccc(OCC(F)F)nc1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000534175124 932315956 /nfs/dbraw/zinc/31/59/56/932315956.db2.gz DDWGKUXSWZCUBS-QFBILLFUSA-N 0 3 403.473 4.023 20 0 HIADHN CN(C)CCN(Cc1cccc(O)c1)C(=O)[C@@H]1C[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000534190413 932322841 /nfs/dbraw/zinc/32/28/41/932322841.db2.gz DPJUCOPCSPTJBY-WOJBJXKFSA-N 0 3 406.448 4.105 20 0 HIADHN C[C@@H](Cc1cccc(C(F)(F)F)c1)C(=O)N(CCN(C)C)Cc1cccc(O)c1 ZINC000534192571 932324443 /nfs/dbraw/zinc/32/44/43/932324443.db2.gz OGIDDHSSTIOGEI-INIZCTEOSA-N 0 3 408.464 4.180 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)[C@H]2CC(=O)N(C)[C@H]2c2ccc(Cl)c(F)c2)c1 ZINC000534285270 932375503 /nfs/dbraw/zinc/37/55/03/932375503.db2.gz ILVQJZXHBANBBZ-UWJYYQICSA-N 0 3 417.912 4.007 20 0 HIADHN CN(CCCCCc1cc(-c2ccc(F)cc2)n[nH]1)Cc1cnc(N2CCCC2)nc1 ZINC000534349743 932389852 /nfs/dbraw/zinc/38/98/52/932389852.db2.gz UWOKPSQRTQEPTK-UHFFFAOYSA-N 0 3 422.552 4.451 20 0 HIADHN CC(=O)c1ccc2c(c1)CCN(CCC(=O)Nc1cccc(C(F)(F)F)c1)CC2 ZINC000534475670 932506485 /nfs/dbraw/zinc/50/64/85/932506485.db2.gz URKJZKCMGDYYQW-UHFFFAOYSA-N 0 3 404.432 4.337 20 0 HIADHN Cc1nn(-c2ccc(C(=O)NC[C@H](Cc3ccccc3)N(C)C)cc2)c(C)c1Cl ZINC000534520555 932543607 /nfs/dbraw/zinc/54/36/07/932543607.db2.gz IRZPZVUQVPFAFE-NRFANRHFSA-N 0 3 410.949 4.045 20 0 HIADHN Cc1nc(-c2ccc(CNC(=O)NC[C@H](Cc3ccccc3)N(C)C)s2)cs1 ZINC000534522244 932544521 /nfs/dbraw/zinc/54/45/21/932544521.db2.gz GGOABXGIKNNRMK-KRWDZBQOSA-N 0 3 414.600 4.152 20 0 HIADHN CN(C)[C@H](CNC(=O)Nc1ccc2oc(C(F)(F)F)nc2c1)Cc1ccccc1 ZINC000534524170 932544909 /nfs/dbraw/zinc/54/49/09/932544909.db2.gz IGABPLHWISIYDR-HNNXBMFYSA-N 0 3 406.408 4.141 20 0 HIADHN Cc1nc(-c2cccc(C(F)(F)F)c2)[nH]c1C(=O)N(CCN(C)C)C1CCCC1 ZINC000534564387 932567036 /nfs/dbraw/zinc/56/70/36/932567036.db2.gz RDNIVXAVWATZMV-UHFFFAOYSA-N 0 3 408.468 4.350 20 0 HIADHN O=C(Nc1ccccc1O)C1CCN(Cc2ccccc2Oc2cccnc2)CC1 ZINC000534655586 932625283 /nfs/dbraw/zinc/62/52/83/932625283.db2.gz NYYNHLLGDIWFBX-UHFFFAOYSA-N 0 3 403.482 4.430 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)c2cccc(CS(=O)(=O)c3ccccc3)c2)c1 ZINC000534700758 932672124 /nfs/dbraw/zinc/67/21/24/932672124.db2.gz ISRMUKQUYADDHK-UHFFFAOYSA-N 0 3 422.550 4.283 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)c2cnn(-c3ccc(Br)cc3)c2)c1 ZINC000534703366 932673912 /nfs/dbraw/zinc/67/39/12/932673912.db2.gz ZLRLBKUDJUODEB-UHFFFAOYSA-N 0 3 413.319 4.257 20 0 HIADHN COc1ccc(C[C@H](C)C(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000534729701 932698073 /nfs/dbraw/zinc/69/80/73/932698073.db2.gz YSNSWXAGDZDYMV-SIKLNZKXSA-N 0 3 418.541 4.156 20 0 HIADHN CN1CC[C@H](NC(=O)CCCc2ccccc2Br)[C@H]1c1ccccc1 ZINC000534756165 932734652 /nfs/dbraw/zinc/73/46/52/932734652.db2.gz PDPRHZBGSPPFKG-PZJWPPBQSA-N 0 3 401.348 4.333 20 0 HIADHN CN(C(=O)[C@@H](OC1CCOCC1)c1ccccc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000534774600 932754291 /nfs/dbraw/zinc/75/42/91/932754291.db2.gz BCDGSRLCWHTEGP-ZCYQVOJMSA-N 0 3 422.569 4.046 20 0 HIADHN CCOc1ccc(F)c(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2F)c1F ZINC000534777606 932758230 /nfs/dbraw/zinc/75/82/30/932758230.db2.gz WOBXQOFZSCLWNT-UHFFFAOYSA-N 0 3 413.415 4.237 20 0 HIADHN CCC(=O)c1ccc(OCCCCC(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)cc1 ZINC000534845383 932804750 /nfs/dbraw/zinc/80/47/50/932804750.db2.gz CPXYOGKDYQYEFX-RDGATRHJSA-N 0 3 408.542 4.390 20 0 HIADHN CCC(=O)c1ccc(OCCCCC(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)cc1 ZINC000534845382 932805098 /nfs/dbraw/zinc/80/50/98/932805098.db2.gz CPXYOGKDYQYEFX-RCZVLFRGSA-N 0 3 408.542 4.390 20 0 HIADHN CN(C)CCN(Cc1cccc(O)c1)C(=O)Cc1cc2c(ccc3ccccc23)o1 ZINC000534924233 932840265 /nfs/dbraw/zinc/84/02/65/932840265.db2.gz AGHOSZNWZOHLFF-UHFFFAOYSA-N 0 3 402.494 4.425 20 0 HIADHN CN(C)CCN(Cc1cccc(O)c1)C(=O)c1cccc(OCc2cccs2)c1 ZINC000534928470 932842790 /nfs/dbraw/zinc/84/27/90/932842790.db2.gz NIRDGVZYBNKODP-UHFFFAOYSA-N 0 3 410.539 4.237 20 0 HIADHN O=C(Nc1ccccc1)NC1CCN(Cc2ccc(OC[C@@H]3CCCO3)cc2)CC1 ZINC000535084622 932901366 /nfs/dbraw/zinc/90/13/66/932901366.db2.gz LOZVRESHKKDEAZ-QHCPKHFHSA-N 0 3 409.530 4.031 20 0 HIADHN Cc1c(C(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)cccc1-c1ccccn1 ZINC000535097885 932913834 /nfs/dbraw/zinc/91/38/34/932913834.db2.gz AORUXTVRIIRYEM-PMACEKPBSA-N 0 3 421.585 4.409 20 0 HIADHN CCOc1cc(CN[C@@H](C)c2ccc(-n3ccnn3)cc2)ccc1OCC(F)(F)F ZINC000535186918 933002192 /nfs/dbraw/zinc/00/21/92/933002192.db2.gz VDQVATJWHTWMFW-HNNXBMFYSA-N 0 3 420.435 4.458 20 0 HIADHN CN(C)CCn1cc(NC(=O)c2ccc(-c3ccc(C(C)(C)C)cc3)o2)ccc1=O ZINC000535227047 933028363 /nfs/dbraw/zinc/02/83/63/933028363.db2.gz XQNOQWVIIWLDAQ-UHFFFAOYSA-N 0 3 407.514 4.220 20 0 HIADHN COc1ccccc1[C@@H](NC(=O)NC[C@@H](Cc1ccccc1)N(C)C)c1ccccc1 ZINC000535260913 933040650 /nfs/dbraw/zinc/04/06/50/933040650.db2.gz IEDDOYKDWMQNPV-RDGATRHJSA-N 0 3 417.553 4.257 20 0 HIADHN Cc1cccn2cc(COc3ccc(CN[C@@H]4CN(C)Cc5ccccc54)cc3)nc12 ZINC000535264695 933042730 /nfs/dbraw/zinc/04/27/30/933042730.db2.gz HALVIVVXQJNHAC-RUZDIDTESA-N 0 3 412.537 4.498 20 0 HIADHN Cc1cc(C(=O)NC[C@H](c2ccccc2)N(C)C)ccc1NC(=O)c1cccs1 ZINC000535329832 933076660 /nfs/dbraw/zinc/07/66/60/933076660.db2.gz MSZSGKNBNCFXOV-HXUWFJFHSA-N 0 3 407.539 4.342 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)[C@@H]1CC(=O)N(C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000535374230 933099864 /nfs/dbraw/zinc/09/98/64/933099864.db2.gz VOOYVZFRGANGKM-IERDGZPVSA-N 0 3 417.912 4.007 20 0 HIADHN CN(Cc1cc(Br)cs1)C(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000535393359 933112285 /nfs/dbraw/zinc/11/22/85/933112285.db2.gz BYPIILPWNFXGHR-DLBZAZTESA-N 0 3 408.365 4.097 20 0 HIADHN Cc1nc(-c2ccc(CNC(=O)N[C@H]3CCN(C)[C@@H]3c3ccccc3)s2)cs1 ZINC000535398516 933115715 /nfs/dbraw/zinc/11/57/15/933115715.db2.gz VGKLVPIYFOYICN-FXAWDEMLSA-N 0 3 412.584 4.425 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)[C@]23CCC(=O)N2c2cc(Cl)ccc2S3)c1 ZINC000535414202 933124274 /nfs/dbraw/zinc/12/42/74/933124274.db2.gz CBZLBOHZUPKGSR-OAQYLSRUSA-N 0 3 415.946 4.278 20 0 HIADHN CN1CC[C@H](NC(=O)N(Cc2ccccc2)CC2CCOCC2)[C@H]1c1ccccc1 ZINC000535433619 933133337 /nfs/dbraw/zinc/13/33/37/933133337.db2.gz UWYRBDIVVVOBMG-BJKOFHAPSA-N 0 3 407.558 4.070 20 0 HIADHN CC(C)c1ccc(-c2noc(CCC(=O)N[C@@H]3CCN(C)[C@@H]3c3ccccc3)n2)cc1 ZINC000535470023 933160300 /nfs/dbraw/zinc/16/03/00/933160300.db2.gz RTWODNRJUZVRFX-ZJSXRUAMSA-N 0 3 418.541 4.354 20 0 HIADHN CC(C)c1ccc(-c2noc(CCC(=O)N[C@H]3CCN(C)[C@@H]3c3ccccc3)n2)cc1 ZINC000535470021 933160744 /nfs/dbraw/zinc/16/07/44/933160744.db2.gz RTWODNRJUZVRFX-XUZZJYLKSA-N 0 3 418.541 4.354 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)c2cc(N3CCCC3=O)ccc2Cl)C1 ZINC000535527084 933217551 /nfs/dbraw/zinc/21/75/51/933217551.db2.gz ADOABOYEFDMYQZ-AEFFLSMTSA-N 0 3 411.933 4.032 20 0 HIADHN CCc1ccc([C@H](CNC(=O)Nc2cnn(CC(C)C)c2C(F)F)N(C)C)cc1 ZINC000535538135 933231629 /nfs/dbraw/zinc/23/16/29/933231629.db2.gz IYPHXRDFMQMDFQ-SFHVURJKSA-N 0 3 407.509 4.464 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)c1cnc(-c2cccnc2)s1 ZINC000535583215 933255001 /nfs/dbraw/zinc/25/50/01/933255001.db2.gz PNUCWZTYVOFQEL-UHFFFAOYSA-N 0 3 410.568 4.049 20 0 HIADHN c1csc(-c2nn(Cc3ccccc3)cc2CN2CCC(Cn3ccnn3)CC2)c1 ZINC000535812916 933408246 /nfs/dbraw/zinc/40/82/46/933408246.db2.gz VJQRVKBOOMAPAQ-UHFFFAOYSA-N 0 3 418.570 4.164 20 0 HIADHN C[C@H](Cc1cccc(Cl)c1)C(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000535909067 933484018 /nfs/dbraw/zinc/48/40/18/933484018.db2.gz BYPZBMAVAZJEEU-GUDVDZBRSA-N 0 3 406.998 4.257 20 0 HIADHN COc1cccc(-c2nc(C)c(C(=O)N(C)[C@@H]3CCCN(Cc4ccccc4)C3)[nH]2)c1 ZINC000535913611 933487950 /nfs/dbraw/zinc/48/79/50/933487950.db2.gz KKVKQMRKTXRONP-OAQYLSRUSA-N 0 3 418.541 4.130 20 0 HIADHN Cc1nc(C(C)C)sc1[C@@H](C)N(C)C(=O)NC1CCN(CCOC(C)C)CC1 ZINC000535930291 933499046 /nfs/dbraw/zinc/49/90/46/933499046.db2.gz MYHPEXMZWLVJOJ-QGZVFWFLSA-N 0 3 410.628 4.167 20 0 HIADHN CCc1ccc(CNCc2ccccc2CS(=O)(=O)N2CCC(C)CC2)cc1 ZINC000535941977 933508380 /nfs/dbraw/zinc/50/83/80/933508380.db2.gz DUAWKSNEPKTJEL-UHFFFAOYSA-N 0 3 400.588 4.101 20 0 HIADHN FC(F)(F)c1ccc(CN2CC[C@H](NCc3cnc([C@@H]4CCCO4)s3)C2)cc1 ZINC000535944724 933511358 /nfs/dbraw/zinc/51/13/58/933511358.db2.gz VPTJOKHCQQXCGT-WMZOPIPTSA-N 0 3 411.493 4.378 20 0 HIADHN FC(F)(F)c1ccc(CN2CC[C@@H](NCc3cnc([C@@H]4CCCO4)s3)C2)cc1 ZINC000535944716 933511368 /nfs/dbraw/zinc/51/13/68/933511368.db2.gz VPTJOKHCQQXCGT-AEFFLSMTSA-N 0 3 411.493 4.378 20 0 HIADHN C[C@@H](NCC1=Cc2cc(Br)ccc2OC1)c1ccc([S@@](C)=O)cc1 ZINC000535946635 933513308 /nfs/dbraw/zinc/51/33/08/933513308.db2.gz RFKREYNTLJVUGV-YEBMWUKDSA-N 0 3 406.345 4.313 20 0 HIADHN Brc1ccc(N2CC[C@@H](NCc3cnc([C@@H]4CCCO4)s3)C2)cc1 ZINC000535959873 933524686 /nfs/dbraw/zinc/52/46/86/933524686.db2.gz WEXSJYWTIYVBTP-PBHICJAKSA-N 0 3 408.365 4.126 20 0 HIADHN CC(=O)c1ccc2c(c1)CCN(CCC(=O)Nc1cccc(Br)c1)CC2 ZINC000535968588 933531961 /nfs/dbraw/zinc/53/19/61/933531961.db2.gz FZAFPIOXLLEDJV-UHFFFAOYSA-N 0 3 415.331 4.081 20 0 HIADHN COc1ccc(C2(CN[C@H](C)c3ncc(Br)s3)CCOCC2)cc1 ZINC000535987961 933549237 /nfs/dbraw/zinc/54/92/37/933549237.db2.gz NIIXAFUAZKEKLS-CYBMUJFWSA-N 0 3 411.365 4.313 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)C(C)(C)Cc3nc4ccccc4[nH]3)c(C)c2)CC1 ZINC000537302516 933705748 /nfs/dbraw/zinc/70/57/48/933705748.db2.gz WOSUEXSPZZOQCO-UHFFFAOYSA-N 0 3 419.573 4.221 20 0 HIADHN COc1ccc([C@@H](C)NCCc2nnc(-c3ccccc3)o2)c(Br)c1 ZINC000537308726 933708896 /nfs/dbraw/zinc/70/88/96/933708896.db2.gz VSMIYVNLSIWVLC-CYBMUJFWSA-N 0 3 402.292 4.401 20 0 HIADHN CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NCc1ccc(F)c(-c2cccs2)c1 ZINC000537314821 933713268 /nfs/dbraw/zinc/71/32/68/933713268.db2.gz DRQDERPNAUAVHR-NRFANRHFSA-N 0 3 407.514 4.482 20 0 HIADHN CN(Cc1ccco1)Cc1ccccc1CNCc1ccc(Br)cn1 ZINC000537315016 933713699 /nfs/dbraw/zinc/71/36/99/933713699.db2.gz QXVSOYAFZPXDTF-UHFFFAOYSA-N 0 3 400.320 4.359 20 0 HIADHN COC(=O)C1CCN(CCCNC(=O)c2ccc(-c3cccc(C(C)C)c3)o2)CC1 ZINC000537328930 933717436 /nfs/dbraw/zinc/71/74/36/933717436.db2.gz GGUQWZADAGHUOY-UHFFFAOYSA-N 0 3 412.530 4.075 20 0 HIADHN CCN(CC)c1ncc(CNCCC(=O)Nc2cc(C)c(Cl)cc2OC)s1 ZINC000537328724 933717869 /nfs/dbraw/zinc/71/78/69/933717869.db2.gz GKKODUGGQKGXPC-UHFFFAOYSA-N 0 3 410.971 4.078 20 0 HIADHN CCN1CCN(c2ccc(N[C@@H](C)c3nnn(-c4ccccc4)c3C)c(C)c2)CC1 ZINC000537406332 933762100 /nfs/dbraw/zinc/76/21/00/933762100.db2.gz CTHPSTAZJSRVPO-IBGZPJMESA-N 0 3 404.562 4.199 20 0 HIADHN Cn1nc2ccccc2c1-c1noc([C@@H]2CN(Cc3ccccc3)CCC2(F)F)n1 ZINC000562898487 945144825 /nfs/dbraw/zinc/14/48/25/945144825.db2.gz ANWRDJMPLOFOJF-KRWDZBQOSA-N 0 3 409.440 4.248 20 0 HIADHN CCNC(=O)[C@H](C)N[C@H]1CCCc2nc(-c3ccc(Br)cc3)sc21 ZINC000537520718 938315227 /nfs/dbraw/zinc/31/52/27/938315227.db2.gz CNJWIDUGRNOWLJ-FZMZJTMJSA-N 0 3 408.365 4.064 20 0 HIADHN CCOc1ccc(CN2CCc3cc(OC)c(OC)c(OC)c3CC2)cc1OCC ZINC000537659951 938348490 /nfs/dbraw/zinc/34/84/90/938348490.db2.gz VUHLFIUDDDYDIM-UHFFFAOYSA-N 0 3 415.530 4.111 20 0 HIADHN F[C@H](C(F)(F)F)C(F)(F)Oc1ccc(CN2CCS[C@@H]3COCC[C@@H]32)cc1 ZINC000537707600 938360524 /nfs/dbraw/zinc/36/05/24/938360524.db2.gz FECYGUGMDPGXPH-RRFJBIMHSA-N 0 3 415.399 4.265 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)C3(Cc4ccc(Cl)cc4)CC3)CC2)C[C@@H](C)O1 ZINC000537747632 938368504 /nfs/dbraw/zinc/36/85/04/938368504.db2.gz NIAXWJAEHMSGCK-QZTJIDSGSA-N 0 3 404.982 4.011 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)NCc3cc(Cl)sc3Cl)CC2)C[C@H](C)O1 ZINC000537765381 938372632 /nfs/dbraw/zinc/37/26/32/938372632.db2.gz OKGGYWXXKCGCPF-BETUJISGSA-N 0 3 420.406 4.086 20 0 HIADHN Cc1ccc(NC(=O)C[C@H](C)N[C@H]2CC(=O)N(c3c(F)cccc3F)C2)c(Cl)c1 ZINC000537767592 938373000 /nfs/dbraw/zinc/37/30/00/938373000.db2.gz KHAJHSRFJRNGMX-KBPBESRZSA-N 0 3 421.875 4.039 20 0 HIADHN O=C([C@@H]1CC12CCN(CCOc1ccc(C(F)(F)F)cc1)CC2)N1CCCCC1 ZINC000537806454 938380977 /nfs/dbraw/zinc/38/09/77/938380977.db2.gz JEYCDXAXMXMTKA-IBGZPJMESA-N 0 3 410.480 4.199 20 0 HIADHN O=C(CCC1CCOCC1)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1 ZINC000537821446 938383914 /nfs/dbraw/zinc/38/39/14/938383914.db2.gz LHGGAENDLRVOAM-UHFFFAOYSA-N 0 3 421.585 4.197 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@@H](c1ccccc1)[C@H]1CCOC1)c1ccsc1 ZINC000537856493 938391461 /nfs/dbraw/zinc/39/14/61/938391461.db2.gz FUFIGZJETUNHNK-TYPHKJRUSA-N 0 3 401.576 4.208 20 0 HIADHN C[C@@H](NCc1ccc(S(=O)(=O)N2CCCCC2)cc1)c1ccc(OC(F)F)cc1 ZINC000537918743 938413275 /nfs/dbraw/zinc/41/32/75/938413275.db2.gz IQWFNVDQDYYIOR-MRXNPFEDSA-N 0 3 424.513 4.313 20 0 HIADHN C[C@H](N[C@@H]1CCc2cc(F)ccc21)c1ccc(S(=O)(=O)NCc2ccco2)cc1 ZINC000537937425 938422679 /nfs/dbraw/zinc/42/26/79/938422679.db2.gz KMONHKAIQQQCLM-OYHNWAKOSA-N 0 3 414.502 4.235 20 0 HIADHN Cc1cccc(NC(=O)C[C@H](C)N[C@H](c2ccc(Cl)cc2)[C@@H]2CN(C)CCO2)c1 ZINC000537943243 938426394 /nfs/dbraw/zinc/42/63/94/938426394.db2.gz HIVTWFPZUKRAJG-JWNTYJGQSA-N 0 3 415.965 4.027 20 0 HIADHN COCCC[C@@H](NCC(=O)N(C)C1CCCCC1)c1ccc(Br)cc1 ZINC000537955398 938432533 /nfs/dbraw/zinc/43/25/33/938432533.db2.gz UZOSLUZLQRWBGH-LJQANCHMSA-N 0 3 411.384 4.298 20 0 HIADHN C[C@@H](N[C@@H]1CCN(c2cnn(C)c2)C1=O)c1ccc(-c2ccccc2Cl)s1 ZINC000537972102 938441609 /nfs/dbraw/zinc/44/16/09/938441609.db2.gz VZHYGJYVACUJCN-CXAGYDPISA-N 0 3 400.935 4.258 20 0 HIADHN Cn1c2ccc(F)cc2nc1CCN[C@@H]1CCc2c1c(Br)ccc2F ZINC000537972826 938442060 /nfs/dbraw/zinc/44/20/60/938442060.db2.gz DMSNOKWUCABECQ-OAHLLOKOSA-N 0 3 406.274 4.434 20 0 HIADHN CC(=O)Nc1cccc([C@H](C)NCCC(=O)Nc2cc(Br)ccc2C)c1 ZINC000537979967 938446792 /nfs/dbraw/zinc/44/67/92/938446792.db2.gz CIGHPYVYYFRPIS-AWEZNQCLSA-N 0 3 418.335 4.395 20 0 HIADHN C[C@H](N[C@@H]1CCCN(S(=O)(=O)c2cccs2)C1)c1ccc(F)c(Cl)c1 ZINC000563314277 945175429 /nfs/dbraw/zinc/17/54/29/945175429.db2.gz LLLKEFHFHXSINT-GXTWGEPZSA-N 0 3 402.944 4.045 20 0 HIADHN C[C@@H]1C[C@@H](NCc2ccc(S(=O)(=O)N(C)C)cc2)c2cccc(Br)c21 ZINC000537987845 938449799 /nfs/dbraw/zinc/44/97/99/938449799.db2.gz QVVWETPZHGZRBA-FZKQIMNGSA-N 0 3 423.376 4.038 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)N[C@@H]2CCN(CCCc3ccccc3)C2=O)cc1 ZINC000538018790 938464112 /nfs/dbraw/zinc/46/41/12/938464112.db2.gz XDNBJRGZYQNQQS-YADARESESA-N 0 3 402.542 4.065 20 0 HIADHN COc1cc(OC)c(OC)cc1CN[C@H](C)[C@@H](OC)c1ccc(Br)cc1 ZINC000538018238 938464394 /nfs/dbraw/zinc/46/43/94/938464394.db2.gz MZNSCYNYLHUQIG-ZUOKHONESA-N 0 3 424.335 4.341 20 0 HIADHN Cc1cccc([C@H](CN[C@H](C)c2nc3ccc(Cl)cc3n2C)N2CCOCC2)c1 ZINC000538063442 938492162 /nfs/dbraw/zinc/49/21/62/938492162.db2.gz UBTIXXIDMPWKCL-VGSWGCGISA-N 0 3 412.965 4.259 20 0 HIADHN C[C@@H](NCc1ccc(-c2ccc3c(c2)C[C@@H](C)O3)cc1)c1ccc(S(N)(=O)=O)cc1 ZINC000538116041 938506357 /nfs/dbraw/zinc/50/63/57/938506357.db2.gz HTBGVFNLQRIMSA-IAGOWNOFSA-N 0 3 422.550 4.175 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(OCc2cccnc2)cc1)C(=O)N1CCc2ccccc21 ZINC000538126795 938512616 /nfs/dbraw/zinc/51/26/16/938512616.db2.gz ZJGVEYIKDMKWEX-OALUTQOASA-N 0 3 401.510 4.289 20 0 HIADHN CC[C@@H](NCC(=O)N1CCC[C@H]1c1ccc2c(c1)OCCCO2)c1ccc(OC)cc1 ZINC000538142276 938519276 /nfs/dbraw/zinc/51/92/76/938519276.db2.gz ZYBBFVGMQSVKTK-YADHBBJMSA-N 0 3 424.541 4.261 20 0 HIADHN COc1ccc(CNC(=O)CN[C@H](Cc2ccc(F)cc2)c2ccc(OC)cc2)cc1 ZINC000538176312 938537115 /nfs/dbraw/zinc/53/71/15/938537115.db2.gz XNVHNSCAFHTBIZ-XMMPIXPASA-N 0 3 422.500 4.033 20 0 HIADHN CN1CC[C@H](N[C@@H]2CCN(c3ccc(Cl)cc3Cl)C2=O)[C@H]1c1ccccc1 ZINC000563330030 945183791 /nfs/dbraw/zinc/18/37/91/945183791.db2.gz HLQIELQEIXIFPH-NLWGTHIKSA-N 0 3 404.341 4.134 20 0 HIADHN COc1ccc([C@H](Cc2ccc(F)cc2)NCC(=O)Nc2ccc3c(c2)OCO3)cc1 ZINC000538180313 938540918 /nfs/dbraw/zinc/54/09/18/938540918.db2.gz NDVAZULBLZYWAK-NRFANRHFSA-N 0 3 422.456 4.075 20 0 HIADHN O=C(CNC1(c2ccccc2)CCCC1)Nc1ccccc1I ZINC000538189371 938544619 /nfs/dbraw/zinc/54/46/19/938544619.db2.gz XQONTXIDQMKPOH-UHFFFAOYSA-N 0 3 420.294 4.289 20 0 HIADHN C[C@@H](N[C@H](C)c1cccc(-n2cccn2)c1)C(=O)Nc1ccccc1Br ZINC000538189310 938544733 /nfs/dbraw/zinc/54/47/33/938544733.db2.gz YPKFIINDRGBDPJ-HUUCEWRRSA-N 0 3 413.319 4.313 20 0 HIADHN Cc1ccccc1[C@H](NCC(=O)NCc1ccccc1CN1CCCC1=O)C(C)(C)C ZINC000538191512 938547473 /nfs/dbraw/zinc/54/74/73/938547473.db2.gz ONZZMMIWCCWBNX-VWLOTQADSA-N 0 3 421.585 4.111 20 0 HIADHN C[C@@H](N[C@H]1CCCN(c2ccccc2)C1=O)c1ccc(NC(=O)c2ccncc2)cc1 ZINC000538193732 938548016 /nfs/dbraw/zinc/54/80/16/938548016.db2.gz CKTGVOGZEWIJPN-JPYJTQIMSA-N 0 3 414.509 4.180 20 0 HIADHN COc1cc(NC(=O)CNC(C)(C)c2ccc(C(C)(C)C)cc2)cc(OC)c1OC ZINC000538204864 938553724 /nfs/dbraw/zinc/55/37/24/938553724.db2.gz MRNCGIPBWOYIOX-UHFFFAOYSA-N 0 3 414.546 4.473 20 0 HIADHN Cc1ccccc1[C@@H](NCC(=O)NCc1ccc(C(=O)N2CCCC2)cc1)C(C)(C)C ZINC000538257700 938576211 /nfs/dbraw/zinc/57/62/11/938576211.db2.gz KDBXWOPDEUUMFH-XMMPIXPASA-N 0 3 421.585 4.224 20 0 HIADHN C[C@H](N[C@@H](C)c1cccc(N2CCCC2)c1)C(=O)Nc1cccc(N2CCCC2=O)c1 ZINC000538277409 938581766 /nfs/dbraw/zinc/58/17/66/938581766.db2.gz TXKYXCCNBGPFNL-OALUTQOASA-N 0 3 420.557 4.091 20 0 HIADHN Cn1ccnc1[C@H](NCCSCCOc1cccc(Br)c1)C1CC1 ZINC000538299720 938587231 /nfs/dbraw/zinc/58/72/31/938587231.db2.gz PEKRBTARNSRZBG-QGZVFWFLSA-N 0 3 410.381 4.036 20 0 HIADHN CCOc1ccc([C@H](C)NC(=O)CN[C@@H](c2ccc(F)c(C)c2)C2CC2)cc1OC ZINC000538320746 938591686 /nfs/dbraw/zinc/59/16/86/938591686.db2.gz NOPNOQHRWMNZAX-UPCLLVRISA-N 0 3 414.521 4.460 20 0 HIADHN Cc1nn(-c2ccccc2)c(Oc2cccc(F)c2)c1CN[C@@H](C)Cn1ccnc1 ZINC000538346461 938599560 /nfs/dbraw/zinc/59/95/60/938599560.db2.gz SAEYKKFPPARGAB-KRWDZBQOSA-N 0 3 405.477 4.487 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2cnoc2-c2ccc(F)cc2Cl)N(C)C)cc1 ZINC000538346548 938599607 /nfs/dbraw/zinc/59/96/07/938599607.db2.gz XIACNSJRNYBWAZ-LJQANCHMSA-N 0 3 401.869 4.475 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)c1ccccc1NC1CCCCC1 ZINC000538388706 938608838 /nfs/dbraw/zinc/60/88/38/938608838.db2.gz VOELDDLLCFFVAK-UHFFFAOYSA-N 0 3 421.585 4.318 20 0 HIADHN CC(C)(C)[C@H](COc1ccccc1F)NCC(=O)N1CCC[C@H](C(F)(F)F)C1 ZINC000538390689 938609347 /nfs/dbraw/zinc/60/93/47/938609347.db2.gz UOCNADRNWNCXGZ-YOEHRIQHSA-N 0 3 404.448 4.010 20 0 HIADHN COc1ccc([C@H](C)NCCc2ccc(OC)c(OC)c2OC)c(Br)c1 ZINC000538393544 938610022 /nfs/dbraw/zinc/61/00/22/938610022.db2.gz NUXNEYNUMKLNKI-ZDUSSCGKSA-N 0 3 424.335 4.377 20 0 HIADHN CCO[C@@H]1C[C@H](N[C@@H](CN2CCCC2=O)c2cccc(C(F)(F)F)c2)C12CCC2 ZINC000538397136 938610719 /nfs/dbraw/zinc/61/07/19/938610719.db2.gz RGGNOLRIJTWLOH-GBESFXJTSA-N 0 3 410.480 4.306 20 0 HIADHN CCO[C@@H]1C[C@@H](N[C@@H](CN2CCCC2=O)c2cccc(C(F)(F)F)c2)C12CCC2 ZINC000538397138 938610809 /nfs/dbraw/zinc/61/08/09/938610809.db2.gz RGGNOLRIJTWLOH-IPMKNSEASA-N 0 3 410.480 4.306 20 0 HIADHN CC(C)(C)c1nn(-c2ccccc2Cl)cc1CNC(C)(C)CCS(C)(=O)=O ZINC000538410201 938613941 /nfs/dbraw/zinc/61/39/41/938613941.db2.gz FQBOOIOOVNCVSK-UHFFFAOYSA-N 0 3 411.999 4.126 20 0 HIADHN Cc1c([C@H](C)Nc2cccc(CN3CCSCC3)c2)nnn1-c1ccc(F)cc1 ZINC000538587334 938656066 /nfs/dbraw/zinc/65/60/66/938656066.db2.gz AHNJPCGURIKEFG-INIZCTEOSA-N 0 3 411.550 4.437 20 0 HIADHN COC(=O)CC1(NCc2cn(-c3ccccc3Cl)nc2C(C)(C)C)CCOCC1 ZINC000538603469 938660049 /nfs/dbraw/zinc/66/00/49/938660049.db2.gz KOCOCXRTZFCIGJ-UHFFFAOYSA-N 0 3 419.953 4.025 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)c1cnn(Cc2ccccc2Cl)c1)c1ccco1 ZINC000563472590 945194531 /nfs/dbraw/zinc/19/45/31/945194531.db2.gz QARCLKLFHKPZKP-BEFAXECRSA-N 0 3 400.910 4.037 20 0 HIADHN C[C@H](C(=O)c1c[nH]c2ncccc12)N1CCC[C@@H](c2nc(C3CCCCC3)n[nH]2)C1 ZINC000538664594 938678896 /nfs/dbraw/zinc/67/88/96/938678896.db2.gz RLPQFZVPRKVYCU-NVXWUHKLSA-N 0 3 406.534 4.180 20 0 HIADHN C[C@]1(NCC(=O)NCc2cccc(COCc3ccco3)c2)CCCc2ccccc21 ZINC000538707740 938687626 /nfs/dbraw/zinc/68/76/26/938687626.db2.gz PLGLSVBGZVMGRZ-SANMLTNESA-N 0 3 418.537 4.454 20 0 HIADHN CNC(=O)CC1CCN(Cc2cn(Cc3ccccc3)nc2-c2cccc(C)c2)CC1 ZINC000538716843 938688941 /nfs/dbraw/zinc/68/89/41/938688941.db2.gz GBGNPOGVAVVENK-UHFFFAOYSA-N 0 3 416.569 4.255 20 0 HIADHN CC(C)(C)c1nn(Cc2ccccc2)cc1CN1CCC[C@@H](C(=O)N2CCCC2)C1 ZINC000538729410 938694395 /nfs/dbraw/zinc/69/43/95/938694395.db2.gz NBCMHVSCEUEPGI-OAQYLSRUSA-N 0 3 408.590 4.063 20 0 HIADHN OCCCCN(Cc1cc(Br)ccc1OCc1ccccn1)C1CC1 ZINC000538729949 938694591 /nfs/dbraw/zinc/69/45/91/938694591.db2.gz PBPZFUSKVBLKJV-UHFFFAOYSA-N 0 3 405.336 4.160 20 0 HIADHN COc1cc(CN2CC[C@@](C)(CCc3ccccc3)C2)cc(Cl)c1OCC(N)=O ZINC000538751019 938701427 /nfs/dbraw/zinc/70/14/27/938701427.db2.gz KVHMSRJTRZSTMU-HSZRJFAPSA-N 0 3 416.949 4.058 20 0 HIADHN CCc1ccc([O-])c(C(=O)N(C[C@@H]2CC[N@H+](Cc3ccccc3)C2)CC(F)(F)F)c1 ZINC000538775377 938707118 /nfs/dbraw/zinc/70/71/18/938707118.db2.gz FYBZACPOTVRTNE-LJQANCHMSA-N 0 3 420.475 4.481 20 0 HIADHN CCc1ccc([O-])c(C(=O)N(C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)CC(F)(F)F)c1 ZINC000538775377 938707122 /nfs/dbraw/zinc/70/71/22/938707122.db2.gz FYBZACPOTVRTNE-LJQANCHMSA-N 0 3 420.475 4.481 20 0 HIADHN COc1ccccc1COC1CCN(C(=O)c2cccc(CN3CCCC3)c2)CC1 ZINC000538806434 938717909 /nfs/dbraw/zinc/71/79/09/938717909.db2.gz ZQBMFSFJARPNAB-UHFFFAOYSA-N 0 3 408.542 4.112 20 0 HIADHN CCc1ccc([C@H](CO)N[C@H](C)CC(=O)Nc2cccc(Br)c2)cc1 ZINC000539040084 938778073 /nfs/dbraw/zinc/77/80/73/938778073.db2.gz CDCYOPMFFAFGFG-KUHUBIRLSA-N 0 3 405.336 4.052 20 0 HIADHN CC[C@H](N[C@H](C)c1cc(OC)c(OC)cc1F)[C@H](c1ccc(C)cc1)n1cncn1 ZINC000539039430 938778307 /nfs/dbraw/zinc/77/83/07/938778307.db2.gz AWMCXZJQTDFKQK-CGYQNGNCSA-N 0 3 412.509 4.462 20 0 HIADHN O=S(=O)(Cc1ccccc1CN[C@H]1CCc2c1cccc2Cl)N1CCCC1 ZINC000539041733 938778662 /nfs/dbraw/zinc/77/86/62/938778662.db2.gz QBMKYGWWHVPYKW-NRFANRHFSA-N 0 3 404.963 4.043 20 0 HIADHN COCCOc1ccc([C@H](C)N[C@@H]2CC(=O)N(C)[C@@H]2c2ccc(Cl)c(F)c2)cc1 ZINC000539042322 938778776 /nfs/dbraw/zinc/77/87/76/938778776.db2.gz FFLMZUXBIYYZHQ-UPNLOYSTSA-N 0 3 420.912 4.127 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(-n2ccnn2)cc1)c1ccc(S(=O)(=O)C2CCCC2)cc1 ZINC000539043756 938780259 /nfs/dbraw/zinc/78/02/59/938780259.db2.gz QIXWOCZQQXSQOH-ZWKOTPCHSA-N 0 3 424.570 4.395 20 0 HIADHN Cc1c([C@@H](C)N[C@H](C)Cn2ncc3ccccc3c2=O)cnn1-c1cccc(Cl)c1 ZINC000539044990 938780866 /nfs/dbraw/zinc/78/08/66/938780866.db2.gz XMGDJLLESGBBTL-HZPDHXFCSA-N 0 3 421.932 4.283 20 0 HIADHN C[C@@H](NC[C@H](C)c1nc(-c2ccccc2)no1)c1ccc(-n2cncn2)cc1Cl ZINC000539052054 938784206 /nfs/dbraw/zinc/78/42/06/938784206.db2.gz DUIHWIADVQTJAM-LSDHHAIUSA-N 0 3 408.893 4.425 20 0 HIADHN CC[C@H](NCc1nnc(-c2ccc(Br)cc2)[nH]1)c1cccc(OC)c1 ZINC000539054198 938784855 /nfs/dbraw/zinc/78/48/55/938784855.db2.gz DULJBVNFHSSVRX-KRWDZBQOSA-N 0 3 401.308 4.484 20 0 HIADHN CC[C@H]([NH2+]Cc1nnc(-c2ccc(Br)cc2)[n-]1)c1cccc(OC)c1 ZINC000539054198 938784861 /nfs/dbraw/zinc/78/48/61/938784861.db2.gz DULJBVNFHSSVRX-KRWDZBQOSA-N 0 3 401.308 4.484 20 0 HIADHN CCN(CC)C(=O)Nc1ccc([C@H](C)NCc2nc(-c3ccc(F)cc3)n[nH]2)cc1 ZINC000539056497 938785760 /nfs/dbraw/zinc/78/57/60/938785760.db2.gz NLIKMYLPZXDIAQ-HNNXBMFYSA-N 0 3 410.497 4.335 20 0 HIADHN CCN(CC)C(=O)Nc1ccc([C@H](C)[NH2+]Cc2nnc(-c3ccc(F)cc3)[n-]2)cc1 ZINC000539056497 938785768 /nfs/dbraw/zinc/78/57/68/938785768.db2.gz NLIKMYLPZXDIAQ-HNNXBMFYSA-N 0 3 410.497 4.335 20 0 HIADHN O[C@H](CN[C@H]1CCSc2c(F)cccc21)COc1ccccc1Br ZINC000539060316 938787652 /nfs/dbraw/zinc/78/76/52/938787652.db2.gz UBNMBELQVHFSDW-WBMJQRKESA-N 0 3 412.324 4.155 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)N[C@@H](CO)c2cccc(Br)c2)cc1 ZINC000539066547 938790520 /nfs/dbraw/zinc/79/05/20/938790520.db2.gz OPHANUWVAKCYNI-XOBRGWDASA-N 0 3 400.320 4.327 20 0 HIADHN C[C@@H](NCc1ccccc1OCc1ccccc1)c1ccc(NS(C)(=O)=O)cc1 ZINC000539066926 938791392 /nfs/dbraw/zinc/79/13/92/938791392.db2.gz MKQWISXULHZXGN-GOSISDBHSA-N 0 3 410.539 4.488 20 0 HIADHN CCC[C@H](NCc1ccc(S(=O)(=O)N(CC)CC)cc1)c1ccc(OC)cc1 ZINC000539073076 938793956 /nfs/dbraw/zinc/79/39/56/938793956.db2.gz XQOJKKCJTFZCBC-QFIPXVFZSA-N 0 3 404.576 4.357 20 0 HIADHN CC(C)(C)CC(=O)N1CCC(N[C@@H](C(=O)Nc2ccccc2)c2ccccc2)CC1 ZINC000539074789 938794746 /nfs/dbraw/zinc/79/47/46/938794746.db2.gz DCXDFNBILQYVDW-HSZRJFAPSA-N 0 3 407.558 4.383 20 0 HIADHN CCc1cc(N2CCC[C@H](N[C@H](COC)c3cccc(C(F)(F)F)c3)C2)ncn1 ZINC000539079012 938796843 /nfs/dbraw/zinc/79/68/43/938796843.db2.gz QHEXXKQWMNMBLP-RBUKOAKNSA-N 0 3 408.468 4.004 20 0 HIADHN Cc1c([C@@H](C)NCCNC(=O)c2c(F)cccc2F)cnn1-c1cc(C)ccc1C ZINC000539078603 938797006 /nfs/dbraw/zinc/79/70/06/938797006.db2.gz HVBMMKODPPJWEC-MRXNPFEDSA-N 0 3 412.484 4.156 20 0 HIADHN CC[C@H](N[C@@H]1CCN(c2cc(OC)cc(OC)c2)C1=O)c1ccc(OC(F)F)cc1 ZINC000539088537 938800189 /nfs/dbraw/zinc/80/01/89/938800189.db2.gz VAYOMLHCEJABOS-VQTJNVASSA-N 0 3 420.456 4.151 20 0 HIADHN COc1cc([C@H](C)NCCOc2cccc(Cl)c2Cl)ccc1S(C)(=O)=O ZINC000539090903 938800985 /nfs/dbraw/zinc/80/09/85/938800985.db2.gz DCCHEAGXGHRILN-LBPRGKRZSA-N 0 3 418.342 4.135 20 0 HIADHN O=c1c2ccccc2ncn1CCN1CCC(c2ccc(C(F)(F)F)cc2)CC1 ZINC000539096757 938802322 /nfs/dbraw/zinc/80/23/22/938802322.db2.gz BJVCWNPDPDNDOZ-UHFFFAOYSA-N 0 3 401.432 4.295 20 0 HIADHN CC[C@@H](C(=O)N1CCC(NCc2ccn(-c3ccccc3)n2)CC1)c1ccccc1 ZINC000539103813 938803521 /nfs/dbraw/zinc/80/35/21/938803521.db2.gz MCJNJDFRAKXVSF-XMMPIXPASA-N 0 3 402.542 4.147 20 0 HIADHN CCNC(=O)COc1cccc(CN[C@@H]2C[C@@H](C)c3c2cccc3Br)c1 ZINC000539121196 938805945 /nfs/dbraw/zinc/80/59/45/938805945.db2.gz DCDASYOYICOXIH-AUUYWEPGSA-N 0 3 417.347 4.302 20 0 HIADHN CCNC(=O)COc1cccc(CN[C@H]2C[C@@H](C)c3c2cccc3Br)c1 ZINC000539121198 938805984 /nfs/dbraw/zinc/80/59/84/938805984.db2.gz DCDASYOYICOXIH-KUHUBIRLSA-N 0 3 417.347 4.302 20 0 HIADHN CCN1CCCN(C(=O)Nc2ccc(Oc3ccc(C)cc3OC)c(F)c2)CC1 ZINC000539128810 938807692 /nfs/dbraw/zinc/80/76/92/938807692.db2.gz YTZTUEOSWRGHBZ-UHFFFAOYSA-N 0 3 401.482 4.495 20 0 HIADHN CCN1CCCN(C(=O)Nc2ncc(Cc3cccc(Br)c3)s2)CC1 ZINC000539145920 938811017 /nfs/dbraw/zinc/81/10/17/938811017.db2.gz GLAFRFSEHZGVLP-UHFFFAOYSA-N 0 3 423.380 4.056 20 0 HIADHN C[C@H](NC[C@@H](c1cccs1)N1CCOCC1)c1nc2ccc(Cl)cc2n1C ZINC000539162130 938814216 /nfs/dbraw/zinc/81/42/16/938814216.db2.gz VNSZYVOACDVUCO-KSSFIOAISA-N 0 3 404.967 4.012 20 0 HIADHN C[C@@H]1CCCN(S(=O)(=O)c2ccc(CN[C@H](c3ccc(F)cc3)C3CC3)cc2)C1 ZINC000539215544 938819951 /nfs/dbraw/zinc/81/99/51/938819951.db2.gz JXROSDVGEHWMNI-HXOBKFHXSA-N 0 3 416.562 4.487 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc(CN[C@@H](c2ccc(OC)cc2)C(C)C)cc1 ZINC000539214740 938819982 /nfs/dbraw/zinc/81/99/82/938819982.db2.gz AFVXRNIFOBXTTO-JOCHJYFZSA-N 0 3 404.576 4.213 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)CN[C@@H](c1ccc2c(c1)OCCO2)C(C)C ZINC000539242257 938824077 /nfs/dbraw/zinc/82/40/77/938824077.db2.gz ZOARPMSUQHWQHZ-OAQYLSRUSA-N 0 3 404.894 4.045 20 0 HIADHN C[C@@H](NCC(=O)NC1CCN(C(=O)C2CCCCC2)CC1)c1cccc2ccccc21 ZINC000539241797 938824120 /nfs/dbraw/zinc/82/41/20/938824120.db2.gz LPEDRTFEDBXHNP-LJQANCHMSA-N 0 3 421.585 4.178 20 0 HIADHN CC[C@@H](NCC(=O)N1CCC[C@@H]1c1ccc(OC)cc1OC)c1ccc(OC)cc1 ZINC000539241152 938824209 /nfs/dbraw/zinc/82/42/09/938824209.db2.gz AMXJEMOHZIBALD-FGZHOGPDSA-N 0 3 412.530 4.117 20 0 HIADHN CC[C@@H](NCc1ccc(-n2nc(C)cc2C)cc1)c1ccccc1OCC(=O)N(C)C ZINC000539251707 938826010 /nfs/dbraw/zinc/82/60/10/938826010.db2.gz ATKVNAKNRCVHIF-HSZRJFAPSA-N 0 3 420.557 4.197 20 0 HIADHN COc1ccc([C@H](NC2CCN(C(=O)N(C)C)CC2)c2ccccc2Cl)cc1 ZINC000539260369 938828949 /nfs/dbraw/zinc/82/89/49/938828949.db2.gz BFHCDQBZLVJGAS-NRFANRHFSA-N 0 3 401.938 4.174 20 0 HIADHN Cc1ccccc1[C@H](CC(C)C)NCC(=O)N1CCC(C(=O)NCCC(C)C)CC1 ZINC000539261683 938829164 /nfs/dbraw/zinc/82/91/64/938829164.db2.gz SLZJGLLICNJWHK-QHCPKHFHSA-N 0 3 415.622 4.073 20 0 HIADHN C[C@@H](NCC(=O)Nc1ccc2c(c1)OC1(CCCC1)O2)c1ccccc1-n1cccn1 ZINC000539263552 938829516 /nfs/dbraw/zinc/82/95/16/938829516.db2.gz YILHXRPNFZGRHF-QGZVFWFLSA-N 0 3 418.497 4.203 20 0 HIADHN O=S(=O)(CCN[C@@H](c1ccc(Br)cc1)C1CCC1)c1ccccc1 ZINC000539278577 938832147 /nfs/dbraw/zinc/83/21/47/938832147.db2.gz CMPZGEAQSDWSRM-LJQANCHMSA-N 0 3 408.361 4.354 20 0 HIADHN COc1cc(NC(=O)CN[C@H](CC(C)(C)C)c2ccccc2)cc(OC)c1OC ZINC000539279855 938832840 /nfs/dbraw/zinc/83/28/40/938832840.db2.gz BUTHKZJGJMZAPD-GOSISDBHSA-N 0 3 400.519 4.418 20 0 HIADHN O=C(CN[C@@H](c1ccccc1)[C@H]1CCOC1)Nc1ccc2c(c1)OC1(CCCCC1)O2 ZINC000539288767 938834072 /nfs/dbraw/zinc/83/40/72/938834072.db2.gz FDWVDSSQSWOCOO-CYFREDJKSA-N 0 3 422.525 4.424 20 0 HIADHN C[C@@H](NCC(=O)N(Cc1cccc(F)c1)C(C)(C)C)c1cccc(-n2cccn2)c1 ZINC000539289887 938834403 /nfs/dbraw/zinc/83/44/03/938834403.db2.gz SGCFEEGXZLJKLW-GOSISDBHSA-N 0 3 408.521 4.489 20 0 HIADHN CN(Cc1cc(Cl)cc(Cl)c1)C(=O)CN[C@H](c1ccccc1)[C@H]1CCOC1 ZINC000539290057 938834445 /nfs/dbraw/zinc/83/44/45/938834445.db2.gz UNQIYTAOVAPCCC-LAUBAEHRSA-N 0 3 407.341 4.319 20 0 HIADHN Cc1ccccc1NC(=O)[C@@H](C)N[C@H](C)c1ccc(NC(=O)c2ccncc2)cc1 ZINC000539297326 938835977 /nfs/dbraw/zinc/83/59/77/938835977.db2.gz QSJJLBDMHRHBCA-QZTJIDSGSA-N 0 3 402.498 4.320 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)N[C@@H]1CCO[C@@H]1c1ccc(Cl)cc1 ZINC000539299897 938836478 /nfs/dbraw/zinc/83/64/78/938836478.db2.gz VFXWIGQMXPUBRM-YPAWHYETSA-N 0 3 413.949 4.306 20 0 HIADHN CSc1cccc(NC(=O)NCCCN2CCN(C)C[C@@H]2c2ccccc2)c1C ZINC000539304877 938837729 /nfs/dbraw/zinc/83/77/29/938837729.db2.gz QRUBCROAALXDAO-OAQYLSRUSA-N 0 3 412.603 4.217 20 0 HIADHN O=S(=O)(c1ccc(CN[C@@H]2CCCc3cc(F)ccc32)cc1)N1CCCCC1 ZINC000539311198 938839044 /nfs/dbraw/zinc/83/90/44/938839044.db2.gz FZWYJBMEZARWBK-JOCHJYFZSA-N 0 3 402.535 4.168 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)N[C@H]1CCOc2ccccc21)c1ccc(-c2cccnc2)cc1 ZINC000539332287 938843284 /nfs/dbraw/zinc/84/32/84/938843284.db2.gz OYMFYBPVIPPLTL-STSQHVNTSA-N 0 3 401.510 4.428 20 0 HIADHN COc1cc(NC(=O)CN[C@@H](C[C@@H]2CCOC2)c2ccccc2)c(OC)cc1Cl ZINC000539334511 938843485 /nfs/dbraw/zinc/84/34/85/938843485.db2.gz ZMTVDHPFIFDOHW-YJBOKZPZSA-N 0 3 418.921 4.053 20 0 HIADHN C[C@@H](NCC(=O)N1CC[C@@H](C)Sc2ccccc21)c1ccc(-n2cccn2)cc1 ZINC000539338064 938844378 /nfs/dbraw/zinc/84/43/78/938844378.db2.gz ZJVXFQSVYBKJTD-QZTJIDSGSA-N 0 3 406.555 4.440 20 0 HIADHN C[C@@H](NCC(=O)N1CC[C@H](C)Sc2ccccc21)c1ccc(-n2cccn2)cc1 ZINC000539338066 938844746 /nfs/dbraw/zinc/84/47/46/938844746.db2.gz ZJVXFQSVYBKJTD-ZWKOTPCHSA-N 0 3 406.555 4.440 20 0 HIADHN CC(=O)c1cccc(OC[C@H](O)CN[C@@H](Cc2ccccc2)c2ccccc2F)c1 ZINC000539360911 938848448 /nfs/dbraw/zinc/84/84/48/938848448.db2.gz XWKJBLDINGZOMD-BWKNWUBXSA-N 0 3 407.485 4.342 20 0 HIADHN COc1cc(NC(=O)CN[C@H](c2ccc(Cl)cc2)[C@H]2C[C@H]2C)cc(OC)c1OC ZINC000539421182 938857819 /nfs/dbraw/zinc/85/78/19/938857819.db2.gz DIUSVRVYVQDCPI-GQNMWPQZSA-N 0 3 418.921 4.291 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)CN[C@@H](COc2c(C)cccc2C)C(C)(C)C)cc1 ZINC000539422533 938858177 /nfs/dbraw/zinc/85/81/77/938858177.db2.gz RMYKYEVYTPWRPV-NRFANRHFSA-N 0 3 411.546 4.284 20 0 HIADHN COc1ccc([C@H](NCC(=O)N[C@H](c2nccs2)c2ccccc2)C2CC2)cc1 ZINC000539491740 938867875 /nfs/dbraw/zinc/86/78/75/938867875.db2.gz ZBFYPLPYGBQBBC-YADHBBJMSA-N 0 3 407.539 4.098 20 0 HIADHN CCOC(=O)COc1ccc(CN[C@@H]2CCc3c2cccc3Br)cc1 ZINC000539504019 938869787 /nfs/dbraw/zinc/86/97/87/938869787.db2.gz ODWSJPKVKADYDV-LJQANCHMSA-N 0 3 404.304 4.168 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@H](C)N[C@@H](C)[C@H](OC)c2ccccc2F)cc1 ZINC000539507077 938870345 /nfs/dbraw/zinc/87/03/45/938870345.db2.gz QYFYQUWLPIHNGL-HOIFWPIMSA-N 0 3 422.566 4.283 20 0 HIADHN COc1cccc(COCCNCC2=Cc3cc(Br)ccc3OC2)c1 ZINC000539528178 938873670 /nfs/dbraw/zinc/87/36/70/938873670.db2.gz HHFORICZWDMQJF-UHFFFAOYSA-N 0 3 404.304 4.040 20 0 HIADHN C[C@]1(CCCO)CCCN1CC(=O)N[C@H](c1ccccc1)c1cccc(Cl)c1 ZINC000539613618 938888024 /nfs/dbraw/zinc/88/80/24/938888024.db2.gz FOELGONGJJCKMT-DHIUTWEWSA-N 0 3 400.950 4.173 20 0 HIADHN CCN1CCN(c2ccccc2N[C@@H](C)c2ccc(OCCOC)c(OC)c2)CC1 ZINC000539646729 938893316 /nfs/dbraw/zinc/89/33/16/938893316.db2.gz DHDWDQIAADECJQ-IBGZPJMESA-N 0 3 413.562 4.035 20 0 HIADHN OC[C@H]1C=C[C@@H](NCc2cn(-c3ccccc3)nc2-c2ccc(Br)cc2)C1 ZINC000539709031 938908120 /nfs/dbraw/zinc/90/81/20/938908120.db2.gz WOWMHNXPJRJKOO-OXJNMPFZSA-N 0 3 424.342 4.328 20 0 HIADHN COc1cc(CN[C@@H]2C=C[C@H](CO)C2)cc(Br)c1OCc1ccccc1 ZINC000539710362 938908683 /nfs/dbraw/zinc/90/86/83/938908683.db2.gz PCAXPTYEOXERLI-FUHWJXTLSA-N 0 3 418.331 4.063 20 0 HIADHN CSc1ccccc1CC(=O)NC1CCN(CCOc2ccc(Cl)cc2)CC1 ZINC000539722457 938913109 /nfs/dbraw/zinc/91/31/09/938913109.db2.gz OCLUVNUAFCXQAX-UHFFFAOYSA-N 0 3 418.990 4.264 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N(C)Cc2cc(F)c(F)c(F)c2)N2CCCC2)cc1 ZINC000539730664 938915206 /nfs/dbraw/zinc/91/52/06/938915206.db2.gz CZFMOILFWPAOQI-FQEVSTJZSA-N 0 3 405.464 4.391 20 0 HIADHN O=C(c1ccc(Cn2ccnc2)cc1)N1CCC[C@@H](c2n[nH]c(C3CCCCC3)n2)C1 ZINC000539752971 938921403 /nfs/dbraw/zinc/92/14/03/938921403.db2.gz LSSCQKOEFDTHLR-OAQYLSRUSA-N 0 3 418.545 4.117 20 0 HIADHN COc1cccc(CN(Cc2cnn(Cc3ccccc3)c2)C2CCC(O)CC2)c1 ZINC000539816506 938941370 /nfs/dbraw/zinc/94/13/70/938941370.db2.gz UGXGGWSOZDVBLZ-UHFFFAOYSA-N 0 3 405.542 4.246 20 0 HIADHN CNC(=O)CC1CCN(Cc2cn(-c3ccccc3)nc2-c2ccccc2C)CC1 ZINC000539817779 938941970 /nfs/dbraw/zinc/94/19/70/938941970.db2.gz AEWOKEAGMYLPLR-UHFFFAOYSA-N 0 3 402.542 4.196 20 0 HIADHN Cc1nn(-c2ccc(F)cc2F)c(C)c1CN1CCC[C@@H](CNC(=O)C(C)(C)C)C1 ZINC000539833223 938952381 /nfs/dbraw/zinc/95/23/81/938952381.db2.gz QASPXEKVRWINGB-KRWDZBQOSA-N 0 3 418.532 4.142 20 0 HIADHN CC(C)(C)OC(=O)[C@@H]1CCN(Cc2cn(Cc3ccccc3)nc2-c2cccnc2)C1 ZINC000539850857 938957666 /nfs/dbraw/zinc/95/76/66/938957666.db2.gz QEERZBDOLURASZ-OAQYLSRUSA-N 0 3 418.541 4.157 20 0 HIADHN COC(=O)CCn1nc(C)c(CN2CCC[C@H](COc3ccccc3Cl)C2)c1C ZINC000539863739 938961373 /nfs/dbraw/zinc/96/13/73/938961373.db2.gz PELRUVZSIDTWQR-SFHVURJKSA-N 0 3 419.953 4.007 20 0 HIADHN CC[C@@H]1CN(Cc2ccc(OCCOc3ccccc3Cl)c(OC)c2)C[C@H]1O ZINC000539897649 938971249 /nfs/dbraw/zinc/97/12/49/938971249.db2.gz UVASEBNFLSTWGQ-IEBWSBKVSA-N 0 3 405.922 4.009 20 0 HIADHN COc1cc(OC)cc(Oc2ccc(CN3CCS[C@H]4COCC[C@H]43)cc2)c1 ZINC000539911527 938977125 /nfs/dbraw/zinc/97/71/25/938977125.db2.gz NIDHNQVOOKICTQ-YADHBBJMSA-N 0 3 401.528 4.202 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)c2ccc(Oc3cccnc3)cc2)cc1 ZINC000539931262 938978830 /nfs/dbraw/zinc/97/88/30/938978830.db2.gz HZGXKOXEOOQDED-XMMPIXPASA-N 0 3 417.509 4.449 20 0 HIADHN CN1CCN(c2cccc(Cl)c2CNCc2ccc(OC3CCCC3)nc2)CC1 ZINC000539953683 938981004 /nfs/dbraw/zinc/98/10/04/938981004.db2.gz OUUUPNGVVTTZRL-UHFFFAOYSA-N 0 3 414.981 4.098 20 0 HIADHN COCCn1cc2c(n1)[C@H](N[C@H](C)Cc1ccc(F)cc1Br)CCC2 ZINC000563613963 945226140 /nfs/dbraw/zinc/22/61/40/945226140.db2.gz PLGSIQMDBYACDC-FZKQIMNGSA-N 0 3 410.331 4.029 20 0 HIADHN C[C@H](CC(=O)Nc1cccc(Cl)c1)N[C@H](CO)c1ccc(Br)cc1 ZINC000540142025 939088696 /nfs/dbraw/zinc/08/86/96/939088696.db2.gz XJXFFYWLBSENKP-SJKOYZFVSA-N 0 3 411.727 4.143 20 0 HIADHN C[C@@H](CC(=O)Nc1cccc(Cl)c1)N[C@@H](CO)c1ccc(Br)cc1 ZINC000540142024 939088834 /nfs/dbraw/zinc/08/88/34/939088834.db2.gz XJXFFYWLBSENKP-SJCJKPOMSA-N 0 3 411.727 4.143 20 0 HIADHN COc1ccc([C@H](Cc2ccncc2)NCc2ccnc(OC3CCOCC3)c2)cc1 ZINC000563631319 945226514 /nfs/dbraw/zinc/22/65/14/945226514.db2.gz RYQQBEXTLYHQOI-DEOSSOPVSA-N 0 3 419.525 4.117 20 0 HIADHN COc1ccc([C@H](C)NCc2ccc(COC3CCOCC3)cc2)cc1NC(C)=O ZINC000540148206 939091773 /nfs/dbraw/zinc/09/17/73/939091773.db2.gz WHWRNNMNDMUZAO-KRWDZBQOSA-N 0 3 412.530 4.200 20 0 HIADHN CCC[C@H](NC[C@@H](O)CS(=O)(=O)c1cccs1)c1ccc(Cl)c(Cl)c1 ZINC000540149574 939092033 /nfs/dbraw/zinc/09/20/33/939092033.db2.gz VZHABCNYUMAPDW-CJNGLKHVSA-N 0 3 422.399 4.321 20 0 HIADHN C[C@H](COc1ccc2cc(Br)ccc2c1)N[C@H](CO)CC(F)(F)F ZINC000540154823 939094058 /nfs/dbraw/zinc/09/40/58/939094058.db2.gz ZJLKEDWLJXHISE-ABAIWWIYSA-N 0 3 406.242 4.273 20 0 HIADHN C[C@@H](NCCOc1ccc(Cl)cn1)c1ccc(S(=O)(=O)C2CCCC2)cc1 ZINC000540164669 939098246 /nfs/dbraw/zinc/09/82/46/939098246.db2.gz KVNWIBUAVBACDN-OAHLLOKOSA-N 0 3 408.951 4.181 20 0 HIADHN COCCNS(=O)(=O)c1ccc(CN[C@H](CC(C)C)c2ccc(Cl)cc2)cc1 ZINC000540166836 939099473 /nfs/dbraw/zinc/09/94/73/939099473.db2.gz RRQPKRYWIKHEMC-OAQYLSRUSA-N 0 3 424.994 4.142 20 0 HIADHN Cc1cccc(COc2ccc([C@@H](C)N[C@H]3CCN(CC(F)(F)F)C3=O)cc2)c1 ZINC000540173216 939103564 /nfs/dbraw/zinc/10/35/64/939103564.db2.gz AQKDNLLLBFYUMQ-UZLBHIALSA-N 0 3 406.448 4.388 20 0 HIADHN COc1ccc(CN2CC[C@@H](N[C@@H](C)c3ccc4cc(OC)ccc4c3)C2=O)cc1 ZINC000540181155 939108562 /nfs/dbraw/zinc/10/85/62/939108562.db2.gz FGNPHJMYLWSBIR-BXKMTCNYSA-N 0 3 404.510 4.309 20 0 HIADHN C[C@H]1C[C@H](NCCNC(=O)c2cccc(Br)c2)c2ccsc2S1 ZINC000540182039 939108864 /nfs/dbraw/zinc/10/88/64/939108864.db2.gz KLGWJMGYBDHRQU-NHYWBVRUSA-N 0 3 411.390 4.456 20 0 HIADHN COc1cc([C@@H](C)NCCOc2cccc(C(C)(C)C)c2)ccc1S(C)(=O)=O ZINC000540183708 939109847 /nfs/dbraw/zinc/10/98/47/939109847.db2.gz SPNDKUCPOLAZGW-MRXNPFEDSA-N 0 3 405.560 4.126 20 0 HIADHN CCSc1ccc([C@@H](C)NCc2ccc(OCC(=O)N(C)C)c(OC)c2)cc1 ZINC000540187749 939112087 /nfs/dbraw/zinc/11/20/87/939112087.db2.gz DAAGIAIYBQZAJA-MRXNPFEDSA-N 0 3 402.560 4.125 20 0 HIADHN COc1cccc([C@H](NC2CCN(c3cnccn3)CC2)c2ccccc2Cl)c1 ZINC000540188520 939113245 /nfs/dbraw/zinc/11/32/45/939113245.db2.gz LPVKSUXIRLXAJM-QHCPKHFHSA-N 0 3 408.933 4.487 20 0 HIADHN O=C(NCc1ccco1)c1cccc(CN[C@H](C[C@@H]2CCOC2)c2ccccc2)c1 ZINC000540190238 939113944 /nfs/dbraw/zinc/11/39/44/939113944.db2.gz HUDGNVIVLHYMJG-GBXCKJPGSA-N 0 3 404.510 4.467 20 0 HIADHN COc1ccc2c(c1)CCC[C@@H]2NCc1ccc(C(=O)N2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000540191441 939116234 /nfs/dbraw/zinc/11/62/34/939116234.db2.gz OAUFKTRRLOXLPV-RHGYRFJNSA-N 0 3 408.542 4.112 20 0 HIADHN CCN1CC[C@@H](NCc2cc(OC)c(OC)cc2OC)[C@H]1c1ccc(Cl)c(F)c1 ZINC000540203537 939125226 /nfs/dbraw/zinc/12/52/26/939125226.db2.gz JAIKSUDODIVCHR-XMSQKQJNSA-N 0 3 422.928 4.430 20 0 HIADHN C[C@H](CNC(=O)c1ccc(Sc2ccc(Cl)cc2)cc1)CN1CCN(C)CC1 ZINC000540220127 939136307 /nfs/dbraw/zinc/13/63/07/939136307.db2.gz KDKZOIAAQCJLAM-QGZVFWFLSA-N 0 3 418.006 4.105 20 0 HIADHN CCOc1ccccc1NC(=O)[C@H](NCCCc1c(C)nn(C)c1C)c1ccccc1 ZINC000540339741 939199572 /nfs/dbraw/zinc/19/95/72/939199572.db2.gz XILSQUVZVAXIGN-XMMPIXPASA-N 0 3 420.557 4.338 20 0 HIADHN CC(C)[C@H](NCC(=O)N(C)[C@H](C)c1ccc(F)c(F)c1)c1ccc2c(c1)OCCO2 ZINC000540341722 939200258 /nfs/dbraw/zinc/20/02/58/939200258.db2.gz RWKSACNVLHCZDZ-CMJOXMDJSA-N 0 3 418.484 4.242 20 0 HIADHN C[C@@H](NCCc1nc2ccccc2n1C)c1cc2c(cc1Br)OCCO2 ZINC000540375304 939215249 /nfs/dbraw/zinc/21/52/49/939215249.db2.gz AUDFUTGJQQDYGV-CYBMUJFWSA-N 0 3 416.319 4.000 20 0 HIADHN CC[C@@H](C)[C@H](NCC(=O)Nc1ccc(C(=O)N(C)C)cc1)c1ccc(Cl)cc1 ZINC000540387295 939223632 /nfs/dbraw/zinc/22/36/32/939223632.db2.gz VQABBSOWEUVAEC-VFNWGFHPSA-N 0 3 401.938 4.357 20 0 HIADHN O=C(CN[C@@H](c1ccccc1)[C@H]1CCOC1)Nc1cc(C2CC2)nn1-c1ccccc1 ZINC000540389553 939227091 /nfs/dbraw/zinc/22/70/91/939227091.db2.gz OEWMQPLDNPMQRX-CPJSRVTESA-N 0 3 416.525 4.056 20 0 HIADHN CN(Cc1ccc(Cl)c(Cl)c1)C(=O)CN[C@@H](c1ccccc1)[C@@H]1CCOC1 ZINC000540395389 939232522 /nfs/dbraw/zinc/23/25/22/939232522.db2.gz UZYZOBJVLXGAOK-UTKZUKDTSA-N 0 3 407.341 4.319 20 0 HIADHN O=C(CN[C@@H](c1cccc(F)c1)C1CCCC1)Nc1cccc(N2CCCC2=O)c1 ZINC000540430207 939246221 /nfs/dbraw/zinc/24/62/21/939246221.db2.gz MJOANVGYGVHAHA-XMMPIXPASA-N 0 3 409.505 4.412 20 0 HIADHN O=C(Nc1cccc(CNC[C@H](O)COc2ccccc2)c1)c1ccc(Cl)cc1 ZINC000540513131 939283603 /nfs/dbraw/zinc/28/36/03/939283603.db2.gz UVDFJBNRZFNHPC-NRFANRHFSA-N 0 3 410.901 4.122 20 0 HIADHN Cc1cc([C@@H](NCC(=O)N2CCC(OCc3ccccc3)CC2)C2CC2)ccc1F ZINC000540520912 939285931 /nfs/dbraw/zinc/28/59/31/939285931.db2.gz HQEKBPASCZVEDM-VWLOTQADSA-N 0 3 410.533 4.383 20 0 HIADHN Cc1cc([C@H](N[C@@H](C)C(=O)Nc2cccc(N3CCCC3=O)c2)C2CC2)ccc1F ZINC000540521774 939286637 /nfs/dbraw/zinc/28/66/37/939286637.db2.gz VJEDJZNKBRLNLK-QMHKHESXSA-N 0 3 409.505 4.329 20 0 HIADHN CSc1ccc(C)c(NC(=O)NCCCN2CCN(Cc3ccccc3)CC2)c1 ZINC000540523465 939287471 /nfs/dbraw/zinc/28/74/71/939287471.db2.gz POBRBCPUPPTEKW-UHFFFAOYSA-N 0 3 412.603 4.046 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)N[C@@H]1CCCOc2c(Cl)cccc21 ZINC000540569807 939307642 /nfs/dbraw/zinc/30/76/42/939307642.db2.gz WQCYMLVIDUBSJP-GOSISDBHSA-N 0 3 407.967 4.389 20 0 HIADHN COc1ccc([C@@H](NCC(=O)Nc2ccc3[nH]c(C(F)(F)F)nc3c2)C2CC2)cc1 ZINC000540588882 939312330 /nfs/dbraw/zinc/31/23/30/939312330.db2.gz LDVCWCSTVVEYOG-IBGZPJMESA-N 0 3 418.419 4.270 20 0 HIADHN Cc1cc(I)ccc1NC(=O)CN[C@H](c1ccccc1)C1CC1 ZINC000540589936 939313056 /nfs/dbraw/zinc/31/30/56/939313056.db2.gz PQBSDHAOADRNHF-LJQANCHMSA-N 0 3 420.294 4.279 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2CNCc2ccc(-n3cncn3)cc2)o1 ZINC000540629499 939323954 /nfs/dbraw/zinc/32/39/54/939323954.db2.gz VLEASLYOXCRDQX-UHFFFAOYSA-N 0 3 410.481 4.311 20 0 HIADHN CC(C)[C@H](NCc1ccc(C(=O)N2CCN(C)CC2)cc1)c1cc2ccccc2o1 ZINC000540651212 939331286 /nfs/dbraw/zinc/33/12/86/939331286.db2.gz PERSZLZDAIBKHB-DEOSSOPVSA-N 0 3 405.542 4.307 20 0 HIADHN COc1ccc(-c2nc3c(s2)[C@@H](N[C@H](C)C(=O)NCc2ccccc2)CCC3)cc1 ZINC000540727928 939350223 /nfs/dbraw/zinc/35/02/23/939350223.db2.gz SXXXJJWIXIHFAH-UZLBHIALSA-N 0 3 421.566 4.491 20 0 HIADHN C[C@@H](Nc1cccc(CN2CCSCC2)c1)[C@H](c1ccccc1)N1CCOCC1 ZINC000540787122 939372026 /nfs/dbraw/zinc/37/20/26/939372026.db2.gz CCZIQYUOYYDSPI-HYBUGGRVSA-N 0 3 411.615 4.109 20 0 HIADHN CN(CCNC(=O)Nc1ccc2nc(-c3ccccn3)oc2c1)Cc1ccccc1 ZINC000540825353 939385419 /nfs/dbraw/zinc/38/54/19/939385419.db2.gz ZQFMNBXTYUGEKQ-UHFFFAOYSA-N 0 3 401.470 4.143 20 0 HIADHN COc1cc(C)c(CN2CCC[C@@H](c3nnc4ccc(C(F)(F)F)cn43)C2)c(C)n1 ZINC000540998788 939428336 /nfs/dbraw/zinc/42/83/36/939428336.db2.gz JJVZXBDAECDINT-OAHLLOKOSA-N 0 3 419.451 4.148 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)N[C@@H](C)C(=O)N2CCSc3ccccc32)cc1 ZINC000541022950 939432660 /nfs/dbraw/zinc/43/26/60/939432660.db2.gz IYNWCMWLWPRRHK-SJORKVTESA-N 0 3 406.555 4.359 20 0 HIADHN COc1ccc([C@@H](NC(=O)CN[C@@H](C)c2ccc(-n3ccnc3C)cc2)C2CC2)cc1 ZINC000541027275 939435276 /nfs/dbraw/zinc/43/52/76/939435276.db2.gz YMZVSIYUSKMKGY-GKVSMKOHSA-N 0 3 418.541 4.107 20 0 HIADHN CN(C)[C@H](CNC(=O)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1)c1ccccc1 ZINC000541034918 939437498 /nfs/dbraw/zinc/43/74/98/939437498.db2.gz OQXSJUBDFPMZTE-WOJBJXKFSA-N 0 3 421.463 4.091 20 0 HIADHN CC(C)N(CCN(C)C)C(=O)Nc1ccc(C(=O)N2CCC[C@H]2c2ccccc2)cc1 ZINC000541042024 939439236 /nfs/dbraw/zinc/43/92/36/939439236.db2.gz IXEVUNLTWMJKKW-QHCPKHFHSA-N 0 3 422.573 4.468 20 0 HIADHN CCc1ccc([C@@H](C)NC(=O)[C@H](C)N2CCC(CCC(=O)N(CC)CC)CC2)cc1 ZINC000541120642 939467409 /nfs/dbraw/zinc/46/74/09/939467409.db2.gz RTIDJKFFHVKEEM-UXHICEINSA-N 0 3 415.622 4.175 20 0 HIADHN COc1ccc([C@@H](NCCCc2ccsc2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000541168595 939483987 /nfs/dbraw/zinc/48/39/87/939483987.db2.gz RBLXIKVZFCJTMF-JOCHJYFZSA-N 0 3 415.580 4.472 20 0 HIADHN CC[C@@H](N[C@@H](CC)c1cccc(S(N)(=O)=O)c1)c1ccc(Br)cc1 ZINC000541204624 939485488 /nfs/dbraw/zinc/48/54/88/939485488.db2.gz AKVGWDZWXQFJPR-MSOLQXFVSA-N 0 3 411.365 4.289 20 0 HIADHN COC(=O)COc1ccc(CNCc2ccc(-c3ccc4c(c3)CCO4)cc2)cc1 ZINC000541206923 939485581 /nfs/dbraw/zinc/48/55/81/939485581.db2.gz FIGMXVUCCUVOIL-UHFFFAOYSA-N 0 3 403.478 4.130 20 0 HIADHN CC(C)OC(=O)C1(C(=O)OC(C)C)CC(N[C@@H](c2ccc(F)cc2)C2CCC2)C1 ZINC000541216881 939486096 /nfs/dbraw/zinc/48/60/96/939486096.db2.gz YFEYCRRMIVBKLK-HXUWFJFHSA-N 0 3 405.510 4.309 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)N1CCCC[C@@H]1c1ccccc1 ZINC000541320382 939490787 /nfs/dbraw/zinc/49/07/87/939490787.db2.gz WFXQLHBFHCSDIO-XMMPIXPASA-N 0 3 407.558 4.080 20 0 HIADHN COc1ccc(C(=O)NC2CCN([C@@H](C)c3ccncc3)CC2)cc1OC1CCCC1 ZINC000541514096 939541634 /nfs/dbraw/zinc/54/16/34/939541634.db2.gz FOJOSCOQXNHRLN-SFHVURJKSA-N 0 3 423.557 4.367 20 0 HIADHN CN(C(=O)C(C)(C)Cc1nc2ccccc2[nH]1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000541539296 939547062 /nfs/dbraw/zinc/54/70/62/939547062.db2.gz FRFXFHDPQNYOAK-HXUWFJFHSA-N 0 3 404.558 4.255 20 0 HIADHN Cc1ccccc1[C@@H](CN1CCOCC1)NCc1ccc(NC(=O)c2ccco2)cc1 ZINC000541552760 939553846 /nfs/dbraw/zinc/55/38/46/939553846.db2.gz SKLNJSTUXKILAA-HSZRJFAPSA-N 0 3 419.525 4.003 20 0 HIADHN O=C(NC1CCCCC1)N1CCC(N[C@@H](c2ccc(F)cc2)c2cccnc2)CC1 ZINC000541565695 939556517 /nfs/dbraw/zinc/55/65/17/939556517.db2.gz RILMNIPPNKYOCO-QHCPKHFHSA-N 0 3 410.537 4.406 20 0 HIADHN CC(C)NS(=O)(=O)Cc1ccccc1CN[C@H](C)c1ccc(OC(C)C)cc1 ZINC000563702411 945258485 /nfs/dbraw/zinc/25/84/85/945258485.db2.gz JTKBCYWLDBVYRR-GOSISDBHSA-N 0 3 404.576 4.152 20 0 HIADHN COc1ccc(C2(C(=O)NCC(C)(C)N3CCc4ccccc4C3)CCC2)cc1OC ZINC000541680200 939599455 /nfs/dbraw/zinc/59/94/55/939599455.db2.gz YAAKHLQIJGGNEH-UHFFFAOYSA-N 0 3 422.569 4.079 20 0 HIADHN C[C@H](NCC(=O)N(Cc1ccc(C(F)(F)F)cc1)C1CC1)[C@@H]1COc2ccccc21 ZINC000541699233 939608009 /nfs/dbraw/zinc/60/80/09/939608009.db2.gz BTZZGUZDZAJIIB-YWZLYKJASA-N 0 3 418.459 4.351 20 0 HIADHN COc1ccc(-c2nc(NC(=O)CN[C@H](C)[C@H]3COc4ccccc43)sc2C)cc1 ZINC000541697916 939608162 /nfs/dbraw/zinc/60/81/62/939608162.db2.gz QJJPFTWQWVXPTJ-AUUYWEPGSA-N 0 3 423.538 4.220 20 0 HIADHN COc1ccccc1[C@H](C)N(C)C(=O)CN(C)[C@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000541700082 939608413 /nfs/dbraw/zinc/60/84/13/939608413.db2.gz SHUGBVXUTVHYAZ-KPDCDPCYSA-N 0 3 414.521 4.206 20 0 HIADHN C[C@H](NCC(=O)NCCC(c1ccccc1)c1ccccc1)[C@@H]1COc2ccccc21 ZINC000541700548 939608428 /nfs/dbraw/zinc/60/84/28/939608428.db2.gz RJXZMCBNVCADDQ-CPJSRVTESA-N 0 3 414.549 4.479 20 0 HIADHN CC(C)Oc1cccc(CNC(=O)CN(C)[C@@H]2CCO[C@@H](c3ccc(F)cc3)C2)c1 ZINC000541700107 939608801 /nfs/dbraw/zinc/60/88/01/939608801.db2.gz TWQMMAROFQNEOM-FYYLOGMGSA-N 0 3 414.521 4.081 20 0 HIADHN CCNC(=O)COc1ccc(CN[C@H]2CCCc3c(Cl)cccc32)cc1OC ZINC000541746357 939619704 /nfs/dbraw/zinc/61/97/04/939619704.db2.gz WGPYTGAKASTYHU-IBGZPJMESA-N 0 3 402.922 4.031 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)Nc1cc(C(C)(C)C)nn1-c1ccccn1 ZINC000541798470 939635347 /nfs/dbraw/zinc/63/53/47/939635347.db2.gz KSMAKEISANRDAS-UHFFFAOYSA-N 0 3 420.561 4.161 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N2CC=C(c3cccc4ccccc43)C2)CC1 ZINC000541812704 939641156 /nfs/dbraw/zinc/64/11/56/939641156.db2.gz LJRHIWUPPIEHGR-UHFFFAOYSA-N 0 3 407.558 4.138 20 0 HIADHN C[C@@H]1CC(N[C@H](c2cccc(S(C)(=O)=O)c2)c2ccc(F)c(F)c2)C[C@@H](C)O1 ZINC000541847743 939646830 /nfs/dbraw/zinc/64/68/30/939646830.db2.gz FJDHFMDPWLDBKW-ZMOMAAQPSA-N 0 3 409.498 4.003 20 0 HIADHN CCOc1ccc(CN2CCC3(C[C@@H]3C(=O)N3CCCCC3)CC2)cc1OCC ZINC000541853497 939647124 /nfs/dbraw/zinc/64/71/24/939647124.db2.gz ATRWQGLMLHLKGK-HXUWFJFHSA-N 0 3 400.563 4.099 20 0 HIADHN CC(C)[C@@H](NCc1cccc(OCCN2CCOCC2)c1)c1ccc(F)c(F)c1 ZINC000541913409 939651790 /nfs/dbraw/zinc/65/17/90/939651790.db2.gz JOPPFPKGECHJPI-HSZRJFAPSA-N 0 3 404.501 4.163 20 0 HIADHN COc1ccc(C[C@H](C)N[C@H](CCO)c2ccccc2Br)cc1OC ZINC000541916517 939652746 /nfs/dbraw/zinc/65/27/46/939652746.db2.gz JDLJERPYQGJYBR-KBXCAEBGSA-N 0 3 408.336 4.111 20 0 HIADHN CC(C)[C@@H](NCc1ccc([C@@]2(C)NC(=O)NC2=O)cc1)c1ccc(Cl)cc1F ZINC000541917240 939653224 /nfs/dbraw/zinc/65/32/24/939653224.db2.gz HETWGXLWDYRUQG-WIYYLYMNSA-N 0 3 403.885 4.021 20 0 HIADHN CC(C)[C@@H](NCc1ccc([C@]2(C)NC(=O)NC2=O)cc1)c1ccc(Cl)cc1F ZINC000541917238 939653342 /nfs/dbraw/zinc/65/33/42/939653342.db2.gz HETWGXLWDYRUQG-NQIIRXRSSA-N 0 3 403.885 4.021 20 0 HIADHN COc1cc(C)c(CN2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)c(C)n1 ZINC000541926699 939656035 /nfs/dbraw/zinc/65/60/35/939656035.db2.gz WCIBDRBJUORDFC-UHFFFAOYSA-N 0 3 405.901 4.350 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)NCC(=O)N(C)[C@@H](C)c2ccc(F)c(F)c2)cc1 ZINC000541956155 939662785 /nfs/dbraw/zinc/66/27/85/939662785.db2.gz SFQHHHRTDGGYGH-HOTGVXAUSA-N 0 3 412.484 4.329 20 0 HIADHN CCN1CC[C@@H](NCc2c[nH]c(-c3ccccc3)n2)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000541992145 939671843 /nfs/dbraw/zinc/67/18/43/939671843.db2.gz PKEQXYFLNKBMPA-CTNGQTDRSA-N 0 3 400.448 4.419 20 0 HIADHN COc1cc(Br)ccc1CCC(=O)Nc1ccc(C)cc1CN(C)C ZINC000542047105 939698861 /nfs/dbraw/zinc/69/88/61/939698861.db2.gz PPGWGKJLQGDCMK-UHFFFAOYSA-N 0 3 405.336 4.399 20 0 HIADHN CC(C)(C)N1CC[C@H](NC(=O)c2[nH]nc3c2CCC3)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000542093659 939709633 /nfs/dbraw/zinc/70/96/33/939709633.db2.gz VGAAZYFNKWEAKU-HKUYNNGSSA-N 0 3 404.917 4.035 20 0 HIADHN COc1ccc(Cl)cc1CN[C@@H](C)CC(=O)Nc1ccc(NC(=O)C2CC2)cc1 ZINC000542152167 939732857 /nfs/dbraw/zinc/73/28/57/939732857.db2.gz JLDOTRZGHTUULN-AWEZNQCLSA-N 0 3 415.921 4.204 20 0 HIADHN C[C@H](N[C@@H]1CCCN(Cc2nccn2C)C1=O)c1ccc(-c2ccccc2F)s1 ZINC000542159660 939737795 /nfs/dbraw/zinc/73/77/95/939737795.db2.gz BTXALVAWXAHUBC-MAUKXSAKSA-N 0 3 412.534 4.130 20 0 HIADHN Cc1nc(COc2ccc(CN3CCC[C@H](n4ccc(C(F)(F)F)n4)C3)cc2)no1 ZINC000542171901 939743296 /nfs/dbraw/zinc/74/32/96/939743296.db2.gz KQFUNHNREPZYFN-INIZCTEOSA-N 0 3 421.423 4.009 20 0 HIADHN Cc1nc(COc2ccc(CN3CCC[C@@H](n4ccc(C(F)(F)F)n4)C3)cc2)no1 ZINC000542171902 939743461 /nfs/dbraw/zinc/74/34/61/939743461.db2.gz KQFUNHNREPZYFN-MRXNPFEDSA-N 0 3 421.423 4.009 20 0 HIADHN CC[C@H](N[C@H]1CCCN(Cc2ccccn2)C1=O)c1ccc(Br)cc1 ZINC000542209633 939757148 /nfs/dbraw/zinc/75/71/48/939757148.db2.gz UVFFMOPDYRIGDP-OALUTQOASA-N 0 3 402.336 4.076 20 0 HIADHN COc1ccc(-c2nc(C)c([C@H](C)N[C@H](Cc3ccc(F)cc3)C(N)=O)s2)cc1 ZINC000542232498 939767662 /nfs/dbraw/zinc/76/76/62/939767662.db2.gz LFNWECRXHVFKTC-ORAYPTAESA-N 0 3 413.518 4.013 20 0 HIADHN O=C(Nc1ccccc1O)C1CCN(CCCc2ccccc2Br)CC1 ZINC000542258984 939774644 /nfs/dbraw/zinc/77/46/44/939774644.db2.gz JVFPPJRWZNMDRV-UHFFFAOYSA-N 0 3 417.347 4.438 20 0 HIADHN C[C@@H](C[S@@](C)=O)NCc1cn(Cc2ccccc2)nc1-c1ccc(Cl)cc1 ZINC000542301845 939791198 /nfs/dbraw/zinc/79/11/98/939791198.db2.gz MQZFMIVPNKSGJF-RKOGDMNLSA-N 0 3 401.963 4.108 20 0 HIADHN Cn1c2ccccc2nc1CCCNCc1cn(-c2ccc(Cl)c(Cl)c2)nn1 ZINC000542304203 939791803 /nfs/dbraw/zinc/79/18/03/939791803.db2.gz LAZGSUDPIYZYAR-UHFFFAOYSA-N 0 3 415.328 4.183 20 0 HIADHN Fc1ccc(-c2noc(CCCNCc3ccc(F)cc3Br)n2)cc1 ZINC000542307579 939793770 /nfs/dbraw/zinc/79/37/70/939793770.db2.gz UWFBIMLSOFFJCD-UHFFFAOYSA-N 0 3 408.246 4.500 20 0 HIADHN O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)[C@H]1CCn2c(cnc2C2CCCCC2)C1 ZINC000542328827 939801495 /nfs/dbraw/zinc/80/14/95/939801495.db2.gz MJIGJKPXGFDTGT-XZOQPEGZSA-N 0 3 420.601 4.274 20 0 HIADHN C[C@H](CN(C)C(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1)c1nccs1 ZINC000542346104 939804423 /nfs/dbraw/zinc/80/44/23/939804423.db2.gz OVUGNYMYNCNODD-BEFAXECRSA-N 0 3 411.493 4.160 20 0 HIADHN C[C@@H](CN(C)C(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1)c1nccs1 ZINC000542346109 939804496 /nfs/dbraw/zinc/80/44/96/939804496.db2.gz OVUGNYMYNCNODD-KXBFYZLASA-N 0 3 411.493 4.160 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)Nc3ccc(-c4ccc[nH]4)cc3)CC2)C[C@H](C)O1 ZINC000542380147 939810872 /nfs/dbraw/zinc/81/08/72/939810872.db2.gz QWKOWFOYLQRJII-OALUTQOASA-N 0 3 410.562 4.425 20 0 HIADHN COc1ccc(C2(C(=O)N3CCCN(Cc4ccccc4)C[C@@H]3C)CCC2)cc1OC ZINC000542509396 939834538 /nfs/dbraw/zinc/83/45/38/939834538.db2.gz ALAXVEAHVDYNGP-FQEVSTJZSA-N 0 3 422.569 4.249 20 0 HIADHN COc1ccc(C2(C(=O)N3CCCN(Cc4ccccc4)C[C@H]3C)CCC2)cc1OC ZINC000542509397 939834663 /nfs/dbraw/zinc/83/46/63/939834663.db2.gz ALAXVEAHVDYNGP-HXUWFJFHSA-N 0 3 422.569 4.249 20 0 HIADHN O=C(CN[C@H](c1cccs1)C1CC1)N1CCC[C@H]1c1ccc2c(c1)OCCCO2 ZINC000542512042 939835049 /nfs/dbraw/zinc/83/50/49/939835049.db2.gz WSMBDHREMDXCOX-MBSDFSHPSA-N 0 3 412.555 4.314 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)N[C@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000542537874 939840326 /nfs/dbraw/zinc/84/03/26/939840326.db2.gz HQORVNFYMHRQTM-ZRBLBEILSA-N 0 3 411.521 4.182 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@H](C)N[C@H](CC(C)C)c2cccs2)cc1OC ZINC000542557274 939843357 /nfs/dbraw/zinc/84/33/57/939843357.db2.gz OHVVALWZPFVILN-FUHWJXTLSA-N 0 3 404.576 4.489 20 0 HIADHN C[C@H](NCC(=O)Nc1ccc(OCc2ccccc2)cc1)[C@H]1COc2ccccc21 ZINC000542624659 939849908 /nfs/dbraw/zinc/84/99/08/939849908.db2.gz AAXFODDFLNOHGU-FDDCHVKYSA-N 0 3 402.494 4.358 20 0 HIADHN C[C@@H](NCC(=O)NCc1ccc(COc2ccccc2)cc1)[C@@H]1COc2ccccc21 ZINC000542626306 939850126 /nfs/dbraw/zinc/85/01/26/939850126.db2.gz ICAACSVOPBLRBZ-DVECYGJZSA-N 0 3 416.521 4.036 20 0 HIADHN C[C@H](NCC(=O)N[C@@H](Cc1ccccc1)c1ccccc1)[C@H]1COc2ccccc21 ZINC000542628136 939850339 /nfs/dbraw/zinc/85/03/39/939850339.db2.gz GMCBKSPQHFEQAC-IEXUWNMDSA-N 0 3 400.522 4.241 20 0 HIADHN CCC(C)(C)OCc1ccccc1NC(=O)N1CC[C@H](N2CCN(C(C)C)CC2)C1 ZINC000542717268 939856300 /nfs/dbraw/zinc/85/63/00/939856300.db2.gz FRCOVUQFHJKEMI-NRFANRHFSA-N 0 3 416.610 4.024 20 0 HIADHN CC(C)N(CCN(C)C)C(=O)Nc1ccc2[nH]c(C(F)(F)C(F)(F)F)nc2c1 ZINC000542892345 939865808 /nfs/dbraw/zinc/86/58/08/939865808.db2.gz RGPVEPUFOFHYME-UHFFFAOYSA-N 0 3 407.387 4.021 20 0 HIADHN COc1cc(Br)c(CN[C@H](C)CCc2n[nH]c3ccccc23)cc1OC ZINC000543016746 939895593 /nfs/dbraw/zinc/89/55/93/939895593.db2.gz LIKNFYLDFVGVQQ-CYBMUJFWSA-N 0 3 418.335 4.454 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)c1cncc(C(F)(F)F)c1 ZINC000563746580 945280462 /nfs/dbraw/zinc/28/04/62/945280462.db2.gz FCKDCZKEEIHUSK-UHFFFAOYSA-N 0 3 419.369 4.323 20 0 HIADHN CC(C)Oc1ccccc1CN[C@H](C)CC(=O)Nc1ccc(NC(=O)C2CC2)cc1 ZINC000543070933 939923592 /nfs/dbraw/zinc/92/35/92/939923592.db2.gz MBWKBLMRRNXVBO-QGZVFWFLSA-N 0 3 409.530 4.329 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)CC3CCC(C(F)(F)F)CC3)CC2)C[C@@H](C)O1 ZINC000543073437 939925243 /nfs/dbraw/zinc/92/52/43/939925243.db2.gz WRBUSCCCATZQEE-HNXFYBAISA-N 0 3 404.517 4.093 20 0 HIADHN Cc1cc(F)ccc1-n1ccc(C(=O)N(C)C2CCN(Cc3ccccc3)CC2)n1 ZINC000543077518 939928538 /nfs/dbraw/zinc/92/85/38/939928538.db2.gz RHICOQBFCHPFCN-UHFFFAOYSA-N 0 3 406.505 4.056 20 0 HIADHN Cc1ccc(C(=O)Nc2ccc(C(=O)N(C)[C@H]3CCCN(C)C3)cc2)c(Cl)c1C ZINC000543078099 939930317 /nfs/dbraw/zinc/93/03/17/939930317.db2.gz SCFMHVMUYNONJB-IBGZPJMESA-N 0 3 413.949 4.375 20 0 HIADHN C[C@H](CC(=O)Nc1ccc(NC(=O)C2CC2)cc1)NCc1ccc2ccccc2n1 ZINC000543081428 939932656 /nfs/dbraw/zinc/93/26/56/939932656.db2.gz DREYCFCURFABTL-MRXNPFEDSA-N 0 3 402.498 4.090 20 0 HIADHN CC(C)OCCCCN[C@@H](c1cccc(S(C)(=O)=O)c1)c1ccc(F)c(F)c1 ZINC000543086377 939934519 /nfs/dbraw/zinc/93/45/19/939934519.db2.gz CBQVXXVSDCRJCH-NRFANRHFSA-N 0 3 411.514 4.253 20 0 HIADHN COc1ccc(Oc2ccc(CNCc3ccc(N4CCO[C@H](C)C4)nc3)cc2)cc1 ZINC000543245507 940006638 /nfs/dbraw/zinc/00/66/38/940006638.db2.gz SPZHZDHNDQOFJI-LJQANCHMSA-N 0 3 419.525 4.397 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)CN2CC[C@H](c3cccc(C)c3)C2)c(OC)c1 ZINC000543253372 940008728 /nfs/dbraw/zinc/00/87/28/940008728.db2.gz PGLIPMAORLTJLB-REWPJTCUSA-N 0 3 408.542 4.165 20 0 HIADHN Cc1nn(CC(=O)N[C@@H](c2ccc(F)c(F)c2)C(C)(C)N2CCCC2)c(C)c1Cl ZINC000543409415 940055852 /nfs/dbraw/zinc/05/58/52/940055852.db2.gz KGZQHUZNENILMV-FQEVSTJZSA-N 0 3 424.923 4.163 20 0 HIADHN CCCC(=O)Nc1ccc(CN[C@@H](CN2CCOCC2)c2ccc(CC)cc2)cc1 ZINC000543408397 940055888 /nfs/dbraw/zinc/05/58/88/940055888.db2.gz INCAMKOQAGMLTM-DEOSSOPVSA-N 0 3 409.574 4.151 20 0 HIADHN CCN(CC)[C@H](CN[C@@H](c1ccc(F)cc1)c1cnccn1)c1cccc(OC)c1 ZINC000543410240 940056890 /nfs/dbraw/zinc/05/68/90/940056890.db2.gz BPNZCXKRIGSXCQ-RPWUZVMVSA-N 0 3 408.521 4.386 20 0 HIADHN COc1ccc(Cl)c(N[C@@H](CN2CCC(C(N)=O)CC2)c2ccc(Cl)cc2)c1 ZINC000543427128 940061475 /nfs/dbraw/zinc/06/14/75/940061475.db2.gz FMRCVPHLGCWTNV-FQEVSTJZSA-N 0 3 422.356 4.353 20 0 HIADHN COC(=O)c1ccccc1N(C)C(=O)CN[C@@H](Cc1ccccc1)c1cccs1 ZINC000543455764 940068380 /nfs/dbraw/zinc/06/83/80/940068380.db2.gz ZVHWOQNYYHMOPW-IBGZPJMESA-N 0 3 408.523 4.071 20 0 HIADHN Cc1csc([C@@H](C)CNC(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)n1 ZINC000543483869 940079069 /nfs/dbraw/zinc/07/90/69/940079069.db2.gz AJHVIXZIBNEXJR-RDJZCZTQSA-N 0 3 406.621 4.389 20 0 HIADHN CCc1ccccc1NC(=O)CN(C)C(=O)[C@@H](C)N[C@H](CC(C)C)c1cccs1 ZINC000543484897 940079550 /nfs/dbraw/zinc/07/95/50/940079550.db2.gz FZWGJIKLWCRZBZ-YLJYHZDGSA-N 0 3 415.603 4.473 20 0 HIADHN CN(Cc1cccc(C(F)(F)F)c1)C1CCN(C(=O)C(=O)c2ccc(F)cc2)CC1 ZINC000543524138 940095791 /nfs/dbraw/zinc/09/57/91/940095791.db2.gz IXUKYBLRNVIQKP-UHFFFAOYSA-N 0 3 422.422 4.150 20 0 HIADHN CCN(CC)[C@H](CNC(=O)C1(c2ccc(OC)c(OC)c2)CCC1)c1ccsc1 ZINC000543540058 940099292 /nfs/dbraw/zinc/09/92/92/940099292.db2.gz XDGIIVZPPDGWEO-LJQANCHMSA-N 0 3 416.587 4.386 20 0 HIADHN C[C@H](c1ccc(F)c(F)c1)N(C)C(=O)CN(C)[C@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000543555727 940107034 /nfs/dbraw/zinc/10/70/34/940107034.db2.gz UUQGGOZEOCUISB-QOEFQVSFSA-N 0 3 420.475 4.475 20 0 HIADHN C[C@H](NCC(=O)N1CCc2sccc2[C@H]1c1ccccc1)[C@H]1COc2ccccc21 ZINC000543557442 940108004 /nfs/dbraw/zinc/10/80/04/940108004.db2.gz MGTYYQPXOPIPKF-SMTRDTIPSA-N 0 3 418.562 4.377 20 0 HIADHN CN(CC(=O)NC12CC3CC(CC(C3)C1)C2)[C@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000543560582 940108351 /nfs/dbraw/zinc/10/83/51/940108351.db2.gz IYMKWKDSJXSDDF-AJVIDYBBSA-N 0 3 400.538 4.063 20 0 HIADHN CC(C)CN(CC(F)(F)F)C(=O)CN(C)[C@@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000543560658 940108928 /nfs/dbraw/zinc/10/89/28/940108928.db2.gz MWTOPCWMCIETDH-MSOLQXFVSA-N 0 3 404.448 4.025 20 0 HIADHN Cc1nn(C)c(=O)c(-c2nc(CNC3(Cc4ccccc4)CCCC3)cs2)c1C ZINC000543560994 940109276 /nfs/dbraw/zinc/10/92/76/940109276.db2.gz SNXMUQXWFUEKQB-UHFFFAOYSA-N 0 3 408.571 4.166 20 0 HIADHN O=S(=O)(c1ccc(CN[C@@H]2CCCc3c(Cl)cccc32)cc1)N1CCCC1 ZINC000543591708 940123558 /nfs/dbraw/zinc/12/35/58/940123558.db2.gz LHULEXYPQBYANW-OAQYLSRUSA-N 0 3 404.963 4.292 20 0 HIADHN COc1ccc([C@@H](CN[C@H](c2ccccc2)c2cncnc2)N2CCCCC2)cc1 ZINC000543604742 940128540 /nfs/dbraw/zinc/12/85/40/940128540.db2.gz CQCYUSSSKHXPPS-JWQCQUIFSA-N 0 3 402.542 4.391 20 0 HIADHN Cc1nc(-c2ccc(CCN[C@@H](C)CS(=O)(=O)c3ccc(C)cc3)s2)cs1 ZINC000543604238 940128636 /nfs/dbraw/zinc/12/86/36/940128636.db2.gz OCHVWSZUBVVJOL-HNNXBMFYSA-N 0 3 420.625 4.483 20 0 HIADHN COc1cc(Br)c(CN[C@H]2CCO[C@@H](c3ccc(F)cc3)C2)cc1O ZINC000543617677 940134120 /nfs/dbraw/zinc/13/41/20/940134120.db2.gz DJFNPWOYDBGBBB-MAUKXSAKSA-N 0 3 410.283 4.312 20 0 HIADHN COc1cc(C[NH2+][C@@H]2CCO[C@H](c3ccc(F)cc3)C2)cc(Br)c1[O-] ZINC000543641759 940147208 /nfs/dbraw/zinc/14/72/08/940147208.db2.gz JDKQYSDYYRNMCC-WBVHZDCISA-N 0 3 410.283 4.312 20 0 HIADHN CCOc1cc(CNCc2ccc(Cl)c(C)c2)ccc1O[C@H](C)C(=O)N(C)C ZINC000543645105 940148224 /nfs/dbraw/zinc/14/82/24/940148224.db2.gz XOYGDWQMYSHYEM-MRXNPFEDSA-N 0 3 404.938 4.192 20 0 HIADHN Cc1nn(-c2ccccc2)cc1NC(=O)N(CCCc1ccccc1)CCN(C)C ZINC000543765425 940178782 /nfs/dbraw/zinc/17/87/82/940178782.db2.gz HIUBIUNNAALLOV-UHFFFAOYSA-N 0 3 405.546 4.209 20 0 HIADHN CC[C@@H](CNC(=O)Nc1cn(-c2ccccc2)nc1C)N1CCc2ccccc2C1 ZINC000543766796 940179585 /nfs/dbraw/zinc/17/95/85/940179585.db2.gz LNNAUQMEZDUXLJ-NRFANRHFSA-N 0 3 403.530 4.139 20 0 HIADHN CC(=O)Nc1ccc([C@@H](C)N[C@@H]2CC(=O)N(c3cccc(C(F)(F)F)c3)C2)cc1 ZINC000543775727 940182767 /nfs/dbraw/zinc/18/27/67/940182767.db2.gz JDMAPVIZEYRMNR-FZKQIMNGSA-N 0 3 405.420 4.120 20 0 HIADHN CC(=O)Nc1ccc([C@@H](C)N[C@@H](Cc2ccccc2)C(=O)NCc2ccccc2)cc1 ZINC000543776983 940183208 /nfs/dbraw/zinc/18/32/08/940183208.db2.gz HZLMUGDXYBUYMT-CLOONOSVSA-N 0 3 415.537 4.223 20 0 HIADHN CC1(C)CC[C@H](C(=O)NC2CCN(CCOc3ccc(Br)cc3)CC2)C1 ZINC000543835845 940204355 /nfs/dbraw/zinc/20/43/55/940204355.db2.gz IRLLMRAECXISGU-INIZCTEOSA-N 0 3 423.395 4.235 20 0 HIADHN O=C(CN[C@@H](CO)C1CCCCC1)N1N=C(c2cccs2)C[C@H]1c1cccs1 ZINC000543839365 940205468 /nfs/dbraw/zinc/20/54/68/940205468.db2.gz JCTAQRTZULDMHF-ROUUACIJSA-N 0 3 417.600 4.018 20 0 HIADHN COC(=O)c1ccc(-c2nc(CN3CCC[C@H]3Cc3cccc(OC)c3)co2)cc1 ZINC000543859882 940213689 /nfs/dbraw/zinc/21/36/89/940213689.db2.gz GZBJCOFMWWTGPZ-NRFANRHFSA-N 0 3 406.482 4.344 20 0 HIADHN Clc1ccc(C2(CNCc3ncc(Br)s3)CCOCC2)cc1 ZINC000543875164 940221034 /nfs/dbraw/zinc/22/10/34/940221034.db2.gz LGBNDWLEYOBNDA-UHFFFAOYSA-N 0 3 401.757 4.397 20 0 HIADHN C[C@H](C(=O)N(C)Cc1c(F)cccc1Cl)N1CCC(CCCn2ccnc2)CC1 ZINC000543987820 940283671 /nfs/dbraw/zinc/28/36/71/940283671.db2.gz JPODEXXBFUHMBW-QGZVFWFLSA-N 0 3 420.960 4.215 20 0 HIADHN COC(=O)c1cccc(NC(=O)C[C@@H](C)N[C@@H](CC(F)(F)F)c2ccccc2)c1 ZINC000543996568 940289269 /nfs/dbraw/zinc/28/92/69/940289269.db2.gz JMGICOLJDDSCPC-KDOFPFPSSA-N 0 3 408.420 4.474 20 0 HIADHN COCC(=O)Nc1cccc(CN[C@H]2CCCc3c(Br)cccc32)c1 ZINC000544009949 940297147 /nfs/dbraw/zinc/29/71/47/940297147.db2.gz OKSBZABEGICDON-IBGZPJMESA-N 0 3 403.320 4.201 20 0 HIADHN O=C([C@H]1CC12CCN(CCCc1ccccc1Br)CC2)N1CCCCC1 ZINC000544119854 940331567 /nfs/dbraw/zinc/33/15/67/940331567.db2.gz DUBRHLCDZKIMON-LJQANCHMSA-N 0 3 419.407 4.496 20 0 HIADHN O=S1(=O)CCCC[C@@H]1CNCc1ccc(-c2ccc(Br)cc2)s1 ZINC000544180982 940346067 /nfs/dbraw/zinc/34/60/67/940346067.db2.gz JZVDNYNUUZHPEF-MRXNPFEDSA-N 0 3 414.390 4.235 20 0 HIADHN C[C@@H]1CCN(C(=O)c2cccc(CN(C)Cc3ccccc3)c2)C[C@@H]1n1ccnc1 ZINC000544278102 940377232 /nfs/dbraw/zinc/37/72/32/940377232.db2.gz LZJXKSJCWWLBGJ-YKSBVNFPSA-N 0 3 402.542 4.238 20 0 HIADHN CSc1ccc(NC(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)nc1 ZINC000544278698 940377349 /nfs/dbraw/zinc/37/73/49/940377349.db2.gz DSYMLSPUFLFBNR-UHFFFAOYSA-N 0 3 412.481 4.418 20 0 HIADHN Cc1cc(-c2nc(C3CC3)no2)ccc1NC(=O)NCCN(C)Cc1ccccc1 ZINC000544299627 940383685 /nfs/dbraw/zinc/38/36/85/940383685.db2.gz DVOMEIBUCAICNW-UHFFFAOYSA-N 0 3 405.502 4.176 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2CN2CCOCC3(CCOCC3)C2)o1 ZINC000544347896 940396941 /nfs/dbraw/zinc/39/69/41/940396941.db2.gz WOJRCEJVGKVBPM-UHFFFAOYSA-N 0 3 407.514 4.070 20 0 HIADHN COc1ccccc1NC(=O)C1CCN(Cc2cn(C)nc2C2CCCCC2)CC1 ZINC000544351418 940397434 /nfs/dbraw/zinc/39/74/34/940397434.db2.gz MWTXQGYKFAQWBG-UHFFFAOYSA-N 0 3 410.562 4.327 20 0 HIADHN NC(=O)C1CCN(C[C@H](NCc2cc3ccccc3o2)c2ccc(Cl)cc2)CC1 ZINC000544355768 940399243 /nfs/dbraw/zinc/39/92/43/940399243.db2.gz NABBHHUATDOJLS-NRFANRHFSA-N 0 3 411.933 4.114 20 0 HIADHN Fc1ccc([C@H](NCC2(N3CCSCC3)CCCC2)c2cccnc2)c(F)c1 ZINC000544361660 940401606 /nfs/dbraw/zinc/40/16/06/940401606.db2.gz ZZQKOGVNJQGWKU-OAQYLSRUSA-N 0 3 403.542 4.400 20 0 HIADHN Cc1cc([C@@H](NC[C@H](c2cccs2)N2CCN(C)CC2)c2cccnc2)ccc1F ZINC000544360660 940401654 /nfs/dbraw/zinc/40/16/54/940401654.db2.gz PFIUYHOUAPJRJT-ISKFKSNPSA-N 0 3 424.589 4.258 20 0 HIADHN Fc1ccc([C@@H](NCC2(N3CCSCC3)CCCC2)c2cccnc2)c(F)c1 ZINC000544361659 940401790 /nfs/dbraw/zinc/40/17/90/940401790.db2.gz ZZQKOGVNJQGWKU-NRFANRHFSA-N 0 3 403.542 4.400 20 0 HIADHN O=C(CCCN[C@H](c1ccco1)c1ccccc1)N1CCN(c2ccccc2)CC1 ZINC000544379250 940407324 /nfs/dbraw/zinc/40/73/24/940407324.db2.gz FEIHYZFLQUDHQX-VWLOTQADSA-N 0 3 403.526 4.088 20 0 HIADHN CCC(C)(C)[NH2+][C@@H](C)C(=O)Nc1ccc(C)c(S(=O)(=O)[N-]c2ccccc2F)c1 ZINC000544403653 940413462 /nfs/dbraw/zinc/41/34/62/940413462.db2.gz KGNUAKRWJMXWEV-HNNXBMFYSA-N 0 3 421.538 4.040 20 0 HIADHN O=C(CN[C@@H](Cc1ccccc1)c1cccs1)N1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000544415142 940417113 /nfs/dbraw/zinc/41/71/13/940417113.db2.gz HRMXFHMAOJDTQY-FCHUYYIVSA-N 0 3 424.541 4.361 20 0 HIADHN CC(C)[C@@H](NC[C@H](O)Cn1c2ccccc2c2ccccc21)c1nnc2ccccn21 ZINC000544435198 940429379 /nfs/dbraw/zinc/42/93/79/940429379.db2.gz LTIXYKWGOFFQOO-MHECFPHRSA-N 0 3 413.525 4.185 20 0 HIADHN COc1cc(-c2noc(CN[C@@H]3C[C@@H](C)CC[C@@H]3C(C)C)n2)cc(OC)c1OC ZINC000544434915 940429465 /nfs/dbraw/zinc/42/94/65/940429465.db2.gz DRFVSAQFRASRKB-USXIJHARSA-N 0 3 403.523 4.313 20 0 HIADHN CC(C)[C@@H](NC[C@@H](O)Cn1c2ccccc2c2ccccc21)c1nnc2ccccn21 ZINC000544435196 940429524 /nfs/dbraw/zinc/42/95/24/940429524.db2.gz LTIXYKWGOFFQOO-HOYKHHGWSA-N 0 3 413.525 4.185 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)c2cn(C)nc2C2CCCCC2)N(C)C)cc1 ZINC000563908997 945321887 /nfs/dbraw/zinc/32/18/87/945321887.db2.gz JBFWFHNLRJELBI-QFIPXVFZSA-N 0 3 412.578 4.288 20 0 HIADHN CN(CC(=O)N1CCc2[nH]c3ccccc3c2C1)[C@@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000544529604 940472921 /nfs/dbraw/zinc/47/29/21/940472921.db2.gz OCHOQPVVULFCNJ-DVECYGJZSA-N 0 3 421.516 4.044 20 0 HIADHN C[C@@H](NCC(=O)N(C)C(c1ccccc1)c1ccccc1)[C@@H]1COc2ccccc21 ZINC000544530618 940472982 /nfs/dbraw/zinc/47/29/82/940472982.db2.gz ZNDGRQZPYVRYDH-XXBNENTESA-N 0 3 400.522 4.389 20 0 HIADHN C[C@@H]1N(CC(=O)N2CCc3sccc3[C@H]2c2ccccc2)CCC12CCOCC2 ZINC000544546405 940476155 /nfs/dbraw/zinc/47/61/55/940476155.db2.gz HTVRLBSGDHUMMC-FDDCHVKYSA-N 0 3 410.583 4.113 20 0 HIADHN CCC[C@H](NCc1ccccc1CN1C(=O)NC2(CCCCC2)C1=O)c1cccnc1 ZINC000544567465 940480857 /nfs/dbraw/zinc/48/08/57/940480857.db2.gz SRRFVTNCXZTMSQ-QFIPXVFZSA-N 0 3 420.557 4.467 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@@H]2NCc2cccc(Cn3ccnc3)c2)cc1 ZINC000544579225 940483667 /nfs/dbraw/zinc/48/36/67/940483667.db2.gz NRPQKPRVAYHJGT-BJKOFHAPSA-N 0 3 423.582 4.115 20 0 HIADHN C[C@H](CNC(=O)N(C)[C@@H]1CCO[C@H](c2ccc(F)cc2)C1)N(C)Cc1ccccc1 ZINC000544661622 940499804 /nfs/dbraw/zinc/49/98/04/940499804.db2.gz SCDKSCWRIPAZPK-YSZBQJHXSA-N 0 3 413.537 4.208 20 0 HIADHN CS[C@@H]1CN(C(=O)c2c(C)onc2-c2c(F)cccc2Cl)C[C@H]1N1CCCC1 ZINC000544684969 940502161 /nfs/dbraw/zinc/50/21/61/940502161.db2.gz RDMSQLMXEOMCPY-HZPDHXFCSA-N 0 3 423.941 4.094 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)c1scnc1C1CCCC1 ZINC000544746538 940510310 /nfs/dbraw/zinc/51/03/10/940510310.db2.gz QYKDPAOHCQMHJR-UHFFFAOYSA-N 0 3 412.603 4.133 20 0 HIADHN Fc1cccc(CN2CCC[C@@H](c3nc(-c4ccc(N5CCCC5)nc4)no3)C2)c1 ZINC000544810702 940516443 /nfs/dbraw/zinc/51/64/43/940516443.db2.gz MZZBHTMFRKPWBI-LJQANCHMSA-N 0 3 407.493 4.251 20 0 HIADHN CCN(C(=O)c1ccc(Cn2nc(C)cc2C)cc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000544848316 940518894 /nfs/dbraw/zinc/51/88/94/940518894.db2.gz RSMKPFKEZYDXIS-RUZDIDTESA-N 0 3 416.569 4.285 20 0 HIADHN CCN(C(=O)c1ccc(N2CCCCCC2)nc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000544848697 940518915 /nfs/dbraw/zinc/51/89/15/940518915.db2.gz HMSXHJZULVONOF-HSZRJFAPSA-N 0 3 406.574 4.199 20 0 HIADHN CCN(C(=O)c1ccc(N2CCCCCC2)nc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000544848701 940519003 /nfs/dbraw/zinc/51/90/03/940519003.db2.gz HMSXHJZULVONOF-QHCPKHFHSA-N 0 3 406.574 4.199 20 0 HIADHN Cc1cc(C(=O)NC[C@H](c2ccccc2)N2CCCC2)c(C)n1Cc1ccncc1 ZINC000545166851 940553477 /nfs/dbraw/zinc/55/34/77/940553477.db2.gz HVRJIPOKVUNBFU-XMMPIXPASA-N 0 3 402.542 4.115 20 0 HIADHN C[C@@](O)(C1CCN(CCC(=O)Nc2cc(Cl)ccc2Cl)CC1)C(F)(F)F ZINC000545225542 940557185 /nfs/dbraw/zinc/55/71/85/940557185.db2.gz HFTYTBMXWMBPNC-MRXNPFEDSA-N 0 3 413.267 4.347 20 0 HIADHN C[C@](O)(C1CCN(CCC(=O)Nc2cc(Cl)ccc2Cl)CC1)C(F)(F)F ZINC000545225541 940557245 /nfs/dbraw/zinc/55/72/45/940557245.db2.gz HFTYTBMXWMBPNC-INIZCTEOSA-N 0 3 413.267 4.347 20 0 HIADHN C[C@@H](NC(=O)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1)c1ccon1 ZINC000545336726 940562399 /nfs/dbraw/zinc/56/23/99/940562399.db2.gz FPHQRNBEUWBXLI-CQSZACIVSA-N 0 3 411.333 4.350 20 0 HIADHN CCO[C@@H]1C[C@@H](NCc2cc(Cl)ccc2OCc2cccnc2)[C@@]12CCCO2 ZINC000545351726 940564033 /nfs/dbraw/zinc/56/40/33/940564033.db2.gz QSWNAYMVEMUKNZ-VSKRKVRLSA-N 0 3 402.922 4.130 20 0 HIADHN CS[C@@H]1CN(C(=O)Nc2ccc(Sc3nc(C)cs3)cc2C)C[C@H]1N(C)C ZINC000545421108 940569029 /nfs/dbraw/zinc/56/90/29/940569029.db2.gz QQQBIVKSTLTJNI-IAGOWNOFSA-N 0 3 422.645 4.420 20 0 HIADHN C[C@H](N[C@H](Cc1ccc(Cl)cc1)C(N)=O)c1ccc(OCC(F)(F)F)cc1 ZINC000545473633 940571301 /nfs/dbraw/zinc/57/13/01/940571301.db2.gz OELFAPDCWHYYPE-YVEFUNNKSA-N 0 3 400.828 4.028 20 0 HIADHN CCN(C(=O)Cc1csc(-c2ccccc2)n1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000545475840 940571392 /nfs/dbraw/zinc/57/13/92/940571392.db2.gz PSNRHEAZMREHIM-JOCHJYFZSA-N 0 3 405.567 4.476 20 0 HIADHN CCN(C(=O)Cc1csc(Cc2ccccc2)n1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000545475402 940571436 /nfs/dbraw/zinc/57/14/36/940571436.db2.gz OHUHZPYMMVWFDI-QHCPKHFHSA-N 0 3 419.594 4.399 20 0 HIADHN CCN(C(=O)c1[nH]nc(C(C)C)c1Br)[C@H]1CCN(Cc2ccccc2)C1 ZINC000545492167 940571927 /nfs/dbraw/zinc/57/19/27/940571927.db2.gz YEDKSYCRCQWLOE-INIZCTEOSA-N 0 3 419.367 4.032 20 0 HIADHN Cc1ccccc1C(NC(=O)C(=O)Nc1cccc(CN(C)C)c1)c1ccccc1C ZINC000545493747 940572049 /nfs/dbraw/zinc/57/20/49/940572049.db2.gz DRCGETRUIPDVHM-UHFFFAOYSA-N 0 3 415.537 4.209 20 0 HIADHN Cc1ccc2[nH]c(-c3nc(-c4ccc(N5CCCN(C)CC5)nc4)no3)cc2c1C ZINC000545655429 940579088 /nfs/dbraw/zinc/57/90/88/940579088.db2.gz RUMYKUXGIZJFLV-UHFFFAOYSA-N 0 3 402.502 4.039 20 0 HIADHN C[C@H](Cc1ccc(Cl)cc1)c1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1 ZINC000545657109 940579202 /nfs/dbraw/zinc/57/92/02/940579202.db2.gz IUTCTPPGZBXKNM-MRXNPFEDSA-N 0 3 411.937 4.273 20 0 HIADHN CC(C)N1CCN(c2ccc(-c3nc([C@H]4CCOc5ccccc54)no3)cc2)CC1 ZINC000545695919 940581249 /nfs/dbraw/zinc/58/12/49/940581249.db2.gz RFBUSLLFZQDROB-NRFANRHFSA-N 0 3 404.514 4.181 20 0 HIADHN COc1ccc(C[C@@H](C)N[C@@H](c2nc(-c3ccncc3)no2)C(C)C)c(C)c1OC ZINC000563984442 945335790 /nfs/dbraw/zinc/33/57/90/945335790.db2.gz MIVVKMMIIMSSPO-FOIQADDNSA-N 0 3 410.518 4.375 20 0 HIADHN CC[C@@H](CNC(=O)C(C)(C)Cc1nc2ccccc2[nH]1)N1CCc2ccccc2C1 ZINC000545965878 940667175 /nfs/dbraw/zinc/66/71/75/940667175.db2.gz BXGBBSVDLVBZKT-FQEVSTJZSA-N 0 3 404.558 4.085 20 0 HIADHN Cc1ccccc1C1(C(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)CCOCC1 ZINC000563992957 945339482 /nfs/dbraw/zinc/33/94/82/945339482.db2.gz OEJXNHVCYLDVQJ-XMMPIXPASA-N 0 3 424.585 4.250 20 0 HIADHN CCN(C(=O)[C@H](C)Cc1ccc(OC)c(OC)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000546182657 940723206 /nfs/dbraw/zinc/72/32/06/940723206.db2.gz IXGUXRMOAHVHCL-KNQAVFIVSA-N 0 3 410.558 4.005 20 0 HIADHN CC[C@H](CC(F)(F)F)NC(=O)Nc1cc(C)nn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000546216743 940732341 /nfs/dbraw/zinc/73/23/41/940732341.db2.gz GRVKMXXIVNCVSE-MSOLQXFVSA-N 0 3 423.483 4.491 20 0 HIADHN CCN(CCC1CC1)[C@H](C)C(=O)Nc1ccc(C(=O)Nc2ccccc2OC)cc1 ZINC000546223269 940734618 /nfs/dbraw/zinc/73/46/18/940734618.db2.gz FBCNWVCTECWKTB-QGZVFWFLSA-N 0 3 409.530 4.397 20 0 HIADHN COCCC(C)(C)CN[C@@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000546225652 940735101 /nfs/dbraw/zinc/73/51/01/940735101.db2.gz UQLNFJVTYRYCSY-FQEVSTJZSA-N 0 3 409.979 4.485 20 0 HIADHN Cc1noc(C)c1CO[C@H]1CCN(CCC(=O)Nc2cc(Cl)ccc2Cl)C1 ZINC000546587542 940858586 /nfs/dbraw/zinc/85/85/86/940858586.db2.gz NCJBKOBSWPMJGQ-HNNXBMFYSA-N 0 3 412.317 4.218 20 0 HIADHN Cc1ccc([C@H](Cc2ccccc2Br)NC[C@@H](C)S(C)(=O)=O)cc1 ZINC000546626685 940862170 /nfs/dbraw/zinc/86/21/70/940862170.db2.gz HUGYDLHDELNMJD-BEFAXECRSA-N 0 3 410.377 4.064 20 0 HIADHN c1csc(-c2nn(Cc3ccccc3)cc2CN2CCOC3(CCOCC3)CC2)c1 ZINC000546717177 940872178 /nfs/dbraw/zinc/87/21/78/940872178.db2.gz ULGNTPFEYRTUSO-UHFFFAOYSA-N 0 3 423.582 4.431 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)NCc2nc3ccccc3n2C2CC2)C1 ZINC000546763160 940878530 /nfs/dbraw/zinc/87/85/30/940878530.db2.gz ZNPMGZYXGIPCCP-IEBWSBKVSA-N 0 3 403.530 4.006 20 0 HIADHN CCN1C(=O)CCc2cc(NC(=O)N3CC[C@@H](C)N(Cc4ccccc4)CC3)ccc21 ZINC000546844683 940893541 /nfs/dbraw/zinc/89/35/41/940893541.db2.gz KUUYCIUQTPDDMD-LJQANCHMSA-N 0 3 420.557 4.114 20 0 HIADHN CCN(C(=O)c1cccc(NC(=O)c2ccco2)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000546889680 940902550 /nfs/dbraw/zinc/90/25/50/940902550.db2.gz MDPJNPRYMLZWIM-JOCHJYFZSA-N 0 3 417.509 4.269 20 0 HIADHN CCN(C(=O)c1cc(C2CC2)nc2onc(C)c21)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000546893183 940903731 /nfs/dbraw/zinc/90/37/31/940903731.db2.gz IGPFHHKKKFMQLJ-LJQANCHMSA-N 0 3 404.514 4.145 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)NCCC[C@H]1CCCCO1 ZINC000546908477 940909369 /nfs/dbraw/zinc/90/93/69/940909369.db2.gz NTDIMXIBUNBSDY-LJQANCHMSA-N 0 3 415.500 4.128 20 0 HIADHN CCC(=O)Nc1cccc(-c2noc(-c3ccc(CN4CCSCC4)cc3)n2)c1 ZINC000546980017 940935278 /nfs/dbraw/zinc/93/52/78/940935278.db2.gz BNJRSYNNYWIHBC-UHFFFAOYSA-N 0 3 408.527 4.301 20 0 HIADHN CC(C)(CS(C)(=O)=O)NCc1ccc(-c2ccccc2Br)s1 ZINC000547284419 941051830 /nfs/dbraw/zinc/05/18/30/941051830.db2.gz AFGGWLGJROTEMW-UHFFFAOYSA-N 0 3 402.379 4.090 20 0 HIADHN CC[C@H](C(=O)Nc1cccc(C(=O)N2CCc3sccc3C2)c1C)N(CC)CC ZINC000547303294 941055470 /nfs/dbraw/zinc/05/54/70/941055470.db2.gz PKMQWDPSGHHBJO-HXUWFJFHSA-N 0 3 413.587 4.314 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NC3CC(OCc4ccccc4)C3)c(C)c2)CC1 ZINC000547332078 941056468 /nfs/dbraw/zinc/05/64/68/941056468.db2.gz OJIWZBIWXPSAHN-UHFFFAOYSA-N 0 3 422.573 4.006 20 0 HIADHN O=C([C@H]1CCCN(Cc2cccnc2)C1)N1CCC(Cc2ccc(F)c(F)c2)CC1 ZINC000547424950 941061750 /nfs/dbraw/zinc/06/17/50/941061750.db2.gz SPYFNVACSNQFKY-NRFANRHFSA-N 0 3 413.512 4.053 20 0 HIADHN O=S1(=O)CCCN1c1ccc(CN[C@H]2CCCc3ccc(Cl)cc32)cc1F ZINC000547832200 941077667 /nfs/dbraw/zinc/07/76/67/941077667.db2.gz LGWGBWZOUPKEAD-IBGZPJMESA-N 0 3 408.926 4.186 20 0 HIADHN COc1cc(C)ccc1C(=O)Nc1cc(C)nn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000548049792 941084143 /nfs/dbraw/zinc/08/41/43/941084143.db2.gz DHYCCRSRADMQKC-FQEVSTJZSA-N 0 3 404.514 4.208 20 0 HIADHN COCCOc1ccc(C(F)(F)F)cc1NC(=O)CN(C)[C@H]1CCCC[C@H]1C ZINC000548403124 941099914 /nfs/dbraw/zinc/09/99/14/941099914.db2.gz PQLIFUNPSDEYHX-PBHICJAKSA-N 0 3 402.457 4.180 20 0 HIADHN CN1CCN(CCCSc2nnc(Cc3ccccc3)n2C2CCCCC2)CC1 ZINC000548474550 941106958 /nfs/dbraw/zinc/10/69/58/941106958.db2.gz DSVSNEFWHAUTKH-UHFFFAOYSA-N 0 3 413.635 4.104 20 0 HIADHN CC(C)([C@@H](NC(=O)CCc1ccccc1O)c1ccc(F)c(F)c1)N1CCCC1 ZINC000548605987 941114267 /nfs/dbraw/zinc/11/42/67/941114267.db2.gz RXSHZDDFHZQWJG-QFIPXVFZSA-N 0 3 402.485 4.335 20 0 HIADHN COc1cccc(C2CCN(C(=O)NC[C@H](c3cccs3)N3CCCC3)CC2)c1 ZINC000548683385 941119268 /nfs/dbraw/zinc/11/92/68/941119268.db2.gz IBRUZHSLVCDILA-OAQYLSRUSA-N 0 3 413.587 4.483 20 0 HIADHN COc1cccc(C2CCN(C(=O)CCCN3CCN(c4ccccc4)CC3)CC2)c1 ZINC000548706480 941120462 /nfs/dbraw/zinc/12/04/62/941120462.db2.gz XUTHBVNYYRLWSW-UHFFFAOYSA-N 0 3 421.585 4.004 20 0 HIADHN C[C@@H]1C[C@@H](CCNC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)C[C@H](C)O1 ZINC000549020756 941144289 /nfs/dbraw/zinc/14/42/89/941144289.db2.gz MXBMMFZGBLUDKV-NZGUISNBSA-N 0 3 412.496 4.151 20 0 HIADHN CO[C@H](CN[C@@H](CO)c1ccc(Br)cc1C(F)(F)F)c1ccccc1 ZINC000549035921 941146894 /nfs/dbraw/zinc/14/68/94/941146894.db2.gz FHGAXSUNMYJCEJ-DLBZAZTESA-N 0 3 418.253 4.479 20 0 HIADHN CO[C@@H](CN[C@@H](CN1CCCC1=O)c1cccc(C(F)(F)F)c1)c1ccccc1 ZINC000549066372 941151681 /nfs/dbraw/zinc/15/16/81/941151681.db2.gz VECPUIMSWQCKFD-PMACEKPBSA-N 0 3 406.448 4.346 20 0 HIADHN COc1cc2c(cc1F)CC[C@H]2NC(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000549100864 941158264 /nfs/dbraw/zinc/15/82/64/941158264.db2.gz LKIPNEFPDAMUKI-MSOLQXFVSA-N 0 3 403.523 4.019 20 0 HIADHN Cc1ccc(NC(=O)CN[C@H]2CCN(C(C)C)[C@H]2c2ccc(F)c(F)c2)c(F)c1 ZINC000549114132 941161232 /nfs/dbraw/zinc/16/12/32/941161232.db2.gz ULCCMXQRUKCTFV-UNMCSNQZSA-N 0 3 405.464 4.164 20 0 HIADHN CCN1CC[C@H](NCC(=O)Nc2cccc(C)c2C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000549115388 941161374 /nfs/dbraw/zinc/16/13/74/941161374.db2.gz GWWGQZJGSUYFIQ-UNMCSNQZSA-N 0 3 403.929 4.460 20 0 HIADHN CCCCCn1cc(CNC(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)c(C)n1 ZINC000549122890 941162436 /nfs/dbraw/zinc/16/24/36/941162436.db2.gz TXPYRFBELMRGET-HXUWFJFHSA-N 0 3 405.974 4.137 20 0 HIADHN Nc1nccc([C@H]2CCCN(Cc3ccc(-c4ccc(Br)cc4)o3)C2)n1 ZINC000549164083 941167583 /nfs/dbraw/zinc/16/75/83/941167583.db2.gz CUKPZGKAZQUORH-HNNXBMFYSA-N 0 3 413.319 4.461 20 0 HIADHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)NCC(C)(C)C(F)(F)F ZINC000549183558 941169248 /nfs/dbraw/zinc/16/92/48/941169248.db2.gz OQBAUSCFWFXUEJ-UHFFFAOYSA-N 0 3 424.305 4.111 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)[C@H](C)c2ccc(C(=O)C(C)C)cc2)c1 ZINC000549269206 941175551 /nfs/dbraw/zinc/17/55/51/941175551.db2.gz YUWWMFZXFCCCFT-LJQANCHMSA-N 0 3 410.558 4.228 20 0 HIADHN CCOc1ccccc1OCC[NH+]1CCC(C(=O)Nc2cc(Cl)ccc2[O-])CC1 ZINC000549398046 941185855 /nfs/dbraw/zinc/18/58/55/941185855.db2.gz UVUNXRQAZVGMAY-UHFFFAOYSA-N 0 3 418.921 4.174 20 0 HIADHN CCOc1ccccc1OCCN1CCC(C(=O)Nc2cc(Cl)ccc2O)CC1 ZINC000549398046 941185856 /nfs/dbraw/zinc/18/58/56/941185856.db2.gz UVUNXRQAZVGMAY-UHFFFAOYSA-N 0 3 418.921 4.174 20 0 HIADHN C[C@]1(CNS(=O)(=O)Cc2ccc(C(F)F)cc2)CCCN1Cc1ccccc1 ZINC000549405800 941186836 /nfs/dbraw/zinc/18/68/36/941186836.db2.gz LIEFAENGDRUFIM-OAQYLSRUSA-N 0 3 408.514 4.098 20 0 HIADHN CN(C)C[C@H](NC(=O)N[C@@H](c1ccc(F)cc1)[C@@H]1CCCO1)c1ccc(Cl)cc1 ZINC000549414602 941187468 /nfs/dbraw/zinc/18/74/68/941187468.db2.gz KIBIVTOCFAIPBG-ACRUOGEOSA-N 0 3 419.928 4.301 20 0 HIADHN CCN1CC[C@@H](NCC(=O)Nc2c(F)cccc2F)[C@H]1c1ccc(Cl)c(F)c1 ZINC000549471413 941193395 /nfs/dbraw/zinc/19/33/95/941193395.db2.gz IUXUYPAKUYUPHG-YLJYHZDGSA-N 0 3 411.855 4.121 20 0 HIADHN CCN1CC[C@@H](NCC(=O)Nc2c(C)cccc2C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000549470497 941193485 /nfs/dbraw/zinc/19/34/85/941193485.db2.gz CURJURQURTWINQ-DENIHFKCSA-N 0 3 403.929 4.460 20 0 HIADHN COc1cccc([C@@H]2[C@@H](NCc3nccn3Cc3ccccc3)CCN2C2CC2)c1 ZINC000549477030 941194591 /nfs/dbraw/zinc/19/45/91/941194591.db2.gz IFYNVSFPVHOAOE-UKILVPOCSA-N 0 3 402.542 4.008 20 0 HIADHN CN(CC(F)(F)F)C(=O)CN[C@H]1CCN(C(C)(C)C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000549479066 941194860 /nfs/dbraw/zinc/19/48/60/941194860.db2.gz XGRMHHNIEUVNCY-DOTOQJQBSA-N 0 3 423.882 4.003 20 0 HIADHN CCc1sc(-c2nnc(CN[C@@H](C)C3CCN(CC(F)(F)F)CC3)o2)cc1C ZINC000549613386 941201340 /nfs/dbraw/zinc/20/13/40/941201340.db2.gz OBXMUJOWAVMRFI-ZDUSSCGKSA-N 0 3 416.513 4.421 20 0 HIADHN Cn1c(COc2ccccc2Cl)nnc1S[C@H]1CCN(Cc2ccccc2)C1 ZINC000549619109 941201609 /nfs/dbraw/zinc/20/16/09/941201609.db2.gz WFODSUGEXYBHKO-KRWDZBQOSA-N 0 3 414.962 4.414 20 0 HIADHN C[C@@H](NCc1coc(-c2c(F)cccc2F)n1)C1CCN(CC(F)(F)F)CC1 ZINC000549692668 941204835 /nfs/dbraw/zinc/20/48/35/941204835.db2.gz IFFGJZBNVFSBIG-GFCCVEGCSA-N 0 3 403.395 4.372 20 0 HIADHN CC[C@H](N[C@@H]1CCN([C@H](C)c2ccc(F)cc2)C1=O)c1ccc(OC)c(OC)c1 ZINC000549708899 941205305 /nfs/dbraw/zinc/20/53/05/941205305.db2.gz HADSLQKCQKRZKB-UIAACRFSSA-N 0 3 400.494 4.246 20 0 HIADHN C[C@H]1CN(c2ccc(Cl)c(F)c2)CCN1C[C@@H]1CCN(C(=O)c2ccccc2)C1 ZINC000549718178 941205551 /nfs/dbraw/zinc/20/55/51/941205551.db2.gz ZWEFVYLZWUTMKK-ROUUACIJSA-N 0 3 415.940 4.152 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2ccc(-c3noc(C(F)F)n3)cc2)N(C)C)cc1 ZINC000549802983 941207789 /nfs/dbraw/zinc/20/77/89/941207789.db2.gz UHWIQTRZIVFUDR-QGZVFWFLSA-N 0 3 415.444 4.407 20 0 HIADHN Cc1ccccc1C(C)(C)NCC(=O)NCc1cccc(COCc2ccco2)c1 ZINC000549868321 941220899 /nfs/dbraw/zinc/22/08/99/941220899.db2.gz STTKZQQURFWLQV-UHFFFAOYSA-N 0 3 406.526 4.446 20 0 HIADHN Cc1nc(COc2ccc(CN[C@@H](C)c3ccc(-n4cccn4)c(F)c3)cc2)no1 ZINC000549887389 941227991 /nfs/dbraw/zinc/22/79/91/941227991.db2.gz IQOBPGLHQPYNQK-HNNXBMFYSA-N 0 3 407.449 4.133 20 0 HIADHN CSc1ccc([C@@H](CNCc2c(Cl)cccc2N2CCOCC2)N(C)C)cc1 ZINC000549937561 941243309 /nfs/dbraw/zinc/24/33/09/941243309.db2.gz UMDRLESRXRPMNI-JOCHJYFZSA-N 0 3 420.022 4.291 20 0 HIADHN Cc1cc(-c2noc([C@@H](C)N[C@@H](C)C3CCN(CC(F)(F)F)CC3)n2)ccc1F ZINC000550023997 941267470 /nfs/dbraw/zinc/26/74/70/941267470.db2.gz HZDJCUZLAQWUGO-UONOGXRCSA-N 0 3 414.447 4.498 20 0 HIADHN CCN(CC)c1nc2sc(C(=O)N3CCCN(CC4CCC4)CC3)cc2s1 ZINC000550118130 941286524 /nfs/dbraw/zinc/28/65/24/941286524.db2.gz KJJJCCCDKPBYTC-UHFFFAOYSA-N 0 3 406.621 4.152 20 0 HIADHN O=C([C@H](NC1(Cc2ccc(F)cc2)CCOCC1)c1ccccc1)N1CCCCC1 ZINC000550180756 941294761 /nfs/dbraw/zinc/29/47/61/941294761.db2.gz XENXXUOGRUETRS-HSZRJFAPSA-N 0 3 410.533 4.261 20 0 HIADHN CCO[C@@H]1C[C@@H](NCc2cn(-c3ccccc3)nc2-c2cccs2)[C@H]1n1cccn1 ZINC000550325518 941315263 /nfs/dbraw/zinc/31/52/63/941315263.db2.gz GVPUCGCRHIRFII-TXTKFYIRSA-N 0 3 419.554 4.306 20 0 HIADHN Cc1ccc([C@H](NC(=O)CN[C@@H]2CCN(C)[C@H]2c2ccccc2)c2cccs2)cc1 ZINC000550705461 941356840 /nfs/dbraw/zinc/35/68/40/941356840.db2.gz UAFSXUUUAAZEAM-ZODMCCGTSA-N 0 3 419.594 4.297 20 0 HIADHN O[C@@H](CNCc1ccccc1F)COC(c1ccc(F)cc1)c1ccc(F)cc1 ZINC000550720855 941359461 /nfs/dbraw/zinc/35/94/61/941359461.db2.gz DWAWQLXUZUMCQK-NRFANRHFSA-N 0 3 401.428 4.361 20 0 HIADHN O=S1(=O)CC[C@@H](NC[C@@H](c2ccccc2)C2CC2)c2cc(Br)ccc21 ZINC000550848384 941374105 /nfs/dbraw/zinc/37/41/05/941374105.db2.gz UMDBMKWLDUICBK-RBUKOAKNSA-N 0 3 420.372 4.451 20 0 HIADHN COc1ccc([C@H](C)N[C@H]2CCCN([C@@H](C)c3ccccc3F)C2=O)cc1OC ZINC000550860567 941375404 /nfs/dbraw/zinc/37/54/04/941375404.db2.gz MCYISOQYKXQWTH-FTRWYGJKSA-N 0 3 400.494 4.246 20 0 HIADHN Fc1ccc([C@@H](NC[C@H]2CCCCN2Cc2cccc(Cl)c2)c2nnc[nH]2)cc1 ZINC000551050349 941400975 /nfs/dbraw/zinc/40/09/75/941400975.db2.gz FXCMCKWHMHSMBG-NHCUHLMSSA-N 0 3 413.928 4.331 20 0 HIADHN COc1cc(Br)ccc1CCCN[C@H](c1nnc[nH]1)c1ccc(F)cc1 ZINC000551165968 941420758 /nfs/dbraw/zinc/42/07/58/941420758.db2.gz TZTNGNFWNXLMLO-SFHVURJKSA-N 0 3 419.298 4.027 20 0 HIADHN CC(C)NC(=O)Nc1ccc(CNCc2cccc(I)c2)cc1 ZINC000551206350 941426896 /nfs/dbraw/zinc/42/68/96/941426896.db2.gz AECDRFBEEMQTHE-UHFFFAOYSA-N 0 3 423.298 4.111 20 0 HIADHN C[C@H](N[C@H]1CCCN([C@@H](C)c2ccc(F)cc2)C1=O)c1ccc2c(c1)CCC(=O)N2 ZINC000551274578 941441399 /nfs/dbraw/zinc/44/13/99/941441399.db2.gz SHZANMXUWMJAQF-WCJKSRRJSA-N 0 3 409.505 4.113 20 0 HIADHN CCS(=O)(=O)Nc1ccc([C@@H](C)N[C@@H](C)c2ccc(-n3cccn3)c(F)c2)cc1 ZINC000551274842 941441447 /nfs/dbraw/zinc/44/14/47/941441447.db2.gz WTNARBFUIGPODN-CVEARBPZSA-N 0 3 416.522 4.185 20 0 HIADHN C[C@H](c1ccc(F)cc1)N1CCC[C@H](N[C@@H](C)c2ccc(-n3cccn3)cc2)C1=O ZINC000551274801 941441685 /nfs/dbraw/zinc/44/16/85/941441685.db2.gz NFTBDBWZAJZLQO-IXFSTUDKSA-N 0 3 406.505 4.414 20 0 HIADHN CCc1nc(C(C)C)ccc1C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000551326142 941452817 /nfs/dbraw/zinc/45/28/17/941452817.db2.gz TVQNVNSFLVLTDQ-UHFFFAOYSA-N 0 3 413.537 4.180 20 0 HIADHN Fc1ccc([C@@H](NC[C@H]2CN(Cc3ccccc3)CCCO2)c2ccccn2)cc1 ZINC000551393226 941468558 /nfs/dbraw/zinc/46/85/58/941468558.db2.gz AGJLUXOERZGPBN-UKILVPOCSA-N 0 3 405.517 4.191 20 0 HIADHN Clc1cccc([C@@H]2CN(C[C@@H]3CN(Cc4ccccc4)CCCO3)CCO2)c1 ZINC000551394908 941468973 /nfs/dbraw/zinc/46/89/73/941468973.db2.gz IHOOGVZQGRUASE-GOTSBHOMSA-N 0 3 400.950 4.004 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1NC(=O)CCN1CCC(CC(F)(F)F)CC1 ZINC000551406652 941471103 /nfs/dbraw/zinc/47/11/03/941471103.db2.gz NOPKTBAKDBWJFA-UHFFFAOYSA-N 0 3 408.468 4.482 20 0 HIADHN CN(C(=O)c1ccc(NCc2c(C3CC3)nc3sccn23)cc1)[C@H]1CCCN(C)C1 ZINC000551452189 941482881 /nfs/dbraw/zinc/48/28/81/941482881.db2.gz JFOOFFZNLDGNPF-IBGZPJMESA-N 0 3 423.586 4.052 20 0 HIADHN CN(C)Cc1ccc(S(=O)(=O)NCc2cnc(-c3ccc(Cl)cc3)s2)cc1 ZINC000551486272 941488438 /nfs/dbraw/zinc/48/84/38/941488438.db2.gz JKUDJUANEQXNIL-UHFFFAOYSA-N 0 3 421.975 4.004 20 0 HIADHN CCCCO[C@H]1C[C@H](NCc2cc(C(F)(F)F)cc(S(C)(=O)=O)c2)C1(C)C ZINC000551517102 941493282 /nfs/dbraw/zinc/49/32/82/941493282.db2.gz DZDGDRGMPCIUTM-IRXDYDNUSA-N 0 3 407.498 4.182 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)c2sc(-c3ccc(F)cc3)nc2C)cc1 ZINC000551533923 941496378 /nfs/dbraw/zinc/49/63/78/941496378.db2.gz KRJRHKPRKXVWPO-IBGZPJMESA-N 0 3 413.518 4.299 20 0 HIADHN COc1ncc([C@H](C)N[C@@H](C)CC(=O)Nc2cccc(N3CCCC3)c2)cc1Cl ZINC000551534795 941497082 /nfs/dbraw/zinc/49/70/82/941497082.db2.gz QXYBUQFNPRTHDX-HOTGVXAUSA-N 0 3 416.953 4.412 20 0 HIADHN CCOc1ccc([C@@H](NCc2ccc(S(C)(=O)=O)cc2)C(C)C)cc1OCC ZINC000551537843 941497779 /nfs/dbraw/zinc/49/77/79/941497779.db2.gz CSNKXBCCJWYARM-QFIPXVFZSA-N 0 3 405.560 4.374 20 0 HIADHN Cc1cc(NC(=O)[C@H]2CCc3cccc(O)c32)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000551712619 941531199 /nfs/dbraw/zinc/53/11/99/941531199.db2.gz VKZVPHZCNVSEHO-SFTDATJTSA-N 0 3 416.525 4.013 20 0 HIADHN Cc1ccc(C)c(OC[C@@H](O)CN[C@H](c2cncc(Br)c2)C2CC2)c1C ZINC000551718557 941532529 /nfs/dbraw/zinc/53/25/29/941532529.db2.gz IDJIKMBPPQAVPH-PMACEKPBSA-N 0 3 419.363 4.250 20 0 HIADHN CC1CCC(NC(=O)CN[C@@H](c2cccc(C(F)(F)F)c2)C2CCOCC2)CC1 ZINC000551721707 941533190 /nfs/dbraw/zinc/53/31/90/941533190.db2.gz FOWRFDPNOFNYMS-FFYTWODTSA-N 0 3 412.496 4.458 20 0 HIADHN Cc1ccc(-n2cc(CN3CCC[C@@]4(CNC(=O)C4)C3)c(-c3ccc(F)cc3)n2)cc1 ZINC000551802306 941548342 /nfs/dbraw/zinc/54/83/42/941548342.db2.gz CSTIICLRYVYSIK-RUZDIDTESA-N 0 3 418.516 4.089 20 0 HIADHN C[C@H](N[C@@H](CO)C[C@H](O)C(C)(C)C)c1ccc(Br)cc1C(F)(F)F ZINC000551816288 941551705 /nfs/dbraw/zinc/55/17/05/941551705.db2.gz IOLPETMVGRVIII-NVBFEUDRSA-N 0 3 412.290 4.277 20 0 HIADHN COc1ccc2nc(C)cc(C(=O)N3CCN(c4ccnc5ccccc54)CC3)c2c1 ZINC000552007029 941568060 /nfs/dbraw/zinc/56/80/60/941568060.db2.gz AOAYJISXSCTKKS-UHFFFAOYSA-N 0 3 412.493 4.062 20 0 HIADHN O=C(NCc1ncc(-c2ccccc2)o1)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000552005906 941568140 /nfs/dbraw/zinc/56/81/40/941568140.db2.gz NEDGVPVKQASQFV-LJQANCHMSA-N 0 3 411.452 4.115 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)c1cnn(-c2ccc(C(F)(F)F)cc2)c1 ZINC000552077453 941580543 /nfs/dbraw/zinc/58/05/43/941580543.db2.gz KPJAMLUDZVTECT-UHFFFAOYSA-N 0 3 422.476 4.157 20 0 HIADHN CCCc1noc2nc(C3CC3)cc(C(=O)N(C)CCCN(C)Cc3ccncc3)c12 ZINC000552112477 941587235 /nfs/dbraw/zinc/58/72/35/941587235.db2.gz DOJKRSJFTQJXRK-UHFFFAOYSA-N 0 3 421.545 4.042 20 0 HIADHN CN(CCCN(C)C(=O)[C@H]1C[C@H]1c1cccc(C(F)(F)F)c1)Cc1ccncc1 ZINC000552112635 941587341 /nfs/dbraw/zinc/58/73/41/941587341.db2.gz NJFZCHORQCMQSM-PMACEKPBSA-N 0 3 405.464 4.184 20 0 HIADHN C[C@@H](NC(=O)c1cccc(C(=O)Nc2ccccc2)c1)[C@@H](c1ccccc1)N(C)C ZINC000552162746 941595711 /nfs/dbraw/zinc/59/57/11/941595711.db2.gz FPYKHRJYSMTAPK-JPYJTQIMSA-N 0 3 401.510 4.360 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@@H](O)C2)c1)c1cccc(OCc2cccs2)c1 ZINC000552199782 941600146 /nfs/dbraw/zinc/60/01/46/941600146.db2.gz HZTDMCNKFKSLBG-HXUWFJFHSA-N 0 3 408.523 4.146 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)c1cc(-c2ccccn2)ccc1Cl ZINC000552200054 941600914 /nfs/dbraw/zinc/60/09/14/941600914.db2.gz SISVZAPWLHFYRX-IBGZPJMESA-N 0 3 407.901 4.221 20 0 HIADHN CCCN(C)[C@H](CNC(=O)c1ccc(NC(C)=O)c(F)c1)c1ccc(Cl)cc1 ZINC000552240974 941610619 /nfs/dbraw/zinc/61/06/19/941610619.db2.gz YXXBHHXMPNLTFU-HXUWFJFHSA-N 0 3 405.901 4.250 20 0 HIADHN CC[C@@H](N[C@H](C)c1ccc(S(=O)(=O)NC)cc1)c1ccc(OC(F)(F)F)cc1 ZINC000552250102 941614112 /nfs/dbraw/zinc/61/41/12/941614112.db2.gz VCPOFDPEEODDLP-FZKQIMNGSA-N 0 3 416.465 4.295 20 0 HIADHN COc1ccc(Oc2cc(CN[C@@H](C)c3ccccc3-n3ccnn3)ccn2)cc1 ZINC000552255526 941615218 /nfs/dbraw/zinc/61/52/18/941615218.db2.gz JSLWWRZMNNRPSR-KRWDZBQOSA-N 0 3 401.470 4.314 20 0 HIADHN CO[C@@H]1C[C@H](c2ccccc2)CC[C@H]1NCC(=O)Nc1ccccc1Br ZINC000552268110 941618179 /nfs/dbraw/zinc/61/81/79/941618179.db2.gz ABAGHLIKTBXEFW-NSISKUIASA-N 0 3 417.347 4.329 20 0 HIADHN COc1ccc([C@H](Cc2ccncc2)N[C@H]2CCN(C(C)=O)c3ccccc32)cc1 ZINC000552277004 941621107 /nfs/dbraw/zinc/62/11/07/941621107.db2.gz ODWRRGJOQKCELA-ZEQRLZLVSA-N 0 3 401.510 4.462 20 0 HIADHN C[C@@H](N[C@H]1CCC(C)(C)c2ccc(Br)cc21)C1(S(C)(=O)=O)CC1 ZINC000552341150 941638297 /nfs/dbraw/zinc/63/82/97/941638297.db2.gz GRMPOVYUFKRWIW-WBMJQRKESA-N 0 3 400.382 4.117 20 0 HIADHN C[C@@H](Cn1cc(Br)cn1)N[C@@H](CCO)c1ccc(Cl)c(Cl)c1 ZINC000552342551 941638816 /nfs/dbraw/zinc/63/88/16/941638816.db2.gz OCSKAONNQOPKKU-BONVTDFDSA-N 0 3 407.139 4.054 20 0 HIADHN NC(=O)[C@H](NCCCCOc1ccc(Cl)cc1)c1ccc(Br)cc1 ZINC000552389068 941653578 /nfs/dbraw/zinc/65/35/78/941653578.db2.gz KQQWWEVGYPUQQZ-QGZVFWFLSA-N 0 3 411.727 4.078 20 0 HIADHN O=C([C@H]1CN(Cc2ccccc2)CCC1(F)F)N1CCC(Cc2cccnc2)CC1 ZINC000552410170 941661441 /nfs/dbraw/zinc/66/14/41/941661441.db2.gz MPPNPLGEXLHHPQ-JOCHJYFZSA-N 0 3 413.512 4.020 20 0 HIADHN Cc1nn(C(C)(C)C)cc1[C@@H](C)NC(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000552434135 941669831 /nfs/dbraw/zinc/66/98/31/941669831.db2.gz QLCTZRYIUNUUDV-OXQOHEQNSA-N 0 3 418.532 4.281 20 0 HIADHN CC(C)Cn1cc(NC(=O)N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)c(C(F)F)n1 ZINC000552490399 941687204 /nfs/dbraw/zinc/68/72/04/941687204.db2.gz QNLNSORAXKLMIT-RDJZCZTQSA-N 0 3 405.493 4.261 20 0 HIADHN CNC(=O)c1ccc(CN[C@H](CCCOC)c2ccc(Br)cc2)cc1 ZINC000552918384 941802623 /nfs/dbraw/zinc/80/26/23/941802623.db2.gz KKSNWQQNWCPKRH-LJQANCHMSA-N 0 3 405.336 4.066 20 0 HIADHN CNc1ccc(Cl)c(C(=O)NCCCCN2CCN(c3cccc(C)c3)CC2)c1 ZINC000552980100 941811600 /nfs/dbraw/zinc/81/16/00/941811600.db2.gz MMNOTEHLDAEVDT-UHFFFAOYSA-N 0 3 414.981 4.022 20 0 HIADHN Cc1cc(NC(=O)CN[C@@H](C[C@@H]2CCOC2)c2ccccc2)n(-c2ccccc2F)n1 ZINC000553063478 941826777 /nfs/dbraw/zinc/82/67/77/941826777.db2.gz XSILMEFAZKOKGY-RXVVDRJESA-N 0 3 422.504 4.016 20 0 HIADHN O=C(CCC1CCOCC1)N(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000553197634 941847963 /nfs/dbraw/zinc/84/79/63/941847963.db2.gz VTEBNLYXKRRAMF-VWLOTQADSA-N 0 3 421.585 4.282 20 0 HIADHN COc1cc(C)c([C@@H](C)NC(=O)CN[C@H](c2ccc(F)c(C)c2)C2CC2)cc1OC ZINC000553283703 941860452 /nfs/dbraw/zinc/86/04/52/941860452.db2.gz FCSLYIWANXOIAW-GYCJOSAFSA-N 0 3 414.521 4.378 20 0 HIADHN Cc1cccc(C)c1NC(=O)CNC(=O)[C@H](C)N[C@@H](c1ccc(Cl)cc1)C(C)C ZINC000553368180 941873732 /nfs/dbraw/zinc/87/37/32/941873732.db2.gz USLCTNMTQXQVLY-LAUBAEHRSA-N 0 3 415.965 4.387 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)C1CCN(c2nc3ccccc3s2)CC1 ZINC000553493200 941895696 /nfs/dbraw/zinc/89/56/96/941895696.db2.gz VTDRNPOZHMJXFF-UHFFFAOYSA-N 0 3 414.619 4.237 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)c2cnc3onc(C(C)C)c3c2)N(C)C)cc1 ZINC000553673184 941941858 /nfs/dbraw/zinc/94/18/58/941941858.db2.gz JUDOTSHXJWBRGK-HXUWFJFHSA-N 0 3 410.518 4.166 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)c2cc(Br)cs2)N(C)C)cc1 ZINC000553672659 941941894 /nfs/dbraw/zinc/94/18/94/941941894.db2.gz MSBPDICPTRHVEF-MRXNPFEDSA-N 0 3 411.365 4.331 20 0 HIADHN Cc1oc(-c2ccccc2)nc1CC(=O)NC[C@H](c1ccc(OC(C)C)cc1)N(C)C ZINC000553694146 941945637 /nfs/dbraw/zinc/94/56/37/941945637.db2.gz KGYJWWRGNJIJPL-HSZRJFAPSA-N 0 3 421.541 4.399 20 0 HIADHN CC[C@@H](NC(=O)N[C@@H](CN1CCCC1)c1ccccc1)c1ccc(OC)c(OC)c1 ZINC000553734420 941954950 /nfs/dbraw/zinc/95/49/50/941954950.db2.gz YFTHGOXWDLFULO-RTWAWAEBSA-N 0 3 411.546 4.291 20 0 HIADHN Cc1nn(-c2ccccc2C)c2sc(C(=O)N3CC[C@H](N4CCCC4)[C@H]3C)cc12 ZINC000553774393 941964817 /nfs/dbraw/zinc/96/48/17/941964817.db2.gz KZMAKQMFVUWPAJ-XLIONFOSSA-N 0 3 408.571 4.403 20 0 HIADHN C[C@@H]1C[C@H]1N1CCN(C(=O)c2cc(Cl)cc(Br)c2F)C[C@@H](C)C1 ZINC000553782957 941967771 /nfs/dbraw/zinc/96/77/71/941967771.db2.gz GAQFORVOSUGXMY-FIXISWKDSA-N 0 3 403.723 4.044 20 0 HIADHN O=C(Nc1ccccc1NC(=O)N1CCCC1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000553807825 941973842 /nfs/dbraw/zinc/97/38/42/941973842.db2.gz PQEJGXNJTHQPQM-IBGZPJMESA-N 0 3 424.520 4.304 20 0 HIADHN CC[C@H](c1ccccc1)N(CC)CC(=O)NC1CCN(C(=O)C2CCCCC2)CC1 ZINC000553845231 941982519 /nfs/dbraw/zinc/98/25/19/941982519.db2.gz VDIZKWITVODKPY-HSZRJFAPSA-N 0 3 413.606 4.147 20 0 HIADHN OC[C@H](NC[C@@H](O)Cc1cccc(Cl)c1)c1ccc(Cl)cc1C(F)(F)F ZINC000553893606 941991979 /nfs/dbraw/zinc/99/19/79/941991979.db2.gz AGCLUQPKPRSTKD-YOEHRIQHSA-N 0 3 408.247 4.239 20 0 HIADHN c1ccc(CN2CCCO[C@H](CN3CCCC[C@@H]3c3nnc(C4CCC4)o3)C2)cc1 ZINC000553923701 941999447 /nfs/dbraw/zinc/99/94/47/941999447.db2.gz AXZZFBSBQDKOEA-FCHUYYIVSA-N 0 3 410.562 4.155 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)[C@H]2C[C@@H]2c2c(F)cccc2F)N(C)C)cc1 ZINC000554011491 942018793 /nfs/dbraw/zinc/01/87/93/942018793.db2.gz DQNCNYGMNKFLLY-WFXMLNOXSA-N 0 3 402.485 4.275 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)c2ccc(Br)s2)N(C)C)cc1 ZINC000554039496 942023189 /nfs/dbraw/zinc/02/31/89/942023189.db2.gz PTIGKFZZVJSAHD-OAHLLOKOSA-N 0 3 411.365 4.331 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)Nc1ccc(C(=O)NC(C)(C)C)cc1)c1ccco1 ZINC000554135410 942046527 /nfs/dbraw/zinc/04/65/27/942046527.db2.gz KKXBXAGQUZUMFJ-CRAIPNDOSA-N 0 3 400.523 4.059 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)Nc1ccc(C)cc1OC[C@H]1CCCO1 ZINC000554180328 942059953 /nfs/dbraw/zinc/05/99/53/942059953.db2.gz WXFMZPNPXPFVDR-HXUWFJFHSA-N 0 3 403.567 4.283 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)Nc1ccc(C(=O)NCC(C)C)cc1C)c1ccco1 ZINC000554182094 942060481 /nfs/dbraw/zinc/06/04/81/942060481.db2.gz OGRASFAPIFTGCS-XLIONFOSSA-N 0 3 414.550 4.225 20 0 HIADHN CN(CCCN1CCN(C)CC1)C(=O)C1(c2ccc(C(C)(C)C)cc2)CCCCC1 ZINC000554308198 942098618 /nfs/dbraw/zinc/09/86/18/942098618.db2.gz PPTJCVTXKJDFLJ-UHFFFAOYSA-N 0 3 413.650 4.282 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1cccc(NC(=O)c2ccoc2)c1)c1ccco1 ZINC000554428682 942140552 /nfs/dbraw/zinc/14/05/52/942140552.db2.gz XRTTVTGXAHYXDY-HNAYVOBHSA-N 0 3 410.474 4.376 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)N[C@H](c2ccc(Cl)cc2)C2CC2)cc1 ZINC000554468327 942153867 /nfs/dbraw/zinc/15/38/67/942153867.db2.gz NKQDAKAWRAMKNI-SFTDATJTSA-N 0 3 401.938 4.402 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)Nc1cccc(CC(=O)OC(C)(C)C)c1 ZINC000554481159 942157949 /nfs/dbraw/zinc/15/79/49/942157949.db2.gz LDAKSPVDTDMNFC-UHFFFAOYSA-N 0 3 403.567 4.301 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](N[C@H]2CCC23CCOCC3)c2ccc(F)c(F)c2)c1 ZINC000554558916 942167404 /nfs/dbraw/zinc/16/74/04/942167404.db2.gz NEFLKVRBJOQEPC-SFTDATJTSA-N 0 3 421.509 4.007 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3ccc(Oc4ccccc4)cn3)CC2)C[C@H](C)O1 ZINC000554596286 942173794 /nfs/dbraw/zinc/17/37/94/942173794.db2.gz NZXFCKURSDKABP-BGYRXZFFSA-N 0 3 423.557 4.225 20 0 HIADHN Cc1ccc(-c2nc3cc(F)ccc3n2C)cc1NC(=O)N(CCN(C)C)C(C)C ZINC000554628787 942179755 /nfs/dbraw/zinc/17/97/55/942179755.db2.gz WLILYIOYBHRIEX-UHFFFAOYSA-N 0 3 411.525 4.492 20 0 HIADHN Cc1c(C(=O)N[C@H](CN(C)C)c2ccc(F)cc2)cnn1-c1cccc(Cl)c1 ZINC000554656441 942190042 /nfs/dbraw/zinc/19/00/42/942190042.db2.gz ZREZWYSWTBDDDT-HXUWFJFHSA-N 0 3 400.885 4.006 20 0 HIADHN CCOc1c(Cl)cc(CNC[C@@H](O)CO[C@H]2CCCc3ccccc32)cc1OC ZINC000554831632 942271158 /nfs/dbraw/zinc/27/11/58/942271158.db2.gz WTTNSUGNQZLFRM-NQIIRXRSSA-N 0 3 419.949 4.292 20 0 HIADHN COC(=O)c1cc(CNCc2ccccc2-c2ccc(Cn3cccn3)cc2)cn1C ZINC000554859299 942294447 /nfs/dbraw/zinc/29/44/47/942294447.db2.gz MRDZUKBGQKQGFG-UHFFFAOYSA-N 0 3 414.509 4.013 20 0 HIADHN CN(C)C[C@@H](NC(=O)Nc1cccc(OC[C@H]2CCCO2)c1)c1ccc(Cl)cc1 ZINC000554871292 942302088 /nfs/dbraw/zinc/30/20/88/942302088.db2.gz RIPDLLZTVDZXOM-NHCUHLMSSA-N 0 3 417.937 4.322 20 0 HIADHN COC(=O)[C@@H](C)Cc1ccc(NC(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)cc1 ZINC000554914993 942317584 /nfs/dbraw/zinc/31/75/84/942317584.db2.gz JHQLZIOXMVUAHC-MGPUTAFESA-N 0 3 417.937 4.116 20 0 HIADHN Cc1ccc(Cl)cc1NC(=O)CN[C@@H]1CCN(C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000554948756 942330063 /nfs/dbraw/zinc/33/00/63/942330063.db2.gz CEACFRXKUSBPHG-XLIONFOSSA-N 0 3 410.320 4.414 20 0 HIADHN CSc1cccc(NC(=O)[C@H](C)N[C@H]2CCN(C)[C@@H]2c2ccc(Cl)cc2)c1 ZINC000554950391 942330867 /nfs/dbraw/zinc/33/08/67/942330867.db2.gz YOAFWIFDLFFVRH-PNHOKKKMSA-N 0 3 403.979 4.424 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(F)cc2)CC1)c1ccc2c(c1)CCCCC2=O ZINC000555034169 942364607 /nfs/dbraw/zinc/36/46/07/942364607.db2.gz CQUXZYAMTZAAJI-UHFFFAOYSA-N 0 3 424.516 4.008 20 0 HIADHN Fc1cc(Br)cc(CN(Cc2ccc(-n3cncn3)cc2)C2CC2)c1 ZINC000555069499 942376155 /nfs/dbraw/zinc/37/61/55/942376155.db2.gz DUJZOIQLYUGCSK-UHFFFAOYSA-N 0 3 401.283 4.334 20 0 HIADHN CCn1c(-c2sccc2C)nnc1N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000555076349 942378758 /nfs/dbraw/zinc/37/87/58/942378758.db2.gz IWYNTUMTZGAFIU-HDICACEKSA-N 0 3 417.623 4.051 20 0 HIADHN CCN1CC[C@H](N[C@H](C)C(=O)Nc2ccc(OC)cc2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000555125028 942391642 /nfs/dbraw/zinc/39/16/42/942391642.db2.gz BFMMRLCPZXFDRF-OREJSRFESA-N 0 3 419.928 4.240 20 0 HIADHN COc1cc(OC)cc(C2(F)CCN(CCC(=O)Nc3cccc(F)c3)CC2)c1 ZINC000555125132 942391822 /nfs/dbraw/zinc/39/18/22/942391822.db2.gz GYNQLAXQAULLAZ-UHFFFAOYSA-N 0 3 404.457 4.132 20 0 HIADHN CC(C)N1CC[C@@H](N[C@@H](C)C(=O)N(C)Cc2ccccc2)[C@H]1c1ccc(F)c(F)c1 ZINC000555125673 942392724 /nfs/dbraw/zinc/39/27/24/942392724.db2.gz LKKBZOPHZPZGDA-JJEOQYAHSA-N 0 3 415.528 4.125 20 0 HIADHN CC(C)N1CC[C@@H](NCc2cnn(C)c2C(F)(F)F)[C@H]1c1ccc(F)c(F)c1 ZINC000555128340 942394924 /nfs/dbraw/zinc/39/49/24/942394924.db2.gz GIVOYLVKGDPFOK-IAGOWNOFSA-N 0 3 402.411 4.031 20 0 HIADHN CCN1CC[C@H](N[C@@H](C)C(=O)Nc2cccc(C)c2)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000555132483 942397172 /nfs/dbraw/zinc/39/71/72/942397172.db2.gz IZVIKTAMMYPNPH-JBYOLUDKSA-N 0 3 405.464 4.164 20 0 HIADHN CC[C@H](N[C@@H](CN(C)C)c1ccc(Cl)cc1)c1ccccc1OCC(=O)N(C)C ZINC000555226498 942437079 /nfs/dbraw/zinc/43/70/79/942437079.db2.gz SKJBHPBNECRSGV-SFTDATJTSA-N 0 3 417.981 4.151 20 0 HIADHN COCCc1ccc(OC[C@@H](O)CN2CC=C(c3ccc(Cl)cc3)CC2)cc1 ZINC000555417212 942522651 /nfs/dbraw/zinc/52/26/51/942522651.db2.gz AGNSEOXYLIWTQJ-QFIPXVFZSA-N 0 3 401.934 4.058 20 0 HIADHN CC(C)[C@@H](NC1CCC2(CC1)c1ccccc1NC2=O)c1nc(-c2cccnc2)no1 ZINC000555419794 942524144 /nfs/dbraw/zinc/52/41/44/942524144.db2.gz AWVZGQJLDVXXEQ-STWKMJTMSA-N 0 3 417.513 4.251 20 0 HIADHN Cc1ccc(CNC(=O)c2cccc(CNCCC(=O)Nc3ccccc3)c2)cc1 ZINC000555575621 942649137 /nfs/dbraw/zinc/64/91/37/942649137.db2.gz QXIWQRVNEXFBPC-UHFFFAOYSA-N 0 3 401.510 4.043 20 0 HIADHN COc1ccc2nc(CNCCc3cnc(SC4CCCC4)nc3)sc2c1 ZINC000555637936 942683704 /nfs/dbraw/zinc/68/37/04/942683704.db2.gz LBPAHILBIRGFSQ-UHFFFAOYSA-N 0 3 400.573 4.462 20 0 HIADHN CCO[C@@H]1C[C@@H](NCc2ccc(Br)cc2C(F)(F)F)[C@@H]1n1cccn1 ZINC000555647449 942685349 /nfs/dbraw/zinc/68/53/49/942685349.db2.gz CCGVCJOTWIASDL-OAGGEKHMSA-N 0 3 418.257 4.173 20 0 HIADHN COc1cccc(OC)c1OC[C@@H](O)CN1CCc2ccccc2[C@@H]1c1ccccc1 ZINC000555659510 942692756 /nfs/dbraw/zinc/69/27/56/942692756.db2.gz SAELONCMRSEHPN-OFVILXPXSA-N 0 3 419.521 4.091 20 0 HIADHN CC[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)NCCCCN1C[C@H](C)O[C@@H](C)C1 ZINC000555852499 942753649 /nfs/dbraw/zinc/75/36/49/942753649.db2.gz APPDYCBSRCBFEF-JENIJYKNSA-N 0 3 414.512 4.280 20 0 HIADHN COc1cnccc1[C@H](C)NC[C@H](O)CO[C@@H](c1ccccc1)c1ccc(C)cc1 ZINC000556018218 942786614 /nfs/dbraw/zinc/78/66/14/942786614.db2.gz REURDCIUXJXZIF-JTJYXVOQSA-N 0 3 406.526 4.216 20 0 HIADHN CC[C@H](N[C@H](C)c1cc(F)ccc1N1CCN(C)CC1)c1ccc(C(=O)OC)cc1 ZINC000556076142 942801588 /nfs/dbraw/zinc/80/15/88/942801588.db2.gz KFYQMXLHYUOQJI-VGSWGCGISA-N 0 3 413.537 4.166 20 0 HIADHN CN1CC[C@H](NC(=O)C(C)(C)c2ccc(Br)cc2)[C@H]1c1ccccc1 ZINC000556187551 942815773 /nfs/dbraw/zinc/81/57/73/942815773.db2.gz GECAFKDBJBVVAB-RBUKOAKNSA-N 0 3 401.348 4.288 20 0 HIADHN C[C@H](Cn1cc(Br)ccc1=O)N[C@@H]1CCCOc2c(Cl)cccc21 ZINC000556257693 942827603 /nfs/dbraw/zinc/82/76/03/942827603.db2.gz JZXAJMAPMVDNRT-MLGOLLRUSA-N 0 3 411.727 4.156 20 0 HIADHN CN(C(=O)c1ccc(NCc2coc(-c3ccccc3)n2)cc1)[C@H]1CCCN(C)C1 ZINC000556337368 942844704 /nfs/dbraw/zinc/84/47/04/942844704.db2.gz NOBXRLUEORGPSS-QFIPXVFZSA-N 0 3 404.514 4.120 20 0 HIADHN CN(C(=O)c1ccc(NCc2ccccc2OCC2CC2)cc1)[C@@H]1CCCN(C)C1 ZINC000556338857 942845417 /nfs/dbraw/zinc/84/54/17/942845417.db2.gz PJUSHLCQVPUNGS-HSZRJFAPSA-N 0 3 407.558 4.254 20 0 HIADHN O=C(c1ccccc1)N1CCC(CNCc2c(F)cccc2OC(F)(F)F)CC1 ZINC000556386102 942854140 /nfs/dbraw/zinc/85/41/40/942854140.db2.gz LOHPFLINMXUWCX-UHFFFAOYSA-N 0 3 410.411 4.366 20 0 HIADHN C[C@@H](Cn1ncc2ccccc2c1=O)NCc1cnc(-c2ccc(Cl)cc2)s1 ZINC000556415830 942860603 /nfs/dbraw/zinc/86/06/03/942860603.db2.gz GXABNGYQBYVYRG-AWEZNQCLSA-N 0 3 410.930 4.352 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)N1CCc2ccc(Br)cc2C1 ZINC000556474946 942879327 /nfs/dbraw/zinc/87/93/27/942879327.db2.gz DJNAIOLKKQXLNU-UHFFFAOYSA-N 0 3 413.315 4.455 20 0 HIADHN CSc1ccc([C@@H](C)NCc2cccc(N3C(=O)N[C@](C)(C4CC4)C3=O)c2)cc1 ZINC000556607927 942913285 /nfs/dbraw/zinc/91/32/85/942913285.db2.gz IPMOGPURRLISQX-IQMFZBJNSA-N 0 3 409.555 4.484 20 0 HIADHN CCOc1ccc([C@H](C)NCc2cccc(N3C(=O)N[C@](C)(C4CC4)C3=O)c2)cc1 ZINC000556611396 942915220 /nfs/dbraw/zinc/91/52/20/942915220.db2.gz OESJSDCEYAKCOB-UPCLLVRISA-N 0 3 407.514 4.161 20 0 HIADHN C[C@@H]1CCc2c(sc3nc(CCC(=O)Nc4ccccc4CN(C)C)[nH]c(=O)c32)C1 ZINC000556665136 942928685 /nfs/dbraw/zinc/92/86/85/942928685.db2.gz FTKFYNCOXQBWKI-CQSZACIVSA-N 0 3 424.570 4.155 20 0 HIADHN CC(C)Cc1cccc([C@@H](C)C(=O)NCc2ccccc2CN2CCC(O)CC2)c1 ZINC000556892804 942954393 /nfs/dbraw/zinc/95/43/93/942954393.db2.gz NNQGPHYHYKDPRN-HXUWFJFHSA-N 0 3 408.586 4.262 20 0 HIADHN CCN(CC)C(=O)Nc1ccc([C@@H](C)NCc2ccc(C[S@@](C)=O)cc2)cc1 ZINC000556897920 942957994 /nfs/dbraw/zinc/95/79/94/942957994.db2.gz CWGWRMXNPPWCJN-JYRCXFKTSA-N 0 3 401.576 4.290 20 0 HIADHN c1csc(-c2nn(-c3ccccc3)cc2CN2CCC(O[C@H]3CCOC3)CC2)c1 ZINC000556906438 942960040 /nfs/dbraw/zinc/96/00/40/942960040.db2.gz XBKDECIWQGDOPE-NRFANRHFSA-N 0 3 409.555 4.371 20 0 HIADHN CNC(=O)COc1cccc(CN[C@H](Cc2cccc(F)c2)c2cccc(F)c2)c1 ZINC000556912281 942963204 /nfs/dbraw/zinc/96/32/04/942963204.db2.gz PYBBSPVHRCPPBC-HSZRJFAPSA-N 0 3 410.464 4.163 20 0 HIADHN Cc1cc(Br)cc(C)c1N1CCC[C@H](N[C@H](C)c2nccnc2C)C1 ZINC000556924105 942968307 /nfs/dbraw/zinc/96/83/07/942968307.db2.gz FXSKDXCEWZHRKE-AEFFLSMTSA-N 0 3 403.368 4.484 20 0 HIADHN Cc1c[nH]c(-c2ccccc2NC(=O)[C@H]2CN(Cc3ccccc3)CCC2(F)F)n1 ZINC000556948595 942976669 /nfs/dbraw/zinc/97/66/69/942976669.db2.gz MUEONJUEPTXLAE-LJQANCHMSA-N 0 3 410.468 4.481 20 0 HIADHN CCOc1ccc(-c2nc(C(=O)Nc3cccc(CN4CC[C@@H](O)C4)c3)cs2)cc1 ZINC000557024043 942997204 /nfs/dbraw/zinc/99/72/04/942997204.db2.gz VCAIXZLWCKRENV-LJQANCHMSA-N 0 3 423.538 4.028 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)c1ccc(OC2CCC2)cc1Cl ZINC000557023277 942997479 /nfs/dbraw/zinc/99/74/79/942997479.db2.gz ODOGWFYLUHKTER-KRWDZBQOSA-N 0 3 400.906 4.090 20 0 HIADHN C[C@H](CC(=O)N1CC[C@]2(CCN(Cc3ccccc3)C2)C1)C(=O)c1cccc(F)c1 ZINC000557127527 943026911 /nfs/dbraw/zinc/02/69/11/943026911.db2.gz PUZYWKZUJAEYPM-CLOONOSVSA-N 0 3 408.517 4.159 20 0 HIADHN C[C@@H](C(=O)N(Cc1ccccc1Br)C1CCN(C)CC1)C(C)(F)F ZINC000557160853 943034903 /nfs/dbraw/zinc/03/49/03/943034903.db2.gz YPISIWZFKYJKEK-ZDUSSCGKSA-N 0 3 403.311 4.163 20 0 HIADHN CCCCNC(=O)c1ccc(CN[C@@H](C)c2ccc(NC(=O)NC3CC3)cc2)cc1 ZINC000557247392 943060946 /nfs/dbraw/zinc/06/09/46/943060946.db2.gz PLBKEXSXMPHZMW-KRWDZBQOSA-N 0 3 408.546 4.351 20 0 HIADHN CC[C@H](C)[C@@H](NCC(=O)Nc1cccc(C(=O)N(C)C)c1)c1ccc(Cl)cc1 ZINC000557543926 943200989 /nfs/dbraw/zinc/20/09/89/943200989.db2.gz XHHJWOBZWCCAON-YCRPNKLZSA-N 0 3 401.938 4.357 20 0 HIADHN COc1ccc(C(=O)Nc2cc(C)cc(N3CCN(C(C)C)CC3)c2)c(C)c1OC ZINC000557649417 943247853 /nfs/dbraw/zinc/24/78/53/943247853.db2.gz LDGJAKCYLIAEHP-UHFFFAOYSA-N 0 3 411.546 4.103 20 0 HIADHN CC[C@H](C)N[C@H](CNc1cc(C(F)(F)F)nc(-c2ccncc2)n1)c1ccco1 ZINC000557695092 943261110 /nfs/dbraw/zinc/26/11/10/943261110.db2.gz SUMKJDYAJPJRGI-DZGCQCFKSA-N 0 3 405.424 4.114 20 0 HIADHN COCCCCN(Cc1ccccc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)[C@@H]1C ZINC000557885530 943320602 /nfs/dbraw/zinc/32/06/02/943320602.db2.gz UFSOLRNIKDKKGM-ZJSXRUAMSA-N 0 3 409.574 4.288 20 0 HIADHN C/C=C\c1ccc(OC[C@H](O)CNCc2csc(Br)c2)c(OC)c1 ZINC000557888740 943321630 /nfs/dbraw/zinc/32/16/30/943321630.db2.gz HTDBNJRLSXGTSS-ABCZVMIZSA-N 0 3 412.349 4.082 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)c1sc(C)c(Br)c1OC)c1ccco1 ZINC000557911275 943326531 /nfs/dbraw/zinc/32/65/31/943326531.db2.gz DHCKKLVQKMGUBH-ZYHUDNBSSA-N 0 3 415.353 4.280 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)C1CCC(NC(=O)CC2CCCC2)CC1)c1ccco1 ZINC000557912638 943327462 /nfs/dbraw/zinc/32/74/62/943327462.db2.gz WCWOHHIJDQCAAU-VWEINGBSSA-N 0 3 417.594 4.080 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3cc(C(F)(F)F)ccc3F)CC2)C[C@@H](C)O1 ZINC000557914498 943328267 /nfs/dbraw/zinc/32/82/67/943328267.db2.gz OYUWHOCMFGSPRP-ZIAGYGMSSA-N 0 3 417.447 4.198 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)[C@H]2C[C@@H]2c2cccc(F)c2F)N(C)C)cc1 ZINC000557934181 943333349 /nfs/dbraw/zinc/33/33/49/943333349.db2.gz DDFZRBOKQCIFQY-DYXWJJEUSA-N 0 3 402.485 4.275 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)[C@@H]2[C@@H](c3ccccc3)C2(F)F)N(C)C)cc1 ZINC000557936936 943333886 /nfs/dbraw/zinc/33/38/86/943333886.db2.gz SHPQLVOACYJKBJ-HBMCJLEFSA-N 0 3 402.485 4.242 20 0 HIADHN CCO[C@H](C)c1ncc(C(=O)NC[C@@H](c2ccc(CC(C)C)cc2)N(C)C)s1 ZINC000557985746 943347363 /nfs/dbraw/zinc/34/73/63/943347363.db2.gz PJZBVSDPUYGMNB-APWZRJJASA-N 0 3 403.592 4.472 20 0 HIADHN CCOC(=O)c1c2c(sc1NC(=O)c1nc(CC)oc1C)C(C)(C)NC(C)(C)C2 ZINC000558011212 943353984 /nfs/dbraw/zinc/35/39/84/943353984.db2.gz LXILQXNNZZHQGN-UHFFFAOYSA-N 0 3 419.547 4.195 20 0 HIADHN Cc1onc(-c2c(F)cccc2Cl)c1C(=O)N1CCN([C@@H]2C[C@H]2C)C[C@@H](C)C1 ZINC000558026667 943360000 /nfs/dbraw/zinc/36/00/00/943360000.db2.gz XRNKDNOYJCPDDH-PBFPGSCMSA-N 0 3 405.901 4.245 20 0 HIADHN CC[C@@H](N[C@H]1CCN(Cc2ccc(OC)cc2OC)C1=O)c1cccc(Cl)c1 ZINC000558240092 943453312 /nfs/dbraw/zinc/45/33/12/943453312.db2.gz ABQOMKPFENPFDK-UXHICEINSA-N 0 3 402.922 4.199 20 0 HIADHN C[C@H](CC(=O)Nc1ccc(NC(=O)C2CC2)cc1)N[C@@H]1c2ccc(F)cc2O[C@H]1C ZINC000558256066 943462080 /nfs/dbraw/zinc/46/20/80/943462080.db2.gz HGNFNSWWJGTDGQ-QLEMLULZSA-N 0 3 411.477 4.003 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)NCc2ccc(OC(F)F)cc2)N(C)C)cc1 ZINC000558359861 943524500 /nfs/dbraw/zinc/52/45/00/943524500.db2.gz FLFOBXZYMDGCBF-HXUWFJFHSA-N 0 3 421.488 4.177 20 0 HIADHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)Nc1nc(-c2ccc(SC)cc2)ns1 ZINC000558459419 943565208 /nfs/dbraw/zinc/56/52/08/943565208.db2.gz UOTNOGMOAUOBBQ-CABCVRRESA-N 0 3 403.577 4.018 20 0 HIADHN Cc1nc(C)c(C(=O)N(Cc2ccccc2Br)C2CCN(C)CC2)s1 ZINC000558609365 943616919 /nfs/dbraw/zinc/61/69/19/943616919.db2.gz DTUBQSUNUWZHQR-UHFFFAOYSA-N 0 3 422.392 4.259 20 0 HIADHN C[C@H](c1nnc(-c2ccccc2F)s1)N1CCC(CCCN2CCOCC2)CC1 ZINC000558722287 943632731 /nfs/dbraw/zinc/63/27/31/943632731.db2.gz ASRSEGADLFGGOX-QGZVFWFLSA-N 0 3 418.582 4.230 20 0 HIADHN C[C@H](N[C@@H]1CN(Cc2ccccc2)C[C@H]1c1ccccc1)C(=O)c1c[nH]c2ncccc12 ZINC000558737697 943635720 /nfs/dbraw/zinc/63/57/20/943635720.db2.gz LPHANFYDMIVFTA-PNTFMKQHSA-N 0 3 424.548 4.392 20 0 HIADHN COCCCn1nccc1CN[C@H]1CCN(C(C)C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000558781073 943661401 /nfs/dbraw/zinc/66/14/01/943661401.db2.gz KDGWKMQXCGLOJG-SFTDATJTSA-N 0 3 408.949 4.026 20 0 HIADHN Cc1ccc(CNCc2ccc(C)cc2-c2cnn(C)c2)c(OC[C@H]2CCOC2)c1 ZINC000558783109 943662231 /nfs/dbraw/zinc/66/22/31/943662231.db2.gz WMWSOUOJKUINKA-FQEVSTJZSA-N 0 3 405.542 4.409 20 0 HIADHN O=C(NCC1CC(c2ccccc2)C1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000558799284 943668553 /nfs/dbraw/zinc/66/85/53/943668553.db2.gz ULDQWQFUTMMGFK-UHFFFAOYSA-N 0 3 409.496 4.285 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N(C)C[C@@H]2OCCc3ccccc32)N2CCCC2)cc1 ZINC000558826132 943681293 /nfs/dbraw/zinc/68/12/93/943681293.db2.gz SCBGIGKWKJWKCA-ZEQRLZLVSA-N 0 3 407.558 4.087 20 0 HIADHN COCc1cccc(CNC(=O)CN[C@@H](c2cccc(C(F)(F)F)c2)C2CC2)c1 ZINC000558864036 943707162 /nfs/dbraw/zinc/70/71/62/943707162.db2.gz LCTNJRCGBAWUAG-OAQYLSRUSA-N 0 3 406.448 4.209 20 0 HIADHN CN(C)C[C@@H](NC(=O)N[C@H](c1nccs1)c1ccccc1)c1ccc(Cl)cc1 ZINC000558895265 943727041 /nfs/dbraw/zinc/72/70/41/943727041.db2.gz MTFLZGKICMCJCC-MOPGFXCFSA-N 0 3 414.962 4.488 20 0 HIADHN CCN1CC[C@@H](NCC(=O)Nc2cc(C(C)(C)C)no2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000558895632 943728727 /nfs/dbraw/zinc/72/87/27/943728727.db2.gz KIYCIANMSJFIEF-OXQOHEQNSA-N 0 3 422.932 4.128 20 0 HIADHN Cc1ccccc1CN(C)C(=O)CN[C@H]1CCN(C(C)C)[C@H]1c1ccc(F)c(F)c1 ZINC000558899974 943735598 /nfs/dbraw/zinc/73/55/98/943735598.db2.gz ZIISRIQPHWRLQE-UPVQGACJSA-N 0 3 415.528 4.045 20 0 HIADHN CC(C)(C)N1CC[C@@H](NCC(=O)NCc2cccs2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000558901334 943736702 /nfs/dbraw/zinc/73/67/02/943736702.db2.gz JDXKSNUBAKDKFE-QUCCMNQESA-N 0 3 423.985 4.361 20 0 HIADHN CN(C)C[C@H](NC(=O)N[C@@H](c1ccccc1)[C@@H]1CCOC1)c1ccc(Cl)cc1 ZINC000558906293 943739273 /nfs/dbraw/zinc/73/92/73/943739273.db2.gz OCDMLASOBFFWHX-GIVPXCGWSA-N 0 3 401.938 4.020 20 0 HIADHN CNS(=O)(=O)c1cccc([C@H](C)N[C@@H](c2cccc(C(F)(F)F)c2)C2CC2)c1 ZINC000558973323 943777551 /nfs/dbraw/zinc/77/75/51/943777551.db2.gz WOAJWCYNSNYEKD-ORAYPTAESA-N 0 3 412.477 4.415 20 0 HIADHN CN(C)C[C@@H](NC(=O)CN(Cc1cccnc1)c1ccccc1)c1ccc(Cl)cc1 ZINC000558974267 943778967 /nfs/dbraw/zinc/77/89/67/943778967.db2.gz WWBSUZYVKDQYAM-HSZRJFAPSA-N 0 3 422.960 4.161 20 0 HIADHN Cc1cc(C[C@@H](C)NCc2c(Cl)cccc2N2CCOCC2)n(-c2ccccc2)n1 ZINC000559282741 943889994 /nfs/dbraw/zinc/88/99/94/943889994.db2.gz UWYUPVGTPDCNQO-GOSISDBHSA-N 0 3 424.976 4.392 20 0 HIADHN O=C1CCCN1Cc1cccc(CN[C@H]2CCc3sc(Br)cc32)c1 ZINC000559741391 944042145 /nfs/dbraw/zinc/04/21/45/944042145.db2.gz LMFJGHBQNHMAOW-INIZCTEOSA-N 0 3 405.361 4.410 20 0 HIADHN CN(C)Cc1ccc(-c2noc([C@@H]3CC(=O)N(C)[C@@H]3c3cccc(Cl)c3)n2)cc1 ZINC000559740062 944042264 /nfs/dbraw/zinc/04/22/64/944042264.db2.gz RUTROAAUBIOZLW-UYAOXDASSA-N 0 3 410.905 4.139 20 0 HIADHN CN1CC[C@H](NCC(=O)N[C@@H](c2cccs2)c2ccc(F)cc2)[C@H]1c1ccccc1 ZINC000559777712 944049315 /nfs/dbraw/zinc/04/93/15/944049315.db2.gz TXCYHYGOLZIOEH-TUACAJSNSA-N 0 3 423.557 4.128 20 0 HIADHN CC[C@@H](Cn1cncn1)N[C@@H](c1cccc(F)c1)c1cccc(Br)c1 ZINC000559913403 944083637 /nfs/dbraw/zinc/08/36/37/944083637.db2.gz KMYOUEPRLATKHU-RBUKOAKNSA-N 0 3 403.299 4.338 20 0 HIADHN CN1CC[C@H](CN[C@H](c2cn[nH]n2)c2ccc(F)cc2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000559920748 944086043 /nfs/dbraw/zinc/08/60/43/944086043.db2.gz HQQXNWTYXMLORF-GQWLDOHISA-N 0 3 417.891 4.108 20 0 HIADHN CC[C@H]1CCCN1CC(=O)NC[C@H](c1c[nH]c2ccccc21)c1ccc(OC)cc1 ZINC000559986054 944112407 /nfs/dbraw/zinc/11/24/07/944112407.db2.gz LBVAKNMKABIPOK-UGKGYDQZSA-N 0 3 405.542 4.299 20 0 HIADHN COCC[C@H](NC(=O)N[C@H](C)C1=CCN(C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000560103714 944160478 /nfs/dbraw/zinc/16/04/78/944160478.db2.gz UTRRZLVUWRNMPT-ACJLOTCBSA-N 0 3 400.350 4.021 20 0 HIADHN CC(C)(C)CCNC(=O)CN[C@H](c1cccc(C(F)(F)F)c1)C1CCOCC1 ZINC000560180939 944189806 /nfs/dbraw/zinc/18/98/06/944189806.db2.gz MLNBTVLIXNKFIB-IBGZPJMESA-N 0 3 400.485 4.315 20 0 HIADHN Cc1cccn2c(=O)cc(CN(Cc3cccs3)C3Cc4ccccc4C3)nc12 ZINC000560185315 944190493 /nfs/dbraw/zinc/19/04/93/944190493.db2.gz WPBKBFWPCICCDI-UHFFFAOYSA-N 0 3 401.535 4.234 20 0 HIADHN COc1ccc([C@@H](CN(C)C)N[C@@H]2CCc3c2cc(Br)cc3F)cc1 ZINC000560261529 944210487 /nfs/dbraw/zinc/21/04/87/944210487.db2.gz ZJNSMXWPZGFDSP-WOJBJXKFSA-N 0 3 407.327 4.477 20 0 HIADHN COc1cccc2c1CCC[C@@H]2NCc1cccc(N2C(=O)N[C@](C)(C3CC3)C2=O)c1 ZINC000560265196 944211230 /nfs/dbraw/zinc/21/12/30/944211230.db2.gz GHCJPFWNGXNTGW-SQJMNOBHSA-N 0 3 419.525 4.087 20 0 HIADHN C[C@H](CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)NCc1cnc2n1CCCC2 ZINC000560265935 944212540 /nfs/dbraw/zinc/21/25/40/944212540.db2.gz MKEOAFRCDMSCTL-GFCCVEGCSA-N 0 3 414.859 4.399 20 0 HIADHN COc1ccc([C@@H](Cc2ccncc2)NCc2ccc(OCC(F)(F)F)nc2)cc1 ZINC000560514489 944240830 /nfs/dbraw/zinc/24/08/30/944240830.db2.gz NRPJRBCOKMZTJC-HXUWFJFHSA-N 0 3 417.431 4.500 20 0 HIADHN C[C@@H](N[C@@H](C)c1cccc(OCc2ccccn2)c1)c1ccc2c(c1)OCC(=O)N2 ZINC000560522825 944241379 /nfs/dbraw/zinc/24/13/79/944241379.db2.gz KOSSXEMPELUGKO-DLBZAZTESA-N 0 3 403.482 4.403 20 0 HIADHN CCc1nnc(NC(=O)[C@H](C)[C@H](C)N[C@@H](C)c2sccc2Br)s1 ZINC000560557513 944253313 /nfs/dbraw/zinc/25/33/13/944253313.db2.gz KLGVQSCEJCBLQH-UTLUCORTSA-N 0 3 417.398 4.238 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O[C@H]3CCOC3)CC2)c1)c1ccccc1Cl ZINC000560560926 944254540 /nfs/dbraw/zinc/25/45/40/944254540.db2.gz FSGLQSOSGWWEDI-FQEVSTJZSA-N 0 3 414.933 4.362 20 0 HIADHN COc1cccc(C2(N[C@@H](C)CC(=O)Nc3ccc(NC(=O)C4CC4)cc3)CC2)c1 ZINC000560573740 944259107 /nfs/dbraw/zinc/25/91/07/944259107.db2.gz JZVBOQFUFSBDEA-INIZCTEOSA-N 0 3 407.514 4.040 20 0 HIADHN CN(CCCN(C)C(=O)[C@H]1C[C@@H]1c1cccc(Cl)c1Cl)Cc1ccncc1 ZINC000560596353 944268632 /nfs/dbraw/zinc/26/86/32/944268632.db2.gz YKMQDJJZBFIFSQ-MSOLQXFVSA-N 0 3 406.357 4.472 20 0 HIADHN O=C(NCC1(c2ccncc2)CCCC1)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000560616781 944275588 /nfs/dbraw/zinc/27/55/88/944275588.db2.gz IPFFGODPRSVGBQ-NRFANRHFSA-N 0 3 413.512 4.167 20 0 HIADHN COC[C@H](C)Nc1ccccc1NC(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000560699245 944299612 /nfs/dbraw/zinc/29/96/12/944299612.db2.gz MKBSCWVOOAYPIP-HKUYNNGSSA-N 0 3 417.500 4.229 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)[C@H](C)Cc1c(C)nn(C)c1C)c1ccc(Cl)cc1 ZINC000560710861 944304531 /nfs/dbraw/zinc/30/45/31/944304531.db2.gz YKLFKKBCQDJFHQ-VFNWGFHPSA-N 0 3 404.986 4.068 20 0 HIADHN COc1ccccc1NC(=O)c1ccc(NC(=O)[C@H](C)N2CCC[C@@H](C)CC2)cc1 ZINC000560846961 944355828 /nfs/dbraw/zinc/35/58/28/944355828.db2.gz HTHICPLLUMUVTD-MSOLQXFVSA-N 0 3 409.530 4.397 20 0 HIADHN Cc1cc(OC(C)C)ccc1NC(=O)N(C)C1CCN(CCc2ccccn2)CC1 ZINC000560849378 944357492 /nfs/dbraw/zinc/35/74/92/944357492.db2.gz FORWYYYXLHERQE-UHFFFAOYSA-N 0 3 410.562 4.348 20 0 HIADHN Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)N(CCN(C)C)Cc1ccccc1 ZINC000560988373 944387726 /nfs/dbraw/zinc/38/77/26/944387726.db2.gz JYLBENUCJHBJCJ-UHFFFAOYSA-N 0 3 422.573 4.263 20 0 HIADHN Cc1ccc(CC(=O)N(Cc2ccncc2)[C@H]2CCCN(Cc3ccccc3)C2)cn1 ZINC000561059786 944421386 /nfs/dbraw/zinc/42/13/86/944421386.db2.gz KJWGTYARPGQTAF-VWLOTQADSA-N 0 3 414.553 4.021 20 0 HIADHN Cn1cc(CN2CCC[C@@H](C(=O)Nc3ccc(Cl)cn3)C2)c(-c2cccs2)n1 ZINC000561250787 944528707 /nfs/dbraw/zinc/52/87/07/944528707.db2.gz URZVLRHNSUIXCX-CQSZACIVSA-N 0 3 415.950 4.048 20 0 HIADHN CN(CCCN(C)C(=O)[C@@H]1CCn2c(cnc2C2CCCCC2)C1)Cc1ccco1 ZINC000561457203 944612390 /nfs/dbraw/zinc/61/23/90/944612390.db2.gz CGHDJPHLIAOWSD-HXUWFJFHSA-N 0 3 412.578 4.067 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)c1ccc(OCc2ccncc2)cc1 ZINC000561516058 944649232 /nfs/dbraw/zinc/64/92/32/944649232.db2.gz ONDMZGVSJFJQGJ-UHFFFAOYSA-N 0 3 407.489 4.004 20 0 HIADHN C[C@@H]1CN(C(=O)CCC(=O)c2cc(Cl)sc2Cl)CCN(C2CCC2)C1 ZINC000561527853 944657525 /nfs/dbraw/zinc/65/75/25/944657525.db2.gz VRYQLXQPFBLREA-LBPRGKRZSA-N 0 3 403.375 4.351 20 0 HIADHN CN(C)CCn1nccc1NC(=O)c1ccc(Oc2cccc(Cl)c2Cl)nc1 ZINC000561606544 944704468 /nfs/dbraw/zinc/70/44/68/944704468.db2.gz BPQYPYNYCFBCFN-UHFFFAOYSA-N 0 3 420.300 4.191 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)c1cc2cc(Br)ccc2[nH]1)c1ccco1 ZINC000561609552 944706183 /nfs/dbraw/zinc/70/61/83/944706183.db2.gz BXBPTIDOKUEVJK-YVEFUNNKSA-N 0 3 404.308 4.383 20 0 HIADHN COc1cc(C(=O)N[C@H](CN(C)C)c2ccc(F)cc2)ccc1OC1CCCC1 ZINC000561615175 944709237 /nfs/dbraw/zinc/70/92/37/944709237.db2.gz OHWXEEAQYFPUCR-HXUWFJFHSA-N 0 3 400.494 4.188 20 0 HIADHN C[C@H](NC(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F)c1nccn1-c1ccccc1 ZINC000561641491 944723333 /nfs/dbraw/zinc/72/33/33/944723333.db2.gz ORTPNSQQCAVXKL-GHTZIAJQSA-N 0 3 424.495 4.207 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)c2ccc(NC(=O)[C@@H]3C[C@H]3C)cc2)N(C)C)cc1 ZINC000561653941 944729890 /nfs/dbraw/zinc/72/98/90/944729890.db2.gz WPZSZAPFEOHIPS-ZQMYSKGWSA-N 0 3 423.557 4.101 20 0 HIADHN Cc1ccc(CN2CC[C@@H](CN(C)C(=O)CCC(=O)c3ccc(F)c(F)c3)C2)s1 ZINC000561698090 944752883 /nfs/dbraw/zinc/75/28/83/944752883.db2.gz MVCFOGBKYOGICN-INIZCTEOSA-N 0 3 420.525 4.278 20 0 HIADHN C[C@H](Cc1ccccc1C(F)(F)F)N(C)C(=O)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000561740860 944772559 /nfs/dbraw/zinc/77/25/59/944772559.db2.gz PCSVOIIWBYAQQC-YLJYHZDGSA-N 0 3 419.491 4.402 20 0 HIADHN CN(C)CCN(C(=O)c1cccc(OCc2cn3ccccc3n2)c1)C1CCCCC1 ZINC000561807298 944804505 /nfs/dbraw/zinc/80/45/05/944804505.db2.gz CFYLSDQEYKIRHB-UHFFFAOYSA-N 0 3 420.557 4.250 20 0 HIADHN COc1cc(Cl)c(NC(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)cc1C ZINC000561817054 944809686 /nfs/dbraw/zinc/80/96/86/944809686.db2.gz ONKOTFVVCJIPEM-IAGOWNOFSA-N 0 3 423.985 4.400 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3ccc(Oc4cccnc4)cc3)CC2)C[C@H](C)O1 ZINC000561817910 944810763 /nfs/dbraw/zinc/81/07/63/944810763.db2.gz WSYBLSIFBXMAJH-KDURUIRLSA-N 0 3 424.545 4.227 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)N1CCC(c2c[nH]nc2C)CC1)c1ccc(Cl)cc1 ZINC000561872177 944829992 /nfs/dbraw/zinc/82/99/92/944829992.db2.gz ZAAHBEOIIOTTKT-NRFANRHFSA-N 0 3 417.985 4.344 20 0 HIADHN C[C@@H](C(=O)NCCc1nc2c(s1)CCCC2)N1CCC(Cc2ccccc2)CC1 ZINC000561887762 944838723 /nfs/dbraw/zinc/83/87/23/944838723.db2.gz FEGHKNXULDDMFP-SFHVURJKSA-N 0 3 411.615 4.024 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)[C@H](C)N[C@@H]1CCN(C)[C@H]1c1ccc(Cl)cc1 ZINC000562050197 944912196 /nfs/dbraw/zinc/91/21/96/944912196.db2.gz NYGPHXJBFDIJCY-ZLXGRDSLSA-N 0 3 422.356 4.364 20 0 HIADHN C[C@@H]1C[C@@H]1[C@H](N[C@H]1CCCc2ccc(S(N)(=O)=O)cc21)c1ccc(Cl)cc1 ZINC000562089726 944934048 /nfs/dbraw/zinc/93/40/48/944934048.db2.gz FFBZIMFBPICROZ-QRDAFUTHSA-N 0 3 404.963 4.352 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)Nc1ccccc1N1C[C@H](C)O[C@@H](C)C1 ZINC000562116496 944949727 /nfs/dbraw/zinc/94/97/27/944949727.db2.gz VLTXKSCONFIURH-PMACEKPBSA-N 0 3 402.583 4.030 20 0 HIADHN CSCc1ccc(CNC(=O)Nc2ccc(CCN3CCSCC3)cc2)cc1 ZINC000562141845 944969984 /nfs/dbraw/zinc/96/99/84/944969984.db2.gz IHVUDNKSWBXZSP-UHFFFAOYSA-N 0 3 415.628 4.463 20 0 HIADHN C[C@H](NC(=O)Nc1ccc(CCC(=O)N2CCCC2)cc1)[C@H](c1ccccc1)N(C)C ZINC000562152942 944981112 /nfs/dbraw/zinc/98/11/12/944981112.db2.gz AQNUPUVCMXMAKT-YADARESESA-N 0 3 422.573 4.055 20 0 HIADHN C[C@H](NC(=O)Nc1ccc(CCC(=O)N2CCCC2)cc1)[C@@H](c1ccccc1)N(C)C ZINC000562152937 944982162 /nfs/dbraw/zinc/98/21/62/944982162.db2.gz AQNUPUVCMXMAKT-CYFREDJKSA-N 0 3 422.573 4.055 20 0 HIADHN Fc1ccc(-c2noc(CN3CCC[C@@H](c4nc(C5CCCCC5)n[nH]4)C3)n2)cc1 ZINC000562159532 944989752 /nfs/dbraw/zinc/98/97/52/944989752.db2.gz SNDDPMGENQIQET-QGZVFWFLSA-N 0 3 410.497 4.421 20 0 HIADHN Fc1ccc(-c2noc(CN3CCC[C@@H](c4n[nH]c(C5CCCCC5)n4)C3)n2)cc1 ZINC000562159532 944989775 /nfs/dbraw/zinc/98/97/75/944989775.db2.gz SNDDPMGENQIQET-QGZVFWFLSA-N 0 3 410.497 4.421 20 0 HIADHN C[C@H](NC(=O)NC[C@@H](Cc1ccccc1)N(C)C)c1ccc(Oc2cccnc2)cc1 ZINC000562174381 945002710 /nfs/dbraw/zinc/00/27/10/945002710.db2.gz BVNSBLGHDIWLBN-SIKLNZKXSA-N 0 3 418.541 4.407 20 0 HIADHN COc1ccc(NC(=O)N[C@@H](CN(C)C)c2ccc(F)cc2)c(Br)c1 ZINC000562193769 945013826 /nfs/dbraw/zinc/01/38/26/945013826.db2.gz UJQMNZITKHSNFC-KRWDZBQOSA-N 0 3 410.287 4.021 20 0 HIADHN CN(C)C[C@@H](NC(=O)Nc1cccc(CC(=O)OC(C)(C)C)c1)c1ccc(F)cc1 ZINC000562223883 945029783 /nfs/dbraw/zinc/02/97/83/945029783.db2.gz FFSQSRLNWDDBNV-HXUWFJFHSA-N 0 3 415.509 4.134 20 0 HIADHN COCCCN(C(=O)c1csc(-c2ccc(Cl)s2)n1)C1CCN(C)CC1 ZINC000562251291 945043695 /nfs/dbraw/zinc/04/36/95/945043695.db2.gz BGZYBVXSMALFHX-UHFFFAOYSA-N 0 3 413.996 4.098 20 0 HIADHN CC(C)CCn1nccc1NC(=O)NC[C@@H](c1ccc(OC(C)C)cc1)N(C)C ZINC000562270816 945051488 /nfs/dbraw/zinc/05/14/88/945051488.db2.gz LHRYXUGHHCLHBP-FQEVSTJZSA-N 0 3 401.555 4.141 20 0 HIADHN CSc1ccc([C@@H](CNC(=O)c2cccc(OCC(F)(F)F)c2)N(C)C)cc1 ZINC000564094124 945376979 /nfs/dbraw/zinc/37/69/79/945376979.db2.gz MCGLRYIJNXDBAD-GOSISDBHSA-N 0 3 412.477 4.382 20 0 HIADHN CNC(=O)c1cccc(CN[C@@H]2CCCc3c4cc(Br)ccc4[nH]c32)c1 ZINC000564142901 945398298 /nfs/dbraw/zinc/39/82/98/945398298.db2.gz DUKXZVKFASGQQF-LJQANCHMSA-N 0 3 412.331 4.457 20 0 HIADHN C[C@H](c1ccccc1F)N1CCC[C@H](NCc2ccc(-c3cnn(C)c3)s2)C1=O ZINC000564229619 945444997 /nfs/dbraw/zinc/44/49/97/945444997.db2.gz FAHAUENFNDXQQS-QRWLVFNGSA-N 0 3 412.534 4.130 20 0 HIADHN CCCCO[C@@H]1C[C@@H](N[C@@H](C)C(=O)Nc2c(C)nn(-c3ccccc3)c2C)C1(C)C ZINC000564293215 945502364 /nfs/dbraw/zinc/50/23/64/945502364.db2.gz BGBLWOGYJNONSW-IOMROCGXSA-N 0 3 412.578 4.390 20 0 HIADHN CCCCNC(=O)C1CCN(CCCC(=O)c2ccc(Br)cc2)CC1 ZINC000564294615 945504179 /nfs/dbraw/zinc/50/41/79/945504179.db2.gz FGJBYOCOBPJGNE-UHFFFAOYSA-N 0 3 409.368 4.040 20 0 HIADHN OC1(Cc2ccc(OC(F)(F)F)cc2)CCN(CC2=Cc3ccccc3OC2)CC1 ZINC000564380299 945543806 /nfs/dbraw/zinc/54/38/06/945543806.db2.gz RBVGVVRUBXZXCR-UHFFFAOYSA-N 0 3 419.443 4.431 20 0 HIADHN COc1ccc(C[C@](C)(O)CNCc2cc(Cl)ccc2OC(F)F)cc1OC ZINC000564416751 945570251 /nfs/dbraw/zinc/57/02/51/945570251.db2.gz DUERSRDWSPLLCD-FQEVSTJZSA-N 0 3 415.864 4.042 20 0 HIADHN COc1ccc([C@H](C)NCc2cc(C(F)(F)F)ccc2N2CCN(C)CC2)cc1O ZINC000564419345 945571861 /nfs/dbraw/zinc/57/18/61/945571861.db2.gz IIBDXVYZDQGXKZ-HNNXBMFYSA-N 0 3 423.479 4.022 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)c1ccc2c(c1)nc(Cc1cccs1)n2C ZINC000564661056 945719896 /nfs/dbraw/zinc/71/98/96/945719896.db2.gz FOGXMMDNVDSDKL-UHFFFAOYSA-N 0 3 422.554 4.023 20 0 HIADHN Cc1cc(I)cc(C(=O)Nc2ccccc2CN(C)C)c1C ZINC000564696790 945736406 /nfs/dbraw/zinc/73/64/06/945736406.db2.gz OUFGZJHYNRYCST-UHFFFAOYSA-N 0 3 408.283 4.222 20 0 HIADHN Cc1cc(NC(=O)N(C)Cc2ccc(C)o2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000565077550 945769169 /nfs/dbraw/zinc/76/91/69/945769169.db2.gz YRWUXDYFQRVHHR-HXUWFJFHSA-N 0 3 407.518 4.204 20 0 HIADHN CCn1ncc(C(=O)NC[C@H](c2ccc(SC)cc2)N(C)C)c1-c1ccccc1 ZINC000565324416 945810030 /nfs/dbraw/zinc/81/00/30/945810030.db2.gz FHBOAYKIBLLHQD-OAQYLSRUSA-N 0 3 408.571 4.325 20 0 HIADHN CSC1(CN(C)Cc2cccc(Br)c2OCC(C)(C)O)CCC1 ZINC000565336155 945815442 /nfs/dbraw/zinc/81/54/42/945815442.db2.gz NRCNZVZAKCLHBE-UHFFFAOYSA-N 0 3 402.398 4.316 20 0 HIADHN CN1CCC(N(Cc2ccccc2Br)C(=O)[C@@H]2CC23CCCC3)CC1 ZINC000565395005 945824298 /nfs/dbraw/zinc/82/42/98/945824298.db2.gz FASUBJYPOWXLOI-SFHVURJKSA-N 0 3 405.380 4.452 20 0 HIADHN Cc1ccccc1C(C)(C)NCC(=O)Nc1cc(C(F)(F)F)ccc1-n1cncn1 ZINC000565435598 945828567 /nfs/dbraw/zinc/82/85/67/945828567.db2.gz ZWOHHLAMAFQRFR-UHFFFAOYSA-N 0 3 417.435 4.058 20 0 HIADHN CN(C)C[C@@H](NC(=O)CCc1nc2cc(Cl)ccc2s1)c1ccc(F)cc1 ZINC000565441347 945830485 /nfs/dbraw/zinc/83/04/85/945830485.db2.gz JCENEYLFLANVDI-QGZVFWFLSA-N 0 3 405.926 4.441 20 0 HIADHN COc1ccc(NC(=O)[C@@H](c2ccccc2)N2[C@@H]3CC[C@H]2CCN(C)C3)cc1Cl ZINC000565459821 945835925 /nfs/dbraw/zinc/83/59/25/945835925.db2.gz GAICIIPNDWKSDS-NNMXDRDESA-N 0 3 413.949 4.197 20 0 HIADHN C[C@H]1C[C@H]1N1CCN(C(=O)c2ccc3c(c2)nc(Cc2cccs2)n3C)C[C@@H](C)C1 ZINC000565617099 945855748 /nfs/dbraw/zinc/85/57/48/945855748.db2.gz NEQNTLFPIWXTEG-PNLZDCPESA-N 0 3 422.598 4.028 20 0 HIADHN Fc1ccc([C@H]2C[C@H](NCc3cn4ccc(Br)cc4n3)CCO2)cc1 ZINC000565721479 945871817 /nfs/dbraw/zinc/87/18/17/945871817.db2.gz NCUYFKKWAAGJKA-SJLPKXTDSA-N 0 3 404.283 4.246 20 0 HIADHN COc1ccccc1O[C@@H]1CCCN(Cc2ccc(OCc3noc(C)n3)cc2)C1 ZINC000565799934 945886204 /nfs/dbraw/zinc/88/62/04/945886204.db2.gz CKYIYOSXQGAABD-HXUWFJFHSA-N 0 3 409.486 4.009 20 0 HIADHN Cc1cc(NC(=O)C(C)(C)C)sc1C(=O)N[C@H](CN(C)C)c1ccc(F)cc1 ZINC000565852974 945894296 /nfs/dbraw/zinc/89/42/96/945894296.db2.gz FAEUSMAXPAYQRM-MRXNPFEDSA-N 0 3 405.539 4.213 20 0 HIADHN COc1cc2c(c(CN3CCC[C@@H](c4nc(C(F)(F)F)cn4C)C3)c1)O[C@@H](C)C2 ZINC000565977556 945955845 /nfs/dbraw/zinc/95/58/45/945955845.db2.gz ZIGRGJDDFCOZRA-UONOGXRCSA-N 0 3 409.452 4.151 20 0 HIADHN CNS(=O)(=O)c1ccc([C@H](C)N[C@@H](c2cccc(C(F)(F)F)c2)C2CC2)cc1 ZINC000566346191 946006501 /nfs/dbraw/zinc/00/65/01/946006501.db2.gz ODFSAFPFISTWJN-ORAYPTAESA-N 0 3 412.477 4.415 20 0 HIADHN O=S(=O)(Cc1ccc(C(F)F)cc1)N1CC[C@@]2(CCN(Cc3ccccc3)C2)C1 ZINC000566371826 946012966 /nfs/dbraw/zinc/01/29/66/946012966.db2.gz CCEJZGUVOSMSOC-JOCHJYFZSA-N 0 3 420.525 4.052 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@@H](NCc2ccc(C(=O)N(CC)CC)cc2)c2ccccc21 ZINC000566392763 946019303 /nfs/dbraw/zinc/01/93/03/946019303.db2.gz ROJIVAUPEWWXNU-DHIUTWEWSA-N 0 3 408.542 4.440 20 0 HIADHN CN(C)C[C@@H](NC(=O)[C@@H]1CCn2c(cnc2C2CCCCC2)C1)c1ccc(F)cc1 ZINC000566523309 946028882 /nfs/dbraw/zinc/02/88/82/946028882.db2.gz NJSDCAXDNIDFBC-DENIHFKCSA-N 0 3 412.553 4.051 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2Cl)c(C)c1CC(=O)N1[C@@H]2CC[C@H]1CCN(C)C2 ZINC000566577560 946045207 /nfs/dbraw/zinc/04/52/07/946045207.db2.gz MBPKQDPMNSXHLZ-DLBZAZTESA-N 0 3 421.372 4.034 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)Nc2ccccc2O[C@@H](C)C(F)(F)F)CC1 ZINC000566624934 946056385 /nfs/dbraw/zinc/05/63/85/946056385.db2.gz PWRDHXBSGYYELN-HNNXBMFYSA-N 0 3 417.472 4.027 20 0 HIADHN FC(F)(F)c1cnc(NCCN[C@H](c2nc[nH]n2)C2CCCCC2)c(Cl)c1 ZINC000566966769 946198361 /nfs/dbraw/zinc/19/83/61/946198361.db2.gz GTNRNSWXQYSEQS-AWEZNQCLSA-N 0 3 402.852 4.195 20 0 HIADHN FC(F)(F)c1cnc(NCC[NH2+][C@H](c2nnc[n-]2)C2CCCCC2)c(Cl)c1 ZINC000566966769 946198376 /nfs/dbraw/zinc/19/83/76/946198376.db2.gz GTNRNSWXQYSEQS-AWEZNQCLSA-N 0 3 402.852 4.195 20 0 HIADHN Cc1cc(CN(CCn2ccnc2)Cc2cccc(Cl)c2)ccc1-n1cncn1 ZINC000567085827 946238335 /nfs/dbraw/zinc/23/83/35/946238335.db2.gz LMGVTJRMAHHWKU-UHFFFAOYSA-N 0 3 406.921 4.128 20 0 HIADHN CN(C)CCn1nccc1NC(=O)c1ccc(COc2ccc3ccccc3c2)o1 ZINC000567254209 946279437 /nfs/dbraw/zinc/27/94/37/946279437.db2.gz NLHZXTZUCLAMMH-UHFFFAOYSA-N 0 3 404.470 4.022 20 0 HIADHN CN1CC[C@@H](NC(=O)NC2(c3cccc(C(F)(F)F)c3)CC2)[C@@H]1c1ccccc1 ZINC000567296613 946299062 /nfs/dbraw/zinc/29/90/62/946299062.db2.gz VYHZINPWWNCHFX-MOPGFXCFSA-N 0 3 403.448 4.439 20 0 HIADHN COc1ccc2c(c1)[C@@H](NCCCS(=O)(=O)c1ccc(Cl)cc1)CCCO2 ZINC000567296108 946299303 /nfs/dbraw/zinc/29/93/03/946299303.db2.gz AIRDRDHCQXFVCQ-IBGZPJMESA-N 0 3 409.935 4.016 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)Nc1ccc(CN(C(C)=O)C2CC2)cc1)c1ccco1 ZINC000567480239 946347304 /nfs/dbraw/zinc/34/73/04/946347304.db2.gz ABDYWLFPYBVFOA-IIBYNOLFSA-N 0 3 412.534 4.041 20 0 HIADHN COc1ccccc1OCc1ccc(C(=O)N[C@@H](CN(C)C)c2ccc(F)cc2)o1 ZINC000567538837 946365611 /nfs/dbraw/zinc/36/56/11/946365611.db2.gz KQKFGRDLLMUKKX-IBGZPJMESA-N 0 3 412.461 4.039 20 0 HIADHN C[C@H](c1ccccc1)N(C)C(=O)CN[C@H]1CCN(C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000567548925 946373698 /nfs/dbraw/zinc/37/36/98/946373698.db2.gz YXAYGZXLJSWUSI-UPKQVVFYSA-N 0 3 403.929 4.034 20 0 HIADHN COCC[C@@H](NC[C@H](O)COc1ccccc1F)c1ccc(Cl)c(Cl)c1 ZINC000567904257 946422623 /nfs/dbraw/zinc/42/26/23/946422623.db2.gz VNBCTMMDFJYUMS-KBXCAEBGSA-N 0 3 402.293 4.240 20 0 HIADHN CC[C@@H](C)[C@@H](NCC(=O)Nc1ccccc1SCC(N)=O)c1ccc(Cl)cc1 ZINC000568063783 946453057 /nfs/dbraw/zinc/45/30/57/946453057.db2.gz WOKLHNGCTMPUEY-SPLOXXLWSA-N 0 3 419.978 4.233 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3nc4ccsc4s3)c(C)c2)CC1 ZINC000568323089 946505126 /nfs/dbraw/zinc/50/51/26/946505126.db2.gz BLRNQGBJPGUEBB-UHFFFAOYSA-N 0 3 401.561 4.452 20 0 HIADHN O=C1CCc2cc(-c3noc([C@@H]4CN(Cc5ccccc5)CCC4(F)F)n3)ccc2N1 ZINC000568326092 946508399 /nfs/dbraw/zinc/50/83/99/946508399.db2.gz KMDRNNSFYZHFHM-SFHVURJKSA-N 0 3 424.451 4.246 20 0 HIADHN C/C(=C\c1ccccc1OC(F)F)CNCc1cc(F)ccc1N1CCOCC1 ZINC000568332550 946513103 /nfs/dbraw/zinc/51/31/03/946513103.db2.gz DIJJISZJPZPSFG-FOWTUZBSSA-N 0 3 406.448 4.457 20 0 HIADHN Cc1cc(C(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)nn1-c1ccccc1 ZINC000568432463 946542725 /nfs/dbraw/zinc/54/27/25/946542725.db2.gz XRXFGSLZPIDQMN-HSZRJFAPSA-N 0 3 406.530 4.001 20 0 HIADHN CN1CCC(N(Cc2ccccc2Br)C(=O)Cc2cccs2)CC1 ZINC000568575804 946615728 /nfs/dbraw/zinc/61/57/28/946615728.db2.gz HADNVJBISDPEEX-UHFFFAOYSA-N 0 3 407.377 4.176 20 0 HIADHN Cc1cc(N2CCCC2)ccc1NC(=O)CN[C@@H]1c2ccccc2CC12CCOCC2 ZINC000568817279 946715451 /nfs/dbraw/zinc/71/54/51/946715451.db2.gz HTEXJKWAOJKPJA-RUZDIDTESA-N 0 3 419.569 4.218 20 0 HIADHN C[C@@H](NC(=O)[C@H](C)N[C@@H]1CCN(C)[C@H]1c1ccc(Cl)c(F)c1)c1ccc(F)cc1 ZINC000568871315 946728857 /nfs/dbraw/zinc/72/88/57/946728857.db2.gz QSEMBKKTFKZDHC-LXPSQPKGSA-N 0 3 421.919 4.219 20 0 HIADHN CCCN(C)[C@H](CNC(=O)N1CCC[C@@H]1C1CCOCC1)c1ccc(Cl)cc1 ZINC000569033839 946803107 /nfs/dbraw/zinc/80/31/07/946803107.db2.gz HYHBEGHABDQRCU-NHCUHLMSSA-N 0 3 407.986 4.324 20 0 HIADHN CCCN(CC)C[C@H](C)N[C@H](c1ccc(C)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000569041449 946805624 /nfs/dbraw/zinc/80/56/24/946805624.db2.gz VEFFMWLDSNOLPN-WMZHIEFXSA-N 0 3 402.604 4.198 20 0 HIADHN COc1ccc([C@H](Cc2ccccc2)N[C@H](C)C(=O)Nc2ccnn2C(C)C)cc1 ZINC000569046726 946808246 /nfs/dbraw/zinc/80/82/46/946808246.db2.gz YCTSAJLKZFQNKN-GCJKJVERSA-N 0 3 406.530 4.373 20 0 HIADHN Cc1ccc2c(c1)[C@H](NCc1cccc(N3C(=O)NC4(CCCC4)C3=O)c1)[C@@H](C)C2 ZINC000569055898 946811869 /nfs/dbraw/zinc/81/18/69/946811869.db2.gz PPXLLKCHKCFKAN-HTAPYJJXSA-N 0 3 403.526 4.387 20 0 HIADHN CC1(C)[C@@H](C(F)(F)F)CCN1C(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000569108982 946816921 /nfs/dbraw/zinc/81/69/21/946816921.db2.gz UOUNQGGXPJKDNH-CVEARBPZSA-N 0 3 404.423 4.333 20 0 HIADHN C[C@H](NCc1ccc2c(c1)nnn2C)c1ccc(NC(=O)c2ccc(F)cc2)cc1 ZINC000569133957 946820071 /nfs/dbraw/zinc/82/00/71/946820071.db2.gz VALVZHVUARKOPZ-HNNXBMFYSA-N 0 3 403.461 4.211 20 0 HIADHN FC(F)(F)c1ccc(-c2nc(CN[C@H]3CCCC[C@H]3N3CCOCC3)co2)cc1 ZINC000569431560 946874601 /nfs/dbraw/zinc/87/46/01/946874601.db2.gz XOXYPMTWRMZKGQ-RBUKOAKNSA-N 0 3 409.452 4.093 20 0 HIADHN COc1cccc(C(=O)CCCC(=O)N2C[C@H]3CN(Cc4ccccc4)CC[C@@H]3C2)c1 ZINC000569636495 946911708 /nfs/dbraw/zinc/91/17/08/946911708.db2.gz KFTMXSSYUKAGTN-DHIUTWEWSA-N 0 3 420.553 4.029 20 0 HIADHN CN(C)Cc1cccc(C(=O)NCC2(c3ccc(Br)s3)CCC2)c1 ZINC000569951104 947050432 /nfs/dbraw/zinc/05/04/32/947050432.db2.gz MADKVOJDMCWUKS-UHFFFAOYSA-N 0 3 407.377 4.424 20 0 HIADHN Cc1ccnc(Oc2ccc(NC(=O)N[C@@H]3CCN(Cc4ccccc4)[C@@H]3C)cc2)n1 ZINC000570033395 947077681 /nfs/dbraw/zinc/07/76/81/947077681.db2.gz SQUXMFOZVQEJKX-XMSQKQJNSA-N 0 3 417.513 4.362 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)Nc2ccc(Oc3cccnc3)nc2)N(C)C)cc1 ZINC000570064150 947082002 /nfs/dbraw/zinc/08/20/02/947082002.db2.gz BBDQVWMESNCOEM-OAQYLSRUSA-N 0 3 405.502 4.256 20 0 HIADHN COc1ccc([C@H](C)NC[C@@]2(CO)C[C@H]2c2ccc(F)cc2)c(Br)c1 ZINC000570084471 947090487 /nfs/dbraw/zinc/09/04/87/947090487.db2.gz DRKHCBZDCCUDNE-YHJVDBJQSA-N 0 3 408.311 4.414 20 0 HIADHN COC(=O)c1ccc(CNCCc2nc3ccccc3s2)c(Br)c1 ZINC000570247957 947168742 /nfs/dbraw/zinc/16/87/42/947168742.db2.gz KVCJYMHNAZIFRU-UHFFFAOYSA-N 0 3 405.317 4.178 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)Nc1ccc(CN(C(C)=O)C(C)C)cc1)c1ccco1 ZINC000570268180 947178133 /nfs/dbraw/zinc/17/81/33/947178133.db2.gz YODUIIOSQQTSSV-DYESRHJHSA-N 0 3 414.550 4.287 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc2c(c1)OCC(=O)N2)c1ccc(NC(=O)c2ccncc2)cc1 ZINC000570339159 947207479 /nfs/dbraw/zinc/20/74/79/947207479.db2.gz PLGVLYUMYAYIJH-CVEARBPZSA-N 0 3 416.481 4.077 20 0 HIADHN CC[C@H](NCc1cnc(N2CCOCC2)c(F)c1)c1ccc(OC(F)(F)F)cc1 ZINC000570553204 947293447 /nfs/dbraw/zinc/29/34/47/947293447.db2.gz BYELCOBBQUKPEQ-SFHVURJKSA-N 0 3 413.415 4.197 20 0 HIADHN Cc1cc(CSc2ncccc2C(=O)N[C@H]2CCN(Cc3ccccc3)[C@@H]2C)no1 ZINC000570595376 947307536 /nfs/dbraw/zinc/30/75/36/947307536.db2.gz LUHPFYHFCMPTIH-UTKZUKDTSA-N 0 3 422.554 4.063 20 0 HIADHN Fc1cccc(CC2(NCc3nn(-c4ccccc4)c4c3CCC4)CCOCC2)c1 ZINC000570700965 947330150 /nfs/dbraw/zinc/33/01/50/947330150.db2.gz DLQBJAZXJZJKMG-UHFFFAOYSA-N 0 3 405.517 4.382 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)c1c(F)cc(Br)cc1F)c1ccco1 ZINC000570712944 947332539 /nfs/dbraw/zinc/33/25/39/947332539.db2.gz BMMAMBWWZYFDAR-HZMBPMFUSA-N 0 3 401.251 4.180 20 0 HIADHN CN1CC[C@H](NCC(=O)Nc2ccc(OCc3ccccc3)cc2)[C@H]1c1ccccc1 ZINC000570762960 947350622 /nfs/dbraw/zinc/35/06/22/947350622.db2.gz XCSDGSUGRBTDMQ-AZGAKELHSA-N 0 3 415.537 4.239 20 0 HIADHN CSc1ccc([C@@H](CNC(=O)c2cnn(-c3ccc(C)cc3)c2C)N(C)C)cc1 ZINC000570880572 947381382 /nfs/dbraw/zinc/38/13/82/947381382.db2.gz FDCAEVWCPITQJM-JOCHJYFZSA-N 0 3 408.571 4.244 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Cc3c[nH]c4cccc(Cl)c34)CC2)C[C@@H](C)O1 ZINC000570949457 947396417 /nfs/dbraw/zinc/39/64/17/947396417.db2.gz XGTICMXRTSRVFF-IAGOWNOFSA-N 0 3 417.981 4.102 20 0 HIADHN CN1CC[C@H](NCC(=O)Nc2ccccc2C(C)(C)C)[C@H]1c1ccc(F)c(F)c1 ZINC000570976499 947406521 /nfs/dbraw/zinc/40/65/21/947406521.db2.gz UZQCGCPAHHEYFV-RBBKRZOGSA-N 0 3 401.501 4.236 20 0 HIADHN CSc1ccc([C@@H](CNC(=O)c2sc([C@@H]3CCCOC3)nc2C)N(C)C)cc1 ZINC000571120406 947514545 /nfs/dbraw/zinc/51/45/45/947514545.db2.gz LQVXLYJXFRNHOJ-SJLPKXTDSA-N 0 3 419.616 4.100 20 0 HIADHN CCN1CC[C@@H](NCC(=O)Nc2ccccc2Cl)[C@H]1c1ccc(Cl)c(F)c1 ZINC000571421702 947638544 /nfs/dbraw/zinc/63/85/44/947638544.db2.gz YFEWZIPNPFWLFJ-UYAOXDASSA-N 0 3 410.320 4.496 20 0 HIADHN CCOC(=O)c1nnc(-c2cccc(C[NH2+][C@H]3CCC[C@H](c4ncccc4C)C3)c2)[n-]1 ZINC000571448173 947652907 /nfs/dbraw/zinc/65/29/07/947652907.db2.gz UZIGCLQDNHXNKT-ICSRJNTNSA-N 0 3 419.529 4.168 20 0 HIADHN CCOC(=O)c1nc(-c2cccc(C[NH2+][C@H]3CCC[C@H](c4ncccc4C)C3)c2)n[n-]1 ZINC000571448173 947652922 /nfs/dbraw/zinc/65/29/22/947652922.db2.gz UZIGCLQDNHXNKT-ICSRJNTNSA-N 0 3 419.529 4.168 20 0 HIADHN C[C@H]1[C@@H](NC(=O)c2cc(F)c(F)cc2Br)CCN1Cc1ccccc1 ZINC000571474414 947664616 /nfs/dbraw/zinc/66/46/16/947664616.db2.gz FBKNZBGXIPIGTO-SGTLLEGYSA-N 0 3 409.274 4.120 20 0 HIADHN COc1ccc([C@H](C)N[C@H](C)C(=O)N2CCC[C@H]2c2cccs2)c(C)c1OC ZINC000571590991 947720261 /nfs/dbraw/zinc/72/02/61/947720261.db2.gz GJWXTRYJLDKNKR-JZXOWHBKSA-N 0 3 402.560 4.477 20 0 HIADHN Cc1cc(NC(=O)CN(C)[C@H]2CC[C@@H](C(F)(F)F)CC2)n(-c2ccc(F)cc2)n1 ZINC000571598204 947722738 /nfs/dbraw/zinc/72/27/38/947722738.db2.gz NFUHVCOSKZPIJP-FZNQNYSPSA-N 0 3 412.431 4.311 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N1C[C@H](c2ccccc2)c2ccccc21 ZINC000571610411 947730882 /nfs/dbraw/zinc/73/08/82/947730882.db2.gz JHCCHJHURCVBPL-JOCHJYFZSA-N 0 3 413.521 4.174 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)c1nc2ccccc2cc1Br)c1ccco1 ZINC000571843106 947802462 /nfs/dbraw/zinc/80/24/62/947802462.db2.gz RKSJUNGENQBEBV-GUYCJALGSA-N 0 3 416.319 4.450 20 0 HIADHN C[C@H](N[C@@H]1c2ccccc2CC12CCOCC2)C(=O)Nc1ccccc1OC(F)F ZINC000571931185 947814922 /nfs/dbraw/zinc/81/49/22/947814922.db2.gz UGPDFIDXELVCEH-MGPUTAFESA-N 0 3 416.468 4.299 20 0 HIADHN CCCCO[C@@H]1C[C@H](NCC(=O)Nc2c(C)nn(-c3ccc(C)cc3)c2C)C1(C)C ZINC000572079678 947841428 /nfs/dbraw/zinc/84/14/28/947841428.db2.gz LTAJSTVMQIXUCT-LEWJYISDSA-N 0 3 412.578 4.309 20 0 HIADHN CCCCO[C@H]1C[C@H](NCC(=O)Nc2c(C)nn(-c3ccc(C)cc3)c2C)C1(C)C ZINC000572079681 947841606 /nfs/dbraw/zinc/84/16/06/947841606.db2.gz LTAJSTVMQIXUCT-SFTDATJTSA-N 0 3 412.578 4.309 20 0 HIADHN Cc1ccc2ncc(-c3noc([C@@H]4CN(Cc5ccccc5)CCC4(F)F)n3)n2c1 ZINC000572164646 947853868 /nfs/dbraw/zinc/85/38/68/947853868.db2.gz QUPBVYCJCUQHGW-KRWDZBQOSA-N 0 3 409.440 4.318 20 0 HIADHN CN1CC[C@H](NCC(=O)NC2(c3ccccc3)CCC2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000572207746 947864396 /nfs/dbraw/zinc/86/43/96/947864396.db2.gz KJLYMTXRYYRADE-RBBKRZOGSA-N 0 3 415.940 4.010 20 0 HIADHN CN(C)C[C@H](NC(=O)N[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1)c1ccc(Cl)cc1 ZINC000572224660 947866902 /nfs/dbraw/zinc/86/69/02/947866902.db2.gz DRRCMCBZPZSQJH-QHAWAJNXSA-N 0 3 419.928 4.301 20 0 HIADHN C[C@@H](NC[C@H](c1ccccc1Cl)N1CCOCC1)c1ccc(Br)cn1 ZINC000572352447 947889219 /nfs/dbraw/zinc/88/92/19/947889219.db2.gz CEMUNJFLMZVOGV-AUUYWEPGSA-N 0 3 424.770 4.222 20 0 HIADHN COc1ccc2c(c1F)CC[C@@H]2N[C@H](C)c1cc(F)ccc1N1CCN(C)CC1 ZINC000572439756 947906125 /nfs/dbraw/zinc/90/61/25/947906125.db2.gz FPNCDTAMDALSAH-QRWLVFNGSA-N 0 3 401.501 4.063 20 0 HIADHN COc1ccc(CN(C)C(=O)CN[C@H](C)c2ccc(F)c3ccccc32)cc1OC ZINC000572558785 947945577 /nfs/dbraw/zinc/94/55/77/947945577.db2.gz NJSPRAONCHYIEI-MRXNPFEDSA-N 0 3 410.489 4.305 20 0 HIADHN CC(C)Cn1ncc(NC(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)c1C(F)F ZINC000572905174 948034864 /nfs/dbraw/zinc/03/48/64/948034864.db2.gz CIRYLFMRRQRYOV-DOTOQJQBSA-N 0 3 405.493 4.434 20 0 HIADHN Cc1cccc(-c2nc(CC(=O)N(C)CCCN(C)Cc3ccncc3)cs2)c1 ZINC000573031739 948065338 /nfs/dbraw/zinc/06/53/38/948065338.db2.gz UHFNVJFYBDLZFH-UHFFFAOYSA-N 0 3 408.571 4.037 20 0 HIADHN NS(=O)(=O)c1ccc2c(c1)[C@H](NCc1ccc(OC3CCCCC3)cc1)CCC2 ZINC000573292234 948148350 /nfs/dbraw/zinc/14/83/50/948148350.db2.gz VCPQFUMSXBNLEM-HSZRJFAPSA-N 0 3 414.571 4.213 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)Nc1cccc(NC(=O)c2ccoc2)c1 ZINC000573479001 948213238 /nfs/dbraw/zinc/21/32/38/948213238.db2.gz FGHOOLAYBAZHCI-QGZVFWFLSA-N 0 3 406.486 4.174 20 0 HIADHN Cc1cc(C)c(CCNC(=O)CN(C)[C@@H]2CCO[C@@H](c3ccc(F)cc3)C2)c(C)c1 ZINC000573845161 948308937 /nfs/dbraw/zinc/30/89/37/948308937.db2.gz ITCLNFICPCJRDQ-ISKFKSNPSA-N 0 3 412.549 4.262 20 0 HIADHN COC(=O)c1cc(NC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)cc2[nH]ccc21 ZINC000574076334 948359301 /nfs/dbraw/zinc/35/93/01/948359301.db2.gz IFSHQTFILFCOTE-QGZVFWFLSA-N 0 3 420.513 4.083 20 0 HIADHN CC[C@@H](C(=O)Nc1cc(CN2CCSCC2)ccc1C)N(C)Cc1ccccc1 ZINC000574305538 948407418 /nfs/dbraw/zinc/40/74/18/948407418.db2.gz QSMOSSWNQDRBKK-QHCPKHFHSA-N 0 3 411.615 4.393 20 0 HIADHN CN(Cc1c(F)cccc1Cl)C(=O)CN[C@H]1CCN(C)[C@H]1c1ccc(Cl)cc1 ZINC000574488538 948456268 /nfs/dbraw/zinc/45/62/68/948456268.db2.gz BCNBZBOPBHXYAE-FPOVZHCZSA-N 0 3 424.347 4.126 20 0 HIADHN CC(C)N1CC[C@@H](NCC(=O)N[C@@H](C)c2cccs2)[C@@H]1c1ccc(F)c(F)c1 ZINC000574929186 948552963 /nfs/dbraw/zinc/55/29/63/948552963.db2.gz TZZZNPXOMNRVCT-HLLQZAQXSA-N 0 3 407.530 4.017 20 0 HIADHN CN(C)Cc1ccc(S(=O)(=O)N[C@H](c2cccs2)c2ccc(F)cc2)cc1 ZINC000574954061 948563967 /nfs/dbraw/zinc/56/39/67/948563967.db2.gz WMAHBJXQLWVTRL-FQEVSTJZSA-N 0 3 404.532 4.017 20 0 HIADHN CCOC(=O)c1cnn(C2CCN(Cc3c(C)nn(-c4ccccc4)c3C)CC2)c1C ZINC000574960942 948565923 /nfs/dbraw/zinc/56/59/23/948565923.db2.gz CFPTVFWKGXSMSH-UHFFFAOYSA-N 0 3 421.545 4.008 20 0 HIADHN O=C(Nc1c[nH]nc1[C@H]1CCCN(C[C@@H]2CCC3(CCCC3)O2)C1)C1CCCC1 ZINC000575021526 948574780 /nfs/dbraw/zinc/57/47/80/948574780.db2.gz XHYUAZGODLIZGR-OALUTQOASA-N 0 3 400.567 4.210 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)c1cccc(C(=O)Nc2ccccc2)c1)c1ccco1 ZINC000575085411 948588684 /nfs/dbraw/zinc/58/86/84/948588684.db2.gz LYVMYBGSDFMKSM-UWJYYQICSA-N 0 3 405.498 4.391 20 0 HIADHN CC[C@H](C)c1nc([C@H](C)NC(=O)NC[C@@H](c2ccccc2Cl)N2CCCC2)n[nH]1 ZINC000575235291 948639819 /nfs/dbraw/zinc/63/98/19/948639819.db2.gz CAEYVXQMAKZRCO-MPGHIAIKSA-N 0 3 418.973 4.169 20 0 HIADHN CN(C)[C@]1(CN[C@H](c2ccc(Br)o2)c2ccc(F)cc2)CCSC1 ZINC000575783884 948705508 /nfs/dbraw/zinc/70/55/08/948705508.db2.gz LSTTYIOPXJCLJL-ROUUACIJSA-N 0 3 413.356 4.298 20 0 HIADHN COc1ccc(C[C@H](C)C(=O)NC[C@@H](c2ccc(SC)cc2)N(C)C)cc1OC ZINC000575831573 948727899 /nfs/dbraw/zinc/72/78/99/948727899.db2.gz RQKSXLSKNMMLGC-JXFKEZNVSA-N 0 3 416.587 4.023 20 0 HIADHN CCc1nc(C)c([C@H](C)N(C)C(=O)N[C@@H]2CCN(Cc3ccccc3)[C@H]2C)s1 ZINC000575928930 948783376 /nfs/dbraw/zinc/78/33/76/948783376.db2.gz FWUVICOBOYANAH-JENIJYKNSA-N 0 3 400.592 4.379 20 0 HIADHN CC[C@@H]1c2ccsc2CCN1C(=O)CN[C@H]1c2ccccc2CC12CCOCC2 ZINC000575958247 948802744 /nfs/dbraw/zinc/80/27/44/948802744.db2.gz HPJDCQUBCAAMKL-OFNKIYASSA-N 0 3 410.583 4.268 20 0 HIADHN CC(C)c1ccc(-c2cc(C(F)(F)N3CC[C@H]4NCCO[C@H]4C3)c(Cl)nn2)cc1 ZINC001164389312 718826287 /nfs/dbraw/zinc/82/62/87/718826287.db2.gz HIQXMGYGKHGPEP-MJGOQNOKSA-N 0 3 422.907 4.032 20 0 HIADHN FC(F)(c1cc(Cl)nc(Cl)n1)N1CCC[C@H]2CN(Cc3ccccc3)C[C@H]21 ZINC001164628744 719056110 /nfs/dbraw/zinc/05/61/10/719056110.db2.gz ZRGRIZFNIFPUFR-LSDHHAIUSA-N 0 3 413.299 4.429 20 0 HIADHN CC(C)N(C)Cc1nn(C(F)(F)c2ccc3ccc(Cl)nc3c2)c2c1CCNC2 ZINC001164682820 719617649 /nfs/dbraw/zinc/61/76/49/719617649.db2.gz GDCZIOFBNQEYFN-UHFFFAOYSA-N 0 3 419.907 4.168 20 0 HIADHN Clc1ccc2nc(Cl)nc(N3CC[C@H]4[C@H]3CCN4Cc3cccnc3)c2c1 ZINC001164728530 720330870 /nfs/dbraw/zinc/33/08/70/720330870.db2.gz WANUMUNZAOKVCA-ZWKOTPCHSA-N 0 3 400.313 4.185 20 0 HIADHN Clc1cc2ncnc(N3CC[C@@H]4[C@@H]3CCN4Cc3cccnc3)c2cc1Cl ZINC001164732419 720414530 /nfs/dbraw/zinc/41/45/30/720414530.db2.gz NGTBPGYIJZLBMK-MOPGFXCFSA-N 0 3 400.313 4.185 20 0 HIADHN Cn1cc(CN2CC[C@H]3CN(c4c(Cl)ccc5ccc(Cl)nc54)C[C@@H]3C2)cn1 ZINC001164768942 721235281 /nfs/dbraw/zinc/23/52/81/721235281.db2.gz YXGUHAWHZRUYJM-IRXDYDNUSA-N 0 3 416.356 4.233 20 0 HIADHN Cc1nc2sccc2c(N2CCC(F)(F)[C@@]3(CCN(Cc4ccccn4)C3)C2)n1 ZINC001164903844 721583466 /nfs/dbraw/zinc/58/34/66/721583466.db2.gz OKJNFBQPGPQQEH-HXUWFJFHSA-N 0 3 415.513 4.132 20 0 HIADHN CC(C)(C)Oc1cccc(N2CCC(F)(F)[C@]3(CCN(Cc4ccccn4)C3)C2)n1 ZINC001164904295 721710631 /nfs/dbraw/zinc/71/06/31/721710631.db2.gz BLILPVHUFCSJBI-QFIPXVFZSA-N 0 3 416.516 4.392 20 0 HIADHN FC1(F)CCN(c2ccc(-c3ccncc3)cn2)C[C@@]12CCN(Cc1ccccn1)C2 ZINC001164908352 721721839 /nfs/dbraw/zinc/72/18/39/721721839.db2.gz XFYLDKXVKNHLMA-QHCPKHFHSA-N 0 3 421.495 4.276 20 0 HIADHN Cc1ccc2nc(Cl)cc(N3CC[C@@H]4CN(Cc5cccnc5)CCO[C@H]4C3)c2c1 ZINC001164979818 722109635 /nfs/dbraw/zinc/10/96/35/722109635.db2.gz QFNOEGNXMHMGTB-XXBNENTESA-N 0 3 422.960 4.319 20 0 HIADHN Clc1ccc2ccc(N3CC[C@H]4CN(Cc5cccnc5)CCO[C@@H]4C3)nc2c1 ZINC001164976720 722128983 /nfs/dbraw/zinc/12/89/83/722128983.db2.gz MHVGSHAYOPMPOU-SIKLNZKXSA-N 0 3 408.933 4.011 20 0 HIADHN Cc1c(NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)cnn1-c1ccccc1F ZINC000435983419 861253897 /nfs/dbraw/zinc/25/38/97/861253897.db2.gz YWUMLEYWYOBZIG-GOSISDBHSA-N 0 3 410.468 4.310 20 0 HIADHN CN(C)CCN(C(=O)Nc1cccc(C[S@](=O)c2ccccc2)c1)C1CCCC1 ZINC000435997842 861281940 /nfs/dbraw/zinc/28/19/40/861281940.db2.gz DINLVIBBIHXDQV-LJAQVGFWSA-N 0 3 413.587 4.333 20 0 HIADHN CN(C)CCN(C(=O)Nc1cccc(C(=O)N(C)c2ccccc2)c1)C1CCCC1 ZINC000436004152 861292762 /nfs/dbraw/zinc/29/27/62/861292762.db2.gz JJCRECXYXITPSB-UHFFFAOYSA-N 0 3 408.546 4.301 20 0 HIADHN O=C(CN1CCCCCC1)Nc1ccc(NC(=O)c2cn[nH]c2-c2ccsc2)cc1 ZINC000436072800 861354140 /nfs/dbraw/zinc/35/41/40/861354140.db2.gz CMJZXTAJNVJDGJ-UHFFFAOYSA-N 0 3 423.542 4.205 20 0 HIADHN Cc1cc(NC(=O)[C@H](c2cccnc2)C(C)C)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000436151170 861449364 /nfs/dbraw/zinc/44/93/64/861449364.db2.gz KXNHSVUGDOMBBB-UPVQGACJSA-N 0 3 417.557 4.412 20 0 HIADHN CS[C@@H]1CN(C(=O)c2c(C)onc2-c2ccc(Cl)c(Cl)c2)C[C@H]1N(C)C ZINC000436152628 861451393 /nfs/dbraw/zinc/45/13/93/861451393.db2.gz WYUSGWVHRLPUAI-HUUCEWRRSA-N 0 3 414.358 4.074 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=S)Nc2ccc(Br)cc2)CC1 ZINC000006544647 845209706 /nfs/dbraw/zinc/20/97/06/845209706.db2.gz KBBYYTJJAAOAIY-UHFFFAOYSA-N 0 3 408.365 4.335 20 0 HIADHN Cc1sc2nc(C)nc(SCC(=O)NCc3ccccc3CN(C)C)c2c1C ZINC000006992891 845232648 /nfs/dbraw/zinc/23/26/48/845232648.db2.gz BNGJBFKBAMGDHT-UHFFFAOYSA-N 0 3 414.600 4.087 20 0 HIADHN Fc1ccc(Cn2cc(CN[C@H]3CCN(c4ccccc4OC(F)F)C3)cn2)cc1 ZINC000436239500 861548397 /nfs/dbraw/zinc/54/83/97/861548397.db2.gz GTOXGORUORCWFF-IBGZPJMESA-N 0 3 416.447 4.040 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)Nc1ccc(N2CCOCC2)cc1)c1ccc2c(c1)CCCC2 ZINC000007370721 845318089 /nfs/dbraw/zinc/31/80/89/845318089.db2.gz UJYMAGOEOYMQLA-MOPGFXCFSA-N 0 3 407.558 4.080 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@@H](C)NCc2cc3c(cccc3F)[nH]2)cc1 ZINC000436267875 861577364 /nfs/dbraw/zinc/57/73/64/861577364.db2.gz FGJRFUYOBMYQCF-OAHLLOKOSA-N 0 3 403.523 4.188 20 0 HIADHN CC(C)CCO[C@@H]1CCCC[C@H]1NCC(=O)Nc1cc2c(cc1Cl)OCCCO2 ZINC000436268699 861579612 /nfs/dbraw/zinc/57/96/12/861579612.db2.gz IHJGYBJQTVQHLH-IEBWSBKVSA-N 0 3 424.969 4.403 20 0 HIADHN COc1cc(NC(=O)CN[C@@H]2CCCC[C@H]2OCCC(C)C)c(OC)cc1Cl ZINC000436274252 861583361 /nfs/dbraw/zinc/58/33/61/861583361.db2.gz WHONGGOQDWTERV-SJLPKXTDSA-N 0 3 412.958 4.259 20 0 HIADHN Cc1c([C@H](C)N[C@H]2CC[C@@H](C(=O)N3CCCCC3)C2)nnn1-c1cccc(Cl)c1 ZINC000436284621 861591527 /nfs/dbraw/zinc/59/15/27/861591527.db2.gz MOGVZHGIMZJTSQ-WDYCEAGBSA-N 0 3 415.969 4.061 20 0 HIADHN C[C@@H](NCc1cnn(Cc2ccc(F)cc2)c1)[C@@H](OC1CCOCC1)c1ccccc1 ZINC000436294899 861600797 /nfs/dbraw/zinc/60/07/97/861600797.db2.gz PIRPOOFYTYXOEK-KBMIEXCESA-N 0 3 423.532 4.486 20 0 HIADHN O=C(Nc1ccccc1)c1ccc(CN2CCC(C(=O)N3CCCCC3)CC2)cc1 ZINC000011011302 845742878 /nfs/dbraw/zinc/74/28/78/845742878.db2.gz DOORSIWSXKPFHL-UHFFFAOYSA-N 0 3 405.542 4.163 20 0 HIADHN C/C=C/c1ccc(OCC(=O)N2c3ccc(C)cc3[C@H]3CN(C)CC[C@H]32)c(OC)c1 ZINC000011760323 845830709 /nfs/dbraw/zinc/83/07/09/845830709.db2.gz BFWSJNHJRXZJOT-GONYIKIESA-N 0 3 406.526 4.250 20 0 HIADHN C[C@H](c1ccc(-n2cncn2)cc1)N(C)Cc1cc(=O)oc2cc3c(cc12)CCC3 ZINC000017306110 846243114 /nfs/dbraw/zinc/24/31/14/846243114.db2.gz WGJWOMFRQKEZGP-MRXNPFEDSA-N 0 3 400.482 4.055 20 0 HIADHN COc1ccc(-c2nc(C(=O)NC3CCN(Cc4ccccc4)CC3)cs2)cc1 ZINC000017363072 846250579 /nfs/dbraw/zinc/25/05/79/846250579.db2.gz ZGYMCWLBVWZRTM-UHFFFAOYSA-N 0 3 407.539 4.213 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)COc3cc(Cl)ccc3Cl)cc2)CC1 ZINC000018356581 846323024 /nfs/dbraw/zinc/32/30/24/846323024.db2.gz LOEXVPMSTQCZKX-UHFFFAOYSA-N 0 3 408.329 4.153 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1)c1ccc(Br)s1 ZINC000436357795 861686417 /nfs/dbraw/zinc/68/64/17/861686417.db2.gz JLQHRPJADBDAFC-QEORTHHSSA-N 0 3 408.365 4.316 20 0 HIADHN Cc1sc2nc(CN3CCN(Cc4cccc5ccccc54)CC3)[nH]c(=O)c2c1C ZINC000022247163 846549849 /nfs/dbraw/zinc/54/98/49/846549849.db2.gz VAKNUXYRPJKQJN-UHFFFAOYSA-N 0 3 418.566 4.072 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cc(C)n(-c4cc(C)on4)c3C)c(C)c2)CC1 ZINC000022324728 846558625 /nfs/dbraw/zinc/55/86/25/846558625.db2.gz WRKUTMOQZJSACS-UHFFFAOYSA-N 0 3 421.545 4.093 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)c2ccc(OC)c(Br)c2)N(C)C)cc1 ZINC000022684074 846603193 /nfs/dbraw/zinc/60/31/93/846603193.db2.gz XRYNQLQXZOTXOG-GOSISDBHSA-N 0 3 405.336 4.053 20 0 HIADHN CCNC(=O)COc1ccc(CN[C@H](C)c2ccc(Cl)c(Cl)c2)cc1OC ZINC000022783392 846620458 /nfs/dbraw/zinc/62/04/58/846620458.db2.gz GPQYUNXDBZGKDD-CYBMUJFWSA-N 0 3 411.329 4.368 20 0 HIADHN C[C@@H]1CCN(C(=O)CN2CCCN(Cc3ccccc3)CC2)c2ccccc2S1 ZINC000022807236 846623922 /nfs/dbraw/zinc/62/39/22/846623922.db2.gz SBLKRFFWHZSCCP-HXUWFJFHSA-N 0 3 409.599 4.112 20 0 HIADHN COc1cc(C(C)=O)ccc1OC[C@@H](O)CNC(c1ccccc1)c1ccccc1 ZINC000023387299 846693460 /nfs/dbraw/zinc/69/34/60/846693460.db2.gz BIWICPZQSZEMOA-QFIPXVFZSA-N 0 3 405.494 4.017 20 0 HIADHN CC(C)c1ccc(-c2noc(CCC(=O)NCc3ccccc3CN(C)C)n2)cc1 ZINC000023444839 846703100 /nfs/dbraw/zinc/70/31/00/846703100.db2.gz SJKSHENJPASEOF-UHFFFAOYSA-N 0 3 406.530 4.171 20 0 HIADHN COc1ccc([C@@H](CNC(=O)Cc2csc(-c3ccccc3)n2)N2CCCC2)cc1 ZINC000023485869 846705933 /nfs/dbraw/zinc/70/59/33/846705933.db2.gz GDSYNTSLVFUTRS-JOCHJYFZSA-N 0 3 421.566 4.315 20 0 HIADHN O=C(CN1CCC(Cc2ccccc2)CC1)N1CCC[C@@H]1c1ccc2c(c1)OCCO2 ZINC000023697993 846741949 /nfs/dbraw/zinc/74/19/49/846741949.db2.gz FMTBSJGGRSPUNQ-HSZRJFAPSA-N 0 3 420.553 4.076 20 0 HIADHN Cc1cccc(-c2nn(-c3ccc(F)cc3)cc2CNCCNC(=O)c2ccco2)c1 ZINC000025055972 846913979 /nfs/dbraw/zinc/91/39/79/846913979.db2.gz ICRHVCCTZNTDKS-UHFFFAOYSA-N 0 3 418.472 4.099 20 0 HIADHN COc1cc(CNC[C@H]2COc3ccccc3O2)ccc1OCc1ccc(F)cc1 ZINC000025261688 846950312 /nfs/dbraw/zinc/95/03/12/846950312.db2.gz HWTWCNFFIAWOFU-FQEVSTJZSA-N 0 3 409.457 4.343 20 0 HIADHN O=C(CCN1CCC[C@H]1[C@H](O)C(F)(F)F)Nc1ccc(Oc2ccccc2)cc1 ZINC000436393710 861737752 /nfs/dbraw/zinc/73/77/52/861737752.db2.gz UZVCNQPTMGLJGG-ICSRJNTNSA-N 0 3 408.420 4.195 20 0 HIADHN CC(=O)c1ccc(OCCCC(=O)NCC(C)(C)N2CCc3ccccc3C2)cc1 ZINC000025464497 846981853 /nfs/dbraw/zinc/98/18/53/846981853.db2.gz XRBFVEBSYJNOMC-UHFFFAOYSA-N 0 3 408.542 4.001 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cc(Br)ccc1F)c1cccc(OC)c1 ZINC000025863372 847048255 /nfs/dbraw/zinc/04/82/55/847048255.db2.gz FBBWHQIIIBNWGJ-LJQANCHMSA-N 0 3 423.326 4.410 20 0 HIADHN CN(Cc1nc2ccccc2s1)C(=O)NCC(C)(C)N1CCc2ccccc2C1 ZINC000026165288 847096947 /nfs/dbraw/zinc/09/69/47/847096947.db2.gz IZUSRBDXGQKKKJ-UHFFFAOYSA-N 0 3 408.571 4.275 20 0 HIADHN COc1ccc(OC)c([C@@H](C)NC[C@@H](O)COc2ccc(-c3ccccc3)cc2)c1 ZINC000026715153 847190101 /nfs/dbraw/zinc/19/01/01/847190101.db2.gz DSFCTOMVUIIWAY-WIYYLYMNSA-N 0 3 407.510 4.461 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)C3(c4cccc(C)c4)CCC3)CC2)c1 ZINC000026961344 847226707 /nfs/dbraw/zinc/22/67/07/847226707.db2.gz ZYJKEBBGWPFWIO-UHFFFAOYSA-N 0 3 419.613 4.444 20 0 HIADHN COc1ccc(CN(C)C[C@H](O)COc2ccc3ccccc3c2)cc1OC(F)F ZINC000027210016 847266104 /nfs/dbraw/zinc/26/61/04/847266104.db2.gz YHDNDYQOAUQEJY-IBGZPJMESA-N 0 3 417.452 4.322 20 0 HIADHN O=C1CCCN1c1ccc(CNCc2cn(-c3ccccc3)nc2-c2ccncc2)cc1 ZINC000028315167 847404863 /nfs/dbraw/zinc/40/48/63/847404863.db2.gz BOMPHJRYLPNKKB-UHFFFAOYSA-N 0 3 423.520 4.351 20 0 HIADHN CC[C@H](CNC(=O)N[C@H](c1ccccc1)c1ccccn1)N1CCc2ccccc2C1 ZINC000028392915 847415000 /nfs/dbraw/zinc/41/50/00/847415000.db2.gz KSXHLMOGIWPJOZ-ILBGXUMGSA-N 0 3 414.553 4.307 20 0 HIADHN CN(CCC(=O)N[C@@H](c1cccs1)c1ccccc1)Cc1ccc2c(c1)OCO2 ZINC000028899847 847475192 /nfs/dbraw/zinc/47/51/92/847475192.db2.gz OQMLQGJPLCIIHX-HSZRJFAPSA-N 0 3 408.523 4.205 20 0 HIADHN CC(=O)Nc1cccc([C@H](C)NC[C@@H](O)COc2ccc(-c3ccccc3)cc2)c1 ZINC000028917876 847477762 /nfs/dbraw/zinc/47/77/62/847477762.db2.gz URGWWAWVOWUCJT-MHECFPHRSA-N 0 3 404.510 4.403 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CNC(=O)CN[C@@H](c1ccccc1)C(C)C ZINC000029117273 847509326 /nfs/dbraw/zinc/50/93/26/847509326.db2.gz PEZUVVPOQMENGX-RUZDIDTESA-N 0 3 404.558 4.151 20 0 HIADHN O=C(CCc1nc(-c2ccc(Cl)cc2)no1)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000029178598 847520157 /nfs/dbraw/zinc/52/01/57/847520157.db2.gz FZFOOWKHOZEVTP-FQEVSTJZSA-N 0 3 424.932 4.276 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3oc4ccccc4c3COC)c(C)c2)CC1 ZINC000029374011 847554226 /nfs/dbraw/zinc/55/42/26/847554226.db2.gz KCMSIFPDTQRUKY-UHFFFAOYSA-N 0 3 407.514 4.282 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)COc3ccc(C(C)(C)C)cc3)c(C)c2)CC1 ZINC000029375295 847554273 /nfs/dbraw/zinc/55/42/73/847554273.db2.gz DQUMSJQKVRQNLX-UHFFFAOYSA-N 0 3 409.574 4.452 20 0 HIADHN CC(C)n1ncc2c1nc(-c1ccco1)cc2C(=O)NC[C@H](c1ccccc1)N(C)C ZINC000029689953 847601273 /nfs/dbraw/zinc/60/12/73/847601273.db2.gz URHKDMCVEQKZQI-OAQYLSRUSA-N 0 3 417.513 4.305 20 0 HIADHN CC[C@H](CNC(=O)c1ccc(OC)c(Br)c1)N1CCc2ccccc2C1 ZINC000029910233 847647616 /nfs/dbraw/zinc/64/76/16/847647616.db2.gz KIWZGPYDZDFHQN-GOSISDBHSA-N 0 3 417.347 4.024 20 0 HIADHN CC[C@@H](CNC(=O)Cc1c(C)nc2ccccc2c1C)N1CCc2ccccc2C1 ZINC000029908372 847648239 /nfs/dbraw/zinc/64/82/39/847648239.db2.gz BGMQQPRLJFPSTF-QFIPXVFZSA-N 0 3 401.554 4.347 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)CN(C)[C@H](C)c3cc4ccccc4o3)cc2)CC1 ZINC000030005652 847669263 /nfs/dbraw/zinc/66/92/63/847669263.db2.gz INIHLUIGGJLZEX-LJQANCHMSA-N 0 3 420.557 4.206 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cc(-c4ccccc4F)on3)c(C)c2)CC1 ZINC000030035737 847675324 /nfs/dbraw/zinc/67/53/24/847675324.db2.gz LOXPGDNSTHSCSY-UHFFFAOYSA-N 0 3 408.477 4.183 20 0 HIADHN CC(C)c1noc([C@H](C)NCc2ccccc2CN2CCN(c3ccccc3)CC2)n1 ZINC000030512321 847725585 /nfs/dbraw/zinc/72/55/85/847725585.db2.gz WDUVBIOJLIMLHR-FQEVSTJZSA-N 0 3 419.573 4.366 20 0 HIADHN Cc1ccc(COc2ccc(CNCc3ccnc(N4CCOCC4)c3)cc2)cc1 ZINC000030900380 847793873 /nfs/dbraw/zinc/79/38/73/847793873.db2.gz AMGBTOQOGIKFNH-UHFFFAOYSA-N 0 3 403.526 4.095 20 0 HIADHN Cc1ccccc1CN1CCCN(C(=O)c2cc(Cl)c3c(c2)OCCCO3)CC1 ZINC000031766187 847944722 /nfs/dbraw/zinc/94/47/22/847944722.db2.gz ORZIYKLJAUAFBY-UHFFFAOYSA-N 0 3 414.933 4.158 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)[C@@H](NC(=O)c1ccc(C)cc1)C(C)C)c1ccsc1 ZINC000031987891 847975888 /nfs/dbraw/zinc/97/58/88/847975888.db2.gz DJZGBANKFGFXLD-SFTDATJTSA-N 0 3 415.603 4.010 20 0 HIADHN Cc1ccc2cc(C(=O)NCCCCN3CCN(c4cccc(C)c4)CC3)[nH]c2c1 ZINC000032066250 847984788 /nfs/dbraw/zinc/98/47/88/847984788.db2.gz VSOGDNIRYLHWJW-UHFFFAOYSA-N 0 3 404.558 4.117 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)c3ccc(OC(C)C)cc3)CC2)c1 ZINC000032067839 847984846 /nfs/dbraw/zinc/98/48/46/847984846.db2.gz ODTDWGPZOREKHR-UHFFFAOYSA-N 0 3 409.574 4.114 20 0 HIADHN Cc1cc(NC(=O)c2ccco2)sc1C(=O)NCCCN1CCc2ccccc2C1 ZINC000032400718 848018735 /nfs/dbraw/zinc/01/87/35/848018735.db2.gz BIUAJWNWJAXCSH-UHFFFAOYSA-N 0 3 423.538 4.080 20 0 HIADHN CC(=O)c1ccc(-c2ccc(C(=O)NCCCN3CCc4ccccc4C3)o2)cc1 ZINC000032400171 848019176 /nfs/dbraw/zinc/01/91/76/848019176.db2.gz XPUAUKVSZIJMRA-UHFFFAOYSA-N 0 3 402.494 4.327 20 0 HIADHN O=C(c1ccccc1[O-])N1CCC([NH2+][C@@H]2CCc3ccc(Br)cc32)CC1 ZINC000436595911 861862989 /nfs/dbraw/zinc/86/29/89/861862989.db2.gz OGGJCBOSPUNTNY-LJQANCHMSA-N 0 3 415.331 4.036 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)c1nn(-c2ccccc2F)c2c1CCC2 ZINC000032485282 848038110 /nfs/dbraw/zinc/03/81/10/848038110.db2.gz BKVQKAWTDDNOLJ-HSZRJFAPSA-N 0 3 418.516 4.067 20 0 HIADHN CCOc1c(Cl)cc(C(=O)NC[C@H](c2ccccc2)N2CCCC2)cc1OC ZINC000036883716 848171563 /nfs/dbraw/zinc/17/15/63/848171563.db2.gz SQHOQXPDQVKMPX-LJQANCHMSA-N 0 3 402.922 4.314 20 0 HIADHN COc1cc2c(cc1NC(=O)CN1CCN(C3CCCCC3)CC1)oc1ccccc12 ZINC000039199891 848182995 /nfs/dbraw/zinc/18/29/95/848182995.db2.gz OEGQKTJHHIMGPV-UHFFFAOYSA-N 0 3 421.541 4.483 20 0 HIADHN CCOc1ccccc1C(=O)N1CCC[C@H]1C(=O)C(C#N)c1nc2ccccc2s1 ZINC000041498166 848222659 /nfs/dbraw/zinc/22/26/59/848222659.db2.gz ZYDPBNGTAGQHCA-WMZOPIPTSA-N 0 3 419.506 4.176 20 0 HIADHN Cc1ncsc1CN(C)C[C@H]1CCN(C(=O)c2cc(C(C)C)c(O)cc2C)C1 ZINC000436657995 861884212 /nfs/dbraw/zinc/88/42/12/861884212.db2.gz KHTJDOUPUFKHTD-QGZVFWFLSA-N 0 3 401.576 4.183 20 0 HIADHN COc1cc([C@H](C)NCc2cc(OC)c3c(c2)OCCO3)ccc1OCC(C)C ZINC000042201787 848300435 /nfs/dbraw/zinc/30/04/35/848300435.db2.gz DDLJUNBDJREJTE-INIZCTEOSA-N 0 3 401.503 4.361 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N(Cc1cccs1)C[C@H]1CCCO1 ZINC000043231145 848396711 /nfs/dbraw/zinc/39/67/11/848396711.db2.gz KGHJMKPYBWKANF-IEBWSBKVSA-N 0 3 419.616 4.337 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N[C@@H](C)c3ccc(F)cc3F)c(C)c2)CC1 ZINC000043526536 848435827 /nfs/dbraw/zinc/43/58/27/848435827.db2.gz SWWRGICJGDCPPN-INIZCTEOSA-N 0 3 402.489 4.298 20 0 HIADHN Cc1ccc(-c2nc(CC(=O)NC[C@H](c3cccs3)N3CCCC3)cs2)o1 ZINC000043803464 848470135 /nfs/dbraw/zinc/47/01/35/848470135.db2.gz HPMZGCNQCADIQQ-MRXNPFEDSA-N 0 3 401.557 4.269 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)c1csc(COc2ccc(F)cc2)n1 ZINC000044020141 848502603 /nfs/dbraw/zinc/50/26/03/848502603.db2.gz NRQYTXMQXYXVSS-UHFFFAOYSA-N 0 3 413.518 4.065 20 0 HIADHN CN(C)C[C@H]1CCc2ccccc2N1C(=O)c1csc(-c2ccc3c(c2)OCO3)n1 ZINC000436727150 861910086 /nfs/dbraw/zinc/91/00/86/861910086.db2.gz XVKKGMDBYNCYEW-QGZVFWFLSA-N 0 3 421.522 4.062 20 0 HIADHN CC(C)c1cccc(C(C)C)c1NC(=S)NC[C@H](C(C)C)N1CCN(C)CC1 ZINC000044073281 848509560 /nfs/dbraw/zinc/50/95/60/848509560.db2.gz ZMSDALFJXKOXEI-OAQYLSRUSA-N 0 3 404.668 4.492 20 0 HIADHN CN(C)CCN(Cc1ccc(C#N)cc1)C(=S)Nc1cccc(Br)c1 ZINC000044158215 848524055 /nfs/dbraw/zinc/52/40/55/848524055.db2.gz FWCZOJWTXBINBF-UHFFFAOYSA-N 0 3 417.376 4.081 20 0 HIADHN Cc1ccc(NC(=S)NCCCCN2CCN(Cc3ccccc3)CC2)c(C)c1 ZINC000044238506 848535640 /nfs/dbraw/zinc/53/56/40/848535640.db2.gz MLTKJRIUJOXWFX-UHFFFAOYSA-N 0 3 410.631 4.188 20 0 HIADHN CC1CCN([C@@H](CNC(=O)c2cccc(Cn3ccnc3)c2)c2cccs2)CC1 ZINC000044867790 848610214 /nfs/dbraw/zinc/61/02/14/848610214.db2.gz QZXJPNHHHYGGBF-NRFANRHFSA-N 0 3 408.571 4.196 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3c(C)nn(-c4ccc(F)cc4)c3C)cc2)CC1 ZINC000045643672 848706414 /nfs/dbraw/zinc/70/64/14/848706414.db2.gz CLOXVOKSCVNWMW-UHFFFAOYSA-N 0 3 421.520 4.022 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)Nc2ccccc2CN(CC)C(C)=O)N(C)C)cc1 ZINC000045686181 848713698 /nfs/dbraw/zinc/71/36/98/848713698.db2.gz XDZQTLNFJQFWOD-HSZRJFAPSA-N 0 3 410.562 4.042 20 0 HIADHN CCc1cc(=O)[n-]c(-c2cccc(NC(=O)c3ccc(C[NH+]4CCCCC4)cc3)c2)n1 ZINC000046065474 848779782 /nfs/dbraw/zinc/77/97/82/848779782.db2.gz IDYTVCITWWOPPF-UHFFFAOYSA-N 0 3 416.525 4.238 20 0 HIADHN C[C@@H]1CCCCN1CCNC(=O)c1ccc(Cl)c(NC(=O)c2cccs2)c1 ZINC000047142707 848993327 /nfs/dbraw/zinc/99/33/27/848993327.db2.gz OLQKKZCOPAUYGE-CQSZACIVSA-N 0 3 405.951 4.258 20 0 HIADHN CCc1ccccc1-n1cnnc1SCC(=O)C(C#N)c1nc2ccccc2s1 ZINC000047365354 849033422 /nfs/dbraw/zinc/03/34/22/849033422.db2.gz MXRHDZBSSKUZLC-OAHLLOKOSA-N 0 3 419.535 4.408 20 0 HIADHN Cc1ccc(-n2cnnc2SCC(=O)C(C#N)c2nc3ccccc3s2)cc1C ZINC000047365367 849033696 /nfs/dbraw/zinc/03/36/96/849033696.db2.gz DESHQSPWRYZEMN-INIZCTEOSA-N 0 3 419.535 4.462 20 0 HIADHN Cc1ccccc1-n1ncc(C(=O)NCc2ccccc2CN(C)C)c1C(F)(F)F ZINC000047429236 849044998 /nfs/dbraw/zinc/04/49/98/849044998.db2.gz HSMJOWAXOMGIBR-UHFFFAOYSA-N 0 3 416.447 4.191 20 0 HIADHN CC(C)NC(=O)Nc1ccc([C@H](C)NCc2cc(Cl)c3c(c2)OCCO3)cc1 ZINC000047723551 849099467 /nfs/dbraw/zinc/09/94/67/849099467.db2.gz HNFKGBBPOQEZOJ-AWEZNQCLSA-N 0 3 403.910 4.492 20 0 HIADHN COc1cc(C)c([C@H](C)NC(=O)NC[C@H](c2cccs2)N2CCCC2)cc1OC ZINC000047951701 849143602 /nfs/dbraw/zinc/14/36/02/849143602.db2.gz WUXKNNQSIWUOJI-FUHWJXTLSA-N 0 3 417.575 4.271 20 0 HIADHN CCCOc1ccc(CNC(=O)NC[C@@H](c2cccs2)N2CCCC2)cc1OC ZINC000047950892 849144085 /nfs/dbraw/zinc/14/40/85/849144085.db2.gz VHKGBNFOIRTPOL-SFHVURJKSA-N 0 3 417.575 4.182 20 0 HIADHN COc1cc(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2)c(OC)cc1Cl ZINC000048055156 849155187 /nfs/dbraw/zinc/15/51/87/849155187.db2.gz ZNYCDTMXUNPARB-UHFFFAOYSA-N 0 3 409.889 4.092 20 0 HIADHN CC(C)C(=O)Nc1ccc(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2)cc1 ZINC000048058049 849156476 /nfs/dbraw/zinc/15/64/76/849156476.db2.gz HVHYMPSNAFSJOS-UHFFFAOYSA-N 0 3 400.498 4.016 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)Nc1ccc(N2CCCC2)c(F)c1 ZINC000048138252 849175806 /nfs/dbraw/zinc/17/58/06/849175806.db2.gz IGMVZLWYTQHAKS-LJQANCHMSA-N 0 3 402.539 4.446 20 0 HIADHN CN(C)[C@@H](CNC(=O)Nc1cccc(NC(=O)c2ccccc2)c1)Cc1ccccc1 ZINC000048481390 849230776 /nfs/dbraw/zinc/23/07/76/849230776.db2.gz WZQDHHWIDBBEGI-HSZRJFAPSA-N 0 3 416.525 4.233 20 0 HIADHN Fc1ccc(N2CCN(c3cc(CNCc4ccc(Cl)cc4)ccn3)CC2)cc1 ZINC000048744983 849261898 /nfs/dbraw/zinc/26/18/98/849261898.db2.gz BWRDJEXAKBODMI-UHFFFAOYSA-N 0 3 410.924 4.491 20 0 HIADHN COc1cccc(OC)c1Oc1ccc(CNCc2ccc(-n3cccn3)cc2)cn1 ZINC000048749702 849264603 /nfs/dbraw/zinc/26/46/03/849264603.db2.gz AIZRXENEWRUHGW-UHFFFAOYSA-N 0 3 416.481 4.367 20 0 HIADHN CC(C)CCOc1ccc(CN[C@H](C)c2ccc(S(=O)(=O)N(C)C)cc2)cc1 ZINC000048780215 849266799 /nfs/dbraw/zinc/26/67/99/849266799.db2.gz MCSMEXZJUSNHBQ-GOSISDBHSA-N 0 3 404.576 4.213 20 0 HIADHN N#CC(C(=O)[C@@H]1CCCN(C(=O)Cc2ccc(F)cc2)C1)c1ccc2ccccc2n1 ZINC000048857315 849275735 /nfs/dbraw/zinc/27/57/35/849275735.db2.gz YSGUNVMHBKUEPG-CTNGQTDRSA-N 0 3 415.468 4.031 20 0 HIADHN CN(C)[C@H](CNC(=O)N1CCC[C@H]1c1nc2ccccc2s1)Cc1ccccc1 ZINC000049794798 849329552 /nfs/dbraw/zinc/32/95/52/849329552.db2.gz ASGLYQRPHPXNKT-ICSRJNTNSA-N 0 3 408.571 4.316 20 0 HIADHN COC(=O)Cc1ccc(NC(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)cc1 ZINC000049790145 849329883 /nfs/dbraw/zinc/32/98/83/849329883.db2.gz SGKHSFWDYZZOMH-LJQANCHMSA-N 0 3 415.559 4.058 20 0 HIADHN C[C@@H](CNC(=O)N1CCC(C(=O)c2ccc(Cl)cc2)CC1)N1CCCC[C@H]1C ZINC000050112087 849354182 /nfs/dbraw/zinc/35/41/82/849354182.db2.gz VDVVUTYRXDMRJC-SJORKVTESA-N 0 3 405.970 4.207 20 0 HIADHN O=C(c1ccccc1[O-])N1CCC([NH2+][C@@H]2CCCOc3c(Cl)cccc32)CC1 ZINC000436828320 862010033 /nfs/dbraw/zinc/01/00/33/862010033.db2.gz LWVAAHWQTHBVPS-LJQANCHMSA-N 0 3 400.906 4.154 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2ccc(C(=O)NCC(C)C)cc2C)N(C)C)cc1 ZINC000051645818 849497253 /nfs/dbraw/zinc/49/72/53/849497253.db2.gz QKLPZOBDSXBWLG-QFIPXVFZSA-N 0 3 410.562 4.114 20 0 HIADHN Cc1cc(N2CCSCC2)ccc1NC(=O)N1CCN(CC2CCCCC2)CC1 ZINC000051648698 849497832 /nfs/dbraw/zinc/49/78/32/849497832.db2.gz IDWMLTVQVHLGOL-UHFFFAOYSA-N 0 3 416.635 4.278 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)CCCCC(=O)c3ccccc3)cc2)CC1 ZINC000052877505 849636871 /nfs/dbraw/zinc/63/68/71/849636871.db2.gz IFYDEIDIHLEYCQ-UHFFFAOYSA-N 0 3 407.558 4.206 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)c1cc(-c2ccc(C)cc2)no1 ZINC000053120878 849669746 /nfs/dbraw/zinc/66/97/46/849669746.db2.gz UFVYHRPCQZXQRZ-NRFANRHFSA-N 0 3 404.514 4.172 20 0 HIADHN CCOc1cc(C(=O)N(CC(C)C)C2CCN(C)CC2)cc(OCC)c1OCC ZINC000053222840 849681417 /nfs/dbraw/zinc/68/14/17/849681417.db2.gz BXBFZMGWPQVIOY-UHFFFAOYSA-N 0 3 406.567 4.075 20 0 HIADHN Cc1nc(COc2cccc(C(=O)N(CC(C)C)C3CCN(C)CC3)c2)cs1 ZINC000053223343 849681620 /nfs/dbraw/zinc/68/16/20/849681620.db2.gz JRHWNBKMRKCKQM-UHFFFAOYSA-N 0 3 401.576 4.223 20 0 HIADHN COc1ccc2[nH]cc(CN3CCC(O)(c4ccc(Br)cc4)CC3)c2c1 ZINC000053294773 849691166 /nfs/dbraw/zinc/69/11/66/849691166.db2.gz MIEJOQGHYSYEFX-UHFFFAOYSA-N 0 3 415.331 4.423 20 0 HIADHN CN(C)Cc1cccc(NC(=O)[C@H]2CCN(c3ccc(Cl)c(Cl)c3)C2=O)c1 ZINC000053477341 849718171 /nfs/dbraw/zinc/71/81/71/849718171.db2.gz LFPHPJLWGGYKTI-MRXNPFEDSA-N 0 3 406.313 4.047 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N1CCC(OCc2ccccc2)CC1 ZINC000053548380 849731273 /nfs/dbraw/zinc/73/12/73/849731273.db2.gz GCZDXPYTYPKHHE-OAQYLSRUSA-N 0 3 413.587 4.276 20 0 HIADHN CCOc1cc(-c2noc([C@H]3CN(Cc4ccccc4)CCC3(F)F)n2)ccc1O ZINC000436880597 862059383 /nfs/dbraw/zinc/05/93/83/862059383.db2.gz RXNXILCRDYTKCZ-QGZVFWFLSA-N 0 3 415.440 4.466 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)Cc2csc(Cc3ccccc3)n2)C1 ZINC000054223271 849828804 /nfs/dbraw/zinc/82/88/04/849828804.db2.gz GFOPGTYNMRGCFE-RXVVDRJESA-N 0 3 405.567 4.228 20 0 HIADHN Cc1noc(C)c1COc1cccc(C(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)c1 ZINC000054227478 849830369 /nfs/dbraw/zinc/83/03/69/849830369.db2.gz UZKOLJDIACWKKO-AVRDEDQJSA-N 0 3 419.525 4.436 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)Nc2cc3c(cc2Cl)OCCO3)C1 ZINC000054386603 849856815 /nfs/dbraw/zinc/85/68/15/849856815.db2.gz KDZVPHBSTIYVIQ-ZBFHGGJFSA-N 0 3 401.894 4.068 20 0 HIADHN CCN(Cc1cccc(NC(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)c1)C(C)=O ZINC000054409433 849862520 /nfs/dbraw/zinc/86/25/20/849862520.db2.gz LKHJTXMHHURHRH-MBSDFSHPSA-N 0 3 408.546 4.012 20 0 HIADHN CC(=O)Nc1ccc(Cl)c(NC(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)c1 ZINC000054446263 849869325 /nfs/dbraw/zinc/86/93/25/849869325.db2.gz XZNVYPPWPOBNQA-KDOFPFPSSA-N 0 3 400.910 4.255 20 0 HIADHN CCCNC(=O)c1ccc(NC(=O)N2CCN(CCC(C)(C)C)CC2)cc1Cl ZINC000054476577 849874129 /nfs/dbraw/zinc/87/41/29/849874129.db2.gz FFCUMSGIVPUAFJ-UHFFFAOYSA-N 0 3 408.974 4.066 20 0 HIADHN O=C(NCCN1CCCCC1)Nc1ccc(NC(=O)c2ccc(Cl)cc2)cc1 ZINC000054507247 849881184 /nfs/dbraw/zinc/88/11/84/849881184.db2.gz ZNZQCFJARIUFTG-UHFFFAOYSA-N 0 3 400.910 4.200 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)N(Cc1ccccc1)C[C@H]1CCCO1 ZINC000054541890 849886119 /nfs/dbraw/zinc/88/61/19/849886119.db2.gz YLDPXGWIYAFQOI-RTWAWAEBSA-N 0 3 413.587 4.276 20 0 HIADHN CCCC(=O)Nc1cccc(CNC(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)c1 ZINC000054717976 849912407 /nfs/dbraw/zinc/91/24/07/849912407.db2.gz ZXDJWFSBFFGALI-PGRDOPGGSA-N 0 3 408.546 4.060 20 0 HIADHN CCCC(=O)Nc1ccc(CNC(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)cc1 ZINC000054717974 849912841 /nfs/dbraw/zinc/91/28/41/849912841.db2.gz UCBFVEIGTYKHHG-AVRDEDQJSA-N 0 3 408.546 4.060 20 0 HIADHN O=C(Nc1ccccc1)[C@@H]1CCCN(Cc2cccc(C(=O)N3CCCCC3)c2)C1 ZINC000054808269 849926748 /nfs/dbraw/zinc/92/67/48/849926748.db2.gz LXVTVYFBYCUNEP-JOCHJYFZSA-N 0 3 405.542 4.163 20 0 HIADHN COc1ccc(C(=O)C2CCN(CCCc3nc(-c4ccccc4)no3)CC2)cc1 ZINC000054886772 849937013 /nfs/dbraw/zinc/93/70/13/849937013.db2.gz XLJNLGUUQFUKDV-UHFFFAOYSA-N 0 3 405.498 4.273 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)N1CCC[C@@H](c2nc3ccccc3[nH]2)C1 ZINC000054921001 849943007 /nfs/dbraw/zinc/94/30/07/849943007.db2.gz IDYJDIFVHYSFFH-OFNKIYASSA-N 0 3 417.557 4.289 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)CSc2ccc(C(F)(F)F)cn2)C1 ZINC000056168506 850268114 /nfs/dbraw/zinc/26/81/14/850268114.db2.gz AXRGUKJMFORCHX-PBHICJAKSA-N 0 3 409.477 4.144 20 0 HIADHN O=C(NCc1ccccc1)C1CCN(Cc2cccc(OCC(F)(F)F)c2)CC1 ZINC000056267990 850304457 /nfs/dbraw/zinc/30/44/57/850304457.db2.gz AJKCRMHWMVWYEZ-UHFFFAOYSA-N 0 3 406.448 4.156 20 0 HIADHN CN(C)Cc1cccc(NC(=O)NCC2(c3ccc(Cl)cc3)CCOCC2)c1 ZINC000056621307 850417870 /nfs/dbraw/zinc/41/78/70/850417870.db2.gz GJSBBKANPIQAQG-UHFFFAOYSA-N 0 3 401.938 4.272 20 0 HIADHN COc1cc(-c2noc([C@@]3(C(F)(F)F)CCN(Cc4ccccc4)C3)n2)ccc1O ZINC000436950705 862127499 /nfs/dbraw/zinc/12/74/99/862127499.db2.gz OHVHQUBVGKNDDY-HXUWFJFHSA-N 0 3 419.403 4.157 20 0 HIADHN CC[C@@H](CNC(=O)Nc1ccc(C)c(NC(C)=O)c1C)N1CCc2ccccc2C1 ZINC000056690937 850440786 /nfs/dbraw/zinc/44/07/86/850440786.db2.gz PRVHVWQXHOKREI-NRFANRHFSA-N 0 3 408.546 4.220 20 0 HIADHN CN1CCC[C@@H](NC(=O)N[C@@H](c2ccccc2)c2ccc(Br)cc2F)C1 ZINC000057831917 850727181 /nfs/dbraw/zinc/72/71/81/850727181.db2.gz JIKQDLFSXFYAHP-APWZRJJASA-N 0 3 420.326 4.071 20 0 HIADHN CCN(Cc1ccccc1NC(=O)N1CCCN(Cc2ccccc2C)CC1)C(C)=O ZINC000058154785 850775090 /nfs/dbraw/zinc/77/50/90/850775090.db2.gz WBSLPRAATZJTAB-UHFFFAOYSA-N 0 3 422.573 4.103 20 0 HIADHN CCOc1cc(CNCc2cc3ccccc3[nH]2)ccc1OCC(=O)N1CCCCC1 ZINC000058474100 850834692 /nfs/dbraw/zinc/83/46/92/850834692.db2.gz PJIWVHUTRHFSNJ-UHFFFAOYSA-N 0 3 421.541 4.248 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Cc1ccc(C(F)(F)F)cc1)c1cccc(OC)c1 ZINC000058582166 850861127 /nfs/dbraw/zinc/86/11/27/850861127.db2.gz FEAPHKFPXFXIIA-HXUWFJFHSA-N 0 3 408.464 4.456 20 0 HIADHN Cc1c2cccc(Cl)c2oc1C(=O)Nc1ccc2oc(=O)n(CCN(C)C)c2c1 ZINC000058738033 850907722 /nfs/dbraw/zinc/90/77/22/850907722.db2.gz UIEGTYCAAVRWLG-UHFFFAOYSA-N 0 3 413.861 4.116 20 0 HIADHN CCN(CC)[C@H](CNC(=O)CSc1ccc(C(F)(F)F)cn1)c1ccsc1 ZINC000058954555 850968278 /nfs/dbraw/zinc/96/82/78/850968278.db2.gz MLPIASZRGOZLAK-OAHLLOKOSA-N 0 3 417.522 4.453 20 0 HIADHN CC1CCN([C@H](CNC(=O)N2CCC[C@H]2c2cccn2C)c2cccs2)CC1 ZINC000059264384 850989125 /nfs/dbraw/zinc/98/91/25/850989125.db2.gz YNPBKQDMAPCHSF-VQTJNVASSA-N 0 3 400.592 4.406 20 0 HIADHN CCCOc1c(Cl)cc(C(=O)N(CCN(C)C)Cc2ccc(C)o2)cc1OC ZINC000059924244 851024433 /nfs/dbraw/zinc/02/44/33/851024433.db2.gz WDKBKKIZEBYZOX-UHFFFAOYSA-N 0 3 408.926 4.243 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2cccc(NC(=O)c3ccc(F)cc3)c2)N(C)C)cc1 ZINC000060155696 851045690 /nfs/dbraw/zinc/04/56/90/851045690.db2.gz MZWGZUZWVRDNED-QHCPKHFHSA-N 0 3 419.500 4.419 20 0 HIADHN Cc1ccc([C@H](CNC(=O)/C=C/c2ccc(OCc3cccnc3)cc2)N(C)C)cc1 ZINC000060155831 851046683 /nfs/dbraw/zinc/04/66/83/851046683.db2.gz XXVJLRFXZSEERX-HFRIYAALSA-N 0 3 415.537 4.401 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)CSc1nc2ccccc2s1 ZINC000060167912 851048390 /nfs/dbraw/zinc/04/83/90/851048390.db2.gz AKTFAPHNTXPKDI-UHFFFAOYSA-N 0 3 421.538 4.257 20 0 HIADHN CCOc1c(Br)cc(C(=O)N(CCN(C)C)c2ccccc2)cc1OC ZINC000060208489 851052137 /nfs/dbraw/zinc/05/21/37/851052137.db2.gz KOOREMRHKFHFPT-UHFFFAOYSA-N 0 3 421.335 4.065 20 0 HIADHN Cc1cccc(CSCC(=O)Nc2ccc(CCN3CCSCC3)cc2)c1 ZINC000060221041 851053350 /nfs/dbraw/zinc/05/33/50/851053350.db2.gz MWOOGAJQMLJHMM-UHFFFAOYSA-N 0 3 400.613 4.458 20 0 HIADHN CC1CCN([C@@H](CNC(=O)c2ccccc2N(C)C(=O)C2CC2)c2ccccc2)CC1 ZINC000060410436 851089332 /nfs/dbraw/zinc/08/93/32/851089332.db2.gz VJGZRBYCRVRXSR-DEOSSOPVSA-N 0 3 419.569 4.262 20 0 HIADHN O[C@@H](CNCc1cc(Cl)c2c(c1)OCCCO2)c1ccccc1C(F)(F)F ZINC000060522598 851132889 /nfs/dbraw/zinc/13/28/89/851132889.db2.gz YAUVIBBAPMTVNM-INIZCTEOSA-N 0 3 401.812 4.343 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)NCc1cccc(Br)c1 ZINC000060564683 851148623 /nfs/dbraw/zinc/14/86/23/851148623.db2.gz HWZIGMRIYCVUHO-UHFFFAOYSA-N 0 3 424.770 4.376 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCc1cccc(Br)c1)c1ccsc1 ZINC000060565741 851149333 /nfs/dbraw/zinc/14/93/33/851149333.db2.gz VDOBQAUYBPKXHR-KRWDZBQOSA-N 0 3 410.381 4.393 20 0 HIADHN COc1ccc2cc(CN(C)C(=O)CN3CCN(CC4CCCCC4)CC3)ccc2c1 ZINC000060569216 851150729 /nfs/dbraw/zinc/15/07/29/851150729.db2.gz JVTMOKDAEWMJGU-UHFFFAOYSA-N 0 3 423.601 4.005 20 0 HIADHN CCn1c2ccccc2c2cc(NC(=O)C(=O)N3CCCN(C(C)(C)C)CC3)ccc21 ZINC000060690476 851192098 /nfs/dbraw/zinc/19/20/98/851192098.db2.gz VCGYKRCGJDQKFQ-UHFFFAOYSA-N 0 3 420.557 4.086 20 0 HIADHN Cc1nn(Cc2ccc(Cl)cc2)c(Cl)c1CNCCCN1CCCCCC1=O ZINC000061014550 851273021 /nfs/dbraw/zinc/27/30/21/851273021.db2.gz JXFIHLUIJZOGCR-UHFFFAOYSA-N 0 3 423.388 4.429 20 0 HIADHN CCOc1cc2c(cc1NC(=O)c1ccc(N3CCN(C(C)C)CC3)cc1)O[C@@H](C)C2 ZINC000061135143 851301961 /nfs/dbraw/zinc/30/19/61/851301961.db2.gz MRUWGTPVUSGZAG-SFHVURJKSA-N 0 3 423.557 4.191 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N(C)[C@H](C)c3cc(F)ccc3F)cc2)CC1 ZINC000061139567 851302620 /nfs/dbraw/zinc/30/26/20/851302620.db2.gz QUIMEMKTLNDAJT-QGZVFWFLSA-N 0 3 401.501 4.328 20 0 HIADHN COc1cccc(CCNC(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)c1 ZINC000061191214 851313682 /nfs/dbraw/zinc/31/36/82/851313682.db2.gz SPMOZXYHAYSBTD-HXUWFJFHSA-N 0 3 401.576 4.072 20 0 HIADHN O=C(CSc1nc2ccccc2o1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000061289206 851339499 /nfs/dbraw/zinc/33/94/99/851339499.db2.gz FPWARJGMRWMDNF-UHFFFAOYSA-N 0 3 413.568 4.150 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1ccc(Cn2nc(C)cc2C)cc1)c1ccsc1 ZINC000061398728 851365223 /nfs/dbraw/zinc/36/52/23/851365223.db2.gz JXLJTAPLPQZYKH-QFIPXVFZSA-N 0 3 410.587 4.423 20 0 HIADHN O=C(CCC(=O)c1ccc(F)cc1F)Nc1ccc(CCN2CCSCC2)cc1 ZINC000061572085 851408579 /nfs/dbraw/zinc/40/85/79/851408579.db2.gz ZLXUUQRKCIDEQN-UHFFFAOYSA-N 0 3 418.509 4.158 20 0 HIADHN CCN(CC)C(=O)c1ccc(NC(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)cc1 ZINC000061747191 851437808 /nfs/dbraw/zinc/43/78/08/851437808.db2.gz OABOMCFOUJTDPE-QHCPKHFHSA-N 0 3 422.573 4.436 20 0 HIADHN CN(Cc1ccc(F)cc1F)C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000061792535 851454133 /nfs/dbraw/zinc/45/41/33/851454133.db2.gz LIBYZHCJIPAGJO-UHFFFAOYSA-N 0 3 405.514 4.220 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)C(=O)Nc1ccc(SC(F)F)cc1)c1ccccc1 ZINC000061878764 851467510 /nfs/dbraw/zinc/46/75/10/851467510.db2.gz KXRUGKIKJMQVAD-SFHVURJKSA-N 0 3 421.513 4.139 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)C(=O)Nc1ccc2c3c(cccc31)CC2)c1ccccc1 ZINC000061878971 851467682 /nfs/dbraw/zinc/46/76/82/851467682.db2.gz XOKMTKOEERAFNJ-QHCPKHFHSA-N 0 3 415.537 4.076 20 0 HIADHN CC(C)(CNC(=O)NCc1csc(Br)c1)N1CCc2ccccc2C1 ZINC000062029600 851493348 /nfs/dbraw/zinc/49/33/48/851493348.db2.gz WJJKASWBNZDYCU-UHFFFAOYSA-N 0 3 422.392 4.147 20 0 HIADHN CCn1c2ccccc2c2cc(NC(=O)C(=O)NC[C@H](C)N3CCCC[C@H]3C)ccc21 ZINC000062120335 851503844 /nfs/dbraw/zinc/50/38/44/851503844.db2.gz LBOBMDFXYZBNDO-MSOLQXFVSA-N 0 3 420.557 4.132 20 0 HIADHN O=C(CCCc1nnc(-c2ccccc2)o1)NC[C@@H]1CCCCN1Cc1ccccc1 ZINC000062228229 851510695 /nfs/dbraw/zinc/51/06/95/851510695.db2.gz SLBHBWOIOPQQQP-QFIPXVFZSA-N 0 3 418.541 4.230 20 0 HIADHN Cc1ccccc1C1(CN[C@@H](C(=O)N2CCCCC2)c2ccccc2)CCOCC1 ZINC000062240245 851513630 /nfs/dbraw/zinc/51/36/30/851513630.db2.gz UYOMCLBGYMPARJ-XMMPIXPASA-N 0 3 406.570 4.387 20 0 HIADHN CCCCCc1nnc(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2F)s1 ZINC000062375799 851533226 /nfs/dbraw/zinc/53/32/26/851533226.db2.gz DGLDMMHLVQYFJR-UHFFFAOYSA-N 0 3 411.522 4.145 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)Nc1ccccc1N1CCCC1 ZINC000062377094 851534040 /nfs/dbraw/zinc/53/40/40/851534040.db2.gz CHZLUIRXQLFSMT-UHFFFAOYSA-N 0 3 402.489 4.161 20 0 HIADHN CC(C)C(=O)Nc1ccc(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2F)cc1 ZINC000062378520 851535446 /nfs/dbraw/zinc/53/54/46/851535446.db2.gz AGYLJAINLYUCMW-UHFFFAOYSA-N 0 3 418.488 4.155 20 0 HIADHN CCOc1cc2c(cc1NC(=O)N(CCN(C)C)Cc1cccc(F)c1)O[C@H](C)C2 ZINC000062380276 851536165 /nfs/dbraw/zinc/53/61/65/851536165.db2.gz YXZYAOHCSYZNKX-MRXNPFEDSA-N 0 3 415.509 4.144 20 0 HIADHN CC(=O)Nc1ccc(C)c(NC(=O)N(CCN(C)C)Cc2cccc(Cl)c2)c1 ZINC000062392501 851539493 /nfs/dbraw/zinc/53/94/93/851539493.db2.gz GQODRASGHIOHNE-UHFFFAOYSA-N 0 3 402.926 4.203 20 0 HIADHN CCC(=O)Nc1ccc(C)c(NC(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)c1 ZINC000062392282 851539729 /nfs/dbraw/zinc/53/97/29/851539729.db2.gz VLRUNFPFSSYSGC-UHFFFAOYSA-N 0 3 418.488 4.217 20 0 HIADHN CCOc1cc(NC(=O)N(CCN(C)C)Cc2cccc(Cl)c2)ccc1OC ZINC000062399751 851541832 /nfs/dbraw/zinc/54/18/32/851541832.db2.gz UTHZPSDARJVKDJ-UHFFFAOYSA-N 0 3 405.926 4.343 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)Nc1cc(F)c(N2CCCC2)c(F)c1 ZINC000062402097 851542102 /nfs/dbraw/zinc/54/21/02/851542102.db2.gz NYNLUGUECGYDLK-UHFFFAOYSA-N 0 3 420.479 4.300 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)Nc1ccc(-c2csnn2)cc1 ZINC000062410637 851545665 /nfs/dbraw/zinc/54/56/65/851545665.db2.gz MMZTURUMUMZFBU-UHFFFAOYSA-N 0 3 417.485 4.079 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCCc1nc2ccccc2n1CC)c1ccsc1 ZINC000062557729 851573591 /nfs/dbraw/zinc/57/35/91/851573591.db2.gz ACRIVRYROXQNNB-HXUWFJFHSA-N 0 3 413.591 4.043 20 0 HIADHN C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=S)NC1CCN(Cc2ccccc2)CC1 ZINC000062698692 851591752 /nfs/dbraw/zinc/59/17/52/851591752.db2.gz BJFZLKHPGHYGON-UHFFFAOYSA-N 0 3 424.570 4.122 20 0 HIADHN O=C(CCC(=O)c1ccc2c(c1)CCC2)NCC1CCN(Cc2ccccc2)CC1 ZINC000063112420 851617016 /nfs/dbraw/zinc/61/70/16/851617016.db2.gz WLCJDWXQRAHLJW-UHFFFAOYSA-N 0 3 404.554 4.167 20 0 HIADHN S=C(NC1CCN(Cc2ccccc2)CC1)N(Cc1ccco1)c1cccnc1 ZINC000063144847 851620322 /nfs/dbraw/zinc/62/03/22/851620322.db2.gz NCAUIZLCKOYJRS-UHFFFAOYSA-N 0 3 406.555 4.220 20 0 HIADHN CCCC(=O)Nc1ccc(CNC(=S)NC2CCN(Cc3ccccc3)CC2)cc1 ZINC000063149172 851621076 /nfs/dbraw/zinc/62/10/76/851621076.db2.gz RWWGVSSKLDOCGJ-UHFFFAOYSA-N 0 3 424.614 4.054 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1NC(=S)NC1CCN(Cc2ccccc2)CC1 ZINC000063145985 851622273 /nfs/dbraw/zinc/62/22/73/851622273.db2.gz JUGXGGMKNWEJRX-UHFFFAOYSA-N 0 3 419.598 4.440 20 0 HIADHN COc1cc(CNCc2ccc(Cl)cc2)cc(I)c1OC ZINC000063312842 851657870 /nfs/dbraw/zinc/65/78/70/851657870.db2.gz DCVQRSCZGNRPRI-UHFFFAOYSA-N 0 3 417.674 4.252 20 0 HIADHN CCOc1cccc([C@@H](C)NC(=O)NCCCCN2CCN(c3ccccc3)CC2)c1 ZINC000063323078 851661120 /nfs/dbraw/zinc/66/11/20/851661120.db2.gz VBLPNYFYYNORSS-OAQYLSRUSA-N 0 3 424.589 4.048 20 0 HIADHN O[C@@H](COc1cccc(C(F)(F)F)c1)CN1CCC(OCc2ccccc2)CC1 ZINC000063483893 851701349 /nfs/dbraw/zinc/70/13/49/851701349.db2.gz FTUPIOZAAQJTCL-LJQANCHMSA-N 0 3 409.448 4.126 20 0 HIADHN CCN(Cc1ccc(Cl)c(Cl)c1)C[C@@H](O)COc1c(OC)cccc1OC ZINC000063549846 851712737 /nfs/dbraw/zinc/71/27/37/851712737.db2.gz VDUNUUIIYAZNMU-OAHLLOKOSA-N 0 3 414.329 4.272 20 0 HIADHN C[C@@H](CC(=O)Nc1ccc(Br)cc1)N[C@@H]1CCOc2c(F)cccc21 ZINC000437081026 862276692 /nfs/dbraw/zinc/27/66/92/862276692.db2.gz WHOAYEOAASMZGF-YVEFUNNKSA-N 0 3 407.283 4.419 20 0 HIADHN C[C@@H](CC(=O)Nc1cccc(Br)c1)N[C@@H]1CCOc2c(F)cccc21 ZINC000437084050 862279370 /nfs/dbraw/zinc/27/93/70/862279370.db2.gz KKQLJBARTOGPMC-YVEFUNNKSA-N 0 3 407.283 4.419 20 0 HIADHN O=C(CN(CCc1ccccc1)C1CCCC1)Nc1cccc(C(=O)NC2CC2)c1 ZINC000063754801 851755852 /nfs/dbraw/zinc/75/58/52/851755852.db2.gz LMLXQYCPNLZQRB-UHFFFAOYSA-N 0 3 405.542 4.005 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cc(F)ccc1NC(=O)[C@@H]1C[C@H]1C)c1ccsc1 ZINC000063803161 851768464 /nfs/dbraw/zinc/76/84/64/851768464.db2.gz YPNBFIINFQORHA-ZTQAJYAQSA-N 0 3 417.550 4.295 20 0 HIADHN CCOc1cc(CNC(=O)c2cccc(CN3CCCC3)c2)ccc1OC(F)F ZINC000064026504 851817767 /nfs/dbraw/zinc/81/77/67/851817767.db2.gz FSBAJMUWPLLZJI-UHFFFAOYSA-N 0 3 404.457 4.213 20 0 HIADHN CC(C)c1ccc(-c2noc(COC(=O)C3CCN(c4ccc(F)cc4)C3=O)n2)cc1 ZINC000064042281 851819923 /nfs/dbraw/zinc/81/99/23/851819923.db2.gz CLPQQXYQPOVSIT-LJQANCHMSA-N 0 3 423.444 4.095 20 0 HIADHN COc1ccc(-c2cnc(CCC(=O)NC[C@@H](c3ccc(C)cc3)N(C)C)o2)cc1 ZINC000064052060 851822110 /nfs/dbraw/zinc/82/21/10/851822110.db2.gz XCCNIGFXNYZULQ-NRFANRHFSA-N 0 3 407.514 4.010 20 0 HIADHN O=C(CN1CCN(CC2CCCCC2)CC1)Nc1ccc(N2CCCCCC2)cc1 ZINC000064129645 851832764 /nfs/dbraw/zinc/83/27/64/851832764.db2.gz BXUAAOWWGIGXOR-UHFFFAOYSA-N 0 3 412.622 4.203 20 0 HIADHN CC(C)(C)N(Cc1cccc(F)c1)C(=O)CN1CCN(CC2CCCCC2)CC1 ZINC000064130426 851833716 /nfs/dbraw/zinc/83/37/16/851833716.db2.gz DXWZUZZHRQWFHE-UHFFFAOYSA-N 0 3 403.586 4.151 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N2C[C@@H](c3ccccc3)O[C@@H](C)C2)N2CCCC2)cc1 ZINC000064236948 851855037 /nfs/dbraw/zinc/85/50/37/851855037.db2.gz YZUQUMLSFFZHRW-OYDLWJJNSA-N 0 3 407.558 4.304 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)NCc2cc(Br)cs2)N2CCCC2)cc1 ZINC000064237232 851855094 /nfs/dbraw/zinc/85/50/94/851855094.db2.gz FFADTNNIDOGLDM-GOSISDBHSA-N 0 3 422.392 4.455 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)c1ccc2ccccc2n1 ZINC000064470575 851905536 /nfs/dbraw/zinc/90/55/36/851905536.db2.gz BDLTVWYBGYPMJM-UHFFFAOYSA-N 0 3 401.432 4.458 20 0 HIADHN COc1ccc(CN[C@@H](C)c2cccc(N3CCOC3=O)c2)cc1OCCCC#N ZINC000064614387 851940407 /nfs/dbraw/zinc/94/04/07/851940407.db2.gz ONWTULOSQGLAGE-KRWDZBQOSA-N 0 3 409.486 4.185 20 0 HIADHN CC(C)n1cnnc1SCC(=O)C(C#N)c1nc(-c2c(F)cccc2F)cs1 ZINC000064715117 851964879 /nfs/dbraw/zinc/96/48/79/851964879.db2.gz SUGOSIGLKDMIPQ-LLVKDONJSA-N 0 3 419.482 4.229 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)NCCSC(F)(F)F ZINC000064758416 851978897 /nfs/dbraw/zinc/97/88/97/851978897.db2.gz PJEIDSLSKCXGLN-UHFFFAOYSA-N 0 3 417.419 4.032 20 0 HIADHN S=C(NCCCCN1CCN(c2ccccc2)CC1)Nc1ccc2c(c1)CCC2 ZINC000064893059 852012913 /nfs/dbraw/zinc/01/29/13/852012913.db2.gz FDIWWJPVEHYLDT-UHFFFAOYSA-N 0 3 408.615 4.064 20 0 HIADHN Cc1ccccc1C(=O)NC1CCN(C(=O)CN[C@@H](c2ccccc2)C(C)(C)C)CC1 ZINC000064932923 852024153 /nfs/dbraw/zinc/02/41/53/852024153.db2.gz SFHYCFZNMRPNFM-DEOSSOPVSA-N 0 3 421.585 4.093 20 0 HIADHN Cc1cc(NC(=O)c2cc(F)c(F)cc2F)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000437124930 862313412 /nfs/dbraw/zinc/31/34/12/862313412.db2.gz JMAMVHYGPOBABA-MRXNPFEDSA-N 0 3 414.431 4.308 20 0 HIADHN CCCCNC(=O)[C@@H]1CCC[N@H+](Cc2c([O-])ccc3cc(Br)ccc32)C1 ZINC000065189170 852084543 /nfs/dbraw/zinc/08/45/43/852084543.db2.gz DCYCKYYBBXMCPR-MRXNPFEDSA-N 0 3 419.363 4.436 20 0 HIADHN CCCCNC(=O)[C@@H]1CCC[N@@H+](Cc2c([O-])ccc3cc(Br)ccc32)C1 ZINC000065189170 852084557 /nfs/dbraw/zinc/08/45/57/852084557.db2.gz DCYCKYYBBXMCPR-MRXNPFEDSA-N 0 3 419.363 4.436 20 0 HIADHN COc1cc(CNC2(c3ccccc3)CCC2)cc(I)c1OC ZINC000065275618 852096336 /nfs/dbraw/zinc/09/63/36/852096336.db2.gz MKKIGWNSCLRNIG-UHFFFAOYSA-N 0 3 423.294 4.477 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2ccc(C(=O)NC3CCCC3)cc2)N(C)C)cc1 ZINC000065413182 852123385 /nfs/dbraw/zinc/12/33/85/852123385.db2.gz ZLUSZGJHVPGIIE-JOCHJYFZSA-N 0 3 408.546 4.092 20 0 HIADHN Cc1cc(Oc2ncccn2)ccc1NC(=O)N1CCN(CC2CCCCC2)CC1 ZINC000065419578 852126712 /nfs/dbraw/zinc/12/67/12/852126712.db2.gz ZGOLRDBUMXNGEJ-UHFFFAOYSA-N 0 3 409.534 4.307 20 0 HIADHN COc1cc(NC(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)c(OC)cc1Cl ZINC000065438268 852132888 /nfs/dbraw/zinc/13/28/88/852132888.db2.gz MUGKVWAKKNODIW-HOCLYGCPSA-N 0 3 403.910 4.314 20 0 HIADHN COc1cc(OC)c(NC(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)cc1Cl ZINC000065438076 852133079 /nfs/dbraw/zinc/13/30/79/852133079.db2.gz QFSOHYYNLLIQTQ-HOCLYGCPSA-N 0 3 403.910 4.314 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)N(Cc1ccccc1)C[C@H]1CCCO1 ZINC000065475630 852148893 /nfs/dbraw/zinc/14/88/93/852148893.db2.gz ZQFXDYQAHRTXRC-RPWUZVMVSA-N 0 3 407.558 4.214 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=S)Nc1cccc(Br)c1 ZINC000065704479 852226249 /nfs/dbraw/zinc/22/62/49/852226249.db2.gz CAWYHVJHXPZPQB-UHFFFAOYSA-N 0 3 410.356 4.349 20 0 HIADHN O=C(Nc1cccc(CNC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)c1)C1CCC1 ZINC000065866144 852291857 /nfs/dbraw/zinc/29/18/57/852291857.db2.gz MFIXEHSOKCYVBA-OAQYLSRUSA-N 0 3 423.532 4.093 20 0 HIADHN COc1ccc(OCc2ccccn2)c(CNC[C@H](c2ccco2)N2CCCC2)c1 ZINC000065888370 852303533 /nfs/dbraw/zinc/30/35/33/852303533.db2.gz VFBPGTNVYTZIBK-JOCHJYFZSA-N 0 3 407.514 4.189 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)c1cc(-c2ccc(Cl)s2)on1 ZINC000065893657 852307682 /nfs/dbraw/zinc/30/76/82/852307682.db2.gz RVQLKJOWZNYBDQ-UHFFFAOYSA-N 0 3 407.898 4.400 20 0 HIADHN O=C(Nc1cccnc1)c1ccc(OC(=O)C2CCN(Cc3ccccc3)CC2)cc1 ZINC000065898896 852308673 /nfs/dbraw/zinc/30/86/73/852308673.db2.gz VNSHOBOZBMGHQL-UHFFFAOYSA-N 0 3 415.493 4.152 20 0 HIADHN CN(C)CCN(Cc1cccc(C#N)c1)C(=O)c1ccc(NC(=O)OC(C)(C)C)cc1 ZINC000065931055 852321713 /nfs/dbraw/zinc/32/17/13/852321713.db2.gz ZUHSMMSVONWMTM-UHFFFAOYSA-N 0 3 422.529 4.109 20 0 HIADHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)c1cc2ccccc2n1C ZINC000065931825 852321967 /nfs/dbraw/zinc/32/19/67/852321967.db2.gz WPLVHKLHHTZXQI-UHFFFAOYSA-N 0 3 414.347 4.145 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)c1cc(-c2ccc(Cl)s2)on1 ZINC000065931570 852322140 /nfs/dbraw/zinc/32/21/40/852322140.db2.gz DKNXSVYFUVWBJR-UHFFFAOYSA-N 0 3 407.898 4.400 20 0 HIADHN CS(=O)(=O)Nc1ccc(CNCc2ccc(Oc3cc(F)cc(F)c3)cc2)cc1 ZINC000065933916 852323140 /nfs/dbraw/zinc/32/31/40/852323140.db2.gz IKSSTMMURUUIHD-UHFFFAOYSA-N 0 3 418.465 4.418 20 0 HIADHN COc1ccc(C(=O)N(CCN(C)C)Cc2cccc(Cl)c2)cc1OC(F)F ZINC000065936678 852325215 /nfs/dbraw/zinc/32/52/15/852325215.db2.gz FMALEVMTLMGIGC-UHFFFAOYSA-N 0 3 412.864 4.154 20 0 HIADHN Cc1cc(C)n(-c2ccc(C(=O)N(CCN(C)C)Cc3cccc(Cl)c3)cc2)n1 ZINC000065937155 852325462 /nfs/dbraw/zinc/32/54/62/852325462.db2.gz VDUZSKHEWFLLJS-UHFFFAOYSA-N 0 3 410.949 4.347 20 0 HIADHN Cc1cc(Br)ccc1C(=O)N(CCN(C)C)Cc1ccc(F)c(F)c1 ZINC000065938437 852326090 /nfs/dbraw/zinc/32/60/90/852326090.db2.gz CFZJZSFBRXGYBD-UHFFFAOYSA-N 0 3 411.290 4.240 20 0 HIADHN Cc1c(C(=O)N(CCN(C)C)Cc2cccc(F)c2)cnn1-c1cccc(Cl)c1 ZINC000065939651 852327974 /nfs/dbraw/zinc/32/79/74/852327974.db2.gz LOTYFMDPFFKSEH-UHFFFAOYSA-N 0 3 414.912 4.177 20 0 HIADHN CCOc1c(Cl)cc(C(=O)N(CCN(C)C)Cc2cccc(F)c2)cc1OC ZINC000065940411 852329034 /nfs/dbraw/zinc/32/90/34/852329034.db2.gz VPJUQFJQVJRHFA-UHFFFAOYSA-N 0 3 408.901 4.090 20 0 HIADHN O=C(NCCNCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1)c1ccccc1 ZINC000065979397 852338188 /nfs/dbraw/zinc/33/81/88/852338188.db2.gz CZRJHSWETRMHJG-UHFFFAOYSA-N 0 3 414.484 4.198 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=S)Nc2ccccc2Oc2ccccc2)CC1 ZINC000066007898 852354134 /nfs/dbraw/zinc/35/41/34/852354134.db2.gz QSMDILDWOKBBPH-IBGZPJMESA-N 0 3 412.603 4.039 20 0 HIADHN Cc1nn(Cc2ccccc2Cl)c(C)c1C(=O)NC[C@H](c1ccccc1)N(C)C ZINC000069343758 852392159 /nfs/dbraw/zinc/39/21/59/852392159.db2.gz QSTRMQGPRHPACX-OAQYLSRUSA-N 0 3 410.949 4.234 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cccnc1SC(F)F)c1cccc(OC)c1 ZINC000071813912 852410204 /nfs/dbraw/zinc/41/02/04/852410204.db2.gz ZLYLAADYFDFJRD-QGZVFWFLSA-N 0 3 409.502 4.218 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cccnc1SC(F)F)c1cccc(OC)c1 ZINC000071813911 852410359 /nfs/dbraw/zinc/41/03/59/852410359.db2.gz ZLYLAADYFDFJRD-KRWDZBQOSA-N 0 3 409.502 4.218 20 0 HIADHN COc1cccc([C@@H](CNC(=O)CCOc2ccccc2Cl)N2CCCC2)c1 ZINC000071897981 852426743 /nfs/dbraw/zinc/42/67/43/852426743.db2.gz DOMYGTMHMGUUJQ-HXUWFJFHSA-N 0 3 402.922 4.071 20 0 HIADHN O=C(NCc1ccc(N2CCCCCC2)nc1)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000071913272 852429868 /nfs/dbraw/zinc/42/98/68/852429868.db2.gz LKPSRVDAWDQMPI-QHCPKHFHSA-N 0 3 421.589 4.098 20 0 HIADHN Cc1cc(C)n(-c2cccc(NC(=O)NC[C@H](c3ccccc3)N3CCCC3)c2)n1 ZINC000071919676 852431493 /nfs/dbraw/zinc/43/14/93/852431493.db2.gz RNXJXIDPQNHCSG-HSZRJFAPSA-N 0 3 403.530 4.448 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N2CCC[C@@H]2c2ccc3c(c2)OCCO3)N(C)C)cc1 ZINC000071923234 852432486 /nfs/dbraw/zinc/43/24/86/852432486.db2.gz AJJRWUMASWKZDC-YADHBBJMSA-N 0 3 423.557 4.170 20 0 HIADHN COc1ccc([C@@H](CNC(=O)[C@H]2CCCN2Cc2ccccc2)N2CCCCC2)cc1 ZINC000072015394 852466452 /nfs/dbraw/zinc/46/64/52/852466452.db2.gz IZOSNSQLILUUIK-JWQCQUIFSA-N 0 3 421.585 4.003 20 0 HIADHN CCCCNC(=O)[C@@H]1CC[C@H](C)N(CC(=O)N[C@@H](C)c2cccc3ccccc32)C1 ZINC000072031907 852474268 /nfs/dbraw/zinc/47/42/68/852474268.db2.gz XDPBRCHUJHXAAP-IRFCIJBXSA-N 0 3 409.574 4.034 20 0 HIADHN O=C(NCCCNc1ccccc1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000078779770 852530223 /nfs/dbraw/zinc/53/02/23/852530223.db2.gz RDMZMOXQWFNCNP-OAQYLSRUSA-N 0 3 405.464 4.059 20 0 HIADHN CCN1CCCC[C@H]1CNC(=O)c1cccc(NC(=O)CCCc2cccs2)c1 ZINC000078917201 852534522 /nfs/dbraw/zinc/53/45/22/852534522.db2.gz VGJJAVRCQCYTGK-FQEVSTJZSA-N 0 3 413.587 4.314 20 0 HIADHN Cc1ccc(C[C@H]2CCCN2CC(=O)N2CCC[C@@H]2c2ccc3c(c2)OCCO3)cc1 ZINC000079097474 852539524 /nfs/dbraw/zinc/53/95/24/852539524.db2.gz VCINOUOQNNORTH-DHIUTWEWSA-N 0 3 420.553 4.137 20 0 HIADHN Cc1cc(C(=O)NC[C@@H](c2cccs2)N2CCCC2)c(C)n1Cc1ccccn1 ZINC000097285727 852596384 /nfs/dbraw/zinc/59/63/84/852596384.db2.gz UNXKJIPXKHRWIE-NRFANRHFSA-N 0 3 408.571 4.177 20 0 HIADHN Cc1nn(Cc2ccc(F)cc2)c(Cl)c1CNCCCCNc1ccccn1 ZINC000097593092 852640245 /nfs/dbraw/zinc/64/02/45/852640245.db2.gz UJWAMCBMUDEGCG-UHFFFAOYSA-N 0 3 401.917 4.409 20 0 HIADHN C[C@@H]1CCCN(Cc2csc(NC(=O)N(CCN(C)C)Cc3cccs3)n2)C1 ZINC000437202778 862392998 /nfs/dbraw/zinc/39/29/98/862392998.db2.gz XRTICOPUIXFMMU-MRXNPFEDSA-N 0 3 421.636 4.032 20 0 HIADHN COc1cccc(CN2CCC(Nc3nc4cc(C)nn4c4ccccc43)CC2)c1 ZINC000108092955 852821939 /nfs/dbraw/zinc/82/19/39/852821939.db2.gz ALZDUFOYRXTAHD-UHFFFAOYSA-N 0 3 401.514 4.276 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)NCCc1ccc(C(F)(F)F)cc1 ZINC000108409335 852847791 /nfs/dbraw/zinc/84/77/91/852847791.db2.gz GBYYOECDSBQWTO-UHFFFAOYSA-N 0 3 411.443 4.160 20 0 HIADHN COc1cccc(CN2CCC(NC(=O)c3cc(Cl)nc4ccccc43)CC2)c1 ZINC000108532457 852856759 /nfs/dbraw/zinc/85/67/59/852856759.db2.gz OZEMIJPANGLXQO-UHFFFAOYSA-N 0 3 409.917 4.291 20 0 HIADHN COc1cccc(CN2CCC(NC(=O)[C@@H](C)Oc3cc(C)ccc3Cl)CC2)c1 ZINC000108536103 852858039 /nfs/dbraw/zinc/85/80/39/852858039.db2.gz BPLXFKRTTKCQPX-QGZVFWFLSA-N 0 3 416.949 4.205 20 0 HIADHN Cc1c(C(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)cnn1-c1cccc(Cl)c1 ZINC000108819348 852882068 /nfs/dbraw/zinc/88/20/68/852882068.db2.gz JVFRJFYBDVJGPA-JXFKEZNVSA-N 0 3 408.933 4.399 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)c(C)c1CC(=O)NC[C@@H](c1ccc(C)cc1)N(C)C ZINC000109289620 852947590 /nfs/dbraw/zinc/94/75/90/852947590.db2.gz OYCBQXJJZCDDNJ-QHCPKHFHSA-N 0 3 424.976 4.413 20 0 HIADHN CC(C)[C@H](NCC(=O)NC1CCC2(CC1)OCCO2)c1ccc(C(C)(C)C)cc1 ZINC000109316035 852951227 /nfs/dbraw/zinc/95/12/27/852951227.db2.gz PEUDRUDTPYKHNO-QFIPXVFZSA-N 0 3 402.579 4.073 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)c1ccc2ccccc2n1 ZINC000109358154 852958129 /nfs/dbraw/zinc/95/81/29/852958129.db2.gz MVXNGUJNMCRQJU-UHFFFAOYSA-N 0 3 401.432 4.458 20 0 HIADHN C[C@H]1C[C@H]1C(=O)Nc1cccc(C(=O)Nc2ccc(CCN3CCSCC3)cc2)c1 ZINC000109484519 852976122 /nfs/dbraw/zinc/97/61/22/852976122.db2.gz WGWVETSMGNJVMU-HTAPYJJXSA-N 0 3 423.582 4.125 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)c1ccc(Br)cc1 ZINC000109499543 852978118 /nfs/dbraw/zinc/97/81/18/852978118.db2.gz DVPOXIQNPUNXHQ-UHFFFAOYSA-N 0 3 405.361 4.293 20 0 HIADHN CCC[C@H](C(=O)N1CCC[C@H](CN2CCN(c3ccccn3)CC2)C1)c1ccccc1 ZINC000109649666 852994735 /nfs/dbraw/zinc/99/47/35/852994735.db2.gz ZXIFTAKHJLOXFW-VWNXMTODSA-N 0 3 420.601 4.026 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)[C@@H]1C[C@@H]1c1ccc(Br)cc1 ZINC000109770644 853011464 /nfs/dbraw/zinc/01/14/64/853011464.db2.gz IGVKFHUJLPXETN-WOJBJXKFSA-N 0 3 419.338 4.282 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N3CCC[C@H]3CCc3ccccc3)cc2)CC1 ZINC000109900210 853031721 /nfs/dbraw/zinc/03/17/21/853031721.db2.gz CUZAWEHGQJGLTH-VWLOTQADSA-N 0 3 405.586 4.454 20 0 HIADHN Cc1c(C(=O)Nc2ccccc2CN2CCC[C@@H](C(N)=O)C2)oc2c1c(C)ccc2C ZINC000109940403 853037454 /nfs/dbraw/zinc/03/74/54/853037454.db2.gz RFLWFQGGKDDCCA-LJQANCHMSA-N 0 3 419.525 4.308 20 0 HIADHN O=C(CN1CCC(c2ccccc2)CC1)Nc1cccc(CN2CCSCC2)c1 ZINC000110178487 853068429 /nfs/dbraw/zinc/06/84/29/853068429.db2.gz CLVQUESWNFYZNB-UHFFFAOYSA-N 0 3 409.599 4.054 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)C3(c4cccc(Cl)c4)CCCC3)CC2)C[C@H](C)O1 ZINC000110407294 853096819 /nfs/dbraw/zinc/09/68/19/853096819.db2.gz CZPSETZMQSDTKM-OALUTQOASA-N 0 3 419.009 4.500 20 0 HIADHN Cc1ccc(SCCC(=O)N2CCC(CN3C[C@H](C)O[C@@H](C)C3)CC2)cc1C ZINC000110452077 853101348 /nfs/dbraw/zinc/10/13/48/853101348.db2.gz ASCVLOXBZDLGCT-PMACEKPBSA-N 0 3 404.620 4.133 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)c3cccc(Oc4ccccc4)c3)CC2)C[C@H](C)O1 ZINC000110454277 853102196 /nfs/dbraw/zinc/10/21/96/853102196.db2.gz XNYMPPFYMCNZIR-PMACEKPBSA-N 0 3 408.542 4.440 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)c3ccc(COc4ccccc4)cc3)CC2)C[C@@H](C)O1 ZINC000110454986 853102446 /nfs/dbraw/zinc/10/24/46/853102446.db2.gz WUVLAOHNNLQXID-NHCUHLMSSA-N 0 3 422.569 4.227 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)C3(c4ccc(Cl)cc4)CCCC3)CC2)C[C@@H](C)O1 ZINC000110458207 853102479 /nfs/dbraw/zinc/10/24/79/853102479.db2.gz ZSWFFVCDWSOWCD-RTBURBONSA-N 0 3 419.009 4.500 20 0 HIADHN O=C(NCCCc1nc(-c2ccncc2)cs1)c1cccc(CN2CCCC2)c1 ZINC000110958574 853174478 /nfs/dbraw/zinc/17/44/78/853174478.db2.gz ZMFBOGMOIGSEQF-UHFFFAOYSA-N 0 3 406.555 4.164 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)c3ccc(Cl)c(C(F)(F)F)c3)CC2)C[C@@H](C)O1 ZINC000437233313 862438823 /nfs/dbraw/zinc/43/88/23/862438823.db2.gz FSZHRVIBAWIWFT-ZIAGYGMSSA-N 0 3 418.887 4.320 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)c1ccc2[nH]c(C(F)F)nc2c1 ZINC000111138150 853207757 /nfs/dbraw/zinc/20/77/57/853207757.db2.gz OPNQTZDKXGBFMF-UHFFFAOYSA-N 0 3 416.497 4.344 20 0 HIADHN C[C@H](NC(=O)[C@H]1CCCN(Cc2cccnc2)C1)c1ccc(OC(F)(F)F)cc1 ZINC000115841110 853267993 /nfs/dbraw/zinc/26/79/93/853267993.db2.gz LZPJROXGIKFRGW-YJBOKZPZSA-N 0 3 407.436 4.070 20 0 HIADHN C[C@H](NC(=O)[C@@H]1CCCN(Cc2cccnc2)C1)c1ccc(OC(F)(F)F)cc1 ZINC000115841105 853268392 /nfs/dbraw/zinc/26/83/92/853268392.db2.gz LZPJROXGIKFRGW-MAUKXSAKSA-N 0 3 407.436 4.070 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)[C@@H]1Cc2ccccc2S1 ZINC000115926593 853273202 /nfs/dbraw/zinc/27/32/02/853273202.db2.gz UZVYVEHGRSQKCA-IBGZPJMESA-N 0 3 408.489 4.313 20 0 HIADHN Cc1noc2nc(C)cc(C(=O)N(CCN(C)C)Cc3ccc(C(F)(F)F)cc3)c12 ZINC000115926562 853273571 /nfs/dbraw/zinc/27/35/71/853273571.db2.gz BIDFIESBDDHRPW-UHFFFAOYSA-N 0 3 420.435 4.062 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)[C@H]1Cc2ccccc2S1 ZINC000115926596 853273720 /nfs/dbraw/zinc/27/37/20/853273720.db2.gz UZVYVEHGRSQKCA-LJQANCHMSA-N 0 3 408.489 4.313 20 0 HIADHN Cc1cc(C(=O)N(CCN(C)C)c2ccccc2)c2cnn(Cc3cccs3)c2n1 ZINC000116141037 853285420 /nfs/dbraw/zinc/28/54/20/853285420.db2.gz ZVVYVNIALGFYEC-UHFFFAOYSA-N 0 3 419.554 4.058 20 0 HIADHN CCc1c(C(=O)Nc2ccc(CCN3CCSCC3)cc2)cnn1C(C)(C)C ZINC000138674347 853394286 /nfs/dbraw/zinc/39/42/86/853394286.db2.gz CUJXZXQKPWFGGA-UHFFFAOYSA-N 0 3 400.592 4.044 20 0 HIADHN Cc1onc(-c2ccccc2)c1C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000138711067 853395392 /nfs/dbraw/zinc/39/53/92/853395392.db2.gz WEGCMEZMFDHCEF-UHFFFAOYSA-N 0 3 407.539 4.494 20 0 HIADHN C[C@@H](NC(=O)c1cccc(CN2CCCC2)c1)c1ccc(NC(=O)NC2CC2)cc1 ZINC000139276588 853407437 /nfs/dbraw/zinc/40/74/37/853407437.db2.gz PPJBXNZBDXELCZ-QGZVFWFLSA-N 0 3 406.530 4.057 20 0 HIADHN COCCOCc1cccc(NC(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)c1 ZINC000139541342 853413410 /nfs/dbraw/zinc/41/34/10/853413410.db2.gz GZHQULBZYCTWOG-HSZRJFAPSA-N 0 3 411.546 4.117 20 0 HIADHN Cc1nc(-c2cccc(NC(=O)NC[C@H](c3ccc(C)cc3)N3CCCC3)c2)no1 ZINC000139746748 853420169 /nfs/dbraw/zinc/42/01/69/853420169.db2.gz QMDMWTHMEIJBAQ-OAQYLSRUSA-N 0 3 405.502 4.312 20 0 HIADHN O[C@@H](Cn1c2ccccc2c2ccccc21)CN1CCN(CCc2cccs2)CC1 ZINC000141386015 853470228 /nfs/dbraw/zinc/47/02/28/853470228.db2.gz OIFDPPPJEGDQFE-HXUWFJFHSA-N 0 3 419.594 4.077 20 0 HIADHN COCCN1CCC(NC(=O)c2ccccc2-c2ncc(-c3ccc(C)cc3)o2)CC1 ZINC000142469617 853495117 /nfs/dbraw/zinc/49/51/17/853495117.db2.gz FRTPBFMOLIPDCM-UHFFFAOYSA-N 0 3 419.525 4.158 20 0 HIADHN C[C@H](NCc1ccc(OCc2ccncc2)cc1)c1ccc(N2CCOC2=O)cc1 ZINC000142724313 853498940 /nfs/dbraw/zinc/49/89/40/853498940.db2.gz KTDSLHCJBMIPML-SFHVURJKSA-N 0 3 403.482 4.468 20 0 HIADHN CSc1cc(C(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)ccc1NC(C)=O ZINC000143059964 853507638 /nfs/dbraw/zinc/50/76/38/853507638.db2.gz OXEXITAEEAXDKC-OAQYLSRUSA-N 0 3 411.571 4.242 20 0 HIADHN Cc1nn(C(F)F)c(C)c1CC(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1 ZINC000143805560 853521821 /nfs/dbraw/zinc/52/18/21/853521821.db2.gz PGWDKHORIBHFPY-KRWDZBQOSA-N 0 3 410.534 4.088 20 0 HIADHN COc1ccc(CCCC(=O)C(C#N)C(=O)Nc2cc(C)c(Cl)cc2OC)cc1 ZINC000147084028 853581961 /nfs/dbraw/zinc/58/19/61/853581961.db2.gz KDPMLLMOTIZWCE-QGZVFWFLSA-N 0 3 414.889 4.336 20 0 HIADHN COc1ccc(CCCC(=O)C(C#N)C(=O)Nc2ccc(OC)c(Cl)c2)cc1 ZINC000147139975 853582636 /nfs/dbraw/zinc/58/26/36/853582636.db2.gz USRNAMPZIWOOPN-KRWDZBQOSA-N 0 3 400.862 4.027 20 0 HIADHN N#Cc1ccc(F)c(COC(=O)C2CCN(c3cc(Cl)ccc3Cl)C2=O)c1 ZINC000149181360 853620381 /nfs/dbraw/zinc/62/03/81/853620381.db2.gz VFHJVQJCJYDYLV-CQSZACIVSA-N 0 3 407.228 4.100 20 0 HIADHN CCCCc1ccc(NC(=O)C(C#N)C(=O)c2ccn(-c3ccc(OC)cc3)n2)cc1 ZINC000150211181 853640463 /nfs/dbraw/zinc/64/04/63/853640463.db2.gz QCTJKSDRQLFNBU-OAQYLSRUSA-N 0 3 416.481 4.185 20 0 HIADHN O[C@@H](COc1ccccc1)CN1CCC(O)(c2ccc(-c3ccccc3)cc2)CC1 ZINC000164347277 853645827 /nfs/dbraw/zinc/64/58/27/853645827.db2.gz QXZLZACBEVKVOH-XMMPIXPASA-N 0 3 403.522 4.077 20 0 HIADHN C[C@H]1CN(C(=O)c2ccc(CNCc3ccccc3C(F)(F)F)cc2)C[C@H](C)O1 ZINC000165979503 853654275 /nfs/dbraw/zinc/65/42/75/853654275.db2.gz WKLAFDUSXUYZHL-HOTGVXAUSA-N 0 3 406.448 4.245 20 0 HIADHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)c1ccc2ncsc2c1 ZINC000195638613 853730768 /nfs/dbraw/zinc/73/07/68/853730768.db2.gz DIQBJLJPSMPGGL-UHFFFAOYSA-N 0 3 418.360 4.263 20 0 HIADHN CCc1ccc2c(CN3CCC(C(=O)N4CCc5ccccc54)CC3)cc(=O)oc2c1 ZINC000195685607 853757816 /nfs/dbraw/zinc/75/78/16/853757816.db2.gz XXILSVPCCANKMX-UHFFFAOYSA-N 0 3 416.521 4.157 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)c1ccc(N(C)c2ccccc2)nc1 ZINC000195724864 853779412 /nfs/dbraw/zinc/77/94/12/853779412.db2.gz CIJOMYSQECYBSX-UHFFFAOYSA-N 0 3 406.505 4.193 20 0 HIADHN Cc1noc2nc(C(C)C)cc(C(=O)N(CCN(C)C)Cc3ccc(F)c(F)c3)c12 ZINC000195724818 853779606 /nfs/dbraw/zinc/77/96/06/853779606.db2.gz RARUVYSETHECGR-UHFFFAOYSA-N 0 3 416.472 4.137 20 0 HIADHN CC(C)n1ncc2ccc(NC(=O)c3ccc(N4CCN(C(C)C)CC4)cc3)cc21 ZINC000195743366 853790317 /nfs/dbraw/zinc/79/03/17/853790317.db2.gz DYHHTTHMSBZJKA-UHFFFAOYSA-N 0 3 405.546 4.400 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)[C@H]2C[C@H]2c2ccc(Br)cc2)CC1 ZINC000216497240 853854460 /nfs/dbraw/zinc/85/44/60/853854460.db2.gz RNJGOSRPWVNDFG-PMACEKPBSA-N 0 3 417.347 4.269 20 0 HIADHN CC(C)(C)c1nn(-c2ccccc2)cc1CNCc1ccc(CN2CCOCC2)cc1 ZINC000236655410 853908277 /nfs/dbraw/zinc/90/82/77/853908277.db2.gz CUHVDRLFVPIJDN-UHFFFAOYSA-N 0 3 418.585 4.292 20 0 HIADHN Brc1cccc(-c2c[nH]c(CNC[C@@H]3CCN(c4ccccc4)C3)n2)c1 ZINC000236662222 853908324 /nfs/dbraw/zinc/90/83/24/853908324.db2.gz GRUJCTISAUJBJU-INIZCTEOSA-N 0 3 411.347 4.455 20 0 HIADHN CC(C)(C)[S@](=O)CCNCc1ccc(OC(F)(F)[C@H](F)C(F)(F)F)cc1 ZINC000236739304 853918255 /nfs/dbraw/zinc/91/82/55/853918255.db2.gz CWQDDWCEJRNAGZ-ZBSNKRKSSA-N 0 3 405.404 4.195 20 0 HIADHN CC(=O)N(c1nc(CNCCCCn2ccnc2C)cs1)c1ccc(F)cc1 ZINC000236786825 853923693 /nfs/dbraw/zinc/92/36/93/853923693.db2.gz NXOUXZULJMXDCY-UHFFFAOYSA-N 0 3 401.511 4.042 20 0 HIADHN CC(C)n1ncc2cc(CNCCCC(=O)N3CCc4ccccc43)c(Cl)nc21 ZINC000236837855 853928074 /nfs/dbraw/zinc/92/80/74/853928074.db2.gz IPJNPHRTAXOVAE-UHFFFAOYSA-N 0 3 411.937 4.125 20 0 HIADHN CC[C@H](C#N)Oc1cccc(C[NH2+]Cc2cc(Br)cc(OC)c2[O-])c1 ZINC000236894474 853933065 /nfs/dbraw/zinc/93/30/65/853933065.db2.gz UAFBYIXYBRIYLB-MRXNPFEDSA-N 0 3 405.292 4.134 20 0 HIADHN CCC[C@@H](NCc1ccc(NC(C)=O)cc1)C(=O)Nc1cccc(N2CCCC2)c1 ZINC000236914797 853937429 /nfs/dbraw/zinc/93/74/29/853937429.db2.gz OXOBDNLRIUOUAR-HSZRJFAPSA-N 0 3 408.546 4.142 20 0 HIADHN CCC(CC)C(=O)N1CCC(NCc2csc(-c3ccc4c(c3)OCO4)n2)CC1 ZINC000236937811 853940229 /nfs/dbraw/zinc/94/02/29/853940229.db2.gz ZBMSYPSUVHHVJE-UHFFFAOYSA-N 0 3 415.559 4.056 20 0 HIADHN CCc1nn(C)c(Cl)c1CNC[C@@H]1CCN(c2cccc(Br)c2)C1 ZINC000237062096 853958989 /nfs/dbraw/zinc/95/89/89/853958989.db2.gz KPHFABVPVCXFCE-ZDUSSCGKSA-N 0 3 411.775 4.015 20 0 HIADHN COc1ccccc1-c1ccc(CNCc2ccc(N3CCO[C@@H](C)C3)nc2)cc1 ZINC000237097513 853963801 /nfs/dbraw/zinc/96/38/01/853963801.db2.gz TVGDJOAWGKUXAV-IBGZPJMESA-N 0 3 403.526 4.272 20 0 HIADHN COc1cc(Br)cc(C[NH2+]C[C@H](O)c2cccc(C(F)(F)F)c2)c1[O-] ZINC000237213527 853984787 /nfs/dbraw/zinc/98/47/87/853984787.db2.gz GSTQDBLTDUCHKS-AWEZNQCLSA-N 0 3 420.225 4.005 20 0 HIADHN COc1cc(CNCc2ccccc2CN2C[C@@H](C)O[C@@H](C)C2)cc(Cl)c1OC ZINC000237216309 853984841 /nfs/dbraw/zinc/98/48/41/853984841.db2.gz UJTRPGZTZIOKIN-CALCHBBNSA-N 0 3 418.965 4.256 20 0 HIADHN COc1ccc([C@@H](Cc2ccccc2C)NCc2cccc(C(N)=O)c2)cc1OC ZINC000237251778 853990932 /nfs/dbraw/zinc/99/09/32/853990932.db2.gz RHGPNQIHFRGLKK-JOCHJYFZSA-N 0 3 404.510 4.185 20 0 HIADHN COc1cc(CNCc2ccc(N3CCCC3=O)cc2)ccc1OCC(F)(F)F ZINC000237250094 853991262 /nfs/dbraw/zinc/99/12/62/853991262.db2.gz ZXVMLMPHYIRAMH-UHFFFAOYSA-N 0 3 408.420 4.053 20 0 HIADHN COc1cc(CNCc2ccc(NC(=O)c3ccc(F)cc3)cc2)cc(OC)c1OC ZINC000237254893 853992070 /nfs/dbraw/zinc/99/20/70/853992070.db2.gz NTOAPWNPPLNXKK-UHFFFAOYSA-N 0 3 424.472 4.394 20 0 HIADHN COc1cc(CNC[C@H](O)c2ccccc2F)cc(OC)c1OCc1ccccc1 ZINC000237274602 853994946 /nfs/dbraw/zinc/99/49/46/853994946.db2.gz FTKMESYBUNQMHB-NRFANRHFSA-N 0 3 411.473 4.245 20 0 HIADHN COc1cc(C[NH2+]C[C@H](O)c2cccc(C(F)(F)F)c2)cc(Br)c1[O-] ZINC000237273462 853995177 /nfs/dbraw/zinc/99/51/77/853995177.db2.gz VKUNMBIPULOXGK-AWEZNQCLSA-N 0 3 420.225 4.005 20 0 HIADHN COc1ccc([C@@H](O)CNCc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)cc1 ZINC000237284643 853997278 /nfs/dbraw/zinc/99/72/78/853997278.db2.gz FJURQTDJQHIFIU-IBGZPJMESA-N 0 3 402.834 4.340 20 0 HIADHN COc1ccc(CN[C@@H](C)c2ccc(OCc3ccncc3)c(OC)c2)cc1C#N ZINC000237290333 853999566 /nfs/dbraw/zinc/99/95/66/853999566.db2.gz KGXIHNQIOFWPQL-KRWDZBQOSA-N 0 3 403.482 4.400 20 0 HIADHN COc1cc(CNCc2ccnc(-n3ccnc3)c2)ccc1OCc1ccc(F)cc1 ZINC000237291092 853999752 /nfs/dbraw/zinc/99/97/52/853999752.db2.gz IQZOSEFSRJDYEH-UHFFFAOYSA-N 0 3 418.472 4.284 20 0 HIADHN COc1cc(CNCc2cnc3c(c2)c(C)nn3C)ccc1OCc1ccccc1 ZINC000237296746 854000296 /nfs/dbraw/zinc/00/02/96/854000296.db2.gz PBBMTJWQZHTIEC-UHFFFAOYSA-N 0 3 402.498 4.154 20 0 HIADHN COc1cccc([C@H](O)CNCc2cccc(NC(=O)c3ccccc3Cl)c2)c1 ZINC000237325304 854006860 /nfs/dbraw/zinc/00/68/60/854006860.db2.gz JMYPVPDCRFKDKO-JOCHJYFZSA-N 0 3 410.901 4.424 20 0 HIADHN COc1ccc([C@@H](CNCc2ccc(-c3ccccc3)o2)N2CCOCC2)cc1OC ZINC000237326238 854006933 /nfs/dbraw/zinc/00/69/33/854006933.db2.gz UAHZLQJOXQWTOR-JOCHJYFZSA-N 0 3 422.525 4.127 20 0 HIADHN COc1ccc([C@H](Cc2ccccc2C)NCc2cccc(C(N)=O)c2)cc1OC ZINC000237348150 854010606 /nfs/dbraw/zinc/01/06/06/854010606.db2.gz RHGPNQIHFRGLKK-QFIPXVFZSA-N 0 3 404.510 4.185 20 0 HIADHN COc1ccc([C@H](CNCc2ccc(-c3ccccc3)o2)N2CCOCC2)cc1OC ZINC000237356299 854012399 /nfs/dbraw/zinc/01/23/99/854012399.db2.gz UAHZLQJOXQWTOR-QFIPXVFZSA-N 0 3 422.525 4.127 20 0 HIADHN CS(=O)(=O)Cc1ccc(CNCC2=Cc3cc(Cl)cc(Cl)c3OC2)cc1 ZINC000237354797 854012723 /nfs/dbraw/zinc/01/27/23/854012723.db2.gz QSMSWSRNGKJQKB-UHFFFAOYSA-N 0 3 412.338 4.104 20 0 HIADHN COc1cc(CNCc2c[nH]nc2-c2ccccc2)cc(Br)c1OC ZINC000237469800 854038922 /nfs/dbraw/zinc/03/89/22/854038922.db2.gz SZYBMILVTZTUKK-UHFFFAOYSA-N 0 3 402.292 4.146 20 0 HIADHN COc1cc(CNCc2c[nH]nc2-c2ccc(F)cc2)cc(Br)c1OC ZINC000237469342 854038981 /nfs/dbraw/zinc/03/89/81/854038981.db2.gz XSHITOLBLYMDRZ-UHFFFAOYSA-N 0 3 420.282 4.285 20 0 HIADHN Cc1nn(Cc2ccc(Cl)cc2Cl)c(Cl)c1CNC[C@@]1(O)CCSC1 ZINC000237601587 854060735 /nfs/dbraw/zinc/06/07/35/854060735.db2.gz QPCNQRVBRBPAQH-KRWDZBQOSA-N 0 3 420.793 4.158 20 0 HIADHN Cc1ccc(C(=O)Nc2cccc(CN[C@H]3CCN(C(=O)OC(C)(C)C)C3)c2)cc1 ZINC000237651077 854067819 /nfs/dbraw/zinc/06/78/19/854067819.db2.gz HTWPLLUHWHHXSV-NRFANRHFSA-N 0 3 409.530 4.346 20 0 HIADHN Cc1nc(COc2ccc(CNCc3cccc(CN4CCOCC4)c3)cc2)cs1 ZINC000237665921 854072262 /nfs/dbraw/zinc/07/22/62/854072262.db2.gz UUDZGIHAGGHFBZ-UHFFFAOYSA-N 0 3 423.582 4.153 20 0 HIADHN Cc1ccoc1C(=O)NCCCNCc1c(C)nn(-c2cc(C)ccc2C)c1Cl ZINC000237685298 854075386 /nfs/dbraw/zinc/07/53/86/854075386.db2.gz SPOXKELYRNUYOI-UHFFFAOYSA-N 0 3 414.937 4.262 20 0 HIADHN Cc1ccc(-c2n[nH]cc2C[NH2+][C@H]2CCCN(Cc3cc(Cl)ccc3[O-])C2)o1 ZINC000237682509 854075433 /nfs/dbraw/zinc/07/54/33/854075433.db2.gz GPJQSKRKKUPCHY-SFHVURJKSA-N 0 3 400.910 4.091 20 0 HIADHN Cc1nn(Cc2ccccc2Cl)c(Cl)c1CNCCCOC[C@H]1CCOC1 ZINC000237689940 854076391 /nfs/dbraw/zinc/07/63/91/854076391.db2.gz JEXZGOZFHLHMHF-MRXNPFEDSA-N 0 3 412.361 4.079 20 0 HIADHN Cc1nn(-c2ccc(Br)cc2)c(C)c1CNC[C@@H](O)c1ccc(F)cc1 ZINC000237700265 854078838 /nfs/dbraw/zinc/07/88/38/854078838.db2.gz WPIMYTQYBKFVHB-HXUWFJFHSA-N 0 3 418.310 4.214 20 0 HIADHN Clc1ccc(OC[C@H]2CCCO2)c(CNCCc2csc(N3CCCC3)n2)c1 ZINC000237715586 854081668 /nfs/dbraw/zinc/08/16/68/854081668.db2.gz KCHSRSJZSMLXPN-LJQANCHMSA-N 0 3 421.994 4.287 20 0 HIADHN Cc1nn(C)c(OCC(F)(F)F)c1CNCCCO[C@H]1CCCc2ccccc21 ZINC000237753410 854088707 /nfs/dbraw/zinc/08/87/07/854088707.db2.gz FDJDSNQKLXQGDU-IBGZPJMESA-N 0 3 411.468 4.244 20 0 HIADHN Cc1cc(CNCc2ccc(NC(=O)c3ccc(F)cc3)cc2)ccc1-n1cncn1 ZINC000237750444 854088910 /nfs/dbraw/zinc/08/89/10/854088910.db2.gz FHFQPKYWOFFIHF-UHFFFAOYSA-N 0 3 415.472 4.257 20 0 HIADHN Cc1nn(Cc2ccccc2Cl)c(C)c1CNC[C@H](O)COc1cccc(C)c1 ZINC000237771562 854093743 /nfs/dbraw/zinc/09/37/43/854093743.db2.gz JQLONWMILPDCTD-FQEVSTJZSA-N 0 3 413.949 4.040 20 0 HIADHN Cc1ccc(Br)cc1NC(=O)CCNCc1cnn(-c2ccccc2)c1 ZINC000237791003 854098240 /nfs/dbraw/zinc/09/82/40/854098240.db2.gz ZDGWUFRMQNNVNH-UHFFFAOYSA-N 0 3 413.319 4.062 20 0 HIADHN Cn1cc(N2CC[C@H](NCc3ccc(-c4ccc(C(F)(F)F)cc4)s3)C2=O)cn1 ZINC000237796925 854099172 /nfs/dbraw/zinc/09/91/72/854099172.db2.gz SEOVQOPEESBWQL-KRWDZBQOSA-N 0 3 420.460 4.063 20 0 HIADHN Cc1nn(Cc2ccc(Cl)cc2)c(C)c1CNC[C@](C)(O)c1ccc(F)cc1F ZINC000237883715 854114860 /nfs/dbraw/zinc/11/48/60/854114860.db2.gz ONTUCBQGNINHGR-QFIPXVFZSA-N 0 3 419.903 4.477 20 0 HIADHN FC(F)(F)c1ccc(-c2nc(CNCCCOC[C@@H]3CCOC3)cs2)cc1 ZINC000237909217 854118088 /nfs/dbraw/zinc/11/80/88/854118088.db2.gz UCGSQAKSDNDERQ-AWEZNQCLSA-N 0 3 400.466 4.362 20 0 HIADHN COc1ccc(CNC(=O)[C@@H](C)N[C@@H](Cc2ccccc2)c2ccccc2)cc1OC ZINC000248237742 854187049 /nfs/dbraw/zinc/18/70/49/854187049.db2.gz FJZGRDMRXZSKMB-XXBNENTESA-N 0 3 418.537 4.282 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@@H](c1ccc(F)cc1)[C@H]1CCCO1)c1ccsc1 ZINC000250046363 854192563 /nfs/dbraw/zinc/19/25/63/854192563.db2.gz VXHOKXOPYOHGDG-NJYVYQBISA-N 0 3 419.566 4.490 20 0 HIADHN O[C@@H](COc1cccc2ccccc21)CN1CCC[C@H]1c1ccc2c(c1)OCCO2 ZINC000250507118 854194712 /nfs/dbraw/zinc/19/47/12/854194712.db2.gz MATOZGQGACRICZ-IRLDBZIGSA-N 0 3 405.494 4.188 20 0 HIADHN C[C@H](OC[C@@H](O)CN1CCC[C@H]1c1ccc2c(c1)OCCO2)c1ccc(Cl)cc1 ZINC000253619513 854209329 /nfs/dbraw/zinc/20/93/29/854209329.db2.gz DBMRNOUGBYIQNM-NDXORKPFSA-N 0 3 417.933 4.387 20 0 HIADHN O=C(NC[C@@H]1CCCO[C@@H]1c1ccccc1)N[C@H](CN1CCCC1)c1ccccc1 ZINC000255959289 854230736 /nfs/dbraw/zinc/23/07/36/854230736.db2.gz MVSXEFGARZTYNS-RBZQAINGSA-N 0 3 407.558 4.291 20 0 HIADHN CN(Cc1ccccc1)C[C@@H](O)CSc1nnc(-c2ccccc2F)n1C1CC1 ZINC000261395395 854246173 /nfs/dbraw/zinc/24/61/73/854246173.db2.gz BCUQDGAMVVCMAM-GOSISDBHSA-N 0 3 412.534 4.004 20 0 HIADHN O=C([C@H]1CCCN(Cc2cccc(F)c2)C1)N1CCC([C@H](O)c2ccccc2)CC1 ZINC000261415086 854254477 /nfs/dbraw/zinc/25/44/77/854254477.db2.gz FLUGMDREROURIS-LADGPHEKSA-N 0 3 410.533 4.010 20 0 HIADHN CCN(C(=O)CNC1(c2ccc(F)cc2)CCOCC1)[C@H](C)c1ccc(F)cc1 ZINC000261421190 854255936 /nfs/dbraw/zinc/25/59/36/854255936.db2.gz DRLAATUEUYAHSS-QGZVFWFLSA-N 0 3 402.485 4.170 20 0 HIADHN Cc1ccc([C@H](CNc2ccc3nnc(-c4ccccc4F)n3n2)N2CCCC2)o1 ZINC000301162764 854316430 /nfs/dbraw/zinc/31/64/30/854316430.db2.gz UMGJANBOASXJHG-SFHVURJKSA-N 0 3 406.465 4.081 20 0 HIADHN CN(c1nc2cc(C(F)(F)F)ccc2s1)C1CCN(CCn2cccn2)CC1 ZINC000301411142 854386668 /nfs/dbraw/zinc/38/66/68/854386668.db2.gz PGBGGVXDGOYJMS-UHFFFAOYSA-N 0 3 409.481 4.112 20 0 HIADHN Cc1nc(-c2ccc(NC[C@H]3CCC[N@@H+](C)[C@H]3c3cccs3)nc2)[n-]c(=O)c1C ZINC000301448296 854397225 /nfs/dbraw/zinc/39/72/25/854397225.db2.gz WHCPVCIDWWKYIK-OXQOHEQNSA-N 0 3 409.559 4.418 20 0 HIADHN Cc1nc(-c2ccc(NC[C@H]3CCC[N@H+](C)[C@H]3c3cccs3)nc2)[n-]c(=O)c1C ZINC000301448296 854397229 /nfs/dbraw/zinc/39/72/29/854397229.db2.gz WHCPVCIDWWKYIK-OXQOHEQNSA-N 0 3 409.559 4.418 20 0 HIADHN Clc1ccc(-c2cc3ncnc(N4CCN(C[C@@H]5CCOC5)CC4)c3s2)cc1 ZINC000301519172 854411408 /nfs/dbraw/zinc/41/14/08/854411408.db2.gz CPQCOWFWHKVPAC-HNNXBMFYSA-N 0 3 414.962 4.170 20 0 HIADHN Cc1cc(C)c(NC(=O)CNC(=O)CN[C@@H](C)c2cccc3ccccc32)c(C)c1 ZINC000301578933 854423598 /nfs/dbraw/zinc/42/35/98/854423598.db2.gz GMDDTZXAGIHRSC-IBGZPJMESA-N 0 3 403.526 4.171 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(Nc2nc(-c3ccccn3)nc3c2CCC3)CC1 ZINC000301792993 854466792 /nfs/dbraw/zinc/46/67/92/854466792.db2.gz OZAOEZKQPGIHTH-KRWDZBQOSA-N 0 3 400.530 4.060 20 0 HIADHN FC(F)(F)c1ccc(CN2CCCN(c3ccc(C(F)(F)F)nn3)CC2)cc1 ZINC000301830307 854472746 /nfs/dbraw/zinc/47/27/46/854472746.db2.gz RTUHDVXHBGFTDJ-UHFFFAOYSA-N 0 3 404.358 4.227 20 0 HIADHN CC(C)(C)c1nnc2ccc(N[C@H]3CCN(Cc4ccc(C(F)(F)F)cc4)C3)nn21 ZINC000302261791 854557986 /nfs/dbraw/zinc/55/79/86/854557986.db2.gz ABJPZLQRWQMBRF-INIZCTEOSA-N 0 3 418.467 4.127 20 0 HIADHN C[N@@H+]1CC[C@H](Nc2nc(C(F)(F)F)nc3[n-]cnc32)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000302836772 854649556 /nfs/dbraw/zinc/64/95/56/854649556.db2.gz WVUWPTVBSXRLQG-AAEUAGOBSA-N 0 3 414.794 4.022 20 0 HIADHN C[N@H+]1CC[C@H](Nc2nc(C(F)(F)F)nc3[n-]cnc32)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000302836772 854649562 /nfs/dbraw/zinc/64/95/62/854649562.db2.gz WVUWPTVBSXRLQG-AAEUAGOBSA-N 0 3 414.794 4.022 20 0 HIADHN CN1CC[C@H](Nc2nc(C(F)(F)F)nc3[nH]cnc32)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000302836772 854649565 /nfs/dbraw/zinc/64/95/65/854649565.db2.gz WVUWPTVBSXRLQG-AAEUAGOBSA-N 0 3 414.794 4.022 20 0 HIADHN COc1ccc([C@@H](C)NC(=O)NC[C@H](c2ccccc2)N(C)C)cc1Br ZINC000302896581 854669748 /nfs/dbraw/zinc/66/97/48/854669748.db2.gz LGBNSRNDIHUCSV-RDTXWAMCSA-N 0 3 420.351 4.121 20 0 HIADHN CN(Cc1ccc(Br)cc1)C(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000302903320 854673248 /nfs/dbraw/zinc/67/32/48/854673248.db2.gz VKBCTWPMKGAREV-KRWDZBQOSA-N 0 3 422.392 4.489 20 0 HIADHN COc1ccc([C@H](NCC(=O)Nc2cc(OC)c(Cl)cc2OC)C(C)C)cc1 ZINC000302919867 854679984 /nfs/dbraw/zinc/67/99/84/854679984.db2.gz GOOAUUJERJPISD-OAQYLSRUSA-N 0 3 406.910 4.291 20 0 HIADHN O=C(Nc1cccc(OC[C@@H]2CCCO2)c1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000302963100 854698683 /nfs/dbraw/zinc/69/86/83/854698683.db2.gz GLTSYYXPJJPGJM-CVDCTZTESA-N 0 3 412.505 4.234 20 0 HIADHN COCCN1CCC(NC(=O)/C=C/c2ccc(-c3ccccc3Cl)s2)CC1 ZINC000303014064 854722893 /nfs/dbraw/zinc/72/28/93/854722893.db2.gz KHLFFWXAFCKVEP-VQHVLOKHSA-N 0 3 404.963 4.309 20 0 HIADHN COCCN1CCC(NC(=O)c2cc(-c3ccc(C)cc3C)nc3ccccc32)CC1 ZINC000303022742 854726805 /nfs/dbraw/zinc/72/68/05/854726805.db2.gz MARCNLXUPWRSEG-UHFFFAOYSA-N 0 3 417.553 4.359 20 0 HIADHN COc1cccc(C(=O)NC[C@H]2CCCCN2Cc2ccccc2)c1OC(F)F ZINC000303077375 854750536 /nfs/dbraw/zinc/75/05/36/854750536.db2.gz RWEBLSPUYYIZSI-QGZVFWFLSA-N 0 3 404.457 4.081 20 0 HIADHN CCOc1ccc(C(=O)N2CCCN(CCCc3ccccc3)CC2)cc1OCC ZINC000303083808 854753658 /nfs/dbraw/zinc/75/36/58/854753658.db2.gz AJZWLHIDRIKQBO-UHFFFAOYSA-N 0 3 410.558 4.265 20 0 HIADHN CCOc1ccc2cc(C(=O)N3CCCN(CCCc4ccccc4)CC3)[nH]c2c1 ZINC000303099152 854759238 /nfs/dbraw/zinc/75/92/38/854759238.db2.gz GUINWDJWFRPCIL-UHFFFAOYSA-N 0 3 405.542 4.347 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Cc2ccccc2Br)N2CCCC2)cc1 ZINC000303172970 854800056 /nfs/dbraw/zinc/80/00/56/854800056.db2.gz BQWOZMGMIYIQOJ-HXUWFJFHSA-N 0 3 401.348 4.253 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Cc3cccc(Br)c3)c(C)c2)CC1 ZINC000303189597 854808798 /nfs/dbraw/zinc/80/87/98/854808798.db2.gz ZXAMCIAETGCUMX-UHFFFAOYSA-N 0 3 416.363 4.081 20 0 HIADHN COc1cccc(CN(C)C(=O)CN(Cc2ccc3c(c2)CCO3)C2CCCC2)c1 ZINC000303234328 854829447 /nfs/dbraw/zinc/82/94/47/854829447.db2.gz YUWNANDXHQUSLU-UHFFFAOYSA-N 0 3 408.542 4.033 20 0 HIADHN O=C(CCc1cc(Br)cs1)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000303292911 854856753 /nfs/dbraw/zinc/85/67/53/854856753.db2.gz LDHLOQDXDGQNRF-KRWDZBQOSA-N 0 3 407.377 4.224 20 0 HIADHN C[C@H](CNC(=O)Cc1csc(Cc2ccc(F)cc2)n1)N(C)Cc1ccccc1 ZINC000303421192 854924172 /nfs/dbraw/zinc/92/41/72/854924172.db2.gz CRISUOHMEIFFIG-QGZVFWFLSA-N 0 3 411.546 4.052 20 0 HIADHN Cc1nn(Cc2ccccc2)c(Cl)c1C(=O)NC[C@H](C)N(C)Cc1ccccc1 ZINC000303444997 854944726 /nfs/dbraw/zinc/94/47/26/854944726.db2.gz ILZGDQGGDFOUGG-KRWDZBQOSA-N 0 3 410.949 4.144 20 0 HIADHN CCN1CCCC[C@H]1CNC(=O)c1cnn(-c2ccc(C)c(Cl)c2)c1C1CC1 ZINC000303460201 854960237 /nfs/dbraw/zinc/96/02/37/854960237.db2.gz HAMJSDNNUFWMQI-SFHVURJKSA-N 0 3 400.954 4.316 20 0 HIADHN C[C@@H](CNC(=O)Cc1ccc(NC(=O)OC(C)(C)C)cc1)N(C)Cc1ccccc1 ZINC000303485203 854977226 /nfs/dbraw/zinc/97/72/26/854977226.db2.gz PCHAKPLQMNWAAL-SFHVURJKSA-N 0 3 411.546 4.213 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)Nc3cc(Br)ccc3F)cc2)CC1 ZINC000303516163 855004423 /nfs/dbraw/zinc/00/44/23/855004423.db2.gz PIWUKHKGZHETJL-UHFFFAOYSA-N 0 3 420.326 4.371 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)NCc1ccc(C(=O)N2CCCCC2)cc1 ZINC000303542039 855027447 /nfs/dbraw/zinc/02/74/47/855027447.db2.gz JWICFIWSSFPMSU-UHFFFAOYSA-N 0 3 419.525 4.051 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)[C@@H]3C[C@@H]3c3cccc(C(F)(F)F)c3)CC2)C[C@H](C)O1 ZINC000303541703 855027779 /nfs/dbraw/zinc/02/77/79/855027779.db2.gz UOSFIYPXGRQHLX-VAKZPMALSA-N 0 3 424.507 4.157 20 0 HIADHN COc1cccc(C(=O)N(CCN2CCCC2)Cc2ccc(Cl)cc2)c1OC ZINC000303577165 855052250 /nfs/dbraw/zinc/05/22/50/855052250.db2.gz NZOWADYXMBOTOR-UHFFFAOYSA-N 0 3 402.922 4.095 20 0 HIADHN COc1cc(F)c([C@@H](C)NC(=O)N[C@@H](CN2CCCC2)c2ccccc2)cc1OC ZINC000303586072 855059954 /nfs/dbraw/zinc/05/99/54/855059954.db2.gz QNEQMBOWWCCVHB-UZLBHIALSA-N 0 3 415.509 4.040 20 0 HIADHN C[C@H](C(=O)Nc1ccc(OC(F)(F)F)cc1)N1CCN(C2CCC(C)CC2)CC1 ZINC000303616162 855079836 /nfs/dbraw/zinc/07/98/36/855079836.db2.gz CKHCQHJYZMEOMC-UPTPFMHGSA-N 0 3 413.484 4.109 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N(C)CCCOc3cccc(Cl)c3)cc2)CC1 ZINC000303715512 855147991 /nfs/dbraw/zinc/14/79/91/855147991.db2.gz QSCDQSLORMVDKQ-UHFFFAOYSA-N 0 3 415.965 4.023 20 0 HIADHN CC1CCC(N2CCN(Cc3nnc(-c4ccccc4Br)o3)CC2)CC1 ZINC000303729862 855156660 /nfs/dbraw/zinc/15/66/60/855156660.db2.gz UOSWGEVZPFURKI-UHFFFAOYSA-N 0 3 419.367 4.195 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)NCc1csc(-c2ccccc2)n1 ZINC000303745228 855167243 /nfs/dbraw/zinc/16/72/43/855167243.db2.gz ZLOIWXKCPVRKJX-UHFFFAOYSA-N 0 3 412.534 4.223 20 0 HIADHN Cc1c(Cl)cccc1S(=O)(=O)N(C)[C@H]1CCN(Cc2ccccc2)[C@@H](C)C1 ZINC000303760799 855179882 /nfs/dbraw/zinc/17/98/82/855179882.db2.gz FAWQGLZJHZHWBR-LPHOPBHVSA-N 0 3 406.979 4.322 20 0 HIADHN CN(C)[C@@H](CNC(=O)c1cc(NC(=O)NC(C)(C)C)ccc1Cl)c1ccccc1 ZINC000303843649 855240939 /nfs/dbraw/zinc/24/09/39/855240939.db2.gz DLQPHRKORNEGEC-IBGZPJMESA-N 0 3 416.953 4.293 20 0 HIADHN Cc1cc(C(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)c2cnn(C(C)C)c2n1 ZINC000303844108 855241118 /nfs/dbraw/zinc/24/11/18/855241118.db2.gz NJZXNTGPLSEHQU-LJQANCHMSA-N 0 3 405.546 4.057 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)CCc2ccccc2Cl)cc1)[C@@H]1CCCN(C)C1 ZINC000303851344 855246963 /nfs/dbraw/zinc/24/69/63/855246963.db2.gz FSASAZAGGVTWJQ-HXUWFJFHSA-N 0 3 413.949 4.078 20 0 HIADHN O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)[C@@H]1C[C@H]1c1ccccc1OC(F)(F)F ZINC000303857312 855252901 /nfs/dbraw/zinc/25/29/01/855252901.db2.gz LULPCEDQYKLEOV-YZGWKJHDSA-N 0 3 418.459 4.470 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)c1ccn(-c2cccc(C(F)(F)F)c2)n1 ZINC000303901372 855277440 /nfs/dbraw/zinc/27/74/40/855277440.db2.gz SSLQYWBJKOBGNS-UHFFFAOYSA-N 0 3 416.447 4.095 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N3CC[C@H](c4ccccc4)[C@@H](C)C3)cc2)CC1 ZINC000303967072 855327504 /nfs/dbraw/zinc/32/75/04/855327504.db2.gz DEXFGBLXNZFPTB-OFVILXPXSA-N 0 3 405.586 4.483 20 0 HIADHN CCCOc1ccc(Br)cc1CNC[C@H](C)NC(=O)OC(C)(C)C ZINC000310056127 855365146 /nfs/dbraw/zinc/36/51/46/855365146.db2.gz JPYXOIHMJSXITF-ZDUSSCGKSA-N 0 3 401.345 4.241 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCN(C(=O)c2ccc(Br)c(F)c2)C1 ZINC000323775872 855396771 /nfs/dbraw/zinc/39/67/71/855396771.db2.gz BOEVHWVVVCECKU-OAHLLOKOSA-N 0 3 405.311 4.182 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)c2cccc(Br)c2Cl)CCN1Cc1ccccc1 ZINC000383281691 855437016 /nfs/dbraw/zinc/43/70/16/855437016.db2.gz LDGCDQOYZQJVAV-DYVFJYSZSA-N 0 3 407.739 4.495 20 0 HIADHN COc1ccc(Br)cc1C(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000388527411 855448106 /nfs/dbraw/zinc/44/81/06/855448106.db2.gz JYJANCGIEHREHG-SFHVURJKSA-N 0 3 417.347 4.194 20 0 HIADHN C[C@H](NCc1ccc(N2CCCC2=O)cc1)c1ccc(I)cc1 ZINC000390331187 855453657 /nfs/dbraw/zinc/45/36/57/855453657.db2.gz ZSSNYOBNVKJXBW-AWEZNQCLSA-N 0 3 420.294 4.269 20 0 HIADHN COc1ccc(C(=O)NCCC[NH+](Cc2ccccc2)Cc2ccccc2)c([O-])c1 ZINC000390801666 855457472 /nfs/dbraw/zinc/45/74/72/855457472.db2.gz ZRZIJPICLQWUJP-UHFFFAOYSA-N 0 3 404.510 4.223 20 0 HIADHN C[C@]1(CNC(=O)c2c(F)cccc2Br)CCCN1Cc1ccccc1 ZINC000397906873 855472865 /nfs/dbraw/zinc/47/28/65/855472865.db2.gz FLSAFKKSXYIGTN-HXUWFJFHSA-N 0 3 405.311 4.373 20 0 HIADHN O=C(NCC1(O)CCN(Cc2ccccc2)CC1)Nc1cc(Cl)ccc1Cl ZINC000397540643 855472982 /nfs/dbraw/zinc/47/29/82/855472982.db2.gz LUZUQQUBYQAIIW-UHFFFAOYSA-N 0 3 408.329 4.142 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)c2cccc(Br)c2Cl)CN1Cc1ccccc1 ZINC000398140001 855476386 /nfs/dbraw/zinc/47/63/86/855476386.db2.gz NYGBQPYSKFTDGS-UKRRQHHQSA-N 0 3 407.739 4.495 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)c2ccnc(OCc3ccccc3)c2)C1 ZINC000409457141 855488376 /nfs/dbraw/zinc/48/83/76/855488376.db2.gz QELGTXJDEMFQHF-AUSIDOKSSA-N 0 3 401.510 4.226 20 0 HIADHN C[C@H](Oc1ccc(C(=O)N(CCN(C)C)Cc2ccccn2)cc1)c1ccccc1 ZINC000409535668 855529576 /nfs/dbraw/zinc/52/95/76/855529576.db2.gz KUXMHXKHZJEJNQ-FQEVSTJZSA-N 0 3 403.526 4.426 20 0 HIADHN CSc1nccn1-c1ccc(C(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)cc1 ZINC000409569713 855545153 /nfs/dbraw/zinc/54/51/53/855545153.db2.gz IUXYKRFFQZDFGW-XLIONFOSSA-N 0 3 406.555 4.160 20 0 HIADHN Cc1ccc(C[C@H](NC(=O)N2CCN(C3CCCCC3)CC2)c2ccccn2)cc1 ZINC000409740656 855629477 /nfs/dbraw/zinc/62/94/77/855629477.db2.gz NFUURNDWNVOOCN-DEOSSOPVSA-N 0 3 406.574 4.334 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)c1ccc2c(c1)nc(C(F)F)n2C ZINC000409741340 855629511 /nfs/dbraw/zinc/62/95/11/855629511.db2.gz PYOFVDVPNCFXKY-INIZCTEOSA-N 0 3 412.484 4.248 20 0 HIADHN CC(C)n1ncc2c1nc(C1CC1)cc2C(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000409848422 855685242 /nfs/dbraw/zinc/68/52/42/855685242.db2.gz JJVAAFXEABRMGH-PXNSSMCTSA-N 0 3 417.557 4.455 20 0 HIADHN Cc1nc2ccc(NC(=O)NCCCCN3CCN(c4ccccc4)CC3)cc2s1 ZINC000409849253 855686479 /nfs/dbraw/zinc/68/64/79/855686479.db2.gz GXFBNGGRCCKSOZ-UHFFFAOYSA-N 0 3 423.586 4.329 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3CCc4cc(F)cc(C)c4C3)c(C)c2)CC1 ZINC000410049916 855799694 /nfs/dbraw/zinc/79/96/94/855799694.db2.gz QYWNYMSTEPSJAU-UHFFFAOYSA-N 0 3 410.537 4.175 20 0 HIADHN CC(C)(C)[C@H](CN1CCc2ccccc2C1)NC(=O)Cc1cnn(-c2ccccc2)c1 ZINC000410052844 855802305 /nfs/dbraw/zinc/80/23/05/855802305.db2.gz KOQHUXRAPKOKPN-DEOSSOPVSA-N 0 3 416.569 4.004 20 0 HIADHN CC(C)(C)[C@H](CN1CCc2ccccc2C1)NC(=O)Cc1cccc2cccnc21 ZINC000410054212 855803242 /nfs/dbraw/zinc/80/32/42/855803242.db2.gz PRNSJKMHPZZMAO-QHCPKHFHSA-N 0 3 401.554 4.367 20 0 HIADHN CN(C)[C@@H](CNC(=O)NCc1cccc(NC(=O)c2ccccc2)c1)c1ccccc1 ZINC000410265366 855890312 /nfs/dbraw/zinc/89/03/12/855890312.db2.gz MLRCSCLGIYNUEB-QHCPKHFHSA-N 0 3 416.525 4.041 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](NCC2CC(F)(F)C2)c2ccc(F)c(F)c2)c1 ZINC000425948758 856013926 /nfs/dbraw/zinc/01/39/26/856013926.db2.gz BVXGHLUAYILQSL-SFHVURJKSA-N 0 3 401.425 4.093 20 0 HIADHN COC[C@H](c1ccc(Cl)cc1)N(C)C(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000425977895 856027110 /nfs/dbraw/zinc/02/71/10/856027110.db2.gz NEQOMHXJFVSUCE-PWRODBHTSA-N 0 3 401.938 4.114 20 0 HIADHN C[C@H](NC(=O)N[C@H]1C[C@H](C)N(Cc2ccccc2)C1)c1nc(C(F)(F)F)cs1 ZINC000426053205 856075285 /nfs/dbraw/zinc/07/52/85/856075285.db2.gz AWUJJYCHEVGUEQ-YDHLFZDLSA-N 0 3 412.481 4.185 20 0 HIADHN Cc1noc(C2(C)CCN(Cc3c[nH]nc3-c3ccc(C(F)(F)F)cc3)CC2)n1 ZINC000426161604 856147510 /nfs/dbraw/zinc/14/75/10/856147510.db2.gz OJXPYKQNCBQLTG-UHFFFAOYSA-N 0 3 405.424 4.341 20 0 HIADHN CCOc1ccc(CNC2(C(=O)Nc3ccc(OC)c(OC)c3)CCCC2)cc1F ZINC000426168770 856150645 /nfs/dbraw/zinc/15/06/45/856150645.db2.gz UVOFLHFGVMGVRQ-UHFFFAOYSA-N 0 3 416.493 4.283 20 0 HIADHN C[C@H]1CN(C2CCOCC2)CCN1C(=O)N[C@H]1C[C@@H]2CCC(C)(C)c3cccc1c32 ZINC000426217223 856183016 /nfs/dbraw/zinc/18/30/16/856183016.db2.gz XMMOQMIOJROZQB-SPEDKVCISA-N 0 3 411.590 4.181 20 0 HIADHN C[C@@H](Sc1ccnc2cc(Cl)ccc21)C(=O)N1CC[C@H](N2CCCCC2)C1 ZINC000426283755 856220748 /nfs/dbraw/zinc/22/07/48/856220748.db2.gz ZOIFLTFQQAMQRI-WBVHZDCISA-N 0 3 403.979 4.456 20 0 HIADHN C[C@H](N[C@@H]1c2cccc(Br)c2CC1(C)C)c1cccc(S(N)(=O)=O)c1 ZINC000426330166 856248664 /nfs/dbraw/zinc/24/86/64/856248664.db2.gz JGMDCWCGLPBOFG-KPZWWZAWSA-N 0 3 423.376 4.071 20 0 HIADHN COc1ccsc1C(=O)N(Cc1ccccc1Br)C1CCN(C)CC1 ZINC000426772320 856468956 /nfs/dbraw/zinc/46/89/56/856468956.db2.gz CUZCGQXRZHEUOU-UHFFFAOYSA-N 0 3 423.376 4.256 20 0 HIADHN COc1cc(CN(C)[C@@H](C)c2cccc(N3CCCS3(=O)=O)c2)ccc1SC ZINC000426796054 856483472 /nfs/dbraw/zinc/48/34/72/856483472.db2.gz ZOFHHKICWNVXJB-INIZCTEOSA-N 0 3 420.600 4.150 20 0 HIADHN COc1ccccc1[C@H](NC(=O)N1CCCN(Cc2ccccc2)CC1)c1ccco1 ZINC000426813207 856493403 /nfs/dbraw/zinc/49/34/03/856493403.db2.gz VEYVGDAMBQFMGQ-DEOSSOPVSA-N 0 3 419.525 4.295 20 0 HIADHN CN(C)CCN(C(=O)NCc1ccnc(Oc2ccccc2F)c1)C1CCCC1 ZINC000426853205 856512879 /nfs/dbraw/zinc/51/28/79/856512879.db2.gz GXVDCVRYKAIWKA-UHFFFAOYSA-N 0 3 400.498 4.029 20 0 HIADHN Cc1ccc(-c2c[nH]cc2C(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)s1 ZINC000427149776 856671101 /nfs/dbraw/zinc/67/11/01/856671101.db2.gz JROJXGDEEFLJSN-IRXDYDNUSA-N 0 3 415.603 4.403 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3ccc(Oc4ccccc4)nc3)CC2)C[C@H](C)O1 ZINC000427289612 856753880 /nfs/dbraw/zinc/75/38/80/856753880.db2.gz VWBCWTUJZPQNGZ-BGYRXZFFSA-N 0 3 423.557 4.225 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)c3cnc(-c4ccsc4)s3)CC2)C[C@H](C)O1 ZINC000427291850 856755307 /nfs/dbraw/zinc/75/53/07/856755307.db2.gz KLFLIHNXRYAZLD-HOTGVXAUSA-N 0 3 419.616 4.223 20 0 HIADHN Cc1nc(CC(C)C)sc1C(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000427291380 856755628 /nfs/dbraw/zinc/75/56/28/856755628.db2.gz FTVUISIIGSPJNQ-IAGOWNOFSA-N 0 3 407.624 4.002 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)c3ccc(N4CCCCC4)cc3)CC2)C[C@H](C)O1 ZINC000427295523 856757224 /nfs/dbraw/zinc/75/72/24/856757224.db2.gz JWNQWXHVJAINMY-SFTDATJTSA-N 0 3 413.606 4.028 20 0 HIADHN Cc1cccc(OCCCCC(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)c1 ZINC000427342546 856782046 /nfs/dbraw/zinc/78/20/46/856782046.db2.gz POXPHTPHGWKPNF-FGZHOGPDSA-N 0 3 416.606 4.282 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)CCCc3c[nH]c4ccccc34)CC2)C[C@H](C)O1 ZINC000427352268 856788046 /nfs/dbraw/zinc/78/80/46/856788046.db2.gz MUXJCTJKWTUYCL-PMACEKPBSA-N 0 3 411.590 4.229 20 0 HIADHN C[C@H](CSc1ccccc1)C(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000427357183 856789831 /nfs/dbraw/zinc/78/98/31/856789831.db2.gz LRXKNEALRYSXQH-AQNXPRMDSA-N 0 3 404.620 4.153 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)c1occc1Br ZINC000427361302 856794026 /nfs/dbraw/zinc/79/40/26/856794026.db2.gz DWQQOILINHMOOD-UHFFFAOYSA-N 0 3 419.241 4.265 20 0 HIADHN Cc1cc2c(cc1C)[C@@H](NCc1ccc(CS(=O)(=O)NC(C)C)cc1)CCS2 ZINC000427572276 856872668 /nfs/dbraw/zinc/87/26/68/856872668.db2.gz MLKRGQLCWICUJR-NRFANRHFSA-N 0 3 418.628 4.458 20 0 HIADHN COc1cc([C@@H](C)N[C@H]2CCCc3ncc(C(F)(F)F)cc32)ccc1OCCO ZINC000427583927 856877621 /nfs/dbraw/zinc/87/76/21/856877621.db2.gz SDZYQGFKGONXGG-ACJLOTCBSA-N 0 3 410.436 4.208 20 0 HIADHN COc1cc(CN[C@H]2CCSc3cc(C)c(C)cc32)ccc1OCC(=O)N(C)C ZINC000427593767 856880987 /nfs/dbraw/zinc/88/09/87/856880987.db2.gz MIRIYBNIWVGRPQ-IBGZPJMESA-N 0 3 414.571 4.106 20 0 HIADHN C[C@@H]1CCN(C(=O)COc2ccc(Cl)c3cccnc23)CCN1Cc1ccccc1 ZINC000437489520 862847806 /nfs/dbraw/zinc/84/78/06/862847806.db2.gz ZZEYGMFEHGVAIS-GOSISDBHSA-N 0 3 423.944 4.390 20 0 HIADHN CCn1ncc(C(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)c1-c1ccccc1 ZINC000427640216 856894830 /nfs/dbraw/zinc/89/48/30/856894830.db2.gz VXFLBEHWUSWJCN-FQEVSTJZSA-N 0 3 402.542 4.307 20 0 HIADHN CSc1cccc(S(=O)(=O)Nc2ccnc(N3CCc4ccccc4C3)c2)c1 ZINC000427646593 856895874 /nfs/dbraw/zinc/89/58/74/856895874.db2.gz SASRCBJBHBYMEW-UHFFFAOYSA-N 0 3 411.552 4.167 20 0 HIADHN NC(=O)[C@H](Cc1ccccc1)NC[C@@H](OCc1ccccc1)c1ccc(Cl)cc1 ZINC000427816348 856967559 /nfs/dbraw/zinc/96/75/59/856967559.db2.gz ICVXCKAAARSERE-XZOQPEGZSA-N 0 3 408.929 4.284 20 0 HIADHN CCOC(=O)C1CCN(C(=O)C[C@@H](C)N[C@@H](C)c2cc(Cl)ccc2Cl)CC1 ZINC000427867050 856987130 /nfs/dbraw/zinc/98/71/30/856987130.db2.gz AHOVPKQFIJLGCT-KGLIPLIRSA-N 0 3 415.361 4.224 20 0 HIADHN C[C@H](N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1=O)[C@H]1OCCc2sccc21 ZINC000427866872 856987181 /nfs/dbraw/zinc/98/71/81/856987181.db2.gz SUQNNQZSVJFOBG-SOVGHPHASA-N 0 3 422.497 4.137 20 0 HIADHN Fc1ccccc1[C@@H](N[C@H]1CCn2ccnc2C1)c1ccc(Br)cc1 ZINC000427865886 856987325 /nfs/dbraw/zinc/98/73/25/856987325.db2.gz OGZGOKWSAKKHDP-JXFKEZNVSA-N 0 3 400.295 4.479 20 0 HIADHN CCN1CCN(c2ccccc2N[C@@H](C)c2ncc(Br)cc2F)CC1 ZINC000427875773 856990076 /nfs/dbraw/zinc/99/00/76/856990076.db2.gz UJUZCIVVAIGUMJ-AWEZNQCLSA-N 0 3 407.331 4.298 20 0 HIADHN CCNC(=O)Nc1ccc(C)c(NC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)c1 ZINC000427940177 857015916 /nfs/dbraw/zinc/01/59/16/857015916.db2.gz CKZMDEJIDXDUIB-SFHVURJKSA-N 0 3 412.509 4.126 20 0 HIADHN Cc1cc(C)c(CC(C(=O)Nc2cccc(N(C)C(N)=O)c2)C(F)(F)F)c(C)c1 ZINC000427955505 857022238 /nfs/dbraw/zinc/02/22/38/857022238.db2.gz DSAFGYAACGQBMZ-SFHVURJKSA-N 0 3 407.436 4.486 20 0 HIADHN Cn1nccc1[C@@H]1CCCN(Cc2cnn(Cc3ccc(C(F)(F)F)cc3)c2)C1 ZINC000428242886 857123840 /nfs/dbraw/zinc/12/38/40/857123840.db2.gz MNELJJCNSXFUSA-GOSISDBHSA-N 0 3 403.452 4.063 20 0 HIADHN CC(C)C[C@H](NCCCc1c(Cl)cccc1Cl)c1nc(-c2nc[nH]n2)no1 ZINC000428268507 857134026 /nfs/dbraw/zinc/13/40/26/857134026.db2.gz MILQMKPSPYUTPO-HNNXBMFYSA-N 0 3 409.321 4.471 20 0 HIADHN O=C(NC[C@H]1CN(Cc2ccccc2)CCCO1)c1ccc(Oc2ccccc2)o1 ZINC000428272423 857136291 /nfs/dbraw/zinc/13/62/91/857136291.db2.gz UTNXDSZACIJTNJ-NRFANRHFSA-N 0 3 406.482 4.093 20 0 HIADHN CCOc1cc(CN2CC[C@H](O)[C@@H](C)C2)ccc1OCCOc1cccc(Cl)c1 ZINC000428480109 857219050 /nfs/dbraw/zinc/21/90/50/857219050.db2.gz BJMDCFZSUGIXFD-UWJYYQICSA-N 0 3 419.949 4.399 20 0 HIADHN O=C(Nc1cccc(CN2CCC(Cn3cncn3)CC2)c1)c1ccc(Cl)cc1 ZINC000428485187 857222617 /nfs/dbraw/zinc/22/26/17/857222617.db2.gz SZFFLKJENZTQJD-UHFFFAOYSA-N 0 3 409.921 4.096 20 0 HIADHN CCN(CC)C(=O)c1cccc(NC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)c1 ZINC000437563313 862887514 /nfs/dbraw/zinc/88/75/14/862887514.db2.gz WWFDKMPAOLOVOI-FQEVSTJZSA-N 0 3 422.573 4.297 20 0 HIADHN COc1ccc(C2(C(=O)Nc3cccc(CN4CC[C@@H](O)C4)c3)CCCCC2)cc1 ZINC000428551461 857259464 /nfs/dbraw/zinc/25/94/64/857259464.db2.gz KPQWVUBAYYCLAP-JOCHJYFZSA-N 0 3 408.542 4.102 20 0 HIADHN COc1ccc2nc(CNC[C@@H](CO)Cc3ccccc3Br)sc2c1 ZINC000428553958 857264503 /nfs/dbraw/zinc/26/45/03/857264503.db2.gz YKRCRNPJLUTUMS-ZDUSSCGKSA-N 0 3 421.360 4.008 20 0 HIADHN Cn1c(CNC[C@@]2(Cc3ccc(F)cc3)CCC[C@@H]2O)nc2ccc(Cl)cc21 ZINC000428564114 857268058 /nfs/dbraw/zinc/26/80/58/857268058.db2.gz IJXJUIZHAJUOQJ-UNMCSNQZSA-N 0 3 401.913 4.229 20 0 HIADHN CN1CCC[C@H](CNC(=O)c2ncc(F)cc2F)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000428716610 857308533 /nfs/dbraw/zinc/30/85/33/857308533.db2.gz ALEUNYMHDDXMQW-ACJLOTCBSA-N 0 3 413.390 4.192 20 0 HIADHN C[C@]1(c2ccccc2)CC[C@H](N2CCN(CC(=O)Nc3ccccc3Cl)CC2)C1 ZINC000437578156 862896298 /nfs/dbraw/zinc/89/62/98/862896298.db2.gz LASBFHOLTKBYCF-RDPSFJRHSA-N 0 3 411.977 4.407 20 0 HIADHN c1ccc(CN2CCC[C@H](N(Cc3nc(C4CC4)no3)Cc3ccncc3)C2)cc1 ZINC000428793480 857342861 /nfs/dbraw/zinc/34/28/61/857342861.db2.gz KQKSYNUWPXJWID-QFIPXVFZSA-N 0 3 403.530 4.009 20 0 HIADHN CC(C)(C)n1ncnc1CN(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000428798030 857346942 /nfs/dbraw/zinc/34/69/42/857346942.db2.gz GGHPPYNNRHKNMM-QHCPKHFHSA-N 0 3 418.589 4.095 20 0 HIADHN C[C@@H](NC(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1)c1c(F)cccc1Cl ZINC000428818202 857359124 /nfs/dbraw/zinc/35/91/24/857359124.db2.gz MKGZUYGECXLBMG-SJLPKXTDSA-N 0 3 419.928 4.130 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)C1(c2cc(F)cc(C(F)(F)F)c2)CC1 ZINC000428828361 857363290 /nfs/dbraw/zinc/36/32/90/857363290.db2.gz WCAVYMPJEZIBHM-IBGZPJMESA-N 0 3 422.422 4.081 20 0 HIADHN CC(C)(C(=O)Nc1cccc(CN2CC[C@@H](O)C2)c1)c1cccc(C(F)(F)F)c1 ZINC000428828697 857363541 /nfs/dbraw/zinc/36/35/41/857363541.db2.gz XHOTXEJUJSJSJC-LJQANCHMSA-N 0 3 406.448 4.188 20 0 HIADHN COc1cc(OC)cc(N2CC[C@H](CNCc3nc4ccc(F)cc4s3)C2)c1 ZINC000428860686 857376405 /nfs/dbraw/zinc/37/64/05/857376405.db2.gz HUDAXZZEELFTEO-CQSZACIVSA-N 0 3 401.507 4.069 20 0 HIADHN CC(C)N(CC(=O)N1CCC(C(=O)N2CCCCCC2)CC1)[C@@H](C)c1ccccc1 ZINC000428870741 857379712 /nfs/dbraw/zinc/37/97/12/857379712.db2.gz GDTGGKBZAKRXDR-NRFANRHFSA-N 0 3 413.606 4.099 20 0 HIADHN O[C@H](CNCc1ccc(C(F)(F)F)s1)COc1ccccc1Br ZINC000428877033 857383126 /nfs/dbraw/zinc/38/31/26/857383126.db2.gz RILFYDIFFWZNIY-SNVBAGLBSA-N 0 3 410.255 4.059 20 0 HIADHN O=C(Nc1ccc(Cl)cn1)[C@@H]1CCCN(Cc2c[nH]nc2-c2ccsc2)C1 ZINC000437592494 862905091 /nfs/dbraw/zinc/90/50/91/862905091.db2.gz LVOLMRDXWONMQV-CYBMUJFWSA-N 0 3 401.923 4.037 20 0 HIADHN CC(C)N(C)c1cccc(NC(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)c1 ZINC000428887827 857391665 /nfs/dbraw/zinc/39/16/65/857391665.db2.gz PPKSYZBMEPMLPT-WOJBJXKFSA-N 0 3 416.610 4.274 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3cc(Cl)ccc3N(C)C)CC2)C[C@@H](C)O1 ZINC000428897281 857398613 /nfs/dbraw/zinc/39/86/13/857398613.db2.gz FYKQDNHJIPCKIV-IAGOWNOFSA-N 0 3 423.001 4.149 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)Nc3ccccc3OCC3CC3)CC2)C[C@H](C)O1 ZINC000428902164 857402099 /nfs/dbraw/zinc/40/20/99/857402099.db2.gz SQAVHHVSDRKXFA-OALUTQOASA-N 0 3 415.578 4.219 20 0 HIADHN CN(C[C@]1(O)CCN(Cc2ccccc2)C1)C(=O)c1ccc(-c2ccccc2Cl)o1 ZINC000428956940 857435470 /nfs/dbraw/zinc/43/54/70/857435470.db2.gz ZFQOQTWAEBSSTO-XMMPIXPASA-N 0 3 424.928 4.309 20 0 HIADHN CCN(Cc1ccc(Cl)s1)C(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000429004916 857452530 /nfs/dbraw/zinc/45/25/30/857452530.db2.gz GENGQIOWWKXLQU-GOSISDBHSA-N 0 3 421.994 4.224 20 0 HIADHN CCCN(Cc1ccc(F)cc1)C(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000429005321 857453290 /nfs/dbraw/zinc/45/32/90/857453290.db2.gz RZCITIVDPIBIJG-HSZRJFAPSA-N 0 3 413.537 4.038 20 0 HIADHN C/C(=C/c1ccccc1)CN(C)C(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000429019245 857459674 /nfs/dbraw/zinc/45/96/74/857459674.db2.gz IQEXJTXBJQZRLE-OFVJEAJMSA-N 0 3 407.558 4.022 20 0 HIADHN CC(C)OCc1cccc(NC(=O)NC[C@@H]2CN(Cc3ccccc3)CCCO2)c1 ZINC000429024243 857462752 /nfs/dbraw/zinc/46/27/52/857462752.db2.gz ACSIQSNSAZSHHG-HSZRJFAPSA-N 0 3 411.546 4.024 20 0 HIADHN CC(C)OCc1cccc(NC(=O)NC[C@H]2CN(Cc3ccccc3)CCCO2)c1 ZINC000429024245 857463232 /nfs/dbraw/zinc/46/32/32/857463232.db2.gz ACSIQSNSAZSHHG-QHCPKHFHSA-N 0 3 411.546 4.024 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)Nc3cccc(Cl)c3N(C)C)CC2)C[C@H](C)O1 ZINC000429033936 857466903 /nfs/dbraw/zinc/46/69/03/857466903.db2.gz ZFDUQIVRYWDBET-IRXDYDNUSA-N 0 3 423.001 4.149 20 0 HIADHN CC(C)N(Cc1ccc(F)cc1)C(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000429033862 857467546 /nfs/dbraw/zinc/46/75/46/857467546.db2.gz GOHVMWAVHVVAIO-QHCPKHFHSA-N 0 3 413.537 4.037 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3cccc(N4CCCC4)c3)CC2)C[C@H](C)O1 ZINC000429042520 857472275 /nfs/dbraw/zinc/47/22/75/857472275.db2.gz CEIYEMBPNHKBQN-BGYRXZFFSA-N 0 3 414.594 4.030 20 0 HIADHN CCCOc1ccccc1NC(=O)N1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000429054404 857480116 /nfs/dbraw/zinc/48/01/16/857480116.db2.gz PMKXKXWZPXHOIQ-OALUTQOASA-N 0 3 403.567 4.219 20 0 HIADHN O=C(NCc1ccc(COCc2ccccc2)cc1)NC[C@H]1CCCCN1C1CC1 ZINC000429104193 857510893 /nfs/dbraw/zinc/51/08/93/857510893.db2.gz PVJSLVHIDDHZBS-XMMPIXPASA-N 0 3 407.558 4.220 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1NC(=O)CCN1Cc2ccccc2O[C@@H](C)C1 ZINC000429123149 857520738 /nfs/dbraw/zinc/52/07/38/857520738.db2.gz OOJDWEQEFUBKDR-KRWDZBQOSA-N 0 3 404.514 4.101 20 0 HIADHN CC(C)[C@H](NC(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1)c1ccccc1 ZINC000429172864 857540791 /nfs/dbraw/zinc/54/07/91/857540791.db2.gz SWNSRVFUMRIMGR-MZKRTTBSSA-N 0 3 401.595 4.305 20 0 HIADHN C[C@@H](NC(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1)c1cc2ccccc2o1 ZINC000429188358 857546489 /nfs/dbraw/zinc/54/64/89/857546489.db2.gz MQGSNZLJQWATGB-CEXWTWQISA-N 0 3 413.562 4.415 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3ccccc3N3CCCC3)CC2)C[C@@H](C)O1 ZINC000429205287 857552591 /nfs/dbraw/zinc/55/25/91/857552591.db2.gz BXACCKFRMOBSCE-WOJBJXKFSA-N 0 3 414.594 4.030 20 0 HIADHN COc1ccc(NC(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)cc1Cl ZINC000429209330 857556579 /nfs/dbraw/zinc/55/65/79/857556579.db2.gz OPANIFXZULGMGL-IYBDPMFKSA-N 0 3 409.958 4.092 20 0 HIADHN C[C@@H](NC(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1)c1ccc(Cl)cc1 ZINC000429218900 857560565 /nfs/dbraw/zinc/56/05/65/857560565.db2.gz ZWWPQRJZRVLXOV-KZNAEPCWSA-N 0 3 407.986 4.322 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3ccc(OC(F)F)cc3)CC2)C[C@H](C)O1 ZINC000429220908 857561024 /nfs/dbraw/zinc/56/10/24/857561024.db2.gz LFAOGYYDHHZRDW-IYBDPMFKSA-N 0 3 411.493 4.031 20 0 HIADHN CCCn1ccnc1CCCN(C)CC(=O)N(C)Cc1cc(Cl)cc(Cl)c1 ZINC000429245685 857571880 /nfs/dbraw/zinc/57/18/80/857571880.db2.gz KXYFCCRZLLDYJI-UHFFFAOYSA-N 0 3 411.377 4.123 20 0 HIADHN CCCn1ccnc1CCCN(C)CC[S@@](=O)c1cc(Cl)ccc1Cl ZINC000429263268 857581983 /nfs/dbraw/zinc/58/19/83/857581983.db2.gz XSHJFJUGJKHYSG-RUZDIDTESA-N 0 3 402.391 4.272 20 0 HIADHN CC(C)n1nccc1NC(=O)[C@H](C)N[C@H]1c2cc(Br)ccc2CC1(C)C ZINC000429292100 857594879 /nfs/dbraw/zinc/59/48/79/857594879.db2.gz ICRYSAKQBQTXCV-UGSOOPFHSA-N 0 3 419.367 4.467 20 0 HIADHN O=C(CN[C@H]1Cc2cccc(O)c2C1)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 ZINC000429297824 857596507 /nfs/dbraw/zinc/59/65/07/857596507.db2.gz UTKLPUJFHFTFJS-HNAYVOBHSA-N 0 3 405.325 4.120 20 0 HIADHN Cc1cnc([C@@H](C)NC(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)s1 ZINC000429320421 857602389 /nfs/dbraw/zinc/60/23/89/857602389.db2.gz VRBCMQJBLBMQAD-CQSZACIVSA-N 0 3 414.497 4.305 20 0 HIADHN CC(C)C[C@@H]1CN(CCCc2ccccc2)CCN1CC(=O)Nc1ccccc1F ZINC000429362982 857622531 /nfs/dbraw/zinc/62/25/31/857622531.db2.gz CGNSZCVQYALJEP-JOCHJYFZSA-N 0 3 411.565 4.429 20 0 HIADHN C[C@@H](NC[C@@H]1CN(Cc2ccccc2)CCCO1)c1nc2ccc(Cl)cc2n1C ZINC000429430457 857663577 /nfs/dbraw/zinc/66/35/77/857663577.db2.gz LVPBLSNOOGEMCX-YLJYHZDGSA-N 0 3 412.965 4.168 20 0 HIADHN Cc1cc([C@@H](NC[C@@H]2CN(Cc3ccccc3)CCCO2)c2cccnc2)ccc1F ZINC000429439080 857668344 /nfs/dbraw/zinc/66/83/44/857668344.db2.gz ARFVGESDZPPRBC-AOYPEHQESA-N 0 3 419.544 4.499 20 0 HIADHN CC[C@H](NC(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1)c1cc(F)ccc1F ZINC000429449119 857675873 /nfs/dbraw/zinc/67/58/73/857675873.db2.gz RMIUQFDUMFCWGT-YVHKJVDXSA-N 0 3 423.548 4.337 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)Nc1ccnn1Cc1ccc(F)cc1 ZINC000429576997 857763504 /nfs/dbraw/zinc/76/35/04/857763504.db2.gz ZSWQRKXLOHJUCY-GOSISDBHSA-N 0 3 413.522 4.091 20 0 HIADHN CC(C)Oc1cc(F)ccc1NC(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000429601146 857784045 /nfs/dbraw/zinc/78/40/45/857784045.db2.gz KMNJOYFNILGINA-FQEVSTJZSA-N 0 3 415.509 4.026 20 0 HIADHN Clc1ccccc1[C@@H]1CN(C[C@H]2CN(Cc3ccccc3)CCCO2)CCO1 ZINC000429685732 857834571 /nfs/dbraw/zinc/83/45/71/857834571.db2.gz XOKHXKRZDYTXHN-OFNKIYASSA-N 0 3 400.950 4.004 20 0 HIADHN CN(C)[C@@H](CNC(=O)Nc1ccnn1Cc1ccc(Cl)c(F)c1)c1ccccc1 ZINC000429696514 857839437 /nfs/dbraw/zinc/83/94/37/857839437.db2.gz IMKKXGCCOQXBQN-IBGZPJMESA-N 0 3 415.900 4.148 20 0 HIADHN CCc1ccccc1NC(=O)C[C@H](C)N[C@@H](CO)c1ccc(Br)c(F)c1 ZINC000430147568 858053159 /nfs/dbraw/zinc/05/31/59/858053159.db2.gz LQIDVGCCDASMEH-DJJJIMSYSA-N 0 3 423.326 4.191 20 0 HIADHN C[C@@H]1CCN(C)CCN1C(=O)N[C@@H](CC1CC1)c1cc(F)cc(Br)c1 ZINC000430289776 858109873 /nfs/dbraw/zinc/10/98/73/858109873.db2.gz LMFILFHHSVLYLH-ACJLOTCBSA-N 0 3 412.347 4.165 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1cc2sccc2[nH]1 ZINC000430294491 858111876 /nfs/dbraw/zinc/11/18/76/858111876.db2.gz OZBPTTBCNRQIEQ-KRWDZBQOSA-N 0 3 405.527 4.434 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)N[C@@H](CC3CC3)c3cc(F)cc(Br)c3)[C@@H]2C1 ZINC000430298932 858113706 /nfs/dbraw/zinc/11/37/06/858113706.db2.gz GXOKUJUOCFVAIN-MDASCCDHSA-N 0 3 424.358 4.165 20 0 HIADHN O=C(CO[C@H]1CCCc2ccccc21)Nc1ccc(CCN2CCSCC2)cc1 ZINC000430414564 858150241 /nfs/dbraw/zinc/15/02/41/858150241.db2.gz COQULLYJFVXWTC-QHCPKHFHSA-N 0 3 410.583 4.311 20 0 HIADHN O=C(N1CCC(c2ccncc2)CC1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000430543561 858212660 /nfs/dbraw/zinc/21/26/60/858212660.db2.gz SECQJTOXNDWLKG-QFIPXVFZSA-N 0 3 417.475 4.242 20 0 HIADHN CCOc1ccc(C(=O)CCC(=O)N[C@@H]2CCN(Cc3ccccc3)[C@H](C)C2)cc1 ZINC000430685258 858268639 /nfs/dbraw/zinc/26/86/39/858268639.db2.gz QGWBFPHOHVBEOX-DENIHFKCSA-N 0 3 408.542 4.218 20 0 HIADHN CC[C@@H](N[C@@H](C)c1ccc(Br)c(S(N)(=O)=O)c1)c1ccc(C)cc1 ZINC000430692910 858271590 /nfs/dbraw/zinc/27/15/90/858271590.db2.gz XFPWMNCOVHIMKP-SUMWQHHRSA-N 0 3 411.365 4.207 20 0 HIADHN Cc1ccc([C@@H](N[C@H](C)c2ccc(Br)c(S(N)(=O)=O)c2)C2CC2)cc1 ZINC000430701444 858273038 /nfs/dbraw/zinc/27/30/38/858273038.db2.gz VVBWBLHUWBYVPR-BFUOFWGJSA-N 0 3 423.376 4.207 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)cc1CN1CC[C@@H](C(=O)N(C)c2ccccc2)C1 ZINC000430864261 858342642 /nfs/dbraw/zinc/34/26/42/858342642.db2.gz JSHGMAFMVGEJJB-GOSISDBHSA-N 0 3 408.933 4.319 20 0 HIADHN COc1ccc([C@H](CN2C(=O)CN([C@@H](C)c3ccccc3)C2=O)N2CCCCC2)cc1 ZINC000430953526 858381240 /nfs/dbraw/zinc/38/12/40/858381240.db2.gz HHZHACUYSVLLAJ-CVDCTZTESA-N 0 3 421.541 4.248 20 0 HIADHN CN(C)[C@H](CN1C(=O)[C@@H](c2ccc(Cl)c(Cl)c2)N(C)C1=O)c1ccccc1 ZINC000430970611 858385846 /nfs/dbraw/zinc/38/58/46/858385846.db2.gz HVFACJBMMGSJLP-QZTJIDSGSA-N 0 3 406.313 4.231 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](N2C(=O)N[C@@H](Cc3cccc4ccccc43)C2=O)C1 ZINC000431042452 858414773 /nfs/dbraw/zinc/41/47/73/858414773.db2.gz HSMYFEWCEGRKQR-OUOWLKGYSA-N 0 3 413.521 4.138 20 0 HIADHN CCc1noc(-c2ccc(C)c(NC(=O)NC[C@@H](C)N(C)Cc3ccccc3)c2)n1 ZINC000431118917 858454679 /nfs/dbraw/zinc/45/46/79/858454679.db2.gz HFYRXTSFWVXCMP-QGZVFWFLSA-N 0 3 407.518 4.249 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3ccc4ncsc4c3)c(OCC)c2)CC1 ZINC000431401980 858596749 /nfs/dbraw/zinc/59/67/49/858596749.db2.gz IOUDVYNAVFKHKM-UHFFFAOYSA-N 0 3 424.570 4.479 20 0 HIADHN COc1cnccc1N1CCN(C(=O)Nc2ccc(OCc3ccccc3)cc2)CC1 ZINC000431424811 858608556 /nfs/dbraw/zinc/60/85/56/858608556.db2.gz AWCMJRVGVDSFJP-UHFFFAOYSA-N 0 3 418.497 4.023 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3ccc(O)cc3OC(C)C)c(C)c2)CC1 ZINC000431557637 858669112 /nfs/dbraw/zinc/66/91/12/858669112.db2.gz NKDILXVSOWMADX-UHFFFAOYSA-N 0 3 412.534 4.274 20 0 HIADHN C[C@H](CCSc1ccccc1)N1CCC(NS(=O)(=O)c2cccs2)CC1 ZINC000431599406 858683606 /nfs/dbraw/zinc/68/36/06/858683606.db2.gz GQPVYBCQYDPBJE-MRXNPFEDSA-N 0 3 410.630 4.062 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cccc(F)c1Br)c1cccc(OC)c1 ZINC000431740299 858777183 /nfs/dbraw/zinc/77/71/83/858777183.db2.gz GOCXRSLGTFUTCF-GOSISDBHSA-N 0 3 423.326 4.410 20 0 HIADHN CN1CC[C@H](NC(=O)NCC[C@H](c2ccccc2)C(F)(F)F)[C@H]1c1ccccc1 ZINC000432079687 858973515 /nfs/dbraw/zinc/97/35/15/858973515.db2.gz NHSGKBPHIKANCE-HSALFYBXSA-N 0 3 405.464 4.467 20 0 HIADHN COC(=O)CCn1nc(C)c(CN2CCC(F)(c3cccc(Cl)c3)CC2)c1C ZINC000467556112 881378525 /nfs/dbraw/zinc/37/85/25/881378525.db2.gz XAUFNOVELUZYJV-UHFFFAOYSA-N 0 3 407.917 4.177 20 0 HIADHN COCC[C@@H]1CCCCN(C(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)C1 ZINC000467559355 881382978 /nfs/dbraw/zinc/38/29/78/881382978.db2.gz GDVYKZXTXCDOCM-VQTJNVASSA-N 0 3 407.624 4.369 20 0 HIADHN CC(C)N(C)C(=O)c1ccc(Cl)c(NC(=O)N(CCN(C)C)C2CCCC2)c1 ZINC000467582432 881396849 /nfs/dbraw/zinc/39/68/49/881396849.db2.gz TVWRWARBRGROCX-UHFFFAOYSA-N 0 3 408.974 4.159 20 0 HIADHN COC(=O)c1cc([C@H](C)N2CCC[C@@H](c3nnc(C4CCCCC4)[nH]3)C2)oc1C ZINC000432850368 859389114 /nfs/dbraw/zinc/38/91/14/859389114.db2.gz JKFWQSGZTJEHSX-WMLDXEAASA-N 0 3 400.523 4.481 20 0 HIADHN CN(C)Cc1ccc(S(=O)(=O)N2CCC[C@H]2c2cccc(Br)c2)cc1 ZINC000432864328 859394969 /nfs/dbraw/zinc/39/49/69/859394969.db2.gz HJIYHVDMAKFHRJ-IBGZPJMESA-N 0 3 423.376 4.037 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CCC(c2ncc(C)s2)CC1)c1ccsc1 ZINC000432870962 859399500 /nfs/dbraw/zinc/39/95/00/859399500.db2.gz FUBNDYXSWRTPSY-SFHVURJKSA-N 0 3 406.621 4.485 20 0 HIADHN COc1ccccc1-c1noc(C2CCN(Cc3cccc(-n4cccn4)c3)CC2)n1 ZINC000433020118 859482237 /nfs/dbraw/zinc/48/22/37/859482237.db2.gz BNFRPBBEJWHJSJ-UHFFFAOYSA-N 0 3 415.497 4.311 20 0 HIADHN Cc1ccc([C@@H](NCC2(CO)CC3(CCC3)C2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000433084649 859516128 /nfs/dbraw/zinc/51/61/28/859516128.db2.gz RTYWQYBGLQZWKU-JOCHJYFZSA-N 0 3 413.583 4.020 20 0 HIADHN C/C=C/c1ccc(OC[C@@H](O)CN2CCC(c3ncc(C)s3)CC2)c(OC)c1 ZINC000433146956 859540228 /nfs/dbraw/zinc/54/02/28/859540228.db2.gz BSDMWHWPXODWFR-PXPVJAHISA-N 0 3 402.560 4.113 20 0 HIADHN Cc1cnc(C2CCN(C[C@H](O)COc3ccc(Cl)cc3Cl)CC2)s1 ZINC000433174743 859554416 /nfs/dbraw/zinc/55/44/16/859554416.db2.gz KFDBEDZJMQIWAZ-HNNXBMFYSA-N 0 3 401.359 4.378 20 0 HIADHN O=C(NCc1ccco1)Nc1ccc(NC(=O)[C@H]2CCCCN2C2CCCC2)cc1 ZINC000433217240 859572533 /nfs/dbraw/zinc/57/25/33/859572533.db2.gz DJWNBJYRZFRFJF-OAQYLSRUSA-N 0 3 410.518 4.337 20 0 HIADHN FC(F)(F)c1ccccc1[C@@H]1CCCCC[C@@H]1NCc1nnnn1C1CCOCC1 ZINC000433241941 859586601 /nfs/dbraw/zinc/58/66/01/859586601.db2.gz FMQIYMJDGBPHKR-HKUYNNGSSA-N 0 3 423.483 4.250 20 0 HIADHN Cc1ccccc1[C@H](CC(F)(F)F)NS(=O)(=O)c1ccc(CN(C)C)cc1 ZINC000433355785 859658931 /nfs/dbraw/zinc/65/89/31/859658931.db2.gz RMAXWGOKSMCBPB-SFHVURJKSA-N 0 3 400.466 4.029 20 0 HIADHN C[C@H](NCc1cccc(-n2cncn2)c1)c1ccc(OC[C@H]2CCCCO2)c(F)c1 ZINC000433385918 859668401 /nfs/dbraw/zinc/66/84/01/859668401.db2.gz GWGPAWMQRZPQIM-LAUBAEHRSA-N 0 3 410.493 4.205 20 0 HIADHN Cc1cccc(C(=O)NCCN[C@H](C)c2ccc(OC[C@@H]3CCCCO3)c(F)c2)c1 ZINC000433391497 859671423 /nfs/dbraw/zinc/67/14/23/859671423.db2.gz RWNBMDIJWIJZOU-NQIIRXRSSA-N 0 3 414.521 4.163 20 0 HIADHN CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)N[C@@H](c1cc(F)ccc1F)C(F)F ZINC000433607780 859807241 /nfs/dbraw/zinc/80/72/41/859807241.db2.gz KRQZADHIQNQMOE-JVPBZIDWSA-N 0 3 424.442 4.000 20 0 HIADHN O=C(Cc1nc(CN2CCCN(Cc3ccccc3)CC2)cs1)Nc1ccccc1 ZINC000433611849 859809043 /nfs/dbraw/zinc/80/90/43/859809043.db2.gz FWOXLSSVQTURTD-UHFFFAOYSA-N 0 3 420.582 4.032 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)N[C@H](c1cc(F)ccc1F)C(F)F ZINC000433612571 859810107 /nfs/dbraw/zinc/81/01/07/859810107.db2.gz NELFVLYQACHVQL-DOTOQJQBSA-N 0 3 415.456 4.469 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)N[C@@H](c1cc(F)ccc1F)C(F)F ZINC000433647214 859822924 /nfs/dbraw/zinc/82/29/24/859822924.db2.gz CDRXCIBZCJJURH-MOPGFXCFSA-N 0 3 409.427 4.407 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)Cc2cc(F)ccc2Br)C1 ZINC000433717875 859851959 /nfs/dbraw/zinc/85/19/59/859851959.db2.gz JYRBGEQOSLPVTA-RDTXWAMCSA-N 0 3 405.311 4.082 20 0 HIADHN CCNC(=O)Nc1cccc(NC(=O)N(CC)[C@H]2CCN(Cc3ccccc3)C2)c1C ZINC000433758547 859879749 /nfs/dbraw/zinc/87/97/49/859879749.db2.gz RZVWCEZTMYHGKZ-FQEVSTJZSA-N 0 3 423.561 4.265 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)Nc3ccc(-c4csc(C(F)(F)F)n4)cc3)[C@@H]2C1 ZINC000433794680 859895595 /nfs/dbraw/zinc/89/55/95/859895595.db2.gz ZIELZGXHMNSFPD-XJKSGUPXSA-N 0 3 410.465 4.387 20 0 HIADHN Cc1cccc(Cl)c1NC(=O)NCCCCN1CCN(Cc2ccccc2)CC1 ZINC000467682527 881476630 /nfs/dbraw/zinc/47/66/30/881476630.db2.gz OUKGPGAQAYEROM-UHFFFAOYSA-N 0 3 414.981 4.368 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)c2ccccc2OCc2cscn2)CN1Cc1ccccc1 ZINC000467689600 881481031 /nfs/dbraw/zinc/48/10/31/881481031.db2.gz WGGQKMRTVHNLMS-PKOBYXMFSA-N 0 3 407.539 4.115 20 0 HIADHN Cc1c(NC(=O)N[C@H](CN2CCCC2)c2ccccc2)noc1-c1ccccc1F ZINC000433917887 859969292 /nfs/dbraw/zinc/96/92/92/859969292.db2.gz HBCQIAMQNFEXTH-HXUWFJFHSA-N 0 3 408.477 4.748 20 0 HIADHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](C)Sc1ccnc2cc(Cl)ccc21 ZINC000434035650 860054171 /nfs/dbraw/zinc/05/41/71/860054171.db2.gz IWOCMXWIUYNVAH-OIISXLGYSA-N 0 3 403.979 4.454 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)c2ccc(OCc3ccccn3)cc2)CN1Cc1ccccc1 ZINC000467700727 881495084 /nfs/dbraw/zinc/49/50/84/881495084.db2.gz NHXCZAITRLILJZ-XXBNENTESA-N 0 3 401.510 4.053 20 0 HIADHN CCCN(C(=O)c1ccc(NC(C)=O)c(F)c1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000434114677 860117335 /nfs/dbraw/zinc/11/73/35/860117335.db2.gz NRRLSEOYHMENAM-OAQYLSRUSA-N 0 3 411.521 4.301 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3cc(C(F)(F)F)ccn3)c(C)c2)CC1 ZINC000434209851 860196913 /nfs/dbraw/zinc/19/69/13/860196913.db2.gz RNHUOVJGBJSWDK-UHFFFAOYSA-N 0 3 407.440 4.195 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)[C@H](C)Oc1cccc(C)c1 ZINC000434308884 860270653 /nfs/dbraw/zinc/27/06/53/860270653.db2.gz PZTBPWFOLRFJDV-RBBKRZOGSA-N 0 3 418.541 4.353 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)[C@H]1CSc2ccccc21 ZINC000434324768 860286066 /nfs/dbraw/zinc/28/60/66/860286066.db2.gz FRGCEAATUMESKW-FPOVZHCZSA-N 0 3 418.566 4.467 20 0 HIADHN CC(=O)c1csc(C(=O)Nc2c(C)cnn2[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000434326769 860288338 /nfs/dbraw/zinc/28/83/38/860288338.db2.gz NRRMTFXFELQJMZ-IBGZPJMESA-N 0 3 408.527 4.155 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)[C@@H](C)OCc1ccccc1 ZINC000434328712 860291048 /nfs/dbraw/zinc/29/10/48/860291048.db2.gz VXJKNAFQXZCEIY-OFNKIYASSA-N 0 3 418.541 4.182 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)[C@H](C)Oc1ccccc1 ZINC000434329660 860292311 /nfs/dbraw/zinc/29/23/11/860292311.db2.gz BSROYKZCKVMPLK-PZJWPPBQSA-N 0 3 404.514 4.045 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1csc(C2CC2)n1 ZINC000434335025 860296234 /nfs/dbraw/zinc/29/62/34/860296234.db2.gz LVMRDRVCEUABEX-GOSISDBHSA-N 0 3 407.543 4.225 20 0 HIADHN O=C(NC[C@H]1CCCCN1C1CC1)N(Cc1cccc(-c2cccnc2)c1)C1CC1 ZINC000434354977 860307961 /nfs/dbraw/zinc/30/79/61/860307961.db2.gz LEIQWOYXXVKVGK-XMMPIXPASA-N 0 3 404.558 4.440 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)[C@H](C)Sc1ccccn1 ZINC000434412076 860338813 /nfs/dbraw/zinc/33/88/13/860338813.db2.gz OONHHLMIFSOYSR-ICSRJNTNSA-N 0 3 421.570 4.153 20 0 HIADHN COc1ccc(CN2CC[C@@H](CN(C)Cc3scnc3C)C2)cc1Br ZINC000434492507 860371669 /nfs/dbraw/zinc/37/16/69/860371669.db2.gz HQGJCGRDSCQXFR-INIZCTEOSA-N 0 3 424.408 4.177 20 0 HIADHN NC(=O)c1ccc(NC(=O)CCN2CCC[C@@H]2c2ccccc2Cl)cc1Cl ZINC000434594850 860418570 /nfs/dbraw/zinc/41/85/70/860418570.db2.gz IJUYIVTVXJYDHG-GOSISDBHSA-N 0 3 406.313 4.258 20 0 HIADHN CC(C)CCN(CC(=O)N(Cc1nnc(-c2ccccc2Cl)o1)C1CC1)C1CC1 ZINC000434625041 860436979 /nfs/dbraw/zinc/43/69/79/860436979.db2.gz SRXZNOQZVUEXOD-UHFFFAOYSA-N 0 3 416.953 4.392 20 0 HIADHN O=C(c1ccc(F)cc1)C1CCN(C[C@H](O)CO[C@@H]2CCCc3ccccc32)CC1 ZINC000434661896 860450355 /nfs/dbraw/zinc/45/03/55/860450355.db2.gz GYEUCRDYEGPSEE-LADGPHEKSA-N 0 3 411.517 4.176 20 0 HIADHN CCC[C@H](NC(=O)[C@@H](C)N1CCC(c2ncc3n2CCCC3)CC1)c1ccccc1 ZINC000434682737 860458559 /nfs/dbraw/zinc/45/85/59/860458559.db2.gz DFHDROYPDFVLRB-XXBNENTESA-N 0 3 408.590 4.445 20 0 HIADHN O=C(CN1CCC(c2ncc3n2CCCC3)CC1)N[C@@H](c1ccccc1)C1CCCC1 ZINC000434684275 860459614 /nfs/dbraw/zinc/45/96/14/860459614.db2.gz HUXYQSNYGZQHHL-VWLOTQADSA-N 0 3 420.601 4.447 20 0 HIADHN Brc1cc2c(cc1CN1CCC(c3ncc4n3CCCC4)CC1)OCO2 ZINC000434687765 860462031 /nfs/dbraw/zinc/46/20/31/860462031.db2.gz FWEARZWJSXDGGM-UHFFFAOYSA-N 0 3 418.335 4.090 20 0 HIADHN O=C(CCN1CCC(C(=O)c2ccc(F)cc2)CC1)N[C@@H]1CCCc2ccccc21 ZINC000434687662 860462047 /nfs/dbraw/zinc/46/20/47/860462047.db2.gz YMAGCISSGUVNHD-HSZRJFAPSA-N 0 3 408.517 4.304 20 0 HIADHN Cc1ccc(NC(=O)Cc2nc(CN3CCN(CCC(C)(C)C)CC3)cs2)cc1 ZINC000434707992 860466069 /nfs/dbraw/zinc/46/60/69/860466069.db2.gz BCJANFVNUIEBDB-UHFFFAOYSA-N 0 3 414.619 4.187 20 0 HIADHN Cc1nn(Cc2ccccc2Cl)c(C)c1CNCCOCC(F)(F)C(F)F ZINC000434789686 860494745 /nfs/dbraw/zinc/49/47/45/860494745.db2.gz ZMIUPJLRKXNXNF-UHFFFAOYSA-N 0 3 407.839 4.208 20 0 HIADHN C[C@H]1CN(CCCCNC(=O)Cc2csc(-c3ccccc3Cl)n2)C[C@H](C)O1 ZINC000434786427 860494899 /nfs/dbraw/zinc/49/48/99/860494899.db2.gz ONNNVBLHLFGUTD-HOTGVXAUSA-N 0 3 421.994 4.012 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CNC(=O)CN1CC[C@H](c2ccccc2)[C@H]1C ZINC000434898228 860543150 /nfs/dbraw/zinc/54/31/50/860543150.db2.gz UKDYCXRULURKJR-YKSBVNFPSA-N 0 3 416.569 4.042 20 0 HIADHN CCCCn1ncc(C(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)c1C ZINC000435010806 860595925 /nfs/dbraw/zinc/59/59/25/860595925.db2.gz BPWLAMMYPRNVJM-UHFFFAOYSA-N 0 3 410.484 4.214 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)CCc2nnc(-c3ccc(Cl)cc3)o2)CN1Cc1ccccc1 ZINC000467750835 881557404 /nfs/dbraw/zinc/55/74/04/881557404.db2.gz CCWRVLBZKKCXSQ-OXQOHEQNSA-N 0 3 424.932 4.102 20 0 HIADHN O=C(c1cc(COc2ccc(Cl)cc2Cl)on1)N1CC[C@H](N2CCCCC2)C1 ZINC000435011458 860597235 /nfs/dbraw/zinc/59/72/35/860597235.db2.gz JYWALFNACCAWSF-HNNXBMFYSA-N 0 3 424.328 4.261 20 0 HIADHN COC(=O)c1ccc(COc2ccccc2CN2CCC(n3ccc(C)n3)CC2)cc1 ZINC000435054058 860616973 /nfs/dbraw/zinc/61/69/73/860616973.db2.gz ABJTXJHBJISXSI-UHFFFAOYSA-N 0 3 419.525 4.394 20 0 HIADHN Cc1cccn2cc(COc3ccc(CN4CC[C@@H](Oc5ccncc5)C4)cc3)nc12 ZINC000435054628 860618075 /nfs/dbraw/zinc/61/80/75/860618075.db2.gz DIUJUNZFPFHREG-XMMPIXPASA-N 0 3 414.509 4.270 20 0 HIADHN Cc1cc(S(C)(=O)=O)cc(NC(=O)NCC2(N3CCCCC3)CCCCC2)c1C ZINC000435092922 860638362 /nfs/dbraw/zinc/63/83/62/860638362.db2.gz AOFJPQAETXGOGE-UHFFFAOYSA-N 0 3 421.607 4.017 20 0 HIADHN Cc1cc(NC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)n(Cc2ccccc2)n1 ZINC000435151380 860666837 /nfs/dbraw/zinc/66/68/37/860666837.db2.gz XQXITENUURHNLE-OAQYLSRUSA-N 0 3 417.557 4.368 20 0 HIADHN COc1cc(CN2CCC[C@@H](CO)C2)ccc1OCc1cccc(C(F)(F)F)c1 ZINC000435245821 860702457 /nfs/dbraw/zinc/70/24/57/860702457.db2.gz NTDGPMIISQXNSD-GOSISDBHSA-N 0 3 409.448 4.497 20 0 HIADHN COc1cc(CN2CCC[C@H](CO)C2)ccc1OCc1cccc(C(F)(F)F)c1 ZINC000435245822 860702710 /nfs/dbraw/zinc/70/27/10/860702710.db2.gz NTDGPMIISQXNSD-SFHVURJKSA-N 0 3 409.448 4.497 20 0 HIADHN COc1cc(C(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)ccc1F ZINC000435266461 860708369 /nfs/dbraw/zinc/70/83/69/860708369.db2.gz JTZUOEQFUZFFQL-LJQANCHMSA-N 0 3 408.477 4.039 20 0 HIADHN CCS[C@@H](C(=O)Nc1cc(C)nn1[C@H]1CCN(Cc2ccccc2)C1)C(C)C ZINC000435267308 860708672 /nfs/dbraw/zinc/70/86/72/860708672.db2.gz LZEKWBKSVVWRGG-PZJWPPBQSA-N 0 3 400.592 4.355 20 0 HIADHN CCS[C@H](C(=O)Nc1cc(C)nn1[C@@H]1CCN(Cc2ccccc2)C1)C(C)C ZINC000435267306 860708756 /nfs/dbraw/zinc/70/87/56/860708756.db2.gz LZEKWBKSVVWRGG-CTNGQTDRSA-N 0 3 400.592 4.355 20 0 HIADHN Cc1cc(NC(=O)Cc2cccc(F)c2F)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435266315 860708770 /nfs/dbraw/zinc/70/87/70/860708770.db2.gz JKTJVBQETIVDCS-LJQANCHMSA-N 0 3 410.468 4.098 20 0 HIADHN Cc1cc(NC(=O)COc2c(C)cccc2C)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435278240 860713852 /nfs/dbraw/zinc/71/38/52/860713852.db2.gz FZZTYNPPZBNJRW-JOCHJYFZSA-N 0 3 418.541 4.273 20 0 HIADHN Cc1cc(NC(=O)CO[C@@H]2CCCC[C@H]2C)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435277530 860714013 /nfs/dbraw/zinc/71/40/13/860714013.db2.gz CXKJEDWRRDUSIG-STZQEDGTSA-N 0 3 410.562 4.172 20 0 HIADHN Cc1cc(NC(=O)CO[C@@H]2CCCC[C@@H]2C)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435277531 860714231 /nfs/dbraw/zinc/71/42/31/860714231.db2.gz CXKJEDWRRDUSIG-VLCRHTCISA-N 0 3 410.562 4.172 20 0 HIADHN CO[C@@](C)(C(=O)Nc1cc(C)nn1[C@@H]1CCN(Cc2ccccc2)C1)c1ccccc1 ZINC000435277366 860714346 /nfs/dbraw/zinc/71/43/46/860714346.db2.gz BPLSAOJSKQPYBR-RCZVLFRGSA-N 0 3 418.541 4.139 20 0 HIADHN Cc1cc(NC(=O)Cc2c[nH]c3ccccc23)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435277704 860714483 /nfs/dbraw/zinc/71/44/83/860714483.db2.gz KAZJSRMHWISMQF-NRFANRHFSA-N 0 3 413.525 4.301 20 0 HIADHN COc1cccc([C@H](C)C(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000435282056 860717126 /nfs/dbraw/zinc/71/71/26/860717126.db2.gz YISYKEIDENKGRJ-UGKGYDQZSA-N 0 3 418.541 4.389 20 0 HIADHN Cc1cc(NC(=O)CCOc2cccc(C)c2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435290892 860720823 /nfs/dbraw/zinc/72/08/23/860720823.db2.gz SPODUXAESJESGY-JOCHJYFZSA-N 0 3 418.541 4.355 20 0 HIADHN Cc1cc(NC(=O)Cc2cccc(Cl)c2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435289057 860721471 /nfs/dbraw/zinc/72/14/71/860721471.db2.gz LWYYGPOLMAPOCA-OAQYLSRUSA-N 0 3 408.933 4.473 20 0 HIADHN COc1cccc(F)c1C(=O)Nc1cc(C)nn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435290087 860721540 /nfs/dbraw/zinc/72/15/40/860721540.db2.gz JQKOIWLXBBBNPX-SFHVURJKSA-N 0 3 408.477 4.039 20 0 HIADHN CCO[C@@H](CC(=O)Nc1cc(C)nn1[C@H]1CCN(Cc2ccccc2)C1)C1=CCCC1 ZINC000435292814 860723154 /nfs/dbraw/zinc/72/31/54/860723154.db2.gz ZELKRBKIEMYXPC-GOTSBHOMSA-N 0 3 422.573 4.483 20 0 HIADHN CCSc1ccc(C(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)cn1 ZINC000435299308 860726734 /nfs/dbraw/zinc/72/67/34/860726734.db2.gz OOAUUOWHIKYWSV-FQEVSTJZSA-N 0 3 421.570 4.398 20 0 HIADHN CCC(CC)n1nccc1C(=O)Nc1cc(C)nn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435303091 860728223 /nfs/dbraw/zinc/72/82/23/860728223.db2.gz URGVXZBTKMZNDR-NRFANRHFSA-N 0 3 420.561 4.448 20 0 HIADHN COc1cc(CCC(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)ccc1Cl ZINC000435342943 860750077 /nfs/dbraw/zinc/75/00/77/860750077.db2.gz KAKYXFXNXCVKNA-HDICACEKSA-N 0 3 422.997 4.019 20 0 HIADHN CC(C)(Oc1ccc(F)cc1)C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435370700 860768494 /nfs/dbraw/zinc/76/84/94/860768494.db2.gz QHJDWRIUZVHVFJ-HXUWFJFHSA-N 0 3 422.504 4.265 20 0 HIADHN CSCc1ccc(C(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000435371328 860769574 /nfs/dbraw/zinc/76/95/74/860769574.db2.gz UQEZBRCPSBPUIP-NRFANRHFSA-N 0 3 406.555 4.445 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)c1ccccc1OCC1CC1 ZINC000435372275 860770454 /nfs/dbraw/zinc/77/04/54/860770454.db2.gz QVCCXTDERJUIOA-OAQYLSRUSA-N 0 3 416.525 4.371 20 0 HIADHN O=C(COc1ccc(Cl)cc1)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435372290 860770922 /nfs/dbraw/zinc/77/09/22/860770922.db2.gz QYQMZYGCDVTBAO-IBGZPJMESA-N 0 3 410.905 4.001 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)[C@@H]1CCCc2ccccc21 ZINC000435373832 860772063 /nfs/dbraw/zinc/77/20/63/860772063.db2.gz GDRFYMGMPJDENK-FYYLOGMGSA-N 0 3 400.526 4.389 20 0 HIADHN O=C(Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)[C@@H]1CSc2ccccc21 ZINC000435374195 860772519 /nfs/dbraw/zinc/77/25/19/860772519.db2.gz HSISIJSUGMRVPT-AZUAARDMSA-N 0 3 404.539 4.158 20 0 HIADHN CC[C@H](Oc1ccccc1F)C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435381741 860777611 /nfs/dbraw/zinc/77/76/11/860777611.db2.gz XRNGXRCEVDLMLD-CTNGQTDRSA-N 0 3 422.504 4.265 20 0 HIADHN Cc1cc(NC(=O)N(C)Cc2scnc2C)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435512231 860830359 /nfs/dbraw/zinc/83/03/59/860830359.db2.gz VNPLAOMJIPBDDY-IBGZPJMESA-N 0 3 424.574 4.067 20 0 HIADHN Cc1cc(NC(=O)N(C)CCc2cccs2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435513169 860831510 /nfs/dbraw/zinc/83/15/10/860831510.db2.gz ILTIGIVXJJPSMH-FQEVSTJZSA-N 0 3 423.586 4.406 20 0 HIADHN Cc1cc(NC(=O)N[C@@H](C)CCc2ccco2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435513664 860833148 /nfs/dbraw/zinc/83/31/48/860833148.db2.gz FDCGXLLQFOSUDT-RXVVDRJESA-N 0 3 421.545 4.374 20 0 HIADHN Cc1cc(NC(=O)N[C@H](C)c2cccc(O)c2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435525590 860842625 /nfs/dbraw/zinc/84/26/25/860842625.db2.gz FDQUNGHGYFWNHX-WIYYLYMNSA-N 0 3 419.529 4.227 20 0 HIADHN Cc1cc(NC(=O)NC[C@@]2(C)CCCS2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435528835 860845048 /nfs/dbraw/zinc/84/50/48/860845048.db2.gz WKNRWGRTKSYVGM-SIKLNZKXSA-N 0 3 413.591 4.046 20 0 HIADHN Cc1cc(NC(=O)NCc2sc(C)nc2C)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435538013 860852012 /nfs/dbraw/zinc/85/20/12/860852012.db2.gz SFCSHVFHVRWZNH-LJQANCHMSA-N 0 3 424.574 4.034 20 0 HIADHN Cc1c(NC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)cnn1-c1ccccc1 ZINC000435560200 860879931 /nfs/dbraw/zinc/87/99/31/860879931.db2.gz LPLPKLFPPNDJEK-LJQANCHMSA-N 0 3 403.530 4.309 20 0 HIADHN Cc1c(NC(=O)N(Cc2ccccc2)C2CCN(C)CC2)cnn1-c1ccccc1F ZINC000435562354 860884335 /nfs/dbraw/zinc/88/43/35/860884335.db2.gz DXMYRCDPZMRCAZ-UHFFFAOYSA-N 0 3 421.520 4.448 20 0 HIADHN COc1cc(OC)c(NC(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)cc1Cl ZINC000467773507 881592042 /nfs/dbraw/zinc/59/20/42/881592042.db2.gz RXYZHZKCLHFIET-KRWDZBQOSA-N 0 3 417.937 4.486 20 0 HIADHN COC(=O)c1ccccc1-c1ccccc1C(=O)NC[C@@H](c1ccccc1)N(C)C ZINC000435663024 860941539 /nfs/dbraw/zinc/94/15/39/860941539.db2.gz LNEANVPWQOZFAL-QHCPKHFHSA-N 0 3 402.494 4.173 20 0 HIADHN Cn1cc(C(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)c2cc(F)ccc21 ZINC000435770396 861045889 /nfs/dbraw/zinc/04/58/89/861045889.db2.gz ZZYNUMBAMLOAGQ-IBGZPJMESA-N 0 3 417.488 4.213 20 0 HIADHN C[C@H](NC(=O)N[C@H]1CCN(Cc2ccccc2)C1)c1ccc(Br)s1 ZINC000435861048 861120733 /nfs/dbraw/zinc/12/07/33/861120733.db2.gz HZURJGWHIUCIHX-ZFWWWQNUSA-N 0 3 408.365 4.145 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1ccc(OC(C)C)cn1 ZINC000435906000 861165854 /nfs/dbraw/zinc/16/58/54/861165854.db2.gz IBWXBZNGKHTUGT-HXUWFJFHSA-N 0 3 419.529 4.073 20 0 HIADHN C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)c1ccccc1CSc1nc2ccccc2o1 ZINC000467805362 881630087 /nfs/dbraw/zinc/63/00/87/881630087.db2.gz CLJHKMFBGGCBMW-FOIQADDNSA-N 0 3 407.539 4.333 20 0 HIADHN COc1ccc(OC(F)F)c(NC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)c1 ZINC000437871576 863232438 /nfs/dbraw/zinc/23/24/38/863232438.db2.gz XMAMXWVNSXBOIQ-MRXNPFEDSA-N 0 3 419.472 4.425 20 0 HIADHN Cc1cccc(Oc2ncccc2NC(=O)N(CCN(C)C)C[C@@H]2CCCO2)c1C ZINC000437879446 863240555 /nfs/dbraw/zinc/24/05/55/863240555.db2.gz BEEWYKDZIZEXPH-IBGZPJMESA-N 0 3 412.534 4.065 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)N[C@@H]3C[C@H]3c3ccc4ccccc4c3)CC2)C[C@H](C)O1 ZINC000437896820 863266972 /nfs/dbraw/zinc/26/69/72/863266972.db2.gz QSPKKPIAODQMLT-QXVOXHNYSA-N 0 3 421.585 4.227 20 0 HIADHN COc1cc(Oc2ccccc2)ccc1NC(=O)CC1(N2CCOCC2)CCCC1 ZINC000437903537 863278033 /nfs/dbraw/zinc/27/80/33/863278033.db2.gz KWRNILAXKRVESC-UHFFFAOYSA-N 0 3 410.514 4.461 20 0 HIADHN Cc1ccc(CC[C@@H](C)NC(=O)Nc2ccc(CCN3CCSCC3)cc2)o1 ZINC000438092796 863493772 /nfs/dbraw/zinc/49/37/72/863493772.db2.gz AYHOATAEPQTXAY-QGZVFWFLSA-N 0 3 401.576 4.322 20 0 HIADHN C[C@@H](CNC(=O)Nc1ccc(CCN2CCSCC2)cc1)Oc1ccc(F)cc1 ZINC000438096512 863501402 /nfs/dbraw/zinc/50/14/02/863501402.db2.gz JKKISODMHWHYAB-KRWDZBQOSA-N 0 3 417.550 4.006 20 0 HIADHN C[C@H](CNC(=O)Nc1ccc(CCN2CCSCC2)cc1)Oc1cccc(F)c1 ZINC000438098674 863506636 /nfs/dbraw/zinc/50/66/36/863506636.db2.gz UEJVUQUFMBWONF-QGZVFWFLSA-N 0 3 417.550 4.006 20 0 HIADHN C[C@H](NCc1ccc(N2C[C@@H](C)O[C@@H](C)C2)nc1)c1cccc(Br)c1 ZINC000467837990 881672980 /nfs/dbraw/zinc/67/29/80/881672980.db2.gz DBSZYDKWXAZRLV-XHSDSOJGSA-N 0 3 404.352 4.309 20 0 HIADHN CC(=O)N1CCN(c2ccccc2CN[C@H](C)c2ccc(C(F)(F)F)cc2)CC1 ZINC000467835145 881668654 /nfs/dbraw/zinc/66/86/54/881668654.db2.gz YWPOIRMFIPNUNE-MRXNPFEDSA-N 0 3 405.464 4.225 20 0 HIADHN C[C@H](N[C@H]1CCCc2cc(OC(F)F)ccc21)c1cccc(S(=O)(=O)N(C)C)c1 ZINC000467839446 881676320 /nfs/dbraw/zinc/67/63/20/881676320.db2.gz PAVYATUPXFPKMH-XOBRGWDASA-N 0 3 424.513 4.267 20 0 HIADHN CCOC(=O)c1sc(NC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)cc1C ZINC000438175644 863598836 /nfs/dbraw/zinc/59/88/36/863598836.db2.gz HGDDSCXQLLTVBZ-QGZVFWFLSA-N 0 3 415.559 4.362 20 0 HIADHN CC(C)COC[C@@H](NC1CCC(N2C(=O)c3ccccc3C2=O)CC1)c1ccco1 ZINC000438197135 863624330 /nfs/dbraw/zinc/62/43/30/863624330.db2.gz CJRAFIPWQNFUQV-WIXQSORDSA-N 0 3 410.514 4.190 20 0 HIADHN CC(C)COC[C@H](NC1CCC(N2C(=O)c3ccccc3C2=O)CC1)c1ccco1 ZINC000438197132 863624636 /nfs/dbraw/zinc/62/46/36/863624636.db2.gz CJRAFIPWQNFUQV-NGICGMGXSA-N 0 3 410.514 4.190 20 0 HIADHN C[C@@H]1CN(CC(C)(C)O)CCN1Cc1csc(-c2ccc(C(F)(F)F)cc2)n1 ZINC000438285105 863761596 /nfs/dbraw/zinc/76/15/96/863761596.db2.gz QRHYJCPICJPWOJ-CQSZACIVSA-N 0 3 413.509 4.106 20 0 HIADHN Cc1cnn(-c2ccc(NC(=O)N3CC[C@@H](C)N(Cc4ccccc4)CC3)cc2F)c1 ZINC000438323296 863801106 /nfs/dbraw/zinc/80/11/06/863801106.db2.gz COSJBAQBAJSKRO-LJQANCHMSA-N 0 3 421.520 4.448 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)N[C@@H]2C[C@H]2c2ccc(Cl)c(F)c2)c1 ZINC000438387920 863840864 /nfs/dbraw/zinc/84/08/64/863840864.db2.gz YLCKXJGYOCBUOO-GHTZIAJQSA-N 0 3 419.928 4.117 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)Nc2ccc(C(C)(C)C(=O)OC)cc2)N(C)C)cc1 ZINC000438455759 863879587 /nfs/dbraw/zinc/87/95/87/863879587.db2.gz BILOOJJGIAKWPF-OAQYLSRUSA-N 0 3 411.546 4.124 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)[C@H]1C[C@@H]1c1ccc(Br)cc1 ZINC000438456806 863879957 /nfs/dbraw/zinc/87/99/57/863879957.db2.gz GTRKNKPMOQXAJM-MSOLQXFVSA-N 0 3 407.377 4.205 20 0 HIADHN CC(=O)c1ccc(SCC(=O)N(Cc2ccccc2)C2CCN(C)CC2)cc1F ZINC000438559640 863992499 /nfs/dbraw/zinc/99/24/99/863992499.db2.gz RTMGQFIIHGHEGB-UHFFFAOYSA-N 0 3 414.546 4.243 20 0 HIADHN CCc1csc(NC(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)n1 ZINC000438585828 864016150 /nfs/dbraw/zinc/01/61/50/864016150.db2.gz XHUWBMBAVRVTLQ-UHFFFAOYSA-N 0 3 400.470 4.320 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Nc1ccc(-n2cccn2)c(Cl)c1 ZINC000438598655 864026111 /nfs/dbraw/zinc/02/61/11/864026111.db2.gz QLCHYMSPJQRHGL-UHFFFAOYSA-N 0 3 403.939 4.183 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)Nc2ccc3c(c2)CCCC(=O)N3)CC1 ZINC000438654475 864095785 /nfs/dbraw/zinc/09/57/85/864095785.db2.gz GPAYJUJZCUIWTB-UHFFFAOYSA-N 0 3 406.530 4.090 20 0 HIADHN CCN(C(=O)C(=O)Nc1cc(F)cc(Cl)c1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000438655643 864098575 /nfs/dbraw/zinc/09/85/75/864098575.db2.gz NKVZNSHBRQOBDW-FOIQADDNSA-N 0 3 417.912 4.102 20 0 HIADHN CCOc1cc(C)ccc1NC(=O)C(=O)N(CC)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000438665205 864116489 /nfs/dbraw/zinc/11/64/89/864116489.db2.gz CINGLMUYVSDZRC-TZIWHRDSSA-N 0 3 423.557 4.016 20 0 HIADHN Cc1nc(-c2cccc(NC(=O)N(Cc3ccccc3)C3CCN(C)CC3)c2)no1 ZINC000438692331 864158465 /nfs/dbraw/zinc/15/84/65/864158465.db2.gz PIZIFPRXOFXHSB-UHFFFAOYSA-N 0 3 405.502 4.173 20 0 HIADHN Cc1cccc(OC[C@H](O)CN2CCC(c3nc4cc(Cl)ccc4o3)CC2)c1 ZINC000438755235 864247713 /nfs/dbraw/zinc/24/77/13/864247713.db2.gz MJLVMKANHRLVAJ-GOSISDBHSA-N 0 3 400.906 4.409 20 0 HIADHN CCOC(=O)c1ccsc1NC(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000438781193 864276258 /nfs/dbraw/zinc/27/62/58/864276258.db2.gz UQQMRMAVCUAHRX-UHFFFAOYSA-N 0 3 401.532 4.053 20 0 HIADHN COc1cc(CN(C)C[C@@H](O)CO[C@@H](c2ccccc2)c2ccccc2C)ccc1O ZINC000438793012 864286302 /nfs/dbraw/zinc/28/63/02/864286302.db2.gz JRMPYRRPCZHISB-GJZUVCINSA-N 0 3 421.537 4.308 20 0 HIADHN Cc1ccsc1CCCC(=O)Nc1ccc(C(=O)N(C)[C@H]2CCCN(C)C2)cc1 ZINC000438838743 864333150 /nfs/dbraw/zinc/33/31/50/864333150.db2.gz GDUSNYKUNPQPHB-FQEVSTJZSA-N 0 3 413.587 4.184 20 0 HIADHN O[C@@H](COc1cc(F)cc(Br)c1)CN1CCC[C@@H]1c1ccsc1 ZINC000438845409 864339801 /nfs/dbraw/zinc/33/98/01/864339801.db2.gz BFPZZIOBSKLBPI-NVXWUHKLSA-N 0 3 400.313 4.227 20 0 HIADHN Cc1nc(COc2ccc(CNCc3cc(Br)ccc3C)cc2)no1 ZINC000438907288 864386584 /nfs/dbraw/zinc/38/65/84/864386584.db2.gz MGGQIYHGZYVNIS-UHFFFAOYSA-N 0 3 402.292 4.318 20 0 HIADHN COc1ccc([C@H](CNC(=O)[C@H]2C[C@@]23CCCc2ccccc23)N2CCCC2)cc1 ZINC000438917703 864396341 /nfs/dbraw/zinc/39/63/41/864396341.db2.gz MNCJIQNISYPEAP-RMTZWNOUSA-N 0 3 404.554 4.243 20 0 HIADHN CN(C)CCN(C(=O)Nc1cccc(COCC(F)(F)C(F)F)c1)C1CCCC1 ZINC000467900486 881762891 /nfs/dbraw/zinc/76/28/91/881762891.db2.gz LHSPLNHPSWWUBZ-UHFFFAOYSA-N 0 3 419.463 4.442 20 0 HIADHN C[C@@H]1CC[C@H](O)[C@@H]([C@@H]2CCCCN2Cc2nnc(-c3ccc(Br)o3)o2)C1 ZINC000438993329 864451386 /nfs/dbraw/zinc/45/13/86/864451386.db2.gz JUNZJXYSZGRSRW-KBXIAJHMSA-N 0 3 424.339 4.244 20 0 HIADHN O[C@@H]1CCCC[C@@H]1[C@H]1CCCCN1Cc1nc(-c2cccc(Br)c2)no1 ZINC000439012298 864463364 /nfs/dbraw/zinc/46/33/64/864463364.db2.gz XJNICRJVWGKWMO-KZNAEPCWSA-N 0 3 420.351 4.405 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)c1cc2ccc(Br)cc2[nH]1 ZINC000439030453 864487474 /nfs/dbraw/zinc/48/74/74/864487474.db2.gz ULKKZCJVYHWGGH-UHFFFAOYSA-N 0 3 406.349 4.196 20 0 HIADHN CC1CCN([C@@H](CNC(=O)N2CCC([C@@H]3CCCO3)CC2)c2cccs2)CC1 ZINC000439112591 864550078 /nfs/dbraw/zinc/55/00/78/864550078.db2.gz BRGKDMQMJWCXHW-PMACEKPBSA-N 0 3 405.608 4.122 20 0 HIADHN CCNC(=O)COc1cccc(CN[C@H](c2ccc(Br)s2)C2CC2)c1 ZINC000439129466 864564759 /nfs/dbraw/zinc/56/47/59/864564759.db2.gz CCPVODSGQLFEMB-IBGZPJMESA-N 0 3 423.376 4.266 20 0 HIADHN CCN(C[C@@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)c1cc(Cl)ccc1C ZINC000439224545 864642651 /nfs/dbraw/zinc/64/26/51/864642651.db2.gz LLFPTUUAWKAQMR-LJQANCHMSA-N 0 3 406.979 4.181 20 0 HIADHN Cc1ccc(CN2CCCC2)cc1NC(=O)CCC(=O)c1ccc2c(c1)CCC(=O)N2 ZINC000467920155 881791180 /nfs/dbraw/zinc/79/11/80/881791180.db2.gz PZDNQZYRUWKQGB-UHFFFAOYSA-N 0 3 419.525 4.077 20 0 HIADHN CC[C@H](NC(=O)N(CCN(C)C)Cc1cccs1)c1nc(C(F)(F)F)cs1 ZINC000439274668 864693617 /nfs/dbraw/zinc/69/36/17/864693617.db2.gz NXNZLBVFSYSHRH-ZDUSSCGKSA-N 0 3 420.526 4.448 20 0 HIADHN O=C1[C@H](N2CCC([C@H]3CCCO3)CC2)CCCN1Cc1cccc(C(F)(F)F)c1 ZINC000439277784 864696016 /nfs/dbraw/zinc/69/60/16/864696016.db2.gz WWVGBSSDMPAPKE-WOJBJXKFSA-N 0 3 410.480 4.087 20 0 HIADHN C[C@@H]1C[C@H](c2ccccc2)CCN1CC(=O)N1CCC(OCc2ccccc2)CC1 ZINC000439315533 864749820 /nfs/dbraw/zinc/74/98/20/864749820.db2.gz JINCBQWGOPTWKY-ZJSXRUAMSA-N 0 3 406.570 4.462 20 0 HIADHN Cc1ncc(NC(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)c(C2CC2)n1 ZINC000439398729 864818344 /nfs/dbraw/zinc/81/83/44/864818344.db2.gz BLFYDLFVMOCCGG-UHFFFAOYSA-N 0 3 421.467 4.277 20 0 HIADHN Cc1cccnc1[C@@H](NC[C@H](O)COc1cc(F)cc(Br)c1)C(C)C ZINC000439458267 864839160 /nfs/dbraw/zinc/83/91/60/864839160.db2.gz SOFCMJHTLHZVAX-WMZOPIPTSA-N 0 3 411.315 4.018 20 0 HIADHN COc1ccccc1[C@H](CNCc1cc(Cl)ccc1OC[C@@H]1CCCO1)N(C)C ZINC000439475972 864844862 /nfs/dbraw/zinc/84/48/62/864844862.db2.gz GRBNOSYNDZLCPN-FPOVZHCZSA-N 0 3 418.965 4.299 20 0 HIADHN CN(C)[C@@H](CNCc1cc(Cl)ccc1OC[C@H]1CCCO1)c1cccc(F)c1 ZINC000439480275 864846533 /nfs/dbraw/zinc/84/65/33/864846533.db2.gz UFTCSCALKYOCNB-RTWAWAEBSA-N 0 3 406.929 4.429 20 0 HIADHN CN(Cc1ccco1)Cc1ccccc1CN[C@@H]1CCN(c2ccccc2Cl)C1=O ZINC000439592500 864916226 /nfs/dbraw/zinc/91/62/26/864916226.db2.gz DVZCHOQHRRSTQL-JOCHJYFZSA-N 0 3 423.944 4.460 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)NC[C@H]1CCC[C@H](C(F)(F)F)C1 ZINC000439627332 864953008 /nfs/dbraw/zinc/95/30/08/864953008.db2.gz DTKOKQWDTCEBFI-RDJZCZTQSA-N 0 3 403.464 4.268 20 0 HIADHN CCO[C@@H]1C[C@@H](N[C@H](C)C(=O)Nc2ccc(C)cc2Br)C12CCCC2 ZINC000439653968 864981266 /nfs/dbraw/zinc/98/12/66/864981266.db2.gz VZWXLKBYVMDAGD-ZTFGCOKTSA-N 0 3 409.368 4.412 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)CCc2ccccc2Br)CC1 ZINC000439731958 865063720 /nfs/dbraw/zinc/06/37/20/865063720.db2.gz OXIUUVGUZSFWMW-MRXNPFEDSA-N 0 3 416.363 4.119 20 0 HIADHN C[C@@H](Oc1ccc(Cl)c(Cl)c1)C(=O)NC1CCN([C@@H](C)c2ccncc2)CC1 ZINC000439764208 865090315 /nfs/dbraw/zinc/09/03/15/865090315.db2.gz JPIHXLXXZPMQRE-LSDHHAIUSA-N 0 3 422.356 4.498 20 0 HIADHN C[C@H](Oc1cc(Cl)cc(Cl)c1)C(=O)NC1CCN([C@@H](C)c2ccncc2)CC1 ZINC000439764987 865091024 /nfs/dbraw/zinc/09/10/24/865091024.db2.gz FZWILRWVJNDTAY-GJZGRUSLSA-N 0 3 422.356 4.498 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)CS[C@@H](C)c2nc3ccccc3[nH]2)CC1 ZINC000439764264 865091077 /nfs/dbraw/zinc/09/10/77/865091077.db2.gz HDRBOUUHNCTPOK-SJORKVTESA-N 0 3 423.586 4.094 20 0 HIADHN COc1ccc(OCc2ccccn2)c(CN2CCc3ccc(OC)cc3CC2)c1 ZINC000439767480 865092866 /nfs/dbraw/zinc/09/28/66/865092866.db2.gz CDCUBDIBKOFLDF-UHFFFAOYSA-N 0 3 404.510 4.279 20 0 HIADHN Cc1cc(Br)ccc1C(=O)NC1CCN([C@@H](C)c2ccncc2)CC1 ZINC000439772430 865097721 /nfs/dbraw/zinc/09/77/21/865097721.db2.gz VXLHQTWYMOSBCZ-HNNXBMFYSA-N 0 3 402.336 4.108 20 0 HIADHN Cc1cc(CCCC(=O)Nc2cccc(CN3CCC(C(N)=O)CC3)c2)c(C)s1 ZINC000439805538 865123159 /nfs/dbraw/zinc/12/31/59/865123159.db2.gz BRUUMUAWXYKDCO-UHFFFAOYSA-N 0 3 413.587 4.024 20 0 HIADHN C[C@@H](C(=O)Nc1cccc(CN2CCC(C(N)=O)CC2)c1)c1ccc2ccccc2c1 ZINC000439815592 865132657 /nfs/dbraw/zinc/13/26/57/865132657.db2.gz VQJUBWLELMVBMJ-GOSISDBHSA-N 0 3 415.537 4.279 20 0 HIADHN CCN(C(=O)Nc1cnn(CC)c1C(F)(F)F)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000439899772 865210673 /nfs/dbraw/zinc/21/06/73/865210673.db2.gz KPXFRWIUOOBZIH-MRXNPFEDSA-N 0 3 409.456 4.050 20 0 HIADHN CN(C)CCN(C(=O)NCc1cccc(NC(=O)Nc2ccccc2)c1)C1CCCC1 ZINC000468010180 881849381 /nfs/dbraw/zinc/84/93/81/881849381.db2.gz VBLVVRWDUBLNQD-UHFFFAOYSA-N 0 3 423.561 4.346 20 0 HIADHN CCCc1nc(C)c(NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)s1 ZINC000468012672 881851549 /nfs/dbraw/zinc/85/15/49/881851549.db2.gz XLQCLJLFUSTFBY-UHFFFAOYSA-N 0 3 404.502 4.331 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)Nc2cc(-c3ccnn3C)ccc2C)N(C)C)cc1 ZINC000439979891 865279060 /nfs/dbraw/zinc/27/90/60/865279060.db2.gz NEMIBCYHXOSSHP-HSZRJFAPSA-N 0 3 405.546 4.382 20 0 HIADHN CC(C)C1CCC(N2CCN(C(=O)CCc3nc(-c4ccsc4)no3)CC2)CC1 ZINC000439991405 865300050 /nfs/dbraw/zinc/30/00/50/865300050.db2.gz SGVREMDUEUPDRA-UHFFFAOYSA-N 0 3 416.591 4.090 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)NCc2cccc(-c3ccccn3)c2)C1 ZINC000440071981 865338014 /nfs/dbraw/zinc/33/80/14/865338014.db2.gz CHZYCLOXZGYLQQ-WMZHIEFXSA-N 0 3 400.526 4.383 20 0 HIADHN COc1ccc2c(c1)[C@@H](N[C@H](C)CC(=O)Nc1cccc(Br)c1)CCO2 ZINC000468026639 881860900 /nfs/dbraw/zinc/86/09/00/881860900.db2.gz PBCPGGYYDXIHLU-ACJLOTCBSA-N 0 3 419.319 4.288 20 0 HIADHN COc1cc([C@@H](C)NC(=O)N(CCN(C)C)C(C)C)ccc1OCc1ccccc1 ZINC000440077105 865342979 /nfs/dbraw/zinc/34/29/79/865342979.db2.gz UEOOIIYSUSIVIE-LJQANCHMSA-N 0 3 413.562 4.317 20 0 HIADHN CC(C)N(CCN(C)C)C(=O)NCc1ccccc1-c1ccc(Cn2ccnc2)cc1 ZINC000440087332 865350349 /nfs/dbraw/zinc/35/03/49/865350349.db2.gz KBQBAWHRXPQMSO-UHFFFAOYSA-N 0 3 419.573 4.080 20 0 HIADHN CC(C)N(CCN(C)C)C(=O)N[C@@H]1CCCc2nc(-c3ccc(F)cc3)sc21 ZINC000440091522 865353317 /nfs/dbraw/zinc/35/33/17/865353317.db2.gz XKGDLEKHHZOCSU-GOSISDBHSA-N 0 3 404.555 4.308 20 0 HIADHN CN(C)Cc1cccc(NC(=O)C(=O)N[C@H]2C[C@H](c3ccc(Cl)c(Cl)c3)C2)c1 ZINC000440092142 865354812 /nfs/dbraw/zinc/35/48/12/865354812.db2.gz NMYJMRLWHGPAAN-JCNLHEQBSA-N 0 3 420.340 4.056 20 0 HIADHN C[C@H](NCc1ccc(OCc2ccccc2F)cc1)c1ccc(-n2cnnn2)cc1 ZINC000468031066 881863658 /nfs/dbraw/zinc/86/36/58/881863658.db2.gz OHSDZUCBLOBUGM-KRWDZBQOSA-N 0 3 403.461 4.231 20 0 HIADHN COc1ccc2c(c1)[C@@H](N[C@@H](C)CC(=O)Nc1ccc(OC(F)(F)F)cc1)CCO2 ZINC000468033525 881864479 /nfs/dbraw/zinc/86/44/79/881864479.db2.gz LKTBBNDLHHZGBT-UGSOOPFHSA-N 0 3 424.419 4.424 20 0 HIADHN CC(C)[C@H](NC(=O)N1CCN(C2CCC(C(C)C)CC2)CC1)c1nc(C2CC2)no1 ZINC000440146839 865380141 /nfs/dbraw/zinc/38/01/41/865380141.db2.gz DFIJJPKUVHJNCO-UUKMXZOPSA-N 0 3 417.598 4.186 20 0 HIADHN CC(C)N(CCN(C)C)C(=O)NCc1cn(-c2ccccc2)nc1-c1ccccc1 ZINC000440200739 865434124 /nfs/dbraw/zinc/43/41/24/865434124.db2.gz GLAHVSWBTPRZGX-UHFFFAOYSA-N 0 3 405.546 4.021 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)Nc1cc(Br)c(C)cc1C ZINC000440227152 865462428 /nfs/dbraw/zinc/46/24/28/865462428.db2.gz LYZQIIHJVRQFOY-UHFFFAOYSA-N 0 3 418.335 4.013 20 0 HIADHN CC(=O)Nc1cc(NC(=O)N2CCN(C3CCC(C(C)C)CC3)CC2)ccc1F ZINC000440240035 865476046 /nfs/dbraw/zinc/47/60/46/865476046.db2.gz HEJKZSXHMFERSR-UHFFFAOYSA-N 0 3 404.530 4.148 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)NCc1cccc(-c2ccccn2)c1 ZINC000440256469 865503649 /nfs/dbraw/zinc/50/36/49/865503649.db2.gz CSHFZZDXWCZMRU-UHFFFAOYSA-N 0 3 406.505 4.161 20 0 HIADHN CC(C)n1cnnc1-c1ccccc1NC(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000440274849 865522161 /nfs/dbraw/zinc/52/21/61/865522161.db2.gz VDCHPHHTBLXXCS-UYAOXDASSA-N 0 3 418.545 4.483 20 0 HIADHN C[C@@H](CSCc1ccccc1)C(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000440278408 865528076 /nfs/dbraw/zinc/52/80/76/865528076.db2.gz DMVMGQKPLGOEBG-PCCBWWKXSA-N 0 3 418.647 4.294 20 0 HIADHN CC(C)n1cnnc1-c1ccccc1NC(=O)N(CCN(C)C)Cc1ccc(F)cc1 ZINC000440290281 865544019 /nfs/dbraw/zinc/54/40/19/865544019.db2.gz GGYHEPGRTAZBTD-UHFFFAOYSA-N 0 3 424.524 4.261 20 0 HIADHN CC(C)(CN[C@H](c1c[nH]nn1)c1ccc(F)cc1)c1ccccc1Br ZINC000468069140 881885980 /nfs/dbraw/zinc/88/59/80/881885980.db2.gz OCSWVNUXPLJZJV-SFHVURJKSA-N 0 3 403.299 4.363 20 0 HIADHN C[C@H](C(=O)NC[C@H](c1cccs1)N1CCC(C)CC1)n1ccc2ccccc2c1=O ZINC000468072771 881888112 /nfs/dbraw/zinc/88/81/12/881888112.db2.gz DTYYNIBAKNMHOI-WIYYLYMNSA-N 0 3 423.582 4.213 20 0 HIADHN Cc1cc(C(=O)CN(C)C2CCN(Cc3ccccc3)CC2)c(C)n1-c1nccs1 ZINC000440450854 865754088 /nfs/dbraw/zinc/75/40/88/865754088.db2.gz HTILPUVNSHCPDC-UHFFFAOYSA-N 0 3 422.598 4.330 20 0 HIADHN Cc1ccccc1-c1cc(C(=O)N[C@H]2C[C@H](C)N(C3CC3)C2)c2cnn(C(C)C)c2n1 ZINC000440913901 866008886 /nfs/dbraw/zinc/00/88/86/866008886.db2.gz MHOXIOKDWKXJMI-ROUUACIJSA-N 0 3 417.557 4.343 20 0 HIADHN Cc1ccc(NC(=O)CSc2ccccc2C(=O)N[C@@H]2C[C@H](C)N(C3CC3)C2)cc1 ZINC000440921933 866017910 /nfs/dbraw/zinc/01/79/10/866017910.db2.gz FHFKKOJTZFUOKD-PKOBYXMFSA-N 0 3 423.582 4.081 20 0 HIADHN C[C@H]1C[C@H](NC(=O)c2cnn(-c3cccc(C(F)(F)F)c3)c2C2CC2)CN1C1CC1 ZINC000440924995 866021588 /nfs/dbraw/zinc/02/15/88/866021588.db2.gz VXGIZSHXLCYWCJ-BBRMVZONSA-N 0 3 418.463 4.124 20 0 HIADHN Cc1cccc(-c2nnc(-c3ccc(C(=O)N[C@@H]4C[C@H](C)N(C5CC5)C4)cc3)o2)c1 ZINC000440925160 866022373 /nfs/dbraw/zinc/02/23/73/866022373.db2.gz LGIBKEGAKSXXDS-OXJNMPFZSA-N 0 3 402.498 4.067 20 0 HIADHN Cc1nn(C)c(C)c1NC(=O)CN1CCc2ccccc2[C@@H](c2ccccc2)[C@@H]1C ZINC000441055059 866132653 /nfs/dbraw/zinc/13/26/53/866132653.db2.gz AKKCOKYEDWKXKN-MHECFPHRSA-N 0 3 402.542 4.054 20 0 HIADHN O=C1c2ccccc2C(=O)N1CCCN1CCC[C@@H](c2nc(C(F)(F)F)cs2)C1 ZINC000441067375 866153990 /nfs/dbraw/zinc/15/39/90/866153990.db2.gz UJAZNOYWNIHEAE-CYBMUJFWSA-N 0 3 423.460 4.028 20 0 HIADHN C[C@H](NC(=O)N1CCC(C)(c2ccc(Br)cc2)CC1)C1=CCN(C)CC1 ZINC000441087701 866182135 /nfs/dbraw/zinc/18/21/35/866182135.db2.gz BUTDNAKALPKAMZ-INIZCTEOSA-N 0 3 420.395 4.163 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2ccc(Oc3nccc(C)n3)cc2)N(C)C)cc1 ZINC000441122199 866217062 /nfs/dbraw/zinc/21/70/62/866217062.db2.gz HEWIIFYCRNWKNG-NRFANRHFSA-N 0 3 405.502 4.310 20 0 HIADHN COc1cccc(OC)c1OC1CCN(CCOc2ccc(SC)cc2)CC1 ZINC000441195857 866266080 /nfs/dbraw/zinc/26/60/80/866266080.db2.gz FKQBWPAFHCTDBF-UHFFFAOYSA-N 0 3 403.544 4.348 20 0 HIADHN O=C(CN1CCC[C@H]([C@@H]2CCOC2)C1)NCCC(c1ccccc1)c1ccccc1 ZINC000441216817 866289184 /nfs/dbraw/zinc/28/91/84/866289184.db2.gz KTYACRVYCRJZFB-BJKOFHAPSA-N 0 3 406.570 4.073 20 0 HIADHN CN1CCN(CCNC(=O)Nc2ccc(-c3nc4ccccc4s3)cc2)CC1(C)C ZINC000441311034 866382298 /nfs/dbraw/zinc/38/22/98/866382298.db2.gz UPQWOQSGJKAEMP-UHFFFAOYSA-N 0 3 423.586 4.111 20 0 HIADHN C[C@H](NC(=O)CN1CC[C@@H](COCc2ccccc2)C1)c1ccc2c(c1)CCCC2 ZINC000441319809 866389443 /nfs/dbraw/zinc/38/94/43/866389443.db2.gz AMMREWXUOFDYSA-RBBKRZOGSA-N 0 3 406.570 4.281 20 0 HIADHN C[C@H](C1CC1)N(Cc1ccccc1)C(=O)CN1CC[C@H](COCc2ccccc2)C1 ZINC000441364510 866434114 /nfs/dbraw/zinc/43/41/14/866434114.db2.gz ZFWDQAJGSZMUIG-QPPBQGQZSA-N 0 3 406.570 4.352 20 0 HIADHN CN(C)[C@H](CNC(=O)N1CCC[C@@H]1c1nc2cc(Cl)ccc2[nH]1)c1ccccc1 ZINC000441417894 866494807 /nfs/dbraw/zinc/49/48/07/866494807.db2.gz HATFWQXSIRHVJN-WOJBJXKFSA-N 0 3 411.937 4.366 20 0 HIADHN O=c1nc(CN2CC[C@@H]3[C@H](CCC[N@@H+]3C3CC3)C2)[n-]c2scc(-c3ccco3)c21 ZINC000441421788 866498246 /nfs/dbraw/zinc/49/82/46/866498246.db2.gz OQLJQTCRKCEPKN-RHSMWYFYSA-N 0 3 410.543 4.106 20 0 HIADHN O=c1nc(CN2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)[n-]c2scc(-c3ccco3)c21 ZINC000441421788 866498250 /nfs/dbraw/zinc/49/82/50/866498250.db2.gz OQLJQTCRKCEPKN-RHSMWYFYSA-N 0 3 410.543 4.106 20 0 HIADHN C[C@@H](NC(=O)CN(C[C@H]1CCCO1)C1CCCC1)c1ccc(Br)cc1 ZINC000441444739 866522017 /nfs/dbraw/zinc/52/20/17/866522017.db2.gz UPJCEPDVJNVBOT-DNVCBOLYSA-N 0 3 409.368 4.050 20 0 HIADHN CCOc1ccc(Br)cc1CN(CCC(=O)N1CCC[C@@H]1C)C1CC1 ZINC000441501186 866582808 /nfs/dbraw/zinc/58/28/08/866582808.db2.gz KVXOBJCJIOEUED-HNNXBMFYSA-N 0 3 409.368 4.213 20 0 HIADHN CCC(C)(C)[C@H]1CCCN1CC(=O)N(C)CC(=O)Nc1ccccc1C(F)(F)F ZINC000441648583 866760604 /nfs/dbraw/zinc/76/06/04/866760604.db2.gz PTHFPKOWISOXLA-QGZVFWFLSA-N 0 3 413.484 4.003 20 0 HIADHN CC(C)Sc1c(Cl)cccc1NC(=O)C(=O)N[C@H](C)CN1CCC[C@@H](C)C1 ZINC000441739310 866828472 /nfs/dbraw/zinc/82/84/72/866828472.db2.gz QOGLHIGNGSXCGM-HUUCEWRRSA-N 0 3 411.999 4.016 20 0 HIADHN Cc1nc(C(C)C)sc1[C@@H](C)N(C)C(=O)C(=O)Nc1cc(CN(C)C)ccc1C ZINC000441771286 866846001 /nfs/dbraw/zinc/84/60/01/866846001.db2.gz VYHYTDKLITZWBQ-MRXNPFEDSA-N 0 3 416.591 4.103 20 0 HIADHN COCc1nc(C(=O)NC[C@@H](c2ccc(C)cc2)N(C)C)c(-c2ccccc2)s1 ZINC000441818602 866879128 /nfs/dbraw/zinc/87/91/28/866879128.db2.gz UXWUVUYZVVOAER-IBGZPJMESA-N 0 3 409.555 4.298 20 0 HIADHN CC1CCN([C@H](CNC(=O)NCc2nnc(C(C)(C)C)s2)c2cccs2)CC1 ZINC000468160077 882027392 /nfs/dbraw/zinc/02/73/92/882027392.db2.gz PCPXNQBPLIIGMS-OAHLLOKOSA-N 0 3 421.636 4.170 20 0 HIADHN CC[C@H]1CCCCN1CCNC(=O)C(=O)Nc1cccc(Cl)c1SC(C)C ZINC000441887765 866953034 /nfs/dbraw/zinc/95/30/34/866953034.db2.gz KLMSLSVLKIJPBE-HNNXBMFYSA-N 0 3 411.999 4.160 20 0 HIADHN CCC(CC)(CC(=O)OC)NCc1ccnc(-c2ccc(Br)cc2)n1 ZINC000441907929 866971507 /nfs/dbraw/zinc/97/15/07/866971507.db2.gz QLKKJAXKDWABQW-UHFFFAOYSA-N 0 3 406.324 4.118 20 0 HIADHN CN(C)Cc1cccc(NC(=O)C(=O)N2CCCCC[C@@H]2/C=C\c2cccs2)c1 ZINC000442490740 867473692 /nfs/dbraw/zinc/47/36/92/867473692.db2.gz ITHRCJNDZGHOEO-GHYICZDASA-N 0 3 411.571 4.233 20 0 HIADHN CC(C)(CC(=O)Nc1cccc(CN2CCC(O)CC2)c1)CC(=O)c1ccccc1 ZINC000442688004 867622925 /nfs/dbraw/zinc/62/29/25/867622925.db2.gz OEGZOZHRJHYPKZ-UHFFFAOYSA-N 0 3 408.542 4.271 20 0 HIADHN C[C@H](NCCc1ccc2[nH]ccc2c1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000442823844 867687808 /nfs/dbraw/zinc/68/78/08/867687808.db2.gz RUZDELVYPCWUJV-NSHDSACASA-N 0 3 412.342 4.015 20 0 HIADHN CCO[C@@H]1C[C@H](NCc2nc(COC)sc2-c2ccccc2)C12CCOCC2 ZINC000442856516 867701079 /nfs/dbraw/zinc/70/10/79/867701079.db2.gz LPOUDRLSBNWCIA-RBUKOAKNSA-N 0 3 402.560 4.020 20 0 HIADHN COCCC[C@@H](NCC(=O)Nc1cccc(Br)c1)c1ccc(F)cc1 ZINC000442856654 867701195 /nfs/dbraw/zinc/70/11/95/867701195.db2.gz OOLWGUQVADOIDK-GOSISDBHSA-N 0 3 409.299 4.284 20 0 HIADHN CCO[C@@H]1C[C@@H](NCc2nc(COC)sc2-c2ccccc2)C12CCOCC2 ZINC000442856518 867701233 /nfs/dbraw/zinc/70/12/33/867701233.db2.gz LPOUDRLSBNWCIA-RTBURBONSA-N 0 3 402.560 4.020 20 0 HIADHN CC(C)OCCCN(C)Cc1cccc(Br)c1OC[C@H]1CCCO1 ZINC000442885461 867717430 /nfs/dbraw/zinc/71/74/30/867717430.db2.gz NHVSAABVIWPRDO-QGZVFWFLSA-N 0 3 400.357 4.254 20 0 HIADHN CSc1cccc([C@H](NCCN2CCN(C)C(C)(C)C2)c2cc(F)ccc2F)c1 ZINC000442891017 867722866 /nfs/dbraw/zinc/72/28/66/867722866.db2.gz QTJVWOJAOGZFCJ-QFIPXVFZSA-N 0 3 419.585 4.392 20 0 HIADHN CCN(CC(=O)Nc1cccc(CN2CCSCC2)c1)Cc1c[nH]c2ccccc12 ZINC000442890996 867723254 /nfs/dbraw/zinc/72/32/54/867723254.db2.gz QLXGLJNCGSLPQA-UHFFFAOYSA-N 0 3 422.598 4.177 20 0 HIADHN COc1cc(NC(C)=O)ccc1[C@H](C)NCCN1CCc2c(Cl)cccc2C1 ZINC000443109935 867822903 /nfs/dbraw/zinc/82/29/03/867822903.db2.gz QPDKFGMZFHZUGU-HNNXBMFYSA-N 0 3 401.938 4.016 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(NS(C)(=O)=O)cc1)c1ccc(Br)s1 ZINC000443196646 867870952 /nfs/dbraw/zinc/87/09/52/867870952.db2.gz OCIXPTFCUCZFKC-WDEREUQCSA-N 0 3 403.367 4.294 20 0 HIADHN C[C@@H](CC(=O)Nc1ccc(NC(=O)C2CC2)cc1)N[C@H]1CCOc2c(F)cccc21 ZINC000443220104 867880280 /nfs/dbraw/zinc/88/02/80/867880280.db2.gz HUXOQXQMOMOSAK-XOBRGWDASA-N 0 3 411.477 4.005 20 0 HIADHN Cc1cc(CCCC(=O)NC2CCN(CCOc3ccc(F)cc3)CC2)c(C)s1 ZINC000443343527 867915048 /nfs/dbraw/zinc/91/50/48/867915048.db2.gz MLEHKDCKAYSYBM-UHFFFAOYSA-N 0 3 418.578 4.486 20 0 HIADHN O=C(COc1cccc2ccccc21)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000443345769 867915888 /nfs/dbraw/zinc/91/58/88/867915888.db2.gz NNEODDGUEPXKKO-UHFFFAOYSA-N 0 3 422.500 4.017 20 0 HIADHN O=C(NCCCCN1CCN(Cc2ccccc2)CC1)Nc1ccc2ccoc2c1 ZINC000443371787 867934736 /nfs/dbraw/zinc/93/47/36/867934736.db2.gz SPYFRDWQGMRILD-UHFFFAOYSA-N 0 3 406.530 4.152 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)Cc3ccc(Cl)c(F)c3)CC2)c1 ZINC000468250651 882155443 /nfs/dbraw/zinc/15/54/43/882155443.db2.gz LGZBWOJETQZPCM-UHFFFAOYSA-N 0 3 417.956 4.049 20 0 HIADHN CC1(C)CN(C(=O)Nc2ccc(CCN3CCSCC3)cc2)CC2(CCCC2)O1 ZINC000443584384 868139368 /nfs/dbraw/zinc/13/93/68/868139368.db2.gz STQPLLJMRDIWAV-UHFFFAOYSA-N 0 3 417.619 4.233 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N3CC=C(c4c[nH]c5ccccc54)CC3)cc2)CC1 ZINC000468251670 882157458 /nfs/dbraw/zinc/15/74/58/882157458.db2.gz JUYGSKANQXPOPU-UHFFFAOYSA-N 0 3 414.553 4.239 20 0 HIADHN CCCCNC(=O)[C@@H]1CCCN(Cc2cc(C)nc(-c3ccc(Cl)cc3)n2)C1 ZINC000443635132 868213849 /nfs/dbraw/zinc/21/38/49/868213849.db2.gz VFPSHBHTAHJUAE-GOSISDBHSA-N 0 3 400.954 4.234 20 0 HIADHN O=c1cc(CN2CCC[C@@H](c3nc4ccc(F)cc4o3)C2)nc2ccc(Cl)cn12 ZINC000443636579 868218358 /nfs/dbraw/zinc/21/83/58/868218358.db2.gz CBLPRPUEHVCUPL-CYBMUJFWSA-N 0 3 412.852 4.008 20 0 HIADHN O=c1[nH]c(CCN2CCN(C3c4ccccc4-c4ccccc43)CC2)nc2ccccc21 ZINC000443660831 868267271 /nfs/dbraw/zinc/26/72/71/868267271.db2.gz RNOABPUBNIDUEM-UHFFFAOYSA-N 0 3 422.532 4.266 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)c2csc(-c3ccccc3Cl)n2)C[C@H](C)O1 ZINC000443671785 868278233 /nfs/dbraw/zinc/27/82/33/868278233.db2.gz DLSSDXADGKCKBK-GASCZTMLSA-N 0 3 407.967 4.083 20 0 HIADHN CCN(C(=O)C(=O)Nc1ccc2ccoc2c1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000443694895 868293515 /nfs/dbraw/zinc/29/35/15/868293515.db2.gz URSRKJFCSCXTIN-DYESRHJHSA-N 0 3 405.498 4.055 20 0 HIADHN Cc1ccccc1[C@H]([C@@H](C)NC(=O)C(=O)Nc1cc(Cl)cc(Cl)c1)N(C)C ZINC000443840914 868371040 /nfs/dbraw/zinc/37/10/40/868371040.db2.gz JLMOEJJBCMSNKO-ACJLOTCBSA-N 0 3 408.329 4.048 20 0 HIADHN COc1ccc(-c2ncc(C(=O)N3C[C@H]4CCCN4Cc4ccccc43)s2)cc1 ZINC000443857565 868390216 /nfs/dbraw/zinc/39/02/16/868390216.db2.gz TWWKBSRTEUCVFY-GOSISDBHSA-N 0 3 405.523 4.444 20 0 HIADHN COC(=O)c1ccccc1-c1ccccc1C(=O)NCc1ccccc1CN(C)C ZINC000443926953 868464175 /nfs/dbraw/zinc/46/41/75/868464175.db2.gz YPSJNVVOAHNSNL-UHFFFAOYSA-N 0 3 402.494 4.132 20 0 HIADHN COc1cccc(N2CC[C@@H](NCc3ccc(OC)cc3OCc3cccnc3)C2)c1 ZINC000443968679 868499418 /nfs/dbraw/zinc/49/94/18/868499418.db2.gz OCAYXXOSJKBTOT-OAQYLSRUSA-N 0 3 419.525 4.046 20 0 HIADHN COc1ccc(CNCCn2c(C)nc3ccccc32)c(OCc2cccnc2)c1 ZINC000443983577 868508981 /nfs/dbraw/zinc/50/89/81/868508981.db2.gz WAEIMQICFZDVMB-UHFFFAOYSA-N 0 3 402.498 4.117 20 0 HIADHN CC[C@@H](C(=O)N1CCC(NCc2cnc(C(F)(F)F)s2)CC1)c1ccccc1 ZINC000443993189 868514284 /nfs/dbraw/zinc/51/42/84/868514284.db2.gz PGMWBUPLTNHQBJ-QGZVFWFLSA-N 0 3 411.493 4.436 20 0 HIADHN COc1ccc(C2(NCc3cc(Cl)c4c(c3)OCCCO4)CCOCC2)cc1F ZINC000444018503 868541841 /nfs/dbraw/zinc/54/18/41/868541841.db2.gz VIGFQSFUEMBSDE-UHFFFAOYSA-N 0 3 421.896 4.445 20 0 HIADHN C[C@@H]1CCN(C)CCN1C(=O)N[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 ZINC000444021211 868545972 /nfs/dbraw/zinc/54/59/72/868545972.db2.gz LMMPFEKBYVITST-IUODEOHRSA-N 0 3 411.390 4.435 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)N[C@@H](C)c2ccc(Br)s2)o1 ZINC000444094434 868612931 /nfs/dbraw/zinc/61/29/31/868612931.db2.gz AQZYZNRBKTVOTI-ZDUSSCGKSA-N 0 3 414.369 4.246 20 0 HIADHN C[C@H](NC(=O)N1CCCN(Cc2ccccc2)CC1)c1ccc(Br)s1 ZINC000444105692 868621144 /nfs/dbraw/zinc/62/11/44/868621144.db2.gz ZSWIPHYNOLJCGN-HNNXBMFYSA-N 0 3 422.392 4.489 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)c1cc(Oc2ccccc2)ccn1 ZINC000444456141 868834678 /nfs/dbraw/zinc/83/46/78/868834678.db2.gz VJVLLZFHUAPZMO-UHFFFAOYSA-N 0 3 403.482 4.083 20 0 HIADHN C[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000444456166 868835020 /nfs/dbraw/zinc/83/50/20/868835020.db2.gz VRYSWQOIEUSVGQ-MRXNPFEDSA-N 0 3 420.475 4.479 20 0 HIADHN CNC(=O)c1cccc(NC(=O)N2CCN(Cc3ccccc3)C3(CCCCC3)C2)c1 ZINC000444496629 868858156 /nfs/dbraw/zinc/85/81/56/868858156.db2.gz JPSDKEDMMCXTSE-UHFFFAOYSA-N 0 3 420.557 4.099 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)NC(=O)NC[C@H](c2ccc(C)cc2)N(C)C)cc1 ZINC000444581692 868889423 /nfs/dbraw/zinc/88/94/23/868889423.db2.gz HFJZDJQPCHSRAZ-FDDCHVKYSA-N 0 3 405.546 4.152 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)NC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000444585224 868891224 /nfs/dbraw/zinc/89/12/24/868891224.db2.gz YBCZIVAYIBLDLS-CVDCTZTESA-N 0 3 417.557 4.206 20 0 HIADHN CC(C)(C)[C@@H](CO)NCC(=O)Nc1nc(-c2ccc(Cl)c(Cl)c2)cs1 ZINC000444668679 868946491 /nfs/dbraw/zinc/94/64/91/868946491.db2.gz CUJHMABTUXIWFZ-CQSZACIVSA-N 0 3 402.347 4.052 20 0 HIADHN Clc1ccc(C[C@H](NCc2nnnn2CC2CCOCC2)C2CCCCC2)cc1 ZINC000444683286 868957073 /nfs/dbraw/zinc/95/70/73/868957073.db2.gz FIDMUGJTYLZSNE-NRFANRHFSA-N 0 3 417.985 4.034 20 0 HIADHN CC(C)(C)[C@@H](CO)NCC(=O)Nc1nc(-c2ccc(Cl)cc2Cl)cs1 ZINC000444685604 868958818 /nfs/dbraw/zinc/95/88/18/868958818.db2.gz SVDXZWZDNHYMJN-CQSZACIVSA-N 0 3 402.347 4.052 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)N([C@@H](C)c2ccc3ccccc3c2)C2CC2)CC1 ZINC000444717865 868973338 /nfs/dbraw/zinc/97/33/38/868973338.db2.gz TZRPYXDEZSLNBE-SFTDATJTSA-N 0 3 422.617 4.348 20 0 HIADHN C[C@@H](NCc1ccc(S(=O)(=O)N(C)C)cc1)c1cccc(OCc2ccccc2)c1 ZINC000444718057 868973911 /nfs/dbraw/zinc/97/39/11/868973911.db2.gz NXKYLWVCKJIYOO-LJQANCHMSA-N 0 3 424.566 4.367 20 0 HIADHN COCCN1CCC[C@H]1CNC(=O)N([C@@H](C)c1cccc(C(F)(F)F)c1)C1CC1 ZINC000444718663 868973930 /nfs/dbraw/zinc/97/39/30/868973930.db2.gz WHQJEHHYOWZHGL-KXBFYZLASA-N 0 3 413.484 4.051 20 0 HIADHN O=C(CCN1CCC[C@@H]([C@@H](O)C(F)(F)F)C1)Nc1ccc(Oc2ccccc2)cc1 ZINC000444724741 868976209 /nfs/dbraw/zinc/97/62/09/868976209.db2.gz LCSPPWPBKVFHOV-IIBYNOLFSA-N 0 3 422.447 4.443 20 0 HIADHN Cc1cccc2nc(C3CCN(C[C@H](O)COc4cccc5[nH]ccc54)CC3)oc21 ZINC000444766043 868992057 /nfs/dbraw/zinc/99/20/57/868992057.db2.gz KNKIEOXHAWVCTK-SFHVURJKSA-N 0 3 405.498 4.237 20 0 HIADHN COc1ccc(C2(NCc3ccc(-n4nc(C)cc4C)cc3)CCOCC2)cc1F ZINC000444814317 869026649 /nfs/dbraw/zinc/02/66/49/869026649.db2.gz DGDXPEFPMNLEQW-UHFFFAOYSA-N 0 3 409.505 4.432 20 0 HIADHN CC1(C)CCCN(CCNC(=O)Nc2cnn(-c3ccccc3)c2C(F)(F)F)C1 ZINC000444951818 869125754 /nfs/dbraw/zinc/12/57/54/869125754.db2.gz QNKFYPFGPUBQIQ-UHFFFAOYSA-N 0 3 409.456 4.135 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)C(=O)Nc1cccc(C(C)(F)F)c1 ZINC000445111302 869222811 /nfs/dbraw/zinc/22/28/11/869222811.db2.gz BCVVHBVSSPTNBP-HXUWFJFHSA-N 0 3 417.500 4.010 20 0 HIADHN CCc1noc(CC)c1CC(=O)N(c1cccc(SC)c1)C1CCN(C)CC1 ZINC000445802673 869830843 /nfs/dbraw/zinc/83/08/43/869830843.db2.gz NSAFQRMROHVGEB-UHFFFAOYSA-N 0 3 401.576 4.191 20 0 HIADHN Cc1ccc(S(=O)(=O)N[C@H](CN[C@H](c2cccnc2)C2CC2)c2ccccc2)cc1 ZINC000445806414 869832793 /nfs/dbraw/zinc/83/27/93/869832793.db2.gz VOUMIUHHKLZQET-RPWUZVMVSA-N 0 3 421.566 4.151 20 0 HIADHN O=C1NC(CC(F)(F)F)C(=O)N1c1ccc(OC(F)F)c(Cc2ccccc2)c1 ZINC000445878038 869869081 /nfs/dbraw/zinc/86/90/81/869869081.db2.gz QSJWIZJUEOHOEN-CQSZACIVSA-N 0 3 414.330 4.256 20 0 HIADHN CC(C)[C@H](CC(F)(F)F)NCC(=O)N[C@H](C)c1ccc(OC(F)(F)F)cc1 ZINC000445898408 869877105 /nfs/dbraw/zinc/87/71/05/869877105.db2.gz RBLJDMIZYOGOCH-RISCZKNCSA-N 0 3 400.363 4.329 20 0 HIADHN C[C@H]1C[C@H](NC(=O)CCC(=O)c2ccc(F)c(F)c2)CCN1Cc1ccccc1 ZINC000445945501 869906014 /nfs/dbraw/zinc/90/60/14/869906014.db2.gz ZDSKXAGVNJFIRT-QFBILLFUSA-N 0 3 400.469 4.097 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3cc(F)cc(C(F)(F)F)c3)CC2)C[C@H](C)O1 ZINC000445946383 869907691 /nfs/dbraw/zinc/90/76/91/869907691.db2.gz JGCVSJPUZFXVKJ-GASCZTMLSA-N 0 3 416.459 4.196 20 0 HIADHN CC(C)Oc1ccc2ccccc2c1CNC(=O)N(CCN(C)C)Cc1ccco1 ZINC000468442569 882381872 /nfs/dbraw/zinc/38/18/72/882381872.db2.gz KZGSSYLKLYITNG-UHFFFAOYSA-N 0 3 409.530 4.493 20 0 HIADHN CN1CCCC(C)(C)[C@@H]1CNC(=O)c1ccccc1SCc1cn2ccccc2n1 ZINC000468456742 882394565 /nfs/dbraw/zinc/39/45/65/882394565.db2.gz IQBCMBBBEYFXMI-NRFANRHFSA-N 0 3 422.598 4.477 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)CCc1ncc(-c2ccccc2Cl)o1 ZINC000446419332 870329945 /nfs/dbraw/zinc/32/99/45/870329945.db2.gz NMJLFPWWQOXMCB-UHFFFAOYSA-N 0 3 401.894 4.111 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)c1ccc(-c2noc(CC(C)(C)C)n2)cc1 ZINC000446441982 870361489 /nfs/dbraw/zinc/36/14/89/870361489.db2.gz HLEJMBQUCYSPRD-UHFFFAOYSA-N 0 3 410.518 4.122 20 0 HIADHN CC(C)CN(CCN(C)C)C(=O)NCc1nc2c(s1)C[C@H](c1ccccc1)CC2 ZINC000468464913 882407930 /nfs/dbraw/zinc/40/79/30/882407930.db2.gz DJQSJZJAKZSEBH-LJQANCHMSA-N 0 3 414.619 4.145 20 0 HIADHN C[C@H](NC(=O)N(CCN(C)C)Cc1ccc(C(F)(F)F)cc1)c1cccc(O)c1 ZINC000446758294 870670460 /nfs/dbraw/zinc/67/04/60/870670460.db2.gz HGLLPVAAPBLEJS-HNNXBMFYSA-N 0 3 409.452 4.245 20 0 HIADHN C[C@H](NCCC(=O)N1CCc2sccc2C1)c1ccc(Br)cc1F ZINC000446834533 870751643 /nfs/dbraw/zinc/75/16/43/870751643.db2.gz KUFWTMWJJQIRAF-LBPRGKRZSA-N 0 3 411.340 4.275 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1ccc(OC(F)F)c2ncccc12 ZINC000446836152 870753424 /nfs/dbraw/zinc/75/34/24/870753424.db2.gz SFNCHYQYPLBGTD-UHFFFAOYSA-N 0 3 404.417 4.025 20 0 HIADHN Cc1ccn2c(CNC3(c4cccc(OC(F)(F)F)c4)CCOCC3)cnc2c1 ZINC000446840551 870758411 /nfs/dbraw/zinc/75/84/11/870758411.db2.gz GNLIYEYUICYUIN-UHFFFAOYSA-N 0 3 405.420 4.337 20 0 HIADHN COc1ccc2c(c1)[C@H]([NH2+]C1CCN(C(=O)c3ccccc3[O-])CC1)CCCS2 ZINC000446841154 870759976 /nfs/dbraw/zinc/75/99/76/870759976.db2.gz MOQBBKUJORAWHA-HXUWFJFHSA-N 0 3 412.555 4.222 20 0 HIADHN Cc1cccc(-n2ncc(C(=O)NC[C@H]3N(C)CCCC3(C)C)c2C(F)(F)F)c1 ZINC000468480850 882447655 /nfs/dbraw/zinc/44/76/55/882447655.db2.gz NMWWYYNBPRXFOT-QGZVFWFLSA-N 0 3 408.468 4.050 20 0 HIADHN COc1ccc(Br)cc1CN[C@@H](CCn1cncn1)c1ccc(C)cc1 ZINC000446919092 870834352 /nfs/dbraw/zinc/83/43/52/870834352.db2.gz DLSMVURBVBAPJK-IBGZPJMESA-N 0 3 415.335 4.279 20 0 HIADHN COc1ccc([C@H](CCn2cncn2)NCc2cc(C)ccc2OC(F)F)cc1 ZINC000446929051 870841030 /nfs/dbraw/zinc/84/10/30/870841030.db2.gz ORJAJPAEVIADAZ-IBGZPJMESA-N 0 3 402.445 4.118 20 0 HIADHN COc1ccc([C@@H](CCn2cncn2)NCc2cc(C)ccc2OC(F)F)cc1 ZINC000446929052 870841236 /nfs/dbraw/zinc/84/12/36/870841236.db2.gz ORJAJPAEVIADAZ-LJQANCHMSA-N 0 3 402.445 4.118 20 0 HIADHN Cc1nc(-c2ccc(C)c(NC(=O)N[C@H](CN3CCCC3)c3ccccc3)c2)n[nH]1 ZINC000447060465 870939566 /nfs/dbraw/zinc/93/95/66/870939566.db2.gz PCSQWENTOXVPII-OAQYLSRUSA-N 0 3 404.518 4.047 20 0 HIADHN CC(C)Oc1cc(Br)cc(NC(=O)N(CCN(C)C)Cc2ccco2)c1 ZINC000447064518 870945242 /nfs/dbraw/zinc/94/52/42/870945242.db2.gz YDZWHUUMAXOKTD-UHFFFAOYSA-N 0 3 424.339 4.425 20 0 HIADHN COC1(CO)CCN(Cc2cn(-c3ccccc3)nc2-c2ccc(C)c(C)c2)CC1 ZINC000447066276 870946508 /nfs/dbraw/zinc/94/65/08/870946508.db2.gz JNYLEHBZYXZQRM-UHFFFAOYSA-N 0 3 405.542 4.129 20 0 HIADHN O=C(Nc1cnn(-c2ccccc2F)c1)N1CCCN(CCCc2ccccc2)CC1 ZINC000447185970 871077561 /nfs/dbraw/zinc/07/75/61/871077561.db2.gz UBHBHMMFONZEEO-UHFFFAOYSA-N 0 3 421.520 4.184 20 0 HIADHN Cc1ccc([C@H](C)NC(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)cc1F ZINC000447224796 871110688 /nfs/dbraw/zinc/11/06/88/871110688.db2.gz YGCORLOBRDLVPM-QRVBRYPASA-N 0 3 405.558 4.116 20 0 HIADHN CCC[C@@H](NC(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1)c1ccc(F)cc1F ZINC000468499944 882489410 /nfs/dbraw/zinc/48/94/10/882489410.db2.gz BULPZEUYUDBDGM-HYFFOGBASA-N 0 3 423.548 4.337 20 0 HIADHN COc1cccc(C[C@H](NCc2ccc(C)c(S(C)(=O)=O)c2)c2ccccc2)c1 ZINC000447567474 871465980 /nfs/dbraw/zinc/46/59/80/871465980.db2.gz BSKHXFRKMPUCCF-QHCPKHFHSA-N 0 3 409.551 4.481 20 0 HIADHN Cc1ccc(CN[C@H]2C[C@H](C)c3c2cccc3Br)cc1S(C)(=O)=O ZINC000447582730 871486425 /nfs/dbraw/zinc/48/64/25/871486425.db2.gz YBMCFTDMMATGKA-GUYCJALGSA-N 0 3 408.361 4.499 20 0 HIADHN CCOC(=O)c1oc2c(c1C)[C@H](N[C@@H]1CCN(c3ncccc3Cl)C1)CCC2 ZINC000447587459 871494729 /nfs/dbraw/zinc/49/47/29/871494729.db2.gz QKIWYXHOIOLJJG-GDBMZVCRSA-N 0 3 403.910 4.059 20 0 HIADHN FC(F)C(F)(F)COCCN[C@@H]1CCCOc2ccc(Br)cc21 ZINC000447599869 871508803 /nfs/dbraw/zinc/50/88/03/871508803.db2.gz ZADNAZOBEQWLKG-GFCCVEGCSA-N 0 3 400.210 4.169 20 0 HIADHN Fc1ccc(C[C@@H](NCc2cnc(N3CCOCC3)c(F)c2)c2ccccc2)cc1 ZINC000447602311 871510780 /nfs/dbraw/zinc/51/07/80/871510780.db2.gz SBXNIVKWOWAFIH-HSZRJFAPSA-N 0 3 409.480 4.270 20 0 HIADHN Brc1ccc(N2CC[C@H](CNCc3nc(-c4ccccc4)c[nH]3)C2)cc1 ZINC000447841089 871765250 /nfs/dbraw/zinc/76/52/50/871765250.db2.gz WIPYQVPUJSGFJZ-MRXNPFEDSA-N 0 3 411.347 4.455 20 0 HIADHN FC(F)(F)c1ccc(CN2CC[C@H](NCc3nc(-c4ccccc4)c[nH]3)C2)cc1 ZINC000447850924 871771042 /nfs/dbraw/zinc/77/10/42/871771042.db2.gz PKGPFHQGGLSLAV-IBGZPJMESA-N 0 3 400.448 4.460 20 0 HIADHN Cc1nn(C)c(CNCC2(c3ccc(C(F)(F)F)cc3)CC2)c1Br ZINC000447899898 871809706 /nfs/dbraw/zinc/80/97/06/871809706.db2.gz XYLQYQLDVKNDHF-UHFFFAOYSA-N 0 3 402.258 4.331 20 0 HIADHN Cc1nn(C)c(CNC[C@@H]2CCN(c3cc(Cl)ccc3C)C2)c1Br ZINC000447926799 871815738 /nfs/dbraw/zinc/81/57/38/871815738.db2.gz CJOBUORCVAZZHJ-AWEZNQCLSA-N 0 3 411.775 4.069 20 0 HIADHN CO[C@@H]1CCOc2c(NC(=O)N(CCN(C)C)Cc3ccc(F)cc3F)cccc21 ZINC000448047214 871878880 /nfs/dbraw/zinc/87/88/80/871878880.db2.gz DKILLVQEPXKNRJ-HXUWFJFHSA-N 0 3 419.472 4.031 20 0 HIADHN CO[C@@H]1CCOc2c(NC(=O)NC[C@@H](C(C)C)N3CCc4ccccc4C3)cccc21 ZINC000448053600 871883905 /nfs/dbraw/zinc/88/39/05/871883905.db2.gz ZAXYWHZLEMQYSU-XZOQPEGZSA-N 0 3 423.557 4.361 20 0 HIADHN CC[C@@H]1C[C@@H](C)CN1CC(=O)N(Cc1nnc(-c2ccccc2Cl)o1)C1CC1 ZINC000448093557 871933020 /nfs/dbraw/zinc/93/30/20/871933020.db2.gz AOHZKOWLNKFRCD-HUUCEWRRSA-N 0 3 402.926 4.001 20 0 HIADHN O=S(=O)(c1c(Cl)ccc2ccccc21)N1CC[C@@H]2[C@@H](CCCN2C2CC2)C1 ZINC000448163628 872041234 /nfs/dbraw/zinc/04/12/34/872041234.db2.gz IETWPOPMOOSIPA-OXJNMPFZSA-N 0 3 404.963 4.131 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)NCc2ccc(-c3ccco3)cc2F)CC1 ZINC000448250031 872167608 /nfs/dbraw/zinc/16/76/08/872167608.db2.gz RHMNMDYJGHBVTK-UHFFFAOYSA-N 0 3 411.477 4.485 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)Nc1ccc(Br)c(Cl)c1 ZINC000448332221 872271501 /nfs/dbraw/zinc/27/15/01/872271501.db2.gz MDGONYPPEVNBDF-UHFFFAOYSA-N 0 3 411.731 4.093 20 0 HIADHN c1cc(CNCc2ccccc2-c2ccc(Cn3cncn3)cc2)n(-c2ccccc2)n1 ZINC000448334771 872273287 /nfs/dbraw/zinc/27/32/87/872273287.db2.gz KOGWVIBFFGANFE-UHFFFAOYSA-N 0 3 420.520 4.469 20 0 HIADHN c1cc(CN2C[C@H]3CCC[C@@]3(c3nc(-c4ccccc4)no3)C2)n(-c2ccccc2)n1 ZINC000448366753 872316975 /nfs/dbraw/zinc/31/69/75/872316975.db2.gz NSGZMLFTOWCETJ-CJFMBICVSA-N 0 3 411.509 4.476 20 0 HIADHN COCCN(Cc1cnn(Cc2ccc(C(F)(F)F)cc2)c1)[C@@H]1CCCSC1 ZINC000448368011 872318128 /nfs/dbraw/zinc/31/81/28/872318128.db2.gz UBQYERNSOZREBZ-LJQANCHMSA-N 0 3 413.509 4.294 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CC(C)(CCOC)C1)c1ccc(C(F)(F)F)cc1 ZINC000460107664 872571653 /nfs/dbraw/zinc/57/16/53/872571653.db2.gz PNRHPBMPLZUCCK-SFHVURJKSA-N 0 3 415.500 4.156 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3nc(-c4ccc(OC)cc4)cs3)cc2)CC1 ZINC000468571176 882633970 /nfs/dbraw/zinc/63/39/70/882633970.db2.gz WXOASWSDAWKQNP-UHFFFAOYSA-N 0 3 422.554 4.213 20 0 HIADHN O=C(NC[C@H]1CCCN1Cc1ccccc1)N1CCCC[C@H]1c1nnc(C2CCC2)o1 ZINC000460342214 872954754 /nfs/dbraw/zinc/95/47/54/872954754.db2.gz YLGCTVCXOQIADS-RTWAWAEBSA-N 0 3 423.561 4.238 20 0 HIADHN O=C(c1cccc(CN2CCCC2)c1)N(CCCOc1ccccc1)C1CCOCC1 ZINC000468597552 882692611 /nfs/dbraw/zinc/69/26/11/882692611.db2.gz KJXBRIUDISTFJC-UHFFFAOYSA-N 0 3 422.569 4.373 20 0 HIADHN CCCN(CCN1CCN(CC)CC1)C(=O)N[C@@H](c1cccc(C)c1)C(C)(C)C ZINC000460497205 873183563 /nfs/dbraw/zinc/18/35/63/873183563.db2.gz MEVLVEBZEGIVIR-QFIPXVFZSA-N 0 3 402.627 4.141 20 0 HIADHN CCC(C)(C)CNC(=O)N(Cc1ccccc1Br)C1CCN(C)CC1 ZINC000460669219 873415332 /nfs/dbraw/zinc/41/53/32/873415332.db2.gz MOMNEHZQNKYIRW-UHFFFAOYSA-N 0 3 410.400 4.491 20 0 HIADHN O=C(NCCN1CCCCCC1)c1ccc(Oc2cccc(Cl)c2Cl)nn1 ZINC000460765567 873608984 /nfs/dbraw/zinc/60/89/84/873608984.db2.gz AOKFEVHUDUXNEY-UHFFFAOYSA-N 0 3 409.317 4.182 20 0 HIADHN C[C@@H](Oc1cccc(Br)c1)C(=O)NC[C@H](c1ccccc1)N1CCCC1 ZINC000460804704 873678921 /nfs/dbraw/zinc/67/89/21/873678921.db2.gz JUYLAUDIVZVFQM-OXQOHEQNSA-N 0 3 417.347 4.170 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cc(C2CC2)n(C)n1)c1ccc(C(F)(F)F)cc1 ZINC000460854560 873753555 /nfs/dbraw/zinc/75/35/55/873753555.db2.gz ITGYFMJDOGUACH-LJQANCHMSA-N 0 3 408.468 4.129 20 0 HIADHN O=C(CC1(N2CCOCC2)CCCC1)N1CC=C(c2cccc3ccccc32)CC1 ZINC000468639966 882773145 /nfs/dbraw/zinc/77/31/45/882773145.db2.gz VGKOUTPTQHAUOT-UHFFFAOYSA-N 0 3 404.554 4.491 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)c2c[nH]cc2-c2ccc3c(c2)OCCO3)C1 ZINC000460973800 873868774 /nfs/dbraw/zinc/86/87/74/873868774.db2.gz OSSIVCWIKRKKQN-YLJYHZDGSA-N 0 3 417.509 4.018 20 0 HIADHN CC[C@H](C(=O)Nc1ccc(C(=O)N(C)[C@@H]2CCCN(C)C2)cc1)c1ccc(F)cc1 ZINC000461010531 873883468 /nfs/dbraw/zinc/88/34/68/873883468.db2.gz ZGKIHSOOVGDXGJ-YADHBBJMSA-N 0 3 411.521 4.124 20 0 HIADHN CC[C@H](C(=O)Nc1ccc(C(=O)N(C)[C@H]2CCCN(C)C2)cc1)c1ccc(F)cc1 ZINC000461010530 873883823 /nfs/dbraw/zinc/88/38/23/873883823.db2.gz ZGKIHSOOVGDXGJ-VXKWHMMOSA-N 0 3 411.521 4.124 20 0 HIADHN CO[C@H](CNC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1)c1ccc(Cl)cc1 ZINC000461031528 873894752 /nfs/dbraw/zinc/89/47/52/873894752.db2.gz DNKHRHCJZPRSEU-WIYYLYMNSA-N 0 3 404.913 4.195 20 0 HIADHN CC(C)(C)CC(=O)Nc1ccc(Cl)c(C(=O)N2CC[C@H](N3CCCCC3)C2)c1 ZINC000461079749 873984741 /nfs/dbraw/zinc/98/47/41/873984741.db2.gz GHKXNDDZPOFXEQ-KRWDZBQOSA-N 0 3 405.970 4.415 20 0 HIADHN CCN1CCCC[C@@H]1CNC(=O)c1ccc(Oc2cccc(Cl)c2Cl)nn1 ZINC000461082601 873991287 /nfs/dbraw/zinc/99/12/87/873991287.db2.gz IPVVBRPFCGXXHU-CYBMUJFWSA-N 0 3 409.317 4.180 20 0 HIADHN c1c2c(sc1-c1nnc(CN3CCC[C@@H](c4n[nH]c(C5CC5)n4)C3)o1)CCCC2 ZINC000461359671 874362373 /nfs/dbraw/zinc/36/23/73/874362373.db2.gz CCXPGNNXCRIXNY-OAHLLOKOSA-N 0 3 410.547 4.052 20 0 HIADHN OCC[C@H](NCc1nc(-c2cc(Cl)ccc2Cl)cs1)C1CCOCC1 ZINC000461404058 874413570 /nfs/dbraw/zinc/41/35/70/874413570.db2.gz FUIWFGDVJZZCPT-INIZCTEOSA-N 0 3 401.359 4.384 20 0 HIADHN CCc1ccc(C(=O)CCC(=O)N2C[C@H]3CN(Cc4ccccc4)CC[C@@H]3C2)cc1 ZINC000461424136 874455545 /nfs/dbraw/zinc/45/55/45/874455545.db2.gz HHRJEKCWTFMYOU-DNQXCXABSA-N 0 3 404.554 4.192 20 0 HIADHN Cc1cc(C(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)nn1-c1c(F)cccc1F ZINC000468744882 882839870 /nfs/dbraw/zinc/83/98/70/882839870.db2.gz SLZUSWGUMHANRC-AEFFLSMTSA-N 0 3 410.468 4.024 20 0 HIADHN O=C1[C@H](NCc2cccc(-c3ccncc3)c2)CCCN1Cc1ccc(F)cc1F ZINC000468760166 882846974 /nfs/dbraw/zinc/84/69/74/882846974.db2.gz AHEFMBOOYRBNMK-HSZRJFAPSA-N 0 3 407.464 4.308 20 0 HIADHN CCCc1noc(CCCC(=O)N2CCN(Cc3ccccc3)C3(CCCCC3)C2)n1 ZINC000461584910 874695496 /nfs/dbraw/zinc/69/54/96/874695496.db2.gz YGYIWHQJUROVJJ-UHFFFAOYSA-N 0 3 424.589 4.392 20 0 HIADHN CC(=O)Nc1cccc(C(=O)N2CCN(Cc3ccccc3)C3(CCCCC3)C2)c1 ZINC000461596868 874721878 /nfs/dbraw/zinc/72/18/78/874721878.db2.gz WGSRXXNRLKUFNK-UHFFFAOYSA-N 0 3 405.542 4.306 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)N3CCCCC[C@@H]3c3ccncc3)CC2)c1 ZINC000461895216 875041732 /nfs/dbraw/zinc/04/17/32/875041732.db2.gz OIAIOVLYOSPPCY-XMMPIXPASA-N 0 3 406.574 4.046 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)c1cc(-c2ccccc2)ns1 ZINC000461968460 875092091 /nfs/dbraw/zinc/09/20/91/875092091.db2.gz HZMGPJNYUMBWTK-UHFFFAOYSA-N 0 3 401.482 4.292 20 0 HIADHN CCCN(C(=O)c1ccc(-c2n[nH]c(C)n2)cc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000461991636 875111257 /nfs/dbraw/zinc/11/12/57/875111257.db2.gz YKCRYBHNGCLUDR-HSZRJFAPSA-N 0 3 417.557 4.297 20 0 HIADHN Cc1ccc(-c2ccncc2)cc1NC(=O)CCN1CCN(c2ccccc2)CC1 ZINC000461994637 875116050 /nfs/dbraw/zinc/11/60/50/875116050.db2.gz KHIIPIDNGCDCIP-UHFFFAOYSA-N 0 3 400.526 4.208 20 0 HIADHN CC[C@@H](NC(=O)CCN1CCN(c2ccccc2)CC1)c1ccccc1OC(F)F ZINC000462021299 875137851 /nfs/dbraw/zinc/13/78/51/875137851.db2.gz CVARSRHJHROFCY-HXUWFJFHSA-N 0 3 417.500 4.068 20 0 HIADHN O=C(N[C@H]1CCCc2cn(C3CCCC3)nc21)N1CCCN(Cc2ccccc2)CC1 ZINC000462152886 875248379 /nfs/dbraw/zinc/24/83/79/875248379.db2.gz VLOPHWJTRVJSFP-QHCPKHFHSA-N 0 3 421.589 4.293 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1cccc(C(=O)N(C)CC(C)(C)C)c1 ZINC000462161476 875256736 /nfs/dbraw/zinc/25/67/36/875256736.db2.gz DSFVALFRSUMSTO-CVDCTZTESA-N 0 3 421.585 4.055 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1cc(NC(=O)C(C)(C)C)ccc1F ZINC000462174586 875273356 /nfs/dbraw/zinc/27/33/56/875273356.db2.gz GUKRYEIVZUIASH-IERDGZPVSA-N 0 3 411.521 4.061 20 0 HIADHN Cc1ccc(-c2nc(CC(=O)N[C@H]3CN(Cc4ccccc4)C[C@H]3C)cs2)cc1 ZINC000462189609 875294650 /nfs/dbraw/zinc/29/46/50/875294650.db2.gz OHNLXSIUYNRFNK-GCJKJVERSA-N 0 3 405.567 4.298 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1ccc(NC(=O)c2ccccc2)cc1 ZINC000462192707 875298829 /nfs/dbraw/zinc/29/88/29/875298829.db2.gz UIDNLQDITVXFBX-CYFREDJKSA-N 0 3 413.521 4.189 20 0 HIADHN C[C@H](C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C)c1ccc(Br)s1 ZINC000462194545 875301624 /nfs/dbraw/zinc/30/16/24/875301624.db2.gz IPEZIEANLRYTOP-OFQRWUPVSA-N 0 3 407.377 4.251 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)CCCc1ncc(-c2ccccc2)o1 ZINC000462197939 875305921 /nfs/dbraw/zinc/30/59/21/875305921.db2.gz WUNYHNRKSRGBOT-DENIHFKCSA-N 0 3 403.526 4.301 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)NC[C@@H](Cc1ccccc1)C(F)(F)F ZINC000462224553 875332958 /nfs/dbraw/zinc/33/29/58/875332958.db2.gz NFGBECBFGCAELW-QGZVFWFLSA-N 0 3 413.509 4.243 20 0 HIADHN CCN(C(=O)c1ccc(COCCOC)cc1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000462242596 875358864 /nfs/dbraw/zinc/35/88/64/875358864.db2.gz BPUCERUFKGJDOB-RDPSFJRHSA-N 0 3 410.558 4.147 20 0 HIADHN CCCC(=O)Nc1cccc(NC(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)c1C ZINC000462272145 875399510 /nfs/dbraw/zinc/39/95/10/875399510.db2.gz QMOQXXJDZWHLDU-VGSWGCGISA-N 0 3 408.546 4.376 20 0 HIADHN O[C@@H](CNCc1ccccc1OCC(F)(F)F)COc1cccc(Cl)c1Cl ZINC000462365177 875478096 /nfs/dbraw/zinc/47/80/96/875478096.db2.gz JYJIVVGILKDBEM-ZDUSSCGKSA-N 0 3 424.246 4.464 20 0 HIADHN COc1ccc(OCc2nc(CN[C@@H]3CN(Cc4ccccc4)C[C@@H]3C)cs2)cc1 ZINC000462553030 875677525 /nfs/dbraw/zinc/67/75/25/875677525.db2.gz PPGHHFXMXDNOPJ-FDDCHVKYSA-N 0 3 423.582 4.341 20 0 HIADHN COc1ccc(OCc2nc(CN[C@H]3CN(Cc4ccccc4)C[C@H]3C)cs2)cc1 ZINC000462553031 875677996 /nfs/dbraw/zinc/67/79/96/875677996.db2.gz PPGHHFXMXDNOPJ-JPYJTQIMSA-N 0 3 423.582 4.341 20 0 HIADHN CCc1noc(-c2ccc(C)c(NC(=O)N[C@@H]3CN(Cc4ccccc4)C[C@H]3C)c2)n1 ZINC000462686073 875778373 /nfs/dbraw/zinc/77/83/73/875778373.db2.gz SYKZPHDKLSULGI-DYESRHJHSA-N 0 3 419.529 4.249 20 0 HIADHN Cc1cc(C)nc(NC(=O)N(CCN(C)C)Cc2ccc(Br)cc2)c1 ZINC000462712827 875794887 /nfs/dbraw/zinc/79/48/87/875794887.db2.gz SXCHEEZOSFBPEZ-UHFFFAOYSA-N 0 3 405.340 4.057 20 0 HIADHN COC(=O)c1cc(CN[C@@H](Cc2ccc(F)cc2)c2ccc(OC)cc2)n(C)c1C ZINC000462782836 875837269 /nfs/dbraw/zinc/83/72/69/875837269.db2.gz GNFDIVIDJRQWJD-QHCPKHFHSA-N 0 3 410.489 4.341 20 0 HIADHN COC(=O)c1cc(CN[C@H](Cc2ccc(OC)cc2)c2ccc(OC)cc2)n(C)c1C ZINC000462784328 875838859 /nfs/dbraw/zinc/83/88/59/875838859.db2.gz DMDIEFHXSSBXGR-XMMPIXPASA-N 0 3 422.525 4.211 20 0 HIADHN CCc1ccc([C@@H](NC[C@](C)(OC)C2CC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000462811507 875854445 /nfs/dbraw/zinc/85/44/45/875854445.db2.gz XCSGPOLZLNTBDH-PKTZIBPZSA-N 0 3 401.572 4.147 20 0 HIADHN COc1ccccc1[C@H](NCc1cccc(N2CCCS2(=O)=O)c1)C1CCCC1 ZINC000462836657 875870956 /nfs/dbraw/zinc/87/09/56/875870956.db2.gz FRARCBOHPGUZLF-HSZRJFAPSA-N 0 3 414.571 4.256 20 0 HIADHN C[C@@H](NCc1cccc(N2CCCS2(=O)=O)c1)c1ccc(OC(C)(C)C)cc1 ZINC000462837418 875872747 /nfs/dbraw/zinc/87/27/47/875872747.db2.gz WMHHWEUQMSGKFE-QGZVFWFLSA-N 0 3 402.560 4.255 20 0 HIADHN Cc1ccccc1NC(=O)C[C@@H](C)NCc1cc(Br)cc2c1OCC2 ZINC000462844261 875878865 /nfs/dbraw/zinc/87/88/65/875878865.db2.gz YMHJUQQWKSNZJX-CQSZACIVSA-N 0 3 403.320 4.199 20 0 HIADHN Cc1nc2ccc(Br)cc2c(NCCCOCC2CCOCC2)c1C ZINC000462862710 875895071 /nfs/dbraw/zinc/89/50/71/875895071.db2.gz PFBJNIQUXXHCRA-UHFFFAOYSA-N 0 3 407.352 4.281 20 0 HIADHN O=S1(=O)CCCN1c1ccc(CNCc2ccc(C3CCCC3)cc2)cc1F ZINC000462911203 875936819 /nfs/dbraw/zinc/93/68/19/875936819.db2.gz KIMWGUZKWIDMNS-UHFFFAOYSA-N 0 3 402.535 4.313 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N[C@H](c1nccs1)c1ccccc1 ZINC000463013035 876029433 /nfs/dbraw/zinc/02/94/33/876029433.db2.gz RIKQXEIOPOEPTR-QMMLZNLJSA-N 0 3 406.555 4.052 20 0 HIADHN C[C@@H]1CCN(C(=O)N[C@H]2CCO[C@@H](c3ccccc3)C2)CCN1Cc1ccccc1 ZINC000463015038 876031436 /nfs/dbraw/zinc/03/14/36/876031436.db2.gz WWOUSPZNQRSMFM-FGCOXFRFSA-N 0 3 407.558 4.213 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N[C@@H]2CCO[C@@H](c3ccccc3)C2)N2CCCC2)cc1 ZINC000463018254 876035277 /nfs/dbraw/zinc/03/52/77/876035277.db2.gz BXRKUXFRFAAVLO-TZRRMPRUSA-N 0 3 407.558 4.351 20 0 HIADHN Cc1nc(COc2ccc(CN[C@@H]3CC(=O)N(c4ccccc4F)C3)cc2)cs1 ZINC000463022187 876039958 /nfs/dbraw/zinc/03/99/58/876039958.db2.gz CUJRJTBIAQQSMH-QGZVFWFLSA-N 0 3 411.502 4.065 20 0 HIADHN COc1cc(CN2CCC[C@](CO)(Cc3ccccc3)C2)c(SC)cc1OC ZINC000463026068 876045451 /nfs/dbraw/zinc/04/54/51/876045451.db2.gz VGZSBVOFOYTCRV-QHCPKHFHSA-N 0 3 401.572 4.243 20 0 HIADHN C[C@H](C(=O)NCC1(N2CCSCC2)CCCC1)c1ccc(Br)s1 ZINC000463109528 876148457 /nfs/dbraw/zinc/14/84/57/876148457.db2.gz SEEAQDNUIDYXJM-ZDUSSCGKSA-N 0 3 417.438 4.092 20 0 HIADHN CC[C@H](O[C@H]1CCC[C@H](C)C1)C(=O)NCCCCN1CCN(c2ccccc2)CC1 ZINC000463123160 876166384 /nfs/dbraw/zinc/16/63/84/876166384.db2.gz ARXKCNLOJUWQDC-XWGVYQGASA-N 0 3 415.622 4.079 20 0 HIADHN Cn1ccnc1[C@@H](NC1CCN(CCC(F)(F)F)CC1)c1ccc(Cl)cc1 ZINC000463138171 876188498 /nfs/dbraw/zinc/18/84/98/876188498.db2.gz VXUGKTIJIFNSDJ-KRWDZBQOSA-N 0 3 400.876 4.169 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3c(C)cccc3Br)c(C)c2)CC1 ZINC000463146377 876200765 /nfs/dbraw/zinc/20/07/65/876200765.db2.gz NXAOSDOJSPGKLI-UHFFFAOYSA-N 0 3 416.363 4.460 20 0 HIADHN CC(C)c1nn(C)c2sc(C(=O)N(CCN(C)C)Cc3ccccc3F)cc12 ZINC000463154804 876207794 /nfs/dbraw/zinc/20/77/94/876207794.db2.gz XKYYEVPCYHXICE-UHFFFAOYSA-N 0 3 402.539 4.101 20 0 HIADHN COc1ccc([C@H](NCCN2CCCOCC2)c2ccc(C(F)(F)F)cc2)cc1 ZINC000463156490 876209405 /nfs/dbraw/zinc/20/94/05/876209405.db2.gz NRAJTFTXGMVLQL-OAQYLSRUSA-N 0 3 408.464 4.115 20 0 HIADHN C[C@@H]1CC[C@H](O)[C@H]([C@H]2CCCCN2Cc2nc(-c3cc(F)c(F)c(F)c3)no2)C1 ZINC000463198837 876258778 /nfs/dbraw/zinc/25/87/78/876258778.db2.gz FPATXOSJFVKJNP-OLUCIUBSSA-N 0 3 409.452 4.306 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)N[C@H]1CCO[C@H](c2ccccc2)C1 ZINC000463229400 876286574 /nfs/dbraw/zinc/28/65/74/876286574.db2.gz XUJOAHFHFZYVNR-VXKWHMMOSA-N 0 3 415.965 4.334 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)N[C@H]1CCO[C@@H](c2ccccc2)C1 ZINC000463229398 876286689 /nfs/dbraw/zinc/28/66/89/876286689.db2.gz XUJOAHFHFZYVNR-FCHUYYIVSA-N 0 3 415.965 4.334 20 0 HIADHN C[C@H](NC(=O)N1CCN(CC2CCOCC2)CC1)c1ccc(Cl)c2ccccc21 ZINC000463267483 876324424 /nfs/dbraw/zinc/32/44/24/876324424.db2.gz RGMJBOMYYUYASQ-KRWDZBQOSA-N 0 3 415.965 4.308 20 0 HIADHN CCc1nc2c(s1)[C@H](N(C)C(=O)N[C@@H]1CN(Cc3ccccc3)C[C@@H]1C)CCC2 ZINC000463280082 876336658 /nfs/dbraw/zinc/33/66/58/876336658.db2.gz RANYBNIVJIEUIS-PWIZWCRZSA-N 0 3 412.603 4.245 20 0 HIADHN CC(C)(C)C(=O)Nc1ccc(F)c(C(=O)N[C@@H](CN2CCCC2)c2ccccc2)c1 ZINC000463323301 876379552 /nfs/dbraw/zinc/37/95/52/876379552.db2.gz HBPHFBPERHMIMG-NRFANRHFSA-N 0 3 411.521 4.377 20 0 HIADHN C[C@H]1CCCCN1CCNC(=O)c1ccc(-c2noc(-c3ccc(F)cc3)n2)cc1 ZINC000463373308 876428043 /nfs/dbraw/zinc/42/80/43/876428043.db2.gz CKBMCAZJBXUUDP-INIZCTEOSA-N 0 3 408.477 4.147 20 0 HIADHN C[C@H](NCCOc1ccccc1F)c1ccc(Br)cc1OCCCO ZINC000463375859 876431627 /nfs/dbraw/zinc/43/16/27/876431627.db2.gz NLTMRIGTLQNQER-AWEZNQCLSA-N 0 3 412.299 4.079 20 0 HIADHN CC(C)[C@@H](CNC(=O)[C@@H]1SCCc2sccc21)N1CCc2ccccc2C1 ZINC000463408587 876461967 /nfs/dbraw/zinc/46/19/67/876461967.db2.gz ZXVOHVITSMXRBS-TZIWHRDSSA-N 0 3 400.613 4.278 20 0 HIADHN COc1cc(-c2noc(CN[C@@H]3CCCCC34CCCC4)n2)cc(OC)c1OC ZINC000463429447 876484115 /nfs/dbraw/zinc/48/41/15/876484115.db2.gz JNLRXOXJJFIRKE-GOSISDBHSA-N 0 3 401.507 4.355 20 0 HIADHN OC[C@]1(Cc2ccccc2)CCCN(C[C@@H](O)COc2ccc(Cl)cc2Cl)C1 ZINC000463434070 876489358 /nfs/dbraw/zinc/48/93/58/876489358.db2.gz CJSWSACVRFQFNV-KNQAVFIVSA-N 0 3 424.368 4.050 20 0 HIADHN Cc1cc(OC[C@@H](O)CN2CC[C@@](CO)(c3ccccc3)C2)c(C(C)C)cc1Cl ZINC000463440516 876497439 /nfs/dbraw/zinc/49/74/39/876497439.db2.gz FUCDQSDSPDYSPO-GBXCKJPGSA-N 0 3 417.977 4.148 20 0 HIADHN CN(C)Cc1cccc(NC(=O)c2c(Cl)cccc2I)c1 ZINC000463510909 876574107 /nfs/dbraw/zinc/57/41/07/876574107.db2.gz AGMYPBOTNLXRHC-UHFFFAOYSA-N 0 3 414.674 4.259 20 0 HIADHN COc1c(Br)c(C)sc1C(=O)NC[C@H](c1ccc(C)cc1)N(C)C ZINC000463513446 876577088 /nfs/dbraw/zinc/57/70/88/876577088.db2.gz NCHHJPMWJYKSRS-CQSZACIVSA-N 0 3 411.365 4.169 20 0 HIADHN Cc1c(Br)cccc1C(=O)N(CCN(C)C)Cc1ccc(F)c(F)c1 ZINC000463534739 876612284 /nfs/dbraw/zinc/61/22/84/876612284.db2.gz WPTPCYCWSFEFTG-UHFFFAOYSA-N 0 3 411.290 4.240 20 0 HIADHN CCO[C@@H](C)c1ncc(C(=O)Nc2ccc(CCN3CCSCC3)cc2)s1 ZINC000463578470 876675586 /nfs/dbraw/zinc/67/55/86/876675586.db2.gz OZMKYQNKOIPQDY-HNNXBMFYSA-N 0 3 405.589 4.084 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2cccc(-c3noc(C4CC4)n3)c2)N2CCCC2)cc1 ZINC000463594385 876706330 /nfs/dbraw/zinc/70/63/30/876706330.db2.gz XMVKSDSEFCZMGE-QFIPXVFZSA-N 0 3 416.525 4.489 20 0 HIADHN O=C([C@@H]1SCCc2sccc21)N1CCCN(CCCc2ccccc2)CC1 ZINC000463618272 876737440 /nfs/dbraw/zinc/73/74/40/876737440.db2.gz MDGCEURMJCLDQV-OAQYLSRUSA-N 0 3 400.613 4.246 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2cccc(-c3ncc4n3CCCC4)c2)[C@@H]1c1ccccc1 ZINC000463704400 876824160 /nfs/dbraw/zinc/82/41/60/876824160.db2.gz QGQCZIVJCBORLR-PKTZIBPZSA-N 0 3 415.541 4.453 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)[C@H]1C[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000463709357 876828238 /nfs/dbraw/zinc/82/82/38/876828238.db2.gz KKQAEXHYWQXXGQ-MSOLQXFVSA-N 0 3 420.500 4.437 20 0 HIADHN O=C(Nc1cccc(-c2ncc3n2CCCC3)c1)N1CCN(C2CCCCC2)CC1 ZINC000463710338 876829538 /nfs/dbraw/zinc/82/95/38/876829538.db2.gz YEUBYZFUQFQDLP-UHFFFAOYSA-N 0 3 407.562 4.369 20 0 HIADHN COc1ccc(Cn2nc(C)c(CNCc3cccc(Cn4cccn4)c3)c2C)cc1 ZINC000463736796 876858382 /nfs/dbraw/zinc/85/83/82/876858382.db2.gz PRNPNUHBHNUZRA-UHFFFAOYSA-N 0 3 415.541 4.091 20 0 HIADHN CC(C)c1ccc(NC(=O)C(=O)Nc2cccc(CN3CC[C@@H](O)C3)c2)c(C(C)C)c1 ZINC000463978911 877109190 /nfs/dbraw/zinc/10/91/90/877109190.db2.gz UHZZATDKMZDEPP-OAQYLSRUSA-N 0 3 423.557 4.077 20 0 HIADHN CN1CCN(Cc2ccc(CNCc3cc(Cl)ccc3Br)cc2)CC1 ZINC000464041800 877180071 /nfs/dbraw/zinc/18/00/71/877180071.db2.gz RUTGDYTYOUZOPK-UHFFFAOYSA-N 0 3 422.798 4.140 20 0 HIADHN Fc1cc(CCNCc2cc(Cl)ccc2Br)c2c(c1)COCO2 ZINC000464045619 877186186 /nfs/dbraw/zinc/18/61/86/877186186.db2.gz UKPGVOALKWZLCT-UHFFFAOYSA-N 0 3 400.675 4.440 20 0 HIADHN Clc1ccc(Br)c(CNC[C@@H](c2ccccc2)N2CCOCC2)c1 ZINC000464047534 877189623 /nfs/dbraw/zinc/18/96/23/877189623.db2.gz ICEURGKWOKNOGX-IBGZPJMESA-N 0 3 409.755 4.266 20 0 HIADHN O=C1COc2ccccc2N1CCCNCc1cc(Cl)ccc1Br ZINC000464054122 877196735 /nfs/dbraw/zinc/19/67/35/877196735.db2.gz UIZUGUCKMGWIIB-UHFFFAOYSA-N 0 3 409.711 4.008 20 0 HIADHN Cc1nn(C(C)(C)C)cc1[C@@H](C)NC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1 ZINC000464151981 877320611 /nfs/dbraw/zinc/32/06/11/877320611.db2.gz LMAUXWDYTTVNTQ-RBUKOAKNSA-N 0 3 411.594 4.314 20 0 HIADHN CSCc1cccnc1C(=O)Nc1cc(C)nn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000464206487 877376886 /nfs/dbraw/zinc/37/68/86/877376886.db2.gz PQFIUQHJSLTXKM-HXUWFJFHSA-N 0 3 421.570 4.149 20 0 HIADHN CC[C@H](C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)c1ccc(OC)cc1 ZINC000464208031 877378180 /nfs/dbraw/zinc/37/81/80/877378180.db2.gz UEQGCFNHMSUTOI-GMAHTHKFSA-N 0 3 418.541 4.471 20 0 HIADHN O=c1ccccn1C[C@@H](NCCOc1ccccc1Br)c1ccccc1 ZINC000503270580 912254143 /nfs/dbraw/zinc/25/41/43/912254143.db2.gz SPHVHKSRKLTOMM-LJQANCHMSA-N 0 3 413.315 4.021 20 0 HIADHN COc1ccccc1S(=O)(=O)CCCN[C@H](C)c1cccc(OC(F)(F)F)c1 ZINC000464483662 877703052 /nfs/dbraw/zinc/70/30/52/877703052.db2.gz DTDJAPOFEACTDT-CQSZACIVSA-N 0 3 417.449 4.108 20 0 HIADHN CN(C(=O)N[C@@H]1CCOc2c(F)ccc(F)c21)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000464506250 877730130 /nfs/dbraw/zinc/73/01/30/877730130.db2.gz IAYJMXPVUMFYQM-FXAWDEMLSA-N 0 3 415.484 4.094 20 0 HIADHN CC(C)CN(C(=O)Cc1c[nH]c2cc(Br)ccc12)C1CCN(C)CC1 ZINC000464570061 877791197 /nfs/dbraw/zinc/79/11/97/877791197.db2.gz ZNMDUUIKZLVMHB-UHFFFAOYSA-N 0 3 406.368 4.052 20 0 HIADHN CC(C)CN(C(=O)[C@H](C)Cc1ccc(F)c(Br)c1)C1CCN(C)CC1 ZINC000464580673 877804690 /nfs/dbraw/zinc/80/46/90/877804690.db2.gz KSMGROFFVYTFIT-OAHLLOKOSA-N 0 3 413.375 4.346 20 0 HIADHN COCCCN(C(=O)c1ccc(-c2cc(F)c(F)c(F)c2)cc1)C1CCN(C)CC1 ZINC000464717520 877943720 /nfs/dbraw/zinc/94/37/20/877943720.db2.gz YFALQAOKFOQSEM-UHFFFAOYSA-N 0 3 420.475 4.344 20 0 HIADHN CCS[C@@H]1CC[C@H](N(C)CC(=O)N(C)Cc2cc(Br)cs2)C1 ZINC000464767909 878009996 /nfs/dbraw/zinc/00/99/96/878009996.db2.gz DWTPOPMBVTWTEX-UONOGXRCSA-N 0 3 405.427 4.075 20 0 HIADHN CCS[C@@H]1CC[C@H](N(C)CC(=O)N2CCC[C@H]2c2ccc3c(c2)OCCCO3)C1 ZINC000464777276 878018316 /nfs/dbraw/zinc/01/83/16/878018316.db2.gz UZYGQJMIMSJZDH-ZCNNSNEGSA-N 0 3 418.603 4.117 20 0 HIADHN CCCCOC1CCN(CCc2nc3sc4c(c3c(N)n2)CC[C@H](C)C4)CC1 ZINC000464849530 878126365 /nfs/dbraw/zinc/12/63/65/878126365.db2.gz KNTAYRGYELBETE-HNNXBMFYSA-N 0 3 402.608 4.222 20 0 HIADHN COC(=O)c1ccc(CN2CCC[C@@H](c3nc(-c4cccc(F)c4)no3)C2)cc1F ZINC000464864616 878146692 /nfs/dbraw/zinc/14/66/92/878146692.db2.gz PWKQXZFKJIZENG-MRXNPFEDSA-N 0 3 413.424 4.181 20 0 HIADHN COc1ccccc1NC(=O)c1ccc(NC(=O)[C@H](C)N2C[C@@H]3CCC[C@H]3C2)cc1 ZINC000464885995 878182989 /nfs/dbraw/zinc/18/29/89/878182989.db2.gz ADDYXMFRIZZWGJ-WDSOQIARSA-N 0 3 407.514 4.006 20 0 HIADHN C[C@H]1CCN(C(=O)c2cccc(Oc3cnccn3)c2)CCN1Cc1ccccc1 ZINC000464891800 878191326 /nfs/dbraw/zinc/19/13/26/878191326.db2.gz ZYYVWYLGCIUPKK-IBGZPJMESA-N 0 3 402.498 4.006 20 0 HIADHN C[C@@H]1CCN(C(=O)c2ccnc(SCC(F)(F)F)c2)CCN1Cc1ccccc1 ZINC000464891899 878193546 /nfs/dbraw/zinc/19/35/46/878193546.db2.gz INGYQSBNNJRSFA-MRXNPFEDSA-N 0 3 423.504 4.473 20 0 HIADHN CCc1c(C(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)cnn1Cc1ccccc1 ZINC000464899547 878208087 /nfs/dbraw/zinc/20/80/87/878208087.db2.gz AMOMQHUGCYSAIK-OAQYLSRUSA-N 0 3 416.569 4.230 20 0 HIADHN C[C@@H]1CCN(C(=O)c2cc(-c3ccccc3Cl)n[nH]2)CCN1Cc1ccccc1 ZINC000464900667 878210310 /nfs/dbraw/zinc/21/03/10/878210310.db2.gz MHULYNJQMWUSJJ-QGZVFWFLSA-N 0 3 408.933 4.467 20 0 HIADHN CC(=O)CCc1ccc(OCCC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)cc1 ZINC000464901544 878211604 /nfs/dbraw/zinc/21/16/04/878211604.db2.gz GZXGTVMCVJIDFY-OAQYLSRUSA-N 0 3 422.569 4.100 20 0 HIADHN COc1ccc2nc(C)cc(C(=O)N3CC[C@@H](C)N(Cc4ccccc4)CC3)c2c1 ZINC000464903550 878216437 /nfs/dbraw/zinc/21/64/37/878216437.db2.gz DWABPTYYWRRCCY-LJQANCHMSA-N 0 3 403.526 4.288 20 0 HIADHN Cc1c(C(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)cnn1-c1ccccc1C ZINC000464907798 878223112 /nfs/dbraw/zinc/22/31/12/878223112.db2.gz SDEKWPBWWWXMGD-HXUWFJFHSA-N 0 3 402.542 4.226 20 0 HIADHN COc1c(Br)cc(Br)cc1CNC[C@@H](OC)C(C)(C)C ZINC000465021457 878384738 /nfs/dbraw/zinc/38/47/38/878384738.db2.gz UEGPXWBGHDLKID-CYBMUJFWSA-N 0 3 409.162 4.371 20 0 HIADHN Cc1ccc([C@H](NC(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)c2ccccn2)cc1 ZINC000503372322 912351817 /nfs/dbraw/zinc/35/18/17/912351817.db2.gz JWIQCSBEAHIWRE-VEXUSMLFSA-N 0 3 402.542 4.470 20 0 HIADHN Cc1ccc([C@H](NC(=O)N[C@@H]2CCN(Cc3ccccc3)[C@@H]2C)c2ccccn2)cc1 ZINC000503373128 912352215 /nfs/dbraw/zinc/35/22/15/912352215.db2.gz RQSSSVQVEJXTHJ-XRODADMRSA-N 0 3 414.553 4.442 20 0 HIADHN Cc1ccc(-c2nc(CNC(=O)[C@@H]3CCCN(Cc4cccc(F)c4)C3)co2)cc1 ZINC000465199146 878603884 /nfs/dbraw/zinc/60/38/84/878603884.db2.gz YRCRBTJXUMIOGB-HXUWFJFHSA-N 0 3 407.489 4.318 20 0 HIADHN CO[C@]1(C)C[C@@H](N[C@H](C)C(=O)Nc2ccc(NC(=O)c3cccs3)cc2)C1(C)C ZINC000465414707 878847468 /nfs/dbraw/zinc/84/74/68/878847468.db2.gz UNCRQXLKVQGEPN-JPEVHGAISA-N 0 3 415.559 4.121 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N1CC[C@H](COCc2ccccc2)C1 ZINC000465419889 878850884 /nfs/dbraw/zinc/85/08/84/878850884.db2.gz CBIVMIAJDYEGJL-LEWJYISDSA-N 0 3 413.587 4.133 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)N1CC[C@H](COCc2ccccc2)C1 ZINC000465419895 878851077 /nfs/dbraw/zinc/85/10/77/878851077.db2.gz CBIVMIAJDYEGJL-SFTDATJTSA-N 0 3 413.587 4.133 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N[C@H](c1cccc(F)c1)C1CCCC1 ZINC000465423290 878852766 /nfs/dbraw/zinc/85/27/66/878852766.db2.gz MNNABCGLWAASEJ-QFIPXVFZSA-N 0 3 411.521 4.182 20 0 HIADHN CN(C)[C@H](CNC(=O)N(Cc1ccc2c(c1)CCO2)C1CCCC1)Cc1ccccc1 ZINC000465427537 878857825 /nfs/dbraw/zinc/85/78/25/878857825.db2.gz YIEZFUVKRPEPEB-DEOSSOPVSA-N 0 3 421.585 4.249 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)N2CC[C@H](COCc3ccccc3)C2)N(C)C)cc1 ZINC000465429598 878859993 /nfs/dbraw/zinc/85/99/93/878859993.db2.gz HVBSUKRJDGUJJT-LADGPHEKSA-N 0 3 409.574 4.100 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N[C@@H](C)c2cccc(-n3cccn3)c2)N(C)C)cc1 ZINC000465431288 878863000 /nfs/dbraw/zinc/86/30/00/878863000.db2.gz IUFJTWCQTNAFGS-MBSDFSHPSA-N 0 3 405.546 4.098 20 0 HIADHN C[C@@H](NC(=O)NC[C@@H](c1ccccc1)N1CCCC1)c1ccc(-n2cccn2)cc1 ZINC000465433030 878864742 /nfs/dbraw/zinc/86/47/42/878864742.db2.gz ZWHXYAFTTQRBRC-XXBNENTESA-N 0 3 403.530 4.070 20 0 HIADHN CN(C)CCN(C[C@@H]1CCCO1)C(=O)N[C@@H](c1ccccc1)c1ccc(Cl)cc1 ZINC000465471678 878907768 /nfs/dbraw/zinc/90/77/68/878907768.db2.gz GHNZRFFGPYFTTH-VXKWHMMOSA-N 0 3 415.965 4.182 20 0 HIADHN COc1ccc([C@@H](NC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)C2CC2)cc1 ZINC000465475061 878912420 /nfs/dbraw/zinc/91/24/20/878912420.db2.gz VAQRNOWYDXQVJM-CYFREDJKSA-N 0 3 407.558 4.452 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N[C@H](c1nc(C)cs1)C1CC1)c1cccc(OC)c1 ZINC000465507049 878946030 /nfs/dbraw/zinc/94/60/30/878946030.db2.gz AWDAMNLIDXBYFX-PMACEKPBSA-N 0 3 416.591 4.294 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N[C@H](C)c1cccc(-n2cccn2)c1)c1ccsc1 ZINC000465520238 878968685 /nfs/dbraw/zinc/96/86/85/878968685.db2.gz ABFNKTOFCHPYCO-UTKZUKDTSA-N 0 3 411.575 4.377 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@@H](C)c1ccc(-n2cccn2)cc1)c1ccsc1 ZINC000465533812 878992049 /nfs/dbraw/zinc/99/20/49/878992049.db2.gz MIIRRBRJTFZAAL-LAUBAEHRSA-N 0 3 411.575 4.377 20 0 HIADHN Cc1ccc([C@H]2C[C@@H](C)CCN2C(=O)NCc2ccc(CN3CCN(C)CC3)cc2)o1 ZINC000465558172 879027782 /nfs/dbraw/zinc/02/77/82/879027782.db2.gz NAOKWVPDPQVIBS-WMZHIEFXSA-N 0 3 424.589 4.018 20 0 HIADHN C[C@H](NC(=O)N[C@@H](CN1CCCC1)c1ccccc1)c1cccc(-n2cccn2)c1 ZINC000465598990 879086608 /nfs/dbraw/zinc/08/66/08/879086608.db2.gz MTBXJHIMGUVJIC-CVDCTZTESA-N 0 3 403.530 4.070 20 0 HIADHN C[C@H](OCCCNC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1)c1ccccc1 ZINC000465609782 879105544 /nfs/dbraw/zinc/10/55/44/879105544.db2.gz VIVDPJBZWXBHEM-VXKWHMMOSA-N 0 3 409.574 4.460 20 0 HIADHN C[C@H](NC(=O)NCC(C)(C)N1CCc2ccccc2C1)c1ccc(-n2cccn2)cc1 ZINC000465697192 879254660 /nfs/dbraw/zinc/25/46/60/879254660.db2.gz SOQCNUOETMZBCQ-IBGZPJMESA-N 0 3 417.557 4.069 20 0 HIADHN Cc1ccc(-c2nc(CNC(=O)N[C@@H]3CCN([C@H](C)c4ccccc4)C3)co2)cc1 ZINC000465756533 879347665 /nfs/dbraw/zinc/34/76/65/879347665.db2.gz OAOKMNBLEVRFSS-WIYYLYMNSA-N 0 3 404.514 4.285 20 0 HIADHN O=C(NCc1coc(-c2ccccc2)n1)NC[C@H]1CCCCN1Cc1ccccc1 ZINC000465783320 879388753 /nfs/dbraw/zinc/38/87/53/879388753.db2.gz KGKYAQBEYWCKPD-JOCHJYFZSA-N 0 3 404.514 4.196 20 0 HIADHN C[C@@H](CCc1ccc2c(c1)OCO2)NC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1 ZINC000465792706 879400381 /nfs/dbraw/zinc/40/03/81/879400381.db2.gz YVEWLKKJXHIDIU-PMACEKPBSA-N 0 3 423.557 4.042 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N2CC[C@H](COCc3ccccc3)C2)N2CCCC2)cc1 ZINC000465816203 879440253 /nfs/dbraw/zinc/44/02/53/879440253.db2.gz SBVVBAFLJNWQKU-ZCYQVOJMSA-N 0 3 421.585 4.380 20 0 HIADHN COc1ccc(CC[C@@H](C)NC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)cc1 ZINC000465818357 879442035 /nfs/dbraw/zinc/44/20/35/879442035.db2.gz PVBBHNIYWJPBFZ-RTWAWAEBSA-N 0 3 409.574 4.322 20 0 HIADHN Cc1ccc([C@H](CNC(=O)NC[C@@H]2CCCO[C@H]2c2ccc(C)cc2)N(C)C)cc1 ZINC000465817478 879442223 /nfs/dbraw/zinc/44/22/23/879442223.db2.gz OWMCSELLPPDMPS-HJOGWXRNSA-N 0 3 409.574 4.373 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)N[C@H](C)c2ccc(Oc3ccccc3)cc2)CC1 ZINC000465823457 879451788 /nfs/dbraw/zinc/45/17/88/879451788.db2.gz WHJUYPJBPZAWCT-NHCUHLMSSA-N 0 3 424.589 4.113 20 0 HIADHN Cc1csc(CCCCNC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)n1 ZINC000465844582 879484919 /nfs/dbraw/zinc/48/49/19/879484919.db2.gz LBYIBDJMQYMDRA-IBGZPJMESA-N 0 3 400.592 4.080 20 0 HIADHN CN(C)CCN(C[C@@H]1CCCO1)C(=O)NCc1ccccc1-c1ccc(Cl)cc1 ZINC000465848486 879490587 /nfs/dbraw/zinc/49/05/87/879490587.db2.gz PXVDYCFPUSKVOD-NRFANRHFSA-N 0 3 415.965 4.259 20 0 HIADHN Cc1ccsc1[C@H](Cc1ccccc1)NC(=O)N(CCN(C)C)C[C@H]1CCCO1 ZINC000465955255 879621386 /nfs/dbraw/zinc/62/13/86/879621386.db2.gz VXEMEEYFHJGLSB-RTWAWAEBSA-N 0 3 415.603 4.093 20 0 HIADHN CC[C@@H](NC(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1)c1ccncc1 ZINC000465959963 879627205 /nfs/dbraw/zinc/62/72/05/879627205.db2.gz WYSQTGCQUJNHHH-LJQANCHMSA-N 0 3 408.468 4.325 20 0 HIADHN COc1ccc([C@H](NC(=O)N[C@H]2CCN(C3CC3)C2)c2ccccc2Cl)c(C)c1 ZINC000466017430 879701617 /nfs/dbraw/zinc/70/16/17/879701617.db2.gz NGEDCQVPNWLYBV-AOMKIAJQSA-N 0 3 413.949 4.282 20 0 HIADHN COc1cccc([C@@H](Cc2cc(C)cc(C)c2)NC(=O)N(C)[C@H]2CCN(C3CC3)C2)c1 ZINC000466033187 879721530 /nfs/dbraw/zinc/72/15/30/879721530.db2.gz JRKREKYNVJEKQE-UKILVPOCSA-N 0 3 421.585 4.474 20 0 HIADHN CO[C@@H](CNC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1)c1ccc(Cl)cc1 ZINC000466092260 879810835 /nfs/dbraw/zinc/81/08/35/879810835.db2.gz NEJMIGBPEOQLRP-AVRDEDQJSA-N 0 3 415.965 4.334 20 0 HIADHN CCCN(C(=O)NCc1nccn1CC(C)C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000466095501 879814164 /nfs/dbraw/zinc/81/41/64/879814164.db2.gz FJCGMKGMQIQAMI-QFIPXVFZSA-N 0 3 411.594 4.125 20 0 HIADHN CCCN(C(=O)NCc1sc(C)nc1C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000466115817 879829473 /nfs/dbraw/zinc/82/94/73/879829473.db2.gz ZEGVUSIHPWDVES-FQEVSTJZSA-N 0 3 400.592 4.346 20 0 HIADHN C[C@H](CCc1cccn1C)NC(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1 ZINC000466124708 879838499 /nfs/dbraw/zinc/83/84/99/879838499.db2.gz RGHZWIAVMZYZDG-QGZVFWFLSA-N 0 3 424.511 4.138 20 0 HIADHN C[C@@H](CNC(=O)N(CC1CCCCC1)CC1CCCCC1)CN1CCN(C)CC1 ZINC000466141548 879851205 /nfs/dbraw/zinc/85/12/05/879851205.db2.gz WDCUHNGDOGGZGZ-NRFANRHFSA-N 0 3 406.659 4.042 20 0 HIADHN C[C@H](CCc1cccn1C)NC(=O)N(CCN(C)C)Cc1ccc(C(F)(F)F)cc1 ZINC000466150674 879857459 /nfs/dbraw/zinc/85/74/59/879857459.db2.gz MDSQNMHIODJDEY-QGZVFWFLSA-N 0 3 424.511 4.138 20 0 HIADHN C[C@@H]1C[C@H]1[C@@H](NC(=O)N(CCN(C)C)Cc1ccccn1)c1ccc(Cl)cc1 ZINC000466152643 879858173 /nfs/dbraw/zinc/85/81/73/879858173.db2.gz PARAPDWFIIWOBK-HBGVWJBISA-N 0 3 400.954 4.206 20 0 HIADHN CCOc1ccc([C@H](C)NC(=O)N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)cc1OC ZINC000466217927 879914123 /nfs/dbraw/zinc/91/41/23/879914123.db2.gz METKDETXKAFYJT-LQWHRVPQSA-N 0 3 411.546 4.117 20 0 HIADHN COc1ccc(-c2cncc(C(=O)N(C)[C@@H]3CCCN(Cc4ccccc4)C3)c2)cc1 ZINC000466245112 879958427 /nfs/dbraw/zinc/95/84/27/879958427.db2.gz WPRUEISFKXSNED-XMMPIXPASA-N 0 3 415.537 4.494 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)N[C@@H](c2nccs2)c2ccccc2)CN1Cc1ccccc1 ZINC000466267479 880000722 /nfs/dbraw/zinc/00/07/22/880000722.db2.gz HNBRFKZCZMDEAK-JRGCBEDISA-N 0 3 406.555 4.195 20 0 HIADHN C[C@@H](CNC(=O)N(CCN(C)C)Cc1ccc(F)c(F)c1)Sc1ccccc1 ZINC000466308710 880060880 /nfs/dbraw/zinc/06/08/80/880060880.db2.gz OQXYVZGKMLJUAQ-INIZCTEOSA-N 0 3 407.530 4.219 20 0 HIADHN Cc1cc(CNCc2cnc(-c3ccccc3)[nH]2)ccc1I ZINC000466365595 880123733 /nfs/dbraw/zinc/12/37/33/880123733.db2.gz WDTXUFNGSQBOOF-UHFFFAOYSA-N 0 3 403.267 4.280 20 0 HIADHN COc1ccc([C@H](NC(=O)N2CCCN(C)CC2)c2ccccc2Cl)c(C)c1 ZINC000466368394 880126753 /nfs/dbraw/zinc/12/67/53/880126753.db2.gz JQYCCEXVJBSDMA-NRFANRHFSA-N 0 3 401.938 4.094 20 0 HIADHN Brc1cccc(-c2c[nH]c(CNC3CCN(c4nccs4)CC3)n2)c1 ZINC000466421455 880193478 /nfs/dbraw/zinc/19/34/78/880193478.db2.gz LSTFGRRDNAQCBR-UHFFFAOYSA-N 0 3 418.364 4.054 20 0 HIADHN Cc1oc2ccccc2c1CC(=O)Nc1ccc(C(=O)N(C)[C@@H]2CCCN(C)C2)cc1 ZINC000466433818 880207755 /nfs/dbraw/zinc/20/77/55/880207755.db2.gz FTVBGNALKAMJJM-HXUWFJFHSA-N 0 3 419.525 4.089 20 0 HIADHN COc1cc(CNCc2cc3cc(Br)ccc3[nH]2)cc(OC)c1OC ZINC000466475571 880258719 /nfs/dbraw/zinc/25/87/19/880258719.db2.gz UHQVIDDLXGZDNW-UHFFFAOYSA-N 0 3 405.292 4.246 20 0 HIADHN CCN1CCC[C@@H](CN(C)C(=O)N[C@@H](C)c2cc3ccccc3o2)[C@@H]1c1cnn(C)c1 ZINC000466491688 880270488 /nfs/dbraw/zinc/27/04/88/880270488.db2.gz XKOVKNSNIYZUNW-WCAVRKLYSA-N 0 3 423.561 4.342 20 0 HIADHN COc1ccc(OC(F)F)c(NC(=O)N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)c1 ZINC000466513197 880287318 /nfs/dbraw/zinc/28/73/18/880287318.db2.gz HNVJAZFXBFLWOL-HOCLYGCPSA-N 0 3 405.445 4.081 20 0 HIADHN Cc1cccc(NC(=O)N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)c1C(=O)N1CCCC1 ZINC000466515770 880289306 /nfs/dbraw/zinc/28/93/06/880289306.db2.gz PHYLXHNRAVHIKK-CTNGQTDRSA-N 0 3 420.557 4.016 20 0 HIADHN Cc1cccc(NC(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)c1C(=O)N1CCCC1 ZINC000466515772 880289746 /nfs/dbraw/zinc/28/97/46/880289746.db2.gz PHYLXHNRAVHIKK-PZJWPPBQSA-N 0 3 420.557 4.016 20 0 HIADHN CCC(=O)Nc1ccc(Cl)c(NC(=O)N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)c1 ZINC000466518402 880292698 /nfs/dbraw/zinc/29/26/98/880292698.db2.gz YTHCHNINZNMZLG-YJBOKZPZSA-N 0 3 414.937 4.473 20 0 HIADHN COc1cc(CN(C)C(=O)N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)ccc1SC ZINC000466524535 880300980 /nfs/dbraw/zinc/30/09/80/880300980.db2.gz DRHQPWXJJMTZHU-PXNSSMCTSA-N 0 3 413.587 4.222 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)Nc2ccc(NC(=O)c3ccco3)cc2)CN1Cc1ccccc1 ZINC000466538876 880313603 /nfs/dbraw/zinc/31/36/03/880313603.db2.gz JMLFOFQAERAPNK-LAUBAEHRSA-N 0 3 418.497 4.316 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)N1CCO[C@@H](c2cccc(Cl)c2)C1 ZINC000466566746 880342219 /nfs/dbraw/zinc/34/22/19/880342219.db2.gz YFWVAVHMLDEBQY-FCHUYYIVSA-N 0 3 413.949 4.260 20 0 HIADHN CCCN1CCC[C@@H]1C(=O)N[C@H](C)c1cccc(NC(=O)Cc2ccccc2F)c1 ZINC000503521567 912571173 /nfs/dbraw/zinc/57/11/73/912571173.db2.gz OWJPGDJQJNYNIT-VGOFRKELSA-N 0 3 411.521 4.059 20 0 HIADHN CC[C@@H](NC(=O)N1CCN(CCC(C)(C)C)CC1)c1nc(C(F)(F)F)cs1 ZINC000466688466 880479270 /nfs/dbraw/zinc/47/92/70/880479270.db2.gz AJCHAQIDDKZUGR-CYBMUJFWSA-N 0 3 406.518 4.376 20 0 HIADHN CN(C(=O)Nc1cc(Br)c(F)cc1F)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000466703003 880494658 /nfs/dbraw/zinc/49/46/58/880494658.db2.gz GBSIJIHQCXZVPS-CQSZACIVSA-N 0 3 424.289 4.466 20 0 HIADHN CCc1c(NC(=O)N[C@@H](CN2CCCC2)c2ccccc2)cnn1-c1ccccc1 ZINC000466707636 880498618 /nfs/dbraw/zinc/49/86/18/880498618.db2.gz ZLOWWIIFHUTGKM-QFIPXVFZSA-N 0 3 403.530 4.393 20 0 HIADHN Cc1ccc(-c2nc(CNC(=O)N(CCCc3ccccc3)CCN(C)C)co2)cc1 ZINC000466772839 880552668 /nfs/dbraw/zinc/55/26/68/880552668.db2.gz BQNMQOIEJFSQPO-UHFFFAOYSA-N 0 3 420.557 4.356 20 0 HIADHN CC1CCN([C@H](CNC(=O)NC[C@]2(C)CCO[C@H]2C2CC2)c2cccs2)CC1 ZINC000466789471 880569054 /nfs/dbraw/zinc/56/90/54/880569054.db2.gz LNMTYGBXWJKGMT-CBQOVEMMSA-N 0 3 405.608 4.026 20 0 HIADHN CCN(C(=O)c1ccc(C(=O)NC(C)C)cc1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000503530931 912585541 /nfs/dbraw/zinc/58/55/41/912585541.db2.gz OUKGJCXTUDXKSD-CVDCTZTESA-N 0 3 407.558 4.122 20 0 HIADHN Cc1cc(C(F)(F)F)ccc1CNC(=O)N(Cc1ccco1)C1CCN(C)CC1 ZINC000466879197 880647045 /nfs/dbraw/zinc/64/70/45/880647045.db2.gz YIIXMDNTYPLWFG-UHFFFAOYSA-N 0 3 409.452 4.413 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)NC2CC(c3ccc(F)c(Cl)c3)C2)o1 ZINC000466882346 880648772 /nfs/dbraw/zinc/64/87/72/880648772.db2.gz WCOZFYADHKTLOX-UHFFFAOYSA-N 0 3 407.917 4.400 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1cccc(-c2cc[nH]n2)c1)c1cccc(OC)c1 ZINC000466914569 880683399 /nfs/dbraw/zinc/68/33/99/880683399.db2.gz WEDNRKHTVPQBDG-JOCHJYFZSA-N 0 3 407.518 4.290 20 0 HIADHN CCc1ccc([C@H](CNC(=O)c2ccc3c(c2)nc(C(F)F)n3C)N(C)C)cc1 ZINC000466986893 880798630 /nfs/dbraw/zinc/79/86/30/880798630.db2.gz IEGOSNJONJOMCU-IBGZPJMESA-N 0 3 400.473 4.106 20 0 HIADHN COCc1ccc([C@H]2CCCN2CCc2nc3sc4c(c3c(N)n2)CCCC4)o1 ZINC000467019812 880822056 /nfs/dbraw/zinc/82/20/56/880822056.db2.gz DAGCGFXVJKZBEI-MRXNPFEDSA-N 0 3 412.559 4.271 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)c2cccc(-c3noc(C4CC4)n3)c2)CN1Cc1ccccc1 ZINC000467021323 880822926 /nfs/dbraw/zinc/82/29/26/880822926.db2.gz GDTXNHVYHWXBMC-IIBYNOLFSA-N 0 3 402.498 4.007 20 0 HIADHN C[C@H](C(=O)N[C@H]1C[C@@H](C)N(Cc2ccccc2)C1)c1ccc(Br)s1 ZINC000467025074 880825932 /nfs/dbraw/zinc/82/59/32/880825932.db2.gz QYHCCNGYEZZGKJ-YCPHGPKFSA-N 0 3 407.377 4.393 20 0 HIADHN Cc1ccc(-c2cnc(CCC(=O)N[C@H]3C[C@H](C)N(Cc4ccccc4)C3)o2)cc1 ZINC000467033931 880831609 /nfs/dbraw/zinc/83/16/09/880831609.db2.gz CYCDUZNTBGVQFB-UGKGYDQZSA-N 0 3 403.526 4.362 20 0 HIADHN C[C@H](NC(=O)N1CCN(C2CCC(C)CC2)CC1)c1nc(C2CCCCC2)no1 ZINC000467035317 880833904 /nfs/dbraw/zinc/83/39/04/880833904.db2.gz UQZMHZDQDFAMBU-HFCFLWKCSA-N 0 3 403.571 4.084 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)[C@H]2C[C@H]2c2ccccc2OC(F)F)CN1Cc1ccccc1 ZINC000467044485 880839463 /nfs/dbraw/zinc/83/94/63/880839463.db2.gz JFVFIRAXHDOUCR-LQJIQPLVSA-N 0 3 400.469 4.171 20 0 HIADHN COc1ccc(C(C)(C)C(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)cc1OC ZINC000467105409 880865274 /nfs/dbraw/zinc/86/52/74/880865274.db2.gz OSCLIZUOLXJNMT-NRFANRHFSA-N 0 3 410.558 4.243 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)N2CCC[C@@H]2c2cc(F)cc(Br)c2)CN1C1CC1 ZINC000467228497 880957938 /nfs/dbraw/zinc/95/79/38/880957938.db2.gz IPWXLEUONCDCGT-XHBKTUGNSA-N 0 3 410.331 4.060 20 0 HIADHN COCC[C@@H]1CCCCN(CC(=O)N[C@H](c2cccs2)c2ccc(F)cc2)C1 ZINC000467272706 881014472 /nfs/dbraw/zinc/01/44/72/881014472.db2.gz HAOIZWBURXZBFP-JTSKRJEESA-N 0 3 404.551 4.231 20 0 HIADHN Cc1cccc(NC(=O)C[C@@H](C)NCc2cc(Cl)ccc2N2CCOCC2)c1C ZINC000467336906 881087284 /nfs/dbraw/zinc/08/72/84/881087284.db2.gz SNDOWAXHUQIVGN-QGZVFWFLSA-N 0 3 415.965 4.300 20 0 HIADHN Fc1cncc([C@@H](NCc2nc(-c3ccc(Br)cc3)n[nH]2)C2CC2)c1 ZINC000467357468 881120148 /nfs/dbraw/zinc/12/01/48/881120148.db2.gz XKKPXLGWNOZUKK-KRWDZBQOSA-N 0 3 402.271 4.009 20 0 HIADHN C[C@H](CCc1cccc(F)c1)N1CCCN(c2nnc(C(F)(F)F)s2)CC1 ZINC000467360309 881125916 /nfs/dbraw/zinc/12/59/16/881125916.db2.gz XJNJCASHXQCHGE-CYBMUJFWSA-N 0 3 402.461 4.229 20 0 HIADHN CCCCOc1ccc(CN[C@H](C)c2ccc(S(=O)(=O)NC)cc2)cc1Cl ZINC000467386439 881166768 /nfs/dbraw/zinc/16/67/68/881166768.db2.gz WONRCMVFFMOGIN-OAHLLOKOSA-N 0 3 410.967 4.278 20 0 HIADHN COc1ccc2c(c1)[C@H](N[C@@H]1CC(=O)N(C)[C@H]1c1ccc(F)c(F)c1)CCS2 ZINC000467394021 881178296 /nfs/dbraw/zinc/17/82/96/881178296.db2.gz BGASBNATLWXEFH-OPYAIIAOSA-N 0 3 404.482 4.072 20 0 HIADHN CCS(=O)(=O)c1cccc(CN[C@H]2CCCc3cc(Br)ccc32)c1 ZINC000467401155 881185370 /nfs/dbraw/zinc/18/53/70/881185370.db2.gz BINJZHMCQMJXAH-IBGZPJMESA-N 0 3 408.361 4.410 20 0 HIADHN Cc1cc(C(F)(F)F)ccc1CN[C@H](C)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000467415360 881202625 /nfs/dbraw/zinc/20/26/25/881202625.db2.gz DPNNJFJKARHIHH-CQSZACIVSA-N 0 3 400.466 4.115 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](NC[C@@H](CO)CC2CCCC2)c2ccc(F)cc2)c1 ZINC000467444717 881247064 /nfs/dbraw/zinc/24/70/64/881247064.db2.gz PXNPTPKBBFEJTM-MBSDFSHPSA-N 0 3 419.562 4.097 20 0 HIADHN Cc1ccnc(-c2ccc(NC(=O)N[C@H]3C[C@@H](C)N(Cc4ccccc4)C3)cc2)n1 ZINC000467474044 881292078 /nfs/dbraw/zinc/29/20/78/881292078.db2.gz TYWJHIPGQIRSHE-GCJKJVERSA-N 0 3 401.514 4.237 20 0 HIADHN CC(C)N1CCCN(C(=O)C(=O)Nc2ccc(F)cc2-c2ccc(Cl)cc2)CC1 ZINC000503585881 912672270 /nfs/dbraw/zinc/67/22/70/912672270.db2.gz SNHJVGSGNBSSDM-UHFFFAOYSA-N 0 3 417.912 4.027 20 0 HIADHN Cc1ccc(-c2nc(C(=O)NCc3ccccc3CN3CCC(O)CC3)cs2)cc1 ZINC000467498013 881314589 /nfs/dbraw/zinc/31/45/89/881314589.db2.gz AJAGBWYKKCAEQH-UHFFFAOYSA-N 0 3 421.566 4.005 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)CCCC(=O)c1ccc(C)cc1 ZINC000467512566 881326840 /nfs/dbraw/zinc/32/68/40/881326840.db2.gz IJOSSBVIOZGGHC-HSZRJFAPSA-N 0 3 407.558 4.256 20 0 HIADHN C[C@@H](N[C@@H]1CCCN(Cc2ccc(F)cc2F)C1=O)c1cccc(OC(F)F)c1 ZINC000469103878 883194237 /nfs/dbraw/zinc/19/42/37/883194237.db2.gz WSTDZOMHRIDBNO-BFUOFWGJSA-N 0 3 410.411 4.408 20 0 HIADHN CN(C)Cc1cccc(C(=O)Nc2ccnn2Cc2cccc(Br)c2)c1 ZINC000469135018 883231617 /nfs/dbraw/zinc/23/16/17/883231617.db2.gz ZNQNHDUENXUUOR-UHFFFAOYSA-N 0 3 413.319 4.008 20 0 HIADHN C[C@H](N[C@@H]1CCCN(Cc2ccc(F)cc2F)C1=O)c1ccc2ncsc2c1 ZINC000469154404 883252837 /nfs/dbraw/zinc/25/28/37/883252837.db2.gz YTYYRYDGYIWCHR-ORAYPTAESA-N 0 3 401.482 4.416 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3ccc4oc(C(F)(F)F)nc4c3)cc2)CC1 ZINC000469240231 883338392 /nfs/dbraw/zinc/33/83/92/883338392.db2.gz LHNHSBZIFZFYMR-UHFFFAOYSA-N 0 3 418.419 4.241 20 0 HIADHN COc1cccc(NC(=O)[C@@H](NC2CCN(c3nccs3)CC2)c2ccccc2)c1 ZINC000503603484 912696098 /nfs/dbraw/zinc/69/60/98/912696098.db2.gz UDNPUKLOYSLWAY-NRFANRHFSA-N 0 3 422.554 4.090 20 0 HIADHN NC(=O)C1CCN(c2ncccc2CN[C@@H](CC2CC2)c2ccc(Cl)cc2)CC1 ZINC000469246849 883344714 /nfs/dbraw/zinc/34/47/14/883344714.db2.gz WPIIUUGOKWCDAC-NRFANRHFSA-N 0 3 412.965 4.068 20 0 HIADHN COCc1ccc([C@@H]2CCCN2C(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)o1 ZINC000469264154 883361385 /nfs/dbraw/zinc/36/13/85/883361385.db2.gz QQVJNWNVAHUFIM-NQIIRXRSSA-N 0 3 400.494 4.141 20 0 HIADHN COc1ccc2cc([C@H](C)NCc3cccc(C(=O)N4CCOCC4)c3)ccc2c1 ZINC000469280028 883377116 /nfs/dbraw/zinc/37/71/16/883377116.db2.gz VOFALMDNWZBMLU-SFHVURJKSA-N 0 3 404.510 4.172 20 0 HIADHN CCOC(=O)[C@@](C)(CN[C@@H](C)C(=O)Nc1ccc(Cl)cc1C)c1ccccc1 ZINC000469305896 883403973 /nfs/dbraw/zinc/40/39/73/883403973.db2.gz UTZCKMFEQGKFFN-AOMKIAJQSA-N 0 3 402.922 4.086 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)NC[C@H]1CCO[C@@H]1c1ccccc1 ZINC000469436285 883623369 /nfs/dbraw/zinc/62/33/69/883623369.db2.gz LNMOVEQEHGRKGL-TZRRMPRUSA-N 0 3 409.574 4.220 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)NCc1nc(C(F)(F)F)cs1 ZINC000469435850 883624373 /nfs/dbraw/zinc/62/43/73/883624373.db2.gz GZTBTYVIYXKAIV-OAHLLOKOSA-N 0 3 414.497 4.118 20 0 HIADHN CCC[C@H](NC(=O)N[C@@H](CN(C)Cc1ccccc1)C(C)C)c1nnc2ccccn21 ZINC000469437498 883626860 /nfs/dbraw/zinc/62/68/60/883626860.db2.gz YZKBKLHTZZOLCR-SFTDATJTSA-N 0 3 422.577 4.026 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1ccc(Cl)c(N)c1Cl)c1cccc(OC)c1 ZINC000469443343 883635991 /nfs/dbraw/zinc/63/59/91/883635991.db2.gz VRISSCBMAUUWBG-QGZVFWFLSA-N 0 3 410.345 4.397 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)c1ccc2c(c1)NC(=O)[C@H](C)S2 ZINC000469479180 883710462 /nfs/dbraw/zinc/71/04/62/883710462.db2.gz CLMGPLJZCLDPRT-JXFKEZNVSA-N 0 3 411.571 4.006 20 0 HIADHN COC(=O)c1ccc(C(C)C)c(NC(=O)c2ccc(CN3CCC(CO)CC3)cc2)c1 ZINC000469505707 883755615 /nfs/dbraw/zinc/75/56/15/883755615.db2.gz WTTVYOCGCIHEBE-UHFFFAOYSA-N 0 3 424.541 4.053 20 0 HIADHN CSc1cc(C(=O)N[C@@H](CN(C)Cc2ccccc2)C(C)C)ccc1NC(C)=O ZINC000469507278 883760752 /nfs/dbraw/zinc/76/07/52/883760752.db2.gz UZJNHNZOWKKGFH-NRFANRHFSA-N 0 3 413.587 4.253 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)Nc3ccc(Oc4ccccn4)cc3)CC2)c1 ZINC000469514172 883775344 /nfs/dbraw/zinc/77/53/44/883775344.db2.gz RZULLQZBGGDQON-UHFFFAOYSA-N 0 3 416.525 4.333 20 0 HIADHN CN(C)C(=O)c1cnc(NC[C@H](c2cccc(C(F)(F)F)c2)N(C)C)c(Cl)c1 ZINC000469557869 883813476 /nfs/dbraw/zinc/81/34/76/883813476.db2.gz CSRWQDWKFUNDDZ-MRXNPFEDSA-N 0 3 414.859 4.170 20 0 HIADHN C[C@H]1CC[C@H](C)N1CC(=O)NCc1ccc(Oc2ccccc2C(F)(F)F)nc1 ZINC000469605706 883831782 /nfs/dbraw/zinc/83/17/82/883831782.db2.gz WPFWNSBKBMABIT-GJZGRUSLSA-N 0 3 407.436 4.382 20 0 HIADHN C[C@H](c1cccc(NS(C)(=O)=O)c1)N1CCC(Cc2ccc(F)c(F)c2)CC1 ZINC000469809429 883984261 /nfs/dbraw/zinc/98/42/61/883984261.db2.gz NHSSITUZOKJMCL-OAHLLOKOSA-N 0 3 408.514 4.352 20 0 HIADHN O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)[C@@H]1C[C@H]1c1cccc2ccccc21 ZINC000469848697 884032292 /nfs/dbraw/zinc/03/22/92/884032292.db2.gz MKQYSJZQXVJJQL-ZSQFBXSQSA-N 0 3 414.549 4.351 20 0 HIADHN O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)c1ccc(-c2ccc(F)cc2)o1 ZINC000469849816 884032573 /nfs/dbraw/zinc/03/25/73/884032573.db2.gz CEPCXLMCYLDLDN-OAQYLSRUSA-N 0 3 408.473 4.107 20 0 HIADHN CC(C)(C(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1)c1cccc(Cl)c1 ZINC000469855635 884041535 /nfs/dbraw/zinc/04/15/35/884041535.db2.gz QEMQFDUDCDFMJX-OAQYLSRUSA-N 0 3 400.950 4.025 20 0 HIADHN CC(C)(C(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1)c1cccc(Cl)c1F ZINC000469861805 884046839 /nfs/dbraw/zinc/04/68/39/884046839.db2.gz YINIGPGRSGBKJO-SFHVURJKSA-N 0 3 418.940 4.164 20 0 HIADHN O=C(CCN1CCN(c2ccccc2)CC1)N[C@H](Cc1ccccc1)c1cccs1 ZINC000469911754 884101706 /nfs/dbraw/zinc/10/17/06/884101706.db2.gz YRDPAALWYMBKOM-HSZRJFAPSA-N 0 3 419.594 4.360 20 0 HIADHN COc1ccc(C[C@@H](C)CN2CCCN(C(=O)c3cccc(F)c3)CC2)cc1F ZINC000469911555 884102850 /nfs/dbraw/zinc/10/28/50/884102850.db2.gz RZMSTCUJXOXOOF-QGZVFWFLSA-N 0 3 402.485 4.000 20 0 HIADHN Cn1cc(NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)c(-c2ccccc2)n1 ZINC000469919533 884110654 /nfs/dbraw/zinc/11/06/54/884110654.db2.gz QMOOYJKJQPCPCH-UHFFFAOYSA-N 0 3 421.467 4.014 20 0 HIADHN CCc1c(C(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)cnn1-c1ccccc1OC ZINC000469924265 884117212 /nfs/dbraw/zinc/11/72/12/884117212.db2.gz CLHDGLNSIFTFRR-QUCCMNQESA-N 0 3 418.541 4.009 20 0 HIADHN CC(=O)c1ccc(NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cc1Cl ZINC000469925933 884119600 /nfs/dbraw/zinc/11/96/00/884119600.db2.gz IGBGIBADSZXQNM-UHFFFAOYSA-N 0 3 417.859 4.469 20 0 HIADHN CC(C)[C@H](NC(=O)NCC(C)(C)N1CCc2ccccc2C1)c1nc2ccccc2[nH]1 ZINC000503686168 912792539 /nfs/dbraw/zinc/79/25/39/912792539.db2.gz SUWWAKDDZQUHIX-QFIPXVFZSA-N 0 3 419.573 4.396 20 0 HIADHN C[C@H](CC(=O)NC1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1)C(=O)c1cccc(F)c1 ZINC000469961606 884168981 /nfs/dbraw/zinc/16/89/81/884168981.db2.gz HFFFJXYBZYXOAA-JYBLXFRWSA-N 0 3 408.517 4.346 20 0 HIADHN CCN(CC)CC(=O)N[C@H](C)c1sc(-c2ccccc2Br)nc1C ZINC000503696040 912800773 /nfs/dbraw/zinc/80/07/73/912800773.db2.gz CTGWTHQIWLKBAZ-GFCCVEGCSA-N 0 3 410.381 4.400 20 0 HIADHN CCCN(C(=O)N[C@@H](CC)C1CCOCC1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470026680 884247912 /nfs/dbraw/zinc/24/79/12/884247912.db2.gz GNSJPYLOWBVOMD-PKTZIBPZSA-N 0 3 401.595 4.278 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N[C@@H](C)c2ccccc2-n2cccn2)C1 ZINC000470034348 884269290 /nfs/dbraw/zinc/26/92/90/884269290.db2.gz PBGYOZFDAHCZLI-ZVDOUQERSA-N 0 3 403.530 4.068 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@@H]2NC(=O)N[C@@H](CN2CCCC2)c2ccccc2)cc1 ZINC000470077551 884333734 /nfs/dbraw/zinc/33/37/34/884333734.db2.gz YLAPNZYKPBKSHV-HJOGWXRNSA-N 0 3 407.558 4.351 20 0 HIADHN COc1cc(NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)ccc1Cl ZINC000470132468 884396928 /nfs/dbraw/zinc/39/69/28/884396928.db2.gz LBJQFQBTUMIOGT-UHFFFAOYSA-N 0 3 405.848 4.275 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)C1(OCc2ccccc2)CCOCC1 ZINC000470168361 884446078 /nfs/dbraw/zinc/44/60/78/884446078.db2.gz ZOQIVONIOYUPLQ-XMMPIXPASA-N 0 3 424.585 4.025 20 0 HIADHN C[C@@H](NC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C)c1ccccc1-n1cccn1 ZINC000470178245 884461555 /nfs/dbraw/zinc/46/15/55/884461555.db2.gz JFLDJZVKWFXGBS-NHCUHLMSSA-N 0 3 417.557 4.239 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)C1(c2cccc(F)c2)CCOCC1 ZINC000470199784 884512999 /nfs/dbraw/zinc/51/29/99/884512999.db2.gz GPEROCYVDJQSLT-QHCPKHFHSA-N 0 3 412.549 4.147 20 0 HIADHN CCc1ccc([C@H](NCC2(OCCO)CCOCC2)c2ccccc2Cl)cc1 ZINC000503858822 912844405 /nfs/dbraw/zinc/84/44/05/912844405.db2.gz SFSBJAVUOXRLDA-QFIPXVFZSA-N 0 3 403.950 4.140 20 0 HIADHN COc1cc(F)c(C(=O)NC[C@H](c2ccccc2)N2CCC(C)CC2)cc1OC ZINC000470342789 884733252 /nfs/dbraw/zinc/73/32/52/884733252.db2.gz DHQLWFGESJQPDJ-HXUWFJFHSA-N 0 3 400.494 4.046 20 0 HIADHN C[C@@H]1CCC[C@@H]1CC(=O)NC1CCN(CCOc2ccc(Br)cc2)CC1 ZINC000470360157 884752896 /nfs/dbraw/zinc/75/28/96/884752896.db2.gz YFGXRYVTBSJDJB-IAGOWNOFSA-N 0 3 423.395 4.235 20 0 HIADHN Cc1c([C@H](C)N[C@@H]2CCCC23CCOCC3)nnn1-c1cccc(Br)c1 ZINC000503911532 912861803 /nfs/dbraw/zinc/86/18/03/912861803.db2.gz PHEQZXNJIFQNCZ-KBXCAEBGSA-N 0 3 419.367 4.338 20 0 HIADHN C[C@H](NCC1(OCCO)CCOCC1)c1ccc(Oc2ccc(F)cc2)cc1Cl ZINC000503931017 912869770 /nfs/dbraw/zinc/86/97/70/912869770.db2.gz UYLLRMILISBDKW-INIZCTEOSA-N 0 3 423.912 4.480 20 0 HIADHN O=C(Nc1cccc(-c2cc[nH]n2)c1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000470647731 885071630 /nfs/dbraw/zinc/07/16/30/885071630.db2.gz AKJYOHULGVHFDK-UHFFFAOYSA-N 0 3 407.440 4.004 20 0 HIADHN CN(C(=O)c1cccc(-c2noc(C3CC3)n2)c1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470656700 885077958 /nfs/dbraw/zinc/07/79/58/885077958.db2.gz JECWKBTWXRZXIL-JOCHJYFZSA-N 0 3 416.525 4.351 20 0 HIADHN Cc1ccc(-c2nc(CC(=O)N(C)[C@@H]3CCCN(Cc4ccccc4)C3)cs2)o1 ZINC000470658126 885080110 /nfs/dbraw/zinc/08/01/10/885080110.db2.gz WXUQCOHNGHGUTK-HXUWFJFHSA-N 0 3 409.555 4.377 20 0 HIADHN Cc1cc(C(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)c2cnn(C(C)C)c2n1 ZINC000470658463 885083273 /nfs/dbraw/zinc/08/32/73/885083273.db2.gz BHPCJFGCGNYQKW-HXUWFJFHSA-N 0 3 405.546 4.057 20 0 HIADHN CN(C(=O)c1cccc(Oc2cnccn2)c1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470663765 885089667 /nfs/dbraw/zinc/08/96/67/885089667.db2.gz ZEERPMDCZBTITM-OAQYLSRUSA-N 0 3 402.498 4.006 20 0 HIADHN CN(C(=O)c1cccc(Oc2cnccn2)c1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470663764 885090571 /nfs/dbraw/zinc/09/05/71/885090571.db2.gz ZEERPMDCZBTITM-NRFANRHFSA-N 0 3 402.498 4.006 20 0 HIADHN CN(C(=O)c1ccnc(SCC(F)(F)F)c1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470664361 885090876 /nfs/dbraw/zinc/09/08/76/885090876.db2.gz XOJULBAMRRVBNB-SFHVURJKSA-N 0 3 423.504 4.473 20 0 HIADHN Cc1nc2c(cnn2C(C)C)cc1C(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470664754 885092001 /nfs/dbraw/zinc/09/20/01/885092001.db2.gz AXTMIVBIMKBQRE-OAQYLSRUSA-N 0 3 405.546 4.057 20 0 HIADHN CN(C(=O)c1ccc(OCC(F)(F)F)cc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470666532 885093413 /nfs/dbraw/zinc/09/34/13/885093413.db2.gz GRBWEFZDNUVNBU-LJQANCHMSA-N 0 3 406.448 4.364 20 0 HIADHN CC(=O)c1ccc(OCCCC(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000470671620 885101051 /nfs/dbraw/zinc/10/10/51/885101051.db2.gz ZPVMUTLNQFRKJU-QHCPKHFHSA-N 0 3 408.542 4.171 20 0 HIADHN CC(C)c1nc(CCNC(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)cs1 ZINC000470719524 885162485 /nfs/dbraw/zinc/16/24/85/885162485.db2.gz IBZDAAPQWBXHHQ-HXUWFJFHSA-N 0 3 400.592 4.115 20 0 HIADHN CN(C(=O)NCCc1c[nH]c2cc(F)ccc12)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470719179 885162793 /nfs/dbraw/zinc/16/27/93/885162793.db2.gz CFMBAJVGAXXWJG-OAQYLSRUSA-N 0 3 408.521 4.156 20 0 HIADHN CCc1cccc2c1OCC[C@@H]2NC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470719903 885164535 /nfs/dbraw/zinc/16/45/35/885164535.db2.gz MWFGTPFTIJPMBT-GMAHTHKFSA-N 0 3 407.558 4.379 20 0 HIADHN CN(C(=O)N[C@H](c1ccccc1)[C@@H]1CCCO1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470726646 885178375 /nfs/dbraw/zinc/17/83/75/885178375.db2.gz NYPNUBSVANMMGS-TZRRMPRUSA-N 0 3 407.558 4.213 20 0 HIADHN CC(=O)Nc1cccc([C@H](C)NC(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000470736105 885191914 /nfs/dbraw/zinc/19/19/14/885191914.db2.gz GLHUUCORYMUZED-MBSDFSHPSA-N 0 3 408.546 4.012 20 0 HIADHN C[C@H](OCCCNC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1)c1ccccc1 ZINC000470740441 885200715 /nfs/dbraw/zinc/20/07/15/885200715.db2.gz MEEQFUHJUOBFEO-XUZZJYLKSA-N 0 3 409.574 4.460 20 0 HIADHN CN(Cc1ccc(Oc2ccccc2)c(F)c1)C[C@@H]1C[C@H](F)CN1Cc1ncccn1 ZINC000470800035 885286652 /nfs/dbraw/zinc/28/66/52/885286652.db2.gz AVWPDVOYXVMNDC-PMACEKPBSA-N 0 3 424.495 4.452 20 0 HIADHN CN(Cc1cc(F)cc(Br)c1)C[C@@H]1C[C@H](F)CN1Cc1nccs1 ZINC000470822947 885311849 /nfs/dbraw/zinc/31/18/49/885311849.db2.gz VQMZXDJEMZXGTB-HOTGVXAUSA-N 0 3 416.335 4.089 20 0 HIADHN O=C(c1cn(Cc2ccccc2)nc1-c1ccc(Cl)cc1)N1CCN2CCC1CC2 ZINC000470845669 885342809 /nfs/dbraw/zinc/34/28/09/885342809.db2.gz SIHYNIOYDXQGSG-UHFFFAOYSA-N 0 3 420.944 4.172 20 0 HIADHN CO[C@H](CNC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1)c1ccc(Cl)cc1 ZINC000470894994 885394507 /nfs/dbraw/zinc/39/45/07/885394507.db2.gz PRCLRYZXNIQARG-FCHUYYIVSA-N 0 3 415.965 4.334 20 0 HIADHN CN(Cc1cccc(OC(F)(F)F)c1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000470899175 885398915 /nfs/dbraw/zinc/39/89/15/885398915.db2.gz HGAXXQNFVMYXBX-SFHVURJKSA-N 0 3 407.436 4.001 20 0 HIADHN Cn1nc(C(F)F)c2cc(C(=O)NC[C@@H]3CCCN(C)[C@@H]3c3cccs3)sc21 ZINC000470996076 885496764 /nfs/dbraw/zinc/49/67/64/885496764.db2.gz VCTZJFHUDVSUFW-ZBEGNZNMSA-N 0 3 424.542 4.447 20 0 HIADHN CN1CCN(CC(=O)Nc2ccc(Cl)cc2C(F)(F)F)C2(CCCCC2)C1 ZINC000471040151 885551272 /nfs/dbraw/zinc/55/12/72/885551272.db2.gz YMKCLAFJDYEENY-UHFFFAOYSA-N 0 3 403.876 4.248 20 0 HIADHN C[C@H]1CCN(C(=O)NCc2nnc(-c3ccccc3)s2)CCN1Cc1ccccc1 ZINC000471077636 885602531 /nfs/dbraw/zinc/60/25/31/885602531.db2.gz FXNSGZQFJSUVRV-SFHVURJKSA-N 0 3 421.570 4.011 20 0 HIADHN O=C(Nc1nc2c(s1)CCCCC2)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000471115020 885650740 /nfs/dbraw/zinc/65/07/40/885650740.db2.gz USIPZKSRDZMEHY-UHFFFAOYSA-N 0 3 416.513 4.339 20 0 HIADHN CCN1CCc2nc3ccccc3c(C(=O)N[C@@H](C)[C@H](c3ccccc3)N(C)C)c2C1 ZINC000471122152 885659062 /nfs/dbraw/zinc/65/90/62/885659062.db2.gz WRMOEFFPHKLGPS-AVRWGWEMSA-N 0 3 416.569 4.034 20 0 HIADHN C[C@H]1CCc2nc(NC(=O)NC3CC(N4CCC(C(F)(F)F)CC4)C3)sc2C1 ZINC000471121718 885659120 /nfs/dbraw/zinc/65/91/20/885659120.db2.gz JJSOIMWIMRDRMI-XGNXJENSSA-N 0 3 416.513 4.195 20 0 HIADHN CC(=O)Nc1cc(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)cc(C(F)(F)F)c1 ZINC000471173806 885734198 /nfs/dbraw/zinc/73/41/98/885734198.db2.gz UEFXWGOJNGTHTQ-FQEVSTJZSA-N 0 3 419.447 4.231 20 0 HIADHN O=C(Nc1cccc(N2CCCC2)c1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000471243575 885820190 /nfs/dbraw/zinc/82/01/90/885820190.db2.gz KVWGNYVVJCOKOE-UHFFFAOYSA-N 0 3 410.484 4.214 20 0 HIADHN COC1CCC(C)(CNC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)CC1 ZINC000471262429 885840621 /nfs/dbraw/zinc/84/06/21/885840621.db2.gz LZRFNGZTADFRKY-DQVLVPHSSA-N 0 3 412.496 4.153 20 0 HIADHN CCOc1ccc(OC)cc1NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000471287865 885870968 /nfs/dbraw/zinc/87/09/68/885870968.db2.gz LJKBAKLDXRFDJI-UHFFFAOYSA-N 0 3 415.456 4.021 20 0 HIADHN Cc1ccc(F)cc1-c1nnc(NC(=O)N2CCN(C3CCCCC3)CC2)s1 ZINC000471350909 885964449 /nfs/dbraw/zinc/96/44/49/885964449.db2.gz QGRKDUWNYPYQIH-UHFFFAOYSA-N 0 3 403.527 4.135 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N[C@@H]1C[C@H]1c1ccc(OC(F)F)cc1)c1ccco1 ZINC000504104005 913012170 /nfs/dbraw/zinc/01/21/70/913012170.db2.gz NDZADTARJORAPT-RUGDWHBFSA-N 0 3 407.461 4.166 20 0 HIADHN CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)Nc1cccc(Br)c1 ZINC000471494421 886194675 /nfs/dbraw/zinc/19/46/75/886194675.db2.gz BYLAIDQXHOVHKJ-YJBOKZPZSA-N 0 3 403.324 4.001 20 0 HIADHN Cc1ccc(C(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)cc1NC(=O)c1ccco1 ZINC000471527651 886230712 /nfs/dbraw/zinc/23/07/12/886230712.db2.gz CXQFSTJUGPBSQX-VGSWGCGISA-N 0 3 405.498 4.262 20 0 HIADHN Cc1cccc(NC(=O)N2CCC[C@H](C(=O)N[C@@H](C)[C@H](c3ccccc3)N(C)C)C2)c1 ZINC000471530668 886234219 /nfs/dbraw/zinc/23/42/19/886234219.db2.gz LWLKDLWKYSXLTJ-IEIRFRATSA-N 0 3 422.573 4.047 20 0 HIADHN C[C@@H](NC(=O)CCc1nc(-c2ccc(Cl)cc2)no1)[C@H](c1ccccc1)N(C)C ZINC000471535161 886240203 /nfs/dbraw/zinc/24/02/03/886240203.db2.gz DUQXNXORIFWUTK-QVKFZJNVSA-N 0 3 412.921 4.130 20 0 HIADHN C[C@H](NC(=O)c1ccc(CNC(=O)c2cccs2)cc1)[C@H](c1ccccc1)N(C)C ZINC000471547547 886254603 /nfs/dbraw/zinc/25/46/03/886254603.db2.gz NXHPNUZZHMMUOL-HTAPYJJXSA-N 0 3 421.566 4.099 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)Nc1cccc(OCc2cscn2)c1 ZINC000504117336 913023688 /nfs/dbraw/zinc/02/36/88/913023688.db2.gz WKBZLTXNSDGEIL-UHFFFAOYSA-N 0 3 422.554 4.292 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)NC2(c3c(Cl)cccc3Cl)CC2)CC1 ZINC000471558921 886267533 /nfs/dbraw/zinc/26/75/33/886267533.db2.gz ZHLUKCNJCOXQCI-UHFFFAOYSA-N 0 3 414.377 4.171 20 0 HIADHN C[C@H](NC(=O)CCSc1ccc2c(c1)OCCCO2)[C@H](c1ccccc1)N(C)C ZINC000471564407 886273320 /nfs/dbraw/zinc/27/33/20/886273320.db2.gz UFIKUQXUISCQNL-GAJHUEQPSA-N 0 3 414.571 4.138 20 0 HIADHN C[C@@H](NC(=O)[C@H](C)Oc1ccccc1Br)[C@@H](c1ccccc1)N(C)C ZINC000471569494 886280357 /nfs/dbraw/zinc/28/03/57/886280357.db2.gz HOJNGFTZORDMAN-VCBZYWHSSA-N 0 3 405.336 4.024 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)[C@@H]3C[C@H]3c3ccccc3OC(F)F)c2)CC1 ZINC000471621588 886339874 /nfs/dbraw/zinc/33/98/74/886339874.db2.gz NQDNKXUHJRFOOP-VQTJNVASSA-N 0 3 415.484 4.172 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)[C@H]3C[C@H]3c3ccccc3OC(F)F)c2)CC1 ZINC000471621586 886339991 /nfs/dbraw/zinc/33/99/91/886339991.db2.gz NQDNKXUHJRFOOP-PMACEKPBSA-N 0 3 415.484 4.172 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)CCCc3nc4ccccc4s3)c2)CC1 ZINC000471628319 886346864 /nfs/dbraw/zinc/34/68/64/886346864.db2.gz UGMHPIAURJMMBE-UHFFFAOYSA-N 0 3 408.571 4.400 20 0 HIADHN CCOc1ccccc1OCCCC(=O)Nc1cccc(N2CCN(CC)CC2)c1 ZINC000471642135 886357158 /nfs/dbraw/zinc/35/71/58/886357158.db2.gz ALGGRQACSVXWNK-UHFFFAOYSA-N 0 3 411.546 4.025 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)CCc3ncc(-c4ccccc4)o3)c2)CC1 ZINC000471642894 886358460 /nfs/dbraw/zinc/35/84/60/886358460.db2.gz NTCHQRQCPPBFEZ-UHFFFAOYSA-N 0 3 404.514 4.055 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)c3cc(C(C)C)nc4onc(C)c43)c2)CC1 ZINC000471643270 886358552 /nfs/dbraw/zinc/35/85/52/886358552.db2.gz HEFZFWRDOKQJMT-UHFFFAOYSA-N 0 3 407.518 4.049 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)CCc3ccc(OC(F)F)cc3)c2)CC1 ZINC000471663703 886376644 /nfs/dbraw/zinc/37/66/44/886376644.db2.gz JYMZKWGLLCEJCR-UHFFFAOYSA-N 0 3 403.473 4.001 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cc2c(C(F)F)nn(C)c2s1)c1ccsc1 ZINC000471749270 886477138 /nfs/dbraw/zinc/47/71/38/886477138.db2.gz QXSBXUJYCDWQID-ZDUSSCGKSA-N 0 3 412.531 4.447 20 0 HIADHN Cc1ccc([C@@H](NC(=O)NC[C@H](c2ccc(C)cc2)N(C)C)c2ccccn2)cc1 ZINC000471765868 886497993 /nfs/dbraw/zinc/49/79/93/886497993.db2.gz DESVDAHZPJHUEY-DNQXCXABSA-N 0 3 402.542 4.390 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N[C@@H](c2ccc(C)cc2)c2ccccn2)N(C)C)cc1 ZINC000471765869 886498918 /nfs/dbraw/zinc/49/89/18/886498918.db2.gz DESVDAHZPJHUEY-RPWUZVMVSA-N 0 3 402.542 4.390 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)c1cc(F)ccc1-c1ccoc1 ZINC000471797379 886533500 /nfs/dbraw/zinc/53/35/00/886533500.db2.gz IMHLLFQALSNVJA-UHFFFAOYSA-N 0 3 421.516 4.418 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)c1ccc(N2CCCCC2)cc1 ZINC000471826750 886576745 /nfs/dbraw/zinc/57/67/45/886576745.db2.gz YVRLMSULAPMUBE-UHFFFAOYSA-N 0 3 420.601 4.009 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)c(OC)c1 ZINC000504176143 913059386 /nfs/dbraw/zinc/05/93/86/913059386.db2.gz JREJMJALMITETG-NOXFTYBFSA-N 0 3 423.557 4.386 20 0 HIADHN COC(=O)c1cc(NC(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)c(C)cc1C ZINC000471863556 886639912 /nfs/dbraw/zinc/63/99/12/886639912.db2.gz OZZQZHLXGCHAMA-LJQANCHMSA-N 0 3 409.530 4.218 20 0 HIADHN CSc1cc(C(=O)NCCCCN2C[C@@H](C)O[C@@H](C)C2)c(Cl)cc1Cl ZINC000471908993 886693641 /nfs/dbraw/zinc/69/36/41/886693641.db2.gz HFFFHEANFSGWMX-BETUJISGSA-N 0 3 405.391 4.335 20 0 HIADHN CC(C)(CNC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1cccs1 ZINC000471914898 886701181 /nfs/dbraw/zinc/70/11/81/886701181.db2.gz LKRPXYIZAHBVLJ-UHFFFAOYSA-N 0 3 403.514 4.130 20 0 HIADHN Cc1cc(C(=O)Nc2cccc(CN3CCC(O)CC3)c2)c(Br)s1 ZINC000471920265 886708567 /nfs/dbraw/zinc/70/85/67/886708567.db2.gz PUAAKXBQPOZZLH-UHFFFAOYSA-N 0 3 409.349 4.028 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)c1cccc(-n2ccc(C(F)(F)F)n2)c1 ZINC000471925999 886715923 /nfs/dbraw/zinc/71/59/23/886715923.db2.gz YIVFZCOTGQSVMV-UHFFFAOYSA-N 0 3 422.476 4.157 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)c3cc(C(F)(F)F)ccc3F)CC2)C[C@H](C)O1 ZINC000471945511 886747543 /nfs/dbraw/zinc/74/75/43/886747543.db2.gz WXZLWVOHUVTYIU-GJZGRUSLSA-N 0 3 416.459 4.196 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2ccc(OC(F)F)c3cccnc23)[C@@H]1c1ccccc1 ZINC000471952301 886759248 /nfs/dbraw/zinc/75/92/48/886759248.db2.gz MRPOJGSDNWBBKE-XLIONFOSSA-N 0 3 412.440 4.403 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)c3ccc(-c4ccccc4)[nH]c3=O)c2)CC1 ZINC000504198553 913080450 /nfs/dbraw/zinc/08/04/50/913080450.db2.gz AREUIAHPTIPARR-UHFFFAOYSA-N 0 3 416.525 4.237 20 0 HIADHN Cc1cc(C)n(-c2ccccc2CNC(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)n1 ZINC000471976230 886806687 /nfs/dbraw/zinc/80/66/87/886806687.db2.gz HUOSQHWZHBACNP-NZQKXSOJSA-N 0 3 417.557 4.124 20 0 HIADHN CSc1cnn(-c2ccccc2)c1NC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000471996276 886822315 /nfs/dbraw/zinc/82/23/15/886822315.db2.gz VXTOCPHPJZMXSK-AZUAARDMSA-N 0 3 407.543 4.161 20 0 HIADHN CCS[C@@H]1CCC[C@H](NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)C1 ZINC000472008592 886832779 /nfs/dbraw/zinc/83/27/79/886832779.db2.gz PHEFSGRDFVUCGT-ZGRYLRDCSA-N 0 3 407.546 4.155 20 0 HIADHN CCc1noc(-c2ccc(C)c(NC(=O)N[C@@H]3CCN(C)[C@@H]3c3ccccc3)c2)n1 ZINC000472019198 886841962 /nfs/dbraw/zinc/84/19/62/886841962.db2.gz YPJKNEWGALHMHG-WIYYLYMNSA-N 0 3 405.502 4.174 20 0 HIADHN Cc1ccc([C@H](NC(=O)N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)c2ccccn2)cc1 ZINC000472069622 886875702 /nfs/dbraw/zinc/87/57/02/886875702.db2.gz KRXUFAZYNMNHAH-XRODADMRSA-N 0 3 414.553 4.442 20 0 HIADHN CCC(CC)[C@@H]1C[C@H](NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)CCO1 ZINC000472131715 886923015 /nfs/dbraw/zinc/92/30/15/886923015.db2.gz CDZKJZMTJNWCNH-UGXKVIGPSA-N 0 3 419.532 4.075 20 0 HIADHN Cc1nc2cc(C(=O)NC3CCN(CCOc4ccc(Cl)cc4)CC3)ccc2o1 ZINC000472162153 886960909 /nfs/dbraw/zinc/96/09/09/886960909.db2.gz XCZZUZNNVGSXOD-UHFFFAOYSA-N 0 3 413.905 4.063 20 0 HIADHN CC(C)(C)OC1CC(CCNC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)C1 ZINC000472170070 886968448 /nfs/dbraw/zinc/96/84/48/886968448.db2.gz GZJPFBOGRLBGGU-UHFFFAOYSA-N 0 3 419.532 4.075 20 0 HIADHN O=C(CCSCc1ccccc1)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000472184814 886984723 /nfs/dbraw/zinc/98/47/23/886984723.db2.gz BBNJCRFCCQJZAA-UHFFFAOYSA-N 0 3 416.562 4.109 20 0 HIADHN CCc1ccc(CN(C)C(=O)CNC2(c3ccc(Cl)cc3)CCOCC2)cc1 ZINC000472251906 887061515 /nfs/dbraw/zinc/06/15/15/887061515.db2.gz OXDAMSWXPJNLIU-UHFFFAOYSA-N 0 3 400.950 4.156 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2ccc3sccc3c2)cc1)[C@H]1CCCN(C)C1 ZINC000472258731 887069833 /nfs/dbraw/zinc/06/98/33/887069833.db2.gz NUOGERUBSNNHSY-FQEVSTJZSA-N 0 3 407.539 4.320 20 0 HIADHN Cc1cc(C)c(C(=O)Nc2cccc(CN3CCC(CO)CC3)c2)c(OC2CCC2)n1 ZINC000472264097 887078206 /nfs/dbraw/zinc/07/82/06/887078206.db2.gz VGXRSTNKHKGONX-UHFFFAOYSA-N 0 3 423.557 4.086 20 0 HIADHN CN(CCN(Cc1ccccc1)C(=O)NCC1(C(F)F)CC1)Cc1ccccc1 ZINC000472295889 887117109 /nfs/dbraw/zinc/11/71/09/887117109.db2.gz PAKOHWSNAIEZAE-UHFFFAOYSA-N 0 3 401.501 4.376 20 0 HIADHN CC(C)OCCOCc1cccc(NC(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)c1 ZINC000472303828 887126225 /nfs/dbraw/zinc/12/62/25/887126225.db2.gz FTHJUQJEBCSFAP-XZOQPEGZSA-N 0 3 411.546 4.195 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2ccc(OCc3ccncc3)cc2)[C@H]1c1ccccc1 ZINC000472309641 887137538 /nfs/dbraw/zinc/13/75/38/887137538.db2.gz CWZFTDPRRQJODN-XZOQPEGZSA-N 0 3 402.498 4.228 20 0 HIADHN Cc1cc(N2CCSCC2)ccc1NC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000472311034 887139957 /nfs/dbraw/zinc/13/99/57/887139957.db2.gz BYDULLRNFUJBIA-VXKWHMMOSA-N 0 3 410.587 4.115 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2ccnc(Sc3ccccn3)c2)[C@H]1c1ccccc1 ZINC000472327917 887161020 /nfs/dbraw/zinc/16/10/20/887161020.db2.gz OZXOHBQAYOXAGR-GHTZIAJQSA-N 0 3 405.527 4.195 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)c(C)c1 ZINC000472333486 887168576 /nfs/dbraw/zinc/16/85/76/887168576.db2.gz CRDDPRYUISZCLG-HSQYWUDLSA-N 0 3 408.546 4.090 20 0 HIADHN Cc1cc2c(cc1C)[C@H](C(=O)Nc1ccnn1[C@@H]1CCN(Cc3ccccc3)C1)CO2 ZINC000472353514 887188325 /nfs/dbraw/zinc/18/83/25/887188325.db2.gz RZWNJNOIXQWOFF-IFMALSPDSA-N 0 3 416.525 4.062 20 0 HIADHN CCN(CC)C(=O)c1cccc(NC(=O)CN2CC[C@H](Cc3ccccc3)[C@H]2C)c1 ZINC000472355137 887189735 /nfs/dbraw/zinc/18/97/35/887189735.db2.gz KIDIXWBUTJRIGF-TZIWHRDSSA-N 0 3 407.558 4.060 20 0 HIADHN CN1CCC(Oc2ccc(NC(=O)c3ccc(Cl)cc3C(F)(F)F)cn2)CC1 ZINC000472367808 887205401 /nfs/dbraw/zinc/20/54/01/887205401.db2.gz IATQWXMMMBAKRB-UHFFFAOYSA-N 0 3 413.827 4.479 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)CCc2cnc3ccccc3c2)cc1 ZINC000472441332 887289867 /nfs/dbraw/zinc/28/98/67/887289867.db2.gz ZRCVUDZVWDQAFX-DEOSSOPVSA-N 0 3 403.526 4.129 20 0 HIADHN CC1(C)[C@@H](C(F)(F)F)CCN1C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472443466 887294159 /nfs/dbraw/zinc/29/41/59/887294159.db2.gz JLCMBZZYBDTXJA-RUXDESIVSA-N 0 3 415.422 4.164 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N1CC[C@@H](c2ccc(F)cc2)C1 ZINC000472450817 887304191 /nfs/dbraw/zinc/30/41/91/887304191.db2.gz ISUMBSLQOVABDH-VNCLNFNDSA-N 0 3 413.459 4.130 20 0 HIADHN Cn1cccc1[C@@H]1CCCCN1C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472453328 887307501 /nfs/dbraw/zinc/30/75/01/887307501.db2.gz FZAONEQGTMYUEC-TVPLGVNVSA-N 0 3 412.500 4.067 20 0 HIADHN C[C@H]1[C@H](Cc2ccccc2)CCN1C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472456826 887311336 /nfs/dbraw/zinc/31/13/36/887311336.db2.gz PICBEBWNIAIYII-GYIPLFPLSA-N 0 3 423.523 4.454 20 0 HIADHN C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472457033 887312928 /nfs/dbraw/zinc/31/29/28/887312928.db2.gz UEBYWBSFYSRKMO-WPPJOMGTSA-N 0 3 415.422 4.164 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N1CC[C@@H](c2ccccc2F)C1 ZINC000472458874 887314292 /nfs/dbraw/zinc/31/42/92/887314292.db2.gz YSPQOZLKQOULCA-ODIFPOPNSA-N 0 3 413.459 4.130 20 0 HIADHN CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)N[C@H]1CC[C@H](c2ccc(F)cc2)C1 ZINC000472527990 887399972 /nfs/dbraw/zinc/39/99/72/887399972.db2.gz NSIBRFMZMUKSND-HMNCIZAVSA-N 0 3 410.537 4.191 20 0 HIADHN C[C@@H](CO)N(CC(=O)N1N=C(c2cccs2)C[C@H]1c1cccs1)C1CCCC1 ZINC000472639502 887504807 /nfs/dbraw/zinc/50/48/07/887504807.db2.gz UXHHSTMANODNGQ-YJBOKZPZSA-N 0 3 417.600 4.113 20 0 HIADHN CN1CCN(CCC(C)(C)Nc2ncnc3scc(-c4ccc(F)cc4)c32)CC1 ZINC000472655750 887516147 /nfs/dbraw/zinc/51/61/47/887516147.db2.gz WDVVFSODUSGTCN-UHFFFAOYSA-N 0 3 413.566 4.325 20 0 HIADHN O=S(=O)(Cc1ccc(Cl)c(F)c1)NCc1ccccc1CN1CCCCC1 ZINC000472673190 887527527 /nfs/dbraw/zinc/52/75/27/887527527.db2.gz ZSPRZJIPHIQZIS-UHFFFAOYSA-N 0 3 410.942 4.085 20 0 HIADHN Cc1cc(C(=O)NC(C)C)ccc1NC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000472694807 887548090 /nfs/dbraw/zinc/54/80/90/887548090.db2.gz UZBBGOYQELSDOX-QFIPXVFZSA-N 0 3 422.573 4.262 20 0 HIADHN COc1cc(NC(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)ccc1Br ZINC000472863284 887718919 /nfs/dbraw/zinc/71/89/19/887718919.db2.gz NDLUVAWOWUJBHK-WMLDXEAASA-N 0 3 418.335 4.415 20 0 HIADHN CCC[C@@H](NC(=O)N[C@H](C)CCN1CCN(C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000472909975 887755683 /nfs/dbraw/zinc/75/56/83/887755683.db2.gz YBHBWWOQFMVGEP-DNVCBOLYSA-N 0 3 415.409 4.160 20 0 HIADHN C[C@H](CCN1CCN(C)CC1)NC(=O)N(C)[C@@H](C)c1ccc(-c2ccccc2)cc1 ZINC000472913805 887758712 /nfs/dbraw/zinc/75/87/12/887758712.db2.gz KNKBVELULYTGFG-RTWAWAEBSA-N 0 3 408.590 4.082 20 0 HIADHN CN(C)[C@@H](CNC(=O)Nc1ccc(OCc2ccccn2)c(F)c1)c1ccccc1 ZINC000472922154 887768755 /nfs/dbraw/zinc/76/87/55/887768755.db2.gz HISCYCAUQJOECB-NRFANRHFSA-N 0 3 408.477 4.224 20 0 HIADHN CC[C@H](C)c1ccc([C@@H](NC(=O)N[C@H](C)CCN2CCN(C)CC2)C(C)C)cc1 ZINC000472943788 887792315 /nfs/dbraw/zinc/79/23/15/887792315.db2.gz XMPHQFNNJJQFAR-MZKRTTBSSA-N 0 3 402.627 4.222 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3nn([C@@H](C)c4ccccc4)cc3C)cc2)CC1 ZINC000472949117 887797110 /nfs/dbraw/zinc/79/71/10/887797110.db2.gz IEHQJBQMNDQMMK-FQEVSTJZSA-N 0 3 417.557 4.195 20 0 HIADHN CCOc1cc(CN2CCSC3(CCOCC3)C2)ccc1OCC(F)(F)F ZINC000473063275 887884744 /nfs/dbraw/zinc/88/47/44/887884744.db2.gz PEUIVWSHBSGDIA-UHFFFAOYSA-N 0 3 405.482 4.124 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CN1CCC(O)(Cc2cccc(F)c2)CC1 ZINC000473074543 887891936 /nfs/dbraw/zinc/89/19/36/887891936.db2.gz VYSYUXDTSIEVRA-UHFFFAOYSA-N 0 3 407.533 4.257 20 0 HIADHN Cc1cc(NC(=O)c2ccc(CN(C)C)cc2)nn1CCCOc1ccc(F)cc1 ZINC000504354330 913189956 /nfs/dbraw/zinc/18/99/56/913189956.db2.gz XHKSLOVVWLHKJQ-UHFFFAOYSA-N 0 3 410.493 4.114 20 0 HIADHN O=C(N1CCO[C@H](c2cccs2)C1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000473181725 887961942 /nfs/dbraw/zinc/96/19/42/887961942.db2.gz JQYXVHOZZMKBBT-FXAWDEMLSA-N 0 3 424.488 4.103 20 0 HIADHN CC(C)c1n[nH]cc1C(=O)Nc1ccc(CN2CCN(Cc3ccccc3)CC2)cc1 ZINC000473271455 888028728 /nfs/dbraw/zinc/02/87/28/888028728.db2.gz HKTJDFPBWXFUKG-UHFFFAOYSA-N 0 3 417.557 4.103 20 0 HIADHN CC(C)c1[nH]ncc1C(=O)Nc1ccc(CN2CCN(Cc3ccccc3)CC2)cc1 ZINC000473271455 888028737 /nfs/dbraw/zinc/02/87/37/888028737.db2.gz HKTJDFPBWXFUKG-UHFFFAOYSA-N 0 3 417.557 4.103 20 0 HIADHN C[C@@H](CC(=O)N[C@H]1[C@H](C)CN(Cc2ccccc2)C[C@@H]1C)C(=O)c1cccc(F)c1 ZINC000473283402 888038738 /nfs/dbraw/zinc/03/87/38/888038738.db2.gz WZDXQSXAGBEMDC-YBJWPOLQSA-N 0 3 410.533 4.307 20 0 HIADHN CCOc1ccc(C(=O)CCC(=O)NC2[C@H](C)CN(Cc3ccccc3)C[C@H]2C)cc1 ZINC000473284322 888040255 /nfs/dbraw/zinc/04/02/55/888040255.db2.gz QOMHMLJGODSHJA-WOJBJXKFSA-N 0 3 422.569 4.321 20 0 HIADHN C[C@H](CCNC(=O)C(=O)Nc1cccc(CN(C)C)c1)c1cccc(C(F)(F)F)c1 ZINC000473296574 888048687 /nfs/dbraw/zinc/04/86/87/888048687.db2.gz ULDWXQQTVBSVKK-OAHLLOKOSA-N 0 3 421.463 4.016 20 0 HIADHN CCO[C@@H](CCNC(=O)Nc1ccc(N2CCN(CC)CC2)cc1C)C1CCCC1 ZINC000473444869 888165881 /nfs/dbraw/zinc/16/58/81/888165881.db2.gz VGVYOLKBIUAPGF-QHCPKHFHSA-N 0 3 416.610 4.244 20 0 HIADHN Cc1nc(-c2ccc([C@@H](C)NC(=O)N(CCN(C)C)Cc3ccccn3)cc2)cs1 ZINC000504398046 913218897 /nfs/dbraw/zinc/21/88/97/913218897.db2.gz BAMMGWVJQDMJGQ-QGZVFWFLSA-N 0 3 423.586 4.348 20 0 HIADHN Cc1ccc(C(C)C)c(OCC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)c1 ZINC000473510507 888239030 /nfs/dbraw/zinc/23/90/30/888239030.db2.gz FVPWJUSCFONNGC-UHFFFAOYSA-N 0 3 412.496 4.419 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1[nH]c2ccc(F)cc2c1Cl ZINC000473517303 888248164 /nfs/dbraw/zinc/24/81/64/888248164.db2.gz HTMGZJMGQKGICR-UHFFFAOYSA-N 0 3 417.834 4.496 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1occc1COc1ccccc1 ZINC000473523595 888258495 /nfs/dbraw/zinc/25/84/95/888258495.db2.gz WBRBHWPKWXALGQ-UHFFFAOYSA-N 0 3 422.447 4.394 20 0 HIADHN COc1ccccc1CC(C)(C)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473530665 888268556 /nfs/dbraw/zinc/26/85/56/888268556.db2.gz ZYMNXIVHXZEMGE-UHFFFAOYSA-N 0 3 412.496 4.185 20 0 HIADHN COc1cccc(C(=O)c2ccc(C(=O)N3CCCC[C@H](N4CCCC4)C3)cc2)c1 ZINC000473587876 888331515 /nfs/dbraw/zinc/33/15/15/888331515.db2.gz NPAKSKBGNHWDBP-QFIPXVFZSA-N 0 3 406.526 4.017 20 0 HIADHN CN1CCN(CCC(C)(C)NC(=O)Nc2ccccc2Oc2cccc(F)c2)CC1 ZINC000473662694 888415304 /nfs/dbraw/zinc/41/53/04/888415304.db2.gz BMGSEOCWFKSQAL-UHFFFAOYSA-N 0 3 414.525 4.156 20 0 HIADHN C[C@@H](CCN1CCN(C)CC1)NC(=O)Nc1ccc(CCCc2ccccc2)cc1 ZINC000473675114 888438188 /nfs/dbraw/zinc/43/81/88/888438188.db2.gz KQUFHYFSQDSCRO-NRFANRHFSA-N 0 3 408.590 4.009 20 0 HIADHN Cc1nc(CNC(=O)NC[C@H](c2ccccc2)N(C)C)oc1-c1ccc(Cl)cc1 ZINC000473678887 888443891 /nfs/dbraw/zinc/44/38/91/888443891.db2.gz RYQHWOALDGUVQQ-LJQANCHMSA-N 0 3 412.921 4.406 20 0 HIADHN CN(C)CCN(C(=O)Nc1cnn(-c2ccccc2)c1C(F)(F)F)C1CCCC1 ZINC000473767898 888565025 /nfs/dbraw/zinc/56/50/25/888565025.db2.gz JCIOQNCFRKJSJP-UHFFFAOYSA-N 0 3 409.456 4.229 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3cc(-n4cccn4)ccc3C)c(C)c2)CC1 ZINC000473772564 888571822 /nfs/dbraw/zinc/57/18/22/888571822.db2.gz LMYXILYDWLLIPI-UHFFFAOYSA-N 0 3 418.545 4.275 20 0 HIADHN C[C@@H](NC(=O)N(CCN(C)C)Cc1ccccn1)c1nc(-c2ccccc2)cs1 ZINC000504449230 913257994 /nfs/dbraw/zinc/25/79/94/913257994.db2.gz QLOXCFZFCLXWEQ-QGZVFWFLSA-N 0 3 409.559 4.040 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3C[C@@H](C)C[C@@H]3c3cccc(OC)c3)c2)CC1 ZINC000473831705 888666732 /nfs/dbraw/zinc/66/67/32/888666732.db2.gz WSCZQFORINCDOF-YADARESESA-N 0 3 422.573 4.452 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)NC[C@H]3CCCC[C@H]3C(F)(F)F)c2)CC1 ZINC000473835066 888672194 /nfs/dbraw/zinc/67/21/94/888672194.db2.gz HFEHKVNYHRPJHK-VQIMIIECSA-N 0 3 412.500 4.319 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N(C)[C@@H]3CCCc4cc(OC)ccc43)c2)CC1 ZINC000473837074 888674491 /nfs/dbraw/zinc/67/44/91/888674491.db2.gz QFQQCXXNLMCZLC-XMMPIXPASA-N 0 3 422.573 4.378 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)NCc3ccc(F)cc3CSC)c2)CC1 ZINC000473839578 888680096 /nfs/dbraw/zinc/68/00/96/888680096.db2.gz LCGYQZVOQQDQSU-UHFFFAOYSA-N 0 3 416.566 4.152 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@@H](C)c3cccc(OC(C)C)c3)c2)CC1 ZINC000473840793 888683370 /nfs/dbraw/zinc/68/33/70/888683370.db2.gz QLARGHPVGVFJCA-IBGZPJMESA-N 0 3 410.562 4.498 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CCc4c(F)cc(F)cc4[C@H]3C)c2)CC1 ZINC000473841646 888683460 /nfs/dbraw/zinc/68/34/60/888683460.db2.gz TXCXXTHKIJCFFO-MRXNPFEDSA-N 0 3 414.500 4.258 20 0 HIADHN Cc1ccc(-c2cc(C(=O)N3CCC(CCN4C[C@@H](C)O[C@H](C)C4)CC3)[nH]n2)cc1C ZINC000473918079 888800285 /nfs/dbraw/zinc/80/02/85/888800285.db2.gz AEMXFQRATHQJAD-WOJBJXKFSA-N 0 3 424.589 4.045 20 0 HIADHN CN1CCN(CCC(C)(C)NC(=O)N[C@@H](c2ccc(Cl)cc2)C2CCCC2)CC1 ZINC000473939795 888817108 /nfs/dbraw/zinc/81/71/08/888817108.db2.gz KHVKOZLTQHWUCA-OAQYLSRUSA-N 0 3 421.029 4.287 20 0 HIADHN CSc1cccc(C)c1NC(=O)NCCCN1CCN(Cc2ccccc2)CC1 ZINC000473960241 888831696 /nfs/dbraw/zinc/83/16/96/888831696.db2.gz MMXUSTXUTNXGIU-UHFFFAOYSA-N 0 3 412.603 4.046 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)N[C@@H]1C[C@H]1c1ccc(OC(F)F)cc1 ZINC000473980046 888844428 /nfs/dbraw/zinc/84/44/28/888844428.db2.gz CSZMOZVQFGJDNL-KSZLIROESA-N 0 3 421.513 4.342 20 0 HIADHN C[C@@H](CC(=O)Nc1ccccc1)N[C@H]1CCN(c2ccc(Cl)cc2Cl)C1=O ZINC000473986268 888848036 /nfs/dbraw/zinc/84/80/36/888848036.db2.gz IPVFSDXIKFTYBX-GUYCJALGSA-N 0 3 406.313 4.106 20 0 HIADHN COC(=O)c1cc(CN[C@@H](Cc2ccccn2)c2ccc(Br)cc2)c[nH]1 ZINC000474011510 888868066 /nfs/dbraw/zinc/86/80/66/888868066.db2.gz PEPICIJEVKEIKF-SFHVURJKSA-N 0 3 414.303 4.032 20 0 HIADHN COc1ccc(CN(C)Cc2ccc(Cl)cc2-n2cncn2)cc1OC(F)F ZINC000474102036 888924405 /nfs/dbraw/zinc/92/44/05/888924405.db2.gz BVJIKSGAVRAPRP-UHFFFAOYSA-N 0 3 408.836 4.163 20 0 HIADHN CCN(C)C(=O)[C@@H](C)N[C@H]1CCCc2nc(-c3ccccc3Br)sc21 ZINC000474101787 888925378 /nfs/dbraw/zinc/92/53/78/888925378.db2.gz ZVKUJFQQFPAGJB-DOMZBBRYSA-N 0 3 422.392 4.406 20 0 HIADHN COc1cccc(CN(Cc2ccc(Cl)cc2-n2cncn2)C[C@H]2CCCO2)c1 ZINC000474143557 888967705 /nfs/dbraw/zinc/96/77/05/888967705.db2.gz GGRQNOKVPJWWAJ-OAQYLSRUSA-N 0 3 412.921 4.111 20 0 HIADHN Cc1cc(C(=O)NC2CCN(CCOc3ccc(F)cc3)CC2)c(C(F)(F)F)o1 ZINC000474142301 888968134 /nfs/dbraw/zinc/96/81/34/888968134.db2.gz QOKWRMRMOHPBRP-UHFFFAOYSA-N 0 3 414.399 4.019 20 0 HIADHN CCOc1cccc2[nH]cc(CC(=O)N(CC)[C@@H]3CCN(Cc4ccccc4)C3)c21 ZINC000474168790 889007624 /nfs/dbraw/zinc/00/76/24/889007624.db2.gz JBCXIKIPFMNIJV-OAQYLSRUSA-N 0 3 405.542 4.232 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N[C@@H](CO)c2c(Cl)cccc2Cl)C1 ZINC000474180206 889018250 /nfs/dbraw/zinc/01/82/50/889018250.db2.gz CVIWDFUNNYBILS-OGWOLHLISA-N 0 3 422.356 4.162 20 0 HIADHN Cc1cccc2nc(CN3CCC(c4ccccc4C(F)(F)F)CC3)cc(=O)n12 ZINC000474208356 889046202 /nfs/dbraw/zinc/04/62/02/889046202.db2.gz DICWQNYZURZDGQ-UHFFFAOYSA-N 0 3 401.432 4.401 20 0 HIADHN C[C@H](N[C@H]1CCN([C@@H](C(=O)OC(C)(C)C)c2ccccc2)C1=O)c1cccs1 ZINC000474431325 889295920 /nfs/dbraw/zinc/29/59/20/889295920.db2.gz HEVXDXKWGYQDMY-VDZJLULYSA-N 0 3 400.544 4.083 20 0 HIADHN COCc1c(Br)cccc1NC(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C ZINC000474431812 889298101 /nfs/dbraw/zinc/29/81/01/889298101.db2.gz LFOIESUNHRGUKS-LIRRHRJNSA-N 0 3 420.351 4.408 20 0 HIADHN Cc1cc(NC(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)ccc1OC1CCOCC1 ZINC000474443741 889308798 /nfs/dbraw/zinc/30/87/98/889308798.db2.gz FDTZFIPPXFPVIL-JPYJTQIMSA-N 0 3 411.546 4.366 20 0 HIADHN O=C(Nc1ccc(CNCc2ccc(Cl)cc2-n2cncn2)cc1)c1ccco1 ZINC000474463040 889329130 /nfs/dbraw/zinc/32/91/30/889329130.db2.gz XIJOFDCROYXLHP-UHFFFAOYSA-N 0 3 407.861 4.056 20 0 HIADHN Cc1ccc(NC(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)c(Br)c1 ZINC000474548156 889424318 /nfs/dbraw/zinc/42/43/18/889424318.db2.gz PIXPSZSFANXDIJ-QGZVFWFLSA-N 0 3 402.336 4.496 20 0 HIADHN Cc1cnn(-c2ccc(NC(=O)N(C)[C@H]3CCN(Cc4ccccc4)C3)cc2F)c1 ZINC000474589449 889458026 /nfs/dbraw/zinc/45/80/26/889458026.db2.gz LAJIECDCWMRKRB-FQEVSTJZSA-N 0 3 407.493 4.058 20 0 HIADHN Cc1cnn(-c2ccc(NC(=O)N(C)[C@@H]3CCN(Cc4ccccc4)C3)cc2F)c1 ZINC000474589450 889458102 /nfs/dbraw/zinc/45/81/02/889458102.db2.gz LAJIECDCWMRKRB-HXUWFJFHSA-N 0 3 407.493 4.058 20 0 HIADHN CN(C(=O)Nc1ccc(OCc2ccncc2)cc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000474591792 889459419 /nfs/dbraw/zinc/45/94/19/889459419.db2.gz BYCKVWIVHRUJEO-QHCPKHFHSA-N 0 3 416.525 4.399 20 0 HIADHN Cn1cc(-c2ncc(CN[C@@H](c3ccc(Br)cc3)C3CCC3)cn2)cn1 ZINC000474599419 889466428 /nfs/dbraw/zinc/46/64/28/889466428.db2.gz LNXWZNJKAQSJLC-LJQANCHMSA-N 0 3 412.335 4.271 20 0 HIADHN CN(C(=O)Nc1cc2c(cc1Cl)OCCCO2)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000474706951 889564802 /nfs/dbraw/zinc/56/48/02/889564802.db2.gz JCJGVIXTDIXQOH-QGZVFWFLSA-N 0 3 415.921 4.240 20 0 HIADHN CCCC(=O)Nc1cccc(NC(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)c1C ZINC000474732688 889588540 /nfs/dbraw/zinc/58/85/40/889588540.db2.gz CPIIVHOWVLEWSP-FQEVSTJZSA-N 0 3 408.546 4.472 20 0 HIADHN COc1ccc(OC(F)F)c(NC(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000474732042 889588647 /nfs/dbraw/zinc/58/86/47/889588647.db2.gz TWQSBXZGGOLTEQ-INIZCTEOSA-N 0 3 405.445 4.035 20 0 HIADHN COc1ccc([C@@H](N[C@H](C)C2CCS(=O)(=O)CC2)c2ccccc2Cl)cc1 ZINC000474797979 889652061 /nfs/dbraw/zinc/65/20/61/889652061.db2.gz WAEIYANGQXMUCI-QVKFZJNVSA-N 0 3 407.963 4.241 20 0 HIADHN COc1cccc([C@H](N[C@@H](C)C2CCS(=O)(=O)CC2)c2ccccc2Cl)c1 ZINC000474804451 889656896 /nfs/dbraw/zinc/65/68/96/889656896.db2.gz OUZKFGITLDTSGV-BTYIYWSLSA-N 0 3 407.963 4.241 20 0 HIADHN CC1CCN([C@@H](CNC(=O)CCc2nc(C3CCCC3)no2)c2cccs2)CC1 ZINC000474839514 889698563 /nfs/dbraw/zinc/69/85/63/889698563.db2.gz XQFIUDUADVJHHB-SFHVURJKSA-N 0 3 416.591 4.311 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)CSc2cc(Cl)ccc2Cl)CC1 ZINC000474880431 889735110 /nfs/dbraw/zinc/73/51/10/889735110.db2.gz SMSATNJVNFSROT-UHFFFAOYSA-N 0 3 405.391 4.091 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)C[C@@H](C)c2ccc(C(F)(F)F)cc2)CC1 ZINC000474883091 889738789 /nfs/dbraw/zinc/73/87/89/889738789.db2.gz UQSSHTORTVDRAI-MRXNPFEDSA-N 0 3 400.485 4.205 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)c2csc(-c3cccc(Cl)c3)n2)CC1 ZINC000474892239 889750799 /nfs/dbraw/zinc/75/07/99/889750799.db2.gz RDILCISTFHCVIO-UHFFFAOYSA-N 0 3 407.967 4.083 20 0 HIADHN CCN(C(=O)Nc1ccc(NC(C)=O)cc1Cl)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475000892 889852097 /nfs/dbraw/zinc/85/20/97/889852097.db2.gz IQAWJMYAHFXJJK-LJQANCHMSA-N 0 3 414.937 4.427 20 0 HIADHN CCN(C(=O)Nc1cc2c(cc1Cl)OCCO2)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475001402 889853194 /nfs/dbraw/zinc/85/31/94/889853194.db2.gz LWYCDPRFLGNBBY-KRWDZBQOSA-N 0 3 415.921 4.240 20 0 HIADHN CCN(C(=O)N[C@@H](C)c1cc(OC)ccc1OC)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475005890 889857073 /nfs/dbraw/zinc/85/70/73/889857073.db2.gz CJYZUWDQTYKJNM-AZUAARDMSA-N 0 3 411.546 4.071 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)C/C=C\c2ccc(F)cc2)cc1)[C@@H]1CCCN(C)C1 ZINC000475008231 889860318 /nfs/dbraw/zinc/86/03/18/889860318.db2.gz KQSJMBARSTUODJ-HLPUOXPYSA-N 0 3 409.505 4.034 20 0 HIADHN CCN(C(=O)NCc1coc(-c2cccs2)n1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475010204 889863846 /nfs/dbraw/zinc/86/38/46/889863846.db2.gz SEJYNUDGNGOJST-IBGZPJMESA-N 0 3 410.543 4.209 20 0 HIADHN CCN(C(=O)NCc1coc(-c2cccs2)n1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475010205 889864086 /nfs/dbraw/zinc/86/40/86/889864086.db2.gz SEJYNUDGNGOJST-LJQANCHMSA-N 0 3 410.543 4.209 20 0 HIADHN CN(C(=O)N[C@@H](c1ccc(F)cc1)C(F)(F)F)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475094142 889940606 /nfs/dbraw/zinc/94/06/06/889940606.db2.gz IEBMCMBRMPLTLW-OALUTQOASA-N 0 3 409.427 4.345 20 0 HIADHN CCN(C(=O)Nc1ccc(C[C@H](C)C(=O)OC)cc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475109594 889959241 /nfs/dbraw/zinc/95/92/41/889959241.db2.gz LAKIIYBSRZPICK-WMZHIEFXSA-N 0 3 423.557 4.167 20 0 HIADHN CCc1cnc(CN(C)C(=O)NC[C@@H](c2ccccc2)N2CCC(C)CC2)s1 ZINC000475112355 889962413 /nfs/dbraw/zinc/96/24/13/889962413.db2.gz SKIKEANEYACARF-FQEVSTJZSA-N 0 3 400.592 4.320 20 0 HIADHN Cc1nc(-c2ccc(CNC(=O)N(C)[C@H]3CCN(Cc4ccccc4)C3)o2)cs1 ZINC000475112241 889962532 /nfs/dbraw/zinc/96/25/32/889962532.db2.gz RZHUUTHIMAVFKV-SFHVURJKSA-N 0 3 410.543 4.127 20 0 HIADHN C[C@@H](NC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1)c1ncc(-c2ccccc2)o1 ZINC000475114384 889965848 /nfs/dbraw/zinc/96/58/48/889965848.db2.gz HMRNPFYVMNKHKF-NQIIRXRSSA-N 0 3 404.514 4.319 20 0 HIADHN C[C@@H](NC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1)c1ncc(-c2ccccc2)o1 ZINC000475114387 889966141 /nfs/dbraw/zinc/96/61/41/889966141.db2.gz HMRNPFYVMNKHKF-WIYYLYMNSA-N 0 3 404.514 4.319 20 0 HIADHN CCN(C(=O)N[C@H](C)c1noc(-c2ccccc2)n1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475161337 890025544 /nfs/dbraw/zinc/02/55/44/890025544.db2.gz HWFKIQNJCGZCKP-WIYYLYMNSA-N 0 3 419.529 4.104 20 0 HIADHN CCN(C(=O)NCc1ccc(Br)s1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475175576 890043201 /nfs/dbraw/zinc/04/32/01/890043201.db2.gz MCAMQEXBNKZWID-INIZCTEOSA-N 0 3 422.392 4.317 20 0 HIADHN Fc1ccc(-c2nc(CNCCCCn3cc(Br)cn3)cs2)cc1 ZINC000475210067 890078539 /nfs/dbraw/zinc/07/85/39/890078539.db2.gz OKLRPVWVVUUNBH-UHFFFAOYSA-N 0 3 409.328 4.478 20 0 HIADHN C[C@@H](NC(=O)N(CCN(C)C)CC1CCCCC1)c1ccc(Br)cn1 ZINC000475244669 890126275 /nfs/dbraw/zinc/12/62/75/890126275.db2.gz IYWNRBFZVIYHPG-OAHLLOKOSA-N 0 3 411.388 4.059 20 0 HIADHN CC(C)c1cc(C(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)c2cnn(C(C)C)c2n1 ZINC000475295334 890202274 /nfs/dbraw/zinc/20/22/74/890202274.db2.gz FAEPJNIOERMPLL-FQEVSTJZSA-N 0 3 419.573 4.482 20 0 HIADHN CN(C(=O)c1ccccc1OCc1cscn1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475298538 890206555 /nfs/dbraw/zinc/20/65/55/890206555.db2.gz AUNZGXIKXLSZBH-FQEVSTJZSA-N 0 3 407.539 4.069 20 0 HIADHN CN(C(=O)c1ccnc(SCC(F)(F)F)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475310465 890225346 /nfs/dbraw/zinc/22/53/46/890225346.db2.gz CKVRDZYRDLCHOF-QGZVFWFLSA-N 0 3 409.477 4.083 20 0 HIADHN Cc1noc(CSc2ccc(C(=O)N(C)[C@@H]3CCN(Cc4ccccc4)C3)cc2)n1 ZINC000475315467 890231463 /nfs/dbraw/zinc/23/14/63/890231463.db2.gz XLGGDRGTSPRXMW-HXUWFJFHSA-N 0 3 422.554 4.017 20 0 HIADHN COC(=O)[C@@H]1CCN(Cc2cn(-c3ccccc3)nc2-c2ccc(OC)cc2)C[C@H]1C ZINC000475360874 890287419 /nfs/dbraw/zinc/28/74/19/890287419.db2.gz CRCTXRIWISCCFM-WZONZLPQSA-N 0 3 419.525 4.179 20 0 HIADHN COC(=O)[C@H]1CCN(Cc2cccc(NC(=O)c3ccccc3Cl)c2)C[C@H]1C ZINC000475364678 890293576 /nfs/dbraw/zinc/29/35/76/890293576.db2.gz AGKYSGJBOGECBA-QAPCUYQASA-N 0 3 400.906 4.223 20 0 HIADHN Cc1noc(C)c1COc1cccc(C(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000475418537 890343435 /nfs/dbraw/zinc/34/34/35/890343435.db2.gz CDCNKNHJSUYKQK-QFIPXVFZSA-N 0 3 419.525 4.217 20 0 HIADHN COc1ccc(C2CCC(N[C@H](C(N)=O)c3cccc(Br)c3)CC2)cc1 ZINC000475426604 890346578 /nfs/dbraw/zinc/34/65/78/890346578.db2.gz XSMOTVZBIPILCY-OQRDJCCKSA-N 0 3 417.347 4.300 20 0 HIADHN CS(=O)(=O)C1(CNCc2ccc(Oc3cccc(Br)c3)cc2)CCC1 ZINC000475425280 890346840 /nfs/dbraw/zinc/34/68/40/890346840.db2.gz XVYOTSZDWPLRQW-UHFFFAOYSA-N 0 3 424.360 4.298 20 0 HIADHN C[C@@H](Cc1ccc(C(F)(F)F)cc1)N[C@@H](C(N)=O)c1cccc(Br)c1 ZINC000475434649 890354190 /nfs/dbraw/zinc/35/41/90/890354190.db2.gz OWASKXVUYJPBEY-MEDUHNTESA-N 0 3 415.253 4.215 20 0 HIADHN COCc1cnc(CN[C@@H](C)CCc2ccc(I)cc2)s1 ZINC000475508554 890424362 /nfs/dbraw/zinc/42/43/62/890424362.db2.gz JIGPRAJCCXIQNX-LBPRGKRZSA-N 0 3 416.328 4.005 20 0 HIADHN CC(C)(C)OC1CC(N[C@H](CO)c2ccc(Br)cc2C(F)(F)F)C1 ZINC000475622111 890557833 /nfs/dbraw/zinc/55/78/33/890557833.db2.gz FJUOUXZEIOYVSJ-KOHJWAIASA-N 0 3 410.274 4.437 20 0 HIADHN COc1cccc(-c2nc(CN3CCC[C@]3(CO)Cc3ccccc3)cs2)c1OC ZINC000475656659 890602931 /nfs/dbraw/zinc/60/29/31/890602931.db2.gz PKYBMASDCMPMPF-XMMPIXPASA-N 0 3 424.566 4.397 20 0 HIADHN COC(=O)c1cccc(-c2nc(CN3CCC[C@]3(CO)Cc3ccccc3)cs2)c1 ZINC000475672213 890615145 /nfs/dbraw/zinc/61/51/45/890615145.db2.gz CHGWRERNPCACHN-XMMPIXPASA-N 0 3 422.550 4.166 20 0 HIADHN CCc1nnc(-c2ccc(NC(=O)N(CCN(C)C)Cc3ccc(F)cc3)cc2)o1 ZINC000475698799 890637154 /nfs/dbraw/zinc/63/71/54/890637154.db2.gz OGDLIKXVRZJZFE-UHFFFAOYSA-N 0 3 411.481 4.034 20 0 HIADHN CCc1nnc(-c2ccc(NC(=O)NC[C@H](CC)N3CCc4ccccc4C3)cc2)o1 ZINC000475710671 890648094 /nfs/dbraw/zinc/64/80/94/890648094.db2.gz SCXFESNOQFBIFB-NRFANRHFSA-N 0 3 419.529 4.257 20 0 HIADHN CC1CCN([C@H](CNC(=O)Nc2ccc([S@@](C)=O)c(F)c2)c2ccccc2)CC1 ZINC000475856159 890791529 /nfs/dbraw/zinc/79/15/29/890791529.db2.gz VSWQEUGNYCTINF-ACSYHNTCSA-N 0 3 417.550 4.158 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(-c2cccnc2)cc1 ZINC000475947150 890869453 /nfs/dbraw/zinc/86/94/53/890869453.db2.gz SGCVMGQHSKOLCG-YADARESESA-N 0 3 400.526 4.383 20 0 HIADHN CN(C)[C@@H](CNC(=O)N1CCO[C@H](c2cccc(C(F)(F)F)c2)C1)c1ccccc1 ZINC000475951921 890873638 /nfs/dbraw/zinc/87/36/38/890873638.db2.gz FLBHYSVSWAQJFN-PMACEKPBSA-N 0 3 421.463 4.091 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N[C@H](c2ccc(Cl)cc2)C2CCC2)CC1 ZINC000476043916 890974801 /nfs/dbraw/zinc/97/48/01/890974801.db2.gz WIMUEATUSSBRGC-NRFANRHFSA-N 0 3 407.986 4.370 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N[C@@H](c2ccccc2)c2ccc(F)cc2)CC1 ZINC000476051782 890982023 /nfs/dbraw/zinc/98/20/23/890982023.db2.gz RXJGHEHUCNIVKO-QHCPKHFHSA-N 0 3 413.537 4.104 20 0 HIADHN Cc1ccc(Cn2cccc(NC(=O)N[C@@H](C)[C@@H](c3ccccc3)N(C)C)c2=O)cc1 ZINC000476140132 891061704 /nfs/dbraw/zinc/06/17/04/891061704.db2.gz IIEYZQIBKKRYSE-CVDCTZTESA-N 0 3 418.541 4.018 20 0 HIADHN C[C@H]1CCc2ccccc2[C@@H]1NC(=O)N(C)C1CCN(CCc2ccccn2)CC1 ZINC000476192613 891124897 /nfs/dbraw/zinc/12/48/97/891124897.db2.gz GTJNFVPBJFJSNX-YADARESESA-N 0 3 406.574 4.054 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)C(C)(C)c2cccc(Cl)c2F)CC1 ZINC000476258518 891181831 /nfs/dbraw/zinc/18/18/31/891181831.db2.gz PVTGTTWEYXYGBL-OAHLLOKOSA-N 0 3 403.929 4.494 20 0 HIADHN COc1cc(CN(C)C[C@@H](O)CO[C@@H]2CCCc3ccccc32)ccc1SC ZINC000476294662 891208108 /nfs/dbraw/zinc/20/81/08/891208108.db2.gz HUESNTUSKZUYAB-TZIWHRDSSA-N 0 3 401.572 4.304 20 0 HIADHN COCCN1CCC[C@H]1CNC(=O)N[C@H](c1cccs1)c1ccc(C(C)C)cc1 ZINC000476414713 891326885 /nfs/dbraw/zinc/32/68/85/891326885.db2.gz YPYKFPCPGKLIRT-UNMCSNQZSA-N 0 3 415.603 4.371 20 0 HIADHN CO[C@@H]1CCC[C@H](CC(=O)Nc2c(C)cnn2[C@H]2CCN(Cc3ccccc3)C2)C1 ZINC000476414462 891328437 /nfs/dbraw/zinc/32/84/37/891328437.db2.gz WWYOLEHNSZUCHA-FDFHNCONSA-N 0 3 410.562 4.172 20 0 HIADHN CCc1ccc([C@@H]2C[C@H](C)CCN2C(=O)NC2CCN(CCOC(C)C)CC2)o1 ZINC000476451731 891364765 /nfs/dbraw/zinc/36/47/65/891364765.db2.gz LAHSKVPUYHFSNW-NQIIRXRSSA-N 0 3 405.583 4.214 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N(C)Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000476458341 891371844 /nfs/dbraw/zinc/37/18/44/891371844.db2.gz MMMWWBDNUHFCQX-UHFFFAOYSA-N 0 3 402.366 4.024 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)c2ccc(COC(F)(F)F)cc2)cc1 ZINC000476551436 891466578 /nfs/dbraw/zinc/46/65/78/891466578.db2.gz SAFNMOXHBPOGNB-HXUWFJFHSA-N 0 3 422.447 4.299 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)Nc1c(SC)cnn1-c1ccccc1)c1ccco1 ZINC000476558648 891477256 /nfs/dbraw/zinc/47/72/56/891477256.db2.gz BDSWVZUAWLQKHN-NVXWUHKLSA-N 0 3 413.547 4.438 20 0 HIADHN CCC[C@H]1CN(C(=O)[C@@H]2CCc3nc(C(C)C)[nH]c3C2)CCN1Cc1ccccc1 ZINC000476589503 891520195 /nfs/dbraw/zinc/52/01/95/891520195.db2.gz SBRQADXZPHIBNZ-RTWAWAEBSA-N 0 3 408.590 4.151 20 0 HIADHN CCC[C@H]1CN(C(=O)[C@@H]2CCc3[nH]c(C(C)C)nc3C2)CCN1Cc1ccccc1 ZINC000476589503 891520215 /nfs/dbraw/zinc/52/02/15/891520215.db2.gz SBRQADXZPHIBNZ-RTWAWAEBSA-N 0 3 408.590 4.151 20 0 HIADHN C[C@@H]1CO[C@H](c2ccccc2Cl)CN1C(=O)NC[C@H](c1ccccc1)N(C)C ZINC000476596795 891529778 /nfs/dbraw/zinc/52/97/78/891529778.db2.gz MDEKVCJONQMBGJ-HBGVWJBISA-N 0 3 401.938 4.114 20 0 HIADHN CN(C)[C@H](CNC(=O)N1CCC(c2c[nH]c3cc(F)ccc32)CC1)c1ccccc1 ZINC000476600643 891534436 /nfs/dbraw/zinc/53/44/36/891534436.db2.gz SLHFWKSWLAWHRE-HSZRJFAPSA-N 0 3 408.521 4.499 20 0 HIADHN COc1cccc([C@H](CNC(=O)NCc2nc(C(C)C)c(C)s2)N2CCCC2)c1 ZINC000476623871 891558463 /nfs/dbraw/zinc/55/84/63/891558463.db2.gz ICCDZGPCAATQLN-IBGZPJMESA-N 0 3 416.591 4.220 20 0 HIADHN CC(C)c1ccccc1OCCNC(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000476686390 891637932 /nfs/dbraw/zinc/63/79/32/891637932.db2.gz SRHOAAMGZVELPA-LJQANCHMSA-N 0 3 401.576 4.387 20 0 HIADHN CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)C(C)(C)c1ccc(Cl)cc1F ZINC000476734933 891704023 /nfs/dbraw/zinc/70/40/23/891704023.db2.gz XNEOWJLUYWMGEO-JXFKEZNVSA-N 0 3 403.929 4.303 20 0 HIADHN CC1(C)CCC[C@H]1C(=O)NC1CCN(CCOc2ccc(Br)cc2)CC1 ZINC000476755797 891726916 /nfs/dbraw/zinc/72/69/16/891726916.db2.gz NXMKJCLWAMBGOE-IBGZPJMESA-N 0 3 423.395 4.235 20 0 HIADHN O=C(CC1(N2CCOCC2)CCCC1)N1CCCC[C@H]1c1nc(-c2ccccc2)c[nH]1 ZINC000476909291 891861700 /nfs/dbraw/zinc/86/17/00/891861700.db2.gz DAUZMKCTBQIDLL-QFIPXVFZSA-N 0 3 422.573 4.165 20 0 HIADHN CC(C)(C)C1=CCN(CCNC(=O)CCc2ncc(-c3ccc(F)cc3F)o2)CC1 ZINC000476945291 891884319 /nfs/dbraw/zinc/88/43/19/891884319.db2.gz AYGILHKUNWFVSM-UHFFFAOYSA-N 0 3 417.500 4.347 20 0 HIADHN O=C(NCc1ccccc1)c1cccc(NC(=O)c2cccc(CN3CCCC3)c2)c1 ZINC000477032420 891958376 /nfs/dbraw/zinc/95/83/76/891958376.db2.gz JVVPFJJCRJYPNP-UHFFFAOYSA-N 0 3 413.521 4.465 20 0 HIADHN C[C@@H](c1ccc([S@@](C)=O)cc1)N(C)CCC(=O)Nc1cccc(Br)c1 ZINC000477056148 891987022 /nfs/dbraw/zinc/98/70/22/891987022.db2.gz JKWGZOPCFOWXJS-HWRSSNJWSA-N 0 3 423.376 4.208 20 0 HIADHN C[C@H](NC(=O)Nc1cccc(-c2noc(C3CC3)n2)c1)[C@H](c1ccccc1)N(C)C ZINC000477071061 892005266 /nfs/dbraw/zinc/00/52/66/892005266.db2.gz RMZNXPWJIUSFAP-MGPUTAFESA-N 0 3 405.502 4.427 20 0 HIADHN COc1cccc(Cl)c1-c1noc(C)c1C(=O)NC[C@@H]1CCCCN1C1CC1 ZINC000477097386 892031682 /nfs/dbraw/zinc/03/16/82/892031682.db2.gz FWLJLWUQXONBCR-HNNXBMFYSA-N 0 3 403.910 4.059 20 0 HIADHN COc1cccc(Cl)c1-c1noc(C)c1C(=O)NCCN1CCCC(C)(C)C1 ZINC000477102168 892036441 /nfs/dbraw/zinc/03/64/41/892036441.db2.gz WKCTVIDAPXEOSS-UHFFFAOYSA-N 0 3 405.926 4.164 20 0 HIADHN COCc1nnc(NC[C@H]2CCCN(C)[C@@H]2c2ccc(C(F)(F)F)cc2)s1 ZINC000477117985 892048697 /nfs/dbraw/zinc/04/86/97/892048697.db2.gz GETCOYLQQXJBMK-CZUORRHYSA-N 0 3 400.470 4.198 20 0 HIADHN C[C@@H](CNC(=O)N(CCc1ccccc1)Cc1cccnc1)N(C)Cc1ccccc1 ZINC000477338558 892307893 /nfs/dbraw/zinc/30/78/93/892307893.db2.gz LXYOICOPNLGTRA-QFIPXVFZSA-N 0 3 416.569 4.356 20 0 HIADHN COCc1cccc(OCC2(CN3CCN(CCc4ccccc4)CC3)CCC2)c1 ZINC000477368535 892331462 /nfs/dbraw/zinc/33/14/62/892331462.db2.gz NBQOBLANTVNBOY-UHFFFAOYSA-N 0 3 408.586 4.242 20 0 HIADHN Cc1nc2ccccc2n1C1CCN(C(=O)[C@@H]2CCCN2Cc2ccccc2)CC1 ZINC000477423051 892376273 /nfs/dbraw/zinc/37/62/73/892376273.db2.gz GJQKOFYLSIUTFE-DEOSSOPVSA-N 0 3 402.542 4.173 20 0 HIADHN C[C@@H](NC(=O)N(C)[C@@H]1CCN(C2CC2)C1)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000477445376 892396581 /nfs/dbraw/zinc/39/65/81/892396581.db2.gz PMQBTAUZLFCKBX-VGOFRKELSA-N 0 3 411.521 4.344 20 0 HIADHN CCN(C(=O)c1cn(CC(F)(F)F)nc1C)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000477469573 892444858 /nfs/dbraw/zinc/44/48/58/892444858.db2.gz IAYFOLXDNWSABL-AEFFLSMTSA-N 0 3 408.468 4.051 20 0 HIADHN O=C(Nc1cccc(OC[C@H]2CCCO2)c1)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000504925916 913663799 /nfs/dbraw/zinc/66/37/99/913663799.db2.gz SQLNTOZQEVBDMG-JTHBVZDNSA-N 0 3 409.530 4.031 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)NCc1ccc(F)cc1C(F)(F)F)c1ccco1 ZINC000477608070 892692844 /nfs/dbraw/zinc/69/28/44/892692844.db2.gz BBFRYVTZVACTHU-LRDDRELGSA-N 0 3 401.404 4.366 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@H](C)c2cn(C)c3ccccc23)cc1 ZINC000477621849 892726328 /nfs/dbraw/zinc/72/63/28/892726328.db2.gz NHOPOTHSAZRYOT-WZONZLPQSA-N 0 3 405.542 4.244 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)Nc1ccc(-c2nccs2)cc1 ZINC000504960139 913698917 /nfs/dbraw/zinc/69/89/17/913698917.db2.gz UNZBFQWNWINDCW-UHFFFAOYSA-N 0 3 402.589 4.293 20 0 HIADHN CC(C)n1ncc2c1C[C@@H](N[C@@H](C)c1ccccc1I)CC2 ZINC000477686662 892810164 /nfs/dbraw/zinc/81/01/64/892810164.db2.gz AQFAJLBUOLXVBB-ZFWWWQNUSA-N 0 3 409.315 4.277 20 0 HIADHN CCN(C[C@H]1CCN(Cc2c3ccccc3sc2C(=O)OC)C1)CC(F)(F)F ZINC000477731391 892830953 /nfs/dbraw/zinc/83/09/53/892830953.db2.gz KPGVUFSZERXXFG-CQSZACIVSA-N 0 3 414.493 4.394 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)[C@@H]1C[C@H]1c1c(F)cccc1Cl ZINC000477758150 892848991 /nfs/dbraw/zinc/84/89/91/892848991.db2.gz ZHPLDOWUJQHTEM-RTBURBONSA-N 0 3 416.924 4.426 20 0 HIADHN O=C(CCc1ccnc2ccccc12)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000477758095 892849055 /nfs/dbraw/zinc/84/90/55/892849055.db2.gz ZAVZWEQLJHZTKJ-UHFFFAOYSA-N 0 3 403.526 4.010 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N1CCC(c2ccc(Cl)cc2)CC1 ZINC000477880538 892942463 /nfs/dbraw/zinc/94/24/63/892942463.db2.gz UBFJXIHGBRNYPB-UHFFFAOYSA-N 0 3 413.949 4.055 20 0 HIADHN CCCN(C)[C@H](CNC(=O)N[C@H]1CCCc2[nH]c(=O)ccc21)c1ccc(Cl)cc1 ZINC000477881141 892946239 /nfs/dbraw/zinc/94/62/39/892946239.db2.gz QNNVHORSOBINQT-VQTJNVASSA-N 0 3 416.953 4.200 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)Nc1ccc(NC(=O)c2ccccc2)cn1 ZINC000477893088 892959699 /nfs/dbraw/zinc/95/96/99/892959699.db2.gz MUBYTIJTZWYWCB-UHFFFAOYSA-N 0 3 414.465 4.394 20 0 HIADHN C[C@H](NC(=O)NCc1ccc(OCC(F)(F)F)cc1)[C@H](c1ccccc1)N(C)C ZINC000477902778 892974306 /nfs/dbraw/zinc/97/43/06/892974306.db2.gz BFEUHIJQISJBEC-HNAYVOBHSA-N 0 3 409.452 4.118 20 0 HIADHN Cc1ccc(CN2CC[C@H](N[C@@H](C)CC(=O)Nc3ccc(C)cc3Cl)C2=O)cc1 ZINC000477917351 893000679 /nfs/dbraw/zinc/00/06/79/893000679.db2.gz NSLVMJXIURFTEM-UWJYYQICSA-N 0 3 413.949 4.065 20 0 HIADHN C[C@H](CNC(=O)C(=O)Nc1ccccc1Oc1ccccc1)N(C)Cc1ccccc1 ZINC000478181545 893345324 /nfs/dbraw/zinc/34/53/24/893345324.db2.gz QYJSJZYYWOOGIG-LJQANCHMSA-N 0 3 417.509 4.054 20 0 HIADHN C[C@H](NC(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1)c1c(F)cccc1Cl ZINC000478378718 893645785 /nfs/dbraw/zinc/64/57/85/893645785.db2.gz HTFXQFUENMTUIN-OAGGEKHMSA-N 0 3 411.949 4.071 20 0 HIADHN CC(C)c1ccc(-c2noc(CCC(=O)N[C@@H]3CN(C)C[C@@H]3c3ccccc3)n2)cc1 ZINC000478396122 893678091 /nfs/dbraw/zinc/67/80/91/893678091.db2.gz COGJPKCESILFIR-FGZHOGPDSA-N 0 3 418.541 4.007 20 0 HIADHN COc1ccccc1C[C@@H](NC(=O)N(Cc1ccco1)C1CCN(C)CC1)C(C)C ZINC000478404601 893689862 /nfs/dbraw/zinc/68/98/62/893689862.db2.gz YHPVNRLPDKBRIK-JOCHJYFZSA-N 0 3 413.562 4.161 20 0 HIADHN COc1cnccc1N1CCN(C(=O)c2csc(-c3ccc(C(C)C)cc3)n2)CC1 ZINC000478496956 893813280 /nfs/dbraw/zinc/81/32/80/893813280.db2.gz YVQVZIPGVHVWMM-UHFFFAOYSA-N 0 3 422.554 4.300 20 0 HIADHN CC(C)[C@H](C(=O)N[C@@H](C)c1nc(-c2ccc(Br)cc2)cs1)N(C)C ZINC000478503065 893816894 /nfs/dbraw/zinc/81/68/94/893816894.db2.gz DQCGXWJGZANFMX-BLLLJJGKSA-N 0 3 410.381 4.336 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)NCc2ccc(-c3ccccc3)o2)c1 ZINC000478614426 893876347 /nfs/dbraw/zinc/87/63/47/893876347.db2.gz AXUIGIGIPPUCKK-UHFFFAOYSA-N 0 3 407.514 4.229 20 0 HIADHN CCC(CC)(C(=O)NC1CCN(CCOC)CC1)c1ccc(Cl)c(Cl)c1 ZINC000505100200 913816619 /nfs/dbraw/zinc/81/66/19/913816619.db2.gz YMJOZVRNTHKIAJ-UHFFFAOYSA-N 0 3 401.378 4.278 20 0 HIADHN Cc1ccc(NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)cc1NC(=O)N(C)C ZINC000478661049 893904818 /nfs/dbraw/zinc/90/48/18/893904818.db2.gz IMTYFHDLSVUPKO-GOSISDBHSA-N 0 3 412.509 4.078 20 0 HIADHN Cc1ccc(NC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)cc1NC(=O)N(C)C ZINC000478661050 893904923 /nfs/dbraw/zinc/90/49/23/893904923.db2.gz IMTYFHDLSVUPKO-SFHVURJKSA-N 0 3 412.509 4.078 20 0 HIADHN COc1ccc([C@H](C)N(C)C(=O)[C@@H]2CN(Cc3ccccc3)CCC2(F)F)cc1 ZINC000505120458 913827396 /nfs/dbraw/zinc/82/73/96/913827396.db2.gz OUKGINHMXOJJRG-UWJYYQICSA-N 0 3 402.485 4.372 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2cccc(Br)c2)c1 ZINC000478771803 894046638 /nfs/dbraw/zinc/04/66/38/894046638.db2.gz MYTIYMFHIHDTTE-UHFFFAOYSA-N 0 3 406.324 4.053 20 0 HIADHN C[C@H](NC(=O)NCc1cccc(OCC(F)(F)F)c1)[C@H](c1ccccc1)N(C)C ZINC000478803897 894077834 /nfs/dbraw/zinc/07/78/34/894077834.db2.gz WJMDYZZYQZZBQV-HNAYVOBHSA-N 0 3 409.452 4.118 20 0 HIADHN CC(C)Oc1ccc(Cl)cc1C(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000478859272 894138780 /nfs/dbraw/zinc/13/87/80/894138780.db2.gz CHOZMQIMXDCWIA-UHFFFAOYSA-N 0 3 416.949 4.014 20 0 HIADHN CN(C)Cc1cccc(NC(=O)[C@H]2CC(=O)N(C)[C@@H]2c2ccc(Cl)c(Cl)c2)c1 ZINC000478904033 894184617 /nfs/dbraw/zinc/18/46/17/894184617.db2.gz SNFSWGZZANYGDL-OXJNMPFZSA-N 0 3 420.340 4.213 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2ccc(F)cc2Br)c1 ZINC000479002661 894273485 /nfs/dbraw/zinc/27/34/85/894273485.db2.gz RITUQORGVAZLEA-UHFFFAOYSA-N 0 3 424.314 4.193 20 0 HIADHN CSc1cccc(N(C(=O)c2ccncc2Br)C2CCN(C)CC2)c1 ZINC000479005010 894274741 /nfs/dbraw/zinc/27/47/41/894274741.db2.gz XOGUQQLSWAIGCB-UHFFFAOYSA-N 0 3 420.376 4.307 20 0 HIADHN O=c1ccccn1Cc1ccc(CN[C@@H]2CCCc3nn(-c4ccccc4)cc32)cc1 ZINC000479057866 894316901 /nfs/dbraw/zinc/31/69/01/894316901.db2.gz IQIHPTMNOBVRLB-XMMPIXPASA-N 0 3 410.521 4.250 20 0 HIADHN Cc1nc(COc2ccc(CNCc3ccc(NC(=O)N(C)C)cc3)cc2)cs1 ZINC000479062538 894322045 /nfs/dbraw/zinc/32/20/45/894322045.db2.gz XNSGXEQYQDBWAR-UHFFFAOYSA-N 0 3 410.543 4.414 20 0 HIADHN C[C@@H](NCCCc1cccc(F)c1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479067201 894331328 /nfs/dbraw/zinc/33/13/28/894331328.db2.gz VOTQAVYXHDJHAV-LLVKDONJSA-N 0 3 405.322 4.063 20 0 HIADHN COc1cc2c(cc1OC)[C@@H](NCc1cc(Br)c3c(c1)OCCO3)CC2 ZINC000479071251 894334692 /nfs/dbraw/zinc/33/46/92/894334692.db2.gz RQRHUJZLQIHWNF-INIZCTEOSA-N 0 3 420.303 4.015 20 0 HIADHN C[C@H](NCCc1ccc(Cl)s1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479073534 894337608 /nfs/dbraw/zinc/33/76/08/894337608.db2.gz XOTUQNSFAXGVNH-QMMMGPOBSA-N 0 3 413.779 4.249 20 0 HIADHN COc1cc2c(cc1OC)[C@H](N[C@H]1CCCN(c3ccccc3Cl)C1=O)CC2 ZINC000479079443 894345545 /nfs/dbraw/zinc/34/55/45/894345545.db2.gz PQALOLIZBQJLJP-MSOLQXFVSA-N 0 3 400.906 4.130 20 0 HIADHN C[C@@H](NCC(C)(C)c1cccc(F)c1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479083117 894349324 /nfs/dbraw/zinc/34/93/24/894349324.db2.gz VIOUMZWGUBDHJS-LLVKDONJSA-N 0 3 419.349 4.408 20 0 HIADHN CCOc1c(Cl)cccc1CC(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000479174802 894443490 /nfs/dbraw/zinc/44/34/90/894443490.db2.gz HPJWIYCLFANEAP-UHFFFAOYSA-N 0 3 416.949 4.124 20 0 HIADHN CN(C)Cc1cccc(NC(=O)NCC2(c3ccc4c(c3)OCCO4)CCCC2)c1 ZINC000505191250 913873171 /nfs/dbraw/zinc/87/31/71/913873171.db2.gz SZWFLBFEKXLRLW-UHFFFAOYSA-N 0 3 409.530 4.153 20 0 HIADHN CCOc1ccc([C@@H](C)NC(=O)NC[C@@H](c2ccccc2)N2CCCC2)cc1OC ZINC000505205968 913882986 /nfs/dbraw/zinc/88/29/86/913882986.db2.gz WAHIHAXQUGVSOC-NQIIRXRSSA-N 0 3 411.546 4.291 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)NCc2ccc(-c3ccncc3)cc2)c1 ZINC000479316094 894602883 /nfs/dbraw/zinc/60/28/83/894602883.db2.gz JDNWPLANHVFDKG-UHFFFAOYSA-N 0 3 418.541 4.031 20 0 HIADHN C[C@@H](NCC1(c2ccc(F)cc2)CC1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479334517 894627736 /nfs/dbraw/zinc/62/77/36/894627736.db2.gz ZFULAGLATDLVFP-LLVKDONJSA-N 0 3 417.333 4.162 20 0 HIADHN COCCOc1ccc([C@@H](C)N[C@H]2CCc3cc(OC)c(OC)cc32)cc1OC ZINC000479344756 894639245 /nfs/dbraw/zinc/63/92/45/894639245.db2.gz DBSMFKCRVQILMZ-BEFAXECRSA-N 0 3 401.503 4.076 20 0 HIADHN C[C@H](NCC(C)(C)c1ccccc1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479347761 894643170 /nfs/dbraw/zinc/64/31/70/894643170.db2.gz PXBPFCRKZOZDME-LBPRGKRZSA-N 0 3 401.359 4.269 20 0 HIADHN C[C@@H](N[C@@H](C)Cc1ccccc1F)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479354651 894650630 /nfs/dbraw/zinc/65/06/30/894650630.db2.gz CKJBITIOWQHPRJ-WDEREUQCSA-N 0 3 405.322 4.062 20 0 HIADHN CC1(C)C[C@H](NCc2cccc(NS(C)(=O)=O)c2)c2cc(Br)ccc21 ZINC000479355543 894653315 /nfs/dbraw/zinc/65/33/15/894653315.db2.gz DCYIKUHRYCOCLG-SFHVURJKSA-N 0 3 423.376 4.333 20 0 HIADHN COc1cc2c(cc1OC)[C@H](NCc1ccc(N3CCc4ccccc4C3)nc1)CC2 ZINC000479366239 894666313 /nfs/dbraw/zinc/66/63/13/894666313.db2.gz WZBCIEHBKJKVEJ-HSZRJFAPSA-N 0 3 415.537 4.439 20 0 HIADHN COc1c(Br)cccc1CNCCc1nc(-c2ccc(Cl)cc2)no1 ZINC000479397327 894701554 /nfs/dbraw/zinc/70/15/54/894701554.db2.gz XKDBQPCLLVHISL-UHFFFAOYSA-N 0 3 422.710 4.493 20 0 HIADHN C[C@@H](NCCC1Cc2ccccc2C1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479400289 894705437 /nfs/dbraw/zinc/70/54/37/894705437.db2.gz XVGDUAYKJSGGTB-GFCCVEGCSA-N 0 3 413.370 4.097 20 0 HIADHN Cc1ccc(CN[C@@H]2CCCc3cc(Br)ccc32)cc1S(C)(=O)=O ZINC000479438033 894752531 /nfs/dbraw/zinc/75/25/31/894752531.db2.gz NKGXLLZDRIALQN-GOSISDBHSA-N 0 3 408.361 4.328 20 0 HIADHN COc1c(Br)cccc1CNCCc1nc(-c2ccccn2)cs1 ZINC000479440354 894754599 /nfs/dbraw/zinc/75/45/99/894754599.db2.gz SWAXYZWSQZZORH-UHFFFAOYSA-N 0 3 404.333 4.309 20 0 HIADHN C[C@H](CCCC(F)(F)F)N[C@@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479459508 894781667 /nfs/dbraw/zinc/78/16/67/894781667.db2.gz WQEWVJOYLBMMMX-BDAKNGLRSA-N 0 3 407.285 4.413 20 0 HIADHN CC(C)n1ncc2c1C[C@@H](N[C@@H](C(=O)Nc1ccc(F)cc1)c1ccccc1)CC2 ZINC000479491839 894812079 /nfs/dbraw/zinc/81/20/79/894812079.db2.gz QPLAWSDJFVIGDK-JTHBVZDNSA-N 0 3 406.505 4.430 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(OC(F)(F)F)cc1)C(=O)NC(=O)Nc1ccccc1F ZINC000479505613 894820483 /nfs/dbraw/zinc/82/04/83/894820483.db2.gz SSPATRYNVZMPDN-NWDGAFQWSA-N 0 3 413.371 4.112 20 0 HIADHN CCOC(=O)c1sc(NC(=O)c2cccc(CN(C)C)c2)nc1-c1ccccc1 ZINC000479515508 894827536 /nfs/dbraw/zinc/82/75/36/894827536.db2.gz YBEHBRINWNESBM-UHFFFAOYSA-N 0 3 409.511 4.301 20 0 HIADHN C[C@H](N[C@H](Cc1ccc(C(F)(F)F)cc1)C(N)=O)c1ccc(OC(F)(F)F)cc1 ZINC000479545007 894846677 /nfs/dbraw/zinc/84/66/77/894846677.db2.gz OCBRMAQYDVMVIC-MEDUHNTESA-N 0 3 420.353 4.351 20 0 HIADHN COc1cc([C@@H](C)NC(=O)N2CCN(C3CCCC3)CC2)ccc1OCC(C)C ZINC000505261858 913919441 /nfs/dbraw/zinc/91/94/41/913919441.db2.gz NKSZKUAHCIEKIT-GOSISDBHSA-N 0 3 403.567 4.061 20 0 HIADHN CCN(Cc1ccc(C(=O)N(C)C)cc1)Cc1ccc(OC)c(Br)c1 ZINC000479687259 894972933 /nfs/dbraw/zinc/97/29/33/894972933.db2.gz GIQCSCAWVKNIQS-UHFFFAOYSA-N 0 3 405.336 4.182 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)NCc2ccc(C)cc2OC(C)C)c1 ZINC000479694119 894983436 /nfs/dbraw/zinc/98/34/36/894983436.db2.gz ZYEVMAHELTWCLK-UHFFFAOYSA-N 0 3 413.562 4.064 20 0 HIADHN O=C(Cc1ccccc1)Nc1cc(NC(=O)[C@H]2CCCN2C2CCCC2)ccc1F ZINC000479740247 895040318 /nfs/dbraw/zinc/04/03/18/895040318.db2.gz FDXBTPOAVQISOG-JOCHJYFZSA-N 0 3 409.505 4.352 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)N1C[C@H](c2ccccc2)[C@@H]2COCC[C@H]21 ZINC000479742907 895041897 /nfs/dbraw/zinc/04/18/97/895041897.db2.gz FKCMFSQQCOOTBN-ZFFYZDHPSA-N 0 3 419.569 4.038 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N[C@@H](C)c1cc(OC)c(OC)cc1C)c1ccco1 ZINC000479778474 895081105 /nfs/dbraw/zinc/08/11/05/895081105.db2.gz BFCAWDKIXHTLIT-BQFCYCMXSA-N 0 3 403.523 4.095 20 0 HIADHN CCN(C(=O)c1cc(OCC(F)F)ccn1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000479839533 895167528 /nfs/dbraw/zinc/16/75/28/895167528.db2.gz OVTZCZOPTAAHMS-FUHWJXTLSA-N 0 3 403.473 4.023 20 0 HIADHN COc1cccc([C@H](CN[C@H](C)c2nnn(-c3ccc(Cl)cc3)c2C)N(C)C)c1 ZINC000479870722 895212492 /nfs/dbraw/zinc/21/24/92/895212492.db2.gz FBESLVHJHCEJQJ-VFNWGFHPSA-N 0 3 413.953 4.191 20 0 HIADHN Cc1nc(-c2cccnc2)sc1[C@@H](C)NCc1ccccc1CN1CCOCC1 ZINC000479903434 895250598 /nfs/dbraw/zinc/25/05/98/895250598.db2.gz QXETWJNRSBVEBW-QGZVFWFLSA-N 0 3 408.571 4.197 20 0 HIADHN CC[C@@H](C)n1ncc(C(=O)N(CCN(C)C)Cc2ccc(Br)cc2)c1C ZINC000479941062 895292058 /nfs/dbraw/zinc/29/20/58/895292058.db2.gz NPJKPUXRZYUNAP-OAHLLOKOSA-N 0 3 421.383 4.129 20 0 HIADHN CCc1ccc(-c2ccc(C(=O)NCc3ccccc3CN3CCC(O)CC3)o2)cc1 ZINC000479960473 895313324 /nfs/dbraw/zinc/31/33/24/895313324.db2.gz HGAUKEFKYWIDBG-UHFFFAOYSA-N 0 3 418.537 4.396 20 0 HIADHN CS(=O)(=O)CCCCN[C@H](c1cccc(F)c1)c1cccc(Br)c1 ZINC000480024469 895374828 /nfs/dbraw/zinc/37/48/28/895374828.db2.gz UIKJKXUQYGZEOF-SFHVURJKSA-N 0 3 414.340 4.092 20 0 HIADHN CCCc1c(NC(=O)NC[C@H](N[C@@H](C)CC)c2ccco2)cnn1-c1cc(C)ccn1 ZINC000480077479 895430838 /nfs/dbraw/zinc/43/08/38/895430838.db2.gz LETSMJKJZOLUDB-HKUYNNGSSA-N 0 3 424.549 4.372 20 0 HIADHN COc1cccc([C@H](CN[C@@H](C)c2cc(OC)c(OC)cc2F)N2CCCC2)c1 ZINC000480080242 895436577 /nfs/dbraw/zinc/43/65/77/895436577.db2.gz AAMAKJQXUJEGSZ-KKSFZXQISA-N 0 3 402.510 4.339 20 0 HIADHN COc1ccc([C@H](CN[C@H](C)c2cc(OC)c(OC)cc2F)N2CCCC2)cc1 ZINC000480087503 895449276 /nfs/dbraw/zinc/44/92/76/895449276.db2.gz XEZOSUDUUHJXDB-IERDGZPVSA-N 0 3 402.510 4.339 20 0 HIADHN C[C@@H](N[C@H](C)c1cccc2ccccc21)c1cccc(S(=O)(=O)N2CCOCC2)c1 ZINC000480098893 895466677 /nfs/dbraw/zinc/46/66/77/895466677.db2.gz YASSNQXUOJRDFN-RTBURBONSA-N 0 3 424.566 4.273 20 0 HIADHN CC[C@H](c1ccccc1)[C@H]1CCCN1CC(=O)Nc1cc(OC)c(OC)c(OC)c1 ZINC000480103140 895470642 /nfs/dbraw/zinc/47/06/42/895470642.db2.gz LOOPJUVRZNETLH-WOJBJXKFSA-N 0 3 412.530 4.309 20 0 HIADHN CC(C)[C@@H](N[C@H](C)c1ccc(S(C)(=O)=O)c(F)c1)c1ccc2c(c1)OCCO2 ZINC000480160950 895547862 /nfs/dbraw/zinc/54/78/62/895547862.db2.gz DYAWDITUQXORQN-SPLOXXLWSA-N 0 3 407.507 4.048 20 0 HIADHN CC(C)[C@H](N[C@@H](C)c1ccc(S(C)(=O)=O)c(F)c1)c1ccc2c(c1)OCCO2 ZINC000480160949 895548000 /nfs/dbraw/zinc/54/80/00/895548000.db2.gz DYAWDITUQXORQN-QKKBWIMNSA-N 0 3 407.507 4.048 20 0 HIADHN Cc1c(NC(=O)N2CCN(C3CCC(C(C)C)CC3)CC2)n(C)nc1C(F)(F)F ZINC000480162205 895549434 /nfs/dbraw/zinc/54/94/34/895549434.db2.gz PXGBHGIDISPYML-UHFFFAOYSA-N 0 3 415.504 4.112 20 0 HIADHN C[C@@H](CN[C@H]1CCS(=O)(=O)c2ccc(Br)cc21)c1ccc(F)cc1 ZINC000480169546 895560835 /nfs/dbraw/zinc/56/08/35/895560835.db2.gz VKPPJQCETAJQQT-SJCJKPOMSA-N 0 3 412.324 4.200 20 0 HIADHN COc1cc(OC)c([C@H](C)NC[C@@H](c2ccccc2)N2CCOCC2)cc1Cl ZINC000480251132 895662970 /nfs/dbraw/zinc/66/29/70/895662970.db2.gz GVROTDXWPVZWJJ-JXFKEZNVSA-N 0 3 404.938 4.081 20 0 HIADHN C[C@@H](Cc1ccccc1F)N[C@@H]1CCS(=O)(=O)c2ccc(Br)cc21 ZINC000480258875 895667801 /nfs/dbraw/zinc/66/78/01/895667801.db2.gz SQFKTUUQCZEKKJ-YVEFUNNKSA-N 0 3 412.324 4.028 20 0 HIADHN COc1ccc(-c2nc3c(s2)[C@H](NCc2ccc(NC(N)=O)cc2)CCC3)cc1 ZINC000480315813 895718034 /nfs/dbraw/zinc/71/80/34/895718034.db2.gz RYOFUBCKXTVJNK-GOSISDBHSA-N 0 3 408.527 4.477 20 0 HIADHN O[C@@H](C(F)F)[C@H](Cc1ccccc1)NCc1cc(Br)c(Cl)s1 ZINC000480343829 895749358 /nfs/dbraw/zinc/74/93/58/895749358.db2.gz OUYLNCPJMQSCSI-QWHCGFSZSA-N 0 3 410.711 4.491 20 0 HIADHN O[C@H](C(F)F)[C@@H](Cc1ccccc1)NCc1cc(Br)c(Cl)s1 ZINC000480343828 895750212 /nfs/dbraw/zinc/75/02/12/895750212.db2.gz OUYLNCPJMQSCSI-OLZOCXBDSA-N 0 3 410.711 4.491 20 0 HIADHN COc1cccc(C(NC(=O)c2cccc(CN(C)C)c2)c2cccc(OC)c2)c1 ZINC000480383371 895788697 /nfs/dbraw/zinc/78/86/97/895788697.db2.gz GBIQJYLYSLGGKX-UHFFFAOYSA-N 0 3 404.510 4.285 20 0 HIADHN Cc1ccc(Oc2ccccc2NC(=O)N2CC[C@@H](N3CCN(C)CC3)[C@H](C)C2)cc1 ZINC000480384501 895790903 /nfs/dbraw/zinc/79/09/03/895790903.db2.gz ZGBPDXRWXOGBGP-NFBKMPQASA-N 0 3 422.573 4.277 20 0 HIADHN Brc1ccc(-c2nnc(C[NH2+]Cc3ccc(OCC4CC4)cc3)[n-]2)cc1 ZINC000480395015 895801406 /nfs/dbraw/zinc/80/14/06/895801406.db2.gz PQQDBWPJQZRVKO-UHFFFAOYSA-N 0 3 413.319 4.313 20 0 HIADHN O=C(NCCNCc1cc(Br)c(Cl)s1)c1ccccc1Cl ZINC000480397105 895802516 /nfs/dbraw/zinc/80/25/16/895802516.db2.gz WZIZLKRUSRRFJW-UHFFFAOYSA-N 0 3 408.148 4.337 20 0 HIADHN Brc1ccc2c(c1)CC[C@H]2N[C@H](CN1CCOCC1)c1ccccc1 ZINC000480441014 895830487 /nfs/dbraw/zinc/83/04/87/895830487.db2.gz BLDKHUIRSIFYJY-NHCUHLMSSA-N 0 3 401.348 4.100 20 0 HIADHN Fc1cc(Br)cc2c1CC[C@@H]2N[C@H](CN1CCOCC1)c1ccccc1 ZINC000480451764 895840038 /nfs/dbraw/zinc/84/00/38/895840038.db2.gz YHMNRXJHAWZJLL-LEWJYISDSA-N 0 3 419.338 4.239 20 0 HIADHN Cc1ccc(Oc2ccc(NC(=O)N3CC[C@H](N4CCN(C)CC4)[C@@H](C)C3)cc2)cc1 ZINC000480536256 895899230 /nfs/dbraw/zinc/89/92/30/895899230.db2.gz AMMMLMBCQDUFFL-RDPSFJRHSA-N 0 3 422.573 4.277 20 0 HIADHN Cc1ccc(Oc2ccc(NC(=O)N3CC[C@@H](N4CCN(C)CC4)[C@H](C)C3)cc2)cc1 ZINC000480536255 895899468 /nfs/dbraw/zinc/89/94/68/895899468.db2.gz AMMMLMBCQDUFFL-HYBUGGRVSA-N 0 3 422.573 4.277 20 0 HIADHN Cc1nc(-c2cccnc2)nc(NC2CC(N3CCC(C(F)(F)F)CC3)C2)c1C ZINC000480546535 895907353 /nfs/dbraw/zinc/90/73/53/895907353.db2.gz AODVGLFXFARRRX-UHFFFAOYSA-N 0 3 405.468 4.373 20 0 HIADHN Cn1ncc2c1CCC[C@H]2NCc1ccc(NC(=O)CCCOc2ccccc2)cc1 ZINC000480602077 895966408 /nfs/dbraw/zinc/96/64/08/895966408.db2.gz PNJZZKBVPYLEFN-HSZRJFAPSA-N 0 3 418.541 4.385 20 0 HIADHN Cc1cc2cc([C@@H](C)NCc3ccc(C(=O)N4CCN(C)CC4)cc3)oc2cc1C ZINC000480602819 895967818 /nfs/dbraw/zinc/96/78/18/895967818.db2.gz BXZWKFZCLOQYEN-LJQANCHMSA-N 0 3 405.542 4.288 20 0 HIADHN CCCCCOc1ccc([C@@H](C)NCc2ccc(C(=O)N3CCN(C)CC3)cc2)cc1 ZINC000480605626 895969837 /nfs/dbraw/zinc/96/98/37/895969837.db2.gz XHCKPWRSEKJGQX-OAQYLSRUSA-N 0 3 423.601 4.494 20 0 HIADHN COc1cc([C@@H](C)N[C@H](C)c2ccc(NC(=O)NC3CC3)cc2)cc(OC)c1OC ZINC000480616854 895984120 /nfs/dbraw/zinc/98/41/20/895984120.db2.gz WJBQWVPEYJSQLN-HUUCEWRRSA-N 0 3 413.518 4.408 20 0 HIADHN COc1cc([C@H](C)N[C@H](C)c2ccc(NC(=O)NC3CC3)cc2)cc(OC)c1OC ZINC000480616852 895984606 /nfs/dbraw/zinc/98/46/06/895984606.db2.gz WJBQWVPEYJSQLN-CABCVRRESA-N 0 3 413.518 4.408 20 0 HIADHN CCCCOc1ccc([C@@H](C)NCc2ccc(N3CCO[C@@H](C)C3)nc2)cc1OC ZINC000480622271 895990055 /nfs/dbraw/zinc/99/00/55/895990055.db2.gz GDLVVKUIFUHSGF-RBUKOAKNSA-N 0 3 413.562 4.345 20 0 HIADHN CCOc1ccc([C@H](C)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)nc2)cc1OCC ZINC000480622733 895991464 /nfs/dbraw/zinc/99/14/64/895991464.db2.gz WCVUSYDEXYDYFH-QRVBRYPASA-N 0 3 413.562 4.343 20 0 HIADHN CC(C)CCn1ccc(NC(=O)Nc2ccc(CCN3CCSCC3)cc2)n1 ZINC000480633849 896004450 /nfs/dbraw/zinc/00/44/50/896004450.db2.gz HHCAKVIFGPBHGE-UHFFFAOYSA-N 0 3 401.580 4.165 20 0 HIADHN Brc1cccc(N2CC[C@H](CNCc3nccn3-c3ccccc3)C2)c1 ZINC000480674078 896038160 /nfs/dbraw/zinc/03/81/60/896038160.db2.gz SSVOVAIRRUSRDA-QGZVFWFLSA-N 0 3 411.347 4.251 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)N2CCC[C@@H]2c2ccc3c(c2)OCO3)N(C)C)cc1 ZINC000480679521 896042486 /nfs/dbraw/zinc/04/24/86/896042486.db2.gz BFBFVOHMSUDTIW-NHCUHLMSSA-N 0 3 409.530 4.127 20 0 HIADHN C[C@H](NCc1ccc(N2CCCS2(=O)=O)c(F)c1)c1ccc(OC(C)(C)C)cc1 ZINC000480708477 896071130 /nfs/dbraw/zinc/07/11/30/896071130.db2.gz LJZSHKSRFKSRDX-INIZCTEOSA-N 0 3 420.550 4.394 20 0 HIADHN O=C(Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1)[C@H]1CCC(F)(F)C1 ZINC000480711817 896074981 /nfs/dbraw/zinc/07/49/81/896074981.db2.gz RLRLWCJQNKHCMN-FQEVSTJZSA-N 0 3 413.512 4.425 20 0 HIADHN Cc1ccc2c(c1C)OC[C@@H]2NC(=O)N(CCN(C)C)Cc1cccc(Cl)c1 ZINC000480716893 896077342 /nfs/dbraw/zinc/07/73/42/896077342.db2.gz BQAOUHOHYYNIGL-FQEVSTJZSA-N 0 3 401.938 4.164 20 0 HIADHN CC(C)Cc1ccc([C@@H](C)NCc2ccc(N3CCCS3(=O)=O)c(F)c2)cc1 ZINC000480723470 896085080 /nfs/dbraw/zinc/08/50/80/896085080.db2.gz ZFZFGXKYFYTQCD-QGZVFWFLSA-N 0 3 404.551 4.415 20 0 HIADHN CCCOc1ccc([C@H](C)N[C@H](C)c2ccc(S(=O)(=O)N(C)C)cc2)cc1OC ZINC000480737268 896097062 /nfs/dbraw/zinc/09/70/62/896097062.db2.gz CSNUGXJZDWIUGZ-SJORKVTESA-N 0 3 420.575 4.146 20 0 HIADHN CCCOc1ccc([C@H](C)N[C@@H](C)c2ccc(NS(C)(=O)=O)cc2)cc1OC ZINC000480737434 896097852 /nfs/dbraw/zinc/09/78/52/896097852.db2.gz ILFGBNFTFSREJX-HOTGVXAUSA-N 0 3 406.548 4.267 20 0 HIADHN CN1CCN(c2cc(CN[C@H]3CCCSc4ccc(Cl)cc43)ccn2)CC1 ZINC000480740010 896100075 /nfs/dbraw/zinc/10/00/75/896100075.db2.gz VAWWDPFLIKHKBY-IBGZPJMESA-N 0 3 402.995 4.204 20 0 HIADHN COc1cc(NC(=O)N[C@@H](CN(C)C)c2ccc(F)cc2)cc(OC)c1C(C)C ZINC000480748154 896109208 /nfs/dbraw/zinc/10/92/08/896109208.db2.gz KYZROAITPWOBKH-SFHVURJKSA-N 0 3 403.498 4.391 20 0 HIADHN Cc1ccc(CN2CCC(C(=O)Nc3cccc(Br)c3)CC2)c(C)n1 ZINC000480755256 896118038 /nfs/dbraw/zinc/11/80/38/896118038.db2.gz GNYIHJULZRMQEK-UHFFFAOYSA-N 0 3 402.336 4.312 20 0 HIADHN C[C@@H](NC[C@H](c1cccc(Cl)c1)N1CCCC1)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000480774193 896138571 /nfs/dbraw/zinc/13/85/71/896138571.db2.gz VIVXZUWFYVBDIQ-FOIQADDNSA-N 0 3 424.969 4.370 20 0 HIADHN C[C@@H](NCc1cccc(Cn2ccnc2)c1)c1ccc(S(=O)(=O)C2CCCC2)cc1 ZINC000480787994 896154153 /nfs/dbraw/zinc/15/41/53/896154153.db2.gz QLWFDOOIZHHBFR-LJQANCHMSA-N 0 3 423.582 4.499 20 0 HIADHN C[C@H]1CN(C(=O)Nc2ccc(SC3CCCC3)cc2)CC[C@@H]1N1CCN(C)CC1 ZINC000480806642 896173546 /nfs/dbraw/zinc/17/35/46/896173546.db2.gz NGVOUVIFXSWUQV-AVRDEDQJSA-N 0 3 416.635 4.211 20 0 HIADHN C[C@H]1CN(C(=O)Nc2ccc3c(c2)C(C)(C)CC3(C)C)CC[C@H]1N1CCN(C)CC1 ZINC000480816432 896188264 /nfs/dbraw/zinc/18/82/64/896188264.db2.gz FQGDUFIVUXLLMG-PGRDOPGGSA-N 0 3 412.622 4.135 20 0 HIADHN C[C@H]1CN(C(=O)Nc2ccc3c(c2)C(C)(C)CC3(C)C)CC[C@@H]1N1CCN(C)CC1 ZINC000480816429 896188484 /nfs/dbraw/zinc/18/84/84/896188484.db2.gz FQGDUFIVUXLLMG-AVRDEDQJSA-N 0 3 412.622 4.135 20 0 HIADHN C[C@@H](NCc1cccc(NC(=O)c2ccncc2)c1)c1cccc(N2CCOCC2)c1 ZINC000480879113 896235758 /nfs/dbraw/zinc/23/57/58/896235758.db2.gz GPNYONDDLVCDRT-LJQANCHMSA-N 0 3 416.525 4.021 20 0 HIADHN CCS(=O)(=O)Nc1ccc([C@@H](C)NCc2cc(F)cc(Br)c2)cc1 ZINC000480884652 896239333 /nfs/dbraw/zinc/23/93/33/896239333.db2.gz TUXDOMHADJJBLX-GFCCVEGCSA-N 0 3 415.328 4.201 20 0 HIADHN CC[C@@H](NCc1cccc(NC(=O)c2ccccn2)c1)c1ccc2c(c1)OCCO2 ZINC000480887222 896243612 /nfs/dbraw/zinc/24/36/12/896243612.db2.gz DOOWOTSCZGOFFI-HXUWFJFHSA-N 0 3 403.482 4.346 20 0 HIADHN COc1cc(CN[C@@H](C)c2sc(-c3ccc(F)cc3)nc2C)ccc1OCCO ZINC000480897094 896252890 /nfs/dbraw/zinc/25/28/90/896252890.db2.gz FAMSKPBXIGZCHC-AWEZNQCLSA-N 0 3 416.518 4.488 20 0 HIADHN CC(C)n1c2ccccc2nc1[C@H]1CCCN1C(=O)CC1(N2CCOCC2)CCCC1 ZINC000480896486 896253677 /nfs/dbraw/zinc/25/36/77/896253677.db2.gz CSAQJFWYRFFESS-JOCHJYFZSA-N 0 3 424.589 4.316 20 0 HIADHN Fc1ccccc1COc1ccc(CN(C[C@H]2CCCO2)[C@@H]2CCSC2)cn1 ZINC000480902984 896259401 /nfs/dbraw/zinc/25/94/01/896259401.db2.gz VUEQEANCWXSSGM-WOJBJXKFSA-N 0 3 402.535 4.286 20 0 HIADHN C[C@H](NCCNC(=O)c1ccc(Br)cc1)c1ccccc1OC(F)F ZINC000480904036 896259435 /nfs/dbraw/zinc/25/94/35/896259435.db2.gz FQDQAQYMYGKZDG-LBPRGKRZSA-N 0 3 413.262 4.131 20 0 HIADHN O=C(NCCN[C@@H]1CC2(CCC2)Oc2ccccc21)c1ccc(Br)cc1 ZINC000480910846 896268100 /nfs/dbraw/zinc/26/81/00/896268100.db2.gz PLEZSVSDSFNFNH-GOSISDBHSA-N 0 3 415.331 4.215 20 0 HIADHN CNS(=O)(=O)c1ccc([C@@H](C)N[C@@H](C)c2ccc(OCCC(C)C)cc2)cc1 ZINC000481166335 896498043 /nfs/dbraw/zinc/49/80/43/896498043.db2.gz CVCURENLPGIGCN-ZWKOTPCHSA-N 0 3 404.576 4.431 20 0 HIADHN COc1cc([C@@H](C)N[C@@H](C)c2sc(-c3cccnc3)nc2C)ccc1OCCO ZINC000481175047 896508877 /nfs/dbraw/zinc/50/88/77/896508877.db2.gz JYIKFPDBQYUVAZ-CABCVRRESA-N 0 3 413.543 4.305 20 0 HIADHN COc1ccc(-c2nc3c(s2)[C@H](NCC(=O)N(C)Cc2ccccc2)CCC3)cc1 ZINC000481181339 896520458 /nfs/dbraw/zinc/52/04/58/896520458.db2.gz ZDEQCDYBVSOXOI-HXUWFJFHSA-N 0 3 421.566 4.444 20 0 HIADHN COc1ccc(-c2nc3c(s2)[C@@H](NCC(=O)N(C)Cc2ccccc2)CCC3)cc1 ZINC000481181337 896520849 /nfs/dbraw/zinc/52/08/49/896520849.db2.gz ZDEQCDYBVSOXOI-FQEVSTJZSA-N 0 3 421.566 4.444 20 0 HIADHN COc1cc([C@@H](C)N[C@@H](C)c2ccc(Br)s2)ccc1OCCO ZINC000481191279 896541140 /nfs/dbraw/zinc/54/11/40/896541140.db2.gz QMDPYUZHYHNTFO-NEPJUHHUSA-N 0 3 400.338 4.302 20 0 HIADHN COc1ccc([C@@H](C)NCc2ccccc2OCCN2CCOCC2)c2ccccc12 ZINC000481196800 896551285 /nfs/dbraw/zinc/55/12/85/896551285.db2.gz XQNUJQHJZUPPKZ-HXUWFJFHSA-N 0 3 420.553 4.410 20 0 HIADHN O=C(CN[C@@H](CC1CCC1)c1ccccc1)N1CCC(C(=O)Nc2ccccc2)CC1 ZINC000481210760 896563147 /nfs/dbraw/zinc/56/31/47/896563147.db2.gz MSIUIVDOGAAUMT-DEOSSOPVSA-N 0 3 419.569 4.385 20 0 HIADHN C[C@@H]1CCCN(S(=O)(=O)c2ccc(CN[C@H]3CCCc4sccc43)cc2)C1 ZINC000481302012 896647021 /nfs/dbraw/zinc/64/70/21/896647021.db2.gz BQXXDJXBXZAFEQ-UZLBHIALSA-N 0 3 404.601 4.336 20 0 HIADHN Cc1cc2n[nH]cc2cc1NC(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000481304545 896651089 /nfs/dbraw/zinc/65/10/89/896651089.db2.gz IDKBKYPTAQDFDR-HXUWFJFHSA-N 0 3 402.420 4.264 20 0 HIADHN COCCOc1cccc(CN[C@@H](C)c2ccc(I)cc2)c1 ZINC000481309332 896656299 /nfs/dbraw/zinc/65/62/99/896656299.db2.gz OTHURQPOJIDKGF-AWEZNQCLSA-N 0 3 411.283 4.167 20 0 HIADHN CCCOCc1ccccc1CN[C@@H](C)c1cccc(N2CCCS2(=O)=O)c1 ZINC000481319968 896672506 /nfs/dbraw/zinc/67/25/06/896672506.db2.gz URWQZHZLVIASOT-SFHVURJKSA-N 0 3 402.560 4.004 20 0 HIADHN C[C@@H](NCc1cccc(CN2CCOCC2)c1)c1ccc(F)c(Br)c1 ZINC000481319576 896673104 /nfs/dbraw/zinc/67/31/04/896673104.db2.gz LMVVBIRJFUUJSG-OAHLLOKOSA-N 0 3 407.327 4.271 20 0 HIADHN CN(C)C(=O)COc1cccc(CN[C@H]2CCCc3nc(-c4ccccc4)sc32)c1 ZINC000481320936 896676272 /nfs/dbraw/zinc/67/62/72/896676272.db2.gz NWBABRPANWAACZ-FQEVSTJZSA-N 0 3 421.566 4.444 20 0 HIADHN C[C@@H](NCc1ccc(N2CCc3ccccc3C2)nc1)c1ccc([S@@](C)=O)cc1 ZINC000481323648 896678839 /nfs/dbraw/zinc/67/88/39/896678839.db2.gz OUSVATZYVUYGKR-LDLUVENISA-N 0 3 405.567 4.233 20 0 HIADHN CC[C@@H](N[C@H](C)c1ccccc1-n1cccn1)c1ccccc1OCC(=O)N(C)C ZINC000481324372 896681253 /nfs/dbraw/zinc/68/12/53/896681253.db2.gz YNPZYVAPQWZNBC-WIYYLYMNSA-N 0 3 406.530 4.141 20 0 HIADHN CC[C@@H](N[C@H](C)c1ccc2c(c1)OCO2)c1ccccc1OCC(=O)N1CCCC1 ZINC000481327594 896686503 /nfs/dbraw/zinc/68/65/03/896686503.db2.gz JWCHEFYJBYTBLA-YLJYHZDGSA-N 0 3 410.514 4.218 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(-n2cnnn2)cc1)c1cccc(OCc2ccccn2)c1 ZINC000481330799 896691249 /nfs/dbraw/zinc/69/12/49/896691249.db2.gz GSLKIBGZROAOKL-ZWKOTPCHSA-N 0 3 400.486 4.048 20 0 HIADHN Cc1ccc(NC(=O)C(C)(C)C)cc1NC(=O)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000481368879 896758028 /nfs/dbraw/zinc/75/80/28/896758028.db2.gz BPHMERJFEAANTB-FQEVSTJZSA-N 0 3 408.546 4.376 20 0 HIADHN CN(C)C[C@@H](NC(=O)N[C@H](c1ccc(F)cc1)C(F)(F)F)c1ccc(F)cc1 ZINC000481391412 896794719 /nfs/dbraw/zinc/79/47/19/896794719.db2.gz LVGPJWYFDJKWCE-IAGOWNOFSA-N 0 3 401.379 4.170 20 0 HIADHN COC(=O)[C@H]1CCCCCC[C@@H]1NCC(=O)Nc1c(Cl)cccc1C(F)(F)F ZINC000481430375 896831054 /nfs/dbraw/zinc/83/10/54/896831054.db2.gz GJRRJCZKJDKXDE-WFASDCNBSA-N 0 3 420.859 4.399 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccc(F)c2)C1)N1CC2(CCOCC2)c2ccccc21 ZINC000481468603 896858544 /nfs/dbraw/zinc/85/85/44/896858544.db2.gz XUMCNTAVCYDHQA-HXUWFJFHSA-N 0 3 408.517 4.133 20 0 HIADHN Cc1nc(Cc2ccccc2)sc1[C@@H](C)NC[C@H](O)COc1ccc(F)cc1 ZINC000481534763 896895485 /nfs/dbraw/zinc/89/54/85/896895485.db2.gz NQNARMIXRFGVTD-BEFAXECRSA-N 0 3 400.519 4.272 20 0 HIADHN COC[C@H](NCc1cccc(CN2CCO[C@@H](C)C2)c1)c1cccc(C(F)(F)F)c1 ZINC000481550287 896917428 /nfs/dbraw/zinc/91/74/28/896917428.db2.gz CFEYEFKOLXUEQL-JTSKRJEESA-N 0 3 422.491 4.403 20 0 HIADHN Cc1c([C@H](C)NC[C@H](O)COc2ccc(F)cc2)cnn1-c1cccc(Cl)c1 ZINC000481555316 896925500 /nfs/dbraw/zinc/92/55/00/896925500.db2.gz DRKMKAWDAUPNKN-LIRRHRJNSA-N 0 3 403.885 4.064 20 0 HIADHN CC[C@H](NC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2)c1ccc(Cl)cc1Cl ZINC000481556508 896928191 /nfs/dbraw/zinc/92/81/91/896928191.db2.gz JKHZSQVPEBNINC-BEFAXECRSA-N 0 3 423.340 4.359 20 0 HIADHN COc1cc(OC)c([C@H](C)NCc2cccc(CN3CCO[C@H](C)C3)c2)cc1Cl ZINC000481560375 896935248 /nfs/dbraw/zinc/93/52/48/896935248.db2.gz UZJYNOXGYKKWGN-SJORKVTESA-N 0 3 418.965 4.429 20 0 HIADHN CC[C@H](NCc1cccc(C(=O)NC[C@H]2CCCO2)c1)c1ccc(OC(F)F)cc1 ZINC000481562045 896937253 /nfs/dbraw/zinc/93/72/53/896937253.db2.gz KZWZJWSKELNUIG-RTWAWAEBSA-N 0 3 418.484 4.438 20 0 HIADHN Cc1cc2cc([C@H](C)NC[C@@H](O)COc3ccc4c(c3)CCC(=O)N4)oc2cc1C ZINC000481571155 896950196 /nfs/dbraw/zinc/95/01/96/896950196.db2.gz LWOLKARBNRIWSS-QFBILLFUSA-N 0 3 408.498 4.025 20 0 HIADHN C[C@@H](NCc1ccc(-n2ccnc2)c(F)c1)c1ccc(OCc2nccn2C)cc1 ZINC000481572571 896952275 /nfs/dbraw/zinc/95/22/75/896952275.db2.gz YSNCIGLZURHUKY-QGZVFWFLSA-N 0 3 405.477 4.175 20 0 HIADHN COc1ccc(CCC(=O)Nc2cc(C)cc(N3CCN(C(C)C)CC3)c2)cc1F ZINC000481635608 897019455 /nfs/dbraw/zinc/01/94/55/897019455.db2.gz BMDVGFDXGLRKNS-UHFFFAOYSA-N 0 3 413.537 4.244 20 0 HIADHN Cc1oc2ccc(NC(=O)NCc3ccccc3CN3CCC(O)CC3)cc2c1C ZINC000481639477 897024387 /nfs/dbraw/zinc/02/43/87/897024387.db2.gz PWNFHQVZSQRLKA-UHFFFAOYSA-N 0 3 407.514 4.328 20 0 HIADHN Cc1cc(NC(=O)c2cnc(-c3ccccn3)s2)cc(N2CCN(C(C)C)CC2)c1 ZINC000481650281 897036774 /nfs/dbraw/zinc/03/67/74/897036774.db2.gz MVZSNEIAXNSIIS-UHFFFAOYSA-N 0 3 421.570 4.296 20 0 HIADHN Cc1cc(NC(=O)Cc2cccc(OC(F)F)c2)cc(N2CCN(C(C)C)CC2)c1 ZINC000481668820 897051668 /nfs/dbraw/zinc/05/16/68/897051668.db2.gz LTPYMZLDWITQJJ-UHFFFAOYSA-N 0 3 417.500 4.308 20 0 HIADHN CCC(CC)[C@H]1C[C@H](NC(=O)Nc2ccc(N3CCN(CC)CC3)cc2C)CCO1 ZINC000481672990 897056493 /nfs/dbraw/zinc/05/64/93/897056493.db2.gz PPZKHXIZGCQJPF-NFBKMPQASA-N 0 3 416.610 4.242 20 0 HIADHN COc1ccc(NC(=O)CCN2CCC[C@]3(C2)OCc2ccccc23)cc1Cl ZINC000481678186 897061039 /nfs/dbraw/zinc/06/10/39/897061039.db2.gz SHUIUMQCFWJHPX-JOCHJYFZSA-N 0 3 400.906 4.199 20 0 HIADHN CC(C)C[C@@H]1OCCC[C@H]1NCC(=O)N1N=C(c2cccs2)C[C@@H]1c1ccco1 ZINC000481721249 897116142 /nfs/dbraw/zinc/11/61/42/897116142.db2.gz HKPGOHWICMOAJC-POAQFYNOSA-N 0 3 415.559 4.202 20 0 HIADHN C[C@H](NCc1cccc2cccnc21)c1ccc(S(=O)(=O)NCc2ccco2)cc1 ZINC000481739861 897135571 /nfs/dbraw/zinc/13/55/71/897135571.db2.gz TTWIQQDZUHVTJE-KRWDZBQOSA-N 0 3 421.522 4.157 20 0 HIADHN CC[C@H](CN(CC)CC(=O)N1CCC(C(=O)Nc2ccccc2)CC1)c1ccccc1 ZINC000481765951 897151882 /nfs/dbraw/zinc/15/18/82/897151882.db2.gz HKAFCRQCBYCFSL-OAQYLSRUSA-N 0 3 421.585 4.379 20 0 HIADHN CC(C)C[C@@H]1OCCC[C@@H]1NCC(=O)Nc1cccc(CSc2ccccn2)c1 ZINC000481769989 897154798 /nfs/dbraw/zinc/15/47/98/897154798.db2.gz VYBKGBJAIUFOJB-SFTDATJTSA-N 0 3 413.587 4.496 20 0 HIADHN CCCN(C(=O)NC1CCN(CCOC(C)C)CC1)[C@H]1C[C@@H](OCC)C12CCCC2 ZINC000481788021 897169028 /nfs/dbraw/zinc/16/90/28/897169028.db2.gz YSRISVRFJOJAKK-FCHUYYIVSA-N 0 3 423.642 4.035 20 0 HIADHN CN1C[C@H](NC(=O)Cc2csc(-c3ccc(Cl)cc3)n2)[C@H](c2ccccc2)C1 ZINC000481847124 897213815 /nfs/dbraw/zinc/21/38/15/897213815.db2.gz MMHYTIRFLLJCGQ-PMACEKPBSA-N 0 3 411.958 4.220 20 0 HIADHN CC(C)Oc1ccc(CN[C@@H](C)c2ccc(-n3cnnn3)cc2)c(C(F)(F)F)c1 ZINC000481949293 897338136 /nfs/dbraw/zinc/33/81/36/897338136.db2.gz UTDRFGGTKBFQGV-AWEZNQCLSA-N 0 3 405.424 4.319 20 0 HIADHN COC(=O)c1ccc(-c2ccc(CN3CCC(NC(=O)C4CCCCC4)CC3)o2)cc1 ZINC000481994281 897390052 /nfs/dbraw/zinc/39/00/52/897390052.db2.gz RUFYRFRZKBZCAH-UHFFFAOYSA-N 0 3 424.541 4.394 20 0 HIADHN COc1ccc(CCN[C@H](C)c2nnn(-c3ccccc3)c2C)cc1OC(F)F ZINC000482012514 897412164 /nfs/dbraw/zinc/41/21/64/897412164.db2.gz GBYFTVXMJHEBTC-CQSZACIVSA-N 0 3 402.445 4.079 20 0 HIADHN Cc1nnc(-c2ccc(C(=O)Nc3cc(C)cc(N4CCN(C(C)C)CC4)c3)cc2)o1 ZINC000482034048 897447182 /nfs/dbraw/zinc/44/71/82/897447182.db2.gz PNWXXKCCLKPYGN-UHFFFAOYSA-N 0 3 419.529 4.136 20 0 HIADHN Cc1cc(NC(=O)c2ccc3c(c2)C(C)(C)C(=O)N3)cc(N2CCN(C(C)C)CC2)c1 ZINC000482044643 897465517 /nfs/dbraw/zinc/46/55/17/897465517.db2.gz QNDPEWNSQPFTQZ-UHFFFAOYSA-N 0 3 420.557 4.007 20 0 HIADHN COc1ccc(OC)c([C@H](C)N[C@@H](C)CC(=O)Nc2cccc(N3CCCC3)c2)c1 ZINC000482087674 897530018 /nfs/dbraw/zinc/53/00/18/897530018.db2.gz GKIGVVBEQTWGAP-ROUUACIJSA-N 0 3 411.546 4.372 20 0 HIADHN COc1ccc([C@@H](C)N[C@H](C)CC(=O)Nc2cccc(N3CCCC3)c2)c(OC)c1 ZINC000482100169 897545218 /nfs/dbraw/zinc/54/52/18/897545218.db2.gz NSMDKBWFNJHSSZ-QZTJIDSGSA-N 0 3 411.546 4.372 20 0 HIADHN CCS(=O)(=O)Nc1ccc([C@H](C)NCc2ccc(OC)cc2C(F)(F)F)cc1 ZINC000482102783 897551479 /nfs/dbraw/zinc/55/14/79/897551479.db2.gz KLUSZPSLWKYHFL-ZDUSSCGKSA-N 0 3 416.465 4.326 20 0 HIADHN COc1ccccc1N1CC[C@H](CN[C@H](C)c2nnn(-c3ccc(C)cc3)c2C)C1 ZINC000482114555 897566088 /nfs/dbraw/zinc/56/60/88/897566088.db2.gz NZSVNISKZHUGLJ-UYAOXDASSA-N 0 3 405.546 4.070 20 0 HIADHN Cc1nc2n(n1)C[C@H](N[C@H](C)c1cnn(-c3ccc(Cl)cc3Cl)c1C)CC2 ZINC000482244652 897725876 /nfs/dbraw/zinc/72/58/76/897725876.db2.gz QDEWLQXWFFOPQU-IAQYHMDHSA-N 0 3 405.333 4.053 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)N[C@@H](c3cccc(C(F)(F)F)c3)C(F)(F)F)[C@H]2C1 ZINC000482335210 897840393 /nfs/dbraw/zinc/84/03/93/897840393.db2.gz PMRKZUWNGXFCRE-UGFHNGPFSA-N 0 3 409.374 4.044 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N(CCC(F)(F)F)Cc3ccccc3)cc2)CC1 ZINC000482363414 897882601 /nfs/dbraw/zinc/88/26/01/897882601.db2.gz UKYNTZTVUHMXIK-UHFFFAOYSA-N 0 3 419.491 4.423 20 0 HIADHN O=C(N[C@H](c1c(F)cccc1F)C(F)(F)F)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000482421846 897973500 /nfs/dbraw/zinc/97/35/00/897973500.db2.gz CLIGHADNDRIKIJ-RDTXWAMCSA-N 0 3 413.390 4.142 20 0 HIADHN Cc1cc(C)n(-c2ccc(C(=O)N[C@@H]3CCN([C@H](C)c4ccccc4)C3)cc2F)n1 ZINC000482476485 898055126 /nfs/dbraw/zinc/05/51/26/898055126.db2.gz INFMTTNPCDTMFB-WIYYLYMNSA-N 0 3 406.505 4.194 20 0 HIADHN COC(=O)c1ccccc1-c1ccc(CN2CCC(c3nnc4n3CCCC4)CC2)o1 ZINC000482489851 898068293 /nfs/dbraw/zinc/06/82/93/898068293.db2.gz WBXVHVBCWZGKQX-UHFFFAOYSA-N 0 3 420.513 4.041 20 0 HIADHN COc1cccc(-c2nn(C(C)(C)C)cc2CN2CCC([C@H](C)NC(C)=O)CC2)c1 ZINC000482526289 898113576 /nfs/dbraw/zinc/11/35/76/898113576.db2.gz JPJMHINZMAHDIL-KRWDZBQOSA-N 0 3 412.578 4.050 20 0 HIADHN COCCNc1ccc(CN[C@H](C)c2ccc(S(=O)(=O)C3CCCC3)cc2)cc1 ZINC000482547131 898136363 /nfs/dbraw/zinc/13/63/63/898136363.db2.gz AHQCPWVMKBDUDK-GOSISDBHSA-N 0 3 416.587 4.312 20 0 HIADHN C[C@@H](N[C@H](C)c1cc(F)ccc1N1CCN(C)CC1)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000482564073 898156016 /nfs/dbraw/zinc/15/60/16/898156016.db2.gz HEGKYDCGCZZZIR-IAGOWNOFSA-N 0 3 424.564 4.219 20 0 HIADHN CC[C@H](C)C(=O)Nc1cccc(CNC(=O)N[C@H]2CCN(Cc3ccccc3)[C@H]2C)c1 ZINC000482583834 898180983 /nfs/dbraw/zinc/18/09/83/898180983.db2.gz UYKKGDOYXMMBIT-YDHSSHFGSA-N 0 3 422.573 4.133 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)c1nn(-c2ccc(F)c(F)c2)c2c1CCC2 ZINC000482583381 898181002 /nfs/dbraw/zinc/18/10/02/898181002.db2.gz HKXKRAYFVOXUFV-UHFFFAOYSA-N 0 3 410.468 4.262 20 0 HIADHN CCCc1nc(C(=O)Nc2cc(CN(C)C)ccc2C)nn1-c1ccccc1Cl ZINC000482610695 898212076 /nfs/dbraw/zinc/21/20/76/898212076.db2.gz NUEWLNHCKVCBDS-UHFFFAOYSA-N 0 3 411.937 4.496 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2ccc3c(c2)CCC(=O)N3CC2CC2)N(C)C)cc1 ZINC000482610806 898212514 /nfs/dbraw/zinc/21/25/14/898212514.db2.gz DGNIIIROMKMYSX-QHCPKHFHSA-N 0 3 420.557 4.109 20 0 HIADHN Cc1cc(C)cc(C(=O)N2CCC[C@@H](C(=O)Nc3cc(CN(C)C)ccc3C)C2)c1 ZINC000482638270 898241661 /nfs/dbraw/zinc/24/16/61/898241661.db2.gz ZRIBYUDOFJKYRD-OAQYLSRUSA-N 0 3 407.558 4.164 20 0 HIADHN CC(C)CN(C(=O)N[C@H]1CCN(Cc2ccccc2)C1)[C@H]1CCCc2cccnc21 ZINC000482641940 898244932 /nfs/dbraw/zinc/24/49/32/898244932.db2.gz MKXBRLJBCHUWLI-GOTSBHOMSA-N 0 3 406.574 4.401 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCCC1)c1ccc(OCC(F)(F)F)cc1 ZINC000482715058 898314706 /nfs/dbraw/zinc/31/47/06/898314706.db2.gz YCRWTLJRRCBXNW-UHFFFAOYSA-N 0 3 416.509 4.109 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)NCCCOc1ccc(C(F)(F)F)cn1 ZINC000482787377 898395248 /nfs/dbraw/zinc/39/52/48/898395248.db2.gz HJHWCOVHHQBBJF-UHFFFAOYSA-N 0 3 421.419 4.107 20 0 HIADHN CC(C)c1nn(-c2ccc(Br)cc2)cc1CNCC[C@H](C)[S@@](C)=O ZINC000482787012 898396204 /nfs/dbraw/zinc/39/62/04/898396204.db2.gz IXFWJTNMWAMEKZ-LFPIHBKWSA-N 0 3 412.397 4.005 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Cc1c[nH]c2cc(Br)ccc12 ZINC000482832930 898441704 /nfs/dbraw/zinc/44/17/04/898441704.db2.gz CJZFQYQMLPUMHP-UHFFFAOYSA-N 0 3 420.376 4.125 20 0 HIADHN CCc1nc(CN2CCC(CN[C@H](C)c3nnn(-c4ccccc4)c3C)CC2)cs1 ZINC000482891484 898509387 /nfs/dbraw/zinc/50/93/87/898509387.db2.gz XAPFLNRKYHYUQT-QGZVFWFLSA-N 0 3 424.618 4.157 20 0 HIADHN CN(C)C(=O)[C@H](Cc1ccccc1)N[C@H]1CCCc2nc(-c3ccccc3)sc21 ZINC000482895234 898514869 /nfs/dbraw/zinc/51/48/69/898514869.db2.gz SLCKSZMSTAZRPW-FPOVZHCZSA-N 0 3 405.567 4.477 20 0 HIADHN Cc1cccc(CC2(O)CCN(C[C@@H](O)COc3c(Cl)cccc3Cl)CC2)c1 ZINC000482933415 898555149 /nfs/dbraw/zinc/55/51/49/898555149.db2.gz CWBPKBPCUBZAGG-GOSISDBHSA-N 0 3 424.368 4.111 20 0 HIADHN COC(=O)c1ccc(OCCN[C@@H](C)c2ccc(Br)cn2)c(Cl)c1 ZINC000482961363 898591152 /nfs/dbraw/zinc/59/11/52/898591152.db2.gz MWBNDXSKCIDFBX-NSHDSACASA-N 0 3 413.699 4.014 20 0 HIADHN Cc1ccc(S(=O)(=O)N[C@@H](CCN(C)Cc2cnccc2C)c2ccccc2)cc1 ZINC000483009188 898660999 /nfs/dbraw/zinc/66/09/99/898660999.db2.gz IUTRYTQMXCAUTO-DEOSSOPVSA-N 0 3 423.582 4.240 20 0 HIADHN COc1cc(NC(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)c(C)c(OC)c1 ZINC000483092761 898781094 /nfs/dbraw/zinc/78/10/94/898781094.db2.gz KUDOSYPWQORADE-OAQYLSRUSA-N 0 3 415.534 4.224 20 0 HIADHN CCN(CC1CCC1)[C@@H](C)C(=O)Nc1ccc(C(=O)Nc2ccccc2OC)cc1 ZINC000483129467 898813247 /nfs/dbraw/zinc/81/32/47/898813247.db2.gz LBLPJRKLRHJQGW-KRWDZBQOSA-N 0 3 409.530 4.397 20 0 HIADHN CC[C@H]1CN(CCC(=O)Nc2ccc(Oc3ccccc3)cc2)C[C@]2(CCOC2)O1 ZINC000483147711 898824658 /nfs/dbraw/zinc/82/46/58/898824658.db2.gz BKBJAPOXBBLVGR-RDPSFJRHSA-N 0 3 410.514 4.077 20 0 HIADHN Cc1cc(NC(=O)C2CCN(Cc3ccc(-c4cccc(F)c4F)o3)CC2)no1 ZINC000483153170 898828051 /nfs/dbraw/zinc/82/80/51/898828051.db2.gz ZJBXDJRAUYQTNP-UHFFFAOYSA-N 0 3 401.413 4.372 20 0 HIADHN C[C@@H](NC[C@@H](c1c(F)cccc1F)N(C)C)c1ccc(-n2cncn2)cc1Cl ZINC000483156697 898829467 /nfs/dbraw/zinc/82/94/67/898829467.db2.gz NSXOGINNWSAAQR-YJYMSZOUSA-N 0 3 405.880 4.152 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)[C@@H]2C[C@H]2c2ccc(OC(F)(F)F)cc2)CC1 ZINC000483170712 898838489 /nfs/dbraw/zinc/83/84/89/898838489.db2.gz SZNHEVQWJWBFQG-VQTJNVASSA-N 0 3 422.447 4.405 20 0 HIADHN CC1(C)CN(CCC(=O)Nc2ccc(Oc3ccccc3)cc2)C[C@]2(CCOC2)O1 ZINC000483182699 898845972 /nfs/dbraw/zinc/84/59/72/898845972.db2.gz ITFCCQBEMABZRK-DEOSSOPVSA-N 0 3 410.514 4.077 20 0 HIADHN C[C@@H](NC(=O)NCc1ccccc1OCC(F)(F)F)[C@H](c1ccccc1)N(C)C ZINC000483276572 898914978 /nfs/dbraw/zinc/91/49/78/898914978.db2.gz NZEUHMFYMLNBDQ-DNVCBOLYSA-N 0 3 409.452 4.118 20 0 HIADHN CS[C@@H]1CN(C(=O)c2cc3cc(Br)cc(C)c3o2)C[C@@H]1N1CCCC1 ZINC000483379621 899014944 /nfs/dbraw/zinc/01/49/44/899014944.db2.gz GERCDNHSDVDGLB-DOTOQJQBSA-N 0 3 423.376 4.156 20 0 HIADHN C[C@H](NC(=O)c1cc2sc(N3CCCC3)nc2s1)[C@H](c1ccccc1)N(C)C ZINC000505601945 914305722 /nfs/dbraw/zinc/30/57/22/914305722.db2.gz IYBZHMZWCMNNOM-KBXCAEBGSA-N 0 3 414.600 4.379 20 0 HIADHN CS[C@H]1CN(C(=O)CCC(=O)c2cc(Cl)sc2Cl)C[C@@H]1N1CCCC1 ZINC000483394630 899028605 /nfs/dbraw/zinc/02/86/05/899028605.db2.gz NURUZNRCVQNAOF-JSGCOSHPSA-N 0 3 421.415 4.056 20 0 HIADHN Cc1noc(C)c1COc1cccc(C(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)c1 ZINC000505606192 914310263 /nfs/dbraw/zinc/31/02/63/914310263.db2.gz GQDOTVYWMMFOIK-UZUQRXQVSA-N 0 3 407.514 4.292 20 0 HIADHN CCc1ccc(-c2nn(-c3ccccc3)cc2CN2CC[C@H](N3CCCC3=O)C2)cc1 ZINC000483436097 899068042 /nfs/dbraw/zinc/06/80/42/899068042.db2.gz CQSCNTCWQJRZDW-DEOSSOPVSA-N 0 3 414.553 4.298 20 0 HIADHN O=C1CCCN1[C@@H]1CCN(Cc2ccc(-c3ccccc3Br)s2)C1 ZINC000483436879 899069437 /nfs/dbraw/zinc/06/94/37/899069437.db2.gz UJJMNLLQQCFHHK-CQSZACIVSA-N 0 3 405.361 4.374 20 0 HIADHN Cc1sc2ncnc(SCC(=O)N[C@H](C)[C@@H](c3ccccc3)N(C)C)c2c1C ZINC000505609154 914313842 /nfs/dbraw/zinc/31/38/42/914313842.db2.gz KHSVJLMICLWVGT-KUHUBIRLSA-N 0 3 414.600 4.208 20 0 HIADHN CCCc1nc(C)c(C(=O)Nc2c(C)cnn2[C@@H]2CCN(Cc3ccccc3)C2)o1 ZINC000483469161 899112675 /nfs/dbraw/zinc/11/26/75/899112675.db2.gz MDBIFQFYXVLWKZ-LJQANCHMSA-N 0 3 407.518 4.140 20 0 HIADHN Brc1ccc(-c2noc(CN3CCN(C4CCCCC4)CC3)n2)s1 ZINC000483491133 899144564 /nfs/dbraw/zinc/14/45/64/899144564.db2.gz OSIATCFCPDSFRD-UHFFFAOYSA-N 0 3 411.369 4.011 20 0 HIADHN C[C@@H](NC(=O)c1cnn(-c2ccccc2)c1C(F)(F)F)[C@@H](c1ccccc1)N(C)C ZINC000505615405 914318187 /nfs/dbraw/zinc/31/81/87/914318187.db2.gz XNZRRLVSLMULGY-BEFAXECRSA-N 0 3 416.447 4.312 20 0 HIADHN Cc1ccc(C(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)cc1NC(=O)NC(C)(C)C ZINC000505627138 914325284 /nfs/dbraw/zinc/32/52/84/914325284.db2.gz BDHAVRCICVVXLN-LAUBAEHRSA-N 0 3 410.562 4.336 20 0 HIADHN Cc1ccccc1[C@H](NC(=O)N(C)C1CCN(CCc2ccccn2)CC1)C(C)C ZINC000483561938 899218947 /nfs/dbraw/zinc/21/89/47/899218947.db2.gz MOCOYLBXKKOCIL-XMMPIXPASA-N 0 3 408.590 4.436 20 0 HIADHN C[C@@H](NC(=O)Nc1cc(-c2cc(F)cc(F)c2)nn1C)[C@@H](c1ccccc1)N(C)C ZINC000483576945 899230253 /nfs/dbraw/zinc/23/02/53/899230253.db2.gz RYOPHTKVMAUGQM-SZNDQCEHSA-N 0 3 413.472 4.178 20 0 HIADHN Cc1ccc(NC(=O)c2cc(-c3ccc(Br)cc3)[nH]n2)c(CN(C)C)c1 ZINC000505628196 914327586 /nfs/dbraw/zinc/32/75/86/914327586.db2.gz BIBZSLJAQJLUQC-UHFFFAOYSA-N 0 3 413.319 4.462 20 0 HIADHN C[C@@H](NC(=O)c1c[nH]nc1-c1cccc(OC(F)F)c1)[C@@H](c1ccccc1)N(C)C ZINC000505629438 914328467 /nfs/dbraw/zinc/32/84/67/914328467.db2.gz IIMCAFNIDDDLBC-VLIAUNLRSA-N 0 3 414.456 4.099 20 0 HIADHN Cc1ccc(OCc2cccc(C(=O)N[C@@H](C)[C@@H](c3ccccc3)N(C)C)c2)cn1 ZINC000505634793 914333987 /nfs/dbraw/zinc/33/39/87/914333987.db2.gz MNGHGLMLWVDQED-CYFREDJKSA-N 0 3 403.526 4.390 20 0 HIADHN Cc1ccc(OCc2cccc(C(=O)N[C@H](C)[C@H](c3ccccc3)N(C)C)c2)cn1 ZINC000505634796 914334376 /nfs/dbraw/zinc/33/43/76/914334376.db2.gz MNGHGLMLWVDQED-NTKDMRAZSA-N 0 3 403.526 4.390 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2ccc(CCSC)cc2)c1 ZINC000483680141 899339825 /nfs/dbraw/zinc/33/98/25/899339825.db2.gz FTFZTSRUHSKDNH-UHFFFAOYSA-N 0 3 401.576 4.196 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)N[C@H]1CCCc2c(O)cccc21 ZINC000483688552 899348156 /nfs/dbraw/zinc/34/81/56/899348156.db2.gz UHCBYRSKZQSLLO-NRFANRHFSA-N 0 3 411.571 4.183 20 0 HIADHN C[C@@H](NC(=O)c1cccc(C(=O)N(C)CC(C)(C)C)c1)[C@@H](c1ccccc1)N(C)C ZINC000505638731 914339005 /nfs/dbraw/zinc/33/90/05/914339005.db2.gz VCKROYKVLRUUCP-GCJKJVERSA-N 0 3 409.574 4.226 20 0 HIADHN C[C@H](NC(=O)c1cccc(C(=O)N(C)CC(C)(C)C)c1)[C@@H](c1ccccc1)N(C)C ZINC000505638725 914339323 /nfs/dbraw/zinc/33/93/23/914339323.db2.gz VCKROYKVLRUUCP-AVRDEDQJSA-N 0 3 409.574 4.226 20 0 HIADHN C[C@@H](N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1=O)c1ccc2c(c1)COC2 ZINC000483709570 899363864 /nfs/dbraw/zinc/36/38/64/899363864.db2.gz FSSHANZCTUJAIP-JLTOFOAXSA-N 0 3 402.441 4.164 20 0 HIADHN CC[C@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)c1ccc(Br)cc1 ZINC000483714135 899371391 /nfs/dbraw/zinc/37/13/91/899371391.db2.gz OOOISNMTNXQQFU-ICSRJNTNSA-N 0 3 414.347 4.328 20 0 HIADHN C[C@H](NC(=O)Nc1cc(-c2ccc(F)cc2F)nn1C)[C@H](c1ccccc1)N(C)C ZINC000483800146 899473591 /nfs/dbraw/zinc/47/35/91/899473591.db2.gz FYLUMIOIDVVBPX-LHSJRXKWSA-N 0 3 413.472 4.178 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)c1ccc2c(c1)CCCC2=O ZINC000483802915 899477481 /nfs/dbraw/zinc/47/74/81/899477481.db2.gz PBFZABGTTVDDKD-OAQYLSRUSA-N 0 3 414.509 4.101 20 0 HIADHN CCC1(CN[C@H](C)c2nnn(-c3cccc(Br)c3)c2C)CCOCC1 ZINC000483855784 899539556 /nfs/dbraw/zinc/53/95/56/899539556.db2.gz XUJKORGINBQEGQ-CQSZACIVSA-N 0 3 407.356 4.196 20 0 HIADHN COc1ccccc1Nc1nc2sc(C(=O)N(CCN(C)C)C3CC3)cc2s1 ZINC000505663087 914361139 /nfs/dbraw/zinc/36/11/39/914361139.db2.gz XQWMJQSGJWLVBY-UHFFFAOYSA-N 0 3 416.572 4.276 20 0 HIADHN Cc1cc(NC(=O)C(C)(C)C2CCOCC2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000483874461 899553131 /nfs/dbraw/zinc/55/31/31/899553131.db2.gz VKGDITRVPMJODF-NRFANRHFSA-N 0 3 410.562 4.030 20 0 HIADHN CN(C)C[C@@H](NC(=O)N[C@H](c1cc(F)ccc1F)C(F)F)c1ccc(F)cc1 ZINC000483881534 899557762 /nfs/dbraw/zinc/55/77/62/899557762.db2.gz FHOSHNUHPJCDQT-IAGOWNOFSA-N 0 3 401.379 4.012 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N[C@H](c1ccccc1Cl)C(C)C ZINC000483971594 899616316 /nfs/dbraw/zinc/61/63/16/899616316.db2.gz IUXAJNLFOXBHRD-FQEVSTJZSA-N 0 3 401.938 4.162 20 0 HIADHN CC[C@H](NCc1ccc(-c2ccncc2)cc1)c1ccccc1OCC(=O)N(C)C ZINC000484146613 899766540 /nfs/dbraw/zinc/76/65/40/899766540.db2.gz QKNGTMMZPOJAFN-QHCPKHFHSA-N 0 3 403.526 4.457 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N[C@H](c1ccc(Cl)cc1)C1CCC1 ZINC000484153778 899773978 /nfs/dbraw/zinc/77/39/78/899773978.db2.gz APFDHKWMKSOIHF-NRFANRHFSA-N 0 3 413.949 4.306 20 0 HIADHN CCN(Cc1ccc(Cl)c(Cl)c1)C(=O)C(=O)Nc1cc(CN(C)C)ccc1C ZINC000484203463 899811450 /nfs/dbraw/zinc/81/14/50/899811450.db2.gz BIIHRLXDGLPMFJ-UHFFFAOYSA-N 0 3 422.356 4.351 20 0 HIADHN Cc1ccc(Oc2ccccc2)c(NC(=O)N2CC[C@H](N3CCN(C)CC3)[C@H](C)C2)c1 ZINC000484225290 899821577 /nfs/dbraw/zinc/82/15/77/899821577.db2.gz XGLRKXNECGQXMD-OFNKIYASSA-N 0 3 422.573 4.277 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N[C@H](c1ccc(F)cc1)[C@H]1CCCO1)c1ccco1 ZINC000484293485 899857842 /nfs/dbraw/zinc/85/78/42/899857842.db2.gz HRVVWPALZVJMLF-FCXXMXSZSA-N 0 3 403.498 4.067 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N[C@H](c1ccc(F)cc1)[C@@H]1CCCO1)c1ccco1 ZINC000484293478 899857868 /nfs/dbraw/zinc/85/78/68/899857868.db2.gz HRVVWPALZVJMLF-DZLUEKEQSA-N 0 3 403.498 4.067 20 0 HIADHN CC[C@@H](N[C@H](C)c1sc(-c2ccc(Cl)cc2)nc1C)C(=O)N1CCOCC1 ZINC000484305006 899865287 /nfs/dbraw/zinc/86/52/87/899865287.db2.gz UJKDPRKCPHBURF-CXAGYDPISA-N 0 3 407.967 4.060 20 0 HIADHN Cc1ccc(C[C@H](NCc2csc(CNC(=O)c3ccccc3)n2)C2CC2)cc1 ZINC000484314572 899873792 /nfs/dbraw/zinc/87/37/92/899873792.db2.gz WRCZMWWJTFLCBW-QFIPXVFZSA-N 0 3 405.567 4.492 20 0 HIADHN Cc1ccc(C[C@@H](NCc2csc(CNC(=O)c3ccccc3)n2)C2CC2)cc1 ZINC000484314571 899873887 /nfs/dbraw/zinc/87/38/87/899873887.db2.gz WRCZMWWJTFLCBW-JOCHJYFZSA-N 0 3 405.567 4.492 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2ccnn2[C@@H](C)CC(C)C)c1 ZINC000484356008 899904892 /nfs/dbraw/zinc/90/48/92/899904892.db2.gz BASWWFUMRZGYBT-SFHVURJKSA-N 0 3 401.555 4.095 20 0 HIADHN CC[C@H](CN[C@@H](C)c1cccc(S(=O)(=O)N(C)C)c1)Oc1ccccc1Cl ZINC000484483703 899975607 /nfs/dbraw/zinc/97/56/07/899975607.db2.gz AQQDMPWLTUIWGU-DOTOQJQBSA-N 0 3 410.967 4.099 20 0 HIADHN COc1cc(OC)cc(N2CC[C@H](N[C@H](C)c3cc(Cl)c(OC)cc3OC)C2)c1 ZINC000484489968 899981502 /nfs/dbraw/zinc/98/15/02/899981502.db2.gz KALBRWQWZLCYEM-CABCVRRESA-N 0 3 420.937 4.304 20 0 HIADHN Cc1ccc(OC(F)F)c([C@H](C)N[C@@H]2CCN(C(=O)CCc3ccccc3)C2)c1 ZINC000484502106 899992266 /nfs/dbraw/zinc/99/22/66/899992266.db2.gz JXCHHPXZTZGFFA-PKOBYXMFSA-N 0 3 402.485 4.481 20 0 HIADHN C[C@H](N[C@H]1CCN(C(=O)CCc2ccccc2)C1)c1ccc(Br)s1 ZINC000484504531 899995106 /nfs/dbraw/zinc/99/51/06/899995106.db2.gz OFSNXHKDAMYOQA-HOCLYGCPSA-N 0 3 407.377 4.395 20 0 HIADHN C[C@@H](N[C@@H]1CCN(C(=O)CCc2ccccc2)C1)c1ccc(Br)s1 ZINC000484504528 899995179 /nfs/dbraw/zinc/99/51/79/899995179.db2.gz OFSNXHKDAMYOQA-GDBMZVCRSA-N 0 3 407.377 4.395 20 0 HIADHN Cc1c([C@H](C)N[C@@H](C)Cc2ccncc2)nnn1-c1cccc(Br)c1 ZINC000484505507 899996095 /nfs/dbraw/zinc/99/60/95/899996095.db2.gz SURSFCNWLTYCTH-KBPBESRZSA-N 0 3 400.324 4.015 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(OCC2CC2)c(F)c1)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000484508454 899999027 /nfs/dbraw/zinc/99/90/27/899999027.db2.gz PIOIQJWCLNLVCP-HZPDHXFCSA-N 0 3 420.550 4.277 20 0 HIADHN O=C(C1CCCCC1)N1CC[C@@H](N[C@H]2CCCOc3ccc(Br)cc32)C1 ZINC000484510240 900002161 /nfs/dbraw/zinc/00/21/61/900002161.db2.gz WMLRSDZBLZDGTP-MJGOQNOKSA-N 0 3 421.379 4.434 20 0 HIADHN O[C@H](CN[C@H](Cn1cnc2ccccc21)c1ccc(F)cc1)COCc1ccccc1 ZINC000484533011 900019426 /nfs/dbraw/zinc/01/94/26/900019426.db2.gz IPEJDHKWHCVTGI-ISKFKSNPSA-N 0 3 419.500 4.084 20 0 HIADHN COc1cc([C@@H](C)N[C@@H](C)c2cccc(N3CCCC3)c2)ccc1S(C)(=O)=O ZINC000484598529 900060368 /nfs/dbraw/zinc/06/03/68/900060368.db2.gz LKPYBCRNIVOBFG-DLBZAZTESA-N 0 3 402.560 4.111 20 0 HIADHN C[C@H](NCCCO[C@@H]1CCOC1)c1ccc(Br)cc1Br ZINC000484615430 900072368 /nfs/dbraw/zinc/07/23/68/900072368.db2.gz HUEZIQFPTHMHMU-WCQYABFASA-N 0 3 407.146 4.058 20 0 HIADHN CN(C(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1)c1cnc2ccccc2n1 ZINC000484873422 900261199 /nfs/dbraw/zinc/26/11/99/900261199.db2.gz AUSMJBPEZJVBDP-NRFANRHFSA-N 0 3 414.431 4.047 20 0 HIADHN CCSc1cccc(F)c1NC(=O)CCCN1CCN(c2ccccc2)CC1 ZINC000484927930 900299588 /nfs/dbraw/zinc/29/95/88/900299588.db2.gz PIPOUNOSNQUUPK-UHFFFAOYSA-N 0 3 401.551 4.479 20 0 HIADHN COc1cccc2[nH]cc(CC(=O)NC[C@H](c3cccs3)N3CCC(C)CC3)c21 ZINC000485036238 900375500 /nfs/dbraw/zinc/37/55/00/900375500.db2.gz UJOLGLMXWOWRSW-LJQANCHMSA-N 0 3 411.571 4.370 20 0 HIADHN CC(C)c1c(NC(=O)N2CC[C@@H]3CCN(C)C[C@H]32)cnn1-c1ccc(Cl)cc1 ZINC000485199456 900492532 /nfs/dbraw/zinc/49/25/32/900492532.db2.gz ZDROOJLFJFZMTN-HNAYVOBHSA-N 0 3 401.942 4.207 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2cc(F)c(Cl)cc2F)cc1)[C@H]1CCCN(C)C1 ZINC000485280284 900557871 /nfs/dbraw/zinc/55/78/71/900557871.db2.gz CELIPHXMAYPAMX-HNNXBMFYSA-N 0 3 421.875 4.037 20 0 HIADHN CCSc1cccc(C(=O)Nc2ccc(C(=O)N(C)[C@H]3CCCN(C)C3)cc2)c1 ZINC000485284551 900561966 /nfs/dbraw/zinc/56/19/66/900561966.db2.gz KVOFVVLNAVPDPL-FQEVSTJZSA-N 0 3 411.571 4.217 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCC[C@]12CCOC2)c1ccc(C(F)(F)F)cc1 ZINC000485333080 900618705 /nfs/dbraw/zinc/61/87/05/900618705.db2.gz TTYZTJQOHVCFGC-UYAOXDASSA-N 0 3 413.484 4.053 20 0 HIADHN CCc1c(NC(=O)N(CCN(C)C)Cc2ccco2)cnn1-c1cccc(Cl)c1 ZINC000485364575 900660188 /nfs/dbraw/zinc/66/01/88/900660188.db2.gz UIPSXTPNXIKZRP-UHFFFAOYSA-N 0 3 415.925 4.277 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)NCc1nc2cc(Cl)ccc2s1)c1ccco1 ZINC000485411453 900709287 /nfs/dbraw/zinc/70/92/87/900709287.db2.gz KPEMXLPSYOTXQW-IUODEOHRSA-N 0 3 406.939 4.471 20 0 HIADHN CCOc1cc(CN(Cc2ccccc2)C(C)(C)C)nc2nc(C(F)(F)F)nn21 ZINC000485415162 900713035 /nfs/dbraw/zinc/71/30/35/900713035.db2.gz YYSVKSLXTIXRQO-UHFFFAOYSA-N 0 3 407.440 4.343 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)Cc2ccc(F)cc2Br)C1 ZINC000485456321 900750274 /nfs/dbraw/zinc/75/02/74/900750274.db2.gz RPOMLHHFFOQIGN-KSSFIOAISA-N 0 3 405.311 4.082 20 0 HIADHN CC(C)c1ccc(OCCC(=O)Nc2ccc(C(=O)NCCN3CCCC3)cc2)cc1 ZINC000485472326 900765501 /nfs/dbraw/zinc/76/55/01/900765501.db2.gz DPFJOYBCVFRPJH-UHFFFAOYSA-N 0 3 423.557 4.043 20 0 HIADHN O=C(Cc1ccc(Cl)cc1Cl)Nc1ccc(C(=O)NCCN2CCCC2)cc1 ZINC000485502336 900790950 /nfs/dbraw/zinc/79/09/50/900790950.db2.gz ULHABXDWFGNMDM-UHFFFAOYSA-N 0 3 420.340 4.000 20 0 HIADHN CCOc1cc(Cl)ccc1C(=O)N1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000485548341 900823453 /nfs/dbraw/zinc/82/34/53/900823453.db2.gz HWURYHWBESGHNU-IRXDYDNUSA-N 0 3 408.970 4.090 20 0 HIADHN COc1cc(CCC2CCN(C(=O)c3ccccc3CN(C)C)CC2)cc(OC)c1 ZINC000485609841 900868864 /nfs/dbraw/zinc/86/88/64/900868864.db2.gz NQLWMNXGDCXZPD-UHFFFAOYSA-N 0 3 410.558 4.250 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N[C@H](C)c3ccc4ncsc4c3)cc2)CC1 ZINC000485669262 900919940 /nfs/dbraw/zinc/91/99/40/900919940.db2.gz DTLPOVGDWDFLNQ-QGZVFWFLSA-N 0 3 408.571 4.318 20 0 HIADHN Cc1cccc2c1[C@H](C)C[C@H]2CC(=O)Nc1ccc2oc(=O)n(CCN(C)C)c2c1 ZINC000485796981 901049108 /nfs/dbraw/zinc/04/91/08/901049108.db2.gz VSUMZNQLEPZPHO-SJORKVTESA-N 0 3 407.514 4.084 20 0 HIADHN CC(C)Oc1ccccc1CN(C)[C@H](C)c1ccc(N2CCCS2(=O)=O)cc1 ZINC000485824060 901071976 /nfs/dbraw/zinc/07/19/76/901071976.db2.gz YSUQHQFRHTUFGS-GOSISDBHSA-N 0 3 402.560 4.207 20 0 HIADHN COc1ccc(OC)c([C@H](C)NC(=O)[C@H](C)N[C@H](C)c2ccc3ncsc3c2)c1 ZINC000485830109 901076254 /nfs/dbraw/zinc/07/62/54/901076254.db2.gz FEVCJTRTSHSFEL-ILXRZTDVSA-N 0 3 413.543 4.230 20 0 HIADHN Cc1[nH]c2ccc(Cl)cc2c1C(=O)N1CCC(CN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000485846611 901090664 /nfs/dbraw/zinc/09/06/64/901090664.db2.gz PNBSYLFJSZSXQK-GJZGRUSLSA-N 0 3 403.954 4.091 20 0 HIADHN CCc1ccc(Cl)c(CC)c1NC(=O)CCCN(C)[C@@H](C)C(=O)NC(C)(C)C ZINC000485856459 901098944 /nfs/dbraw/zinc/09/89/44/901098944.db2.gz GMYHVDAMWYUECV-HNNXBMFYSA-N 0 3 410.002 4.419 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3cccc(Br)c3)CC2)C[C@H](C)O1 ZINC000485976794 901194715 /nfs/dbraw/zinc/19/47/15/901194715.db2.gz HZZXKMNGCFNVNM-IYBDPMFKSA-N 0 3 424.383 4.192 20 0 HIADHN COc1ccc([C@H](NCCc2ccc(C)cc2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000486028574 901234509 /nfs/dbraw/zinc/23/45/09/901234509.db2.gz LCPYFZUKUJQQBM-DEOSSOPVSA-N 0 3 409.551 4.329 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)c1cc2c(s1)CCOC2 ZINC000486163528 901352291 /nfs/dbraw/zinc/35/22/91/901352291.db2.gz HJCDMEBSCHOYEO-UHFFFAOYSA-N 0 3 412.477 4.044 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)C[C@H](c3ccccc3)C(F)(F)F)CC2)C[C@H](C)O1 ZINC000486293201 901474818 /nfs/dbraw/zinc/47/48/18/901474818.db2.gz QIKIXVXPCVWZGG-FUHIMQAGSA-N 0 3 412.496 4.070 20 0 HIADHN FC(F)Oc1ccccc1CN1C[C@H]2CCC[C@@]2(c2nc(-c3cccnc3)no2)C1 ZINC000486435751 901594649 /nfs/dbraw/zinc/59/46/49/901594649.db2.gz QTMCUAILDPLEMS-VGOFRKELSA-N 0 3 412.440 4.287 20 0 HIADHN COc1ccc(CN2C[C@H]3CCC[C@@]3(c3nc(CC4CC4)no3)C2)cc1OC(F)F ZINC000486463642 901624007 /nfs/dbraw/zinc/62/40/07/901624007.db2.gz RZJKQJYVRFQLCX-OPAMFIHVSA-N 0 3 419.472 4.186 20 0 HIADHN O=C([C@@H]1CCCCCC(=O)C1)N(C[C@H]1CCN(Cc2ccccc2)C1)CC(F)(F)F ZINC000486549230 901696513 /nfs/dbraw/zinc/69/65/13/901696513.db2.gz SIBZHNAOILIGKM-VQTJNVASSA-N 0 3 424.507 4.439 20 0 HIADHN CC(=O)c1ccc(CC(=O)N[C@@H](c2ccc(F)c(F)c2)C(C)(C)N2CCCC2)cc1 ZINC000486556900 901703146 /nfs/dbraw/zinc/70/31/46/901703146.db2.gz HIQHAMUHGLZDSR-QHCPKHFHSA-N 0 3 414.496 4.442 20 0 HIADHN O=C(CCSc1cccc(Cl)c1)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000486568086 901713856 /nfs/dbraw/zinc/71/38/56/901713856.db2.gz RSWHBKVBLIMLNI-UHFFFAOYSA-N 0 3 404.963 4.418 20 0 HIADHN CC(C)c1nnc(CCC(=O)N[C@@H](c2ccc(F)c(F)c2)C(C)(C)N2CCCC2)o1 ZINC000486586232 901726413 /nfs/dbraw/zinc/72/64/13/901726413.db2.gz NTDVMKMQIMADNO-FQEVSTJZSA-N 0 3 420.504 4.136 20 0 HIADHN C[C@H](c1nc2ccccc2o1)N1C[C@H]2CCC[C@@]2(c2nc(-c3cccnc3)no2)C1 ZINC000486829591 901881447 /nfs/dbraw/zinc/88/14/47/901881447.db2.gz WHCLUNBPPUZLNJ-QDOIMOTRSA-N 0 3 401.470 4.388 20 0 HIADHN CC(C)N(C(=O)CN1C[C@H]2CCC[C@@]2(c2nc(-c3ccccc3)no2)C1)C1CCCC1 ZINC000486833784 901884323 /nfs/dbraw/zinc/88/43/23/901884323.db2.gz QLLWDRFFGPJXLV-CJFMBICVSA-N 0 3 422.573 4.270 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)c3ccc(F)cc3C(F)(F)F)cc2)CC1 ZINC000486836698 901886521 /nfs/dbraw/zinc/88/65/21/901886521.db2.gz ZLIWOFOLIPMHBR-UHFFFAOYSA-N 0 3 409.427 4.234 20 0 HIADHN C[C@@H](c1cccc(Cl)c1F)N1C[C@H]2CCC[C@@]2(c2nc(-c3cnccn3)no2)C1 ZINC000486845712 901892761 /nfs/dbraw/zinc/89/27/61/901892761.db2.gz NFJDNMUENAFGAB-PXIJXODZSA-N 0 3 413.884 4.434 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N2C[C@H](c3ccccc3)[C@H]3CCCC[C@H]32)CC1 ZINC000486878532 901924156 /nfs/dbraw/zinc/92/41/56/901924156.db2.gz ITAMWDRBKYPUDD-WXFUMESZSA-N 0 3 413.606 4.244 20 0 HIADHN CCCC(=O)Nc1ccc(Cl)c(NC(=O)NC2CCN(CCOC(C)C)CC2)c1 ZINC000486905687 901951916 /nfs/dbraw/zinc/95/19/16/901951916.db2.gz ZYDHEVSLPWANDY-UHFFFAOYSA-N 0 3 424.973 4.090 20 0 HIADHN CCN1CCN(Cc2ccc(CNc3cc(-c4nc(C(C)C)no4)ccn3)cc2)CC1 ZINC000486968040 901994348 /nfs/dbraw/zinc/99/43/48/901994348.db2.gz NNEWIIABQRGIKE-UHFFFAOYSA-N 0 3 420.561 4.005 20 0 HIADHN Cc1[nH]nc(-c2ccccc2)c1NC(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000487056067 902040301 /nfs/dbraw/zinc/04/03/01/902040301.db2.gz HHWPKUWFYVUTOS-LJQANCHMSA-N 0 3 410.468 4.481 20 0 HIADHN O=C(N[C@@H](c1ccccc1)c1ccc(F)cc1)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000505936242 914587670 /nfs/dbraw/zinc/58/76/70/914587670.db2.gz CDAFPRMGMKTWDC-ZEQRLZLVSA-N 0 3 403.501 4.489 20 0 HIADHN CC(=O)Nc1ccc(Cl)c(C(=O)N2CCCN(CCCc3ccccc3)CC2)c1 ZINC000487314138 902148407 /nfs/dbraw/zinc/14/84/07/902148407.db2.gz CJGUSSKDHNECOG-UHFFFAOYSA-N 0 3 413.949 4.079 20 0 HIADHN COc1cc(-c2noc(CN[C@@H]3CCCC[C@@H]3C(C)(C)C)n2)cc(OC)c1OC ZINC000487391107 902175535 /nfs/dbraw/zinc/17/55/35/902175535.db2.gz KYTIVQRATKVHOM-JKSUJKDBSA-N 0 3 403.523 4.457 20 0 HIADHN C[C@@H](c1cccc(N2CCCS2(=O)=O)c1)N(C)Cc1ccc(Br)cc1 ZINC000487866781 902414371 /nfs/dbraw/zinc/41/43/71/902414371.db2.gz CANUEUYJHQPKCN-HNNXBMFYSA-N 0 3 423.376 4.182 20 0 HIADHN Cc1cc(CN2CC[C@H]3[C@H](CCC(=O)N3C3CC3)C2)nc(-c2ccc(Cl)cc2)n1 ZINC000487975851 902500203 /nfs/dbraw/zinc/50/02/03/902500203.db2.gz FNXNXRCZXBUNDK-UTKZUKDTSA-N 0 3 410.949 4.081 20 0 HIADHN Cc1cccc(NC(=O)[C@@H]2CSCN2C(=O)c2cccc(CN3CCCC3)c2)c1C ZINC000488122918 902621054 /nfs/dbraw/zinc/62/10/54/902621054.db2.gz OTPPHWLQRXEGLY-QFIPXVFZSA-N 0 3 423.582 4.053 20 0 HIADHN Brc1ccccc1-c1noc(C2CCN(CCc3ccccn3)CC2)n1 ZINC000488221584 902701791 /nfs/dbraw/zinc/70/17/91/902701791.db2.gz PMOFMBZAGWKFRD-UHFFFAOYSA-N 0 3 413.319 4.316 20 0 HIADHN C[C@H](NCc1cccc(NC(=O)CCN2CCOCC2)c1)c1ccc(C(C)(C)C)cc1 ZINC000488241282 902716582 /nfs/dbraw/zinc/71/65/82/902716582.db2.gz JZMBFTUKXSPSFQ-FQEVSTJZSA-N 0 3 423.601 4.496 20 0 HIADHN C[C@@H]1CN(C2CCOCC2)CCN1C(=O)Nc1ccc(C(F)(F)F)cc1Cl ZINC000488247012 902721695 /nfs/dbraw/zinc/72/16/95/902721695.db2.gz AEZRTBGYYLKJGN-GFCCVEGCSA-N 0 3 405.848 4.076 20 0 HIADHN Cc1cccc(COc2cccc(NC(=O)N3CCN(C4CCOCC4)C[C@@H]3C)c2)c1 ZINC000488312744 902760335 /nfs/dbraw/zinc/76/03/35/902760335.db2.gz KTEUXOIFSRZWKO-FQEVSTJZSA-N 0 3 423.557 4.291 20 0 HIADHN C[C@H]1CN(C2CCOCC2)CCN1C(=O)Nc1ccc(COCc2ccccc2)cc1 ZINC000488468269 902840794 /nfs/dbraw/zinc/84/07/94/902840794.db2.gz RZIZKSPGTWBTJH-FQEVSTJZSA-N 0 3 423.557 4.120 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)CCC(=O)c1ccc2c(c1)CCC2 ZINC000488480540 902847612 /nfs/dbraw/zinc/84/76/12/902847612.db2.gz CVSHWMXFTKDQFM-YADARESESA-N 0 3 404.554 4.165 20 0 HIADHN CC(C)c1cnc(-c2ccc(NC(=O)N3CCN(C4CCOCC4)C[C@@H]3C)cc2)o1 ZINC000488508058 902862043 /nfs/dbraw/zinc/86/20/43/902862043.db2.gz RVVBJTDGKHERPG-KRWDZBQOSA-N 0 3 412.534 4.182 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)c1cccc(Oc2ccncc2)c1 ZINC000488663802 902926039 /nfs/dbraw/zinc/92/60/39/902926039.db2.gz YDMBRJYJKFNAMX-UHFFFAOYSA-N 0 3 403.482 4.083 20 0 HIADHN C[C@@H]1C[C@H]1C(=O)Nc1cccc(C(=O)N(Cc2ccccc2)C2CCN(C)CC2)c1 ZINC000488672766 902933266 /nfs/dbraw/zinc/93/32/66/902933266.db2.gz FIDKOAITIYSABL-WZONZLPQSA-N 0 3 405.542 4.018 20 0 HIADHN CSCc1nc2ccccc2n1CC(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000488682535 902942343 /nfs/dbraw/zinc/94/23/43/902942343.db2.gz XIBAZDJIRAIGOB-UHFFFAOYSA-N 0 3 422.598 4.022 20 0 HIADHN Cc1ccccc1[C@H](C(C)C)N(C)CC(=O)Nc1ccc(CN2CCOCC2)cc1 ZINC000488732448 902970363 /nfs/dbraw/zinc/97/03/63/902970363.db2.gz WLNUIIXPLAXBPH-VWLOTQADSA-N 0 3 409.574 4.095 20 0 HIADHN Cc1cc(C)c(-c2nnc(SCC(=O)NC[C@H](c3ccccc3)N(C)C)o2)c(C)c1 ZINC000488802759 903009026 /nfs/dbraw/zinc/00/90/26/903009026.db2.gz HNNICJSVCRZSBC-LJQANCHMSA-N 0 3 424.570 4.173 20 0 HIADHN CN(C)C[C@H](NC(=O)c1[nH]c2ccccc2c1Br)c1ccc(F)cc1 ZINC000488896497 903066023 /nfs/dbraw/zinc/06/60/23/903066023.db2.gz JSOABSGUZOZYSB-INIZCTEOSA-N 0 3 404.283 4.102 20 0 HIADHN COCCOc1cc(C)ccc1NC(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000489007178 903116967 /nfs/dbraw/zinc/11/69/67/903116967.db2.gz HQLIHKWFRPOLAH-UHFFFAOYSA-N 0 3 411.546 4.149 20 0 HIADHN CC(=O)Nc1cccc(NC(=O)[C@H](C)N[C@H](COc2ccccc2F)C(C)(C)C)c1 ZINC000489026542 903130667 /nfs/dbraw/zinc/13/06/67/903130667.db2.gz IWAVOAQGAQRXMO-YCRPNKLZSA-N 0 3 415.509 4.194 20 0 HIADHN CCOC1(C)CCN(C(=O)N[C@H](CN2CCc3ccccc3C2)C(C)(C)C)CC1 ZINC000489046495 903152490 /nfs/dbraw/zinc/15/24/90/903152490.db2.gz RVNYPUMAGDZHNO-OAQYLSRUSA-N 0 3 401.595 4.060 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)NCCCCCc3ccc(F)cc3)CC2)C[C@H](C)O1 ZINC000489080348 903180648 /nfs/dbraw/zinc/18/06/48/903180648.db2.gz RHBLORFHDVEJAW-BGYRXZFFSA-N 0 3 419.585 4.069 20 0 HIADHN Cc1ccc(NC(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)cc1C(=O)N(C)C(C)C ZINC000489124836 903215286 /nfs/dbraw/zinc/21/52/86/903215286.db2.gz QHZOCTDACRAZQR-CVDCTZTESA-N 0 3 422.573 4.117 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N2CCC(F)(c3cccnc3)CC2)N2CCCC2)cc1 ZINC000489197111 903257403 /nfs/dbraw/zinc/25/74/03/903257403.db2.gz MDLWUKPJCWZNJB-JOCHJYFZSA-N 0 3 410.537 4.197 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)NCc2cccc(OC(F)F)c2)N(C)C)cc1 ZINC000489199228 903259654 /nfs/dbraw/zinc/25/96/54/903259654.db2.gz SCPFYJIXOHTIFO-FQEVSTJZSA-N 0 3 421.488 4.177 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)N[C@H]2CCCOc3ccc(F)cc32)CC1 ZINC000489317709 903328494 /nfs/dbraw/zinc/32/84/94/903328494.db2.gz NSTQNGPGAYXQRY-QFIPXVFZSA-N 0 3 411.521 4.345 20 0 HIADHN C[C@H](CC(C)(C)c1ccccc1)NC(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000489380570 903355159 /nfs/dbraw/zinc/35/51/59/903355159.db2.gz PVIIRSZDAFAMQV-HXUWFJFHSA-N 0 3 423.601 4.199 20 0 HIADHN Cc1cc(-c2noc([C@@H](C)N3CCC(CCCN4CCOCC4)CC3)n2)ccc1F ZINC000506027517 914710496 /nfs/dbraw/zinc/71/04/96/914710496.db2.gz MAQNWFHQPOIEOX-GOSISDBHSA-N 0 3 416.541 4.070 20 0 HIADHN C[C@@H]1C[C@@H]1C(=O)Nc1ccc(C(=O)Nc2ccc(CCN3CCSCC3)cc2)cc1 ZINC000489418527 903376133 /nfs/dbraw/zinc/37/61/33/903376133.db2.gz MMRWBXGKARXEEG-VGSWGCGISA-N 0 3 423.582 4.125 20 0 HIADHN CNC(=O)[C@H](Cc1c[nH]c2ccccc12)N[C@@H](C)c1ccc(Br)c(F)c1 ZINC000489505743 903428659 /nfs/dbraw/zinc/42/86/59/903428659.db2.gz FFXKEPZBSYVIMI-BUXKBTBVSA-N 0 3 418.310 4.077 20 0 HIADHN COc1cccc(NC(=O)[C@H](N[C@@H]2CCO[C@@]3(CCSC3)C2)c2ccccc2)c1 ZINC000489524745 903437578 /nfs/dbraw/zinc/43/75/78/903437578.db2.gz BAHANHKQAPAEOC-LSWJPFSZSA-N 0 3 412.555 4.019 20 0 HIADHN CC(C)(CNC(=O)N[C@H](c1ccccc1)c1ccncc1)N1CCc2ccccc2C1 ZINC000489536965 903446251 /nfs/dbraw/zinc/44/62/51/903446251.db2.gz KIYANWZYLRSCHL-XMMPIXPASA-N 0 3 414.553 4.307 20 0 HIADHN C[C@H](c1ccc(S(N)(=O)=O)cc1)N(C)Cc1ccc(-c2ccc(F)cc2)s1 ZINC000506035766 914719638 /nfs/dbraw/zinc/71/96/38/914719638.db2.gz SNGBLEMRCWYRBH-CQSZACIVSA-N 0 3 404.532 4.395 20 0 HIADHN c1cc(CN2CCOCC2)ccc1CN[C@@H]1CCCOc2cc3c(cc21)CCCC3 ZINC000489548853 903458283 /nfs/dbraw/zinc/45/82/83/903458283.db2.gz GUXZOCRZIQTZHN-RUZDIDTESA-N 0 3 406.570 4.401 20 0 HIADHN C[C@@H](N[C@@H]1CCN(C(=O)CCc2ccccc2)C1)c1ccc(Br)c(F)c1 ZINC000489552938 903459624 /nfs/dbraw/zinc/45/96/24/903459624.db2.gz NQXPLUQKHDCSJE-CRAIPNDOSA-N 0 3 419.338 4.473 20 0 HIADHN CN(C)C(=O)COc1cccc(CN[C@H]2CCCOc3cc4c(cc32)CCCC4)c1 ZINC000489574867 903473183 /nfs/dbraw/zinc/47/31/83/903473183.db2.gz SPJCOPPUQWZQPJ-QHCPKHFHSA-N 0 3 408.542 4.036 20 0 HIADHN COCc1ccsc1C(=O)Nc1c(C)cnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000489626508 903504296 /nfs/dbraw/zinc/50/42/96/903504296.db2.gz RXSUXWCNZYCKPE-IBGZPJMESA-N 0 3 410.543 4.099 20 0 HIADHN Cc1ccc([C@H](CNC(=O)CCCc2nc(-c3cccs3)no2)N2CCCC2)cc1 ZINC000489720438 903557565 /nfs/dbraw/zinc/55/75/65/903557565.db2.gz XILDWPRESUVPEN-IBGZPJMESA-N 0 3 424.570 4.383 20 0 HIADHN Cc1cccc(CN(CC(C)C)C(=O)NCc2ccccc2CN2CCC(O)CC2)c1 ZINC000489721427 903559227 /nfs/dbraw/zinc/55/92/27/903559227.db2.gz XAPMIDVINNBDCQ-UHFFFAOYSA-N 0 3 423.601 4.320 20 0 HIADHN CC(C)n1ncc(C(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)c1-c1ccccc1 ZINC000489743155 903571295 /nfs/dbraw/zinc/57/12/95/903571295.db2.gz SKIBQBZHLHMHIS-QFIPXVFZSA-N 0 3 402.542 4.478 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)N(Cc1ccccc1)CC1CCC1 ZINC000489788985 903600115 /nfs/dbraw/zinc/60/01/15/903600115.db2.gz JCGDAHVGSPCDOB-UHFFFAOYSA-N 0 3 421.585 4.155 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)Nc1cc(Cl)ccc1Cl ZINC000489809424 903607392 /nfs/dbraw/zinc/60/73/92/903607392.db2.gz PCPDQEWYORRZKW-UHFFFAOYSA-N 0 3 408.329 4.272 20 0 HIADHN COc1ccc(-c2noc([C@H](C)N3CC[C@H](C)N(Cc4ccccc4)CC3)n2)cc1 ZINC000489884861 903651649 /nfs/dbraw/zinc/65/16/49/903651649.db2.gz KJQKRVMVKLKSCB-OALUTQOASA-N 0 3 406.530 4.403 20 0 HIADHN CSCC[C@H](N[C@@H](C)c1ccc(OCc2ccc(F)cc2)cc1)C(=O)N(C)C ZINC000489907261 903664649 /nfs/dbraw/zinc/66/46/49/903664649.db2.gz JXMRNBBDPJQPSX-KKSFZXQISA-N 0 3 404.551 4.265 20 0 HIADHN CN(c1ccccc1)C1CCN(C(=O)N[C@H](CN2CCCC2)c2ccccc2)CC1 ZINC000489915710 903671920 /nfs/dbraw/zinc/67/19/20/903671920.db2.gz GKAQWDKGZNIUHJ-XMMPIXPASA-N 0 3 406.574 4.134 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)NC[C@H]2SCCc3ccccc32)CC1 ZINC000489929458 903683672 /nfs/dbraw/zinc/68/36/72/903683672.db2.gz VYQYNXMJRHBHCA-HSZRJFAPSA-N 0 3 409.599 4.323 20 0 HIADHN CSCC[C@H](N[C@@H](C)c1ccc(OCc2cccc(C)c2)cc1)C(=O)N(C)C ZINC000489960711 903698178 /nfs/dbraw/zinc/69/81/78/903698178.db2.gz XUSBTBWXDZVEJW-AVRDEDQJSA-N 0 3 400.588 4.435 20 0 HIADHN CCCN(CCCCN1C(=O)c2ccccc2C1=O)[C@@H](C)C(=O)Nc1ccccc1C ZINC000490088380 903765442 /nfs/dbraw/zinc/76/54/42/903765442.db2.gz ICLDIWCUVLMBMS-IBGZPJMESA-N 0 3 421.541 4.110 20 0 HIADHN CCc1ccc([C@@H](NC[C@@H](CC(C)C)N(C)C)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000490138816 903785536 /nfs/dbraw/zinc/78/55/36/903785536.db2.gz XNCNFAUJXZEXIX-ISKFKSNPSA-N 0 3 416.631 4.308 20 0 HIADHN CN1CCN(c2cc(CN[C@H](c3ccccc3)c3ccc(Cl)cc3)ccn2)CC1 ZINC000490139359 903787545 /nfs/dbraw/zinc/78/75/45/903787545.db2.gz ZXZPJWQATPDNRF-XMMPIXPASA-N 0 3 406.961 4.366 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](NCC2(O)CCCCC2)c2ccc(Cl)cc2)c1 ZINC000490151533 903794796 /nfs/dbraw/zinc/79/47/96/903794796.db2.gz RAHRZNLCNNEPJD-HXUWFJFHSA-N 0 3 407.963 4.118 20 0 HIADHN CCN(C)[C@H](C(=O)Nc1ccc(NC(=O)CN2CCCCCC2)cc1)c1ccccc1 ZINC000490160888 903802621 /nfs/dbraw/zinc/80/26/21/903802621.db2.gz HOCHANRGZNSLJA-DEOSSOPVSA-N 0 3 422.573 4.133 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](NCCCOC2CCCC2)c2ccc(F)cc2)c1 ZINC000490164139 903805174 /nfs/dbraw/zinc/80/51/74/903805174.db2.gz KKBZDWNXSZQUDS-JOCHJYFZSA-N 0 3 405.535 4.258 20 0 HIADHN Cc1ccc([C@@H](NCCN2CCC[C@@H](C)C2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000490173093 903810206 /nfs/dbraw/zinc/81/02/06/903810206.db2.gz SKCZGEBJBPHZEY-DVECYGJZSA-N 0 3 414.615 4.118 20 0 HIADHN CN(C)C[C@@H](NC(=O)NCc1ccc(Oc2ccccc2)nc1)c1ccc(F)cc1 ZINC000490185590 903814863 /nfs/dbraw/zinc/81/48/63/903814863.db2.gz YFJOATAOZWQEIK-OAQYLSRUSA-N 0 3 408.477 4.115 20 0 HIADHN CCC(CC)[C@H](CN[C@@H](c1ccc(F)cc1)c1cccc(S(C)(=O)=O)c1)N(C)C ZINC000490190400 903817182 /nfs/dbraw/zinc/81/71/82/903817182.db2.gz IRMBOYMQQYXZLH-GOTSBHOMSA-N 0 3 420.594 4.275 20 0 HIADHN COc1ccc(NC(=O)NCCCN2CCc3ccccc3C2)cc1Br ZINC000490285106 903874880 /nfs/dbraw/zinc/87/48/80/903874880.db2.gz IBJYOHBGYJGQRY-UHFFFAOYSA-N 0 3 418.335 4.028 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N(C)Cc1ccc(OC)c(C)c1)c1cccc(OC)c1 ZINC000490292107 903879932 /nfs/dbraw/zinc/87/99/32/903879932.db2.gz WIXBKRUJMCNXNC-QFIPXVFZSA-N 0 3 413.562 4.237 20 0 HIADHN Cc1ccc(-c2cc(C(=O)Nc3cccc([C@H](C)N4CCOCC4)c3)[nH]n2)c(C)c1 ZINC000490294442 903883124 /nfs/dbraw/zinc/88/31/24/903883124.db2.gz RTOBOULWWYDGEP-SFHVURJKSA-N 0 3 404.514 4.339 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)Nc3ccc(NC(=O)c4ccc(Cl)cc4)cc3)[C@H]2C1 ZINC000490327972 903913559 /nfs/dbraw/zinc/91/35/59/903913559.db2.gz PLJWCSVPKWJGHC-YWZLYKJASA-N 0 3 412.921 4.150 20 0 HIADHN CCNC(=O)Nc1ccc(C)c(NC(=O)N[C@H](CN2CCCC2)c2ccccc2)c1 ZINC000490341401 903931783 /nfs/dbraw/zinc/93/17/83/903931783.db2.gz YYIKGDSYXAZCGA-OAQYLSRUSA-N 0 3 409.534 4.095 20 0 HIADHN O=C(Nc1ccc(-c2ccco2)cc1F)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1CO ZINC000490496210 904048409 /nfs/dbraw/zinc/04/84/09/904048409.db2.gz PHEOCFPJEMEHKY-TZIWHRDSSA-N 0 3 423.488 4.090 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2cc(F)cc(Br)c2F)[C@@H]1c1ccccc1 ZINC000490515321 904065254 /nfs/dbraw/zinc/06/52/54/904065254.db2.gz VHONSVHJBBYCLC-YOEHRIQHSA-N 0 3 410.262 4.294 20 0 HIADHN CN(C(=O)c1c[nH]c2cccc(Br)c12)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000490612267 904135805 /nfs/dbraw/zinc/13/58/05/904135805.db2.gz VGWZSLSJNWXJMK-MRXNPFEDSA-N 0 3 412.331 4.277 20 0 HIADHN O=C1C[C@@H]([C@@H]2CCCCN2Cc2nc3cc(Cl)ccc3n2Cc2ccccc2)CN1 ZINC000490674247 904168114 /nfs/dbraw/zinc/16/81/14/904168114.db2.gz OLDZZZDXYCYEIB-NQIIRXRSSA-N 0 3 422.960 4.229 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2ccc(C(=O)NCC(C)C)cc2)N2CCCC2)cc1 ZINC000490688436 904173935 /nfs/dbraw/zinc/17/39/35/904173935.db2.gz AIHDSSAECKYDNN-HSZRJFAPSA-N 0 3 422.573 4.339 20 0 HIADHN C[C@H](NC(=O)NCCc1coc(-c2ccc(F)cc2)n1)[C@H](c1ccccc1)N(C)C ZINC000490745967 904205043 /nfs/dbraw/zinc/20/50/43/904205043.db2.gz OAALEGAAWBFOKR-HRAATJIYSA-N 0 3 410.493 4.014 20 0 HIADHN Cc1ccc(-c2nc(CCNC(=O)N[C@H](C)[C@H](c3ccccc3)N(C)C)co2)cc1 ZINC000490762108 904215019 /nfs/dbraw/zinc/21/50/19/904215019.db2.gz WYLMKFRANONNLA-XMSQKQJNSA-N 0 3 406.530 4.183 20 0 HIADHN O=C(N[C@H](c1c[nH]c2ccccc21)C(F)(F)F)N1CCN(C2CCCCC2)CC1 ZINC000490858736 904290257 /nfs/dbraw/zinc/29/02/57/904290257.db2.gz YBXCKLYVDUQKAH-LJQANCHMSA-N 0 3 408.468 4.431 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N1CCc2ccc(Br)cc21 ZINC000490888292 904304968 /nfs/dbraw/zinc/30/49/68/904304968.db2.gz LYVCCRLBCYYHKZ-QGZVFWFLSA-N 0 3 420.376 4.420 20 0 HIADHN C[C@@H](Cc1ccccc1F)NC(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000490971852 904343234 /nfs/dbraw/zinc/34/32/34/904343234.db2.gz GQSUWEHCBXXOPD-KRWDZBQOSA-N 0 3 401.551 4.170 20 0 HIADHN Cc1sc2ncnc(SCCC(=O)NC[C@H](c3ccccc3)N(C)C)c2c1C ZINC000506113454 914808737 /nfs/dbraw/zinc/80/87/37/914808737.db2.gz RPKBWOXCTDXLHW-QGZVFWFLSA-N 0 3 414.600 4.209 20 0 HIADHN CCc1ccc([C@H](NCCN(C)[C@H](C)CC)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000491054138 904397861 /nfs/dbraw/zinc/39/78/61/904397861.db2.gz PXGSPNGPHXRZSM-JPYJTQIMSA-N 0 3 402.604 4.062 20 0 HIADHN Cc1ccccc1[C@@H](NC(=O)N(CCN(C)C)Cc1ccc(F)cc1F)C1CC1 ZINC000491090082 904422835 /nfs/dbraw/zinc/42/28/35/904422835.db2.gz JYJVBPZPEUMPAH-QFIPXVFZSA-N 0 3 401.501 4.498 20 0 HIADHN CN1CC[C@@H](NC(=O)C2(Cc3ccccc3Br)CC2)[C@@H]1c1ccccc1 ZINC000491135520 904448235 /nfs/dbraw/zinc/44/82/35/904448235.db2.gz YBBKRDSRHCOHBV-UXHICEINSA-N 0 3 413.359 4.333 20 0 HIADHN CN1CC[C@H](NC(=O)C2(Cc3ccccc3Br)CC2)[C@@H]1c1ccccc1 ZINC000491135516 904448348 /nfs/dbraw/zinc/44/83/48/904448348.db2.gz YBBKRDSRHCOHBV-PMACEKPBSA-N 0 3 413.359 4.333 20 0 HIADHN CC(C)Oc1ccc([C@@H](CN2C(=O)[C@@H]3CC[C@@H](c4ccccc4)N3C2=O)N(C)C)cc1 ZINC000491206829 904482237 /nfs/dbraw/zinc/48/22/37/904482237.db2.gz VLZLAEPNWJKLPN-RJGXRXQPSA-N 0 3 421.541 4.244 20 0 HIADHN Cc1c(C)n(Cc2ccco2)c2ncnc(NCCc3nc4ccc(F)cc4[nH]3)c12 ZINC000506133424 914816515 /nfs/dbraw/zinc/81/65/15/914816515.db2.gz WFOGGQKKUZLLRN-UHFFFAOYSA-N 0 3 404.449 4.359 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)Nc3ccc(Br)c(C(F)(F)F)c3)[C@H]2C1 ZINC000491297186 904523838 /nfs/dbraw/zinc/52/38/38/904523838.db2.gz SXLRYGIDSCZWAO-HZMBPMFUSA-N 0 3 406.246 4.026 20 0 HIADHN CC(C)Oc1ccc([C@H](CN2C(=O)CN([C@H](C)c3ccccc3)C2=O)N(C)C)cc1 ZINC000491313679 904532296 /nfs/dbraw/zinc/53/22/96/904532296.db2.gz BBEZBOCSPWWHTK-GCJKJVERSA-N 0 3 409.530 4.102 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)NCc3ccc(C4CC4)cc3F)CC2)C[C@H](C)O1 ZINC000491350519 904551489 /nfs/dbraw/zinc/55/14/89/904551489.db2.gz WZNXTBCRNQSCFI-ROUUACIJSA-N 0 3 417.569 4.124 20 0 HIADHN COc1ccc(CN(Cc2cccc(C(=O)N3CCCCC3)c2)[C@H](CO)C(C)C)cc1 ZINC000491356641 904553558 /nfs/dbraw/zinc/55/35/58/904553558.db2.gz PNOCLPDAHUYFDF-RUZDIDTESA-N 0 3 424.585 4.340 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](NCCc2ccccc2F)c2ccc(F)cc2)c1 ZINC000491357493 904555473 /nfs/dbraw/zinc/55/54/73/904555473.db2.gz ZXPMHNGSGLWZCV-QFIPXVFZSA-N 0 3 401.478 4.290 20 0 HIADHN CCc1ccc([C@@H](NCCc2csc(C)n2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000491367488 904561573 /nfs/dbraw/zinc/56/15/73/904561573.db2.gz MNLGRJBKTZGASS-JOCHJYFZSA-N 0 3 414.596 4.339 20 0 HIADHN Cc1ccc(C)c([C@H](NCc2ccc(N3CCN(C)CC3)nc2)c2ccccc2)c1 ZINC000491424988 904589958 /nfs/dbraw/zinc/58/99/58/904589958.db2.gz YJDBDYOYPNRIAR-AREMUKBSSA-N 0 3 400.570 4.329 20 0 HIADHN O=C(NCC1(c2ccccc2)CC1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000491533409 904640626 /nfs/dbraw/zinc/64/06/26/904640626.db2.gz ZEOHTBBGELVQEG-JOCHJYFZSA-N 0 3 402.460 4.289 20 0 HIADHN COc1cccc(CN(C)C(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)c1 ZINC000491542020 904643557 /nfs/dbraw/zinc/64/35/57/904643557.db2.gz ZUTKLEIGNZQPOU-NRFANRHFSA-N 0 3 406.448 4.108 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)Nc2ccccc2N2C[C@@H](C)O[C@@H](C)C2)c1 ZINC000491557248 904649195 /nfs/dbraw/zinc/64/91/95/904649195.db2.gz KDNUMXUKEYCCPD-OYRHEFFESA-N 0 3 424.589 4.204 20 0 HIADHN CCN1CC[C@H](N(C)S(=O)(=O)c2cc(Cl)ccc2OCCC2CC2)C[C@@H]1C ZINC000491587333 904664251 /nfs/dbraw/zinc/66/42/51/904664251.db2.gz WYSVYPIVESZHCL-YJBOKZPZSA-N 0 3 414.999 4.012 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)N[C@@H](c2ccccc2)c2ccncc2)CCN1Cc1ccccc1 ZINC000491997531 904754104 /nfs/dbraw/zinc/75/41/04/904754104.db2.gz ILSFZDHVGHEDSQ-YGOYIFOWSA-N 0 3 400.526 4.133 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)Nc3cc(Br)cc(C(F)(F)F)c3)[C@H]2C1 ZINC000491998150 904755055 /nfs/dbraw/zinc/75/50/55/904755055.db2.gz KKDMFIMBAZZUSI-HZMBPMFUSA-N 0 3 406.246 4.026 20 0 HIADHN Cc1ccc(-c2nc3cc(F)ccc3n2C)cc1NC(=O)N1CC[C@@H]2CCN(C)C[C@@H]21 ZINC000492001330 904757252 /nfs/dbraw/zinc/75/72/52/904757252.db2.gz RCBUQBLQEKFPQH-AOMKIAJQSA-N 0 3 421.520 4.246 20 0 HIADHN CCC(CC)[C@H](O)CN[C@H](c1cccc(S(C)(=O)=O)c1)c1ccc(C)cc1C ZINC000492078331 904791499 /nfs/dbraw/zinc/79/14/99/904791499.db2.gz HHCXVUQTACGCBN-DHIUTWEWSA-N 0 3 403.588 4.183 20 0 HIADHN CN(C)[C@H](CNC(=O)NCc1ccnc(Oc2ccccc2F)c1)c1ccccc1 ZINC000492137366 904803845 /nfs/dbraw/zinc/80/38/45/904803845.db2.gz XQVPADDXIISVAZ-HXUWFJFHSA-N 0 3 408.477 4.115 20 0 HIADHN Cc1cc(Br)cn2c(CN[C@H](C)[C@@H]3OCCc4sccc43)cnc12 ZINC000492226878 904818732 /nfs/dbraw/zinc/81/87/32/904818732.db2.gz PUIISZPTVDOEEK-PXAZEXFGSA-N 0 3 406.349 4.259 20 0 HIADHN COc1ccc([C@H](CNC(=O)N[C@@H](C)CCCC(F)(F)F)N2CCCC2)cc1 ZINC000492313971 904833325 /nfs/dbraw/zinc/83/33/25/904833325.db2.gz QRKFEPBPIQXFPG-YJBOKZPZSA-N 0 3 401.473 4.252 20 0 HIADHN COc1ccc([C@@H](CNC(=O)N[C@H](C)CCCC(F)(F)F)N2CCCC2)cc1 ZINC000492313968 904833365 /nfs/dbraw/zinc/83/33/65/904833365.db2.gz QRKFEPBPIQXFPG-CRAIPNDOSA-N 0 3 401.473 4.252 20 0 HIADHN COc1ccc([C@@H](CNC(=O)N[C@@H](C)CCCC(F)(F)F)N2CCCC2)cc1 ZINC000492313969 904833666 /nfs/dbraw/zinc/83/36/66/904833666.db2.gz QRKFEPBPIQXFPG-MAUKXSAKSA-N 0 3 401.473 4.252 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)Nc1nc(C2CCOCC2)cs1 ZINC000492515330 904861829 /nfs/dbraw/zinc/86/18/29/904861829.db2.gz MPCQJQURWYLXAT-IBGZPJMESA-N 0 3 416.591 4.315 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)C(=O)Nc1cccc(C(F)F)c1)c1ccc(Cl)cc1 ZINC000506224374 914851323 /nfs/dbraw/zinc/85/13/23/914851323.db2.gz DMHFEKOKKKDWHJ-SFHVURJKSA-N 0 3 423.891 4.415 20 0 HIADHN Cc1nn2c(CN3CCCN(Cc4ccc(C(F)(F)F)cc4)CC3)c(C)nc2s1 ZINC000506245583 914860843 /nfs/dbraw/zinc/86/08/43/914860843.db2.gz LTODVAKDNWGRQD-UHFFFAOYSA-N 0 3 423.508 4.134 20 0 HIADHN C[C@H](C(=O)N(C)[C@@H](c1ncc[nH]1)c1ccccc1)N1CCC(Cc2ccccc2)CC1 ZINC000493010016 904987894 /nfs/dbraw/zinc/98/78/94/904987894.db2.gz PGGYVRZAJKBERI-HYBUGGRVSA-N 0 3 416.569 4.301 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](NCCCNc2ccccc2)c2ccc(F)cc2)c1 ZINC000493052788 905003917 /nfs/dbraw/zinc/00/39/17/905003917.db2.gz FNVXGMWVXMDDRT-HSZRJFAPSA-N 0 3 412.530 4.410 20 0 HIADHN CCc1ccc([C@H](NCC2(CCO)CCCC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000493062519 905005984 /nfs/dbraw/zinc/00/59/84/905005984.db2.gz TVHNRTUCIGWNTM-QHCPKHFHSA-N 0 3 415.599 4.274 20 0 HIADHN Cc1ccc([C@H](NC[C@@H](CO)c2ccccc2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000493128524 905026988 /nfs/dbraw/zinc/02/69/88/905026988.db2.gz JVFGEJZOXAEACQ-WIOPSUGQSA-N 0 3 423.578 4.162 20 0 HIADHN Cc1ccc([C@H](NC[C@]2(C)CCCC[C@@H]2O)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000493176852 905041297 /nfs/dbraw/zinc/04/12/97/905041297.db2.gz PIUJVDMZSXJPCL-VXNXHJTFSA-N 0 3 415.599 4.327 20 0 HIADHN CN(C(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1)[C@H](c1ncc[nH]1)c1ccccc1 ZINC000493206366 905049748 /nfs/dbraw/zinc/04/97/48/905049748.db2.gz QRLZMFFERYNUMX-IRLDBZIGSA-N 0 3 406.505 4.009 20 0 HIADHN CCO[C@@H](CCN[C@H](c1ccc(F)cc1)c1cccc(S(C)(=O)=O)c1)C(C)C ZINC000493308847 905082694 /nfs/dbraw/zinc/08/26/94/905082694.db2.gz ZXQYWZRSTADIQK-FCHUYYIVSA-N 0 3 407.551 4.359 20 0 HIADHN C[C@]1(CO)CCC[C@H]1NCC(=O)Nc1nc(-c2ccc(Cl)cc2Cl)cs1 ZINC000493388895 905102169 /nfs/dbraw/zinc/10/21/69/905102169.db2.gz SJRAJPCMRYROQN-CRAIPNDOSA-N 0 3 414.358 4.196 20 0 HIADHN Cc1ccccc1-c1cc(C(=O)N2CC[C@H]3CCN(C)C[C@@H]32)c2cnn(C(C)C)c2n1 ZINC000493469431 905131892 /nfs/dbraw/zinc/13/18/92/905131892.db2.gz ZYRXAPBOULCWJH-JPYJTQIMSA-N 0 3 417.557 4.154 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)c3cc(-c4ccc(F)cc4)nc4onc(C5CC5)c43)[C@H]2C1 ZINC000493559378 905160594 /nfs/dbraw/zinc/16/05/94/905160594.db2.gz VWKKUUYJALJHLI-YWZLYKJASA-N 0 3 420.488 4.073 20 0 HIADHN COc1c(O)cccc1CNc1cccc(N2CCN(CCc3ccccc3)CC2)c1 ZINC000493733939 905205094 /nfs/dbraw/zinc/20/50/94/905205094.db2.gz HERSKHVYDPOKLW-UHFFFAOYSA-N 0 3 417.553 4.378 20 0 HIADHN O=C(NCc1ccco1)N(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000493917221 905268047 /nfs/dbraw/zinc/26/80/47/905268047.db2.gz PUPWOPKINIZCKG-QFIPXVFZSA-N 0 3 404.514 4.051 20 0 HIADHN CC[C@H](NC(=O)NC[C@@H](c1ccc(OC(C)C)cc1)N(C)C)c1nc(C)cs1 ZINC000493919130 905269403 /nfs/dbraw/zinc/26/94/03/905269403.db2.gz GWCYUELKZWIJDU-OALUTQOASA-N 0 3 404.580 4.292 20 0 HIADHN COCCC(=O)N1CCC(N[C@@H](c2ccc(OC)cc2)c2ccccc2Cl)CC1 ZINC000493997361 905340199 /nfs/dbraw/zinc/34/01/99/905340199.db2.gz VLZYKXFHLRUDTM-QHCPKHFHSA-N 0 3 416.949 4.055 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](N[C@H]2CCOC3(CCCC3)C2)c2ccc(F)cc2)c1 ZINC000494003755 905343457 /nfs/dbraw/zinc/34/34/57/905343457.db2.gz LYDNDUWGXSQNFN-RBBKRZOGSA-N 0 3 417.546 4.400 20 0 HIADHN Cc1nn(Cc2ccccc2Cl)c(C)c1CN1CCC[C@@H](CNC(=O)C(C)C)C1 ZINC000512405284 921139844 /nfs/dbraw/zinc/13/98/44/921139844.db2.gz YMBHRPMBVDKSSO-IBGZPJMESA-N 0 3 416.997 4.186 20 0 HIADHN COCCC1(CN[C@@H](c2ccc(Cl)cc2)c2cccc(S(C)(=O)=O)c2)CC1 ZINC000494026582 905368288 /nfs/dbraw/zinc/36/82/88/905368288.db2.gz CSYLSORHXXAIGQ-FQEVSTJZSA-N 0 3 407.963 4.239 20 0 HIADHN C[C@H]1[C@H](NC(=O)CCn2c3ccccc3nc2C2CC2)CCN1Cc1ccccc1 ZINC000494036589 905376221 /nfs/dbraw/zinc/37/62/21/905376221.db2.gz GAXKTHAHUSZUJX-GHTZIAJQSA-N 0 3 402.542 4.083 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)[C@@H]2CCn3c(cnc3C3CCCCC3)C2)CCN1Cc1ccccc1 ZINC000494039990 905382239 /nfs/dbraw/zinc/38/22/39/905382239.db2.gz WEZBRWFRHUXUEY-CKUXNOBLSA-N 0 3 420.601 4.272 20 0 HIADHN CCN(CC(=O)Nc1ccccc1C(F)(F)F)C(=O)[C@H](C(C)C)N1CCCCC1 ZINC000494040151 905382637 /nfs/dbraw/zinc/38/26/37/905382637.db2.gz APBBNBQULHTUAT-IBGZPJMESA-N 0 3 413.484 4.003 20 0 HIADHN O=C(Nc1ccccc1OC(F)(F)F)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000494050080 905388975 /nfs/dbraw/zinc/38/89/75/905388975.db2.gz XMGKZHYFAMORAV-UHFFFAOYSA-N 0 3 408.420 4.042 20 0 HIADHN C[C@H]1[C@H](NC(=O)c2ccc(NC(=O)c3ccccc3)cc2)CCN1Cc1ccccc1 ZINC000494061554 905400050 /nfs/dbraw/zinc/40/00/50/905400050.db2.gz XQFRAYJIXBZXPY-YADARESESA-N 0 3 413.521 4.332 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)c1ccnc(SCC(F)(F)F)c1 ZINC000494091568 905426554 /nfs/dbraw/zinc/42/65/54/905426554.db2.gz DRHUMQBRDNJKEN-UHFFFAOYSA-N 0 3 415.456 4.079 20 0 HIADHN Cc1nn(-c2ccccc2)cc1CN1CCC[C@@H](CNC(=O)Nc2cccc(F)c2)C1 ZINC000512427923 921155170 /nfs/dbraw/zinc/15/51/70/921155170.db2.gz OKAWFPHPWSEZSQ-IBGZPJMESA-N 0 3 421.520 4.354 20 0 HIADHN CC(=O)c1c(C)cc(C)c(CN[C@H]2CC(=O)N(C)[C@@H]2c2ccc(F)c(F)c2)c1C ZINC000494208924 905540168 /nfs/dbraw/zinc/54/01/68/905540168.db2.gz OIBPRTFHLYHHRA-NZQKXSOJSA-N 0 3 400.469 4.154 20 0 HIADHN CC(C)c1ccc([C@@H](NC(=O)N2CCN(C3CCOCC3)C[C@H]2C)C(C)C)cc1 ZINC000494212063 905543533 /nfs/dbraw/zinc/54/35/33/905543533.db2.gz KCXILBDUSLIGPG-XXBNENTESA-N 0 3 401.595 4.402 20 0 HIADHN C[C@@H](NC(=O)NC[C@H](c1cccs1)N1CCCC1)c1nc(C(F)(F)F)cs1 ZINC000494219165 905551069 /nfs/dbraw/zinc/55/10/69/905551069.db2.gz HVMVUHPSEFXVMQ-VXGBXAGGSA-N 0 3 418.510 4.421 20 0 HIADHN C[C@@H](O)C[C@H]1CCCCCN1CC(=O)Nc1cccc(CSc2ccccn2)c1 ZINC000512434173 921159172 /nfs/dbraw/zinc/15/91/72/921159172.db2.gz UZLDAVXYYUWODA-WIYYLYMNSA-N 0 3 413.587 4.328 20 0 HIADHN O=C(Nc1cccc(OC2CCCC2)c1)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1CO ZINC000494263115 905588480 /nfs/dbraw/zinc/58/84/80/905588480.db2.gz VLYIASMBEQYUTC-GBXCKJPGSA-N 0 3 423.557 4.013 20 0 HIADHN CC(C)C(=O)NC[C@H]1CCCN(Cc2cc3ccccc3nc2N2CCCCC2)C1 ZINC000512449149 921168810 /nfs/dbraw/zinc/16/88/10/921168810.db2.gz CEELYVHBTOGGRO-HXUWFJFHSA-N 0 3 408.590 4.209 20 0 HIADHN COc1ccccc1[C@H](C)NC(=O)[C@H](C)N[C@@H]1CCO[C@H]1c1ccc(Cl)cc1 ZINC000494462729 905744495 /nfs/dbraw/zinc/74/44/95/905744495.db2.gz HDSFDLGZLCYUBI-VDKWYEAUSA-N 0 3 402.922 4.034 20 0 HIADHN O=C1[C@H](N[C@H]2CCO[C@H]2c2ccc(Cl)cc2)CCCN1Cc1ccc(F)cc1F ZINC000494481708 905763661 /nfs/dbraw/zinc/76/36/61/905763661.db2.gz BPPRGXQYVIZWRH-HBMCJLEFSA-N 0 3 420.887 4.229 20 0 HIADHN Cc1ccc2nc(-c3ccc(NC(=O)CN[C@H]4CCO[C@@H]4C4CC4)cc3)sc2c1 ZINC000494486421 905771040 /nfs/dbraw/zinc/77/10/40/905771040.db2.gz UKOSKKQXLKDANA-SIKLNZKXSA-N 0 3 407.539 4.367 20 0 HIADHN O=C1[C@H](N[C@@H]2CCO[C@@H]2c2ccc(Cl)c(F)c2)CCCN1c1ccccc1F ZINC000494492202 905777371 /nfs/dbraw/zinc/77/73/71/905777371.db2.gz HFVRCVGYAKRXBY-QWFCFKBJSA-N 0 3 406.860 4.233 20 0 HIADHN CC[C@H](N[C@H]1CCO[C@H]1c1ccc(Cl)c(F)c1)C(=O)Nc1ccc(OC)cc1 ZINC000494499334 905787546 /nfs/dbraw/zinc/78/75/46/905787546.db2.gz ZFFIWGBQHMSPRL-UFYCRDLUSA-N 0 3 406.885 4.325 20 0 HIADHN O=C(Nc1ccc2[nH]c(C3CCC3)nc2c1)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000494519612 905809594 /nfs/dbraw/zinc/80/95/94/905809594.db2.gz MCACEOQBTYVPRV-UHFFFAOYSA-N 0 3 418.541 4.287 20 0 HIADHN Cc1cc(NC(=O)N2CC[C@H](C)C(F)(F)C2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000494653784 905885296 /nfs/dbraw/zinc/88/52/96/905885296.db2.gz VRIAEOKOSYKYCP-QFBILLFUSA-N 0 3 417.504 4.148 20 0 HIADHN Cc1cc(NC(=O)N2CC[C@H](C)C(F)(F)C2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000494653783 905885340 /nfs/dbraw/zinc/88/53/40/905885340.db2.gz VRIAEOKOSYKYCP-LPHOPBHVSA-N 0 3 417.504 4.148 20 0 HIADHN Clc1ccc(-n2c(CN3CCCC3)nnc2SCCN2CCCCC2)cc1 ZINC000494666865 905890736 /nfs/dbraw/zinc/89/07/36/905890736.db2.gz WANAEXAGSGQQOT-UHFFFAOYSA-N 0 3 405.999 4.095 20 0 HIADHN C[C@@H](NC(=O)N1CCN(C2CCOCC2)C[C@H]1C)C(c1ccccc1)c1ccccc1 ZINC000494683361 905897874 /nfs/dbraw/zinc/89/78/74/905897874.db2.gz VTROLJWJVPSIDO-NHCUHLMSSA-N 0 3 421.585 4.102 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](NCCc2c[nH]c3ncccc23)c2ccc(F)cc2)c1 ZINC000494747181 905947069 /nfs/dbraw/zinc/94/70/69/905947069.db2.gz QDMYRDHESZEIPB-QFIPXVFZSA-N 0 3 423.513 4.027 20 0 HIADHN CSC[C@H](O)CN[C@H](COc1cccc(F)c1)c1cccc(C(F)(F)F)c1 ZINC000494793552 905994686 /nfs/dbraw/zinc/99/46/86/905994686.db2.gz VHLIHYOEJDTEIC-SJLPKXTDSA-N 0 3 403.441 4.278 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3ccccc3O[C@@H](C)C(F)(F)F)cc2)CC1 ZINC000494794620 905996836 /nfs/dbraw/zinc/99/68/36/905996836.db2.gz YQNBHFDTGJSEGK-INIZCTEOSA-N 0 3 421.463 4.410 20 0 HIADHN CC(C)Oc1ccc(CN[C@H](C)c2ccc(S(=O)(=O)N(C)C)cc2)cc1Cl ZINC000494795630 905996993 /nfs/dbraw/zinc/99/69/93/905996993.db2.gz PVFGOFMIVLKGBX-OAHLLOKOSA-N 0 3 410.967 4.228 20 0 HIADHN C[C@@H](NC(=O)N1CCN(C2CCOCC2)C[C@@H]1C)c1ccccc1Oc1ccccc1 ZINC000494902892 906077892 /nfs/dbraw/zinc/07/78/92/906077892.db2.gz KKRHZDBMAUYPHQ-VQTJNVASSA-N 0 3 423.557 4.435 20 0 HIADHN C[C@H](N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1)c1ccc(C(=O)N(C)C)cc1 ZINC000494929505 906101764 /nfs/dbraw/zinc/10/17/64/906101764.db2.gz ITZFCLFSISNREP-YADARESESA-N 0 3 415.537 4.289 20 0 HIADHN Cc1ccc([C@@H](NCC2([C@H](O)C(C)C)CC2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000494969434 906138121 /nfs/dbraw/zinc/13/81/21/906138121.db2.gz MMSXRFFFGAPHBX-XZOQPEGZSA-N 0 3 415.599 4.183 20 0 HIADHN COc1ccc([C@H](NC[C@@H]2C[C@H](O)CN2Cc2ccccc2)c2ccc(F)cc2)cc1 ZINC000494971229 906139485 /nfs/dbraw/zinc/13/94/85/906139485.db2.gz PGOGMDPWMCCUSH-KYPHJKQUSA-N 0 3 420.528 4.149 20 0 HIADHN C[C@H](NC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1)[C@@H]1OCCc2sccc21 ZINC000494972055 906139647 /nfs/dbraw/zinc/13/96/47/906139647.db2.gz FZMMFMJDPHOOPX-JLMWRMLUSA-N 0 3 413.587 4.056 20 0 HIADHN C[C@@H](CNC(=O)N(Cc1ccc(F)cc1)C1CCOCC1)N(C)Cc1ccccc1 ZINC000494980761 906146524 /nfs/dbraw/zinc/14/65/24/906146524.db2.gz QXSZJZFOTBFLPB-IBGZPJMESA-N 0 3 413.537 4.037 20 0 HIADHN COc1cccc([C@@H](CNC(=O)N[C@@H](C)CCCC(F)(F)F)N2CCCC2)c1 ZINC000495013322 906171061 /nfs/dbraw/zinc/17/10/61/906171061.db2.gz ASBPWICSZHIAEK-MAUKXSAKSA-N 0 3 401.473 4.252 20 0 HIADHN C[C@H](N[C@H](c1cncc(Br)c1)C1CC1)c1ccc(C(=O)N(C)C)cc1 ZINC000495020918 906179300 /nfs/dbraw/zinc/17/93/00/906179300.db2.gz VLIDRBOATUIFJD-DJJJIMSYSA-N 0 3 402.336 4.348 20 0 HIADHN CCN1CCN(Cc2ccc(CNC(=O)Nc3c(C)cc(OC)c(C)c3C)cc2)CC1 ZINC000495032654 906188242 /nfs/dbraw/zinc/18/82/42/906188242.db2.gz WPMUYLMYWJZNDH-UHFFFAOYSA-N 0 3 424.589 4.080 20 0 HIADHN Cc1ccc([C@H](NCCc2ccncc2C)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000495041581 906196514 /nfs/dbraw/zinc/19/65/14/906196514.db2.gz AMNATOOJPZHZRB-XMMPIXPASA-N 0 3 408.567 4.332 20 0 HIADHN Cc1ccccc1[C@H](NCc1cccnc1N1CCC(C(N)=O)CC1)C1CCCC1 ZINC000495039629 906196697 /nfs/dbraw/zinc/19/66/97/906196697.db2.gz CRYAUJDABKKKJR-HSZRJFAPSA-N 0 3 406.574 4.113 20 0 HIADHN Cc1cnccc1CCN[C@@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000495043139 906197989 /nfs/dbraw/zinc/19/79/89/906197989.db2.gz DIEDNZYKTRRCKF-QFIPXVFZSA-N 0 3 414.958 4.369 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)c2c[nH]cc2-c2ccc(C)s2)CC1 ZINC000495052027 906206856 /nfs/dbraw/zinc/20/68/56/906206856.db2.gz WREWGDULGBHEIS-UHFFFAOYSA-N 0 3 422.598 4.119 20 0 HIADHN Brc1ccc(N2CC[C@@H](N[C@@H](c3nc[nH]n3)C3CCCCC3)C2)cc1 ZINC000495081640 906227262 /nfs/dbraw/zinc/22/72/62/906227262.db2.gz UHJGGSPORDTIRS-SJLPKXTDSA-N 0 3 404.356 4.057 20 0 HIADHN Cc1ccccc1NC(=O)C[C@H](C)N[C@@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O ZINC000495181158 906290039 /nfs/dbraw/zinc/29/00/39/906290039.db2.gz CFKHJSWTRZDHKL-IFXJQAMLSA-N 0 3 420.340 4.414 20 0 HIADHN COCCC[C@@H](CNCc1c(Br)c(C)nn1C)c1ccc(Cl)cc1 ZINC000512537561 921222799 /nfs/dbraw/zinc/22/27/99/921222799.db2.gz UWUNFUCMMOXLLF-HNNXBMFYSA-N 0 3 414.775 4.444 20 0 HIADHN C[C@@H]1CCCN(CCNC(=O)c2ccc(COc3cccc(Br)c3)o2)C1 ZINC000495309081 906369734 /nfs/dbraw/zinc/36/97/34/906369734.db2.gz YVQDRLDTRQXGCV-OAHLLOKOSA-N 0 3 421.335 4.083 20 0 HIADHN CCCNC(=O)[C@@H]1CCCN(Cc2ccc(OCc3cccs3)c(OC)c2)C1 ZINC000512552286 921231304 /nfs/dbraw/zinc/23/13/04/921231304.db2.gz LRMLFQLCKGAPNJ-GOSISDBHSA-N 0 3 402.560 4.074 20 0 HIADHN COc1cc(NC(=O)NCCCN2CCc3ccccc3C2)cc(OC)c1C(C)C ZINC000495364053 906404948 /nfs/dbraw/zinc/40/49/48/906404948.db2.gz MBELTSQESQIHDP-UHFFFAOYSA-N 0 3 411.546 4.397 20 0 HIADHN Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)N[C@H](C)c1cccc(N2CCOCC2)c1 ZINC000495415413 906438085 /nfs/dbraw/zinc/43/80/85/906438085.db2.gz PSVDWYKRXFHNBL-CABCVRRESA-N 0 3 410.484 4.311 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1CCN(Cc2ccccc2)[C@H]1C)c1nc(C(C)(C)C)cs1 ZINC000495449174 906456049 /nfs/dbraw/zinc/45/60/49/906456049.db2.gz ATLICNNYVWLQCJ-XYJFISCASA-N 0 3 400.592 4.464 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)N[C@@H](C)c2nc(C(C)(C)C)cs2)cc1 ZINC000495455622 906461422 /nfs/dbraw/zinc/46/14/22/906461422.db2.gz PRGSJYIBJJZXDV-YOEHRIQHSA-N 0 3 404.580 4.112 20 0 HIADHN O=C(Nc1ccc(O)cc1)C1CCN(Cc2ccc(-c3ccncc3)cc2F)CC1 ZINC000512582580 921248816 /nfs/dbraw/zinc/24/88/16/921248816.db2.gz NUHHXTMDQBTYGW-UHFFFAOYSA-N 0 3 405.473 4.444 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)[C@H]1C[C@@H]1c1ccc(Br)cc1 ZINC000496000392 906594426 /nfs/dbraw/zinc/59/44/26/906594426.db2.gz UHGMXDOMHDCXMD-UXHICEINSA-N 0 3 401.348 4.143 20 0 HIADHN Cc1sc(CNC(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)nc1C(C)C ZINC000496225855 906632315 /nfs/dbraw/zinc/63/23/15/906632315.db2.gz XPBRHNLLCKOKHY-LJQANCHMSA-N 0 3 418.607 4.464 20 0 HIADHN COc1cc(C(=O)N(CCN(C)C)Cc2ccccc2F)ccc1OCC(C)C ZINC000496336466 906661429 /nfs/dbraw/zinc/66/14/29/906661429.db2.gz DEQZWCQAADPZSY-UHFFFAOYSA-N 0 3 402.510 4.073 20 0 HIADHN COc1ccc([C@@H]2CCCN2C[C@H](O)COCc2ccccc2Cl)cc1OC ZINC000497095014 906803388 /nfs/dbraw/zinc/80/33/88/906803388.db2.gz FRLRRCWHIWWIAF-ICSRJNTNSA-N 0 3 405.922 4.072 20 0 HIADHN CC(C)c1nc(C(=O)NC[C@H](c2ccccc2)N(C)C)nn1-c1ccccc1Cl ZINC000497374965 906862597 /nfs/dbraw/zinc/86/25/97/906862597.db2.gz SPCGFWVUSDUHKI-LJQANCHMSA-N 0 3 411.937 4.077 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)CSc2cccc(C(F)(F)F)c2)o1 ZINC000497381556 906868853 /nfs/dbraw/zinc/86/88/53/906868853.db2.gz FJCOYKBQTFKILC-UHFFFAOYSA-N 0 3 400.466 4.289 20 0 HIADHN CCOc1cc(C(=O)NC[C@@H](c2ccccc2)N(C)C)ccc1OCc1cccnc1 ZINC000497383177 906870475 /nfs/dbraw/zinc/87/04/75/906870475.db2.gz GNIVXYWSKBVAOX-QFIPXVFZSA-N 0 3 419.525 4.092 20 0 HIADHN CC(C)[C@H](c1ccccc1)N(C)CC(=O)N1CCC(C(=O)Nc2ccccc2)CC1 ZINC000497395308 906877821 /nfs/dbraw/zinc/87/78/21/906877821.db2.gz YYEAZTYGLWRXPB-XMMPIXPASA-N 0 3 407.558 4.193 20 0 HIADHN Cc1ccccc1C(=O)NC1CCN(C(=O)CN(C)[C@H](c2ccccc2)C(C)C)CC1 ZINC000497412654 906888435 /nfs/dbraw/zinc/88/84/35/906888435.db2.gz SPKPHNWMJUBTMK-VWLOTQADSA-N 0 3 421.585 4.045 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)CNC(=O)c2ccc(Oc3ccccc3)cc2)c1 ZINC000497446356 906921107 /nfs/dbraw/zinc/92/11/07/906921107.db2.gz SYQPNYQBLUNPSU-UHFFFAOYSA-N 0 3 417.509 4.217 20 0 HIADHN Cc1ccc(C(=O)NC2CCN(Cc3ccc(OCc4cccnc4)cc3)CC2)s1 ZINC000512664325 921280211 /nfs/dbraw/zinc/28/02/11/921280211.db2.gz ZUULDJQFKBTWOT-UHFFFAOYSA-N 0 3 421.566 4.425 20 0 HIADHN COc1ccc(CCCN(C)[C@@H](C)C(=O)Nc2ccccc2Br)cc1 ZINC000497469881 906951689 /nfs/dbraw/zinc/95/16/89/906951689.db2.gz DSGCBJWCEDUAJW-HNNXBMFYSA-N 0 3 405.336 4.349 20 0 HIADHN CN(CCCN1CCN(C)CC1)C(=O)N[C@H](CCCc1ccccc1)c1ccccc1 ZINC000497480813 906961277 /nfs/dbraw/zinc/96/12/77/906961277.db2.gz FMRPROKIPLCYAD-RUZDIDTESA-N 0 3 422.617 4.030 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)N[C@H](C)c2cc(OC)c(OC)cc2F)N(C)C)cc1 ZINC000512667476 921281407 /nfs/dbraw/zinc/28/14/07/921281407.db2.gz PTFYKGICHLJJSH-FOIQADDNSA-N 0 3 417.525 4.068 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CN1CCC(C(=O)NCc2ccc(C)cc2)CC1 ZINC000512672806 921283052 /nfs/dbraw/zinc/28/30/52/921283052.db2.gz KWEWMHDKCODNCY-UHFFFAOYSA-N 0 3 416.569 4.326 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)NCc3ccccc3COc3ccccc3Cl)[C@@H]2C1 ZINC000497506458 906997120 /nfs/dbraw/zinc/99/71/20/906997120.db2.gz IANFVEDQUZLJGI-LAUBAEHRSA-N 0 3 413.949 4.155 20 0 HIADHN O=C(Nc1ccccc1)C1CCN(C[C@@H](O)COc2cc(Cl)ccc2Cl)CC1 ZINC000497586405 907069509 /nfs/dbraw/zinc/06/95/09/907069509.db2.gz YWIKNVCQNHINRN-GOSISDBHSA-N 0 3 423.340 4.084 20 0 HIADHN COc1ccc(CNC(=O)C2CCN(Cc3ccc4c(c3)CCC(C)(C)O4)CC2)cc1 ZINC000512710533 921293561 /nfs/dbraw/zinc/29/35/61/921293561.db2.gz UVILOTHQRLQTIR-UHFFFAOYSA-N 0 3 422.569 4.327 20 0 HIADHN Cc1ccc(-c2nc(C(=O)NCCCCN3CCN(c4ccccc4)CC3)cs2)o1 ZINC000512720299 921296063 /nfs/dbraw/zinc/29/60/63/921296063.db2.gz KAKKOAHPZCVQFZ-UHFFFAOYSA-N 0 3 424.570 4.044 20 0 HIADHN CC(C)Cn1ncc(NC(=O)NCC(C)(C)N2CCc3ccccc3C2)c1C1CC1 ZINC000497662445 907154098 /nfs/dbraw/zinc/15/40/98/907154098.db2.gz OETXDJFXHIBLHP-UHFFFAOYSA-N 0 3 409.578 4.375 20 0 HIADHN COc1cccc(C[C@@H](C)NC(=O)N(CCN(C)C)Cc2cccc(Cl)c2)c1 ZINC000497696732 907202669 /nfs/dbraw/zinc/20/26/69/907202669.db2.gz MVZNBTMAPYYWGU-QGZVFWFLSA-N 0 3 403.954 4.053 20 0 HIADHN Brc1cccc(-c2ccc(CN[C@H]3CCCN(c4ncccn4)C3)o2)c1 ZINC000512795624 921312765 /nfs/dbraw/zinc/31/27/65/921312765.db2.gz XETPMXXYGKRFBZ-KRWDZBQOSA-N 0 3 413.319 4.258 20 0 HIADHN C[C@H](NC(=O)N[C@H](CN(C)C)c1ccc(Cl)cc1)c1nccn1-c1ccccc1 ZINC000512798183 921313315 /nfs/dbraw/zinc/31/33/15/921313315.db2.gz RTXYVZPOYACSOC-OXJNMPFZSA-N 0 3 411.937 4.189 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)N[C@H](C)[C@H](OC)c2ccc(Cl)cc2)cc1 ZINC000497847806 907328175 /nfs/dbraw/zinc/32/81/75/907328175.db2.gz QEXMPQXLKVPPEE-NQERJWCQSA-N 0 3 419.953 4.027 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)N[C@@H](C)[C@@H](OC)c2ccc(Cl)cc2)cc1 ZINC000497847807 907329920 /nfs/dbraw/zinc/32/99/20/907329920.db2.gz QEXMPQXLKVPPEE-ONGXBYRLSA-N 0 3 419.953 4.027 20 0 HIADHN Cc1c(NCC(C)(C)C)cccc1C(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1CO ZINC000497888353 907362052 /nfs/dbraw/zinc/36/20/52/907362052.db2.gz IIRLZABNURCJEG-ZJSXRUAMSA-N 0 3 423.601 4.066 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)c(C)c1CNC[C@H]1CN(Cc2ccccc2)CCO1 ZINC000512813826 921318745 /nfs/dbraw/zinc/31/87/45/921318745.db2.gz ARJYEIYUZUAWOR-QHCPKHFHSA-N 0 3 424.976 4.133 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)[C@H]3CCCc4ccccc43)CC2)c1 ZINC000497937277 907401461 /nfs/dbraw/zinc/40/14/61/907401461.db2.gz LEEYNSKDWGJKHP-VWLOTQADSA-N 0 3 405.586 4.134 20 0 HIADHN CCN(C(=O)c1ccc(N2CCCC2=O)cc1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000497966876 907435418 /nfs/dbraw/zinc/43/54/18/907435418.db2.gz SAVYVEQXZHRHRC-AUSIDOKSSA-N 0 3 405.542 4.111 20 0 HIADHN Cc1ccc(-c2nc3cc(F)ccc3n2C)cc1NC(=O)N[C@@H](C)C1=CCN(C)CC1 ZINC000512821929 921325768 /nfs/dbraw/zinc/32/57/68/921325768.db2.gz SPRGIXGYHMGRLZ-INIZCTEOSA-N 0 3 421.520 4.460 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)N2CCC[C@@H](C(F)(F)F)[C@@H]2C)N(C)C)cc1 ZINC000512825271 921328872 /nfs/dbraw/zinc/32/88/72/921328872.db2.gz DBSJGGNQTANIFP-IPELMVKDSA-N 0 3 415.500 4.449 20 0 HIADHN O=C(NCCCN1CCN(Cc2ccccc2)CC1)c1cc(F)c(Cl)cc1Cl ZINC000498100100 907608702 /nfs/dbraw/zinc/60/87/02/907608702.db2.gz BUAVSIWHVFRRPS-UHFFFAOYSA-N 0 3 424.347 4.070 20 0 HIADHN CCC(CC)[C@@H]1C[C@@H](NC(=O)NC[C@H](c2cccc(OC)c2)N2CCCC2)CCO1 ZINC000498116902 907627951 /nfs/dbraw/zinc/62/79/51/907627951.db2.gz HBUTYNDPLCHXEG-WWNPGLIZSA-N 0 3 417.594 4.115 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)c2c[nH]c3ccc(Br)cc23)o1 ZINC000498220535 907748989 /nfs/dbraw/zinc/74/89/89/907748989.db2.gz YXWBEYQNYONPMB-UHFFFAOYSA-N 0 3 404.308 4.036 20 0 HIADHN Cc1cccc([C@@H](NC(=O)NC[C@H](C)N(C)Cc2ccccc2)c2ccccn2)c1 ZINC000498237949 907771661 /nfs/dbraw/zinc/77/16/61/907771661.db2.gz HHLPZPNKPVAJBD-GBXCKJPGSA-N 0 3 402.542 4.299 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)NCCc2csc(C(C)(C)C)n2)C1 ZINC000498240850 907775242 /nfs/dbraw/zinc/77/52/42/907775242.db2.gz WQIJLWFKFYUTJA-FUHWJXTLSA-N 0 3 400.592 4.118 20 0 HIADHN Brc1ccc(-n2cc(CNCc3ccccc3Cn3ccnc3)cn2)cc1 ZINC000512847642 921352085 /nfs/dbraw/zinc/35/20/85/921352085.db2.gz YBUVYCMDLHYLBJ-UHFFFAOYSA-N 0 3 422.330 4.169 20 0 HIADHN COc1ccc(C(=O)CCCC(=O)NC2CCN([C@@H](C)c3ccccc3)CC2)cc1 ZINC000498345697 907850642 /nfs/dbraw/zinc/85/06/42/907850642.db2.gz NVOYWKYWLRIKFB-IBGZPJMESA-N 0 3 408.542 4.390 20 0 HIADHN CC[C@@H](NCc1ccc(OCc2ccc(F)cc2)c(OC)c1)[C@H](O)C(F)(F)F ZINC000498353208 907853672 /nfs/dbraw/zinc/85/36/72/907853672.db2.gz LQTPQMJPJACDGT-APWZRJJASA-N 0 3 401.400 4.205 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)Cc3cc(Cl)ccc3Cl)cc2)CC1 ZINC000498371658 907862539 /nfs/dbraw/zinc/86/25/39/907862539.db2.gz FDINXCSRZNRSED-UHFFFAOYSA-N 0 3 406.357 4.312 20 0 HIADHN CCN(CC)[C@H](CNC(=O)COc1cccc(Br)c1)c1ccsc1 ZINC000498376462 907866330 /nfs/dbraw/zinc/86/63/30/907866330.db2.gz YSRGJNPPXIQKCP-QGZVFWFLSA-N 0 3 411.365 4.089 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)N[C@@H]2COc3c2ccc(Cl)c3Cl)cc1 ZINC000498412502 907888845 /nfs/dbraw/zinc/88/88/45/907888845.db2.gz AWWKSTICAWNNBI-IAGOWNOFSA-N 0 3 424.328 4.038 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)c2ccc(Oc3cccc(Cl)c3)cc2)CC1 ZINC000498422321 907894824 /nfs/dbraw/zinc/89/48/24/907894824.db2.gz IXAIYBZNEMXUCM-SFHVURJKSA-N 0 3 415.965 4.136 20 0 HIADHN Cc1cc(C(=O)NC2CCN(CCOc3ccc(Cl)cc3)CC2)c(C)n1C1CC1 ZINC000498528421 907998233 /nfs/dbraw/zinc/99/82/33/907998233.db2.gz UJWGIZPNSACGAO-UHFFFAOYSA-N 0 3 415.965 4.366 20 0 HIADHN COc1ccc([C@@H](NC(=O)N2CCCN(C)CC2)c2ccc(C(F)(F)F)cc2)cc1 ZINC000498678314 908109776 /nfs/dbraw/zinc/10/97/76/908109776.db2.gz COHFQGCSZPVGAW-FQEVSTJZSA-N 0 3 421.463 4.151 20 0 HIADHN C[C@@H]1CCN(C)CCN1C(=O)c1cc(-c2ccc(F)cc2)nc2onc(C3CC3)c21 ZINC000498709465 908134886 /nfs/dbraw/zinc/13/48/86/908134886.db2.gz JMEKIIBBCOKWCQ-CQSZACIVSA-N 0 3 408.477 4.073 20 0 HIADHN C[C@H]1CCN(C)CCN1C(=O)c1ccc(Oc2cccc(Br)c2)cc1 ZINC000498710574 908136933 /nfs/dbraw/zinc/13/69/33/908136933.db2.gz PRJVURMMXNTAHK-HNNXBMFYSA-N 0 3 403.320 4.408 20 0 HIADHN C[C@H]1CCN(C)CCN1C(=O)[C@@](C)(Cc1nc2ccccc2s1)c1ccccc1 ZINC000498717201 908141823 /nfs/dbraw/zinc/14/18/23/908141823.db2.gz RFGXAIPMSRFHPQ-UUOWRZLLSA-N 0 3 407.583 4.349 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N[C@H](C)c1nc(C2CCCCC2)no1)c1ccco1 ZINC000498733499 908163243 /nfs/dbraw/zinc/16/32/43/908163243.db2.gz YDQFNTQWBCZACZ-ZMSDIMECSA-N 0 3 403.527 4.200 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)N[C@H]2CCCOc3c(F)cccc32)CC1 ZINC000498828553 908236450 /nfs/dbraw/zinc/23/64/50/908236450.db2.gz BLDSEDKKSLYJGQ-QFIPXVFZSA-N 0 3 411.521 4.345 20 0 HIADHN CC(C)c1ccccc1NC(=O)N1CCC[C@H](CN2CCN(c3ccccn3)CC2)C1 ZINC000498844870 908250072 /nfs/dbraw/zinc/25/00/72/908250072.db2.gz RLJAQKCKZGNJGL-OAQYLSRUSA-N 0 3 421.589 4.271 20 0 HIADHN C[C@H](NC(=O)[C@H](C)N1CCC[C@@H](c2nc(C3CC3)n[nH]2)C1)c1ccc2c(c1)CCCC2 ZINC000498903828 908312426 /nfs/dbraw/zinc/31/24/26/908312426.db2.gz DCUBRDHHLPCUAT-PNLZDCPESA-N 0 3 421.589 4.006 20 0 HIADHN C[C@H](NC(=O)[C@H](C)N1CCC[C@@H](c2n[nH]c(C3CC3)n2)C1)c1ccc2c(c1)CCCC2 ZINC000498903828 908312435 /nfs/dbraw/zinc/31/24/35/908312435.db2.gz DCUBRDHHLPCUAT-PNLZDCPESA-N 0 3 421.589 4.006 20 0 HIADHN CC(=O)CCc1ccc(O[C@H](C)C(=O)NC[C@H]2CCCCN2Cc2ccccc2)cc1 ZINC000498919956 908329612 /nfs/dbraw/zinc/32/96/12/908329612.db2.gz VHLQRHJDZPSDFZ-ZJSXRUAMSA-N 0 3 422.569 4.146 20 0 HIADHN Cc1cncc(CCC(=O)N[C@H](c2ccc(F)c(F)c2)C(C)(C)N2CCCC2)c1 ZINC000498934160 908341950 /nfs/dbraw/zinc/34/19/50/908341950.db2.gz IDNMVDQFBBLSIL-JOCHJYFZSA-N 0 3 401.501 4.333 20 0 HIADHN CCN1C[C@@H](C)N(Cc2csc(N(C(C)=O)c3ccc(C)c(C)c3)n2)C[C@H]1C ZINC000498939563 908345621 /nfs/dbraw/zinc/34/56/21/908345621.db2.gz WATMLRRGRGXKHJ-QZTJIDSGSA-N 0 3 400.592 4.359 20 0 HIADHN Cc1cccc([C@H](NC(=O)N(Cc2ccco2)C2CCN(C)CC2)c2ccccn2)c1 ZINC000499012538 908389038 /nfs/dbraw/zinc/38/90/38/908389038.db2.gz VUGKFPDQELHHMG-DEOSSOPVSA-N 0 3 418.541 4.378 20 0 HIADHN COc1ccc(C[C@@H](NCC(=O)Nc2ccccc2OC)c2ccc(OC)cc2)cc1 ZINC000499055209 908425394 /nfs/dbraw/zinc/42/53/94/908425394.db2.gz VNNROILOTYTAOS-HSZRJFAPSA-N 0 3 420.509 4.225 20 0 HIADHN COc1ccc(C[C@@H](N[C@H](C)C(=O)NCc2ccccc2)c2ccc(OC)cc2)cc1 ZINC000499068982 908434737 /nfs/dbraw/zinc/43/47/37/908434737.db2.gz KDATYEPDPTWRKA-KBMIEXCESA-N 0 3 418.537 4.282 20 0 HIADHN COc1ccc(C[C@H](N[C@@H](C)C(=O)NCc2ccccc2)c2ccc(OC)cc2)cc1 ZINC000499068981 908434864 /nfs/dbraw/zinc/43/48/64/908434864.db2.gz KDATYEPDPTWRKA-DFBJGRDBSA-N 0 3 418.537 4.282 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)N(C)CCc2ccc(F)cc2)N(C)C)cc1 ZINC000512916084 921410597 /nfs/dbraw/zinc/41/05/97/921410597.db2.gz ARUIMIZDBFREBK-QFIPXVFZSA-N 0 3 401.526 4.100 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)N(C)[C@@H](C)Cc2ccc(O)cc2)N(C)C)cc1 ZINC000512916612 921410813 /nfs/dbraw/zinc/41/08/13/921410813.db2.gz DXDKNMYGDWZLPI-FDDCHVKYSA-N 0 3 413.562 4.055 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N2CCC[C@@H]2[C@@H]2C[C@@H](C)CC[C@@H]2O)N2CCCC2)cc1 ZINC000499140494 908496931 /nfs/dbraw/zinc/49/69/31/908496931.db2.gz HKDSSGICGSQABI-PJKILVJMSA-N 0 3 413.606 4.103 20 0 HIADHN Cc1noc(CSc2ccc(C(=O)NC[C@H](c3ccc(C)cc3)N(C)C)cc2)n1 ZINC000499147251 908506024 /nfs/dbraw/zinc/50/60/24/908506024.db2.gz ANIWNCZZMFDFPH-HXUWFJFHSA-N 0 3 410.543 4.011 20 0 HIADHN Cc1ccc(C[C@H]2CCCN2C(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)cc1 ZINC000499200225 908555047 /nfs/dbraw/zinc/55/50/47/908555047.db2.gz BHICFRRTEVVDMS-RUZDIDTESA-N 0 3 405.586 4.373 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)NC(=O)N[C@@H]2CCN(Cc3ccccc3)[C@H]2C)cc1 ZINC000499318171 908691663 /nfs/dbraw/zinc/69/16/63/908691663.db2.gz TUJKGVWNEUBKCV-AXHZCLLHSA-N 0 3 417.557 4.204 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)NCCc1csc(C(C)(C)C)n1 ZINC000499337739 908710616 /nfs/dbraw/zinc/71/06/16/908710616.db2.gz PXAAPWOXFYOACM-UHFFFAOYSA-N 0 3 424.561 4.035 20 0 HIADHN COc1ccc(C(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)cc1Br ZINC000499402027 908765457 /nfs/dbraw/zinc/76/54/57/908765457.db2.gz ZOTOYCMTDNTGSG-IBGZPJMESA-N 0 3 417.347 4.333 20 0 HIADHN O=C(NC1CCN(Cc2ccccc2)CC1)c1csc(CCc2ccccc2)n1 ZINC000499525369 908828745 /nfs/dbraw/zinc/82/87/45/908828745.db2.gz ZXRRLCHCZRLJJD-UHFFFAOYSA-N 0 3 405.567 4.323 20 0 HIADHN Cc1c(NC(=O)Nc2ccc(CCN3CCSCC3)cc2)cnn1CC(C)C ZINC000499567922 908842927 /nfs/dbraw/zinc/84/29/27/908842927.db2.gz HYMCPCXUMGDFSY-UHFFFAOYSA-N 0 3 401.580 4.083 20 0 HIADHN Cc1nn2c(CNCCOc3ncc(Cl)cc3Cl)c(C(C)C)nc2s1 ZINC000499706514 908883560 /nfs/dbraw/zinc/88/35/60/908883560.db2.gz OKYRZUCPEBOHGO-UHFFFAOYSA-N 0 3 400.335 4.093 20 0 HIADHN C[C@@H](CN1CCC[C@H](C)C1)NC(=O)c1oc2ccccc2c1CSc1ncccn1 ZINC000499725471 908892028 /nfs/dbraw/zinc/89/20/28/908892028.db2.gz AGGPKKKRTDWFDH-IRXDYDNUSA-N 0 3 424.570 4.365 20 0 HIADHN COc1ccccc1-c1csc([C@@H]2CCCN(C[C@](C)(O)C(F)(F)F)C2)n1 ZINC000499732996 908893799 /nfs/dbraw/zinc/89/37/99/908893799.db2.gz JFNAJAYSGPVDKG-ACJLOTCBSA-N 0 3 400.466 4.311 20 0 HIADHN CCOc1cc2c(cc1[C@@H]1C[C@@H]1C(=O)N(CCN(C)C)Cc1ccccc1)O[C@H](C)C2 ZINC000499936975 909045132 /nfs/dbraw/zinc/04/51/32/909045132.db2.gz QZTWPDNPUCYOJV-JZWVFAODSA-N 0 3 422.569 4.103 20 0 HIADHN O=C(c1cccc([C@H]2CCCOC2)c1)N1CCCN(CCCc2ccccc2)CC1 ZINC000499950029 909054369 /nfs/dbraw/zinc/05/43/69/909054369.db2.gz YPSIXOSFBZCSOJ-VWLOTQADSA-N 0 3 406.570 4.361 20 0 HIADHN C[C@H](NCc1cc(Br)c2c(c1)OCCCO2)c1ccc2n[nH]cc2c1 ZINC000513031115 921489981 /nfs/dbraw/zinc/48/99/81/921489981.db2.gz BSJFLHHJCMGSJB-LBPRGKRZSA-N 0 3 402.292 4.338 20 0 HIADHN CC(C)Cn1ncc(NC(=O)NCC2(N3CCSCC3)CCCC2)c1C(C)C ZINC000500004536 909452995 /nfs/dbraw/zinc/45/29/95/909452995.db2.gz ZMZUUPVOYOCXRG-UHFFFAOYSA-N 0 3 407.628 4.146 20 0 HIADHN CC(C)Cn1ncc(NC(=O)N2CCC(CN3C[C@H](C)O[C@@H](C)C3)CC2)c1C(C)C ZINC000500006877 909457654 /nfs/dbraw/zinc/45/76/54/909457654.db2.gz UKTWLBOVFUUMAF-OALUTQOASA-N 0 3 419.614 4.016 20 0 HIADHN CCOCc1cc(CN2CCC(C(=O)Nc3cccc(F)c3)CC2)ccc1OC ZINC000513037568 921496825 /nfs/dbraw/zinc/49/68/25/921496825.db2.gz SWXDSSQRIASQDN-UHFFFAOYSA-N 0 3 400.494 4.222 20 0 HIADHN CCN(C(=O)c1cccc(NC(=O)C2CC2)c1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000500010785 909465477 /nfs/dbraw/zinc/46/54/77/909465477.db2.gz UYHRYBOSESUZRF-WZONZLPQSA-N 0 3 405.542 4.333 20 0 HIADHN Cc1ccc(C(C)C)c(O[C@@H](C)C(=O)N(C)C2CCN(CCc3ccccn3)CC2)c1 ZINC000500027071 909483932 /nfs/dbraw/zinc/48/39/32/909483932.db2.gz RIFYNJXIXKAXGL-NRFANRHFSA-N 0 3 423.601 4.446 20 0 HIADHN CC(C)[C@H]1CC[C@@H](C)C[C@H]1OCC(=O)N(C)C1CCN(CCc2ccccn2)CC1 ZINC000500063103 909530685 /nfs/dbraw/zinc/53/06/85/909530685.db2.gz LZZSZDYPRSCMPQ-AGILITTLSA-N 0 3 415.622 4.024 20 0 HIADHN C/C=C\c1ccc(NC(=O)C(=O)Nc2cc(C)cc(N3CCN(C(C)C)CC3)c2)cc1 ZINC000500369889 909818497 /nfs/dbraw/zinc/81/84/97/909818497.db2.gz XENUBYVXXOKHKC-WAYWQWQTSA-N 0 3 420.557 4.136 20 0 HIADHN C[C@H](NC(=O)N[C@H](CN1CCCC1)c1ccccc1)c1ccccc1OC(F)F ZINC000500381760 909826579 /nfs/dbraw/zinc/82/65/79/909826579.db2.gz GFLTYJGQGZIDCX-QFBILLFUSA-N 0 3 403.473 4.485 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)c2cnc3onc(C(C)(C)C)c3c2)cc1 ZINC000500392640 909831884 /nfs/dbraw/zinc/83/18/84/909831884.db2.gz XFLQRQDUQDNZDF-HXUWFJFHSA-N 0 3 422.529 4.096 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)CCCc2ccc(F)c(F)c2)cc1 ZINC000500410074 909842437 /nfs/dbraw/zinc/84/24/37/909842437.db2.gz OJVUDCYNVKCBAZ-JOCHJYFZSA-N 0 3 402.485 4.249 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)c2cccc(Oc3ccncc3)c2)cc1 ZINC000500412401 909844216 /nfs/dbraw/zinc/84/42/16/909844216.db2.gz YSMQJWDXQLWFDN-DEOSSOPVSA-N 0 3 417.509 4.449 20 0 HIADHN COc1cc(C(C)=O)ccc1OC[C@H](O)CNC1(c2ccc(Cl)c(Cl)c2)CC1 ZINC000500457907 909870202 /nfs/dbraw/zinc/87/02/02/909870202.db2.gz RJVKDVPDCVREFY-MRXNPFEDSA-N 0 3 424.324 4.223 20 0 HIADHN COc1ccccc1[C@H](NC(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C)c1ccccn1 ZINC000500525024 909908329 /nfs/dbraw/zinc/90/83/29/909908329.db2.gz IVQGYGHVZPSOAB-NWVWQQAFSA-N 0 3 418.541 4.170 20 0 HIADHN CN(C)[C@H](CNC(=O)CSc1ncc(C(F)(F)F)cc1Cl)c1ccccc1 ZINC000500566697 909933074 /nfs/dbraw/zinc/93/30/74/909933074.db2.gz CNKLFKRAIXKDSY-OAHLLOKOSA-N 0 3 417.884 4.265 20 0 HIADHN CCc1nnc(NC(=O)[C@@H](C)[C@H](C)NCc2cc(Cl)cc(Cl)c2OC)s1 ZINC000513089853 921539738 /nfs/dbraw/zinc/53/97/38/921539738.db2.gz PTEOMOFPVDBZER-UWVGGRQHSA-N 0 3 417.362 4.169 20 0 HIADHN CCN1CCN(Cc2ccc(CNC(=O)Nc3cc(Cl)ccc3Cl)cc2)CC1 ZINC000500623031 909972828 /nfs/dbraw/zinc/97/28/28/909972828.db2.gz XNWWRQJBABRMCF-UHFFFAOYSA-N 0 3 421.372 4.453 20 0 HIADHN O=C(NC[C@@H]1CCCN(Cc2c[nH]nc2-c2cccc(Cl)c2)C1)c1ccccc1 ZINC000513088170 921538105 /nfs/dbraw/zinc/53/81/05/921538105.db2.gz FTHPIMRRVDFHFF-KRWDZBQOSA-N 0 3 408.933 4.372 20 0 HIADHN Cc1ccc(OCCC(=O)N(CC(C)C)C2CCN(C)CC2)c(Br)c1 ZINC000500668865 910008151 /nfs/dbraw/zinc/00/81/51/910008151.db2.gz PWQARPGCBKSRPI-UHFFFAOYSA-N 0 3 411.384 4.105 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)c2csc(CCc3ccccc3)n2)c1 ZINC000500685429 910021664 /nfs/dbraw/zinc/02/16/64/910021664.db2.gz IYFZLQLTRSKPLD-UHFFFAOYSA-N 0 3 407.583 4.441 20 0 HIADHN C[C@@H](Sc1cc(Cl)ccc1Cl)C(=O)N(CCN(C)C)Cc1ccccn1 ZINC000500762269 910065365 /nfs/dbraw/zinc/06/53/65/910065365.db2.gz NMGGIPIXXPFAMW-CQSZACIVSA-N 0 3 412.386 4.459 20 0 HIADHN CN(C(=O)c1cc(-c2cccc(Cl)c2)no1)C1CCN(CCc2ccccn2)CC1 ZINC000500765890 910067382 /nfs/dbraw/zinc/06/73/82/910067382.db2.gz OUTIFAMMVUHECU-UHFFFAOYSA-N 0 3 424.932 4.169 20 0 HIADHN Cc1cc(C)n(Cc2cccc(C(=O)N[C@@H]3CCN([C@@H](C)c4ccccc4)C3)c2)n1 ZINC000500838111 910114454 /nfs/dbraw/zinc/11/44/54/910114454.db2.gz AIZGEHNJDLZKDF-GBXCKJPGSA-N 0 3 402.542 4.114 20 0 HIADHN C[C@H]1C[C@H](NC(=O)c2ccc(-c3noc(C(F)F)n3)cc2)CN1Cc1ccccc1 ZINC000500855038 910128471 /nfs/dbraw/zinc/12/84/71/910128471.db2.gz CKMGOMJLEVLRRJ-KSSFIOAISA-N 0 3 412.440 4.067 20 0 HIADHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)[C@H]1Cc2ccccc2S1 ZINC000500956672 910206745 /nfs/dbraw/zinc/20/67/45/910206745.db2.gz XNUCTQBCQCIKGB-LJQANCHMSA-N 0 3 419.388 4.056 20 0 HIADHN CCOc1ccc(C(=O)N(CCN(C)C)Cc2ccc(Br)cc2)cc1 ZINC000500963826 910209918 /nfs/dbraw/zinc/20/99/18/910209918.db2.gz JCMVQKBVLVWAAT-UHFFFAOYSA-N 0 3 405.336 4.052 20 0 HIADHN CN(C)[C@H](CNC(=O)NC[C@@H](c1cccc(Cl)c1)N1CCCC1)c1ccsc1 ZINC000501027527 910244387 /nfs/dbraw/zinc/24/43/87/910244387.db2.gz ZVSXYUOTPCZQSP-UXHICEINSA-N 0 3 421.010 4.141 20 0 HIADHN CN(C)[C@@H](CNC(=O)NC[C@H](c1cccc(Cl)c1)N1CCCC1)c1ccsc1 ZINC000501027528 910244602 /nfs/dbraw/zinc/24/46/02/910244602.db2.gz ZVSXYUOTPCZQSP-VQTJNVASSA-N 0 3 421.010 4.141 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1ccc2oc(C(=O)OC)cc2c1)c1ccsc1 ZINC000501076708 910277298 /nfs/dbraw/zinc/27/72/98/910277298.db2.gz GPLXXJWKEMZJMW-QGZVFWFLSA-N 0 3 415.515 4.486 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)N[C@H](c2cccc(C)c2)c2ccccn2)cc1 ZINC000501089070 910286962 /nfs/dbraw/zinc/28/69/62/910286962.db2.gz POSURSGADQUUKS-DNQXCXABSA-N 0 3 418.541 4.090 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(C(F)(F)F)cc2)CC1)c1ccc(F)cc1 ZINC000501299818 910455703 /nfs/dbraw/zinc/45/57/03/910455703.db2.gz DMZIYQBRINJTFY-UHFFFAOYSA-N 0 3 410.411 4.118 20 0 HIADHN CC(C)c1ccc(C[C@H](C)NC(=O)N(C)C2CCN(CCc3ccccn3)CC2)cc1 ZINC000501334663 910474769 /nfs/dbraw/zinc/47/47/69/910474769.db2.gz TUOLQZQXFSKABV-NRFANRHFSA-N 0 3 422.617 4.485 20 0 HIADHN COC(=O)c1cc2cc(CN(C)[C@H](CO)c3cccc(Br)c3)ccc2o1 ZINC000501415451 910546762 /nfs/dbraw/zinc/54/67/62/910546762.db2.gz DTXDSAHHXIGLMR-QGZVFWFLSA-N 0 3 418.287 4.147 20 0 HIADHN COc1ccc(SCC(=O)Nc2ccc(CCN3CCSCC3)cc2)cc1 ZINC000501437869 910567217 /nfs/dbraw/zinc/56/72/17/910567217.db2.gz YAMWRJAUMHDDTL-UHFFFAOYSA-N 0 3 402.585 4.017 20 0 HIADHN CNS(=O)(=O)c1cccc([C@H](C)NC/C(C)=C\c2ccccc2C(F)(F)F)c1 ZINC000501456344 910582097 /nfs/dbraw/zinc/58/20/97/910582097.db2.gz UGJQCCWMCGRURU-SZGZABIGSA-N 0 3 412.477 4.368 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1cnn(CC(C)C)c1C ZINC000501520918 910631602 /nfs/dbraw/zinc/63/16/02/910631602.db2.gz URQCDYZVAPPPKS-NRFANRHFSA-N 0 3 420.561 4.052 20 0 HIADHN FC(F)(F)C(F)(F)COCCN[C@@H]1CCOc2c(Br)cccc21 ZINC000501531654 910641022 /nfs/dbraw/zinc/64/10/22/910641022.db2.gz LYOXUQVNKSDXKW-LLVKDONJSA-N 0 3 404.173 4.077 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)Cc2ccc(OCc3ccccn3)cc2)C1 ZINC000501677705 910752375 /nfs/dbraw/zinc/75/23/75/910752375.db2.gz GYYUJYGFNGXGRR-REWPJTCUSA-N 0 3 415.537 4.155 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)Cc3csc(-c4ccc(C)o4)n3)cc2)CC1 ZINC000513186591 921609297 /nfs/dbraw/zinc/60/92/97/921609297.db2.gz LMNWPAFDDJDIOY-UHFFFAOYSA-N 0 3 424.570 4.030 20 0 HIADHN COCc1cccc(CN2CCC[C@H](c3n[nH]cc3NC(=O)c3ccccc3)C2)c1 ZINC000501714818 910783891 /nfs/dbraw/zinc/78/38/91/910783891.db2.gz FCICTVGQEDZMII-NRFANRHFSA-N 0 3 404.514 4.188 20 0 HIADHN CN(Cc1ccc(Br)s1)C(=O)NCCCN1CCc2ccccc2C1 ZINC000501716567 910785340 /nfs/dbraw/zinc/78/53/40/910785340.db2.gz KSQJCYPNNNUHRV-UHFFFAOYSA-N 0 3 422.392 4.100 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)N1CCC[C@H]1c1ccc2c(c1)OCCO2 ZINC000501801627 910852338 /nfs/dbraw/zinc/85/23/38/910852338.db2.gz FVNOOBGJVCMZKG-YADHBBJMSA-N 0 3 421.541 4.141 20 0 HIADHN O=C(Nc1cccc(N2CCCCC2=O)c1)N[C@H](CN1CCCC1)c1ccccc1 ZINC000501823667 910869524 /nfs/dbraw/zinc/86/95/24/910869524.db2.gz GEIVTYDHFRLWJX-JOCHJYFZSA-N 0 3 406.530 4.162 20 0 HIADHN COc1ccc([C@H]2CCCN2C(=O)N[C@H](CN2CCCC2)c2ccccc2)cc1OC ZINC000501831861 910873543 /nfs/dbraw/zinc/87/35/43/910873543.db2.gz PFXQYBDDDYNIDF-FGZHOGPDSA-N 0 3 423.557 4.387 20 0 HIADHN COc1ccc([C@H]2CCCN2C(=O)N[C@@H](CN2CCCC2)c2ccccc2)cc1OC ZINC000501831860 910873819 /nfs/dbraw/zinc/87/38/19/910873819.db2.gz PFXQYBDDDYNIDF-FCHUYYIVSA-N 0 3 423.557 4.387 20 0 HIADHN Cc1ccc(C(C)C)c(OCCC(=O)N2CCC(CN3C[C@@H](C)O[C@H](C)C3)CC2)c1 ZINC000501852858 910885881 /nfs/dbraw/zinc/88/58/81/910885881.db2.gz SBGICMUWMCQUCK-NHCUHLMSSA-N 0 3 416.606 4.235 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N3CCC[C@@H]3Cc3ccc(F)cc3)cc2)CC1 ZINC000501884000 910902575 /nfs/dbraw/zinc/90/25/75/910902575.db2.gz VNYRRGXVLXNJBT-XMMPIXPASA-N 0 3 409.549 4.203 20 0 HIADHN C[C@@H]1[C@H](NC(=O)N[C@H]2CCCc3cn(C4CCCC4)nc32)CCN1Cc1ccccc1 ZINC000501921291 910919181 /nfs/dbraw/zinc/91/91/81/910919181.db2.gz ZCBXXWQZKQRTDL-YSZBQJHXSA-N 0 3 421.589 4.338 20 0 HIADHN CCN(C(=O)c1cc2c(c(Cl)c1)OCO2)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000501953067 910939901 /nfs/dbraw/zinc/93/99/01/910939901.db2.gz BNRQIBMRQJHYGF-CRAIPNDOSA-N 0 3 400.906 4.366 20 0 HIADHN CCN(C(=O)c1ccc(-n2nc(C)cc2C)nc1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000501955971 910944070 /nfs/dbraw/zinc/94/40/70/910944070.db2.gz IBGPLQUSQZXESN-NFBKMPQASA-N 0 3 417.557 4.182 20 0 HIADHN CCN(C(=O)c1cnc2c(cnn2CC(C)C)c1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000501962428 910950465 /nfs/dbraw/zinc/95/04/65/910950465.db2.gz PQIDTUPUFQCUES-XXBNENTESA-N 0 3 419.573 4.385 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)[C@@H]1C[C@H]1c1cccc(Cl)c1 ZINC000502030214 910987668 /nfs/dbraw/zinc/98/76/68/910987668.db2.gz GCRBBAVOMJDTOJ-XZOQPEGZSA-N 0 3 411.977 4.162 20 0 HIADHN C[C@@H](NC[C@H]1CN(C(=O)c2ccccc2)[C@H]2CCN1C2)c1ccc(Cl)cc1Cl ZINC000502035700 910992094 /nfs/dbraw/zinc/99/20/94/910992094.db2.gz LKPNBXFFMIBTFS-MNEFBYGVSA-N 0 3 418.368 4.243 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)c1ccc(F)c(C(F)(F)F)c1 ZINC000502059193 911008398 /nfs/dbraw/zinc/00/83/98/911008398.db2.gz BOPAROLOGPVAOK-UHFFFAOYSA-N 0 3 423.454 4.177 20 0 HIADHN COc1cccc(C2=CCN(C(=O)c3ccc(N4CCN(C(C)C)CC4)cc3)CC2)c1 ZINC000502063151 911009951 /nfs/dbraw/zinc/00/99/51/911009951.db2.gz KZUIIOIPTBXMEE-UHFFFAOYSA-N 0 3 419.569 4.155 20 0 HIADHN CCOc1ccc(NC(=O)CN[C@@]2(Cc3ccc(C(F)(F)F)cc3)CCOC2)cc1 ZINC000513210935 921628155 /nfs/dbraw/zinc/62/81/55/921628155.db2.gz TWOQDDSIOXFPKY-OAQYLSRUSA-N 0 3 422.447 4.034 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)c1cccc(OCc2cccnc2)c1 ZINC000513218029 921632998 /nfs/dbraw/zinc/63/29/98/921632998.db2.gz MVAIGEJBTUZBQX-QHCPKHFHSA-N 0 3 401.510 4.055 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CC[C@@H](c2ccccc2F)C1)c1cccc(OC)c1 ZINC000502176277 911099309 /nfs/dbraw/zinc/09/93/09/911099309.db2.gz YGVVMSCLBYMJFP-XXBNENTESA-N 0 3 413.537 4.416 20 0 HIADHN CN(C)C(=O)Nc1ccc(Cl)c(C(=O)N[C@H](CN2CCCC2)c2ccccc2)c1 ZINC000502224998 911172641 /nfs/dbraw/zinc/17/26/41/911172641.db2.gz FLIUOBVLVCRSJO-HXUWFJFHSA-N 0 3 414.937 4.000 20 0 HIADHN O=C(NC[C@H]1CCCN1Cc1ccccc1)c1ccc(NC(=O)c2ccccc2)cc1 ZINC000513225933 921640959 /nfs/dbraw/zinc/64/09/59/921640959.db2.gz FJJAPJNPKZPSHX-XMMPIXPASA-N 0 3 413.521 4.333 20 0 HIADHN COc1cccc([C@H](CNC(=O)C[C@@H](C)c2ccc(F)cc2F)N2CCCC2)c1 ZINC000502269640 911217980 /nfs/dbraw/zinc/21/79/80/911217980.db2.gz PIQXNKHSISCBEA-ZHRRBRCNSA-N 0 3 402.485 4.420 20 0 HIADHN CS(=O)(=O)c1ccc(F)c(CNC2CC(c3cccc(Br)c3)C2)c1 ZINC000502317377 911288651 /nfs/dbraw/zinc/28/86/51/911288651.db2.gz MTMDLXIDQBVMBG-UHFFFAOYSA-N 0 3 412.324 4.028 20 0 HIADHN C[C@H](NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1)c1ccc(OC(F)F)cc1 ZINC000502334663 911314900 /nfs/dbraw/zinc/31/49/00/911314900.db2.gz RQCFVBZMEOEBFX-LPHOPBHVSA-N 0 3 403.473 4.313 20 0 HIADHN C[C@H](CCc1cccc(C(F)(F)F)c1)NCc1cc(S(C)(=O)=O)ccc1F ZINC000502337809 911317886 /nfs/dbraw/zinc/31/78/86/911317886.db2.gz YDPJPCNBXATQLY-CYBMUJFWSA-N 0 3 403.441 4.359 20 0 HIADHN Cc1ccccc1NC(=O)CCN1CCC[C@@H](c2n[nH]cc2NC(=O)C2CCCC2)C1 ZINC000502363609 911348472 /nfs/dbraw/zinc/34/84/72/911348472.db2.gz WTYVGXGBYZSGTD-LJQANCHMSA-N 0 3 423.561 4.055 20 0 HIADHN C[C@@H](CC(=O)N(C)c1ccccc1)N[C@H]1CCOc2c(Br)cccc21 ZINC000502369809 911356148 /nfs/dbraw/zinc/35/61/48/911356148.db2.gz UJFJRAGWOARMFD-KSSFIOAISA-N 0 3 403.320 4.304 20 0 HIADHN CN(C)Cc1cccc(C(=O)N2CCN(C3c4ccccc4-c4ccccc43)CC2)c1 ZINC000502379789 911367958 /nfs/dbraw/zinc/36/79/58/911367958.db2.gz YBKYLXFFSYVGFW-UHFFFAOYSA-N 0 3 411.549 4.276 20 0 HIADHN COCc1cc(CNC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)ccc1F ZINC000502409978 911392067 /nfs/dbraw/zinc/39/20/67/911392067.db2.gz UIYCQTQTLSYBPN-NRFANRHFSA-N 0 3 424.438 4.043 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCC[C@H]1C[C@H](C)O)c1ccc(C(F)(F)F)cc1 ZINC000502468939 911461121 /nfs/dbraw/zinc/46/11/21/911461121.db2.gz AISGNKHSORPQOD-ZYSHUDEJSA-N 0 3 415.500 4.033 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)[C@@H](C)n1nc(C)cc1C)c1ccc(C(F)(F)F)cc1 ZINC000502506917 911511320 /nfs/dbraw/zinc/51/13/20/911511320.db2.gz LKBLRUZULUYANP-APWZRJJASA-N 0 3 410.484 4.279 20 0 HIADHN CC(C)[C@H](N[C@@H](C)C(=O)N[C@H](C)c1ccc2c(c1)OCCO2)c1ccc(F)cc1 ZINC000502507317 911511391 /nfs/dbraw/zinc/51/13/91/911511391.db2.gz GTICGSRJCZHNAI-VVBPWWLESA-N 0 3 400.494 4.150 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1ccc2c(c1)OCCO2)c1ccc(C(F)(F)F)cc1 ZINC000502509238 911513783 /nfs/dbraw/zinc/51/37/83/911513783.db2.gz UJBYYFJYNMOAAY-GOSISDBHSA-N 0 3 422.447 4.290 20 0 HIADHN FC(F)O[C@@H]1CCCC[C@H]1NCc1cc2c(cc1Br)OCCCO2 ZINC000502521099 911525088 /nfs/dbraw/zinc/52/50/88/911525088.db2.gz JREXGWWAGPNNIE-ZIAGYGMSSA-N 0 3 406.267 4.250 20 0 HIADHN COCC1(CN[C@@H](c2ccc(Cl)cc2)c2cccc(S(C)(=O)=O)c2)CCC1 ZINC000502531940 911537083 /nfs/dbraw/zinc/53/70/83/911537083.db2.gz UMCDDIVZLBHUSC-FQEVSTJZSA-N 0 3 407.963 4.239 20 0 HIADHN O=C(NCc1ccco1)c1cccc(CN[C@@]2(Cc3ccc(Cl)cc3)CCOC2)c1 ZINC000502533563 911539244 /nfs/dbraw/zinc/53/92/44/911539244.db2.gz ZNADCBIXYKCWJT-XMMPIXPASA-N 0 3 424.928 4.354 20 0 HIADHN O=C(CN[C@@]1(Cc2ccc(Cl)cc2)CCOC1)Nc1ccccc1C(F)(F)F ZINC000502601885 911608765 /nfs/dbraw/zinc/60/87/65/911608765.db2.gz RIPDQTYQDLZDJX-LJQANCHMSA-N 0 3 412.839 4.289 20 0 HIADHN COc1ccc(NC(=O)[C@H](N[C@@H](C)[C@@H]2CCCOC2)c2ccccc2)cc1Cl ZINC000502668489 911711061 /nfs/dbraw/zinc/71/10/61/911711061.db2.gz ZRLVNKKHZRAYQH-LUQKVYGDSA-N 0 3 402.922 4.433 20 0 HIADHN Cc1nccn1CCCCN(C)CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 ZINC000502693596 911731043 /nfs/dbraw/zinc/73/10/43/911731043.db2.gz JXMLIOMRIYKELD-UHFFFAOYSA-N 0 3 402.848 4.214 20 0 HIADHN COCCN1CCC(NC(=O)N[C@H](c2ccccc2C)[C@H]2CCC[C@@H](C)C2)CC1 ZINC000502811159 911827988 /nfs/dbraw/zinc/82/79/88/911827988.db2.gz BJXHOHDNBVIRAZ-RFWXGWTQSA-N 0 3 401.595 4.272 20 0 HIADHN O=C(CCC(=O)c1cccc(F)c1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000502816031 911831125 /nfs/dbraw/zinc/83/11/25/911831125.db2.gz FXTZHZZGRPNBGP-UHFFFAOYSA-N 0 3 400.519 4.019 20 0 HIADHN CCc1ccc(C(=O)CCC(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)cc1 ZINC000502856309 911864669 /nfs/dbraw/zinc/86/46/69/911864669.db2.gz MXEHYUREWCBQCO-UHFFFAOYSA-N 0 3 407.558 4.381 20 0 HIADHN CSc1ccc(O[C@H](C)C(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)cc1 ZINC000502881399 911882400 /nfs/dbraw/zinc/88/24/00/911882400.db2.gz RBOCDOKZNUBLHQ-GOSISDBHSA-N 0 3 413.587 4.345 20 0 HIADHN Cc1nccn1CCCCN1CCC[C@H]1c1ccc(I)cc1 ZINC000502889418 911885405 /nfs/dbraw/zinc/88/54/05/911885405.db2.gz WYUFBAOKCIQSPG-SFHVURJKSA-N 0 3 409.315 4.413 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)c1ccc([C@H]2CCCOC2)cc1 ZINC000502935195 911921205 /nfs/dbraw/zinc/92/12/05/911921205.db2.gz OXFAYYBDTUFKPN-QFIPXVFZSA-N 0 3 410.583 4.424 20 0 HIADHN CN(C)Cc1cccc(NC(=O)C2(c3ccc(Br)cc3)CCOCC2)c1 ZINC000513311966 921705057 /nfs/dbraw/zinc/70/50/57/921705057.db2.gz XXOFMNUAZWKXCV-UHFFFAOYSA-N 0 3 417.347 4.198 20 0 HIADHN CCN1CCN(CCCNC(=O)[C@@H](Oc2cccc(C(C)C)c2)c2ccccc2)CC1 ZINC000503022526 911994281 /nfs/dbraw/zinc/99/42/81/911994281.db2.gz SZOKXXKXTSCHID-VWLOTQADSA-N 0 3 423.601 4.074 20 0 HIADHN CCn1c2ccccc2c2cc(NC(=O)CN(C)CCCn3ccnc3C)ccc21 ZINC000503082781 912050753 /nfs/dbraw/zinc/05/07/53/912050753.db2.gz ZQNKBIAGFUYLMN-UHFFFAOYSA-N 0 3 403.530 4.280 20 0 HIADHN CN(C)Cc1cccc(NC(=O)N[C@@]2(Cc3ccc(C(F)(F)F)cc3)CCOC2)c1 ZINC000513329309 921716917 /nfs/dbraw/zinc/71/69/17/921716917.db2.gz MBXNKXZNTZWCLZ-OAQYLSRUSA-N 0 3 421.463 4.290 20 0 HIADHN O[C@H](CO[C@H]1CCCc2ccccc21)CN1CCC[C@H]1c1n[nH]c(-c2ccccc2)n1 ZINC000503161382 912129667 /nfs/dbraw/zinc/12/96/67/912129667.db2.gz UHYLLQPBJDSLGN-PMVMPFDFSA-N 0 3 418.541 4.064 20 0 HIADHN O[C@H](CO[C@H]1CCCc2ccccc21)C[N@@H+]1CCC[C@H]1c1nnc(-c2ccccc2)[n-]1 ZINC000503161382 912129678 /nfs/dbraw/zinc/12/96/78/912129678.db2.gz UHYLLQPBJDSLGN-PMVMPFDFSA-N 0 3 418.541 4.064 20 0 HIADHN O[C@H](CO[C@H]1CCCc2ccccc21)C[N@H+]1CCC[C@H]1c1nnc(-c2ccccc2)[n-]1 ZINC000503161382 912129695 /nfs/dbraw/zinc/12/96/95/912129695.db2.gz UHYLLQPBJDSLGN-PMVMPFDFSA-N 0 3 418.541 4.064 20 0 HIADHN O[C@@H](Cc1ccccc1C(F)(F)F)CN1CCC[C@@H]1c1nnc(-c2ccccc2)[nH]1 ZINC000503186726 912163191 /nfs/dbraw/zinc/16/31/91/912163191.db2.gz MPIHLISMHOWZTH-PKOBYXMFSA-N 0 3 416.447 4.231 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)Nc3nc4ccccc4s3)CC2)c1 ZINC000503214603 912197378 /nfs/dbraw/zinc/19/73/78/912197378.db2.gz GRUKAKWOVWTNPS-UHFFFAOYSA-N 0 3 423.586 4.329 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)N(C)[C@@H]3CCCC[C@H]3C)CC2)c1 ZINC000503217112 912198952 /nfs/dbraw/zinc/19/89/52/912198952.db2.gz NUJBYICKRZKFGF-FYYLOGMGSA-N 0 3 400.611 4.117 20 0 HIADHN Cc1cc(C(=O)NC(C)C)ccc1NC(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000506283035 914882882 /nfs/dbraw/zinc/88/28/82/914882882.db2.gz QHZQYZCCSWWOEA-WIYYLYMNSA-N 0 3 408.546 4.090 20 0 HIADHN COC(=O)c1cc2cc(NC(=O)N[C@@H]3CCN([C@@H](C)c4ccccc4)C3)ccc2o1 ZINC000506294896 914890325 /nfs/dbraw/zinc/89/03/25/914890325.db2.gz MYNSARXJYSSWGI-HNAYVOBHSA-N 0 3 407.470 4.176 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)N3CCC[C@@H](C[N@H+]4CCCC[C@H]4C)C3)cc2)cc(=O)[n-]1 ZINC000506314230 914907544 /nfs/dbraw/zinc/90/75/44/914907544.db2.gz JEIYVWRQTBRNBX-MJGOQNOKSA-N 0 3 423.561 4.276 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)N3CCC[C@@H](C[N@@H+]4CCCC[C@H]4C)C3)cc2)cc(=O)[n-]1 ZINC000506314230 914907567 /nfs/dbraw/zinc/90/75/67/914907567.db2.gz JEIYVWRQTBRNBX-MJGOQNOKSA-N 0 3 423.561 4.276 20 0 HIADHN Cc1noc(C)c1C(C)(C)NC(=O)NC[C@H](c1ccc(CC(C)C)cc1)N(C)C ZINC000513352283 921732583 /nfs/dbraw/zinc/73/25/83/921732583.db2.gz PGSZBHDDCRGJRX-HXUWFJFHSA-N 0 3 400.567 4.327 20 0 HIADHN Cc1nsc(NC2CC2)c1C(=O)Nc1cc(C)cc(N2CCN(C(C)C)CC2)c1 ZINC000506337535 914953389 /nfs/dbraw/zinc/95/33/89/914953389.db2.gz AYJVSSLKPLFPTC-UHFFFAOYSA-N 0 3 413.591 4.117 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)NC1CC(C(F)(F)F)C1 ZINC000513371688 921746237 /nfs/dbraw/zinc/74/62/37/921746237.db2.gz LWIFDOKKFOQSQD-UHFFFAOYSA-N 0 3 411.390 4.120 20 0 HIADHN Cc1c2ccc(F)cc2sc1C(=O)N(C)C[C@@]1(O)CCN(Cc2ccccc2)C1 ZINC000506511005 915135694 /nfs/dbraw/zinc/13/56/94/915135694.db2.gz IUVMQXMVMCLHEW-QHCPKHFHSA-N 0 3 412.530 4.058 20 0 HIADHN COc1ccc(Br)c(NC(=O)NC[C@@H](c2ccc(C)cc2)N(C)C)c1 ZINC000506529094 915171628 /nfs/dbraw/zinc/17/16/28/915171628.db2.gz GGFSRLXUZNOTSV-SFHVURJKSA-N 0 3 406.324 4.191 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)N1CCC(OC2CCCC2)CC1 ZINC000506536283 915180720 /nfs/dbraw/zinc/18/07/20/915180720.db2.gz YWGSUFPWZUVAHV-UHFFFAOYSA-N 0 3 417.619 4.233 20 0 HIADHN CCN1CCN([C@@H]2CCN([C@@H](C)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)C2)CC1 ZINC000506568220 915215548 /nfs/dbraw/zinc/21/55/48/915215548.db2.gz WRFZLMNEXLSYCP-KBXCAEBGSA-N 0 3 423.445 4.497 20 0 HIADHN CC[C@@H](N[C@H](C)C(=O)N1CCSc2ccccc21)c1ccc(OC)c(OC)c1 ZINC000506601899 915255559 /nfs/dbraw/zinc/25/55/59/915255559.db2.gz MQJZWRDBETVGGY-NVXWUHKLSA-N 0 3 400.544 4.272 20 0 HIADHN c1[nH]nc(-c2ccc3c(c2)OCCO3)c1CN1CC=C(c2c[nH]c3ncccc23)CC1 ZINC000506622211 915282486 /nfs/dbraw/zinc/28/24/86/915282486.db2.gz AZFYUOJFVGWGIF-UHFFFAOYSA-N 0 3 413.481 4.014 20 0 HIADHN CC[C@@H](N[C@H](C)C(=O)Nc1ccc(OC(F)F)cc1)c1ccc(OC)c(OC)c1 ZINC000506661781 915336768 /nfs/dbraw/zinc/33/67/68/915336768.db2.gz JLYRJDBJJOKTBQ-CXAGYDPISA-N 0 3 408.445 4.373 20 0 HIADHN O=C(NCc1ccccc1)C1CCN(Cc2ccc(OCc3ccccn3)cc2)CC1 ZINC000506731218 915416107 /nfs/dbraw/zinc/41/61/07/915416107.db2.gz QBYOWEPVXDUBSD-UHFFFAOYSA-N 0 3 415.537 4.189 20 0 HIADHN CCOC(=O)c1sc2ncnc(NC[C@@H](c3ccc(C)o3)N3CCCC3)c2c1C ZINC000506742270 915429093 /nfs/dbraw/zinc/42/90/93/915429093.db2.gz LYLVWHYLHVXAIZ-HNNXBMFYSA-N 0 3 414.531 4.327 20 0 HIADHN COc1ccc(CN2CC[C@H](n3ncc4ccccc43)C2)cc1OCc1cccnc1 ZINC000513412468 921780095 /nfs/dbraw/zinc/78/00/95/921780095.db2.gz AFEOPCOLKXSKOC-QFIPXVFZSA-N 0 3 414.509 4.466 20 0 HIADHN CCSc1cccc(NC(=O)NCc2ccccc2CN2CCN(CC)CC2)c1 ZINC000506856300 915641580 /nfs/dbraw/zinc/64/15/80/915641580.db2.gz FJCTVQWKWLSDSN-UHFFFAOYSA-N 0 3 412.603 4.258 20 0 HIADHN O=C(Nc1ccc(F)cc1OCC(F)(F)F)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000506872437 915662178 /nfs/dbraw/zinc/66/21/78/915662178.db2.gz GEXWJBFBEXVTSX-MRXNPFEDSA-N 0 3 411.399 4.163 20 0 HIADHN CC(C)OCCCNC(=O)C1CCN(Cc2ccc(-c3c(F)cccc3F)o2)CC1 ZINC000506894049 915689355 /nfs/dbraw/zinc/68/93/55/915689355.db2.gz LDKBIZJOUDCBRV-UHFFFAOYSA-N 0 3 420.500 4.368 20 0 HIADHN CCOC(=O)c1cc(C)sc1NC(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000506991047 915803370 /nfs/dbraw/zinc/80/33/70/915803370.db2.gz RVDBEAVOMIVYBQ-UHFFFAOYSA-N 0 3 415.559 4.362 20 0 HIADHN Cc1ccccc1C(=O)NC1CCN(C(=O)CN[C@H](c2ccccc2)C(C)(C)C)CC1 ZINC000506995424 915809420 /nfs/dbraw/zinc/80/94/20/915809420.db2.gz SFHYCFZNMRPNFM-XMMPIXPASA-N 0 3 421.585 4.093 20 0 HIADHN COc1ccc(-c2nc(C)c([C@@H](C)NC(=O)N(C)[C@@H]3CCN(C4CC4)C3)s2)cc1 ZINC000507059528 915846513 /nfs/dbraw/zinc/84/65/13/915846513.db2.gz KQYADMZZKNVEDA-CRAIPNDOSA-N 0 3 414.575 4.066 20 0 HIADHN COc1ccc([C@H]2C[C@H](NC(=O)NC[C@@H](c3cccs3)N3CCCC3)C2)cc1F ZINC000507073846 915853721 /nfs/dbraw/zinc/85/37/21/915853721.db2.gz OROJVXDQTUKSNK-LNLFQRSKSA-N 0 3 417.550 4.278 20 0 HIADHN Cn1c2ccc(CN3CCN(C4c5ccccc5-c5ccccc54)CC3)cc2oc1=O ZINC000507092506 915865040 /nfs/dbraw/zinc/86/50/40/915865040.db2.gz CGGXVPIDROZLNK-UHFFFAOYSA-N 0 3 411.505 4.019 20 0 HIADHN O=C(c1ccc(OCC(F)(F)F)cc1)N1CCCN(CCCc2ccccc2)CC1 ZINC000507162011 915899495 /nfs/dbraw/zinc/89/94/95/915899495.db2.gz MREXYDYSCMLXFF-UHFFFAOYSA-N 0 3 420.475 4.408 20 0 HIADHN CN(C)Cc1cccc(NC(=O)N2CCO[C@H](c3ccccc3C(F)(F)F)C2)c1 ZINC000513439878 921808392 /nfs/dbraw/zinc/80/83/92/921808392.db2.gz XHBRTBXLWCZSGU-IBGZPJMESA-N 0 3 407.436 4.372 20 0 HIADHN COCCOc1cc(C)ccc1NC(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000507190453 915939580 /nfs/dbraw/zinc/93/95/80/915939580.db2.gz ZQFXXGNFQPNVSC-IBGZPJMESA-N 0 3 418.484 4.116 20 0 HIADHN COCCOc1ccc(NC(=O)[C@H]2CN(Cc3ccccc3)CCC2(F)F)c(C)c1 ZINC000507191946 915941333 /nfs/dbraw/zinc/94/13/33/915941333.db2.gz QLCSOCYGFQKWKC-HXUWFJFHSA-N 0 3 418.484 4.116 20 0 HIADHN COc1ccc(OC)c([C@H]2CCCN2C(=O)CN2CC[C@H](c3ccccc3C)C2)c1 ZINC000507218586 915969673 /nfs/dbraw/zinc/96/96/73/915969673.db2.gz LLJALXUZHNZUDL-WMZHIEFXSA-N 0 3 408.542 4.165 20 0 HIADHN O=C(c1csc(-c2ncccc2F)n1)N1CCCN(CCCc2ccccc2)CC1 ZINC000507272423 916036380 /nfs/dbraw/zinc/03/63/80/916036380.db2.gz LHQHTLYEEMHOIT-UHFFFAOYSA-N 0 3 424.545 4.125 20 0 HIADHN CCCn1nccc1C1CCN(C(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)CC1 ZINC000507308325 916069463 /nfs/dbraw/zinc/06/94/63/916069463.db2.gz YFXLMYMSSULHFG-SIKLNZKXSA-N 0 3 409.578 4.018 20 0 HIADHN C[C@H]1CCCCN1CCNC(=O)c1cnn(-c2cccc(C(F)(F)F)c2)c1C1CC1 ZINC000507343071 916096936 /nfs/dbraw/zinc/09/69/36/916096936.db2.gz VWMQHDXXSQXTOU-HNNXBMFYSA-N 0 3 420.479 4.373 20 0 HIADHN Cc1nc(-c2ccccc2Br)sc1[C@H](C)N[C@@H]1CCCCNC1=O ZINC000507442418 916213281 /nfs/dbraw/zinc/21/32/81/916213281.db2.gz KICIRFIRPRIGLU-XHDPSFHLSA-N 0 3 408.365 4.200 20 0 HIADHN COCCSc1ccc([C@H](C)N[C@H](C)C(=O)N2CCc3sccc3C2)cc1 ZINC000507458347 916225757 /nfs/dbraw/zinc/22/57/57/916225757.db2.gz FYINJPHIFYRBLZ-JKSUJKDBSA-N 0 3 404.601 4.111 20 0 HIADHN C[C@H](N[C@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1)[C@H]1CCCOC1 ZINC000507498336 916264294 /nfs/dbraw/zinc/26/42/94/916264294.db2.gz VFDYARJXYRYPQV-UQASEVPWSA-N 0 3 407.963 4.238 20 0 HIADHN C[C@H](N[C@@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1)[C@H]1CCCOC1 ZINC000507498337 916265328 /nfs/dbraw/zinc/26/53/28/916265328.db2.gz VFDYARJXYRYPQV-XERREHJYSA-N 0 3 407.963 4.238 20 0 HIADHN COc1ccc(C)cc1NC(=O)[C@H](C)N(C)CCCc1cc(-c2ccccc2)n[nH]1 ZINC000507564275 916321360 /nfs/dbraw/zinc/32/13/60/916321360.db2.gz JTRYMVYRDVWNFL-SFHVURJKSA-N 0 3 406.530 4.285 20 0 HIADHN CCc1c(C(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)cnn1-c1ccc(F)cc1 ZINC000507598851 916353149 /nfs/dbraw/zinc/35/31/49/916353149.db2.gz ITUNRCVKEJECGT-FXAWDEMLSA-N 0 3 406.505 4.139 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3oc(C4CC4)nc3C)c(OCC)c2)CC1 ZINC000507599770 916354274 /nfs/dbraw/zinc/35/42/74/916354274.db2.gz HAEQAGFBOPZLKW-UHFFFAOYSA-N 0 3 412.534 4.043 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3ccc4[nH]ccc4c3)c(OCC)c2)CC1 ZINC000507610799 916368092 /nfs/dbraw/zinc/36/80/92/916368092.db2.gz LMCPBJGVRBVDMF-UHFFFAOYSA-N 0 3 406.530 4.351 20 0 HIADHN CCc1ccc([C@H](NCC[C@@H]2CCCCO2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000507618090 916375559 /nfs/dbraw/zinc/37/55/59/916375559.db2.gz IADUQWGAWBMTHC-GMAHTHKFSA-N 0 3 401.572 4.291 20 0 HIADHN CCc1ccc([C@H](NCC[C@H]2CCCCO2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000507618088 916376102 /nfs/dbraw/zinc/37/61/02/916376102.db2.gz IADUQWGAWBMTHC-GGAORHGYSA-N 0 3 401.572 4.291 20 0 HIADHN O=C(Nc1ccc(Cn2cccn2)cc1)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000507652015 916413694 /nfs/dbraw/zinc/41/36/94/916413694.db2.gz VZWHXNBPFXAKPU-OAQYLSRUSA-N 0 3 410.468 4.027 20 0 HIADHN CCCN(Cc1ccn(-c2ccccc2)n1)C1CCN(C(=O)c2ccccc2)CC1 ZINC000507660135 916421730 /nfs/dbraw/zinc/42/17/30/916421730.db2.gz YLLKTZRYZXXGEQ-UHFFFAOYSA-N 0 3 402.542 4.389 20 0 HIADHN CC[C@@H](C)N(CC(=O)N1CCC(C(=O)Nc2ccccc2)CC1)Cc1ccccc1 ZINC000507675805 916446594 /nfs/dbraw/zinc/44/65/94/916446594.db2.gz BEFQIXXUCASNCT-HXUWFJFHSA-N 0 3 407.558 4.164 20 0 HIADHN CC(C)c1ccccc1OCCC(=O)Nc1ccc(C(=O)NCCN2CCCC2)cc1 ZINC000507705788 916490283 /nfs/dbraw/zinc/49/02/83/916490283.db2.gz HWIZQXQJDDXIHH-UHFFFAOYSA-N 0 3 423.557 4.043 20 0 HIADHN Cc1nc(COc2ccc(CN3CC=C(c4ccc5c(c4)OCCO5)CC3)cc2)no1 ZINC000507706240 916491707 /nfs/dbraw/zinc/49/17/07/916491707.db2.gz GXNQGNNGCTZKPR-UHFFFAOYSA-N 0 3 419.481 4.018 20 0 HIADHN CCCN(CC(=O)Nc1cccc(CN2CCSCC2)c1)Cc1ccc(F)cc1 ZINC000507708362 916497730 /nfs/dbraw/zinc/49/77/30/916497730.db2.gz IXOUAJMPVCSEGY-UHFFFAOYSA-N 0 3 415.578 4.225 20 0 HIADHN Cn1ccnc1-c1cccc(NC(=O)[C@H]2CN(Cc3ccccc3)CCC2(F)F)c1 ZINC000507719521 916513905 /nfs/dbraw/zinc/51/39/05/916513905.db2.gz SWERMPZYBLBNAN-HXUWFJFHSA-N 0 3 410.468 4.183 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)NC[C@@H](c2ccsc2)N(CC)CC)cc1 ZINC000507765848 916550710 /nfs/dbraw/zinc/55/07/10/916550710.db2.gz GXXYOBHOHAHUJZ-JXFKEZNVSA-N 0 3 416.591 4.481 20 0 HIADHN CC(C)Sc1cc(Br)ccc1CN1CCN(C[C@@H]2CCOC2)CC1 ZINC000507784997 916569766 /nfs/dbraw/zinc/56/97/66/916569766.db2.gz UYHPUJVBHAUUIL-INIZCTEOSA-N 0 3 413.425 4.104 20 0 HIADHN CCOC(=O)C1CCN(C(=O)[C@H](C)N[C@H](C)c2ccc(Oc3ccccc3)cc2)CC1 ZINC000507892550 916746999 /nfs/dbraw/zinc/74/69/99/916746999.db2.gz HCBYZZKXXBIMDT-MOPGFXCFSA-N 0 3 424.541 4.320 20 0 HIADHN Cc1sc(Br)c(C(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)c1C ZINC000507901420 916768875 /nfs/dbraw/zinc/76/88/75/916768875.db2.gz FUJFVCOGBREHOJ-WBMJQRKESA-N 0 3 407.377 4.378 20 0 HIADHN O=C(c1c[nH]c2ccccc12)[C@H](c1ccccc1)N1CCC(CN2CCOCC2)CC1 ZINC000507939588 916808245 /nfs/dbraw/zinc/80/82/45/916808245.db2.gz RCSZXCQNJRPVRR-VWLOTQADSA-N 0 3 417.553 4.136 20 0 HIADHN Cc1ccc(NC(=O)[C@@H]2CCCN(Cc3ccc(OCc4ccncc4)cc3)C2)nc1 ZINC000507996374 916837224 /nfs/dbraw/zinc/83/72/24/916837224.db2.gz CYOSSEALESYVNZ-JOCHJYFZSA-N 0 3 416.525 4.215 20 0 HIADHN Cc1cccc(NC(=O)[C@@H]2CCCN(Cc3c[nH]nc3-c3cccc(Cl)c3)C2)n1 ZINC000508013941 916851545 /nfs/dbraw/zinc/85/15/45/916851545.db2.gz JNEITRBGYTUNSA-QGZVFWFLSA-N 0 3 409.921 4.284 20 0 HIADHN COC(=O)c1ccc(-c2noc([C@H]3CN(Cc4ccccc4)CCC3(F)F)n2)cc1 ZINC000508055198 916881649 /nfs/dbraw/zinc/88/16/49/916881649.db2.gz SFDLWMQVUSHLRC-GOSISDBHSA-N 0 3 413.424 4.148 20 0 HIADHN O=C(CC1CCCC1)NCCNCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1 ZINC000508079468 916899336 /nfs/dbraw/zinc/89/93/36/916899336.db2.gz QDMNKFBBEIOEAP-UHFFFAOYSA-N 0 3 420.532 4.465 20 0 HIADHN CC(C)(CNC(=O)N[C@@H](c1nccs1)c1ccccc1)N1CCc2ccccc2C1 ZINC000508127883 916946263 /nfs/dbraw/zinc/94/62/63/916946263.db2.gz LBHRBZQXADCESO-OAQYLSRUSA-N 0 3 420.582 4.369 20 0 HIADHN O=C1COc2ccc(CN3CCC[C@H](c4nc(-c5ccc(Cl)cc5)no4)C3)cc2N1 ZINC000508156990 916977911 /nfs/dbraw/zinc/97/79/11/916977911.db2.gz DBPXSYYEEMMUBH-INIZCTEOSA-N 0 3 424.888 4.101 20 0 HIADHN COc1ccc(NC(=O)[C@H](C)N2[C@H](C)CC[C@H]2C)cc1NC(=O)c1cccc(F)c1 ZINC000508203203 917022147 /nfs/dbraw/zinc/02/21/47/917022147.db2.gz CCEVUVODXBAGJW-OAGGEKHMSA-N 0 3 413.493 4.286 20 0 HIADHN Cc1ccc(Cc2nc(C(=O)Nc3ccc(OC4CCN(C)CC4)nc3)cs2)cc1 ZINC000508310817 917116734 /nfs/dbraw/zinc/11/67/34/917116734.db2.gz CNFBODKFRUSIFU-UHFFFAOYSA-N 0 3 422.554 4.163 20 0 HIADHN O=C(CCc1ccc(F)cc1F)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000508329549 917131453 /nfs/dbraw/zinc/13/14/53/917131453.db2.gz CQURXRRAOVWDNC-FQEVSTJZSA-N 0 3 410.468 4.180 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N2CCO[C@H](c3ccccc3Cl)C2)N(C)C)cc1 ZINC000508391263 917185947 /nfs/dbraw/zinc/18/59/47/917185947.db2.gz JSCVDABFUTYRDG-RTWAWAEBSA-N 0 3 401.938 4.034 20 0 HIADHN Cc1cc(NC(=O)c2cccc(Cn3ccnc3)c2)cc(N2CCN(C(C)C)CC2)c1 ZINC000508478664 917263348 /nfs/dbraw/zinc/26/33/48/917263348.db2.gz SWPVGNHTQCQWEW-UHFFFAOYSA-N 0 3 417.557 4.023 20 0 HIADHN O=C(c1occ2c1CCOC2)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000508583768 917354684 /nfs/dbraw/zinc/35/46/84/917354684.db2.gz TXDKWSPTEFDJMG-UHFFFAOYSA-N 0 3 423.340 4.397 20 0 HIADHN CCC(CC)(C(=O)NC[C@H](C)CN1CCN(C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000508621107 917387478 /nfs/dbraw/zinc/38/74/78/917387478.db2.gz SDRGWZZQTSRKKM-INIZCTEOSA-N 0 3 414.421 4.051 20 0 HIADHN CCc1ccccc1NC(=O)CN1[C@H](C)C[C@H](C(=O)N[C@H](C)CC)[C@@H]2CCCC[C@H]21 ZINC000508657487 917423615 /nfs/dbraw/zinc/42/36/15/917423615.db2.gz SHHNAXFQAGOFGE-GHJIKITLSA-N 0 3 413.606 4.371 20 0 HIADHN Brc1ccc2c(c1)OCCC[C@H]2NCc1ccccc1Cn1cncn1 ZINC000508750384 917508571 /nfs/dbraw/zinc/50/85/71/917508571.db2.gz YWQXLOJLLZDIBI-LJQANCHMSA-N 0 3 413.319 4.092 20 0 HIADHN C[C@H](NC(=O)N1CCC(OC2CCC(C)CC2)CC1)[C@H](c1ccccc1)N(C)C ZINC000508850585 917602463 /nfs/dbraw/zinc/60/24/63/917602463.db2.gz FRCSQSBBEDCFLS-JHYNZKOVSA-N 0 3 401.595 4.447 20 0 HIADHN C[C@@H](NC(=O)N(Cc1ccccc1)CC1CCOCC1)[C@@H](c1ccccc1)N(C)C ZINC000508852253 917606062 /nfs/dbraw/zinc/60/60/62/917606062.db2.gz JUDOEDWUMBCSQT-YKSBVNFPSA-N 0 3 409.574 4.316 20 0 HIADHN CCc1nc2c(s1)[C@H](N(C)C(=O)N[C@H](C)[C@H](c1ccccc1)N(C)C)CCC2 ZINC000508852170 917606314 /nfs/dbraw/zinc/60/63/14/917606314.db2.gz JEPNRFZCMIPRHN-XFQXTVEOSA-N 0 3 400.592 4.416 20 0 HIADHN C[C@H](NC(=O)N1CCC(c2c[nH]c3ncccc23)CC1)[C@H](c1ccccc1)N(C)C ZINC000508869540 917623661 /nfs/dbraw/zinc/62/36/61/917623661.db2.gz YFYASYXAAJHVPJ-HTAPYJJXSA-N 0 3 405.546 4.143 20 0 HIADHN COc1ccc(OC)c(CN(C(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)C2CC2)c1 ZINC000508875044 917628920 /nfs/dbraw/zinc/62/89/20/917628920.db2.gz VVFQDININLOAKB-UZUQRXQVSA-N 0 3 411.546 4.069 20 0 HIADHN C[C@@H](NC(=O)Nc1ccccc1CN1C[C@@H](C)O[C@H](C)C1)[C@@H](c1ccccc1)N(C)C ZINC000508877241 917630168 /nfs/dbraw/zinc/63/01/68/917630168.db2.gz XUFQSMGTNYVYBD-FIXDAVPBSA-N 0 3 424.589 4.109 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)cc1OC ZINC000508880327 917634317 /nfs/dbraw/zinc/63/43/17/917634317.db2.gz LGBWAFSMPKLECE-DHJUGAMNSA-N 0 3 411.546 4.242 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)c1cn2cc(Cl)cc(Cl)c2n1 ZINC000508982728 917737457 /nfs/dbraw/zinc/73/74/57/917737457.db2.gz IYPVHNCVEMDHMU-HNNXBMFYSA-N 0 3 417.340 4.378 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)N1CCCC[C@H]1c1ccnn1C)c1ccc(Cl)cc1 ZINC000509025006 917778430 /nfs/dbraw/zinc/77/84/30/917778430.db2.gz SOOUAPNCMOKCDJ-SFTDATJTSA-N 0 3 417.985 4.393 20 0 HIADHN CCCN(C)[C@H](CNC(=O)N1CCCC2(CCOCC2)C1)c1ccc(Cl)cc1 ZINC000509039662 917793479 /nfs/dbraw/zinc/79/34/79/917793479.db2.gz QFPCQCCOXSJDLB-HXUWFJFHSA-N 0 3 407.986 4.325 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cccc(NC(=O)[C@H]2C[C@H]2C)c1)c1cccc(OC)c1 ZINC000509116171 917851370 /nfs/dbraw/zinc/85/13/70/917851370.db2.gz WYTNIDQXNAXCCL-MQNAVGNWSA-N 0 3 423.557 4.103 20 0 HIADHN O=C(N1CC2C[C@@H]3CC1C[C@H](C2)C3)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000509124003 917856952 /nfs/dbraw/zinc/85/69/52/917856952.db2.gz NIUMIIGZANBWMR-YUOXAOAISA-N 0 3 406.492 4.478 20 0 HIADHN Cc1ccc(C(=O)C2CCN(CCCN3CCN(c4ccccc4)CC3)CC2)cc1 ZINC000509262936 917951664 /nfs/dbraw/zinc/95/16/64/917951664.db2.gz JJDWMLCABBETHK-UHFFFAOYSA-N 0 3 405.586 4.102 20 0 HIADHN CC(C)N(Cc1cc(Br)ccc1F)C(=O)NCCN1CCC(C)CC1 ZINC000509263336 917951694 /nfs/dbraw/zinc/95/16/94/917951694.db2.gz LBDJDBQMLWQYAJ-UHFFFAOYSA-N 0 3 414.363 4.240 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)N1CCO[C@@H](c2ccccc2Cl)C1 ZINC000509348396 918013077 /nfs/dbraw/zinc/01/30/77/918013077.db2.gz OPEVVDGRIYKVLE-FGZHOGPDSA-N 0 3 413.949 4.260 20 0 HIADHN COc1cc(C)c(CN(C)C[C@@H](O)COc2c(Cl)cccc2Cl)cc1OC ZINC000509359190 918025132 /nfs/dbraw/zinc/02/51/32/918025132.db2.gz QOHDHKZRSKTZAE-OAHLLOKOSA-N 0 3 414.329 4.191 20 0 HIADHN COc1cccc(-c2nn(C(C)(C)C)cc2CN2CCC[C@@H](c3nc(C)no3)C2)c1 ZINC000509372881 918037913 /nfs/dbraw/zinc/03/79/13/918037913.db2.gz NXZYVLNGUABQLU-GOSISDBHSA-N 0 3 409.534 4.385 20 0 HIADHN Cn1cnnc1C1CCN(Cc2cn(-c3ccccc3)nc2-c2cccs2)CC1 ZINC000509418824 918078871 /nfs/dbraw/zinc/07/88/71/918078871.db2.gz LIOODOKBGGJIHR-UHFFFAOYSA-N 0 3 404.543 4.109 20 0 HIADHN Cn1cc(-c2ccc(CNCc3ccc(NC(=O)c4ccncc4)cc3)s2)cn1 ZINC000509470240 918118191 /nfs/dbraw/zinc/11/81/91/918118191.db2.gz KTQHMXVGEFXTGJ-UHFFFAOYSA-N 0 3 403.511 4.086 20 0 HIADHN O=C(Nc1ccc(Cl)c(OC(F)F)c1)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000509472501 918119655 /nfs/dbraw/zinc/11/96/55/918119655.db2.gz NXYSWTVASQPBBY-UHFFFAOYSA-N 0 3 424.875 4.398 20 0 HIADHN O=C(NCCCCOCc1ccccc1)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000509504985 918151632 /nfs/dbraw/zinc/15/16/32/918151632.db2.gz DBSSJKPKPJUGQN-QFIPXVFZSA-N 0 3 416.512 4.257 20 0 HIADHN COCCSc1ccc([C@H](C)NC(=O)N2CCN(CC3CCCCC3)CC2)cc1 ZINC000509505107 918151995 /nfs/dbraw/zinc/15/19/95/918151995.db2.gz UNNSWLUYNOYCJY-IBGZPJMESA-N 0 3 419.635 4.394 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)c2[nH]c3ccccc3c2Br)C1 ZINC000509519567 918168766 /nfs/dbraw/zinc/16/87/66/918168766.db2.gz KSCLUHLIOVTPDO-GDBMZVCRSA-N 0 3 412.331 4.496 20 0 HIADHN O=C([C@@H]1CCC[C@@H]2CCCC[C@H]12)N1CCC[C@@H](CN2CCN(c3ccccn3)CC2)C1 ZINC000509519744 918169156 /nfs/dbraw/zinc/16/91/56/918169156.db2.gz MAMMPLVTZMCIES-NEWJYFPISA-N 0 3 424.633 4.049 20 0 HIADHN COc1ccccc1/C=C\CN1CCC(C(=O)Nc2cc(Cl)ccc2O)CC1 ZINC000509523052 918171866 /nfs/dbraw/zinc/17/18/66/918171866.db2.gz WRMCQCWWEGGVNT-XQRVVYSFSA-N 0 3 400.906 4.418 20 0 HIADHN CC(C)c1nn(-c2ccccc2)cc1CN1CCC(C(=O)N2CCC[C@H](C)C2)CC1 ZINC000509532975 918181191 /nfs/dbraw/zinc/18/11/91/918181191.db2.gz NUFHOYQKWIAJMW-FQEVSTJZSA-N 0 3 408.590 4.466 20 0 HIADHN C[C@H]1CCCN(C(=O)C2CCN(Cc3ccccc3OCc3cccnc3)CC2)C1 ZINC000509547179 918197904 /nfs/dbraw/zinc/19/79/04/918197904.db2.gz XVOJIHJXPJXWKI-FQEVSTJZSA-N 0 3 407.558 4.131 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N1CCO[C@H](c2ccc(F)c(Cl)c2)C1)c1ccco1 ZINC000509566729 918215384 /nfs/dbraw/zinc/21/53/84/918215384.db2.gz GSXOXFLOTDWUHR-DCPHZVHLSA-N 0 3 423.916 4.284 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N1CCC[C@@H]1c1cc(OC)ccc1OC)c1ccco1 ZINC000509566035 918215593 /nfs/dbraw/zinc/21/55/93/918215593.db2.gz CIBPUNKHQGFAPP-FFZOFVMBSA-N 0 3 415.534 4.273 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)N(C)Cc1cccc(OC(F)(F)F)c1)c1ccco1 ZINC000509568066 918217477 /nfs/dbraw/zinc/21/74/77/918217477.db2.gz KSUQKRKJBLTEBZ-PBHICJAKSA-N 0 3 413.440 4.449 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)N(C)Cc1ccc(Br)cc1)c1ccco1 ZINC000509576066 918225564 /nfs/dbraw/zinc/22/55/64/918225564.db2.gz CPTRVPIZJRITGD-PBHICJAKSA-N 0 3 408.340 4.313 20 0 HIADHN O=C(NCCCCN1CCN(Cc2ccccc2)CC1)Nc1cc(Cl)ccc1F ZINC000509588792 918236890 /nfs/dbraw/zinc/23/68/90/918236890.db2.gz XWDGCZYILIBATQ-UHFFFAOYSA-N 0 3 418.944 4.199 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N[C@H](CO)c1c(Cl)cccc1Cl)c1ccco1 ZINC000509594332 918242061 /nfs/dbraw/zinc/24/20/61/918242061.db2.gz ZZYOPXALCFRSCQ-APHBMKBZSA-N 0 3 414.333 4.048 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)N(C)Cc1cc(Br)cs1)c1ccco1 ZINC000509593416 918242258 /nfs/dbraw/zinc/24/22/58/918242258.db2.gz CUBNZXBGZMHXII-DOMZBBRYSA-N 0 3 414.369 4.374 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N1C[C@@H](C)O[C@@H](c2ccc(F)cc2)C1)c1ccco1 ZINC000509594018 918243215 /nfs/dbraw/zinc/24/32/15/918243215.db2.gz YZCSRIOTRXZVOL-VXIWKAIFSA-N 0 3 403.498 4.020 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N1CC=C(c2c(F)cccc2F)CC1)c1ccco1 ZINC000509594835 918244900 /nfs/dbraw/zinc/24/49/00/918244900.db2.gz FXXWEZFYEOCXJP-KXBFYZLASA-N 0 3 403.473 4.486 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N1CCC[C@H](OCc2ccccc2F)C1)c1ccco1 ZINC000509596159 918246923 /nfs/dbraw/zinc/24/69/23/918246923.db2.gz NPJONCVZNPSMPR-CUWPLCDZSA-N 0 3 417.525 4.239 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N(Cc3ccccc3OC)C3CC3)c(C)c2)CC1 ZINC000509599948 918250173 /nfs/dbraw/zinc/25/01/73/918250173.db2.gz KLRYGYLXLRZLGD-UHFFFAOYSA-N 0 3 422.573 4.342 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N(C)[C@@H]1CCO[C@H](c2ccc(F)cc2)C1)c1ccco1 ZINC000509617379 918266261 /nfs/dbraw/zinc/26/62/61/918266261.db2.gz YNANZQSMTLMDKC-DQMRONCHSA-N 0 3 417.525 4.410 20 0 HIADHN Cc1cc(Br)cc(C)c1N1CCC[C@H](N2CCC3(C2)CCOCC3)C1=O ZINC000509699043 918329329 /nfs/dbraw/zinc/32/93/29/918329329.db2.gz PQOLYDBKWBMONB-SFHVURJKSA-N 0 3 421.379 4.064 20 0 HIADHN COCCN(C)CCNC(=O)N(Cc1ccc(-c2ccc(F)cc2)s1)C(C)C ZINC000509714538 918342629 /nfs/dbraw/zinc/34/26/29/918342629.db2.gz SZIXKFNGJSYCAI-UHFFFAOYSA-N 0 3 407.555 4.052 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)NC[C@@H](c3cccs3)N3CCCC3)cc2)cc(=O)[nH]1 ZINC000509885513 918487597 /nfs/dbraw/zinc/48/75/97/918487597.db2.gz YSOHAHAFEAMICV-IBGZPJMESA-N 0 3 423.542 4.178 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)NC[C@@H](C(C)C)[NH+]3CCCCCC3)cc2)cc(=O)[n-]1 ZINC000509891824 918494717 /nfs/dbraw/zinc/49/47/17/918494717.db2.gz XQHYVGQPRGRPNC-NRFANRHFSA-N 0 3 411.550 4.180 20 0 HIADHN O=C(N[C@@H]1C[C@@H]1c1ccccc1C(F)(F)F)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000509906413 918509036 /nfs/dbraw/zinc/50/90/36/918509036.db2.gz YLJHXWAERJOCLV-YVWKXTFCSA-N 0 3 403.448 4.135 20 0 HIADHN O=C(N[C@@H]1C[C@H]1c1ccccc1C(F)(F)F)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000509906410 918509322 /nfs/dbraw/zinc/50/93/22/918509322.db2.gz YLJHXWAERJOCLV-IMFGXOCKSA-N 0 3 403.448 4.135 20 0 HIADHN CCN(CC)c1nc2sc(C(=O)N(CC(C)C)C3CCN(C)CC3)cc2s1 ZINC000509921973 918522105 /nfs/dbraw/zinc/52/21/05/918522105.db2.gz DPTRPGFWBOKFTC-UHFFFAOYSA-N 0 3 408.637 4.396 20 0 HIADHN CC(C)CN(C(=O)c1cc(-c2ccco2)nc2c1cnn2C(C)C)C1CCN(C)CC1 ZINC000509936411 918534769 /nfs/dbraw/zinc/53/47/69/918534769.db2.gz CYWPIZGQNLDOBN-UHFFFAOYSA-N 0 3 423.561 4.465 20 0 HIADHN C[C@H]1CCN(C(=O)c2cc(N(C)C)nc3ccccc32)CCN1Cc1ccccc1 ZINC000510027880 918603138 /nfs/dbraw/zinc/60/31/38/918603138.db2.gz ITHNTNBVBHLWGU-IBGZPJMESA-N 0 3 402.542 4.037 20 0 HIADHN Cc1ccc([C@H](CNCc2ccc(Sc3ccccn3)o2)N2CCOCC2)cc1 ZINC000510031487 918605079 /nfs/dbraw/zinc/60/50/79/918605079.db2.gz VOWASNMJRUUZLP-NRFANRHFSA-N 0 3 409.555 4.297 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N(C)Cc3cc(C)c(OC)c(C)c3)c(C)c2)CC1 ZINC000510070015 918638858 /nfs/dbraw/zinc/63/88/58/918638858.db2.gz HUWBOCLZYGBENQ-UHFFFAOYSA-N 0 3 424.589 4.426 20 0 HIADHN COc1ccc(NC(C)=O)cc1NC(=O)[C@@H](C)N1CCC[C@@](C)(c2ccccc2)CC1 ZINC000510138719 918695742 /nfs/dbraw/zinc/69/57/42/918695742.db2.gz DHCPSJZGFFGVMJ-IQGLISFBSA-N 0 3 423.557 4.424 20 0 HIADHN CCOc1cc(C)ccc1NC(=O)NCCCCN1CCN(c2ccccc2)CC1 ZINC000510197413 918746339 /nfs/dbraw/zinc/74/63/39/918746339.db2.gz LJKUUYOJKISPGZ-UHFFFAOYSA-N 0 3 410.562 4.118 20 0 HIADHN CC[C@@H](NCC(=O)N(C)Cc1ccc(SC)cc1)c1ccc(OC)c(OC)c1 ZINC000510245544 918782847 /nfs/dbraw/zinc/78/28/47/918782847.db2.gz ULVXIWZQGTXRQL-LJQANCHMSA-N 0 3 402.560 4.125 20 0 HIADHN CC[C@@H](N[C@@H](C)C(=O)Nc1ccc(-c2c[nH]cn2)cc1)c1ccc(OC)c(OC)c1 ZINC000510272012 918799159 /nfs/dbraw/zinc/79/91/59/918799159.db2.gz WSWJIPNZLPDVSS-HNAYVOBHSA-N 0 3 408.502 4.162 20 0 HIADHN COc1ccc(F)cc1NC(=O)N(CCN(C)C)Cc1ccc(Br)cc1 ZINC000510284672 918806912 /nfs/dbraw/zinc/80/69/12/918806912.db2.gz XBJNLUPSZUIMRS-UHFFFAOYSA-N 0 3 424.314 4.193 20 0 HIADHN COc1ccc([C@H](Cc2ccc(F)cc2)NCc2ccc3c(c2)NC(=O)CO3)cc1 ZINC000510338559 918840813 /nfs/dbraw/zinc/84/08/13/918840813.db2.gz QZMSMWOCFVNTSU-NRFANRHFSA-N 0 3 406.457 4.239 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N(Cc3ccc([C@H]4C[C@@H]4C)o3)C3CC3)cc2)CC1 ZINC000510383150 918864963 /nfs/dbraw/zinc/86/49/63/918864963.db2.gz CCTHWLWNRFEVBL-MBSDFSHPSA-N 0 3 407.558 4.350 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CN1CCC(C(=O)N2CCC(C)CC2)CC1 ZINC000510417497 918885172 /nfs/dbraw/zinc/88/51/72/918885172.db2.gz VRKLNAKBJSTPPE-UHFFFAOYSA-N 0 3 408.590 4.019 20 0 HIADHN CC1CCN(C(=O)C2CCN(Cc3ccccc3OCc3ccccn3)CC2)CC1 ZINC000510422648 918888533 /nfs/dbraw/zinc/88/85/33/918888533.db2.gz XCVHUYKMSIXSFA-UHFFFAOYSA-N 0 3 407.558 4.131 20 0 HIADHN COc1cccc(OC)c1OC1CCN(Cc2c[nH]nc2-c2cccc(C)c2)CC1 ZINC000510436123 918895970 /nfs/dbraw/zinc/89/59/70/918895970.db2.gz OKGSIAAXWFVOMG-UHFFFAOYSA-N 0 3 407.514 4.446 20 0 HIADHN CCc1ccc([C@H](CNC(=O)Nc2cccc(C(=O)NC(C)(C)C)c2)N(C)C)cc1 ZINC000510462439 918917898 /nfs/dbraw/zinc/91/78/98/918917898.db2.gz PQQRXLLKXXCSQJ-NRFANRHFSA-N 0 3 410.562 4.202 20 0 HIADHN Cc1ccccc1[C@H]1CCN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)C1 ZINC000510496734 918943370 /nfs/dbraw/zinc/94/33/70/918943370.db2.gz OUBYJHQNDGQFEE-QHCPKHFHSA-N 0 3 420.601 4.096 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)Nc1ccc2[nH]c([C@@H]3CCCO3)nc2c1 ZINC000510498756 918947740 /nfs/dbraw/zinc/94/77/40/918947740.db2.gz CPMSRNKPBKQSJX-FQEVSTJZSA-N 0 3 404.470 4.475 20 0 HIADHN COc1cc(OC)c(OC)cc1CN(C)CCCc1cc(-c2ccc(F)cc2)n[nH]1 ZINC000510500570 918949409 /nfs/dbraw/zinc/94/94/09/918949409.db2.gz FONZSNGQWRIAFM-UHFFFAOYSA-N 0 3 413.493 4.306 20 0 HIADHN Cc1nn(-c2ccc(Br)cc2)cc1CN1CCC[C@@H](c2ncc[nH]2)C1 ZINC000510522478 918968083 /nfs/dbraw/zinc/96/80/83/918968083.db2.gz IHBWFECNWZCLHY-OAHLLOKOSA-N 0 3 400.324 4.046 20 0 HIADHN C[C@H](NC(=O)N[C@@H](C)C1=CCN(C)CC1)c1ccc(NC(=O)c2ccc(F)cc2)cc1 ZINC000510570700 919014385 /nfs/dbraw/zinc/01/43/85/919014385.db2.gz JZHXUKJLCIKSIJ-IRXDYDNUSA-N 0 3 424.520 4.089 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)N[C@@H](c1nccs1)c1ccccc1 ZINC000510604241 919045793 /nfs/dbraw/zinc/04/57/93/919045793.db2.gz WDJSVXLSPNXYFJ-HXUWFJFHSA-N 0 3 412.534 4.145 20 0 HIADHN C[C@H]1COCC[C@H]1CNC(=O)N(CCN(C)Cc1ccccc1)Cc1ccccc1 ZINC000510618645 919061194 /nfs/dbraw/zinc/06/11/94/919061194.db2.gz VGLRHLYUKVNGDQ-URXFXBBRSA-N 0 3 409.574 4.003 20 0 HIADHN COc1ccc(C[C@H](NCc2cnn(CC(F)F)c2)c2ccccc2)cc1OC ZINC000510628237 919069594 /nfs/dbraw/zinc/06/95/94/919069594.db2.gz GJRKBRZQMIOVPG-IBGZPJMESA-N 0 3 401.457 4.239 20 0 HIADHN CN(C)Cc1cccc(NC(=O)N2CCC[C@@H](c3nc(-c4ccc(F)cc4)no3)C2)c1 ZINC000510639589 919080408 /nfs/dbraw/zinc/08/04/08/919080408.db2.gz WVTIOMDTGOILTH-GOSISDBHSA-N 0 3 423.492 4.349 20 0 HIADHN CC(C)(C)CCN1CCN(C(=O)Nc2ccc(C(=O)NC3CCCCC3)cc2)CC1 ZINC000510673444 919113243 /nfs/dbraw/zinc/11/32/43/919113243.db2.gz BSCNRBVVGTXPJV-UHFFFAOYSA-N 0 3 414.594 4.335 20 0 HIADHN Cc1cccc([C@H](NCc2ccc(N3CCN(C)CC3)nc2)c2cccc(F)c2)c1 ZINC000510683491 919123548 /nfs/dbraw/zinc/12/35/48/919123548.db2.gz GMECTHKSTGGWQM-VWLOTQADSA-N 0 3 404.533 4.160 20 0 HIADHN C[C@H](N[C@@H]1CCc2ccc(Br)cc21)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000510693373 919129636 /nfs/dbraw/zinc/12/96/36/919129636.db2.gz ANWWCWPQYUGWME-ORAYPTAESA-N 0 3 423.376 4.038 20 0 HIADHN CC[C@H](CS(=O)(=O)c1ccccc1)N[C@H]1CCc2ccc(Br)cc21 ZINC000510693945 919131234 /nfs/dbraw/zinc/13/12/34/919131234.db2.gz DZKOCHKGPGWDOG-APWZRJJASA-N 0 3 408.361 4.279 20 0 HIADHN O=C([C@H](Cc1ccccc1)N[C@H]1CCc2ccc(Br)cc21)N1CCCC1 ZINC000510745605 919195474 /nfs/dbraw/zinc/19/54/74/919195474.db2.gz CRFAIXJHENEQFM-SFTDATJTSA-N 0 3 413.359 4.260 20 0 HIADHN CNC(=O)c1ccc(CN2CCC[C@@H](Cc3nc(C4CCCCCC4)no3)C2)cc1 ZINC000510765082 919219385 /nfs/dbraw/zinc/21/93/85/919219385.db2.gz DYQHPLIZXKSUCD-IBGZPJMESA-N 0 3 410.562 4.322 20 0 HIADHN C[C@H]1CSc2ccc(Br)cc2[C@H]1NCc1ccc2c(c1)oc(=O)n2C ZINC000510798775 919270576 /nfs/dbraw/zinc/27/05/76/919270576.db2.gz TUJBGKYZYMUTGT-VOJFVSQTSA-N 0 3 419.344 4.467 20 0 HIADHN C[C@H](C(=O)Nc1ccc(CC(=O)N2CCCc3ccccc32)cc1)N1CCCCCC1 ZINC000510800648 919272682 /nfs/dbraw/zinc/27/26/82/919272682.db2.gz QQPSXSOVUQYFJJ-HXUWFJFHSA-N 0 3 419.569 4.412 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1ccc(-n2cccn2)c(F)c1)c1ccsc1 ZINC000510834973 919316261 /nfs/dbraw/zinc/31/62/61/919316261.db2.gz DBYUZPCTSBIBKT-LJQANCHMSA-N 0 3 401.511 4.278 20 0 HIADHN CC(C)N(CC(=O)Nc1ccccc1C(F)(F)F)C(=O)[C@H](C)N1CCCCCC1 ZINC000510926015 919444505 /nfs/dbraw/zinc/44/45/05/919444505.db2.gz WMHYHWXLQBOPJQ-INIZCTEOSA-N 0 3 413.484 4.145 20 0 HIADHN Cc1nccn1CCCN[C@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000510948616 919478824 /nfs/dbraw/zinc/47/88/24/919478824.db2.gz UIJRMMFXDFFVMI-OAQYLSRUSA-N 0 3 417.962 4.018 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@H](C)N[C@H]2CCc3cc(F)c(OC)cc32)cc1 ZINC000510962056 919502386 /nfs/dbraw/zinc/50/23/86/919502386.db2.gz YWJNSCDZQIQAJA-BTYIYWSLSA-N 0 3 420.550 4.203 20 0 HIADHN Cc1c([C@H](C)N[C@H]2CCCN(C(=O)Cc3ccccc3)C2)cnn1-c1ccc(F)cc1 ZINC000510991470 919546805 /nfs/dbraw/zinc/54/68/05/919546805.db2.gz ITMSCOKELYMOHK-AVRDEDQJSA-N 0 3 420.532 4.204 20 0 HIADHN Fc1ccc([C@@H](NCCc2nnnn2-c2ccccc2)c2ccc(Cl)cc2)cc1 ZINC000511009568 919570116 /nfs/dbraw/zinc/57/01/16/919570116.db2.gz GTISOSXAOFOOLQ-QFIPXVFZSA-N 0 3 407.880 4.377 20 0 HIADHN CC[C@@H](N[C@@H]1CCN(C(=O)COc2ccccc2)C1)c1ccccc1OC(F)F ZINC000511016411 919585902 /nfs/dbraw/zinc/58/59/02/919585902.db2.gz PCWDIGFCUTWQAM-VQIMIIECSA-N 0 3 404.457 4.009 20 0 HIADHN Cc1ccc(Cc2nc(C(=O)N(Cc3ccco3)C3CCN(C)CC3)cs2)cc1 ZINC000511063101 919663235 /nfs/dbraw/zinc/66/32/35/919663235.db2.gz GOOBYDIFGBTANK-UHFFFAOYSA-N 0 3 409.555 4.372 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)NCCN2CCCCC2)cc1Cl)C1CCCCC1 ZINC000511063844 919663474 /nfs/dbraw/zinc/66/34/74/919663474.db2.gz LSMJGMKUJIDIAF-UHFFFAOYSA-N 0 3 420.985 4.352 20 0 HIADHN Cc1cccn2c(=O)cc(CN3CCC[C@H](c4cccc(C(F)(F)F)c4)C3)nc12 ZINC000511066976 919667557 /nfs/dbraw/zinc/66/75/57/919667557.db2.gz SUDOMVVWQGWAAW-KRWDZBQOSA-N 0 3 401.432 4.401 20 0 HIADHN CC[C@H](C)n1ncc2c1nc(C)cc2C(=O)NC[C@H](c1ccccc1)N1CCCC1 ZINC000511075770 919677240 /nfs/dbraw/zinc/67/72/40/919677240.db2.gz JAYTXOKZFSQRIE-PGRDOPGGSA-N 0 3 405.546 4.278 20 0 HIADHN CN(CCCc1cc(-c2ccccc2)n[nH]1)C(=O)[C@@H]1CCCN1Cc1ccccc1 ZINC000511087682 919690278 /nfs/dbraw/zinc/69/02/78/919690278.db2.gz ABTNQTFLWODVCR-DEOSSOPVSA-N 0 3 402.542 4.132 20 0 HIADHN COCCCNC(=O)C1CCN(Cc2cccc(OCC3CCCCC3)c2)CC1 ZINC000511103381 919708003 /nfs/dbraw/zinc/70/80/03/919708003.db2.gz AGJLXGURQVLNKL-UHFFFAOYSA-N 0 3 402.579 4.010 20 0 HIADHN C[C@@H]1CN(c2ccccc2NC(=O)N[C@H](CN2CCCC2)c2ccccc2)C[C@H](C)O1 ZINC000511111956 919723086 /nfs/dbraw/zinc/72/30/86/919723086.db2.gz ZKKDKHSIROPTLM-ZRCGQRJVSA-N 0 3 422.573 4.259 20 0 HIADHN Cc1cc(C(=O)NCc2ccccc2CN(C)C)c2cc(Br)ccc2n1 ZINC000511118287 919728563 /nfs/dbraw/zinc/72/85/63/919728563.db2.gz AKPHNLCIKULARC-UHFFFAOYSA-N 0 3 412.331 4.297 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)Nc1ccc2c(c1)OC1(CCCC1)O2 ZINC000511177879 919800072 /nfs/dbraw/zinc/80/00/72/919800072.db2.gz STLJXVLCGIXBAV-UHFFFAOYSA-N 0 3 413.493 4.463 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)N[C@@H](c2ccccc2)C2CCC2)CC1 ZINC000511201154 919815430 /nfs/dbraw/zinc/81/54/30/919815430.db2.gz NETLUOPGGLEQCX-VWLOTQADSA-N 0 3 420.601 4.165 20 0 HIADHN C[C@H](NC(=O)Nc1ccc(Br)c(C(F)(F)F)c1)C1=CCN(C)CC1 ZINC000511231558 919836502 /nfs/dbraw/zinc/83/65/02/919836502.db2.gz IITXQNYYZHUQDE-JTQLQIEISA-N 0 3 406.246 4.240 20 0 HIADHN COc1ccc(CN(C(=O)N[C@@H](C)C2=CCN(C)CC2)C2CCCCC2)cc1OC ZINC000511246739 919846789 /nfs/dbraw/zinc/84/67/89/919846789.db2.gz DVUBPASGJMXNHW-SFHVURJKSA-N 0 3 415.578 4.199 20 0 HIADHN COc1ccc(CCN(Cc2ccccc2)C(=O)N[C@@H](C)C2=CCN(C)CC2)cc1 ZINC000511249371 919850309 /nfs/dbraw/zinc/85/03/09/919850309.db2.gz OWUVYSCZMVECIU-FQEVSTJZSA-N 0 3 407.558 4.100 20 0 HIADHN C[C@H](NC(=O)N1CCCC[C@H]1c1nc(-c2cccc(F)c2)c[nH]1)C1=CCN(C)CC1 ZINC000511249868 919852045 /nfs/dbraw/zinc/85/20/45/919852045.db2.gz PYTCAOJGLKSKCY-KKSFZXQISA-N 0 3 411.525 4.103 20 0 HIADHN C[C@H](NC(=O)NCc1ccc(Oc2ccccc2F)c(F)c1)C1=CCN(C)CC1 ZINC000511266676 919864338 /nfs/dbraw/zinc/86/43/38/919864338.db2.gz FZIFSFQUHOFCST-HNNXBMFYSA-N 0 3 401.457 4.207 20 0 HIADHN C[C@@H](NC(=O)NCc1ccccc1COc1ccccc1Cl)C1=CCN(C)CC1 ZINC000511288749 919885896 /nfs/dbraw/zinc/88/58/96/919885896.db2.gz OYGGUALFQWCQGO-QGZVFWFLSA-N 0 3 413.949 4.369 20 0 HIADHN CC(C)[C@H](NC1CCC(C(=O)OC(C)(C)C)CC1)c1nc(-c2ccncc2)no1 ZINC000511382229 919983637 /nfs/dbraw/zinc/98/36/37/919983637.db2.gz WDJRNLSEFJHNGG-ABHNRTSZSA-N 0 3 400.523 4.319 20 0 HIADHN COc1ccc(C[C@@H](C)C(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)cc1OC ZINC000511530722 920151962 /nfs/dbraw/zinc/15/19/62/920151962.db2.gz FZHSHEXZZKFURS-DENIHFKCSA-N 0 3 410.558 4.144 20 0 HIADHN O=C(N[C@@H](CC(F)(F)F)c1ccc(F)cc1)N1CCN(C2CCCCC2)CC1 ZINC000511563154 920203211 /nfs/dbraw/zinc/20/32/11/920203211.db2.gz NLWPOXWQTZUJIC-SFHVURJKSA-N 0 3 401.448 4.479 20 0 HIADHN CN(Cc1ccccc1)Cc1cccc(C(=O)NC[C@@H](c2ccco2)N2CCCC2)c1 ZINC000511568385 920210955 /nfs/dbraw/zinc/21/09/55/920210955.db2.gz ZDMHOCXXAJHREI-DEOSSOPVSA-N 0 3 417.553 4.479 20 0 HIADHN Cc1nn(C)c(C)c1NC(=O)[C@@H](C)N[C@@H](c1cccc(OC(F)(F)F)c1)C1CC1 ZINC000511571554 920215449 /nfs/dbraw/zinc/21/54/49/920215449.db2.gz BDYZXTRSSUZTPL-KZULUSFZSA-N 0 3 410.440 4.003 20 0 HIADHN CN(C)C[C@@H](NC(=O)Nc1cccc(C(=O)N(C)c2ccccc2)c1)c1ccccc1 ZINC000511620138 920276892 /nfs/dbraw/zinc/27/68/92/920276892.db2.gz JUXDNTGRWDERSL-HSZRJFAPSA-N 0 3 416.525 4.388 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)Cc2cn3cc(Cl)cc(Cl)c3n2)C1 ZINC000511660305 920325898 /nfs/dbraw/zinc/32/58/98/920325898.db2.gz FLVVYXNLHTXSKK-RHSMWYFYSA-N 0 3 417.340 4.135 20 0 HIADHN CN(CCCCCc1cc(-c2cccc(F)c2)n[nH]1)Cc1cc(C(N)=O)cs1 ZINC000511664442 920329982 /nfs/dbraw/zinc/32/99/82/920329982.db2.gz GJJNZYLDSBAMBE-UHFFFAOYSA-N 0 3 400.523 4.221 20 0 HIADHN OC[C@@H]1CN(CCSc2ccnc3cc(Cl)ccc32)CC[C@@H]1C(F)(F)F ZINC000511667443 920333533 /nfs/dbraw/zinc/33/35/33/920333533.db2.gz ONCKULKYSCISTF-WFASDCNBSA-N 0 3 404.885 4.473 20 0 HIADHN COc1cc(CN(C)C[C@H]2OCCc3ccccc32)ccc1OCc1ccncc1 ZINC000511669948 920336222 /nfs/dbraw/zinc/33/62/22/920336222.db2.gz ZGQBXRCCYNGHIF-RUZDIDTESA-N 0 3 404.510 4.415 20 0 HIADHN Fc1ccccc1[C@@H]1CC[C@H](NCc2ncc(I)s2)C1 ZINC000511764347 920447456 /nfs/dbraw/zinc/44/74/56/920447456.db2.gz DULUCOTVRZBJDX-MNOVXSKESA-N 0 3 402.276 4.313 20 0 HIADHN Cc1cc(C(=O)CN2C[C@H](c3ccccc3)[C@@H]3COCC[C@H]32)c(C)n1-c1nccs1 ZINC000511781876 920473604 /nfs/dbraw/zinc/47/36/04/920473604.db2.gz UFZRINMSDMARKK-BHIFYINESA-N 0 3 421.566 4.238 20 0 HIADHN Fc1ccc(-n2cc(CN3C[C@H](c4ccccc4)[C@@H]4COCC[C@H]43)nn2)cc1Cl ZINC000511798685 920493043 /nfs/dbraw/zinc/49/30/43/920493043.db2.gz XDXDSPATDHQSQE-XQBPLPMBSA-N 0 3 412.896 4.064 20 0 HIADHN CCN(CC)[C@H](CNC(=O)CCc1ccc2ccccc2n1)c1cccc(OC)c1 ZINC000511834618 920543115 /nfs/dbraw/zinc/54/31/15/920543115.db2.gz LDGZYJPCRGYBLO-XMMPIXPASA-N 0 3 405.542 4.375 20 0 HIADHN O=C(CN1C[C@H](c2ccccc2)[C@H]2CCC[C@H]21)Nc1cccc(N2CCCC2=O)c1 ZINC000511839762 920551800 /nfs/dbraw/zinc/55/18/00/920551800.db2.gz WMWLNNODEJLXTK-DNVJHFABSA-N 0 3 403.526 4.020 20 0 HIADHN O=C(NC1CCN(Cc2c[nH]nc2-c2cccc(Cl)c2)CC1)c1ccsc1 ZINC000511843874 920560563 /nfs/dbraw/zinc/56/05/63/920560563.db2.gz KHYSPARMWOSKBV-UHFFFAOYSA-N 0 3 400.935 4.186 20 0 HIADHN C[C@H](CC(=O)Nc1cc(C(F)(F)F)ccc1Cl)N[C@@H](CO)c1ccsc1 ZINC000511921637 920665961 /nfs/dbraw/zinc/66/59/61/920665961.db2.gz IJOHMBCMDZKKPU-BMIGLBTASA-N 0 3 406.857 4.461 20 0 HIADHN COc1ccc(CNCCCc2nc(-c3ccc(F)cc3)no2)c(Br)c1 ZINC000511985565 920755627 /nfs/dbraw/zinc/75/56/27/920755627.db2.gz AGPLYHNAQJRCNT-UHFFFAOYSA-N 0 3 420.282 4.369 20 0 HIADHN O=C1NC2(CCCCC2)C(=O)N1Cc1ccccc1CNCc1ccc2occc2c1 ZINC000511990500 920759542 /nfs/dbraw/zinc/75/95/42/920759542.db2.gz OQPOYYZBFXEQSD-UHFFFAOYSA-N 0 3 417.509 4.477 20 0 HIADHN FC(F)(F)c1ccc(-n2cc(CN[C@@H]3CCN(c4ncccc4Cl)C3)cn2)cc1 ZINC000512006719 920778181 /nfs/dbraw/zinc/77/81/81/920778181.db2.gz HRDDCKBTPOGVPR-MRXNPFEDSA-N 0 3 421.854 4.308 20 0 HIADHN C[C@@H]1CC[C@H](C)N1CC(=O)N1CCC[C@@H](Cc2nc(C3CCCCCC3)no2)C1 ZINC000512022989 920798418 /nfs/dbraw/zinc/79/84/18/920798418.db2.gz DIUMJXHDLUXCOA-OTWHNJEPSA-N 0 3 402.583 4.161 20 0 HIADHN FC(F)(F)c1ccc(-n2cc(CNCCc3nnc(-c4ccccc4)o3)cn2)cc1 ZINC000512036814 920808915 /nfs/dbraw/zinc/80/89/15/920808915.db2.gz BFVKXWNADVHEOT-UHFFFAOYSA-N 0 3 413.403 4.273 20 0 HIADHN C[C@H](CN1CCN(CCCOCC(F)(F)F)CC1)c1cccc(Br)c1 ZINC000512082704 920846643 /nfs/dbraw/zinc/84/66/43/920846643.db2.gz KXRUBJNCMSRMPJ-OAHLLOKOSA-N 0 3 423.317 4.139 20 0 HIADHN CCCNC(=O)Nc1ccc(CC(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)cc1 ZINC000512096193 920858030 /nfs/dbraw/zinc/85/80/30/920858030.db2.gz WSSPNZVNUVREQN-QHCPKHFHSA-N 0 3 422.573 4.022 20 0 HIADHN FC(F)(F)c1ccc(-n2cc(CNCc3ccccc3Cn3ccnc3)cn2)cc1 ZINC000512114550 920868419 /nfs/dbraw/zinc/86/84/19/920868419.db2.gz HGLWMJHYRCIFGQ-UHFFFAOYSA-N 0 3 411.431 4.426 20 0 HIADHN C[C@@H](NC(=O)c1cccnc1Oc1ccc(Br)cc1)C1=CCN(C)CC1 ZINC000512144639 920888693 /nfs/dbraw/zinc/88/86/93/920888693.db2.gz VFXXKHQWUSMYLF-CQSZACIVSA-N 0 3 416.319 4.017 20 0 HIADHN COc1ccc(CN[C@@H](C)CC(=O)Nc2cc(C(F)(F)F)ccc2Cl)cn1 ZINC000512147182 920889684 /nfs/dbraw/zinc/88/96/84/920889684.db2.gz SMNZLJDKVRSGFP-NSHDSACASA-N 0 3 401.816 4.269 20 0 HIADHN C[C@H]1CC[C@@H](c2ccccc2)N(CC(=O)N2CCC(C(=O)Nc3ccccc3)CC2)C1 ZINC000512154531 920894548 /nfs/dbraw/zinc/89/45/48/920894548.db2.gz YVHLZKIWNMWBAK-RDPSFJRHSA-N 0 3 419.569 4.337 20 0 HIADHN O=c1[n-]c(CN2CC[C@]3(CC[N@H+](Cc4ccccc4)C3)C2)nc2c3ccccc3oc21 ZINC000512292924 921048504 /nfs/dbraw/zinc/04/85/04/921048504.db2.gz QYPJOYJMAFQCSI-VWLOTQADSA-N 0 3 414.509 4.180 20 0 HIADHN O=c1[n-]c(CN2CC[C@]3(CC[N@@H+](Cc4ccccc4)C3)C2)nc2c3ccccc3oc21 ZINC000512292924 921048520 /nfs/dbraw/zinc/04/85/20/921048520.db2.gz QYPJOYJMAFQCSI-VWLOTQADSA-N 0 3 414.509 4.180 20 0 HIADHN COc1c(Br)cc(Br)cc1CN(C)C[C@@H]1CCCOC1 ZINC000513454917 921820995 /nfs/dbraw/zinc/82/09/95/921820995.db2.gz IUNUGHFJAHBNTL-NSHDSACASA-N 0 3 407.146 4.079 20 0 HIADHN COc1ccc(NC(=O)C[C@H](C)NCc2ccc(-c3csc(C)n3)o2)c(OC)c1 ZINC000513581994 921914076 /nfs/dbraw/zinc/91/40/76/921914076.db2.gz FQKOANLPAUACPO-ZDUSSCGKSA-N 0 3 415.515 4.236 20 0 HIADHN CCCN(CC(=O)Nc1ccccc1N1CCCC1=O)[C@H]1CCc2ccccc2C1 ZINC000513632206 921958178 /nfs/dbraw/zinc/95/81/78/921958178.db2.gz AJZMYKUFJZPAEC-NRFANRHFSA-N 0 3 405.542 4.021 20 0 HIADHN O=C(Nc1cccc(CN2CCCN(c3cccnn3)CC2)c1)c1ccccc1Cl ZINC000513637840 921961421 /nfs/dbraw/zinc/96/14/21/921961421.db2.gz MXTDZTAWIFIGAR-UHFFFAOYSA-N 0 3 421.932 4.095 20 0 HIADHN Clc1cccc([C@H](CN[C@@H](c2ncc[nH]2)C2CCCCC2)N2CCOCC2)c1 ZINC000513656028 921977685 /nfs/dbraw/zinc/97/76/85/921977685.db2.gz PUWZLPJGJXKQDM-LEWJYISDSA-N 0 3 402.970 4.348 20 0 HIADHN COc1cc(CN2CCC[C@@H](c3nnc4n3CCC4)C2)ccc1OCc1ccccc1 ZINC000513678650 922000825 /nfs/dbraw/zinc/00/08/25/922000825.db2.gz QKHFOXBEUMAGPO-OAQYLSRUSA-N 0 3 418.541 4.192 20 0 HIADHN COc1ccc(C(=O)N(CCN2CCCC2)Cc2ccc(Cl)cc2)c(OC)c1 ZINC000513715360 922034249 /nfs/dbraw/zinc/03/42/49/922034249.db2.gz OQYSUUCXZILLKG-UHFFFAOYSA-N 0 3 402.922 4.095 20 0 HIADHN C[C@@H](CCOCc1ccccc1)NC(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000513716278 922035767 /nfs/dbraw/zinc/03/57/67/922035767.db2.gz ZIFYZRKWSQBTDL-NRFANRHFSA-N 0 3 409.574 4.288 20 0 HIADHN CC(=O)N(C)C1CCN(C[C@@H](O)COc2ccc(C(C)(C)CC(C)(C)C)cc2)CC1 ZINC000513820231 922143717 /nfs/dbraw/zinc/14/37/17/922143717.db2.gz LORNNOFCQBAOSE-JOCHJYFZSA-N 0 3 418.622 4.083 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3nc(-c4ccccc4)cs3)CC2)C[C@@H](C)O1 ZINC000513831450 922158172 /nfs/dbraw/zinc/15/81/72/922158172.db2.gz RMUBMHRNOQEIMX-QZTJIDSGSA-N 0 3 413.587 4.162 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1nc(-c2ccccc2)cs1 ZINC000513840152 922167158 /nfs/dbraw/zinc/16/71/58/922167158.db2.gz XYBPVGAUQSZNMC-UHFFFAOYSA-N 0 3 407.539 4.267 20 0 HIADHN CN1CCN(CCCNC(=O)Nc2cccc(C(F)F)c2)[C@@H](c2ccccc2)C1 ZINC000513920013 922242050 /nfs/dbraw/zinc/24/20/50/922242050.db2.gz IGIMXRVMSRQDRK-HXUWFJFHSA-N 0 3 402.489 4.125 20 0 HIADHN COc1ccc(C(=O)C[C@H](C)C(=O)N[C@H]2CCN(Cc3ccccc3)CC2(C)C)cc1 ZINC000513921174 922244592 /nfs/dbraw/zinc/24/45/92/922244592.db2.gz YCFRHBIOHVANDE-CYFREDJKSA-N 0 3 422.569 4.321 20 0 HIADHN C[C@H](c1ccccc1Cl)N1CCN(C[C@@H]2CCN(C(=O)c3ccccc3)C2)CC1 ZINC000513965290 922282989 /nfs/dbraw/zinc/28/29/89/922282989.db2.gz WSNQEBIFJLCERZ-UXHICEINSA-N 0 3 411.977 4.181 20 0 HIADHN COCCN1CCC(NC(=O)N[C@@H](CCCc2ccccc2)c2ccccc2)CC1 ZINC000514028692 922351569 /nfs/dbraw/zinc/35/15/69/922351569.db2.gz IPAVTYWSOZXMJC-DEOSSOPVSA-N 0 3 409.574 4.161 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCc1ccc(C)nc1)c1ccc(C(F)(F)F)cc1 ZINC000514075652 922398302 /nfs/dbraw/zinc/39/83/02/922398302.db2.gz JUYKWYPHGVMPRG-IBGZPJMESA-N 0 3 408.468 4.291 20 0 HIADHN Cc1nc2ccccc2nc1CN1CCC[C@H](CNC(=O)Nc2cccc(F)c2)C1 ZINC000514093477 922416438 /nfs/dbraw/zinc/41/64/38/922416438.db2.gz HGXAIJMZLBVIFF-QGZVFWFLSA-N 0 3 407.493 4.111 20 0 HIADHN CC[C@@H](NCc1ccc(N2CCO[C@@H](C)C2)nc1)c1ccc(OC(F)(F)F)cc1 ZINC000514095258 922419985 /nfs/dbraw/zinc/41/99/85/922419985.db2.gz QCOINBHPTNYYDM-HNAYVOBHSA-N 0 3 409.452 4.446 20 0 HIADHN COc1ccc(C[C@@H](C)N[C@H](CCSC)c2nnc3ccccn32)c(C)c1OC ZINC000514096197 922421995 /nfs/dbraw/zinc/42/19/95/922421995.db2.gz VCNFHGZBXZLBMI-CRAIPNDOSA-N 0 3 414.575 4.070 20 0 HIADHN CCCNC(=O)c1cccc(CN[C@H](Cc2ccncc2)c2ccc(OC)cc2)c1 ZINC000514104083 922432342 /nfs/dbraw/zinc/43/23/42/922432342.db2.gz HJUVEVVHPJTGDC-XMMPIXPASA-N 0 3 403.526 4.304 20 0 HIADHN CCCNC(=O)c1cccc(CN[C@@H](Cc2ccncc2)c2ccc(OC)cc2)c1 ZINC000514104082 922432987 /nfs/dbraw/zinc/43/29/87/922432987.db2.gz HJUVEVVHPJTGDC-DEOSSOPVSA-N 0 3 403.526 4.304 20 0 HIADHN CO[C@H](C)c1nc(CN2CCCN(C[C@@H](OC)c3ccc(Cl)cc3)CC2)cs1 ZINC000514108073 922437822 /nfs/dbraw/zinc/43/78/22/922437822.db2.gz UUXRQWWQUXNRJS-OXQOHEQNSA-N 0 3 424.010 4.399 20 0 HIADHN CC[C@@H](C)N(Cc1nc2ccccc2c(=O)[nH]1)C[C@@H]1CCN(C(=O)c2ccccc2)C1 ZINC000514118810 922452400 /nfs/dbraw/zinc/45/24/00/922452400.db2.gz NJUGHYIRXPMGTF-RTBURBONSA-N 0 3 418.541 4.098 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)N[C@@H]3CCc4cc(F)ccc43)CC2)c1 ZINC000514139161 922472812 /nfs/dbraw/zinc/47/28/12/922472812.db2.gz XFKBERZUCUZMJX-XMMPIXPASA-N 0 3 424.564 4.023 20 0 HIADHN CC(C)COC[C@@H](NC(=O)NC[C@@H](c1cccs1)N1CCCC1)c1ccco1 ZINC000514150165 922485686 /nfs/dbraw/zinc/48/56/86/922485686.db2.gz YEOBEFBNKXXVBR-MSOLQXFVSA-N 0 3 405.564 4.191 20 0 HIADHN CCOc1cccc([C@@H](C)NC(=O)NC[C@H](c2cccc(OC)c2)N2CCCC2)c1 ZINC000514154322 922491501 /nfs/dbraw/zinc/49/15/01/922491501.db2.gz SBKUSWHTVMUONF-WZONZLPQSA-N 0 3 411.546 4.291 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N[C@@H](C)c2cccc(N3CCCC3=O)c2)N(C)C)cc1 ZINC000514161839 922500350 /nfs/dbraw/zinc/50/03/50/922500350.db2.gz FYRAWKBBZMTVAV-MBSDFSHPSA-N 0 3 422.573 4.039 20 0 HIADHN CN(C)[C@@H](CNC(=O)N[C@@H]1CCCc2cc(OC(F)F)ccc21)Cc1ccccc1 ZINC000514176713 922514643 /nfs/dbraw/zinc/51/46/43/922514643.db2.gz UTBICHGLNMZLSJ-WIYYLYMNSA-N 0 3 417.500 4.138 20 0 HIADHN COc1cccc([C@H](CNC(=O)NCc2ccc3[nH]c(C)c(C)c3c2)N2CCCC2)c1 ZINC000514187121 922526843 /nfs/dbraw/zinc/52/68/43/922526843.db2.gz OQPWHXVBESCGDW-DEOSSOPVSA-N 0 3 420.557 4.430 20 0 HIADHN CC[C@H]1C[C@H](CC(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)CCO1 ZINC000514190147 922530539 /nfs/dbraw/zinc/53/05/39/922530539.db2.gz PTOKLHAVQWAITC-MJGOQNOKSA-N 0 3 400.485 4.191 20 0 HIADHN C[C@H](NC(=O)N[C@@H](CN1CCCC1)c1ccccc1)c1cccc(N2CCCC2=O)c1 ZINC000514207001 922544060 /nfs/dbraw/zinc/54/40/60/922544060.db2.gz XWMBMYKGRDTMKK-CVDCTZTESA-N 0 3 420.557 4.011 20 0 HIADHN O=C(NCc1sccc1Br)N[C@H](CN1CCCC1)c1ccccc1 ZINC000514221620 922556165 /nfs/dbraw/zinc/55/61/65/922556165.db2.gz ISSGMDGWSVWORG-MRXNPFEDSA-N 0 3 408.365 4.147 20 0 HIADHN CCCN(CCCS(=O)(=O)c1ccc(NC(C)=O)cc1)[C@@H]1CCc2ccccc21 ZINC000514224133 922560147 /nfs/dbraw/zinc/56/01/47/922560147.db2.gz XZHSLSWLUCSUCT-HSZRJFAPSA-N 0 3 414.571 4.208 20 0 HIADHN O=C(Nc1ccc(Br)cn1)[C@H]1CCCN(C/C=C\c2ccccc2)C1 ZINC000514231360 922568307 /nfs/dbraw/zinc/56/83/07/922568307.db2.gz WUUCPMTUEJJOOS-LYLYKKCESA-N 0 3 400.320 4.208 20 0 HIADHN CCC[C@@H](NC(=O)NC[C@H](c1ccsc1)N(CC)CC)c1nnc2ccccn21 ZINC000514242242 922582386 /nfs/dbraw/zinc/58/23/86/922582386.db2.gz QZQWKQVSDJZDDG-QZTJIDSGSA-N 0 3 414.579 4.014 20 0 HIADHN CC(C)[C@@H](NC(=O)NC[C@@H](c1ccccc1)N1CCCC1)c1ccc2c(c1)OCCO2 ZINC000514442598 922628933 /nfs/dbraw/zinc/62/89/33/922628933.db2.gz CZWAFSXGABMDMR-XUZZJYLKSA-N 0 3 423.557 4.291 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)c1nn(-c2ccccc2F)c2c1CCC2 ZINC000514500079 922651976 /nfs/dbraw/zinc/65/19/76/922651976.db2.gz HKCYIPDAWHYHGG-OAQYLSRUSA-N 0 3 418.516 4.067 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)NC[C@H](c2ccccc2)N(C)C)c(C(F)(F)F)c1 ZINC000514504688 922655329 /nfs/dbraw/zinc/65/53/29/922655329.db2.gz XFBCJFKLOMSUNX-GOSISDBHSA-N 0 3 408.424 4.088 20 0 HIADHN C[C@@H](N[C@H]1CCCc2cc(S(N)(=O)=O)ccc21)c1ccc(-c2cccnc2)cc1 ZINC000514619438 922724938 /nfs/dbraw/zinc/72/49/38/922724938.db2.gz YYLDWZIMLCVCBL-MWTRTKDXSA-N 0 3 407.539 4.124 20 0 HIADHN CC[NH+](CC)Cc1ccc(C[N-]S(=O)(=O)c2cc(Cl)sc2Cl)cc1 ZINC000514689112 922756990 /nfs/dbraw/zinc/75/69/90/922756990.db2.gz UODZWUCIXBVDHR-UHFFFAOYSA-N 0 3 407.388 4.375 20 0 HIADHN Fc1ccc(CC2(NCc3nnc(C4CC4)n3C3CC3)CCOCC2)c(Cl)c1 ZINC000514877763 922828467 /nfs/dbraw/zinc/82/84/67/922828467.db2.gz QBIVKNYVODATRF-UHFFFAOYSA-N 0 3 404.917 4.164 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@@H](O)C2)c1)c1cc2cc(Br)ccc2o1 ZINC000514957530 922852800 /nfs/dbraw/zinc/85/28/00/922852800.db2.gz ICEPIKAAUGSRLI-QGZVFWFLSA-N 0 3 415.287 4.014 20 0 HIADHN CCOCCOc1ccc(Br)cc1CN1CC[C@@H](C2CCOCC2)C1 ZINC000514956416 922852827 /nfs/dbraw/zinc/85/28/27/922852827.db2.gz HHKYGMHTDJKTTF-QGZVFWFLSA-N 0 3 412.368 4.113 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cc(-c4cccc(F)c4)no3)c(C)c2)CC1 ZINC000515076850 922895447 /nfs/dbraw/zinc/89/54/47/922895447.db2.gz WIRJEJRJDIAWLP-UHFFFAOYSA-N 0 3 408.477 4.183 20 0 HIADHN C[C@H]1C[C@@H]1N1CCN(C(=O)c2cc(F)c(Br)cc2Cl)C[C@@H](C)C1 ZINC000515079669 922896216 /nfs/dbraw/zinc/89/62/16/922896216.db2.gz ACZKWBSGRCWEDU-MMPTUQATSA-N 0 3 403.723 4.044 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)Nc2cc(OC)c(Cl)cc2OC)N(C)C)cc1 ZINC000515110960 922924567 /nfs/dbraw/zinc/92/45/67/922924567.db2.gz KNGLPNIPHYMIGN-GOSISDBHSA-N 0 3 405.926 4.344 20 0 HIADHN COc1cccc([C@@H](CNC(=O)Nc2cccc(NC(=O)C(C)C)c2)N2CCCC2)c1 ZINC000515120201 922933672 /nfs/dbraw/zinc/93/36/72/922933672.db2.gz DBUKRJNGYLQUOX-JOCHJYFZSA-N 0 3 424.545 4.248 20 0 HIADHN O=C(CCCc1ccccc1Cl)NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000515259484 923023011 /nfs/dbraw/zinc/02/30/11/923023011.db2.gz ROWYTCLPENXBGJ-OAQYLSRUSA-N 0 3 400.950 4.070 20 0 HIADHN Cc1ccc(Oc2ccccc2NC(=O)C(=O)NC[C@H](C)N2CCCC[C@@H]2C)cc1 ZINC000515277873 923031021 /nfs/dbraw/zinc/03/10/21/923031021.db2.gz MHLQMXVDLFUCRB-OALUTQOASA-N 0 3 409.530 4.105 20 0 HIADHN CCc1ccc([C@H](C)NC(=O)[C@H](C)N[C@@H](C)c2ccc(NC(=O)NC3CC3)cc2)cc1 ZINC000515517117 923146907 /nfs/dbraw/zinc/14/69/07/923146907.db2.gz FHNHYAARYHTGCE-BZSNNMDCSA-N 0 3 422.573 4.449 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N[C@H](C)c1c(F)cccc1F)c1cccc(OC)c1 ZINC000515528784 923157881 /nfs/dbraw/zinc/15/78/81/923157881.db2.gz NSVFWPWSJSZZSM-QRWLVFNGSA-N 0 3 405.489 4.417 20 0 HIADHN CC(C)c1ccccc1NC(=O)[C@@H](C)N[C@@H](C)c1ccc(OCC(=O)NC2CC2)cc1 ZINC000515759583 923332808 /nfs/dbraw/zinc/33/28/08/923332808.db2.gz PXYWGZNRODSSJR-ZWKOTPCHSA-N 0 3 423.557 4.145 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)N1CCC[C@H]1c1cccc(F)c1 ZINC000515791406 923352059 /nfs/dbraw/zinc/35/20/59/923352059.db2.gz ZAKRTANQPNVLRL-DEOSSOPVSA-N 0 3 424.564 4.275 20 0 HIADHN CC(C)Oc1ccccc1[C@H](C)NC(=O)N(CCN(C)C)Cc1ccccc1F ZINC000515838562 923385131 /nfs/dbraw/zinc/38/51/31/923385131.db2.gz CEIBTZNMJQFINM-SFHVURJKSA-N 0 3 401.526 4.447 20 0 HIADHN CC(C)C1CCC(N2CCN(c3nnc(C4CC4)n3C[C@H]3CCCCO3)CC2)CC1 ZINC000515876374 923407551 /nfs/dbraw/zinc/40/75/51/923407551.db2.gz AGAFOSRAGYYCCX-KITAHSCOSA-N 0 3 415.626 4.061 20 0 HIADHN CN(C)Cc1cccc(NC(=O)C(=O)N[C@H](CCc2ccccc2)c2ccccc2)c1 ZINC000516046972 923519575 /nfs/dbraw/zinc/51/95/75/923519575.db2.gz WOCOWJVFBGWPKV-XMMPIXPASA-N 0 3 415.537 4.177 20 0 HIADHN Cc1nc2ccc(Br)cc2c(NCc2cnn(CC(F)(F)F)c2)c1C ZINC000516128585 923561696 /nfs/dbraw/zinc/56/16/96/923561696.db2.gz WKLCCKMPSQHUPV-UHFFFAOYSA-N 0 3 413.241 4.407 20 0 HIADHN Cc1noc(C)c1CSCC(=O)NC[C@H](c1ccccc1)N1CCC(C)CC1 ZINC000516138742 923569746 /nfs/dbraw/zinc/56/97/46/923569746.db2.gz LBCUMOUMFXTOMD-OAQYLSRUSA-N 0 3 401.576 4.114 20 0 HIADHN CN(Cc1csc(Br)c1)C(=O)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000516260428 923633464 /nfs/dbraw/zinc/63/34/64/923633464.db2.gz XJSLALWOHHYRBH-KRWDZBQOSA-N 0 3 422.392 4.489 20 0 HIADHN C[C@@H](CNC(=O)CSc1nnc(-c2ccc3ccccc3c2)o1)N1CCCC[C@@H]1C ZINC000516491430 923756849 /nfs/dbraw/zinc/75/68/49/923756849.db2.gz GVIKOUKJMVDDAY-IRXDYDNUSA-N 0 3 424.570 4.361 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1cc(C)n(-c2ccc(F)cc2F)n1)c1ccco1 ZINC000516600596 923808969 /nfs/dbraw/zinc/80/89/69/923808969.db2.gz VMIQGQOUODZEHF-GUYCJALGSA-N 0 3 417.460 4.303 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)c2ccccc2OCc2ccncc2)C1 ZINC000516623196 923820332 /nfs/dbraw/zinc/82/03/32/923820332.db2.gz XGTQWBCZICJQKG-SIKLNZKXSA-N 0 3 401.510 4.226 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)NCc2cccc(Cl)c2Cl)c1 ZINC000516624026 923820656 /nfs/dbraw/zinc/82/06/56/923820656.db2.gz SKCJUBDATOEYNF-UHFFFAOYSA-N 0 3 410.345 4.275 20 0 HIADHN O=C(NCCCCN1CCN(Cc2ccccc2)CC1)c1cc2sccc2s1 ZINC000517105582 924000574 /nfs/dbraw/zinc/00/05/74/924000574.db2.gz BDSYUDCVFZEIAQ-UHFFFAOYSA-N 0 3 413.612 4.291 20 0 HIADHN C[C@H](O)CN(CC(=O)N1N=C(c2cccs2)C[C@H]1c1ccco1)C1CCCCC1 ZINC000517119198 924008032 /nfs/dbraw/zinc/00/80/32/924008032.db2.gz PBXAWKKSMUPVIX-LPHOPBHVSA-N 0 3 415.559 4.034 20 0 HIADHN CC[C@@H](NC(=O)NC[C@H](c1cccc(OC)c1)N1CCCC1)c1nc(C)cs1 ZINC000517136874 924020264 /nfs/dbraw/zinc/02/02/64/924020264.db2.gz TZFRYPWFYPQNRG-RTBURBONSA-N 0 3 402.564 4.048 20 0 HIADHN Clc1ccc(-c2nnc(CN3CCN(c4ccnc5ccccc54)CC3)o2)cc1 ZINC000517202628 924050152 /nfs/dbraw/zinc/05/01/52/924050152.db2.gz PCPVWQUNNHZHAP-UHFFFAOYSA-N 0 3 405.889 4.260 20 0 HIADHN CC[C@@H]1CN(c2nnc(C(C)C)n2C[C@H]2CCCCO2)CCN1Cc1ccccc1 ZINC000517248891 924059077 /nfs/dbraw/zinc/05/90/77/924059077.db2.gz GWUWTDUKOOQVAZ-FGZHOGPDSA-N 0 3 411.594 4.071 20 0 HIADHN CN(C)CCn1c(=O)oc2ccc(NC(=O)c3cscc3-c3ccccc3)cc21 ZINC000517265753 924069464 /nfs/dbraw/zinc/06/94/64/924069464.db2.gz VCGSWCBVCUKXEB-UHFFFAOYSA-N 0 3 407.495 4.137 20 0 HIADHN Cc1nc(CCC(=O)NCCCN2CCc3ccccc3C2)oc1-c1ccccc1 ZINC000517353907 924127038 /nfs/dbraw/zinc/12/70/38/924127038.db2.gz WIZVZSVZYZYBIB-UHFFFAOYSA-N 0 3 403.526 4.147 20 0 HIADHN CC1(C)CN(C2(CNC(=O)Nc3cccc(N4CCCC4)c3)CCCCC2)CCO1 ZINC000517505014 924235629 /nfs/dbraw/zinc/23/56/29/924235629.db2.gz YKQJORLFPXJOAK-UHFFFAOYSA-N 0 3 414.594 4.222 20 0 HIADHN CN(C[C@@H](O)COc1ccccc1)[C@H]1CCSc2ccc(Br)cc21 ZINC000517526746 924246796 /nfs/dbraw/zinc/24/67/96/924246796.db2.gz BZZOTLFWSYMUSR-QAPCUYQASA-N 0 3 408.361 4.358 20 0 HIADHN COc1cc(OC)cc(C(=O)N(CCN2CCCC2)Cc2ccc(Cl)cc2)c1 ZINC000517635677 926744098 /nfs/dbraw/zinc/74/40/98/926744098.db2.gz BJCOUQUXWLXARS-UHFFFAOYSA-N 0 3 402.922 4.095 20 0 HIADHN Cc1ccc(-c2cc(C(=O)N(C)[C@H]3CCN(C4CC4)C3)c3cnn(C(C)C)c3n2)cc1 ZINC000517693623 926798080 /nfs/dbraw/zinc/79/80/80/926798080.db2.gz VDWYCOSMHJQOQF-FQEVSTJZSA-N 0 3 417.557 4.296 20 0 HIADHN CN(C(=O)[C@H](Oc1ccc(F)cc1Cl)c1ccccc1)[C@@H]1CCN(C2CC2)C1 ZINC000517697337 926800711 /nfs/dbraw/zinc/80/07/11/926800711.db2.gz ONRSCWKYDUXEMO-WIYYLYMNSA-N 0 3 402.897 4.294 20 0 HIADHN C[C@@H](CNC(=O)N(C)CCc1ccc(Br)cc1)N(C)Cc1ccccc1 ZINC000517703945 926803937 /nfs/dbraw/zinc/80/39/37/926803937.db2.gz VZNRZYSXGSVCMQ-KRWDZBQOSA-N 0 3 418.379 4.154 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N1CCC(COc2ccccc2)CC1 ZINC000517715045 926811396 /nfs/dbraw/zinc/81/13/96/926811396.db2.gz ZOCLHLPQJRLMAC-OAQYLSRUSA-N 0 3 413.587 4.386 20 0 HIADHN CN(Cc1csc(Br)c1)C(=O)N[C@H](CN1CCCC1)c1ccccc1 ZINC000517792221 926839289 /nfs/dbraw/zinc/83/92/89/926839289.db2.gz LYDZCHZUMSVTDU-QGZVFWFLSA-N 0 3 422.392 4.489 20 0 HIADHN C[C@H](CN1CCC[C@@H](C)C1)NC(=O)C(=O)Nc1ccccc1Sc1ccccc1 ZINC000517816299 926849651 /nfs/dbraw/zinc/84/96/51/926849651.db2.gz WNZNMQPUVLCNKN-QZTJIDSGSA-N 0 3 411.571 4.013 20 0 HIADHN CCC(CC)(C(=O)NCCCCN1CCN(C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000517824442 926854086 /nfs/dbraw/zinc/85/40/86/926854086.db2.gz TVTRKWMOKSNJCQ-UHFFFAOYSA-N 0 3 414.421 4.195 20 0 HIADHN Cc1ccc(CCC2CCN(C(=O)[C@H]3CCCN(Cc4cccnc4)C3)CC2)cc1 ZINC000517896239 926880530 /nfs/dbraw/zinc/88/05/30/926880530.db2.gz DRWIJZSJRFYTGB-VWLOTQADSA-N 0 3 405.586 4.473 20 0 HIADHN CN(C)Cc1ccc(S(=O)(=O)N(Cc2ccccc2F)c2ccccc2F)cc1 ZINC000517999712 926941144 /nfs/dbraw/zinc/94/11/44/926941144.db2.gz YKIVVGVUWVGHAB-UHFFFAOYSA-N 0 3 416.493 4.422 20 0 HIADHN C[C@@H](NC(=O)N(CCN(C)C)Cc1cccc(F)c1)c1nc(C(C)(C)C)cs1 ZINC000518030609 926967991 /nfs/dbraw/zinc/96/79/91/926967991.db2.gz PTYPMPOCAUZLHD-OAHLLOKOSA-N 0 3 406.571 4.414 20 0 HIADHN CN(C)[C@@H](CNC(=O)Nc1nnc(C(C)(C)c2ccccc2)s1)c1ccccc1 ZINC000518055068 926992447 /nfs/dbraw/zinc/99/24/47/926992447.db2.gz KDPXAJIDKLKNHJ-SFHVURJKSA-N 0 3 409.559 4.288 20 0 HIADHN COC1CCN(C(C)(C)CNC(=O)[C@H](C)Sc2cc(Cl)ccc2Cl)CC1 ZINC000518082879 927011896 /nfs/dbraw/zinc/01/18/96/927011896.db2.gz ADSONAJFIOABMH-ZDUSSCGKSA-N 0 3 419.418 4.480 20 0 HIADHN Clc1ccccc1[C@@H](CNCc1ccccc1Br)N1CCOCC1 ZINC000518267954 927126597 /nfs/dbraw/zinc/12/65/97/927126597.db2.gz AXMVWZPJFNRXBX-LJQANCHMSA-N 0 3 409.755 4.266 20 0 HIADHN COCC(=O)Nc1cccc(CNCc2cc(OC)c(OC)cc2-c2ccccc2)c1 ZINC000518268100 927126889 /nfs/dbraw/zinc/12/68/89/927126889.db2.gz DTPDBLQAQTXAOQ-UHFFFAOYSA-N 0 3 420.509 4.246 20 0 HIADHN COCCNc1ccc(CNCc2c(C)nn(-c3ccc(F)cc3F)c2C)cc1 ZINC000518274637 927133728 /nfs/dbraw/zinc/13/37/28/927133728.db2.gz OWURYOQNRTUZGD-UHFFFAOYSA-N 0 3 400.473 4.115 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)c1ccc(Cl)c2cccnc12 ZINC000518286006 927143129 /nfs/dbraw/zinc/14/31/29/927143129.db2.gz SDESXSVYVLBYIK-UHFFFAOYSA-N 0 3 422.960 4.220 20 0 HIADHN Fc1ccc(OCCNCc2cnn(-c3ccc(Br)cc3)c2)cc1F ZINC000518287250 927146806 /nfs/dbraw/zinc/14/68/06/927146806.db2.gz YXRJUXDPDABOAB-UHFFFAOYSA-N 0 3 408.246 4.082 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)Nc3ccc4oc(C5CC5)nc4c3)CC2)C[C@H](C)O1 ZINC000518313288 927174924 /nfs/dbraw/zinc/17/49/24/927174924.db2.gz GEEVXRADYOPREB-HOTGVXAUSA-N 0 3 412.534 4.058 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)Nc3cccc(Cl)c3Cl)CC2)C[C@H](C)O1 ZINC000518316869 927180466 /nfs/dbraw/zinc/18/04/66/927180466.db2.gz ZJBUVVFJDLYYNF-KBPBESRZSA-N 0 3 400.350 4.347 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)N(Cc1ccc(F)cc1F)C1CC1 ZINC000518357251 927217987 /nfs/dbraw/zinc/21/79/87/927217987.db2.gz LEKVMMRTRSZEHQ-UHFFFAOYSA-N 0 3 413.512 4.058 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)N1CCC[C@H]1Cc1ccccc1 ZINC000518356683 927218473 /nfs/dbraw/zinc/21/84/73/927218473.db2.gz DILYUOIIWFIIBP-VWLOTQADSA-N 0 3 420.601 4.006 20 0 HIADHN C[C@H](C(=O)NC[C@@H]1CCN(c2ccc(F)cc2)C1)N1CCC(Cc2ccccc2)CC1 ZINC000518385893 927233495 /nfs/dbraw/zinc/23/34/95/927233495.db2.gz FKIVTSPXOSMWFV-OFNKIYASSA-N 0 3 423.576 4.111 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)NCc2cccc(OCC(F)(F)F)c2)C1 ZINC000518403657 927244430 /nfs/dbraw/zinc/24/44/30/927244430.db2.gz QPMPJUFQKFUZTO-VQIMIIECSA-N 0 3 421.463 4.262 20 0 HIADHN CC[C@H](NC(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1)c1ccc2c(c1)OCCO2 ZINC000518406877 927248075 /nfs/dbraw/zinc/24/80/75/927248075.db2.gz JTCIYGHYRXCRJZ-UIFIKXQLSA-N 0 3 409.530 4.044 20 0 HIADHN COc1ccc2cc(CNC(=O)N[C@@H]3CCN([C@@H](C)c4ccccc4)C3)ccc2c1 ZINC000518409554 927249575 /nfs/dbraw/zinc/24/95/75/927249575.db2.gz CWACKNXHBVZWLX-FDDCHVKYSA-N 0 3 403.526 4.483 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)NCc2ccc(OC(F)(F)F)cc2)C1 ZINC000518409644 927251260 /nfs/dbraw/zinc/25/12/60/927251260.db2.gz LGSVUCCWMFKLCK-MAUKXSAKSA-N 0 3 407.436 4.220 20 0 HIADHN C[C@H](NC(=O)N1CCCN(Cc2ccccc2)CC1)c1nc(C(C)(C)C)cs1 ZINC000518540942 927336292 /nfs/dbraw/zinc/33/62/92/927336292.db2.gz LJVKZLUDKNKULL-KRWDZBQOSA-N 0 3 400.592 4.419 20 0 HIADHN Cc1c(C(=O)N(CCN(C)C)Cc2ccccc2F)cnn1-c1cccc(Cl)c1 ZINC000518640207 927396526 /nfs/dbraw/zinc/39/65/26/927396526.db2.gz YSHOPCGUEYGRLK-UHFFFAOYSA-N 0 3 414.912 4.177 20 0 HIADHN CN(CCN1CCN(CCOc2ccc(Cl)cc2Cl)CC1)Cc1ccccc1 ZINC000518722595 927454999 /nfs/dbraw/zinc/45/49/99/927454999.db2.gz NDJULLVYEYOJGA-UHFFFAOYSA-N 0 3 422.400 4.122 20 0 HIADHN COc1cc(CNCc2ccc(NC(=O)c3ccc(F)cc3)cc2)cc(OC)c1O ZINC000518746263 927472258 /nfs/dbraw/zinc/47/22/58/927472258.db2.gz OWKYWNJICPLDPL-UHFFFAOYSA-N 0 3 410.445 4.091 20 0 HIADHN COc1cc(Br)c(CN[C@H]2CCN([C@H](C)c3ccccc3)C2)cc1OC ZINC000518774658 927486412 /nfs/dbraw/zinc/48/64/12/927486412.db2.gz ZFQITGPBUXPGDZ-QAPCUYQASA-N 0 3 419.363 4.391 20 0 HIADHN CCn1c(CNC[C@@H]2CCN(c3cccc(Br)c3)C2)nc2ccccc21 ZINC000518780046 927488807 /nfs/dbraw/zinc/48/88/07/927488807.db2.gz BPZQLNPSQNLFHV-INIZCTEOSA-N 0 3 413.363 4.435 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)Nc3cc(Cl)ccc3N(C)C)cc2)CC1 ZINC000518803856 927501967 /nfs/dbraw/zinc/50/19/67/927501967.db2.gz MUOYYBSGYBRIPV-UHFFFAOYSA-N 0 3 400.954 4.189 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)NCC3(Sc4ccccc4)CC3)cc2)CC1 ZINC000518808740 927504988 /nfs/dbraw/zinc/50/49/88/927504988.db2.gz LNLDZZGNUMJJLI-UHFFFAOYSA-N 0 3 409.599 4.272 20 0 HIADHN CCc1cccc(CC)c1NC(=O)CN1CCN(c2ccnc3ccccc32)CC1 ZINC000518836900 927535649 /nfs/dbraw/zinc/53/56/49/927535649.db2.gz VOFMUIJHOWFCCA-UHFFFAOYSA-N 0 3 402.542 4.120 20 0 HIADHN CSc1ccc(O[C@@H](C)C(=O)N2CCN(c3ccnc4ccccc43)CC2)cc1 ZINC000518853707 927558751 /nfs/dbraw/zinc/55/87/51/927558751.db2.gz MQUJERVSFPEVQA-KRWDZBQOSA-N 0 3 407.539 4.073 20 0 HIADHN O=C(c1ccc2c(c1)OCCCO2)N(CCN1CCCC1)Cc1ccc(Cl)cc1 ZINC000518878964 927591683 /nfs/dbraw/zinc/59/16/83/927591683.db2.gz DRPSYCHUCGVYPN-UHFFFAOYSA-N 0 3 414.933 4.240 20 0 HIADHN CCN(C(=O)CCCN1CCN(c2ccccc2)CC1)[C@@H](C)c1cccc(OC)c1 ZINC000518887705 927598898 /nfs/dbraw/zinc/59/88/98/927598898.db2.gz QIWSLJCRZSHJPW-NRFANRHFSA-N 0 3 409.574 4.207 20 0 HIADHN Cc1nc(-c2ccc(CNC(=O)NC[C@H](C)N(C)Cc3ccccc3)s2)cs1 ZINC000518968802 927662614 /nfs/dbraw/zinc/66/26/14/927662614.db2.gz WXEYWGQSOQQNCE-HNNXBMFYSA-N 0 3 414.600 4.500 20 0 HIADHN COc1cccc(COC[C@@H](O)CN2CCC[C@@H]2Cc2c(F)cccc2Cl)c1 ZINC000519000272 927682451 /nfs/dbraw/zinc/68/24/51/927682451.db2.gz CFPABCCJRGNBMJ-MSOLQXFVSA-N 0 3 407.913 4.072 20 0 HIADHN C[C@H](NC(=O)C(=O)Nc1cccc(-c2ccccc2)c1)[C@H](c1ccccc1)N(C)C ZINC000519007436 927686551 /nfs/dbraw/zinc/68/65/51/927686551.db2.gz SQGGHGTZAVANRL-FDDCHVKYSA-N 0 3 401.510 4.100 20 0 HIADHN COc1cc(CN(C)C(=O)N[C@H]2CCN(Cc3ccccc3)[C@@H]2C)ccc1SC ZINC000519020277 927698745 /nfs/dbraw/zinc/69/87/45/927698745.db2.gz AFWOGNNVUDMITE-XLIONFOSSA-N 0 3 413.587 4.222 20 0 HIADHN CC(C)[C@@H](C(=O)Nc1ccc(C(=O)NCc2ccc(F)cc2)cc1)N1CCCCC1 ZINC000519105297 927774748 /nfs/dbraw/zinc/77/47/48/927774748.db2.gz JDJCBDQJIOLGFZ-QFIPXVFZSA-N 0 3 411.521 4.205 20 0 HIADHN O=C([C@H]1CCCN(Cc2cccc(F)c2)C1)N1CCC(COc2ccccc2)CC1 ZINC000519110759 927778745 /nfs/dbraw/zinc/77/87/45/927778745.db2.gz QLMHYRQQZRVQPU-QFIPXVFZSA-N 0 3 410.533 4.355 20 0 HIADHN COC(=O)c1cc(NC(=O)N(Cc2ccccc2)C2CCN(C)CC2)cc2[nH]ccc21 ZINC000519128412 927795256 /nfs/dbraw/zinc/79/52/56/927795256.db2.gz RBXQAFLHTSYMPU-UHFFFAOYSA-N 0 3 420.513 4.083 20 0 HIADHN CCN1CCCC[C@H]1C(=O)NCc1cn(Cc2ccccc2)nc1-c1ccccc1 ZINC000519164017 927808359 /nfs/dbraw/zinc/80/83/59/927808359.db2.gz ZEOYZBRLDSPINB-QHCPKHFHSA-N 0 3 402.542 4.089 20 0 HIADHN COCCN(CCN(C)C)C(=O)NC(c1ccc(Cl)cc1)c1ccc(Cl)cc1 ZINC000519175161 927812949 /nfs/dbraw/zinc/81/29/49/927812949.db2.gz VMBVMTLQGGADCP-UHFFFAOYSA-N 0 3 424.372 4.302 20 0 HIADHN CC(C)COC1CCN(C(=O)NC[C@@H](c2ccccc2)N2CCC(C)CC2)CC1 ZINC000519187357 927816864 /nfs/dbraw/zinc/81/68/64/927816864.db2.gz BMDDXVCPADIJRW-QHCPKHFHSA-N 0 3 401.595 4.306 20 0 HIADHN CCc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@@H](c1ccc(OC)cc1)N1CCCC1 ZINC000519237540 927841524 /nfs/dbraw/zinc/84/15/24/927841524.db2.gz LFOIIDKFRRFFAO-NRFANRHFSA-N 0 3 412.490 4.124 20 0 HIADHN COCCOc1c(Cl)cccc1NC(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000519244157 927844779 /nfs/dbraw/zinc/84/47/79/927844779.db2.gz AEKFKICTAICUOM-KRWDZBQOSA-N 0 3 423.966 4.385 20 0 HIADHN Cc1cc(C)n(-c2ccccc2NC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)n1 ZINC000519363685 927898169 /nfs/dbraw/zinc/89/81/69/927898169.db2.gz OYZUMZIYYJSMJM-FQEVSTJZSA-N 0 3 406.505 4.479 20 0 HIADHN Cc1cc(C(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)ccc1[N+](=O)[O-] ZINC000519412362 927930931 /nfs/dbraw/zinc/93/09/31/927930931.db2.gz HZVSXOHVRJZRDI-UHFFFAOYSA-N 0 3 409.408 4.126 20 0 HIADHN CCN(CC(=O)Nc1ccc2c(c1)OC1(CCCCC1)O2)[C@H]1CCOC(C)(C)C1 ZINC000519481517 927979742 /nfs/dbraw/zinc/97/97/42/927979742.db2.gz MTVJWQWAYKSKIJ-SFHVURJKSA-N 0 3 402.535 4.336 20 0 HIADHN C[C@@H](N[C@@H]1c2ccccc2CC12CCOCC2)C(=O)NC12CC3CC(CC(C3)C1)C2 ZINC000519482949 927980057 /nfs/dbraw/zinc/98/00/57/927980057.db2.gz GOKKSPNUQLDELI-SYNKRZKOSA-N 0 3 408.586 4.144 20 0 HIADHN O=C(NCc1cccnc1)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000519498981 927993485 /nfs/dbraw/zinc/99/34/85/927993485.db2.gz LDQNKBHIJYAAKC-UHFFFAOYSA-N 0 3 407.345 4.196 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)Nc1nnc(-c2ccco2)s1 ZINC000519509906 928001530 /nfs/dbraw/zinc/00/15/30/928001530.db2.gz AYJFBQHXEFDURY-UHFFFAOYSA-N 0 3 405.911 4.047 20 0 HIADHN C[C@H](NCCC(=O)N1CCOc2ccccc21)c1ccc(Br)cc1F ZINC000519691701 928051018 /nfs/dbraw/zinc/05/10/18/928051018.db2.gz GGNBUWYDVIMKGX-ZDUSSCGKSA-N 0 3 407.283 4.055 20 0 HIADHN Cc1onc(-c2ccncc2)c1C(=O)NC[C@@H](c1ccc(CC(C)C)cc1)N(C)C ZINC000519721615 928056220 /nfs/dbraw/zinc/05/62/20/928056220.db2.gz FTXIMXLZSBOZMA-NRFANRHFSA-N 0 3 406.530 4.276 20 0 HIADHN COCCO[C@@H]1CCCN(Cc2cn(-c3ccccc3)nc2-c2ccc(OC)cc2)C1 ZINC000519834395 928086934 /nfs/dbraw/zinc/08/69/34/928086934.db2.gz GPZASYJIEQWMDY-XMMPIXPASA-N 0 3 421.541 4.175 20 0 HIADHN CCOCCOc1c(Cl)cccc1NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000519879005 928112306 /nfs/dbraw/zinc/11/23/06/928112306.db2.gz UDLCJNMBQKHIMZ-GOSISDBHSA-N 0 3 417.937 4.151 20 0 HIADHN CN(C)CCN(C(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1)c1ccccc1 ZINC000519898429 928134600 /nfs/dbraw/zinc/13/46/00/928134600.db2.gz PMNXDXUGFXSAPT-UHFFFAOYSA-N 0 3 411.509 4.143 20 0 HIADHN CN(C)[C@@H](CNC(=O)N[C@H]1CCCc2cc(OC(F)F)ccc21)c1ccccc1 ZINC000519927882 928160365 /nfs/dbraw/zinc/16/03/65/928160365.db2.gz OKUXCKFCLNWJQI-PMACEKPBSA-N 0 3 403.473 4.268 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)[C@H](c2ccccc2)N2CCSCC2)N2CCCC2)cc1 ZINC000519936792 928172009 /nfs/dbraw/zinc/17/20/09/928172009.db2.gz RGRKXCLJSMIGQY-RPWUZVMVSA-N 0 3 423.626 4.038 20 0 HIADHN CCOc1ccc(NC(=O)NC[C@@H](c2cccc(OC)c2)N2CCCC2)cc1OC ZINC000520051084 928276310 /nfs/dbraw/zinc/27/63/10/928276310.db2.gz VJLAXWDPEJJNGR-FQEVSTJZSA-N 0 3 413.518 4.061 20 0 HIADHN COCCOc1ccc(NC(=O)NC[C@@H]2CCCCN2Cc2ccccc2)c(C)c1 ZINC000520054283 928278869 /nfs/dbraw/zinc/27/88/69/928278869.db2.gz BNFUXKMGQCNTBZ-NRFANRHFSA-N 0 3 411.546 4.196 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2nn(-c3ccc(C)cc3)c3c2CCC3)N(C)C)cc1 ZINC000520061223 928286009 /nfs/dbraw/zinc/28/60/09/928286009.db2.gz IMRBPIQRCAEMOU-HSZRJFAPSA-N 0 3 402.542 4.011 20 0 HIADHN Cc1ccc(NC(=O)c2cccc(CN3CCCC3)c2)cc1NC(=O)c1ccncc1 ZINC000520064632 928289358 /nfs/dbraw/zinc/28/93/58/928289358.db2.gz UFVAJCROYQWXIV-UHFFFAOYSA-N 0 3 414.509 4.490 20 0 HIADHN COc1ccc(CN(C)C(=O)NC[C@H](c2ccc(C)cc2)N(C)C)cc1OC(F)F ZINC000520067646 928291587 /nfs/dbraw/zinc/29/15/87/928291587.db2.gz YUZREXGNKJTKPL-GOSISDBHSA-N 0 3 421.488 4.049 20 0 HIADHN O=C(N[C@H](c1ccccc1)c1ccccn1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000520093691 928305780 /nfs/dbraw/zinc/30/57/80/928305780.db2.gz KYXLTEKXVIVIMU-XUZZJYLKSA-N 0 3 403.501 4.339 20 0 HIADHN CCOc1cc2c(cc1NC(=O)[C@@H]1CCCN(Cc3cccc(F)c3)C1)O[C@@H](C)C2 ZINC000520106905 928315313 /nfs/dbraw/zinc/31/53/13/928315313.db2.gz RNPMVJUTEPPQOP-FUHWJXTLSA-N 0 3 412.505 4.399 20 0 HIADHN C[C@H](Oc1ccc(C(=O)N(CCN(C)C)Cc2ccccc2)cn1)c1ccccc1 ZINC000520106496 928315773 /nfs/dbraw/zinc/31/57/73/928315773.db2.gz XDWCAGIAIVKSGN-FQEVSTJZSA-N 0 3 403.526 4.426 20 0 HIADHN CCCN(CC(=O)N1CCC(C(=O)Nc2ccccc2)CC1)[C@H]1CCc2ccccc21 ZINC000520171616 928362756 /nfs/dbraw/zinc/36/27/56/928362756.db2.gz UZCXJMYHJMBHFU-DEOSSOPVSA-N 0 3 419.569 4.263 20 0 HIADHN CCN(C(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1)[C@@H](C)Cc1ccc(OC)cc1 ZINC000520196964 928381771 /nfs/dbraw/zinc/38/17/71/928381771.db2.gz LVTGOSOOKWHCMD-MIZPHKNDSA-N 0 3 409.574 4.493 20 0 HIADHN CC[C@@H](NCC1=Cc2ccccc2OC1)c1ccccc1OCC(=O)N1CCCC1 ZINC000520201747 928386364 /nfs/dbraw/zinc/38/63/64/928386364.db2.gz IONRMSDZSSCYHE-JOCHJYFZSA-N 0 3 406.526 4.205 20 0 HIADHN O=C1CCCN1c1cccc(CNCc2ccc(-n3ccc(C(F)(F)F)n3)cc2)c1 ZINC000520203183 928386427 /nfs/dbraw/zinc/38/64/27/928386427.db2.gz NBAUWYOZEIZCQO-UHFFFAOYSA-N 0 3 414.431 4.308 20 0 HIADHN COc1ccc(C[C@H](N[C@H]2CCN(c3ccccc3)C2=O)c2ccccc2)cc1OC ZINC000520249345 928416929 /nfs/dbraw/zinc/41/69/29/928416929.db2.gz ZKTDDFICQPHEIW-GOTSBHOMSA-N 0 3 416.521 4.383 20 0 HIADHN COCCN1CCC(NC(=O)N[C@H](c2ccccc2)c2ccc3ccccc3c2)CC1 ZINC000520266632 928431695 /nfs/dbraw/zinc/43/16/95/928431695.db2.gz WCDAMGBDILVZLV-RUZDIDTESA-N 0 3 417.553 4.339 20 0 HIADHN CN(C)CCn1nccc1NC(=O)c1ccc(Oc2ccc(C(C)(C)C)cc2)nc1 ZINC000520274732 928439761 /nfs/dbraw/zinc/43/97/61/928439761.db2.gz RZDLKNZWYXGJEM-UHFFFAOYSA-N 0 3 407.518 4.182 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2ccc(-n3cccn3)c(F)c2)N2CCCC2)cc1 ZINC000520291551 928453632 /nfs/dbraw/zinc/45/36/32/928453632.db2.gz WMHVYFXZPIGHAN-JOCHJYFZSA-N 0 3 407.493 4.278 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)Nc1cccc(-c2nccs2)c1 ZINC000520314128 928475577 /nfs/dbraw/zinc/47/55/77/928475577.db2.gz IPLDEHDGKKKTCV-UHFFFAOYSA-N 0 3 406.555 4.351 20 0 HIADHN COc1ccc(-c2[nH]c3ccccc3c2CCC(=O)N(C)[C@@H]2CCN(C3CC3)C2)cc1 ZINC000520318609 928480041 /nfs/dbraw/zinc/48/00/41/928480041.db2.gz YCFLGMDOPPLNAW-HXUWFJFHSA-N 0 3 417.553 4.471 20 0 HIADHN C[C@H](CNC(=O)C1(c2cccc(Br)c2)CC1)N(C)Cc1ccccc1 ZINC000520376054 928529705 /nfs/dbraw/zinc/52/97/05/928529705.db2.gz XKLDKIHQNSWBFG-MRXNPFEDSA-N 0 3 401.348 4.117 20 0 HIADHN Cc1noc(C2CCN(C[C@@H](O)CO[C@@H](c3ccccc3)c3ccccc3C)CC2)n1 ZINC000520419349 928556051 /nfs/dbraw/zinc/55/60/51/928556051.db2.gz DRUFICYSTFAONU-VWNXMTODSA-N 0 3 421.541 4.033 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)N(CC[NH+](C)C)CC3CCCCC3)cc2)cc(=O)[n-]1 ZINC000520467929 928584289 /nfs/dbraw/zinc/58/42/89/928584289.db2.gz VGMDOLVNAKUKJX-UHFFFAOYSA-N 0 3 411.550 4.133 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)c2cccc(C(=O)N(C)c3ccccc3)c2)o1 ZINC000520505913 928607411 /nfs/dbraw/zinc/60/74/11/928607411.db2.gz FMYUENZEWNDRME-UHFFFAOYSA-N 0 3 419.525 4.069 20 0 HIADHN C[C@H](NC(=O)NC[C@H]1CCCCN1C1CC1)c1ccc(OCc2cccnc2)cc1 ZINC000520706554 928753605 /nfs/dbraw/zinc/75/36/05/928753605.db2.gz WMQADKQUXPXHHR-PGRDOPGGSA-N 0 3 408.546 4.038 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cc(Br)cs3)c(C)c2)CC1 ZINC000520726320 928776692 /nfs/dbraw/zinc/77/66/92/928776692.db2.gz XFDSYGOZDUJQOR-UHFFFAOYSA-N 0 3 408.365 4.213 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2nc(CN3CCC[C@H](C)C3)cs2)N(C)C)cc1 ZINC000520830066 928836016 /nfs/dbraw/zinc/83/60/16/928836016.db2.gz JTKWRIWZLWCXNL-PXNSSMCTSA-N 0 3 415.607 4.108 20 0 HIADHN Cc1ccc(Cc2nnc(NC(=O)N[C@H]3CCN([C@@H](C)c4ccccc4)C3)s2)cc1 ZINC000520856389 928846444 /nfs/dbraw/zinc/84/64/44/928846444.db2.gz CKXZGYPMULRYAR-PXNSSMCTSA-N 0 3 421.570 4.394 20 0 HIADHN COc1ccc(-c2nc(C)c(C(=O)NC[C@H](c3ccc(C)cc3)N(C)C)s2)cc1 ZINC000520857761 928847425 /nfs/dbraw/zinc/84/74/25/928847425.db2.gz TUDKKQRNACUNCK-HXUWFJFHSA-N 0 3 409.555 4.468 20 0 HIADHN COCCOc1c(Cl)cccc1NC(=O)N[C@H]1CCN(Cc2ccccc2)[C@@H]1C ZINC000520882569 928857758 /nfs/dbraw/zinc/85/77/58/928857758.db2.gz AUSWUKRBHBGPKA-APWZRJJASA-N 0 3 417.937 4.150 20 0 HIADHN CS(=O)(=O)Nc1cccc(CNCc2ccc(Oc3cc(F)cc(F)c3)cc2)c1 ZINC000520954761 928888780 /nfs/dbraw/zinc/88/87/80/928888780.db2.gz JSQJTBSAERWRLS-UHFFFAOYSA-N 0 3 418.465 4.418 20 0 HIADHN CCOc1cc(CNCc2ccccc2C(F)(F)F)ccc1O[C@H](C)C(=O)N(C)C ZINC000520965735 928892852 /nfs/dbraw/zinc/89/28/52/928892852.db2.gz XTTYGLNTWCTWEE-OAHLLOKOSA-N 0 3 424.463 4.249 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2CNCCNC(=O)c2ccc(C)cc2)o1 ZINC000520987656 928906848 /nfs/dbraw/zinc/90/68/48/928906848.db2.gz CXHWKSZAOPRYML-UHFFFAOYSA-N 0 3 414.509 4.269 20 0 HIADHN O=C(NCc1csc(-c2ccccc2)n1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000520994015 928911993 /nfs/dbraw/zinc/91/19/93/928911993.db2.gz NOQWDJFFDVVNDK-LJQANCHMSA-N 0 3 409.530 4.478 20 0 HIADHN O=C(N[C@@H]1CCCOc2ccc(F)cc21)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000521001661 928918125 /nfs/dbraw/zinc/91/81/25/928918125.db2.gz IBOHKXMEODBYEY-LAUBAEHRSA-N 0 3 400.469 4.207 20 0 HIADHN O=C(NCc1ccc2c(c1)OCO2)[C@H](NCCCc1cccc(F)c1)c1ccccc1 ZINC000521012740 928928355 /nfs/dbraw/zinc/92/83/55/928928355.db2.gz SXPSKFWNEOSFHX-XMMPIXPASA-N 0 3 420.484 4.134 20 0 HIADHN CC(C)OCc1ccc(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2F)cc1 ZINC000521073133 928973212 /nfs/dbraw/zinc/97/32/12/928973212.db2.gz RIEWQQUKMNCNCL-UHFFFAOYSA-N 0 3 405.489 4.486 20 0 HIADHN O=C(NC[C@H]1CCc2ccccc21)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000521082980 928980882 /nfs/dbraw/zinc/98/08/82/928980882.db2.gz KVRVTXDTMHBXTD-KNQAVFIVSA-N 0 3 402.460 4.287 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)C(=O)Nc1cccc2ccncc21)c1ccc(Cl)cc1 ZINC000521094104 928989053 /nfs/dbraw/zinc/98/90/53/928989053.db2.gz QFTGZYXFOOLHTR-NRFANRHFSA-N 0 3 424.932 4.026 20 0 HIADHN C[C@@H](CNC(=O)c1cnn(-c2ccccc2)c1C(F)(F)F)N(C)Cc1ccccc1 ZINC000521095762 928992099 /nfs/dbraw/zinc/99/20/99/928992099.db2.gz TWRNTJFQMOSDMP-INIZCTEOSA-N 0 3 416.447 4.141 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)[C@H](C)c2cn(C)c3ccccc23)N(C)C)cc1 ZINC000521099045 928994270 /nfs/dbraw/zinc/99/42/70/928994270.db2.gz RGMJOPONTSVWIX-HOYKHHGWSA-N 0 3 407.558 4.488 20 0 HIADHN C[C@@H](C(=O)N1CC=C(c2ccc(O)cc2)CC1)N1CCC(Cc2ccccc2)CC1 ZINC000521105600 928997901 /nfs/dbraw/zinc/99/79/01/928997901.db2.gz USDXFPPDFYJGJA-FQEVSTJZSA-N 0 3 404.554 4.351 20 0 HIADHN C[C@@H](CNC(=O)N(C)Cc1ccc(OC(F)(F)F)cc1)N(C)Cc1ccccc1 ZINC000521164354 929036833 /nfs/dbraw/zinc/03/68/33/929036833.db2.gz UJJJXCBKJOFULI-INIZCTEOSA-N 0 3 409.452 4.247 20 0 HIADHN O=C(NCCCCCOC1CCCCC1)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000521175506 929044074 /nfs/dbraw/zinc/04/40/74/929044074.db2.gz BMXZTIFEHNMTCH-QFIPXVFZSA-N 0 3 401.595 4.470 20 0 HIADHN COc1cc(CN(C)C(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)ccc1SC ZINC000521203330 929059025 /nfs/dbraw/zinc/05/90/25/929059025.db2.gz MPTRQGZKSFNGPH-YLJYHZDGSA-N 0 3 413.587 4.394 20 0 HIADHN COc1c(C)ccc(NC(=O)NCC2(N3CCOC(C)(C)C3)CCCCC2)c1C ZINC000521305771 929116030 /nfs/dbraw/zinc/11/60/30/929116030.db2.gz AFXZCDJSTUTMIZ-UHFFFAOYSA-N 0 3 403.567 4.247 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2ccc(C(=O)N3CCCC[C@@H]3C)cc2)N(C)C)cc1 ZINC000521468106 929235358 /nfs/dbraw/zinc/23/53/58/929235358.db2.gz QVWUHDOSHWDSHU-CVDCTZTESA-N 0 3 422.573 4.434 20 0 HIADHN COc1ccc(CNCCNC(=O)c2ccc(C)cc2)cc1OCc1ccccc1 ZINC000521586400 929313446 /nfs/dbraw/zinc/31/34/46/929313446.db2.gz OXGIIVWCPKLJLE-UHFFFAOYSA-N 0 3 404.510 4.102 20 0 HIADHN O=C(Nc1ccc(OC[C@@H]2CCCO2)cc1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000521597594 929319657 /nfs/dbraw/zinc/31/96/57/929319657.db2.gz HEECASVLBXLGSX-XXBNENTESA-N 0 3 412.505 4.234 20 0 HIADHN CCN(CC)[C@H](CNC(=O)[C@@H](c1ccccc1)N1CCSCC1)c1ccsc1 ZINC000521836575 929488732 /nfs/dbraw/zinc/48/87/32/929488732.db2.gz LEKIYQZSFGMCSG-NHCUHLMSSA-N 0 3 417.644 4.037 20 0 HIADHN Cc1ccc(Br)cc1NC(=O)N1CCC(CN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000521879142 929528219 /nfs/dbraw/zinc/52/82/19/929528219.db2.gz XFBRQGMKYASKNS-HOTGVXAUSA-N 0 3 424.383 4.111 20 0 HIADHN COCCSc1ccc([C@@H](C)N[C@H](C)C(=O)N(C)Cc2cccc(F)c2)cc1 ZINC000521881793 929529922 /nfs/dbraw/zinc/52/99/22/929529922.db2.gz VRQARHSBGDDOFK-IAGOWNOFSA-N 0 3 404.551 4.262 20 0 HIADHN C[C@@H](C(=O)N1[C@H](C)CCC[C@@H]1C)N(C)CCCc1cc(-c2cccc(F)c2)n[nH]1 ZINC000521902620 929545804 /nfs/dbraw/zinc/54/58/04/929545804.db2.gz GCWPBCCRIDLULA-KSZLIROESA-N 0 3 400.542 4.258 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)Nc1ccc(F)cc1Br ZINC000524483108 929631722 /nfs/dbraw/zinc/63/17/22/929631722.db2.gz FSVGKWYGJAEPIP-INIZCTEOSA-N 0 3 406.299 4.374 20 0 HIADHN CC(C)CC(=O)Nc1ccc(NC(=O)NC[C@@H]2CCCN2Cc2ccccc2)cc1 ZINC000524483999 929632949 /nfs/dbraw/zinc/63/29/49/929632949.db2.gz BEPBWBKXWYHWOE-QFIPXVFZSA-N 0 3 408.546 4.457 20 0 HIADHN CN(C)Cc1cccc(NC(=O)N2CCN(Cc3cccc(C(F)(F)F)c3)CC2)c1 ZINC000524540009 929672540 /nfs/dbraw/zinc/67/25/40/929672540.db2.gz AZJOXLWKSBMEMB-UHFFFAOYSA-N 0 3 420.479 4.117 20 0 HIADHN CC[C@@H](NC(=O)NC[C@@H](c1cccc(OC)c1)N(CC)CC)c1nc(C)cs1 ZINC000524555345 929684063 /nfs/dbraw/zinc/68/40/63/929684063.db2.gz OFJFJJVFHUXTFT-MOPGFXCFSA-N 0 3 404.580 4.294 20 0 HIADHN Cc1cc(NC(=O)c2cccc(F)c2)sc1C(=O)NCCN1[C@@H](C)CCC[C@@H]1C ZINC000524673151 929787763 /nfs/dbraw/zinc/78/77/63/929787763.db2.gz CJOQJDLTAAANTF-HOTGVXAUSA-N 0 3 417.550 4.441 20 0 HIADHN CCN1CCN(Cc2ccc(CNC(=O)Nc3cccc(C)c3Cl)cc2)CC1 ZINC000524723312 929810995 /nfs/dbraw/zinc/81/09/95/929810995.db2.gz KUWQPZJFZJKZKL-UHFFFAOYSA-N 0 3 400.954 4.108 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)Nc1ccc(O[C@H]2CCOC2)cc1 ZINC000524799757 929834188 /nfs/dbraw/zinc/83/41/88/929834188.db2.gz PZYUIJGDOXOCIC-NRFANRHFSA-N 0 3 417.937 4.103 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2ccc(O[C@H]3CCOC3)cc2)N2CCCC2)cc1 ZINC000524799538 929834400 /nfs/dbraw/zinc/83/44/00/929834400.db2.gz HAHTUJVUWUKABU-GOTSBHOMSA-N 0 3 409.530 4.121 20 0 HIADHN C[C@@H](SCc1ccccc1)C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000524818731 929842462 /nfs/dbraw/zinc/84/24/62/929842462.db2.gz FCTVEPHBWPXBPZ-GOSISDBHSA-N 0 3 416.562 4.107 20 0 HIADHN O=C(NCc1ccc(-c2ccncc2)cc1)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000524827891 929847996 /nfs/dbraw/zinc/84/79/96/929847996.db2.gz BADXMPQPOKNPEN-XMMPIXPASA-N 0 3 400.526 4.212 20 0 HIADHN CCn1cc(CC(=O)NC2CCN(CCOc3ccc(F)cc3)CC2)c2ccccc21 ZINC000524835576 929852392 /nfs/dbraw/zinc/85/23/92/929852392.db2.gz PQERBPFHNQXVGC-UHFFFAOYSA-N 0 3 423.532 4.002 20 0 HIADHN O=C(CCCc1ccc(Cl)cc1)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000524836209 929852440 /nfs/dbraw/zinc/85/24/40/929852440.db2.gz LXMVHLKVNSTRRH-UHFFFAOYSA-N 0 3 418.940 4.461 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)c1cnn(-c2ccccc2)c1C1CC1 ZINC000524864352 929864123 /nfs/dbraw/zinc/86/41/23/929864123.db2.gz NQCSXTSUDJUTPR-FQEVSTJZSA-N 0 3 414.553 4.486 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)NCCCCOCc1ccccc1 ZINC000524881306 929870597 /nfs/dbraw/zinc/87/05/97/929870597.db2.gz AWLQYVBGYXQOGB-QFIPXVFZSA-N 0 3 409.574 4.289 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)NCc1cc(Br)cs1 ZINC000524883233 929871013 /nfs/dbraw/zinc/87/10/13/929871013.db2.gz HQHMNYDZXIQERK-OAHLLOKOSA-N 0 3 422.392 4.317 20 0 HIADHN COc1ccc(CC[C@@H](C)NC(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)cc1 ZINC000524882173 929871188 /nfs/dbraw/zinc/87/11/88/929871188.db2.gz IWAQSBDNNVSHMA-NHCUHLMSSA-N 0 3 409.574 4.322 20 0 HIADHN CCCOc1c(Br)cc(Br)cc1CNC[C@H](O)C(C)C ZINC000524889031 929875040 /nfs/dbraw/zinc/87/50/40/929875040.db2.gz GDOSZAIQADGPLW-AWEZNQCLSA-N 0 3 409.162 4.107 20 0 HIADHN C[C@@H](c1ccccc1)N(CC(=O)NC[C@H]1CCN(c2ccccc2)C1)CC1CCC1 ZINC000524893746 929876822 /nfs/dbraw/zinc/87/68/22/929876822.db2.gz LFFVDHYMBDFMKL-JTHBVZDNSA-N 0 3 405.586 4.492 20 0 HIADHN CCOC(=O)c1sc2ccsc2c1CNC(=O)c1cccc(CN(C)C)c1 ZINC000524976795 929941594 /nfs/dbraw/zinc/94/15/94/929941594.db2.gz OEKKQYSTHHWYKT-UHFFFAOYSA-N 0 3 402.541 4.131 20 0 HIADHN COc1cc(CN(C)CCCOc2ccc3c(c2)OCO3)c(SC)cc1OC ZINC000524991363 929957876 /nfs/dbraw/zinc/95/78/76/929957876.db2.gz VUBPFKHDUGGNEG-UHFFFAOYSA-N 0 3 405.516 4.055 20 0 HIADHN Cc1ccc(NC(=O)N2CCN(CCC(C)(C)C)CC2)cc1OCC1CCOCC1 ZINC000524993677 929960377 /nfs/dbraw/zinc/96/03/77/929960377.db2.gz YJYFUTPUKYYLLD-UHFFFAOYSA-N 0 3 417.594 4.386 20 0 HIADHN CN(C)[C@@H](CNC(=O)Nc1cnn(-c2cccc(C(F)(F)F)c2)c1)c1ccccc1 ZINC000525001951 929966043 /nfs/dbraw/zinc/96/60/43/929966043.db2.gz STQJXABIRYWGKZ-IBGZPJMESA-N 0 3 417.435 4.316 20 0 HIADHN CN(C)c1nc2sc(C(=O)NC[C@@H]3CCCN(C)[C@@H]3c3cccs3)cc2s1 ZINC000525057809 930008461 /nfs/dbraw/zinc/00/84/61/930008461.db2.gz TZLIVOPRNQMTSH-LRDDRELGSA-N 0 3 420.629 4.298 20 0 HIADHN CCCc1c(C(=O)N2CC[C@@H](N3CCCCC3)C2)nnn1-c1cccc(C(C)C)c1 ZINC000525059666 930009826 /nfs/dbraw/zinc/00/98/26/930009826.db2.gz KMNNHLVZMWEZQZ-OAQYLSRUSA-N 0 3 409.578 4.044 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2ccc(CNC(=O)C(C)(C)C)cc2)N2CCCC2)cc1 ZINC000525061613 930010305 /nfs/dbraw/zinc/01/03/05/930010305.db2.gz KVBWMEDAWRAERX-QHCPKHFHSA-N 0 3 421.585 4.224 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)Cc1ccc(NC(=O)CC(C)(C)C)cc1 ZINC000525066999 930014280 /nfs/dbraw/zinc/01/42/80/930014280.db2.gz PERFYRBLOSJASX-UHFFFAOYSA-N 0 3 411.546 4.313 20 0 HIADHN COc1ccc(C[C@H](C)NC(=O)[C@H](C)N2CCC(Cc3ccccc3)CC2)cc1OC ZINC000525088164 930027421 /nfs/dbraw/zinc/02/74/21/930027421.db2.gz IADAMCZERDFQBJ-PMACEKPBSA-N 0 3 424.585 4.094 20 0 HIADHN C[C@@H]1CN(C(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)C[C@@H](c2ccc(F)cc2)O1 ZINC000525095996 930032241 /nfs/dbraw/zinc/03/22/41/930032241.db2.gz OKAWYIPHCORQAH-MONBJTKQSA-N 0 3 414.496 4.165 20 0 HIADHN C[C@@H]1CN(CC(=O)N2CCC[C@@H]2c2ccc3c(c2)OCCO3)CC[C@H]1c1ccccc1 ZINC000525121980 930048941 /nfs/dbraw/zinc/04/89/41/930048941.db2.gz OAQXUYCSGPCEQQ-UEVCKROQSA-N 0 3 420.553 4.247 20 0 HIADHN C[C@@H]1CN(CC(=O)N2CCC[C@H]2c2ccc3c(c2)OCCO3)CC[C@@H]1c1ccccc1 ZINC000525121978 930049427 /nfs/dbraw/zinc/04/94/27/930049427.db2.gz OAQXUYCSGPCEQQ-OIBXWCBGSA-N 0 3 420.553 4.247 20 0 HIADHN Cc1cccc([C@@H]2CCCN2CC(=O)N2CCC(C(=O)Nc3ccccc3)CC2)c1C ZINC000525125895 930050682 /nfs/dbraw/zinc/05/06/82/930050682.db2.gz KQVKYYONTWOHEA-DEOSSOPVSA-N 0 3 419.569 4.318 20 0 HIADHN CC(C)(C)OC(=O)Cc1cccc(NC(=O)NC[C@H]2CCCN2Cc2ccccc2)c1 ZINC000525227644 930093552 /nfs/dbraw/zinc/09/35/52/930093552.db2.gz ALLURQSZAOOMBS-JOCHJYFZSA-N 0 3 423.557 4.357 20 0 HIADHN Cc1ccc(C(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)cc1NC(=O)NC(C)(C)C ZINC000525371795 930203031 /nfs/dbraw/zinc/20/30/31/930203031.db2.gz SEFJAYUQPRKGRQ-NQIIRXRSSA-N 0 3 422.573 4.480 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)[C@H](c1c(F)cccc1Cl)N(C)C)c1ccsc1 ZINC000525383930 930210422 /nfs/dbraw/zinc/21/04/22/930210422.db2.gz HLFAMSBMCUBHMB-HKUYNNGSSA-N 0 3 411.974 4.343 20 0 HIADHN COCCc1ccc(OCCCC(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)cc1 ZINC000525384278 930211645 /nfs/dbraw/zinc/21/16/45/930211645.db2.gz WNNYUUJDOIEUQA-QFIPXVFZSA-N 0 3 424.585 4.158 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)N[C@@H]1C[C@H]1c1c(F)cccc1Cl ZINC000525394455 930215743 /nfs/dbraw/zinc/21/57/43/930215743.db2.gz REEWMUMHJWNPNZ-YLJYHZDGSA-N 0 3 401.913 4.083 20 0 HIADHN C[C@H](OCCCNC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C)c1ccccc1 ZINC000525399373 930218579 /nfs/dbraw/zinc/21/85/79/930218579.db2.gz LETLCJLYQAISDD-YADHBBJMSA-N 0 3 409.574 4.460 20 0 HIADHN C[C@@H](OCCCNC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C)c1ccccc1 ZINC000525399371 930218803 /nfs/dbraw/zinc/21/88/03/930218803.db2.gz LETLCJLYQAISDD-FGZHOGPDSA-N 0 3 409.574 4.460 20 0 HIADHN Cc1nn(Cc2ccc(Cl)cc2)c(C)c1CNCc1cccc(-n2cncn2)c1 ZINC000525404684 930222027 /nfs/dbraw/zinc/22/20/27/930222027.db2.gz CRGAFVKBROJRCG-UHFFFAOYSA-N 0 3 406.921 4.072 20 0 HIADHN C[C@@H](COc1ccc(F)cc1F)NC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C ZINC000525416267 930228620 /nfs/dbraw/zinc/22/86/20/930228620.db2.gz LMUORETUDYKCEF-ROUUACIJSA-N 0 3 417.500 4.038 20 0 HIADHN CCCN(C(=O)NC[C@H](CC)N1CCc2ccccc2C1)[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC000525418872 930229796 /nfs/dbraw/zinc/22/97/96/930229796.db2.gz BUFJZPZSVPPNJO-GPJHCHHRSA-N 0 3 413.606 4.058 20 0 HIADHN COc1ccc(OC(F)F)c(NC(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)c1 ZINC000525419665 930230800 /nfs/dbraw/zinc/23/08/00/930230800.db2.gz UYZBOBZLUSGADX-INIZCTEOSA-N 0 3 419.472 4.425 20 0 HIADHN C[C@@H](CN1CCC[C@H](C)C1)NC(=O)C(=O)Nc1cccc(CSC2CCCC2)c1 ZINC000525434780 930238378 /nfs/dbraw/zinc/23/83/78/930238378.db2.gz TZBPBBTXRMNYTP-ROUUACIJSA-N 0 3 417.619 4.038 20 0 HIADHN CN(C)C[C@H]1CN(C(=O)N[C@H](c2ccc(Cl)cc2)c2ccccc2Cl)CCO1 ZINC000525444802 930243658 /nfs/dbraw/zinc/24/36/58/930243658.db2.gz PHNFOLUVMDAILL-FXAWDEMLSA-N 0 3 422.356 4.055 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)[C@@H]1C[C@H]1c1ccccc1OC(F)(F)F ZINC000525471536 930261654 /nfs/dbraw/zinc/26/16/54/930261654.db2.gz SLDFRBDHTSBZDD-JKSUJKDBSA-N 0 3 408.420 4.398 20 0 HIADHN O=C(Nc1cccc(CN2CCSCC2)c1)[C@H]1CCCCN1Cc1ccccc1 ZINC000525484222 930272942 /nfs/dbraw/zinc/27/29/42/930272942.db2.gz ZPGLWLMVHLUWMJ-HSZRJFAPSA-N 0 3 409.599 4.229 20 0 HIADHN Cc1c2cccc(C)c2oc1C(=O)Nc1ccc(C(=O)N(C)[C@@H]2CCCN(C)C2)cc1 ZINC000525581799 930344381 /nfs/dbraw/zinc/34/43/81/930344381.db2.gz QRRAFBNZXUBFSO-HXUWFJFHSA-N 0 3 419.525 4.468 20 0 HIADHN Cc1ccc(-c2nn(Cc3ccccc3)cc2C(=O)N(C)[C@@H]2CCCN(C)C2)cc1 ZINC000525618267 930364682 /nfs/dbraw/zinc/36/46/82/930364682.db2.gz RCDDKDPYPNGLIL-JOCHJYFZSA-N 0 3 402.542 4.073 20 0 HIADHN c1ccc(Oc2ccc(OCCN3CCC[C@@H](c4nnc5n4CCC5)C3)cc2)cc1 ZINC000525635638 930375728 /nfs/dbraw/zinc/37/57/28/930375728.db2.gz JGCCIEFXYPARMY-LJQANCHMSA-N 0 3 404.514 4.275 20 0 HIADHN CC[C@@H](Cc1ccccc1)N(C)CC(=O)NCc1c(C)nn(Cc2ccccc2)c1C ZINC000525636060 930375937 /nfs/dbraw/zinc/37/59/37/930375937.db2.gz CXKSHSJOOCCXLR-DEOSSOPVSA-N 0 3 418.585 4.118 20 0 HIADHN Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)N[C@H]1CCCN(c2cnn(C)c2)C1=O ZINC000525756839 930432154 /nfs/dbraw/zinc/43/21/54/930432154.db2.gz KISDGSKARMITDO-KXBFYZLASA-N 0 3 409.559 4.007 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCO[C@H](c2ccccc2C)C1)c1ccsc1 ZINC000525756639 930432601 /nfs/dbraw/zinc/43/26/01/930432601.db2.gz KXMABCXOWGCUCW-RTWAWAEBSA-N 0 3 401.576 4.223 20 0 HIADHN CC(C)[C@@H](CNC(=O)CCCCc1ccc(C(C)(C)C)cc1)N1CCN(C)CC1 ZINC000525773481 930439588 /nfs/dbraw/zinc/43/95/88/930439588.db2.gz GLOBBCNKMFYRNB-HSZRJFAPSA-N 0 3 401.639 4.085 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(S(C)(=O)=O)cc1)c1ccc(OCc2cccnc2)cc1 ZINC000525953219 930494192 /nfs/dbraw/zinc/49/41/92/930494192.db2.gz WLBWEEXNKLILCL-QZTJIDSGSA-N 0 3 410.539 4.476 20 0 HIADHN COc1ccc([C@H](CNc2nnc(Cc3ccc(F)cc3)s2)N(C)C)cc1OC ZINC000525960528 930496805 /nfs/dbraw/zinc/49/68/05/930496805.db2.gz PBNAVEDBRVVYOE-KRWDZBQOSA-N 0 3 416.522 4.000 20 0 HIADHN COc1ccc([C@@H](C)N[C@H]2CCCN(Cc3ccc(F)cc3F)C2=O)cc1Cl ZINC000526048019 930515292 /nfs/dbraw/zinc/51/52/92/930515292.db2.gz QGBIJBWKBHSMSA-YJYMSZOUSA-N 0 3 408.876 4.469 20 0 HIADHN COc1ccc([C@@H](CCn2cncn2)NCc2c(C)nn(-c3ccccc3)c2C)cc1 ZINC000526107009 930536181 /nfs/dbraw/zinc/53/61/81/930536181.db2.gz ZMOWNNROJFSSLN-XMMPIXPASA-N 0 3 416.529 4.010 20 0 HIADHN CCC(CC)[C@@H](c1ccc(Cl)cc1)N(C)C(=O)NCCCCN1CCN(C)CC1 ZINC000526884974 930547902 /nfs/dbraw/zinc/54/79/02/930547902.db2.gz FSBMYAUTPNLZIE-QFIPXVFZSA-N 0 3 423.045 4.486 20 0 HIADHN C[C@@H](N[C@@H](C)c1cc2ccccc2s1)C(=O)NCCc1ccc2c(c1)OCCO2 ZINC000526944759 930554720 /nfs/dbraw/zinc/55/47/20/930554720.db2.gz OTIWBFPRQWWUJP-JKSUJKDBSA-N 0 3 410.539 4.071 20 0 HIADHN C[C@H](N[C@@H](C)c1cc2ccccc2s1)C(=O)NCCc1ccc2c(c1)OCCO2 ZINC000526944757 930555073 /nfs/dbraw/zinc/55/50/73/930555073.db2.gz OTIWBFPRQWWUJP-HOTGVXAUSA-N 0 3 410.539 4.071 20 0 HIADHN C[C@H](CNC(=O)[C@H]1CCCN(Cc2cccnc2)C1)c1ccc(C(F)(F)F)cc1 ZINC000526956102 930557487 /nfs/dbraw/zinc/55/74/87/930557487.db2.gz GJBUUTQCRQDJAW-APWZRJJASA-N 0 3 405.464 4.232 20 0 HIADHN C[C@@H](CC(=O)Nc1ccc(NC(=O)C2CC2)cc1)N[C@H]1CCOc2ccc(F)cc21 ZINC000527099722 930589921 /nfs/dbraw/zinc/58/99/21/930589921.db2.gz IDYJEURWNXLZFD-XOBRGWDASA-N 0 3 411.477 4.005 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)N1CCC[C@H](OCc2ccccc2F)C1 ZINC000527320090 930633491 /nfs/dbraw/zinc/63/34/91/930633491.db2.gz RPNUBKKEUYKPTI-IBGZPJMESA-N 0 3 415.509 4.109 20 0 HIADHN CSc1ccc(CN[C@H](CN2CCC(C(N)=O)CC2)c2ccc(Cl)cc2)cc1 ZINC000527373094 930650605 /nfs/dbraw/zinc/65/06/05/930650605.db2.gz YPTUAKRIZKURIK-OAQYLSRUSA-N 0 3 418.006 4.090 20 0 HIADHN CC(C)(NC(=O)[C@H]1CCCN(Cc2cccnc2)C1)c1ccc(OC(F)(F)F)cc1 ZINC000530404073 930701745 /nfs/dbraw/zinc/70/17/45/930701745.db2.gz MRUQAVCATRHOOK-KRWDZBQOSA-N 0 3 421.463 4.244 20 0 HIADHN COc1cc(Br)cc(C)c1NC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000530409443 930703837 /nfs/dbraw/zinc/70/38/37/930703837.db2.gz CZYMVVLOQBXPPX-APWZRJJASA-N 0 3 418.335 4.333 20 0 HIADHN Cc1cc(C)n(-c2ccc(NC(=O)N[C@H]3CCN(C)[C@H]3c3ccccc3)cc2F)n1 ZINC000530409929 930705059 /nfs/dbraw/zinc/70/50/59/930705059.db2.gz ZVYVVFSXRVUJOM-UNMCSNQZSA-N 0 3 407.493 4.195 20 0 HIADHN C[C@@H]1CCCCN1C(=O)c1ccc(NC(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)cc1 ZINC000530409869 930705276 /nfs/dbraw/zinc/70/52/76/930705276.db2.gz VZPAYNMUOGKDOU-YFXJRYMSSA-N 0 3 420.557 4.268 20 0 HIADHN C[C@@H](NC(=O)[C@H]1CCCN(Cc2cccnc2)C1)c1ccc(-c2cccnc2)cc1 ZINC000530619209 930774533 /nfs/dbraw/zinc/77/45/33/930774533.db2.gz NZTBNEOZPWKSGB-DVECYGJZSA-N 0 3 400.526 4.233 20 0 HIADHN COc1cc2c(cc1CNCCC(=O)Nc1cc(C)c(Cl)cc1OC)O[C@H](C)C2 ZINC000530631027 930778927 /nfs/dbraw/zinc/77/89/27/930778927.db2.gz JYPQSTUWRSVPJH-CQSZACIVSA-N 0 3 418.921 4.107 20 0 HIADHN COc1ccc(CCc2nc(-c3ccc(CN(C)C)cc3)no2)cc1Br ZINC000530633081 930780326 /nfs/dbraw/zinc/78/03/26/930780326.db2.gz YSJGQAZLIBIJMP-UHFFFAOYSA-N 0 3 416.319 4.355 20 0 HIADHN Cc1[nH]c(=O)c(C(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)cc1-c1ccccc1 ZINC000530684513 930797738 /nfs/dbraw/zinc/79/77/38/930797738.db2.gz BJTZNISTIDUUGX-RXVVDRJESA-N 0 3 401.510 4.328 20 0 HIADHN C[C@H](Sc1ccccc1)c1ccc(NC(=O)C(=O)N2CC[C@@H](N3CCCC3)C2)cc1 ZINC000530747090 930815469 /nfs/dbraw/zinc/81/54/69/930815469.db2.gz VJZSLSMMKJKFAR-GHTZIAJQSA-N 0 3 423.582 4.175 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)c1ccc(-n2cc(Br)cn2)cc1 ZINC000530898260 930853172 /nfs/dbraw/zinc/85/31/72/930853172.db2.gz JXBKHZVXVZCZHB-UHFFFAOYSA-N 0 3 413.319 4.257 20 0 HIADHN COc1cc([C@@H](C)NCc2cnc3cccc(C)n23)ccc1OCc1ccncc1 ZINC000530904196 930855208 /nfs/dbraw/zinc/85/52/08/930855208.db2.gz GKRRHYNPLHWJDK-GOSISDBHSA-N 0 3 402.498 4.476 20 0 HIADHN COC(=O)c1cc2c(o1)c(OC)ccc2CNCc1ccc(Br)s1 ZINC000530904506 930855362 /nfs/dbraw/zinc/85/53/62/930855362.db2.gz VURSQYURXZQAMD-UHFFFAOYSA-N 0 3 410.289 4.342 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)CCSc3ccc(F)cc3)CC2)C[C@@H](C)O1 ZINC000530940951 930862797 /nfs/dbraw/zinc/86/27/97/930862797.db2.gz SGBDTOLUQPZLOQ-QZTJIDSGSA-N 0 3 408.583 4.046 20 0 HIADHN CO[C@H](C)c1nc(CN2CCCN(CCCOc3ccc(Cl)cc3)CC2)cs1 ZINC000531231364 930975748 /nfs/dbraw/zinc/97/57/48/930975748.db2.gz NTLZLJCEIRKBER-QGZVFWFLSA-N 0 3 424.010 4.481 20 0 HIADHN Cc1sc([C@H](C)NC(=O)N[C@H]2CCN(C3CC3)C2)nc1-c1ccc(Cl)cc1 ZINC000531263617 930987652 /nfs/dbraw/zinc/98/76/52/930987652.db2.gz YHXLSVOVSHFYNE-LRDDRELGSA-N 0 3 404.967 4.369 20 0 HIADHN CC[C@@H](C(=O)Nc1ccc(Cl)c(C(=O)NCc2ccccc2F)c1)N(CC)CC ZINC000531289134 931002850 /nfs/dbraw/zinc/00/28/50/931002850.db2.gz ZNHDSOXGXCJMAC-FQEVSTJZSA-N 0 3 419.928 4.468 20 0 HIADHN CN(C)Cc1ccc(-c2noc(C3CCN(C(=O)Nc4ccccc4)CC3)n2)cc1 ZINC000531348786 931026612 /nfs/dbraw/zinc/02/66/12/931026612.db2.gz ABZBNYYFYSBHRZ-UHFFFAOYSA-N 0 3 405.502 4.210 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2cccc(Nc3cnn(C)c3)c2)N2CCCC2)cc1 ZINC000531355432 931029578 /nfs/dbraw/zinc/02/95/78/931029578.db2.gz JWALTWOZJKZORC-HSZRJFAPSA-N 0 3 403.530 4.039 20 0 HIADHN O=C(NC[C@@H](Cc1ccccc1)c1ccccc1)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000531389268 931040712 /nfs/dbraw/zinc/04/07/12/931040712.db2.gz KQHJTTNDPGTSJK-CLJLJLNGSA-N 0 3 413.565 4.436 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)Cc2ccc(OC(F)(F)F)cc2)CC1 ZINC000531395935 931042660 /nfs/dbraw/zinc/04/26/60/931042660.db2.gz FMJGVKUUXPSKNX-UHFFFAOYSA-N 0 3 406.448 4.251 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)NCc2ncc(-c3ccccc3)o2)CC1 ZINC000531394458 931043224 /nfs/dbraw/zinc/04/32/24/931043224.db2.gz UHMIJRLNMPTJAS-UHFFFAOYSA-N 0 3 404.514 4.148 20 0 HIADHN CO[C@H](C)c1noc(CN2CCCN(Cc3ccc(-c4ccccc4)cc3)CC2)n1 ZINC000531416759 931048701 /nfs/dbraw/zinc/04/87/01/931048701.db2.gz OFGIOKSCFQPAOT-LJQANCHMSA-N 0 3 406.530 4.152 20 0 HIADHN COc1cc(CN[C@@H](c2cnn(C)c2)C(C)(C)C)ccc1OCc1c(C)noc1C ZINC000531445204 931059252 /nfs/dbraw/zinc/05/92/52/931059252.db2.gz AFLWFWIZBZNJPG-QFIPXVFZSA-N 0 3 412.534 4.490 20 0 HIADHN CCN1CCN(c2ccc(CNCc3cc(-c4ccccc4)ccc3OC)cn2)CC1 ZINC000531535411 931095634 /nfs/dbraw/zinc/09/56/34/931095634.db2.gz WMKXZJDQEWAJFN-UHFFFAOYSA-N 0 3 416.569 4.189 20 0 HIADHN FC(F)(F)c1ccc(OCCNCc2ccccc2OCc2cccnc2)nc1 ZINC000531609602 931122934 /nfs/dbraw/zinc/12/29/34/931122934.db2.gz VWYZXEROLVUEDX-UHFFFAOYSA-N 0 3 403.404 4.243 20 0 HIADHN O=C(CN1CC[C@@H](Cc2ccccc2)C1)NCc1cccc(COCc2ccco2)c1 ZINC000531643720 931136834 /nfs/dbraw/zinc/13/68/34/931136834.db2.gz HFRRKGMTRROHGE-QHCPKHFHSA-N 0 3 418.537 4.177 20 0 HIADHN C[C@H](NCc1ccc(-n2cccn2)cc1)c1ccc(S(=O)(=O)C2CCCC2)cc1 ZINC000531682418 931151029 /nfs/dbraw/zinc/15/10/29/931151029.db2.gz UZRFHPCMVPUFDL-SFHVURJKSA-N 0 3 409.555 4.439 20 0 HIADHN CC[C@H](N[C@H](C)c1cc(OC)c(OC)cc1C)c1ccccc1OCC(=O)N(C)C ZINC000531700201 931163810 /nfs/dbraw/zinc/16/38/10/931163810.db2.gz QDEWIHHLFQZPRI-XLIONFOSSA-N 0 3 414.546 4.281 20 0 HIADHN CC[C@H](N[C@@H](C)c1cc(OC)c(OC)cc1C)c1ccccc1OCC(=O)N(C)C ZINC000531700200 931164211 /nfs/dbraw/zinc/16/42/11/931164211.db2.gz QDEWIHHLFQZPRI-PXNSSMCTSA-N 0 3 414.546 4.281 20 0 HIADHN CN1CCN(C[C@@H](N[C@@H]2CCSc3ccc(Cl)cc32)c2ccccc2)CC1 ZINC000531710116 931169211 /nfs/dbraw/zinc/16/92/11/931169211.db2.gz KKHSZGILHXDBGF-NHCUHLMSSA-N 0 3 402.007 4.455 20 0 HIADHN COc1ccc([C@H](C)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2=O)cc1OC ZINC000531724080 931174161 /nfs/dbraw/zinc/17/41/61/931174161.db2.gz REVCEKZJTWRBHV-KSSFIOAISA-N 0 3 420.456 4.151 20 0 HIADHN Cc1ccc(-c2cccc(CNCc3ccc(C(=O)N4CCOCC4)cc3)c2)cc1 ZINC000531807609 931205800 /nfs/dbraw/zinc/20/58/00/931205800.db2.gz TUTCJNKVWVWCMU-UHFFFAOYSA-N 0 3 400.522 4.424 20 0 HIADHN O=S(=O)(c1ccc(CNCc2cc3ccccc3s2)cc1)N1CCCCC1 ZINC000531818070 931207396 /nfs/dbraw/zinc/20/73/96/931207396.db2.gz NHDAJYKAKZXLQJ-UHFFFAOYSA-N 0 3 400.569 4.366 20 0 HIADHN CC(C)c1ccc([C@H](NC(=O)N2CC[C@H](N3CCN(C(C)C)CC3)C2)C(C)C)cc1 ZINC000531839044 931215015 /nfs/dbraw/zinc/21/50/15/931215015.db2.gz MENNKDJOJOATQQ-BJKOFHAPSA-N 0 3 414.638 4.317 20 0 HIADHN CC(C)CCNC(=O)C1CCN(C(=O)CN2CCCCC[C@@H]2c2ccccc2)CC1 ZINC000531897768 931238534 /nfs/dbraw/zinc/23/85/34/931238534.db2.gz KXFLFELWDZLCEN-HSZRJFAPSA-N 0 3 413.606 4.005 20 0 HIADHN COc1cc(OC)c([C@H](C)NC[C@@H](c2cccs2)N2CCN(C)CC2)cc1Cl ZINC000531932584 931251271 /nfs/dbraw/zinc/25/12/71/931251271.db2.gz UEWOQBBVAJPYHR-YJBOKZPZSA-N 0 3 424.010 4.058 20 0 HIADHN CC(C)Oc1ccc(CN[C@@H](C)CC(=O)Nc2ccc(OC(F)(F)F)cc2)cn1 ZINC000531937028 931253278 /nfs/dbraw/zinc/25/32/78/931253278.db2.gz LGXVFMDMZYYODG-AWEZNQCLSA-N 0 3 411.424 4.274 20 0 HIADHN CNS(=O)(=O)c1ccc([C@H](C)N[C@H](C)c2sc(-c3ccccc3)nc2C)cc1 ZINC000531952602 931261623 /nfs/dbraw/zinc/26/16/23/931261623.db2.gz WNYWYMBPDSYYII-LSDHHAIUSA-N 0 3 415.584 4.438 20 0 HIADHN C[C@@H](NCCCS(=O)(=O)c1ccccc1)c1ccc(F)c(Br)c1 ZINC000531951886 931262068 /nfs/dbraw/zinc/26/20/68/931262068.db2.gz DXZKBBRANMCOBJ-CYBMUJFWSA-N 0 3 400.313 4.103 20 0 HIADHN Cc1c([C@@H](C)N[C@@H](C)Cn2cc(Br)cn2)cnn1-c1ccc(F)cc1 ZINC000531962415 931266830 /nfs/dbraw/zinc/26/68/30/931266830.db2.gz KMCUUKFMDISMCC-QWHCGFSZSA-N 0 3 406.303 4.018 20 0 HIADHN C[C@H](NCc1cccc(CS(C)(=O)=O)c1)c1ccc(OCC(F)(F)F)cc1 ZINC000531963361 931267500 /nfs/dbraw/zinc/26/75/00/931267500.db2.gz ANRAQEDKPLVHFP-AWEZNQCLSA-N 0 3 401.450 4.023 20 0 HIADHN CC(C)N1CCN([C@H]2CCN(C(=O)c3ccc(SCc4ccccc4)cc3)C2)CC1 ZINC000532093647 931309317 /nfs/dbraw/zinc/30/93/17/931309317.db2.gz TYQQWOUXYYYMDM-QHCPKHFHSA-N 0 3 423.626 4.219 20 0 HIADHN CC(C)N1CCN([C@@H]2CCN(C(=O)Nc3ccccc3SC3CCCC3)C2)CC1 ZINC000532096678 931310778 /nfs/dbraw/zinc/31/07/78/931310778.db2.gz UJHUYFMJKZGVQI-LJQANCHMSA-N 0 3 416.635 4.354 20 0 HIADHN CC(C)(C)N1CCCN(C(=O)c2cn(C3CC3)c3cc(Cl)c(F)cc3c2=O)CC1 ZINC000532155882 931330949 /nfs/dbraw/zinc/33/09/49/931330949.db2.gz JIUFPLGDBGCNOB-UHFFFAOYSA-N 0 3 419.928 4.075 20 0 HIADHN CCC(=O)Nc1cccc(CN[C@@H](C)CC(=O)Nc2ccc(OC(F)(F)F)cc2)c1 ZINC000532192092 931343299 /nfs/dbraw/zinc/34/32/99/931343299.db2.gz UKKIYINXJGMDBV-AWEZNQCLSA-N 0 3 423.435 4.441 20 0 HIADHN C[C@@H](NCc1ccc(N2CCN(C)CC2)nc1)c1ccc(SCC(F)(F)F)cc1 ZINC000532197120 931345107 /nfs/dbraw/zinc/34/51/07/931345107.db2.gz GDAJMKZTQAKJAF-MRXNPFEDSA-N 0 3 424.536 4.339 20 0 HIADHN COCC(=O)Nc1cccc(CN[C@H](Cc2cccc(OC)c2)c2ccccc2)c1 ZINC000532197593 931345253 /nfs/dbraw/zinc/34/52/53/931345253.db2.gz WUOGVLBHSZXPJW-XMMPIXPASA-N 0 3 404.510 4.354 20 0 HIADHN CCc1nc2c(s1)[C@@H](N[C@@H](C)c1ccc(S(=O)(=O)N(CC)CC)cc1)CCC2 ZINC000532203038 931348316 /nfs/dbraw/zinc/34/83/16/931348316.db2.gz CJERPEDPSVAVMN-YJBOKZPZSA-N 0 3 421.632 4.464 20 0 HIADHN COc1cc(CN[C@H](C)CC(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)ccn1 ZINC000532202935 931348410 /nfs/dbraw/zinc/34/84/10/931348410.db2.gz KBLBIJPGUIWSIP-LLVKDONJSA-N 0 3 401.816 4.269 20 0 HIADHN C[C@@H](NC[C@H](c1ccc(F)cc1)N1CCOCC1)c1sccc1Br ZINC000532204371 931348991 /nfs/dbraw/zinc/34/89/91/931348991.db2.gz ZDXSDKFXAODORJ-CXAGYDPISA-N 0 3 413.356 4.374 20 0 HIADHN Cc1cc(C)c2c(c1)[C@@H](NCc1ccc(CS(=O)(=O)NC(C)C)cc1)CCCO2 ZINC000532207322 931351203 /nfs/dbraw/zinc/35/12/03/931351203.db2.gz RHABQGIKJNEKFR-QFIPXVFZSA-N 0 3 416.587 4.135 20 0 HIADHN COc1ccc(CN[C@@H](C)CC(=O)Nc2ccc(OC(F)(F)F)cc2)c(OC)c1 ZINC000532208730 931352211 /nfs/dbraw/zinc/35/22/11/931352211.db2.gz QPVXYWNWMCHSMD-ZDUSSCGKSA-N 0 3 412.408 4.109 20 0 HIADHN C[C@H](NCc1ccc(OCCOc2ccccc2)nc1)c1ccc2c(c1)CCC(=O)N2 ZINC000532210704 931353246 /nfs/dbraw/zinc/35/32/46/931353246.db2.gz JZJMQJRMONDXSG-SFHVURJKSA-N 0 3 417.509 4.275 20 0 HIADHN C[C@@H](NCc1ccc2c(c1)nnn2C)c1cccc(NC(=O)Cc2ccccc2F)c1 ZINC000532211917 931353912 /nfs/dbraw/zinc/35/39/12/931353912.db2.gz AMQXATWRCCOGDC-MRXNPFEDSA-N 0 3 417.488 4.139 20 0 HIADHN CNC(=O)C1CCC(N[C@@H](C)c2ccc(Br)cc2Br)CC1 ZINC000532217921 931358519 /nfs/dbraw/zinc/35/85/19/931358519.db2.gz CWZWPAQRZFEIJE-ZBOXLXRLSA-N 0 3 418.173 4.167 20 0 HIADHN CCOc1ccc(Cl)cc1[C@@H](C)N[C@H](CN1CCN(C)CC1)c1ccccc1 ZINC000532221240 931359786 /nfs/dbraw/zinc/35/97/86/931359786.db2.gz HIYCGAMGBPOAHT-XMSQKQJNSA-N 0 3 401.982 4.378 20 0 HIADHN C[C@@H](NCCOc1ccc(F)cc1F)c1ccc(S(=O)(=O)C2CCCC2)cc1 ZINC000532247752 931370878 /nfs/dbraw/zinc/37/08/78/931370878.db2.gz OCWLHQPKJOHPTH-OAHLLOKOSA-N 0 3 409.498 4.411 20 0 HIADHN C[C@H](NCCOc1ccc(F)cc1F)c1ccc(S(=O)(=O)C2CCCC2)cc1 ZINC000532247751 931371075 /nfs/dbraw/zinc/37/10/75/931371075.db2.gz OCWLHQPKJOHPTH-HNNXBMFYSA-N 0 3 409.498 4.411 20 0 HIADHN CC(C)(C)n1cc(CN[C@H]2CCN(c3ncc(C(F)(F)F)cc3Cl)C2)cn1 ZINC000532322108 931396699 /nfs/dbraw/zinc/39/66/99/931396699.db2.gz CUQMXTATVVNESP-AWEZNQCLSA-N 0 3 401.864 4.074 20 0 HIADHN COc1ccc([C@H](C)NCc2ccc(OCCN3CCOCC3)c(Cl)c2)cc1F ZINC000532346606 931403733 /nfs/dbraw/zinc/40/37/33/931403733.db2.gz RHLNABSWSWVMRQ-INIZCTEOSA-N 0 3 422.928 4.050 20 0 HIADHN Cc1ccc(NC(=O)N2CC[C@H](N3CCN(C(C)C)CC3)C2)cc1OCCC(C)C ZINC000532350968 931404629 /nfs/dbraw/zinc/40/46/29/931404629.db2.gz CMBDVWKOPDORAG-QFIPXVFZSA-N 0 3 416.610 4.052 20 0 HIADHN Cc1ccc(NC(=O)N2CC[C@@H](N3CCN(C(C)C)CC3)C2)cc1OCCC(C)C ZINC000532350965 931404664 /nfs/dbraw/zinc/40/46/64/931404664.db2.gz CMBDVWKOPDORAG-JOCHJYFZSA-N 0 3 416.610 4.052 20 0 HIADHN Cn1cc(CNCc2ccc(C(=O)Nc3ccc(F)cc3)cc2)c(-c2cccnc2)n1 ZINC000532373872 931414084 /nfs/dbraw/zinc/41/40/84/931414084.db2.gz AFFSYDZHRVOUAY-UHFFFAOYSA-N 0 3 415.472 4.163 20 0 HIADHN C[C@H](NCc1ccc(Cn2cnc3ccccc32)cc1)c1ccc(S(C)(=O)=O)cc1 ZINC000532464549 931446591 /nfs/dbraw/zinc/44/65/91/931446591.db2.gz FMWAUNDXAXZVBM-SFHVURJKSA-N 0 3 419.550 4.339 20 0 HIADHN CC[C@H](N[C@@H](CN1CCN(C)CC1)c1ccccc1)c1ccccc1OC(F)F ZINC000532481121 931455432 /nfs/dbraw/zinc/45/54/32/931455432.db2.gz OXLKUMSYHOTUKE-SFTDATJTSA-N 0 3 403.517 4.317 20 0 HIADHN CC(C)(COc1ncc(Cl)cc1Cl)NCc1ccc(Br)cn1 ZINC000532495781 931461021 /nfs/dbraw/zinc/46/10/21/931461021.db2.gz JAJUVRXYAGIOAO-UHFFFAOYSA-N 0 3 405.123 4.493 20 0 HIADHN C[C@@H](N[C@H](CN1CCN(C)CC1)c1ccccc1)c1ccc(Br)s1 ZINC000532498122 931462953 /nfs/dbraw/zinc/46/29/53/931462953.db2.gz BJZYTTPAAHXXKT-NVXWUHKLSA-N 0 3 408.409 4.150 20 0 HIADHN C[C@H](N[C@@H](CN1CCN(C)CC1)c1ccccc1)c1ccc(Br)s1 ZINC000532498123 931463271 /nfs/dbraw/zinc/46/32/71/931463271.db2.gz BJZYTTPAAHXXKT-RDJZCZTQSA-N 0 3 408.409 4.150 20 0 HIADHN Cc1cccc(O[C@@H]2CCCC[C@H]2NC(=O)[C@H]2CCCN(Cc3cccnc3)C2)c1 ZINC000532516150 931470922 /nfs/dbraw/zinc/47/09/22/931470922.db2.gz ZTCQFEUXZQDFAO-QPTUXGOLSA-N 0 3 407.558 4.108 20 0 HIADHN C[C@H](CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)N[C@H]1c2ccccc2C[C@H]1O ZINC000532520984 931473390 /nfs/dbraw/zinc/47/33/90/931473390.db2.gz KMQLZKWFWPUQIG-JPJOULJCSA-N 0 3 412.839 4.324 20 0 HIADHN NC(=O)CC[C@@H]1CCCN(Cc2c(-c3ccc(Cl)cc3)nc3sccn23)C1 ZINC000532524005 931474305 /nfs/dbraw/zinc/47/43/05/931474305.db2.gz DBXZPZHQNMPVJK-AWEZNQCLSA-N 0 3 402.951 4.194 20 0 HIADHN O=C(Nc1ccccc1)c1cccc(CN2CCC(c3nnc4ccccn43)CC2)c1 ZINC000532571545 931532078 /nfs/dbraw/zinc/53/20/78/931532078.db2.gz QTDOUCFALPEQJJ-UHFFFAOYSA-N 0 3 411.509 4.361 20 0 HIADHN CO[C@H](C)c1noc(CN2CCCN([C@@H](C)c3ccc(C(C)(C)C)cc3)CC2)n1 ZINC000532645367 931566068 /nfs/dbraw/zinc/56/60/68/931566068.db2.gz SGPGRPONRZXBTE-ZWKOTPCHSA-N 0 3 400.567 4.343 20 0 HIADHN CCCN(C(=O)c1cccs1)C1CCN(Cc2ccc(-n3ccnc3)cc2)CC1 ZINC000532648856 931567024 /nfs/dbraw/zinc/56/70/24/931567024.db2.gz CKIMHNJIAICDRO-UHFFFAOYSA-N 0 3 408.571 4.451 20 0 HIADHN Cc1nn(-c2ccc(C)cc2)c(C)c1NC(=O)CNC1(c2ccccc2)CCOCC1 ZINC000532708518 931600349 /nfs/dbraw/zinc/60/03/49/931600349.db2.gz DNPUMHGMVVOAOV-UHFFFAOYSA-N 0 3 418.541 4.032 20 0 HIADHN O=C(CNC1(c2ccccc2)CCOCC1)N[C@H](c1ccc(F)cc1)C1CCCC1 ZINC000532708455 931601336 /nfs/dbraw/zinc/60/13/36/931601336.db2.gz AWLJKLOOKBUYPP-DEOSSOPVSA-N 0 3 410.533 4.469 20 0 HIADHN O=C(CN[C@@H](c1ccccc1)C1CCCC1)NCCc1cnn(-c2ccccc2)c1 ZINC000532714016 931604649 /nfs/dbraw/zinc/60/46/49/931604649.db2.gz IJEPEIWSIGCAOO-VWLOTQADSA-N 0 3 402.542 4.052 20 0 HIADHN COc1cccc(COCCNCc2c(C)nn(-c3ccc(F)cc3F)c2C)c1 ZINC000532829257 931645270 /nfs/dbraw/zinc/64/52/70/931645270.db2.gz XCHORFHPCKJVMU-UHFFFAOYSA-N 0 3 401.457 4.082 20 0 HIADHN Brc1ccc(CNCc2ccc3ncccc3c2)c(N2CCOCC2)c1 ZINC000532879393 931677359 /nfs/dbraw/zinc/67/73/59/931677359.db2.gz ZJXVDNWBNXKODD-UHFFFAOYSA-N 0 3 412.331 4.124 20 0 HIADHN CC[C@@H](C)[C@@H](C)N(CC(=O)Nc1ccccc1I)C1CC1 ZINC000532966321 931717204 /nfs/dbraw/zinc/71/72/04/931717204.db2.gz FKBFCQHETOCAOP-CHWSQXEVSA-N 0 3 400.304 4.129 20 0 HIADHN CCCN(CC(=O)Nc1ccc(Br)cc1F)[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC000532970202 931720153 /nfs/dbraw/zinc/72/01/53/931720153.db2.gz ADGDLTPBEUTRKY-VHSSKADRSA-N 0 3 413.331 4.052 20 0 HIADHN C[C@H]1C[C@H](c2ccccc2)CN1CC(=O)Nc1cccc(CN2CCSCC2)c1 ZINC000532977953 931723878 /nfs/dbraw/zinc/72/38/78/931723878.db2.gz XXSDKFSZELPPDC-UGKGYDQZSA-N 0 3 409.599 4.052 20 0 HIADHN C[C@H](CNCc1nc(-c2cc(Cl)ccc2Cl)cs1)CN1CCOCC1 ZINC000533149410 931787487 /nfs/dbraw/zinc/78/74/87/931787487.db2.gz SOJFRZXWKUBEOY-CYBMUJFWSA-N 0 3 400.375 4.175 20 0 HIADHN CCCn1c2ccccc2nc1CNC[C@@H](CO)Cc1ccc(C(F)(F)F)cc1 ZINC000533187440 931804777 /nfs/dbraw/zinc/80/47/77/931804777.db2.gz ZGJCSXXWHUWVQH-KRWDZBQOSA-N 0 3 405.464 4.406 20 0 HIADHN C[C@H](C1CC1)N(CC(=O)N1CCC(OCc2ccccc2)CC1)Cc1ccccc1 ZINC000533243996 931817413 /nfs/dbraw/zinc/81/74/13/931817413.db2.gz UWADPJLIVXNVMZ-OAQYLSRUSA-N 0 3 406.570 4.495 20 0 HIADHN CCC[C@@H](Cc1ccccc1)N(CCC)Cc1nnc2n1c1ccsc1c(=O)n2C ZINC000533262115 931822306 /nfs/dbraw/zinc/82/23/06/931822306.db2.gz GIXWTQYPUAWKQN-SFHVURJKSA-N 0 3 423.586 4.266 20 0 HIADHN O=C(Nc1ccc(Sc2ccncc2)cc1)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000533262376 931822437 /nfs/dbraw/zinc/82/24/37/931822437.db2.gz UARHAXUXLMRILC-IBGZPJMESA-N 0 3 404.539 4.479 20 0 HIADHN O=C(CCN1CCC[C@@H](OCC(F)(F)F)C1)NC(c1ccccc1)c1ccccc1 ZINC000533290395 931830048 /nfs/dbraw/zinc/83/00/48/931830048.db2.gz HBIUWWMITYTBLJ-HXUWFJFHSA-N 0 3 420.475 4.326 20 0 HIADHN CCCN(CC(=O)Nc1ccc(OC(F)(F)F)cc1)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000533292440 931830995 /nfs/dbraw/zinc/83/09/95/931830995.db2.gz KOTDVOUGMGQVQL-NXHRZFHOSA-N 0 3 400.441 4.049 20 0 HIADHN CCCN(CC(=O)Nc1ccc(Br)cc1C)[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC000533293657 931831019 /nfs/dbraw/zinc/83/10/19/931831019.db2.gz YYLJNWROPWKCRI-IPELMVKDSA-N 0 3 409.368 4.222 20 0 HIADHN Cc1ccccc1C(=O)NC1CCN(CCc2nc(-c3cccc(Cl)c3)no2)CC1 ZINC000533358233 931847724 /nfs/dbraw/zinc/84/77/24/931847724.db2.gz OETJKGNIJCUEKI-UHFFFAOYSA-N 0 3 424.932 4.135 20 0 HIADHN COc1ccc(Br)c(CNCCc2nc(-c3ccccn3)cs2)c1 ZINC000533360953 931848168 /nfs/dbraw/zinc/84/81/68/931848168.db2.gz AJUUGMYYLNBRSU-UHFFFAOYSA-N 0 3 404.333 4.309 20 0 HIADHN C/C=C/c1ccc(OC[C@H](O)CN(C)[C@H]2CCCc3nc(C)sc32)c(OC)c1 ZINC000533386194 931854598 /nfs/dbraw/zinc/85/45/98/931854598.db2.gz FMSFMFZJTPIRAW-RJGJNRFASA-N 0 3 402.560 4.242 20 0 HIADHN O=C(CN[C@H](c1ccccc1)C1CCCC1)NCc1ccccc1Cn1cccn1 ZINC000533384206 931854696 /nfs/dbraw/zinc/85/46/96/931854696.db2.gz LGWDBAGHVUHQNF-RUZDIDTESA-N 0 3 402.542 4.069 20 0 HIADHN Cc1cc(NC(=O)CN[C@H](c2ccccc2)C2CCCC2)n(-c2nc(C)cc(C)n2)n1 ZINC000533386817 931855268 /nfs/dbraw/zinc/85/52/68/931855268.db2.gz ZPALJCVZDNXLEK-HSZRJFAPSA-N 0 3 418.545 4.047 20 0 HIADHN Cc1nc2ccccc2nc1CN1CCC(C(=O)N(Cc2ccccc2)C2CC2)CC1 ZINC000533394097 931856569 /nfs/dbraw/zinc/85/65/69/931856569.db2.gz UWUKWRBLWLAHQS-UHFFFAOYSA-N 0 3 414.553 4.341 20 0 HIADHN COc1ccccc1CC1CCN(CC(=O)N2CCc3[nH]c4ccccc4c3C2)CC1 ZINC000533400974 931858622 /nfs/dbraw/zinc/85/86/22/931858622.db2.gz JOPKYTJYQRRNMC-UHFFFAOYSA-N 0 3 417.553 4.016 20 0 HIADHN CC[C@H](Cc1ccccc1)N(C)CC(=O)N1CCC[C@@H]1c1ccc(OC)c(OC)c1 ZINC000533431910 931866820 /nfs/dbraw/zinc/86/68/20/931866820.db2.gz RIKYLMWZYGAIOR-FGZHOGPDSA-N 0 3 410.558 4.320 20 0 HIADHN CC(C)Cc1ncc(CN[C@@H](C)CC(=O)Nc2cccc(N3CCCC3)c2)s1 ZINC000533449410 931873297 /nfs/dbraw/zinc/87/32/97/931873297.db2.gz SRGXFUMLORYBKM-KRWDZBQOSA-N 0 3 400.592 4.449 20 0 HIADHN C[C@@H]1CCCC[C@H]1N(C)C(=O)CNC1(c2cccc(Br)c2)CCOCC1 ZINC000533485262 931881687 /nfs/dbraw/zinc/88/16/87/931881687.db2.gz KTQMKQGJOLXRFB-VQIMIIECSA-N 0 3 423.395 4.082 20 0 HIADHN C[C@H](c1ccccc1F)N1CCC(C(=O)Nc2ccc(Br)cn2)CC1 ZINC000533492041 931883765 /nfs/dbraw/zinc/88/37/65/931883765.db2.gz DDJQTFFSGCUNBY-CYBMUJFWSA-N 0 3 406.299 4.395 20 0 HIADHN C[C@H](N[C@@H](c1ccc(F)cc1)C1CCC1)C(=O)N[C@@H](C)c1ccc2c(c1)OCCO2 ZINC000533504090 931886616 /nfs/dbraw/zinc/88/66/16/931886616.db2.gz VHHHOSYLHYVTOD-PBPSECFOSA-N 0 3 412.505 4.294 20 0 HIADHN O=C(CN[C@@H](c1ccc(F)cc1)C1CCC1)N1CCC(OCc2ccccc2)CC1 ZINC000533505168 931887296 /nfs/dbraw/zinc/88/72/96/931887296.db2.gz BEFQQBPUKCYLOC-RUZDIDTESA-N 0 3 410.533 4.464 20 0 HIADHN O=C(CN[C@H](c1ccc(F)cc1)C1CCC1)N1CCC(OCc2ccccc2)CC1 ZINC000533505169 931887414 /nfs/dbraw/zinc/88/74/14/931887414.db2.gz BEFQQBPUKCYLOC-VWLOTQADSA-N 0 3 410.533 4.464 20 0 HIADHN COC(=O)c1cc2cc(CN3CCC(C(=O)Nc4cccc(F)c4)CC3)ccc2o1 ZINC000533507528 931888599 /nfs/dbraw/zinc/88/85/99/931888599.db2.gz CEIIXGREVQNZQD-UHFFFAOYSA-N 0 3 410.445 4.209 20 0 HIADHN COc1ccc(C(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)cc1-c1ccccn1 ZINC000533643013 931941121 /nfs/dbraw/zinc/94/11/21/931941121.db2.gz GXVCYNNZBCXIEO-WIYYLYMNSA-N 0 3 401.510 4.323 20 0 HIADHN Cc1c(C(=O)NC2CCN([C@@H](C)c3ccncc3)CC2)cccc1-c1ccccn1 ZINC000533651040 931946817 /nfs/dbraw/zinc/94/68/17/931946817.db2.gz NMRTZQXSNRQNEY-IBGZPJMESA-N 0 3 400.526 4.407 20 0 HIADHN COc1cc(CN[C@@H](C)c2ccc(-n3ccnn3)cc2)ccc1OCc1ccncc1 ZINC000533753030 932010823 /nfs/dbraw/zinc/01/08/23/932010823.db2.gz SBIPGUQKBCXRAO-SFHVURJKSA-N 0 3 415.497 4.101 20 0 HIADHN C[C@H](NCc1cnc([C@H]2CCCO2)s1)[C@@H](OC1CCOCC1)c1ccccc1 ZINC000533756623 932013202 /nfs/dbraw/zinc/01/32/02/932013202.db2.gz NDAHIDUPYHPVSK-ZLGUVYLKSA-N 0 3 402.560 4.410 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N1CCC[C@H]1Cn1cnc2ccccc21 ZINC000533767198 932021642 /nfs/dbraw/zinc/02/16/42/932021642.db2.gz OHOIOXWSNOAJAZ-GHTZIAJQSA-N 0 3 423.586 4.109 20 0 HIADHN CN(C)[C@@H](CNC(=O)c1ccc(-c2noc(CC(C)(C)C)n2)cc1)Cc1ccccc1 ZINC000533814444 932044163 /nfs/dbraw/zinc/04/41/63/932044163.db2.gz CFDPABYIVFFDRS-OAQYLSRUSA-N 0 3 420.557 4.228 20 0 HIADHN COC(=O)c1ccccc1CCC(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1 ZINC000533923572 932102458 /nfs/dbraw/zinc/10/24/58/932102458.db2.gz PFXASXGLUADNHE-FQEVSTJZSA-N 0 3 414.571 4.057 20 0 HIADHN CCCOc1ccc([C@H](C)NC(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)cc1OC ZINC000533929688 932106486 /nfs/dbraw/zinc/10/64/86/932106486.db2.gz LVBPSMJCDVQBIF-KPDCDPCYSA-N 0 3 411.546 4.290 20 0 HIADHN COc1ccc(CCC(=O)Nc2cc(C)cc(CN(C)C)c2)cc1Br ZINC000533967623 932142656 /nfs/dbraw/zinc/14/26/56/932142656.db2.gz RNJOVQDJWVJYHT-UHFFFAOYSA-N 0 3 405.336 4.399 20 0 HIADHN O=C(Nc1ccc2[nH]c(C(F)F)nc2c1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000533967841 932144928 /nfs/dbraw/zinc/14/49/28/932144928.db2.gz ZMGFYZXYLZECDD-AWEZNQCLSA-N 0 3 402.420 4.490 20 0 HIADHN COc1ccc(C[C@@H](C)CNC(=O)N(Cc2ccccc2)C2CCN(C)CC2)cc1 ZINC000533984677 932161540 /nfs/dbraw/zinc/16/15/40/932161540.db2.gz FECCLZBYQZHYKJ-HXUWFJFHSA-N 0 3 409.574 4.180 20 0 HIADHN COc1ccccc1COc1cccc(NC(=O)N2CC[C@@H](N3CC=CC3)C2)c1C ZINC000534013355 932194898 /nfs/dbraw/zinc/19/48/98/932194898.db2.gz OEOOAUBOBMRRQG-HXUWFJFHSA-N 0 3 407.514 4.061 20 0 HIADHN CN1CC[C@H](NC(=O)C2CCN(c3nc4ccccc4s3)CC2)[C@@H]1c1ccccc1 ZINC000534017963 932199264 /nfs/dbraw/zinc/19/92/64/932199264.db2.gz LTLQCZOTIPSSQI-UNMCSNQZSA-N 0 3 420.582 4.074 20 0 HIADHN CN1CC[C@H](NC(=O)Cc2c[nH]c3cc(Br)ccc23)[C@H]1c1ccccc1 ZINC000534017739 932199628 /nfs/dbraw/zinc/19/96/28/932199628.db2.gz CORXPLOCXNRZSQ-GHTZIAJQSA-N 0 3 412.331 4.035 20 0 HIADHN COC(=O)[C@@H]1CCCC[C@@]1(C)NCC(=O)Nc1c(Cl)cc(Cl)cc1Cl ZINC000534019449 932200993 /nfs/dbraw/zinc/20/09/93/932200993.db2.gz QWFKWJUZRMDIDZ-APPDUMDISA-N 0 3 407.725 4.297 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3CCc4c5ccccc5[nH]c4C3)c(C)c2)CC1 ZINC000534041094 932217025 /nfs/dbraw/zinc/21/70/25/932217025.db2.gz QOOMMMJFZGRDPD-UHFFFAOYSA-N 0 3 417.557 4.208 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NC[C@H](C)Cc3ccc(OC)cc3)c(C)c2)CC1 ZINC000534041068 932217332 /nfs/dbraw/zinc/21/73/32/932217332.db2.gz PSVAJFUTVFZOLR-LJQANCHMSA-N 0 3 424.589 4.146 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCc1cncc(C)c1)c1ccc(C(F)(F)F)cc1 ZINC000534071782 932250609 /nfs/dbraw/zinc/25/06/09/932250609.db2.gz ZCFBHEKJLBLYMB-IBGZPJMESA-N 0 3 408.468 4.291 20 0 HIADHN CC(C)Cn1ncc(NC(=O)N[C@H](CN2CCCC2)c2ccccc2)c1C(F)F ZINC000534087165 932266104 /nfs/dbraw/zinc/26/61/04/932266104.db2.gz ACPRMSIJUOHLJS-GOSISDBHSA-N 0 3 405.493 4.435 20 0 HIADHN CC[C@H](C)n1ncc(C(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)c1C1CC1 ZINC000534112835 932285570 /nfs/dbraw/zinc/28/55/70/932285570.db2.gz AHLMFRKYYJLFSE-FHWLQOOXSA-N 0 3 416.610 4.083 20 0 HIADHN Cc1ccc(C(=O)N(CCN(C)C)Cc2cccc(O)c2)cc1Oc1ccncc1 ZINC000534193868 932325178 /nfs/dbraw/zinc/32/51/78/932325178.db2.gz XDWCEAIKAAFCBF-UHFFFAOYSA-N 0 3 405.498 4.092 20 0 HIADHN Cc1ccc2[nH]c([C@H]3CCCN([C@H](C)C(=O)N4CCc5sccc5C4)C3)nc2c1 ZINC000534216251 932337464 /nfs/dbraw/zinc/33/74/64/932337464.db2.gz JYFRFOJGIRLEMV-AEFFLSMTSA-N 0 3 408.571 4.086 20 0 HIADHN Cc1ccc2nc([C@H]3CCCN([C@H](C)C(=O)N4CCc5sccc5C4)C3)[nH]c2c1 ZINC000534216251 932337472 /nfs/dbraw/zinc/33/74/72/932337472.db2.gz JYFRFOJGIRLEMV-AEFFLSMTSA-N 0 3 408.571 4.086 20 0 HIADHN CN(C)Cc1ccc(CNCC2=Cc3cc(Br)ccc3OC2)cc1F ZINC000534240045 932358841 /nfs/dbraw/zinc/35/88/41/932358841.db2.gz MMLUAVGMXMSITL-UHFFFAOYSA-N 0 3 405.311 4.215 20 0 HIADHN Cc1cnc(CCN(C)C[C@@H](O)CO[C@H](c2ccccc2)c2ccccc2C)s1 ZINC000534379838 932407654 /nfs/dbraw/zinc/40/76/54/932407654.db2.gz YXENZILFTWBECZ-ZJSXRUAMSA-N 0 3 410.583 4.401 20 0 HIADHN O=C([C@@H]1CC[C@@H]2CCCC[C@@H]2C1)N1CCC[C@@H](CN2CCN(c3ccccn3)CC2)C1 ZINC000534426467 932443087 /nfs/dbraw/zinc/44/30/87/932443087.db2.gz MJAUGLKBEWLNRB-CJRSTVEYSA-N 0 3 424.633 4.049 20 0 HIADHN Cc1cc(C)c(CC(C(=O)Nc2cc(-c3nccn3C)nn2C)C(F)(F)F)c(C)c1 ZINC000534474027 932502632 /nfs/dbraw/zinc/50/26/32/932502632.db2.gz AGJCTSVEVHHUHH-INIZCTEOSA-N 0 3 419.451 4.106 20 0 HIADHN Cc1cc(C)c(CC(C(=O)Nc2ccc3c(c2)oc(=O)n3C)C(F)(F)F)c(C)c1 ZINC000534474538 932504782 /nfs/dbraw/zinc/50/47/82/932504782.db2.gz NCVHZCOONLNJJT-INIZCTEOSA-N 0 3 406.404 4.416 20 0 HIADHN FC(F)(F)c1nc2nc[nH]c2c(NC[C@H](c2ccccc2Cl)N2CCCC2)n1 ZINC000534520755 932543514 /nfs/dbraw/zinc/54/35/14/932543514.db2.gz LYNFYWOXZQSWPW-CYBMUJFWSA-N 0 3 410.831 4.226 20 0 HIADHN FC(F)(F)c1nc2nc[nH]c2c(NC[C@@H](c2ccccc2Cl)N2CCCC2)n1 ZINC000534520756 932543759 /nfs/dbraw/zinc/54/37/59/932543759.db2.gz LYNFYWOXZQSWPW-ZDUSSCGKSA-N 0 3 410.831 4.226 20 0 HIADHN CN1CC[C@@H](NC(=O)NCc2ccc(COCC(F)(F)F)cc2)[C@@H]1c1ccccc1 ZINC000534610359 932594315 /nfs/dbraw/zinc/59/43/15/932594315.db2.gz RHAUKHOAUKZEEW-UXHICEINSA-N 0 3 421.463 4.010 20 0 HIADHN CN(Cc1ccc(Br)s1)C(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000534681644 932652141 /nfs/dbraw/zinc/65/21/41/932652141.db2.gz KBPKANCOFULHGF-DOTOQJQBSA-N 0 3 408.365 4.097 20 0 HIADHN CN1CC[C@H](NC(=O)N2CCC[C@H](c3nc4c(s3)CCCC4)C2)[C@H]1c1ccccc1 ZINC000534682387 932652317 /nfs/dbraw/zinc/65/23/17/932652317.db2.gz QPWFKXRNIKHNNB-RCZSKKKRSA-N 0 3 424.614 4.356 20 0 HIADHN CC(=O)N1CCN(c2ccccc2CN[C@@H]2CCc3c2cc(Cl)cc3Cl)CC1 ZINC000534793990 932774792 /nfs/dbraw/zinc/77/47/92/932774792.db2.gz GPLJWBLLFRKOHP-OAQYLSRUSA-N 0 3 418.368 4.439 20 0 HIADHN CC(C)Cn1ncc(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2)c1C(F)F ZINC000534823037 932794747 /nfs/dbraw/zinc/79/47/47/932794747.db2.gz OEGVPCJXUFXCLJ-UHFFFAOYSA-N 0 3 411.472 4.212 20 0 HIADHN COc1ccc(C[C@@H](C)CN(C)CC(=O)Nc2ccc(N3CCCC3)cc2C)cc1 ZINC000534906016 932832542 /nfs/dbraw/zinc/83/25/42/932832542.db2.gz KBQQYUNZJMXTIP-LJQANCHMSA-N 0 3 409.574 4.353 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)NC1CCC(F)(F)CC1 ZINC000534936484 932845942 /nfs/dbraw/zinc/84/59/42/932845942.db2.gz VJBGROWNRBGTRP-UHFFFAOYSA-N 0 3 407.427 4.357 20 0 HIADHN CC(C)c1ccc([C@@H]2CCCCN2C(=O)NCCCCN2CCN(C)CC2)cc1 ZINC000535006698 932883789 /nfs/dbraw/zinc/88/37/89/932883789.db2.gz LJUHKWNSMRFAJH-QHCPKHFHSA-N 0 3 400.611 4.074 20 0 HIADHN O=C(NC1CC1)c1ccc(CN(Cc2ccc(OCC(F)F)cc2)C2CC2)cc1 ZINC000535071164 932897407 /nfs/dbraw/zinc/89/74/07/932897407.db2.gz RSHIXKVZXJSMSE-UHFFFAOYSA-N 0 3 400.469 4.387 20 0 HIADHN O=C(NC1CC1)c1ccc(CN(Cc2ccc(OC[C@@H]3CCCO3)cc2)C2CC2)cc1 ZINC000535071265 932897748 /nfs/dbraw/zinc/89/77/48/932897748.db2.gz SFRSRLJOXLUKTH-VWLOTQADSA-N 0 3 420.553 4.301 20 0 HIADHN O=C1NCCN1[C@H]1CCCN(Cc2ccc(-c3ccccc3Br)s2)C1 ZINC000535082998 932899788 /nfs/dbraw/zinc/89/97/88/932899788.db2.gz GQXAMRHIYBEIRS-AWEZNQCLSA-N 0 3 420.376 4.167 20 0 HIADHN C[C@H]1CN(CCCCNC(=O)c2cc(-c3ccccn3)ccc2Cl)C[C@H](C)O1 ZINC000535096616 932913141 /nfs/dbraw/zinc/91/31/41/932913141.db2.gz VJMYNZLUBDAFJG-IRXDYDNUSA-N 0 3 401.938 4.021 20 0 HIADHN CCc1ccc(CNCc2ccccc2CS(=O)(=O)N2CCC(C)CC2)s1 ZINC000535201747 933011200 /nfs/dbraw/zinc/01/12/00/933011200.db2.gz NSURTDZTHKYUEA-UHFFFAOYSA-N 0 3 406.617 4.162 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)N1CCC[C@@H]1Cn1cnc2ccccc21 ZINC000535216645 933021852 /nfs/dbraw/zinc/02/18/52/933021852.db2.gz QKSDOTWYQHEYOB-ZJSXRUAMSA-N 0 3 417.557 4.047 20 0 HIADHN Cc1cc(NC(=O)NCCSCC(C)C)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000535218978 933023305 /nfs/dbraw/zinc/02/33/05/933023305.db2.gz GAQTXJFEEDLPLZ-FQEVSTJZSA-N 0 3 415.607 4.149 20 0 HIADHN CC(C)n1cnnc1[C@@H]1CCCN(CCC(=O)Nc2cc(Cl)ccc2Cl)C1 ZINC000535271421 933043943 /nfs/dbraw/zinc/04/39/43/933043943.db2.gz UBAHPUQGOZQHJA-CQSZACIVSA-N 0 3 410.349 4.374 20 0 HIADHN Cc1ccc(-c2nc(C(=O)NC[C@H]3CCCN(C)[C@@H]3c3cccs3)cs2)n1C ZINC000535388183 933108794 /nfs/dbraw/zinc/10/87/94/933108794.db2.gz JQSGZXWSJMXRAD-BEFAXECRSA-N 0 3 414.600 4.331 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N[C@@H](C)Cc1c(Cl)cccc1Cl ZINC000535396986 933115081 /nfs/dbraw/zinc/11/50/81/933115081.db2.gz VLRKYZYJGIFPRS-AWEZNQCLSA-N 0 3 422.356 4.049 20 0 HIADHN CCOc1cc2c(cc1[C@@H]1C[C@@H]1C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1)O[C@H](C)C2 ZINC000535468027 933158488 /nfs/dbraw/zinc/15/84/88/933158488.db2.gz GWXVZHXOKRZWGX-LNQAAEHSSA-N 0 3 420.553 4.074 20 0 HIADHN C[C@@H](CNC(=O)Nc1cccc2c1CN(c1nccs1)C2)N(C)Cc1ccccc1 ZINC000535475946 933169180 /nfs/dbraw/zinc/16/91/80/933169180.db2.gz NTPORRWEIJFIPZ-KRWDZBQOSA-N 0 3 421.570 4.305 20 0 HIADHN C[C@@H](CNC(=O)c1oc2ccccc2c1CN(C)C)c1nc(-c2ccccc2)no1 ZINC000535548450 933237073 /nfs/dbraw/zinc/23/70/73/933237073.db2.gz NYHJDKNUYIYCEW-HNNXBMFYSA-N 0 3 404.470 4.078 20 0 HIADHN O=C(CCCc1csc2ccccc12)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1CO ZINC000535632369 933275116 /nfs/dbraw/zinc/27/51/16/933275116.db2.gz QCEMFBXWTGNQAG-JTHBVZDNSA-N 0 3 422.594 4.223 20 0 HIADHN O=C(CCCc1csc2ccccc12)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1CO ZINC000535632362 933275510 /nfs/dbraw/zinc/27/55/10/933275510.db2.gz QCEMFBXWTGNQAG-GGAORHGYSA-N 0 3 422.594 4.223 20 0 HIADHN COc1cc(CN2CCC[C@@H](c3nc4ccc(F)cc4o3)C2)cc(OC)c1OC ZINC000535809341 933404470 /nfs/dbraw/zinc/40/44/70/933404470.db2.gz SACZRALMEQQGHF-OAHLLOKOSA-N 0 3 400.450 4.372 20 0 HIADHN Cc1cc(C)c(CC(C(=O)Nc2ccnn2C[C@H]2CCOC2)C(F)(F)F)c(C)c1 ZINC000535879851 933461064 /nfs/dbraw/zinc/46/10/64/933461064.db2.gz NNVVUXUZNPWHKH-AEFFLSMTSA-N 0 3 409.452 4.205 20 0 HIADHN CCSc1ccc([C@H](C)NCc2cccc(OCCN3CCOCC3)c2)cc1 ZINC000535987668 933548155 /nfs/dbraw/zinc/54/81/55/933548155.db2.gz WYQDFEWUPQRKFC-IBGZPJMESA-N 0 3 400.588 4.360 20 0 HIADHN COc1cc(CN[C@@H]2CCN(C(C)=O)c3ccccc32)ccc1OCC(F)(F)F ZINC000536008945 933566738 /nfs/dbraw/zinc/56/67/38/933566738.db2.gz WVQXNXKOACVLQB-QGZVFWFLSA-N 0 3 408.420 4.224 20 0 HIADHN CCOc1ccc(-c2nc(CC(=O)NC[C@@H](Cc3ccccc3)N(C)C)cs2)cc1 ZINC000536013718 933571213 /nfs/dbraw/zinc/57/12/13/933571213.db2.gz JQQXQTQYMHCUIW-OAQYLSRUSA-N 0 3 423.582 4.040 20 0 HIADHN Clc1cc(Br)cc2c1CC[C@@H]2NCc1cccnc1-n1cccn1 ZINC000536153612 933689438 /nfs/dbraw/zinc/68/94/38/933689438.db2.gz WANVDCVJGJIZDE-KRWDZBQOSA-N 0 3 403.711 4.460 20 0 HIADHN CC[C@H](N[C@@H]1CCO[C@@H]1c1ccc(F)c(F)c1)c1ccccc1OCC(=O)N(C)C ZINC000537303162 933705894 /nfs/dbraw/zinc/70/58/94/933705894.db2.gz CVKMKRBSGNJHLE-MIZPHKNDSA-N 0 3 418.484 4.003 20 0 HIADHN C[C@H](N[C@@H]1CCC[C@H](S(C)(=O)=O)C1)c1cc2cc(Br)ccc2o1 ZINC000537307071 933707926 /nfs/dbraw/zinc/70/79/26/933707926.db2.gz KMGKPYSESIQAPC-GLQYFDAESA-N 0 3 400.338 4.202 20 0 HIADHN CCN1CC[C@H](NCc2c(C)nc3sc(C)nn23)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000537353166 933731474 /nfs/dbraw/zinc/73/14/74/933731474.db2.gz ZXODFMFWNFWNAC-WMZOPIPTSA-N 0 3 407.946 4.125 20 0 HIADHN CN1CC[C@@H](NCc2nc(-c3ccc(Br)cc3)c[nH]2)[C@H]1c1ccccc1 ZINC000537360746 933736454 /nfs/dbraw/zinc/73/64/54/933736454.db2.gz GWTRUVALKWPYHS-WIYYLYMNSA-N 0 3 411.347 4.374 20 0 HIADHN Cc1cc(C(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)nn1-c1cccc(Cl)c1 ZINC000537461881 933785793 /nfs/dbraw/zinc/78/57/93/933785793.db2.gz MQKDPQZWFROCEB-OAQYLSRUSA-N 0 3 408.933 4.181 20 0 HIADHN CC(C)(C)[C@H](CN1CCc2ccccc2C1)NC(=O)N1CCC[C@H]1C1CCOCC1 ZINC000537527782 933800837 /nfs/dbraw/zinc/80/08/37/933800837.db2.gz OQGFHVZEZXDIIN-GOTSBHOMSA-N 0 3 413.606 4.060 20 0 HIADHN COc1ccccc1-c1csc([C@@H]2CCCN(CCOC[C@@H]3CCCO3)C2)n1 ZINC000562493368 945089566 /nfs/dbraw/zinc/08/95/66/945089566.db2.gz MKKWHXFYCGBKFG-MSOLQXFVSA-N 0 3 402.560 4.194 20 0 HIADHN C[C@@H]1CN(CCC(=O)Nc2ccc(Oc3ccccc3)cc2)CC2(CCOCC2)O1 ZINC000562615892 945107248 /nfs/dbraw/zinc/10/72/48/945107248.db2.gz YQDLLCACJQKATF-LJQANCHMSA-N 0 3 410.514 4.077 20 0 HIADHN CCOc1cc(CN2CC[C@](CO)(Cc3ccc(F)cc3)C2)ccc1OC(F)F ZINC000562905571 945147321 /nfs/dbraw/zinc/14/73/21/945147321.db2.gz SEQNAQZMZVPMIC-QFIPXVFZSA-N 0 3 409.448 4.253 20 0 HIADHN c1cn(Cc2ccccc2)c(CN2CCC[C@H](c3n[nH]c(C4CCCCC4)n3)C2)n1 ZINC000537564342 938326277 /nfs/dbraw/zinc/32/62/77/938326277.db2.gz TVYZOOIVSVMHEE-NRFANRHFSA-N 0 3 404.562 4.477 20 0 HIADHN COc1cccc(-c2nn(C(C)(C)C)cc2CN2CCC(N3CCCCC3=O)CC2)c1 ZINC000537621726 938336763 /nfs/dbraw/zinc/33/67/63/938336763.db2.gz DYZBMTUMAPXJSV-UHFFFAOYSA-N 0 3 424.589 4.291 20 0 HIADHN COCCOC1CCN(Cc2cn(-c3ccccc3Cl)nc2C(C)(C)C)CC1 ZINC000537626614 938338606 /nfs/dbraw/zinc/33/86/06/938338606.db2.gz ANTQJWZEBVQEPT-UHFFFAOYSA-N 0 3 405.970 4.451 20 0 HIADHN O=C(CCn1c2ccccc2nc1C1CC1)NC[C@@H](c1cccs1)N1CCCC1 ZINC000537642955 938344332 /nfs/dbraw/zinc/34/43/32/938344332.db2.gz CNRNJNXVMWPQLD-FQEVSTJZSA-N 0 3 408.571 4.319 20 0 HIADHN CCN(C[C@H]1CCN(Cc2c[nH]nc2-c2c(F)cccc2F)C1)CC(F)(F)F ZINC000537649871 938346830 /nfs/dbraw/zinc/34/68/30/938346830.db2.gz KJUYPWXLHIESRD-CYBMUJFWSA-N 0 3 402.411 4.061 20 0 HIADHN Cn1cc(CN2CC[C@@H](Oc3ccc(Cl)c(Cl)c3)C2)c(-c2cccnc2)n1 ZINC000537658445 938348670 /nfs/dbraw/zinc/34/86/70/938348670.db2.gz GTSVXDYAUCFUSH-QGZVFWFLSA-N 0 3 403.313 4.442 20 0 HIADHN CC(C)(C)OC(=O)C1CCC(NC(=O)NC[C@@H](c2ccccc2)N2CCCC2)CC1 ZINC000537676861 938351888 /nfs/dbraw/zinc/35/18/88/938351888.db2.gz NPQBVHXQWCGVGJ-CBNMVNINSA-N 0 3 415.578 4.023 20 0 HIADHN CCOCCO[C@H]1CCN(Cc2cn(Cc3ccccc3)nc2-c2ccccc2)C1 ZINC000537696507 938357335 /nfs/dbraw/zinc/35/73/35/938357335.db2.gz HIXHCJHEWYZAGY-DEOSSOPVSA-N 0 3 405.542 4.226 20 0 HIADHN c1nc(N2CCOCC2)sc1CN1CCc2ccccc2[C@H]1Cc1ccccc1 ZINC000537702992 938359506 /nfs/dbraw/zinc/35/95/06/938359506.db2.gz YIQFITSNJFIQLE-HSZRJFAPSA-N 0 3 405.567 4.322 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)CCc2nc3ccccc3s2)cc1 ZINC000537728182 938364123 /nfs/dbraw/zinc/36/41/23/938364123.db2.gz COVCKTSTZPARNA-FQEVSTJZSA-N 0 3 409.555 4.191 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)[C@H](C)Oc2ccc(SC)cc2)cc1 ZINC000537728225 938364234 /nfs/dbraw/zinc/36/42/34/938364234.db2.gz JCIDLGVEKQUQHT-JTSKRJEESA-N 0 3 414.571 4.138 20 0 HIADHN COCCn1ccc2ccc(NC(=O)N[C@H]3CCCN(Cc4ccccc4)C3)cc21 ZINC000537802662 938379981 /nfs/dbraw/zinc/37/99/81/938379981.db2.gz PEZTUKHDKOQXNU-QFIPXVFZSA-N 0 3 406.530 4.074 20 0 HIADHN CC(C)C[C@@H](NCc1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1)c1ccccc1 ZINC000537939026 938424223 /nfs/dbraw/zinc/42/42/23/938424223.db2.gz ZUBLHWDUAOPTEP-FYYLOGMGSA-N 0 3 416.587 4.021 20 0 HIADHN Cc1c([C@H](C)N[C@H](C)Cn2ncc3ccccc3c2=O)cnn1-c1cc(C)ccc1C ZINC000537941983 938426181 /nfs/dbraw/zinc/42/61/81/938426181.db2.gz KXKDPJBHNRRWJY-MOPGFXCFSA-N 0 3 415.541 4.247 20 0 HIADHN C[C@H](NCc1ccccc1CS(=O)(=O)N1CCCC1)c1cc2c(s1)CCCC2 ZINC000537943875 938427337 /nfs/dbraw/zinc/42/73/37/938427337.db2.gz FSOBQDNUQURULM-KRWDZBQOSA-N 0 3 418.628 4.403 20 0 HIADHN Cc1nc(-c2ccccc2Br)sc1[C@@H](C)N[C@@H]1CC(=O)N(C2CC2)C1 ZINC000537955061 938431743 /nfs/dbraw/zinc/43/17/43/938431743.db2.gz FWBYLBGGBKVVRE-DGCLKSJQSA-N 0 3 420.376 4.295 20 0 HIADHN C[C@@H]1Cc2ccc(F)cc2[C@H]1NCc1ccc(Br)cc1N1CCOCC1 ZINC000537960617 938435157 /nfs/dbraw/zinc/43/51/57/938435157.db2.gz BNYISQPYRKBBDS-SZNDQCEHSA-N 0 3 419.338 4.448 20 0 HIADHN C[C@H](N[C@H]1CCN(CC(F)(F)F)C1=O)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000537976758 938444691 /nfs/dbraw/zinc/44/46/91/938444691.db2.gz IGCPROZKJMISDX-LIRRHRJNSA-N 0 3 410.411 4.219 20 0 HIADHN O[C@H](CN[C@H](Cc1ccccc1F)c1ccccc1Br)C1CCOCC1 ZINC000537985596 938448689 /nfs/dbraw/zinc/44/86/89/938448689.db2.gz BGTWGYRNSRVTKU-NHCUHLMSSA-N 0 3 422.338 4.249 20 0 HIADHN O[C@@H](CN[C@@H](Cc1ccccc1F)c1ccccc1Br)C1CCOCC1 ZINC000537985605 938448920 /nfs/dbraw/zinc/44/89/20/938448920.db2.gz BGTWGYRNSRVTKU-SFTDATJTSA-N 0 3 422.338 4.249 20 0 HIADHN COc1ccc(OC)c(NC(=O)C[C@@H](C)N[C@H]2CCCOc3ccc(F)cc32)c1 ZINC000537989819 938451119 /nfs/dbraw/zinc/45/11/19/938451119.db2.gz HCKKQFCXHWBWOH-KDOFPFPSSA-N 0 3 402.466 4.064 20 0 HIADHN C[C@@H](NCc1ccccc1OCC(=O)NC[C@H]1CCCO1)c1ccc2c(c1)CCCC2 ZINC000537991863 938453075 /nfs/dbraw/zinc/45/30/75/938453075.db2.gz TWUIYPUTDHAKRY-NTKDMRAZSA-N 0 3 422.569 4.090 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)N[C@H]2CCN(CCCc3ccccc3)C2=O)cc1 ZINC000538018787 938464133 /nfs/dbraw/zinc/46/41/33/938464133.db2.gz XDNBJRGZYQNQQS-DVECYGJZSA-N 0 3 402.542 4.065 20 0 HIADHN CC(C)(C)OCc1ccccc1C(=O)Nc1ccc(C(=O)NCCN2CCCC2)cc1 ZINC000538018186 938464173 /nfs/dbraw/zinc/46/41/73/938464173.db2.gz MKZKQMKIIIMHCT-UHFFFAOYSA-N 0 3 423.557 4.080 20 0 HIADHN CCNC(=O)COc1cccc(CN[C@@H](C)c2sc(Cc3ccccc3)nc2C)c1 ZINC000538019828 938464775 /nfs/dbraw/zinc/46/47/75/938464775.db2.gz MVCBSOQPYQQDNY-KRWDZBQOSA-N 0 3 423.582 4.408 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)Nc1ccc(F)cc1OCC(F)F ZINC000538025473 938469142 /nfs/dbraw/zinc/46/91/42/938469142.db2.gz VPKGQNDINLTECW-UHFFFAOYSA-N 0 3 413.415 4.204 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(OCc2cccnc2)cc1)C(=O)N(C)Cc1cccc(F)c1 ZINC000538123748 938510233 /nfs/dbraw/zinc/51/02/33/938510233.db2.gz AZAPTSQPFZMBHQ-RTBURBONSA-N 0 3 421.516 4.497 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(OCc2cccnc2)cc1)C(=O)N1CCc2ccccc21 ZINC000538126797 938512370 /nfs/dbraw/zinc/51/23/70/938512370.db2.gz ZJGVEYIKDMKWEX-RTBURBONSA-N 0 3 401.510 4.289 20 0 HIADHN CC[C@H](N[C@@H](C)C(=O)N(C)Cc1ccc(OC)c(OC)c1)c1ccc(Cl)cc1 ZINC000538129051 938514169 /nfs/dbraw/zinc/51/41/69/938514169.db2.gz DABKHVXRWDCDSU-KXBFYZLASA-N 0 3 404.938 4.445 20 0 HIADHN C[C@H](NCC(=O)Nc1ccc(OC(F)F)c(Cl)c1)c1ccccc1-n1cccn1 ZINC000538160872 938530058 /nfs/dbraw/zinc/53/00/58/938530058.db2.gz FBTVKZJEHQIADC-ZDUSSCGKSA-N 0 3 420.847 4.416 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(OCC(F)(F)F)cc1)C(=O)NCCc1cccs1 ZINC000538161365 938530293 /nfs/dbraw/zinc/53/02/93/938530293.db2.gz AICLVEDPCVGPTB-UONOGXRCSA-N 0 3 400.466 4.087 20 0 HIADHN CN1CC[C@H](N[C@H]2CCN(c3ccc(Cl)cc3Cl)C2=O)[C@@H]1c1ccccc1 ZINC000563330026 945183443 /nfs/dbraw/zinc/18/34/43/945183443.db2.gz HLQIELQEIXIFPH-BJLQDIEVSA-N 0 3 404.341 4.134 20 0 HIADHN O=C1[C@H](N[C@@H](c2ccc(Br)cc2)C2CCC2)CCN1CC(F)(F)F ZINC000538177397 938538446 /nfs/dbraw/zinc/53/84/46/938538446.db2.gz UKVDTTSJNNENLH-HUUCEWRRSA-N 0 3 405.258 4.043 20 0 HIADHN O=C(CN[C@H](c1ccccc1)[C@H]1CCOC1)Nc1nc(-c2ccc(F)cc2)cs1 ZINC000538187468 938543583 /nfs/dbraw/zinc/54/35/83/938543583.db2.gz HVJIKYNJVYECEJ-LAUBAEHRSA-N 0 3 411.502 4.255 20 0 HIADHN Cc1ccc(NC(=O)CN[C@@H](C)c2cccc(-n3cccn3)c2)c(Br)c1 ZINC000538189216 938544474 /nfs/dbraw/zinc/54/44/74/938544474.db2.gz XTUOQCIWTHLQDE-HNNXBMFYSA-N 0 3 413.319 4.233 20 0 HIADHN Cc1cc(N2CCCC2)ccc1NC(=O)CN[C@H](C)c1cccc(-n2cccn2)c1 ZINC000538188782 938544964 /nfs/dbraw/zinc/54/49/64/938544964.db2.gz YNIOQIQHQYDWOT-LJQANCHMSA-N 0 3 403.530 4.070 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)N[C@H]1CCO[C@@H]1c1ccc(Cl)cc1 ZINC000538191585 938547371 /nfs/dbraw/zinc/54/73/71/938547371.db2.gz PILRWRWCQGVNJO-RBUKOAKNSA-N 0 3 407.967 4.005 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(-c2cccnc2)cc1)C(=O)Nc1ccc2c(c1)OCCO2 ZINC000538223515 938563674 /nfs/dbraw/zinc/56/36/74/938563674.db2.gz PFOCNKFXURBSGB-DLBZAZTESA-N 0 3 403.482 4.198 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(-n2ccnn2)cc1)C(=O)Nc1cccc(Cl)c1Cl ZINC000538232377 938566865 /nfs/dbraw/zinc/56/68/65/938566865.db2.gz AXZXPCHOOZWALB-CHWSQXEVSA-N 0 3 404.301 4.252 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(-n2ccnn2)cc1)C(=O)Nc1cccc(Cl)c1Cl ZINC000538232384 938567081 /nfs/dbraw/zinc/56/70/81/938567081.db2.gz AXZXPCHOOZWALB-STQMWFEESA-N 0 3 404.301 4.252 20 0 HIADHN O=C(CN[C@H](C[C@@H]1CCOC1)c1ccccc1)Nc1ccccc1Br ZINC000538232532 938567138 /nfs/dbraw/zinc/56/71/38/938567138.db2.gz DFEQGFJRPLTHRW-HNAYVOBHSA-N 0 3 403.320 4.145 20 0 HIADHN CS(=O)(=O)c1ccc(NC(=O)CN[C@@H](c2cccc(Cl)c2)C2CCCC2)cc1 ZINC000538232656 938567355 /nfs/dbraw/zinc/56/73/55/938567355.db2.gz GOJFKMUOSXRVOZ-OAQYLSRUSA-N 0 3 420.962 4.203 20 0 HIADHN CCN(CC)CCN(C(=O)[C@@H]1CCC(=O)[C@H](C)C1)c1cccc(Br)c1 ZINC000538256819 938575936 /nfs/dbraw/zinc/57/59/36/938575936.db2.gz QGIRKKWNDRGHIK-HZPDHXFCSA-N 0 3 409.368 4.129 20 0 HIADHN Cc1ccccc1[C@H](NCC(=O)NCc1ccc(C(=O)N2CCCC2)cc1)C(C)(C)C ZINC000538257698 938576045 /nfs/dbraw/zinc/57/60/45/938576045.db2.gz KDBXWOPDEUUMFH-DEOSSOPVSA-N 0 3 421.585 4.224 20 0 HIADHN CC[C@H]1Oc2cc([C@H](C)NCc3ccc4oc(C(=O)OC)cc4c3)ccc2NC1=O ZINC000538258467 938576488 /nfs/dbraw/zinc/57/64/88/938576488.db2.gz YXIDGQWYMIAWJB-SCLBCKFNSA-N 0 3 408.454 4.180 20 0 HIADHN COc1cccc(OC)c1OC1CCN(Cc2cn(C)nc2-c2ccccc2)CC1 ZINC000538265790 938578511 /nfs/dbraw/zinc/57/85/11/938578511.db2.gz NPPONPZBWJDVCP-UHFFFAOYSA-N 0 3 407.514 4.148 20 0 HIADHN COc1ccc(CCNC(=O)CN[C@H](c2ccc(Cl)cc2)[C@H]2C[C@@H]2C)cc1OC ZINC000538324635 938592948 /nfs/dbraw/zinc/59/29/48/938592948.db2.gz BCHWAQNBLHBQCV-IGCHPXFFSA-N 0 3 416.949 4.003 20 0 HIADHN CSc1ccc(C)c(NC(=O)NCCCCN2CCN(c3ccccc3)CC2)c1 ZINC000538324256 938593106 /nfs/dbraw/zinc/59/31/06/938593106.db2.gz FTCRIRZZNPIBDH-UHFFFAOYSA-N 0 3 412.603 4.441 20 0 HIADHN COc1ccc(CCNC(=O)CN[C@H](c2ccc(Cl)cc2)[C@@H]2C[C@H]2C)cc1OC ZINC000538324637 938593172 /nfs/dbraw/zinc/59/31/72/938593172.db2.gz BCHWAQNBLHBQCV-NFHUAXAMSA-N 0 3 416.949 4.003 20 0 HIADHN CCN(C[C@H]1CCN(CCc2cc(Cl)c3c(c2)OCCCO3)C1)CC(F)(F)F ZINC000538354372 938601973 /nfs/dbraw/zinc/60/19/73/938601973.db2.gz WAPWFGIYVVJEBO-MRXNPFEDSA-N 0 3 420.903 4.250 20 0 HIADHN CC(C)(C)[C@H](COc1ccccc1F)NCC(=O)N1CCC[C@@H](C(F)(F)F)C1 ZINC000538390686 938609597 /nfs/dbraw/zinc/60/95/97/938609597.db2.gz UOCNADRNWNCXGZ-PBHICJAKSA-N 0 3 404.448 4.010 20 0 HIADHN CCc1c2cc(C)ccc2oc1[C@@H](C)NC[C@H](O)COc1ccc2c(c1)CCC(=O)N2 ZINC000538396940 938610623 /nfs/dbraw/zinc/61/06/23/938610623.db2.gz JWZVHPUCRVWDJU-AEFFLSMTSA-N 0 3 422.525 4.279 20 0 HIADHN COc1ccc(CNC2(c3ccc(Br)cc3)CCOCC2)cc1OC ZINC000538398260 938611209 /nfs/dbraw/zinc/61/12/09/938611209.db2.gz HKUCVEVBTXHAJE-UHFFFAOYSA-N 0 3 406.320 4.262 20 0 HIADHN Cc1ccc(CNCc2ccccc2CS(=O)(=O)N2CCC(C)CC2)cc1C ZINC000538428612 938617930 /nfs/dbraw/zinc/61/79/30/938617930.db2.gz AVOATKFKABEOTN-UHFFFAOYSA-N 0 3 400.588 4.155 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)c1coc(-c2ccccc2Cl)n1 ZINC000538431157 938618368 /nfs/dbraw/zinc/61/83/68/938618368.db2.gz LHODOBZHASFKBB-UHFFFAOYSA-N 0 3 419.859 4.477 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N[C@H]1C[C@H]2CCC(C)(C)c3cccc1c32 ZINC000538483789 938632188 /nfs/dbraw/zinc/63/21/88/938632188.db2.gz COGLODPAINKRRV-GCJKJVERSA-N 0 3 419.569 4.411 20 0 HIADHN COc1ccc(C2(C(=O)N[C@@H]3CCN([C@H](C)c4ccccc4)C3)CCCC2)cc1OC ZINC000538529577 938642264 /nfs/dbraw/zinc/64/22/64/938642264.db2.gz RBECAZRCSNEXMQ-DENIHFKCSA-N 0 3 422.569 4.467 20 0 HIADHN Cc1cc(NC(=O)N(CCN(C)C)Cc2ccco2)nn1-c1ccccc1Cl ZINC000538630627 938667156 /nfs/dbraw/zinc/66/71/56/938667156.db2.gz AHODFJGDLFSTEM-UHFFFAOYSA-N 0 3 401.898 4.023 20 0 HIADHN Cc1ccc(NC(=O)CN[C@H]2CCN(C(C)C)[C@H]2c2ccc(F)c(F)c2)c(C)c1 ZINC000563472882 945194523 /nfs/dbraw/zinc/19/45/23/945194523.db2.gz UEFVJMOWLHLGBB-GMAHTHKFSA-N 0 3 401.501 4.334 20 0 HIADHN Cc1cc(C(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)nn1-c1cccc(F)c1 ZINC000538662843 938677725 /nfs/dbraw/zinc/67/77/25/938677725.db2.gz UTGDIAPOCRENBD-IBGZPJMESA-N 0 3 406.505 4.056 20 0 HIADHN CCOCCOc1ccc(Br)cc1CN(C)CCC1CCOCC1 ZINC000538719318 938690082 /nfs/dbraw/zinc/69/00/82/938690082.db2.gz ARRQQGDYSGZRLM-UHFFFAOYSA-N 0 3 400.357 4.113 20 0 HIADHN O=C(Nc1ccc(F)c(Cl)c1)C1CCN(Cc2c[nH]nc2-c2cccnc2)CC1 ZINC000538726503 938693359 /nfs/dbraw/zinc/69/33/59/938693359.db2.gz YQPGELIYOBBSIK-UHFFFAOYSA-N 0 3 413.884 4.115 20 0 HIADHN O=C1NCCCN1C1CCN(Cc2cccc(OCc3ccccc3Cl)c2)CC1 ZINC000538734871 938696641 /nfs/dbraw/zinc/69/66/41/938696641.db2.gz IDCWWCQDMDRMEE-UHFFFAOYSA-N 0 3 413.949 4.299 20 0 HIADHN CC(C)(C)n1cc(CN2CC[C@@H](CN3CCOCC3)C2)c(-c2ccccc2Cl)n1 ZINC000538733699 938696669 /nfs/dbraw/zinc/69/66/69/938696669.db2.gz REFGTOHZSFNJJN-SFHVURJKSA-N 0 3 416.997 4.113 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(CN(CCO)[C@H]3CCc4ccccc43)c2)cc1 ZINC000538739599 938697618 /nfs/dbraw/zinc/69/76/18/938697618.db2.gz DTWRDRJYVKWYLF-VWLOTQADSA-N 0 3 416.521 4.429 20 0 HIADHN CCN(CC(F)(F)F)C(=O)[C@H]1CCCN(Cc2cnc(C3CCCC3)s2)C1 ZINC000538752348 938702806 /nfs/dbraw/zinc/70/28/06/938702806.db2.gz BOSSTNLBMQZLTJ-HNNXBMFYSA-N 0 3 403.514 4.424 20 0 HIADHN COc1c(Br)cc(CN(C)CCOCC2CC2)cc1Br ZINC000538763440 938704634 /nfs/dbraw/zinc/70/46/34/938704634.db2.gz DSCHZKHBFIKCQA-UHFFFAOYSA-N 0 3 407.146 4.079 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)NC2CCC(C(=O)OC(C)(C)C)CC2)C1 ZINC000538781402 938709100 /nfs/dbraw/zinc/70/91/00/938709100.db2.gz ZPVLJIJWZMGINJ-WYNBGMTASA-N 0 3 415.578 4.022 20 0 HIADHN COc1ccc(CN(C(=O)N[C@@H]2CN(C3CC3)C[C@H]2C)C2CCCCC2)cc1OC ZINC000538811841 938719038 /nfs/dbraw/zinc/71/90/38/938719038.db2.gz JPFHRQFVYROYBJ-DYESRHJHSA-N 0 3 415.578 4.031 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)[C@H]2C[C@H]2c2ccc(F)cc2F)cc1 ZINC000538830775 938721806 /nfs/dbraw/zinc/72/18/06/938721806.db2.gz PDMIBGNVELRZLG-ONTIZHBOSA-N 0 3 400.469 4.030 20 0 HIADHN Nc1nc(CCN2CCC(OCC3CCCC3)CC2)nc2sc3c(c21)CCCC3 ZINC000538966863 938753658 /nfs/dbraw/zinc/75/36/58/938753658.db2.gz JCYOAYOPWYCZNZ-UHFFFAOYSA-N 0 3 414.619 4.366 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1ccn(-c2ccc(Cl)cc2Cl)n1 ZINC000538983677 938759618 /nfs/dbraw/zinc/75/96/18/938759618.db2.gz GPLXEFYWJCVBEM-UHFFFAOYSA-N 0 3 422.316 4.368 20 0 HIADHN C[C@H](NC[C@H](CO)Cc1ccccc1OC(F)(F)F)c1nc2c(s1)CCCC2 ZINC000538986000 938759793 /nfs/dbraw/zinc/75/97/93/938759793.db2.gz ZSEHYJVLRRRBCS-UONOGXRCSA-N 0 3 414.493 4.422 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@@H](C)N[C@@H](C)c2cnc3cc(C)nn3c2C)CC1 ZINC000538988033 938760482 /nfs/dbraw/zinc/76/04/82/938760482.db2.gz XGGCAVJZVZSPOM-MSOLQXFVSA-N 0 3 424.568 4.039 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@H](C)N[C@@H](C)c2cnc3cc(C)nn3c2C)CC1 ZINC000538988036 938760649 /nfs/dbraw/zinc/76/06/49/938760649.db2.gz XGGCAVJZVZSPOM-ROUUACIJSA-N 0 3 424.568 4.039 20 0 HIADHN CC(C)COc1ccc([C@H](C)NCc2ccc(S(=O)(=O)N3CCCC3)cc2)cc1 ZINC000539021455 938771485 /nfs/dbraw/zinc/77/14/85/938771485.db2.gz ZALCKXOFTCFQCR-IBGZPJMESA-N 0 3 416.587 4.357 20 0 HIADHN CCc1ccc([C@H](CO)N[C@@H](C)CC(=O)Nc2cccc(Br)c2)cc1 ZINC000539040086 938778137 /nfs/dbraw/zinc/77/81/37/938778137.db2.gz CDCYOPMFFAFGFG-LIRRHRJNSA-N 0 3 405.336 4.052 20 0 HIADHN COCCOc1ccc([C@H](C)N[C@@H]2CC(=O)N(C)[C@H]2c2ccc(Cl)c(F)c2)cc1 ZINC000539042319 938778648 /nfs/dbraw/zinc/77/86/48/938778648.db2.gz FFLMZUXBIYYZHQ-OTPBECDQSA-N 0 3 420.912 4.127 20 0 HIADHN COc1ccc([C@H](NC2CCN(c3ccccn3)CC2)c2ccccc2OC)cc1 ZINC000539043958 938780596 /nfs/dbraw/zinc/78/05/96/938780596.db2.gz ZJRGZRVSKQEGHG-VWLOTQADSA-N 0 3 403.526 4.447 20 0 HIADHN C[C@@H](Cn1ncc2ccccc2c1=O)N[C@@H](C)c1ccc(F)c(Br)c1 ZINC000539044232 938780616 /nfs/dbraw/zinc/78/06/16/938780616.db2.gz VVRVXEOCMBWXHN-STQMWFEESA-N 0 3 404.283 4.037 20 0 HIADHN CC[C@H](NCc1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1)c1cccc(Cl)c1 ZINC000539044997 938780833 /nfs/dbraw/zinc/78/08/33/938780833.db2.gz XTJCUIHCJVZJKQ-FPOVZHCZSA-N 0 3 422.978 4.038 20 0 HIADHN Cc1cccc(NC(=O)C[C@H](C)N[C@H]2CC(=O)N(C)[C@H]2c2ccc(Cl)cc2)c1C ZINC000539051823 938784277 /nfs/dbraw/zinc/78/42/77/938784277.db2.gz BXXYTPKYDNDUGG-RSDPBLMXSA-N 0 3 413.949 4.236 20 0 HIADHN Cc1nc(-c2ccccc2F)sc1[C@H](C)N[C@@H]1CCCN(CC(F)(F)F)C1=O ZINC000539053528 938784677 /nfs/dbraw/zinc/78/46/77/938784677.db2.gz XSZPOGZSMBIHQH-XHDPSFHLSA-N 0 3 415.456 4.462 20 0 HIADHN O=C1c2ccccc2C(=O)N1[C@@H]1CCCC[C@H](NCc2ccn(C3CCCC3)n2)C1 ZINC000539061427 938787999 /nfs/dbraw/zinc/78/79/99/938787999.db2.gz MHIPNBNKTYOGNJ-FXAWDEMLSA-N 0 3 406.530 4.085 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)N[C@@H](CO)c2cccc(Br)c2)cc1 ZINC000539066546 938790791 /nfs/dbraw/zinc/79/07/91/938790791.db2.gz OPHANUWVAKCYNI-VLIAUNLRSA-N 0 3 400.320 4.327 20 0 HIADHN C[C@@H](N[C@@H](COc1ccccc1F)c1ccccc1)c1ccc(-n2cnnn2)cc1 ZINC000539066968 938791027 /nfs/dbraw/zinc/79/10/27/938791027.db2.gz MTFULJYVNMPWQR-VGSWGCGISA-N 0 3 403.461 4.272 20 0 HIADHN CCc1cc(N2CCC[C@@H](N[C@H](COC)c3cccc(C(F)(F)F)c3)C2)ncn1 ZINC000539079015 938796851 /nfs/dbraw/zinc/79/68/51/938796851.db2.gz QHEXXKQWMNMBLP-RTBURBONSA-N 0 3 408.468 4.004 20 0 HIADHN O=C1c2ccccc2C(=O)N1[C@H]1CCCC[C@@H](NCc2coc(-c3ccccc3)n2)C1 ZINC000539087082 938800229 /nfs/dbraw/zinc/80/02/29/938800229.db2.gz QWJMJFIZFCGKAI-QUCCMNQESA-N 0 3 415.493 4.429 20 0 HIADHN CNS(=O)(=O)c1ccc([C@@H](C)NCc2ccc(-c3ccc(OC)cc3)cc2)cc1 ZINC000539088665 938800365 /nfs/dbraw/zinc/80/03/65/938800365.db2.gz YKDOJWQDDGGING-QGZVFWFLSA-N 0 3 410.539 4.121 20 0 HIADHN Cc1nc(-c2ccccc2F)sc1[C@@H](C)NCc1ccc(NS(C)(=O)=O)cc1 ZINC000539091764 938801358 /nfs/dbraw/zinc/80/13/58/938801358.db2.gz KNSPYDZPWXFKPM-CYBMUJFWSA-N 0 3 419.547 4.480 20 0 HIADHN CCCN1c2ccc(NC(=O)N[C@@H]3C[C@@H](C)N(Cc4ccccc4)C3)cc2CCC1=O ZINC000539130789 938808159 /nfs/dbraw/zinc/80/81/59/938808159.db2.gz OKGPDALXNACYPD-XMSQKQJNSA-N 0 3 420.557 4.160 20 0 HIADHN CCCN1C(=O)CCc2cc(NC(=O)c3oc4ccccc4c3CN(C)C)ccc21 ZINC000539148180 938811309 /nfs/dbraw/zinc/81/13/09/938811309.db2.gz PEZAKIRTCIKGDL-UHFFFAOYSA-N 0 3 405.498 4.436 20 0 HIADHN C[C@H](N[C@@H]1CCO[C@@H]1c1ccc(Cl)c(F)c1)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000539195554 938817918 /nfs/dbraw/zinc/81/79/18/938817918.db2.gz BFBZZNJSRGPWHH-OWOPXTPDSA-N 0 3 415.889 4.203 20 0 HIADHN CCOc1ccc([C@@H](C)NC(=O)CCCN[C@H](C)c2nc3ccccc3n2C)cc1 ZINC000539216255 938819866 /nfs/dbraw/zinc/81/98/66/938819866.db2.gz BIYFCKSKSDESQH-QZTJIDSGSA-N 0 3 408.546 4.280 20 0 HIADHN COc1ccccc1OCCN[C@H](CN1CCCC1=O)c1cccc(C(F)(F)F)c1 ZINC000539221690 938820818 /nfs/dbraw/zinc/82/08/18/938820818.db2.gz AEQISPPGXMRZEC-GOSISDBHSA-N 0 3 422.447 4.046 20 0 HIADHN CC[C@H](NCc1ccc(-n2nc(C)cc2C)cc1)c1ccccc1OCC(=O)N(C)C ZINC000539251708 938826207 /nfs/dbraw/zinc/82/62/07/938826207.db2.gz ATKVNAKNRCVHIF-QHCPKHFHSA-N 0 3 420.557 4.197 20 0 HIADHN Cc1ccc(S(=O)(=O)CCCN[C@@H](C)c2cccc(OCc3ccccn3)c2)cc1 ZINC000539253437 938827144 /nfs/dbraw/zinc/82/71/44/938827144.db2.gz FFSCWTFRBSNYOO-FQEVSTJZSA-N 0 3 424.566 4.484 20 0 HIADHN CC[C@@H](NCCCS(=O)(=O)c1ccc(F)cc1)c1ccccc1OC(F)F ZINC000539254856 938827529 /nfs/dbraw/zinc/82/75/29/938827529.db2.gz UQPRXQDECVOUKW-QGZVFWFLSA-N 0 3 401.450 4.332 20 0 HIADHN CC[C@@H](NCCn1cncn1)c1ccccc1OCc1ccccc1Br ZINC000539261202 938829107 /nfs/dbraw/zinc/82/91/07/938829107.db2.gz MHCWOEDSMIHOOY-LJQANCHMSA-N 0 3 415.335 4.361 20 0 HIADHN COc1cc(NC(=O)CN[C@@H](CC(C)(C)C)c2ccccc2)cc(OC)c1OC ZINC000539279857 938832732 /nfs/dbraw/zinc/83/27/32/938832732.db2.gz BUTHKZJGJMZAPD-SFHVURJKSA-N 0 3 400.519 4.418 20 0 HIADHN C[C@@H](NCc1cccc(C(=O)NCc2ccco2)c1)c1cccc(-n2cccn2)c1 ZINC000539288464 938834077 /nfs/dbraw/zinc/83/40/77/938834077.db2.gz JKDQZWPVSYOIPL-GOSISDBHSA-N 0 3 400.482 4.246 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CNC(=O)CN[C@@H](C)c1cccc(C)c1C ZINC000539289340 938834183 /nfs/dbraw/zinc/83/41/83/938834183.db2.gz LBOGMGCIWIPRPW-IBGZPJMESA-N 0 3 404.558 4.132 20 0 HIADHN COc1ccc2cc(CN(C)C(=O)CN[C@@H](c3ccccc3)[C@@H]3CCOC3)ccc2c1 ZINC000539288883 938834270 /nfs/dbraw/zinc/83/42/70/938834270.db2.gz GWKSEKZMXBOHFT-BVAGGSTKSA-N 0 3 418.537 4.174 20 0 HIADHN C[C@H](NC[C@@H](O)COc1cccc2ccccc21)c1cccc(N2CCCC2=O)c1 ZINC000539314000 938839552 /nfs/dbraw/zinc/83/95/52/938839552.db2.gz STYJNENOHOIBHS-PGRDOPGGSA-N 0 3 404.510 4.057 20 0 HIADHN CC(=O)Nc1ccc(S(=O)(=O)CCCN[C@H](c2ccc(F)cc2F)C(C)C)cc1 ZINC000539325640 938841758 /nfs/dbraw/zinc/84/17/58/938841758.db2.gz OJQRWJWICRJIIM-NRFANRHFSA-N 0 3 424.513 4.074 20 0 HIADHN O=C(CN[C@@H](C[C@H]1CCOC1)c1ccccc1)Nc1ccc(OC(F)(F)F)cc1 ZINC000539334868 938843749 /nfs/dbraw/zinc/84/37/49/938843749.db2.gz NPVZPLUJGLHAKJ-BEFAXECRSA-N 0 3 408.420 4.281 20 0 HIADHN CCc1ccc([C@H](CNC(=O)c2c(OC)ccc(SC)c2OC)N(C)C)cc1 ZINC000539365769 938849343 /nfs/dbraw/zinc/84/93/43/938849343.db2.gz PUDJALICNZNLGJ-KRWDZBQOSA-N 0 3 402.560 4.021 20 0 HIADHN O=C(CN[C@H](c1cccs1)C1CC1)N1c2ccccc2NC(=O)C[C@H]1C(F)(F)F ZINC000539368995 938849752 /nfs/dbraw/zinc/84/97/52/938849752.db2.gz XMVSYOAAAUZRHT-LPHOPBHVSA-N 0 3 423.460 4.095 20 0 HIADHN COc1ccc([C@@H](NC(=O)CN[C@@H](C)c2cccc(N3CCCC3)c2)C(C)C)cc1 ZINC000539379245 938851850 /nfs/dbraw/zinc/85/18/50/938851850.db2.gz SSIJKTZZRXWIBG-DFBJGRDBSA-N 0 3 409.574 4.460 20 0 HIADHN CCn1nccc1NC(=O)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000539428247 938859219 /nfs/dbraw/zinc/85/92/19/938859219.db2.gz HKOXXASMCJRRSN-UHFFFAOYSA-N 0 3 410.349 4.340 20 0 HIADHN CCOC(=O)c1c2c(sc1NC(=O)[C@H]1CCC(=O)C[C@@H]1C)C(C)(C)NC(C)(C)C2 ZINC000539550225 938878597 /nfs/dbraw/zinc/87/85/97/938878597.db2.gz CJCITCFANRTUSF-JSGCOSHPSA-N 0 3 420.575 4.028 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)Nc1ccnc(OCC(F)(F)F)c1 ZINC000539592414 938884971 /nfs/dbraw/zinc/88/49/71/938884971.db2.gz WPUATKKSNYXBIF-AWEZNQCLSA-N 0 3 414.453 4.043 20 0 HIADHN CC(C)[C@@H]1C[C@@H](N[C@@H](c2ccc(F)cc2)c2cccc(S(C)(=O)=O)c2)CCO1 ZINC000539608536 938887645 /nfs/dbraw/zinc/88/76/45/938887645.db2.gz QTTCSDCJQZSOAB-BVSLBCMMSA-N 0 3 405.535 4.112 20 0 HIADHN C[C@@]1(CCCO)CCCN1CC(=O)N[C@@H](c1ccccc1)c1cccc(Cl)c1 ZINC000539613634 938888009 /nfs/dbraw/zinc/88/80/09/938888009.db2.gz FOELGONGJJCKMT-GOTSBHOMSA-N 0 3 400.950 4.173 20 0 HIADHN CCN1CCN(c2ccccc2N[C@H](C)c2ccc(OC)c(Cn3cccn3)c2)CC1 ZINC000539648437 938893557 /nfs/dbraw/zinc/89/35/57/938893557.db2.gz VAHBHRMEPVABCP-HXUWFJFHSA-N 0 3 419.573 4.255 20 0 HIADHN NC(=O)[C@@H](N[C@H]1CC=C(c2ccc(F)cc2)CC1)c1ccc(Br)cc1 ZINC000539754172 938921978 /nfs/dbraw/zinc/92/19/78/938921978.db2.gz JNWFXGKYVJQYFU-OALUTQOASA-N 0 3 403.295 4.340 20 0 HIADHN C[C@@H](NCC(=O)Nc1cccc(N2CCCC2=O)c1)c1ccc(F)c2ccccc21 ZINC000563563966 945216437 /nfs/dbraw/zinc/21/64/37/945216437.db2.gz GDNLVKIIEFSBGJ-MRXNPFEDSA-N 0 3 405.473 4.395 20 0 HIADHN COc1ccc(CN2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)cc1OC ZINC000539826563 938947830 /nfs/dbraw/zinc/94/78/30/938947830.db2.gz VDVLHPRQQCRJDW-UHFFFAOYSA-N 0 3 406.885 4.347 20 0 HIADHN Cc1nn(Cc2ccc(Cl)cc2)c(C)c1CN1CCC[C@H](C(=O)N2CCCC2)C1 ZINC000539831119 938951025 /nfs/dbraw/zinc/95/10/25/938951025.db2.gz TXFRPLLMFSDGDI-FQEVSTJZSA-N 0 3 414.981 4.036 20 0 HIADHN Cn1cc(CN2CC[C@H](Oc3ccc(Cl)c(Cl)c3)C2)c(-c2ccncc2)n1 ZINC000539861820 938960095 /nfs/dbraw/zinc/96/00/95/938960095.db2.gz DYJJGVJBTXKLKM-KRWDZBQOSA-N 0 3 403.313 4.442 20 0 HIADHN CCc1cccc(C)c1NC(=O)CNC(C)(C)COc1ncccc1Br ZINC000539912987 938977424 /nfs/dbraw/zinc/97/74/24/938977424.db2.gz VRYDEZXVDAUBAP-UHFFFAOYSA-N 0 3 420.351 4.101 20 0 HIADHN CN(Cc1cc(Br)ccc1OCc1ccccn1)C[C@@H]1CCC[C@H]1O ZINC000539912637 938977455 /nfs/dbraw/zinc/97/74/55/938977455.db2.gz DRYQKXYNPKAYAH-HNAYVOBHSA-N 0 3 405.336 4.016 20 0 HIADHN O=C(CCCNCc1ncc(-c2ccccc2)s1)N1CCN(c2ccccc2)CC1 ZINC000539953767 938980979 /nfs/dbraw/zinc/98/09/79/938980979.db2.gz REWGHQMPWYIKPS-UHFFFAOYSA-N 0 3 420.582 4.029 20 0 HIADHN Brc1ccc2c(c1)[C@H](NCc1ccccc1N1CCOCC1)CCC2 ZINC000539968957 938982381 /nfs/dbraw/zinc/98/23/81/938982381.db2.gz FFUINRHBNAAWJX-HXUWFJFHSA-N 0 3 401.348 4.453 20 0 HIADHN CCc1nnc([C@H](C)Nc2cccc(N3CCN(CCc4ccccc4)CC3)c2)o1 ZINC000539974418 939027752 /nfs/dbraw/zinc/02/77/52/939027752.db2.gz PFOLYIDGUCXMOH-IBGZPJMESA-N 0 3 405.546 4.170 20 0 HIADHN C[C@@H](Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1)c1nc(C2CC2)no1 ZINC000539974581 939028046 /nfs/dbraw/zinc/02/80/46/939028046.db2.gz QTLCZBJQTYUFNB-LJQANCHMSA-N 0 3 417.557 4.485 20 0 HIADHN Brc1cccc(-c2nc(CN[C@H]3CCO[C@]4(CCOC4)C3)cs2)c1 ZINC000539976972 939028359 /nfs/dbraw/zinc/02/83/59/939028359.db2.gz JXFYQZUXKUYHIG-MAUKXSAKSA-N 0 3 409.349 4.000 20 0 HIADHN COc1cc(OC)cc(N2CC[C@@H](CN[C@@H](C)c3nc4c(s3)CCCC4)C2)c1 ZINC000540084384 939063925 /nfs/dbraw/zinc/06/39/25/939063925.db2.gz BKWSTRHQKVSOQV-HOTGVXAUSA-N 0 3 401.576 4.216 20 0 HIADHN C[C@@H](NC[C@H](c1ccc(Cl)cc1)N1CCOCC1)c1nc2c(s1)CCCC2 ZINC000540085229 939064833 /nfs/dbraw/zinc/06/48/33/939064833.db2.gz NKXFFENQGPXALI-DNVCBOLYSA-N 0 3 405.995 4.399 20 0 HIADHN C[C@@H](NC[C@H](CO)Cc1cccc(OC(F)(F)F)c1)c1nc2c(s1)CCCC2 ZINC000540087052 939065376 /nfs/dbraw/zinc/06/53/76/939065376.db2.gz QLFKJVVUWKQGIH-UKRRQHHQSA-N 0 3 414.493 4.422 20 0 HIADHN COc1ccccc1-c1ccc([C@H](C)NCc2ccc(S(=O)(=O)N(C)C)cc2)cc1 ZINC000540117331 939078775 /nfs/dbraw/zinc/07/87/75/939078775.db2.gz DANRQOGBYXHBNZ-SFHVURJKSA-N 0 3 424.566 4.463 20 0 HIADHN COc1cc(CN[C@@H](C)c2ccc(-c3ccncc3)cc2)ccc1OCC(=O)N(C)C ZINC000540119278 939079722 /nfs/dbraw/zinc/07/97/22/939079722.db2.gz PJISCFOKEIRPGJ-SFHVURJKSA-N 0 3 419.525 4.075 20 0 HIADHN Cc1cc(NC(=O)N(Cc2ccccc2)C2CCN(C)CC2)nn1-c1ccccc1 ZINC000540137494 939087039 /nfs/dbraw/zinc/08/70/39/939087039.db2.gz YGADBHZEIJGHLR-UHFFFAOYSA-N 0 3 403.530 4.309 20 0 HIADHN COc1ccc([C@H](C)N[C@H]2CC(=O)N(C)[C@@H]2c2ccc(Cl)c(F)c2)cc1OC ZINC000540139077 939087867 /nfs/dbraw/zinc/08/78/67/939087867.db2.gz KEYXWLPKIYXPCG-ODLKPZKQSA-N 0 3 406.885 4.119 20 0 HIADHN C[C@@H](N[C@@H]1CCc2cc(F)ccc21)c1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000540139336 939087915 /nfs/dbraw/zinc/08/79/15/939087915.db2.gz QYULZVXPMFBQTH-OPAMFIHVSA-N 0 3 402.535 4.338 20 0 HIADHN Cc1cccc(COc2ccc([C@H](C)N[C@H]3CCN(CC(F)(F)F)C3=O)cc2)c1 ZINC000540173211 939102664 /nfs/dbraw/zinc/10/26/64/939102664.db2.gz AQKDNLLLBFYUMQ-JXFKEZNVSA-N 0 3 406.448 4.388 20 0 HIADHN COCCSc1ccc([C@@H](C)N[C@@H](C)c2cccc(NS(C)(=O)=O)c2)cc1 ZINC000540173664 939103452 /nfs/dbraw/zinc/10/34/52/939103452.db2.gz HOWUGHCGSZXWJZ-CVEARBPZSA-N 0 3 408.589 4.208 20 0 HIADHN COc1ccc([C@@H](Cc2ccncc2)NCc2ccnc(OC3CCOCC3)c2)cc1 ZINC000563631342 945227539 /nfs/dbraw/zinc/22/75/39/945227539.db2.gz RYQQBEXTLYHQOI-XMMPIXPASA-N 0 3 419.525 4.117 20 0 HIADHN O=C(CCCN[C@H]1CCc2c1c(Br)ccc2F)N1Cc2ccccc2C1 ZINC000540178863 939106808 /nfs/dbraw/zinc/10/68/08/939106808.db2.gz PQGNPWNUNAPQSJ-IBGZPJMESA-N 0 3 417.322 4.488 20 0 HIADHN O=C(C1CCC1)N(CCCN[C@@H]1CCc2c1c(Br)ccc2F)C1CC1 ZINC000540179879 939107302 /nfs/dbraw/zinc/10/73/02/939107302.db2.gz IXPNBAQCRUIEMI-GOSISDBHSA-N 0 3 409.343 4.346 20 0 HIADHN Cc1c([C@H](C)NC2CCN(C(=O)NC3CCCCC3)CC2)nnn1-c1ccc(C)cc1 ZINC000540182310 939108347 /nfs/dbraw/zinc/10/83/47/939108347.db2.gz UAZMUBPTDTVALA-SFHVURJKSA-N 0 3 424.593 4.041 20 0 HIADHN COc1ccc(CN2CC[C@@H](N[C@H](C)c3ccc4cc(OC)ccc4c3)C2=O)cc1 ZINC000540181159 939108936 /nfs/dbraw/zinc/10/89/36/939108936.db2.gz FGNPHJMYLWSBIR-MZNJEOGPSA-N 0 3 404.510 4.309 20 0 HIADHN CC(=O)Nc1cccc([C@H](C)NCCOc2ncc(C(F)(F)F)cc2Cl)c1 ZINC000540183312 939109563 /nfs/dbraw/zinc/10/95/63/939109563.db2.gz GXYYEPBQXZYSFX-NSHDSACASA-N 0 3 401.816 4.442 20 0 HIADHN Cc1cc2c(cc1C)[C@@H](N[C@H](C)c1ccc(S(=O)(=O)N(C)C)cc1)CCCO2 ZINC000540191465 939115469 /nfs/dbraw/zinc/11/54/69/939115469.db2.gz PKAREXMEQVTPME-UTKZUKDTSA-N 0 3 402.560 4.118 20 0 HIADHN COc1ccc([C@H](CCC(C)C)NCc2ccc(S(=O)(=O)N(C)C)cc2)cc1 ZINC000540190974 939115766 /nfs/dbraw/zinc/11/57/66/939115766.db2.gz VRYVNOHRCZFLBE-QFIPXVFZSA-N 0 3 404.576 4.213 20 0 HIADHN Cc1cc(C)c([C@@H](C)NCc2ccccc2OCC(=O)NC[C@@H]2CCCO2)cc1C ZINC000540191632 939116237 /nfs/dbraw/zinc/11/62/37/939116237.db2.gz SRCRPQMFWGIFBF-IRLDBZIGSA-N 0 3 410.558 4.137 20 0 HIADHN CC(=O)Nc1cccc(OCCN[C@@H](C)c2cnn(-c3cc(C)ccc3C)c2C)c1 ZINC000540193574 939118660 /nfs/dbraw/zinc/11/86/60/939118660.db2.gz AVWHBWHPNSJVIX-SFHVURJKSA-N 0 3 406.530 4.486 20 0 HIADHN Cc1nc2c(s1)[C@@H]([NH2+]Cc1nnc(-c3ccc(Br)cc3)[n-]1)CCC2 ZINC000540222064 939138130 /nfs/dbraw/zinc/13/81/30/939138130.db2.gz ZKGQQNOHECPZSR-ZDUSSCGKSA-N 0 3 404.337 4.166 20 0 HIADHN Cc1ccccc1NC(=O)C[C@@H](C)N[C@H]1CC(=O)N(c2cccc(C(F)(F)F)c2)C1 ZINC000540223639 939138674 /nfs/dbraw/zinc/13/86/74/939138674.db2.gz ONHPKFRWTOQVDW-WBVHZDCISA-N 0 3 419.447 4.126 20 0 HIADHN C[C@@H]1CCCN(S(=O)(=O)c2ccc(CN[C@@H]3CCCNc4ccccc43)cc2)C1 ZINC000563647934 945232595 /nfs/dbraw/zinc/23/25/95/945232595.db2.gz CBZPJZSYRBTPJB-WZONZLPQSA-N 0 3 413.587 4.144 20 0 HIADHN Cc1nc2ccc(Br)cc2c(NCc2nccn2CC(F)(F)F)c1C ZINC000540297602 939185621 /nfs/dbraw/zinc/18/56/21/939185621.db2.gz BKZYHZAQZJKIMS-UHFFFAOYSA-N 0 3 413.241 4.407 20 0 HIADHN CCN1CC[C@H](N[C@@H]2CC(=O)N(C)c3ccccc32)[C@H]1c1ccc(Cl)c(F)c1 ZINC000540297425 939185912 /nfs/dbraw/zinc/18/59/12/939185912.db2.gz LCUAOCQPGXGGGG-NNMXDRDESA-N 0 3 401.913 4.312 20 0 HIADHN O=C1CCCN1C[C@H](NCCOc1cccc(F)c1)c1cccc(C(F)(F)F)c1 ZINC000540319229 939192677 /nfs/dbraw/zinc/19/26/77/939192677.db2.gz MVGFCGTZJWDUCH-IBGZPJMESA-N 0 3 410.411 4.177 20 0 HIADHN Cc1ccsc1[C@@H](Cc1ccccc1)N[C@H](C)c1cccc(S(N)(=O)=O)c1 ZINC000540320480 939193414 /nfs/dbraw/zinc/19/34/14/939193414.db2.gz LLKRUHOWNNLMLE-OXQOHEQNSA-N 0 3 400.569 4.339 20 0 HIADHN CC(C)[C@@H](NCC(=O)N(C)[C@@H](C)c1ccc(F)c(F)c1)c1ccc2c(c1)OCCO2 ZINC000540341724 939200381 /nfs/dbraw/zinc/20/03/81/939200381.db2.gz RWKSACNVLHCZDZ-NPMXOYFQSA-N 0 3 418.484 4.242 20 0 HIADHN CCOc1ccc([C@H]2CCCN2C(=O)CN[C@H](C)c2ccccc2-n2cccn2)cc1 ZINC000540359288 939208127 /nfs/dbraw/zinc/20/81/27/939208127.db2.gz HSPMEFFPJOWGII-AUSIDOKSSA-N 0 3 418.541 4.285 20 0 HIADHN Cc1cccn2c(=O)cc(CN[C@H](c3ccc(Br)cc3)C3CCC3)nc12 ZINC000540377044 939217217 /nfs/dbraw/zinc/21/72/17/939217217.db2.gz SSRRIWZTWHZITO-FQEVSTJZSA-N 0 3 412.331 4.396 20 0 HIADHN C[C@@H](NCC(=O)NC(=O)NCC(F)(F)F)c1ccccc1-c1ccc(Cl)cc1 ZINC000540386813 939223148 /nfs/dbraw/zinc/22/31/48/939223148.db2.gz VLXFMDMHXYDOCC-GFCCVEGCSA-N 0 3 413.827 4.046 20 0 HIADHN C[C@H](C1CC1)N(Cc1ccccc1)C(=O)CN[C@@H](C)c1cccc(-n2cccn2)c1 ZINC000540388883 939225330 /nfs/dbraw/zinc/22/53/30/939225330.db2.gz ZBNMLGPBBSZDSZ-VQTJNVASSA-N 0 3 402.542 4.350 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)N(C)C1CCCCC1)c1ccc(NC(=O)c2ccncc2)cc1 ZINC000540388911 939225858 /nfs/dbraw/zinc/22/58/58/939225858.db2.gz ZQLGINAOGRETBW-MSOLQXFVSA-N 0 3 408.546 4.164 20 0 HIADHN C[C@@H](NCC(=O)N(Cc1ccccc1)[C@H](C)C1CC1)c1cccc(-n2cccn2)c1 ZINC000540388885 939225887 /nfs/dbraw/zinc/22/58/87/939225887.db2.gz ZBNMLGPBBSZDSZ-WOJBJXKFSA-N 0 3 402.542 4.350 20 0 HIADHN CC(C)[C@@H](NCCC(=O)Nc1ccc(C(N)=O)c(Cl)c1)c1ccccc1Cl ZINC000540389595 939226750 /nfs/dbraw/zinc/22/67/50/939226750.db2.gz POFZIMIZXKSXNT-LJQANCHMSA-N 0 3 408.329 4.408 20 0 HIADHN O=C(CN[C@H](c1ccccc1)[C@@H]1CCOC1)NCC1(c2ccc(F)cc2)CCCC1 ZINC000540389660 939227637 /nfs/dbraw/zinc/22/76/37/939227637.db2.gz GQYNZTHHXNUGMZ-HYBUGGRVSA-N 0 3 410.533 4.121 20 0 HIADHN Cc1cc(C)cc([C@@H](C)NCC(=O)N2c3ccccc3NC(=O)C[C@@H]2C(F)(F)F)c1 ZINC000540410425 939238726 /nfs/dbraw/zinc/23/87/26/939238726.db2.gz XZMXJFFGWUPFGI-DNVCBOLYSA-N 0 3 419.447 4.260 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(-n2ccnn2)cc1)C(=O)Nc1cc(Cl)ccc1Cl ZINC000540429489 939245472 /nfs/dbraw/zinc/24/54/72/939245472.db2.gz IXERQSRVTFMZIM-QWHCGFSZSA-N 0 3 404.301 4.252 20 0 HIADHN C[C@H](NCC(=O)Nc1ccc2c(c1)OC1(CCCC1)O2)c1ccc(-n2cccn2)cc1 ZINC000540435638 939248043 /nfs/dbraw/zinc/24/80/43/939248043.db2.gz OOAVWIQDPJHYET-KRWDZBQOSA-N 0 3 418.497 4.203 20 0 HIADHN Cc1cc(N2CCCC2)ccc1NC(=O)CN[C@H](C)c1ccc(-n2cccn2)cc1 ZINC000540440164 939250317 /nfs/dbraw/zinc/25/03/17/939250317.db2.gz QFMXVEGTONKICK-LJQANCHMSA-N 0 3 403.530 4.070 20 0 HIADHN COc1cc(C(C)=O)ccc1OC[C@@H](O)CN[C@H](C)c1ccccc1C(F)(F)F ZINC000540443032 939251764 /nfs/dbraw/zinc/25/17/64/939251764.db2.gz GPWYFIAQUMSKNV-CJNGLKHVSA-N 0 3 411.420 4.007 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)NCC(=O)Nc2cccc(C(F)(F)F)c2)cc1 ZINC000540467556 939264712 /nfs/dbraw/zinc/26/47/12/939264712.db2.gz BEGJODUTTPFEGR-AWEZNQCLSA-N 0 3 402.420 4.489 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@@H]1CCO[C@H]1c1ccc(F)c(F)c1)c1ccsc1 ZINC000540494026 939274023 /nfs/dbraw/zinc/27/40/23/939274023.db2.gz RIQXVGJGZUPCET-AQNXPRMDSA-N 0 3 423.529 4.239 20 0 HIADHN Cn1cc(CN2CCC([C@@H]3C(=O)Nc4cc(Cl)ccc43)CC2)c(C(C)(C)C)n1 ZINC000540496087 939275765 /nfs/dbraw/zinc/27/57/65/939275765.db2.gz LFIWGEYVHAJMDZ-IBGZPJMESA-N 0 3 400.954 4.319 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(CCCc4ccccc4Cl)n3)cn2)CC1 ZINC000563659029 945241591 /nfs/dbraw/zinc/24/15/91/945241591.db2.gz XKIPGZGXVSTALD-UHFFFAOYSA-N 0 3 411.937 4.102 20 0 HIADHN CCOC(=O)c1nn(-c2ccccc2)cc1CNC[C@H]1CCCO[C@@H]1c1ccccc1 ZINC000540570595 939308075 /nfs/dbraw/zinc/30/80/75/939308075.db2.gz FAZNXIFLXJFFNP-HYBUGGRVSA-N 0 3 419.525 4.307 20 0 HIADHN Cc1ccc([C@@H](NC(=O)CN[C@H](c2ccc3c(c2)OCCO3)C2CC2)C2CC2)cc1 ZINC000540588776 939312565 /nfs/dbraw/zinc/31/25/65/939312565.db2.gz GDELYJFYZYENOH-LOSJGSFVSA-N 0 3 406.526 4.074 20 0 HIADHN CCN(C(=O)CN[C@@H](c1ccc2c(c1)OCCO2)C1CC1)[C@H](C)c1ccc(F)cc1 ZINC000540590240 939312988 /nfs/dbraw/zinc/31/29/88/939312988.db2.gz DFKKPWXGNXNSOU-VOIUYBSRSA-N 0 3 412.505 4.247 20 0 HIADHN COc1cccc2cc([C@H](C)NC[C@@H](O)COc3ccccc3Br)oc21 ZINC000540605121 939317489 /nfs/dbraw/zinc/31/74/89/939317489.db2.gz CJQVHQRTQAVAGY-DZGCQCFKSA-N 0 3 420.303 4.294 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@@H](C)NCc2c(C)nn(C(C)(C)C)c2C)CC1 ZINC000540609559 939318505 /nfs/dbraw/zinc/31/85/05/939318505.db2.gz UXBFKNYMDLUMLJ-QGZVFWFLSA-N 0 3 415.601 4.387 20 0 HIADHN Cc1cc(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2)nn1-c1cccc(F)c1 ZINC000540690176 939339886 /nfs/dbraw/zinc/33/98/86/939339886.db2.gz QTISBUNFTAQZCY-UHFFFAOYSA-N 0 3 413.472 4.055 20 0 HIADHN CCN1CCN(c2ccc(N[C@@H](C)c3sc(CCOC)nc3C)c(C)c2)CC1 ZINC000540707750 939345020 /nfs/dbraw/zinc/34/50/20/939345020.db2.gz NGANAPTWDBYUQB-KRWDZBQOSA-N 0 3 402.608 4.264 20 0 HIADHN Cc1cc(C(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)nn1-c1ccc(F)cc1 ZINC000540719587 939348251 /nfs/dbraw/zinc/34/82/51/939348251.db2.gz HWDAOCKEZGIISM-LJQANCHMSA-N 0 3 406.505 4.056 20 0 HIADHN C[C@H](CC(=O)N(C)Cc1ccccc1Cl)NC1(c2ccc3c(c2)OCO3)CC1 ZINC000540749167 939357806 /nfs/dbraw/zinc/35/78/06/939357806.db2.gz FDXBRHSJXGKSCK-OAHLLOKOSA-N 0 3 400.906 4.085 20 0 HIADHN C[C@@H]1CN(Cc2ccccn2)CC[C@H]1Nc1cnn(-c2ncc(Cl)cc2Cl)c1 ZINC000540825356 939385608 /nfs/dbraw/zinc/38/56/08/939385608.db2.gz XPLDUAGTPLNZNY-AUUYWEPGSA-N 0 3 417.344 4.292 20 0 HIADHN CCc1ccc([C@H](NC(=O)CN2CCC[C@H]2C2CCOCC2)c2cccs2)cc1 ZINC000540826673 939386082 /nfs/dbraw/zinc/38/60/82/939386082.db2.gz BIJCORKBMMPOGJ-URXFXBBRSA-N 0 3 412.599 4.407 20 0 HIADHN COc1cccc([C@@H]2[C@H](Nc3cc(C)nc(-c4ccccn4)n3)CCN2C2CC2)c1 ZINC000540872465 939405493 /nfs/dbraw/zinc/40/54/93/939405493.db2.gz VMLUFSREDBWZIU-NFBKMPQASA-N 0 3 401.514 4.246 20 0 HIADHN C[C@@H](N[C@@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O)c1ccc(-n2ccnn2)cc1 ZINC000540889784 939411136 /nfs/dbraw/zinc/41/11/36/939411136.db2.gz WQLZDFWEEUOZMM-BFUOFWGJSA-N 0 3 416.312 4.030 20 0 HIADHN O[C@H](COc1ccc2ccccc2c1)CN1CCC2(CC1)OCCc1ccsc12 ZINC000540911985 939416102 /nfs/dbraw/zinc/41/61/02/939416102.db2.gz TYNATZVDVGANDS-NRFANRHFSA-N 0 3 409.551 4.205 20 0 HIADHN CS(=O)(=O)[C@@H]1CCC[C@H](NCc2ccc(-c3cccc(C(F)(F)F)c3)o2)C1 ZINC000540979874 939424148 /nfs/dbraw/zinc/42/41/48/939424148.db2.gz SBGAJLWEUGPBRF-DOTOQJQBSA-N 0 3 401.450 4.411 20 0 HIADHN CSC[C@@H](NC[C@@H](O)COc1ccc(F)cc1)c1ccc(C(F)(F)F)cc1 ZINC000540987882 939425819 /nfs/dbraw/zinc/42/58/19/939425819.db2.gz BJXSGOGJAIRMGB-SJLPKXTDSA-N 0 3 403.441 4.278 20 0 HIADHN CC(C)[C@H](NCc1ccc(S(=O)(=O)N(C)C(C)C)cc1)c1ccc(F)c(F)c1 ZINC000540989627 939426223 /nfs/dbraw/zinc/42/62/23/939426223.db2.gz ZGGYENAHDWNNAQ-NRFANRHFSA-N 0 3 410.530 4.481 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)NC2CCC(c3ccc(F)cc3)CC2)CC1 ZINC000541000322 939428714 /nfs/dbraw/zinc/42/87/14/939428714.db2.gz XNMYSSVYUSSNQB-UHFFFAOYSA-N 0 3 405.558 4.041 20 0 HIADHN CC(C)N(CCN(C)C)C(=O)Nc1ccc(Cl)c(C(=O)NCc2cccs2)c1 ZINC000541044513 939440346 /nfs/dbraw/zinc/44/03/46/939440346.db2.gz TXYGMUNQUJRALZ-UHFFFAOYSA-N 0 3 422.982 4.135 20 0 HIADHN COc1ccc2c(c1)[C@H](N(CCC(=O)N1CCCCC1)Cc1ccccc1)CCO2 ZINC000541057304 939444619 /nfs/dbraw/zinc/44/46/19/939444619.db2.gz XZXRCEALPLLIAX-HSZRJFAPSA-N 0 3 408.542 4.424 20 0 HIADHN COc1cc(C(C)=O)ccc1OC[C@H](O)CN[C@@H](c1ccc(Cl)cc1F)C(C)C ZINC000541059414 939444809 /nfs/dbraw/zinc/44/48/09/939444809.db2.gz IVHZBZLUJWLDPW-VGOFRKELSA-N 0 3 423.912 4.417 20 0 HIADHN CCN1CC[C@H](NCc2ccc(Br)cn2)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000541065671 939447330 /nfs/dbraw/zinc/44/73/30/939447330.db2.gz VSJYHEPIDZHVPL-FUHWJXTLSA-N 0 3 414.269 4.187 20 0 HIADHN CCN(CC)C(=O)CCC1CCN([C@@H](C)C(=O)N[C@@H](C)c2ccc(Cl)cc2)CC1 ZINC000541119048 939466778 /nfs/dbraw/zinc/46/67/78/939466778.db2.gz AYVAZCZASDQQOX-ROUUACIJSA-N 0 3 422.013 4.266 20 0 HIADHN CC(C)c1ccccc1OC[C@H](O)CN1CCC[C@@H](n2ccc(C(F)(F)F)n2)C1 ZINC000541127753 939470308 /nfs/dbraw/zinc/47/03/08/939470308.db2.gz OURGMEGMURQWPT-IAGOWNOFSA-N 0 3 411.468 4.102 20 0 HIADHN CC(=O)Nc1ccc(OC[C@H](O)CN2CCCCC[C@H]2/C=C\c2cccs2)cc1 ZINC000541201029 939485329 /nfs/dbraw/zinc/48/53/29/939485329.db2.gz IJFHPMJZIPSEDR-JOUZLBOKSA-N 0 3 414.571 4.404 20 0 HIADHN Cc1cc(F)ccc1-n1ccc(C(=O)NC[C@H]2CCCN(C)[C@@H]2c2cccs2)n1 ZINC000541207059 939485609 /nfs/dbraw/zinc/48/56/09/939485609.db2.gz GZSAQNBVMIMXMT-IERDGZPVSA-N 0 3 412.534 4.194 20 0 HIADHN Cc1cc(F)ccc1-n1ccc(C(=O)NC[C@H]2CCCN(C)[C@H]2c2cccs2)n1 ZINC000541207060 939485634 /nfs/dbraw/zinc/48/56/34/939485634.db2.gz GZSAQNBVMIMXMT-IIBYNOLFSA-N 0 3 412.534 4.194 20 0 HIADHN CC(C)n1ccc(C[C@H](C)N[C@H](CN2CCCC2=O)c2cccc(C(F)(F)F)c2)n1 ZINC000541212487 939485887 /nfs/dbraw/zinc/48/58/87/939485887.db2.gz JIISKZLXAWCNLR-OXJNMPFZSA-N 0 3 422.495 4.367 20 0 HIADHN CCC[C@H](N[C@H]1CCCN(Cc2nccn2C)C1=O)c1ccc(Cl)c(Cl)c1 ZINC000541228305 939486599 /nfs/dbraw/zinc/48/65/99/939486599.db2.gz IKENGHWGSVSFQI-ROUUACIJSA-N 0 3 409.361 4.349 20 0 HIADHN O=C1[C@@H](NCc2ccc(Oc3cc(F)cc(F)c3)cc2)CCCN1Cc1ccccn1 ZINC000541381116 939501918 /nfs/dbraw/zinc/50/19/18/939501918.db2.gz KMKAMRCFHMIAQQ-QHCPKHFHSA-N 0 3 423.463 4.433 20 0 HIADHN CN1CC[C@H](NC(=O)[C@@H]2CCn3c(cnc3C3CCCCC3)C2)[C@H]1c1ccccc1 ZINC000541454466 939521029 /nfs/dbraw/zinc/52/10/29/939521029.db2.gz NBBOZEODVXITAT-AKIFATBCSA-N 0 3 406.574 4.055 20 0 HIADHN C[C@H](CN(C)C(=O)Nc1ccc(CCN2CCSCC2)cc1)c1nccs1 ZINC000541476908 939531312 /nfs/dbraw/zinc/53/13/12/939531312.db2.gz UWXMIQLUKSFXNN-MRXNPFEDSA-N 0 3 404.605 4.002 20 0 HIADHN CC(C)[C@@H](CN[C@H](c1ccc(F)cc1)c1cnc2ccccc2c1)N1CCOCC1 ZINC000541549217 939551769 /nfs/dbraw/zinc/55/17/69/939551769.db2.gz QSZRJAYWMHIMKD-JWQCQUIFSA-N 0 3 407.533 4.410 20 0 HIADHN Cc1ccccc1[C@H](CN1CCOCC1)NCc1ccc(NC(=O)c2ccco2)cc1 ZINC000541552761 939553612 /nfs/dbraw/zinc/55/36/12/939553612.db2.gz SKLNJSTUXKILAA-QHCPKHFHSA-N 0 3 419.525 4.003 20 0 HIADHN O=C(NC1CCCCC1)N1CCC(N[C@H](c2ccccc2)c2ccc(F)cn2)CC1 ZINC000541564780 939556676 /nfs/dbraw/zinc/55/66/76/939556676.db2.gz BAOAUGAHRGBRBI-HSZRJFAPSA-N 0 3 410.537 4.406 20 0 HIADHN Cc1nc(-c2ccccc2)sc1[C@@H](C)N[C@@H]1CCCN(Cc2ccccn2)C1=O ZINC000541568510 939557151 /nfs/dbraw/zinc/55/71/51/939557151.db2.gz UGSZWYLQPCUEHY-OXQOHEQNSA-N 0 3 406.555 4.355 20 0 HIADHN Cc1ccsc1[C@H](Cc1ccccc1)N[C@H](C)C(=O)N1CC(=O)Nc2ccccc21 ZINC000541593710 939562162 /nfs/dbraw/zinc/56/21/62/939562162.db2.gz XIJNSBWWHOXQTR-XLIONFOSSA-N 0 3 419.550 4.304 20 0 HIADHN CC(C)C[C@@H](NCC(=O)N1CCC(C(=O)N2CCCCCC2)CC1)c1cccs1 ZINC000541625922 939574375 /nfs/dbraw/zinc/57/43/75/939574375.db2.gz ACPQEDSVNJRIRT-HXUWFJFHSA-N 0 3 419.635 4.066 20 0 HIADHN CC[C@H](NCC(=O)N(Cc1ccccc1)c1nc2c(s1)CCCC2)[C@@H]1CCCO1 ZINC000541637391 939579543 /nfs/dbraw/zinc/57/95/43/939579543.db2.gz POJOBKIKFGQCFU-ICSRJNTNSA-N 0 3 413.587 4.102 20 0 HIADHN CN(CC(=O)NCCCSc1ccccc1)[C@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000541700824 939608540 /nfs/dbraw/zinc/60/85/40/939608540.db2.gz DJQBZMXRLJMSGS-UNMCSNQZSA-N 0 3 416.562 4.276 20 0 HIADHN C[C@@H](NCc1ccccc1CS(C)(=O)=O)c1ccc(OCC(F)(F)F)cc1 ZINC000563704293 945260112 /nfs/dbraw/zinc/26/01/12/945260112.db2.gz XSPZNCOXOVPRLX-CQSZACIVSA-N 0 3 401.450 4.023 20 0 HIADHN CC(C)NS(=O)(=O)Cc1ccccc1CN[C@@H]1CCCc2c(Cl)cccc21 ZINC000541741010 939618608 /nfs/dbraw/zinc/61/86/08/939618608.db2.gz DYCRCCUCKUBUQZ-OAQYLSRUSA-N 0 3 406.979 4.335 20 0 HIADHN Cc1ccccc1C1=CCN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)C1 ZINC000541781201 939628257 /nfs/dbraw/zinc/62/82/57/939628257.db2.gz QJWNSXOZCBAITH-UHFFFAOYSA-N 0 3 418.585 4.006 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](N[C@@H](CCO)c2ccccc2Br)C1 ZINC000541916791 939653379 /nfs/dbraw/zinc/65/33/79/939653379.db2.gz OMWYGPAUEZXAHM-BLIXFSHQSA-N 0 3 403.364 4.298 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)NCC(=O)N(C)[C@H](C)c2ccc(F)c(F)c2)cc1 ZINC000541956157 939662367 /nfs/dbraw/zinc/66/23/67/939662367.db2.gz SFQHHHRTDGGYGH-JKSUJKDBSA-N 0 3 412.484 4.329 20 0 HIADHN CCN1CC[C@H](NCc2cnn(Cc3ccccc3)c2)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000541993905 939672811 /nfs/dbraw/zinc/67/28/11/939672811.db2.gz GECVVDCVZHPOEB-GMAHTHKFSA-N 0 3 414.475 4.274 20 0 HIADHN COc1c(NC(=O)C(Cc2c(C)cc(C)cc2C)C(F)(F)F)cccc1C(N)=O ZINC000542018894 939688286 /nfs/dbraw/zinc/68/82/86/939688286.db2.gz GUCFTZNKJLNMNO-MRXNPFEDSA-N 0 3 408.420 4.079 20 0 HIADHN CC(C)n1ccc(C[C@@H](C)N[C@H](c2ccccc2)c2cccc(S(C)(=O)=O)c2)n1 ZINC000542137180 939726891 /nfs/dbraw/zinc/72/68/91/939726891.db2.gz YYDMXGJDKLECBP-WZONZLPQSA-N 0 3 411.571 4.178 20 0 HIADHN CC(C)OC(=O)C1(C(=O)OC(C)C)CC(N[C@@H]2c3cccc(F)c3CC[C@H]2C)C1 ZINC000542165101 939740275 /nfs/dbraw/zinc/74/02/75/939740275.db2.gz VKSIGFPVUBALKN-QRWLVFNGSA-N 0 3 405.510 4.091 20 0 HIADHN CC(C)c1ccccc1NC(=O)C[C@H](C)NCc1ccnc(OC2CCOCC2)c1 ZINC000542179735 939746800 /nfs/dbraw/zinc/74/68/00/939746800.db2.gz SLHRZKLVGLTGJG-SFHVURJKSA-N 0 3 411.546 4.270 20 0 HIADHN C[C@]1(NCC(=O)Nc2cc(C(F)(F)F)cc(C(F)(F)F)c2)CCO[C@@H]1C1CC1 ZINC000542309034 939794241 /nfs/dbraw/zinc/79/42/41/939794241.db2.gz DNXLOMTWLJQVLW-CVEARBPZSA-N 0 3 410.358 4.210 20 0 HIADHN C[C@]1(NCC(=O)N2N=C(c3cccs3)C[C@H]2c2cccs2)CCO[C@H]1C1CC1 ZINC000542315622 939798212 /nfs/dbraw/zinc/79/82/12/939798212.db2.gz TUBZFQWEPQGVST-NDXORKPFSA-N 0 3 415.584 4.035 20 0 HIADHN COc1ccc([C@H]2CCCN2C(=O)CN2CC[C@@H](c3cccc(C)c3)C2)cc1OC ZINC000542318939 939798492 /nfs/dbraw/zinc/79/84/92/939798492.db2.gz BRAJJHDWFNAWPZ-FGZHOGPDSA-N 0 3 408.542 4.165 20 0 HIADHN COC(=O)[C@@H](NC(=O)c1cccc(CN2CCCC2)c1)c1ccc(Cl)cc1Cl ZINC000542375605 939809997 /nfs/dbraw/zinc/80/99/97/939809997.db2.gz XODHBBJVCDFWND-IBGZPJMESA-N 0 3 421.324 4.233 20 0 HIADHN COc1cc(NC(C)=O)ccc1[C@H](C)NCCOc1ccc(Br)cc1 ZINC000563737716 945274543 /nfs/dbraw/zinc/27/45/43/945274543.db2.gz FTLWHLLJOZOWGJ-ZDUSSCGKSA-N 0 3 407.308 4.146 20 0 HIADHN COc1ccc(C2(CNC(=O)N(Cc3ccco3)C3CCN(C)CC3)CCC2)cc1 ZINC000542447683 939824815 /nfs/dbraw/zinc/82/48/15/939824815.db2.gz ZHSROKGJKFWQAB-UHFFFAOYSA-N 0 3 411.546 4.016 20 0 HIADHN O=S(=O)(c1ccccc1)N1CCC(CN[C@@H](c2ccco2)c2ccccc2)CC1 ZINC000542494100 939832694 /nfs/dbraw/zinc/83/26/94/939832694.db2.gz KOLLOIGQZKGLSX-HSZRJFAPSA-N 0 3 410.539 4.060 20 0 HIADHN Cc1ccccc1[C@H](CN1CCOCC1)Nc1cccc(CN2CCSCC2)c1 ZINC000542497934 939832867 /nfs/dbraw/zinc/83/28/67/939832867.db2.gz DCRJGSFJTRQZEY-DEOSSOPVSA-N 0 3 411.615 4.029 20 0 HIADHN O=C1[C@@H](N[C@H]2CCCc3ccc(Br)cc32)CCCN1Cc1ccccn1 ZINC000542499406 939833109 /nfs/dbraw/zinc/83/31/09/939833109.db2.gz PUFARURUSFSGDH-PMACEKPBSA-N 0 3 414.347 4.002 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)CN[C@H](c2cccs2)C2CC2)cc1OC ZINC000542510782 939834905 /nfs/dbraw/zinc/83/49/05/939834905.db2.gz NKEWHDRWDANONV-JTSKRJEESA-N 0 3 400.544 4.170 20 0 HIADHN Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)NC[C@H](O)COc1ccc2ccccc2c1 ZINC000542531950 939838585 /nfs/dbraw/zinc/83/85/85/939838585.db2.gz MMRPIQMVSVEFKP-KUHUBIRLSA-N 0 3 421.463 4.306 20 0 HIADHN CC(C)[C@@H](Cc1ccc(F)cc1)NCc1coc(-c2ccc(S(C)(=O)=O)cc2)n1 ZINC000542550101 939842329 /nfs/dbraw/zinc/84/23/29/939842329.db2.gz OZCINIIURHXAOB-OAQYLSRUSA-N 0 3 416.518 4.241 20 0 HIADHN C[C@H](N[C@@H](C)[C@H]1COc2ccccc21)C(=O)Nc1nc(-c2ccc(F)cc2)cs1 ZINC000542618074 939849157 /nfs/dbraw/zinc/84/91/57/939849157.db2.gz BDZINHSCKQNKQD-SUNYJGFJSA-N 0 3 411.502 4.431 20 0 HIADHN CN(CC(=O)N1CCC(Cc2ccccc2)CC1)[C@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000542627709 939850122 /nfs/dbraw/zinc/85/01/22/939850122.db2.gz LQVWYPAZGHXDOV-DQEYMECFSA-N 0 3 424.560 4.459 20 0 HIADHN CN(Cc1c(F)cccc1Cl)C(=O)CN(C)[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000542629047 939850284 /nfs/dbraw/zinc/85/02/84/939850284.db2.gz WUKMAXOJQDDMBP-DYESRHJHSA-N 0 3 422.903 4.429 20 0 HIADHN C[C@@H]1N(CC(=O)NCc2ccc(-c3ccc(Cl)cc3)o2)CCC12CCOCC2 ZINC000542647769 939851525 /nfs/dbraw/zinc/85/15/25/939851525.db2.gz CQNKCMRSQNAGNC-INIZCTEOSA-N 0 3 402.922 4.107 20 0 HIADHN Clc1cccc(N2CCN(CCCN[C@H](c3ccccc3)c3cncnc3)CC2)c1 ZINC000542666990 939852754 /nfs/dbraw/zinc/85/27/54/939852754.db2.gz URMFPXQQUBEIID-XMMPIXPASA-N 0 3 421.976 4.021 20 0 HIADHN C[C@@H]1C[C@H](c2cccnc2)N(C(=O)Nc2ccc(CCN3CCSCC3)cc2)C1 ZINC000542669490 939852885 /nfs/dbraw/zinc/85/28/85/939852885.db2.gz JIMBOAKBAQCQEW-XMSQKQJNSA-N 0 3 410.587 4.288 20 0 HIADHN COc1ccc([C@H](Cc2ccc(F)cc2)NCc2ccc3c(c2)C(=O)NCC3)cc1 ZINC000542683279 939853961 /nfs/dbraw/zinc/85/39/61/939853961.db2.gz NSWWLZRTDJFQRG-DEOSSOPVSA-N 0 3 404.485 4.194 20 0 HIADHN Cc1ccc([C@@H](NC[C@H](C)c2nccs2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000542696844 939854937 /nfs/dbraw/zinc/85/49/37/939854937.db2.gz DHVXJDCDBRZLPH-OXJNMPFZSA-N 0 3 400.569 4.338 20 0 HIADHN O=C(Nc1cccc(C(F)F)c1Cl)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1CO ZINC000542721582 939856731 /nfs/dbraw/zinc/85/67/31/939856731.db2.gz IAQGPTSZURQVLZ-NVXWUHKLSA-N 0 3 423.891 4.282 20 0 HIADHN C[C@H]1N(C(=O)N[C@H](CN2CCc3ccccc3C2)C(C)(C)C)CCC12CCOCC2 ZINC000542744464 939858615 /nfs/dbraw/zinc/85/86/15/939858615.db2.gz DGUYCPMLLJUIEW-DENIHFKCSA-N 0 3 413.606 4.060 20 0 HIADHN CC(C)c1nn(-c2ccc(Br)cc2)cc1CN1CCC[C@H]([C@H](C)O)C1 ZINC000542820557 939861352 /nfs/dbraw/zinc/86/13/52/939861352.db2.gz RZVKMAYLRIBEOT-HOTGVXAUSA-N 0 3 406.368 4.351 20 0 HIADHN COc1cc(-c2ccccc2)ccc1CN1CCC(C(=O)NCC(F)(F)F)CC1 ZINC000542830788 939861672 /nfs/dbraw/zinc/86/16/72/939861672.db2.gz QGILUCUUHRWSHU-UHFFFAOYSA-N 0 3 406.448 4.253 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1cn(-c2ccccc2)nc1C)c1cccc(OC)c1 ZINC000542836395 939862012 /nfs/dbraw/zinc/86/20/12/939862012.db2.gz GYOLZTMAQOGHOX-HSZRJFAPSA-N 0 3 421.545 4.394 20 0 HIADHN COC(=O)c1cccc(NC(=O)C[C@@H](C)N[C@H](C)c2ccccc2OC(F)F)c1 ZINC000543066738 939919803 /nfs/dbraw/zinc/91/98/03/939919803.db2.gz MEIWUIVOBXYIGA-ZIAGYGMSSA-N 0 3 406.429 4.143 20 0 HIADHN C[C@@H](CN(C)C(=O)NC[C@H](c1cccs1)N1CCC(C)CC1)c1nccs1 ZINC000543187516 939990401 /nfs/dbraw/zinc/99/04/01/939990401.db2.gz XIDHLIYZCDBXAW-DLBZAZTESA-N 0 3 406.621 4.423 20 0 HIADHN O=S1(=O)CCCC[C@H]1CNCc1ccc(-c2cccc(Br)c2)s1 ZINC000543237694 940003878 /nfs/dbraw/zinc/00/38/78/940003878.db2.gz DRTXOZDSAKFRAY-INIZCTEOSA-N 0 3 414.390 4.235 20 0 HIADHN O=C1[C@H](NCc2cccc(OCc3ccc(F)cc3)c2)CCCN1Cc1ccccn1 ZINC000543244545 940006592 /nfs/dbraw/zinc/00/65/92/940006592.db2.gz VLYFYVWKHSFQNH-XMMPIXPASA-N 0 3 419.500 4.081 20 0 HIADHN COc1ccc(OC)c([C@H]2CCCN2C(=O)CN2CC[C@H](c3ccc(C)cc3)C2)c1 ZINC000543247155 940007452 /nfs/dbraw/zinc/00/74/52/940007452.db2.gz UQKNONLJBLXZOK-NZQKXSOJSA-N 0 3 408.542 4.165 20 0 HIADHN Cc1ccccc1[C@@H](OC[C@H](O)CN(C)CCc1ccccc1O)c1ccccc1 ZINC000543254501 940009373 /nfs/dbraw/zinc/00/93/73/940009373.db2.gz ZHOHEFMTLMIJHR-BVAGGSTKSA-N 0 3 405.538 4.342 20 0 HIADHN Cc1ccccc1[C@@H](OC[C@@H](O)CN(C)CCc1ccccc1O)c1ccccc1 ZINC000543254503 940009618 /nfs/dbraw/zinc/00/96/18/940009618.db2.gz ZHOHEFMTLMIJHR-OZXSUGGESA-N 0 3 405.538 4.342 20 0 HIADHN CN(C)[C@@H](CNC(=O)c1ncoc1-c1cccc(C(F)(F)F)c1)Cc1ccccc1 ZINC000543261647 940011776 /nfs/dbraw/zinc/01/17/76/940011776.db2.gz GVLUUYALOTXZSH-GOSISDBHSA-N 0 3 417.431 4.263 20 0 HIADHN CN1CC[C@@H](NC(=O)CCc2cc(F)ccc2Br)[C@@H]1c1ccccc1 ZINC000543313159 940025895 /nfs/dbraw/zinc/02/58/95/940025895.db2.gz YZGWEGYBLUBLHK-QUCCMNQESA-N 0 3 405.311 4.082 20 0 HIADHN CN1CC[C@@H](NC(=O)CCc2cc(F)ccc2Br)[C@H]1c1ccccc1 ZINC000543313160 940026170 /nfs/dbraw/zinc/02/61/70/940026170.db2.gz YZGWEGYBLUBLHK-UYAOXDASSA-N 0 3 405.311 4.082 20 0 HIADHN COc1ccc(CCC(=O)N2CCCN(Cc3cc(C)c4ncccc4c3)CC2)cc1 ZINC000543397101 940050784 /nfs/dbraw/zinc/05/07/84/940050784.db2.gz YTDISKYHQSIFBN-UHFFFAOYSA-N 0 3 417.553 4.219 20 0 HIADHN FC(F)(F)c1cc(Cl)c2nnc(CN[C@H]3CCCN(Cc4ccccc4)C3)n2c1 ZINC000543399597 940051793 /nfs/dbraw/zinc/05/17/93/940051793.db2.gz RSFNPLGSOCIUCG-INIZCTEOSA-N 0 3 423.870 4.156 20 0 HIADHN COc1ccc(Oc2ccc(CNCc3ccc(CS(C)(=O)=O)cc3)cc2)cc1 ZINC000543415432 940057876 /nfs/dbraw/zinc/05/78/76/940057876.db2.gz VRFVPZMUOCGPLA-UHFFFAOYSA-N 0 3 411.523 4.322 20 0 HIADHN COCCN1CC[C@H](N[C@H](c2ccc(OC)cc2)c2ccc(C(F)(F)F)cc2)C1 ZINC000543414358 940057934 /nfs/dbraw/zinc/05/79/34/940057934.db2.gz SDZFSRKQUYHSLX-FPOVZHCZSA-N 0 3 408.464 4.114 20 0 HIADHN COc1ccc(Cl)c(N[C@H](CN2CCC(C(N)=O)CC2)c2ccc(Cl)cc2)c1 ZINC000543427130 940061213 /nfs/dbraw/zinc/06/12/13/940061213.db2.gz FMRCVPHLGCWTNV-HXUWFJFHSA-N 0 3 422.356 4.353 20 0 HIADHN COc1ccccc1COC1CCN(C[C@@H](O)COc2cc(C)ccc2Cl)CC1 ZINC000543439049 940064078 /nfs/dbraw/zinc/06/40/78/940064078.db2.gz PQEANFBYGSTPLH-LJQANCHMSA-N 0 3 419.949 4.078 20 0 HIADHN Cc1c([C@@H](C)NC[C@@H](O)COc2ccccc2Cl)cnn1-c1ccc(F)cc1 ZINC000543470265 940074649 /nfs/dbraw/zinc/07/46/49/940074649.db2.gz OXXLLZVKWDVXFT-RDTXWAMCSA-N 0 3 403.885 4.064 20 0 HIADHN COC[C@H](N[C@H](C)C(=O)N1N=C(c2ccc(Cl)cc2)C[C@H]1c1ccco1)C1CC1 ZINC000543477712 940077768 /nfs/dbraw/zinc/07/77/68/940077768.db2.gz FAFRZKHVCVYTQV-UAOJZALGSA-N 0 3 415.921 4.014 20 0 HIADHN COc1ccc(NC(C)=O)cc1NC(=O)[C@H](C)N[C@@H](CC(C)C)c1cccs1 ZINC000543486170 940080151 /nfs/dbraw/zinc/08/01/51/940080151.db2.gz SQACARAWHXXALS-KSSFIOAISA-N 0 3 403.548 4.419 20 0 HIADHN C[C@H](NCC(=O)Nc1ccc(Br)cc1F)[C@@H]1Oc2ccccc2[C@@H]1C ZINC000543545259 940102257 /nfs/dbraw/zinc/10/22/57/940102257.db2.gz SAKPFONVWCEGRH-SYTFOFBDSA-N 0 3 407.283 4.070 20 0 HIADHN C[C@H](c1ccc(F)c(F)c1)N(C)C(=O)CN(C)[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000543555728 940106876 /nfs/dbraw/zinc/10/68/76/940106876.db2.gz UUQGGOZEOCUISB-YIFZBPKDSA-N 0 3 420.475 4.475 20 0 HIADHN C[C@H](NCC(=O)N1CCc2sccc2[C@@H]1c1ccccc1)[C@@H]1COc2ccccc21 ZINC000543557436 940107917 /nfs/dbraw/zinc/10/79/17/940107917.db2.gz MGTYYQPXOPIPKF-ADSMNUKGSA-N 0 3 418.562 4.377 20 0 HIADHN C[C@H](N[C@@H]1CCN(c2cnn(C)c2)C1=O)c1ccc(-c2ccc(Cl)cc2F)s1 ZINC000543599896 940126559 /nfs/dbraw/zinc/12/65/59/940126559.db2.gz JUACIGQJWPJMQQ-YVEFUNNKSA-N 0 3 418.925 4.397 20 0 HIADHN Cc1nc(-c2ccc(CCN[C@H](C)CS(=O)(=O)c3ccc(C)cc3)s2)cs1 ZINC000543604239 940128452 /nfs/dbraw/zinc/12/84/52/940128452.db2.gz OCHVWSZUBVVJOL-OAHLLOKOSA-N 0 3 420.625 4.483 20 0 HIADHN Fc1ccc([C@@H]2C[C@H](NCc3cc4c(cc3Br)OCO4)CCO2)cc1 ZINC000543623408 940138898 /nfs/dbraw/zinc/13/88/98/940138898.db2.gz BMDKDFHDCIYBIO-WBVHZDCISA-N 0 3 408.267 4.327 20 0 HIADHN CC(C)(C)c1cc(NC(=O)N2CCN(C3CCCCC3)CC2)n(-c2ccccn2)n1 ZINC000543659611 940152586 /nfs/dbraw/zinc/15/25/86/940152586.db2.gz VYKLQTDROIZEOY-UHFFFAOYSA-N 0 3 410.566 4.047 20 0 HIADHN C[C@@H](Cc1ccccc1C(F)(F)F)NC(=O)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000543744037 940173951 /nfs/dbraw/zinc/17/39/51/940173951.db2.gz WOMXOZNXXHJLRG-LPHOPBHVSA-N 0 3 405.464 4.060 20 0 HIADHN CC(C)Cc1noc(-c2cc(Cl)ccc2NC(=O)N[C@@H](C)C2=CCN(C)CC2)n1 ZINC000543766649 940179598 /nfs/dbraw/zinc/17/95/98/940179598.db2.gz ZXIDDFWXTTULOT-AWEZNQCLSA-N 0 3 417.941 4.360 20 0 HIADHN CC(=O)Nc1ccc([C@H](C)N[C@H](Cc2ccccc2)C(=O)NCc2ccccc2)cc1 ZINC000543776988 940183478 /nfs/dbraw/zinc/18/34/78/940183478.db2.gz HZLMUGDXYBUYMT-UQBPGWFLSA-N 0 3 415.537 4.223 20 0 HIADHN COc1ccc2c(c1)C[C@@H](C)N(C(=O)CCCN1CCN(c3ccccc3)CC1)[C@@H]2C ZINC000543789188 940187082 /nfs/dbraw/zinc/18/70/82/940187082.db2.gz YYWWCAVFMJRUSR-NHCUHLMSSA-N 0 3 421.585 4.132 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)NCC(=O)NCCCSc2ccccc2)cc1 ZINC000543811129 940194363 /nfs/dbraw/zinc/19/43/63/940194363.db2.gz MYEFFXHHNKHVNG-SFHVURJKSA-N 0 3 408.571 4.130 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@@H](C)N[C@@H](C)c2ccc(-n3ccnc3C)cc2)cc1F ZINC000543813597 940194869 /nfs/dbraw/zinc/19/48/69/940194869.db2.gz ZLGGEAFQGPLGKW-DLBZAZTESA-N 0 3 424.520 4.026 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N[C@H](c1ccc(Cl)cc1F)C(C)C ZINC000543825948 940199647 /nfs/dbraw/zinc/19/96/47/940199647.db2.gz LEOBISISTKMWIG-FQEVSTJZSA-N 0 3 419.928 4.301 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)c2ccn(Cc3ccccc3)c2)cc1 ZINC000543849420 940207664 /nfs/dbraw/zinc/20/76/64/940207664.db2.gz AYXLMNNKCKQWKA-DEOSSOPVSA-N 0 3 403.526 4.112 20 0 HIADHN CN(C)C(=O)c1ccc(CN[C@H]2CCN(C(C)(C)C)[C@@H]2c2ccc(Cl)c(F)c2)[nH]1 ZINC000543850110 940208431 /nfs/dbraw/zinc/20/84/31/940208431.db2.gz IZGPFLQOLISEJQ-AZUAARDMSA-N 0 3 420.960 4.213 20 0 HIADHN C[C@@H](N[C@@H](Cc1ccc(C(F)(F)F)cc1)C(N)=O)c1ccc(OC(F)F)cc1 ZINC000544095790 940325343 /nfs/dbraw/zinc/32/53/43/940325343.db2.gz BVMDMBUPKMTDHD-BZNIZROVSA-N 0 3 402.363 4.054 20 0 HIADHN COc1cc(Br)ccc1CCCN(C)Cc1ccc([S@](C)=O)cc1 ZINC000544144992 940337230 /nfs/dbraw/zinc/33/72/30/940337230.db2.gz FTQCUQCNAFZWGE-DEOSSOPVSA-N 0 3 410.377 4.260 20 0 HIADHN O=C(Nc1nc(Cc2ccccc2)cs1)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000544237980 940364187 /nfs/dbraw/zinc/36/41/87/940364187.db2.gz SLNRSFBGEKAECK-UHFFFAOYSA-N 0 3 421.566 4.191 20 0 HIADHN Cc1cc(NC(=O)N2CCCN(CCCc3ccccc3)CC2)nn1[C@H](C)C1CC1 ZINC000544265914 940372919 /nfs/dbraw/zinc/37/29/19/940372919.db2.gz UXGPJWINOGGRSL-HXUWFJFHSA-N 0 3 409.578 4.335 20 0 HIADHN Cc1cc(N2CCC(N[C@@H](c3cccnc3)c3ccc(F)c(C)c3)CC2)nc(C)n1 ZINC000544358275 940399731 /nfs/dbraw/zinc/39/97/31/940399731.db2.gz NPIGHBJGOVPAAE-XMMPIXPASA-N 0 3 405.521 4.284 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)Cc1nc(-c2ccc(F)cc2)cs1 ZINC000544390943 940409895 /nfs/dbraw/zinc/40/98/95/940409895.db2.gz OVQPXFDRSKKGJC-UHFFFAOYSA-N 0 3 415.509 4.221 20 0 HIADHN O=C(CN[C@H](c1cccs1)C1CC1)Nc1ccccc1I ZINC000544397476 940411525 /nfs/dbraw/zinc/41/15/25/940411525.db2.gz JGNPSKMBAOGCRR-INIZCTEOSA-N 0 3 412.296 4.032 20 0 HIADHN COc1ccc(OC)c([C@H]2CCCN2C(=O)CN[C@H](c2cccs2)C2CC2)c1 ZINC000544399369 940412393 /nfs/dbraw/zinc/41/23/93/940412393.db2.gz BRCZNISJZYJUOB-GCJKJVERSA-N 0 3 400.544 4.170 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(-c4cc(F)cc(C(F)(F)F)c4)n3)cn2)CC1 ZINC000544406267 940414713 /nfs/dbraw/zinc/41/47/13/940414713.db2.gz OHAFMKMIVGZODI-UHFFFAOYSA-N 0 3 421.398 4.098 20 0 HIADHN Cn1c2ccccc2c(Cl)c1-c1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1 ZINC000544424942 940423299 /nfs/dbraw/zinc/42/32/99/940423299.db2.gz NLMJKTFEKMNQKP-UHFFFAOYSA-N 0 3 422.920 4.086 20 0 HIADHN CC(C)(C)[C@@H]1CCN(Cc2ccnc(-c3ccc(Br)cc3)n2)C[C@H]1O ZINC000544438948 940431429 /nfs/dbraw/zinc/43/14/29/940431429.db2.gz UADDFPFOVFGLGM-QZTJIDSGSA-N 0 3 404.352 4.135 20 0 HIADHN Cc1ccc(Cl)c(OC[C@@H](O)CN2CCC3(CC2)OCCc2ccsc23)c1 ZINC000544442050 940432627 /nfs/dbraw/zinc/43/26/27/940432627.db2.gz ATAHHDGOOVZNEI-KRWDZBQOSA-N 0 3 407.963 4.014 20 0 HIADHN CC[C@H](NC[C@@H](O)COc1ccc(Cl)cc1Br)c1c(C)noc1C ZINC000544458637 940439695 /nfs/dbraw/zinc/43/96/95/940439695.db2.gz QIHIWPCSCNTXHM-HIFRSBDPSA-N 0 3 417.731 4.188 20 0 HIADHN CCOc1ncccc1-c1noc([C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)n1 ZINC000544481174 940450818 /nfs/dbraw/zinc/45/08/18/940450818.db2.gz IOMAVGYAMHWFQK-FQEVSTJZSA-N 0 3 418.419 4.236 20 0 HIADHN O=C(c1cccc2nccnc21)N1CCN(Cc2ccccc2)C2(CCCCC2)C1 ZINC000544503282 940458518 /nfs/dbraw/zinc/45/85/18/940458518.db2.gz FLKCVJQTIMKBMH-UHFFFAOYSA-N 0 3 400.526 4.291 20 0 HIADHN C[C@H](Cc1c(F)cccc1F)NC(=O)CN(C)[C@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000544527553 940472273 /nfs/dbraw/zinc/47/22/73/940472273.db2.gz AGZGEDMVKVPBDZ-QRFQSNJMSA-N 0 3 420.475 4.003 20 0 HIADHN C[C@@H](NCC(=O)N(C)Cc1cnn(C)c1)c1ccc(-c2ccc(Cl)cc2)s1 ZINC000544531607 940473232 /nfs/dbraw/zinc/47/32/32/940473232.db2.gz WUZXOBZOJLHFAL-CQSZACIVSA-N 0 3 402.951 4.111 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@H]2CCCC[C@@H]2NCc2cccc(Cn3ccnc3)c2)cc1 ZINC000544579228 940483739 /nfs/dbraw/zinc/48/37/39/940483739.db2.gz NRPQKPRVAYHJGT-ZEQRLZLVSA-N 0 3 423.582 4.115 20 0 HIADHN CS[C@H]1CN(C(=O)c2c(C)onc2-c2c(F)cccc2Cl)C[C@@H]1N1CCCC1 ZINC000544684968 940502303 /nfs/dbraw/zinc/50/23/03/940502303.db2.gz RDMSQLMXEOMCPY-HOTGVXAUSA-N 0 3 423.941 4.094 20 0 HIADHN CCO[C@@H]1C[C@@H](NCc2cccc(NC(=O)c3ccccc3Cl)c2)[C@]12CCCO2 ZINC000544709975 940505517 /nfs/dbraw/zinc/50/55/17/940505517.db2.gz NGSLDDOOSXFKAH-MQSCRBSSSA-N 0 3 414.933 4.409 20 0 HIADHN CS[C@H]1CN(C(=O)Nc2ccc(C)c(Oc3cc(C)ccn3)c2)C[C@H]1N(C)C ZINC000544792752 940514529 /nfs/dbraw/zinc/51/45/29/940514529.db2.gz IQOUHCQRVSFTDI-MJGOQNOKSA-N 0 3 400.548 4.000 20 0 HIADHN CCN(C(=O)c1cnn(CC(C)C)c1C(F)F)[C@H]1CCN(Cc2ccccc2)C1 ZINC000544850876 940519223 /nfs/dbraw/zinc/51/92/23/940519223.db2.gz PKAPTJBCHBEABZ-SFHVURJKSA-N 0 3 404.505 4.213 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2ccc(F)c(Cl)c2F)cc1)[C@@H]1CCCN(C)C1 ZINC000544852583 940519370 /nfs/dbraw/zinc/51/93/70/940519370.db2.gz WQADOIOQUIIWSH-OAHLLOKOSA-N 0 3 421.875 4.037 20 0 HIADHN Fc1cccc(CN2CCC[C@H](c3nc(-c4ccnc(N5CCCC5)c4)no3)C2)c1 ZINC000545053848 940537527 /nfs/dbraw/zinc/53/75/27/940537527.db2.gz FPDRVIYHKRQWIU-IBGZPJMESA-N 0 3 407.493 4.251 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccnc2)C1)N1CCC(=Cc2ccc(F)c(F)c2)CC1 ZINC000545306143 940561090 /nfs/dbraw/zinc/56/10/90/940561090.db2.gz SBLJRMFMCHOESH-OAQYLSRUSA-N 0 3 411.496 4.278 20 0 HIADHN CCO[C@@H]1C[C@H](NCc2c(C)nn(Cc3ccc(Cl)cc3)c2C)[C@]12CCCO2 ZINC000545349784 940563885 /nfs/dbraw/zinc/56/38/85/940563885.db2.gz GTMMWEDMUPOJHI-BHDDXSALSA-N 0 3 403.954 4.018 20 0 HIADHN CCO[C@@H]1C[C@H](NCc2cc(Cl)ccc2OCc2cccnc2)[C@@]12CCCO2 ZINC000545351724 940563978 /nfs/dbraw/zinc/56/39/78/940563978.db2.gz QSWNAYMVEMUKNZ-BDTNDASRSA-N 0 3 402.922 4.130 20 0 HIADHN C[C@H](CC(=O)c1ccc(Cl)cc1)C(=O)NC1CCN(CCc2ccccc2)CC1 ZINC000545375323 940566907 /nfs/dbraw/zinc/56/69/07/940566907.db2.gz SZBQDARBXXJONL-GOSISDBHSA-N 0 3 412.961 4.372 20 0 HIADHN Cc1nc(C(=O)NC2CCN(CCOc3ccc(F)cc3)CC2)c(-c2ccccc2)o1 ZINC000545388700 940567842 /nfs/dbraw/zinc/56/78/42/940567842.db2.gz SQTXOBUCASVCHM-UHFFFAOYSA-N 0 3 423.488 4.062 20 0 HIADHN C[C@@H](CNC(=O)c1cc(Cl)ccc1Sc1ccccc1)CN1CCN(C)CC1 ZINC000545387299 940567889 /nfs/dbraw/zinc/56/78/89/940567889.db2.gz DVCNTNSNTGZJSK-KRWDZBQOSA-N 0 3 418.006 4.105 20 0 HIADHN CSCc1ccccc1NC(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000545429222 940569398 /nfs/dbraw/zinc/56/93/98/940569398.db2.gz XGXABUDTKFVKRT-QZTJIDSGSA-N 0 3 405.608 4.293 20 0 HIADHN COc1ccc(C[C@@H](C)N[C@H](c2nc(-c3ccncc3)no2)C(C)C)c(C)c1OC ZINC000563984444 945335464 /nfs/dbraw/zinc/33/54/64/945335464.db2.gz MIVVKMMIIMSSPO-QRWLVFNGSA-N 0 3 410.518 4.375 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)[C@@H](C)c1c(C)nn(CC(F)(F)F)c1C)c1ccco1 ZINC000563986615 945336296 /nfs/dbraw/zinc/33/62/96/945336296.db2.gz AYYJEKXZECIHPY-XEZPLFJOSA-N 0 3 414.472 4.004 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)N[C@@H](CC(C)(C)C)C(F)(F)F)CC2)C[C@@H](C)O1 ZINC000546110712 940702392 /nfs/dbraw/zinc/70/23/92/940702392.db2.gz OFIRMRTVDZXLIL-NUJGCVRESA-N 0 3 421.548 4.274 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)Nc2ccccc2CSC)CC1 ZINC000546141177 940711377 /nfs/dbraw/zinc/71/13/77/940711377.db2.gz SLVUZESMTPYHIO-UHFFFAOYSA-N 0 3 412.603 4.009 20 0 HIADHN CC[C@H](C)n1ncc2c1nc(C)cc2C(=O)N(CC)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000546183388 940723735 /nfs/dbraw/zinc/72/37/35/940723735.db2.gz FCANNOCYVFFUNU-PZJWPPBQSA-N 0 3 419.573 4.447 20 0 HIADHN CCN(C(=O)c1cc(Br)cn1CC)[C@H]1CCN(Cc2ccccc2)C1 ZINC000546205839 940729612 /nfs/dbraw/zinc/72/96/12/940729612.db2.gz JWNZSXRGQKUFGW-SFHVURJKSA-N 0 3 404.352 4.007 20 0 HIADHN CCOc1ccc(CCNCc2cn3ccc(Br)cc3n2)cc1OCC ZINC000564007568 945345534 /nfs/dbraw/zinc/34/55/34/945345534.db2.gz IPMPYSYCYSHTER-UHFFFAOYSA-N 0 3 418.335 4.227 20 0 HIADHN CN1CCC(N(Cc2ccccc2Br)C(=O)NCc2ccccc2)CC1 ZINC000564012491 945349735 /nfs/dbraw/zinc/34/97/35/945349735.db2.gz JCJORIULNYYZHO-UHFFFAOYSA-N 0 3 416.363 4.255 20 0 HIADHN CN(C)C[C@H](NC(=O)c1cccc(NC(=O)c2cccs2)c1)c1ccc(F)cc1 ZINC000564021200 945352778 /nfs/dbraw/zinc/35/27/78/945352778.db2.gz GPDORIZGZATNSC-IBGZPJMESA-N 0 3 411.502 4.172 20 0 HIADHN CCCN(C(=O)NC[C@H](C)c1nccs1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000546747683 940875500 /nfs/dbraw/zinc/87/55/00/940875500.db2.gz YZMLLKYCVKDMPU-AZUAARDMSA-N 0 3 400.592 4.333 20 0 HIADHN COc1ccc(-c2csc(CN[C@@H](Cc3ccc(Cl)cc3)C(N)=O)c2)cc1 ZINC000546886995 940901645 /nfs/dbraw/zinc/90/16/45/940901645.db2.gz IIMBOAHUCFIJFQ-FQEVSTJZSA-N 0 3 400.931 4.263 20 0 HIADHN CCN(C(=O)c1[nH]c(-c2cccc(OC)c2)nc1C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000546913895 940911573 /nfs/dbraw/zinc/91/15/73/940911573.db2.gz ORZLWVDRHZRYKP-OAQYLSRUSA-N 0 3 418.541 4.130 20 0 HIADHN CC[C@@H](C)Oc1ccc(-c2nc(-c3ccc(N4CCCN(C)CC4)nc3)no2)cc1 ZINC000547061714 940978904 /nfs/dbraw/zinc/97/89/04/940978904.db2.gz FPQHVGDBCHVMSN-QGZVFWFLSA-N 0 3 407.518 4.118 20 0 HIADHN CC(C)Oc1cccc(/C=C/c2nc(-c3ccc(N4CCCN(C)CC4)nc3)no2)c1 ZINC000547074390 940984803 /nfs/dbraw/zinc/98/48/03/940984803.db2.gz XHONDVISBKUSBV-DHZHZOJOSA-N 0 3 419.529 4.231 20 0 HIADHN COCCOc1cccc(-c2noc([C@H]3CCCN(Cc4cccc(F)c4)C3)n2)c1 ZINC000547076388 940986000 /nfs/dbraw/zinc/98/60/00/940986000.db2.gz SHKNQTXQMNKJRQ-IBGZPJMESA-N 0 3 411.477 4.281 20 0 HIADHN c1cc(-c2noc(-c3ccc(CN4CCSCC4)cc3)n2)cc(OC2CCC2)n1 ZINC000547172482 941020684 /nfs/dbraw/zinc/02/06/84/941020684.db2.gz FKMZOXQXWNNOJX-UHFFFAOYSA-N 0 3 408.527 4.279 20 0 HIADHN c1ccc(Oc2cnc(-c3noc([C@@H]4CCCN(Cc5cccnc5)C4)n3)cn2)cc1 ZINC000547225569 941037506 /nfs/dbraw/zinc/03/75/06/941037506.db2.gz CSVRYXSCNSOMFA-GOSISDBHSA-N 0 3 414.469 4.094 20 0 HIADHN COc1cc(Br)ccc1CCCN1CCC([C@@](C)(O)C(F)(F)F)CC1 ZINC000547346364 941057532 /nfs/dbraw/zinc/05/75/32/941057532.db2.gz HLICSGDREIWCMC-QGZVFWFLSA-N 0 3 424.301 4.416 20 0 HIADHN Cc1cc(CN[C@@H](C)c2ccc3c(c2)CCC(=O)N3)ccc1I ZINC000547397256 941060336 /nfs/dbraw/zinc/06/03/36/941060336.db2.gz WOSOMBHEBGTSRH-ZDUSSCGKSA-N 0 3 420.294 4.335 20 0 HIADHN CCOc1ccc(OC(C)(C)C(=O)Nc2cccc(N3CCN(CC)CC3)c2)cc1 ZINC000547431414 941062162 /nfs/dbraw/zinc/06/21/62/941062162.db2.gz YACCHRMSXCQMMM-UHFFFAOYSA-N 0 3 411.546 4.023 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3nnc(-c4ccccc4)s3)c(C)c2)CC1 ZINC000547504515 941065891 /nfs/dbraw/zinc/06/58/91/941065891.db2.gz ARFAQOXUBWRCOP-UHFFFAOYSA-N 0 3 422.558 4.299 20 0 HIADHN COC(=O)c1ccc(COc2ccc(CN3CCC(OC(C)C)CC3)cc2OC)o1 ZINC000547521987 941067086 /nfs/dbraw/zinc/06/70/86/941067086.db2.gz ONXQKQCYDXFZGW-UHFFFAOYSA-N 0 3 417.502 4.043 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)N[C@H]1CCOc2ccc(F)cc21 ZINC000547713790 941073085 /nfs/dbraw/zinc/07/30/85/941073085.db2.gz HDWVUMWHQYSKTH-IBGZPJMESA-N 0 3 405.901 4.076 20 0 HIADHN COC[C@H](CC(C)C)N[C@@H](c1cccc(S(C)(=O)=O)c1)c1ccc(C)cc1C ZINC000547867657 941079317 /nfs/dbraw/zinc/07/93/17/941079317.db2.gz CNPZKPSCRKZDRR-REWPJTCUSA-N 0 3 403.588 4.447 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)c1csc(C(F)(F)F)n1 ZINC000548059038 941084825 /nfs/dbraw/zinc/08/48/25/941084825.db2.gz FNIWKKNYAIPMFC-UHFFFAOYSA-N 0 3 401.479 4.006 20 0 HIADHN COc1ccc(-c2ccncc2)cc1CN[C@@H](C)[C@H]1CN(Cc2ccccc2)CCO1 ZINC000548477337 941107401 /nfs/dbraw/zinc/10/74/01/941107401.db2.gz FHPNFNMWUULLLL-RXFWQSSRSA-N 0 3 417.553 4.136 20 0 HIADHN CCc1ccc([C@H](N[C@H]2CCC23CCOCC3)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000548791841 941124122 /nfs/dbraw/zinc/12/41/22/941124122.db2.gz YSRHTKXXWVUURZ-GOTSBHOMSA-N 0 3 413.583 4.291 20 0 HIADHN CCNC(=O)Nc1ccc(C)c(NC(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)c1 ZINC000548971613 941136415 /nfs/dbraw/zinc/13/64/15/941136415.db2.gz YYFIQFLRBVDIPE-IBGZPJMESA-N 0 3 417.941 4.214 20 0 HIADHN CCc1nc2cc(CNC(=O)NC[C@H](c3ccccc3)N(C)C)ccc2n1C1CC1 ZINC000548988619 941139161 /nfs/dbraw/zinc/13/91/61/941139161.db2.gz ACFWYVQFVQKYIR-JOCHJYFZSA-N 0 3 405.546 4.036 20 0 HIADHN Cc1nc(COc2ccc(CN[C@H](CN(C)C)c3ccc(Cl)cc3)cc2)no1 ZINC000548991651 941139655 /nfs/dbraw/zinc/13/96/55/941139655.db2.gz LYFLGCZOWAXGRQ-HXUWFJFHSA-N 0 3 400.910 4.003 20 0 HIADHN CO[C@@H](CN[C@@H](CO)c1ccc(Br)cc1C(F)(F)F)c1ccccc1 ZINC000549035923 941146838 /nfs/dbraw/zinc/14/68/38/941146838.db2.gz FHGAXSUNMYJCEJ-IRXDYDNUSA-N 0 3 418.253 4.479 20 0 HIADHN CC(C)(C)N1CC[C@H](NCc2cn3cccnc3n2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000549112772 941160956 /nfs/dbraw/zinc/16/09/56/941160956.db2.gz GMVWVVRGYWANIC-OALUTQOASA-N 0 3 401.917 4.226 20 0 HIADHN Cc1ccc(CNCc2cc3c(c(Br)c2)OCO3)c(-c2ccnn2C)c1 ZINC000549247199 941173872 /nfs/dbraw/zinc/17/38/72/941173872.db2.gz JFPCASAHFLIROK-UHFFFAOYSA-N 0 3 414.303 4.177 20 0 HIADHN Cc1ccc(CNCc2cccc(C(=O)NCc3ccco3)c2)c(-c2cnn(C)c2)c1 ZINC000549245959 941173931 /nfs/dbraw/zinc/17/39/31/941173931.db2.gz MRZAAOBUUJWEMO-UHFFFAOYSA-N 0 3 414.509 4.208 20 0 HIADHN Cc1ccc(-c2nc(CNC(=O)N[C@H](CN(C)C)c3ccc(Cl)cc3)co2)cc1 ZINC000549463705 941192564 /nfs/dbraw/zinc/19/25/64/941192564.db2.gz YSTCKJWNKHMBQA-HXUWFJFHSA-N 0 3 412.921 4.406 20 0 HIADHN CC(C)[C@@H](NCC(=O)N1CCO[C@@H](c2ccc(F)cc2)C1)c1ccc(Cl)cc1 ZINC000549466635 941192731 /nfs/dbraw/zinc/19/27/31/941192731.db2.gz XOMTYKZCIIQXHY-IFMALSPDSA-N 0 3 404.913 4.366 20 0 HIADHN CCOC(=O)[C@H]1CC[C@@H](NCc2ccnc(OCC(F)(F)F)c2)c2ccccc21 ZINC000549523794 941197995 /nfs/dbraw/zinc/19/79/95/941197995.db2.gz LNBJDMULYNQOTF-ZWKOTPCHSA-N 0 3 408.420 4.294 20 0 HIADHN C[C@@H]1CN(c2ccc(Cl)c(F)c2)CCN1C[C@@H]1CCN(C(=O)c2ccccc2)C1 ZINC000549718176 941205556 /nfs/dbraw/zinc/20/55/56/941205556.db2.gz ZWEFVYLZWUTMKK-MSOLQXFVSA-N 0 3 415.940 4.152 20 0 HIADHN C[C@@H]1C[C@H](NS(=O)(=O)Cc2ccc(C(F)F)cc2)CCN1Cc1ccccc1 ZINC000549782411 941207277 /nfs/dbraw/zinc/20/72/77/941207277.db2.gz PUQTXQISFXMMQI-OXQOHEQNSA-N 0 3 408.514 4.097 20 0 HIADHN C[C@H](c1ccc(F)cc1)N1CC[C@H](N(C)CCCc2cc(-c3ccccc3)n[nH]2)C1=O ZINC000549806321 941207892 /nfs/dbraw/zinc/20/78/92/941207892.db2.gz QMQPAQIRQGOVGG-KOSHJBKYSA-N 0 3 420.532 4.442 20 0 HIADHN C[C@@H](c1ccc(F)cc1)N1CC[C@H](N(C)CCCc2cc(-c3ccccc3)n[nH]2)C1=O ZINC000549806323 941207965 /nfs/dbraw/zinc/20/79/65/941207965.db2.gz QMQPAQIRQGOVGG-UUOWRZLLSA-N 0 3 420.532 4.442 20 0 HIADHN COc1ccc(CN(Cc2cn(-c3ccncc3)nc2C)CC2CCC2)c(OC)c1 ZINC000549823595 941208630 /nfs/dbraw/zinc/20/86/30/941208630.db2.gz CVRHNOFBDPOJIN-UHFFFAOYSA-N 0 3 406.530 4.395 20 0 HIADHN Cc1nccnc1CCNCc1cc(Br)ccc1OCc1ccccc1 ZINC000549914096 941236966 /nfs/dbraw/zinc/23/69/66/941236966.db2.gz ZBCLWAGURQLYOW-UHFFFAOYSA-N 0 3 412.331 4.459 20 0 HIADHN COc1ccc(-c2noc([C@H](C)N[C@@H](C)C3CCN(CC(F)(F)F)CC3)n2)cc1 ZINC000550024223 941267497 /nfs/dbraw/zinc/26/74/97/941267497.db2.gz FKUJUYOVSSPFCG-KBPBESRZSA-N 0 3 412.456 4.059 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)C2CCC(OC[C@H]3CCCO3)CC2)N2CCCC2)cc1 ZINC000550272781 941307261 /nfs/dbraw/zinc/30/72/61/941307261.db2.gz AAYFHTPGTUQTPP-SNDHGLFQSA-N 0 3 414.590 4.003 20 0 HIADHN CCO[C@@H]1C[C@@H](NCc2cn(-c3ccccc3)nc2-c2cccs2)[C@@H]1n1cccn1 ZINC000550325519 941315131 /nfs/dbraw/zinc/31/51/31/941315131.db2.gz GVPUCGCRHIRFII-VIZSFHNOSA-N 0 3 419.554 4.306 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1scnc1COC)c1ccc(C(F)(F)F)cc1 ZINC000550553302 941338061 /nfs/dbraw/zinc/33/80/61/941338061.db2.gz LQWAUNHYHAHBMO-INIZCTEOSA-N 0 3 415.481 4.121 20 0 HIADHN C/C=C\c1ccc(OC[C@H](O)CNCc2cc(F)cc(Br)c2)c(OC)c1 ZINC000550624278 941347295 /nfs/dbraw/zinc/34/72/95/941347295.db2.gz NDRJBSUVXMCXLC-DDKKJVIOSA-N 0 3 424.310 4.159 20 0 HIADHN NS(=O)(=O)c1ccc2c(c1)CCC[C@H]2NC1(c2cccc(C(F)(F)F)c2)CCC1 ZINC000550754130 941363253 /nfs/dbraw/zinc/36/32/53/941363253.db2.gz UUXYYUWTDYJSIK-LJQANCHMSA-N 0 3 424.488 4.399 20 0 HIADHN CC(=O)NC1CCC(NCc2csc(-c3cccc(Br)c3)n2)CC1 ZINC000550840292 941373123 /nfs/dbraw/zinc/37/31/23/941373123.db2.gz LKJBMMPKPQJUIZ-UHFFFAOYSA-N 0 3 408.365 4.110 20 0 HIADHN CC[C@H](N[C@@H]1CCCN([C@@H](C)c2ccccc2F)C1=O)c1ccc2c(c1)OCCO2 ZINC000550860520 941375505 /nfs/dbraw/zinc/37/55/05/941375505.db2.gz KULLQLKOTAIAGZ-ORYQWCPZSA-N 0 3 412.505 4.390 20 0 HIADHN C[C@H](NC[C@@H](c1ccc(C(F)(F)F)cc1)N1CCOCC1)c1cn2ccccc2n1 ZINC000550885530 941379020 /nfs/dbraw/zinc/37/90/20/941379020.db2.gz GJBIGSLGBBHGBY-JXFKEZNVSA-N 0 3 418.463 4.077 20 0 HIADHN Brc1ccc(C2(CN[C@@H](c3nnc[nH]3)c3cccnc3)CCCC2)cc1 ZINC000550891756 941379805 /nfs/dbraw/zinc/37/98/05/941379805.db2.gz NRWHUBSAECIKOE-GOSISDBHSA-N 0 3 412.335 4.153 20 0 HIADHN CCO[C@@H]1C[C@H](N[C@@H](C)c2sc(-c3ccc(OC)cc3)nc2C)[C@@H]1n1cccn1 ZINC000550947189 941384832 /nfs/dbraw/zinc/38/48/32/941384832.db2.gz ZCMVTTZVRFOCFZ-GAZPGATBSA-N 0 3 412.559 4.393 20 0 HIADHN C[C@H](N[C@H]1CCCN([C@@H](C)c2ccccc2F)C1=O)c1ccc2c(c1)CCC(=O)N2 ZINC000551242890 941434539 /nfs/dbraw/zinc/43/45/39/941434539.db2.gz XYPCTHNARNXKSP-WCJKSRRJSA-N 0 3 409.505 4.113 20 0 HIADHN COc1ccc([C@H](C)N[C@@H]2CCCN([C@H](C)c3ccc(F)cc3)C2=O)cc1OC ZINC000551275058 941441416 /nfs/dbraw/zinc/44/14/16/941441416.db2.gz YNXJDUBPRZPCKC-RZQQEMMASA-N 0 3 400.494 4.246 20 0 HIADHN CCO[C@@H]1C[C@H](N[C@@H](c2ccc(Br)cc2F)C2CC2)[C@H]1n1cccn1 ZINC000551320120 941451688 /nfs/dbraw/zinc/45/16/88/941451688.db2.gz JDMSBYJGBPAENX-WJFTUGDTSA-N 0 3 408.315 4.244 20 0 HIADHN C[C@@H]1CCN(C(=O)Nc2ccc(Oc3cccnc3)nc2)CCN1Cc1ccccc1 ZINC000551393062 941468517 /nfs/dbraw/zinc/46/85/17/941468517.db2.gz CJPZTNMTWWXNKJ-LJQANCHMSA-N 0 3 417.513 4.397 20 0 HIADHN O=C1CCN1c1cccc(-c2noc([C@H]3CN(Cc4ccccc4)CCC3(F)F)n2)c1 ZINC000551439920 941479835 /nfs/dbraw/zinc/47/98/35/941479835.db2.gz QJEHCPOHMMRICP-LJQANCHMSA-N 0 3 424.451 4.098 20 0 HIADHN Cc1ccc([C@@H](NC[C@H]2CN(Cc3ccccc3)CCCO2)c2ccccn2)cc1 ZINC000551448651 941481430 /nfs/dbraw/zinc/48/14/30/941481430.db2.gz WOIOEVBFXJSMCP-AZGAKELHSA-N 0 3 401.554 4.360 20 0 HIADHN CN(C(=O)c1ccc(NCc2cc(Br)cs2)cc1)[C@@H]1CCCN(C)C1 ZINC000551452722 941482675 /nfs/dbraw/zinc/48/26/75/941482675.db2.gz VWSNVPFKNBACOL-QGZVFWFLSA-N 0 3 422.392 4.289 20 0 HIADHN COCC[C@H](N[C@H](C)c1ccc(-n2cnnn2)cc1)c1ccc(Cl)c(Cl)c1 ZINC000551572308 941504429 /nfs/dbraw/zinc/50/44/29/941504429.db2.gz YNPUOQUJOFPAAP-YJYMSZOUSA-N 0 3 406.317 4.398 20 0 HIADHN COc1ccc([C@@H](NCc2cccc(N3C(=O)N[C@](C)(C4CC4)C3=O)c2)C2CC2)cc1 ZINC000551572774 941505090 /nfs/dbraw/zinc/50/50/90/941505090.db2.gz KDMDKLUJOVDJTQ-WIOPSUGQSA-N 0 3 419.525 4.161 20 0 HIADHN CC(C)N1CCN([C@H]2CCN(C(=O)c3csc(-c4ccc(Cl)cc4)c3)C2)CC1 ZINC000551591493 941508198 /nfs/dbraw/zinc/50/81/98/941508198.db2.gz OSDGDDYROHEDOA-FQEVSTJZSA-N 0 3 418.006 4.309 20 0 HIADHN O=C(Cc1c[nH]c2cccc(Cl)c12)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000551796927 941546588 /nfs/dbraw/zinc/54/65/88/941546588.db2.gz LDINVRFQKOTVGA-UHFFFAOYSA-N 0 3 411.933 4.207 20 0 HIADHN COCC[C@H](N[C@@H](C)c1ccc(S(N)(=O)=O)cc1)c1ccc(Cl)c(Cl)c1 ZINC000551812496 941550246 /nfs/dbraw/zinc/55/02/46/941550246.db2.gz FKYBENMRGPZZFR-SGTLLEGYSA-N 0 3 417.358 4.069 20 0 HIADHN CCC[C@@H](N[C@@H](C)c1ccc(OC)c(OC)c1C)C(=O)N1CCc2sccc2C1 ZINC000552044948 941573092 /nfs/dbraw/zinc/57/30/92/941573092.db2.gz SSPQMYQPBLIRTA-QFBILLFUSA-N 0 3 416.587 4.478 20 0 HIADHN Cc1nn(-c2ccc(F)cc2F)c(C)c1CN1CCC(CO)(c2ccccc2)CC1 ZINC000552071626 941579689 /nfs/dbraw/zinc/57/96/89/941579689.db2.gz VIOMKQFRWKXJMC-UHFFFAOYSA-N 0 3 411.496 4.293 20 0 HIADHN CCc1nnc(NC(=O)[C@H](C)[C@H](C)N[C@@H](C)c2ccc(F)cc2OC(F)F)s1 ZINC000552089175 941582738 /nfs/dbraw/zinc/58/27/38/941582738.db2.gz CABYFXSIHRFORR-VWYCJHECSA-N 0 3 416.469 4.155 20 0 HIADHN FC(F)(F)[C@@H](CN[C@@H]1CCCc2nc(-c3ccccc3)sc21)N1CCOCC1 ZINC000552097196 941584050 /nfs/dbraw/zinc/58/40/50/941584050.db2.gz WFXPDFWJBJEIPQ-NVXWUHKLSA-N 0 3 411.493 4.040 20 0 HIADHN CS(=O)(=O)C1(CN[C@@H]2CCCc3nc(-c4ccc(F)cc4)sc32)CCCC1 ZINC000552098812 941584785 /nfs/dbraw/zinc/58/47/85/941584785.db2.gz PBXTYQGNKQBHFB-MRXNPFEDSA-N 0 3 408.564 4.274 20 0 HIADHN C[C@H](CC(=O)Nc1cccc(CN2CC[C@@H](O)C2)c1)c1ccc(C(F)(F)F)cc1 ZINC000552198770 941600425 /nfs/dbraw/zinc/60/04/25/941600425.db2.gz FJZBJKJUSYIIRD-FOIQADDNSA-N 0 3 406.448 4.404 20 0 HIADHN OC[C@H](CN[C@H](c1ncc[nH]1)C1CCCCC1)Cc1cccc(OC(F)(F)F)c1 ZINC000552246405 941612868 /nfs/dbraw/zinc/61/28/68/941612868.db2.gz SZHYFMWRQJBRTE-LPHOPBHVSA-N 0 3 411.468 4.371 20 0 HIADHN COC(=O)c1csc([C@@H](C)N[C@@H](C)CC(=O)Nc2cccc(N3CCCC3)c2)c1 ZINC000552247324 941613452 /nfs/dbraw/zinc/61/34/52/941613452.db2.gz KMGYPZAXJXTHQK-JKSUJKDBSA-N 0 3 415.559 4.203 20 0 HIADHN O=C(NCCCN[C@@H](c1ncc[nH]1)C1CCCCC1)c1ccc(Br)cc1 ZINC000552252647 941614443 /nfs/dbraw/zinc/61/44/43/941614443.db2.gz SKMOGCAZWRUFJD-GOSISDBHSA-N 0 3 419.367 4.203 20 0 HIADHN COc1ccc([C@H](C)N[C@H]2CCCN(c3ccc(F)cc3C)C2=O)c(C)c1OC ZINC000552252616 941614503 /nfs/dbraw/zinc/61/45/03/941614503.db2.gz RQVWYZQDYRFCQA-LPHOPBHVSA-N 0 3 400.494 4.306 20 0 HIADHN COc1ccc([C@@H](C)N[C@H]2CCCN(c3ccc(F)cc3C)C2=O)c(C)c1OC ZINC000552252615 941614570 /nfs/dbraw/zinc/61/45/70/941614570.db2.gz RQVWYZQDYRFCQA-APWZRJJASA-N 0 3 400.494 4.306 20 0 HIADHN COc1ccc(NC(=O)CN[C@@H]2CC[C@@H](c3ccccc3)C[C@H]2OC)cc1Cl ZINC000552258629 941615828 /nfs/dbraw/zinc/61/58/28/941615828.db2.gz RNQJQZVTQKBCNU-OZOXKJRCSA-N 0 3 402.922 4.228 20 0 HIADHN C[C@H](NC[C@H](c1ccc(Cl)cc1)N(C)CCC(F)(F)F)c1ccc(=O)[nH]n1 ZINC000552266699 941617759 /nfs/dbraw/zinc/61/77/59/941617759.db2.gz ZMWPRGDUGHPKCN-BLLLJJGKSA-N 0 3 402.848 4.112 20 0 HIADHN OC[C@H](CN[C@@H](c1ncc[nH]1)C1CCCCC1)Cc1ccccc1OC(F)(F)F ZINC000552270758 941619144 /nfs/dbraw/zinc/61/91/44/941619144.db2.gz BIIUWXXQMMUBNL-HNAYVOBHSA-N 0 3 411.468 4.371 20 0 HIADHN COc1cc(CN(C)CCc2ncc(C)s2)cc(Br)c1OC(F)F ZINC000552307156 941628380 /nfs/dbraw/zinc/62/83/80/941628380.db2.gz XTEQROPEEJXSGG-UHFFFAOYSA-N 0 3 421.307 4.499 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc2n[nH]cc2c1)c1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000552335101 941635215 /nfs/dbraw/zinc/63/52/15/941635215.db2.gz ISCAYPYQVUQIPU-SJORKVTESA-N 0 3 412.559 4.149 20 0 HIADHN C[C@H]1CSc2ccc(Br)cc2[C@@H]1NCC1(S(C)(=O)=O)CCCC1 ZINC000552338644 941638123 /nfs/dbraw/zinc/63/81/23/941638123.db2.gz LAWKOKPWSYDCPC-BLLLJJGKSA-N 0 3 418.422 4.179 20 0 HIADHN O=C(Cc1coc2ccccc12)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000552365460 941646086 /nfs/dbraw/zinc/64/60/86/941646086.db2.gz CMTKDHXHKXUBCH-HXUWFJFHSA-N 0 3 400.482 4.258 20 0 HIADHN CN1CC[C@@H](NC(=O)C2(c3cc(F)cc(Br)c3)CC2)[C@H]1c1ccccc1 ZINC000552397975 941657282 /nfs/dbraw/zinc/65/72/82/941657282.db2.gz SATDXFMXHVDZLN-RTBURBONSA-N 0 3 417.322 4.181 20 0 HIADHN C/C=C\c1ccc(OC[C@H](O)CN[C@H]2CCSc3c(F)cccc32)c(OC)c1 ZINC000552676124 941735314 /nfs/dbraw/zinc/73/53/14/941735314.db2.gz KOWOZMONAMHRRK-VRQBABSCSA-N 0 3 403.519 4.434 20 0 HIADHN O=C(CC1(N2CCOCC2)CCCC1)N1CCC([C@H](F)c2ccccc2F)CC1 ZINC000552792726 941764597 /nfs/dbraw/zinc/76/45/97/941764597.db2.gz QQVHZYVUJJZMOO-QFIPXVFZSA-N 0 3 406.517 4.110 20 0 HIADHN COc1ccc(CN(Cc2cc(=O)c(OC)co2)[C@@H]2CCCC[C@@H]2C)cc1OC ZINC000552835459 941781785 /nfs/dbraw/zinc/78/17/85/941781785.db2.gz MPPOBVBGDWKWIF-QFBILLFUSA-N 0 3 401.503 4.247 20 0 HIADHN Cc1cc2ncc([C@@H](C)N[C@@H](C)c3ccc(NC(=O)c4ccncc4)cc3)c(C)n2n1 ZINC000552866354 941792922 /nfs/dbraw/zinc/79/29/22/941792922.db2.gz ZGUUOTULACDHGK-DLBZAZTESA-N 0 3 414.513 4.405 20 0 HIADHN Cc1nc(-c2cc([C@@H](C)NCc3ccc(NS(C)(=O)=O)cc3)cs2)cs1 ZINC000552880318 941797228 /nfs/dbraw/zinc/79/72/28/941797228.db2.gz ZYWPKMDBMIDUTJ-GFCCVEGCSA-N 0 3 407.586 4.402 20 0 HIADHN COc1ccccc1-c1ccc([C@H](C)NCc2ccc(OCC(N)=O)c(OC)c2)cc1 ZINC000552919024 941802422 /nfs/dbraw/zinc/80/24/22/941802422.db2.gz YEGXZUZZOGHOAP-KRWDZBQOSA-N 0 3 420.509 4.086 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)N1[C@H](C)CCC[C@@H]1C)c1ccc(NC(=O)c2ccncc2)cc1 ZINC000553002802 941813780 /nfs/dbraw/zinc/81/37/80/941813780.db2.gz KDTCOLGURVYNOU-HCXYKTFWSA-N 0 3 408.546 4.163 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)c1coc(C2CCOCC2)n1)c1ccc(Cl)cc1 ZINC000553016689 941816870 /nfs/dbraw/zinc/81/68/70/941816870.db2.gz DKVMJWTXPVDKTL-IBGZPJMESA-N 0 3 405.926 4.035 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)CSc1nc(C)cc(C)n1)c1ccc(Cl)cc1 ZINC000553027375 941819670 /nfs/dbraw/zinc/81/96/70/941819670.db2.gz XVMNJZSIHAFUTO-SFHVURJKSA-N 0 3 406.983 4.038 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)c1csc(-c2cnccn2)n1)c1ccc(Cl)cc1 ZINC000553028705 941820048 /nfs/dbraw/zinc/82/00/48/941820048.db2.gz QRLVMGOJNOMCRR-SFHVURJKSA-N 0 3 415.950 4.066 20 0 HIADHN CCOc1ccc(Oc2ccc(Cl)cc2NC(=O)CN2CCCN(C)CC2)cc1 ZINC000553046569 941824006 /nfs/dbraw/zinc/82/40/06/941824006.db2.gz VNUCWDMQFHBTNC-UHFFFAOYSA-N 0 3 417.937 4.107 20 0 HIADHN Cc1nn(Cc2ccc(C)cc2)c(C)c1CCC(=O)Nc1ccccc1CN(C)C ZINC000553055177 941825442 /nfs/dbraw/zinc/82/54/42/941825442.db2.gz VSRPTFMVEKTBDM-UHFFFAOYSA-N 0 3 404.558 4.490 20 0 HIADHN C[C@@H](NCC(=O)Nc1ccc(OC(F)(F)F)cc1)c1cccc(N2CCCC2)c1 ZINC000553075457 941828930 /nfs/dbraw/zinc/82/89/30/941828930.db2.gz NRYFUCWGXOJCFZ-OAHLLOKOSA-N 0 3 407.436 4.475 20 0 HIADHN Cc1cc(NC(=O)c2cccc(F)c2)sc1C(=O)N1C[C@@H](N2CCCC2)C[C@H]1C ZINC000553102414 941833196 /nfs/dbraw/zinc/83/31/96/941833196.db2.gz PAQWRSUWBJMRGY-QAPCUYQASA-N 0 3 415.534 4.147 20 0 HIADHN COC1(CC(=O)N(Cc2ccncc2)[C@H]2CCCN(Cc3ccccc3)C2)CCC1 ZINC000553174459 941844774 /nfs/dbraw/zinc/84/47/74/941844774.db2.gz UOIRMVNFJNEORK-QHCPKHFHSA-N 0 3 407.558 4.034 20 0 HIADHN C[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCC[C@@H](c2n[nH]cc2CN2CCCC2)C1 ZINC000553180636 941844994 /nfs/dbraw/zinc/84/49/94/941844994.db2.gz CRKJNBUYLOOPQS-IEBWSBKVSA-N 0 3 414.981 4.244 20 0 HIADHN C[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCC[C@H](c2n[nH]cc2CN2CCCC2)C1 ZINC000553180637 941845187 /nfs/dbraw/zinc/84/51/87/941845187.db2.gz CRKJNBUYLOOPQS-MJGOQNOKSA-N 0 3 414.981 4.244 20 0 HIADHN Cc1ccc(C(=O)N(Cc2ccncc2)[C@H]2CCCN(Cc3ccccc3)C2)n1C ZINC000553197583 941847818 /nfs/dbraw/zinc/84/78/18/941847818.db2.gz RUTWIZWPZYNIEJ-QHCPKHFHSA-N 0 3 402.542 4.036 20 0 HIADHN C[C@H](NC(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1)c1ccc2n[nH]cc2c1 ZINC000553363917 941872989 /nfs/dbraw/zinc/87/29/89/941872989.db2.gz WKFNDYQDETVPRX-JXFKEZNVSA-N 0 3 411.575 4.458 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)NCC(=O)Nc2ccc(C(F)(F)F)cc2)cc1 ZINC000553427557 941882797 /nfs/dbraw/zinc/88/27/97/941882797.db2.gz DROUOTHZKXKYQX-CQSZACIVSA-N 0 3 402.420 4.489 20 0 HIADHN CC[C@H](NC(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1)c1ccc(OC)c(OC)c1 ZINC000553485007 941893688 /nfs/dbraw/zinc/89/36/88/941893688.db2.gz REXXDQZRQFCRBT-WMQCIHAUSA-N 0 3 411.546 4.290 20 0 HIADHN C[C@@H](CC(=O)N1CCC[C@@H](c2n[nH]cc2CN2CCCC2)C1)Cc1cccc(F)c1 ZINC000553513924 941900241 /nfs/dbraw/zinc/90/02/41/941900241.db2.gz ZHXLFHBJXOYPBL-UYAOXDASSA-N 0 3 412.553 4.120 20 0 HIADHN CCN1CC[C@@H](N(C)C(=O)Nc2ccc(Cl)cc2C(=O)c2ccc[nH]2)C[C@@H]1C ZINC000553614944 941921867 /nfs/dbraw/zinc/92/18/67/941921867.db2.gz BPTODVCSZPHMGM-GOEBONIOSA-N 0 3 402.926 4.236 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)CCCc2nc3ccccc3[nH]2)N(C)C)cc1 ZINC000553672867 941942079 /nfs/dbraw/zinc/94/20/79/941942079.db2.gz WMDJDFLEZAUGDS-QFIPXVFZSA-N 0 3 408.546 4.092 20 0 HIADHN Cc1cccc(-n2ncc(C(=O)N3CCN([C@@H]4C[C@@H]4C)C[C@H](C)C3)c2C(F)(F)F)c1 ZINC000553783449 941967928 /nfs/dbraw/zinc/96/79/28/941967928.db2.gz VNBSEXNIKCWHDI-TXPKVOOTSA-N 0 3 420.479 4.002 20 0 HIADHN CC(C)Oc1cc(Br)ccc1C(=O)N1CCN([C@@H]2C[C@@H]2C)C[C@H](C)C1 ZINC000553782685 941967975 /nfs/dbraw/zinc/96/79/75/941967975.db2.gz DOMDYUPDDKQSOD-RLFYNMQTSA-N 0 3 409.368 4.039 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)N[C@@H](C)c1nc(C(C)(C)C)no1)c1ccc(Cl)cc1 ZINC000553797030 941971605 /nfs/dbraw/zinc/97/16/05/941971605.db2.gz DUIFVFAILRGSHC-YOEHRIQHSA-N 0 3 421.973 4.464 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)N[C@@H](CO)c1sccc1C)c1ccc(Cl)cc1 ZINC000553894581 941992708 /nfs/dbraw/zinc/99/27/08/941992708.db2.gz PGUWBXQYHWYPHG-ROUUACIJSA-N 0 3 409.983 4.126 20 0 HIADHN Fc1ccc(CN(Cc2cc3c(c(Br)c2)OCO3)C2CCOCC2)cc1 ZINC000553907890 941996080 /nfs/dbraw/zinc/99/60/80/941996080.db2.gz RMEPOAZCORPPOP-UHFFFAOYSA-N 0 3 422.294 4.498 20 0 HIADHN CC[C@H](CNC(=O)[C@H](C)Cc1cncc2ccccc21)N1CCc2ccccc2C1 ZINC000553964012 942008760 /nfs/dbraw/zinc/00/87/60/942008760.db2.gz OGRJSWIKALFYRF-NTKDMRAZSA-N 0 3 401.554 4.367 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)[C@H](C)Cc3cncc4ccccc43)c2)CC1 ZINC000553978585 942012242 /nfs/dbraw/zinc/01/22/42/942012242.db2.gz VMMISEQAQLBIOG-LJQANCHMSA-N 0 3 402.542 4.194 20 0 HIADHN CC(C)Cc1ccc([C@H](CNC(=O)Cc2csc(-c3cccnc3)n2)N(C)C)cc1 ZINC000554083782 942032916 /nfs/dbraw/zinc/03/29/16/942032916.db2.gz FMNYWEFMWOVRMJ-QFIPXVFZSA-N 0 3 422.598 4.365 20 0 HIADHN C[C@H]1C[C@H]1N1CCN(C(=O)c2ccc(Sc3ccccc3Cl)nn2)C[C@@H](C)C1 ZINC000554132802 942045365 /nfs/dbraw/zinc/04/53/65/942045365.db2.gz VEZABZXBPQDBMA-RLFYNMQTSA-N 0 3 416.978 4.084 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)Nc1ccc(C(=O)NC2CCCC2)cc1)c1ccco1 ZINC000554147318 942050093 /nfs/dbraw/zinc/05/00/93/942050093.db2.gz VXQAZJRGMNXPBG-UZLBHIALSA-N 0 3 412.534 4.203 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)N[C@@H](CN(C)C)c2ccc(F)cc2)c(C)c1 ZINC000554162335 942053033 /nfs/dbraw/zinc/05/30/33/942053033.db2.gz QSQDDRCCERHOEK-KKSFZXQISA-N 0 3 414.525 4.087 20 0 HIADHN COc1cc([C@H](C)N[C@H](C)c2cccc(NS(C)(=O)=O)c2)ccc1OC(C)C ZINC000554209461 942067770 /nfs/dbraw/zinc/06/77/70/942067770.db2.gz HKQRMKOKOZCLHK-CVEARBPZSA-N 0 3 406.548 4.266 20 0 HIADHN CCCN(C(=O)c1cccs1)C1CCN(C[C@H](O)Cc2cccc(Cl)c2)CC1 ZINC000554236029 942074469 /nfs/dbraw/zinc/07/44/69/942074469.db2.gz MEFJATXCDKBOQK-HXUWFJFHSA-N 0 3 421.006 4.322 20 0 HIADHN Cc1cc(OC[C@H](O)CN2CC[C@@H](OCc3ccncc3)C2)c(C(C)C)cc1Cl ZINC000554248147 942077181 /nfs/dbraw/zinc/07/71/81/942077181.db2.gz SCWMMWSAVYQTHL-WOJBJXKFSA-N 0 3 418.965 4.198 20 0 HIADHN CN(C)C[C@H](NC(=O)Nc1c(F)cc(Br)cc1F)c1ccc(F)cc1 ZINC000554259194 942081681 /nfs/dbraw/zinc/08/16/81/942081681.db2.gz CMGULFYRFSENEP-HNNXBMFYSA-N 0 3 416.241 4.291 20 0 HIADHN CC(=O)NCC[C@H]1CCCN(Cc2c(-c3ccc(Cl)cc3)nc3sccn23)C1 ZINC000554290484 942092677 /nfs/dbraw/zinc/09/26/77/942092677.db2.gz RVVRJWYJHJSSPL-MRXNPFEDSA-N 0 3 416.978 4.454 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)Nc2ccc(OC(F)F)cc2)N(C)C)cc1 ZINC000554349563 942110078 /nfs/dbraw/zinc/11/00/78/942110078.db2.gz WIHFOLRPNDGCEU-IBGZPJMESA-N 0 3 407.461 4.500 20 0 HIADHN CC[C@@H](N[C@@H]1CCN(Cc2ccc(OC)cc2OC)C1=O)c1ccc(Cl)cc1 ZINC000554366154 942115157 /nfs/dbraw/zinc/11/51/57/942115157.db2.gz HFPCEZNCMZFDFY-WOJBJXKFSA-N 0 3 402.922 4.199 20 0 HIADHN CC(C)Cc1ccc([C@H](CNC(=O)Nc2ccc(C(=O)N(C)C)cc2)N(C)C)cc1 ZINC000554384901 942121741 /nfs/dbraw/zinc/12/17/41/942121741.db2.gz NOBSPPKPFMNVAY-QFIPXVFZSA-N 0 3 410.562 4.011 20 0 HIADHN CN(C)C[C@H](NC(=O)Nc1cccc(OCc2cccnc2)c1)c1ccc(F)cc1 ZINC000554398788 942125894 /nfs/dbraw/zinc/12/58/94/942125894.db2.gz BEKQTRBVPZAWHH-QFIPXVFZSA-N 0 3 408.477 4.224 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)Nc1ccc(-c2noc(C(F)F)n2)cc1 ZINC000554454267 942149774 /nfs/dbraw/zinc/14/97/74/942149774.db2.gz LVVHRMWWRMVHJT-UHFFFAOYSA-N 0 3 407.465 4.404 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1ccc(OC2CCOCC2)c(C)c1)c1ccco1 ZINC000554464470 942152486 /nfs/dbraw/zinc/15/24/86/942152486.db2.gz JWMSGYZICPPUQW-PXNSSMCTSA-N 0 3 415.534 4.397 20 0 HIADHN COc1cccc([C@H](CNC(=O)NCc2ccc(CSC)cc2)N2CCCC2)c1 ZINC000554466696 942153056 /nfs/dbraw/zinc/15/30/56/942153056.db2.gz KCIKZRGWVNBJHF-QFIPXVFZSA-N 0 3 413.587 4.195 20 0 HIADHN O=c1[nH]c2ccccc2n1CCCN[C@H]1CCOc2c(Br)cccc21 ZINC000554553627 942166873 /nfs/dbraw/zinc/16/68/73/942166873.db2.gz CXVAPRRKYCWILF-HNNXBMFYSA-N 0 3 402.292 4.008 20 0 HIADHN O=C(Nc1ccc([C@H]2CCOC2)cc1)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000554620425 942178083 /nfs/dbraw/zinc/17/80/83/942178083.db2.gz YPZJKLXOPTUZMP-FPOVZHCZSA-N 0 3 400.469 4.286 20 0 HIADHN COc1cc(Cl)c(NC(=O)N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)cc1C ZINC000554763234 942227739 /nfs/dbraw/zinc/22/77/39/942227739.db2.gz OUIXDSJQGXEFOR-IYBDPMFKSA-N 0 3 409.958 4.010 20 0 HIADHN O[C@@H](COCc1ccccc1Cl)CN1CCC(Oc2ccc(F)cc2F)CC1 ZINC000554831542 942269188 /nfs/dbraw/zinc/26/91/88/942269188.db2.gz SUDLPMGIPYGVFU-QGZVFWFLSA-N 0 3 411.876 4.039 20 0 HIADHN Cc1ccc([C@H](OC[C@H](O)CN2CC3(CCC3)[C@H]2[C@@H]2CCCO2)c2ccccc2)cc1 ZINC000554959860 942334173 /nfs/dbraw/zinc/33/41/73/942334173.db2.gz JJVVKNHYTVYOAS-XDZVQPMWSA-N 0 3 421.581 4.495 20 0 HIADHN COc1cc(F)c([C@@H](C)NC(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)cc1OC ZINC000555123587 942391055 /nfs/dbraw/zinc/39/10/55/942391055.db2.gz KXIBGADJCUWZRC-FZKQIMNGSA-N 0 3 423.916 4.159 20 0 HIADHN Cc1ccccc1CNC(=O)[C@H](C)N[C@H]1CCN(C(C)C)[C@@H]1c1ccc(F)c(F)c1 ZINC000555126535 942393473 /nfs/dbraw/zinc/39/34/73/942393473.db2.gz XIYINMZUKQLYSE-PDIWNELESA-N 0 3 415.528 4.092 20 0 HIADHN COc1cccc([C@@H]2[C@@H](NCc3nc4cc(Cl)ccc4c(=O)[nH]3)CCN2C2CC2)c1 ZINC000555130434 942395576 /nfs/dbraw/zinc/39/55/76/942395576.db2.gz TVDVLGBXTRCNLR-SIKLNZKXSA-N 0 3 424.932 4.065 20 0 HIADHN CCc1cccc(NC(=O)CN[C@@H]2CCN(CC)[C@@H]2c2cc(F)c(F)c(F)c2)c1 ZINC000555132171 942396288 /nfs/dbraw/zinc/39/62/88/942396288.db2.gz IDCNMEQYDYZXJY-DENIHFKCSA-N 0 3 405.464 4.030 20 0 HIADHN CCN1CC[C@H](NCC(=O)Nc2ccc(C)cc2F)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000555131659 942396739 /nfs/dbraw/zinc/39/67/39/942396739.db2.gz PEHJKULYAAIVCE-FPOVZHCZSA-N 0 3 407.892 4.290 20 0 HIADHN CCN1CC[C@H](N[C@H](C)C(=O)Nc2cccc(C)c2)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000555132488 942397523 /nfs/dbraw/zinc/39/75/23/942397523.db2.gz IZVIKTAMMYPNPH-XWRIVVANSA-N 0 3 405.464 4.164 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@@H](N[C@@H]2CCN(c3ccccc3Cl)C2=O)c2ccccc21 ZINC000555232846 942438626 /nfs/dbraw/zinc/43/86/26/942438626.db2.gz NOFPDWGSGOHJRW-MISYRCLQSA-N 0 3 412.917 4.217 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)C1NS(=O)(=O)Cc1ccc(C(F)F)cc1 ZINC000555320816 942475291 /nfs/dbraw/zinc/47/52/91/942475291.db2.gz WHHIPDWHZLMVDN-IAGOWNOFSA-N 0 3 422.541 4.200 20 0 HIADHN COCCO[C@@H]1CCCN(Cc2cccc(NC(=O)c3ccc(Cl)cc3)c2)C1 ZINC000555339713 942483828 /nfs/dbraw/zinc/48/38/28/942483828.db2.gz JKSQTZAXPWONPS-OAQYLSRUSA-N 0 3 402.922 4.220 20 0 HIADHN O=C(NC1(c2cccc(C(F)(F)F)c2)CC1)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000556039822 942793632 /nfs/dbraw/zinc/79/36/32/942793632.db2.gz YXJKBYBGOWVBOV-KRWDZBQOSA-N 0 3 403.448 4.118 20 0 HIADHN Cc1cc(C(=O)NC2CCN(Cc3ccc(OCc4cccnc4)cc3)CC2)c(C)o1 ZINC000556046774 942795634 /nfs/dbraw/zinc/79/56/34/942795634.db2.gz HAMXIYDBUFOMKZ-UHFFFAOYSA-N 0 3 419.525 4.265 20 0 HIADHN COc1ccc2c(c1F)CC[C@@H]2N[C@@H]1CCCN([C@H](C)c2ccccc2F)C1=O ZINC000556225713 942821375 /nfs/dbraw/zinc/82/13/75/942821375.db2.gz ZIVQFCXINMPALN-VOBQZIQPSA-N 0 3 400.469 4.303 20 0 HIADHN CN(C(=O)c1ccc(NCc2ccccc2OCC2CC2)cc1)[C@H]1CCCN(C)C1 ZINC000556338858 942845069 /nfs/dbraw/zinc/84/50/69/942845069.db2.gz PJUSHLCQVPUNGS-QHCPKHFHSA-N 0 3 407.558 4.254 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)N(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)CN1C1CC1 ZINC000556454584 942872840 /nfs/dbraw/zinc/87/28/40/942872840.db2.gz QVHRMMWUOJGBOB-XHDPSFHLSA-N 0 3 423.401 4.491 20 0 HIADHN CC(C)CN(C(=O)CN[C@H](c1cccc(C(F)(F)F)c1)C1CCOCC1)C1CC1 ZINC000556523058 942891296 /nfs/dbraw/zinc/89/12/96/942891296.db2.gz SYAGYNTZSKDTED-NRFANRHFSA-N 0 3 412.496 4.410 20 0 HIADHN CCc1sc(C(=O)Nc2cccc(CN3CCC(O)CC3)c2)cc1Br ZINC000556535982 942893833 /nfs/dbraw/zinc/89/38/33/942893833.db2.gz NZMVCXIKKUUFGH-UHFFFAOYSA-N 0 3 423.376 4.282 20 0 HIADHN CCOc1cc(NC(=O)C(=O)N(CC)[C@H]2CCN([C@@H](C)c3ccccc3)C2)ccc1C ZINC000556548870 942897214 /nfs/dbraw/zinc/89/72/14/942897214.db2.gz RKSBBFCESNJRCC-UGKGYDQZSA-N 0 3 423.557 4.016 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2ccc3c(c2)CCC=C3)cc1)[C@H]1CCCN(C)C1 ZINC000556574032 942904034 /nfs/dbraw/zinc/90/40/34/942904034.db2.gz OGIHENRUQMOGLY-QHCPKHFHSA-N 0 3 403.526 4.065 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)c2cc(C3CC3)nc3onc(C(C)C)c32)cc1 ZINC000556590146 942908469 /nfs/dbraw/zinc/90/84/69/942908469.db2.gz ZKMPIRRJBOEDRB-HXUWFJFHSA-N 0 3 422.529 4.265 20 0 HIADHN COC(=O)c1ccc(CN[C@@H]2CCO[C@@H](c3ccccc3)C2)c(Br)c1 ZINC000556603364 942912259 /nfs/dbraw/zinc/91/22/59/942912259.db2.gz IWYXOIFCXKBKMZ-IEBWSBKVSA-N 0 3 404.304 4.246 20 0 HIADHN C[C@H](NCc1cccc(N2C(=O)N[C@@](C)(C3CC3)C2=O)c1)c1ccc2c(c1)CCC2 ZINC000556607259 942913138 /nfs/dbraw/zinc/91/31/38/942913138.db2.gz BUMINLNBZFPQBI-LMKMVOKYSA-N 0 3 403.526 4.251 20 0 HIADHN Cc1nc2cc(F)ccc2cc1C(=O)N1CCN(c2ccnc3ccccc32)CC1 ZINC000556832631 942937557 /nfs/dbraw/zinc/93/75/57/942937557.db2.gz HFYHCBOGIQCPEX-UHFFFAOYSA-N 0 3 400.457 4.193 20 0 HIADHN CC(C)c1ccc([C@H](NC[C@@H](O)CN2C[C@@H](C)O[C@H](C)C2)c2cccs2)cc1 ZINC000556853787 942941311 /nfs/dbraw/zinc/94/13/11/942941311.db2.gz NXPUWPIVVHOGSL-PGCKSFNISA-N 0 3 402.604 4.021 20 0 HIADHN Cn1cccc1[C@@H]1CCCCN1C(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000556891048 942953344 /nfs/dbraw/zinc/95/33/44/942953344.db2.gz CBFUKVXBHZRZBK-CTNGQTDRSA-N 0 3 401.501 4.236 20 0 HIADHN C[C@H](Cn1ccc2ccccc21)C(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000556922406 942967296 /nfs/dbraw/zinc/96/72/96/942967296.db2.gz KLPVEJUJKYICTD-NJYVYQBISA-N 0 3 411.590 4.015 20 0 HIADHN C[C@@H](Cn1ccc2ccccc21)C(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000556922408 942967510 /nfs/dbraw/zinc/96/75/10/942967510.db2.gz KLPVEJUJKYICTD-PCCBWWKXSA-N 0 3 411.590 4.015 20 0 HIADHN CN(CCCN(C)C(=O)c1ccc(Sc2ccccn2)cc1)Cc1ccncc1 ZINC000556932890 942971305 /nfs/dbraw/zinc/97/13/05/942971305.db2.gz DTAJGJKSCCDWGZ-UHFFFAOYSA-N 0 3 406.555 4.222 20 0 HIADHN O=C(N[C@H](c1ccccc1)[C@H]1CCOC1)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000556951464 942978213 /nfs/dbraw/zinc/97/82/13/942978213.db2.gz PCLFIGJTHPLIOS-FDFHNCONSA-N 0 3 414.496 4.038 20 0 HIADHN Cc1cc(C)c(C(=O)CCCC(=O)Nc2cccc(CN3CC[C@@H](O)C3)c2)c(C)c1 ZINC000557025352 942997965 /nfs/dbraw/zinc/99/79/65/942997965.db2.gz PAQWXUBFBZTIDK-JOCHJYFZSA-N 0 3 408.542 4.170 20 0 HIADHN CO[C@@H]1CCCC[C@H]1C(=O)N(Cc1ccccc1Br)C1CCN(C)CC1 ZINC000557160038 943035331 /nfs/dbraw/zinc/03/53/31/943035331.db2.gz HQGBEUILSFTRPD-UYAOXDASSA-N 0 3 423.395 4.077 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)c2ccc(Sc3ccccn3)cc2)cc1 ZINC000557206657 943050816 /nfs/dbraw/zinc/05/08/16/943050816.db2.gz VWIUEQGPYGBGRF-OAQYLSRUSA-N 0 3 407.539 4.274 20 0 HIADHN Cc1nn(-c2ccccc2)cc1CCCN[C@H](C)c1nnn(-c2ccccc2)c1C ZINC000557246778 943060307 /nfs/dbraw/zinc/06/03/07/943060307.db2.gz JHUPENFCIATHJL-LJQANCHMSA-N 0 3 400.530 4.353 20 0 HIADHN COc1ccc2c(c1)OC[C@H](N[C@@H](C)c1ccc(S(=O)(=O)C3CCCC3)cc1)C2 ZINC000557266446 943064313 /nfs/dbraw/zinc/06/43/13/943064313.db2.gz RCGNIGAHQGSPKC-QFBILLFUSA-N 0 3 415.555 4.066 20 0 HIADHN O=C(COC1CCCC1)N(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000557448979 943132437 /nfs/dbraw/zinc/13/24/37/943132437.db2.gz NDJOABNLGUFCNE-HSZRJFAPSA-N 0 3 407.558 4.034 20 0 HIADHN O=C(Cc1ccc(F)cc1)N(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000557448570 943132681 /nfs/dbraw/zinc/13/26/81/943132681.db2.gz MDMDPCPDEXONQI-RUZDIDTESA-N 0 3 417.528 4.457 20 0 HIADHN CN(C)C[C@@H](NC(=O)c1cnc(-c2ccc(F)c(F)c2)s1)c1ccc(F)cc1 ZINC000557487252 943162324 /nfs/dbraw/zinc/16/23/24/943162324.db2.gz UEQOSPDQIVVMJI-QGZVFWFLSA-N 0 3 405.445 4.260 20 0 HIADHN C[C@]1(CNCc2cnn(-c3ccc(Br)cc3)c2)OCCc2sccc21 ZINC000557528412 943191990 /nfs/dbraw/zinc/19/19/90/943191990.db2.gz AENXJJJGCZRYBV-LJQANCHMSA-N 0 3 418.360 4.274 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)CSc1nnc(-c2ccc(Cl)cc2)o1 ZINC000557634405 943241154 /nfs/dbraw/zinc/24/11/54/943241154.db2.gz CFVHFNREOLCQQI-UHFFFAOYSA-N 0 3 422.982 4.207 20 0 HIADHN CC1CCN([C@H](CNC(=O)N2CCC=C(c3ccncc3)C2)c2cccs2)CC1 ZINC000557751512 943279024 /nfs/dbraw/zinc/27/90/24/943279024.db2.gz RQYBKZMBNPJDKW-OAQYLSRUSA-N 0 3 410.587 4.415 20 0 HIADHN Cc1ccc(NC(=O)C2CC2)cc1NC(=O)N[C@H]1CCN(Cc2ccccc2)[C@@H]1C ZINC000557885827 943321071 /nfs/dbraw/zinc/32/10/71/943321071.db2.gz VQLSARQVHZIUMS-UTKZUKDTSA-N 0 3 406.530 4.128 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)c1cccc(C(=O)N(C)CC(C)(C)C)c1)c1ccco1 ZINC000557916816 943328372 /nfs/dbraw/zinc/32/83/72/943328372.db2.gz SDFYPMJZBLXLIC-FXAWDEMLSA-N 0 3 413.562 4.257 20 0 HIADHN CN(C)C[C@H](NC(=O)c1cccc(-n2nccc2C(F)(F)F)c1)c1ccc(F)cc1 ZINC000557955757 943339747 /nfs/dbraw/zinc/33/97/47/943339747.db2.gz QQAHGUGLBKRMJF-SFHVURJKSA-N 0 3 420.410 4.063 20 0 HIADHN COc1cc(C(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)ccc1OC(C)C ZINC000557956343 943339778 /nfs/dbraw/zinc/33/97/78/943339778.db2.gz FMASOBFAPRTJQN-OAQYLSRUSA-N 0 3 414.546 4.302 20 0 HIADHN Cc1nn(Cc2ccc(Cl)cc2)c(C)c1C(=O)N1CCN([C@@H]2C[C@H]2C)C[C@H](C)C1 ZINC000558013140 943354900 /nfs/dbraw/zinc/35/49/00/943354900.db2.gz SVHZBRMSDHVOJA-GCKMJXCFSA-N 0 3 414.981 4.004 20 0 HIADHN C[C@H]1C[C@H]1N1CCN(C(=O)CCC(=O)c2cc(Cl)sc2Cl)C[C@@H](C)C1 ZINC000558025777 943359766 /nfs/dbraw/zinc/35/97/66/943359766.db2.gz PDMVSNDCDWXCDJ-SGMGOOAPSA-N 0 3 403.375 4.207 20 0 HIADHN CC(=O)c1cccc(OC[C@@H](O)CN2CCC(c3c[nH]c4ccc(F)cc43)CC2)c1 ZINC000558177341 943412488 /nfs/dbraw/zinc/41/24/88/943412488.db2.gz UMQYGQJTKUGJML-FQEVSTJZSA-N 0 3 410.489 4.129 20 0 HIADHN Cc1cc(Oc2ncccn2)ccc1NC(=O)N[C@@H]1CCN(Cc2ccccc2)[C@H]1C ZINC000558194532 943427548 /nfs/dbraw/zinc/42/75/48/943427548.db2.gz YRGBXYLWORBLQH-PGRDOPGGSA-N 0 3 417.513 4.362 20 0 HIADHN CCN(C(=O)Nc1cc2[nH]ccc2c(C(=O)OC)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000558202507 943430385 /nfs/dbraw/zinc/43/03/85/943430385.db2.gz HQHVZHITRAZCPS-LJQANCHMSA-N 0 3 420.513 4.083 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)Nc2cc3c(cc2Cl)OCO3)N(C)C)cc1 ZINC000558246944 943455995 /nfs/dbraw/zinc/45/59/95/943455995.db2.gz POURFWRLENIAAE-GOSISDBHSA-N 0 3 419.909 4.280 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)N[C@@H]1CC[C@@H](c2ccccc2)C[C@@H]1OC ZINC000558278366 943478378 /nfs/dbraw/zinc/47/83/78/943478378.db2.gz PEAGLYPIJCLSFA-VIZSFHNOSA-N 0 3 411.546 4.230 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1cc(NC(=O)C(C)C)ccc1C)c1ccco1 ZINC000558310895 943498701 /nfs/dbraw/zinc/49/87/01/943498701.db2.gz GSCZVWHTQZIJOW-QFBILLFUSA-N 0 3 400.523 4.433 20 0 HIADHN CCOCCOc1ccc(Cl)cc1NC(=O)N[C@@H](CN(C)C)c1ccc(F)cc1 ZINC000558321050 943505581 /nfs/dbraw/zinc/50/55/81/943505581.db2.gz AUMASPFKFVPMAM-IBGZPJMESA-N 0 3 423.916 4.319 20 0 HIADHN COC(=O)c1ccc(CN[C@H]2CCCc3c4cc(Br)ccc4[nH]c32)[nH]1 ZINC000558425005 943556984 /nfs/dbraw/zinc/55/69/84/943556984.db2.gz MDUJKMQLZSKPOF-INIZCTEOSA-N 0 3 402.292 4.212 20 0 HIADHN CN1CC[C@H](NCC(=O)Nc2ccccc2C(F)(F)F)[C@@H]1c1ccc(Cl)cc1 ZINC000558467128 943567284 /nfs/dbraw/zinc/56/72/84/943567284.db2.gz OFFDPHZGRLSFMT-HKUYNNGSSA-N 0 3 411.855 4.332 20 0 HIADHN C[C@H](N[C@@H]1CCN(C)[C@H]1c1ccc(Cl)cc1)C(=O)Nc1cccc2ncccc21 ZINC000558467556 943567516 /nfs/dbraw/zinc/56/75/16/943567516.db2.gz SGZKOYHQXYJKSR-ARBPTSGCSA-N 0 3 408.933 4.250 20 0 HIADHN Cc1nnc(CCNCc2cn(-c3ccc(Br)cc3)nc2C(C)C)s1 ZINC000558479865 943570369 /nfs/dbraw/zinc/57/03/69/943570369.db2.gz CEVKISLVANRGJL-UHFFFAOYSA-N 0 3 420.380 4.250 20 0 HIADHN CNS(=O)(=O)c1ccc([C@H](C)N[C@H](Cc2ccccc2)c2ccc(OC)cc2)cc1 ZINC000558505689 943579291 /nfs/dbraw/zinc/57/92/91/943579291.db2.gz NKQJGHUVIAWETR-MHECFPHRSA-N 0 3 424.566 4.238 20 0 HIADHN Cc1cc(NC(=O)c2cn(C)c3ccccc23)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000558531409 943589790 /nfs/dbraw/zinc/58/97/90/943589790.db2.gz CHNJQBZNRPOWLK-FQEVSTJZSA-N 0 3 413.525 4.383 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)N[C@H]1c2ccccc2CC12CCOCC2 ZINC000558606395 943616338 /nfs/dbraw/zinc/61/63/38/943616338.db2.gz FHKZMGFZKJNGOA-ZEQRLZLVSA-N 0 3 419.569 4.217 20 0 HIADHN Cc1cccc(C(=O)N(Cc2ccccc2Br)C2CCN(C)CC2)c1 ZINC000558610212 943616761 /nfs/dbraw/zinc/61/67/61/943616761.db2.gz PSIBPCGHXBUTFV-UHFFFAOYSA-N 0 3 401.348 4.494 20 0 HIADHN O=C(N1CCC(C2CCOCC2)CC1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000558636797 943622196 /nfs/dbraw/zinc/62/21/96/943622196.db2.gz ADRYQJFULBWXPX-JOCHJYFZSA-N 0 3 424.507 4.106 20 0 HIADHN CCC(CC)[C@@H](NC(=O)N1CC[C@@H](N2CCN(C(C)C)CC2)C1)c1cccs1 ZINC000558694545 943629770 /nfs/dbraw/zinc/62/97/70/943629770.db2.gz FBZOHRXJKCGNRE-TZIWHRDSSA-N 0 3 406.640 4.035 20 0 HIADHN C[C@@H](c1cccc(NC(=O)c2ccccc2)c1)N1CCC[C@@H](c2nc(N(C)C)no2)C1 ZINC000558743640 943637976 /nfs/dbraw/zinc/63/79/76/943637976.db2.gz VYFBNXJCULVEMY-FXAWDEMLSA-N 0 3 419.529 4.329 20 0 HIADHN COCCCn1nccc1CN[C@H]1CCN(C(C)C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000558781068 943661342 /nfs/dbraw/zinc/66/13/42/943661342.db2.gz KDGWKMQXCGLOJG-LEWJYISDSA-N 0 3 408.949 4.026 20 0 HIADHN CCc1cccc(C)c1NC(=O)CN[C@@H]1CCN(C2CC2)[C@H]1c1cccc(OC)c1 ZINC000558902615 943737450 /nfs/dbraw/zinc/73/74/50/943737450.db2.gz SAWDISOOEJYHJM-RDGATRHJSA-N 0 3 407.558 4.072 20 0 HIADHN C[C@H](NC(=O)N[C@H](CN(C)C)c1ccc(Cl)cc1)c1ccccc1-n1cccn1 ZINC000558914242 943744103 /nfs/dbraw/zinc/74/41/03/943744103.db2.gz PSRRMZKBUKYTLG-OXJNMPFZSA-N 0 3 411.937 4.189 20 0 HIADHN CN(C)C[C@H](NC(=O)NCc1cccc(OCC(F)F)c1)c1ccc(Cl)cc1 ZINC000558941182 943762619 /nfs/dbraw/zinc/76/26/19/943762619.db2.gz SGDRRBUFVZWBSI-SFHVURJKSA-N 0 3 411.880 4.086 20 0 HIADHN COCCOc1ccc(C(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)c(Cl)c1 ZINC000558973555 943777923 /nfs/dbraw/zinc/77/79/23/943777923.db2.gz SZPHIZKVVDFRSA-LJQANCHMSA-N 0 3 411.329 4.051 20 0 HIADHN CCOC(=O)[C@H]1CC[C@@H](Nc2ccccc2N2CCN(CC)CC2)c2ccccc21 ZINC000558975737 943779175 /nfs/dbraw/zinc/77/91/75/943779175.db2.gz ARHNXESFQKKPFB-FCHUYYIVSA-N 0 3 407.558 4.422 20 0 HIADHN Cc1ccccc1NC(=O)CC[NH+]1CCC(C(=O)Nc2cc(Cl)ccc2[O-])CC1 ZINC000559066149 943821260 /nfs/dbraw/zinc/82/12/60/943821260.db2.gz XIPNTRJBFXHEJF-UHFFFAOYSA-N 0 3 415.921 4.033 20 0 HIADHN COCC(=O)Nc1cccc(CN[C@H]2CCc3cc(Br)cc(C)c32)c1 ZINC000559075568 943827324 /nfs/dbraw/zinc/82/73/24/943827324.db2.gz OOJSDIBQLVSRMV-SFHVURJKSA-N 0 3 403.320 4.120 20 0 HIADHN CC(C)Cn1c([C@@H]2OCC[C@@H]2C)nnc1N1CCN(Cc2ccccc2)C(C)(C)C1 ZINC000559080606 943829770 /nfs/dbraw/zinc/82/97/70/943829770.db2.gz GZVWPAHUVSFAAA-PZJWPPBQSA-N 0 3 411.594 4.132 20 0 HIADHN C[C@H](N[C@H](CN1CCN(C)CC1)c1ccccc1)c1cc(Br)cs1 ZINC000559087064 943832166 /nfs/dbraw/zinc/83/21/66/943832166.db2.gz OAOGSVBDAPQNIB-MAUKXSAKSA-N 0 3 408.409 4.150 20 0 HIADHN CC[C@@H]1CN(c2nnc([C@@H]3OCC[C@@H]3C)n2CC(C)C)CCN1Cc1ccccc1 ZINC000559087460 943833102 /nfs/dbraw/zinc/83/31/02/943833102.db2.gz GKFFKIWTUOBVFU-KSEOMHKRSA-N 0 3 411.594 4.132 20 0 HIADHN C[C@H](Cc1cnc2ccccc2n1)C(=O)NC[C@@H](c1ccccc1)N1CCC(C)CC1 ZINC000559149915 943854252 /nfs/dbraw/zinc/85/42/52/943854252.db2.gz PXGBBUMDFVFKLK-NLFFAJNJSA-N 0 3 416.569 4.398 20 0 HIADHN CN(C)Cc1ccc(-c2noc([C@H]3CC(=O)N(C)[C@H]3c3cccc(Cl)c3)n2)cc1 ZINC000559740060 944042944 /nfs/dbraw/zinc/04/29/44/944042944.db2.gz RUTROAAUBIOZLW-ICSRJNTNSA-N 0 3 410.905 4.139 20 0 HIADHN CN1CCC[C@@H](CNC(=O)c2ncoc2C2CC2)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000559908194 944081775 /nfs/dbraw/zinc/08/17/75/944081775.db2.gz IWFKVROXEPQDSN-YJBOKZPZSA-N 0 3 407.436 4.384 20 0 HIADHN CCC[C@H](C)N1Cc2cccc([N-]S(=O)(=O)c3ccc(C[NH+](C)C)cc3)c2C1 ZINC000559961282 944100566 /nfs/dbraw/zinc/10/05/66/944100566.db2.gz SMMDPIMHDYCCGR-KRWDZBQOSA-N 0 3 401.576 4.053 20 0 HIADHN Cc1ccc(C=Cc2nc(SC[C@H]3CN(Cc4ccccc4)CCCO3)n[nH]2)o1 ZINC000559976576 944106917 /nfs/dbraw/zinc/10/69/17/944106917.db2.gz CMWKCDGOVZGKNL-CTDFXDFQSA-N 0 3 410.543 4.260 20 0 HIADHN COC(=O)[C@H](Cc1ccccc1)[C@H](C)N[C@@H](C)C(=O)Nc1ccc(Cl)cc1Cl ZINC000560178521 944188307 /nfs/dbraw/zinc/18/83/07/944188307.db2.gz QIXYQUXQSARDGL-GRDNDAEWSA-N 0 3 423.340 4.330 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)[C@H](C)Cc2ccc(Br)cc2)cc1 ZINC000560248165 944206870 /nfs/dbraw/zinc/20/68/70/944206870.db2.gz CGVCWBIQHISFNV-FOIQADDNSA-N 0 3 419.363 4.055 20 0 HIADHN COc1ccc2c(c1)[C@H](NCc1cccc(N3C(=O)N[C@@](C)(C4CC4)C3=O)c1)CCC2 ZINC000560266031 944212568 /nfs/dbraw/zinc/21/25/68/944212568.db2.gz UVLIPBGMUXMPFZ-RDGATRHJSA-N 0 3 419.525 4.087 20 0 HIADHN C[C@@H](N[C@@H](c1cncc(Br)c1)C1CC1)c1cccc(N2CCOCC2)c1 ZINC000560269711 944214275 /nfs/dbraw/zinc/21/42/75/944214275.db2.gz XNSMAVXUWQTSEP-QVKFZJNVSA-N 0 3 416.363 4.483 20 0 HIADHN CC(C)Cc1cccc([C@H](C)NCc2cccc(NC(=O)CCN3CCOCC3)c2)c1 ZINC000560522032 944241364 /nfs/dbraw/zinc/24/13/64/944241364.db2.gz QZTKODPWWKHTCM-NRFANRHFSA-N 0 3 423.601 4.397 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)CN[C@@H]1CC[C@@H](c2ccccc2)C[C@H]1OC ZINC000560540851 944247976 /nfs/dbraw/zinc/24/79/76/944247976.db2.gz ZIGBEJRJDBNCIA-HGHGUNKESA-N 0 3 402.922 4.228 20 0 HIADHN CCC[C@@H](C)C(=O)NCCNCc1cnc(-c2ccc(Br)cc2)s1 ZINC000560556248 944253769 /nfs/dbraw/zinc/25/37/69/944253769.db2.gz HTKBWFIALHVWTF-CYBMUJFWSA-N 0 3 410.381 4.215 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O[C@@H]3CCOC3)CC2)c1)c1ccccc1Cl ZINC000560560927 944254807 /nfs/dbraw/zinc/25/48/07/944254807.db2.gz FSGLQSOSGWWEDI-HXUWFJFHSA-N 0 3 414.933 4.362 20 0 HIADHN C[C@@H](Oc1ccc(-c2ccccc2)cc1)C(=O)Nc1cccc(CN2CC[C@@H](O)C2)c1 ZINC000560675480 944289928 /nfs/dbraw/zinc/28/99/28/944289928.db2.gz LXYZFDDTQFQDKY-NTKDMRAZSA-N 0 3 416.521 4.326 20 0 HIADHN O[C@@H](CNCc1cc(F)cc(Br)c1)COc1cccc(C(F)(F)F)c1 ZINC000560857944 944360336 /nfs/dbraw/zinc/36/03/36/944360336.db2.gz NHCPIFKPMICYGP-HNNXBMFYSA-N 0 3 422.216 4.137 20 0 HIADHN CCCN(C)[C@H](CNC(=O)c1cnn(C2CCOCC2)c1C)c1ccc(Cl)cc1 ZINC000560973113 944382246 /nfs/dbraw/zinc/38/22/46/944382246.db2.gz AVXPIUUWCKAXEO-OAQYLSRUSA-N 0 3 418.969 4.009 20 0 HIADHN COc1ccc(OC)c(-c2csc(NC(=O)[C@@H]3CCN(Cc4ccccc4)C3)n2)c1 ZINC000561091838 944443323 /nfs/dbraw/zinc/44/33/23/944443323.db2.gz MBUBABCVXYOUHT-QGZVFWFLSA-N 0 3 423.538 4.288 20 0 HIADHN CC(C)N(C)c1cccc(NC(=O)NCCCN2CCN(C)C[C@H]2c2ccccc2)c1 ZINC000561344807 944557941 /nfs/dbraw/zinc/55/79/41/944557941.db2.gz ZLGBDXHFTLRWLY-DEOSSOPVSA-N 0 3 423.605 4.032 20 0 HIADHN CSc1ccc([C@@H](CNC(=O)CCc2ccc(OC(F)F)cc2)N(C)C)cc1 ZINC000561381542 944569330 /nfs/dbraw/zinc/56/93/30/944569330.db2.gz SKRAORCGLMKRAR-LJQANCHMSA-N 0 3 408.514 4.362 20 0 HIADHN COc1ccc([C@@H](C)NCCCC(=O)N2Cc3ccccc3C2)c(Br)c1 ZINC000561480070 944624195 /nfs/dbraw/zinc/62/41/95/944624195.db2.gz RKPXXXGFZSZRTR-OAHLLOKOSA-N 0 3 417.347 4.431 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)[C@H]2C[C@H]2c2cc(F)c(F)c(F)c2)N(C)C)cc1 ZINC000561650632 944729090 /nfs/dbraw/zinc/72/90/90/944729090.db2.gz JNXKCVSBDVRYLV-WFXMLNOXSA-N 0 3 420.475 4.414 20 0 HIADHN Cc1nn(CC(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)cc1-c1ccccc1 ZINC000561657863 944732610 /nfs/dbraw/zinc/73/26/10/944732610.db2.gz QWMHDYCUHLVLMJ-DEOSSOPVSA-N 0 3 420.557 4.065 20 0 HIADHN C[C@H]1C[C@H]1N1CCN(C(=O)c2cc(Br)cc(C(F)(F)F)c2)C[C@@H](C)C1 ZINC000561764162 944784856 /nfs/dbraw/zinc/78/48/56/944784856.db2.gz GMVCEIJXDWURCW-MQIPJXDCSA-N 0 3 419.285 4.270 20 0 HIADHN C[C@@H]1C[C@@H]1N1CCN(C(=O)c2cc(Br)cc(C(F)(F)F)c2)C[C@@H](C)C1 ZINC000561764163 944785572 /nfs/dbraw/zinc/78/55/72/944785572.db2.gz GMVCEIJXDWURCW-OZVIIMIRSA-N 0 3 419.285 4.270 20 0 HIADHN CC[C@@H](N[C@@H]1CCc2c1ccc(OC)c2F)c1ccccc1OCC(=O)N(C)C ZINC000561772135 944789363 /nfs/dbraw/zinc/78/93/63/944789363.db2.gz LQSINLAHWFDUED-RTBURBONSA-N 0 3 400.494 4.030 20 0 HIADHN CCS(=O)(=O)N1CCC([C@H](C)N(C)Cc2nc3ccccc3c(C)c2Cl)CC1 ZINC000561786204 944796760 /nfs/dbraw/zinc/79/67/60/944796760.db2.gz UJGLEWBUFHKMBE-INIZCTEOSA-N 0 3 424.010 4.079 20 0 HIADHN Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)N[C@H]1CCN(Cc2ccccc2)[C@@H]1C ZINC000561798795 944801318 /nfs/dbraw/zinc/80/13/18/944801318.db2.gz HGGCIDZAJQRIKB-XXBNENTESA-N 0 3 420.557 4.016 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)Nc1ccc(Oc2cccnc2)cc1 ZINC000561820787 944811705 /nfs/dbraw/zinc/81/17/05/944811705.db2.gz WVGMDWYVAZAFFV-UHFFFAOYSA-N 0 3 402.498 4.444 20 0 HIADHN C[C@H](NC(=O)NC[C@H](c1ccccc1)N1CCCC1)c1nccn1-c1ccccc1 ZINC000561995828 944889290 /nfs/dbraw/zinc/88/92/90/944889290.db2.gz PQPPKFXXBYTIFL-SIKLNZKXSA-N 0 3 403.530 4.070 20 0 HIADHN Cc1c([C@@H](C)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)nnn1-c1ccccc1 ZINC000562056608 944914628 /nfs/dbraw/zinc/91/46/28/944914628.db2.gz BLSXRYSZONUKBC-WZONZLPQSA-N 0 3 407.562 4.316 20 0 HIADHN Cc1c([C@H](C)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)nnn1-c1ccccc1 ZINC000562056607 944914951 /nfs/dbraw/zinc/91/49/51/944914951.db2.gz BLSXRYSZONUKBC-MBSDFSHPSA-N 0 3 407.562 4.316 20 0 HIADHN O=C1[C@H](N[C@@H]2c3ccccc3CC23CCOCC3)CCN1c1ccc(Cl)c(F)c1 ZINC000562071096 944922066 /nfs/dbraw/zinc/92/20/66/944922066.db2.gz UHPJSCLJYIOVPO-NHCUHLMSSA-N 0 3 414.908 4.268 20 0 HIADHN COc1ccc([C@@H](Cc2ccccc2)NCc2cnc(N3CCOCC3)s2)cc1 ZINC000562083221 944929270 /nfs/dbraw/zinc/92/92/70/944929270.db2.gz GVSYHPQNPMPZDK-JOCHJYFZSA-N 0 3 409.555 4.062 20 0 HIADHN Cc1cc(NC(=O)N[C@H](CN(C)C)c2ccc(F)cc2)ccc1NC(=O)c1ccco1 ZINC000562125067 944956670 /nfs/dbraw/zinc/95/66/70/944956670.db2.gz RPKMAACAKKHERW-HXUWFJFHSA-N 0 3 424.476 4.404 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)Nc2cccc(N3CCCC3)c2)N(C)C)cc1 ZINC000562128069 944958728 /nfs/dbraw/zinc/95/87/28/944958728.db2.gz OFJGIJLWNWOXMC-QHCPKHFHSA-N 0 3 410.562 4.498 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1nc2c(cccc2COC)s1)c1ccco1 ZINC000562171056 945000818 /nfs/dbraw/zinc/00/08/18/945000818.db2.gz HGGBSGASBYDEKH-DZGCQCFKSA-N 0 3 402.520 4.287 20 0 HIADHN C[C@H](NC(=O)NCc1cccc(COCc2ccco2)c1)[C@@H](c1ccccc1)N(C)C ZINC000562248028 945042693 /nfs/dbraw/zinc/04/26/93/945042693.db2.gz JKJOKBHBGQATKO-CYFREDJKSA-N 0 3 421.541 4.487 20 0 HIADHN COc1ccc2ccccc2c1-c1cc(CN[C@@H](CC(N)=O)C2CCCCC2)on1 ZINC000564130063 945393624 /nfs/dbraw/zinc/39/36/24/945393624.db2.gz WDNCOFGXVUZRKG-FQEVSTJZSA-N 0 3 407.514 4.417 20 0 HIADHN CCc1nnc(-c2ccc(NC(=O)N[C@H]3CCN(Cc4ccccc4)[C@H]3C)cc2)o1 ZINC000564165764 945411495 /nfs/dbraw/zinc/41/14/95/945411495.db2.gz NSAVMZHULBGTDX-JXFKEZNVSA-N 0 3 405.502 4.084 20 0 HIADHN COc1cc(Br)c(CN2C[C@H](c3ccccc3)[C@H]3COCC[C@@H]32)cc1O ZINC000564307135 945508754 /nfs/dbraw/zinc/50/87/54/945508754.db2.gz BEXSCLHUIXGFTJ-LMMKCTJWSA-N 0 3 418.331 4.168 20 0 HIADHN C[C@H](N[C@@H]1CCN(C)[C@@H]1c1ccc(Cl)c(F)c1)C(=O)Nc1ccc(F)cc1F ZINC000564400092 945557003 /nfs/dbraw/zinc/55/70/03/945557003.db2.gz XHQFJVCDRHPXOI-ZKWAXGPOSA-N 0 3 411.855 4.119 20 0 HIADHN COc1ccc([C@@H](C)N[C@H]2CCCN(Cc3ccc(F)cc3F)C2=O)c(C)c1OC ZINC000564478414 945612446 /nfs/dbraw/zinc/61/24/46/945612446.db2.gz UCICJROCKAIWGQ-QRWLVFNGSA-N 0 3 418.484 4.132 20 0 HIADHN Cc1ccccc1-n1ncc(C(=O)N(C)CCCN(C)Cc2ccncc2)c1C(C)C ZINC000565271370 945799538 /nfs/dbraw/zinc/79/95/38/945799538.db2.gz IQZGURBBSLKSKG-UHFFFAOYSA-N 0 3 419.573 4.293 20 0 HIADHN Cc1n[nH]cc1C1CCN(C[C@H](O)COc2cc(C)c(Cl)cc2C(C)C)CC1 ZINC000565377284 945819278 /nfs/dbraw/zinc/81/92/78/945819278.db2.gz DPMACRGDSFABFS-SFHVURJKSA-N 0 3 405.970 4.423 20 0 HIADHN CN1CCC(N(Cc2ccccc2Br)C(=O)c2cccc(F)c2)CC1 ZINC000565395890 945825287 /nfs/dbraw/zinc/82/52/87/945825287.db2.gz TYVWMQOTBYZYBG-UHFFFAOYSA-N 0 3 405.311 4.325 20 0 HIADHN CCCC[C@@H](N[C@@H]1CCCc2ccc(S(N)(=O)=O)cc21)c1ccc(OC)cc1 ZINC000565450168 945833685 /nfs/dbraw/zinc/83/36/85/945833685.db2.gz LAAMRBXQUBAKAR-FGZHOGPDSA-N 0 3 402.560 4.241 20 0 HIADHN C[C@@H](c1nc(Cc2ccc(Cl)cc2)no1)N(C)CCCN(C)Cc1ccco1 ZINC000565614763 945855481 /nfs/dbraw/zinc/85/54/81/945855481.db2.gz OSNDXCCJXWBVQH-INIZCTEOSA-N 0 3 402.926 4.422 20 0 HIADHN CC(C)(C)[C@@H](Cc1ccccc1C(F)(F)F)NCc1cn(Cc2cccnc2)nn1 ZINC000565628537 945858212 /nfs/dbraw/zinc/85/82/12/945858212.db2.gz ZEBZPCRHPQWSCB-HXUWFJFHSA-N 0 3 417.479 4.487 20 0 HIADHN C[C@H]1[C@H](NC(=O)Nc2ccccc2C(=O)N2CCCCC2)CCN1Cc1ccccc1 ZINC000565794453 945884533 /nfs/dbraw/zinc/88/45/33/945884533.db2.gz LHXUIZZKQKJXMU-SIKLNZKXSA-N 0 3 420.557 4.097 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)c1cn(CC)nc1C(F)(F)F)c1ccc(Cl)cc1 ZINC000565849558 945893405 /nfs/dbraw/zinc/89/34/05/945893405.db2.gz GCKCERGJJYPXOL-INIZCTEOSA-N 0 3 416.875 4.388 20 0 HIADHN C/C(=C\c1cccc(C(F)(F)F)c1)CN(C)[C@@H](C)c1cccc(S(N)(=O)=O)c1 ZINC000566587838 946050533 /nfs/dbraw/zinc/05/05/33/946050533.db2.gz KTSGYMSOKSWZAR-IPJDOKCGSA-N 0 3 412.477 4.449 20 0 HIADHN CCc1ccccc1OCCC(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000566611585 946055479 /nfs/dbraw/zinc/05/54/79/946055479.db2.gz OEGNGHCKOQACLZ-QFIPXVFZSA-N 0 3 418.541 4.300 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)c1ccc(C)c(NC(=O)c2ccco2)c1)c1ccco1 ZINC000566758016 946090278 /nfs/dbraw/zinc/09/02/78/946090278.db2.gz YXHDBIBBKIEQLK-LPHOPBHVSA-N 0 3 409.486 4.293 20 0 HIADHN O=C(CCC(F)(F)F)N1CCC[C@@H](NCc2cnc(-c3ccsc3)s2)C1 ZINC000566820502 946114659 /nfs/dbraw/zinc/11/46/59/946114659.db2.gz PFPVZSNGGNUUAP-CYBMUJFWSA-N 0 3 403.495 4.295 20 0 HIADHN CSc1ccc([C@H](CNC(=O)CCc2ncc(-c3ccccc3)o2)N(C)C)cc1 ZINC000566937253 946173383 /nfs/dbraw/zinc/17/33/83/946173383.db2.gz SHJTZCRUJULANT-FQEVSTJZSA-N 0 3 409.555 4.415 20 0 HIADHN CCN(CC)C(=O)Nc1ccc([C@H](C)NCc2ccc(Cn3cncn3)cc2)cc1 ZINC000566944595 946183735 /nfs/dbraw/zinc/18/37/35/946183735.db2.gz VBCREVPWHGNTPQ-SFHVURJKSA-N 0 3 406.534 4.051 20 0 HIADHN Cc1ccc(CCC(=O)NC2CCN(CCOc3ccc(Cl)cc3)CC2)s1 ZINC000567003084 946212404 /nfs/dbraw/zinc/21/24/04/946212404.db2.gz CEPFAMZYLCBHRS-UHFFFAOYSA-N 0 3 406.979 4.302 20 0 HIADHN COC(=O)c1c(F)ccc(NC(=O)N[C@H](CN(C)Cc2ccccc2)C(C)C)c1F ZINC000567089409 946239173 /nfs/dbraw/zinc/23/91/73/946239173.db2.gz VSUGMGICDPDJIY-GOSISDBHSA-N 0 3 419.472 4.030 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CNC[C@H](O)COc1cccc2ccccc21 ZINC000567153784 946257278 /nfs/dbraw/zinc/25/72/78/946257278.db2.gz LVCLPHGORRNYFE-QHCPKHFHSA-N 0 3 415.537 4.231 20 0 HIADHN CCn1ncc2ccc(NC(=O)NC[C@@H](c3ccc(OC(C)C)cc3)N(C)C)cc21 ZINC000567261580 946282153 /nfs/dbraw/zinc/28/21/53/946282153.db2.gz XEJQBCFAAPMAOM-QFIPXVFZSA-N 0 3 409.534 4.268 20 0 HIADHN Cc1nc(CCC(=O)N[C@@H]2CCN(Cc3ccccc3)[C@@H]2C)oc1-c1ccccc1 ZINC000567304373 946303362 /nfs/dbraw/zinc/30/33/62/946303362.db2.gz YCEKEQRUWYRGNX-DENIHFKCSA-N 0 3 403.526 4.362 20 0 HIADHN Cc1cc(F)ccc1-c1nc(C(C)(C)C(=O)N[C@@H](C)C2=CCN(C)CC2)cs1 ZINC000567553715 946375517 /nfs/dbraw/zinc/37/55/17/946375517.db2.gz AYXNWEIYOOKQAM-HNNXBMFYSA-N 0 3 401.551 4.302 20 0 HIADHN Cc1ccccc1[C@@H](CC(F)(F)F)NC(=O)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000567604517 946383242 /nfs/dbraw/zinc/38/32/42/946383242.db2.gz XUKFSQGTHPSUSG-AZUAARDMSA-N 0 3 405.464 4.412 20 0 HIADHN COc1ccc([C@H](CNC(=O)CN(C)[C@H](C)C2CC2)c2c[nH]c3ccccc32)cc1 ZINC000567718812 946400393 /nfs/dbraw/zinc/40/03/93/946400393.db2.gz UMOVYCDLPONFCZ-VGSWGCGISA-N 0 3 405.542 4.155 20 0 HIADHN O=c1ccc2c([nH]1)CCC[C@@H]2NCc1cnn(Cc2ccc(C(F)(F)F)cc2)c1 ZINC000567793224 946413769 /nfs/dbraw/zinc/41/37/69/946413769.db2.gz GUHDUIMWYGIVRH-SFHVURJKSA-N 0 3 402.420 4.218 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)CCc1nnc(-c2cc3ccccc3o2)o1)c1ccco1 ZINC000568313551 946500444 /nfs/dbraw/zinc/50/04/44/946500444.db2.gz RFDQDDYXBMFJGQ-DOTOQJQBSA-N 0 3 422.485 4.254 20 0 HIADHN C[C@H](C(=O)NCCC1=CCCCC1)N(C)CCCc1cc(-c2cccc(F)c2)n[nH]1 ZINC000568545260 946586888 /nfs/dbraw/zinc/58/68/88/946586888.db2.gz FZCUCPYSPQIBDS-GOSISDBHSA-N 0 3 412.553 4.475 20 0 HIADHN COc1ccc(C(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)c(OC(F)F)c1 ZINC000568682606 946653437 /nfs/dbraw/zinc/65/34/37/946653437.db2.gz GYIZVYWLFSTYEF-IBGZPJMESA-N 0 3 422.472 4.117 20 0 HIADHN CN1CCC(N(Cc2ccccc2Br)C(=O)c2ccncc2Cl)CC1 ZINC000569283482 946848882 /nfs/dbraw/zinc/84/88/82/946848882.db2.gz JCHOKIIIEDBMKY-UHFFFAOYSA-N 0 3 422.754 4.234 20 0 HIADHN CN(C)C[C@@H](NC(=O)CCc1ncc(-c2ccc(F)cc2F)o1)c1ccc(F)cc1 ZINC000569282356 946848998 /nfs/dbraw/zinc/84/89/98/946848998.db2.gz VDXBHDIKWATEKE-LJQANCHMSA-N 0 3 417.431 4.111 20 0 HIADHN CC(C)C[C@H](NCC(=O)N1CCC(C(=O)Nc2ccccc2)CC1)c1cccs1 ZINC000569410109 946870691 /nfs/dbraw/zinc/87/06/91/946870691.db2.gz GKWGAGVFDMUTAN-FQEVSTJZSA-N 0 3 413.587 4.302 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)N2CCC(c3nc4ccccc4[nH]3)CC2)CCN1Cc1ccccc1 ZINC000569726637 946956804 /nfs/dbraw/zinc/95/68/04/946956804.db2.gz WWHINQZBUGPZFW-NQIIRXRSSA-N 0 3 417.557 4.115 20 0 HIADHN C[C@H](NC(=O)N(Cc1ccco1)C1CCN(C)CC1)c1ccc(Br)cc1 ZINC000569792126 947007892 /nfs/dbraw/zinc/00/78/92/947007892.db2.gz ULAKYUDHWBPHHR-HNNXBMFYSA-N 0 3 420.351 4.409 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CC(=O)N[C@H](CN(C)C)c1ccc(Cl)cc1 ZINC000569870858 947027227 /nfs/dbraw/zinc/02/72/27/947027227.db2.gz NZGHHMHXGLNULH-JOCHJYFZSA-N 0 3 410.949 4.104 20 0 HIADHN CN1CC[C@H](NCc2nc3cc(Br)ccc3[nH]2)[C@H]1c1ccc(F)c(F)c1 ZINC000569970783 947058140 /nfs/dbraw/zinc/05/81/40/947058140.db2.gz XTOQNSCZCUIIEY-QFBILLFUSA-N 0 3 421.289 4.139 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)C1NS(=O)(=O)c1ccc(C(F)F)cc1 ZINC000570116066 947098300 /nfs/dbraw/zinc/09/83/00/947098300.db2.gz UFUOYCCKPTUBFL-HZPDHXFCSA-N 0 3 408.514 4.059 20 0 HIADHN Cc1c(NC(=O)NC[C@H](Cc2ccccc2)N(C)C)cnn1-c1ccc(Cl)cc1 ZINC000570197886 947136368 /nfs/dbraw/zinc/13/63/68/947136368.db2.gz XEIPBJBNTVZTLM-FQEVSTJZSA-N 0 3 411.937 4.129 20 0 HIADHN CN(C)C[C@H](NC(=O)Nc1ccnc(Sc2ccccn2)c1)c1ccc(F)cc1 ZINC000570234907 947157678 /nfs/dbraw/zinc/15/76/78/947157678.db2.gz YPQDVNMHCXUVHO-SFHVURJKSA-N 0 3 411.506 4.191 20 0 HIADHN COc1cc(C(C)=O)ccc1OC[C@H](O)CN1CCC[C@@H](C)[C@H]1c1ccc(C)cc1 ZINC000570319258 947198611 /nfs/dbraw/zinc/19/86/11/947198611.db2.gz OGMKJCGVWJFJKH-KPCPBYSCSA-N 0 3 411.542 4.419 20 0 HIADHN CN(C)[C@@H](CNCc1cn2ccc(Br)cc2n1)c1ccc(Cl)cc1 ZINC000570369051 947224385 /nfs/dbraw/zinc/22/43/85/947224385.db2.gz KTBVFQXNHATAAN-KRWDZBQOSA-N 0 3 407.743 4.143 20 0 HIADHN CN1CCC(N(Cc2ccccc2Br)C(=O)[C@H]2CCCCS2)CC1 ZINC000570374019 947226257 /nfs/dbraw/zinc/22/62/57/947226257.db2.gz JZZVSACZWDIKQZ-GOSISDBHSA-N 0 3 411.409 4.158 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Cc1c[nH]c2cc(Br)ccc12)c1ccco1 ZINC000570424360 947236154 /nfs/dbraw/zinc/23/61/54/947236154.db2.gz JRQIQLALUYCMBK-UGSOOPFHSA-N 0 3 418.335 4.312 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1cccc(C(=O)N2CCCC2)c1C)c1ccco1 ZINC000570504574 947270739 /nfs/dbraw/zinc/27/07/39/947270739.db2.gz KNRIUDAQKGWSNS-OXJNMPFZSA-N 0 3 412.534 4.075 20 0 HIADHN CCCN(CC[NH+]1CCCCCC1)C(=O)Nc1ccc(-c2cc(=O)[n-]c(C)n2)cc1 ZINC000570547356 947287935 /nfs/dbraw/zinc/28/79/35/947287935.db2.gz ZNHZADBETQNTKB-UHFFFAOYSA-N 0 3 411.550 4.278 20 0 HIADHN CC(=O)Nc1cccc(NC(=O)[C@@H](C)N[C@@H](C)c2ccc(-c3ccncc3)cc2)c1 ZINC000570700787 947329722 /nfs/dbraw/zinc/32/97/22/947329722.db2.gz VWOMBHZVHMNRME-DLBZAZTESA-N 0 3 402.498 4.385 20 0 HIADHN Cc1cc(Cl)ccc1NC(=O)[C@H](C)N[C@@H]1CCN(C)[C@@H]1c1ccc(F)c(F)c1 ZINC000571366723 947623915 /nfs/dbraw/zinc/62/39/15/947623915.db2.gz KPPHUCGUXTXJEG-CJMONDIMSA-N 0 3 407.892 4.289 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N1C[C@@H](c2ccccc2)c2ccccc21 ZINC000571610412 947730749 /nfs/dbraw/zinc/73/07/49/947730749.db2.gz JHCCHJHURCVBPL-QFIPXVFZSA-N 0 3 413.521 4.174 20 0 HIADHN Cc1ccccc1-n1cc(CNC[C@@H]2CCN(C)[C@@H]2c2ccc(Cl)c(F)c2)nn1 ZINC000571717568 947760509 /nfs/dbraw/zinc/76/05/09/947760509.db2.gz DYKNOWFJHYCYBR-HTAPYJJXSA-N 0 3 413.928 4.151 20 0 HIADHN NS(=O)(=O)c1ccc2c(c1)[C@@H](N[C@@H](Cc1ccccc1)c1ccccc1)CCC2 ZINC000571725238 947765811 /nfs/dbraw/zinc/76/58/11/947765811.db2.gz WEKSIONBWLFICB-ZEQRLZLVSA-N 0 3 406.551 4.285 20 0 HIADHN COc1ccc(C(=O)Nc2ccc(C(=O)Nc3ccccc3CN(C)C)s2)cc1 ZINC000571731969 947768594 /nfs/dbraw/zinc/76/85/94/947768594.db2.gz GCSCENHVTWAKLO-UHFFFAOYSA-N 0 3 409.511 4.323 20 0 HIADHN COc1ccc(CN2CCC[C@H](CNC(=O)Nc3ccc(C)cc3)C2)c(C)c1OC ZINC000571808004 947790473 /nfs/dbraw/zinc/79/04/73/947790473.db2.gz SRYSPAZYOMFQIQ-LJQANCHMSA-N 0 3 411.546 4.354 20 0 HIADHN O=S(=O)(CCCNCc1ccc(F)c(Br)c1)c1ccc(Cl)cc1 ZINC000571900415 947809021 /nfs/dbraw/zinc/80/90/21/947809021.db2.gz GXRYVTHCAWVCOD-UHFFFAOYSA-N 0 3 420.731 4.195 20 0 HIADHN O=C(C[C@@H]1CCCCO1)N(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000572192364 947859839 /nfs/dbraw/zinc/85/98/39/947859839.db2.gz CVVWCYXCEUCDIV-RPWUZVMVSA-N 0 3 407.558 4.034 20 0 HIADHN CSc1ccc([C@@H](CNC(=O)c2c[nH]nc2-c2c(F)cccc2F)N(C)C)cc1 ZINC000572268526 947873239 /nfs/dbraw/zinc/87/32/39/947873239.db2.gz AQRJFRRKXSAVNR-GOSISDBHSA-N 0 3 416.497 4.110 20 0 HIADHN CCNC(=O)Nc1cccc(NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)c1C ZINC000572349632 947888483 /nfs/dbraw/zinc/88/84/83/947888483.db2.gz NLJBSOVUSUMAAL-GOSISDBHSA-N 0 3 412.509 4.126 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)Nc2ccc([C@@H](C)N3CCOCC3)cc2)N(C)C)cc1 ZINC000572440934 947905725 /nfs/dbraw/zinc/90/57/25/947905725.db2.gz RWQAWNGNJCDUJZ-NTKDMRAZSA-N 0 3 424.589 4.067 20 0 HIADHN O=C(CCN1CCCC[C@@H]1CNC(=O)Nc1ccccc1)Nc1cccc(Cl)c1 ZINC000572535035 947937552 /nfs/dbraw/zinc/93/75/52/947937552.db2.gz DHXSFFNOQJSTDP-HXUWFJFHSA-N 0 3 414.937 4.345 20 0 HIADHN CCN(CC)[C@H](CNCc1cn2ccc(Br)cc2n1)c1ccsc1 ZINC000572651809 947968254 /nfs/dbraw/zinc/96/82/54/947968254.db2.gz UCFKEZWAXLQUFE-QGZVFWFLSA-N 0 3 407.381 4.331 20 0 HIADHN CCN(C(C)=O)c1nc(CNC[C@@H](c2ccc(CC(C)C)cc2)N(C)C)cs1 ZINC000572796400 948013034 /nfs/dbraw/zinc/01/30/34/948013034.db2.gz HUNYYUZFBFEIHR-NRFANRHFSA-N 0 3 402.608 4.107 20 0 HIADHN CCOc1cc(C[NH2+]C2CCN(C(=O)CCc3ccccc3)CC2)cc(Cl)c1[O-] ZINC000573038050 948066322 /nfs/dbraw/zinc/06/63/22/948066322.db2.gz PTKOUDNHSDQNBT-UHFFFAOYSA-N 0 3 416.949 4.158 20 0 HIADHN CCN1CC[C@H](NCc2cc(C(=O)OC)sc2C)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000573147828 948090782 /nfs/dbraw/zinc/09/07/82/948090782.db2.gz PAIOAKXRLZNMFL-LPHOPBHVSA-N 0 3 412.477 4.186 20 0 HIADHN C[C@H](CN1CCCCC1)NC(=O)C(C)(C)c1csc(-c2cc(F)ccc2F)n1 ZINC000573253581 948122728 /nfs/dbraw/zinc/12/27/28/948122728.db2.gz USZRLORAXLNEQW-CQSZACIVSA-N 0 3 407.530 4.357 20 0 HIADHN COc1cc(CN2CCC[C@@H](c3nc(N(C)C)no3)C2)ccc1OCc1ccccc1 ZINC000573432076 948204745 /nfs/dbraw/zinc/20/47/45/948204745.db2.gz PIGYFVWDEMPPDD-HXUWFJFHSA-N 0 3 422.529 4.103 20 0 HIADHN CCN(CC)C(=O)CCC1CCN(CC(=O)N(C)[C@@H](C)c2ccc(Cl)cc2)CC1 ZINC000573714581 948280109 /nfs/dbraw/zinc/28/01/09/948280109.db2.gz HDRGBLOFEGIMGX-SFHVURJKSA-N 0 3 422.013 4.220 20 0 HIADHN Cc1nc(-c2ccc(F)cc2)sc1C(=O)Nc1cccc(CN2CC[C@H](O)C2)c1 ZINC000573942958 948329579 /nfs/dbraw/zinc/32/95/79/948329579.db2.gz LASSKLHTCGQFOW-IBGZPJMESA-N 0 3 411.502 4.077 20 0 HIADHN CNC(=O)COc1cccc(CN[C@@H](C)c2sc(-c3ccc(C)cc3)nc2C)c1 ZINC000574107091 948366248 /nfs/dbraw/zinc/36/62/48/948366248.db2.gz SMGSGXSLXRKZBD-INIZCTEOSA-N 0 3 409.555 4.403 20 0 HIADHN COc1ccc(OC)c(-c2nn(-c3ccccc3)cc2CN(C)[C@@H]2CCCOC2)c1 ZINC000574438258 948442561 /nfs/dbraw/zinc/44/25/61/948442561.db2.gz HNRLMKSIRMLIQD-HXUWFJFHSA-N 0 3 407.514 4.167 20 0 HIADHN CC[C@H](C)C(=O)Nc1cccc(CNC[C@@H](O)COc2cc(C)ccc2Cl)c1 ZINC000574726156 948514361 /nfs/dbraw/zinc/51/43/61/948514361.db2.gz USEHDMLMGOAXGL-QFBILLFUSA-N 0 3 404.938 4.163 20 0 HIADHN COc1ccc([C@H](CO)N(C)CCCC(=O)c2ccc(Br)cc2)cc1 ZINC000574866640 948547525 /nfs/dbraw/zinc/54/75/25/948547525.db2.gz WHWBJSWWXJWKKQ-IBGZPJMESA-N 0 3 406.320 4.086 20 0 HIADHN COC(=O)c1c(F)ccc(NC(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)c1C ZINC000574946908 948562741 /nfs/dbraw/zinc/56/27/41/948562741.db2.gz FFMBBGLWMAYAIG-FQEVSTJZSA-N 0 3 413.493 4.188 20 0 HIADHN CCCn1c(CNc2ccc(C(=O)N(C)[C@@H]3CCCN(C)C3)cc2)nc2ccccc21 ZINC000575007983 948572537 /nfs/dbraw/zinc/57/25/37/948572537.db2.gz YAJYUWKYUMFELL-OAQYLSRUSA-N 0 3 419.573 4.225 20 0 HIADHN O=C(Nc1c[nH]nc1[C@H]1CCCN(C[C@H]2CCC3(CCCC3)O2)C1)C1CCCC1 ZINC000575021527 948574433 /nfs/dbraw/zinc/57/44/33/948574433.db2.gz XHYUAZGODLIZGR-RBUKOAKNSA-N 0 3 400.567 4.210 20 0 HIADHN COCC(=O)Nc1cccc(CN[C@@H](Cc2cccnc2)c2cccc(Cl)c2)c1 ZINC000575733965 948688646 /nfs/dbraw/zinc/68/86/46/948688646.db2.gz BQDFGDIQJVLFIU-QFIPXVFZSA-N 0 3 409.917 4.394 20 0 HIADHN O[C@@H](CN[C@@H]1CCSc2c(F)cccc21)COc1ccccc1C(F)(F)F ZINC000576068896 948819330 /nfs/dbraw/zinc/81/93/30/948819330.db2.gz XHVDYFMWFDCYGP-BLLLJJGKSA-N 0 3 401.425 4.411 20 0 HIADHN FC(F)(c1nc(Cl)cc(Cl)n1)N1CCC[C@@H]2CN(Cc3ccccc3)C[C@H]21 ZINC001164623704 719059502 /nfs/dbraw/zinc/05/95/02/719059502.db2.gz KPAKRRMIUQECQE-HUUCEWRRSA-N 0 3 413.299 4.429 20 0 HIADHN Clc1cccc2c1nc(Cl)nc2N1CC[C@H]2[C@@H]1CCN2Cc1cccnc1 ZINC001164726534 720372965 /nfs/dbraw/zinc/37/29/65/720372965.db2.gz PDINAJOIEJTJCV-IRXDYDNUSA-N 0 3 400.313 4.185 20 0 HIADHN CN(Cc1ccc(N2CCC(F)(F)[C@@]3(CCN(c4ccccc4)C3)C2)nc1)C1CC1 ZINC001164830466 720395667 /nfs/dbraw/zinc/39/56/67/720395667.db2.gz QZZIBNORJYHNHD-HSZRJFAPSA-N 0 3 412.528 4.418 20 0 HIADHN Cc1nc2sc3c(c2c(N2CC[C@H]4[C@H]2CCN4Cc2cccnc2)n1)CCCC3 ZINC001164734513 720432744 /nfs/dbraw/zinc/43/27/44/720432744.db2.gz SXJDDYWHPWSZMY-RBUKOAKNSA-N 0 3 405.571 4.127 20 0 HIADHN Fc1ccc(-c2ccc(Cl)nn2)c(N2CC[C@@H]3[C@H]2CCN3Cc2cccnc2)c1 ZINC001164727891 720456361 /nfs/dbraw/zinc/45/63/61/720456361.db2.gz FEBQGABTSORZJK-WOJBJXKFSA-N 0 3 409.896 4.184 20 0 HIADHN Clc1cc(-c2ccccc2)cc(N2CCN3C[C@H](OCc4cccnc4)C[C@@H]3C2)n1 ZINC001164863450 721085949 /nfs/dbraw/zinc/08/59/49/721085949.db2.gz CIFXWCIJBGOLQK-FGZHOGPDSA-N 0 3 420.944 4.277 20 0 HIADHN Cc1csc2c1nc(Cl)cc2N1CCN2C[C@H](OCc3cccnc3)C[C@H]2C1 ZINC001164865670 721116283 /nfs/dbraw/zinc/11/62/83/721116283.db2.gz OFQYSRISGPKJNF-DLBZAZTESA-N 0 3 414.962 4.133 20 0 HIADHN Cc1cc2c(nc(Cl)nc2N2CCN3C[C@H](Oc4cccc(F)c4)C[C@H]3C2)s1 ZINC001164899188 721525142 /nfs/dbraw/zinc/52/51/42/721525142.db2.gz KREHVAYGURNIQK-GOEBONIOSA-N 0 3 418.925 4.134 20 0 HIADHN Cc1cccc2ncnc(N3CCC(F)(F)[C@]4(CCN(Cc5ccccn5)C4)C3)c12 ZINC001164904973 721707793 /nfs/dbraw/zinc/70/77/93/721707793.db2.gz GCUDAYMRGFUFOB-QFIPXVFZSA-N 0 3 409.484 4.071 20 0 HIADHN COc1ccc2ccc(N3CCC(F)(F)[C@@]4(CCN(Cc5ccccn5)C4)C3)nc2c1 ZINC001164904335 721711521 /nfs/dbraw/zinc/71/15/21/721711521.db2.gz BVBZXOXFAKBBCZ-HSZRJFAPSA-N 0 3 424.495 4.376 20 0 HIADHN Clc1ccc2ccnc(N3CC[C@H]4CN(Cc5cccnc5)CCO[C@@H]4C3)c2c1 ZINC001164981104 722110117 /nfs/dbraw/zinc/11/01/17/722110117.db2.gz SOIFAELBPRCCEG-SIKLNZKXSA-N 0 3 408.933 4.011 20 0 HIADHN Cc1c(Cl)ccc2ccc(N3CC[C@@H]4CN(Cc5cccnc5)CCO[C@@H]4C3)nc21 ZINC001164984223 722135129 /nfs/dbraw/zinc/13/51/29/722135129.db2.gz WOPVHVZZFVZCDQ-IFMALSPDSA-N 0 3 422.960 4.319 20 0 HIADHN CC(C)c1cc(C(=O)Nc2cccc(CN3CCC(O)CC3)c2)nn1-c1ccccc1 ZINC000435971956 861234043 /nfs/dbraw/zinc/23/40/43/861234043.db2.gz KCQYMUWYQLMGTB-UHFFFAOYSA-N 0 3 418.541 4.205 20 0 HIADHN CCn1ccnc1[C@@H]1CCCCN1C(=O)[C@H](C)N1CCC(Cc2ccccc2)CC1 ZINC000435991577 861271411 /nfs/dbraw/zinc/27/14/11/861271411.db2.gz JJDSZAWOEXMCNZ-REWPJTCUSA-N 0 3 408.590 4.300 20 0 HIADHN CC[C@](C)(COc1ncccc1Cl)NC(=O)c1cccc(CN2CCCC2)c1 ZINC000436001432 861288475 /nfs/dbraw/zinc/28/84/75/861288475.db2.gz NTAVYPGNVJDKAZ-JOCHJYFZSA-N 0 3 401.938 4.308 20 0 HIADHN CN(C)CCN(C(=O)Nc1cccc(NC(=O)c2cccs2)c1)C1CCCC1 ZINC000436014817 861306766 /nfs/dbraw/zinc/30/67/66/861306766.db2.gz SUFXRTRKGULLGT-UHFFFAOYSA-N 0 3 400.548 4.339 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1NC(=O)CN[C@@H]1CCCC[C@H]1OCCC(C)C ZINC000436251335 861562584 /nfs/dbraw/zinc/56/25/84/861562584.db2.gz IGKZPYIETNFKSS-FGZHOGPDSA-N 0 3 412.578 4.391 20 0 HIADHN CC(C)[C@H](NCC(=O)Nc1ccc(CN2CCOCC2)cc1)c1ccc(Cl)cc1 ZINC000010138967 845623167 /nfs/dbraw/zinc/62/31/67/845623167.db2.gz RNRMDLDWIHKATQ-QHCPKHFHSA-N 0 3 415.965 4.098 20 0 HIADHN COCCS(=O)(=O)c1ccc(CN[C@H]2CC(C)(C)CCc3ccccc32)cc1 ZINC000436296673 861602917 /nfs/dbraw/zinc/60/29/17/861602917.db2.gz SKAWZDBCGRGVBT-QFIPXVFZSA-N 0 3 401.572 4.300 20 0 HIADHN CCCc1ccc(C(=O)CCC(=O)Nc2ccc(N3CCN(CC)CC3)cc2)cc1 ZINC000011872489 845838807 /nfs/dbraw/zinc/83/88/07/845838807.db2.gz IILFIZMXBCMPKL-UHFFFAOYSA-N 0 3 407.558 4.383 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)CS[C@H](C)c3nc4ccccc4[nH]3)cc2)CC1 ZINC000011945164 845843145 /nfs/dbraw/zinc/84/31/45/845843145.db2.gz YWTRDBSQLIKBIE-QGZVFWFLSA-N 0 3 423.586 4.138 20 0 HIADHN COc1cc(CN2CCCC2)ccc1OCC(=O)Nc1ccccc1C(F)(F)F ZINC000012670094 845882332 /nfs/dbraw/zinc/88/23/32/845882332.db2.gz ARCUBWBIOADDTE-UHFFFAOYSA-N 0 3 408.420 4.327 20 0 HIADHN CCOC(=O)Nc1ccc2c(CN(C)CCOc3ccc(F)cc3)cc(=O)oc2c1 ZINC000015101533 846009676 /nfs/dbraw/zinc/00/96/76/846009676.db2.gz RBJMUQVFFCJZTE-UHFFFAOYSA-N 0 3 414.433 4.011 20 0 HIADHN COc1ccc(Nc2nnc(SCC(=O)C(C#N)c3nc(C)cs3)s2)cc1 ZINC000020055123 846377385 /nfs/dbraw/zinc/37/73/85/846377385.db2.gz WPUQMEMUCUDVRX-CYBMUJFWSA-N 0 3 417.541 4.024 20 0 HIADHN CC(C)(C)c1ccc(S(=O)(=O)NCC2CCN(Cc3cccs3)CC2)cc1 ZINC000023000353 846646779 /nfs/dbraw/zinc/64/67/79/846646779.db2.gz YHHOYCRFBCJWSP-UHFFFAOYSA-N 0 3 406.617 4.236 20 0 HIADHN COc1ccc([C@H](CNC(=O)CCCc2c[nH]c3ccccc23)N2CCCC2)cc1 ZINC000023486777 846707616 /nfs/dbraw/zinc/70/76/16/846707616.db2.gz ZFJSXMMHGOYNQU-DEOSSOPVSA-N 0 3 405.542 4.453 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2CNCCNC(=O)c2ccco2)cc1C ZINC000025053933 846913841 /nfs/dbraw/zinc/91/38/41/846913841.db2.gz XZQQMANJLRGUPP-UHFFFAOYSA-N 0 3 414.509 4.269 20 0 HIADHN CN(C)[C@H](CNC(=O)c1cnn(-c2ccc(F)cc2)c1C(F)(F)F)c1ccccc1 ZINC000025238909 846946731 /nfs/dbraw/zinc/94/67/31/846946731.db2.gz OREMSAJRMOGJAQ-GOSISDBHSA-N 0 3 420.410 4.063 20 0 HIADHN Cc1nn(CC(C)C)c(C)c1CCC(=O)NCC(C)(C)N1CCc2ccccc2C1 ZINC000025463016 846981912 /nfs/dbraw/zinc/98/19/12/846981912.db2.gz FZSCMNZHMTWIID-UHFFFAOYSA-N 0 3 410.606 4.042 20 0 HIADHN CC(C)[C@H](CNC(=O)c1ccccc1OC[C@H]1CCCO1)N1CCc2ccccc2C1 ZINC000025540859 846996313 /nfs/dbraw/zinc/99/63/13/846996313.db2.gz NRXSSWJJXHKFEY-VWNXMTODSA-N 0 3 422.569 4.057 20 0 HIADHN COc1cc(C(C)=O)ccc1OC[C@@H](O)CN[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000025664077 847016550 /nfs/dbraw/zinc/01/65/50/847016550.db2.gz YKZZHUBQNXTVNV-ACJLOTCBSA-N 0 3 411.420 4.007 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1c(C)onc1-c1ccccc1)c1cccc(OC)c1 ZINC000025856711 847047560 /nfs/dbraw/zinc/04/75/60/847047560.db2.gz XQOGECUXMKHYON-NRFANRHFSA-N 0 3 407.514 4.472 20 0 HIADHN CC(C)NC(=O)c1ccccc1NC(=O)CN[C@H](Cc1ccccc1)c1ccccc1 ZINC000025945903 847061009 /nfs/dbraw/zinc/06/10/09/847061009.db2.gz BEOPYPOHJLAXIP-XMMPIXPASA-N 0 3 415.537 4.337 20 0 HIADHN COc1ccc(OC)c([C@@H](C)NC[C@@H](O)COc2ccc(Cl)cc2Cl)c1 ZINC000026715105 847188673 /nfs/dbraw/zinc/18/86/73/847188673.db2.gz LKRSTEDFWBORRU-TZMCWYRMSA-N 0 3 400.302 4.101 20 0 HIADHN O=C(CN1CCN(C2CCCC2)CC1)N[C@H](c1ccccc1)c1ccc(Cl)cc1 ZINC000027119177 847250079 /nfs/dbraw/zinc/25/00/79/847250079.db2.gz MVMQCLGQYGUADQ-XMMPIXPASA-N 0 3 411.977 4.106 20 0 HIADHN CCOc1ccccc1NC(=O)[C@@H](c1ccccc1)N1CCN(C2CCCC2)CC1 ZINC000027118389 847250284 /nfs/dbraw/zinc/25/02/84/847250284.db2.gz KLHJVRPHFJJOLZ-XMMPIXPASA-N 0 3 407.558 4.325 20 0 HIADHN COc1cc(C(=O)NC[C@@H](Cc2ccccc2)N(C)C)ccc1OCc1ccccc1 ZINC000027145167 847255894 /nfs/dbraw/zinc/25/58/94/847255894.db2.gz KDOCKCMIMYWQSD-HSZRJFAPSA-N 0 3 418.537 4.177 20 0 HIADHN O=C(CCc1ncc(-c2ccccc2F)o1)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000029179223 847522034 /nfs/dbraw/zinc/52/20/34/847522034.db2.gz OYYBTJZHNHRKSV-NRFANRHFSA-N 0 3 407.489 4.367 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)c1nn(-c2ccc(F)cc2)c2c1CCC2 ZINC000029179178 847522295 /nfs/dbraw/zinc/52/22/95/847522295.db2.gz TVMUMEFXAIPYTG-JOCHJYFZSA-N 0 3 418.516 4.067 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)c1ccc(NC(=O)c2ccccc2)cc1 ZINC000029369948 847553965 /nfs/dbraw/zinc/55/39/65/847553965.db2.gz BPWJLKPALCPZFN-UHFFFAOYSA-N 0 3 423.582 4.030 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3nc(-c4ccco4)sc3C)c(C)c2)CC1 ZINC000029441872 847565205 /nfs/dbraw/zinc/56/52/05/847565205.db2.gz OEVFSSWBJUHSFH-UHFFFAOYSA-N 0 3 410.543 4.414 20 0 HIADHN CCCCNC(=O)C1CC[NH+](Cc2c([O-])ccc3cc(Br)ccc32)CC1 ZINC000029540602 847577002 /nfs/dbraw/zinc/57/70/02/847577002.db2.gz MLBKMROVRISFPS-UHFFFAOYSA-N 0 3 419.363 4.436 20 0 HIADHN COc1ccc(NC(=O)c2ccccc2NC(=O)CN([C@H](C)C2CC2)C2CC2)cc1 ZINC000029725342 847609841 /nfs/dbraw/zinc/60/98/41/847609841.db2.gz PAHLWITXTXXQPA-MRXNPFEDSA-N 0 3 407.514 4.149 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cnn(-c4ccccc4)c3C(C)C)cc2)CC1 ZINC000029799020 847621384 /nfs/dbraw/zinc/62/13/84/847621384.db2.gz QHUFMKPCEAFFLM-UHFFFAOYSA-N 0 3 417.557 4.390 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)COc3ccc(Cl)c(Cl)c3)cc2)CC1 ZINC000029799023 847621632 /nfs/dbraw/zinc/62/16/32/847621632.db2.gz LBXQJCCMHWQENG-UHFFFAOYSA-N 0 3 408.329 4.153 20 0 HIADHN CC(C)[C@@H](CNc1ncnc2scc(-c3ccc(F)cc3)c21)N1CCN(C)CC1 ZINC000029839956 847629535 /nfs/dbraw/zinc/62/95/35/847629535.db2.gz ICBSGBVXIGGYIM-LJQANCHMSA-N 0 3 413.566 4.181 20 0 HIADHN CCOC(=O)Nc1ccc2c(CN(C)CCCOc3ccccc3)cc(=O)oc2c1 ZINC000029852634 847634871 /nfs/dbraw/zinc/63/48/71/847634871.db2.gz KLKOOIYOMFDHJD-UHFFFAOYSA-N 0 3 410.470 4.262 20 0 HIADHN COc1ccccc1NC(=O)C1CCN(Cc2cc(=O)oc3cc(C)c(C)cc23)CC1 ZINC000029905004 847645124 /nfs/dbraw/zinc/64/51/24/847645124.db2.gz NXUQUTDNEAZOQT-UHFFFAOYSA-N 0 3 420.509 4.269 20 0 HIADHN Cc1ccc(NC(=O)[C@H](NCCc2ccc3c(c2)OCCO3)c2ccccc2)cc1 ZINC000030007761 847668756 /nfs/dbraw/zinc/66/87/56/847668756.db2.gz IKFURLGEGLYLCH-XMMPIXPASA-N 0 3 402.494 4.278 20 0 HIADHN COc1cc(CN[C@H](C)c2ccc(-n3cncn3)cc2)ccc1OCc1ccncc1 ZINC000030545465 847733750 /nfs/dbraw/zinc/73/37/50/847733750.db2.gz IOBAKIHXBQIWQZ-GOSISDBHSA-N 0 3 415.497 4.101 20 0 HIADHN COc1cc(CNCc2ccnc(-n3cccn3)c2)ccc1OCc1cccs1 ZINC000030901086 847794543 /nfs/dbraw/zinc/79/45/43/847794543.db2.gz DIIHNTRBRKMEOI-UHFFFAOYSA-N 0 3 406.511 4.206 20 0 HIADHN COc1ccc2cc(CNC(=O)NC[C@H](c3ccccc3)N3CCCC3)ccc2c1 ZINC000030989083 847805690 /nfs/dbraw/zinc/80/56/90/847805690.db2.gz YZRBCTCVBXJFOC-XMMPIXPASA-N 0 3 403.526 4.485 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCc1ccc(NC(=O)C(C)C)cc1)c1ccsc1 ZINC000031097204 847822216 /nfs/dbraw/zinc/82/22/16/847822216.db2.gz IBCZQPAYUNPWQW-HXUWFJFHSA-N 0 3 416.591 4.225 20 0 HIADHN C[C@@H](NC(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1)c1ccc2c(c1)OCO2 ZINC000031101871 847823094 /nfs/dbraw/zinc/82/30/94/847823094.db2.gz DCADKESHFNJXSJ-AEFFLSMTSA-N 0 3 415.559 4.310 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N(C)Cc1cnn(-c2ccccc2)c1)c1ccsc1 ZINC000031194008 847841044 /nfs/dbraw/zinc/84/10/44/847841044.db2.gz UMAGIVJQXPGJCJ-OAQYLSRUSA-N 0 3 411.575 4.158 20 0 HIADHN CCOc1c(Br)cc(C(=O)Nc2ccccc2CN(C)C)cc1OC ZINC000031233290 847847893 /nfs/dbraw/zinc/84/78/93/847847893.db2.gz WEHTXFWLCGGAAN-UHFFFAOYSA-N 0 3 407.308 4.170 20 0 HIADHN C[C@@H](Cc1ccccc1C(F)(F)F)[NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1 ZINC000436541080 861842693 /nfs/dbraw/zinc/84/26/93/861842693.db2.gz SISWBGDUYURAQL-HNNXBMFYSA-N 0 3 406.448 4.236 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)c1cccnc1Sc1ccccc1 ZINC000031958121 847970535 /nfs/dbraw/zinc/97/05/35/847970535.db2.gz IVIKXKSGJDCEOB-UHFFFAOYSA-N 0 3 413.612 4.324 20 0 HIADHN O=C(CCCc1nc2ccccc2s1)NCC1(N2CCSCC2)CCCC1 ZINC000031960286 847971685 /nfs/dbraw/zinc/97/16/85/847971685.db2.gz GFWAOIDGCAAOFF-UHFFFAOYSA-N 0 3 403.617 4.097 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1ccccc1OC[C@H]1CCCO1)c1ccsc1 ZINC000031984375 847974581 /nfs/dbraw/zinc/97/45/81/847974581.db2.gz YWYOQRYVITXENP-UYAOXDASSA-N 0 3 402.560 4.119 20 0 HIADHN CCN(CC)[C@H](CNC(=O)[C@@H](NC(=O)c1ccc(C)cc1)C(C)C)c1ccsc1 ZINC000031987893 847975872 /nfs/dbraw/zinc/97/58/72/847975872.db2.gz DJZGBANKFGFXLD-RTWAWAEBSA-N 0 3 415.603 4.010 20 0 HIADHN CCc1ccc([C@H](CNC(=O)Cn2c3ccccc3nc2C(F)(F)F)N(C)C)cc1 ZINC000032732918 848069238 /nfs/dbraw/zinc/06/92/38/848069238.db2.gz FMXZQSJNBLCGJN-IBGZPJMESA-N 0 3 418.463 4.037 20 0 HIADHN Cc1cc(O)c(C(C)C)cc1C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000436602462 861866135 /nfs/dbraw/zinc/86/61/35/861866135.db2.gz KCFZQYWFGGVAEA-UHFFFAOYSA-N 0 3 414.521 4.236 20 0 HIADHN CN1CCN(CCCNC(=O)c2occc2-c2ccccc2)[C@@H](c2ccccc2)C1 ZINC000033136022 848112594 /nfs/dbraw/zinc/11/25/94/848112594.db2.gz ZCIMQQFAZFOBHQ-HSZRJFAPSA-N 0 3 403.526 4.055 20 0 HIADHN CCOc1ccc(C(=O)Nc2ccc(N3CCN(CC)CC3)cc2C)cc1OCC ZINC000036037219 848146210 /nfs/dbraw/zinc/14/62/10/848146210.db2.gz WGNIOKHXABXLCJ-UHFFFAOYSA-N 0 3 411.546 4.187 20 0 HIADHN O=C(Nc1ccc(F)cc1)[C@@H](NCCc1ccc2c(c1)OCCO2)c1ccccc1 ZINC000038433332 848178479 /nfs/dbraw/zinc/17/84/79/848178479.db2.gz KPBBTRXELKKFFU-QHCPKHFHSA-N 0 3 406.457 4.109 20 0 HIADHN Cc1oc(-c2ccccc2)nc1CC(=O)N1CCCN(Cc2ccccc2C)CC1 ZINC000041315404 848210743 /nfs/dbraw/zinc/21/07/43/848210743.db2.gz OEHYQYOCMTUAAQ-UHFFFAOYSA-N 0 3 403.526 4.235 20 0 HIADHN N#CC(C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)c1ccccn1 ZINC000041493764 848221013 /nfs/dbraw/zinc/22/10/13/848221013.db2.gz FSGJJRHTDBODHG-OAHLLOKOSA-N 0 3 418.375 4.101 20 0 HIADHN C[C@H](NC(=O)c1ccccc1)C(=O)C(C#N)c1nc2cc(C(F)(F)F)ccc2s1 ZINC000041549359 848230595 /nfs/dbraw/zinc/23/05/95/848230595.db2.gz VTCKNBXQKYRRPW-FZMZJTMJSA-N 0 3 417.412 4.310 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CCC(C(=O)c2ccccc2)CC1)c1ccccc1 ZINC000043230068 848396377 /nfs/dbraw/zinc/39/63/77/848396377.db2.gz MHXIEJJSDIOWJI-QHCPKHFHSA-N 0 3 407.558 4.374 20 0 HIADHN CN(CCCN(C)C(=O)c1cc(OCc2ccccc2)ccc1O)Cc1ccco1 ZINC000436712990 861899776 /nfs/dbraw/zinc/89/97/76/861899776.db2.gz PXWBMQQQKGXHMS-UHFFFAOYSA-N 0 3 408.498 4.158 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NC[C@H]3CCCc4ccccc43)c(C)c2)CC1 ZINC000043522150 848434463 /nfs/dbraw/zinc/43/44/63/848434463.db2.gz AQLFIQXZCBSCNR-OAQYLSRUSA-N 0 3 406.574 4.379 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N[C@@H]3CCSc4ccccc43)c(C)c2)CC1 ZINC000043522045 848434907 /nfs/dbraw/zinc/43/49/07/848434907.db2.gz LZUJPVITXQLCDD-OAQYLSRUSA-N 0 3 410.587 4.496 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCc3ccccc3OC(F)F)c(C)c2)CC1 ZINC000043522577 848435777 /nfs/dbraw/zinc/43/57/77/848435777.db2.gz FWNOVHUDBRDOJY-UHFFFAOYSA-N 0 3 418.488 4.060 20 0 HIADHN CCOc1cc(C(=O)NCc2ccccc2CN(C)C)ccc1OCc1cccnc1 ZINC000043732716 848456661 /nfs/dbraw/zinc/45/66/61/848456661.db2.gz YLTIHMGBKQFCRW-UHFFFAOYSA-N 0 3 419.525 4.051 20 0 HIADHN O=C(Nc1ccc(C[NH+]2CCN(c3ccccn3)CC2)cc1)c1cc(Cl)ccc1[O-] ZINC000436721133 861907105 /nfs/dbraw/zinc/90/71/05/861907105.db2.gz GRVXHZKTACAMMI-UHFFFAOYSA-N 0 3 422.916 4.015 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1cccc(NC(=O)C2CC2)c1)c1ccsc1 ZINC000044101625 848514639 /nfs/dbraw/zinc/51/46/39/848514639.db2.gz UQHPDRUYQBJMRK-LJQANCHMSA-N 0 3 400.548 4.301 20 0 HIADHN CNC(=O)c1ccc(C)c(NC(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)c1 ZINC000044182364 848526925 /nfs/dbraw/zinc/52/69/25/848526925.db2.gz CKLDYQFGFKLKFO-IBGZPJMESA-N 0 3 414.575 4.011 20 0 HIADHN CN(C)c1ccc(NC(=O)NC[C@@H](Cc2ccccc2)N(C)C)c(C(F)(F)F)c1 ZINC000044368980 848552189 /nfs/dbraw/zinc/55/21/89/848552189.db2.gz XTFUCJYYUZFDCP-QGZVFWFLSA-N 0 3 408.468 4.066 20 0 HIADHN CCN(Cc1cccc(NC(=O)NC[C@H](c2ccsc2)N(CC)CC)c1)C(C)=O ZINC000044379141 848553091 /nfs/dbraw/zinc/55/30/91/848553091.db2.gz XURNPAMWHNQZOS-OAQYLSRUSA-N 0 3 416.591 4.321 20 0 HIADHN COc1ccc(CCN[C@H](C(=O)Nc2ccc(F)cc2)c2ccccc2)cc1OC ZINC000045295793 848660811 /nfs/dbraw/zinc/66/08/11/848660811.db2.gz HGBRMGWYQLEFGA-QHCPKHFHSA-N 0 3 408.473 4.355 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N(C)Cc1ccc(OC)c(F)c1)c1cccc(OC)c1 ZINC000045596091 848698367 /nfs/dbraw/zinc/69/83/67/848698367.db2.gz NONBOZQRMYZDDH-NRFANRHFSA-N 0 3 417.525 4.067 20 0 HIADHN CCN(Cc1ccccc1NC(=O)NC[C@@H](c1ccccc1)N1CCCC1)C(C)=O ZINC000045686164 848713360 /nfs/dbraw/zinc/71/33/60/848713360.db2.gz NBHYNICSVLBYMT-QHCPKHFHSA-N 0 3 408.546 4.014 20 0 HIADHN CCCNC(=O)c1cccc(NC(=O)NC[C@H](c2ccsc2)N(CC)CC)c1 ZINC000045739261 848720640 /nfs/dbraw/zinc/72/06/40/848720640.db2.gz ZMCRDKYPJHCRQO-LJQANCHMSA-N 0 3 402.564 4.093 20 0 HIADHN C[C@@H]1CCCN(C(=O)C2CCN(Cc3ccc(C(=O)Nc4ccccc4)cc3)CC2)C1 ZINC000045804751 848731604 /nfs/dbraw/zinc/73/16/04/848731604.db2.gz UFGGSAASYLFEBC-HXUWFJFHSA-N 0 3 419.569 4.409 20 0 HIADHN Cc1nc(C(C)C)sc1C(=O)NCCCCN1CCN(c2cccc(C)c2)CC1 ZINC000046749271 848925127 /nfs/dbraw/zinc/92/51/27/848925127.db2.gz BVDWTQVATBQQJW-UHFFFAOYSA-N 0 3 414.619 4.216 20 0 HIADHN CN(C)Cc1cccc(NC(=O)[C@H]2CCCN(c3ncccc3C(F)(F)F)C2)c1 ZINC000046785001 848933944 /nfs/dbraw/zinc/93/39/44/848933944.db2.gz ZLBNZCWHSNHVDV-INIZCTEOSA-N 0 3 406.452 4.017 20 0 HIADHN CCOc1ccc([C@H](C)NC(=O)N2CCCN(Cc3ccccc3)CC2)cc1OC ZINC000047045452 848977247 /nfs/dbraw/zinc/97/72/47/848977247.db2.gz CYLVZHCWPHYOOC-IBGZPJMESA-N 0 3 411.546 4.072 20 0 HIADHN Cc1ccc(CNC(=O)c2cccc(CNCc3ccc(-n4ccnc4)cc3)c2)cc1 ZINC000047718484 849098293 /nfs/dbraw/zinc/09/82/93/849098293.db2.gz USDBEMRBHLDGFI-UHFFFAOYSA-N 0 3 410.521 4.401 20 0 HIADHN CCN(CC)C(=O)Nc1ccc([C@H](C)NCc2cc(OC)c(OC)c(OC)c2)cc1 ZINC000047724727 849099246 /nfs/dbraw/zinc/09/92/46/849099246.db2.gz VSXKGEUXENSEEP-INIZCTEOSA-N 0 3 415.534 4.437 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)Nc1ccccc1OCC(F)(F)F ZINC000048072752 849159489 /nfs/dbraw/zinc/15/94/89/849159489.db2.gz BQBITXLDXNYSEW-UHFFFAOYSA-N 0 3 413.415 4.363 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)Nc1ccc(N2CCCC2)c(F)c1 ZINC000048139803 849176929 /nfs/dbraw/zinc/17/69/29/849176929.db2.gz ZGQSLJMIKDADDU-UHFFFAOYSA-N 0 3 402.489 4.161 20 0 HIADHN CCC(=O)Nc1ccc(C)c(NC(=O)NCC(C)(C)N2CCc3ccccc3C2)c1 ZINC000048257600 849200690 /nfs/dbraw/zinc/20/06/90/849200690.db2.gz QAZWXEHTRNGUHK-UHFFFAOYSA-N 0 3 408.546 4.302 20 0 HIADHN CCC(=O)Nc1ccc(NC(=O)NC[C@@H](c2ccc(OC)cc2)N2CCCC2)cc1 ZINC000048394369 849216545 /nfs/dbraw/zinc/21/65/45/849216545.db2.gz FXCZSNBNYQMTNI-NRFANRHFSA-N 0 3 410.518 4.002 20 0 HIADHN COCCOc1cccc(CNCc2cn(-c3ccccc3)nc2-c2cccnc2)c1 ZINC000048744958 849261970 /nfs/dbraw/zinc/26/19/70/849261970.db2.gz YNTPKBLPPMETBF-UHFFFAOYSA-N 0 3 414.509 4.249 20 0 HIADHN CC(C)Oc1cccc(CNCc2cn(C)nc2-c2ccc3c(c2)OCCCO3)c1 ZINC000048746100 849263366 /nfs/dbraw/zinc/26/33/66/849263366.db2.gz FDTVAEWZBYAELH-UHFFFAOYSA-N 0 3 407.514 4.325 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2CNCc2cc(Cl)c3c(c2)OCCO3)C[C@H](C)O1 ZINC000048816700 849270774 /nfs/dbraw/zinc/27/07/74/849270774.db2.gz CFLUMCQGISLKMW-CALCHBBNSA-N 0 3 416.949 4.010 20 0 HIADHN Cc1cc([C@H]2CCCN2C(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)no1 ZINC000049790418 849329747 /nfs/dbraw/zinc/32/97/47/849329747.db2.gz NNEUMGNOCLCOKU-RTBURBONSA-N 0 3 402.564 4.364 20 0 HIADHN C[C@H]([NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1)c1ccc(F)cc1Br ZINC000436833404 862011375 /nfs/dbraw/zinc/01/13/75/862011375.db2.gz YMJUPKHGRRVVIC-ZDUSSCGKSA-N 0 3 421.310 4.249 20 0 HIADHN COc1ccc2oc([C@H](C)[NH2+]C3CCN(C(=O)c4ccccc4[O-])CC3)c(C)c2c1 ZINC000436833743 862015361 /nfs/dbraw/zinc/01/53/61/862015361.db2.gz YYFLZSZNDCQUNV-INIZCTEOSA-N 0 3 408.498 4.411 20 0 HIADHN C[C@H](C(=O)NCc1ccccc1Cl)N(C)C[C@@H]1CCCO[C@@H]1c1ccccc1 ZINC000051132876 849434994 /nfs/dbraw/zinc/43/49/94/849434994.db2.gz UZHOGFWTVQJJFP-PIPMEXSNSA-N 0 3 400.950 4.444 20 0 HIADHN CCOc1ccc(CN(C)C(=O)CN(C)C[C@H]2CCCO[C@@H]2c2ccccc2)cc1 ZINC000051133542 849436036 /nfs/dbraw/zinc/43/60/36/849436036.db2.gz SHYOISOPPDVBAA-RCZVLFRGSA-N 0 3 410.558 4.143 20 0 HIADHN CC(=O)N[C@H](C(=O)C(C#N)c1nc(-c2ccc(Cl)cc2)cs1)C1CCCC1 ZINC000051156268 849438048 /nfs/dbraw/zinc/43/80/48/849438048.db2.gz JNRWEYIRXLEHBH-WMZOPIPTSA-N 0 3 401.919 4.335 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N(C)C[C@H]2CCCO[C@@H]2c2ccccc2)N(C)C)cc1 ZINC000051713740 849508643 /nfs/dbraw/zinc/50/86/43/849508643.db2.gz VFGHSKRZDAOFHJ-TZRRMPRUSA-N 0 3 409.574 4.407 20 0 HIADHN O=C(NCc1cscn1)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000051751232 849512468 /nfs/dbraw/zinc/51/24/68/849512468.db2.gz UGNSOZUQGIRPSQ-UHFFFAOYSA-N 0 3 413.374 4.258 20 0 HIADHN COC(=O)Nc1ccc(CNC(=O)CN[C@@H](Cc2ccccc2)c2ccccc2)cc1 ZINC000051797772 849516440 /nfs/dbraw/zinc/51/64/40/849516440.db2.gz ZPVZXFONDNPVAL-QHCPKHFHSA-N 0 3 417.509 4.055 20 0 HIADHN Cc1ccc(CNC(=O)C2CCN(Cc3ccc(F)c4cccnc34)CC2)cc1F ZINC000051880207 849524505 /nfs/dbraw/zinc/52/45/05/849524505.db2.gz GQYASTIWPVTYMM-UHFFFAOYSA-N 0 3 409.480 4.350 20 0 HIADHN CC(C)Oc1ccc(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2F)c(F)c1 ZINC000052263788 849566888 /nfs/dbraw/zinc/56/68/88/849566888.db2.gz SZDNLHMTNRHOEI-UHFFFAOYSA-N 0 3 409.452 4.487 20 0 HIADHN COc1ccc(CCCN(C)C(=O)NC[C@H](c2cccs2)N2CCCC2)cc1 ZINC000052499672 849588952 /nfs/dbraw/zinc/58/89/52/849588952.db2.gz OQKUNDFFLIXPDA-HXUWFJFHSA-N 0 3 401.576 4.168 20 0 HIADHN Cc1ccccc1C(=O)NC1CCN(CCOc2ccc(Br)cc2)CC1 ZINC000052745938 849621034 /nfs/dbraw/zinc/62/10/34/849621034.db2.gz ZYNNYKJXGFRZJL-UHFFFAOYSA-N 0 3 417.347 4.031 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)CCSc3ccccc3F)c(C)c2)CC1 ZINC000052751051 849623474 /nfs/dbraw/zinc/62/34/74/849623474.db2.gz DFGGYSCYNPGWCQ-UHFFFAOYSA-N 0 3 401.551 4.397 20 0 HIADHN CC(=O)Nc1cc(C(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)ccc1F ZINC000052959582 849650142 /nfs/dbraw/zinc/65/01/42/849650142.db2.gz QCTWPFYQIDSITC-IBGZPJMESA-N 0 3 403.523 4.049 20 0 HIADHN Cc1noc(C)c1CSc1ccccc1C(=O)NCCN(C)Cc1ccccc1 ZINC000053349538 849697397 /nfs/dbraw/zinc/69/73/97/849697397.db2.gz RLRIFEKCYZOPLN-UHFFFAOYSA-N 0 3 409.555 4.446 20 0 HIADHN Cc1ccc(C(=O)C2CCN(C[C@@H](O)CO[C@H]3CCCc4ccccc43)CC2)cc1 ZINC000054421811 849863873 /nfs/dbraw/zinc/86/38/73/849863873.db2.gz WCWFDNRFPVANAG-NOZRDPDXSA-N 0 3 407.554 4.345 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N[C@H]1CCCOc2ccc(F)cc21 ZINC000054784439 849922813 /nfs/dbraw/zinc/92/28/13/849922813.db2.gz COBBQONMORWART-ZWKOTPCHSA-N 0 3 403.523 4.237 20 0 HIADHN O=C(Nc1ccccc1)[C@H]1CCCN(Cc2cccc(C(=O)N3CCCCC3)c2)C1 ZINC000054808271 849926047 /nfs/dbraw/zinc/92/60/47/849926047.db2.gz LXVTVYFBYCUNEP-QFIPXVFZSA-N 0 3 405.542 4.163 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)N1CCC[C@@H](c2nc3ccccc3[nH]2)C1 ZINC000054921000 849942606 /nfs/dbraw/zinc/94/26/06/849942606.db2.gz IDYJDIFVHYSFFH-NFBKMPQASA-N 0 3 417.557 4.289 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=S)Nc1ccc(OC(F)(F)F)cc1 ZINC000054959536 849948484 /nfs/dbraw/zinc/94/84/84/849948484.db2.gz LLXHYHYVVOCZEC-UHFFFAOYSA-N 0 3 415.456 4.485 20 0 HIADHN COc1ccc(CNCc2cccc(Cn3cccn3)c2)cc1OCc1cccnc1 ZINC000055171982 849981632 /nfs/dbraw/zinc/98/16/32/849981632.db2.gz INDHLHBICQJANS-UHFFFAOYSA-N 0 3 414.509 4.204 20 0 HIADHN CC(C)(C)CCN1CCN(CC(=O)Nc2ccc(Br)cc2Cl)CC1 ZINC000055934205 850210780 /nfs/dbraw/zinc/21/07/80/850210780.db2.gz UXPQGJVCXGJOSQ-UHFFFAOYSA-N 0 3 416.791 4.095 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)N1CCC(C)CC1)c1ccc(NC(=O)c2ccc(F)cc2)cc1 ZINC000056207181 850283936 /nfs/dbraw/zinc/28/39/36/850283936.db2.gz UFADYNFGZMNUNX-MSOLQXFVSA-N 0 3 411.521 4.376 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)N[C@H]1CCOc2c(Cl)cccc21 ZINC000056804643 850489076 /nfs/dbraw/zinc/48/90/76/850489076.db2.gz WFHYACLGRHBOET-IRXDYDNUSA-N 0 3 405.951 4.361 20 0 HIADHN CC(C)CN(C(=O)c1ccc(-n2ccc(C(F)(F)F)n2)cc1)C1CCN(C)CC1 ZINC000057048355 850539998 /nfs/dbraw/zinc/53/99/98/850539998.db2.gz OWOPSIXOVSWWRD-UHFFFAOYSA-N 0 3 408.468 4.084 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)[C@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000057114006 850550539 /nfs/dbraw/zinc/55/05/39/850550539.db2.gz JAKGHBWGDJYQME-RBUKOAKNSA-N 0 3 411.512 4.074 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)[C@H](C)Cc1ccccc1 ZINC000436959534 862140811 /nfs/dbraw/zinc/14/08/11/862140811.db2.gz AGVFGVLEDDBJQE-XXBNENTESA-N 0 3 402.542 4.456 20 0 HIADHN COc1cccc(CN2CCC(NC(=O)CCCCOc3cccc(C)c3)CC2)c1 ZINC000057433256 850637725 /nfs/dbraw/zinc/63/77/25/850637725.db2.gz OIWKKKIRRPWESH-UHFFFAOYSA-N 0 3 410.558 4.334 20 0 HIADHN Cc1ccc(NC(=O)C(C)C)cc1NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000057541575 850663855 /nfs/dbraw/zinc/66/38/55/850663855.db2.gz GRSSVDZZGWYQLG-OAQYLSRUSA-N 0 3 408.546 4.376 20 0 HIADHN Cc1ccc(NC(=O)C2CC2)cc1NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000057544068 850665705 /nfs/dbraw/zinc/66/57/05/850665705.db2.gz RBGYBPGXSHBOHY-NRFANRHFSA-N 0 3 406.530 4.130 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)Nc3ccc(N(C)C)c(C)c3)CC2)c1 ZINC000058123490 850769337 /nfs/dbraw/zinc/76/93/37/850769337.db2.gz ZHDUBUINUGEZFM-UHFFFAOYSA-N 0 3 423.605 4.093 20 0 HIADHN CC[C@@H](CNC(=O)Nc1cccc(CN(CC)C(C)=O)c1)N1CCc2ccccc2C1 ZINC000058153770 850774837 /nfs/dbraw/zinc/77/48/37/850774837.db2.gz UVKFKGWMICFJCA-DEOSSOPVSA-N 0 3 422.573 4.013 20 0 HIADHN CN(C)CCn1c2cc(NC(=O)c3ccccc3Nc3ccccc3)ccc2oc1=O ZINC000059004043 850977819 /nfs/dbraw/zinc/97/78/19/850977819.db2.gz UGOYCAZQYVXRNQ-UHFFFAOYSA-N 0 3 416.481 4.152 20 0 HIADHN Cc1ccc([C@H](CNC(=O)C2(c3ccc(Br)cc3)CC2)N(C)C)cc1 ZINC000060155891 851047313 /nfs/dbraw/zinc/04/73/13/851047313.db2.gz GQLQXRGLLWLRKG-IBGZPJMESA-N 0 3 401.348 4.208 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)/C=C/c1ccc2c(c1)OCO2 ZINC000060168102 851047888 /nfs/dbraw/zinc/04/78/88/851047888.db2.gz NDADRYJNNXWWCU-VQHVLOKHSA-N 0 3 420.431 4.038 20 0 HIADHN COc1cc([C@@H](C)NCC2=Cc3cc(Cl)cc(Cl)c3OC2)ccc1OCCO ZINC000060332798 851066425 /nfs/dbraw/zinc/06/64/25/851066425.db2.gz KYVHVEGBYFOZGR-CYBMUJFWSA-N 0 3 424.324 4.500 20 0 HIADHN CCCc1noc2nc(C3CC3)cc(C(=O)N(CCN(C)C)Cc3ccc(C)o3)c12 ZINC000060407163 851089750 /nfs/dbraw/zinc/08/97/50/851089750.db2.gz HRHRNRYWVXARGL-UHFFFAOYSA-N 0 3 410.518 4.158 20 0 HIADHN COc1cc(CN(C)C[C@@H](O)c2ccccc2C(F)(F)F)ccc1OC(F)F ZINC000060464069 851107991 /nfs/dbraw/zinc/10/79/91/851107991.db2.gz FGSQFTPDGPZEAW-OAHLLOKOSA-N 0 3 405.363 4.481 20 0 HIADHN CCOC(=O)N1CCC(NCc2c(C)nn(-c3cc(C)ccc3C)c2Cl)CC1 ZINC000060523749 851133612 /nfs/dbraw/zinc/13/36/12/851133612.db2.gz HFMVRVHNXKPVSG-UHFFFAOYSA-N 0 3 404.942 4.161 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)NCc1cccc(Br)c1 ZINC000060564727 851147981 /nfs/dbraw/zinc/14/79/81/851147981.db2.gz QQNYMIIRXJDHHE-UHFFFAOYSA-N 0 3 418.379 4.155 20 0 HIADHN O=C(CN1CCN(CC2CCCCC2)CC1)N[C@H](Cc1ccccc1)c1ccccc1 ZINC000060569236 851151025 /nfs/dbraw/zinc/15/10/25/851151025.db2.gz SSSRVQGAHIZTNC-AREMUKBSSA-N 0 3 419.613 4.285 20 0 HIADHN O=C(Nc1ccc(C(=O)N2CCN(CC3CCCCC3)CC2)cc1)c1cccs1 ZINC000060579970 851154654 /nfs/dbraw/zinc/15/46/54/851154654.db2.gz IXTGXQXCTHRPBG-UHFFFAOYSA-N 0 3 411.571 4.339 20 0 HIADHN O=C(CCc1nc(-c2ccc(Cl)cc2)no1)N1CCN(CC2CCCCC2)CC1 ZINC000060579508 851154740 /nfs/dbraw/zinc/15/47/40/851154740.db2.gz FRLCWNBENQHWFT-UHFFFAOYSA-N 0 3 416.953 4.047 20 0 HIADHN C[C@H]1CCCCN1CCNC(=O)c1cccnc1Oc1ccc(Br)cc1 ZINC000060669710 851183595 /nfs/dbraw/zinc/18/35/95/851183595.db2.gz MROKATASBYHIQU-HNNXBMFYSA-N 0 3 418.335 4.241 20 0 HIADHN COc1ccccc1OCCNCc1cc(Br)ccc1OC(F)F ZINC000060817993 851220474 /nfs/dbraw/zinc/22/04/74/851220474.db2.gz KTBGJQGFKKWTNF-UHFFFAOYSA-N 0 3 402.235 4.228 20 0 HIADHN COc1ccc(Br)cc1CNC[C@H](O)c1ccc(OC(F)(F)F)cc1 ZINC000060953033 851256279 /nfs/dbraw/zinc/25/62/79/851256279.db2.gz RKJXUIZNWFSTPC-HNNXBMFYSA-N 0 3 420.225 4.180 20 0 HIADHN c1cnn(-c2ccc(CNCc3cn(-c4ccccc4)nc3-c3ccncc3)cc2)c1 ZINC000060971048 851263381 /nfs/dbraw/zinc/26/33/81/851263381.db2.gz YVJZNEUJRSHWIE-UHFFFAOYSA-N 0 3 406.493 4.410 20 0 HIADHN Cc1nn(-c2cc(C)ccc2C)c(Cl)c1CNCCCN1CCCCCC1=O ZINC000061014561 851273434 /nfs/dbraw/zinc/27/34/34/851273434.db2.gz LYWMFBBGEZQFDX-UHFFFAOYSA-N 0 3 402.970 4.333 20 0 HIADHN CCCC(=O)Nc1cccc(NC(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)c1 ZINC000061165924 851308723 /nfs/dbraw/zinc/30/87/23/851308723.db2.gz JEOXUFLILDGMTI-UHFFFAOYSA-N 0 3 408.546 4.208 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)Nc3ccc(OC[C@H]4CCCO4)cc3)cc2)CC1 ZINC000061163763 851308867 /nfs/dbraw/zinc/30/88/67/851308867.db2.gz ZFUOPLJYCYMMKM-XMMPIXPASA-N 0 3 423.557 4.027 20 0 HIADHN CCOc1cccc(CNC(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)c1 ZINC000061190837 851313810 /nfs/dbraw/zinc/31/38/10/851313810.db2.gz WJPZJHUAOMCPID-FQEVSTJZSA-N 0 3 401.576 4.419 20 0 HIADHN O=C(/C=C/c1ccc(Br)o1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000061289642 851339218 /nfs/dbraw/zinc/33/92/18/851339218.db2.gz NFIMRVXRKGPRGD-SOFGYWHQSA-N 0 3 421.360 4.285 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2ccc(Cn3cccn3)cc2)N2CCCC2)cc1 ZINC000061786030 851451418 /nfs/dbraw/zinc/45/14/18/851451418.db2.gz XDHDKAPEYDFXOW-QHCPKHFHSA-N 0 3 403.530 4.198 20 0 HIADHN COc1ccc(CCCNC(=O)Nc2ccc(CCN3CCSCC3)cc2)cc1 ZINC000061791201 851454066 /nfs/dbraw/zinc/45/40/66/851454066.db2.gz FUVAAGMJHWLGFE-UHFFFAOYSA-N 0 3 413.587 4.041 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)Nc1ccccc1Br ZINC000062368090 851530219 /nfs/dbraw/zinc/53/02/19/851530219.db2.gz MDNPOVJWXVNYBX-UHFFFAOYSA-N 0 3 412.278 4.323 20 0 HIADHN CCCOc1ccc(CNC(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)cc1 ZINC000062484858 851563225 /nfs/dbraw/zinc/56/32/25/851563225.db2.gz DBDVGBKNAYPHQP-UHFFFAOYSA-N 0 3 405.489 4.027 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)N[C@H]1CCc2c1cccc2Cl ZINC000062500883 851566218 /nfs/dbraw/zinc/56/62/18/851566218.db2.gz GGKUTNGEWCMFLV-FQEVSTJZSA-N 0 3 407.892 4.379 20 0 HIADHN COc1cc(OC)c(NC(=S)NC2CCN(Cc3ccccc3)CC2)cc1Cl ZINC000063143414 851620355 /nfs/dbraw/zinc/62/03/55/851620355.db2.gz OOKXNDULBNYYGO-UHFFFAOYSA-N 0 3 419.978 4.308 20 0 HIADHN FC(F)(F)Oc1ccc(NNC(=S)NC2CCN(Cc3ccccc3)CC2)cc1 ZINC000063146074 851620929 /nfs/dbraw/zinc/62/09/29/851620929.db2.gz MRASOOOAFOCURP-UHFFFAOYSA-N 0 3 424.492 4.041 20 0 HIADHN CCOC(=O)Nc1ccc(NC(=S)NC2CCN(Cc3ccccc3)CC2)cc1 ZINC000063149176 851621460 /nfs/dbraw/zinc/62/14/60/851621460.db2.gz JFZIXXWLKZRNLU-UHFFFAOYSA-N 0 3 412.559 4.206 20 0 HIADHN S=C(NCc1coc(-c2cccs2)n1)NC1CCN(Cc2ccccc2)CC1 ZINC000063146176 851622088 /nfs/dbraw/zinc/62/20/88/851622088.db2.gz CXIYHCKARJKUJO-UHFFFAOYSA-N 0 3 412.584 4.032 20 0 HIADHN CC(C)(CNC(=O)c1ccc(Oc2cccnc2)cc1)N1CCc2ccccc2C1 ZINC000063288692 851652439 /nfs/dbraw/zinc/65/24/39/851652439.db2.gz RIBZKUCQIJCKNM-UHFFFAOYSA-N 0 3 401.510 4.441 20 0 HIADHN CCOCCOc1c(Cl)cccc1NC(=O)NC[C@@H](c1ccccc1)N(C)C ZINC000063397914 851678464 /nfs/dbraw/zinc/67/84/64/851678464.db2.gz NJPHZXHWBQXNKI-IBGZPJMESA-N 0 3 405.926 4.180 20 0 HIADHN O[C@@H](CNCc1ccccc1OC(F)(F)F)COc1cccc(Cl)c1Cl ZINC000063565921 851715949 /nfs/dbraw/zinc/71/59/49/851715949.db2.gz HAMOFVPUWIEONW-LBPRGKRZSA-N 0 3 410.219 4.422 20 0 HIADHN CC(C)(C)OC(=O)NC[C@@H]1CCCN(Cc2cccc(OCC(F)(F)F)c2)C1 ZINC000063628207 851728838 /nfs/dbraw/zinc/72/88/38/851728838.db2.gz WGWPLEJYZJKZSB-INIZCTEOSA-N 0 3 402.457 4.364 20 0 HIADHN CC(=O)Nc1ccc(OC[C@@H](O)CN2CC=C(c3cccc4ccccc43)CC2)cc1 ZINC000063762435 851757434 /nfs/dbraw/zinc/75/74/34/851757434.db2.gz HDTDTQFDYMHTPL-QHCPKHFHSA-N 0 3 416.521 4.327 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)c1csc(-c2ccccc2F)n1 ZINC000063827485 851773578 /nfs/dbraw/zinc/77/35/78/851773578.db2.gz SYGXLZXCIZMRGG-UHFFFAOYSA-N 0 3 401.482 4.292 20 0 HIADHN CN1C[C@@H](CN[C@H](c2ccc(Br)cc2)c2cncnc2)Cc2ccccc21 ZINC000437092372 862284337 /nfs/dbraw/zinc/28/43/37/862284337.db2.gz GWVYCKBTMRATJW-OPAMFIHVSA-N 0 3 423.358 4.227 20 0 HIADHN CN(CC(=O)N(Cc1nnc(-c2ccccc2Cl)o1)C1CC1)CC1CCCC1 ZINC000064021144 851816818 /nfs/dbraw/zinc/81/68/18/851816818.db2.gz GXHDCKCVESJORR-UHFFFAOYSA-N 0 3 402.926 4.003 20 0 HIADHN CC1CCN(C(=O)c2ccc(NC(=O)c3cccc(CN4CCCC4)c3)cc2)CC1 ZINC000064027173 851817409 /nfs/dbraw/zinc/81/74/09/851817409.db2.gz AXMCDVWLMGTFDG-UHFFFAOYSA-N 0 3 405.542 4.407 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1NC(=O)[C@@H](C)N1CCN(CC2CCCCC2)CC1 ZINC000064130026 851833630 /nfs/dbraw/zinc/83/36/30/851833630.db2.gz DNMSWPUXHOGTST-OAQYLSRUSA-N 0 3 423.605 4.014 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)/C=C/c1ccccc1C#N ZINC000064470566 851905411 /nfs/dbraw/zinc/90/54/11/851905411.db2.gz PMNPBBHBJKOSAW-FMIVXFBMSA-N 0 3 401.432 4.181 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3ccc(Oc4ccc(F)cc4)nc3)cc2)CC1 ZINC000467524613 881343082 /nfs/dbraw/zinc/34/30/82/881343082.db2.gz BDZJYQOSXSRGPK-UHFFFAOYSA-N 0 3 420.488 4.407 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1ccc(N)c([N+](=O)[O-])c1)c1ccc(C(F)(F)F)cc1 ZINC000065121974 852072057 /nfs/dbraw/zinc/07/20/57/852072057.db2.gz HXDWZIQJOIOTMJ-SFHVURJKSA-N 0 3 424.423 4.009 20 0 HIADHN CSc1nccn1-c1ccc(C(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)cc1 ZINC000065140335 852076399 /nfs/dbraw/zinc/07/63/99/852076399.db2.gz IUXYKRFFQZDFGW-PXNSSMCTSA-N 0 3 406.555 4.160 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1ccc2[nH]cnc2c1)c1ccc(C(F)(F)F)cc1 ZINC000065217601 852088298 /nfs/dbraw/zinc/08/82/98/852088298.db2.gz CFSCJNVQGWJVTI-IBGZPJMESA-N 0 3 404.436 4.395 20 0 HIADHN Cc1occc1C(=O)Nc1cc(NC(=O)NCCN(C)Cc2ccccc2)ccc1F ZINC000065444670 852134882 /nfs/dbraw/zinc/13/48/82/852134882.db2.gz WDSDLNYHJIJDHX-UHFFFAOYSA-N 0 3 424.476 4.233 20 0 HIADHN CC(C)(CNC(=O)N(Cc1ccccc1)C[C@@H]1CCCO1)N1CCc2ccccc2C1 ZINC000065477419 852150244 /nfs/dbraw/zinc/15/02/44/852150244.db2.gz MPWWUGYWKKHIKN-DEOSSOPVSA-N 0 3 421.585 4.214 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N[C@@H](C)c2cccc(OC(F)F)c2)C1 ZINC000065522719 852166418 /nfs/dbraw/zinc/16/64/18/852166418.db2.gz WTFCDPYHFWRUOD-FCEWJHQRSA-N 0 3 403.473 4.484 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)NCc2cc(Br)cs2)C1 ZINC000065522778 852167160 /nfs/dbraw/zinc/16/71/60/852167160.db2.gz TYNCSWQFLLKSID-BBRMVZONSA-N 0 3 408.365 4.145 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)NNc2ccc(F)cc2Br)C1 ZINC000065521659 852167185 /nfs/dbraw/zinc/16/71/85/852167185.db2.gz BMWGQRGFMSKGIS-CJNGLKHVSA-N 0 3 421.314 4.050 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)NCc2cccc(NC(=O)C3CCC3)c2)C1 ZINC000065523695 852168094 /nfs/dbraw/zinc/16/80/94/852168094.db2.gz WPJIIASSUMHTKA-MBSDFSHPSA-N 0 3 420.557 4.060 20 0 HIADHN CC(C)(C)[C@H](CN1CCc2ccccc2C1)NC(=O)c1ccc(Cn2ccnc2)cc1 ZINC000065791201 852257917 /nfs/dbraw/zinc/25/79/17/852257917.db2.gz CCJOLEZWHDTGJA-DEOSSOPVSA-N 0 3 416.569 4.134 20 0 HIADHN CC(C)Oc1ccc(C(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)cn1 ZINC000065938933 852327733 /nfs/dbraw/zinc/32/77/33/852327733.db2.gz RNIIYNHVMZPUJR-UHFFFAOYSA-N 0 3 409.452 4.092 20 0 HIADHN CCCOc1c(Cl)cc(C(=O)N(CCN(C)C)Cc2cccc(F)c2)cc1OC ZINC000065939171 852327889 /nfs/dbraw/zinc/32/78/89/852327889.db2.gz GAZQUBBYKXPUCP-UHFFFAOYSA-N 0 3 422.928 4.481 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)c1c(Cl)c2ccccc2n1C ZINC000065938516 852328389 /nfs/dbraw/zinc/32/83/89/852328389.db2.gz YDSAVFZPTZGMMS-UHFFFAOYSA-N 0 3 405.876 4.314 20 0 HIADHN Cc1noc2nc(C)cc(C(=O)N(CCN(C)C)Cc3cccc(C(F)(F)F)c3)c12 ZINC000065938984 852328469 /nfs/dbraw/zinc/32/84/69/852328469.db2.gz OMCREPNAXVHZCV-UHFFFAOYSA-N 0 3 420.435 4.062 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)c1csc(-c2ccccc2F)n1 ZINC000065939228 852328503 /nfs/dbraw/zinc/32/85/03/852328503.db2.gz HFNAXYMMJBAMMI-UHFFFAOYSA-N 0 3 401.482 4.292 20 0 HIADHN O=C(CN1CCC(c2cc3ccccc3[nH]2)CC1)N1CCc2[nH]c3ccccc3c2C1 ZINC000065966399 852335978 /nfs/dbraw/zinc/33/59/78/852335978.db2.gz SUZJVBGMIVPEBF-UHFFFAOYSA-N 0 3 412.537 4.414 20 0 HIADHN Cc1cc(NC(=O)N(CCN2CCCC2)Cc2ccc(Cl)c(Cl)c2)n(C)n1 ZINC000065984669 852341423 /nfs/dbraw/zinc/34/14/23/852341423.db2.gz PMWYSFZZUFOAIR-UHFFFAOYSA-N 0 3 410.349 4.165 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N[C@H](C)c2cccc(N3CCCC3=O)c2)N(C)C)cc1 ZINC000065994812 852349047 /nfs/dbraw/zinc/34/90/47/852349047.db2.gz FYRAWKBBZMTVAV-JPYJTQIMSA-N 0 3 422.573 4.039 20 0 HIADHN Cc1ccccc1C(=O)N[C@@H](CC(C)C)C(=O)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000069251076 852390238 /nfs/dbraw/zinc/39/02/38/852390238.db2.gz SHLYXCMITZGMNX-ZEQRLZLVSA-N 0 3 421.585 4.093 20 0 HIADHN Cc1nn(Cc2ccccc2Cl)c(C)c1C(=O)NCc1ccccc1CN(C)C ZINC000071802620 852408099 /nfs/dbraw/zinc/40/80/99/852408099.db2.gz MWXXMRMBWKNMET-UHFFFAOYSA-N 0 3 410.949 4.193 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N2CCC[C@H]2c2ccc3c(c2)OCCO3)N(C)C)cc1 ZINC000071923236 852432047 /nfs/dbraw/zinc/43/20/47/852432047.db2.gz AJJRWUMASWKZDC-VXKWHMMOSA-N 0 3 423.557 4.170 20 0 HIADHN COc1ccc([C@H]2CCCN2C(=O)NC[C@H](c2ccc(C)cc2)N(C)C)c(OC)c1 ZINC000072044296 852484442 /nfs/dbraw/zinc/48/44/42/852484442.db2.gz KXFWRVYDMVLMSW-FGZHOGPDSA-N 0 3 411.546 4.162 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)NC[C@@H](c2ccc(C)cc2)N(C)C)c(OC)c1 ZINC000072044298 852484497 /nfs/dbraw/zinc/48/44/97/852484497.db2.gz KXFWRVYDMVLMSW-VXKWHMMOSA-N 0 3 411.546 4.162 20 0 HIADHN COc1ccc2[nH]cc(C3=CCN(C[C@H](O)COc4cccc5[nH]ccc54)CC3)c2c1 ZINC000079698850 852544058 /nfs/dbraw/zinc/54/40/58/852544058.db2.gz GBSLJJRFLANJRX-SFHVURJKSA-N 0 3 417.509 4.187 20 0 HIADHN CCN1CCn2c(-c3ccccc3)cnc2C12CCN(Cc1ccc(OC)cc1)CC2 ZINC000096062636 852547137 /nfs/dbraw/zinc/54/71/37/852547137.db2.gz ACUONWFUUBBUEL-UHFFFAOYSA-N 0 3 416.569 4.386 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)[C@H]1C[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000097261428 852593327 /nfs/dbraw/zinc/59/33/27/852593327.db2.gz UGLVFNSQTKJVJR-ROUUACIJSA-N 0 3 412.521 4.287 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cc(C)n(-c2cc(C)on2)c1C)c1ccsc1 ZINC000097327273 852601536 /nfs/dbraw/zinc/60/15/36/852601536.db2.gz DLOYGQBFHHYFFC-LJQANCHMSA-N 0 3 400.548 4.265 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cc(F)cc2[nH]c(=S)[nH]c21)c1cccc(OC)c1 ZINC000097507806 852621435 /nfs/dbraw/zinc/62/14/35/852621435.db2.gz LZOQJDAUJPYYDZ-GOSISDBHSA-N 0 3 416.522 4.186 20 0 HIADHN C[C@@H](SCC(=O)NC[C@H](c1ccccc1)N1CCCC1)c1nc2ccccc2[nH]1 ZINC000097656486 852645707 /nfs/dbraw/zinc/64/57/07/852645707.db2.gz CNONAFOFURRISD-DYESRHJHSA-N 0 3 408.571 4.310 20 0 HIADHN C[C@H](C(=O)Nc1ccccc1C(F)(F)F)N1CCCN(Cc2ccccc2)CC1 ZINC000105523859 852710676 /nfs/dbraw/zinc/71/06/76/852710676.db2.gz OKIBDDOHMWCUQT-QGZVFWFLSA-N 0 3 405.464 4.240 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)c2ccc(Cl)cc2Cl)CC1 ZINC000106189004 852760516 /nfs/dbraw/zinc/76/05/16/852760516.db2.gz PLNIVONZTFMXHE-UHFFFAOYSA-N 0 3 406.357 4.061 20 0 HIADHN Cc1ccc(NC(=O)C2CCN(Cc3cccc(OCC(F)(F)F)c3)CC2)nc1 ZINC000108447034 852851656 /nfs/dbraw/zinc/85/16/56/852851656.db2.gz KFAFAWDEFZNWFU-UHFFFAOYSA-N 0 3 407.436 4.182 20 0 HIADHN COc1cccc2sc(NC(=O)c3ccc(N4CCN(C(C)C)CC4)cc3)nc21 ZINC000109187937 852933323 /nfs/dbraw/zinc/93/33/23/852933323.db2.gz PLQALWSIMAHCBX-UHFFFAOYSA-N 0 3 410.543 4.088 20 0 HIADHN Cc1c(C(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)cnn1-c1ccccc1F ZINC000109503470 852978085 /nfs/dbraw/zinc/97/80/85/852978085.db2.gz QXDLDDQAQBCPFQ-QHCPKHFHSA-N 0 3 406.505 4.195 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)OCc3ncc(-c4ccccc4)o3)cc2)CC1 ZINC000109852375 853024102 /nfs/dbraw/zinc/02/41/02/853024102.db2.gz VOMRMYPQVFJSDI-UHFFFAOYSA-N 0 3 405.498 4.229 20 0 HIADHN O=C(Nc1ccc(C(=O)Nc2ccccc2)cc1)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000110070396 853056704 /nfs/dbraw/zinc/05/67/04/853056704.db2.gz MUMUUNGVFMKZCA-QHCPKHFHSA-N 0 3 414.509 4.335 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)C3(c4cccc(Cl)c4)CCCC3)CC2)C[C@H](C)O1 ZINC000110407291 853096121 /nfs/dbraw/zinc/09/61/21/853096121.db2.gz CZPSETZMQSDTKM-KDURUIRLSA-N 0 3 419.009 4.500 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)c(Cl)c1 ZINC000110589468 853122946 /nfs/dbraw/zinc/12/29/46/853122946.db2.gz RFMJNBHTOQDVIE-UHFFFAOYSA-N 0 3 414.937 4.081 20 0 HIADHN CN(CCN1CCCC1)C(=O)c1ccccc1OCc1ccccc1Br ZINC000110912385 853167305 /nfs/dbraw/zinc/16/73/05/853167305.db2.gz PHTYYNZHONPYBU-UHFFFAOYSA-N 0 3 417.347 4.196 20 0 HIADHN CC(C)(C)OC(=O)NC1CCN(CCC(=O)Nc2cc(Cl)ccc2Cl)CC1 ZINC000110981918 853178808 /nfs/dbraw/zinc/17/88/08/853178808.db2.gz LKODUMSQFNWDHH-UHFFFAOYSA-N 0 3 416.349 4.311 20 0 HIADHN O=C(NCCCOc1cccc2cccnc21)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000111021362 853189189 /nfs/dbraw/zinc/18/91/89/853189189.db2.gz WLAMXOVFSFIMJU-NRFANRHFSA-N 0 3 421.516 4.171 20 0 HIADHN C[C@H](NC(C)(C)CNS(=O)(=O)c1ccccc1C(F)(F)F)c1ccccc1 ZINC000111048668 853193491 /nfs/dbraw/zinc/19/34/91/853193491.db2.gz KFNNBCQQKSZFBP-AWEZNQCLSA-N 0 3 400.466 4.113 20 0 HIADHN C[C@H]1Cc2ccccc2N1Cc1occc1C(=O)NC[C@@H](c1ccccc1)N(C)C ZINC000111141224 853209092 /nfs/dbraw/zinc/20/90/92/853209092.db2.gz TZWDNYJWDQCDTQ-MBSDFSHPSA-N 0 3 403.526 4.264 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)NC[C@@H](c2cccs2)N2CCCC2)c(Cl)c1 ZINC000111217340 853226096 /nfs/dbraw/zinc/22/60/96/853226096.db2.gz JVSBCECHTWRNHJ-KRWDZBQOSA-N 0 3 406.939 4.319 20 0 HIADHN CC(C)(C)OC(=O)NCc1cccc(NC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000112592077 853233601 /nfs/dbraw/zinc/23/36/01/853233601.db2.gz GBCQOZKAYOPHPD-OAQYLSRUSA-N 0 3 424.545 4.107 20 0 HIADHN O=C(Nc1cccc(-c2ncc[nH]2)c1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000112650155 853236428 /nfs/dbraw/zinc/23/64/28/853236428.db2.gz YUFZYQMAAKNJNJ-NRFANRHFSA-N 0 3 414.431 4.470 20 0 HIADHN O=C1NC2(CCCC2)C(=O)N1CCN1CCCC[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000112692489 853238683 /nfs/dbraw/zinc/23/86/83/853238683.db2.gz GWFWMHFHYVMHAB-KRWDZBQOSA-N 0 3 409.452 4.097 20 0 HIADHN O=C(Nc1cccc(NC(=O)[C@@H]2CCCN(Cc3cccnc3)C2)c1)c1cccs1 ZINC000115840333 853268445 /nfs/dbraw/zinc/26/84/45/853268445.db2.gz KUXQGPZLXPKUBQ-GOSISDBHSA-N 0 3 420.538 4.246 20 0 HIADHN Cc1ccc([C@H](CNC(=O)[C@@H]2CCCN(c3nc4ccccc4s3)C2)N(C)C)cc1 ZINC000116026843 853280420 /nfs/dbraw/zinc/28/04/20/853280420.db2.gz YGWYTZZPYIAHSR-CTNGQTDRSA-N 0 3 422.598 4.240 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)CSCc2cc(-c3cccs3)on2)N(C)C)cc1 ZINC000116183600 853290304 /nfs/dbraw/zinc/29/03/04/853290304.db2.gz ZDYJXIXWFLOJGX-GOSISDBHSA-N 0 3 415.584 4.364 20 0 HIADHN Cc1ccc2c(CN3CCC(c4nc(-c5ccccc5)n[nH]4)CC3)cc(=O)oc2c1 ZINC000116499976 853309962 /nfs/dbraw/zinc/30/99/62/853309962.db2.gz OWCPSWKKHSXIFI-UHFFFAOYSA-N 0 3 400.482 4.266 20 0 HIADHN CCn1c2ccccc2nc1[C@H]1CCCN1C(=O)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000116596170 853317922 /nfs/dbraw/zinc/31/79/22/853317922.db2.gz BOFWDOSWAHVCOO-NFBKMPQASA-N 0 3 417.557 4.027 20 0 HIADHN COc1ccc2oc(C)c(C(=O)NCCCCN3CCN(c4ccccc4)CC3)c2c1 ZINC000117624210 853363365 /nfs/dbraw/zinc/36/33/65/853363365.db2.gz BXABTZJXQBXXOQ-UHFFFAOYSA-N 0 3 421.541 4.082 20 0 HIADHN Brc1ccc(CNCc2ccc3c(c2)OCCO3)cc1Br ZINC000124493091 853369032 /nfs/dbraw/zinc/36/90/32/853369032.db2.gz MYCAGKQQCIYOTQ-UHFFFAOYSA-N 0 3 413.109 4.273 20 0 HIADHN Cc1cc(Cl)ccc1NC(=O)[C@@H](C)N[C@H](C)c1ccc(N2CCOCC2)cc1 ZINC000140188011 853437426 /nfs/dbraw/zinc/43/74/26/853437426.db2.gz LQPUXPFCHUQBNK-IAGOWNOFSA-N 0 3 401.938 4.163 20 0 HIADHN Cc1c(Cl)cccc1NC(=O)[C@@H](C)N[C@@H](C)c1ccc(N2CCOCC2)cc1 ZINC000140200595 853437696 /nfs/dbraw/zinc/43/76/96/853437696.db2.gz FKFUOUFRTNBLDH-DLBZAZTESA-N 0 3 401.938 4.163 20 0 HIADHN Cc1cc(CN[C@@H](C)C(=O)NCc2ccccc2)cc(C)c1OCc1ccccn1 ZINC000140328819 853441636 /nfs/dbraw/zinc/44/16/36/853441636.db2.gz YNUADASEPOBLAZ-FQEVSTJZSA-N 0 3 403.526 4.072 20 0 HIADHN O=c1ccccn1Cc1ccc(CNCc2cccc(OCc3ccccn3)c2)cc1 ZINC000140415695 853444261 /nfs/dbraw/zinc/44/42/61/853444261.db2.gz PRGVERHFBWFQPZ-UHFFFAOYSA-N 0 3 411.505 4.160 20 0 HIADHN Cc1ccc2nc([C@H]3CCCN3C(=O)NC[C@H](c3ccc(F)cc3)N(C)C)[nH]c2c1 ZINC000140959100 853458116 /nfs/dbraw/zinc/45/81/16/853458116.db2.gz KMVIIDKCSOPXAT-NHCUHLMSSA-N 0 3 409.509 4.160 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)NCc2coc(-c3cccs3)n2)N2CCCC2)cc1 ZINC000141717338 853478710 /nfs/dbraw/zinc/47/87/10/853478710.db2.gz SFJWRTOGFHELPN-LJQANCHMSA-N 0 3 410.543 4.348 20 0 HIADHN Cc1ccc([C@H](CNC(=O)C2(c3ccccc3C)CCOCC2)N2CCCC2)cc1 ZINC000143024216 853505964 /nfs/dbraw/zinc/50/59/64/853505964.db2.gz NRNVITWXTUCWOL-DEOSSOPVSA-N 0 3 406.570 4.305 20 0 HIADHN CN(Cc1nc2ccccc2s1)C(=S)NC1CCN(Cc2ccccc2)CC1 ZINC000145499973 853552586 /nfs/dbraw/zinc/55/25/86/853552586.db2.gz LOFQPGOEFSVFIR-UHFFFAOYSA-N 0 3 410.612 4.267 20 0 HIADHN Fc1ccc2c(c1)[C@@H](NC(=S)NC1CCN(Cc3ccccc3)CC1)CCCO2 ZINC000145699557 853556496 /nfs/dbraw/zinc/55/64/96/853556496.db2.gz KGQCSXIUSIGTDV-NRFANRHFSA-N 0 3 413.562 4.168 20 0 HIADHN O=C(NCc1ccc(OCC(F)(F)F)cc1)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000195601219 853706561 /nfs/dbraw/zinc/70/65/61/853706561.db2.gz HHXFCQZGJZCQCX-FQEVSTJZSA-N 0 3 421.463 4.264 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)N(Cc1ccccc1)C[C@H]1CCCO1 ZINC000195613368 853715293 /nfs/dbraw/zinc/71/52/93/853715293.db2.gz BMAXPPBLEBYUDT-RPWUZVMVSA-N 0 3 407.558 4.214 20 0 HIADHN CN(Cc1ccccc1Br)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000195648602 853736948 /nfs/dbraw/zinc/73/69/48/853736948.db2.gz VULBOPTXWDQRRK-IBGZPJMESA-N 0 3 416.363 4.255 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3ccc(OC)c(Cl)c3)c(C)c2)CC1 ZINC000195700794 853766727 /nfs/dbraw/zinc/76/67/27/853766727.db2.gz RORFNAWDGPZARL-UHFFFAOYSA-N 0 3 402.926 4.443 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(S(=O)(=O)N(C)C)cc1)c1ccc(Br)cc1 ZINC000195702201 853768258 /nfs/dbraw/zinc/76/82/58/853768258.db2.gz ONJDNQOHBCNBLD-KGLIPLIRSA-N 0 3 411.365 4.111 20 0 HIADHN CCN(CC)CCN(Cc1ccccc1)S(=O)(=O)c1ccccc1C(F)(F)F ZINC000195707479 853771151 /nfs/dbraw/zinc/77/11/51/853771151.db2.gz OLFKPSFYVVWJLZ-UHFFFAOYSA-N 0 3 414.493 4.238 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cc(Br)cs1)c1cccc(OC)c1 ZINC000195714579 853774752 /nfs/dbraw/zinc/77/47/52/853774752.db2.gz IACZXBGRXDXUDF-INIZCTEOSA-N 0 3 411.365 4.332 20 0 HIADHN O=C(NCc1ccc(Br)c(F)c1)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000195740863 853788346 /nfs/dbraw/zinc/78/83/46/853788346.db2.gz IUTBQJTVPCBECJ-IBGZPJMESA-N 0 3 420.326 4.225 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)NCc3ccc(OC(F)(F)F)cc3)cc2)CC1 ZINC000195742361 853789420 /nfs/dbraw/zinc/78/94/20/853789420.db2.gz IOJIJRDLRFAXSD-UHFFFAOYSA-N 0 3 421.463 4.046 20 0 HIADHN Cc1cc(-n2c(C)cc(C(=O)NC[C@H](c3ccc(C)cc3)N3CCCC3)c2C)no1 ZINC000195745130 853791180 /nfs/dbraw/zinc/79/11/80/853791180.db2.gz CHNIVBPPAKFFMW-JOCHJYFZSA-N 0 3 406.530 4.266 20 0 HIADHN COc1ccccc1NC(=O)C1CCN(CCOc2ccccc2C(F)(F)F)CC1 ZINC000215889976 853839243 /nfs/dbraw/zinc/83/92/43/853839243.db2.gz KMCSSMZBXRMZDU-UHFFFAOYSA-N 0 3 422.447 4.444 20 0 HIADHN CCOc1c(Br)cc(Br)cc1CNC[C@H](O)CC(C)C ZINC000224268112 853878722 /nfs/dbraw/zinc/87/87/22/853878722.db2.gz CXQZQEWSPRJRFP-CYBMUJFWSA-N 0 3 409.162 4.107 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)CSc2ccc(C(F)(F)F)cn2)C1 ZINC000227469833 853885870 /nfs/dbraw/zinc/88/58/70/853885870.db2.gz AXRGUKJMFORCHX-WMLDXEAASA-N 0 3 409.477 4.144 20 0 HIADHN CC(C)Oc1ccc(CN[C@H](C)CC(=O)Nc2ccc(Br)cc2)cn1 ZINC000236722313 853915585 /nfs/dbraw/zinc/91/55/85/853915585.db2.gz QZVIDDZHBIGFJD-CQSZACIVSA-N 0 3 406.324 4.138 20 0 HIADHN CCOC(=O)N1CCC(NCc2csc(-c3cccc(Br)c3)n2)CC1 ZINC000236897541 853934062 /nfs/dbraw/zinc/93/40/62/853934062.db2.gz ABYAGLLSZAPBKJ-UHFFFAOYSA-N 0 3 424.364 4.283 20 0 HIADHN CCOc1cc(CNC(C)(C)c2ccc(F)cc2)ccc1O[C@H](C)C(=O)N(C)C ZINC000236909674 853936330 /nfs/dbraw/zinc/93/63/30/853936330.db2.gz VCZUPTQEMBULCN-MRXNPFEDSA-N 0 3 402.510 4.105 20 0 HIADHN CCNC(=O)COc1ccc(CN[C@H]2CCc3c2ccc(Cl)c3Cl)cc1OC ZINC000236913329 853937411 /nfs/dbraw/zinc/93/74/11/853937411.db2.gz HOQHMRLQHDWANM-KRWDZBQOSA-N 0 3 423.340 4.294 20 0 HIADHN CC[C@H](NCc1ccc(Br)c(C)c1)c1ccccc1OCC(=O)N(C)C ZINC000236932184 853939279 /nfs/dbraw/zinc/93/92/79/853939279.db2.gz RMGZORWDTLSHFW-IBGZPJMESA-N 0 3 419.363 4.465 20 0 HIADHN CCCOc1c(Br)cc(CNC[C@H](c2ccco2)N(C)C)cc1OC ZINC000236991199 853948144 /nfs/dbraw/zinc/94/81/44/853948144.db2.gz KOJKRMWWPWGJMF-MRXNPFEDSA-N 0 3 411.340 4.232 20 0 HIADHN CN(C)[C@H](CNCc1nc(-c2ccc(Br)cc2)c[nH]1)c1cccc(F)c1 ZINC000237040094 853955689 /nfs/dbraw/zinc/95/56/89/853955689.db2.gz BDVWCOHCDICERV-LJQANCHMSA-N 0 3 417.326 4.371 20 0 HIADHN Cc1nn(Cc2ccc(C)cc2)c(Cl)c1CNCCc1cccc(C(=O)N(C)C)c1 ZINC000237073580 853960186 /nfs/dbraw/zinc/96/01/86/853960186.db2.gz WWIFLIHXMHACTQ-UHFFFAOYSA-N 0 3 424.976 4.236 20 0 HIADHN COC(=O)c1cc(CN[C@H](Cc2ccccc2C)c2ccc(OC)c(OC)c2)c[nH]1 ZINC000237084349 853962192 /nfs/dbraw/zinc/96/21/92/853962192.db2.gz BJZSGDNTEOFERB-HXUWFJFHSA-N 0 3 408.498 4.201 20 0 HIADHN CN(C(=O)c1ccncc1)c1ccc(CNCc2cc(Br)cs2)cc1 ZINC000237093329 853963039 /nfs/dbraw/zinc/96/30/39/853963039.db2.gz WSVYIQUYHWWYFK-UHFFFAOYSA-N 0 3 416.344 4.472 20 0 HIADHN COc1ccccc1-c1ccc(CNCc2ccc(CN3CCOCC3)cc2)cc1 ZINC000237097103 853964108 /nfs/dbraw/zinc/96/41/08/853964108.db2.gz NUWIKCZLKVULBT-UHFFFAOYSA-N 0 3 402.538 4.484 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CNCc1c(Cl)cccc1N1CCN(C)CC1 ZINC000237101755 853965616 /nfs/dbraw/zinc/96/56/16/853965616.db2.gz FLGPPEUOPHNOMU-UHFFFAOYSA-N 0 3 423.992 4.184 20 0 HIADHN COC(=O)c1cc(CNCc2cn(Cc3ccccc3)nc2-c2ccccc2)c[nH]1 ZINC000237126428 853968320 /nfs/dbraw/zinc/96/83/20/853968320.db2.gz KYZCJYNJHWSDMX-UHFFFAOYSA-N 0 3 400.482 4.003 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)C[C@@H](C)NCc1cnn(Cc2ccccc2)c1 ZINC000237132084 853969667 /nfs/dbraw/zinc/96/96/67/853969667.db2.gz LASXDNDUGZHADK-MRXNPFEDSA-N 0 3 412.921 4.100 20 0 HIADHN COC(=O)COc1c(C)cc(CNCc2ccc(Oc3cccc(F)c3)nc2)cc1C ZINC000237184771 853977864 /nfs/dbraw/zinc/97/78/64/853977864.db2.gz INVCECPWICHDBN-UHFFFAOYSA-N 0 3 424.472 4.471 20 0 HIADHN COc1cc(CNCc2ccc3c(c2)CC(C)(C)O3)cc(Br)c1OC ZINC000237271379 853995035 /nfs/dbraw/zinc/99/50/35/853995035.db2.gz VYGNUZMUJIIIJM-UHFFFAOYSA-N 0 3 406.320 4.470 20 0 HIADHN COc1ccc([C@@H](O)CNCc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)cc1 ZINC000237284301 853997613 /nfs/dbraw/zinc/99/76/13/853997613.db2.gz OSPNKJYVUWVURL-NRFANRHFSA-N 0 3 412.417 4.358 20 0 HIADHN CS(=O)(=O)CC1(CNCc2cccc(Oc3cccc(C(F)(F)F)c3)c2)CC1 ZINC000237297252 854000748 /nfs/dbraw/zinc/00/07/48/854000748.db2.gz NMGASHDGNSEEAZ-UHFFFAOYSA-N 0 3 413.461 4.412 20 0 HIADHN COc1ccc(NC(=O)C[C@H](C)N[C@@H]2CCSc3c(F)cccc32)c(OC)c1 ZINC000237306175 854002474 /nfs/dbraw/zinc/00/24/74/854002474.db2.gz ZEBPDDGLVSINEQ-SUMWQHHRSA-N 0 3 404.507 4.387 20 0 HIADHN COc1ccc(NC(=O)C[C@H](C)N[C@H]2CCSc3c(F)cccc32)c(OC)c1 ZINC000237307477 854003714 /nfs/dbraw/zinc/00/37/14/854003714.db2.gz ZEBPDDGLVSINEQ-GUYCJALGSA-N 0 3 404.507 4.387 20 0 HIADHN COc1cc(CNCc2ccc(C)cc2SC)ccc1OCC(=O)N1CCCC1 ZINC000237311464 854004669 /nfs/dbraw/zinc/00/46/69/854004669.db2.gz YUOUYRKVNXCTHP-UHFFFAOYSA-N 0 3 414.571 4.017 20 0 HIADHN COc1cc(OC)c(CNC2CCN(Cc3ccc(Cl)cc3)CC2)c(OC)c1 ZINC000237327280 854007732 /nfs/dbraw/zinc/00/77/32/854007732.db2.gz BGWSJSGGGPUMNI-UHFFFAOYSA-N 0 3 404.938 4.120 20 0 HIADHN COc1cc2c(c(CNCCC(=O)Nc3cc(C)c(Cl)cc3OC)c1)O[C@@H](C)C2 ZINC000237385695 854019666 /nfs/dbraw/zinc/01/96/66/854019666.db2.gz BYLQLSINIYJPFS-AWEZNQCLSA-N 0 3 418.921 4.107 20 0 HIADHN COc1cc(CN[C@H](C)c2cc3ccccc3s2)cc(Cl)c1OCC(N)=O ZINC000237391627 854021277 /nfs/dbraw/zinc/02/12/77/854021277.db2.gz FFNUXTFGQDOULC-GFCCVEGCSA-N 0 3 404.919 4.278 20 0 HIADHN Cc1nn(-c2ccccc2)c(Oc2ccc(Br)cc2)c1CN[C@H](C)CO ZINC000237392256 854021476 /nfs/dbraw/zinc/02/14/76/854021476.db2.gz IVILRGSNVILQNN-CQSZACIVSA-N 0 3 416.319 4.206 20 0 HIADHN COc1ccc(OC)c(NC(=O)C[C@H](C)NCc2oc3ccc(F)cc3c2C)c1 ZINC000237402249 854024672 /nfs/dbraw/zinc/02/46/72/854024672.db2.gz NOJDLABLQYYOSQ-ZDUSSCGKSA-N 0 3 400.450 4.404 20 0 HIADHN COc1cc2c(c(CN[C@H](C)CC(=O)Nc3cccc(N4CCCC4)c3)c1)O[C@H](C)C2 ZINC000237429349 854031654 /nfs/dbraw/zinc/03/16/54/854031654.db2.gz HGBWPWXNCUPEON-QZTJIDSGSA-N 0 3 423.557 4.126 20 0 HIADHN CSC1(CNCc2c(C)nn(-c3cccc(Cl)c3)c2Cl)CCOCC1 ZINC000237489630 854044437 /nfs/dbraw/zinc/04/44/37/854044437.db2.gz MACWLAGUEFEKJN-UHFFFAOYSA-N 0 3 400.375 4.489 20 0 HIADHN C[C@H](NCc1ccc(-n2ccc(C(F)(F)F)n2)cc1)c1ccc(S(C)(=O)=O)cc1 ZINC000237583217 854058374 /nfs/dbraw/zinc/05/83/74/854058374.db2.gz VTTXQJLXUPFWKV-AWEZNQCLSA-N 0 3 423.460 4.145 20 0 HIADHN Cc1nn(Cc2ccc(F)cc2)c(Cl)c1CNCCCNC(=O)c1cccs1 ZINC000237609459 854061689 /nfs/dbraw/zinc/06/16/89/854061689.db2.gz CIEOZWRCRITDLE-UHFFFAOYSA-N 0 3 420.941 4.004 20 0 HIADHN Cc1nc(COc2ccc(CNC3(c4ccc(Br)cc4)CC3)cc2)no1 ZINC000237654404 854069120 /nfs/dbraw/zinc/06/91/20/854069120.db2.gz LNOAVBWTEGPWBL-UHFFFAOYSA-N 0 3 414.303 4.498 20 0 HIADHN C[C@H]1C[C@H]1c1ccc(CNCc2cc(C(F)(F)F)ccc2N2CCN(C)CC2)o1 ZINC000237667383 854071983 /nfs/dbraw/zinc/07/19/83/854071983.db2.gz LWDGTSSMWJGAFL-HNAYVOBHSA-N 0 3 407.480 4.463 20 0 HIADHN Cc1nn(-c2ccc(Br)cc2)c(C)c1CNC[C@@H](O)c1ccsc1 ZINC000237700351 854079179 /nfs/dbraw/zinc/07/91/79/854079179.db2.gz ONQNKGVDFZHVND-GOSISDBHSA-N 0 3 406.349 4.136 20 0 HIADHN Cc1ccccc1COc1c(C)cc(CNCc2cccc(OCC(N)=O)c2)cc1C ZINC000237752656 854088788 /nfs/dbraw/zinc/08/87/88/854088788.db2.gz JPTKSXMOWBTWIV-UHFFFAOYSA-N 0 3 418.537 4.345 20 0 HIADHN NC(=O)c1cccc(CCNCc2sc(Sc3ccccc3)nc2Cl)c1 ZINC000237757741 854089510 /nfs/dbraw/zinc/08/95/10/854089510.db2.gz OLPGPNYNKWKSPL-UHFFFAOYSA-N 0 3 403.960 4.379 20 0 HIADHN O=C(NCCNCc1cc2ccccc2nc1N1CCCCC1)c1c(F)cccc1F ZINC000237765033 854091922 /nfs/dbraw/zinc/09/19/22/854091922.db2.gz JEGATHWSKJTCCD-UHFFFAOYSA-N 0 3 424.495 4.023 20 0 HIADHN Cc1ccc(Br)cc1NC(=O)CCNCc1ccccc1OC(F)F ZINC000237789778 854097964 /nfs/dbraw/zinc/09/79/64/854097964.db2.gz UXTVBEOXWOCPSW-UHFFFAOYSA-N 0 3 413.262 4.477 20 0 HIADHN Fc1ccc(C2(NCc3cnc4ccc(Br)cn34)CCOCC2)cc1 ZINC000237829266 854105639 /nfs/dbraw/zinc/10/56/39/854105639.db2.gz OUBQFQYAUHTEAK-UHFFFAOYSA-N 0 3 404.283 4.031 20 0 HIADHN Cc1nn(Cc2ccc(C)cc2)c(Cl)c1CNCCCOCC1CCOCC1 ZINC000237855848 854108326 /nfs/dbraw/zinc/10/83/26/854108326.db2.gz GNQXPBGLGRZDFD-UHFFFAOYSA-N 0 3 405.970 4.125 20 0 HIADHN Cc1ccc(CNCc2ccnc(N3CCN(c4ccc(F)cc4)CC3)c2)c(C)c1 ZINC000237882881 854113890 /nfs/dbraw/zinc/11/38/90/854113890.db2.gz KQULRLVGGNLKKK-UHFFFAOYSA-N 0 3 404.533 4.454 20 0 HIADHN Cc1cccn2cc(COc3ccc(CNCc4ccnc(-n5ccnc5)c4)cc3)nc12 ZINC000237894358 854115663 /nfs/dbraw/zinc/11/56/63/854115663.db2.gz MRTCACQAZXOKSG-UHFFFAOYSA-N 0 3 424.508 4.092 20 0 HIADHN OCC[C@H](CNCc1nc(-c2cccc(Br)c2)c[nH]1)c1ccccc1 ZINC000238196258 854152535 /nfs/dbraw/zinc/15/25/35/854152535.db2.gz JGMUIXPYOZNGJU-QGZVFWFLSA-N 0 3 400.320 4.095 20 0 HIADHN Cc1ccc(C(=O)N(CCN(C)C)Cc2ccccc2)cc1NC(=O)c1ccco1 ZINC000248022033 854173475 /nfs/dbraw/zinc/17/34/75/854173475.db2.gz RPYUAUUXKBLMPS-UHFFFAOYSA-N 0 3 405.498 4.044 20 0 HIADHN O=C(CN1CCC[C@H](c2ccccc2)CC1)N1CCC[C@H]1c1ccc2c(c1)OCCO2 ZINC000250800380 854195456 /nfs/dbraw/zinc/19/54/56/854195456.db2.gz DVFHSUWGDVTCGA-GMAHTHKFSA-N 0 3 420.553 4.391 20 0 HIADHN Cc1nn(C)c2ncc(CN3CCC[C@H](c4nc(-c5ccc(Cl)cc5)no4)C3)cc12 ZINC000261417342 854255249 /nfs/dbraw/zinc/25/52/49/854255249.db2.gz WVZNVMLBLQFGJB-KRWDZBQOSA-N 0 3 422.920 4.360 20 0 HIADHN CCCO[C@@H]1CCCN(CC(=O)N2Cc3ccccc3[C@H](c3ccccc3)C2)CC1 ZINC000261421075 854256392 /nfs/dbraw/zinc/25/63/92/854256392.db2.gz DMSDAWHTKFMOMT-NOZRDPDXSA-N 0 3 406.570 4.442 20 0 HIADHN CN(C)[C@@H](CNc1ccc(C(=O)N2CCc3ccccc32)cn1)c1cccc(F)c1 ZINC000301222913 854332151 /nfs/dbraw/zinc/33/21/51/854332151.db2.gz DDUQCELYYBOQOI-QFIPXVFZSA-N 0 3 404.489 4.138 20 0 HIADHN CN(C)[C@@H](CNc1ccc(C(=O)N2CCc3ccccc32)cn1)c1ccc(F)cc1 ZINC000301242097 854337498 /nfs/dbraw/zinc/33/74/98/854337498.db2.gz OKAFBFFZFLDRMG-QFIPXVFZSA-N 0 3 404.489 4.138 20 0 HIADHN C[C@H](CNc1ccc(C(=O)N2CCc3ccccc32)cn1)N1CCc2ccccc2C1 ZINC000301261272 854342348 /nfs/dbraw/zinc/34/23/48/854342348.db2.gz VCFOHUOBKGSSCD-LJQANCHMSA-N 0 3 412.537 4.143 20 0 HIADHN C[C@H](CNc1ncccc1C(=O)N1CCc2ccccc21)N1CCc2ccccc2C1 ZINC000301336546 854363673 /nfs/dbraw/zinc/36/36/73/854363673.db2.gz DELHKBGKJAKMDM-LJQANCHMSA-N 0 3 412.537 4.143 20 0 HIADHN Cc1noc(-c2cccnc2N2CCCN(Cc3ccc(C(F)(F)F)cc3)CC2)n1 ZINC000301363124 854371580 /nfs/dbraw/zinc/37/15/80/854371580.db2.gz PCXYCLLQBODBRT-UHFFFAOYSA-N 0 3 417.435 4.171 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(NC[C@H]3CCC[N@H+](C)[C@H]3c3cccs3)nc2)n1 ZINC000301421493 854390314 /nfs/dbraw/zinc/39/03/14/854390314.db2.gz NSQHXNCWYBWQKH-QVKFZJNVSA-N 0 3 409.559 4.363 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(NC[C@H]3CCC[N@@H+](C)[C@H]3c3cccs3)nc2)n1 ZINC000301421493 854390326 /nfs/dbraw/zinc/39/03/26/854390326.db2.gz NSQHXNCWYBWQKH-QVKFZJNVSA-N 0 3 409.559 4.363 20 0 HIADHN Fc1ccccc1-c1nnc2ccc(NC[C@@H](c3cccs3)N3CCCC3)nn21 ZINC000301506129 854408813 /nfs/dbraw/zinc/40/88/13/854408813.db2.gz GYWQJYVVDBKWDF-KRWDZBQOSA-N 0 3 408.506 4.241 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(N3CCC(CC[N@@H+]4CCCC[C@@H]4C)CC3)nc2)n1 ZINC000301658563 854439357 /nfs/dbraw/zinc/43/93/57/854439357.db2.gz JADHLQBSDRRSKQ-SFHVURJKSA-N 0 3 409.578 4.288 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(N3CCC(CC[N@H+]4CCCC[C@@H]4C)CC3)nc2)n1 ZINC000301658563 854439360 /nfs/dbraw/zinc/43/93/60/854439360.db2.gz JADHLQBSDRRSKQ-SFHVURJKSA-N 0 3 409.578 4.288 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(Nc2nc(-c3ccccn3)nc3c2CCC3)CC1 ZINC000301792994 854466824 /nfs/dbraw/zinc/46/68/24/854466824.db2.gz OZAOEZKQPGIHTH-QGZVFWFLSA-N 0 3 400.530 4.060 20 0 HIADHN CC(C)(C)n1ncc2c1ncnc2N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1 ZINC000301890597 854486327 /nfs/dbraw/zinc/48/63/27/854486327.db2.gz NWULCNIQFYUJDY-INIZCTEOSA-N 0 3 418.467 4.287 20 0 HIADHN CN(C)[C@H](CNc1cc(Br)cc(F)c1C(N)=O)c1ccc(Cl)cc1 ZINC000301941623 854500515 /nfs/dbraw/zinc/50/05/15/854500515.db2.gz VZNZLZQMTRMSBR-OAHLLOKOSA-N 0 3 414.706 4.055 20 0 HIADHN COc1cccc([C@H](CNc2nn3cc(-c4cccnc4)nc3s2)N2CCCC2)c1 ZINC000302117755 854532860 /nfs/dbraw/zinc/53/28/60/854532860.db2.gz WSOIKHRMBPFYAA-FQEVSTJZSA-N 0 3 420.542 4.110 20 0 HIADHN CN1CCC[C@@H](CNc2nn3cc(-c4cccnc4)nc3s2)[C@@H]1c1cccs1 ZINC000302153406 854538358 /nfs/dbraw/zinc/53/83/58/854538358.db2.gz IEFVDJZHXAUMDT-MAUKXSAKSA-N 0 3 410.572 4.409 20 0 HIADHN Brc1cc(CNC[C@@H](c2ccco2)N2CCCCC2)cc2c1OCO2 ZINC000302222687 854552643 /nfs/dbraw/zinc/55/26/43/854552643.db2.gz PGSMDBCKXRPTKN-INIZCTEOSA-N 0 3 407.308 4.088 20 0 HIADHN CCN1CCN([C@@H](C)CNc2ccnc3c(Cl)cc(Br)cc23)CC1 ZINC000302753606 854621381 /nfs/dbraw/zinc/62/13/81/854621381.db2.gz VHLDCQYBJPGZKW-ZDUSSCGKSA-N 0 3 411.775 4.089 20 0 HIADHN COc1ccc([C@@H](CNC(=O)NCCCn2ccc3ccccc32)N2CCCC2)cc1 ZINC000302818798 854645742 /nfs/dbraw/zinc/64/57/42/854645742.db2.gz ZUPCAJRBNOGHKG-XMMPIXPASA-N 0 3 420.557 4.176 20 0 HIADHN C[C@H](C1CC1)N(CC(=O)N1CCC[C@H]1c1ccc2c(c1)OCCO2)Cc1ccccc1 ZINC000302839633 854651867 /nfs/dbraw/zinc/65/18/67/854651867.db2.gz XZCDNNVOCJOFCQ-XXBNENTESA-N 0 3 420.553 4.422 20 0 HIADHN COc1ccc([C@H](NCC(=O)Nc2ccccc2C(=O)NCC(C)C)C(C)C)cc1 ZINC000302845928 854654680 /nfs/dbraw/zinc/65/46/80/854654680.db2.gz GONZALWRTMKUJT-HSZRJFAPSA-N 0 3 411.546 4.006 20 0 HIADHN CN(CCOc1cccc(Cl)c1)C(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000302889002 854666962 /nfs/dbraw/zinc/66/69/62/854666962.db2.gz BEGQAVIACFECBW-GOSISDBHSA-N 0 3 407.967 4.259 20 0 HIADHN Cc1nc(CN2CCN(c3ccnc4ccc(Oc5ccccc5)cc43)CC2)no1 ZINC000302888035 854667419 /nfs/dbraw/zinc/66/74/19/854667419.db2.gz MKSUDGIUFPDKSZ-UHFFFAOYSA-N 0 3 401.470 4.041 20 0 HIADHN Cc1c(C(=O)NC[C@H](c2ccccc2)N2CCC(C)CC2)cnn1Cc1ccccc1 ZINC000302970221 854702547 /nfs/dbraw/zinc/70/25/47/854702547.db2.gz NXTJZUZINSUPGR-RUZDIDTESA-N 0 3 416.569 4.443 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)C1(c2cccc(F)c2)CCCC1 ZINC000302992292 854713290 /nfs/dbraw/zinc/71/32/90/854713290.db2.gz LNZYCOGZSCADIE-UHFFFAOYSA-N 0 3 423.576 4.356 20 0 HIADHN Cc1cc(NC(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)n(-c2ccccc2F)n1 ZINC000303004846 854718757 /nfs/dbraw/zinc/71/87/57/854718757.db2.gz PBDFXJSFMJLPTP-UHFFFAOYSA-N 0 3 421.520 4.103 20 0 HIADHN CCc1c(C(=O)Nc2ccc(CCN3CCSCC3)cc2)cnn1-c1ccccc1 ZINC000303024452 854727893 /nfs/dbraw/zinc/72/78/93/854727893.db2.gz MOVXMBQUEJBLHU-UHFFFAOYSA-N 0 3 420.582 4.278 20 0 HIADHN CCOC(=O)c1sc2ncnc(NC[C@@H](c3ccco3)N(CC)CC)c2c1C ZINC000303069115 854747410 /nfs/dbraw/zinc/74/74/10/854747410.db2.gz OEQHOQVHFFLZAS-AWEZNQCLSA-N 0 3 402.520 4.264 20 0 HIADHN COc1ccc2c(CC(=O)N(CCN(C)C)Cc3cccc(Cl)c3)coc2c1 ZINC000303074197 854748784 /nfs/dbraw/zinc/74/87/84/854748784.db2.gz QLHCEGMLTVQCNN-UHFFFAOYSA-N 0 3 400.906 4.228 20 0 HIADHN CC(C)c1ncc(Cl)c(C(=O)NC[C@H](c2ccccc2)N2CCC(C)CC2)n1 ZINC000303076232 854749201 /nfs/dbraw/zinc/74/92/01/854749201.db2.gz RJFFTCDGZGSHBD-LJQANCHMSA-N 0 3 400.954 4.456 20 0 HIADHN CC(C)c1ncc(Cl)c(C(=O)NC[C@@H](c2ccccc2)N2CCC(C)CC2)n1 ZINC000303076231 854749522 /nfs/dbraw/zinc/74/95/22/854749522.db2.gz RJFFTCDGZGSHBD-IBGZPJMESA-N 0 3 400.954 4.456 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2cc3cc(Br)ccc3[nH]2)N(C)C)cc1 ZINC000303085997 854754344 /nfs/dbraw/zinc/75/43/44/854754344.db2.gz XPFPSSNTYONGTC-LJQANCHMSA-N 0 3 400.320 4.272 20 0 HIADHN CCOc1ccccc1CNC(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000303097497 854758290 /nfs/dbraw/zinc/75/82/90/854758290.db2.gz GFFPJHQJBHYVDJ-OAQYLSRUSA-N 0 3 406.448 4.156 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)NCc3cccc(COC(C)(C)C)c3)cc2)CC1 ZINC000303114057 854767028 /nfs/dbraw/zinc/76/70/28/854767028.db2.gz KXHBBRPGAOSTRU-UHFFFAOYSA-N 0 3 423.601 4.462 20 0 HIADHN CC(C)(O)CN1CCN(CCCC(c2ccc(F)cc2)c2ccc(F)cc2)CC1 ZINC000303131532 854775691 /nfs/dbraw/zinc/77/56/91/854775691.db2.gz BYWGJJFDJZLFFX-UHFFFAOYSA-N 0 3 402.529 4.265 20 0 HIADHN COCCN(C)CCNC(=O)c1oc2ccccc2c1CSC1CCCCC1 ZINC000303148670 854785581 /nfs/dbraw/zinc/78/55/81/854785581.db2.gz MFMZYRYYFHYEHU-UHFFFAOYSA-N 0 3 404.576 4.307 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)NCC1(c2ccc(Cl)cc2)CC1 ZINC000303228573 854826897 /nfs/dbraw/zinc/82/68/97/854826897.db2.gz XJOYSBLKCKBZED-UHFFFAOYSA-N 0 3 403.929 4.284 20 0 HIADHN O=C(NCc1ccc(Br)cc1)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000303286154 854852852 /nfs/dbraw/zinc/85/28/52/854852852.db2.gz KAAMRXVOYYJLBK-IBGZPJMESA-N 0 3 402.336 4.085 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)C1(c2ccccc2Cl)CCOCC1 ZINC000303300635 854860013 /nfs/dbraw/zinc/86/00/13/854860013.db2.gz MMYNLFXYIGMLPF-QFIPXVFZSA-N 0 3 412.961 4.342 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)C1(c2ccccc2Cl)CCOCC1 ZINC000303307591 854864027 /nfs/dbraw/zinc/86/40/27/854864027.db2.gz NXOMEYOOYNHURK-LJQANCHMSA-N 0 3 418.990 4.403 20 0 HIADHN CN(C(=O)OC(C)(C)C)C1CCN(CCC(=O)Nc2ccc(Cl)cc2F)CC1 ZINC000303319076 854870352 /nfs/dbraw/zinc/87/03/52/854870352.db2.gz QWDGADGQGGWMDX-UHFFFAOYSA-N 0 3 413.921 4.139 20 0 HIADHN Cc1c(Br)cccc1NC(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000303360485 854891757 /nfs/dbraw/zinc/89/17/57/854891757.db2.gz HMTWQBYUWQEBGA-GASCZTMLSA-N 0 3 424.383 4.111 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)[C@H]1C[C@@H]1c1cccc(C(F)(F)F)c1 ZINC000303450929 854949431 /nfs/dbraw/zinc/94/94/31/854949431.db2.gz JMTIKUNWARTAPG-MSOLQXFVSA-N 0 3 412.521 4.287 20 0 HIADHN Cc1nc2cc(F)ccc2cc1C(=O)NCC1(N2CCSCC2)CCCCC1 ZINC000303497504 854986072 /nfs/dbraw/zinc/98/60/72/854986072.db2.gz XRBCMSMDGAFZQY-UHFFFAOYSA-N 0 3 401.551 4.164 20 0 HIADHN O=S(=O)(NC1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1)c1ccc(C(F)(F)F)cc1 ZINC000303519970 855007929 /nfs/dbraw/zinc/00/79/29/855007929.db2.gz YTPSRZITBKQWSM-YQQQUEKLSA-N 0 3 424.488 4.179 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)[C@H](C)Oc3ccc(F)cc3Cl)c(C)c2)CC1 ZINC000303545647 855031866 /nfs/dbraw/zinc/03/18/66/855031866.db2.gz UWGABNKYLCAAIL-INIZCTEOSA-N 0 3 419.928 4.335 20 0 HIADHN Cc1nc(COc2ccc(NC(=O)c3oc4ccccc4c3CN(C)C)cc2)no1 ZINC000303587462 855061085 /nfs/dbraw/zinc/06/10/85/855061085.db2.gz TXGIVIYJLOIUKP-UHFFFAOYSA-N 0 3 406.442 4.017 20 0 HIADHN O=C(Nc1cccc(OC(=O)[C@@H]2CCCN(Cc3ccccc3)C2)c1)c1ccco1 ZINC000303590326 855063198 /nfs/dbraw/zinc/06/31/98/855063198.db2.gz HJTLIBCAEXZSNW-LJQANCHMSA-N 0 3 404.466 4.350 20 0 HIADHN CCCOc1cccc(C(=O)NC2CCN(CCOc3ccc(Cl)cc3)CC2)c1 ZINC000303662599 855115371 /nfs/dbraw/zinc/11/53/71/855115371.db2.gz DPPAMNYEPBOULS-UHFFFAOYSA-N 0 3 416.949 4.402 20 0 HIADHN CCN(Cc1ccc(OC)c(OC)c1)C(=O)CN1C[C@H](c2ccc(F)cc2)C[C@@H]1C ZINC000303694692 855138290 /nfs/dbraw/zinc/13/82/90/855138290.db2.gz ABDONOTUMQRBLB-FXAWDEMLSA-N 0 3 414.521 4.069 20 0 HIADHN Cc1nn(CC(C)C)c(C)c1CCC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C ZINC000303765593 855184489 /nfs/dbraw/zinc/18/44/89/855184489.db2.gz AUHXCGPSOYRLFE-HXUWFJFHSA-N 0 3 410.606 4.212 20 0 HIADHN O=C(NCC1(c2cccc(F)c2)CC1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000303766776 855185357 /nfs/dbraw/zinc/18/53/57/855185357.db2.gz DTNJBSMBHFRJHD-UHFFFAOYSA-N 0 3 413.562 4.270 20 0 HIADHN CC(C)c1ccc([C@H](C)CC(=O)Nc2ccc3oc(=O)n(CCN(C)C)c3c2)cc1 ZINC000303776637 855192035 /nfs/dbraw/zinc/19/20/35/855192035.db2.gz KEBFIFSGXZNYSX-QGZVFWFLSA-N 0 3 409.530 4.412 20 0 HIADHN Cc1ccc(S(=O)(=O)N(C)[C@H]2CCN(Cc3ccccc3)[C@H](C)C2)cc1Cl ZINC000303788858 855199347 /nfs/dbraw/zinc/19/93/47/855199347.db2.gz JNKHGUQBAIALIH-MJGOQNOKSA-N 0 3 406.979 4.322 20 0 HIADHN C[C@H](c1ccccc1)N(CC(=O)Nc1cccc(C(=O)NC2CC2)c1)CC1CCC1 ZINC000303802046 855206458 /nfs/dbraw/zinc/20/64/58/855206458.db2.gz GZYKLNZXTOTWBW-GOSISDBHSA-N 0 3 405.542 4.381 20 0 HIADHN O=c1[nH]c(CN2CCN(CCCc3cccc4ccccc43)CC2)nc2ccccc21 ZINC000303807332 855211718 /nfs/dbraw/zinc/21/17/18/855211718.db2.gz YCYVLQGPIKFHHF-UHFFFAOYSA-N 0 3 412.537 4.239 20 0 HIADHN Cc1csc(-c2cccc(C(=O)NCC3(N4CCSCC4)CCCC3)c2)n1 ZINC000303818417 855220265 /nfs/dbraw/zinc/22/02/65/855220265.db2.gz OTPNLIDHYJTFGD-UHFFFAOYSA-N 0 3 401.601 4.210 20 0 HIADHN COc1ccc([C@H](CNC(=O)[C@@H]2C[C@@H]2c2cc(F)ccc2F)N2CCCC2)cc1 ZINC000303838845 855236410 /nfs/dbraw/zinc/23/64/10/855236410.db2.gz HYVDWSUAGQYHOG-UZKOGDIHSA-N 0 3 400.469 4.030 20 0 HIADHN CCC[C@H](C(=O)Nc1ccc(C(=O)N(C)[C@@H]2CCCN(C)C2)cc1)c1ccccc1 ZINC000303848331 855244850 /nfs/dbraw/zinc/24/48/50/855244850.db2.gz FDRXXESXRFSGPC-PKTZIBPZSA-N 0 3 407.558 4.375 20 0 HIADHN CSCc1nc2ccccc2n1CC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C ZINC000303858112 855253382 /nfs/dbraw/zinc/25/33/82/855253382.db2.gz PEPWWWGBWUVFJE-IBGZPJMESA-N 0 3 422.598 4.022 20 0 HIADHN Cc1ccc(S(=O)(=O)N(C)[C@@H]2CCN(Cc3ccccc3)[C@H](C)C2)c(Cl)c1 ZINC000303860361 855256052 /nfs/dbraw/zinc/25/60/52/855256052.db2.gz WLRYTSFHQROIRE-IEBWSBKVSA-N 0 3 406.979 4.322 20 0 HIADHN CCCOCc1ccccc1CNC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C ZINC000303867041 855260649 /nfs/dbraw/zinc/26/06/49/855260649.db2.gz QDPLRADARMGXSH-OAQYLSRUSA-N 0 3 409.574 4.419 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)[C@H]1C[C@@H]1c1cc(F)ccc1F ZINC000303928371 855297197 /nfs/dbraw/zinc/29/71/97/855297197.db2.gz UWJGKOPZPFJQOG-QUCCMNQESA-N 0 3 402.510 4.298 20 0 HIADHN CC(=O)N1C=Cc2ccccc2[C@@H]1CC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C ZINC000303944837 855309756 /nfs/dbraw/zinc/30/97/56/855309756.db2.gz ZCDYYVNKYVYPCP-NLFFAJNJSA-N 0 3 417.553 4.074 20 0 HIADHN CC(=O)N1C=Cc2ccccc2[C@@H]1CC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C ZINC000303944829 855309845 /nfs/dbraw/zinc/30/98/45/855309845.db2.gz ZCDYYVNKYVYPCP-CPJSRVTESA-N 0 3 417.553 4.074 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1cccc(NC(=O)C2CC2)c1 ZINC000303946642 855310829 /nfs/dbraw/zinc/31/08/29/855310829.db2.gz YEKCGQCURLUXCN-GOSISDBHSA-N 0 3 406.530 4.163 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)NC[C@@H]1CCCO[C@H]1c1ccccc1 ZINC000303951113 855314075 /nfs/dbraw/zinc/31/40/75/855314075.db2.gz ZWZYJRSJPBKZRS-ZODMCCGTSA-N 0 3 421.585 4.460 20 0 HIADHN C[C@@H](NCCCn1cc(Br)cn1)c1ccc(F)cc1Br ZINC000312359659 855372275 /nfs/dbraw/zinc/37/22/75/855372275.db2.gz YZRWDLYZLZYYJC-SNVBAGLBSA-N 0 3 405.109 4.288 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)c1ccc(F)c(Br)c1 ZINC000383044361 855435925 /nfs/dbraw/zinc/43/59/25/855435925.db2.gz FFILUKKSCQOFKY-OAHLLOKOSA-N 0 3 405.311 4.325 20 0 HIADHN CC(C)n1cc(Br)cc1C(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000385199368 855441028 /nfs/dbraw/zinc/44/10/28/855441028.db2.gz SAEXDMALECIGSH-GOSISDBHSA-N 0 3 404.352 4.178 20 0 HIADHN C[C@@H](NCc1ccc(N2CCCC2=O)cc1)c1ccc(I)cc1 ZINC000390331188 855453795 /nfs/dbraw/zinc/45/37/95/855453795.db2.gz ZSSNYOBNVKJXBW-CQSZACIVSA-N 0 3 420.294 4.269 20 0 HIADHN COc1cc(CN[C@H](C)c2ccc3c(c2)OCCO3)cc(Br)c1OC ZINC000392740165 855466860 /nfs/dbraw/zinc/46/68/60/855466860.db2.gz UWOIVBOXNPSOKJ-GFCCVEGCSA-N 0 3 408.292 4.088 20 0 HIADHN C[C@@H]1C[C@H](NCc2cccc(F)c2Br)CCN1C(=O)OC(C)(C)C ZINC000394620406 855470923 /nfs/dbraw/zinc/47/09/23/855470923.db2.gz XIMHTQQEQLHKSV-TZMCWYRMSA-N 0 3 401.320 4.466 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cnn(-c2ccccc2OC)c1C)c1ccsc1 ZINC000409453522 855486398 /nfs/dbraw/zinc/48/63/98/855486398.db2.gz PEFHOBWCSXYSEU-FQEVSTJZSA-N 0 3 412.559 4.064 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3C[C@@H](C)O[C@H](c4ccccc4)C3)c(C)c2)CC1 ZINC000409617226 855566981 /nfs/dbraw/zinc/56/69/81/855566981.db2.gz ROEONYDIYQYXQK-YKSBVNFPSA-N 0 3 422.573 4.131 20 0 HIADHN Cc1ccc(-n2nc(C(=O)N(CCN(C)C)c3ccccc3)c3c2CCCC3)cc1 ZINC000409620094 855567500 /nfs/dbraw/zinc/56/75/00/855567500.db2.gz HISJRHZTUZJJBV-UHFFFAOYSA-N 0 3 402.542 4.268 20 0 HIADHN CN(CCNC(=O)Nc1ccc(C(=O)NC2CCCCC2)cc1)Cc1ccccc1 ZINC000409654125 855585955 /nfs/dbraw/zinc/58/59/55/855585955.db2.gz WDLTUIPIHMZVKT-UHFFFAOYSA-N 0 3 408.546 4.003 20 0 HIADHN C[C@H](CNC(=O)[C@@H]1CCO[C@H]1c1ccc(Cl)c(F)c1)N(C)Cc1ccccc1 ZINC000409680569 855599070 /nfs/dbraw/zinc/59/90/70/855599070.db2.gz XBHPDCBRXBNZBJ-FPDPHYFHSA-N 0 3 404.913 4.193 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)Nc1ccc(F)c(Cl)c1 ZINC000409714896 855616887 /nfs/dbraw/zinc/61/68/87/855616887.db2.gz NETSTYVDXVCNOX-UHFFFAOYSA-N 0 3 404.917 4.203 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)c1cnc2onc(C(C)(C)C)c2c1 ZINC000409723094 855620295 /nfs/dbraw/zinc/62/02/95/855620295.db2.gz KZNGNCFNRGKPKZ-UHFFFAOYSA-N 0 3 408.546 4.157 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2cccc(C3CCC3)c2)cc1)[C@H]1CCCN(C)C1 ZINC000409743168 855631417 /nfs/dbraw/zinc/63/14/17/855631417.db2.gz UAJJQHCYOKIXKS-QHCPKHFHSA-N 0 3 405.542 4.373 20 0 HIADHN C[C@H]1CCN(C(=O)c2ccc3c(c2)nc(C(F)F)n3C)CCN1Cc1ccccc1 ZINC000409752870 855635921 /nfs/dbraw/zinc/63/59/21/855635921.db2.gz JPZRGPZZAMAMBW-INIZCTEOSA-N 0 3 412.484 4.248 20 0 HIADHN CCN(C(=O)c1ccc2c(c1)nc(C(F)F)n2C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000409939080 855735188 /nfs/dbraw/zinc/73/51/88/855735188.db2.gz VBIZGRQPEBZJNK-SFHVURJKSA-N 0 3 412.484 4.248 20 0 HIADHN Cc1cc(NC(=O)[C@@H]2CCCC(F)(F)C2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000409980707 855760062 /nfs/dbraw/zinc/76/00/62/855760062.db2.gz PWCMROHAWOCBPG-MOPGFXCFSA-N 0 3 402.489 4.403 20 0 HIADHN C[C@H](C(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1)c1ccc(C(F)(F)F)cc1 ZINC000409994997 855768382 /nfs/dbraw/zinc/76/83/82/855768382.db2.gz XUEUVRZNTBGKFW-LAUBAEHRSA-N 0 3 420.475 4.216 20 0 HIADHN CC(C)(C)[C@H](CN1CCc2ccccc2C1)NC(=O)c1cccc(N2CCCC2=O)c1 ZINC000410052586 855801426 /nfs/dbraw/zinc/80/14/26/855801426.db2.gz JXMBJPIOIQPFCI-QHCPKHFHSA-N 0 3 419.569 4.016 20 0 HIADHN Cc1nn(CC(C)C)c(C)c1CC(=O)N[C@H](CN1CCc2ccccc2C1)C(C)(C)C ZINC000410051254 855801505 /nfs/dbraw/zinc/80/15/05/855801505.db2.gz GCJVRLROHNVAEL-XMMPIXPASA-N 0 3 424.633 4.288 20 0 HIADHN CC(C)(C)[C@@H](CN1CCc2ccccc2C1)NC(=O)Cc1cnn(-c2ccccc2)c1 ZINC000410052845 855802425 /nfs/dbraw/zinc/80/24/25/855802425.db2.gz KOQHUXRAPKOKPN-XMMPIXPASA-N 0 3 416.569 4.004 20 0 HIADHN COc1ccc2ccccc2c1CNC(=O)NCC1(N2CCSCC2)CCCC1 ZINC000410193678 855856614 /nfs/dbraw/zinc/85/66/14/855856614.db2.gz INJGHJPEOPPLOF-UHFFFAOYSA-N 0 3 413.587 4.009 20 0 HIADHN CN(C)Cc1cccc(NC(=O)NCc2cccc(NC(=O)c3ccccc3)c2)c1 ZINC000410291533 855908770 /nfs/dbraw/zinc/90/87/70/855908770.db2.gz YUQNNMUIBFBROT-UHFFFAOYSA-N 0 3 402.498 4.322 20 0 HIADHN COc1cccc2c1CC[C@H](NCc1nnc3c(Cl)cc(C(F)(F)F)cn13)C2 ZINC000425914732 855995962 /nfs/dbraw/zinc/99/59/62/855995962.db2.gz HPQIGUZUDBLSQQ-ZDUSSCGKSA-N 0 3 410.827 4.057 20 0 HIADHN COCC1(CN[C@H](c2ccc(OC)c(OC)c2)c2ccccc2Cl)CCOCC1 ZINC000425924546 856002189 /nfs/dbraw/zinc/00/21/89/856002189.db2.gz PQRYXRDPXDSFAK-JOCHJYFZSA-N 0 3 419.949 4.479 20 0 HIADHN CS(=O)(=O)Cc1ccc(CN[C@H](Cc2cccnc2)c2cccc(Cl)c2)cc1 ZINC000425952816 856015060 /nfs/dbraw/zinc/01/50/60/856015060.db2.gz UKNSTCCXPBTBKZ-JOCHJYFZSA-N 0 3 414.958 4.353 20 0 HIADHN Cc1ccc(-c2cccc(CNC(=O)N3CCN(C4CCOCC4)C[C@@H]3C)c2)cc1 ZINC000426002192 856040060 /nfs/dbraw/zinc/04/00/60/856040060.db2.gz DVXSRZWJODRTDE-FQEVSTJZSA-N 0 3 407.558 4.057 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000426021580 856051702 /nfs/dbraw/zinc/05/17/02/856051702.db2.gz OGHRNNIHHWYBLR-HZPDHXFCSA-N 0 3 409.958 4.092 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)N[C@@H]2CCCc3sc(Cl)cc32)cc1 ZINC000426053113 856075633 /nfs/dbraw/zinc/07/56/33/856075633.db2.gz VGCYFKXRSFKBFW-SJORKVTESA-N 0 3 407.967 4.390 20 0 HIADHN O=C(Nc1cccc(-c2cccs2)c1)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1CO ZINC000426109019 856112226 /nfs/dbraw/zinc/11/22/26/856112226.db2.gz AXNHOGQNFKSMEM-IFMALSPDSA-N 0 3 421.566 4.420 20 0 HIADHN O=C(Nc1cccc(-c2cccs2)c1)N[C@H]1CCN(Cc2ccccc2)C[C@H]1CO ZINC000426109022 856112448 /nfs/dbraw/zinc/11/24/48/856112448.db2.gz AXNHOGQNFKSMEM-UNMCSNQZSA-N 0 3 421.566 4.420 20 0 HIADHN Cc1c(NC(=O)N[C@H]2CCN(Cc3ccccc3)C[C@H]2CO)cccc1C(F)(F)F ZINC000426143025 856136823 /nfs/dbraw/zinc/13/68/23/856136823.db2.gz KXJWNPFNBJXCQL-PXNSSMCTSA-N 0 3 421.463 4.018 20 0 HIADHN CC(C)[C@H](NC(=O)N1CCN(C2CCOCC2)C[C@@H]1C)c1ccc(Cl)cc1F ZINC000426255739 856204431 /nfs/dbraw/zinc/20/44/31/856204431.db2.gz MAGFPCMUTUBIHK-YWZLYKJASA-N 0 3 411.949 4.071 20 0 HIADHN C[C@@H](Sc1ccnc2cc(Cl)ccc21)C(=O)N1CC[C@@H](N2CCCCC2)C1 ZINC000426283753 856221002 /nfs/dbraw/zinc/22/10/02/856221002.db2.gz ZOIFLTFQQAMQRI-NVXWUHKLSA-N 0 3 403.979 4.456 20 0 HIADHN COc1ccccc1[C@@H](NC(=O)NC[C@H](c1ccc(C)cc1)N(C)C)c1ccco1 ZINC000426314793 856239874 /nfs/dbraw/zinc/23/98/74/856239874.db2.gz YGKWLJUREDQLCH-NFBKMPQASA-N 0 3 407.514 4.288 20 0 HIADHN C[C@H](N[C@H]1c2cc(Br)ccc2CC1(C)C)c1cccc(S(N)(=O)=O)c1 ZINC000426331993 856250093 /nfs/dbraw/zinc/25/00/93/856250093.db2.gz BRJUTPJKDYEKMI-SGTLLEGYSA-N 0 3 423.376 4.071 20 0 HIADHN COc1ccccc1[C@H](NC(=O)NC[C@H](C)N(C)Cc1ccccc1)c1ccco1 ZINC000426351081 856256240 /nfs/dbraw/zinc/25/62/40/856256240.db2.gz HLEVBDIUYCRFOX-MBSDFSHPSA-N 0 3 407.514 4.197 20 0 HIADHN Cc1ccc(NC(=O)Cc2noc([C@@H]3CN(C(C)(C)C)C[C@H]3C(F)(F)F)n2)c(C)c1 ZINC000426444085 856293162 /nfs/dbraw/zinc/29/31/62/856293162.db2.gz SLYFICCQIZVRBI-HUUCEWRRSA-N 0 3 424.467 4.244 20 0 HIADHN Cc1ccnc(-c2nnc([C@@H](C)[NH2+]C[C@@H](C)c3cccc(Br)c3)[n-]2)c1 ZINC000426510440 856326305 /nfs/dbraw/zinc/32/63/05/856326305.db2.gz OIJSKHRVFKAHQE-ZIAGYGMSSA-N 0 3 400.324 4.392 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3ccccc3C(F)(F)F)CC2)C[C@H](C)O1 ZINC000426646658 856392688 /nfs/dbraw/zinc/39/26/88/856392688.db2.gz MJOSHESUNJNGDM-IYBDPMFKSA-N 0 3 413.484 4.449 20 0 HIADHN CN1CCC(N(Cc2ccccc2Br)C(=O)CCCn2cccc2)CC1 ZINC000426796856 856483788 /nfs/dbraw/zinc/48/37/88/856483788.db2.gz DLIIMXDLZZLDDF-UHFFFAOYSA-N 0 3 418.379 4.154 20 0 HIADHN CN1CCC(N(Cc2ccccc2Br)C(=O)c2ocnc2C2CC2)CC1 ZINC000426800212 856485921 /nfs/dbraw/zinc/48/59/21/856485921.db2.gz NPHKSUBKGVNDPL-UHFFFAOYSA-N 0 3 418.335 4.051 20 0 HIADHN Cc1coc(C)c1C(=O)N(Cc1ccccc1Br)C1CCN(C)CC1 ZINC000426801000 856486755 /nfs/dbraw/zinc/48/67/55/856486755.db2.gz ROJCMDWMUYMOIV-UHFFFAOYSA-N 0 3 405.336 4.396 20 0 HIADHN O=C(Nc1ccc(F)cc1I)c1cccc(CN2CCCC2)c1 ZINC000426858783 856514950 /nfs/dbraw/zinc/51/49/50/856514950.db2.gz XSUXRHSFPWXVFA-UHFFFAOYSA-N 0 3 424.257 4.278 20 0 HIADHN CN(C(=O)NCc1nc(-c2ccccc2F)cs1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000426897104 856531901 /nfs/dbraw/zinc/53/19/01/856531901.db2.gz DOGPDSUERTZMQV-GOSISDBHSA-N 0 3 424.545 4.365 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)C/C=C\c2ccccc2F)cc1)[C@@H]1CCCN(C)C1 ZINC000426948127 856557240 /nfs/dbraw/zinc/55/72/40/856557240.db2.gz KGYSUFCOVYYYTL-HUCIYCNJSA-N 0 3 409.505 4.034 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)C3(c4cccc(Cl)c4)CC3)CC2)C[C@H](C)O1 ZINC000427286537 856752504 /nfs/dbraw/zinc/75/25/04/856752504.db2.gz GHICCURAIYBKBV-ROUUACIJSA-N 0 3 404.982 4.110 20 0 HIADHN Cc1oc(-c2ccccc2)nc1C(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000427288134 856753532 /nfs/dbraw/zinc/75/35/32/856753532.db2.gz OCRMSMHEDCSHGM-QZTJIDSGSA-N 0 3 411.546 4.002 20 0 HIADHN Cc1ccc(-c2cc(C(=O)N3CCC(CCN4C[C@@H](C)O[C@@H](C)C4)CC3)on2)cc1 ZINC000427290360 856755486 /nfs/dbraw/zinc/75/54/86/856755486.db2.gz ZQSNWTKYAHRWIC-KDURUIRLSA-N 0 3 411.546 4.002 20 0 HIADHN Cc1ccc(C)c(C(=O)CCC(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)c1 ZINC000427292069 856755561 /nfs/dbraw/zinc/75/55/61/856755561.db2.gz MOVVLGKIVFHRJU-SFTDATJTSA-N 0 3 414.590 4.004 20 0 HIADHN Cc1ccc(-c2cc(C(=O)N3CCC(CCN4C[C@@H](C)O[C@H](C)C4)CC3)on2)cc1 ZINC000427290364 856755619 /nfs/dbraw/zinc/75/56/19/856755619.db2.gz ZQSNWTKYAHRWIC-RTBURBONSA-N 0 3 411.546 4.002 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3ccc(Oc4ccccc4)o3)CC2)C[C@@H](C)O1 ZINC000427297895 856758122 /nfs/dbraw/zinc/75/81/22/856758122.db2.gz XPZGQHSRBRWSTB-RTBURBONSA-N 0 3 412.530 4.423 20 0 HIADHN Cc1cc(Br)ccc1C(=O)N1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000427297758 856758206 /nfs/dbraw/zinc/75/82/06/856758206.db2.gz WPNSMJQWZGFFEV-IRXDYDNUSA-N 0 3 423.395 4.109 20 0 HIADHN C[C@H](CC(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1)Cc1cccc(F)c1 ZINC000427298505 856758248 /nfs/dbraw/zinc/75/82/48/856758248.db2.gz CXYPGVROQPTAGK-XUVXKRRUSA-N 0 3 404.570 4.132 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3[nH]c4ccccc4c3Cl)CC2)C[C@H](C)O1 ZINC000427299468 856759705 /nfs/dbraw/zinc/75/97/05/856759705.db2.gz NDXRFZXXFHCLPN-IYBDPMFKSA-N 0 3 403.954 4.173 20 0 HIADHN Cc1ccc(C(C)(C)CC(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)cc1 ZINC000427307746 856763390 /nfs/dbraw/zinc/76/33/90/856763390.db2.gz JOWNJTJRUHLZFJ-SFTDATJTSA-N 0 3 400.607 4.401 20 0 HIADHN Cc1ccc([C@@H]2C[C@H](C)CCN2C(=O)CCCN2CCN(c3ccccc3)CC2)o1 ZINC000437484040 862842227 /nfs/dbraw/zinc/84/22/27/862842227.db2.gz NPIIPFVZARMFSK-OFNKIYASSA-N 0 3 409.574 4.490 20 0 HIADHN Cc1cc2c(cc1C)[C@H](NCc1ccc(C(=O)N3CCN(C)CC3)cc1)CCS2 ZINC000427593724 856881249 /nfs/dbraw/zinc/88/12/49/856881249.db2.gz LZSZTDUYKKOYSM-JOCHJYFZSA-N 0 3 409.599 4.018 20 0 HIADHN COc1cc(CN[C@@H]2CCSc3cc(C)c(C)cc32)ccc1OCC(=O)N(C)C ZINC000427593768 856881332 /nfs/dbraw/zinc/88/13/32/856881332.db2.gz MIRIYBNIWVGRPQ-LJQANCHMSA-N 0 3 414.571 4.106 20 0 HIADHN Cc1cc2c(cc1C)[C@@H](NCc1ccc(S(=O)(=O)N3CCCC3)cc1)CCS2 ZINC000427598199 856882888 /nfs/dbraw/zinc/88/28/88/856882888.db2.gz BSLOHQKKLRCYDU-NRFANRHFSA-N 0 3 416.612 4.415 20 0 HIADHN COc1cccc([C@H](CN[C@@H](C)c2ncc(Br)cc2F)N2CCCC2)c1 ZINC000427600514 856884042 /nfs/dbraw/zinc/88/40/42/856884042.db2.gz GWXTYGMOHFMJAU-LIRRHRJNSA-N 0 3 422.342 4.480 20 0 HIADHN CCNC(=O)COc1ccc(CN[C@@H]2CCSc3cc(C)c(C)cc32)cc1OC ZINC000427619248 856889055 /nfs/dbraw/zinc/88/90/55/856889055.db2.gz XBBAMBWSASPGFF-LJQANCHMSA-N 0 3 414.571 4.154 20 0 HIADHN C[C@@H]1C[C@H]1C(=O)Nc1cccc(C(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)c1 ZINC000437492416 862849702 /nfs/dbraw/zinc/84/97/02/862849702.db2.gz GAYHDVZOSNXHLZ-SELNLUPBSA-N 0 3 405.542 4.018 20 0 HIADHN C[C@@H]1CCN(C(=O)c2ccccc2NC(=O)C(C)(C)C)CCN1Cc1ccccc1 ZINC000437499194 862854398 /nfs/dbraw/zinc/85/43/98/862854398.db2.gz UWYKMLSLDOJUOM-LJQANCHMSA-N 0 3 407.558 4.408 20 0 HIADHN C[C@@H](CC(=O)Nc1ccc(NC(=O)C2CC2)cc1)NCc1ccc(Cl)cc1F ZINC000427847367 856980319 /nfs/dbraw/zinc/98/03/19/856980319.db2.gz CIUMUSADZFIBDE-ZDUSSCGKSA-N 0 3 403.885 4.335 20 0 HIADHN Cc1ccc([C@@H](NC[C@H]2CCC(C)(C)O2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000427979814 857030831 /nfs/dbraw/zinc/03/08/31/857030831.db2.gz QGPQTUMOTGZNAK-KNQAVFIVSA-N 0 3 401.572 4.344 20 0 HIADHN CN(C)Cc1cccc(C(=O)Nc2cnn(-c3ccc(F)cc3)c2C(F)(F)F)c1 ZINC000428025260 857046734 /nfs/dbraw/zinc/04/67/34/857046734.db2.gz RIEUKPMYIGGOGU-UHFFFAOYSA-N 0 3 406.383 4.344 20 0 HIADHN COc1cc(CN2CC[C@@H](O)[C@@H](C)C2)ccc1OCCOc1ccccc1Cl ZINC000428454646 857207934 /nfs/dbraw/zinc/20/79/34/857207934.db2.gz DEVOBHDQFYIRQI-QFBILLFUSA-N 0 3 405.922 4.009 20 0 HIADHN C[C@H](c1cccc(N2CCCS2(=O)=O)c1)N(C)Cc1cc2cc(F)ccc2o1 ZINC000428486987 857222983 /nfs/dbraw/zinc/22/29/83/857222983.db2.gz SCQGCCBUTGHXCC-OAHLLOKOSA-N 0 3 402.491 4.305 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N2CCC(c3ncccc3Cl)CC2)N(C)C)cc1 ZINC000428528367 857242282 /nfs/dbraw/zinc/24/22/82/857242282.db2.gz DJZLFLMKQIHWOL-FQEVSTJZSA-N 0 3 400.954 4.235 20 0 HIADHN Cc1cc(Br)c(C(=O)Nc2cccc(CN3CC[C@@H](O)C3)c2)cc1Cl ZINC000428536396 857249720 /nfs/dbraw/zinc/24/97/20/857249720.db2.gz MQCKPBFOOZSFQZ-OAHLLOKOSA-N 0 3 423.738 4.230 20 0 HIADHN O=C(CSc1cccc(C(F)(F)F)c1)Nc1cccc(CN2CC[C@@H](O)C2)c1 ZINC000428542328 857253883 /nfs/dbraw/zinc/25/38/83/857253883.db2.gz UWBNYURBQGHFIA-QGZVFWFLSA-N 0 3 410.461 4.003 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@@H](O)C2)c1)c1[nH]c2ccc(Cl)cc2c1Cl ZINC000428548648 857258224 /nfs/dbraw/zinc/25/82/24/857258224.db2.gz QZJZUQKPIPGJMY-OAHLLOKOSA-N 0 3 404.297 4.294 20 0 HIADHN Cc1cc(C(=O)Nc2cccc(CN3CC[C@@H](O)C3)c2)cc(Cl)c1Br ZINC000428550692 857259500 /nfs/dbraw/zinc/25/95/00/857259500.db2.gz SAABXOUGUIFLQJ-MRXNPFEDSA-N 0 3 423.738 4.230 20 0 HIADHN COc1ccccc1Nc1ccccc1C(=O)Nc1cccc(CN2CC[C@@H](O)C2)c1 ZINC000428553725 857262880 /nfs/dbraw/zinc/26/28/80/857262880.db2.gz PMSPFFKXEICRFH-HXUWFJFHSA-N 0 3 417.509 4.258 20 0 HIADHN O=C(NC[C@H]1CCCN1Cc1ccccc1)N1CCC(c2ncccc2Cl)CC1 ZINC000428590026 857273647 /nfs/dbraw/zinc/27/36/47/857273647.db2.gz YKOZWHYCKJJZGW-HXUWFJFHSA-N 0 3 412.965 4.289 20 0 HIADHN O=C(Nc1cccc(CN[C@@H](CO)CC(F)F)c1)c1ccc(Cl)cc1Cl ZINC000428641071 857286150 /nfs/dbraw/zinc/28/61/50/857286150.db2.gz LLJIXHCZOFXTES-CQSZACIVSA-N 0 3 403.256 4.351 20 0 HIADHN O=C(NC[C@H]1CN(Cc2ccccc2)CCCO1)Nc1ccccc1C(F)(F)F ZINC000428701855 857302377 /nfs/dbraw/zinc/30/23/77/857302377.db2.gz QEUZKEPTGVGYOX-KRWDZBQOSA-N 0 3 407.436 4.118 20 0 HIADHN C[C@H](NC(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1)c1cc2ccccc2o1 ZINC000428760507 857323583 /nfs/dbraw/zinc/32/35/83/857323583.db2.gz SVCXPSJMIYWUAE-RXVVDRJESA-N 0 3 407.514 4.084 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N[C@@](C)(CC)c3nc(C)cs3)c(C)c2)CC1 ZINC000437581722 862898381 /nfs/dbraw/zinc/89/83/81/862898381.db2.gz UEJHDKUMBWGPLY-QFIPXVFZSA-N 0 3 415.607 4.349 20 0 HIADHN CC(C)c1nc(CN(Cc2ccncc2)[C@@H]2CCCN(Cc3ccccc3)C2)no1 ZINC000428778702 857334238 /nfs/dbraw/zinc/33/42/38/857334238.db2.gz CUXOMCVHYDYGIC-JOCHJYFZSA-N 0 3 405.546 4.255 20 0 HIADHN CCCc1noc(CN(Cc2ccncc2)[C@H]2CCCN(Cc3ccccc3)C2)n1 ZINC000428797325 857347016 /nfs/dbraw/zinc/34/70/16/857347016.db2.gz BZOWPTHVCFQHKQ-QFIPXVFZSA-N 0 3 405.546 4.084 20 0 HIADHN Fc1ccc2nc(CNC[C@H](c3ccc(Cl)cc3)N3CCOCC3)sc2c1 ZINC000428864590 857376930 /nfs/dbraw/zinc/37/69/30/857376930.db2.gz UAXVAJGBHZJCTC-GOSISDBHSA-N 0 3 405.926 4.252 20 0 HIADHN CN(C)CCN(C)C(=O)Nc1ccc(OCc2ccccc2)c(Br)c1 ZINC000428890006 857392914 /nfs/dbraw/zinc/39/29/14/857392914.db2.gz XZVMHGNJWOCWKX-UHFFFAOYSA-N 0 3 406.324 4.053 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3ccccc3OCC3CC3)CC2)C[C@H](C)O1 ZINC000428902163 857402145 /nfs/dbraw/zinc/40/21/45/857402145.db2.gz SQAVHHVSDRKXFA-KDURUIRLSA-N 0 3 415.578 4.219 20 0 HIADHN C[C@@H]1CCN(C(=O)Nc2ccccc2C(=O)N2CCCC2)CCN1Cc1ccccc1 ZINC000437597225 862910864 /nfs/dbraw/zinc/91/08/64/862910864.db2.gz BXUDWPCBGVTGSW-HXUWFJFHSA-N 0 3 420.557 4.051 20 0 HIADHN C[C@@H](c1cccc(Cl)c1)N(C)C(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000429008767 857454081 /nfs/dbraw/zinc/45/40/81/857454081.db2.gz MVCDEECCULTZOW-AVRDEDQJSA-N 0 3 415.965 4.334 20 0 HIADHN Cc1ccc(C)c([C@@H](C)N(C)C(=O)NC[C@H]2CN(Cc3ccccc3)CCCO2)c1 ZINC000429017506 857458943 /nfs/dbraw/zinc/45/89/43/857458943.db2.gz FNNBMMDUJVHTRS-GGAORHGYSA-N 0 3 409.574 4.297 20 0 HIADHN O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)N(Cc1ccco1)C1CCCC1 ZINC000429035676 857466950 /nfs/dbraw/zinc/46/69/50/857466950.db2.gz OQPHJCGXJDXLJL-HSZRJFAPSA-N 0 3 411.546 4.025 20 0 HIADHN Cc1ccc(CN(C(=O)NC[C@H]2CN(Cc3ccccc3)CCCO2)C(C)C)s1 ZINC000429036954 857468350 /nfs/dbraw/zinc/46/83/50/857468350.db2.gz RXFJGSHHWQCWPI-NRFANRHFSA-N 0 3 415.603 4.268 20 0 HIADHN C[C@@H]1CCN(C(=O)NC[C@H]2CN(Cc3ccccc3)CCCO2)[C@@H](c2ccco2)C1 ZINC000429044708 857473575 /nfs/dbraw/zinc/47/35/75/857473575.db2.gz RPIISRKATDDJBP-BAGYTPMASA-N 0 3 411.546 4.053 20 0 HIADHN O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)Nc1cccc(C(F)(F)F)c1 ZINC000429048029 857476315 /nfs/dbraw/zinc/47/63/15/857476315.db2.gz XXBMFKLFAFZVFR-LJQANCHMSA-N 0 3 407.436 4.118 20 0 HIADHN CC[C@@H]1c2ccsc2CCN1C(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000429053340 857479963 /nfs/dbraw/zinc/47/99/63/857479963.db2.gz MROMPOAOCAQEQS-PZJWPPBQSA-N 0 3 413.587 4.058 20 0 HIADHN OCCn1nccc1C1CCN(Cc2cccc3c(Br)cccc23)CC1 ZINC000429060143 857486264 /nfs/dbraw/zinc/48/62/64/857486264.db2.gz LCJCVDAHIVCMTI-UHFFFAOYSA-N 0 3 414.347 4.171 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3ccc4scnc4c3)CC2)C[C@H](C)O1 ZINC000429080466 857499288 /nfs/dbraw/zinc/49/92/88/857499288.db2.gz QQCXCYKDOCKLAH-IYBDPMFKSA-N 0 3 402.564 4.040 20 0 HIADHN CCOc1cc(C)ccc1NC(=O)N1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000429109767 857513260 /nfs/dbraw/zinc/51/32/60/857513260.db2.gz NRDVIFBDBZWUJV-OALUTQOASA-N 0 3 403.567 4.137 20 0 HIADHN C[C@H](NC(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1)c1cccc(Cl)c1 ZINC000429201306 857550614 /nfs/dbraw/zinc/55/06/14/857550614.db2.gz RVMSOGUCFUNEJY-KSZLIROESA-N 0 3 407.986 4.322 20 0 HIADHN CN(C)[C@@H](CNC(=O)Nc1cccc(NC(=O)C2CCCCC2)c1)Cc1ccccc1 ZINC000429206045 857554023 /nfs/dbraw/zinc/55/40/23/857554023.db2.gz MZDRTKFJPWAQFG-HSZRJFAPSA-N 0 3 422.573 4.500 20 0 HIADHN COc1ccc(NC(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)cc1Cl ZINC000429209328 857555977 /nfs/dbraw/zinc/55/59/77/857555977.db2.gz OPANIFXZULGMGL-HOTGVXAUSA-N 0 3 409.958 4.092 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3ccccc3Br)CC2)C[C@H](C)O1 ZINC000429209267 857556222 /nfs/dbraw/zinc/55/62/22/857556222.db2.gz CQTFOUKQWLDNBA-IYBDPMFKSA-N 0 3 424.383 4.192 20 0 HIADHN COc1c(C)ccc(NC(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)c1C ZINC000429253340 857575791 /nfs/dbraw/zinc/57/57/91/857575791.db2.gz HYSOJOTUZLTCMK-ROUUACIJSA-N 0 3 403.567 4.055 20 0 HIADHN C[C@@H](N[C@@H]1Cc2cccc(O)c2C1)C(=O)Nc1ccc(OCc2ccccc2)cc1 ZINC000429313482 857599864 /nfs/dbraw/zinc/59/98/64/857599864.db2.gz GOEGUXVQXWHDOK-DYESRHJHSA-N 0 3 402.494 4.055 20 0 HIADHN C[C@@H](N[C@@H]1Cc2cccc(O)c2C1)C(=O)Nc1cccc(CSc2ccccn2)c1 ZINC000429314102 857600142 /nfs/dbraw/zinc/60/01/42/857600142.db2.gz YFXDREYDKJEEES-OXQOHEQNSA-N 0 3 419.550 4.164 20 0 HIADHN Cc1cnc([C@@H](C)NC(=O)N[C@H](CN2CCc3ccccc3C2)C(C)(C)C)s1 ZINC000429321841 857602474 /nfs/dbraw/zinc/60/24/74/857602474.db2.gz FZKJFFJWMQLIDJ-VQIMIIECSA-N 0 3 400.592 4.285 20 0 HIADHN C[C@H](NCc1cccc2c(Br)cccc12)c1cccc(S(N)(=O)=O)c1 ZINC000429339143 857609937 /nfs/dbraw/zinc/60/99/37/857609937.db2.gz YZVHWASKCCENIR-ZDUSSCGKSA-N 0 3 419.344 4.101 20 0 HIADHN COC(=O)[C@H]1CCN(Cc2ncc(-c3cccc(Br)c3)o2)[C@H]1C(C)C ZINC000429396639 857641668 /nfs/dbraw/zinc/64/16/68/857641668.db2.gz WYKIJLUVKKQEHW-YJBOKZPZSA-N 0 3 407.308 4.124 20 0 HIADHN Cc1nn(C)c(C)c1NC(=O)[C@H](C)N[C@@H]1c2cccc(Br)c2CC1(C)C ZINC000429407324 857649393 /nfs/dbraw/zinc/64/93/93/857649393.db2.gz LHBKEWPDORQVRC-KPZWWZAWSA-N 0 3 419.367 4.040 20 0 HIADHN C[C@H](NC[C@@H](CO)Cc1ccccc1Br)c1nc2c(s1)CCCC2 ZINC000429415955 857654340 /nfs/dbraw/zinc/65/43/40/857654340.db2.gz JLVWTFPGXKXSSL-KBPBESRZSA-N 0 3 409.393 4.286 20 0 HIADHN OC[C@H](CN[C@@H](c1ccccc1)c1ccccn1)Cc1cccc(Br)c1 ZINC000429418623 857655383 /nfs/dbraw/zinc/65/53/83/857655383.db2.gz OGKJIOXEJHWHRS-AVRDEDQJSA-N 0 3 411.343 4.374 20 0 HIADHN Cc1cnc([C@H](C)NC(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)s1 ZINC000429419821 857656750 /nfs/dbraw/zinc/65/67/50/857656750.db2.gz RELIRFAMQBOLDF-AWEZNQCLSA-N 0 3 414.497 4.305 20 0 HIADHN Cc1cnn([C@H]2CCCN(C(=O)N[C@@H](CN3CCc4ccccc4C3)C(C)(C)C)C2)c1 ZINC000429504862 857702691 /nfs/dbraw/zinc/70/26/91/857702691.db2.gz RNRGWDLZTUNKIR-GOTSBHOMSA-N 0 3 423.605 4.011 20 0 HIADHN Cc1noc(C[C@H](NCCOc2ccc(OC(F)(F)F)cc2)c2ccccc2)n1 ZINC000429528179 857721150 /nfs/dbraw/zinc/72/11/50/857721150.db2.gz JAMFGCSWJDTDDX-SFHVURJKSA-N 0 3 407.392 4.229 20 0 HIADHN CC(F)(F)c1cccc(NC(=O)NC[C@@H]2CN(Cc3ccccc3)CCCO2)c1 ZINC000429620043 857801868 /nfs/dbraw/zinc/80/18/68/857801868.db2.gz GCUGOJFNIBEZKW-HXUWFJFHSA-N 0 3 403.473 4.211 20 0 HIADHN CCCc1c(NC(=O)N(CCN(C)C)Cc2ccccn2)cnn1-c1ccccc1C ZINC000429676266 857831616 /nfs/dbraw/zinc/83/16/16/857831616.db2.gz QCEGTJGAYZWBOF-UHFFFAOYSA-N 0 3 420.561 4.124 20 0 HIADHN CCCOc1cc(O)ccc1NC(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000429745612 857865532 /nfs/dbraw/zinc/86/55/32/857865532.db2.gz RKSLECSMZQRQQR-UHFFFAOYSA-N 0 3 415.559 4.416 20 0 HIADHN COc1ccc(NC(=O)[C@H](N[C@@H]2CCC[C@H]2CCO)c2ccccc2)cc1Cl ZINC000429765586 857877325 /nfs/dbraw/zinc/87/73/25/857877325.db2.gz AZFUPIJECIZRQB-NYSBEXSLSA-N 0 3 402.922 4.169 20 0 HIADHN CCO[C@H]1C[C@H](NCC(=O)Nc2cc(OC)c(Cl)cc2OC)C12CCCCC2 ZINC000429784403 857884097 /nfs/dbraw/zinc/88/40/97/857884097.db2.gz JCWBLCXHQBCWAB-OALUTQOASA-N 0 3 410.942 4.013 20 0 HIADHN CCO[C@@H]1C[C@@H](NCC(=O)Nc2cc3c(cc2Cl)OCCCO3)C12CCCCC2 ZINC000429794661 857887174 /nfs/dbraw/zinc/88/71/74/857887174.db2.gz XPEPOIQTCLJEGN-WOJBJXKFSA-N 0 3 422.953 4.157 20 0 HIADHN CC(C)N1CC[C@@H](NCC(=O)Nc2ccccc2F)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000429793776 857887205 /nfs/dbraw/zinc/88/72/05/857887205.db2.gz WHCWBGCWKVRUKV-CTNGQTDRSA-N 0 3 407.892 4.370 20 0 HIADHN CCO[C@H]1C[C@@H](NCC(=O)Nc2cc3c(cc2Cl)OCCCO3)C12CCCCC2 ZINC000429794659 857887229 /nfs/dbraw/zinc/88/72/29/857887229.db2.gz XPEPOIQTCLJEGN-UXHICEINSA-N 0 3 422.953 4.157 20 0 HIADHN Cc1ccc(CC(=O)NC[C@@H](c2cccs2)N2CCCC2)cc1Br ZINC000437640312 862969101 /nfs/dbraw/zinc/96/91/01/862969101.db2.gz FYZBUOKNCMTFFX-KRWDZBQOSA-N 0 3 407.377 4.315 20 0 HIADHN CC[C@H]1CN(Cc2cnc(-c3ccccc3OC)nc2)CCN1Cc1ccccc1 ZINC000430087437 858024769 /nfs/dbraw/zinc/02/47/69/858024769.db2.gz UFLPSKPZGGBYKM-QFIPXVFZSA-N 0 3 402.542 4.249 20 0 HIADHN COC(=O)[C@@H]1CCO[C@H]1C1CCN(Cc2cnc(-c3ccc(Cl)cc3)s2)CC1 ZINC000430096816 858030927 /nfs/dbraw/zinc/03/09/27/858030927.db2.gz QBOVSRADGHZIMF-MOPGFXCFSA-N 0 3 420.962 4.254 20 0 HIADHN COc1ccccc1-c1ncc(CN2CCC[C@H]2Cn2c(C)nc3ccccc32)cn1 ZINC000430232971 858091409 /nfs/dbraw/zinc/09/14/09/858091409.db2.gz IXEWJLAIGMQADJ-FQEVSTJZSA-N 0 3 413.525 4.475 20 0 HIADHN COc1ccccc1-c1ncc(CN2C[C@H](C)N(Cc3ccccc3)C[C@H]2C)cn1 ZINC000430246629 858095549 /nfs/dbraw/zinc/09/55/49/858095549.db2.gz SDAOACDWTAUJAC-VQTJNVASSA-N 0 3 402.542 4.247 20 0 HIADHN COC(=O)c1sc2ccccc2c1CN1CC[C@H](C(=O)N(C)c2ccccc2)C1 ZINC000430306629 858116543 /nfs/dbraw/zinc/11/65/43/858116543.db2.gz YRXNMFBXWYGACU-INIZCTEOSA-N 0 3 408.523 4.173 20 0 HIADHN CCOc1ccc(C(=O)CCC(=O)N[C@H]2CCN(Cc3ccccc3)[C@@H](C)C2)cc1 ZINC000430685261 858268300 /nfs/dbraw/zinc/26/83/00/858268300.db2.gz QGWBFPHOHVBEOX-UGKGYDQZSA-N 0 3 408.542 4.218 20 0 HIADHN C[C@H](NCc1cccc2ccccc21)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000430709205 858275087 /nfs/dbraw/zinc/27/50/87/858275087.db2.gz WQTSWVBFGLHKCA-ZDUSSCGKSA-N 0 3 419.344 4.101 20 0 HIADHN Cc1ccccc1[C@@H](N[C@H](C)c1ccc(Br)c(S(N)(=O)=O)c1)C1CC1 ZINC000430725953 858279817 /nfs/dbraw/zinc/27/98/17/858279817.db2.gz YVSCTSABBGYMLL-YJYMSZOUSA-N 0 3 423.376 4.207 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)NCc2c(F)cc(F)c(F)c2F)CC1 ZINC000430939468 858375810 /nfs/dbraw/zinc/37/58/10/858375810.db2.gz GNBAUPKAMMCKNG-UHFFFAOYSA-N 0 3 409.427 4.049 20 0 HIADHN C[C@H]1C(=O)N(C[C@H](c2cccs2)N2CCC(C)CC2)C(=O)N1Cc1ccccc1 ZINC000430946044 858378514 /nfs/dbraw/zinc/37/85/14/858378514.db2.gz USUQGERYVGWWPT-AZUAARDMSA-N 0 3 411.571 4.374 20 0 HIADHN COc1ccc([C@@H](CNC(=O)N[C@H](c2ccccc2)C(F)F)N2CCCC2)cc1 ZINC000430953115 858381013 /nfs/dbraw/zinc/38/10/13/858381013.db2.gz GBFGSRDSJZZXCX-WOJBJXKFSA-N 0 3 403.473 4.138 20 0 HIADHN CC[C@@H](c1ccccc1)N1CC(=O)N(C[C@@H](c2cccc(OC)c2)N2CCCC2)C1=O ZINC000430955513 858382215 /nfs/dbraw/zinc/38/22/15/858382215.db2.gz AUGQIFWPFYXELL-GOTSBHOMSA-N 0 3 421.541 4.248 20 0 HIADHN COCCCOc1cccc(NC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)c1 ZINC000431104484 858447826 /nfs/dbraw/zinc/44/78/26/858447826.db2.gz UXAJPCBFPZDITQ-FQEVSTJZSA-N 0 3 411.546 4.230 20 0 HIADHN C[C@H]1CCN(C(=O)Nc2ccc(NC(=O)C3CC3)cc2)CCN1Cc1ccccc1 ZINC000437684277 863024555 /nfs/dbraw/zinc/02/45/55/863024555.db2.gz FLGPXDFRJRVFFH-SFHVURJKSA-N 0 3 406.530 4.163 20 0 HIADHN O=C1N[C@H](c2ccc(Cl)c(F)c2)C(=O)N1C[C@H]1CCCN(Cc2cccs2)C1 ZINC000431169647 858484076 /nfs/dbraw/zinc/48/40/76/858484076.db2.gz MWAYWTFKTVYOBB-SCLBCKFNSA-N 0 3 421.925 4.046 20 0 HIADHN O=C1[C@@H]2C[C@H](C3CCCCC3)CN2C(=O)N1C[C@@H]1CCCN(Cc2cccs2)C1 ZINC000431170261 858484773 /nfs/dbraw/zinc/48/47/73/858484773.db2.gz PCPAXWFZSYNZHD-LMNJBCLMSA-N 0 3 415.603 4.193 20 0 HIADHN O=C1[C@@H]2C[C@H](C3CCCCC3)CN2C(=O)N1C[C@H]1CCCN(Cc2cccs2)C1 ZINC000431170248 858484827 /nfs/dbraw/zinc/48/48/27/858484827.db2.gz PCPAXWFZSYNZHD-CUWPLCDZSA-N 0 3 415.603 4.193 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)Cc2cccc(OCC(F)(F)F)c2)C1 ZINC000431468010 858631497 /nfs/dbraw/zinc/63/14/97/858631497.db2.gz BGUKPVJKIWGFKZ-LPHOPBHVSA-N 0 3 406.448 4.122 20 0 HIADHN O=C(NCCCN1CCN(Cc2ccccc2)CC1)c1c(Cl)cc(F)cc1Cl ZINC000431499555 858645545 /nfs/dbraw/zinc/64/55/45/858645545.db2.gz IRAGKYNLKOTTBJ-UHFFFAOYSA-N 0 3 424.347 4.070 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3CC(C)(C)[C@@H]3c3ccncc3)c(C)c2)CC1 ZINC000431707591 858753675 /nfs/dbraw/zinc/75/36/75/858753675.db2.gz YLSSGHHNSIHVAS-QFIPXVFZSA-N 0 3 407.562 4.147 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2cccc(-c3noc(C(F)(F)F)n3)c2)N(C)C)cc1 ZINC000431777116 858806762 /nfs/dbraw/zinc/80/67/62/858806762.db2.gz WUIDQNVXTBBHFN-QGZVFWFLSA-N 0 3 418.419 4.097 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3c(Cl)cc(F)cc3Cl)CC2)C[C@H](C)O1 ZINC000431832387 858831789 /nfs/dbraw/zinc/83/17/89/858831789.db2.gz GEBFLGVVVDQPLX-OKILXGFUSA-N 0 3 417.352 4.484 20 0 HIADHN Cc1cc(C)c(NC(=O)N[C@H]2CCN(Cc3ccccc3)C2)c(Br)c1 ZINC000431982667 858901708 /nfs/dbraw/zinc/90/17/08/858901708.db2.gz SPPDAXOIPPBAEQ-KRWDZBQOSA-N 0 3 402.336 4.462 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)C2(Cc3cccc(F)c3)CCOCC2)N(C)C)cc1 ZINC000432055712 858954001 /nfs/dbraw/zinc/95/40/01/858954001.db2.gz TYFQGSWGVKPDRC-HSZRJFAPSA-N 0 3 412.549 4.147 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCCc1cccc(C(F)(F)F)n1)c1ccsc1 ZINC000432106533 858994225 /nfs/dbraw/zinc/99/42/25/858994225.db2.gz JLUYJZUNASOXCQ-INIZCTEOSA-N 0 3 414.497 4.087 20 0 HIADHN O=C(NCCN1CCCC1)c1ccc(CNCc2ccc(F)c(Cl)c2Cl)cc1 ZINC000432252919 859069618 /nfs/dbraw/zinc/06/96/18/859069618.db2.gz IIOZBUSICLGVPV-UHFFFAOYSA-N 0 3 424.347 4.248 20 0 HIADHN Clc1scc(CNc2ccc3nc(CCN4CCOCC4)[nH]c3c2)c1Cl ZINC000432254064 859069671 /nfs/dbraw/zinc/06/96/71/859069671.db2.gz MVSGIBSHBMCICV-UHFFFAOYSA-N 0 3 411.358 4.418 20 0 HIADHN Cc1cc(NC(=O)NC[C@@H]2CCC(F)(F)C2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000432273782 859079891 /nfs/dbraw/zinc/07/98/91/859079891.db2.gz DFNWAZFXUYDRPD-MOPGFXCFSA-N 0 3 417.504 4.195 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N2CCCC[C@H]2c2ccc(F)cc2F)CC1 ZINC000432449609 859169691 /nfs/dbraw/zinc/16/96/91/859169691.db2.gz SICBSYJCSLKJFS-NRFANRHFSA-N 0 3 409.521 4.091 20 0 HIADHN CN(C)CCN(C(=O)Nc1cccc(CSC2CCOCC2)c1)C1CCCC1 ZINC000467573924 881392963 /nfs/dbraw/zinc/39/29/63/881392963.db2.gz DZZOCJMNOAFUSH-UHFFFAOYSA-N 0 3 405.608 4.437 20 0 HIADHN O=C(Nc1ccc(Br)c(C(F)(F)F)c1)[C@@H]1CCCN1C1CCOCC1 ZINC000432585574 859240567 /nfs/dbraw/zinc/24/05/67/859240567.db2.gz SVFCLGYUYYUCLR-HNNXBMFYSA-N 0 3 421.257 4.050 20 0 HIADHN CCCN1CCN(c2ccccc2CNc2ccc3c(c2)CCCN3C(C)=O)CC1 ZINC000432630351 859262686 /nfs/dbraw/zinc/26/26/86/859262686.db2.gz GMXIPPKEMJFDLD-UHFFFAOYSA-N 0 3 406.574 4.130 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)c2cncc(-c3ccc(Cl)cc3)c2)CC1 ZINC000467596570 881405681 /nfs/dbraw/zinc/40/56/81/881405681.db2.gz XCRCKTKCCBNWPK-UHFFFAOYSA-N 0 3 401.938 4.021 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCc3cc(F)c(Cl)cc3F)c(C)c2)CC1 ZINC000432901703 859418813 /nfs/dbraw/zinc/41/88/13/859418813.db2.gz ARXWHWVDGWFFIG-UHFFFAOYSA-N 0 3 422.907 4.390 20 0 HIADHN C[C@H](NS(=O)(=O)c1ccc(CN(C)C)cc1)c1cc(F)c(Cl)cc1Cl ZINC000432937594 859438922 /nfs/dbraw/zinc/43/89/22/859438922.db2.gz IHSUEVPCLHSVGL-NSHDSACASA-N 0 3 405.322 4.234 20 0 HIADHN CCc1nc(-c2ccc(C(=O)N(CC)[C@H]3CCN([C@H](C)c4ccccc4)C3)cc2)n[nH]1 ZINC000433018343 859480928 /nfs/dbraw/zinc/48/09/28/859480928.db2.gz DMYQGSJRUVFHII-GCJKJVERSA-N 0 3 417.557 4.332 20 0 HIADHN COC(=O)c1cc2c(o1)c(OC)ccc2CN1CCC(c2ncc(C)s2)CC1 ZINC000433029703 859488339 /nfs/dbraw/zinc/48/83/39/859488339.db2.gz HNDGYBAXNXXQDE-UHFFFAOYSA-N 0 3 400.500 4.373 20 0 HIADHN CN(CCSCC(=O)N1N=C(c2ccco2)C[C@H]1c1ccco1)Cc1ccccc1 ZINC000433041062 859495965 /nfs/dbraw/zinc/49/59/65/859495965.db2.gz VEQUGTFHLUVIAT-FQEVSTJZSA-N 0 3 423.538 4.416 20 0 HIADHN COc1ccccc1-c1noc(C2CCN(CCC(=O)Nc3cccc(F)c3)CC2)n1 ZINC000433174472 859554387 /nfs/dbraw/zinc/55/43/87/859554387.db2.gz JKHSUVYTHILNGN-UHFFFAOYSA-N 0 3 424.476 4.093 20 0 HIADHN CN(C)Cc1ccccc1C(=O)NC[C@H](c1c(F)cccc1Cl)N1CCCC1 ZINC000433225270 859578201 /nfs/dbraw/zinc/57/82/01/859578201.db2.gz GZGNWVCYEBWOGU-HXUWFJFHSA-N 0 3 403.929 4.108 20 0 HIADHN Cc1cnc(C2CCN(C(=O)NC[C@@H](c3ccc(C)cc3)N3CCCC3)CC2)s1 ZINC000433337556 859652735 /nfs/dbraw/zinc/65/27/35/859652735.db2.gz SNMLSCDTLAPKBR-NRFANRHFSA-N 0 3 412.603 4.486 20 0 HIADHN CN(C)Cc1ccccc1C(=O)N1CCO[C@@H](c2cc(F)c(Cl)cc2Cl)C1 ZINC000433345195 859656598 /nfs/dbraw/zinc/65/65/98/859656598.db2.gz WTSWXNBMXQBNLK-LJQANCHMSA-N 0 3 411.304 4.408 20 0 HIADHN CN(C)Cc1ccccc1C(=O)Nc1cccc(CS(=O)(=O)Cc2ccccc2)c1 ZINC000433346045 859657293 /nfs/dbraw/zinc/65/72/93/859657293.db2.gz BHJKGWJBIJCHKX-UHFFFAOYSA-N 0 3 422.550 4.116 20 0 HIADHN Cc1cccc(OC[C@H](O)CN[C@H](C)c2ccc(OC[C@H]3CCCCO3)c(F)c2)c1 ZINC000433397127 859676152 /nfs/dbraw/zinc/67/61/52/859676152.db2.gz IHPOQKKGOPEGOZ-SYYKKAFVSA-N 0 3 417.521 4.173 20 0 HIADHN O=C(Nc1c2c(ccc1Cl)OCC2)N1CCCN(CCCc2ccccc2)CC1 ZINC000433515429 859746915 /nfs/dbraw/zinc/74/69/15/859746915.db2.gz BLHOXRHBMSCHFW-UHFFFAOYSA-N 0 3 413.949 4.447 20 0 HIADHN O=C(NCc1ccccc1COCc1ccccc1)NC[C@H]1CCCCN1C1CC1 ZINC000433554321 859774076 /nfs/dbraw/zinc/77/40/76/859774076.db2.gz OCLKXNJGQUSMJN-XMMPIXPASA-N 0 3 407.558 4.220 20 0 HIADHN COc1cccc([C@@H](CNC(=O)Nc2ccc(Cl)c(OC)c2)N2CCCC2)c1 ZINC000433604703 859806629 /nfs/dbraw/zinc/80/66/29/859806629.db2.gz SHRRCTKWQNFIEH-LJQANCHMSA-N 0 3 403.910 4.316 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)Cc2cc(F)ccc2Br)C1 ZINC000433717874 859851713 /nfs/dbraw/zinc/85/17/13/859851713.db2.gz JYRBGEQOSLPVTA-KSSFIOAISA-N 0 3 405.311 4.082 20 0 HIADHN CCNC(=O)Nc1cccc(NC(=O)NC[C@H](c2ccccc2)N2CCCC2)c1C ZINC000433725896 859856477 /nfs/dbraw/zinc/85/64/77/859856477.db2.gz CNWCTKVVWZRBMX-OAQYLSRUSA-N 0 3 409.534 4.095 20 0 HIADHN Cc1c(Br)ccc(NC(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)c1F ZINC000433728191 859858318 /nfs/dbraw/zinc/85/83/18/859858318.db2.gz AFPBHLYYDJGFMT-SJLPKXTDSA-N 0 3 406.299 4.464 20 0 HIADHN CCNC(=O)Nc1cccc(NC(=O)NC[C@@H](c2ccc(CC)cc2)N(C)C)c1C ZINC000433757649 859878625 /nfs/dbraw/zinc/87/86/25/859878625.db2.gz OVXUUJDITKJIPM-NRFANRHFSA-N 0 3 411.550 4.123 20 0 HIADHN Cc1nc2ccc(Br)cc2c(N2CCCN(C(=O)C(C)C)CC2)c1C ZINC000433773236 859886880 /nfs/dbraw/zinc/88/68/80/859886880.db2.gz FOAXHJJNSZYBOX-UHFFFAOYSA-N 0 3 404.352 4.309 20 0 HIADHN CC(C)[C@H](N[C@@H](C)C(=O)Nc1ccccc1S(C)(=O)=O)c1ccc(Cl)cc1 ZINC000433779209 859889613 /nfs/dbraw/zinc/88/96/13/859889613.db2.gz HQPHRIQCRSITGB-LIRRHRJNSA-N 0 3 408.951 4.057 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)N[C@H](c2cccc(Cl)c2)C2CCCC2)CC1 ZINC000433814957 859908483 /nfs/dbraw/zinc/90/84/83/859908483.db2.gz YPNUFWMFVLTVSI-AVRDEDQJSA-N 0 3 421.029 4.144 20 0 HIADHN CN(C)Cc1ccc(S(=O)(=O)N[C@@H](Cc2ccccc2)c2cccs2)cc1 ZINC000433863389 859941062 /nfs/dbraw/zinc/94/10/62/859941062.db2.gz FQDYZRCWYBTOKN-FQEVSTJZSA-N 0 3 400.569 4.072 20 0 HIADHN CCN(Cc1cccc(-c2ccncc2)c1)S(=O)(=O)c1ccc(CN(C)C)cc1 ZINC000433877170 859948547 /nfs/dbraw/zinc/94/85/47/859948547.db2.gz KIWUKPJWTPHVIU-UHFFFAOYSA-N 0 3 409.555 4.021 20 0 HIADHN Cc1cc(C(=O)N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)ccc1NC(=O)CC(C)C ZINC000467689546 881481124 /nfs/dbraw/zinc/48/11/24/881481124.db2.gz VSKMMVQKQHLWJV-UGKGYDQZSA-N 0 3 407.558 4.372 20 0 HIADHN Cc1c(NC(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)noc1-c1ccccc1F ZINC000433923569 859973282 /nfs/dbraw/zinc/97/32/82/859973282.db2.gz YSEYWUMZHZCCBE-IBGZPJMESA-N 0 3 422.504 4.917 20 0 HIADHN Cc1c(NC(=O)N(CCCc2ccccc2)CCN(C)C)noc1-c1ccccc1F ZINC000433928538 859978708 /nfs/dbraw/zinc/97/87/08/859978708.db2.gz ATRILXLSHYNVPP-UHFFFAOYSA-N 0 3 424.520 4.817 20 0 HIADHN Cc1nc(COc2ccccc2C(=O)N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)cs1 ZINC000467692970 881486155 /nfs/dbraw/zinc/48/61/55/881486155.db2.gz WABIGGWSGUMYNZ-XLIONFOSSA-N 0 3 421.566 4.423 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)NC[C@@H]1CCCN(c2ccccc2)C1 ZINC000433974573 860011000 /nfs/dbraw/zinc/01/10/00/860011000.db2.gz AUYDKMTXWICTDI-FPOVZHCZSA-N 0 3 412.603 4.101 20 0 HIADHN CC(C)CC(=O)Nc1ccc(C(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)cc1F ZINC000467694409 881488867 /nfs/dbraw/zinc/48/88/67/881488867.db2.gz AABQUPMOOBBDQW-FXAWDEMLSA-N 0 3 411.521 4.203 20 0 HIADHN CCCOc1cccc(CCNC(=O)N(Cc2ccccc2)C2CCN(C)CC2)c1 ZINC000433988517 860019761 /nfs/dbraw/zinc/01/97/61/860019761.db2.gz RKKGIVJUETZAES-UHFFFAOYSA-N 0 3 409.574 4.324 20 0 HIADHN Cc1ccc(C(=O)N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)cc1NC(=O)NC(C)(C)C ZINC000467696678 881490470 /nfs/dbraw/zinc/49/04/70/881490470.db2.gz VYNAYGGJAYAZHJ-WIYYLYMNSA-N 0 3 422.573 4.308 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)Cc2csc(Cc3ccccc3)n2)CN1Cc1ccccc1 ZINC000467699206 881493704 /nfs/dbraw/zinc/49/37/04/881493704.db2.gz DFYTXHPSQJLSFH-GHTZIAJQSA-N 0 3 405.567 4.056 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)c2cccc(NC(=O)c3cccs3)c2)CN1Cc1ccccc1 ZINC000467700854 881495708 /nfs/dbraw/zinc/49/57/08/881495708.db2.gz OFXINIOXJAFAEW-DYESRHJHSA-N 0 3 419.550 4.393 20 0 HIADHN O=C(Nc1cccc(-c2noc(C3CC3)n2)c1)N1CCN(CC2CCCCC2)CC1 ZINC000434050912 860064830 /nfs/dbraw/zinc/06/48/30/860064830.db2.gz CSQKFMYIOFKDDX-UHFFFAOYSA-N 0 3 409.534 4.344 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)CCCc2ncc(-c3ccccc3)o2)CN1Cc1ccccc1 ZINC000467701301 881497177 /nfs/dbraw/zinc/49/71/77/881497177.db2.gz TYVAUWUISWIKSZ-SIKLNZKXSA-N 0 3 403.526 4.444 20 0 HIADHN CCC(=O)c1cccc(NC(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)c1 ZINC000434119912 860120996 /nfs/dbraw/zinc/12/09/96/860120996.db2.gz RDQUTTHNZPDPJT-ROUUACIJSA-N 0 3 401.551 4.023 20 0 HIADHN CCC(=O)c1cccc(NC(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)c1 ZINC000434119910 860121517 /nfs/dbraw/zinc/12/15/17/860121517.db2.gz RDQUTTHNZPDPJT-QZTJIDSGSA-N 0 3 401.551 4.023 20 0 HIADHN C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)c1ccccc1-c1ncc(-c2ccccc2F)o1 ZINC000467718820 881517661 /nfs/dbraw/zinc/51/76/61/881517661.db2.gz UAPIDONJHPVGDR-VFNWGFHPSA-N 0 3 405.473 4.360 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N3CCCCC[C@@H]3CC(=O)c3ccco3)cc2)CC1 ZINC000434258867 860235739 /nfs/dbraw/zinc/23/57/39/860235739.db2.gz ZLCXDQNGZZKQAH-JOCHJYFZSA-N 0 3 423.557 4.079 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)CCOc1ccccc1 ZINC000434309739 860270592 /nfs/dbraw/zinc/27/05/92/860270592.db2.gz TXSDGMFZFMAFBX-NRFANRHFSA-N 0 3 404.514 4.046 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1ccnn1C1CCCC1 ZINC000434316952 860277270 /nfs/dbraw/zinc/27/72/70/860277270.db2.gz ODCKXADFOANOLP-OAQYLSRUSA-N 0 3 418.545 4.202 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1ccc2ncccc2c1 ZINC000434319008 860279218 /nfs/dbraw/zinc/27/92/18/860279218.db2.gz RMGDAVRFOBAUQH-QFIPXVFZSA-N 0 3 411.509 4.439 20 0 HIADHN CCSc1ccc(C(=O)Nc2c(C)cnn2[C@H]2CCN(Cc3ccccc3)C2)cn1 ZINC000434321817 860282373 /nfs/dbraw/zinc/28/23/73/860282373.db2.gz RMDXRMRCPILYCO-FQEVSTJZSA-N 0 3 421.570 4.398 20 0 HIADHN COc1ccc(C(=O)Nc2c(C)cnn2[C@@H]2CCN(Cc3ccccc3)C2)c(C)c1 ZINC000434323223 860283196 /nfs/dbraw/zinc/28/31/96/860283196.db2.gz ZPDBTDKTTWHEPZ-HXUWFJFHSA-N 0 3 404.514 4.208 20 0 HIADHN CCOc1cccc(C(=O)Nc2c(C)cnn2[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000434322274 860283646 /nfs/dbraw/zinc/28/36/46/860283646.db2.gz UPRPVLDVUFRMKY-NRFANRHFSA-N 0 3 404.514 4.290 20 0 HIADHN COc1cc(C(=O)Nc2c(C)cnn2[C@@H]2CCN(Cc3ccccc3)C2)ccc1F ZINC000434330088 860291984 /nfs/dbraw/zinc/29/19/84/860291984.db2.gz IUAKFXVQPMMOBL-LJQANCHMSA-N 0 3 408.477 4.039 20 0 HIADHN CC(=O)c1ccc(C(=O)Nc2c(C)cnn2[C@H]2CCN(Cc3ccccc3)C2)s1 ZINC000434332128 860294232 /nfs/dbraw/zinc/29/42/32/860294232.db2.gz GSWUQAPXCNQKHQ-SFHVURJKSA-N 0 3 408.527 4.155 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1cc(C)c(F)cc1F ZINC000434332693 860294297 /nfs/dbraw/zinc/29/42/97/860294297.db2.gz JKMBFEPKJYNRRY-GOSISDBHSA-N 0 3 410.468 4.477 20 0 HIADHN CCOc1ccccc1C(=O)Nc1c(C)cnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000434334630 860296255 /nfs/dbraw/zinc/29/62/55/860296255.db2.gz RLTPBUIRLNADDB-HXUWFJFHSA-N 0 3 404.514 4.290 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)CNc1c(C)cccc1C ZINC000434358882 860310504 /nfs/dbraw/zinc/31/05/04/860310504.db2.gz SAXBTPAJVKEOPN-QFIPXVFZSA-N 0 3 417.557 4.306 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccc(F)c2)C1)N1CCC(OCC2CCCC2)CC1 ZINC000434369791 860316704 /nfs/dbraw/zinc/31/67/04/860316704.db2.gz MLBJVUIFLKSTEO-OAQYLSRUSA-N 0 3 402.554 4.236 20 0 HIADHN COc1cc(C(=O)NC[C@H]2CCCCN2C2CC2)cc(OC)c1OCc1ccccc1 ZINC000434423616 860344057 /nfs/dbraw/zinc/34/40/57/860344057.db2.gz FRVUSGKPDDNQLZ-OAQYLSRUSA-N 0 3 424.541 4.030 20 0 HIADHN Cc1ccc(Cl)c(NC(=O)NCc2ccc(CN3CCN(C)CC3)cc2)c1C ZINC000434487200 860369104 /nfs/dbraw/zinc/36/91/04/860369104.db2.gz VPBAOVNCUIZDPN-UHFFFAOYSA-N 0 3 400.954 4.026 20 0 HIADHN NC(=O)c1ccc(NC(=O)CCN2CCC[C@H]2c2cccc(Cl)c2)cc1Cl ZINC000434659773 860448922 /nfs/dbraw/zinc/44/89/22/860448922.db2.gz UNBNTGBPSKFKOM-SFHVURJKSA-N 0 3 406.313 4.258 20 0 HIADHN O=C(c1ccc(F)cc1)C1CCN(C[C@H](O)Cc2ccccc2C(F)(F)F)CC1 ZINC000434664198 860451684 /nfs/dbraw/zinc/45/16/84/860451684.db2.gz SZJDDPNNFNYVQG-LJQANCHMSA-N 0 3 409.423 4.343 20 0 HIADHN O=C(c1ccc(F)cc1)C1CCN(C[C@@H](O)Cc2ccccc2C(F)(F)F)CC1 ZINC000434664196 860451825 /nfs/dbraw/zinc/45/18/25/860451825.db2.gz SZJDDPNNFNYVQG-IBGZPJMESA-N 0 3 409.423 4.343 20 0 HIADHN O=C(CN1CCC(c2ncc3n2CCCC3)CC1)N[C@H](c1ccccc1)C1CCCC1 ZINC000434684274 860459682 /nfs/dbraw/zinc/45/96/82/860459682.db2.gz HUXYQSNYGZQHHL-RUZDIDTESA-N 0 3 420.601 4.447 20 0 HIADHN CCN(C(=O)CN1CCC(c2ncc3n2CCCC3)CC1)[C@H](C)c1ccc(F)cc1 ZINC000434687073 860460702 /nfs/dbraw/zinc/46/07/02/860460702.db2.gz WCMOYUCWENSROD-GOSISDBHSA-N 0 3 412.553 4.148 20 0 HIADHN CC(C)C[C@@H](NC(=O)CN1CCC(c2ncc3n2CCCC3)CC1)c1ccccc1 ZINC000434690690 860462822 /nfs/dbraw/zinc/46/28/22/860462822.db2.gz JIDJATOXRVYDSR-HSZRJFAPSA-N 0 3 408.590 4.302 20 0 HIADHN CC(C)N(Cc1ccccc1)C(=O)[C@@H](C)N1CCC(c2ncc3n2CCCC3)CC1 ZINC000434689430 860462972 /nfs/dbraw/zinc/46/29/72/860462972.db2.gz WESKRJSOQVQIPH-HXUWFJFHSA-N 0 3 408.590 4.225 20 0 HIADHN CCOc1ccccc1[C@@H](CC)NC(=O)CN1CCC(c2ncc3n2CCCC3)CC1 ZINC000434690411 860463349 /nfs/dbraw/zinc/46/33/49/860463349.db2.gz GYKFJARQYMFROD-JOCHJYFZSA-N 0 3 424.589 4.065 20 0 HIADHN Cc1noc([C@@H]2CCCN(CCC(=O)Nc3ccc(Oc4ccccc4)cc3)C2)n1 ZINC000434729935 860474370 /nfs/dbraw/zinc/47/43/70/860474370.db2.gz ZZHUGABZJHXYER-GOSISDBHSA-N 0 3 406.486 4.379 20 0 HIADHN C[C@H](C1CC1)N(Cc1ccccc1)C(=O)CN1CCC(c2ncc3n2CCCC3)CC1 ZINC000434736916 860476727 /nfs/dbraw/zinc/47/67/27/860476727.db2.gz NOWMJYCGQRZZJJ-HXUWFJFHSA-N 0 3 420.601 4.226 20 0 HIADHN C[C@@H](NC(=O)[C@@H](C)N1CCC(c2ncc3n2CCCC3)CC1)c1ccc(Cl)cc1 ZINC000434751232 860481055 /nfs/dbraw/zinc/48/10/55/860481055.db2.gz CUUHZBQCOCDYFC-IAGOWNOFSA-N 0 3 414.981 4.318 20 0 HIADHN Cc1c2cc(Br)ccc2oc1C(=O)NCCCCN1C[C@@H](C)O[C@H](C)C1 ZINC000434753229 860482408 /nfs/dbraw/zinc/48/24/08/860482408.db2.gz BGQGLKFAVVXEQF-ZIAGYGMSSA-N 0 3 423.351 4.123 20 0 HIADHN CCOc1cc(CN2CC[C@](C)(c3ccc(C)cc3)C2)nc2nc(C(F)(F)F)nn21 ZINC000434755878 860483411 /nfs/dbraw/zinc/48/34/11/860483411.db2.gz YENYTBRXXAVTGB-FQEVSTJZSA-N 0 3 419.451 4.014 20 0 HIADHN Cc1nn(Cc2ccc(Cl)cc2)c(C)c1CNCCOCC(F)(F)C(F)F ZINC000434782448 860493813 /nfs/dbraw/zinc/49/38/13/860493813.db2.gz CVPPIQVFHMTDTI-UHFFFAOYSA-N 0 3 407.839 4.208 20 0 HIADHN Cc1onc(-c2c(F)cccc2Cl)c1C(=O)NCCCCN1C[C@H](C)O[C@@H](C)C1 ZINC000434789416 860494681 /nfs/dbraw/zinc/49/46/81/860494681.db2.gz MPEKKJXYYLBFPY-KBPBESRZSA-N 0 3 423.916 4.062 20 0 HIADHN COc1ccc2c(c1)CN(CCC(=O)N[C@@H](c1cccs1)c1ccccc1)CC2 ZINC000434790854 860495781 /nfs/dbraw/zinc/49/57/81/860495781.db2.gz ZLDPFMLJYCZDCN-XMMPIXPASA-N 0 3 406.551 4.411 20 0 HIADHN CCn1nccc1C1CCN(CCc2nc3sc4c(c3c(N)n2)CC[C@@H](C)C4)CC1 ZINC000434799292 860498339 /nfs/dbraw/zinc/49/83/39/860498339.db2.gz QYVPIHCNXCGHMT-OAHLLOKOSA-N 0 3 424.618 4.037 20 0 HIADHN CC(C)[C@H]1CCCN1CC(=O)N(Cc1nnc(-c2ccccc2Cl)o1)C1CC1 ZINC000434834924 860513781 /nfs/dbraw/zinc/51/37/81/860513781.db2.gz WVCAEDJQQCIWMC-GOSISDBHSA-N 0 3 402.926 4.001 20 0 HIADHN CCN(CC)C(=O)c1cccc(NC(=O)[C@H](C)N2CC[C@H](c3ccccc3)[C@@H]2C)c1 ZINC000434901908 860545964 /nfs/dbraw/zinc/54/59/64/860545964.db2.gz FYDAMKSTFBPQBH-YDHSSHFGSA-N 0 3 407.558 4.374 20 0 HIADHN COc1cc(CN2CCC[C@@H](CNC(C)=O)C2)ccc1OCc1ccc(Cl)cc1 ZINC000434982971 860584978 /nfs/dbraw/zinc/58/49/78/860584978.db2.gz OBJWITVOQMEJHS-FQEVSTJZSA-N 0 3 416.949 4.276 20 0 HIADHN O=C(c1cc(COc2ccc(Cl)cc2Cl)on1)N1CC[C@@H](N2CCCCC2)C1 ZINC000435011459 860596975 /nfs/dbraw/zinc/59/69/75/860596975.db2.gz JYWALFNACCAWSF-OAHLLOKOSA-N 0 3 424.328 4.261 20 0 HIADHN CSc1nc(-c2ccco2)nc(C)c1C(=O)N[C@@H]1C[C@H](C)N(Cc2ccccc2)C1 ZINC000467751272 881560490 /nfs/dbraw/zinc/56/04/90/881560490.db2.gz AQMNYZCQIYZIGZ-MAUKXSAKSA-N 0 3 422.554 4.160 20 0 HIADHN O=C(Nc1ccc(F)c(Cl)c1)C1CCN(Cc2ccc(-c3cc[nH]n3)o2)CC1 ZINC000435126298 860652783 /nfs/dbraw/zinc/65/27/83/860652783.db2.gz LJOYSPIKQPXFLZ-UHFFFAOYSA-N 0 3 402.857 4.313 20 0 HIADHN C[C@H](SCC(=O)N[C@H]1C[C@H](C)N(Cc2ccccc2)C1)c1nc2ccccc2[nH]1 ZINC000467755110 881567276 /nfs/dbraw/zinc/56/72/76/881567276.db2.gz QVZIAKBPGGCJSY-LNLFQRSKSA-N 0 3 408.571 4.136 20 0 HIADHN C[C@H](SCC(=O)N[C@@H]1C[C@H](C)N(Cc2ccccc2)C1)c1nc2ccccc2[nH]1 ZINC000467755109 881567615 /nfs/dbraw/zinc/56/76/15/881567615.db2.gz QVZIAKBPGGCJSY-JENIJYKNSA-N 0 3 408.571 4.136 20 0 HIADHN COc1cc(CN2CCC[C@@H](CO)C2)ccc1OCCOc1ccccc1Cl ZINC000435240424 860702379 /nfs/dbraw/zinc/70/23/79/860702379.db2.gz OCQYYEFMQJXXMX-GOSISDBHSA-N 0 3 405.922 4.011 20 0 HIADHN Cc1cc(NC(=O)[C@@H](C)Oc2ccc(F)cc2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435276603 860713192 /nfs/dbraw/zinc/71/31/92/860713192.db2.gz ZUCJOEMJPAXHQS-NQIIRXRSSA-N 0 3 422.504 4.184 20 0 HIADHN Cc1cc(NC(=O)[C@@H](C)COc2ccccc2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435277046 860714075 /nfs/dbraw/zinc/71/40/75/860714075.db2.gz IKPKWIZSQZYPAR-SIKLNZKXSA-N 0 3 418.541 4.292 20 0 HIADHN Cc1cc(NC(=O)Cc2c[nH]c3ccccc23)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435277705 860714169 /nfs/dbraw/zinc/71/41/69/860714169.db2.gz KAZJSRMHWISMQF-OAQYLSRUSA-N 0 3 413.525 4.301 20 0 HIADHN Cc1cc(NC(=O)COc2c(C)cccc2C)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435278241 860714375 /nfs/dbraw/zinc/71/43/75/860714375.db2.gz FZZTYNPPZBNJRW-QFIPXVFZSA-N 0 3 418.541 4.273 20 0 HIADHN Cc1cc(NC(=O)c2cccc3c2CCC3)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435280409 860716116 /nfs/dbraw/zinc/71/61/16/860716116.db2.gz NOCJXRXBRBAHOG-OAQYLSRUSA-N 0 3 400.526 4.380 20 0 HIADHN COc1cccc([C@@H](C)C(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000435282054 860717176 /nfs/dbraw/zinc/71/71/76/860717176.db2.gz YISYKEIDENKGRJ-KNQAVFIVSA-N 0 3 418.541 4.389 20 0 HIADHN Cc1cc(NC(=O)CCOc2ccc(F)cc2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435287362 860720208 /nfs/dbraw/zinc/72/02/08/860720208.db2.gz GPMFBHAEXYJTOQ-NRFANRHFSA-N 0 3 422.504 4.185 20 0 HIADHN CCOCCC1(C(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)CCC1 ZINC000435289609 860721287 /nfs/dbraw/zinc/72/12/87/860721287.db2.gz OEPWFMCRUSWFME-OAQYLSRUSA-N 0 3 410.562 4.174 20 0 HIADHN CCOc1ccccc1C(=O)Nc1cc(C)nn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435295346 860723933 /nfs/dbraw/zinc/72/39/33/860723933.db2.gz OSYNOAINHKYHFX-HXUWFJFHSA-N 0 3 404.514 4.290 20 0 HIADHN CC(C)c1noc(-c2ccccc2C(=O)N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)n1 ZINC000467757137 881573303 /nfs/dbraw/zinc/57/33/03/881573303.db2.gz XAUYHMLMPHNUOJ-IEBWSBKVSA-N 0 3 404.514 4.253 20 0 HIADHN CCOc1cc(C(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)ccc1C ZINC000435370719 860768576 /nfs/dbraw/zinc/76/85/76/860768576.db2.gz QOOBEBWSCWYOFT-OAQYLSRUSA-N 0 3 404.514 4.290 20 0 HIADHN CC(C)(C)c1nc(CC(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)cs1 ZINC000435371983 860769495 /nfs/dbraw/zinc/76/94/95/860769495.db2.gz PQRFVHDJSCNFPG-LJQANCHMSA-N 0 3 423.586 4.265 20 0 HIADHN Cc1ccc(SCC(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000435371691 860769813 /nfs/dbraw/zinc/76/98/13/860769813.db2.gz WPTLLAICLDEXAA-HXUWFJFHSA-N 0 3 406.555 4.369 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)[C@@H]1C[C@@H]1c1c(F)cccc1F ZINC000435372510 860770472 /nfs/dbraw/zinc/77/04/72/860770472.db2.gz JVEXNPUHAMQDKV-CEXWTWQISA-N 0 3 422.479 4.351 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)[C@H]1C[C@@H]1c1c(F)cccc1F ZINC000435372515 860770676 /nfs/dbraw/zinc/77/06/76/860770676.db2.gz JVEXNPUHAMQDKV-QYZOEREBSA-N 0 3 422.479 4.351 20 0 HIADHN COc1cccc([C@@H]2C[C@@H]2C(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000435373956 860772110 /nfs/dbraw/zinc/77/21/10/860772110.db2.gz ONQVIKGRMMBCPF-PUHATCMVSA-N 0 3 416.525 4.081 20 0 HIADHN C[C@@H](Oc1ccccc1Cl)C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435375300 860773242 /nfs/dbraw/zinc/77/32/42/860773242.db2.gz LRGDOFVGCCONLT-IEBWSBKVSA-N 0 3 424.932 4.390 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)[C@@H]1C[C@@]12CCc1ccccc12 ZINC000435377972 860774878 /nfs/dbraw/zinc/77/48/78/860774878.db2.gz BQGHLKUCRLAOFE-VIICAESSSA-N 0 3 412.537 4.173 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)[C@@H]1CCCc2sccc21 ZINC000435377399 860775146 /nfs/dbraw/zinc/77/51/46/860775146.db2.gz BCVSLUDLJFDVLR-UYAOXDASSA-N 0 3 406.555 4.450 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)[C@H]1SCCc2ccccc21 ZINC000435380350 860776802 /nfs/dbraw/zinc/77/68/02/860776802.db2.gz NTEKATOGOBPJND-OFNKIYASSA-N 0 3 418.566 4.299 20 0 HIADHN O=C(Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)[C@@H]1SCCc2ccccc21 ZINC000435380349 860776865 /nfs/dbraw/zinc/77/68/65/860776865.db2.gz NTEKATOGOBPJND-NZQKXSOJSA-N 0 3 418.566 4.299 20 0 HIADHN CC[C@@H](Oc1ccccc1F)C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435381745 860777968 /nfs/dbraw/zinc/77/79/68/860777968.db2.gz XRNGXRCEVDLMLD-PZJWPPBQSA-N 0 3 422.504 4.265 20 0 HIADHN COc1cccc([C@H](C)CC(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000435381605 860778015 /nfs/dbraw/zinc/77/80/15/860778015.db2.gz UXOCIDIAPDJXOA-KNQAVFIVSA-N 0 3 418.541 4.471 20 0 HIADHN O=C(NCc1csc(CCc2ccccc2)n1)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000435530335 860845877 /nfs/dbraw/zinc/84/58/77/860845877.db2.gz WGAUASBFTWIEBY-NRFANRHFSA-N 0 3 420.582 4.002 20 0 HIADHN CC(C)[C@@H](CNC(=O)N(CCN(C)C)Cc1cccc(Cl)c1)c1cccnc1 ZINC000435537606 860852445 /nfs/dbraw/zinc/85/24/45/860852445.db2.gz QIWSKCUHEDOHEQ-OAQYLSRUSA-N 0 3 402.970 4.248 20 0 HIADHN Cc1c(NC(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)cnn1-c1ccccc1 ZINC000435552737 860870311 /nfs/dbraw/zinc/87/03/11/860870311.db2.gz WAWQXBHRLOSVFG-LJQANCHMSA-N 0 3 403.530 4.309 20 0 HIADHN Cc1c(NC(=O)N[C@@H](CN2CCCC2)c2ccccc2)cnn1-c1ccccc1F ZINC000435561882 860883167 /nfs/dbraw/zinc/88/31/67/860883167.db2.gz ZDUAATVQQQMVBX-NRFANRHFSA-N 0 3 407.493 4.278 20 0 HIADHN O=C(Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)c1cc(-c2cccs2)[nH]n1 ZINC000435639577 860930190 /nfs/dbraw/zinc/93/01/90/860930190.db2.gz VHPTYBBNUJTTLX-KRWDZBQOSA-N 0 3 418.526 4.034 20 0 HIADHN Cc1cc(C(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)c(C)n1C1CC1 ZINC000435645042 860932594 /nfs/dbraw/zinc/93/25/94/860932594.db2.gz KWSNHMJYJZBRMM-NRFANRHFSA-N 0 3 403.530 4.336 20 0 HIADHN CCn1c(C)cc(C(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)c1C ZINC000435696416 860979530 /nfs/dbraw/zinc/97/95/30/860979530.db2.gz JPLWOCJDOZONMV-OAQYLSRUSA-N 0 3 405.546 4.329 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)c1c[nH]nc1-c1cc2ccccc2o1 ZINC000435813652 861078671 /nfs/dbraw/zinc/07/86/71/861078671.db2.gz LEGWXRSNJIPDND-QGZVFWFLSA-N 0 3 406.511 4.451 20 0 HIADHN Cc1cccc2nc(C3CCN(C(=O)NC[C@@H](c4ccccc4)N(C)C)CC3)oc21 ZINC000435862396 861121713 /nfs/dbraw/zinc/12/17/13/861121713.db2.gz YXRPRTNXRKBZNH-NRFANRHFSA-N 0 3 406.530 4.328 20 0 HIADHN COc1ccc([C@@H](CNC(=O)N[C@H]2C[C@H](c3ccccc3F)C2)N2CCCC2)cc1 ZINC000435868521 861129392 /nfs/dbraw/zinc/12/93/92/861129392.db2.gz FMEHVBLLTQBWLA-DNVFCKCGSA-N 0 3 411.521 4.217 20 0 HIADHN CCc1nc(CN(C(C)=O)[C@@H]2CCN(Cc3cccc(-c4ccc(C)cc4)c3)C2)no1 ZINC000435871201 861131748 /nfs/dbraw/zinc/13/17/48/861131748.db2.gz JFCJXPSUISDFJZ-HSZRJFAPSA-N 0 3 418.541 4.230 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(Br)cc1)C(=O)Nc1ccc2c(c1)OCCCO2 ZINC000435887174 861144549 /nfs/dbraw/zinc/14/45/49/861144549.db2.gz AJDHSJNGAXLJFH-UONOGXRCSA-N 0 3 419.319 4.288 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1ccc(OC(C)C)cn1 ZINC000435905999 861165945 /nfs/dbraw/zinc/16/59/45/861165945.db2.gz IBWXBZNGKHTUGT-FQEVSTJZSA-N 0 3 419.529 4.073 20 0 HIADHN C[C@H]1CCN(C(=O)Nc2ccc(OC[C@@H]3CCCO3)cc2)CCN1Cc1ccccc1 ZINC000437742518 863070037 /nfs/dbraw/zinc/07/00/37/863070037.db2.gz GCIRORBPAUPQMQ-RDPSFJRHSA-N 0 3 423.557 4.373 20 0 HIADHN C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)c1ccccc1-c1nc(-c2cccc(Cl)c2)no1 ZINC000467811401 881639353 /nfs/dbraw/zinc/63/93/53/881639353.db2.gz KMYPTDUCJRQWSH-VLIAUNLRSA-N 0 3 422.916 4.270 20 0 HIADHN O[C@@H](COC(c1ccccc1)c1ccccc1)CN1CCC(Oc2ccccn2)CC1 ZINC000437906176 863279797 /nfs/dbraw/zinc/27/97/97/863279797.db2.gz QSQIXPYYTWTRHT-HSZRJFAPSA-N 0 3 418.537 4.092 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCc3cccc(CSC)c3)c(C)c2)CC1 ZINC000437934485 863310133 /nfs/dbraw/zinc/31/01/33/863310133.db2.gz NGTAJSLMYSWVQY-UHFFFAOYSA-N 0 3 412.603 4.322 20 0 HIADHN C[C@H]1CCCN(CCNC(=O)c2cc(COc3c(Cl)cccc3Cl)on2)C1 ZINC000467822411 881651354 /nfs/dbraw/zinc/65/13/54/881651354.db2.gz AZSSAJUBOOEPEK-ZDUSSCGKSA-N 0 3 412.317 4.022 20 0 HIADHN CN(C(=O)c1ccc2ccc(Cl)cc2n1)C1CCN(CCc2ccccn2)CC1 ZINC000438057636 863427653 /nfs/dbraw/zinc/42/76/53/863427653.db2.gz AHFYVILZKNJOLZ-UHFFFAOYSA-N 0 3 408.933 4.062 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@@H](C)NCc2ccc3nc(C)ccc3c2)cc1 ZINC000438074123 863458803 /nfs/dbraw/zinc/45/88/03/863458803.db2.gz MRXNYXPJEOAXRU-GOSISDBHSA-N 0 3 411.571 4.425 20 0 HIADHN Cc1ccccc1O[C@H](C)CNC(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000438081619 863477920 /nfs/dbraw/zinc/47/79/20/863477920.db2.gz PBJLYYWVXSPYNE-LJQANCHMSA-N 0 3 413.587 4.175 20 0 HIADHN C[C@@H](CNC(=O)Nc1ccc(CCN2CCSCC2)cc1)Cc1cccs1 ZINC000438092563 863495621 /nfs/dbraw/zinc/49/56/21/863495621.db2.gz HHOBAYRHZUFYIS-QGZVFWFLSA-N 0 3 403.617 4.340 20 0 HIADHN COc1cccc(F)c1[C@@H](C)NC(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000438100254 863509894 /nfs/dbraw/zinc/50/98/94/863509894.db2.gz LJNTYZQONXSKGS-MRXNPFEDSA-N 0 3 417.550 4.308 20 0 HIADHN CC(C)N1CCCN(C(=O)c2cc(COc3c(Cl)cccc3Cl)on2)CC1 ZINC000467834898 881668970 /nfs/dbraw/zinc/66/89/70/881668970.db2.gz WTILNPWDXZXNDW-UHFFFAOYSA-N 0 3 412.317 4.117 20 0 HIADHN O=C(Nc1ccccc1)c1cc(NC(=O)N2CC[C@H](N3CC=CC3)C2)ccc1Cl ZINC000438173699 863597388 /nfs/dbraw/zinc/59/73/88/863597388.db2.gz FGODOPQFSJAMGN-SFHVURJKSA-N 0 3 410.905 4.070 20 0 HIADHN C[C@@H](N[C@@H]1CCCc2cc(OC(F)F)ccc21)c1cccc(S(=O)(=O)N(C)C)c1 ZINC000467839443 881676034 /nfs/dbraw/zinc/67/60/34/881676034.db2.gz PAVYATUPXFPKMH-JLTOFOAXSA-N 0 3 424.513 4.267 20 0 HIADHN C[C@H](NCc1cccc(OCCN2CCOCC2)c1)c1cccc(Br)c1 ZINC000467843542 881686341 /nfs/dbraw/zinc/68/63/41/881686341.db2.gz IVFSHDGAUMLHHQ-KRWDZBQOSA-N 0 3 419.363 4.011 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)Nc2cccc(CSC3CCCC3)c2)CC1 ZINC000438248675 863710741 /nfs/dbraw/zinc/71/07/41/863710741.db2.gz UNLDATAURYRINH-LJQANCHMSA-N 0 3 418.651 4.258 20 0 HIADHN O=C(Nc1cc(Cl)ccc1SCC(F)(F)F)N1CC[C@H](N2CC=CC2)C1 ZINC000438251675 863714903 /nfs/dbraw/zinc/71/49/03/863714903.db2.gz ISPVPVZKXLVKJU-ZDUSSCGKSA-N 0 3 405.873 4.472 20 0 HIADHN C[C@@H](N[C@H](Cc1ccccc1)C(=O)N1CCCC1)c1cccc(Br)c1 ZINC000467847102 881693155 /nfs/dbraw/zinc/69/31/55/881693155.db2.gz UXCAPAWUUPJGAJ-OXQOHEQNSA-N 0 3 401.348 4.333 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)Nc2cccc(N3CCCCC3=O)c2)CC1 ZINC000438323215 863801247 /nfs/dbraw/zinc/80/12/47/863801247.db2.gz CEGOAYBTUCPDGN-UHFFFAOYSA-N 0 3 420.557 4.332 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)N[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl ZINC000438367049 863828231 /nfs/dbraw/zinc/82/82/31/863828231.db2.gz YTFAGYFUYGSNOI-PKOBYXMFSA-N 0 3 407.345 4.018 20 0 HIADHN CN(C)CCN(C[C@H]1CCCO1)C(=O)Nc1ccnc(Oc2ccccc2Cl)c1 ZINC000438376005 863835172 /nfs/dbraw/zinc/83/51/72/863835172.db2.gz KOLCRECUSVHKNQ-QGZVFWFLSA-N 0 3 418.925 4.102 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Cc1ccc(NC(=O)CC(C)(C)C)cc1 ZINC000438461149 863884433 /nfs/dbraw/zinc/88/44/33/863884433.db2.gz DRQHAFOYRSUZAW-UHFFFAOYSA-N 0 3 415.603 4.256 20 0 HIADHN COC(=O)C(C)(C)c1ccc(NC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)cc1 ZINC000438470738 863890715 /nfs/dbraw/zinc/89/07/15/863890715.db2.gz JUDYMJNPXOGYJY-IBGZPJMESA-N 0 3 423.557 4.266 20 0 HIADHN COC(=O)C(C)(C)c1ccc(NC(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)cc1 ZINC000438471447 863890997 /nfs/dbraw/zinc/89/09/97/863890997.db2.gz SPOHFCIMBMBMGU-LJQANCHMSA-N 0 3 423.557 4.266 20 0 HIADHN COc1ccc([C@@H](C)N[C@@H](C)c2cc(F)ccc2N2CCN(C)CC2)cc1OC ZINC000467856985 881706711 /nfs/dbraw/zinc/70/67/11/881706711.db2.gz UCHSKQQZWPQGIG-SJORKVTESA-N 0 3 401.526 4.007 20 0 HIADHN C[C@@H](CNC(=O)Nc1cccc(CSC2CCCCC2)c1)CN1CCN(C)CC1 ZINC000438506818 863930019 /nfs/dbraw/zinc/93/00/19/863930019.db2.gz HMRLVCNUFRUNFH-IBGZPJMESA-N 0 3 418.651 4.258 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)Nc3ccccc3CC(F)(F)F)CC2)C[C@H](C)O1 ZINC000438623544 864049673 /nfs/dbraw/zinc/04/96/73/864049673.db2.gz NAOPTBUHDMYOLA-HOTGVXAUSA-N 0 3 413.484 4.145 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3ccccc3CC(F)(F)F)CC2)C[C@@H](C)O1 ZINC000438623547 864049850 /nfs/dbraw/zinc/04/98/50/864049850.db2.gz NAOPTBUHDMYOLA-HZPDHXFCSA-N 0 3 413.484 4.145 20 0 HIADHN Cc1cc(C)n(-c2ccc(NC(=O)N(CCN(C)C)Cc3cccs3)cc2F)n1 ZINC000438635066 864066184 /nfs/dbraw/zinc/06/61/84/864066184.db2.gz KBOBWSJAOQUEDC-UHFFFAOYSA-N 0 3 415.538 4.285 20 0 HIADHN CCN(C(=O)C(=O)Nc1ccsc1Cl)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000438653454 864094791 /nfs/dbraw/zinc/09/47/91/864094791.db2.gz FKGXWGOMKGUWCU-GOEBONIOSA-N 0 3 405.951 4.024 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)Nc1ccc(OC2CCCC2)c(F)c1 ZINC000438657725 864102352 /nfs/dbraw/zinc/10/23/52/864102352.db2.gz TUIOBZGISQXGSE-UHFFFAOYSA-N 0 3 400.498 4.138 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Nc1cc(F)ccc1OC[C@H]1CCCO1 ZINC000438664422 864116556 /nfs/dbraw/zinc/11/65/56/864116556.db2.gz HYZLYOXXWJTBCZ-QGZVFWFLSA-N 0 3 421.538 4.041 20 0 HIADHN CCN(C(=O)C(=O)Nc1ccccc1SC)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000438666549 864120592 /nfs/dbraw/zinc/12/05/92/864120592.db2.gz ICSBYYDJJACVQU-MJGOQNOKSA-N 0 3 411.571 4.031 20 0 HIADHN CCN(C(=O)CNC1(c2ccc(Br)cc2)CCOCC1)c1ccccc1 ZINC000438721564 864201950 /nfs/dbraw/zinc/20/19/50/864201950.db2.gz FQIPLLIXLOCNKF-UHFFFAOYSA-N 0 3 417.347 4.098 20 0 HIADHN Cc1ccc(C(F)(F)F)cc1NC(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000438756898 864251311 /nfs/dbraw/zinc/25/13/11/864251311.db2.gz KCTVHLALERDIQX-UHFFFAOYSA-N 0 3 421.463 4.292 20 0 HIADHN CCN1CCC[C@H]1CNC(=O)C(=O)Nc1ccc([C@H](C)Sc2ccccc2)cc1 ZINC000438808569 864298895 /nfs/dbraw/zinc/29/88/95/864298895.db2.gz BSIVYKKYKMDOLR-PXNSSMCTSA-N 0 3 411.571 4.079 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)[C@H]3C[C@]34CCCc3ccccc34)c(C)c2)CC1 ZINC000438893548 864375007 /nfs/dbraw/zinc/37/50/07/864375007.db2.gz LFRUZPAPYTVLPZ-BVAGGSTKSA-N 0 3 403.570 4.370 20 0 HIADHN Cc1cc(C)c(CC(C(=O)N2CCNC(=O)c3ccccc32)C(F)(F)F)c(C)c1 ZINC000438951085 864422133 /nfs/dbraw/zinc/42/21/33/864422133.db2.gz IPAOPSIBZVFVOE-GOSISDBHSA-N 0 3 404.432 4.109 20 0 HIADHN COc1ccc(NC(=O)CC2(N3CCOCC3)CCCC2)c(OCc2ccccc2)c1 ZINC000439013687 864465019 /nfs/dbraw/zinc/46/50/19/864465019.db2.gz DRAJEXWEXDDMNW-UHFFFAOYSA-N 0 3 424.541 4.248 20 0 HIADHN COC(=O)[C@@H](NC1CCN([C@H](C)c2ccncc2)CC1)c1cc(Cl)cc(Cl)c1 ZINC000439044486 864497198 /nfs/dbraw/zinc/49/71/98/864497198.db2.gz APTMKPUYAOYMNL-VLIAUNLRSA-N 0 3 422.356 4.418 20 0 HIADHN Cc1cc(O)c(C(C)C)cc1C(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000439062236 864512348 /nfs/dbraw/zinc/51/23/48/864512348.db2.gz XDYRDVAMARYDKK-RTBURBONSA-N 0 3 402.579 4.176 20 0 HIADHN CS(=O)(=O)Cc1ccc(CN[C@@H](c2ccc(Br)s2)C2CC2)cc1 ZINC000439138247 864571273 /nfs/dbraw/zinc/57/12/73/864571273.db2.gz UQCOLUVWYMKUPM-QGZVFWFLSA-N 0 3 414.390 4.296 20 0 HIADHN CN(C)Cc1cccc(NC(=O)C(=O)Nc2ccc(OCC3CCCCC3)cc2)c1 ZINC000439180691 864609335 /nfs/dbraw/zinc/60/93/35/864609335.db2.gz UFDAYXICPHZDFH-UHFFFAOYSA-N 0 3 409.530 4.285 20 0 HIADHN CCN(C[C@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)c1ccc(Cl)cc1F ZINC000439231693 864648140 /nfs/dbraw/zinc/64/81/40/864648140.db2.gz VXGDMDZQNUSMNV-KRWDZBQOSA-N 0 3 410.942 4.012 20 0 HIADHN COc1ccccc1O[C@H](C)CNCc1cc(Cl)ccc1OC[C@H]1CCCO1 ZINC000439467671 864842602 /nfs/dbraw/zinc/84/26/02/864842602.db2.gz JKMNFQHABFYDQC-VQIMIIECSA-N 0 3 405.922 4.464 20 0 HIADHN COc1cccc([C@H](CNCc2cc(Cl)ccc2OC[C@H]2CCCO2)N(C)C)c1 ZINC000439480611 864846602 /nfs/dbraw/zinc/84/66/02/864846602.db2.gz VLIRIAPGJPTNPI-YADHBBJMSA-N 0 3 418.965 4.299 20 0 HIADHN COc1ccc(NC(=O)[C@H](NC2CCC(c3nc(C)no3)CC2)c2ccccc2)cc1 ZINC000439517831 864860051 /nfs/dbraw/zinc/86/00/51/864860051.db2.gz GJBFCEDHTYODMQ-OBFZPWGMSA-N 0 3 420.513 4.382 20 0 HIADHN CCCCCn1nc(C)cc1NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000467939632 881810797 /nfs/dbraw/zinc/81/07/97/881810797.db2.gz SWJRRFHFIVPZSF-UHFFFAOYSA-N 0 3 415.504 4.309 20 0 HIADHN COC(=O)[C@@H](NCC1CCN(Cc2ccccc2Cl)CC1)c1ccccc1F ZINC000439601413 864922752 /nfs/dbraw/zinc/92/27/52/864922752.db2.gz AKLNKCQJGSHFHS-NRFANRHFSA-N 0 3 404.913 4.195 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)NC[C@@H]1CCC[C@H](C(F)(F)F)C1 ZINC000439623765 864946722 /nfs/dbraw/zinc/94/67/22/864946722.db2.gz KPGRHWAABDVSKP-WBVHZDCISA-N 0 3 403.464 4.268 20 0 HIADHN CO[C@@H](C)c1nc(CN2CCCN(CCOc3c(C)cccc3C)CC2)cs1 ZINC000439623519 864947858 /nfs/dbraw/zinc/94/78/58/864947858.db2.gz RRFBJFJVTWQKSI-IBGZPJMESA-N 0 3 403.592 4.054 20 0 HIADHN CN(CCN(Cc1ccccc1)C(=O)c1cn2ccnc2s1)Cc1ccccc1 ZINC000467956822 881820122 /nfs/dbraw/zinc/82/01/22/881820122.db2.gz GATMAJCTZWCEJR-UHFFFAOYSA-N 0 3 404.539 4.170 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)NC[C@H]1CCC[C@H](C(F)(F)F)C1 ZINC000439633707 864959544 /nfs/dbraw/zinc/95/95/44/864959544.db2.gz MEBHGYNZPHHKJK-IRXDYDNUSA-N 0 3 403.464 4.268 20 0 HIADHN COc1ccc(C)cc1NC(=O)[C@H](NCC1(SC)CCOCC1)c1ccccc1 ZINC000439634480 864960677 /nfs/dbraw/zinc/96/06/77/864960677.db2.gz PPMGZNYRFUOOGC-OAQYLSRUSA-N 0 3 414.571 4.185 20 0 HIADHN CC(C)c1ccccc1OC[C@H](O)CN1CCC(c2nc(-c3ccccc3)n[nH]2)CC1 ZINC000439738619 865070806 /nfs/dbraw/zinc/07/08/06/865070806.db2.gz YNERPHOHRCNXBG-OAQYLSRUSA-N 0 3 420.557 4.214 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)c2ccc(OCc3ccccn3)cc2)CC1 ZINC000439740835 865072477 /nfs/dbraw/zinc/07/24/77/865072477.db2.gz CQEJSCNBFKKXDD-LJQANCHMSA-N 0 3 416.525 4.011 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)[C@H](C)c2ccc(Br)s2)CC1 ZINC000439751353 865080613 /nfs/dbraw/zinc/08/06/13/865080613.db2.gz LRZLGDISHSCTGS-ZIAGYGMSSA-N 0 3 422.392 4.351 20 0 HIADHN Cc1cc(O[C@@H](C)C(=O)NC2CCN([C@H](C)c3ccncc3)CC2)ccc1Cl ZINC000439750792 865081141 /nfs/dbraw/zinc/08/11/41/865081141.db2.gz VNVRCCKWNSRKFD-SJORKVTESA-N 0 3 401.938 4.153 20 0 HIADHN C[C@@H](SCC(=O)NC1CCN([C@H](C)c2ccncc2)CC1)c1nc2ccccc2[nH]1 ZINC000439764262 865090665 /nfs/dbraw/zinc/09/06/65/865090665.db2.gz HDRBOUUHNCTPOK-IAGOWNOFSA-N 0 3 423.586 4.094 20 0 HIADHN C[C@@H](Oc1cc(Cl)cc(Cl)c1)C(=O)NC1CCN([C@H](C)c2ccncc2)CC1 ZINC000439764989 865090803 /nfs/dbraw/zinc/09/08/03/865090803.db2.gz FZWILRWVJNDTAY-HUUCEWRRSA-N 0 3 422.356 4.498 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)CCCOc2ccc(Cl)cc2)CC1 ZINC000439765397 865090861 /nfs/dbraw/zinc/09/08/61/865090861.db2.gz ZSCHWJVTSPNIOY-QGZVFWFLSA-N 0 3 401.938 4.236 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)C2(c3cccc(C(F)(F)F)c3)CC2)CC1 ZINC000439767071 865092508 /nfs/dbraw/zinc/09/25/08/865092508.db2.gz JOKCOIUZVKMHDA-INIZCTEOSA-N 0 3 417.475 4.474 20 0 HIADHN Cc1ccc(-c2ccnn2C)cc1NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000439950845 865243722 /nfs/dbraw/zinc/24/37/22/865243722.db2.gz BKXSEQGPQFJHLB-NRFANRHFSA-N 0 3 403.530 4.182 20 0 HIADHN Cc1ccc(-c2ccnn2C)cc1NC(=O)NC[C@H]1CCCN1Cc1ccccc1 ZINC000439960369 865253087 /nfs/dbraw/zinc/25/30/87/865253087.db2.gz ZVQBQRLSJWHAGJ-OAQYLSRUSA-N 0 3 403.530 4.182 20 0 HIADHN Cc1cccc(NC(=O)Nc2cccc(CNC(=O)N(CCN(C)C)C(C)C)c2)c1 ZINC000440069580 865337337 /nfs/dbraw/zinc/33/73/37/865337337.db2.gz HRRKTRPZKKTMND-UHFFFAOYSA-N 0 3 411.550 4.121 20 0 HIADHN CCc1nc(C)c([C@H](C)N[C@H]2CC(=O)N(Cc3ccccc3C(F)(F)F)C2)s1 ZINC000468050022 881876359 /nfs/dbraw/zinc/87/63/59/881876359.db2.gz WQHLJKCOOHMOMZ-WFASDCNBSA-N 0 3 411.493 4.484 20 0 HIADHN C[C@H](NC(=O)N(CCN(C)C)C1CCCC1)c1cccc(OCc2ccccn2)c1 ZINC000468055443 881879321 /nfs/dbraw/zinc/87/93/21/881879321.db2.gz SJDPPVCACDXVTJ-IBGZPJMESA-N 0 3 410.562 4.237 20 0 HIADHN CC(C)n1cnnc1-c1ccccc1NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000440277383 865527223 /nfs/dbraw/zinc/52/72/23/865527223.db2.gz PEKSHFTZLIWXFO-FQEVSTJZSA-N 0 3 418.545 4.312 20 0 HIADHN CC(C)n1cnnc1-c1ccccc1NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000440277385 865528420 /nfs/dbraw/zinc/52/84/20/865528420.db2.gz PEKSHFTZLIWXFO-HXUWFJFHSA-N 0 3 418.545 4.312 20 0 HIADHN CCN1CCN(CCC(=O)N(Cc2ccc(-c3ccc(F)cc3)s2)C(C)C)CC1 ZINC000468062111 881882021 /nfs/dbraw/zinc/88/20/21/881882021.db2.gz YFEMCUCGTDTKHT-UHFFFAOYSA-N 0 3 417.594 4.319 20 0 HIADHN CC(C)C1CCC(N2CCN([C@@H](C)C(=O)NCCc3c[nH]c4ccccc34)CC2)CC1 ZINC000440320451 865589416 /nfs/dbraw/zinc/58/94/16/865589416.db2.gz XXCZJVQRHXQBLB-ZJOBEGKPSA-N 0 3 424.633 4.048 20 0 HIADHN CCNC(=O)c1ccc(NC(=O)N2CCN(C3CCC(C(C)C)CC3)CC2)c(C)c1 ZINC000440378747 865669236 /nfs/dbraw/zinc/66/92/36/865669236.db2.gz XBGVVFLWMWXFIH-UHFFFAOYSA-N 0 3 414.594 4.109 20 0 HIADHN COCc1nc(C(=O)NC[C@H](C)N(C)Cc2ccccc2)c(-c2ccccc2)s1 ZINC000440485375 865789376 /nfs/dbraw/zinc/78/93/76/865789376.db2.gz JLRUPGZHXBXLJD-KRWDZBQOSA-N 0 3 409.555 4.207 20 0 HIADHN Cc1cc(C(=O)NC[C@]2(O)CCN(Cc3ccccc3)C2)sc1-c1ccc(F)cc1 ZINC000440514592 865801630 /nfs/dbraw/zinc/80/16/30/865801630.db2.gz QGVWSBWXBUUCDD-XMMPIXPASA-N 0 3 424.541 4.229 20 0 HIADHN CCN1CCC[C@@H](CN(C)c2ncnc3sc4ccccc4c32)[C@@H]1c1cnn(C)c1 ZINC000440632704 865849476 /nfs/dbraw/zinc/84/94/76/865849476.db2.gz BZDXQIJHWXJGGC-HRAATJIYSA-N 0 3 420.586 4.487 20 0 HIADHN COc1ccc(CNCCc2nnc(-c3ccccc3)o2)c(OCc2cccnc2)c1 ZINC000440807224 865926939 /nfs/dbraw/zinc/92/69/39/865926939.db2.gz UKIXVCMSECQQFX-UHFFFAOYSA-N 0 3 416.481 4.052 20 0 HIADHN O=C(COc1cccc(NC(=O)[C@H]2CCCN2C2CCCC2)c1)Nc1ccccc1 ZINC000440919695 866015452 /nfs/dbraw/zinc/01/54/52/866015452.db2.gz FRSATIUCYAVOIP-JOCHJYFZSA-N 0 3 407.514 4.050 20 0 HIADHN Cc1cc(-c2cc(C(=O)N[C@H]3C[C@@H](C)N(C4CC4)C3)c3cnn(C(C)C)c3n2)c(C)o1 ZINC000440924697 866019837 /nfs/dbraw/zinc/01/98/37/866019837.db2.gz JLBWTLMIENYGGM-PBHICJAKSA-N 0 3 421.545 4.244 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)c2cc(-c3ccc(F)cc3)nc3onc(C4CC4)c32)CN1C1CC1 ZINC000440927524 866023823 /nfs/dbraw/zinc/02/38/23/866023823.db2.gz KUNNQGSDCGJQIH-CXAGYDPISA-N 0 3 420.488 4.261 20 0 HIADHN CC(C)n1ncc2c1nc(-c1cccs1)cc2C(=O)N[C@H]1C[C@H](C)N(C2CC2)C1 ZINC000440930721 866026611 /nfs/dbraw/zinc/02/66/11/866026611.db2.gz IDLBJIQVSUONJU-GJZGRUSLSA-N 0 3 409.559 4.096 20 0 HIADHN O=C(CCN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1)Nc1ccccc1 ZINC000440940157 866038490 /nfs/dbraw/zinc/03/84/90/866038490.db2.gz XHUIFSHJAQMFRH-QHCPKHFHSA-N 0 3 401.510 4.063 20 0 HIADHN O=C(Nc1ccc(C(=O)N2CCCCC2)c(Cl)c1)[C@@H]1CCCN1C1CCCC1 ZINC000440967361 866052506 /nfs/dbraw/zinc/05/25/06/866052506.db2.gz WIJQKWBLVLTJMW-FQEVSTJZSA-N 0 3 403.954 4.312 20 0 HIADHN CN(C)Cc1cccc(NC(=O)C(=O)N2Cc3ccccc3C[C@@H]2c2ccccc2)c1 ZINC000441042469 866107752 /nfs/dbraw/zinc/10/77/52/866107752.db2.gz QNAXMKLTZJFXPC-XMMPIXPASA-N 0 3 413.521 4.013 20 0 HIADHN CN(C)Cc1cccc(NC(=O)C(=O)N2Cc3ccccc3C[C@H]2c2ccccc2)c1 ZINC000441042468 866108373 /nfs/dbraw/zinc/10/83/73/866108373.db2.gz QNAXMKLTZJFXPC-DEOSSOPVSA-N 0 3 413.521 4.013 20 0 HIADHN C[C@H](NC(=O)CCN1CCN(c2ccccc2)CC1)c1ccccc1C(F)(F)F ZINC000468116299 881941623 /nfs/dbraw/zinc/94/16/23/881941623.db2.gz DSAPEUIRRUDDCP-KRWDZBQOSA-N 0 3 405.464 4.095 20 0 HIADHN Cc1nn(C)c(C)c1NC(=O)CN1CCc2ccccc2[C@@H](c2ccccc2)[C@H]1C ZINC000441055057 866131670 /nfs/dbraw/zinc/13/16/70/866131670.db2.gz AKKCOKYEDWKXKN-HOYKHHGWSA-N 0 3 402.542 4.054 20 0 HIADHN CCOc1cc(CN2C[C@@H](c3ccccc3)C(C)(C)C2)nc2nc(C(F)(F)F)nn21 ZINC000441080542 866173495 /nfs/dbraw/zinc/17/34/95/866173495.db2.gz QYKKPOKVBMJFGZ-INIZCTEOSA-N 0 3 419.451 4.167 20 0 HIADHN C[C@@H](NC(=O)N1CCC(C)(c2ccc(Br)cc2)CC1)C1=CCN(C)CC1 ZINC000441087702 866182338 /nfs/dbraw/zinc/18/23/38/866182338.db2.gz BUTDNAKALPKAMZ-MRXNPFEDSA-N 0 3 420.395 4.163 20 0 HIADHN Cc1ccnc(Oc2ccc(NC(=O)N(CCN(C)C)Cc3cccs3)cc2)n1 ZINC000441138231 866230950 /nfs/dbraw/zinc/23/09/50/866230950.db2.gz VBIGIGAQQQWGHO-UHFFFAOYSA-N 0 3 411.531 4.235 20 0 HIADHN Cc1ccc([C@@H]2CCC[C@H]2N(C)C(=O)C(=O)Nc2cc(CN(C)C)ccc2C)cc1 ZINC000441255968 866329550 /nfs/dbraw/zinc/32/95/50/866329550.db2.gz HZUSVRUPXOYNLJ-JTHBVZDNSA-N 0 3 407.558 4.098 20 0 HIADHN O=C(CN1CCC[C@H]([C@@H]2CCOC2)C1)N[C@@H](c1ccccc1)c1cccc(Cl)c1 ZINC000441286013 866360836 /nfs/dbraw/zinc/36/08/36/866360836.db2.gz YZAJEORIZPFGJO-IMSXRSKXSA-N 0 3 412.961 4.294 20 0 HIADHN Cc1ccc([C@H]2CCC[C@@H]2N(C)CC(=O)Nc2cccc(N3CCCC3=O)c2)cc1 ZINC000441338361 866409285 /nfs/dbraw/zinc/40/92/85/866409285.db2.gz CYIZNQATANWZGW-PKTZIBPZSA-N 0 3 405.542 4.328 20 0 HIADHN CC[C@H](Cc1ccc(C)cc1)N(CC)CC(=O)Nc1ccc(CN2CCOCC2)cc1 ZINC000441348319 866417729 /nfs/dbraw/zinc/41/77/29/866417729.db2.gz BYKNOEQFLAWNPS-RUZDIDTESA-N 0 3 423.601 4.109 20 0 HIADHN C[C@@H](c1cccc(NC(=O)c2ccccc2)c1)N(C)C(=O)CN1CCC2(CCC2)C1 ZINC000468131391 881975157 /nfs/dbraw/zinc/97/51/57/881975157.db2.gz JRRQZPHVVTXCKQ-IBGZPJMESA-N 0 3 405.542 4.334 20 0 HIADHN CCN(CC(F)(F)F)C(=O)[C@H]1CCCN(Cc2ccccc2OCC(C)C)C1 ZINC000441364493 866434584 /nfs/dbraw/zinc/43/45/84/866434584.db2.gz HQAFEJYLCFYDOM-SFHVURJKSA-N 0 3 400.485 4.344 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@@H](C)N2CCC[C@H]2c2cccc(N(C)C)c2)cc1F ZINC000441386841 866459232 /nfs/dbraw/zinc/45/92/32/866459232.db2.gz XDAOUAASUTZTCH-VGSWGCGISA-N 0 3 413.537 4.084 20 0 HIADHN C[C@H]1CCCN1C(=O)CCN1CCc2c(cccc2NC(=O)Nc2ccccc2)C1 ZINC000441390236 866460743 /nfs/dbraw/zinc/46/07/43/866460743.db2.gz XEJJPEXHDZOCIN-SFHVURJKSA-N 0 3 406.530 4.090 20 0 HIADHN O=c1nc(CN2CC[C@@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)[n-]c2scc(-c3ccco3)c21 ZINC000441421789 866497612 /nfs/dbraw/zinc/49/76/12/866497612.db2.gz OQLJQTCRKCEPKN-WMLDXEAASA-N 0 3 410.543 4.106 20 0 HIADHN O=c1nc(CN2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)[n-]c2scc(-c3ccco3)c21 ZINC000441421789 866497615 /nfs/dbraw/zinc/49/76/15/866497615.db2.gz OQLJQTCRKCEPKN-WMLDXEAASA-N 0 3 410.543 4.106 20 0 HIADHN C[C@@H](c1nc2ccccc2s1)N(C)C(=O)CCN1CCN(c2ccccc2)CC1 ZINC000468140487 881993069 /nfs/dbraw/zinc/99/30/69/881993069.db2.gz PYRWOEZWHULKHW-SFHVURJKSA-N 0 3 408.571 4.028 20 0 HIADHN CC(C)(CC(=O)NC1CCN(CCc2ccccc2)CC1)CC(=O)c1ccccc1 ZINC000441558514 866633907 /nfs/dbraw/zinc/63/39/07/866633907.db2.gz NPZFQAZNCUVDPA-UHFFFAOYSA-N 0 3 406.570 4.499 20 0 HIADHN CC(C)c1ccc([C@H](NC(=O)CN(C)C2CCN(c3cccnn3)CC2)C(C)C)cc1 ZINC000468147376 882005954 /nfs/dbraw/zinc/00/59/54/882005954.db2.gz XYALHCUGADKVOH-RUZDIDTESA-N 0 3 423.605 4.014 20 0 HIADHN COCc1nc(C(=O)NC[C@H](c2ccc(C)cc2)N(C)C)c(-c2ccccc2)s1 ZINC000441818604 866878816 /nfs/dbraw/zinc/87/88/16/866878816.db2.gz UXWUVUYZVVOAER-LJQANCHMSA-N 0 3 409.555 4.298 20 0 HIADHN COc1cccc(C(C)(C)CNC(=O)N(Cc2ccccc2)C2CCN(C)CC2)c1 ZINC000441841426 866899208 /nfs/dbraw/zinc/89/92/08/866899208.db2.gz XMUCICNQZBIKKS-UHFFFAOYSA-N 0 3 409.574 4.279 20 0 HIADHN CC(C)C[C@H](NC(=O)C(=O)Nc1cccc(CN(C)C)c1)c1ccc(Cl)cc1 ZINC000442086277 867114779 /nfs/dbraw/zinc/11/47/79/867114779.db2.gz XWBSIMXEOKEIMB-FQEVSTJZSA-N 0 3 401.938 4.244 20 0 HIADHN CC[C@H](C)[C@@H](NC(=O)C(=O)Nc1cccc(CN(C)C)c1)c1ccc(Cl)cc1 ZINC000442144316 867166354 /nfs/dbraw/zinc/16/63/54/867166354.db2.gz HWJOKBREBHZPTB-MGPUTAFESA-N 0 3 401.938 4.244 20 0 HIADHN Cc1c(NC(=O)Nc2ccc(CCN3CCSCC3)cc2)cnn1CCC(C)C ZINC000442206133 867227196 /nfs/dbraw/zinc/22/71/96/867227196.db2.gz FVVCPMVROUUBQG-UHFFFAOYSA-N 0 3 415.607 4.473 20 0 HIADHN CCc1c(NC(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)cnn1-c1ccccc1 ZINC000468184990 882060484 /nfs/dbraw/zinc/06/04/84/882060484.db2.gz YZDKFMCUDDVJBU-UHFFFAOYSA-N 0 3 417.557 4.217 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N1CC=C(c2cccc3ccccc32)C1 ZINC000442383345 867368592 /nfs/dbraw/zinc/36/85/92/867368592.db2.gz XBAZBHZLXHRKIT-UHFFFAOYSA-N 0 3 413.521 4.074 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)c1ncccc1Oc1ccccc1 ZINC000442692099 867627342 /nfs/dbraw/zinc/62/73/42/867627342.db2.gz ZHQCBJPULVMZBW-UHFFFAOYSA-N 0 3 403.482 4.083 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)c3ccncc3Oc3ccccc3)CC2)C[C@H](C)O1 ZINC000442693567 867628866 /nfs/dbraw/zinc/62/88/66/867628866.db2.gz PPFVDEUAGQKAOQ-PMACEKPBSA-N 0 3 423.557 4.225 20 0 HIADHN COCc1nc(C(=O)N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)c(-c2ccccc2)s1 ZINC000442694451 867628945 /nfs/dbraw/zinc/62/89/45/867628945.db2.gz SDIJGGGBMJCANA-XLIONFOSSA-N 0 3 421.566 4.349 20 0 HIADHN Cc1nc(-c2ccc(C(=O)N(C)C[C@@H]3CCN(C)[C@H]3c3cccnc3)cc2)cs1 ZINC000442748458 867662009 /nfs/dbraw/zinc/66/20/09/867662009.db2.gz MRKUCMYHGHSTNR-UNMCSNQZSA-N 0 3 406.555 4.279 20 0 HIADHN COCCC[C@@H](NCc1ccc(S(=O)(=O)N(C)C(C)C)cc1)c1ccc(F)cc1 ZINC000442792516 867677865 /nfs/dbraw/zinc/67/78/65/867677865.db2.gz MNJRXZUTEVBZPL-JOCHJYFZSA-N 0 3 422.566 4.112 20 0 HIADHN Cc1cc(NC(=O)C2(Oc3ccccc3F)CC2)cc(N2CCN(C(C)C)CC2)c1 ZINC000442806250 867681364 /nfs/dbraw/zinc/68/13/64/867681364.db2.gz AWVBDYGARWZZGF-UHFFFAOYSA-N 0 3 411.521 4.215 20 0 HIADHN CC(C)(O)CN1CCc2c(cccc2NC(=O)c2ncccc2Oc2ccccc2)C1 ZINC000442885912 867717721 /nfs/dbraw/zinc/71/77/21/867717721.db2.gz MQXCIFVSSHBUTG-UHFFFAOYSA-N 0 3 417.509 4.255 20 0 HIADHN CN(CC[C@H]1CCCCO1)Cc1cccc(Br)c1OC[C@H]1CCCO1 ZINC000442890726 867723352 /nfs/dbraw/zinc/72/33/52/867723352.db2.gz KXMVOJCZLZDPAU-QZTJIDSGSA-N 0 3 412.368 4.398 20 0 HIADHN Cc1cc(C(F)(F)F)ccc1CNCc1ccc(S(=O)(=O)N2CCCC2)cc1 ZINC000443004188 867789708 /nfs/dbraw/zinc/78/97/08/867789708.db2.gz WHHXLOGPVZSXKD-UHFFFAOYSA-N 0 3 412.477 4.088 20 0 HIADHN CCOc1cc(CN2CC[C@@H](OC)C[C@H]2C)ccc1OCC(=O)N(C(C)C)C(C)C ZINC000443077132 867813547 /nfs/dbraw/zinc/81/35/47/867813547.db2.gz ZIEDAKVYPMIJBT-TZIWHRDSSA-N 0 3 420.594 4.109 20 0 HIADHN C[C@H](CCc1ccccc1F)C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000443334865 867910966 /nfs/dbraw/zinc/91/09/66/867910966.db2.gz NNWIXDPPLMHDBU-GOSISDBHSA-N 0 3 416.512 4.193 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N[C@H](C)c3ccc(Br)s3)cc2)CC1 ZINC000443401233 867963807 /nfs/dbraw/zinc/96/38/07/867963807.db2.gz TUUDADRMGPUMJA-CQSZACIVSA-N 0 3 422.392 4.144 20 0 HIADHN COc1cccc(OCCN2CCC[C@H](c3nnc4ccc(C(F)(F)F)cn43)C2)c1 ZINC000443614085 868182288 /nfs/dbraw/zinc/18/22/88/868182288.db2.gz KUNGUHUBKRCDIA-HNNXBMFYSA-N 0 3 420.435 4.015 20 0 HIADHN O[C@@H](COc1ccc(Cl)cc1)CN1CCC[C@@H](c2nc3ccc(F)cc3o2)C1 ZINC000443636665 868217076 /nfs/dbraw/zinc/21/70/76/868217076.db2.gz FWORKTWVQJQAQZ-RHSMWYFYSA-N 0 3 404.869 4.240 20 0 HIADHN CC(=O)c1ccc(NC(=O)CCN2CCC[C@H](c3nc4ccc(F)cc4o3)C2)cc1 ZINC000443645583 868236588 /nfs/dbraw/zinc/23/65/88/868236588.db2.gz BHDYNIWUOIONTP-KRWDZBQOSA-N 0 3 409.461 4.378 20 0 HIADHN C[C@@H](CC(=O)NCCCCN1C[C@@H](C)O[C@@H](C)C1)c1ccccc1C(F)(F)F ZINC000443677756 868284500 /nfs/dbraw/zinc/28/45/00/868284500.db2.gz UGWCISGTUQBXFJ-YESZJQIVSA-N 0 3 400.485 4.205 20 0 HIADHN CCOC(=O)c1c(NC(=O)[C@H](C)C(F)(F)F)sc2c1CC(C)(C)NC2(C)C ZINC000443819354 868351648 /nfs/dbraw/zinc/35/16/48/868351648.db2.gz YIFPDBYYPIWFCA-VIFPVBQESA-N 0 3 406.470 4.221 20 0 HIADHN CSc1ccc(Cl)cc1NC(=O)C(=O)N[C@H](C)[C@@H](c1ccccc1C)N(C)C ZINC000443840920 868370465 /nfs/dbraw/zinc/37/04/65/868370465.db2.gz YTRRGJRZKAZZRO-KUHUBIRLSA-N 0 3 419.978 4.116 20 0 HIADHN Cc1ccccc1[C@@H]([C@@H](C)NC(=O)C(=O)Nc1cccc(OC2CCCC2)c1)N(C)C ZINC000443841232 868372120 /nfs/dbraw/zinc/37/21/20/868372120.db2.gz ZIAGSRGKYUFJQR-WZONZLPQSA-N 0 3 423.557 4.063 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)Nc1cc(-c2ccccc2)ns1 ZINC000443875997 868407778 /nfs/dbraw/zinc/40/77/78/868407778.db2.gz KLUOQXWQJAGEFD-UHFFFAOYSA-N 0 3 406.555 4.351 20 0 HIADHN FC(F)(F)c1ncc(CNCCCN2CCN(c3cccc(Cl)c3)CC2)s1 ZINC000443970814 868500297 /nfs/dbraw/zinc/50/02/97/868500297.db2.gz UTIRNAPRCNUIGN-UHFFFAOYSA-N 0 3 418.916 4.117 20 0 HIADHN CSc1ccccc1S(=O)(=O)N(C)[C@@H]1CCN(Cc2ccccc2)[C@H](C)C1 ZINC000444082663 868606693 /nfs/dbraw/zinc/60/66/93/868606693.db2.gz IIEAJWDGEHKYJE-IEBWSBKVSA-N 0 3 404.601 4.082 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)C1(c2ccc(C(F)(F)F)cc2)CC1 ZINC000444178942 868652387 /nfs/dbraw/zinc/65/23/87/868652387.db2.gz DFELLMSSYLQCKQ-UHFFFAOYSA-N 0 3 418.459 4.332 20 0 HIADHN CCc1nc(-c2ccc(Cl)cc2)[nH]c1C(=O)N(CCN(C)C)Cc1ccco1 ZINC000444299743 868730072 /nfs/dbraw/zinc/73/00/72/868730072.db2.gz CVPVAFZSMGBGIR-UHFFFAOYSA-N 0 3 400.910 4.090 20 0 HIADHN Cc1cc(NC(=O)N2CCN(Cc3ccccc3)C3(CCCCC3)C2)ccc1C(N)=O ZINC000444379643 868800744 /nfs/dbraw/zinc/80/07/44/868800744.db2.gz AOCHKBMRISRYNT-UHFFFAOYSA-N 0 3 420.557 4.147 20 0 HIADHN C[C@H](Oc1cccc2ccccc21)C(=O)N(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1 ZINC000444377076 868800805 /nfs/dbraw/zinc/80/08/05/868800805.db2.gz RPOLHYJXDHMWMR-XZOYJPPVSA-N 0 3 403.526 4.154 20 0 HIADHN C[C@H](C(=O)Nc1cccc(CN2CCC(O)CC2)c1)c1ccc(Br)s1 ZINC000444449172 868832971 /nfs/dbraw/zinc/83/29/71/868832971.db2.gz FFJUTAXXVSNCED-ZDUSSCGKSA-N 0 3 423.376 4.210 20 0 HIADHN C[C@H](Oc1ccc(Cl)c(Cl)c1)C(=O)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000444453527 868834102 /nfs/dbraw/zinc/83/41/02/868834102.db2.gz IXYXHFJMZLIRTQ-AWEZNQCLSA-N 0 3 423.340 4.356 20 0 HIADHN Cc1ccc(C)n1-c1sccc1C(=O)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000444460311 868836717 /nfs/dbraw/zinc/83/67/17/868836717.db2.gz JDUBXTOUDQQTCZ-UHFFFAOYSA-N 0 3 409.555 4.365 20 0 HIADHN Cc1cc(Cl)ccc1O[C@H](C)C(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000444538207 868873992 /nfs/dbraw/zinc/87/39/92/868873992.db2.gz BDZYOMGMXYGYDC-QGZVFWFLSA-N 0 3 416.949 4.259 20 0 HIADHN O=C(NCc1ccc2c(n1)CCCC2)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000444540902 868874706 /nfs/dbraw/zinc/87/47/06/868874706.db2.gz GWNBNYVUCIRIOE-JOCHJYFZSA-N 0 3 417.475 4.031 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)C1(c2ccc(F)cc2)CCCC1 ZINC000444549972 868878559 /nfs/dbraw/zinc/87/85/59/868878559.db2.gz QMBZNWJEUZJLIQ-UHFFFAOYSA-N 0 3 410.533 4.481 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)NC(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)cc1 ZINC000444577041 868888410 /nfs/dbraw/zinc/88/84/10/868888410.db2.gz WRHBGYOEJUVSES-SFYKDHMMSA-N 0 3 417.557 4.376 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)NC(=O)NC[C@H](c2ccc(C)cc2)N(C)C)cc1 ZINC000444581695 868889466 /nfs/dbraw/zinc/88/94/66/868889466.db2.gz HFJZDJQPCHSRAZ-WZONZLPQSA-N 0 3 405.546 4.152 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)NC(=O)N(Cc2ccco2)C2CCN(C)CC2)cc1 ZINC000444598563 868896642 /nfs/dbraw/zinc/89/66/42/868896642.db2.gz RPAWHACTXTUQBA-SFHVURJKSA-N 0 3 421.545 4.141 20 0 HIADHN Cc1cc(N2CCCC[C@@H]2C)ccc1NC(=O)NC1CCN(CCOC(C)C)CC1 ZINC000468314827 882241027 /nfs/dbraw/zinc/24/10/27/882241027.db2.gz DTFOEYHMFNBYTO-FQEVSTJZSA-N 0 3 416.610 4.385 20 0 HIADHN CCOC(=O)c1c(C)oc2nc(CN[C@@H]3CCCC[C@H]3c3ccccc3)nc(N)c21 ZINC000444648206 868928465 /nfs/dbraw/zinc/92/84/65/868928465.db2.gz XQEPPSUZVHLJJT-DLBZAZTESA-N 0 3 408.502 4.106 20 0 HIADHN Cc1cccc2nc(C3CCN(C[C@@H](O)COc4ccc(Cl)cc4)CC3)oc21 ZINC000444768165 868993760 /nfs/dbraw/zinc/99/37/60/868993760.db2.gz VTPUDMZDRDNGKA-GOSISDBHSA-N 0 3 400.906 4.409 20 0 HIADHN Cc1ccccc1[C@H](CC(F)(F)F)NCCOc1ccc(S(C)(=O)=O)cc1 ZINC000444788347 869006881 /nfs/dbraw/zinc/00/68/81/869006881.db2.gz UOENQJUVLDVBDQ-SFHVURJKSA-N 0 3 401.450 4.061 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)NCc1cccc(-c2cccnc2)c1 ZINC000468323839 882253844 /nfs/dbraw/zinc/25/38/44/882253844.db2.gz OLZYTDJQGYIMFC-UHFFFAOYSA-N 0 3 424.495 4.300 20 0 HIADHN CCOC(=O)c1n[nH]c(C2CCN([C@@H]3CCc4c3cc(Cl)cc4Cl)CC2)n1 ZINC000444818720 869029050 /nfs/dbraw/zinc/02/90/50/869029050.db2.gz XDEPMJWQTDOITB-MRXNPFEDSA-N 0 3 409.317 4.155 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)C(=O)Nc1cccc(C(C)(F)F)c1 ZINC000445111299 869222184 /nfs/dbraw/zinc/22/21/84/869222184.db2.gz BCVVHBVSSPTNBP-FQEVSTJZSA-N 0 3 417.500 4.010 20 0 HIADHN C[C@@H]1c2cc(F)cc(F)c2CCN1C(=O)CCCN1CCN(c2ccccc2)CC1 ZINC000468352837 882289720 /nfs/dbraw/zinc/28/97/20/882289720.db2.gz YSQOGCUXSDJUOM-GOSISDBHSA-N 0 3 413.512 4.013 20 0 HIADHN CC(C)(C)n1cc(-c2noc([C@@]3(C(F)(F)F)CCN(Cc4ccccc4)C3)n2)cn1 ZINC000445647142 869716864 /nfs/dbraw/zinc/71/68/64/869716864.db2.gz KVKWVTNXHDOBOC-HXUWFJFHSA-N 0 3 419.451 4.394 20 0 HIADHN COc1ccc2c(c1)C=C(C(=O)N(c1cccc(SC)c1)C1CCN(C)CC1)CO2 ZINC000445801235 869829985 /nfs/dbraw/zinc/82/99/85/869829985.db2.gz FMUDRQFMTQMLJU-UHFFFAOYSA-N 0 3 424.566 4.320 20 0 HIADHN CCCN(CCC)C(=O)CCC(=O)N(c1cccc(SC)c1)C1CCN(C)CC1 ZINC000445801959 869830904 /nfs/dbraw/zinc/83/09/04/869830904.db2.gz JRNDQDKOCMLUDF-UHFFFAOYSA-N 0 3 419.635 4.265 20 0 HIADHN CN(CCc1nc(-c2ccccc2)no1)[C@H]1CCOc2ccc(Br)cc21 ZINC000445878139 869868799 /nfs/dbraw/zinc/86/87/99/869868799.db2.gz FEQCBKYXIGGXJO-KRWDZBQOSA-N 0 3 414.303 4.497 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)CN[C@@H](CC(F)(F)F)C(C)C)c(C(F)(F)F)c1 ZINC000445887090 869873506 /nfs/dbraw/zinc/87/35/06/869873506.db2.gz RUSVUBVROYEXKT-AWEZNQCLSA-N 0 3 413.362 4.169 20 0 HIADHN CC(C)[C@H](CC(F)(F)F)NCC(=O)N[C@@H](C)c1ccc(OC(F)(F)F)cc1 ZINC000445898406 869877049 /nfs/dbraw/zinc/87/70/49/869877049.db2.gz RBLJDMIZYOGOCH-FZMZJTMJSA-N 0 3 400.363 4.329 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)CCC(=O)c2ccc(F)c(F)c2)CCN1Cc1ccccc1 ZINC000445945502 869905778 /nfs/dbraw/zinc/90/57/78/869905778.db2.gz ZDSKXAGVNJFIRT-VQIMIIECSA-N 0 3 400.469 4.097 20 0 HIADHN C[C@@H](c1ccccc1)N1CCC(NC(=O)CCC(=O)c2ccc(F)c(F)c2)CC1 ZINC000445962729 869930292 /nfs/dbraw/zinc/93/02/92/869930292.db2.gz OSYCBQMMMQZKJG-INIZCTEOSA-N 0 3 400.469 4.270 20 0 HIADHN Fc1cccc(CN2CCC[C@H](c3nc(-c4nnc(-c5ccccc5)o4)no3)C2)c1 ZINC000445998982 869961985 /nfs/dbraw/zinc/96/19/85/869961985.db2.gz PZHOULCTPZPZEH-KRWDZBQOSA-N 0 3 405.433 4.305 20 0 HIADHN C[C@H](NC(=O)CN1[C@H](C)CC[C@H]1C)c1cccc(NC(=O)Cc2ccccc2F)c1 ZINC000468414290 882358723 /nfs/dbraw/zinc/35/87/23/882358723.db2.gz HLYRZJKUUMVQKW-KURKYZTESA-N 0 3 411.521 4.057 20 0 HIADHN O=C(CCN1CCN(c2ccccc2)CC1)N[C@@H](c1ccccc1)c1ccc(F)cc1 ZINC000468419893 882363235 /nfs/dbraw/zinc/36/32/35/882363235.db2.gz WAHJDTSMPDCTTG-SANMLTNESA-N 0 3 417.528 4.244 20 0 HIADHN CC(C)Oc1ccc(-c2nc(C(=O)N(CCN(C)C)Cc3ccco3)cs2)cc1 ZINC000446431604 870349900 /nfs/dbraw/zinc/34/99/00/870349900.db2.gz BIOMLNKOGSBPAU-UHFFFAOYSA-N 0 3 413.543 4.394 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)N[C@H]3CCCc4sccc43)CC2)C[C@H](C)O1 ZINC000468465746 882411477 /nfs/dbraw/zinc/41/14/77/882411477.db2.gz HVYRXUISVXQEDU-QKLQHJQFSA-N 0 3 405.608 4.046 20 0 HIADHN Cc1ccc(C(=O)NC[C@H]2N(C)CCCC2(C)C)cc1NC(=O)c1ccccc1F ZINC000468472624 882427355 /nfs/dbraw/zinc/42/73/55/882427355.db2.gz LRSOQIFUPFRNCW-OAQYLSRUSA-N 0 3 411.521 4.237 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N[C@@H](c2ccccc2)c2cccc(F)c2)CC1 ZINC000446782668 870699909 /nfs/dbraw/zinc/69/99/09/870699909.db2.gz CIDKLXSCHDANLY-QHCPKHFHSA-N 0 3 413.537 4.104 20 0 HIADHN CCOC(=O)c1nnc(C2CC[NH+](Cc3ccc(-c4cccc(F)c4)s3)CC2)[n-]1 ZINC000446834680 870750930 /nfs/dbraw/zinc/75/09/30/870750930.db2.gz YCNFMJNVXKABDM-UHFFFAOYSA-N 0 3 414.506 4.229 20 0 HIADHN COc1ccc([C@@H](CCn2cncn2)NCc2ccnc(OC3CCCCC3)c2)cc1 ZINC000446838383 870757133 /nfs/dbraw/zinc/75/71/33/870757133.db2.gz HUCIEBIRGIERPR-HSZRJFAPSA-N 0 3 421.545 4.314 20 0 HIADHN Cc1cc(Sc2ncccn2)ccc1NC(=O)N(CCN(C)C)Cc1ccco1 ZINC000446916883 870833113 /nfs/dbraw/zinc/83/31/13/870833113.db2.gz RZJXWJRRGYNCHE-UHFFFAOYSA-N 0 3 411.531 4.125 20 0 HIADHN CC[C@@H](C)C(=O)Nc1cccc(CN[C@@H](CCn2cncn2)c2ccc(C)cc2)c1 ZINC000446922701 870836354 /nfs/dbraw/zinc/83/63/54/870836354.db2.gz NPMJNYIPPHSOCH-XXBNENTESA-N 0 3 405.546 4.492 20 0 HIADHN COC(=O)[C@@](C)(CN[C@@H](C)C(=O)Nc1cccc2ccccc21)c1ccc(F)cc1 ZINC000447019909 870895873 /nfs/dbraw/zinc/89/58/73/870895873.db2.gz ZEEGTZMYXFABPN-FYSMJZIKSA-N 0 3 408.473 4.026 20 0 HIADHN COC(=O)[C@@](C)(CNCc1ccccc1OCc1ccccn1)c1ccc(F)cc1 ZINC000447085236 870976178 /nfs/dbraw/zinc/97/61/78/870976178.db2.gz HQLJHRNXJWSNDE-DEOSSOPVSA-N 0 3 408.473 4.020 20 0 HIADHN Cc1sc([C@@H](C)NC(=O)N2CC[C@@H](N3CC=CC3)C2)nc1-c1ccc(Cl)cc1 ZINC000447118968 871021682 /nfs/dbraw/zinc/02/16/82/871021682.db2.gz HXPYOEXKUIJXMI-RDTXWAMCSA-N 0 3 416.978 4.489 20 0 HIADHN COCCN(CCN(C)C)C(=O)N[C@H](C)c1nc(-c2ccc(Cl)cc2)c(C)s1 ZINC000447121236 871022601 /nfs/dbraw/zinc/02/26/01/871022601.db2.gz KFCPSRSPZGLTCM-CQSZACIVSA-N 0 3 424.998 4.053 20 0 HIADHN COc1ccc(F)c(NC(=O)N(CCN(C)C)Cc2ccc(Br)cc2)c1 ZINC000447124916 871025886 /nfs/dbraw/zinc/02/58/86/871025886.db2.gz GMIOYXDKZHIGKB-UHFFFAOYSA-N 0 3 424.314 4.193 20 0 HIADHN C[C@H](NC(=O)N(CCN(C)C)Cc1ccco1)c1cccc(OCc2ccccn2)c1 ZINC000447320952 871212625 /nfs/dbraw/zinc/21/26/25/871212625.db2.gz ITHKUAKFFCEPEN-IBGZPJMESA-N 0 3 422.529 4.088 20 0 HIADHN C[C@H](c1nc(Cc2ccc(F)cc2)no1)N1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC000447344806 871245673 /nfs/dbraw/zinc/24/56/73/871245673.db2.gz DERZBDMGOZXVSF-RTBURBONSA-N 0 3 408.521 4.457 20 0 HIADHN C[C@@H](c1nc(Cc2ccc(F)cc2)no1)N1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC000447344803 871246620 /nfs/dbraw/zinc/24/66/20/871246620.db2.gz DERZBDMGOZXVSF-MOPGFXCFSA-N 0 3 408.521 4.457 20 0 HIADHN CN(Cc1cc(C(C)(C)C)[nH]n1)C[C@@H](O)COC(c1ccccc1)c1ccccc1 ZINC000447404499 871314353 /nfs/dbraw/zinc/31/43/53/871314353.db2.gz KAUIGVXRJBPPKZ-JOCHJYFZSA-N 0 3 407.558 4.306 20 0 HIADHN O[C@H](CN[C@H](c1ccc(Br)cc1C(F)(F)F)C1CC1)C(F)(F)F ZINC000447528364 871392692 /nfs/dbraw/zinc/39/26/92/871392692.db2.gz IYVITORKUOBNOW-NEPJUHHUSA-N 0 3 406.164 4.432 20 0 HIADHN CC(C)[C@H]1C[C@@H](NCc2cccc(NC(=O)CCN3CCOCC3)c2)c2ccccc21 ZINC000447546637 871415086 /nfs/dbraw/zinc/41/50/86/871415086.db2.gz XNBGZPADEXKCGK-JWQCQUIFSA-N 0 3 421.585 4.322 20 0 HIADHN Cc1ccc(CN[C@@H](c2ccc(Br)cc2)C2CC2)cc1S(C)(=O)=O ZINC000447571405 871471371 /nfs/dbraw/zinc/47/13/71/871471371.db2.gz YAIBKJGBMRWYPK-LJQANCHMSA-N 0 3 408.361 4.402 20 0 HIADHN Cc1ccc([C@@H](NCCN2CCCC(C)(C)C2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000447574708 871475890 /nfs/dbraw/zinc/47/58/90/871475890.db2.gz WHMPQUKNTLICDD-HSZRJFAPSA-N 0 3 414.615 4.200 20 0 HIADHN C[C@H](N[C@@H](C)c1cccc(OCc2ccccc2)c1)c1ccc(S(N)(=O)=O)cc1 ZINC000447593496 871500268 /nfs/dbraw/zinc/50/02/68/871500268.db2.gz SHLWVYMFDIJWGX-ROUUACIJSA-N 0 3 410.539 4.325 20 0 HIADHN COc1ccc(Cn2nc(C)c(CN3CC[C@H](COc4ccccc4)C3)c2C)cc1 ZINC000468519227 882528695 /nfs/dbraw/zinc/52/86/95/882528695.db2.gz ZMUDIHSFGZUTLY-QFIPXVFZSA-N 0 3 405.542 4.458 20 0 HIADHN CC(C)[C@H]1CN(C(=O)NCc2ccccc2CN2CCC(O)CC2)c2ccccc21 ZINC000447767706 871700604 /nfs/dbraw/zinc/70/06/04/871700604.db2.gz JSYBVPLNBNCXNF-HSZRJFAPSA-N 0 3 407.558 4.113 20 0 HIADHN CC[C@@H](C(=O)N1CCC(NCc2nc(-c3ccccc3)c[nH]2)CC1)c1ccccc1 ZINC000447847880 871768787 /nfs/dbraw/zinc/76/87/87/871768787.db2.gz IUPVBVJKSJKQAP-JOCHJYFZSA-N 0 3 402.542 4.351 20 0 HIADHN COc1cccc2sc(NC(=O)CN[C@@H](C[C@H]3CCOC3)c3ccccc3)nc21 ZINC000447889253 871803024 /nfs/dbraw/zinc/80/30/24/871803024.db2.gz GYKDGNBVSGPYFU-WBVHZDCISA-N 0 3 411.527 4.001 20 0 HIADHN Cc1nn(C)c(CNC[C@H]2CCN(c3cc(Cl)ccc3C)C2)c1Br ZINC000447926800 871815613 /nfs/dbraw/zinc/81/56/13/871815613.db2.gz CJOBUORCVAZZHJ-CQSZACIVSA-N 0 3 411.775 4.069 20 0 HIADHN C[C@H]1CCC[C@H](C)N(CC(=O)N(Cc2nnc(-c3ccccc3Cl)o2)C2CC2)C1 ZINC000448023162 871865005 /nfs/dbraw/zinc/86/50/05/871865005.db2.gz RXOMYFOHQIURFB-HOTGVXAUSA-N 0 3 416.953 4.392 20 0 HIADHN CO[C@H]1CCOc2c(NC(=O)NC[C@H](c3ccc(C)cc3)N3CCCC3)cccc21 ZINC000448050741 871881765 /nfs/dbraw/zinc/88/17/65/871881765.db2.gz OUGGSVQYPIMYQH-YADHBBJMSA-N 0 3 409.530 4.424 20 0 HIADHN CO[C@@H]1CCOc2c(NC(=O)NC[C@H](C(C)C)N3CCc4ccccc4C3)cccc21 ZINC000448053519 871883664 /nfs/dbraw/zinc/88/36/64/871883664.db2.gz ZAXYWHZLEMQYSU-DHIUTWEWSA-N 0 3 423.557 4.361 20 0 HIADHN C[C@@H](CSCc1ccccc1)C(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000448240580 872155758 /nfs/dbraw/zinc/15/57/58/872155758.db2.gz OEOYVQWAWJMAJP-IBGZPJMESA-N 0 3 412.599 4.399 20 0 HIADHN COc1ccc(CC[C@@H](C)NCc2csc(CNC(=O)c3ccccc3)n2)cc1 ZINC000468561826 882617012 /nfs/dbraw/zinc/61/70/12/882617012.db2.gz WZZXQEAXYKXBJY-QGZVFWFLSA-N 0 3 409.555 4.193 20 0 HIADHN CCN(C(=O)NC[C@@H](c1ccccc1)N1CCC(C)CC1)[C@H]1CCOC(C)(C)C1 ZINC000460119117 872590306 /nfs/dbraw/zinc/59/03/06/872590306.db2.gz XPFGGMVPDGAAIH-VXKWHMMOSA-N 0 3 401.595 4.449 20 0 HIADHN CC[C@@H](C)[C@@H](C)NC(=O)N(Cc1ccccc1Br)C1CCN(C)CC1 ZINC000460121928 872593176 /nfs/dbraw/zinc/59/31/76/872593176.db2.gz VIAPPSLXDOECTC-HZPDHXFCSA-N 0 3 410.400 4.490 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N2CCCC[C@H]2c2nnc(C3CCC3)o2)N(C)C)cc1 ZINC000460140197 872638509 /nfs/dbraw/zinc/63/85/09/872638509.db2.gz ADUUSYDGXVJJCF-PMACEKPBSA-N 0 3 411.550 4.185 20 0 HIADHN CCn1c(N2CCCN(Cc3ccc(C(F)(F)F)cc3)CC2)nnc1C(C)(C)C ZINC000460185493 872750158 /nfs/dbraw/zinc/75/01/58/872750158.db2.gz UKXKZTXEFVYYIN-UHFFFAOYSA-N 0 3 409.500 4.327 20 0 HIADHN C[C@H](CNC(=O)N1CCCC[C@H]1c1nnc(C2CCC2)o1)N(C)Cc1ccccc1 ZINC000460277884 872865657 /nfs/dbraw/zinc/86/56/57/872865657.db2.gz VOBCJXBAKDYVPD-XLIONFOSSA-N 0 3 411.550 4.094 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3cccc(COCc4ccco4)c3)cc2)CC1 ZINC000468592860 882680059 /nfs/dbraw/zinc/68/00/59/882680059.db2.gz XFRXOWPCRUHCTE-UHFFFAOYSA-N 0 3 419.525 4.391 20 0 HIADHN CC[C@H](C)[C@@H](NC(=O)c1ccc(N2CCN(CC)CC2)cc1)c1nc2ccccc2[nH]1 ZINC000468593842 882682054 /nfs/dbraw/zinc/68/20/54/882682054.db2.gz CBAQZTWOXFVOHF-FDDCHVKYSA-N 0 3 419.573 4.222 20 0 HIADHN CCOC(=O)c1csc(CCNCc2cn(-c3ccccc3)nc2C(C)(C)C)n1 ZINC000468596773 882688086 /nfs/dbraw/zinc/68/80/86/882688086.db2.gz CHJONROARSNWGR-UHFFFAOYSA-N 0 3 412.559 4.135 20 0 HIADHN Cc1ccnc(Oc2cc(NC(=O)CC3(N4CCOCC4)CCCC3)ccc2C)c1 ZINC000460505254 873192145 /nfs/dbraw/zinc/19/21/45/873192145.db2.gz WAAASKTYGXRGEK-UHFFFAOYSA-N 0 3 409.530 4.464 20 0 HIADHN CN1CCC(N(Cc2ccccc2Br)C(=O)N[C@H]2C=CCCC2)CC1 ZINC000460510486 873198495 /nfs/dbraw/zinc/19/84/95/873198495.db2.gz JUNHKRCXJBBDKZ-KRWDZBQOSA-N 0 3 406.368 4.164 20 0 HIADHN CCCN(CCN1CCN(CC)CC1)C(=O)NCC1(c2cccs2)CCCCC1 ZINC000460521460 873210916 /nfs/dbraw/zinc/21/09/16/873210916.db2.gz BUDPRDUOPOFYMG-UHFFFAOYSA-N 0 3 420.667 4.009 20 0 HIADHN COc1ccc(-c2ccc(CNC(=O)CC3(N4CCOCC4)CCCC3)cc2)cc1 ZINC000460595787 873335121 /nfs/dbraw/zinc/33/51/21/873335121.db2.gz GMSQAYIUJUCOBH-UHFFFAOYSA-N 0 3 408.542 4.014 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N[C@H](c1ccc(F)cc1F)C(C)(C)C ZINC000468614315 882726428 /nfs/dbraw/zinc/72/64/28/882726428.db2.gz YINQYCNHEFGJQH-HXUWFJFHSA-N 0 3 417.500 4.177 20 0 HIADHN CC(C)CC(=O)Nc1ccc(C(=O)N(CCN(C)C)CC2CCCCC2)cc1F ZINC000460961011 873857242 /nfs/dbraw/zinc/85/72/42/873857242.db2.gz GQKITWMNXSIYBN-UHFFFAOYSA-N 0 3 405.558 4.394 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)c2c[nH]cc2-c2ccc3c(c2)OCCO3)C1 ZINC000460973799 873868292 /nfs/dbraw/zinc/86/82/92/873868292.db2.gz OSSIVCWIKRKKQN-XLIONFOSSA-N 0 3 417.509 4.018 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N[C@H]1c2ccccc2CC12CCOCC2)c1ccco1 ZINC000461004535 873881000 /nfs/dbraw/zinc/88/10/00/873881000.db2.gz CNEHGFPFCRNPFS-WEYGHZABSA-N 0 3 411.546 4.102 20 0 HIADHN CC(=O)c1cc(F)c(NC(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)c(F)c1F ZINC000461086636 873999654 /nfs/dbraw/zinc/99/96/54/873999654.db2.gz QTWFSMRXJMNJRU-UHFFFAOYSA-N 0 3 419.447 4.089 20 0 HIADHN CCOc1cccc2cc([C@H](C)NCc3ccc(N4CCCS4(=O)=O)cc3)oc21 ZINC000461094573 874010693 /nfs/dbraw/zinc/01/06/93/874010693.db2.gz ZKCVHEGMKTWEFM-INIZCTEOSA-N 0 3 414.527 4.222 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3CCn4c(cc5ccccc54)C3)c(C)c2)CC1 ZINC000461116319 874041929 /nfs/dbraw/zinc/04/19/29/874041929.db2.gz JYOAZFGEHSJYSO-UHFFFAOYSA-N 0 3 417.557 4.139 20 0 HIADHN CCCN(C(=O)c1ccc(N2CCN(CC)CC2)cc1)[C@H](C)c1ccccc1OC ZINC000468677741 882805971 /nfs/dbraw/zinc/80/59/71/882805971.db2.gz QVDHANUQEXCPOD-HXUWFJFHSA-N 0 3 409.574 4.451 20 0 HIADHN Cc1ccc(Br)cc1-c1nnc(N2CC[C@H](N3CCCCC3)C2)s1 ZINC000468704969 882822334 /nfs/dbraw/zinc/82/23/34/882822334.db2.gz FLKKWJVNRIVCNP-HNNXBMFYSA-N 0 3 407.381 4.341 20 0 HIADHN C[C@@H]1CC[C@H](C)N1CC(=O)Nc1ccc(=O)n(Cc2ccc(Cl)c(Cl)c2)c1 ZINC000468716245 882826364 /nfs/dbraw/zinc/82/63/64/882826364.db2.gz ODBTUJKBAYKAQV-OKILXGFUSA-N 0 3 408.329 4.015 20 0 HIADHN CCN(C(=O)NC[C@H](c1ccc(OC(C)C)cc1)N(C)C)[C@H]1CCOC(C)(C)C1 ZINC000461414478 874431146 /nfs/dbraw/zinc/43/11/46/874431146.db2.gz BFHNXPCAXBDFCM-PZJWPPBQSA-N 0 3 405.583 4.066 20 0 HIADHN CCN(C(=O)NC[C@H](c1ccc(OC(C)C)cc1)N(C)C)[C@@H]1CCOC(C)(C)C1 ZINC000461414479 874432020 /nfs/dbraw/zinc/43/20/20/874432020.db2.gz BFHNXPCAXBDFCM-TZIWHRDSSA-N 0 3 405.583 4.066 20 0 HIADHN Cc1cc(C(=O)CCC(=O)N2C[C@H]3CCN(Cc4ccccc4)C[C@H]3C2)c(C)s1 ZINC000461444502 874501083 /nfs/dbraw/zinc/50/10/83/874501083.db2.gz LJLBOHRCHKPMMD-RTWAWAEBSA-N 0 3 410.583 4.308 20 0 HIADHN CCCCOc1ccc(C(=O)NC2CCN(CCOc3ccc(F)cc3)CC2)cc1 ZINC000461448975 874508261 /nfs/dbraw/zinc/50/82/61/874508261.db2.gz QNWQZCLZXZXWOZ-UHFFFAOYSA-N 0 3 414.521 4.278 20 0 HIADHN CN(c1nnc(C(C)(C)c2ccccc2)n1Cc1cccs1)[C@H]1CCN(C2CC2)C1 ZINC000461508940 874585965 /nfs/dbraw/zinc/58/59/65/874585965.db2.gz CCFNZPJSYUAHNK-FQEVSTJZSA-N 0 3 421.614 4.387 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)N2CCCC[C@H]2c2nnc(C3CCC3)o2)CCN1Cc1ccccc1 ZINC000461539401 874626976 /nfs/dbraw/zinc/62/69/76/874626976.db2.gz XJYWPQJCKXSSEQ-QMMLZNLJSA-N 0 3 423.561 4.237 20 0 HIADHN O=C([C@H]1CC(=O)Nc2ccccc21)N1CCN(Cc2ccccc2)C2(CCCCC2)C1 ZINC000461598030 874723322 /nfs/dbraw/zinc/72/33/22/874723322.db2.gz FXZLFZXUFCZWMP-QFIPXVFZSA-N 0 3 417.553 4.160 20 0 HIADHN CC[C@H](NCc1ccc(C)nc1-n1cc(Cl)cn1)c1ccc(OC)c(OC)c1 ZINC000468811358 882871274 /nfs/dbraw/zinc/87/12/74/882871274.db2.gz DFAXRJFNFWOJIX-SFHVURJKSA-N 0 3 400.910 4.487 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)NC[C@H]2CC[C@H](c3ccccc3)O2)CC1 ZINC000461779692 874903745 /nfs/dbraw/zinc/90/37/45/874903745.db2.gz ZQJIUGKMMBTVDF-DNQXCXABSA-N 0 3 407.558 4.213 20 0 HIADHN CCOC(=O)[C@](C)(CN[C@@H](C)C(=O)Nc1c(C)cc(C)cc1Cl)c1ccccc1 ZINC000468824750 882878224 /nfs/dbraw/zinc/87/82/24/882878224.db2.gz CMLYSMGYCSJUHP-GAJHUEQPSA-N 0 3 416.949 4.394 20 0 HIADHN CCOC(=O)[C@@](C)(CN[C@@H](C)C(=O)Nc1c(C)cc(C)cc1Cl)c1ccccc1 ZINC000468827034 882878849 /nfs/dbraw/zinc/87/88/49/882878849.db2.gz CMLYSMGYCSJUHP-SBUREZEXSA-N 0 3 416.949 4.394 20 0 HIADHN CN(C(=O)Cc1cccc(Cl)c1Cl)C1CCN(CCc2ccccn2)CC1 ZINC000468844828 882886876 /nfs/dbraw/zinc/88/68/76/882886876.db2.gz FEHPUWDVLUKPCH-UHFFFAOYSA-N 0 3 406.357 4.096 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)N(C)[C@H](C)c3ccc(F)c(F)c3)CC2)c1 ZINC000462030306 875145514 /nfs/dbraw/zinc/14/55/14/875145514.db2.gz ALXQCDYTOUGSMU-GOSISDBHSA-N 0 3 401.501 4.005 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)[C@@H]3CCCCN3Cc3ccccc3)c(C)c2)CC1 ZINC000462046057 875157885 /nfs/dbraw/zinc/15/78/85/875157885.db2.gz RBMGHQATSHRIET-VWLOTQADSA-N 0 3 420.601 4.130 20 0 HIADHN COc1ccc([C@H]2CCCCCN2C(=O)CCN2CCN(c3ccccc3)CC2)cc1 ZINC000462059376 875172466 /nfs/dbraw/zinc/17/24/66/875172466.db2.gz NVDFDSPJWRLIKA-RUZDIDTESA-N 0 3 421.585 4.351 20 0 HIADHN CN(C)Cc1ccc(S(=O)(=O)N[C@H]2C[C@H](c3ccc(Cl)c(Cl)c3)C2)cc1 ZINC000462073352 875184221 /nfs/dbraw/zinc/18/42/21/875184221.db2.gz HXRCNDWGBBASHO-WKILWMFISA-N 0 3 413.370 4.280 20 0 HIADHN CN(C(=O)NCc1ccc2sccc2c1)C1CCN(CCc2ccccn2)CC1 ZINC000462162764 875258073 /nfs/dbraw/zinc/25/80/73/875258073.db2.gz GFSPLUMFGIOXDG-UHFFFAOYSA-N 0 3 408.571 4.145 20 0 HIADHN CSc1nc(C(C)(C)C)nc(C)c1C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C ZINC000462178551 875277813 /nfs/dbraw/zinc/27/78/13/875277813.db2.gz IMMQKEFFPDPWFO-CRAIPNDOSA-N 0 3 412.603 4.055 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)Cc1coc(-c2ccc(Cl)cc2)n1 ZINC000462183246 875284799 /nfs/dbraw/zinc/28/47/99/875284799.db2.gz BPEZPOUBVQBLTQ-KKSFZXQISA-N 0 3 409.917 4.174 20 0 HIADHN COc1ccc(C(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)cc1-c1ccccn1 ZINC000462190836 875295423 /nfs/dbraw/zinc/29/54/23/875295423.db2.gz OXHOIGRTZRJSOE-JPYJTQIMSA-N 0 3 401.510 4.008 20 0 HIADHN Cc1nc(COc2ccccc2C(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)cs1 ZINC000462195763 875302225 /nfs/dbraw/zinc/30/22/25/875302225.db2.gz MNEZCQBFIDVVOO-JTSKRJEESA-N 0 3 421.566 4.281 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)NC[C@@H](Cc2ccccc2)C(F)(F)F)cc1 ZINC000462240346 875355380 /nfs/dbraw/zinc/35/53/80/875355380.db2.gz VECBIHQFTWBAHQ-UYAOXDASSA-N 0 3 423.479 4.018 20 0 HIADHN COCCOc1ccc(NC(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)cc1Cl ZINC000462248264 875366229 /nfs/dbraw/zinc/36/62/29/875366229.db2.gz SPFACGOWQOYSJP-JXFKEZNVSA-N 0 3 417.937 4.007 20 0 HIADHN Cc1cc(Oc2ncccn2)ccc1NC(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C ZINC000462250435 875369637 /nfs/dbraw/zinc/36/96/37/875369637.db2.gz ZDWVCLSHVLLVRW-PGRDOPGGSA-N 0 3 417.513 4.219 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)Nc1cccc(-c2noc(C3CC3)n2)c1 ZINC000462271392 875400144 /nfs/dbraw/zinc/40/01/44/875400144.db2.gz SZITTYNDIGAJKI-IERDGZPVSA-N 0 3 417.513 4.256 20 0 HIADHN O=C(NC[C@@H]1CCCCN1Cc1ccccc1)N[C@@H]1CCO[C@@H](c2ccccc2)C1 ZINC000462317599 875437880 /nfs/dbraw/zinc/43/78/80/875437880.db2.gz ZDNPZDXPGZDKRF-TZRRMPRUSA-N 0 3 407.558 4.261 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)cc1CNCCNC(=O)c1ccc(Cl)cc1 ZINC000462368041 875480876 /nfs/dbraw/zinc/48/08/76/875480876.db2.gz MXFLDKIRGCEQDH-UHFFFAOYSA-N 0 3 403.313 4.007 20 0 HIADHN CCN(C(=O)c1ccnc(N2CCC[C@@H](C)C2)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000462491419 875602485 /nfs/dbraw/zinc/60/24/85/875602485.db2.gz RALMKBUZAWAZHB-OFNKIYASSA-N 0 3 406.574 4.055 20 0 HIADHN Cc1ccnc(-c2cccc(NC(=O)N[C@H]3CN(Cc4ccccc4)C[C@H]3C)c2)n1 ZINC000462557362 875682647 /nfs/dbraw/zinc/68/26/47/875682647.db2.gz LOQCBLWYOMVRSW-VGSWGCGISA-N 0 3 401.514 4.094 20 0 HIADHN Clc1cc(Br)ccc1CNC[C@@H](c1ccccc1)N1CCOCC1 ZINC000462680659 875775540 /nfs/dbraw/zinc/77/55/40/875775540.db2.gz JEELBJQFBIQVCC-IBGZPJMESA-N 0 3 409.755 4.266 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Nc1ccc(OCC2CCOCC2)cc1 ZINC000462685852 875778036 /nfs/dbraw/zinc/77/80/36/875778036.db2.gz VZHBMAUZGMGOSC-YADARESESA-N 0 3 423.557 4.134 20 0 HIADHN C[C@@H](COCc1ccccc1)NCc1cnn(-c2ccc(Br)cc2)c1 ZINC000462735235 875808906 /nfs/dbraw/zinc/80/89/06/875808906.db2.gz HIRXSURWAOAIMM-INIZCTEOSA-N 0 3 400.320 4.330 20 0 HIADHN O=C1C[C@H](NCc2ccc(OC(F)F)c(Cl)c2)CN1[C@H]1C[C@H]1c1ccccc1 ZINC000462752251 875818313 /nfs/dbraw/zinc/81/83/13/875818313.db2.gz BGVTUWRYJSKJSJ-BQFCYCMXSA-N 0 3 406.860 4.188 20 0 HIADHN CC(C)(C)OC(=O)c1ccc(CN2CCC[C@@H](c3nnc4n3CCCCC4)C2)cc1 ZINC000462791628 875842982 /nfs/dbraw/zinc/84/29/82/875842982.db2.gz YLHMECYFUFNXKJ-HXUWFJFHSA-N 0 3 410.562 4.339 20 0 HIADHN CC(C)(C)OC(=O)c1ccc(CN2CCC(n3cc(Br)cn3)CC2)cc1 ZINC000462804361 875851790 /nfs/dbraw/zinc/85/17/90/875851790.db2.gz RPFNLNPTFVDFME-UHFFFAOYSA-N 0 3 420.351 4.438 20 0 HIADHN C=Cc1ccc(CCN[C@@H]2CCS(=O)(=O)c3ccc(Br)cc32)cc1 ZINC000462818940 875859019 /nfs/dbraw/zinc/85/90/19/875859019.db2.gz LPKHXJLCHIDMKB-GOSISDBHSA-N 0 3 406.345 4.143 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1[nH]c2ccccc2c1Br ZINC000462823021 875862173 /nfs/dbraw/zinc/86/21/73/875862173.db2.gz RJRIIEJHJCJDIX-KSSFIOAISA-N 0 3 412.331 4.181 20 0 HIADHN NC(=O)C1CCN(C[C@H](NCc2ccc(C(F)F)cc2)c2ccc(Cl)cc2)CC1 ZINC000462846900 875881814 /nfs/dbraw/zinc/88/18/14/875881814.db2.gz VLZGQXJXSGMXMI-FQEVSTJZSA-N 0 3 421.919 4.306 20 0 HIADHN CC[C@@H](NCc1cccc(N2CCCS2(=O)=O)c1)c1cccc(Br)c1 ZINC000462858699 875892364 /nfs/dbraw/zinc/89/23/64/875892364.db2.gz ZHLAEIVKVDVCLT-LJQANCHMSA-N 0 3 423.376 4.230 20 0 HIADHN COC(=O)c1cc(CN[C@@H](c2cccc(C(F)(F)F)c2)C2CCOCC2)n(C)c1C ZINC000462910471 875935669 /nfs/dbraw/zinc/93/56/69/875935669.db2.gz RKWHKEVLJUTQBM-HXUWFJFHSA-N 0 3 424.463 4.396 20 0 HIADHN C[C@H](NC(=O)C(=O)Nc1cccc(CN(C)C)c1)c1ccc(Cl)c2ccccc21 ZINC000462961426 875975177 /nfs/dbraw/zinc/97/51/77/875975177.db2.gz FHIWNXVLOYVPOE-HNNXBMFYSA-N 0 3 409.917 4.371 20 0 HIADHN C[C@@H]1CCc2c(sc3nc(CCN4CCC(OC(C)(C)C)CC4)nc(N)c23)C1 ZINC000468923213 882984636 /nfs/dbraw/zinc/98/46/36/882984636.db2.gz JXMYRKDMFOWBLS-CQSZACIVSA-N 0 3 402.608 4.220 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)N[C@@H]1CCO[C@@H](c2ccccc2)C1 ZINC000463006318 876020143 /nfs/dbraw/zinc/02/01/43/876020143.db2.gz BDIKYFFRCDWYRT-AGILITTLSA-N 0 3 407.558 4.213 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N1CCC(C(F)(F)F)(C(F)(F)F)C1 ZINC000463011307 876027661 /nfs/dbraw/zinc/02/76/61/876027661.db2.gz LGIKRFWXHRAVIJ-UKRRQHHQSA-N 0 3 423.401 4.033 20 0 HIADHN COc1cc(CN(C)C(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)ccc1SC ZINC000463023249 876043031 /nfs/dbraw/zinc/04/30/31/876043031.db2.gz UQNPYNRKGMENCL-XLIONFOSSA-N 0 3 413.587 4.079 20 0 HIADHN CC(C)O[C@@H]1C[C@@H](N[C@H](c2ccccc2)c2cccc(S(C)(=O)=O)c2)C1(C)C ZINC000463028284 876046908 /nfs/dbraw/zinc/04/69/08/876046908.db2.gz JRIYQQNRGHYELN-YPAWHYETSA-N 0 3 401.572 4.361 20 0 HIADHN Cc1cccc(NC[C@@H]2CCN(Cc3nc4ccc(Br)cc4o3)C2)n1 ZINC000463090331 876122730 /nfs/dbraw/zinc/12/27/30/876122730.db2.gz GKQXKLQNAHJRJO-AWEZNQCLSA-N 0 3 401.308 4.228 20 0 HIADHN CC[C@@H](NC1CCN(Cc2ccc(Cl)cc2)CC1)c1nnc2n1CCCCC2 ZINC000463115010 876154979 /nfs/dbraw/zinc/15/49/79/876154979.db2.gz VUXGHSCKMRUBEY-HXUWFJFHSA-N 0 3 401.986 4.363 20 0 HIADHN C[C@H](C(=O)N[C@H]1CCO[C@@H](c2ccccc2)C1)N1CCC(Cc2ccccc2)CC1 ZINC000463118617 876160567 /nfs/dbraw/zinc/16/05/67/876160567.db2.gz DHFDIHPXJHBEHC-DCEDVJGZSA-N 0 3 406.570 4.366 20 0 HIADHN CC(C)n1cc(Br)cc1C(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000463152176 876204962 /nfs/dbraw/zinc/20/49/62/876204962.db2.gz REZWLWSVLUEVAV-YJBOKZPZSA-N 0 3 404.352 4.397 20 0 HIADHN C[C@H](Oc1cccc2ccccc21)C(=O)N(C)C1CCN(CCc2ccccn2)CC1 ZINC000468947273 883012907 /nfs/dbraw/zinc/01/29/07/883012907.db2.gz KTSPPAJHQGPCMY-FQEVSTJZSA-N 0 3 417.553 4.168 20 0 HIADHN C[C@H](CN(C)Cc1cc(Br)cc(Br)c1N)c1nccs1 ZINC000463244824 876301817 /nfs/dbraw/zinc/30/18/17/876301817.db2.gz WJQMGFWSSUXJSZ-SECBINFHSA-N 0 3 419.186 4.486 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](NCCCC2CCOCC2)c2ccc(F)c(F)c2)c1 ZINC000463246121 876303229 /nfs/dbraw/zinc/30/32/29/876303229.db2.gz HDCOVWCSORVQHC-JOCHJYFZSA-N 0 3 423.525 4.254 20 0 HIADHN C[C@@H](C(=O)N(Cc1ccco1)C1CCN(C)CC1)c1cccc(Br)c1 ZINC000463259669 876316427 /nfs/dbraw/zinc/31/64/27/876316427.db2.gz QCXGFCYAUWAEAX-OAHLLOKOSA-N 0 3 405.336 4.269 20 0 HIADHN CN(CCN(Cc1ccccc1)C(=O)N[C@@H]1CCO[C@@H](C2CC2)C1)Cc1ccccc1 ZINC000463258649 876316829 /nfs/dbraw/zinc/31/68/29/876316829.db2.gz RCSVNVRBPJVMBA-JWQCQUIFSA-N 0 3 421.585 4.288 20 0 HIADHN Cn1c(CNC2CCN(C(=O)c3ccccc3Cl)CC2)nc2cccc(Cl)c21 ZINC000463288073 876347489 /nfs/dbraw/zinc/34/74/89/876347489.db2.gz OHVMHVIMXWNKKZ-UHFFFAOYSA-N 0 3 417.340 4.275 20 0 HIADHN COC(=O)CCCN1CCC(Nc2cc(C)ccc2SCC(F)(F)F)CC1 ZINC000463292059 876352674 /nfs/dbraw/zinc/35/26/74/876352674.db2.gz ZADMDQPXRSNKKT-UHFFFAOYSA-N 0 3 404.498 4.479 20 0 HIADHN C[C@H]1CCN(C(=O)NCc2ccccc2CN2CCC(O)CC2)CC12CCCCC2 ZINC000463299472 876360281 /nfs/dbraw/zinc/36/02/81/876360281.db2.gz AAPIMMGKFOTZBQ-FQEVSTJZSA-N 0 3 413.606 4.145 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)c1cccc(-c2noc(C3CC3)n2)c1 ZINC000463323495 876380105 /nfs/dbraw/zinc/38/01/05/876380105.db2.gz IGZAOIDUXPQZAT-NRFANRHFSA-N 0 3 402.498 4.181 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NC[C@@H]1CCN(c2ccccc2F)C1)c1ccsc1 ZINC000463344771 876399123 /nfs/dbraw/zinc/39/91/23/876399123.db2.gz MIIMQSPJUPSAFF-LAUBAEHRSA-N 0 3 418.582 4.096 20 0 HIADHN C[C@@H](NCCOc1ccccc1F)c1ccc(Br)cc1OCCCO ZINC000463375860 876431355 /nfs/dbraw/zinc/43/13/55/876431355.db2.gz NLTMRIGTLQNQER-CQSZACIVSA-N 0 3 412.299 4.079 20 0 HIADHN CC(C)(C)C(=O)Nc1ccc(F)c(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)c1 ZINC000463430490 876485532 /nfs/dbraw/zinc/48/55/32/876485532.db2.gz NPRYEHPTTWNQPB-NRFANRHFSA-N 0 3 411.521 4.377 20 0 HIADHN OC[C@@]1(Cc2ccccc2)CCCN(C[C@H](O)COc2ccc(Cl)cc2Cl)C1 ZINC000463434071 876490108 /nfs/dbraw/zinc/49/01/08/876490108.db2.gz CJSWSACVRFQFNV-SIKLNZKXSA-N 0 3 424.368 4.050 20 0 HIADHN CC(C)n1cc(Br)cc1C(=O)N(CCN(C)C)Cc1ccc(F)cc1 ZINC000463506123 876567433 /nfs/dbraw/zinc/56/74/33/876567433.db2.gz HSSTZSGERGDCPA-UHFFFAOYSA-N 0 3 410.331 4.175 20 0 HIADHN CN(C)CCn1c2cc(NC(=O)C3CCC(c4ccccc4)CC3)ccc2oc1=O ZINC000463572092 876667414 /nfs/dbraw/zinc/66/74/14/876667414.db2.gz XJTVTAXWGVNOKM-UHFFFAOYSA-N 0 3 407.514 4.069 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)CCc2cccc(C(F)(F)F)c2)CC1 ZINC000463574776 876669771 /nfs/dbraw/zinc/66/97/71/876669771.db2.gz DFWFRBJZSQEPSU-MRXNPFEDSA-N 0 3 405.464 4.375 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)[C@H]3C[C@@H]3c3cc(F)c(F)c(F)c3)c2)CC1 ZINC000463595193 876706904 /nfs/dbraw/zinc/70/69/04/876706904.db2.gz LEVRZQKEILZTKP-MOPGFXCFSA-N 0 3 417.475 4.377 20 0 HIADHN Cn1cc(CNCc2ccc(OCc3ccccc3F)cc2)c(-c2cccnc2)n1 ZINC000463735234 876855544 /nfs/dbraw/zinc/85/55/44/876855544.db2.gz ZENYMPHCBCKDJP-UHFFFAOYSA-N 0 3 402.473 4.490 20 0 HIADHN COC1CCN(C2(CNC(=O)c3sc(C4CCCC4)nc3C)CCCC2)CC1 ZINC000463799012 876916633 /nfs/dbraw/zinc/91/66/33/876916633.db2.gz LVVZGSZSSHZHAH-UHFFFAOYSA-N 0 3 405.608 4.263 20 0 HIADHN Cc1ccc2sc(C(=O)Nc3ccc(C(=O)NCCN4CCCC4)cc3)cc2c1 ZINC000463820214 876934298 /nfs/dbraw/zinc/93/42/98/876934298.db2.gz MUXFHWXIJRIUCF-UHFFFAOYSA-N 0 3 407.539 4.288 20 0 HIADHN COc1cccc([C@H](Cc2cc(C)cc(C)c2)N[C@H](C)C(=O)NCC(F)(F)F)c1 ZINC000463918167 877039194 /nfs/dbraw/zinc/03/91/94/877039194.db2.gz BHVBHBTXRRQSTI-UZLBHIALSA-N 0 3 408.464 4.252 20 0 HIADHN COc1ccc([C@@H](CNC(=O)NC[C@H](C)Sc2ccccc2)N2CCCC2)cc1 ZINC000463951443 877073716 /nfs/dbraw/zinc/07/37/16/877073716.db2.gz ARLPCMAAAFPXAM-PGRDOPGGSA-N 0 3 413.587 4.312 20 0 HIADHN CCc1cc(N2CCC[C@@H](NCc3cc(Cl)ccc3Br)C2)ncn1 ZINC000464052214 877193527 /nfs/dbraw/zinc/19/35/27/877193527.db2.gz JHMQGCZKSLEPKH-MRXNPFEDSA-N 0 3 409.759 4.214 20 0 HIADHN CN(C(=O)C(C)(C)c1csc(-c2c(F)cccc2Cl)n1)[C@H]1CCCN(C)C1 ZINC000464054249 877195944 /nfs/dbraw/zinc/19/59/44/877195944.db2.gz UXQANDDRNNQIML-ZDUSSCGKSA-N 0 3 409.958 4.433 20 0 HIADHN O=C(NCc1cccc(-c2cccnc2)c1)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000464148149 877316293 /nfs/dbraw/zinc/31/62/93/877316293.db2.gz BHAHTOBPJFSQBP-XMMPIXPASA-N 0 3 400.526 4.212 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)Nc3ccc4ncsc4c3)CC2)c1 ZINC000503241959 912221130 /nfs/dbraw/zinc/22/11/30/912221130.db2.gz KMPWIEOEBVXYBI-UHFFFAOYSA-N 0 3 423.586 4.329 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)N(Cc2ccccc2)[C@@H](C)c2ccccc2)CC1 ZINC000464254362 877432375 /nfs/dbraw/zinc/43/23/75/877432375.db2.gz PZWKPKXVZTVLFX-PKTZIBPZSA-N 0 3 422.617 4.233 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)NCc1cccc(-c2cccnc2)c1 ZINC000464292279 877479135 /nfs/dbraw/zinc/47/91/35/877479135.db2.gz DBSUGOYCJLNMKT-YADARESESA-N 0 3 400.526 4.068 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)N[C@@H]2CCCc3sc(-c4ccc(F)cc4)nc32)CCCN1C ZINC000464314352 877506858 /nfs/dbraw/zinc/50/68/58/877506858.db2.gz WPKHIKRRARBKRA-XOKHGSTOSA-N 0 3 402.539 4.109 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)NCc2cccc(-c3cccnc3)c2)C1 ZINC000464351345 877543731 /nfs/dbraw/zinc/54/37/31/877543731.db2.gz GSPMLYLQKNFIGF-NTKDMRAZSA-N 0 3 400.526 4.383 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)NCc2cccc(-c3cccnc3)c2)C1 ZINC000464351344 877544401 /nfs/dbraw/zinc/54/44/01/877544401.db2.gz GSPMLYLQKNFIGF-DVECYGJZSA-N 0 3 400.526 4.383 20 0 HIADHN CC[C@@H]1CCCC[C@@H]1OCC(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000464405695 877608971 /nfs/dbraw/zinc/60/89/71/877608971.db2.gz NGJTUKCEXOOFBD-VSKRKVRLSA-N 0 3 410.562 4.254 20 0 HIADHN Cc1cccc(S(=O)(=O)CCCN[C@H](C)c2cccc(OC(F)(F)F)c2)c1 ZINC000464483696 877702926 /nfs/dbraw/zinc/70/29/26/877702926.db2.gz FBGIRCGJOZAGGH-OAHLLOKOSA-N 0 3 401.450 4.408 20 0 HIADHN CCOc1cccc2cc([C@@H](C)NCCCS(=O)(=O)c3ccccc3OC)oc21 ZINC000464490272 877708773 /nfs/dbraw/zinc/70/87/73/877708773.db2.gz LKVAFSSHPLGWIB-MRXNPFEDSA-N 0 3 417.527 4.355 20 0 HIADHN COc1ccccc1S(=O)(=O)CCCN[C@@H](C)c1ccc(C(F)(F)F)cc1 ZINC000464489254 877709352 /nfs/dbraw/zinc/70/93/52/877709352.db2.gz FLMDPSDSBNTILJ-AWEZNQCLSA-N 0 3 401.450 4.229 20 0 HIADHN COc1ccc2oc([C@H](C)NCCCS(=O)(=O)c3ccccc3OC)c(C)c2c1 ZINC000464497158 877715759 /nfs/dbraw/zinc/71/57/59/877715759.db2.gz FXVLRITVCQULHH-INIZCTEOSA-N 0 3 417.527 4.273 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3cccc4cccnc43)c(OCC)c2)CC1 ZINC000464498252 877718755 /nfs/dbraw/zinc/71/87/55/877718755.db2.gz IRDMGDGTVLXACR-UHFFFAOYSA-N 0 3 418.541 4.418 20 0 HIADHN COc1ccccc1S(=O)(=O)CCCNC1(c2ccc(F)cc2F)CCCC1 ZINC000464500909 877723428 /nfs/dbraw/zinc/72/34/28/877723428.db2.gz SJZVXPKRYBMPMB-UHFFFAOYSA-N 0 3 409.498 4.196 20 0 HIADHN C/C=C\c1ccc(OC[C@H](O)CN[C@H](C)c2cn(C(C)(C)C)nc2C)c(OC)c1 ZINC000464600010 877827692 /nfs/dbraw/zinc/82/76/92/877827692.db2.gz FNHJPIQJPFTCFO-BUFKOALHSA-N 0 3 401.551 4.079 20 0 HIADHN CN(CCN(Cc1ccccc1)C(=O)Cc1c[nH]c2ncccc12)Cc1ccccc1 ZINC000464733327 877969130 /nfs/dbraw/zinc/96/91/30/877969130.db2.gz HHDKGZOPMBWISI-UHFFFAOYSA-N 0 3 412.537 4.266 20 0 HIADHN C[C@H](C(=O)NCCc1c[nH]c2ccccc12)N1CC[C@@H](CSc2ccccc2)C1 ZINC000464754053 877991396 /nfs/dbraw/zinc/99/13/96/877991396.db2.gz CTFVIUXHZVFXIP-RTBURBONSA-N 0 3 407.583 4.329 20 0 HIADHN Cc1nsc(N2CCCN(CC/C=C\c3ccc(Br)cc3)CC2)n1 ZINC000464760898 878004646 /nfs/dbraw/zinc/00/46/46/878004646.db2.gz BOWUKACYSHLTDS-DJWKRKHSSA-N 0 3 407.381 4.225 20 0 HIADHN FC(F)(F)C1CCN(CCCOc2cccc(I)c2)CC1 ZINC000464775924 878019084 /nfs/dbraw/zinc/01/90/84/878019084.db2.gz SMZAJVYZDHDYBP-UHFFFAOYSA-N 0 3 413.221 4.334 20 0 HIADHN COc1cc2nc(CN(C)[C@H](Cc3ccc(F)cc3)C(C)C)[nH]c(=O)c2cc1OC ZINC000464784882 878031965 /nfs/dbraw/zinc/03/19/65/878031965.db2.gz JVRAPMWLSVQROZ-LJQANCHMSA-N 0 3 413.493 4.191 20 0 HIADHN CCN(CC(=O)Nc1ccccc1C(F)(F)F)CC1CCN(c2ccccn2)CC1 ZINC000464801327 878043544 /nfs/dbraw/zinc/04/35/44/878043544.db2.gz DWUVVBYGIFAAKG-UHFFFAOYSA-N 0 3 420.479 4.277 20 0 HIADHN CCc1ccc([C@@H]2C[C@H](C)CCN2C[C@H](O)COc2c(OC)cccc2OC)o1 ZINC000464846643 878120615 /nfs/dbraw/zinc/12/06/15/878120615.db2.gz SENMVCFEIAZPEK-AOIWGVFYSA-N 0 3 403.519 4.072 20 0 HIADHN C[C@@H]1CCN(C(=O)Cc2coc(-c3ccc(F)cc3)n2)CCN1Cc1ccccc1 ZINC000464884526 878180973 /nfs/dbraw/zinc/18/09/73/878180973.db2.gz IGTMLTHUORRDQJ-GOSISDBHSA-N 0 3 407.489 4.146 20 0 HIADHN CC(C)COc1cn(-c2ccccc2)nc1C(=O)N(CCN(C)C)c1ccccc1 ZINC000503340007 912318627 /nfs/dbraw/zinc/31/86/27/912318627.db2.gz GKFDPWMDNHYUFS-UHFFFAOYSA-N 0 3 406.530 4.116 20 0 HIADHN Cc1cc(C)n(Cc2ccc(C(=O)N3CC[C@H](C)N(Cc4ccccc4)CC3)cc2)n1 ZINC000464891128 878191370 /nfs/dbraw/zinc/19/13/70/878191370.db2.gz IVTFRGXJNQEQAD-NRFANRHFSA-N 0 3 416.569 4.285 20 0 HIADHN C[C@@H]1CCN(C(=O)CCCOc2ccc(F)cc2F)CCN1Cc1ccccc1 ZINC000464893892 878195983 /nfs/dbraw/zinc/19/59/83/878195983.db2.gz NUBVDVWNJLAAKG-GOSISDBHSA-N 0 3 402.485 4.247 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(C)c1C(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC000464896758 878201053 /nfs/dbraw/zinc/20/10/53/878201053.db2.gz OJZHTJLJLFBOPB-GOSISDBHSA-N 0 3 420.532 4.365 20 0 HIADHN C[C@@H]1CCN(C(=O)c2cc(F)cc(Br)c2)CCN1Cc1ccccc1 ZINC000464903171 878214996 /nfs/dbraw/zinc/21/49/96/878214996.db2.gz UTEVPBMERUINRY-OAHLLOKOSA-N 0 3 405.311 4.325 20 0 HIADHN CCOc1ccccc1OCCCC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC000464904928 878220007 /nfs/dbraw/zinc/22/00/07/878220007.db2.gz BGFQEVOSMPWCQM-OAQYLSRUSA-N 0 3 410.558 4.367 20 0 HIADHN CCN(C[C@H]1CCN(Cc2ccccc2)C1)C(=O)[C@H](C)CC(=O)c1ccccc1F ZINC000464960539 878301377 /nfs/dbraw/zinc/30/13/77/878301377.db2.gz KRKYECMIKGXXDH-CTNGQTDRSA-N 0 3 410.533 4.405 20 0 HIADHN CCO[C@@H](CC(=O)NC1CCN(CCOc2ccc(Cl)cc2)CC1)C1=CCCC1 ZINC000465134883 878516034 /nfs/dbraw/zinc/51/60/34/878516034.db2.gz YGYPHZWUTBVSME-QFIPXVFZSA-N 0 3 420.981 4.205 20 0 HIADHN CC1CCN([C@@H](CNC(=O)NCc2ccc(-n3cccn3)cc2)c2cccs2)CC1 ZINC000503374053 912355832 /nfs/dbraw/zinc/35/58/32/912355832.db2.gz GPXDNDFIGDITFZ-NRFANRHFSA-N 0 3 423.586 4.206 20 0 HIADHN CC(C)c1nc(C(=O)N2CC[C@H]3CC[C@@H](C2)N3C)nn1-c1c(Cl)cccc1Cl ZINC000465231121 878648873 /nfs/dbraw/zinc/64/88/73/878648873.db2.gz MMRMXLSLDOTZDQ-KGLIPLIRSA-N 0 3 422.360 4.006 20 0 HIADHN C[C@H](NC(=O)NC[C@H](c1cccs1)N1CCCC1)c1ccc(-n2cccn2)cc1 ZINC000465422362 878852688 /nfs/dbraw/zinc/85/26/88/878852688.db2.gz NKZOTZYNPZFEAN-FXAWDEMLSA-N 0 3 409.559 4.131 20 0 HIADHN O=C(N[C@H]1CCN(Cc2ccccc2)C1)N(Cc1ccc2c(c1)CCO2)C1CCCC1 ZINC000465428019 878858416 /nfs/dbraw/zinc/85/84/16/878858416.db2.gz DCPOCEXZCGXKFF-QHCPKHFHSA-N 0 3 419.569 4.350 20 0 HIADHN CC1CCN([C@H](CNC(=O)NCc2cccc(N3CC=CC3)c2)c2cccs2)CC1 ZINC000465433780 878866465 /nfs/dbraw/zinc/86/64/65/878866465.db2.gz OKFFAOIYWZLUHG-JOCHJYFZSA-N 0 3 424.614 4.397 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)N1CC[C@H](COCc2ccccc2)C1 ZINC000465436978 878869282 /nfs/dbraw/zinc/86/92/82/878869282.db2.gz FBOWUBLYGSRHCW-UPVQGACJSA-N 0 3 407.558 4.072 20 0 HIADHN C[C@H](NC(=O)NC[C@H](c1ccccc1)N1CCCC1)c1nc(C2CCCCC2)no1 ZINC000465443413 878874807 /nfs/dbraw/zinc/87/48/07/878874807.db2.gz SXJZYBJEVUQZBZ-FXAWDEMLSA-N 0 3 411.550 4.315 20 0 HIADHN COc1cccc([C@@H](CNC(=O)NC[C@H](C)Cc2cccs2)N2CCCC2)c1 ZINC000465470849 878906624 /nfs/dbraw/zinc/90/66/24/878906624.db2.gz FPAREEKFFCOPSP-DYESRHJHSA-N 0 3 401.576 4.072 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCc1coc(-c2ccccc2)n1)c1cccc(OC)c1 ZINC000465479922 878919268 /nfs/dbraw/zinc/91/92/68/878919268.db2.gz NBNVDNOJBBXQKE-QFIPXVFZSA-N 0 3 422.529 4.233 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@@H](c1ncc(C)s1)C1CC1)c1cccc(OC)c1 ZINC000465504793 878942496 /nfs/dbraw/zinc/94/24/96/878942496.db2.gz SGCRTRBITSMLKX-WOJBJXKFSA-N 0 3 416.591 4.294 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@@H](c1nc(C)cs1)C1CC1)c1cccc(OC)c1 ZINC000465507052 878945364 /nfs/dbraw/zinc/94/53/64/878945364.db2.gz AWDAMNLIDXBYFX-WOJBJXKFSA-N 0 3 416.591 4.294 20 0 HIADHN C[C@H]1CCN(C(=O)NCc2ccnc(OC3CCCC3)c2)CCN1Cc1ccccc1 ZINC000465525919 878977496 /nfs/dbraw/zinc/97/74/96/878977496.db2.gz LGEALVWRDZIUSO-FQEVSTJZSA-N 0 3 422.573 4.209 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@@H]1C[C@]1(C)c1ccccc1OC)c1ccsc1 ZINC000465526568 878979706 /nfs/dbraw/zinc/97/97/06/878979706.db2.gz OVORBMRELNRPAL-SYYKKAFVSA-N 0 3 401.576 4.169 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@H]1C[C@]1(C)c1ccccc1OC)c1ccsc1 ZINC000465526567 878979956 /nfs/dbraw/zinc/97/99/56/878979956.db2.gz OVORBMRELNRPAL-KAGYGMCKSA-N 0 3 401.576 4.169 20 0 HIADHN CC(=O)Nc1cccc([C@@H](C)NC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)c1 ZINC000465563380 879034713 /nfs/dbraw/zinc/03/47/13/879034713.db2.gz GQBGVYPEQVRHJD-RTBURBONSA-N 0 3 408.546 4.012 20 0 HIADHN CC[C@H](Cc1ccccc1)N(C)C(=O)NCCCN1CCN(C)C[C@H]1c1ccccc1 ZINC000465610607 879105780 /nfs/dbraw/zinc/10/57/80/879105780.db2.gz WOEFEYANHSHHTM-RPBOFIJWSA-N 0 3 422.617 4.028 20 0 HIADHN C[C@H]1CCN(C(=O)NCc2cc(Br)cs2)CCN1Cc1ccccc1 ZINC000465649457 879169658 /nfs/dbraw/zinc/16/96/58/879169658.db2.gz BSLXKGLBZKTELQ-HNNXBMFYSA-N 0 3 422.392 4.317 20 0 HIADHN CCc1nc(C)c([C@H](C)N(C)C(=O)NCC2(N3CCSCC3)CCCC2)s1 ZINC000465652039 879173231 /nfs/dbraw/zinc/17/32/31/879173231.db2.gz HQZPASZLWZDTNM-INIZCTEOSA-N 0 3 410.653 4.078 20 0 HIADHN C[C@@H]1CCN(C(=O)NCC2(c3ccccc3)CCOCC2)CCN1Cc1ccccc1 ZINC000465654164 879179894 /nfs/dbraw/zinc/17/98/94/879179894.db2.gz HZKHPIQZQVPFTI-JOCHJYFZSA-N 0 3 421.585 4.041 20 0 HIADHN C[C@@H]1CCN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)[C@@H](c2ccco2)C1 ZINC000465670245 879206920 /nfs/dbraw/zinc/20/69/20/879206920.db2.gz WWTPVOBVURPINW-FYYLOGMGSA-N 0 3 424.589 4.365 20 0 HIADHN C[C@H](NC(=O)NCC(C)(C)N1CCc2ccccc2C1)c1cccc(-n2cccn2)c1 ZINC000465688886 879241262 /nfs/dbraw/zinc/24/12/62/879241262.db2.gz JNXIRNHVKDLWRC-IBGZPJMESA-N 0 3 417.557 4.069 20 0 HIADHN CCc1nc(C)c([C@@H](C)N(C)C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)s1 ZINC000465695922 879253820 /nfs/dbraw/zinc/25/38/20/879253820.db2.gz SKMGGJOGAVSIEC-MJGOQNOKSA-N 0 3 400.592 4.381 20 0 HIADHN CC[C@@H](NC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1)c1ccc2c(c1)OCCO2 ZINC000465708339 879274451 /nfs/dbraw/zinc/27/44/51/879274451.db2.gz MGMGPSZSRJOKDH-SIKLNZKXSA-N 0 3 423.557 4.215 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N2C[C@@H](C)O[C@H](c3ccc(F)cc3)C2)C1 ZINC000465741932 879328350 /nfs/dbraw/zinc/32/83/50/879328350.db2.gz ADCCJUMNJJCFCW-GGILJOMBSA-N 0 3 411.521 4.133 20 0 HIADHN C[C@@H]1CCN(C(=O)N[C@@H]2CCCOc3ccc(F)cc32)CCN1Cc1ccccc1 ZINC000465760023 879355789 /nfs/dbraw/zinc/35/57/89/879355789.db2.gz QLOJRHFFLRMCHD-XMSQKQJNSA-N 0 3 411.521 4.345 20 0 HIADHN C[C@@H]1CCN(C(=O)NCCc2c[nH]c3cc(F)ccc23)CCN1Cc1ccccc1 ZINC000465805020 879419155 /nfs/dbraw/zinc/41/91/55/879419155.db2.gz DZFHOQVHALPTKW-GOSISDBHSA-N 0 3 408.521 4.156 20 0 HIADHN C[C@H](NC(=O)N(CCN(C)C)C[C@H]1CCCO1)c1ccccc1Oc1ccccc1 ZINC000465807150 879422537 /nfs/dbraw/zinc/42/25/37/879422537.db2.gz QXMDPLSCDWSUET-PZJWPPBQSA-N 0 3 411.546 4.292 20 0 HIADHN Cc1ccc([C@H](CNC(=O)NC[C@H]2CCCO[C@H]2c2ccc(C)cc2)N(C)C)cc1 ZINC000465817509 879442823 /nfs/dbraw/zinc/44/28/23/879442823.db2.gz OWMCSELLPPDMPS-SGNDLWITSA-N 0 3 409.574 4.373 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N[C@H](C)c2cccc(-n3cccn3)c2)N2CCCC2)cc1 ZINC000465819847 879446081 /nfs/dbraw/zinc/44/60/81/879446081.db2.gz WNWUDDSYTOMZOS-HYBUGGRVSA-N 0 3 417.557 4.378 20 0 HIADHN Cc1ccc([C@H](CNC(=O)NC[C@@H]2CCO[C@H]2c2ccccc2)N2CCCC2)cc1 ZINC000465820273 879446742 /nfs/dbraw/zinc/44/67/42/879446742.db2.gz RNUIASLNAMAPGC-HJOGWXRNSA-N 0 3 407.558 4.209 20 0 HIADHN C[C@H]1CCN(C(=O)NCc2cc(-c3ccccc3)on2)CCN1Cc1ccccc1 ZINC000465840394 879479278 /nfs/dbraw/zinc/47/92/78/879479278.db2.gz OFGZDARVTSSUSN-IBGZPJMESA-N 0 3 404.514 4.148 20 0 HIADHN Cc1cnc([C@H](NC(=O)NCC2(N3CCOC(C)(C)C3)CCCCC2)C2CC2)s1 ZINC000465865960 879516768 /nfs/dbraw/zinc/51/67/68/879516768.db2.gz DZDKHUFPXHJWTR-GOSISDBHSA-N 0 3 420.623 4.016 20 0 HIADHN CC[C@H](NC(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1)c1ccncc1 ZINC000465959962 879627594 /nfs/dbraw/zinc/62/75/94/879627594.db2.gz WYSQTGCQUJNHHH-IBGZPJMESA-N 0 3 408.468 4.325 20 0 HIADHN C[C@H]1CCN(C(=O)NCc2ccccc2OC2CCC2)CCN1Cc1ccccc1 ZINC000465993949 879670100 /nfs/dbraw/zinc/67/01/00/879670100.db2.gz YHGGQMSAUNGGQW-FQEVSTJZSA-N 0 3 407.558 4.424 20 0 HIADHN Cc1cccc2c(CCNC(=O)N(CCN(C)C)Cc3ccc(F)c(F)c3)c[nH]c21 ZINC000466003255 879680278 /nfs/dbraw/zinc/68/02/78/879680278.db2.gz BEGFUENZTUOXCQ-UHFFFAOYSA-N 0 3 414.500 4.070 20 0 HIADHN Cc1csc([C@@H](NC(=O)N(CCCc2ccccc2)CCN(C)C)C2CC2)n1 ZINC000466095905 879815352 /nfs/dbraw/zinc/81/53/52/879815352.db2.gz UPJOIBXSNZBCMT-FQEVSTJZSA-N 0 3 400.592 4.109 20 0 HIADHN C[C@@H](CNC(=O)N(CCN(C)C)Cc1ccccc1F)Oc1ccccc1Cl ZINC000466157850 879861670 /nfs/dbraw/zinc/86/16/70/879861670.db2.gz BVEPHKBMODEPJJ-INIZCTEOSA-N 0 3 407.917 4.020 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccc(O)cc1)C(=O)c1cnc(-c2ccncc2)s1 ZINC000503472169 912507162 /nfs/dbraw/zinc/50/71/62/912507162.db2.gz JEYFZXUGYWPUQL-LJQANCHMSA-N 0 3 422.554 4.037 20 0 HIADHN Cc1nc(-c2ccc(CNC(=O)N[C@H]3C[C@@H](C)N(Cc4ccccc4)C3)o2)cs1 ZINC000466253330 879975283 /nfs/dbraw/zinc/97/52/83/879975283.db2.gz OPBZWNCGTWZRQS-QAPCUYQASA-N 0 3 410.543 4.174 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)NC[C@@H]2CCCO[C@H]2c2ccccc2)CN1Cc1ccccc1 ZINC000466258238 879984840 /nfs/dbraw/zinc/98/48/40/879984840.db2.gz KMHAOMKSZVZHEM-DLTYFMDKSA-N 0 3 407.558 4.117 20 0 HIADHN Cc1cc(CNCc2cn(C)nc2-c2cccs2)ccc1I ZINC000466365617 880124080 /nfs/dbraw/zinc/12/40/80/880124080.db2.gz WKNDDIQUNZZESO-UHFFFAOYSA-N 0 3 423.323 4.351 20 0 HIADHN Cc1cc(CNCc2cn(C)nc2-c2ccccc2)ccc1I ZINC000466364968 880124264 /nfs/dbraw/zinc/12/42/64/880124264.db2.gz SMMQFOMYRFSZOP-UHFFFAOYSA-N 0 3 417.294 4.290 20 0 HIADHN O=C(N[C@H]1CCSC1)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000466403850 880170254 /nfs/dbraw/zinc/17/02/54/880170254.db2.gz HVLHQBIVZWWQMS-HNNXBMFYSA-N 0 3 402.391 4.106 20 0 HIADHN COc1ccc([C@@H](CNC(=O)Nc2ccc(OC)c(Cl)c2)N2CCCC2)cc1 ZINC000503492786 912540439 /nfs/dbraw/zinc/54/04/39/912540439.db2.gz JFVQKMYOQURXQG-LJQANCHMSA-N 0 3 403.910 4.316 20 0 HIADHN Clc1cc(CN[C@@H]2CCCc3sccc32)ccc1OCCN1CCOCC1 ZINC000466455346 880235629 /nfs/dbraw/zinc/23/56/29/880235629.db2.gz LPFGKKZAIVVXHT-LJQANCHMSA-N 0 3 406.979 4.280 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccc(O)cc1)C(=O)[C@H]1SCCc2sccc21 ZINC000503498699 912545331 /nfs/dbraw/zinc/54/53/31/912545331.db2.gz ZKBNZEVPTWAUOL-UTKZUKDTSA-N 0 3 416.612 4.297 20 0 HIADHN C[C@H](NC(=O)N1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1)c1cc2ccccc2o1 ZINC000466485004 880265095 /nfs/dbraw/zinc/26/50/95/880265095.db2.gz MQGSNZLJQWATGB-FHWLQOOXSA-N 0 3 413.562 4.415 20 0 HIADHN Cc1ccc(-c2nc(CNC(=O)N[C@H]3C[C@@H](C)N(Cc4ccccc4)C3)co2)cc1 ZINC000466516134 880290914 /nfs/dbraw/zinc/29/09/14/880290914.db2.gz QJAYRYATTJKHHO-NQIIRXRSSA-N 0 3 404.514 4.112 20 0 HIADHN COCCCCN(Cc1ccccc1)C(=O)N[C@@H]1C[C@@H](C)N(Cc2ccccc2)C1 ZINC000466529591 880305389 /nfs/dbraw/zinc/30/53/89/880305389.db2.gz OSFFRTHWJMJKKB-ZJSXRUAMSA-N 0 3 409.574 4.288 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)Nc2ccc(NC(=O)c3ccco3)cc2)CN1Cc1ccccc1 ZINC000466538877 880314037 /nfs/dbraw/zinc/31/40/37/880314037.db2.gz JMLFOFQAERAPNK-UTKZUKDTSA-N 0 3 418.497 4.316 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)Nc2ccccc2C(=O)N2CCCCC2)CN1Cc1ccccc1 ZINC000466541930 880315717 /nfs/dbraw/zinc/31/57/17/880315717.db2.gz PNDRFZGEYFYUSD-CTNGQTDRSA-N 0 3 420.557 4.097 20 0 HIADHN CCc1nc(C)c([C@H](C)N(C)C(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)s1 ZINC000466542560 880316730 /nfs/dbraw/zinc/31/67/30/880316730.db2.gz VNZDUWHBPMXFOI-VDZJLULYSA-N 0 3 400.592 4.379 20 0 HIADHN CN(C)[C@H](CNC(=O)Nc1cc(Br)c(F)cc1F)Cc1ccccc1 ZINC000466669660 880454740 /nfs/dbraw/zinc/45/47/40/880454740.db2.gz PYSBOISZKHPHIB-ZDUSSCGKSA-N 0 3 412.278 4.022 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)N[C@H](C)c2cccc(-n3cccn3)c2)c1 ZINC000466697096 880488602 /nfs/dbraw/zinc/48/86/02/880488602.db2.gz PUDLPUSQAFUWDQ-HXUWFJFHSA-N 0 3 405.546 4.015 20 0 HIADHN Cc1cc(C(F)(F)F)ccc1CN[C@H](Cc1ccc(C(F)(F)F)cc1)C(N)=O ZINC000466747898 880529839 /nfs/dbraw/zinc/52/98/39/880529839.db2.gz PRZYWDKTVPFCGW-MRXNPFEDSA-N 0 3 404.354 4.219 20 0 HIADHN C[C@H]1CN(C2CC2)C[C@H]1NC(=O)N1CCC(c2nc3cc(Cl)ccc3s2)CC1 ZINC000466750335 880530846 /nfs/dbraw/zinc/53/08/46/880530846.db2.gz CNPCWGAYNQZFFF-SCLBCKFNSA-N 0 3 418.994 4.321 20 0 HIADHN Cc1ccc(-c2nc(CNC(=O)N3CCCN(Cc4ccccc4)CC3)co2)cc1 ZINC000466775907 880554765 /nfs/dbraw/zinc/55/47/65/880554765.db2.gz JFYAKKQTBWUMNC-UHFFFAOYSA-N 0 3 404.514 4.068 20 0 HIADHN Cc1ccc(-c2nc(CNC(=O)N3CCCN(Cc4ccccc4)C[C@H]3C)co2)cc1 ZINC000466776386 880556244 /nfs/dbraw/zinc/55/62/44/880556244.db2.gz MFHLKGKQUDRCIQ-HXUWFJFHSA-N 0 3 418.541 4.456 20 0 HIADHN C[C@H]1CN(C2CC2)C[C@@H]1NC(=O)N(C)CCCCCc1cc(-c2ccccc2)no1 ZINC000466777082 880556295 /nfs/dbraw/zinc/55/62/95/880556295.db2.gz MGMSNPWLZMMRFK-MBSDFSHPSA-N 0 3 410.562 4.179 20 0 HIADHN COC(=O)c1ccc(CNC2(c3ccc(Br)cc3)CCOCC2)s1 ZINC000466802416 880580304 /nfs/dbraw/zinc/58/03/04/880580304.db2.gz JMEWOXFNBKUVPF-UHFFFAOYSA-N 0 3 410.333 4.093 20 0 HIADHN C[C@@H](NC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1)c1ccc(-n2cccn2)cc1 ZINC000466964247 880754585 /nfs/dbraw/zinc/75/45/85/880754585.db2.gz JJRJRSCDILUYOJ-LEWJYISDSA-N 0 3 417.557 4.239 20 0 HIADHN Cc1nc(CCC(=O)N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)oc1-c1ccccc1 ZINC000467028900 880828691 /nfs/dbraw/zinc/82/86/91/880828691.db2.gz NTUQBJOMFPLLMP-XMSQKQJNSA-N 0 3 403.526 4.362 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)CCc2cc(Br)cs2)CN1Cc1ccccc1 ZINC000467044735 880839820 /nfs/dbraw/zinc/83/98/20/880839820.db2.gz IDAQBVXGXAIOKS-PBHICJAKSA-N 0 3 407.377 4.222 20 0 HIADHN Cc1cc(CSc2ncccc2C(=O)N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)no1 ZINC000467048960 880841538 /nfs/dbraw/zinc/84/15/38/880841538.db2.gz UXCDLPKYVWCRRL-VQIMIIECSA-N 0 3 422.554 4.063 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)Cc2coc(-c3ccc(Cl)cc3)n2)CN1Cc1ccccc1 ZINC000467049969 880842002 /nfs/dbraw/zinc/84/20/02/880842002.db2.gz YLYGNOIHMCCNRY-OXJNMPFZSA-N 0 3 409.917 4.317 20 0 HIADHN COc1ccc(Br)c(NC(=O)N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)c1 ZINC000467110857 880869981 /nfs/dbraw/zinc/86/99/81/880869981.db2.gz PCVYBDKPVVHSIY-HOCLYGCPSA-N 0 3 418.335 4.242 20 0 HIADHN COC[C@@H]1CCCCN([C@@H](C)C(=O)Nc2ccc(NC(=O)c3cccs3)cc2)C1 ZINC000467120090 880876637 /nfs/dbraw/zinc/87/66/37/880876637.db2.gz DNBNBDBFGCVCTR-DLBZAZTESA-N 0 3 415.559 4.076 20 0 HIADHN COC[C@H]1CCCCN([C@@H](C)C(=O)Nc2ccc(NC(=O)c3cccs3)cc2)C1 ZINC000467120092 880876706 /nfs/dbraw/zinc/87/67/06/880876706.db2.gz DNBNBDBFGCVCTR-IRXDYDNUSA-N 0 3 415.559 4.076 20 0 HIADHN CC[C@@H]1Oc2cc([C@@H](C)NC(=O)c3oc4ccccc4c3CN(C)C)ccc2NC1=O ZINC000467125039 880879006 /nfs/dbraw/zinc/87/90/06/880879006.db2.gz GQBLONRNTLDLEV-KUHUBIRLSA-N 0 3 421.497 4.095 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N[C@H](C)c1nc(C(F)(F)F)cs1)c1ccco1 ZINC000503551467 912619746 /nfs/dbraw/zinc/61/97/46/912619746.db2.gz MYPWFEWBWDARCB-TUAOUCFPSA-N 0 3 404.458 4.245 20 0 HIADHN C[C@H](NC(=O)N1CCC[C@H]1c1cc(F)cc(Br)c1)C1=CCN(C)CC1 ZINC000467214953 880943783 /nfs/dbraw/zinc/94/37/83/880943783.db2.gz DWOUNSYVMMSVQM-UGSOOPFHSA-N 0 3 410.331 4.085 20 0 HIADHN C[C@@H](NC(=O)N1CCC[C@H]1c1cc(F)cc(Br)c1)C1=CCN(C)CC1 ZINC000467214950 880944142 /nfs/dbraw/zinc/94/41/42/880944142.db2.gz DWOUNSYVMMSVQM-ACJLOTCBSA-N 0 3 410.331 4.085 20 0 HIADHN Cc1ccc(Br)cc1NC(=O)CCN[C@H](c1cncc(F)c1)C1CC1 ZINC000467329997 881077910 /nfs/dbraw/zinc/07/79/10/881077910.db2.gz FFVBHAFPAAXKHK-IBGZPJMESA-N 0 3 406.299 4.361 20 0 HIADHN C[C@@H](N[C@H]1CCCC12CCOCC2)c1nc(-c2ccc(Br)cc2)no1 ZINC000503571112 912649293 /nfs/dbraw/zinc/64/92/93/912649293.db2.gz MLVWFYQYWIIUAX-CJNGLKHVSA-N 0 3 406.324 4.499 20 0 HIADHN C[C@H](N[C@H]1CCCC12CCOCC2)c1nc(-c2ccc(Br)cc2)no1 ZINC000503571110 912650734 /nfs/dbraw/zinc/65/07/34/912650734.db2.gz MLVWFYQYWIIUAX-BBRMVZONSA-N 0 3 406.324 4.499 20 0 HIADHN CCc1ccccc1NC(=O)C[C@@H](C)NCc1cc(Cl)ccc1N1CCOCC1 ZINC000467388666 881172176 /nfs/dbraw/zinc/17/21/76/881172176.db2.gz HXWWPVKSYXYSRT-QGZVFWFLSA-N 0 3 415.965 4.246 20 0 HIADHN COc1ccc2c(c1)[C@@H](NC[C@@H](O)COc1ccccc1Br)CCS2 ZINC000467391322 881174818 /nfs/dbraw/zinc/17/48/18/881174818.db2.gz BXMCELOYPAGIEG-DYVFJYSZSA-N 0 3 424.360 4.024 20 0 HIADHN Brc1cccc([C@H](NCc2cccc3c2OCO3)C2CCOCC2)c1 ZINC000467401925 881185101 /nfs/dbraw/zinc/18/51/01/881185101.db2.gz DMYGENMXTDPVFS-LJQANCHMSA-N 0 3 404.304 4.435 20 0 HIADHN C[C@H](CCN[C@H]1CCS(=O)(=O)c2ccc(Br)cc21)c1ccccc1 ZINC000467401626 881185880 /nfs/dbraw/zinc/18/58/80/881185880.db2.gz AXGWEAGVKSURBN-KDOFPFPSSA-N 0 3 408.361 4.451 20 0 HIADHN C[C@@H](CCN[C@@H]1CCS(=O)(=O)c2ccc(Br)cc21)c1ccccc1 ZINC000467401625 881186182 /nfs/dbraw/zinc/18/61/82/881186182.db2.gz AXGWEAGVKSURBN-KBXCAEBGSA-N 0 3 408.361 4.451 20 0 HIADHN C[C@H](CCN[C@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl)c1ccccc1 ZINC000467406036 881192725 /nfs/dbraw/zinc/19/27/25/881192725.db2.gz OQQXCHJQXVNETQ-CHWSQXEVSA-N 0 3 401.359 4.485 20 0 HIADHN Cc1nc(-c2cccnc2)sc1[C@H](C)N[C@H]1CC(=O)N(Cc2ccccc2)[C@H]1C ZINC000467440698 881241373 /nfs/dbraw/zinc/24/13/73/881241373.db2.gz WMSCRCKDNUJVPE-KNBMTAEXSA-N 0 3 406.555 4.354 20 0 HIADHN Cc1nc(-c2cccnc2)sc1[C@H](C)N[C@H]1CC(=O)N(Cc2ccccc2)[C@@H]1C ZINC000467440700 881242394 /nfs/dbraw/zinc/24/23/94/881242394.db2.gz WMSCRCKDNUJVPE-VPWXQRGCSA-N 0 3 406.555 4.354 20 0 HIADHN Cc1ccc([C@H](NC[C@@H](CO)CC2CCCC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000467451835 881255177 /nfs/dbraw/zinc/25/51/77/881255177.db2.gz YZOGHHUGVFBCBT-RDPSFJRHSA-N 0 3 415.599 4.266 20 0 HIADHN Cc1cc(NC(=O)N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)ccc1OC1CCOCC1 ZINC000467466194 881281465 /nfs/dbraw/zinc/28/14/65/881281465.db2.gz BZLNHDQDEHSVBK-UGKGYDQZSA-N 0 3 423.557 4.337 20 0 HIADHN CC(=O)N(Cc1ccc(NC(=O)N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)cc1)C(C)C ZINC000467476113 881294767 /nfs/dbraw/zinc/29/47/67/881294767.db2.gz NGGHDIYRBANGIY-NTKDMRAZSA-N 0 3 422.573 4.228 20 0 HIADHN C[C@H](Sc1ccccc1Cl)C(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000467492184 881309536 /nfs/dbraw/zinc/30/95/36/881309536.db2.gz LEQBQXCPPSACGM-INIZCTEOSA-N 0 3 418.990 4.094 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)c2cc(Br)c(F)cc2F)C1 ZINC000469051588 883125067 /nfs/dbraw/zinc/12/50/67/883125067.db2.gz SACDHTIEWSFLLU-GXTWGEPZSA-N 0 3 409.274 4.293 20 0 HIADHN CC(C)(C)N1CCC(NS(=O)(=O)c2cc(Cl)ccc2OCC2CCC2)CC1 ZINC000469055190 883128689 /nfs/dbraw/zinc/12/86/89/883128689.db2.gz UYYWYHXYYNVVRZ-UHFFFAOYSA-N 0 3 414.999 4.060 20 0 HIADHN C[C@H](C(=O)NC[C@H](C[C@H](C)O)c1ccccc1)N1CCC(Cc2ccccc2)CC1 ZINC000469075637 883159143 /nfs/dbraw/zinc/15/91/43/883159143.db2.gz VUOAKVLNOZNONP-BKSPAHHJSA-N 0 3 408.586 4.001 20 0 HIADHN COc1ccc2c(c1)[C@@H](N[C@H]1CCCN(Cc3ccc(F)cc3F)C1=O)CCC2 ZINC000469113245 883204141 /nfs/dbraw/zinc/20/41/41/883204141.db2.gz VOHNTRBFKXSSRL-VXKWHMMOSA-N 0 3 400.469 4.132 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(Cl)cc2)CC1)[C@H]1CCCC(F)(F)C1 ZINC000503593777 912681342 /nfs/dbraw/zinc/68/13/42/912681342.db2.gz DFGLEBDQYLKZAQ-HNNXBMFYSA-N 0 3 400.897 4.125 20 0 HIADHN CCN(C(=O)c1nnn(CC2CCCC2)c1C)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000469187752 883288251 /nfs/dbraw/zinc/28/82/51/883288251.db2.gz CSMYVRWVFHNPSM-XMSQKQJNSA-N 0 3 409.578 4.074 20 0 HIADHN CCOC(=O)c1csc(CCN[C@H](C)c2cnn(-c3cccc(Cl)c3)c2C)n1 ZINC000469239055 883339238 /nfs/dbraw/zinc/33/92/38/883339238.db2.gz MMKCPOIOCITTJP-CYBMUJFWSA-N 0 3 418.950 4.361 20 0 HIADHN COc1cccc(NC(=O)[C@H](NC2CCN(c3nccs3)CC2)c2ccccc2)c1 ZINC000503603485 912697295 /nfs/dbraw/zinc/69/72/95/912697295.db2.gz UDNPUKLOYSLWAY-OAQYLSRUSA-N 0 3 422.554 4.090 20 0 HIADHN C[C@H](NCc1ccc(S(C)(=O)=O)s1)[C@H](C)Oc1ccc(Cl)cc1Cl ZINC000469269706 883367243 /nfs/dbraw/zinc/36/72/43/883367243.db2.gz UWNSSPXRKHSFRR-QWRGUYRKSA-N 0 3 408.372 4.404 20 0 HIADHN C[C@@H](Oc1ccc(Cl)cc1Cl)[C@H](C)NCc1ccc(S(C)(=O)=O)s1 ZINC000469269719 883368181 /nfs/dbraw/zinc/36/81/81/883368181.db2.gz UWNSSPXRKHSFRR-WDEREUQCSA-N 0 3 408.372 4.404 20 0 HIADHN CCOC(=O)[C@](C)(CN[C@@H](C)C(=O)Nc1ccc(Cl)cc1C)c1ccccc1 ZINC000469305899 883403493 /nfs/dbraw/zinc/40/34/93/883403493.db2.gz UTZCKMFEQGKFFN-KSFYIVLOSA-N 0 3 402.922 4.086 20 0 HIADHN CN(C(=O)c1cc(Br)c(F)cc1F)C1CCN(Cc2ccccc2)CC1 ZINC000469408694 883579433 /nfs/dbraw/zinc/57/94/33/883579433.db2.gz VNQIAJNRMIERRD-UHFFFAOYSA-N 0 3 423.301 4.464 20 0 HIADHN CCOc1ccccc1NC(=O)CCN(CCO)Cc1ccc(Cl)c(Cl)c1 ZINC000503630080 912730303 /nfs/dbraw/zinc/73/03/03/912730303.db2.gz VIEIILDPEQYSFD-UHFFFAOYSA-N 0 3 411.329 4.215 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)Nc1ccccc1C(=O)N1CCCC1 ZINC000469458611 883667948 /nfs/dbraw/zinc/66/79/48/883667948.db2.gz HTPUXURAWAFTAN-QHCPKHFHSA-N 0 3 422.573 4.201 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)Nc1cccc(C(=O)N2CCCC2)c1 ZINC000469459154 883669840 /nfs/dbraw/zinc/66/98/40/883669840.db2.gz OVMVFSBKDDOSOK-QHCPKHFHSA-N 0 3 422.573 4.201 20 0 HIADHN O=C(NCc1cccc2cc[nH]c21)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000469464242 883678056 /nfs/dbraw/zinc/67/80/56/883678056.db2.gz GQBNOTDFTRWKKL-OAQYLSRUSA-N 0 3 401.432 4.239 20 0 HIADHN CC(=O)Nc1ccc(F)c(NC(=O)N[C@@H](CN(C)Cc2ccccc2)C(C)C)c1 ZINC000469469170 883692353 /nfs/dbraw/zinc/69/23/53/883692353.db2.gz RVRRWBBTQMJPBW-NRFANRHFSA-N 0 3 400.498 4.062 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)[C@@H]3C[C@H]3c3ccc(Cl)s3)CC2)C[C@H](C)O1 ZINC000469528305 883800835 /nfs/dbraw/zinc/80/08/35/883800835.db2.gz BQQHCQUXRYCQPG-CYGHRXIMSA-N 0 3 411.011 4.243 20 0 HIADHN CN(C)[C@@H](CNCc1ccc(Br)cn1)c1cccc(C(F)(F)F)c1 ZINC000469564419 883816003 /nfs/dbraw/zinc/81/60/03/883816003.db2.gz YLIHRKLMABLIRE-INIZCTEOSA-N 0 3 402.258 4.255 20 0 HIADHN CCOc1cc(Cl)ccc1NC(=O)N1CCC(CN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000469612958 883835091 /nfs/dbraw/zinc/83/50/91/883835091.db2.gz GXPVCUOEYBWABT-HOTGVXAUSA-N 0 3 409.958 4.092 20 0 HIADHN Cc1cc(C(=O)NC(C)C)ccc1NC(=O)N[C@@H](CN(C)Cc1ccccc1)C(C)C ZINC000469656276 883852018 /nfs/dbraw/zinc/85/20/18/883852018.db2.gz OWAKQAPDTVPQJV-QHCPKHFHSA-N 0 3 424.589 4.411 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)Nc1cc(C(F)(F)F)c[nH]c1=O ZINC000469664198 883857409 /nfs/dbraw/zinc/85/74/09/883857409.db2.gz TUPBVUXFYQWIBZ-QGZVFWFLSA-N 0 3 410.440 4.084 20 0 HIADHN Fc1cccc(-c2noc([C@@H]3CCCN(CCOCC(F)(F)C(F)(F)F)C3)n2)c1 ZINC000469718161 883884912 /nfs/dbraw/zinc/88/49/12/883884912.db2.gz PZFNMNBTRBIPSL-CYBMUJFWSA-N 0 3 423.357 4.269 20 0 HIADHN COc1cc(Br)ccc1[C@H](C)NC[C@H](O)COc1cccc2[nH]ccc21 ZINC000469751437 883911684 /nfs/dbraw/zinc/91/16/84/883911684.db2.gz INOWYSSTXQOBQN-ZFWWWQNUSA-N 0 3 419.319 4.030 20 0 HIADHN COC(=O)c1cccc(NC(=O)CN[C@H](C)c2ccccc2-c2ccc(Cl)cc2)n1 ZINC000469757614 883922582 /nfs/dbraw/zinc/92/25/82/883922582.db2.gz SPPFOFSJQCSLJS-OAHLLOKOSA-N 0 3 423.900 4.478 20 0 HIADHN C[C@H]1CCCCN1CCNC(=O)C(=O)Nc1ccc(F)cc1-c1ccc(Cl)cc1 ZINC000503660578 912766398 /nfs/dbraw/zinc/76/63/98/912766398.db2.gz XADQOULAOHDFKB-HNNXBMFYSA-N 0 3 417.912 4.075 20 0 HIADHN C[C@H](N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1=O)c1cccc(-n2ccnc2)c1 ZINC000469767117 883939067 /nfs/dbraw/zinc/93/90/67/883939067.db2.gz YJVGQEQWLJLERH-HNAYVOBHSA-N 0 3 414.431 4.347 20 0 HIADHN Fc1ccc([C@@H](Cn2cnc3ccccc32)NCCOCC(F)(F)C(F)F)cc1 ZINC000469767842 883941069 /nfs/dbraw/zinc/94/10/69/883941069.db2.gz ZSNAFWKLKQVFII-QGZVFWFLSA-N 0 3 413.390 4.423 20 0 HIADHN C[C@H]1C[NH+](Cc2ccccc2)C[C@H](C)C1NCc1nc2c3ccccc3oc2c(=O)[n-]1 ZINC000469775865 883950979 /nfs/dbraw/zinc/95/09/79/883950979.db2.gz MURORKIGDDQYLT-IRXDYDNUSA-N 0 3 416.525 4.328 20 0 HIADHN COc1cc([C@@H](C)NCc2ccc(Br)c(Cl)c2)ccc1OCCO ZINC000469781110 883954794 /nfs/dbraw/zinc/95/47/94/883954794.db2.gz SEXSZPAKNGBEKG-GFCCVEGCSA-N 0 3 414.727 4.333 20 0 HIADHN COc1cc(Cl)c(Cl)cc1C(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000469845500 884027994 /nfs/dbraw/zinc/02/79/94/884027994.db2.gz WYOKKWBAXUKQRC-INIZCTEOSA-N 0 3 423.340 4.023 20 0 HIADHN O=C(NC[C@H]1CN(Cc2ccccc2)CCCO1)C1(Cc2ccccc2Cl)CC1 ZINC000469851194 884036086 /nfs/dbraw/zinc/03/60/86/884036086.db2.gz HNNDWMGHTVUZBL-NRFANRHFSA-N 0 3 412.961 4.070 20 0 HIADHN COc1ccc2sc(C(=O)NC[C@@H]3CN(Cc4ccccc4)CCCO3)c(C)c2c1 ZINC000469854450 884039869 /nfs/dbraw/zinc/03/98/69/884039869.db2.gz MISPTNRARCDORI-HXUWFJFHSA-N 0 3 424.566 4.239 20 0 HIADHN O=C(NC[C@H]1CN(Cc2ccccc2)CCCO1)c1ccccc1CCC(F)(F)F ZINC000469857966 884042638 /nfs/dbraw/zinc/04/26/38/884042638.db2.gz ZQBUPHNUINIQMD-FQEVSTJZSA-N 0 3 420.475 4.202 20 0 HIADHN O=C(NC[C@H]1CN(Cc2ccccc2)CCCO1)[C@H](OC1CCCC1)c1ccccc1 ZINC000469874528 884064916 /nfs/dbraw/zinc/06/49/16/884064916.db2.gz WGMASYBXRMBVGJ-LOSJGSFVSA-N 0 3 422.569 4.094 20 0 HIADHN CC(C)n1c(CCNC(=O)c2oc3ccccc3c2CN(C)C)nc2ccccc21 ZINC000469875826 884066551 /nfs/dbraw/zinc/06/65/51/884066551.db2.gz ZGMGEFBZTMRMDO-UHFFFAOYSA-N 0 3 404.514 4.398 20 0 HIADHN Cc1ccc(Sc2ccc(NC(=O)N3CCCN([C@H](C)CO)CC3)cc2)c(C)c1 ZINC000469916514 884107298 /nfs/dbraw/zinc/10/72/98/884107298.db2.gz JALLEQUMRHHXAG-LJQANCHMSA-N 0 3 413.587 4.375 20 0 HIADHN O=C(Nc1cccc(-c2ncco2)c1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000469928985 884121723 /nfs/dbraw/zinc/12/17/23/884121723.db2.gz PJNVATZTCRYRLA-UHFFFAOYSA-N 0 3 408.424 4.268 20 0 HIADHN CC(C)[C@H](NC(=O)NC[C@H](c1ccccc1)N1CCCC1)c1nc2ccccc2[nH]1 ZINC000503687326 912792043 /nfs/dbraw/zinc/79/20/43/912792043.db2.gz ZTHBXECOYFAIBI-YADHBBJMSA-N 0 3 405.546 4.396 20 0 HIADHN CC(C)(COCc1ccccc1)C(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000503692242 912796314 /nfs/dbraw/zinc/79/63/14/912796314.db2.gz KAGFUIUCCAUFGX-UHFFFAOYSA-N 0 3 410.558 4.072 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@H]2NC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000470026306 884247543 /nfs/dbraw/zinc/24/75/43/884247543.db2.gz DRFFXEWJLXEERP-SMIHKQSGSA-N 0 3 407.558 4.179 20 0 HIADHN CC[C@H](CNC(=O)N1C[C@@H](C)O[C@H](c2ccsc2)C1)N1CCc2ccccc2C1 ZINC000470038128 884277219 /nfs/dbraw/zinc/27/72/19/884277219.db2.gz ILGHEMDKUHUHLA-YHYVQYDKSA-N 0 3 413.587 4.056 20 0 HIADHN C[C@H]1CN(C(=O)NCC(C)(C)N2CCc3ccccc3C2)C[C@H](c2ccsc2)O1 ZINC000470040587 884282764 /nfs/dbraw/zinc/28/27/64/884282764.db2.gz DTANOCKXPWUGSF-LAUBAEHRSA-N 0 3 413.587 4.056 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)N1CC[C@@H](c2c(F)cccc2F)C1 ZINC000470042081 884283326 /nfs/dbraw/zinc/28/33/26/884283326.db2.gz BOOICWTZHPAZFO-QAPCUYQASA-N 0 3 405.514 4.362 20 0 HIADHN Cc1ccc([C@H]2OCCC[C@@H]2NC(=O)N(CCN(C)C)Cc2cccc(F)c2)cc1 ZINC000470048712 884293489 /nfs/dbraw/zinc/29/34/89/884293489.db2.gz CZPKUDZXHBGBGM-XZOQPEGZSA-N 0 3 413.537 4.128 20 0 HIADHN COc1ccc([C@H](CNC(=O)NCCCSc2ccccc2)N2CCCC2)cc1 ZINC000503720036 912809589 /nfs/dbraw/zinc/80/95/89/912809589.db2.gz XNWFSABEXNEXEF-QFIPXVFZSA-N 0 3 413.587 4.314 20 0 HIADHN Cc1ccc([C@H]2OCCC[C@H]2NC(=O)N(CCN(C)C)Cc2cccc(C)c2)cc1 ZINC000470072546 884327459 /nfs/dbraw/zinc/32/74/59/884327459.db2.gz DDZKZKLNXGKYEM-DNQXCXABSA-N 0 3 409.574 4.297 20 0 HIADHN Cc1cccc2[nH]cc(CCNC(=O)N(CCN(C)C)Cc3ccc(F)cc3F)c21 ZINC000503789245 912825322 /nfs/dbraw/zinc/82/53/22/912825322.db2.gz AUNQRAZUPPCVPC-UHFFFAOYSA-N 0 3 414.500 4.070 20 0 HIADHN O=C(CCc1nc2cc(C(F)(F)F)ccc2s1)NC[C@H]1CCCCN1C1CC1 ZINC000470172766 884454865 /nfs/dbraw/zinc/45/48/65/884454865.db2.gz BNLNPEUPCCJFMP-OAHLLOKOSA-N 0 3 411.493 4.381 20 0 HIADHN CC1CCN([C@@H](CNC(=O)c2ccc(C(F)(F)F)[nH]c2=O)c2cccs2)CC1 ZINC000503853716 912841922 /nfs/dbraw/zinc/84/19/22/912841922.db2.gz BMOFCLBOSUCPQF-AWEZNQCLSA-N 0 3 413.465 4.071 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)NCc1ncc(-c2ccccc2)cn1 ZINC000470285397 884654230 /nfs/dbraw/zinc/65/42/30/884654230.db2.gz IDLGEQPIABOMKD-QHCPKHFHSA-N 0 3 417.557 4.099 20 0 HIADHN CC(C)(C)NC(=O)Nc1ccc(Cl)c(C(=O)NCCN2CCCC(C)(C)C2)c1 ZINC000470299498 884675259 /nfs/dbraw/zinc/67/52/59/884675259.db2.gz RIEQFZXYGLXTRP-UHFFFAOYSA-N 0 3 408.974 4.112 20 0 HIADHN C[C@@H]1CN(C[C@@H]2CCCN2Cc2cc(Br)cc3cccnc32)C[C@H](C)O1 ZINC000470369688 884765253 /nfs/dbraw/zinc/76/52/53/884765253.db2.gz PLOCEYMQYKDOGH-YRNRMSPPSA-N 0 3 418.379 4.071 20 0 HIADHN O=C(CN[C@H]1CCCc2c(Br)cccc21)N[C@H]1CCOc2ccccc21 ZINC000503910559 912861618 /nfs/dbraw/zinc/86/16/18/912861618.db2.gz MNQWEDWYHUACPR-OALUTQOASA-N 0 3 415.331 4.056 20 0 HIADHN CC(C)N1CCN(CCCSc2nnc(-c3ccc(C(C)(C)C)cc3)n2C)CC1 ZINC000470454105 884850202 /nfs/dbraw/zinc/85/02/02/884850202.db2.gz ZGPHBUSCIMBEOK-UHFFFAOYSA-N 0 3 415.651 4.288 20 0 HIADHN C[C@@H](CCNC(=O)N(CCN(C)C)Cc1ccccn1)c1cccc(C(F)(F)F)c1 ZINC000470466512 884860169 /nfs/dbraw/zinc/86/01/69/884860169.db2.gz GXGVGTVMWCBVEW-KRWDZBQOSA-N 0 3 422.495 4.367 20 0 HIADHN Cc1cc(C(=O)NC2CCN(CCOc3ccc(F)cc3)CC2)c(Cl)cc1F ZINC000470468930 884861188 /nfs/dbraw/zinc/86/11/88/884861188.db2.gz XBDPXZKFMPYPMR-UHFFFAOYSA-N 0 3 408.876 4.200 20 0 HIADHN COC[C@H](C)Oc1ccc(Cl)cc1NC(=O)N1CCN(C2CCCCC2)CC1 ZINC000470517886 884906806 /nfs/dbraw/zinc/90/68/06/884906806.db2.gz CSBNQLBFBAZGAD-INIZCTEOSA-N 0 3 409.958 4.236 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)Nc3cccc(Oc4ccccn4)c3)CC2)c1 ZINC000470522979 884915030 /nfs/dbraw/zinc/91/50/30/884915030.db2.gz ZIQCUSDBXHDCCE-UHFFFAOYSA-N 0 3 416.525 4.333 20 0 HIADHN C[C@@H](CC(=O)Nc1cccc(Cl)c1)N[C@H](Cn1ccccc1=O)c1ccccc1 ZINC000503944021 912876233 /nfs/dbraw/zinc/87/62/33/912876233.db2.gz YFHOMUXYUNMRCS-LAUBAEHRSA-N 0 3 409.917 4.250 20 0 HIADHN CCN1CCN(c2ccc(C(=O)NC[C@@H]3CCCO[C@@H]3c3ccc(C)cc3)cc2)CC1 ZINC000470542093 884947276 /nfs/dbraw/zinc/94/72/76/884947276.db2.gz DWLOLCNVXJVVIR-UKILVPOCSA-N 0 3 421.585 4.035 20 0 HIADHN Cc1cc(C(=O)N[C@@H](CN(C)Cc2ccccc2)C(C)C)c(C)n1Cc1ccccn1 ZINC000470589929 885006075 /nfs/dbraw/zinc/00/60/75/885006075.db2.gz DESCTHGHVNBUEM-VWLOTQADSA-N 0 3 418.585 4.435 20 0 HIADHN C[C@@H]1[C@H](C(F)(F)F)CCN1C(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000470628121 885053775 /nfs/dbraw/zinc/05/37/75/885053775.db2.gz RBTLNMXOCRCASN-FRFSOERESA-N 0 3 408.386 4.240 20 0 HIADHN Cc1ccc(C)n1-c1nc(CC(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)cs1 ZINC000470653971 885074462 /nfs/dbraw/zinc/07/44/62/885074462.db2.gz MGMOMCLGNXEWJC-QFIPXVFZSA-N 0 3 422.598 4.216 20 0 HIADHN CN(C(=O)CCCc1nc(-c2cccs2)no1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470660869 885087155 /nfs/dbraw/zinc/08/71/55/885087155.db2.gz JUKKJEQTEPNDOT-LJQANCHMSA-N 0 3 424.570 4.244 20 0 HIADHN CN(C(=O)CN[C@@H](c1ccccc1)C(F)(F)F)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470669710 885097627 /nfs/dbraw/zinc/09/76/27/885097627.db2.gz SFNONCAYUUPVCE-IRLDBZIGSA-N 0 3 419.491 4.003 20 0 HIADHN CN(C(=O)CCc1ccc(OC(F)F)cc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470678204 885110134 /nfs/dbraw/zinc/11/01/34/885110134.db2.gz MZCJJBGLIZMYDL-FQEVSTJZSA-N 0 3 402.485 4.344 20 0 HIADHN Cc1oc(-c2cccs2)nc1CC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470681305 885112493 /nfs/dbraw/zinc/11/24/93/885112493.db2.gz XZMKTZQFHCISCU-IBGZPJMESA-N 0 3 409.555 4.377 20 0 HIADHN CN(C(=O)N[C@H]1CCOc2c(Cl)cccc21)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470718866 885160276 /nfs/dbraw/zinc/16/02/76/885160276.db2.gz YMAGIXWUGYUQHX-RXVVDRJESA-N 0 3 413.949 4.470 20 0 HIADHN CCCOCc1ccccc1CNC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470728714 885179336 /nfs/dbraw/zinc/17/93/36/885179336.db2.gz XJQHIJQEZDDCQU-XMMPIXPASA-N 0 3 409.574 4.419 20 0 HIADHN COc1ccc(C(C)(C)CNC(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000470738218 885196411 /nfs/dbraw/zinc/19/64/11/885196411.db2.gz UGOUTTIZYQVPBO-JOCHJYFZSA-N 0 3 409.574 4.279 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3cc(-c4nc(C)co4)ccc3C)cc2)CC1 ZINC000470776906 885245263 /nfs/dbraw/zinc/24/52/63/885245263.db2.gz OFDMPHZWRORZTH-UHFFFAOYSA-N 0 3 404.514 4.353 20 0 HIADHN CCc1c(C(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)cnn1-c1ccccc1 ZINC000470823726 885311535 /nfs/dbraw/zinc/31/15/35/885311535.db2.gz YHULLONOXGIMBP-JOCHJYFZSA-N 0 3 402.542 4.171 20 0 HIADHN O=C(Cc1sc(-c2ccccc2)nc1-c1cccs1)N1CCN2CCC1CC2 ZINC000470849675 885347545 /nfs/dbraw/zinc/34/75/45/885347545.db2.gz VGVDKEPSRFYKSS-UHFFFAOYSA-N 0 3 409.580 4.388 20 0 HIADHN CN(C(=O)NCc1ccc(Br)cc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470879486 885371107 /nfs/dbraw/zinc/37/11/07/885371107.db2.gz JHNVLZWLJTUSMZ-HXUWFJFHSA-N 0 3 416.363 4.255 20 0 HIADHN C[C@@H](NC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1)c1ccc(-n2cccn2)cc1 ZINC000470892125 885387164 /nfs/dbraw/zinc/38/71/64/885387164.db2.gz KPIKKVFMIJGIDP-YKSBVNFPSA-N 0 3 417.557 4.239 20 0 HIADHN C[C@@H]1CN(C(=O)NC[C@@H](c2cccs2)N2CCCC2)C[C@H](c2ccsc2)O1 ZINC000470897079 885395400 /nfs/dbraw/zinc/39/54/00/885395400.db2.gz KCJFGQHGVMHJSP-BPQIPLTHSA-N 0 3 405.589 4.118 20 0 HIADHN CSc1ccc(F)cc1CNC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470898814 885399541 /nfs/dbraw/zinc/39/95/41/885399541.db2.gz FJXSFQPDOGXYPC-HXUWFJFHSA-N 0 3 401.551 4.354 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2)o1 ZINC000504034494 912939782 /nfs/dbraw/zinc/93/97/82/912939782.db2.gz MSSBVHHNKVSOQZ-UHFFFAOYSA-N 0 3 420.513 4.436 20 0 HIADHN Cc1cc(NC(=O)c2ccc3oc(C)nc3c2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000471051139 885566236 /nfs/dbraw/zinc/56/62/36/885566236.db2.gz CFSQTBFHVUPXSI-FQEVSTJZSA-N 0 3 415.497 4.340 20 0 HIADHN Cn1cc(Nc2cccc(NC(=O)[C@@H]3CCCN(Cc4cccc(F)c4)C3)c2)cn1 ZINC000471114109 885650187 /nfs/dbraw/zinc/65/01/87/885650187.db2.gz RBHMEYZFNLYFNE-GOSISDBHSA-N 0 3 407.493 4.154 20 0 HIADHN CCN1CCc2nc3ccccc3c(C(=O)N[C@H](C)[C@H](c3ccccc3)N(C)C)c2C1 ZINC000471122226 885659025 /nfs/dbraw/zinc/65/90/25/885659025.db2.gz WRMOEFFPHKLGPS-IQGLISFBSA-N 0 3 416.569 4.034 20 0 HIADHN O=C(Nc1cccc(Br)c1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000471124357 885661437 /nfs/dbraw/zinc/66/14/37/885661437.db2.gz LPMFDXUMKPZMRX-UHFFFAOYSA-N 0 3 420.273 4.376 20 0 HIADHN Cc1noc(CSc2ccccc2C(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)n1 ZINC000471124532 885661513 /nfs/dbraw/zinc/66/15/13/885661513.db2.gz KXFIVFLBEXVSMV-QVKFZJNVSA-N 0 3 410.543 4.092 20 0 HIADHN CSc1nc(C(C)(C)C)nc(C)c1C(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C ZINC000471137191 885677247 /nfs/dbraw/zinc/67/72/47/885677247.db2.gz OFKKCGXGJFJBPW-YJBOKZPZSA-N 0 3 400.592 4.226 20 0 HIADHN Cc1noc(C)c1CSc1ncccc1C(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C ZINC000471141366 885685633 /nfs/dbraw/zinc/68/56/33/885685633.db2.gz UKUPLLBRJWRLHD-KKSFZXQISA-N 0 3 424.570 4.400 20 0 HIADHN CCCc1ncc(C(=O)Nc2ccc(N3CCN(CCC)CC3)cc2OCC)s1 ZINC000471168440 885725652 /nfs/dbraw/zinc/72/56/52/885725652.db2.gz JEOUFKVEXIUGHY-UHFFFAOYSA-N 0 3 416.591 4.279 20 0 HIADHN Cc1cc(Br)cc(C)c1NC(=O)N(CCN(C)C)Cc1ccccn1 ZINC000504072602 912975707 /nfs/dbraw/zinc/97/57/07/912975707.db2.gz YHFLVIKSCUUJCZ-UHFFFAOYSA-N 0 3 405.340 4.057 20 0 HIADHN CN(C)[C@@H]1Cc2ccccc2N(C(=O)c2cccc(-n3ccc(C(F)(F)F)n3)c2)C1 ZINC000471282705 885863853 /nfs/dbraw/zinc/86/38/53/885863853.db2.gz NHPJBXFHSJMZAL-GOSISDBHSA-N 0 3 414.431 4.024 20 0 HIADHN Cc1c(NC(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)cccc1NC(=O)N(C)C ZINC000471367933 886005138 /nfs/dbraw/zinc/00/51/38/886005138.db2.gz XUXARXRMSUMFGQ-PKOBYXMFSA-N 0 3 409.534 4.046 20 0 HIADHN CN(C)[C@@H](CNC(=O)Nc1cccc(CCC(=O)OC(C)(C)C)c1)c1ccccc1 ZINC000471374351 886016337 /nfs/dbraw/zinc/01/63/37/886016337.db2.gz LYHGBYUGYZKOJI-NRFANRHFSA-N 0 3 411.546 4.385 20 0 HIADHN COCCOc1ccc(C(F)(F)F)cc1NC(=O)CCN1CCc2ccccc2C1 ZINC000471408224 886060590 /nfs/dbraw/zinc/06/05/90/886060590.db2.gz ZLIJDECXIOJSMY-UHFFFAOYSA-N 0 3 422.447 4.118 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)c1cccc(Br)c1Cl ZINC000504094415 913006138 /nfs/dbraw/zinc/00/61/38/913006138.db2.gz NTQZMXYHWSJDBD-UHFFFAOYSA-N 0 3 417.800 4.194 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)N[C@@H](C)c2ccccc2-n2cccn2)c1 ZINC000471475803 886169477 /nfs/dbraw/zinc/16/94/77/886169477.db2.gz LVRBMYPKOCYPIY-FQEVSTJZSA-N 0 3 405.546 4.015 20 0 HIADHN Cc1ncsc1CN(C)C[C@@H]1CCN(C(=O)Nc2cccc(Br)c2)C1 ZINC000471477164 886170948 /nfs/dbraw/zinc/17/09/48/886170948.db2.gz SAEKPGJDEULBRA-AWEZNQCLSA-N 0 3 423.380 4.200 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N[C@@H]1CC[C@@H]2CCCC[C@@H]2C1 ZINC000471506807 886208002 /nfs/dbraw/zinc/20/80/02/886208002.db2.gz JRBKLULEDYMYQN-FEWPEAAVSA-N 0 3 401.517 4.450 20 0 HIADHN C[C@H](NC(=O)CCc1nc(-c2ccc(Cl)cc2)no1)[C@H](c1ccccc1)N(C)C ZINC000471535163 886239538 /nfs/dbraw/zinc/23/95/38/886239538.db2.gz DUQXNXORIFWUTK-YCRPNKLZSA-N 0 3 412.921 4.130 20 0 HIADHN C[C@@H](NC(=O)c1ccc(CNC(=O)c2cccs2)cc1)[C@H](c1ccccc1)N(C)C ZINC000471547549 886255143 /nfs/dbraw/zinc/25/51/43/886255143.db2.gz NXHPNUZZHMMUOL-VGOFRKELSA-N 0 3 421.566 4.099 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCc1ccc2ncccc2c1)c1cccc(OC)c1 ZINC000471551464 886259901 /nfs/dbraw/zinc/25/99/01/886259901.db2.gz MQBNSKMRMAEDFL-QHCPKHFHSA-N 0 3 406.530 4.126 20 0 HIADHN CC(C)c1ccccc1NC(=O)C[C@@H](C)NCc1n[nH]c(COc2ccccc2)n1 ZINC000471583889 886295000 /nfs/dbraw/zinc/29/50/00/886295000.db2.gz CMJOSJWEWSOUDD-QGZVFWFLSA-N 0 3 407.518 4.014 20 0 HIADHN C[C@H](Cc1ccc(Br)cc1F)[NH2+]Cc1nnc(COc2ccccc2)[n-]1 ZINC000471613320 886327237 /nfs/dbraw/zinc/32/72/37/886327237.db2.gz JESHHKRBESTVKY-CYBMUJFWSA-N 0 3 419.298 4.006 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)c3cn(C)nc3-c3ccccc3Cl)c2)CC1 ZINC000471637837 886355202 /nfs/dbraw/zinc/35/52/02/886355202.db2.gz FYJJDJVXTGDJSL-UHFFFAOYSA-N 0 3 423.948 4.135 20 0 HIADHN O=C(NC[C@@H]1CCCc2ccccc21)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000471647303 886362846 /nfs/dbraw/zinc/36/28/46/886362846.db2.gz GHQDOGOTPKHDMX-IVMQYODDSA-N 0 3 409.496 4.211 20 0 HIADHN CC[C@@H](C)n1ncc2c1nc(C)cc2C(=O)Nc1cccc(N2CCN(CC)CC2)c1 ZINC000471656980 886371065 /nfs/dbraw/zinc/37/10/65/886371065.db2.gz GBEGAGGHHJSJOX-GOSISDBHSA-N 0 3 420.561 4.105 20 0 HIADHN Cc1ccc([C@@H](NC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)c2ccccn2)cc1 ZINC000471677958 886388154 /nfs/dbraw/zinc/38/81/54/886388154.db2.gz JKNQASRXSDKBPA-ILBGXUMGSA-N 0 3 414.553 4.443 20 0 HIADHN O=C(NCCc1ccc(Cl)s1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000471689711 886398858 /nfs/dbraw/zinc/39/88/58/886398858.db2.gz VCTXLGIOGTUWBY-UHFFFAOYSA-N 0 3 409.905 4.049 20 0 HIADHN COc1ccc(NC(=O)[C@@H](C(C)C)N(C)C)cc1OCc1ccc2ccccc2n1 ZINC000471787751 886522922 /nfs/dbraw/zinc/52/29/22/886522922.db2.gz MXDGJIUGPVUVNR-HSZRJFAPSA-N 0 3 407.514 4.347 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3ccnc(-c4ccccc4)c3)CC2)C[C@@H](C)O1 ZINC000504163970 913052533 /nfs/dbraw/zinc/05/25/33/913052533.db2.gz VAOQKDCRQOELLV-RTBURBONSA-N 0 3 408.546 4.102 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1cc(OC)c(OC)cc1F)c1cccc(OC)c1 ZINC000504171873 913058228 /nfs/dbraw/zinc/05/82/28/913058228.db2.gz NBZVWDXYBQUNEM-IBGZPJMESA-N 0 3 419.497 4.056 20 0 HIADHN Cc1ccccc1C1(CNC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)CC1 ZINC000471833490 886586584 /nfs/dbraw/zinc/58/65/84/886586584.db2.gz CDSTZGSNWRZPTR-UHFFFAOYSA-N 0 3 409.496 4.131 20 0 HIADHN Cc1cn([C@H](C)c2ccccc2)nc1NC(=O)N(CCN(C)C)Cc1cccs1 ZINC000471841905 886604039 /nfs/dbraw/zinc/60/40/39/886604039.db2.gz AYOLREZNBOAODS-GOSISDBHSA-N 0 3 411.575 4.458 20 0 HIADHN C[C@@H](NC(=O)N(CCN(C)C)Cc1ccccn1)c1cc(F)c(Cl)cc1Cl ZINC000504186520 913069723 /nfs/dbraw/zinc/06/97/23/913069723.db2.gz IVDWRUFAHDMBAZ-CYBMUJFWSA-N 0 3 413.324 4.362 20 0 HIADHN CN1CC[C@H](NC(=O)N[C@H](c2c(F)cccc2F)C(F)(F)F)[C@H]1c1ccccc1 ZINC000471932999 886726961 /nfs/dbraw/zinc/72/69/61/886726961.db2.gz ZELONHLPCXFVKZ-CGTJXYLNSA-N 0 3 413.390 4.313 20 0 HIADHN CCc1c(C(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)cnn1-c1ccccc1 ZINC000504198599 913080985 /nfs/dbraw/zinc/08/09/85/913080985.db2.gz BLNNMJWJQRMQIQ-UHFFFAOYSA-N 0 3 417.557 4.217 20 0 HIADHN Cc1ccc(NC(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)c(-c2nc(C3CC3)no2)c1 ZINC000471990466 886816112 /nfs/dbraw/zinc/81/61/12/886816112.db2.gz FIBQKWUGBXGUNE-LEWJYISDSA-N 0 3 417.513 4.489 20 0 HIADHN Cc1cc(NC(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)ccc1OC1CCOCC1 ZINC000471994635 886819852 /nfs/dbraw/zinc/81/98/52/886819852.db2.gz CLUNKUOGZKMLDN-FYYLOGMGSA-N 0 3 409.530 4.120 20 0 HIADHN Cc1cc(NC(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)ccc1OC1CCOCC1 ZINC000471994638 886820669 /nfs/dbraw/zinc/82/06/69/886820669.db2.gz CLUNKUOGZKMLDN-JTHBVZDNSA-N 0 3 409.530 4.120 20 0 HIADHN Cc1ccc(NC(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)cc1OCC1CCOCC1 ZINC000472004705 886829026 /nfs/dbraw/zinc/82/90/26/886829026.db2.gz BIYUAPKHMKPSQV-LADGPHEKSA-N 0 3 423.557 4.367 20 0 HIADHN Cc1ccc(NC(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)cc1OCC1CCOCC1 ZINC000472004704 886829400 /nfs/dbraw/zinc/82/94/00/886829400.db2.gz BIYUAPKHMKPSQV-ISKFKSNPSA-N 0 3 423.557 4.367 20 0 HIADHN COc1ccccc1[C@@H](CNCc1c(C(C)C)nc2sc(C)nn12)OC(C)C ZINC000472058336 886868629 /nfs/dbraw/zinc/86/86/29/886868629.db2.gz OPVNDKIDTZYDRP-LJQANCHMSA-N 0 3 402.564 4.487 20 0 HIADHN COc1ccsc1[C@H](C)NCCC(=O)N(C)Cc1ccccc1Br ZINC000472147490 886944800 /nfs/dbraw/zinc/94/48/00/886944800.db2.gz MGXRSGDLFAHDQC-ZDUSSCGKSA-N 0 3 411.365 4.219 20 0 HIADHN Cc1ccc([C@H](NC(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)c2ccccn2)cc1 ZINC000472174817 886972870 /nfs/dbraw/zinc/97/28/70/886972870.db2.gz RADCWKXLDRPLMF-OPXMRZJTSA-N 0 3 414.553 4.299 20 0 HIADHN Cc1ccc([C@H](NC(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)c2ccccn2)cc1 ZINC000472174818 886974805 /nfs/dbraw/zinc/97/48/05/886974805.db2.gz RADCWKXLDRPLMF-YNJKOYDBSA-N 0 3 414.553 4.299 20 0 HIADHN COc1ccc(OC)c([C@H]2C[C@@H]2C(=O)N(CCN(C)C)Cc2cccc(Cl)c2)c1 ZINC000472217969 887019185 /nfs/dbraw/zinc/01/91/85/887019185.db2.gz ZZYUXIIYPHASPN-CTNGQTDRSA-N 0 3 416.949 4.051 20 0 HIADHN COc1ccc(OC)c([C@@H]2C[C@H]2C(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)c1 ZINC000472230724 887037927 /nfs/dbraw/zinc/03/79/27/887037927.db2.gz HIKCBDDRUVTHKG-WWNPGLIZSA-N 0 3 408.542 4.069 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3cc(F)ccc3-c3ccoc3)CC2)C[C@@H](C)O1 ZINC000472250433 887059385 /nfs/dbraw/zinc/05/93/85/887059385.db2.gz IPEKRTXUKLMULN-QZTJIDSGSA-N 0 3 414.521 4.437 20 0 HIADHN C[C@H]1CCN(C(=O)NCCCCCC(=O)OC(C)(C)C)CCN1Cc1ccccc1 ZINC000504239425 913108826 /nfs/dbraw/zinc/10/88/26/913108826.db2.gz NCADOUGDLCSOHJ-FQEVSTJZSA-N 0 3 417.594 4.195 20 0 HIADHN CC[C@@H]1CN(C(C)=O)[C@@H](CC)CN1CCC(=O)Nc1cc(Cl)ccc1Cl ZINC000472317679 887150076 /nfs/dbraw/zinc/15/00/76/887150076.db2.gz QWKNYLGPASXIHR-CVEARBPZSA-N 0 3 400.350 4.043 20 0 HIADHN Cc1cc(Oc2ncccn2)ccc1NC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000472329490 887163012 /nfs/dbraw/zinc/16/30/12/887163012.db2.gz QOTNFRHOYIXVCJ-LEWJYISDSA-N 0 3 403.486 4.144 20 0 HIADHN CO[C@@H]1CC[C@@H](NC(=O)N(CCN2CCCC2)Cc2ccc(Cl)c(Cl)c2)C1 ZINC000472346498 887180486 /nfs/dbraw/zinc/18/04/86/887180486.db2.gz JFGFOHXDQRSSNJ-IAGOWNOFSA-N 0 3 414.377 4.168 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2cccc(C[S@@](=O)C(C)(C)C)c2)[C@H]1c1ccccc1 ZINC000472345395 887180765 /nfs/dbraw/zinc/18/07/65/887180765.db2.gz XDYWQJXCXODNAD-BNJCFXFUSA-N 0 3 413.587 4.301 20 0 HIADHN COCCCNC(=O)C1CCN(Cc2cnc(-c3ccc(C(C)C)cc3)s2)CC1 ZINC000472432783 887279906 /nfs/dbraw/zinc/27/99/06/887279906.db2.gz RBXRNYLEJQNCGM-UHFFFAOYSA-N 0 3 415.603 4.298 20 0 HIADHN Cc1nc([C@H]2CCCN2C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cs1 ZINC000472443388 887293585 /nfs/dbraw/zinc/29/35/85/887293585.db2.gz INVIPZNBLJRCES-VMBOVVBDSA-N 0 3 416.513 4.103 20 0 HIADHN CC[C@@H](Cc1ccccc1)N(C)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472447448 887298983 /nfs/dbraw/zinc/29/89/83/887298983.db2.gz MIHGRMALDVBECL-GPJFCIFZSA-N 0 3 411.512 4.454 20 0 HIADHN Cc1nc(C)c([C@@H](C)N(C)C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)s1 ZINC000472455520 887311369 /nfs/dbraw/zinc/31/13/69/887311369.db2.gz QPBDULXBUBMTBW-UWTIGNOOSA-N 0 3 418.529 4.268 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N1CCc2c3ccccc3[nH]c2C1 ZINC000472455618 887311713 /nfs/dbraw/zinc/31/17/13/887311713.db2.gz QWXZGYICMFEEKL-UHFFFAOYSA-N 0 3 420.479 4.041 20 0 HIADHN COCCCC[C@@H](NC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1)c1ccccc1 ZINC000472458988 887316253 /nfs/dbraw/zinc/31/62/53/887316253.db2.gz YWDLFSCKJWXKEK-DNQXCXABSA-N 0 3 409.574 4.460 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N(Cc1cccs1)C1CC1 ZINC000472465409 887323269 /nfs/dbraw/zinc/32/32/69/887323269.db2.gz VPZJQSXMNSJTGH-UHFFFAOYSA-N 0 3 401.498 4.227 20 0 HIADHN COCCC[C@@H](Cc1ccccc1)NC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1 ZINC000472465028 887324288 /nfs/dbraw/zinc/32/42/88/887324288.db2.gz UCSXSDMJNSLRKW-DHLKQENFSA-N 0 3 423.601 4.330 20 0 HIADHN Cc1ccccc1C[C@@H](C)N(C)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472468361 887327884 /nfs/dbraw/zinc/32/78/84/887327884.db2.gz SRZNTIHDEBPWFH-PBPGXSGUSA-N 0 3 411.512 4.373 20 0 HIADHN Cc1ccc(NC(=O)C2CC2)cc1NC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000472676567 887531532 /nfs/dbraw/zinc/53/15/32/887531532.db2.gz ILTOBRMGQLTGRG-QFIPXVFZSA-N 0 3 420.557 4.472 20 0 HIADHN CC[C@@H](C)NC(=O)c1ccc(NC(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000472700566 887553370 /nfs/dbraw/zinc/55/33/70/887553370.db2.gz DJKYCZJCUWOUEO-XXBNENTESA-N 0 3 422.573 4.343 20 0 HIADHN Cc1ccc(C(=O)NC2CC2)cc1NC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000472709147 887559894 /nfs/dbraw/zinc/55/98/94/887559894.db2.gz WXFSSXLQBYOGHF-QFIPXVFZSA-N 0 3 420.557 4.016 20 0 HIADHN OCCCN(Cc1ccc(Cl)c(Cl)c1)C[C@H](O)COc1cccc2[nH]ccc21 ZINC000472733502 887579249 /nfs/dbraw/zinc/57/92/49/887579249.db2.gz ASTMKXIINACXLG-INIZCTEOSA-N 0 3 423.340 4.099 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)c3cn(-c4ccc(Cl)cc4)nc3C)c2)CC1 ZINC000472759137 887604207 /nfs/dbraw/zinc/60/42/07/887604207.db2.gz YJZHCJDITYAZOL-UHFFFAOYSA-N 0 3 423.948 4.228 20 0 HIADHN C[C@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)N[C@@H](C)CCN1CCN(C)CC1 ZINC000472913803 887759117 /nfs/dbraw/zinc/75/91/17/887759117.db2.gz KNKBVELULYTGFG-LEWJYISDSA-N 0 3 408.590 4.082 20 0 HIADHN CCOC(=O)c1ccsc1NC(=O)N(CCN(C)C)Cc1cccc(Cl)c1 ZINC000472925476 887772908 /nfs/dbraw/zinc/77/29/08/887772908.db2.gz IULWFZOVBQBVSR-UHFFFAOYSA-N 0 3 409.939 4.174 20 0 HIADHN C[C@H](N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1=O)c1ccc(-n2ccnc2)cc1 ZINC000473045406 887867712 /nfs/dbraw/zinc/86/77/12/887867712.db2.gz WZJQXSGCCYYRFM-HNAYVOBHSA-N 0 3 414.431 4.347 20 0 HIADHN C[C@@H]1CCc2c(sc3nc(CCN4CC[C@]5(C4)OCc4ccccc45)nc(N)c23)C1 ZINC000473178282 887958006 /nfs/dbraw/zinc/95/80/06/887958006.db2.gz WAAIWHFJKKOZST-OYLFLEFRSA-N 0 3 420.582 4.072 20 0 HIADHN COc1cccc([C@@H](CNC(=O)C[C@@H](c2cccs2)n2cccc2)N2CCCC2)c1 ZINC000473291296 888045110 /nfs/dbraw/zinc/04/51/10/888045110.db2.gz DRNAPWXWGFNJFR-FCHUYYIVSA-N 0 3 423.582 4.491 20 0 HIADHN O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)c1ccccc1C(=O)c1ccc(F)cc1 ZINC000473309952 888057209 /nfs/dbraw/zinc/05/72/09/888057209.db2.gz VVMWCQVRSHIDIJ-FQEVSTJZSA-N 0 3 416.496 4.309 20 0 HIADHN OC1(Cc2cccc(F)c2)CCN(CCOc2ccc(Br)cc2)CC1 ZINC000473441074 888162281 /nfs/dbraw/zinc/16/22/81/888162281.db2.gz JAJPRSYDZYYMEO-UHFFFAOYSA-N 0 3 408.311 4.037 20 0 HIADHN Cc1ccc(Oc2ccc(NC(=O)NC(C)(C)CCN3CCN(C)CC3)cc2)cc1 ZINC000473496634 888220837 /nfs/dbraw/zinc/22/08/37/888220837.db2.gz IAEXKUHJIYCPIR-UHFFFAOYSA-N 0 3 410.562 4.325 20 0 HIADHN Cc1nc(-c2ccccc2)oc1C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473511574 888240186 /nfs/dbraw/zinc/24/01/86/888240186.db2.gz IABIJNAMQMAGCR-UHFFFAOYSA-N 0 3 407.436 4.185 20 0 HIADHN COc1ccc(C(=O)CCC(=O)N2CC[C@@]3(C2)CCCN(Cc2ccccc2)C3)cc1 ZINC000473514925 888244932 /nfs/dbraw/zinc/24/49/32/888244932.db2.gz LWTYIOBQWZMYIQ-SANMLTNESA-N 0 3 420.553 4.173 20 0 HIADHN O=C(CCCc1ccc(F)c(F)c1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473515692 888247160 /nfs/dbraw/zinc/24/71/60/888247160.db2.gz ZXGWEKOJVZJDTN-UHFFFAOYSA-N 0 3 404.423 4.209 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1cc(-c2ccc(F)cc2)on1 ZINC000473515293 888247485 /nfs/dbraw/zinc/24/74/85/888247485.db2.gz WZFWRJOFGGPDCI-UHFFFAOYSA-N 0 3 411.399 4.016 20 0 HIADHN CCCN(CC)c1ccc(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cc1 ZINC000473517650 888249565 /nfs/dbraw/zinc/24/95/65/888249565.db2.gz ILBZQYGUKUSZSG-UHFFFAOYSA-N 0 3 411.512 4.458 20 0 HIADHN Cc1ccc(-c2ocnc2C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cc1 ZINC000473520268 888253962 /nfs/dbraw/zinc/25/39/62/888253962.db2.gz OUMSFANXHMRRIH-UHFFFAOYSA-N 0 3 407.436 4.185 20 0 HIADHN C[C@@H](C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1cn(C)c2ccccc12 ZINC000473520828 888254748 /nfs/dbraw/zinc/25/47/48/888254748.db2.gz POHIVZNSZWPFIE-ODIFPOPNSA-N 0 3 407.480 4.203 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1csc(-c2ccccc2)n1 ZINC000473520481 888254961 /nfs/dbraw/zinc/25/49/61/888254961.db2.gz PLMDHYUCBVHFBZ-UHFFFAOYSA-N 0 3 409.477 4.345 20 0 HIADHN CC(C)(C)c1ccccc1OCC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473524626 888259643 /nfs/dbraw/zinc/25/96/43/888259643.db2.gz VCNWFBIRVPNCIL-UHFFFAOYSA-N 0 3 412.496 4.284 20 0 HIADHN CCn1cc(CC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)c2ccccc21 ZINC000473523769 888260121 /nfs/dbraw/zinc/26/01/21/888260121.db2.gz NFSHFJKFYQMOAH-UHFFFAOYSA-N 0 3 407.480 4.125 20 0 HIADHN Cc1c(Br)cccc1C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473526449 888264187 /nfs/dbraw/zinc/26/41/87/888264187.db2.gz QSJNXWBNVUBBOS-UHFFFAOYSA-N 0 3 419.285 4.293 20 0 HIADHN CCc1c(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cnn1CCC(C)C ZINC000473528662 888265371 /nfs/dbraw/zinc/26/53/71/888265371.db2.gz VSNJBVIZURAGNE-UHFFFAOYSA-N 0 3 414.516 4.027 20 0 HIADHN CC(C)COc1ccc(CC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cc1 ZINC000473527218 888265814 /nfs/dbraw/zinc/26/58/14/888265814.db2.gz LAJAVRXBEHBTJR-UHFFFAOYSA-N 0 3 412.496 4.185 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1ccc(N2CCCCC2)cc1 ZINC000473529424 888266506 /nfs/dbraw/zinc/26/65/06/888266506.db2.gz PXXLKVMZIHSMAZ-UHFFFAOYSA-N 0 3 409.496 4.212 20 0 HIADHN C[C@@H](CC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1)Cc1cccc(F)c1 ZINC000473530604 888269018 /nfs/dbraw/zinc/26/90/18/888269018.db2.gz ZUMUNGUTWVVOAJ-FTXHTYHOSA-N 0 3 400.460 4.316 20 0 HIADHN C[C@@H](CC(=O)c1ccc(Cl)cc1)C(=O)N1C[C@H]2CN(Cc3ccccc3)C[C@H]2C1 ZINC000473565051 888305760 /nfs/dbraw/zinc/30/57/60/888305760.db2.gz ZNMHXKGQULCRAL-DZFGPLHGSA-N 0 3 410.945 4.139 20 0 HIADHN COc1cccc(C(=O)c2ccc(C(=O)N3CCC[C@@H]3CN3CCCCC3)cc2)c1 ZINC000473617799 888359136 /nfs/dbraw/zinc/35/91/36/888359136.db2.gz LUCUTZBDVJUOJX-JOCHJYFZSA-N 0 3 406.526 4.017 20 0 HIADHN Cc1cc(Sc2ccccc2)ccc1NC(=O)N[C@H](C)CCN1CCN(C)CC1 ZINC000473653326 888402059 /nfs/dbraw/zinc/40/20/59/888402059.db2.gz GITUYDMDLKPBQD-LJQANCHMSA-N 0 3 412.603 4.294 20 0 HIADHN CN1CCN(CCC(C)(C)NC(=O)Nc2c(F)cc(F)cc2-c2ccccc2)CC1 ZINC000473669811 888429099 /nfs/dbraw/zinc/42/90/99/888429099.db2.gz GCPHHFZEACFNGC-UHFFFAOYSA-N 0 3 416.516 4.169 20 0 HIADHN C[C@@H](CCN1CCN(C)CC1)NC(=O)Nc1ccc(F)cc1-c1ccc(Cl)cc1 ZINC000473672506 888432581 /nfs/dbraw/zinc/43/25/81/888432581.db2.gz BCRCPOAXQYBEQD-INIZCTEOSA-N 0 3 418.944 4.294 20 0 HIADHN C[C@H](CCN1CCN(C)CC1)NC(=O)Nc1ccc(F)cc1-c1ccc(Cl)cc1 ZINC000473672507 888433061 /nfs/dbraw/zinc/43/30/61/888433061.db2.gz BCRCPOAXQYBEQD-MRXNPFEDSA-N 0 3 418.944 4.294 20 0 HIADHN C[C@H](CCN1CCN(C)CC1)NC(=O)Nc1ccc(CCCc2ccccc2)cc1 ZINC000473675115 888438504 /nfs/dbraw/zinc/43/85/04/888438504.db2.gz KQUFHYFSQDSCRO-OAQYLSRUSA-N 0 3 408.590 4.009 20 0 HIADHN CCSc1nnc(NC(=O)N(CC)[C@H]2CCN([C@H](C)c3ccccc3)C2)s1 ZINC000473683172 888452547 /nfs/dbraw/zinc/45/25/47/888452547.db2.gz QEWZIWXXTWIWQR-ZBFHGGJFSA-N 0 3 405.593 4.339 20 0 HIADHN O[C@@H](CN1CCN(CCOC(c2ccccc2)c2ccccc2)CC1)C1CCCCC1 ZINC000473772710 888571713 /nfs/dbraw/zinc/57/17/13/888571713.db2.gz XOUOWVPPMLFXEG-SANMLTNESA-N 0 3 422.613 4.351 20 0 HIADHN CCN(C(=O)Nc1nnc(-c2ccco2)s1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000473777927 888580476 /nfs/dbraw/zinc/58/04/76/888580476.db2.gz XLJQBYIXOMLBMY-NVXWUHKLSA-N 0 3 411.531 4.487 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)Nc3ccc(NC4CCOCC4)cc3)c2)CC1 ZINC000473802106 888623206 /nfs/dbraw/zinc/62/32/06/888623206.db2.gz ALSQADKXAQQEOS-UHFFFAOYSA-N 0 3 423.561 4.063 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)NCc3ccc4[nH]c(C)c(C)c4c3)c2)CC1 ZINC000473814445 888640175 /nfs/dbraw/zinc/64/01/75/888640175.db2.gz CHQYTBPVMGGARM-UHFFFAOYSA-N 0 3 405.546 4.248 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N(C)Cc3nc4ccccc4s3)c2)CC1 ZINC000473824629 888656848 /nfs/dbraw/zinc/65/68/48/888656848.db2.gz VMYCZGWZJPLZEK-UHFFFAOYSA-N 0 3 409.559 4.102 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@@H]3CCC[C@H]3OCc3ccccc3)c2)CC1 ZINC000473830275 888663250 /nfs/dbraw/zinc/66/32/50/888663250.db2.gz PCPBGTUODIASST-DNQXCXABSA-N 0 3 422.573 4.088 20 0 HIADHN CCN(C(=O)Nc1cccc(N2CCN(CC)CC2)c1)[C@H](C)Cc1ccc(OC)cc1 ZINC000473831746 888667275 /nfs/dbraw/zinc/66/72/75/888667275.db2.gz WWXMQBGUIRGXFH-HXUWFJFHSA-N 0 3 424.589 4.322 20 0 HIADHN Cc1nc(CC(C)C)c(NC(=O)N(C)C2CCN(CCc3ccccn3)CC2)s1 ZINC000473836468 888674586 /nfs/dbraw/zinc/67/45/86/888674586.db2.gz NBJDDZQJXRHJOL-UHFFFAOYSA-N 0 3 415.607 4.216 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)NCc3ccccc3OC(F)(F)F)c2)CC1 ZINC000473837610 888675840 /nfs/dbraw/zinc/67/58/40/888675840.db2.gz SHYKBMXLPKCOJJ-UHFFFAOYSA-N 0 3 422.451 4.049 20 0 HIADHN C[C@@H](NC(=O)N1CC[C@@H](CN(C)Cc2cccnc2)C1)c1cc2cccc(F)c2o1 ZINC000473873907 888734816 /nfs/dbraw/zinc/73/48/16/888734816.db2.gz HTJOWDMTVLGVLQ-AEFFLSMTSA-N 0 3 410.493 4.191 20 0 HIADHN C[C@H](CC(=O)Nc1ccccc1)N[C@H]1CCN(c2ccc(Cl)cc2Cl)C1=O ZINC000473986267 888847611 /nfs/dbraw/zinc/84/76/11/888847611.db2.gz IPVFSDXIKFTYBX-DYVFJYSZSA-N 0 3 406.313 4.106 20 0 HIADHN COc1ccc2c(c1)C(C)(C)C[C@@H]2NCc1cccc(C(=O)NC[C@H]2CCCO2)c1 ZINC000474054880 888892876 /nfs/dbraw/zinc/89/28/76/888892876.db2.gz IQSFRBQORFCSFB-OFNKIYASSA-N 0 3 408.542 4.116 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)[C@H]3CCN(c4ccccc4)[C@H]3C)c2)CC1 ZINC000474151537 888980253 /nfs/dbraw/zinc/98/02/53/888980253.db2.gz NVZIWIBMPMZHLA-RDPSFJRHSA-N 0 3 406.574 4.071 20 0 HIADHN CCOc1cccc2[nH]cc(CC(=O)Nc3cccc(N4CCN(C(C)C)CC4)c3)c21 ZINC000474151850 888982896 /nfs/dbraw/zinc/98/28/96/888982896.db2.gz SGEYSGKNVRBHMF-UHFFFAOYSA-N 0 3 420.557 4.278 20 0 HIADHN O=C1c2ccccc2C(=O)N1CCCCN1CCCC[C@@H]1c1nc2ccccc2o1 ZINC000474208399 889045972 /nfs/dbraw/zinc/04/59/72/889045972.db2.gz DVROTAXCCKKYMP-HXUWFJFHSA-N 0 3 403.482 4.431 20 0 HIADHN Cc1ccc2nc(CN3CCC(c4ccccc4C(F)(F)F)CC3)cc(=O)n2c1 ZINC000474241133 889086889 /nfs/dbraw/zinc/08/68/89/889086889.db2.gz UCPUBPMRHUOJFT-UHFFFAOYSA-N 0 3 401.432 4.401 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)C(C)(C)c2ccc(Cl)cc2F)CC1 ZINC000474247741 889098006 /nfs/dbraw/zinc/09/80/06/889098006.db2.gz GRJKUBFSNKVRNY-OAHLLOKOSA-N 0 3 403.929 4.494 20 0 HIADHN CSc1cccc(N(C(=O)c2cc(-c3ccccn3)no2)C2CCN(C)CC2)c1 ZINC000474269845 889132413 /nfs/dbraw/zinc/13/24/13/889132413.db2.gz MUPVTCDMMKHCMM-UHFFFAOYSA-N 0 3 408.527 4.200 20 0 HIADHN CSc1nc(-c2ccco2)nc(C)c1C(=O)NC[C@@H](c1ccc(C)cc1)N(C)C ZINC000474294920 889159667 /nfs/dbraw/zinc/15/96/67/889159667.db2.gz BDDJFVLIPGNCBP-KRWDZBQOSA-N 0 3 410.543 4.108 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)C/C=C\c3ccc(F)cc3)CC2)c1 ZINC000474348303 889224701 /nfs/dbraw/zinc/22/47/01/889224701.db2.gz GHHQSKQMQLTDCO-ALCCZGGFSA-N 0 3 409.549 4.256 20 0 HIADHN COc1ccc2nc(CN[C@@H]3CCN(c4ccccc4OC(F)F)C3)sc2c1 ZINC000474350181 889226599 /nfs/dbraw/zinc/22/65/99/889226599.db2.gz BEUIEELBUJWCAA-CYBMUJFWSA-N 0 3 405.470 4.275 20 0 HIADHN COc1ccc2nc(CN[C@@H]3CCN(c4cc(Cl)ccc4OC)C3)sc2c1 ZINC000474378086 889254129 /nfs/dbraw/zinc/25/41/29/889254129.db2.gz YCZDQTANFMGFGD-CQSZACIVSA-N 0 3 403.935 4.335 20 0 HIADHN Cc1c(CN2CCSCC2)cccc1NCc1ccc(Cl)cc1-n1cncn1 ZINC000474389159 889260010 /nfs/dbraw/zinc/26/00/10/889260010.db2.gz MFBFYQJXVCJFIP-UHFFFAOYSA-N 0 3 413.978 4.390 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)[C@@H]1CCc2nc(C(C)C)[nH]c2C1)c1ccccc1Cl ZINC000474416465 889281085 /nfs/dbraw/zinc/28/10/85/889281085.db2.gz UTZCJWQNUXFIMQ-IERDGZPVSA-N 0 3 416.997 4.491 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)[C@@H]1CCc2[nH]c(C(C)C)nc2C1)c1ccccc1Cl ZINC000474416465 889281098 /nfs/dbraw/zinc/28/10/98/889281098.db2.gz UTZCJWQNUXFIMQ-IERDGZPVSA-N 0 3 416.997 4.491 20 0 HIADHN CC(C)c1nc2c([nH]1)CC[C@@H](C(=O)N[C@@H](c1ccccc1)c1ccc3nc[nH]c3c1)C2 ZINC000474428539 889292459 /nfs/dbraw/zinc/29/24/59/889292459.db2.gz UUQWUBIJTAITLY-JPYJTQIMSA-N 0 3 413.525 4.420 20 0 HIADHN Cc1ccccc1-n1nccc1CNCc1ccc(CN2C[C@@H](C)O[C@H](C)C2)cc1 ZINC000474468279 889332736 /nfs/dbraw/zinc/33/27/36/889332736.db2.gz JZPXLVQBIFSGMD-NHCUHLMSSA-N 0 3 404.558 4.080 20 0 HIADHN CC(C)Sc1cccc(Cl)c1CNCc1ccnc(N2CCN(C)CC2)c1 ZINC000474478002 889339065 /nfs/dbraw/zinc/33/90/65/889339065.db2.gz OEWCLGPRTGCAND-UHFFFAOYSA-N 0 3 405.011 4.277 20 0 HIADHN O=C(NCCCCN1CCN(Cc2ccccc2)CC1)c1c(Cl)cccc1Cl ZINC000474512193 889377815 /nfs/dbraw/zinc/37/78/15/889377815.db2.gz DLVOVLCAWYLCPI-UHFFFAOYSA-N 0 3 420.384 4.321 20 0 HIADHN C[C@@H](NC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C)c1noc(-c2ccccc2)n1 ZINC000474517347 889384127 /nfs/dbraw/zinc/38/41/27/889384127.db2.gz IYTKDAPFEXNZPQ-RTBURBONSA-N 0 3 419.529 4.104 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)C2(CCOCc3ccccc3)CC2)CC1 ZINC000474522757 889392796 /nfs/dbraw/zinc/39/27/96/889392796.db2.gz XBWCIBJQGBQYHI-FQEVSTJZSA-N 0 3 407.558 4.110 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)C2(CCOCc3ccccc3)CC2)CC1 ZINC000474522758 889393047 /nfs/dbraw/zinc/39/30/47/889393047.db2.gz XBWCIBJQGBQYHI-HXUWFJFHSA-N 0 3 407.558 4.110 20 0 HIADHN COCCOc1ccc(C(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)c(Cl)c1 ZINC000474549362 889426513 /nfs/dbraw/zinc/42/65/13/889426513.db2.gz BRSWGFGINPGWJZ-SFHVURJKSA-N 0 3 416.949 4.102 20 0 HIADHN CSc1nc(-c2ccco2)nc(C)c1C(=O)N[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000474555496 889432364 /nfs/dbraw/zinc/43/23/64/889432364.db2.gz YHVNBFFIVXNDKF-AEFFLSMTSA-N 0 3 422.554 4.332 20 0 HIADHN C[C@@H](CNC(=O)c1ccc(NC(=O)Nc2ccccc2)s1)N1CCC(C)CC1 ZINC000474571002 889447285 /nfs/dbraw/zinc/44/72/85/889447285.db2.gz WJAIASCCTXVNLT-INIZCTEOSA-N 0 3 400.548 4.242 20 0 HIADHN O=C(CCc1cnc[nH]1)N[C@H](c1ccccc1)c1ccc2[nH]c(C(F)(F)F)nc2c1 ZINC000474590993 889459814 /nfs/dbraw/zinc/45/98/14/889459814.db2.gz CUFWEVNGPZCQML-LJQANCHMSA-N 0 3 413.403 4.143 20 0 HIADHN Cc1ccccc1-n1nccc1CNCc1ccccc1CN1C[C@@H](C)O[C@@H](C)C1 ZINC000474610880 889475291 /nfs/dbraw/zinc/47/52/91/889475291.db2.gz DOIGNAAHUOKSEA-OYRHEFFESA-N 0 3 404.558 4.080 20 0 HIADHN Cc1ccnc(-c2cccc(NC(=O)N(C)[C@@H]3CCN(Cc4ccccc4)C3)c2)n1 ZINC000474616395 889480769 /nfs/dbraw/zinc/48/07/69/889480769.db2.gz SWWZFZVMLFSHGZ-JOCHJYFZSA-N 0 3 401.514 4.190 20 0 HIADHN CN(C(=O)Nc1ccc(OCC(F)(F)F)cc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000474701510 889560950 /nfs/dbraw/zinc/56/09/50/889560950.db2.gz MKTPIFARYCKUAC-SFHVURJKSA-N 0 3 407.436 4.366 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)c1cc(-c2ccc(F)cc2)on1 ZINC000474717603 889575559 /nfs/dbraw/zinc/57/55/59/889575559.db2.gz YLPKFLDQOHHGCL-FQEVSTJZSA-N 0 3 408.477 4.002 20 0 HIADHN CCC(=O)Nc1ccc(Cl)c(NC(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000474745196 889600741 /nfs/dbraw/zinc/60/07/41/889600741.db2.gz MQWWBBQKBJQLDI-GOSISDBHSA-N 0 3 414.937 4.427 20 0 HIADHN Cc1cc(F)ccc1-c1ccc(C(=O)NC(C)(C)CCN2CCN(C)CC2)cc1F ZINC000474818511 889671056 /nfs/dbraw/zinc/67/10/56/889671056.db2.gz MGMJDCLGQLBCFF-UHFFFAOYSA-N 0 3 415.528 4.086 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)c3[nH]c4ccc(F)cc4c3Cl)c2)CC1 ZINC000474843745 889701623 /nfs/dbraw/zinc/70/16/23/889701623.db2.gz VFOZIQBTFKWOSV-UHFFFAOYSA-N 0 3 400.885 4.355 20 0 HIADHN CC(C)C[C@@H](N[C@@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1)c1nc(-c2nc[nH]n2)no1 ZINC000474891642 889748927 /nfs/dbraw/zinc/74/89/27/889748927.db2.gz ZDZDNOMDZQIFOO-WUHRBBMRSA-N 0 3 406.943 4.439 20 0 HIADHN CC(C)C[C@@H]([NH2+][C@@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1)c1nc(-c2nc[n-]n2)no1 ZINC000474891642 889748934 /nfs/dbraw/zinc/74/89/34/889748934.db2.gz ZDZDNOMDZQIFOO-WUHRBBMRSA-N 0 3 406.943 4.439 20 0 HIADHN Clc1ccc(CNCc2cc3cc(Br)ccc3[nH]2)c(-n2cncn2)c1 ZINC000474934712 889792987 /nfs/dbraw/zinc/79/29/87/889792987.db2.gz ZQQPUKLJVYJOKW-UHFFFAOYSA-N 0 3 416.710 4.454 20 0 HIADHN C[C@H](Sc1ccccn1)C(=O)N(CCN(C)C)Cc1ccc(C(F)(F)F)cc1 ZINC000474940296 889797329 /nfs/dbraw/zinc/79/73/29/889797329.db2.gz DVZISIMYSOZRTK-HNNXBMFYSA-N 0 3 411.493 4.171 20 0 HIADHN CC(C)(C)[C@H](CN1CCc2ccccc2C1)NC(=O)c1ncccc1Br ZINC000474959820 889815188 /nfs/dbraw/zinc/81/51/88/889815188.db2.gz KVYWLNGHBFKNCE-SFHVURJKSA-N 0 3 416.363 4.047 20 0 HIADHN CCN(C(=O)Nc1ccc2oc(N(C)C)nc2c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000474997715 889849498 /nfs/dbraw/zinc/84/94/98/889849498.db2.gz HFQHPNNSAMEJDA-LJQANCHMSA-N 0 3 407.518 4.022 20 0 HIADHN CCN(C(=O)Nc1ccccc1-n1nc(C)nc1C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475010134 889864076 /nfs/dbraw/zinc/86/40/76/889864076.db2.gz NOSFRIXSSQLDJX-OAQYLSRUSA-N 0 3 418.545 4.012 20 0 HIADHN CCN(Cc1cccc(NC(=O)N(CC)[C@@H]2CCN(Cc3ccccc3)C2)c1)C(C)=O ZINC000475010911 889864129 /nfs/dbraw/zinc/86/41/29/889864129.db2.gz WFKYHSDFLMDOTR-XMMPIXPASA-N 0 3 422.573 4.183 20 0 HIADHN CCN(C(=O)Nc1ccc(C)cc1OCCOC)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475011676 889865757 /nfs/dbraw/zinc/86/57/57/889865757.db2.gz ZVBQWRDRDLKWFP-OAQYLSRUSA-N 0 3 411.546 4.149 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)NCCC(c2ccccc2)c2ccccc2)CC1 ZINC000475017463 889870180 /nfs/dbraw/zinc/87/01/80/889870180.db2.gz RFDYMLWRAURLHZ-UHFFFAOYSA-N 0 3 423.601 4.397 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)Nc2ccccc2N(C)C2CCCC2)CC1 ZINC000475038927 889890741 /nfs/dbraw/zinc/89/07/41/889890741.db2.gz NWAXVULRBYBDBU-UHFFFAOYSA-N 0 3 402.583 4.076 20 0 HIADHN CN(Cc1cccc(OC(F)(F)F)c1)C[C@@H]1C[C@H](F)CN1Cc1nccs1 ZINC000475085132 889931215 /nfs/dbraw/zinc/93/12/15/889931215.db2.gz DXAWMZOWQMPQPE-GJZGRUSLSA-N 0 3 403.445 4.086 20 0 HIADHN CN(Cc1nc2c(s1)CCCC2)C(=O)NCC(C)(C)N1CCc2ccccc2C1 ZINC000475109476 889958639 /nfs/dbraw/zinc/95/86/39/889958639.db2.gz ASUWQBXYTWJHOP-UHFFFAOYSA-N 0 3 412.603 4.000 20 0 HIADHN CCN(C(=O)Nc1ccc2c(c1)CCC(=O)N2CC)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475109194 889959151 /nfs/dbraw/zinc/95/91/51/889959151.db2.gz KYMMBEFURPNBOI-JOCHJYFZSA-N 0 3 420.557 4.114 20 0 HIADHN CN(C(=O)NCc1ccccc1OC(F)(F)F)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475130232 889993880 /nfs/dbraw/zinc/99/38/80/889993880.db2.gz PDTKHSOFSHXVTP-SFHVURJKSA-N 0 3 407.436 4.001 20 0 HIADHN CN(C(=O)NCc1cccc(OCC(F)(F)F)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475132403 889997148 /nfs/dbraw/zinc/99/71/48/889997148.db2.gz AYKPHYNVNNSOHE-IBGZPJMESA-N 0 3 421.463 4.044 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N(C)Cc1nc2c(s1)CCCC2)c1ccsc1 ZINC000475137573 890004431 /nfs/dbraw/zinc/00/44/31/890004431.db2.gz KLDMPHUKWQDZIF-QGZVFWFLSA-N 0 3 406.621 4.308 20 0 HIADHN CC1CCN([C@@H](CNC(=O)N2CCC[C@]3(CCCOC3)C2)c2cccs2)CC1 ZINC000475148693 890014982 /nfs/dbraw/zinc/01/49/82/890014982.db2.gz ZLSHCEAHJDHYGE-UGKGYDQZSA-N 0 3 405.608 4.123 20 0 HIADHN CCN(C(=O)N[C@H](c1ccccc1)[C@H]1CCCO1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475161583 890026721 /nfs/dbraw/zinc/02/67/21/890026721.db2.gz JVUDZCZQKCSRTN-RBZQAINGSA-N 0 3 407.558 4.213 20 0 HIADHN CCN(C(=O)N[C@@H](C)c1cn(C(C)(C)C)nc1C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475166900 890031959 /nfs/dbraw/zinc/03/19/59/890031959.db2.gz XZYJHKUHQDVXNB-RXVVDRJESA-N 0 3 411.594 4.314 20 0 HIADHN CCOCCC1(CNC(=O)N(CC)[C@@H]2CCN(Cc3ccccc3)C2)CCCC1 ZINC000475166970 890032191 /nfs/dbraw/zinc/03/21/91/890032191.db2.gz YXZQPYZLWGKMOZ-JOCHJYFZSA-N 0 3 401.595 4.279 20 0 HIADHN CCN(C(=O)NCc1nnc(-c2ccccc2)s1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475169029 890034964 /nfs/dbraw/zinc/03/49/64/890034964.db2.gz XSTJFHCTUPUCLA-HXUWFJFHSA-N 0 3 421.570 4.011 20 0 HIADHN CCN(C(=O)NCCCCc1nc(C)cs1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475172534 890038037 /nfs/dbraw/zinc/03/80/37/890038037.db2.gz HIIGGNCVMOGLQR-HXUWFJFHSA-N 0 3 400.592 4.080 20 0 HIADHN CCCC(=O)Nc1ccc(CNC(=O)N(CC)[C@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000475186058 890055796 /nfs/dbraw/zinc/05/57/96/890055796.db2.gz WYNUQRXUPKQNFI-QHCPKHFHSA-N 0 3 422.573 4.231 20 0 HIADHN CSCc1cc(F)ccc1CNC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475285217 890182824 /nfs/dbraw/zinc/18/28/24/890182824.db2.gz MBRCHGUXAOOBKZ-NRFANRHFSA-N 0 3 401.551 4.105 20 0 HIADHN CN(C(=O)c1cccc(NC(=O)c2cccs2)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475295606 890202799 /nfs/dbraw/zinc/20/27/99/890202799.db2.gz FYQRRDNPUGENHA-NRFANRHFSA-N 0 3 419.550 4.347 20 0 HIADHN COc1ccc(-c2cnc(CCC(=O)N(C)[C@H]3CCN(Cc4ccccc4)C3)o2)cc1 ZINC000475307645 890219467 /nfs/dbraw/zinc/21/94/67/890219467.db2.gz FIPUTRJBIIIVGJ-NRFANRHFSA-N 0 3 419.525 4.016 20 0 HIADHN CN(C(=O)Cc1csc(Cc2ccc(F)cc2)n1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475307748 890219528 /nfs/dbraw/zinc/21/95/28/890219528.db2.gz GRNWXATZDGTXND-JOCHJYFZSA-N 0 3 423.557 4.148 20 0 HIADHN C[C@@H](SCC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1)c1nc2ccccc2[nH]1 ZINC000475313123 890228307 /nfs/dbraw/zinc/22/83/07/890228307.db2.gz OUKDKCCRZZXCJT-MJGOQNOKSA-N 0 3 408.571 4.090 20 0 HIADHN CO[C@@H]1CCC[C@@H](CC(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)C1 ZINC000475316693 890231373 /nfs/dbraw/zinc/23/13/73/890231373.db2.gz XVNABAKLVDBLOZ-VQIMIIECSA-N 0 3 400.485 4.191 20 0 HIADHN COCCC[C@@H](Cc1ccccc1)NCc1cn(-c2ccc(F)cc2Cl)nn1 ZINC000475355812 890280205 /nfs/dbraw/zinc/28/02/05/890280205.db2.gz WAVLORHQXQAVRL-SFHVURJKSA-N 0 3 402.901 4.187 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)Nc3ccccc3OCC(F)F)cc2)CC1 ZINC000475416463 890341449 /nfs/dbraw/zinc/34/14/49/890341449.db2.gz ZJXKCGYMPSLTRX-UHFFFAOYSA-N 0 3 403.473 4.113 20 0 HIADHN CCc1c(C(=O)NC[C@H](c2cccc(OC)c2)N(CC)CC)cnn1C1CCCC1 ZINC000475479252 890387145 /nfs/dbraw/zinc/38/71/45/890387145.db2.gz NLXFXYYOSKEMPU-HSZRJFAPSA-N 0 3 412.578 4.382 20 0 HIADHN CN(C(=O)c1ccc2c(c1)[nH]c(=O)n2C1CCCC1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475541123 890464183 /nfs/dbraw/zinc/46/41/83/890464183.db2.gz NNULUTMXYDUSSE-NRFANRHFSA-N 0 3 418.541 4.204 20 0 HIADHN CN(C(=O)c1ccc2c(c1)[nH]c(=O)n2C1CCCC1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475541124 890464271 /nfs/dbraw/zinc/46/42/71/890464271.db2.gz NNULUTMXYDUSSE-OAQYLSRUSA-N 0 3 418.541 4.204 20 0 HIADHN CN(C(=O)c1cc2ccc(Br)cc2[nH]1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475554045 890480123 /nfs/dbraw/zinc/48/01/23/890480123.db2.gz HQDQEUGWCRVSSG-SFHVURJKSA-N 0 3 412.331 4.277 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)Nc2ccc3oc(CC(C)(C)C)nc3c2)CC1 ZINC000475615264 890545483 /nfs/dbraw/zinc/54/54/83/890545483.db2.gz ZQQUNRWHPONZEL-UHFFFAOYSA-N 0 3 416.566 4.427 20 0 HIADHN Cc1ccc(NC(=O)NC2CCN(CCOC(C)C)CC2)cc1OCCC(C)C ZINC000475616573 890546793 /nfs/dbraw/zinc/54/67/93/890546793.db2.gz GSKARCUCWXCREE-UHFFFAOYSA-N 0 3 405.583 4.431 20 0 HIADHN Cc1ccc(-n2cccn2)cc1NC(=O)NCC(C)(C)N1CCc2ccccc2C1 ZINC000475634126 890574630 /nfs/dbraw/zinc/57/46/30/890574630.db2.gz ZYDYURKNWBODLU-UHFFFAOYSA-N 0 3 403.530 4.139 20 0 HIADHN COc1ccc(CN2CCC[C@]2(CO)Cc2ccccc2)c(Br)c1OC ZINC000475647940 890590943 /nfs/dbraw/zinc/59/09/43/890590943.db2.gz HWAPJCYUJLPBQK-OAQYLSRUSA-N 0 3 420.347 4.036 20 0 HIADHN CCN(C(=O)Nc1cc(-n2cccn2)ccc1C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475650361 890594791 /nfs/dbraw/zinc/59/47/91/890594791.db2.gz XOAGHLZRKDPWOO-QFIPXVFZSA-N 0 3 403.530 4.309 20 0 HIADHN CCCCOc1ccc(-c2nnc(CN3CCC[C@]3(CO)Cc3ccccc3)o2)cc1 ZINC000475659100 890606275 /nfs/dbraw/zinc/60/62/75/890606275.db2.gz XBIHOCWVRQPTNP-RUZDIDTESA-N 0 3 421.541 4.485 20 0 HIADHN COC(=O)c1ccc(-c2nc(CN3CCC[C@]3(CO)Cc3ccccc3)cs2)cc1 ZINC000475672607 890617084 /nfs/dbraw/zinc/61/70/84/890617084.db2.gz MEQAPYJCZXNCHH-XMMPIXPASA-N 0 3 422.550 4.166 20 0 HIADHN CCCN1CCN(c2ccccc2CNc2ccc(C)c(NC(=O)N(C)C)c2)CC1 ZINC000475690610 890630404 /nfs/dbraw/zinc/63/04/04/890630404.db2.gz BPRUYTQEBFLKRW-UHFFFAOYSA-N 0 3 409.578 4.233 20 0 HIADHN CC(C)(NCC(=O)N1CCC[C@H](C(F)(F)F)C1)c1ccc(OC(F)(F)F)cc1 ZINC000475701476 890640443 /nfs/dbraw/zinc/64/04/43/890640443.db2.gz MBMFJMNQOXOXSE-ZDUSSCGKSA-N 0 3 412.374 4.211 20 0 HIADHN C[C@H](NCCC(=O)Nc1ccc(C(N)=O)c(Cl)c1)c1cc2cccc(F)c2o1 ZINC000475704804 890643165 /nfs/dbraw/zinc/64/31/65/890643165.db2.gz RYVQARRWIIXIRI-NSHDSACASA-N 0 3 403.841 4.004 20 0 HIADHN Clc1ccc2c(c1)nc(CN1CCN(C3CCOCC3)CC1)n2Cc1ccccc1 ZINC000475750933 890696513 /nfs/dbraw/zinc/69/65/13/890696513.db2.gz VOTMZDUQHOUSIH-UHFFFAOYSA-N 0 3 424.976 4.035 20 0 HIADHN COc1cccc(Cl)c1-c1noc(C)c1C(=O)N1CC[C@@H](N2CCCCC2)C1 ZINC000475776817 890719845 /nfs/dbraw/zinc/71/98/45/890719845.db2.gz PTJYFAJVLSPCMH-OAHLLOKOSA-N 0 3 403.910 4.012 20 0 HIADHN O=C(c1ccccc1)c1cc(F)c(F)cc1C(=O)N1CCCC[C@@H](N2CCCC2)C1 ZINC000475778690 890721166 /nfs/dbraw/zinc/72/11/66/890721166.db2.gz XIXYJXMYRPKQKW-GOSISDBHSA-N 0 3 412.480 4.286 20 0 HIADHN CCN(C(=O)c1ccc(OC)cc1OC(F)F)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475814145 890748682 /nfs/dbraw/zinc/74/86/82/890748682.db2.gz WIYFRBXGJXQVDY-QGZVFWFLSA-N 0 3 404.457 4.033 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1CO)c1cccc2ccccc21 ZINC000475970947 890889236 /nfs/dbraw/zinc/88/92/36/890889236.db2.gz YSUJSIPFKJXXSF-KIVTUJJHSA-N 0 3 417.553 4.083 20 0 HIADHN CC[C@@H](NC(=O)N[C@@H](CN1CCc2ccccc2C1)C(C)(C)C)c1nccs1 ZINC000476037217 890969303 /nfs/dbraw/zinc/96/93/03/890969303.db2.gz YXGQWBYRJMOVLT-MOPGFXCFSA-N 0 3 400.592 4.366 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)NC(C)(C)c2cccc(C(F)(F)F)c2)CC1 ZINC000476041557 890972627 /nfs/dbraw/zinc/97/26/27/890972627.db2.gz HEVDLIZYOPAEED-UHFFFAOYSA-N 0 3 415.500 4.129 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)NC[C@H](C)c2c(Cl)cccc2Cl)CC1 ZINC000476057180 890986831 /nfs/dbraw/zinc/98/68/31/890986831.db2.gz ZXMSUMQHEXGOGA-HNNXBMFYSA-N 0 3 416.393 4.286 20 0 HIADHN CN(C(=O)N[C@H](c1ccc(Br)cc1)C1CCC1)[C@H]1CCN(C2CC2)C1 ZINC000476154413 891079338 /nfs/dbraw/zinc/07/93/38/891079338.db2.gz MZDKWPMHHQLWCG-OALUTQOASA-N 0 3 406.368 4.168 20 0 HIADHN COc1cc([C@@H](C)NC(=O)N(C)[C@@H]2CCN(C3CC3)C2)ccc1OCc1ccccc1 ZINC000476162786 891090271 /nfs/dbraw/zinc/09/02/71/891090271.db2.gz OSPLPFIETLGOML-XMSQKQJNSA-N 0 3 423.557 4.213 20 0 HIADHN COc1ccc(-c2nc(C)c(C(=O)N[C@H](C)CN3CCCCCC3)s2)cc1OC ZINC000476189090 891121623 /nfs/dbraw/zinc/12/16/23/891121623.db2.gz FSUADFOSBUMICZ-OAHLLOKOSA-N 0 3 417.575 4.130 20 0 HIADHN C[C@@H]1CCc2ccccc2[C@H]1NC(=O)N(C)C1CCN(CCc2ccccn2)CC1 ZINC000476192608 891124376 /nfs/dbraw/zinc/12/43/76/891124376.db2.gz GTJNFVPBJFJSNX-DVECYGJZSA-N 0 3 406.574 4.054 20 0 HIADHN Cc1nc2c(s1)[C@@H](N(C)C(=O)NCC(C)(C)N1CCc3ccccc3C1)CCC2 ZINC000476236353 891159058 /nfs/dbraw/zinc/15/90/58/891159058.db2.gz VFRLALOHIVIAIW-FQEVSTJZSA-N 0 3 412.603 4.307 20 0 HIADHN CCCOc1ccc(Oc2ncccc2CNC(=O)N(C)[C@H]2CCN(C3CC3)C2)cc1 ZINC000476262671 891184082 /nfs/dbraw/zinc/18/40/82/891184082.db2.gz QEMLUDOYHWQGEV-FQEVSTJZSA-N 0 3 424.545 4.041 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)c1cc2sc(N3CCCC3)nc2s1 ZINC000476276837 891197005 /nfs/dbraw/zinc/19/70/05/891197005.db2.gz YIXXOIZHXPSTDF-UHFFFAOYSA-N 0 3 420.629 4.224 20 0 HIADHN COCCN1CCC[C@@H]1CNC(=O)N[C@H](c1cccs1)c1ccc(C(C)C)cc1 ZINC000476414711 891328113 /nfs/dbraw/zinc/32/81/13/891328113.db2.gz YPYKFPCPGKLIRT-IRLDBZIGSA-N 0 3 415.603 4.371 20 0 HIADHN CCCN(Cc1c(F)cccc1Cl)C(=O)NC1CCN(CCOC(C)C)CC1 ZINC000476436177 891348324 /nfs/dbraw/zinc/34/83/24/891348324.db2.gz NFRGVLFCKFERSZ-UHFFFAOYSA-N 0 3 413.965 4.290 20 0 HIADHN CC[C@H](c1ccccc1)[C@H]1CCCN1C(=O)NC1CCN(CCOC(C)C)CC1 ZINC000476437369 891349813 /nfs/dbraw/zinc/34/98/13/891349813.db2.gz OXKOEQAHMLOKJU-DHIUTWEWSA-N 0 3 401.595 4.244 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N(Cc2ccc(F)cc2F)C2CCCC2)CC1 ZINC000476446349 891358548 /nfs/dbraw/zinc/35/85/48/891358548.db2.gz BLFKTQALDHFKKT-UHFFFAOYSA-N 0 3 423.548 4.308 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N(Cc2ccc3ccccc3c2)C2CC2)CC1 ZINC000476452295 891364583 /nfs/dbraw/zinc/36/45/83/891364583.db2.gz OQJJOKFLPMBDFW-UHFFFAOYSA-N 0 3 409.574 4.403 20 0 HIADHN C[C@@H](c1ccc(F)c(F)c1)N(C)C(=O)CN1CC[C@H](COCc2ccccc2)C1 ZINC000476586946 891515154 /nfs/dbraw/zinc/51/51/54/891515154.db2.gz GHVVWZRVMORVEL-HKUYNNGSSA-N 0 3 402.485 4.023 20 0 HIADHN CC(C)([C@H](NC(=O)Cc1ccc2c[nH]nc2c1)c1ccc(F)c(F)c1)N1CCCC1 ZINC000476621165 891555160 /nfs/dbraw/zinc/55/51/60/891555160.db2.gz ZUBLXMHNBIOPKJ-JOCHJYFZSA-N 0 3 412.484 4.116 20 0 HIADHN CCc1onc(-c2ccc(Br)cc2)c1C(=O)N[C@H](C)C1=CCN(C)CC1 ZINC000476658569 891603954 /nfs/dbraw/zinc/60/39/54/891603954.db2.gz KRSPDGQPLUDBBE-CYBMUJFWSA-N 0 3 418.335 4.047 20 0 HIADHN CCc1onc(-c2ccccc2Cl)c1C(=O)N1C[C@H](SC)[C@@H](N2CCCC2)C1 ZINC000476670033 891619817 /nfs/dbraw/zinc/61/98/17/891619817.db2.gz AESPGQGLFBWCQA-WMZOPIPTSA-N 0 3 419.978 4.209 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)N1CCC[C@@]2(C1)OCc1ccccc12 ZINC000476687718 891642138 /nfs/dbraw/zinc/64/21/38/891642138.db2.gz BAGBBVLYPOMJDJ-NOZRDPDXSA-N 0 3 405.542 4.055 20 0 HIADHN CC(C)c1nc2c([nH]1)C[C@H](C(=O)NC[C@H](c1cccc(C(F)(F)F)c1)N(C)C)CC2 ZINC000476725684 891691252 /nfs/dbraw/zinc/69/12/52/891691252.db2.gz MJGBOVJTBGAWHO-DNVCBOLYSA-N 0 3 422.495 4.076 20 0 HIADHN CC(C)c1nc2c([nH]1)CC[C@@H](C(=O)NC[C@H](c1cccc(C(F)(F)F)c1)N(C)C)C2 ZINC000476725684 891691270 /nfs/dbraw/zinc/69/12/70/891691270.db2.gz MJGBOVJTBGAWHO-DNVCBOLYSA-N 0 3 422.495 4.076 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CNC(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C ZINC000476950973 891887574 /nfs/dbraw/zinc/88/75/74/891887574.db2.gz IVQDCMSEDMEKCI-YADARESESA-N 0 3 419.573 4.039 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)NCc1c(C)nn(Cc2ccccc2)c1C)c1ccco1 ZINC000476960756 891892228 /nfs/dbraw/zinc/89/22/28/891892228.db2.gz KKGBMQGHZSGJGC-VGSWGCGISA-N 0 3 423.561 4.070 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1cccc(-c2noc(C3CC3)n2)c1)c1ccco1 ZINC000477031463 891957326 /nfs/dbraw/zinc/95/73/26/891957326.db2.gz GAJSFQLZEWDJDC-KBXCAEBGSA-N 0 3 409.490 4.458 20 0 HIADHN CCCN(C(=O)c1cn(CC(F)(F)F)nc1C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000477081848 892016902 /nfs/dbraw/zinc/01/69/02/892016902.db2.gz GWXXVIBURIOTPF-LJQANCHMSA-N 0 3 422.495 4.271 20 0 HIADHN COCc1nnc(NC[C@@H]2CCCN(C)[C@@H]2c2ccc(C(F)(F)F)cc2)s1 ZINC000477117987 892048088 /nfs/dbraw/zinc/04/80/88/892048088.db2.gz GETCOYLQQXJBMK-XJKSGUPXSA-N 0 3 400.470 4.198 20 0 HIADHN C/C=C/c1ccc(OC[C@H](O)CN2CCC(OCc3ccccc3)CC2)c(OC)c1 ZINC000477157175 892079133 /nfs/dbraw/zinc/07/91/33/892079133.db2.gz BWMOMMVEOKQNRA-DWUINAILSA-N 0 3 411.542 4.149 20 0 HIADHN Cc1nc([C@@H](C)N2CCN(CC3CCOCC3)CC2)oc1-c1ccc(Cl)cc1 ZINC000477263515 892216232 /nfs/dbraw/zinc/21/62/32/892216232.db2.gz IFPCSYWCSMGUQI-QGZVFWFLSA-N 0 3 403.954 4.409 20 0 HIADHN C[C@H](CNC(=O)N(Cc1cccc(F)c1)C[C@@H]1CCCO1)N(C)Cc1ccccc1 ZINC000477339551 892308295 /nfs/dbraw/zinc/30/82/95/892308295.db2.gz HHZDNXWNSFBRNR-XXBNENTESA-N 0 3 413.537 4.037 20 0 HIADHN C/C=C/c1ccc(OC[C@H](O)CN2CCC[C@H]2c2ccc3c(c2)OCO3)c(OC)c1 ZINC000477465034 892435138 /nfs/dbraw/zinc/43/51/38/892435138.db2.gz PFSCEEKDIWADTJ-BWXLTGRJSA-N 0 3 411.498 4.034 20 0 HIADHN CCO[C@@H]1C[C@H](N[C@@H](C)c2c(C)nn(CC(F)(F)F)c2C)[C@H]1Oc1ccccc1 ZINC000477489305 892486076 /nfs/dbraw/zinc/48/60/76/892486076.db2.gz BIPJLFBPISYFGX-RDOJZNBBSA-N 0 3 411.468 4.338 20 0 HIADHN CC(C)(C(=O)Nc1cccc(CN2CCC(CO)CC2)c1)c1ccccc1Cl ZINC000477705770 892818869 /nfs/dbraw/zinc/81/88/69/892818869.db2.gz VEXCACWYPKLUSN-UHFFFAOYSA-N 0 3 400.950 4.461 20 0 HIADHN CC[C@@H](Oc1ccccc1Cl)C(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000477719536 892824980 /nfs/dbraw/zinc/82/49/80/892824980.db2.gz BPPSEEAGRNCRNT-OAQYLSRUSA-N 0 3 416.949 4.340 20 0 HIADHN CCN(Cc1ccc(Cl)s1)C(=O)NCC1(N2CCSCC2)CCCC1 ZINC000504965759 913702452 /nfs/dbraw/zinc/70/24/52/913702452.db2.gz QJHROCROBMUAIO-UHFFFAOYSA-N 0 3 402.029 4.295 20 0 HIADHN CN(Cc1csc2ccccc12)C(=O)NCC1(N2CCSCC2)CCCC1 ZINC000504965058 913702508 /nfs/dbraw/zinc/70/25/08/913702508.db2.gz HERYLBABWTXEDB-UHFFFAOYSA-N 0 3 403.617 4.404 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1cc(-c2ccccc2)ns1 ZINC000477724008 892827298 /nfs/dbraw/zinc/82/72/98/892827298.db2.gz KWEZAYXRKKBLHS-UHFFFAOYSA-N 0 3 407.539 4.267 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CCC[C@@H]1c1ccc2c(c1)OCO2)c1ccsc1 ZINC000477744956 892839610 /nfs/dbraw/zinc/83/96/10/892839610.db2.gz CWWVBRXJXZNHAL-MOPGFXCFSA-N 0 3 415.559 4.406 20 0 HIADHN Cc1ccc(COc2ccc(C[C@@H](C)NC(=O)N(C)[C@H]3CCN(C4CC4)C3)cc2)cc1 ZINC000477764681 892852556 /nfs/dbraw/zinc/85/25/56/892852556.db2.gz SYUKXVDSEVMUST-YKSBVNFPSA-N 0 3 421.585 4.383 20 0 HIADHN CC[C@H](CNC(=O)N(C)Cc1nc(-c2ccccc2)c[nH]1)N1CCc2ccccc2C1 ZINC000477819131 892886724 /nfs/dbraw/zinc/88/67/24/892886724.db2.gz IKZXEEBFBORAFR-JOCHJYFZSA-N 0 3 417.557 4.055 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)NCCc1ccc(Br)s1)c1ccco1 ZINC000477844409 892903242 /nfs/dbraw/zinc/90/32/42/892903242.db2.gz MLBSRHBZAJIKQR-GXTWGEPZSA-N 0 3 414.369 4.075 20 0 HIADHN COC(=O)c1csc(-c2cccc(CN[C@@H](C)c3cccc(NC(C)=O)c3)c2)n1 ZINC000477869416 892928087 /nfs/dbraw/zinc/92/80/87/892928087.db2.gz ZCZFVDTYIIUPQM-AWEZNQCLSA-N 0 3 409.511 4.406 20 0 HIADHN CCCN(C)[C@H](CNC(=O)N[C@@H]1CCCc2[nH]c(=O)ccc21)c1ccc(Cl)cc1 ZINC000477881144 892944262 /nfs/dbraw/zinc/94/42/62/892944262.db2.gz QNNVHORSOBINQT-WOJBJXKFSA-N 0 3 416.953 4.200 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)N[C@@H]1CCC[C@@H]1c1ccccc1 ZINC000477903500 892975528 /nfs/dbraw/zinc/97/55/28/892975528.db2.gz CNSVQRBCWLUHMR-DENIHFKCSA-N 0 3 401.501 4.374 20 0 HIADHN Cc1ccc(CN2CC[C@@H](N[C@H](C)CC(=O)Nc3ccc(C(C)C)cc3)C2=O)cc1 ZINC000477917627 893001275 /nfs/dbraw/zinc/00/12/75/893001275.db2.gz NVOGZRNGVNYKLR-AUSIDOKSSA-N 0 3 407.558 4.226 20 0 HIADHN Cc1c(Br)scc1C(=O)Nc1cccc2c1CCN(CC(C)(C)O)C2 ZINC000478246245 893416908 /nfs/dbraw/zinc/41/69/08/893416908.db2.gz DMYBETCHGWTZAX-UHFFFAOYSA-N 0 3 423.376 4.200 20 0 HIADHN Cc1nc(COc2ccc(F)cc2)sc1C(=O)NC[C@@H](C)N1CCC[C@H](C)C1 ZINC000478487988 893808896 /nfs/dbraw/zinc/80/88/96/893808896.db2.gz PYGTYXFFEHMQAH-LSDHHAIUSA-N 0 3 405.539 4.020 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N(C)C2c3ccccc3-c3ccccc32)CC1 ZINC000478495806 893812210 /nfs/dbraw/zinc/81/22/10/893812210.db2.gz FGRFZQMMMLDCMA-UHFFFAOYSA-N 0 3 407.558 4.287 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)Cc1nc(-c2ccc(F)cc2)cs1 ZINC000478584113 893860768 /nfs/dbraw/zinc/86/07/68/893860768.db2.gz KKDIXKKWIYVELK-JXFKEZNVSA-N 0 3 409.530 4.128 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)N1CCC[C@@H](Nc2ccccc2)C1 ZINC000478662758 893908517 /nfs/dbraw/zinc/90/85/17/893908517.db2.gz AZUAJBGEKLAFOZ-HSZRJFAPSA-N 0 3 424.614 4.386 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)Nc1cc(Br)cc(OC)c1)c1ccco1 ZINC000478927184 894208438 /nfs/dbraw/zinc/20/84/38/894208438.db2.gz GBTRMXVRNASPHV-WBMJQRKESA-N 0 3 410.312 4.302 20 0 HIADHN CCc1ccc([C@H](CNC(=O)NCc2cc(Br)cs2)N(C)C)cc1 ZINC000505155949 913848123 /nfs/dbraw/zinc/84/81/23/913848123.db2.gz BHBXUMQZISVNBK-KRWDZBQOSA-N 0 3 410.381 4.175 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N2CC3(CCOCC3)c3ccccc32)N2CCCC2)cc1 ZINC000478951662 894233109 /nfs/dbraw/zinc/23/31/09/894233109.db2.gz JSGRYJPOYLZHCE-DEOSSOPVSA-N 0 3 419.569 4.410 20 0 HIADHN CC(C)NC(=O)Nc1ccc([C@@H](C)N[C@@H]2CCCN(c3ccccc3F)C2=O)cc1 ZINC000478980315 894258489 /nfs/dbraw/zinc/25/84/89/894258489.db2.gz YLYRFFIQWLMVSY-OXQOHEQNSA-N 0 3 412.509 4.202 20 0 HIADHN CN(CCCN(C)C(=O)Nc1cccc2c1CN(c1ccccn1)C2)Cc1ccco1 ZINC000478988882 894263302 /nfs/dbraw/zinc/26/33/02/894263302.db2.gz JVBOTXQEMDMONU-UHFFFAOYSA-N 0 3 419.529 4.181 20 0 HIADHN O=C(CCc1ccccc1)N1CC[C@@H](N[C@H]2CCCc3nn(-c4ccccc4)cc32)C1 ZINC000479062400 894321634 /nfs/dbraw/zinc/32/16/34/894321634.db2.gz BBFHRJDLFAMIFM-QPPBQGQZSA-N 0 3 414.553 4.073 20 0 HIADHN COc1ccc(CNCc2ccc(NC(=O)N(C)C)cc2)cc1OCc1cccnc1 ZINC000479065126 894326792 /nfs/dbraw/zinc/32/67/92/894326792.db2.gz RIXUULKQJSGYBB-UHFFFAOYSA-N 0 3 420.513 4.053 20 0 HIADHN COc1cc2c(cc1OC)[C@H](N[C@@H]1CCCN(c3ccccc3Cl)C1=O)CC2 ZINC000479079444 894345713 /nfs/dbraw/zinc/34/57/13/894345713.db2.gz PQALOLIZBQJLJP-QZTJIDSGSA-N 0 3 400.906 4.130 20 0 HIADHN C[C@@H](NC(=O)Nc1cccc2c1CN(c1nccs1)C2)[C@H](c1ccccc1)N(C)C ZINC000479082263 894346666 /nfs/dbraw/zinc/34/66/66/894346666.db2.gz ASMSWDJUWMCICP-IIBYNOLFSA-N 0 3 421.570 4.476 20 0 HIADHN CC1CCN([C@H](CNC(=O)C2CCC(OC(F)F)CC2)c2cccs2)CC1 ZINC000505174718 913863083 /nfs/dbraw/zinc/86/30/83/913863083.db2.gz KJVGCRPHAOMSAV-OFLPRAFFSA-N 0 3 400.535 4.435 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)Nc1ccc(O[C@H]2CCCC[C@@H]2O)cc1 ZINC000505204699 913882322 /nfs/dbraw/zinc/88/23/22/913882322.db2.gz PFIRQSBXAMONHS-UNMCSNQZSA-N 0 3 408.498 4.429 20 0 HIADHN C[C@H]1CN(Cc2cccc(CN[C@H]3CCCc4nn(-c5ccccc5)cc43)c2)CCO1 ZINC000479344125 894637293 /nfs/dbraw/zinc/63/72/93/894637293.db2.gz AWHJVMKLOMWVSE-CPJSRVTESA-N 0 3 416.569 4.260 20 0 HIADHN CNS(=O)(=O)c1ccc([C@@H](C)N[C@@H]2CCCc3cc(Br)ccc32)cc1 ZINC000479344510 894638951 /nfs/dbraw/zinc/63/89/51/894638951.db2.gz KZZWESAIKGSLFJ-BFUOFWGJSA-N 0 3 423.376 4.085 20 0 HIADHN C[C@H](Cc1ccccc1F)N[C@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479354647 894651269 /nfs/dbraw/zinc/65/12/69/894651269.db2.gz CKJBITIOWQHPRJ-GHMZBOCLSA-N 0 3 405.322 4.062 20 0 HIADHN C[C@@H](NCCCOC1CCCCC1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479366214 894666695 /nfs/dbraw/zinc/66/66/95/894666695.db2.gz WSDAXDKDRQNNQO-GFCCVEGCSA-N 0 3 409.379 4.031 20 0 HIADHN CCS(=O)(=O)c1c(Cl)cccc1CNCC[C@@H](C)N(C)Cc1ccccc1 ZINC000479422300 894734279 /nfs/dbraw/zinc/73/42/79/894734279.db2.gz KNKPMTGAATXIBV-QGZVFWFLSA-N 0 3 408.995 4.134 20 0 HIADHN CCS(=O)(=O)c1c(Cl)cccc1CNCC[C@H](C)N(C)Cc1ccccc1 ZINC000479422298 894734861 /nfs/dbraw/zinc/73/48/61/894734861.db2.gz KNKPMTGAATXIBV-KRWDZBQOSA-N 0 3 408.995 4.134 20 0 HIADHN Cn1nc(CCNCc2nc(-c3cccc(Br)c3)c[nH]2)c2ccccc21 ZINC000479431517 894746545 /nfs/dbraw/zinc/74/65/45/894746545.db2.gz ZRPVLPXYZNPOKD-UHFFFAOYSA-N 0 3 410.319 4.058 20 0 HIADHN CCC(CC)[C@@H]1C[C@@H](N[C@@H](C)c2cc(S(N)(=O)=O)c(Cl)cc2Cl)CCO1 ZINC000479434356 894748224 /nfs/dbraw/zinc/74/82/24/894748224.db2.gz DJHDLGXWINDNCA-BNLOLNQZSA-N 0 3 423.406 4.275 20 0 HIADHN C[C@@H]1CCCN(S(=O)(=O)c2ccc(CN[C@H]3CCc4ccc(F)cc43)cc2)C1 ZINC000479433051 894748336 /nfs/dbraw/zinc/74/83/36/894748336.db2.gz XOIUUBJOSDUEKM-ZHRRBRCNSA-N 0 3 402.535 4.023 20 0 HIADHN COc1c(Br)cccc1CNC[C@H](C)c1nc(-c2ccccc2)no1 ZINC000479442267 894756638 /nfs/dbraw/zinc/75/66/38/894756638.db2.gz XEVATNJYBPXTJR-ZDUSSCGKSA-N 0 3 402.292 4.401 20 0 HIADHN C[C@H]1CCc2ccc(Br)cc2[C@@H](NCC2(S(C)(=O)=O)CCC2)C1 ZINC000479488206 894809513 /nfs/dbraw/zinc/80/95/13/894809513.db2.gz IKDWVVKURBDVMR-GUYCJALGSA-N 0 3 400.382 4.020 20 0 HIADHN CCN(CC)Cc1ccccc1CNCc1cccc(Cl)c1S(=O)(=O)CC ZINC000479583081 894872532 /nfs/dbraw/zinc/87/25/32/894872532.db2.gz VLIAEGVBXQAPMU-UHFFFAOYSA-N 0 3 408.995 4.265 20 0 HIADHN CCc1nc2c(s1)[C@H](N(C)C(=O)N[C@H]1C[C@@H](C)N(Cc3ccccc3)C1)CCC2 ZINC000479734011 895032784 /nfs/dbraw/zinc/03/27/84/895032784.db2.gz HLEKRPXYHDNIFU-IMFGXOCKSA-N 0 3 412.603 4.387 20 0 HIADHN COc1ccc(CCN[C@@H](C)c2ccccc2I)cc1OC ZINC000479775279 895077317 /nfs/dbraw/zinc/07/73/17/895077317.db2.gz RZCMDROGRHUCKY-ZDUSSCGKSA-N 0 3 411.283 4.202 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N[C@H](C)c1ccc(NC(=O)C2CC2)cc1)c1ccco1 ZINC000479789349 895091819 /nfs/dbraw/zinc/09/18/19/895091819.db2.gz QTQQTNBZYWFDMT-YRNRMSPPSA-N 0 3 412.534 4.118 20 0 HIADHN COc1cc2c(cc1OC)CN(C(=O)CN[C@@H](c1ccc(Cl)cc1)C(C)C)CC2 ZINC000505286591 913944264 /nfs/dbraw/zinc/94/42/64/913944264.db2.gz CVQUBPYVWDNOKP-HSZRJFAPSA-N 0 3 416.949 4.229 20 0 HIADHN COc1ccc([C@@H](C)NCc2ccc(CN3CCOCC3)cc2)cc1Br ZINC000479879519 895223073 /nfs/dbraw/zinc/22/30/73/895223073.db2.gz KODGJEXMSCJCIK-MRXNPFEDSA-N 0 3 419.363 4.141 20 0 HIADHN Cc1c([C@@H](C)NCc2ccc(CN3CCOCC3)cc2)cnn1-c1cc(C)ccc1C ZINC000479888991 895234866 /nfs/dbraw/zinc/23/48/66/895234866.db2.gz UXGLVZDCLPPOQV-OAQYLSRUSA-N 0 3 418.585 4.481 20 0 HIADHN COc1ccc([C@H](CN[C@H](C)c2ccc(F)cc2Cl)N2CCOCC2)cc1OC ZINC000479890604 895237677 /nfs/dbraw/zinc/23/76/77/895237677.db2.gz VRODHPJFTLYUDI-QRWLVFNGSA-N 0 3 422.928 4.220 20 0 HIADHN Fc1cc(Br)cc2c1CC[C@H]2NCc1ccccc1CN1CCOCC1 ZINC000479892421 895239663 /nfs/dbraw/zinc/23/96/63/895239663.db2.gz TXYBRSKUDIHKSX-OAQYLSRUSA-N 0 3 419.338 4.198 20 0 HIADHN O=C(c1ccc(C2CCC2)cc1)N1CCC[C@H](CN2CCN(c3ccccn3)CC2)C1 ZINC000479945484 895300295 /nfs/dbraw/zinc/30/02/95/895300295.db2.gz ZBJWHHWWJOCKKR-OAQYLSRUSA-N 0 3 418.585 4.024 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3CCC[C@@H](C(F)(F)F)[C@H]3C)c(C)c2)CC1 ZINC000479966101 895319783 /nfs/dbraw/zinc/31/97/83/895319783.db2.gz QTUSEUHFWXNXJF-SJLPKXTDSA-N 0 3 412.500 4.332 20 0 HIADHN CC[C@H](c1ccccc1)[C@H]1CCCN1Cc1nc2cc(C(=O)OC)ccc2c(=O)[nH]1 ZINC000480041636 895390335 /nfs/dbraw/zinc/39/03/35/895390335.db2.gz FHZLHVGYUNENSB-WIYYLYMNSA-N 0 3 405.498 4.280 20 0 HIADHN COc1ccc([C@H](CN[C@@H](C)c2nnn(-c3ccccc3)c2C)N2CCCC2)cc1 ZINC000480079860 895434988 /nfs/dbraw/zinc/43/49/88/895434988.db2.gz DTJDHKPWMGSTGH-MBSDFSHPSA-N 0 3 405.546 4.072 20 0 HIADHN Cc1ccc([C@H](C)CN[C@H]2CCS(=O)(=O)c3ccc(Br)cc32)cc1 ZINC000480147779 895529579 /nfs/dbraw/zinc/52/95/79/895529579.db2.gz LCLPGAJPTOIQBQ-KDOFPFPSSA-N 0 3 408.361 4.369 20 0 HIADHN Cc1c(C(F)(F)F)nn(C)c1NC(=O)NC[C@H](c1ccc(C)cc1)N1CCCC1 ZINC000480162833 895552144 /nfs/dbraw/zinc/55/21/44/895552144.db2.gz RJGNWCGYCZPGOY-MRXNPFEDSA-N 0 3 409.456 4.014 20 0 HIADHN CC(C)C1CCC(N[C@@H]2CCS(=O)(=O)c3ccc(Br)cc32)CC1 ZINC000480187786 895582722 /nfs/dbraw/zinc/58/27/22/895582722.db2.gz CGAZWQMFSCGDLG-PUJMQQBBSA-N 0 3 400.382 4.472 20 0 HIADHN CC(C)CC1(CN[C@@H]2CCS(=O)(=O)c3ccc(Br)cc32)CCC1 ZINC000480207424 895609562 /nfs/dbraw/zinc/60/95/62/895609562.db2.gz DPQZYHCKEOITPR-MRXNPFEDSA-N 0 3 400.382 4.474 20 0 HIADHN CC[C@H](Cc1ccccc1)N[C@@H]1CCS(=O)(=O)c2ccc(Br)cc21 ZINC000480206573 895610007 /nfs/dbraw/zinc/61/00/07/895610007.db2.gz ACMAJNHWBFSWMI-SJLPKXTDSA-N 0 3 408.361 4.279 20 0 HIADHN COCc1ccc(CN[C@@H]2CCCOc3ccc(I)cc32)cc1 ZINC000480237797 895646914 /nfs/dbraw/zinc/64/69/14/895646914.db2.gz ZGWSPWHGRXISTP-GOSISDBHSA-N 0 3 423.294 4.441 20 0 HIADHN COc1cc(F)c([C@H](C)NCc2ccc(CN3C[C@@H](C)O[C@H](C)C3)cc2)cc1OC ZINC000480247238 895658633 /nfs/dbraw/zinc/65/86/33/895658633.db2.gz ZSQGOZCJWFTPQQ-KURKYZTESA-N 0 3 416.537 4.303 20 0 HIADHN C[C@H](Cc1ccccc1F)N[C@H]1CCS(=O)(=O)c2ccc(Br)cc21 ZINC000480258863 895668609 /nfs/dbraw/zinc/66/86/09/895668609.db2.gz SQFKTUUQCZEKKJ-PXAZEXFGSA-N 0 3 412.324 4.028 20 0 HIADHN Cc1cc([C@@H]2CN(C(=O)N[C@@H](CN3CCCC3)c3ccccc3)CCO2)ccc1F ZINC000480264416 895672374 /nfs/dbraw/zinc/67/23/74/895672374.db2.gz YIGYABBPFUJMML-GOTSBHOMSA-N 0 3 411.521 4.054 20 0 HIADHN CC(C)Cc1ccc([C@H](CNC(=O)Nc2ccc(-c3ncn(C)n3)cc2)N(C)C)cc1 ZINC000480271865 895678989 /nfs/dbraw/zinc/67/89/89/895678989.db2.gz UWQSPKLUJVUVFM-QFIPXVFZSA-N 0 3 420.561 4.105 20 0 HIADHN CC[C@@H](N[C@@H](C)c1ccc(S(=O)(=O)N2CCOCC2)cc1)c1ccc(Cl)cc1 ZINC000480283612 895688669 /nfs/dbraw/zinc/68/86/69/895688669.db2.gz OOPDTAAVOVZCSQ-HRAATJIYSA-N 0 3 422.978 4.163 20 0 HIADHN NC(=O)[C@H](CNCc1cc(Br)c(Cl)s1)Cc1ccccc1Cl ZINC000480305422 895709410 /nfs/dbraw/zinc/70/94/10/895709410.db2.gz FRGHGMBHRULCLL-JTQLQIEISA-N 0 3 422.175 4.251 20 0 HIADHN O=S1(=O)CC[C@H](NC[C@@H]2CCCc3ccccc32)c2cc(Br)ccc21 ZINC000480327032 895729755 /nfs/dbraw/zinc/72/97/55/895729755.db2.gz LWJPAFDXVSCGCF-KXBFYZLASA-N 0 3 420.372 4.377 20 0 HIADHN Brc1ccc(CN[C@@H]2CCN(c3ccccc3Br)C2)o1 ZINC000480339900 895744414 /nfs/dbraw/zinc/74/44/14/895744414.db2.gz WGKMZFWPXVFUEA-LLVKDONJSA-N 0 3 400.114 4.173 20 0 HIADHN Cc1nn(-c2ccccc2)cc1NC(=O)NC[C@H](c1ccc(OC(C)C)cc1)N(C)C ZINC000480361689 895767291 /nfs/dbraw/zinc/76/72/91/895767291.db2.gz CFSCOBBQIFEUOJ-HSZRJFAPSA-N 0 3 421.545 4.392 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)[C@@H](C)c2c(C)nn(CC(F)(F)F)c2C)N(C)C)cc1 ZINC000480399487 895803558 /nfs/dbraw/zinc/80/35/58/895803558.db2.gz XFQIZCQVRZPJLM-IFXJQAMLSA-N 0 3 424.511 4.147 20 0 HIADHN CN(CCNC(=O)Cc1csc(Cc2cccc(Cl)c2)n1)Cc1ccccc1 ZINC000480457499 895843900 /nfs/dbraw/zinc/84/39/00/895843900.db2.gz BFRBCBVMBJCMGZ-UHFFFAOYSA-N 0 3 413.974 4.178 20 0 HIADHN Cc1ccc([C@@H](CN2CCOCC2)N[C@@H](C)c2ccc(NC(=O)NC(C)C)cc2)cc1 ZINC000480458410 895845098 /nfs/dbraw/zinc/84/50/98/895845098.db2.gz CUMRSPKDZIXIHI-GBXCKJPGSA-N 0 3 424.589 4.249 20 0 HIADHN C[C@@H](c1ccccc1Cl)N1CCN(CC2CCN(C(=O)C(C)(C)C)CC2)CC1 ZINC000480513256 895879973 /nfs/dbraw/zinc/87/99/73/895879973.db2.gz QBIAEEGYSXRZRM-SFHVURJKSA-N 0 3 406.014 4.303 20 0 HIADHN COc1ccc(C(=O)N2CC[C@@H](CN(C)Cc3cccnc3)C2)c(OC2CCCC2)c1 ZINC000480528404 895891880 /nfs/dbraw/zinc/89/18/80/895891880.db2.gz QPAGGBSUHVDJRW-FQEVSTJZSA-N 0 3 423.557 4.006 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)NCc1cc(Br)ccc1F)c1ccco1 ZINC000480594535 895958028 /nfs/dbraw/zinc/95/80/28/895958028.db2.gz IHBXIYFJBIMOQO-MLGOLLRUSA-N 0 3 412.303 4.110 20 0 HIADHN CCNC(=O)c1ccc(CN[C@H](CCCOC)c2ccc(Br)cc2)cc1 ZINC000480616082 895982207 /nfs/dbraw/zinc/98/22/07/895982207.db2.gz WAAXOMBZTNSQLV-HXUWFJFHSA-N 0 3 419.363 4.456 20 0 HIADHN CCS(=O)(=O)Nc1ccc([C@@H](C)NCc2cccc(OCC(F)(F)F)c2)cc1 ZINC000480618819 895985862 /nfs/dbraw/zinc/98/58/62/895985862.db2.gz YKMIHCMQCTUMNR-CQSZACIVSA-N 0 3 416.465 4.240 20 0 HIADHN C[C@H](NCc1ccc(N2C[C@@H](C)O[C@@H](C)C2)nc1)c1ccc(OC(F)(F)F)cc1 ZINC000480622699 895990870 /nfs/dbraw/zinc/99/08/70/895990870.db2.gz WAUUNWLFCWKWBR-XHSDSOJGSA-N 0 3 409.452 4.445 20 0 HIADHN C[C@@H](NCc1ccc(N2C[C@@H](C)O[C@@H](C)C2)nc1)c1cccc(OC(F)(F)F)c1 ZINC000480623897 895992781 /nfs/dbraw/zinc/99/27/81/895992781.db2.gz XRWPTRVUBZAUPX-OWCLPIDISA-N 0 3 409.452 4.445 20 0 HIADHN CC[C@H](NCc1ccc(N2CCO[C@@H](C)C2)nc1)c1ccc(Br)cc1 ZINC000480629216 895997644 /nfs/dbraw/zinc/99/76/44/895997644.db2.gz DKFOXWJEPMRUPF-KXBFYZLASA-N 0 3 404.352 4.310 20 0 HIADHN O=S(=O)(Cc1ccc(Cl)c(F)c1)NC1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1 ZINC000480633189 896003833 /nfs/dbraw/zinc/00/38/33/896003833.db2.gz DFPPAMYESGRXRB-YQQQUEKLSA-N 0 3 422.953 4.094 20 0 HIADHN CCN1CCN(c2ccc(CNCc3ccc(-c4cccc(F)c4F)o3)cn2)CC1 ZINC000480637922 896007137 /nfs/dbraw/zinc/00/71/37/896007137.db2.gz GJCOEPLWJMXRGN-UHFFFAOYSA-N 0 3 412.484 4.052 20 0 HIADHN Cc1nc(-c2cccnc2)sc1[C@H](C)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)nc1 ZINC000480643734 896012573 /nfs/dbraw/zinc/01/25/73/896012573.db2.gz OWVUXWASNJIPBE-ULQDDVLXSA-N 0 3 423.586 4.373 20 0 HIADHN COc1ccc(-c2cc(C(=O)Nc3nc(CN4CCC(C)CC4)cs3)[nH]n2)cc1 ZINC000480672471 896036913 /nfs/dbraw/zinc/03/69/13/896036913.db2.gz HJQILMPWMRGPGK-UHFFFAOYSA-N 0 3 411.531 4.026 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)N1CCC[C@@H]1c1ccc2c(c1)OCO2 ZINC000480690138 896051954 /nfs/dbraw/zinc/05/19/54/896051954.db2.gz ZXGJMAYBGCUFHN-NHCUHLMSSA-N 0 3 407.514 4.099 20 0 HIADHN Cc1ccc(I)cc1NC1CCN(CCC(F)(F)F)CC1 ZINC000480695981 896058487 /nfs/dbraw/zinc/05/84/87/896058487.db2.gz SIEXKYAOECZNEM-UHFFFAOYSA-N 0 3 412.237 4.428 20 0 HIADHN COCCOc1ccc([C@H](C)N[C@@H](C)c2cccc(N3CCCC3=O)c2)cc1OC ZINC000480713555 896073988 /nfs/dbraw/zinc/07/39/88/896073988.db2.gz XQXVFXVDFVKFOX-ROUUACIJSA-N 0 3 412.530 4.259 20 0 HIADHN C[C@H](NCc1ccc(N2CCCCC2)nc1)c1ccc(OCc2nccn2C)cc1 ZINC000480740997 896102564 /nfs/dbraw/zinc/10/25/64/896102564.db2.gz YBAKRDILFLARCD-IBGZPJMESA-N 0 3 405.546 4.235 20 0 HIADHN COc1cc(F)c([C@H](C)NCCCNc2ccc(C(F)(F)F)cn2)cc1OC ZINC000480741820 896103542 /nfs/dbraw/zinc/10/35/42/896103542.db2.gz AWUSHDNAPUAYEJ-LBPRGKRZSA-N 0 3 401.404 4.410 20 0 HIADHN C[C@@H](NCc1ccc(N2CCCCC2)nc1)c1ccc(OCc2nccn2C)cc1 ZINC000480740998 896103618 /nfs/dbraw/zinc/10/36/18/896103618.db2.gz YBAKRDILFLARCD-LJQANCHMSA-N 0 3 405.546 4.235 20 0 HIADHN C[C@@H]1CN(C(=O)Nc2ccc(SC3CCCC3)cc2)CC[C@@H]1N1CCN(C)CC1 ZINC000480806643 896174288 /nfs/dbraw/zinc/17/42/88/896174288.db2.gz NGVOUVIFXSWUQV-GCJKJVERSA-N 0 3 416.635 4.211 20 0 HIADHN Brc1ccc2nc(CN[C@@H](c3ccc4c(c3)OCCO4)C3CC3)[nH]c2c1 ZINC000480887986 896245115 /nfs/dbraw/zinc/24/51/15/896245115.db2.gz GQKSKNDLCKIICL-HXUWFJFHSA-N 0 3 414.303 4.338 20 0 HIADHN C[C@H](NCCCS(=O)(=O)Cc1ccccc1)c1ccccc1OC(F)(F)F ZINC000480901848 896257473 /nfs/dbraw/zinc/25/74/73/896257473.db2.gz RHKCNPAWGUTPOQ-HNNXBMFYSA-N 0 3 401.450 4.241 20 0 HIADHN CCS(=O)(=O)Nc1ccc([C@@H](C)NCc2ccccc2OCC(F)(F)F)cc1 ZINC000480904034 896259675 /nfs/dbraw/zinc/25/96/75/896259675.db2.gz FQBRNHANGFWWHQ-CQSZACIVSA-N 0 3 416.465 4.240 20 0 HIADHN COc1cc(CN[C@H](Cc2cccc(F)c2)c2cccc(F)c2)ccc1OCCO ZINC000480907058 896264025 /nfs/dbraw/zinc/26/40/25/896264025.db2.gz YSCSFXRYNMJDLG-JOCHJYFZSA-N 0 3 413.464 4.418 20 0 HIADHN C[C@H](NCc1cccc(COc2ccccc2)c1)c1cccc(NS(C)(=O)=O)c1 ZINC000480921225 896279074 /nfs/dbraw/zinc/27/90/74/896279074.db2.gz PGHBSMYKLLHKRK-SFHVURJKSA-N 0 3 410.539 4.488 20 0 HIADHN Cc1nc(-c2cccnc2)sc1[C@@H](C)NCCCS(=O)(=O)Cc1ccccc1 ZINC000480923355 896280560 /nfs/dbraw/zinc/28/05/60/896280560.db2.gz ZMXMADZSFFKAEV-MRXNPFEDSA-N 0 3 415.584 4.169 20 0 HIADHN C[C@H](NC[C@H](c1ccccc1)N1CCC(C)CC1)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000481053136 896376097 /nfs/dbraw/zinc/37/60/97/896376097.db2.gz ZPDTZRSSUBGROM-PGRDOPGGSA-N 0 3 418.578 4.353 20 0 HIADHN C[C@@H](NC(C)(C)CNS(=O)(=O)c1ccc(CC(F)(F)F)cc1)c1ccccc1 ZINC000481055764 896378001 /nfs/dbraw/zinc/37/80/01/896378001.db2.gz TWTJLGKUJUDMDX-OAHLLOKOSA-N 0 3 414.493 4.199 20 0 HIADHN COc1ccc2ccccc2c1-c1cc(CN2CCC[C@@H](Cn3ccnn3)C2)on1 ZINC000481076601 896395515 /nfs/dbraw/zinc/39/55/15/896395515.db2.gz PAPJBCGGKGGJDA-QGZVFWFLSA-N 0 3 403.486 4.007 20 0 HIADHN CC(=O)N[C@@H](C)C1CCN(Cc2c(-c3ccc(Cl)cc3)nc3sccn23)CC1 ZINC000481157298 896490518 /nfs/dbraw/zinc/49/05/18/896490518.db2.gz VBTJBTOBSOOQGX-AWEZNQCLSA-N 0 3 416.978 4.453 20 0 HIADHN CNS(=O)(=O)c1ccc([C@H](C)N[C@@H]2C[C@H](C)c3c2cccc3Br)cc1 ZINC000481176994 896512923 /nfs/dbraw/zinc/51/29/23/896512923.db2.gz PIYZYWLFBHSQQK-ZJNRKIDTSA-N 0 3 423.376 4.256 20 0 HIADHN CNS(=O)(=O)c1ccc([C@H](C)N[C@H](C)c2csc(-c3csc(C)n3)c2)cc1 ZINC000481180360 896516863 /nfs/dbraw/zinc/51/68/63/896516863.db2.gz XHYTWFUOIWRVHI-QWHCGFSZSA-N 0 3 421.613 4.500 20 0 HIADHN COc1cc([C@@H](C)N[C@H](C)c2ccc(F)c(Br)c2)ccc1OCCO ZINC000481195909 896548576 /nfs/dbraw/zinc/54/85/76/896548576.db2.gz YJRBSZCXSPJCGU-CHWSQXEVSA-N 0 3 412.299 4.380 20 0 HIADHN Cc1c([C@H](C)NCCCS(=O)(=O)c2ccccc2)cnn1-c1cccc(Cl)c1 ZINC000481237419 896586545 /nfs/dbraw/zinc/58/65/45/896586545.db2.gz CIQULXRRBWBLJY-INIZCTEOSA-N 0 3 417.962 4.349 20 0 HIADHN CCOc1cc(CN2CC[C@@H](C(N)=O)C2)ccc1OCc1c(Cl)cccc1Cl ZINC000505415870 914080441 /nfs/dbraw/zinc/08/04/41/914080441.db2.gz PWHSFNABQQOURB-OAHLLOKOSA-N 0 3 423.340 4.278 20 0 HIADHN CN1CCN(c2ncccc2CN[C@H]2CCCOc3c(Cl)c(Cl)ccc32)CC1 ZINC000481246763 896598927 /nfs/dbraw/zinc/59/89/27/896598927.db2.gz QZKHPPCGFPNCLA-SFHVURJKSA-N 0 3 421.372 4.144 20 0 HIADHN COc1cccc([C@@H](CNC(=O)Nc2ccc(OCC(F)F)cc2)N2CCCC2)c1 ZINC000481269625 896618084 /nfs/dbraw/zinc/61/80/84/896618084.db2.gz RXNLYVHWFYLCIS-HXUWFJFHSA-N 0 3 419.472 4.298 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)NCc1cnc(-c2ccc(Cl)cc2)s1 ZINC000505419246 914084197 /nfs/dbraw/zinc/08/41/97/914084197.db2.gz CTOHSXWZPJBWLV-UHFFFAOYSA-N 0 3 418.950 4.330 20 0 HIADHN C[C@@H](N[C@H](C)c1cccc(OC(F)F)c1)c1ccc(OCC(=O)NC2CC2)cc1 ZINC000481293660 896638100 /nfs/dbraw/zinc/63/81/00/896638100.db2.gz HYHMYRVIHGPUDM-HUUCEWRRSA-N 0 3 404.457 4.357 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(OCC(=O)NC2CC2)cc1)c1cccc(OC(F)F)c1 ZINC000481293661 896638384 /nfs/dbraw/zinc/63/83/84/896638384.db2.gz HYHMYRVIHGPUDM-LSDHHAIUSA-N 0 3 404.457 4.357 20 0 HIADHN COc1ccc(Oc2cc(CN[C@H](C)c3ccc(-n4cncn4)cc3)ccn2)cc1 ZINC000481298376 896641464 /nfs/dbraw/zinc/64/14/64/896641464.db2.gz HJQJJMSABHBLCO-QGZVFWFLSA-N 0 3 401.470 4.314 20 0 HIADHN COCCN1CCC(NC(=O)N(Cc2ccccc2)[C@H](C)c2cccs2)CC1 ZINC000481299122 896643531 /nfs/dbraw/zinc/64/35/31/896643531.db2.gz DNFUSCRAGNWOGI-GOSISDBHSA-N 0 3 401.576 4.132 20 0 HIADHN COc1ccc([C@@H](C)NCc2ccnc(N3CCN(c4ccc(F)cc4)CC3)c2)cc1 ZINC000481319816 896672605 /nfs/dbraw/zinc/67/26/05/896672605.db2.gz HCDVHUBSIDIBGJ-LJQANCHMSA-N 0 3 420.532 4.407 20 0 HIADHN Fc1cc(Br)cc2c1CC[C@H]2NCc1cccc(CN2CCOCC2)c1 ZINC000481319822 896673525 /nfs/dbraw/zinc/67/35/25/896673525.db2.gz HDKGLHGQOXAQKD-OAQYLSRUSA-N 0 3 419.338 4.198 20 0 HIADHN CC[C@H](N[C@@H]1CCc2ccc(OC)cc21)c1ccccc1OCC(=O)N1CCCC1 ZINC000481336065 896697778 /nfs/dbraw/zinc/69/77/78/896697778.db2.gz MEXWEJCGGRSZGB-XZOQPEGZSA-N 0 3 408.542 4.425 20 0 HIADHN COc1cc(C)c(NC(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)cc1F ZINC000481412713 896817048 /nfs/dbraw/zinc/81/70/48/896817048.db2.gz STIPUODKTVEJAH-FQEVSTJZSA-N 0 3 403.498 4.354 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1nnc(-c2ccc(OC)cc2)s1)c1ccco1 ZINC000481486670 896867883 /nfs/dbraw/zinc/86/78/83/896867883.db2.gz RJNFYCVLPCRBHU-XJKSGUPXSA-N 0 3 415.519 4.058 20 0 HIADHN C[C@@H](NC[C@@H](O)COc1cccc(Cl)c1Cl)c1cnn(Cc2ccccc2)c1 ZINC000481546048 896906807 /nfs/dbraw/zinc/90/68/07/896906807.db2.gz KSEKAZAVBOEUGF-CRAIPNDOSA-N 0 3 420.340 4.329 20 0 HIADHN COCCOc1ccc([C@@H](C)NCc2ccc(-n3ccnc3C)c(F)c2)cc1OC ZINC000481558129 896931222 /nfs/dbraw/zinc/93/12/22/896931222.db2.gz CEDHEZDERQSTGK-MRXNPFEDSA-N 0 3 413.493 4.204 20 0 HIADHN C[C@@H](NCc1cc2c(c(Br)c1)OCO2)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000481579448 896959746 /nfs/dbraw/zinc/95/97/46/896959746.db2.gz WAOQWUDVEGNWRM-LLVKDONJSA-N 0 3 417.303 4.258 20 0 HIADHN CN(C)Cc1cccc(NC(=O)N[C@H]2CCN(c3ccc(Cl)c(Cl)c3)C2)c1 ZINC000481623365 897007664 /nfs/dbraw/zinc/00/76/64/897007664.db2.gz IRHQYUJYRKVASY-INIZCTEOSA-N 0 3 407.345 4.455 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)Nc1cc(Cl)cc(C(F)(F)F)c1 ZINC000481624365 897007812 /nfs/dbraw/zinc/00/78/12/897007812.db2.gz DLBIJDDYXOIVKE-UHFFFAOYSA-N 0 3 400.832 4.350 20 0 HIADHN Cc1cc(NC(=O)c2ccc(NC(=O)C3CC3)cc2)cc(N2CCN(C(C)C)CC2)c1 ZINC000481677506 897060842 /nfs/dbraw/zinc/06/08/42/897060842.db2.gz NXYCNSJCTRQSMT-UHFFFAOYSA-N 0 3 420.557 4.126 20 0 HIADHN CCOC(=O)C[C@](C)(NCc1ccnc(-c2ccc(Br)cc2)n1)C(C)C ZINC000481716445 897109827 /nfs/dbraw/zinc/10/98/27/897109827.db2.gz GTYWYPOXRBXTGT-FQEVSTJZSA-N 0 3 420.351 4.364 20 0 HIADHN C[C@H](N[C@@H]1CCCc2cc(OC(F)F)ccc21)c1cccc(NS(C)(=O)=O)c1 ZINC000481733551 897126929 /nfs/dbraw/zinc/12/69/29/897126929.db2.gz HYDOMGWAAFXXLJ-ORAYPTAESA-N 0 3 410.486 4.388 20 0 HIADHN CCc1ccc(-c2nc(CC(=O)N[C@H]3CN(C)C[C@@H]3c3ccccc3)cs2)cc1 ZINC000481753142 897143715 /nfs/dbraw/zinc/14/37/15/897143715.db2.gz GWTHRNYRYQKQFE-YADHBBJMSA-N 0 3 405.567 4.129 20 0 HIADHN CCc1ccc(-c2nc(CC(=O)N[C@H]3CN(C)C[C@H]3c3ccccc3)cs2)cc1 ZINC000481753141 897144112 /nfs/dbraw/zinc/14/41/12/897144112.db2.gz GWTHRNYRYQKQFE-VXKWHMMOSA-N 0 3 405.567 4.129 20 0 HIADHN Cc1nc(-c2ccccc2C)sc1C(=O)N(CCN(C)C)Cc1cccc(O)c1 ZINC000481817937 897191753 /nfs/dbraw/zinc/19/17/53/897191753.db2.gz UIYMFVXGPAPQIM-UHFFFAOYSA-N 0 3 409.555 4.337 20 0 HIADHN CCCCN(C)C(=O)C1CCN(Cc2ccc(-c3ccccc3C(=O)OC)o2)CC1 ZINC000481904382 897285166 /nfs/dbraw/zinc/28/51/66/897285166.db2.gz JVIVUDQUVSUGNH-UHFFFAOYSA-N 0 3 412.530 4.204 20 0 HIADHN Cc1cc(C(=O)Nc2cc(C)cc(N3CCN(C(C)C)CC3)c2)nn1[C@H](C)C1CC1 ZINC000482013177 897412903 /nfs/dbraw/zinc/41/29/03/897412903.db2.gz FSMQFQKGKMYFSC-LJQANCHMSA-N 0 3 409.578 4.254 20 0 HIADHN CC(=O)N1CCN(c2ccccc2CN[C@@H](C)c2cccc(C(F)(F)F)c2)CC1 ZINC000482024311 897430852 /nfs/dbraw/zinc/43/08/52/897430852.db2.gz FFTSIVHPMGOLKJ-INIZCTEOSA-N 0 3 405.464 4.225 20 0 HIADHN Cc1nn(C(C)(C)C)cc1[C@H](C)NCCC(=O)Nc1ccc(Br)cc1 ZINC000482045500 897466811 /nfs/dbraw/zinc/46/68/11/897466811.db2.gz RRECVYOIUSLPQO-ZDUSSCGKSA-N 0 3 407.356 4.388 20 0 HIADHN Cc1cc(NC(=O)c2cn(C)nc2-c2ccccc2)cc(N2CCN(C(C)C)CC2)c1 ZINC000482047945 897470703 /nfs/dbraw/zinc/47/07/03/897470703.db2.gz WCIFBGRDNYKDII-UHFFFAOYSA-N 0 3 417.557 4.178 20 0 HIADHN CCC[C@H](N[C@@H](C)c1ccc2c(c1)OCO2)C(=O)Nc1cccc(N2CCCC2)c1 ZINC000482047957 897471264 /nfs/dbraw/zinc/47/12/64/897471264.db2.gz WEGXYZQUIHTZHY-UWJYYQICSA-N 0 3 409.530 4.474 20 0 HIADHN C[C@@H](C(=O)NCCCCN1CCN(c2ccccc2)CC1)c1cc2ccccc2o1 ZINC000482056105 897483357 /nfs/dbraw/zinc/48/33/57/897483357.db2.gz RKPAIHXNWQKCIA-HXUWFJFHSA-N 0 3 405.542 4.255 20 0 HIADHN COc1cc([C@@H](C)NC2CC(F)(c3cccc(Cl)c3)C2)ccc1S(C)(=O)=O ZINC000482068463 897502527 /nfs/dbraw/zinc/50/25/27/897502527.db2.gz LRJQTMFNEVIRMR-HVSQPAOISA-N 0 3 411.926 4.430 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)Nc1cnn(-c2ccc(Cl)cc2)c1 ZINC000482082342 897521677 /nfs/dbraw/zinc/52/16/77/897521677.db2.gz OQPMZKWAGUPFEF-UHFFFAOYSA-N 0 3 415.900 4.261 20 0 HIADHN C[C@@H]1CCN(C(=O)NC[C@H]2CCO[C@@H]2c2ccccc2)CCN1Cc1ccccc1 ZINC000482089117 897531447 /nfs/dbraw/zinc/53/14/47/897531447.db2.gz OLNHDEUYOZDCMT-AGILITTLSA-N 0 3 407.558 4.070 20 0 HIADHN C[C@@H](N[C@H](Cc1ccccc1)C(=O)N1CCCC1)c1cccc(OC(F)(F)F)c1 ZINC000482109606 897560118 /nfs/dbraw/zinc/56/01/18/897560118.db2.gz LPOFKPSXFVHUPC-OXQOHEQNSA-N 0 3 406.448 4.470 20 0 HIADHN COc1cc([C@@H](C)NCc2ccc(NC(=O)c3cccnc3)cc2)cc(OC)c1OC ZINC000482113036 897563033 /nfs/dbraw/zinc/56/30/33/897563033.db2.gz WXKPEBRTMHCZHA-MRXNPFEDSA-N 0 3 421.497 4.211 20 0 HIADHN C[C@@H](NCc1ccc(NC(=O)c2ccncc2)cc1)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000482114037 897564875 /nfs/dbraw/zinc/56/48/75/897564875.db2.gz KNZQOJKHKXBYQB-MRXNPFEDSA-N 0 3 414.509 4.414 20 0 HIADHN COc1cc([C@@H](C)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)ccc1OC(F)F ZINC000482124344 897581078 /nfs/dbraw/zinc/58/10/78/897581078.db2.gz ROLVCMSWIWCHFZ-APWZRJJASA-N 0 3 418.484 4.181 20 0 HIADHN C[C@@H](NCc1ccc(OCC2CC2)nc1)c1ccc(I)cc1 ZINC000482135091 897594426 /nfs/dbraw/zinc/59/44/26/897594426.db2.gz MMMAUWWNHGKLDK-CYBMUJFWSA-N 0 3 408.283 4.326 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)N[C@@H](c1ccc(F)cc1)C(F)(F)F ZINC000482143114 897603998 /nfs/dbraw/zinc/60/39/98/897603998.db2.gz NDBFFLHBJFOLMC-INIZCTEOSA-N 0 3 403.445 4.264 20 0 HIADHN C[C@H]1C[C@H](NCCC(=O)N2CCN(c3ccccc3)CC2)c2ccsc2S1 ZINC000482149819 897612117 /nfs/dbraw/zinc/61/21/17/897612117.db2.gz WNEXSTAABGYCIJ-LPHOPBHVSA-N 0 3 401.601 4.002 20 0 HIADHN Cc1cc(F)c(Br)cc1NC(=O)N[C@H](CN(C)C)c1ccc(F)cc1 ZINC000482159796 897622851 /nfs/dbraw/zinc/62/28/51/897622851.db2.gz QLWUCYJOQZVIJU-QGZVFWFLSA-N 0 3 412.278 4.460 20 0 HIADHN CCc1c(NC(=O)N[C@H](CN(C)C)c2ccc(F)cc2)cnn1-c1ccccc1C ZINC000482238910 897719763 /nfs/dbraw/zinc/71/97/63/897719763.db2.gz KNTNLFZPMMLRMU-HXUWFJFHSA-N 0 3 409.509 4.307 20 0 HIADHN C[C@@H](N[C@@H](C)c1cccc(-c2ccncc2)c1)c1cccc(S(=O)(=O)N(C)C)c1 ZINC000482249028 897731595 /nfs/dbraw/zinc/73/15/95/897731595.db2.gz YEZONIFSGLHSGE-ZWKOTPCHSA-N 0 3 409.555 4.411 20 0 HIADHN COC(=O)c1ccc(Cl)c(CNCCCc2nc(-c3ccc(F)cc3)no2)c1 ZINC000482256541 897738482 /nfs/dbraw/zinc/73/84/82/897738482.db2.gz YCZCZQVEPZKXNZ-UHFFFAOYSA-N 0 3 403.841 4.038 20 0 HIADHN CCCN(Cc1ccccc1OCC(=O)N1CCCC1)[C@H]1CCCc2cccnc21 ZINC000482279177 897768922 /nfs/dbraw/zinc/76/89/22/897768922.db2.gz ZPKPMQRIIQJVAY-QFIPXVFZSA-N 0 3 407.558 4.372 20 0 HIADHN COc1cc([C@@H](C)NCc2cc(C)cc3c(C)c(C)[nH]c32)ccc1S(C)(=O)=O ZINC000482327472 897829400 /nfs/dbraw/zinc/82/94/00/897829400.db2.gz OMOSMRAECTWKAY-MRXNPFEDSA-N 0 3 400.544 4.356 20 0 HIADHN O=C(Nc1ccc(C(=O)NCCN2CCCC2)cc1)c1ccc(Oc2ccccc2)o1 ZINC000482331286 897835577 /nfs/dbraw/zinc/83/55/77/897835577.db2.gz VYYRLBXLNQYQNA-UHFFFAOYSA-N 0 3 419.481 4.150 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)C[C@H](c2ccccc2)C(F)(F)F)c1 ZINC000482351129 897864983 /nfs/dbraw/zinc/86/49/83/897864983.db2.gz NWFVEHANZHZPDJ-HXUWFJFHSA-N 0 3 408.464 4.322 20 0 HIADHN CN(C)[C@H](CNC(=O)N[C@@H](c1c(F)cccc1F)C(F)(F)F)c1ccccc1 ZINC000482404294 897945276 /nfs/dbraw/zinc/94/52/76/897945276.db2.gz MLBLCCDSKXXSNG-WBVHZDCISA-N 0 3 401.379 4.170 20 0 HIADHN Cc1c2cc(C)ccc2[nH]c1C(=O)Nc1ccc(C(=O)N(C)[C@@H]2CCCN(C)C2)cc1 ZINC000482416685 897965043 /nfs/dbraw/zinc/96/50/43/897965043.db2.gz ROBGLOKGGYTZMB-HXUWFJFHSA-N 0 3 418.541 4.203 20 0 HIADHN Cc1cccc(NC(=O)[C@H]2CCCN(Cc3ccc(OCC(F)(F)F)cc3)C2)n1 ZINC000505519219 914209659 /nfs/dbraw/zinc/20/96/59/914209659.db2.gz IXVOQOWUFPSPEF-KRWDZBQOSA-N 0 3 407.436 4.182 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)N[C@H](c1cccc(F)c1F)C(F)(F)F ZINC000482456727 898027422 /nfs/dbraw/zinc/02/74/22/898027422.db2.gz RHMKPSONARIUGM-MRXNPFEDSA-N 0 3 421.435 4.403 20 0 HIADHN CC(C)c1nn(-c2ccccc2)cc1CN1CCC(c2nnc3n2CCCC3)CC1 ZINC000482494935 898073715 /nfs/dbraw/zinc/07/37/15/898073715.db2.gz MMSZYOJQVLOJRJ-UHFFFAOYSA-N 0 3 404.562 4.303 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)Nc3cc(F)ccc3OCC3CC3)cc2)CC1 ZINC000482496267 898076014 /nfs/dbraw/zinc/07/60/14/898076014.db2.gz OJEBUCGRBMZUAF-UHFFFAOYSA-N 0 3 411.521 4.397 20 0 HIADHN COc1ccc([C@@H](C)N[C@H](C)c2cc(F)ccc2N2CCN(C)CC2)c(OC)c1 ZINC000482551204 898142265 /nfs/dbraw/zinc/14/22/65/898142265.db2.gz QOSCVKHTIMUYMC-IAGOWNOFSA-N 0 3 401.526 4.007 20 0 HIADHN COc1cc(C)c([C@H](C)N[C@H](C)c2cc(F)ccc2N2CCN(C)CC2)cc1OC ZINC000482567956 898162554 /nfs/dbraw/zinc/16/25/54/898162554.db2.gz UODLPAZRUVAURR-ZWKOTPCHSA-N 0 3 415.553 4.315 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@@H](C)N[C@H](C)c2ccc(OC)cc2OC)CC1 ZINC000482570413 898165770 /nfs/dbraw/zinc/16/57/70/898165770.db2.gz WNNIAMORQMADQT-QZTJIDSGSA-N 0 3 415.553 4.397 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)c1nnn(-c2cccc(F)c2)c1C(F)(F)F ZINC000482581999 898178836 /nfs/dbraw/zinc/17/88/36/898178836.db2.gz DWNCHWVIRDXVCV-UHFFFAOYSA-N 0 3 421.398 4.048 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)[C@H]1CCN(c2cc(Cl)ccc2Cl)C1=O ZINC000482581830 898178990 /nfs/dbraw/zinc/17/89/90/898178990.db2.gz DLTULSUCXZKUQO-MRXNPFEDSA-N 0 3 420.340 4.355 20 0 HIADHN C[C@@H](CNC(=O)Nc1ccc2c(c1)CCC(=O)N2CC1CC1)N(C)Cc1ccccc1 ZINC000482613692 898215450 /nfs/dbraw/zinc/21/54/50/898215450.db2.gz DGADBJDJDRYPHY-SFHVURJKSA-N 0 3 420.557 4.018 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)[C@@H](NC(=O)c1ccccc1Cl)C(C)C ZINC000482615818 898216415 /nfs/dbraw/zinc/21/64/15/898216415.db2.gz JPJUZUCYZVPQLZ-FQEVSTJZSA-N 0 3 401.938 4.103 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)N1CCC[C@@]2(C1)OCc1ccccc12 ZINC000482632364 898235794 /nfs/dbraw/zinc/23/57/94/898235794.db2.gz QGIIZNGKIYOGDA-NOZRDPDXSA-N 0 3 405.542 4.055 20 0 HIADHN CN1C(=O)C[C@H](NCc2ccc(OCc3cccnc3)cc2)[C@@H]1c1ccc(F)c(F)c1 ZINC000482698078 898297386 /nfs/dbraw/zinc/29/73/86/898297386.db2.gz YEQXINGJTQTELP-UPVQGACJSA-N 0 3 423.463 4.000 20 0 HIADHN CC(C)(C)c1nn(Cc2ccccc2)cc1CNCc1cccc(-n2cncn2)c1 ZINC000482756689 898363268 /nfs/dbraw/zinc/36/32/68/898363268.db2.gz XKLPYBUFDGANCX-UHFFFAOYSA-N 0 3 400.530 4.099 20 0 HIADHN CC(C)c1nn(-c2ccc(Br)cc2)cc1CNCC[C@@H](C)[S@](C)=O ZINC000482787013 898395414 /nfs/dbraw/zinc/39/54/14/898395414.db2.gz IXFWJTNMWAMEKZ-SHACYNPGSA-N 0 3 412.397 4.005 20 0 HIADHN O=C(NCc1cc(-c2ccccc2)no1)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000505553743 914256733 /nfs/dbraw/zinc/25/67/33/914256733.db2.gz PWQROOCOOJQDTF-FQEVSTJZSA-N 0 3 411.452 4.115 20 0 HIADHN NC(=O)c1ccc(NC(=O)CCN2CCCC[C@H]2c2ccc(F)cc2)cc1Cl ZINC000482907776 898526260 /nfs/dbraw/zinc/52/62/60/898526260.db2.gz YWELXEXNVJDOOC-IBGZPJMESA-N 0 3 403.885 4.134 20 0 HIADHN O=C1NC2(CCCCC2)C(=O)N1Cc1ccccc1CN[C@H]1CCc2c1cccc2F ZINC000482951492 898579633 /nfs/dbraw/zinc/57/96/33/898579633.db2.gz BDUCDBSXTREQFL-QFIPXVFZSA-N 0 3 421.516 4.358 20 0 HIADHN C[C@@H](NCc1ccnc(OC2CCOCC2)c1)c1ccc(OCC(F)(F)F)cc1 ZINC000482961928 898591503 /nfs/dbraw/zinc/59/15/03/898591503.db2.gz PFWLUXFOGHRJNQ-OAHLLOKOSA-N 0 3 410.436 4.431 20 0 HIADHN C[C@@H](NC[C@@H](O)Cc1ccccc1C(F)(F)F)c1ccc(Br)cn1 ZINC000482964581 898595874 /nfs/dbraw/zinc/59/58/74/898595874.db2.gz RZYAUSJCRCGNIW-RISCZKNCSA-N 0 3 403.242 4.117 20 0 HIADHN C[C@@H]1Cc2ccccc2[C@H]1NCc1ccccc1CN1C(=O)NC2(CCCCC2)C1=O ZINC000482968012 898600445 /nfs/dbraw/zinc/60/04/45/898600445.db2.gz ZGCLXXISYNDFRV-JPYJTQIMSA-N 0 3 417.553 4.464 20 0 HIADHN COc1c(Br)c(C)sc1C(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C ZINC000505573825 914281059 /nfs/dbraw/zinc/28/10/59/914281059.db2.gz FDIORYQSMDAXDX-XHDPSFHLSA-N 0 3 411.365 4.249 20 0 HIADHN C[C@@H](NC(=O)Cc1c[nH]c2cc(Br)ccc12)[C@@H](c1ccccc1)N(C)C ZINC000505574454 914281320 /nfs/dbraw/zinc/28/13/20/914281320.db2.gz JGINVYHCMPBMQC-SZNDQCEHSA-N 0 3 414.347 4.281 20 0 HIADHN COCCOc1ccc(C(F)(F)F)cc1NC(=O)CN(C)[C@H]1CCC(C)(C)C1 ZINC000483120915 898809065 /nfs/dbraw/zinc/80/90/65/898809065.db2.gz UYAQRPJPMRHQIZ-HNNXBMFYSA-N 0 3 402.457 4.180 20 0 HIADHN COc1ccc([C@H](C)N[C@H](Cc2ccccc2)[C@H](O)C(F)F)cc1Br ZINC000483125888 898810753 /nfs/dbraw/zinc/81/07/53/898810753.db2.gz JWKNFPPZKLAJGW-XZOAIXRZSA-N 0 3 414.290 4.346 20 0 HIADHN COCC[C@](C)(O)CN[C@@H](Cc1ccccc1F)c1ccccc1Br ZINC000483138638 898818457 /nfs/dbraw/zinc/81/84/57/898818457.db2.gz WQBSCMZEFJKYLT-PMACEKPBSA-N 0 3 410.327 4.249 20 0 HIADHN COc1ccc(S(=O)(=O)Nc2cccc(CN[C@@H](C)c3ccsc3)c2)cc1 ZINC000483144920 898823774 /nfs/dbraw/zinc/82/37/74/898823774.db2.gz SIYSJFSXEMSHJC-HNNXBMFYSA-N 0 3 402.541 4.408 20 0 HIADHN COCCNS(=O)(=O)c1cccc(CN[C@@H](C)c2cccc(-c3ccccc3)c2)c1 ZINC000483185729 898847096 /nfs/dbraw/zinc/84/70/96/898847096.db2.gz SANAUNWCXMLVBE-IBGZPJMESA-N 0 3 424.566 4.129 20 0 HIADHN CCOCCOCc1cccc(NC(=O)N2CCN(C3CCCCC3)CC2)c1C ZINC000483211895 898861692 /nfs/dbraw/zinc/86/16/92/898861692.db2.gz ICTDDLOBHACOHI-UHFFFAOYSA-N 0 3 403.567 4.030 20 0 HIADHN OC[C@H](NC[C@H](O)C1CCCCC1)c1ccc(Br)cc1C(F)(F)F ZINC000483247453 898890147 /nfs/dbraw/zinc/89/01/47/898890147.db2.gz XFQYGEBFLJMLHZ-HOTGVXAUSA-N 0 3 410.274 4.032 20 0 HIADHN CCCOc1ccc(C(C)(C)NCC(=O)N(C)Cc2ccc(OC)c(F)c2)cc1 ZINC000483269748 898909272 /nfs/dbraw/zinc/90/92/72/898909272.db2.gz MZNXWPDCMDLUAR-UHFFFAOYSA-N 0 3 402.510 4.106 20 0 HIADHN C[C@@H](NC(=O)NCc1ccccc1OCC(F)(F)F)[C@@H](c1ccccc1)N(C)C ZINC000483276571 898913166 /nfs/dbraw/zinc/91/31/66/898913166.db2.gz NZEUHMFYMLNBDQ-BEFAXECRSA-N 0 3 409.452 4.118 20 0 HIADHN COc1ccc(-c2cc(C(=O)N3C[C@@H](SC)[C@@H](N4CCCC4)C3)sc2C)cc1 ZINC000483390737 899024455 /nfs/dbraw/zinc/02/44/55/899024455.db2.gz CUYZRNKLNGKTCL-PZJWPPBQSA-N 0 3 416.612 4.384 20 0 HIADHN COc1ccc(-c2cc(C(=O)N3C[C@@H](SC)[C@H](N4CCCC4)C3)sc2C)cc1 ZINC000483390738 899024747 /nfs/dbraw/zinc/02/47/47/899024747.db2.gz CUYZRNKLNGKTCL-TZIWHRDSSA-N 0 3 416.612 4.384 20 0 HIADHN CO[C@H](c1ccccc1Cl)[C@@H](C)NC(=O)N(CCN(C)C)Cc1cccs1 ZINC000483415363 899045850 /nfs/dbraw/zinc/04/58/50/899045850.db2.gz WIQKHCHIGXOQGM-BEFAXECRSA-N 0 3 409.983 4.251 20 0 HIADHN C[C@H](NC(=O)C1CCN(c2nc3ccccc3s2)CC1)[C@H](c1ccccc1)N(C)C ZINC000505602847 914309011 /nfs/dbraw/zinc/30/90/11/914309011.db2.gz AJQRGYZPHMWRPH-HTAPYJJXSA-N 0 3 422.598 4.320 20 0 HIADHN CO[C@H](c1ccccc1Cl)[C@@H](C)NC(=O)N(Cc1ccco1)C1CCN(C)CC1 ZINC000483418503 899048425 /nfs/dbraw/zinc/04/84/25/899048425.db2.gz NZBMTEJURBCJRF-IERDGZPVSA-N 0 3 419.953 4.315 20 0 HIADHN Cc1noc(C)c1COc1cccc(C(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)c1 ZINC000505606191 914309742 /nfs/dbraw/zinc/30/97/42/914309742.db2.gz GQDOTVYWMMFOIK-SBUREZEXSA-N 0 3 407.514 4.292 20 0 HIADHN Cc1cc(NC(=O)c2ccco2)sc1C(=O)N[C@H](C)[C@H](c1ccccc1)N(C)C ZINC000505605943 914309915 /nfs/dbraw/zinc/30/99/15/914309915.db2.gz JDQCNDRQEKUTJP-DNVCBOLYSA-N 0 3 411.527 4.323 20 0 HIADHN Cc1cc(NC(=O)c2ccco2)sc1C(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C ZINC000505605947 914310285 /nfs/dbraw/zinc/31/02/85/914310285.db2.gz JDQCNDRQEKUTJP-KXBFYZLASA-N 0 3 411.527 4.323 20 0 HIADHN Cc1sc2ncnc(SCC(=O)N[C@@H](C)[C@H](c3ccccc3)N(C)C)c2c1C ZINC000505609153 914313678 /nfs/dbraw/zinc/31/36/78/914313678.db2.gz KHSVJLMICLWVGT-IFXJQAMLSA-N 0 3 414.600 4.208 20 0 HIADHN C[C@@H](NC(=O)[C@@H]1CCO[C@H]1c1ccc(Cl)c(F)c1)[C@@H](c1ccccc1)N(C)C ZINC000505615253 914317488 /nfs/dbraw/zinc/31/74/88/914317488.db2.gz VTSAEYWXTRCVST-LPNJYYIDSA-N 0 3 404.913 4.364 20 0 HIADHN COc1cc(CN[C@@H](C)c2ccc(OCc3nccn3C)cc2)c2ccccc2n1 ZINC000483541769 899203891 /nfs/dbraw/zinc/20/38/91/899203891.db2.gz HXXDKYLCSRIDNP-KRWDZBQOSA-N 0 3 402.498 4.407 20 0 HIADHN CCOCCC1(CNC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)CCC1 ZINC000483575520 899229239 /nfs/dbraw/zinc/22/92/39/899229239.db2.gz QOHTZPVUXCLDQN-OAQYLSRUSA-N 0 3 412.496 4.154 20 0 HIADHN C[C@H](NC(=O)c1c[nH]nc1-c1cccc(OC(F)F)c1)[C@H](c1ccccc1)N(C)C ZINC000505629436 914328718 /nfs/dbraw/zinc/32/87/18/914328718.db2.gz IIMCAFNIDDDLBC-VBKZILBWSA-N 0 3 414.456 4.099 20 0 HIADHN COc1ccccc1-c1noc([C@H](C)N[C@H]2C[C@H](C)CN(Cc3ccccc3)C2)n1 ZINC000483645567 899301933 /nfs/dbraw/zinc/30/19/33/899301933.db2.gz ASQRQWCWNSJGMG-BJLQDIEVSA-N 0 3 406.530 4.306 20 0 HIADHN C[C@@](CO)(CNCc1nc(-c2ccc(Br)cc2)c[nH]1)Cc1ccccc1 ZINC000483650937 899308418 /nfs/dbraw/zinc/30/84/18/899308418.db2.gz YUHHMZJMSJCOCC-NRFANRHFSA-N 0 3 414.347 4.170 20 0 HIADHN CCOc1ccccc1[C@H](CC(C)C)N[C@@H](C)c1ccc(S(=O)(=O)NC)cc1 ZINC000483706632 899360927 /nfs/dbraw/zinc/36/09/27/899360927.db2.gz CUPGXASGZWMDDV-UWJYYQICSA-N 0 3 404.576 4.431 20 0 HIADHN C[C@H](NC(=O)c1cccc(C(=O)N(C)CC(C)(C)C)c1)[C@H](c1ccccc1)N(C)C ZINC000505638732 914339582 /nfs/dbraw/zinc/33/95/82/914339582.db2.gz VCKROYKVLRUUCP-PGRDOPGGSA-N 0 3 409.574 4.226 20 0 HIADHN C[C@H](N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1=O)c1ccc2c(c1)COC2 ZINC000483709573 899364053 /nfs/dbraw/zinc/36/40/53/899364053.db2.gz FSSHANZCTUJAIP-XOBRGWDASA-N 0 3 402.441 4.164 20 0 HIADHN CC[C@@H]1Oc2cc([C@H](C)N[C@H](C)c3cccc(N4CCOCC4)c3)ccc2NC1=O ZINC000483858726 899542275 /nfs/dbraw/zinc/54/22/75/899542275.db2.gz MJQSDRMMFBBGKM-JLHGSKIFSA-N 0 3 409.530 4.045 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)NC[C@H](CC)N2CCc3ccccc3C2)cc1 ZINC000505668378 914365892 /nfs/dbraw/zinc/36/58/92/914365892.db2.gz ZFCOKIUMYJXOIY-MBSDFSHPSA-N 0 3 422.573 4.173 20 0 HIADHN CC[C@@H](C)NC(=O)c1ccc(NC(=O)NC[C@@H](CC)N2CCc3ccccc3C2)cc1 ZINC000505668379 914366291 /nfs/dbraw/zinc/36/62/91/914366291.db2.gz ZFCOKIUMYJXOIY-WZONZLPQSA-N 0 3 422.573 4.173 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)NC[C@H]1CCCC[C@H]1C(F)(F)F ZINC000484048931 899679910 /nfs/dbraw/zinc/67/99/10/899679910.db2.gz VZVMJLUVDRJEMN-HZPDHXFCSA-N 0 3 421.454 4.407 20 0 HIADHN CSc1cccc(N(C(=O)c2ccn(Cc3ccccc3)n2)C2CCN(C)CC2)c1 ZINC000484049330 899681581 /nfs/dbraw/zinc/68/15/81/899681581.db2.gz SPSPPFBKFORZFB-UHFFFAOYSA-N 0 3 420.582 4.394 20 0 HIADHN C[C@H](N[C@@H](CCCO)c1ccccc1)c1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000484135435 899756928 /nfs/dbraw/zinc/75/69/28/899756928.db2.gz QJCDEINTPIXZRO-CVDCTZTESA-N 0 3 416.587 4.026 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N(C)Cc1ccccc1-c1ccccc1 ZINC000484170015 899789138 /nfs/dbraw/zinc/78/91/38/899789138.db2.gz CYYYUDDNCOHSEE-UHFFFAOYSA-N 0 3 415.537 4.321 20 0 HIADHN CSc1cccc(N(C(=O)c2cc(C)nc3onc(C)c32)C2CCN(C)CC2)c1 ZINC000484288848 899854137 /nfs/dbraw/zinc/85/41/37/899854137.db2.gz ABWNAYKPSJFALC-UHFFFAOYSA-N 0 3 410.543 4.303 20 0 HIADHN CC(C)[C@@](C)(NCc1cc(=O)n2ccccc2n1)c1ccc(Br)cc1 ZINC000484329111 899883175 /nfs/dbraw/zinc/88/31/75/899883175.db2.gz KPMLWPUHFHWLKE-HXUWFJFHSA-N 0 3 400.320 4.118 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2cc(C)n(-c3ccc(C)cc3)n2)c1 ZINC000484345944 899895898 /nfs/dbraw/zinc/89/58/98/899895898.db2.gz QPQHALOUROLBGY-UHFFFAOYSA-N 0 3 421.545 4.093 20 0 HIADHN COc1ccc(O[C@@H](C)C(=O)N(c2cccc(SC)c2)C2CCN(C)CC2)cc1 ZINC000484413997 899933441 /nfs/dbraw/zinc/93/34/41/899933441.db2.gz ZDLSKNSQHYCAOB-KRWDZBQOSA-N 0 3 414.571 4.312 20 0 HIADHN O[C@@H](CN[C@@H]1CCCc2nc(-c3ccc(Br)cc3)sc21)C(F)F ZINC000484469013 899962470 /nfs/dbraw/zinc/96/24/70/899962470.db2.gz CSWICZODKJGFKS-YPMHNXCESA-N 0 3 403.292 4.166 20 0 HIADHN Cc1ccc(NC(=O)C[C@H](C)NCC(=O)N2CCC(Cc3ccccc3)CC2)c(C)c1 ZINC000484481952 899974375 /nfs/dbraw/zinc/97/43/75/899974375.db2.gz XINYPIKMJZIXOL-NRFANRHFSA-N 0 3 421.585 4.091 20 0 HIADHN CC[C@H](CN[C@H](C)c1cccc(S(=O)(=O)N(C)C)c1)Oc1ccccc1Cl ZINC000484483705 899975885 /nfs/dbraw/zinc/97/58/85/899975885.db2.gz AQQDMPWLTUIWGU-NVXWUHKLSA-N 0 3 410.967 4.099 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2cnn(CC(C)C)c2C(C)C)c1 ZINC000484491378 899982860 /nfs/dbraw/zinc/98/28/60/899982860.db2.gz LDFUHVZBNHLPBC-UHFFFAOYSA-N 0 3 415.582 4.267 20 0 HIADHN C[C@H](N[C@@H]1CCN(C(=O)CCc2ccccc2)C1)c1ccc(F)cc1OC(F)F ZINC000484501921 899992755 /nfs/dbraw/zinc/99/27/55/899992755.db2.gz MVBLTGHRCKHRRJ-MAUKXSAKSA-N 0 3 406.448 4.311 20 0 HIADHN CC(C)n1cc([C@@H](C)N[C@@H]2CCN(c3ncc(C(F)(F)F)cc3Cl)C2)cn1 ZINC000484523628 900011510 /nfs/dbraw/zinc/01/15/10/900011510.db2.gz VVHYJGZRJPDGDC-IUODEOHRSA-N 0 3 401.864 4.461 20 0 HIADHN CC(C)([C@H](NC[C@@H](O)COc1ccccc1F)c1ccc(F)c(F)c1)N1CCCC1 ZINC000484527220 900014627 /nfs/dbraw/zinc/01/46/27/900014627.db2.gz ATXPHKJHITXFCK-VGOFRKELSA-N 0 3 422.491 4.049 20 0 HIADHN O=[S@](CCN[C@H](Cn1cnc2ccccc21)c1ccc(F)cc1)c1ccccc1 ZINC000484557520 900033504 /nfs/dbraw/zinc/03/35/04/900033504.db2.gz VHKRFMWGFDJZPH-KPURRNSFSA-N 0 3 407.514 4.314 20 0 HIADHN C[C@H](N[C@H]1CCN(c2c(F)cccc2F)C1)c1ccc(-n2cncn2)cc1Cl ZINC000484623029 900076523 /nfs/dbraw/zinc/07/65/23/900076523.db2.gz QQNWSQRGGCBIHF-KBPBESRZSA-N 0 3 403.864 4.128 20 0 HIADHN Brc1ccccc1-n1nnnc1CN[C@H]1CCCC[C@@H]1c1ccccc1 ZINC000484633620 900083003 /nfs/dbraw/zinc/08/30/03/900083003.db2.gz AHQQMYPXXSMWBR-AEFFLSMTSA-N 0 3 412.335 4.241 20 0 HIADHN CCc1nc(C2CCN([C@H](C)C(=O)N[C@H](C)c3ccc(Cl)cc3Cl)CC2)n[nH]1 ZINC000484740625 900164112 /nfs/dbraw/zinc/16/41/12/900164112.db2.gz NUYKFAZIIJQUMP-CHWSQXEVSA-N 0 3 424.376 4.119 20 0 HIADHN CCc1n[nH]c(C2CCN([C@H](C)C(=O)N[C@H](C)c3ccc(Cl)cc3Cl)CC2)n1 ZINC000484740625 900164117 /nfs/dbraw/zinc/16/41/17/900164117.db2.gz NUYKFAZIIJQUMP-CHWSQXEVSA-N 0 3 424.376 4.119 20 0 HIADHN CCc1nnc(C2CCN([C@H](C)C(=O)N[C@H](C)c3ccc(Cl)cc3Cl)CC2)[nH]1 ZINC000484740625 900164124 /nfs/dbraw/zinc/16/41/24/900164124.db2.gz NUYKFAZIIJQUMP-CHWSQXEVSA-N 0 3 424.376 4.119 20 0 HIADHN CCOc1cc(CNC(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)ccc1OC(F)F ZINC000484764335 900179540 /nfs/dbraw/zinc/17/95/40/900179540.db2.gz PSCDGOSAOVIILC-FOIQADDNSA-N 0 3 421.488 4.177 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)Nc1ccnn1C(C)(C)C ZINC000484783967 900193067 /nfs/dbraw/zinc/19/30/67/900193067.db2.gz LVZUIOIFQKKNHC-UHFFFAOYSA-N 0 3 411.472 4.253 20 0 HIADHN CCc1c(NC(=O)N[C@H](C)C2=CCN(C)CC2)cnn1-c1ccc(C(F)(F)F)cc1 ZINC000484812902 900216008 /nfs/dbraw/zinc/21/60/08/900216008.db2.gz NIZXXMNCSKYPEC-CQSZACIVSA-N 0 3 421.467 4.225 20 0 HIADHN Cc1cc(C)c(NC(=O)CCCN2CCCN(C(=O)c3ccccc3)CC2)c(C)c1 ZINC000484984664 900341251 /nfs/dbraw/zinc/34/12/51/900341251.db2.gz GFVLJMQNIAMYSQ-UHFFFAOYSA-N 0 3 407.558 4.179 20 0 HIADHN C[C@H](NCC(=O)Nc1cc(S(C)(=O)=O)ccc1Cl)c1cccc2ccccc21 ZINC000485082617 900397876 /nfs/dbraw/zinc/39/78/76/900397876.db2.gz YQJPUHVSNSVKTL-AWEZNQCLSA-N 0 3 416.930 4.186 20 0 HIADHN C[C@@H](NCC(=O)Nc1cc(S(C)(=O)=O)ccc1Cl)c1cccc2ccccc21 ZINC000485082618 900398594 /nfs/dbraw/zinc/39/85/94/900398594.db2.gz YQJPUHVSNSVKTL-CQSZACIVSA-N 0 3 416.930 4.186 20 0 HIADHN CCOc1cc(CN2CCCC[C@@H]2Cc2ccccc2)nc2nc(C(F)(F)F)nn21 ZINC000485110156 900415803 /nfs/dbraw/zinc/41/58/03/900415803.db2.gz YINTUCAZIOZQTF-QGZVFWFLSA-N 0 3 419.451 4.139 20 0 HIADHN CCOc1cc(CN2CCCC[C@H]2Cc2ccccc2)nc2nc(C(F)(F)F)nn21 ZINC000485110153 900416320 /nfs/dbraw/zinc/41/63/20/900416320.db2.gz YINTUCAZIOZQTF-KRWDZBQOSA-N 0 3 419.451 4.139 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)Nc1cccc(Cl)c1Br ZINC000485233750 900518492 /nfs/dbraw/zinc/51/84/92/900518492.db2.gz ADVHEENFUIYJMR-UHFFFAOYSA-N 0 3 411.731 4.093 20 0 HIADHN CCC[C@@H](NCC(=O)Nc1cc(C(F)(F)F)ccc1-n1cncn1)c1ccccc1 ZINC000485287819 900566717 /nfs/dbraw/zinc/56/67/17/900566717.db2.gz PYRDIWYHYYSGME-QGZVFWFLSA-N 0 3 417.435 4.356 20 0 HIADHN CN(C)[C@@H](CNC(=O)Nc1ccc(Oc2ccccc2C(N)=O)cc1)c1ccccc1 ZINC000485369483 900667825 /nfs/dbraw/zinc/66/78/25/900667825.db2.gz GXCHIBSAOKMDNQ-NRFANRHFSA-N 0 3 418.497 4.002 20 0 HIADHN Cc1cccc(C)c1NC(=O)CCCN1CCCN(C(=O)CCc2ccccc2)CC1 ZINC000485401717 900701223 /nfs/dbraw/zinc/70/12/23/900701223.db2.gz GOUSVRJZTZMXQR-UHFFFAOYSA-N 0 3 421.585 4.189 20 0 HIADHN Cc1ccc(CCCCC(=O)Nc2ccc(C(=O)NCCN3CCCC3)cc2)cc1 ZINC000485477722 900771304 /nfs/dbraw/zinc/77/13/04/900771304.db2.gz SCLHJOUEBNZTTC-UHFFFAOYSA-N 0 3 407.558 4.172 20 0 HIADHN CC(C)c1ccc(CCC(=O)Nc2ccc(C(=O)NCCN3CCCC3)cc2)cc1 ZINC000485483137 900775029 /nfs/dbraw/zinc/77/50/29/900775029.db2.gz TWEZPKVSFUEGJW-UHFFFAOYSA-N 0 3 407.558 4.207 20 0 HIADHN CC[C@@H](C)[C@H](C(=O)Nc1ccc(C(=O)NCCN2CCCC2)cc1)c1ccccc1 ZINC000485521832 900805061 /nfs/dbraw/zinc/80/50/61/900805061.db2.gz RWYMJRRQDSIRHY-XXBNENTESA-N 0 3 407.558 4.281 20 0 HIADHN Cc1cc(Br)ccc1CC(=O)NC1CCN([C@@H](C)c2ccncc2)CC1 ZINC000485569074 900838245 /nfs/dbraw/zinc/83/82/45/900838245.db2.gz MDGZMYWTWLDLGW-INIZCTEOSA-N 0 3 416.363 4.037 20 0 HIADHN CCOC(=O)c1cc(NC(=O)NC[C@H](N[C@H](C)CC)c2ccco2)c(F)cc1C ZINC000485572287 900840567 /nfs/dbraw/zinc/84/05/67/900840567.db2.gz CJJVSGSGXVTJJJ-KDOFPFPSSA-N 0 3 405.470 4.155 20 0 HIADHN O=C(N[C@H](c1ccccc1)c1cccnc1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000485604064 900863063 /nfs/dbraw/zinc/86/30/63/900863063.db2.gz UZNDENJUTZPOEA-ISKFKSNPSA-N 0 3 403.501 4.339 20 0 HIADHN C[C@@H](NC(=O)N1CCN(C2CCCCC2)CC1)c1cccc(OCc2ccccn2)c1 ZINC000485613104 900871314 /nfs/dbraw/zinc/87/13/14/900871314.db2.gz JTKLQWPMWFJCJV-HXUWFJFHSA-N 0 3 422.573 4.382 20 0 HIADHN COCCN1CCC(NC(=O)NCc2ccc(-c3ccc(Cl)cc3)cc2F)CC1 ZINC000485626992 900880968 /nfs/dbraw/zinc/88/09/68/900880968.db2.gz KFNILVPPWBXKME-UHFFFAOYSA-N 0 3 419.928 4.056 20 0 HIADHN C[C@@H]1CN(C(=O)c2ccc(-c3ccc(Cl)cc3)s2)CC[C@@H]1N1CCN(C)CC1 ZINC000485678324 900929336 /nfs/dbraw/zinc/92/93/36/900929336.db2.gz OQSNHIYKYCNVHR-APWZRJJASA-N 0 3 418.006 4.167 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCN1CCC(=O)Nc1ccccc1C(F)(F)F ZINC000485694786 900945175 /nfs/dbraw/zinc/94/51/75/900945175.db2.gz LMFONHROURVGDK-QGZVFWFLSA-N 0 3 405.464 4.240 20 0 HIADHN Cc1ccc(-c2ccc(C(=O)N3CC[C@@H](N4CCN(C)CC4)[C@H](C)C3)c(F)c2)cc1C ZINC000485783487 901037933 /nfs/dbraw/zinc/03/79/33/901037933.db2.gz HBWHHRRJWZUQPL-CJFMBICVSA-N 0 3 423.576 4.208 20 0 HIADHN C[C@H](NCCN1c2cccc3cccc(c23)S1(=O)=O)c1ccc2ncsc2c1 ZINC000485794933 901047547 /nfs/dbraw/zinc/04/75/47/901047547.db2.gz FRTODQZPUBGVNO-AWEZNQCLSA-N 0 3 409.536 4.309 20 0 HIADHN C[C@@H](c1ccc(N2CCCS2(=O)=O)cc1)N(C)Cc1ccccc1OC(F)F ZINC000485823602 901069636 /nfs/dbraw/zinc/06/96/36/901069636.db2.gz QTDRHRFZEVVEOG-HNNXBMFYSA-N 0 3 410.486 4.021 20 0 HIADHN CCN1CCCN(C(=O)c2ccc(Oc3cccc(Br)c3)cc2)CC1 ZINC000485937058 901159330 /nfs/dbraw/zinc/15/93/30/901159330.db2.gz GDXHPLKVSJUJLK-UHFFFAOYSA-N 0 3 403.320 4.409 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)c3scc(C)c3Br)c2)CC1 ZINC000485955800 901174292 /nfs/dbraw/zinc/17/42/92/901174292.db2.gz KTTWNUMNYOEJBL-UHFFFAOYSA-N 0 3 408.365 4.213 20 0 HIADHN CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)c1cncc(SCc2ccccc2)n1 ZINC000486008143 901219457 /nfs/dbraw/zinc/21/94/57/901219457.db2.gz PCZDOWZACPPXFE-REWPJTCUSA-N 0 3 405.571 4.293 20 0 HIADHN CCCOc1cn(-c2ccccc2)nc1C(=O)N(CCN(C)C)Cc1cccc(F)c1 ZINC000486040031 901241799 /nfs/dbraw/zinc/24/17/99/901241799.db2.gz CSMFGWGSLZYIIF-UHFFFAOYSA-N 0 3 424.520 4.004 20 0 HIADHN CC[C@@H](NC(=O)N1CCN(C2CCCCC2)CC1)c1nc(C(F)(F)F)cs1 ZINC000486088628 901277484 /nfs/dbraw/zinc/27/74/84/901277484.db2.gz CJKZBSPTIZZLHJ-CQSZACIVSA-N 0 3 404.502 4.273 20 0 HIADHN CC[C@@H](N[C@@H](C)c1ccc(-n2cnnn2)cc1)c1cc(F)cc(Br)c1 ZINC000486093717 901281061 /nfs/dbraw/zinc/28/10/61/901281061.db2.gz UWUZYWLAXGORKS-KPZWWZAWSA-N 0 3 404.287 4.366 20 0 HIADHN CN(C(=O)C[C@@H](c1ccccc1)C(F)(F)F)C1CCN(CCc2ccccn2)CC1 ZINC000486100153 901287534 /nfs/dbraw/zinc/28/75/34/901287534.db2.gz ZUFQZXDRVXTYLL-NRFANRHFSA-N 0 3 419.491 4.283 20 0 HIADHN COc1cccc(C(=O)c2c3c(sc2NC(=O)C2CCN(C4CC4)CC2)CCC3)c1 ZINC000486117045 901303379 /nfs/dbraw/zinc/30/33/79/901303379.db2.gz DRXNORFTOFMXMH-UHFFFAOYSA-N 0 3 424.566 4.289 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)c2cc3ccccc3n2CC(F)(F)F)o1 ZINC000486304737 901484120 /nfs/dbraw/zinc/48/41/20/901484120.db2.gz NDIBMVPINAWYGP-UHFFFAOYSA-N 0 3 407.436 4.309 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(F)cc2)CC1)c1cc2cc(Cl)sc2[nH]1 ZINC000486369656 901536621 /nfs/dbraw/zinc/53/66/21/901536621.db2.gz JRMRFVAQQMXPCY-UHFFFAOYSA-N 0 3 421.925 4.295 20 0 HIADHN COc1cccc(-c2cc(NC(=O)c3oc4ccccc4c3CN(C)C)n(C)n2)c1 ZINC000486428774 901588320 /nfs/dbraw/zinc/58/83/20/901588320.db2.gz DJSYNYOPRDUYJM-UHFFFAOYSA-N 0 3 404.470 4.156 20 0 HIADHN CC(=O)c1cc(C(=O)N2CC[C@@]3(C2)CCCN(Cc2ccccc2)C3)c(C)nc1C ZINC000486434685 901592656 /nfs/dbraw/zinc/59/26/56/901592656.db2.gz PORSGJGDAJMIRU-VWLOTQADSA-N 0 3 405.542 4.029 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)N[C@H]2CC(C)(C)Oc3cc(F)ccc32)o1 ZINC000486478793 901638185 /nfs/dbraw/zinc/63/81/85/901638185.db2.gz APZAYJHMCLNCOB-IBGZPJMESA-N 0 3 403.498 4.103 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)N[C@H](c2ccccc2)c2ccccn2)CC1 ZINC000486493349 901645941 /nfs/dbraw/zinc/64/59/41/901645941.db2.gz ZSMIXEKXJLVQRJ-RUZDIDTESA-N 0 3 414.553 4.477 20 0 HIADHN C[C@@H](Cc1cncc2ccccc21)C(=O)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000486566172 901711100 /nfs/dbraw/zinc/71/11/00/901711100.db2.gz OKULKLIKMMSGCT-SFHVURJKSA-N 0 3 403.526 4.009 20 0 HIADHN Cc1nn(C)c(C)c1[C@@H](C)C(=O)N[C@H](c1ccc(F)c(F)c1)C(C)(C)N1CCCC1 ZINC000486584707 901725123 /nfs/dbraw/zinc/72/51/23/901725123.db2.gz IBCNCDRXSHMUNE-SPLOXXLWSA-N 0 3 418.532 4.151 20 0 HIADHN COc1cc(-c2noc(CN3CC[C@@H](c4ccccc4)[C@H]3C)n2)cc(OC)c1OC ZINC000486812242 901870258 /nfs/dbraw/zinc/87/02/58/901870258.db2.gz YMGPRPBWXXAICY-CRAIPNDOSA-N 0 3 409.486 4.140 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3c(F)cccc3Br)c(C)c2)CC1 ZINC000486829762 901881502 /nfs/dbraw/zinc/88/15/02/901881502.db2.gz YFCYOGOSKAIHJK-UHFFFAOYSA-N 0 3 420.326 4.291 20 0 HIADHN CC(C)N(C(=O)[C@@H](C)N1C[C@H]2CCC[C@@]2(c2nc(-c3ccccc3)no2)C1)C(C)C ZINC000486844485 901891127 /nfs/dbraw/zinc/89/11/27/901891127.db2.gz KQPIMWHPDWRZIM-DRMXPCRNSA-N 0 3 410.562 4.124 20 0 HIADHN CC[C@@H]1CCCCN1C(=O)[C@@H](C)N1C[C@H]2CCC[C@@]2(c2nc(-c3ccccc3)no2)C1 ZINC000486851675 901896926 /nfs/dbraw/zinc/89/69/26/901896926.db2.gz BDVZVZLGAHEUJD-GUQHISFFSA-N 0 3 422.573 4.270 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)Nc3ncc(Cc4cccc(C(F)(F)F)c4)s3)[C@@H]2C1 ZINC000486858632 901903048 /nfs/dbraw/zinc/90/30/48/901903048.db2.gz BOPWLHDYAUWLEU-RHSMWYFYSA-N 0 3 424.492 4.311 20 0 HIADHN C[C@@H](NC(=O)N(CCN(C)C)Cc1ccc(F)c(F)c1)c1ccc2ncsc2c1 ZINC000486878624 901923372 /nfs/dbraw/zinc/92/33/72/901923372.db2.gz IQVUAYKDLQJGTC-CQSZACIVSA-N 0 3 418.513 4.409 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)Nc3nc(-c4cccc(C(F)(F)F)c4)cs3)[C@H]2C1 ZINC000486881431 901927232 /nfs/dbraw/zinc/92/72/32/901927232.db2.gz APNLAMHDXVBHQZ-WBMJQRKESA-N 0 3 410.465 4.387 20 0 HIADHN CN(C)Cc1ccccc1C(=O)NCc1ccc(Br)cc1C(F)(F)F ZINC000486893462 901935585 /nfs/dbraw/zinc/93/55/85/901935585.db2.gz KLXSVOVXIQWHKX-UHFFFAOYSA-N 0 3 415.253 4.460 20 0 HIADHN Cc1ccc(Cc2cnc(NC(=O)N3CC[C@H]4CCN(C)C[C@@H]43)s2)cc1Cl ZINC000486905219 901952507 /nfs/dbraw/zinc/95/25/07/901952507.db2.gz DSLHROJXFCKAKP-QAPCUYQASA-N 0 3 404.967 4.254 20 0 HIADHN CCOc1cc(CN2CCC(c3ccsc3)CC2)ccc1O[C@@H](C)C(=O)N(C)C ZINC000486923892 901965728 /nfs/dbraw/zinc/96/57/28/901965728.db2.gz ZXKXRKAVSJYRFZ-KRWDZBQOSA-N 0 3 416.587 4.382 20 0 HIADHN Cc1nc2cc(F)ccc2cc1C(=O)NCCCCN1CCN(c2ccccc2)CC1 ZINC000486981360 902002003 /nfs/dbraw/zinc/00/20/03/902002003.db2.gz BCPRLWFXWDNGEI-UHFFFAOYSA-N 0 3 420.532 4.015 20 0 HIADHN CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)Nc1ccc(C(=O)C2CCC2)cc1 ZINC000486990462 902005332 /nfs/dbraw/zinc/00/53/32/902005332.db2.gz PVCMZCLMBKCIJL-UNMCSNQZSA-N 0 3 406.530 4.221 20 0 HIADHN CC(C)([C@H](NC(=O)CCc1ccc(O)cc1)c1ccc(F)c(F)c1)N1CCCC1 ZINC000487083190 902050934 /nfs/dbraw/zinc/05/09/34/902050934.db2.gz JTMMFFJNFPRSIL-JOCHJYFZSA-N 0 3 402.485 4.335 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2c(F)cc(F)cc2Br)[C@@H]1c1ccccc1 ZINC000487193585 902096069 /nfs/dbraw/zinc/09/60/69/902096069.db2.gz HEEVNRBIBWUMBH-RDJZCZTQSA-N 0 3 410.262 4.294 20 0 HIADHN CCN1CCC[C@@H](CN(C)C(=O)c2cc3cc(Cl)sc3[nH]2)[C@@H]1c1cnn(C)c1 ZINC000487263479 902125850 /nfs/dbraw/zinc/12/58/50/902125850.db2.gz LHGYCASJDVYPLS-SCLBCKFNSA-N 0 3 419.982 4.162 20 0 HIADHN C[C@@H]1CN(C(=O)N[C@@H](CC2CCCCC2)C(C)(C)C)CC[C@@H]1N1CCN(C)CC1 ZINC000487295362 902139096 /nfs/dbraw/zinc/13/90/96/902139096.db2.gz WFGJAEJTARLYGD-HJNYFJLDSA-N 0 3 406.659 4.039 20 0 HIADHN Cc1nc(-c2ccc(C)cc2NC(=O)CN(Cc2ccccc2)[C@H](C)C2CC2)n[nH]1 ZINC000487412114 902195453 /nfs/dbraw/zinc/19/54/53/902195453.db2.gz JBHDWBNXUVHXCB-QGZVFWFLSA-N 0 3 403.530 4.328 20 0 HIADHN Fc1ccc(-c2nnc3n2C[C@H](NCc2cc(Br)ccc2F)CC3)cc1 ZINC000505946539 914601582 /nfs/dbraw/zinc/60/15/82/914601582.db2.gz JZNWXOWMTUUKBJ-MRXNPFEDSA-N 0 3 419.273 4.090 20 0 HIADHN COc1cc(-c2noc(CN3CCC[C@@H]3CCc3ccccc3)n2)cc(OC)c1OC ZINC000487414287 902196970 /nfs/dbraw/zinc/19/69/70/902196970.db2.gz PNSIAGLFRVSSTO-LJQANCHMSA-N 0 3 423.513 4.360 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)N[C@H]1CCC[C@@H](c2ccccc2)C1 ZINC000487417842 902200180 /nfs/dbraw/zinc/20/01/80/902200180.db2.gz WHVITRPPGKMLRV-QPPBQGQZSA-N 0 3 421.585 4.169 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)NCc2cccc3cccnc32)N(C)C)cc1 ZINC000487778661 902359723 /nfs/dbraw/zinc/35/97/23/902359723.db2.gz CPPGLGDTTLAWGT-JOCHJYFZSA-N 0 3 406.530 4.124 20 0 HIADHN COc1ccccc1CNC(=O)[C@H](C)N[C@H](C)c1ccc(Oc2cccnc2)cc1 ZINC000487937404 902467368 /nfs/dbraw/zinc/46/73/68/902467368.db2.gz XZKISVVQCLRVDX-MSOLQXFVSA-N 0 3 405.498 4.238 20 0 HIADHN CC(=O)N(c1nc(CN2CCN(C)[C@H](C(C)C)C2)cs1)c1ccc(C)c(C)c1 ZINC000487944740 902474414 /nfs/dbraw/zinc/47/44/14/902474414.db2.gz HUOGWINRTSDGOI-NRFANRHFSA-N 0 3 400.592 4.217 20 0 HIADHN C[C@@H]1CCN(C(=O)c2cccc(COC3CCOCC3)c2)CCN1Cc1ccccc1 ZINC000487952423 902480108 /nfs/dbraw/zinc/48/01/08/902480108.db2.gz CXSMDRVSQUIEQZ-OAQYLSRUSA-N 0 3 422.569 4.119 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCC1CC(F)(F)C1)c1ccc(C(F)(F)F)cc1 ZINC000488096454 902600712 /nfs/dbraw/zinc/60/07/12/902600712.db2.gz STXQUXMFDXBOPS-MRXNPFEDSA-N 0 3 407.427 4.433 20 0 HIADHN CCNC(=O)C1(CN[C@H](C)c2ccc(Br)cc2Br)CCC1 ZINC000488456471 902834167 /nfs/dbraw/zinc/83/41/67/902834167.db2.gz BAUGWGRPDZNRLT-LLVKDONJSA-N 0 3 418.173 4.169 20 0 HIADHN C[C@H](CCc1ccc2c(c1)OCO2)NCc1csc(-c2ccc3c(c2)OCO3)n1 ZINC000488458274 902835448 /nfs/dbraw/zinc/83/54/48/902835448.db2.gz MAQFAZCBDMFIGR-CQSZACIVSA-N 0 3 410.495 4.378 20 0 HIADHN CCN(C[C@H]1CCN(Cc2cncc(OCc3ccccc3)c2)C1)CC(F)(F)F ZINC000488467998 902840769 /nfs/dbraw/zinc/84/07/69/902840769.db2.gz XTFVXGRBQJIBCQ-LJQANCHMSA-N 0 3 407.480 4.367 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)NCCc2ccc3ccccc3n2)N(C)C)cc1 ZINC000488491786 902852713 /nfs/dbraw/zinc/85/27/13/902852713.db2.gz RQJPLAHPCYSQLG-DEOSSOPVSA-N 0 3 420.557 4.167 20 0 HIADHN Cc1c(C(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@H]2C)[nH]c2c1C(=O)CC(C)(C)C2 ZINC000488516556 902866257 /nfs/dbraw/zinc/86/62/57/902866257.db2.gz NLRACEUOCQHOQF-VQIMIIECSA-N 0 3 407.558 4.119 20 0 HIADHN Cc1nc(CCC(=O)Nc2cccc(CN3CCC(O)CC3)c2)oc1-c1ccccc1 ZINC000488663794 902925840 /nfs/dbraw/zinc/92/58/40/902925840.db2.gz YBFSPBCMQNXOLJ-UHFFFAOYSA-N 0 3 419.525 4.178 20 0 HIADHN C[C@H](CNC(=O)Nc1ccc(F)cc1OC1CCOCC1)N(C)Cc1ccccc1 ZINC000488675695 902937098 /nfs/dbraw/zinc/93/70/98/902937098.db2.gz XFOFLYOEIOKBFT-QGZVFWFLSA-N 0 3 415.509 4.026 20 0 HIADHN CC[N@H+](Cc1ccc(C(=O)NCc2ccc([O-])c(Br)c2)cc1)C(C)C ZINC000488683287 902943504 /nfs/dbraw/zinc/94/35/04/902943504.db2.gz DWXHDGXALZUXQY-UHFFFAOYSA-N 0 3 405.336 4.315 20 0 HIADHN CC[N@@H+](Cc1ccc(C(=O)NCc2ccc([O-])c(Br)c2)cc1)C(C)C ZINC000488683287 902943512 /nfs/dbraw/zinc/94/35/12/902943512.db2.gz DWXHDGXALZUXQY-UHFFFAOYSA-N 0 3 405.336 4.315 20 0 HIADHN Clc1ccc2c(c1)nccc2SCCN1CCC(Oc2cnccn2)CC1 ZINC000488751912 902979994 /nfs/dbraw/zinc/97/99/94/902979994.db2.gz WTGPXDGKGQYBNH-UHFFFAOYSA-N 0 3 400.935 4.314 20 0 HIADHN CC[C@H](c1nnc(SCC(=O)NC[C@@H](c2ccccc2)N(C)C)o1)c1ccccc1 ZINC000488847439 903040803 /nfs/dbraw/zinc/04/08/03/903040803.db2.gz BPIJQOAOEMXKOW-PMACEKPBSA-N 0 3 424.570 4.123 20 0 HIADHN Cc1cc(N2CCCC[C@@H]2C)ccc1NC(=O)N1CCN(C2CCOCC2)C[C@@H]1C ZINC000488904411 903069136 /nfs/dbraw/zinc/06/91/36/903069136.db2.gz BSTIYHUNYPQNCS-PMACEKPBSA-N 0 3 414.594 4.091 20 0 HIADHN Cc1cc(NC(=O)NCc2cscc2C)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000488931893 903082089 /nfs/dbraw/zinc/08/20/89/903082089.db2.gz AYGWJGQYJIHLJJ-HXUWFJFHSA-N 0 3 409.559 4.330 20 0 HIADHN COc1cccc(N2C[C@H](NCc3ccc(Oc4cccnc4)c(C)c3)CC2=O)c1 ZINC000489055528 903161552 /nfs/dbraw/zinc/16/15/52/903161552.db2.gz UEVUKNJTZPMDBY-LJQANCHMSA-N 0 3 403.482 4.086 20 0 HIADHN Cc1cccc2c1[C@@H](C)C[C@@H]2CC(=O)Nc1cccc(CN2CCC(C(N)=O)CC2)c1 ZINC000489069065 903171474 /nfs/dbraw/zinc/17/14/74/903171474.db2.gz GYVPGZCIBQHATC-GHTZIAJQSA-N 0 3 419.569 4.312 20 0 HIADHN Cc1ccc(NC(=O)N[C@H](CN2CCCC2)c2ccccc2)cc1C(=O)N(C)C(C)C ZINC000489126565 903216742 /nfs/dbraw/zinc/21/67/42/903216742.db2.gz DJDQNPMJVMJMOZ-HSZRJFAPSA-N 0 3 422.573 4.434 20 0 HIADHN C[C@@H](N[C@@H](COc1ccccc1F)C(C)(C)C)C(=O)Nc1ccc2c(c1)OCCO2 ZINC000489142828 903228026 /nfs/dbraw/zinc/22/80/26/903228026.db2.gz WLZDDMLUGDPQRT-VFNWGFHPSA-N 0 3 416.493 4.007 20 0 HIADHN C[C@@H](N[C@H](COc1ccccc1F)C(C)(C)C)C(=O)Nc1ccc2c(c1)OCCO2 ZINC000489142827 903228379 /nfs/dbraw/zinc/22/83/79/903228379.db2.gz WLZDDMLUGDPQRT-QVKFZJNVSA-N 0 3 416.493 4.007 20 0 HIADHN c1ccc(CN2CCOCC2)c(CN[C@@H]2CCCOc3cc4c(cc32)CCCC4)c1 ZINC000489549788 903458421 /nfs/dbraw/zinc/45/84/21/903458421.db2.gz IKXLROSJKWFILK-RUZDIDTESA-N 0 3 406.570 4.401 20 0 HIADHN Cc1ccc(NC(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)cc1C(=O)N(C)C(C)C ZINC000489564016 903468306 /nfs/dbraw/zinc/46/83/06/903468306.db2.gz DVGZKZBTMBVPMZ-YADHBBJMSA-N 0 3 408.546 4.042 20 0 HIADHN COc1cc([C@@H](C)N[C@H](C)c2ccc(Br)c(F)c2)ccc1OCCO ZINC000489631823 903508161 /nfs/dbraw/zinc/50/81/61/903508161.db2.gz ORAGBNHIIJQDRP-CHWSQXEVSA-N 0 3 412.299 4.380 20 0 HIADHN COc1cc(C)cc(NC(=O)NCCCCN2CCN(c3ccccc3)CC2)c1C ZINC000489693979 903543307 /nfs/dbraw/zinc/54/33/07/903543307.db2.gz GNCJZCYEHRQJSA-UHFFFAOYSA-N 0 3 410.562 4.036 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)Nc1ccc2c3c(cccc31)CC2 ZINC000489712790 903554355 /nfs/dbraw/zinc/55/43/55/903554355.db2.gz IKQSUEKFILZEDE-UHFFFAOYSA-N 0 3 415.537 4.217 20 0 HIADHN Cn1nc(-c2ccsc2)cc1NC(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000489732705 903566116 /nfs/dbraw/zinc/56/61/16/903566116.db2.gz FJRIYZZDTPYETH-UHFFFAOYSA-N 0 3 409.559 4.277 20 0 HIADHN CCN(C(=O)NCc1ccccc1CN1CCC(O)CC1)[C@H](C)c1ccc(F)cc1 ZINC000489750792 903577980 /nfs/dbraw/zinc/57/79/80/903577980.db2.gz ANTLWHGGBAVPLM-GOSISDBHSA-N 0 3 413.537 4.075 20 0 HIADHN C[C@@H](c1cccc(Cl)c1)N(C)C(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000489784440 903597063 /nfs/dbraw/zinc/59/70/63/903597063.db2.gz XNGGPODDIHDVKT-KRWDZBQOSA-N 0 3 415.965 4.199 20 0 HIADHN Cc1ccccc1[C@H]1C[C@@H](C)N(C(=O)NCc2ccccc2CN2CCC(O)CC2)C1 ZINC000489791348 903601597 /nfs/dbraw/zinc/60/15/97/903601597.db2.gz ZGUYYVAGLAMJHK-OFNKIYASSA-N 0 3 421.585 4.039 20 0 HIADHN CC(C)c1ccc([C@H](NC(=O)N2CC[C@@H](N3CCN(C)CC3)[C@H](C)C2)C(C)C)cc1 ZINC000489867533 903639723 /nfs/dbraw/zinc/63/97/23/903639723.db2.gz AXJJDRKMSMELJP-AGILITTLSA-N 0 3 414.638 4.175 20 0 HIADHN CSCC[C@H](N[C@@H]1CCCc2nc(-c3ccccc3F)sc21)C(=O)N(C)C ZINC000489886550 903653003 /nfs/dbraw/zinc/65/30/03/903653003.db2.gz SFPPBSMQINEHPQ-WBVHZDCISA-N 0 3 407.580 4.126 20 0 HIADHN CSCC[C@H](N[C@H](C)c1ccc(OCc2ccc(F)cc2)cc1)C(=O)N(C)C ZINC000489907260 903665174 /nfs/dbraw/zinc/66/51/74/903665174.db2.gz JXMRNBBDPJQPSX-IERDGZPVSA-N 0 3 404.551 4.265 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)NC[C@H]1SCCc2ccccc21 ZINC000489929035 903683231 /nfs/dbraw/zinc/68/32/31/903683231.db2.gz YFVKEFXCMGNGIM-AZUAARDMSA-N 0 3 401.601 4.215 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)NCc2ccc(OC3CCCC3)nc2)CC1 ZINC000489936084 903687091 /nfs/dbraw/zinc/68/70/91/903687091.db2.gz LCSVRVUTZKGXBC-UHFFFAOYSA-N 0 3 422.573 4.209 20 0 HIADHN Cc1nc(-c2ccc(C)cc2NC(=O)CN2C[C@@H](c3ccc(C)cc3)C[C@@H]2C)n[nH]1 ZINC000490063429 903753129 /nfs/dbraw/zinc/75/31/29/903753129.db2.gz ZQSMLUZIEKTVSP-PXNSSMCTSA-N 0 3 403.530 4.213 20 0 HIADHN CN1CCN(c2cc(CN[C@@H](c3ccccc3)c3ccc(Cl)cc3)ccn2)CC1 ZINC000490139357 903787570 /nfs/dbraw/zinc/78/75/70/903787570.db2.gz ZXZPJWQATPDNRF-DEOSSOPVSA-N 0 3 406.961 4.366 20 0 HIADHN COc1cccc(Oc2ccc(CN[C@H]3CCN(C(C)=O)Cc4ccccc43)cn2)c1 ZINC000490143706 903789910 /nfs/dbraw/zinc/78/99/10/903789910.db2.gz NCCVPEFTTKTTAB-DEOSSOPVSA-N 0 3 417.509 4.466 20 0 HIADHN Cc1ccc([C@@H](NCCN(C)Cc2ccccc2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000490156431 903798038 /nfs/dbraw/zinc/79/80/38/903798038.db2.gz IJZSGFGYJZYYPC-RUZDIDTESA-N 0 3 422.594 4.210 20 0 HIADHN Cc1ccc([C@@H](NCCN2CCCC[C@@H]2C)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000490168377 903806279 /nfs/dbraw/zinc/80/62/79/903806279.db2.gz UVUVFDRDPMREGO-RDPSFJRHSA-N 0 3 414.615 4.260 20 0 HIADHN Cc1ccc([C@@H](NC[C@@H](C(C)C)N2CCCC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000490172559 903810239 /nfs/dbraw/zinc/81/02/39/903810239.db2.gz ONVFAWQZAXVAOE-BJKOFHAPSA-N 0 3 414.615 4.198 20 0 HIADHN CCCNC(=O)CN1CCC(N[C@H](c2cccc(F)c2)c2cccc(Cl)c2)CC1 ZINC000490191554 903818568 /nfs/dbraw/zinc/81/85/68/903818568.db2.gz UKZIFHBYMPOIAX-QHCPKHFHSA-N 0 3 417.956 4.149 20 0 HIADHN CCC(CC)[C@H](CN[C@H](c1ccc(C)cc1)c1cccc(S(C)(=O)=O)c1)N(C)C ZINC000490191844 903818652 /nfs/dbraw/zinc/81/86/52/903818652.db2.gz XTVYMEUJSSRLLW-BJKOFHAPSA-N 0 3 416.631 4.444 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)N[C@H]2CCCOc3ccccc32)N(C)C)cc1 ZINC000490195545 903820982 /nfs/dbraw/zinc/82/09/82/903820982.db2.gz BMKJAYJHPADOLK-VXKWHMMOSA-N 0 3 411.546 4.290 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)NCc1ccc(Oc2ccccc2)nc1)c1ccco1 ZINC000490218444 903833764 /nfs/dbraw/zinc/83/37/64/903833764.db2.gz SZYOCEOWZVBYGF-FXAWDEMLSA-N 0 3 408.502 4.396 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)Nc3nnc(/C=C/c4ccco4)s3)cc2)CC1 ZINC000490234939 903843808 /nfs/dbraw/zinc/84/38/08/903843808.db2.gz CNBIKWJMKSMTSO-MDZDMXLPSA-N 0 3 423.542 4.084 20 0 HIADHN CCCN(C)[C@H](CNC(=O)Nc1cc(CCOC)ccn1)c1ccc(Cl)cc1 ZINC000490263579 903861442 /nfs/dbraw/zinc/86/14/42/903861442.db2.gz YGBGXIJQNNNQIV-LJQANCHMSA-N 0 3 404.942 4.129 20 0 HIADHN CC1CCN([C@H](CNC(=O)N[C@@H]2CCOC3(CCCC3)C2)c2cccs2)CC1 ZINC000490316460 903896964 /nfs/dbraw/zinc/89/69/64/903896964.db2.gz OZYLIZJDRWCVIL-RTBURBONSA-N 0 3 405.608 4.312 20 0 HIADHN C[C@@H](c1cccc(N2CCCS2(=O)=O)c1)N(C)Cc1cccc(C(F)(F)F)c1 ZINC000490336745 903926243 /nfs/dbraw/zinc/92/62/43/903926243.db2.gz SEQMOSHTKXTZCZ-HNNXBMFYSA-N 0 3 412.477 4.438 20 0 HIADHN O=C(NCc1ccc(C2CC2)cc1F)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000490351065 903944337 /nfs/dbraw/zinc/94/43/37/903944337.db2.gz COXIIDPWGYAXOH-UHFFFAOYSA-N 0 3 413.459 4.308 20 0 HIADHN COC(=O)[C@H]1CC12CCN(Cc1cc(Br)cc(C)c1OC(F)F)CC2 ZINC000490403158 903987435 /nfs/dbraw/zinc/98/74/35/903987435.db2.gz OPGDMEJBMJJQSE-CQSZACIVSA-N 0 3 418.278 4.134 20 0 HIADHN Cc1ccc2c(c1)[C@@H](N[C@H](C)c1ccc(Br)c(S(N)(=O)=O)c1)CCC2 ZINC000490436671 904009111 /nfs/dbraw/zinc/00/91/11/904009111.db2.gz SKNMXQFWZYWVSJ-ACJLOTCBSA-N 0 3 423.376 4.133 20 0 HIADHN CN(C)[C@H](CNC(=O)Nc1cccc(-c2noc(C(F)(F)F)n2)c1)c1ccccc1 ZINC000490498224 904051342 /nfs/dbraw/zinc/05/13/42/904051342.db2.gz IQPCNDHEELQIHI-MRXNPFEDSA-N 0 3 419.407 4.180 20 0 HIADHN Cn1nc(-c2ccc(Cl)s2)cc1NC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000490528534 904077594 /nfs/dbraw/zinc/07/75/94/904077594.db2.gz SDOIVCGJSBVCLP-AUUYWEPGSA-N 0 3 415.950 4.369 20 0 HIADHN O=C(CN1CCCC[C@@H]1[C@H]1CNC(=O)C1)c1c2ccccc2[nH]c1-c1ccccc1 ZINC000490631942 904147826 /nfs/dbraw/zinc/14/78/26/904147826.db2.gz QCRJIEFFNZQEKA-WIYYLYMNSA-N 0 3 401.510 4.008 20 0 HIADHN CN(C)[C@@H](CNC(=O)N[C@H](c1c[nH]c2ccccc21)C(F)(F)F)c1ccccc1 ZINC000490764429 904216553 /nfs/dbraw/zinc/21/65/53/904216553.db2.gz TWHJKZUSLVPGMV-RBUKOAKNSA-N 0 3 404.436 4.373 20 0 HIADHN Cc1cc(C)n(-c2ccc(C(F)(F)F)cc2NC(=O)N2CC[C@H]3CCN(C)C[C@@H]32)n1 ZINC000490764059 904217337 /nfs/dbraw/zinc/21/73/37/904217337.db2.gz SKYLSDOBFKAUPC-BEFAXECRSA-N 0 3 421.467 4.066 20 0 HIADHN CCOc1c(Br)cc(Cl)cc1NC(=O)N1CC[C@H]2CCN(C)C[C@@H]21 ZINC000490808867 904255253 /nfs/dbraw/zinc/25/52/53/904255253.db2.gz VSZIXIRVUNVPKA-ABAIWWIYSA-N 0 3 416.747 4.059 20 0 HIADHN CCN1CCN(c2ccc(C(=O)NCC[C@@H](c3ccccc3)C(F)(F)F)cc2)CC1 ZINC000490848284 904285287 /nfs/dbraw/zinc/28/52/87/904285287.db2.gz WJSVDKCTYACVMN-NRFANRHFSA-N 0 3 419.491 4.295 20 0 HIADHN O=C(NCC1(c2ccc(F)cc2)CC1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000490910955 904313895 /nfs/dbraw/zinc/31/38/95/904313895.db2.gz LZXQMDANSNYEQV-UHFFFAOYSA-N 0 3 413.562 4.270 20 0 HIADHN C[C@@H](COc1cccc(F)c1)NC(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000490952999 904334244 /nfs/dbraw/zinc/33/42/44/904334244.db2.gz UAYQFYANBIMCQF-KRWDZBQOSA-N 0 3 417.550 4.006 20 0 HIADHN Cc1ccc([C@H](NC[C@@H](O)C2CCCCC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000491008951 904367546 /nfs/dbraw/zinc/36/75/46/904367546.db2.gz QDAMKENMAPMDPQ-PKTZIBPZSA-N 0 3 401.572 4.019 20 0 HIADHN CCN(CC)c1nc2sc(C(=O)NC[C@H](c3ccccc3)N(C)C)cc2s1 ZINC000506112918 914808654 /nfs/dbraw/zinc/80/86/54/914808654.db2.gz OHNJLPVKSHFSCL-OAHLLOKOSA-N 0 3 402.589 4.237 20 0 HIADHN Cc1ccc([C@@H](N[C@H]2CCN(C3CCCC3)C2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000491056489 904398447 /nfs/dbraw/zinc/39/84/47/904398447.db2.gz UZEGNLSKKOQMMY-XUZZJYLKSA-N 0 3 412.599 4.094 20 0 HIADHN CC(=O)N1CCC(CN[C@H](c2ccccc2)c2ccccc2Br)CC1 ZINC000491059313 904403140 /nfs/dbraw/zinc/40/31/40/904403140.db2.gz ZNRXIXGASBHDKE-OAQYLSRUSA-N 0 3 401.348 4.387 20 0 HIADHN C[C@H](C1CC1)n1cc(NC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)cn1 ZINC000491068615 904409007 /nfs/dbraw/zinc/40/90/07/904409007.db2.gz NHTQTKPYXMSBAV-FOIQADDNSA-N 0 3 406.452 4.247 20 0 HIADHN COc1cc(CN2CCC[C@H](c3nnc4ccc(C(F)(F)F)cn43)C2)cc(OC)c1 ZINC000506123475 914812806 /nfs/dbraw/zinc/81/28/06/914812806.db2.gz AKTZZTJZWYKGKM-HNNXBMFYSA-N 0 3 420.435 4.145 20 0 HIADHN COc1ccccc1NC(=O)c1ccc(NC(=O)[C@H](C)N2CC[C@@H](C3CC3)C2)cc1 ZINC000491218182 904488684 /nfs/dbraw/zinc/48/86/84/904488684.db2.gz ONDLQVKOGBASAP-QFBILLFUSA-N 0 3 407.514 4.006 20 0 HIADHN COc1ccccc1-c1ncc(CNCCNc2ncc(Cl)cc2Cl)cn1 ZINC000491234596 904494346 /nfs/dbraw/zinc/49/43/46/904494346.db2.gz HKJHGECJEADCQL-UHFFFAOYSA-N 0 3 404.301 4.056 20 0 HIADHN CC1CCN(CCCN[C@@H](c2ccc(F)cc2)c2cccc(S(C)(=O)=O)c2)CC1 ZINC000491259050 904506679 /nfs/dbraw/zinc/50/66/79/904506679.db2.gz HPQWVHSZTRVXPE-QHCPKHFHSA-N 0 3 418.578 4.030 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](NCCc2cccc(F)c2)c2ccc(F)cc2)c1 ZINC000491296761 904522585 /nfs/dbraw/zinc/52/25/85/904522585.db2.gz SOFQXFGUTPZLQT-QFIPXVFZSA-N 0 3 401.478 4.290 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)Nc1cc(F)c(OC(F)F)cc1F ZINC000491320746 904536447 /nfs/dbraw/zinc/53/64/47/904536447.db2.gz HCXWMFSVYXTLOU-UHFFFAOYSA-N 0 3 421.460 4.049 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)Nc1cc(F)c(OC(F)F)cc1F ZINC000491330954 904540961 /nfs/dbraw/zinc/54/09/61/904540961.db2.gz BMLDAKGQTUEKQE-UHFFFAOYSA-N 0 3 411.399 4.136 20 0 HIADHN CCCN1CCC(N[C@H](c2ccc(Cl)cc2)c2cccc(S(C)(=O)=O)c2)CC1 ZINC000491344121 904548449 /nfs/dbraw/zinc/54/84/49/904548449.db2.gz WQOSXOIHNPWTKA-JOCHJYFZSA-N 0 3 421.006 4.297 20 0 HIADHN CCc1ccc([C@@H](NCCN(C(C)C)C(C)C)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000491354466 904550914 /nfs/dbraw/zinc/55/09/14/904550914.db2.gz BSJXTXRORIVYAZ-XMMPIXPASA-N 0 3 416.631 4.450 20 0 HIADHN COc1ccc([C@@H](CN[C@H](c2cnn(C)c2)c2cccc(F)c2)N2CCCCC2)cc1 ZINC000491370365 904562751 /nfs/dbraw/zinc/56/27/51/904562751.db2.gz ZSVPBJOARPUCBN-RPBOFIJWSA-N 0 3 422.548 4.474 20 0 HIADHN Cc1ccc([C@H](NC[C@H]2Cc3ccccc3O2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000491392586 904574318 /nfs/dbraw/zinc/57/43/18/904574318.db2.gz AUQMRKNSJLYSQR-PXDATVDWSA-N 0 3 421.562 4.390 20 0 HIADHN CCc1ccc([C@H](NC[C@H]2Cc3ccccc3O2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000491420136 904586262 /nfs/dbraw/zinc/58/62/62/904586262.db2.gz AURXXPIMJLWBTC-RDGATRHJSA-N 0 3 421.562 4.335 20 0 HIADHN CCc1ccc([C@@H](NC[C@H]2Cc3ccccc3O2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000491420134 904586396 /nfs/dbraw/zinc/58/63/96/904586396.db2.gz AURXXPIMJLWBTC-RCZVLFRGSA-N 0 3 421.562 4.335 20 0 HIADHN COc1ccc([C@H](NCc2ccc(CN3CCOCC3)cc2)c2ccccc2)cc1 ZINC000491425211 904591770 /nfs/dbraw/zinc/59/17/70/904591770.db2.gz ZZZFXDJPDCBXOL-AREMUKBSSA-N 0 3 402.538 4.407 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)Nc2ccc(C(=O)N3CCCC3)cc2C)c1 ZINC000491537275 904642056 /nfs/dbraw/zinc/64/20/56/904642056.db2.gz HBVYKRUQHUNWCM-UHFFFAOYSA-N 0 3 422.573 4.135 20 0 HIADHN CN(C)[C@H](CNC(=O)N(Cc1csc(Br)c1)C1CC1)c1ccccc1 ZINC000506169633 914831441 /nfs/dbraw/zinc/83/14/41/914831441.db2.gz BADMVEOYWICQSX-QGZVFWFLSA-N 0 3 422.392 4.488 20 0 HIADHN CN(C)[C@@H](CNC(=O)N1CCC[C@H](c2nc3ccc(F)cc3o2)C1)c1ccccc1 ZINC000506170139 914832266 /nfs/dbraw/zinc/83/22/66/914832266.db2.gz IXGRHQSCOZCGSU-PXNSSMCTSA-N 0 3 410.493 4.159 20 0 HIADHN COc1ccc([C@@H](CNC(=O)NCc2ccc(CSC)cc2)N2CCCC2)cc1 ZINC000506179179 914835266 /nfs/dbraw/zinc/83/52/66/914835266.db2.gz NTTOSXVWEYKQLL-JOCHJYFZSA-N 0 3 413.587 4.195 20 0 HIADHN CCC(CC)[C@H](O)CN[C@@H](c1cccc(S(C)(=O)=O)c1)c1ccc(C)cc1C ZINC000492078362 904790013 /nfs/dbraw/zinc/79/00/13/904790013.db2.gz HHCXVUQTACGCBN-PKTZIBPZSA-N 0 3 403.588 4.183 20 0 HIADHN O=C(Nc1ccc2c3c(cccc31)CC2)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000492165331 904809107 /nfs/dbraw/zinc/80/91/07/904809107.db2.gz BNDBINQQNIYBQV-UHFFFAOYSA-N 0 3 400.522 4.395 20 0 HIADHN CN1CCN(C)[C@H](CN[C@H](c2ccc(Cl)cc2)c2ccc(C(F)(F)F)cc2)C1 ZINC000492177089 904810044 /nfs/dbraw/zinc/81/00/44/904810044.db2.gz DNKXZSHBRIHEAC-UXHICEINSA-N 0 3 411.899 4.284 20 0 HIADHN CCN1CCCC[C@H]1CN[C@H](c1cccc(S(C)(=O)=O)c1)c1ccc(C)cc1C ZINC000492194771 904813274 /nfs/dbraw/zinc/81/32/74/904813274.db2.gz HGKKGADUTPWMGL-XUZZJYLKSA-N 0 3 414.615 4.260 20 0 HIADHN CCc1ccc([C@H](NC[C@H]2CCCCN2CC)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000492194459 904813282 /nfs/dbraw/zinc/81/32/82/904813282.db2.gz FTCNUHWGASFBSJ-VWNXMTODSA-N 0 3 414.615 4.206 20 0 HIADHN COc1ccc([C@@H](NCCN2C[C@H]3CC[C@@H](C2)O3)c2ccc(C(F)(F)F)cc2)cc1 ZINC000492516430 904862776 /nfs/dbraw/zinc/86/27/76/904862776.db2.gz TXIGPOQOVBAIPF-BDTNDASRSA-N 0 3 420.475 4.256 20 0 HIADHN Brc1cccc(OCCN2CCC3(CC2)OCCc2ccsc23)c1 ZINC000492602912 904875397 /nfs/dbraw/zinc/87/53/97/904875397.db2.gz RIWXRBQQZHGTQA-UHFFFAOYSA-N 0 3 408.361 4.453 20 0 HIADHN C[C@@H](OC[C@H](O)CN1CCC2(CC1)OCCc1ccsc12)c1ccc(Cl)cc1 ZINC000492810756 904909850 /nfs/dbraw/zinc/90/98/50/904909850.db2.gz UMKZEYWOQBBUPW-OXQOHEQNSA-N 0 3 421.990 4.404 20 0 HIADHN C[C@H](OC[C@@H](O)CN1CCC2(CC1)OCCc1ccsc12)c1ccc(Cl)cc1 ZINC000492810754 904911547 /nfs/dbraw/zinc/91/15/47/904911547.db2.gz UMKZEYWOQBBUPW-JXFKEZNVSA-N 0 3 421.990 4.404 20 0 HIADHN Cc1ccc(NC(=O)c2ccc(CN3CCC(CO)CC3)cc2)cc1C(F)(F)F ZINC000492884705 904937338 /nfs/dbraw/zinc/93/73/38/904937338.db2.gz DKZFLZQUBWZZHY-UHFFFAOYSA-N 0 3 406.448 4.470 20 0 HIADHN CN(CCN(Cc1ccccc1)C(=O)Nc1cc2n(n1)CCCC2)Cc1ccccc1 ZINC000492910149 904948132 /nfs/dbraw/zinc/94/81/32/904948132.db2.gz GAVMEDVRNTYSMM-UHFFFAOYSA-N 0 3 417.557 4.386 20 0 HIADHN CNC(=O)C1CCN(Cc2cccc(NC(=O)c3ccc(Cl)cc3Cl)c2)CC1 ZINC000506237732 914858159 /nfs/dbraw/zinc/85/81/59/914858159.db2.gz ZVPHESIPFGIAOO-UHFFFAOYSA-N 0 3 420.340 4.204 20 0 HIADHN CCC(CC)(CCO)CN[C@@H](c1ccc(F)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000493132082 905028199 /nfs/dbraw/zinc/02/81/99/905028199.db2.gz RPQKPKMYJCAVPW-NRFANRHFSA-N 0 3 407.551 4.097 20 0 HIADHN CCCC(O)(CCC)CN[C@H](c1ccc(C)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000493202601 905046094 /nfs/dbraw/zinc/04/60/94/905046094.db2.gz HBUGGEFACAFOBK-JOCHJYFZSA-N 0 3 403.588 4.409 20 0 HIADHN Cc1ccc(-c2cc(C(=O)N3CC[C@H]4CCN(C)C[C@@H]43)c3cnn(C(C)C)c3n2)s1 ZINC000493412191 905110775 /nfs/dbraw/zinc/11/07/75/905110775.db2.gz VDWBPCHWRBNXCX-UZLBHIALSA-N 0 3 423.586 4.215 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)c3ccc(CSc4nc5ccccc5[nH]4)cc3)[C@@H]2C1 ZINC000493436472 905116973 /nfs/dbraw/zinc/11/69/73/905116973.db2.gz CRUTXCSZWOLKHT-DYESRHJHSA-N 0 3 406.555 4.021 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)CCc3c4ccccc4[nH]c3-c3ccc(F)cc3)[C@@H]2C1 ZINC000493536804 905152571 /nfs/dbraw/zinc/15/25/71/905152571.db2.gz MPJYPAWZENCHHB-UZUQRXQVSA-N 0 3 405.517 4.459 20 0 HIADHN COc1cc(-c2noc(CN[C@@H]3CCC[C@H]3Cc3ccccc3)n2)cc(OC)c1OC ZINC000493541085 905156183 /nfs/dbraw/zinc/15/61/83/905156183.db2.gz DHTDISZBHYVOKI-PKOBYXMFSA-N 0 3 423.513 4.263 20 0 HIADHN COc1cc([C@H](C)N[C@H]2CCc3cc(Br)cc(C)c32)ccc1OCCO ZINC000493819886 905228453 /nfs/dbraw/zinc/22/84/53/905228453.db2.gz NVRFLFLZOLTKNH-KSSFIOAISA-N 0 3 420.347 4.475 20 0 HIADHN CCN1CCN(CCNC(=O)c2ccc(-c3cc(Cl)cc(Cl)c3)s2)CC1 ZINC000493864003 905233580 /nfs/dbraw/zinc/23/35/80/905233580.db2.gz JDBRUAPLOGJRGR-UHFFFAOYSA-N 0 3 412.386 4.089 20 0 HIADHN COc1cccc(COc2cccc(NC(=O)N3CC[C@H]4CCN(C)C[C@H]43)c2C)c1 ZINC000493920769 905274483 /nfs/dbraw/zinc/27/44/83/905274483.db2.gz RFSKEPOLZACRIF-DENIHFKCSA-N 0 3 409.530 4.141 20 0 HIADHN Cc1cccc(NC(=O)N(Cc2ccncc2)[C@@H]2CCCN(Cc3ccccc3)C2)n1 ZINC000493923696 905275874 /nfs/dbraw/zinc/27/58/74/905275874.db2.gz DITWNCZEDHBXQQ-HSZRJFAPSA-N 0 3 415.541 4.484 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)Nc3ccc(C(F)(F)F)cc3Br)[C@H]2C1 ZINC000493936266 905287725 /nfs/dbraw/zinc/28/77/25/905287725.db2.gz XSSZCONWOKQJJR-YGRLFVJLSA-N 0 3 406.246 4.026 20 0 HIADHN COC[C@H](N[C@@H](C)c1cc(F)ccc1N1CCN(C)CC1)c1ccc(Cl)cc1 ZINC000493961336 905310978 /nfs/dbraw/zinc/31/09/78/905310978.db2.gz PFNULPNVFXTRND-KKSFZXQISA-N 0 3 405.945 4.269 20 0 HIADHN Cc1cc(C(=O)N[C@@H]2CCN(Cc3ccccc3)[C@H]2C)ccc1NC(=O)CC(C)C ZINC000493998517 905342115 /nfs/dbraw/zinc/34/21/15/905342115.db2.gz DODVWYFPMCRMEV-WMZHIEFXSA-N 0 3 407.558 4.372 20 0 HIADHN Cc1ccc([C@H](NCCCc2nccs2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000494019935 905359445 /nfs/dbraw/zinc/35/94/45/905359445.db2.gz KOVAFJGJFIDPFW-NRFANRHFSA-N 0 3 400.569 4.167 20 0 HIADHN C[C@H](O)CC(C)(C)CN[C@@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000494021786 905363042 /nfs/dbraw/zinc/36/30/42/905363042.db2.gz ZVNMNVCJWIIXME-YWZLYKJASA-N 0 3 409.979 4.220 20 0 HIADHN CC(C)[C@@H]1OCCC[C@@H]1CN[C@@H](c1ccc(F)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000494021425 905363975 /nfs/dbraw/zinc/36/39/75/905363975.db2.gz WLIKQYFZTRKKMD-OIBXWCBGSA-N 0 3 419.562 4.359 20 0 HIADHN Cc1ccc(C(=O)N[C@H]2CCN(Cc3ccccc3)[C@H]2C)cc1NC(=O)NC(C)(C)C ZINC000494025589 905365706 /nfs/dbraw/zinc/36/57/06/905365706.db2.gz CRRBHSVBSRXSCQ-RXVVDRJESA-N 0 3 422.573 4.308 20 0 HIADHN Cc1ccc([C@H](NCCCc2nccs2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000494030387 905372308 /nfs/dbraw/zinc/37/23/08/905372308.db2.gz VUGGGHAWIFAFRA-JOCHJYFZSA-N 0 3 414.596 4.475 20 0 HIADHN NC(=O)C1CCC(N[C@H](c2ccccc2)c2ccc(Br)cc2F)CC1 ZINC000494041560 905383745 /nfs/dbraw/zinc/38/37/45/905383745.db2.gz XKCACNWSUMVSPM-GSQSYGFSSA-N 0 3 405.311 4.311 20 0 HIADHN C[C@H]1[C@H](NC(=O)COc2ccc(Oc3ccccn3)cc2)CCN1Cc1ccccc1 ZINC000494060771 905397989 /nfs/dbraw/zinc/39/79/89/905397989.db2.gz QOMCYOFABIOGSW-WMZHIEFXSA-N 0 3 417.509 4.032 20 0 HIADHN COc1ccc([C@H](NCCc2cccc(C(N)=O)c2)c2ccccc2Cl)cc1OC ZINC000494075475 905411429 /nfs/dbraw/zinc/41/14/29/905411429.db2.gz PEAFVHFPBSAEPU-QHCPKHFHSA-N 0 3 424.928 4.378 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)Cc2csc(Cc3ccc(F)cc3)n2)CCN1Cc1ccccc1 ZINC000494076641 905414926 /nfs/dbraw/zinc/41/49/26/905414926.db2.gz CQYNVZYGRCXRLT-VGSWGCGISA-N 0 3 423.557 4.195 20 0 HIADHN Cc1ccc(-c2nc(CC(=O)N[C@@H]3CCN(Cc4ccccc4)[C@H]3C)cs2)cc1 ZINC000494078065 905415437 /nfs/dbraw/zinc/41/54/37/905415437.db2.gz JIUXMBXENWHNSR-PGRDOPGGSA-N 0 3 405.567 4.440 20 0 HIADHN COCCN(CCc1nc2ccccc2n1C)Cc1cc(Br)cs1 ZINC000494129543 905474100 /nfs/dbraw/zinc/47/41/00/905474100.db2.gz YNFJZOOVYPMRHX-UHFFFAOYSA-N 0 3 408.365 4.088 20 0 HIADHN O=C(Nc1ccccc1OC1CCCC1)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1CO ZINC000494203447 905535672 /nfs/dbraw/zinc/53/56/72/905535672.db2.gz CQKAYYFIWFFOSK-IRLDBZIGSA-N 0 3 423.557 4.013 20 0 HIADHN COC[C@@H](NC(=O)NC[C@H](c1cccs1)N1CCCC1)c1ccc(Cl)cc1 ZINC000494219118 905548464 /nfs/dbraw/zinc/54/84/64/905548464.db2.gz HMKAFCHIZNRXLV-QZTJIDSGSA-N 0 3 407.967 4.225 20 0 HIADHN C[C@H](N[C@]1(C)CCO[C@@H]1C)C(=O)N1N=C(c2ccc(Cl)cc2)C[C@@H]1c1ccco1 ZINC000494266630 905590530 /nfs/dbraw/zinc/59/05/30/905590530.db2.gz ZPADVPSDYAQWFL-FGXHJERBSA-N 0 3 415.921 4.156 20 0 HIADHN CN1C(=O)C[C@H](NCc2ccc(Cl)c3cccnc23)[C@H]1c1ccc(F)c(F)c1 ZINC000494277650 905601599 /nfs/dbraw/zinc/60/15/99/905601599.db2.gz SSNFZTSYOLNRKW-GHTZIAJQSA-N 0 3 401.844 4.228 20 0 HIADHN CN(C)Cc1cccc(NC(=O)CCC(=O)Nc2nnc(C3CCCCC3)s2)c1 ZINC000494280649 905603984 /nfs/dbraw/zinc/60/39/84/905603984.db2.gz XYGVAEIMXDXTCA-UHFFFAOYSA-N 0 3 415.563 4.005 20 0 HIADHN Cc1ccc(NC(=O)c2ccc(CN3CCC(CO)CC3)cc2)cc1-c1ncco1 ZINC000494378824 905676640 /nfs/dbraw/zinc/67/66/40/905676640.db2.gz QVXRQPPGYPCSLM-UHFFFAOYSA-N 0 3 405.498 4.107 20 0 HIADHN Cc1nn(-c2ccccc2)c(Oc2ccc(F)cc2)c1CN[C@H]1CCn2ccnc2C1 ZINC000494414633 905703306 /nfs/dbraw/zinc/70/33/06/905703306.db2.gz WPEMHTQGOOXFNU-IBGZPJMESA-N 0 3 417.488 4.413 20 0 HIADHN COC[C@H](NC(=O)N[C@H]1CCN([C@H](C)c2ccccc2)C1)c1ccc(Cl)cc1 ZINC000494426362 905714180 /nfs/dbraw/zinc/71/41/80/905714180.db2.gz AVYVUQADDPFGSR-CZAAIQMYSA-N 0 3 401.938 4.162 20 0 HIADHN CC[C@H](N[C@@H]1CCO[C@@H]1c1ccc(Cl)c(F)c1)C(=O)Nc1ccc(OC)cc1 ZINC000494499335 905788577 /nfs/dbraw/zinc/78/85/77/905788577.db2.gz ZFFIWGBQHMSPRL-XUVXKRRUSA-N 0 3 406.885 4.325 20 0 HIADHN CCCC(=O)NC[C@H]1CCCN(Cc2cn(-c3ccccc3)nc2-c2cccnc2)C1 ZINC000512470263 921182854 /nfs/dbraw/zinc/18/28/54/921182854.db2.gz WWMSDKSBMUZASO-HXUWFJFHSA-N 0 3 417.557 4.063 20 0 HIADHN O=C(CC1CCCCC1)NCCNCc1cnn(Cc2ccc(C(F)(F)F)cc2)c1 ZINC000494597623 905854677 /nfs/dbraw/zinc/85/46/77/905854677.db2.gz BNNFCUNDJYJGDI-UHFFFAOYSA-N 0 3 422.495 4.126 20 0 HIADHN O=C(NC[C@@H]1CCCN(Cc2ccc(OC(F)F)cc2)C1)Nc1cccc(F)c1 ZINC000512478253 921187757 /nfs/dbraw/zinc/18/77/57/921187757.db2.gz BUUZQNWVCDUIDN-INIZCTEOSA-N 0 3 407.436 4.461 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)NC12CCC(C(F)(F)F)(CC1)CC2 ZINC000494664435 905889062 /nfs/dbraw/zinc/88/90/62/905889062.db2.gz YEYOSFVBIXIYKC-UHFFFAOYSA-N 0 3 409.496 4.389 20 0 HIADHN C[C@H](CC(=O)N(CCN(C)C)Cc1cccc(O)c1)c1ccc(C(F)(F)F)cc1 ZINC000494781751 905982272 /nfs/dbraw/zinc/98/22/72/905982272.db2.gz XMOMKLONNKIZQM-MRXNPFEDSA-N 0 3 408.464 4.495 20 0 HIADHN Cc1nc2ccc(CN[C@@H]3CCCN(Cc4ccc(F)cc4F)C3=O)cc2s1 ZINC000494845015 906032901 /nfs/dbraw/zinc/03/29/01/906032901.db2.gz FFGHWADLZWJGCH-LJQANCHMSA-N 0 3 401.482 4.164 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3cc(Cl)c(F)c(Cl)c3)CC2)C[C@@H](C)O1 ZINC000494890613 906067525 /nfs/dbraw/zinc/06/75/25/906067525.db2.gz GZDJATPIEJQOII-CHWSQXEVSA-N 0 3 418.340 4.486 20 0 HIADHN CCCCNC(=O)C1CCN(Cc2c[nH]nc2-c2ccc(C(F)(F)F)cc2)CC1 ZINC000494919575 906091780 /nfs/dbraw/zinc/09/17/80/906091780.db2.gz DZZPOLSLGAQROC-UHFFFAOYSA-N 0 3 408.468 4.224 20 0 HIADHN O=C(Nc1ccc(Br)cc1)C1CCN(C/C=C\c2ccncc2)CC1 ZINC000494926317 906099454 /nfs/dbraw/zinc/09/94/54/906099454.db2.gz XGEOGAVOYYSXOS-UPHRSURJSA-N 0 3 400.320 4.208 20 0 HIADHN CC1(C)C[C@H](N[C@H](c2cccc(S(C)(=O)=O)c2)c2ccc(F)c(F)c2)CCO1 ZINC000494949286 906121395 /nfs/dbraw/zinc/12/13/95/906121395.db2.gz KFBSRRQWHOGNHN-OXQOHEQNSA-N 0 3 409.498 4.005 20 0 HIADHN CC1(C)C[C@H](N[C@@H](c2cccc(S(C)(=O)=O)c2)c2ccc(F)c(F)c2)CCO1 ZINC000494949287 906121848 /nfs/dbraw/zinc/12/18/48/906121848.db2.gz KFBSRRQWHOGNHN-UZLBHIALSA-N 0 3 409.498 4.005 20 0 HIADHN CC(C)(C)C(=O)NC[C@@H]1CCCN(Cc2c[nH]nc2-c2ccc(C(F)(F)F)cc2)C1 ZINC000494962266 906131804 /nfs/dbraw/zinc/13/18/04/906131804.db2.gz UUYHVWFUIGQPFX-HNNXBMFYSA-N 0 3 422.495 4.470 20 0 HIADHN C[C@H](CNC(=O)NCc1ccnc(Oc2ccccc2F)c1)N(C)Cc1ccccc1 ZINC000495007878 906167540 /nfs/dbraw/zinc/16/75/40/906167540.db2.gz PXNQBHQPIMNJKA-GOSISDBHSA-N 0 3 422.504 4.333 20 0 HIADHN COc1cccc([C@@H](CNC(=O)N[C@H](C)CCCC(F)(F)F)N2CCCC2)c1 ZINC000495013319 906171193 /nfs/dbraw/zinc/17/11/93/906171193.db2.gz ASBPWICSZHIAEK-CRAIPNDOSA-N 0 3 401.473 4.252 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)c1[nH]c2ccccc2c1Br ZINC000495028725 906186414 /nfs/dbraw/zinc/18/64/14/906186414.db2.gz MZAHYFOMKXOHKY-CQSZACIVSA-N 0 3 400.320 4.181 20 0 HIADHN Cc1c2ccccc2oc1[C@@H](NC(=O)N1CCN(C2CCOCC2)C[C@H]1C)C(C)C ZINC000495036214 906190602 /nfs/dbraw/zinc/19/06/02/906190602.db2.gz LPQBCLVJTGETQM-VGSWGCGISA-N 0 3 413.562 4.333 20 0 HIADHN CCOc1c(OC)cc(CN[C@@H](C[C@H]2CCOC2)c2ccc(F)cc2)cc1OC ZINC000495054665 906208499 /nfs/dbraw/zinc/20/84/99/906208499.db2.gz VVJCUFUXEVHGSK-UZLBHIALSA-N 0 3 403.494 4.499 20 0 HIADHN FC(F)(F)Oc1cccc(N2CC[C@@H](N[C@@H](c3nc[nH]n3)C3CCCCC3)C2)c1 ZINC000495062162 906215761 /nfs/dbraw/zinc/21/57/61/906215761.db2.gz AIOGBBXOTGCIMR-CRAIPNDOSA-N 0 3 409.456 4.193 20 0 HIADHN Cc1cccc(-c2cncc(C(=O)N3CCC(CN4C[C@@H](C)O[C@H](C)C4)CC3)c2)c1 ZINC000495199325 906303949 /nfs/dbraw/zinc/30/39/49/906303949.db2.gz BYUNTBWRJJIRDZ-WOJBJXKFSA-N 0 3 407.558 4.018 20 0 HIADHN C[C@H]1CCCCN1CCNC(=O)c1ccc(COc2ccc(Br)cc2)o1 ZINC000495329000 906379401 /nfs/dbraw/zinc/37/94/01/906379401.db2.gz DKADHAOLKJDCPA-HNNXBMFYSA-N 0 3 421.335 4.225 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)N1CC2(CCC2)[C@@H]1c1ccccc1 ZINC000495346254 906392226 /nfs/dbraw/zinc/39/22/26/906392226.db2.gz CGZKZWOOXJECSS-VWLOTQADSA-N 0 3 403.570 4.343 20 0 HIADHN CCS(=O)(=O)Nc1ccc([C@H](C)NCc2ccccc2N2CCCCC2)cc1 ZINC000495402432 906428775 /nfs/dbraw/zinc/42/87/75/906428775.db2.gz QUYJDWDLUNTFQB-SFHVURJKSA-N 0 3 401.576 4.289 20 0 HIADHN CCC[C@H](C)NC(=O)[C@H]1CCCN(Cc2cn(C)nc2-c2ccccc2Cl)C1 ZINC000512557297 921234903 /nfs/dbraw/zinc/23/49/03/921234903.db2.gz OTVVQMROEUAFHT-IRXDYDNUSA-N 0 3 402.970 4.257 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1CCN(Cc2ccccc2)[C@@H]1C)c1nc(C(C)(C)C)cs1 ZINC000495449173 906455859 /nfs/dbraw/zinc/45/58/59/906455859.db2.gz ATLICNNYVWLQCJ-LZLYRXPVSA-N 0 3 400.592 4.464 20 0 HIADHN Cc1cc(OC[C@@H](O)CN2CCC[C@@](O)(C(F)(F)F)CC2)c(C(C)C)cc1Cl ZINC000512562588 921238412 /nfs/dbraw/zinc/23/84/12/921238412.db2.gz YSBKBLMNUWZVQZ-KXBFYZLASA-N 0 3 423.903 4.291 20 0 HIADHN O=C1CCCN1Cc1ccccc1CNCc1c(-c2ccccc2)nc2ccccn21 ZINC000495548239 906501267 /nfs/dbraw/zinc/50/12/67/906501267.db2.gz PHKKOLURNWXQHY-UHFFFAOYSA-N 0 3 410.521 4.414 20 0 HIADHN Cc1sc(CNC(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)nc1C(C)C ZINC000496225854 906632740 /nfs/dbraw/zinc/63/27/40/906632740.db2.gz XPBRHNLLCKOKHY-IBGZPJMESA-N 0 3 418.607 4.464 20 0 HIADHN COc1cccc(C[C@@H](C)NC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)c1 ZINC000496260308 906640350 /nfs/dbraw/zinc/64/03/50/906640350.db2.gz BVMYJPRJSRWBID-VGSWGCGISA-N 0 3 420.475 4.197 20 0 HIADHN Cc1nn(-c2ccc(F)cc2F)c(C)c1CN1CCC(C(=O)N[C@H](C)C(C)C)CC1 ZINC000512599571 921255007 /nfs/dbraw/zinc/25/50/07/921255007.db2.gz FUSOAQLYJSBMCN-OAHLLOKOSA-N 0 3 418.532 4.140 20 0 HIADHN Cn1ncc(NC(=O)N(Cc2ccccc2)C2CCN(C)CC2)c1-c1ccccc1 ZINC000496751770 906750144 /nfs/dbraw/zinc/75/01/44/906750144.db2.gz GTEUERRYBFEJIQ-UHFFFAOYSA-N 0 3 403.530 4.215 20 0 HIADHN CN(Cc1cc(Br)ccc1OCc1ccccn1)C[C@@H]1CCCC[C@H]1O ZINC000497095001 906804089 /nfs/dbraw/zinc/80/40/89/906804089.db2.gz FQRNOZFGMKFQOJ-OXJNMPFZSA-N 0 3 419.363 4.406 20 0 HIADHN Cc1nc(COc2ccc(CN3CCC(n4ccc(C(F)(F)F)n4)CC3)cc2)no1 ZINC000497226878 906822855 /nfs/dbraw/zinc/82/28/55/906822855.db2.gz HCHXVHYQOCBYBS-UHFFFAOYSA-N 0 3 421.423 4.009 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)COc2ccccc2Cc2ccccc2)CC1 ZINC000497356117 906849451 /nfs/dbraw/zinc/84/94/51/906849451.db2.gz PIUVOTBCKADDCY-UHFFFAOYSA-N 0 3 418.537 4.372 20 0 HIADHN CC(C)[C@@H](c1ccccc1)N(C)CC(=O)N1CCC[C@@H]1c1ccc2c(c1)OCCO2 ZINC000497384237 906870212 /nfs/dbraw/zinc/87/02/12/906870212.db2.gz GRDWRBVJJIKIDN-BWKNWUBXSA-N 0 3 408.542 4.450 20 0 HIADHN Cn1cc(C(=O)NCC2CCN(Cc3ccc(Sc4ccccc4)cc3)CC2)cn1 ZINC000512648223 921273588 /nfs/dbraw/zinc/27/35/88/921273588.db2.gz LHNBUBAMHQQXIH-UHFFFAOYSA-N 0 3 420.582 4.213 20 0 HIADHN CO[C@H]1CCC[C@H](C(=O)Nc2cccc(N3CCN(CCc4ccccc4)CC3)c2)C1 ZINC000497398550 906879461 /nfs/dbraw/zinc/87/94/61/906879461.db2.gz FQHKIIGKHKHSIG-DHLKQENFSA-N 0 3 421.585 4.195 20 0 HIADHN COc1ccc(C2=NN(C(=O)CN(C)C(C3CC3)C3CC3)[C@@H](c3ccco3)C2)cc1 ZINC000497429161 906900272 /nfs/dbraw/zinc/90/02/72/906900272.db2.gz QWPQDDWHSBUTLS-OAQYLSRUSA-N 0 3 407.514 4.086 20 0 HIADHN O=C(c1ccc(Cl)cc1)C1CCN(CCCCN2C(=O)c3ccccc3C2=O)CC1 ZINC000497474633 906956524 /nfs/dbraw/zinc/95/65/24/906956524.db2.gz ODNBZEATAXLPOA-UHFFFAOYSA-N 0 3 424.928 4.311 20 0 HIADHN C[C@H]1CN(C(=O)c2cc3sc4ccccc4c3s2)CC[C@@H]1N1CCN(C)CC1 ZINC000497479217 906960691 /nfs/dbraw/zinc/96/06/91/906960691.db2.gz YUKZUXMMASIUPI-RDJZCZTQSA-N 0 3 413.612 4.214 20 0 HIADHN Cc1cc(C(=O)NC[C@@H](c2cccs2)N2CCCC2)c(C)n1-c1nccs1 ZINC000512684860 921286670 /nfs/dbraw/zinc/28/66/70/921286670.db2.gz LBUNGHHUVMVAOL-KRWDZBQOSA-N 0 3 400.573 4.179 20 0 HIADHN Cc1nc2c(s1)[C@@H](N(C)C(=O)[C@@H]1CN(Cc3ccccc3)CCC1(F)F)CCC2 ZINC000512689994 921288444 /nfs/dbraw/zinc/28/84/44/921288444.db2.gz KKAOQBDTDSAYAE-HKUYNNGSSA-N 0 3 419.541 4.445 20 0 HIADHN O[C@H](COc1ccc(Cl)cc1Cl)CN(Cc1cccs1)C[C@H]1CCCO1 ZINC000497590204 907070394 /nfs/dbraw/zinc/07/03/94/907070394.db2.gz BVTFDONEPODFGR-JKSUJKDBSA-N 0 3 416.370 4.476 20 0 HIADHN CC(C)(C)[C@@H](CN1CCc2ccccc2C1)NC(=O)N1CCCC[C@@H]1c1cn[nH]c1 ZINC000497657386 907147736 /nfs/dbraw/zinc/14/77/36/907147736.db2.gz MPVAXXKCLGIMBL-FGZHOGPDSA-N 0 3 409.578 4.119 20 0 HIADHN O=C(CCOc1cccc(Br)c1)N[C@H](CN1CCCC1)c1ccccc1 ZINC000497722393 907221023 /nfs/dbraw/zinc/22/10/23/907221023.db2.gz BTBNFODLCDKSLL-HXUWFJFHSA-N 0 3 417.347 4.171 20 0 HIADHN COC(=O)CC1CCN(Cc2c(-c3ccc(Cl)cc3)nc3sccn23)CC1 ZINC000497728700 907227588 /nfs/dbraw/zinc/22/75/88/907227588.db2.gz YEDNFXMTHSUUAI-UHFFFAOYSA-N 0 3 403.935 4.491 20 0 HIADHN CCN(CC)[C@H](CNC(=O)C1(c2ccccc2C)CCOCC1)c1cccc(OC)c1 ZINC000497764681 907256466 /nfs/dbraw/zinc/25/64/66/907256466.db2.gz MOXAMALGFOXBQF-XMMPIXPASA-N 0 3 424.585 4.251 20 0 HIADHN Cc1oc(C(C)C)nc1C(=O)NC1CCN(CCOc2ccc(Cl)cc2)CC1 ZINC000512782905 921310341 /nfs/dbraw/zinc/31/03/41/921310341.db2.gz KXTWHANUGSEWKL-UHFFFAOYSA-N 0 3 405.926 4.033 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)NC[C@@H]2CCCO[C@@H]2C(C)(C)C)N(C)C)cc1 ZINC000497823283 907305586 /nfs/dbraw/zinc/30/55/86/907305586.db2.gz PUKXUUJSRNDGHS-BVSLBCMMSA-N 0 3 419.610 4.217 20 0 HIADHN Cc1cnc(CC(=O)N(CCN2CCCC2)Cc2ccc(Cl)c(Cl)c2)s1 ZINC000497859042 907337092 /nfs/dbraw/zinc/33/70/92/907337092.db2.gz DUVLOVBRDFNGAX-UHFFFAOYSA-N 0 3 412.386 4.425 20 0 HIADHN Cc1ccc(COc2ccc(CN3CCC(c4ccnn4CCO)CC3)cc2)cc1 ZINC000512811520 921316603 /nfs/dbraw/zinc/31/66/03/921316603.db2.gz HOZCLEQYHLOWNB-UHFFFAOYSA-N 0 3 405.542 4.142 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)c1cccc2ncccc21 ZINC000497893371 907366975 /nfs/dbraw/zinc/36/69/75/907366975.db2.gz YQBXDEOALMDCFI-UHFFFAOYSA-N 0 3 401.432 4.458 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)c1cc(-c2cccc(Cl)c2)no1 ZINC000497897488 907370600 /nfs/dbraw/zinc/37/06/00/907370600.db2.gz JHZKBKFOZQVOQG-UHFFFAOYSA-N 0 3 419.859 4.477 20 0 HIADHN CCc1nc(C(=O)Nc2cccc(CN(C)C)c2)nn1-c1c(Cl)cccc1Cl ZINC000497966111 907435452 /nfs/dbraw/zinc/43/54/52/907435452.db2.gz KIFIBJAOEVALAJ-UHFFFAOYSA-N 0 3 418.328 4.450 20 0 HIADHN COc1ccc([C@H](CNC(=O)CCOc2ccccc2Cl)N2CCCC2)cc1 ZINC000497982168 907459067 /nfs/dbraw/zinc/45/90/67/907459067.db2.gz KYUYPHGDOSSSPP-FQEVSTJZSA-N 0 3 402.922 4.071 20 0 HIADHN CCN(C(=O)c1cncc(Br)c1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000498007356 907495642 /nfs/dbraw/zinc/49/56/42/907495642.db2.gz AKFMOBSRUFOSQW-BEFAXECRSA-N 0 3 402.336 4.142 20 0 HIADHN CCN(C(=O)c1cccc(CN2CCCC2=O)c1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000498021271 907518242 /nfs/dbraw/zinc/51/82/42/907518242.db2.gz CLWFYANBVLUHMX-HYBUGGRVSA-N 0 3 419.569 4.107 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)N(CC(C)C)[C@@H](C)c2ccccc2Cl)CC1 ZINC000498031265 907533284 /nfs/dbraw/zinc/53/32/84/907533284.db2.gz USLIZENPMHDLGD-PMACEKPBSA-N 0 3 423.045 4.342 20 0 HIADHN CCCOc1ccc([C@H](C)NC(=O)N2CC[C@H]3CCN(C)C[C@@H]32)cc1OCCC ZINC000498129148 907648054 /nfs/dbraw/zinc/64/80/54/907648054.db2.gz YLWUTDSPFRONAC-NSHGMRRFSA-N 0 3 403.567 4.061 20 0 HIADHN CN1CCN(CCCNC(=O)c2occc2-c2ccccc2)[C@H](c2ccccc2)C1 ZINC000498133875 907652091 /nfs/dbraw/zinc/65/20/91/907652091.db2.gz ZCIMQQFAZFOBHQ-QHCPKHFHSA-N 0 3 403.526 4.055 20 0 HIADHN CCOc1ccccc1CN(C)C(=O)NC[C@H](c1ccc(OC(C)C)cc1)N(C)C ZINC000512839524 921342947 /nfs/dbraw/zinc/34/29/47/921342947.db2.gz SBKCVNBYVRWSGC-JOCHJYFZSA-N 0 3 413.562 4.317 20 0 HIADHN Cc1nn(-c2ccc(F)cc2F)c(C)c1CNCc1ccccc1Cn1ccnc1 ZINC000512845345 921349234 /nfs/dbraw/zinc/34/92/34/921349234.db2.gz KRXVWCWYGSPHLZ-UHFFFAOYSA-N 0 3 407.468 4.302 20 0 HIADHN O=C(N[C@@H](c1cccc(F)c1)c1ccccn1)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000498239726 907773466 /nfs/dbraw/zinc/77/34/66/907773466.db2.gz ONDAZEFIZIXKRT-UPVQGACJSA-N 0 3 418.516 4.274 20 0 HIADHN O=C(N[C@H](c1cccc(F)c1)c1ccccn1)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000498239725 907773788 /nfs/dbraw/zinc/77/37/88/907773788.db2.gz ONDAZEFIZIXKRT-LADGPHEKSA-N 0 3 418.516 4.274 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)NCc1ccccc1N1CCCCC1 ZINC000498483354 907952490 /nfs/dbraw/zinc/95/24/90/907952490.db2.gz JLHBICXGOFZSJF-UHFFFAOYSA-N 0 3 400.592 4.012 20 0 HIADHN COc1ccc(NC(=O)Nc2cccc(CN(C)C)c2)cc1Oc1ccc(C)nn1 ZINC000498490075 907963747 /nfs/dbraw/zinc/96/37/47/907963747.db2.gz ODFDEDZBZTVVSR-UHFFFAOYSA-N 0 3 407.474 4.292 20 0 HIADHN C[C@H](NC(=O)c1cccc(CN(C)C)c1)c1cccc(NC(=O)c2ccccc2)c1 ZINC000498573487 908030331 /nfs/dbraw/zinc/03/03/31/908030331.db2.gz URWRTQIKXMQHNQ-SFHVURJKSA-N 0 3 401.510 4.492 20 0 HIADHN C[C@@H](NC(=O)c1cccc(CN(C)C)c1)c1cccc(NC(=O)c2ccccc2)c1 ZINC000498573486 908031559 /nfs/dbraw/zinc/03/15/59/908031559.db2.gz URWRTQIKXMQHNQ-GOSISDBHSA-N 0 3 401.510 4.492 20 0 HIADHN O=C(Nc1ccc(Oc2nncc3ccccc32)cc1)[C@H]1CCCN1C1CCOCC1 ZINC000498575156 908032892 /nfs/dbraw/zinc/03/28/92/908032892.db2.gz GQIUGVQCIFDPPY-JOCHJYFZSA-N 0 3 418.497 4.004 20 0 HIADHN Cc1c2cccc(C)c2oc1C(=O)NCCCCN1CCN(Cc2ccccc2)CC1 ZINC000498612022 908058999 /nfs/dbraw/zinc/05/89/99/908058999.db2.gz HQNFNZLBDNIOIX-UHFFFAOYSA-N 0 3 419.569 4.377 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1CCN(Cc2ccccc2)[C@@H]1C)c1nc(C2CCCCC2)no1 ZINC000498705024 908128544 /nfs/dbraw/zinc/12/85/44/908128544.db2.gz CDCOFXURSSMVIM-SQGPQFPESA-N 0 3 411.550 4.141 20 0 HIADHN Cc1nc(C(=O)N(CCN(C)C)Cc2ccc(F)cc2)nn1-c1ccccc1C(C)C ZINC000498716875 908142197 /nfs/dbraw/zinc/14/21/97/908142197.db2.gz HMXSKCGIWFBFKQ-UHFFFAOYSA-N 0 3 423.536 4.042 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)c1sc(-c2ccccn2)nc1C ZINC000498720964 908147224 /nfs/dbraw/zinc/14/72/24/908147224.db2.gz RSWDIRISLDILII-LJQANCHMSA-N 0 3 421.570 4.035 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)NC[C@H]1CCCO[C@H]1c1ccc(C)cc1 ZINC000498722421 908147961 /nfs/dbraw/zinc/14/79/61/908147961.db2.gz XQXSIPDJPLQMOQ-PKTZIBPZSA-N 0 3 401.595 4.370 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)c1cnn(-c2ccccc2C)c1C ZINC000498723934 908149413 /nfs/dbraw/zinc/14/94/13/908149413.db2.gz BVHBBSTYDXADIP-JOCHJYFZSA-N 0 3 417.557 4.011 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)N2CCC(C(F)(F)F)CC2)N(C)C)cc1 ZINC000512901291 921393652 /nfs/dbraw/zinc/39/36/52/921393652.db2.gz IKGGOLKSJJVCHV-SFHVURJKSA-N 0 3 401.473 4.060 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)NC[C@H](c2cccnc2)C(C)C)N(C)C)cc1 ZINC000498901158 908308534 /nfs/dbraw/zinc/30/85/34/908308534.db2.gz YYVIEFDAYAKVAM-GOTSBHOMSA-N 0 3 412.578 4.211 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)NC2CCC3(CCOCC3)CC2)N(C)C)cc1 ZINC000498902599 908310231 /nfs/dbraw/zinc/31/02/31/908310231.db2.gz WFYHTNOHOVIAHO-JOCHJYFZSA-N 0 3 417.594 4.115 20 0 HIADHN COc1ccc(COc2cccc(F)c2)cc1NC(=O)N[C@H](C)C1=CCN(C)CC1 ZINC000512907179 921399283 /nfs/dbraw/zinc/39/92/83/921399283.db2.gz NIZKOJOGKOQGHJ-MRXNPFEDSA-N 0 3 413.493 4.185 20 0 HIADHN CCc1ccccc1N(C(C)=O)c1nc(CN2C[C@@H](C)N(CC)C[C@H]2C)cs1 ZINC000498913315 908322232 /nfs/dbraw/zinc/32/22/32/908322232.db2.gz GIGWOCWSOZHQSO-IAGOWNOFSA-N 0 3 400.592 4.305 20 0 HIADHN CC(C)[C@@H](NCc1cc(C(F)(F)F)ccc1N1CCN(C)CC1)c1ccc(F)cn1 ZINC000498916517 908325766 /nfs/dbraw/zinc/32/57/66/908325766.db2.gz DJJTXIMULQLHKD-OAQYLSRUSA-N 0 3 424.486 4.478 20 0 HIADHN CC(=O)N1CCN(CCC(=O)Nc2cc(Cl)ccc2Cl)CC12CCCCC2 ZINC000498919337 908327655 /nfs/dbraw/zinc/32/76/55/908327655.db2.gz RUUTUKVNSQPGOB-UHFFFAOYSA-N 0 3 412.361 4.189 20 0 HIADHN Brc1cc2cccnc2c(CN2CCC[C@@H](c3nnc(C4CC4)[nH]3)C2)c1 ZINC000498923044 908332359 /nfs/dbraw/zinc/33/23/59/908332359.db2.gz OIWPJJPFVPUDJF-OAHLLOKOSA-N 0 3 412.335 4.372 20 0 HIADHN CCN1C[C@@H](C)N(Cc2csc(N(C(C)=O)c3cccc(Cl)c3)n2)C[C@@H]1C ZINC000498928610 908338948 /nfs/dbraw/zinc/33/89/48/908338948.db2.gz ZEKXLRXXKVLPOH-LSDHHAIUSA-N 0 3 406.983 4.396 20 0 HIADHN Clc1ccc(-c2nnc(CN3CCC[C@@H](c4nc(C5CC5)n[nH]4)C3)o2)c(Cl)c1 ZINC000498930646 908340324 /nfs/dbraw/zinc/34/03/24/908340324.db2.gz VTVOMJBPWIOJSA-GFCCVEGCSA-N 0 3 419.316 4.419 20 0 HIADHN Clc1ccc(-c2nnc(CN3CCC[C@@H](c4n[nH]c(C5CC5)n4)C3)o2)c(Cl)c1 ZINC000498930646 908340342 /nfs/dbraw/zinc/34/03/42/908340342.db2.gz VTVOMJBPWIOJSA-GFCCVEGCSA-N 0 3 419.316 4.419 20 0 HIADHN CN(C)C(=O)[C@@H]1CCC[C@H](N[C@H](c2ccco2)c2ccc(Br)cc2)C1 ZINC000498938767 908345457 /nfs/dbraw/zinc/34/54/57/908345457.db2.gz DVSKYKFYKCPJJP-AYBZRNKSSA-N 0 3 405.336 4.368 20 0 HIADHN CCN1C[C@H](C)N(CC(=O)Nc2nc(-c3cc(C)c(C)cc3C)cs2)C[C@@H]1C ZINC000498944130 908349839 /nfs/dbraw/zinc/34/98/39/908349839.db2.gz ZMQACYRMPKIZIM-ROUUACIJSA-N 0 3 400.592 4.088 20 0 HIADHN CC[C@H](NC(=O)NC[C@H](c1ccc(OC(C)C)cc1)N(C)C)c1nc2ccccc2[nH]1 ZINC000512913854 921407340 /nfs/dbraw/zinc/40/73/40/921407340.db2.gz XOCAQLULJUGPIY-SIKLNZKXSA-N 0 3 423.561 4.403 20 0 HIADHN Cc1cn(-c2ccccc2Cl)nc1C(=O)NC1CCN(Cc2ccccc2)CC1 ZINC000499201474 908554593 /nfs/dbraw/zinc/55/45/93/908554593.db2.gz KBTRZLFPUDHECE-UHFFFAOYSA-N 0 3 408.933 4.229 20 0 HIADHN CN(C(=O)N[C@H](c1cccc(F)c1)c1ccccn1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000499317038 908690117 /nfs/dbraw/zinc/69/01/17/908690117.db2.gz QCIRTVZYLIRGCL-ISKFKSNPSA-N 0 3 418.516 4.226 20 0 HIADHN CN(C(=O)NCCc1csc(C(C)(C)C)n1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000499332101 908706230 /nfs/dbraw/zinc/70/62/30/908706230.db2.gz UYPDIPGCLHIOAE-HXUWFJFHSA-N 0 3 414.619 4.289 20 0 HIADHN COc1cc(C(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)ccc1OCC(C)C ZINC000499379030 908744475 /nfs/dbraw/zinc/74/44/75/908744475.db2.gz CAQMEEVBLBACFP-UHFFFAOYSA-N 0 3 420.500 4.212 20 0 HIADHN Cc1nn2c(CNC[C@@H](c3c(F)cccc3Cl)N3CCCC3)c(C)nc2s1 ZINC000499655470 908866301 /nfs/dbraw/zinc/86/63/01/908866301.db2.gz HUIUJIVPBDHENT-KRWDZBQOSA-N 0 3 407.946 4.127 20 0 HIADHN CSC[C@](C)(O)CNCc1c(C)nn(-c2ccccc2)c1Oc1cccc(F)c1 ZINC000499696781 908879545 /nfs/dbraw/zinc/87/95/45/908879545.db2.gz JABZDESQRLKIQB-JOCHJYFZSA-N 0 3 415.534 4.316 20 0 HIADHN Cc1nn(-c2ccccc2)c(Oc2cccc(F)c2)c1CNCC[C@H](C)[S@@](C)=O ZINC000499698143 908880172 /nfs/dbraw/zinc/88/01/72/908880172.db2.gz ABBQITNSVUKBDW-GUNSETOZSA-N 0 3 415.534 4.359 20 0 HIADHN Cc1nn2c(CNCCc3nc(-c4ccc(Cl)cc4)no3)c(C(C)C)nc2s1 ZINC000499698219 908880398 /nfs/dbraw/zinc/88/03/98/908880398.db2.gz CBYKGMQIROSKGF-UHFFFAOYSA-N 0 3 416.938 4.258 20 0 HIADHN CCN(CC)C(=O)c1ccc(NC(=O)CN[C@@H](C)c2ccc3c(c2)CCCC3)cc1 ZINC000499717577 908888010 /nfs/dbraw/zinc/88/80/10/908888010.db2.gz BDGZBOBLVRMLCF-SFHVURJKSA-N 0 3 407.558 4.337 20 0 HIADHN CCc1c(C)nn(-c2cccc(C(=O)N3C[C@@H](N(C)C)Cc4ccccc43)c2)c1C ZINC000499720319 908889248 /nfs/dbraw/zinc/88/92/48/908889248.db2.gz PMELHPHUXSERID-QFIPXVFZSA-N 0 3 402.542 4.185 20 0 HIADHN O=C(NCc1cccnc1OC1CCCC1)NC[C@@H](c1cccs1)N1CCCC1 ZINC000499769572 908910573 /nfs/dbraw/zinc/91/05/73/908910573.db2.gz JWBFNRDGMYNSCX-IBGZPJMESA-N 0 3 414.575 4.101 20 0 HIADHN CC(C)N(C)CC(=O)N[C@H](c1ccccc1)c1ccc2[nH]c(C(F)(F)F)nc2c1 ZINC000499858190 908992686 /nfs/dbraw/zinc/99/26/86/908992686.db2.gz CBGSZIJHYUPBIG-LJQANCHMSA-N 0 3 404.436 4.128 20 0 HIADHN CC(C)N(C)CC(=O)N[C@H](c1ccccc1)c1ccc2nc(C(F)(F)F)[nH]c2c1 ZINC000499858190 908992701 /nfs/dbraw/zinc/99/27/01/908992701.db2.gz CBGSZIJHYUPBIG-LJQANCHMSA-N 0 3 404.436 4.128 20 0 HIADHN Cc1nc(-c2ccc(Cl)s2)sc1C(=O)N(CCN(C)C)C[C@@H]1CCCO1 ZINC000499930838 909039891 /nfs/dbraw/zinc/03/98/91/909039891.db2.gz QBZIZTSGMUNWBW-ZDUSSCGKSA-N 0 3 413.996 4.016 20 0 HIADHN CN(Cc1cc(Br)ccc1F)C1CCN(C(=O)c2ccccc2)CC1 ZINC000513028382 921488324 /nfs/dbraw/zinc/48/83/24/921488324.db2.gz ZKKPVTCSIYUBLL-UHFFFAOYSA-N 0 3 405.311 4.325 20 0 HIADHN Cc1cc(Br)cc(C)c1N1CCC[C@H](NC/C=C\c2ccncc2)C1=O ZINC000513034783 921493404 /nfs/dbraw/zinc/49/34/04/921493404.db2.gz CXZJHTPLLPZLJP-UABKOXTMSA-N 0 3 414.347 4.259 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)c1csc(CCc2ccccc2)n1 ZINC000499976236 909421489 /nfs/dbraw/zinc/42/14/89/909421489.db2.gz CUSOJNMRYZPWRU-UHFFFAOYSA-N 0 3 411.546 4.271 20 0 HIADHN CCc1nnc(NC(=O)[C@H](C)[C@H](C)NCc2ccc(-c3ccncc3)cc2F)s1 ZINC000513040994 921500477 /nfs/dbraw/zinc/50/04/77/921500477.db2.gz MJEXMWNLVVHLOE-KGLIPLIRSA-N 0 3 413.522 4.055 20 0 HIADHN Fc1cccc(-c2noc([C@H]3CCCN(Cc4cnn(CC(F)(F)F)c4)C3)n2)c1 ZINC000513047234 921505980 /nfs/dbraw/zinc/50/59/80/921505980.db2.gz QEQNJYIMMCPNFL-HNNXBMFYSA-N 0 3 409.387 4.014 20 0 HIADHN CN(C)C[C@@H](NC(=O)N[C@H]1CC(C)(C)Oc2cc(F)ccc21)c1ccc(F)cc1 ZINC000500142446 909622665 /nfs/dbraw/zinc/62/26/65/909622665.db2.gz ORGWSQSRPIXBKF-RBUKOAKNSA-N 0 3 403.473 4.169 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N[C@@H]1CC(C)(C)Oc2cc(F)ccc21)c1ccco1 ZINC000500152916 909629898 /nfs/dbraw/zinc/62/98/98/909629898.db2.gz CUJAYFZOJZTOEO-QGTPRVQTSA-N 0 3 403.498 4.450 20 0 HIADHN CN(C)[C@H](CNC(=O)NCc1cccnc1Oc1cccc(F)c1)c1ccccc1 ZINC000500161443 909641945 /nfs/dbraw/zinc/64/19/45/909641945.db2.gz FCHYIGSAMUPYLW-OAQYLSRUSA-N 0 3 408.477 4.115 20 0 HIADHN COc1ccc(OC)c([C@H](C)NC(=O)[C@H](C)N[C@@H](C)c2ccc(SC)cc2)c1 ZINC000500238483 909727550 /nfs/dbraw/zinc/72/75/50/909727550.db2.gz PUMVZRQSQCKMJW-JYJNAYRXSA-N 0 3 402.560 4.342 20 0 HIADHN CCc1nnc(NC(=O)[C@H](C)[C@H](C)NCc2cc(Cl)c(OC)cc2Cl)s1 ZINC000513066049 921520703 /nfs/dbraw/zinc/52/07/03/921520703.db2.gz ZJJITHUILNPHLI-ZJUUUORDSA-N 0 3 417.362 4.169 20 0 HIADHN COCCn1cc(CNCc2ccc(-c3cccc(Br)c3)s2)cn1 ZINC000500373372 909821216 /nfs/dbraw/zinc/82/12/16/909821216.db2.gz ATHLOKWHMUVHKR-UHFFFAOYSA-N 0 3 406.349 4.310 20 0 HIADHN COCCn1cc(CNCc2ccc(-c3ccc(Br)cc3)s2)cn1 ZINC000500374321 909822210 /nfs/dbraw/zinc/82/22/10/909822210.db2.gz FBRIWEQKZLLKPD-UHFFFAOYSA-N 0 3 406.349 4.310 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)CCc2c[nH]c3ccc(C)cc23)cc1 ZINC000500377426 909824188 /nfs/dbraw/zinc/82/41/88/909824188.db2.gz HBMQCSCIIAMISV-XMMPIXPASA-N 0 3 405.542 4.371 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)CCc2c[nH]c3cc(C)ccc23)cc1 ZINC000500387936 909829033 /nfs/dbraw/zinc/82/90/33/909829033.db2.gz HSJLXHUHZUZNTE-XMMPIXPASA-N 0 3 405.542 4.371 20 0 HIADHN C[C@@H](C(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1)c1cn(C)c2ccccc12 ZINC000500396949 909834678 /nfs/dbraw/zinc/83/46/78/909834678.db2.gz OXUQYEQAJHAWKT-VAMGGRTRSA-N 0 3 411.590 4.020 20 0 HIADHN Brc1cnc(CN[C@H]2CCCC23CCOCC3)c(Br)c1 ZINC000500424329 909848288 /nfs/dbraw/zinc/84/82/88/909848288.db2.gz DLCUSNXBDBKZJW-AWEZNQCLSA-N 0 3 404.146 4.046 20 0 HIADHN CC(C)(C)[NH+]1CCC([N-]S(=O)(=O)c2csc(-c3ccc(Cl)cc3)n2)CC1 ZINC000500434520 909854107 /nfs/dbraw/zinc/85/41/07/909854107.db2.gz RECGYFOFNFWFDA-UHFFFAOYSA-N 0 3 413.996 4.005 20 0 HIADHN COc1ccc(CNCc2ccc(I)c(Cl)c2)cc1OC ZINC000500436747 909856255 /nfs/dbraw/zinc/85/62/55/909856255.db2.gz ADWJVBFNVUEJJI-UHFFFAOYSA-N 0 3 417.674 4.252 20 0 HIADHN Fc1ccc(Br)c(F)c1CNCC1CCN(CC(F)(F)F)CC1 ZINC000500447973 909865793 /nfs/dbraw/zinc/86/57/93/909865793.db2.gz SDHIASOBWJBPCQ-UHFFFAOYSA-N 0 3 401.217 4.091 20 0 HIADHN COc1cc(C(C)=O)ccc1OC[C@@H](O)CNC1(c2ccc(Cl)c(Cl)c2)CC1 ZINC000500457906 909870611 /nfs/dbraw/zinc/87/06/11/909870611.db2.gz RJVKDVPDCVREFY-INIZCTEOSA-N 0 3 424.324 4.223 20 0 HIADHN CCc1nnc(NC(=O)[C@@H](C)[C@@H](C)NCc2cc(Cl)ccc2OC(F)F)s1 ZINC000513081856 921534167 /nfs/dbraw/zinc/53/41/67/921534167.db2.gz HNIWSICLPSAJAW-VHSXEESVSA-N 0 3 418.897 4.108 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)C1CCC(OC[C@@H]2CCCO2)CC1 ZINC000500583233 909945368 /nfs/dbraw/zinc/94/53/68/909945368.db2.gz OUADTLSTFHKQCS-MXXWWZHRSA-N 0 3 416.606 4.014 20 0 HIADHN CCN1CCN(Cc2ccc(CNC(=O)N3CCC[C@H]3c3ccc(F)cc3)cc2)CC1 ZINC000500623021 909972631 /nfs/dbraw/zinc/97/26/31/909972631.db2.gz XMOFCCAREVDXEA-DEOSSOPVSA-N 0 3 424.564 4.010 20 0 HIADHN CCc1nnc(NC(=O)[C@H](C)[C@@H](C)NCc2ccc(-c3ccccc3F)o2)s1 ZINC000513093400 921542340 /nfs/dbraw/zinc/54/23/40/921542340.db2.gz AFVOQAGKEPNMGK-CHWSQXEVSA-N 0 3 402.495 4.253 20 0 HIADHN CC[C@@H](C)c1ccccc1N1C[C@H](C(=O)N(CC(C)C)C2CCN(C)CC2)CC1=O ZINC000500720046 910039120 /nfs/dbraw/zinc/03/91/20/910039120.db2.gz KKILNOKAXRRPFK-WOJBJXKFSA-N 0 3 413.606 4.132 20 0 HIADHN COC(=O)[C@@H](CNC(=O)Nc1cccc(CN(C)C)c1)Cc1ccc2ccccc2c1 ZINC000500744052 910054699 /nfs/dbraw/zinc/05/46/99/910054699.db2.gz DJINCVYKAYJAIR-JOCHJYFZSA-N 0 3 419.525 4.055 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000500784725 910077418 /nfs/dbraw/zinc/07/74/18/910077418.db2.gz BXPQSEJDSVABEY-UHFFFAOYSA-N 0 3 419.369 4.323 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)NCc2cc(Cl)sc2Cl)cc1 ZINC000500882949 910155652 /nfs/dbraw/zinc/15/56/52/910155652.db2.gz BPQRBMVLFVDAQE-CQSZACIVSA-N 0 3 402.347 4.166 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(C)c1CN1CCC[C@H](CNC(=O)c2ccccc2)C1 ZINC000513106331 921554828 /nfs/dbraw/zinc/55/48/28/921554828.db2.gz KMTWHKOMTLQWMD-HXUWFJFHSA-N 0 3 420.532 4.270 20 0 HIADHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)c1nc2ccccc2s1 ZINC000500979810 910215964 /nfs/dbraw/zinc/21/59/64/910215964.db2.gz VDNGBAMTQDOARJ-UHFFFAOYSA-N 0 3 418.360 4.263 20 0 HIADHN COc1ccc([C@H](CNC(=O)NCCc2ccc(F)cc2Cl)N2CCCC2)cc1 ZINC000501020457 910239534 /nfs/dbraw/zinc/23/95/34/910239534.db2.gz CGDQFKAFSBFFMI-NRFANRHFSA-N 0 3 419.928 4.167 20 0 HIADHN CCCN(C(=O)c1cnn(C2CCOCC2)c1C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000501135875 910316805 /nfs/dbraw/zinc/31/68/05/910316805.db2.gz QXELKIMGWHEHIE-QHCPKHFHSA-N 0 3 424.589 4.060 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCc2c(cnn2-c2ccccc2)C1)c1ccsc1 ZINC000501185163 910350384 /nfs/dbraw/zinc/35/03/84/910350384.db2.gz GQPQDHINSTYRNF-JOCHJYFZSA-N 0 3 423.586 4.085 20 0 HIADHN COc1cccc([C@H](CNC(=O)Nc2c(C)cc(N(C)C)cc2C)N2CCCC2)c1 ZINC000501191067 910354438 /nfs/dbraw/zinc/35/44/38/910354438.db2.gz YOLUAUUFJPFSIV-QFIPXVFZSA-N 0 3 410.562 4.337 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)CCc2nc(-c3ccc(Cl)cc3)no2)C1 ZINC000501236927 910393968 /nfs/dbraw/zinc/39/39/68/910393968.db2.gz VINCCCNEJFFXLR-UZLBHIALSA-N 0 3 424.932 4.274 20 0 HIADHN CN(Cc1ccccc1N1CCCC1)C(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000513135990 921576270 /nfs/dbraw/zinc/57/62/70/921576270.db2.gz QUIDZRZKRBWKQP-QFIPXVFZSA-N 0 3 409.549 4.297 20 0 HIADHN CC[C@@H](CNC(=O)N1CCc2[nH]c3ccccc3c2C1)N1CCc2ccccc2C1 ZINC000501326419 910471700 /nfs/dbraw/zinc/47/17/00/910471700.db2.gz JUSLKISIASVUBG-FQEVSTJZSA-N 0 3 402.542 4.073 20 0 HIADHN O=C(c1ccccc1)N1CCC(NCc2c(F)ccc(Br)c2F)CC1 ZINC000501386123 910516806 /nfs/dbraw/zinc/51/68/06/910516806.db2.gz JMZRDTLQDJEIBW-UHFFFAOYSA-N 0 3 409.274 4.122 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)c2cc3c(cccc3Br)[nH]2)CC1 ZINC000501388865 910519993 /nfs/dbraw/zinc/51/99/93/910519993.db2.gz CQNYCRDYNMAMPZ-UHFFFAOYSA-N 0 3 416.319 4.260 20 0 HIADHN CC[C@H](CNC(=O)NCc1cc(Br)cs1)N1CCc2ccccc2C1 ZINC000501408028 910542851 /nfs/dbraw/zinc/54/28/51/910542851.db2.gz SSPXCDRCCMNLCZ-QGZVFWFLSA-N 0 3 422.392 4.147 20 0 HIADHN COc1cccc(CN(Cc2cn(-c3ccccc3)nc2C)C2CCC(O)CC2)c1 ZINC000513148908 921586727 /nfs/dbraw/zinc/58/67/27/921586727.db2.gz JHYCUXOYULRSBC-UHFFFAOYSA-N 0 3 405.542 4.495 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)N[C@H]2CCCOc3c(Cl)cccc32)cc1 ZINC000501546252 910647589 /nfs/dbraw/zinc/64/75/89/910647589.db2.gz XREDDAVOXAHTIN-PMACEKPBSA-N 0 3 417.937 4.164 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1CCO[C@@H]1c1ccc(Cl)c(F)c1)[C@@H](c1ccccc1)N(C)C ZINC000501564193 910673397 /nfs/dbraw/zinc/67/33/97/910673397.db2.gz ACUQNXFQLUCXCY-MYDCNYLUSA-N 0 3 419.928 4.300 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)CC1(C(F)(F)F)CC1 ZINC000501667907 910745534 /nfs/dbraw/zinc/74/55/34/910745534.db2.gz WKMACJXKKFCOTI-KRWDZBQOSA-N 0 3 406.452 4.310 20 0 HIADHN Cc1cc(Br)ccc1NC(=O)NCCCN1CCc2ccccc2C1 ZINC000501718983 910789112 /nfs/dbraw/zinc/78/91/12/910789112.db2.gz NSRSOQQYVZRNFN-UHFFFAOYSA-N 0 3 402.336 4.327 20 0 HIADHN C[C@@H](c1ccccc1)N(C)C(=O)CN[C@@]1(Cc2ccc(C(F)(F)F)cc2)CCOC1 ZINC000513181422 921606063 /nfs/dbraw/zinc/60/60/63/921606063.db2.gz AMRUGGVWMMSPPN-HTAPYJJXSA-N 0 3 420.475 4.216 20 0 HIADHN CCOc1ccccc1NC(=O)CN[C@@]1(Cc2ccc(C(F)(F)F)cc2)CCOC1 ZINC000513182617 921608008 /nfs/dbraw/zinc/60/80/08/921608008.db2.gz HNROOWOROLQQBA-OAQYLSRUSA-N 0 3 422.447 4.034 20 0 HIADHN CN(Cc1ccc(OC(F)F)cc1)C(=O)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000501783494 910837461 /nfs/dbraw/zinc/83/74/61/910837461.db2.gz XYLOPRAUFWEQKY-FQEVSTJZSA-N 0 3 403.473 4.267 20 0 HIADHN Cc1cc(NC(=O)[C@@H](C)Cc2ccccc2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000501802359 910853778 /nfs/dbraw/zinc/85/37/78/910853778.db2.gz XAUFRCQZCBLJDT-CVDCTZTESA-N 0 3 402.542 4.456 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)CCc3ccc(-c4ccccc4)[nH]3)cc2)CC1 ZINC000513191737 921612683 /nfs/dbraw/zinc/61/26/83/921612683.db2.gz VFLGUFSLZYXTJJ-UHFFFAOYSA-N 0 3 416.569 4.391 20 0 HIADHN Cc1cc(C)n(-c2ccccc2NC(=O)N[C@@H](CN2CCCC2)c2ccccc2)n1 ZINC000501838242 910879326 /nfs/dbraw/zinc/87/93/26/910879326.db2.gz XCWPOHPCNFVLEZ-QFIPXVFZSA-N 0 3 403.530 4.448 20 0 HIADHN O=C(NCc1cc(Br)cs1)N[C@H](CN1CCCC1)c1ccccc1 ZINC000501848123 910882575 /nfs/dbraw/zinc/88/25/75/910882575.db2.gz IAVGIUJFFYQEIW-QGZVFWFLSA-N 0 3 408.365 4.147 20 0 HIADHN CCOc1cc2c(cc1CNC(=O)N[C@H](CN1CCCC1)c1ccccc1)O[C@@H](C)C2 ZINC000501852112 910884383 /nfs/dbraw/zinc/88/43/83/910884383.db2.gz UCEIDLJJFMTFTJ-PGRDOPGGSA-N 0 3 423.557 4.045 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)c3ccc(CCC(F)(F)F)cc3)CC2)C[C@H](C)O1 ZINC000501852867 910886064 /nfs/dbraw/zinc/88/60/64/910886064.db2.gz SCYOQBDZDKSTII-CALCHBBNSA-N 0 3 412.496 4.143 20 0 HIADHN Cc1ccc(C(=O)N2CCN(CC3CCCCC3)CC2)cc1NC(=O)c1ccco1 ZINC000501859969 910890840 /nfs/dbraw/zinc/89/08/40/910890840.db2.gz CBDVRVUTEAGWOV-UHFFFAOYSA-N 0 3 409.530 4.178 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)N[C@@H]1CCCc2cn(C3CCCC3)nc21 ZINC000501945042 910931081 /nfs/dbraw/zinc/93/10/81/910931081.db2.gz OIQKUVAMBIWNOI-OAQYLSRUSA-N 0 3 401.599 4.283 20 0 HIADHN CCN(C(=O)c1cnc2c(cnn2CC(C)C)c1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000501962425 910950387 /nfs/dbraw/zinc/95/03/87/910950387.db2.gz PQIDTUPUFQCUES-AUSIDOKSSA-N 0 3 419.573 4.385 20 0 HIADHN COc1ccc(C2(CN[C@@H](C)c3nnc(-c4ccc(C)cc4)o3)CCOCC2)cc1 ZINC000513205508 921622525 /nfs/dbraw/zinc/62/25/25/921622525.db2.gz OBLFYJZRXHGJPN-SFHVURJKSA-N 0 3 407.514 4.453 20 0 HIADHN C[C@H](NC[C@H]1CN(C(=O)c2ccccc2)[C@H]2CCN1C2)c1ccc(-c2ccccc2)o1 ZINC000502063699 911009371 /nfs/dbraw/zinc/00/93/71/911009371.db2.gz ZEWRSKMERVJNAL-VJBMBRPKSA-N 0 3 415.537 4.196 20 0 HIADHN Cc1cccc(NC(=O)CN[C@@]2(Cc3ccc(C(F)(F)F)cc3)CCOC2)c1C ZINC000513210904 921626242 /nfs/dbraw/zinc/62/62/42/921626242.db2.gz SRNNLNAMGPVATJ-OAQYLSRUSA-N 0 3 406.448 4.252 20 0 HIADHN C[C@H](CCc1ccc(Br)cc1)N[C@@H](C(=O)NC1CC1)c1ccccc1 ZINC000513209987 921626305 /nfs/dbraw/zinc/62/63/05/921626305.db2.gz MSYFFUSZSGNQLK-FOIQADDNSA-N 0 3 401.348 4.380 20 0 HIADHN C[C@H](CCc1ccc(Br)cc1)N[C@H](C(=O)NC1CC1)c1ccccc1 ZINC000513209989 921626664 /nfs/dbraw/zinc/62/66/64/921626664.db2.gz MSYFFUSZSGNQLK-QRWLVFNGSA-N 0 3 401.348 4.380 20 0 HIADHN C[C@@H]1[C@H](NC(=O)NCc2cccc(-c3cccnc3)c2)CCN1Cc1ccccc1 ZINC000502145342 911068234 /nfs/dbraw/zinc/06/82/34/911068234.db2.gz FJGWUWQGJXOQTN-NTKDMRAZSA-N 0 3 400.526 4.211 20 0 HIADHN COc1ccccc1[C@H](CNC(=O)N[C@H](C)[C@H](c1ccccc1)N(C)C)OC(C)C ZINC000502184504 911116360 /nfs/dbraw/zinc/11/63/60/911116360.db2.gz IDLHWVBEISYWMZ-YFXJRYMSSA-N 0 3 413.562 4.152 20 0 HIADHN Cc1cc(C)c(NC(=O)CCCN(CC(=O)N2CCCCCC2)C(C)C)c(C)c1 ZINC000513230444 921643350 /nfs/dbraw/zinc/64/33/50/921643350.db2.gz CIKCKLAYFPRYIM-UHFFFAOYSA-N 0 3 401.595 4.444 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)CN2C[C@@H](C)C[C@@H]2c2ccccc2)cc1OC ZINC000513241911 921651402 /nfs/dbraw/zinc/65/14/02/921651402.db2.gz MXGOFWYXKNOUKY-YUXAGFNASA-N 0 3 408.542 4.450 20 0 HIADHN Cc1nc2ccccc2nc1CN1CCC[C@H](c2n[nH]cc2NC(=O)C2CCCC2)C1 ZINC000502337484 911316920 /nfs/dbraw/zinc/31/69/20/911316920.db2.gz KCAFXXHLXUMUSR-SFHVURJKSA-N 0 3 418.545 4.170 20 0 HIADHN Cc1ccc([C@@H](C)N(C)C(=O)NCCCN2CCN(C)C[C@@H]2c2ccccc2)cc1 ZINC000502347035 911327385 /nfs/dbraw/zinc/32/73/85/911327385.db2.gz STVOXOIAFMDASN-ZJSXRUAMSA-N 0 3 408.590 4.076 20 0 HIADHN CN1CCN(CCCNC(=O)N2CCC[C@@H]2c2ccc(F)cc2)[C@@H](c2ccccc2)C1 ZINC000502353128 911333783 /nfs/dbraw/zinc/33/37/83/911333783.db2.gz JRUNURYKAMXTTK-DNQXCXABSA-N 0 3 424.564 4.051 20 0 HIADHN O=C(Nc1c[nH]nc1[C@@H]1CCCN(CCCOc2ccccc2)C1)c1ccccc1 ZINC000502357223 911340536 /nfs/dbraw/zinc/34/05/36/911340536.db2.gz FPRHOJGARINRMS-HXUWFJFHSA-N 0 3 404.514 4.311 20 0 HIADHN CSc1cccc(NC(=O)CNC(C)(C)COc2ncccc2C(F)(F)F)c1 ZINC000502375913 911362557 /nfs/dbraw/zinc/36/25/57/911362557.db2.gz MHEGCDRAJVDBJI-UHFFFAOYSA-N 0 3 413.465 4.208 20 0 HIADHN C[C@@H](NC(=O)N[C@H](CN(C)C)c1ccc(F)cc1)c1ccc(Br)s1 ZINC000502415160 911395789 /nfs/dbraw/zinc/39/57/89/911395789.db2.gz JOYFHVXHQNOKCH-BXUZGUMPSA-N 0 3 414.344 4.313 20 0 HIADHN O=C(Cc1csc(Cc2ccc(F)cc2)n1)NC[C@@H]1CCCN1Cc1ccccc1 ZINC000513255516 921661149 /nfs/dbraw/zinc/66/11/49/921661149.db2.gz PIDIVSCEZILTCX-QFIPXVFZSA-N 0 3 423.557 4.196 20 0 HIADHN NC(=O)CCC1CCN(Cc2c(-c3ccc(Cl)cc3)nc3sccn23)CC1 ZINC000502505904 911508846 /nfs/dbraw/zinc/50/88/46/911508846.db2.gz HKJLYPIUXTXBEP-UHFFFAOYSA-N 0 3 402.951 4.194 20 0 HIADHN O=C(CN[C@@H]1CCCC[C@H]1OC(F)F)Nc1nc(-c2ccc(F)c(F)c2)cs1 ZINC000502548166 911553248 /nfs/dbraw/zinc/55/32/48/911553248.db2.gz UCFXOHRJRNGZKX-UKRRQHHQSA-N 0 3 417.428 4.167 20 0 HIADHN CN(Cc1ccc(Cl)s1)C(=O)CN[C@@]1(Cc2ccc(Cl)cc2)CCOC1 ZINC000502548524 911557614 /nfs/dbraw/zinc/55/76/14/911557614.db2.gz VXOIXLZQFZNZPY-LJQANCHMSA-N 0 3 413.370 4.005 20 0 HIADHN O=S1(=O)CC[C@@H](NC[C@H]2CCCC(F)(F)C2)c2cc(Br)ccc21 ZINC000502573051 911577459 /nfs/dbraw/zinc/57/74/59/911577459.db2.gz CTJRKJZKEPMCLD-SMDDNHRTSA-N 0 3 408.308 4.083 20 0 HIADHN COc1cc(C)c([C@H](C)NC(=O)CN[C@@H](c2ccc(F)cc2)C(C)C)cc1OC ZINC000502578455 911585799 /nfs/dbraw/zinc/58/57/99/911585799.db2.gz JONYGGFNPCFIGT-QMHKHESXSA-N 0 3 402.510 4.315 20 0 HIADHN COc1cc([C@H](C)NC(=O)NC[C@@H](Cc2ccccc2)N(C)C)ccc1OC(C)C ZINC000502629418 911656929 /nfs/dbraw/zinc/65/69/29/911656929.db2.gz WZCUULPNVAHHBU-GHTZIAJQSA-N 0 3 413.562 4.016 20 0 HIADHN CN(C(=O)c1cc(-c2ccc(F)cc2)nc2onc(C3CC3)c21)C1CCN(C)CC1 ZINC000502715708 911747097 /nfs/dbraw/zinc/74/70/97/911747097.db2.gz LBMXDMLQYJPYPH-UHFFFAOYSA-N 0 3 408.477 4.073 20 0 HIADHN CCN1CC[C@H]2OCCN(C(=O)c3cccc(Oc4ccc(Cl)cc4)c3)[C@H]2C1 ZINC000502715061 911747566 /nfs/dbraw/zinc/74/75/66/911747566.db2.gz ZHDUZZFGROCIQZ-LEWJYISDSA-N 0 3 400.906 4.068 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)c1cc(C2CC2)nn1-c1ccccc1 ZINC000513294054 921691373 /nfs/dbraw/zinc/69/13/73/921691373.db2.gz MWHBEACLNPXAOP-QFIPXVFZSA-N 0 3 400.526 4.144 20 0 HIADHN CC(C)(O)CN1CCc2c(cccc2NC(=O)c2cnccc2Oc2ccccc2)C1 ZINC000502864919 911870980 /nfs/dbraw/zinc/87/09/80/911870980.db2.gz WILLFLRRXKFBFK-UHFFFAOYSA-N 0 3 417.509 4.255 20 0 HIADHN Cc1ccc([C@H](CNC(=O)CCc2cc3ccccc3[nH]c2=O)N2CCCC2)cc1 ZINC000502925857 911912102 /nfs/dbraw/zinc/91/21/02/911912102.db2.gz MWFVEMKIEJXVJZ-QHCPKHFHSA-N 0 3 403.526 4.135 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)CCc2cc3ccccc3[nH]c2=O)N2CCCC2)cc1 ZINC000502925856 911912796 /nfs/dbraw/zinc/91/27/96/911912796.db2.gz MWFVEMKIEJXVJZ-HSZRJFAPSA-N 0 3 403.526 4.135 20 0 HIADHN COc1ccc([C@H](CNC(=O)NC(C)(C)c2ccccc2OC)N2CCCC2)cc1 ZINC000502961298 911942723 /nfs/dbraw/zinc/94/27/23/911942723.db2.gz MSDXVGPRKKAJRF-NRFANRHFSA-N 0 3 411.546 4.075 20 0 HIADHN CCN1CCN([C@@H](C)CNC(=O)[C@H](Oc2cccc(C(C)C)c2)c2ccccc2)CC1 ZINC000503010793 911984399 /nfs/dbraw/zinc/98/43/99/911984399.db2.gz BPFVDDKOEZZNRN-SQJMNOBHSA-N 0 3 423.601 4.072 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)c3cnccc3Oc3ccccc3)CC2)C[C@H](C)O1 ZINC000503010441 911984576 /nfs/dbraw/zinc/98/45/76/911984576.db2.gz CALWMFCKLQZHLH-PMACEKPBSA-N 0 3 423.557 4.225 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3ccc(OC)cc3C(F)(F)F)cc2)CC1 ZINC000503039199 912008778 /nfs/dbraw/zinc/00/87/78/912008778.db2.gz OVIGFNOQWNGNIN-UHFFFAOYSA-N 0 3 407.436 4.108 20 0 HIADHN Cc1nccn1CCCN(C)CC(=O)N[C@H](c1ccccc1)c1cccc(Cl)c1 ZINC000503056153 912021105 /nfs/dbraw/zinc/02/11/05/912021105.db2.gz ZNZHJSVBKFYIEV-HSZRJFAPSA-N 0 3 410.949 4.073 20 0 HIADHN COc1ccc(C)cc1NC(=O)[C@@H](c1ccccc1)N(C)CCCn1ccnc1C ZINC000503073358 912040241 /nfs/dbraw/zinc/04/02/41/912040241.db2.gz FWUVOYATLHIMPS-HSZRJFAPSA-N 0 3 406.530 4.210 20 0 HIADHN Cc1nccn1CCCCN1CCN(Cc2csc(-c3ccc(F)cc3)n2)CC1 ZINC000503074322 912042732 /nfs/dbraw/zinc/04/27/32/912042732.db2.gz QYFOCJQCTJEFOZ-UHFFFAOYSA-N 0 3 413.566 4.052 20 0 HIADHN C[C@@H]1CCN(Cc2ccnc(-c3ccc(Br)cc3)n2)C[C@@H]1n1ccnc1 ZINC000503076581 912049446 /nfs/dbraw/zinc/04/94/46/912049446.db2.gz YPGGPGDTNYBXPM-BEFAXECRSA-N 0 3 412.335 4.186 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)c1csc(-c2ccc(F)c(F)c2)n1 ZINC000503155705 912120917 /nfs/dbraw/zinc/12/09/17/912120917.db2.gz GUSDPCORTQQGLS-UHFFFAOYSA-N 0 3 419.472 4.431 20 0 HIADHN c1csc(-c2noc(CCC[N@@H+]3CCC[C@@H]3c3nnc(-c4ccccc4)[n-]3)n2)c1 ZINC000503160002 912126917 /nfs/dbraw/zinc/12/69/17/912126917.db2.gz BOGPTAPFOJHAQI-MRXNPFEDSA-N 0 3 406.515 4.353 20 0 HIADHN c1csc(-c2noc(CCC[N@H+]3CCC[C@@H]3c3nnc(-c4ccccc4)[n-]3)n2)c1 ZINC000503160002 912126940 /nfs/dbraw/zinc/12/69/40/912126940.db2.gz BOGPTAPFOJHAQI-MRXNPFEDSA-N 0 3 406.515 4.353 20 0 HIADHN CN(C(=O)Nc1ccc(OCC2CC2)cc1)C1CCN(CCc2ccccn2)CC1 ZINC000503172484 912146911 /nfs/dbraw/zinc/14/69/11/912146911.db2.gz VHAMSUDKRYGEQH-UHFFFAOYSA-N 0 3 408.546 4.041 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)N3c4ccccc4C[C@@H]3C)CC2)c1 ZINC000503208950 912188889 /nfs/dbraw/zinc/18/88/89/912188889.db2.gz LNOIAPKLKQONNF-NRFANRHFSA-N 0 3 406.574 4.058 20 0 HIADHN C[C@@H](NC(=O)Nc1cccc(CN(C)C)c1)c1ccc(NC(=O)c2ccncc2)cc1 ZINC000506286770 914885071 /nfs/dbraw/zinc/88/50/71/914885071.db2.gz XBSXZYADTPUKJN-QGZVFWFLSA-N 0 3 417.513 4.278 20 0 HIADHN COC(=O)c1cc2cc(NC(=O)N[C@H]3CCN([C@@H](C)c4ccccc4)C3)ccc2o1 ZINC000506294898 914890612 /nfs/dbraw/zinc/89/06/12/914890612.db2.gz MYNSARXJYSSWGI-KXBFYZLASA-N 0 3 407.470 4.176 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)Nc2cccc(N3CCCCC3=O)c2)C1 ZINC000506296470 914891542 /nfs/dbraw/zinc/89/15/42/914891542.db2.gz ZAIOUQIKTPSOGT-WIYYLYMNSA-N 0 3 406.530 4.161 20 0 HIADHN Cc1[nH]c2ccccc2c1C1=CCN(Cc2ccccc2OCC(=O)N(C)C)CC1 ZINC000506415695 915024952 /nfs/dbraw/zinc/02/49/52/915024952.db2.gz KVCDXUWUJBRZBT-UHFFFAOYSA-N 0 3 403.526 4.233 20 0 HIADHN COc1ccccc1O[C@H]1CCCN(Cc2ccc(OCc3nccn3C)cc2)C1 ZINC000513368313 921742282 /nfs/dbraw/zinc/74/22/82/921742282.db2.gz VELLTUPKOCCHPX-NRFANRHFSA-N 0 3 407.514 4.051 20 0 HIADHN CCC(=O)Nc1ccc(C)c(NC(=O)[C@@H]2CN(Cc3ccccc3)CCC2(F)F)c1 ZINC000506476999 915079403 /nfs/dbraw/zinc/07/94/03/915079403.db2.gz LRSDLUUYZWZGAJ-IBGZPJMESA-N 0 3 415.484 4.439 20 0 HIADHN CN(C(=O)c1ccc(Oc2ccccc2)nc1)C1CCN(CCc2ccccn2)CC1 ZINC000513369525 921743665 /nfs/dbraw/zinc/74/36/65/921743665.db2.gz ASZPEMPHPFIUDS-UHFFFAOYSA-N 0 3 416.525 4.048 20 0 HIADHN CC(=O)Nc1cccc(CN2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)c1 ZINC000506484941 915090256 /nfs/dbraw/zinc/09/02/56/915090256.db2.gz GLFMSAUYGOUYOO-UHFFFAOYSA-N 0 3 403.885 4.288 20 0 HIADHN CC[C@@H](N[C@@H](C)C(=O)NC(=O)Nc1ccc(C)cc1C)c1ccc(OC)c(OC)c1 ZINC000506600796 915250086 /nfs/dbraw/zinc/25/00/86/915250086.db2.gz HJZJBCHNZOLPIX-FUHWJXTLSA-N 0 3 413.518 4.098 20 0 HIADHN CC[C@@H](N[C@@H](C)C(=O)NC12CC3CC(CC(C3)C1)C2)c1ccc(OC)c(OC)c1 ZINC000506662092 915337995 /nfs/dbraw/zinc/33/79/95/915337995.db2.gz KWMTWDUKFJQKSW-GBHQCPNNSA-N 0 3 400.563 4.218 20 0 HIADHN CC(C)CCOC1CCN(C(=O)[C@@H]2CN(Cc3ccccc3)CCC2(F)F)CC1 ZINC000506720510 915399013 /nfs/dbraw/zinc/39/90/13/915399013.db2.gz SVZXWIGPPAZQLA-NRFANRHFSA-N 0 3 408.533 4.198 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)c1cccc(C(=O)Nc2ccccc2)c1 ZINC000506743677 915431543 /nfs/dbraw/zinc/43/15/43/915431543.db2.gz MYLXNTJTAMKSOU-UHFFFAOYSA-N 0 3 419.500 4.282 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)cc1CN1CCC(C(=O)NCc2ccccc2)CC1 ZINC000506745332 915436979 /nfs/dbraw/zinc/43/69/79/915436979.db2.gz WONVHPLKCWVSHB-UHFFFAOYSA-N 0 3 422.960 4.363 20 0 HIADHN O=C(Nc1ccccc1)Nc1cccc(CNC(=O)N2CCN(C3CCCC3)CC2)c1 ZINC000506798572 915535386 /nfs/dbraw/zinc/53/53/86/915535386.db2.gz SOOWJIFIYDXJNV-UHFFFAOYSA-N 0 3 421.545 4.100 20 0 HIADHN Cc1cc(N2CCN(C)CC2)ccc1NS(=O)(=O)c1cccc(-c2ccccc2)c1 ZINC000506803713 915547137 /nfs/dbraw/zinc/54/71/37/915547137.db2.gz DDRMSBMAAGAEIJ-UHFFFAOYSA-N 0 3 421.566 4.215 20 0 HIADHN CCCCCNC(=O)C1CCN(Cc2c(C)nn(-c3ccc(F)cc3F)c2C)CC1 ZINC000506849231 915629450 /nfs/dbraw/zinc/62/94/50/915629450.db2.gz QJWVTSKWOZEPPY-UHFFFAOYSA-N 0 3 418.532 4.286 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N[C@@H](c3ccc(C)cc3)c3ccccn3)cc2)CC1 ZINC000506892588 915688155 /nfs/dbraw/zinc/68/81/55/915688155.db2.gz HHJWSXZSERRNER-VWLOTQADSA-N 0 3 414.553 4.051 20 0 HIADHN COCCc1ccc(S(=O)(=O)[N-]c2ccccc2C[N@H+](C)C2CCCCC2)cc1 ZINC000506902899 915701389 /nfs/dbraw/zinc/70/13/89/915701389.db2.gz NQCLTFQWEWCKHZ-UHFFFAOYSA-N 0 3 416.587 4.441 20 0 HIADHN COCCc1ccc(S(=O)(=O)[N-]c2ccccc2C[N@@H+](C)C2CCCCC2)cc1 ZINC000506902899 915701405 /nfs/dbraw/zinc/70/14/05/915701405.db2.gz NQCLTFQWEWCKHZ-UHFFFAOYSA-N 0 3 416.587 4.441 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)N(CCc1cccc(F)c1)C1CC1 ZINC000506915229 915714356 /nfs/dbraw/zinc/71/43/56/915714356.db2.gz GEEIUTNOASTHIR-FQEVSTJZSA-N 0 3 401.551 4.441 20 0 HIADHN CCOC(=O)c1c(NC(=O)N(C)CCN(C)C)sc(C)c1-c1ccc(F)cc1 ZINC000506953589 915759061 /nfs/dbraw/zinc/75/90/61/915759061.db2.gz NMPDSRKVMKNXSB-UHFFFAOYSA-N 0 3 407.511 4.065 20 0 HIADHN COc1cccc(CN(C)C(=O)CN[C@@H](c2ccc(F)cc2)C(C)(C)C)c1OC ZINC000507042414 915837418 /nfs/dbraw/zinc/83/74/18/915837418.db2.gz XJHMDGMQBAMUEF-QFIPXVFZSA-N 0 3 402.510 4.178 20 0 HIADHN CCCn1nccc1C1CCN(C(=O)NC[C@@H](c2cccs2)N2CCCC2)CC1 ZINC000507075281 915854683 /nfs/dbraw/zinc/85/46/83/915854683.db2.gz VVELVRVCYRGPBW-FQEVSTJZSA-N 0 3 415.607 4.081 20 0 HIADHN C/C=C\c1ccc(OCC(=O)N2CCCN(CCCc3ccccc3)CC2)c(OC)c1 ZINC000507096116 915867149 /nfs/dbraw/zinc/86/71/49/915867149.db2.gz AAAGWAIQKBGLSM-OQFOIZHKSA-N 0 3 422.569 4.274 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)N1CCC(N2CCc3ccccc32)CC1 ZINC000507097563 915868900 /nfs/dbraw/zinc/86/89/00/915868900.db2.gz PUANPTHIGKTMRH-XMMPIXPASA-N 0 3 418.585 4.060 20 0 HIADHN O=C(c1cnn(-c2ccc(Cl)cc2)c1)N1CCCN(CCCc2ccccc2)CC1 ZINC000507104027 915870719 /nfs/dbraw/zinc/87/07/19/915870719.db2.gz QBIXQWKZXSADRJ-UHFFFAOYSA-N 0 3 422.960 4.306 20 0 HIADHN CCOc1cc(CN(Cc2ccc(F)cc2)C(C)C)ccc1O[C@@H](C)C(=O)N(C)C ZINC000507171054 915915158 /nfs/dbraw/zinc/91/51/58/915915158.db2.gz RXRUSIHQRBJEHU-SFHVURJKSA-N 0 3 416.537 4.491 20 0 HIADHN COc1ccc([C@H]2CCCN2C(=O)CN2CC[C@@H](c3ccccc3C)C2)c(OC)c1 ZINC000507177361 915923273 /nfs/dbraw/zinc/92/32/73/915923273.db2.gz HAVLJEGWUTZXHF-AUSIDOKSSA-N 0 3 408.542 4.165 20 0 HIADHN COc1ccccc1C[C@@H](C)N(Cc1ccccc1)Cc1cc(=O)n2ccsc2n1 ZINC000507220780 915974003 /nfs/dbraw/zinc/97/40/03/915974003.db2.gz ZWOUCVYNLLCHQA-GOSISDBHSA-N 0 3 419.550 4.398 20 0 HIADHN C[C@H](N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1=O)c1ccc2n[nH]cc2c1 ZINC000507233223 915989121 /nfs/dbraw/zinc/98/91/21/915989121.db2.gz QCPCJAPUBZPPSL-DJJJIMSYSA-N 0 3 400.429 4.011 20 0 HIADHN CCCn1nccc1C1CCN(C(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)CC1 ZINC000507308324 916069983 /nfs/dbraw/zinc/06/99/83/916069983.db2.gz YFXLMYMSSULHFG-KNQAVFIVSA-N 0 3 409.578 4.018 20 0 HIADHN O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)N1CCO[C@@H](c2ccccc2Cl)C1 ZINC000507317406 916078247 /nfs/dbraw/zinc/07/82/47/916078247.db2.gz JVDRSSYPXXNYSX-DENIHFKCSA-N 0 3 413.949 4.088 20 0 HIADHN COCCSc1ccc([C@@H](C)N[C@H](C)C(=O)NCc2ccccc2Cl)cc1 ZINC000507464277 916231016 /nfs/dbraw/zinc/23/10/16/916231016.db2.gz MQRPSUFFEBTNCT-HZPDHXFCSA-N 0 3 406.979 4.434 20 0 HIADHN COCCSc1ccc([C@@H](C)N[C@H](C)C(=O)NCc2ccc(Cl)cc2)cc1 ZINC000507465912 916232842 /nfs/dbraw/zinc/23/28/42/916232842.db2.gz RDSPKUWRHNXKJU-HZPDHXFCSA-N 0 3 406.979 4.434 20 0 HIADHN Cc1nc(-c2ccc(Br)cc2)sc1[C@H](C)N[C@@H]1CCCCNC1=O ZINC000507482356 916251987 /nfs/dbraw/zinc/25/19/87/916251987.db2.gz QSALJHKDWHHCFY-XHDPSFHLSA-N 0 3 408.365 4.200 20 0 HIADHN COc1ccc(OC)c([C@H](C)NC(=O)[C@@H](C)N[C@H](C)c2ccc(SC)cc2)c1 ZINC000507486848 916254740 /nfs/dbraw/zinc/25/47/40/916254740.db2.gz PUMVZRQSQCKMJW-OWCLPIDISA-N 0 3 402.560 4.342 20 0 HIADHN CCc1c(C(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)cnn1-c1ccc(F)cc1 ZINC000507598853 916352591 /nfs/dbraw/zinc/35/25/91/916352591.db2.gz ITUNRCVKEJECGT-PXNSSMCTSA-N 0 3 406.505 4.139 20 0 HIADHN Cc1ccc(-n2nc(C(=O)N[C@H]3CCN([C@H](C)c4ccccc4)C3)c3c2CCC3)cc1 ZINC000507604607 916360776 /nfs/dbraw/zinc/36/07/76/916360776.db2.gz LWJOBGYJCJXDOC-CTNGQTDRSA-N 0 3 414.553 4.235 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3ccc(C(C)C)nc3)c(OCC)c2)CC1 ZINC000507609780 916367158 /nfs/dbraw/zinc/36/71/58/916367158.db2.gz FXBTUPREKHHUTL-UHFFFAOYSA-N 0 3 410.562 4.388 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)COc2ccc(Oc3ccccn3)cc2)C1 ZINC000507613879 916372465 /nfs/dbraw/zinc/37/24/65/916372465.db2.gz ACKMOYHAFQWKFC-TZIWHRDSSA-N 0 3 417.509 4.204 20 0 HIADHN Cc1noc([C@@H]2CCCN(C[C@H](O)CO[C@H](c3ccccc3)c3ccc(C)cc3)C2)n1 ZINC000507687121 916459236 /nfs/dbraw/zinc/45/92/36/916459236.db2.gz JEZWJMUWYXNIGM-TZRRMPRUSA-N 0 3 421.541 4.033 20 0 HIADHN O=S1(=O)CCC(CCNCc2csc(-c3ccc(C(F)(F)F)cc3)n2)CC1 ZINC000507817937 916615630 /nfs/dbraw/zinc/61/56/30/916615630.db2.gz ARXQLIMCDGROGF-UHFFFAOYSA-N 0 3 418.506 4.133 20 0 HIADHN CC(C)(CN[C@@H](C(=O)NC1CC1)c1ccccc1)c1cccc(Br)c1 ZINC000507847451 916663865 /nfs/dbraw/zinc/66/38/65/916663865.db2.gz ZFORCSLQEXHCAR-LJQANCHMSA-N 0 3 401.348 4.336 20 0 HIADHN COc1ccc(OC)c(CNCc2ccccc2-c2ccc(Cn3cncn3)cc2)c1 ZINC000507854123 916680612 /nfs/dbraw/zinc/68/06/12/916680612.db2.gz YHHADDIMWLHDMX-UHFFFAOYSA-N 0 3 414.509 4.300 20 0 HIADHN O=C(COc1ccccc1CN1CC=C(c2c[nH]c3ccccc32)CC1)N1CCCC1 ZINC000507857899 916688215 /nfs/dbraw/zinc/68/82/15/916688215.db2.gz FTXITNOXVWRRIP-UHFFFAOYSA-N 0 3 415.537 4.458 20 0 HIADHN COc1ccc(CCN[C@H](C(=O)N2CCCCC2)c2ccccc2)cc1OC(F)F ZINC000507880703 916721053 /nfs/dbraw/zinc/72/10/53/916721053.db2.gz QNEMAKLAUHXECY-NRFANRHFSA-N 0 3 418.484 4.183 20 0 HIADHN COc1cc(CN2CCC[C@H]2/C=C/c2ccccc2)ccc1OCC(=O)N1CCCC1 ZINC000507887085 916733428 /nfs/dbraw/zinc/73/34/28/916733428.db2.gz NPNCNUIJESXBOF-BWSGXRDBSA-N 0 3 420.553 4.374 20 0 HIADHN Cc1ccc(NC(=O)C2CCN(Cc3c[nH]nc3-c3cccc(Cl)c3)CC2)nc1 ZINC000508001533 916842974 /nfs/dbraw/zinc/84/29/74/916842974.db2.gz XCZQXAWFQSUEIX-UHFFFAOYSA-N 0 3 409.921 4.284 20 0 HIADHN O=C(CSCc1ccc(Cl)cc1)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000508057712 916883334 /nfs/dbraw/zinc/88/33/34/916883334.db2.gz JNSUEDWNGZFSGC-UHFFFAOYSA-N 0 3 418.990 4.416 20 0 HIADHN CCCN(C(=O)N[C@H]1CCCC12CCOCC2)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000508065935 916888847 /nfs/dbraw/zinc/88/88/47/916888847.db2.gz XWQFXTDXGHVFPI-GOTSBHOMSA-N 0 3 413.606 4.422 20 0 HIADHN O=C(CCc1nc2ccccc2s1)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000508068811 916892154 /nfs/dbraw/zinc/89/21/54/916892154.db2.gz FZKNCSRBPOPDQV-UHFFFAOYSA-N 0 3 409.555 4.072 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1ccc(OC(F)(F)F)cc1 ZINC000508073594 916895114 /nfs/dbraw/zinc/89/51/14/916895114.db2.gz XQGGCISKRXTNJU-UHFFFAOYSA-N 0 3 408.420 4.042 20 0 HIADHN CC(C)(CNC(=O)N[C@H](c1nccs1)c1ccccc1)N1CCc2ccccc2C1 ZINC000508127882 916946781 /nfs/dbraw/zinc/94/67/81/916946781.db2.gz LBHRBZQXADCESO-NRFANRHFSA-N 0 3 420.582 4.369 20 0 HIADHN Cc1ccc2[nH]c([C@H]3CCCN(C(=O)c4cccc(CN5CCCC5)c4)C3)nc2c1 ZINC000508237529 917056465 /nfs/dbraw/zinc/05/64/65/917056465.db2.gz PEMZZILYBXBTQD-NRFANRHFSA-N 0 3 402.542 4.487 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)N1CCC[C@H]1/C=C/c1ccccc1 ZINC000508296480 917105942 /nfs/dbraw/zinc/10/59/42/917105942.db2.gz DBCILZRICARHPZ-BYUVYSIJSA-N 0 3 419.569 4.031 20 0 HIADHN COc1ccc(NC(=O)C[C@@H](C)NCc2cc(Cl)c3c(c2)OCCCO3)cc1 ZINC000508323847 917127864 /nfs/dbraw/zinc/12/78/64/917127864.db2.gz BPZISOYIZXLUBF-CQSZACIVSA-N 0 3 404.894 4.017 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N2CCO[C@@H](c3ccccc3Cl)C2)N(C)C)cc1 ZINC000508391258 917186132 /nfs/dbraw/zinc/18/61/32/917186132.db2.gz JSCVDABFUTYRDG-LEWJYISDSA-N 0 3 401.938 4.034 20 0 HIADHN COCCN(Cc1cn(C)nc1-c1ccc2c(c1)OCCCO2)[C@H](C)c1ccccc1 ZINC000508542390 917322462 /nfs/dbraw/zinc/32/24/62/917322462.db2.gz FIBGYJVPDMKPOQ-LJQANCHMSA-N 0 3 421.541 4.458 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N2CCC(n3cc(Cl)cn3)CC2)N2CCCC2)cc1 ZINC000508546710 917325805 /nfs/dbraw/zinc/32/58/05/917325805.db2.gz ITKVELBOWGUPAI-OAQYLSRUSA-N 0 3 415.969 4.029 20 0 HIADHN O=C(N[C@@H]1CCc2cc(F)ccc21)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000508605854 917374866 /nfs/dbraw/zinc/37/48/66/917374866.db2.gz WKKUFSUHFWVWEI-TZIWHRDSSA-N 0 3 406.423 4.384 20 0 HIADHN CC(C)[C@H](NC(=O)N(C)C1CCN(CCc2ccccn2)CC1)c1ccc(F)cc1 ZINC000508647440 917412704 /nfs/dbraw/zinc/41/27/04/917412704.db2.gz GKUPUVYWSMWUPL-QHCPKHFHSA-N 0 3 412.553 4.266 20 0 HIADHN CC[C@H](C)NC(=O)[C@@H]1C[C@H](C)N(Cc2nnc(-c3ccccc3)o2)[C@H]2CCCC[C@@H]12 ZINC000508655856 917421550 /nfs/dbraw/zinc/42/15/50/917421550.db2.gz OVABGAWCCIQPIL-UGKANONSSA-N 0 3 410.562 4.421 20 0 HIADHN CC[C@H](C)NC(=O)[C@@H]1C[C@H](C)N(CC(=O)Nc2c(C)cccc2C)[C@@H]2CCCC[C@H]12 ZINC000508673168 917438211 /nfs/dbraw/zinc/43/82/11/917438211.db2.gz XJXCPXMZZYHWJC-VNXMGFANSA-N 0 3 413.606 4.426 20 0 HIADHN CC[C@@H](NCc1ccccc1Cn1cncn1)c1cc(F)cc(Br)c1 ZINC000508739393 917498654 /nfs/dbraw/zinc/49/86/54/917498654.db2.gz JZUKYQDAVNWARE-LJQANCHMSA-N 0 3 403.299 4.469 20 0 HIADHN CCN(CC1CCN(c2ccccn2)CC1)C(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C ZINC000508857336 917611718 /nfs/dbraw/zinc/61/17/18/917611718.db2.gz WWYCTJWVOGNULM-GBXCKJPGSA-N 0 3 423.605 4.021 20 0 HIADHN C[C@H](NC(=O)N1CCn2cccc2[C@@H]1c1ccccc1)[C@H](c1ccccc1)N(C)C ZINC000508873349 917627021 /nfs/dbraw/zinc/62/70/21/917627021.db2.gz TUGYBERRIIEZAG-IEXUWNMDSA-N 0 3 402.542 4.294 20 0 HIADHN Cc1cccc(NC(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)c1C(=O)N1CCCC1 ZINC000508889928 917643731 /nfs/dbraw/zinc/64/37/31/917643731.db2.gz DXBANKRTIPTNEP-XMSQKQJNSA-N 0 3 408.546 4.044 20 0 HIADHN C[C@H](NC(=O)N1CCC2(CC1)OCCc1ccsc12)[C@H](c1ccccc1)N(C)C ZINC000508891080 917646289 /nfs/dbraw/zinc/64/62/89/917646289.db2.gz GIWWMCUXSYHSOQ-FXAWDEMLSA-N 0 3 413.587 4.013 20 0 HIADHN COc1ccc(CN(C)C(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)cc1OC(F)F ZINC000508892327 917647411 /nfs/dbraw/zinc/64/74/11/917647411.db2.gz CGKXFQXIHGSMQI-QRWLVFNGSA-N 0 3 421.488 4.129 20 0 HIADHN COCCOc1ccc(NC(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)cc1Cl ZINC000508893035 917648008 /nfs/dbraw/zinc/64/80/08/917648008.db2.gz DLOZARSFGLWYEJ-QRWLVFNGSA-N 0 3 405.926 4.178 20 0 HIADHN COC[C@H](c1ccc(Cl)cc1)N(C)C(=O)N[C@H](C)[C@@H](c1ccccc1)N(C)C ZINC000508899774 917654612 /nfs/dbraw/zinc/65/46/12/917654612.db2.gz QMDLKCKCYXTGRN-HBGVWJBISA-N 0 3 403.954 4.360 20 0 HIADHN Cc1nc2ccccc2n1C[C@@H]1CCCN1C(=O)N[C@H](C)[C@H](c1ccccc1)N(C)C ZINC000508903797 917658365 /nfs/dbraw/zinc/65/83/65/917658365.db2.gz YDXLOFZHXYKRCR-UTSGNWPNSA-N 0 3 419.573 4.210 20 0 HIADHN Cc1nc2sccn2c(=O)c1CCN1CC=C(c2ccccc2C(F)(F)F)CC1 ZINC000508968193 917723859 /nfs/dbraw/zinc/72/38/59/917723859.db2.gz VWJILWCBUPUAME-UHFFFAOYSA-N 0 3 419.472 4.415 20 0 HIADHN CCC(=O)Nc1ccc(NC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)cc1 ZINC000508986212 917739801 /nfs/dbraw/zinc/73/98/01/917739801.db2.gz JEFKXXSXPQWMBQ-NRFANRHFSA-N 0 3 419.447 4.428 20 0 HIADHN CCCN(C)[C@H](CNC(=O)N(Cc1ccccn1)C1CC1)c1ccc(Cl)cc1 ZINC000509016733 917770534 /nfs/dbraw/zinc/77/05/34/917770534.db2.gz LLGXKEYHPIFOKH-OAQYLSRUSA-N 0 3 400.954 4.492 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)N1CCCC[C@@H]1c1nc(C)no1)c1ccc(Cl)cc1 ZINC000509041358 917795205 /nfs/dbraw/zinc/79/52/05/917795205.db2.gz VRTBUNQKDADHCY-MOPGFXCFSA-N 0 3 419.957 4.351 20 0 HIADHN CN(Cc1ccc(OC[C@H]2CCCO2)cc1)[C@H](CO)c1cccc(Br)c1 ZINC000509100466 917840351 /nfs/dbraw/zinc/84/03/51/917840351.db2.gz ZLVWTQUNYBPFOB-NHCUHLMSSA-N 0 3 420.347 4.172 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cccc(NC(=O)[C@@H]2C[C@H]2C)c1)c1cccc(OC)c1 ZINC000509116172 917851523 /nfs/dbraw/zinc/85/15/23/917851523.db2.gz WYTNIDQXNAXCCL-NLSFWIRASA-N 0 3 423.557 4.103 20 0 HIADHN COc1ccc(-c2nn(Cc3ccccc3)cc2CN2CCC[C@H](OC)C2)cc1OC ZINC000509135727 917863961 /nfs/dbraw/zinc/86/39/61/917863961.db2.gz GOOUTIYLCSADNZ-QFIPXVFZSA-N 0 3 421.541 4.226 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N[C@@H](CC(F)(F)F)c3ccc(F)cc3)cc2)CC1 ZINC000509294103 917975787 /nfs/dbraw/zinc/97/57/87/917975787.db2.gz NVNQUWRANLQYMB-FQEVSTJZSA-N 0 3 423.454 4.391 20 0 HIADHN Cc1cc(Br)cc(C)c1N1CCC[C@@H](N(C)CCC2CCOCC2)C1=O ZINC000509333632 918003578 /nfs/dbraw/zinc/00/35/78/918003578.db2.gz ZWTGHFHMJQSZOY-LJQANCHMSA-N 0 3 423.395 4.310 20 0 HIADHN CCC[N@H+](CC)Cc1ccc(C(=O)Nc2ccc(-c3nc(C)cc(=O)[n-]3)cc2)cc1 ZINC000509347035 918013043 /nfs/dbraw/zinc/01/30/43/918013043.db2.gz XTQPAUNUPNJBCZ-UHFFFAOYSA-N 0 3 404.514 4.230 20 0 HIADHN CCC[N@@H+](CC)Cc1ccc(C(=O)Nc2ccc(-c3nc(C)cc(=O)[n-]3)cc2)cc1 ZINC000509347035 918013055 /nfs/dbraw/zinc/01/30/55/918013055.db2.gz XTQPAUNUPNJBCZ-UHFFFAOYSA-N 0 3 404.514 4.230 20 0 HIADHN O=C(Nc1ccc(Cl)cn1)C1CCN(Cc2ccc(Oc3cnccn3)cc2)CC1 ZINC000509349393 918014382 /nfs/dbraw/zinc/01/43/82/918014382.db2.gz XLCRCHLAHGZDLV-UHFFFAOYSA-N 0 3 423.904 4.168 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)c1ccc2c(c1)[nH]c(=O)n2C1CCCC1 ZINC000509355073 918018970 /nfs/dbraw/zinc/01/89/70/918018970.db2.gz VJRAQOOJWGAWFU-UHFFFAOYSA-N 0 3 424.520 4.200 20 0 HIADHN Cc1noc([C@@H]2CCCN(Cc3cn(-c4ccc(Br)cc4)nc3C)C2)n1 ZINC000509354810 918019153 /nfs/dbraw/zinc/01/91/53/918019153.db2.gz CEODYYLRDNWIGL-OAHLLOKOSA-N 0 3 416.323 4.014 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N[C@@H](c2nccs2)c2ccccc2)N(C)C)cc1 ZINC000509369768 918035935 /nfs/dbraw/zinc/03/59/35/918035935.db2.gz FQEOMIWLWURTME-LEWJYISDSA-N 0 3 408.571 4.397 20 0 HIADHN Cc1ccccc1[C@H](OC[C@H](O)CN(C)Cc1ccc2c(c1)OCO2)c1ccccc1 ZINC000509372407 918037848 /nfs/dbraw/zinc/03/78/48/918037848.db2.gz MSABDJBWLVNITJ-ATIYNZHBSA-N 0 3 419.521 4.323 20 0 HIADHN COc1ccccc1OCCN(C)Cc1cn(-c2ccccc2)nc1-c1cccnc1 ZINC000509390859 918055970 /nfs/dbraw/zinc/05/59/70/918055970.db2.gz WREIMHIRDJHLFY-UHFFFAOYSA-N 0 3 414.509 4.454 20 0 HIADHN CCOC1CC(CN2CCN(CCOC(c3ccccc3)c3ccccc3)CC2)C1 ZINC000509398348 918066031 /nfs/dbraw/zinc/06/60/31/918066031.db2.gz DLLUGLBNEKJCKK-UHFFFAOYSA-N 0 3 408.586 4.225 20 0 HIADHN CC(C)(C)n1cc(CN[C@@H]2CC(=O)N3CCCC[C@@H]23)c(-c2ccccc2Cl)n1 ZINC000509422224 918083414 /nfs/dbraw/zinc/08/34/14/918083414.db2.gz BIGHWSZPGZHHFC-MOPGFXCFSA-N 0 3 400.954 4.202 20 0 HIADHN O=C(NCc1cccc(OC(F)F)c1)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000509488030 918134063 /nfs/dbraw/zinc/13/40/63/918134063.db2.gz KHXLUEZLZZJHBK-GOSISDBHSA-N 0 3 410.411 4.062 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)CCCc2nc(-c3cccs3)no2)C1 ZINC000509516977 918165145 /nfs/dbraw/zinc/16/51/45/918165145.db2.gz PHKHSAPYETXXBG-SJLPKXTDSA-N 0 3 410.543 4.073 20 0 HIADHN O=C([C@@H]1CCC[C@@H]2CCCC[C@@H]12)N1CCC[C@H](CN2CCN(c3ccccn3)CC2)C1 ZINC000509519745 918168582 /nfs/dbraw/zinc/16/85/82/918168582.db2.gz MAMMPLVTZMCIES-UEQSERJNSA-N 0 3 424.633 4.049 20 0 HIADHN O=C(Nc1cc(Cl)ccc1[O-])C1CC[NH+](Cc2cccc(-n3cccn3)c2)CC1 ZINC000509519348 918168952 /nfs/dbraw/zinc/16/89/52/918168952.db2.gz JKABFVHQPHKYFR-UHFFFAOYSA-N 0 3 410.905 4.082 20 0 HIADHN COc1ccccc1NC(=O)C1CCN(Cc2ccc(OC(C)C)c(OC)c2)CC1 ZINC000509562744 918212458 /nfs/dbraw/zinc/21/24/58/918212458.db2.gz ZFVRUSLACYYSSL-UHFFFAOYSA-N 0 3 412.530 4.342 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N1CCO[C@H](c2ccc(F)c(Cl)c2)C1)c1ccco1 ZINC000509566730 918215354 /nfs/dbraw/zinc/21/53/54/918215354.db2.gz GSXOXFLOTDWUHR-QMIHWGKISA-N 0 3 423.916 4.284 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N(Cc1cccs1)C[C@H]1CCCO1)c1ccco1 ZINC000509565771 918215740 /nfs/dbraw/zinc/21/57/40/918215740.db2.gz BCPIAMMGOSQDMF-SCTDSRPQSA-N 0 3 405.564 4.161 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)N1CCCc2c([nH]c3c2cccc3F)C1)c1ccco1 ZINC000509567286 918218373 /nfs/dbraw/zinc/21/83/73/918218373.db2.gz IOGBNQZCHOTVKA-DNVCBOLYSA-N 0 3 412.509 4.487 20 0 HIADHN CC[C@H](NC(=O)N(CCN(C)C)Cc1cccc(C)c1)c1ccc(OC)c(OC)c1 ZINC000509581389 918230103 /nfs/dbraw/zinc/23/01/03/918230103.db2.gz BUKWUQGKTKHZDC-NRFANRHFSA-N 0 3 413.562 4.237 20 0 HIADHN CCOc1c(OC)cc(CN[C@@H](C)c2ccc(NC(=O)NC(C)C)cc2)cc1OC ZINC000509586261 918234782 /nfs/dbraw/zinc/23/47/82/918234782.db2.gz MMYGEROJVXHHRJ-INIZCTEOSA-N 0 3 415.534 4.483 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N1CC[C@@](F)(c2cc(F)cc(F)c2)C1)c1ccco1 ZINC000509601664 918251565 /nfs/dbraw/zinc/25/15/65/918251565.db2.gz LLVXLRYHOYDVOE-XQAUZQBESA-N 0 3 409.452 4.267 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N1CC=C(c2c[nH]c3ncccc23)CC1)c1ccco1 ZINC000509611098 918258742 /nfs/dbraw/zinc/25/87/42/918258742.db2.gz MWDVLRHBNZYAAJ-JXFKEZNVSA-N 0 3 407.518 4.084 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N(Cc1ccccc1)CC1(O)CCCC1)c1ccco1 ZINC000509613068 918260069 /nfs/dbraw/zinc/26/00/69/918260069.db2.gz IAXYCDNGDQOJJI-FPOVZHCZSA-N 0 3 413.562 4.226 20 0 HIADHN CC[C@H](NC(=O)N1CCCN(Cc2ccccc2)CC1)c1ccc(OC)c(OC)c1 ZINC000509615338 918264247 /nfs/dbraw/zinc/26/42/47/918264247.db2.gz UNAHJEPXXDBLEE-NRFANRHFSA-N 0 3 411.546 4.072 20 0 HIADHN COc1ccc([C@H](CNCc2ccc(Sc3ccccn3)o2)N(C)C)cc1OC ZINC000509653822 918290485 /nfs/dbraw/zinc/29/04/85/918290485.db2.gz RJXJKIOSDCRDRK-SFHVURJKSA-N 0 3 413.543 4.236 20 0 HIADHN O=C(N[C@H](C[C@H]1CCOC1)c1ccccc1)N[C@H](CN1CCCC1)c1ccccc1 ZINC000509751268 918368575 /nfs/dbraw/zinc/36/85/75/918368575.db2.gz MXWBZDKXQAXLTA-AGILITTLSA-N 0 3 407.558 4.291 20 0 HIADHN O=C(N[C@H](C[C@H]1CCOC1)c1ccccc1)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000509751270 918369330 /nfs/dbraw/zinc/36/93/30/918369330.db2.gz MXWBZDKXQAXLTA-HUVFLSCGSA-N 0 3 407.558 4.291 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N[C@@H](C[C@@H]2CCOC2)c2ccccc2)C1 ZINC000509767862 918382429 /nfs/dbraw/zinc/38/24/29/918382429.db2.gz QUXUPGUIWCZTIE-SHBJFUFKSA-N 0 3 407.558 4.289 20 0 HIADHN CCCn1ccc2cc(NC(=O)NCc3ccc(CN4CCN(C)CC4)cc3)ccc21 ZINC000509833010 918434608 /nfs/dbraw/zinc/43/46/08/918434608.db2.gz QFVUERLSNGBAMR-UHFFFAOYSA-N 0 3 419.573 4.120 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)NCc3ccc(C[NH+]4CCCC4)cc3)cc2)cc(=O)[n-]1 ZINC000509843215 918444006 /nfs/dbraw/zinc/44/40/06/918444006.db2.gz DQELRVMJTPMQAG-UHFFFAOYSA-N 0 3 417.513 4.075 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)c1ccc2c(c1)[nH]c(=O)n2C1CCCC1 ZINC000509936822 918534654 /nfs/dbraw/zinc/53/46/54/918534654.db2.gz FYHRDXSGHVXKEU-UHFFFAOYSA-N 0 3 424.520 4.200 20 0 HIADHN O=C(COc1ccccc1)N1CC[C@@H](NCc2ccc(Cl)c(C(F)(F)F)c2)C1 ZINC000509963569 918554453 /nfs/dbraw/zinc/55/44/53/918554453.db2.gz KTMNECSEDWZEKR-OAHLLOKOSA-N 0 3 412.839 4.128 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)c1ccc(F)cc1Br ZINC000509981004 918569359 /nfs/dbraw/zinc/56/93/59/918569359.db2.gz DPQHXMMJKBJMEB-UHFFFAOYSA-N 0 3 407.327 4.225 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(C)c1CN[C@@H]1CCN(C(=O)Nc2ccccc2)C1 ZINC000509990822 918577805 /nfs/dbraw/zinc/57/78/05/918577805.db2.gz NSWHVKVKFOHCLB-HXUWFJFHSA-N 0 3 407.493 4.024 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(C)c1CN[C@H]1CCN(C(=O)Nc2ccccc2)C1 ZINC000509990821 918577916 /nfs/dbraw/zinc/57/79/16/918577916.db2.gz NSWHVKVKFOHCLB-FQEVSTJZSA-N 0 3 407.493 4.024 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cnn(CC(C)C)c3C3CC3)c(C)c2)CC1 ZINC000510001015 918584773 /nfs/dbraw/zinc/58/47/73/918584773.db2.gz YETINMIZVDTNHV-UHFFFAOYSA-N 0 3 409.578 4.119 20 0 HIADHN COCCOc1cccc(NC(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)c1 ZINC000510149677 918705567 /nfs/dbraw/zinc/70/55/67/918705567.db2.gz SWRKGVUISRILDW-FQEVSTJZSA-N 0 3 417.575 4.368 20 0 HIADHN CC[C@H](NCC(=O)N(CC)[C@@H](C)c1ccc(F)cc1)c1ccc(OC)c(OC)c1 ZINC000510245066 918782040 /nfs/dbraw/zinc/78/20/40/918782040.db2.gz UEEXUVCAGXTCFU-JXFKEZNVSA-N 0 3 402.510 4.493 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCC(=O)Nc1cccc2ccccc21)c1ccsc1 ZINC000510260114 918792113 /nfs/dbraw/zinc/79/21/13/918792113.db2.gz ULVLYBFUDGLNTJ-OAQYLSRUSA-N 0 3 424.570 4.222 20 0 HIADHN CCc1cc(C(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)c2c(n1)onc2C(C)C ZINC000510259542 918792466 /nfs/dbraw/zinc/79/24/66/918792466.db2.gz QWOCSMZRVJCUBD-LJQANCHMSA-N 0 3 406.530 4.255 20 0 HIADHN CCC1(c2nc(-c3ccc(CN(C)C)cc3)no2)CCN(C(=O)c2ccccc2)CC1 ZINC000510263004 918794927 /nfs/dbraw/zinc/79/49/27/918794927.db2.gz AHPSSPNNSYRZLP-UHFFFAOYSA-N 0 3 418.541 4.382 20 0 HIADHN Cc1cc2cccnc2c(NC(=O)N(C)C2CCN(CCc3ccccn3)CC2)c1 ZINC000510282408 918806101 /nfs/dbraw/zinc/80/61/01/918806101.db2.gz OVISNMSDOGXZAT-UHFFFAOYSA-N 0 3 403.530 4.109 20 0 HIADHN O=C(N[C@@H](CC(F)(F)F)c1ccc(F)cc1)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000510385812 918866169 /nfs/dbraw/zinc/86/61/69/918866169.db2.gz DJXNAPOGEPYMJF-OALUTQOASA-N 0 3 409.427 4.393 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)NCc1nn(-c2ccccc2)c2c1CCC2 ZINC000510449944 918907015 /nfs/dbraw/zinc/90/70/15/918907015.db2.gz AJTDJLDGINGDJA-UHFFFAOYSA-N 0 3 414.509 4.099 20 0 HIADHN CC[C@@H](C)C(=O)Nc1cccc(CNC(=O)c2oc3ccccc3c2CN(C)C)c1 ZINC000510494877 918941936 /nfs/dbraw/zinc/94/19/36/918941936.db2.gz XWXPZVXZRJZFHS-MRXNPFEDSA-N 0 3 407.514 4.409 20 0 HIADHN COc1cc([C@H](C)NC(=O)N[C@@H](C)C2=CCN(C)CC2)ccc1OC1CCCC1 ZINC000510499699 918947635 /nfs/dbraw/zinc/94/76/35/918947635.db2.gz ITNXCGKBJCIHRK-IRXDYDNUSA-N 0 3 401.551 4.027 20 0 HIADHN CCCCCOc1ccc([C@H](C)NC(=O)N[C@@H](C)C2=CCN(C)CC2)cc1OC ZINC000510502502 918950670 /nfs/dbraw/zinc/95/06/70/918950670.db2.gz QQJKUDBJRFHQTO-ROUUACIJSA-N 0 3 403.567 4.275 20 0 HIADHN CN(CCNC(=O)N(C)CCCc1cc(-c2ccccc2)no1)Cc1ccccc1 ZINC000510510219 918955820 /nfs/dbraw/zinc/95/58/20/918955820.db2.gz MBNMVVFWJVKASO-UHFFFAOYSA-N 0 3 406.530 4.048 20 0 HIADHN CN(C)[C@@H](CNC(=O)Nc1ccc(C(=O)NC2CCCCC2)cc1)Cc1ccccc1 ZINC000510522445 918967646 /nfs/dbraw/zinc/96/76/46/918967646.db2.gz HWCVCMCARMAEIM-HSZRJFAPSA-N 0 3 422.573 4.044 20 0 HIADHN Cc1n[nH]c(C)c1[C@H]1CCCCCN1C(=O)NC[C@H](c1ccccc1)N1CCCC1 ZINC000510526749 918972900 /nfs/dbraw/zinc/97/29/00/918972900.db2.gz UMOGFHUVOWUWGC-FGZHOGPDSA-N 0 3 409.578 4.490 20 0 HIADHN O=C(N[C@H](c1nccs1)c1ccccc1)N1CCCN(Cc2ccccc2)CC1 ZINC000510581670 919024417 /nfs/dbraw/zinc/02/44/17/919024417.db2.gz ZKKFWUGIYJPDDB-NRFANRHFSA-N 0 3 406.555 4.150 20 0 HIADHN COc1ccc([C@@H](CNC(=O)Nc2ccc(OC(F)F)c(F)c2)N2CCCC2)cc1 ZINC000510667230 919107831 /nfs/dbraw/zinc/10/78/31/919107831.db2.gz QMMFUFFNAWPRHH-GOSISDBHSA-N 0 3 423.435 4.394 20 0 HIADHN Cc1cccc([C@H](NCc2ccnc(N3CCN(C)CC3)c2)c2cccc(F)c2)c1 ZINC000510704647 919144075 /nfs/dbraw/zinc/14/40/75/919144075.db2.gz OIXCCYRUOSVHCH-VWLOTQADSA-N 0 3 404.533 4.160 20 0 HIADHN Cc1nc(C)c([C@H](C)N(C)C(=O)[C@H]2CN(Cc3ccccc3)CCC2(F)F)s1 ZINC000510705547 919144367 /nfs/dbraw/zinc/14/43/67/919144367.db2.gz WBKCBAHHIBSBRU-MAUKXSAKSA-N 0 3 407.530 4.437 20 0 HIADHN Cc1cc(OC(F)F)c(C(=O)NCC2(N3CCSCC3)CCCCC2)s1 ZINC000510743406 919190999 /nfs/dbraw/zinc/19/09/99/919190999.db2.gz SXVLCWWUHZKMTE-UHFFFAOYSA-N 0 3 404.548 4.139 20 0 HIADHN CC(C)c1nc(C(=O)N[C@H](C)C2=CCN(C)CC2)nn1-c1c(Cl)cccc1Cl ZINC000510788979 919255593 /nfs/dbraw/zinc/25/55/93/919255593.db2.gz WXHICPVSTKQJGT-CYBMUJFWSA-N 0 3 422.360 4.078 20 0 HIADHN CC(C)COc1cccc(CNCc2ccc(S(=O)(=O)N3CCCCC3)cc2)c1 ZINC000510857528 919346658 /nfs/dbraw/zinc/34/66/58/919346658.db2.gz RNSXNGROLGXOJX-UHFFFAOYSA-N 0 3 416.587 4.186 20 0 HIADHN Cc1c(C(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)cnn1C1CCCCC1 ZINC000510867037 919359120 /nfs/dbraw/zinc/35/91/20/919359120.db2.gz NXXHHRUZWSEJLD-UHFFFAOYSA-N 0 3 409.578 4.479 20 0 HIADHN Cc1cc(C)n(-c2ccc(NC(=O)NCCCN3CCc4ccccc4C3)cc2F)n1 ZINC000510868712 919361863 /nfs/dbraw/zinc/36/18/63/919361863.db2.gz MLBNNHIZZNVZED-UHFFFAOYSA-N 0 3 421.520 4.198 20 0 HIADHN CC(C)[C@@H](CNC(=O)Nc1ccc(-c2csnn2)cc1)N1CCc2ccccc2C1 ZINC000510875135 919369323 /nfs/dbraw/zinc/36/93/23/919369323.db2.gz VLJPSDGXQHDCAA-JOCHJYFZSA-N 0 3 421.570 4.410 20 0 HIADHN COc1ccc(C[C@@H](C)C(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)cc1OC ZINC000510883604 919379322 /nfs/dbraw/zinc/37/93/22/919379322.db2.gz YQMNBAZERWBVDW-WOJBJXKFSA-N 0 3 410.558 4.005 20 0 HIADHN Cc1nccn1CCCN[C@@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000510948614 919477248 /nfs/dbraw/zinc/47/72/48/919477248.db2.gz UIJRMMFXDFFVMI-NRFANRHFSA-N 0 3 417.962 4.018 20 0 HIADHN COC[C@H](N[C@@H]1CCN(C(=O)Nc2ccccc2)C1)c1cccc(C(F)(F)F)c1 ZINC000510970405 919516026 /nfs/dbraw/zinc/51/60/26/919516026.db2.gz VAFIJMLDOHJVGS-MOPGFXCFSA-N 0 3 407.436 4.289 20 0 HIADHN C[C@@H]1CN(Cc2ccccn2)CC[C@@H]1Nc1ccc(NC(=O)CC(F)(F)F)cc1 ZINC000510974524 919521130 /nfs/dbraw/zinc/52/11/30/919521130.db2.gz GMSDNROYZSNHPG-BEFAXECRSA-N 0 3 406.452 4.295 20 0 HIADHN C[C@H]1CN(Cc2ccccn2)CC[C@H]1Nc1ccc(NC(=O)CC(F)(F)F)cc1 ZINC000510974526 919523082 /nfs/dbraw/zinc/52/30/82/919523082.db2.gz GMSDNROYZSNHPG-HNAYVOBHSA-N 0 3 406.452 4.295 20 0 HIADHN Cc1c(C(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)cnn1C1CCCCC1 ZINC000511014580 919581466 /nfs/dbraw/zinc/58/14/66/919581466.db2.gz MPSWSOPHNYBFAG-UHFFFAOYSA-N 0 3 404.505 4.179 20 0 HIADHN Cc1nc(COc2ccc(F)cc2)sc1C(=O)N(CC(C)C)C1CCN(C)CC1 ZINC000511032438 919610885 /nfs/dbraw/zinc/61/08/85/919610885.db2.gz RJADHPXOPQFVLR-UHFFFAOYSA-N 0 3 419.566 4.362 20 0 HIADHN C[C@H](N[C@@H]1CCCN(C(=O)Cc2ccccc2)C1)c1ccc(F)cc1OC(F)F ZINC000511052979 919648100 /nfs/dbraw/zinc/64/81/00/919648100.db2.gz DBILWMCVRAHTHB-MAUKXSAKSA-N 0 3 406.448 4.311 20 0 HIADHN C[C@@H](CNC(=O)C1(c2ccc(C(C)(C)C)cc2)CCCCC1)CN1CCN(C)CC1 ZINC000511057326 919653234 /nfs/dbraw/zinc/65/32/34/919653234.db2.gz UARODBWQKCOMSA-NRFANRHFSA-N 0 3 413.650 4.186 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)c1cc2c(cccc2Br)[nH]1 ZINC000511077541 919679806 /nfs/dbraw/zinc/67/98/06/919679806.db2.gz TWKFYQQASFCSOL-HXUWFJFHSA-N 0 3 412.331 4.497 20 0 HIADHN CN(C)[C@@H](CNC(=O)Nc1cc(F)c(Br)cc1F)Cc1ccccc1 ZINC000511131075 919746637 /nfs/dbraw/zinc/74/66/37/919746637.db2.gz LOAJBUCWMQLTSF-CYBMUJFWSA-N 0 3 412.278 4.022 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)c1cccc(COc2cccc(F)c2)c1 ZINC000511156032 919776883 /nfs/dbraw/zinc/77/68/83/919776883.db2.gz GCXKRBXHBSEKIH-UHFFFAOYSA-N 0 3 407.489 4.004 20 0 HIADHN C[C@H]1CCCN(CCNC(=O)c2cccnc2Oc2ccc(Br)cc2)C1 ZINC000511157822 919778419 /nfs/dbraw/zinc/77/84/19/919778419.db2.gz DATGPNLVEBHGFU-HNNXBMFYSA-N 0 3 418.335 4.098 20 0 HIADHN C[C@@H]1CCCN(CCNC(=O)c2cccnc2Oc2cccc(Br)c2)C1 ZINC000511157875 919778795 /nfs/dbraw/zinc/77/87/95/919778795.db2.gz DIEAYHOELUOOCR-OAHLLOKOSA-N 0 3 418.335 4.098 20 0 HIADHN C[C@H]1CCCCN1C(=O)c1ccc(NC(=O)N(CCN(C)C)Cc2ccccc2)cc1 ZINC000511197745 919812496 /nfs/dbraw/zinc/81/24/96/919812496.db2.gz JBQLMRFQPRJSLZ-FQEVSTJZSA-N 0 3 422.573 4.297 20 0 HIADHN CC(C)CN(Cc1ccccc1Br)C(=O)N[C@H](C)C1=CCN(C)CC1 ZINC000511246859 919846964 /nfs/dbraw/zinc/84/69/64/919846964.db2.gz HUTDEPPBYYSCRQ-MRXNPFEDSA-N 0 3 408.384 4.267 20 0 HIADHN COCCN(C(=O)N[C@@H](C)C1=CCN(C)CC1)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000511295337 919891815 /nfs/dbraw/zinc/89/18/15/919891815.db2.gz UYEDVQBVMKXYBR-HOTGVXAUSA-N 0 3 413.484 4.075 20 0 HIADHN C[C@@H]1CCCCN1C(=O)c1ccc(NC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000511298827 919894874 /nfs/dbraw/zinc/89/48/74/919894874.db2.gz WQOPMELHXNOLMS-AUSIDOKSSA-N 0 3 420.557 4.097 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)N[C@@H](C[C@H]2CCOC2)c2ccccc2)CC1 ZINC000511363258 919957054 /nfs/dbraw/zinc/95/70/54/919957054.db2.gz NAJFQFFGIGROAY-RDGATRHJSA-N 0 3 421.585 4.460 20 0 HIADHN CCc1cccc2c3c([nH]c21)[C@](CC)(CC(=O)N[C@@H](C)C1=CCN(C)CC1)OCC3 ZINC000511368901 919960787 /nfs/dbraw/zinc/96/07/87/919960787.db2.gz IWHJAROQLIKRFP-GKVSMKOHSA-N 0 3 409.574 4.065 20 0 HIADHN CN(C)CCN(C[C@H]1CCCO1)C(=O)c1ccc(-c2cccc3cccnc32)cc1 ZINC000511379624 919981174 /nfs/dbraw/zinc/98/11/74/919981174.db2.gz OWLSHFNMXHBWEH-JOCHJYFZSA-N 0 3 403.526 4.085 20 0 HIADHN CC[C@H](NC(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F)c1nc2ccccc2[nH]1 ZINC000511493605 920103893 /nfs/dbraw/zinc/10/38/93/920103893.db2.gz MHSPBPFHWLBZQR-MSOLQXFVSA-N 0 3 412.484 4.288 20 0 HIADHN Cc1nn(C)c(C)c1NC(=O)[C@@H](C)N[C@H](c1cccc(OC(F)(F)F)c1)C1CC1 ZINC000511571556 920216109 /nfs/dbraw/zinc/21/61/09/920216109.db2.gz BDYZXTRSSUZTPL-XIKOKIGWSA-N 0 3 410.440 4.003 20 0 HIADHN CC(C)N(CC(F)(F)F)C(=O)CN[C@H](c1cccc(OC(F)(F)F)c1)C1CC1 ZINC000511607957 920256428 /nfs/dbraw/zinc/25/64/28/920256428.db2.gz ADWQJJPQYXPELG-INIZCTEOSA-N 0 3 412.374 4.425 20 0 HIADHN O=C(Nc1cccc(C(=O)N2CCCCC2)c1)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000511610693 920262817 /nfs/dbraw/zinc/26/28/17/920262817.db2.gz GIFDUAYKTASQJU-QHCPKHFHSA-N 0 3 420.557 4.099 20 0 HIADHN COc1ccc2nc(NC(=O)N(CCN(C)C)Cc3ccc(F)cc3)sc2c1 ZINC000511613687 920267068 /nfs/dbraw/zinc/26/70/68/920267068.db2.gz FOVFKUJFJPXHKB-UHFFFAOYSA-N 0 3 402.495 4.040 20 0 HIADHN Cc1cc(C)n(-c2ccc(CN[C@@](C)(CO)c3ccc(Br)cc3)cc2)n1 ZINC000511621830 920275775 /nfs/dbraw/zinc/27/57/75/920275775.db2.gz HYSRCANTVLCXEK-NRFANRHFSA-N 0 3 414.347 4.249 20 0 HIADHN CC(C)n1nccc1NC(=O)[C@H](C)N[C@@H](c1cccc(OC(F)(F)F)c1)C1CC1 ZINC000511623242 920282947 /nfs/dbraw/zinc/28/29/47/920282947.db2.gz NDLLJNVNMMLZSK-SCLBCKFNSA-N 0 3 410.440 4.431 20 0 HIADHN O=C(CN1C[C@H](c2ccccc2)[C@@H]2COCC[C@H]21)Nc1ccc(C(F)(F)F)cc1 ZINC000511668346 920335111 /nfs/dbraw/zinc/33/51/11/920335111.db2.gz SZYLAABWJOPRAD-HSALFYBXSA-N 0 3 404.432 4.148 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)c2ccc3c(c2)[nH]c(=O)n3C2CCCC2)C1 ZINC000511677056 920341935 /nfs/dbraw/zinc/34/19/35/920341935.db2.gz FJWOBVTZQWQLIA-FXAWDEMLSA-N 0 3 418.541 4.422 20 0 HIADHN O=C1NCCN1C1CCN(Cc2ccc(OCc3c(F)cccc3Cl)cc2)CC1 ZINC000511748490 920426405 /nfs/dbraw/zinc/42/64/05/920426405.db2.gz OSASHZJAFOCAME-UHFFFAOYSA-N 0 3 417.912 4.048 20 0 HIADHN O=C(NC1CCCCC1)NC1CCN(Cc2ccc(OCc3cccnc3)cc2)CC1 ZINC000511753636 920432066 /nfs/dbraw/zinc/43/20/66/920432066.db2.gz GJZHRGMARBFHEE-UHFFFAOYSA-N 0 3 422.573 4.257 20 0 HIADHN O=C(CN1C[C@H](c2ccccc2)[C@@H]2COCC[C@H]21)N(Cc1ccco1)c1ccccc1 ZINC000511764802 920448588 /nfs/dbraw/zinc/44/85/88/920448588.db2.gz ZILRIXNFGYHHNA-DSNGMDLFSA-N 0 3 416.521 4.317 20 0 HIADHN Cc1ncc(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2c2ccccc2)c(C2CC2)n1 ZINC000511771479 920458570 /nfs/dbraw/zinc/45/85/70/920458570.db2.gz WGUYHHOOUYUMFQ-BJKOFHAPSA-N 0 3 412.537 4.060 20 0 HIADHN O=C(Nc1ccccc1)NC1CCN(Cc2cccc(OCc3ccccn3)c2)CC1 ZINC000511775083 920462422 /nfs/dbraw/zinc/46/24/22/920462422.db2.gz GMHJDPDECTXTJH-UHFFFAOYSA-N 0 3 416.525 4.447 20 0 HIADHN Cn1c(CN2C[C@H](c3ccccc3)[C@@H]3COCC[C@@H]32)nnc1-c1ccc(Cl)cc1 ZINC000511775766 920464038 /nfs/dbraw/zinc/46/40/38/920464038.db2.gz SQKHBXNXZWYXAQ-HKBOAZHASA-N 0 3 408.933 4.140 20 0 HIADHN Cc1cc(C(=O)CN2C[C@H](c3ccccc3)[C@@H]3COCC[C@@H]32)c(C)n1-c1nccs1 ZINC000511781877 920472705 /nfs/dbraw/zinc/47/27/05/920472705.db2.gz UFZRINMSDMARKK-FSSWDIPSSA-N 0 3 421.566 4.238 20 0 HIADHN CC1(C)CN(Cc2ccccc2)CC[C@H]1NC(=O)CSCC(=O)c1ccccc1 ZINC000511782416 920474606 /nfs/dbraw/zinc/47/46/06/920474606.db2.gz AYKIGRTWYBXDNJ-JOCHJYFZSA-N 0 3 410.583 4.019 20 0 HIADHN Cc1ccc([C@H](NC(=O)CN2C[C@H](c3ccccc3)[C@@H]3COCC[C@@H]32)C2CC2)cc1 ZINC000511795935 920489755 /nfs/dbraw/zinc/48/97/55/920489755.db2.gz JITNOSHCRSXKID-APFRJGHOSA-N 0 3 404.554 4.067 20 0 HIADHN COCc1ccccc1/C=C(/C)CN[C@@H]1CC(=O)N(C)[C@@H]1c1ccc(F)c(F)c1 ZINC000511800096 920494896 /nfs/dbraw/zinc/49/48/96/920494896.db2.gz TZULGGUDGMZGRZ-AZBWFWNHSA-N 0 3 400.469 4.076 20 0 HIADHN CCN(C)[C@H](C(=O)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1 ZINC000511847268 920567747 /nfs/dbraw/zinc/56/77/47/920567747.db2.gz PYUYXLHABJHWDZ-SFTDATJTSA-N 0 3 419.491 4.089 20 0 HIADHN CC(C)[C@@H](NC(=O)N[C@H](C)CCN1CCN(C)CC1)c1ccc(C(C)(C)C)cc1 ZINC000511899272 920637360 /nfs/dbraw/zinc/63/73/60/920637360.db2.gz RHDJRHDTINKTKO-DENIHFKCSA-N 0 3 402.627 4.006 20 0 HIADHN Clc1ccc2[nH]cc(CCNCc3ncc(I)s3)c2c1 ZINC000512005359 920775322 /nfs/dbraw/zinc/77/53/22/920775322.db2.gz DJAJNAKDKJYARC-UHFFFAOYSA-N 0 3 417.703 4.215 20 0 HIADHN C[C@@H]1CC[C@H](C)N1CC(=O)N1CCC[C@H](Cc2nc(C3CCCCCC3)no2)C1 ZINC000512022987 920798967 /nfs/dbraw/zinc/79/89/67/920798967.db2.gz DIUMJXHDLUXCOA-CEXWTWQISA-N 0 3 402.583 4.161 20 0 HIADHN CCCOc1ccc(O[C@@H]2CCCC[C@H]2NCc2ncc(CN(C)C)s2)cc1 ZINC000512032273 920804190 /nfs/dbraw/zinc/80/41/90/920804190.db2.gz TYWUYWBTEJGBKZ-NHCUHLMSSA-N 0 3 403.592 4.473 20 0 HIADHN CN(C)Cc1cnc(CNC(Cc2ccccc2F)Cc2ccccc2F)s1 ZINC000512037723 920808888 /nfs/dbraw/zinc/80/88/88/920808888.db2.gz HITNZUYUPWAUPP-UHFFFAOYSA-N 0 3 401.526 4.427 20 0 HIADHN CCN1CCCC[C@H]1C(=O)N1CCC[C@@H](Cc2nc(C3CCCCCC3)no2)C1 ZINC000512055950 920825369 /nfs/dbraw/zinc/82/53/69/920825369.db2.gz HAQTXMWUTHJXGP-ICSRJNTNSA-N 0 3 402.583 4.163 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Cc1ccccc1Br)c1cccc(OC)c1 ZINC000512057077 920826948 /nfs/dbraw/zinc/82/69/48/920826948.db2.gz JGTMTVCUARSGFA-HXUWFJFHSA-N 0 3 419.363 4.200 20 0 HIADHN Cc1c([C@@H](C)N[C@H](C)CC(=O)Nc2cc(C(F)(F)F)ccc2Cl)cnn1C ZINC000512097395 920857776 /nfs/dbraw/zinc/85/77/76/920857776.db2.gz DKTRBJHHHMQVSH-GHMZBOCLSA-N 0 3 402.848 4.469 20 0 HIADHN C[C@@H](CC(=O)Nc1cc(C(F)(F)F)ccc1Cl)N[C@@H]1c2ccccc2C[C@@H]1O ZINC000512106673 920863825 /nfs/dbraw/zinc/86/38/25/920863825.db2.gz OZXZGCIWIGPMRB-WOVYWWTOSA-N 0 3 412.839 4.324 20 0 HIADHN COc1ccc([C@@H](CNC(=O)NCC(C)(C)c2cccs2)N2CCCC2)cc1 ZINC000512118171 920871395 /nfs/dbraw/zinc/87/13/95/920871395.db2.gz GXVOKHMRVLOFGE-LJQANCHMSA-N 0 3 401.576 4.171 20 0 HIADHN COc1cc(C(=O)N[C@@H](C)C2=CCN(C)CC2)ccc1OCc1ccccc1Cl ZINC000512126251 920875536 /nfs/dbraw/zinc/87/55/36/920875536.db2.gz XXFYHAZRHDUHGX-INIZCTEOSA-N 0 3 414.933 4.308 20 0 HIADHN Cc1nc(COc2ccc(Cl)cc2)sc1C(=O)N[C@H](C)C1=CCN(C)CC1 ZINC000512130758 920879275 /nfs/dbraw/zinc/87/92/75/920879275.db2.gz BAGWFKPMOQGPKX-CYBMUJFWSA-N 0 3 405.951 4.064 20 0 HIADHN Cc1cc([C@H](C)NCc2ccc(N3CCO[C@H](C)C3)nc2)sc1Br ZINC000512135229 920882584 /nfs/dbraw/zinc/88/25/84/920882584.db2.gz HAIPLCXVWASXJY-KGLIPLIRSA-N 0 3 410.381 4.290 20 0 HIADHN C[C@H]1CSC[C@@H]1NCC(=O)Nc1nc(-c2ccc(Cl)cc2Cl)cs1 ZINC000512180224 920921127 /nfs/dbraw/zinc/92/11/27/920921127.db2.gz NIXMSKMLZQWWLG-ZANVPECISA-N 0 3 402.372 4.397 20 0 HIADHN OCC[C@@H](NC[C@H](O)COc1ccccc1Cl)c1ccc(Cl)c(Cl)c1 ZINC000512202461 920948178 /nfs/dbraw/zinc/94/81/78/920948178.db2.gz KMZLXRXMLWRVIZ-SUMWQHHRSA-N 0 3 404.721 4.100 20 0 HIADHN Cc1cc2cc(CNC(=O)N(CCN(C)C)Cc3ccc(F)cc3F)ccc2[nH]1 ZINC000512211657 920957162 /nfs/dbraw/zinc/95/71/62/920957162.db2.gz HQLYOBIDWKTLFP-UHFFFAOYSA-N 0 3 400.473 4.028 20 0 HIADHN Fc1ccc(-n2cc(CN[C@@H]3CCN(c4cccc(OC(F)(F)F)c4)C3)cn2)cc1 ZINC000512241542 920998121 /nfs/dbraw/zinc/99/81/21/920998121.db2.gz KNIGVXNZUNDBQB-QGZVFWFLSA-N 0 3 420.410 4.279 20 0 HIADHN CCCN(Cc1nc2c(cccc2F)n1CC)C1CCN(c2cc(C)nc(C)n2)CC1 ZINC000512283491 921038315 /nfs/dbraw/zinc/03/83/15/921038315.db2.gz QHACOSSNQDPFGE-UHFFFAOYSA-N 0 3 424.568 4.483 20 0 HIADHN CC(=O)N(C)C1CCN(Cc2ccc(OC(F)(F)[C@@H](F)C(F)(F)F)cc2)CC1 ZINC000512292653 921048034 /nfs/dbraw/zinc/04/80/34/921048034.db2.gz IOQWUOJWIVULNY-INIZCTEOSA-N 0 3 412.374 4.001 20 0 HIADHN CNC(=O)c1ccc(CN(C)CCOc2ccc(OCc3ccccc3)cc2)cc1 ZINC000512329623 921078488 /nfs/dbraw/zinc/07/84/88/921078488.db2.gz RJTYZWASICVPIR-UHFFFAOYSA-N 0 3 404.510 4.136 20 0 HIADHN CC(C)CN(C(=O)c1cnn(-c2ccc(C(F)(F)F)cc2)c1)C1CCN(C)CC1 ZINC000512334607 921081672 /nfs/dbraw/zinc/08/16/72/921081672.db2.gz VSCYPPSODHXFNQ-UHFFFAOYSA-N 0 3 408.468 4.084 20 0 HIADHN CCOC(=O)c1sc(NC(=O)c2ccc(CN(C)C)cc2)nc1-c1ccccc1 ZINC000512359268 921101855 /nfs/dbraw/zinc/10/18/55/921101855.db2.gz DGXNQOCIVDWNQQ-UHFFFAOYSA-N 0 3 409.511 4.301 20 0 HIADHN COC(=O)[C@@H](NC1CCN([C@@H](C)c2ccncc2)CC1)c1cccc(Cl)c1Cl ZINC000513456992 921822354 /nfs/dbraw/zinc/82/23/54/921822354.db2.gz HAZIVMNMVPIHHV-XOBRGWDASA-N 0 3 422.356 4.418 20 0 HIADHN COCC1CCN(Cc2cn(-c3ccccc3)nc2-c2cc(OC)ccc2OC)CC1 ZINC000513466441 921828957 /nfs/dbraw/zinc/82/89/57/921828957.db2.gz FVFHANITQJRNKZ-UHFFFAOYSA-N 0 3 421.541 4.415 20 0 HIADHN O[C@@H](CN[C@H]1CCSc2ccc(Br)cc21)COc1ccc(F)cc1 ZINC000513472481 921831280 /nfs/dbraw/zinc/83/12/80/921831280.db2.gz FXPVWPXRFRRFNG-YOEHRIQHSA-N 0 3 412.324 4.155 20 0 HIADHN O=C(NCc1coc(-c2ccccc2)n1)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000513479306 921837260 /nfs/dbraw/zinc/83/72/60/921837260.db2.gz KKIUNULPGWADRW-FQEVSTJZSA-N 0 3 411.452 4.115 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)c1ccc(Oc2ccccc2)nc1 ZINC000513494970 921845641 /nfs/dbraw/zinc/84/56/41/921845641.db2.gz KTUSFNSXLJAKOB-UHFFFAOYSA-N 0 3 411.452 4.356 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2CN[C@@H](Cc2ccccn2)c2cccnc2)C[C@H](C)O1 ZINC000513498530 921848129 /nfs/dbraw/zinc/84/81/29/921848129.db2.gz AMTIQPGAEIPMCR-UZINWLIJSA-N 0 3 416.569 4.159 20 0 HIADHN Cc1nc([C@H]2CCCOC2)sc1C(=O)N[C@@H](CN(C)C)c1ccc(Cl)cc1 ZINC000513574367 921906208 /nfs/dbraw/zinc/90/62/08/921906208.db2.gz WIIBRTNFPOCHDC-RDJZCZTQSA-N 0 3 407.967 4.032 20 0 HIADHN O=C(NC[C@H]1CCCN1Cc1ccccc1)c1ccc2c(c1)[nH]c(=O)n2C1CCCC1 ZINC000513599239 921930684 /nfs/dbraw/zinc/93/06/84/921930684.db2.gz XQHQQDOFYJHHJX-OAQYLSRUSA-N 0 3 418.541 4.251 20 0 HIADHN COc1ccc(CCNC(=O)CN2CCC[C@H]2c2cccc3ccccc32)cc1OC ZINC000513679137 921999690 /nfs/dbraw/zinc/99/96/90/921999690.db2.gz UZKSUGCCXXFRSQ-QHCPKHFHSA-N 0 3 418.537 4.353 20 0 HIADHN CC(C)(C)O[C@@H](C(=O)NCCCCN1CCN(c2ccccc2)CC1)c1ccccc1 ZINC000513724228 922044111 /nfs/dbraw/zinc/04/41/11/922044111.db2.gz ZUPSUFLFBQZHRZ-XMMPIXPASA-N 0 3 423.601 4.261 20 0 HIADHN CC(C)(CCC(=O)Nc1cccc(CN2CCC(C(N)=O)CC2)c1)c1ccccc1 ZINC000513726890 922047155 /nfs/dbraw/zinc/04/71/55/922047155.db2.gz BUCARQNFXCKWND-UHFFFAOYSA-N 0 3 407.558 4.080 20 0 HIADHN CS(=O)(=O)Nc1ccc(CN[C@@H]2CC3(CCCCC3)Oc3ccccc32)cc1 ZINC000513786289 922112392 /nfs/dbraw/zinc/11/23/92/922112392.db2.gz CYMCNPGSWNABIC-HXUWFJFHSA-N 0 3 400.544 4.374 20 0 HIADHN COc1ccc([C@H](CNC(=O)Cc2cccc3ccc(OC)cc32)N2CCCC2)cc1 ZINC000513806170 922130355 /nfs/dbraw/zinc/13/03/55/922130355.db2.gz DSASNMXRGZFCGF-VWLOTQADSA-N 0 3 418.537 4.353 20 0 HIADHN CS(=O)(=O)c1ccc(OCCN[C@H]2CC3(CCCCC3)Oc3ccccc32)cc1 ZINC000513829473 922156146 /nfs/dbraw/zinc/15/61/46/922156146.db2.gz CXWYWQLDKJZMCX-NRFANRHFSA-N 0 3 415.555 4.285 20 0 HIADHN Cc1noc(C)c1[C@H](C)CC(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1 ZINC000513855750 922180827 /nfs/dbraw/zinc/18/08/27/922180827.db2.gz KEHAYMWLDRJTLP-CQSZACIVSA-N 0 3 411.468 4.394 20 0 HIADHN Cc1noc(C)c1[C@H](C)CC(=O)N(CCN(C)C)Cc1ccc(Br)cc1 ZINC000513857410 922183902 /nfs/dbraw/zinc/18/39/02/922183902.db2.gz LHWRSXHIBPLHDI-CQSZACIVSA-N 0 3 422.367 4.138 20 0 HIADHN O=C(Nc1cccc(CN[C@H]2CCc3c2cccc3Br)c1)[C@@H]1CCCO1 ZINC000513873514 922203385 /nfs/dbraw/zinc/20/33/85/922203385.db2.gz ZELFQAJBFAHEOE-PMACEKPBSA-N 0 3 415.331 4.344 20 0 HIADHN CN(Cc1cccc(Br)c1)C(=O)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000513881566 922210798 /nfs/dbraw/zinc/21/07/98/922210798.db2.gz RPQZXPWWPKOQLJ-FQEVSTJZSA-N 0 3 416.363 4.428 20 0 HIADHN Cc1nn(-c2ccccc2C)c(C)c1CN(C)C[C@@H]1CCN(C(=O)c2ccccc2)C1 ZINC000513903116 922226421 /nfs/dbraw/zinc/22/64/21/922226421.db2.gz ALHSKSMBZHNKEB-QFIPXVFZSA-N 0 3 416.569 4.392 20 0 HIADHN Cc1n[nH]c(C)c1NC(=O)CN(Cc1ccc2c(c1)OCO2)[C@@H]1CCC[C@@H](C)[C@@H]1C ZINC000513958405 922276290 /nfs/dbraw/zinc/27/62/90/922276290.db2.gz QCKDPFDIASNNDJ-ZRGWGRIASA-N 0 3 412.534 4.021 20 0 HIADHN COc1ccc2cccc(CC(=O)N3CCC(CCN4C[C@@H](C)O[C@@H](C)C4)CC3)c2c1 ZINC000514011274 922334953 /nfs/dbraw/zinc/33/49/53/922334953.db2.gz MIXDSKDUBIESCP-BGYRXZFFSA-N 0 3 424.585 4.129 20 0 HIADHN Cc1noc(C)c1[C@H](C)CC(=O)NC1CCN(CCOc2ccc(Cl)cc2)CC1 ZINC000514011454 922335128 /nfs/dbraw/zinc/33/51/28/922335128.db2.gz OVLMFTHXCHYUCS-OAHLLOKOSA-N 0 3 419.953 4.098 20 0 HIADHN CC[S@@](=O)c1ccccc1C(=O)NCC1(CC)CCN(Cc2ccccc2)CC1 ZINC000514042119 922363239 /nfs/dbraw/zinc/36/32/39/922363239.db2.gz AUYOSXVGGBSJCY-GDLZYMKVSA-N 0 3 412.599 4.236 20 0 HIADHN CCCN(C(=O)NCc1ccc(NC(C)=O)cc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000514062745 922387719 /nfs/dbraw/zinc/38/77/19/922387719.db2.gz JRGRPHHCRDQYOD-DEOSSOPVSA-N 0 3 422.573 4.231 20 0 HIADHN Cc1cc(C(=O)NC2CCN(Cc3cccc(OCc4ccccn4)c3)CC2)c(C)o1 ZINC000514085376 922408488 /nfs/dbraw/zinc/40/84/88/922408488.db2.gz UVGCIYVZGQXKHO-UHFFFAOYSA-N 0 3 419.525 4.265 20 0 HIADHN Cc1csc2nc(CN(Cc3ccc(Br)cc3)C(C)C)cc(=O)n12 ZINC000514101152 922428334 /nfs/dbraw/zinc/42/83/34/922428334.db2.gz ZDGIWDXGBHSSHW-UHFFFAOYSA-N 0 3 406.349 4.238 20 0 HIADHN C[C@@H](NCc1ccc(N2CCc3ccccc3C2)nc1)c1ccccc1-n1ccnn1 ZINC000514106530 922435431 /nfs/dbraw/zinc/43/54/31/922435431.db2.gz ZEWSPCIURDWQBG-LJQANCHMSA-N 0 3 410.525 4.076 20 0 HIADHN CC(C)N(Cc1cccs1)C(=O)NCCCN1CCN(C)C[C@H]1c1ccccc1 ZINC000514107186 922437680 /nfs/dbraw/zinc/43/76/80/922437680.db2.gz ICTAKXZLYYIUEQ-QFIPXVFZSA-N 0 3 414.619 4.047 20 0 HIADHN CC(C)(C)N(CC(=O)Nc1ccc(F)cc1)C[C@H]1CCN(C(=O)c2ccccc2)C1 ZINC000514114478 922445905 /nfs/dbraw/zinc/44/59/05/922445905.db2.gz HBECYQSGCTVBPV-SFHVURJKSA-N 0 3 411.521 4.027 20 0 HIADHN CC(C)COc1cccc(CNC(=O)NC[C@H](c2cccs2)N2CCCC2)c1 ZINC000514158849 922497359 /nfs/dbraw/zinc/49/73/59/922497359.db2.gz XBSUKQQJBHRWEE-HXUWFJFHSA-N 0 3 401.576 4.419 20 0 HIADHN O=C(NCCc1ccccc1C(F)(F)F)NC[C@@H](c1cccs1)N1CCCC1 ZINC000514176496 922515145 /nfs/dbraw/zinc/51/51/45/922515145.db2.gz QNTMEVONZZPBIH-KRWDZBQOSA-N 0 3 411.493 4.446 20 0 HIADHN COc1c(C)cc(CN(C)C(=O)NC[C@H](c2cccs2)N2CCCC2)cc1C ZINC000514178858 922517026 /nfs/dbraw/zinc/51/70/26/922517026.db2.gz CEGPHXCLOQSNPF-LJQANCHMSA-N 0 3 401.576 4.352 20 0 HIADHN CCCCN(CC(=O)N1CCC(C(=O)N(C)C(C)C)CC1)[C@@H](CC)c1ccccc1 ZINC000514182225 922522175 /nfs/dbraw/zinc/52/21/75/922522175.db2.gz GEOBJTVTCPOSFS-QHCPKHFHSA-N 0 3 415.622 4.345 20 0 HIADHN C[C@H](Cc1cccc(O)c1)NC(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1 ZINC000514182284 922522242 /nfs/dbraw/zinc/52/22/42/922522242.db2.gz JYHKFYWHUQQWFM-XLIONFOSSA-N 0 3 401.576 4.157 20 0 HIADHN Cc1ccc(-c2ccc(C(=O)Nc3ccccc3CN3CCC[C@H](C(N)=O)C3)s2)o1 ZINC000514226646 922563080 /nfs/dbraw/zinc/56/30/80/922563080.db2.gz KXPQZCIZUPBXOS-KRWDZBQOSA-N 0 3 423.538 4.266 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)c2ccccc2OCc2cscn2)N(C)C)cc1 ZINC000514353192 922605218 /nfs/dbraw/zinc/60/52/18/922605218.db2.gz QWMTXYUEROPTMD-OAQYLSRUSA-N 0 3 409.555 4.317 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N[C@@H](C)c1ccc(OC)c(F)c1)c1cccc(OC)c1 ZINC000514535920 922683256 /nfs/dbraw/zinc/68/32/56/922683256.db2.gz KOVRSPUWBXIGBJ-KKSFZXQISA-N 0 3 417.525 4.286 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)NC[C@@H](c2ccccc2)N2CCCC2)cc1OC ZINC000514566768 922703662 /nfs/dbraw/zinc/70/36/62/922703662.db2.gz NRGSXIQHVBVJMB-VXKWHMMOSA-N 0 3 423.557 4.387 20 0 HIADHN CN(C)C[C@H](NC(=O)CCCc1ccc(Br)s1)c1ccc(F)cc1 ZINC000514626185 922728864 /nfs/dbraw/zinc/72/88/64/922728864.db2.gz RWRVTNWDWFOFPO-INIZCTEOSA-N 0 3 413.356 4.392 20 0 HIADHN COc1cccc2c1CCC[C@@H]2N[C@H]1CCCN(Cc2ccc(F)cc2F)C1=O ZINC000514650632 922745940 /nfs/dbraw/zinc/74/59/40/922745940.db2.gz KPDMHBOOXHAEDV-SFTDATJTSA-N 0 3 400.469 4.132 20 0 HIADHN CSc1ccc([C@H](CNC[C@@H](O)C(F)(F)F)N2CCc3sccc3C2)cc1 ZINC000514700723 922765818 /nfs/dbraw/zinc/76/58/18/922765818.db2.gz LFAKDCPCHFEXAE-FUHWJXTLSA-N 0 3 416.534 4.082 20 0 HIADHN CO[C@@H](C)c1nc(C)c(C(=O)NC[C@H](c2ccc(CC(C)C)cc2)N(C)C)s1 ZINC000514749794 922781878 /nfs/dbraw/zinc/78/18/78/922781878.db2.gz CRVODDLNIQMCRE-QFBILLFUSA-N 0 3 403.592 4.390 20 0 HIADHN CSc1ccc([C@H](CNC(=O)[C@@H](C)[C@@H]2OCCc3sccc32)N(C)C)cc1 ZINC000514967265 922857674 /nfs/dbraw/zinc/85/76/74/922857674.db2.gz YQICMASJPCGAQL-DCPHZVHLSA-N 0 3 404.601 4.139 20 0 HIADHN O=C(CCOc1cccc(Br)c1)NC[C@H](c1cccs1)N1CCCC1 ZINC000515081636 922897295 /nfs/dbraw/zinc/89/72/95/922897295.db2.gz LJSNBJKSWSBDNC-QGZVFWFLSA-N 0 3 423.376 4.233 20 0 HIADHN CN(CCCCN1C(=O)c2ccccc2C1=O)Cc1cc(Br)cs1 ZINC000515135660 922942809 /nfs/dbraw/zinc/94/28/09/922942809.db2.gz BKRXMJKMLDGKGO-UHFFFAOYSA-N 0 3 407.333 4.019 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)C(=O)Nc1cc(Cl)cc2cccnc21)c1ccccc1 ZINC000515150562 922953132 /nfs/dbraw/zinc/95/31/32/922953132.db2.gz ABVOLYGZBLCZKJ-FQEVSTJZSA-N 0 3 424.932 4.026 20 0 HIADHN CCN(CC)[C@H](CNC(=O)C(=O)Nc1cc(Cl)cc(Cl)c1)c1ccccc1 ZINC000515150798 922953719 /nfs/dbraw/zinc/95/37/19/922953719.db2.gz LCASGLYIQIFOBI-GOSISDBHSA-N 0 3 408.329 4.131 20 0 HIADHN Cc1nc2sccn2c1-c1noc([C@@H]2CN(Cc3ccccc3)CCC2(F)F)n1 ZINC000515183244 922974300 /nfs/dbraw/zinc/97/43/00/922974300.db2.gz SAVJVBRAUQRBDJ-HNNXBMFYSA-N 0 3 415.469 4.379 20 0 HIADHN Cc1cc(I)ccc1NC(=O)NC[C@H](c1ccccc1)N(C)C ZINC000515227033 923004193 /nfs/dbraw/zinc/00/41/93/923004193.db2.gz SGZVJVLJQBQXLP-QGZVFWFLSA-N 0 3 423.298 4.024 20 0 HIADHN Cc1cccc(Oc2ccccc2NC(=O)C(=O)NCC(C)(C)N2CCCCC2)c1 ZINC000515265276 923026200 /nfs/dbraw/zinc/02/62/00/923026200.db2.gz AFSICEGPNUEZHN-UHFFFAOYSA-N 0 3 409.530 4.107 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1nnc(-c2ccccc2)s1)c1ccsc1 ZINC000515385454 923075770 /nfs/dbraw/zinc/07/57/70/923075770.db2.gz RZENIFXOMLWNKX-INIZCTEOSA-N 0 3 401.561 4.471 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)c1cc(F)c(F)cc1Br)c1ccco1 ZINC000515696292 923278139 /nfs/dbraw/zinc/27/81/39/923278139.db2.gz IQFQLTQUYZLSTP-BONVTDFDSA-N 0 3 401.251 4.180 20 0 HIADHN C[C@@H](NC(=O)N1CCN(CCC(C)(C)C)CC1)c1cccc(OCc2ccccn2)c1 ZINC000515791269 923352326 /nfs/dbraw/zinc/35/23/26/923352326.db2.gz PPFPWCXLOGHQEF-HXUWFJFHSA-N 0 3 424.589 4.485 20 0 HIADHN CC[C@@H](NC(=O)NC[C@H](c1ccccc1)N1CCCC1)c1ccc2c(c1)OCCO2 ZINC000515865642 923398663 /nfs/dbraw/zinc/39/86/63/923398663.db2.gz QAHKFBUBDLRHLW-NHCUHLMSSA-N 0 3 409.530 4.045 20 0 HIADHN CC(C)n1ncc2cc(C(=O)NC[C@@H](c3ccccc3)N3CCC(C)CC3)cnc21 ZINC000515981715 923476268 /nfs/dbraw/zinc/47/62/68/923476268.db2.gz MTZBXEUIOPFHCK-QFIPXVFZSA-N 0 3 405.546 4.215 20 0 HIADHN CCOC(=O)c1[nH]c(C)c(C(=O)NC[C@H](c2ccccc2)N2CCC(C)CC2)c1C ZINC000516138744 923569076 /nfs/dbraw/zinc/56/90/76/923569076.db2.gz LBRXHJMGAVWQPY-HXUWFJFHSA-N 0 3 411.546 4.011 20 0 HIADHN CO[C@H](CNC(=O)NC[C@H](c1cccs1)N1CCC(C)CC1)c1ccccc1 ZINC000516150695 923577988 /nfs/dbraw/zinc/57/79/88/923577988.db2.gz TUAXTLHRXQLRNN-WOJBJXKFSA-N 0 3 401.576 4.208 20 0 HIADHN CCS(=O)(=O)c1ccc([C@H](C)N[C@@H](C)CC(=O)Nc2cccc(Cl)c2)cc1 ZINC000516199495 923594253 /nfs/dbraw/zinc/59/42/53/923594253.db2.gz IVKAWJWNPVPTFL-GJZGRUSLSA-N 0 3 408.951 4.202 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)NCc1ccc(Oc2ccccc2)nc1 ZINC000516208996 923601493 /nfs/dbraw/zinc/60/14/93/923601493.db2.gz SBOWPFGIUYGKGY-LJQANCHMSA-N 0 3 404.514 4.194 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N[C@H](C)COc3c(C)cccc3C)c(C)c2)CC1 ZINC000516232835 923618288 /nfs/dbraw/zinc/61/82/88/923618288.db2.gz CPOUZUFQOKDSPV-OAQYLSRUSA-N 0 3 424.589 4.343 20 0 HIADHN Cc1ccc(C(=O)C2CCN(C(=O)N[C@H](C)CN3C[C@@H](C)C[C@H](C)C3)CC2)c(C)c1 ZINC000516242340 923623483 /nfs/dbraw/zinc/62/34/83/923623483.db2.gz FDMNNWHYXHEUJO-IRFCIJBXSA-N 0 3 413.606 4.274 20 0 HIADHN CSc1ccccc1NC(=O)[C@H](C)N[C@H]1CCN(C)[C@@H]1c1ccc(Cl)cc1 ZINC000516351751 923682141 /nfs/dbraw/zinc/68/21/41/923682141.db2.gz KBEFGDHELPAGCA-ADLFWFRXSA-N 0 3 403.979 4.424 20 0 HIADHN CCN1CCN(CCCNC(=O)c2cc(Cl)ccc2Oc2ccc(F)cc2)CC1 ZINC000516383685 923704695 /nfs/dbraw/zinc/70/46/95/923704695.db2.gz COGKJWYFMQMNMA-UHFFFAOYSA-N 0 3 419.928 4.029 20 0 HIADHN CN1CCC[C@@H]1CNC(=O)Cn1c2ccccc2nc1-c1cccc(Cl)c1Cl ZINC000516393404 923708067 /nfs/dbraw/zinc/70/80/67/923708067.db2.gz HOYBXLBBHDGZRL-CQSZACIVSA-N 0 3 417.340 4.221 20 0 HIADHN O=C(CCCc1nnc(-c2ccccc2)o1)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000516436149 923731836 /nfs/dbraw/zinc/73/18/36/923731836.db2.gz PDDILGSOIASECH-NRFANRHFSA-N 0 3 404.514 4.013 20 0 HIADHN Cc1ccc(-c2noc(CCC(=O)N[C@H](CN3CCCC3)c3ccccc3)n2)cc1F ZINC000516436355 923732366 /nfs/dbraw/zinc/73/23/66/923732366.db2.gz WAVBMPISOKKMEU-OAQYLSRUSA-N 0 3 422.504 4.070 20 0 HIADHN C[C@H](NC(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1)c1ccccc1OC(F)F ZINC000516579723 923800405 /nfs/dbraw/zinc/80/04/05/923800405.db2.gz MPDIQKIYHZYRKE-BQFCYCMXSA-N 0 3 403.473 4.484 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N[C@@H](C)c2cccc(OC(F)F)c2)C1 ZINC000516578219 923800489 /nfs/dbraw/zinc/80/04/89/923800489.db2.gz WTFCDPYHFWRUOD-FRQCXROJSA-N 0 3 403.473 4.484 20 0 HIADHN C[C@H](CCc1ccc(Br)cc1)NC(=O)N1CCN(C2CCCC2)CC1 ZINC000516587632 923803463 /nfs/dbraw/zinc/80/34/63/923803463.db2.gz JOROAVTUBFEVEH-MRXNPFEDSA-N 0 3 408.384 4.040 20 0 HIADHN COCc1cc(NC2CC(N3CCC(C(F)(F)F)CC3)C2)c2cc(F)ccc2n1 ZINC000516694520 923849509 /nfs/dbraw/zinc/84/95/09/923849509.db2.gz FGKOSVTYCKRQFA-UHFFFAOYSA-N 0 3 411.443 4.159 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)c2ccc(-c3nc(C4CC4)no3)cc2)CCN1Cc1ccccc1 ZINC000517021850 923966406 /nfs/dbraw/zinc/96/64/06/923966406.db2.gz YYUJSYAYBIDNAC-IERDGZPVSA-N 0 3 402.498 4.007 20 0 HIADHN CC(C)(C)c1csc(CNC(=O)Nc2ccc(CCN3CCSCC3)cc2)n1 ZINC000517103460 923999011 /nfs/dbraw/zinc/99/90/11/923999011.db2.gz HSYOAOVYMQOEFX-UHFFFAOYSA-N 0 3 418.632 4.354 20 0 HIADHN CCC[C@@H]1CN(c2nnc(C(C)C)n2C[C@@H]2CCCO2)CCN1Cc1ccccc1 ZINC000517248748 924059229 /nfs/dbraw/zinc/05/92/29/924059229.db2.gz AQAXYTVDXGSRDP-YADHBBJMSA-N 0 3 411.594 4.071 20 0 HIADHN CC[C@H]1CN(c2nnc(C(C)C)n2C[C@@H]2CCCCO2)CCN1Cc1ccccc1 ZINC000517248892 924059540 /nfs/dbraw/zinc/05/95/40/924059540.db2.gz GWUWTDUKOOQVAZ-VXKWHMMOSA-N 0 3 411.594 4.071 20 0 HIADHN O=C(CN1CCC[C@@H](Cc2ccccc2)C1)N1CCC[C@H]1c1ccc2c(c1)OCCO2 ZINC000517324701 924103117 /nfs/dbraw/zinc/10/31/17/924103117.db2.gz ZGCLHUNDAORIMH-GMAHTHKFSA-N 0 3 420.553 4.076 20 0 HIADHN CC(C)Sc1ccc(Cl)cc1NC(=O)C(=O)NCCN1[C@H](C)CCC[C@H]1C ZINC000517423357 924174208 /nfs/dbraw/zinc/17/42/08/924174208.db2.gz VSWLTXKCFSSNBV-HUUCEWRRSA-N 0 3 411.999 4.158 20 0 HIADHN COc1ccccc1[C@@H](NC(=O)NC[C@@H](c1ccccc1)N(C)C)c1ccccc1 ZINC000517474744 924216145 /nfs/dbraw/zinc/21/61/45/924216145.db2.gz UWULWDDEORIBSB-UPVQGACJSA-N 0 3 403.526 4.387 20 0 HIADHN CN(C)CCn1c2cc(NC(=O)[C@@H]3C[C@H]3c3ccc4ccccc4c3)ccc2oc1=O ZINC000517487050 924225433 /nfs/dbraw/zinc/22/54/33/924225433.db2.gz FWFWWNLTBMTLPI-LEWJYISDSA-N 0 3 415.493 4.052 20 0 HIADHN CC(C)C[C@@H](NC(=O)NCc1ccc(CN2CCN(C)CC2)cc1)c1cccs1 ZINC000517505298 924235457 /nfs/dbraw/zinc/23/54/57/924235457.db2.gz YJCFCSAVXSVIBM-OAQYLSRUSA-N 0 3 414.619 4.082 20 0 HIADHN COc1c(Cl)cc(Cl)cc1CNC[C@H](c1cccs1)N1CCN(C)CC1 ZINC000517524944 924246015 /nfs/dbraw/zinc/24/60/15/924246015.db2.gz BSRDYJPSFLSWGO-QGZVFWFLSA-N 0 3 414.402 4.142 20 0 HIADHN COc1ccc(CN(C)C(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)cc1O ZINC000517526587 924246722 /nfs/dbraw/zinc/24/67/22/924246722.db2.gz VEHRSNJCQZEGCR-SFHVURJKSA-N 0 3 417.575 4.077 20 0 HIADHN COc1ccc2ccccc2c1CNC(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000517539112 924254204 /nfs/dbraw/zinc/25/42/04/924254204.db2.gz FNFLOHGOANVQTB-WIYYLYMNSA-N 0 3 403.526 4.483 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N[C@H](c2ccc3c(c2)OCCO3)C2CC2)C1 ZINC000517543442 924255033 /nfs/dbraw/zinc/25/50/33/924255033.db2.gz RTJWECSLHRJQIF-JKHABCDFSA-N 0 3 421.541 4.044 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N2CCC(c3noc4cc(F)ccc43)CC2)N(C)C)cc1 ZINC000517636796 926744932 /nfs/dbraw/zinc/74/49/32/926744932.db2.gz GLQFEBZLFLELJA-NRFANRHFSA-N 0 3 424.520 4.467 20 0 HIADHN CN1CCN(c2ccncc2NC(=O)CCCc2ccc(Cl)c(Cl)c2)CC1 ZINC000517652608 926760499 /nfs/dbraw/zinc/76/04/99/926760499.db2.gz NHPCIYBABTXQJV-UHFFFAOYSA-N 0 3 407.345 4.102 20 0 HIADHN CC(C)Oc1ccccc1[C@@H](C)NC(=O)CCCN1CCN(c2ccccc2)CC1 ZINC000517655716 926761780 /nfs/dbraw/zinc/76/17/80/926761780.db2.gz SBVKTMATFLIMQA-OAQYLSRUSA-N 0 3 409.574 4.253 20 0 HIADHN Cc1noc(C)c1COc1cc2ccccc2cc1C(=O)N(C)[C@@H]1CCN(C2CC2)C1 ZINC000517692932 926796348 /nfs/dbraw/zinc/79/63/48/926796348.db2.gz VWXDIGAOQSLHFW-OAQYLSRUSA-N 0 3 419.525 4.332 20 0 HIADHN Fc1ccc(-n2cc(CN[C@@H]3CCN(c4ccccc4Br)C3)cn2)cc1 ZINC000517709851 926807741 /nfs/dbraw/zinc/80/77/41/926807741.db2.gz VTURMBRHHONFOZ-QGZVFWFLSA-N 0 3 415.310 4.142 20 0 HIADHN CC(C)N(Cc1ccco1)C[C@@H](O)COc1ccc(Cl)cc1Br ZINC000518001341 926941351 /nfs/dbraw/zinc/94/13/51/926941351.db2.gz DNAKZNLDWUNWOZ-CQSZACIVSA-N 0 3 402.716 4.346 20 0 HIADHN CSc1nccn1-c1ccc(C(=O)N[C@H](CN2CCCC2)c2ccccc2)cc1 ZINC000518042109 926980038 /nfs/dbraw/zinc/98/00/38/926980038.db2.gz FIMLMQOLYBUVKL-OAQYLSRUSA-N 0 3 406.555 4.161 20 0 HIADHN Cc1ccccc1Oc1ccccc1CNC(=O)C(=O)Nc1cccc(CN(C)C)c1 ZINC000518060379 926997622 /nfs/dbraw/zinc/99/76/22/926997622.db2.gz KNOVWOIELKIJDE-UHFFFAOYSA-N 0 3 417.509 4.104 20 0 HIADHN O=C(CCC(=O)N1CCC(N2CCc3ccccc3C2)CC1)c1ccc2c(c1)CCC2 ZINC000518128444 927037562 /nfs/dbraw/zinc/03/75/62/927037562.db2.gz URHHTWMSWJSVJF-UHFFFAOYSA-N 0 3 416.565 4.188 20 0 HIADHN CSc1ccc([C@H](CNCc2cnc(C)nc2)N2CCc3sccc3C2)cc1 ZINC000518266270 927122968 /nfs/dbraw/zinc/12/29/68/927122968.db2.gz UBBRMMLVDIXZMI-NRFANRHFSA-N 0 3 410.612 4.458 20 0 HIADHN COc1ccc(C[C@@H]2CCCN([C@H](C)C(=O)N[C@@H](C)c3ccccc3OC)C2)cc1 ZINC000518270954 927128754 /nfs/dbraw/zinc/12/87/54/927128754.db2.gz XFASCZPQVUSAEE-ZVDOUQERSA-N 0 3 410.558 4.224 20 0 HIADHN COc1ccc(C[C@@H]2CCCN([C@@H](C)C(=O)N[C@@H](C)c3ccccc3OC)C2)cc1 ZINC000518270953 927128982 /nfs/dbraw/zinc/12/89/82/927128982.db2.gz XFASCZPQVUSAEE-ZJOUEHCJSA-N 0 3 410.558 4.224 20 0 HIADHN Fc1cccc(N2CCCC2)c1CNC[C@@H](c1ccc(Cl)cc1)N1CCOCC1 ZINC000518280584 927137207 /nfs/dbraw/zinc/13/72/07/927137207.db2.gz ZUFYFMNLAGFWAK-QHCPKHFHSA-N 0 3 417.956 4.242 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)c1cc(-c2cccc(F)c2)no1 ZINC000518298951 927159219 /nfs/dbraw/zinc/15/92/19/927159219.db2.gz WTFKCVGADCQYBW-HXUWFJFHSA-N 0 3 408.477 4.002 20 0 HIADHN CC(C)n1ncc2c1nc(C1CC1)cc2C(=O)NC[C@@H](C)N(C)Cc1ccccc1 ZINC000518378184 927229865 /nfs/dbraw/zinc/22/98/65/927229865.db2.gz OBGOEOCWJCXHFC-QGZVFWFLSA-N 0 3 405.546 4.140 20 0 HIADHN C[C@H](NCc1ccc(-n2ccc(C(F)(F)F)n2)cc1)c1ccc2c(c1)OCC(=O)N2 ZINC000518386330 927233972 /nfs/dbraw/zinc/23/39/72/927233972.db2.gz AOSOUCIGUKDCFV-ZDUSSCGKSA-N 0 3 416.403 4.073 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)NCc2ccc(N3CCCCCC3)nc2)C1 ZINC000518402454 927242906 /nfs/dbraw/zinc/24/29/06/927242906.db2.gz AYDLCCGCYKSGOQ-OFNKIYASSA-N 0 3 421.589 4.097 20 0 HIADHN CC[C@H](NC(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1)c1ccc2c(c1)OCCO2 ZINC000518406879 927247655 /nfs/dbraw/zinc/24/76/55/927247655.db2.gz JTCIYGHYRXCRJZ-YYWHXJBOSA-N 0 3 409.530 4.044 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)NCc2cc(F)ccc2Br)C1 ZINC000518407100 927247812 /nfs/dbraw/zinc/24/78/12/927247812.db2.gz AFKBBGIFDYYFTD-RDTXWAMCSA-N 0 3 420.326 4.223 20 0 HIADHN CCN1CCCN(C(=O)c2cc(-c3ccc(F)cc3)nc3onc(C4CC4)c32)CC1 ZINC000518415429 927254974 /nfs/dbraw/zinc/25/49/74/927254974.db2.gz DDRFGXQZJJNANK-UHFFFAOYSA-N 0 3 408.477 4.074 20 0 HIADHN CC[C@@H](Oc1ccccc1C(C)C)C(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000518500220 927310774 /nfs/dbraw/zinc/31/07/74/927310774.db2.gz IZWWGZZXBLWMIX-ZRCGQRJVSA-N 0 3 416.606 4.315 20 0 HIADHN Cc1ccccc1CN1CCCN(C(=O)CN(C)[C@@H](C)c2cc(F)ccc2F)CC1 ZINC000518513024 927318976 /nfs/dbraw/zinc/31/89/76/927318976.db2.gz MHBXLVNMBHTQSN-IBGZPJMESA-N 0 3 415.528 4.001 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)C(=O)N1CCCCC[C@H]1c1cccc(C)c1 ZINC000518611072 927376732 /nfs/dbraw/zinc/37/67/32/927376732.db2.gz MAWLFSQQYKSOHV-QFIPXVFZSA-N 0 3 423.557 4.148 20 0 HIADHN COc1cc(CNCc2cccc(C(=O)N(C)C)c2)c(-c2ccccc2)cc1OC ZINC000518767740 927483311 /nfs/dbraw/zinc/48/33/11/927483311.db2.gz OSQPBONQAANXCO-UHFFFAOYSA-N 0 3 404.510 4.362 20 0 HIADHN O[C@@H](CNCc1ccc(-c2ccc(Br)cc2)o1)COc1ccccc1 ZINC000518771373 927484827 /nfs/dbraw/zinc/48/48/27/927484827.db2.gz YWSIHUSQMFBMHQ-KRWDZBQOSA-N 0 3 402.288 4.239 20 0 HIADHN Cc1c(CN2CCSCC2)cccc1NC(=O)[C@@H](c1cccc(Cl)c1)N(C)C ZINC000518891077 927602236 /nfs/dbraw/zinc/60/22/36/927602236.db2.gz IVECCMAVJSYDHF-OAQYLSRUSA-N 0 3 418.006 4.439 20 0 HIADHN CC(C)CCOC1CCN(C(=O)[C@@H](C)N2CCC(Cc3ccccc3)CC2)CC1 ZINC000518920442 927628098 /nfs/dbraw/zinc/62/80/98/927628098.db2.gz YBJCZSZPRTZWGH-OAQYLSRUSA-N 0 3 400.607 4.383 20 0 HIADHN C[C@H](O)CN(CC(=O)N1N=C(c2ccco2)C[C@H]1c1cccs1)C1CCCCC1 ZINC000519201637 927824106 /nfs/dbraw/zinc/82/41/06/927824106.db2.gz RMZHCAIVXKUIEE-LPHOPBHVSA-N 0 3 415.559 4.034 20 0 HIADHN COc1ccc2c(c1F)CC[C@H]2NCc1cc(Br)c2c(c1)OCCO2 ZINC000519221829 927834129 /nfs/dbraw/zinc/83/41/29/927834129.db2.gz JHEPPHXLZPCZPO-OAHLLOKOSA-N 0 3 408.267 4.145 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)Nc1cc2c(cc1Cl)OCCCO2 ZINC000519223785 927835103 /nfs/dbraw/zinc/83/51/03/927835103.db2.gz UEQKOQVKUBXQLJ-OAHLLOKOSA-N 0 3 403.910 4.143 20 0 HIADHN CCN(Cc1cccc(NC(=O)NC[C@@H]2CCCCN2Cc2ccccc2)c1)C(C)=O ZINC000519261902 927854115 /nfs/dbraw/zinc/85/41/15/927854115.db2.gz FVCWELMHBILFNL-DEOSSOPVSA-N 0 3 422.573 4.231 20 0 HIADHN C[C@@H]1C[C@H]1C(=O)Nc1cccc(C(=O)NC[C@H]2CCCCN2Cc2ccccc2)c1 ZINC000519271912 927858363 /nfs/dbraw/zinc/85/83/63/927858363.db2.gz XGFNBOOKZAURJB-SXSPYAJSSA-N 0 3 405.542 4.066 20 0 HIADHN C[C@@H]1C[C@@H]1C(=O)Nc1cccc(C(=O)N(CCN(C)C)Cc2cccc(Cl)c2)c1 ZINC000519418199 927934668 /nfs/dbraw/zinc/93/46/68/927934668.db2.gz JLRJKFYOWAOAEB-IERDGZPVSA-N 0 3 413.949 4.139 20 0 HIADHN CC(=O)c1ccc(CC(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)cc1 ZINC000519417490 927935073 /nfs/dbraw/zinc/93/50/73/927935073.db2.gz FEEAZICIYVQFGQ-UHFFFAOYSA-N 0 3 406.448 4.041 20 0 HIADHN COc1ccc(Cl)cc1NCCC(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000519432311 927944214 /nfs/dbraw/zinc/94/42/14/927944214.db2.gz DPJVUVBIXIGRTR-LPHOPBHVSA-N 0 3 401.938 4.102 20 0 HIADHN CCCO[C@@H]1CCCN(C(=O)NC[C@@H](c2cccc(OC)c2)N(CC)CC)CC1 ZINC000519452278 927958873 /nfs/dbraw/zinc/95/88/73/927958873.db2.gz WVDRJDAFYZUADP-IRLDBZIGSA-N 0 3 405.583 4.069 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)NC[C@H]1CCCO[C@@H]1c1ccccc1 ZINC000519453042 927960584 /nfs/dbraw/zinc/96/05/84/927960584.db2.gz UYCOABKDSZLZRR-FYYLOGMGSA-N 0 3 413.537 4.067 20 0 HIADHN c1nc(-c2ccccn2)sc1CN1CCC[C@H](c2nc(-c3ccccc3)n[nH]2)C1 ZINC000519669224 928043841 /nfs/dbraw/zinc/04/38/41/928043841.db2.gz IELMONFWXPJBSO-KRWDZBQOSA-N 0 3 402.527 4.370 20 0 HIADHN CCCN(C)[C@H](CNC(=O)N1CC[C@H](n2cc(Cl)cn2)C1)c1ccc(Cl)cc1 ZINC000519758270 928067684 /nfs/dbraw/zinc/06/76/84/928067684.db2.gz YYGCHEDSIBFDFA-RBUKOAKNSA-N 0 3 424.376 4.229 20 0 HIADHN COc1ccc(OC)c(CN(C(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)C2CC2)c1 ZINC000519810968 928083604 /nfs/dbraw/zinc/08/36/04/928083604.db2.gz GABZLBJKWVHXFQ-NQIIRXRSSA-N 0 3 423.557 4.213 20 0 HIADHN COc1ccc([C@H](NC(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)C(C)C)cc1 ZINC000519950854 928183661 /nfs/dbraw/zinc/18/36/61/928183661.db2.gz FGDDGMDLBXROGO-XMMPIXPASA-N 0 3 409.574 4.353 20 0 HIADHN O=C(CN1CCCCC[C@@H]1c1ccccc1)NCc1ccccc1CN1CCCC1=O ZINC000520042543 928265864 /nfs/dbraw/zinc/26/58/64/928265864.db2.gz NXKARSVFRRVHEG-XMMPIXPASA-N 0 3 419.569 4.043 20 0 HIADHN CCOc1ccc([C@H](C)NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)cc1OC ZINC000520093201 928305081 /nfs/dbraw/zinc/30/50/81/928305081.db2.gz ONIFYVXOHNWPIM-FXAWDEMLSA-N 0 3 414.521 4.322 20 0 HIADHN C[C@@H](NC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1)c1cccc(N2CCCC2=O)c1 ZINC000520109663 928316574 /nfs/dbraw/zinc/31/65/74/928316574.db2.gz XHJMHXQQNGTODM-WIYYLYMNSA-N 0 3 423.532 4.042 20 0 HIADHN CCN(CCC(=O)Nc1cc(Cl)ccc1OC)Cc1ccc(OC)cc1OC ZINC000520171601 928362971 /nfs/dbraw/zinc/36/29/71/928362971.db2.gz UCZGHEPQXUIDOF-UHFFFAOYSA-N 0 3 406.910 4.217 20 0 HIADHN Cc1cc(Br)cc(C)c1CNC(=O)N(CCN(C)C)Cc1ccccc1 ZINC000520203773 928385929 /nfs/dbraw/zinc/38/59/29/928385929.db2.gz XFFCLEKHDKEOQZ-UHFFFAOYSA-N 0 3 418.379 4.339 20 0 HIADHN CCCN(C(=O)C(=O)Nc1cc(CN(C)C)ccc1OC)[C@@H](CC)c1ccccc1 ZINC000520235447 928404735 /nfs/dbraw/zinc/40/47/35/928404735.db2.gz RWJLDWLSALVGGC-NRFANRHFSA-N 0 3 411.546 4.085 20 0 HIADHN Cc1cccc(N2CCN(CCCCNc3cc(C)nc(-c4ccccn4)n3)CC2)c1 ZINC000520246225 928413858 /nfs/dbraw/zinc/41/38/58/928413858.db2.gz UKMPXWKFXJABCQ-UHFFFAOYSA-N 0 3 416.573 4.170 20 0 HIADHN COCCN1CCC(NC(=O)N[C@@H](c2ccccc2)c2ccc3ccccc3c2)CC1 ZINC000520266633 928431198 /nfs/dbraw/zinc/43/11/98/928431198.db2.gz WCDAMGBDILVZLV-VWLOTQADSA-N 0 3 417.553 4.339 20 0 HIADHN Cn1c(C2CCCC2)nnc1N1CCCN(Cc2ccc(C(F)(F)F)cc2)CC1 ZINC000520291136 928453152 /nfs/dbraw/zinc/45/31/52/928453152.db2.gz RFQIUDHQAOFYAE-UHFFFAOYSA-N 0 3 407.484 4.204 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N2CCC(OCCC(C)C)CC2)N2CCCC2)cc1 ZINC000520296807 928458635 /nfs/dbraw/zinc/45/86/35/928458635.db2.gz SWQPMRQFJDIHEO-HSZRJFAPSA-N 0 3 401.595 4.369 20 0 HIADHN CN(C)[C@H](CNC(=O)NCc1ccc(-n2cnc3ccccc32)cc1)c1ccccc1 ZINC000520297777 928460606 /nfs/dbraw/zinc/46/06/06/928460606.db2.gz HJMOUPNKKLRESK-XMMPIXPASA-N 0 3 413.525 4.128 20 0 HIADHN CN(C(=O)Cc1csc(-c2cccc(C(F)(F)F)c2)n1)[C@H]1CCN(C2CC2)C1 ZINC000520319690 928481918 /nfs/dbraw/zinc/48/19/18/928481918.db2.gz WWWUMBIGPHCRRR-KRWDZBQOSA-N 0 3 409.477 4.067 20 0 HIADHN CC(C)c1cc(C(=O)NC[C@@H](C)N(C)Cc2ccccc2)c2cnn(C(C)C)c2n1 ZINC000520326737 928491592 /nfs/dbraw/zinc/49/15/92/928491592.db2.gz JJKUSVROLSSOER-GOSISDBHSA-N 0 3 407.562 4.386 20 0 HIADHN Cc1ccc(NC(=O)C2CC2)cc1NC(=O)c1ccc(N2CCN(C(C)C)CC2)cc1 ZINC000520477511 928589327 /nfs/dbraw/zinc/58/93/27/928589327.db2.gz ZMUKOGOXBIDHLW-UHFFFAOYSA-N 0 3 420.557 4.126 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CCCSCC1)c1ccc(C(F)(F)F)cc1 ZINC000520541106 928628967 /nfs/dbraw/zinc/62/89/67/928628967.db2.gz QEIHDENOHZOMPW-KRWDZBQOSA-N 0 3 403.514 4.237 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N[C@H](c2ccc(F)cc2)[C@H]2CCCO2)C1 ZINC000520756238 928803492 /nfs/dbraw/zinc/80/34/92/928803492.db2.gz MQAUGJCNQLMOCV-FJTGNWTPSA-N 0 3 411.521 4.181 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)N[C@H]1C[C@@H]1c1cccc(Br)c1 ZINC000520781681 928814555 /nfs/dbraw/zinc/81/45/55/928814555.db2.gz WHOKQVLRPLTDCJ-UXHICEINSA-N 0 3 416.363 4.078 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)Nc1cccc(C(=O)NC(C)(C)C)c1 ZINC000520790583 928820546 /nfs/dbraw/zinc/82/05/46/928820546.db2.gz RQMGMHFEFYFMDE-UHFFFAOYSA-N 0 3 424.589 4.243 20 0 HIADHN Cn1c2ccccc2nc1[C@@H]1CCCN1C(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000520813442 928829921 /nfs/dbraw/zinc/82/99/21/928829921.db2.gz GQRQQXNEXNYRCS-CVDCTZTESA-N 0 3 420.532 4.288 20 0 HIADHN Cc1ccc(Cc2nnc(NC(=O)N[C@H]3CCN([C@H](C)c4ccccc4)C3)s2)cc1 ZINC000520856390 928846492 /nfs/dbraw/zinc/84/64/92/928846492.db2.gz CKXZGYPMULRYAR-XLIONFOSSA-N 0 3 421.570 4.394 20 0 HIADHN Cc1cc(NC(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)ccc1C(=O)NC(C)C ZINC000520903772 928867780 /nfs/dbraw/zinc/86/77/80/928867780.db2.gz XFBXLYMUVKQYGC-NQIIRXRSSA-N 0 3 408.546 4.090 20 0 HIADHN CCN(CC(=O)N(C)Cc1ccc(SC)cc1)[C@H](C)Cc1ccc(OC)cc1 ZINC000520938845 928883193 /nfs/dbraw/zinc/88/31/93/928883193.db2.gz DYXRCCFJCBWXQV-GOSISDBHSA-N 0 3 400.588 4.329 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)c1cc2cc(Br)ccc2[nH]1 ZINC000520985494 928903026 /nfs/dbraw/zinc/90/30/26/928903026.db2.gz FBAYCFQLKTVRBW-UHFFFAOYSA-N 0 3 400.320 4.134 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)c1ccn(-c2ccccc2)n1 ZINC000520989033 928906519 /nfs/dbraw/zinc/90/65/19/928906519.db2.gz ANRPCVCCBYHYGD-UHFFFAOYSA-N 0 3 416.447 4.095 20 0 HIADHN C[C@@H](CCc1ccco1)NC(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1 ZINC000521062013 928967958 /nfs/dbraw/zinc/96/79/58/928967958.db2.gz VZAPUIMRULHOSA-INIZCTEOSA-N 0 3 411.468 4.393 20 0 HIADHN C[C@@H](CNC(=O)COC(c1ccccc1)c1ccccc1)N(C)Cc1ccccc1 ZINC000521095622 928990399 /nfs/dbraw/zinc/99/03/99/928990399.db2.gz KTEABTCXMCJCEP-NRFANRHFSA-N 0 3 402.538 4.429 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)[C@@H](C)c2cn(C)c3ccccc23)N(C)C)cc1 ZINC000521099048 928994114 /nfs/dbraw/zinc/99/41/14/928994114.db2.gz RGMJOPONTSVWIX-UUOWRZLLSA-N 0 3 407.558 4.488 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)[C@@H](C)c2cn(C)c3ccccc23)N(C)C)cc1 ZINC000521099047 928994407 /nfs/dbraw/zinc/99/44/07/928994407.db2.gz RGMJOPONTSVWIX-MHECFPHRSA-N 0 3 407.558 4.488 20 0 HIADHN CN(C)CCN(C(=O)C1CCC(NC(=O)CC2CCCCC2)CC1)C1CCCCC1 ZINC000521150450 929026193 /nfs/dbraw/zinc/02/61/93/929026193.db2.gz CBUHQYNJWWPSSU-UHFFFAOYSA-N 0 3 419.654 4.355 20 0 HIADHN C[C@H](CNC(=O)N1CCO[C@H](c2ccc(F)c(Cl)c2)C1)N(C)Cc1ccccc1 ZINC000521162605 929034860 /nfs/dbraw/zinc/03/48/60/929034860.db2.gz WJLHLEJDCVNMFF-IERDGZPVSA-N 0 3 419.928 4.083 20 0 HIADHN C[C@@H](CNC(=O)N1CCO[C@@H](c2ccc(F)c(Cl)c2)C1)N(C)Cc1ccccc1 ZINC000521162604 929035617 /nfs/dbraw/zinc/03/56/17/929035617.db2.gz WJLHLEJDCVNMFF-HRAATJIYSA-N 0 3 419.928 4.083 20 0 HIADHN CC[C@H](CNC(=O)N(CCOC)[C@@H](C)c1ccccc1)N1CCc2ccccc2C1 ZINC000521167293 929039727 /nfs/dbraw/zinc/03/97/27/929039727.db2.gz STDNJRBHLAWARS-GBXCKJPGSA-N 0 3 409.574 4.243 20 0 HIADHN CN(Cc1ccccc1Br)C(=O)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000521183330 929049235 /nfs/dbraw/zinc/04/92/35/929049235.db2.gz RVYMFRDOSIDWGX-FQEVSTJZSA-N 0 3 416.363 4.428 20 0 HIADHN Cc1ccc(-c2nn(Cc3ccccc3)cc2C(=O)N[C@H]2CCN(C3CC3)C2)cc1C ZINC000521223601 929067142 /nfs/dbraw/zinc/06/71/42/929067142.db2.gz FYLKJYDRDLNDFL-QFIPXVFZSA-N 0 3 414.553 4.182 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)NCc1nc2cc(Cl)ccc2s1 ZINC000521272523 929092842 /nfs/dbraw/zinc/09/28/42/929092842.db2.gz JIRCDYGOZICGQI-UHFFFAOYSA-N 0 3 420.941 4.362 20 0 HIADHN CN(CCN1CCN(Cc2csc(-c3ccsc3)n2)CC1)Cc1ccccc1 ZINC000521302852 929111598 /nfs/dbraw/zinc/11/15/98/929111598.db2.gz TUFCGMGSNCFGAZ-UHFFFAOYSA-N 0 3 412.628 4.121 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)NCc1ccc(C(F)(F)F)cc1 ZINC000521454464 929228461 /nfs/dbraw/zinc/22/84/61/929228461.db2.gz ZNLWSWOYQZOKMF-UHFFFAOYSA-N 0 3 407.480 4.411 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)COc2ccc(C(=O)c3ccccc3)cc2)N(C)C)cc1 ZINC000521488881 929248213 /nfs/dbraw/zinc/24/82/13/929248213.db2.gz BRWNSEHEEAINRM-XMMPIXPASA-N 0 3 416.521 4.024 20 0 HIADHN COc1cc(CN(C)C(=O)NC[C@H](c2ccc(C)cc2)N(C)C)ccc1OC(F)F ZINC000521509476 929260554 /nfs/dbraw/zinc/26/05/54/929260554.db2.gz GXDWCRUKSGVICP-GOSISDBHSA-N 0 3 421.488 4.049 20 0 HIADHN CN(C(=O)Nc1cccc(C(F)(F)F)c1)C1CCN(CCc2ccccn2)CC1 ZINC000521555777 929294554 /nfs/dbraw/zinc/29/45/54/929294554.db2.gz BSCDGGGRNKXRKX-UHFFFAOYSA-N 0 3 406.452 4.271 20 0 HIADHN COc1cccc(C[C@@H]2CCCN2C(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)c1 ZINC000521598788 929321036 /nfs/dbraw/zinc/32/10/36/929321036.db2.gz ZDLJDHPOLUGIJD-GMAHTHKFSA-N 0 3 410.533 4.280 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)Nc1cc(F)ccc1OC[C@H]1CCCO1 ZINC000521656188 929349181 /nfs/dbraw/zinc/34/91/81/929349181.db2.gz RJUFKHKZXBQREK-LJQANCHMSA-N 0 3 407.530 4.113 20 0 HIADHN CCn1c(CNC[C@@H]2CCN(c3ccc(Br)cc3)C2)nc2ccccc21 ZINC000521816931 929473655 /nfs/dbraw/zinc/47/36/55/929473655.db2.gz MRXJZQFCWPGXPC-INIZCTEOSA-N 0 3 413.363 4.435 20 0 HIADHN CC(C)CN(CC(=O)N1CCC[C@@H]1c1ccc2c(c1)OCCO2)Cc1ccccc1 ZINC000521816229 929474742 /nfs/dbraw/zinc/47/47/42/929474742.db2.gz LEBIFHSABKZUTI-JOCHJYFZSA-N 0 3 408.542 4.280 20 0 HIADHN CC(=O)Nc1ccc(CN[C@@H]2CC(=O)N(c3ccc(Oc4ccccc4)cc3)C2)cc1 ZINC000521830851 929484151 /nfs/dbraw/zinc/48/41/51/929484151.db2.gz ZZVZWVPMEQIOEN-OAQYLSRUSA-N 0 3 415.493 4.332 20 0 HIADHN CC[C@H]1CCCCN1C(=O)[C@H](C)N(C)CCCc1cc(-c2cccc(F)c2)n[nH]1 ZINC000521879225 929528155 /nfs/dbraw/zinc/52/81/55/929528155.db2.gz ZUPXPVWNHYJMEL-UWJYYQICSA-N 0 3 400.542 4.260 20 0 HIADHN C[C@H](C(=O)N1CCc2ccccc2C1)N(C)CCCc1cc(-c2cccc(F)c2)n[nH]1 ZINC000521880161 929530567 /nfs/dbraw/zinc/53/05/67/929530567.db2.gz HWOVQRARGZYJHN-GOSISDBHSA-N 0 3 420.532 4.054 20 0 HIADHN O=S(=O)(c1cc(Cl)ccc1Cl)N1CCN(c2ccnc3ccccc32)CC1 ZINC000521916549 929559489 /nfs/dbraw/zinc/55/94/89/929559489.db2.gz FRAHBBWZOYHYRJ-UHFFFAOYSA-N 0 3 422.337 4.053 20 0 HIADHN CC(C)Oc1ccccc1[C@H](C)NC(=O)c1ccc(N2CCN(C(C)C)CC2)cc1 ZINC000521931382 929571599 /nfs/dbraw/zinc/57/15/99/929571599.db2.gz GDJMONFIQGFNLS-FQEVSTJZSA-N 0 3 409.574 4.495 20 0 HIADHN COc1ccc([C@@H](Cc2ccccc2C)NCc2c[nH]c3nccnc23)cc1OC ZINC000521947135 929581797 /nfs/dbraw/zinc/58/17/97/929581797.db2.gz XULOPJGGSJHPFF-HXUWFJFHSA-N 0 3 402.498 4.309 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)Nc1scnc1-c1ccccc1 ZINC000521957725 929595479 /nfs/dbraw/zinc/59/54/79/929595479.db2.gz UKZNKJQVIDXKHQ-UHFFFAOYSA-N 0 3 406.555 4.351 20 0 HIADHN COc1ccc(C(=O)CCCC(=O)NC2C[C@H]3CC[C@@H](C2)N3Cc2ccccc2)cc1 ZINC000521982533 929610582 /nfs/dbraw/zinc/61/05/82/929610582.db2.gz NIZADNJEKDPBRF-NOTZXAQLSA-N 0 3 420.553 4.360 20 0 HIADHN COc1cccc(NC(=O)[C@@H](NC[C@H](C)N(C)Cc2ccccc2)c2ccccc2)c1 ZINC000522057017 929625673 /nfs/dbraw/zinc/62/56/73/929625673.db2.gz XUVBNUJFHLASIB-CPJSRVTESA-N 0 3 417.553 4.485 20 0 HIADHN O=C(NC[C@H]1CCCN1Cc1ccccc1)Nc1ccc(F)cc1Br ZINC000524483109 929631574 /nfs/dbraw/zinc/63/15/74/929631574.db2.gz FSVGKWYGJAEPIP-MRXNPFEDSA-N 0 3 406.299 4.374 20 0 HIADHN CC[C@H](CNC(=O)NCc1nc(C(C)(C)C)cs1)N1CCc2ccccc2C1 ZINC000524590838 929701682 /nfs/dbraw/zinc/70/16/82/929701682.db2.gz RAOFEORORACHJD-GOSISDBHSA-N 0 3 400.592 4.077 20 0 HIADHN CC(C)c1ccc(-c2nc(C(=O)N(CCN(C)C)C[C@@H]3CCCO3)cs2)cc1 ZINC000524591221 929703120 /nfs/dbraw/zinc/70/31/20/929703120.db2.gz CVDNZCGUOBFJFE-IBGZPJMESA-N 0 3 401.576 4.116 20 0 HIADHN CC[C@@H](NC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C)c1ccc2c(c1)OCCO2 ZINC000524630012 929738938 /nfs/dbraw/zinc/73/89/38/929738938.db2.gz SZMPFVAUOBOHSB-DENIHFKCSA-N 0 3 423.557 4.215 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2ccc(C(=O)NCC(C)(C)C)cc2)N2CCCC2)cc1 ZINC000524647066 929759501 /nfs/dbraw/zinc/75/95/01/929759501.db2.gz OJKHSNHXXWWHCF-HSZRJFAPSA-N 0 3 421.585 4.338 20 0 HIADHN Cc1cc(C(=O)N(CCN(C)C)Cc2cccc(F)c2)ccc1NC(=O)CC(C)C ZINC000524661510 929776290 /nfs/dbraw/zinc/77/62/90/929776290.db2.gz RCIKXWXQOZSDOG-UHFFFAOYSA-N 0 3 413.537 4.323 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1ccc(N2CCCCCC2)nc1)c1ccsc1 ZINC000524708028 929806549 /nfs/dbraw/zinc/80/65/49/929806549.db2.gz RMQVSOQYVMJAEU-HXUWFJFHSA-N 0 3 400.592 4.336 20 0 HIADHN COc1cc(-c2nnc(CN3CC[C@H](C)[C@H]4CCCC[C@H]43)o2)cc(OC)c1OC ZINC000524758836 929821025 /nfs/dbraw/zinc/82/10/25/929821025.db2.gz FYKAJZRENIJWKY-USXIJHARSA-N 0 3 401.507 4.163 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)NCc1ccc2ccccc2c1 ZINC000524777869 929826548 /nfs/dbraw/zinc/82/65/48/929826548.db2.gz HTNXEOALJQDIJW-UHFFFAOYSA-N 0 3 416.569 4.241 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)NCC1(c2cccc(Cl)c2)CC1 ZINC000524800120 929834369 /nfs/dbraw/zinc/83/43/69/929834369.db2.gz FLDCSYXCJQVQJK-UHFFFAOYSA-N 0 3 403.929 4.284 20 0 HIADHN O=C(CCCc1c[nH]c2ccccc12)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000524817999 929842431 /nfs/dbraw/zinc/84/24/31/929842431.db2.gz ZMGQMSLXGXDZPZ-UHFFFAOYSA-N 0 3 423.532 4.289 20 0 HIADHN CCCN(CCN(C)C)C(=O)c1cc2c(C)nn(-c3cccc(Cl)c3)c2s1 ZINC000524824845 929846028 /nfs/dbraw/zinc/84/60/28/929846028.db2.gz YGVPNHWVGHCEJL-UHFFFAOYSA-N 0 3 404.967 4.463 20 0 HIADHN O=C(NCc1ccc(-c2ccncc2)cc1)N[C@H](CN1CCCC1)c1ccccc1 ZINC000524829181 929848660 /nfs/dbraw/zinc/84/86/60/929848660.db2.gz DGSORLNMOXRQLR-XMMPIXPASA-N 0 3 400.526 4.385 20 0 HIADHN Cc1ccc(C(=O)N[C@@H](CN2CCCC2)c2ccccc2)cc1NC(=O)NC(C)(C)C ZINC000524853774 929859284 /nfs/dbraw/zinc/85/92/84/929859284.db2.gz IOTUZYPYBRWPLI-QFIPXVFZSA-N 0 3 422.573 4.482 20 0 HIADHN C[C@@H](CNC(=O)Nc1ccccc1Oc1ccccc1Cl)CN1CCN(C)CC1 ZINC000524856948 929860339 /nfs/dbraw/zinc/86/03/39/929860339.db2.gz CIYDFGZQMIOWOG-KRWDZBQOSA-N 0 3 416.953 4.137 20 0 HIADHN C[C@H](CNC(=O)Nc1ccccc1Oc1ccccc1Cl)CN1CCN(C)CC1 ZINC000524856949 929860575 /nfs/dbraw/zinc/86/05/75/929860575.db2.gz CIYDFGZQMIOWOG-QGZVFWFLSA-N 0 3 416.953 4.137 20 0 HIADHN C[C@@H]1CCC[C@@H](C)N1CCNC(=O)C(=O)Nc1cccc(CSC2CCCC2)c1 ZINC000524921309 929890276 /nfs/dbraw/zinc/89/02/76/929890276.db2.gz XRFAGOYSHLKDHA-QZTJIDSGSA-N 0 3 417.619 4.180 20 0 HIADHN Cc1ccc(C(=O)Nc2cccc(CNC(=O)c3cccc(CN(C)C)c3)c2)cc1 ZINC000524973803 929937910 /nfs/dbraw/zinc/93/79/10/929937910.db2.gz LHTFMXONBVUQAA-UHFFFAOYSA-N 0 3 401.510 4.239 20 0 HIADHN O=C(N[C@@H]1C[C@@H]1Cc1ccccc1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000525009451 929971311 /nfs/dbraw/zinc/97/13/11/929971311.db2.gz QVKOURNWHPFPCT-VWPQPMDRSA-N 0 3 402.460 4.188 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)CCc2ccc(Cl)cc2)cc1)[C@H]1CCCN(C)C1 ZINC000525066065 930013559 /nfs/dbraw/zinc/01/35/59/930013559.db2.gz FVEKWUMKVHHOGL-NRFANRHFSA-N 0 3 413.949 4.078 20 0 HIADHN CC(C)(C)CNC(=O)c1ccc(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)cc1 ZINC000525068530 930014963 /nfs/dbraw/zinc/01/49/63/930014963.db2.gz FRGKNYWEMVEDPL-QFIPXVFZSA-N 0 3 407.558 4.029 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2c[nH]cc2-c2ccccc2)cc1)[C@@H]1CCCN(C)C1 ZINC000525098729 930033960 /nfs/dbraw/zinc/03/39/60/930033960.db2.gz GSQBBEDHRKETQO-OAQYLSRUSA-N 0 3 416.525 4.100 20 0 HIADHN COc1cccc(-c2nn(-c3ccc(C)cc3)cc2C(=O)N(C)[C@H]2CCCN(C)C2)c1 ZINC000525105219 930038978 /nfs/dbraw/zinc/03/89/78/930038978.db2.gz AEOQCMMYOYPGTD-NRFANRHFSA-N 0 3 418.541 4.023 20 0 HIADHN C[C@@H]1CN(CC(=O)N(C)Cc2ccc(OC(F)F)cc2)CC[C@@H]1c1ccccc1 ZINC000525121737 930048852 /nfs/dbraw/zinc/04/88/52/930048852.db2.gz BYKSBNJBSLZHCO-UTKZUKDTSA-N 0 3 402.485 4.372 20 0 HIADHN COc1ccc(OC)c([C@@H]2CCCN2C(=O)CN2CC[C@@H](c3ccccc3)[C@H](C)C2)c1 ZINC000525122299 930048960 /nfs/dbraw/zinc/04/89/60/930048960.db2.gz DKNNKMBDMFZDJO-CKUXNOBLSA-N 0 3 422.569 4.493 20 0 HIADHN CC(C)CC(=O)Nc1ccc(C(=O)N(CCN(C)C)Cc2cccc(F)c2)cc1F ZINC000525139009 930057322 /nfs/dbraw/zinc/05/73/22/930057322.db2.gz QJTYQUXFDURHLM-UHFFFAOYSA-N 0 3 417.500 4.153 20 0 HIADHN CCn1nc(C(C)C)cc1C(=O)N(CCN1CCCC1)Cc1ccc(Cl)cc1 ZINC000525139099 930057550 /nfs/dbraw/zinc/05/75/50/930057550.db2.gz XPIIJSCFDPBSKF-UHFFFAOYSA-N 0 3 402.970 4.418 20 0 HIADHN Cc1cc(C(=O)NC[C@H]2CCCN2Cc2ccccc2)ccc1NC(=O)CC(C)C ZINC000525148331 930064915 /nfs/dbraw/zinc/06/49/15/930064915.db2.gz XYMJJOZOYLAKTK-JOCHJYFZSA-N 0 3 407.558 4.374 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2cccc(CC(=O)OC(C)(C)C)c2)N(C)C)cc1 ZINC000525228181 930093635 /nfs/dbraw/zinc/09/36/35/930093635.db2.gz YACPQMRZPIOYIL-NRFANRHFSA-N 0 3 411.546 4.304 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@H](C)N[C@H](C)c2ccc(OC(C)C)cc2)cc1OC ZINC000525244398 930102997 /nfs/dbraw/zinc/10/29/97/930102997.db2.gz SQXZXIHZDSAAHF-MSOLQXFVSA-N 0 3 414.546 4.189 20 0 HIADHN CN1CCN(CCCCNC(=O)N[C@H](CC(C)(C)C)c2ccc(Cl)cc2)CC1 ZINC000525249056 930105880 /nfs/dbraw/zinc/10/58/80/930105880.db2.gz VMJNNRCWBIICOZ-HXUWFJFHSA-N 0 3 409.018 4.144 20 0 HIADHN CC(C)(C)C[C@H](NC(=O)N1CCN(CC2CCOCC2)CC1)c1ccc(F)cc1 ZINC000525303936 930144773 /nfs/dbraw/zinc/14/47/73/930144773.db2.gz SMOHOQWMHQAKEG-NRFANRHFSA-N 0 3 405.558 4.057 20 0 HIADHN CCCN(C(=O)NCc1ccccc1NC(C)=O)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000525305954 930146149 /nfs/dbraw/zinc/14/61/49/930146149.db2.gz OVDJFJRNHOQAMQ-QHCPKHFHSA-N 0 3 422.573 4.231 20 0 HIADHN COC(=O)c1ccc(NC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)c(F)c1 ZINC000525311000 930150297 /nfs/dbraw/zinc/15/02/97/930150297.db2.gz GKUURJYBBKORIR-HXUWFJFHSA-N 0 3 424.394 4.005 20 0 HIADHN COc1ccc(SCCC(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)cc1OC ZINC000525338921 930176143 /nfs/dbraw/zinc/17/61/43/930176143.db2.gz JTUNQSSODBTIRR-PKOBYXMFSA-N 0 3 414.571 4.138 20 0 HIADHN CCCN(CCN(C)C)C(=O)c1ccc(OCc2ccc(Cl)cc2)c(OC)c1 ZINC000525341092 930178120 /nfs/dbraw/zinc/17/81/20/930178120.db2.gz WQRCPKNGIOZTQB-UHFFFAOYSA-N 0 3 404.938 4.341 20 0 HIADHN O=C(CCc1ccc(Cl)cc1)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000525352376 930190792 /nfs/dbraw/zinc/19/07/92/930190792.db2.gz LGINRAMQJDPRJI-UHFFFAOYSA-N 0 3 404.913 4.071 20 0 HIADHN Cc1ccc(C(=O)N2CCN(C3CCC(C)CC3)CC2)cc1NC(=O)NC(C)(C)C ZINC000525375312 930204445 /nfs/dbraw/zinc/20/44/45/930204445.db2.gz QEXIKKLELJCYEK-UHFFFAOYSA-N 0 3 414.594 4.252 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)c1cccc(Oc2cnccn2)c1 ZINC000525383110 930210202 /nfs/dbraw/zinc/21/02/02/930210202.db2.gz WJPVJZOTZWQDLE-LJQANCHMSA-N 0 3 402.498 4.006 20 0 HIADHN C[C@@H]1C[C@H]1C(=O)Nc1ccc(C(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)cc1 ZINC000525384200 930211040 /nfs/dbraw/zinc/21/10/40/930211040.db2.gz UDVXXQQAWPPKRA-DNVFCKCGSA-N 0 3 405.542 4.018 20 0 HIADHN C[C@@H]1C[C@@H]1C(=O)Nc1ccc(C(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)cc1 ZINC000525384201 930211436 /nfs/dbraw/zinc/21/14/36/930211436.db2.gz UDVXXQQAWPPKRA-MSYCTHLASA-N 0 3 405.542 4.018 20 0 HIADHN COCCn1cc(C(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)c2ccccc21 ZINC000525391820 930213983 /nfs/dbraw/zinc/21/39/83/930213983.db2.gz CMVWNMILAGCOOS-FQEVSTJZSA-N 0 3 405.542 4.024 20 0 HIADHN COc1ccc(OC(F)F)c(NC(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)c1 ZINC000525419666 930230979 /nfs/dbraw/zinc/23/09/79/930230979.db2.gz UYZBOBZLUSGADX-MRXNPFEDSA-N 0 3 419.472 4.425 20 0 HIADHN O=C(N[C@@H]1CCN(Cc2ccccc2)C1)[C@@H]1C[C@H]1c1ccccc1OC(F)(F)F ZINC000525474507 930265131 /nfs/dbraw/zinc/26/51/31/930265131.db2.gz CLAWPHIQWVNYJF-NZSAHSFTSA-N 0 3 404.432 4.079 20 0 HIADHN Cc1ccc([C@H](CNC(=O)CCSc2ccc3c(c2)OCCCO3)N(C)C)cc1 ZINC000525476122 930266270 /nfs/dbraw/zinc/26/62/70/930266270.db2.gz HVFSXPKYRHVBEJ-FQEVSTJZSA-N 0 3 414.571 4.058 20 0 HIADHN COc1ccc(C[C@H](NC(=O)c2cccc(CN(C)C)c2)c2ccccc2)cc1OC ZINC000525490303 930277484 /nfs/dbraw/zinc/27/74/84/930277484.db2.gz OOCGSKGHCZHKNX-QHCPKHFHSA-N 0 3 418.537 4.479 20 0 HIADHN CN(C)Cc1cccc(C(=O)NCc2cccc(NC(=O)c3cccc(F)c3)c2)c1 ZINC000525494028 930280501 /nfs/dbraw/zinc/28/05/01/930280501.db2.gz ADYOUYMZEGKHKX-UHFFFAOYSA-N 0 3 405.473 4.070 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)Cc2cccc3ccccc32)cc1)[C@@H]1CCCN(C)C1 ZINC000525580437 930342849 /nfs/dbraw/zinc/34/28/49/930342849.db2.gz UUHAWFOSVFYNJZ-HSZRJFAPSA-N 0 3 415.537 4.187 20 0 HIADHN CC[C@@H](Cc1ccccc1)N(C)CC(=O)N1CCC[C@H]1c1cc(OC)ccc1OC ZINC000525638575 930377724 /nfs/dbraw/zinc/37/77/24/930377724.db2.gz RTJFYBVWCNMZFL-REWPJTCUSA-N 0 3 410.558 4.320 20 0 HIADHN COc1ccccc1-c1ccc([C@@H](C)N(C)CCN2C(=O)NC3(CCCC3)C2=O)cc1 ZINC000525639040 930378384 /nfs/dbraw/zinc/37/83/84/930378384.db2.gz QHQYZZZNGQGLKD-GOSISDBHSA-N 0 3 421.541 4.220 20 0 HIADHN Cc1c(N[C@@H](C)C(C)C)cccc1C(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000525641867 930379136 /nfs/dbraw/zinc/37/91/36/930379136.db2.gz INUVCZYHWJLDEH-ZVDOUQERSA-N 0 3 415.622 4.413 20 0 HIADHN CC(C)CC(=O)Nc1ccc(C(=O)N(Cc2ccco2)C2CCN(C)CC2)cc1F ZINC000525649285 930381941 /nfs/dbraw/zinc/38/19/41/930381941.db2.gz LTOLUAXJBRGCJC-UHFFFAOYSA-N 0 3 415.509 4.140 20 0 HIADHN Cc1cccc(C(C)C)c1NC(=O)[C@H](C)NC[C@@H](c1cccs1)N1CCOCC1 ZINC000525757083 930432469 /nfs/dbraw/zinc/43/24/69/930432469.db2.gz BJLYORWEGMTWEZ-ICSRJNTNSA-N 0 3 415.603 4.170 20 0 HIADHN C[C@@H]1CN(Cc2cccc(NC(=O)c3oc4ccccc4c3CN(C)C)c2)C[C@H](C)O1 ZINC000525759007 930433246 /nfs/dbraw/zinc/43/32/46/930433246.db2.gz MSXPESJOZIYTNW-HDICACEKSA-N 0 3 421.541 4.356 20 0 HIADHN C[C@@H](NC(=O)CC1(N2CCOCC2)CCCC1)C(c1ccccc1)c1ccccc1 ZINC000525823969 930458420 /nfs/dbraw/zinc/45/84/20/930458420.db2.gz UMBYJOGBUWPSEV-OAQYLSRUSA-N 0 3 406.570 4.358 20 0 HIADHN CC(C)[C@H](CC(F)(F)F)NC(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000525841040 930461898 /nfs/dbraw/zinc/46/18/98/930461898.db2.gz ZSNMYPAZTRVOAT-KRWDZBQOSA-N 0 3 403.514 4.376 20 0 HIADHN C[C@H](N[C@H](CN1CCN(C)CC1)c1ccccc1)c1ccc(Br)cc1F ZINC000525857690 930469529 /nfs/dbraw/zinc/46/95/29/930469529.db2.gz SRMDYUCVMSRHHP-HRAATJIYSA-N 0 3 420.370 4.228 20 0 HIADHN O=C1[C@H](N[C@H](c2cccnc2)C2CC2)CCCN1Cc1cccc(C(F)(F)F)c1 ZINC000526083842 930523587 /nfs/dbraw/zinc/52/35/87/930523587.db2.gz IMUMYNFMQKHULE-UXHICEINSA-N 0 3 403.448 4.332 20 0 HIADHN COC(=O)c1ccsc1N1CC[C@H](N[C@H](C)c2cc3ccccc3s2)C1=O ZINC000526944680 930554359 /nfs/dbraw/zinc/55/43/59/930554359.db2.gz UCKNZEOFICEPPN-DOMZBBRYSA-N 0 3 400.525 4.206 20 0 HIADHN COC(=O)c1ccsc1N1CC[C@@H](N[C@H](C)c2cc3ccccc3s2)C1=O ZINC000526944681 930555033 /nfs/dbraw/zinc/55/50/33/930555033.db2.gz UCKNZEOFICEPPN-IUODEOHRSA-N 0 3 400.525 4.206 20 0 HIADHN CS(=O)(=O)[C@@H]1CCC[C@@H](N[C@H](c2ccc(Br)cc2Cl)C2CC2)C1 ZINC000527109282 930592801 /nfs/dbraw/zinc/59/28/01/930592801.db2.gz IKSLMHNZSDSKCE-CPUCHLNUSA-N 0 3 420.800 4.499 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCc1ncccc1F)c1ccc(C(F)(F)F)cc1 ZINC000527215897 930614460 /nfs/dbraw/zinc/61/44/60/930614460.db2.gz GJADACPBEXRZDG-GOSISDBHSA-N 0 3 412.431 4.122 20 0 HIADHN CN(CCc1ccncc1)Cc1cccc(Br)c1OC[C@H]1CCCO1 ZINC000527489770 930667547 /nfs/dbraw/zinc/66/75/47/930667547.db2.gz XCOBMQRHXHNTFF-GOSISDBHSA-N 0 3 405.336 4.076 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2ccc(C(=O)N3CCCCCC3)cc2)[C@H]1c1ccccc1 ZINC000530356919 930691803 /nfs/dbraw/zinc/69/18/03/930691803.db2.gz RJSHNVHDESKSLX-XZOQPEGZSA-N 0 3 420.557 4.270 20 0 HIADHN CN(C)c1ccc(NC(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)c(C(F)(F)F)c1 ZINC000530357474 930693895 /nfs/dbraw/zinc/69/38/95/930693895.db2.gz ZMJWRSNAJVMRQS-RTBURBONSA-N 0 3 406.452 4.338 20 0 HIADHN CCC(C)(C)NC(=O)c1ccc(NC(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)cc1 ZINC000530409370 930703858 /nfs/dbraw/zinc/70/38/58/930703858.db2.gz XDGXEZMKEGEUAY-SFTDATJTSA-N 0 3 408.546 4.172 20 0 HIADHN CCCC(=O)Nc1cccc(CNC(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000530587121 930760529 /nfs/dbraw/zinc/76/05/29/930760529.db2.gz JIUXEWYAEZLNHK-HSZRJFAPSA-N 0 3 422.573 4.231 20 0 HIADHN CN(C)Cc1ccc(-c2noc(-c3ccc(OCC(F)(F)C(F)F)nc3)n2)cc1 ZINC000530632065 930779037 /nfs/dbraw/zinc/77/90/37/930779037.db2.gz JYUUUEOGYGECDQ-UHFFFAOYSA-N 0 3 410.371 4.139 20 0 HIADHN C[C@H](NC(=O)NCC1(N2CCSCC2)CCCC1)c1cccc(N2CCCC2)c1 ZINC000530789512 930823959 /nfs/dbraw/zinc/82/39/59/930823959.db2.gz GOIIDEKWFJXGPN-IBGZPJMESA-N 0 3 416.635 4.009 20 0 HIADHN Cc1ccsc1[C@@H](Cc1ccccc1)NC(=O)CC1(N2CCOCC2)CCCC1 ZINC000530816995 930830933 /nfs/dbraw/zinc/83/09/33/930830933.db2.gz NICYAOGQPADUNT-OAQYLSRUSA-N 0 3 412.599 4.492 20 0 HIADHN O=C(CC1(N2CCOCC2)CCCC1)N[C@H](Cc1ccccc1)c1ccccc1F ZINC000530820589 930831543 /nfs/dbraw/zinc/83/15/43/930831543.db2.gz ZBWGWWLNXVWABA-HSZRJFAPSA-N 0 3 410.533 4.261 20 0 HIADHN COc1cccc(-c2noc([C@]3(C(F)(F)F)CCN(Cc4ccccc4)C3)n2)c1 ZINC000530879339 930847227 /nfs/dbraw/zinc/84/72/27/930847227.db2.gz AMTHLPJJMMEZSG-FQEVSTJZSA-N 0 3 403.404 4.451 20 0 HIADHN O=C(c1ccc2nccnc2c1)N1CCN(Cc2ccccc2)C2(CCCCC2)C1 ZINC000531019276 930886987 /nfs/dbraw/zinc/88/69/87/930886987.db2.gz JBWYSKHACCXTCR-UHFFFAOYSA-N 0 3 400.526 4.291 20 0 HIADHN CCN(C(=O)c1cccc(-c2nnc(C)o2)c1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000531047038 930896588 /nfs/dbraw/zinc/89/65/88/930896588.db2.gz PVQTZPOLTYVIPZ-JTSKRJEESA-N 0 3 404.514 4.343 20 0 HIADHN CCN(C(=O)c1cccc(-c2nnc(C)o2)c1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000531047037 930896676 /nfs/dbraw/zinc/89/66/76/930896676.db2.gz PVQTZPOLTYVIPZ-HTAPYJJXSA-N 0 3 404.514 4.343 20 0 HIADHN O=C(CC1(N2CCOCC2)CCCC1)N[C@H](c1cccs1)c1ccc(F)cc1 ZINC000531051443 930898215 /nfs/dbraw/zinc/89/82/15/930898215.db2.gz DJPTUIIOVBLUBF-NRFANRHFSA-N 0 3 402.535 4.128 20 0 HIADHN COc1ccc(-c2csc(CNC(=O)[C@H]3CCCN(Cc4cccnc4)C3)c2)cc1 ZINC000531081561 930912433 /nfs/dbraw/zinc/91/24/33/930912433.db2.gz FGEALPCMLSPGLS-FQEVSTJZSA-N 0 3 421.566 4.347 20 0 HIADHN O=C(NCCN1CCCC1)c1ccc(NC(=O)c2c(Cl)cccc2Cl)cc1 ZINC000531099324 930919045 /nfs/dbraw/zinc/91/90/45/930919045.db2.gz WJVOCXKEZNVHAN-UHFFFAOYSA-N 0 3 406.313 4.071 20 0 HIADHN Cc1ccc2[nH]c([C@@H]3CCCN(C(=O)c4ccc(Nc5ccncc5)cc4)C3)nc2c1 ZINC000531112520 930925007 /nfs/dbraw/zinc/92/50/07/930925007.db2.gz AIBBRRGNNOYJDK-LJQANCHMSA-N 0 3 411.509 4.452 20 0 HIADHN Cc1ccc2nc([C@@H]3CCCN(C(=O)c4ccc(Nc5ccncc5)cc4)C3)[nH]c2c1 ZINC000531112520 930925026 /nfs/dbraw/zinc/92/50/26/930925026.db2.gz AIBBRRGNNOYJDK-LJQANCHMSA-N 0 3 411.509 4.452 20 0 HIADHN Cc1cccc(CNC(=O)N(CCN(C)Cc2ccccc2)Cc2ccccc2)n1 ZINC000531156344 930946775 /nfs/dbraw/zinc/94/67/75/930946775.db2.gz IFXDGVOHZLPKDI-UHFFFAOYSA-N 0 3 402.542 4.234 20 0 HIADHN Cc1[nH]c(=O)c(C(=O)N2CCCN(Cc3ccccc3)CC2)cc1-c1ccccc1 ZINC000531163392 930949496 /nfs/dbraw/zinc/94/94/96/930949496.db2.gz IKYOCILDOOFCTG-UHFFFAOYSA-N 0 3 401.510 4.111 20 0 HIADHN Cc1cc([C@@H](C)NC(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)c(C)s1 ZINC000531183496 930955920 /nfs/dbraw/zinc/95/59/20/930955920.db2.gz FAGJWWZQYATDBZ-SOLBZPMBSA-N 0 3 407.624 4.347 20 0 HIADHN Cc1cc([C@H](C)NC(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)c(C)s1 ZINC000531183493 930956044 /nfs/dbraw/zinc/95/60/44/930956044.db2.gz FAGJWWZQYATDBZ-JZXOWHBKSA-N 0 3 407.624 4.347 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)Nc1ccccc1Br)[C@@H]1Oc2ccccc2[C@@H]1C ZINC000531212525 930968383 /nfs/dbraw/zinc/96/83/83/930968383.db2.gz CIWUTXCSWQGULA-SSHHRWTQSA-N 0 3 403.320 4.319 20 0 HIADHN CN(c1ccccc1)C1CCN(C(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)CC1 ZINC000531225989 930974211 /nfs/dbraw/zinc/97/42/11/930974211.db2.gz DEBJQZOKERCYAR-OAQYLSRUSA-N 0 3 409.549 4.165 20 0 HIADHN COc1cccc(C2=CCN(C(=O)NC[C@H](c3cccs3)N3CCCC3)CC2)c1 ZINC000531228000 930974529 /nfs/dbraw/zinc/97/45/29/930974529.db2.gz MKUZZCKHKSIKAO-OAQYLSRUSA-N 0 3 411.571 4.393 20 0 HIADHN CC(C)N(Cc1cccc(C(F)(F)F)c1)C(=O)CC1(N2CCOCC2)CCCC1 ZINC000531290871 931004492 /nfs/dbraw/zinc/00/44/92/931004492.db2.gz YODFSBKXOHORFJ-UHFFFAOYSA-N 0 3 412.496 4.478 20 0 HIADHN CC[C@H](C(=O)Nc1cc(Cl)c(NC(=O)c2cnccn2)c(Cl)c1)N(CC)CC ZINC000531300093 931007193 /nfs/dbraw/zinc/00/71/93/931007193.db2.gz XBODMXPJJFMMOT-MRXNPFEDSA-N 0 3 424.332 4.095 20 0 HIADHN Cc1cc(C)cc(C(=O)N2CCC[C@H](c3nc(-c4ccc(CN(C)C)cc4)no3)C2)c1 ZINC000531348540 931026509 /nfs/dbraw/zinc/02/65/09/931026509.db2.gz OAQHCIQWRRWFEO-NRFANRHFSA-N 0 3 418.541 4.435 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)C3CC(c4cccc(F)c4)C3)CC2)C[C@@H](C)O1 ZINC000531417791 931048961 /nfs/dbraw/zinc/04/89/61/931048961.db2.gz CGYXSRZKQNKQIE-NFAVZRQZSA-N 0 3 402.554 4.057 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)C3CC(c4cccc(F)c4)C3)CC2)C[C@H](C)O1 ZINC000531417790 931049550 /nfs/dbraw/zinc/04/95/50/931049550.db2.gz CGYXSRZKQNKQIE-HTAFUYNTSA-N 0 3 402.554 4.057 20 0 HIADHN COc1cc(CN[C@H](c2cnn(C)c2)C(C)(C)C)ccc1OCc1c(C)noc1C ZINC000531445203 931059335 /nfs/dbraw/zinc/05/93/35/931059335.db2.gz AFLWFWIZBZNJPG-JOCHJYFZSA-N 0 3 412.534 4.490 20 0 HIADHN O=C(NCCc1nc2cc(Cl)ccc2s1)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000531500111 931080390 /nfs/dbraw/zinc/08/03/90/931080390.db2.gz KYURMLYFHPVOOF-KRWDZBQOSA-N 0 3 414.962 4.066 20 0 HIADHN CC(C)N1CCN([C@H]2CCN(C(=O)c3ccc(-c4ccc(C(C)(C)C)cc4)o3)C2)CC1 ZINC000531578968 931108110 /nfs/dbraw/zinc/10/81/10/931108110.db2.gz UYYMQCUDVLATGC-QFIPXVFZSA-N 0 3 423.601 4.485 20 0 HIADHN O=C(NCc1ccncc1)Nc1cccc(CNCc2ccc(F)c3cccnc23)c1 ZINC000531581959 931109023 /nfs/dbraw/zinc/10/90/23/931109023.db2.gz DRMYYKUNRVSRCO-UHFFFAOYSA-N 0 3 415.472 4.380 20 0 HIADHN Cc1ccc(-c2csc3ncnc(N4CC[C@@H](N5CCN(C(C)C)CC5)C4)c23)cc1 ZINC000531582505 931109366 /nfs/dbraw/zinc/10/93/66/931109366.db2.gz OGJCOAZJMBTWIX-HXUWFJFHSA-N 0 3 421.614 4.271 20 0 HIADHN Cc1ccc(Oc2ccc(NC(=O)N3CC[C@@H](N4CCN(C(C)C)CC4)C3)cc2)cc1 ZINC000531586730 931110603 /nfs/dbraw/zinc/11/06/03/931110603.db2.gz NRDJNGOBFSPIGX-JOCHJYFZSA-N 0 3 422.573 4.420 20 0 HIADHN CC(C)NS(=O)(=O)Cc1ccccc1CNCc1ccc(Cl)c2cccnc12 ZINC000531612047 931126517 /nfs/dbraw/zinc/12/65/17/931126517.db2.gz VUACYBUKOWEQLZ-UHFFFAOYSA-N 0 3 417.962 4.006 20 0 HIADHN C[C@H](NC[C@H](c1cccs1)N1CCN(C)CC1)c1sccc1Br ZINC000531677408 931147576 /nfs/dbraw/zinc/14/75/76/931147576.db2.gz VXSWTDGBJNVTLI-DZGCQCFKSA-N 0 3 414.438 4.211 20 0 HIADHN CC(C)NC(=O)Nc1ccc([C@H](C)NCc2ccccc2CN2CCCC2=O)cc1 ZINC000531685120 931152122 /nfs/dbraw/zinc/15/21/22/931152122.db2.gz HCDGZVUGPJMLSA-SFHVURJKSA-N 0 3 408.546 4.190 20 0 HIADHN COc1cc(CN[C@H](C)c2ccc([S@](C)=O)cc2)ccc1OCC(F)(F)F ZINC000531690871 931155479 /nfs/dbraw/zinc/15/54/79/931155479.db2.gz BIPGALCVLVBIIX-QWVSSGJLSA-N 0 3 401.450 4.225 20 0 HIADHN CC(C)NS(=O)(=O)Cc1ccc(CN[C@H]2CCCOc3ccc(Cl)cc32)cc1 ZINC000531695435 931158790 /nfs/dbraw/zinc/15/87/90/931158790.db2.gz UNJZSTKTDXGAIE-FQEVSTJZSA-N 0 3 422.978 4.171 20 0 HIADHN C[C@@H](NCc1ccc(N2CCc3ccccc3C2)nc1)c1ccc2c(c1)CCC(=O)N2 ZINC000531699490 931162649 /nfs/dbraw/zinc/16/26/49/931162649.db2.gz RAIXPQRZWRKPBN-GOSISDBHSA-N 0 3 412.537 4.380 20 0 HIADHN C[C@H](CC(=O)Nc1ccccc1C(F)(F)F)N[C@@H]1CCCN(c2ccccc2)C1=O ZINC000531711487 931169813 /nfs/dbraw/zinc/16/98/13/931169813.db2.gz JLQRQTMXYBNANS-DNVCBOLYSA-N 0 3 419.447 4.208 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1C(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000531800873 931203278 /nfs/dbraw/zinc/20/32/78/931203278.db2.gz MKHCVCSIOBGUEI-XMMPIXPASA-N 0 3 416.569 4.285 20 0 HIADHN COc1ccc(NC(=O)CN(CCc2ccc(F)cc2)C2CCCC2)c(OC)c1 ZINC000531802389 931204645 /nfs/dbraw/zinc/20/46/45/931204645.db2.gz KPJPUEUDKZOBOY-UHFFFAOYSA-N 0 3 400.494 4.269 20 0 HIADHN CCS(=O)(=O)c1ccc(N2CCC(NCc3cccc(Cl)c3F)CC2)cc1 ZINC000531848391 931218949 /nfs/dbraw/zinc/21/89/49/931218949.db2.gz MJQXNFMKGADMTL-UHFFFAOYSA-N 0 3 410.942 4.031 20 0 HIADHN CCN(C(=O)Nc1ncn(Cc2ccccc2)n1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000531875214 931231271 /nfs/dbraw/zinc/23/12/71/931231271.db2.gz VJHVDOBSZADXCY-DENIHFKCSA-N 0 3 418.545 4.016 20 0 HIADHN Cn1c(CNC2CCN(Cc3ccc(Br)cc3)CC2)nc2ccccc21 ZINC000531883981 931234561 /nfs/dbraw/zinc/23/45/61/931234561.db2.gz DGOVVYXZFIUFAV-UHFFFAOYSA-N 0 3 413.363 4.090 20 0 HIADHN C[C@H](c1ccccc1)N(CC(=O)NCc1cccc(C(=O)NC2CC2)c1)CC1CCC1 ZINC000531905308 931243517 /nfs/dbraw/zinc/24/35/17/931243517.db2.gz LKIKCRCOHNEHPX-LJQANCHMSA-N 0 3 419.569 4.058 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@H](C)N[C@H]2CCc3ccc(OC)cc32)cc1 ZINC000531931027 931250109 /nfs/dbraw/zinc/25/01/09/931250109.db2.gz DPJOYQJWKCAYBZ-AOMKIAJQSA-N 0 3 402.560 4.064 20 0 HIADHN CCC(=O)Nc1cccc(CN[C@@H](C)CC(=O)N(C)Cc2cccc(Cl)c2)c1 ZINC000531937503 931253640 /nfs/dbraw/zinc/25/36/40/931253640.db2.gz GISKDKZIMXLECF-INIZCTEOSA-N 0 3 401.938 4.215 20 0 HIADHN CCC(=O)Nc1cccc(CN[C@@H](C)CC(=O)N(C)Cc2ccccc2Cl)c1 ZINC000531937679 931253898 /nfs/dbraw/zinc/25/38/98/931253898.db2.gz RATCZLFLFSTYRZ-INIZCTEOSA-N 0 3 401.938 4.215 20 0 HIADHN CC(C)Oc1ccc(CN[C@@H](C)CC(=O)Nc2cccc(Br)c2)cn1 ZINC000531937537 931254081 /nfs/dbraw/zinc/25/40/81/931254081.db2.gz NUOSVQUNAZJEEE-AWEZNQCLSA-N 0 3 406.324 4.138 20 0 HIADHN C[C@H](NCc1ccc(N2CCN(C)CC2)nc1)c1cccc(OCc2ccccc2)c1 ZINC000531941774 931255159 /nfs/dbraw/zinc/25/51/59/931255159.db2.gz UVXBGEVPSWZFOR-NRFANRHFSA-N 0 3 416.569 4.263 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)Cc1c[nH]c2cc(Br)ccc12 ZINC000531942380 931256098 /nfs/dbraw/zinc/25/60/98/931256098.db2.gz ZJEBGWTVPJKKHZ-UHFFFAOYSA-N 0 3 416.319 4.182 20 0 HIADHN COc1ccccc1-c1ccc([C@@H](C)NCc2ccc(N3CCOCC3)nc2)cc1 ZINC000531945413 931257929 /nfs/dbraw/zinc/25/79/29/931257929.db2.gz SSYCANOLZWAFII-LJQANCHMSA-N 0 3 403.526 4.445 20 0 HIADHN C[C@H](NCc1cccc(NC(=O)C2CCCCC2)c1)c1ccc(-n2cnnn2)cc1 ZINC000531956148 931263540 /nfs/dbraw/zinc/26/35/40/931263540.db2.gz AWYDQCAOFGPYIZ-KRWDZBQOSA-N 0 3 404.518 4.032 20 0 HIADHN C[C@H](N[C@@H](CN1CCN(C)CC1)c1ccccc1)c1ccccc1Br ZINC000531965891 931268720 /nfs/dbraw/zinc/26/87/20/931268720.db2.gz RKZKSHNUMFFANM-UWJYYQICSA-N 0 3 402.380 4.088 20 0 HIADHN COc1cc(OC)c(CCN[C@H](C)c2sccc2Br)c(OC)c1 ZINC000531970602 931270517 /nfs/dbraw/zinc/27/05/17/931270517.db2.gz PYCVOCAWCNQMLG-LLVKDONJSA-N 0 3 400.338 4.430 20 0 HIADHN CN1CCN(c2ccc(CN[C@H]3CCCc4c(Cl)sc(Cl)c43)cn2)CC1 ZINC000531989253 931278346 /nfs/dbraw/zinc/27/83/46/931278346.db2.gz KZFCPSBJBUTMGU-HNNXBMFYSA-N 0 3 411.402 4.369 20 0 HIADHN CN1CCN(c2ccc(CN[C@@H]3CCCc4nc(-c5ccccc5)sc43)cn2)CC1 ZINC000531989925 931278601 /nfs/dbraw/zinc/27/86/01/931278601.db2.gz XPXJJPLVJKHFST-HXUWFJFHSA-N 0 3 419.598 4.124 20 0 HIADHN COc1ccc(CNCc2ccccc2-n2ccc(C)n2)cc1OCc1cccnc1 ZINC000532015769 931285673 /nfs/dbraw/zinc/28/56/73/931285673.db2.gz YXKQLVQNOOHPJZ-UHFFFAOYSA-N 0 3 414.509 4.453 20 0 HIADHN CCCN(C(=O)NCc1c(CC)noc1CC)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000532038973 931293995 /nfs/dbraw/zinc/29/39/95/931293995.db2.gz DAYIWUFKTAXXEL-FQEVSTJZSA-N 0 3 412.578 4.386 20 0 HIADHN CC(C)N1CCN([C@H]2CCN(C(=O)[C@@H](Sc3ccccc3)c3ccccc3)C2)CC1 ZINC000532088892 931307457 /nfs/dbraw/zinc/30/74/57/931307457.db2.gz HVIZMBFUVQKNSO-UPVQGACJSA-N 0 3 423.626 4.147 20 0 HIADHN CC(C)N1CCN([C@H]2CCN(C(=O)C3(c4ccc(Cl)c(Cl)c4)CCC3)C2)CC1 ZINC000532088128 931307873 /nfs/dbraw/zinc/30/78/73/931307873.db2.gz HZBAFOHKCITMIM-SFHVURJKSA-N 0 3 424.416 4.042 20 0 HIADHN CC[C@H](NCC(=O)Nc1cc(OC)cc(OC)c1)c1ccc(Br)cc1 ZINC000532114952 931317866 /nfs/dbraw/zinc/31/78/66/931317866.db2.gz LODDSLWKPAACBF-SFHVURJKSA-N 0 3 407.308 4.146 20 0 HIADHN CN(C(=O)[C@H](Cc1ccccc1)NCc1cccc(-n2cccn2)c1)c1ccccc1 ZINC000532123004 931321792 /nfs/dbraw/zinc/32/17/92/931321792.db2.gz OXDVPESBCSEEBB-VWLOTQADSA-N 0 3 410.521 4.236 20 0 HIADHN Fc1ccc(-c2nc3c(s2)[C@@H](NCc2ccc(N4CCOCC4)nc2)CCC3)cc1 ZINC000532200313 931346963 /nfs/dbraw/zinc/34/69/63/931346963.db2.gz FURWUALBGNMVLW-IBGZPJMESA-N 0 3 424.545 4.348 20 0 HIADHN COc1ccc([C@@H](C)N[C@H](C)c2ccc(OCC(=O)NC3CC3)cc2)cc1Cl ZINC000532211356 931353879 /nfs/dbraw/zinc/35/38/79/931353879.db2.gz QXDIRDIKWSRAHM-HUUCEWRRSA-N 0 3 402.922 4.418 20 0 HIADHN CC(C)NS(=O)(=O)Cc1ccccc1CN[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000532214870 931356249 /nfs/dbraw/zinc/35/62/49/931356249.db2.gz YQUCTHVVVYCYGF-OAHLLOKOSA-N 0 3 414.493 4.384 20 0 HIADHN CNC(=O)C1CCC(N[C@H](C)c2ccc(Br)cc2Br)CC1 ZINC000532217920 931358043 /nfs/dbraw/zinc/35/80/43/931358043.db2.gz CWZWPAQRZFEIJE-XSRFYTQQSA-N 0 3 418.173 4.167 20 0 HIADHN C[C@@H](CC(=O)Nc1ccccc1C(F)(F)F)NCc1ccc(OCC2CC2)nc1 ZINC000532219751 931358236 /nfs/dbraw/zinc/35/82/36/931358236.db2.gz RUKTZJZVLQPLEI-AWEZNQCLSA-N 0 3 407.436 4.396 20 0 HIADHN CSCc1cc(F)ccc1CNC(=O)N(CCN(C)C)Cc1ccccc1F ZINC000532290996 931387315 /nfs/dbraw/zinc/38/73/15/931387315.db2.gz FFBSORULUYZJII-UHFFFAOYSA-N 0 3 407.530 4.101 20 0 HIADHN CC(C)N1CCN([C@H]2CCN(C(=O)CCCCc3ccc(C(C)(C)C)cc3)C2)CC1 ZINC000532342990 931402239 /nfs/dbraw/zinc/40/22/39/931402239.db2.gz FRZQMIVUTLLORH-DEOSSOPVSA-N 0 3 413.650 4.324 20 0 HIADHN CCc1ccc(Cl)c(CC)c1NC(=O)N1CC[C@H](N2CCN(C(C)C)CC2)C1 ZINC000532348557 931404600 /nfs/dbraw/zinc/40/46/00/931404600.db2.gz GBNNOOLHDSRTRQ-SFHVURJKSA-N 0 3 407.002 4.097 20 0 HIADHN C[C@@H]1CN(C(=O)c2ccc(CNCc3ccc(Cl)c4cccnc34)cc2)C[C@H](C)O1 ZINC000532367496 931411375 /nfs/dbraw/zinc/41/13/75/931411375.db2.gz XCIWLVFKIPVTFQ-CALCHBBNSA-N 0 3 423.944 4.427 20 0 HIADHN FC(F)(F)c1ccc(OCCNCc2ccccc2OCc2ccncc2)nc1 ZINC000532373738 931414150 /nfs/dbraw/zinc/41/41/50/931414150.db2.gz YNFIDSSDDDLAFO-UHFFFAOYSA-N 0 3 403.404 4.243 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)nc2)cc1 ZINC000532446772 931438884 /nfs/dbraw/zinc/43/88/84/931438884.db2.gz XPOSRUPDMVWROA-QRVBRYPASA-N 0 3 405.546 4.040 20 0 HIADHN CC[C@H](N[C@H](C)c1ccc(NC(=O)C2CC2)cc1)c1ccccc1OCC(=O)N(C)C ZINC000532455183 931442512 /nfs/dbraw/zinc/44/25/12/931442512.db2.gz AUYTWERKPFVXDG-VGSWGCGISA-N 0 3 423.557 4.304 20 0 HIADHN Cc1ccc(C)c(Oc2ccc(CN[C@H](C)c3ccc(-n4cnnn4)cc3)cn2)c1 ZINC000532459301 931444709 /nfs/dbraw/zinc/44/47/09/931444709.db2.gz MQOBAQIURDLQOP-GOSISDBHSA-N 0 3 400.486 4.317 20 0 HIADHN COc1cc(CN[C@H](C)c2ccc(S(=O)(=O)N3CCCCC3)cc2)ccc1C ZINC000532468146 931448646 /nfs/dbraw/zinc/44/86/46/931448646.db2.gz GOLXIGCGDSDBJL-GOSISDBHSA-N 0 3 402.560 4.029 20 0 HIADHN CC(C)NS(=O)(=O)Cc1ccc(CN[C@H](C)c2ccccc2C(F)(F)F)cc1 ZINC000532467756 931448704 /nfs/dbraw/zinc/44/87/04/931448704.db2.gz HHFNWVPJXWMQRG-OAHLLOKOSA-N 0 3 414.493 4.384 20 0 HIADHN O=C(c1ccc(CN[C@@H]2CCSc3ccc(Cl)cc32)cc1)N1CCOCC1 ZINC000532472112 931451173 /nfs/dbraw/zinc/45/11/73/931451173.db2.gz MNBPWUKDGXXZLD-LJQANCHMSA-N 0 3 402.947 4.139 20 0 HIADHN CC(C)COc1ccc([C@H](C)NCc2ccccc2CS(=O)(=O)NC(C)C)cc1 ZINC000532482847 931456252 /nfs/dbraw/zinc/45/62/52/931456252.db2.gz SYSZPZMKAXHEOB-IBGZPJMESA-N 0 3 418.603 4.400 20 0 HIADHN CC(C)(C)c1ccc(S(=O)(=O)CCNC2CCN(c3ccccc3)CC2)cc1 ZINC000532514556 931470831 /nfs/dbraw/zinc/47/08/31/931470831.db2.gz FRGJAPNUJREJHQ-UHFFFAOYSA-N 0 3 400.588 4.016 20 0 HIADHN COc1ccc(NC(=O)C[C@@H](C)NCc2cc(C)ccc2OC(F)F)c(OC)c1 ZINC000532543535 931516943 /nfs/dbraw/zinc/51/69/43/931516943.db2.gz RMGMNIUSXBHLDY-CQSZACIVSA-N 0 3 408.445 4.121 20 0 HIADHN COc1ccc(OC)c(NC(=O)C[C@@H](C)NCc2cc(C)ccc2OC(F)F)c1 ZINC000532543537 931517260 /nfs/dbraw/zinc/51/72/60/931517260.db2.gz RUSLHIBWMPQNCD-CQSZACIVSA-N 0 3 408.445 4.121 20 0 HIADHN COc1cc(OC)cc(N2CC[C@@H](N[C@H](C)c3sccc3Br)C2)c1 ZINC000532549723 931518955 /nfs/dbraw/zinc/51/89/55/931518955.db2.gz QNIJCJMSOKATNJ-CHWSQXEVSA-N 0 3 411.365 4.457 20 0 HIADHN CO[C@@H](C)CN(CC(=O)NC[C@H](c1c[nH]c2ccccc21)c1ccccc1)C(C)C ZINC000532586912 931544017 /nfs/dbraw/zinc/54/40/17/931544017.db2.gz UBFPJUDYHWAAJW-UGKGYDQZSA-N 0 3 407.558 4.161 20 0 HIADHN C[C@H](NCc1cnn(Cc2ccccc2)c1)[C@@H](OC1CCOCC1)c1ccccc1 ZINC000532615536 931555020 /nfs/dbraw/zinc/55/50/20/931555020.db2.gz DLBOMOKSBDFKIF-NBGIEHNGSA-N 0 3 405.542 4.346 20 0 HIADHN C[C@@H](NCc1cnn(Cc2ccccc2)c1)[C@@H](OC1CCOCC1)c1ccccc1 ZINC000532615534 931555468 /nfs/dbraw/zinc/55/54/68/931555468.db2.gz DLBOMOKSBDFKIF-CJFMBICVSA-N 0 3 405.542 4.346 20 0 HIADHN O=C(CN[C@H](Cc1ccccc1)c1ccccc1)NC[C@H]1CCN(c2ccccc2)C1 ZINC000532642256 931564573 /nfs/dbraw/zinc/56/45/73/931564573.db2.gz PVPMWGANQSYMCV-ZEQKJWHPSA-N 0 3 413.565 4.203 20 0 HIADHN O=C(CCN1CCCN(C(=O)Nc2cccc(Cl)c2)CC1)Nc1ccc(F)cc1 ZINC000532668556 931576232 /nfs/dbraw/zinc/57/62/32/931576232.db2.gz SOHSZGUVBDQTDB-UHFFFAOYSA-N 0 3 418.900 4.048 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc(CNCc2cccc(-c3ccccn3)c2)cc1 ZINC000532672364 931577996 /nfs/dbraw/zinc/57/79/96/931577996.db2.gz RFLYSHWNUBCRBW-UHFFFAOYSA-N 0 3 409.555 4.069 20 0 HIADHN CC(C)N(C)S(=O)(=O)c1ccc(CNCc2cccc(-c3ccccn3)c2)cc1 ZINC000532672823 931578654 /nfs/dbraw/zinc/57/86/54/931578654.db2.gz VTDBFOYGDVNHSX-UHFFFAOYSA-N 0 3 409.555 4.067 20 0 HIADHN COc1ccc([C@H]2CCCN2C(=O)CN[C@@H](c2ccccc2)C2CCC2)cc1OC ZINC000532686231 931583869 /nfs/dbraw/zinc/58/38/69/931583869.db2.gz GBNORPLEWJHERT-BWKNWUBXSA-N 0 3 408.542 4.498 20 0 HIADHN CCc1ccc(CCN2CCC(C(=O)c3ccc4c(c3)NC(=O)[C@H](C)O4)CC2)cc1 ZINC000532690660 931585842 /nfs/dbraw/zinc/58/58/42/931585842.db2.gz NRIKBPKAAOETGM-KRWDZBQOSA-N 0 3 406.526 4.106 20 0 HIADHN C[C@H](NCc1cccc(NC(=O)CCN2CCOCC2)c1)c1ccccc1C(C)(C)C ZINC000532849885 931661125 /nfs/dbraw/zinc/66/11/25/931661125.db2.gz DXIXBUQHXKNZNG-FQEVSTJZSA-N 0 3 423.601 4.496 20 0 HIADHN COc1ccc(CNC[C@H](CO)Cc2ccccc2C(F)(F)F)c(Cl)c1OC ZINC000532868053 931673435 /nfs/dbraw/zinc/67/34/35/931673435.db2.gz NHIFUAARQRSUND-CYBMUJFWSA-N 0 3 417.855 4.317 20 0 HIADHN CC(C)Oc1ccc(CNCc2ccc(Br)cc2N2CCOCC2)cc1 ZINC000532878532 931677113 /nfs/dbraw/zinc/67/71/13/931677113.db2.gz KMQLFNUDXDEUGA-UHFFFAOYSA-N 0 3 419.363 4.363 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)CN(C)CCCCc2ccccc2)cc1OC ZINC000532919367 931694795 /nfs/dbraw/zinc/69/47/95/931694795.db2.gz YAECJOSGCBWLNP-QFIPXVFZSA-N 0 3 410.558 4.322 20 0 HIADHN COc1ccc(C2=NN(C(=O)CN([C@H](C)C3CC3)C3CC3)[C@@H](c3ccco3)C2)cc1 ZINC000532929535 931699798 /nfs/dbraw/zinc/69/97/98/931699798.db2.gz FMMUKNIZPOCJEL-OPAMFIHVSA-N 0 3 407.514 4.229 20 0 HIADHN COc1cc(CNCc2c(C)c(C)c(C)c(C)c2C)cc(Cl)c1OCC(N)=O ZINC000532932232 931701823 /nfs/dbraw/zinc/70/18/23/931701823.db2.gz OZANAYXOCPORGV-UHFFFAOYSA-N 0 3 404.938 4.045 20 0 HIADHN Cc1[nH]c(=O)c(C(=O)NC2CCN([C@@H](C)c3ccncc3)CC2)cc1-c1ccccc1 ZINC000533048005 931753182 /nfs/dbraw/zinc/75/31/82/931753182.db2.gz CRWLEIWFWCWKNV-SFHVURJKSA-N 0 3 416.525 4.113 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccnc2)C1)N1CCC(Oc2ccccc2Cl)CC1 ZINC000533126371 931776117 /nfs/dbraw/zinc/77/61/17/931776117.db2.gz UXOTUSKALILCKX-LJQANCHMSA-N 0 3 413.949 4.017 20 0 HIADHN O=C(c1cccc(COC2CCOCC2)c1)N(CCN1CCCC1)c1ccccc1 ZINC000533186831 931804138 /nfs/dbraw/zinc/80/41/38/931804138.db2.gz YODYTRYTZWHNPU-UHFFFAOYSA-N 0 3 408.542 4.125 20 0 HIADHN O=C(CN1CCC(Cc2ccccc2)CC1)N1CCC(OCc2ccccc2)CC1 ZINC000533222199 931813685 /nfs/dbraw/zinc/81/36/85/931813685.db2.gz UHQIYEHPBBHQJD-UHFFFAOYSA-N 0 3 406.570 4.149 20 0 HIADHN O=C(CCN1CCN(c2cccc(O)c2)CC1)Nc1ccccc1-c1ccccc1 ZINC000533236062 931815837 /nfs/dbraw/zinc/81/58/37/931815837.db2.gz YCVDYWBQYNBMSL-UHFFFAOYSA-N 0 3 401.510 4.210 20 0 HIADHN COC1CCC(N(C)CC(=O)Nc2cc(C3CCCC3)nn2-c2ccccc2)CC1 ZINC000533299083 931833009 /nfs/dbraw/zinc/83/30/09/931833009.db2.gz JWMLLXKPQHDBFO-UHFFFAOYSA-N 0 3 410.562 4.358 20 0 HIADHN C[C@H](NCc1ccc(Br)cn1)[C@@H](OC1CCOCC1)c1ccccc1 ZINC000533329130 931839818 /nfs/dbraw/zinc/83/98/18/931839818.db2.gz XBAUDINPSIGQJB-MGPUTAFESA-N 0 3 405.336 4.259 20 0 HIADHN COc1cc(C(C)=O)ccc1OC[C@@H](O)CN(Cc1cccc(F)c1)C1CCCC1 ZINC000533349468 931845319 /nfs/dbraw/zinc/84/53/19/931845319.db2.gz DVHXZWHQCQMETN-QFIPXVFZSA-N 0 3 415.505 4.221 20 0 HIADHN CC(C)(C)OC(=O)C1CCN(CCC(=O)Nc2c(Cl)cccc2Cl)CC1 ZINC000533399904 931857933 /nfs/dbraw/zinc/85/79/33/931857933.db2.gz KERNOHOVXSRGFI-UHFFFAOYSA-N 0 3 401.334 4.376 20 0 HIADHN Cc1nc(-c2cccc(NC(=O)CN3CCN(C4CCC(C)CC4)CC3)c2)cs1 ZINC000533435898 931868006 /nfs/dbraw/zinc/86/80/06/931868006.db2.gz OUBOKRXRHYXCAE-UHFFFAOYSA-N 0 3 412.603 4.253 20 0 HIADHN CCCCOc1ccc([C@@H](C)N[C@H]2CCCN(CC(F)(F)F)C2=O)cc1OC ZINC000533449119 931872673 /nfs/dbraw/zinc/87/26/73/931872673.db2.gz MKDJZMGHSNWLSW-ZBFHGGJFSA-N 0 3 402.457 4.078 20 0 HIADHN CC(C)Cc1ncc(CN[C@H](C)CC(=O)Nc2cccc(N3CCCC3)c2)s1 ZINC000533449411 931873474 /nfs/dbraw/zinc/87/34/74/931873474.db2.gz SRGXFUMLORYBKM-QGZVFWFLSA-N 0 3 400.592 4.449 20 0 HIADHN Cc1ccccc1O[C@@H]1CCCC[C@H]1NC(=O)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000533450498 931874185 /nfs/dbraw/zinc/87/41/85/931874185.db2.gz KSZAGNANMOSWOT-CQOQZXRMSA-N 0 3 407.558 4.108 20 0 HIADHN FC(F)(F)c1cccnc1OCCNCc1ccccc1OCc1cccnc1 ZINC000533466278 931876547 /nfs/dbraw/zinc/87/65/47/931876547.db2.gz PTSCTMHYTZLFLP-UHFFFAOYSA-N 0 3 403.404 4.243 20 0 HIADHN Cc1cccc([C@H]2CCCN2CCc2nc3sc4c(c3c(N)n2)CC[C@H](C)C4)n1 ZINC000533483214 931880939 /nfs/dbraw/zinc/88/09/39/931880939.db2.gz PUCBMZGKJQVQSN-KBXCAEBGSA-N 0 3 407.587 4.481 20 0 HIADHN COc1ccc(CN(C)C(=O)CN[C@@H](Cc2ccccc2)c2ccccc2)cc1OC ZINC000533494169 931884435 /nfs/dbraw/zinc/88/44/35/931884435.db2.gz IMZYFSXIQMHKEC-QHCPKHFHSA-N 0 3 418.537 4.236 20 0 HIADHN CCN(Cc1cccc(F)c1)C(=O)CNC1(c2ccc(Cl)cc2)CCOCC1 ZINC000533523021 931893897 /nfs/dbraw/zinc/89/38/97/931893897.db2.gz HZHBVNAEKADMRB-UHFFFAOYSA-N 0 3 404.913 4.123 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3cccc(-c4ncco4)c3)CC2)C[C@H](C)O1 ZINC000533594106 931910597 /nfs/dbraw/zinc/91/05/97/931910597.db2.gz DMNROLDMNFFAKI-HDICACEKSA-N 0 3 412.534 4.085 20 0 HIADHN Cc1ccc(Cn2cccc(NC(=O)c3oc4ccccc4c3CN(C)C)c2=O)cc1 ZINC000533602305 931917696 /nfs/dbraw/zinc/91/76/96/931917696.db2.gz ZGDSAPOFVGURGR-UHFFFAOYSA-N 0 3 415.493 4.265 20 0 HIADHN O=C(CN1CC[C@@H](C2CCOCC2)C1)NCCC(c1ccccc1)c1ccccc1 ZINC000533670251 931960975 /nfs/dbraw/zinc/96/09/75/931960975.db2.gz KPKKMGWLWNRSSJ-XMMPIXPASA-N 0 3 406.570 4.073 20 0 HIADHN Cc1cc(C)c(CC(C(=O)Nc2ccc3c(c2)OCC(=O)N3)C(F)(F)F)c(C)c1 ZINC000533679126 931966471 /nfs/dbraw/zinc/96/64/71/931966471.db2.gz FFCABCYZQFOHOH-MRXNPFEDSA-N 0 3 406.404 4.302 20 0 HIADHN O=C(c1csc([C@H]2CCCO2)n1)N(CCN1CCCC1)Cc1ccc(Cl)cc1 ZINC000533705485 931980667 /nfs/dbraw/zinc/98/06/67/931980667.db2.gz NMPUAMQVZIDDIG-LJQANCHMSA-N 0 3 419.978 4.386 20 0 HIADHN CC[C@H](NCc1cnn(-c2ccc(F)cc2)c1)[C@@H](c1ccc(C)cc1)n1cncn1 ZINC000533739932 932001955 /nfs/dbraw/zinc/00/19/55/932001955.db2.gz MSMIEJIBVYFVIU-XZOQPEGZSA-N 0 3 404.493 4.069 20 0 HIADHN Cc1nc(C(C)C)sc1[C@H](C)N(C)C(=O)CCN1CCN(c2ccccc2)CC1 ZINC000533745378 932005280 /nfs/dbraw/zinc/00/52/80/932005280.db2.gz UMTFMTDUGDWYTO-IBGZPJMESA-N 0 3 414.619 4.307 20 0 HIADHN CN(C)CCN(C(=O)c1ccc(C(=O)N(C)c2ccccc2)cc1)C1CCCCC1 ZINC000533801042 932037743 /nfs/dbraw/zinc/03/77/43/932037743.db2.gz PVEXVHHOKDZOOU-UHFFFAOYSA-N 0 3 407.558 4.300 20 0 HIADHN Cc1ccc(C)c(OC2CCN(C(=O)NC[C@@H](Cc3ccccc3)N(C)C)CC2)c1 ZINC000533810226 932042112 /nfs/dbraw/zinc/04/21/12/932042112.db2.gz HHDZHAUUAKFCPO-JOCHJYFZSA-N 0 3 409.574 4.029 20 0 HIADHN CN(C)[C@@H](CNC(=O)Nc1nnc(C(C)(C)c2ccccc2)s1)Cc1ccccc1 ZINC000533812752 932043233 /nfs/dbraw/zinc/04/32/33/932043233.db2.gz LOZXNWUROAZVIW-LJQANCHMSA-N 0 3 423.586 4.158 20 0 HIADHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1[nH]c(-c2cccc(C(F)(F)F)c2)nc1C ZINC000533846071 932058432 /nfs/dbraw/zinc/05/84/32/932058432.db2.gz WNLWQERTGSSSRJ-SJORKVTESA-N 0 3 406.452 4.103 20 0 HIADHN O=C(c1c[nH]c2cccc(Br)c12)N1CCCN(Cc2ccccc2)CC1 ZINC000533870235 932072388 /nfs/dbraw/zinc/07/23/88/932072388.db2.gz BHGBEXJVKLSTNI-UHFFFAOYSA-N 0 3 412.331 4.279 20 0 HIADHN O=C(CNC1(c2ccc(Cl)cc2)CCCCC1)Nc1nnc(-c2ccco2)o1 ZINC000533873254 932073585 /nfs/dbraw/zinc/07/35/85/932073585.db2.gz QEOQUOLCRXAYEQ-UHFFFAOYSA-N 0 3 400.866 4.371 20 0 HIADHN Cc1n[nH]c(C)c1[C@H](C)CC(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1 ZINC000533873888 932074514 /nfs/dbraw/zinc/07/45/14/932074514.db2.gz HUVXJBNXIVHSPD-CQSZACIVSA-N 0 3 410.484 4.129 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)c1ccc(C(=O)Nc2ccccc2)cc1 ZINC000533891057 932083937 /nfs/dbraw/zinc/08/39/37/932083937.db2.gz BQRMNSUKVGSWBY-UHFFFAOYSA-N 0 3 419.500 4.282 20 0 HIADHN Cc1nc(-c2ccc(CNC(=O)N[C@@H]3CCN(C)[C@@H]3c3ccccc3)cc2)cs1 ZINC000533945621 932119313 /nfs/dbraw/zinc/11/93/13/932119313.db2.gz SBSNOAOLUMUBPO-IFMALSPDSA-N 0 3 406.555 4.363 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)N[C@H](c1cccnc1)C1CC1 ZINC000533967386 932143264 /nfs/dbraw/zinc/14/32/64/932143264.db2.gz SAFCKMGTSPHWIM-FQEVSTJZSA-N 0 3 420.479 4.325 20 0 HIADHN COc1cc(C(=O)N2C[C@H]3CCCN3Cc3ccccc32)sc1Br ZINC000533999366 932180283 /nfs/dbraw/zinc/18/02/83/932180283.db2.gz FQDCTSDAYUMTMC-CYBMUJFWSA-N 0 3 407.333 4.144 20 0 HIADHN CN1CC[C@@H](NC(=O)c2ccc(NC(=O)c3cccs3)cc2)[C@@H]1c1ccccc1 ZINC000534017281 932198556 /nfs/dbraw/zinc/19/85/56/932198556.db2.gz DEFALFMHLXEEKP-CTNGQTDRSA-N 0 3 405.523 4.176 20 0 HIADHN COc1ccccc1[C@@H](NC(=O)c1cccc(CN2CCCC2)c1)c1ccccn1 ZINC000534104651 932281429 /nfs/dbraw/zinc/28/14/29/932281429.db2.gz PYZSBJQHKWXRIB-XMMPIXPASA-N 0 3 401.510 4.205 20 0 HIADHN COc1ccc(COCCCC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)cc1 ZINC000534114988 932286567 /nfs/dbraw/zinc/28/65/67/932286567.db2.gz YZSVXJRFBRQROU-NRFANRHFSA-N 0 3 410.558 4.115 20 0 HIADHN O=C(CC1CCC(c2ccccc2)CC1)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1CO ZINC000534183254 932319650 /nfs/dbraw/zinc/31/96/50/932319650.db2.gz BUUIDIWZHFIXTA-JRXXQQOISA-N 0 3 420.597 4.350 20 0 HIADHN CN(C)CCN(Cc1cccc(O)c1)C(=O)c1ccc(Sc2ccccn2)cc1 ZINC000534191017 932323559 /nfs/dbraw/zinc/32/35/59/932323559.db2.gz NIMROLABWWFZLS-UHFFFAOYSA-N 0 3 407.539 4.142 20 0 HIADHN CN(C)CCN(Cc1cccc(O)c1)C(=O)CCCCc1nc2ccccc2s1 ZINC000534190970 932323619 /nfs/dbraw/zinc/32/36/19/932323619.db2.gz WSZUEOWMMFCTBA-UHFFFAOYSA-N 0 3 411.571 4.305 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)C(=O)N[C@H]1CCCc2ccc(C(C)C)cc21 ZINC000534245086 932362092 /nfs/dbraw/zinc/36/20/92/932362092.db2.gz NXAOTFBFPIUUJZ-NRFANRHFSA-N 0 3 423.557 4.013 20 0 HIADHN Cc1cnc(CCN(C)Cc2ccnc(-c3ccc(Br)cc3)n2)s1 ZINC000534378599 932406542 /nfs/dbraw/zinc/40/65/42/932406542.db2.gz HEGCJQRDHRCNDO-UHFFFAOYSA-N 0 3 403.349 4.346 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@H](C)NCc2cnc([C@@H]3CCCO3)s2)CC1 ZINC000534465474 932483210 /nfs/dbraw/zinc/48/32/10/932483210.db2.gz OQVFHOWNBVWWNH-KKSFZXQISA-N 0 3 418.582 4.126 20 0 HIADHN Cc1cc(C)c(CC(C(=O)Nc2cc(-c3nccn3C)nn2C)C(F)(F)F)c(C)c1 ZINC000534474031 932502098 /nfs/dbraw/zinc/50/20/98/932502098.db2.gz AGJCTSVEVHHUHH-MRXNPFEDSA-N 0 3 419.451 4.106 20 0 HIADHN COc1ccc(CN[C@H]2CCN(C(C)=O)c3ccccc32)cc1OCc1cccnc1 ZINC000534511366 932539583 /nfs/dbraw/zinc/53/95/83/932539583.db2.gz VMXZCOLBUICSOA-QFIPXVFZSA-N 0 3 417.509 4.257 20 0 HIADHN CN1CC[C@H](NC(=O)N2CCC[C@@H](c3nc4c(s3)CCCC4)C2)[C@@H]1c1ccccc1 ZINC000534682385 932651402 /nfs/dbraw/zinc/65/14/02/932651402.db2.gz QPWFKXRNIKHNNB-CBQOVEMMSA-N 0 3 424.614 4.356 20 0 HIADHN CN(CCCc1cc(-c2ccccc2)no1)C(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000534683120 932653737 /nfs/dbraw/zinc/65/37/37/932653737.db2.gz AEUDHQCQOPDVSU-UPVQGACJSA-N 0 3 418.541 4.361 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)[C@@H]2C[C@@H]3CCCC[C@@H]3N2C(=O)c2ccccc2)c1 ZINC000534699924 932671201 /nfs/dbraw/zinc/67/12/01/932671201.db2.gz HCKVIKDLRZXGSC-XWGVYQGASA-N 0 3 419.569 4.469 20 0 HIADHN CN1CC[C@H](NC(=O)NC2(c3cccc(Br)c3)CC2)[C@@H]1c1ccccc1 ZINC000534724183 932692481 /nfs/dbraw/zinc/69/24/81/932692481.db2.gz SIBBIWSVVDYAIK-OALUTQOASA-N 0 3 414.347 4.183 20 0 HIADHN CN1CC[C@@H](NC(=O)c2cccc(NC(=O)c3cccs3)c2)[C@H]1c1ccccc1 ZINC000534754060 932729794 /nfs/dbraw/zinc/72/97/94/932729794.db2.gz JZUXBFCKWQSPGN-TZIWHRDSSA-N 0 3 405.523 4.176 20 0 HIADHN CN1CC[C@H](NC(=O)c2cccc(NC(=O)c3cccs3)c2)[C@H]1c1ccccc1 ZINC000534754058 932729866 /nfs/dbraw/zinc/72/98/66/932729866.db2.gz JZUXBFCKWQSPGN-PZJWPPBQSA-N 0 3 405.523 4.176 20 0 HIADHN CN1CC[C@H](NC(=O)c2cccc(NC(=O)c3cccs3)c2)[C@@H]1c1ccccc1 ZINC000534754057 932730312 /nfs/dbraw/zinc/73/03/12/932730312.db2.gz JZUXBFCKWQSPGN-FPOVZHCZSA-N 0 3 405.523 4.176 20 0 HIADHN CCOc1ccc(F)c(NC(=O)N(Cc2ccccc2)C2CCN(C)CC2)c1F ZINC000534778199 932759763 /nfs/dbraw/zinc/75/97/63/932759763.db2.gz ZIMIJWKLIQWVOO-UHFFFAOYSA-N 0 3 403.473 4.492 20 0 HIADHN Clc1cc2c(c(Br)c1)CC[C@@H]2NCc1ccc(N2CCOCC2)nc1 ZINC000534792660 932774060 /nfs/dbraw/zinc/77/40/60/932774060.db2.gz ALNWBAKBAPYQBD-SFHVURJKSA-N 0 3 422.754 4.111 20 0 HIADHN COc1ccc(C[C@H](C)CN(C)[C@@H](C)C(=O)Nc2ccccc2OC(F)F)cc1 ZINC000534913510 932836298 /nfs/dbraw/zinc/83/62/98/932836298.db2.gz ZMLHJSQKBVKEPR-HOTGVXAUSA-N 0 3 406.473 4.434 20 0 HIADHN C[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)N(CCN(C)C)Cc1cccc(O)c1 ZINC000534924135 932840330 /nfs/dbraw/zinc/84/03/30/932840330.db2.gz JWFHYVCRTGUXIY-INIZCTEOSA-N 0 3 408.464 4.180 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NC1C[C@H](C)O[C@@H](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000535061888 932895780 /nfs/dbraw/zinc/89/57/80/932895780.db2.gz SYPGNVGLPRUPMJ-YZVOILCLSA-N 0 3 415.500 4.344 20 0 HIADHN O=C(NC1CC1)c1ccc(CN(Cc2ccc(OC[C@H]3CCCO3)cc2)C2CC2)cc1 ZINC000535071264 932897545 /nfs/dbraw/zinc/89/75/45/932897545.db2.gz SFRSRLJOXLUKTH-RUZDIDTESA-N 0 3 420.553 4.301 20 0 HIADHN COc1cc(CN(Cc2ccc(-n3cncn3)cc2)C2CC2)ccc1OC(F)F ZINC000535074442 932897739 /nfs/dbraw/zinc/89/77/39/932897739.db2.gz QXHWYCUHWXQXBG-UHFFFAOYSA-N 0 3 400.429 4.042 20 0 HIADHN Cc1nc(-c2cccc(C)c2)[nH]c1C(=O)NC1CCN([C@@H](C)c2ccncc2)CC1 ZINC000535249860 933036362 /nfs/dbraw/zinc/03/63/62/933036362.db2.gz BZZCKNPEKQXIMD-SFHVURJKSA-N 0 3 403.530 4.044 20 0 HIADHN Cc1cccc(C(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)c1Br ZINC000535287600 933051136 /nfs/dbraw/zinc/05/11/36/933051136.db2.gz JDKFCFAGPXVMSF-IAGOWNOFSA-N 0 3 423.395 4.109 20 0 HIADHN CN(C)[C@H](CNC(=O)Nc1cccc2c1CN(c1ccccn1)C2)c1ccccc1 ZINC000535323996 933072911 /nfs/dbraw/zinc/07/29/11/933072911.db2.gz AVRYUNZZMKRUEC-JOCHJYFZSA-N 0 3 401.514 4.026 20 0 HIADHN CC(C)Cn1ncc(C(=O)NC[C@H](C(C)C)N2CCc3ccccc3C2)c1C(F)F ZINC000535329162 933076237 /nfs/dbraw/zinc/07/62/37/933076237.db2.gz GNDNDMCXSVVJPM-HXUWFJFHSA-N 0 3 418.532 4.289 20 0 HIADHN CN(CCCc1cc(-c2ccccc2)n[nH]1)C(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000535396940 933114893 /nfs/dbraw/zinc/11/48/93/933114893.db2.gz RQGOSYHWSAHJBI-UPVQGACJSA-N 0 3 417.557 4.096 20 0 HIADHN CCOC(=O)CC1(CNC(=O)c2oc3ccccc3c2CN(C)C)CCCCC1 ZINC000535415929 933125154 /nfs/dbraw/zinc/12/51/54/933125154.db2.gz UHDZCYSSHLSJHS-UHFFFAOYSA-N 0 3 400.519 4.128 20 0 HIADHN CN1CC[C@H](NC(=O)NCc2ccc(Oc3ccccc3)nc2)[C@H]1c1ccccc1 ZINC000535438886 933136019 /nfs/dbraw/zinc/13/60/19/933136019.db2.gz XSVYIOIVBUDBBE-JTHBVZDNSA-N 0 3 402.498 4.119 20 0 HIADHN C[C@@H]1CCN(C(=O)Nc2cc3c(cc2Cl)OCO3)CCN1Cc1ccccc1 ZINC000535471398 933161990 /nfs/dbraw/zinc/16/19/90/933161990.db2.gz FBWCFOWKLMIDRH-OAHLLOKOSA-N 0 3 401.894 4.197 20 0 HIADHN Cc1ncc(-c2ccccc2)cc1NC(=O)N1CCC(CN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000535538083 933231472 /nfs/dbraw/zinc/23/14/72/933231472.db2.gz LJYCQYMJRPTURD-OALUTQOASA-N 0 3 422.573 4.410 20 0 HIADHN Cc1ncc(-c2ccccc2)cc1NC(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000535538084 933231551 /nfs/dbraw/zinc/23/15/51/933231551.db2.gz LJYCQYMJRPTURD-RTBURBONSA-N 0 3 422.573 4.410 20 0 HIADHN Cc1c(Cl)cc(F)c(NC(=O)N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)c1F ZINC000535621976 933272244 /nfs/dbraw/zinc/27/22/44/933272244.db2.gz NIVQSQRDMIQCQU-BETUJISGSA-N 0 3 415.912 4.280 20 0 HIADHN O=C(NCC(F)(F)F)C1CCN(Cc2ccc(-c3ccccc3Cl)o2)CC1 ZINC000535794211 933392997 /nfs/dbraw/zinc/39/29/97/933392997.db2.gz DSOYELPZOHHZCT-UHFFFAOYSA-N 0 3 400.828 4.491 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(CN3CC[C@H](C)[C@@H](n4ccnc4)C3)c2)cc1 ZINC000535850005 933431788 /nfs/dbraw/zinc/43/17/88/933431788.db2.gz CCEYMGCFKFECBT-MBSDFSHPSA-N 0 3 404.514 4.227 20 0 HIADHN C[C@@H](C(=O)Nc1ccc2c(c1)OC1(CCCCC1)O2)N1CC[C@@H](C2CCOCC2)C1 ZINC000535871356 933453929 /nfs/dbraw/zinc/45/39/29/933453929.db2.gz SQMJTQWBTZPLMJ-PKOBYXMFSA-N 0 3 414.546 4.194 20 0 HIADHN C[C@@H](Cc1cccc(Cl)c1)C(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000535909069 933483725 /nfs/dbraw/zinc/48/37/25/933483725.db2.gz BYPZBMAVAZJEEU-IPMKNSEASA-N 0 3 406.998 4.257 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccc(O)cc1)C(=O)c1csc(-c2ccoc2)n1 ZINC000536033936 933583064 /nfs/dbraw/zinc/58/30/64/933583064.db2.gz APEUKJOYDHIKPB-GOSISDBHSA-N 0 3 411.527 4.235 20 0 HIADHN CN1CC[C@@H](NC(=O)NCc2cccc(COCc3ccco3)c2)[C@H]1c1ccccc1 ZINC000536094051 933644340 /nfs/dbraw/zinc/64/43/40/933644340.db2.gz CMXIAZOORNQSPC-DNQXCXABSA-N 0 3 419.525 4.241 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@@H]2CNC(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)cc1 ZINC000536155155 933690904 /nfs/dbraw/zinc/69/09/04/933690904.db2.gz MUAKBJGQVUUVPF-YCAMKHIRSA-N 0 3 407.558 4.207 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)[C@H](C)N[C@@H](c1ccc2c(c1)OCCO2)C1CC1 ZINC000537289738 933699955 /nfs/dbraw/zinc/69/99/55/933699955.db2.gz HSKHHKMTIIZTKZ-YEJXKQKISA-N 0 3 416.905 4.188 20 0 HIADHN CCNC(=O)COc1ccc(CN[C@@H](c2cc3ccccc3o2)C(C)C)cc1OC ZINC000537350548 933730767 /nfs/dbraw/zinc/73/07/67/933730767.db2.gz UXTQGAVIKRVUDQ-XMMPIXPASA-N 0 3 410.514 4.443 20 0 HIADHN Cc1cc(C(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)nn1C1CCCCC1 ZINC000537386120 933749661 /nfs/dbraw/zinc/74/96/61/933749661.db2.gz AGBRHVFBLHABCM-UHFFFAOYSA-N 0 3 409.578 4.479 20 0 HIADHN CC(C)(C)[C@@H](CN1CCc2ccccc2C1)NC(=O)N1CCC[C@H]1C1CCOCC1 ZINC000537527794 933800544 /nfs/dbraw/zinc/80/05/44/933800544.db2.gz OQGFHVZEZXDIIN-XZOQPEGZSA-N 0 3 413.606 4.060 20 0 HIADHN COc1ccccc1-c1csc([C@H]2CCCN(CCOC[C@@H]3CCCO3)C2)n1 ZINC000562493370 945090231 /nfs/dbraw/zinc/09/02/31/945090231.db2.gz MKKWHXFYCGBKFG-ROUUACIJSA-N 0 3 402.560 4.194 20 0 HIADHN C[C@@H]1CN(C2CCOCC2)CCN1C(=O)Nc1ccc(-c2ccc(Cl)s2)nc1 ZINC000562752743 945114452 /nfs/dbraw/zinc/11/44/52/945114452.db2.gz GYGMCIIQDJYLOK-CQSZACIVSA-N 0 3 420.966 4.181 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@@H](NCc2cccc(C(=O)N[C@H](C)CC)c2)c2ccccc21 ZINC000562758478 945117767 /nfs/dbraw/zinc/11/77/67/945117767.db2.gz SEBCGKGTSCSZBG-NLSFWIRASA-N 0 3 408.542 4.486 20 0 HIADHN CCS(=O)(=O)c1ccc(CN[C@@H]2CCCc3ccc(Br)cc32)cc1 ZINC000562877510 945136693 /nfs/dbraw/zinc/13/66/93/945136693.db2.gz WQIGIXVUMRGFDD-LJQANCHMSA-N 0 3 408.361 4.410 20 0 HIADHN CC(C)N1CC[C@H](NC(=O)c2cccc(CN(C)C)c2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000537521196 938315482 /nfs/dbraw/zinc/31/54/82/938315482.db2.gz MSKKWWKDDAWXJF-VXKWHMMOSA-N 0 3 417.956 4.495 20 0 HIADHN Cc1nc([C@H]2CCCN([C@@H](C(=O)Nc3cc(C)ccc3C)c3ccccc3)C2)n[nH]1 ZINC000537564334 938325951 /nfs/dbraw/zinc/32/59/51/938325951.db2.gz SVDLRTFFECSQED-RBBKRZOGSA-N 0 3 403.530 4.289 20 0 HIADHN Cc1n[nH]c([C@H]2CCCN([C@@H](C(=O)Nc3cc(C)ccc3C)c3ccccc3)C2)n1 ZINC000537564334 938325953 /nfs/dbraw/zinc/32/59/53/938325953.db2.gz SVDLRTFFECSQED-RBBKRZOGSA-N 0 3 403.530 4.289 20 0 HIADHN Cc1nnc([C@H]2CCCN([C@@H](C(=O)Nc3cc(C)ccc3C)c3ccccc3)C2)[nH]1 ZINC000537564334 938325957 /nfs/dbraw/zinc/32/59/57/938325957.db2.gz SVDLRTFFECSQED-RBBKRZOGSA-N 0 3 403.530 4.289 20 0 HIADHN CCOc1c(Br)cc(CN(C)[C@H](CCO)c2ccccc2)cc1OC ZINC000537624335 938338089 /nfs/dbraw/zinc/33/80/89/938338089.db2.gz IPWHHIZTTPCESV-GOSISDBHSA-N 0 3 408.336 4.412 20 0 HIADHN COc1ccc(CN2CCC[C@@H](C(=O)N3CCCC3)C2)cc1OCc1ccccc1 ZINC000537628004 938339081 /nfs/dbraw/zinc/33/90/81/938339081.db2.gz YEULVEHXRUTANV-JOCHJYFZSA-N 0 3 408.542 4.109 20 0 HIADHN Cc1nn(Cc2ccc(C)cc2)c(C)c1CN1CCC[C@@H](CNC(=O)C(C)(C)C)C1 ZINC000537630573 938340554 /nfs/dbraw/zinc/34/05/54/938340554.db2.gz AYKADCHXKUKJRS-QFIPXVFZSA-N 0 3 410.606 4.231 20 0 HIADHN O=C1NCCCN1C1CCN(Cc2ccc(-c3ccc(C(F)(F)F)cc3)o2)CC1 ZINC000537632337 938341105 /nfs/dbraw/zinc/34/11/05/938341105.db2.gz MRKUPZCEMSMCSG-UHFFFAOYSA-N 0 3 407.436 4.345 20 0 HIADHN C[C@@H]1Oc2ccc(C(=O)C3CCN(Cc4ccc5ncccc5c4)CC3)cc2NC1=O ZINC000537637703 938342944 /nfs/dbraw/zinc/34/29/44/938342944.db2.gz NNOLMPVQKXAZPC-INIZCTEOSA-N 0 3 415.493 4.049 20 0 HIADHN CN(CCC(=O)OC(C)(C)C)Cc1cn(Cc2ccccc2)nc1-c1cccnc1 ZINC000537649275 938346747 /nfs/dbraw/zinc/34/67/47/938346747.db2.gz XQNMWBMHLNQFFJ-UHFFFAOYSA-N 0 3 406.530 4.157 20 0 HIADHN CC[C@@H](O)CN(Cc1cn(C)nc1-c1ccc2c(c1)OCCCO2)Cc1ccccc1 ZINC000537650285 938347026 /nfs/dbraw/zinc/34/70/26/938347026.db2.gz STHOAEUNGXCJSK-JOCHJYFZSA-N 0 3 421.541 4.022 20 0 HIADHN Brc1ccc2c(c1)C=C(CN1CCC(OC[C@@H]3CCCCO3)CC1)CO2 ZINC000537662019 938348950 /nfs/dbraw/zinc/34/89/50/938348950.db2.gz ZSVINBIYBNHVRT-FQEVSTJZSA-N 0 3 422.363 4.275 20 0 HIADHN CC[C@@H]1c2ccsc2CCN1C(=O)CN1CCC[C@H]1Cn1cnc2ccccc21 ZINC000537678896 938352436 /nfs/dbraw/zinc/35/24/36/938352436.db2.gz WCWKUIWXMPAHRX-FXAWDEMLSA-N 0 3 408.571 4.098 20 0 HIADHN CCOc1cc(CN2CCC[C@H](Cn3ccnn3)C2)ccc1OCc1ccccc1 ZINC000537695780 938357350 /nfs/dbraw/zinc/35/73/50/938357350.db2.gz BLPBOLMBNYMSOC-QFIPXVFZSA-N 0 3 406.530 4.168 20 0 HIADHN COc1ccc(CN2CCC[C@H](c3nc4ccc(F)cc4o3)C2)c(OC)c1OC ZINC000537698905 938358518 /nfs/dbraw/zinc/35/85/18/938358518.db2.gz YHOLMXRLTHPCHU-HNNXBMFYSA-N 0 3 400.450 4.372 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)C3(Cc4ccc(Cl)cc4)CC3)CC2)C[C@H](C)O1 ZINC000537747637 938368807 /nfs/dbraw/zinc/36/88/07/938368807.db2.gz NIAXWJAEHMSGCK-ROUUACIJSA-N 0 3 404.982 4.011 20 0 HIADHN COCCc1nc(C)c([C@@H](C)N[C@@H](C)c2ccc(NC(=O)NC3CC3)cc2)s1 ZINC000537765371 938372667 /nfs/dbraw/zinc/37/26/67/938372667.db2.gz OIAAIQCDMWAAGN-UONOGXRCSA-N 0 3 402.564 4.336 20 0 HIADHN Cc1nc([C@H](NC(=O)c2cccc(CN3CCCC3)c2)c2ccc(Cl)cc2)no1 ZINC000537792653 938377373 /nfs/dbraw/zinc/37/73/73/938377373.db2.gz PZTWODZIBIIHEH-HXUWFJFHSA-N 0 3 410.905 4.147 20 0 HIADHN C[C@@H](C(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1)C(F)(F)F ZINC000537827147 938385121 /nfs/dbraw/zinc/38/51/21/938385121.db2.gz FOEYBJRVALAJJL-KRWDZBQOSA-N 0 3 405.464 4.188 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)Nc2ccc3[nH]c(C(F)F)nc3c2)CC1 ZINC000537882629 938398806 /nfs/dbraw/zinc/39/88/06/938398806.db2.gz DMSQCVQGTNKHTR-CYBMUJFWSA-N 0 3 414.460 4.243 20 0 HIADHN COc1cc(CN[C@@H](C)c2ccc(-c3ccccc3F)s2)ccc1OCC(N)=O ZINC000537938211 938423535 /nfs/dbraw/zinc/42/35/35/938423535.db2.gz QNFPKONSSAJWII-AWEZNQCLSA-N 0 3 414.502 4.278 20 0 HIADHN COc1cccc(COCCN[C@H](C)c2ccc(S(=O)(=O)C3CCCC3)cc2)c1 ZINC000537942917 938426222 /nfs/dbraw/zinc/42/62/22/938426222.db2.gz UQUYEPTUVIWFNC-GOSISDBHSA-N 0 3 417.571 4.279 20 0 HIADHN Cc1c([C@@H](C)N[C@@H](C)Cn2ncc3ccccc3c2=O)cnn1-c1cc(C)ccc1C ZINC000537941985 938426480 /nfs/dbraw/zinc/42/64/80/938426480.db2.gz KXKDPJBHNRRWJY-RBUKOAKNSA-N 0 3 415.541 4.247 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)N[C@@H]2CC(=O)N(C)[C@H]2c2ccc(F)c(F)c2)cc1 ZINC000537944457 938427073 /nfs/dbraw/zinc/42/70/73/938427073.db2.gz BGMQHFSBMRUXNR-RUGFAHKUSA-N 0 3 410.468 4.082 20 0 HIADHN CC1CCN(S(=O)(=O)Cc2ccccc2CN[C@@H]2CCc3c2cccc3F)CC1 ZINC000537950174 938429737 /nfs/dbraw/zinc/42/97/37/938429737.db2.gz LHPYGZIJPQZYJK-HSZRJFAPSA-N 0 3 416.562 4.165 20 0 HIADHN Cc1nc(-c2ccccc2Br)sc1[C@H](C)N[C@H]1CC(=O)N(C2CC2)C1 ZINC000537955060 938431151 /nfs/dbraw/zinc/43/11/51/938431151.db2.gz FWBYLBGGBKVVRE-AAEUAGOBSA-N 0 3 420.376 4.295 20 0 HIADHN Cc1nc(-c2ccccc2Br)sc1[C@H](C)N[C@@H]1CC(=O)N(C2CC2)C1 ZINC000537955062 938431982 /nfs/dbraw/zinc/43/19/82/938431982.db2.gz FWBYLBGGBKVVRE-WCQYABFASA-N 0 3 420.376 4.295 20 0 HIADHN C[C@@H]1Cc2ccccc2[C@H]1NCc1ccc(Br)cc1N1CCOCC1 ZINC000537957342 938432760 /nfs/dbraw/zinc/43/27/60/938432760.db2.gz BHHCHDLMXAULIR-VFNWGFHPSA-N 0 3 401.348 4.309 20 0 HIADHN C[C@@H](CC(=O)N(C)Cc1ccccc1Cl)NCc1cccc2c1OCCCO2 ZINC000537957708 938433218 /nfs/dbraw/zinc/43/32/18/938433218.db2.gz RQLJEYIBWRMNJI-INIZCTEOSA-N 0 3 402.922 4.028 20 0 HIADHN Cc1nc2c(s1)[C@H](NCc1ccc(Br)cc1N1CCOCC1)CCC2 ZINC000537960799 938435455 /nfs/dbraw/zinc/43/54/55/938435455.db2.gz JVXOMFRNHMAPLS-MRXNPFEDSA-N 0 3 422.392 4.218 20 0 HIADHN C[C@H](NCc1cccc(NS(C)(=O)=O)c1)c1cccc(OCc2ccccc2)c1 ZINC000537972782 938442118 /nfs/dbraw/zinc/44/21/18/938442118.db2.gz CAKMOLKXNQMMAB-SFHVURJKSA-N 0 3 410.539 4.488 20 0 HIADHN CCc1cc(N2CCC[C@@H](N[C@@H](C)c3cc(Cl)c(OC)cc3OC)C2)ncn1 ZINC000537979934 938446326 /nfs/dbraw/zinc/44/63/26/938446326.db2.gz BROAIWLDUJIBNS-GOEBONIOSA-N 0 3 404.942 4.029 20 0 HIADHN CC[C@@H](N[C@H]1CCN(Cc2ccc(OC)cc2)C1=O)c1ccc(OC(F)F)cc1 ZINC000537982028 938447064 /nfs/dbraw/zinc/44/70/64/938447064.db2.gz HQBPYTCGLHHLST-UXHICEINSA-N 0 3 404.457 4.138 20 0 HIADHN COc1cc(CN[C@@H](C)c2cc(Cl)cc(Cl)c2)ccc1OCC(=O)N(C)C ZINC000537989510 938451799 /nfs/dbraw/zinc/45/17/99/938451799.db2.gz BTOHKLHJMLGNNU-ZDUSSCGKSA-N 0 3 411.329 4.320 20 0 HIADHN COc1cc(CN[C@@H](C)c2cccc(C(F)(F)F)c2)ccc1OCC(=O)N(C)C ZINC000537990760 938452428 /nfs/dbraw/zinc/45/24/28/938452428.db2.gz JTXHSZAFMDDDHF-AWEZNQCLSA-N 0 3 410.436 4.032 20 0 HIADHN CN1CCN(CCCNC(=O)c2ccccc2COC(C)(C)C)[C@H](c2ccccc2)C1 ZINC000538010291 938460899 /nfs/dbraw/zinc/46/08/99/938460899.db2.gz ZKOOBFUBSHUGRB-DEOSSOPVSA-N 0 3 423.601 4.110 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)N[C@H]2CCN(CCCc3ccccc3)C2=O)cc1 ZINC000538018785 938464378 /nfs/dbraw/zinc/46/43/78/938464378.db2.gz XDNBJRGZYQNQQS-CYFREDJKSA-N 0 3 402.542 4.065 20 0 HIADHN Fc1ccc([C@H](NCCCc2ccc(Br)cc2F)c2nnc[nH]2)cc1 ZINC000563319591 945178062 /nfs/dbraw/zinc/17/80/62/945178062.db2.gz XOPWWKDLPTXWBI-KRWDZBQOSA-N 0 3 407.262 4.157 20 0 HIADHN COCCOc1c(Cl)cc(NC(=O)N(CCN(C)C)C2CCCC2)cc1Cl ZINC000538031839 938474064 /nfs/dbraw/zinc/47/40/64/938474064.db2.gz HUCOYBKVLAYBAZ-UHFFFAOYSA-N 0 3 418.365 4.357 20 0 HIADHN CCOc1ccc([C@@H](N[C@@H](C)c2cccc(S(N)(=O)=O)c2)C(C)C)cc1OCC ZINC000538061503 938491329 /nfs/dbraw/zinc/49/13/29/938491329.db2.gz UHNFCTBKKCQSIF-AOMKIAJQSA-N 0 3 420.575 4.179 20 0 HIADHN C[C@@H](NC[C@@H](c1ccc(F)cc1)N1CCOCC1)c1nc2ccc(Cl)cc2n1C ZINC000538061177 938491550 /nfs/dbraw/zinc/49/15/50/938491550.db2.gz DYGRBKOOCRBHNN-VFNWGFHPSA-N 0 3 416.928 4.090 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)N[C@H]1CCO[C@H]1c1ccc(Cl)c(F)c1 ZINC000538116092 938505823 /nfs/dbraw/zinc/50/58/23/938505823.db2.gz IEUYTJKNRYDLMQ-SFTDATJTSA-N 0 3 419.928 4.083 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(OCc2cccnc2)cc1)C(=O)N(C)Cc1cccc(F)c1 ZINC000538123747 938510266 /nfs/dbraw/zinc/51/02/66/938510266.db2.gz AZAPTSQPFZMBHQ-RBUKOAKNSA-N 0 3 421.516 4.497 20 0 HIADHN CC[C@H](N[C@@H](C)C(=O)Nc1cc(NC(C)=O)ccc1OC)c1cccc(Cl)c1 ZINC000538128895 938513144 /nfs/dbraw/zinc/51/31/44/938513144.db2.gz PHAKEUJAEDUIGE-UGSOOPFHSA-N 0 3 403.910 4.375 20 0 HIADHN CC[C@H](NCC(=O)Nc1cc(C2CC2)nn1-c1ccccc1)c1ccc(OC)cc1 ZINC000538142206 938519197 /nfs/dbraw/zinc/51/91/97/938519197.db2.gz YBOWIXPDQDJPNO-NRFANRHFSA-N 0 3 404.514 4.438 20 0 HIADHN CC[C@H](NCC(=O)Nc1cc(C(F)(F)F)ccc1-n1cncn1)c1ccc(C)cc1 ZINC000538149600 938521844 /nfs/dbraw/zinc/52/18/44/938521844.db2.gz CZUBLLTVYQOBQL-KRWDZBQOSA-N 0 3 417.435 4.274 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)NC(=O)Nc1ccccc1)c1ccc(OCC(F)(F)F)cc1 ZINC000538163006 938531097 /nfs/dbraw/zinc/53/10/97/938531097.db2.gz HYJVXAILHLHZQE-KGLIPLIRSA-N 0 3 409.408 4.015 20 0 HIADHN Nc1ccc(F)c(NC(=O)CCN[C@H](COc2ccccc2F)c2ccccc2)c1 ZINC000538165408 938531991 /nfs/dbraw/zinc/53/19/91/938531991.db2.gz IWEGEIBQJOANBN-OAQYLSRUSA-N 0 3 411.452 4.286 20 0 HIADHN Cc1cccc([C@@H](C)NCC(=O)Nc2ccccc2I)c1C ZINC000538187094 938542627 /nfs/dbraw/zinc/54/26/27/938542627.db2.gz DKNTUFSESHWPBC-CQSZACIVSA-N 0 3 408.283 4.197 20 0 HIADHN CC(C)(C)c1ccc(S(=O)(=O)CCN[C@H](c2ccccc2)[C@H]2CCOC2)cc1 ZINC000538191259 938546678 /nfs/dbraw/zinc/54/66/78/938546678.db2.gz ROPMUDHOJJFACO-SIKLNZKXSA-N 0 3 401.572 4.125 20 0 HIADHN Cc1n[nH]c(C)c1[C@@H]1CCCN1C(=O)N[C@H](CN1CCc2ccccc2C1)C(C)(C)C ZINC000538215527 938559412 /nfs/dbraw/zinc/55/94/12/938559412.db2.gz YUGDNBKQPCWPLQ-FCHUYYIVSA-N 0 3 423.605 4.346 20 0 HIADHN Cc1cc(NC(=O)CN[C@@H](C[C@H]2CCOC2)c2ccccc2)n(-c2ccc(F)cc2)n1 ZINC000538232747 938566844 /nfs/dbraw/zinc/56/68/44/938566844.db2.gz HEAQHPDXEPWXBK-GCJKJVERSA-N 0 3 422.504 4.016 20 0 HIADHN Cc1cc(NC(=O)CN[C@H](C[C@H]2CCOC2)c2ccccc2)n(-c2ccc(F)cc2)n1 ZINC000538232751 938567374 /nfs/dbraw/zinc/56/73/74/938567374.db2.gz HEAQHPDXEPWXBK-XMSQKQJNSA-N 0 3 422.504 4.016 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)N[C@H](C)C(=O)Nc2ccccc2OC(F)F)cc1 ZINC000538262288 938577920 /nfs/dbraw/zinc/57/79/20/938577920.db2.gz QXKRFOIGXNNREP-LSDHHAIUSA-N 0 3 414.456 4.460 20 0 HIADHN CCC[C@H]1CN(Cc2csc(N(CC)C(C)=O)n2)CCN1Cc1ccccc1 ZINC000538300759 938586995 /nfs/dbraw/zinc/58/69/95/938586995.db2.gz UYURIZNQMDHTAR-NRFANRHFSA-N 0 3 400.592 4.002 20 0 HIADHN COc1ccc(SC)c(OC)c1C(=O)N(C)C1CCN(Cc2ccccc2)CC1 ZINC000538300208 938587223 /nfs/dbraw/zinc/58/72/23/938587223.db2.gz NKTFYMWBHGTDOR-UHFFFAOYSA-N 0 3 414.571 4.162 20 0 HIADHN Cn1cc(CN2CCC[C@H](c3nnc4ccc(C(F)(F)F)cn43)C2)c(C(C)(C)C)n1 ZINC000538307454 938588905 /nfs/dbraw/zinc/58/89/05/938588905.db2.gz XSCOMVYDDZPALG-AWEZNQCLSA-N 0 3 420.483 4.159 20 0 HIADHN C[C@H](N[C@H](c1ccc2c(c1)OCCO2)C1CC1)C(=O)N1CCSc2ccccc21 ZINC000538390635 938609547 /nfs/dbraw/zinc/60/95/47/938609547.db2.gz WGHRUVBFCUMXJZ-NYHFZMIOSA-N 0 3 410.539 4.026 20 0 HIADHN CC[C@H](N[C@H](C)[C@H](OC)c1ccccc1F)c1ccccc1OCC(=O)N(C)C ZINC000538406421 938612841 /nfs/dbraw/zinc/61/28/41/938612841.db2.gz DNVNCJUGRTUDPJ-CGYQNGNCSA-N 0 3 402.510 4.110 20 0 HIADHN COc1ccc([C@@H](C)NCCCNC(=O)c2ccc(F)cc2)c(Br)c1 ZINC000538405937 938612916 /nfs/dbraw/zinc/61/29/16/938612916.db2.gz JPJYAPGYLIASPB-CYBMUJFWSA-N 0 3 409.299 4.068 20 0 HIADHN COc1cc(OC)c(CNC[C@H]2CCN(C)[C@H]2c2ccc(Cl)c(F)c2)c(OC)c1 ZINC000538463710 938628135 /nfs/dbraw/zinc/62/81/35/938628135.db2.gz FHBMBULTCGJDPP-QRQCRPRQSA-N 0 3 422.928 4.288 20 0 HIADHN CC(C)(C)Cc1csc(NC(=O)c2ccc(CN3CCC(CO)CC3)cc2)n1 ZINC000538532747 938642945 /nfs/dbraw/zinc/64/29/45/938642945.db2.gz RLALQZSIQYGYPB-UHFFFAOYSA-N 0 3 401.576 4.188 20 0 HIADHN O=C(CCc1ccccc1)N1CC[C@H](N[C@@H]2CCCOc3cc4c(cc32)CCC4)C1 ZINC000538560759 938649495 /nfs/dbraw/zinc/64/94/95/938649495.db2.gz VAKWTIYFWMKNKW-LADGPHEKSA-N 0 3 404.554 4.212 20 0 HIADHN CCN(CC(F)(F)F)C(=O)[C@@H]1CCCN(Cc2c(F)cccc2N2CCCC2)C1 ZINC000538750888 938701640 /nfs/dbraw/zinc/70/16/40/938701640.db2.gz FFQMXMDYWOIPNX-MRXNPFEDSA-N 0 3 415.475 4.049 20 0 HIADHN CCOc1c(Br)cc(CN(C)CCC(=O)OC(C)(C)C)cc1OC ZINC000538751411 938702143 /nfs/dbraw/zinc/70/21/43/938702143.db2.gz KYXIGHSWDDUYQH-UHFFFAOYSA-N 0 3 402.329 4.020 20 0 HIADHN COC(=O)c1cc2cc(CN3CCC(OCc4ccccc4OC)CC3)ccc2o1 ZINC000538785600 938710125 /nfs/dbraw/zinc/71/01/25/938710125.db2.gz CFDNEXAEYMSGHZ-UHFFFAOYSA-N 0 3 409.482 4.409 20 0 HIADHN CCCN1CCN(c2ccccc2CNc2cccc(C(=O)N(CC)CC)c2)CC1 ZINC000538819226 938719773 /nfs/dbraw/zinc/71/97/73/938719773.db2.gz IEGGXKIEQUBRCX-UHFFFAOYSA-N 0 3 408.590 4.313 20 0 HIADHN OC1CCN(Cc2ccccc2NCc2ccccc2OCc2ccncc2)CC1 ZINC000538820922 938720126 /nfs/dbraw/zinc/72/01/26/938720126.db2.gz LAOYRXCNMOJDGS-UHFFFAOYSA-N 0 3 403.526 4.229 20 0 HIADHN Cc1nn(-c2ccc(Br)cc2)cc1CN1CC[C@H](C)[C@@H](n2ccnc2)C1 ZINC000538827299 938720958 /nfs/dbraw/zinc/72/09/58/938720958.db2.gz UGMSSBDHZYRCGT-YWZLYKJASA-N 0 3 414.351 4.223 20 0 HIADHN CS(=O)(=O)Cc1ccc(CN[C@H]2CCCc3ccc(Br)cc32)cc1 ZINC000538867820 938728570 /nfs/dbraw/zinc/72/85/70/938728570.db2.gz SZINEGJVBJFMFR-IBGZPJMESA-N 0 3 408.361 4.161 20 0 HIADHN COCCn1ccc2ccc(NC(=O)N[C@H]3C[C@H](C)N(Cc4ccccc4)C3)cc21 ZINC000538903147 938734584 /nfs/dbraw/zinc/73/45/84/938734584.db2.gz SYYPTWJCNRHLHI-AVRDEDQJSA-N 0 3 406.530 4.072 20 0 HIADHN Cc1cc(NC(=O)N[C@H]2CC23CCCCC3)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000538947559 938745103 /nfs/dbraw/zinc/74/51/03/938745103.db2.gz CUFMLBNMGKODET-SFTDATJTSA-N 0 3 407.562 4.483 20 0 HIADHN COc1ccc(CN(CC(=O)Nc2c(C)n[nH]c2C)[C@H]2CCCC[C@@H]2C)cc1OC ZINC000538955474 938748682 /nfs/dbraw/zinc/74/86/82/938748682.db2.gz HEOQVIJRVNWNOQ-KXBFYZLASA-N 0 3 414.550 4.063 20 0 HIADHN COc1ccc(CN(CC(=O)Nc2c(C)n[nH]c2C)[C@@H]2CCCC[C@H]2C)cc1OC ZINC000538955472 938748921 /nfs/dbraw/zinc/74/89/21/938748921.db2.gz HEOQVIJRVNWNOQ-DNVCBOLYSA-N 0 3 414.550 4.063 20 0 HIADHN CCc1nc2ccccc2n1C1CCN([C@@H](C)C(=O)N(C)Cc2cccc(F)c2)CC1 ZINC000538956398 938749104 /nfs/dbraw/zinc/74/91/04/938749104.db2.gz VKKHEEJJCHUAFU-SFHVURJKSA-N 0 3 422.548 4.422 20 0 HIADHN CCOCCCn1c(C(C)C)nnc1N1CCN(Cc2cccc3ccccc32)CC1 ZINC000563483415 945200982 /nfs/dbraw/zinc/20/09/82/945200982.db2.gz XTHCOCPQNIWGMW-UHFFFAOYSA-N 0 3 421.589 4.304 20 0 HIADHN O=S(=O)(c1ccc(CN[C@H]2CCc3c2cccc3Cl)cc1)N1CCCCC1 ZINC000539020250 938770891 /nfs/dbraw/zinc/77/08/91/938770891.db2.gz WEPOCHJXZBBMMQ-NRFANRHFSA-N 0 3 404.963 4.292 20 0 HIADHN Cc1c([C@H](C)N[C@H](C)Cn2ncc3ccccc3c2=O)cnn1-c1cccc(Cl)c1 ZINC000539044988 938780149 /nfs/dbraw/zinc/78/01/49/938780149.db2.gz XMGDJLLESGBBTL-CVEARBPZSA-N 0 3 421.932 4.283 20 0 HIADHN Cc1ccc([C@@H](C)NCc2ccccc2CS(=O)(=O)N2CCC(C)CC2)s1 ZINC000539054008 938784530 /nfs/dbraw/zinc/78/45/30/938784530.db2.gz KHSXMNNOGUZBEU-GOSISDBHSA-N 0 3 406.617 4.469 20 0 HIADHN FC(F)(F)c1cc(Cl)c2nnc(CNC3CCC4(CCOCC4)CC3)n2c1 ZINC000539066857 938790638 /nfs/dbraw/zinc/79/06/38/938790638.db2.gz LIRDYNWGYFLKLD-UHFFFAOYSA-N 0 3 402.848 4.231 20 0 HIADHN C[C@H](NCc1cccc(NS(C)(=O)=O)c1)c1ccc(SCC(F)F)cc1 ZINC000539075816 938795338 /nfs/dbraw/zinc/79/53/38/938795338.db2.gz LPUWFOTXUVRCQN-ZDUSSCGKSA-N 0 3 400.516 4.266 20 0 HIADHN COCC[C@H](NCc1cc(Br)c(OC)c(OC)c1)c1ccc(F)cc1 ZINC000539078170 938796573 /nfs/dbraw/zinc/79/65/73/938796573.db2.gz DQEUABNKRGCDEC-KRWDZBQOSA-N 0 3 412.299 4.473 20 0 HIADHN COc1ccc([C@@H](C)NCCc2nc(-c3ccc(Cl)cc3)no2)cc1NC(C)=O ZINC000539080510 938797521 /nfs/dbraw/zinc/79/75/21/938797521.db2.gz ULPBJLNLPXTXOX-CYBMUJFWSA-N 0 3 414.893 4.250 20 0 HIADHN C[C@H](N[C@@H](C)c1ccccc1C(F)(F)F)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000539086409 938799488 /nfs/dbraw/zinc/79/94/88/938799488.db2.gz LKMRVQVBXWHQDJ-KBPBESRZSA-N 0 3 400.466 4.368 20 0 HIADHN Cc1cc(N2CC[C@H](N[C@H](C)c3ccc(OCc4ccccc4C)cc3)C2=O)n(C)n1 ZINC000539088546 938800049 /nfs/dbraw/zinc/80/00/49/938800049.db2.gz VDOSXZIFZBIRHL-XXBNENTESA-N 0 3 418.541 4.072 20 0 HIADHN C[C@H](NCCCN1C(=O)COc2ccccc21)c1ccc(F)cc1Br ZINC000539088103 938800251 /nfs/dbraw/zinc/80/02/51/938800251.db2.gz YOKRDYQAHAQVOP-ZDUSSCGKSA-N 0 3 407.283 4.055 20 0 HIADHN C[C@@H](N[C@@H](C)c1cccc(-c2ccncc2)c1)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000539090769 938800804 /nfs/dbraw/zinc/80/08/04/938800804.db2.gz BUPDDAVWHNHTTI-MSOLQXFVSA-N 0 3 409.555 4.411 20 0 HIADHN CCc1nc2c(s1)[C@@H](NCc1ccc(C(=O)N3C[C@@H](C)O[C@@H](C)C3)cc1)CCC2 ZINC000539091678 938801388 /nfs/dbraw/zinc/80/13/88/938801388.db2.gz JNAYLXLIJVKXAL-FCEWJHQRSA-N 0 3 413.587 4.122 20 0 HIADHN C[C@@H]1CC[C@H](NCc2ccccc2OCC(=O)NC[C@@H]2CCCO2)c2ccccc21 ZINC000539091761 938801414 /nfs/dbraw/zinc/80/14/14/938801414.db2.gz WHSJMAIGKCQACS-RFWXGWTQSA-N 0 3 408.542 4.089 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)Nc1ccc(F)cc1OCC(F)F ZINC000539097794 938802420 /nfs/dbraw/zinc/80/24/20/938802420.db2.gz ZCGAXZQFYXMWLH-UHFFFAOYSA-N 0 3 421.463 4.011 20 0 HIADHN CS(=O)(=O)Cc1ccccc1CN[C@H]1CCCc2ccc(Br)cc21 ZINC000539121452 938805969 /nfs/dbraw/zinc/80/59/69/938805969.db2.gz UPZSZKFFEUGPHY-IBGZPJMESA-N 0 3 408.361 4.161 20 0 HIADHN Brc1ccc(-c2nnc(C[NH2+][C@@H]3CSCCc4ccccc43)[n-]2)cc1 ZINC000539121756 938806009 /nfs/dbraw/zinc/80/60/09/938806009.db2.gz PSUSYDIRCMBGRP-QGZVFWFLSA-N 0 3 415.360 4.354 20 0 HIADHN CCCN1C(=O)CCc2cc(NC(=O)N(CCN(C)C)Cc3cccs3)ccc21 ZINC000539132404 938808465 /nfs/dbraw/zinc/80/84/65/938808465.db2.gz UDYAXFSDTPAKJB-UHFFFAOYSA-N 0 3 414.575 4.033 20 0 HIADHN C[C@H]1CN(c2ccc(CN[C@@H](c3ccc(Br)cc3)C3CC3)cn2)CCO1 ZINC000539159397 938814012 /nfs/dbraw/zinc/81/40/12/938814012.db2.gz PGBOCWSJLHDKCA-YCRPNKLZSA-N 0 3 416.363 4.310 20 0 HIADHN O=C([C@H](Cc1ccccc1)N[C@H]1CCc2c1cccc2Br)N1CCCC1 ZINC000539204420 938819160 /nfs/dbraw/zinc/81/91/60/938819160.db2.gz RQHXHOLMOPMAEO-SFTDATJTSA-N 0 3 413.359 4.260 20 0 HIADHN CCc1cnccc1[C@@H](C)N[C@@H](C)c1ccc(S(=O)(=O)NCc2ccco2)cc1 ZINC000539214364 938819605 /nfs/dbraw/zinc/81/96/05/938819605.db2.gz IUEHBKQESUUHJG-DLBZAZTESA-N 0 3 413.543 4.127 20 0 HIADHN COc1cc(CN[C@@H](c2ccccc2F)C2CCCC2)ccc1OCC(=O)N(C)C ZINC000539214543 938819898 /nfs/dbraw/zinc/81/98/98/938819898.db2.gz OYCBPZWTUIXPHD-XMMPIXPASA-N 0 3 414.521 4.322 20 0 HIADHN CC[C@H]1c2ccsc2CCN1C(=O)CN[C@@H](c1ccc2c(c1)OCCO2)C(C)C ZINC000539241015 938824044 /nfs/dbraw/zinc/82/40/44/938824044.db2.gz MZVVDVOKUJGIRI-FDDCHVKYSA-N 0 3 414.571 4.342 20 0 HIADHN CC[C@H]1c2ccsc2CCN1C(=O)CN[C@H](c1ccc2c(c1)OCCO2)C(C)C ZINC000539241017 938824205 /nfs/dbraw/zinc/82/42/05/938824205.db2.gz MZVVDVOKUJGIRI-MBSDFSHPSA-N 0 3 414.571 4.342 20 0 HIADHN CC[C@H](NCCOC1CCCCCC1)c1ccccc1OCC(=O)N1CCCC1 ZINC000539254937 938827328 /nfs/dbraw/zinc/82/73/28/938827328.db2.gz DHTIHOYOZIFSGQ-QFIPXVFZSA-N 0 3 402.579 4.468 20 0 HIADHN C[C@H](NCC(=O)N(Cc1ccco1)c1ccccc1)c1ccccc1-n1cccn1 ZINC000539260086 938828845 /nfs/dbraw/zinc/82/88/45/938828845.db2.gz JPWYICVYRZFJFQ-IBGZPJMESA-N 0 3 400.482 4.349 20 0 HIADHN COc1ccc(C[C@H](NCC(=O)Nc2cccc(F)c2)c2ccccc2)cc1OC ZINC000539261535 938829187 /nfs/dbraw/zinc/82/91/87/938829187.db2.gz SISSDFXOJDEWQV-NRFANRHFSA-N 0 3 408.473 4.355 20 0 HIADHN Cc1cccc(C(C)(C)NCC(=O)Nc2ccccc2I)c1 ZINC000539287966 938833937 /nfs/dbraw/zinc/83/39/37/938833937.db2.gz ZVEJBZKOIRMJFQ-UHFFFAOYSA-N 0 3 408.283 4.063 20 0 HIADHN COc1ccc(-c2csc(NC(=O)CN[C@H](c3ccccc3)[C@@H]3CCOC3)n2)cc1 ZINC000539289389 938834280 /nfs/dbraw/zinc/83/42/80/938834280.db2.gz MWUYXUUTPZGUJU-XMSQKQJNSA-N 0 3 423.538 4.125 20 0 HIADHN O=S(=O)(c1ccc(CN[C@H]2CCCc3cc(F)ccc32)cc1)N1CCCCC1 ZINC000539311199 938838972 /nfs/dbraw/zinc/83/89/72/938838972.db2.gz FZWYJBMEZARWBK-QFIPXVFZSA-N 0 3 402.535 4.168 20 0 HIADHN CC(=O)Nc1cccc(NC(=O)[C@H](C)N[C@H](C)c2ccc(-c3cccnc3)cc2)c1 ZINC000539327492 938842364 /nfs/dbraw/zinc/84/23/64/938842364.db2.gz YXVIXKIHVGNSDP-SJORKVTESA-N 0 3 402.498 4.385 20 0 HIADHN CC(C)[C@@H](NCC(=O)Nc1cccc(C(=O)N(C)C)c1)c1ccc(C(F)(F)F)cc1 ZINC000539328664 938842597 /nfs/dbraw/zinc/84/25/97/938842597.db2.gz WATCZHNDLHRWMJ-HXUWFJFHSA-N 0 3 421.463 4.333 20 0 HIADHN CC(C)[C@H](NCC(=O)Nc1cccc(C(=O)N(C)C)c1)c1ccc(C(F)(F)F)cc1 ZINC000539328663 938842612 /nfs/dbraw/zinc/84/26/12/938842612.db2.gz WATCZHNDLHRWMJ-FQEVSTJZSA-N 0 3 421.463 4.333 20 0 HIADHN COc1cccc(CN(C)C(=O)CN[C@@H](c2cccc(F)c2)C(C)(C)C)c1OC ZINC000539329154 938842652 /nfs/dbraw/zinc/84/26/52/938842652.db2.gz DMENPEFYADTTMA-QFIPXVFZSA-N 0 3 402.510 4.178 20 0 HIADHN O=C(CN[C@H](C[C@@H]1CCOC1)c1ccccc1)N[C@H](c1nccs1)c1ccccc1 ZINC000539335362 938843717 /nfs/dbraw/zinc/84/37/17/938843717.db2.gz AZRMPEBXZQWWOK-ZEYPLWLESA-N 0 3 421.566 4.106 20 0 HIADHN CCN(CC)[C@H](CNC(=O)CCc1cncc(F)c1)c1ccc(C(F)(F)F)cc1 ZINC000539335521 938843725 /nfs/dbraw/zinc/84/37/25/938843725.db2.gz NMZKNKOSMVKIIO-LJQANCHMSA-N 0 3 411.443 4.371 20 0 HIADHN COc1ccc(NC(=O)[C@@H](C)N[C@H](C)c2ccc(-c3ccncc3)cc2)c(OC)c1 ZINC000539338429 938844591 /nfs/dbraw/zinc/84/45/91/938844591.db2.gz QKGPSFMVVYTJAK-IAGOWNOFSA-N 0 3 405.498 4.444 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)NCC(=O)Nc2ccccc2Br)cc1 ZINC000539363517 938849101 /nfs/dbraw/zinc/84/91/01/938849101.db2.gz NOVRNOWKYSTIRE-CQSZACIVSA-N 0 3 413.319 4.233 20 0 HIADHN Cc1cc([C@H](NCC(=O)NCCc2ccc(OC(F)F)cc2)C2CC2)ccc1F ZINC000539423421 938858462 /nfs/dbraw/zinc/85/84/62/938858462.db2.gz MLVPYMXDNKLGKJ-OAQYLSRUSA-N 0 3 406.448 4.135 20 0 HIADHN Cc1ccc(-c2ccc(CNCc3ccc(C(=O)N4CCOCC4)cc3)s2)cc1 ZINC000539469653 938865171 /nfs/dbraw/zinc/86/51/71/938865171.db2.gz UCTHTEOREBXXFG-UHFFFAOYSA-N 0 3 406.551 4.486 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)c2cccc(NC(=O)c3cccs3)c2)cc1 ZINC000563556769 945214313 /nfs/dbraw/zinc/21/43/13/945214313.db2.gz IIIIGUOMLUVTBA-HXUWFJFHSA-N 0 3 423.538 4.042 20 0 HIADHN CCN1CCN(Cc2ccc(N[C@H](Cc3ccccn3)c3cccnc3)cc2)CC1 ZINC000539596260 938885491 /nfs/dbraw/zinc/88/54/91/938885491.db2.gz VVBDIGFUHXOWJQ-RUZDIDTESA-N 0 3 401.558 4.010 20 0 HIADHN Cc1ccc([C@H](N[C@@H]2CCO[C@H](C(C)C)C2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000539611935 938887893 /nfs/dbraw/zinc/88/78/93/938887893.db2.gz MNYLKMSESCGYSM-PUHATCMVSA-N 0 3 401.572 4.281 20 0 HIADHN O=S(=O)(CCCNCc1c[nH]nc1-c1ccc(Cl)cc1)c1ccc(Cl)cc1 ZINC000563552815 945212990 /nfs/dbraw/zinc/21/29/90/945212990.db2.gz YSNKIRRYGRWMDC-UHFFFAOYSA-N 0 3 424.353 4.337 20 0 HIADHN CCN1CCN(Cc2ccc(N[C@@H](C)c3cnn(Cc4ccccc4)c3)cc2)CC1 ZINC000539636006 938891709 /nfs/dbraw/zinc/89/17/09/938891709.db2.gz PVZFCSUTVLVEPF-NRFANRHFSA-N 0 3 403.574 4.242 20 0 HIADHN Brc1cc2c(cc1CNCCc1nc(-c3ccccn3)cs1)OCO2 ZINC000539710050 938908631 /nfs/dbraw/zinc/90/86/31/938908631.db2.gz FBFJOQLGTQVFFA-UHFFFAOYSA-N 0 3 418.316 4.029 20 0 HIADHN COc1ccc([C@H](C)Nc2cnn(Cc3ccncc3)c2)cc1CN1CCCCC1 ZINC000539714943 938910001 /nfs/dbraw/zinc/91/00/01/938910001.db2.gz UZMRGCXYJCMPSP-IBGZPJMESA-N 0 3 405.546 4.494 20 0 HIADHN C[C@H](c1nc(-c2cccnc2)no1)N1CCC[C@@H](c2nc(C3CCCCC3)n[nH]2)C1 ZINC000539764269 938928777 /nfs/dbraw/zinc/92/87/77/938928777.db2.gz BMEMLFDMYHPQPN-CRAIPNDOSA-N 0 3 407.522 4.238 20 0 HIADHN C[C@H](c1nc(-c2cccnc2)no1)N1CCC[C@@H](c2n[nH]c(C3CCCCC3)n2)C1 ZINC000539764269 938928785 /nfs/dbraw/zinc/92/87/85/938928785.db2.gz BMEMLFDMYHPQPN-CRAIPNDOSA-N 0 3 407.522 4.238 20 0 HIADHN C[C@H](c1nc(-c2cccnc2)no1)N1CCC[C@H](c2nc(C3CCCCC3)n[nH]2)C1 ZINC000539764271 938929286 /nfs/dbraw/zinc/92/92/86/938929286.db2.gz BMEMLFDMYHPQPN-QAPCUYQASA-N 0 3 407.522 4.238 20 0 HIADHN C[C@H](c1nc(-c2cccnc2)no1)N1CCC[C@H](c2n[nH]c(C3CCCCC3)n2)C1 ZINC000539764271 938929291 /nfs/dbraw/zinc/92/92/91/938929291.db2.gz BMEMLFDMYHPQPN-QAPCUYQASA-N 0 3 407.522 4.238 20 0 HIADHN CS(=O)(=O)[C@@H]1CCC[C@H](N[C@@H](c2ccccc2)c2ccc(OC(F)F)cc2)C1 ZINC000539813196 938940743 /nfs/dbraw/zinc/94/07/43/938940743.db2.gz SWJUARCZEPFQEK-SXLOBPIMSA-N 0 3 409.498 4.323 20 0 HIADHN CCO[C@H]1C[C@@H](O)C12CCN(Cc1ccc(OCc3cccs3)c(OC)c1)CC2 ZINC000539819822 938943315 /nfs/dbraw/zinc/94/33/15/938943315.db2.gz VSKYCOFRYMTCNP-YADHBBJMSA-N 0 3 417.571 4.088 20 0 HIADHN CC(=O)N1C[C@@H]2CCC[C@H](N[C@H](C)c3nc(-c4cccc(C(F)(F)F)c4)no3)[C@@H]2C1 ZINC000563566200 945217828 /nfs/dbraw/zinc/21/78/28/945217828.db2.gz SRWJVFKBCQXRQM-XGWTYTTDSA-N 0 3 422.451 4.053 20 0 HIADHN CCOc1cc(CN2CCS[C@H](C(C)C)C2)ccc1OCC(=O)N1CCCCC1 ZINC000539828349 938948969 /nfs/dbraw/zinc/94/89/69/938948969.db2.gz DWSFCUPHYOCHCU-QFIPXVFZSA-N 0 3 420.619 4.050 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2CN2CCC[C@@H](N3CCCC3=O)C2)cc1 ZINC000539833690 938952535 /nfs/dbraw/zinc/95/25/35/938952535.db2.gz JFBPLNHDKWWAJG-XMMPIXPASA-N 0 3 414.553 4.435 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(-c2ccc(F)cc2)cc1)C(=O)Nc1ccc(C(N)=O)cc1 ZINC000539853722 938958715 /nfs/dbraw/zinc/95/87/15/938958715.db2.gz KUAGFTGUMBAGSZ-JKSUJKDBSA-N 0 3 405.473 4.269 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(-c2ccc(F)cc2)cc1)C(=O)Nc1ccc(C(N)=O)cc1 ZINC000539853717 938958783 /nfs/dbraw/zinc/95/87/83/938958783.db2.gz KUAGFTGUMBAGSZ-HOTGVXAUSA-N 0 3 405.473 4.269 20 0 HIADHN CN1CCN(c2ncc(CN[C@@H](c3cccc(C(F)(F)F)c3)C(C)(C)C)cn2)CC1 ZINC000539858186 938959137 /nfs/dbraw/zinc/95/91/37/938959137.db2.gz CKXGRWHGNHWFRX-IBGZPJMESA-N 0 3 421.511 4.124 20 0 HIADHN COc1cc(NC(=O)CCN2[C@H](C)c3ccc(F)cc3C[C@@H]2C)cc(OC)c1OC ZINC000539887805 938966262 /nfs/dbraw/zinc/96/62/62/938966262.db2.gz YBGPMDPSAVIOLV-LSDHHAIUSA-N 0 3 416.493 4.188 20 0 HIADHN Brc1cccc(-c2nc(CN[C@H]3CCO[C@@]4(CCOC4)C3)cs2)c1 ZINC000539976974 939028573 /nfs/dbraw/zinc/02/85/73/939028573.db2.gz JXFYQZUXKUYHIG-YJBOKZPZSA-N 0 3 409.349 4.000 20 0 HIADHN CC[N@H+](CCC1CCN(Cc2nc3c4ccccc4oc3c(=O)[n-]2)CC1)CC1CC1 ZINC000540050814 939050660 /nfs/dbraw/zinc/05/06/60/939050660.db2.gz ZFPNOJZMIAXTQK-UHFFFAOYSA-N 0 3 408.546 4.416 20 0 HIADHN CC[N@@H+](CCC1CCN(Cc2nc3c4ccccc4oc3c(=O)[n-]2)CC1)CC1CC1 ZINC000540050814 939050666 /nfs/dbraw/zinc/05/06/66/939050666.db2.gz ZFPNOJZMIAXTQK-UHFFFAOYSA-N 0 3 408.546 4.416 20 0 HIADHN Cc1sc(C2(NCCN3C[C@H]4CC[C@@H](C3)O4)CCC2)nc1-c1ccccc1F ZINC000563637713 945229008 /nfs/dbraw/zinc/22/90/08/945229008.db2.gz XYLREYFCJBQKNS-CALCHBBNSA-N 0 3 401.551 4.090 20 0 HIADHN COc1ccc2c(c1)CCC[C@H]2NCc1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000540119676 939079849 /nfs/dbraw/zinc/07/98/49/939079849.db2.gz NENDHYHHHYHTBO-HSZRJFAPSA-N 0 3 414.571 4.037 20 0 HIADHN COc1ccc([C@@H](C)NCc2ccccc2CS(=O)(=O)N2CCCC2)cc1Cl ZINC000540143299 939089618 /nfs/dbraw/zinc/08/96/18/939089618.db2.gz CIOVGSKQXATRDL-MRXNPFEDSA-N 0 3 422.978 4.125 20 0 HIADHN CC(C)Oc1ccc([C@H](C)N[C@H](C)c2cccc(N3CCCS3(=O)=O)c2)cc1 ZINC000540144018 939090024 /nfs/dbraw/zinc/09/00/24/939090024.db2.gz LHSCSKSNVWDMFS-ZWKOTPCHSA-N 0 3 402.560 4.426 20 0 HIADHN C[C@@H](NCCc1nnc(-c2ccccc2)o1)c1ccccc1I ZINC000540146141 939090444 /nfs/dbraw/zinc/09/04/44/939090444.db2.gz AMIABCDFPGMYQN-CYBMUJFWSA-N 0 3 419.266 4.235 20 0 HIADHN C[C@H](NC[C@H](C)S(C)(=O)=O)c1ccc(-c2ccccc2Br)s1 ZINC000540145802 939090963 /nfs/dbraw/zinc/09/09/63/939090963.db2.gz XSDZYXLDQUZLRS-RYUDHWBXSA-N 0 3 402.379 4.261 20 0 HIADHN C[C@H](NCc1ccc(COC2CCOCC2)cc1)c1cccc(N2CCCC2=O)c1 ZINC000540146525 939091633 /nfs/dbraw/zinc/09/16/33/939091633.db2.gz HHCZWLKWFGXQMQ-IBGZPJMESA-N 0 3 408.542 4.360 20 0 HIADHN CCOCCC1(CN[C@@H](C)c2nnn(-c3cccc(Br)c3)c2C)CC1 ZINC000540149085 939091921 /nfs/dbraw/zinc/09/19/21/939091921.db2.gz GDRBYEQETWMIPW-AWEZNQCLSA-N 0 3 407.356 4.196 20 0 HIADHN Fc1ccc(Br)c2c1CC[C@@H]2NCCc1nnc(-c2ccccc2)o1 ZINC000540151971 939092964 /nfs/dbraw/zinc/09/29/64/939092964.db2.gz VBRWUDPOKHESJM-INIZCTEOSA-N 0 3 402.267 4.458 20 0 HIADHN Cc1c([C@@H](C)N[C@@H]2CCOC3(CCC3)C2)nnn1-c1cccc(Br)c1 ZINC000540158532 939094777 /nfs/dbraw/zinc/09/47/77/939094777.db2.gz ZDJYVGXALMKEMU-CZUORRHYSA-N 0 3 405.340 4.091 20 0 HIADHN Cc1c([C@H](C)N[C@@H]2CCOC3(CCC3)C2)nnn1-c1cccc(Br)c1 ZINC000540158533 939095071 /nfs/dbraw/zinc/09/50/71/939095071.db2.gz ZDJYVGXALMKEMU-XJKSGUPXSA-N 0 3 405.340 4.091 20 0 HIADHN Cc1nc(-c2cccnc2)sc1[C@H](C)NCc1cccc(CN2CCCC2=O)c1 ZINC000540167029 939099851 /nfs/dbraw/zinc/09/98/51/939099851.db2.gz XZMTZCJNMAAFGD-INIZCTEOSA-N 0 3 406.555 4.487 20 0 HIADHN Cc1cccc(COc2ccc([C@H](C)N[C@@H]3CCN(CC(F)(F)F)C3=O)cc2)c1 ZINC000540173213 939102783 /nfs/dbraw/zinc/10/27/83/939102783.db2.gz AQKDNLLLBFYUMQ-OXJNMPFZSA-N 0 3 406.448 4.388 20 0 HIADHN Cn1c2cccc(F)c2nc1CCN[C@H]1CCc2c1c(Br)ccc2F ZINC000540181393 939108697 /nfs/dbraw/zinc/10/86/97/939108697.db2.gz FORMOVYEXSNEOV-HNNXBMFYSA-N 0 3 406.274 4.434 20 0 HIADHN Cc1cccc(COc2ccc([C@@H](C)N[C@H]3CCCN(c4ccn(C)n4)C3=O)cc2)c1 ZINC000540181410 939108727 /nfs/dbraw/zinc/10/87/27/939108727.db2.gz GGNYELKVXBYTEA-XXBNENTESA-N 0 3 418.541 4.154 20 0 HIADHN Cc1ccc([C@H](N[C@H]2C[C@H](C)N(C3CC3)C2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000540185734 939110321 /nfs/dbraw/zinc/11/03/21/939110321.db2.gz ZCESTBSPGAEPGB-VAXXYWNWSA-N 0 3 412.599 4.011 20 0 HIADHN COc1cccc([C@@H](NC2CCN(c3cnccn3)CC2)c2ccccc2Cl)c1 ZINC000540188519 939112755 /nfs/dbraw/zinc/11/27/55/939112755.db2.gz LPVKSUXIRLXAJM-HSZRJFAPSA-N 0 3 408.933 4.487 20 0 HIADHN C[C@@H]1CN(C(=O)c2ccc(CN[C@@H]3c4cccc(F)c4CC[C@@H]3C)cc2)C[C@H](C)O1 ZINC000540190275 939114946 /nfs/dbraw/zinc/11/49/46/939114946.db2.gz FQSCUZUEVOHNGC-KKFFFLSNSA-N 0 3 410.533 4.488 20 0 HIADHN COc1ccc([C@@H](C)N[C@@H](C)c2ccc(-n3cncn3)cc2)cc1Br ZINC000540191218 939116179 /nfs/dbraw/zinc/11/61/79/939116179.db2.gz MYGJZCIZICMCQB-UONOGXRCSA-N 0 3 401.308 4.450 20 0 HIADHN Cc1ccc2c(c1)[C@H](NCc1ccc(C(=O)N3C[C@@H](C)O[C@H](C)C3)cc1)CCCO2 ZINC000540192090 939116856 /nfs/dbraw/zinc/11/68/56/939116856.db2.gz ZXAJHXLKNNLEOH-DNVFCKCGSA-N 0 3 408.542 4.248 20 0 HIADHN Cc1ccc2c(c1)[C@@H](NCc1ccc(C(=O)N3C[C@@H](C)O[C@@H](C)C3)cc1)CCCO2 ZINC000540192093 939117018 /nfs/dbraw/zinc/11/70/18/939117018.db2.gz ZXAJHXLKNNLEOH-YYDVJCTNSA-N 0 3 408.542 4.248 20 0 HIADHN CC(C)C(=O)Nc1ccc(CN[C@@H](C)c2ccc(OCc3nccn3C)cc2)cc1 ZINC000540192168 939117548 /nfs/dbraw/zinc/11/75/48/939117548.db2.gz BJCNDPRHZLOIHI-SFHVURJKSA-N 0 3 406.530 4.444 20 0 HIADHN CNS(=O)(=O)c1ccc([C@H](C)N[C@@H](C)c2ccc(OCC(C)C)c(OC)c2)cc1 ZINC000540192474 939117565 /nfs/dbraw/zinc/11/75/65/939117565.db2.gz HTCSZHKGOJMBDP-IRXDYDNUSA-N 0 3 420.575 4.050 20 0 HIADHN CC(C)c1nn(-c2ccc(Br)cc2)cc1CN[C@H](C)Cn1cccn1 ZINC000540216416 939132940 /nfs/dbraw/zinc/13/29/40/939132940.db2.gz MRRLMUMXADJQON-OAHLLOKOSA-N 0 3 402.340 4.133 20 0 HIADHN Cc1nc(-c2ccc(Br)cc2)sc1[C@@H](C)N[C@H]1CC(=O)N(C2CC2)C1 ZINC000540219639 939134156 /nfs/dbraw/zinc/13/41/56/939134156.db2.gz JOCZEYWYJWDFAZ-ABAIWWIYSA-N 0 3 420.376 4.295 20 0 HIADHN C[C@@H](N[C@H]1CCCc2nc(-c3ccc(Br)cc3)sc21)C(=O)N(C)C ZINC000540223305 939139771 /nfs/dbraw/zinc/13/97/71/939139771.db2.gz CINCMZFRLNBRFO-RISCZKNCSA-N 0 3 408.365 4.016 20 0 HIADHN Cc1n[nH]c(C)c1[C@@H]1CCCN1C(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1 ZINC000540293279 939184969 /nfs/dbraw/zinc/18/49/69/939184969.db2.gz TXEMAIVWDIEEJD-OALUTQOASA-N 0 3 415.607 4.408 20 0 HIADHN CCN1CC[C@H](N[C@H]2CC(=O)N(C)c3ccccc32)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000540297423 939185658 /nfs/dbraw/zinc/18/56/58/939185658.db2.gz LCUAOCQPGXGGGG-IPJJNNNSSA-N 0 3 401.913 4.312 20 0 HIADHN CCN1CC[C@H](N[C@@H]2CC(=O)N(C)c3ccccc32)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000540297424 939185745 /nfs/dbraw/zinc/18/57/45/939185745.db2.gz LCUAOCQPGXGGGG-JQVVWYNYSA-N 0 3 401.913 4.312 20 0 HIADHN CC[C@@H](NCC(=O)N(CC)Cc1ccc(OC)c(OC)c1)c1ccc(Cl)cc1 ZINC000540330143 939197066 /nfs/dbraw/zinc/19/70/66/939197066.db2.gz DRJZQLYIXFZQEY-LJQANCHMSA-N 0 3 404.938 4.447 20 0 HIADHN COc1ccc(C)cc1NC(=O)[C@@H](NCCCc1c(C)nn(C)c1C)c1ccccc1 ZINC000540341250 939200214 /nfs/dbraw/zinc/20/02/14/939200214.db2.gz ZGUQLWZINDKXNO-DEOSSOPVSA-N 0 3 420.557 4.256 20 0 HIADHN C[C@@H](NCC(=O)N1CCC(C(=O)N2CCCCCC2)CC1)c1cccc2ccccc21 ZINC000540342286 939200818 /nfs/dbraw/zinc/20/08/18/939200818.db2.gz IKKLGEXAUGPSLJ-HXUWFJFHSA-N 0 3 421.585 4.132 20 0 HIADHN CC(C)c1ccc([C@H](NCC(=O)N2CCC(C(=O)N(C)C(C)C)CC2)C(C)C)cc1 ZINC000540344030 939201463 /nfs/dbraw/zinc/20/14/63/939201463.db2.gz WXFFTSGNOVZPHK-XMMPIXPASA-N 0 3 415.622 4.202 20 0 HIADHN C[C@@H](N[C@H](C)c1cccc(OCc2ccccn2)c1)C(=O)N1CCc2ccccc2C1 ZINC000540353641 939205173 /nfs/dbraw/zinc/20/51/73/939205173.db2.gz ZECWUDOAPCDIJT-WOJBJXKFSA-N 0 3 415.537 4.285 20 0 HIADHN COc1cc2c(cc1OC)CN(C(=O)CN[C@H](CC(C)C)c1ccccc1C)CC2 ZINC000540359407 939208490 /nfs/dbraw/zinc/20/84/90/939208490.db2.gz BEVUMQQHAUYCRE-JOCHJYFZSA-N 0 3 410.558 4.274 20 0 HIADHN Cc1ccc(NC(=O)CN[C@H](C)c2ccccc2-n2cccn2)c(Br)c1 ZINC000540360651 939209552 /nfs/dbraw/zinc/20/95/52/939209552.db2.gz TZJXZEOXLBVBHB-OAHLLOKOSA-N 0 3 413.319 4.233 20 0 HIADHN C[C@H](NCC(=O)N1CC[C@@H](C)Sc2ccccc21)c1ccccc1-n1cccn1 ZINC000540361250 939209731 /nfs/dbraw/zinc/20/97/31/939209731.db2.gz UVBAOTTVTVUZAT-MSOLQXFVSA-N 0 3 406.555 4.440 20 0 HIADHN CS(=O)(=O)c1ccc(OCCCN[C@@H](CC(F)(F)F)c2ccc(F)cc2)cc1 ZINC000540380548 939220432 /nfs/dbraw/zinc/22/04/32/939220432.db2.gz VBIILXNDKUSNRK-SFHVURJKSA-N 0 3 419.440 4.281 20 0 HIADHN CCC(CC)[C@H](NCC(=O)Nc1cc(S(C)(=O)=O)ccc1Cl)c1ccccc1 ZINC000540381802 939221252 /nfs/dbraw/zinc/22/12/52/939221252.db2.gz XAQHFSPVUOWACQ-NRFANRHFSA-N 0 3 422.978 4.449 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)Nc1ccc(OC(F)(F)F)cc1)c1cccc(-n2cccn2)c1 ZINC000540387119 939222905 /nfs/dbraw/zinc/22/29/05/939222905.db2.gz NENACVLMMILLMT-CABCVRRESA-N 0 3 418.419 4.449 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(NC(=O)c2ccncc2)cc1)C(=O)N(C)C1CCCCC1 ZINC000540388914 939225562 /nfs/dbraw/zinc/22/55/62/939225562.db2.gz ZQLGINAOGRETBW-ZWKOTPCHSA-N 0 3 408.546 4.164 20 0 HIADHN Cc1ccccc1-n1nccc1NC(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000540410157 939238705 /nfs/dbraw/zinc/23/87/05/939238705.db2.gz TUBWGSRYJMINRN-UHFFFAOYSA-N 0 3 403.530 4.309 20 0 HIADHN Cc1cccc(OCCNC(=O)[C@@H](C)N[C@@H](C)c2ccc(-c3cccnc3)cc2)c1 ZINC000540433195 939246621 /nfs/dbraw/zinc/24/66/21/939246621.db2.gz PRZWFSLODKEGAS-VQTJNVASSA-N 0 3 403.526 4.291 20 0 HIADHN O=C(CN[C@H](C[C@H]1CCOC1)c1ccccc1)N(Cc1ccccc1)CC(F)(F)F ZINC000540434789 939247456 /nfs/dbraw/zinc/24/74/56/939247456.db2.gz ULPSVNUQPHKWAL-TZIWHRDSSA-N 0 3 420.475 4.335 20 0 HIADHN COc1cc2c(cc1OC)CN(C(=O)CN[C@H](c1ccccc1C)C(C)(C)C)CC2 ZINC000540457453 939258809 /nfs/dbraw/zinc/25/88/09/939258809.db2.gz ABRZYKUDEIJBNX-XMMPIXPASA-N 0 3 410.558 4.274 20 0 HIADHN Cc1cc(C)c(NC(=O)CNC(=O)CN[C@H](c2ccccc2C)C(C)(C)C)c(C)c1 ZINC000540459065 939260171 /nfs/dbraw/zinc/26/01/71/939260171.db2.gz VLWAVZXMHUFJNS-XMMPIXPASA-N 0 3 409.574 4.352 20 0 HIADHN COc1ccccc1NC(=O)C1CCN(Cc2cn(C)nc2-c2cccs2)CC1 ZINC000540506453 939280512 /nfs/dbraw/zinc/28/05/12/939280512.db2.gz IGRNVBDBLPTMJY-UHFFFAOYSA-N 0 3 410.543 4.008 20 0 HIADHN CC[C@H](NCc1nc2cc(S(=O)(=O)CC)ccc2o1)C(C)(C)c1ccccc1 ZINC000540521029 939285914 /nfs/dbraw/zinc/28/59/14/939285914.db2.gz KLHNZROTYLENIQ-FQEVSTJZSA-N 0 3 400.544 4.467 20 0 HIADHN CSc1ccc(C)c(NC(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)c1 ZINC000540520718 939286079 /nfs/dbraw/zinc/28/60/79/939286079.db2.gz QIDRVUYCCIUWMC-HDICACEKSA-N 0 3 405.608 4.460 20 0 HIADHN COc1cc(OC)c(NC(=O)CN[C@@H](c2ccc(F)c(C)c2)C2CC2)cc1Cl ZINC000540523312 939287897 /nfs/dbraw/zinc/28/78/97/939287897.db2.gz NWBRUFHICAVWQJ-OAQYLSRUSA-N 0 3 406.885 4.484 20 0 HIADHN CN(CC(F)(F)F)C(=O)CN[C@@H](c1ccc(Cl)c(C(F)(F)F)c1)C1CC1 ZINC000540524343 939288353 /nfs/dbraw/zinc/28/83/53/939288353.db2.gz DVERICKYXJWVER-CQSZACIVSA-N 0 3 402.766 4.420 20 0 HIADHN C[C@H](NC(=O)CN[C@@H](c1ccc2c(c1)OCCO2)C1CC1)c1ccccc1Cl ZINC000540589840 939312727 /nfs/dbraw/zinc/31/27/27/939312727.db2.gz BDXZCBJMWAHDOQ-RCDICMHDSA-N 0 3 400.906 4.029 20 0 HIADHN CC[C@@H](N[C@@H]1CCCN(CC(F)(F)F)C1=O)c1cc(F)cc(Br)c1 ZINC000540605991 939317672 /nfs/dbraw/zinc/31/76/72/939317672.db2.gz JGZRCNWFOVPPSN-ZIAGYGMSSA-N 0 3 411.237 4.182 20 0 HIADHN CC(C)c1cccc(-c2ccc(C(=O)N3CC[C@@H](N4CCN(C(C)C)CC4)C3)o2)c1 ZINC000540662577 939333889 /nfs/dbraw/zinc/33/38/89/939333889.db2.gz NBAJSXUOTLITKX-JOCHJYFZSA-N 0 3 409.574 4.311 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)N[C@H]1C[C@@H]2CCC(C)(C)c3cccc1c32 ZINC000540665549 939334569 /nfs/dbraw/zinc/33/45/69/939334569.db2.gz OWLPUNAFVCBDED-AVRDEDQJSA-N 0 3 406.574 4.455 20 0 HIADHN COc1ccc(-c2nc3c(s2)[C@@H](N[C@@H](C)C(=O)NCc2ccccc2)CCC3)cc1 ZINC000540727924 939350436 /nfs/dbraw/zinc/35/04/36/939350436.db2.gz SXXXJJWIXIHFAH-JXFKEZNVSA-N 0 3 421.566 4.491 20 0 HIADHN CSc1ccccc1CC(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000540766222 939364846 /nfs/dbraw/zinc/36/48/46/939364846.db2.gz ZMLJTCJHPVDDSL-HXUWFJFHSA-N 0 3 406.555 4.233 20 0 HIADHN COc1cc([C@@H](C)Nc2cccc(CN3CCSCC3)c2)cc(OC)c1OC ZINC000540788001 939372282 /nfs/dbraw/zinc/37/22/82/939372282.db2.gz RILFYMQGMUGVLZ-MRXNPFEDSA-N 0 3 402.560 4.434 20 0 HIADHN Cc1cc(NC(=O)N(CCN(C)C)Cc2cccs2)nn1-c1ccccc1Cl ZINC000540829065 939386968 /nfs/dbraw/zinc/38/69/68/939386968.db2.gz AVIATIIYCYDYJI-UHFFFAOYSA-N 0 3 417.966 4.491 20 0 HIADHN CC(C)CNC(=O)c1cccc(CN2CCC[C@@H](c3nc(-c4ccccc4)n[nH]3)C2)c1 ZINC000540863635 939401529 /nfs/dbraw/zinc/40/15/29/939401529.db2.gz OQWWNESPPZLRGK-JOCHJYFZSA-N 0 3 417.557 4.237 20 0 HIADHN COc1cccc([C@H]2[C@H](Nc3cc(C)nc(-c4ccccn4)n3)CCN2C2CC2)c1 ZINC000540872467 939405915 /nfs/dbraw/zinc/40/59/15/939405915.db2.gz VMLUFSREDBWZIU-OFNKIYASSA-N 0 3 401.514 4.246 20 0 HIADHN Cc1cc(C(=O)NC2CCN(Cc3ccccc3)CC2)nn1-c1ccc(Cl)cc1 ZINC000540876567 939407035 /nfs/dbraw/zinc/40/70/35/939407035.db2.gz JQGFJIXAKSYIRJ-UHFFFAOYSA-N 0 3 408.933 4.229 20 0 HIADHN C[C@H](N[C@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O)c1ccc(-n2ccnn2)cc1 ZINC000540889785 939411460 /nfs/dbraw/zinc/41/14/60/939411460.db2.gz WQLZDFWEEUOZMM-DJJJIMSYSA-N 0 3 416.312 4.030 20 0 HIADHN Cc1ncc2c(n1)CC[C@H](N[C@@H](c1ccc3c(c1)OCCO3)c1ccccc1Cl)C2 ZINC000540916324 939417068 /nfs/dbraw/zinc/41/70/68/939417068.db2.gz STCBQTCTDDDIGJ-UUOWRZLLSA-N 0 3 421.928 4.446 20 0 HIADHN Cc1ccc(-n2c(SCCCN3CCN(C)CC3)nnc2-c2ccccc2)cc1C ZINC000540957352 939420756 /nfs/dbraw/zinc/42/07/56/939420756.db2.gz UQPXFFULORZMLW-UHFFFAOYSA-N 0 3 421.614 4.281 20 0 HIADHN CC(C)c1ccc(OC2CCN(CCC(=O)NCC(=O)c3ccccc3)CC2)cc1 ZINC000540965975 939421861 /nfs/dbraw/zinc/42/18/61/939421861.db2.gz SNLJDLBRBCHMBW-UHFFFAOYSA-N 0 3 408.542 4.042 20 0 HIADHN C[C@H](NC(=O)Nc1ccc(C(F)(F)F)cc1Br)C1=CCN(C)CC1 ZINC000540981492 939424952 /nfs/dbraw/zinc/42/49/52/939424952.db2.gz VNJYVUMAHMBBDG-JTQLQIEISA-N 0 3 406.246 4.240 20 0 HIADHN CC(=O)Nc1ccc([C@H](C)N[C@H]2CC(=O)N(C)[C@H]2c2ccc(Cl)c(F)c2)cc1 ZINC000540987095 939425123 /nfs/dbraw/zinc/42/51/23/939425123.db2.gz SFZLWIBVZNYZQQ-DRAMBROLSA-N 0 3 403.885 4.060 20 0 HIADHN OC[C@@H](NC[C@H](O)COc1c(Cl)cccc1Cl)c1ccc(C(F)(F)F)cc1 ZINC000541023983 939433470 /nfs/dbraw/zinc/43/34/70/939433470.db2.gz UEJHFRQTLDMAIM-XJKSGUPXSA-N 0 3 424.246 4.075 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)NCC(=O)N[C@H](c2ccc(F)cc2)C(C)C)cc1 ZINC000541027522 939435272 /nfs/dbraw/zinc/43/52/72/939435272.db2.gz BCNMJSFLXXNQGO-XDHUDOTRSA-N 0 3 408.521 4.484 20 0 HIADHN COc1ccc(COc2cccc(F)c2)cc1NC(=O)N(CCN(C)C)C(C)C ZINC000541044302 939440258 /nfs/dbraw/zinc/44/02/58/939440258.db2.gz XZZLEDIGUZJQDF-UHFFFAOYSA-N 0 3 403.498 4.217 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)Nc1cccc2c1OCO2 ZINC000541096867 939459254 /nfs/dbraw/zinc/45/92/54/939459254.db2.gz BJDRFSBPYHXTRF-UHFFFAOYSA-N 0 3 409.408 4.030 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2cc(-c3cnn(C)c3)ccc2F)N2CCCC2)cc1 ZINC000541171131 939484150 /nfs/dbraw/zinc/48/41/50/939484150.db2.gz YSZCURXIBDDSHP-QHCPKHFHSA-N 0 3 406.505 4.102 20 0 HIADHN CN(C)CCN(C(=O)Nc1ccn(-c2cccc(C(F)(F)F)c2)n1)C1CCCC1 ZINC000541180638 939484619 /nfs/dbraw/zinc/48/46/19/939484619.db2.gz CFKWOIJMGNOABS-UHFFFAOYSA-N 0 3 409.456 4.229 20 0 HIADHN CC[C@@H](N[C@@H]1CCCc2ccc(Br)cc21)c1cccc(S(N)(=O)=O)c1 ZINC000541202050 939485353 /nfs/dbraw/zinc/48/53/53/939485353.db2.gz ZTLGNIACRBFRTC-RTBURBONSA-N 0 3 423.376 4.215 20 0 HIADHN Cc1cc(F)ccc1-n1ccc(C(=O)NC[C@@H]2CCCN(C)[C@@H]2c2cccs2)n1 ZINC000541207061 939485603 /nfs/dbraw/zinc/48/56/03/939485603.db2.gz GZSAQNBVMIMXMT-KKSFZXQISA-N 0 3 412.534 4.194 20 0 HIADHN Brc1cccc2c1CCC[C@@H]2NCc1ccccc1N1CCOCC1 ZINC000541223988 939486434 /nfs/dbraw/zinc/48/64/34/939486434.db2.gz WPWKIWQXHVIHSC-FQEVSTJZSA-N 0 3 401.348 4.453 20 0 HIADHN CC(=O)NC1CCC(N(C)CC(=O)N2CCC[C@H]2c2ccc(C(C)(C)C)cc2)CC1 ZINC000541319114 939490714 /nfs/dbraw/zinc/49/07/14/939490714.db2.gz JNSCABLFMIKRTA-VNXZQDSDSA-N 0 3 413.606 4.027 20 0 HIADHN C[C@@H](N[C@@H](Cc1ccc(C(F)(F)F)cc1)C(N)=O)c1cccc(OC(F)F)c1 ZINC000541328267 939491023 /nfs/dbraw/zinc/49/10/23/939491023.db2.gz SDQNDQUZAQPXNF-BZNIZROVSA-N 0 3 402.363 4.054 20 0 HIADHN CN(CCCc1cc(-c2cccc(F)c2)n[nH]1)Cc1cncc(Br)c1 ZINC000541348023 939494267 /nfs/dbraw/zinc/49/42/67/939494267.db2.gz HWHHFTRCKMOWSL-UHFFFAOYSA-N 0 3 403.299 4.438 20 0 HIADHN COc1cc(Br)ccc1CCCN1CCC([C@@H](O)C(F)(F)F)CC1 ZINC000541352445 939495539 /nfs/dbraw/zinc/49/55/39/939495539.db2.gz ZGIOQJWEPAEKFI-MRXNPFEDSA-N 0 3 410.274 4.026 20 0 HIADHN CO[C@H](c1ccccc1F)[C@H](C)NCc1cnc2c(C)cc(Br)cn12 ZINC000541378044 939501018 /nfs/dbraw/zinc/50/10/18/939501018.db2.gz JAOTXOJRWWXUGG-UGSOOPFHSA-N 0 3 406.299 4.410 20 0 HIADHN CCN(C(=O)c1cnn(CCC(F)(F)F)c1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000541393711 939504418 /nfs/dbraw/zinc/50/44/18/939504418.db2.gz MCIPXIHWJWOFQT-VQIMIIECSA-N 0 3 408.468 4.133 20 0 HIADHN Cc1cc(-c2nc(C3CC3)no2)ccc1NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000541505658 939538777 /nfs/dbraw/zinc/53/87/77/939538777.db2.gz FUWBMMDGXCDBHQ-HXUWFJFHSA-N 0 3 417.513 4.318 20 0 HIADHN COc1ccc(CC(=O)N[C@@H](c2ccc(F)c(F)c2)C(C)(C)N2CCCC2)cc1 ZINC000541545755 939549927 /nfs/dbraw/zinc/54/99/27/939549927.db2.gz PGPIYOCNWBGPND-QFIPXVFZSA-N 0 3 402.485 4.248 20 0 HIADHN CCOc1cc(CN[C@H](CN2CCOCC2)c2ccccc2C)ccc1OC(F)F ZINC000541548316 939551538 /nfs/dbraw/zinc/55/15/38/939551538.db2.gz BIOHFZZJYPZSNQ-HXUWFJFHSA-N 0 3 420.500 4.158 20 0 HIADHN Cc1cc([C@H](NC[C@H](c2ccc(F)cc2)N2CCOCC2)c2cccnc2)ccc1F ZINC000541550329 939552265 /nfs/dbraw/zinc/55/22/65/939552265.db2.gz RRAOVTPGKAMBND-RPBOFIJWSA-N 0 3 423.507 4.421 20 0 HIADHN Cc1cc([C@@H](NC[C@H]2CC(=O)N(Cc3ccccc3)C2)c2cccnc2)ccc1F ZINC000541565205 939556669 /nfs/dbraw/zinc/55/66/69/939556669.db2.gz COSPKEOECPWBBP-CJFMBICVSA-N 0 3 403.501 4.257 20 0 HIADHN O=C(CN[C@@H](c1cccs1)C1CC1)NC1(c2ccc3c(c2)OCCO3)CCCC1 ZINC000541580010 939559664 /nfs/dbraw/zinc/55/96/64/939559664.db2.gz NGWJJRQJKRDLDF-JOCHJYFZSA-N 0 3 412.555 4.146 20 0 HIADHN Cc1ccsc1[C@H](Cc1ccccc1)NCc1cccc(S(=O)(=O)N(C)C)c1 ZINC000541597152 939563017 /nfs/dbraw/zinc/56/30/17/939563017.db2.gz NEKGYAURSPPBNW-NRFANRHFSA-N 0 3 414.596 4.380 20 0 HIADHN Cc1ccsc1[C@@H](Cc1ccccc1)NCc1cccc(S(=O)(=O)N(C)C)c1 ZINC000541597153 939563048 /nfs/dbraw/zinc/56/30/48/939563048.db2.gz NEKGYAURSPPBNW-OAQYLSRUSA-N 0 3 414.596 4.380 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N[C@@H]2CCO[C@H](c3ccc(F)cc3)C2)C1 ZINC000541619777 939572683 /nfs/dbraw/zinc/57/26/83/939572683.db2.gz WVIGHZSNVFMZLF-DZWOVHDNSA-N 0 3 411.521 4.181 20 0 HIADHN C[C@@H](NCC(=O)Nc1ccc(NC(=O)c2cccs2)cc1)[C@@H]1COc2ccccc21 ZINC000541694992 939606951 /nfs/dbraw/zinc/60/69/51/939606951.db2.gz GNVCHFMTOQESMS-BEFAXECRSA-N 0 3 421.522 4.093 20 0 HIADHN COc1cc2[nH]c(CCCN[C@@H](c3ccccc3)c3cncnc3)cc2c(OC)c1 ZINC000541734737 939616461 /nfs/dbraw/zinc/61/64/61/939616461.db2.gz RCMGURQBKQQBNW-DEOSSOPVSA-N 0 3 402.498 4.287 20 0 HIADHN CN(C(=O)Nc1csc(-c2ccccn2)n1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000541763729 939624232 /nfs/dbraw/zinc/62/42/32/939624232.db2.gz VQPVNGXNKKXBOK-SFHVURJKSA-N 0 3 407.543 4.333 20 0 HIADHN CS[C@H]1CN(C(=O)c2csc(-c3ccc(Cl)cc3)n2)C[C@@H]1N1CCCC1 ZINC000541844079 939646018 /nfs/dbraw/zinc/64/60/18/939646018.db2.gz YKWMUAKLNZBDGK-IRXDYDNUSA-N 0 3 407.992 4.115 20 0 HIADHN NC(=O)[C@H](CNCc1ccc(-c2nc3ccccc3s2)o1)Cc1ccc(F)cc1 ZINC000541852628 939647151 /nfs/dbraw/zinc/64/71/51/939647151.db2.gz KWICVMGUCFQJIZ-HNNXBMFYSA-N 0 3 409.486 4.129 20 0 HIADHN CSC[C@H](NCc1ccc(NS(C)(=O)=O)cc1)c1ccc(C(F)(F)F)cc1 ZINC000541917125 939653388 /nfs/dbraw/zinc/65/33/88/939653388.db2.gz BNOLQEMISTVBGB-KRWDZBQOSA-N 0 3 418.506 4.271 20 0 HIADHN CCOc1ccccc1[C@H](CC)NC(=O)CN[C@@H](C)c1ccc(-n2ccnc2C)cc1 ZINC000541958858 939662328 /nfs/dbraw/zinc/66/23/28/939662328.db2.gz SWGCBWVCUIEGER-MBSDFSHPSA-N 0 3 420.557 4.498 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)NCC(=O)N(C)[C@@H](C)c2ccc(F)c(F)c2)cc1 ZINC000541956154 939662546 /nfs/dbraw/zinc/66/25/46/939662546.db2.gz SFQHHHRTDGGYGH-CVEARBPZSA-N 0 3 412.484 4.329 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1ccn(-c2cccc(C(F)(F)F)c2)n1 ZINC000542111231 939718243 /nfs/dbraw/zinc/71/82/43/939718243.db2.gz JQJVJZZJUKVNRW-UHFFFAOYSA-N 0 3 421.423 4.080 20 0 HIADHN CCc1cccc2c1OCC[C@H]2N[C@H](C)CC(=O)Nc1ccc(NC(=O)C2CC2)cc1 ZINC000542143108 939728917 /nfs/dbraw/zinc/72/89/17/939728917.db2.gz GBOYULXSRVYXAV-OPAMFIHVSA-N 0 3 421.541 4.428 20 0 HIADHN Cc1cc([C@H](NC2CC(C(=O)OC(C)C)(C(=O)OC(C)C)C2)C2CC2)ccc1F ZINC000542146110 939730242 /nfs/dbraw/zinc/73/02/42/939730242.db2.gz WJRAIIZISWELHH-HXUWFJFHSA-N 0 3 405.510 4.227 20 0 HIADHN C[C@H](N[C@H]1CCCN(Cc2nccn2C)C1=O)c1ccc(-c2ccccc2F)s1 ZINC000542159662 939737086 /nfs/dbraw/zinc/73/70/86/939737086.db2.gz BTXALVAWXAHUBC-YJBOKZPZSA-N 0 3 412.534 4.130 20 0 HIADHN CC(C)c1ccccc1NC(=O)C[C@@H](C)NCc1ccnc(OC2CCOCC2)c1 ZINC000542179733 939746950 /nfs/dbraw/zinc/74/69/50/939746950.db2.gz SLHRZKLVGLTGJG-GOSISDBHSA-N 0 3 411.546 4.270 20 0 HIADHN CN(C(=O)c1nccnc1Sc1ccccc1)C1CCN(Cc2ccccc2)CC1 ZINC000542191757 939750947 /nfs/dbraw/zinc/75/09/47/939750947.db2.gz MTHKTHQUYNHLTL-UHFFFAOYSA-N 0 3 418.566 4.364 20 0 HIADHN CC[C@H](N[C@@H]1CCCN(Cc2ccccn2)C1=O)c1ccc(Br)cc1 ZINC000542209635 939757397 /nfs/dbraw/zinc/75/73/97/939757397.db2.gz UVFFMOPDYRIGDP-RBUKOAKNSA-N 0 3 402.336 4.076 20 0 HIADHN COc1ccccc1-c1ccc(CN[C@H]2CCCN(Cc3ccccn3)C2=O)cc1 ZINC000542314203 939797113 /nfs/dbraw/zinc/79/71/13/939797113.db2.gz MKNOBHNWCQNLGC-QHCPKHFHSA-N 0 3 401.510 4.038 20 0 HIADHN COc1ccc(Oc2ccc(CNCc3cccc(NS(C)(=O)=O)c3)cc2)cc1 ZINC000542319720 939799105 /nfs/dbraw/zinc/79/91/05/939799105.db2.gz QGWVTUBDPBKVAF-UHFFFAOYSA-N 0 3 412.511 4.149 20 0 HIADHN Cc1cc(CNCc2ccc(S(=O)(=O)N3CCC[C@@H](C)C3)cc2)cc2cccnc12 ZINC000542321939 939800046 /nfs/dbraw/zinc/80/00/46/939800046.db2.gz ONPQAGQFSGEBLB-GOSISDBHSA-N 0 3 423.582 4.254 20 0 HIADHN Cc1ccc(NCCCNC(=O)c2cccc(CN(C)Cc3ccccc3)c2)nc1 ZINC000542352044 939805803 /nfs/dbraw/zinc/80/58/03/939805803.db2.gz RXIVBTDOTFPBSJ-UHFFFAOYSA-N 0 3 402.542 4.254 20 0 HIADHN CCc1nccn1C[C@@H]1CCCN1C(=O)c1cccc(CN(C)Cc2ccccc2)c1 ZINC000542402381 939815476 /nfs/dbraw/zinc/81/54/76/939815476.db2.gz MZPCPFQKAZTSPS-DEOSSOPVSA-N 0 3 416.569 4.382 20 0 HIADHN Cc1ccnn1-c1ccccc1NC(=O)N(CCN(C)C)Cc1ccc(F)cc1F ZINC000542422178 939818919 /nfs/dbraw/zinc/81/89/19/939818919.db2.gz LDMFULUTTSDHDE-UHFFFAOYSA-N 0 3 413.472 4.055 20 0 HIADHN O[C@@H](CN[C@@H]1CCOc2c(Cl)cccc21)COc1cccc(C(F)(F)F)c1 ZINC000563738878 945274825 /nfs/dbraw/zinc/27/48/25/945274825.db2.gz KTDFKIULPAMRIM-SUMWQHHRSA-N 0 3 401.812 4.212 20 0 HIADHN COc1cccc(CC(=O)N[C@@H](c2ccc(F)c(F)c2)C(C)(C)N2CCCC2)c1 ZINC000542472027 939828686 /nfs/dbraw/zinc/82/86/86/939828686.db2.gz XGXSORFYIGVMRS-QFIPXVFZSA-N 0 3 402.485 4.248 20 0 HIADHN C[C@@H](CN[C@@H](c1ccc(F)cc1)c1cccnc1)N1CCN(c2ccccc2)CC1 ZINC000542480705 939830834 /nfs/dbraw/zinc/83/08/34/939830834.db2.gz JWJMFIAFEBIPIE-CPJSRVTESA-N 0 3 404.533 4.110 20 0 HIADHN O[C@@H](CN[C@@H](Cn1cnc2ccccc21)c1ccc(F)cc1)COc1ccc(F)cc1 ZINC000542517989 939835870 /nfs/dbraw/zinc/83/58/70/939835870.db2.gz MDLKLZIKHCDQJQ-REWPJTCUSA-N 0 3 423.463 4.085 20 0 HIADHN COc1ccc(CN(C)C(=O)CN[C@@H](Cc2ccccc2)c2cccs2)cc1OC ZINC000542520398 939836719 /nfs/dbraw/zinc/83/67/19/939836719.db2.gz ALQWLUCXNQJIFP-FQEVSTJZSA-N 0 3 424.566 4.297 20 0 HIADHN Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)NC[C@H](O)COc1ccccc1C(C)C ZINC000542534612 939839117 /nfs/dbraw/zinc/83/91/17/939839117.db2.gz YQAIBVXQHVRMJX-YOEHRIQHSA-N 0 3 413.484 4.276 20 0 HIADHN CC[C@H](C)[C@H](C)NCc1nc2c(Br)cc(Br)cc2c(=O)[nH]1 ZINC000542543869 939841350 /nfs/dbraw/zinc/84/13/50/939841350.db2.gz HWYQDNTURYAKHZ-IUCAKERBSA-N 0 3 417.145 4.385 20 0 HIADHN CS(=O)(=O)c1ccc(-c2nc(CN[C@@H](Cc3ccccc3)C3CC3)cs2)cc1 ZINC000542548478 939842036 /nfs/dbraw/zinc/84/20/36/939842036.db2.gz KAPLVJHMTPNKBA-NRFANRHFSA-N 0 3 412.580 4.325 20 0 HIADHN Cc1cnc([C@H](C)CNC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)s1 ZINC000542572447 939845154 /nfs/dbraw/zinc/84/51/54/939845154.db2.gz GCAQYPIPSDETFJ-AUUYWEPGSA-N 0 3 411.493 4.126 20 0 HIADHN COC(=O)C1CCN(C(=O)CN[C@H](C)c2ccc(-c3ccc(Cl)cc3)s2)CC1 ZINC000542618187 939849175 /nfs/dbraw/zinc/84/91/75/939849175.db2.gz HXKOMYGYUWDNSR-CQSZACIVSA-N 0 3 420.962 4.131 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@H]2NCc2cccc(-n3ccnc3)c2)cc1 ZINC000542660109 939852194 /nfs/dbraw/zinc/85/21/94/939852194.db2.gz CZUHIAQXSWHVLY-DHIUTWEWSA-N 0 3 409.555 4.055 20 0 HIADHN Cc1csc([C@@H](C)CN[C@@H](c2ccc(F)cc2)c2cccc(S(C)(=O)=O)c2)n1 ZINC000542682230 939853875 /nfs/dbraw/zinc/85/38/75/939853875.db2.gz SBTPXRYBLRSBFN-XOBRGWDASA-N 0 3 418.559 4.477 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3csc(-c4ccccn4)n3)c(C)c2)CC1 ZINC000542688408 939854246 /nfs/dbraw/zinc/85/42/46/939854246.db2.gz GIXPWRJHVMCAFJ-UHFFFAOYSA-N 0 3 422.558 4.299 20 0 HIADHN Cc1cc(Br)ccc1NC(=O)CCNCc1cccc2c1OCCCO2 ZINC000542694176 939854763 /nfs/dbraw/zinc/85/47/63/939854763.db2.gz OUHSOIZSGBIGFL-UHFFFAOYSA-N 0 3 419.319 4.037 20 0 HIADHN Cc1cnc([C@@H](C)CN[C@H](c2ccc(F)cc2)c2cccc(S(C)(=O)=O)c2)s1 ZINC000542698029 939855058 /nfs/dbraw/zinc/85/50/58/939855058.db2.gz ZLHCYGHZBWGDLI-VBKZILBWSA-N 0 3 418.559 4.477 20 0 HIADHN CS[C@@H]1CN(C(=O)c2csc(-c3ccc(Cl)s3)n2)C[C@H]1N1CCCC1 ZINC000542772628 939860138 /nfs/dbraw/zinc/86/01/38/939860138.db2.gz YCEASFWHYGHFDJ-TZMCWYRMSA-N 0 3 414.021 4.177 20 0 HIADHN COc1ccccc1[C@@H](C)N(C)C(=O)CN[C@H](C)c1ccc(-n2ccnc2C)cc1 ZINC000542883742 939865299 /nfs/dbraw/zinc/86/52/99/939865299.db2.gz WQJHTXLCLCHNSZ-QZTJIDSGSA-N 0 3 406.530 4.060 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cc(-c2cnn(C)c2)ccc1F)c1cccc(OC)c1 ZINC000542947237 939884008 /nfs/dbraw/zinc/88/40/08/939884008.db2.gz XMWRLEMJMNWTKV-QHCPKHFHSA-N 0 3 424.520 4.048 20 0 HIADHN Cn1cc(-c2ccc(F)c(C(=O)N3CCCN(CCCc4ccccc4)CC3)c2)cn1 ZINC000543033443 939899523 /nfs/dbraw/zinc/89/95/23/939899523.db2.gz ACDWXQSXPWKFCJ-UHFFFAOYSA-N 0 3 420.532 4.007 20 0 HIADHN COC(=O)c1cccc(NC(=O)C[C@H](C)N[C@H](C)c2ccccc2OC(F)F)c1 ZINC000543066737 939920104 /nfs/dbraw/zinc/92/01/04/939920104.db2.gz MEIWUIVOBXYIGA-UONOGXRCSA-N 0 3 406.429 4.143 20 0 HIADHN CCOc1cc(C)ccc1CN[C@@H](C)CC(=O)Nc1ccc(NC(=O)C2CC2)cc1 ZINC000543077899 939928605 /nfs/dbraw/zinc/92/86/05/939928605.db2.gz UTYBKVKYLXJGKZ-KRWDZBQOSA-N 0 3 409.530 4.249 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)c3ccc(SC4CC4)cc3)CC2)C[C@H](C)O1 ZINC000543104584 939946198 /nfs/dbraw/zinc/94/61/98/939946198.db2.gz HAYVGQMMENWNTA-ROUUACIJSA-N 0 3 402.604 4.293 20 0 HIADHN CCOC(=O)c1c(C)c(C)sc1NC(=O)C[C@@H](C)NCc1ccnc(SC)c1 ZINC000543115784 939953784 /nfs/dbraw/zinc/95/37/84/939953784.db2.gz WCMLIBLCPHSOPD-GFCCVEGCSA-N 0 3 421.588 4.165 20 0 HIADHN COc1ccc([C@H]2CCCN2C(=O)CN2CC[C@@H](c3cccc(C)c3)C2)c(OC)c1 ZINC000543253369 940008834 /nfs/dbraw/zinc/00/88/34/940008834.db2.gz PGLIPMAORLTJLB-NFBKMPQASA-N 0 3 408.542 4.165 20 0 HIADHN O=C(Nc1ccc(-c2cccc(F)c2)c(F)c1)N1CCN(CC2CCOCC2)CC1 ZINC000543304061 940023467 /nfs/dbraw/zinc/02/34/67/940023467.db2.gz VPCBILOCJPHTOO-UHFFFAOYSA-N 0 3 415.484 4.208 20 0 HIADHN Cc1ccnn1-c1ccccc1NC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1 ZINC000543347403 940037275 /nfs/dbraw/zinc/03/72/75/940037275.db2.gz JHLVTQDXGMPJGJ-IBGZPJMESA-N 0 3 403.530 4.309 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2CN2CCOCC3(CCOCC3)C2)cc1 ZINC000543392873 940049745 /nfs/dbraw/zinc/04/97/45/940049745.db2.gz GCTCGKBSYLOVBY-UHFFFAOYSA-N 0 3 417.553 4.477 20 0 HIADHN CCN1CCN(Cc2ccccc2CN[C@@H](c2ccccc2)c2ccc(F)cn2)CC1 ZINC000543406808 940054972 /nfs/dbraw/zinc/05/49/72/940054972.db2.gz LVOYHNOQDMKHPT-SANMLTNESA-N 0 3 418.560 4.237 20 0 HIADHN Cc1nn(CC(=O)N[C@H](c2ccc(F)c(F)c2)C(C)(C)N2CCCC2)c(C)c1Cl ZINC000543409418 940055862 /nfs/dbraw/zinc/05/58/62/940055862.db2.gz KGZQHUZNENILMV-HXUWFJFHSA-N 0 3 424.923 4.163 20 0 HIADHN CCc1ccccc1NC(=O)CN(C)C(=O)[C@@H](C)N[C@@H](CC(C)C)c1cccs1 ZINC000543484895 940079500 /nfs/dbraw/zinc/07/95/00/940079500.db2.gz FZWGJIKLWCRZBZ-XLIONFOSSA-N 0 3 415.603 4.473 20 0 HIADHN CC[C@H](NCC(=O)Nc1cc(C(F)(F)F)ccc1N1CCCCC1)[C@@H]1CCCO1 ZINC000543496728 940085126 /nfs/dbraw/zinc/08/51/26/940085126.db2.gz LRRASVOKPLIGOQ-LPHOPBHVSA-N 0 3 413.484 4.181 20 0 HIADHN C[C@H](NCCCN1CCCC1=O)c1nc(-c2ccc(Br)cc2)cs1 ZINC000543498588 940085318 /nfs/dbraw/zinc/08/53/18/940085318.db2.gz HWNQMCXBRLYZLJ-ZDUSSCGKSA-N 0 3 408.365 4.236 20 0 HIADHN C[C@H](c1ccc(F)cc1)N(C)C(=O)CN(C)[C@@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000543558957 940108947 /nfs/dbraw/zinc/10/89/47/940108947.db2.gz OQVYOXJIYNIPFT-HVETUWLQSA-N 0 3 402.485 4.336 20 0 HIADHN COc1ccc([C@@H](CN[C@@H](c2ccccc2)c2cncnc2)N2CCCCC2)cc1 ZINC000543604744 940128911 /nfs/dbraw/zinc/12/89/11/940128911.db2.gz CQCYUSSSKHXPPS-RPBOFIJWSA-N 0 3 402.542 4.391 20 0 HIADHN CCCOc1c(Br)cc(CN2CCC[C@@H](c3nnc(C)[nH]3)C2)cc1OC ZINC000543621236 940135863 /nfs/dbraw/zinc/13/58/63/940135863.db2.gz JNYIOXQFFMDOOF-OAHLLOKOSA-N 0 3 423.355 4.053 20 0 HIADHN C[C@H](Cc1ccccc1C(F)(F)F)NC(=O)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000543744039 940173945 /nfs/dbraw/zinc/17/39/45/940173945.db2.gz WOMXOZNXXHJLRG-VQIMIIECSA-N 0 3 405.464 4.060 20 0 HIADHN CSC[C@@H](NCCNC(=O)c1ccccc1F)c1ccc(C(F)(F)F)cc1 ZINC000543776571 940182587 /nfs/dbraw/zinc/18/25/87/940182587.db2.gz LVGQUIIZLFVYPL-QGZVFWFLSA-N 0 3 400.441 4.268 20 0 HIADHN CCCCCc1nnc(NC(=O)CN[C@@H](C)c2ccc(-n3ccnc3C)cc2)s1 ZINC000543809213 940193366 /nfs/dbraw/zinc/19/33/66/940193366.db2.gz IQFUMUFZZYOHEA-HNNXBMFYSA-N 0 3 412.563 4.054 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)NCC(=O)Nc2ccc(OC(F)F)cc2)cc1 ZINC000543814120 940196212 /nfs/dbraw/zinc/19/62/12/940196212.db2.gz ZXBKQXWUXLGXJP-CQSZACIVSA-N 0 3 400.429 4.071 20 0 HIADHN CCN1CC[C@@H](NCc2cnn(-c3ccccc3)c2)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000543849128 940207567 /nfs/dbraw/zinc/20/75/67/940207567.db2.gz LXZQHPMCRIKZOA-IFMALSPDSA-N 0 3 400.448 4.215 20 0 HIADHN CN(C)C(=O)c1ccc(CN[C@@H]2CCN(C(C)(C)C)[C@@H]2c2ccc(Cl)c(F)c2)[nH]1 ZINC000543850113 940208539 /nfs/dbraw/zinc/20/85/39/940208539.db2.gz IZGPFLQOLISEJQ-UYAOXDASSA-N 0 3 420.960 4.213 20 0 HIADHN CCN1CC[C@H](NCc2cccc3c2OCCCO3)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000543870515 940218263 /nfs/dbraw/zinc/21/82/63/940218263.db2.gz BQNRTZCGOYPDMJ-GHTZIAJQSA-N 0 3 406.448 4.190 20 0 HIADHN CCOC(=O)c1oc2ccccc2c1CN1CCC(CCC(=O)N(CC)CC)CC1 ZINC000543870048 940218398 /nfs/dbraw/zinc/21/83/98/940218398.db2.gz PKHOSSXSIDODFB-UHFFFAOYSA-N 0 3 414.546 4.470 20 0 HIADHN c1cc(COc2ccc3c(c2)OCO3)cc(NC2CCN(Cc3ccncc3)CC2)c1 ZINC000543876789 940221756 /nfs/dbraw/zinc/22/17/56/940221756.db2.gz DVBAXLPYARGIRX-UHFFFAOYSA-N 0 3 417.509 4.466 20 0 HIADHN CN(C)C[C@@H](NC(=O)Nc1cccc(C(=O)N2CCCC2)c1)c1ccc(Cl)cc1 ZINC000563824213 945305676 /nfs/dbraw/zinc/30/56/76/945305676.db2.gz WOUMLPZGVSACLO-HXUWFJFHSA-N 0 3 414.937 4.000 20 0 HIADHN CCCc1c(NC(=O)N(CCN(C)C)Cc2ccccc2)cnn1-c1ccccc1 ZINC000543974362 940280388 /nfs/dbraw/zinc/28/03/88/940280388.db2.gz FUGBCPRQXVTKKC-UHFFFAOYSA-N 0 3 405.546 4.421 20 0 HIADHN CC(C)Cc1ccc([C@@H](CNC(=O)c2ccc(-c3ccco3)[nH]c2=O)N(C)C)cc1 ZINC000563837265 945309837 /nfs/dbraw/zinc/30/98/37/945309837.db2.gz UIJPNALTEGZXHA-OAQYLSRUSA-N 0 3 407.514 4.278 20 0 HIADHN C[C@@H](N[C@@H]1CCCN(Cc2nccn2C)C1=O)c1ccc(Oc2ccccc2)cc1 ZINC000544017005 940300735 /nfs/dbraw/zinc/30/07/35/940300735.db2.gz RYQVZBMUMIZZMJ-XMSQKQJNSA-N 0 3 404.514 4.054 20 0 HIADHN COc1ccc2cc(CN[C@@H](Cc3ccc(C(F)(F)F)cc3)C(N)=O)ccc2c1 ZINC000544095546 940325236 /nfs/dbraw/zinc/32/52/36/940325236.db2.gz UWPQPRHUIDMZCI-FQEVSTJZSA-N 0 3 402.416 4.053 20 0 HIADHN C[C@H](N[C@@H](Cc1ccc(C(F)(F)F)cc1)C(N)=O)c1ccc(OC(F)F)cc1 ZINC000544095794 940325255 /nfs/dbraw/zinc/32/52/55/940325255.db2.gz BVMDMBUPKMTDHD-ZBEGNZNMSA-N 0 3 402.363 4.054 20 0 HIADHN C[C@@H](C[S@@](C)=O)NCc1cn(Cc2ccccc2Cl)nc1-c1ccccc1 ZINC000544168119 940342335 /nfs/dbraw/zinc/34/23/35/940342335.db2.gz BHGUQPMZJBAXSS-RKOGDMNLSA-N 0 3 401.963 4.108 20 0 HIADHN CC(C)Oc1ccc(-c2nn(-c3ccccc3)cc2CN[C@H](C)C[S@@](C)=O)cc1 ZINC000544169168 940342524 /nfs/dbraw/zinc/34/25/24/940342524.db2.gz MGGDKENEUHGNAK-LDLUVENISA-N 0 3 411.571 4.183 20 0 HIADHN C[C@@]1(NCC(=O)Nc2cc(C3CCCC3)nn2-c2ccccc2)CCO[C@H]1C1CC1 ZINC000544175566 940344333 /nfs/dbraw/zinc/34/43/33/940344333.db2.gz NAPZNMYWDHIYRY-BJKOFHAPSA-N 0 3 408.546 4.016 20 0 HIADHN CCCc1c(NC(=O)[C@@H]2CCCN(Cc3cccnc3)C2)cnn1-c1cccc(F)c1 ZINC000544294847 940382203 /nfs/dbraw/zinc/38/22/03/940382203.db2.gz IQTOOZFMJXGUFW-LJQANCHMSA-N 0 3 421.520 4.210 20 0 HIADHN Cc1cc(-c2nc(C3CC3)no2)ccc1NC(=O)NC[C@@H](Cc1ccccc1)N(C)C ZINC000544306675 940385510 /nfs/dbraw/zinc/38/55/10/940385510.db2.gz FKOJSFZGIXCSGI-HXUWFJFHSA-N 0 3 419.529 4.217 20 0 HIADHN Cc1c(-c2nc(-c3ccc(N4CCCN(C)CC4)nc3)no2)sc2nccc(C)c12 ZINC000544332864 940392747 /nfs/dbraw/zinc/39/27/47/940392747.db2.gz DUVMSIYMHWWFRO-UHFFFAOYSA-N 0 3 420.542 4.167 20 0 HIADHN COc1ccc(CCN[C@@H](c2cccnc2)c2ccc(F)c(C)c2)c(OC)c1OC ZINC000544360823 940401574 /nfs/dbraw/zinc/40/15/74/940401574.db2.gz RQGMAMRWAQMYQU-JOCHJYFZSA-N 0 3 410.489 4.477 20 0 HIADHN CCC(C)(C)[NH2+][C@H](C)C(=O)Nc1ccc(C)c(S(=O)(=O)[N-]c2ccccc2F)c1 ZINC000544403654 940413499 /nfs/dbraw/zinc/41/34/99/940413499.db2.gz KGNUAKRWJMXWEV-OAHLLOKOSA-N 0 3 421.538 4.040 20 0 HIADHN COc1ccc(CN(C)C[C@@H](O)COc2cc(C)ccc2Cl)cc1OC(F)F ZINC000544410143 940416393 /nfs/dbraw/zinc/41/63/93/940416393.db2.gz ZLODPHIZEPTCGX-OAHLLOKOSA-N 0 3 415.864 4.130 20 0 HIADHN C[C@H](NCC(=O)N[C@H](c1cccs1)c1ccc(F)cc1)[C@@H]1COc2ccccc21 ZINC000544527779 940472229 /nfs/dbraw/zinc/47/22/29/940472229.db2.gz CTRHUBAUPIDARP-FOMLIJIXSA-N 0 3 410.514 4.247 20 0 HIADHN C[C@@H]1N(CC(=O)N2CCc3sccc3[C@@H]2c2ccccc2)CCC12CCOCC2 ZINC000544546407 940476312 /nfs/dbraw/zinc/47/63/12/940476312.db2.gz HTVRLBSGDHUMMC-MBSDFSHPSA-N 0 3 410.583 4.113 20 0 HIADHN C[C@H]1N(CC(=O)N[C@H](c2ccccc2)c2cccc(Cl)c2)CCC12CCOCC2 ZINC000544547197 940476673 /nfs/dbraw/zinc/47/66/73/940476673.db2.gz LUEPXXLKPCVKJR-WZONZLPQSA-N 0 3 412.961 4.437 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@H]2CCCC[C@@H]2NCc2ccccc2Cn2cccn2)cc1 ZINC000544580184 940483619 /nfs/dbraw/zinc/48/36/19/940483619.db2.gz LPXDYLGDEXSMAA-ZEQRLZLVSA-N 0 3 423.582 4.115 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)Nc1csc(-c2ccccn2)n1 ZINC000544598708 940487691 /nfs/dbraw/zinc/48/76/91/940487691.db2.gz SKEPRFKHWIYCCU-UHFFFAOYSA-N 0 3 409.559 4.233 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1csc(-c2ccccn2)n1 ZINC000544599107 940487730 /nfs/dbraw/zinc/48/77/30/940487730.db2.gz SZKPNPWHAPEXKN-KRWDZBQOSA-N 0 3 407.543 4.333 20 0 HIADHN C[C@H](CNC(=O)N(C)[C@H]1CCO[C@@H](c2ccc(F)cc2)C1)N(C)Cc1ccccc1 ZINC000544661621 940499786 /nfs/dbraw/zinc/49/97/86/940499786.db2.gz SCDKSCWRIPAZPK-YFXJRYMSSA-N 0 3 413.537 4.208 20 0 HIADHN CS[C@H]1CN(C(=O)c2ccc(COc3ccc(C)cc3C)o2)C[C@H]1N1CCCC1 ZINC000544685224 940502386 /nfs/dbraw/zinc/50/23/86/940502386.db2.gz WMXOEFPIGOWOPR-KNQAVFIVSA-N 0 3 414.571 4.127 20 0 HIADHN CCO[C@@H]1C[C@H](NCc2cccc(NC(=O)c3ccccc3Cl)c2)[C@]12CCCO2 ZINC000544709976 940505494 /nfs/dbraw/zinc/50/54/94/940505494.db2.gz NGSLDDOOSXFKAH-QZNHQXDQSA-N 0 3 414.933 4.409 20 0 HIADHN Cc1ccc(C(C)(C)NC[C@H](O)COc2ccc(Cl)cc2Br)cn1 ZINC000544762009 940511773 /nfs/dbraw/zinc/51/17/73/940511773.db2.gz RXVKNVMGUNVGLD-HNNXBMFYSA-N 0 3 413.743 4.071 20 0 HIADHN Cc1nnc([C@H](C)NC(=O)N(CCN(C)Cc2ccccc2)Cc2ccccc2)s1 ZINC000544801996 940515715 /nfs/dbraw/zinc/51/57/15/940515715.db2.gz WAYXQTMKMMXBRJ-SFHVURJKSA-N 0 3 423.586 4.251 20 0 HIADHN CN(C)C(=O)COc1cccc(CN[C@H](Cc2cccnc2)c2ccc(Cl)cc2)c1 ZINC000544827469 940517889 /nfs/dbraw/zinc/51/78/89/940517889.db2.gz MNRQPWBAPFUZCG-HSZRJFAPSA-N 0 3 423.944 4.276 20 0 HIADHN CO[C@H](c1ccccc1Cl)[C@H](C)N[C@@H](C)c1cccc(S(=O)(=O)N(C)C)c1 ZINC000544828129 940518053 /nfs/dbraw/zinc/51/80/53/940518053.db2.gz OIZFYMGXPYAJCA-AVYPCKFXSA-N 0 3 410.967 4.017 20 0 HIADHN FC(F)(F)c1ccc(Cc2noc(-c3ccc(CN4CCSCC4)cc3)n2)nc1 ZINC000544993928 940531655 /nfs/dbraw/zinc/53/16/55/940531655.db2.gz PVZUTYZHRNBDKV-UHFFFAOYSA-N 0 3 420.460 4.290 20 0 HIADHN FC(F)(F)Oc1ccc(-c2noc([C@H]3CCCN(Cc4cccnc4)C3)n2)cc1 ZINC000545036242 940535670 /nfs/dbraw/zinc/53/56/70/940535670.db2.gz SJPCODSKDCGGNO-INIZCTEOSA-N 0 3 404.392 4.410 20 0 HIADHN COc1ccc2[nH]c3c(c2c1)C[C@@H](N[C@@H](c1nc(-c2ccncc2)no1)C(C)C)CC3 ZINC000545191333 940555182 /nfs/dbraw/zinc/55/51/82/940555182.db2.gz RBQLRAZEBQEWRE-KSFYIVLOSA-N 0 3 417.513 4.466 20 0 HIADHN CCN1CC[C@H](NCc2cncc(Br)c2)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000545218948 940556535 /nfs/dbraw/zinc/55/65/35/940556535.db2.gz STSYYKRRDPTABD-FUHWJXTLSA-N 0 3 414.269 4.187 20 0 HIADHN CN(C(=O)N[C@@H](CC(C)(C)C)C(F)(F)F)C1CCN(CCc2ccccn2)CC1 ZINC000545405728 940568671 /nfs/dbraw/zinc/56/86/71/940568671.db2.gz KNVKFGXZHKVAOV-SFHVURJKSA-N 0 3 414.516 4.097 20 0 HIADHN Clc1ccc([C@@H](Cc2cccnc2)NCc2ccc(N3CCOCC3)nc2)cc1 ZINC000545459114 940570870 /nfs/dbraw/zinc/57/08/70/940570870.db2.gz GQUKWPNNMJUNPD-JOCHJYFZSA-N 0 3 408.933 4.040 20 0 HIADHN COc1cc([C@H](C)N[C@H](C)[C@H](OC)c2ccccc2Cl)ccc1S(C)(=O)=O ZINC000545460613 940570987 /nfs/dbraw/zinc/57/09/87/940570987.db2.gz RNJMFEAQFYPWTD-MNVSYLFESA-N 0 3 411.951 4.179 20 0 HIADHN CCN(C(=O)[C@@H](C)Oc1ccc(CCC(C)=O)cc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000545474939 940571259 /nfs/dbraw/zinc/57/12/59/940571259.db2.gz IUUSPBQCMHPJAQ-QPPBQGQZSA-N 0 3 422.569 4.099 20 0 HIADHN CCN(C(=O)c1cccc(NC(=O)[C@@H]2C[C@@H]2C)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000545476605 940571419 /nfs/dbraw/zinc/57/14/19/940571419.db2.gz DXFZOSFOYKESFX-CDNPAEQRSA-N 0 3 405.542 4.018 20 0 HIADHN CCN(C(=O)c1cccc(Oc2cnccn2)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000545475967 940571439 /nfs/dbraw/zinc/57/14/39/940571439.db2.gz WBWHBIJURVDEQR-OAQYLSRUSA-N 0 3 402.498 4.006 20 0 HIADHN COc1ccc(C(=O)CCc2nc(-c3ccccc3CN3CCCC3)no2)cc1OC ZINC000545535681 940573688 /nfs/dbraw/zinc/57/36/88/940573688.db2.gz QMHUAYKHDBBLCN-UHFFFAOYSA-N 0 3 421.497 4.165 20 0 HIADHN COC(=O)c1cn(C2CCN(Cc3ccc(-c4cccc(Cl)c4)s3)CC2)nn1 ZINC000545547693 940574278 /nfs/dbraw/zinc/57/42/78/940574278.db2.gz BNAMGCCMBRHAAK-UHFFFAOYSA-N 0 3 416.934 4.284 20 0 HIADHN CC(C)N1CCN(c2ccc(-c3nc([C@@H]4CCOc5ccccc54)no3)cc2)CC1 ZINC000545695920 940581188 /nfs/dbraw/zinc/58/11/88/940581188.db2.gz RFBUSLLFZQDROB-OAQYLSRUSA-N 0 3 404.514 4.181 20 0 HIADHN COc1cc(-c2noc([C@H]3CCCN(Cc4cccnc4)C3)n2)c2ccccc2n1 ZINC000545740062 940583145 /nfs/dbraw/zinc/58/31/45/940583145.db2.gz FQJAQSISKYXXEP-KRWDZBQOSA-N 0 3 401.470 4.068 20 0 HIADHN CN(C)C[C@@H](NC(=O)Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(Cl)cc1 ZINC000563977823 945333803 /nfs/dbraw/zinc/33/38/03/945333803.db2.gz LFUCTRIJJBLIDR-HXUWFJFHSA-N 0 3 414.937 4.000 20 0 HIADHN Fc1cccc(CN2CCC[C@@H](c3nc(-c4cc(OCC(F)F)ccn4)no3)C2)c1 ZINC000545845978 940630711 /nfs/dbraw/zinc/63/07/11/940630711.db2.gz MRTKKMTYRJYXFX-OAHLLOKOSA-N 0 3 418.419 4.294 20 0 HIADHN CCc1ccc([C@H](CNC(=O)c2cc(C)n(Cc3ccncc3)c2C)N(C)C)cc1 ZINC000545872839 940646693 /nfs/dbraw/zinc/64/66/93/940646693.db2.gz ALGSHMFTJFSURS-DEOSSOPVSA-N 0 3 404.558 4.143 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)CCc1cc(Br)ccc1F)c1ccco1 ZINC000563989526 945337836 /nfs/dbraw/zinc/33/78/36/945337836.db2.gz VZUUUUQYZUYRGN-CXAGYDPISA-N 0 3 411.315 4.359 20 0 HIADHN CCN(CC)[C@H](CNC(=O)C(C)(C)Cc1nc2ccccc2[nH]1)c1cccc(OC)c1 ZINC000545964804 940666911 /nfs/dbraw/zinc/66/69/11/940666911.db2.gz KKZDPFSQEGMXMU-JOCHJYFZSA-N 0 3 422.573 4.340 20 0 HIADHN Cc1ccc(C(=O)CCCCC(=O)N2CCC(CN3C[C@H](C)O[C@@H](C)C3)CC2)cc1 ZINC000546081869 940694020 /nfs/dbraw/zinc/69/40/20/940694020.db2.gz KGDJHJGKXLPNGB-SFTDATJTSA-N 0 3 414.590 4.086 20 0 HIADHN CC[C@H](C)n1ncc2c1nc(C)cc2C(=O)N(CC)[C@H]1CCN(Cc2ccccc2)C1 ZINC000546183387 940723121 /nfs/dbraw/zinc/72/31/21/940723121.db2.gz FCANNOCYVFFUNU-FPOVZHCZSA-N 0 3 419.573 4.447 20 0 HIADHN CCN(C(=O)c1nn(-c2ccccc2)c2c1CCC2)[C@H]1CCN(Cc2ccccc2)C1 ZINC000546184842 940724212 /nfs/dbraw/zinc/72/42/12/940724212.db2.gz VGBGBGSIUUSMDY-QFIPXVFZSA-N 0 3 414.553 4.098 20 0 HIADHN CCCN(C(=O)NCCC[C@@H]1CCCCO1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000546203691 940729122 /nfs/dbraw/zinc/72/91/22/940729122.db2.gz NLYBYHDISIEBKI-PKTZIBPZSA-N 0 3 401.595 4.422 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CCC(c4ccccc4F)CC3)c2)CC1 ZINC000546744513 940875361 /nfs/dbraw/zinc/87/53/61/940875361.db2.gz OMJAMGQXYIHART-UHFFFAOYSA-N 0 3 410.537 4.379 20 0 HIADHN CC[C@@H](CNC(=O)NCc1nc2ccccc2n1C1CC1)N1CCc2ccccc2C1 ZINC000546758187 940878247 /nfs/dbraw/zinc/87/82/47/940878247.db2.gz RUGINYROUXMBKD-FQEVSTJZSA-N 0 3 417.557 4.007 20 0 HIADHN CCN(C(=O)c1ccc(N2CCC(C)CC2)nc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000546891008 940903337 /nfs/dbraw/zinc/90/33/37/940903337.db2.gz VWPUWCOEXBEEHK-HSZRJFAPSA-N 0 3 406.574 4.055 20 0 HIADHN CCCN(CC)C(=O)c1ccc(C(=O)N(CC)[C@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000546893402 940904629 /nfs/dbraw/zinc/90/46/29/940904629.db2.gz QBHBCWDGGZUPSG-DEOSSOPVSA-N 0 3 421.585 4.295 20 0 HIADHN CCCN(CC)C(=O)c1ccc(C(=O)N(CC)[C@@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000546893403 940904888 /nfs/dbraw/zinc/90/48/88/940904888.db2.gz QBHBCWDGGZUPSG-XMMPIXPASA-N 0 3 421.585 4.295 20 0 HIADHN CCN(C(=O)c1ccc(-c2n[nH]c(C3CC3)n2)cc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000546906657 940909237 /nfs/dbraw/zinc/90/92/37/940909237.db2.gz FNDAQQSRPLTWHQ-QFIPXVFZSA-N 0 3 415.541 4.086 20 0 HIADHN CCCc1c(NC(=O)N(CCN(C)C)Cc2ccccc2)cnn1-c1cc(C)ccn1 ZINC000546928000 940916030 /nfs/dbraw/zinc/91/60/30/940916030.db2.gz HJFQSSGISWEYQN-UHFFFAOYSA-N 0 3 420.561 4.124 20 0 HIADHN C[C@@H](SCc1ccccc1)c1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1 ZINC000547064739 940980547 /nfs/dbraw/zinc/98/05/47/940980547.db2.gz UHEFNMHMLOCSIG-QGZVFWFLSA-N 0 3 409.559 4.268 20 0 HIADHN Cc1cc(CCCc2nc(-c3ccc(N4CCCN(C)CC4)nc3)no2)c(C)s1 ZINC000547065245 940981184 /nfs/dbraw/zinc/98/11/84/940981184.db2.gz IDRACALRQXGWJN-UHFFFAOYSA-N 0 3 411.575 4.127 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(-c4cccc(-c5cscn5)c4)n3)cn2)CC1 ZINC000547071192 940983385 /nfs/dbraw/zinc/98/33/85/940983385.db2.gz XANQUGFSSOIIJB-UHFFFAOYSA-N 0 3 418.526 4.064 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(-c4cc5ccc(Cl)cc5[nH]4)n3)cn2)CC1 ZINC000547071156 940983692 /nfs/dbraw/zinc/98/36/92/940983692.db2.gz UOPMBLJIQVJDFW-UHFFFAOYSA-N 0 3 408.893 4.075 20 0 HIADHN c1ccc(Oc2cnc(-c3noc([C@H]4CCCN(Cc5cccnc5)C4)n3)cn2)cc1 ZINC000547225570 941037532 /nfs/dbraw/zinc/03/75/32/941037532.db2.gz CSVRYXSCNSOMFA-SFHVURJKSA-N 0 3 414.469 4.094 20 0 HIADHN Cc1cc(C(=O)N(CCCc2ccccc2)CCN(C)C)c(C)n1Cc1ccncc1 ZINC000547274201 941050347 /nfs/dbraw/zinc/05/03/47/941050347.db2.gz YUIHSJONFBIEQL-UHFFFAOYSA-N 0 3 418.585 4.185 20 0 HIADHN Cc1cn(-c2ccc(Cl)cc2)nc1NC(=O)c1oc2ccccc2c1CN(C)C ZINC000547407708 941060909 /nfs/dbraw/zinc/06/09/09/941060909.db2.gz JILWEKOQKHTBDA-UHFFFAOYSA-N 0 3 408.889 4.894 20 0 HIADHN CCCC(=O)Nc1cccc(CNC(=O)N(CC)[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000547788290 941075891 /nfs/dbraw/zinc/07/58/91/941075891.db2.gz OZBHTJGIEJNOAQ-QHCPKHFHSA-N 0 3 422.573 4.231 20 0 HIADHN CC(C)N1CCN([C@@H]2CCN(C(=O)C34CC5(C)CC(C)(CC(C)(C5)C3)C4)C2)CC1 ZINC000547803680 941076497 /nfs/dbraw/zinc/07/64/97/941076497.db2.gz GOZWUACNMXOTOF-OUOZTYEKSA-N 0 3 401.639 4.000 20 0 HIADHN COC[C@@H](CC(C)C)N[C@@H](c1cccc(S(C)(=O)=O)c1)c1ccc(C)cc1C ZINC000547867656 941079233 /nfs/dbraw/zinc/07/92/33/941079233.db2.gz CNPZKPSCRKZDRR-OFNKIYASSA-N 0 3 403.588 4.447 20 0 HIADHN CN1CCN(C[C@H](NCc2cc(Cl)cc(C(F)(F)F)c2)c2ccccc2)CC1 ZINC000548032385 941083598 /nfs/dbraw/zinc/08/35/98/941083598.db2.gz GBDLDRINRNCNPM-FQEVSTJZSA-N 0 3 411.899 4.437 20 0 HIADHN O=C(Nc1ccc(Oc2cccc(Br)c2)nc1)C12CCCN1CCC2 ZINC000548413939 941101237 /nfs/dbraw/zinc/10/12/37/941101237.db2.gz ZQAKTIMHJPRKQJ-UHFFFAOYSA-N 0 3 402.292 4.203 20 0 HIADHN CN(C)C[C@H](NC(=O)Nc1ccc(NC(=O)C2CC2)cc1)c1ccc(Cl)cc1 ZINC000548947561 941132264 /nfs/dbraw/zinc/13/22/64/941132264.db2.gz YUCCUGOVBBEASG-IBGZPJMESA-N 0 3 400.910 4.113 20 0 HIADHN CN(C)C[C@H](NC(=O)Nc1ccnn1Cc1ccc(F)cc1)c1ccc(Cl)cc1 ZINC000548976386 941137379 /nfs/dbraw/zinc/13/73/79/941137379.db2.gz XUBITRRAZQQHLM-IBGZPJMESA-N 0 3 415.900 4.148 20 0 HIADHN CCc1oc(C(=O)N(c2cccc(SC)c2)C2CCN(C)CC2)cc1C(=O)OC ZINC000549008692 941142249 /nfs/dbraw/zinc/14/22/49/941142249.db2.gz GFARVYRAZBWSLR-UHFFFAOYSA-N 0 3 416.543 4.092 20 0 HIADHN CC(C)c1noc(Cc2ccc(NC(=O)NCCN(C)Cc3ccccc3)cc2)n1 ZINC000549051894 941149069 /nfs/dbraw/zinc/14/90/69/941149069.db2.gz CMJTURPBRYEYFL-UHFFFAOYSA-N 0 3 407.518 4.037 20 0 HIADHN COc1ccc([C@@H](NC(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)C2CC2)cc1 ZINC000549104310 941159208 /nfs/dbraw/zinc/15/92/08/941159208.db2.gz RGZHAEUSJHRUNU-SFTDATJTSA-N 0 3 401.938 4.402 20 0 HIADHN CCc1ccccc1NC(=O)CN[C@H]1CCN(C(C)C)[C@@H]1c1ccc(F)c(F)c1 ZINC000549114032 941161249 /nfs/dbraw/zinc/16/12/49/941161249.db2.gz PLMPYGPDWUGPPZ-JTHBVZDNSA-N 0 3 401.501 4.279 20 0 HIADHN CCN1CC[C@H](NCc2cc(F)cc3c2OCOC3)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000549114514 941161419 /nfs/dbraw/zinc/16/14/19/941161419.db2.gz ZECDZKHHADGEGO-ICSRJNTNSA-N 0 3 410.411 4.035 20 0 HIADHN COc1cccc([C@@H]2[C@@H](NCC(=O)Nc3ccc(C)cc3Cl)CCN2C2CC2)c1 ZINC000549118298 941161921 /nfs/dbraw/zinc/16/19/21/941161921.db2.gz RWKQADKITMWFNQ-JTHBVZDNSA-N 0 3 413.949 4.163 20 0 HIADHN CN(C)C[C@H](NC(=O)NCc1csc(-c2ccco2)n1)c1ccc(Cl)cc1 ZINC000549127217 941163081 /nfs/dbraw/zinc/16/30/81/941163081.db2.gz BMEMXQZGCIIKDN-INIZCTEOSA-N 0 3 404.923 4.159 20 0 HIADHN CS(=O)(=O)Nc1cccc(CN[C@H]2CCCCc3cc(Br)ccc32)c1 ZINC000549146213 941165442 /nfs/dbraw/zinc/16/54/42/941165442.db2.gz KVMQQIRJEQURLA-IBGZPJMESA-N 0 3 423.376 4.378 20 0 HIADHN CC[C@H](C)C(=O)Nc1cccc(CNC[C@H](O)CO[C@H]2CCCc3ccccc32)c1 ZINC000549159590 941167156 /nfs/dbraw/zinc/16/71/56/941167156.db2.gz YWDLRMONGRRXQU-OEOAZWSVSA-N 0 3 410.558 4.216 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@@H](N[C@H](CO)c2cccc(Br)c2)c2ccccc21 ZINC000549228909 941172406 /nfs/dbraw/zinc/17/24/06/941172406.db2.gz PAJPNJYSFIOIRJ-VAMGGRTRSA-N 0 3 418.331 4.254 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)[C@@H](C)c3ccc(C(=O)C(C)C)cc3)cc2)CC1 ZINC000549232040 941172630 /nfs/dbraw/zinc/17/26/30/941172630.db2.gz XYDMJIGKVLXKEU-FQEVSTJZSA-N 0 3 421.585 4.405 20 0 HIADHN Cc1cc(C(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)c(C)n1Cc1ccccn1 ZINC000549239709 941173257 /nfs/dbraw/zinc/17/32/57/941173257.db2.gz IWUTYVVHTJAGPU-JOCHJYFZSA-N 0 3 410.949 4.234 20 0 HIADHN COc1ccc(Br)c(C(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)c1 ZINC000549244609 941173788 /nfs/dbraw/zinc/17/37/88/941173788.db2.gz HJSWKDRHUOTGSW-QGZVFWFLSA-N 0 3 411.727 4.144 20 0 HIADHN COc1ccccc1NC(=O)CN[C@@H]1CCN(C(C)C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000549345356 941181607 /nfs/dbraw/zinc/18/16/07/941181607.db2.gz NDFMXIOHQOFJMY-KNQAVFIVSA-N 0 3 419.928 4.240 20 0 HIADHN CC[C@H]1CN(c2nnc(COCc3ccccc3)n2CC)CCN1Cc1ccccc1 ZINC000549398850 941186138 /nfs/dbraw/zinc/18/61/38/941186138.db2.gz IWNQIEZMANUXIT-QHCPKHFHSA-N 0 3 419.573 4.116 20 0 HIADHN CN(C)C[C@H](NC(=O)N[C@@H](c1ccc(F)cc1)[C@H]1CCCO1)c1ccc(Cl)cc1 ZINC000549414604 941187519 /nfs/dbraw/zinc/18/75/19/941187519.db2.gz KIBIVTOCFAIPBG-HBMCJLEFSA-N 0 3 419.928 4.301 20 0 HIADHN CC(=O)NCCN(Cc1ccc(-c2nc3ccccc3s2)o1)C1CCSCC1 ZINC000549447061 941191069 /nfs/dbraw/zinc/19/10/69/941191069.db2.gz WREUZNSDGRHKOL-UHFFFAOYSA-N 0 3 415.584 4.390 20 0 HIADHN CC(C)Cn1c(-c2cccc3ccccc32)nnc1N1CCN(C2CCOCC2)CC1 ZINC000549462910 941192631 /nfs/dbraw/zinc/19/26/31/941192631.db2.gz HGQKPQOJEUASIC-UHFFFAOYSA-N 0 3 419.573 4.055 20 0 HIADHN CC(C)N1CC[C@H](N[C@@H](C)C(=O)Nc2c(F)cccc2F)[C@@H]1c1ccc(F)c(F)c1 ZINC000549471647 941193289 /nfs/dbraw/zinc/19/32/89/941193289.db2.gz NMAIAYMXLRYPFN-LPLGYCIKSA-N 0 3 423.454 4.384 20 0 HIADHN CC(C)N1CC[C@@H](NCC(=O)NCc2ccc(Cl)cc2)[C@H]1c1ccc(F)c(F)c1 ZINC000549472342 941193579 /nfs/dbraw/zinc/19/35/79/941193579.db2.gz MTTFFUWKVHRDSM-IFMALSPDSA-N 0 3 421.919 4.048 20 0 HIADHN COc1cccc([C@@H]2[C@H](NCC(=O)N(c3ccccc3)C(C)C)CCN2C2CC2)c1 ZINC000549473343 941193717 /nfs/dbraw/zinc/19/37/17/941193717.db2.gz SUHCKTNSUDEQFR-ILBGXUMGSA-N 0 3 407.558 4.004 20 0 HIADHN COc1cccc([C@H]2[C@H](NCC(=O)N(c3ccccc3)C(C)C)CCN2C2CC2)c1 ZINC000549473353 941193732 /nfs/dbraw/zinc/19/37/32/941193732.db2.gz SUHCKTNSUDEQFR-NOZRDPDXSA-N 0 3 407.558 4.004 20 0 HIADHN CCn1c(CN[C@H]2CCN(C3CC3)[C@H]2c2cccc(OC)c2)nc2c1cccc2F ZINC000549475377 941194023 /nfs/dbraw/zinc/19/40/23/941194023.db2.gz DFTKVHVGFBZCON-RDPSFJRHSA-N 0 3 408.521 4.272 20 0 HIADHN COc1ccc(C)cc1NC(=O)CN[C@H]1CCN(C(C)C)[C@H]1c1ccc(F)c(F)c1 ZINC000549475050 941194182 /nfs/dbraw/zinc/19/41/82/941194182.db2.gz CBEMRTCSFFRRQH-CVDCTZTESA-N 0 3 417.500 4.034 20 0 HIADHN CCc1cccc(CC)c1NC(=O)CN[C@@H]1CCN(C2CC2)[C@H]1c1cccc(OC)c1 ZINC000549477369 941194653 /nfs/dbraw/zinc/19/46/53/941194653.db2.gz JQBZVLZOPNDZCB-BVAGGSTKSA-N 0 3 421.585 4.326 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@@H](NCc2cccc(NC(=O)[C@H]3CCCO3)c2)c2ccccc21 ZINC000549525017 941198048 /nfs/dbraw/zinc/19/80/48/941198048.db2.gz QCHFKOLZVGFQDU-DNVJHFABSA-N 0 3 422.525 4.076 20 0 HIADHN C[C@H](c1ccc(F)cc1)N1CC[C@H](N[C@@H]2CCO[C@@H]2c2ccc(Cl)cc2)C1=O ZINC000549609840 941201241 /nfs/dbraw/zinc/20/12/41/941201241.db2.gz BZQYOMFSEMHPKU-MSPZUWAUSA-N 0 3 402.897 4.261 20 0 HIADHN C[C@H](NCc1coc(-c2c(F)cccc2F)n1)C1CCN(CC(F)(F)F)CC1 ZINC000549692669 941204793 /nfs/dbraw/zinc/20/47/93/941204793.db2.gz IFFGJZBNVFSBIG-LBPRGKRZSA-N 0 3 403.395 4.372 20 0 HIADHN CC[C@H](N[C@H]1CCN([C@H](C)c2ccc(F)cc2)C1=O)c1ccc(OC)c(OC)c1 ZINC000549708900 941205299 /nfs/dbraw/zinc/20/52/99/941205299.db2.gz HADSLQKCQKRZKB-XPGWFJOJSA-N 0 3 400.494 4.246 20 0 HIADHN CC(C)Cn1c([C@H](C)Oc2ccccc2F)nnc1N1CCN(C2CCCC2)CC1 ZINC000549835176 941209567 /nfs/dbraw/zinc/20/95/67/941209567.db2.gz OLVWZZGOSPVBRV-SFHVURJKSA-N 0 3 415.557 4.278 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)N[C@H]2CCN([C@@H](C)c3ccc(F)cc3)C2=O)cc1 ZINC000549927535 941240670 /nfs/dbraw/zinc/24/06/70/941240670.db2.gz AHEKOHRITJRZLD-QQMNAOGKSA-N 0 3 406.505 4.333 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)N[C@@H]2CCN([C@@H](C)c3ccc(F)cc3)C2=O)cc1 ZINC000549927531 941241002 /nfs/dbraw/zinc/24/10/02/941241002.db2.gz AHEKOHRITJRZLD-HKARXFIJSA-N 0 3 406.505 4.333 20 0 HIADHN CCOc1ccc(NC(=O)COc2ccc(CN[C@@H]3CCC[C@@H]3F)cc2OC)cc1 ZINC000549937932 941243223 /nfs/dbraw/zinc/24/32/23/941243223.db2.gz YCBIRENHMHQCEW-VQTJNVASSA-N 0 3 416.493 4.092 20 0 HIADHN CC(=O)c1ccc2c(c1)CCN(C[C@@H](O)CO[C@H](C)c1ccc(Cl)cc1)CC2 ZINC000549970626 941254747 /nfs/dbraw/zinc/25/47/47/941254747.db2.gz JPXURRLWAGICPC-UZUQRXQVSA-N 0 3 401.934 4.082 20 0 HIADHN CC(C)[C@](C)(Cc1ccc(Cl)cc1)NCc1csc(CS(C)(=O)=O)n1 ZINC000549988310 941260259 /nfs/dbraw/zinc/26/02/59/941260259.db2.gz QXGXVLHTXYUURC-SFHVURJKSA-N 0 3 400.997 4.088 20 0 HIADHN CC[C@@H]1CN(c2nnc(C3CCC3)n2C[C@@H]2CCCCO2)CCN1Cc1ccccc1 ZINC000550055921 941275294 /nfs/dbraw/zinc/27/52/94/941275294.db2.gz DWRSQRLOYJIBFZ-PKTZIBPZSA-N 0 3 423.605 4.216 20 0 HIADHN COc1ccc(F)c(CNC[C@@H](c2ccc(C(F)(F)F)cc2)N2CCOCC2)c1 ZINC000550122323 941286950 /nfs/dbraw/zinc/28/69/50/941286950.db2.gz GMMNLLCKUXTANV-FQEVSTJZSA-N 0 3 412.427 4.016 20 0 HIADHN CN(C)[C@@H](CNC(=O)c1cc(CNC(=O)C(C)(C)C)ccc1Cl)c1ccccc1 ZINC000550266624 941306237 /nfs/dbraw/zinc/30/62/37/941306237.db2.gz HHTHFXMOSQVNBV-FQEVSTJZSA-N 0 3 415.965 4.035 20 0 HIADHN CN(c1nc(CNC2(Cc3ccc(F)cc3Cl)CCOCC2)cs1)C1CC1 ZINC000550409892 941323393 /nfs/dbraw/zinc/32/33/93/941323393.db2.gz FGDYLJCQYLYFPU-UHFFFAOYSA-N 0 3 409.958 4.416 20 0 HIADHN CC(C)[C@@]1(CO)CCCN([C@H](C)C(=O)N[C@@H](C)c2ccc(Cl)cc2Cl)C1 ZINC000550433752 941326599 /nfs/dbraw/zinc/32/65/99/941326599.db2.gz UHACBEVSMMLGJY-MDOVXXIYSA-N 0 3 401.378 4.290 20 0 HIADHN C/C=C\c1ccc(OC[C@@H](O)CNCc2cc(F)cc(Br)c2)c(OC)c1 ZINC000550624279 941346971 /nfs/dbraw/zinc/34/69/71/941346971.db2.gz NDRJBSUVXMCXLC-JXCVUKRWSA-N 0 3 424.310 4.159 20 0 HIADHN CN(C)[C@@H](CNC(=O)c1cc(Cl)cc(F)c1Br)Cc1ccccc1 ZINC000550650697 941350390 /nfs/dbraw/zinc/35/03/90/941350390.db2.gz UWSKNACZKBIAGR-CQSZACIVSA-N 0 3 413.718 4.144 20 0 HIADHN CC(C)(C)CCN1CCN(CC(=O)Nc2ccc3c(c2)OC2(CCCCC2)O3)CC1 ZINC000550842407 941373055 /nfs/dbraw/zinc/37/30/55/941373055.db2.gz HCNRMVLUHPOTOH-UHFFFAOYSA-N 0 3 415.578 4.111 20 0 HIADHN Brc1ccc2c(c1)OCCC[C@@H]2NCc1cccc(N2CCOCC2)c1 ZINC000550857112 941374912 /nfs/dbraw/zinc/37/49/12/941374912.db2.gz OAKGKRQNGFFIQP-FQEVSTJZSA-N 0 3 417.347 4.289 20 0 HIADHN CC(C)(CN[C@@H](c1nnc[nH]1)c1ccc(F)cc1)c1ccccc1Br ZINC000551085681 941406762 /nfs/dbraw/zinc/40/67/62/941406762.db2.gz FRUDEJMHWOFQHB-QGZVFWFLSA-N 0 3 403.299 4.363 20 0 HIADHN COc1cc(Br)ccc1CCCN[C@@H](c1nnc[nH]1)c1ccc(F)cc1 ZINC000551165954 941420792 /nfs/dbraw/zinc/42/07/92/941420792.db2.gz TZTNGNFWNXLMLO-GOSISDBHSA-N 0 3 419.298 4.027 20 0 HIADHN O=C(c1ccccc1F)N1CCC(NCc2c(F)cccc2OC(F)(F)F)CC1 ZINC000551224826 941430955 /nfs/dbraw/zinc/43/09/55/941430955.db2.gz IWVOFDDXLPGQJN-UHFFFAOYSA-N 0 3 414.374 4.258 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCC(CC(F)(F)F)CC1)c1cccc(OC)c1 ZINC000551269476 941440344 /nfs/dbraw/zinc/44/03/44/941440344.db2.gz SBXUOAFXAMBSLU-LJQANCHMSA-N 0 3 415.500 4.452 20 0 HIADHN CCc1nc(C)c(C(=O)NC[C@@H]2CCCN(C)[C@@H]2c2ccc(C(F)(F)F)cc2)o1 ZINC000551289674 941444479 /nfs/dbraw/zinc/44/44/79/941444479.db2.gz TZUFQZNEGYNXBW-MAUKXSAKSA-N 0 3 409.452 4.377 20 0 HIADHN COc1ccc2ccc(C(=O)N3CCC(CCN4C[C@@H](C)O[C@@H](C)C4)CC3)cc2c1 ZINC000551464985 941484774 /nfs/dbraw/zinc/48/47/74/941484774.db2.gz RCCPUTGZCUQZHI-KDURUIRLSA-N 0 3 410.558 4.200 20 0 HIADHN COc1cccc(C(=O)CCCC(=O)N[C@H]2CCN(Cc3ccccc3)[C@H](C)C2)c1 ZINC000551468774 941485743 /nfs/dbraw/zinc/48/57/43/941485743.db2.gz KLJZYASWCQYDFC-KNQAVFIVSA-N 0 3 408.542 4.218 20 0 HIADHN CC[C@H](N[C@H](C)c1cnc(OC)c(Cl)c1)[C@@H]1CN(Cc2ccccc2)CCO1 ZINC000551533694 941496359 /nfs/dbraw/zinc/49/63/59/941496359.db2.gz NBALLTAVYLZHRO-CZAAIQMYSA-N 0 3 403.954 4.074 20 0 HIADHN COc1ccc([C@H](NCc2cccc(N3C(=O)N[C@@](C)(C4CC4)C3=O)c2)C(C)C)cc1 ZINC000551562953 941501933 /nfs/dbraw/zinc/50/19/33/941501933.db2.gz CZUPXNZBSMZBLD-RDGATRHJSA-N 0 3 421.541 4.407 20 0 HIADHN COc1ccc([C@@H](NCc2cccc(N3C(=O)N[C@@](C)(C4CC4)C3=O)c2)C(C)C)cc1 ZINC000551562951 941502065 /nfs/dbraw/zinc/50/20/65/941502065.db2.gz CZUPXNZBSMZBLD-DHLKQENFSA-N 0 3 421.541 4.407 20 0 HIADHN C[C@H](NCc1cccc(I)c1)c1ccc2c(c1)CCC(=O)N2 ZINC000551575761 941505500 /nfs/dbraw/zinc/50/55/00/941505500.db2.gz NQTONRZGXTYRCC-LBPRGKRZSA-N 0 3 406.267 4.027 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CCC(F)(c2cccnc2)CC1)c1ccsc1 ZINC000551617032 941513016 /nfs/dbraw/zinc/51/30/16/941513016.db2.gz KJJZFYZCBGYAQQ-IBGZPJMESA-N 0 3 404.555 4.196 20 0 HIADHN COc1ccc([C@@H](NCCn2cc(C)cn2)c2ccccc2)cc1Br ZINC000551699114 941528835 /nfs/dbraw/zinc/52/88/35/941528835.db2.gz LIAIOXQBTQKTDS-FQEVSTJZSA-N 0 3 400.320 4.342 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)[C@H]1CCc2cccc(O)c21 ZINC000551704903 941530212 /nfs/dbraw/zinc/53/02/12/941530212.db2.gz FZDNPRZKURWHMS-RTWAWAEBSA-N 0 3 416.525 4.013 20 0 HIADHN Cc1nc([C@H]2CCCOC2)sc1C(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000551740946 941536462 /nfs/dbraw/zinc/53/64/62/941536462.db2.gz ZQOCTVZZGVPLIV-IBGZPJMESA-N 0 3 413.587 4.082 20 0 HIADHN COc1ccc([C@@H](NCc2cc(C(F)(F)F)cc(S(C)(=O)=O)c2)C2CC2)cc1 ZINC000551778562 941543620 /nfs/dbraw/zinc/54/36/20/941543620.db2.gz CSZUNGQTPZJBRF-IBGZPJMESA-N 0 3 413.461 4.358 20 0 HIADHN CCOc1cc(CN(Cc2ccccc2C)C2CC2)ccc1O[C@H](C)C(=O)N(C)C ZINC000551930987 941562600 /nfs/dbraw/zinc/56/26/00/941562600.db2.gz VTRLSBXXXFCAJN-LJQANCHMSA-N 0 3 410.558 4.414 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccc(O)cc1)C(=O)c1sc(C(C)C)nc1C ZINC000551987596 941564615 /nfs/dbraw/zinc/56/46/15/941564615.db2.gz HLHSADWEOCXZSO-SFHVURJKSA-N 0 3 401.576 4.407 20 0 HIADHN Cc1c([C@H](C)NCCn2cc(Br)cn2)cnn1-c1cc(C)ccc1C ZINC000552096808 941584033 /nfs/dbraw/zinc/58/40/33/941584033.db2.gz LBSCEDLNDAJEQD-HNNXBMFYSA-N 0 3 402.340 4.107 20 0 HIADHN COC(=O)c1csc([C@H](C)N[C@H](C)CC(=O)Nc2cccc(N3CCCC3)c2)c1 ZINC000552247321 941613395 /nfs/dbraw/zinc/61/33/95/941613395.db2.gz KMGYPZAXJXTHQK-CVEARBPZSA-N 0 3 415.559 4.203 20 0 HIADHN Clc1ccc([C@@H](CN[C@H](c2ncc[nH]2)C2CCCCC2)N2CCOCC2)cc1 ZINC000552248459 941613458 /nfs/dbraw/zinc/61/34/58/941613458.db2.gz HULZMNSFVFKFPJ-RTWAWAEBSA-N 0 3 402.970 4.348 20 0 HIADHN NS(=O)(=O)C[C@@H]1CCCN(Cc2ccc(-c3ccc(Cl)c(Cl)c3)s2)C1 ZINC000552256527 941615125 /nfs/dbraw/zinc/61/51/25/941615125.db2.gz PARBUMRATZBVSK-GFCCVEGCSA-N 0 3 419.399 4.222 20 0 HIADHN COc1ccc2nc(C3CC3)cc(C(=O)N(C)CCCN(C)Cc3ccncc3)c2c1 ZINC000552360526 941644327 /nfs/dbraw/zinc/64/43/27/941644327.db2.gz JGUGQTSTDNAXSJ-UHFFFAOYSA-N 0 3 418.541 4.110 20 0 HIADHN Cc1cc(OCCCC(=O)Nc2cccc(CN3CC[C@@H](O)C3)c2)ccc1Cl ZINC000552516213 941692650 /nfs/dbraw/zinc/69/26/50/941692650.db2.gz LSPYYPZBZFKDAA-LJQANCHMSA-N 0 3 402.922 4.013 20 0 HIADHN CCOc1cc(C[NH2+]CCCc2ccc(OC)c(OC)c2)cc(Br)c1[O-] ZINC000552668852 941732866 /nfs/dbraw/zinc/73/28/66/941732866.db2.gz JGKNBTXLXSZORG-UHFFFAOYSA-N 0 3 424.335 4.293 20 0 HIADHN O=C(Cc1ccccc1O)N(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000552851269 941787551 /nfs/dbraw/zinc/78/75/51/941787551.db2.gz RFHPSEZRUKNDPN-DEOSSOPVSA-N 0 3 415.537 4.023 20 0 HIADHN Cc1c(Br)cccc1CN[C@@H](C)c1cccc(N2CCCS2(=O)=O)c1 ZINC000552920361 941802905 /nfs/dbraw/zinc/80/29/05/941802905.db2.gz SYBLOGOBROHKSY-HNNXBMFYSA-N 0 3 423.376 4.148 20 0 HIADHN CCCN(CCN1CCCC1)C(=O)c1cc(-c2ccco2)nc2c1cnn2C(C)C ZINC000553055257 941825415 /nfs/dbraw/zinc/82/54/15/941825415.db2.gz AKSNETNVCRPWOU-UHFFFAOYSA-N 0 3 409.534 4.220 20 0 HIADHN COc1ccc(C(=O)C[C@H](C)C(=O)N2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)cc1 ZINC000553176121 941845200 /nfs/dbraw/zinc/84/52/00/941845200.db2.gz RPWFNZXMXPRNBY-RXFWQSSRSA-N 0 3 420.553 4.029 20 0 HIADHN Cc1cc(Cl)ccc1NC(=O)[C@H](C)N[C@@H](c1ccc2c(c1)OCCO2)C1CC1 ZINC000553315087 941866540 /nfs/dbraw/zinc/86/65/40/941866540.db2.gz PAZCEMRBSIYJJB-LHSJRXKWSA-N 0 3 400.906 4.488 20 0 HIADHN CCOC1CC2(C1)CCN(C(=O)NC[C@H](c1cccs1)N1CCC(C)CC1)C2 ZINC000553363413 941873049 /nfs/dbraw/zinc/87/30/49/941873049.db2.gz ICCNUZVMWVDWEN-GSVIPDFHSA-N 0 3 405.608 4.122 20 0 HIADHN C[C@H]1CN(C(=O)c2cccc(CN(C)C)c2)C[C@@H](c2cccc(C(F)(F)F)c2)O1 ZINC000553382884 941877151 /nfs/dbraw/zinc/87/71/51/941877151.db2.gz XHCCLORRQQRBKP-YWZLYKJASA-N 0 3 406.448 4.369 20 0 HIADHN COc1ccccc1[C@H]1C[C@@H](C)CCN1C(=O)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000553488943 941894856 /nfs/dbraw/zinc/89/48/56/941894856.db2.gz IEQWLLVQPSKKPB-XKCSPQBFSA-N 0 3 407.558 4.302 20 0 HIADHN C[C@@H](CC(=O)N1CCC[C@H](c2n[nH]cc2CN2CCCC2)C1)Cc1cccc(F)c1 ZINC000553513923 941900197 /nfs/dbraw/zinc/90/01/97/941900197.db2.gz ZHXLFHBJXOYPBL-QUCCMNQESA-N 0 3 412.553 4.120 20 0 HIADHN C[C@@H]1C[C@@H]1[C@H](NCC(=O)NC[C@H]1CCN(c2ccccc2)C1)c1ccc(Cl)cc1 ZINC000553622046 941922597 /nfs/dbraw/zinc/92/25/97/941922597.db2.gz QLTMMSBZXRTRJT-ITJSVJTHSA-N 0 3 411.977 4.269 20 0 HIADHN COc1ccc([C@@H](CNC(=O)[C@H](C)Cc2cncc3ccccc32)N2CCCC2)cc1 ZINC000553626274 941924792 /nfs/dbraw/zinc/92/47/92/941924792.db2.gz VNLXHXGJWCEVRZ-KBMIEXCESA-N 0 3 417.553 4.375 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)Cc2ccccc2OC(F)F)N(C)C)cc1 ZINC000553670813 941941048 /nfs/dbraw/zinc/94/10/48/941941048.db2.gz GLAXQTKAAPRPRA-IBGZPJMESA-N 0 3 406.473 4.037 20 0 HIADHN CC[C@@H](NC(=O)N[C@H](CN1CCCC1)c1ccccc1)c1ccc(OC)c(OC)c1 ZINC000553734419 941954788 /nfs/dbraw/zinc/95/47/88/941954788.db2.gz YFTHGOXWDLFULO-NHCUHLMSSA-N 0 3 411.546 4.291 20 0 HIADHN CC(C)Cc1ccc([C@@H](CNC(=O)CCc2nc(C3CCCC3)no2)N(C)C)cc1 ZINC000553742267 941956837 /nfs/dbraw/zinc/95/68/37/941956837.db2.gz KYRHNCVFJMFBCQ-OAQYLSRUSA-N 0 3 412.578 4.277 20 0 HIADHN Cc1nn(-c2ccccc2C)c2sc(C(=O)N3CC[C@@H](N4CCCC4)[C@H]3C)cc12 ZINC000553774394 941964699 /nfs/dbraw/zinc/96/46/99/941964699.db2.gz KZMAKQMFVUWPAJ-YLJYHZDGSA-N 0 3 408.571 4.403 20 0 HIADHN C[C@H]1C[C@H]1N1CCN(C(=O)c2cc(Cl)cc(Br)c2F)C[C@@H](C)C1 ZINC000553782960 941967868 /nfs/dbraw/zinc/96/78/68/941967868.db2.gz GAQFORVOSUGXMY-ZIBATOQPSA-N 0 3 403.723 4.044 20 0 HIADHN CCN(CCN1CCCCCC1)C(=O)c1cn(CC)c2ccc(Cl)cc2c1=O ZINC000553801335 941972566 /nfs/dbraw/zinc/97/25/66/941972566.db2.gz GKTSGZWTTBIAHN-UHFFFAOYSA-N 0 3 403.954 4.013 20 0 HIADHN Cc1cc(C(=O)NC(C)C)ccc1NC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000553805741 941972967 /nfs/dbraw/zinc/97/29/67/941972967.db2.gz BPVWKBWKHGJVFG-HXUWFJFHSA-N 0 3 411.521 4.123 20 0 HIADHN OC[C@H](NC[C@H](O)Cc1cccc(Cl)c1)c1ccc(Cl)cc1C(F)(F)F ZINC000553893593 941992023 /nfs/dbraw/zinc/99/20/23/941992023.db2.gz AGCLUQPKPRSTKD-PBHICJAKSA-N 0 3 408.247 4.239 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)[C@@H]2C[C@H]2c2c(F)cccc2F)N(C)C)cc1 ZINC000554011488 942018808 /nfs/dbraw/zinc/01/88/08/942018808.db2.gz DQNCNYGMNKFLLY-OPYAIIAOSA-N 0 3 402.485 4.275 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)[C@@H]2C[C@@H]2c2ccc(F)cc2F)N(C)C)cc1 ZINC000554015325 942018982 /nfs/dbraw/zinc/01/89/82/942018982.db2.gz MSDCLYJGMVPGCJ-SJBKTWHCSA-N 0 3 402.485 4.275 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)c2cccc([C@H]3CCCOC3)c2)N(C)C)cc1 ZINC000554012830 942019408 /nfs/dbraw/zinc/01/94/08/942019408.db2.gz QKOWCDVUHJBQSP-LADGPHEKSA-N 0 3 410.558 4.401 20 0 HIADHN Cc1ccc(-c2cc(C(=O)N(C)[C@H]3CN4CCC3CC4)c3cnn(C(C)C)c3n2)s1 ZINC000554017736 942020429 /nfs/dbraw/zinc/02/04/29/942020429.db2.gz STMXATVTOFZUJW-FQEVSTJZSA-N 0 3 423.586 4.215 20 0 HIADHN CCOc1cc2c(cc1NC(=O)NC[C@H](N[C@H](C)CC)c1ccco1)O[C@H](C)C2 ZINC000554068049 942028968 /nfs/dbraw/zinc/02/89/68/942028968.db2.gz SFMGQVUUXJQJSO-RKVPGOIHSA-N 0 3 401.507 4.253 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](NC[C@@H]2CCCSC2)c2ccc(F)c(F)c2)c1 ZINC000554068435 942029093 /nfs/dbraw/zinc/02/90/93/942029093.db2.gz COTUSWMMFVOFAY-VBKZILBWSA-N 0 3 411.539 4.191 20 0 HIADHN C[C@@H](NC(=O)Nc1ccccc1C(=O)N1CCCCC1)[C@H](c1ccccc1)N(C)C ZINC000554111764 942038642 /nfs/dbraw/zinc/03/86/42/942038642.db2.gz BKVOSMVERCKRAI-XMSQKQJNSA-N 0 3 408.546 4.126 20 0 HIADHN CC(C)n1c2ccc(C(=O)N3CCN([C@@H]4C[C@@H]4C)C[C@H](C)C3)cc2nc1C(F)(F)F ZINC000554113209 942039400 /nfs/dbraw/zinc/03/94/00/942039400.db2.gz KDCXOOOSMWKTOO-YZVOILCLSA-N 0 3 422.495 4.438 20 0 HIADHN C[C@@H](NC[C@@H](CO)c1cccnc1)c1ccc(Br)cc1Br ZINC000554116828 942040562 /nfs/dbraw/zinc/04/05/62/942040562.db2.gz XEGHZFOHZAAJSZ-YPMHNXCESA-N 0 3 414.141 4.033 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)N[C@H](CN(C)C)c2ccc(F)cc2)c(C)c1 ZINC000554162323 942053100 /nfs/dbraw/zinc/05/31/00/942053100.db2.gz QSQDDRCCERHOEK-HRAATJIYSA-N 0 3 414.525 4.087 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)Nc1ccc(C)cc1OC[C@@H]1CCCO1 ZINC000554180323 942059662 /nfs/dbraw/zinc/05/96/62/942059662.db2.gz WXFMZPNPXPFVDR-FQEVSTJZSA-N 0 3 403.567 4.283 20 0 HIADHN CN(C)C[C@@H](NC(=O)Nc1ccccc1OC[C@@H]1CCCCO1)c1ccc(F)cc1 ZINC000554192163 942063572 /nfs/dbraw/zinc/06/35/72/942063572.db2.gz WRWKQBMIBHENOZ-PZJWPPBQSA-N 0 3 415.509 4.198 20 0 HIADHN CN(C)C[C@@H](NC(=O)Nc1ccc(F)cc1OCC(F)(F)F)c1ccc(F)cc1 ZINC000554205539 942066030 /nfs/dbraw/zinc/06/60/30/942066030.db2.gz NURFHNDFQKREOQ-MRXNPFEDSA-N 0 3 417.378 4.330 20 0 HIADHN Cc1cc(OC[C@@H](O)CN2CC[C@@H](OCc3ccncc3)C2)c(C(C)C)cc1Cl ZINC000554248146 942077434 /nfs/dbraw/zinc/07/74/34/942077434.db2.gz SCWMMWSAVYQTHL-VQTJNVASSA-N 0 3 418.965 4.198 20 0 HIADHN C[C@@H](NC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C)c1nccn1-c1ccccc1 ZINC000554333677 942106484 /nfs/dbraw/zinc/10/64/84/942106484.db2.gz UIBOCZBYRKKTOF-NHCUHLMSSA-N 0 3 417.557 4.239 20 0 HIADHN O=C(CCC(F)(F)F)N1CCC[C@@H](N[C@H]2CCCOc3c(Cl)cccc32)C1 ZINC000554376076 942117752 /nfs/dbraw/zinc/11/77/52/942117752.db2.gz DWDWZZMNVFFHLD-CJNGLKHVSA-N 0 3 404.860 4.477 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)Nc1cc(N2CCCC2=O)ccc1Cl ZINC000554381443 942119972 /nfs/dbraw/zinc/11/99/72/942119972.db2.gz KDTRSBLCQNWUMM-UHFFFAOYSA-N 0 3 406.958 4.197 20 0 HIADHN OC[C@H](CN[C@H](c1cccc(F)c1)c1cccc(Br)c1)c1cccnc1 ZINC000554404492 942129359 /nfs/dbraw/zinc/12/93/59/942129359.db2.gz ZZBSIXRSAOYQQW-RXVVDRJESA-N 0 3 415.306 4.438 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)Nc1cccc(C(=O)N2CCCCC2)c1)c1ccco1 ZINC000554418575 942134883 /nfs/dbraw/zinc/13/48/83/942134883.db2.gz BQMHXLBGWHHTGC-XLIONFOSSA-N 0 3 412.534 4.157 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)Nc1ccc(C(=O)NCC(C)C)cc1C ZINC000554427261 942139922 /nfs/dbraw/zinc/13/99/22/942139922.db2.gz QPSLOCJWOMEJRU-UHFFFAOYSA-N 0 3 402.583 4.111 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1ccc(N2CCSCC2)cc1C)c1ccco1 ZINC000554428745 942140137 /nfs/dbraw/zinc/14/01/37/942140137.db2.gz ZWVNWRMSFYYUKL-PXNSSMCTSA-N 0 3 416.591 4.392 20 0 HIADHN CC(C)c1noc(-c2ccc(NC(=O)N[C@H](CN(C)C)c3ccc(F)cc3)cc2)n1 ZINC000554460744 942151662 /nfs/dbraw/zinc/15/16/62/942151662.db2.gz AIWQHSSUKGMDMU-LJQANCHMSA-N 0 3 411.481 4.424 20 0 HIADHN Cc1nc(-c2ccc(C(=O)NC[C@H](c3ccc(CC(C)C)cc3)N(C)C)cc2)n[nH]1 ZINC000554663915 942192727 /nfs/dbraw/zinc/19/27/27/942192727.db2.gz OVCFSDKEBYOQNI-JOCHJYFZSA-N 0 3 405.546 4.011 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)c1cccc(NC(=O)c2cccs2)c1 ZINC000554724177 942212384 /nfs/dbraw/zinc/21/23/84/942212384.db2.gz LVPFVRNMWPGPLC-QGZVFWFLSA-N 0 3 407.539 4.251 20 0 HIADHN COc1ccc(NC(=O)N[C@H]2CCN(Cc3ccccc3)[C@H]2C)c(Br)c1 ZINC000554748865 942219655 /nfs/dbraw/zinc/21/96/55/942219655.db2.gz LEENRRPUKAZNPL-KSSFIOAISA-N 0 3 418.335 4.242 20 0 HIADHN CCCN(C(=O)NCc1nc2ccccc2n1C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000554813680 942256946 /nfs/dbraw/zinc/25/69/46/942256946.db2.gz ZFBFPDAYFCOQPM-OAQYLSRUSA-N 0 3 419.573 4.160 20 0 HIADHN CC1(C)C[N@H+](Cc2ccccc2)CC[C@@H]1NCc1nc2c3ccccc3oc2c(=O)[n-]1 ZINC000554840104 942278403 /nfs/dbraw/zinc/27/84/03/942278403.db2.gz PELHFHLCTVUMMW-FQEVSTJZSA-N 0 3 416.525 4.472 20 0 HIADHN CC1(C)C[N@@H+](Cc2ccccc2)CC[C@@H]1NCc1nc2c3ccccc3oc2c(=O)[n-]1 ZINC000554840104 942278418 /nfs/dbraw/zinc/27/84/18/942278418.db2.gz PELHFHLCTVUMMW-FQEVSTJZSA-N 0 3 416.525 4.472 20 0 HIADHN Cc1cc(NC(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)n(Cc2ccccc2)n1 ZINC000554895065 942310846 /nfs/dbraw/zinc/31/08/46/942310846.db2.gz JVLQVOPOSYDROF-FQEVSTJZSA-N 0 3 411.937 4.318 20 0 HIADHN CSc1ccc(NC(=O)CN[C@@H]2CCN(C)[C@H]2c2ccc(Cl)c(F)c2)cc1 ZINC000554954274 942331823 /nfs/dbraw/zinc/33/18/23/942331823.db2.gz MLVUJESELJDHMC-QUCCMNQESA-N 0 3 407.942 4.175 20 0 HIADHN Cc1ccc([C@H](OC[C@H](O)CN2CC3(CCC3)[C@@H]2[C@@H]2CCCO2)c2ccccc2)cc1 ZINC000554959861 942333964 /nfs/dbraw/zinc/33/39/64/942333964.db2.gz JJVVKNHYTVYOAS-ZJSPYRCASA-N 0 3 421.581 4.495 20 0 HIADHN Brc1ccc2ncc(CN[C@H]3c4ccccc4CC34CCOCC4)n2c1 ZINC000554982078 942341719 /nfs/dbraw/zinc/34/17/19/942341719.db2.gz MDJQMTZDYOPGPI-FQEVSTJZSA-N 0 3 412.331 4.281 20 0 HIADHN CCN1CC[C@H](NC(=O)c2cccc3nc(C)[nH]c32)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000555011880 942356062 /nfs/dbraw/zinc/35/60/62/942356062.db2.gz UZWLPZRJICMVKD-ICSRJNTNSA-N 0 3 400.885 4.229 20 0 HIADHN Cn1nccc1C1C[C@H]2CC[C@@H](C1)N2[C@@H]1CCN(c2ccc(Cl)cc2Cl)C1=O ZINC000555074239 942377438 /nfs/dbraw/zinc/37/74/38/942377438.db2.gz NSLLBFMSJZXCNE-SOJLYPPLSA-N 0 3 419.356 4.243 20 0 HIADHN CCN1CC[C@H](N[C@H](C)C(=O)Nc2ccc(OC)cc2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000555125029 942392061 /nfs/dbraw/zinc/39/20/61/942392061.db2.gz BFMMRLCPZXFDRF-PUCZYUMASA-N 0 3 419.928 4.240 20 0 HIADHN CCN1CC[C@@H](NCC(=O)Nc2ccc(F)cc2F)[C@H]1c1ccc(Cl)c(F)c1 ZINC000555124756 942392156 /nfs/dbraw/zinc/39/21/56/942392156.db2.gz AWROAQYGDSXGJG-UYAOXDASSA-N 0 3 411.855 4.121 20 0 HIADHN COC(=O)c1cccc(CN[C@H]2CCN(C(C)(C)C)[C@H]2c2ccc(Cl)c(F)c2)n1 ZINC000555127117 942394314 /nfs/dbraw/zinc/39/43/14/942394314.db2.gz AMOVQDYTVNAAGF-ICSRJNTNSA-N 0 3 419.928 4.364 20 0 HIADHN CCN1CC[C@@H](NCC(=O)Nc2cc(C)ccc2C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000555132446 942396281 /nfs/dbraw/zinc/39/62/81/942396281.db2.gz ISPKUBRYHFPAJD-DENIHFKCSA-N 0 3 403.929 4.460 20 0 HIADHN C[C@@H]1C[C@@H](C(=O)N(Cc2ccccc2Br)C2CCN(C)CC2)C[C@H](C)O1 ZINC000555162366 942411577 /nfs/dbraw/zinc/41/15/77/942411577.db2.gz JGWRXRZAKJQPSH-ALXJQNPVSA-N 0 3 423.395 4.076 20 0 HIADHN Cc1ccc(Br)cc1-c1nnc(N2CC[C@@]3(C2)CCCN(C)C3)s1 ZINC000555206861 942431795 /nfs/dbraw/zinc/43/17/95/942431795.db2.gz XSWSLDCLLHFKTL-SFHVURJKSA-N 0 3 407.381 4.198 20 0 HIADHN CN(C)C[C@H](NC(=O)CCn1c2ccccc2nc1C1CC1)c1ccc(Cl)cc1 ZINC000555231389 942438523 /nfs/dbraw/zinc/43/85/23/942438523.db2.gz RDKSWTCNPYBPLM-FQEVSTJZSA-N 0 3 410.949 4.376 20 0 HIADHN CCc1nc2cc(CN[C@H](CN3CCOCC3)c3ccccc3C)ccc2n1C1CC1 ZINC000555232793 942438904 /nfs/dbraw/zinc/43/89/04/942438904.db2.gz MKYPCLVIENQTOH-XMMPIXPASA-N 0 3 418.585 4.405 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@@H](N[C@@H](Cn2ccccc2=O)c2ccccc2)c2ccccc21 ZINC000555236104 942440635 /nfs/dbraw/zinc/44/06/35/942440635.db2.gz QWOFMHXBRYKINB-SMIHKQSGSA-N 0 3 416.521 4.361 20 0 HIADHN CO[C@@H](C)CCNC(=O)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000555276189 942459671 /nfs/dbraw/zinc/45/96/71/942459671.db2.gz GAFANEYIWRTQPB-HNNXBMFYSA-N 0 3 402.366 4.026 20 0 HIADHN CN(C)Cc1cccc(NC(=O)C2CCN(c3noc4ccc(Cl)cc43)CC2)c1 ZINC000555285529 942462802 /nfs/dbraw/zinc/46/28/02/942462802.db2.gz OTYITTDTDMMVPL-UHFFFAOYSA-N 0 3 412.921 4.398 20 0 HIADHN CC(C)[C@@H](NCC(=O)Nc1nc(CN2CCC(C)CC2)cs1)c1ccccc1 ZINC000555369477 942499324 /nfs/dbraw/zinc/49/93/24/942499324.db2.gz NYBLNBLUUADMPP-OAQYLSRUSA-N 0 3 400.592 4.300 20 0 HIADHN CC(C)C1CCC(N2CCN([C@@H]3CCN([C@@H](C)c4ccc(F)cc4)C3=O)CC2)CC1 ZINC000555379620 942504127 /nfs/dbraw/zinc/50/41/27/942504127.db2.gz BEHCLAIHUFWORZ-HVSOUCNWSA-N 0 3 415.597 4.320 20 0 HIADHN CC(C)c1nnc(N2CCN(Cc3cccc4ccccc43)CC2)n1C[C@H]1CCCO1 ZINC000555386168 942506810 /nfs/dbraw/zinc/50/68/10/942506810.db2.gz MNOIOTRLNWKSHZ-JOCHJYFZSA-N 0 3 419.573 4.056 20 0 HIADHN O=C(CN1CCN(C2CCCC2)CC1)N1CCC[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000555422232 942525588 /nfs/dbraw/zinc/52/55/88/942525588.db2.gz OKHHZYDSPNBSJP-FQEVSTJZSA-N 0 3 410.389 4.217 20 0 HIADHN CCC[C@H](NCc1ccc(OC(F)(F)F)cc1)C(=O)N1CCc2sccc2C1 ZINC000555779329 942729902 /nfs/dbraw/zinc/72/99/02/942729902.db2.gz SENJHUXXSNQQLZ-KRWDZBQOSA-N 0 3 412.477 4.490 20 0 HIADHN CC(C)CN(C(=O)c1cc(Cl)cc(F)c1Br)C1CCN(C)CC1 ZINC000555866912 942758419 /nfs/dbraw/zinc/75/84/19/942758419.db2.gz MOGNRXLBCIFXMK-UHFFFAOYSA-N 0 3 405.739 4.434 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCCC1)c1cccc(F)c1Br ZINC000556081101 942802625 /nfs/dbraw/zinc/80/26/25/942802625.db2.gz NRJYIOWWQYEYOP-UHFFFAOYSA-N 0 3 415.372 4.070 20 0 HIADHN Brc1ccc(C2(CN[C@@H](c3cccs3)c3nnc[nH]3)CCC2)s1 ZINC000556194217 942817242 /nfs/dbraw/zinc/81/72/42/942817242.db2.gz WAGHBEUECRTJNK-AWEZNQCLSA-N 0 3 409.378 4.491 20 0 HIADHN Brc1cccc2c1OCCC[C@H]2NCc1cccc(N2CCOCC2)c1 ZINC000556217559 942820318 /nfs/dbraw/zinc/82/03/18/942820318.db2.gz NABPBMWDMGGIII-HXUWFJFHSA-N 0 3 417.347 4.289 20 0 HIADHN CN(C)Cc1ccc(S(=O)(=O)N2CCSc3ccc(C(F)(F)F)cc32)cc1 ZINC000556303730 942836637 /nfs/dbraw/zinc/83/66/37/942836637.db2.gz XCHXISDICBQAQE-UHFFFAOYSA-N 0 3 416.490 4.068 20 0 HIADHN C(=Cc1ccccc1)c1nc(SC[C@@H]2CN(Cc3ccccc3)CCCO2)n[nH]1 ZINC000556314621 942839450 /nfs/dbraw/zinc/83/94/50/942839450.db2.gz KZEWCWUIBCEHSD-SQZREULQSA-N 0 3 406.555 4.358 20 0 HIADHN CN(C(=O)c1ccc(NCc2ccc(F)c3cccnc23)cc1)[C@H]1CCCN(C)C1 ZINC000556336786 942844329 /nfs/dbraw/zinc/84/43/29/942844329.db2.gz DWCSCHADHRTVOM-FQEVSTJZSA-N 0 3 406.505 4.152 20 0 HIADHN C[C@@H]1CCCC[C@@H]1NC(=O)CN[C@@H](c1cccc(C(F)(F)F)c1)C1CCOCC1 ZINC000556515428 942889789 /nfs/dbraw/zinc/88/97/89/942889789.db2.gz VJSPCWRWDURWQU-MFMILTCTSA-N 0 3 412.496 4.458 20 0 HIADHN O=C(CN[C@H](c1cccc(C(F)(F)F)c1)C1CCOCC1)NCC1CCCCC1 ZINC000556516123 942889934 /nfs/dbraw/zinc/88/99/34/942889934.db2.gz XVTNKXWAZIMWQU-NRFANRHFSA-N 0 3 412.496 4.459 20 0 HIADHN CCCCOc1ccc([C@H](C)NCc2ccccc2N2CCN(C(C)=O)CC2)cc1 ZINC000556585248 942907444 /nfs/dbraw/zinc/90/74/44/942907444.db2.gz BJBNEJHJICDWQF-FQEVSTJZSA-N 0 3 409.574 4.385 20 0 HIADHN Cc1ccc(-n2cc(CN(C)CCc3cnccn3)c(-c3ccc(F)cc3)n2)cc1 ZINC000556599125 942911248 /nfs/dbraw/zinc/91/12/48/942911248.db2.gz WWEAEBFCAGJITR-UHFFFAOYSA-N 0 3 401.489 4.451 20 0 HIADHN CNC(=O)CC1CCN(Cc2cn(-c3ccc(C)cc3)nc2-c2ccc(F)cc2)CC1 ZINC000556604071 942911941 /nfs/dbraw/zinc/91/19/41/942911941.db2.gz VLIKMLQWGCVJJR-UHFFFAOYSA-N 0 3 420.532 4.335 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)Cc3coc4ccccc34)CC2)c1 ZINC000556782585 942932287 /nfs/dbraw/zinc/93/22/87/942932287.db2.gz JMNAENUZDJYMQP-UHFFFAOYSA-N 0 3 405.542 4.002 20 0 HIADHN CCN(CC)C(=O)Nc1ccc([C@H](C)NCc2ccc(C[S@](C)=O)cc2)cc1 ZINC000556897919 942957912 /nfs/dbraw/zinc/95/79/12/942957912.db2.gz CWGWRMXNPPWCJN-HPGBDJQBSA-N 0 3 401.576 4.290 20 0 HIADHN Cc1nc(-c2ccccc2F)sc1[C@@H](C)NC[C@@H](N1CCOCC1)C(F)(F)F ZINC000556924832 942968611 /nfs/dbraw/zinc/96/86/11/942968611.db2.gz WPJYCXIHFOESIZ-MLGOLLRUSA-N 0 3 417.472 4.171 20 0 HIADHN O=C(CCCn1ccc2cc(Cl)ccc21)Nc1cccc(CN2CC[C@H](O)C2)c1 ZINC000557024526 942997371 /nfs/dbraw/zinc/99/73/71/942997371.db2.gz YRICNZOEOZCGQG-NRFANRHFSA-N 0 3 411.933 4.280 20 0 HIADHN CCCCNC(=O)c1ccc(CN[C@H](C)c2ccc(NC(=O)NC3CC3)cc2)cc1 ZINC000557247394 943061409 /nfs/dbraw/zinc/06/14/09/943061409.db2.gz PLBKEXSXMPHZMW-QGZVFWFLSA-N 0 3 408.546 4.351 20 0 HIADHN O[C@H](CN[C@@H]1CCSc2c(F)cccc21)COc1ccc(Br)cc1 ZINC000557340007 943078341 /nfs/dbraw/zinc/07/83/41/943078341.db2.gz BADFHMBONINTHL-CXAGYDPISA-N 0 3 412.324 4.155 20 0 HIADHN Cc1onc(-c2ccccc2Cl)c1C(=O)Nc1cccc(CN2CC[C@@H](O)C2)c1 ZINC000557399912 943103652 /nfs/dbraw/zinc/10/36/52/943103652.db2.gz ZDQGMYONUZXPCU-QGZVFWFLSA-N 0 3 411.889 4.122 20 0 HIADHN O=C(Cc1ccccc1F)N(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000557431566 943123269 /nfs/dbraw/zinc/12/32/69/943123269.db2.gz SWHJGINPEOTREP-XMMPIXPASA-N 0 3 417.528 4.457 20 0 HIADHN C[C@@H]1C[C@@H](C(=O)N(Cc2ccncc2)[C@@H]2CCCN(Cc3ccccc3)C2)C[C@H](C)O1 ZINC000557449436 943134149 /nfs/dbraw/zinc/13/41/49/943134149.db2.gz RXVKGRCPPAQRID-RRJCBXKSSA-N 0 3 421.585 4.278 20 0 HIADHN C[C@@]1(CNCc2cnn(-c3ccc(Br)cc3)c2)OCCc2sccc21 ZINC000557528411 943192206 /nfs/dbraw/zinc/19/22/06/943192206.db2.gz AENXJJJGCZRYBV-IBGZPJMESA-N 0 3 418.360 4.274 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)c1ccc2c(C)nn(-c3ccccc3)c2n1 ZINC000557628592 943237856 /nfs/dbraw/zinc/23/78/56/943237856.db2.gz HLGGGWRMRPTJBJ-UHFFFAOYSA-N 0 3 405.546 4.067 20 0 HIADHN C[C@@H](NC(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1)c1ccc2n[nH]cc2c1 ZINC000557720187 943269455 /nfs/dbraw/zinc/26/94/55/943269455.db2.gz ODMFXASQXIVHSE-QVKFZJNVSA-N 0 3 416.447 4.195 20 0 HIADHN C[C@H]1[C@H](NC(=O)N2CCC(c3ncccc3Cl)CC2)CCN1Cc1ccccc1 ZINC000557879951 943318925 /nfs/dbraw/zinc/31/89/25/943318925.db2.gz CRGCHKOCBGUDDM-LAUBAEHRSA-N 0 3 412.965 4.287 20 0 HIADHN O=C(CCNC(=O)c1cccc(CN2CCCC2)c1)Nc1cc(Cl)cc(Cl)c1 ZINC000557896427 943323010 /nfs/dbraw/zinc/32/30/10/943323010.db2.gz QCCFCMUXGWDZSB-UHFFFAOYSA-N 0 3 420.340 4.348 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)c1cnn(-c2ccc(Cl)cc2)c1C)c1ccco1 ZINC000557912668 943327721 /nfs/dbraw/zinc/32/77/21/943327721.db2.gz WYHJGRRHYDEQLG-AUUYWEPGSA-N 0 3 400.910 4.286 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)[C@@H]2C[C@@H]2c2cccc(F)c2F)N(C)C)cc1 ZINC000557934186 943333323 /nfs/dbraw/zinc/33/33/23/943333323.db2.gz DDFZRBOKQCIFQY-SBHAEUEKSA-N 0 3 402.485 4.275 20 0 HIADHN CC(C)Cc1ccc([C@H](CNC(=O)c2csc([C@@H]3CCCO3)n2)N(C)C)cc1 ZINC000557983072 943346626 /nfs/dbraw/zinc/34/66/26/943346626.db2.gz RPZDDFSMEDEPJO-PMACEKPBSA-N 0 3 401.576 4.226 20 0 HIADHN Cc1onc(-c2c(F)cccc2Cl)c1C(=O)N1CCN([C@@H]2C[C@@H]2C)C[C@@H](C)C1 ZINC000558026654 943359523 /nfs/dbraw/zinc/35/95/23/943359523.db2.gz XRNKDNOYJCPDDH-IIYDPXPESA-N 0 3 405.901 4.245 20 0 HIADHN Cc1cccc(C(=O)N2CCN([C@@H]3C[C@@H]3C)C[C@@H](C)C2)c1NC(=O)c1ccccc1F ZINC000558026344 943360190 /nfs/dbraw/zinc/36/01/90/943360190.db2.gz WMEHHIUIAGIYDY-TVTNDZMWSA-N 0 3 423.532 4.189 20 0 HIADHN COc1cc(CN[C@@H](C)c2ccc3c(c2)CCC(=O)N3)cc(OC)c1OCC(F)F ZINC000558104439 943380349 /nfs/dbraw/zinc/38/03/49/943380349.db2.gz PIUYXBILNZJPMT-ZDUSSCGKSA-N 0 3 420.456 4.083 20 0 HIADHN O=C(Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)c1ccccc1OC1CC1 ZINC000558144983 943395655 /nfs/dbraw/zinc/39/56/55/943395655.db2.gz ANXXPTXMNIYBEQ-IBGZPJMESA-N 0 3 402.498 4.124 20 0 HIADHN OCC[C@@H](NCc1ccc(I)cc1)c1ccc(Cl)cc1 ZINC000558147124 943396398 /nfs/dbraw/zinc/39/63/98/943396398.db2.gz SZLNSTWLPHQGBJ-MRXNPFEDSA-N 0 3 401.675 4.158 20 0 HIADHN Cc1ccccc1-c1nn(-c2ccccc2)cc1C(=O)N(C)[C@H]1CCN(C2CC2)C1 ZINC000558196945 943428241 /nfs/dbraw/zinc/42/82/41/943428241.db2.gz ALNNWEUSLAPRPD-NRFANRHFSA-N 0 3 400.526 4.156 20 0 HIADHN CCSc1ccc([C@H](C)N[C@@H]2CCN(Cc3ccc(OC)cc3OC)C2=O)cc1 ZINC000558231865 943448482 /nfs/dbraw/zinc/44/84/82/943448482.db2.gz OTRTWLNCTHCTPS-HRAATJIYSA-N 0 3 414.571 4.268 20 0 HIADHN FC(F)(F)[C@@H]1C[C@H](NCc2ccc(Cl)cc2I)CCO1 ZINC000558254170 943461254 /nfs/dbraw/zinc/46/12/54/943461254.db2.gz AVGJBWABBWIDRF-PWSUYJOCSA-N 0 3 419.612 4.144 20 0 HIADHN C[C@@H](N[C@@H]1CCCN(C(=O)CCC(F)(F)F)C1)c1ccc(F)cc1OC(F)F ZINC000558255098 943462621 /nfs/dbraw/zinc/46/26/21/943462621.db2.gz MRENFXHXVPMKGR-DGCLKSJQSA-N 0 3 412.374 4.411 20 0 HIADHN Cc1cccc(C(=O)N2CCCC2)c1NC(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C ZINC000558268252 943469589 /nfs/dbraw/zinc/46/95/89/943469589.db2.gz ROSXZUBNTYSBTH-AVRDEDQJSA-N 0 3 408.546 4.044 20 0 HIADHN Cc1nc2ccccn2c1CN1CCC(O)(Cc2ccc(OC(F)(F)F)cc2)CC1 ZINC000558285857 943483966 /nfs/dbraw/zinc/48/39/66/943483966.db2.gz IKHZJAJAERNELE-UHFFFAOYSA-N 0 3 419.447 4.111 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1ccc(Cl)c(C(=O)NC2CC2)c1)c1ccco1 ZINC000558299029 943491986 /nfs/dbraw/zinc/49/19/86/943491986.db2.gz CEDDSXUABBVHIP-UGSOOPFHSA-N 0 3 418.925 4.076 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)Nc1cc(NC(=O)C(C)C)ccc1C)c1ccco1 ZINC000558310897 943498178 /nfs/dbraw/zinc/49/81/78/943498178.db2.gz GSCZVWHTQZIJOW-VQIMIIECSA-N 0 3 400.523 4.433 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)Nc1cccc(OCc2cscn2)c1 ZINC000558317767 943502991 /nfs/dbraw/zinc/50/29/91/943502991.db2.gz AQJQDGLGJPBPBQ-UHFFFAOYSA-N 0 3 402.564 4.452 20 0 HIADHN FC(F)Oc1cc(-c2noc([C@@H]3CN(Cc4ccccc4)CCC3(F)F)n2)ccn1 ZINC000558388505 943542214 /nfs/dbraw/zinc/54/22/14/943542214.db2.gz MXIAFGZRXJBWLL-HNNXBMFYSA-N 0 3 422.382 4.358 20 0 HIADHN C[C@@H](N[C@@H]1CCCC[C@H]1OC(F)F)C(=O)N(c1nccs1)C1CCCCC1 ZINC000558619057 943619088 /nfs/dbraw/zinc/61/90/88/943619088.db2.gz KMIVXFSZGNRPFG-FVQBIDKESA-N 0 3 401.523 4.337 20 0 HIADHN O[C@H](CNC[C@@H](c1ccc(Cl)cc1)N1CCc2sccc2C1)C(F)(F)F ZINC000558628624 943621503 /nfs/dbraw/zinc/62/15/03/943621503.db2.gz NMRYLTPQMFEESW-DOTOQJQBSA-N 0 3 404.885 4.014 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)NCc2cc3ccccc3s2)CC1 ZINC000558726968 943633305 /nfs/dbraw/zinc/63/33/05/943633305.db2.gz WKVKEPQRFPOQCW-UHFFFAOYSA-N 0 3 422.598 4.038 20 0 HIADHN CCN(Cc1cccc(NC(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)c1)C(C)=O ZINC000558755013 943645041 /nfs/dbraw/zinc/64/50/41/943645041.db2.gz YZTWDWNZWIHKLM-OAQYLSRUSA-N 0 3 416.953 4.133 20 0 HIADHN CC(C)n1ncc2cc(NC(=O)N[C@H](CN(C)C)c3ccc(Cl)cc3)cnc21 ZINC000558756139 943647474 /nfs/dbraw/zinc/64/74/74/943647474.db2.gz WDJRRZDWOQDPOM-GOSISDBHSA-N 0 3 400.914 4.090 20 0 HIADHN Cc1c(NC(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)noc1-c1ccccc1F ZINC000558771067 943655394 /nfs/dbraw/zinc/65/53/94/943655394.db2.gz RTBJTMTWPBZQJY-GOSISDBHSA-N 0 3 416.884 4.867 20 0 HIADHN CC(C)C(=O)c1ccc([C@@H](C)C(=O)N(CCN(C)C)Cc2ccc(F)cc2F)cc1 ZINC000558806092 943671489 /nfs/dbraw/zinc/67/14/89/943671489.db2.gz XDMSUEMWBWRWAN-QGZVFWFLSA-N 0 3 416.512 4.497 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N(C)C[C@H]2OCCc3ccccc32)N2CCCC2)cc1 ZINC000558826125 943681413 /nfs/dbraw/zinc/68/14/13/943681413.db2.gz SCBGIGKWKJWKCA-DNQXCXABSA-N 0 3 407.558 4.087 20 0 HIADHN CCn1c([C@@H](C)Oc2cccc(Cl)c2)nnc1N1CCN(C2CCCC2)CC1 ZINC000558857881 943703133 /nfs/dbraw/zinc/70/31/33/943703133.db2.gz NWHLGLTZIGFXNI-MRXNPFEDSA-N 0 3 403.958 4.156 20 0 HIADHN CN(Cc1cnn(C)c1)C(=O)CN[C@@H](c1cccc(C(F)(F)F)c1)C1CCCCC1 ZINC000558860634 943704731 /nfs/dbraw/zinc/70/47/31/943704731.db2.gz GLDNHBYYJPIRAR-OAQYLSRUSA-N 0 3 422.495 4.309 20 0 HIADHN COc1cccc([C@@H]2[C@@H](N[C@H](C)C(=O)Nc3ccc(C)c(C)c3)CCN2C2CC2)c1 ZINC000558894685 943726094 /nfs/dbraw/zinc/72/60/94/943726094.db2.gz IWFMWDZIWNSXMP-PUZWTLIVSA-N 0 3 407.558 4.207 20 0 HIADHN CN(C)C[C@H](NC(=O)N[C@H](c1nccs1)c1ccccc1)c1ccc(Cl)cc1 ZINC000558895272 943727747 /nfs/dbraw/zinc/72/77/47/943727747.db2.gz MTFLZGKICMCJCC-OALUTQOASA-N 0 3 414.962 4.488 20 0 HIADHN CC(C)N1CC[C@@H](N[C@@H](C)C(=O)Nc2cccc(F)c2)[C@@H]1c1ccc(F)c(F)c1 ZINC000558896295 943728920 /nfs/dbraw/zinc/72/89/20/943728920.db2.gz KVSVYJMSCWHAND-DLPLYFIVSA-N 0 3 405.464 4.245 20 0 HIADHN COc1cccc([C@@H]2[C@H](N[C@@H](C)C(=O)Nc3ccc(C)cc3F)CCN2C2CC2)c1 ZINC000558896429 943729493 /nfs/dbraw/zinc/72/94/93/943729493.db2.gz SRIFWXCISAGFSS-PBNUPURSSA-N 0 3 411.521 4.037 20 0 HIADHN CN(C)C[C@H](NC(=O)NC[C@@H]1CCCN(c2ccccc2)C1)c1ccc(Cl)cc1 ZINC000558950444 943768513 /nfs/dbraw/zinc/76/85/13/943768513.db2.gz OQQOESXXNFXAOJ-AVRDEDQJSA-N 0 3 414.981 4.159 20 0 HIADHN C[C@H]1C[C@H](N(C)S(=O)(=O)Cc2ccc(C(F)F)cc2)CCN1Cc1ccccc1 ZINC000559051734 943816306 /nfs/dbraw/zinc/81/63/06/943816306.db2.gz JHBVTZROGHLNNR-LAUBAEHRSA-N 0 3 422.541 4.439 20 0 HIADHN Cc1ccc(CN(CCO)Cc2ccc(Br)s2)c(-c2cnn(C)c2)c1 ZINC000559072923 943825593 /nfs/dbraw/zinc/82/55/93/943825593.db2.gz DTAZXCCRQVWBNQ-UHFFFAOYSA-N 0 3 420.376 4.214 20 0 HIADHN C[C@H](Cc1cnc2ccccc2n1)C(=O)NC[C@H](c1ccccc1)N1CCC(C)CC1 ZINC000559149897 943854571 /nfs/dbraw/zinc/85/45/71/943854571.db2.gz PXGBBUMDFVFKLK-CJFMBICVSA-N 0 3 416.569 4.398 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)c1ccc(Oc2ccccc2Cl)nc1 ZINC000559249237 943885750 /nfs/dbraw/zinc/88/57/50/943885750.db2.gz UJEIXRLRPDCFCC-IBGZPJMESA-N 0 3 423.900 4.346 20 0 HIADHN COC(=O)c1ccc(-c2nc(CNC3(Cc4cccc(F)c4)CCOCC3)co2)cc1 ZINC000559334309 943898414 /nfs/dbraw/zinc/89/84/14/943898414.db2.gz SCXLMUVZURIJMD-UHFFFAOYSA-N 0 3 424.472 4.149 20 0 HIADHN CC[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)NC1CCN(CCOC(C)C)CC1 ZINC000559557737 944003944 /nfs/dbraw/zinc/00/39/44/944003944.db2.gz BODPMWZTWNSJPZ-SFHVURJKSA-N 0 3 414.512 4.280 20 0 HIADHN CC[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)NC1CCN(CCOC(C)C)CC1 ZINC000559557733 944003956 /nfs/dbraw/zinc/00/39/56/944003956.db2.gz BODPMWZTWNSJPZ-GOSISDBHSA-N 0 3 414.512 4.280 20 0 HIADHN COc1ccc(CNC[C@@H](O)COc2cc(C)c(Cl)cc2C(C)C)cc1OC ZINC000559581282 944011204 /nfs/dbraw/zinc/01/12/04/944011204.db2.gz HACJGHVJWLMGHU-QGZVFWFLSA-N 0 3 407.938 4.319 20 0 HIADHN CC(C)(CN[C@H](c1nnc[nH]1)c1ccc(F)cc1)c1cccc(Br)c1 ZINC000559754293 944043502 /nfs/dbraw/zinc/04/35/02/944043502.db2.gz YQFJYXAGEKNLDG-KRWDZBQOSA-N 0 3 403.299 4.363 20 0 HIADHN COC(=O)CCC[C@@H]1CCC[C@H](N[C@@H](c2nc(-c3cccnc3)no2)C(C)C)C1 ZINC000559752337 944043981 /nfs/dbraw/zinc/04/39/81/944043981.db2.gz RLQGFTCQOFVREO-XKGZKEIXSA-N 0 3 400.523 4.320 20 0 HIADHN Cc1ccc(NC(=O)c2ccn(-c3ccc(Br)cc3)n2)c(CN(C)C)c1 ZINC000559824559 944060993 /nfs/dbraw/zinc/06/09/93/944060993.db2.gz OZAUCOVXEQYTPE-UHFFFAOYSA-N 0 3 413.319 4.257 20 0 HIADHN COc1ccc2ccccc2c1-c1cc(CN[C@H]2CCCC[C@@H]2N2CCOCC2)on1 ZINC000559841406 944064174 /nfs/dbraw/zinc/06/41/74/944064174.db2.gz JQZBAMGYBLMZGK-GMAHTHKFSA-N 0 3 421.541 4.236 20 0 HIADHN COCCS(=O)(=O)c1ccc(CN[C@@H](C)c2ccc(F)c3ccccc32)cc1 ZINC000559843335 944065630 /nfs/dbraw/zinc/06/56/30/944065630.db2.gz VFCINHUSMRPJRE-INIZCTEOSA-N 0 3 401.503 4.250 20 0 HIADHN COc1ccc([C@H]2CCCCCN2C(=O)CN2CCN(CCC(C)(C)C)CC2)cc1 ZINC000559869276 944071390 /nfs/dbraw/zinc/07/13/90/944071390.db2.gz ZMTZJQAMVRMRRA-HSZRJFAPSA-N 0 3 415.622 4.193 20 0 HIADHN COCCOc1ccc([C@@H](C)N[C@@H](C)c2ccc(-n3cccn3)c(F)c2)cc1OC ZINC000559897019 944078874 /nfs/dbraw/zinc/07/88/74/944078874.db2.gz FAENORYDCUGGBB-DLBZAZTESA-N 0 3 413.493 4.457 20 0 HIADHN CC(F)(F)c1ccc(C(=O)NC2CCN(CCOc3ccc(F)cc3)CC2)cc1 ZINC000559927259 944087468 /nfs/dbraw/zinc/08/74/68/944087468.db2.gz OIXFTGRROFLOSX-UHFFFAOYSA-N 0 3 406.448 4.211 20 0 HIADHN COc1ccc2ccc(-c3nc(-c4ccc(N5CCCN(C)CC5)nc4)no3)cc2c1 ZINC000559943525 944094480 /nfs/dbraw/zinc/09/44/80/944094480.db2.gz JTBQFHMDROAGSA-UHFFFAOYSA-N 0 3 415.497 4.102 20 0 HIADHN CN(Cc1cccc(Br)c1)C[C@@H](O)CO[C@H]1CCCc2ccccc21 ZINC000559958715 944099822 /nfs/dbraw/zinc/09/98/22/944099822.db2.gz IUJJAFHJCLFURI-CTNGQTDRSA-N 0 3 404.348 4.336 20 0 HIADHN CN(Cc1cccc(Br)c1)C[C@H](O)CO[C@H]1CCCc2ccccc21 ZINC000559958716 944100006 /nfs/dbraw/zinc/10/00/06/944100006.db2.gz IUJJAFHJCLFURI-FPOVZHCZSA-N 0 3 404.348 4.336 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)CCc2nc3cc(Cl)ccc3s2)cc1 ZINC000560247608 944206139 /nfs/dbraw/zinc/20/61/39/944206139.db2.gz WSPQDYCMNXFJBF-SFHVURJKSA-N 0 3 417.962 4.310 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)[C@H](C)Cc2cccc(C(F)(F)F)c2)cc1 ZINC000560252750 944207844 /nfs/dbraw/zinc/20/78/44/944207844.db2.gz WMPGIUASABZDOG-QRWLVFNGSA-N 0 3 408.464 4.312 20 0 HIADHN C[C@@H](N[C@@H](c1cncc(Br)c1)C1CC1)c1cccc(NS(C)(=O)=O)c1 ZINC000560267068 944211919 /nfs/dbraw/zinc/21/19/19/944211919.db2.gz UVHPPCGGLILITP-KZULUSFZSA-N 0 3 424.364 4.018 20 0 HIADHN CCOc1cc2c(cc1CNC[C@H](O)CO[C@H](C)c1ccc(Cl)cc1)O[C@@H](C)C2 ZINC000560315317 944224994 /nfs/dbraw/zinc/22/49/94/944224994.db2.gz WHBUZMLTGWAHBG-MRUHUIDDSA-N 0 3 419.949 4.290 20 0 HIADHN COc1ccc([C@@H](Cc2ccncc2)NCc2ccc(OC)c(NC(C)=O)c2)cc1 ZINC000560528660 944243721 /nfs/dbraw/zinc/24/37/21/944243721.db2.gz JPBJJJDTIBKNIA-JOCHJYFZSA-N 0 3 405.498 4.131 20 0 HIADHN CCc1nnc(NC(=O)[C@H](C)[C@@H](C)N[C@H](C)c2sccc2Br)s1 ZINC000560557511 944253618 /nfs/dbraw/zinc/25/36/18/944253618.db2.gz KLGVQSCEJCBLQH-OPRDCNLKSA-N 0 3 417.398 4.238 20 0 HIADHN CCOc1cc(CN2CCC(O[C@H]3CCOC3)CC2)ccc1OCc1ccccc1 ZINC000560562771 944256286 /nfs/dbraw/zinc/25/62/86/944256286.db2.gz UCPMITZSXMQPHS-QHCPKHFHSA-N 0 3 411.542 4.434 20 0 HIADHN Cc1c([C@@H](C)N[C@@H]2CCCN(C(=O)N3CCCC3)C2)cnn1-c1cccc(Cl)c1 ZINC000560573070 944258907 /nfs/dbraw/zinc/25/89/07/944258907.db2.gz DHWGPCXLOIHLIN-VQIMIIECSA-N 0 3 415.969 4.165 20 0 HIADHN CO[C@@H]1C[C@H](c2ccccc2)CC[C@@H]1N[C@H](C)CS(=O)(=O)c1ccc(C)cc1 ZINC000560576550 944261461 /nfs/dbraw/zinc/26/14/61/944261461.db2.gz ZZTUECREKKCSLY-WENLIBGGSA-N 0 3 401.572 4.098 20 0 HIADHN CC(C)(C)C1=CCN(CCNC(=O)[C@@H]2CCn3c(cnc3C3CCCCC3)C2)CC1 ZINC000560648971 944284084 /nfs/dbraw/zinc/28/40/84/944284084.db2.gz VARXEKXTKXJFSE-HXUWFJFHSA-N 0 3 412.622 4.288 20 0 HIADHN COCCN(CCN(C)C)C(=O)c1ccc(CSc2ccc(Cl)cc2)cc1 ZINC000560670749 944288775 /nfs/dbraw/zinc/28/87/75/944288775.db2.gz TTYFMRYYBQNWDO-UHFFFAOYSA-N 0 3 406.979 4.283 20 0 HIADHN CC(C)(C)OC1CC(CCNC(=O)[C@@H]2CN(Cc3ccccc3)CCC2(F)F)C1 ZINC000560674413 944289981 /nfs/dbraw/zinc/28/99/81/944289981.db2.gz DNLRSFGOEWCLAV-MHJFOBGBSA-N 0 3 408.533 4.244 20 0 HIADHN Cc1nn(Cc2ccccc2)c2sc(C(=O)N3C[C@H](N4CCCC4)C[C@@H]3C)cc12 ZINC000560759301 944322262 /nfs/dbraw/zinc/32/22/62/944322262.db2.gz WHNWNEMYWAPWQH-QFBILLFUSA-N 0 3 408.571 4.153 20 0 HIADHN Cc1nn(Cc2ccccc2)c2sc(C(=O)N3C[C@@H](N4CCCC4)C[C@H]3C)cc12 ZINC000560759299 944322701 /nfs/dbraw/zinc/32/27/01/944322701.db2.gz WHNWNEMYWAPWQH-APWZRJJASA-N 0 3 408.571 4.153 20 0 HIADHN CN(C)Cc1ccccc1NC(=O)c1cc(OCC(F)(F)F)c2ccccc2n1 ZINC000560831086 944349713 /nfs/dbraw/zinc/34/97/13/944349713.db2.gz PXAVGLLBDSCRTH-UHFFFAOYSA-N 0 3 403.404 4.490 20 0 HIADHN O=C(CC[C@@H]1CCCO1)N(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000561075662 944430949 /nfs/dbraw/zinc/43/09/49/944430949.db2.gz UEVBANLXWWGQIS-ZEQRLZLVSA-N 0 3 407.558 4.034 20 0 HIADHN COc1ccccc1[C@@H]1CC[C@H](C)CN1C(=O)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000561092377 944445835 /nfs/dbraw/zinc/44/58/35/944445835.db2.gz XWCNYYGBLUUQKF-RRPUWOKSSA-N 0 3 407.558 4.302 20 0 HIADHN Cc1ccc([C@H](CNC(=O)C[C@@H](c2ncc[nH]2)c2ccccc2)N2CCCC2)cc1 ZINC000561206891 944514263 /nfs/dbraw/zinc/51/42/63/944514263.db2.gz YMTYIHKHFYXQOU-PKTZIBPZSA-N 0 3 402.542 4.193 20 0 HIADHN O[C@@H](CN[C@@H]1CCCOc2ccc(F)cc21)COc1c(Cl)cccc1Cl ZINC000561257263 944530257 /nfs/dbraw/zinc/53/02/57/944530257.db2.gz NLFNQULQNIARMM-SUMWQHHRSA-N 0 3 400.277 4.376 20 0 HIADHN Cc1n[nH]cc1C1CCN(C(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)CC1 ZINC000561288928 944541292 /nfs/dbraw/zinc/54/12/92/944541292.db2.gz MJKANUKBKRHEOE-FQEVSTJZSA-N 0 3 415.607 4.142 20 0 HIADHN CN(CCC(F)(F)F)[C@H](CNC(=O)C(C)(C)c1cnc[nH]1)c1ccc(Cl)cc1 ZINC000561322658 944551171 /nfs/dbraw/zinc/55/11/71/944551171.db2.gz ZTGKQTFUNPKOLS-OAHLLOKOSA-N 0 3 416.875 4.082 20 0 HIADHN CN(C)C[C@H](NC(=O)[C@@H]1C[C@@H]1c1cccc(Br)c1)c1ccc(F)cc1 ZINC000561369554 944563781 /nfs/dbraw/zinc/56/37/81/944563781.db2.gz GYNIWMMHVDZABD-QRVBRYPASA-N 0 3 405.311 4.111 20 0 HIADHN C[C@H]1Cc2ccccc2N1Cc1occc1C(=O)N1CCN(C2CCC2)C[C@H](C)C1 ZINC000561533382 944659887 /nfs/dbraw/zinc/65/98/87/944659887.db2.gz SMNBPNAPTUYFCQ-OALUTQOASA-N 0 3 407.558 4.177 20 0 HIADHN C[C@@H](NC(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F)c1nccn1-c1ccccc1 ZINC000561641498 944723100 /nfs/dbraw/zinc/72/31/00/944723100.db2.gz ORTPNSQQCAVXKL-WIYYLYMNSA-N 0 3 424.495 4.207 20 0 HIADHN C[C@H](NC(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F)c1nccn1-c1ccccc1 ZINC000561641496 944723298 /nfs/dbraw/zinc/72/32/98/944723298.db2.gz ORTPNSQQCAVXKL-RXVVDRJESA-N 0 3 424.495 4.207 20 0 HIADHN COc1ccc2c(CC(=O)NC[C@H](c3ccc(OC(C)C)cc3)N(C)C)coc2c1 ZINC000561650485 944727375 /nfs/dbraw/zinc/72/73/75/944727375.db2.gz CJRBTHVKMMUCDE-JOCHJYFZSA-N 0 3 410.514 4.190 20 0 HIADHN CC[C@H](N[C@H]1CCc2c1ccc(OC)c2F)c1ccccc1OCC(=O)N(C)C ZINC000561772130 944789928 /nfs/dbraw/zinc/78/99/28/944789928.db2.gz LQSINLAHWFDUED-OALUTQOASA-N 0 3 400.494 4.030 20 0 HIADHN COc1cc2c(cc1OC)CN(C(=O)CN[C@@H](C)c1ccc(F)c3ccccc31)CC2 ZINC000561787131 944796679 /nfs/dbraw/zinc/79/66/79/944796679.db2.gz JMOUNRYXGKRBPU-INIZCTEOSA-N 0 3 422.500 4.232 20 0 HIADHN CCCc1nc(C)c(CNC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)o1 ZINC000561795382 944799177 /nfs/dbraw/zinc/79/91/77/944799177.db2.gz DICCHAXRZRWPLN-HXUWFJFHSA-N 0 3 409.452 4.006 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)N[C@@H]2CCN(Cc3ccccc3)[C@H]2C)c(C)c1 ZINC000561802977 944803349 /nfs/dbraw/zinc/80/33/49/944803349.db2.gz CJFPVBXGGUALHH-SFYKDHMMSA-N 0 3 422.573 4.308 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)NC[C@@H]2CCO[C@H]2c2ccccc2)N2CCCC2)cc1 ZINC000561805514 944804613 /nfs/dbraw/zinc/80/46/13/944804613.db2.gz RNUIASLNAMAPGC-VXNXHJTFSA-N 0 3 407.558 4.209 20 0 HIADHN COc1cc(Cl)c(NC(=O)N(C)C2CCN(CCc3ccccn3)CC2)cc1C ZINC000561817839 944810619 /nfs/dbraw/zinc/81/06/19/944810619.db2.gz UPPVQRCZESIAQX-UHFFFAOYSA-N 0 3 416.953 4.223 20 0 HIADHN COC(=O)c1ccc(COc2ccccc2CN[C@@H]2CCCc3[nH]c(=O)ccc32)cc1 ZINC000561971947 944880870 /nfs/dbraw/zinc/88/08/70/944880870.db2.gz UWVJYWNIJIBIPZ-OAQYLSRUSA-N 0 3 418.493 4.320 20 0 HIADHN Cc1nc2ccccn2c(=O)c1CCN1CCc2sccc2[C@@H]1c1cccs1 ZINC000562033918 944905054 /nfs/dbraw/zinc/90/50/54/944905054.db2.gz LWTPZALWFFDDSY-OAQYLSRUSA-N 0 3 407.564 4.316 20 0 HIADHN COc1ccc2c(c1)[C@@H](NCc1cccc(N3C(=O)NC4(CCCC4)C3=O)c1)CCC2 ZINC000562098184 944937078 /nfs/dbraw/zinc/93/70/78/944937078.db2.gz VHYBBYUJSASAQX-QFIPXVFZSA-N 0 3 419.525 4.231 20 0 HIADHN CC(C)Cc1ccc([C@@H](CNC(=O)Nc2ccc3c(c2)CCC(=O)N3C)N(C)C)cc1 ZINC000562168158 944997069 /nfs/dbraw/zinc/99/70/69/944997069.db2.gz HCOIIMNBTGJRCX-HSZRJFAPSA-N 0 3 422.573 4.219 20 0 HIADHN COc1cc(F)c(NC(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)cc1OC ZINC000562173884 945003277 /nfs/dbraw/zinc/00/32/77/945003277.db2.gz VTTAULPSZCDYTP-IBGZPJMESA-N 0 3 419.497 4.055 20 0 HIADHN O=C(NCc1c(F)cccc1N1CCCC1)NC[C@@H](c1cccs1)N1CCCC1 ZINC000562180218 945004953 /nfs/dbraw/zinc/00/49/53/945004953.db2.gz MUAKPAKFPRELJR-FQEVSTJZSA-N 0 3 416.566 4.124 20 0 HIADHN CC(C)c1nc2ccc(NC(=O)NC[C@@]3(O)CCN(Cc4ccccc4)C3)cc2s1 ZINC000562190189 945011958 /nfs/dbraw/zinc/01/19/58/945011958.db2.gz QZQNZYQFYLDQTF-QHCPKHFHSA-N 0 3 424.570 4.178 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)Nc1cnn(-c2ccccn2)c1)c1ccc(Cl)cc1 ZINC000562199808 945017097 /nfs/dbraw/zinc/01/70/97/945017097.db2.gz MAEFBYFDLJHSGA-IBGZPJMESA-N 0 3 412.925 4.125 20 0 HIADHN CN(CCCN(C)C(=O)COc1ccccc1-c1ccccc1)Cc1ccncc1 ZINC000564073048 945371675 /nfs/dbraw/zinc/37/16/75/945371675.db2.gz KBCLORFFQLDCFQ-UHFFFAOYSA-N 0 3 403.526 4.108 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1NC(=O)N[C@H]1CCN(Cc2ccccc2)[C@@H]1C ZINC000564136733 945395816 /nfs/dbraw/zinc/39/58/16/945395816.db2.gz YYODYENFBFNCCC-GCJKJVERSA-N 0 3 403.530 4.274 20 0 HIADHN COc1cc(CN2CCN(C3c4ccccc4-c4ccccc43)CC2)cc(OC)c1O ZINC000564293318 945503781 /nfs/dbraw/zinc/50/37/81/945503781.db2.gz GMDZORALMCFRJX-UHFFFAOYSA-N 0 3 416.521 4.297 20 0 HIADHN COc1ccc(CN2CCC[C@H](c3nnc(C4CC4)[nH]3)C2)c(OCc2cccnc2)c1 ZINC000564319709 945513969 /nfs/dbraw/zinc/51/39/69/945513969.db2.gz MZXMGMCEHUBFSR-FQEVSTJZSA-N 0 3 419.529 4.044 20 0 HIADHN COc1ccc(CN2CCC[C@@H](c3nnc(C4CC4)[nH]3)C2)c(OCc2cccnc2)c1 ZINC000564319802 945514120 /nfs/dbraw/zinc/51/41/20/945514120.db2.gz MZXMGMCEHUBFSR-HXUWFJFHSA-N 0 3 419.529 4.044 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)N[C@@H]1c2ccccc2CC12CCOCC2 ZINC000564575931 945683619 /nfs/dbraw/zinc/68/36/19/945683619.db2.gz SQEBUKOYRZONEN-LADGPHEKSA-N 0 3 419.569 4.044 20 0 HIADHN CC[C@@H]1C[C@H](C(=O)N(Cc2ccccc2Br)C2CCN(C)CC2)CCO1 ZINC000564590974 945691454 /nfs/dbraw/zinc/69/14/54/945691454.db2.gz QRZGZROGCILIHV-VQIMIIECSA-N 0 3 423.395 4.077 20 0 HIADHN CSc1ccc([C@@H](CNC(=O)c2cc(C)n(C3CCCCC3)n2)N(C)C)cc1 ZINC000565428560 945828082 /nfs/dbraw/zinc/82/80/82/945828082.db2.gz TYSVSIZQTWJCJG-OAQYLSRUSA-N 0 3 400.592 4.451 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)c1ccc(NC(=O)c2ccccc2)cc1)c1ccco1 ZINC000565679155 945865646 /nfs/dbraw/zinc/86/56/46/945865646.db2.gz QZJRFMUARLQKAT-DYESRHJHSA-N 0 3 405.498 4.391 20 0 HIADHN COc1ccc([C@@H](Cc2ccccc2)NCC(=O)N(C)Cc2cccc(OC)c2)cc1 ZINC000565803727 945888024 /nfs/dbraw/zinc/88/80/24/945888024.db2.gz MMJNQIIKUNVTPX-RUZDIDTESA-N 0 3 418.537 4.236 20 0 HIADHN CCN1CCN(c2ccc(N[C@H](C)c3ccc(Br)cn3)c(C)c2)CC1 ZINC000565809413 945889786 /nfs/dbraw/zinc/88/97/86/945889786.db2.gz QLCJSSAGHUJZPL-MRXNPFEDSA-N 0 3 403.368 4.468 20 0 HIADHN O=C(CCNCc1cnc(-c2ccncc2)s1)Nc1ccc(Br)cc1 ZINC000565910504 945916255 /nfs/dbraw/zinc/91/62/55/945916255.db2.gz PYWSBENDNNZOCI-UHFFFAOYSA-N 0 3 417.332 4.086 20 0 HIADHN COc1cc2c(c(CN3CCC[C@H](c4nc(C(F)(F)F)cn4C)C3)c1)O[C@H](C)C2 ZINC000565977555 945956570 /nfs/dbraw/zinc/95/65/70/945956570.db2.gz ZIGRGJDDFCOZRA-KGLIPLIRSA-N 0 3 409.452 4.151 20 0 HIADHN CCN1CC[C@H](N[C@@H](C)C(=O)Nc2ccccc2C)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000566347716 946006828 /nfs/dbraw/zinc/00/68/28/946006828.db2.gz WGWIPQYQMUNFMY-JBYOLUDKSA-N 0 3 405.464 4.164 20 0 HIADHN COc1cccc([C@@H]2[C@@H](NCC(=O)Nc3c(C)cccc3Cl)CCN2C2CC2)c1 ZINC000566400549 946021804 /nfs/dbraw/zinc/02/18/04/946021804.db2.gz HRYUUVHDQBKADO-NZQKXSOJSA-N 0 3 413.949 4.163 20 0 HIADHN COCc1cc(Cl)cc(S(=O)(=O)Nc2ccc(CN(C)C)c(Cl)c2)c1 ZINC000566770481 946096872 /nfs/dbraw/zinc/09/68/72/946096872.db2.gz YRDVEPMSCDMRRW-UHFFFAOYSA-N 0 3 403.331 4.002 20 0 HIADHN Cc1n[nH]c(C)c1CCC(=O)N1CCN(CCCc2ccccc2)C[C@H]1CC(C)C ZINC000566874027 946142800 /nfs/dbraw/zinc/14/28/00/946142800.db2.gz XELDGENIISWOKR-HSZRJFAPSA-N 0 3 410.606 4.151 20 0 HIADHN O=C(CCCc1ccccc1)N[C@H]1CCCN(Cc2cc(-n3ccnc3)cs2)C1 ZINC000567000629 946210406 /nfs/dbraw/zinc/21/04/06/946210406.db2.gz JKUUEVSIILXIEC-FQEVSTJZSA-N 0 3 408.571 4.037 20 0 HIADHN COc1ccc([C@@H](Cc2ccccc2)N[C@@H]2CCCN(CC(F)(F)F)C2=O)cc1 ZINC000567003183 946212344 /nfs/dbraw/zinc/21/23/44/946212344.db2.gz VTXDZEKKXATBNP-WOJBJXKFSA-N 0 3 406.448 4.122 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)[C@@H]1CCc2cccc(O)c21 ZINC000567058043 946228425 /nfs/dbraw/zinc/22/84/25/946228425.db2.gz NZHXRSFDZAPMFE-GOSISDBHSA-N 0 3 406.448 4.031 20 0 HIADHN CC[C@H]1CN(Cc2cc(Cl)c(OCC(N)=O)c(OC)c2)CC[C@@H]1c1ccccc1 ZINC000567068890 946231617 /nfs/dbraw/zinc/23/16/17/946231617.db2.gz APSVIVZUWPMMQR-HKUYNNGSSA-N 0 3 416.949 4.228 20 0 HIADHN Cc1cc2ncn(C[C@H](O)CNCc3cn(-c4ccccc4)nc3C(C)C)c2cc1C ZINC000567070924 946232674 /nfs/dbraw/zinc/23/26/74/946232674.db2.gz OPNJYLBLNXJEQP-JOCHJYFZSA-N 0 3 417.557 4.113 20 0 HIADHN O=C(CCCSc1ccc(Cl)cc1)Nc1cccc(CN2CC[C@@H](O)C2)c1 ZINC000567069846 946232727 /nfs/dbraw/zinc/23/27/27/946232727.db2.gz ZFAUWYZEBJAROP-LJQANCHMSA-N 0 3 404.963 4.418 20 0 HIADHN COC(=O)c1c(F)ccc(NC(=O)N[C@@H](CN(C)Cc2ccccc2)C(C)C)c1F ZINC000567089410 946239219 /nfs/dbraw/zinc/23/92/19/946239219.db2.gz VSUGMGICDPDJIY-SFHVURJKSA-N 0 3 419.472 4.030 20 0 HIADHN CCN(CC(F)(F)F)C(=O)[C@@H]1CCCN(Cc2cn(C)nc2C2CCCCC2)C1 ZINC000567396530 946323106 /nfs/dbraw/zinc/32/31/06/946323106.db2.gz MHAPERWWQFQARN-QGZVFWFLSA-N 0 3 414.516 4.091 20 0 HIADHN O=C(Nc1ccc(OC[C@@H]2CN(Cc3ccccc3)CCCO2)cc1)c1ccco1 ZINC000567523857 946359024 /nfs/dbraw/zinc/35/90/24/946359024.db2.gz SBFVEQGBSMFRKU-QFIPXVFZSA-N 0 3 406.482 4.202 20 0 HIADHN O=c1ccc2c([nH]1)CCC[C@H]2NCc1cnn(Cc2ccc(C(F)(F)F)cc2)c1 ZINC000567793223 946413782 /nfs/dbraw/zinc/41/37/82/946413782.db2.gz GUHDUIMWYGIVRH-GOSISDBHSA-N 0 3 402.420 4.218 20 0 HIADHN CCn1nccc1N1CCC[C@H](NC/C(C)=C\c2cccc(C(F)(F)F)c2)C1=O ZINC000568132107 946474064 /nfs/dbraw/zinc/47/40/64/946474064.db2.gz LEFUDGVHQWNKCS-NZHZHZHDSA-N 0 3 406.452 4.110 20 0 HIADHN CC1(C)CN(CC2CN(Cc3ccc(-n4cncn4)cc3)C2)c2cc(C3CC3)ccc21 ZINC000568298083 946490375 /nfs/dbraw/zinc/49/03/75/946490375.db2.gz OHDUJVVXCYENBB-UHFFFAOYSA-N 0 3 413.569 4.374 20 0 HIADHN CN(CCCN[C@H](c1ccccc1)c1cccc(S(C)(=O)=O)c1)c1ccccc1 ZINC000568429774 946540692 /nfs/dbraw/zinc/54/06/92/946540692.db2.gz WDAQUIQNOGGBBC-XMMPIXPASA-N 0 3 408.567 4.296 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)c2sc(NC(=O)C(C)(C)C)cc2C)cc1 ZINC000568493278 946569832 /nfs/dbraw/zinc/56/98/32/946569832.db2.gz JKNBJKLVKRTLDG-QGZVFWFLSA-N 0 3 417.575 4.082 20 0 HIADHN CC[C@H](C)n1ncc(C(=O)N2CCN(c3ccnc4ccccc43)CC2)c1C1CC1 ZINC000568554642 946592543 /nfs/dbraw/zinc/59/25/43/946592543.db2.gz KBDVTOGMDSWYNV-KRWDZBQOSA-N 0 3 403.530 4.242 20 0 HIADHN COc1cc(NC(=O)CCN[C@H]2CCCOc3ccc(F)cc32)c(OC)cc1Cl ZINC000568710275 946670768 /nfs/dbraw/zinc/67/07/68/946670768.db2.gz UVGKWXHEYJAKMV-INIZCTEOSA-N 0 3 422.884 4.328 20 0 HIADHN CSc1nc(-c2ccco2)nc(C)c1C(=O)N[C@H](C)CN(C)Cc1ccccc1 ZINC000568931345 946765912 /nfs/dbraw/zinc/76/59/12/946765912.db2.gz KUIKLRLHIUCKQQ-OAHLLOKOSA-N 0 3 410.543 4.017 20 0 HIADHN CCN1CC[C@H](N[C@H](C)C(=O)N2[C@H](C)CCC[C@H]2C)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000568991782 946792406 /nfs/dbraw/zinc/79/24/06/946792406.db2.gz WOLDMPFIPVZFRZ-AXJDZHCCSA-N 0 3 411.512 4.007 20 0 HIADHN C[C@H](c1ccc(F)cc1)N1CC[C@H](N[C@@H]2c3ccccc3CC23CCOCC3)C1=O ZINC000569007373 946796375 /nfs/dbraw/zinc/79/63/75/946796375.db2.gz WGSYVMQWFCPSKI-MQNAVGNWSA-N 0 3 408.517 4.171 20 0 HIADHN CSc1ccc([C@H](CNC(=O)c2ccc(-c3cncnc3)cc2F)N(C)C)cc1 ZINC000569147676 946822698 /nfs/dbraw/zinc/82/26/98/946822698.db2.gz RXLHOHCXFNASLG-NRFANRHFSA-N 0 3 410.518 4.037 20 0 HIADHN COCc1c(Br)cccc1NC(=O)N[C@H](C)CN(C)Cc1ccccc1 ZINC000569148841 946823362 /nfs/dbraw/zinc/82/33/62/946823362.db2.gz FKKFRCWBCGGHOQ-OAHLLOKOSA-N 0 3 420.351 4.238 20 0 HIADHN CCCN(CCc1ccccn1)C(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000569253272 946840832 /nfs/dbraw/zinc/84/08/32/946840832.db2.gz RGNWIPYAMYUICX-JOCHJYFZSA-N 0 3 419.491 4.317 20 0 HIADHN CN(CCNC(=O)Nc1cccc(CSC2CCOCC2)c1)Cc1ccccc1 ZINC000569405223 946869022 /nfs/dbraw/zinc/86/90/22/946869022.db2.gz XVWIFNDRGXOLAM-UHFFFAOYSA-N 0 3 413.587 4.352 20 0 HIADHN CCOc1ccc(NC(=O)COc2ccc(CN3CC[C@@H]3C(C)C)cc2OC)cc1 ZINC000569443058 946876036 /nfs/dbraw/zinc/87/60/36/946876036.db2.gz GWDHDJIWJYZHEY-OAQYLSRUSA-N 0 3 412.530 4.342 20 0 HIADHN CCN(C(=O)CN[C@@H]1CCN(C)[C@H]1c1ccc(F)c(F)c1)[C@@H](C)c1ccc(F)cc1 ZINC000569510876 946882482 /nfs/dbraw/zinc/88/24/82/946882482.db2.gz QIGCPJFOKWSOTJ-XFEAKLGESA-N 0 3 419.491 4.048 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)c1sc2ccccc2c1Br ZINC000569654341 946927266 /nfs/dbraw/zinc/92/72/66/946927266.db2.gz CRLDETFJRCTSRI-UHFFFAOYSA-N 0 3 418.360 4.263 20 0 HIADHN CC(C)[C@@H](O)C1(CNCc2cc(Br)ccc2OCc2ccccn2)CC1 ZINC000569836343 947015998 /nfs/dbraw/zinc/01/59/98/947015998.db2.gz JYNCVWJKLXPPEU-HXUWFJFHSA-N 0 3 419.363 4.310 20 0 HIADHN C[C@@H](N[C@@H]1c2ccccc2CC12CCOCC2)C(=O)Nc1ccc(OC(F)F)cc1 ZINC000569891237 947037155 /nfs/dbraw/zinc/03/71/55/947037155.db2.gz BSYYMXNTNQSEEQ-FOIQADDNSA-N 0 3 416.468 4.299 20 0 HIADHN CCOC(=O)c1oc2ccccc2c1CN1CC[C@](CO)(Cc2ccc(F)cc2)C1 ZINC000569963442 947055069 /nfs/dbraw/zinc/05/50/69/947055069.db2.gz FTGQODNVRSYDDU-DEOSSOPVSA-N 0 3 411.473 4.176 20 0 HIADHN O=C1NC2(CCCC2)C(=O)N1c1cccc(CNC/C=C/c2ccc(F)c(F)c2)c1 ZINC000569973870 947059528 /nfs/dbraw/zinc/05/95/28/947059528.db2.gz OVNWXSRNYRNNFF-GQCTYLIASA-N 0 3 411.452 4.137 20 0 HIADHN COc1c2ccccc2[nH]c1C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000569994920 947065050 /nfs/dbraw/zinc/06/50/50/947065050.db2.gz XFXKMOXSWQRJMV-GOSISDBHSA-N 0 3 415.497 4.072 20 0 HIADHN COc1cccc(C(=O)NC[C@H](c2ccc(SC)cc2)N(C)C)c1OC(F)F ZINC000570311937 947190794 /nfs/dbraw/zinc/19/07/94/947190794.db2.gz YLOFXFXROUMHTD-MRXNPFEDSA-N 0 3 410.486 4.051 20 0 HIADHN CC(C)[C@H](CNC(=O)CN[C@@H]1c2ccccc2CC12CCOCC2)c1ccccc1 ZINC000570369784 947224030 /nfs/dbraw/zinc/22/40/30/947224030.db2.gz ZRNSBEKNSDNWIZ-UKILVPOCSA-N 0 3 406.570 4.226 20 0 HIADHN CN(C)[C@H](CNCc1cn2ccc(Br)cc2n1)c1ccc(Cl)cc1 ZINC000570369052 947225016 /nfs/dbraw/zinc/22/50/16/947225016.db2.gz KTBVFQXNHATAAN-QGZVFWFLSA-N 0 3 407.743 4.143 20 0 HIADHN O=S(=O)(CCCNCc1ccc(Br)cc1)c1ccc(Cl)cc1 ZINC000570406377 947231920 /nfs/dbraw/zinc/23/19/20/947231920.db2.gz ZLWQVDSWQGUSFY-UHFFFAOYSA-N 0 3 402.741 4.056 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)c1ccc(COc2ccc(F)cc2)o1)c1ccco1 ZINC000570476519 947259475 /nfs/dbraw/zinc/25/94/75/947259475.db2.gz JTCZNHLLEMCTIQ-KXBFYZLASA-N 0 3 400.450 4.450 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)Nc1cccc(C(=O)N2CCCC2)c1C)c1ccco1 ZINC000570504576 947270010 /nfs/dbraw/zinc/27/00/10/947270010.db2.gz KNRIUDAQKGWSNS-UZLBHIALSA-N 0 3 412.534 4.075 20 0 HIADHN CC(=O)Nc1cccc(NC(=O)[C@H](C)N[C@@H](C)c2ccc(-c3ccncc3)cc2)c1 ZINC000570700789 947329964 /nfs/dbraw/zinc/32/99/64/947329964.db2.gz VWOMBHZVHMNRME-IRXDYDNUSA-N 0 3 402.498 4.385 20 0 HIADHN Cc1cc(OC(C)C)ccc1NC(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000570755452 947346185 /nfs/dbraw/zinc/34/61/85/947346185.db2.gz VGKDYKMEXISJRT-QFIPXVFZSA-N 0 3 411.546 4.195 20 0 HIADHN C[C@@H](Cc1ccccc1C(F)(F)F)N(C)S(=O)(=O)c1ccc(CN(C)C)cc1 ZINC000570855819 947370156 /nfs/dbraw/zinc/37/01/56/947370156.db2.gz YXQCRPPDLKSJQD-HNNXBMFYSA-N 0 3 414.493 4.019 20 0 HIADHN Cc1cccnc1OC1CCN(C[C@@H](O)CO[C@@H](C)c2ccc(Cl)cc2)CC1 ZINC000571930402 947814814 /nfs/dbraw/zinc/81/48/14/947814814.db2.gz PBJAHISIUIBGRR-FXAWDEMLSA-N 0 3 404.938 4.025 20 0 HIADHN COCCCN(C(=O)c1ccc2cc(Br)ccc2c1)C1CCN(C)CC1 ZINC000571935600 947817160 /nfs/dbraw/zinc/81/71/60/947817160.db2.gz SRRXVTYWZKSLNT-UHFFFAOYSA-N 0 3 419.363 4.175 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N[C@@H](C)c2nccn2-c2ccccc2)C1 ZINC000572193030 947860484 /nfs/dbraw/zinc/86/04/84/947860484.db2.gz GFENNTDILQGYFL-QKNQBKEWSA-N 0 3 403.530 4.068 20 0 HIADHN CCn1nccc1N1CCC[C@H](N[C@H](C)c2ccc(OC(C)C)c(Cl)c2)C1=O ZINC000572264302 947871204 /nfs/dbraw/zinc/87/12/04/947871204.db2.gz HRIKSIATXGJODM-QAPCUYQASA-N 0 3 404.942 4.190 20 0 HIADHN CCN(CC)[C@H](CN[C@H](c1nnc[nH]1)c1ccc(F)cc1)c1ccccc1Cl ZINC000572307652 947880268 /nfs/dbraw/zinc/88/02/68/947880268.db2.gz XQFHDBFXKNKERT-UXHICEINSA-N 0 3 401.917 4.359 20 0 HIADHN CCN(CC)[C@@H](CN[C@H](c1nnc[nH]1)c1ccc(F)cc1)c1ccccc1Cl ZINC000572307651 947880378 /nfs/dbraw/zinc/88/03/78/947880378.db2.gz XQFHDBFXKNKERT-PMACEKPBSA-N 0 3 401.917 4.359 20 0 HIADHN CCOc1cc(CN2CCC[C@H](c3ccnc(N)n3)C2)ccc1OCc1ccccc1 ZINC000572324126 947884765 /nfs/dbraw/zinc/88/47/65/947884765.db2.gz JQEMBOPQFQCZJX-NRFANRHFSA-N 0 3 418.541 4.416 20 0 HIADHN O=S(=O)(Cc1ccccc1CN[C@H]1CCCc2c(Cl)cccc21)N1CCCC1 ZINC000572325176 947885039 /nfs/dbraw/zinc/88/50/39/947885039.db2.gz XDLBSTWWODYFJH-QFIPXVFZSA-N 0 3 418.990 4.433 20 0 HIADHN C[C@H](NC[C@@H](c1ccccc1Cl)N1CCOCC1)c1ccc(Br)cn1 ZINC000572352450 947889128 /nfs/dbraw/zinc/88/91/28/947889128.db2.gz CEMUNJFLMZVOGV-LIRRHRJNSA-N 0 3 424.770 4.222 20 0 HIADHN CC(C)N1CC[C@H](N[C@@H](C)C(=O)Nc2ccc(F)cc2F)[C@@H]1c1ccc(F)c(F)c1 ZINC000572375192 947889926 /nfs/dbraw/zinc/88/99/26/947889926.db2.gz ILSODRQKQICSIL-ZEWGMFERSA-N 0 3 423.454 4.384 20 0 HIADHN COCC(=O)Nc1cccc(CN[C@H](Cc2ccccc2)c2ccc(OC)cc2)c1 ZINC000572414126 947897698 /nfs/dbraw/zinc/89/76/98/947897698.db2.gz IVIXJVKCAWACBA-XMMPIXPASA-N 0 3 404.510 4.354 20 0 HIADHN COc1ccc([C@H](C)NCc2cnc3ccc(Br)cn23)c(C)c1OC ZINC000572439303 947905822 /nfs/dbraw/zinc/90/58/22/947905822.db2.gz UJTPUYJREIGPLZ-ZDUSSCGKSA-N 0 3 404.308 4.273 20 0 HIADHN COC(=O)c1oc(CN2CCC[C@H](c3nc(-c4ccc(Cl)cc4)no3)C2)cc1C ZINC000572534975 947936894 /nfs/dbraw/zinc/93/68/94/947936894.db2.gz AHZFSEMBVVBPDO-HNNXBMFYSA-N 0 3 415.877 4.458 20 0 HIADHN COc1ccc(-c2n[nH]cc2CN2CC[C@H](Oc3ccc(C(F)(F)F)cn3)C2)cc1 ZINC000572683033 947984685 /nfs/dbraw/zinc/98/46/85/947984685.db2.gz CXOAGJZDMGTYOQ-SFHVURJKSA-N 0 3 418.419 4.152 20 0 HIADHN CSc1ccc([C@@H](CNC(=O)c2ccc(N3CCCC3)c(F)c2)N(C)C)cc1 ZINC000572876954 948026851 /nfs/dbraw/zinc/02/68/51/948026851.db2.gz FSIJWZGOSMTIQU-OAQYLSRUSA-N 0 3 401.551 4.181 20 0 HIADHN CCN1CC[C@@H](NCc2cc(C(=O)OC)sc2C)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000573147827 948091315 /nfs/dbraw/zinc/09/13/15/948091315.db2.gz PAIOAKXRLZNMFL-APWZRJJASA-N 0 3 412.477 4.186 20 0 HIADHN CN(C[C@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)Cc1ccc2ccccc2c1 ZINC000573215854 948108488 /nfs/dbraw/zinc/10/84/88/948108488.db2.gz DTNAUICZWMPHOU-JOCHJYFZSA-N 0 3 408.567 4.124 20 0 HIADHN CC[C@@H](N[C@H]1c2ccccc2CC12CCOCC2)c1ccccc1OCC(=O)N(C)C ZINC000573410958 948196875 /nfs/dbraw/zinc/19/68/75/948196875.db2.gz OTBUBKUANAOZGN-RDGATRHJSA-N 0 3 422.569 4.289 20 0 HIADHN Cc1ccc(CN(C(=O)CN[C@H]2c3ccccc3CC23CCOCC3)C2CC2)cc1 ZINC000573528901 948232936 /nfs/dbraw/zinc/23/29/36/948232936.db2.gz IZXBLFKCVKUDMZ-VWLOTQADSA-N 0 3 404.554 4.170 20 0 HIADHN C[C@H]1[C@@H](NC(=O)CCc2nnc(-c3ccc(Cl)cc3)o2)CCN1Cc1ccccc1 ZINC000573552101 948238126 /nfs/dbraw/zinc/23/81/26/948238126.db2.gz VEGBTJAFDZVFLN-JXFKEZNVSA-N 0 3 424.932 4.102 20 0 HIADHN CCOC(=O)[C@H]1CC[C@@H](NCc2ccc(C)cc2N2CCOCC2)c2ccccc21 ZINC000573581372 948240554 /nfs/dbraw/zinc/24/05/54/948240554.db2.gz AFANMQWPMCFWCU-XZOQPEGZSA-N 0 3 408.542 4.103 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@H](NCc2ccc(C)cc2N2CCOCC2)c2ccccc21 ZINC000573581371 948240790 /nfs/dbraw/zinc/24/07/90/948240790.db2.gz AFANMQWPMCFWCU-PKTZIBPZSA-N 0 3 408.542 4.103 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3nc4c(s3)CCCC4(C)C)CC2)C[C@H](C)O1 ZINC000573647553 948266290 /nfs/dbraw/zinc/26/62/90/948266290.db2.gz HKATYQOILSZYCY-IYBDPMFKSA-N 0 3 420.623 4.110 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)c2c[nH]nc2-c2ccccc2F)N(C)C)cc1 ZINC000573671724 948272576 /nfs/dbraw/zinc/27/25/76/948272576.db2.gz ZEFPGGQVXZVFJQ-OAQYLSRUSA-N 0 3 410.493 4.036 20 0 HIADHN Cc1cc(C)c(CCNC(=O)CN(C)[C@H]2CCO[C@@H](c3ccc(F)cc3)C2)c(C)c1 ZINC000573845164 948309147 /nfs/dbraw/zinc/30/91/47/948309147.db2.gz ITCLNFICPCJRDQ-LADGPHEKSA-N 0 3 412.549 4.262 20 0 HIADHN CC[C@H](c1cccc(OC)c1)N(C)C(=O)CCCN1CCN(c2ccccc2)CC1 ZINC000574072331 948357347 /nfs/dbraw/zinc/35/73/47/948357347.db2.gz SLPZYZTZGHDYGK-XMMPIXPASA-N 0 3 409.574 4.207 20 0 HIADHN Cc1cc(C)c(NC(=O)[C@H](C)N[C@H]2CCN(C)[C@@H]2c2ccc(F)c(F)c2)c(C)c1 ZINC000574122576 948371566 /nfs/dbraw/zinc/37/15/66/948371566.db2.gz YLHWIMNODGXUIV-XUEUYAKLSA-N 0 3 401.501 4.252 20 0 HIADHN COc1ccc2c(c1)C1(CC1)CN(C(=O)NC[C@H](c1cccs1)N1CCCC1)C2 ZINC000574247558 948398386 /nfs/dbraw/zinc/39/83/86/948398386.db2.gz BSFKFZZYMOWOGK-HXUWFJFHSA-N 0 3 411.571 4.151 20 0 HIADHN CC(C)[C@@H](CNC(=O)[C@H](C)Cc1cnc2ccccc2n1)N1CCc2ccccc2C1 ZINC000574295452 948403800 /nfs/dbraw/zinc/40/38/00/948403800.db2.gz OGKXLBFKDLWESI-KBMIEXCESA-N 0 3 416.569 4.008 20 0 HIADHN Cc1ccc2[nH]c3c(c2c1)CCC[C@@H]3NCc1ccc(S(=O)(=O)N2CCCC2)cc1 ZINC000574311755 948408709 /nfs/dbraw/zinc/40/87/09/948408709.db2.gz ASXLMVVJULZXFH-QHCPKHFHSA-N 0 3 423.582 4.428 20 0 HIADHN CCc1ccc([C@H]2CCCN(Cc3cc(Cl)c(OCC(N)=O)c(OC)c3)C2)cc1 ZINC000574320361 948412353 /nfs/dbraw/zinc/41/23/53/948412353.db2.gz OPZRIOLCRLIGPO-IBGZPJMESA-N 0 3 416.949 4.155 20 0 HIADHN Brc1ccc(C2(CN[C@H](c3nnc[nH]3)c3ccccc3)CCC2)s1 ZINC000574361539 948423870 /nfs/dbraw/zinc/42/38/70/948423870.db2.gz GRHZKBYUWCLAPA-INIZCTEOSA-N 0 3 403.349 4.430 20 0 HIADHN C[C@@H](N[C@@H]1CCCN(Cc2nccn2C)C1=O)c1ccc(-c2c(F)cccc2F)cc1 ZINC000574490370 948458017 /nfs/dbraw/zinc/45/80/17/948458017.db2.gz PXAODIFPAJNMFX-IIBYNOLFSA-N 0 3 424.495 4.207 20 0 HIADHN CCN(C(=O)[C@H](C)N[C@@H]1CCN(C2CC2)[C@H]1c1cccc(OC)c1)c1ccccc1 ZINC000574859545 948545618 /nfs/dbraw/zinc/54/56/18/948545618.db2.gz JASBTOQJABQSHR-GLYQVZKVSA-N 0 3 407.558 4.004 20 0 HIADHN C[C@H](NC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1)c1nccn1-c1ccccc1 ZINC000574937191 948557652 /nfs/dbraw/zinc/55/76/52/948557652.db2.gz XKMPBSZODGDZCP-AZUAARDMSA-N 0 3 406.505 4.101 20 0 HIADHN Cc1ccc(C[C@@H](NC[C@@H](O)COc2cccc3[nH]ccc32)c2ccccn2)cc1 ZINC000574961754 948566044 /nfs/dbraw/zinc/56/60/44/948566044.db2.gz QQOQLIHXEQVQAN-HYBUGGRVSA-N 0 3 401.510 4.185 20 0 HIADHN CCc1ccccc1NC(=O)[C@H](C)N[C@@H]1CCN(CC)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000575198483 948627197 /nfs/dbraw/zinc/62/71/97/948627197.db2.gz LEKYNPODYAFVNR-UPNLOYSTSA-N 0 3 419.491 4.418 20 0 HIADHN C[C@H](NC(=O)CN[C@H]1CCN(C)[C@@H]1c1ccccc1)c1ccc(Cl)c(Cl)c1 ZINC000575370018 948658906 /nfs/dbraw/zinc/65/89/06/948658906.db2.gz KUURBOQLTBYGOT-ONTRVFCTSA-N 0 3 406.357 4.206 20 0 HIADHN O[C@@H](CN[C@@H]1CCCOc2ccc(F)cc21)COc1ccc(Cl)cc1Cl ZINC000575735799 948688701 /nfs/dbraw/zinc/68/87/01/948688701.db2.gz OJSIYURMIJJXIX-WMLDXEAASA-N 0 3 400.277 4.376 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)N[C@H]2c3ccccc3CC23CCOCC3)N(C)C)cc1 ZINC000575794626 948718575 /nfs/dbraw/zinc/71/85/75/948718575.db2.gz CQQXUZAIMBTRID-RPWUZVMVSA-N 0 3 421.585 4.245 20 0 HIADHN CC(=O)CCc1ccc2oc(C(=O)Nc3cccc(CN4CC[C@@H](O)C4)c3)c(C)c2c1 ZINC000575813659 948721760 /nfs/dbraw/zinc/72/17/60/948721760.db2.gz KNPTYSZXPUYLEA-OAQYLSRUSA-N 0 3 420.509 4.082 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)NCCc1nc2cc(Cl)ccc2s1 ZINC000576006970 948808606 /nfs/dbraw/zinc/80/86/06/948808606.db2.gz ZYSMBOITZKGJQR-UHFFFAOYSA-N 0 3 416.978 4.266 20 0 HIADHN COc1ccc([C@@H](Cc2ccccc2)NCC(=O)N2CCc3sccc3C2)cc1 ZINC000576032377 948813648 /nfs/dbraw/zinc/81/36/48/948813648.db2.gz JJBHMWVJDOOPPY-JOCHJYFZSA-N 0 3 406.551 4.215 20 0 HIADHN FC(F)(c1cnc(Cl)c(-c2ccc(Cl)cc2)c1)N1CC[C@H]2NCCO[C@H]2C1 ZINC001164391783 718826573 /nfs/dbraw/zinc/82/65/73/718826573.db2.gz XGGHSIYUKMYPTA-SJORKVTESA-N 0 3 414.283 4.167 20 0 HIADHN CN(Cc1ccc(N2CCC(F)(F)[C@]3(CCN(c4ccccc4)C3)C2)nc1)C1CC1 ZINC001164830467 720396134 /nfs/dbraw/zinc/39/61/34/720396134.db2.gz QZZIBNORJYHNHD-QHCPKHFHSA-N 0 3 412.528 4.418 20 0 HIADHN Clc1ccc2[nH]c3ncnc(N4CC[C@H]5[C@@H]4CCN5Cc4cccnc4)c3c2c1 ZINC001164729379 720426193 /nfs/dbraw/zinc/42/61/93/720426193.db2.gz HIHXWNYAMUKPSU-OALUTQOASA-N 0 3 404.905 4.013 20 0 HIADHN Clc1ccc2[nH]c3ncnc(N4CC[C@H]5[C@H]4CCN5Cc4cccnc4)c3c2c1 ZINC001164729381 720426750 /nfs/dbraw/zinc/42/67/50/720426750.db2.gz HIHXWNYAMUKPSU-RBUKOAKNSA-N 0 3 404.905 4.013 20 0 HIADHN Clc1ccc2c(Cl)nnc(N3CC[C@@H]4[C@H]3CCN4Cc3cccnc3)c2c1 ZINC001164726350 720464904 /nfs/dbraw/zinc/46/49/04/720464904.db2.gz BPVLVKLINWXSQZ-QZTJIDSGSA-N 0 3 400.313 4.185 20 0 HIADHN c1cc2c(nc(-c3ccncc3)nc2N2CC[C@H]3[C@@H]2CCN3Cc2cccnc2)s1 ZINC001164723907 720468507 /nfs/dbraw/zinc/46/85/07/720468507.db2.gz DKHGFSNKRMEZQZ-PMACEKPBSA-N 0 3 414.538 4.002 20 0 HIADHN Cc1cccc2c1ncnc2N1CCC(F)(F)[C@]2(CCN(Cc3ccccn3)C2)C1 ZINC001164906268 721694454 /nfs/dbraw/zinc/69/44/54/721694454.db2.gz MVQLPHMBAPYZNJ-QFIPXVFZSA-N 0 3 409.484 4.071 20 0 HIADHN COc1cccc2ccc(N3CCC(F)(F)[C@@]4(CCN(Cc5ccccn5)C4)C3)nc21 ZINC001164903710 721694933 /nfs/dbraw/zinc/69/49/33/721694933.db2.gz BUBXOFOQFRAOQA-HSZRJFAPSA-N 0 3 424.495 4.376 20 0 HIADHN Clc1cc(N2CC[C@H]3CN(Cc4cccnc4)CCO[C@@H]3C2)c2ccccc2n1 ZINC001164980839 722099503 /nfs/dbraw/zinc/09/95/03/722099503.db2.gz KOQXWPCJAOXQQE-PGRDOPGGSA-N 0 3 408.933 4.011 20 0 HIADHN Cc1cc(N2CC[C@H]3CN(Cc4cccnc4)CCO[C@@H]3C2)nc2cc(Cl)ccc12 ZINC001164979008 722128706 /nfs/dbraw/zinc/12/87/06/722128706.db2.gz ORSBCEHIFOCWLE-WMZHIEFXSA-N 0 3 422.960 4.319 20 0 HIADHN CC(C)c1cc(N2CC[C@H]3CN(Cc4cccnc4)CCO[C@@H]3C2)nc(C(C)(C)C)n1 ZINC001164973362 722148164 /nfs/dbraw/zinc/14/81/64/722148164.db2.gz BTZRMCANCIWKJY-RBBKRZOGSA-N 0 3 423.605 4.020 20 0 HIADHN CN(C)CCN(C(=O)Nc1ccc(CC(=O)N(C)c2ccccc2)cc1)C1CCCC1 ZINC000436002873 861289436 /nfs/dbraw/zinc/28/94/36/861289436.db2.gz KANZTZSOPCYZEU-UHFFFAOYSA-N 0 3 422.573 4.230 20 0 HIADHN O=C(c1cccc(CN2CCCC2)c1)N(CCn1ccnc1)Cc1cccc(Cl)c1 ZINC000436027007 861319762 /nfs/dbraw/zinc/31/97/62/861319762.db2.gz KMGNFEUIZZUOMI-UHFFFAOYSA-N 0 3 422.960 4.475 20 0 HIADHN OCC[C@@H](NCc1ccc(I)c(Cl)c1)c1ccccc1 ZINC000436132852 861423956 /nfs/dbraw/zinc/42/39/56/861423956.db2.gz WMIVNDHLPJCGIZ-MRXNPFEDSA-N 0 3 401.675 4.158 20 0 HIADHN Cc1csc(C(C#N)C(=O)CSc2nnc(Nc3cccc(C)c3)s2)n1 ZINC000006912906 845223878 /nfs/dbraw/zinc/22/38/78/845223878.db2.gz JPCFYLVLLFUKDR-ZDUSSCGKSA-N 0 3 401.542 4.324 20 0 HIADHN Cc1ccc(-c2nc(CNC3CCC(N4C(=O)c5ccccc5C4=O)CC3)co2)cc1 ZINC000436250066 861560583 /nfs/dbraw/zinc/56/05/83/861560583.db2.gz GFLWNTSZGYTNRJ-UHFFFAOYSA-N 0 3 415.493 4.347 20 0 HIADHN C[C@@H](NCc1cc(=O)n2cc(Br)ccc2n1)c1cccc2ccccc21 ZINC000008268375 845503493 /nfs/dbraw/zinc/50/34/93/845503493.db2.gz ZKBTXJMNGWZTCF-CQSZACIVSA-N 0 3 408.299 4.461 20 0 HIADHN O=C(Cc1csc(-c2ccc(Cl)cc2)n1)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000008367033 845518531 /nfs/dbraw/zinc/51/85/31/845518531.db2.gz AOMYEWKFCYKBDP-IBGZPJMESA-N 0 3 411.958 4.397 20 0 HIADHN CCn1ncc2c1nc(-c1ccccc1)cc2C(=O)NCc1ccccc1CN(C)C ZINC000010085774 845618622 /nfs/dbraw/zinc/61/86/22/845618622.db2.gz MRSQKQDJYITGRV-UHFFFAOYSA-N 0 3 413.525 4.110 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Cc3csc(-c4cccc(F)c4)n3)cc2)CC1 ZINC000010192987 845629555 /nfs/dbraw/zinc/62/95/55/845629555.db2.gz BEBXZAHXLPDDMG-UHFFFAOYSA-N 0 3 424.545 4.272 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)CCc3ncc(-c4ccccc4F)o3)cc2)CC1 ZINC000010193062 845630029 /nfs/dbraw/zinc/63/00/29/845630029.db2.gz OUYLCJJNCHVWCP-UHFFFAOYSA-N 0 3 422.504 4.194 20 0 HIADHN Cc1c([C@H](C)NCC2([S@](C)=O)CCC2)cnn1-c1ccc(Cl)cc1Cl ZINC000436311598 861615852 /nfs/dbraw/zinc/61/58/52/861615852.db2.gz UDSKMAGUGCTDLJ-VDBVYFBLSA-N 0 3 400.375 4.439 20 0 HIADHN O=C(Nc1ccccc1)C1CCN(C[C@H](O)COc2c(Cl)cccc2Cl)CC1 ZINC000014074152 845922794 /nfs/dbraw/zinc/92/27/94/845922794.db2.gz PWOPYLGDUABLHK-KRWDZBQOSA-N 0 3 423.340 4.084 20 0 HIADHN O=C(CSc1ccccn1)Nc1ccc(N2CCN(Cc3ccccc3)CC2)cc1 ZINC000014897413 845990715 /nfs/dbraw/zinc/99/07/15/845990715.db2.gz CGWGQZAZOYEGML-UHFFFAOYSA-N 0 3 418.566 4.135 20 0 HIADHN CCOC(=O)Nc1ccc2c(CN(C)CCOc3ccc(C)cc3)cc(=O)oc2c1 ZINC000015102686 846009480 /nfs/dbraw/zinc/00/94/80/846009480.db2.gz SZEOWWHOFAVXLN-UHFFFAOYSA-N 0 3 410.470 4.181 20 0 HIADHN COc1ccc2c(CN3CCCN(Cc4ccc(Cl)cc4)CC3)cc(=O)oc2c1 ZINC000022845041 846628545 /nfs/dbraw/zinc/62/85/45/846628545.db2.gz JMKMZBRZTYEMAP-UHFFFAOYSA-N 0 3 412.917 4.163 20 0 HIADHN Cc1cccc2nc(C3CCN(C(=O)N[C@H]4CCN(C)[C@H]4c4ccccc4)CC3)oc21 ZINC000436370739 861708535 /nfs/dbraw/zinc/70/85/35/861708535.db2.gz ZZZXPNKJGSCJOV-UNMCSNQZSA-N 0 3 418.541 4.471 20 0 HIADHN COc1cc(C)ccc1OCC(=O)NC[C@H](c1cccs1)N1CCC(C)CC1 ZINC000023721819 846742937 /nfs/dbraw/zinc/74/29/37/846742937.db2.gz DFWUXICZVWTGHD-GOSISDBHSA-N 0 3 402.560 4.033 20 0 HIADHN COc1ccc(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)cc1Br ZINC000023739748 846744654 /nfs/dbraw/zinc/74/46/54/846744654.db2.gz MOZNODYXXRNDIQ-SFHVURJKSA-N 0 3 403.320 4.025 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(C)c1C(=O)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000023739584 846744723 /nfs/dbraw/zinc/74/47/23/846744723.db2.gz JNQMLGDFBGTGFS-QFIPXVFZSA-N 0 3 406.505 4.195 20 0 HIADHN C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)NC[C@H](c1ccccc1)N1CCCC1 ZINC000023737691 846744794 /nfs/dbraw/zinc/74/47/94/846744794.db2.gz LZKGZECADWEWJQ-WMZHIEFXSA-N 0 3 421.585 4.056 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)COc3cccc4ccccc43)c(C)c2)CC1 ZINC000025186092 846938675 /nfs/dbraw/zinc/93/86/75/846938675.db2.gz KIJYBTMVSCWZTF-UHFFFAOYSA-N 0 3 403.526 4.308 20 0 HIADHN COc1cc(CNCCNC(=O)C2CC2)ccc1OCc1ccc(Cl)cc1Cl ZINC000025359404 846966738 /nfs/dbraw/zinc/96/67/38/846966738.db2.gz NATNBVABQBLZPC-UHFFFAOYSA-N 0 3 423.340 4.197 20 0 HIADHN CN(C)[C@H](CNC(=O)c1ccc(-c2ccc3c(c2)OCCO3)s1)c1ccccc1 ZINC000025420291 846974995 /nfs/dbraw/zinc/97/49/95/846974995.db2.gz HHAQDYRRKXPRAE-GOSISDBHSA-N 0 3 408.523 4.219 20 0 HIADHN O[C@H](CNc1ncnc2scc(-c3ccccc3)c21)CN1CCc2ccccc2C1 ZINC000025499744 846987627 /nfs/dbraw/zinc/98/76/27/846987627.db2.gz PJBLYADGKNQSES-HXUWFJFHSA-N 0 3 416.550 4.189 20 0 HIADHN COCCOc1ccc(C(F)(F)F)cc1NC(=O)CN(C)[C@@H]1CCC[C@@H](C)C1 ZINC000026475499 847154554 /nfs/dbraw/zinc/15/45/54/847154554.db2.gz NTGYLJMAMVACPN-GDBMZVCRSA-N 0 3 402.457 4.180 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3ccc(C)c(-n4cccc4)c3)c(C)c2)CC1 ZINC000026909046 847220819 /nfs/dbraw/zinc/22/08/19/847220819.db2.gz MXJSPPBMAHSRRG-UHFFFAOYSA-N 0 3 402.542 4.488 20 0 HIADHN CSCc1ccc(C(=O)NCCCCN2CCN(c3cccc(C)c3)CC2)cc1 ZINC000026955540 847226825 /nfs/dbraw/zinc/22/68/25/847226825.db2.gz GEDXAGHDLBUKNH-UHFFFAOYSA-N 0 3 411.615 4.190 20 0 HIADHN Cn1ncc(Cl)c1CNc1cccc(N2CCN(CCc3ccccc3)CC2)c1 ZINC000436418625 861773099 /nfs/dbraw/zinc/77/30/99/861773099.db2.gz WFPWHQYJDQYBJL-UHFFFAOYSA-N 0 3 409.965 4.050 20 0 HIADHN CC1CCN([C@H](CNC(=O)c2cccc(NC(=O)C3CC3)c2)c2cccs2)CC1 ZINC000027573460 847321700 /nfs/dbraw/zinc/32/17/00/847321700.db2.gz ZJHPMRXRHXDUPC-HXUWFJFHSA-N 0 3 411.571 4.300 20 0 HIADHN CN(C)[C@@H](CNC(=O)COC(c1ccccc1)c1ccccc1)Cc1ccccc1 ZINC000027583553 847323354 /nfs/dbraw/zinc/32/33/54/847323354.db2.gz XJEJJCGJSUVFDE-XMMPIXPASA-N 0 3 402.538 4.082 20 0 HIADHN CN(C)[C@H](CNC(=O)CCCc1ccc(Br)s1)Cc1ccccc1 ZINC000027586740 847324342 /nfs/dbraw/zinc/32/43/42/847324342.db2.gz QRTUHKUUYLESEH-INIZCTEOSA-N 0 3 409.393 4.122 20 0 HIADHN Cc1ccc(-n2ncc(C(=O)N[C@H](C)CN3CCCCC3)c2C2CC2)cc1Cl ZINC000027767003 847349163 /nfs/dbraw/zinc/34/91/63/847349163.db2.gz KDNBNACUPFAIAM-MRXNPFEDSA-N 0 3 400.954 4.316 20 0 HIADHN COc1ccc([C@H]2CCCN2C(=O)CN2CCC[C@@H]2Cc2ccccc2)cc1OC ZINC000028279263 847401576 /nfs/dbraw/zinc/40/15/76/847401576.db2.gz ZTCNMNWRUHRYSQ-FGZHOGPDSA-N 0 3 408.542 4.074 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)c1cccc(OCc2cscn2)c1 ZINC000029178950 847520880 /nfs/dbraw/zinc/52/08/80/847520880.db2.gz QQYLDADYNVWWHV-JOCHJYFZSA-N 0 3 407.539 4.289 20 0 HIADHN Cc1nc(C(F)(F)F)ccc1C(=O)NC[C@H](C(C)C)N1CCc2ccccc2C1 ZINC000029174989 847521161 /nfs/dbraw/zinc/52/11/61/847521161.db2.gz MBEZBTIRFIEIPA-LJQANCHMSA-N 0 3 405.464 4.222 20 0 HIADHN CC(=O)Nc1ccc(OC[C@@H](O)CN(Cc2ccc(C(F)(F)F)cc2)C2CC2)cc1 ZINC000029719504 847607850 /nfs/dbraw/zinc/60/78/50/847607850.db2.gz INEBRWLYWZNIQX-FQEVSTJZSA-N 0 3 422.447 4.068 20 0 HIADHN CCCOc1ccc(OCCN2CCC(C(=O)Nc3ccccc3OC)CC2)cc1 ZINC000029905269 847645303 /nfs/dbraw/zinc/64/53/03/847645303.db2.gz WZMZEHVHJAXJKJ-UHFFFAOYSA-N 0 3 412.530 4.214 20 0 HIADHN CC[C@H](CNC(=O)c1ccc(OCc2ccncc2)cc1)N1CCc2ccccc2C1 ZINC000029912772 847649266 /nfs/dbraw/zinc/64/92/66/847649266.db2.gz CGJCTAJQDPYJIF-XMMPIXPASA-N 0 3 415.537 4.227 20 0 HIADHN Cc1ccccc1CN1CCCN(CC(=O)Nc2ccccc2SC(F)F)CC1 ZINC000030153974 847683494 /nfs/dbraw/zinc/68/34/94/847683494.db2.gz VCSMXYWUKWZLLO-UHFFFAOYSA-N 0 3 419.541 4.456 20 0 HIADHN O=C(CNCc1ccc(-c2ccc(Br)cc2)s1)NCc1ccco1 ZINC000030641860 847751162 /nfs/dbraw/zinc/75/11/62/847751162.db2.gz ZVGRBJLFPGQHHX-UHFFFAOYSA-N 0 3 405.317 4.177 20 0 HIADHN COc1cc(CNC[C@H](c2c(F)cccc2Cl)N2CCCC2)cc2c1OCCO2 ZINC000030910936 847797597 /nfs/dbraw/zinc/79/75/97/847797597.db2.gz UDIZSLUSXFXUHY-GOSISDBHSA-N 0 3 420.912 4.186 20 0 HIADHN COCCOc1ccc(CNCc2cn(-c3ccccc3)nc2-c2ccncc2)cc1 ZINC000030916405 847798918 /nfs/dbraw/zinc/79/89/18/847798918.db2.gz NBMFBHHWPMKNBH-UHFFFAOYSA-N 0 3 414.509 4.249 20 0 HIADHN C[C@H](Cc1ccccc1C(F)(F)F)[NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1 ZINC000436541082 861841988 /nfs/dbraw/zinc/84/19/88/861841988.db2.gz SISWBGDUYURAQL-OAHLLOKOSA-N 0 3 406.448 4.236 20 0 HIADHN COc1ccc2cc([C@H](C)C(=O)NCC3(N4CCSCC4)CCCC3)ccc2c1 ZINC000031960075 847971799 /nfs/dbraw/zinc/97/17/99/847971799.db2.gz ZYTUIZYKWDEEGY-SFHVURJKSA-N 0 3 412.599 4.430 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1ccc(OC[C@@H]2CCCO2)cc1)c1ccsc1 ZINC000031988936 847975923 /nfs/dbraw/zinc/97/59/23/847975923.db2.gz DQVNVDJIHHRCDB-SFTDATJTSA-N 0 3 402.560 4.119 20 0 HIADHN CC(C)(C)OC(=O)Nc1cccc(C(=O)NCCCN2CCc3ccccc3C2)c1 ZINC000032400042 848018837 /nfs/dbraw/zinc/01/88/37/848018837.db2.gz WNSPYYFFMMKJPN-UHFFFAOYSA-N 0 3 409.530 4.212 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)c1cc2cc(Br)ccc2[nH]1 ZINC000032401463 848020537 /nfs/dbraw/zinc/02/05/37/848020537.db2.gz KXNCUZJZUQQJGG-UHFFFAOYSA-N 0 3 412.331 4.109 20 0 HIADHN CC[C@H](CNC(=O)Cc1csc(-c2ccccc2)n1)N1CCc2ccccc2C1 ZINC000032446128 848028586 /nfs/dbraw/zinc/02/85/86/848028586.db2.gz XYTHUEWXZFHKNO-JOCHJYFZSA-N 0 3 405.567 4.306 20 0 HIADHN Cc1ccc(C(=O)N(C[C@@H]2CC[N@H+](Cc3ccccc3)C2)CC(F)(F)F)c([O-])c1 ZINC000436578324 861858512 /nfs/dbraw/zinc/85/85/12/861858512.db2.gz WJWHWDKGDWOKME-GOSISDBHSA-N 0 3 406.448 4.227 20 0 HIADHN Cc1ccc(C(=O)N(C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)CC(F)(F)F)c([O-])c1 ZINC000436578324 861858516 /nfs/dbraw/zinc/85/85/16/861858516.db2.gz WJWHWDKGDWOKME-GOSISDBHSA-N 0 3 406.448 4.227 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)c2c(C)nn(-c3ccc(F)cc3)c2C)N(C)C)cc1 ZINC000032733659 848069543 /nfs/dbraw/zinc/06/95/43/848069543.db2.gz HLSDWISXZSIPDA-JOCHJYFZSA-N 0 3 408.521 4.223 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cccc(NC(=O)[C@H]2C[C@@H]2C)c1)c1cccc(OC)c1 ZINC000032949760 848095664 /nfs/dbraw/zinc/09/56/64/848095664.db2.gz WYTNIDQXNAXCCL-PDIWNELESA-N 0 3 423.557 4.103 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)c1cc(C2CC2)nn1-c1ccccc1 ZINC000036659963 848153316 /nfs/dbraw/zinc/15/33/16/848153316.db2.gz YIQULXGCMVROKT-XMMPIXPASA-N 0 3 400.526 4.317 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)c2c(C)nn(-c3ccccc3)c2Cl)N(C)C)cc1 ZINC000036700618 848156068 /nfs/dbraw/zinc/15/60/68/848156068.db2.gz JYPAWIAYWPYFEX-HXUWFJFHSA-N 0 3 410.949 4.429 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)CCc3cccc(Cl)c3)CC2)c1 ZINC000041479073 848218926 /nfs/dbraw/zinc/21/89/26/848218926.db2.gz OIZICXNRORZZBD-UHFFFAOYSA-N 0 3 413.993 4.300 20 0 HIADHN CSCC[C@H](NC(=O)OC(C)(C)C)C(=O)C(C#N)c1nc2ccccc2s1 ZINC000041499489 848222456 /nfs/dbraw/zinc/22/24/56/848222456.db2.gz ZXFSLTVKYNLRCG-JSGCOSHPSA-N 0 3 405.545 4.119 20 0 HIADHN CCOC(=O)N[C@@H](C(=O)C(C#N)c1nc(-c2ccc(Cl)cc2)cs1)C(C)C ZINC000041514012 848224975 /nfs/dbraw/zinc/22/49/75/848224975.db2.gz VRURLLFUSCAQOA-GDBMZVCRSA-N 0 3 405.907 4.410 20 0 HIADHN C[C@@H](NC(=O)OCc1ccccc1)C(=O)C(C#N)c1nc(-c2ccccc2)cs1 ZINC000041533247 848227140 /nfs/dbraw/zinc/22/71/40/848227140.db2.gz TUGXHNKBNVSJEW-CRAIPNDOSA-N 0 3 405.479 4.301 20 0 HIADHN C[C@@H](NC(=O)OC(C)(C)C)C(=O)C(C#N)c1nc2cc(C(F)(F)F)ccc2s1 ZINC000041548473 848230028 /nfs/dbraw/zinc/23/00/28/848230028.db2.gz GPLMJYVMCOJYSG-KOLCDFICSA-N 0 3 413.421 4.405 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)CCc3ncc(-c4ccccc4)o3)cc2)CC1 ZINC000041577881 848234445 /nfs/dbraw/zinc/23/44/45/848234445.db2.gz OHZOFQWATXSLSI-UHFFFAOYSA-N 0 3 418.541 4.050 20 0 HIADHN CCOC(=O)C1CCC(N(CC)Cc2csc(-c3ccc(O)c(OC)c3)n2)CC1 ZINC000436685086 861893358 /nfs/dbraw/zinc/89/33/58/861893358.db2.gz AVSCJZOOAHBKFD-UHFFFAOYSA-N 0 3 418.559 4.468 20 0 HIADHN CSc1cccc(NC(=O)NCCCCN2CCN(c3cccc(C)c3)CC2)c1 ZINC000043157016 848391245 /nfs/dbraw/zinc/39/12/45/848391245.db2.gz HVNYPQTTWKQBKV-UHFFFAOYSA-N 0 3 412.603 4.441 20 0 HIADHN CCN(CC)C(=O)c1cccc(NC(=O)NC[C@H](c2ccccc2)N2CCCC2)c1 ZINC000043499221 848432314 /nfs/dbraw/zinc/43/23/14/848432314.db2.gz GAZSHLGIXRJWRO-JOCHJYFZSA-N 0 3 408.546 4.127 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCc3nc4ccccc4s3)c(C)c2)CC1 ZINC000043521906 848434323 /nfs/dbraw/zinc/43/43/23/848434323.db2.gz VSMXRAWJCGCMME-UHFFFAOYSA-N 0 3 409.559 4.068 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCc3ccc(OC(F)F)cc3)c(C)c2)CC1 ZINC000043522823 848435475 /nfs/dbraw/zinc/43/54/75/848435475.db2.gz ODBCRNHTNDLJSO-UHFFFAOYSA-N 0 3 418.488 4.060 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=S)N[C@@H](C)c3ccccc3)CC2)c1 ZINC000044075676 848510811 /nfs/dbraw/zinc/51/08/11/848510811.db2.gz GHJJOVAXRMNDAU-NRFANRHFSA-N 0 3 410.631 4.123 20 0 HIADHN CN(C)CCN(CCc1ccccc1)C(=S)Nc1cccc(Br)c1 ZINC000044158131 848524416 /nfs/dbraw/zinc/52/44/16/848524416.db2.gz ZCZXWIKCDQAACB-UHFFFAOYSA-N 0 3 406.393 4.252 20 0 HIADHN CCc1ccccc1NC(=S)NCCCCN1CCN(Cc2ccccc2)CC1 ZINC000044238463 848536023 /nfs/dbraw/zinc/53/60/23/848536023.db2.gz UGURHPNZFBVSDG-UHFFFAOYSA-N 0 3 410.631 4.133 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1ccc(N2CCOCC2)cc1C)c1ccsc1 ZINC000044357965 848550779 /nfs/dbraw/zinc/55/07/79/848550779.db2.gz WLVMIQLZLNGVGC-NRFANRHFSA-N 0 3 416.591 4.098 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)Nc2cccc(CN(CC)C(C)=O)c2)N(C)C)cc1 ZINC000044381047 848554364 /nfs/dbraw/zinc/55/43/64/848554364.db2.gz KAEFHVOYYARYQF-HSZRJFAPSA-N 0 3 410.562 4.042 20 0 HIADHN Cc1ccc(NC(=O)NC(=O)[C@H](C)N[C@H](C)c2ccc(OC(F)F)cc2)c(C)c1 ZINC000044803506 848605838 /nfs/dbraw/zinc/60/58/38/848605838.db2.gz BSAOQJAFRCEXJZ-CABCVRRESA-N 0 3 405.445 4.292 20 0 HIADHN Cc1ccccc1CN1CCCN(C(=O)NCc2coc(-c3cccs3)n2)CC1 ZINC000045345181 848668016 /nfs/dbraw/zinc/66/80/16/848668016.db2.gz RIUNUDFLRRXZDA-UHFFFAOYSA-N 0 3 410.543 4.129 20 0 HIADHN Cc1cc(C)c(-c2csc(NC(=O)CN3CCN(C4CCCC4)CC3)n2)c(C)c1 ZINC000045768706 848724829 /nfs/dbraw/zinc/72/48/29/848724829.db2.gz JKRNDPFVDIYOJF-UHFFFAOYSA-N 0 3 412.603 4.234 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)NCc1ccnc(Oc2ccccc2)c1 ZINC000045997955 848769375 /nfs/dbraw/zinc/76/93/75/848769375.db2.gz FJXKMIUMZDVJTD-UHFFFAOYSA-N 0 3 404.514 4.147 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)N3CC[C@@H]3c3ccccc3)CC2)c1 ZINC000046867922 848950202 /nfs/dbraw/zinc/95/02/02/848950202.db2.gz DXLCVRGIAWOGHP-XMMPIXPASA-N 0 3 406.574 4.054 20 0 HIADHN CN(C)CCN(CCc1ccccc1)C(=O)c1ccc(C2SCCS2)cc1 ZINC000046917594 848958897 /nfs/dbraw/zinc/95/88/97/848958897.db2.gz JNHGRPASXGQPTL-UHFFFAOYSA-N 0 3 400.613 4.412 20 0 HIADHN CCOc1c(Br)cc(C(=O)Nc2cccc(CN(C)C)c2)cc1OC ZINC000047453122 849051014 /nfs/dbraw/zinc/05/10/14/849051014.db2.gz MKZDKXNGKGGMMJ-UHFFFAOYSA-N 0 3 407.308 4.170 20 0 HIADHN O=C(c1ccccc1[O-])N1CCC([NH2+][C@@H]2CCc3sc(Br)cc32)CC1 ZINC000436783268 861975305 /nfs/dbraw/zinc/97/53/05/861975305.db2.gz LNVHJULOKCKZKQ-OAHLLOKOSA-N 0 3 421.360 4.098 20 0 HIADHN CCCC(=O)Nc1cccc(NC(=O)NC[C@@H](c2cccs2)N2CCCC2)c1 ZINC000047715221 849097232 /nfs/dbraw/zinc/09/72/32/849097232.db2.gz MVDVMZGPYRTKBP-SFHVURJKSA-N 0 3 400.548 4.445 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)Nc1cc(F)c(N2CCCC2)c(F)c1 ZINC000047861267 849127969 /nfs/dbraw/zinc/12/79/69/849127969.db2.gz HIEOUUVZSQMYCX-UHFFFAOYSA-N 0 3 402.489 4.161 20 0 HIADHN COc1cc(C(C)=O)ccc1OC[C@H](O)CN(Cc1cccc(Cl)c1)C(C)C ZINC000047959203 849145038 /nfs/dbraw/zinc/14/50/38/849145038.db2.gz AADMFDCOFLNDBT-HXUWFJFHSA-N 0 3 405.922 4.202 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)Nc1cccc(OCC(F)(F)F)c1 ZINC000048076838 849160294 /nfs/dbraw/zinc/16/02/94/849160294.db2.gz BRTGIZOJCUDSFN-UHFFFAOYSA-N 0 3 413.415 4.363 20 0 HIADHN Cc1ccc(COc2ccc(CNCc3cccc(OCC(=O)N(C)C)c3)cc2)cc1 ZINC000048745667 849262560 /nfs/dbraw/zinc/26/25/60/849262560.db2.gz DUPGDBFBIFIZSS-UHFFFAOYSA-N 0 3 418.537 4.331 20 0 HIADHN CC(C)CCOc1ccc(CN[C@@H](C)c2ccc(S(=O)(=O)N(C)C)cc2)cc1 ZINC000048780212 849266914 /nfs/dbraw/zinc/26/69/14/849266914.db2.gz MCSMEXZJUSNHBQ-SFHVURJKSA-N 0 3 404.576 4.213 20 0 HIADHN NC(=O)C1CCN(Cc2cccc(NC(=O)c3ccc(-c4ccccc4)cc3)c2)CC1 ZINC000049770658 849328037 /nfs/dbraw/zinc/32/80/37/849328037.db2.gz IGXJVBPEIKGOTC-UHFFFAOYSA-N 0 3 413.521 4.303 20 0 HIADHN CN(C)[C@@H](CNC(=O)N1CCC[C@H]1c1nc2ccccc2s1)Cc1ccccc1 ZINC000049794799 849330174 /nfs/dbraw/zinc/33/01/74/849330174.db2.gz ASGLYQRPHPXNKT-QUCCMNQESA-N 0 3 408.571 4.316 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2ccc(N3C[C@@H](C)O[C@@H](C)C3)cc2)N(C)C)cc1 ZINC000050080064 849350266 /nfs/dbraw/zinc/35/02/66/849350266.db2.gz MWJRWKOCTBJVLE-SELNLUPBSA-N 0 3 410.562 4.033 20 0 HIADHN C[C@H]([NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1)c1ccccc1Br ZINC000436825911 862008093 /nfs/dbraw/zinc/00/80/93/862008093.db2.gz FTRATIPVPYMUNL-AWEZNQCLSA-N 0 3 403.320 4.110 20 0 HIADHN C[C@H]([NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1)c1ccc(F)cc1OC(F)F ZINC000436830358 862010813 /nfs/dbraw/zinc/01/08/13/862010813.db2.gz QNYKLVOMVFEOHV-ZDUSSCGKSA-N 0 3 408.420 4.088 20 0 HIADHN COc1ccc(OC)c(NC(=O)[C@H](C)N(C)C[C@@H]2CCCO[C@@H]2c2ccccc2)c1 ZINC000051133577 849435996 /nfs/dbraw/zinc/43/59/96/849435996.db2.gz DQDVJEDCZZIKEA-WCAVRKLYSA-N 0 3 412.530 4.131 20 0 HIADHN CCNC(=O)COc1ccc(CNC2(c3ccc(Cl)cc3)CCC2)cc1OC ZINC000051188698 849441095 /nfs/dbraw/zinc/44/10/95/849441095.db2.gz PTFVKBMKXGKROX-UHFFFAOYSA-N 0 3 402.922 4.033 20 0 HIADHN Cc1cc(N2CCSCC2)ccc1NC(=O)N1CCN(CCC(C)(C)C)CC1 ZINC000051649101 849499407 /nfs/dbraw/zinc/49/94/07/849499407.db2.gz CSDVKKOXSMLWKH-UHFFFAOYSA-N 0 3 404.624 4.134 20 0 HIADHN CC(=O)N[C@@H](C(=O)C(C#N)c1nc2cc(C(F)(F)F)ccc2s1)C1CCCC1 ZINC000051677674 849503093 /nfs/dbraw/zinc/50/30/93/849503093.db2.gz RUQPRASQFCYLDH-XJKSGUPXSA-N 0 3 409.433 4.186 20 0 HIADHN CNC(=O)c1ccc(CN(C)[C@@H](C)c2cccc(NC(=O)c3ccccc3)c2)cc1 ZINC000052073696 849547568 /nfs/dbraw/zinc/54/75/68/849547568.db2.gz DPRXEGDMJANYIN-SFHVURJKSA-N 0 3 401.510 4.492 20 0 HIADHN COc1ccc([C@H](C)NCc2ccc(N3CCOCC3)cc2)cc1Br ZINC000052918783 849645639 /nfs/dbraw/zinc/64/56/39/849645639.db2.gz BDEXHSKMIZSLQL-HNNXBMFYSA-N 0 3 405.336 4.145 20 0 HIADHN N#Cc1ccc(OCCC[NH+]2CCC(C(=O)Nc3cc(Cl)ccc3[O-])CC2)cc1 ZINC000053039017 849657632 /nfs/dbraw/zinc/65/76/32/849657632.db2.gz QXAJECIJDJNSMA-UHFFFAOYSA-N 0 3 413.905 4.037 20 0 HIADHN CCN(Cc1ccccc1NC(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1)C(C)=O ZINC000054409482 849862725 /nfs/dbraw/zinc/86/27/25/849862725.db2.gz QZCRMAACHMCAEW-AVRDEDQJSA-N 0 3 408.546 4.012 20 0 HIADHN Cc1ccc(COc2ccc(CNCc3cccc(NS(C)(=O)=O)c3)cc2)cc1 ZINC000055373353 850007712 /nfs/dbraw/zinc/00/77/12/850007712.db2.gz GVNWUJSCVWPWAP-UHFFFAOYSA-N 0 3 410.539 4.235 20 0 HIADHN CCN1CCN(c2ccc(N[C@@H](C)C(=O)Nc3ccc(F)cc3Cl)c(C)c2)CC1 ZINC000056170184 850268659 /nfs/dbraw/zinc/26/86/59/850268659.db2.gz SUBYFCSFEQWGCC-INIZCTEOSA-N 0 3 418.944 4.369 20 0 HIADHN CCN1CCN(c2ccc(N[C@H](C)C(=O)Nc3cccc(SC)c3)c(C)c2)CC1 ZINC000056170365 850270284 /nfs/dbraw/zinc/27/02/84/850270284.db2.gz GVVAFJMLJYOGLZ-GOSISDBHSA-N 0 3 412.603 4.298 20 0 HIADHN C[C@H](C[NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1)c1ccc(C(F)(F)F)cc1 ZINC000436934421 862112876 /nfs/dbraw/zinc/11/28/76/862112876.db2.gz GNIKOEFWLXKVMB-OAHLLOKOSA-N 0 3 406.448 4.409 20 0 HIADHN COc1cccc(NC(=O)N(CCN(C)C)Cc2ccc(Br)cc2)c1 ZINC000056515956 850381137 /nfs/dbraw/zinc/38/11/37/850381137.db2.gz RBNWDNZBXCTHDR-UHFFFAOYSA-N 0 3 406.324 4.053 20 0 HIADHN COc1ccc([C@@H]([NH2+]C2CCN(C(=O)c3ccccc3[O-])CC2)c2ccccc2)cc1 ZINC000436946760 862123163 /nfs/dbraw/zinc/12/31/63/862123163.db2.gz KDYSAWOFTLDXSZ-VWLOTQADSA-N 0 3 416.521 4.385 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)Nc1cccc(-c2nccs2)c1 ZINC000056777347 850479773 /nfs/dbraw/zinc/47/97/73/850479773.db2.gz VKUAIGHUJWRNSN-UHFFFAOYSA-N 0 3 402.589 4.293 20 0 HIADHN C[C@H](CN1CCC[C@@H](C)C1)NC(=O)N1CCC(C(=O)c2ccc(Cl)cc2)CC1 ZINC000056788648 850483827 /nfs/dbraw/zinc/48/38/27/850483827.db2.gz WKWJQJHMQQHIPD-IAGOWNOFSA-N 0 3 405.970 4.065 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)N[C@H]1CCOc2c(Cl)cccc21 ZINC000056806263 850490384 /nfs/dbraw/zinc/49/03/84/850490384.db2.gz HVLWJUDBLMEWRX-IBGZPJMESA-N 0 3 405.901 4.076 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)c1[nH]c2ccccc2c1Br ZINC000056885329 850509356 /nfs/dbraw/zinc/50/93/56/850509356.db2.gz PEOJHXAQBJOJLF-UHFFFAOYSA-N 0 3 412.331 4.109 20 0 HIADHN COc1cc(-c2nc(CN3CCC[C@@]3(CO)Cc3ccccc3)cs2)ccc1O ZINC000436962340 862143727 /nfs/dbraw/zinc/14/37/27/862143727.db2.gz NOTAAKZFEPCJMR-QHCPKHFHSA-N 0 3 410.539 4.094 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)C1(c2ccccc2C)CCOCC1)c1ccsc1 ZINC000057432933 850636746 /nfs/dbraw/zinc/63/67/46/850636746.db2.gz PRMCQFCJTINNKC-NRFANRHFSA-N 0 3 400.588 4.304 20 0 HIADHN Cc1ccc(NC(=O)C(C)C)cc1NC(=O)N(CCc1ccccc1)CCN(C)C ZINC000057541268 850661693 /nfs/dbraw/zinc/66/16/93/850661693.db2.gz KOODEPLTFAFEIJ-UHFFFAOYSA-N 0 3 410.562 4.228 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCc1ccc(N2CCCC2)cc1)c1cccc(OC)c1 ZINC000057562157 850668329 /nfs/dbraw/zinc/66/83/29/850668329.db2.gz PNJVFIANUHYRDY-XMMPIXPASA-N 0 3 424.589 4.178 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCc1ncc(-c2ccccc2)o1)c1cccc(OC)c1 ZINC000057562160 850668776 /nfs/dbraw/zinc/66/87/76/850668776.db2.gz GJEHZQDQDXVIJQ-NRFANRHFSA-N 0 3 422.529 4.233 20 0 HIADHN CN(C)[C@H](CNC(=O)Nc1ccc(OC(F)F)cc1OC(F)F)c1ccccc1 ZINC000057616141 850679621 /nfs/dbraw/zinc/67/96/21/850679621.db2.gz SPFICINOCXTIOI-OAHLLOKOSA-N 0 3 415.387 4.314 20 0 HIADHN CN(C)[C@@H](CNC(=O)Nc1ccc(OC(F)F)cc1OC(F)F)c1ccccc1 ZINC000057616139 850680705 /nfs/dbraw/zinc/68/07/05/850680705.db2.gz SPFICINOCXTIOI-HNNXBMFYSA-N 0 3 415.387 4.314 20 0 HIADHN COc1ccc([C@@H](CNC(=O)N[C@@H]2CCSc3ccccc32)N2CCCC2)cc1 ZINC000057769053 850711198 /nfs/dbraw/zinc/71/11/98/850711198.db2.gz KGWUPILNEPQJGG-NHCUHLMSSA-N 0 3 411.571 4.368 20 0 HIADHN COc1ccc([C@@H](CNC(=O)N[C@H]2CCSc3ccccc32)N2CCCC2)cc1 ZINC000057769056 850711335 /nfs/dbraw/zinc/71/13/35/850711335.db2.gz KGWUPILNEPQJGG-LEWJYISDSA-N 0 3 411.571 4.368 20 0 HIADHN O=C(Nc1cccc(OCC(F)(F)F)c1)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000058075803 850762464 /nfs/dbraw/zinc/76/24/64/850762464.db2.gz SLZCLVWABDONPT-SFHVURJKSA-N 0 3 407.436 4.414 20 0 HIADHN C[C@@H]1CC[C@@H](C)[NH+]1[C@@H]1CCCN(C(=O)c2cc(OCc3ccccc3)ccc2[O-])C1 ZINC000436989277 862166801 /nfs/dbraw/zinc/16/68/01/862166801.db2.gz NTPJYYDILFFCIW-SFHLNBCPSA-N 0 3 408.542 4.449 20 0 HIADHN C[C@H](Sc1nc2ccc(Cl)cc2[nH]1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000058593199 850863771 /nfs/dbraw/zinc/86/37/71/850863771.db2.gz AGWGIIJOKJLKCQ-WMLDXEAASA-N 0 3 414.962 4.088 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)CCCOc3cccc(C(C)=O)c3)c(C)c2)CC1 ZINC000058629718 850872741 /nfs/dbraw/zinc/87/27/41/850872741.db2.gz AKLKTHNKVWQRNS-UHFFFAOYSA-N 0 3 423.557 4.137 20 0 HIADHN CN(C)CCn1c2cc(NC(=O)CCc3ccc(C(C)(C)C)cc3)ccc2oc1=O ZINC000058738414 850907291 /nfs/dbraw/zinc/90/72/91/850907291.db2.gz WLZICRNNRMEAJM-UHFFFAOYSA-N 0 3 409.530 4.025 20 0 HIADHN CC(=O)c1cccc(OCCCC(=O)NC[C@@H]2CCCCN2Cc2ccccc2)c1 ZINC000058878713 850948850 /nfs/dbraw/zinc/94/88/50/850948850.db2.gz BYFIWKQJUTWSHA-QHCPKHFHSA-N 0 3 408.542 4.219 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)C[C@@H](NC(C)=O)c1ccc(Cl)cc1)c1ccsc1 ZINC000058954501 850967826 /nfs/dbraw/zinc/96/78/26/850967826.db2.gz UOQIKABTQMYVCY-UXHICEINSA-N 0 3 421.994 4.168 20 0 HIADHN CC[C@H](c1ccccc1)[C@H]1CCCN1CC(=O)NCC(=O)Nc1c(C)cc(C)cc1C ZINC000058959162 850969477 /nfs/dbraw/zinc/96/94/77/850969477.db2.gz ZEYVLBCREXEFNN-DHIUTWEWSA-N 0 3 421.585 4.325 20 0 HIADHN CCN(C[C@H]1COc2ccccc2O1)C(=O)NC[C@@H](c1ccsc1)N(CC)CC ZINC000059308173 850994817 /nfs/dbraw/zinc/99/48/17/850994817.db2.gz GRKNMLYULJOUTE-OALUTQOASA-N 0 3 417.575 4.003 20 0 HIADHN CN(C)CCN(C(=O)C[C@@H](NC(=O)c1ccccc1)c1ccccc1)c1ccccc1 ZINC000060208824 851052167 /nfs/dbraw/zinc/05/21/67/851052167.db2.gz OXTCPNLOFPSRBL-XMMPIXPASA-N 0 3 415.537 4.143 20 0 HIADHN CCN1CCN(C[C@@H](C)CNc2nc(C3CC3)nc3sc4c(c32)CCCC4)CC1 ZINC000060380157 851084696 /nfs/dbraw/zinc/08/46/96/851084696.db2.gz UCKFTZXIDGDTHT-INIZCTEOSA-N 0 3 413.635 4.133 20 0 HIADHN CCCCc1ccc(NC(=S)NCc2ccc(CN3CCN(C)CC3)cc2)cc1 ZINC000060432819 851097849 /nfs/dbraw/zinc/09/78/49/851097849.db2.gz SYPIWGWVDXDHSQ-UHFFFAOYSA-N 0 3 410.631 4.263 20 0 HIADHN CN1CCN(Cc2ccc(CNC(=S)Nc3ccc4ccccc4c3)cc2)CC1 ZINC000060432815 851098289 /nfs/dbraw/zinc/09/82/89/851098289.db2.gz HVXBZUQFUMHPFA-UHFFFAOYSA-N 0 3 404.583 4.074 20 0 HIADHN Cn1nc(C(=O)C(C#N)c2nc(-c3ccc(Cl)cc3)cs2)c2ccccc2c1=O ZINC000060477674 851114001 /nfs/dbraw/zinc/11/40/01/851114001.db2.gz ZARFFPNISWXKDE-INIZCTEOSA-N 0 3 420.881 4.200 20 0 HIADHN CC(C)(C(=O)NCCCN1CCc2ccccc2C1)c1ccc(Br)cc1 ZINC000060505455 851125773 /nfs/dbraw/zinc/12/57/73/851125773.db2.gz ZMMAZHAZYBAZIG-UHFFFAOYSA-N 0 3 415.375 4.291 20 0 HIADHN CCCc1noc2nc(C3CC3)cc(C(=O)N(CCc3ccccc3)CCN(C)C)c12 ZINC000060536710 851137700 /nfs/dbraw/zinc/13/77/00/851137700.db2.gz WQJGBZQNRYQCNY-UHFFFAOYSA-N 0 3 420.557 4.299 20 0 HIADHN O=S(=O)(NCC1CCN(Cc2cccs2)CC1)c1cccc(Cl)c1Cl ZINC000060923554 851249577 /nfs/dbraw/zinc/24/95/77/851249577.db2.gz QKERVEQTQHCQRV-UHFFFAOYSA-N 0 3 419.399 4.245 20 0 HIADHN COc1cccc(CNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1OC(F)F ZINC000060953086 851256435 /nfs/dbraw/zinc/25/64/35/851256435.db2.gz MDBFXNVQFMNPNV-CQSZACIVSA-N 0 3 407.335 4.018 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CNC[C@@H](O)c1ccc(OC(F)(F)F)cc1 ZINC000060953015 851256462 /nfs/dbraw/zinc/25/64/62/851256462.db2.gz CFRWOJPBJYPVAZ-OAQYLSRUSA-N 0 3 419.447 4.270 20 0 HIADHN COc1ccc(CNCc2ccc(C#N)cc2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000061079271 851290563 /nfs/dbraw/zinc/29/05/63/851290563.db2.gz IBXPWXWLWCJISX-UHFFFAOYSA-N 0 3 403.438 4.344 20 0 HIADHN CC(C)[C@H](NC(=O)c1ccc(N2CCN(C(C)C)CC2)cc1)c1nc2ccccc2[nH]1 ZINC000061114751 851297352 /nfs/dbraw/zinc/29/73/52/851297352.db2.gz LJKCPWLUYQDFJF-QHCPKHFHSA-N 0 3 419.573 4.220 20 0 HIADHN COc1ccc([C@H](NC(=O)NC[C@@H](Cc2ccccc2)N(C)C)c2ccccc2)cc1 ZINC000061194770 851314613 /nfs/dbraw/zinc/31/46/13/851314613.db2.gz BICWMADOJXIINB-ILBGXUMGSA-N 0 3 417.553 4.257 20 0 HIADHN O=C(NCc1cccnc1OC1CCCC1)NC[C@H](c1ccccc1)N1CCCC1 ZINC000061229721 851322699 /nfs/dbraw/zinc/32/26/99/851322699.db2.gz OBUCTWZZIFELPW-JOCHJYFZSA-N 0 3 408.546 4.039 20 0 HIADHN Cc1cnn(-c2ccc(C(=O)Nc3ccc(CCN4CCSCC4)cc3)cc2)c1 ZINC000061287645 851339860 /nfs/dbraw/zinc/33/98/60/851339860.db2.gz PKWRKIQJNGPFEF-UHFFFAOYSA-N 0 3 406.555 4.024 20 0 HIADHN CCOC(=O)/C=C/c1ccc(NC(=O)NC[C@@H](c2ccc(CC)cc2)N(C)C)cc1 ZINC000061375484 851359104 /nfs/dbraw/zinc/35/91/04/851359104.db2.gz ZINADYLAAKEFJE-GSTVHYHFSA-N 0 3 409.530 4.250 20 0 HIADHN Cc1cc(C)n(Cc2ccc(C(=O)NC[C@H](c3ccc(C)cc3)N3CCCC3)cc2)n1 ZINC000061502304 851389784 /nfs/dbraw/zinc/38/97/84/851389784.db2.gz UPAICALBWIRWLU-RUZDIDTESA-N 0 3 416.569 4.424 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Cc2csc(-c3cccnc3)n2)N2CCCC2)cc1 ZINC000061503091 851391055 /nfs/dbraw/zinc/39/10/55/851391055.db2.gz NFTJPXBOTAJKED-NRFANRHFSA-N 0 3 406.555 4.009 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2cc(F)ccc2NC(=O)[C@@H]2C[C@H]2C)N2CCCC2)cc1 ZINC000061502680 851391153 /nfs/dbraw/zinc/39/11/53/851391153.db2.gz RNDGIAMGGSUHOH-HCLVMJGWSA-N 0 3 423.532 4.296 20 0 HIADHN Cc1ccccc1CN1CCCN(C(=O)Nc2ccc(OCC(F)(F)F)nc2)CC1 ZINC000061521071 851394652 /nfs/dbraw/zinc/39/46/52/851394652.db2.gz HUZHFAWIMRLXPA-UHFFFAOYSA-N 0 3 422.451 4.071 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)CSCc2cc(-c3cccs3)on2)o1 ZINC000061638029 851418224 /nfs/dbraw/zinc/41/82/24/851418224.db2.gz ZLVSZJYASRBCPB-UHFFFAOYSA-N 0 3 419.572 4.128 20 0 HIADHN O=C(NC[C@H]1CN2CCC[C@H]2CO1)c1ccc(-c2ccc(Cl)c(Cl)c2)s1 ZINC000061649041 851420105 /nfs/dbraw/zinc/42/01/05/851420105.db2.gz CAOVWAAOGZJJDW-KBPBESRZSA-N 0 3 411.354 4.315 20 0 HIADHN COCCOCc1cccc(NC(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)c1 ZINC000061772373 851446464 /nfs/dbraw/zinc/44/64/64/851446464.db2.gz GZHQULBZYCTWOG-QHCPKHFHSA-N 0 3 411.546 4.117 20 0 HIADHN CCCC(=O)Nc1ccc(CNC(=O)NC[C@H](CC)N2CCc3ccccc3C2)cc1 ZINC000061953482 851478267 /nfs/dbraw/zinc/47/82/67/851478267.db2.gz PWLQKYDAMGIDSR-QHCPKHFHSA-N 0 3 422.573 4.061 20 0 HIADHN Cc1sc2nc([C@H](C)NCC3(c4ccccc4C)CCOCC3)[nH]c(=O)c2c1C ZINC000062240220 851513735 /nfs/dbraw/zinc/51/37/35/851513735.db2.gz QNMWWGQRAMNBSL-INIZCTEOSA-N 0 3 411.571 4.309 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)Nc1ccc(OC(F)(F)F)cc1 ZINC000062372650 851531623 /nfs/dbraw/zinc/53/16/23/851531623.db2.gz OHTLQNGNKCRAFD-UHFFFAOYSA-N 0 3 417.378 4.459 20 0 HIADHN COc1cc(OC)c(NC(=O)N(CCN(C)C)Cc2cccc(F)c2)cc1Cl ZINC000062375869 851533005 /nfs/dbraw/zinc/53/30/05/851533005.db2.gz TZKPXTRRYQYAQD-UHFFFAOYSA-N 0 3 409.889 4.092 20 0 HIADHN Cc1nc2ccc(NC(=O)N(CCN(C)C)Cc3ccc(F)cc3F)cc2s1 ZINC000062375153 851533388 /nfs/dbraw/zinc/53/33/88/851533388.db2.gz QNGCSMVDBYXIDM-UHFFFAOYSA-N 0 3 404.486 4.479 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)Nc1nnc(-c2ccsc2)s1 ZINC000062406808 851543715 /nfs/dbraw/zinc/54/37/15/851543715.db2.gz DQVBDDBFDLRVOJ-UHFFFAOYSA-N 0 3 423.514 4.141 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)NCCCSc1ccc(F)cc1 ZINC000062474505 851559239 /nfs/dbraw/zinc/55/92/39/851559239.db2.gz QDCPJDCHVGOJOF-UHFFFAOYSA-N 0 3 407.530 4.220 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)NCc1ccc(OC(F)F)cc1 ZINC000062475411 851559277 /nfs/dbraw/zinc/55/92/77/851559277.db2.gz UCKYCJPUTPPKIN-UHFFFAOYSA-N 0 3 411.880 4.215 20 0 HIADHN CC(C)OCCCNC(=O)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000062474099 851559304 /nfs/dbraw/zinc/55/93/04/851559304.db2.gz FIAKQQBOCVAMAQ-UHFFFAOYSA-N 0 3 416.393 4.416 20 0 HIADHN COc1ccc([C@H](NC(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)C2CC2)cc1 ZINC000062476952 851560288 /nfs/dbraw/zinc/56/02/88/851560288.db2.gz FHFAAXVDJUFOKC-JOCHJYFZSA-N 0 3 417.500 4.198 20 0 HIADHN COc1ccc2ccccc2c1CNC(=O)N(CCN(C)C)Cc1cccc(F)c1 ZINC000062478595 851560414 /nfs/dbraw/zinc/56/04/14/851560414.db2.gz HERXUDNQGPOJDS-UHFFFAOYSA-N 0 3 409.505 4.261 20 0 HIADHN C[C@H](NC(=O)N(CCN(C)C)Cc1cccc(F)c1)c1cccc(OC(F)F)c1 ZINC000062486050 851562645 /nfs/dbraw/zinc/56/26/45/851562645.db2.gz HNNYFEVEHWXMNI-HNNXBMFYSA-N 0 3 409.452 4.262 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)NCc1csc2ccccc12 ZINC000062486802 851562733 /nfs/dbraw/zinc/56/27/33/851562733.db2.gz JEGYBNKNIPKFCO-UHFFFAOYSA-N 0 3 403.498 4.453 20 0 HIADHN CC(C)Oc1cccc(CNC(=O)N(CCN(C)C)Cc2ccc(F)cc2F)c1 ZINC000062488836 851564075 /nfs/dbraw/zinc/56/40/75/851564075.db2.gz VTISZZSMFFCKGV-UHFFFAOYSA-N 0 3 405.489 4.025 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)N[C@@H]1CCCOc2ccc(F)cc21 ZINC000062500170 851565851 /nfs/dbraw/zinc/56/58/51/851565851.db2.gz YWKISKHJSVFVIM-HXUWFJFHSA-N 0 3 419.928 4.466 20 0 HIADHN COc1ccc(CC[C@H](C)NC(=O)N2CCCN(Cc3ccccc3C)CC2)cc1 ZINC000062931883 851608999 /nfs/dbraw/zinc/60/89/99/851608999.db2.gz SOFYZQNYLDUOJS-NRFANRHFSA-N 0 3 409.574 4.242 20 0 HIADHN CC(=O)Nc1cccc([C@@H](C)N(Cc2ccccc2)C(=S)NC2CCN(C)CC2)c1 ZINC000063146777 851622378 /nfs/dbraw/zinc/62/23/78/851622378.db2.gz LBTKADAKFOHCOF-GOSISDBHSA-N 0 3 424.614 4.177 20 0 HIADHN O=S(=O)([N-]CC1CC[NH+](Cc2ccccc2)CC1)c1c(Cl)cccc1Cl ZINC000063182209 851629536 /nfs/dbraw/zinc/62/95/36/851629536.db2.gz REPFIDRHLMMHBA-UHFFFAOYSA-N 0 3 413.370 4.184 20 0 HIADHN CCOc1cccc([C@@H](C)NC(=O)N(CCN(C)C)Cc2ccc(F)cc2F)c1 ZINC000063404528 851680897 /nfs/dbraw/zinc/68/08/97/851680897.db2.gz VDYAMMYCFBFTBF-MRXNPFEDSA-N 0 3 405.489 4.198 20 0 HIADHN CCN(CC)c1ccc(/C=[NH+]/C[C@@H](O)COc2cccc(C(F)(F)F)c2)c([O-])c1 ZINC000063427618 851686462 /nfs/dbraw/zinc/68/64/62/851686462.db2.gz NRJYBAOSZCKHOZ-LLXCYVELSA-N 0 3 410.436 4.116 20 0 HIADHN CC(C)(C)N1CCCN(C(=O)CSc2nnc(-c3ccc4ccccc4c3)o2)CC1 ZINC000063722207 851747771 /nfs/dbraw/zinc/74/77/71/851747771.db2.gz MHWDDCSNYFZXJU-UHFFFAOYSA-N 0 3 424.570 4.315 20 0 HIADHN CCN(Cc1cc(Br)ccc1F)C(=O)NCCN(C)Cc1ccccc1 ZINC000063789282 851763854 /nfs/dbraw/zinc/76/38/54/851763854.db2.gz PZURNGLPPLBKCU-UHFFFAOYSA-N 0 3 422.342 4.252 20 0 HIADHN COC(=O)COc1c(C)cc(CNCc2ccc(Oc3cccnc3)c(F)c2)cc1C ZINC000063916445 851793426 /nfs/dbraw/zinc/79/34/26/851793426.db2.gz YSRVIVBGUQLKBM-UHFFFAOYSA-N 0 3 424.472 4.471 20 0 HIADHN COc1ccc(C(=O)C2CCN(C(=O)c3cccc(CN4CCCC4)c3)CC2)cc1 ZINC000063916134 851793586 /nfs/dbraw/zinc/79/35/86/851793586.db2.gz ICIPSRLXSOPTKQ-UHFFFAOYSA-N 0 3 406.526 4.026 20 0 HIADHN N#Cc1ccc(F)c(COC(=O)C2CCN(c3cc(Cl)ccc3Cl)C2=O)c1 ZINC000064072308 851824470 /nfs/dbraw/zinc/82/44/70/851824470.db2.gz VFHJVQJCJYDYLV-AWEZNQCLSA-N 0 3 407.228 4.100 20 0 HIADHN Cc1ccc([C@H](CNC(=O)NCc2cc(-c3ccccc3)no2)N2CCCC2)cc1 ZINC000064237056 851855320 /nfs/dbraw/zinc/85/53/20/851855320.db2.gz DFMOUSMITGOEEU-QHCPKHFHSA-N 0 3 404.514 4.286 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)c1ccc2noc(-c3ccc(F)cc3)c2c1 ZINC000437105845 862293925 /nfs/dbraw/zinc/29/39/25/862293925.db2.gz FJKWFGRYBMTUDX-UHFFFAOYSA-N 0 3 407.445 4.431 20 0 HIADHN S=C(NCCSc1ccccc1)NC[C@H]1CCCN(Cc2cccs2)C1 ZINC000064377912 851882810 /nfs/dbraw/zinc/88/28/10/851882810.db2.gz HDRSGDZWMLCCMR-QGZVFWFLSA-N 0 3 405.658 4.217 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)c1cc(Br)c[nH]1 ZINC000064470586 851905344 /nfs/dbraw/zinc/90/53/44/851905344.db2.gz BTPCDKMMZGOVKT-UHFFFAOYSA-N 0 3 418.257 4.000 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cnn(-c2ccccc2Cl)c1)c1ccsc1 ZINC000064488538 851911808 /nfs/dbraw/zinc/91/18/08/851911808.db2.gz FELJDOWTICAKFJ-IBGZPJMESA-N 0 3 402.951 4.400 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)c1cnn(-c2ccccc2Cl)c1 ZINC000064497705 851913828 /nfs/dbraw/zinc/91/38/28/851913828.db2.gz WCZLULVVICCTFL-UHFFFAOYSA-N 0 3 418.875 4.008 20 0 HIADHN COC(=O)c1ccc(NC(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)cc1 ZINC000064530090 851921647 /nfs/dbraw/zinc/92/16/47/851921647.db2.gz BMJCELZMOZFUMB-UHFFFAOYSA-N 0 3 423.435 4.088 20 0 HIADHN COc1ccc(CCNC(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)cc1 ZINC000064752946 851976433 /nfs/dbraw/zinc/97/64/33/851976433.db2.gz YTRMYJUXNPJCAY-UHFFFAOYSA-N 0 3 423.479 4.030 20 0 HIADHN Cc1cc(NC(=O)c2cc(F)c(F)cc2F)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000437124928 862314253 /nfs/dbraw/zinc/31/42/53/862314253.db2.gz JMAMVHYGPOBABA-INIZCTEOSA-N 0 3 414.431 4.308 20 0 HIADHN CCOC(=O)C1=C(C)NC(SC[C@@H](O)c2ccccc2F)=N[C@@H]1c1ccccc1 ZINC000064855251 852006727 /nfs/dbraw/zinc/00/67/27/852006727.db2.gz WIUNZFPWSHDYIS-UYAOXDASSA-N 0 3 414.502 4.130 20 0 HIADHN CCCCNC(=O)[C@@H]1CC[C@H](C)N(Cc2cccc(C(=O)Nc3ccccc3)c2)C1 ZINC000064995458 852036403 /nfs/dbraw/zinc/03/64/03/852036403.db2.gz QOKOWKFGWGUMPO-SIKLNZKXSA-N 0 3 407.558 4.456 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1c(C)nn(C)c1Cl)c1ccc(C(F)(F)F)cc1 ZINC000065121797 852071932 /nfs/dbraw/zinc/07/19/32/852071932.db2.gz CKESYFVMQNHCDA-HNNXBMFYSA-N 0 3 416.875 4.214 20 0 HIADHN CCCNC(=O)[C@@H]1CCC[N@H+](Cc2c([O-])ccc3cc(Br)ccc32)C1 ZINC000065188679 852085226 /nfs/dbraw/zinc/08/52/26/852085226.db2.gz UYHCSAXOANNGDK-OAHLLOKOSA-N 0 3 405.336 4.046 20 0 HIADHN CCCNC(=O)[C@@H]1CCC[N@@H+](Cc2c([O-])ccc3cc(Br)ccc32)C1 ZINC000065188679 852085234 /nfs/dbraw/zinc/08/52/34/852085234.db2.gz UYHCSAXOANNGDK-OAHLLOKOSA-N 0 3 405.336 4.046 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)Nc1ccc2ccccc2c1)c1ccc(N2CCOCC2)cc1 ZINC000065278411 852097448 /nfs/dbraw/zinc/09/74/48/852097448.db2.gz ZWYVDJLTZIUBIN-MOPGFXCFSA-N 0 3 403.526 4.354 20 0 HIADHN Cc1ccc(Cl)cc1NC(=O)[C@H](C)N[C@H](C)c1ccc(N2CCOCC2)cc1 ZINC000065278370 852097754 /nfs/dbraw/zinc/09/77/54/852097754.db2.gz ZACRFPJHXFZGEI-SJORKVTESA-N 0 3 401.938 4.163 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2cc(F)c(N3CCCC3)c(F)c2)N(C)C)cc1 ZINC000065413653 852123785 /nfs/dbraw/zinc/12/37/85/852123785.db2.gz MWZJLPVPFXWTCH-HXUWFJFHSA-N 0 3 402.489 4.298 20 0 HIADHN COCCOc1c(Cl)cccc1NC(=O)NC[C@H](c1ccc(C)cc1)N(C)C ZINC000065420109 852126940 /nfs/dbraw/zinc/12/69/40/852126940.db2.gz OIFPTBSCWLOPBY-LJQANCHMSA-N 0 3 405.926 4.098 20 0 HIADHN COc1cc(C)ccc1Oc1ccc(NC(=O)NCCN(C)Cc2ccccc2)cn1 ZINC000065445936 852136323 /nfs/dbraw/zinc/13/63/23/852136323.db2.gz SIBWKWFVGCTIEF-UHFFFAOYSA-N 0 3 420.513 4.444 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N(C)Cc2ccccc2OC(F)(F)F)N(C)C)cc1 ZINC000065466634 852143805 /nfs/dbraw/zinc/14/38/05/852143805.db2.gz UWNUHPKFGVJIKA-SFHVURJKSA-N 0 3 409.452 4.338 20 0 HIADHN Cc1ccc([C@H](CNC(=O)NCc2cccnc2Oc2cccc(F)c2)N(C)C)cc1 ZINC000065469592 852145205 /nfs/dbraw/zinc/14/52/05/852145205.db2.gz LGKCFGWURCZXCF-QFIPXVFZSA-N 0 3 422.504 4.424 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N(C)Cc2ccc(Br)cc2)N(C)C)cc1 ZINC000065470382 852145436 /nfs/dbraw/zinc/14/54/36/852145436.db2.gz WEYYAKRZRHMVFK-IBGZPJMESA-N 0 3 404.352 4.202 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N(C)Cc2ccc(OC(F)(F)F)cc2)N(C)C)cc1 ZINC000065469650 852145470 /nfs/dbraw/zinc/14/54/70/852145470.db2.gz ROYRARMHRJWKPY-IBGZPJMESA-N 0 3 409.452 4.338 20 0 HIADHN CCOC(=O)N(C)c1ccc(NC(=O)NCC(C)(C)N2CCc3ccccc3C2)cc1 ZINC000065472983 852147405 /nfs/dbraw/zinc/14/74/05/852147405.db2.gz XQNVMECNYHNMMD-UHFFFAOYSA-N 0 3 424.545 4.238 20 0 HIADHN CCOC(=O)N(C)c1ccc(NC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000065472988 852147607 /nfs/dbraw/zinc/14/76/07/852147607.db2.gz BWYXJKKMWWKXPW-FQEVSTJZSA-N 0 3 410.518 4.065 20 0 HIADHN Cc1cc(NC(=O)c2cccc(F)c2)sc1C(=O)N[C@@H](C)CN1CCC[C@H](C)C1 ZINC000065674930 852214675 /nfs/dbraw/zinc/21/46/75/852214675.db2.gz BNOREOJFFYDTPZ-HOCLYGCPSA-N 0 3 417.550 4.298 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=S)NCCSc1ccccc1 ZINC000065704347 852225491 /nfs/dbraw/zinc/22/54/91/852225491.db2.gz QULVIXIWLWMQGI-UHFFFAOYSA-N 0 3 408.036 4.370 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=S)Nc1ccc(OC(F)F)cc1 ZINC000065704589 852226369 /nfs/dbraw/zinc/22/63/69/852226369.db2.gz GAGJVLMDMMKBAR-UHFFFAOYSA-N 0 3 415.456 4.327 20 0 HIADHN CN(C)CCN(C(=O)c1nc(-c2cccs2)n(-c2ccccc2)n1)C1CCCCC1 ZINC000065745901 852242218 /nfs/dbraw/zinc/24/22/18/852242218.db2.gz PXLVJERNAAVDEZ-UHFFFAOYSA-N 0 3 423.586 4.332 20 0 HIADHN Cc1c(C(=O)N(CCN(C)C)Cc2ccc(F)cc2)cnn1-c1cccc(Cl)c1 ZINC000065931625 852322258 /nfs/dbraw/zinc/32/22/58/852322258.db2.gz FHSJZNCOUQKYIU-UHFFFAOYSA-N 0 3 414.912 4.177 20 0 HIADHN COCCn1cc(C(=O)N(CCN(C)C)Cc2cccc(Cl)c2)c2ccccc21 ZINC000065936500 852324731 /nfs/dbraw/zinc/32/47/31/852324731.db2.gz FSLFZBKZMDDZJG-UHFFFAOYSA-N 0 3 413.949 4.145 20 0 HIADHN COc1cc(C(=O)N(CCN(C)C)Cc2cccc(Cl)c2)ccc1OC(C)C ZINC000065937239 852324786 /nfs/dbraw/zinc/32/47/86/852324786.db2.gz KTYPJXJPBJYJRA-UHFFFAOYSA-N 0 3 404.938 4.340 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)CCc1nc2ccccc2s1 ZINC000065937225 852324944 /nfs/dbraw/zinc/32/49/44/852324944.db2.gz FYTNJXFFDPIVOP-UHFFFAOYSA-N 0 3 401.963 4.473 20 0 HIADHN CC(C)c1cc(C(=O)N(CCN(C)C)Cc2ccc(F)cc2F)nn1C(C)(C)C ZINC000065937586 852327001 /nfs/dbraw/zinc/32/70/01/852327001.db2.gz VAAIJMJOODHEOB-UHFFFAOYSA-N 0 3 406.521 4.244 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)[C@H]1Cc2ccccc2S1 ZINC000065938979 852328420 /nfs/dbraw/zinc/32/84/20/852328420.db2.gz IYPAZASXSTWLMO-LJQANCHMSA-N 0 3 408.489 4.313 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)c1ccc(N(C)C)c(F)c1 ZINC000065938867 852328482 /nfs/dbraw/zinc/32/84/82/852328482.db2.gz UDJIIOBEMFCHSC-UHFFFAOYSA-N 0 3 411.443 4.115 20 0 HIADHN Cc1cc(NC(=O)C(C)(C)C)sc1C(=O)N(CCN(C)C)Cc1cccc(F)c1 ZINC000065939822 852329725 /nfs/dbraw/zinc/32/97/25/852329725.db2.gz HWICIZOFMSMIFZ-UHFFFAOYSA-N 0 3 419.566 4.384 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)NCc1ccc(N(C)C)cc1 ZINC000065984113 852339760 /nfs/dbraw/zinc/33/97/60/852339760.db2.gz KJVWYSVPHPYWHA-UHFFFAOYSA-N 0 3 422.495 4.045 20 0 HIADHN COc1cc(CNCc2ccc(-c3ccccc3)s2)ccc1OCC(=O)N(C)C ZINC000065981216 852340137 /nfs/dbraw/zinc/34/01/37/852340137.db2.gz WOFQKMXMOVFEEA-UHFFFAOYSA-N 0 3 410.539 4.181 20 0 HIADHN C[C@@H](NC(=O)NC[C@H](c1ccccc1)N1CCCC1)c1ccc(N2CCCC2=O)cc1 ZINC000065995202 852348800 /nfs/dbraw/zinc/34/88/00/852348800.db2.gz TWAANTAZNXVYSX-AUSIDOKSSA-N 0 3 420.557 4.011 20 0 HIADHN Cc1cc(C)n(-c2cccc(NC(=O)NC[C@@H](c3ccccc3)N3CCCC3)c2)n1 ZINC000071919675 852431370 /nfs/dbraw/zinc/43/13/70/852431370.db2.gz RNXJXIDPQNHCSG-QHCPKHFHSA-N 0 3 403.530 4.448 20 0 HIADHN CN1CCN(Cc2ccc(CNC(=O)c3sccc3-c3ccccc3)cc2)CC1 ZINC000071958752 852445804 /nfs/dbraw/zinc/44/58/04/852445804.db2.gz SJNHSZGROPOAFD-UHFFFAOYSA-N 0 3 405.567 4.093 20 0 HIADHN Cc1ccc(C(C)C)c(OCC(=O)NCCCCN2CCN(c3ccccc3)CC2)c1 ZINC000071999029 852456521 /nfs/dbraw/zinc/45/65/21/852456521.db2.gz SINCFFHLNATNSQ-UHFFFAOYSA-N 0 3 423.601 4.216 20 0 HIADHN O=C(CN(Cc1ccccc1)CC1CCC1)N1CCC[C@H]1c1ccc2c(c1)OCCO2 ZINC000072031960 852474476 /nfs/dbraw/zinc/47/44/76/852474476.db2.gz DGLXPTSAVACRMU-QHCPKHFHSA-N 0 3 420.553 4.424 20 0 HIADHN CC(C)COC(=O)Nc1cccc(NC(=O)N(CCN(C)C)Cc2ccccc2)c1 ZINC000072033367 852475618 /nfs/dbraw/zinc/47/56/18/852475618.db2.gz RZZMKOHQIORQQH-UHFFFAOYSA-N 0 3 412.534 4.487 20 0 HIADHN CN(C)C(=O)c1cccc(NC(=O)CNC2(c3ccc(Cl)cc3)CCCCC2)c1 ZINC000072063246 852492233 /nfs/dbraw/zinc/49/22/33/852492233.db2.gz BJGDRKPUSTWLOI-UHFFFAOYSA-N 0 3 413.949 4.430 20 0 HIADHN CC[C@H](CC(=O)N1CCC[C@H](CN2CCN(c3ccccn3)CC2)C1)c1ccccc1 ZINC000078414348 852513972 /nfs/dbraw/zinc/51/39/72/852513972.db2.gz DVAMODVHRXQQJZ-DHIUTWEWSA-N 0 3 420.601 4.026 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2ccccc2-c2nc(C(C)(C)C)no2)N(C)C)cc1 ZINC000078494599 852516011 /nfs/dbraw/zinc/51/60/11/852516011.db2.gz MUWIYHOKGDSSGE-FQEVSTJZSA-N 0 3 406.530 4.375 20 0 HIADHN CSc1nc(-c2ccco2)nc(C)c1C(=O)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000097089769 852581581 /nfs/dbraw/zinc/58/15/81/852581581.db2.gz HFGUZQIDJAVRDU-SFHVURJKSA-N 0 3 422.554 4.334 20 0 HIADHN C[C@@H](SCC(=O)N[C@H](CN1CCCC1)c1ccccc1)c1nc2ccccc2[nH]1 ZINC000097121363 852584063 /nfs/dbraw/zinc/58/40/63/852584063.db2.gz VXVAKVJDZPVIDD-DYESRHJHSA-N 0 3 408.571 4.310 20 0 HIADHN C[C@H](NC(=O)N[C@@H](CN1CCCC1)c1ccccc1)c1ccc(OC(F)F)cc1 ZINC000097204864 852588870 /nfs/dbraw/zinc/58/88/70/852588870.db2.gz ZIRSSAWPGMMPTN-JXFKEZNVSA-N 0 3 403.473 4.485 20 0 HIADHN CC[C@@H](C)[C@H](C(=O)Nc1cccc(CN2CCC(C(N)=O)CC2)c1)c1ccccc1 ZINC000097393397 852606654 /nfs/dbraw/zinc/60/66/54/852606654.db2.gz PEJLRFLWTYGKBK-JPYJTQIMSA-N 0 3 407.558 4.152 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)N1CCCCC[C@H]1c1ccncc1 ZINC000097438570 852612663 /nfs/dbraw/zinc/61/26/63/852612663.db2.gz BOOJCERBECWOJK-FQEVSTJZSA-N 0 3 402.608 4.070 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N[C@H](C)[C@@H]3Oc4ccccc4[C@@H]3C)c(C)c2)CC1 ZINC000437183749 862375855 /nfs/dbraw/zinc/37/58/55/862375855.db2.gz WPWOKAZJINFBLX-XLNZFTOWSA-N 0 3 422.573 4.212 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cc(F)cc2[nH]c(=S)[nH]c21)c1cccc(OC)c1 ZINC000097507805 852621592 /nfs/dbraw/zinc/62/15/92/852621592.db2.gz LZOQJDAUJPYYDZ-SFHVURJKSA-N 0 3 416.522 4.186 20 0 HIADHN C[C@H](SCC(=O)NC[C@@H](c1ccccc1)N1CCCC1)c1nc2ccccc2[nH]1 ZINC000097656483 852645231 /nfs/dbraw/zinc/64/52/31/852645231.db2.gz CNONAFOFURRISD-UWJYYQICSA-N 0 3 408.571 4.310 20 0 HIADHN O=C(N[C@H]1CCN(Cc2ccccc2)C1)C1(c2ccc(Br)cc2)CCC1 ZINC000105701770 852723202 /nfs/dbraw/zinc/72/32/02/852723202.db2.gz CAUDCZUMOBMAIX-FQEVSTJZSA-N 0 3 413.359 4.262 20 0 HIADHN CC(C)c1c(C(=O)NC[C@H](Cc2ccccc2)N(C)C)cnn1-c1ccc(F)cc1 ZINC000105867821 852734234 /nfs/dbraw/zinc/73/42/34/852734234.db2.gz AXXVHGURKIUCKE-NRFANRHFSA-N 0 3 408.521 4.038 20 0 HIADHN CC[C@@H](CNC(=O)N(C)Cc1ccccc1N1CCCC1)N1CCc2ccccc2C1 ZINC000107968355 852813633 /nfs/dbraw/zinc/81/36/33/852813633.db2.gz XMJKHMUXSGLINM-DEOSSOPVSA-N 0 3 420.601 4.265 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cnn(-c2cccc(Cl)c2)c1)c1ccsc1 ZINC000108411980 852848081 /nfs/dbraw/zinc/84/80/81/852848081.db2.gz ZQIGQSOOTJJDJW-LJQANCHMSA-N 0 3 402.951 4.400 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cnn(-c2cccc(Cl)c2)c1)c1ccsc1 ZINC000108411979 852848100 /nfs/dbraw/zinc/84/81/00/852848100.db2.gz ZQIGQSOOTJJDJW-IBGZPJMESA-N 0 3 402.951 4.400 20 0 HIADHN CCSCc1ccc(C(=O)NCc2ccc(CN3CCN(CC)CC3)cc2)cc1 ZINC000108413360 852848173 /nfs/dbraw/zinc/84/81/73/852848173.db2.gz IZZIEYOIJVOUOW-UHFFFAOYSA-N 0 3 411.615 4.007 20 0 HIADHN COc1ccc(-c2nc(C(=O)N(CCN(C)C)Cc3ccccc3F)cs2)cc1 ZINC000108682110 852871566 /nfs/dbraw/zinc/87/15/66/852871566.db2.gz KSERGLVILQKIKB-UHFFFAOYSA-N 0 3 413.518 4.162 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)C2(c3ccc(Br)cc3)CC2)C1 ZINC000108817079 852882289 /nfs/dbraw/zinc/88/22/89/852882289.db2.gz ACQXNFPXKDMMIN-JXFKEZNVSA-N 0 3 413.359 4.432 20 0 HIADHN COc1ccc2[nH]cc(C3CCN([C@@H](C)C(=O)NCc4ccc(C)cc4)CC3)c2c1 ZINC000108969810 852900790 /nfs/dbraw/zinc/90/07/90/852900790.db2.gz ZORIHHVCZMVNJL-SFHVURJKSA-N 0 3 405.542 4.369 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)c1cc2ccc(Br)cc2[nH]1 ZINC000109005674 852907379 /nfs/dbraw/zinc/90/73/79/852907379.db2.gz YNVGGPIGYVLOFW-UHFFFAOYSA-N 0 3 418.310 4.274 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)c1ccn(-c2ccccc2)n1 ZINC000109358483 852957958 /nfs/dbraw/zinc/95/79/58/852957958.db2.gz NJEVUKWTBFOUCF-UHFFFAOYSA-N 0 3 416.447 4.095 20 0 HIADHN CC(=O)c1cccc(O[C@H](C)C(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)c1 ZINC000109366395 852959705 /nfs/dbraw/zinc/95/97/05/852959705.db2.gz ZOBAFQZYOHLFFV-WIYYLYMNSA-N 0 3 414.571 4.307 20 0 HIADHN O=C(NCCCOC1CCCCC1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000109548009 852982831 /nfs/dbraw/zinc/98/28/31/852982831.db2.gz MWYOWCXROIBAIJ-NRFANRHFSA-N 0 3 412.496 4.297 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)[C@@H]1C[C@@H]1c1ccc(Br)cc1 ZINC000109769893 853011842 /nfs/dbraw/zinc/01/18/42/853011842.db2.gz XCEQWJSQABVZDB-WOJBJXKFSA-N 0 3 419.338 4.282 20 0 HIADHN CN(C(=O)CCc1ccc(-c2ccccc2)o1)C1CCN(CCc2ccccn2)CC1 ZINC000109795242 853015744 /nfs/dbraw/zinc/01/57/44/853015744.db2.gz MZYSDNGHJSFXLH-UHFFFAOYSA-N 0 3 417.553 4.440 20 0 HIADHN O=C(NCCN1CCCCCC1)c1oc2ccccc2c1CSc1ncccn1 ZINC000109827606 853019411 /nfs/dbraw/zinc/01/94/11/853019411.db2.gz ZBWFETBEHOEIJR-UHFFFAOYSA-N 0 3 410.543 4.121 20 0 HIADHN CSc1cc2c(cc1NC(=O)[C@H]1CCCN(Cc3cccc(F)c3)C1)OCCO2 ZINC000110156451 853067338 /nfs/dbraw/zinc/06/73/38/853067338.db2.gz GHPYFYDEPKHLDW-INIZCTEOSA-N 0 3 416.518 4.170 20 0 HIADHN CCCN(CC(=O)Nc1ccccc1Cl)C1CCN(C(=O)c2ccccc2)CC1 ZINC000110287278 853083789 /nfs/dbraw/zinc/08/37/89/853083789.db2.gz QXOBMBVHGONHOA-UHFFFAOYSA-N 0 3 413.949 4.295 20 0 HIADHN COc1cc(C(C)=O)ccc1OC[C@H](O)CN(C)Cc1ccccc1-c1ccccc1 ZINC000110306298 853085690 /nfs/dbraw/zinc/08/56/90/853085690.db2.gz FVIRSICXSHAEEN-HSZRJFAPSA-N 0 3 419.521 4.437 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)c3ccccc3Cc3ccccc3)CC2)C[C@H](C)O1 ZINC000110411434 853096783 /nfs/dbraw/zinc/09/67/83/853096783.db2.gz XXRBONKQBLVMSJ-OYRHEFFESA-N 0 3 406.570 4.239 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Cc3ccc(-c4ccccc4)cc3)CC2)C[C@@H](C)O1 ZINC000110455605 853102093 /nfs/dbraw/zinc/10/20/93/853102093.db2.gz VUBIZQHYEZLZRI-NHCUHLMSSA-N 0 3 406.570 4.244 20 0 HIADHN Cc1c2cccc(Cl)c2oc1C(=O)N1CCC(CN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000110455484 853102527 /nfs/dbraw/zinc/10/25/27/853102527.db2.gz RMKJHQUYZLIBJL-GJZGRUSLSA-N 0 3 404.938 4.356 20 0 HIADHN Fc1cccc(-c2noc([C@@H]3CCCN(Cn4cnc5cc(F)c(F)cc54)C3)n2)c1 ZINC000110479212 853105645 /nfs/dbraw/zinc/10/56/45/853105645.db2.gz JXZUQDVCEXPMDZ-CQSZACIVSA-N 0 3 413.403 4.341 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)Nc3ccccc3N3CCCCC3)CC2)C[C@H](C)O1 ZINC000110720092 853143919 /nfs/dbraw/zinc/14/39/19/853143919.db2.gz FWNSGARLCHBOJK-PMACEKPBSA-N 0 3 414.594 4.030 20 0 HIADHN Cc1ccc(NC(=O)N2CCC(CN3C[C@H](C)O[C@@H](C)C3)CC2)c(Br)c1 ZINC000110720850 853144196 /nfs/dbraw/zinc/14/41/96/853144196.db2.gz RKRJTIMJTDIBTR-HOTGVXAUSA-N 0 3 424.383 4.111 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3ccc(-c4nccs4)cc3)CC2)C[C@@H](C)O1 ZINC000110723270 853145087 /nfs/dbraw/zinc/14/50/87/853145087.db2.gz DVIACHVDMWMXSV-IAGOWNOFSA-N 0 3 414.575 4.163 20 0 HIADHN COc1cc(C(=O)N(C)CCN2CCCC2)ccc1OCc1ccc(Cl)cc1 ZINC000110918378 853168252 /nfs/dbraw/zinc/16/82/52/853168252.db2.gz LDRUWOBCMVCNCU-UHFFFAOYSA-N 0 3 402.922 4.095 20 0 HIADHN O=S(=O)(NC1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1)c1cccc2ccccc21 ZINC000437232961 862435243 /nfs/dbraw/zinc/43/52/43/862435243.db2.gz PFKKXADXEKGUSO-FRIKZZABSA-N 0 3 406.551 4.314 20 0 HIADHN COc1ccccc1NC(=O)[C@@H](C)N(C)CCCc1cc(-c2ccc(F)cc2)n[nH]1 ZINC000111039584 853191279 /nfs/dbraw/zinc/19/12/79/853191279.db2.gz ZCOYYBQBBVTFSK-MRXNPFEDSA-N 0 3 410.493 4.116 20 0 HIADHN CCN(CC)[C@@H](C(=O)NC[C@H](c1ccccc1OC)N1CCCC1)c1ccccc1 ZINC000111075256 853198011 /nfs/dbraw/zinc/19/80/11/853198011.db2.gz KKEHNWTXOMPPQS-ISKFKSNPSA-N 0 3 409.574 4.031 20 0 HIADHN O=C(c1ccc2[nH]c(C(F)F)nc2c1)N1CCCN(CCCc2ccccc2)CC1 ZINC000111136892 853207071 /nfs/dbraw/zinc/20/70/71/853207071.db2.gz SMAWHNWDEDTAJA-UHFFFAOYSA-N 0 3 412.484 4.281 20 0 HIADHN C[C@@H]1Cc2ccccc2N1Cc1occc1C(=O)NC[C@@H](c1ccccc1)N(C)C ZINC000111141222 853208743 /nfs/dbraw/zinc/20/87/43/853208743.db2.gz TZWDNYJWDQCDTQ-JPYJTQIMSA-N 0 3 403.526 4.264 20 0 HIADHN COc1ccc(CN(C)CCC(=O)N[C@@H](c2cccs2)c2ccccc2)c(OC)c1 ZINC000115411860 853251818 /nfs/dbraw/zinc/25/18/18/853251818.db2.gz CLGFEUCRWDUCAU-XMMPIXPASA-N 0 3 424.566 4.493 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1NC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000116059944 853281434 /nfs/dbraw/zinc/28/14/34/853281434.db2.gz YEBCWVXKYBOWIR-HXUWFJFHSA-N 0 3 406.505 4.479 20 0 HIADHN CC(C)[C@@H](NCC(=O)Nc1ccc(N2C[C@@H](C)O[C@H](C)C2)cc1)c1ccc(F)cc1 ZINC000116221125 853292362 /nfs/dbraw/zinc/29/23/62/853292362.db2.gz SPHRGXZAJAJTSY-QZTZHPFYSA-N 0 3 413.537 4.365 20 0 HIADHN NC(=O)[C@H]1CCCN(Cc2ccccc2NC(=O)CCc2ccc3ccccc3c2)C1 ZINC000116438559 853303771 /nfs/dbraw/zinc/30/37/71/853303771.db2.gz RTDDXMBQHMCPPZ-QHCPKHFHSA-N 0 3 415.537 4.108 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)cc1Cl ZINC000138281066 853382419 /nfs/dbraw/zinc/38/24/19/853382419.db2.gz XYRHSQZMDARYMS-MRXNPFEDSA-N 0 3 403.885 4.288 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2NC(=O)c2cccc(CN3CCCC3)c2)C[C@@H](C)O1 ZINC000139285106 853407487 /nfs/dbraw/zinc/40/74/87/853407487.db2.gz KZMUGNFGRYQJPV-WOJBJXKFSA-N 0 3 407.558 4.144 20 0 HIADHN Cc1cc(C)c(NC(=O)[C@H](C)N[C@H](C)c2ccc(N3CCOCC3)cc2)c(Cl)c1 ZINC000140191042 853437461 /nfs/dbraw/zinc/43/74/61/853437461.db2.gz WPFAAYSOLYIJJE-MSOLQXFVSA-N 0 3 415.965 4.471 20 0 HIADHN COc1cc(CNCc2ccccc2-n2ccnc2)ccc1OCc1c(C)noc1C ZINC000140465544 853446629 /nfs/dbraw/zinc/44/66/29/853446629.db2.gz XELFRAOMZRAQDV-UHFFFAOYSA-N 0 3 418.497 4.355 20 0 HIADHN C[C@@H](CNC(=O)[C@H](C)SCc1ncc(-c2ccc(Cl)cc2)o1)N1CCCC1 ZINC000140586756 853447504 /nfs/dbraw/zinc/44/75/04/853447504.db2.gz VSAFBAVPJCQXRO-GJZGRUSLSA-N 0 3 407.967 4.217 20 0 HIADHN NC(=O)Nc1ccc(-c2csc(NC3CCN(Cc4ccccc4)CC3)n2)cc1 ZINC000141263470 853467091 /nfs/dbraw/zinc/46/70/91/853467091.db2.gz LVEGNLCAGDIZPT-UHFFFAOYSA-N 0 3 407.543 4.377 20 0 HIADHN C[C@@H](NCc1ccc(OCc2cccnc2)cc1)c1cccc(N2CCOC2=O)c1 ZINC000142692344 853497723 /nfs/dbraw/zinc/49/77/23/853497723.db2.gz CVJLGHUFWLGSPY-GOSISDBHSA-N 0 3 403.482 4.468 20 0 HIADHN Cc1ccc([C@H](CNC(=O)CCCc2nnc(-c3ccccc3)o2)N2CCCC2)cc1 ZINC000143090661 853507570 /nfs/dbraw/zinc/50/75/70/853507570.db2.gz OPDFNDXEQZYDSX-QFIPXVFZSA-N 0 3 418.541 4.321 20 0 HIADHN Cc1ccccc1-n1nc(C(=O)C(C#N)C(=O)Nc2ccccc2Cl)c2c1CCC2 ZINC000143122472 853508103 /nfs/dbraw/zinc/50/81/03/853508103.db2.gz UYUKMDZRMTXIRG-INIZCTEOSA-N 0 3 418.884 4.284 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2ccc(CN3CCCCC3=O)cc2)N2CCCC2)cc1 ZINC000143102110 853508664 /nfs/dbraw/zinc/50/86/64/853508664.db2.gz NQHWSYXOAKEUPM-DEOSSOPVSA-N 0 3 419.569 4.074 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)CCc2cnn(-c3ccccc3)c2)N2CCCC2)cc1 ZINC000143185501 853509417 /nfs/dbraw/zinc/50/94/17/853509417.db2.gz LEBYYAXIMHZFFI-XMMPIXPASA-N 0 3 402.542 4.067 20 0 HIADHN CC(C)(C)OC(=O)NC[C@H]1CCCN(Cc2ccc(OCc3ccncc3)cc2)C1 ZINC000143525281 853516987 /nfs/dbraw/zinc/51/69/87/853516987.db2.gz HUQBZPAJUNOSQV-OAQYLSRUSA-N 0 3 411.546 4.397 20 0 HIADHN COCCN1CCC(NC(=O)Nc2ccccc2Oc2ccc(Cl)cc2)CC1 ZINC000144307914 853533538 /nfs/dbraw/zinc/53/35/38/853533538.db2.gz QAPIFLPWHPISMR-UHFFFAOYSA-N 0 3 403.910 4.365 20 0 HIADHN C[C@@H](c1cc(F)ccc1F)N(C)C(=S)NC1CCN(Cc2ccccc2)CC1 ZINC000145649560 853555494 /nfs/dbraw/zinc/55/54/94/853555494.db2.gz FBDWHEBQUZTVHD-INIZCTEOSA-N 0 3 403.542 4.497 20 0 HIADHN CCCC(=O)Nc1cccc(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2)c1C ZINC000148169897 853602088 /nfs/dbraw/zinc/60/20/88/853602088.db2.gz VYWPTDYFXNKDGO-UHFFFAOYSA-N 0 3 414.525 4.468 20 0 HIADHN N#CC(C(=O)Nc1ccccc1Cl)C(=O)c1ccnc(OCc2ccccc2)c1 ZINC000150155938 853639325 /nfs/dbraw/zinc/63/93/25/853639325.db2.gz BMNPKWNXMMRODE-QGZVFWFLSA-N 0 3 405.841 4.275 20 0 HIADHN CCOc1c(Cl)cc(C(=O)N(Cc2ccco2)C2CCN(C)CC2)cc1OC ZINC000195540889 853674766 /nfs/dbraw/zinc/67/47/66/853674766.db2.gz RLMXNNSXUOKMDD-UHFFFAOYSA-N 0 3 406.910 4.077 20 0 HIADHN CN(C)Cc1cccc(NC(=O)C[C@@](O)(c2nc3ccccc3s2)C(F)(F)F)c1 ZINC000195547261 853678446 /nfs/dbraw/zinc/67/84/46/853678446.db2.gz UTAUTXOZUPLZSD-LJQANCHMSA-N 0 3 423.460 4.137 20 0 HIADHN Cc1nc(-c2cccs2)ccc1C(=O)NCC1(N2CCSCC2)CCCC1 ZINC000195563877 853685842 /nfs/dbraw/zinc/68/58/42/853685842.db2.gz ADUZVZKMLRKUKX-UHFFFAOYSA-N 0 3 401.601 4.210 20 0 HIADHN O=C(NCc1ccc(OCC(F)(F)F)cc1)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000195605072 853708809 /nfs/dbraw/zinc/70/88/09/853708809.db2.gz ORTIBEIWPKDDNH-LJQANCHMSA-N 0 3 421.463 4.092 20 0 HIADHN COc1ccc(OCc2nc(CN3CCCN(Cc4ccccc4)CC3)cs2)cc1 ZINC000195616964 853716169 /nfs/dbraw/zinc/71/61/69/853716169.db2.gz LSXGKRFHAKVGTM-UHFFFAOYSA-N 0 3 423.582 4.439 20 0 HIADHN Cc1nc(COc2ccc(F)cc2)sc1C(=O)N[C@@H](C)CN1CCC[C@@H](C)C1 ZINC000195621296 853720731 /nfs/dbraw/zinc/72/07/31/853720731.db2.gz HXRFGMLEEIZNFL-CABCVRRESA-N 0 3 405.539 4.020 20 0 HIADHN CCOc1ccc([C@@H]2CCCN2C(=O)CN[C@H](c2ccc(OC)cc2)C2CC2)cc1 ZINC000195667949 853747240 /nfs/dbraw/zinc/74/72/40/853747240.db2.gz QKOLFYPRNJOCCA-ZCYQVOJMSA-N 0 3 408.542 4.498 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)Nc1ccc2c(c1)CCO2 ZINC000195686918 853757751 /nfs/dbraw/zinc/75/77/51/853757751.db2.gz IHXPOKAOXKDLMZ-UHFFFAOYSA-N 0 3 407.436 4.236 20 0 HIADHN Cc1nn(C)c2sc(C(=O)N(CCN(C)C)Cc3ccc(C(F)(F)F)cc3)cc12 ZINC000195686496 853758130 /nfs/dbraw/zinc/75/81/30/853758130.db2.gz KZUHGXXOQGKBNH-UHFFFAOYSA-N 0 3 424.492 4.166 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(S(=O)(=O)N(C)C)cc1)c1ccc(Br)cc1 ZINC000195702203 853768677 /nfs/dbraw/zinc/76/86/77/853768677.db2.gz ONJDNQOHBCNBLD-ZIAGYGMSSA-N 0 3 411.365 4.111 20 0 HIADHN Cc1ccc(-c2nn(Cc3ccccc3)cc2C(=O)N(C)C2CCN(C)CC2)cc1 ZINC000215835380 853838537 /nfs/dbraw/zinc/83/85/37/853838537.db2.gz DDKIOXOTFZKIJP-UHFFFAOYSA-N 0 3 402.542 4.073 20 0 HIADHN C[C@@H](NC[C@H](c1cccs1)N1CCOCC1)C(=O)Nc1ccc(C(C)(C)C)cc1 ZINC000216379858 853851095 /nfs/dbraw/zinc/85/10/95/853851095.db2.gz ZEQZGGVZASHNHQ-YLJYHZDGSA-N 0 3 415.603 4.036 20 0 HIADHN CN(C)[C@@H](CNC(=O)c1cnn(-c2ccccc2F)c1C(F)(F)F)c1ccccc1 ZINC000219393788 853868775 /nfs/dbraw/zinc/86/87/75/853868775.db2.gz BPKLDCWXQJDTRP-SFHVURJKSA-N 0 3 420.410 4.063 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)NC12CC3CC(CC(C3)C1)C2)c1ccc(NC(=O)C2CC2)cc1 ZINC000220349100 853875292 /nfs/dbraw/zinc/87/52/92/853875292.db2.gz ZZZDBEJCYNIYRC-AFNSFWMCSA-N 0 3 409.574 4.159 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)CCCc2nnc(-c3ccccc3)o2)C1 ZINC000227390202 853885993 /nfs/dbraw/zinc/88/59/93/853885993.db2.gz QEXRLRYJXQQPDW-WIYYLYMNSA-N 0 3 404.514 4.011 20 0 HIADHN CCCCN(CC)c1ccc(C(=O)N2CCC(CN3C[C@H](C)O[C@@H](C)C3)CC2)cc1 ZINC000228908117 853890579 /nfs/dbraw/zinc/89/05/79/853890579.db2.gz UAXLYBOLFYYNRF-SFTDATJTSA-N 0 3 415.622 4.274 20 0 HIADHN O=C(N1CC[C@@H](Nc2ccccc2)C1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000229735480 853892654 /nfs/dbraw/zinc/89/26/54/853892654.db2.gz SYGGGIYSEMYCQR-IRLDBZIGSA-N 0 3 417.475 4.154 20 0 HIADHN O=[N+]([O-])c1cc(CN[C@H](c2ccc3c(c2)OCCO3)C2CC2)ccc1Br ZINC000236605007 853901717 /nfs/dbraw/zinc/90/17/17/853901717.db2.gz BQYZSKLFZOPGMN-IBGZPJMESA-N 0 3 419.275 4.369 20 0 HIADHN Brc1ccc2ncc(CNC[C@H](c3ccco3)N3CCCCC3)n2c1 ZINC000236643020 853906244 /nfs/dbraw/zinc/90/62/44/853906244.db2.gz IZGNCYHXGACAOT-QGZVFWFLSA-N 0 3 403.324 4.007 20 0 HIADHN CCC(CC)[C@@H](O)CNCc1cc(Br)ccc1OCc1ccccn1 ZINC000236685882 853911105 /nfs/dbraw/zinc/91/11/05/853911105.db2.gz JDSPQLGEHWCXNL-IBGZPJMESA-N 0 3 407.352 4.310 20 0 HIADHN CCC(CC)[C@H](O)CNCc1cc(Br)ccc1OCc1ccccn1 ZINC000236706083 853914131 /nfs/dbraw/zinc/91/41/31/853914131.db2.gz JDSPQLGEHWCXNL-LJQANCHMSA-N 0 3 407.352 4.310 20 0 HIADHN Cc1nn(Cc2ccc(C)cc2)c(Cl)c1CNC1CCN(C(=O)OC(C)C)CC1 ZINC000236774802 853921509 /nfs/dbraw/zinc/92/15/09/853921509.db2.gz NPJUCEJQZNFULK-UHFFFAOYSA-N 0 3 418.969 4.301 20 0 HIADHN CC(C)n1ncc2cc(CNCCCC(=O)N3Cc4ccccc4C3)c(Cl)nc21 ZINC000236837944 853927656 /nfs/dbraw/zinc/92/76/56/853927656.db2.gz DDUWLRVPOKGOJA-UHFFFAOYSA-N 0 3 411.937 4.078 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@@H](C)NCc2cn(-c3ccccc3)nc2C)CC1 ZINC000236851550 853928858 /nfs/dbraw/zinc/92/88/58/853928858.db2.gz QIHGJAGIIIEOOL-HXUWFJFHSA-N 0 3 421.564 4.313 20 0 HIADHN CCOc1c(OC)cc(CNC[C@@H](O)c2c(Cl)cccc2Cl)cc1OC ZINC000236863140 853930406 /nfs/dbraw/zinc/93/04/06/853930406.db2.gz QAURFRUNPILLJW-OAHLLOKOSA-N 0 3 400.302 4.233 20 0 HIADHN CCCNC(=O)c1cccc(CNCC2=Cc3cc(Br)ccc3OC2)c1 ZINC000236894504 853934018 /nfs/dbraw/zinc/93/40/18/853934018.db2.gz JVRAIRFYBIDCAD-UHFFFAOYSA-N 0 3 415.331 4.155 20 0 HIADHN CCN(CC)c1ncc(CN[C@@H](C)c2cc(F)ccc2N2CCN(CC)CC2)s1 ZINC000236985928 853947294 /nfs/dbraw/zinc/94/72/94/853947294.db2.gz VVSAWGKOQHHIEE-KRWDZBQOSA-N 0 3 419.614 4.121 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@H](C)NCc2ccc3c(c2)CC(C)(C)O3)cc1 ZINC000237033702 853954653 /nfs/dbraw/zinc/95/46/53/853954653.db2.gz WTMOLHFXPPYFHG-KRWDZBQOSA-N 0 3 416.587 4.281 20 0 HIADHN CCC[C@H](NCc1ccc(-n2cccn2)cc1)C(=O)Nc1cccc(N2CCCC2)c1 ZINC000237039545 853955705 /nfs/dbraw/zinc/95/57/05/853955705.db2.gz NZRZRWDCTQIUNV-DEOSSOPVSA-N 0 3 417.557 4.370 20 0 HIADHN CN(C)Cc1cc(CNCc2cn(-c3ccccc3)nc2-c2cccnc2)ccc1F ZINC000237077529 853960863 /nfs/dbraw/zinc/96/08/63/853960863.db2.gz PMRIACBJKGJQLA-UHFFFAOYSA-N 0 3 415.516 4.425 20 0 HIADHN Cc1nn(Cc2ccccc2)c(Cl)c1CNc1cccc(CN2CCN(C)CC2)c1 ZINC000237093720 853963210 /nfs/dbraw/zinc/96/32/10/853963210.db2.gz XAKDALQENBUWMZ-UHFFFAOYSA-N 0 3 423.992 4.253 20 0 HIADHN COc1cc(CNCc2ccc(N(C)CCC#N)cc2)cc(Br)c1OC ZINC000237098593 853964087 /nfs/dbraw/zinc/96/40/87/853964087.db2.gz ATWCYOAVIPAWFS-UHFFFAOYSA-N 0 3 418.335 4.106 20 0 HIADHN COC(=O)c1cc(CNC2(c3ccc(OCc4ccccc4)cc3)CCOCC2)c[nH]1 ZINC000237126002 853968543 /nfs/dbraw/zinc/96/85/43/853968543.db2.gz XLQRXCNVEVOPOZ-UHFFFAOYSA-N 0 3 420.509 4.176 20 0 HIADHN COc1ccc(Br)cc1CNCCc1nc(-c2ccc(Cl)cc2)no1 ZINC000237132488 853969513 /nfs/dbraw/zinc/96/95/13/853969513.db2.gz CKUOBGTWIKNNOJ-UHFFFAOYSA-N 0 3 422.710 4.493 20 0 HIADHN CN(Cc1ccccc1Br)C(=O)CCNCc1cc(F)c(F)c(F)c1 ZINC000237142806 853971309 /nfs/dbraw/zinc/97/13/09/853971309.db2.gz PCZALSFXVIEIKG-UHFFFAOYSA-N 0 3 415.253 4.005 20 0 HIADHN COC(=O)COc1c(C)cc(CNCc2ccc(Br)c(F)c2)cc1C ZINC000237170978 853975305 /nfs/dbraw/zinc/97/53/05/853975305.db2.gz FGOUDRQNDXNPHA-UHFFFAOYSA-N 0 3 410.283 4.047 20 0 HIADHN CN1CCN(c2ccc(C(F)(F)F)cc2CNCc2ccc(Cl)s2)CC1 ZINC000237233279 853987490 /nfs/dbraw/zinc/98/74/90/853987490.db2.gz XJAPVVANXPKYQI-UHFFFAOYSA-N 0 3 403.901 4.462 20 0 HIADHN COc1cc(CNCc2cccc(Cn3ccnc3)c2)ccc1OCC(F)(F)F ZINC000237278772 853996003 /nfs/dbraw/zinc/99/60/03/853996003.db2.gz KSHDYJNXRCCDTE-UHFFFAOYSA-N 0 3 405.420 4.171 20 0 HIADHN COc1cc(CNCc2ccc(F)c(C)c2)cc(I)c1OC ZINC000237314999 854004812 /nfs/dbraw/zinc/00/48/12/854004812.db2.gz VIEREDZNMOIUGF-UHFFFAOYSA-N 0 3 415.246 4.046 20 0 HIADHN CSCC[C@H](N)C(=O)NC[C@@H](c1c[nH]c2ccccc21)c1ccccc1Cl ZINC000237320165 854005521 /nfs/dbraw/zinc/00/55/21/854005521.db2.gz OBDRLBAWCFHNJU-APWZRJJASA-N 0 3 401.963 4.150 20 0 HIADHN COc1ccccc1-c1ccc(CNCCCS(=O)(=O)Cc2ccccc2)cc1 ZINC000237336426 854008690 /nfs/dbraw/zinc/00/86/90/854008690.db2.gz QKAQDIFJGZXOAW-UHFFFAOYSA-N 0 3 409.551 4.457 20 0 HIADHN CNS(=O)(=O)c1ccc([C@@H](C)NCc2ccc(OCc3ccc(C)cc3)cc2)cc1 ZINC000237388200 854020573 /nfs/dbraw/zinc/02/05/73/854020573.db2.gz GCQFGKXAMPHGJK-LJQANCHMSA-N 0 3 424.566 4.333 20 0 HIADHN COc1cc(OC)cc([C@H](O)CNCc2cc3ccccc3nc2N2CCCCC2)c1 ZINC000237467920 854039075 /nfs/dbraw/zinc/03/90/75/854039075.db2.gz MBHOCSNGXDPHKK-XMMPIXPASA-N 0 3 421.541 4.066 20 0 HIADHN COc1cc(CNCc2c[nH]nc2-c2ccc(C)cc2)cc(Br)c1OC ZINC000237468916 854039282 /nfs/dbraw/zinc/03/92/82/854039282.db2.gz GIRLSOHUTSKPJN-UHFFFAOYSA-N 0 3 416.319 4.455 20 0 HIADHN C[C@@H]1CN(C(=O)c2ccc(CNCc3cccc(-c4ccncc4)c3)cc2)C[C@@H](C)O1 ZINC000237560347 854054139 /nfs/dbraw/zinc/05/41/39/854054139.db2.gz YRPFTNQTDUQEBL-WOJBJXKFSA-N 0 3 415.537 4.288 20 0 HIADHN Cc1nn(Cc2ccccc2)c(Cl)c1CNCCc1csc(N2CCCC2)n1 ZINC000237657628 854070185 /nfs/dbraw/zinc/07/01/85/854070185.db2.gz YPMQPLIVMLHMQP-UHFFFAOYSA-N 0 3 415.994 4.282 20 0 HIADHN C[C@@H]1CN(C(=O)c2ccc(CNCc3cccc(-c4ccncc4)c3)cc2)C[C@H](C)O1 ZINC000237765631 854091872 /nfs/dbraw/zinc/09/18/72/854091872.db2.gz YRPFTNQTDUQEBL-BGYRXZFFSA-N 0 3 415.537 4.288 20 0 HIADHN Cn1c(CCNCc2cc(Cl)ccc2OC[C@H]2CCCO2)nc2cc(F)ccc21 ZINC000237852514 854107220 /nfs/dbraw/zinc/10/72/20/854107220.db2.gz VWPJMUHKXJEZOV-GOSISDBHSA-N 0 3 417.912 4.256 20 0 HIADHN Cn1c(CCCNCc2nc(-c3cccc(Br)c3)c[nH]2)nc2ccccc21 ZINC000237849595 854107368 /nfs/dbraw/zinc/10/73/68/854107368.db2.gz DWIIIJAJQRLCOR-UHFFFAOYSA-N 0 3 424.346 4.448 20 0 HIADHN Cc1cccc(OC[C@@H](O)CNCc2cc3ccccc3nc2N2CCCCC2)c1 ZINC000237867404 854111448 /nfs/dbraw/zinc/11/14/48/854111448.db2.gz LVPUJWAGBZGMRY-QFIPXVFZSA-N 0 3 405.542 4.063 20 0 HIADHN Cc1nn(Cc2c(Cl)cccc2Cl)c(Cl)c1CNC[C@]1(O)CCSC1 ZINC000237875508 854112626 /nfs/dbraw/zinc/11/26/26/854112626.db2.gz RJTFEXLHRUIUQA-QGZVFWFLSA-N 0 3 420.793 4.158 20 0 HIADHN Cc1cc([C@@](C)(O)CNCc2c(C)nn(Cc3ccccc3Cl)c2C)c(C)o1 ZINC000237876746 854112807 /nfs/dbraw/zinc/11/28/07/854112807.db2.gz IXKINHUHRCFXFF-QFIPXVFZSA-N 0 3 401.938 4.409 20 0 HIADHN Cc1cn2c(nc(C)c2CNCCC(=O)Nc2cc(Br)ccc2C)s1 ZINC000237888255 854115923 /nfs/dbraw/zinc/11/59/23/854115923.db2.gz SLMGIYTZDXFBCE-UHFFFAOYSA-N 0 3 421.364 4.202 20 0 HIADHN OCc1ccc(CNC[C@@H](c2ccc(Cl)cc2)N2CCc3sccc3C2)o1 ZINC000237991337 854129916 /nfs/dbraw/zinc/12/99/16/854129916.db2.gz XMCYJECCUJDQBG-FQEVSTJZSA-N 0 3 402.947 4.376 20 0 HIADHN OCC[C@@H](CNCc1nc(-c2ccc(Br)cc2)c[nH]1)c1ccccc1 ZINC000238194511 854151903 /nfs/dbraw/zinc/15/19/03/854151903.db2.gz CIIHFJWORCHEKK-KRWDZBQOSA-N 0 3 400.320 4.095 20 0 HIADHN CN1CCN(CCCNC(=O)c2sc3cc(Cl)cc(Cl)c3c2Cl)CC1 ZINC000248001797 854172795 /nfs/dbraw/zinc/17/27/95/854172795.db2.gz ARTFYKZQPBGQNP-UHFFFAOYSA-N 0 3 420.793 4.229 20 0 HIADHN C[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000248147274 854182811 /nfs/dbraw/zinc/18/28/11/854182811.db2.gz AAJVVEUABAIFGX-AQNXPRMDSA-N 0 3 416.606 4.099 20 0 HIADHN Cc1ccccc1C(=O)N[C@H](CC(C)C)C(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000251167139 854196641 /nfs/dbraw/zinc/19/66/41/854196641.db2.gz NTXBBNJMIYUZEC-KIFXHHALSA-N 0 3 421.585 4.091 20 0 HIADHN O=C(NC[C@@H]1CCCO[C@H]1c1ccccc1)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000255959247 854230427 /nfs/dbraw/zinc/23/04/27/854230427.db2.gz ICINIYZMJSUSRY-HJOGWXRNSA-N 0 3 407.558 4.118 20 0 HIADHN C[C@@H]1CCN(CC(=O)N[C@@H](c2ccccc2)c2ccc3[nH]c(C(F)(F)F)nc3c2)C1 ZINC000261399846 854248431 /nfs/dbraw/zinc/24/84/31/854248431.db2.gz VSCDIPQZHDVHJO-VLIAUNLRSA-N 0 3 416.447 4.129 20 0 HIADHN C[C@@H]1CCN(CC(=O)N[C@@H](c2ccccc2)c2ccc3nc(C(F)(F)F)[nH]c3c2)C1 ZINC000261399846 854248437 /nfs/dbraw/zinc/24/84/37/854248437.db2.gz VSCDIPQZHDVHJO-VLIAUNLRSA-N 0 3 416.447 4.129 20 0 HIADHN Cc1nn(C)c2ncc(CN(CCCO)C(c3ccccc3)c3ccccc3)cc12 ZINC000261404144 854249883 /nfs/dbraw/zinc/24/98/83/854249883.db2.gz NXUJZTYEFDDNBU-UHFFFAOYSA-N 0 3 400.526 4.251 20 0 HIADHN CN(C)[C@H](CNc1ccc(C(=O)N2CCc3ccccc32)cn1)c1cccc(F)c1 ZINC000301222911 854331969 /nfs/dbraw/zinc/33/19/69/854331969.db2.gz DDUQCELYYBOQOI-JOCHJYFZSA-N 0 3 404.489 4.138 20 0 HIADHN O=C(c1cccnc1NCCCN1CCc2ccccc2C1)N1CCc2ccccc21 ZINC000301345645 854366445 /nfs/dbraw/zinc/36/64/45/854366445.db2.gz HEUJVGLTOSFXHN-UHFFFAOYSA-N 0 3 412.537 4.145 20 0 HIADHN C[C@H](CN1CCCCC1)Nc1ccc(-n2ncc(Cl)c(Cl)c2=O)cc1Cl ZINC000301522234 854412350 /nfs/dbraw/zinc/41/23/50/854412350.db2.gz LVUOTVIESIQYKQ-GFCCVEGCSA-N 0 3 415.752 4.479 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(N[C@@H]3CC[N@H+](Cc4ccccc4)[C@H](C)C3)nc2)n1 ZINC000301532279 854414009 /nfs/dbraw/zinc/41/40/09/854414009.db2.gz KNFGGICKAACYIP-DYESRHJHSA-N 0 3 403.530 4.272 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(N[C@@H]3CC[N@@H+](Cc4ccccc4)[C@H](C)C3)nc2)n1 ZINC000301532279 854414010 /nfs/dbraw/zinc/41/40/10/854414010.db2.gz KNFGGICKAACYIP-DYESRHJHSA-N 0 3 403.530 4.272 20 0 HIADHN Cc1nc2ccc(Br)cc2c(N2CCC[C@H](Cn3ccnn3)C2)c1C ZINC000301767197 854462268 /nfs/dbraw/zinc/46/22/68/854462268.db2.gz BRNOMYKYYBTMEP-HNNXBMFYSA-N 0 3 400.324 4.122 20 0 HIADHN CCN(CC)CCN(CCC(F)(F)F)S(=O)(=O)c1c(Cl)cccc1Cl ZINC000437308862 862570613 /nfs/dbraw/zinc/57/06/13/862570613.db2.gz MZGKZDKTHXVCSS-UHFFFAOYSA-N 0 3 421.312 4.278 20 0 HIADHN C[C@H](c1ccccc1)N1CCC(Nc2nn3cc(-c4cccnc4)nc3s2)CC1 ZINC000302082099 854528679 /nfs/dbraw/zinc/52/86/79/854528679.db2.gz JKFVQYDTCBLJBP-MRXNPFEDSA-N 0 3 404.543 4.490 20 0 HIADHN CCN1CCN(c2ccc(Nc3nn4cc(-c5cccnc5)nc4s3)c(C)c2)CC1 ZINC000302119145 854533161 /nfs/dbraw/zinc/53/31/61/854533161.db2.gz XIASPRCYOTYYQT-UHFFFAOYSA-N 0 3 419.558 4.047 20 0 HIADHN CN1CCC[C@H](CNc2nn3cc(-c4cccnc4)nc3s2)[C@H]1c1cccs1 ZINC000302153407 854538194 /nfs/dbraw/zinc/53/81/94/854538194.db2.gz IEFVDJZHXAUMDT-QAPCUYQASA-N 0 3 410.572 4.409 20 0 HIADHN CN(C[C@@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)c1ccc(Cl)c(Cl)c1 ZINC000437315670 862580826 /nfs/dbraw/zinc/58/08/26/862580826.db2.gz RQAMJGXTTZYKCX-INIZCTEOSA-N 0 3 413.370 4.136 20 0 HIADHN C[C@@H]1CN(CCC2CCN(c3nn4cc(C5CCCC5)nc4s3)CC2)C[C@@H](C)O1 ZINC000302571298 854587605 /nfs/dbraw/zinc/58/76/05/854587605.db2.gz ZCLXBOZKFDJIKE-IAGOWNOFSA-N 0 3 417.623 4.164 20 0 HIADHN COCc1c(C(=O)N(CCN(C)C)Cc2ccccc2)sc2cccc(F)c21 ZINC000302656482 854598864 /nfs/dbraw/zinc/59/88/64/854598864.db2.gz PRIDREGANVSRJB-UHFFFAOYSA-N 0 3 400.519 4.391 20 0 HIADHN CN1CC[C@H]2[C@H](CCCN2c2nnc(-c3cc(Br)ccc3F)s2)C1 ZINC000302759862 854624318 /nfs/dbraw/zinc/62/43/18/854624318.db2.gz WVOBSAVLKCVZGM-ABAIWWIYSA-N 0 3 411.344 4.027 20 0 HIADHN O=C(Nc1ccccc1)c1ccc(CN[C@@H](CN2CCOCC2)c2ccccc2)cc1 ZINC000302771102 854629616 /nfs/dbraw/zinc/62/96/16/854629616.db2.gz ZUSXFCHMUARAOJ-VWLOTQADSA-N 0 3 415.537 4.102 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)CCCc1ccc(Br)s1 ZINC000302814965 854644613 /nfs/dbraw/zinc/64/46/13/854644613.db2.gz NZPCBZWEDAHHNS-UHFFFAOYSA-N 0 3 409.393 4.424 20 0 HIADHN COc1ccc(OC)c([C@@H]2CCCN2C[C@H](O)COc2cccc3ccccc32)c1 ZINC000302876055 854664244 /nfs/dbraw/zinc/66/42/44/854664244.db2.gz NJYICBNSXXBZBE-CVDCTZTESA-N 0 3 407.510 4.434 20 0 HIADHN CN(CCOc1cccc(Cl)c1)C(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000302889003 854667382 /nfs/dbraw/zinc/66/73/82/854667382.db2.gz BEGQAVIACFECBW-SFHVURJKSA-N 0 3 407.967 4.259 20 0 HIADHN O=C(NCc1ccc(Br)c(F)c1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000302941909 854689811 /nfs/dbraw/zinc/68/98/11/854689811.db2.gz BHZYJADZXLZPTD-INIZCTEOSA-N 0 3 423.301 4.256 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)c1cc2ccc(OC(F)(F)F)cc2[nH]1 ZINC000302970568 854702584 /nfs/dbraw/zinc/70/25/84/854702584.db2.gz IGVHAWDKHXYRBB-UHFFFAOYSA-N 0 3 423.410 4.410 20 0 HIADHN CCOC(=O)Nc1ccc2c(CN3CCCN(c4ccccc4)CC3)cc(=O)oc2c1 ZINC000302994646 854714124 /nfs/dbraw/zinc/71/41/24/854714124.db2.gz SOYCVUAAPRKYJF-UHFFFAOYSA-N 0 3 421.497 4.074 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N(Cc3ccco3)c3ccccn3)cc2)CC1 ZINC000303014895 854723736 /nfs/dbraw/zinc/72/37/36/854723736.db2.gz RWVFZWNWHYTHDC-UHFFFAOYSA-N 0 3 404.514 4.052 20 0 HIADHN Cc1c(C(=O)N(CCN(C)C)Cc2cccc(Cl)c2)cnn1Cc1ccccc1 ZINC000303026966 854729751 /nfs/dbraw/zinc/72/97/51/854729751.db2.gz WCAGDDLZZTVTOF-UHFFFAOYSA-N 0 3 410.949 4.097 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2ccccc2OC[C@H]2CCCO2)N2CCCC2)cc1 ZINC000303048526 854738380 /nfs/dbraw/zinc/73/83/80/854738380.db2.gz RBZQCMADFCBKQF-GGAORHGYSA-N 0 3 408.542 4.120 20 0 HIADHN CCN(CC)CC(=O)NC[C@@H](c1ccc(SC)cc1)N1CCc2sccc2C1 ZINC000303060367 854743311 /nfs/dbraw/zinc/74/33/11/854743311.db2.gz XIQYZXHTJBTEAN-FQEVSTJZSA-N 0 3 417.644 4.027 20 0 HIADHN CCCN(C(=O)c1ccc2c(c1)CCN2C(C)=O)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000303129671 854774707 /nfs/dbraw/zinc/77/47/07/854774707.db2.gz OYBAAOZLNKRAQT-DEOSSOPVSA-N 0 3 419.569 4.112 20 0 HIADHN CN(C)CCN(C[C@H]1CCCO1)C(=O)/C=C/c1ccc(-c2ccc(F)cc2)s1 ZINC000303164580 854795148 /nfs/dbraw/zinc/79/51/48/854795148.db2.gz AKERRUSVEIKLRH-FMAYLGMYSA-N 0 3 402.535 4.137 20 0 HIADHN CC(C)(CNC(=O)N(Cc1ccc(F)cc1F)C1CC1)N1CCc2ccccc2C1 ZINC000303237508 854830136 /nfs/dbraw/zinc/83/01/36/854830136.db2.gz YRTLZDNRTIYJMR-UHFFFAOYSA-N 0 3 413.512 4.476 20 0 HIADHN O=C(NCC1CCN(Cc2ccccc2Cl)CC1)c1ccc(-n2ccnc2)cc1 ZINC000303304650 854862165 /nfs/dbraw/zinc/86/21/65/854862165.db2.gz NNFPJHHYUBZXKY-UHFFFAOYSA-N 0 3 408.933 4.168 20 0 HIADHN CCc1ccc([C@H](CNC(=O)C2(c3ccccc3Cl)CCOCC2)N(C)C)cc1 ZINC000303352385 854887903 /nfs/dbraw/zinc/88/79/03/854887903.db2.gz XVXZWDXWSHSSQT-QFIPXVFZSA-N 0 3 414.977 4.370 20 0 HIADHN CCCO[C@@H]1CCCN(C(=O)Nc2ccc(CCN3CCSCC3)cc2)CC1 ZINC000303352775 854887974 /nfs/dbraw/zinc/88/79/74/854887974.db2.gz FMOMBDBAFAMWLA-OAQYLSRUSA-N 0 3 405.608 4.091 20 0 HIADHN O=c1[nH]c(CCN(CCCO)Cc2ccc(Cl)c(Cl)c2)nc2ccccc12 ZINC000303362626 854892685 /nfs/dbraw/zinc/89/26/85/854892685.db2.gz HWTFJEMHYYTHEJ-UHFFFAOYSA-N 0 3 406.313 4.069 20 0 HIADHN CCc1cccc2c(CC(=O)NC[C@@H](c3cccc(OC)c3)N3CCCC3)c[nH]c21 ZINC000303375607 854897886 /nfs/dbraw/zinc/89/78/86/854897886.db2.gz KOWDXQSQPHXBEU-QHCPKHFHSA-N 0 3 405.542 4.235 20 0 HIADHN CCCO[C@@H]1CCCN(CC(=O)N2CCCCC[C@@H]2c2ccc(OC)cc2)CC1 ZINC000303407719 854912528 /nfs/dbraw/zinc/91/25/28/854912528.db2.gz SYAPVRAEBBGNJC-DHIUTWEWSA-N 0 3 402.579 4.420 20 0 HIADHN CCCO[C@@H]1CCCN([C@@H](C)C(=O)N(C)Cc2ccc3cc(OC)ccc3c2)CC1 ZINC000303417200 854919195 /nfs/dbraw/zinc/91/91/95/854919195.db2.gz WXMAODYLBUOKED-WMZHIEFXSA-N 0 3 412.574 4.476 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)NC[C@@H](C)N(C)Cc2ccccc2)c(OC)c1 ZINC000303434827 854935663 /nfs/dbraw/zinc/93/56/63/854935663.db2.gz DEPVXNTWYLEERR-GCJKJVERSA-N 0 3 411.546 4.071 20 0 HIADHN Cc1noc(C)c1COc1ccccc1C(=O)NC[C@H](C)N(C)Cc1ccccc1 ZINC000303458038 854958747 /nfs/dbraw/zinc/95/87/47/854958747.db2.gz GQSIDZWSDBPNCE-KRWDZBQOSA-N 0 3 407.514 4.121 20 0 HIADHN CCN1CCCC[C@@H]1CNC(=O)c1cnn(-c2ccc(C)c(Cl)c2)c1C1CC1 ZINC000303460199 854960154 /nfs/dbraw/zinc/96/01/54/854960154.db2.gz HAMJSDNNUFWMQI-GOSISDBHSA-N 0 3 400.954 4.316 20 0 HIADHN O=S(=O)(NC1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1)c1cccc(C(F)(F)F)c1 ZINC000303468313 854966073 /nfs/dbraw/zinc/96/60/73/854966073.db2.gz NCRRERNXPLSQMB-YQQQUEKLSA-N 0 3 424.488 4.179 20 0 HIADHN Cc1ccc(S(=O)(=O)NC2C[C@H]3CC[C@@H](C2)N3Cc2ccccc2)c(Cl)c1 ZINC000303518975 855006385 /nfs/dbraw/zinc/00/63/85/855006385.db2.gz YOIOEGRDWHSNFU-YQQQUEKLSA-N 0 3 404.963 4.122 20 0 HIADHN CCn1c2ccccc2nc1[C@@H]1CCCN1C(=O)NC[C@@H](C)N(C)Cc1ccccc1 ZINC000303523106 855009802 /nfs/dbraw/zinc/00/98/02/855009802.db2.gz ZOCRJCRTRLQUKC-XXBNENTESA-N 0 3 419.573 4.423 20 0 HIADHN CC[C@@H](Sc1ccccc1)C(=O)NCc1ccccc1CN1CCN(CC)CC1 ZINC000303534406 855021257 /nfs/dbraw/zinc/02/12/57/855021257.db2.gz XGHSQXKSTQWKCX-HSZRJFAPSA-N 0 3 411.615 4.011 20 0 HIADHN COc1ccc(CCNC(=O)c2oc3ccccc3c2CN(C)C)cc1OC(F)F ZINC000303559075 855039988 /nfs/dbraw/zinc/03/99/88/855039988.db2.gz MZPYVZUBOYUTAT-UHFFFAOYSA-N 0 3 418.440 4.077 20 0 HIADHN CC(C)(C)c1ccc([C@@H](O)CNC(=O)N[C@H](CN2CCCC2)c2ccccc2)cc1 ZINC000303635684 855092495 /nfs/dbraw/zinc/09/24/95/855092495.db2.gz GSELMSZAIUOREN-PKTZIBPZSA-N 0 3 409.574 4.154 20 0 HIADHN O=C(CCc1nc(-c2ccc(Cl)cc2)no1)O[C@@H]1CCN(Cc2ccccc2)C1 ZINC000303636958 855093760 /nfs/dbraw/zinc/09/37/60/855093760.db2.gz ADPIVGJWSSGHBW-LJQANCHMSA-N 0 3 411.889 4.140 20 0 HIADHN C[C@@H](CNC(=O)c1ccn(-c2cccc(C(F)(F)F)c2)n1)N(C)Cc1ccccc1 ZINC000303699468 855139944 /nfs/dbraw/zinc/13/99/44/855139944.db2.gz AVRAADHVQHYZEW-INIZCTEOSA-N 0 3 416.447 4.141 20 0 HIADHN Cc1ccc(NC(=O)CCCCCNC(=O)NC2CCCCC2)c(CN(C)C)c1 ZINC000303706026 855143808 /nfs/dbraw/zinc/14/38/08/855143808.db2.gz PAJMUSGNWYXAFP-UHFFFAOYSA-N 0 3 402.583 4.187 20 0 HIADHN Cc1cc(OCc2ccccc2)ccc1NC(=O)N(CCN(C)C)C[C@H]1CCCO1 ZINC000303734119 855159180 /nfs/dbraw/zinc/15/91/80/855159180.db2.gz WFVWIOZPIGCLIP-JOCHJYFZSA-N 0 3 411.546 4.149 20 0 HIADHN C[C@H]1C[C@H](N(C)S(=O)(=O)c2ccc(F)cc2Cl)CCN1Cc1ccccc1 ZINC000303755867 855176306 /nfs/dbraw/zinc/17/63/06/855176306.db2.gz CYOJJYSDIUIBMF-MAUKXSAKSA-N 0 3 410.942 4.153 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)Cc1ccc(F)c(Br)c1 ZINC000303768684 855186956 /nfs/dbraw/zinc/18/69/56/855186956.db2.gz BIOOVCQVCWVDOL-INIZCTEOSA-N 0 3 419.338 4.254 20 0 HIADHN CC[C@H](NC(=O)c1ccc(N2CCN(C(C)C)CC2)cc1)c1cc(F)ccc1F ZINC000303786662 855197849 /nfs/dbraw/zinc/19/78/49/855197849.db2.gz DRGMHXKRCVCWFG-QFIPXVFZSA-N 0 3 401.501 4.376 20 0 HIADHN CN(C)Cc1cccc(C(=O)NC[C@@H](c2ccccc2)N2CCc3sccc3C2)c1 ZINC000303828337 855228301 /nfs/dbraw/zinc/22/83/01/855228301.db2.gz GUUMHPAKCHWPNI-QHCPKHFHSA-N 0 3 419.594 4.339 20 0 HIADHN Cc1cc(C(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)c2cnn(C(C)C)c2n1 ZINC000303844105 855241304 /nfs/dbraw/zinc/24/13/04/855241304.db2.gz NJZXNTGPLSEHQU-IBGZPJMESA-N 0 3 405.546 4.057 20 0 HIADHN CN(C)Cc1cccc(C(=O)Nc2cccc(C[S@](=O)Cc3ccccc3)c2)c1 ZINC000303893688 855274841 /nfs/dbraw/zinc/27/48/41/855274841.db2.gz PUAOHYCDDXLKRJ-GDLZYMKVSA-N 0 3 406.551 4.449 20 0 HIADHN Cc1c(C(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)cnn1-c1ccccc1F ZINC000303939728 855306268 /nfs/dbraw/zinc/30/62/68/855306268.db2.gz YJIATSYEPDNZRK-GOSISDBHSA-N 0 3 406.505 4.056 20 0 HIADHN C[C@@H]1C[C@@H]1C(=O)Nc1cccc(C(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)c1 ZINC000303950387 855312815 /nfs/dbraw/zinc/31/28/15/855312815.db2.gz ZUIPORLBZPFUDS-MSYCTHLASA-N 0 3 405.542 4.018 20 0 HIADHN C[C@@H](NCCc1nnc2ccccn21)c1ccc(Br)cc1Br ZINC000315902053 855379204 /nfs/dbraw/zinc/37/92/04/855379204.db2.gz QUVMPULYVIABCF-LLVKDONJSA-N 0 3 424.140 4.148 20 0 HIADHN CN(C(=O)c1cccc(Br)c1F)C1CCN(Cc2ccccc2)CC1 ZINC000380945660 855428746 /nfs/dbraw/zinc/42/87/46/855428746.db2.gz NSRDJPSEKKXOLH-UHFFFAOYSA-N 0 3 405.311 4.325 20 0 HIADHN CCOc1c(Br)cc(Br)cc1CN[C@@H](C)CC(C)(C)O ZINC000384976398 855440859 /nfs/dbraw/zinc/44/08/59/855440859.db2.gz IYSPNJVYANIXKA-JTQLQIEISA-N 0 3 409.162 4.249 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc2c(c1)OCCO2)c1ccc(I)cc1 ZINC000386057070 855442869 /nfs/dbraw/zinc/44/28/69/855442869.db2.gz GTKGMASSHIDAPZ-OLZOCXBDSA-N 0 3 409.267 4.474 20 0 HIADHN CN(C(=O)c1ccc(Br)c(F)c1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000388857682 855449034 /nfs/dbraw/zinc/44/90/34/855449034.db2.gz OVZZPVRCSJFJHV-QGZVFWFLSA-N 0 3 405.311 4.325 20 0 HIADHN CN(C)Cc1ccccc1CNC(=O)[C@H]1C[C@]12CCc1cc(Br)ccc12 ZINC000409479599 855502031 /nfs/dbraw/zinc/50/20/31/855502031.db2.gz MNYZXBYZBNAZLN-IRLDBZIGSA-N 0 3 413.359 4.031 20 0 HIADHN CCCc1cc(C(=O)Nc2ccccc2CN2CCC[C@H](C(N)=O)C2)ccc1Cl ZINC000409499725 855510458 /nfs/dbraw/zinc/51/04/58/855510458.db2.gz MFGBKBRYPFBTGC-IBGZPJMESA-N 0 3 413.949 4.242 20 0 HIADHN O=C(c1cccc(C2CCC2)c1)N1CCC[C@H](CN2CCN(c3ccccn3)CC2)C1 ZINC000409623435 855569678 /nfs/dbraw/zinc/56/96/78/855569678.db2.gz RQHSGVFJXAYXJW-OAQYLSRUSA-N 0 3 418.585 4.024 20 0 HIADHN Cc1nn(-c2ccccc2C)c(C)c1CN(C)C(=O)NCCN(C)Cc1ccccc1 ZINC000409650665 855583356 /nfs/dbraw/zinc/58/33/56/855583356.db2.gz FJRKRNAWISGQPJ-UHFFFAOYSA-N 0 3 419.573 4.071 20 0 HIADHN CN(C)CCn1c2cc(NC(=O)CC3CCC(c4ccccc4)CC3)ccc2oc1=O ZINC000409662788 855590870 /nfs/dbraw/zinc/59/08/70/855590870.db2.gz HFZLSYDEQZIVKQ-UHFFFAOYSA-N 0 3 421.541 4.459 20 0 HIADHN CC[C@@H](C)n1ncc2c1nc(C)cc2C(=O)N(CCCc1ccccc1)CCN(C)C ZINC000409704722 855611568 /nfs/dbraw/zinc/61/15/68/855611568.db2.gz LAZWZOQJKPPFBE-HXUWFJFHSA-N 0 3 421.589 4.347 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)CC2CC(c3ccccc3)C2)cc1)[C@H]1CCCN(C)C1 ZINC000409738240 855628734 /nfs/dbraw/zinc/62/87/34/855628734.db2.gz DYFKZFPFTSYSGV-HTIOENIKSA-N 0 3 419.569 4.375 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)C(C)(C)Cc3nc4ccccc4[nH]3)c2)CC1 ZINC000409871049 855698229 /nfs/dbraw/zinc/69/82/29/855698229.db2.gz WFPVKPNNBQTSBH-UHFFFAOYSA-N 0 3 419.573 4.301 20 0 HIADHN CCOc1cc2c(cc1[C@@H]1C[C@@H]1C(=O)N(CCN(C)C)C1CCCCC1)O[C@H](C)C2 ZINC000409882018 855705145 /nfs/dbraw/zinc/70/51/45/855705145.db2.gz GZIFDEVYWGAGQJ-AGHHOFFYSA-N 0 3 414.590 4.235 20 0 HIADHN CC(C)C(=O)Nc1ccc(C(=O)N[C@H](CN2CCc3ccccc3C2)C(C)(C)C)cc1 ZINC000410049985 855800098 /nfs/dbraw/zinc/80/00/98/855800098.db2.gz AIFOMPUOZKXQCE-HSZRJFAPSA-N 0 3 421.585 4.484 20 0 HIADHN CC(C)(C)[C@@H](CN1CCc2ccccc2C1)NC(=O)c1cccc(N2CCCC2=O)c1 ZINC000410052585 855801290 /nfs/dbraw/zinc/80/12/90/855801290.db2.gz JXMBJPIOIQPFCI-HSZRJFAPSA-N 0 3 419.569 4.016 20 0 HIADHN C[C@@H](NC(=O)N1CCN(C2CCCC2)CC1)c1cccc(NC(=O)c2ccccc2)c1 ZINC000410285357 855902556 /nfs/dbraw/zinc/90/25/56/855902556.db2.gz DIJMUSIVRQWEGE-LJQANCHMSA-N 0 3 420.557 4.270 20 0 HIADHN CC[C@@H](NC(=O)NCc1ccc(CN2CCN(C)CC2)cc1)c1ccc(Cl)cc1 ZINC000410370046 855956180 /nfs/dbraw/zinc/95/61/80/855956180.db2.gz WZFVNKIZAOAUSA-JOCHJYFZSA-N 0 3 414.981 4.038 20 0 HIADHN CN1CCN(Cc2ccc(CNC(=O)Nc3ccccc3-c3cccs3)cc2)CC1 ZINC000410389078 855967887 /nfs/dbraw/zinc/96/78/87/855967887.db2.gz AMLCITNSRAWEJE-UHFFFAOYSA-N 0 3 420.582 4.484 20 0 HIADHN CS(=O)(=O)Nc1ccc(CN[C@@H](Cc2cccnc2)c2cccc(Cl)c2)cc1 ZINC000425937555 856008724 /nfs/dbraw/zinc/00/87/24/856008724.db2.gz SBKCUVZKKLHVTC-NRFANRHFSA-N 0 3 415.946 4.180 20 0 HIADHN Cc1ccc2cc([C@@H](C)NCc3cccc(NC(=O)CCN4CCOCC4)c3)oc2c1 ZINC000425938490 856010192 /nfs/dbraw/zinc/01/01/92/856010192.db2.gz XHHHNHFCKQVJQO-LJQANCHMSA-N 0 3 421.541 4.253 20 0 HIADHN CN1CC[C@H](NC(=O)NCc2ccnc(Oc3ccccc3F)c2)[C@H]1c1ccccc1 ZINC000425975941 856025487 /nfs/dbraw/zinc/02/54/87/856025487.db2.gz DJADZQMRWXVWDX-NZQKXSOJSA-N 0 3 420.488 4.258 20 0 HIADHN CSc1ccc(Cl)cc1NC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1CO ZINC000426098069 856107263 /nfs/dbraw/zinc/10/72/63/856107263.db2.gz FEIMIWOZPIPZPO-FUHWJXTLSA-N 0 3 419.978 4.066 20 0 HIADHN CC1CCN([C@@H](CNC(=O)N(CCCO)Cc2ccccc2)c2cccs2)CC1 ZINC000426232372 856191053 /nfs/dbraw/zinc/19/10/53/856191053.db2.gz VOAQGYLULDQMGA-NRFANRHFSA-N 0 3 415.603 4.115 20 0 HIADHN COc1cccc([C@@H](CNC(=O)N[C@H]2CCOC3(CCCCC3)C2)N2CCCC2)c1 ZINC000426242396 856197522 /nfs/dbraw/zinc/19/75/22/856197522.db2.gz XEKHCSQEUSFVPB-RBBKRZOGSA-N 0 3 415.578 4.013 20 0 HIADHN C[C@@H](N[C@@H]1c2cccc(Br)c2CC1(C)C)c1ccc(S(N)(=O)=O)cc1 ZINC000426323423 856245585 /nfs/dbraw/zinc/24/55/85/856245585.db2.gz NBVACIGJFYFSMI-KZULUSFZSA-N 0 3 423.376 4.071 20 0 HIADHN C[C@H](N[C@H]1c2cccc(Br)c2CC1(C)C)c1ccc(S(N)(=O)=O)cc1 ZINC000426323424 856245637 /nfs/dbraw/zinc/24/56/37/856245637.db2.gz NBVACIGJFYFSMI-SGTLLEGYSA-N 0 3 423.376 4.071 20 0 HIADHN COCC(C)(C)CN(C)Cc1cccc(Br)c1OC[C@H]1CCCO1 ZINC000426374816 856264583 /nfs/dbraw/zinc/26/45/83/856264583.db2.gz ZBVGVAQCFLPJFW-MRXNPFEDSA-N 0 3 400.357 4.111 20 0 HIADHN CCOc1ccc(NC(=O)c2ccc(NC(=O)CN3CC[C@H]4CCC[C@@H]43)cc2)cc1 ZINC000426464845 856305209 /nfs/dbraw/zinc/30/52/09/856305209.db2.gz YGLSWHSDKBDYPB-VGSWGCGISA-N 0 3 407.514 4.151 20 0 HIADHN Cc1ccnc(-c2nnc([C@@H](C)[NH2+]C[C@H](C)c3cccc(Br)c3)[n-]2)c1 ZINC000426510439 856326068 /nfs/dbraw/zinc/32/60/68/856326068.db2.gz OIJSKHRVFKAHQE-UONOGXRCSA-N 0 3 400.324 4.392 20 0 HIADHN CCN1CCC[C@@H](CN(C)C(=O)N[C@H](C)CC2CCCCC2)[C@@H]1c1cnn(C)c1 ZINC000426592258 856363698 /nfs/dbraw/zinc/36/36/98/856363698.db2.gz XTZUFORSKOJNNR-KAGYGMCKSA-N 0 3 403.615 4.193 20 0 HIADHN CC(C)Oc1ccc(CN(C)[C@H](C)c2cccc(N3CCCS3(=O)=O)c2)cc1 ZINC000426747720 856451096 /nfs/dbraw/zinc/45/10/96/856451096.db2.gz RKXUGHANNQGUJY-GOSISDBHSA-N 0 3 402.560 4.207 20 0 HIADHN O=C(Nc1ccccc1)c1ccc(CN2CCC(OC[C@@H]3CCCCO3)CC2)cc1 ZINC000426773886 856470491 /nfs/dbraw/zinc/47/04/91/856470491.db2.gz LSLZBZUKDFQKMY-DEOSSOPVSA-N 0 3 408.542 4.489 20 0 HIADHN CCCc1nc(C(=O)N(Cc2ccccc2Br)C2CCN(C)CC2)co1 ZINC000426781136 856474403 /nfs/dbraw/zinc/47/44/03/856474403.db2.gz YSHLPDKYQPLBRS-UHFFFAOYSA-N 0 3 420.351 4.126 20 0 HIADHN Cc1cc(C(=O)N(Cc2ccccc2Br)C2CCN(C)CC2)ccc1O ZINC000426796609 856483366 /nfs/dbraw/zinc/48/33/66/856483366.db2.gz CMCJIMDWXDKZHU-UHFFFAOYSA-N 0 3 417.347 4.200 20 0 HIADHN COc1ccccc1[C@@H](NC(=O)N(Cc1ccco1)C1CCN(C)CC1)c1ccco1 ZINC000426809756 856491068 /nfs/dbraw/zinc/49/10/68/856491068.db2.gz FYWFCILHGPXGKS-HSZRJFAPSA-N 0 3 423.513 4.277 20 0 HIADHN CN1C[C@@H](c2ccccc2)[C@H](NC(=O)c2cc3ccccc3n2CC(F)(F)F)C1 ZINC000426986438 856580390 /nfs/dbraw/zinc/58/03/90/856580390.db2.gz KYVLZNUABCGNPF-ZWKOTPCHSA-N 0 3 401.432 4.031 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)Nc1cccc(Oc2ccccn2)c1 ZINC000437458991 862822517 /nfs/dbraw/zinc/82/25/17/862822517.db2.gz BLNZAIHAGJJVGN-UHFFFAOYSA-N 0 3 416.525 4.415 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3csc(-c4cccs4)n3)CC2)C[C@@H](C)O1 ZINC000427287774 856752460 /nfs/dbraw/zinc/75/24/60/856752460.db2.gz MIVNUYDKEJHYHH-HZPDHXFCSA-N 0 3 419.616 4.223 20 0 HIADHN Cc1cc(C(=O)CCC(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)c(C)s1 ZINC000427291386 856755439 /nfs/dbraw/zinc/75/54/39/856755439.db2.gz FUGJCUULRYYNRW-CALCHBBNSA-N 0 3 420.619 4.066 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3ccc4c5c(cccc53)CC4)CC2)C[C@@H](C)O1 ZINC000427292677 856756397 /nfs/dbraw/zinc/75/63/97/856756397.db2.gz SOKQPXHCHCUCGO-RTBURBONSA-N 0 3 406.570 4.290 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)c3cc4cc(F)ccc4s3)CC2)C[C@H](C)O1 ZINC000427297215 856757346 /nfs/dbraw/zinc/75/73/46/856757346.db2.gz SBOCJSSZCBHAAQ-HOTGVXAUSA-N 0 3 404.551 4.392 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)[C@@H]3CCC[C@@H](C(F)(F)F)C3)CC2)C[C@H](C)O1 ZINC000427297433 856758740 /nfs/dbraw/zinc/75/87/40/856758740.db2.gz STPGAAYSAJAXTN-UKBAYJJMSA-N 0 3 404.517 4.093 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3ccc(-c4ccccc4F)o3)CC2)C[C@H](C)O1 ZINC000427311668 856764416 /nfs/dbraw/zinc/76/44/16/856764416.db2.gz DKKXSZDVBGYZHC-HDICACEKSA-N 0 3 414.521 4.437 20 0 HIADHN COc1ccccc1C[C@@H](C)CC(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000427330996 856775409 /nfs/dbraw/zinc/77/54/09/856775409.db2.gz OMGBASKGSWFCGL-NJYVYQBISA-N 0 3 416.606 4.002 20 0 HIADHN CC(C)[C@@H](Cc1ccccc1)C(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000427342098 856781937 /nfs/dbraw/zinc/78/19/37/856781937.db2.gz LBHWCFPJGQAEJL-PQNGQFLHSA-N 0 3 400.607 4.239 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)[C@H]3CCSc4ccccc43)CC2)C[C@@H](C)O1 ZINC000427346722 856785149 /nfs/dbraw/zinc/78/51/49/856785149.db2.gz KUSMRPHWMOWUPN-OPYAIIAOSA-N 0 3 402.604 4.004 20 0 HIADHN CC(C)CC(=O)N[C@@H](C(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1)c1ccccc1 ZINC000437477072 862837477 /nfs/dbraw/zinc/83/74/77/862837477.db2.gz RYMDZZHMBUKJCG-SQJMNOBHSA-N 0 3 421.585 4.013 20 0 HIADHN CN(C)Cc1cccc(NC(=O)C(=O)N[C@@H]2CCc3ccc(-c4ccccc4)cc32)c1 ZINC000427402412 856807431 /nfs/dbraw/zinc/80/74/31/856807431.db2.gz CLFGLVPDYRRTQF-XMMPIXPASA-N 0 3 413.521 4.157 20 0 HIADHN O=C(C[C@@H]1C=CCCC1)NC1CCN(CCOc2ccc(Br)cc2)CC1 ZINC000427448058 856824103 /nfs/dbraw/zinc/82/41/03/856824103.db2.gz DPXYTEXPLGKOIM-QGZVFWFLSA-N 0 3 421.379 4.155 20 0 HIADHN CSc1nccn1-c1ccc(C(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)cc1 ZINC000437488917 862846796 /nfs/dbraw/zinc/84/67/96/862846796.db2.gz XRQPQJYOLXVPDV-IBGZPJMESA-N 0 3 420.582 4.331 20 0 HIADHN CCNC(=O)COc1ccc(CN[C@H]2CCSc3cc(C)c(C)cc32)cc1OC ZINC000427619247 856889643 /nfs/dbraw/zinc/88/96/43/856889643.db2.gz XBBAMBWSASPGFF-IBGZPJMESA-N 0 3 414.571 4.154 20 0 HIADHN CC(=O)N1CCN(c2ccccc2CN[C@@H]2CCSc3cc(C)c(C)cc32)CC1 ZINC000427708394 856918037 /nfs/dbraw/zinc/91/80/37/856918037.db2.gz YRNMIZRXMCGOOR-JOCHJYFZSA-N 0 3 409.599 4.299 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)c3c[nH]nc3-c3ccc(Cl)s3)c2)CC1 ZINC000427811003 856965844 /nfs/dbraw/zinc/96/58/44/856965844.db2.gz KIBZUJNERMSMMN-UHFFFAOYSA-N 0 3 415.950 4.186 20 0 HIADHN C[C@H](N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1=O)[C@@H]1OCCc2sccc21 ZINC000427866870 856986987 /nfs/dbraw/zinc/98/69/87/856986987.db2.gz SUQNNQZSVJFOBG-IRWQIABSSA-N 0 3 422.497 4.137 20 0 HIADHN Cc1ccc(Br)cc1-c1nnc(N2CCC[C@@H]3CN(C)CC[C@@H]32)s1 ZINC000428170498 857095164 /nfs/dbraw/zinc/09/51/64/857095164.db2.gz IWHNGELGCUSTPP-CJNGLKHVSA-N 0 3 407.381 4.197 20 0 HIADHN O=C(NCc1ccco1)c1cccc(CN(CCc2ccccc2)[C@H]2CCOC2)c1 ZINC000437534533 862871361 /nfs/dbraw/zinc/87/13/61/862871361.db2.gz JMJNFOJSAIACHL-QHCPKHFHSA-N 0 3 404.510 4.043 20 0 HIADHN O=C(CCN1CCS[C@@H]2CCCC[C@@H]21)Nc1ccc(Br)cc1F ZINC000437541438 862875422 /nfs/dbraw/zinc/87/54/22/862875422.db2.gz XATCOCATOWGGGO-JKSUJKDBSA-N 0 3 401.345 4.277 20 0 HIADHN c1c(CN2CCC[C@H](OCC3CC3)C2)c(-c2cccnc2)nn1Cc1ccccc1 ZINC000428388139 857186776 /nfs/dbraw/zinc/18/67/76/857186776.db2.gz VQYDYTPJDABOIC-DEOSSOPVSA-N 0 3 402.542 4.384 20 0 HIADHN O=C(CC1(N2CCOCC2)CCCC1)N(Cc1cccc(-c2cccnc2)c1)C1CC1 ZINC000428404885 857193864 /nfs/dbraw/zinc/19/38/64/857193864.db2.gz WRVURODFXURMDZ-UHFFFAOYSA-N 0 3 419.569 4.275 20 0 HIADHN COc1c(C)cc(CN(C)[C@@H](C)c2cccc(N3CCCS3(=O)=O)c2)cc1C ZINC000428477507 857217476 /nfs/dbraw/zinc/21/74/76/857217476.db2.gz UMUOPWMOCLTYAP-SFHVURJKSA-N 0 3 402.560 4.045 20 0 HIADHN CC(C)(C)c1nn(-c2ccccc2Cl)cc1CN1CCC(Cn2cncn2)CC1 ZINC000428488410 857222732 /nfs/dbraw/zinc/22/27/32/857222732.db2.gz STQHLKVTIMUXJY-UHFFFAOYSA-N 0 3 412.969 4.327 20 0 HIADHN C[C@H](Oc1ccc(Cl)cc1)C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000428513467 857234600 /nfs/dbraw/zinc/23/46/00/857234600.db2.gz DMGSECDSETVAKY-PXNSSMCTSA-N 0 3 424.932 4.390 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@@H](O)C2)c1)c1cc2c(s1)-c1ccccc1OC2 ZINC000428527090 857241061 /nfs/dbraw/zinc/24/10/61/857241061.db2.gz APTYBSWUEYWEFE-GOSISDBHSA-N 0 3 406.507 4.126 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@@H](O)C2)c1)c1occc1CSc1ccccc1 ZINC000428526570 857241574 /nfs/dbraw/zinc/24/15/74/857241574.db2.gz SXPPVHCTIUDZKY-HXUWFJFHSA-N 0 3 408.523 4.391 20 0 HIADHN CCc1ccc(-c2nc(CC(=O)Nc3cccc(CN4CC[C@H](O)C4)c3)cs2)cc1 ZINC000428531269 857244195 /nfs/dbraw/zinc/24/41/95/857244195.db2.gz FLUUROFUYKQEBZ-QFIPXVFZSA-N 0 3 421.566 4.120 20 0 HIADHN C[C@@H]1CCC[C@H](OCCCCCC(=O)Nc2cccc(CN3CC[C@H](O)C3)c2)C1 ZINC000428533045 857246178 /nfs/dbraw/zinc/24/61/78/857246178.db2.gz IEIUFLFTIKJTMN-OIBXWCBGSA-N 0 3 402.579 4.347 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)c1ccc2nc(-c3ccccc3)oc2c1 ZINC000428532544 857246360 /nfs/dbraw/zinc/24/63/60/857246360.db2.gz BXKGGWLWBHNDQD-NRFANRHFSA-N 0 3 413.477 4.314 20 0 HIADHN OC[C@]1(CNCc2cc(Cl)ccc2OC[C@H]2CCCO2)C[C@H]1c1ccc(F)cc1 ZINC000428541048 857253409 /nfs/dbraw/zinc/25/34/09/857253409.db2.gz DONDNJSKQWTBFY-FUPPJEDESA-N 0 3 419.924 4.293 20 0 HIADHN CCCn1c2ccccc2nc1CNC[C@H](CO)Cc1cccc(Br)c1 ZINC000428545884 857256254 /nfs/dbraw/zinc/25/62/54/857256254.db2.gz WLORNSPDFAGCPY-QGZVFWFLSA-N 0 3 416.363 4.150 20 0 HIADHN C[C@H](Cc1ccc(Cl)cc1Cl)C(=O)Nc1cccc(CN2CC[C@H](O)C2)c1 ZINC000428547297 857258187 /nfs/dbraw/zinc/25/81/87/857258187.db2.gz YPOUACZIRIAWTB-KUHUBIRLSA-N 0 3 407.341 4.377 20 0 HIADHN OC[C@@H](CNCc1sccc1Br)Cc1ccc(Br)cc1 ZINC000428549118 857258426 /nfs/dbraw/zinc/25/84/26/857258426.db2.gz PLZRGELMDXJWJI-GFCCVEGCSA-N 0 3 419.182 4.214 20 0 HIADHN COc1cccc(CNC[C@H]2CSCCN2Cc2ccccc2)c1OC(F)F ZINC000428557276 857265197 /nfs/dbraw/zinc/26/51/97/857265197.db2.gz CAKGLQKEWFJDBO-SFHVURJKSA-N 0 3 408.514 4.004 20 0 HIADHN Cn1c(CNC[C@@]2(Cc3ccc(F)cc3)CCC[C@H]2O)nc2ccc(Cl)cc21 ZINC000428564109 857267857 /nfs/dbraw/zinc/26/78/57/857267857.db2.gz IJXJUIZHAJUOQJ-IRLDBZIGSA-N 0 3 401.913 4.229 20 0 HIADHN COc1ccc(CNC[C@]2(Cc3ccc(F)cc3)CCC[C@@H]2O)c(Cl)c1OC ZINC000428574220 857269891 /nfs/dbraw/zinc/26/98/91/857269891.db2.gz QZGBWOOOXCYERE-SIKLNZKXSA-N 0 3 407.913 4.360 20 0 HIADHN C[C@@H](CNC(=O)N1CCC(c2ncccc2Cl)CC1)N(C)Cc1ccccc1 ZINC000428576827 857269919 /nfs/dbraw/zinc/26/99/19/857269919.db2.gz CYSXHBMQPVWLDX-KRWDZBQOSA-N 0 3 400.954 4.145 20 0 HIADHN Cc1cc([C@@H](C)NC(=O)NC[C@@H]2CN(Cc3ccccc3)CCCO2)c(C)s1 ZINC000428691029 857298526 /nfs/dbraw/zinc/29/85/26/857298526.db2.gz GQESOYFKULOIIV-YLJYHZDGSA-N 0 3 401.576 4.016 20 0 HIADHN CN(Cc1c[nH]nc1-c1ccsc1)C[C@@H](O)COc1ccccc1C(F)(F)F ZINC000437578577 862895961 /nfs/dbraw/zinc/89/59/61/862895961.db2.gz GOOIHORFUOFKDB-OAHLLOKOSA-N 0 3 411.449 4.029 20 0 HIADHN CCOC(=O)Cn1nc(C)c(CN(Cc2cccc(Br)c2)C(C)C)c1C ZINC000437579406 862897477 /nfs/dbraw/zinc/89/74/77/862897477.db2.gz IGARPCVSZIYLNW-UHFFFAOYSA-N 0 3 422.367 4.236 20 0 HIADHN COCc1nc(CN(Cc2ccncc2)[C@H]2CCCN(Cc3ccccc3)C2)cs1 ZINC000428797259 857346645 /nfs/dbraw/zinc/34/66/45/857346645.db2.gz PRKKKWUFOOGLJK-QHCPKHFHSA-N 0 3 422.598 4.351 20 0 HIADHN CC(C)c1nnc(CN(Cc2ccncc2)[C@H]2CCCN(Cc3ccccc3)C2)o1 ZINC000428800914 857349165 /nfs/dbraw/zinc/34/91/65/857349165.db2.gz DNMBIPOYSDVQDX-QFIPXVFZSA-N 0 3 405.546 4.255 20 0 HIADHN CCCn1c(C)nnc1CN(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000428807199 857353267 /nfs/dbraw/zinc/35/32/67/857353267.db2.gz CJHFWTZZHLARMQ-DEOSSOPVSA-N 0 3 418.589 4.058 20 0 HIADHN C[C@@H](NC(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1)C(C)(C)c1ccccc1 ZINC000428814040 857357132 /nfs/dbraw/zinc/35/71/32/857357132.db2.gz CAVCXARYLUHITM-QHAWAJNXSA-N 0 3 415.622 4.274 20 0 HIADHN C[C@H](NC(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1)C(C)(C)c1ccccc1 ZINC000428814034 857357196 /nfs/dbraw/zinc/35/71/96/857357196.db2.gz CAVCXARYLUHITM-HBMCJLEFSA-N 0 3 415.622 4.274 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)NCc3csc4ccccc34)CC2)C[C@H](C)O1 ZINC000428839870 857368095 /nfs/dbraw/zinc/36/80/95/857368095.db2.gz MSZBLNRUZOGOQN-HDICACEKSA-N 0 3 415.603 4.322 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)NCc3csc4ccccc34)CC2)C[C@@H](C)O1 ZINC000428839872 857368468 /nfs/dbraw/zinc/36/84/68/857368468.db2.gz MSZBLNRUZOGOQN-QZTJIDSGSA-N 0 3 415.603 4.322 20 0 HIADHN C[C@H](C(=O)Nc1cccc(F)c1)N1CCN([C@H]2CC[C@](C)(c3ccccc3)C2)CC1 ZINC000437590454 862903838 /nfs/dbraw/zinc/90/38/38/862903838.db2.gz MIZPCMDXPVWMDY-VPHKFGTKSA-N 0 3 409.549 4.281 20 0 HIADHN C[C@H](c1ccccc1)[C@H](NCc1c(-c2ccc(Cl)cc2)nc2sccn21)C(N)=O ZINC000428866335 857378243 /nfs/dbraw/zinc/37/82/43/857378243.db2.gz YLVIDKZOTISZAO-KUHUBIRLSA-N 0 3 424.957 4.463 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3ccc(OCC4CC4)cc3)CC2)C[C@@H](C)O1 ZINC000428890631 857394016 /nfs/dbraw/zinc/39/40/16/857394016.db2.gz VGXMCMZLCRHAKD-RTBURBONSA-N 0 3 415.578 4.219 20 0 HIADHN CCn1cnnc1-c1ccccc1NC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000428899189 857399962 /nfs/dbraw/zinc/39/99/62/857399962.db2.gz CBGGBGKQTOSLQO-HXUWFJFHSA-N 0 3 418.545 4.093 20 0 HIADHN CCc1ccccc1NC(=O)CN1CCN([C@@H]2CC[C@](C)(c3ccccc3)C2)CC1 ZINC000437593682 862908485 /nfs/dbraw/zinc/90/84/85/862908485.db2.gz UQCJXDULJLZLIJ-BVAGGSTKSA-N 0 3 405.586 4.316 20 0 HIADHN CCSc1cc(Cl)ccc1C(=O)N(C)C[C@]1(O)CCN(Cc2ccccc2)C1 ZINC000428955015 857434021 /nfs/dbraw/zinc/43/40/21/857434021.db2.gz SXMDDIXNLDJCGO-JOCHJYFZSA-N 0 3 418.990 4.161 20 0 HIADHN Cc1c(C(=O)N(C)C[C@@]2(O)CCN(Cc3ccccc3)C2)sc2cccc(F)c12 ZINC000428970041 857439698 /nfs/dbraw/zinc/43/96/98/857439698.db2.gz SKCWMOIDBMSUHL-QHCPKHFHSA-N 0 3 412.530 4.058 20 0 HIADHN CN(Cc1ccc2ccccc2c1)C(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000429021142 857461065 /nfs/dbraw/zinc/46/10/65/857461065.db2.gz PIQNTWIGMGICSY-RUZDIDTESA-N 0 3 417.553 4.272 20 0 HIADHN Cc1ccc([C@@H]2CCCN2C(=O)NC[C@@H]2CN(Cc3ccccc3)CCCO2)s1 ZINC000429020285 857461790 /nfs/dbraw/zinc/46/17/90/857461790.db2.gz LEMNPHHRMVYKPW-RTWAWAEBSA-N 0 3 413.587 4.194 20 0 HIADHN Cc1nc2ccc(NC(=O)NC[C@@H]3CN(Cc4ccccc4)CCCO3)cc2s1 ZINC000429038540 857470271 /nfs/dbraw/zinc/47/02/71/857470271.db2.gz CAXQXLRXIKLILP-LJQANCHMSA-N 0 3 410.543 4.017 20 0 HIADHN CC(C)N(Cc1cccc(F)c1)C(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000429048802 857476133 /nfs/dbraw/zinc/47/61/33/857476133.db2.gz SXWSWMFLODEGOZ-HSZRJFAPSA-N 0 3 413.537 4.037 20 0 HIADHN O=C(NC[C@H]1CN(Cc2ccccc2)CCCO1)N1CCCCC[C@@H]1c1ccco1 ZINC000429049211 857477723 /nfs/dbraw/zinc/47/77/23/857477723.db2.gz BGJWPMHIUVGUQV-FCHUYYIVSA-N 0 3 411.546 4.197 20 0 HIADHN CC(C)OCc1ccc(NC(=O)NC[C@@H]2CN(Cc3ccccc3)CCCO2)cc1 ZINC000429056764 857483063 /nfs/dbraw/zinc/48/30/63/857483063.db2.gz ZADDIEGHJAJAFC-HSZRJFAPSA-N 0 3 411.546 4.024 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3ccc4scnc4c3)CC2)C[C@@H](C)O1 ZINC000429080463 857498862 /nfs/dbraw/zinc/49/88/62/857498862.db2.gz QQCXCYKDOCKLAH-HZPDHXFCSA-N 0 3 402.564 4.040 20 0 HIADHN COCCOc1ccc(C(F)(F)F)cc1NC(=O)CN(C1CCC1)C1CCC1 ZINC000429188927 857546803 /nfs/dbraw/zinc/54/68/03/857546803.db2.gz JPIVQSOEFQPJMW-UHFFFAOYSA-N 0 3 400.441 4.076 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)Nc3ccccc3N3CCCC3)CC2)C[C@H](C)O1 ZINC000429205286 857552984 /nfs/dbraw/zinc/55/29/84/857552984.db2.gz BXACCKFRMOBSCE-PMACEKPBSA-N 0 3 414.594 4.030 20 0 HIADHN O=C(CN[C@@H]1Cc2cccc(O)c2C1)N[C@H](c1ccccc1)c1cccc(Cl)c1 ZINC000429227524 857564207 /nfs/dbraw/zinc/56/42/07/857564207.db2.gz OAYNMYKUYHLSNZ-HYBUGGRVSA-N 0 3 406.913 4.008 20 0 HIADHN CCCOc1cccc(NC(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)c1 ZINC000429249553 857574679 /nfs/dbraw/zinc/57/46/79/857574679.db2.gz BVWCRBXUYTZQOJ-OALUTQOASA-N 0 3 403.567 4.219 20 0 HIADHN CSC[C@@H]1CCCN(CC(=O)N(C)[C@@H](c2ccccc2)c2ccc(F)cc2)C1 ZINC000429275250 857586526 /nfs/dbraw/zinc/58/65/26/857586526.db2.gz KQMZSSRIILZVBZ-JPYJTQIMSA-N 0 3 400.563 4.449 20 0 HIADHN Cc1cnc([C@H](C)NC(=O)N[C@H](CN2CCc3ccccc3C2)C(C)(C)C)s1 ZINC000429321839 857602182 /nfs/dbraw/zinc/60/21/82/857602182.db2.gz FZKJFFJWMQLIDJ-QFBILLFUSA-N 0 3 400.592 4.285 20 0 HIADHN C[C@@H](NCc1cccc2c(Br)cccc12)c1cccc(S(N)(=O)=O)c1 ZINC000429339142 857609512 /nfs/dbraw/zinc/60/95/12/857609512.db2.gz YZVHWASKCCENIR-CYBMUJFWSA-N 0 3 419.344 4.101 20 0 HIADHN CC(C)n1nccc1NC(=O)[C@H](C)N[C@H]1c2cccc(Br)c2CC1(C)C ZINC000429412307 857651895 /nfs/dbraw/zinc/65/18/95/857651895.db2.gz ZREYCKMJVIIAPC-UGSOOPFHSA-N 0 3 419.367 4.467 20 0 HIADHN COCCS(=O)(=O)c1ccc(CN[C@@H]2CCCCc3ccc(Cl)cc32)cc1 ZINC000429426898 857661116 /nfs/dbraw/zinc/66/11/16/857661116.db2.gz GVVPCGWSTFWUHN-OAQYLSRUSA-N 0 3 407.963 4.317 20 0 HIADHN COCCS(=O)(=O)c1ccc(CN[C@H](c2ccc(C)cc2)C2CCCC2)cc1 ZINC000429445388 857673720 /nfs/dbraw/zinc/67/37/20/857673720.db2.gz PIZJIGQUYOTTGV-QHCPKHFHSA-N 0 3 401.572 4.436 20 0 HIADHN CC(C)(C)[C@H](CN1CCc2ccccc2C1)NC(=O)N1CCC[C@@H]1c1cccnc1 ZINC000429495326 857697064 /nfs/dbraw/zinc/69/70/64/857697064.db2.gz VGLBGYOQKSEBKF-PKTZIBPZSA-N 0 3 406.574 4.401 20 0 HIADHN CCc1cnc(CN(C)C(=O)N[C@H](CN2CCc3ccccc3C2)C(C)(C)C)s1 ZINC000429501187 857700528 /nfs/dbraw/zinc/70/05/28/857700528.db2.gz HNYJFPHGLFFQQA-HXUWFJFHSA-N 0 3 414.619 4.320 20 0 HIADHN Cc1cnn([C@@H]2CCCN(C(=O)N[C@H](CN3CCc4ccccc4C3)C(C)(C)C)C2)c1 ZINC000429504861 857702817 /nfs/dbraw/zinc/70/28/17/857702817.db2.gz RNRGWDLZTUNKIR-DHIUTWEWSA-N 0 3 423.605 4.011 20 0 HIADHN CN(C)C(=O)COc1cccc(CN[C@H](Cc2ccccc2F)c2ccccc2)c1 ZINC000429519106 857713064 /nfs/dbraw/zinc/71/30/64/857713064.db2.gz JPJMBFUSMPVOIC-XMMPIXPASA-N 0 3 406.501 4.366 20 0 HIADHN COC1(C[C@@H](C)N[C@@H](c2ccc(F)cc2)c2cccc(S(C)(=O)=O)c2)CCC1 ZINC000429526012 857718298 /nfs/dbraw/zinc/71/82/98/857718298.db2.gz HTQICUMAOPATGR-IERDGZPVSA-N 0 3 405.535 4.256 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)Nc1ccnn1Cc1ccc(F)cc1 ZINC000429569311 857754991 /nfs/dbraw/zinc/75/49/91/857754991.db2.gz LSJCEXVQZOTWKA-OAQYLSRUSA-N 0 3 407.493 4.029 20 0 HIADHN C[C@H]1CCN(C(=O)NC[C@H](c2ccccc2)C(C)(C)CO)CCN1Cc1ccccc1 ZINC000437628115 862950948 /nfs/dbraw/zinc/95/09/48/862950948.db2.gz QQRUUVRPLCUROC-XUZZJYLKSA-N 0 3 423.601 4.095 20 0 HIADHN CC(F)(F)c1cccc(NC(=O)NC[C@H]2CN(Cc3ccccc3)CCCO2)c1 ZINC000429620041 857801716 /nfs/dbraw/zinc/80/17/16/857801716.db2.gz GCUGOJFNIBEZKW-FQEVSTJZSA-N 0 3 403.473 4.211 20 0 HIADHN CN1CCN(CCC(C)(C)NC(=O)Nc2ccc(C(C)(C)C(F)(F)F)cc2)CC1 ZINC000429676345 857831285 /nfs/dbraw/zinc/83/12/85/857831285.db2.gz QLZSFPNDAIJOFI-UHFFFAOYSA-N 0 3 414.516 4.064 20 0 HIADHN O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)Nc1ccc(CC(F)(F)F)cc1 ZINC000429763663 857876319 /nfs/dbraw/zinc/87/63/19/857876319.db2.gz IXUVSYZTHFWEPQ-HXUWFJFHSA-N 0 3 421.463 4.204 20 0 HIADHN CC(C)N1CC[C@H](NCC(=O)Nc2ccccc2F)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000429793778 857887349 /nfs/dbraw/zinc/88/73/49/857887349.db2.gz WHCWBGCWKVRUKV-FPOVZHCZSA-N 0 3 407.892 4.370 20 0 HIADHN C[C@H](C(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1)c1ccc2c(c1)OCO2 ZINC000429815195 857894900 /nfs/dbraw/zinc/89/49/00/857894900.db2.gz ZOTYQUFCBDEQDN-HNNXBMFYSA-N 0 3 422.447 4.128 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)c3ccc(C(C)(F)F)cc3)CC2)c1 ZINC000429823878 857898539 /nfs/dbraw/zinc/89/85/39/857898539.db2.gz FSQSSWQEXAOLHA-UHFFFAOYSA-N 0 3 415.528 4.439 20 0 HIADHN C[C@@H](C(=O)Nc1ccc(CCN2CCSCC2)cc1)[C@@H]1OCCc2sccc21 ZINC000429890922 857929396 /nfs/dbraw/zinc/92/93/96/857929396.db2.gz PZXYEMSTIVPJAJ-IERDGZPVSA-N 0 3 416.612 4.228 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)c1c[nH]c(C(F)(F)F)c1 ZINC000429898217 857934062 /nfs/dbraw/zinc/93/40/62/857934062.db2.gz GKTDXPJGFUKNKZ-UHFFFAOYSA-N 0 3 407.358 4.256 20 0 HIADHN CCn1c(SC[C@H]2CN(Cc3ccccc3)CCCO2)nnc1-c1ccccc1 ZINC000430120024 858039998 /nfs/dbraw/zinc/03/99/98/858039998.db2.gz GKASMJNVIOHCBM-OAQYLSRUSA-N 0 3 408.571 4.348 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)N[C@H]2C[C@@H]2c2ccccc2OC(F)F)C1 ZINC000437648574 862981150 /nfs/dbraw/zinc/98/11/50/862981150.db2.gz VPBLOTLDNPAJEN-ZSXHRAQDSA-N 0 3 415.484 4.279 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CCCC[C@@H]1c1nccn1CC)c1ccsc1 ZINC000430185515 858072615 /nfs/dbraw/zinc/07/26/15/858072615.db2.gz DYIBSYISHFPMJU-MOPGFXCFSA-N 0 3 403.596 4.284 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N[C@H]2C[C@@H]2c2ccccc2OC(F)F)N(C)C)cc1 ZINC000437655519 862992410 /nfs/dbraw/zinc/99/24/10/862992410.db2.gz NVRHSIKEDPWPIZ-QYZOEREBSA-N 0 3 403.473 4.054 20 0 HIADHN Cc1ccc(CCCC(=O)NCCCCN2CCN(c3cccc(C)c3)CC2)s1 ZINC000430774764 858300271 /nfs/dbraw/zinc/30/02/71/858300271.db2.gz GKJIHGWKCXBJMQ-UHFFFAOYSA-N 0 3 413.631 4.406 20 0 HIADHN CCN(CC)[C@@H](CN1C(=O)N[C@H](c2ccc(Cl)c(F)c2)C1=O)c1ccsc1 ZINC000430867536 858345832 /nfs/dbraw/zinc/34/58/32/858345832.db2.gz KVKAKQSOQMTONQ-DLBZAZTESA-N 0 3 409.914 4.217 20 0 HIADHN C[C@@H](NC(=O)N1CCC[C@@H]1c1ccc(Br)c(F)c1)C1=CCN(C)CC1 ZINC000430892268 858358011 /nfs/dbraw/zinc/35/80/11/858358011.db2.gz CLTBPBUDDFCSDU-FZKQIMNGSA-N 0 3 410.331 4.085 20 0 HIADHN O=C1[C@@H]2C[C@@H](C3CCCCC3)CN2C(=O)N1C[C@H](c1cccs1)N1CCCC1 ZINC000430976858 858389158 /nfs/dbraw/zinc/38/91/58/858389158.db2.gz UIJFCPMVAYAQMJ-CEXWTWQISA-N 0 3 401.576 4.118 20 0 HIADHN O=C1N[C@@H](C[C@@H]2CCCc3ccccc32)C(=O)N1C1CCN(Cc2ccccc2)CC1 ZINC000430980426 858389829 /nfs/dbraw/zinc/38/98/29/858389829.db2.gz DWGFYIXZYIWOBX-URXFXBBRSA-N 0 3 417.553 4.082 20 0 HIADHN CN1C(=O)N([C@H]2CCN(Cc3ccccc3)C2)C(=O)[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000430981116 858391247 /nfs/dbraw/zinc/39/12/47/858391247.db2.gz WCODOKHNUSGTLD-QFBILLFUSA-N 0 3 418.324 4.203 20 0 HIADHN c1nc2c(ncnc2N2CCN(C(c3ccccc3)c3ccccc3)CC2)n1C1CC1 ZINC000431015286 858404922 /nfs/dbraw/zinc/40/49/22/858404922.db2.gz OCWILIFAYDVHCP-UHFFFAOYSA-N 0 3 410.525 4.073 20 0 HIADHN CCc1noc(-c2ccc(C)c(NC(=O)N3CCN(CC4CCCCC4)CC3)c2)n1 ZINC000431114725 858453128 /nfs/dbraw/zinc/45/31/28/858453128.db2.gz ZOCREFDNKFKVJT-UHFFFAOYSA-N 0 3 411.550 4.337 20 0 HIADHN CCCN(C(=O)c1cccs1)C1CCN(CCC(=O)Nc2ccccc2F)CC1 ZINC000431139022 858466012 /nfs/dbraw/zinc/46/60/12/858466012.db2.gz NHMQKIMBDHALCF-UHFFFAOYSA-N 0 3 417.550 4.233 20 0 HIADHN O=C1CN(Cc2ccc(Cl)cc2)C(=O)N1C[C@H]1CCCN(Cc2cccs2)C1 ZINC000431163879 858480191 /nfs/dbraw/zinc/48/01/91/858480191.db2.gz ZRNLNAKWTYOOGY-KRWDZBQOSA-N 0 3 417.962 4.078 20 0 HIADHN CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)N[C@@H]1C[C@H]1c1cccc2ccccc21 ZINC000431189695 858495035 /nfs/dbraw/zinc/49/50/35/858495035.db2.gz FAVQBGMUSRCELZ-OXCBMLQPSA-N 0 3 414.553 4.425 20 0 HIADHN COc1ccc2nc(NC(=O)N3CC[C@@H](C)N(Cc4ccccc4)CC3)sc2c1 ZINC000437705561 863037543 /nfs/dbraw/zinc/03/75/43/863037543.db2.gz AXEOBLIYBMWRAX-MRXNPFEDSA-N 0 3 410.543 4.433 20 0 HIADHN c1nc2c(ncnc2N2CCN(C3c4ccccc4-c4ccccc43)CC2)n1C1CC1 ZINC000431430862 858611051 /nfs/dbraw/zinc/61/10/51/858611051.db2.gz NASCPSGWEIQCFJ-UHFFFAOYSA-N 0 3 408.509 4.053 20 0 HIADHN CC(=O)NC[C@H]1CCCN(Cc2cn(-c3ccccc3)nc2-c2ccc(F)cc2)C1 ZINC000431738193 858775820 /nfs/dbraw/zinc/77/58/20/858775820.db2.gz BJGNRYKFKRTNAM-LJQANCHMSA-N 0 3 406.505 4.027 20 0 HIADHN C[C@@H]1CCc2c(F)cccc2[C@H]1NC(=O)N(C)C1CCN(CCc2ccccn2)CC1 ZINC000431740372 858779266 /nfs/dbraw/zinc/77/92/66/858779266.db2.gz GWSIWNSBYJJOCL-KOSHJBKYSA-N 0 3 424.564 4.193 20 0 HIADHN CCC(CC)n1nccc1C(=O)N(CCN(C)C)Cc1ccc(Br)cc1 ZINC000431780324 858808307 /nfs/dbraw/zinc/80/83/07/858808307.db2.gz DWGPHMZMBAEKAP-UHFFFAOYSA-N 0 3 421.383 4.211 20 0 HIADHN O=C(Nc1ccc(OCc2noc(C3CC3)n2)cc1)[C@H]1CCCCN1C1CCCC1 ZINC000431782480 858809332 /nfs/dbraw/zinc/80/93/32/858809332.db2.gz DULXSAWSNWVEOE-HXUWFJFHSA-N 0 3 410.518 4.262 20 0 HIADHN CCC(CC)n1ccc(C(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)n1 ZINC000431788440 858811568 /nfs/dbraw/zinc/81/15/68/858811568.db2.gz ZXDDPYOZYPCXGB-UHFFFAOYSA-N 0 3 410.484 4.467 20 0 HIADHN C[C@H](NC(=O)[C@@H]1CCCCN1C1CCCC1)c1noc(-c2ccc(Cl)cc2)n1 ZINC000431865368 858845701 /nfs/dbraw/zinc/84/57/01/858845701.db2.gz POQTZPRUHSOOSG-KSSFIOAISA-N 0 3 402.926 4.364 20 0 HIADHN COc1ccc2c(c1)[C@H](C(=O)Nc1ccnn1[C@H]1CCN(Cc3ccccc3)C1)CC2 ZINC000431924852 858873014 /nfs/dbraw/zinc/87/30/14/858873014.db2.gz LRUWQNSUTVHLKD-RBBKRZOGSA-N 0 3 416.525 4.007 20 0 HIADHN COc1cnccc1N1CCN(C(=O)Nc2cccc(COC(C)(C)C)c2C)CC1 ZINC000432225990 859056479 /nfs/dbraw/zinc/05/64/79/859056479.db2.gz BPYWJJVQEMQIHH-UHFFFAOYSA-N 0 3 412.534 4.068 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)CO[C@H]3CCCc4ccccc43)c2)CC1 ZINC000432251478 859068772 /nfs/dbraw/zinc/06/87/72/859068772.db2.gz STTQEKGWBCXCHH-DEOSSOPVSA-N 0 3 407.558 4.250 20 0 HIADHN Cc1cc(NC(=O)Nc2cn(C)nc2C(C)C)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000432277515 859082067 /nfs/dbraw/zinc/08/20/67/859082067.db2.gz QRTFZHSHOQKITP-IBGZPJMESA-N 0 3 421.549 4.139 20 0 HIADHN O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)N1CC2(CCC2)[C@@H]1c1ccccc1 ZINC000432347376 859113998 /nfs/dbraw/zinc/11/39/98/859113998.db2.gz OWDFLOLLQSEXCJ-RPWUZVMVSA-N 0 3 419.569 4.214 20 0 HIADHN Cc1cc(OCc2cccc(F)c2)ccc1NC(=O)[C@@H]1CCCN1C1CCOCC1 ZINC000432490969 859190590 /nfs/dbraw/zinc/19/05/90/859190590.db2.gz QOORSVQABDCZGD-QHCPKHFHSA-N 0 3 412.505 4.295 20 0 HIADHN Cc1ccc(-c2cncc(C(=O)N3CCC(CCN4C[C@@H](C)O[C@@H](C)C4)CC3)c2)cc1 ZINC000467602035 881409654 /nfs/dbraw/zinc/40/96/54/881409654.db2.gz MVTXQNVPWFMEPE-OYRHEFFESA-N 0 3 421.585 4.409 20 0 HIADHN C[C@H]1CN(C(=O)Nc2ccc(CCN3CCSCC3)cc2)Cc2ccccc2O1 ZINC000432765612 859344959 /nfs/dbraw/zinc/34/49/59/859344959.db2.gz CELDDZNPHBZWHI-SFHVURJKSA-N 0 3 411.571 4.093 20 0 HIADHN O=C(NCc1ccn(C2CCCC2)n1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000432855163 859389588 /nfs/dbraw/zinc/38/95/88/859389588.db2.gz PXGYJCRLJTXIFC-OAQYLSRUSA-N 0 3 420.479 4.069 20 0 HIADHN CN(C)Cc1ccc(S(=O)(=O)N(Cc2ccccc2C(F)(F)F)C2CC2)cc1 ZINC000432861535 859394044 /nfs/dbraw/zinc/39/40/44/859394044.db2.gz WOYQVECUSMDCGR-UHFFFAOYSA-N 0 3 412.477 4.120 20 0 HIADHN CC[C@H](C(=O)Nc1cccc(Oc2ncc(Br)cn2)c1)N(CC)CC ZINC000432870692 859400074 /nfs/dbraw/zinc/40/00/74/859400074.db2.gz DGNRKOGJNXWVIH-MRXNPFEDSA-N 0 3 407.312 4.090 20 0 HIADHN COc1ccccc1-c1noc(C2CCN(CC3=Cc4ccccc4OC3)CC2)n1 ZINC000433020263 859482099 /nfs/dbraw/zinc/48/20/99/859482099.db2.gz MUSLYLRFNLEFMA-UHFFFAOYSA-N 0 3 403.482 4.401 20 0 HIADHN Cc1cc(NC(=O)CSCCN(C)Cc2ccccc2)n(-c2ccccc2F)n1 ZINC000433023099 859484736 /nfs/dbraw/zinc/48/47/36/859484736.db2.gz NLVOLTQYICABJI-UHFFFAOYSA-N 0 3 412.534 4.124 20 0 HIADHN CN(CCSCC(=O)N1CCC(OCc2ccccc2)CC1)Cc1ccccc1 ZINC000433053195 859502053 /nfs/dbraw/zinc/50/20/53/859502053.db2.gz PHVULCMWCSHPLY-UHFFFAOYSA-N 0 3 412.599 4.059 20 0 HIADHN O=C(N[C@@H]1CCN(C2CC2)C1)[C@@H](Oc1ccc(Cl)c(Cl)c1)c1ccccc1 ZINC000503233461 912212224 /nfs/dbraw/zinc/21/22/24/912212224.db2.gz QSIAYGALRSKCNL-QRWLVFNGSA-N 0 3 405.325 4.466 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)Nc2cccc([S@](C)=O)c2)N(CC)CC)cc1 ZINC000433137474 859535510 /nfs/dbraw/zinc/53/55/10/859535510.db2.gz TZVNFYADJCKIAY-PIKZIKFNSA-N 0 3 401.576 4.191 20 0 HIADHN COc1cccc(OCCN2CCC(c3nc(-c4ccccc4OC)no3)CC2)c1 ZINC000433180233 859558201 /nfs/dbraw/zinc/55/82/01/859558201.db2.gz XHSOLYCCMOVRRO-UHFFFAOYSA-N 0 3 409.486 4.012 20 0 HIADHN CCN1CC[C@H](N[C@@H](C)c2cc(C(=O)OC)c(C)o2)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000433206553 859566075 /nfs/dbraw/zinc/56/60/75/859566075.db2.gz OBCLZNOZNOWFJE-LFBSBKMHSA-N 0 3 410.436 4.278 20 0 HIADHN CCN1CCN(Cc2ccc(CNC(=O)Nc3c(C)cccc3Cl)cc2)CC1 ZINC000467649717 881445910 /nfs/dbraw/zinc/44/59/10/881445910.db2.gz HTJYIOKMPJKERI-UHFFFAOYSA-N 0 3 400.954 4.108 20 0 HIADHN Cc1cc(NC(=O)N2CC3(CCC3)C[C@@H]2C)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000433496360 859733621 /nfs/dbraw/zinc/73/36/21/859733621.db2.gz FAGICGPEMHIPFW-PZJWPPBQSA-N 0 3 407.562 4.435 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)Nc3c4c(ccc3Cl)OCC4)CC2)C[C@H](C)O1 ZINC000433508447 859743507 /nfs/dbraw/zinc/74/35/07/859743507.db2.gz GEQVBWDKFKLKHC-HOTGVXAUSA-N 0 3 421.969 4.018 20 0 HIADHN O=C(NCc1cccc(COCc2ccccc2)c1)NC[C@@H]1CCCCN1C1CC1 ZINC000433552475 859771773 /nfs/dbraw/zinc/77/17/73/859771773.db2.gz DPUJGBPGDHXCJF-DEOSSOPVSA-N 0 3 407.558 4.220 20 0 HIADHN O=C(NCc1ccccc1COCc1ccccc1)NC[C@@H]1CCCCN1C1CC1 ZINC000433554320 859774882 /nfs/dbraw/zinc/77/48/82/859774882.db2.gz OCLKXNJGQUSMJN-DEOSSOPVSA-N 0 3 407.558 4.220 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)N[C@H](c1cc(F)ccc1F)C(F)F ZINC000433611785 859809261 /nfs/dbraw/zinc/80/92/61/859809261.db2.gz FHWACMDUXWVVLL-GOSISDBHSA-N 0 3 415.406 4.184 20 0 HIADHN CCNC(=O)Nc1cccc(NC(=O)N[C@@H](CN2CCCC2)c2ccccc2)c1C ZINC000433724277 859854983 /nfs/dbraw/zinc/85/49/83/859854983.db2.gz MVNBZKFSXUYGAQ-NRFANRHFSA-N 0 3 409.534 4.095 20 0 HIADHN CCNC(=O)Nc1cccc(NC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)c1C ZINC000433726207 859856552 /nfs/dbraw/zinc/85/65/52/859856552.db2.gz HETCGNUTJNJBJS-SFHVURJKSA-N 0 3 423.561 4.265 20 0 HIADHN CCNC(=O)Nc1cccc(NC(=O)NC[C@@H](CC)N2CCc3ccccc3C2)c1C ZINC000433747201 859872748 /nfs/dbraw/zinc/87/27/48/859872748.db2.gz DOULTUMJJWESRQ-HXUWFJFHSA-N 0 3 423.561 4.095 20 0 HIADHN CCNC(=O)Nc1cccc(NC(=O)NC[C@H](c2ccc(CC)cc2)N(C)C)c1C ZINC000433757650 859878677 /nfs/dbraw/zinc/87/86/77/859878677.db2.gz OVXUUJDITKJIPM-OAQYLSRUSA-N 0 3 411.550 4.123 20 0 HIADHN CC(C)[C@@H](N[C@H](C)C(=O)Nc1ccccc1S(C)(=O)=O)c1ccc(Cl)cc1 ZINC000433779206 859890064 /nfs/dbraw/zinc/89/00/64/859890064.db2.gz HQPHRIQCRSITGB-AUUYWEPGSA-N 0 3 408.951 4.057 20 0 HIADHN COc1cc(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2)ccc1OC(C)C ZINC000467684272 881476166 /nfs/dbraw/zinc/47/61/66/881476166.db2.gz BZOZHPPEJACCQF-UHFFFAOYSA-N 0 3 403.498 4.217 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)c1ccc(-c2nc(C3CC3)no2)cc1 ZINC000433857755 859938467 /nfs/dbraw/zinc/93/84/67/859938467.db2.gz FSMFLKVZULPUKU-OAQYLSRUSA-N 0 3 402.498 4.181 20 0 HIADHN C[C@@H](NS(=O)(=O)c1ccc(CN(C)C)cc1)[C@H](C)c1ccccc1C(F)(F)F ZINC000433863562 859940939 /nfs/dbraw/zinc/94/09/39/859940939.db2.gz GEEVMIDZJHKIID-LSDHHAIUSA-N 0 3 414.493 4.238 20 0 HIADHN CC[C@H](CNC(=O)c1ccc(-c2nc(C3CC3)no2)cc1)N1CCc2ccccc2C1 ZINC000433864415 859941105 /nfs/dbraw/zinc/94/11/05/859941105.db2.gz JVAOFTNSOKGYRM-JOCHJYFZSA-N 0 3 416.525 4.181 20 0 HIADHN Cc1c(NC(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)noc1-c1ccccc1F ZINC000433923571 859973733 /nfs/dbraw/zinc/97/37/33/859973733.db2.gz YSEYWUMZHZCCBE-LJQANCHMSA-N 0 3 422.504 4.917 20 0 HIADHN CC(C)n1nc(-c2ccco2)cc1NC(=O)N(CCN(C)C)Cc1cccs1 ZINC000433926254 859976225 /nfs/dbraw/zinc/97/62/25/859976225.db2.gz YPDLVKCBYNGZEE-UHFFFAOYSA-N 0 3 401.536 4.381 20 0 HIADHN CC(C)n1nc(-c2ccco2)cc1NC(=O)N(CCN(C)C)Cc1cccc(F)c1 ZINC000433929692 859979296 /nfs/dbraw/zinc/97/92/96/859979296.db2.gz HIKOTZWPEQUNKP-UHFFFAOYSA-N 0 3 413.497 4.459 20 0 HIADHN Cc1nc(COc2ccccc2C(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)cs1 ZINC000467692968 881485201 /nfs/dbraw/zinc/48/52/01/881485201.db2.gz WABIGGWSGUMYNZ-FXAWDEMLSA-N 0 3 421.566 4.423 20 0 HIADHN C[C@H]1CCN(C(=O)Nc2cnn(Cc3ccccc3)c2)CCN1Cc1ccccc1 ZINC000467693933 881487085 /nfs/dbraw/zinc/48/70/85/881487085.db2.gz DIDIJKDLFSMMDT-FQEVSTJZSA-N 0 3 403.530 4.060 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)c2ccc(NC(=O)c3cccs3)cc2)CN1Cc1ccccc1 ZINC000467693417 881487485 /nfs/dbraw/zinc/48/74/85/881487485.db2.gz BCNOGTVKWKBSSJ-LAUBAEHRSA-N 0 3 419.550 4.393 20 0 HIADHN CC1CCC(N2CCN(C(=O)Nc3cccc(-c4noc(C5CC5)n4)c3)CC2)CC1 ZINC000434056922 860069882 /nfs/dbraw/zinc/06/98/82/860069882.db2.gz ARNVEINJWCTZSP-UHFFFAOYSA-N 0 3 409.534 4.342 20 0 HIADHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc(-c2ccco2)nc2onc(C(C)C)c21 ZINC000434064122 860074771 /nfs/dbraw/zinc/07/47/71/860074771.db2.gz WGHWGDQGYFRIML-CVEARBPZSA-N 0 3 408.502 4.305 20 0 HIADHN C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)c1ccccc1-c1ncc(-c2ccccc2F)o1 ZINC000467718819 881516740 /nfs/dbraw/zinc/51/67/40/881516740.db2.gz UAPIDONJHPVGDR-QVKFZJNVSA-N 0 3 405.473 4.360 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)Cc1ccccc1Cl ZINC000434307727 860270196 /nfs/dbraw/zinc/27/01/96/860270196.db2.gz ANBIHBSAKYLNBF-HXUWFJFHSA-N 0 3 408.933 4.473 20 0 HIADHN COc1cc(C(=O)Nc2c(C)cnn2[C@@H]2CCN(Cc3ccccc3)C2)ccc1C ZINC000434312214 860273374 /nfs/dbraw/zinc/27/33/74/860273374.db2.gz JYUGZFBIVHGNNC-OAQYLSRUSA-N 0 3 404.514 4.208 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1cc(F)c(F)c(F)c1 ZINC000434319175 860279554 /nfs/dbraw/zinc/27/95/54/860279554.db2.gz RWDMTDJCJLFEGW-QGZVFWFLSA-N 0 3 414.431 4.308 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1ccnc(OC(C)C)c1 ZINC000434323599 860284446 /nfs/dbraw/zinc/28/44/46/860284446.db2.gz KORHDBPIVVMJKF-OAQYLSRUSA-N 0 3 419.529 4.073 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1cccc(C(C)C)n1 ZINC000434330563 860292025 /nfs/dbraw/zinc/29/20/25/860292025.db2.gz OVXTXFPGBHYQNZ-FQEVSTJZSA-N 0 3 403.530 4.409 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1cccc2cnccc21 ZINC000434331692 860293937 /nfs/dbraw/zinc/29/39/37/860293937.db2.gz CDKSMZWDKOVQGP-NRFANRHFSA-N 0 3 411.509 4.439 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)[C@@H](C)Oc1ccc(C)cc1 ZINC000434334869 860296205 /nfs/dbraw/zinc/29/62/05/860296205.db2.gz SNTWZJJXLWPLGF-IFMALSPDSA-N 0 3 418.541 4.353 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)CCc1cc(F)ccc1F ZINC000434337947 860298863 /nfs/dbraw/zinc/29/88/63/860298863.db2.gz ZSEUDHPDCSCAGV-OAQYLSRUSA-N 0 3 424.495 4.488 20 0 HIADHN Cc1ccc(C(=O)NC[C@@H]2CCCCN2C2CC2)cc1NC(=O)c1ccccc1F ZINC000434426438 860345653 /nfs/dbraw/zinc/34/56/53/860345653.db2.gz VNPJBWNQAOGZJV-IBGZPJMESA-N 0 3 409.505 4.133 20 0 HIADHN CCCNc1ccc(CNC(=O)NC[C@@H](c2ccc(OC)cc2)N2CCCC2)cc1 ZINC000434452509 860356728 /nfs/dbraw/zinc/35/67/28/860356728.db2.gz FMEIEMIXIOOIPP-QHCPKHFHSA-N 0 3 410.562 4.153 20 0 HIADHN CC[C@H](Nc1ccccc1)C(=O)Nc1c(C)cnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000434552730 860397907 /nfs/dbraw/zinc/39/79/07/860397907.db2.gz YLCKBCJWFUTCNC-PKTZIBPZSA-N 0 3 417.557 4.468 20 0 HIADHN COc1cc(C(C)=O)ccc1OC[C@H](O)CN(C)[C@@H](c1ccc(F)cc1)C(C)C ZINC000434611777 860428721 /nfs/dbraw/zinc/42/87/21/860428721.db2.gz KUFIPCPUMFOROZ-NFBKMPQASA-N 0 3 403.494 4.106 20 0 HIADHN O=C1N[C@]2(CCN(Cc3ccccc3)C2)C(=O)N1Cc1ccc(-c2cccs2)cc1 ZINC000434651667 860446340 /nfs/dbraw/zinc/44/63/40/860446340.db2.gz XEGHTMNTSDVYBU-DEOSSOPVSA-N 0 3 417.534 4.112 20 0 HIADHN O=C(c1ccc(F)cc1)C1CCN(C[C@@H](O)Cc2ccc(C(F)(F)F)cc2)CC1 ZINC000434667119 860452801 /nfs/dbraw/zinc/45/28/01/860452801.db2.gz TYJUIOWGGDHNGO-FQEVSTJZSA-N 0 3 409.423 4.343 20 0 HIADHN Clc1cc(CCN2CCC(c3ncc4n3CCCC4)CC2)cc2c1OCCCO2 ZINC000434673658 860453974 /nfs/dbraw/zinc/45/39/74/860453974.db2.gz FAVOFZGEHAVNCH-UHFFFAOYSA-N 0 3 415.965 4.456 20 0 HIADHN C[C@H](C(=O)N1c2ccccc2CC[C@H]1C)N1CCC(c2ncc3n2CCCC3)CC1 ZINC000434686910 860460408 /nfs/dbraw/zinc/46/04/08/860460408.db2.gz BKJGUVYQYSOQAB-RTBURBONSA-N 0 3 406.574 4.155 20 0 HIADHN CC(C)(C)c1ccc(CCNC(=O)CN2CCC(c3ncc4n3CCCC4)CC2)cc1 ZINC000434687580 860461633 /nfs/dbraw/zinc/46/16/33/860461633.db2.gz FCBZSIYEZLJIIA-UHFFFAOYSA-N 0 3 422.617 4.055 20 0 HIADHN C[C@@H](C(=O)N1CCC[C@@H]1c1cccs1)N1CCC(c2ncc3n2CCCC3)CC1 ZINC000434688998 860461863 /nfs/dbraw/zinc/46/18/63/860461863.db2.gz RUNZOBWRYFAXQN-FXAWDEMLSA-N 0 3 412.603 4.213 20 0 HIADHN CCN(C(=O)NC[C@@H]1CCCN(c2ccccc2)C1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000434868551 860528903 /nfs/dbraw/zinc/52/89/03/860528903.db2.gz LWHWUSRXOOWDSA-UKILVPOCSA-N 0 3 420.601 4.209 20 0 HIADHN O[C@H](COCc1ccccc1F)CN1CCC[C@@H](c2nc(C(F)(F)F)cs2)C1 ZINC000434885624 860535470 /nfs/dbraw/zinc/53/54/70/860535470.db2.gz IWRYTLLZAOBKOR-HIFRSBDPSA-N 0 3 418.456 4.058 20 0 HIADHN COc1cc(-c2nnc(CN3CC[C@H](c4ccccc4)[C@@H]3C)o2)cc(OC)c1OC ZINC000434893721 860540192 /nfs/dbraw/zinc/54/01/92/860540192.db2.gz CSGBHOWCVDROEZ-YJBOKZPZSA-N 0 3 409.486 4.140 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)CN2CC[C@H](c3ccccc3)[C@H]2C)cc1OC ZINC000434894733 860541399 /nfs/dbraw/zinc/54/13/99/860541399.db2.gz IJFCTVAMCJBJGO-COPCDDAFSA-N 0 3 408.542 4.245 20 0 HIADHN COc1cc(CN2CCC[C@H](CNC(C)=O)C2)ccc1OCc1ccc(Cl)cc1 ZINC000434982972 860584743 /nfs/dbraw/zinc/58/47/43/860584743.db2.gz OBJWITVOQMEJHS-HXUWFJFHSA-N 0 3 416.949 4.276 20 0 HIADHN C[C@H]1C[C@H](NC(=O)CCc2nnc(-c3ccc(Cl)cc3)o2)CN1Cc1ccccc1 ZINC000467750833 881556364 /nfs/dbraw/zinc/55/63/64/881556364.db2.gz CCWRVLBZKKCXSQ-JXFKEZNVSA-N 0 3 424.932 4.102 20 0 HIADHN CCn1nccc1C1CCN(Cc2ccc(OC)c(OCc3cccnc3)c2)CC1 ZINC000435023071 860603298 /nfs/dbraw/zinc/60/32/98/860603298.db2.gz GHIBVLQGNFFAEN-UHFFFAOYSA-N 0 3 406.530 4.265 20 0 HIADHN CC(C)CN(CCN(C)C)C(=O)c1cc(COc2ccc(Cl)cc2Cl)on1 ZINC000435041771 860612416 /nfs/dbraw/zinc/61/24/16/860612416.db2.gz KHAWXHIRDJABDA-UHFFFAOYSA-N 0 3 414.333 4.220 20 0 HIADHN Brc1cc2c(c(CN3CCC(c4ncc5n4CCCC5)CC3)c1)OCC2 ZINC000435058666 860620855 /nfs/dbraw/zinc/62/08/55/860620855.db2.gz GCDBIUQYECCNJE-UHFFFAOYSA-N 0 3 416.363 4.296 20 0 HIADHN Cc1cccc(-c2cc(Cl)ccc2NC(=O)N[C@H](C)CCN2CCN(C)CC2)c1 ZINC000435175867 860679772 /nfs/dbraw/zinc/67/97/72/860679772.db2.gz DFZSEOWLSKBUMP-GOSISDBHSA-N 0 3 414.981 4.463 20 0 HIADHN COCc1cccc(C(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000435275093 860712313 /nfs/dbraw/zinc/71/23/13/860712313.db2.gz OTDVBLCWBMUVRD-QFIPXVFZSA-N 0 3 404.514 4.037 20 0 HIADHN CCOc1ccc(CC(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000435274340 860712456 /nfs/dbraw/zinc/71/24/56/860712456.db2.gz IIVFQNFPXZMMTK-JOCHJYFZSA-N 0 3 418.541 4.218 20 0 HIADHN Cc1cc(NC(=O)c2cccc3ncccc32)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435274024 860712540 /nfs/dbraw/zinc/71/25/40/860712540.db2.gz FPPUYSIJIYTRCZ-FQEVSTJZSA-N 0 3 411.509 4.439 20 0 HIADHN Cc1cc(NC(=O)c2ccc(C3CC3)cn2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435279475 860714921 /nfs/dbraw/zinc/71/49/21/860714921.db2.gz JRGJMEKFEZYYKG-NRFANRHFSA-N 0 3 401.514 4.163 20 0 HIADHN Cc1cc(NC(=O)COc2ccc(C)cc2C)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435283271 860717819 /nfs/dbraw/zinc/71/78/19/860717819.db2.gz ZEJVXUQWPKCVCC-JOCHJYFZSA-N 0 3 418.541 4.273 20 0 HIADHN Cc1cc(NC(=O)CCO[C@@H](C)CC(C)C)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435286762 860720061 /nfs/dbraw/zinc/72/00/61/860720061.db2.gz DNWBEWKVFBLECT-UNMCSNQZSA-N 0 3 412.578 4.418 20 0 HIADHN Cc1cc(NC(=O)c2ccc3ccccc3n2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435290811 860720985 /nfs/dbraw/zinc/72/09/85/860720985.db2.gz RZVOCXRIYLVLOS-NRFANRHFSA-N 0 3 411.509 4.439 20 0 HIADHN Cc1cc(NC(=O)[C@@H](C)Oc2ccccc2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435298293 860726029 /nfs/dbraw/zinc/72/60/29/860726029.db2.gz XYVWXGAIWVLYKN-CTNGQTDRSA-N 0 3 404.514 4.045 20 0 HIADHN COc1cc(C(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)ccc1C ZINC000435299509 860726675 /nfs/dbraw/zinc/72/66/75/860726675.db2.gz QZFIJJXSOSOBJU-NRFANRHFSA-N 0 3 404.514 4.208 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Cn1cc(-c2ccccc2)c(C)n1)c1cccc(OC)c1 ZINC000435327508 860738958 /nfs/dbraw/zinc/73/89/58/860738958.db2.gz NHFLKXHEUFJAPU-DEOSSOPVSA-N 0 3 420.557 4.066 20 0 HIADHN COc1cc(CCC(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)ccc1Cl ZINC000435342944 860750142 /nfs/dbraw/zinc/75/01/42/860750142.db2.gz KAKYXFXNXCVKNA-QZTJIDSGSA-N 0 3 422.997 4.019 20 0 HIADHN Cc1cccc(OCCCC(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000435369275 860767011 /nfs/dbraw/zinc/76/70/11/860767011.db2.gz DCQVVSKCFLKDNL-JOCHJYFZSA-N 0 3 418.541 4.436 20 0 HIADHN O=C(CCCOCc1ccccc1)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435371382 860769218 /nfs/dbraw/zinc/76/92/18/860769218.db2.gz MORQPVYXSQCDQI-HSZRJFAPSA-N 0 3 418.541 4.266 20 0 HIADHN Cc1ccc(SCC(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000435371690 860769295 /nfs/dbraw/zinc/76/92/95/860769295.db2.gz WPTLLAICLDEXAA-FQEVSTJZSA-N 0 3 406.555 4.369 20 0 HIADHN Cc1nc2ccccc2cc1C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435371870 860769772 /nfs/dbraw/zinc/76/97/72/860769772.db2.gz XTKAALLSKQVNJM-NRFANRHFSA-N 0 3 411.509 4.439 20 0 HIADHN COc1ccc(CCC(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)cc1F ZINC000435374208 860772592 /nfs/dbraw/zinc/77/25/92/860772592.db2.gz WUOIDEQYKAJPOY-FQEVSTJZSA-N 0 3 422.504 4.049 20 0 HIADHN C[C@H](Cc1cccc(F)c1)C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435374660 860772731 /nfs/dbraw/zinc/77/27/31/860772731.db2.gz JLBDLXAFQUCQAT-XMSQKQJNSA-N 0 3 406.505 4.287 20 0 HIADHN C[C@@H](Cc1cccc(F)c1)C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435374657 860773014 /nfs/dbraw/zinc/77/30/14/860773014.db2.gz JLBDLXAFQUCQAT-AVRDEDQJSA-N 0 3 406.505 4.287 20 0 HIADHN C[C@H](OC1CCCCCC1)C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435374952 860773127 /nfs/dbraw/zinc/77/31/27/860773127.db2.gz KGZLPUNGVLQSHX-PZJWPPBQSA-N 0 3 410.562 4.397 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)[C@H]1CSc2ccccc21 ZINC000435374197 860773232 /nfs/dbraw/zinc/77/32/32/860773232.db2.gz HSISIJSUGMRVPT-QUCCMNQESA-N 0 3 404.539 4.158 20 0 HIADHN Cc1cc(Cl)ccc1OCC(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435377054 860774092 /nfs/dbraw/zinc/77/40/92/860774092.db2.gz XOUJEPRLIBUNKG-FQEVSTJZSA-N 0 3 424.932 4.309 20 0 HIADHN O=C(CCCOc1ccccc1)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435378449 860775862 /nfs/dbraw/zinc/77/58/62/860775862.db2.gz ILZZRFUOOGLLHA-OAQYLSRUSA-N 0 3 404.514 4.128 20 0 HIADHN O=C(Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)c1c(F)c(F)cc(F)c1F ZINC000435380142 860776121 /nfs/dbraw/zinc/77/61/21/860776121.db2.gz MNLNCRVKOJGBBH-AWEZNQCLSA-N 0 3 418.394 4.139 20 0 HIADHN Cc1[nH]c2ccccc2c1CC(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435381011 860776718 /nfs/dbraw/zinc/77/67/18/860776718.db2.gz UMIRMXKEHDVBKU-HXUWFJFHSA-N 0 3 413.525 4.301 20 0 HIADHN Cc1cc(NC(=O)N2CCC[C@@H]2C2CCC2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435517149 860834906 /nfs/dbraw/zinc/83/49/06/860834906.db2.gz OVNBBZUOWDAMPN-FGZHOGPDSA-N 0 3 407.562 4.435 20 0 HIADHN CC(C)[C@H](CNC(=O)N(CCN(C)C)Cc1cccc(Cl)c1)c1cccnc1 ZINC000435537605 860852568 /nfs/dbraw/zinc/85/25/68/860852568.db2.gz QIWSKCUHEDOHEQ-NRFANRHFSA-N 0 3 402.970 4.248 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CCC(c2cnc[nH]2)CC1)c1ccccc1Cl ZINC000435580795 860896319 /nfs/dbraw/zinc/89/63/19/860896319.db2.gz SGQBNWUGGGPPNP-FQEVSTJZSA-N 0 3 403.958 4.035 20 0 HIADHN C[C@@H]1[C@H](C(=O)NC2CCN(CCOc3ccc(Cl)cc3)CC2)[C@H]1c1ccccc1 ZINC000435706499 860989240 /nfs/dbraw/zinc/98/92/40/860989240.db2.gz ONKFLMQKTFYPED-IMRHEYAYSA-N 0 3 412.961 4.349 20 0 HIADHN CN(c1ccccc1)c1ccc(CN[C@H]2CCN(C(=O)CCc3ccccc3)C2)cn1 ZINC000435779076 861052762 /nfs/dbraw/zinc/05/27/62/861052762.db2.gz PHFFFRUWIKPHEA-QHCPKHFHSA-N 0 3 414.553 4.173 20 0 HIADHN Cc1ccc(NC(=O)[C@@H](N[C@H]2CC[C@@H](C(=O)N3CCCC3)C2)c2ccccc2)cc1 ZINC000435792332 861064298 /nfs/dbraw/zinc/06/42/98/861064298.db2.gz UXUSASRBGNMMQG-PUHATCMVSA-N 0 3 405.542 4.056 20 0 HIADHN Cc1ccc([C@H](NCCCc2ccccc2Br)[C@H](C)S(C)(=O)=O)cc1 ZINC000435895199 861151450 /nfs/dbraw/zinc/15/14/50/861151450.db2.gz XMUCYQKLXLCZHE-OXJNMPFZSA-N 0 3 424.404 4.454 20 0 HIADHN Cc1cc(NC(=O)[C@@H]2CCCc3cccnc32)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435911356 861172427 /nfs/dbraw/zinc/17/24/27/861172427.db2.gz LJBUCXZGTHBZFM-FCHUYYIVSA-N 0 3 415.541 4.092 20 0 HIADHN CCC(=O)Nc1ccc(C)c(NC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)c1 ZINC000437803047 863122980 /nfs/dbraw/zinc/12/29/80/863122980.db2.gz TWCBJMNNBBZSHN-IBGZPJMESA-N 0 3 408.546 4.472 20 0 HIADHN C[C@@H]1CCN(C(=O)Nc2ccc(-n3cccn3)c(F)c2)CCN1Cc1ccccc1 ZINC000437811491 863139415 /nfs/dbraw/zinc/13/94/15/863139415.db2.gz RIYMZYKMKBITGO-GOSISDBHSA-N 0 3 407.493 4.140 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N[C@H]1C[C@H](c2ccccc2F)C1 ZINC000437866857 863227983 /nfs/dbraw/zinc/22/79/83/863227983.db2.gz IUTPEYNIWBYMEK-FFXHRGSVSA-N 0 3 413.459 4.176 20 0 HIADHN CSc1ccc(CCNC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cc1 ZINC000437869294 863228883 /nfs/dbraw/zinc/22/88/83/863228883.db2.gz PVVALBVHQKLXMV-UHFFFAOYSA-N 0 3 415.525 4.056 20 0 HIADHN COc1cccc(Oc2ccc(NC(=O)N(CCN(C)C)C[C@@H]3CCCO3)cc2)c1 ZINC000437898368 863268362 /nfs/dbraw/zinc/26/83/62/863268362.db2.gz PRBAORPFZCJWFR-QFIPXVFZSA-N 0 3 413.518 4.062 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)N1CCC(C(F)(F)F)CC1 ZINC000438080536 863475098 /nfs/dbraw/zinc/47/50/98/863475098.db2.gz NWXBNUOYSBODEQ-UHFFFAOYSA-N 0 3 401.498 4.084 20 0 HIADHN COC(=O)c1ccc(COc2ccccc2CN2CCC(c3c[nH]cn3)CC2)cc1 ZINC000438112468 863526500 /nfs/dbraw/zinc/52/65/00/863526500.db2.gz ASDFDIILQXINCC-UHFFFAOYSA-N 0 3 405.498 4.155 20 0 HIADHN Cc1csc(Sc2ccc(NC(=O)N3CC[C@H](N4CC=CC4)C3)c(C)c2)n1 ZINC000438142861 863562585 /nfs/dbraw/zinc/56/25/85/863562585.db2.gz TYKJDRBZKOCADN-INIZCTEOSA-N 0 3 400.573 4.389 20 0 HIADHN CN(C)CCN(C[C@H]1CCCO1)C(=O)Nc1ccc(Oc2ccc(Cl)cc2)nc1 ZINC000438232206 863670989 /nfs/dbraw/zinc/67/09/89/863670989.db2.gz PIRIIFJHCAOYPG-LJQANCHMSA-N 0 3 418.925 4.102 20 0 HIADHN CN(C)CCN(C[C@H]1CCCO1)C(=O)Nc1cccc(CSC2CCCC2)c1 ZINC000438261349 863728043 /nfs/dbraw/zinc/72/80/43/863728043.db2.gz PQPQBFVRIFFYIW-HXUWFJFHSA-N 0 3 405.608 4.437 20 0 HIADHN C[C@H](N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)c1cccc(Br)c1 ZINC000467847100 881694349 /nfs/dbraw/zinc/69/43/49/881694349.db2.gz UXCAPAWUUPJGAJ-JXFKEZNVSA-N 0 3 401.348 4.333 20 0 HIADHN CC(C)N(C)c1ccccc1CNCc1cn(C)nc1-c1ccc2c(c1)OCCCO2 ZINC000438321768 863801337 /nfs/dbraw/zinc/80/13/37/863801337.db2.gz BLWCHNWCWXIDSO-UHFFFAOYSA-N 0 3 420.557 4.383 20 0 HIADHN Cc1cc(C)c2nc(C3CC3)cc(C(=O)N(CCN(C)C)Cc3ccccn3)c2c1 ZINC000438349217 863817697 /nfs/dbraw/zinc/81/76/97/863817697.db2.gz NHBYVTKLXHCREP-UHFFFAOYSA-N 0 3 402.542 4.328 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Nc1ccc2c(c1)OC1(CCCC1)O2 ZINC000438375324 863835286 /nfs/dbraw/zinc/83/52/86/863835286.db2.gz QMUJFMGSQODKSB-UHFFFAOYSA-N 0 3 401.532 4.385 20 0 HIADHN CN(C(=O)Nc1ccc(CC(F)(F)F)cc1)C1CCN(CCc2ccccn2)CC1 ZINC000438380596 863837680 /nfs/dbraw/zinc/83/76/80/863837680.db2.gz SBHUHAOWMAMKDJ-UHFFFAOYSA-N 0 3 420.479 4.357 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)N[C@@H]2C[C@H]2c2cc(F)c(F)c(F)c2)CC1 ZINC000438385823 863839883 /nfs/dbraw/zinc/83/98/83/863839883.db2.gz FGMRNICWAICNDP-GHTZIAJQSA-N 0 3 417.475 4.266 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)c1cccc(C(=O)N(C)CC(C)(C)C)c1 ZINC000438461619 863884409 /nfs/dbraw/zinc/88/44/09/863884409.db2.gz QCUXCZWIKMDYMD-UHFFFAOYSA-N 0 3 415.603 4.070 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)CCCc1ccc(Br)s1 ZINC000438462646 863885438 /nfs/dbraw/zinc/88/54/38/863885438.db2.gz JHSCHTTZLIVCLA-UHFFFAOYSA-N 0 3 415.422 4.485 20 0 HIADHN COC(=O)C(C)(C)c1ccc(NC(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)cc1 ZINC000438471915 863890514 /nfs/dbraw/zinc/89/05/14/863890514.db2.gz MYTIGDHUZDDIRC-JOCHJYFZSA-N 0 3 423.557 4.404 20 0 HIADHN CC(C)c1cnc(-c2ccc(NC(=O)N(CCN(C)C)C[C@@H]3CCCO3)cc2)o1 ZINC000438498183 863918470 /nfs/dbraw/zinc/91/84/70/863918470.db2.gz XWSPNJFIFXOAGB-IBGZPJMESA-N 0 3 400.523 4.040 20 0 HIADHN CN(C(=O)Nc1cccc(CC(F)(F)F)c1)C1CCN(CCc2ccccn2)CC1 ZINC000438556290 863987608 /nfs/dbraw/zinc/98/76/08/863987608.db2.gz YRNMJLHABXCHLO-UHFFFAOYSA-N 0 3 420.479 4.357 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)Cc2coc(-c3ccc(F)cc3)n2)CC1 ZINC000438558767 863991311 /nfs/dbraw/zinc/99/13/11/863991311.db2.gz SXUKXSMHYWPTCT-UHFFFAOYSA-N 0 3 407.489 4.146 20 0 HIADHN CCCOc1cccc(NC(=O)C(=O)N(CC)[C@@H]2CCN([C@@H](C)c3ccccc3)C2)c1 ZINC000438646947 864086383 /nfs/dbraw/zinc/08/63/83/864086383.db2.gz FWRXBJAYEXUXTF-SIKLNZKXSA-N 0 3 423.557 4.098 20 0 HIADHN O[C@H](CO[C@H]1CCCc2ccccc21)CN1CC=C(c2c[nH]c3ncccc23)CC1 ZINC000438650383 864090780 /nfs/dbraw/zinc/09/07/80/864090780.db2.gz POEWPESXFYQYCQ-RDPSFJRHSA-N 0 3 403.526 4.107 20 0 HIADHN CCN(C(=O)C(=O)Nc1cc2[nH]ccc2cc1C)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000438666637 864120474 /nfs/dbraw/zinc/12/04/74/864120474.db2.gz VIFULAGCGPKDHH-GHTZIAJQSA-N 0 3 418.541 4.099 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Nc1ccccc1OC[C@@H]1CCCCO1 ZINC000438683588 864148517 /nfs/dbraw/zinc/14/85/17/864148517.db2.gz VIHNKOOMNAISJA-SFHVURJKSA-N 0 3 417.575 4.292 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)C(=O)Nc1cccc(-c2cccs2)c1 ZINC000438730919 864215101 /nfs/dbraw/zinc/21/51/01/864215101.db2.gz FFCYNRAGQSRQIP-UHFFFAOYSA-N 0 3 413.568 4.006 20 0 HIADHN COc1cc(CN(C)C[C@@H](O)CO[C@@H](c2ccccc2)c2ccc(C)cc2)ccc1O ZINC000438792048 864284157 /nfs/dbraw/zinc/28/41/57/864284157.db2.gz OFXAKWZVQUAJDK-BVAGGSTKSA-N 0 3 421.537 4.308 20 0 HIADHN Cc1ccsc1[C@H]1C[C@@H]1C(=O)NC1CCN(CCOc2ccc(Cl)cc2)CC1 ZINC000438841796 864335308 /nfs/dbraw/zinc/33/53/08/864335308.db2.gz MNVBCFCYCGFQHX-PMACEKPBSA-N 0 3 418.990 4.473 20 0 HIADHN CCSCc1cccc(NC(=O)NCc2ccccc2CN2CCC(O)CC2)c1 ZINC000438873670 864365703 /nfs/dbraw/zinc/36/57/03/864365703.db2.gz ALHORZLQQGZAMV-UHFFFAOYSA-N 0 3 413.587 4.218 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Nc1ccc(OCC2CCOCC2)cc1 ZINC000438879073 864367687 /nfs/dbraw/zinc/36/76/87/864367687.db2.gz DAZPAMZOPVGVDX-UHFFFAOYSA-N 0 3 417.575 4.149 20 0 HIADHN CCOC(=O)CCc1ccc(NC(=O)N(Cc2ccccc2)C2CCN(C)CC2)cc1 ZINC000438887358 864371180 /nfs/dbraw/zinc/37/11/80/864371180.db2.gz PNEWHVDLASXCGL-UHFFFAOYSA-N 0 3 423.557 4.311 20 0 HIADHN COc1cc(NC(C)=O)ccc1[C@@H](C)N[C@H]1CCN(c2ccccc2OC(F)F)C1 ZINC000438987659 864448781 /nfs/dbraw/zinc/44/87/81/864448781.db2.gz PTPRDGPVBPKIIW-PBHICJAKSA-N 0 3 419.472 4.185 20 0 HIADHN Cc1ccc(C(=O)NC2CCN(CCc3cccc(OC(F)(F)F)c3)CC2)s1 ZINC000439137617 864569027 /nfs/dbraw/zinc/56/90/27/864569027.db2.gz ITSIBCUOVLRMSH-UHFFFAOYSA-N 0 3 412.477 4.392 20 0 HIADHN COc1cc([C@@H](C)NC(=O)N(CCN(C)C)Cc2cccs2)ccc1OC(C)C ZINC000439178744 864607576 /nfs/dbraw/zinc/60/75/76/864607576.db2.gz MNNVOICELYJKIW-QGZVFWFLSA-N 0 3 419.591 4.378 20 0 HIADHN COc1cc([C@H](C)NC(=O)N(CCN(C)C)Cc2cccs2)ccc1OC(C)C ZINC000439178742 864607954 /nfs/dbraw/zinc/60/79/54/864607954.db2.gz MNNVOICELYJKIW-KRWDZBQOSA-N 0 3 419.591 4.378 20 0 HIADHN CCN(C[C@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)c1cccc(Cl)c1F ZINC000439226787 864643867 /nfs/dbraw/zinc/64/38/67/864643867.db2.gz WPJWTNXJRSMMNY-KRWDZBQOSA-N 0 3 410.942 4.012 20 0 HIADHN CCC[C@@H](CNC(=O)CN(C)[C@H]1CC[C@H](O)CC1)c1ccc(Cl)cc1Cl ZINC000439285526 864706144 /nfs/dbraw/zinc/70/61/44/864706144.db2.gz OPPUUNRICAAEOL-XIRDDKMYSA-N 0 3 401.378 4.229 20 0 HIADHN C[C@H]1C[C@@H](c2ccccc2)CCN1CC(=O)N1CCC(C(=O)Nc2ccccc2)CC1 ZINC000439312520 864745819 /nfs/dbraw/zinc/74/58/19/864745819.db2.gz FLQOPCNXHLBLGV-REWPJTCUSA-N 0 3 419.569 4.132 20 0 HIADHN Cc1ccc([C@H]2OCCC[C@@H]2CNC(=O)N(CCN(C)C)Cc2cccs2)cc1 ZINC000439330229 864767831 /nfs/dbraw/zinc/76/78/31/864767831.db2.gz YFDBDTKVGOIRPF-IFMALSPDSA-N 0 3 415.603 4.298 20 0 HIADHN Cc1ncc(NC(=O)N[C@@H](CN2CCc3ccccc3C2)C(C)(C)C)c(C2CC2)n1 ZINC000439417375 864824835 /nfs/dbraw/zinc/82/48/35/864824835.db2.gz TYIUJASDMGKYIR-NRFANRHFSA-N 0 3 407.562 4.257 20 0 HIADHN Clc1ccc(OC[C@@H]2CCCO2)c(CNCCN2CCc3ccccc3C2)c1 ZINC000439473348 864844658 /nfs/dbraw/zinc/84/46/58/864844658.db2.gz LCAODEOUQFUFLC-QFIPXVFZSA-N 0 3 400.950 4.046 20 0 HIADHN CN(C)[C@@H](CNCc1cc(Cl)ccc1OC[C@@H]1CCCO1)c1cccc(F)c1 ZINC000439480277 864846629 /nfs/dbraw/zinc/84/66/29/864846629.db2.gz UFTCSCALKYOCNB-SFTDATJTSA-N 0 3 406.929 4.429 20 0 HIADHN Cc1noc(C2CCC(N[C@@H](C(=O)NCc3ccccc3)c3ccccc3)CC2)n1 ZINC000439521670 864862293 /nfs/dbraw/zinc/86/22/93/864862293.db2.gz KQXVQZYEIPSCPI-LZBANZJXSA-N 0 3 404.514 4.052 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)Nc1nc(-c2cccc(O)c2)cs1 ZINC000439527614 864864844 /nfs/dbraw/zinc/86/48/44/864864844.db2.gz RXXHVRKJEUOQEM-UHFFFAOYSA-N 0 3 422.554 4.057 20 0 HIADHN COc1ccccc1NC(=O)[C@@H](C)NCc1ccccc1CN(C)Cc1ccco1 ZINC000439595504 864917828 /nfs/dbraw/zinc/91/78/28/864917828.db2.gz KCUUMASURTZPIA-GOSISDBHSA-N 0 3 407.514 4.037 20 0 HIADHN COc1ccc(NC(=O)[C@@H](C)NCC(C)(C)c2c(F)cccc2Cl)cc1OC ZINC000439648284 864973668 /nfs/dbraw/zinc/97/36/68/864973668.db2.gz WPWWKLAAPUWRLL-CYBMUJFWSA-N 0 3 408.901 4.391 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@@H]2CN[C@H](C(N)=O)c2ccc(Br)cc2)cc1 ZINC000439659203 864987597 /nfs/dbraw/zinc/98/75/97/864987597.db2.gz DQTXREHCWDKISW-HOJAQTOUSA-N 0 3 417.347 4.041 20 0 HIADHN CC[C@](C)(O)CN(Cc1ccccc1)C(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000439714935 865052070 /nfs/dbraw/zinc/05/20/70/865052070.db2.gz MIEYHASEDDDGEU-OFNKIYASSA-N 0 3 415.603 4.258 20 0 HIADHN Cc1cc(Cl)ccc1O[C@H](C)C(=O)NC1CCN([C@@H](C)c2ccncc2)CC1 ZINC000439732265 865064730 /nfs/dbraw/zinc/06/47/30/865064730.db2.gz LRACXMSXVMHGSM-DLBZAZTESA-N 0 3 401.938 4.153 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)Cc2csc(-c3ccccc3)n2)CC1 ZINC000439734348 865065942 /nfs/dbraw/zinc/06/59/42/865065942.db2.gz PSEGOZCCNNOWIV-KRWDZBQOSA-N 0 3 406.555 4.089 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)CSCc2ccc(Cl)cc2)CC1 ZINC000439737040 865069556 /nfs/dbraw/zinc/06/95/56/865069556.db2.gz XBYHFIQYEYXLNR-MRXNPFEDSA-N 0 3 403.979 4.310 20 0 HIADHN Cc1ccc(-c2cnc(CCC(=O)NC3CCN([C@H](C)c4ccncc4)CC3)o2)cc1 ZINC000439743039 865076301 /nfs/dbraw/zinc/07/63/01/865076301.db2.gz ILMZEKXFUUDYFE-LJQANCHMSA-N 0 3 418.541 4.319 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)CCc2ccc(-c3ccccc3)[nH]2)CC1 ZINC000439747550 865077870 /nfs/dbraw/zinc/07/78/70/865077870.db2.gz UBOOBXQEYLJMSP-IBGZPJMESA-N 0 3 402.542 4.351 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)c2ccc(Oc3cccnc3)cc2)CC1 ZINC000439763639 865089384 /nfs/dbraw/zinc/08/93/84/865089384.db2.gz DIMJTPAZUFLMPE-GOSISDBHSA-N 0 3 402.498 4.224 20 0 HIADHN Cc1ccc(C(=O)NC2CCN([C@H](C)c3ccncc3)CC2)cc1Br ZINC000439765159 865090635 /nfs/dbraw/zinc/09/06/35/865090635.db2.gz LCJKDBGVQJLXQE-OAHLLOKOSA-N 0 3 402.336 4.108 20 0 HIADHN CCn1ncc(NC(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)c1C(F)(F)F ZINC000439894412 865206855 /nfs/dbraw/zinc/20/68/55/865206855.db2.gz CPPOGADLYHCNJH-HNNXBMFYSA-N 0 3 409.456 4.050 20 0 HIADHN CCn1ncc(NC(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)c1C(F)(F)F ZINC000439896713 865208346 /nfs/dbraw/zinc/20/83/46/865208346.db2.gz GHZOREBAFADVDT-MRXNPFEDSA-N 0 3 409.456 4.050 20 0 HIADHN CCn1ncc(NC(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)c1C(F)(F)F ZINC000439918487 865224725 /nfs/dbraw/zinc/22/47/25/865224725.db2.gz UUALJHDHRFZJNO-QGZVFWFLSA-N 0 3 409.456 4.189 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N[C@H](c2ccc(F)cc2F)C(C)(C)C)CC1 ZINC000468010052 881849503 /nfs/dbraw/zinc/84/95/03/881849503.db2.gz STZQBFJGLZVUSI-HXUWFJFHSA-N 0 3 411.537 4.241 20 0 HIADHN Cc1ccc(-c2ccnn2C)cc1NC(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C ZINC000439947341 865242122 /nfs/dbraw/zinc/24/21/22/865242122.db2.gz DNMZKMZFJSRXOV-XMSQKQJNSA-N 0 3 403.530 4.038 20 0 HIADHN CC[C@@H](CNC(=O)Nc1cc(-c2ccnn2C)ccc1C)N1CCc2ccccc2C1 ZINC000439960253 865252205 /nfs/dbraw/zinc/25/22/05/865252205.db2.gz YIYHFVMUODMJFV-QFIPXVFZSA-N 0 3 417.557 4.354 20 0 HIADHN CC[C@H](C)NC(=O)[C@@H]1C[C@H](C)N(Cc2nc(-c3ccccc3)no2)[C@@H]2CCCC[C@H]12 ZINC000439990244 865300645 /nfs/dbraw/zinc/30/06/45/865300645.db2.gz UCBHDJPPRJSCID-HSROGRKHSA-N 0 3 410.562 4.421 20 0 HIADHN COc1cc([C@H](C)NC(=O)N(CCN(C)C)C(C)C)ccc1OCc1ccccc1 ZINC000440077104 865342382 /nfs/dbraw/zinc/34/23/82/865342382.db2.gz UEOOIIYSUSIVIE-IBGZPJMESA-N 0 3 413.562 4.317 20 0 HIADHN CC(C)N(CCN(C)C)C(=O)N[C@H](C)c1ccc(NC(=O)c2ccc(F)cc2)cc1 ZINC000440086053 865348587 /nfs/dbraw/zinc/34/85/87/865348587.db2.gz DEZZSDDJGBZREZ-QGZVFWFLSA-N 0 3 414.525 4.121 20 0 HIADHN O=C(NCc1cccc(-c2ccccn2)c1)N1CCCN(Cc2ccccc2)CC1 ZINC000440247073 865485959 /nfs/dbraw/zinc/48/59/59/865485959.db2.gz XGKAQKSRUDUCOM-UHFFFAOYSA-N 0 3 400.526 4.166 20 0 HIADHN CC(C)n1cnnc1-c1ccccc1NC(=O)NC[C@@H]1CCCN1Cc1ccccc1 ZINC000440299387 865557373 /nfs/dbraw/zinc/55/73/73/865557373.db2.gz VLBZUVBFZXYGFQ-FQEVSTJZSA-N 0 3 418.545 4.312 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)CN1CCN(C2CCC(C(C)C)CC2)CC1 ZINC000440322219 865593732 /nfs/dbraw/zinc/59/37/32/865593732.db2.gz BUEKVOYMERXIDZ-UHFFFAOYSA-N 0 3 407.986 4.120 20 0 HIADHN CCC(CC)(C(=O)NCCCCN1CCN(c2ccccc2)CC1)c1ccccc1 ZINC000440387395 865680248 /nfs/dbraw/zinc/68/02/48/865680248.db2.gz UMYMKJKGVVWMRN-UHFFFAOYSA-N 0 3 407.602 4.463 20 0 HIADHN Cc1ccc(C(=O)C(=O)N(C[C@@H]2CCN(Cc3ccccc3)C2)CC(F)(F)F)cc1 ZINC000440419535 865718092 /nfs/dbraw/zinc/71/80/92/865718092.db2.gz JQKQRDGLYOWYAT-LJQANCHMSA-N 0 3 418.459 4.091 20 0 HIADHN CC(=O)c1csc(C(=O)N(C[C@H]2CCN(Cc3ccccc3)C2)CC(F)(F)F)c1 ZINC000440446663 865748726 /nfs/dbraw/zinc/74/87/26/865748726.db2.gz BQRFBUQYDWINMU-KRWDZBQOSA-N 0 3 424.488 4.477 20 0 HIADHN OC[C@]1(NCCSc2ccnc3cc(Cl)ccc32)CCOc2ccccc21 ZINC000440484242 865787553 /nfs/dbraw/zinc/78/75/53/865787553.db2.gz ZVDREWCNZUKUMS-OAQYLSRUSA-N 0 3 400.931 4.240 20 0 HIADHN CN(C)[C@@H](CNC(=O)N1CCC[C@@H]1c1nc2ccc(Cl)cc2[nH]1)c1cccs1 ZINC000440499944 865797470 /nfs/dbraw/zinc/79/74/70/865797470.db2.gz ABBDJKABUXDZLW-SJORKVTESA-N 0 3 417.966 4.427 20 0 HIADHN CC1(c2ccc(Br)cc2)CCN(Cc2cc(=O)n3ccccc3n2)CC1 ZINC000440524066 865803734 /nfs/dbraw/zinc/80/37/34/865803734.db2.gz RXSYTPLVNZHZER-UHFFFAOYSA-N 0 3 412.331 4.011 20 0 HIADHN COc1cc(NC2CCN(CCOc3ccc(SC)cc3)CC2)cc(OC)c1 ZINC000440538854 865810246 /nfs/dbraw/zinc/81/02/46/865810246.db2.gz MLDQKXUYLZJYES-UHFFFAOYSA-N 0 3 402.560 4.381 20 0 HIADHN C[C@H](N[C@H]1CC(C)(C)CCc2ccccc21)C(=O)Nc1ccccc1S(C)(=O)=O ZINC000440610515 865837411 /nfs/dbraw/zinc/83/74/11/865837411.db2.gz HFQRBOJWNOXQAH-JXFKEZNVSA-N 0 3 414.571 4.111 20 0 HIADHN Cc1ccccc1-c1nn(-c2ccccc2)cc1C(=O)N[C@@H]1C[C@H](C)N(C2CC2)C1 ZINC000440915815 866011409 /nfs/dbraw/zinc/01/14/09/866011409.db2.gz MDIVNTUXLDBJAI-RBUKOAKNSA-N 0 3 400.526 4.203 20 0 HIADHN Cc1ccc(-c2nnc(-c3ccc(C(=O)N[C@@H]4C[C@@H](C)N(C5CC5)C4)cc3)o2)cc1 ZINC000440917071 866012330 /nfs/dbraw/zinc/01/23/30/866012330.db2.gz ZGIQZTOEVFOFFI-OXQOHEQNSA-N 0 3 402.498 4.067 20 0 HIADHN C[C@H]1C[C@H](NC(=O)CSc2ncnc3scc(-c4ccccc4)c32)CN1C1CC1 ZINC000440922164 866018591 /nfs/dbraw/zinc/01/85/91/866018591.db2.gz NBLKTPQDKHOGGJ-HOCLYGCPSA-N 0 3 424.595 4.192 20 0 HIADHN Cc1ccc(NC(=O)CSc2ccccc2C(=O)N[C@H]2C[C@@H](C)N(C3CC3)C2)cc1 ZINC000440921931 866018716 /nfs/dbraw/zinc/01/87/16/866018716.db2.gz FHFKKOJTZFUOKD-MJGOQNOKSA-N 0 3 423.582 4.081 20 0 HIADHN Cc1cc(-c2cc(C(=O)N[C@@H]3C[C@H](C)N(C4CC4)C3)c3cnn(C(C)C)c3n2)c(C)o1 ZINC000440924701 866020087 /nfs/dbraw/zinc/02/00/87/866020087.db2.gz JLBWTLMIENYGGM-WMLDXEAASA-N 0 3 421.545 4.244 20 0 HIADHN CCc1nc2c(s1)[C@H](N(C)C[C@H](O)CO[C@@H]1CCCc3ccccc31)CCC2 ZINC000441023363 866089194 /nfs/dbraw/zinc/08/91/94/866089194.db2.gz OHBJLDIXKUYSMC-IOMROCGXSA-N 0 3 400.588 4.470 20 0 HIADHN Cc1nn(C)c(C)c1NC(=O)CN1CCc2ccccc2[C@H](c2ccccc2)[C@H]1C ZINC000441055058 866131086 /nfs/dbraw/zinc/13/10/86/866131086.db2.gz AKKCOKYEDWKXKN-KOSHJBKYSA-N 0 3 402.542 4.054 20 0 HIADHN CCOc1cc(CN2C[C@H](c3ccccc3)C(C)(C)C2)nc2nc(C(F)(F)F)nn21 ZINC000441080543 866174553 /nfs/dbraw/zinc/17/45/53/866174553.db2.gz QYKKPOKVBMJFGZ-MRXNPFEDSA-N 0 3 419.451 4.167 20 0 HIADHN CCOc1ccc2c(c1)CCN(CCC(=O)Nc1ccccc1Br)C2 ZINC000441095376 866191573 /nfs/dbraw/zinc/19/15/73/866191573.db2.gz LMLAPEPSQGEHDC-UHFFFAOYSA-N 0 3 403.320 4.235 20 0 HIADHN Cc1ccnc(Oc2ccc(NC(=O)N(CCN(C)C)Cc3cccc(F)c3)cc2)n1 ZINC000441112434 866210536 /nfs/dbraw/zinc/21/05/36/866210536.db2.gz KPXBDJOQWMSVSX-UHFFFAOYSA-N 0 3 423.492 4.312 20 0 HIADHN CO[C@H]1CCCC[C@@H]1NCC(=O)N1N=C(c2cccs2)C[C@@H]1c1cccs1 ZINC000441235720 866311772 /nfs/dbraw/zinc/31/17/72/866311772.db2.gz SPKKDDPYYOHUFP-UAGQMJEPSA-N 0 3 403.573 4.035 20 0 HIADHN CN(C)[C@H](CNC(=O)N1CCC[C@@H]1c1nc2ccc(Cl)cc2[nH]1)c1ccsc1 ZINC000441242697 866317866 /nfs/dbraw/zinc/31/78/66/866317866.db2.gz GCFXKLFIYXCFEY-QZTJIDSGSA-N 0 3 417.966 4.427 20 0 HIADHN CO[C@H]1CCCC[C@@H]1NCC(=O)N1N=C(c2cc3ccccc3o2)C[C@@H]1c1ccco1 ZINC000441258987 866335048 /nfs/dbraw/zinc/33/50/48/866335048.db2.gz KTEHKBDQHFCWAA-DSKINZAPSA-N 0 3 421.497 4.251 20 0 HIADHN Cc1cc(CN(C)C(=O)N[C@@H]2C[C@H](C)N(C3CC3)C2)cc(C)c1OCC(F)(F)F ZINC000441280246 866354844 /nfs/dbraw/zinc/35/48/44/866354844.db2.gz CFJNJFLQWWVLGY-DOTOQJQBSA-N 0 3 413.484 4.011 20 0 HIADHN O=C(CN1CCC[C@H]([C@@H]2CCOC2)C1)N[C@@H](c1ccccc1)c1ccc(Cl)cc1 ZINC000441279598 866355277 /nfs/dbraw/zinc/35/52/77/866355277.db2.gz CISBWSHZKGRRBJ-IMSXRSKXSA-N 0 3 412.961 4.294 20 0 HIADHN O=C(CN1CC[C@H](COCc2ccccc2)C1)N1CCC(Cc2ccccc2)CC1 ZINC000441334079 866405190 /nfs/dbraw/zinc/40/51/90/866405190.db2.gz BXDYVBCIIXLKBO-VWLOTQADSA-N 0 3 406.570 4.006 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)N2CCC(c3nc4cc(Cl)ccc4s3)CC2)CN1C1CC1 ZINC000441346529 866417225 /nfs/dbraw/zinc/41/72/25/866417225.db2.gz APPHRGFJUHEAKG-CZUORRHYSA-N 0 3 418.994 4.464 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)N2CCC(c3nc4cc(Cl)ccc4s3)CC2)CN1C1CC1 ZINC000441346530 866417360 /nfs/dbraw/zinc/41/73/60/866417360.db2.gz APPHRGFJUHEAKG-XJKSGUPXSA-N 0 3 418.994 4.464 20 0 HIADHN COc1ccc(CCN(Cc2ccccc2)C(=O)N[C@@H]2C[C@@H](C)N(C3CC3)C2)cc1 ZINC000441382205 866454231 /nfs/dbraw/zinc/45/42/31/866454231.db2.gz KABOFSRYQKQLJY-DENIHFKCSA-N 0 3 407.558 4.075 20 0 HIADHN C[C@H](NC(=O)CN(C[C@H]1CCCO1)C1CCCC1)c1ccc(Br)cc1 ZINC000441444740 866521501 /nfs/dbraw/zinc/52/15/01/866521501.db2.gz UPJCEPDVJNVBOT-HNAYVOBHSA-N 0 3 409.368 4.050 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)c2cc(F)c(F)cc2Br)CN1Cc1ccccc1 ZINC000441451203 866527130 /nfs/dbraw/zinc/52/71/30/866527130.db2.gz TWJXKNPRTVSMHF-OCCSQVGLSA-N 0 3 409.274 4.120 20 0 HIADHN COc1ccc2c(c1)[C@@H](N(CCC(=O)N1CCC[C@@H]1C)Cc1ccccc1)CCO2 ZINC000441455081 866529812 /nfs/dbraw/zinc/52/98/12/866529812.db2.gz CUWLZOBCFDDUMU-CVDCTZTESA-N 0 3 408.542 4.422 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)CCc3c[nH]c4ccc(C)cc34)c(C)c2)CC1 ZINC000468138916 881991540 /nfs/dbraw/zinc/99/15/40/881991540.db2.gz UEUFDZAVVOTVEU-UHFFFAOYSA-N 0 3 404.558 4.498 20 0 HIADHN COc1ccc([C@@H]2CCN([C@H]3CCCN(c4ccc(OC(F)F)cc4)C3=O)C2)cc1 ZINC000441529758 866605753 /nfs/dbraw/zinc/60/57/53/866605753.db2.gz AYWZBUZSFLNYSI-UTKZUKDTSA-N 0 3 416.468 4.282 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N(C)[C@@H](C)c3nc4ccccc4s3)cc2)CC1 ZINC000468141151 881997114 /nfs/dbraw/zinc/99/71/14/881997114.db2.gz ZOQNNZDMPLUOJF-KRWDZBQOSA-N 0 3 408.571 4.271 20 0 HIADHN COc1ccc(NC(=O)[C@H](c2ccccc2)N2CC[C@H]([C@@H]3CCOC3)C2)cc1Cl ZINC000441643205 866751272 /nfs/dbraw/zinc/75/12/72/866751272.db2.gz BGFSMAWKVGASHV-SVMVAKDDSA-N 0 3 414.933 4.387 20 0 HIADHN Cc1nc(C(C)C)sc1[C@H](C)N(C)C(=O)C(=O)Nc1cc(CN(C)C)ccc1C ZINC000441771285 866846119 /nfs/dbraw/zinc/84/61/19/866846119.db2.gz VYHYTDKLITZWBQ-INIZCTEOSA-N 0 3 416.591 4.103 20 0 HIADHN CN1CCN(CCNC(=O)Nc2ccc(Cl)cc2-c2ccccc2)CC1(C)C ZINC000441791781 866861407 /nfs/dbraw/zinc/86/14/07/866861407.db2.gz DGKXOVHVIGDMPR-UHFFFAOYSA-N 0 3 400.954 4.155 20 0 HIADHN Cc1nn(C(C)(C)C)cc1[C@H](C)NC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000468159181 882024605 /nfs/dbraw/zinc/02/46/05/882024605.db2.gz KZLSXIVZTARLAN-GHTZIAJQSA-N 0 3 411.594 4.314 20 0 HIADHN CC[C@H]1CCc2nc(NC(=O)N(C)C[C@@H]3CCN(C)[C@H]3c3cccnc3)sc2C1 ZINC000441935497 867001813 /nfs/dbraw/zinc/00/18/13/867001813.db2.gz OOAXBQPPDGPVQY-KNBMTAEXSA-N 0 3 413.591 4.210 20 0 HIADHN Cc1nn(C(C)(C)C)cc1[C@@H](C)NC(=O)N(CCN(C)C)Cc1ccc(F)cc1F ZINC000468166242 882042900 /nfs/dbraw/zinc/04/29/00/882042900.db2.gz ATNFMRNFWOVWPP-OAHLLOKOSA-N 0 3 421.536 4.059 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)N[C@H]3CCCc4sc(-c5ccc(F)cc5)nc43)[C@H]2C1 ZINC000468166643 882042361 /nfs/dbraw/zinc/04/23/61/882042361.db2.gz ZLLLHAVODGXPEK-JLSDUUJJSA-N 0 3 414.550 4.062 20 0 HIADHN Cc1nc(-c2ccc(C(=O)N3CCC(CN4C[C@@H](C)O[C@@H](C)C4)CC3)cc2)cs1 ZINC000442019426 867069999 /nfs/dbraw/zinc/06/99/99/867069999.db2.gz OVMWRDVENMJKDJ-CALCHBBNSA-N 0 3 413.587 4.080 20 0 HIADHN Cc1nn(C(C)(C)C)cc1[C@H](C)NC(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000468169319 882045365 /nfs/dbraw/zinc/04/53/65/882045365.db2.gz OYEBZGNNEVQBCZ-SFHVURJKSA-N 0 3 411.594 4.314 20 0 HIADHN C[C@@H](Sc1ccccc1)c1ccc(NC(=O)C(=O)N[C@@H](C)C2=CCN(C)CC2)cc1 ZINC000442332676 867331488 /nfs/dbraw/zinc/33/14/88/867331488.db2.gz BEHPTNGWDZTVEG-ZWKOTPCHSA-N 0 3 423.582 4.245 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N(C)Cc3ccc(Cl)c(Cl)c3)cc2)CC1 ZINC000468200486 882079488 /nfs/dbraw/zinc/07/94/88/882079488.db2.gz HGSHSYIBBZUPIJ-UHFFFAOYSA-N 0 3 406.357 4.408 20 0 HIADHN Cc1cc(NC(=O)NCc2ccccc2CN2CCC(O)CC2)cc(C)c1Cl ZINC000442430375 867400467 /nfs/dbraw/zinc/40/04/67/867400467.db2.gz AMGYPGCRALQJDF-UHFFFAOYSA-N 0 3 401.938 4.235 20 0 HIADHN Fc1cccc(CN2CCC[C@H](c3nc(-c4ccc(OCC(F)F)cn4)no3)C2)c1 ZINC000442688807 867622508 /nfs/dbraw/zinc/62/25/08/867622508.db2.gz MMQBLMHIODCJRW-HNNXBMFYSA-N 0 3 418.419 4.294 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3ncccc3Oc3ccccc3)CC2)C[C@@H](C)O1 ZINC000442692250 867626241 /nfs/dbraw/zinc/62/62/41/867626241.db2.gz NMRCWROHIMKGPR-WOJBJXKFSA-N 0 3 423.557 4.225 20 0 HIADHN O=C1[C@H](NCc2ccc(Br)c3cccnc23)CCCN1C1CCCCC1 ZINC000443006369 867789290 /nfs/dbraw/zinc/78/92/90/867789290.db2.gz XFMQFYNFRDJBAK-LJQANCHMSA-N 0 3 416.363 4.411 20 0 HIADHN CCOc1cc(CN2CC[C@H](OC)C[C@H]2C)ccc1OCC(=O)N(C(C)C)C(C)C ZINC000443077122 867813352 /nfs/dbraw/zinc/81/33/52/867813352.db2.gz ZIEDAKVYPMIJBT-CTNGQTDRSA-N 0 3 420.594 4.109 20 0 HIADHN O=C(C/C=C/c1ccc(F)cc1)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000443335966 867910421 /nfs/dbraw/zinc/91/04/21/867910421.db2.gz QKLHSEOFIDJNFW-OWOJBTEDSA-N 0 3 400.469 4.028 20 0 HIADHN O=C(CCc1cc(Cl)cs1)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000443334770 867910570 /nfs/dbraw/zinc/91/05/70/867910570.db2.gz NCCLZRMCSCLNJS-UHFFFAOYSA-N 0 3 410.942 4.133 20 0 HIADHN CC[C@@H](Sc1ccccc1)C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000443343244 867914209 /nfs/dbraw/zinc/91/42/09/867914209.db2.gz IKVRKEQQWQJYCD-JOCHJYFZSA-N 0 3 416.562 4.356 20 0 HIADHN COc1ccc2c(c1)CCC[C@@H]2CNC(=O)N(Cc1ccco1)C1CCN(C)CC1 ZINC000468239207 882135646 /nfs/dbraw/zinc/13/56/46/882135646.db2.gz CWEQYVUREAFMGQ-LJQANCHMSA-N 0 3 411.546 4.014 20 0 HIADHN CO[C@@H](C)c1noc(CN2CCCN([C@@H](C)c3ccc(C(F)(F)F)cc3)CC2)n1 ZINC000468239356 882136014 /nfs/dbraw/zinc/13/60/14/882136014.db2.gz FOIAFAHREHPNJK-GJZGRUSLSA-N 0 3 412.456 4.065 20 0 HIADHN O[C@@H](Cc1ccccc1C(F)(F)F)CN1CCC[C@@H]1c1cccc2c1OCCO2 ZINC000443624478 868195111 /nfs/dbraw/zinc/19/51/11/868195111.db2.gz FBZRSORYJUMJRV-QFBILLFUSA-N 0 3 407.432 4.217 20 0 HIADHN O[C@H](COc1ccc(Cl)cc1)CN1CCC[C@H](c2nc3ccc(F)cc3o2)C1 ZINC000443636670 868218109 /nfs/dbraw/zinc/21/81/09/868218109.db2.gz FWORKTWVQJQAQZ-YOEHRIQHSA-N 0 3 404.869 4.240 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)C2(c3cccc(C(F)(F)F)c3)CCC2)C[C@H](C)O1 ZINC000443676593 868283169 /nfs/dbraw/zinc/28/31/69/868283169.db2.gz UWWIMFLIRLUDMJ-CALCHBBNSA-N 0 3 412.496 4.133 20 0 HIADHN C[C@@H](NC(=O)N(CCN(C)C)Cc1cccs1)c1ccc(Br)s1 ZINC000443724764 868307533 /nfs/dbraw/zinc/30/75/33/868307533.db2.gz MHJFSHIKBARTAR-GFCCVEGCSA-N 0 3 416.410 4.407 20 0 HIADHN Cc1ccccc1[C@H]([C@@H](C)NC(=O)C(=O)Nc1ccc(OC2CCCC2)cc1)N(C)C ZINC000443845070 868376022 /nfs/dbraw/zinc/37/60/22/868376022.db2.gz SVBGIPGTWPLMBA-JPYJTQIMSA-N 0 3 423.557 4.063 20 0 HIADHN Cn1c2ccc(F)cc2nc1NC(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000443974509 868503630 /nfs/dbraw/zinc/50/36/30/868503630.db2.gz VBOBURNSNCTWJD-FQEVSTJZSA-N 0 3 420.410 4.106 20 0 HIADHN CCCOc1ccc(CNC2(c3ccc(OC)c(F)c3)CCOCC2)cc1OC ZINC000444019815 868544260 /nfs/dbraw/zinc/54/42/60/868544260.db2.gz YMDKBAGABKGVTC-UHFFFAOYSA-N 0 3 403.494 4.427 20 0 HIADHN CCOc1ccc([C@@H]2CCCN2C(=O)CN(C[C@H]2CCCO2)C2CCCC2)cc1 ZINC000444209780 868668684 /nfs/dbraw/zinc/66/86/84/868668684.db2.gz DOBGAAQNCPIGMO-PKTZIBPZSA-N 0 3 400.563 4.172 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)c1ccc(OCc2ccccc2)cc1 ZINC000444453398 868833773 /nfs/dbraw/zinc/83/37/73/868833773.db2.gz HRSGHBYCDSDXIG-UHFFFAOYSA-N 0 3 416.521 4.475 20 0 HIADHN Cc1nc(-c2cccs2)ccc1C(=O)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000444454400 868835097 /nfs/dbraw/zinc/83/50/97/868835097.db2.gz NLUXGPOZRVZYSK-UHFFFAOYSA-N 0 3 407.539 4.328 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)c1ncoc1-c1ccccc1Cl ZINC000444463703 868839076 /nfs/dbraw/zinc/83/90/76/868839076.db2.gz XXARYQALHDPOIO-UHFFFAOYSA-N 0 3 411.889 4.204 20 0 HIADHN Cc1nc(-c2ccc(CCNC(=O)N(CCN(C)C)C3CCCC3)s2)cs1 ZINC000468311610 882238052 /nfs/dbraw/zinc/23/80/52/882238052.db2.gz IZQRGAKPHNPMSA-UHFFFAOYSA-N 0 3 406.621 4.238 20 0 HIADHN O[C@H](COc1ccc(Cl)cc1Br)CN1CC[C@@H](CC(F)(F)F)C1 ZINC000444689430 868960217 /nfs/dbraw/zinc/96/02/17/868960217.db2.gz FVBIKBZJBMVYGV-JQWIXIFHSA-N 0 3 416.665 4.117 20 0 HIADHN Cc1nn(C)cc1[C@H](C)NC(=O)N1CCN(Cc2ccccc2)C2(CCCCC2)C1 ZINC000444706547 868966502 /nfs/dbraw/zinc/96/65/02/868966502.db2.gz NILYHSWBBGFTBB-IBGZPJMESA-N 0 3 409.578 4.020 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)NCc1cccc(-c2cccnc2)c1 ZINC000468320543 882250138 /nfs/dbraw/zinc/25/01/38/882250138.db2.gz MORICXAUOWJSOC-UHFFFAOYSA-N 0 3 424.495 4.300 20 0 HIADHN Cc1cccc(N2CCN(Cc3ccc(NC(=O)c4cn[nH]c4C(C)C)cc3)CC2)c1 ZINC000444853835 869056562 /nfs/dbraw/zinc/05/65/62/869056562.db2.gz VQSJKJXTRPQTBL-UHFFFAOYSA-N 0 3 417.557 4.416 20 0 HIADHN CCN1CCC[C@@H](CN(C)C(=O)Nc2cccc(C(C)(F)F)c2)[C@@H]1c1cnn(C)c1 ZINC000444937476 869118268 /nfs/dbraw/zinc/11/82/68/869118268.db2.gz PAVYGEXMMDDKHO-OXJNMPFZSA-N 0 3 419.520 4.469 20 0 HIADHN Cn1ncc(NC(=O)N[C@@H](CN2CCc3ccccc3C2)C(C)(C)C)c1C(F)(F)F ZINC000445031959 869180940 /nfs/dbraw/zinc/18/09/40/869180940.db2.gz LGRUEQZRKMFAPN-KRWDZBQOSA-N 0 3 423.483 4.033 20 0 HIADHN Cc1cccc(C)c1NC(=O)Cc1noc([C@@H]2CCCN(Cc3cccc(F)c3)C2)n1 ZINC000445314445 869368934 /nfs/dbraw/zinc/36/89/34/869368934.db2.gz CSRNSEYIQPUCKJ-LJQANCHMSA-N 0 3 422.504 4.386 20 0 HIADHN COc1ccc([C@@H](CNC(=O)NCc2cccc(CSC)c2)N2CCCC2)cc1 ZINC000445557152 869612423 /nfs/dbraw/zinc/61/24/23/869612423.db2.gz KRPRBGAUFRXXEX-JOCHJYFZSA-N 0 3 413.587 4.195 20 0 HIADHN FC(F)(F)[C@@]1(c2nc(-c3ccc4cc[nH]c4n3)no2)CCN(Cc2ccccc2)C1 ZINC000445580677 869640176 /nfs/dbraw/zinc/64/01/76/869640176.db2.gz TVDQEIBZHKGHLT-FQEVSTJZSA-N 0 3 413.403 4.319 20 0 HIADHN COc1cc(C)c(C(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)cc1OC ZINC000445643857 869714195 /nfs/dbraw/zinc/71/41/95/869714195.db2.gz CXXGRLYJXOBXAZ-GOSISDBHSA-N 0 3 402.560 4.277 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3sc(C)nc3CC(C)C)c(C)c2)CC1 ZINC000445646372 869717307 /nfs/dbraw/zinc/71/73/07/869717307.db2.gz FQSDHEYNHBQFCG-UHFFFAOYSA-N 0 3 400.592 4.353 20 0 HIADHN NC(=O)[C@H]1CCCC[C@@H]1NCC(=O)Nc1ccccc1Sc1ccc(Cl)cc1 ZINC000445788033 869824753 /nfs/dbraw/zinc/82/47/53/869824753.db2.gz WSUOKXNIRQYMKV-IRXDYDNUSA-N 0 3 417.962 4.063 20 0 HIADHN COc1cccc(NC(=O)CCN(C)[C@H]2CCOc3ccc(Br)cc32)c1 ZINC000445877990 869868776 /nfs/dbraw/zinc/86/87/76/869868776.db2.gz DPVYKRWGOJEMIG-SFHVURJKSA-N 0 3 419.319 4.242 20 0 HIADHN CC(C)[C@H](CC(F)(F)F)NCC(=O)N1CCC[C@H]1c1ccc2c(c1)OCCCO2 ZINC000445878692 869869574 /nfs/dbraw/zinc/86/95/74/869869574.db2.gz VMCUXXXDQLYQAO-IRXDYDNUSA-N 0 3 414.468 4.078 20 0 HIADHN COc1cc(-c2noc(CN[C@H]3CCC[C@@H]3c3ccccc3)n2)cc(OC)c1OC ZINC000445993714 869956041 /nfs/dbraw/zinc/95/60/41/869956041.db2.gz TYFNEMDZXLOECX-MSOLQXFVSA-N 0 3 409.486 4.188 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)C2(c3c(Cl)cccc3Cl)CCC2)C[C@H](C)O1 ZINC000446245799 870188883 /nfs/dbraw/zinc/18/88/83/870188883.db2.gz SSSRBRLVTFVMHH-IYBDPMFKSA-N 0 3 413.389 4.421 20 0 HIADHN C[C@@H]1C[C@H](N(C)C(=O)CCC(=O)c2ccc(F)c(F)c2)CCN1Cc1ccccc1 ZINC000446271146 870207681 /nfs/dbraw/zinc/20/76/81/870207681.db2.gz WPMYWMVRUJHKLS-YLJYHZDGSA-N 0 3 414.496 4.439 20 0 HIADHN CC(C)Oc1cc(Br)ccc1C(=O)N(CCN(C)C)Cc1ccco1 ZINC000446442990 870363584 /nfs/dbraw/zinc/36/35/84/870363584.db2.gz YUUPQCVQCCMHRB-UHFFFAOYSA-N 0 3 409.324 4.033 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N[C@H](C)c3cccc(N4CCCC4)c3)cc2)CC1 ZINC000446488070 870400561 /nfs/dbraw/zinc/40/05/61/870400561.db2.gz IRVUSCPDFZDVRU-OAQYLSRUSA-N 0 3 420.601 4.308 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3cccc(-c4noc(C5CC5)n4)c3)cc2)CC1 ZINC000446679242 870590576 /nfs/dbraw/zinc/59/05/76/870590576.db2.gz XMVPQKUUFCHXDW-UHFFFAOYSA-N 0 3 417.513 4.008 20 0 HIADHN CN(C)Cc1cccc(NC(=O)C(=O)Nc2cccc(OCc3ccc(F)cc3)c2)c1 ZINC000446789868 870707466 /nfs/dbraw/zinc/70/74/66/870707466.db2.gz KFSMVXSJRMJFHN-UHFFFAOYSA-N 0 3 421.472 4.044 20 0 HIADHN COc1cc(CN2CCC(CO)(Cc3ccccc3)CC2)ccc1OCC(F)(F)F ZINC000446832121 870747551 /nfs/dbraw/zinc/74/75/51/870747551.db2.gz MHJYYAUUPYKGEL-UHFFFAOYSA-N 0 3 423.475 4.454 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1ccccc1CN1CCc2ccccc21 ZINC000446835338 870753250 /nfs/dbraw/zinc/75/32/50/870753250.db2.gz NVERILKGKSGITK-UHFFFAOYSA-N 0 3 418.541 4.438 20 0 HIADHN CCN1CCN(CCCNC(=O)c2ccc(Oc3ccc(Cl)cc3)c(F)c2)CC1 ZINC000468478134 882439677 /nfs/dbraw/zinc/43/96/77/882439677.db2.gz GIMPEWFGSWBLNW-UHFFFAOYSA-N 0 3 419.928 4.029 20 0 HIADHN COc1cc(CNC2(c3cccc(OC(F)(F)F)c3)CCOCC2)cc(OC)c1 ZINC000446836542 870754810 /nfs/dbraw/zinc/75/48/10/870754810.db2.gz VBUWRQPWZXPBDE-UHFFFAOYSA-N 0 3 411.420 4.398 20 0 HIADHN Cc1ccc(-n2ncc(C(=O)NC[C@@H]3N(C)CCCC3(C)C)c2C(F)(F)F)cc1 ZINC000468480642 882446611 /nfs/dbraw/zinc/44/66/11/882446611.db2.gz UQCKIDHWSCEECV-KRWDZBQOSA-N 0 3 408.468 4.050 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1ncc(Cc2ccc(F)c(F)c2)s1 ZINC000446938641 870848071 /nfs/dbraw/zinc/84/80/71/870848071.db2.gz JMIIKTJBLMCYMC-UHFFFAOYSA-N 0 3 420.485 4.201 20 0 HIADHN COc1ccc([C@@H](CCn2cncn2)NCc2ccc(F)cc2CSC)cc1 ZINC000446939392 870849791 /nfs/dbraw/zinc/84/97/91/870849791.db2.gz NOCBXRJRVLZQQR-OAQYLSRUSA-N 0 3 400.523 4.210 20 0 HIADHN Cc1cc(CN2CCC[C@@H]([C@H](O)C(F)(F)F)C2)cc(C)c1OCc1ccccn1 ZINC000446974530 870871920 /nfs/dbraw/zinc/87/19/20/870871920.db2.gz JFWCDEQVCARULT-NQIIRXRSSA-N 0 3 408.464 4.413 20 0 HIADHN Cc1ccc(NC(=O)N(CCN(C)C)Cc2ccco2)cc1NC(=O)C(C)(C)C ZINC000447064827 870944834 /nfs/dbraw/zinc/94/48/34/870944834.db2.gz BESDVNORUGXPMJ-UHFFFAOYSA-N 0 3 400.523 4.168 20 0 HIADHN COc1cc(OC)c(NC(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)cc1F ZINC000447133070 871034167 /nfs/dbraw/zinc/03/41/67/871034167.db2.gz NESXYZPSZVZTGX-LJQANCHMSA-N 0 3 401.482 4.110 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)Nc2ccc(Cl)c(Br)c2)CC1 ZINC000447144761 871045107 /nfs/dbraw/zinc/04/51/07/871045107.db2.gz PFXKAJCPTDYALJ-UHFFFAOYSA-N 0 3 418.763 4.113 20 0 HIADHN Cc1ccc(NC(=O)CCN[C@H](Cn2cnc3ccccc32)c2ccc(F)cc2)nc1 ZINC000447304590 871202213 /nfs/dbraw/zinc/20/22/13/871202213.db2.gz JEOJAOISMKUPBX-OAQYLSRUSA-N 0 3 417.488 4.239 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)c2c(F)ccc(Br)c2F)CC1 ZINC000447311287 871205294 /nfs/dbraw/zinc/20/52/94/871205294.db2.gz AOPUQOUCGXBVSM-UHFFFAOYSA-N 0 3 413.262 4.057 20 0 HIADHN CC(=O)Nc1cccc(CNC2(c3cccc(OC(F)(F)F)c3)CCOCC2)c1 ZINC000447317054 871210383 /nfs/dbraw/zinc/21/03/83/871210383.db2.gz BFQILAMHDNUISR-UHFFFAOYSA-N 0 3 408.420 4.339 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)NCc1ccc(COc2ccccc2)cc1 ZINC000447320778 871213255 /nfs/dbraw/zinc/21/32/55/871213255.db2.gz GPUOLJBUVVBSKK-UHFFFAOYSA-N 0 3 407.514 4.132 20 0 HIADHN COc1ccccc1-c1csc([C@H]2CCCN(C[C@@H](O)CC(F)(F)F)C2)n1 ZINC000447402629 871310625 /nfs/dbraw/zinc/31/06/25/871310625.db2.gz LBFLQXJPKBIXPA-KBPBESRZSA-N 0 3 400.466 4.311 20 0 HIADHN Cc1c(F)cccc1NC(=O)CCN1CCN(c2cccc3cnccc32)C[C@@H]1C ZINC000447400231 871311055 /nfs/dbraw/zinc/31/10/55/871311055.db2.gz NMBQDSFNKOPJQF-KRWDZBQOSA-N 0 3 406.505 4.222 20 0 HIADHN COc1ccc(-c2ccc(CNC(=O)N(CCN(C)C)Cc3ccco3)cc2)cc1 ZINC000447409230 871318694 /nfs/dbraw/zinc/31/86/94/871318694.db2.gz UUOXMFWKJYMCOO-UHFFFAOYSA-N 0 3 407.514 4.229 20 0 HIADHN O=C(Cc1cccc(Cl)c1Cl)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000447504311 871379450 /nfs/dbraw/zinc/37/94/50/871379450.db2.gz MNJZXLLGXCLLRL-UHFFFAOYSA-N 0 3 407.341 4.379 20 0 HIADHN Cc1ccc(CN[C@H]2CCCc3ccc(Br)cc32)cc1S(C)(=O)=O ZINC000447566622 871460937 /nfs/dbraw/zinc/46/09/37/871460937.db2.gz VCNJOVUTKPHJHO-SFHVURJKSA-N 0 3 408.361 4.328 20 0 HIADHN C[C@H](N[C@@H](C)c1cccc(N2CCCS2(=O)=O)c1)c1ccc(Br)cc1 ZINC000447566964 871464944 /nfs/dbraw/zinc/46/49/44/871464944.db2.gz YAEIDTSPUFGQQC-GJZGRUSLSA-N 0 3 423.376 4.401 20 0 HIADHN Cc1ccc(CN[C@@H]2C[C@@H](C)c3c2cccc3Br)cc1S(C)(=O)=O ZINC000447582728 871484596 /nfs/dbraw/zinc/48/45/96/871484596.db2.gz YBMCFTDMMATGKA-CXAGYDPISA-N 0 3 408.361 4.499 20 0 HIADHN Cc1ccc(CN[C@H]2CCCc3c(Br)cccc32)cc1S(C)(=O)=O ZINC000447582796 871486264 /nfs/dbraw/zinc/48/62/64/871486264.db2.gz YKTPJILCBFKNEY-SFHVURJKSA-N 0 3 408.361 4.328 20 0 HIADHN FC(F)(F)c1ccc(CN2CC[C@@H](NCc3nc(-c4ccccc4)c[nH]3)C2)cc1 ZINC000447850925 871771482 /nfs/dbraw/zinc/77/14/82/871771482.db2.gz PKGPFHQGGLSLAV-LJQANCHMSA-N 0 3 400.448 4.460 20 0 HIADHN CCOc1ccc([C@@H](N[C@@H]2CCCN(CC(F)(F)F)C2=O)C(C)C)cc1OCC ZINC000447886675 871800807 /nfs/dbraw/zinc/80/08/07/871800807.db2.gz ULVIGGQKWBVOEI-APWZRJJASA-N 0 3 416.484 4.324 20 0 HIADHN C[C@@H]1CCC[C@H](C)N(CC(=O)N(Cc2nnc(-c3ccccc3Cl)o2)C2CC2)C1 ZINC000448023161 871864773 /nfs/dbraw/zinc/86/47/73/871864773.db2.gz RXOMYFOHQIURFB-CVEARBPZSA-N 0 3 416.953 4.392 20 0 HIADHN CCN(C(=O)Nc1cccc2c1OCC[C@H]2OC)[C@H]1CCN(Cc2ccccc2)C1 ZINC000448042047 871875329 /nfs/dbraw/zinc/87/53/29/871875329.db2.gz HQAXEOMIKNDCQV-SIKLNZKXSA-N 0 3 409.530 4.285 20 0 HIADHN CO[C@H]1CCOc2c(NC(=O)N(CCN(C)C)Cc3ccc(F)c(F)c3)cccc21 ZINC000448045865 871877553 /nfs/dbraw/zinc/87/75/53/871877553.db2.gz VCKSHUFHVMAOAQ-FQEVSTJZSA-N 0 3 419.472 4.031 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)c2ccc(Sc3ccccc3C)cc2)CC1 ZINC000448248341 872165895 /nfs/dbraw/zinc/16/58/95/872165895.db2.gz PJQDBSDRNAUULT-IBGZPJMESA-N 0 3 411.615 4.150 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)c2ccc(Sc3ccccc3C)cc2)CC1 ZINC000448248342 872166624 /nfs/dbraw/zinc/16/66/24/872166624.db2.gz PJQDBSDRNAUULT-LJQANCHMSA-N 0 3 411.615 4.150 20 0 HIADHN CCC(C)(C)c1ccc(NC(=O)C(=O)NC2CCN([C@@H](C)c3ccncc3)CC2)cc1 ZINC000448294188 872228300 /nfs/dbraw/zinc/22/83/00/872228300.db2.gz NYHBXKGEHSKPDP-SFHVURJKSA-N 0 3 422.573 4.050 20 0 HIADHN C[C@H](c1cccc(C(F)(F)F)c1)N(C)C(=O)CCN1CCN(c2ccccc2)CC1 ZINC000468554380 882596962 /nfs/dbraw/zinc/59/69/62/882596962.db2.gz NAOBGBZUBVRWTD-GOSISDBHSA-N 0 3 419.491 4.437 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)NCc1ccc(Oc2cccnc2)c(F)c1 ZINC000460126771 872605369 /nfs/dbraw/zinc/60/53/69/872605369.db2.gz ZCKFADUVAUUXTJ-GOSISDBHSA-N 0 3 422.504 4.333 20 0 HIADHN CCCN(CCN1CCN(CC)CC1)C(=O)N[C@@H](c1ccc(F)cc1)C1CCCC1 ZINC000460135906 872624865 /nfs/dbraw/zinc/62/48/65/872624865.db2.gz DJCWPMOYAVOEQT-HSZRJFAPSA-N 0 3 418.601 4.116 20 0 HIADHN CCCN(CCN1CCN(CC)CC1)C(=O)N[C@H](c1ccc(F)cc1)C1CCCC1 ZINC000460135907 872625350 /nfs/dbraw/zinc/62/53/50/872625350.db2.gz DJCWPMOYAVOEQT-QHCPKHFHSA-N 0 3 418.601 4.116 20 0 HIADHN O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)N1CCCC[C@H]1c1nnc(C2CCC2)o1 ZINC000460141767 872643159 /nfs/dbraw/zinc/64/31/59/872643159.db2.gz XEURINGYSINQKG-RTWAWAEBSA-N 0 3 423.561 4.238 20 0 HIADHN CCCN(CCN1CCN(CC)CC1)C(=O)NCc1ccc(Oc2ccccc2)cc1 ZINC000460168768 872720779 /nfs/dbraw/zinc/72/07/79/872720779.db2.gz ZFDRKPJDJMKCRR-UHFFFAOYSA-N 0 3 424.589 4.038 20 0 HIADHN Cc1cc(NC(=O)N2CC[C@H](N3CCN(C)CC3)[C@H](C)C2)ccc1-c1ccccc1 ZINC000460229585 872815858 /nfs/dbraw/zinc/81/58/58/872815858.db2.gz HSUDGLZFIULYJC-YKSBVNFPSA-N 0 3 406.574 4.152 20 0 HIADHN Cc1cc(NC(=O)N2CC[C@@H](N3CCN(C)CC3)[C@@H](C)C2)ccc1-c1ccccc1 ZINC000460229581 872815971 /nfs/dbraw/zinc/81/59/71/872815971.db2.gz HSUDGLZFIULYJC-GBXCKJPGSA-N 0 3 406.574 4.152 20 0 HIADHN CCCN(CCN1CCN(CC)CC1)C(=O)N[C@H](C)c1cccc(Cl)c1Cl ZINC000460318005 872907951 /nfs/dbraw/zinc/90/79/51/872907951.db2.gz AYOOYLVGHOWDFS-MRXNPFEDSA-N 0 3 415.409 4.114 20 0 HIADHN CCCN(CCN1CCN(CC)CC1)C(=O)N[C@@H](c1ccccc1Cl)C(C)C ZINC000460340461 872950591 /nfs/dbraw/zinc/95/05/91/872950591.db2.gz SJTTVUYZDXIHQW-OAQYLSRUSA-N 0 3 409.018 4.096 20 0 HIADHN CC[C@H](C)[C@H](NC(=O)c1ccc(N2CCN(CC)CC2)cc1)c1nc2ccccc2[nH]1 ZINC000468593844 882681392 /nfs/dbraw/zinc/68/13/92/882681392.db2.gz CBAQZTWOXFVOHF-MBSDFSHPSA-N 0 3 419.573 4.222 20 0 HIADHN Cc1ccc(CNCc2ccc(Oc3cnccn3)cc2)c(-n2cc(Cl)cn2)n1 ZINC000468594812 882685449 /nfs/dbraw/zinc/68/54/49/882685449.db2.gz HURPBBKTJODEBT-UHFFFAOYSA-N 0 3 406.877 4.101 20 0 HIADHN CCCOc1ccc(CNCc2ccc(C)nc2-n2cc(Cl)cn2)cc1OC ZINC000468602603 882699484 /nfs/dbraw/zinc/69/94/84/882699484.db2.gz QATBFHQFGRCICG-UHFFFAOYSA-N 0 3 400.910 4.316 20 0 HIADHN Cc1ccc(CNCc2cccc(OCC(F)(F)F)c2)c(-n2cc(Cl)cn2)n1 ZINC000468605065 882705751 /nfs/dbraw/zinc/70/57/51/882705751.db2.gz GMELZFXVTBOFPU-UHFFFAOYSA-N 0 3 410.827 4.460 20 0 HIADHN CCN1C[C@@H](C)N(c2nnc(CSc3ccccc3OC)n2CC(C)C)C[C@H]1C ZINC000460596170 873336842 /nfs/dbraw/zinc/33/68/42/873336842.db2.gz HOOXLOUFMYDWRT-QZTJIDSGSA-N 0 3 417.623 4.154 20 0 HIADHN CC1CCN(CCNC(=O)c2cn(C(C)(C)C)nc2-c2ccc(F)cc2F)CC1 ZINC000460725733 873531054 /nfs/dbraw/zinc/53/10/54/873531054.db2.gz LNLJFNRZBKHZCQ-UHFFFAOYSA-N 0 3 404.505 4.045 20 0 HIADHN CN(C)[C@H](CNC(=O)C1(c2cccc(C(F)(F)F)c2)CCC1)Cc1ccccc1 ZINC000460802477 873675380 /nfs/dbraw/zinc/67/53/80/873675380.db2.gz BRUNWJJZRCHFGV-FQEVSTJZSA-N 0 3 404.476 4.416 20 0 HIADHN CC(C)CC(=O)Nc1ccc(C(=O)NC[C@H](c2ccccc2)N2CCCC2)cc1F ZINC000460806724 873683273 /nfs/dbraw/zinc/68/32/73/873683273.db2.gz QAGDABUTKSYGQU-JOCHJYFZSA-N 0 3 411.521 4.377 20 0 HIADHN COc1ccc2sc(C(=O)N3CCC(CN4C[C@@H](C)O[C@@H](C)C4)CC3)c(C)c2c1 ZINC000460862470 873766253 /nfs/dbraw/zinc/76/62/53/873766253.db2.gz JSEWWDXVFAVYKT-IYBDPMFKSA-N 0 3 416.587 4.180 20 0 HIADHN O=C(c1ccc(OC2CCOCC2)cc1)N1CCCN(CCCc2ccccc2)CC1 ZINC000460870960 873777455 /nfs/dbraw/zinc/77/74/55/873777455.db2.gz MGHGLHCMGOHRBM-UHFFFAOYSA-N 0 3 422.569 4.025 20 0 HIADHN CCN1C[C@H](C)N(c2nnc([C@H]3OCC[C@H]3c3ccccc3)n2CC(C)C)C[C@H]1C ZINC000460919463 873824623 /nfs/dbraw/zinc/82/46/23/873824623.db2.gz XFFWRMXXCRIMRT-WAGURGNTSA-N 0 3 411.594 4.098 20 0 HIADHN CCN1C[C@H](C)N(c2nnc([C@H]3OCC[C@H]3c3ccccc3)n2CC(C)C)C[C@@H]1C ZINC000460919458 873824706 /nfs/dbraw/zinc/82/47/06/873824706.db2.gz XFFWRMXXCRIMRT-LGGPRVQUSA-N 0 3 411.594 4.098 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)c1ccc(OCc2ccccn2)cc1 ZINC000460926490 873830853 /nfs/dbraw/zinc/83/08/53/873830853.db2.gz PWBCZOPHDLCIDF-UHFFFAOYSA-N 0 3 407.489 4.004 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)c1ccc(OCc2ccccn2)cc1 ZINC000460959912 873856482 /nfs/dbraw/zinc/85/64/82/873856482.db2.gz QNGIWXWDHNDRCF-UHFFFAOYSA-N 0 3 407.489 4.004 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N[C@H]1c2ccccc2CC12CCOCC2)c1ccco1 ZINC000461004538 873880944 /nfs/dbraw/zinc/88/09/44/873880944.db2.gz CNEHGFPFCRNPFS-XJABCFGWSA-N 0 3 411.546 4.102 20 0 HIADHN COc1ccccc1[C@H](NCc1ccc(N2CCCS2(=O)=O)cc1)C1CCCC1 ZINC000461084121 873995850 /nfs/dbraw/zinc/99/58/50/873995850.db2.gz SFBIOEIGBICBHU-HSZRJFAPSA-N 0 3 414.571 4.256 20 0 HIADHN CC1(C)CN(C2(CNC(=O)c3c[nH]cc3-c3ccc(F)cc3)CCCCC2)CCO1 ZINC000461105397 874025417 /nfs/dbraw/zinc/02/54/17/874025417.db2.gz ZUUGTIHCKSPCOP-UHFFFAOYSA-N 0 3 413.537 4.364 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1c2ccccc2CC12CCOCC2)[C@@H](c1ccccc1)N(C)C ZINC000461226312 874227401 /nfs/dbraw/zinc/22/74/01/874227401.db2.gz MIAHDOXYZFVORH-OFAXGOBFSA-N 0 3 407.558 4.071 20 0 HIADHN c1c2c(sc1-c1nnc(CN3CCC[C@H](c4n[nH]c(C5CC5)n4)C3)o1)CCCC2 ZINC000461359670 874361448 /nfs/dbraw/zinc/36/14/48/874361448.db2.gz CCXPGNNXCRIXNY-HNNXBMFYSA-N 0 3 410.547 4.052 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccc(F)c2)C1)N1CC[C@H](COCc2ccccc2)C1 ZINC000461380191 874386320 /nfs/dbraw/zinc/38/63/20/874386320.db2.gz APSJLVHCTSWFNO-XZOQPEGZSA-N 0 3 410.533 4.103 20 0 HIADHN C[C@@H](c1ccc(Cl)cc1)N1CCN(C(=O)c2cccc(CN3CCCC3)c2)CC1 ZINC000461388313 874394318 /nfs/dbraw/zinc/39/43/18/874394318.db2.gz PJBXHWIAUWEOFR-IBGZPJMESA-N 0 3 411.977 4.455 20 0 HIADHN C[C@H]1CC[C@H](C)N1CC(=O)Nc1ccc(=O)n(Cc2ccc(Cl)c(Cl)c2)c1 ZINC000468716244 882826735 /nfs/dbraw/zinc/82/67/35/882826735.db2.gz ODBTUJKBAYKAQV-KBPBESRZSA-N 0 3 408.329 4.015 20 0 HIADHN O=C(CCC(=O)N1C[C@@H]2CCN(Cc3ccccc3)C[C@@H]2C1)c1ccc(Cl)cc1 ZINC000461433322 874482252 /nfs/dbraw/zinc/48/22/52/874482252.db2.gz VUHWDZIURIATOA-LEWJYISDSA-N 0 3 410.945 4.283 20 0 HIADHN Cc1c(C(=O)N2C[C@@H]3CCN(Cc4ccccc4)C[C@H]3C2)[nH]c2c1C(=O)CC(C)(C)C2 ZINC000461439717 874494423 /nfs/dbraw/zinc/49/44/23/874494423.db2.gz UIXCWQGDVDDTDV-PMACEKPBSA-N 0 3 419.569 4.072 20 0 HIADHN Cc1cn(-c2c(F)cccc2F)nc1C(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000468745873 882839550 /nfs/dbraw/zinc/83/95/50/882839550.db2.gz WGRXZTJBYYCEBH-SJLPKXTDSA-N 0 3 410.468 4.024 20 0 HIADHN COc1cc(Br)ccc1[C@@H](C)NC(=O)N(CCN(C)C)C1CCCC1 ZINC000468778880 882855584 /nfs/dbraw/zinc/85/55/84/882855584.db2.gz AYSITAFXRUEITI-CQSZACIVSA-N 0 3 412.372 4.035 20 0 HIADHN C[C@H]1CCc2onc(C(=O)N(CCN(C)C)Cc3cccc(C(F)(F)F)c3)c2C1 ZINC000468791232 882861937 /nfs/dbraw/zinc/86/19/37/882861937.db2.gz BVZTYNLEXSAYAN-AWEZNQCLSA-N 0 3 409.452 4.022 20 0 HIADHN Cc1cc(C)c(Br)c(C(=O)Nc2cccc(CN3CCC(O)CC3)c2)c1 ZINC000461765801 874899194 /nfs/dbraw/zinc/89/91/94/874899194.db2.gz SZVHEIBFUXIOIG-UHFFFAOYSA-N 0 3 417.347 4.275 20 0 HIADHN C[C@@H](CCCOc1ccccc1C(N)=O)NCc1cc(F)ccc1Br ZINC000468845422 882887119 /nfs/dbraw/zinc/88/71/19/882887119.db2.gz DSIJGXBZGJJSKL-ZDUSSCGKSA-N 0 3 409.299 4.024 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1c(C)nc(C2CC2)nc1SC)c1ccsc1 ZINC000461892235 875040228 /nfs/dbraw/zinc/04/02/28/875040228.db2.gz ZBTALIVFOZDWHW-MRXNPFEDSA-N 0 3 404.605 4.259 20 0 HIADHN C[C@H](CNC(=O)N[C@@H]1CCCc2cn(C3CCCC3)nc21)N(C)Cc1ccccc1 ZINC000461957790 875085938 /nfs/dbraw/zinc/08/59/38/875085938.db2.gz PSFGJEYXPGOVHH-XMSQKQJNSA-N 0 3 409.578 4.195 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)N[C@@H]2CCCc3cn(C4CCCC4)nc32)CN1Cc1ccccc1 ZINC000461965263 875090309 /nfs/dbraw/zinc/09/03/09/875090309.db2.gz MYKSSXFBMJIPGO-RZFNWQHOSA-N 0 3 421.589 4.338 20 0 HIADHN O=C(CCN1CCN(c2ccccc2)CC1)N1Cc2ccccc2-c2ccccc2C1 ZINC000462018061 875136166 /nfs/dbraw/zinc/13/61/66/875136166.db2.gz YJFGXALXPJFZMR-UHFFFAOYSA-N 0 3 411.549 4.408 20 0 HIADHN COc1ccc([C@H](CNC(=O)CN2[C@H](C)CC[C@@H]2C)c2c[nH]c3ccccc32)cc1 ZINC000462042507 875154725 /nfs/dbraw/zinc/15/47/25/875154725.db2.gz ZYIBSHHTPBDOFX-SVMVAKDDSA-N 0 3 405.542 4.297 20 0 HIADHN Cc1ccc(S(=O)(=O)N2CCC(N[C@H](C)c3nc(C(C)(C)C)cs3)CC2)cc1 ZINC000462044562 875156291 /nfs/dbraw/zinc/15/62/91/875156291.db2.gz FYSMQEILLJFGBU-MRXNPFEDSA-N 0 3 421.632 4.253 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)CCN3CCN(c4ccccc4)CC3)cc2)cs1 ZINC000462048571 875162105 /nfs/dbraw/zinc/16/21/05/875162105.db2.gz BWZVLKGACJKIFK-UHFFFAOYSA-N 0 3 406.555 4.269 20 0 HIADHN Cc1nc2ccc(Br)cc2c(NCc2ccnc(-n3cccn3)c2)c1C ZINC000462090320 875200515 /nfs/dbraw/zinc/20/05/15/875200515.db2.gz OZKIKNHARQDQGY-UHFFFAOYSA-N 0 3 408.303 4.229 20 0 HIADHN COc1cccc([C@H](CNc2ncccc2C(=O)N2CCc3ccccc32)N(C)C)c1 ZINC000462116813 875220835 /nfs/dbraw/zinc/22/08/35/875220835.db2.gz RGEKVBUHOZIKOJ-QHCPKHFHSA-N 0 3 416.525 4.008 20 0 HIADHN C[C@@H]1CCCN(c2cc(C(=O)N3CCCN(Cc4ccccc4)C[C@H]3C)ccn2)C1 ZINC000462153900 875249885 /nfs/dbraw/zinc/24/98/85/875249885.db2.gz YKYHXFAQQIOAHR-NHCUHLMSSA-N 0 3 406.574 4.055 20 0 HIADHN Cc1cc(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)ccc1NC(=O)CC(C)C ZINC000462172778 875269817 /nfs/dbraw/zinc/26/98/17/875269817.db2.gz XTNNTHCLOQMVST-WMZHIEFXSA-N 0 3 407.558 4.230 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1ccc(NC(=O)c2cccs2)cc1 ZINC000462195101 875302276 /nfs/dbraw/zinc/30/22/76/875302276.db2.gz KCDGKPNPJQCCQP-DYESRHJHSA-N 0 3 419.550 4.251 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Nc1ccc(OCc2ccncc2)cc1 ZINC000462243861 875359820 /nfs/dbraw/zinc/35/98/20/875359820.db2.gz CVARYHNQVWNRSK-YADARESESA-N 0 3 416.525 4.303 20 0 HIADHN C[C@@H](C(=O)NC1CCN([C@@H](C)c2ccncc2)CC1)c1cccc(Br)c1 ZINC000462247277 875364362 /nfs/dbraw/zinc/36/43/62/875364362.db2.gz OMIJNKUVPROOHP-CVEARBPZSA-N 0 3 416.363 4.289 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1NC(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C ZINC000462252282 875373024 /nfs/dbraw/zinc/37/30/24/875373024.db2.gz BCRSYCYOEJMETH-JTSKRJEESA-N 0 3 403.530 4.131 20 0 HIADHN CC(C)[C@H](Oc1ccc(Cl)cc1)C(=O)NC1CCN([C@@H](C)c2ccncc2)CC1 ZINC000462256921 875380345 /nfs/dbraw/zinc/38/03/45/875380345.db2.gz UTRVDGNUKLUBLP-JTSKRJEESA-N 0 3 415.965 4.480 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)Nc1ccc(C(=O)NC2CCCC2)cc1 ZINC000462263229 875389019 /nfs/dbraw/zinc/38/90/19/875389019.db2.gz NUUCDCYMSHMRIB-MBSDFSHPSA-N 0 3 420.557 4.001 20 0 HIADHN COCCOc1c(Cl)cccc1NC(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C ZINC000462268605 875396666 /nfs/dbraw/zinc/39/66/66/875396666.db2.gz QBQBUGACQSLQPO-UZLBHIALSA-N 0 3 417.937 4.007 20 0 HIADHN CC(C)(C)c1nc2ccc(S(=O)(=O)N3CCCC[C@@H](N4CCCC4)C3)cc2s1 ZINC000462293730 875416588 /nfs/dbraw/zinc/41/65/88/875416588.db2.gz QXCBQGAFOWOCRJ-MRXNPFEDSA-N 0 3 421.632 4.233 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)CN[C@H](c1ccccc1)C(F)(F)F ZINC000468887210 882927560 /nfs/dbraw/zinc/92/75/60/882927560.db2.gz GMUXQLZLMTVTBB-PGRDOPGGSA-N 0 3 419.491 4.003 20 0 HIADHN CC(C)(CNC(=O)N[C@H]1CCO[C@H](c2ccccc2)C1)N1CCc2ccccc2C1 ZINC000462299967 875421435 /nfs/dbraw/zinc/42/14/35/875421435.db2.gz UZAWGGPOAPSELU-GOTSBHOMSA-N 0 3 407.558 4.043 20 0 HIADHN CCCN(C(=O)NCc1ccc2cc[nH]c2n1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000462526134 875642550 /nfs/dbraw/zinc/64/25/50/875642550.db2.gz LTWZZBKKQKZBOJ-JOCHJYFZSA-N 0 3 405.546 4.149 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)N[C@@H]2c3ccccc3CC23CCOCC3)c1 ZINC000462528905 875647443 /nfs/dbraw/zinc/64/74/43/875647443.db2.gz FNDOYDOLGRUXEU-XMMPIXPASA-N 0 3 421.585 4.162 20 0 HIADHN Fc1ccc(-c2nnc3n2C[C@H](NCc2sccc2Br)CC3)cc1 ZINC000462533151 875651479 /nfs/dbraw/zinc/65/14/79/875651479.db2.gz HGMYPVJWUVWKLO-CYBMUJFWSA-N 0 3 407.312 4.013 20 0 HIADHN O=S1(=O)CCCN1c1cccc(CNCc2ccc(OCc3ccccc3)cc2)c1 ZINC000462559653 875686952 /nfs/dbraw/zinc/68/69/52/875686952.db2.gz ZYZHLBBSGGYJJY-UHFFFAOYSA-N 0 3 422.550 4.095 20 0 HIADHN Cc1cc(C)cc(-c2ccc(CNCc3ccc(N4CCN(C)CC4)nc3)cc2)c1 ZINC000462690197 875781382 /nfs/dbraw/zinc/78/13/82/875781382.db2.gz XICONBZUKBZILF-UHFFFAOYSA-N 0 3 400.570 4.407 20 0 HIADHN COc1ccccc1/C=C\CN[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1=O ZINC000462739765 875811433 /nfs/dbraw/zinc/81/14/33/875811433.db2.gz WWWWDAQPUQJCMD-OCTSTCLRSA-N 0 3 402.441 4.095 20 0 HIADHN C[C@@H]1C[C@@H]1N1C[C@@H](NCc2cn(C(C)(C)C)nc2-c2ccccc2Cl)CC1=O ZINC000462747397 875815781 /nfs/dbraw/zinc/81/57/81/875815781.db2.gz VCQFFEYUQLPKCQ-ALKREAHSSA-N 0 3 400.954 4.057 20 0 HIADHN COc1cccc([C@@H](CNC(=O)CCc2cncc3ccccc32)N2CCCC2)c1 ZINC000462765836 875827554 /nfs/dbraw/zinc/82/75/54/875827554.db2.gz USOCLBUZTVCWFR-XMMPIXPASA-N 0 3 403.526 4.129 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@H](C)N[C@@H]2CCCc3ccc(O)cc32)cc1 ZINC000462814011 875856213 /nfs/dbraw/zinc/85/62/13/875856213.db2.gz CPPRYCKZHITUDK-KSFYIVLOSA-N 0 3 402.560 4.151 20 0 HIADHN Fc1cc(CN[C@@H](c2cccc(C(F)(F)F)c2)C2CC2)cnc1N1CCOCC1 ZINC000462835866 875869926 /nfs/dbraw/zinc/86/99/26/875869926.db2.gz SAAOZVLOMGFKMR-LJQANCHMSA-N 0 3 409.427 4.317 20 0 HIADHN C[C@@H]1C[C@H](NCc2cnc(N3CCOCC3)c(F)c2)c2cccc(Br)c21 ZINC000462837467 875872054 /nfs/dbraw/zinc/87/20/54/875872054.db2.gz XNKPLKVVHXGKAX-ACJLOTCBSA-N 0 3 420.326 4.158 20 0 HIADHN Cc1cc(Cl)c2ccccc2c1NC(=O)N1CC[C@H](N2CCN(C)CC2)[C@H](C)C1 ZINC000462853160 875887145 /nfs/dbraw/zinc/88/71/45/875887145.db2.gz ITPZHMCSGZNDNG-UTKZUKDTSA-N 0 3 414.981 4.291 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)C1(C2CC2)CCOCC1)c1ccc(C(F)(F)F)cc1 ZINC000462925450 875954238 /nfs/dbraw/zinc/95/42/38/875954238.db2.gz JNCAMOFHIGWFCJ-IBGZPJMESA-N 0 3 412.496 4.411 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)cc1OC ZINC000463012515 876027712 /nfs/dbraw/zinc/02/77/12/876027712.db2.gz QMBNDYAJFAXQFE-NYVOZVTQSA-N 0 3 423.557 4.071 20 0 HIADHN OC[C@]1(c2ccccc2)CCN(Cc2cnn(Cc3ccc(C(F)(F)F)cc3)c2)C1 ZINC000463022561 876039918 /nfs/dbraw/zinc/03/99/18/876039918.db2.gz JZHCCUKVANFVGF-QFIPXVFZSA-N 0 3 415.459 4.086 20 0 HIADHN CC(=O)N1CCN(c2ccccc2CN[C@@H](C)c2ccc(OC(C)(C)C)cc2)CC1 ZINC000463025154 876043429 /nfs/dbraw/zinc/04/34/29/876043429.db2.gz SEMHOMTVUWOWHQ-IBGZPJMESA-N 0 3 409.574 4.383 20 0 HIADHN C[C@H]1CCN(c2cnn(Cc3ccccc3)c(=O)c2Cl)CCN1Cc1ccccc1 ZINC000463072587 876102582 /nfs/dbraw/zinc/10/25/82/876102582.db2.gz WQMCSGWNFBIXOY-IBGZPJMESA-N 0 3 422.960 4.046 20 0 HIADHN CC(C)[C@H](C(=O)NCCCCN1CCN(Cc2ccccc2)CC1)c1ccccc1 ZINC000463133874 876182097 /nfs/dbraw/zinc/18/20/97/876182097.db2.gz WKRLQWOSAQYBSQ-VWLOTQADSA-N 0 3 407.602 4.140 20 0 HIADHN Cc1ccc(CN[C@H](C)c2ccc(NC(=O)NC3CC3)cc2)c(-n2cc(Cl)cn2)n1 ZINC000468940982 883005651 /nfs/dbraw/zinc/00/56/51/883005651.db2.gz MFXWLOUVEKMWSF-OAHLLOKOSA-N 0 3 424.936 4.364 20 0 HIADHN C[C@@H](c1ccsc1)N1CCN(C(=O)NC[C@@H](c2cccs2)N2CCCC2)CC1 ZINC000463158130 876210428 /nfs/dbraw/zinc/21/04/28/876210428.db2.gz CJIZBDAKHXLHTM-HKUYNNGSSA-N 0 3 418.632 4.035 20 0 HIADHN Cc1nc(-c2cccc(NC(=O)CN3CCCC[C@@H]3[C@@H]3CCCC[C@@H]3O)c2)cs1 ZINC000463195484 876254692 /nfs/dbraw/zinc/25/46/92/876254692.db2.gz XUMCFCUWMQAUMB-NNWRFLSQSA-N 0 3 413.587 4.463 20 0 HIADHN CCOc1ccc(NC(=O)CN2CCCC[C@@H]2[C@@H]2C[C@@H](C)CC[C@@H]2O)cc1OCC ZINC000463205888 876266570 /nfs/dbraw/zinc/26/65/70/876266570.db2.gz VSZCCMAHOGGDBS-WJMWBRGCSA-N 0 3 418.578 4.074 20 0 HIADHN COC(=O)c1ccc(-c2nc(CN3CCCC[C@@H]3[C@@H]3C[C@H](C)CC[C@@H]3O)co2)cc1 ZINC000463208413 876268573 /nfs/dbraw/zinc/26/85/73/876268573.db2.gz XMPUXGVTHNZLAY-ZJMJOCHXSA-N 0 3 412.530 4.280 20 0 HIADHN CN(CCc1ccccc1O)Cc1cc(Br)cc(Br)c1N ZINC000463239148 876295705 /nfs/dbraw/zinc/29/57/05/876295705.db2.gz WGJOUWOBQNGDJV-UHFFFAOYSA-N 0 3 414.141 4.174 20 0 HIADHN CN(CCN(Cc1ccccc1)C(=O)N[C@@H]1CCO[C@H](C2CC2)C1)Cc1ccccc1 ZINC000463258651 876316339 /nfs/dbraw/zinc/31/63/39/876316339.db2.gz RCSVNVRBPJVMBA-RPBOFIJWSA-N 0 3 421.585 4.288 20 0 HIADHN C[C@@H]1CCCc2ccccc2[C@H]1NC(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000463261720 876320243 /nfs/dbraw/zinc/32/02/43/876320243.db2.gz IRASLBWTUIWYPX-CLOONOSVSA-N 0 3 421.585 4.156 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)NCc1ccc(-c2cccnc2)cc1 ZINC000463266228 876324905 /nfs/dbraw/zinc/32/49/05/876324905.db2.gz LPGAZNBGSBBZKT-YADARESESA-N 0 3 400.526 4.068 20 0 HIADHN Cc1cc(C)c(CN2CC[C@@](CO)(c3ccccc3)C2)c(OCc2ccccc2)n1 ZINC000463432270 876487533 /nfs/dbraw/zinc/48/75/33/876487533.db2.gz UHCXYZXPOZTVLY-AREMUKBSSA-N 0 3 402.538 4.413 20 0 HIADHN O=C([C@H](c1ccccc1)N1CCC[C@@](CO)(Cc2ccccc2)C1)N1CCCCC1 ZINC000463437461 876493409 /nfs/dbraw/zinc/49/34/09/876493409.db2.gz FAAYXXDRLUQPCZ-AZGAKELHSA-N 0 3 406.570 4.057 20 0 HIADHN O=C([C@@H](c1ccccc1)N1CCC[C@@](CO)(Cc2ccccc2)C1)N1CCCCC1 ZINC000463437459 876493486 /nfs/dbraw/zinc/49/34/86/876493486.db2.gz FAAYXXDRLUQPCZ-AOYPEHQESA-N 0 3 406.570 4.057 20 0 HIADHN OC[C@]1(Cc2ccccc2)CCCN(C[C@H](O)COc2c(Cl)cccc2Cl)C1 ZINC000463446071 876504670 /nfs/dbraw/zinc/50/46/70/876504670.db2.gz BMVITNWJEVHRPU-AVRDEDQJSA-N 0 3 424.368 4.050 20 0 HIADHN COc1ccc([C@H](CNC(=O)[C@H]2C[C@H]2c2cc(F)c(F)c(F)c2)N2CCCC2)cc1 ZINC000463500329 876560622 /nfs/dbraw/zinc/56/06/22/876560622.db2.gz OKWNMQWSKMENDL-WFXMLNOXSA-N 0 3 418.459 4.169 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)[C@H]3C[C@@H]3c3cc(F)c(F)c(F)c3)c(C)c2)CC1 ZINC000463516185 876581405 /nfs/dbraw/zinc/58/14/05/876581405.db2.gz VIDMLJXXZUXVMK-MSOLQXFVSA-N 0 3 417.475 4.296 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)cc1C(=O)N(CCN(C)C)Cc1ccc(F)cc1 ZINC000463519394 876586225 /nfs/dbraw/zinc/58/62/25/876586225.db2.gz SZIHYKIOZPDEQU-UHFFFAOYSA-N 0 3 414.912 4.177 20 0 HIADHN C[C@@H](C(=O)N(CCN(C)C)Cc1cccc(F)c1)c1ccc(Br)s1 ZINC000463524976 876594414 /nfs/dbraw/zinc/59/44/14/876594414.db2.gz GZXHQIVYQWBUJD-CYBMUJFWSA-N 0 3 413.356 4.344 20 0 HIADHN CC(C)c1nn(C)c2sc(C(=O)N(CCN(C)C)Cc3ccc(F)cc3F)cc12 ZINC000463527103 876598298 /nfs/dbraw/zinc/59/82/98/876598298.db2.gz NZKWMSMFZLHDCW-UHFFFAOYSA-N 0 3 420.529 4.240 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)[C@@H]1SCCc2sccc21 ZINC000463588609 876693862 /nfs/dbraw/zinc/69/38/62/876693862.db2.gz IUCOSAJZVFLSNY-LJQANCHMSA-N 0 3 404.626 4.309 20 0 HIADHN C[C@H](CC(=O)c1ccccc1F)C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000463588647 876696531 /nfs/dbraw/zinc/69/65/31/876696531.db2.gz JJPKZQLWZMQAQH-QGZVFWFLSA-N 0 3 414.546 4.265 20 0 HIADHN CN(C)C(=O)N1CCC(N[C@@H]2CCCc3sc(-c4ccc(F)cc4)nc32)CC1 ZINC000463716427 876835812 /nfs/dbraw/zinc/83/58/12/876835812.db2.gz LIVBMLULGTZDRN-QGZVFWFLSA-N 0 3 402.539 4.062 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3ccccc3OCc3cscn3)cc2)CC1 ZINC000469003727 883070581 /nfs/dbraw/zinc/07/05/81/883070581.db2.gz LYKNTPURXGRECD-UHFFFAOYSA-N 0 3 422.554 4.116 20 0 HIADHN COc1ccc(Cn2nc(C)c(CNCc3cccc(-n4ccnc4)c3)c2C)cc1 ZINC000463741391 876862579 /nfs/dbraw/zinc/86/25/79/876862579.db2.gz JMNAZUUYBVDZDL-UHFFFAOYSA-N 0 3 401.514 4.032 20 0 HIADHN C[C@H](C(=O)NC[C@H]1CCCN1Cc1ccccc1)c1ccc(Br)s1 ZINC000463742203 876863850 /nfs/dbraw/zinc/86/38/50/876863850.db2.gz VFGRXJCEXOPETL-GOEBONIOSA-N 0 3 407.377 4.395 20 0 HIADHN O=C1[C@H](NCc2cccc(-c3ccccn3)c2)CCCN1Cc1ccc(F)cc1F ZINC000469006539 883072183 /nfs/dbraw/zinc/07/21/83/883072183.db2.gz NVLQARCDRFVLMH-HSZRJFAPSA-N 0 3 407.464 4.308 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)[C@H]1C[C@H]1c1cc(F)c(F)c(F)c1 ZINC000463769035 876890181 /nfs/dbraw/zinc/89/01/81/876890181.db2.gz MSGDGBSSLQJSRB-MNEFBYGVSA-N 0 3 402.460 4.330 20 0 HIADHN Cc1cc(N2CC[C@H](N[C@H](Cc3ccc(Cl)cc3)c3ccccc3)C2=O)n(C)n1 ZINC000463885291 877006248 /nfs/dbraw/zinc/00/62/48/877006248.db2.gz AHOWEZKZFYRYDN-LEWJYISDSA-N 0 3 408.933 4.061 20 0 HIADHN Cn1ccc(N2CCC[C@H](N[C@H](CCCc3ccccc3)c3ccccc3)C2=O)n1 ZINC000463885987 877008080 /nfs/dbraw/zinc/00/80/80/877008080.db2.gz CNBOTZXCFWOIOI-PKTZIBPZSA-N 0 3 402.542 4.269 20 0 HIADHN Cn1cc(N2CCC[C@H](N[C@@H](CCCc3ccccc3)c3ccccc3)C2=O)cn1 ZINC000463900040 877022322 /nfs/dbraw/zinc/02/23/22/877022322.db2.gz ZAEFIWVHKDNYKR-ZEQRLZLVSA-N 0 3 402.542 4.269 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)NCCc3c[nH]c4ccc(Cl)cc34)cc2)CC1 ZINC000463902524 877025353 /nfs/dbraw/zinc/02/53/53/877025353.db2.gz TVKSCZRHHLRUMK-UHFFFAOYSA-N 0 3 424.976 4.324 20 0 HIADHN O=C1[C@@H](N2CCC(c3ccc(O)cc3)CC2)CCCN1Cc1ccc(F)cc1F ZINC000469044428 883114823 /nfs/dbraw/zinc/11/48/23/883114823.db2.gz RBVIKEDAJIUZCK-QFIPXVFZSA-N 0 3 400.469 4.041 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@@H](C)c1cn(C(C)(C)C)nc1C)c1ccsc1 ZINC000464136539 877299417 /nfs/dbraw/zinc/29/94/17/877299417.db2.gz BNMLDSLDFONCRL-HNAYVOBHSA-N 0 3 405.612 4.451 20 0 HIADHN COc1cc(NC(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)ccc1OC(C)C ZINC000464465467 877688122 /nfs/dbraw/zinc/68/81/22/877688122.db2.gz YRAMCRLJVUKAHQ-UHFFFAOYSA-N 0 3 411.546 4.265 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3scnc3C3CC3)c(OCC)c2)CC1 ZINC000464499645 877720129 /nfs/dbraw/zinc/72/01/29/877720129.db2.gz NLQRVMFPTFFLPJ-UHFFFAOYSA-N 0 3 414.575 4.204 20 0 HIADHN COc1ccc(-c2ncc(C(=O)N(CC(C)C)C3CCN(C)CC3)s2)cc1OC ZINC000464569436 877789151 /nfs/dbraw/zinc/78/91/51/877789151.db2.gz JIBMNRVIQLVYCK-UHFFFAOYSA-N 0 3 417.575 4.020 20 0 HIADHN COc1cc(-n2cccc2)c(Cl)cc1C(=O)N(CC(C)C)C1CCN(C)CC1 ZINC000464578377 877802620 /nfs/dbraw/zinc/80/26/20/877802620.db2.gz UPQOZDHSAFZGGW-UHFFFAOYSA-N 0 3 403.954 4.332 20 0 HIADHN CCCN(CCc1cccs1)CC(=O)N1CCC[C@@H]1c1ccc(OC)c(OC)c1 ZINC000464588838 877813333 /nfs/dbraw/zinc/81/33/33/877813333.db2.gz SZTZSBAZBVSRGD-HXUWFJFHSA-N 0 3 416.587 4.384 20 0 HIADHN CCN(CC)Cc1cccc(NC(=O)CCC(=O)c2ccc3c(c2)CCC(=O)N3)c1 ZINC000464650520 877871226 /nfs/dbraw/zinc/87/12/26/877871226.db2.gz QNYAGRLRHBRLOL-UHFFFAOYSA-N 0 3 407.514 4.015 20 0 HIADHN Cc1cccc(S(=O)(=O)CCCN(C)[C@H]2CCN(Cc3ccccc3)[C@@H](C)C2)c1 ZINC000464680402 877896645 /nfs/dbraw/zinc/89/66/45/877896645.db2.gz ZKZDUYMAONFDBC-GMAHTHKFSA-N 0 3 414.615 4.144 20 0 HIADHN Cc1nsc(N2CCCN(CCCCOc3cccc(C(F)(F)F)c3)CC2)n1 ZINC000464764456 878005898 /nfs/dbraw/zinc/00/58/98/878005898.db2.gz VVOLXNYOAVSHFW-UHFFFAOYSA-N 0 3 414.497 4.237 20 0 HIADHN CCS[C@@H]1CC[C@H](N(C)CC(=O)N[C@H](c2ccc3c(c2)OCCCO3)C(C)C)C1 ZINC000464766543 878009541 /nfs/dbraw/zinc/00/95/41/878009541.db2.gz ALKSAJHDZNHPTI-YYDVJCTNSA-N 0 3 420.619 4.267 20 0 HIADHN CCN(CC(=O)Nc1ccc(C(=O)N(C)C)cc1)[C@@H](Cc1ccc(F)cc1)C(C)C ZINC000464768466 878011254 /nfs/dbraw/zinc/01/12/54/878011254.db2.gz ASALOIXLWZZZFC-QFIPXVFZSA-N 0 3 413.537 4.055 20 0 HIADHN CC(C)[C@@H](Cc1ccc(F)cc1)N(C)Cc1nc2c(cnn2-c2ccccc2)c(=O)[nH]1 ZINC000464784942 878032295 /nfs/dbraw/zinc/03/22/95/878032295.db2.gz ADSNGVYBTGHIOH-OAQYLSRUSA-N 0 3 419.504 4.359 20 0 HIADHN CC(C)[C@@H](Cc1ccc(F)cc1)[N@H+](C)Cc1nc2c(cnn2-c2ccccc2)c(=O)[n-]1 ZINC000464784942 878032318 /nfs/dbraw/zinc/03/23/18/878032318.db2.gz ADSNGVYBTGHIOH-OAQYLSRUSA-N 0 3 419.504 4.359 20 0 HIADHN CC(C)[C@@H](Cc1ccc(F)cc1)[N@@H+](C)Cc1nc2c(cnn2-c2ccccc2)c(=O)[n-]1 ZINC000464784942 878032334 /nfs/dbraw/zinc/03/23/34/878032334.db2.gz ADSNGVYBTGHIOH-OAQYLSRUSA-N 0 3 419.504 4.359 20 0 HIADHN C[C@@H]1CCCN1CC(=O)N[C@@H](c1ccccc1)c1ccc2[nH]c(C(F)(F)F)nc2c1 ZINC000464840377 878107878 /nfs/dbraw/zinc/10/78/78/878107878.db2.gz UODXDGWEBKBQSB-VLIAUNLRSA-N 0 3 416.447 4.272 20 0 HIADHN C[C@@H]1CCCN1CC(=O)N[C@@H](c1ccccc1)c1ccc2nc(C(F)(F)F)[nH]c2c1 ZINC000464840377 878107889 /nfs/dbraw/zinc/10/78/89/878107889.db2.gz UODXDGWEBKBQSB-VLIAUNLRSA-N 0 3 416.447 4.272 20 0 HIADHN C[C@@H]1CCN(Cc2nc3c4ccccc4oc3c(=O)[n-]2)CC[N@@H+]1Cc1ccccc1 ZINC000464842144 878112771 /nfs/dbraw/zinc/11/27/71/878112771.db2.gz YSDYSKRCROWDBN-QGZVFWFLSA-N 0 3 402.498 4.178 20 0 HIADHN C[C@@H]1CCN(Cc2nc3c4ccccc4oc3c(=O)[n-]2)CC[N@H+]1Cc1ccccc1 ZINC000464842144 878112774 /nfs/dbraw/zinc/11/27/74/878112774.db2.gz YSDYSKRCROWDBN-QGZVFWFLSA-N 0 3 402.498 4.178 20 0 HIADHN CC[C@@H]1c2ccsc2CCN1C(=O)CN1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC000464849435 878122776 /nfs/dbraw/zinc/12/27/76/878122776.db2.gz ZERSHLBDXROLMI-DENIHFKCSA-N 0 3 411.615 4.180 20 0 HIADHN Cc1nn(CC(C)C)c(C)c1CCC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC000464894544 878199328 /nfs/dbraw/zinc/19/93/28/878199328.db2.gz LSHAARQOQLKFPO-HXUWFJFHSA-N 0 3 410.606 4.212 20 0 HIADHN Cc1cc(C(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)c2cnn(C(C)C)c2n1 ZINC000464903361 878217021 /nfs/dbraw/zinc/21/70/21/878217021.db2.gz DGXNRFQCBBVJEM-IBGZPJMESA-N 0 3 405.546 4.057 20 0 HIADHN Cc1cc(C)n(-c2ccc(C(=O)N3CC[C@@H](C)N(Cc4ccccc4)CC3)cc2)n1 ZINC000464906186 878219015 /nfs/dbraw/zinc/21/90/15/878219015.db2.gz MFCDQEKEMGYFTB-HXUWFJFHSA-N 0 3 402.542 4.226 20 0 HIADHN C[C@@H]1CCN(C(=O)Cc2ccc(OC(F)(F)F)cc2)CCN1Cc1ccccc1 ZINC000464904893 878219228 /nfs/dbraw/zinc/21/92/28/878219228.db2.gz HWDRBMQGLNDGFL-QGZVFWFLSA-N 0 3 406.448 4.251 20 0 HIADHN C[C@@H]1CCN(C(=O)Cc2ccccc2Br)CCN1Cc1ccccc1 ZINC000464912779 878231238 /nfs/dbraw/zinc/23/12/38/878231238.db2.gz XLEDYUSJQCTUJG-QGZVFWFLSA-N 0 3 401.348 4.115 20 0 HIADHN CCOc1ccc(C(=O)CCC(=O)N(C)C[C@@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000464972926 878314039 /nfs/dbraw/zinc/31/40/39/878314039.db2.gz OHWPQPPTGBRMFS-NRFANRHFSA-N 0 3 408.542 4.029 20 0 HIADHN C[C@H](NC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1)c1cccc(-n2cccn2)c1 ZINC000465206233 878613686 /nfs/dbraw/zinc/61/36/86/878613686.db2.gz NGHNPKUQIBEWLA-RXVVDRJESA-N 0 3 406.505 4.101 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N(CCc2ccc(F)cc2)C2CCCC2)CC1 ZINC000465282292 878719330 /nfs/dbraw/zinc/71/93/30/878719330.db2.gz CJHDQQJNKKCYQL-UHFFFAOYSA-N 0 3 419.585 4.212 20 0 HIADHN CC1CCN([C@@H](CNC(=O)N2CCCC3(CCOCC3)C2)c2cccs2)CC1 ZINC000465421460 878851427 /nfs/dbraw/zinc/85/14/27/878851427.db2.gz GQDRQLGYGQLULJ-IBGZPJMESA-N 0 3 405.608 4.123 20 0 HIADHN O=C(NCc1ccc(-c2cccnc2)cc1)NC[C@H](c1cccs1)N1CCCC1 ZINC000465425218 878854181 /nfs/dbraw/zinc/85/41/81/878854181.db2.gz QQFVSEHSYQMNTL-OAQYLSRUSA-N 0 3 406.555 4.446 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)N[C@H](C)c2ccc(-n3cccn3)cc2)N(C)C)cc1 ZINC000465426161 878855982 /nfs/dbraw/zinc/85/59/82/878855982.db2.gz ROCJDXZNRAITGZ-WZONZLPQSA-N 0 3 405.546 4.098 20 0 HIADHN CC[C@H](NC(=O)NC[C@H](c1cccs1)N1CCC(C)CC1)c1c(C)nn(C)c1C ZINC000465427551 878858164 /nfs/dbraw/zinc/85/81/64/878858164.db2.gz YJDLLAXZYSIFHC-RBUKOAKNSA-N 0 3 417.623 4.322 20 0 HIADHN CC[C@H](NC(=O)N[C@H]1CCN(Cc2ccccc2)C1)c1nc(C(F)(F)F)cs1 ZINC000465430410 878861708 /nfs/dbraw/zinc/86/17/08/878861708.db2.gz HPARWALFBQZFPW-GJZGRUSLSA-N 0 3 412.481 4.187 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N[C@@H](C)c2nc(C3CCCCC3)no2)N(C)C)cc1 ZINC000465431219 878863744 /nfs/dbraw/zinc/86/37/44/878863744.db2.gz JYAXTHNUPRGFKC-JXFKEZNVSA-N 0 3 413.566 4.343 20 0 HIADHN CCN(Cc1cccc(-c2ccncc2)c1)C(=O)NC[C@@H](Cc1ccccc1)N(C)C ZINC000465433617 878864670 /nfs/dbraw/zinc/86/46/70/878864670.db2.gz NXZKFUZWUVCMCJ-RUZDIDTESA-N 0 3 416.569 4.453 20 0 HIADHN CO[C@H](CNC(=O)NC[C@H](c1ccccc1)N1CCCC1)c1cccc(Cl)c1 ZINC000465432629 878865425 /nfs/dbraw/zinc/86/54/25/878865425.db2.gz YANFPAFTENMXEF-NHCUHLMSSA-N 0 3 401.938 4.164 20 0 HIADHN C[C@@H](NC(=O)NC[C@H](c1ccccc1)N1CCCC1)c1cccc(-n2cccn2)c1 ZINC000465447655 878879412 /nfs/dbraw/zinc/87/94/12/878879412.db2.gz ZECCVAABYXIHBL-AUSIDOKSSA-N 0 3 403.530 4.070 20 0 HIADHN COc1cccc([C@@H](CNC(=O)N[C@H](C)c2c(F)cccc2OC)N2CCCC2)c1 ZINC000465467145 878901538 /nfs/dbraw/zinc/90/15/38/878901538.db2.gz OBEVYXXZIAZYNA-OXQOHEQNSA-N 0 3 415.509 4.040 20 0 HIADHN COc1ccc([C@@H](NC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)C2CC2)cc1 ZINC000465475062 878912624 /nfs/dbraw/zinc/91/26/24/878912624.db2.gz VAQRNOWYDXQVJM-DVECYGJZSA-N 0 3 407.558 4.452 20 0 HIADHN C[C@@H]1CCN(C(=O)NCc2coc(-c3cccs3)n2)CCN1Cc1ccccc1 ZINC000465483172 878923311 /nfs/dbraw/zinc/92/33/11/878923311.db2.gz LOKXPKYPLRBDAZ-QGZVFWFLSA-N 0 3 410.543 4.209 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N[C@H](c1ncc(C)s1)C1CC1)c1cccc(OC)c1 ZINC000465504786 878942012 /nfs/dbraw/zinc/94/20/12/878942012.db2.gz SGCRTRBITSMLKX-PMACEKPBSA-N 0 3 416.591 4.294 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@@H](C)c1cccc(-n2cccn2)c1)c1ccsc1 ZINC000465520236 878968501 /nfs/dbraw/zinc/96/85/01/878968501.db2.gz ABFNKTOFCHPYCO-LAUBAEHRSA-N 0 3 411.575 4.377 20 0 HIADHN CC[C@@H](CNC(=O)N[C@H](C)c1cccc(-n2cccn2)c1)N1CCc2ccccc2C1 ZINC000465535352 878994787 /nfs/dbraw/zinc/99/47/87/878994787.db2.gz AWJAMPJDBGUFRA-XXBNENTESA-N 0 3 417.557 4.069 20 0 HIADHN CC[C@@H](CNC(=O)N1CC[C@@H](COCc2ccccc2)C1)N1CCc2ccccc2C1 ZINC000465537021 878996702 /nfs/dbraw/zinc/99/67/02/878996702.db2.gz GEGBEDICCGTBDA-RDGATRHJSA-N 0 3 421.585 4.072 20 0 HIADHN CCCC(=O)Nc1ccc(CNC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)cc1 ZINC000465537182 878999157 /nfs/dbraw/zinc/99/91/57/878999157.db2.gz DQIGGWUJZCQJMU-HXUWFJFHSA-N 0 3 422.573 4.231 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)N3CCCC(C)(C)CC3)CC2)c1 ZINC000465548099 879012020 /nfs/dbraw/zinc/01/20/20/879012020.db2.gz QPQSMRVWDKSLOM-UHFFFAOYSA-N 0 3 400.611 4.119 20 0 HIADHN C[C@@H]1CCN(C(=O)NCCCN2CCN(C)C[C@H]2c2ccccc2)[C@H](c2ccco2)C1 ZINC000465588806 879069792 /nfs/dbraw/zinc/06/97/92/879069792.db2.gz DPKFVLNCHBGOGL-PUHATCMVSA-N 0 3 424.589 4.141 20 0 HIADHN CO[C@@H](CNC(=O)N[C@H](CN1CCCC1)c1ccccc1)c1cccc(Cl)c1 ZINC000465609353 879103941 /nfs/dbraw/zinc/10/39/41/879103941.db2.gz UCRXTRMWMOCXRE-RTWAWAEBSA-N 0 3 401.938 4.164 20 0 HIADHN C[C@H](OCCCNC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1)c1ccccc1 ZINC000465609783 879106200 /nfs/dbraw/zinc/10/62/00/879106200.db2.gz VIVDPJBZWXBHEM-YADHBBJMSA-N 0 3 409.574 4.460 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)N[C@H](c2ccc(C(C)C)cc2)C(C)C)CC1 ZINC000465638362 879154348 /nfs/dbraw/zinc/15/43/48/879154348.db2.gz VCJMTPCIAGTNRT-REWPJTCUSA-N 0 3 402.627 4.080 20 0 HIADHN C[C@@H](NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1)c1nc(C2CCCCC2)no1 ZINC000465703294 879268686 /nfs/dbraw/zinc/26/86/86/879268686.db2.gz YEPTVVQXDOETMS-XLIONFOSSA-N 0 3 411.550 4.142 20 0 HIADHN C[C@@H]1CCN(C(=O)NC[C@H]2CCCO[C@H]2c2ccccc2)CCN1Cc1ccccc1 ZINC000465730794 879312418 /nfs/dbraw/zinc/31/24/18/879312418.db2.gz WEFKEPGYRCAFQP-SDUSCBPUSA-N 0 3 421.585 4.460 20 0 HIADHN Clc1cc(CCN2CCC[C@@H](c3ncc4n3CCCC4)C2)cc2c1OCCCO2 ZINC000503436749 912444956 /nfs/dbraw/zinc/44/49/56/912444956.db2.gz OSKDOZIKXSTGSP-GOSISDBHSA-N 0 3 415.965 4.456 20 0 HIADHN Cc1ccccc1[C@@H]1CN(C(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)[C@H](C)CO1 ZINC000465752711 879342871 /nfs/dbraw/zinc/34/28/71/879342871.db2.gz JWNDBHUJTVEDPM-ADGBJGEGSA-N 0 3 407.558 4.302 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)NCc2c(F)cccc2OC(F)F)C1 ZINC000465759446 879353107 /nfs/dbraw/zinc/35/31/07/879353107.db2.gz PBCFPDUESOGLTB-GDBMZVCRSA-N 0 3 407.436 4.062 20 0 HIADHN COc1ccc(C2CCN(C(=O)N[C@H]3CCN([C@H](C)c4ccccc4)C3)CC2)cc1 ZINC000465766233 879366105 /nfs/dbraw/zinc/36/61/05/879366105.db2.gz ZHFJMFZKVRUOTL-XXBNENTESA-N 0 3 407.558 4.420 20 0 HIADHN Cc1cc(C(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)nn1-c1ccc(F)cc1F ZINC000503438693 912449235 /nfs/dbraw/zinc/44/92/35/912449235.db2.gz SMFOISDSNFEGQX-VQIMIIECSA-N 0 3 410.468 4.024 20 0 HIADHN CC(C)COC[C@@H](NC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1)c1ccco1 ZINC000465800495 879411656 /nfs/dbraw/zinc/41/16/56/879411656.db2.gz XKGZTTFYEMQWMQ-RBBKRZOGSA-N 0 3 413.562 4.299 20 0 HIADHN C[C@H](NC(=O)N(CCN(C)C)C[C@@H]1CCCO1)c1ccc(Oc2ccccc2)cc1 ZINC000465816866 879440894 /nfs/dbraw/zinc/44/08/94/879440894.db2.gz PHORXHCADCAHOR-CVDCTZTESA-N 0 3 411.546 4.292 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N2CC[C@H](COCc3ccccc3)C2)N2CCCC2)cc1 ZINC000465816202 879440913 /nfs/dbraw/zinc/44/09/13/879440913.db2.gz SBVVBAFLJNWQKU-UKILVPOCSA-N 0 3 421.585 4.380 20 0 HIADHN CCC[C@@H](NC(=O)NC[C@@H](C)CN1CCN(C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000465824985 879454229 /nfs/dbraw/zinc/45/42/29/879454229.db2.gz AMWAUNFANAVXIV-DNVCBOLYSA-N 0 3 415.409 4.017 20 0 HIADHN C[C@@H]1CCN(C(=O)N[C@@H](c2ccccc2)[C@H]2CCCO2)CCN1Cc1ccccc1 ZINC000465839953 879477873 /nfs/dbraw/zinc/47/78/73/879477873.db2.gz JMQYNIJZTDWAPW-HUVFLSCGSA-N 0 3 407.558 4.213 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@@H]2CNC(=O)NC[C@@H](C)N(C)Cc2ccccc2)cc1 ZINC000465894178 879551033 /nfs/dbraw/zinc/55/10/33/879551033.db2.gz UIHFGHMUBKRKTR-HUVFLSCGSA-N 0 3 409.574 4.282 20 0 HIADHN Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)NC(=O)N1CC[C@H](N2CC=CC2)C1 ZINC000465912524 879575273 /nfs/dbraw/zinc/57/52/73/879575273.db2.gz UPLOUEJLVUCGHG-QAPCUYQASA-N 0 3 416.978 4.489 20 0 HIADHN C[C@@H](NC(=O)NC[C@H]1CCCN1Cc1ccccc1)c1nc(C2CCCCC2)no1 ZINC000465921833 879584901 /nfs/dbraw/zinc/58/49/01/879584901.db2.gz ANTNSPKJQCUTGK-YLJYHZDGSA-N 0 3 411.550 4.142 20 0 HIADHN CCO[C@H](C)c1nc(CN(C)C(=O)NC[C@H]2CCCN2Cc2ccccc2)cs1 ZINC000465931521 879595768 /nfs/dbraw/zinc/59/57/68/879595768.db2.gz NRXJESSXNWOIQL-YLJYHZDGSA-N 0 3 416.591 4.047 20 0 HIADHN C[C@H](CNC(=O)N[C@H](CC(C)(C)C)c1ccc(Cl)cc1)CN1CCN(C)CC1 ZINC000465964866 879632783 /nfs/dbraw/zinc/63/27/83/879632783.db2.gz CRNTWQURJIYINW-YLJYHZDGSA-N 0 3 409.018 4.000 20 0 HIADHN CSc1cccc([C@@H](NC(=O)N[C@H]2CCN(C3CC3)C2)c2cc(F)ccc2F)c1 ZINC000466026327 879714027 /nfs/dbraw/zinc/71/40/27/879714027.db2.gz OAXADTOSXHZIMK-HRAATJIYSA-N 0 3 417.525 4.312 20 0 HIADHN C[C@H]1CCN(C)CCN1C(=O)NCc1ccccc1COc1ccccc1Cl ZINC000466031820 879719793 /nfs/dbraw/zinc/71/97/93/879719793.db2.gz DSSHTCRPKUFIIV-KRWDZBQOSA-N 0 3 401.938 4.155 20 0 HIADHN COc1cccc([C@@H](Cc2cc(C)cc(C)c2)NC(=O)N(C)[C@@H]2CCN(C3CC3)C2)c1 ZINC000466032973 879721485 /nfs/dbraw/zinc/72/14/85/879721485.db2.gz JRKREKYNVJEKQE-ILBGXUMGSA-N 0 3 421.585 4.474 20 0 HIADHN COc1ccc([C@@H](C)CCNC(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)cc1 ZINC000466043918 879733641 /nfs/dbraw/zinc/73/36/41/879733641.db2.gz VNMSOCSMKYKKIX-KRWDZBQOSA-N 0 3 419.516 4.240 20 0 HIADHN COc1ccccc1[C@]1(C)C[C@@H]1NC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC000466053053 879743076 /nfs/dbraw/zinc/74/30/76/879743076.db2.gz BQFCNOVJLNDFOH-VPHKFGTKSA-N 0 3 407.558 4.031 20 0 HIADHN COc1ccccc1[C@]1(C)C[C@H]1NC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC000466053051 879743849 /nfs/dbraw/zinc/74/38/49/879743849.db2.gz BQFCNOVJLNDFOH-NIDLKEISSA-N 0 3 407.558 4.031 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N[C@@H](c3ncc(C)s3)C3CC3)c(C)c2)CC1 ZINC000466121941 879835029 /nfs/dbraw/zinc/83/50/29/879835029.db2.gz ZCQQJVHPQGFNGT-HXUWFJFHSA-N 0 3 413.591 4.175 20 0 HIADHN COc1cccc(F)c1[C@H](C)NC(=O)N(CCCc1ccccc1)CCN(C)C ZINC000466125851 879840148 /nfs/dbraw/zinc/84/01/48/879840148.db2.gz VMSIWFRMUDOASY-SFHVURJKSA-N 0 3 401.526 4.101 20 0 HIADHN C[C@@H]1CCN(C)CCN1C(=O)NCc1ccc(Oc2ccccc2C(F)(F)F)nc1 ZINC000466149598 879855842 /nfs/dbraw/zinc/85/58/42/879855842.db2.gz KUOLKBXDVHIFMJ-OAHLLOKOSA-N 0 3 422.451 4.128 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NC[C@@H](C)Oc3ccccc3C)c(C)c2)CC1 ZINC000466171870 879872805 /nfs/dbraw/zinc/87/28/05/879872805.db2.gz JMLHKNFVOXFBPB-HXUWFJFHSA-N 0 3 410.562 4.034 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)N[C@@H]1COc2c1ccc(Cl)c2Cl ZINC000466203815 879894364 /nfs/dbraw/zinc/89/43/64/879894364.db2.gz KNTUXECJCBEHSV-QGZVFWFLSA-N 0 3 408.329 4.200 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)N[C@H](c1ccccc1)c1cccnc1 ZINC000503471831 912507359 /nfs/dbraw/zinc/50/73/59/912507359.db2.gz IWIXSWMRDTVNSR-BJKOFHAPSA-N 0 3 400.526 4.307 20 0 HIADHN COc1ccc([C@@H](CNC(=O)Nc2cccc(Cl)c2OC)N2CCCC2)cc1 ZINC000503472206 912508334 /nfs/dbraw/zinc/50/83/34/912508334.db2.gz JRXTYLWYGIEPKW-LJQANCHMSA-N 0 3 403.910 4.316 20 0 HIADHN C[C@H](NC(=O)N[C@H]1C[C@H](C)N(Cc2ccccc2)C1)c1ccc(NC(=O)C2CC2)cc1 ZINC000466214326 879906302 /nfs/dbraw/zinc/90/63/02/879906302.db2.gz BGBGOJMNRYMOLQ-BSRJHKFKSA-N 0 3 420.557 4.058 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)N[C@@H](c2ccccc2)c2cccnc2)CN1Cc1ccccc1 ZINC000466236590 879941318 /nfs/dbraw/zinc/94/13/18/879941318.db2.gz APATZKUSXQIRQZ-FOVJLYNBSA-N 0 3 400.526 4.133 20 0 HIADHN Cc1nc(-c2ccc(CNC(=O)N[C@H]3C[C@H](C)N(Cc4ccccc4)C3)o2)cs1 ZINC000466253334 879975744 /nfs/dbraw/zinc/97/57/44/879975744.db2.gz OPBZWNCGTWZRQS-YJBOKZPZSA-N 0 3 410.543 4.174 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)N[C@H](c2nccs2)c2ccccc2)CN1Cc1ccccc1 ZINC000466267480 880001185 /nfs/dbraw/zinc/00/11/85/880001185.db2.gz HNBRFKZCZMDEAK-QMMLZNLJSA-N 0 3 406.555 4.195 20 0 HIADHN CO[C@@H](CNC(=O)N(CCN(C)C)Cc1cccc(C)c1)c1cccc(Cl)c1 ZINC000466347866 880104970 /nfs/dbraw/zinc/10/49/70/880104970.db2.gz RVTLXOFZJJOCNL-NRFANRHFSA-N 0 3 403.954 4.109 20 0 HIADHN C[C@H](CNC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C)c1ccc(F)cc1F ZINC000466424793 880198326 /nfs/dbraw/zinc/19/83/26/880198326.db2.gz GZPPCETUUJLPEX-MSOLQXFVSA-N 0 3 401.501 4.374 20 0 HIADHN C[C@H](CNC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C)c1ccc(F)cc1F ZINC000466424795 880199138 /nfs/dbraw/zinc/19/91/38/880199138.db2.gz GZPPCETUUJLPEX-QZTJIDSGSA-N 0 3 401.501 4.374 20 0 HIADHN Brc1ccc2[nH]c(CNCc3ccccc3N3CCOCC3)cc2c1 ZINC000466476550 880258499 /nfs/dbraw/zinc/25/84/99/880258499.db2.gz ZPTAOADGXIXTKQ-UHFFFAOYSA-N 0 3 400.320 4.057 20 0 HIADHN CSc1ccc([C@H](C)NC(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)cc1 ZINC000466483162 880263715 /nfs/dbraw/zinc/26/37/15/880263715.db2.gz VNIWKGIWGBJOOK-OTWHNJEPSA-N 0 3 419.635 4.390 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)N(C)Cc2ccccc2N2CCCC2)CN1Cc1ccccc1 ZINC000466511454 880286586 /nfs/dbraw/zinc/28/65/86/880286586.db2.gz BOWCEHVCNZDACK-NFBKMPQASA-N 0 3 406.574 4.091 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)N2CCC(c3nc4ccccc4[nH]3)CC2)CN1Cc1ccccc1 ZINC000466521273 880296833 /nfs/dbraw/zinc/29/68/33/880296833.db2.gz WIQAYNZWGQYFAQ-NQIIRXRSSA-N 0 3 417.557 4.115 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)N(C)Cc2ccc(OC(F)F)cc2)CN1Cc1ccccc1 ZINC000466526956 880302933 /nfs/dbraw/zinc/30/29/33/880302933.db2.gz KXPBNXRFDQXFGK-VQIMIIECSA-N 0 3 403.473 4.092 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)N2CCC(C(F)(F)F)(C(F)(F)F)C2)CN1Cc1ccccc1 ZINC000466528998 880305638 /nfs/dbraw/zinc/30/56/38/880305638.db2.gz IZPZCMSABJNDGY-HIFRSBDPSA-N 0 3 423.401 4.176 20 0 HIADHN CCCN1CCC[C@H]1C(=O)N[C@H](C)c1cccc(NC(=O)Cc2ccccc2F)c1 ZINC000503521568 912570353 /nfs/dbraw/zinc/57/03/53/912570353.db2.gz OWJPGDJQJNYNIT-VGSWGCGISA-N 0 3 411.521 4.059 20 0 HIADHN C[C@@H](NC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C)c1cccc(-n2cccn2)c1 ZINC000466663292 880444923 /nfs/dbraw/zinc/44/49/23/880444923.db2.gz DHRYHHCJNOYXPB-NHCUHLMSSA-N 0 3 417.557 4.239 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)Nc1cc(Cl)c(Cl)cn1 ZINC000466663421 880445006 /nfs/dbraw/zinc/44/50/06/880445006.db2.gz FJIJVZKHUKQKNF-UHFFFAOYSA-N 0 3 403.260 4.262 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3cc(Cl)c(Cl)cn3)CC2)C[C@@H](C)O1 ZINC000466664214 880446301 /nfs/dbraw/zinc/44/63/01/880446301.db2.gz KFHMXFJWUOZKPK-ZIAGYGMSSA-N 0 3 415.365 4.132 20 0 HIADHN CN(C(=O)Nc1cc(Br)c(F)cc1F)[C@H]1CCN(Cc2ccccc2)C1 ZINC000466703002 880494349 /nfs/dbraw/zinc/49/43/49/880494349.db2.gz GBSIJIHQCXZVPS-AWEZNQCLSA-N 0 3 424.289 4.466 20 0 HIADHN CCCN1CCC[C@@H]1C(=O)NC[C@@H](c1c[nH]c2ccccc21)c1ccc(OC)cc1 ZINC000503526997 912579526 /nfs/dbraw/zinc/57/95/26/912579526.db2.gz IPIRRPFYVDYGHY-ZJSXRUAMSA-N 0 3 405.542 4.299 20 0 HIADHN Cc1cnn(-c2ccncc2NC(=O)c2cccc(CN(C)Cc3ccccc3)c2)c1 ZINC000503532793 912589126 /nfs/dbraw/zinc/58/91/26/912589126.db2.gz CTERVHHYNULVKS-UHFFFAOYSA-N 0 3 411.509 4.460 20 0 HIADHN Cc1noc(C2CC2)c1NC(=O)N(CCN(C)C)Cc1ccc(Br)cc1 ZINC000466918781 880687747 /nfs/dbraw/zinc/68/77/47/880687747.db2.gz SBGFEBRFPIDJEF-UHFFFAOYSA-N 0 3 421.339 4.219 20 0 HIADHN CC1CCN([C@@H](CNC(=O)Nc2cccnc2-c2cnn(C)c2)c2cccs2)CC1 ZINC000466946710 880721455 /nfs/dbraw/zinc/72/14/55/880721455.db2.gz NCBCKRHNKLQTHN-IBGZPJMESA-N 0 3 424.574 4.138 20 0 HIADHN COCCc1ccccc1NC(=O)N[C@H](CN1CCc2ccccc2C1)C(C)(C)C ZINC000466954948 880737037 /nfs/dbraw/zinc/73/70/37/880737037.db2.gz OWVBSBQLMDDYRB-HSZRJFAPSA-N 0 3 409.574 4.470 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1NC(=O)N[C@H]1C[C@H](C)N(Cc2ccccc2)C1 ZINC000466976488 880781999 /nfs/dbraw/zinc/78/19/99/880781999.db2.gz JSJNEHJULVVSOD-UWJYYQICSA-N 0 3 403.530 4.274 20 0 HIADHN COc1ccc(C)cc1NC(=O)[C@H](NC[C@]1(C)CCO[C@@H]1C1CC1)c1ccccc1 ZINC000467001885 880811457 /nfs/dbraw/zinc/81/14/57/880811457.db2.gz NIJSWCXWGVPVMK-OYRHQHFDSA-N 0 3 408.542 4.478 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)CSCc2coc(-c3ccccc3)n2)CN1Cc1ccccc1 ZINC000467021876 880822800 /nfs/dbraw/zinc/82/28/00/880822800.db2.gz GRUJTESFXKJCPQ-WIYYLYMNSA-N 0 3 421.566 4.354 20 0 HIADHN Cc1ccc(C(=O)N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)cc1NC(=O)c1ccco1 ZINC000467024039 880825060 /nfs/dbraw/zinc/82/50/60/880825060.db2.gz SFIIMUOVWCRUOI-RXVVDRJESA-N 0 3 417.509 4.233 20 0 HIADHN C[C@@H](NC(=O)N(CCN(C)C)Cc1ccc(F)cc1)c1nc(C2CCCCC2)no1 ZINC000467029932 880829392 /nfs/dbraw/zinc/82/93/92/880829392.db2.gz XJOXIMGQQQMPAQ-MRXNPFEDSA-N 0 3 417.529 4.091 20 0 HIADHN Cc1nc(COc2cccc(C(=O)N[C@H]3C[C@@H](C)N(Cc4ccccc4)C3)c2)cs1 ZINC000467034540 880833064 /nfs/dbraw/zinc/83/30/64/880833064.db2.gz PJIUYYOBNALTKS-UTKZUKDTSA-N 0 3 421.566 4.423 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(C)c1C(=O)N[C@@H]1C[C@H](C)N(Cc2ccccc2)C1 ZINC000467035327 880833469 /nfs/dbraw/zinc/83/34/69/880833469.db2.gz UTYUDIAEBNGWMD-HRAATJIYSA-N 0 3 406.505 4.021 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)N[C@@H](C)c2nc(C3CCCCC3)no2)c1 ZINC000467037348 880834606 /nfs/dbraw/zinc/83/46/06/880834606.db2.gz ZRMUCACTQIUXOF-SFHVURJKSA-N 0 3 413.566 4.260 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)c2ccc(-c3nc(C4CC4)no3)cc2)CN1Cc1ccccc1 ZINC000467039013 880836046 /nfs/dbraw/zinc/83/60/46/880836046.db2.gz TXYOSVRFDDINKT-HRAATJIYSA-N 0 3 402.498 4.007 20 0 HIADHN COc1ccc(-c2cnc(CCC(=O)N[C@@H]3C[C@H](C)N(Cc4ccccc4)C3)o2)cc1 ZINC000467053393 880843085 /nfs/dbraw/zinc/84/30/85/880843085.db2.gz IGLGPVAQEDZGDM-GHTZIAJQSA-N 0 3 419.525 4.062 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)c2cnn(C(C)(C)C)c2C(F)(F)F)CN1Cc1ccccc1 ZINC000467051729 880843228 /nfs/dbraw/zinc/84/32/28/880843228.db2.gz RHYLXJIJFOADEU-GOEBONIOSA-N 0 3 408.468 4.050 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)c2cnn(C(C)(C)C)c2C(F)(F)F)CN1Cc1ccccc1 ZINC000467051728 880843513 /nfs/dbraw/zinc/84/35/13/880843513.db2.gz RHYLXJIJFOADEU-GDBMZVCRSA-N 0 3 408.468 4.050 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)CCc2nc(-c3ccc(Cl)cc3)no2)CN1Cc1ccccc1 ZINC000467053931 880843924 /nfs/dbraw/zinc/84/39/24/880843924.db2.gz NZTAOSOZLMXXSW-OXJNMPFZSA-N 0 3 424.932 4.102 20 0 HIADHN COC[C@H]1CCCCN(CC(=O)NC[C@@H](c2c[nH]c3ccccc32)c2ccccc2)C1 ZINC000467121180 880876404 /nfs/dbraw/zinc/87/64/04/880876404.db2.gz VCDGSWOHXSVGSZ-NZQKXSOJSA-N 0 3 419.569 4.165 20 0 HIADHN COc1ccc(C(C)(C)C(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)cc1OC ZINC000467203480 880932443 /nfs/dbraw/zinc/93/24/43/880932443.db2.gz ADVRCWITHHWOQD-LJQANCHMSA-N 0 3 410.558 4.104 20 0 HIADHN Cc1nnc(-c2ccc(C(=O)NC[C@@H](c3cccs3)N3CCC(C)CC3)cc2)o1 ZINC000467247468 880972929 /nfs/dbraw/zinc/97/29/29/880972929.db2.gz GTQZUZGIWFHXES-IBGZPJMESA-N 0 3 410.543 4.310 20 0 HIADHN COC[C@@H]1CCCCN([C@H](C)C(=O)Nc2ccc3c(c2)OC2(CCCCC2)O3)C1 ZINC000467298613 881046097 /nfs/dbraw/zinc/04/60/97/881046097.db2.gz FSENUTANRQIQCQ-QZTJIDSGSA-N 0 3 402.535 4.194 20 0 HIADHN Cc1ccc(Br)cc1NC(=O)CCN[C@@H](c1cncc(F)c1)C1CC1 ZINC000467329998 881078842 /nfs/dbraw/zinc/07/88/42/881078842.db2.gz FFVBHAFPAAXKHK-LJQANCHMSA-N 0 3 406.299 4.361 20 0 HIADHN O=S(=O)(CCO)c1ccc(CN[C@@H](c2ccc(Cl)cc2)C2CCCC2)cc1 ZINC000467357200 881120542 /nfs/dbraw/zinc/12/05/42/881120542.db2.gz HKHIAKLBWTVQLQ-OAQYLSRUSA-N 0 3 407.963 4.127 20 0 HIADHN Cc1cc(CN[C@H](C)c2ccc3c(c2)OCCO3)ccc1I ZINC000467369865 881143685 /nfs/dbraw/zinc/14/36/85/881143685.db2.gz MQFMSLMWQGXONO-CYBMUJFWSA-N 0 3 409.267 4.222 20 0 HIADHN CC(C)CCOc1ccc(NC(=O)N2CCC(CN3C[C@@H](C)O[C@H](C)C3)CC2)cc1 ZINC000467371341 881145861 /nfs/dbraw/zinc/14/58/61/881145861.db2.gz UKQOAQCSLINOHC-WOJBJXKFSA-N 0 3 417.594 4.465 20 0 HIADHN Cc1cccnc1[C@@H]1CCC[C@@H](Nc2ccc3nc(CCN4CCOCC4)[nH]c3c2)C1 ZINC000467391211 881174276 /nfs/dbraw/zinc/17/42/76/881174276.db2.gz RLLDRIGZJOJTPV-WOJBJXKFSA-N 0 3 419.573 4.279 20 0 HIADHN CN(C)c1ncccc1CN[C@H](c1cccc(Br)c1)C1CCOCC1 ZINC000467399504 881181665 /nfs/dbraw/zinc/18/16/65/881181665.db2.gz FZTBZJFAASEJCU-IBGZPJMESA-N 0 3 404.352 4.168 20 0 HIADHN C[C@H](NC1CCN(c2nccs2)CC1)c1ccccc1I ZINC000467447473 881249749 /nfs/dbraw/zinc/24/97/49/881249749.db2.gz ICPFNOSKBYWBJD-LBPRGKRZSA-N 0 3 413.328 4.067 20 0 HIADHN CN(C)CCN(C(=O)Nc1ncc(Cc2ccc(F)c(F)c2)s1)C1CCCC1 ZINC000467461077 881270255 /nfs/dbraw/zinc/27/02/55/881270255.db2.gz WQHWYKCSKVLKSO-UHFFFAOYSA-N 0 3 408.518 4.350 20 0 HIADHN CCc1nnc(-c2ccc(NC(=O)N[C@H]3C[C@H](C)N(Cc4ccccc4)C3)cc2)o1 ZINC000467470958 881287957 /nfs/dbraw/zinc/28/79/57/881287957.db2.gz BBVADMHKRVWZGG-JXFKEZNVSA-N 0 3 405.502 4.084 20 0 HIADHN CCc1nnc(-c2ccc(NC(=O)N[C@@H]3C[C@@H](C)N(Cc4ccccc4)C3)cc2)o1 ZINC000467470960 881288051 /nfs/dbraw/zinc/28/80/51/881288051.db2.gz BBVADMHKRVWZGG-OXQOHEQNSA-N 0 3 405.502 4.084 20 0 HIADHN Cc1ccnc(Oc2ccc(NC(=O)N[C@H]3C[C@H](C)N(Cc4ccccc4)C3)cc2)n1 ZINC000467478964 881300873 /nfs/dbraw/zinc/30/08/73/881300873.db2.gz VXTZCWYZHOMNIB-RXVVDRJESA-N 0 3 417.513 4.362 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)CCCC(=O)c1ccc(C)cc1 ZINC000467512567 881327866 /nfs/dbraw/zinc/32/78/66/881327866.db2.gz IJOSSBVIOZGGHC-QHCPKHFHSA-N 0 3 407.558 4.256 20 0 HIADHN Cc1cc(NC(=O)CCN2CCN(c3ccccc3)CC2)ccc1OCC(F)(F)F ZINC000469084561 883171447 /nfs/dbraw/zinc/17/14/47/883171447.db2.gz XVMXMSAVXMPZDK-UHFFFAOYSA-N 0 3 421.463 4.087 20 0 HIADHN CCN1CC[C@H](N(C)S(=O)(=O)c2cc(Cl)ccc2OCC2CCC2)C[C@@H]1C ZINC000469339010 883452060 /nfs/dbraw/zinc/45/20/60/883452060.db2.gz SOVXSLBUJVNBHQ-YJBOKZPZSA-N 0 3 414.999 4.012 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)N[C@H](c1ccccc1)[C@@H]1CCOC1 ZINC000469428909 883612977 /nfs/dbraw/zinc/61/29/77/883612977.db2.gz WZNHFIDEVOFEEK-TZRRMPRUSA-N 0 3 409.574 4.220 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)NCc1nc(C(F)(F)F)cs1 ZINC000469435849 883624102 /nfs/dbraw/zinc/62/41/02/883624102.db2.gz GZTBTYVIYXKAIV-HNNXBMFYSA-N 0 3 414.497 4.118 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)Cc1coc(-c2ccc(F)cc2)n1 ZINC000469485247 883718977 /nfs/dbraw/zinc/71/89/77/883718977.db2.gz DPBLMEXVFDUGBF-JOCHJYFZSA-N 0 3 409.505 4.296 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)c1cccc(COC2CCOCC2)c1 ZINC000469504792 883751861 /nfs/dbraw/zinc/75/18/61/883751861.db2.gz KCVRWJVTAIOYMO-VWLOTQADSA-N 0 3 424.585 4.269 20 0 HIADHN Cc1cc(Br)cc(C)c1NC(=O)CCCN[C@@H](CCO)c1ccco1 ZINC000469526889 883799275 /nfs/dbraw/zinc/79/92/75/883799275.db2.gz HTKGCAYPQCSLDS-INIZCTEOSA-N 0 3 409.324 4.091 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)C3CCC(C(F)(F)F)CC3)CC2)C[C@@H](C)O1 ZINC000469530930 883801880 /nfs/dbraw/zinc/80/18/80/883801880.db2.gz KJBJCAGYXYSBJH-FDCMFXBMSA-N 0 3 404.517 4.093 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)Nc1ccc(O[C@@H]2CCOC2)cc1 ZINC000469648675 883847967 /nfs/dbraw/zinc/84/79/67/883847967.db2.gz CRKFPDQQTQBFHC-DHIUTWEWSA-N 0 3 411.546 4.132 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)Nc1ccccc1O[C@H]1CCOC1 ZINC000469661244 883855322 /nfs/dbraw/zinc/85/53/22/883855322.db2.gz MAKHTGLSTFOHPB-UNMCSNQZSA-N 0 3 411.546 4.132 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)Nc1ccc2c(c1)CCCC(=O)N2 ZINC000469661309 883855799 /nfs/dbraw/zinc/85/57/99/883855799.db2.gz NERQGIQPLJUJGA-QFIPXVFZSA-N 0 3 408.546 4.240 20 0 HIADHN CC(C)(C)OC1CCN(C(=O)Nc2ccc(CCN3CCSCC3)cc2)CC1 ZINC000469683171 883868302 /nfs/dbraw/zinc/86/83/02/883868302.db2.gz KWSRLUYENCNBAT-UHFFFAOYSA-N 0 3 405.608 4.089 20 0 HIADHN CCN(C(=O)c1ccc2nnc(C(C)(C)C)n2c1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000469710010 883882343 /nfs/dbraw/zinc/88/23/43/883882343.db2.gz NAQIRDDMHDTDCT-GHTZIAJQSA-N 0 3 419.573 4.324 20 0 HIADHN CCc1nc(C)c([C@H](C)N(C)C(=O)CCN2CCN(c3cccc(C)c3)CC2)s1 ZINC000469744014 883899834 /nfs/dbraw/zinc/89/98/34/883899834.db2.gz FRJMIGIBEUVRAB-IBGZPJMESA-N 0 3 414.619 4.054 20 0 HIADHN CC(=O)Nc1ccc(Cl)c(C(=O)N[C@@H](CN(C)Cc2ccccc2)C(C)C)c1 ZINC000469770707 883944394 /nfs/dbraw/zinc/94/43/94/883944394.db2.gz VYSPSHSCQDZJNC-NRFANRHFSA-N 0 3 401.938 4.185 20 0 HIADHN CC(C)n1cc(C(=O)Nc2cccc(N3CCN(CCc4ccccc4)CC3)c2)cn1 ZINC000469800352 883973913 /nfs/dbraw/zinc/97/39/13/883973913.db2.gz MMMXNRUBDUSCLV-UHFFFAOYSA-N 0 3 417.557 4.081 20 0 HIADHN COc1ccc(NC(C)=O)cc1NC(=O)[C@H](C)N1CCCC2(CCCCC2)CC1 ZINC000469861803 884047552 /nfs/dbraw/zinc/04/75/52/884047552.db2.gz BGOKHJHZNGTYJS-KRWDZBQOSA-N 0 3 401.551 4.417 20 0 HIADHN Cc1csc(-c2cccc(C(=O)NC[C@@H]3CN(Cc4ccccc4)CCCO3)c2)n1 ZINC000469869764 884060192 /nfs/dbraw/zinc/06/01/92/884060192.db2.gz GHWICRYUCYMSDQ-JOCHJYFZSA-N 0 3 421.566 4.139 20 0 HIADHN Cc1nc(-c2ccccc2)sc1C(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000469871683 884060868 /nfs/dbraw/zinc/06/08/68/884060868.db2.gz NPLKZTAZFRNKKX-OAQYLSRUSA-N 0 3 421.566 4.139 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N3CCSC[C@@H]3c3ccc(C)cc3)cc2)CC1 ZINC000469896938 884087063 /nfs/dbraw/zinc/08/70/63/884087063.db2.gz KVZQRMQQMJXRQJ-HSZRJFAPSA-N 0 3 409.599 4.067 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)N1CCC(CN2CCc3ccccc32)CC1 ZINC000469980683 884194399 /nfs/dbraw/zinc/19/43/99/884194399.db2.gz FLRQBUMMKXPXHN-UHFFFAOYSA-N 0 3 417.553 4.409 20 0 HIADHN CCCOc1ccc(C(F)(F)F)cc1NC(=O)N(CCN(C)C)Cc1ccccn1 ZINC000503695049 912799333 /nfs/dbraw/zinc/79/93/33/912799333.db2.gz JUBAJLDATUCFOZ-UHFFFAOYSA-N 0 3 424.467 4.485 20 0 HIADHN CC(C)[C@H](NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1)c1nc2ccccc2[nH]1 ZINC000503698149 912802087 /nfs/dbraw/zinc/80/20/87/912802087.db2.gz IESFMRZWRNZLQW-UGKGYDQZSA-N 0 3 405.546 4.224 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@@H]2NC(=O)NC[C@@H]2CCCN2Cc2ccccc2)cc1 ZINC000470023861 884242489 /nfs/dbraw/zinc/24/24/89/884242489.db2.gz GINLYTNDHUOEKC-HJOGWXRNSA-N 0 3 407.558 4.179 20 0 HIADHN CCCN(C(=O)N[C@H](CC)C1CCOCC1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470026678 884248395 /nfs/dbraw/zinc/24/83/95/884248395.db2.gz GNSJPYLOWBVOMD-DHIUTWEWSA-N 0 3 401.595 4.278 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N[C@@H](C)c1ccccc1-n1cccn1)c1ccsc1 ZINC000470040303 884281017 /nfs/dbraw/zinc/28/10/17/884281017.db2.gz BJKLJMBXVRSCGW-UWJYYQICSA-N 0 3 411.575 4.377 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@@H]2NC(=O)N(CCN(C)C)Cc2ccc(F)cc2)cc1 ZINC000470048517 884292399 /nfs/dbraw/zinc/29/23/99/884292399.db2.gz WYOWMZRLPRKTEM-GOTSBHOMSA-N 0 3 413.537 4.128 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@@H]2NC(=O)NC[C@@H](c2ccccc2)N2CCCC2)cc1 ZINC000470062893 884314943 /nfs/dbraw/zinc/31/49/43/884314943.db2.gz SQGBJYXZVRDKBX-HJOGWXRNSA-N 0 3 407.558 4.351 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@@H]2NC(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)cc1 ZINC000470071102 884326758 /nfs/dbraw/zinc/32/67/58/884326758.db2.gz IATOXEMZAYNHPL-JFTIXFDTSA-N 0 3 407.558 4.350 20 0 HIADHN COc1cc(SC)ccc1NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000470119461 884380825 /nfs/dbraw/zinc/38/08/25/884380825.db2.gz BTNPZJSWUYYOIA-UHFFFAOYSA-N 0 3 417.497 4.344 20 0 HIADHN NC(=O)c1ccc(CN(Cc2cc(Br)cc3cccnc32)C2CC2)cc1 ZINC000470186115 884476273 /nfs/dbraw/zinc/47/62/73/884476273.db2.gz OWSXCFBBRLOFCR-UHFFFAOYSA-N 0 3 410.315 4.261 20 0 HIADHN CC[C@H]1CN(C(=O)c2ccc(N3CCN(CC)CC3)cc2)CC[C@H]1c1ccccc1 ZINC000470192865 884495746 /nfs/dbraw/zinc/49/57/46/884495746.db2.gz CWWSXDIUYHECBX-SQJMNOBHSA-N 0 3 405.586 4.484 20 0 HIADHN CC(C)[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)Nc1cccc(CN(C)C)c1 ZINC000503860062 912844013 /nfs/dbraw/zinc/84/40/13/912844013.db2.gz SEPKNLHZHVYEGJ-QFIPXVFZSA-N 0 3 409.574 4.439 20 0 HIADHN COc1cccc(C[C@@H](NCC(=O)N[C@@H]2CCOc3ccccc32)c2ccccc2)c1 ZINC000503858807 912844446 /nfs/dbraw/zinc/84/44/46/912844446.db2.gz LQJFZZJRKWSAPJ-DNQXCXABSA-N 0 3 416.521 4.209 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)N(CCc1nccs1)C(C)C ZINC000470300478 884674006 /nfs/dbraw/zinc/67/40/06/884674006.db2.gz YFSGBTUHQIJMEU-FQEVSTJZSA-N 0 3 402.608 4.262 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1ccccc1O[C@H]1CCOC1)c1ccsc1 ZINC000470300270 884674727 /nfs/dbraw/zinc/67/47/27/884674727.db2.gz YSIHAOIUAQLJMD-PKOBYXMFSA-N 0 3 403.548 4.120 20 0 HIADHN CCN(C(=O)c1cc(OC)c(OC)cc1F)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000470341315 884728200 /nfs/dbraw/zinc/72/82/00/884728200.db2.gz ZOAHJVNUCRVMFA-AEFFLSMTSA-N 0 3 400.494 4.141 20 0 HIADHN Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)N1CCCN([C@H](C)CO)CC1 ZINC000470349024 884740148 /nfs/dbraw/zinc/74/01/48/884740148.db2.gz CWKDGRZHGDSRQT-UXHICEINSA-N 0 3 411.546 4.055 20 0 HIADHN CC1(C)[C@H](C(F)(F)F)CCN1C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000470349865 884742359 /nfs/dbraw/zinc/74/23/59/884742359.db2.gz OSIYZLQMFBSGJT-QGZVFWFLSA-N 0 3 415.525 4.473 20 0 HIADHN Cc1c([C@H](C)N[C@H]2CCCC23CCOCC3)nnn1-c1cccc(Br)c1 ZINC000503911534 912861494 /nfs/dbraw/zinc/86/14/94/912861494.db2.gz PHEQZXNJIFQNCZ-KSSFIOAISA-N 0 3 419.367 4.338 20 0 HIADHN C[C@H](CO)N1CCCN(C(=O)Nc2ccc([C@H](C)Sc3ccccc3)cc2)CC1 ZINC000470408997 884812567 /nfs/dbraw/zinc/81/25/67/884812567.db2.gz PEJRDNMSZYNVMX-MOPGFXCFSA-N 0 3 413.587 4.460 20 0 HIADHN C[C@@H]1CN(C2CCOCC2)CCN1C(=O)CCCc1cc(Cl)sc1Cl ZINC000470504724 884893421 /nfs/dbraw/zinc/89/34/21/884893421.db2.gz YMCDQIIUZYPACY-CYBMUJFWSA-N 0 3 405.391 4.089 20 0 HIADHN CCN(CC1CCN(c2ccccn2)CC1)C(=O)c1ccc(Nc2ccncc2)cc1 ZINC000470515530 884905683 /nfs/dbraw/zinc/90/56/83/884905683.db2.gz CCVPIQGEFKZGQY-UHFFFAOYSA-N 0 3 415.541 4.021 20 0 HIADHN COC[C@@H](C)Oc1ccc(Cl)cc1NC(=O)N1CCN(C2CCCCC2)CC1 ZINC000470517887 884907638 /nfs/dbraw/zinc/90/76/38/884907638.db2.gz CSBNQLBFBAZGAD-MRXNPFEDSA-N 0 3 409.958 4.236 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3cccc(Oc4ccccn4)c3)cc2)CC1 ZINC000470532908 884932708 /nfs/dbraw/zinc/93/27/08/884932708.db2.gz XURDRLLSILNGPE-UHFFFAOYSA-N 0 3 402.498 4.268 20 0 HIADHN COC[C@@H](C)Oc1ccc(Cl)cc1NC(=O)NC[C@H](c1ccccc1)N(C)C ZINC000470535071 884935566 /nfs/dbraw/zinc/93/55/66/884935566.db2.gz XUXKBNVWRXJTHS-DNVCBOLYSA-N 0 3 405.926 4.178 20 0 HIADHN C/C(=C/c1ccccc1C(F)(F)F)CN(C)[C@H](C)c1ccc(S(N)(=O)=O)cc1 ZINC000503951231 912880484 /nfs/dbraw/zinc/88/04/84/912880484.db2.gz FGHJNIZLHRKRET-IKESIWSLSA-N 0 3 412.477 4.449 20 0 HIADHN C/C(=C/c1ccccc1C(F)(F)F)CN(C)[C@@H](C)c1cccc(S(N)(=O)=O)c1 ZINC000503957124 912883406 /nfs/dbraw/zinc/88/34/06/912883406.db2.gz DXWXZZGHMPUEJY-SZGZABIGSA-N 0 3 412.477 4.449 20 0 HIADHN COc1cc(C(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)ccc1OC(F)F ZINC000470654317 885076541 /nfs/dbraw/zinc/07/65/41/885076541.db2.gz QAVHMKRNQRXQSD-SFHVURJKSA-N 0 3 404.457 4.033 20 0 HIADHN Cc1cc(C)n(Cc2ccc(C(=O)N(C)[C@H]3CCCN(Cc4ccccc4)C3)cc2)n1 ZINC000470655797 885077625 /nfs/dbraw/zinc/07/76/25/885077625.db2.gz CDSQRSXOKWVJIE-VWLOTQADSA-N 0 3 416.569 4.285 20 0 HIADHN CC[C@H](C)n1ncc2c1nc(C)cc2C(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470656354 885078168 /nfs/dbraw/zinc/07/81/68/885078168.db2.gz HGYJELALZWJHLG-FPOVZHCZSA-N 0 3 419.573 4.447 20 0 HIADHN CN(C(=O)c1cc(-c2ccccc2Cl)n[nH]1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470661277 885086956 /nfs/dbraw/zinc/08/69/56/885086956.db2.gz FAKOKUFIFQFIEG-SFHVURJKSA-N 0 3 408.933 4.467 20 0 HIADHN Cc1c(C(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)cnn1-c1cccc(C)c1 ZINC000470675706 885107284 /nfs/dbraw/zinc/10/72/84/885107284.db2.gz TZQYILBHTIGHNR-HSZRJFAPSA-N 0 3 402.542 4.226 20 0 HIADHN CC(C)C(=O)N(C)Cc1ccc(C(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000470682624 885116358 /nfs/dbraw/zinc/11/63/58/885116358.db2.gz MYFQANGNOYRRSA-DEOSSOPVSA-N 0 3 421.585 4.038 20 0 HIADHN CN(C(=O)NCc1ccccc1Br)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470719864 885163984 /nfs/dbraw/zinc/16/39/84/885163984.db2.gz MLHQYTYXFQICHD-LJQANCHMSA-N 0 3 416.363 4.255 20 0 HIADHN COCC[C@@H](NC(=O)NC[C@H](c1cccs1)N1CCC(C)CC1)c1ccco1 ZINC000503999073 912904608 /nfs/dbraw/zinc/90/46/08/912904608.db2.gz IIEDTSFHKWKSGO-QZTJIDSGSA-N 0 3 405.564 4.191 20 0 HIADHN C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470723143 885171154 /nfs/dbraw/zinc/17/11/54/885171154.db2.gz NWJJXIIHCUTYRA-DENIHFKCSA-N 0 3 423.557 4.042 20 0 HIADHN COc1ccccc1C1(CNC(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)CC1 ZINC000470733107 885187741 /nfs/dbraw/zinc/18/77/41/885187741.db2.gz PQTNZQVNSPJCLI-NRFANRHFSA-N 0 3 407.558 4.033 20 0 HIADHN CN(C(=O)NCc1ccc(Br)s1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470734661 885189583 /nfs/dbraw/zinc/18/95/83/885189583.db2.gz XNNFGRQPKLGKJE-MRXNPFEDSA-N 0 3 422.392 4.317 20 0 HIADHN COc1ccc([C@@H](NC(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)C2CC2)cc1 ZINC000470740996 885203000 /nfs/dbraw/zinc/20/30/00/885203000.db2.gz RXFPIZXMBVPEHP-VWNXMTODSA-N 0 3 407.558 4.452 20 0 HIADHN Cc1nc2ccccc2n1CCCNC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470741106 885203306 /nfs/dbraw/zinc/20/33/06/885203306.db2.gz SYQQKAQXCLULMD-JOCHJYFZSA-N 0 3 419.573 4.041 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)c2cccc(NC(=O)C3CCCCC3)c2)o1 ZINC000504011758 912918630 /nfs/dbraw/zinc/91/86/30/912918630.db2.gz XMTYRQYEMHDABP-UHFFFAOYSA-N 0 3 411.546 4.311 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)COC(c2ccccc2)c2ccccc2)o1 ZINC000504011336 912918790 /nfs/dbraw/zinc/91/87/90/912918790.db2.gz SKSARNKXZGLBGB-UHFFFAOYSA-N 0 3 406.526 4.284 20 0 HIADHN CN(Cc1ccccc1Oc1cccnc1)C[C@@H]1C[C@H](F)CN1Cc1nccs1 ZINC000470817123 885304282 /nfs/dbraw/zinc/30/42/82/885304282.db2.gz NGIATTILJUJCRS-OALUTQOASA-N 0 3 412.534 4.375 20 0 HIADHN Cn1nc(C(F)F)c2cc(C(=O)N3C[C@H]4CCCN4Cc4ccccc43)sc21 ZINC000470848095 885345639 /nfs/dbraw/zinc/34/56/39/885345639.db2.gz KBYTXUHDTQGTEC-CYBMUJFWSA-N 0 3 402.470 4.197 20 0 HIADHN CN(C(=O)NC[C@@H]1CCCO[C@H]1C(C)(C)C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470882248 885375137 /nfs/dbraw/zinc/37/51/37/885375137.db2.gz DCXOBQXHIFUWKA-BHDDXSALSA-N 0 3 401.595 4.134 20 0 HIADHN CO[C@@H](CNC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1)c1cccc(Cl)c1 ZINC000470885919 885381032 /nfs/dbraw/zinc/38/10/32/885381032.db2.gz JEGYKSCXMIJNOU-VXKWHMMOSA-N 0 3 415.965 4.334 20 0 HIADHN Cc1cccc2c(CCNC(=O)N(C)[C@@H]3CCCN(Cc4ccccc4)C3)c[nH]c21 ZINC000470900345 885401936 /nfs/dbraw/zinc/40/19/36/885401936.db2.gz APCJFCFACACSPV-JOCHJYFZSA-N 0 3 404.558 4.325 20 0 HIADHN Cn1c(CNC[C@H](c2ccc(Cl)cc2)N2CCOC(C)(C)C2)nc2ccccc21 ZINC000504034373 912936416 /nfs/dbraw/zinc/93/64/16/912936416.db2.gz NKCNVWAVRTUVOM-OAQYLSRUSA-N 0 3 412.965 4.168 20 0 HIADHN Cn1c(CNC[C@@H](c2ccc(Cl)cc2)N2CCOC(C)(C)C2)nc2ccccc21 ZINC000504034370 912937051 /nfs/dbraw/zinc/93/70/51/912937051.db2.gz NKCNVWAVRTUVOM-NRFANRHFSA-N 0 3 412.965 4.168 20 0 HIADHN C[C@@H]1[C@H](C(F)(F)F)CCN1C[C@H](O)COc1ccc(Cl)cc1Br ZINC000470962839 885461818 /nfs/dbraw/zinc/46/18/18/885461818.db2.gz YKLSTWSEAPWGNP-ADEWGFFLSA-N 0 3 416.665 4.115 20 0 HIADHN O=C(CSCC(=O)N1CC[C@@]2(C1)CCCN(Cc1ccccc1)C2)c1ccccc1 ZINC000470964359 885463245 /nfs/dbraw/zinc/46/32/45/885463245.db2.gz XGGIJNLQQVAMHF-VWLOTQADSA-N 0 3 422.594 4.117 20 0 HIADHN CN1CCN(CC(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)C2(CCCCC2)C1 ZINC000471039722 885548497 /nfs/dbraw/zinc/54/84/97/885548497.db2.gz GQURXNHYOYXCPS-UHFFFAOYSA-N 0 3 403.876 4.248 20 0 HIADHN C[C@@H](NC(=O)C1(c2cccc(Cl)c2)CCOCC1)[C@@H](c1ccccc1)N(C)C ZINC000471129813 885668813 /nfs/dbraw/zinc/66/88/13/885668813.db2.gz QUIWWNDENPBMSG-UTKZUKDTSA-N 0 3 400.950 4.196 20 0 HIADHN C[C@H](NC(=O)c1ccccc1-c1nc(C(C)(C)C)no1)[C@H](c1ccccc1)N(C)C ZINC000471131989 885670831 /nfs/dbraw/zinc/67/08/31/885670831.db2.gz CLLASDNABNKMQA-OXJNMPFZSA-N 0 3 406.530 4.455 20 0 HIADHN C[C@H](NC(=O)c1ccccc1-c1nc(C(C)(C)C)no1)[C@@H](c1ccccc1)N(C)C ZINC000471131988 885671305 /nfs/dbraw/zinc/67/13/05/885671305.db2.gz CLLASDNABNKMQA-JXFKEZNVSA-N 0 3 406.530 4.455 20 0 HIADHN CC(C)(C)c1csc(NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)n1 ZINC000471141728 885685341 /nfs/dbraw/zinc/68/53/41/885685341.db2.gz GPFRKBZQFXLXSB-UHFFFAOYSA-N 0 3 404.502 4.367 20 0 HIADHN CC(=O)Nc1cc(C(=O)N[C@H](CN2CCCC2)c2ccccc2)cc(C(F)(F)F)c1 ZINC000471149077 885694845 /nfs/dbraw/zinc/69/48/45/885694845.db2.gz YABLILHUPIDXOJ-HXUWFJFHSA-N 0 3 419.447 4.231 20 0 HIADHN CSc1nc(C(C)(C)C)nc(C)c1C(=O)NC1CCN(Cc2ccccc2)CC1 ZINC000471153600 885702649 /nfs/dbraw/zinc/70/26/49/885702649.db2.gz HIXZGBKOYGGHEH-UHFFFAOYSA-N 0 3 412.603 4.199 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3cc(-c4ccco4)on3)c(OCC)c2)CC1 ZINC000471172391 885732133 /nfs/dbraw/zinc/73/21/33/885732133.db2.gz GDBAFWWZHJGOFL-UHFFFAOYSA-N 0 3 424.501 4.118 20 0 HIADHN CCOc1ccc(NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cc1F ZINC000471254997 885833688 /nfs/dbraw/zinc/83/36/88/885833688.db2.gz POGITAZAUXCQEI-UHFFFAOYSA-N 0 3 403.420 4.151 20 0 HIADHN COc1cc(NC(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)cc(-n2cccn2)c1 ZINC000471476398 886171779 /nfs/dbraw/zinc/17/17/79/886171779.db2.gz OLRQXPUPCGBSRK-NRFANRHFSA-N 0 3 419.529 4.009 20 0 HIADHN CCN1CCC[C@@H](CN(C)C(=O)Nc2ccc(F)c(Cl)c2)[C@@H]1c1cnn(C)c1 ZINC000471500782 886201977 /nfs/dbraw/zinc/20/19/77/886201977.db2.gz UNZWTIKPMNZBHB-IFXJQAMLSA-N 0 3 407.921 4.150 20 0 HIADHN O=C(NCc1ccc2ncccc2c1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000471533253 886238652 /nfs/dbraw/zinc/23/86/52/886238652.db2.gz UZZLPVNHFXMAHY-QFIPXVFZSA-N 0 3 413.443 4.306 20 0 HIADHN C[C@H](NC(=O)CCc1ncc(-c2ccc(F)cc2F)o1)[C@@H](c1ccccc1)N(C)C ZINC000471542062 886248406 /nfs/dbraw/zinc/24/84/06/886248406.db2.gz MJWZKEBKDXOJED-WNSKOXEYSA-N 0 3 413.468 4.360 20 0 HIADHN C[C@@H](NC(=O)Cc1csc(Cc2ccc(F)cc2)n1)[C@H](c1ccccc1)N(C)C ZINC000471557846 886265786 /nfs/dbraw/zinc/26/57/86/886265786.db2.gz VHQNLELCFCEUTF-WAIKUNEKSA-N 0 3 411.546 4.223 20 0 HIADHN C[C@H](NC(=O)[C@@H]1C[C@@H]1c1ccccc1OC(F)(F)F)[C@@H](c1ccccc1)N(C)C ZINC000471575713 886287389 /nfs/dbraw/zinc/28/73/89/886287389.db2.gz ZFIGMAIRZKZCKY-IVGZAAIESA-N 0 3 406.448 4.496 20 0 HIADHN COc1ccccc1[C@H](CN[C@@H](C)c1ccc(S(C)(=O)=O)c(F)c1)OC(C)C ZINC000471582677 886294355 /nfs/dbraw/zinc/29/43/55/886294355.db2.gz PWBXRTSZMBZREU-YWZLYKJASA-N 0 3 409.523 4.055 20 0 HIADHN Cc1ccc([C@@H](NC(=O)NCCCN2CCc3ccccc3C2)c2ccccn2)cc1 ZINC000471590985 886303030 /nfs/dbraw/zinc/30/30/30/886303030.db2.gz POMOOUFFNZLNMZ-RUZDIDTESA-N 0 3 414.553 4.227 20 0 HIADHN COc1cccc([C@H](CNC(=O)CCc2cnc3ccccc3c2)N2CCCC2)c1 ZINC000471604555 886318479 /nfs/dbraw/zinc/31/84/79/886318479.db2.gz XRSKODMSJAQCBX-DEOSSOPVSA-N 0 3 403.526 4.129 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)Cc3coc(-c4ccc(Cl)cc4)n3)c2)CC1 ZINC000471620251 886337173 /nfs/dbraw/zinc/33/71/73/886337173.db2.gz RMALQXQEDSYBJL-UHFFFAOYSA-N 0 3 424.932 4.318 20 0 HIADHN CCCc1c(C(=O)Nc2cccc(N3CCN(CC)CC3)c2)cnn1C1CCCC1 ZINC000471631861 886350183 /nfs/dbraw/zinc/35/01/83/886350183.db2.gz CMQFTAUYTZEEJZ-UHFFFAOYSA-N 0 3 409.578 4.345 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)Cc3cccc4ccc(OC)cc43)c2)CC1 ZINC000471633070 886351045 /nfs/dbraw/zinc/35/10/45/886351045.db2.gz FAICISLRNCMJHS-UHFFFAOYSA-N 0 3 403.526 4.172 20 0 HIADHN Cc1c(NC(=O)NCC(C)(C)N2CCc3ccccc3C2)cccc1NC(=O)N(C)C ZINC000471649371 886363944 /nfs/dbraw/zinc/36/39/44/886363944.db2.gz QNIDTGDCTYQRJE-UHFFFAOYSA-N 0 3 423.561 4.047 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)c3cnc(-c4ccc(OC)cc4)s3)c2)CC1 ZINC000471650336 886365939 /nfs/dbraw/zinc/36/59/39/886365939.db2.gz UEBAPPUHOSABEU-UHFFFAOYSA-N 0 3 422.554 4.213 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)NCC2CCN(c3ccccc3)CC2)C1 ZINC000471730997 886450440 /nfs/dbraw/zinc/45/04/40/886450440.db2.gz GZOUDQBDQPCEGP-NFBKMPQASA-N 0 3 406.574 4.038 20 0 HIADHN O=C(NCc1c(F)cccc1Cl)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000471774358 886506608 /nfs/dbraw/zinc/50/66/08/886506608.db2.gz SOSZATFFHSQNIE-UHFFFAOYSA-N 0 3 407.839 4.084 20 0 HIADHN O=C(NCc1ccc(-c2nc3ccccc3s2)o1)N1CCN(C2CCCC2)CC1 ZINC000504163283 913052369 /nfs/dbraw/zinc/05/23/69/913052369.db2.gz IROSCZPLHPDGDL-UHFFFAOYSA-N 0 3 410.543 4.326 20 0 HIADHN CCc1ccc([C@@H](NCCC(O)(CC)CC)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000471796970 886533348 /nfs/dbraw/zinc/53/33/48/886533348.db2.gz FFZCXXXQCWALOA-JOCHJYFZSA-N 0 3 403.588 4.273 20 0 HIADHN CCSCc1cc(C(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)no1 ZINC000471828488 886579248 /nfs/dbraw/zinc/57/92/48/886579248.db2.gz WZQJAVBVMUISQC-UHFFFAOYSA-N 0 3 415.481 4.151 20 0 HIADHN Cc1cc2occ(C(=O)Nc3ccc(C(=O)NCCN4CCCC4)cc3)c2cc1C ZINC000471828950 886580076 /nfs/dbraw/zinc/58/00/76/886580076.db2.gz ZSZCJNQWEWAWKT-UHFFFAOYSA-N 0 3 405.498 4.128 20 0 HIADHN Cc1[nH]c2ccccc2c1CCNC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000471834243 886589210 /nfs/dbraw/zinc/58/92/10/886589210.db2.gz RYAWTVRPVPNJOV-UHFFFAOYSA-N 0 3 422.495 4.123 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)Nc1ccc(Cl)cc1-n1cccn1 ZINC000471912603 886699326 /nfs/dbraw/zinc/69/93/26/886699326.db2.gz SJMDLMRHPMIQNW-UHFFFAOYSA-N 0 3 415.900 4.261 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2ccc3nc(-c4ccccn4)oc3c2)[C@@H]1c1ccccc1 ZINC000471924196 886714421 /nfs/dbraw/zinc/71/44/21/886714421.db2.gz LZEYVZJEVXPZTQ-UGKGYDQZSA-N 0 3 413.481 4.457 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2cc(F)c(Br)cc2F)[C@H]1c1ccccc1 ZINC000471933513 886728941 /nfs/dbraw/zinc/72/89/41/886728941.db2.gz SOPXQEVCYYHMMU-NVXWUHKLSA-N 0 3 410.262 4.294 20 0 HIADHN Cc1cc(Br)c(F)cc1NC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000471942556 886743630 /nfs/dbraw/zinc/74/36/30/886743630.db2.gz GAILAZCMBVRANX-AEFFLSMTSA-N 0 3 406.299 4.464 20 0 HIADHN CC1CCN([C@@H](CNC(=O)Nc2ccc(C(F)(F)F)nn2)c2cccs2)CC1 ZINC000471960295 886782263 /nfs/dbraw/zinc/78/22/63/886782263.db2.gz GCGIGBSFQBMYNY-ZDUSSCGKSA-N 0 3 413.469 4.152 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2cccc3c2CN(c2nccs2)C3)[C@H]1c1ccccc1 ZINC000471964248 886791562 /nfs/dbraw/zinc/79/15/62/886791562.db2.gz ILQOVKMPWAIMSV-LEWJYISDSA-N 0 3 419.554 4.230 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2ccc(F)cc2-c2nc(C3CC3)no2)[C@@H]1c1ccccc1 ZINC000471992156 886818804 /nfs/dbraw/zinc/81/88/04/886818804.db2.gz MVEAFLTZIPSTQM-PMACEKPBSA-N 0 3 421.476 4.320 20 0 HIADHN CCn1nc(CNC2CCN(Cc3coc(-c4ccccc4)n3)CC2)c2ccccc21 ZINC000472043136 886860098 /nfs/dbraw/zinc/86/00/98/886860098.db2.gz OOZQHXLHPVEZTH-UHFFFAOYSA-N 0 3 415.541 4.465 20 0 HIADHN COc1ccccc1[C@H](CNCc1cnc2ccc(Br)cn12)OC(C)C ZINC000472044431 886861238 /nfs/dbraw/zinc/86/12/38/886861238.db2.gz NIVALTAIYVUNHR-IBGZPJMESA-N 0 3 418.335 4.361 20 0 HIADHN C[C@H](CCCCN1C(=O)c2ccccc2C1=O)NCc1cc(-c2ccccc2)on1 ZINC000472132783 886925152 /nfs/dbraw/zinc/92/51/52/886925152.db2.gz PPBNHOYDEPNTPD-QGZVFWFLSA-N 0 3 403.482 4.286 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2ccc3sccc3c2)cc1)[C@@H]1CCCN(C)C1 ZINC000472258733 887070885 /nfs/dbraw/zinc/07/08/85/887070885.db2.gz NUOGERUBSNNHSY-HXUWFJFHSA-N 0 3 407.539 4.320 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)N[C@@H]1CCSc2ccc(Cl)cc21 ZINC000504245025 913112832 /nfs/dbraw/zinc/11/28/32/913112832.db2.gz GVQDYMQDSMEZOU-GOSISDBHSA-N 0 3 404.967 4.045 20 0 HIADHN COc1ccc(CNC(=O)C2CCN(Cc3ccccc3OCC(C)C)CC2)cc1 ZINC000472316668 887147923 /nfs/dbraw/zinc/14/79/23/887147923.db2.gz VOTRVXKJVQXFHY-UHFFFAOYSA-N 0 3 410.558 4.258 20 0 HIADHN COc1ccc(NC(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)c(Br)c1 ZINC000472319764 887151976 /nfs/dbraw/zinc/15/19/76/887151976.db2.gz VLAYPEOLHZRTEE-ZWKOTPCHSA-N 0 3 404.308 4.025 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2OCC(F)(F)F)[C@H]1c1ccccc1 ZINC000472342087 887177212 /nfs/dbraw/zinc/17/72/12/887177212.db2.gz YBBUSHKUGANBHG-SJLPKXTDSA-N 0 3 411.399 4.334 20 0 HIADHN COCCC[C@@H](Cc1ccccc1)NC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C ZINC000472458680 887315069 /nfs/dbraw/zinc/31/50/69/887315069.db2.gz YQCGJQXFNPZCQX-DHLKQENFSA-N 0 3 423.601 4.330 20 0 HIADHN COCCC[C@@H](Cc1ccccc1)NC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000472461514 887319395 /nfs/dbraw/zinc/31/93/95/887319395.db2.gz IDHPTWNDVJLWGC-DQEYMECFSA-N 0 3 423.601 4.330 20 0 HIADHN Cc1ccc([C@@H](NC(=O)N(CCN(C)C)Cc2cccc(F)c2)c2ccccn2)cc1 ZINC000472484109 887350263 /nfs/dbraw/zinc/35/02/63/887350263.db2.gz IPRJSPPMHVXUFT-XMMPIXPASA-N 0 3 420.532 4.392 20 0 HIADHN Cc1ccc([C@@H](NC(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)c2ccccn2)cc1 ZINC000472490759 887357225 /nfs/dbraw/zinc/35/72/25/887357225.db2.gz ZSZWQCUTMDPSRO-UKILVPOCSA-N 0 3 414.553 4.395 20 0 HIADHN CN(C(=O)Nc1cccc(C(=O)NC(C)(C)C)c1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000472694266 887548634 /nfs/dbraw/zinc/54/86/34/887548634.db2.gz UHOPXEXTAZQHNR-QFIPXVFZSA-N 0 3 422.573 4.343 20 0 HIADHN Cc1nc(-c2cccc(NC(=O)N(C)[C@@H]3CCCN(Cc4ccccc4)C3)c2)no1 ZINC000472711885 887561328 /nfs/dbraw/zinc/56/13/28/887561328.db2.gz YNFHPMRTLUNPGG-OAQYLSRUSA-N 0 3 405.502 4.173 20 0 HIADHN OCCCN(Cc1ccc(Cl)c(Cl)c1)C[C@@H](O)COc1cccc2[nH]ccc21 ZINC000472733508 887579188 /nfs/dbraw/zinc/57/91/88/887579188.db2.gz ASTMKXIINACXLG-MRXNPFEDSA-N 0 3 423.340 4.099 20 0 HIADHN O=C(N[C@@H]1CCOc2c(Br)cccc21)c1cccc(CN2CCCC2)c1 ZINC000504332150 913175568 /nfs/dbraw/zinc/17/55/68/913175568.db2.gz OCEFMPWNZHOTGV-LJQANCHMSA-N 0 3 415.331 4.299 20 0 HIADHN C[C@@H](CCN1CCN(C)CC1)NC(=O)N[C@@H](CCCc1ccccc1)c1ccccc1 ZINC000472905110 887751061 /nfs/dbraw/zinc/75/10/61/887751061.db2.gz ARADNPZZXQUARP-DHLKQENFSA-N 0 3 422.617 4.076 20 0 HIADHN C[C@H](CCN1CCN(C)CC1)NC(=O)N[C@@H](CCCc1ccccc1)c1ccccc1 ZINC000472905116 887752581 /nfs/dbraw/zinc/75/25/81/887752581.db2.gz ARADNPZZXQUARP-RDGATRHJSA-N 0 3 422.617 4.076 20 0 HIADHN CN(CCNC(=O)Nc1ccc(OCc2ccccn2)c(F)c1)Cc1ccccc1 ZINC000472911707 887757524 /nfs/dbraw/zinc/75/75/24/887757524.db2.gz DRDYURQHKLXWJP-UHFFFAOYSA-N 0 3 408.477 4.053 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3nn([C@H](C)c4ccccc4)cc3C)cc2)CC1 ZINC000472949120 887797988 /nfs/dbraw/zinc/79/79/88/887797988.db2.gz IEHQJBQMNDQMMK-HXUWFJFHSA-N 0 3 417.557 4.195 20 0 HIADHN CN(Cc1cc2ccccc2o1)C(=O)NCCCCN1CCN(c2ccccc2)CC1 ZINC000472950031 887799564 /nfs/dbraw/zinc/79/95/64/887799564.db2.gz JXMUPURTIZPOET-UHFFFAOYSA-N 0 3 420.557 4.177 20 0 HIADHN COc1ccc(NC(=O)C2(NCc3ccc4ncccc4c3)CCCC2)cc1OC ZINC000473037294 887860428 /nfs/dbraw/zinc/86/04/28/887860428.db2.gz QKYKPHDEOMSFIV-UHFFFAOYSA-N 0 3 405.498 4.293 20 0 HIADHN Cc1cc(NC(=O)[C@H]2CCCN2C2CCCC2)nn1CCCOc1ccc(F)cc1 ZINC000504353452 913187537 /nfs/dbraw/zinc/18/75/37/913187537.db2.gz KWEPANYCFRQICZ-OAQYLSRUSA-N 0 3 414.525 4.145 20 0 HIADHN CC(=O)CC(C)(C)CC(=O)N(C[C@@H]1CCN(Cc2ccccc2)C1)CC(F)(F)F ZINC000473067480 887887544 /nfs/dbraw/zinc/88/75/44/887887544.db2.gz AQACTYSNFZKJLX-LJQANCHMSA-N 0 3 412.496 4.295 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)c2ccc(O[C@@H](C)c3ccccc3)cc2)CC1 ZINC000473069501 887888547 /nfs/dbraw/zinc/88/85/47/887888547.db2.gz CULXASJUFMGCGF-FQEVSTJZSA-N 0 3 410.558 4.446 20 0 HIADHN Cc1ccc(C(F)(F)F)cc1NC(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000473070323 887890346 /nfs/dbraw/zinc/89/03/46/887890346.db2.gz DDBRYYDLLWOAPZ-HZPDHXFCSA-N 0 3 413.484 4.367 20 0 HIADHN C[C@@H](NC(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1)c1ccc(Cl)cn1 ZINC000473182922 887961769 /nfs/dbraw/zinc/96/17/69/887961769.db2.gz AKWXNBLFKRZCLC-KUHUBIRLSA-N 0 3 411.855 4.367 20 0 HIADHN C[NH+](C)CC1CCN(c2ccccc2NC(=O)CCCc2ccc([O-])c(F)c2)CC1 ZINC000473250361 888016218 /nfs/dbraw/zinc/01/62/18/888016218.db2.gz QSDSVWCNMIXERN-UHFFFAOYSA-N 0 3 413.537 4.271 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)C1NC(=O)CCC(=O)c1ccc(F)cc1F ZINC000473280118 888035190 /nfs/dbraw/zinc/03/51/90/888035190.db2.gz YNRJTVBGMCBHSV-IAGOWNOFSA-N 0 3 414.496 4.201 20 0 HIADHN C[C@H](CC(=O)NC1[C@@H](C)CN(Cc2ccccc2)C[C@@H]1C)C(=O)c1cccc(F)c1 ZINC000473283401 888038388 /nfs/dbraw/zinc/03/83/88/888038388.db2.gz WZDXQSXAGBEMDC-QYZOEREBSA-N 0 3 410.533 4.307 20 0 HIADHN O=C(NC[C@H]1CCN(Cc2ccccc2)C1)c1ccccc1C(=O)c1cccs1 ZINC000473307791 888055842 /nfs/dbraw/zinc/05/58/42/888055842.db2.gz DERAHQOFGLUPQD-LJQANCHMSA-N 0 3 404.535 4.231 20 0 HIADHN CCc1c(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)cnn1-c1ccc(OC)cc1 ZINC000473496966 888219994 /nfs/dbraw/zinc/21/99/94/888219994.db2.gz JCEKMBCGWVNTLO-DEOSSOPVSA-N 0 3 418.541 4.010 20 0 HIADHN Cc1c(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cnn1-c1ccccc1C ZINC000473514198 888244408 /nfs/dbraw/zinc/24/44/08/888244408.db2.gz QRHKNZQSLNRABJ-UHFFFAOYSA-N 0 3 420.479 4.024 20 0 HIADHN CCc1c(C(=O)N2CC[C@@]3(C2)CCCN(Cc2ccccc2)C3)[nH]c(C)c1C(C)=O ZINC000473515130 888246057 /nfs/dbraw/zinc/24/60/57/888246057.db2.gz MZVSBSBYHBLBII-VWLOTQADSA-N 0 3 407.558 4.216 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1csc(Br)c1 ZINC000473516200 888247362 /nfs/dbraw/zinc/24/73/62/888247362.db2.gz ABXQAHPSCQLKMT-UHFFFAOYSA-N 0 3 411.287 4.046 20 0 HIADHN Cc1nc(-c2cccc(C)c2)[nH]c1C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473518438 888250054 /nfs/dbraw/zinc/25/00/54/888250054.db2.gz LXLUMSCRXARQLL-UHFFFAOYSA-N 0 3 420.479 4.229 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1cc(Oc2ccccc2)ccn1 ZINC000473517730 888250153 /nfs/dbraw/zinc/25/01/53/888250153.db2.gz JUKBFRIICPHWBA-UHFFFAOYSA-N 0 3 419.447 4.409 20 0 HIADHN Cc1cc(OCC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cc(C)c1Cl ZINC000473517833 888250461 /nfs/dbraw/zinc/25/04/61/888250461.db2.gz BNYQZSOMJODAJZ-UHFFFAOYSA-N 0 3 418.887 4.257 20 0 HIADHN O=C(CCCOc1ccc(F)cc1F)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473522179 888256701 /nfs/dbraw/zinc/25/67/01/888256701.db2.gz PTRCEIHYJYTDNW-UHFFFAOYSA-N 0 3 420.422 4.045 20 0 HIADHN Cc1nc(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)c(-c2ccccc2)o1 ZINC000473530107 888267266 /nfs/dbraw/zinc/26/72/66/888267266.db2.gz XFEFADBFTWNCAY-UHFFFAOYSA-N 0 3 407.436 4.185 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)C1(c2ccc(Cl)cc2)CC1 ZINC000473537095 888276524 /nfs/dbraw/zinc/27/65/24/888276524.db2.gz ZJZHPKQYWYBMER-UHFFFAOYSA-N 0 3 400.872 4.293 20 0 HIADHN CCc1nc2cc(CNC(=O)NC[C@H](N[C@H](C)CC)c3ccco3)ccc2n1C1CC1 ZINC000504417827 913234030 /nfs/dbraw/zinc/23/40/30/913234030.db2.gz FNEOBVQISFNCGB-UZLBHIALSA-N 0 3 423.561 4.455 20 0 HIADHN CCCN(C(=O)NCCC1CC(OCC)C1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000473599522 888344386 /nfs/dbraw/zinc/34/43/86/888344386.db2.gz SUPCDHHAAWOGTA-OOMBGRCJSA-N 0 3 401.595 4.278 20 0 HIADHN Cc1ccc(NC(=O)NC(C)(C)CCN2CCN(C)CC2)c(OCc2ccccc2)c1 ZINC000473673149 888434367 /nfs/dbraw/zinc/43/43/67/888434367.db2.gz DKNJWSMCUDALSK-UHFFFAOYSA-N 0 3 424.589 4.112 20 0 HIADHN C[C@H](N[C@@H]1CCN(c2ccc(Cl)cc2Cl)C1=O)c1ccc(-n2ccnn2)cc1 ZINC000473680486 888447348 /nfs/dbraw/zinc/44/73/48/888447348.db2.gz VNUQHDOBPGPHNE-SCLBCKFNSA-N 0 3 416.312 4.030 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)N2CCCC[C@H]2c2nc(-c3cccc(F)c3)c[nH]2)CN1C1CC1 ZINC000473737042 888516263 /nfs/dbraw/zinc/51/62/63/888516263.db2.gz APDRLGISGMSSAD-FPDPHYFHSA-N 0 3 411.525 4.078 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1c2c(nn1C(C)C)CCC2)c1cccc(OC)c1 ZINC000473794651 888611427 /nfs/dbraw/zinc/61/14/27/888611427.db2.gz DZJVIQBETKSEEQ-NRFANRHFSA-N 0 3 413.566 4.166 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CCC(COc4ccccc4)CC3)c2)CC1 ZINC000473806872 888630698 /nfs/dbraw/zinc/63/06/98/888630698.db2.gz LKQPSFUPPLNMOK-UHFFFAOYSA-N 0 3 422.573 4.151 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)NC[C@@H]3CCCO[C@@H]3c3ccccc3)c2)CC1 ZINC000473818296 888646986 /nfs/dbraw/zinc/64/69/86/888646986.db2.gz CDOWGNYJPJAMQD-XUZZJYLKSA-N 0 3 422.573 4.118 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CCC[C@@H]3Cc3ccccc3OC)c2)CC1 ZINC000473828607 888662116 /nfs/dbraw/zinc/66/21/16/888662116.db2.gz XTXNRLNUYWRPHH-HSZRJFAPSA-N 0 3 422.573 4.076 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)Nc3ccc(OC[C@@H]4CCCO4)cc3)c2)CC1 ZINC000473832379 888666303 /nfs/dbraw/zinc/66/63/03/888666303.db2.gz AXFGCACKNHZVQG-QHCPKHFHSA-N 0 3 424.545 4.030 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@H](C)c3cccc(N4CCCC4)c3)c2)CC1 ZINC000473839436 888680947 /nfs/dbraw/zinc/68/09/47/888680947.db2.gz IWFPABIHYDUCSC-HXUWFJFHSA-N 0 3 421.589 4.311 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CCC[C@H]3c3cccc(OC)c3)c2)CC1 ZINC000473841211 888683061 /nfs/dbraw/zinc/68/30/61/888683061.db2.gz RPVFPRNVCLXHKC-QHCPKHFHSA-N 0 3 408.546 4.206 20 0 HIADHN Cc1nc(CC(C)C)c(NC(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)s1 ZINC000473848232 888696221 /nfs/dbraw/zinc/69/62/21/888696221.db2.gz QKRMTNBVCDKOKX-IAGOWNOFSA-N 0 3 422.639 4.393 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N[C@@H](C)c1noc(-c2ccccc2)n1)c1ccsc1 ZINC000473873278 888735237 /nfs/dbraw/zinc/73/52/37/888735237.db2.gz CQKWMXMZOMALKP-YJBOKZPZSA-N 0 3 413.547 4.241 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)C3(Cc4ccccc4Cl)CC3)CC2)C[C@@H](C)O1 ZINC000473921949 888802136 /nfs/dbraw/zinc/80/21/36/888802136.db2.gz KYIKFBRWLSTPKS-RTBURBONSA-N 0 3 419.009 4.401 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)c3ccc(C(F)(F)F)c(F)c3)CC2)C[C@H](C)O1 ZINC000473923161 888803664 /nfs/dbraw/zinc/80/36/64/888803664.db2.gz YDFYUTMDGFJCCW-GJZGRUSLSA-N 0 3 416.459 4.196 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N[C@H](C)c2ccc(Br)cn2)N(C)C)cc1 ZINC000473967478 888835415 /nfs/dbraw/zinc/83/54/15/888835415.db2.gz GIIYGTOJQIVOLK-KUHUBIRLSA-N 0 3 419.367 4.070 20 0 HIADHN O=C(Nc1ccc(OC2CCCC2)cc1)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1CO ZINC000473975286 888840884 /nfs/dbraw/zinc/84/08/84/888840884.db2.gz NSKIMMAXIKQNCL-HYBUGGRVSA-N 0 3 423.557 4.013 20 0 HIADHN CN1CCN(CCC(C)(C)NC(=O)N[C@H]2C[C@H]3CCC(C)(C)c4cccc2c43)CC1 ZINC000474004026 888862457 /nfs/dbraw/zinc/86/24/57/888862457.db2.gz ATHQFKIUPUKJLN-NQIIRXRSSA-N 0 3 412.622 4.002 20 0 HIADHN COc1ccc(Cc2nc(C)c([C@H](C)NCCOC(F)(F)F)s2)cc1OC ZINC000474028430 888878460 /nfs/dbraw/zinc/87/84/60/888878460.db2.gz DFIPLOKZAODOHS-NSHDSACASA-N 0 3 404.454 4.247 20 0 HIADHN CCOC1CC(CCN[C@@H](c2ccc(F)cc2)c2cccc(S(C)(=O)=O)c2)C1 ZINC000474067504 888897774 /nfs/dbraw/zinc/89/77/74/888897774.db2.gz PRHHCYINLNSYTE-STKUJCBHSA-N 0 3 405.535 4.113 20 0 HIADHN C[C@H](NC(=O)c1ccc2c(c1)[nH]c(=O)n2C1CCCC1)[C@H](c1ccccc1)N(C)C ZINC000474178127 889017494 /nfs/dbraw/zinc/01/74/94/889017494.db2.gz QIOUVTZDKCRIBR-KSFYIVLOSA-N 0 3 406.530 4.278 20 0 HIADHN CN1CC[C@@H](NC(=O)C2(c3cc(F)cc(C(F)(F)F)c3)CC2)[C@@H]1c1ccccc1 ZINC000474258472 889115227 /nfs/dbraw/zinc/11/52/27/889115227.db2.gz LDBPVSMMNZPKDC-MOPGFXCFSA-N 0 3 406.423 4.438 20 0 HIADHN COc1ccc2nc(CNC[C@@H](CO)Cc3ccc(C(F)(F)F)cc3)sc2c1 ZINC000474371785 889249689 /nfs/dbraw/zinc/24/96/89/889249689.db2.gz OHQYUUQDKCTHEP-AWEZNQCLSA-N 0 3 410.461 4.265 20 0 HIADHN CCc1noc(-c2ccc(C)c(NC(=O)N[C@H](C)[C@@H](c3ccccc3)N(C)C)c2)n1 ZINC000474441023 889306681 /nfs/dbraw/zinc/30/66/81/889306681.db2.gz XAOUEQWGFDQAEI-IERDGZPVSA-N 0 3 407.518 4.420 20 0 HIADHN CCc1noc(-c2ccc(C)c(NC(=O)N[C@@H](C)[C@H](c3ccccc3)N(C)C)c2)n1 ZINC000474441022 889307567 /nfs/dbraw/zinc/30/75/67/889307567.db2.gz XAOUEQWGFDQAEI-HRAATJIYSA-N 0 3 407.518 4.420 20 0 HIADHN CCCCOc1ccc(CNCc2ccc(Cl)cc2-n2cncn2)cc1OC ZINC000474467924 889332813 /nfs/dbraw/zinc/33/28/13/889332813.db2.gz GGMIFPFKSLKRGK-UHFFFAOYSA-N 0 3 400.910 4.398 20 0 HIADHN CCCOc1c(Cl)cc(CN2CCC[C@@H](CN3CCOCC3)C2)cc1OCC ZINC000504576228 913341898 /nfs/dbraw/zinc/34/18/98/913341898.db2.gz XLLUOIWOYNONRM-SFHVURJKSA-N 0 3 410.986 4.072 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)c1c(Cl)cccc1Cl ZINC000474537217 889410474 /nfs/dbraw/zinc/41/04/74/889410474.db2.gz VLMPYNQPURWMKP-UHFFFAOYSA-N 0 3 406.357 4.326 20 0 HIADHN CSc1nc(-c2ccco2)nc(C)c1C(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000474555497 889432607 /nfs/dbraw/zinc/43/26/07/889432607.db2.gz YHVNBFFIVXNDKF-FUHWJXTLSA-N 0 3 422.554 4.332 20 0 HIADHN CN(C(=O)Nc1ccccc1CC(=O)OC(C)(C)C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000474574709 889449482 /nfs/dbraw/zinc/44/94/82/889449482.db2.gz DSBLYPCGLITQSG-OAQYLSRUSA-N 0 3 423.557 4.309 20 0 HIADHN CN(C(=O)Nc1ccccc1CC(=O)OC(C)(C)C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000474574707 889449744 /nfs/dbraw/zinc/44/97/44/889449744.db2.gz DSBLYPCGLITQSG-NRFANRHFSA-N 0 3 423.557 4.309 20 0 HIADHN CN(C(=O)Nc1cc(Br)ccc1F)[C@H]1CCN(Cc2ccccc2)C1 ZINC000474583282 889454872 /nfs/dbraw/zinc/45/48/72/889454872.db2.gz DXVYSYFHFQFFJK-INIZCTEOSA-N 0 3 406.299 4.326 20 0 HIADHN CC(C)N1CCC(N(C)C(=O)c2cc(F)c(F)cc2C(=O)c2ccccc2)CC1 ZINC000474591962 889461358 /nfs/dbraw/zinc/46/13/58/889461358.db2.gz LQJSEZFAQDNMKI-UHFFFAOYSA-N 0 3 400.469 4.141 20 0 HIADHN O=C(Nc1ccc(C(=O)N2CCC[C@H]2CN2CCCCC2)s1)Nc1ccccc1 ZINC000474611132 889475089 /nfs/dbraw/zinc/47/50/89/889475089.db2.gz AMZJJFGGAHVBRS-SFHVURJKSA-N 0 3 412.559 4.483 20 0 HIADHN Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000474617001 889480712 /nfs/dbraw/zinc/48/07/12/889480712.db2.gz UHRGDXAWYKUAGV-QFIPXVFZSA-N 0 3 422.573 4.119 20 0 HIADHN CCc1nnc(-c2ccc(NC(=O)N(C)[C@@H]3CCN(Cc4ccccc4)C3)cc2)o1 ZINC000474617918 889482361 /nfs/dbraw/zinc/48/23/61/889482361.db2.gz HMQCWFQPWRFKGW-HXUWFJFHSA-N 0 3 405.502 4.037 20 0 HIADHN Cc1cc(C)n(-c2ccc(Cl)c(C(=O)N[C@@H](CN3CCCC3)c3ccccc3)n2)n1 ZINC000474697902 889556654 /nfs/dbraw/zinc/55/66/54/889556654.db2.gz PGBYSBMVPSQLCB-FQEVSTJZSA-N 0 3 423.948 4.104 20 0 HIADHN CN(C(=O)Nc1ccc(OCC(F)(F)F)cc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000474701509 889560918 /nfs/dbraw/zinc/56/09/18/889560918.db2.gz MKTPIFARYCKUAC-GOSISDBHSA-N 0 3 407.436 4.366 20 0 HIADHN CC(C)CC(=O)Nc1ccc(NC(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000474708367 889567330 /nfs/dbraw/zinc/56/73/30/889567330.db2.gz FPVJKIRIFLGNOJ-JOCHJYFZSA-N 0 3 408.546 4.409 20 0 HIADHN COc1ccc([C@H](N[C@@H](C)C2CCS(=O)(=O)CC2)c2ccccc2Cl)cc1 ZINC000474797978 889651676 /nfs/dbraw/zinc/65/16/76/889651676.db2.gz WAEIYANGQXMUCI-BTYIYWSLSA-N 0 3 407.963 4.241 20 0 HIADHN CN1CCN(CCC(C)(C)NC(=O)c2ccc(CSc3ccccc3)cc2)CC1 ZINC000474802736 889655325 /nfs/dbraw/zinc/65/53/25/889655325.db2.gz ZEXYBQQNPNWMSI-UHFFFAOYSA-N 0 3 411.615 4.125 20 0 HIADHN C[C@H](NCc1csc(-c2ccc(C(F)(F)F)cc2)n1)C1CCS(=O)(=O)CC1 ZINC000474810885 889664580 /nfs/dbraw/zinc/66/45/80/889664580.db2.gz QDRRMTCJKSVELQ-LBPRGKRZSA-N 0 3 418.506 4.132 20 0 HIADHN CN1CCN(CCC(C)(C)NC(=O)c2ccc(SCc3ccccc3)cc2)CC1 ZINC000474815024 889668050 /nfs/dbraw/zinc/66/80/50/889668050.db2.gz VHVUFEHVFBYDLM-UHFFFAOYSA-N 0 3 411.615 4.125 20 0 HIADHN Cc1ccc(CCCN[C@H](c2ccc(F)cc2)c2cccc(S(C)(=O)=O)c2)cn1 ZINC000474866714 889721420 /nfs/dbraw/zinc/72/14/20/889721420.db2.gz FKECBAYWXNOMIU-HSZRJFAPSA-N 0 3 412.530 4.244 20 0 HIADHN COc1cc(-c2ccccc2)sc1C(=O)NC1CCN(CCOC(C)C)CC1 ZINC000474875596 889730725 /nfs/dbraw/zinc/73/07/25/889730725.db2.gz BJPKZXNADUFUGJ-UHFFFAOYSA-N 0 3 402.560 4.043 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)C[C@H](Cc2ccccc2)c2ccccc2)CC1 ZINC000474888441 889745961 /nfs/dbraw/zinc/74/59/61/889745961.db2.gz CVHIJMMPMDVDNW-DEOSSOPVSA-N 0 3 408.586 4.409 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)[C@@H](C)Sc2cc(Cl)ccc2Cl)CC1 ZINC000474891541 889748916 /nfs/dbraw/zinc/74/89/16/889748916.db2.gz OCXODCWZKWWNBO-CQSZACIVSA-N 0 3 419.418 4.480 20 0 HIADHN CC(C)C[C@H](N[C@@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1)c1nc(-c2nc[nH]n2)no1 ZINC000474891641 889749169 /nfs/dbraw/zinc/74/91/69/889749169.db2.gz ZDZDNOMDZQIFOO-RVMXOQNASA-N 0 3 406.943 4.439 20 0 HIADHN CC(C)C[C@H]([NH2+][C@@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1)c1nc(-c2nc[n-]n2)no1 ZINC000474891641 889749178 /nfs/dbraw/zinc/74/91/78/889749178.db2.gz ZDZDNOMDZQIFOO-RVMXOQNASA-N 0 3 406.943 4.439 20 0 HIADHN Cc1nc(-c2cccc(Cl)c2)sc1C(=O)NC1CCN(CCOC(C)C)CC1 ZINC000474893729 889751851 /nfs/dbraw/zinc/75/18/51/889751851.db2.gz OIXHRTJQNIRYBC-UHFFFAOYSA-N 0 3 421.994 4.391 20 0 HIADHN CC(C)(C)[C@H]1C[C@@H](NCc2c(F)ccc(I)c2F)CCO1 ZINC000474894835 889753344 /nfs/dbraw/zinc/75/33/44/889753344.db2.gz UAUUHZFFULLAID-IINYFYTJSA-N 0 3 409.258 4.253 20 0 HIADHN CN(Cc1nc2c(s1)CCCC2)C(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000474913877 889773836 /nfs/dbraw/zinc/77/38/36/889773836.db2.gz QOKDVKNBKKOLRR-QGZVFWFLSA-N 0 3 401.551 4.032 20 0 HIADHN CCN(C(=O)NCc1ccc(OC(F)F)cc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475009451 889862289 /nfs/dbraw/zinc/86/22/89/889862289.db2.gz ZSPIRNNAWFDPPI-LJQANCHMSA-N 0 3 403.473 4.094 20 0 HIADHN CCN(C(=O)Nc1cnn(-c2ccccc2)c1C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475011022 889865411 /nfs/dbraw/zinc/86/54/11/889865411.db2.gz RJQYJYLWBGYLQB-QFIPXVFZSA-N 0 3 403.530 4.309 20 0 HIADHN CC(C)[C@@H](NC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1)c1nc2ccccc2[nH]1 ZINC000475012269 889865538 /nfs/dbraw/zinc/86/55/38/889865538.db2.gz GMIUTQFYCFUARZ-SIKLNZKXSA-N 0 3 405.546 4.176 20 0 HIADHN CCN(C(=O)Nc1cn(C)nc1-c1ccccc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475017140 889870087 /nfs/dbraw/zinc/87/00/87/889870087.db2.gz POHQVLLDVRZIKS-OAQYLSRUSA-N 0 3 403.530 4.215 20 0 HIADHN CN(C(=O)Nc1ccccc1OCC(F)F)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000475026086 889878349 /nfs/dbraw/zinc/87/83/49/889878349.db2.gz WHBTZXMXEGHJBL-SFHVURJKSA-N 0 3 403.473 4.459 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(Nc2ccnc3cc(Br)cnc32)CC1 ZINC000475040225 889892278 /nfs/dbraw/zinc/89/22/78/889892278.db2.gz LZEWJOGNDFOJKN-AWEZNQCLSA-N 0 3 412.335 4.425 20 0 HIADHN CN(C(=O)NCc1cc(F)cc(Br)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475127235 889987416 /nfs/dbraw/zinc/98/74/16/889987416.db2.gz BRXKUIIELNBMHH-LJQANCHMSA-N 0 3 420.326 4.004 20 0 HIADHN CC(C)CC(=O)Nc1cccc(CNC(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000475128717 889989421 /nfs/dbraw/zinc/98/94/21/889989421.db2.gz HSLGFURTAVSYLX-HSZRJFAPSA-N 0 3 422.573 4.087 20 0 HIADHN CN(C(=O)NCc1ccc(F)cc1Br)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475134993 890001061 /nfs/dbraw/zinc/00/10/61/890001061.db2.gz DSPOBCSATWZMAJ-SFHVURJKSA-N 0 3 420.326 4.004 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N(C)[C@H](C)c1ccc([S@](C)=O)cc1)c1ccsc1 ZINC000475136909 890001714 /nfs/dbraw/zinc/00/17/14/890001714.db2.gz IVVYTRWJHYEJQW-KFBKUSRJSA-N 0 3 421.632 4.271 20 0 HIADHN CN(C(=O)NCc1nc2cc(Cl)ccc2s1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475139900 890005647 /nfs/dbraw/zinc/00/56/47/890005647.db2.gz ZMDZWXAYNKOGKR-KRWDZBQOSA-N 0 3 414.962 4.366 20 0 HIADHN C[C@@H](NC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1)c1ccc(OC(F)F)cc1 ZINC000475145427 890011777 /nfs/dbraw/zinc/01/17/77/890011777.db2.gz XIPCDQUECHIXBE-APWZRJJASA-N 0 3 403.473 4.265 20 0 HIADHN CCN(C(=O)NCc1ccc(OC)c(Cl)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475161064 890024774 /nfs/dbraw/zinc/02/47/74/890024774.db2.gz DMYIRUCQWAIAEA-IBGZPJMESA-N 0 3 401.938 4.155 20 0 HIADHN CCN(C(=O)NCc1nnc(-c2ccccc2)s1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475169028 890034097 /nfs/dbraw/zinc/03/40/97/890034097.db2.gz XSTJFHCTUPUCLA-FQEVSTJZSA-N 0 3 421.570 4.011 20 0 HIADHN C[C@@H](CC(=O)N1CCC[C@@H](CN2CCN(c3ccccn3)CC2)C1)C1CCCCC1 ZINC000504676118 913415266 /nfs/dbraw/zinc/41/52/66/913415266.db2.gz FYGBEWBABDXNMT-VXKWHMMOSA-N 0 3 412.622 4.049 20 0 HIADHN CC1CCN([C@@H](CNC(=O)Nc2cccc(-c3ncn(C)n3)c2)c2cccs2)CC1 ZINC000475237812 890111888 /nfs/dbraw/zinc/11/18/88/890111888.db2.gz SSMQGXBKHKAFRM-IBGZPJMESA-N 0 3 424.574 4.138 20 0 HIADHN CCOc1cc(CN2CCC[C@@](C)(OC)C2)ccc1OCC(=O)Nc1ccccc1 ZINC000475288449 890189174 /nfs/dbraw/zinc/18/91/74/890189174.db2.gz ZBZDABLCLCNWGZ-XMMPIXPASA-N 0 3 412.530 4.104 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2cccs2)cc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475302656 890210199 /nfs/dbraw/zinc/21/01/99/890210199.db2.gz MMFAERHKPXORAD-OAQYLSRUSA-N 0 3 419.550 4.347 20 0 HIADHN CN(CC(C)(C)C)C(=O)c1cccc(C(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000475312290 890226231 /nfs/dbraw/zinc/22/62/31/890226231.db2.gz MENFZFGNENTHEL-QHCPKHFHSA-N 0 3 421.585 4.151 20 0 HIADHN COCCC[C@@H](Cc1ccccc1)NCc1cc(O)c(OC)cc1Br ZINC000475329855 890250421 /nfs/dbraw/zinc/25/04/21/890250421.db2.gz CCLAKASOVLCKTB-KRWDZBQOSA-N 0 3 408.336 4.291 20 0 HIADHN CN(C)CCN(C(=O)c1cc2sc(N3CCCC3)nc2s1)c1ccccc1 ZINC000475390756 890317897 /nfs/dbraw/zinc/31/78/97/890317897.db2.gz OSQYMFGEPIQLKB-UHFFFAOYSA-N 0 3 400.573 4.166 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)N[C@H]3C[C@H](c4ccc(Cl)cc4)C3)CC2)C[C@H](C)O1 ZINC000475407240 890335832 /nfs/dbraw/zinc/33/58/32/890335832.db2.gz FGZUDGBQUQYOCE-TZLLFPAYSA-N 0 3 419.997 4.117 20 0 HIADHN CC(C)C(=O)Nc1ccc(Cl)c(C(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000475421359 890342745 /nfs/dbraw/zinc/34/27/45/890342745.db2.gz CJXMKQPQCNHDKL-IBGZPJMESA-N 0 3 413.949 4.281 20 0 HIADHN Cc1nc(COc2ccccc2C(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)cs1 ZINC000475420537 890343378 /nfs/dbraw/zinc/34/33/78/890343378.db2.gz HCINBNOVKBUSSY-OAQYLSRUSA-N 0 3 421.566 4.377 20 0 HIADHN C[C@H](N[C@@H](C(N)=O)c1cccc(Br)c1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000475427723 890348120 /nfs/dbraw/zinc/34/81/20/890348120.db2.gz HWBFEVCTZPWXIX-WSNQVKOXSA-N 0 3 413.768 4.472 20 0 HIADHN C[C@H](CCc1ccc(Cl)s1)N[C@@H](C(N)=O)c1cccc(Br)c1 ZINC000475438671 890357676 /nfs/dbraw/zinc/35/76/76/890357676.db2.gz HZGXCKFXQCLJLK-MEBBXXQBSA-N 0 3 401.757 4.301 20 0 HIADHN C[C@@H](N[C@@H](C(N)=O)c1cccc(Br)c1)C1CCC(C(F)(F)F)CC1 ZINC000475442475 890360082 /nfs/dbraw/zinc/36/00/82/890360082.db2.gz QQFUQROAAIBOJR-FJWBTJNKSA-N 0 3 407.274 4.322 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)Cc2nc(-c3ccc(F)cc3)cs2)C1 ZINC000475614307 890543110 /nfs/dbraw/zinc/54/31/10/890543110.db2.gz VGUZYORVCKCWQE-JXFKEZNVSA-N 0 3 409.530 4.443 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)Nc2ccc3oc(C(C)(C)C)nc3c2)CC1 ZINC000475615860 890547132 /nfs/dbraw/zinc/54/71/32/890547132.db2.gz LVKLRWWHIOQTNM-UHFFFAOYSA-N 0 3 402.539 4.136 20 0 HIADHN CC(C)N1CCc2nc(CNCCc3cccc(OCC(F)(F)F)c3)sc2C1 ZINC000475634553 890575605 /nfs/dbraw/zinc/57/56/05/890575605.db2.gz MXFNFTLAFNSUJC-UHFFFAOYSA-N 0 3 413.509 4.183 20 0 HIADHN C[C@@H](CC(=O)N1CCCCCC1)N[C@@H](CO)c1ccc(Cl)cc1C(F)(F)F ZINC000475638031 890579344 /nfs/dbraw/zinc/57/93/44/890579344.db2.gz NOZOXKONGVKFAJ-GUYCJALGSA-N 0 3 406.876 4.163 20 0 HIADHN CCN(C(=O)c1ccn(-c2c(F)cccc2F)n1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000475656205 890601348 /nfs/dbraw/zinc/60/13/48/890601348.db2.gz MNWSFBAHDNVLEJ-HKUYNNGSSA-N 0 3 424.495 4.448 20 0 HIADHN COc1ccc(-c2nc(CN3CCC[C@@]3(CO)Cc3ccccc3)cs2)c(OC)c1 ZINC000475656799 890602680 /nfs/dbraw/zinc/60/26/80/890602680.db2.gz QCJFJXYZUIZWOJ-DEOSSOPVSA-N 0 3 424.566 4.397 20 0 HIADHN COC(=O)c1cccc(-c2nc(CN3CCC[C@@]3(CO)Cc3ccccc3)cs2)c1 ZINC000475672212 890615612 /nfs/dbraw/zinc/61/56/12/890615612.db2.gz CHGWRERNPCACHN-DEOSSOPVSA-N 0 3 422.550 4.166 20 0 HIADHN OC[C@@]1(Cc2ccccc2)CCCN1Cc1nc(-c2ccc(C(F)(F)F)cc2)no1 ZINC000475684596 890625583 /nfs/dbraw/zinc/62/55/83/890625583.db2.gz BUBKTHNWYYZMLM-NRFANRHFSA-N 0 3 417.431 4.325 20 0 HIADHN CCc1nnc(-c2ccc(NC(=O)NCC(C)(C)N3CCc4ccccc4C3)cc2)o1 ZINC000475699644 890638535 /nfs/dbraw/zinc/63/85/35/890638535.db2.gz LXRDOWSRVHJGSK-UHFFFAOYSA-N 0 3 419.529 4.257 20 0 HIADHN CC(C)C[C@]1(CO)CCCN1CC(=O)Nc1cccc(CSc2ccccn2)c1 ZINC000475713921 890652086 /nfs/dbraw/zinc/65/20/86/890652086.db2.gz GBCQOBJYTCUPHG-QHCPKHFHSA-N 0 3 413.587 4.185 20 0 HIADHN CCc1nnc(-c2ccc(NC(=O)NC[C@H](c3ccccc3)N3CCCC3)cc2)o1 ZINC000475720159 890658866 /nfs/dbraw/zinc/65/88/66/890658866.db2.gz XGRUQCOHPMEHHH-HXUWFJFHSA-N 0 3 405.502 4.258 20 0 HIADHN C[C@H]([C@@H](C)c1ccc(Cl)cc1)N(C)Cc1ccc(S(=O)(=O)N2CCCC2)o1 ZINC000475729227 890667695 /nfs/dbraw/zinc/66/76/95/890667695.db2.gz DXBWVWRNXCNEIJ-HZPDHXFCSA-N 0 3 410.967 4.342 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)c1cn(C)nc1-c1ccc(Cl)s1 ZINC000475812540 890747659 /nfs/dbraw/zinc/74/76/59/890747659.db2.gz SWKBCURTSLMYAV-CQSZACIVSA-N 0 3 402.951 4.052 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCCc1ccncc1)c1ccc(C(F)(F)F)cc1 ZINC000475847081 890780089 /nfs/dbraw/zinc/78/00/89/890780089.db2.gz FODNEHLWFSFERY-LJQANCHMSA-N 0 3 408.468 4.025 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)N[C@H](C)c2ccc(-c3cccnc3)cc2)o1 ZINC000475933412 890857661 /nfs/dbraw/zinc/85/76/61/890857661.db2.gz RWUKIQJJCAFMRQ-LJQANCHMSA-N 0 3 406.530 4.484 20 0 HIADHN C[C@@H](NC(=O)NCC1(N2CCSCC2)CCCC1)c1ccc(-c2cccnc2)cc1 ZINC000475937784 890862043 /nfs/dbraw/zinc/86/20/43/890862043.db2.gz IAEZUDCPUFVOMX-LJQANCHMSA-N 0 3 424.614 4.470 20 0 HIADHN C[C@H](NC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1CO)c1cccc2ccccc21 ZINC000475970946 890888870 /nfs/dbraw/zinc/88/88/70/890888870.db2.gz YSUJSIPFKJXXSF-JTJYXVOQSA-N 0 3 417.553 4.083 20 0 HIADHN CCN1CCC[C@@H](CN(C)C(=O)c2cc(C)c(Cl)cc2C)[C@@H]1c1cnn(C)c1 ZINC000476021431 890953181 /nfs/dbraw/zinc/95/31/81/890953181.db2.gz PGBQUTXBHYRZEQ-LAUBAEHRSA-N 0 3 402.970 4.236 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N[C@H](Cc2ccccc2)c2cccs2)CC1 ZINC000476048856 890978155 /nfs/dbraw/zinc/97/81/55/890978155.db2.gz HKVOBJOLYCWKQF-OAQYLSRUSA-N 0 3 415.603 4.221 20 0 HIADHN Cc1csc([C@H](C)NC(=O)N[C@H](CN2CCc3ccccc3C2)C(C)(C)C)n1 ZINC000476054687 890984258 /nfs/dbraw/zinc/98/42/58/890984258.db2.gz KHLXBFFTEOIDGQ-QFBILLFUSA-N 0 3 400.592 4.285 20 0 HIADHN Cc1cc(C(=O)Nc2ccc(C(=O)N(C)[C@H]3CCCN(C)C3)cc2)c(C)cc1Cl ZINC000476129651 891052051 /nfs/dbraw/zinc/05/20/51/891052051.db2.gz BJEDHOSWDVBNLC-IBGZPJMESA-N 0 3 413.949 4.375 20 0 HIADHN C[C@@H]1CCc2ccccc2[C@@H]1NC(=O)N(C)C1CCN(CCc2ccccn2)CC1 ZINC000476192610 891124790 /nfs/dbraw/zinc/12/47/90/891124790.db2.gz GTJNFVPBJFJSNX-NTKDMRAZSA-N 0 3 406.574 4.054 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)[C@@H](C)c3cn(C)c4ccccc34)c2)CC1 ZINC000476246125 891170237 /nfs/dbraw/zinc/17/02/37/891170237.db2.gz AOFBHZFATHONQY-IBGZPJMESA-N 0 3 404.558 4.451 20 0 HIADHN CN1CCC(Oc2ccc(NC(=O)C(C)(C)c3cccc(Cl)c3F)cn2)CC1 ZINC000476262185 891184860 /nfs/dbraw/zinc/18/48/60/891184860.db2.gz XRFXMUJENFGDFP-UHFFFAOYSA-N 0 3 405.901 4.263 20 0 HIADHN CCCOc1ccc(Oc2ncccc2CNC(=O)N(C)[C@@H]2CCN(C3CC3)C2)cc1 ZINC000476262673 891184898 /nfs/dbraw/zinc/18/48/98/891184898.db2.gz QEMLUDOYHWQGEV-HXUWFJFHSA-N 0 3 424.545 4.041 20 0 HIADHN O=C(N[C@@H]1CCCOc2ccccc21)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000504812707 913532177 /nfs/dbraw/zinc/53/21/77/913532177.db2.gz QDJKFWCDIHQPBE-KNQAVFIVSA-N 0 3 418.459 4.471 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)c2ccc3nc(-c4ccccc4)oc3c2)C[C@H](C)O1 ZINC000476305058 891217378 /nfs/dbraw/zinc/21/73/78/891217378.db2.gz IWQHWRZRBUHDNE-HDICACEKSA-N 0 3 407.514 4.114 20 0 HIADHN CCc1c(C(=O)Nc2cccc(CN3CCC(CO)CC3)c2)cnn1C1CCCC1 ZINC000476307018 891218310 /nfs/dbraw/zinc/21/83/10/891218310.db2.gz MTEASNWFXDOACJ-UHFFFAOYSA-N 0 3 410.562 4.017 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2cccc3c2CN(CC(F)(F)F)C3)N(C)C)cc1 ZINC000476338969 891244215 /nfs/dbraw/zinc/24/42/15/891244215.db2.gz FSUMCNOWSGNHSO-HXUWFJFHSA-N 0 3 420.479 4.297 20 0 HIADHN CCc1c(C(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)cnn1C1CCCC1 ZINC000476369228 891280595 /nfs/dbraw/zinc/28/05/95/891280595.db2.gz XULUUQDBJSNZMM-UHFFFAOYSA-N 0 3 409.578 4.343 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N(C)[C@@H](C)c2cccc(C(F)(F)F)c2)CC1 ZINC000476439527 891350568 /nfs/dbraw/zinc/35/05/68/891350568.db2.gz YDUPHGXAUFTNCX-INIZCTEOSA-N 0 3 415.500 4.297 20 0 HIADHN CCc1ccc([C@H]2C[C@H](C)CCN2C(=O)NC2CCN(CCOC(C)C)CC2)o1 ZINC000476451733 891364229 /nfs/dbraw/zinc/36/42/29/891364229.db2.gz LAHSKVPUYHFSNW-WIYYLYMNSA-N 0 3 405.583 4.214 20 0 HIADHN CC(C)n1ncc2ccc(NC(=O)N(CCN(C)C)Cc3ccc(F)c(F)c3)cc21 ZINC000476535839 891447946 /nfs/dbraw/zinc/44/79/46/891447946.db2.gz MKEUMKLLJJFYCP-UHFFFAOYSA-N 0 3 415.488 4.491 20 0 HIADHN C[C@@H]1CCC[C@@H](C)N1CCNC(=O)c1cn(C2CC2)c2cc(Cl)c(F)cc2c1=O ZINC000476540777 891454307 /nfs/dbraw/zinc/45/43/07/891454307.db2.gz FZYFZWKKHFSOAM-ZIAGYGMSSA-N 0 3 419.928 4.122 20 0 HIADHN C[C@@H]1CCC[C@H](C)N1CCNC(=O)c1cn(C2CC2)c2cc(Cl)c(F)cc2c1=O ZINC000476540771 891455042 /nfs/dbraw/zinc/45/50/42/891455042.db2.gz FZYFZWKKHFSOAM-OKILXGFUSA-N 0 3 419.928 4.122 20 0 HIADHN CCN1CC[C@H](N(C)C(=O)c2cn(C3CC3)c3cc(Cl)c(F)cc3c2=O)C[C@@H]1C ZINC000476546378 891461802 /nfs/dbraw/zinc/46/18/02/891461802.db2.gz NZRZOUWNNLMHTG-ZFWWWQNUSA-N 0 3 419.928 4.074 20 0 HIADHN CN1CCN(CC(=O)N(Cc2ccc(C(F)(F)F)cc2)C2CC2)C2(CCCCC2)C1 ZINC000476560502 891479506 /nfs/dbraw/zinc/47/95/06/891479506.db2.gz LNQIZTSRCNGLFL-UHFFFAOYSA-N 0 3 423.523 4.147 20 0 HIADHN CN(C)[C@@H](CNC(=O)N1CCC(c2c[nH]c3cc(F)ccc32)CC1)Cc1ccccc1 ZINC000476566847 891486319 /nfs/dbraw/zinc/48/63/19/891486319.db2.gz NYCPWFNUVFXZSA-OAQYLSRUSA-N 0 3 422.548 4.369 20 0 HIADHN C[C@@H](c1ccc(Cl)cc1)N(C)C(=O)CN1CC[C@@H](COCc2ccccc2)C1 ZINC000476590081 891521344 /nfs/dbraw/zinc/52/13/44/891521344.db2.gz YHAAIIFQAWADGL-AZUAARDMSA-N 0 3 400.950 4.398 20 0 HIADHN C[C@@H]1CO[C@@H](c2ccccc2Cl)CN1C(=O)NC[C@@H](c1ccccc1)N(C)C ZINC000476596805 891529153 /nfs/dbraw/zinc/52/91/53/891529153.db2.gz MDEKVCJONQMBGJ-TYCQWZJGSA-N 0 3 401.938 4.114 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)N(C)[C@H]2CCCc3nc(C)sc32)N(C)C)cc1 ZINC000476622649 891556405 /nfs/dbraw/zinc/55/64/05/891556405.db2.gz FKBXATYMVBRYJI-VQTJNVASSA-N 0 3 400.592 4.336 20 0 HIADHN CC1CCN([C@@H](CNC(=O)c2cncnc2-c2ccccc2)c2cccs2)CC1 ZINC000476652547 891595708 /nfs/dbraw/zinc/59/57/08/891595708.db2.gz KTRNRXHMUKXDTR-FQEVSTJZSA-N 0 3 406.555 4.408 20 0 HIADHN C[C@@H](C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1)c1cn(C)c2ccccc12 ZINC000476766600 891739714 /nfs/dbraw/zinc/73/97/14/891739714.db2.gz SRTVEGSZIBLIIQ-GOSISDBHSA-N 0 3 423.532 4.081 20 0 HIADHN CC(C)C(=O)Nc1cccc(NC(=O)NC[C@H](C(C)C)N2CCc3ccccc3C2)c1 ZINC000504863055 913592289 /nfs/dbraw/zinc/59/22/89/913592289.db2.gz IONOGDZMXLXVFK-HSZRJFAPSA-N 0 3 422.573 4.486 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)NCc2cccc(OC(C)(C)C)n2)CC1 ZINC000504865258 913595255 /nfs/dbraw/zinc/59/52/55/913595255.db2.gz PDYPWAQVXLGSPN-UHFFFAOYSA-N 0 3 410.562 4.065 20 0 HIADHN C[C@H](C(=O)Nc1cccc(CN2CCC(CO)CC2)c1)c1cn(C)c2ccccc12 ZINC000476921273 891870629 /nfs/dbraw/zinc/87/06/29/891870629.db2.gz IKAZXXUQYLEOQM-SFHVURJKSA-N 0 3 405.542 4.125 20 0 HIADHN CN(C)Cc1ccsc1C(=O)NC[C@H]1CCN(C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000476984687 891910773 /nfs/dbraw/zinc/91/07/73/891910773.db2.gz YOBQVFXYBBFNJH-KDOFPFPSSA-N 0 3 409.958 4.025 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)c(OC)c1 ZINC000504887572 913620580 /nfs/dbraw/zinc/62/05/80/913620580.db2.gz CSOUZSSUQYBOKS-OFNKIYASSA-N 0 3 423.557 4.215 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1ccc(Oc2nccc(C)n2)cc1)c1ccco1 ZINC000477110896 892042602 /nfs/dbraw/zinc/04/26/02/892042602.db2.gz FNLTZAOJBJBTTC-HNAYVOBHSA-N 0 3 409.490 4.421 20 0 HIADHN COC(=O)c1cc2cc(NC(=O)N[C@H]3CCCN(Cc4ccccc4)C3)ccc2o1 ZINC000504904698 913636844 /nfs/dbraw/zinc/63/68/44/913636844.db2.gz XZKMOFQHNPUYRD-IBGZPJMESA-N 0 3 407.470 4.006 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1ccc2cnn(CC)c2c1)c1cccc(OC)c1 ZINC000477404022 892357789 /nfs/dbraw/zinc/35/77/89/892357789.db2.gz GBIKMJCPXVEIGR-JOCHJYFZSA-N 0 3 409.534 4.269 20 0 HIADHN C[C@@H]1CSc2ccc(Br)cc2[C@@H]1NC(=O)N(C)[C@@H]1CCN(C2CC2)C1 ZINC000477419836 892373039 /nfs/dbraw/zinc/37/30/39/892373039.db2.gz RQRIKQSVCMYGSQ-CDHAZOANSA-N 0 3 424.408 4.110 20 0 HIADHN Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)NC(=O)N(C)[C@H]1CCN(C2CC2)C1 ZINC000477475390 892456502 /nfs/dbraw/zinc/45/65/02/892456502.db2.gz YCHXQHHUISCRNW-KDOFPFPSSA-N 0 3 402.539 4.197 20 0 HIADHN CN(Cc1ccc(Br)cc1)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000504927299 913666136 /nfs/dbraw/zinc/66/61/36/913666136.db2.gz YTCZBIQOXVZBOR-HXUWFJFHSA-N 0 3 416.363 4.255 20 0 HIADHN CN(C(=O)N[C@H]1CCCc2nc(-c3ccc(F)cc3)sc21)[C@H]1CCN(C2CC2)C1 ZINC000477496931 892497556 /nfs/dbraw/zinc/49/75/56/892497556.db2.gz IANUNLUIMZLOJV-HKUYNNGSSA-N 0 3 414.550 4.205 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)c2csc(Br)c2C)cc1 ZINC000477619506 892719923 /nfs/dbraw/zinc/71/99/23/892719923.db2.gz CQVFABWHMSWLKX-KRWDZBQOSA-N 0 3 423.376 4.395 20 0 HIADHN Cc1nc(C(C)(C)C)sc1C(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000477720918 892825950 /nfs/dbraw/zinc/82/59/50/892825950.db2.gz RXVFDBSQZKOVSF-UHFFFAOYSA-N 0 3 401.576 4.206 20 0 HIADHN Cc1ccc(-c2ocnc2C(=O)Nc2cccc(CN3CCC(CO)CC3)c2)cc1 ZINC000477722379 892826521 /nfs/dbraw/zinc/82/65/21/892826521.db2.gz HEFLEVOHNCEGMH-UHFFFAOYSA-N 0 3 405.498 4.107 20 0 HIADHN CC[C@H](CNC(=O)N1CCC[C@H]1c1ccc2c(c1)OCO2)N1CCc2ccccc2C1 ZINC000477725813 892827765 /nfs/dbraw/zinc/82/77/65/892827765.db2.gz XPMGLQHDQRWEHX-YADHBBJMSA-N 0 3 421.541 4.099 20 0 HIADHN Cc1ccc(Br)c(C(=O)Nc2cccc(CN3CCC(CO)CC3)c2)c1 ZINC000477729367 892830243 /nfs/dbraw/zinc/83/02/43/892830243.db2.gz YRVVEVWDYGLCRH-UHFFFAOYSA-N 0 3 417.347 4.214 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1cnc(-c2ccccc2)s1 ZINC000477732622 892832191 /nfs/dbraw/zinc/83/21/91/892832191.db2.gz YDADUBGEXRYIHM-UHFFFAOYSA-N 0 3 407.539 4.267 20 0 HIADHN Cc1nc(CC(C)C)sc1C(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000477739276 892835897 /nfs/dbraw/zinc/83/58/97/892835897.db2.gz HOSQBVWBXPDOMF-UHFFFAOYSA-N 0 3 401.576 4.107 20 0 HIADHN COc1ccc(SCCC(=O)Nc2cccc(CN3CCC(CO)CC3)c2)cc1 ZINC000477742248 892837729 /nfs/dbraw/zinc/83/77/29/892837729.db2.gz LDQLKELWDHNBCE-UHFFFAOYSA-N 0 3 414.571 4.020 20 0 HIADHN CCN(c1ccc(C(=O)Nc2cccc(CN3CCC(CO)CC3)c2)cc1)C(C)C ZINC000477747204 892841316 /nfs/dbraw/zinc/84/13/16/892841316.db2.gz VVSLPIFWHUTLJV-UHFFFAOYSA-N 0 3 409.574 4.378 20 0 HIADHN C[C@@H](NC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1)c1ccc(Br)cn1 ZINC000477806333 892878450 /nfs/dbraw/zinc/87/84/50/892878450.db2.gz LUAYOOZTWGZIBJ-GDBMZVCRSA-N 0 3 420.326 4.073 20 0 HIADHN CC(C)(CNC(=O)NCc1csc(-c2ccco2)n1)N1CCc2ccccc2C1 ZINC000477810642 892881153 /nfs/dbraw/zinc/88/11/53/892881153.db2.gz IWWGTUGZXXAJIL-UHFFFAOYSA-N 0 3 410.543 4.039 20 0 HIADHN C[C@H](NCc1ccc(C2CC2)cc1)c1ccc(S(=O)(=O)NCc2ccco2)cc1 ZINC000477854350 892912636 /nfs/dbraw/zinc/91/26/36/892912636.db2.gz HLNPEWOJQJUEFD-KRWDZBQOSA-N 0 3 410.539 4.486 20 0 HIADHN Cc1ccc(CN2CC[C@@H](N[C@H](C)CC(=O)Nc3ccccc3C(C)C)C2=O)cc1 ZINC000477915613 892997115 /nfs/dbraw/zinc/99/71/15/892997115.db2.gz LFSIOKVYCQGQIT-AUSIDOKSSA-N 0 3 407.558 4.226 20 0 HIADHN Cc1ccc(CN2CC[C@@H](N[C@@H](C)c3ccc(OCC(F)(F)F)cc3)C2=O)cc1 ZINC000477918894 893004693 /nfs/dbraw/zinc/00/46/93/893004693.db2.gz QJESQCBUHMCYBP-OXJNMPFZSA-N 0 3 406.448 4.388 20 0 HIADHN CCC[C@@H](NCc1ccc(S(=O)(=O)CCO)cc1)c1cccc(C(F)(F)F)c1 ZINC000477924683 893012551 /nfs/dbraw/zinc/01/25/51/893012551.db2.gz GHZVNTCCMMIRNZ-LJQANCHMSA-N 0 3 415.477 4.102 20 0 HIADHN Cc1ccc(CN2CC[C@H](N[C@H](C)CC(=O)Nc3cc(Cl)ccc3C)C2=O)cc1 ZINC000477937524 893026569 /nfs/dbraw/zinc/02/65/69/893026569.db2.gz ZTJARGBQBCZHBN-XLIONFOSSA-N 0 3 413.949 4.065 20 0 HIADHN Cc1cc(NC(=O)N2Cc3ccccc3CO2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000477939875 893030575 /nfs/dbraw/zinc/03/05/75/893030575.db2.gz JRGRCACVELYNOQ-QFIPXVFZSA-N 0 3 417.513 4.118 20 0 HIADHN O=C(c1cncc(Br)c1)N(CCN1CCCC1)Cc1ccc(Cl)cc1 ZINC000477980974 893079857 /nfs/dbraw/zinc/07/98/57/893079857.db2.gz GMRWSDRJYDAFSJ-UHFFFAOYSA-N 0 3 422.754 4.236 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1ccn(-c2ccccc2Cl)n1)c1ccco1 ZINC000478020637 893138929 /nfs/dbraw/zinc/13/89/29/893138929.db2.gz OFSNUPKBQWFVRI-GOEBONIOSA-N 0 3 401.898 4.370 20 0 HIADHN Cc1ccc(C(=O)N[C@@H]2CN(C)C[C@H]2c2ccccc2)cc1NC(=O)c1ccccc1 ZINC000478372283 893638471 /nfs/dbraw/zinc/63/84/71/893638471.db2.gz PUUPJKAJQJVZLV-LADGPHEKSA-N 0 3 413.521 4.075 20 0 HIADHN CN1C[C@H](NC(=O)CCc2ncc(-c3ccc(Cl)cc3)o2)[C@@H](c2ccccc2)C1 ZINC000478377313 893643253 /nfs/dbraw/zinc/64/32/53/893643253.db2.gz YRRCGFKCWMSMLX-UXHICEINSA-N 0 3 409.917 4.142 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)N1CC2(CCOCC2)c2ccccc21 ZINC000478443850 893752137 /nfs/dbraw/zinc/75/21/37/893752137.db2.gz DMFPQOQNLKJCBL-QHCPKHFHSA-N 0 3 405.542 4.102 20 0 HIADHN COc1ccc(-c2nc(C)c(C(=O)NC[C@@H](C)N3CCCC[C@@H]3C)s2)cc1OC ZINC000478567015 893852594 /nfs/dbraw/zinc/85/25/94/893852594.db2.gz RFDUPIZONNIHMQ-LSDHHAIUSA-N 0 3 417.575 4.128 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)Nc1c(C)nn(CCOC)c1C)c1ccc(Cl)cc1 ZINC000478605364 893870449 /nfs/dbraw/zinc/87/04/49/893870449.db2.gz SHQXGVJEBUUXHE-IBGZPJMESA-N 0 3 421.973 4.004 20 0 HIADHN Cc1sc(CNC(=O)N(CCCc2ccccc2)CCN(C)C)nc1C(C)C ZINC000478627660 893883752 /nfs/dbraw/zinc/88/37/52/893883752.db2.gz MQYYKVQPQRADGY-UHFFFAOYSA-N 0 3 402.608 4.281 20 0 HIADHN Cc1sc(CNC(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)nc1C(C)C ZINC000478690672 893948412 /nfs/dbraw/zinc/94/84/12/893948412.db2.gz SBFDSAGIUIOVPV-UHFFFAOYSA-N 0 3 410.534 4.127 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2nc3c(s2)CCCCC3)c1 ZINC000478791505 894066713 /nfs/dbraw/zinc/06/67/13/894066713.db2.gz YTPRMDZNZCFPMU-UHFFFAOYSA-N 0 3 402.564 4.016 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)N2CC3(CCOCC3)c3ccccc32)C1 ZINC000478793319 894068995 /nfs/dbraw/zinc/06/89/95/894068995.db2.gz IMOLWIMELVQWRL-PZJWPPBQSA-N 0 3 405.542 4.100 20 0 HIADHN CN(C)Cc1cccc(NC(=O)N[C@@H](CO)c2ccc(Cl)cc2C(F)(F)F)c1 ZINC000478907877 894188253 /nfs/dbraw/zinc/18/82/53/894188253.db2.gz NHGCYDFAQJYPSM-KRWDZBQOSA-N 0 3 415.843 4.276 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3CC[C@@H](c4ccc(F)cc4)C3)c(C)c2)CC1 ZINC000478908197 894188769 /nfs/dbraw/zinc/18/87/69/894188769.db2.gz DUKRQTIXHHSNFH-HXUWFJFHSA-N 0 3 410.537 4.297 20 0 HIADHN CC(C)NC(=O)Nc1ccc([C@H](C)N[C@@H]2CCCN(c3ccccc3F)C2=O)cc1 ZINC000478980313 894257735 /nfs/dbraw/zinc/25/77/35/894257735.db2.gz YLYRFFIQWLMVSY-OXJNMPFZSA-N 0 3 412.509 4.202 20 0 HIADHN COc1cc2c(cc1OC)[C@@H](NCc1ccc(NC(=O)c3cccnc3)cc1)CC2 ZINC000479062745 894323864 /nfs/dbraw/zinc/32/38/64/894323864.db2.gz OMGXLBXTNWLIFV-NRFANRHFSA-N 0 3 403.482 4.128 20 0 HIADHN CCC[C@@H](N[C@@H]1CCc2cc(OC)c(OC)cc21)C(=O)N1CCc2sccc2C1 ZINC000479065590 894329253 /nfs/dbraw/zinc/32/92/53/894329253.db2.gz UWXIWPSRVILZQD-RTBURBONSA-N 0 3 414.571 4.096 20 0 HIADHN Cc1ccc([C@@H](C)CN[C@@H](C)c2cc(S(N)(=O)=O)c(Cl)cc2Cl)cc1 ZINC000479077502 894341745 /nfs/dbraw/zinc/34/17/45/894341745.db2.gz MDUIHZDVBSVZJX-STQMWFEESA-N 0 3 401.359 4.404 20 0 HIADHN COc1cc2c(cc1OC)[C@@H](N[C@@H]1CCCN(c3ccccc3Cl)C1=O)CC2 ZINC000479079446 894345319 /nfs/dbraw/zinc/34/53/19/894345319.db2.gz PQALOLIZBQJLJP-ZWKOTPCHSA-N 0 3 400.906 4.130 20 0 HIADHN CNS(=O)(=O)c1cccc([C@@H](C)N[C@H]2CCCc3cc(Br)ccc32)c1 ZINC000479081588 894346777 /nfs/dbraw/zinc/34/67/77/894346777.db2.gz RGFQPNLQNYYHOP-YJYMSZOUSA-N 0 3 423.376 4.085 20 0 HIADHN C[C@H](NC(=O)Nc1cccc2c1CN(c1nccs1)C2)[C@@H](c1ccccc1)N(C)C ZINC000479082266 894347701 /nfs/dbraw/zinc/34/77/01/894347701.db2.gz ASMSWDJUWMCICP-KKSFZXQISA-N 0 3 421.570 4.476 20 0 HIADHN CC1CCN([C@@H](CNC(=O)C2CCC(OC(F)F)CC2)c2cccs2)CC1 ZINC000505174717 913862630 /nfs/dbraw/zinc/86/26/30/913862630.db2.gz KJVGCRPHAOMSAV-JCYILVPMSA-N 0 3 400.535 4.435 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)Nc2ccc(C(F)(F)F)nc2)N(C)C)cc1 ZINC000479129900 894397339 /nfs/dbraw/zinc/39/73/39/894397339.db2.gz GRMVVZCHRSJAQY-QGZVFWFLSA-N 0 3 410.440 4.312 20 0 HIADHN CCC[C@H](C)N1Cc2cccc(NS(=O)(=O)c3ccccc3Cn3ccnc3)c2C1 ZINC000479130969 894399442 /nfs/dbraw/zinc/39/94/42/894399442.db2.gz FUEDPMLBRXLHCK-SFHVURJKSA-N 0 3 424.570 4.236 20 0 HIADHN CC[C@H](C)n1nc(C(=O)Nc2c(C)cnn2[C@@H]2CCN(Cc3ccccc3)C2)cc1C ZINC000479184269 894450891 /nfs/dbraw/zinc/45/08/91/894450891.db2.gz HZGPUDHFKIMHFW-GHTZIAJQSA-N 0 3 420.561 4.367 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)NCCc1c[nH]c2cc(Cl)cc(Cl)c12 ZINC000479220127 894482202 /nfs/dbraw/zinc/48/22/02/894482202.db2.gz DPCLBMJHACLLJS-UHFFFAOYSA-N 0 3 423.344 4.384 20 0 HIADHN C[C@@H](NCCCSc1ccccc1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479350918 894647205 /nfs/dbraw/zinc/64/72/05/894647205.db2.gz UUKZJSHFDABXFD-GFCCVEGCSA-N 0 3 419.399 4.474 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)Nc1ccc2c(c1)CCC(=O)N2CC1CC1 ZINC000479384098 894686159 /nfs/dbraw/zinc/68/61/59/894686159.db2.gz XFVSSBQLATZZOS-UHFFFAOYSA-N 0 3 417.509 4.436 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@@H](C)NCc2c(C)c3ccccc3n2C)cc1 ZINC000479440606 894756616 /nfs/dbraw/zinc/75/66/16/894756616.db2.gz WKNKZGDWZAMBTF-GOSISDBHSA-N 0 3 413.587 4.368 20 0 HIADHN Fc1ccc([C@H](NCCCCn2cc(Br)cn2)c2ccccn2)cc1 ZINC000479448055 894764964 /nfs/dbraw/zinc/76/49/64/894764964.db2.gz REVUXEKLEKWWJD-IBGZPJMESA-N 0 3 403.299 4.339 20 0 HIADHN Cc1nc2ccc(Br)cc2c(N2CCC(O[C@@H]3CCOC3)CC2)c1C ZINC000479448407 894767666 /nfs/dbraw/zinc/76/76/66/894767666.db2.gz CLTPBYJSIVAZDS-QGZVFWFLSA-N 0 3 405.336 4.388 20 0 HIADHN OC[C@H](CC(F)F)N[C@@H]1CCCc2c(Br)cc(Br)cc21 ZINC000479452205 894772121 /nfs/dbraw/zinc/77/21/21/894772121.db2.gz IJBHEBBARZBQND-TVQRCGJNSA-N 0 3 413.100 4.195 20 0 HIADHN COC(=O)[C@@H](NC1CCN([C@@H](C)c2ccncc2)CC1)c1ccc(Cl)c(Cl)c1 ZINC000479487637 894809523 /nfs/dbraw/zinc/80/95/23/894809523.db2.gz HVQKOYMYCVJRFG-XOBRGWDASA-N 0 3 422.356 4.418 20 0 HIADHN CC(=O)N1CCC[C@H](CN[C@H](c2ccc3c(c2)OCCO3)c2ccccc2Cl)C1 ZINC000479489290 894810733 /nfs/dbraw/zinc/81/07/33/894810733.db2.gz JLBFGHXHZLGQIP-UZUQRXQVSA-N 0 3 414.933 4.049 20 0 HIADHN COCCCC[C@H](N[C@@H](C)c1cc(S(N)(=O)=O)c(C)cc1C)c1ccccc1 ZINC000479500091 894818177 /nfs/dbraw/zinc/81/81/77/894818177.db2.gz PJPLOOXKWQWSIC-RXVVDRJESA-N 0 3 404.576 4.159 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(OC(F)(F)F)cc1)C(=O)NC(=O)Nc1ccccc1F ZINC000479505614 894820377 /nfs/dbraw/zinc/82/03/77/894820377.db2.gz SSPATRYNVZMPDN-RYUDHWBXSA-N 0 3 413.371 4.112 20 0 HIADHN C[C@H](NCCCc1ccccc1F)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479510897 894824529 /nfs/dbraw/zinc/82/45/29/894824529.db2.gz NNADWMOWFJGPLX-NSHDSACASA-N 0 3 405.322 4.063 20 0 HIADHN C[C@@H](CNC(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1)Oc1ccccc1 ZINC000505251600 913906669 /nfs/dbraw/zinc/90/66/69/913906669.db2.gz PIMKVUPSKXJPJN-LAUBAEHRSA-N 0 3 406.448 4.025 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)Cc3coc4cc(F)ccc34)CC2)c1 ZINC000479533592 894840009 /nfs/dbraw/zinc/84/00/09/894840009.db2.gz AKUZRCBLCCMKMX-UHFFFAOYSA-N 0 3 423.532 4.141 20 0 HIADHN CCS(=O)(=O)c1c(Cl)cccc1CNCC1(c2ccccc2C)CCOCC1 ZINC000479536702 894841035 /nfs/dbraw/zinc/84/10/35/894841035.db2.gz MZYCQBKXSHKKLJ-UHFFFAOYSA-N 0 3 421.990 4.280 20 0 HIADHN CCN(CC)C(=O)Nc1ccc([C@@H](C)N[C@@H](C)C(=O)N2Cc3ccccc3C2)cc1 ZINC000479547315 894847647 /nfs/dbraw/zinc/84/76/47/894847647.db2.gz WRVIMJHSLAHUTL-MSOLQXFVSA-N 0 3 408.546 4.142 20 0 HIADHN Cc1cc2[nH]c(CNCc3ccc(C(=O)N4C[C@H](C)O[C@@H](C)C4)cc3)cc2c(C)c1 ZINC000479560534 894857787 /nfs/dbraw/zinc/85/77/87/894857787.db2.gz AZWMWSKUWJOFSH-OALUTQOASA-N 0 3 405.542 4.324 20 0 HIADHN CN(C(=O)NCc1csc(-c2ccco2)n1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000479579864 894869694 /nfs/dbraw/zinc/86/96/94/894869694.db2.gz NTNFCVDAXJHAJU-LJQANCHMSA-N 0 3 410.543 4.209 20 0 HIADHN Cc1ccc([C@H](OC[C@H](O)CN(C)[C@@H](CO)c2ccccc2)c2ccccc2)cc1 ZINC000479669661 894947610 /nfs/dbraw/zinc/94/76/10/894947610.db2.gz ZECIANGCQAQFGV-UODIDJSMSA-N 0 3 405.538 4.127 20 0 HIADHN CC(C)[C@@](C)(NC(=O)N[C@H](C)C1=CCN(C)CC1)c1ccc(Br)cc1 ZINC000479746877 895045881 /nfs/dbraw/zinc/04/58/81/895045881.db2.gz BVGXUJRFPPGGTB-FOIQADDNSA-N 0 3 408.384 4.270 20 0 HIADHN C[C@H](CN(C(=O)N[C@H](CN1CCCC1)c1ccccc1)[C@@H](C)CO)c1ccccc1 ZINC000479758164 895056913 /nfs/dbraw/zinc/05/69/13/895056913.db2.gz RSHJDXVGXAMOND-ZFGGDYGUSA-N 0 3 409.574 4.020 20 0 HIADHN CC[C@H](NC(=O)N[C@H](CN(C)C)c1ccc(F)cc1)c1ccccc1OC(F)F ZINC000479760201 895060260 /nfs/dbraw/zinc/06/02/60/895060260.db2.gz QWUXOODKTCDKMG-ZWKOTPCHSA-N 0 3 409.452 4.480 20 0 HIADHN COc1cc([C@@H](C)NC(=O)N[C@H](CN(C)C)c2ccc(F)cc2)ccc1OC(C)C ZINC000479790015 895094061 /nfs/dbraw/zinc/09/40/61/895094061.db2.gz QIGNYEKCNADVFV-OXQOHEQNSA-N 0 3 417.525 4.285 20 0 HIADHN COc1ccc([C@@H](C)NC(=O)N[C@H](CN2CCCC2)c2ccccc2)c(C)c1OC ZINC000479791680 895095418 /nfs/dbraw/zinc/09/54/18/895095418.db2.gz WOLJVVQLNZSZGO-WIYYLYMNSA-N 0 3 411.546 4.210 20 0 HIADHN COc1cc(C)c([C@H](C)NC(=O)N[C@H]2CCN(Cc3ccccc3)[C@H]2C)cc1OC ZINC000479817152 895129893 /nfs/dbraw/zinc/12/98/93/895129893.db2.gz OYWLWHDOLIQTBH-WFXMLNOXSA-N 0 3 411.546 4.035 20 0 HIADHN CCN(C(=O)c1cc(OCC(F)F)ccn1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000479839531 895168105 /nfs/dbraw/zinc/16/81/05/895168105.db2.gz OVTZCZOPTAAHMS-AEFFLSMTSA-N 0 3 403.473 4.023 20 0 HIADHN C[C@@H](NC[C@@H](c1cccs1)N1CCOCC1)c1ccc(F)cc1OC(F)F ZINC000479850348 895182053 /nfs/dbraw/zinc/18/20/53/895182053.db2.gz HIOFBSKZIFOMSA-CJNGLKHVSA-N 0 3 400.466 4.213 20 0 HIADHN C[C@H](NC[C@@H](c1cccs1)N1CCOCC1)c1ccc(F)cc1Br ZINC000479851053 895185117 /nfs/dbraw/zinc/18/51/17/895185117.db2.gz NAWSGZLWXOJXIW-GUYCJALGSA-N 0 3 413.356 4.374 20 0 HIADHN O=C(c1c[nH]nc1-c1ccncc1)N1CCN(Cc2ccccc2)C2(CCCCC2)C1 ZINC000479868216 895208086 /nfs/dbraw/zinc/20/80/86/895208086.db2.gz SOFFRWWNHLIQQF-UHFFFAOYSA-N 0 3 415.541 4.133 20 0 HIADHN COc1ccccc1[C@H](CN[C@H](C)c1cc(OC)c(OC)cc1F)N1CCCC1 ZINC000479875491 895219787 /nfs/dbraw/zinc/21/97/87/895219787.db2.gz QTLRZSFTAVGIDG-UZLBHIALSA-N 0 3 402.510 4.339 20 0 HIADHN FC(F)(F)Oc1ccc2c(c1)[C@@H](NCc1ccc(CN3CCOCC3)cc1)CC2 ZINC000479903557 895250841 /nfs/dbraw/zinc/25/08/41/895250841.db2.gz QCSRXDLMMXUUAG-NRFANRHFSA-N 0 3 406.448 4.195 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)[C@@H]1C[C@@H]1c1ccc2ccccc2c1 ZINC000479965784 895319362 /nfs/dbraw/zinc/31/93/62/895319362.db2.gz POLJGRSTMXSRHU-CLJLJLNGSA-N 0 3 414.549 4.216 20 0 HIADHN C[C@@H](C(=O)NCc1ccccc1CN1CCC(O)CC1)c1ccc(Cl)c(Cl)c1 ZINC000479988382 895342128 /nfs/dbraw/zinc/34/21/28/895342128.db2.gz OVVDETBHEPNJPX-OAHLLOKOSA-N 0 3 421.368 4.370 20 0 HIADHN CN(C)CCN(C)C(=O)C12C[C@H]3C[C@@H](C1)CC(C(F)(F)[C@H](F)C(F)(F)F)(C3)C2 ZINC000480097664 895464244 /nfs/dbraw/zinc/46/42/44/895464244.db2.gz YVFWPAVZVKYCTN-HHUWHTLVSA-N 0 3 414.434 4.129 20 0 HIADHN CC[C@@H](Cc1ccccc1)N[C@H]1CCS(=O)(=O)c2ccc(Br)cc21 ZINC000480206574 895609938 /nfs/dbraw/zinc/60/99/38/895609938.db2.gz ACMAJNHWBFSWMI-WMZOPIPTSA-N 0 3 408.361 4.279 20 0 HIADHN Cc1ccc(C[C@@H](C)N[C@H]2CCS(=O)(=O)c3ccc(Br)cc32)s1 ZINC000480206930 895610091 /nfs/dbraw/zinc/61/00/91/895610091.db2.gz BXPLVCVBOSYMFU-BZNIZROVSA-N 0 3 414.390 4.258 20 0 HIADHN CCN(CC)C(=O)c1ccc(CN[C@@H](C)c2ccc(OCc3nccn3C)cc2)cc1 ZINC000480209606 895611951 /nfs/dbraw/zinc/61/19/51/895611951.db2.gz OITSWZQPBAXLMM-IBGZPJMESA-N 0 3 420.557 4.332 20 0 HIADHN COCc1ccc(CN[C@H]2CCCOc3ccc(I)cc32)cc1 ZINC000480237799 895646443 /nfs/dbraw/zinc/64/64/43/895646443.db2.gz ZGWSPWHGRXISTP-SFHVURJKSA-N 0 3 423.294 4.441 20 0 HIADHN CC(C)(CN[C@@H]1CCS(=O)(=O)c2ccc(Br)cc21)c1ccccc1 ZINC000480267015 895675460 /nfs/dbraw/zinc/67/54/60/895675460.db2.gz QKDBZTZKMAVBKK-QGZVFWFLSA-N 0 3 408.361 4.235 20 0 HIADHN O=C1[C@@H](NCc2ccc(OCC3CC3)cc2)CCCN1Cc1ccc(F)cc1F ZINC000480305915 895711118 /nfs/dbraw/zinc/71/11/18/895711118.db2.gz ITSLBCSEOMTXMB-QFIPXVFZSA-N 0 3 400.469 4.034 20 0 HIADHN CC[C@@H](N[C@H](C)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccc(Cl)cc1 ZINC000480335978 895739863 /nfs/dbraw/zinc/73/98/63/895739863.db2.gz YEBPDZLWYHMTQW-IIBYNOLFSA-N 0 3 422.978 4.163 20 0 HIADHN CCN(Cc1cccc(Br)c1)C(=O)NC[C@H](Cc1ccccc1)N(C)C ZINC000480337410 895742114 /nfs/dbraw/zinc/74/21/14/895742114.db2.gz RTIZOKNXVUETAA-FQEVSTJZSA-N 0 3 418.379 4.154 20 0 HIADHN COc1cc([C@@H](C)N[C@@H](CN2CCOCC2)c2ccccc2)ccc1OC(F)F ZINC000480447087 895835072 /nfs/dbraw/zinc/83/50/72/895835072.db2.gz USPBNGLPPVTYES-APWZRJJASA-N 0 3 406.473 4.021 20 0 HIADHN Fc1cc(Br)cc2c1CC[C@H]2N[C@H](CN1CCOCC1)c1ccccc1 ZINC000480451765 895840302 /nfs/dbraw/zinc/84/03/02/895840302.db2.gz YHMNRXJHAWZJLL-NHCUHLMSSA-N 0 3 419.338 4.239 20 0 HIADHN Cc1nc(-c2cccnc2)sc1[C@@H](C)N[C@@H](CN1CCOCC1)c1ccccc1 ZINC000480457052 895843599 /nfs/dbraw/zinc/84/35/99/895843599.db2.gz WCXFVHZJHILPLJ-UTKZUKDTSA-N 0 3 408.571 4.238 20 0 HIADHN Cc1ccc([C@H](CN2CCOCC2)N[C@@H](C)c2ccc(NC(=O)NC(C)C)cc2)cc1 ZINC000480458414 895845280 /nfs/dbraw/zinc/84/52/80/895845280.db2.gz CUMRSPKDZIXIHI-RDPSFJRHSA-N 0 3 424.589 4.249 20 0 HIADHN CN(Cc1cccnc1)C[C@H]1CCN(C(=O)c2cc3c(cc(Cl)cc3Cl)[nH]2)C1 ZINC000480526342 895888455 /nfs/dbraw/zinc/88/84/55/895888455.db2.gz NAKYRWOKWBTOKW-OAHLLOKOSA-N 0 3 417.340 4.464 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)N(C)C3CCC(F)(F)CC3)CC2)c1 ZINC000480543412 895905408 /nfs/dbraw/zinc/90/54/08/895905408.db2.gz RUNXIQIEWXPPHO-UHFFFAOYSA-N 0 3 422.564 4.117 20 0 HIADHN Cc1nc(-c2ccc(NC3CC([NH+]4CCC(C(F)(F)F)CC4)C3)nc2)[n-]c(=O)c1C ZINC000480549174 895909060 /nfs/dbraw/zinc/90/90/60/895909060.db2.gz HCMXLSOJJQIBGI-UHFFFAOYSA-N 0 3 421.467 4.078 20 0 HIADHN FC(F)(F)C1CCN(C2CC(Nc3ccc4nnc(-c5ccsc5)n4n3)C2)CC1 ZINC000480551323 895912332 /nfs/dbraw/zinc/91/23/32/895912332.db2.gz KHHWZPXOUCGNAO-UHFFFAOYSA-N 0 3 422.480 4.070 20 0 HIADHN FC(F)(F)C1CCN(C2CC(Nc3nc(-c4cccnc4)nc4c3CCC4)C2)CC1 ZINC000480563068 895923265 /nfs/dbraw/zinc/92/32/65/895923265.db2.gz ZTRFLKKDGLRCPW-UHFFFAOYSA-N 0 3 417.479 4.245 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)NCc1cc(Br)ccc1F)c1ccco1 ZINC000480594536 895957736 /nfs/dbraw/zinc/95/77/36/895957736.db2.gz IHBXIYFJBIMOQO-WBMJQRKESA-N 0 3 412.303 4.110 20 0 HIADHN C[C@@H](NCc1ccc(C(=O)N2CCN(C)CC2)cc1)c1cc(Cl)cc(Cl)c1 ZINC000480609457 895975822 /nfs/dbraw/zinc/97/58/22/895975822.db2.gz LERWZYKTRQBCHI-OAHLLOKOSA-N 0 3 406.357 4.232 20 0 HIADHN CCOc1ccc([C@H](CC)NCc2ccc(N3CCO[C@H](C)C3)nc2)cc1OCC ZINC000480627714 895995232 /nfs/dbraw/zinc/99/52/32/895995232.db2.gz UQCHKQQWBJWEKS-NQIIRXRSSA-N 0 3 413.562 4.345 20 0 HIADHN CC(C)N(C)c1ccc(CNCc2ccc(-n3ccc(C(F)(F)F)n3)cc2)cn1 ZINC000480669139 896032462 /nfs/dbraw/zinc/03/24/62/896032462.db2.gz OCWPWXYGAMMYDU-UHFFFAOYSA-N 0 3 403.452 4.421 20 0 HIADHN COc1ccc(Cl)cc1C1(CNCc2nccn2-c2ccccc2)CCOCC1 ZINC000480674810 896038866 /nfs/dbraw/zinc/03/88/66/896038866.db2.gz YUTAHMTZPPIWCH-UHFFFAOYSA-N 0 3 411.933 4.372 20 0 HIADHN CCCNC(=O)[C@@H]1CCCN(Cc2cc(-c3c(OC)ccc4ccccc43)no2)C1 ZINC000480678260 896041396 /nfs/dbraw/zinc/04/13/96/896041396.db2.gz JWQLOYILPDMSFX-GOSISDBHSA-N 0 3 407.514 4.242 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)N1CCC[C@@H]1c1ccc2c(c1)OCO2 ZINC000480690137 896052978 /nfs/dbraw/zinc/05/29/78/896052978.db2.gz ZXGJMAYBGCUFHN-LEWJYISDSA-N 0 3 407.514 4.099 20 0 HIADHN CCS(=O)(=O)Nc1ccc([C@@H](C)NCc2ccc(N3CCCCCC3)nc2)cc1 ZINC000480693344 896055979 /nfs/dbraw/zinc/05/59/79/896055979.db2.gz BQLXHWFKECSWJE-GOSISDBHSA-N 0 3 416.591 4.074 20 0 HIADHN COc1ccccc1-c1ccc([C@@H](C)NCc2ccnc(N3CCN(C)CC3)c2)cc1 ZINC000480705203 896067629 /nfs/dbraw/zinc/06/76/29/896067629.db2.gz MOLRLSLYFSPRHG-HXUWFJFHSA-N 0 3 416.569 4.360 20 0 HIADHN Cc1nc(-c2ccccc2)sc1[C@H](C)NCc1ccnc(N2CCN(C)CC2)c1 ZINC000480739890 896100733 /nfs/dbraw/zinc/10/07/33/896100733.db2.gz OEAOXKODHWHBBH-KRWDZBQOSA-N 0 3 407.587 4.116 20 0 HIADHN COc1ccc2ccccc2c1-c1cc(CN2CCC[C@H](CNC(=O)C(C)C)C2)on1 ZINC000480745088 896107598 /nfs/dbraw/zinc/10/75/98/896107598.db2.gz DCWMMWRGJMHHIR-GOSISDBHSA-N 0 3 421.541 4.488 20 0 HIADHN C[C@H](NCCCCN1C(=O)NC2(CCCC2)C1=O)c1cc(Cl)sc1Cl ZINC000480758265 896119659 /nfs/dbraw/zinc/11/96/59/896119659.db2.gz MODMEVHZCAUANR-NSHDSACASA-N 0 3 404.363 4.350 20 0 HIADHN CCS(=O)(=O)Nc1ccc([C@@H](C)NCc2ccnc(OC3CCCC3)c2)cc1 ZINC000480768828 896130730 /nfs/dbraw/zinc/13/07/30/896130730.db2.gz OAIOUHNIYQEPDI-MRXNPFEDSA-N 0 3 403.548 4.015 20 0 HIADHN C[C@@H]1Cc2ccc(Br)cc2CN1CC1CCN(C(=O)C(C)(C)C)CC1 ZINC000480858197 896224174 /nfs/dbraw/zinc/22/41/74/896224174.db2.gz QKBGTYSUIPUMKU-OAHLLOKOSA-N 0 3 407.396 4.480 20 0 HIADHN CCN(Cc1ccc(OC)cc1OC)C(=O)N[C@H](CN1CCCC1)c1ccccc1 ZINC000480862512 896228963 /nfs/dbraw/zinc/22/89/63/896228963.db2.gz HBABAQZGCBYIKX-JOCHJYFZSA-N 0 3 411.546 4.072 20 0 HIADHN C[C@H](NCc1ccc(OCc2ccccc2F)nc1)c1ccc(-n2ccnn2)cc1 ZINC000480878881 896236668 /nfs/dbraw/zinc/23/66/68/896236668.db2.gz SKCJTSJDAGDJCQ-KRWDZBQOSA-N 0 3 403.461 4.231 20 0 HIADHN CC(C)n1c2ccccc2nc1[C@@H]1CCCN1C(=O)CC1(N2CCOCC2)CCCC1 ZINC000480896487 896252799 /nfs/dbraw/zinc/25/27/99/896252799.db2.gz CSAQJFWYRFFESS-QFIPXVFZSA-N 0 3 424.589 4.316 20 0 HIADHN CC(C)NC(=O)Nc1ccc([C@@H](C)NCc2ccc(CN3CCCC3=O)cc2)cc1 ZINC000480899894 896254886 /nfs/dbraw/zinc/25/48/86/896254886.db2.gz PYCJGPROWVSKKX-GOSISDBHSA-N 0 3 408.546 4.190 20 0 HIADHN C[C@@H](NCCCS(=O)(=O)Cc1ccccc1)c1ccc(OC(F)(F)F)cc1 ZINC000480900324 896257137 /nfs/dbraw/zinc/25/71/37/896257137.db2.gz ROJJUYFUCDTLEV-OAHLLOKOSA-N 0 3 401.450 4.241 20 0 HIADHN C[C@@H]1CC[C@H](NCc2cccc(NC(=O)CCN3CCOCC3)c2)c2ccccc21 ZINC000480912372 896269347 /nfs/dbraw/zinc/26/93/47/896269347.db2.gz MWPGFEBZXYXSPU-DVECYGJZSA-N 0 3 407.558 4.076 20 0 HIADHN COc1cc(CN[C@H](C)c2sc(-c3ccccc3F)nc2C)ccc1OCCO ZINC000480912515 896270584 /nfs/dbraw/zinc/27/05/84/896270584.db2.gz UYWLKSSMOQYTOL-CQSZACIVSA-N 0 3 416.518 4.488 20 0 HIADHN CC(C)C[C@@H](NCc1cccc(NC(=O)CCN2CCOCC2)c1)c1cccs1 ZINC000480916840 896275808 /nfs/dbraw/zinc/27/58/08/896275808.db2.gz WQDIQFWNQVJTLG-OAQYLSRUSA-N 0 3 415.603 4.286 20 0 HIADHN CNS(=O)(=O)c1ccc([C@@H](C)NCc2cccc(COc3ccccc3)c2)cc1 ZINC000480918379 896277596 /nfs/dbraw/zinc/27/75/96/896277596.db2.gz APWMYJFYFBPWCD-GOSISDBHSA-N 0 3 410.539 4.025 20 0 HIADHN CCc1cc(NC(=O)N2CCC[C@@H](CN3CCN(c4ccccn4)CC3)C2)ccc1C ZINC000480969533 896307642 /nfs/dbraw/zinc/30/76/42/896307642.db2.gz WFFHOVCJDKNMJQ-NRFANRHFSA-N 0 3 421.589 4.019 20 0 HIADHN CNS(=O)(=O)c1cccc(CN[C@@H](Cc2ccc(Cl)cc2)c2ccccc2)c1 ZINC000481018391 896350105 /nfs/dbraw/zinc/35/01/05/896350105.db2.gz DVIGMLICSGDYJI-QFIPXVFZSA-N 0 3 414.958 4.322 20 0 HIADHN CNS(=O)(=O)c1cccc(CN[C@@H](C)c2ccc(-c3ccc(F)cc3)s2)c1 ZINC000481027725 896356616 /nfs/dbraw/zinc/35/66/16/896356616.db2.gz RWPHNYKVJUDWHY-AWEZNQCLSA-N 0 3 404.532 4.313 20 0 HIADHN COc1ccc2ccccc2c1-c1cc(CN2CCCC[C@@H]2CN2CCOCC2)on1 ZINC000481109819 896434361 /nfs/dbraw/zinc/43/43/61/896434361.db2.gz OOWJLIGFRJUAQC-HXUWFJFHSA-N 0 3 421.541 4.190 20 0 HIADHN COC(=O)C1CCN(CCCNC(=O)c2cc3sc4ccccc4c3s2)CC1 ZINC000481130519 896458698 /nfs/dbraw/zinc/45/86/98/896458698.db2.gz ANIBPVRFJKFHAA-UHFFFAOYSA-N 0 3 416.568 4.121 20 0 HIADHN CNS(=O)(=O)c1ccc([C@H](C)N[C@@H](C)c2ccc(OCCC(C)C)cc2)cc1 ZINC000481166332 896497853 /nfs/dbraw/zinc/49/78/53/896497853.db2.gz CVCURENLPGIGCN-ROUUACIJSA-N 0 3 404.576 4.431 20 0 HIADHN CCOc1ccc([C@H](CC)N[C@H](C)c2ccc(S(=O)(=O)NC)cc2)cc1OCC ZINC000481182790 896524028 /nfs/dbraw/zinc/52/40/28/896524028.db2.gz QEGIIWDOQXXZJI-UZLBHIALSA-N 0 3 420.575 4.194 20 0 HIADHN COc1ccc([C@H](C)NCc2ccccc2OCCN2CCOCC2)c2ccccc12 ZINC000481196799 896550187 /nfs/dbraw/zinc/55/01/87/896550187.db2.gz XQNUJQHJZUPPKZ-FQEVSTJZSA-N 0 3 420.553 4.410 20 0 HIADHN Cc1nn(-c2ccccc2)cc1CCCNC(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C ZINC000481224876 896576251 /nfs/dbraw/zinc/57/62/51/896576251.db2.gz IFBWUKFBSNTZSI-GBXCKJPGSA-N 0 3 419.573 4.104 20 0 HIADHN C[C@@H](NC[C@@H](c1cccc(F)c1)N1CCOCC1)c1ccc(F)cc1OC(F)F ZINC000481231815 896583378 /nfs/dbraw/zinc/58/33/78/896583378.db2.gz IJYPKJXRAFWZAX-KUHUBIRLSA-N 0 3 412.427 4.290 20 0 HIADHN C[C@H](NCc1cccnc1N1CCN(C)CC1)c1ccc(Oc2ccccc2)cc1 ZINC000481243192 896593539 /nfs/dbraw/zinc/59/35/39/896593539.db2.gz SNTSOUXXTMVQJK-FQEVSTJZSA-N 0 3 402.542 4.477 20 0 HIADHN C[C@H](NCc1cccnc1N1CCN(C)CC1)c1ccc(SCC(F)F)cc1 ZINC000481245230 896597071 /nfs/dbraw/zinc/59/70/71/896597071.db2.gz FUPINOLJIQXALM-INIZCTEOSA-N 0 3 406.546 4.041 20 0 HIADHN Cc1cc(C)n(-c2ccc(CN[C@@H](C)c3ccc(NC(=O)NC4CC4)cc3)cn2)n1 ZINC000481306848 896652756 /nfs/dbraw/zinc/65/27/56/896652756.db2.gz NUEJJRFWTUMIMQ-KRWDZBQOSA-N 0 3 404.518 4.019 20 0 HIADHN CCOc1ccccc1Oc1ccc(CN[C@H](C)c2ccc(-n3cnnn3)cc2)cn1 ZINC000481308779 896654727 /nfs/dbraw/zinc/65/47/27/896654727.db2.gz BOQWXEOWVHOHAA-QGZVFWFLSA-N 0 3 416.485 4.099 20 0 HIADHN COc1cc([C@@H](C)N[C@@H](C)c2ccc(OCC(=O)NC3CC3)cc2)ccc1SC ZINC000481317678 896670835 /nfs/dbraw/zinc/67/08/35/896670835.db2.gz YVNFEJHQEBRWSI-JKSUJKDBSA-N 0 3 414.571 4.486 20 0 HIADHN Cc1c([C@@H](C)NCc2cccc(CN3CCOCC3)c2)cnn1-c1ccc(F)cc1 ZINC000481324189 896680602 /nfs/dbraw/zinc/68/06/02/896680602.db2.gz QSNLPAWKYUTERX-GOSISDBHSA-N 0 3 408.521 4.003 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)N[C@H](c1ccc(OC)cc1)C(F)(F)F ZINC000481381927 896781259 /nfs/dbraw/zinc/78/12/59/896781259.db2.gz OCLRJLUEVCSHTA-GOSISDBHSA-N 0 3 401.473 4.206 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)N[C@H](C3CCCC3)C(F)(F)F)CC2)C[C@@H](C)O1 ZINC000481388713 896790485 /nfs/dbraw/zinc/79/04/85/896790485.db2.gz SIKCUYSAOCWGSL-GPMSIDNRSA-N 0 3 419.532 4.028 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N[C@@H](c1ccc(F)cc1)C(F)(F)F)c1ccco1 ZINC000481390149 896793346 /nfs/dbraw/zinc/79/33/46/896793346.db2.gz IRTYYUAREQGWBX-MJEQTWJJSA-N 0 3 401.404 4.451 20 0 HIADHN COc1ccc2oc([C@@H](C)NCc3cccc(OCCN4CCOCC4)c3)c(C)c2c1 ZINC000481422738 896825041 /nfs/dbraw/zinc/82/50/41/896825041.db2.gz LLCXHBIBPLMYNF-LJQANCHMSA-N 0 3 424.541 4.312 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)Nc1cnn(-c2ccc(Cl)cc2)c1)c1ccco1 ZINC000481431101 896831814 /nfs/dbraw/zinc/83/18/14/896831814.db2.gz ZWMHJGZUOGDZFQ-RDTXWAMCSA-N 0 3 401.898 4.370 20 0 HIADHN Cc1noc(-c2ccccc2)c1NC(=O)N1CCC(CN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000481465151 896857652 /nfs/dbraw/zinc/85/76/52/896857652.db2.gz NEJDLSXIYZSOJA-IRXDYDNUSA-N 0 3 412.534 4.003 20 0 HIADHN CC(C)Oc1cncc(C(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)c1 ZINC000481481909 896865342 /nfs/dbraw/zinc/86/53/42/896865342.db2.gz OTCIGHUOXJSAON-UHFFFAOYSA-N 0 3 409.452 4.092 20 0 HIADHN CC(C)Oc1ccc([C@@H](C)NCc2ccc(S(=O)(=O)N(C)C(C)C)cc2)cc1 ZINC000481543780 896904159 /nfs/dbraw/zinc/90/41/59/896904159.db2.gz LISXHWZPGOKXEK-GOSISDBHSA-N 0 3 404.576 4.354 20 0 HIADHN CCOc1ccc(C2(CN[C@H](C)c3nnn(-c4ccccc4)c3C)CCOCC2)cc1 ZINC000481545223 896908084 /nfs/dbraw/zinc/90/80/84/896908084.db2.gz NOOLELLZMGBJJJ-LJQANCHMSA-N 0 3 420.557 4.373 20 0 HIADHN C[C@@H](NCc1cccc(CN2CCO[C@@H](C)C2)c1)c1cnn(Cc2ccccc2)c1 ZINC000481550040 896915866 /nfs/dbraw/zinc/91/58/66/896915866.db2.gz ULCJVTSOSUUJOI-LEWJYISDSA-N 0 3 404.558 4.003 20 0 HIADHN O=C(Nc1cccc(CN[C@H]2CCc3ccc(OC(F)(F)F)cc32)c1)[C@@H]1CCCO1 ZINC000481561603 896938327 /nfs/dbraw/zinc/93/83/27/896938327.db2.gz KOVPDWWCOUBFSZ-PMACEKPBSA-N 0 3 420.431 4.480 20 0 HIADHN O[C@H](CN[C@@H]1CCSc2ccc(F)cc21)COc1ccc(C(F)(F)F)cc1 ZINC000481565779 896944409 /nfs/dbraw/zinc/94/44/09/896944409.db2.gz QXUUBHANSCWGAC-RHSMWYFYSA-N 0 3 401.425 4.411 20 0 HIADHN COc1ccccc1NC(=O)c1ccc(NC(=O)[C@H](C)N2CCCC[C@@H](C)C2)cc1 ZINC000481579787 896959345 /nfs/dbraw/zinc/95/93/45/896959345.db2.gz IPPIUMXVNXNOBA-MSOLQXFVSA-N 0 3 409.530 4.397 20 0 HIADHN Cc1cc(NC(=O)c2coc(Br)c2)cc(N2CCN(C(C)C)CC2)c1 ZINC000481640477 897024701 /nfs/dbraw/zinc/02/47/01/897024701.db2.gz RVULILMMUPRTBF-UHFFFAOYSA-N 0 3 406.324 4.133 20 0 HIADHN Cc1cc(NC(=O)C[C@@H]2OCCc3ccccc32)cc(N2CCN(C(C)C)CC2)c1 ZINC000481653797 897038451 /nfs/dbraw/zinc/03/84/51/897038451.db2.gz VASCSAMPZJBKLK-DEOSSOPVSA-N 0 3 407.558 4.168 20 0 HIADHN CCC(=O)Nc1cccc(C(=O)Nc2cc(C)cc(N3CCN(C(C)C)CC3)c2)c1 ZINC000481660319 897045054 /nfs/dbraw/zinc/04/50/54/897045054.db2.gz KPMLRCABLSIRJW-UHFFFAOYSA-N 0 3 408.546 4.126 20 0 HIADHN Cc1cc(NC(=O)CCc2nc3c(cccc3C)[nH]2)cc(N2CCN(C(C)C)CC2)c1 ZINC000481665342 897048374 /nfs/dbraw/zinc/04/83/74/897048374.db2.gz CHQLQSVWUKGQPN-UHFFFAOYSA-N 0 3 419.573 4.281 20 0 HIADHN CC1(C)CC[C@@H](NCc2ccccc2OCC(=O)NC[C@@H]2CCCO2)c2ccccc21 ZINC000481672690 897054981 /nfs/dbraw/zinc/05/49/81/897054981.db2.gz SGRIZMLYBCNTIW-NZQKXSOJSA-N 0 3 422.569 4.263 20 0 HIADHN COc1ccc(NC(=O)CCN2CCC[C@@]3(C2)OCc2ccccc23)cc1Cl ZINC000481678187 897060674 /nfs/dbraw/zinc/06/06/74/897060674.db2.gz SHUIUMQCFWJHPX-QFIPXVFZSA-N 0 3 400.906 4.199 20 0 HIADHN CCOC(=O)C[C@@](C)(NCC(=O)Nc1c(Cl)cccc1C(F)(F)F)C(C)C ZINC000481698606 897086677 /nfs/dbraw/zinc/08/66/77/897086677.db2.gz UJLJGYOWEYNVDD-QGZVFWFLSA-N 0 3 408.848 4.255 20 0 HIADHN CCOCCOc1ccc(Cl)cc1NC(=O)NC[C@H](c1ccccc1)N(C)C ZINC000481715469 897108297 /nfs/dbraw/zinc/10/82/97/897108297.db2.gz UGXKJMOBUCFMER-LJQANCHMSA-N 0 3 405.926 4.180 20 0 HIADHN O=C1[C@H](N[C@H](c2cc(F)cc(Br)c2)C2CC2)CCCN1CC(F)(F)F ZINC000481768205 897153865 /nfs/dbraw/zinc/15/38/65/897153865.db2.gz PZQSOMMMSTYFEZ-CABCVRRESA-N 0 3 423.248 4.182 20 0 HIADHN O=C1[C@@H](N[C@@H](c2cc(F)cc(Br)c2)C2CC2)CCCN1CC(F)(F)F ZINC000481768589 897155383 /nfs/dbraw/zinc/15/53/83/897155383.db2.gz PZQSOMMMSTYFEZ-LSDHHAIUSA-N 0 3 423.248 4.182 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)c1ccc(-c2cncnc2)cc1F ZINC000481784775 897166568 /nfs/dbraw/zinc/16/65/68/897166568.db2.gz IAFPTAAXURRLAO-SFHVURJKSA-N 0 3 404.489 4.019 20 0 HIADHN O=C(NCCN1CCCC1)c1ccc(NC(=O)C2(Cc3cccc(F)c3)CCC2)cc1 ZINC000481898414 897277492 /nfs/dbraw/zinc/27/74/92/897277492.db2.gz WPKLRWZJEOWCMH-UHFFFAOYSA-N 0 3 423.532 4.003 20 0 HIADHN C[C@@H](Cc1ccccc1C(F)(F)F)NCc1nnc2ccc(C(F)(F)F)cn21 ZINC000481916154 897298813 /nfs/dbraw/zinc/29/88/13/897298813.db2.gz WXXHDJPMWSHBGJ-NSHDSACASA-N 0 3 402.342 4.488 20 0 HIADHN CC[C@@H](NCc1cccc2cccnc21)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000481916589 897298964 /nfs/dbraw/zinc/29/89/64/897298964.db2.gz DPIYZEYKNCOUHX-GOSISDBHSA-N 0 3 403.935 4.037 20 0 HIADHN COc1ccc(-c2ccncc2)cc1CN1CCC(C(=O)N2CCC[C@@H](C)C2)CC1 ZINC000481918713 897302813 /nfs/dbraw/zinc/30/28/13/897302813.db2.gz RPZDJMRZYCOHHC-LJQANCHMSA-N 0 3 407.558 4.228 20 0 HIADHN COc1cc(F)c([C@H](C)N[C@H]2CCN(c3cc(Cl)ccc3OC)C2)cc1OC ZINC000481933762 897317711 /nfs/dbraw/zinc/31/77/11/897317711.db2.gz IJNUKQRVPCEBBJ-ZFWWWQNUSA-N 0 3 408.901 4.434 20 0 HIADHN COc1ccc(-c2nnc(NC(=O)N[C@H]3CCN([C@H](C)c4ccccc4)C3)s2)cc1 ZINC000481974833 897367419 /nfs/dbraw/zinc/36/74/19/897367419.db2.gz SUHPJYQSUQJRPK-QAPCUYQASA-N 0 3 423.542 4.171 20 0 HIADHN Cc1ccc(-c2nc(CCN[C@@H](C)c3ccc(S(C)(=O)=O)c(F)c3)co2)cc1 ZINC000482013269 897412844 /nfs/dbraw/zinc/41/28/44/897412844.db2.gz FWMBXOLCBXPSHE-HNNXBMFYSA-N 0 3 402.491 4.086 20 0 HIADHN CCCCCC(=O)NC1CCN(Cc2ccc(-c3ccc(C(=O)OC)cc3)o2)CC1 ZINC000482017143 897418287 /nfs/dbraw/zinc/41/82/87/897418287.db2.gz NHSPDPXUOMGMPC-UHFFFAOYSA-N 0 3 412.530 4.394 20 0 HIADHN COc1ccc([C@@H](C)NCCC(=O)Nc2cccc(Cl)c2C)cc1NC(C)=O ZINC000482023955 897430574 /nfs/dbraw/zinc/43/05/74/897430574.db2.gz COPJOOFFZXNEAQ-CQSZACIVSA-N 0 3 403.910 4.295 20 0 HIADHN Cc1cc(NC(=O)c2cc(=O)[nH]c3cc(F)ccc32)cc(N2CCN(C(C)C)CC2)c1 ZINC000482032446 897443340 /nfs/dbraw/zinc/44/33/40/897443340.db2.gz KZMLJCRDQCEKHZ-UHFFFAOYSA-N 0 3 422.504 4.171 20 0 HIADHN CCCOc1c(Br)cc(Br)cc1CNC[C@@](C)(O)C1CC1 ZINC000482042807 897461623 /nfs/dbraw/zinc/46/16/23/897461623.db2.gz OOQXDHKAVAADFD-MRXNPFEDSA-N 0 3 421.173 4.251 20 0 HIADHN Cc1cc(NC(=O)c2ccc(NC(=O)C(C)C)cc2)cc(N2CCN(C(C)C)CC2)c1 ZINC000482054522 897481525 /nfs/dbraw/zinc/48/15/25/897481525.db2.gz MQIAQDNWJWGOBZ-UHFFFAOYSA-N 0 3 422.573 4.372 20 0 HIADHN Cc1nc(-c2ccccc2)sc1[C@H](C)NCc1ccc([C@@]2(C)NC(=O)NC2=O)cc1 ZINC000482073192 897509014 /nfs/dbraw/zinc/50/90/14/897509014.db2.gz JRVPAZWZHIVYSY-LFVRLGFBSA-N 0 3 420.538 4.024 20 0 HIADHN COc1ccc(OC)c([C@H](C)N[C@H](C)CC(=O)Nc2cccc(N3CCCC3)c2)c1 ZINC000482087672 897529586 /nfs/dbraw/zinc/52/95/86/897529586.db2.gz GKIGVVBEQTWGAP-MSOLQXFVSA-N 0 3 411.546 4.372 20 0 HIADHN C[C@H]1CCN(C(=O)NC[C@H]2CCO[C@@H]2c2ccccc2)CCN1Cc1ccccc1 ZINC000482089118 897531226 /nfs/dbraw/zinc/53/12/26/897531226.db2.gz OLNHDEUYOZDCMT-TUACAJSNSA-N 0 3 407.558 4.070 20 0 HIADHN CC[C@H](C)n1ncc(NC(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)c1C ZINC000482100561 897546625 /nfs/dbraw/zinc/54/66/25/897546625.db2.gz IRBYYLDCHQKPTP-HRAATJIYSA-N 0 3 401.555 4.374 20 0 HIADHN C[C@H](C(=O)NCCCN1CCN(C)C[C@H]1c1ccccc1)c1cc2ccccc2o1 ZINC000482101643 897548728 /nfs/dbraw/zinc/54/87/28/897548728.db2.gz HXSWRBCRQXWFNR-UGKGYDQZSA-N 0 3 405.542 4.031 20 0 HIADHN COCCC[C@@H](NCC(=O)Nc1ccc(F)cc1)c1ccc(Br)cc1 ZINC000482108257 897557411 /nfs/dbraw/zinc/55/74/11/897557411.db2.gz HEVVSWVDIXSJAW-GOSISDBHSA-N 0 3 409.299 4.284 20 0 HIADHN C[C@@H](C(=O)NCCCCN1CCN(Cc2ccccc2)CC1)c1cc2ccccc2o1 ZINC000482112262 897563542 /nfs/dbraw/zinc/56/35/42/897563542.db2.gz GGPMCSOQFJLELO-OAQYLSRUSA-N 0 3 419.569 4.251 20 0 HIADHN COc1cc([C@@H](C)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)ccc1OC(F)F ZINC000482124351 897581598 /nfs/dbraw/zinc/58/15/98/897581598.db2.gz ROLVCMSWIWCHFZ-VQIMIIECSA-N 0 3 418.484 4.181 20 0 HIADHN CCO[C@@H]1C[C@H](NCC(=O)Nc2cc3c(cc2Cl)OCCCO3)C1(CC)CC ZINC000482144721 897605251 /nfs/dbraw/zinc/60/52/51/897605251.db2.gz BKURJUYEQHRLCP-RBUKOAKNSA-N 0 3 410.942 4.013 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)CCCc2ccccc2Br)CC1 ZINC000482184152 897654757 /nfs/dbraw/zinc/65/47/57/897654757.db2.gz XDWRZIIYBSDGAG-UHFFFAOYSA-N 0 3 419.363 4.488 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(C)c1CN1CCC(O)(Cc2ccc(F)cc2)CC1 ZINC000482284886 897780367 /nfs/dbraw/zinc/78/03/67/897780367.db2.gz SEMNXCRPTQJHCU-UHFFFAOYSA-N 0 3 411.496 4.337 20 0 HIADHN C[C@H](C(=O)Nc1ccc(C(=O)NCCN2CCCC2)cc1)c1cc2ccccc2o1 ZINC000482331438 897835528 /nfs/dbraw/zinc/83/55/28/897835528.db2.gz WMSJVYKMTJTROX-KRWDZBQOSA-N 0 3 405.498 4.001 20 0 HIADHN C[C@@H](C(=O)Nc1ccc(C(=O)NCCN2CCCC2)cc1)c1cc2ccccc2o1 ZINC000482331441 897835689 /nfs/dbraw/zinc/83/56/89/897835689.db2.gz WMSJVYKMTJTROX-QGZVFWFLSA-N 0 3 405.498 4.001 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)N[C@H](c3cccc(C(F)(F)F)c3)C(F)(F)F)[C@@H]2C1 ZINC000482335209 897840327 /nfs/dbraw/zinc/84/03/27/897840327.db2.gz PMRKZUWNGXFCRE-KCPJHIHWSA-N 0 3 409.374 4.044 20 0 HIADHN C[C@H](NC(=O)N[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)C1=CCN(C)CC1 ZINC000482355092 897869989 /nfs/dbraw/zinc/86/99/89/897869989.db2.gz UBZUTBQYFFMEMJ-XHDPSFHLSA-N 0 3 409.374 4.258 20 0 HIADHN CC(C)N(CCN(C)C)C(=O)N[C@H](c1ccc(OC(F)(F)F)cc1)C(F)(F)F ZINC000482359025 897875313 /nfs/dbraw/zinc/87/53/13/897875313.db2.gz BHIGLPSXESUILK-CQSZACIVSA-N 0 3 415.378 4.170 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)c2csc(-c3ccc(F)cc3)n2)c1 ZINC000482415047 897961760 /nfs/dbraw/zinc/96/17/60/897961760.db2.gz ZBKOXOLSFZYZPI-UHFFFAOYSA-N 0 3 413.518 4.162 20 0 HIADHN CC(C)CN(CCN(C)C)C(=O)N[C@@H](c1ccc(OC(F)F)cc1)C(F)(F)F ZINC000482427744 897982518 /nfs/dbraw/zinc/98/25/18/897982518.db2.gz XXSCRMFAMDDHEW-HNNXBMFYSA-N 0 3 411.415 4.121 20 0 HIADHN CN(C)[C@@H](CNC(=O)N[C@@H](c1cccc(F)c1F)C(F)(F)F)c1ccccc1 ZINC000482439820 898000252 /nfs/dbraw/zinc/00/02/52/898000252.db2.gz MVDMWEDNGAGSKI-RDJZCZTQSA-N 0 3 401.379 4.170 20 0 HIADHN C[C@@H](NC(=O)N[C@H](c1ccccc1C(F)(F)F)C(F)(F)F)C1=CCN(C)CC1 ZINC000482451243 898017995 /nfs/dbraw/zinc/01/79/95/898017995.db2.gz MWSMQVBBYIXHBM-IAQYHMDHSA-N 0 3 409.374 4.258 20 0 HIADHN C[C@H](NCc1cccnc1N1CCC(C(N)=O)CC1)c1cccc(-c2ccccc2)c1 ZINC000482452495 898019177 /nfs/dbraw/zinc/01/91/77/898019177.db2.gz MEHIXNNYMWDLAE-IBGZPJMESA-N 0 3 414.553 4.301 20 0 HIADHN CC(C)C[C@@H](NCc1cccnc1N1CCC(C(N)=O)CC1)c1ccc(Cl)cc1 ZINC000482456419 898026185 /nfs/dbraw/zinc/02/61/85/898026185.db2.gz SGNCIKDXIDCFBH-OAQYLSRUSA-N 0 3 414.981 4.314 20 0 HIADHN COc1ccc(Cc2nc(C)c([C@@H](C)NCc3cccc(CO)c3)s2)cc1OC ZINC000482542257 898129540 /nfs/dbraw/zinc/12/95/40/898129540.db2.gz XPKLKOIRMASSLS-OAHLLOKOSA-N 0 3 412.555 4.403 20 0 HIADHN C[C@@H](N[C@H](C)c1cc(F)ccc1N1CCN(C)CC1)c1cnn(Cc2ccccc2)c1 ZINC000482550218 898140324 /nfs/dbraw/zinc/14/03/24/898140324.db2.gz PNRHHNODOBAWEH-WOJBJXKFSA-N 0 3 421.564 4.234 20 0 HIADHN CC[C@@H](N[C@H](C)c1cc(F)ccc1N1CCN(C)CC1)c1ccc2c(c1)OCCO2 ZINC000482565128 898157794 /nfs/dbraw/zinc/15/77/94/898157794.db2.gz MPMXLKGMYSRVLJ-DYESRHJHSA-N 0 3 413.537 4.151 20 0 HIADHN COc1cc(C)c([C@H](C)N[C@@H](C)c2cc(F)ccc2N2CCN(C)CC2)cc1OC ZINC000482567955 898162424 /nfs/dbraw/zinc/16/24/24/898162424.db2.gz UODLPAZRUVAURR-ROUUACIJSA-N 0 3 415.553 4.315 20 0 HIADHN Cc1c([C@H](C)NC[C@@H](O)COc2ccc(F)c(F)c2)cnn1-c1cccc(Cl)c1 ZINC000482568630 898163439 /nfs/dbraw/zinc/16/34/39/898163439.db2.gz HXOQDVHHMYJZSS-SUMWQHHRSA-N 0 3 421.875 4.203 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)[C@]12CCC(=O)N1c1cc(Cl)ccc1S2 ZINC000482587534 898186270 /nfs/dbraw/zinc/18/62/70/898186270.db2.gz OGSFKBNEKIOSJF-OAQYLSRUSA-N 0 3 415.946 4.278 20 0 HIADHN CCCN(C(=O)NCCn1cnc2ccccc21)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000482609868 898211062 /nfs/dbraw/zinc/21/10/62/898211062.db2.gz YYJQEHHXZUBPSY-QFIPXVFZSA-N 0 3 419.573 4.123 20 0 HIADHN CN1C(=O)C[C@@H](NCc2cc(Cl)cc3cccnc32)[C@@H]1c1ccc(F)c(F)c1 ZINC000482702028 898301942 /nfs/dbraw/zinc/30/19/42/898301942.db2.gz AOXTZIUYMRTERB-NQIIRXRSSA-N 0 3 401.844 4.228 20 0 HIADHN CN1C(=O)C[C@@H](NCc2cccc(OCc3ccccn3)c2)[C@@H]1c1ccc(F)c(F)c1 ZINC000482719583 898321796 /nfs/dbraw/zinc/32/17/96/898321796.db2.gz CIYIBDXTVFCJRL-VWNXMTODSA-N 0 3 423.463 4.000 20 0 HIADHN CCN1C[C@@H](C)N(CCOc2c(Br)cccc2Br)C[C@H]1C ZINC000482799317 898407774 /nfs/dbraw/zinc/40/77/74/898407774.db2.gz SAJPWWGSGPGRLW-CHWSQXEVSA-N 0 3 420.189 4.005 20 0 HIADHN C[C@@H](CNC(=O)c1cccc(CN2CCCC2)c1)Oc1ccccc1Br ZINC000482812291 898423010 /nfs/dbraw/zinc/42/30/10/898423010.db2.gz XLIRIDFHAVXZSO-INIZCTEOSA-N 0 3 417.347 4.242 20 0 HIADHN CCCN(C(=O)NCC1(N2CCSCC2)CCCC1)[C@@H]1CCCc2cccnc21 ZINC000482858482 898470562 /nfs/dbraw/zinc/47/05/62/898470562.db2.gz PPKHMNXKYDIPLC-HXUWFJFHSA-N 0 3 416.635 4.242 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)CSc2nccc3ccccc32)CC1 ZINC000482863488 898474199 /nfs/dbraw/zinc/47/41/99/898474199.db2.gz UZCQPGDKLIQBDK-UHFFFAOYSA-N 0 3 405.567 4.450 20 0 HIADHN C[C@@H](NCc1ccc(-c2nc3ccccc3[nH]2)cc1)c1cccc(NS(C)(=O)=O)c1 ZINC000482948773 898575966 /nfs/dbraw/zinc/57/59/66/898575966.db2.gz RWHVBXMSLNXHDB-MRXNPFEDSA-N 0 3 420.538 4.452 20 0 HIADHN C[C@@H](NCCC(=O)Nc1ccccc1)c1ccc(S(=O)(=O)C2CCCC2)cc1 ZINC000482957093 898586969 /nfs/dbraw/zinc/58/69/69/898586969.db2.gz HZVJHYHGBZACEK-QGZVFWFLSA-N 0 3 400.544 4.082 20 0 HIADHN O=C(Nc1ccc(C(=O)N2CCCCCC2)cc1)N1CCN(C2CCCCC2)CC1 ZINC000482978017 898613973 /nfs/dbraw/zinc/61/39/73/898613973.db2.gz KGSXSOBVWBWNTK-UHFFFAOYSA-N 0 3 412.578 4.185 20 0 HIADHN O=C(Nc1cccc(NC(=O)N2CCN(C3CCCCC3)CC2)c1)c1ccccc1 ZINC000483039828 898707369 /nfs/dbraw/zinc/70/73/69/898707369.db2.gz FFCKYKJSGZXTTO-UHFFFAOYSA-N 0 3 406.530 4.421 20 0 HIADHN C[C@H]1CN(C(=O)Nc2ccccc2SC2CCCC2)CC[C@H]1N1CCN(C)CC1 ZINC000483056621 898730095 /nfs/dbraw/zinc/73/00/95/898730095.db2.gz HCHHJVBAFHEYDY-GHTZIAJQSA-N 0 3 416.635 4.211 20 0 HIADHN CC(C)C[C@](C)(N[C@H]1CCN(C2CCOCC2)C1=O)c1cccc(Br)c1 ZINC000483060195 898737500 /nfs/dbraw/zinc/73/75/00/898737500.db2.gz VMAFCRUWSPJTKJ-FPOVZHCZSA-N 0 3 423.395 4.080 20 0 HIADHN Cc1ccccc1[C@@H](N[C@@H](C)c1cccc(S(=O)(=O)N2CCOCC2)c1)C(C)C ZINC000483117025 898805725 /nfs/dbraw/zinc/80/57/25/898805725.db2.gz WVOIDOLKEHWULU-CVDCTZTESA-N 0 3 416.587 4.064 20 0 HIADHN C[C@H](NC(=O)[C@H]1CCn2c(cnc2C2CCCCC2)C1)[C@@H](c1ccccc1)N(C)C ZINC000505580459 914286807 /nfs/dbraw/zinc/28/68/07/914286807.db2.gz GQTGZYXWGQUTPO-HARLFGEKSA-N 0 3 408.590 4.301 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N2CCC(c3ccc(Cl)cc3)CC2)CC1 ZINC000483154393 898828033 /nfs/dbraw/zinc/82/80/33/898828033.db2.gz UZFWTYHREASZPB-UHFFFAOYSA-N 0 3 407.986 4.118 20 0 HIADHN CCc1ccc(Cl)c(CC)c1NC(=O)CCCN1C[C@@H](C)O[C@]2(CCOC2)C1 ZINC000483172886 898840411 /nfs/dbraw/zinc/84/04/11/898840411.db2.gz LVJXYKZXLQWOJZ-OPAMFIHVSA-N 0 3 408.970 4.063 20 0 HIADHN CC(C)N(C)c1ccc(CN2CCC[C@@H](CNC(=O)Nc3cccc(F)c3)C2)cn1 ZINC000483287291 898923248 /nfs/dbraw/zinc/92/32/48/898923248.db2.gz USYNOMLSWYRQII-SFHVURJKSA-N 0 3 413.541 4.099 20 0 HIADHN COCc1c(Br)cccc1NC(=O)N1CCN(C2CCCCC2)CC1 ZINC000483338672 898968401 /nfs/dbraw/zinc/96/84/01/898968401.db2.gz QKIAUZFDQPTAIH-UHFFFAOYSA-N 0 3 410.356 4.078 20 0 HIADHN C[C@@H]1CN(CCC(=O)Nc2ccc(Oc3ccccc3)cc2)C[C@@]2(CCCOC2)O1 ZINC000483367090 899004264 /nfs/dbraw/zinc/00/42/64/899004264.db2.gz LDCDTLRNEYLLTA-NTKDMRAZSA-N 0 3 410.514 4.077 20 0 HIADHN CO[C@H](c1ccccc1Cl)[C@@H](C)NC(=O)N(CCN(C)C)Cc1ccc(C)o1 ZINC000483436178 899070166 /nfs/dbraw/zinc/07/01/66/899070166.db2.gz ZCQZOCWTOMNHGP-UZLBHIALSA-N 0 3 407.942 4.091 20 0 HIADHN Cc1ccc(NC(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)cc1C(=O)N(C)C(C)C ZINC000483450687 899087279 /nfs/dbraw/zinc/08/72/79/899087279.db2.gz WYHNPPGOPKZKLE-GCJKJVERSA-N 0 3 410.562 4.288 20 0 HIADHN CC[C@@H](N[C@H](C)c1ccc(S(=O)(=O)N2CCCCC2)cc1)c1c(C)nn(C)c1C ZINC000483454088 899091827 /nfs/dbraw/zinc/09/18/27/899091827.db2.gz KUHSVIIACAWYOF-IIBYNOLFSA-N 0 3 418.607 4.013 20 0 HIADHN COc1ccccc1OCc1ccc(C(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)o1 ZINC000505610890 914314247 /nfs/dbraw/zinc/31/42/47/914314247.db2.gz NBJVRJDRUJGVLG-SBUREZEXSA-N 0 3 408.498 4.288 20 0 HIADHN C[C@@H](NC(=O)CSCc1cc(-c2cccs2)on1)[C@H](c1ccccc1)N(C)C ZINC000505611885 914316056 /nfs/dbraw/zinc/31/60/56/914316056.db2.gz OYKMOUQTFDKEML-QVKFZJNVSA-N 0 3 415.584 4.444 20 0 HIADHN C[C@@H](NC(=O)[C@@H]1CCO[C@H]1c1ccc(Cl)c(F)c1)[C@H](c1ccccc1)N(C)C ZINC000505615254 914317418 /nfs/dbraw/zinc/31/74/18/914317418.db2.gz VTSAEYWXTRCVST-NVGWVTIJSA-N 0 3 404.913 4.364 20 0 HIADHN C[C@H](NC(=O)c1cccc(CSc2nccn2C)c1)[C@@H](c1ccccc1)N(C)C ZINC000505616057 914320059 /nfs/dbraw/zinc/32/00/59/914320059.db2.gz ZWJNATWGLHHBGB-UWJYYQICSA-N 0 3 408.571 4.134 20 0 HIADHN C[C@@H](NC(=O)c1cccc(CSc2nccn2C)c1)[C@H](c1ccccc1)N(C)C ZINC000505616049 914320353 /nfs/dbraw/zinc/32/03/53/914320353.db2.gz ZWJNATWGLHHBGB-DYESRHJHSA-N 0 3 408.571 4.134 20 0 HIADHN CCOc1cc2c(cc1[C@@H]1C[C@@H]1C(=O)N[C@H](C)[C@@H](c1ccccc1)N(C)C)O[C@@H](C)C2 ZINC000505629412 914328886 /nfs/dbraw/zinc/32/88/86/914328886.db2.gz IFMHSUONIRBVEC-SJSPJNMXSA-N 0 3 422.569 4.320 20 0 HIADHN C[C@H](NC(=O)c1c[nH]nc1-c1cccc(OC(F)F)c1)[C@@H](c1ccccc1)N(C)C ZINC000505629440 914329487 /nfs/dbraw/zinc/32/94/87/914329487.db2.gz IIMCAFNIDDDLBC-XOBRGWDASA-N 0 3 414.456 4.099 20 0 HIADHN C[C@@H](NC(=O)c1cccc(C(=O)N(C)CC(C)(C)C)c1)[C@H](c1ccccc1)N(C)C ZINC000505638733 914340270 /nfs/dbraw/zinc/34/02/70/914340270.db2.gz VCKROYKVLRUUCP-XMSQKQJNSA-N 0 3 409.574 4.226 20 0 HIADHN CNC(=O)[C@H](Cc1c[nH]c2ccccc12)N[C@H]1CCc2ccc(OC(F)(F)F)cc21 ZINC000483710537 899366596 /nfs/dbraw/zinc/36/65/96/899366596.db2.gz HUVOHXLNAXFFBN-PMACEKPBSA-N 0 3 417.431 4.001 20 0 HIADHN CNS(=O)(=O)c1ccc([C@H](C)NCc2ccc(-c3cccc(OC)c3)cc2)cc1 ZINC000483712556 899369057 /nfs/dbraw/zinc/36/90/57/899369057.db2.gz LKWCOUOTNCJSSN-KRWDZBQOSA-N 0 3 410.539 4.121 20 0 HIADHN Cc1nc(C)c([C@H](C)NCc2cc(C(F)(F)F)ccc2N2CCN(C)CC2)s1 ZINC000483732332 899393696 /nfs/dbraw/zinc/39/36/96/899393696.db2.gz MHNDHNSQSSEYKV-ZDUSSCGKSA-N 0 3 412.525 4.381 20 0 HIADHN Cc1cc(C(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)nc(-c2ccc(Cl)cc2)n1 ZINC000505644403 914345334 /nfs/dbraw/zinc/34/53/34/914345334.db2.gz ATWOVSBRXYWNJC-NRFANRHFSA-N 0 3 420.944 4.452 20 0 HIADHN Cc1ccc(NC(=O)NCC2(N3CCSCC3)CCCC2)cc1-c1ncco1 ZINC000483784194 899451610 /nfs/dbraw/zinc/45/16/10/899451610.db2.gz AXYQWNOJGMYVNV-UHFFFAOYSA-N 0 3 400.548 4.133 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2ccc(CC(F)(F)F)cc2)c1 ZINC000483788428 899458492 /nfs/dbraw/zinc/45/84/92/899458492.db2.gz NNSVBCXCBADVLD-UHFFFAOYSA-N 0 3 409.452 4.396 20 0 HIADHN Cc1ccc(NC(=O)[C@@H](C)NC(=O)c2cccc(Cl)c2Cl)c(CN(C)C)c1 ZINC000505652769 914350057 /nfs/dbraw/zinc/35/00/57/914350057.db2.gz BAUPQIOYIJIUGN-CYBMUJFWSA-N 0 3 408.329 4.120 20 0 HIADHN COc1cccc([C@H](CNC(=O)NC2(c3ccc(Cl)cc3)CC2)N2CCCC2)c1 ZINC000483849597 899530833 /nfs/dbraw/zinc/53/08/33/899530833.db2.gz VFWQPWQDCPALDR-NRFANRHFSA-N 0 3 413.949 4.474 20 0 HIADHN CC[C@H](N[C@@H](C)c1cccc(-n2cccn2)c1)c1ccccc1OCC(=O)N(C)C ZINC000483851832 899534128 /nfs/dbraw/zinc/53/41/28/899534128.db2.gz LMUHKFPXDIOJCZ-AVRDEDQJSA-N 0 3 406.530 4.141 20 0 HIADHN COCCOc1ccc([C@H](C)NCc2cc(N(C)C)nc3ccccc23)cc1OC ZINC000483855495 899539176 /nfs/dbraw/zinc/53/91/76/899539176.db2.gz DZDAFDYYIPLNHZ-KRWDZBQOSA-N 0 3 409.530 4.185 20 0 HIADHN CN(C)[C@H](CNC(=O)Nc1ccc(-n2nccc2C(F)(F)F)cc1)c1ccccc1 ZINC000505658633 914357642 /nfs/dbraw/zinc/35/76/42/914357642.db2.gz IKAYZYMOUCWMJP-GOSISDBHSA-N 0 3 417.435 4.316 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N[C@H](C)c1cccc(Cl)c1Cl ZINC000483908589 899577584 /nfs/dbraw/zinc/57/75/84/899577584.db2.gz CDRSXBFEZMUTMN-CYBMUJFWSA-N 0 3 408.329 4.179 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N[C@@H]1CCc2c1ccc(Cl)c2Cl ZINC000483931402 899590589 /nfs/dbraw/zinc/59/05/89/899590589.db2.gz SFBFJRPFQGOBGE-QGZVFWFLSA-N 0 3 420.340 4.106 20 0 HIADHN COc1ccc(-c2noc(CCCC(=O)Nc3ccc(C)cc3CN(C)C)n2)cc1 ZINC000505666337 914363912 /nfs/dbraw/zinc/36/39/12/914363912.db2.gz XNAMRZSLWFZHJZ-UHFFFAOYSA-N 0 3 408.502 4.077 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2cccc(-c3nccc(C)n3)c2)c1 ZINC000484036546 899667250 /nfs/dbraw/zinc/66/72/50/899667250.db2.gz UTRPSOACEVICBW-UHFFFAOYSA-N 0 3 419.529 4.056 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N(C)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000484162256 899781750 /nfs/dbraw/zinc/78/17/50/899781750.db2.gz JXNHSFZTDYTKMQ-HNNXBMFYSA-N 0 3 421.463 4.234 20 0 HIADHN CCCCCN(Cc1ccc(F)cc1)C(=O)C(=O)Nc1cc(CN(C)C)ccc1C ZINC000484222015 899820531 /nfs/dbraw/zinc/82/05/31/899820531.db2.gz MZGFYVJVNPGRBF-UHFFFAOYSA-N 0 3 413.537 4.353 20 0 HIADHN CSc1cccc(N(C(=O)CCOc2ccc(F)cc2)C2CCN(C)CC2)c1 ZINC000484282275 899849702 /nfs/dbraw/zinc/84/97/02/899849702.db2.gz KGUYWVLOHOERQE-UHFFFAOYSA-N 0 3 402.535 4.444 20 0 HIADHN C[C@H](N[C@@H]1c2cccc(F)c2CC[C@H]1C)c1cccc(N2CCCS2(=O)=O)c1 ZINC000484287128 899853134 /nfs/dbraw/zinc/85/31/34/899853134.db2.gz FPOZMYRNCKPIBA-VVBPWWLESA-N 0 3 402.535 4.340 20 0 HIADHN CSc1cccc(N(C(=O)[C@@H]2Oc3ccccc3O[C@@H]2C)C2CCN(C)CC2)c1 ZINC000484290809 899855623 /nfs/dbraw/zinc/85/56/23/899855623.db2.gz CZCQGXJHDRBVCG-OPAMFIHVSA-N 0 3 412.555 4.064 20 0 HIADHN Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)N[C@H](C(=O)N1CCOCC1)C(C)C ZINC000484302184 899863942 /nfs/dbraw/zinc/86/39/42/899863942.db2.gz PCDZJMIMUKXETM-KSSFIOAISA-N 0 3 421.994 4.306 20 0 HIADHN COc1cc(C(=O)N(c2cccc(SC)c2)C2CCN(C)CC2)cc(OC)c1C ZINC000484316736 899874945 /nfs/dbraw/zinc/87/49/45/899874945.db2.gz SKXWWDFEKSHVGV-UHFFFAOYSA-N 0 3 414.571 4.475 20 0 HIADHN COc1ccc(OC)c(C(=O)N(c2cccc(SC)c2)C2CCN(C)CC2)c1 ZINC000484405533 899929144 /nfs/dbraw/zinc/92/91/44/899929144.db2.gz OVPUPONUELPXPV-UHFFFAOYSA-N 0 3 400.544 4.167 20 0 HIADHN CSc1cccc(N(C(=O)c2cnn(-c3ccccc3)c2)C2CCN(C)CC2)c1 ZINC000484411309 899933473 /nfs/dbraw/zinc/93/34/73/899933473.db2.gz ZFHFAXSWNMQHBE-UHFFFAOYSA-N 0 3 406.555 4.335 20 0 HIADHN CSc1cccc(N(C(=O)c2ccc(Cn3cccn3)cc2)C2CCN(C)CC2)c1 ZINC000484413765 899933544 /nfs/dbraw/zinc/93/35/44/899933544.db2.gz YVJGGJWMKZPXJZ-UHFFFAOYSA-N 0 3 420.582 4.394 20 0 HIADHN COc1ccc([C@@H](CN2C(=O)[C@@H]3CC[C@@H](c4ccccc4)N3C2=O)N2CCCC2)cc1 ZINC000484438732 899945543 /nfs/dbraw/zinc/94/55/43/899945543.db2.gz ZCZKRASSCHQKCZ-RJGXRXQPSA-N 0 3 419.525 4.000 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2nc3c(ccc(F)c3F)s2)c1 ZINC000484475274 899967607 /nfs/dbraw/zinc/96/76/07/899967607.db2.gz NPBPSARVBMIOES-UHFFFAOYSA-N 0 3 420.485 4.179 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2cnn(CC(C)C)c2C(F)F)c1 ZINC000484491963 899984610 /nfs/dbraw/zinc/98/46/10/899984610.db2.gz JYICAUJJLJLJAX-UHFFFAOYSA-N 0 3 423.508 4.081 20 0 HIADHN O=C(C1CCCCC1)N1CC[C@@H](N[C@@H]2CCCOc3ccc(Br)cc32)C1 ZINC000484510239 900002580 /nfs/dbraw/zinc/00/25/80/900002580.db2.gz WMLRSDZBLZDGTP-IEBWSBKVSA-N 0 3 421.379 4.434 20 0 HIADHN CCS(=O)(=O)Nc1ccc([C@H](C)NCc2ccc(C)cc2OCC2CC2)cc1 ZINC000484608843 900067081 /nfs/dbraw/zinc/06/70/81/900067081.db2.gz ULCRDCOPPUIMAD-KRWDZBQOSA-N 0 3 402.560 4.396 20 0 HIADHN CCc1c(NC(=O)N[C@@H](C)C2=CCN(C)CC2)cnn1-c1ccc(C(F)(F)F)cc1 ZINC000484812901 900215769 /nfs/dbraw/zinc/21/57/69/900215769.db2.gz NIZXXMNCSKYPEC-AWEZNQCLSA-N 0 3 421.467 4.225 20 0 HIADHN CCc1c(NC(=O)N[C@@H]2CCCN(C)[C@H]2C)cnn1-c1ccc(C(F)(F)F)cc1 ZINC000484817460 900219876 /nfs/dbraw/zinc/21/98/76/900219876.db2.gz BCBSVTFBOUVDHR-XJKSGUPXSA-N 0 3 409.456 4.058 20 0 HIADHN CCc1c(NC(=O)N[C@H]2CCCN(C)[C@@H]2C)cnn1-c1ccc(C(F)(F)F)cc1 ZINC000484817455 900219975 /nfs/dbraw/zinc/21/99/75/900219975.db2.gz BCBSVTFBOUVDHR-CJNGLKHVSA-N 0 3 409.456 4.058 20 0 HIADHN Cc1ccc(S(=O)(=O)CCCN[C@@H](C)c2ccc(OC(F)(F)F)cc2)cc1 ZINC000484897207 900279106 /nfs/dbraw/zinc/27/91/06/900279106.db2.gz XAMCBBHEMDBDNA-HNNXBMFYSA-N 0 3 401.450 4.408 20 0 HIADHN COc1ccccc1-c1csc(C2CCN(C[C@@H](O)COCC(C)C)CC2)n1 ZINC000485105476 900412702 /nfs/dbraw/zinc/41/27/02/900412702.db2.gz JRMCTHCSERALID-GOSISDBHSA-N 0 3 404.576 4.032 20 0 HIADHN COCCN(CC(=O)N1CC=C(c2c[nH]c3ccccc32)CC1)C[C@@H]1CC=CCC1 ZINC000485106254 900414367 /nfs/dbraw/zinc/41/43/67/900414367.db2.gz JOIYALNKKZKYGK-HXUWFJFHSA-N 0 3 407.558 4.088 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2cc(F)ccc2OCC2CC2)c1 ZINC000485264614 900547269 /nfs/dbraw/zinc/54/72/69/900547269.db2.gz RASDFZXAXUQFCD-UHFFFAOYSA-N 0 3 415.509 4.219 20 0 HIADHN CN(C)Cc1ccc(-c2noc(-c3ccccc3N(C)C(=O)c3ccco3)n2)cc1 ZINC000485280524 900557892 /nfs/dbraw/zinc/55/78/92/900557892.db2.gz AIHLLKUEQWJFFE-UHFFFAOYSA-N 0 3 402.454 4.335 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)NCc1ccc(Oc2cccnc2)c(F)c1 ZINC000485283421 900560801 /nfs/dbraw/zinc/56/08/01/900560801.db2.gz GBFOIRDETXWSTC-UHFFFAOYSA-N 0 3 414.525 4.421 20 0 HIADHN CCc1c(NC(=O)N(CCN(C)C)C2CCCC2)cnn1-c1ccc(Cl)cc1 ZINC000485318238 900597993 /nfs/dbraw/zinc/59/79/93/900597993.db2.gz KOIHQQTXGPOZLA-UHFFFAOYSA-N 0 3 403.958 4.426 20 0 HIADHN CC[C@H](C)n1ncc(NC(=O)NC[C@H](c2cccc(OC)c2)N(CC)CC)c1C ZINC000485350947 900644845 /nfs/dbraw/zinc/64/48/45/900644845.db2.gz QVDLVFPDDAVXRJ-HRAATJIYSA-N 0 3 401.555 4.376 20 0 HIADHN C[C@H](NC(=O)NCc1nc2cc(Cl)ccc2s1)[C@H](c1ccccc1)N(C)C ZINC000485399543 900697734 /nfs/dbraw/zinc/69/77/34/900697734.db2.gz GQNWFPRWCDHAPT-ORAYPTAESA-N 0 3 402.951 4.440 20 0 HIADHN Cc1c2ccc(NC(=O)[C@@]3(C(F)(F)F)CCN(Cc4ccccc4)C3)cc2nn1C ZINC000485443949 900740054 /nfs/dbraw/zinc/74/00/54/900740054.db2.gz FUCCCRVYWTZBKQ-OAQYLSRUSA-N 0 3 416.447 4.275 20 0 HIADHN O=S(=O)(Cc1ccccc1C(F)(F)F)N1C[C@@H]2CCCN2Cc2ccccc21 ZINC000485448328 900743593 /nfs/dbraw/zinc/74/35/93/900743593.db2.gz XTMRBQHLFWAYDO-KRWDZBQOSA-N 0 3 410.461 4.020 20 0 HIADHN Cc1cc2occ(CC(=O)Nc3ccc(C(=O)NCCN4CCCC4)cc3)c2cc1C ZINC000485482394 900774741 /nfs/dbraw/zinc/77/47/41/900774741.db2.gz QSUGMRGYPQSVEN-UHFFFAOYSA-N 0 3 419.525 4.056 20 0 HIADHN CSc1cccc(N(C(=O)CCOCC(F)(F)C(F)F)C2CCN(C)CC2)c1 ZINC000485519116 900802663 /nfs/dbraw/zinc/80/26/63/900802663.db2.gz NADYGHCUAHIQSU-UHFFFAOYSA-N 0 3 422.488 4.143 20 0 HIADHN CC(C)c1cccc(O[C@@H](C)C(=O)Nc2ccc(C(=O)NCCN3CCCC3)cc2)c1 ZINC000485526117 900807569 /nfs/dbraw/zinc/80/75/69/900807569.db2.gz JZZNCTJSMZMZJM-IBGZPJMESA-N 0 3 423.557 4.042 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)NCc2ccc(OC(F)(F)F)cc2)CC1 ZINC000485597743 900858582 /nfs/dbraw/zinc/85/85/82/900858582.db2.gz ILTQWQWTWYILHW-UHFFFAOYSA-N 0 3 421.463 4.391 20 0 HIADHN CN(C)Cc1ccccc1C(=O)NC[C@H](c1ccccc1)N1CCc2sccc2C1 ZINC000485604000 900862994 /nfs/dbraw/zinc/86/29/94/900862994.db2.gz UDFYTTLJWDGTHB-HSZRJFAPSA-N 0 3 419.594 4.339 20 0 HIADHN O=C(NCc1ccc(Oc2cccnc2)c(F)c1)N1CCN(C2CCCCC2)CC1 ZINC000485623406 900878605 /nfs/dbraw/zinc/87/86/05/900878605.db2.gz GDVCKIKATGKZSU-UHFFFAOYSA-N 0 3 412.509 4.173 20 0 HIADHN C[C@@H]1Cc2ccccc2N1C(=O)[C@H]1CCCC[C@H]1C(=O)Nc1cccc(CN(C)C)c1 ZINC000485768177 901024344 /nfs/dbraw/zinc/02/43/44/901024344.db2.gz VEELIDJHOOCQOR-YSZBQJHXSA-N 0 3 419.569 4.471 20 0 HIADHN Cc1ccc(-c2ccc(C(=O)N3CC[C@H](N4CCN(C)CC4)[C@@H](C)C3)c(F)c2)cc1C ZINC000485783495 901038246 /nfs/dbraw/zinc/03/82/46/901038246.db2.gz HBWHHRRJWZUQPL-CPJSRVTESA-N 0 3 423.576 4.208 20 0 HIADHN C[C@@H](NCCN1c2cccc3cccc(c23)S1(=O)=O)c1ccc2ncsc2c1 ZINC000485794935 901046919 /nfs/dbraw/zinc/04/69/19/901046919.db2.gz FRTODQZPUBGVNO-CQSZACIVSA-N 0 3 409.536 4.309 20 0 HIADHN C[C@H](CNC(=O)c1ccc(NC(=O)Nc2ccccc2)s1)N1CCCC[C@@H]1C ZINC000485914605 901140620 /nfs/dbraw/zinc/14/06/20/901140620.db2.gz CAGBRKMMVQLJCQ-JKSUJKDBSA-N 0 3 400.548 4.385 20 0 HIADHN C[C@H]1C[C@H](C(=O)N2CCC(N(C)Cc3cccc(C(F)(F)F)c3)CC2)CCC1=O ZINC000485943064 901162390 /nfs/dbraw/zinc/16/23/90/901162390.db2.gz GXZZOZIIALIGSP-DOTOQJQBSA-N 0 3 410.480 4.134 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)Nc3cccc(Br)c3)CC2)C[C@H](C)O1 ZINC000485976789 901193119 /nfs/dbraw/zinc/19/31/19/901193119.db2.gz HZZXKMNGCFNVNM-HOTGVXAUSA-N 0 3 424.383 4.192 20 0 HIADHN CN(C)Cc1ccccc1C(=O)NCc1cccc(NC(=O)c2cccc(F)c2)c1 ZINC000485981617 901200819 /nfs/dbraw/zinc/20/08/19/901200819.db2.gz RHXPXHQMFIEIGM-UHFFFAOYSA-N 0 3 405.473 4.070 20 0 HIADHN Cc1ccc(F)c(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)c1Br ZINC000486117084 901303083 /nfs/dbraw/zinc/30/30/83/901303083.db2.gz FAWHBRRHHLWNMD-WMLDXEAASA-N 0 3 405.311 4.147 20 0 HIADHN Cc1ccc(S(=O)(=O)N[C@H](CCN2CCC(C(F)F)CC2)c2ccccc2)cc1 ZINC000486125299 901312364 /nfs/dbraw/zinc/31/23/64/901312364.db2.gz IACUVZPWCHSDOW-OAQYLSRUSA-N 0 3 422.541 4.382 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)c1cc(F)c(F)c(F)c1 ZINC000486152486 901339598 /nfs/dbraw/zinc/33/95/98/901339598.db2.gz OXCLIZMAVGGJMO-UHFFFAOYSA-N 0 3 404.354 4.327 20 0 HIADHN COc1ccc(NC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)cc1Br ZINC000486154460 901342443 /nfs/dbraw/zinc/34/24/43/901342443.db2.gz ZVBQBPPPCIZNPP-HNNXBMFYSA-N 0 3 421.310 4.448 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)c1cc2cc(Br)ccc2[nH]1 ZINC000486175550 901361314 /nfs/dbraw/zinc/36/13/14/901361314.db2.gz SDTNYJRYTYQISH-FQEVSTJZSA-N 0 3 412.331 4.497 20 0 HIADHN O=C(CN1CCN(C2CCCCC2)CC1)NCc1ccc(-c2ccc(Cl)cc2)o1 ZINC000486250450 901432866 /nfs/dbraw/zinc/43/28/66/901432866.db2.gz LBBNKSUEKYXMBC-UHFFFAOYSA-N 0 3 415.965 4.167 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)C[C@@H](c3ccccc3)C(F)(F)F)CC2)C[C@@H](C)O1 ZINC000486293202 901474620 /nfs/dbraw/zinc/47/46/20/901474620.db2.gz QIKIXVXPCVWZGG-HLIPFELVSA-N 0 3 412.496 4.070 20 0 HIADHN COc1ccc(CN2C[C@H]3CCC[C@@]3(c3nc(-c4cccnc4)no3)C2)cc1Cl ZINC000486457678 901617007 /nfs/dbraw/zinc/61/70/07/901617007.db2.gz HDCXKMWDBWNJLB-VGOFRKELSA-N 0 3 410.905 4.347 20 0 HIADHN COc1cccc(CC2(C(=O)NC3CCN(CCOC(C)C)CC3)CCCCC2)c1 ZINC000486589265 901728694 /nfs/dbraw/zinc/72/86/94/901728694.db2.gz LMMRKRQCGNHVRP-UHFFFAOYSA-N 0 3 416.606 4.194 20 0 HIADHN CC(C)(O)CN1CCc2c(cccc2NC(=O)[C@@H]2C[C@H]2c2ccc(Cl)s2)C1 ZINC000486593670 901732850 /nfs/dbraw/zinc/73/28/50/901732850.db2.gz ABNCQJNOBOSNOA-HZPDHXFCSA-N 0 3 404.963 4.273 20 0 HIADHN C[C@@H]([N-]S(=O)(=O)c1c(Cl)cccc1Cl)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000486597780 901735871 /nfs/dbraw/zinc/73/58/71/901735871.db2.gz RNZNFHHQTUQLFB-ZBFHGGJFSA-N 0 3 413.370 4.182 20 0 HIADHN C[C@@H]([N-]S(=O)(=O)c1c(Cl)cccc1Cl)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000486597780 901735879 /nfs/dbraw/zinc/73/58/79/901735879.db2.gz RNZNFHHQTUQLFB-ZBFHGGJFSA-N 0 3 413.370 4.182 20 0 HIADHN O=C(CCc1ccc2ccccc2n1)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000486719075 901811144 /nfs/dbraw/zinc/81/11/44/901811144.db2.gz FZAVWAVMIZCIPX-UHFFFAOYSA-N 0 3 403.526 4.010 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1nc2ccccc2cc1Cl ZINC000486722775 901814421 /nfs/dbraw/zinc/81/44/21/901814421.db2.gz PDGDICYFDUSFOD-UHFFFAOYSA-N 0 3 409.917 4.345 20 0 HIADHN C[C@H]1CN(C2CCOCC2)CCN1C(=O)Nc1cc(Cl)ccc1N1CCCCC1 ZINC000486750611 901828071 /nfs/dbraw/zinc/82/80/71/901828071.db2.gz ZPQRLTCTKNIBKQ-KRWDZBQOSA-N 0 3 420.985 4.047 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)c1cnc(-c2ccsc2)s1 ZINC000486762630 901837400 /nfs/dbraw/zinc/83/74/00/901837400.db2.gz ZOAQSQWKMMPQCQ-UHFFFAOYSA-N 0 3 407.511 4.354 20 0 HIADHN COc1cc(-c2noc(CN3CC[C@H](c4ccccc4)[C@H]3C)n2)cc(OC)c1OC ZINC000486812244 901869913 /nfs/dbraw/zinc/86/99/13/901869913.db2.gz YMGPRPBWXXAICY-QAPCUYQASA-N 0 3 409.486 4.140 20 0 HIADHN CO[C@@H](c1ccc(Br)cc1)[C@@H](C)NC(=O)c1ccccc1CN(C)C ZINC000486847147 901892723 /nfs/dbraw/zinc/89/27/23/901892723.db2.gz PXOBVYCPNHQHLO-AUUYWEPGSA-N 0 3 405.336 4.017 20 0 HIADHN O=C(NC[C@H]1CCCN(Cc2cccs2)C1)c1c(F)cccc1Br ZINC000486895699 901939566 /nfs/dbraw/zinc/93/95/66/901939566.db2.gz FPCRYEAPERFJQX-CYBMUJFWSA-N 0 3 411.340 4.292 20 0 HIADHN CN(C(=O)Nc1nnc(/C=C/c2ccco2)s1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000486898913 901942669 /nfs/dbraw/zinc/94/26/69/901942669.db2.gz HJNSZFIHZJEUPU-FVNWOWOISA-N 0 3 409.515 4.040 20 0 HIADHN Cn1ncc(Br)c1CNCC(C)(C)c1ccc(Br)cc1 ZINC000486971748 901997739 /nfs/dbraw/zinc/99/77/39/901997739.db2.gz UHVDJFGWHNQPLK-UHFFFAOYSA-N 0 3 401.146 4.013 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)NC[C@H](c1ccccc1)C(F)(F)F ZINC000487030448 902027529 /nfs/dbraw/zinc/02/75/29/902027529.db2.gz IUAVHAYSTIXAII-LJQANCHMSA-N 0 3 411.443 4.245 20 0 HIADHN O=C(N[C@@H](c1ccccc1)c1ccc(F)cc1)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000505936241 914587320 /nfs/dbraw/zinc/58/73/20/914587320.db2.gz CDAFPRMGMKTWDC-RPWUZVMVSA-N 0 3 403.501 4.489 20 0 HIADHN O=C(N[C@H](c1ccccc1)c1ccc(F)cc1)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000505936240 914587749 /nfs/dbraw/zinc/58/77/49/914587749.db2.gz CDAFPRMGMKTWDC-DNQXCXABSA-N 0 3 403.501 4.489 20 0 HIADHN COc1cc(-c2noc(CN[C@@H]3CCCC[C@H]3C(C)(C)C)n2)cc(OC)c1OC ZINC000487391106 902176212 /nfs/dbraw/zinc/17/62/12/902176212.db2.gz KYTIVQRATKVHOM-HZPDHXFCSA-N 0 3 403.523 4.457 20 0 HIADHN CN(CCN(Cc1ccccc1)C(=O)c1cc(C2CC2)n(C)n1)Cc1ccccc1 ZINC000487406624 902189355 /nfs/dbraw/zinc/18/93/55/902189355.db2.gz AAYCCEPIBHFJRD-UHFFFAOYSA-N 0 3 402.542 4.072 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N(C[C@H]3CCCO3)C3CCCC3)c(C)c2)CC1 ZINC000487525481 902233646 /nfs/dbraw/zinc/23/36/46/902233646.db2.gz ZTNVGHHDTSTPIW-JOCHJYFZSA-N 0 3 414.594 4.092 20 0 HIADHN Cc1cc(C)n(Cc2ccc(C(=O)N(CCN(C)C)Cc3cccc(C)c3)cc2)n1 ZINC000487586711 902248223 /nfs/dbraw/zinc/24/82/23/902248223.db2.gz FXGGAAIIAMISGO-UHFFFAOYSA-N 0 3 404.558 4.061 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)c2cccc(OCc3cccnc3)c2)c1 ZINC000487621444 902255854 /nfs/dbraw/zinc/25/58/54/902255854.db2.gz MPMFECHPWHQXNO-UHFFFAOYSA-N 0 3 403.526 4.173 20 0 HIADHN CCCc1ccc([C@H](NC(=O)N2CC[C@@H](N3CCN(C)CC3)[C@H](C)C2)C(C)C)cc1 ZINC000487869034 902414144 /nfs/dbraw/zinc/41/41/44/902414144.db2.gz FIOPNRBZJCTNSU-AGILITTLSA-N 0 3 414.638 4.004 20 0 HIADHN COc1cccc(CNC(=O)[C@H](C)N[C@H](C)c2ccc(Oc3cccnc3)cc2)c1 ZINC000487890546 902433062 /nfs/dbraw/zinc/43/30/62/902433062.db2.gz BMSWWGXOFCPGCD-MSOLQXFVSA-N 0 3 405.498 4.238 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(Oc2cccnc2)cc1)C(=O)NC(=O)Nc1ccccc1F ZINC000487931378 902461661 /nfs/dbraw/zinc/46/16/61/902461661.db2.gz FBMLOHDQFAGAPU-HOTGVXAUSA-N 0 3 422.460 4.400 20 0 HIADHN C[C@@H](NCC(=O)Nc1cccc(CN2CCSCC2)c1)c1cccc(Cl)c1 ZINC000487942706 902472065 /nfs/dbraw/zinc/47/20/65/902472065.db2.gz FVJFQXSMOIAQJR-MRXNPFEDSA-N 0 3 403.979 4.178 20 0 HIADHN COCCN(CC(=O)Nc1ccc(NC(=O)c2cccs2)cc1)[C@H]1CCC[C@H]1C ZINC000487985107 902508242 /nfs/dbraw/zinc/50/82/42/902508242.db2.gz CWJHLGXTLGLTJH-APWZRJJASA-N 0 3 415.559 4.076 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(Oc2cccnc2)cc1)C(=O)NC(=O)Nc1ccccc1 ZINC000488008237 902527777 /nfs/dbraw/zinc/52/77/77/902527777.db2.gz QYGCRGGLEYYNIE-DLBZAZTESA-N 0 3 404.470 4.261 20 0 HIADHN O=C(CCN1CCC[C@@H](c2nc3ccc(F)cc3o2)C1)c1ccc2c(c1)OCCO2 ZINC000488155731 902651350 /nfs/dbraw/zinc/65/13/50/902651350.db2.gz ZKOCDLWLNBJDCE-MRXNPFEDSA-N 0 3 410.445 4.191 20 0 HIADHN C[C@@H]1CC[C@H](CN2CCC(c3nc(-c4ccccc4Br)no3)CC2)O1 ZINC000488171830 902660977 /nfs/dbraw/zinc/66/09/77/902660977.db2.gz UHRNZYASFXKSBY-UKRRQHHQSA-N 0 3 406.324 4.246 20 0 HIADHN CC(C)c1nc(C2CCN(C[C@H](O)CO[C@@H](C)c3ccc(Cl)cc3)CC2)no1 ZINC000505982266 914646049 /nfs/dbraw/zinc/64/60/49/914646049.db2.gz PEUUSVVHGKIENN-KXBFYZLASA-N 0 3 407.942 4.165 20 0 HIADHN CC(=O)N(c1nc(CN2CCN(C)[C@@H](C(C)C)C2)cs1)c1ccc(C)cc1C ZINC000488172306 902662916 /nfs/dbraw/zinc/66/29/16/902662916.db2.gz RKRJCMRZPYVQMO-OAQYLSRUSA-N 0 3 400.592 4.217 20 0 HIADHN C[C@H]1CN(C2CCOCC2)CCN1C(=O)Nc1ccccc1N(C)Cc1ccccc1 ZINC000488380658 902789772 /nfs/dbraw/zinc/78/97/72/902789772.db2.gz QMAACPNQSJSVDM-FQEVSTJZSA-N 0 3 422.573 4.040 20 0 HIADHN COCc1cnc(NC(=O)N2CCN(Cc3ccccc3)C3(CCCCC3)C2)s1 ZINC000488386562 902796367 /nfs/dbraw/zinc/79/63/67/902796367.db2.gz RTDBTSDJXYXITA-UHFFFAOYSA-N 0 3 414.575 4.342 20 0 HIADHN Cc1cccc(Oc2ncccc2NC(=O)N2CCN(C3CCOCC3)C[C@@H]2C)c1C ZINC000488394358 902803932 /nfs/dbraw/zinc/80/39/32/902803932.db2.gz FJFXFSVHSFUAEN-SFHVURJKSA-N 0 3 424.545 4.208 20 0 HIADHN C[C@H]1CN(C2CCOCC2)CCN1C(=O)Nc1ccccc1Oc1cccc(F)c1 ZINC000488393967 902804077 /nfs/dbraw/zinc/80/40/77/902804077.db2.gz HNMZBCAVCZAJAM-KRWDZBQOSA-N 0 3 413.493 4.335 20 0 HIADHN Cc1c(COc2ccccc2)cccc1NC(=O)N1CCN(C2CCOCC2)C[C@H]1C ZINC000488491027 902852910 /nfs/dbraw/zinc/85/29/10/902852910.db2.gz CTJOEMHGRKNKML-LJQANCHMSA-N 0 3 423.557 4.291 20 0 HIADHN Cc1cccc(Oc2ccc(NC(=O)N3CCN(C4CCOCC4)C[C@H]3C)cn2)c1C ZINC000488515290 902865319 /nfs/dbraw/zinc/86/53/19/902865319.db2.gz LBZLUOQDCQLGPR-GOSISDBHSA-N 0 3 424.545 4.208 20 0 HIADHN CCCOc1ccc(C(=O)CCC(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@H]2C)cc1 ZINC000488519881 902867104 /nfs/dbraw/zinc/86/71/04/902867104.db2.gz VCRBKDSPHZULDQ-HYBUGGRVSA-N 0 3 422.569 4.465 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)c1ccccc1Cc1ccccc1 ZINC000488693607 902948737 /nfs/dbraw/zinc/94/87/37/902948737.db2.gz MOBKRISYVJHQSQ-UHFFFAOYSA-N 0 3 400.522 4.486 20 0 HIADHN CN(C)[C@@H](CNC(=O)CSc1nnc(CCC2CCCCC2)o1)c1ccccc1 ZINC000488803635 903008173 /nfs/dbraw/zinc/00/81/73/903008173.db2.gz AREYXNLIHXDPKL-IBGZPJMESA-N 0 3 416.591 4.094 20 0 HIADHN COc1ccc([C@@H](C)NC(=O)[C@@H]2CN(Cc3ccccc3)CCC2(F)F)cc1F ZINC000506011093 914686018 /nfs/dbraw/zinc/68/60/18/914686018.db2.gz XHVRCOPAAWMNST-QAPCUYQASA-N 0 3 406.448 4.169 20 0 HIADHN C[C@H](N[C@H](COc1ccccc1F)C(C)(C)C)C(=O)N1CCc2sccc2C1 ZINC000489034369 903141411 /nfs/dbraw/zinc/14/14/11/903141411.db2.gz KEHFDXKFKSGHDO-MGPUTAFESA-N 0 3 404.551 4.244 20 0 HIADHN Cc1ccc(NC(=O)NC[C@@H](C)N(C)Cc2ccccc2)cc1C(=O)N(C)C(C)C ZINC000489120342 903210595 /nfs/dbraw/zinc/21/05/95/903210595.db2.gz ZKMRKGLZLHDPJP-LJQANCHMSA-N 0 3 410.562 4.117 20 0 HIADHN Cc1cc(NC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)n(-c2cc(C)ccn2)n1 ZINC000489122742 903213553 /nfs/dbraw/zinc/21/35/53/903213553.db2.gz LEYMUVQFRQOXFB-FQEVSTJZSA-N 0 3 418.545 4.012 20 0 HIADHN COc1ccccc1-c1ccc(CN(C)[C@H](C)c2ccc(S(N)(=O)=O)cc2)cc1 ZINC000506022437 914702667 /nfs/dbraw/zinc/70/26/67/914702667.db2.gz TVDKNKGLSCQNTL-QGZVFWFLSA-N 0 3 410.539 4.203 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)N2CCC(N(C)c3ccccc3)CC2)C1 ZINC000489292216 903313798 /nfs/dbraw/zinc/31/37/98/903313798.db2.gz MDBMAEKHRSJEHH-UNMCSNQZSA-N 0 3 406.574 4.132 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)NCc2ccc(-c3ccccc3)cc2F)CC1 ZINC000489388152 903359585 /nfs/dbraw/zinc/35/95/85/903359585.db2.gz IFEKPVOOVHUECL-UHFFFAOYSA-N 0 3 413.537 4.181 20 0 HIADHN CC[C@@H](C)c1ccccc1NC(=O)[C@H](C)N1CCC(CCCN2CCOCC2)CC1 ZINC000506032018 914715158 /nfs/dbraw/zinc/71/51/58/914715158.db2.gz OISBKLWLUQOZCC-RTWAWAEBSA-N 0 3 415.622 4.352 20 0 HIADHN COc1cccc(NC(=O)[C@H](N[C@@H]2CCO[C@]3(CCSC3)C2)c2ccccc2)c1 ZINC000489524743 903438062 /nfs/dbraw/zinc/43/80/62/903438062.db2.gz BAHANHKQAPAEOC-KJXAQDMKSA-N 0 3 412.555 4.019 20 0 HIADHN c1cc(CN[C@@H]2CCCOc3cc4c(cc32)CCCC4)cc(CN2CCOCC2)c1 ZINC000489574618 903473238 /nfs/dbraw/zinc/47/32/38/903473238.db2.gz SJVZLTGGIZHBAM-RUZDIDTESA-N 0 3 406.570 4.401 20 0 HIADHN C[C@H](NCCCS(=O)(=O)c1ccccc1)c1ccc(Br)c(F)c1 ZINC000489576534 903474123 /nfs/dbraw/zinc/47/41/23/903474123.db2.gz ZWMKZPSTMDHCHX-ZDUSSCGKSA-N 0 3 400.313 4.103 20 0 HIADHN COc1cc(C)cc(NC(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)c1C ZINC000489701476 903547407 /nfs/dbraw/zinc/54/74/07/903547407.db2.gz KAWIKHMDLBUPIJ-QZTJIDSGSA-N 0 3 403.567 4.055 20 0 HIADHN Cc1ccccc1[C@H](C(C)C)N(C)C(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000489763940 903587323 /nfs/dbraw/zinc/58/73/23/903587323.db2.gz VRVUQSNZVYYIRK-VWLOTQADSA-N 0 3 423.601 4.490 20 0 HIADHN CNC(=O)[C@H](CCSC)N[C@@H]1CCCc2nc(-c3ccc(Cl)cc3)sc21 ZINC000489907358 903665021 /nfs/dbraw/zinc/66/50/21/903665021.db2.gz LCCGYIWYHMAGHT-ZBFHGGJFSA-N 0 3 410.008 4.298 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)NCc2cccnc2OC2CCCC2)CC1 ZINC000489940480 903688653 /nfs/dbraw/zinc/68/86/53/903688653.db2.gz VOTKXUADHOFROA-UHFFFAOYSA-N 0 3 422.573 4.209 20 0 HIADHN Cc1nc(-c2ccc(C)cc2NC(=O)CN2C[C@H](c3ccc(C)cc3)C[C@@H]2C)n[nH]1 ZINC000490063427 903753443 /nfs/dbraw/zinc/75/34/43/903753443.db2.gz ZQSMLUZIEKTVSP-FXAWDEMLSA-N 0 3 403.530 4.213 20 0 HIADHN Cc1ccc(NC(=O)NC[C@H](c2ccccc2)N(C)C)cc1C(=O)N1CCCCC1 ZINC000490137922 903785671 /nfs/dbraw/zinc/78/56/71/903785671.db2.gz CUFWBJWZARTOOX-JOCHJYFZSA-N 0 3 408.546 4.046 20 0 HIADHN Cc1nn(-c2ccccc2)cc1CCCN[C@@H](c1cnn(C)c1)c1cccc(F)c1 ZINC000490151151 903794360 /nfs/dbraw/zinc/79/43/60/903794360.db2.gz PLJIGVXFFUKEPZ-XMMPIXPASA-N 0 3 403.505 4.365 20 0 HIADHN CCN1CCN([C@H](C)CN[C@H](c2ccccc2Cl)c2cc(F)ccc2F)CC1 ZINC000490168444 903806261 /nfs/dbraw/zinc/80/62/61/903806261.db2.gz VRIPSZYJSKZSFJ-OPAMFIHVSA-N 0 3 407.936 4.323 20 0 HIADHN CCc1ccc([C@H](NC[C@@H](CC)N2CCCC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000490171908 903809278 /nfs/dbraw/zinc/80/92/78/903809278.db2.gz JONKECLJKPHIJQ-VWNXMTODSA-N 0 3 414.615 4.206 20 0 HIADHN CCN1CCN([C@@H](C)CN[C@H](c2cccc(SC)c2)c2cc(F)ccc2F)CC1 ZINC000490171580 903809313 /nfs/dbraw/zinc/80/93/13/903809313.db2.gz FUYKAGHDSRXHIQ-GAJHUEQPSA-N 0 3 419.585 4.392 20 0 HIADHN Cc1ccc([C@H](NC[C@H](C(C)C)N2CCCC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000490172561 903810182 /nfs/dbraw/zinc/81/01/82/903810182.db2.gz ONVFAWQZAXVAOE-RPWUZVMVSA-N 0 3 414.615 4.198 20 0 HIADHN Cc1ccc([C@H](NCCN2CCC[C@H](C)C2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000490173095 903810569 /nfs/dbraw/zinc/81/05/69/903810569.db2.gz SKCZGEBJBPHZEY-YADARESESA-N 0 3 414.615 4.118 20 0 HIADHN Cc1ccc(NC(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)cc1C(=O)N1CCCCC1 ZINC000490207635 903828916 /nfs/dbraw/zinc/82/89/16/903828916.db2.gz ZQJMUNLYQKSFJW-XZOQPEGZSA-N 0 3 420.557 4.188 20 0 HIADHN CC1CCN([C@@H](CNC(=O)c2cccc(CN3CCCC3=O)c2)c2ccccc2)CC1 ZINC000490225476 903836848 /nfs/dbraw/zinc/83/68/48/903836848.db2.gz SZXNTSRJARCTPB-DEOSSOPVSA-N 0 3 419.569 4.012 20 0 HIADHN COCc1cccc(CC(=O)N[C@H](c2ccc(F)c(F)c2)C(C)(C)N2CCCC2)c1 ZINC000490233998 903842840 /nfs/dbraw/zinc/84/28/40/903842840.db2.gz CKKTZSIDLJGNSQ-HSZRJFAPSA-N 0 3 416.512 4.386 20 0 HIADHN COc1ccc(NC(=O)N(CCN(C)C)Cc2cccc(F)c2)cc1Br ZINC000490284545 903874576 /nfs/dbraw/zinc/87/45/76/903874576.db2.gz HIIPSULDIBVQAB-UHFFFAOYSA-N 0 3 424.314 4.193 20 0 HIADHN O=C(Nc1ccc(OC(F)F)c(Cl)c1)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000490365565 903957386 /nfs/dbraw/zinc/95/73/86/903957386.db2.gz LJSNTUGJMUQTEO-UHFFFAOYSA-N 0 3 424.875 4.398 20 0 HIADHN CC(C)Cc1ccc([C@H](CNC(=O)C2(c3ccccc3)CCOCC2)N(C)C)cc1 ZINC000490483978 904037049 /nfs/dbraw/zinc/03/70/49/904037049.db2.gz MZBPJDGEZYTNTH-DEOSSOPVSA-N 0 3 408.586 4.352 20 0 HIADHN CN1CCN(Cc2ccc(CNC(=O)Nc3ccc(-c4ccco4)cc3F)cc2)CC1 ZINC000490486206 904037628 /nfs/dbraw/zinc/03/76/28/904037628.db2.gz GUBPQSRVMDHZSI-UHFFFAOYSA-N 0 3 422.504 4.155 20 0 HIADHN Cn1cc(-c2ccc(F)c(C(=O)NC[C@]3(C)CCCN3Cc3ccccc3)c2)cn1 ZINC000490523155 904070575 /nfs/dbraw/zinc/07/05/75/904070575.db2.gz FKKKQXSUOYEPAP-DEOSSOPVSA-N 0 3 406.505 4.011 20 0 HIADHN COC(=O)c1cc(NC(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)c(F)cc1F ZINC000490658825 904159521 /nfs/dbraw/zinc/15/95/21/904159521.db2.gz DBMFSGQXESWMOX-HXUWFJFHSA-N 0 3 417.456 4.018 20 0 HIADHN CC(C)(C)c1ccc(-c2ccc(CN3CCC(C(=O)N4CCOCC4)CC3)o2)cc1 ZINC000506089134 914798753 /nfs/dbraw/zinc/79/87/53/914798753.db2.gz ZNJRYLFWUVIKBP-UHFFFAOYSA-N 0 3 410.558 4.315 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2cc(C(F)(F)F)c[nH]c2=O)N2CCCC2)cc1 ZINC000490923804 904319633 /nfs/dbraw/zinc/31/96/33/904319633.db2.gz UHMXCUJYVUDKAT-QGZVFWFLSA-N 0 3 408.424 4.073 20 0 HIADHN COc1cccc([C@H](CNC(=O)N2CCC[C@H]2c2nc3cc(C)ccc3[nH]2)N(C)C)c1 ZINC000490929852 904323894 /nfs/dbraw/zinc/32/38/94/904323894.db2.gz ZCFNYZFULKDPEX-VXKWHMMOSA-N 0 3 421.545 4.029 20 0 HIADHN COc1cccc([C@H](CNC(=O)N2CCC[C@H]2c2nc3ccc(C)cc3[nH]2)N(C)C)c1 ZINC000490929852 904323900 /nfs/dbraw/zinc/32/39/00/904323900.db2.gz ZCFNYZFULKDPEX-VXKWHMMOSA-N 0 3 421.545 4.029 20 0 HIADHN C[C@H](NC(=O)Nc1ccc(CCN2CCSCC2)cc1)c1c(F)cccc1F ZINC000490979151 904348322 /nfs/dbraw/zinc/34/83/22/904348322.db2.gz CYYIZIDRIWUSPE-HNNXBMFYSA-N 0 3 405.514 4.439 20 0 HIADHN COc1ccc([C@H](CNC(=O)NCCc2ccc(Cl)s2)N2CCCC2)cc1 ZINC000506111905 914808580 /nfs/dbraw/zinc/80/85/80/914808580.db2.gz GXXIKWXJFYQSDX-SFHVURJKSA-N 0 3 407.967 4.089 20 0 HIADHN CCc1ccc([C@H](NCCN(CC)C(C)C)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000491006083 904366463 /nfs/dbraw/zinc/36/64/63/904366463.db2.gz LNTNTHHGPWJBAU-QHCPKHFHSA-N 0 3 402.604 4.062 20 0 HIADHN CCOc1ccc([C@H](NC[C@H](C)N2CCN(C)CC2)c2ccccc2Cl)cc1 ZINC000491026863 904376892 /nfs/dbraw/zinc/37/68/92/904376892.db2.gz ZGIUYTLSCAZSDZ-MBSDFSHPSA-N 0 3 401.982 4.054 20 0 HIADHN CSc1cccc([C@@H](NC[C@H](C)N2CCN(C)CC2)c2cc(F)ccc2F)c1 ZINC000491036727 904388755 /nfs/dbraw/zinc/38/87/55/904388755.db2.gz ZFZHGITYTADRPI-KSFYIVLOSA-N 0 3 405.558 4.002 20 0 HIADHN CC[C@H](C)N(C)CCN[C@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000491050964 904394696 /nfs/dbraw/zinc/39/46/96/904394696.db2.gz IKNXKYNMIJFFCD-HRAATJIYSA-N 0 3 408.995 4.153 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC000491073588 904410365 /nfs/dbraw/zinc/41/03/65/904410365.db2.gz DVJICLNKRBZJPT-HXUWFJFHSA-N 0 3 416.569 4.155 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)NCc2cccc(COC(C)(C)C)c2)cc1 ZINC000491145176 904454540 /nfs/dbraw/zinc/45/45/40/904454540.db2.gz MIVFCWJRQLYLPA-JOCHJYFZSA-N 0 3 413.562 4.112 20 0 HIADHN CN(Cc1cccc(OCc2ccccn2)c1)Cc1ccccc1N1CCOCC1 ZINC000506124124 914812546 /nfs/dbraw/zinc/81/25/46/914812546.db2.gz GCQLKBUNDDQNES-UHFFFAOYSA-N 0 3 403.526 4.129 20 0 HIADHN COc1ccc([C@@H](CNC(=O)CN2CC[C@@H](C3CC3)C2)c2c[nH]c3ccccc32)cc1 ZINC000491277038 904514958 /nfs/dbraw/zinc/51/49/58/904514958.db2.gz HGEKVPNPVQBOQS-NFBKMPQASA-N 0 3 417.553 4.157 20 0 HIADHN COc1cccc([C@H](CN[C@@H](c2cnn(C)c2)c2cccc(F)c2)N2CCCC2)c1 ZINC000491309886 904529127 /nfs/dbraw/zinc/52/91/27/904529127.db2.gz ZPGQOPMZJCGLSD-BJKOFHAPSA-N 0 3 408.521 4.084 20 0 HIADHN O=C(Nc1ccccc1O)C1CCN(Cc2cccc(OCc3ccccn3)c2)CC1 ZINC000506137996 914819579 /nfs/dbraw/zinc/81/95/79/914819579.db2.gz QIOHMMKUYKSCSV-UHFFFAOYSA-N 0 3 417.509 4.217 20 0 HIADHN CCOc1cc(CN2CCC(C(=O)Nc3ccccc3O)CC2)ccc1OC(F)F ZINC000506139006 914819772 /nfs/dbraw/zinc/81/97/72/914819772.db2.gz VDXZPUSNYCEHQZ-UHFFFAOYSA-N 0 3 420.456 4.243 20 0 HIADHN O=S1(=O)CC[C@H](CN[C@@H](c2ccc(Cl)cc2)c2ccc(OC(F)F)cc2)C1 ZINC000491316816 904533941 /nfs/dbraw/zinc/53/39/41/904533941.db2.gz MTIJAXMOFVCLAF-ACJLOTCBSA-N 0 3 415.889 4.055 20 0 HIADHN CCCN1CCC(N[C@@H](c2ccc(Cl)cc2)c2cccc(S(C)(=O)=O)c2)CC1 ZINC000491344122 904548285 /nfs/dbraw/zinc/54/82/85/904548285.db2.gz WQOSXOIHNPWTKA-QFIPXVFZSA-N 0 3 421.006 4.297 20 0 HIADHN O=C1CCCN1CCCN[C@H](c1cccc(F)c1)c1cccc(Br)c1 ZINC000491354495 904550789 /nfs/dbraw/zinc/55/07/89/904550789.db2.gz BXQLTGSLPYIYTM-FQEVSTJZSA-N 0 3 405.311 4.280 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)cc1CN1CCC[C@H](c2nnc3ccccn32)C1 ZINC000506141437 914821612 /nfs/dbraw/zinc/82/16/12/914821612.db2.gz WPBUXWFTDIUOSS-KRWDZBQOSA-N 0 3 406.921 4.256 20 0 HIADHN CC(C)N(CCN[C@@H](c1cccc(S(C)(=O)=O)c1)c1ccc(F)cc1F)C(C)C ZINC000491354776 904552345 /nfs/dbraw/zinc/55/23/45/904552345.db2.gz DAGFCWQJQNSABR-QFIPXVFZSA-N 0 3 424.557 4.166 20 0 HIADHN CC(C)N(CCN[C@H](c1ccc(F)cc1)c1cccc(S(C)(=O)=O)c1)C(C)C ZINC000491355050 904553158 /nfs/dbraw/zinc/55/31/58/904553158.db2.gz FBWOYLAKDFNLRT-JOCHJYFZSA-N 0 3 406.567 4.027 20 0 HIADHN CCc1ccc([C@H](NC[C@@H]2Cc3ccccc3O2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000491420131 904586113 /nfs/dbraw/zinc/58/61/13/904586113.db2.gz AURXXPIMJLWBTC-DHLKQENFSA-N 0 3 421.562 4.335 20 0 HIADHN CCN(CC)[C@@H](CN[C@H](c1cnn(C)c1)c1cccc(F)c1)c1cccc(OC)c1 ZINC000491425163 904590846 /nfs/dbraw/zinc/59/08/46/904590846.db2.gz ZCSPWADZSICKOL-ZEQRLZLVSA-N 0 3 410.537 4.330 20 0 HIADHN C[C@H]1C[C@H](NC(=O)Nc2cc(F)c(OC(F)F)cc2F)CN1Cc1ccccc1 ZINC000491472753 904615554 /nfs/dbraw/zinc/61/55/54/904615554.db2.gz XQTYAWXDLGPEIW-JSGCOSHPSA-N 0 3 411.399 4.351 20 0 HIADHN COc1ccc(Br)c(NC(=O)N(CCN(C)C)Cc2cccc(C)c2)c1 ZINC000491478823 904615764 /nfs/dbraw/zinc/61/57/64/904615764.db2.gz HKHNWWOLHVSDNQ-UHFFFAOYSA-N 0 3 420.351 4.362 20 0 HIADHN COCCOc1c(Cl)cccc1NC(=O)N(CCN(C)C)Cc1cccc(C)c1 ZINC000491514178 904632066 /nfs/dbraw/zinc/63/20/66/904632066.db2.gz MOWFRAYKXOAWRQ-UHFFFAOYSA-N 0 3 419.953 4.269 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)Nc2cccc(OC[C@@H]3CCCO3)c2)c1 ZINC000491527192 904637804 /nfs/dbraw/zinc/63/78/04/904637804.db2.gz YLSUULOEHJNKFN-QHCPKHFHSA-N 0 3 411.546 4.149 20 0 HIADHN COc1ccc(CNC2(Cc3ccccc3Br)CC2)c(OC)c1OC ZINC000492155452 904807144 /nfs/dbraw/zinc/80/71/44/904807144.db2.gz VTMSPKZDGFSPFD-UHFFFAOYSA-N 0 3 406.320 4.340 20 0 HIADHN CC[C@H](C)[C@@](C)(O)CN[C@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000492177791 904810866 /nfs/dbraw/zinc/81/08/66/904810866.db2.gz INCBPPZZTDLUMZ-RVHYNSKXSA-N 0 3 409.979 4.220 20 0 HIADHN O[C@H](CO[C@H]1CCCc2ccccc21)CN1CCC2(CC1)OCCc1ccsc12 ZINC000492379661 904841779 /nfs/dbraw/zinc/84/17/79/904841779.db2.gz YLZUFRWFZDKUOB-UNMCSNQZSA-N 0 3 413.583 4.067 20 0 HIADHN FC(F)(F)c1ccn(C2CCN(CCOc3cccc(Br)c3)CC2)n1 ZINC000492485532 904857034 /nfs/dbraw/zinc/85/70/34/904857034.db2.gz FBFRGJYQRJUUBB-UHFFFAOYSA-N 0 3 418.257 4.380 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)Nc1nc(C2CCOCC2)cs1 ZINC000492515331 904861429 /nfs/dbraw/zinc/86/14/29/904861429.db2.gz MPCQJQURWYLXAT-LJQANCHMSA-N 0 3 416.591 4.315 20 0 HIADHN CO[C@H]1C[C@@H](CN(C)C(=O)N[C@@H](c2cccc(C(F)(F)F)c2)C(C)(C)C)N(C)C1 ZINC000492627651 904879144 /nfs/dbraw/zinc/87/91/44/904879144.db2.gz KZJVWVVJKTVOBL-BZSNNMDCSA-N 0 3 415.500 4.153 20 0 HIADHN O[C@@H](COc1cccc2ccccc21)CN1CCC2(CC1)OCCc1ccsc12 ZINC000492784762 904905915 /nfs/dbraw/zinc/90/59/15/904905915.db2.gz QRKBIPGRSZJYTI-HXUWFJFHSA-N 0 3 409.551 4.205 20 0 HIADHN OCC[C@]1(CN[C@H](c2ccc(Cl)cc2)c2ccc(OC(F)F)cc2)CCOC1 ZINC000493008809 904984548 /nfs/dbraw/zinc/98/45/48/904984548.db2.gz LMTULLQQMGYEJX-TZIWHRDSSA-N 0 3 411.876 4.410 20 0 HIADHN O=C(NC1CCN(Cc2cccc(OCc3ccccn3)c2)CC1)c1ccccc1 ZINC000506244525 914860921 /nfs/dbraw/zinc/86/09/21/914860921.db2.gz ANNURPTXGQQNTJ-UHFFFAOYSA-N 0 3 401.510 4.055 20 0 HIADHN CCc1ccc([C@@H](NCCc2cscn2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000493061435 905005685 /nfs/dbraw/zinc/00/56/85/905005685.db2.gz RJBUYSKQZOCMST-OAQYLSRUSA-N 0 3 400.569 4.031 20 0 HIADHN CCOc1ccc(NC(=O)c2ccc(CN3CCC(CO)CC3)cc2)cc1Cl ZINC000493110777 905023898 /nfs/dbraw/zinc/02/38/98/905023898.db2.gz ABDSHKVEOYGJNJ-UHFFFAOYSA-N 0 3 402.922 4.195 20 0 HIADHN CCc1ccc([C@H](NC[C@H](CO)c2ccccc2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000493134344 905029363 /nfs/dbraw/zinc/02/93/63/905029363.db2.gz YYUKQBRNHQTFNQ-NOZRDPDXSA-N 0 3 423.578 4.108 20 0 HIADHN Cc1ccc([C@H](NC[C@@]2(C)CCCC[C@@H]2O)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000493175764 905039767 /nfs/dbraw/zinc/03/97/67/905039767.db2.gz LSVSUMWKUJVZGY-RJGXRXQPSA-N 0 3 401.572 4.019 20 0 HIADHN CC[C@H]1CCCCN1CCN[C@H](c1ccc(C)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000493178422 905041225 /nfs/dbraw/zinc/04/12/25/905041225.db2.gz SRZUJYIJKOWIFV-LADGPHEKSA-N 0 3 414.615 4.342 20 0 HIADHN COCCC1(CN[C@@H](c2ccc(F)cc2)c2cccc(S(C)(=O)=O)c2)CCC1 ZINC000493252780 905068626 /nfs/dbraw/zinc/06/86/26/905068626.db2.gz WMRXGNWOMHSUGT-NRFANRHFSA-N 0 3 405.535 4.115 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)[C@H]1CCCc2sc(C)nc21)c1cccc(OC)c1 ZINC000493253073 905070480 /nfs/dbraw/zinc/07/04/80/905070480.db2.gz JIYFEUGKHUVCRG-OALUTQOASA-N 0 3 401.576 4.079 20 0 HIADHN CCOc1cc(CN(C)[C@H](C)c2ccc(F)cc2)ccc1O[C@H](C)C(=O)N(C)C ZINC000506259350 914868628 /nfs/dbraw/zinc/86/86/28/914868628.db2.gz OJCDRQGTQWGDQZ-IAGOWNOFSA-N 0 3 402.510 4.273 20 0 HIADHN COc1ccc(-c2[nH]c3ccccc3c2CCC(=O)N2CC[C@H]3CCN(C)C[C@@H]32)cc1 ZINC000493441645 905123573 /nfs/dbraw/zinc/12/35/73/905123573.db2.gz YIWVXJZVHFTMMI-KOSHJBKYSA-N 0 3 417.553 4.329 20 0 HIADHN COc1cc(-c2nnc(CN[C@@H]3CCC[C@H]3Cc3ccccc3)o2)cc(OC)c1OC ZINC000493525530 905150539 /nfs/dbraw/zinc/15/05/39/905150539.db2.gz LZTJEWIGSHPRBV-PKOBYXMFSA-N 0 3 423.513 4.263 20 0 HIADHN COc1cc(C(=O)N2CC[C@H]3CCN(C)C[C@@H]32)ccc1OCc1ccc(Cl)cc1 ZINC000493550917 905158430 /nfs/dbraw/zinc/15/84/30/905158430.db2.gz JEOYADMARQEDHO-XLIONFOSSA-N 0 3 414.933 4.094 20 0 HIADHN COc1cc(C(=O)N2CC[C@@H]3CCN(C)C[C@@H]32)ccc1OCc1ccc(Cl)cc1 ZINC000493550915 905158524 /nfs/dbraw/zinc/15/85/24/905158524.db2.gz JEOYADMARQEDHO-PXNSSMCTSA-N 0 3 414.933 4.094 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)c3cc(-c4ccc(F)cc4)nc4onc(C5CC5)c43)[C@H]2C1 ZINC000493559371 905160834 /nfs/dbraw/zinc/16/08/34/905160834.db2.gz VWKKUUYJALJHLI-QRWLVFNGSA-N 0 3 420.488 4.073 20 0 HIADHN O=C(Nc1cccc(-c2cc[nH]n2)c1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000493878292 905239403 /nfs/dbraw/zinc/23/94/03/905239403.db2.gz JKPWGHFPRMYVEY-OAQYLSRUSA-N 0 3 414.431 4.470 20 0 HIADHN CNS(=O)(=O)c1cccc([C@@H](C)N[C@H]2CCc3cc(Br)cc(C)c32)c1 ZINC000493918510 905269615 /nfs/dbraw/zinc/26/96/15/905269615.db2.gz ZBOQRVWMYZIBFO-ACJLOTCBSA-N 0 3 423.376 4.004 20 0 HIADHN COc1cccc(COc2cccc(NC(=O)N3CC[C@@H]4CCN(C)C[C@H]43)c2C)c1 ZINC000493920771 905273910 /nfs/dbraw/zinc/27/39/10/905273910.db2.gz RFSKEPOLZACRIF-SIKLNZKXSA-N 0 3 409.530 4.141 20 0 HIADHN COc1cccc(Cn2ccc3ccc(NC(=O)N4CC[C@H]5CCN(C)C[C@@H]54)cc32)c1 ZINC000493965847 905315777 /nfs/dbraw/zinc/31/57/77/905315777.db2.gz XAVYOQUZPIVEOP-YKSBVNFPSA-N 0 3 418.541 4.256 20 0 HIADHN CN(C(=O)c1ccc(S(=O)(=O)C2CCCC2)cc1)C(C)(C)CN1CCCCCC1 ZINC000493974416 905323019 /nfs/dbraw/zinc/32/30/19/905323019.db2.gz BFGOBIWVXIUEOD-UHFFFAOYSA-N 0 3 420.619 4.130 20 0 HIADHN C[C@H]1[C@H](NC(=O)c2ccc(OCc3ccccn3)cc2)CCN1Cc1ccccc1 ZINC000493999510 905343611 /nfs/dbraw/zinc/34/36/11/905343611.db2.gz JGLCWIQNPFHKGP-YADARESESA-N 0 3 401.510 4.053 20 0 HIADHN Cc1nc2ccc(CNCc3cc(Br)c4c(c3)OCCO4)cc2s1 ZINC000494018951 905357689 /nfs/dbraw/zinc/35/76/89/905357689.db2.gz RNOYMISMZRCJOI-UHFFFAOYSA-N 0 3 405.317 4.428 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)CCn2c3ccccc3nc2C2CC2)CCN1Cc1ccccc1 ZINC000494036590 905376508 /nfs/dbraw/zinc/37/65/08/905376508.db2.gz GAXKTHAHUSZUJX-NQIIRXRSSA-N 0 3 402.542 4.083 20 0 HIADHN CCCC(=O)NC[C@@H]1CCCN(Cc2cn(Cc3ccccc3)nc2C(C)(C)C)C1 ZINC000512416770 921145079 /nfs/dbraw/zinc/14/50/79/921145079.db2.gz VPVBLECKRANHDL-NRFANRHFSA-N 0 3 410.606 4.357 20 0 HIADHN Cc1ccc(C(F)(F)F)cc1NC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1CO ZINC000494109498 905451649 /nfs/dbraw/zinc/45/16/49/905451649.db2.gz UMKGBMIHFKFDRP-HKUYNNGSSA-N 0 3 421.463 4.018 20 0 HIADHN CCOc1ccc(CN2CCC[C@@H](CNC(=O)Nc3ccc(C)cc3)C2)cc1OC ZINC000512426312 921152658 /nfs/dbraw/zinc/15/26/58/921152658.db2.gz FVSCACLCNMLJBO-FQEVSTJZSA-N 0 3 411.546 4.436 20 0 HIADHN COCCOc1ccccc1CN1CCC[C@H](CNC(=O)Nc2ccc(C)cc2)C1 ZINC000512426462 921153220 /nfs/dbraw/zinc/15/32/20/921153220.db2.gz GUEQPNMNLNIEDI-HXUWFJFHSA-N 0 3 411.546 4.054 20 0 HIADHN C[C@H](NC(=O)N1CCN(C2CCOCC2)C[C@@H]1C)c1cc(F)c(Cl)cc1Cl ZINC000494238581 905564715 /nfs/dbraw/zinc/56/47/15/905564715.db2.gz RSSBEGGRZOACLF-STQMWFEESA-N 0 3 418.340 4.088 20 0 HIADHN C[C@@H](CC(=O)NCCCN1CCN(C)C[C@H]1c1ccccc1)c1c[nH]c2ccccc21 ZINC000494312986 905627554 /nfs/dbraw/zinc/62/75/54/905627554.db2.gz OALFDFRTKRQBGY-CPJSRVTESA-N 0 3 418.585 4.157 20 0 HIADHN CCCC(=O)NC[C@@H]1CCCN(Cc2ccc(OCc3ccccc3)c(OC)c2)C1 ZINC000512439617 921162873 /nfs/dbraw/zinc/16/28/73/921162873.db2.gz UQJBAGPVYOUVQM-QFIPXVFZSA-N 0 3 410.558 4.403 20 0 HIADHN CCCN1CCN(c2ccccc2CNCc2nc3cc(Cl)ccc3n2C)CC1 ZINC000494448142 905731471 /nfs/dbraw/zinc/73/14/71/905731471.db2.gz VBZRTBYLZBXOMF-UHFFFAOYSA-N 0 3 411.981 4.049 20 0 HIADHN Cc1nn(Cc2ccc(Cl)cc2)c(C)c1CN1CCC[C@H](CNC(=O)C(C)C)C1 ZINC000512455197 921172699 /nfs/dbraw/zinc/17/26/99/921172699.db2.gz BGLDWJWUEJTMCU-HXUWFJFHSA-N 0 3 416.997 4.186 20 0 HIADHN CC(C)S(=O)(=O)c1ccc(CN[C@@H]2CCO[C@H]2c2ccc(Cl)c(F)c2)cc1 ZINC000494478074 905759814 /nfs/dbraw/zinc/75/98/14/905759814.db2.gz RWALYPPOGNPCJD-UXHICEINSA-N 0 3 411.926 4.281 20 0 HIADHN C[C@H](Cn1cc(Br)cn1)N[C@H]1CSc2ccc(Br)cc21 ZINC000494485425 905768827 /nfs/dbraw/zinc/76/88/27/905768827.db2.gz RPICQXZOMNRHLA-RNCFNFMXSA-N 0 3 417.170 4.233 20 0 HIADHN CCOc1cc(CN2CCC[C@H](CNC(=O)Nc3ccc(C)cc3)C2)ccc1OC ZINC000512461652 921177256 /nfs/dbraw/zinc/17/72/56/921177256.db2.gz FCBJSTFAJCAOJB-HXUWFJFHSA-N 0 3 411.546 4.436 20 0 HIADHN Cc1cc(NC(=O)Nc2cc([C@@H]3C[C@H]3C)[nH]n2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000494648139 905881243 /nfs/dbraw/zinc/88/12/43/905881243.db2.gz KKHGJRHGVMTDJA-ATZDWAIDSA-N 0 3 419.533 4.129 20 0 HIADHN O=C(c1ccc(CN2CCC(CO)CC2)cc1)N1CC2(CCC2)c2c1cccc2F ZINC000494648776 905882429 /nfs/dbraw/zinc/88/24/29/905882429.db2.gz PXGDJIWPHHKZLD-UHFFFAOYSA-N 0 3 408.517 4.112 20 0 HIADHN Cc1ccc([C@H](NCC(C)(C)[C@@H](O)C(C)C)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000494715190 905918503 /nfs/dbraw/zinc/91/85/03/905918503.db2.gz MPYFWOZLFZDMMZ-PKTZIBPZSA-N 0 3 417.615 4.429 20 0 HIADHN CSc1cccc([C@H](NCC2CCS(=O)(=O)CC2)c2cc(F)ccc2F)c1 ZINC000494716449 905919844 /nfs/dbraw/zinc/91/98/44/905919844.db2.gz XMOSDJZLVNGGSD-FQEVSTJZSA-N 0 3 411.539 4.191 20 0 HIADHN COCCn1cc2c(n1)[C@@H](NC1CC(c3ccc(Br)cc3)C1)CCC2 ZINC000494759003 905955614 /nfs/dbraw/zinc/95/56/14/905955614.db2.gz DIGGBUHAEAEJHT-KVZIAJEVSA-N 0 3 404.352 4.205 20 0 HIADHN CC1CCN(CCNC(=O)c2cccnc2Oc2ccc(Br)cc2)CC1 ZINC000512487287 921195266 /nfs/dbraw/zinc/19/52/66/921195266.db2.gz SOUKKZDEAZYADE-UHFFFAOYSA-N 0 3 418.335 4.098 20 0 HIADHN C[C@H]1CN(C2CCOCC2)CCN1C(=O)N[C@@H](c1ccc(Cl)cc1)C1CCC1 ZINC000494857025 906040218 /nfs/dbraw/zinc/04/02/18/906040218.db2.gz DJRTWGROEGQQGK-HRAATJIYSA-N 0 3 405.970 4.076 20 0 HIADHN COc1cc(CN[C@H](C)c2ccc(C(=O)N(C)C)cc2)ccc1OCC(F)(F)F ZINC000494884048 906061617 /nfs/dbraw/zinc/06/16/17/906061617.db2.gz VJNSHOWSPSXYAU-CQSZACIVSA-N 0 3 410.436 4.189 20 0 HIADHN COc1cc(CN[C@@H](C)c2ccc(C(=O)N(C)C)cc2)ccc1OCC(F)(F)F ZINC000494884047 906061922 /nfs/dbraw/zinc/06/19/22/906061922.db2.gz VJNSHOWSPSXYAU-AWEZNQCLSA-N 0 3 410.436 4.189 20 0 HIADHN CCc1c(NC(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)cnn1CCC(C)C ZINC000494923452 906097408 /nfs/dbraw/zinc/09/74/08/906097408.db2.gz LLPHKCZFOHJNCW-UHFFFAOYSA-N 0 3 421.536 4.366 20 0 HIADHN CCc1c(NC(=O)N(CCN(C)C)Cc2cccc(F)c2)cnn1CCC(C)C ZINC000494938314 906109252 /nfs/dbraw/zinc/10/92/52/906109252.db2.gz ONAQHADNEAVPNE-UHFFFAOYSA-N 0 3 403.546 4.226 20 0 HIADHN C[C@H](CCO)C1(CN[C@H](c2ccc(F)cc2)c2cccc(S(C)(=O)=O)c2)CCC1 ZINC000494959891 906130082 /nfs/dbraw/zinc/13/00/82/906130082.db2.gz YVZYVROPGGIQQR-VGOFRKELSA-N 0 3 419.562 4.097 20 0 HIADHN CO[C@@H]1CCC[C@H]1CN[C@@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000494966802 906135794 /nfs/dbraw/zinc/13/57/94/906135794.db2.gz BHSGMXRFXDCTGC-WMQCIHAUSA-N 0 3 407.963 4.238 20 0 HIADHN O=C(Nc1cccc(Oc2ccncc2)c1)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000494982622 906146116 /nfs/dbraw/zinc/14/61/16/906146116.db2.gz BVYRNTKAAOAHAD-UHFFFAOYSA-N 0 3 417.509 4.331 20 0 HIADHN O=C(CC1CCN(Cc2c[nH]nc2-c2ccc(C(F)(F)F)cc2)CC1)N1CCCC1 ZINC000494980579 906146425 /nfs/dbraw/zinc/14/64/25/906146425.db2.gz QJIZVRLMUWKCGV-UHFFFAOYSA-N 0 3 420.479 4.320 20 0 HIADHN C[C@H](CNC(=O)N(Cc1ccc(F)cc1)C1CCOCC1)N(C)Cc1ccccc1 ZINC000494980762 906146638 /nfs/dbraw/zinc/14/66/38/906146638.db2.gz QXSZJZFOTBFLPB-LJQANCHMSA-N 0 3 413.537 4.037 20 0 HIADHN C[C@H](NC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C)[C@@H]1OCCc2sccc21 ZINC000494986367 906149952 /nfs/dbraw/zinc/14/99/52/906149952.db2.gz PTRDLDBMTICCPP-FGSXEWAUSA-N 0 3 413.587 4.056 20 0 HIADHN CCc1ccc([C@@H](NCC(CC)(CC)CO)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000494989538 906153397 /nfs/dbraw/zinc/15/33/97/906153397.db2.gz UDDIGEMXTRZJPM-JOCHJYFZSA-N 0 3 403.588 4.130 20 0 HIADHN C[C@@H](CNC(=O)N[C@@H](C)c1nc(C(F)(F)F)cs1)N(C)Cc1ccccc1 ZINC000494996486 906159090 /nfs/dbraw/zinc/15/90/90/906159090.db2.gz IPWNNJWKPUXVDB-STQMWFEESA-N 0 3 400.470 4.043 20 0 HIADHN Brc1cccc(N2CC[C@@H](N[C@@H](c3nc[nH]n3)C3CCCCC3)C2)c1 ZINC000495001354 906163064 /nfs/dbraw/zinc/16/30/64/906163064.db2.gz WYIDEYDTIODUCC-SJLPKXTDSA-N 0 3 404.356 4.057 20 0 HIADHN Brc1cccc(N2CC[C@H](N[C@@H](c3nc[nH]n3)C3CCCCC3)C2)c1 ZINC000495001353 906163236 /nfs/dbraw/zinc/16/32/36/906163236.db2.gz WYIDEYDTIODUCC-FUHWJXTLSA-N 0 3 404.356 4.057 20 0 HIADHN CN(Cc1ccc(Br)c(F)c1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000495017209 906175003 /nfs/dbraw/zinc/17/50/03/906175003.db2.gz LUXSUOYYHLSWAV-QGZVFWFLSA-N 0 3 420.326 4.004 20 0 HIADHN C[C@@H](N[C@@H](c1cncc(Br)c1)C1CC1)c1ccc(C(=O)N(C)C)cc1 ZINC000495020917 906179569 /nfs/dbraw/zinc/17/95/69/906179569.db2.gz VLIDRBOATUIFJD-BFUOFWGJSA-N 0 3 402.336 4.348 20 0 HIADHN c1nnc([C@H](NCc2cn(-c3ccccc3)nc2-c2ccncc2)C2CCCCC2)[nH]1 ZINC000495049501 906203228 /nfs/dbraw/zinc/20/32/28/906203228.db2.gz SRDDDIGIYPQRJT-HSZRJFAPSA-N 0 3 413.529 4.464 20 0 HIADHN CC1CCN([C@H](CNC(=O)c2ccc3c(c2)C(C)(C)C(=O)N3)c2ccccc2)CC1 ZINC000495050835 906205742 /nfs/dbraw/zinc/20/57/42/906205742.db2.gz MVHRNODRRBLZAK-JOCHJYFZSA-N 0 3 405.542 4.119 20 0 HIADHN Clc1ccccc1[C@H](N[C@H]1CCO[C@@]2(CCOC2)C1)c1ccc2c(c1)OCCO2 ZINC000495061000 906213066 /nfs/dbraw/zinc/21/30/66/906213066.db2.gz BWKHKEHQLIENKQ-IMRHEYAYSA-N 0 3 415.917 4.128 20 0 HIADHN Brc1ccccc1N1CC[C@@H](N[C@@H](c2nc[nH]n2)C2CCCCC2)C1 ZINC000495074206 906222652 /nfs/dbraw/zinc/22/26/52/906222652.db2.gz ZWXGCEBUYDKOPP-CRAIPNDOSA-N 0 3 404.356 4.057 20 0 HIADHN O=C(CN[C@H](C[C@@H]1CCOC1)c1ccc(F)cc1)N1CCC(Cc2ccccc2)CC1 ZINC000495081083 906227068 /nfs/dbraw/zinc/22/70/68/906227068.db2.gz SNEJNJHUPNSHRM-WIOPSUGQSA-N 0 3 424.560 4.364 20 0 HIADHN C[C@H](C(=O)NCCCN1CCN(C)C[C@@H]1c1ccccc1)c1ccc(Cl)s1 ZINC000495182639 906292096 /nfs/dbraw/zinc/29/20/96/906292096.db2.gz HVICHHIHZSCPIL-FUHWJXTLSA-N 0 3 405.995 4.000 20 0 HIADHN CC(C)Nc1ccc(C(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)cn1 ZINC000495189761 906298852 /nfs/dbraw/zinc/29/88/52/906298852.db2.gz IGSZNWRPWCQNKS-UHFFFAOYSA-N 0 3 408.468 4.125 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)C(=O)Nc1csc2ccccc12 ZINC000495282402 906355570 /nfs/dbraw/zinc/35/55/70/906355570.db2.gz DZZKNEVOQWQDPK-UHFFFAOYSA-N 0 3 415.946 4.084 20 0 HIADHN C[C@@H](NCCNc1cccc(Br)c1)c1ccc(-n2cncn2)cc1Cl ZINC000495395466 906424954 /nfs/dbraw/zinc/42/49/54/906424954.db2.gz FCLWQGWHDSLUCI-CYBMUJFWSA-N 0 3 420.742 4.446 20 0 HIADHN Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)N[C@H](C)c1cccc(N2CCOCC2)c1 ZINC000495415415 906437744 /nfs/dbraw/zinc/43/77/44/906437744.db2.gz PSVDWYKRXFHNBL-HUUCEWRRSA-N 0 3 410.484 4.311 20 0 HIADHN COc1cc(-c2noc(CN[C@H](Cc3ccccc3)C3CC3)n2)ccc1OC(F)F ZINC000495491525 906482790 /nfs/dbraw/zinc/48/27/90/906482790.db2.gz YRVWGXPJCQUVNL-QGZVFWFLSA-N 0 3 415.440 4.458 20 0 HIADHN CCS(=O)(=O)c1ccc(N2CCC(N[C@H](C)c3ccc(F)cc3F)CC2)cc1 ZINC000495682460 906523343 /nfs/dbraw/zinc/52/33/43/906523343.db2.gz IGGQHLZBDVNVJB-OAHLLOKOSA-N 0 3 408.514 4.078 20 0 HIADHN CCCOc1c(Cl)cc(C(=O)N(CCN(C)C)Cc2ccccc2)cc1OC ZINC000495980472 906590472 /nfs/dbraw/zinc/59/04/72/906590472.db2.gz FKNDXOCNFMZLHB-UHFFFAOYSA-N 0 3 404.938 4.341 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)CSCc1cc(-c2cccs2)on1 ZINC000496000739 906595312 /nfs/dbraw/zinc/59/53/12/906595312.db2.gz YEGOIHSVIDTTMC-UHFFFAOYSA-N 0 3 415.584 4.227 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)CSCc1ccc(Cl)cc1 ZINC000496247463 906638208 /nfs/dbraw/zinc/63/82/08/906638208.db2.gz WMHJDHFKCFYENK-OAQYLSRUSA-N 0 3 418.006 4.481 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)c1csc(-c2cccs2)n1 ZINC000496247488 906638400 /nfs/dbraw/zinc/63/84/00/906638400.db2.gz WONIPDASCYISSW-QGZVFWFLSA-N 0 3 412.584 4.393 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)c1cnn(-c2cccc(Cl)c2)c1 ZINC000496262494 906641993 /nfs/dbraw/zinc/64/19/93/906641993.db2.gz LNANKLUYZFEBKH-QFIPXVFZSA-N 0 3 423.948 4.047 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)c1csc(-c2ccc(F)cc2)n1 ZINC000496262432 906642247 /nfs/dbraw/zinc/64/22/47/906642247.db2.gz LBUZHDJHUKAHMZ-FQEVSTJZSA-N 0 3 424.545 4.471 20 0 HIADHN CC(=O)c1cccc(OCCCC(=O)NC[C@@H](c2cccs2)N2CCCC2)c1 ZINC000496465598 906688171 /nfs/dbraw/zinc/68/81/71/906688171.db2.gz WGUUCGILKFXRPL-FQEVSTJZSA-N 0 3 400.544 4.063 20 0 HIADHN O=C(Nc1ccc(O)cc1)C1CCN(Cc2cccc(OCC(F)(F)F)c2)CC1 ZINC000512614693 921262357 /nfs/dbraw/zinc/26/23/57/921262357.db2.gz RUFKWNZAYZDQHF-UHFFFAOYSA-N 0 3 408.420 4.184 20 0 HIADHN Cc1csc(C2(NC(=O)[C@@H]3CCCN(Cc4cccc(F)c4)C3)CCCC2)n1 ZINC000497048326 906797428 /nfs/dbraw/zinc/79/74/28/906797428.db2.gz NOWQFCHWLJBRNL-GOSISDBHSA-N 0 3 401.551 4.388 20 0 HIADHN CN(Cc1ccc(OC(F)(F)F)cc1)C[C@@H](O)COCc1ccccc1Cl ZINC000497161139 906814896 /nfs/dbraw/zinc/81/48/96/906814896.db2.gz LOSACABHWZAIQU-MRXNPFEDSA-N 0 3 403.828 4.248 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)Nc3ccc(-n4ccnc4)c(Cl)c3)cc2)CC1 ZINC000512646170 921272928 /nfs/dbraw/zinc/27/29/28/921272928.db2.gz UVCBIOAUCVRGMA-UHFFFAOYSA-N 0 3 423.948 4.308 20 0 HIADHN COc1cc([C@H](C)NC(=O)N2CC[C@@H]3CCN(C)C[C@@H]32)ccc1OCc1ccccc1 ZINC000497375719 906863746 /nfs/dbraw/zinc/86/37/46/906863746.db2.gz CABYOJXXVAOOCK-VCOUNFBDSA-N 0 3 423.557 4.071 20 0 HIADHN C/C=C/c1ccc(NC(=O)N2CCC[C@@H](CN3CCN(c4ccccn4)CC3)C2)cc1 ZINC000497383833 906870142 /nfs/dbraw/zinc/87/01/42/906870142.db2.gz GFUQFXWGGHQXKS-KSBKHAFUSA-N 0 3 419.573 4.181 20 0 HIADHN CN(C)[C@@H](CNC(=O)C1(c2ccc(Br)cc2)CCC1)c1ccccc1 ZINC000497383946 906870404 /nfs/dbraw/zinc/87/04/04/906870404.db2.gz HTZGMDDGBVGDTQ-IBGZPJMESA-N 0 3 401.348 4.290 20 0 HIADHN O=C(Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1)c1ncccc1Cl ZINC000497399815 906880279 /nfs/dbraw/zinc/88/02/79/906880279.db2.gz PPKHQBAHCFPOJP-UHFFFAOYSA-N 0 3 420.944 4.352 20 0 HIADHN CN1C[C@@H](NC(=O)CCCc2ccc(Br)s2)[C@@H](c2ccccc2)C1 ZINC000497415656 906890610 /nfs/dbraw/zinc/89/06/10/906890610.db2.gz HWXYRSOIHDTASZ-IAGOWNOFSA-N 0 3 407.377 4.047 20 0 HIADHN O=C(NC[C@]1(O)CCN(Cc2ccccc2)C1)Nc1cc(C(F)F)ccc1Cl ZINC000497424935 906897429 /nfs/dbraw/zinc/89/74/29/906897429.db2.gz DRDKGPIAMWMRMS-HXUWFJFHSA-N 0 3 409.864 4.036 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N[C@@H](C)c2cc(OC)c(OC)cc2F)N(C)C)cc1 ZINC000512667479 921281481 /nfs/dbraw/zinc/28/14/81/921281481.db2.gz PTFYKGICHLJJSH-YWZLYKJASA-N 0 3 417.525 4.068 20 0 HIADHN Cc1ccc(CNC(=O)C2CCN(Cc3ccc(OCC(F)F)cc3)CC2)cc1 ZINC000512669790 921282273 /nfs/dbraw/zinc/28/22/73/921282273.db2.gz YMVUHEXJPOIMMG-UHFFFAOYSA-N 0 3 402.485 4.167 20 0 HIADHN O=C(NCc1ccccc1)[C@@H](NCCc1c[nH]c2cc(F)ccc12)c1ccccc1 ZINC000497503807 906990895 /nfs/dbraw/zinc/99/08/95/906990895.db2.gz BGNKMHXCEJGXEO-DEOSSOPVSA-N 0 3 401.485 4.497 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)NCc3ccccc3COc3ccccc3Cl)[C@H]2C1 ZINC000497506463 906996584 /nfs/dbraw/zinc/99/65/84/906996584.db2.gz IANFVEDQUZLJGI-UWJYYQICSA-N 0 3 413.949 4.155 20 0 HIADHN Cc1ccc(CNC(=O)C2CCN(Cc3ccccc3OCC(F)(F)F)CC2)cc1 ZINC000512676999 921284693 /nfs/dbraw/zinc/28/46/93/921284693.db2.gz GOQJBHPCAZBYAR-UHFFFAOYSA-N 0 3 420.475 4.465 20 0 HIADHN Cc1cc(C(=O)NC[C@H](c2cccs2)N2CCCC2)c(C)n1-c1nccs1 ZINC000512684861 921286465 /nfs/dbraw/zinc/28/64/65/921286465.db2.gz LBUNGHHUVMVAOL-QGZVFWFLSA-N 0 3 400.573 4.179 20 0 HIADHN Cc1cn(-c2ccc(F)cc2)nc1C(=O)Nc1cccc(N2CCN(C(C)C)CC2)c1 ZINC000512698395 921291062 /nfs/dbraw/zinc/29/10/62/921291062.db2.gz AHOBZEZFBIQUAW-UHFFFAOYSA-N 0 3 421.520 4.103 20 0 HIADHN COc1cccc([C@H]2CCCN2C[C@H](O)COc2cccc(Br)c2)c1 ZINC000497611691 907090032 /nfs/dbraw/zinc/09/00/32/907090032.db2.gz PHAFTJCOTNMOHE-FXAWDEMLSA-N 0 3 406.320 4.035 20 0 HIADHN CN1CCC[C@@H](CNC(=O)c2occ3c2CCOC3)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000512745230 921300660 /nfs/dbraw/zinc/30/06/60/921300660.db2.gz WOCUJADMJODVSM-HNAYVOBHSA-N 0 3 422.447 4.184 20 0 HIADHN CC[C@H](CNC(=O)Nc1cnn(CC(C)C)c1C1CC1)N1CCc2ccccc2C1 ZINC000497676255 907180227 /nfs/dbraw/zinc/18/02/27/907180227.db2.gz HLRBKNIGKLFOCX-OAQYLSRUSA-N 0 3 409.578 4.375 20 0 HIADHN COc1cc(C)c(CN(C)C[C@@H](O)CO[C@@H](C)c2ccc(Cl)cc2)cc1OC ZINC000497706077 907209736 /nfs/dbraw/zinc/20/97/36/907209736.db2.gz LDBXIMQLIALILC-OXJNMPFZSA-N 0 3 407.938 4.236 20 0 HIADHN Cc1noc(C)c1C[C@H](C)NC(=O)NC[C@@H](c1ccc(CC(C)C)cc1)N(C)C ZINC000497732158 907230717 /nfs/dbraw/zinc/23/07/17/907230717.db2.gz WIHNRTACCINYCA-AOMKIAJQSA-N 0 3 400.567 4.023 20 0 HIADHN CCOCCCNC(=O)C1CCN(Cc2ccc(-c3ccccc3)cc2OC)CC1 ZINC000512798060 921313309 /nfs/dbraw/zinc/31/33/09/921313309.db2.gz QHXMFHICABGTEB-UHFFFAOYSA-N 0 3 410.558 4.117 20 0 HIADHN CC[C@@](C)(NCC1(CN[C@](C)(CC)c2nc(C)cs2)COC1)c1nc(C)cs1 ZINC000497848763 907328858 /nfs/dbraw/zinc/32/88/58/907328858.db2.gz ZNLQJNNGTTWYDH-WOJBJXKFSA-N 0 3 422.664 4.363 20 0 HIADHN CCc1ccc([C@@H](N[C@@H](C)CCn2cccn2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000497850953 907330496 /nfs/dbraw/zinc/33/04/96/907330496.db2.gz DKPXFALHIBRVGA-FDDCHVKYSA-N 0 3 411.571 4.007 20 0 HIADHN COc1cc(Cl)c(C)cc1NC(=O)[C@@H](C)N1CCN(CC2CCCCC2)CC1 ZINC000497995626 907473829 /nfs/dbraw/zinc/47/38/29/907473829.db2.gz GDBZYRQSXSVWSI-QGZVFWFLSA-N 0 3 407.986 4.182 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)[C@@H]1C[C@H]1c1ccc(Br)cc1 ZINC000498054122 907565325 /nfs/dbraw/zinc/56/53/25/907565325.db2.gz LTWPIEPJZLGMPF-LEWJYISDSA-N 0 3 413.359 4.117 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N[C@@H]1CCCOc2c(F)cccc21 ZINC000498112650 907623651 /nfs/dbraw/zinc/62/36/51/907623651.db2.gz VYIRLHTZPFBAAG-QZTJIDSGSA-N 0 3 403.523 4.237 20 0 HIADHN CC[C@H](C)c1ccc([C@H](NC(=O)N(C)CCCN2CCN(C)CC2)C(C)C)cc1 ZINC000498128229 907645504 /nfs/dbraw/zinc/64/55/04/907645504.db2.gz TVQWHKYCEHLVSY-NZQKXSOJSA-N 0 3 402.627 4.176 20 0 HIADHN O=C(NC[C@H]1CCCN1Cc1ccccc1)N[C@H](c1cccc(F)c1)c1ccccn1 ZINC000498241918 907777907 /nfs/dbraw/zinc/77/79/07/907777907.db2.gz CEDZXCOQOPYJGZ-ISKFKSNPSA-N 0 3 418.516 4.274 20 0 HIADHN O=C(N[C@H](CC1CCC1)c1ccccc1)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1CO ZINC000498359888 907857210 /nfs/dbraw/zinc/85/72/10/907857210.db2.gz MWSXSHFQFYIPEE-ISJGIBHGSA-N 0 3 421.585 4.100 20 0 HIADHN O=C(N[C@H](CC1CCC1)c1ccccc1)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1CO ZINC000498359889 907857363 /nfs/dbraw/zinc/85/73/63/907857363.db2.gz MWSXSHFQFYIPEE-UBFVSLLYSA-N 0 3 421.585 4.100 20 0 HIADHN CC[C@H](NCc1ccc(OCc2cn3cccc(C)c3n2)cc1)[C@H](O)C(F)(F)F ZINC000498369930 907861445 /nfs/dbraw/zinc/86/14/45/907861445.db2.gz YCDRBKBWHLJFEJ-OALUTQOASA-N 0 3 407.436 4.013 20 0 HIADHN O=C(N[C@H](c1ccccc1Cl)c1cc(F)ccc1F)N1CCN2CCC1CC2 ZINC000498403108 907884578 /nfs/dbraw/zinc/88/45/78/907884578.db2.gz SNJNLBMLJZAKTC-HXUWFJFHSA-N 0 3 405.876 4.197 20 0 HIADHN O=C(N1CCCC1)N1CCC[C@@H](NCc2cnc(-c3ccc(Cl)cc3)s2)C1 ZINC000512873733 921370968 /nfs/dbraw/zinc/37/09/68/921370968.db2.gz DZLGZKIDCOZKRF-QGZVFWFLSA-N 0 3 404.967 4.233 20 0 HIADHN CN(C)Cc1ccccc1CNC(=O)CSCc1ccc(Br)cc1 ZINC000498553596 908016336 /nfs/dbraw/zinc/01/63/36/908016336.db2.gz GVJFPXBURLFGBJ-UHFFFAOYSA-N 0 3 407.377 4.060 20 0 HIADHN CC[C@H](C)n1ncc2c1nc(C)cc2C(=O)N(CCN(C)C)Cc1ccc(F)cc1 ZINC000498720247 908144952 /nfs/dbraw/zinc/14/49/52/908144952.db2.gz PDMSFKSQONAQPU-KRWDZBQOSA-N 0 3 411.525 4.054 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@H]2CNC(=O)N[C@H](CN(C)C)c2ccc(F)cc2)cc1 ZINC000498724084 908150157 /nfs/dbraw/zinc/15/01/57/908150157.db2.gz ZJXHHSIPEIUWDU-WWNPGLIZSA-N 0 3 413.537 4.204 20 0 HIADHN C[C@H](NCc1ccc(-c2ccccc2Br)s1)C1(S(C)(=O)=O)CC1 ZINC000512891099 921384802 /nfs/dbraw/zinc/38/48/02/921384802.db2.gz ODWVHLNIQOBJGP-LBPRGKRZSA-N 0 3 414.390 4.233 20 0 HIADHN CCc1ccc([C@H](CNC(=O)Nc2ccc(C(=O)N3CCCC3)cc2C)N(C)C)cc1 ZINC000498823960 908232256 /nfs/dbraw/zinc/23/22/56/908232256.db2.gz CUFCMDWAXRSKFR-QHCPKHFHSA-N 0 3 422.573 4.218 20 0 HIADHN Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000498857723 908260576 /nfs/dbraw/zinc/26/05/76/908260576.db2.gz STTPKHJTPRGVIP-SIKLNZKXSA-N 0 3 420.557 4.188 20 0 HIADHN Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000498857724 908260750 /nfs/dbraw/zinc/26/07/50/908260750.db2.gz STTPKHJTPRGVIP-UGKGYDQZSA-N 0 3 420.557 4.188 20 0 HIADHN Cc1cnc(C(C)(C)NC(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)s1 ZINC000512905961 921397576 /nfs/dbraw/zinc/39/75/76/921397576.db2.gz ATOKRWSHJITMTP-SFHVURJKSA-N 0 3 404.580 4.076 20 0 HIADHN CO[C@H](C)c1nc(CNC(=O)NC[C@@H](c2ccc(CC(C)C)cc2)N(C)C)cs1 ZINC000498899330 908305813 /nfs/dbraw/zinc/30/58/13/908305813.db2.gz FNZJGTLIPIRMMJ-UZLBHIALSA-N 0 3 418.607 4.151 20 0 HIADHN FC(F)(F)c1ccc(-c2noc(CN3CCC[C@H](c4nc(C5CC5)n[nH]4)C3)n2)cc1 ZINC000498916432 908325324 /nfs/dbraw/zinc/32/53/24/908325324.db2.gz QYHCQASXRPCJMV-AWEZNQCLSA-N 0 3 418.423 4.131 20 0 HIADHN FC(F)(F)c1ccc(-c2noc(CN3CCC[C@H](c4n[nH]c(C5CC5)n4)C3)n2)cc1 ZINC000498916432 908325331 /nfs/dbraw/zinc/32/53/31/908325331.db2.gz QYHCQASXRPCJMV-AWEZNQCLSA-N 0 3 418.423 4.131 20 0 HIADHN CCN1C[C@@H](C)N(CC(=O)Nc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C[C@H]1C ZINC000498924057 908334096 /nfs/dbraw/zinc/33/40/96/908334096.db2.gz JVRSOPRJYMNIDR-VXGBXAGGSA-N 0 3 411.390 4.077 20 0 HIADHN CCCCOc1ccc(-c2nnc(CN3CCC[C@H](c4nc(C5CC5)n[nH]4)C3)o2)cc1 ZINC000498924245 908334291 /nfs/dbraw/zinc/33/42/91/908334291.db2.gz UHWDSBMJBASRAW-SFHVURJKSA-N 0 3 422.533 4.291 20 0 HIADHN CCCCOc1ccc(-c2nnc(CN3CCC[C@H](c4n[nH]c(C5CC5)n4)C3)o2)cc1 ZINC000498924245 908334305 /nfs/dbraw/zinc/33/43/05/908334305.db2.gz UHWDSBMJBASRAW-SFHVURJKSA-N 0 3 422.533 4.291 20 0 HIADHN O=C(Nc1ccccc1)[C@@H](c1ccccc1)N1CCC[C@H](c2nc(C3CC3)n[nH]2)C1 ZINC000498935727 908343197 /nfs/dbraw/zinc/34/31/97/908343197.db2.gz AEBYMIKUOKZMAB-PZJWPPBQSA-N 0 3 401.514 4.242 20 0 HIADHN CC[C@H](C)Sc1ccc(NC(=O)C(=O)NC[C@H](C)N2CCC[C@H](C)C2)c(C)c1 ZINC000498948032 908352844 /nfs/dbraw/zinc/35/28/44/908352844.db2.gz AQDWFZNGESKBEN-SZMVWBNQSA-N 0 3 405.608 4.061 20 0 HIADHN CC[C@H](C)Sc1ccc(NC(=O)C(=O)NC[C@H](C)N2CCC(C)CC2)c(C)c1 ZINC000499000881 908378433 /nfs/dbraw/zinc/37/84/33/908378433.db2.gz OFASRZRXJRPNMF-ROUUACIJSA-N 0 3 405.608 4.061 20 0 HIADHN COc1ccc(C[C@@H](NCC(=O)Nc2ccc(OC)cc2)c2ccc(OC)cc2)cc1 ZINC000499061365 908429605 /nfs/dbraw/zinc/42/96/05/908429605.db2.gz ZSXSPFJTIRXPAP-XMMPIXPASA-N 0 3 420.509 4.225 20 0 HIADHN C[C@H]1CN(C(=O)NCC2(C3CCCCC3)CCCCC2)CC[C@H]1N1CCN(C)CC1 ZINC000499148669 908507820 /nfs/dbraw/zinc/50/78/20/908507820.db2.gz FZJWWVYFDSMGKR-JTHBVZDNSA-N 0 3 418.670 4.185 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cccc([C@H]2CCCOC2)c1)c1cccc(OC)c1 ZINC000499151507 908510792 /nfs/dbraw/zinc/51/07/92/908510792.db2.gz RMHZQCPUDCVWCP-UPVQGACJSA-N 0 3 410.558 4.402 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cccc([C@@H]2CCCOC2)c1)c1cccc(OC)c1 ZINC000499151508 908511570 /nfs/dbraw/zinc/51/15/70/908511570.db2.gz RMHZQCPUDCVWCP-VWNXMTODSA-N 0 3 410.558 4.402 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N[C@@H](C)c3cccc(F)c3F)c(C)c2)CC1 ZINC000499167895 908520128 /nfs/dbraw/zinc/52/01/28/908520128.db2.gz NGQHMCJKMULQOU-INIZCTEOSA-N 0 3 402.489 4.298 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)[C@@H]1C[C@@H]1c1cccc(Br)c1 ZINC000499365044 908731774 /nfs/dbraw/zinc/73/17/74/908731774.db2.gz SAWKVKLBRCOZQN-WOJBJXKFSA-N 0 3 419.338 4.282 20 0 HIADHN COCc1ccc(C(=O)N(CCN2CCCC2)Cc2ccc(Cl)c(Cl)c2)o1 ZINC000499368420 908736326 /nfs/dbraw/zinc/73/63/26/908736326.db2.gz JOIUKKXLJWBWSP-UHFFFAOYSA-N 0 3 411.329 4.471 20 0 HIADHN Cc1oc(-c2ccccc2)nc1CC(=O)N(CCN(C)C)Cc1ccc(F)c(F)c1 ZINC000499374049 908741470 /nfs/dbraw/zinc/74/14/70/908741470.db2.gz DRMGUARTAUQSJN-UHFFFAOYSA-N 0 3 413.468 4.061 20 0 HIADHN CCc1c(C(=O)N(C)C2CCN(Cc3ccccc3)CC2)cnn1-c1ccccc1 ZINC000499469553 908808620 /nfs/dbraw/zinc/80/86/20/908808620.db2.gz IWFNYFQBZOKYSV-UHFFFAOYSA-N 0 3 402.542 4.171 20 0 HIADHN Cc1nn2c(CNC[C@H](c3c(F)cccc3Cl)N3CCCC3)c(C)nc2s1 ZINC000499655477 908866213 /nfs/dbraw/zinc/86/62/13/908866213.db2.gz HUIUJIVPBDHENT-QGZVFWFLSA-N 0 3 407.946 4.127 20 0 HIADHN CCOc1cccc(CNC(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)c1 ZINC000499680613 908875000 /nfs/dbraw/zinc/87/50/00/908875000.db2.gz WJPZJHUAOMCPID-HXUWFJFHSA-N 0 3 401.576 4.419 20 0 HIADHN CSCc1ccc(CNCc2cn(C)nc2-c2ccc3c(c2)OCCCO3)cc1 ZINC000512977318 921449183 /nfs/dbraw/zinc/44/91/83/921449183.db2.gz JZPJUFOLTVJBQI-UHFFFAOYSA-N 0 3 409.555 4.401 20 0 HIADHN COc1ccc([C@H]2C[C@H](NC(=O)NC[C@H](c3ccccc3)N3CCCC3)C2)cc1F ZINC000499768296 908908495 /nfs/dbraw/zinc/90/84/95/908908495.db2.gz HNPYHLMQJBHNKQ-KCZVDYSFSA-N 0 3 411.521 4.217 20 0 HIADHN CSCc1ccc(CNCc2ccc(Br)cc2N2CCOCC2)cc1 ZINC000512977985 921450650 /nfs/dbraw/zinc/45/06/50/921450650.db2.gz VRCLRCXSXZTMKY-UHFFFAOYSA-N 0 3 421.404 4.439 20 0 HIADHN O=C(NCc1ccnc(OC2CCCC2)c1)NC[C@@H](c1cccs1)N1CCCC1 ZINC000499795272 908927408 /nfs/dbraw/zinc/92/74/08/908927408.db2.gz VLTYKHZGORAOLP-IBGZPJMESA-N 0 3 414.575 4.101 20 0 HIADHN CC(C)N(C)CC(=O)N[C@@H](c1ccccc1)c1ccc2[nH]c(C(F)(F)F)nc2c1 ZINC000499858184 908992959 /nfs/dbraw/zinc/99/29/59/908992959.db2.gz CBGSZIJHYUPBIG-IBGZPJMESA-N 0 3 404.436 4.128 20 0 HIADHN CC(C)N(C)CC(=O)N[C@@H](c1ccccc1)c1ccc2nc(C(F)(F)F)[nH]c2c1 ZINC000499858184 908992987 /nfs/dbraw/zinc/99/29/87/908992987.db2.gz CBGSZIJHYUPBIG-IBGZPJMESA-N 0 3 404.436 4.128 20 0 HIADHN O=C(CCc1nc2cc(C(F)(F)F)ccc2s1)N1CCN(C2CCCC2)CC1 ZINC000499874911 909004631 /nfs/dbraw/zinc/00/46/31/909004631.db2.gz CWNZKNIUJUKMQO-UHFFFAOYSA-N 0 3 411.493 4.335 20 0 HIADHN CCOC(=O)C1CCN(C(=O)CN(C)[C@@H](c2ccc(Cl)cc2)C2CCCC2)CC1 ZINC000499911905 909028894 /nfs/dbraw/zinc/02/88/94/909028894.db2.gz OFDIEHGZXYDTGM-JOCHJYFZSA-N 0 3 420.981 4.305 20 0 HIADHN CCOc1cc2c(cc1[C@@H]1C[C@H]1C(=O)N(CCN(C)C)Cc1ccccc1)O[C@@H](C)C2 ZINC000499936973 909044506 /nfs/dbraw/zinc/04/45/06/909044506.db2.gz QZTWPDNPUCYOJV-AVCGJXAMSA-N 0 3 422.569 4.103 20 0 HIADHN Brc1ccc(-n2cc(CN3CCC[C@@H](c4nccs4)C3)cn2)cc1 ZINC000513026781 921487127 /nfs/dbraw/zinc/48/71/27/921487127.db2.gz FTABSVCBAXFPRA-OAHLLOKOSA-N 0 3 403.349 4.471 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2ccc(-c3noc(C(F)(F)F)n3)cc2)N(C)C)cc1 ZINC000499979734 909428252 /nfs/dbraw/zinc/42/82/52/909428252.db2.gz ZIEVBGWLACEALC-QGZVFWFLSA-N 0 3 418.419 4.097 20 0 HIADHN COc1cc(CN2CCC[C@@H](CNC(=O)c3ccccc3)C2)c(SC)cc1OC ZINC000513041237 921499645 /nfs/dbraw/zinc/49/96/45/921499645.db2.gz OIOAXSOFDANWDV-KRWDZBQOSA-N 0 3 414.571 4.068 20 0 HIADHN CN(C(=O)c1csc(-c2ccc(F)cc2)n1)C1CCN(CCc2ccccn2)CC1 ZINC000500068190 909539131 /nfs/dbraw/zinc/53/91/31/909539131.db2.gz ZDRJVNQUMDNPFK-UHFFFAOYSA-N 0 3 424.545 4.123 20 0 HIADHN Cc1noc(C)c1[C@H](C)CNC(=O)NC[C@H](c1ccc(CC(C)C)cc1)N(C)C ZINC000500101918 909582015 /nfs/dbraw/zinc/58/20/15/909582015.db2.gz JIXWTWWZKMKMJP-IIBYNOLFSA-N 0 3 400.567 4.196 20 0 HIADHN COc1ccc(C(=O)CCCC(=O)N[C@H]2CCN(Cc3ccccc3)C[C@@H]2C)cc1 ZINC000500103911 909587082 /nfs/dbraw/zinc/58/70/82/909587082.db2.gz FFJXGSXTWNPKOQ-CVDCTZTESA-N 0 3 408.542 4.075 20 0 HIADHN CC(C)(C)OC(=O)c1cccc(CN2CCC(C(=O)N3CCc4ccccc43)CC2)c1 ZINC000500131205 909612990 /nfs/dbraw/zinc/61/29/90/909612990.db2.gz HLWFMLQHGSZDOD-UHFFFAOYSA-N 0 3 420.553 4.443 20 0 HIADHN CCc1nnc(NC(=O)[C@@H](C)[C@@H](C)NCc2cc(Cl)c(OC)cc2Cl)s1 ZINC000513066048 921521415 /nfs/dbraw/zinc/52/14/15/921521415.db2.gz ZJJITHUILNPHLI-VHSXEESVSA-N 0 3 417.362 4.169 20 0 HIADHN CCc1nnc(NC(=O)[C@@H](C)[C@@H](C)NCc2ccc(-c3cccc(F)c3F)o2)s1 ZINC000513069678 921525086 /nfs/dbraw/zinc/52/50/86/921525086.db2.gz PGMYGRMNMICRNP-NWDGAFQWSA-N 0 3 420.485 4.392 20 0 HIADHN C[C@H](c1ccccc1C(F)(F)F)[C@H](C)NC(=O)C(=O)Nc1cccc(CN(C)C)c1 ZINC000500377086 909824002 /nfs/dbraw/zinc/82/40/02/909824002.db2.gz IDPJODBAJCTVKG-GJZGRUSLSA-N 0 3 421.463 4.014 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)CCc2cn(C)c3ccccc23)cc1 ZINC000500388307 909828661 /nfs/dbraw/zinc/82/86/61/909828661.db2.gz IDBKOYMYLMTLMB-HSZRJFAPSA-N 0 3 405.542 4.073 20 0 HIADHN C[C@H](NC(=O)NCC(C)(C)N1CCc2ccccc2C1)c1ccccc1OC(F)F ZINC000500405800 909837944 /nfs/dbraw/zinc/83/79/44/909837944.db2.gz STMFLLTVFWHDCB-INIZCTEOSA-N 0 3 417.500 4.485 20 0 HIADHN COc1cc(CN[C@@H](C)c2ccc(OCc3ccncc3)c(OC)c2)cc(OC)c1O ZINC000513075703 921529377 /nfs/dbraw/zinc/52/93/77/921529377.db2.gz OFOHSRATRJNFMC-INIZCTEOSA-N 0 3 424.497 4.243 20 0 HIADHN CCCOc1cccc(CNCc2ccc(S(=O)(=O)N3CCC[C@H](C)C3)cc2)c1 ZINC000513076811 921530729 /nfs/dbraw/zinc/53/07/29/921530729.db2.gz RWVIGQUNHMTYSJ-IBGZPJMESA-N 0 3 416.587 4.186 20 0 HIADHN COc1ccc(CCNC(=O)c2oc3ccccc3c2CN(C)C)c(Cl)c1OC ZINC000500577702 909941667 /nfs/dbraw/zinc/94/16/67/909941667.db2.gz XNMPBNFFUISBPO-UHFFFAOYSA-N 0 3 416.905 4.138 20 0 HIADHN O=C(NC[C@H]1CCCN(Cc2c[nH]nc2-c2cccc(Cl)c2)C1)c1ccccc1 ZINC000513088171 921538689 /nfs/dbraw/zinc/53/86/89/921538689.db2.gz FTHPIMRRVDFHFF-QGZVFWFLSA-N 0 3 408.933 4.372 20 0 HIADHN CC(C)(CNC(=O)Cc1nc(-c2ccc(F)cc2)cs1)N1CCc2ccccc2C1 ZINC000500694884 910027563 /nfs/dbraw/zinc/02/75/63/910027563.db2.gz COOIOXNWXYZTOZ-UHFFFAOYSA-N 0 3 423.557 4.445 20 0 HIADHN COc1cc(CNCc2ccc(-c3cccc(C)c3)cc2)cc(Cl)c1OCC(N)=O ZINC000500745990 910056088 /nfs/dbraw/zinc/05/60/88/910056088.db2.gz HGAWFXACMFWBNG-UHFFFAOYSA-N 0 3 424.928 4.478 20 0 HIADHN CN(C)Cc1cc(NC(=O)c2ccc(CN3CCSCC3)cc2)ccc1Cl ZINC000500747932 910058844 /nfs/dbraw/zinc/05/88/44/910058844.db2.gz YFKFJUVPSVHNEM-UHFFFAOYSA-N 0 3 403.979 4.203 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)Cc2csc(-c3cccc(F)c3)n2)C1 ZINC000500839755 910116954 /nfs/dbraw/zinc/11/69/54/910116954.db2.gz FOBPZHJTJOREHL-OXJNMPFZSA-N 0 3 409.530 4.443 20 0 HIADHN Fc1ccc(-c2noc([C@H]3CCCN(Cc4cnn(CC(F)(F)F)c4)C3)n2)cc1 ZINC000513106623 921554685 /nfs/dbraw/zinc/55/46/85/921554685.db2.gz OVVVCNROLTXDHQ-HNNXBMFYSA-N 0 3 409.387 4.014 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)N[C@@H](c2cccc(C)c2)c2ccccn2)cc1 ZINC000501089072 910288154 /nfs/dbraw/zinc/28/81/54/910288154.db2.gz POSURSGADQUUKS-ZEQRLZLVSA-N 0 3 418.541 4.090 20 0 HIADHN Cc1cccc([C@H](NC(=O)N[C@H]2CCN(Cc3ccccc3)[C@H]2C)c2ccccn2)c1 ZINC000501090089 910289368 /nfs/dbraw/zinc/28/93/68/910289368.db2.gz RQRJDKPZQVKDAE-OPHFCASCSA-N 0 3 414.553 4.442 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCc1cc(Br)cs1)c1ccsc1 ZINC000501139340 910318962 /nfs/dbraw/zinc/31/89/62/910318962.db2.gz BKXPIWAMELFQQV-HNNXBMFYSA-N 0 3 416.410 4.454 20 0 HIADHN COCc1ccccc1/C=C(/C)CN[C@@H]1CCCN(Cc2ccc(F)cc2F)C1=O ZINC000513122970 921567818 /nfs/dbraw/zinc/56/78/18/921567818.db2.gz RENZCNNPZOLKMP-QUDXMAFCSA-N 0 3 414.496 4.295 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CCc2c(cnn2-c2ccccc2)C1)c1ccsc1 ZINC000501185165 910351030 /nfs/dbraw/zinc/35/10/30/910351030.db2.gz GQPQDHINSTYRNF-QFIPXVFZSA-N 0 3 423.586 4.085 20 0 HIADHN COc1ccccc1CN1CCC(C(=O)Nc2ccccc2Br)CC1 ZINC000513129576 921573239 /nfs/dbraw/zinc/57/32/39/921573239.db2.gz ZNQWGSAAGCTRKZ-UHFFFAOYSA-N 0 3 403.320 4.308 20 0 HIADHN CCN(C(=O)c1cnc(C2CCCC2)nc1N)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000501281219 910442601 /nfs/dbraw/zinc/44/26/01/910442601.db2.gz JPKAMFQDZGZSJL-YLJYHZDGSA-N 0 3 407.562 4.014 20 0 HIADHN CC1CCN([C@H](CNC(=O)[C@H](c2ccccc2)n2cccn2)c2ccccc2)CC1 ZINC000513137297 921578262 /nfs/dbraw/zinc/57/82/62/921578262.db2.gz JIJOYLWJWIPLMP-RPWUZVMVSA-N 0 3 402.542 4.062 20 0 HIADHN CC[C@H](CNC(=O)Nc1cc(Cl)c(OC)cc1OC)N1CCc2ccccc2C1 ZINC000501377829 910508030 /nfs/dbraw/zinc/50/80/30/910508030.db2.gz RYFDKAHDLPKINE-QGZVFWFLSA-N 0 3 417.937 4.316 20 0 HIADHN C[C@@H](Oc1ccccc1Cl)C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000501411688 910545448 /nfs/dbraw/zinc/54/54/48/910545448.db2.gz QSSQTUQOKYKPGQ-MRXNPFEDSA-N 0 3 404.963 4.337 20 0 HIADHN CCc1cc(OC)ccc1CNCc1cccc(NC(=O)NCc2ccncc2)c1 ZINC000501424421 910556028 /nfs/dbraw/zinc/55/60/28/910556028.db2.gz OOKSZXWUSFOQDL-UHFFFAOYSA-N 0 3 404.514 4.264 20 0 HIADHN C[C@H](Cc1cncc2ccccc21)C(=O)N(CCN(C)C)Cc1ccc(F)c(F)c1 ZINC000501740841 910801234 /nfs/dbraw/zinc/80/12/34/910801234.db2.gz GSYDZTOQUUHPII-QGZVFWFLSA-N 0 3 411.496 4.282 20 0 HIADHN C[C@@H](C(=O)N(Cc1nnc(-c2ccc(Cl)cc2)o1)C1CC1)N1CCCCCC1 ZINC000501752183 910812544 /nfs/dbraw/zinc/81/25/44/910812544.db2.gz UXOQVKBEXIIWSQ-HNNXBMFYSA-N 0 3 402.926 4.146 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)N(Cc1ccco1)Cc1ccccc1 ZINC000501755735 910814355 /nfs/dbraw/zinc/81/43/55/910814355.db2.gz MOXUAIWZTBRCPT-UHFFFAOYSA-N 0 3 403.526 4.440 20 0 HIADHN CC(=O)Nc1c[nH]nc1[C@@H]1CCCN(C[C@H](C)c2cccc(Br)c2)C1 ZINC000501768072 910823561 /nfs/dbraw/zinc/82/35/61/910823561.db2.gz HDDMZIOSMITUDI-XJKSGUPXSA-N 0 3 405.340 4.114 20 0 HIADHN Cc1cc(NC(=O)[C@H](C)Cc2ccccc2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000501773661 910829329 /nfs/dbraw/zinc/82/93/29/910829329.db2.gz XAUFRCQZCBLJDT-XXBNENTESA-N 0 3 402.542 4.456 20 0 HIADHN C[C@H](NC(=O)N[C@@H](CN1CCCC1)c1ccccc1)c1cccc(OC(F)F)c1 ZINC000501799047 910850327 /nfs/dbraw/zinc/85/03/27/910850327.db2.gz FPLBGHBXBDOXNN-JXFKEZNVSA-N 0 3 403.473 4.485 20 0 HIADHN Cc1cc(NC(=O)[C@@H](C)Cc2ccccc2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000501802362 910854027 /nfs/dbraw/zinc/85/40/27/910854027.db2.gz XAUFRCQZCBLJDT-WMZHIEFXSA-N 0 3 402.542 4.456 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)N1CCc2[nH]c3ccc(F)cc3c2C1 ZINC000501809863 910861265 /nfs/dbraw/zinc/86/12/65/910861265.db2.gz MGFMAEBSTBZTGA-QHCPKHFHSA-N 0 3 406.505 4.212 20 0 HIADHN Cc1ccccc1C1(C(=O)NC[C@@H](C(C)C)N2CCc3ccccc3C2)CCOCC1 ZINC000501817190 910865867 /nfs/dbraw/zinc/86/58/67/910865867.db2.gz BSMPPRWYDKPFRT-VWLOTQADSA-N 0 3 420.597 4.242 20 0 HIADHN CCN(C(=O)c1cnc2c(cnn2C(C)C)c1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000501953166 910941327 /nfs/dbraw/zinc/94/13/27/910941327.db2.gz ZBNUFBRPOYMNEI-PGRDOPGGSA-N 0 3 405.546 4.310 20 0 HIADHN CCN(C(=O)c1ccc2c(c1)NC(=O)CCS2)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000501963724 910949328 /nfs/dbraw/zinc/94/93/28/910949328.db2.gz VWYVOQBUZVZTOT-PXNSSMCTSA-N 0 3 423.582 4.419 20 0 HIADHN COc1ccc(C2(CN[C@H](C)c3nnc(-c4ccc(C)cc4)o3)CCOCC2)cc1 ZINC000513205507 921623284 /nfs/dbraw/zinc/62/32/84/921623284.db2.gz OBLFYJZRXHGJPN-GOSISDBHSA-N 0 3 407.514 4.453 20 0 HIADHN COCCN1CCC(NC(=O)C23C[C@@H]4C[C@H](C2)CC(c2ccc(C)c(C)c2)(C4)C3)CC1 ZINC000502041325 910996857 /nfs/dbraw/zinc/99/68/57/910996857.db2.gz MJISKLNEXRYSGZ-PRSBGKBPSA-N 0 3 424.629 4.368 20 0 HIADHN O=C(Nc1ccc(F)cc1)[C@@H](NC1CCN(c2nccs2)CC1)c1ccccc1 ZINC000502056605 911006265 /nfs/dbraw/zinc/00/62/65/911006265.db2.gz JKCHVCVESSBDLX-FQEVSTJZSA-N 0 3 410.518 4.221 20 0 HIADHN Cc1cccc(Cl)c1NC(=O)CNC(C)(C)COc1ncccc1C(F)(F)F ZINC000502219645 911163871 /nfs/dbraw/zinc/16/38/71/911163871.db2.gz RFLTXQZZNXFXQJ-UHFFFAOYSA-N 0 3 415.843 4.448 20 0 HIADHN c1onc(Cc2ccccc2)c1CN1C[C@H]2CCC[C@@]2(c2nc(CC3CC3)no2)C1 ZINC000513224682 921639109 /nfs/dbraw/zinc/63/91/09/921639109.db2.gz XTCUBFZYHOCPMQ-HYBUGGRVSA-N 0 3 404.514 4.155 20 0 HIADHN O=C(COc1ccc(Oc2ccccn2)cc1)NC[C@@H]1CCCN1Cc1ccccc1 ZINC000513226364 921640624 /nfs/dbraw/zinc/64/06/24/921640624.db2.gz JAZOGWZDJNSQBM-NRFANRHFSA-N 0 3 417.509 4.034 20 0 HIADHN CC(C)NC(=O)c1ccc(C(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)cc1 ZINC000502239382 911191821 /nfs/dbraw/zinc/19/18/21/911191821.db2.gz SSEWTRPUGDFXNM-HXUWFJFHSA-N 0 3 413.587 4.089 20 0 HIADHN CCc1ccc([C@H](CNC(=O)Cc2ccc(OCc3ccccn3)cc2)N(C)C)cc1 ZINC000502286691 911242614 /nfs/dbraw/zinc/24/26/14/911242614.db2.gz XYIBMNUDGNBWMV-VWLOTQADSA-N 0 3 417.553 4.185 20 0 HIADHN C[C@@H](NC(=O)NCC1(N2CCSCC2)CCCC1)c1cccc(OC(F)F)c1 ZINC000502299567 911258358 /nfs/dbraw/zinc/25/83/58/911258358.db2.gz HXVTUMKEQHZMLC-OAHLLOKOSA-N 0 3 413.534 4.010 20 0 HIADHN CC(C)(COc1ncccc1C(F)(F)F)NCC(=O)Nc1ccccc1Cl ZINC000502337513 911316356 /nfs/dbraw/zinc/31/63/56/911316356.db2.gz KLPLPTHLNRMCAW-UHFFFAOYSA-N 0 3 401.816 4.140 20 0 HIADHN C/C=C\COc1ccc(CC[C@H](C)NCc2cc(S(C)(=O)=O)ccc2F)cc1 ZINC000502368824 911353765 /nfs/dbraw/zinc/35/37/65/911353765.db2.gz GPHBPDPZGFBPGV-CHYADLBTSA-N 0 3 405.535 4.295 20 0 HIADHN COc1cc(CCNC(=O)CN2C[C@H](C)C[C@@H]2c2ccccc2)ccc1OC(F)F ZINC000513259367 921664783 /nfs/dbraw/zinc/66/47/83/921664783.db2.gz AZDMTDLMGDZINQ-VQIMIIECSA-N 0 3 418.484 4.038 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1ccc2nccnc2c1)c1ccc(C(F)(F)F)cc1 ZINC000502504642 911507454 /nfs/dbraw/zinc/50/74/54/911507454.db2.gz BLXKONMSIACIBL-FQEVSTJZSA-N 0 3 416.447 4.462 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)[C@H]1Cc2ccccc2O1)c1ccc(C(F)(F)F)cc1 ZINC000502515624 911518494 /nfs/dbraw/zinc/51/84/94/911518494.db2.gz JSUHCHCURWXKFW-AZUAARDMSA-N 0 3 406.448 4.208 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)CCc1c(C)noc1C)c1ccc(C(F)(F)F)cc1 ZINC000502532335 911537449 /nfs/dbraw/zinc/53/74/49/911537449.db2.gz YTVNLTCIFOYOMX-IBGZPJMESA-N 0 3 411.468 4.442 20 0 HIADHN CCc1ccccc1NC(=O)CN(C)C(=O)[C@@H](C)N[C@H](c1ccc(F)cc1)C(C)C ZINC000502552430 911558910 /nfs/dbraw/zinc/55/89/10/911558910.db2.gz PRANIAIRZQJJMV-HXOBKFHXSA-N 0 3 413.537 4.160 20 0 HIADHN CCc1ccccc1NC(=O)CN(C)C(=O)[C@H](C)N[C@H](c1ccc(F)cc1)C(C)C ZINC000502552431 911559772 /nfs/dbraw/zinc/55/97/72/911559772.db2.gz PRANIAIRZQJJMV-SBUREZEXSA-N 0 3 413.537 4.160 20 0 HIADHN Cc1nnc([C@@H]2CCCCN2C(=O)c2cccc(CN(C)Cc3ccccc3)c2)[nH]1 ZINC000513273042 921673666 /nfs/dbraw/zinc/67/36/66/921673666.db2.gz SMQAVFWFVSWHMW-QFIPXVFZSA-N 0 3 403.530 4.113 20 0 HIADHN COc1ccc([C@H](CNC(=O)[C@@H]2C[C@@H]2c2ccc([C@@H]3C[C@@H]3C)o2)N2CCCC2)cc1 ZINC000502607558 911617066 /nfs/dbraw/zinc/61/70/66/911617066.db2.gz AQVNQUYUFNPLSY-QTQOVQFESA-N 0 3 408.542 4.468 20 0 HIADHN COc1cc([C@@H](C)NC(=O)N(CCN(C)C)CC(C)C)ccc1OC1CCCC1 ZINC000502611955 911634551 /nfs/dbraw/zinc/63/45/51/911634551.db2.gz QRPJHAAEAGJDQS-GOSISDBHSA-N 0 3 405.583 4.307 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)c2csc(-c3ccc(F)c(F)c3)n2)CC1 ZINC000502647379 911686120 /nfs/dbraw/zinc/68/61/20/911686120.db2.gz CMVCMHBHDKWFDX-UHFFFAOYSA-N 0 3 417.481 4.418 20 0 HIADHN CCCOc1ccc([C@H](C)NC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1OC ZINC000502667445 911708931 /nfs/dbraw/zinc/70/89/31/911708931.db2.gz MDDCOQUMQQSJEN-GHTZIAJQSA-N 0 3 411.546 4.119 20 0 HIADHN Cc1ccc(-c2nc(CC(=O)Nc3cccc(N4CCN(C(C)C)CC4)c3)cs2)o1 ZINC000502866101 911872404 /nfs/dbraw/zinc/87/24/04/911872404.db2.gz MFXSUDNVFYEYNF-UHFFFAOYSA-N 0 3 424.570 4.423 20 0 HIADHN Cc1nc(-c2c[nH]c(C(=O)Nc3cccc(N4CCN(C(C)C)CC4)c3)c2)cs1 ZINC000502880593 911880825 /nfs/dbraw/zinc/88/08/25/911880825.db2.gz QJFJBPHMCRTWES-UHFFFAOYSA-N 0 3 409.559 4.229 20 0 HIADHN C/C=C/c1ccc(OCC(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)c(OC)c1 ZINC000502881388 911881164 /nfs/dbraw/zinc/88/11/64/911881164.db2.gz QWXVEHWOIBVGRL-FNORWQNLSA-N 0 3 423.557 4.276 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)[C@H](C)Oc3ccccc3Cl)c2)CC1 ZINC000502879722 911881319 /nfs/dbraw/zinc/88/13/19/911881319.db2.gz IOQYLQFWBLRBDE-KRWDZBQOSA-N 0 3 401.938 4.276 20 0 HIADHN Cc1nc(C(F)(F)F)ccc1C(=O)Nc1cccc(N2CCN(C(C)C)CC2)c1 ZINC000502889373 911885290 /nfs/dbraw/zinc/88/52/90/911885290.db2.gz VOCFBLWZHHCAET-UHFFFAOYSA-N 0 3 406.452 4.192 20 0 HIADHN C[C@H]1CCN(Cc2ccnc(-c3ccc(Br)cc3)n2)C[C@H]1n1ccnc1 ZINC000503076587 912048490 /nfs/dbraw/zinc/04/84/90/912048490.db2.gz YPGGPGDTNYBXPM-HNAYVOBHSA-N 0 3 412.335 4.186 20 0 HIADHN c1csc(-c2noc(CCC[N@@H+]3CCC[C@H]3c3nnc(-c4ccccc4)[n-]3)n2)c1 ZINC000503160001 912127299 /nfs/dbraw/zinc/12/72/99/912127299.db2.gz BOGPTAPFOJHAQI-INIZCTEOSA-N 0 3 406.515 4.353 20 0 HIADHN c1csc(-c2noc(CCC[N@H+]3CCC[C@H]3c3nnc(-c4ccccc4)[n-]3)n2)c1 ZINC000503160001 912127317 /nfs/dbraw/zinc/12/73/17/912127317.db2.gz BOGPTAPFOJHAQI-INIZCTEOSA-N 0 3 406.515 4.353 20 0 HIADHN COc1ccc(CN(C)C(=O)NC[C@@H](c2ccc(CC(C)C)cc2)N(C)C)cc1O ZINC000513341464 921725108 /nfs/dbraw/zinc/72/51/08/921725108.db2.gz VMFRUTILQJPKOU-NRFANRHFSA-N 0 3 413.562 4.044 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)N(C)[C@H]3CCc4ccccc43)CC2)c1 ZINC000503200028 912177879 /nfs/dbraw/zinc/17/78/79/912177879.db2.gz AXFHCIDUYSSLMU-VWLOTQADSA-N 0 3 420.601 4.226 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)N(C)[C@@H]3CCC[C@@H](C)C3)CC2)c1 ZINC000503200638 912179938 /nfs/dbraw/zinc/17/99/38/912179938.db2.gz BZTWKXQJUXEGEO-IFMALSPDSA-N 0 3 400.611 4.117 20 0 HIADHN COc1ccc(OC(F)F)c(NC(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)c1 ZINC000506282254 914881691 /nfs/dbraw/zinc/88/16/91/914881691.db2.gz OMEWQTHDURRHNU-GOEBONIOSA-N 0 3 405.445 4.254 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)Nc2cccc(OC[C@H]3CCCO3)c2)C1 ZINC000506295304 914890714 /nfs/dbraw/zinc/89/07/14/914890714.db2.gz PQNNMPCZDZPBKZ-RZFNWQHOSA-N 0 3 409.530 4.201 20 0 HIADHN CCOC1CC(CN[C@H](c2ccc(Cl)cc2)c2cccc(S(C)(=O)=O)c2)C1 ZINC000506296172 914891463 /nfs/dbraw/zinc/89/14/63/914891463.db2.gz XISXBXIKXNYDPN-FFYTWODTSA-N 0 3 407.963 4.238 20 0 HIADHN CCOc1cc2c(cc1NC(=O)N[C@@H]1CCN([C@@H](C)c3ccccc3)C1)O[C@@H](C)C2 ZINC000506309661 914899307 /nfs/dbraw/zinc/89/93/07/914899307.db2.gz NQOYFQHRUQUHQD-ABSDTBQOSA-N 0 3 409.530 4.366 20 0 HIADHN COc1cc(OC)c(NC(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)cc1Cl ZINC000506312740 914902232 /nfs/dbraw/zinc/90/22/32/914902232.db2.gz QFSOHYYNLLIQTQ-GOEBONIOSA-N 0 3 403.910 4.314 20 0 HIADHN COc1cc(CN2CCC[C@H]2c2ccc(C)cc2)ccc1OCC(=O)N1CCCC1 ZINC000506324523 914926211 /nfs/dbraw/zinc/92/62/11/914926211.db2.gz JQKUWEWCIFJIJS-QFIPXVFZSA-N 0 3 408.542 4.342 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCc3ccc4[nH]c(C)cc4c3)c(C)c2)CC1 ZINC000513351887 921732789 /nfs/dbraw/zinc/73/27/89/921732789.db2.gz VXWDXYOXFYLVPV-UHFFFAOYSA-N 0 3 405.546 4.248 20 0 HIADHN CN(Cc1cc(Br)ccc1F)C(=O)c1cccc(CN2CCCC2)c1 ZINC000513355240 921734374 /nfs/dbraw/zinc/73/43/74/921734374.db2.gz LARHIVZYOLRXJW-UHFFFAOYSA-N 0 3 405.311 4.456 20 0 HIADHN COc1cccc2c1[C@@H](C(=O)Nc1cc(C)cc(N3CCN(C(C)C)CC3)c1)CC2 ZINC000506339429 914957051 /nfs/dbraw/zinc/95/70/51/914957051.db2.gz JMYUEQAHZCYBIC-QFIPXVFZSA-N 0 3 407.558 4.203 20 0 HIADHN Cc1noc(C2(C)CCN(Cc3cn(-c4ccccc4)nc3-c3cccnc3)CC2)n1 ZINC000513368211 921741451 /nfs/dbraw/zinc/74/14/51/921741451.db2.gz ZWNDPYJAFFYZLV-UHFFFAOYSA-N 0 3 414.513 4.179 20 0 HIADHN Cc1cc(CN2CCC(NC(=O)c3ccc(F)cc3)CC2)cc(C)c1OC(F)F ZINC000506476829 915076551 /nfs/dbraw/zinc/07/65/51/915076551.db2.gz KSBSVNMFBIDKLE-UHFFFAOYSA-N 0 3 406.448 4.438 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)Nc2cccc(CN3CCCCC3=O)c2)C1 ZINC000506488773 915095936 /nfs/dbraw/zinc/09/59/36/915095936.db2.gz SKZALVXOIQPASD-XXBNENTESA-N 0 3 420.557 4.156 20 0 HIADHN O=C(NC1CCN(Cc2c[nH]nc2-c2ccc(Cl)cc2)CC1)c1ccc(F)cc1 ZINC000506496800 915109508 /nfs/dbraw/zinc/10/95/08/915109508.db2.gz SPKQQOQYHZZIFF-UHFFFAOYSA-N 0 3 412.896 4.264 20 0 HIADHN COc1ccc(Br)c(NC(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)c1 ZINC000506515316 915146542 /nfs/dbraw/zinc/14/65/42/915146542.db2.gz GUGWUVCXTQIUPQ-GOEBONIOSA-N 0 3 418.335 4.415 20 0 HIADHN Cc1cnc(CCN(C)C(=O)NC[C@@H](c2ccc(CC(C)C)cc2)N(C)C)s1 ZINC000513385020 921757565 /nfs/dbraw/zinc/75/75/65/921757565.db2.gz SGSSYDFPTZTNRE-FQEVSTJZSA-N 0 3 402.608 4.137 20 0 HIADHN Cc1noc(C)c1[C@@H](C)CNC(=O)N[C@H](CN1CCc2ccccc2C1)C(C)(C)C ZINC000506610507 915263026 /nfs/dbraw/zinc/26/30/26/915263026.db2.gz AKIOOKBXUZTMFI-HRAATJIYSA-N 0 3 412.578 4.167 20 0 HIADHN CCCNC(=O)C1CCN(Cc2cccc(NC(=O)c3ccccc3Cl)c2)CC1 ZINC000506690153 915368392 /nfs/dbraw/zinc/36/83/92/915368392.db2.gz ZGUMRYYYADPWAP-UHFFFAOYSA-N 0 3 413.949 4.331 20 0 HIADHN O=C(NCc1ccccc1)C1CCN(Cc2cccc(OCc3ccccn3)c2)CC1 ZINC000506727623 915409594 /nfs/dbraw/zinc/40/95/94/915409594.db2.gz UQHOUFUOFPOBHJ-UHFFFAOYSA-N 0 3 415.537 4.189 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(C)c1CN1CCC(C(=O)Nc2ccccc2)CC1 ZINC000506736990 915422833 /nfs/dbraw/zinc/42/28/33/915422833.db2.gz VDTZRWOTRNWYNC-UHFFFAOYSA-N 0 3 406.505 4.479 20 0 HIADHN Cn1cc(CN2CCC(c3nnc4ccccn43)CC2)c(-c2ccccc2Cl)n1 ZINC000506741907 915428979 /nfs/dbraw/zinc/42/89/79/915428979.db2.gz CJZCKQMHEUJUQR-UHFFFAOYSA-N 0 3 406.921 4.163 20 0 HIADHN CCN(Cc1ccc(OC)c(OCc2cccnc2)c1)C[C@H]1COc2ccccc2O1 ZINC000506753394 915446772 /nfs/dbraw/zinc/44/67/72/915446772.db2.gz QVVCFXHCOJFPFU-NRFANRHFSA-N 0 3 420.509 4.331 20 0 HIADHN C[C@H](CNC(=O)Nc1ccnc(Sc2ccccn2)c1)N(C)Cc1ccccc1 ZINC000506754736 915451906 /nfs/dbraw/zinc/45/19/06/915451906.db2.gz AUHRCOCKUKISKX-QGZVFWFLSA-N 0 3 407.543 4.270 20 0 HIADHN CN(C)Cc1cccc(NC(=O)c2cnn(-c3ccc(F)cc3)c2-n2cccc2)c1 ZINC000506781765 915506916 /nfs/dbraw/zinc/50/69/16/915506916.db2.gz PDYCXFAIEBKSPU-UHFFFAOYSA-N 0 3 403.461 4.116 20 0 HIADHN COc1ccc(-c2nc(C)c([C@@H](C)NC(=O)N(CCN(C)C)CC(C)C)s2)cc1 ZINC000507077198 915855826 /nfs/dbraw/zinc/85/58/26/915855826.db2.gz LNPAWXIXOUFLPC-QGZVFWFLSA-N 0 3 418.607 4.417 20 0 HIADHN CCCn1nccc1C1CCN(C(=O)N[C@H](CN2CCCC2)c2ccccc2)CC1 ZINC000507097972 915868620 /nfs/dbraw/zinc/86/86/20/915868620.db2.gz TVESGMKHYKDMTI-JOCHJYFZSA-N 0 3 409.578 4.019 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1C(=O)N1CCCN(CCCc2ccccc2)CC1 ZINC000507113203 915875508 /nfs/dbraw/zinc/87/55/08/915875508.db2.gz POLYKPARTCCMLR-UHFFFAOYSA-N 0 3 416.569 4.270 20 0 HIADHN COc1ccc2c(c1)CCC[C@@H]2N(C)Cc1ccccc1OCC(=O)NCC1CC1 ZINC000507158780 915896981 /nfs/dbraw/zinc/89/69/81/915896981.db2.gz FSUXMKYMBALQHD-QHCPKHFHSA-N 0 3 408.542 4.110 20 0 HIADHN Cc1nc2cc(F)ccc2cc1C(=O)N1CCCN(CCCc2ccccc2)CC1 ZINC000507161942 915899227 /nfs/dbraw/zinc/89/92/27/915899227.db2.gz KYSRQSRXTJSDRT-UHFFFAOYSA-N 0 3 405.517 4.463 20 0 HIADHN Cc1ccccc1[C@@H]1CCN(CC(=O)N2CCC[C@@H]2c2ccc3c(c2)OCCCO3)C1 ZINC000507184821 915932714 /nfs/dbraw/zinc/93/27/14/915932714.db2.gz XCORRBQPAVOSKA-FYYLOGMGSA-N 0 3 420.553 4.309 20 0 HIADHN CCOc1cc(CN(Cc2ccco2)C2CCCC2)ccc1O[C@@H](C)C(=O)N(C)C ZINC000507217095 915967885 /nfs/dbraw/zinc/96/78/85/915967885.db2.gz ZZVQYSDQUNUJJY-SFHVURJKSA-N 0 3 414.546 4.479 20 0 HIADHN COc1ccc(OC)c([C@@H]2CCCN2C(=O)CN2CC[C@H](c3ccccc3C)C2)c1 ZINC000507218585 915970163 /nfs/dbraw/zinc/97/01/63/915970163.db2.gz LLJALXUZHNZUDL-CVDCTZTESA-N 0 3 408.542 4.165 20 0 HIADHN C/C=C/c1ccc(OC[C@H](O)CN2CCC(Nc3ccc(F)cc3)CC2)c(OC)c1 ZINC000507220389 915975044 /nfs/dbraw/zinc/97/50/44/915975044.db2.gz WHTASVLFJNVGPC-LFTXJPJQSA-N 0 3 414.521 4.184 20 0 HIADHN C[C@H](N[C@@H]1CSC[C@H]1C)C(=O)N1N=C(c2ccc(Cl)cc2)C[C@@H]1c1ccco1 ZINC000507252135 916012691 /nfs/dbraw/zinc/01/26/91/916012691.db2.gz LSTZKLDXJBAQPS-GTYSZEQSSA-N 0 3 417.962 4.340 20 0 HIADHN C[C@H](N[C@@H]1CSC[C@H]1C)C(=O)N1N=C(c2ccc(Cl)cc2)C[C@H]1c1ccco1 ZINC000507252134 916013387 /nfs/dbraw/zinc/01/33/87/916013387.db2.gz LSTZKLDXJBAQPS-CFGMGRTJSA-N 0 3 417.962 4.340 20 0 HIADHN CCNC(=O)COc1ccc(CN(C)[C@H](C)c2ccc(C(F)(F)F)cc2)cc1OC ZINC000507331007 916089922 /nfs/dbraw/zinc/08/99/22/916089922.db2.gz DHQDIHZOLZLKDL-OAHLLOKOSA-N 0 3 424.463 4.422 20 0 HIADHN CN1CCC[C@H](CNC(=O)c2cc(C3CC3)no2)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000507356666 916110347 /nfs/dbraw/zinc/11/03/47/916110347.db2.gz HOSDCVXERHDQCR-DNVCBOLYSA-N 0 3 407.436 4.384 20 0 HIADHN CCOC(=O)CC1CCN(Cc2cn(C(C)(C)C)nc2-c2cccc(OC)c2)CC1 ZINC000507372502 916129708 /nfs/dbraw/zinc/12/97/08/916129708.db2.gz QRDYUCUEJHFTEF-UHFFFAOYSA-N 0 3 413.562 4.479 20 0 HIADHN NC(=O)CN(CCC(=O)Nc1cc(Cl)ccc1Cl)CCC1CCCCC1 ZINC000507411577 916182389 /nfs/dbraw/zinc/18/23/89/916182389.db2.gz YCBYYXANDNMVMI-UHFFFAOYSA-N 0 3 400.350 4.080 20 0 HIADHN Cc1sc(Br)c(C(=O)N(Cc2ccco2)C2CCN(C)CC2)c1C ZINC000507532754 916290512 /nfs/dbraw/zinc/29/05/12/916290512.db2.gz PGXPLGRLJBMMGK-UHFFFAOYSA-N 0 3 411.365 4.457 20 0 HIADHN CCOc1ccccc1NC(=O)[C@H](C)N(C)CCCc1cc(-c2ccccc2)n[nH]1 ZINC000507562530 916317858 /nfs/dbraw/zinc/31/78/58/916317858.db2.gz FNGMMQIQBXMSSY-SFHVURJKSA-N 0 3 406.530 4.367 20 0 HIADHN CCCN(CC(=O)c1c[nH]c2ccccc12)C1CCN(C(=O)c2ccccc2)CC1 ZINC000507598557 916352890 /nfs/dbraw/zinc/35/28/90/916352890.db2.gz KJEXMDHRUKZGPN-UHFFFAOYSA-N 0 3 403.526 4.367 20 0 HIADHN Cc1ccc(-n2nc(C(=O)N[C@@H]3CCN([C@@H](C)c4ccccc4)C3)c3c2CCC3)cc1 ZINC000507604613 916360983 /nfs/dbraw/zinc/36/09/83/916360983.db2.gz LWJOBGYJCJXDOC-PZJWPPBQSA-N 0 3 414.553 4.235 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)c2nn(-c3ccc(F)cc3)c3c2CCC3)C1 ZINC000507606395 916362087 /nfs/dbraw/zinc/36/20/87/916362087.db2.gz POMNNYZXUPNLCW-FXAWDEMLSA-N 0 3 418.516 4.065 20 0 HIADHN Cc1ccc([C@@H](NCC[C@@H]2CCCCO2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000507610437 916368837 /nfs/dbraw/zinc/36/88/37/916368837.db2.gz JZVOWNSEAQUYFZ-REWPJTCUSA-N 0 3 401.572 4.345 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](NCC[C@@H]2CCCCO2)c2ccc(Cl)cc2)c1 ZINC000507610803 916368901 /nfs/dbraw/zinc/36/89/01/916368901.db2.gz LRDBOHCBXDQBMS-FPOVZHCZSA-N 0 3 407.963 4.382 20 0 HIADHN CN(CCNC(=O)Nc1ncc(Cc2ccc(F)c(F)c2)s1)Cc1ccccc1 ZINC000507653938 916416388 /nfs/dbraw/zinc/41/63/88/916416388.db2.gz PAXOSZGMEUBBTD-UHFFFAOYSA-N 0 3 416.497 4.266 20 0 HIADHN Cc1noc([C@@H]2CCCN(C[C@H](O)CO[C@@H](c3ccccc3)c3ccccc3C)C2)n1 ZINC000507688169 916459967 /nfs/dbraw/zinc/45/99/67/916459967.db2.gz OXZUTCLQTXWTNJ-GPXNEJASSA-N 0 3 421.541 4.033 20 0 HIADHN CC[C@@H]1C[C@H](CN2CCN(Cc3csc(-c4ccc(F)cc4)n3)CC2)CCO1 ZINC000507802836 916588032 /nfs/dbraw/zinc/58/80/32/916588032.db2.gz IMBMEEKXOQOCMU-DYESRHJHSA-N 0 3 403.567 4.272 20 0 HIADHN CCNC(=O)COc1ccc(CN[C@@H]2CCc3c2cc(Cl)cc3Cl)cc1OC ZINC000507839802 916647393 /nfs/dbraw/zinc/64/73/93/916647393.db2.gz CTWXOWLYQOBHFU-GOSISDBHSA-N 0 3 423.340 4.294 20 0 HIADHN CN1C(=O)C[C@H](NCc2ccc(OCc3ccncc3)cc2)[C@H]1c1ccc(Cl)cc1 ZINC000507851026 916671839 /nfs/dbraw/zinc/67/18/39/916671839.db2.gz MPTNWHCJBAAOSH-LADGPHEKSA-N 0 3 421.928 4.376 20 0 HIADHN CCOc1cc(CN2CCC[C@H](C(=O)Nc3ccc(C)cn3)C2)ccc1OC(F)F ZINC000507994250 916835086 /nfs/dbraw/zinc/83/50/86/916835086.db2.gz DKBQYXJQRPSPLR-KRWDZBQOSA-N 0 3 419.472 4.241 20 0 HIADHN Cc1ccc(NC(=O)[C@@H]2CCCN(Cc3ccccc3OCc3ccccn3)C2)nc1 ZINC000507995832 916837057 /nfs/dbraw/zinc/83/70/57/916837057.db2.gz ZQNXXNVSANDTSJ-OAQYLSRUSA-N 0 3 416.525 4.215 20 0 HIADHN Cc1cccc(NC(=O)[C@H]2CCCN(Cc3ccccc3OCc3ccccn3)C2)n1 ZINC000507998842 916839574 /nfs/dbraw/zinc/83/95/74/916839574.db2.gz NIAUOMVOYZOXQT-NRFANRHFSA-N 0 3 416.525 4.215 20 0 HIADHN Cc1cccc(NC(=O)[C@H]2CCCN(Cc3c[nH]nc3-c3ccc(Cl)cc3)C2)n1 ZINC000508001307 916842998 /nfs/dbraw/zinc/84/29/98/916842998.db2.gz WFQQBWMBTCPLGF-KRWDZBQOSA-N 0 3 409.921 4.284 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(C)c1CN1CCC[C@H](C(=O)Nc2ccc(C)cn2)C1 ZINC000508011224 916849201 /nfs/dbraw/zinc/84/92/01/916849201.db2.gz BOYJHRLGCNYCRT-IBGZPJMESA-N 0 3 421.520 4.182 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CN1CCC[C@H](C(=O)Nc2ccc(C)cn2)C1 ZINC000508012050 916850302 /nfs/dbraw/zinc/85/03/02/916850302.db2.gz CGSIJLZIKKKYDY-FQEVSTJZSA-N 0 3 403.530 4.043 20 0 HIADHN Cc1ccc(NC(=O)[C@@H]2CCCN(Cc3ccc(OCC(F)(F)F)cc3)C2)nc1 ZINC000508014739 916851758 /nfs/dbraw/zinc/85/17/58/916851758.db2.gz KXARAXPTANQTGA-QGZVFWFLSA-N 0 3 407.436 4.182 20 0 HIADHN CC[C@@H](CNC(=O)N[C@H](c1nccs1)c1ccccc1)N1CCc2ccccc2C1 ZINC000508189853 917012656 /nfs/dbraw/zinc/01/26/56/917012656.db2.gz HTKYLQTZYBCEGO-VXKWHMMOSA-N 0 3 420.582 4.369 20 0 HIADHN COc1ccccc1NC(=O)C[C@@H](C)NCc1cc(Cl)c2c(c1)OCCCO2 ZINC000508326384 917129710 /nfs/dbraw/zinc/12/97/10/917129710.db2.gz OCDYPEHBEGIGJY-CQSZACIVSA-N 0 3 404.894 4.017 20 0 HIADHN CN(C)CCN(C[C@H]1CCCO1)C(=O)c1cccc(OCc2ccc(Cl)cc2)c1 ZINC000508620441 917388092 /nfs/dbraw/zinc/38/80/92/917388092.db2.gz PTXJAQIXNNBCDV-JOCHJYFZSA-N 0 3 416.949 4.102 20 0 HIADHN Cc1ccc(-c2nn(-c3ccc(F)cc3)cc2CN(C)CCc2cnccn2)cc1 ZINC000508678016 917441758 /nfs/dbraw/zinc/44/17/58/917441758.db2.gz NHEUHUJUGQPCHG-UHFFFAOYSA-N 0 3 401.489 4.451 20 0 HIADHN CC[C@H](C)NC(=O)[C@@H]1C[C@H](C)N(Cc2nc(-c3ccco3)no2)[C@@H]2CCCC[C@H]12 ZINC000508679814 917443593 /nfs/dbraw/zinc/44/35/93/917443593.db2.gz SXRCENPCBKBVJZ-QXDIGNSFSA-N 0 3 400.523 4.014 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2cccc(C(=O)Nc3ccccc3)c2)N(C)C)cc1 ZINC000508703830 917464516 /nfs/dbraw/zinc/46/45/16/917464516.db2.gz NIOJOWUFWCPTGZ-QHCPKHFHSA-N 0 3 401.510 4.280 20 0 HIADHN COc1ccc(C)cc1CCNC(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000508772089 917526393 /nfs/dbraw/zinc/52/63/93/917526393.db2.gz VCAKOKPYTFGIGH-QFIPXVFZSA-N 0 3 420.475 4.117 20 0 HIADHN C[C@@H](NC(=O)N(C)CCCc1cc(-c2ccccc2)n[nH]1)[C@@H](c1ccccc1)N(C)C ZINC000508851810 917604399 /nfs/dbraw/zinc/60/43/99/917604399.db2.gz IBAWHCBLYBIEPH-DVECYGJZSA-N 0 3 419.573 4.342 20 0 HIADHN CCc1nc2c(s1)[C@H](N(C)C(=O)N[C@H](C)[C@@H](c1ccccc1)N(C)C)CCC2 ZINC000508852171 917606131 /nfs/dbraw/zinc/60/61/31/917606131.db2.gz JEPNRFZCMIPRHN-ZTNFWEORSA-N 0 3 400.592 4.416 20 0 HIADHN C[C@H](NC(=O)N1CCC(Oc2ccc(F)cc2F)CC1)[C@H](c1ccccc1)N(C)C ZINC000508860114 917613546 /nfs/dbraw/zinc/61/35/46/917613546.db2.gz ZXEYEBXUEMWWKF-KSFYIVLOSA-N 0 3 417.500 4.209 20 0 HIADHN Cc1cccc(NC(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)c1C(=O)N1CCCC1 ZINC000508889924 917644227 /nfs/dbraw/zinc/64/42/27/917644227.db2.gz DXBANKRTIPTNEP-AVRDEDQJSA-N 0 3 408.546 4.044 20 0 HIADHN O=C(Nc1ccc(-n2cccn2)cc1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000508916397 917674010 /nfs/dbraw/zinc/67/40/10/917674010.db2.gz ATHVJRCJZLPHCB-OAQYLSRUSA-N 0 3 414.431 4.265 20 0 HIADHN COc1ccc(NC(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)cc1N1CCCCC1=O ZINC000508925656 917684735 /nfs/dbraw/zinc/68/47/35/917684735.db2.gz SWBCOUVRDUOBEO-GAJHUEQPSA-N 0 3 424.545 4.025 20 0 HIADHN O=C(Nc1cccc(-n2ccnc2)c1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000508945797 917703470 /nfs/dbraw/zinc/70/34/70/917703470.db2.gz FCKPEXLHKGXSMT-NRFANRHFSA-N 0 3 414.431 4.265 20 0 HIADHN O=C(Nc1ccc2nccnc2c1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000508976787 917730004 /nfs/dbraw/zinc/73/00/04/917730004.db2.gz JDLBRQCZAOWYGV-FQEVSTJZSA-N 0 3 400.404 4.023 20 0 HIADHN Cc1ccc(S(=O)(=O)N[C@H](CCN(C)[C@H](C)c2ccccn2)c2ccccc2)cc1 ZINC000509020180 917775113 /nfs/dbraw/zinc/77/51/13/917775113.db2.gz CJJYWDLUMVMBCE-HYBUGGRVSA-N 0 3 423.582 4.493 20 0 HIADHN CCCN(C)[C@H](CNC(=O)N1CCCC[C@H]1c1ccnn1C)c1ccc(Cl)cc1 ZINC000509025003 917778700 /nfs/dbraw/zinc/77/87/00/917778700.db2.gz SOOUAPNCMOKCDJ-LEWJYISDSA-N 0 3 417.985 4.393 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)c1cccc(Br)c1Cl ZINC000509035329 917790664 /nfs/dbraw/zinc/79/06/64/917790664.db2.gz XBUXTHVJSUTNMA-UHFFFAOYSA-N 0 3 423.738 4.312 20 0 HIADHN CCCN(C)[C@H](CNC(=O)N1CCCC[C@@H]1c1nc(C)no1)c1ccc(Cl)cc1 ZINC000509041361 917795848 /nfs/dbraw/zinc/79/58/48/917795848.db2.gz VRTBUNQKDADHCY-RTBURBONSA-N 0 3 419.957 4.351 20 0 HIADHN O=C(CN1CCN(CC(c2ccccc2)c2ccccc2)CC1)Nc1ccccc1F ZINC000509098471 917838758 /nfs/dbraw/zinc/83/87/58/917838758.db2.gz LQFOQMQYUQRIJK-UHFFFAOYSA-N 0 3 417.528 4.214 20 0 HIADHN CN(C)CCN(C(=O)C1CCC(NC(=O)CC2CCCCC2)CC1)c1ccccc1 ZINC000509135200 917863891 /nfs/dbraw/zinc/86/38/91/917863891.db2.gz DYPLCRLUHFRBNX-UHFFFAOYSA-N 0 3 413.606 4.227 20 0 HIADHN O=C(Cc1ccc(Cl)s1)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000509182362 917892865 /nfs/dbraw/zinc/89/28/65/917892865.db2.gz DRKRNLPOZQMRSM-INIZCTEOSA-N 0 3 400.935 4.226 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)NCc1ccncc1OCc1ccccc1 ZINC000509273784 917960065 /nfs/dbraw/zinc/96/00/65/917960065.db2.gz MRCYWLCBDOHCGA-UHFFFAOYSA-N 0 3 410.562 4.068 20 0 HIADHN Cc1cc(Br)cc(C)c1N1CCC[C@H](N(C)CCC2CCOCC2)C1=O ZINC000509333631 918003890 /nfs/dbraw/zinc/00/38/90/918003890.db2.gz ZWTGHFHMJQSZOY-IBGZPJMESA-N 0 3 423.395 4.310 20 0 HIADHN Cc1ccc(CN2CCC(C(=O)Nc3ccc(Br)cn3)CC2)cc1F ZINC000509345896 918011967 /nfs/dbraw/zinc/01/19/67/918011967.db2.gz SSZHKUCFZXLBTA-UHFFFAOYSA-N 0 3 406.299 4.142 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)N1CCO[C@H](c2ccccc2Cl)C1 ZINC000509348397 918012655 /nfs/dbraw/zinc/01/26/55/918012655.db2.gz OPEVVDGRIYKVLE-VXKWHMMOSA-N 0 3 413.949 4.260 20 0 HIADHN Cn1cnnc1C1CCN(Cc2cn(Cc3ccccc3)nc2-c2cccs2)CC1 ZINC000509348823 918015220 /nfs/dbraw/zinc/01/52/20/918015220.db2.gz URPWBUGZVFQLAM-UHFFFAOYSA-N 0 3 418.570 4.168 20 0 HIADHN O=C(NCc1cnc2ccccc2c1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000509353464 918017555 /nfs/dbraw/zinc/01/75/55/918017555.db2.gz KDINKHKONHZQQA-QFIPXVFZSA-N 0 3 413.443 4.306 20 0 HIADHN Cc1noc([C@H]2CCCN(Cc3cn(-c4ccc(Br)cc4)nc3C)C2)n1 ZINC000509354809 918019350 /nfs/dbraw/zinc/01/93/50/918019350.db2.gz CEODYYLRDNWIGL-HNNXBMFYSA-N 0 3 416.323 4.014 20 0 HIADHN COc1ccccc1SC[C@@H](C)CNC(=O)NC[C@@H](c1ccccc1)N(C)C ZINC000509360371 918027194 /nfs/dbraw/zinc/02/71/94/918027194.db2.gz VZWCHUVDPSNGTI-HKUYNNGSSA-N 0 3 401.576 4.026 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N1CCO[C@H](c2ccccc2Cl)C1 ZINC000509365738 918030818 /nfs/dbraw/zinc/03/08/18/918030818.db2.gz LIDFKHBDZYVMSW-MOPGFXCFSA-N 0 3 419.978 4.322 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)N1CCO[C@@H](c2ccccc2Cl)C1 ZINC000509367884 918031342 /nfs/dbraw/zinc/03/13/42/918031342.db2.gz XGQVKYXAGVLKLS-FCHUYYIVSA-N 0 3 413.949 4.260 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)N1CCO[C@@H](c2ccccc2Cl)C1 ZINC000509367885 918032200 /nfs/dbraw/zinc/03/22/00/918032200.db2.gz XGQVKYXAGVLKLS-FGZHOGPDSA-N 0 3 413.949 4.260 20 0 HIADHN C[C@@H](c1ccccc1)N1CCC(NS(=O)(=O)CCc2cccc(Cl)c2)CC1 ZINC000509433017 918090832 /nfs/dbraw/zinc/09/08/32/918090832.db2.gz BWWRTIBKMGAPMT-KRWDZBQOSA-N 0 3 406.979 4.028 20 0 HIADHN Cc1ccc(-c2n[nH]cc2CN2CCC(C(=O)Nc3cc(Cl)ccc3O)CC2)o1 ZINC000509528696 918175633 /nfs/dbraw/zinc/17/56/33/918175633.db2.gz TVSWEYVIHJEISM-UHFFFAOYSA-N 0 3 414.893 4.188 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N1CCC[C@H]1Cn1c(C)nc2ccccc21)c1ccco1 ZINC000509556891 918206808 /nfs/dbraw/zinc/20/68/08/918206808.db2.gz NYOCWNBEHHKVQX-CUWPLCDZSA-N 0 3 423.561 4.241 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N1CCCc2c([nH]c3c2cccc3F)C1)c1ccco1 ZINC000509567287 918217456 /nfs/dbraw/zinc/21/74/56/918217456.db2.gz IOGBNQZCHOTVKA-HNAYVOBHSA-N 0 3 412.509 4.487 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N1CCC(Nc2ccc(F)cc2)CC1)c1ccco1 ZINC000509570201 918219240 /nfs/dbraw/zinc/21/92/40/918219240.db2.gz OSWOVWRDXAZEMD-JXFKEZNVSA-N 0 3 402.514 4.134 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N(C)Cc1nc(C(F)(F)F)cs1)c1ccco1 ZINC000509569127 918220378 /nfs/dbraw/zinc/22/03/78/918220378.db2.gz NBHPLSLOHYJXKR-NWDGAFQWSA-N 0 3 404.458 4.026 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N[C@@H](CO)c1c(Cl)cccc1Cl)c1ccco1 ZINC000509594334 918242862 /nfs/dbraw/zinc/24/28/62/918242862.db2.gz ZZYOPXALCFRSCQ-RCBQFDQVSA-N 0 3 414.333 4.048 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)N1CCC(c2nc3ccccc3[nH]2)CC1)c1ccco1 ZINC000509597836 918247827 /nfs/dbraw/zinc/24/78/27/918247827.db2.gz ATYCMAGAZAUVKJ-UZLBHIALSA-N 0 3 409.534 4.174 20 0 HIADHN CCCCCOc1ccc(C(=O)CCC(=O)N2CCCC23CCN(C)CC3)cc1 ZINC000509627085 918273058 /nfs/dbraw/zinc/27/30/58/918273058.db2.gz WPPMHHDJCNUYDA-UHFFFAOYSA-N 0 3 400.563 4.305 20 0 HIADHN Cc1nc2sccn2c(=O)c1CCN(Cc1c(F)cccc1F)C1CCCC1 ZINC000509686835 918316091 /nfs/dbraw/zinc/31/60/91/918316091.db2.gz SSFVVTIWQWRUIT-UHFFFAOYSA-N 0 3 403.498 4.330 20 0 HIADHN CCCN(Cc1nnc(-c2ccccc2Cl)o1)C(=O)[C@@H](C)N1CCCCCC1 ZINC000509690065 918321531 /nfs/dbraw/zinc/32/15/31/918321531.db2.gz BVWQJPZDVYPJTQ-MRXNPFEDSA-N 0 3 404.942 4.393 20 0 HIADHN O=C(Nc1ccc(F)cc1)NC1CCN(Cc2ccc(OCC(F)F)cc2)CC1 ZINC000509698952 918328823 /nfs/dbraw/zinc/32/88/23/918328823.db2.gz PCDUGUDVXKZCGM-UHFFFAOYSA-N 0 3 407.436 4.256 20 0 HIADHN CN(C[C@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)c1csc2ccccc21 ZINC000509922893 918523083 /nfs/dbraw/zinc/52/30/83/918523083.db2.gz FOYBOXDFJUXIRG-GOSISDBHSA-N 0 3 400.569 4.044 20 0 HIADHN Cn1cc2c(n1)CCC[C@H]2NCc1ccc(OC(F)(F)[C@@H](F)C(F)(F)F)cc1 ZINC000509956793 918549853 /nfs/dbraw/zinc/54/98/53/918549853.db2.gz IUYJEIBWEQOAKB-ZBFHGGJFSA-N 0 3 407.358 4.459 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)cc1CN[C@H]1CCN(C(=O)Nc2ccccc2)C1 ZINC000509977424 918566194 /nfs/dbraw/zinc/56/61/94/918566194.db2.gz NWXCDNBKYDTQOK-FQEVSTJZSA-N 0 3 409.921 4.230 20 0 HIADHN Cc1ccc([C@@H](CNCc2ccc(Sc3ccccn3)o2)N2CCOCC2)cc1 ZINC000510031488 918604513 /nfs/dbraw/zinc/60/45/13/918604513.db2.gz VOWASNMJRUUZLP-OAQYLSRUSA-N 0 3 409.555 4.297 20 0 HIADHN COc1ccc(NC(C)=O)cc1NC(=O)[C@@H](C)N1CCC[C@](C)(c2ccccc2)CC1 ZINC000510138718 918696011 /nfs/dbraw/zinc/69/60/11/918696011.db2.gz DHCPSJZGFFGVMJ-CJAUYULYSA-N 0 3 423.557 4.424 20 0 HIADHN COc1ccc([C@H](CNC(=O)Cc2ccc(Br)s2)N2CCCC2)cc1 ZINC000510184828 918734107 /nfs/dbraw/zinc/73/41/07/918734107.db2.gz JTLUJFCQDDPMAM-KRWDZBQOSA-N 0 3 423.376 4.015 20 0 HIADHN COc1ccc(CNC(=O)c2oc3ccccc3c2CN(C)C)cc1OC(F)F ZINC000510299645 918815982 /nfs/dbraw/zinc/81/59/82/918815982.db2.gz RCCSHJASLUKRAK-UHFFFAOYSA-N 0 3 404.413 4.034 20 0 HIADHN COc1ccc(F)cc1NC(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1 ZINC000510300829 918816367 /nfs/dbraw/zinc/81/63/67/918816367.db2.gz WICKABPKZTVVEE-UHFFFAOYSA-N 0 3 413.415 4.449 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N(C)CCc3cccc4ccccc43)cc2)CC1 ZINC000510411199 918881240 /nfs/dbraw/zinc/88/12/40/918881240.db2.gz BLNPLWZRSWVINT-UHFFFAOYSA-N 0 3 401.554 4.296 20 0 HIADHN CC(=O)Nc1nc2ccc(NC(=O)c3oc4ccccc4c3CN(C)C)cc2s1 ZINC000510470804 918926005 /nfs/dbraw/zinc/92/60/05/918926005.db2.gz JMHUJIKQCKBOPB-UHFFFAOYSA-N 0 3 408.483 4.315 20 0 HIADHN C[C@H](NC(=O)NC[C@H]1CC2c3ccccc3C1c1ccccc12)C1=CCN(C)CC1 ZINC000510485052 918936663 /nfs/dbraw/zinc/93/66/63/918936663.db2.gz YLQCNIONUXYFKC-MJDSCDBUSA-N 0 3 401.554 4.233 20 0 HIADHN COc1ccc([C@@H](Cc2ccc(F)cc2)NC(=O)N[C@H](C)C2=CCN(C)CC2)cc1 ZINC000510526004 918971152 /nfs/dbraw/zinc/97/11/52/918971152.db2.gz OJWCQSUMVRTKRC-UZUQRXQVSA-N 0 3 411.521 4.068 20 0 HIADHN CC(C)CCOC1CCN(Cc2cn(C)nc2-c2ccc3c(c2)OCCCO3)CC1 ZINC000510531649 918977208 /nfs/dbraw/zinc/97/72/08/918977208.db2.gz BKXZTGOJEOJCBB-UHFFFAOYSA-N 0 3 413.562 4.276 20 0 HIADHN COc1cc(CN2CCC[C@H](c3ncc[nH]3)C2)cc(OC)c1OCc1ccccc1 ZINC000510540879 918985429 /nfs/dbraw/zinc/98/54/29/918985429.db2.gz XCFFLIHCDUHPSQ-FQEVSTJZSA-N 0 3 407.514 4.386 20 0 HIADHN Cc1n[nH]c(C)c1[C@@H]1CCCCCN1C(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000510546738 918991434 /nfs/dbraw/zinc/99/14/34/918991434.db2.gz NOKQPAAWECJZDQ-NNWRFLSQSA-N 0 3 409.578 4.489 20 0 HIADHN CCc1ccc(Cl)c(CC)c1NC(=O)CCCN1CCO[C@]2(CCCOC2)C1 ZINC000510579217 919021705 /nfs/dbraw/zinc/02/17/05/919021705.db2.gz NDHURQHIOKUIGD-JOCHJYFZSA-N 0 3 408.970 4.065 20 0 HIADHN C[C@@H](NC(=O)NCc1ccc(-c2ccc3c(c2)C[C@@H](C)O3)cc1)C1=CCN(C)CC1 ZINC000510605167 919045980 /nfs/dbraw/zinc/04/59/80/919045980.db2.gz ATMAGUBSOREMFR-QZTJIDSGSA-N 0 3 405.542 4.127 20 0 HIADHN CN(C)Cc1cccc(NC(=O)N2CCC[C@H](c3nc(-c4cccc(F)c4)no3)C2)c1 ZINC000510653391 919094533 /nfs/dbraw/zinc/09/45/33/919094533.db2.gz RWDHNCHNZBJUOF-SFHVURJKSA-N 0 3 423.492 4.349 20 0 HIADHN CCc1ccc([C@H](CNC(=O)Nc2ccc(C(=O)NCC(C)C)cc2)N(C)C)cc1 ZINC000510665902 919107616 /nfs/dbraw/zinc/10/76/16/919107616.db2.gz OCSATBZPEDDPJI-QFIPXVFZSA-N 0 3 410.562 4.059 20 0 HIADHN Fc1ccc(N2CCOCC2)c(CN[C@@H]2CCc3ccc(Br)cc32)c1 ZINC000510683304 919121110 /nfs/dbraw/zinc/12/11/10/919121110.db2.gz NMEIZZUFJFYIIS-LJQANCHMSA-N 0 3 405.311 4.202 20 0 HIADHN Brc1ccc2c(c1)[C@H](N[C@@H](CN1CCOCC1)c1ccccc1)CC2 ZINC000510689136 919127241 /nfs/dbraw/zinc/12/72/41/919127241.db2.gz UVPMQJMQHGYFPR-RTWAWAEBSA-N 0 3 401.348 4.100 20 0 HIADHN CC[C@@H](CS(=O)(=O)c1ccccc1)N[C@H]1CCc2ccc(Br)cc21 ZINC000510693946 919131080 /nfs/dbraw/zinc/13/10/80/919131080.db2.gz DZKOCHKGPGWDOG-LPHOPBHVSA-N 0 3 408.361 4.279 20 0 HIADHN Cc1ccc(OCc2cccc(C(=O)NC[C@H](C)N(C)Cc3ccccc3)c2)cn1 ZINC000510711380 919151671 /nfs/dbraw/zinc/15/16/71/919151671.db2.gz AAOZSKIEFXNUEO-FQEVSTJZSA-N 0 3 403.526 4.219 20 0 HIADHN C[C@H](NC(=O)c1cc(Oc2cccc(Br)c2)ccn1)C1=CCN(C)CC1 ZINC000510736035 919182001 /nfs/dbraw/zinc/18/20/01/919182001.db2.gz SWGAUSYWKGGHIL-AWEZNQCLSA-N 0 3 416.319 4.017 20 0 HIADHN CN(C)[C@H](CNC(=O)c1cccc(CN(C)Cc2ccccc2)c1)c1ccsc1 ZINC000510736338 919182068 /nfs/dbraw/zinc/18/20/68/919182068.db2.gz PRVQWAXEZBECCV-HSZRJFAPSA-N 0 3 407.583 4.413 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)NCc1cccc(COC2CCOCC2)c1 ZINC000510758166 919208592 /nfs/dbraw/zinc/20/85/92/919208592.db2.gz HTUWGOIPPMOARR-UHFFFAOYSA-N 0 3 422.525 4.120 20 0 HIADHN CCOC1CC(CN2CCC[C@H]2c2nc(-c3ccccc3Br)no2)C1 ZINC000510768880 919224106 /nfs/dbraw/zinc/22/41/06/919224106.db2.gz ZZUSAOVLMKDZHU-KVULBXGLSA-N 0 3 406.324 4.451 20 0 HIADHN C[C@@H](NC(=O)c1csc(-c2cc(Br)cs2)n1)C1=CCN(C)CC1 ZINC000510773658 919233066 /nfs/dbraw/zinc/23/30/66/919233066.db2.gz UXWMQYYRTIIGNH-SNVBAGLBSA-N 0 3 412.378 4.014 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@@H](C)N[C@@H]2CCc3cc(F)c(OC)cc32)cc1 ZINC000510962057 919501592 /nfs/dbraw/zinc/50/15/92/919501592.db2.gz YWJNSCDZQIQAJA-QVKFZJNVSA-N 0 3 420.550 4.203 20 0 HIADHN COC[C@@H](N[C@@H]1CCN(C(=O)Nc2ccccc2)C1)c1cccc(C(F)(F)F)c1 ZINC000510970413 919516406 /nfs/dbraw/zinc/51/64/06/919516406.db2.gz VAFIJMLDOHJVGS-RTBURBONSA-N 0 3 407.436 4.289 20 0 HIADHN FC(F)Oc1ccc([C@@H](NCCc2nnnn2-c2ccccc2)c2ccccc2)cc1 ZINC000510980538 919531926 /nfs/dbraw/zinc/53/19/26/919531926.db2.gz BJMBVOQUNXGJDF-QFIPXVFZSA-N 0 3 421.451 4.185 20 0 HIADHN Fc1ccc([C@H](NCCc2nnnn2-c2ccccc2)c2cnc3ccccc3c2)cc1 ZINC000510993847 919549699 /nfs/dbraw/zinc/54/96/99/919549699.db2.gz OSTNIUAADSLFLA-VWLOTQADSA-N 0 3 424.483 4.271 20 0 HIADHN COc1cccc(NC(=O)[C@@H](N[C@H](Cc2ccccc2)CN(C)C)c2ccccc2)c1 ZINC000511012079 919579728 /nfs/dbraw/zinc/57/97/28/919579728.db2.gz RQZYBLZWEWKEEJ-NOZRDPDXSA-N 0 3 417.553 4.138 20 0 HIADHN CC[C@H](C)c1ccc([C@H](NC(=O)CCN2CCN(CC)CC2)c2cccs2)cc1 ZINC000511107857 919714401 /nfs/dbraw/zinc/71/44/01/919714401.db2.gz SROHKPWMRBKBNA-CYFREDJKSA-N 0 3 413.631 4.495 20 0 HIADHN Cc1nc2sccn2c(=O)c1CCN(Cc1ccc(F)cc1Cl)CC1CC1 ZINC000511108303 919717416 /nfs/dbraw/zinc/71/74/16/919717416.db2.gz MVQHPFOIYFWPDK-UHFFFAOYSA-N 0 3 405.926 4.312 20 0 HIADHN O=C(Nc1ccc2c(c1)CCCC(=O)N2)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000511157792 919778237 /nfs/dbraw/zinc/77/82/37/919778237.db2.gz CVQNXWPHZCXUJO-LJQANCHMSA-N 0 3 413.468 4.057 20 0 HIADHN NC(=O)c1ccc(NC(=O)CCN2CC=C(c3ccc(Cl)c(Cl)c3)CC2)cc1 ZINC000511213326 919824237 /nfs/dbraw/zinc/82/42/37/919824237.db2.gz AIWOAIRPWLTECT-UHFFFAOYSA-N 0 3 418.324 4.210 20 0 HIADHN C[C@H](NC(=O)NCc1ccc(OC(C)(C)C)cc1C(F)(F)F)C1=CCN(C)CC1 ZINC000511230924 919834771 /nfs/dbraw/zinc/83/47/71/919834771.db2.gz HGEFYZOEBBDBFJ-AWEZNQCLSA-N 0 3 413.484 4.332 20 0 HIADHN CC(C)Cc1ccc(C(=O)C2CCN(C(=O)N[C@H](C)C3=CCN(C)CC3)CC2)cc1 ZINC000511232362 919836291 /nfs/dbraw/zinc/83/62/91/919836291.db2.gz VXGJTHNJXXJLSW-LJQANCHMSA-N 0 3 411.590 4.140 20 0 HIADHN C[C@@H]1CCCCN1C(=O)c1ccc(NC(=O)NC[C@@H](c2ccccc2)N(C)C)cc1 ZINC000511297248 919893248 /nfs/dbraw/zinc/89/32/48/919893248.db2.gz NMRNAIDTPGSWSS-GCJKJVERSA-N 0 3 408.546 4.126 20 0 HIADHN CC(C)n1ncc2c1nc(-c1ccccc1)cc2C(=O)N[C@@H](C)C1=CCN(C)CC1 ZINC000511346924 919939829 /nfs/dbraw/zinc/93/98/29/919939829.db2.gz VBPUPNOHQBVSJA-KRWDZBQOSA-N 0 3 403.530 4.059 20 0 HIADHN CC[C@H](C)n1ncc2c1nc(C)cc2C(=O)N[C@H](CN1CCCC1)c1ccccc1 ZINC000511354674 919949184 /nfs/dbraw/zinc/94/91/84/919949184.db2.gz FRSRCPUGHBUGKA-PGRDOPGGSA-N 0 3 405.546 4.278 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N[C@@H](C[C@@H]2CCOC2)c2ccccc2)N(C)C)cc1 ZINC000511382555 919986076 /nfs/dbraw/zinc/98/60/76/919986076.db2.gz LASQGGBWEFGUOB-OYDLWJJNSA-N 0 3 409.574 4.319 20 0 HIADHN CC[C@@H](CC1CCCCC1)C(=O)NCc1ccc(C(=O)NCCN2CCCC2)cc1 ZINC000511422472 920036987 /nfs/dbraw/zinc/03/69/87/920036987.db2.gz JFRZOLJWEKLQST-QFIPXVFZSA-N 0 3 413.606 4.125 20 0 HIADHN COc1ccc(CN(C)CCCc2cc(-c3cccc(F)c3)n[nH]2)c(OC)c1OC ZINC000511494688 920104327 /nfs/dbraw/zinc/10/43/27/920104327.db2.gz LVPSNLBCZRULPQ-UHFFFAOYSA-N 0 3 413.493 4.306 20 0 HIADHN CC(=O)Nc1cccc(NC(=O)CN[C@@H](c2cccc(OC(F)(F)F)c2)C2CC2)c1 ZINC000511561359 920202079 /nfs/dbraw/zinc/20/20/79/920202079.db2.gz IGSKATYUNSYUAP-HXUWFJFHSA-N 0 3 421.419 4.223 20 0 HIADHN COc1ccc(NC(=O)CN[C@H](c2cccc(OC(F)(F)F)c2)C2CC2)cc1OC ZINC000511586148 920231101 /nfs/dbraw/zinc/23/11/01/920231101.db2.gz FPOBTBMDVGZFRT-FQEVSTJZSA-N 0 3 424.419 4.282 20 0 HIADHN COc1ccc(NC(=O)CN[C@@H](c2cccc(OC(F)(F)F)c2)C2CC2)cc1OC ZINC000511586149 920232125 /nfs/dbraw/zinc/23/21/25/920232125.db2.gz FPOBTBMDVGZFRT-HXUWFJFHSA-N 0 3 424.419 4.282 20 0 HIADHN CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@@H]3CN2Cc1csc(-c2cccc(Br)c2)n1 ZINC000511668810 920334761 /nfs/dbraw/zinc/33/47/61/920334761.db2.gz VXUSHWUMFWFVDB-KISNFGTJSA-N 0 3 405.361 4.428 20 0 HIADHN COc1cc(CN(C)C[C@@H]2OCCc3ccccc32)ccc1OCc1ccncc1 ZINC000511669949 920337215 /nfs/dbraw/zinc/33/72/15/920337215.db2.gz ZGQBXRCCYNGHIF-VWLOTQADSA-N 0 3 404.510 4.415 20 0 HIADHN O=C(CSCc1cscn1)N[C@@H]1CN(Cc2ccccc2)C[C@H]1c1ccccc1 ZINC000511729926 920396999 /nfs/dbraw/zinc/39/69/99/920396999.db2.gz DPRBSIIJHBRHIP-FCHUYYIVSA-N 0 3 423.607 4.161 20 0 HIADHN Cc1cccc(COc2c(C)cc(CN3CCC(N4CCNC4=O)CC3)cc2C)c1 ZINC000511740307 920414461 /nfs/dbraw/zinc/41/44/61/920414461.db2.gz JFMLPEYHJFTKMM-UHFFFAOYSA-N 0 3 407.558 4.180 20 0 HIADHN O=C1NCCN1C1CCN(Cc2ccc(-c3cccc(Br)c3)s2)CC1 ZINC000511754252 920432454 /nfs/dbraw/zinc/43/24/54/920432454.db2.gz IGVLZPYZTIVPGP-UHFFFAOYSA-N 0 3 420.376 4.167 20 0 HIADHN Cn1c(CN2C[C@H](c3ccccc3)[C@H]3COCC[C@@H]32)nnc1-c1ccc(Cl)cc1 ZINC000511775768 920464237 /nfs/dbraw/zinc/46/42/37/920464237.db2.gz SQKHBXNXZWYXAQ-NJYVYQBISA-N 0 3 408.933 4.140 20 0 HIADHN C[C@@H](N[C@@H](C)CC(=O)Nc1cc(C(F)(F)F)ccc1Cl)C(=O)N1CCCCC1 ZINC000511780463 920471080 /nfs/dbraw/zinc/47/10/80/920471080.db2.gz HXVKMKPLLGIPSG-QWHCGFSZSA-N 0 3 419.875 4.067 20 0 HIADHN CN(C)Cc1cccc(C(=O)N[C@H](c2ccc(OC(F)F)cc2)C(F)(F)F)c1 ZINC000511795787 920489628 /nfs/dbraw/zinc/48/96/28/920489628.db2.gz QBIIKBRMLKUQIY-MRXNPFEDSA-N 0 3 402.363 4.383 20 0 HIADHN CN(C)Cc1cccc(C(=O)N[C@@H](c2ccc(OC(F)F)cc2)C(F)(F)F)c1 ZINC000511795785 920489681 /nfs/dbraw/zinc/48/96/81/920489681.db2.gz QBIIKBRMLKUQIY-INIZCTEOSA-N 0 3 402.363 4.383 20 0 HIADHN O=C(CN1C[C@H](c2ccccc2)[C@@H]2CCC[C@H]21)Nc1cccc(N2CCCC2=O)c1 ZINC000511839763 920552642 /nfs/dbraw/zinc/55/26/42/920552642.db2.gz WMWLNNODEJLXTK-YTFSRNRJSA-N 0 3 403.526 4.020 20 0 HIADHN CCN(C)[C@H](C(=O)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1 ZINC000511847267 920568513 /nfs/dbraw/zinc/56/85/13/920568513.db2.gz PYUYXLHABJHWDZ-RTWAWAEBSA-N 0 3 419.491 4.089 20 0 HIADHN O=C(Nc1ccc(OC(F)(F)F)cc1)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000511866591 920593100 /nfs/dbraw/zinc/59/31/00/920593100.db2.gz DAQFISNDYMJHBO-UHFFFAOYSA-N 0 3 408.420 4.042 20 0 HIADHN CC(C)[C@H](NC(=O)N[C@H](C)CCN1CCN(C)CC1)c1ccc(C(C)(C)C)cc1 ZINC000511899273 920636775 /nfs/dbraw/zinc/63/67/75/920636775.db2.gz RHDJRHDTINKTKO-KNQAVFIVSA-N 0 3 402.627 4.006 20 0 HIADHN CCN(C)C(=O)c1cccc(C(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)c1 ZINC000512027680 920802390 /nfs/dbraw/zinc/80/23/90/920802390.db2.gz XOIMPMYNFLOVON-HXUWFJFHSA-N 0 3 413.587 4.043 20 0 HIADHN COc1ccccc1N1CC[C@H](NCc2cnn(-c3ccc(C(F)(F)F)cc3)c2)C1 ZINC000512045233 920815015 /nfs/dbraw/zinc/81/50/15/920815015.db2.gz KXFDRDBSSAGMBW-SFHVURJKSA-N 0 3 416.447 4.268 20 0 HIADHN COc1ccc([C@H](C)CCNCc2ncc(I)s2)cc1 ZINC000512066325 920833857 /nfs/dbraw/zinc/83/38/57/920833857.db2.gz DZKFWQMNFPILBF-LLVKDONJSA-N 0 3 402.301 4.040 20 0 HIADHN CC(C)C[C@H](Cc1cccc(Br)c1)C(=O)N[C@H](C)C1=CCN(C)CC1 ZINC000512129102 920877624 /nfs/dbraw/zinc/87/76/24/920877624.db2.gz SYGUHOKKUVUSOC-VQIMIIECSA-N 0 3 407.396 4.421 20 0 HIADHN C[C@@H](NC(=O)c1ccc(Cl)c(NC(=O)c2cccs2)c1)C1=CCN(C)CC1 ZINC000512131661 920880553 /nfs/dbraw/zinc/88/05/53/920880553.db2.gz HIYRHXROYXOVGK-CYBMUJFWSA-N 0 3 403.935 4.034 20 0 HIADHN C[C@H](NC(=O)c1ccc(CSc2nc3ccccc3[nH]2)cc1)C1=CCN(C)CC1 ZINC000512142931 920887340 /nfs/dbraw/zinc/88/73/40/920887340.db2.gz OTQZWOLOKWFLQV-INIZCTEOSA-N 0 3 406.555 4.235 20 0 HIADHN Cc1ccc(-c2nn(Cc3ccccc3)cc2C(=O)N[C@H](C)C2=CCN(C)CC2)cc1 ZINC000512145494 920888581 /nfs/dbraw/zinc/88/85/81/920888581.db2.gz XNAMDOQRTCNIIM-HXUWFJFHSA-N 0 3 414.553 4.287 20 0 HIADHN OCC[C@H](NC[C@@H](O)COc1ccc(Cl)cc1)c1ccc(Cl)c(Cl)c1 ZINC000512153026 920893104 /nfs/dbraw/zinc/89/31/04/920893104.db2.gz QHXKUOWYXLDKOS-KDOFPFPSSA-N 0 3 404.721 4.100 20 0 HIADHN CN(CCOc1cccc(Br)c1)CCc1nc(-c2ccccc2)no1 ZINC000512164824 920902485 /nfs/dbraw/zinc/90/24/85/920902485.db2.gz FBZNAMDSFWNRJY-UHFFFAOYSA-N 0 3 402.292 4.052 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)N3CCC[C@@]4(CC=CCC4)C3)CC2)c1 ZINC000512191515 920935913 /nfs/dbraw/zinc/93/59/13/920935913.db2.gz MKNXGSJYJFQCQO-SANMLTNESA-N 0 3 424.633 4.429 20 0 HIADHN Cc1cc2ncn(C[C@H](O)CN[C@@H](CCO)c3ccc(Cl)c(Cl)c3)c2cc1C ZINC000512194270 920937801 /nfs/dbraw/zinc/93/78/01/920937801.db2.gz HLAYPIUZNVKERI-APWZRJJASA-N 0 3 422.356 4.034 20 0 HIADHN OCC[C@H](NC[C@H](O)COCc1ccc(Cl)cc1)c1ccc(Cl)c(Cl)c1 ZINC000512211209 920957331 /nfs/dbraw/zinc/95/73/31/920957331.db2.gz GTLZSBDZQCQTKJ-LPHOPBHVSA-N 0 3 418.748 4.238 20 0 HIADHN O=C1[C@@H](NCc2ccc(-n3ccc(C(F)(F)F)n3)cc2)CCCN1c1ccccc1 ZINC000512219758 920968708 /nfs/dbraw/zinc/96/87/08/920968708.db2.gz RUDPDXHMSSDKOU-IBGZPJMESA-N 0 3 414.431 4.176 20 0 HIADHN Cc1cccc2nc(CN3CCC[C@H](c4nc5ccccc5n4C(C)C)C3)cc(=O)n12 ZINC000512282534 921037053 /nfs/dbraw/zinc/03/70/53/921037053.db2.gz VTRNQKWSPLWUAE-IBGZPJMESA-N 0 3 415.541 4.313 20 0 HIADHN FC(F)(F)[C@]1(c2nc(-c3ccc4c(c3)CCO4)no2)CCN(Cc2ccccc2)C1 ZINC000512317493 921067958 /nfs/dbraw/zinc/06/79/58/921067958.db2.gz XPDSQWCMHRFANZ-OAQYLSRUSA-N 0 3 415.415 4.378 20 0 HIADHN CC(C)n1nccc1[C@H]1OCC[C@@H]1NCc1cnn(-c2ccc(C(F)(F)F)cc2)c1 ZINC000512354429 921100543 /nfs/dbraw/zinc/10/05/43/921100543.db2.gz CMZIXXAARJCRIV-ICSRJNTNSA-N 0 3 419.451 4.288 20 0 HIADHN COc1c(Br)cc(Br)cc1CN(C)C[C@H]1CCCOC1 ZINC000513454916 921820535 /nfs/dbraw/zinc/82/05/35/921820535.db2.gz IUNUGHFJAHBNTL-LLVKDONJSA-N 0 3 407.146 4.079 20 0 HIADHN CCN(Cc1ccc2ccccc2c1)C[C@H](O)COc1ccc(C(C)=O)cc1OC ZINC000513496852 921846625 /nfs/dbraw/zinc/84/66/25/921846625.db2.gz MEYNXZJUEPDINJ-QHCPKHFHSA-N 0 3 407.510 4.313 20 0 HIADHN CCN(Cc1ccc2ccccc2c1)C[C@@H](O)COc1ccc(C(C)=O)cc1OC ZINC000513496851 921846791 /nfs/dbraw/zinc/84/67/91/921846791.db2.gz MEYNXZJUEPDINJ-HSZRJFAPSA-N 0 3 407.510 4.313 20 0 HIADHN C[C@@H]1CN(Cc2ccc(CN[C@@H](Cc3ccccn3)c3cccnc3)cc2)C[C@H](C)O1 ZINC000513500352 921849927 /nfs/dbraw/zinc/84/99/27/921849927.db2.gz MCNMPNBCFVRFCV-UZINWLIJSA-N 0 3 416.569 4.159 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)N[C@H]2C[C@@H](Oc3ccccc3)C2(C)C)CC1 ZINC000513636355 921962072 /nfs/dbraw/zinc/96/20/72/921962072.db2.gz YYKGJRHJHOPPHJ-FCHUYYIVSA-N 0 3 411.546 4.132 20 0 HIADHN CCOc1cc(C[NH2+]C[C@@H](c2ccc(F)cc2)N(C)C)cc(Br)c1[O-] ZINC000513643861 921966796 /nfs/dbraw/zinc/96/67/96/921966796.db2.gz RTWOWSOGRVDDIN-KRWDZBQOSA-N 0 3 411.315 4.085 20 0 HIADHN CCOc1cc(C[NH2+]C[C@H](c2ccc(F)cc2)N(C)C)cc(Br)c1[O-] ZINC000513643862 921966955 /nfs/dbraw/zinc/96/69/55/921966955.db2.gz RTWOWSOGRVDDIN-QGZVFWFLSA-N 0 3 411.315 4.085 20 0 HIADHN CCc1csc(CC(=O)N[C@H](c2ccc(F)c(F)c2)C(C)(C)N2CCCC2)n1 ZINC000513647785 921969392 /nfs/dbraw/zinc/96/93/92/921969392.db2.gz KOMFKSIHSOKNQI-HXUWFJFHSA-N 0 3 407.530 4.258 20 0 HIADHN Cc1cc([C@@H]2CCCN2CCCOc2cccc(I)c2)on1 ZINC000513691279 922012765 /nfs/dbraw/zinc/01/27/65/922012765.db2.gz SXBSHKFXYKQDGD-INIZCTEOSA-N 0 3 412.271 4.194 20 0 HIADHN CN(Cc1ccc2c(c1)nnn2C)[C@@H]1CCSc2ccc(Br)cc21 ZINC000513725371 922044921 /nfs/dbraw/zinc/04/49/21/922044921.db2.gz OQBJAZWITGYVIH-MRXNPFEDSA-N 0 3 403.349 4.400 20 0 HIADHN CCOc1cc(CN(CC)Cc2ccc(C(=O)N(C)C)cc2)ccc1OC(F)F ZINC000513750365 922071062 /nfs/dbraw/zinc/07/10/62/922071062.db2.gz HAEWIRPGMSRLDA-UHFFFAOYSA-N 0 3 406.473 4.411 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cc(OC)c(OC)cc1Cl)c1cccc(OC)c1 ZINC000513757580 922076555 /nfs/dbraw/zinc/07/65/55/922076555.db2.gz OHFWYIMPAWQSIH-LJQANCHMSA-N 0 3 420.937 4.179 20 0 HIADHN Cn1cc(CN(CCCO)C(c2ccccc2)c2ccccc2)c(-c2cccnc2)n1 ZINC000513761725 922079877 /nfs/dbraw/zinc/07/98/77/922079877.db2.gz NWAVIMFJAGMKOQ-UHFFFAOYSA-N 0 3 412.537 4.456 20 0 HIADHN C[C@@H]1CCCN(S(=O)(=O)c2ccc(CN[C@H]3CCc4c3cccc4F)cc2)C1 ZINC000513858470 922186086 /nfs/dbraw/zinc/18/60/86/922186086.db2.gz ABURMMGIHYCLMI-ZHRRBRCNSA-N 0 3 402.535 4.023 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1ccc(C(N)=O)cc1)c1ccc(C(F)(F)F)cc1 ZINC000513882328 922211860 /nfs/dbraw/zinc/21/18/60/922211860.db2.gz GFEGWQQKCGPTCC-GOSISDBHSA-N 0 3 422.451 4.009 20 0 HIADHN CCCCCc1nnc(NC(=O)N2CCCN(CCCc3ccccc3)CC2)s1 ZINC000513950030 922268718 /nfs/dbraw/zinc/26/87/18/922268718.db2.gz KSJSDTBFQQWNMQ-UHFFFAOYSA-N 0 3 415.607 4.443 20 0 HIADHN COc1ccc2nc(NC(=O)N3CCCN(CCCc4ccccc4)CC3)sc2c1 ZINC000513961612 922280244 /nfs/dbraw/zinc/28/02/44/922280244.db2.gz HKIMECMPTVOXSL-UHFFFAOYSA-N 0 3 424.570 4.477 20 0 HIADHN C[C@H](c1ccccc1Cl)N1CCN(C[C@H]2CCN(C(=O)c3ccccc3)C2)CC1 ZINC000513965292 922283318 /nfs/dbraw/zinc/28/33/18/922283318.db2.gz WSNQEBIFJLCERZ-WOJBJXKFSA-N 0 3 411.977 4.181 20 0 HIADHN C[C@@H](c1ccccc1Cl)N1CCN(C[C@H]2CCN(C(=O)c3ccccc3)C2)CC1 ZINC000513965291 922283533 /nfs/dbraw/zinc/28/35/33/922283533.db2.gz WSNQEBIFJLCERZ-VQTJNVASSA-N 0 3 411.977 4.181 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)CCC(C)(C)c3ccccc3)CC2)C[C@@H](C)O1 ZINC000514012273 922336360 /nfs/dbraw/zinc/33/63/60/922336360.db2.gz ZYGXENKSIQKEDT-NHCUHLMSSA-N 0 3 400.607 4.482 20 0 HIADHN C[C@@H](Cc1ccccc1Cl)C(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000514012011 922337483 /nfs/dbraw/zinc/33/74/83/922337483.db2.gz WKGZGTGOIXYOIA-IPMKNSEASA-N 0 3 406.998 4.257 20 0 HIADHN CCCN(C(=O)NCc1ccc(NC(C)=O)cc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000514062746 922388049 /nfs/dbraw/zinc/38/80/49/922388049.db2.gz JRGRPHHCRDQYOD-XMMPIXPASA-N 0 3 422.573 4.231 20 0 HIADHN OCCCN(Cc1ccccc1N1CCOCC1)C(c1ccccc1)c1ccccc1 ZINC000514090034 922411860 /nfs/dbraw/zinc/41/18/60/922411860.db2.gz SWVDHFYZJLKEHX-UHFFFAOYSA-N 0 3 416.565 4.497 20 0 HIADHN COc1cc([C@@H](C)NC(=O)NC[C@H](c2ccc(C)cc2)N(C)C)ccc1OC(C)C ZINC000514102240 922430784 /nfs/dbraw/zinc/43/07/84/922430784.db2.gz MQEAWLUQUGPLFF-WIYYLYMNSA-N 0 3 413.562 4.454 20 0 HIADHN Cc1ccc2c(c1)[C@@H](NC(=O)N(C)C1CCN(CCc3ccccn3)CC1)CCC2 ZINC000514128297 922461719 /nfs/dbraw/zinc/46/17/19/922461719.db2.gz HENFZYIOGLZHMR-DEOSSOPVSA-N 0 3 406.574 4.116 20 0 HIADHN CCN1CCC[C@@H](CN(C)C(=O)N[C@H]2CCCc3ccc(C)cc32)[C@@H]1c1cnn(C)c1 ZINC000514129349 922463777 /nfs/dbraw/zinc/46/37/77/922463777.db2.gz VXOYPMXWSDBOEZ-NKKJXINNSA-N 0 3 423.605 4.221 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)NC(C)(C)c3ccccc3)CC2)c1 ZINC000514133825 922468971 /nfs/dbraw/zinc/46/89/71/922468971.db2.gz CXLMXDHJURNBQN-UHFFFAOYSA-N 0 3 408.590 4.132 20 0 HIADHN COc1cccc([C@@H](CNC(=O)NCc2ccccc2C(F)(F)F)N2CCCC2)c1 ZINC000514163542 922503158 /nfs/dbraw/zinc/50/31/58/922503158.db2.gz ZFOWLKHEBYVFGD-HXUWFJFHSA-N 0 3 421.463 4.350 20 0 HIADHN COc1cccc([C@@H](CNC(=O)N[C@@H]2CCCOc3ccccc32)N2CCCC2)c1 ZINC000514173094 922511800 /nfs/dbraw/zinc/51/18/00/922511800.db2.gz UHCDSHJHSPYOBP-FGZHOGPDSA-N 0 3 409.530 4.045 20 0 HIADHN Cc1ccccc1CN(Cc1cccnc1)C(=O)NC[C@H](Cc1ccccc1)N(C)C ZINC000514176550 922514926 /nfs/dbraw/zinc/51/49/26/922514926.db2.gz RIBKHSFTPCTUGJ-VWLOTQADSA-N 0 3 416.569 4.275 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)N1CC[C@@H](C(F)(F)F)C2(CCC2)C1 ZINC000514201726 922539480 /nfs/dbraw/zinc/53/94/80/922539480.db2.gz LLOIKJSXKRAUCP-HXUWFJFHSA-N 0 3 423.523 4.170 20 0 HIADHN O=C(c1ccn(Cc2ccccc2)c1)N1CCCN(CCCc2ccccc2)CC1 ZINC000514212672 922547268 /nfs/dbraw/zinc/54/72/68/922547268.db2.gz GRNWARMXONEIOE-UHFFFAOYSA-N 0 3 401.554 4.317 20 0 HIADHN CN(Cc1cccc(Br)c1)C(=O)NCCCN1CCc2ccccc2C1 ZINC000514214558 922548820 /nfs/dbraw/zinc/54/88/20/922548820.db2.gz NQXJRYZOKMDWMI-UHFFFAOYSA-N 0 3 416.363 4.039 20 0 HIADHN C[C@H](NC(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1)c1ccc(OC(F)F)cc1 ZINC000514214205 922548919 /nfs/dbraw/zinc/54/89/19/922548919.db2.gz LRFHIZNYHUFSKR-BXWFABGCSA-N 0 3 403.473 4.484 20 0 HIADHN Cc1cccc(NC(=O)N[C@@H](CN2CCCC2)c2ccccc2)c1C(=O)N1CCCC1 ZINC000514225256 922562588 /nfs/dbraw/zinc/56/25/88/922562588.db2.gz BCJLYGWTRLDVRK-QFIPXVFZSA-N 0 3 420.557 4.190 20 0 HIADHN CCc1ccc([C@H](CNC(=O)c2ccccc2OCc2cscn2)N(C)C)cc1 ZINC000514353191 922605026 /nfs/dbraw/zinc/60/50/26/922605026.db2.gz QWMTXYUEROPTMD-NRFANRHFSA-N 0 3 409.555 4.317 20 0 HIADHN CC(C)[C@@H](NC(=O)NC[C@H](c1ccccc1)N1CCCC1)c1ccc2c(c1)OCCO2 ZINC000514442599 922629272 /nfs/dbraw/zinc/62/92/72/922629272.db2.gz CZWAFSXGABMDMR-ZJSXRUAMSA-N 0 3 423.557 4.291 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)c1cc(-c2ccc(Cl)s2)on1 ZINC000514501474 922652692 /nfs/dbraw/zinc/65/26/92/922652692.db2.gz IDPYIPOQPBCKQB-UHFFFAOYSA-N 0 3 401.919 4.235 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1nc(C(F)(F)F)cs1)c1cccc(OC)c1 ZINC000514503155 922653829 /nfs/dbraw/zinc/65/38/29/922653829.db2.gz SSXAEWPWNOBBKA-AWEZNQCLSA-N 0 3 416.469 4.375 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)NC[C@@H](c2ccccc2)N(C)C)c(C(F)(F)F)c1 ZINC000514504690 922656120 /nfs/dbraw/zinc/65/61/20/922656120.db2.gz XFBCJFKLOMSUNX-SFHVURJKSA-N 0 3 408.424 4.088 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)NC[C@H](c2ccccc2)N2CCCC2)cc1OC ZINC000514566766 922704075 /nfs/dbraw/zinc/70/40/75/922704075.db2.gz NRGSXIQHVBVJMB-FCHUYYIVSA-N 0 3 423.557 4.387 20 0 HIADHN CCOc1ccc(CN2CCN(CCCC(=O)Nc3c(C)cccc3C)CC2)cc1 ZINC000514748811 922780304 /nfs/dbraw/zinc/78/03/04/922780304.db2.gz HYFHHOZIVDXIEX-UHFFFAOYSA-N 0 3 409.574 4.239 20 0 HIADHN CCc1[nH]ccc1C(=O)N(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000514805972 922806657 /nfs/dbraw/zinc/80/66/57/922806657.db2.gz OJAGNHHHUHPQNM-JOCHJYFZSA-N 0 3 402.542 4.279 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1cccc(N2CCCC2=O)c1)c1cccc(OC)c1 ZINC000515104892 922918621 /nfs/dbraw/zinc/91/86/21/922918621.db2.gz CAPIZGKIENXVJW-JOCHJYFZSA-N 0 3 424.545 4.027 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCCc3ccc(OC(C)C)cc3)c(C)c2)CC1 ZINC000515112839 922925971 /nfs/dbraw/zinc/92/59/71/922925971.db2.gz UJJLLVMTAZYQJC-UHFFFAOYSA-N 0 3 424.589 4.288 20 0 HIADHN O=C(Nc1cccc(NC(=O)c2cccs2)c1)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000515119553 922933970 /nfs/dbraw/zinc/93/39/70/922933970.db2.gz AFEUILJXHZIESS-HXUWFJFHSA-N 0 3 420.538 4.396 20 0 HIADHN Cc1ccc(CNC(=O)C2CCN(CCOc3ccc(Cl)cc3)CC2)cc1F ZINC000515141080 922948873 /nfs/dbraw/zinc/94/88/73/922948873.db2.gz UVCAKXCKUIJNBP-UHFFFAOYSA-N 0 3 404.913 4.195 20 0 HIADHN CCc1ccc(Cl)c(CC)c1NC(=O)CCCN1C[C@H](C)OC2(CCOCC2)C1 ZINC000515185573 922976955 /nfs/dbraw/zinc/97/69/55/922976955.db2.gz XHXVJLAGOIHMAF-KRWDZBQOSA-N 0 3 422.997 4.453 20 0 HIADHN CCc1ccc(Cl)c(CC)c1NC(=O)CCCN1C[C@@H](C)OC2(CCOCC2)C1 ZINC000515185574 922977036 /nfs/dbraw/zinc/97/70/36/922977036.db2.gz XHXVJLAGOIHMAF-QGZVFWFLSA-N 0 3 422.997 4.453 20 0 HIADHN O=C(c1occc1COc1ccccc1)N1CCN(c2ccnc3ccccc32)CC1 ZINC000515318157 923046903 /nfs/dbraw/zinc/04/69/03/923046903.db2.gz FTEQTMPVZJFIMZ-UHFFFAOYSA-N 0 3 413.477 4.369 20 0 HIADHN Cc1cc(OC(C)C)ccc1NC(=O)NCCCN1CCN(Cc2ccccc2)CC1 ZINC000515470926 923122078 /nfs/dbraw/zinc/12/20/78/923122078.db2.gz VMWPKAOJAZBJRO-UHFFFAOYSA-N 0 3 424.589 4.112 20 0 HIADHN Cc1cc(C)n(-c2ccc(CCN[C@H](C(=O)N3CCCCC3)c3ccccc3)cc2)n1 ZINC000515518561 923148588 /nfs/dbraw/zinc/14/85/88/923148588.db2.gz KUUOUVPSDMYZKM-VWLOTQADSA-N 0 3 416.569 4.375 20 0 HIADHN O=C(CCOc1cccc(Cl)c1Cl)N1CCCN(Cc2ccccc2)CC1 ZINC000515746919 923320613 /nfs/dbraw/zinc/32/06/13/923320613.db2.gz GLVVWJYUMUZFKF-UHFFFAOYSA-N 0 3 407.341 4.497 20 0 HIADHN COc1ccc([C@H](NC(=O)N(CCN(C)C)Cc2ccc(F)cc2)C(C)C)cc1 ZINC000515789164 923350634 /nfs/dbraw/zinc/35/06/34/923350634.db2.gz OAVZMFWLBITEOZ-JOCHJYFZSA-N 0 3 401.526 4.305 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)NCc3ccc([C@H]4C[C@@H]4C)o3)CC2)c1 ZINC000515794319 923353330 /nfs/dbraw/zinc/35/33/30/923353330.db2.gz KRLXLABMNPNYCD-REWPJTCUSA-N 0 3 424.589 4.113 20 0 HIADHN CSc1ncc(Cl)c(C(=O)NC[C@@H](c2ccccc2)N2CCC(C)CC2)n1 ZINC000515980441 923476743 /nfs/dbraw/zinc/47/67/43/923476743.db2.gz IOZSIQQNFMXRBY-KRWDZBQOSA-N 0 3 404.967 4.055 20 0 HIADHN CC1CCN([C@@H](CNC(=O)c2cccc(N3CCCC3=O)c2)c2ccccc2)CC1 ZINC000515987338 923482687 /nfs/dbraw/zinc/48/26/87/923482687.db2.gz FQTONTRJQLZRQW-QHCPKHFHSA-N 0 3 405.542 4.016 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)C[C@@H](C)c3ccc(F)cc3)CC2)c1 ZINC000515997703 923489647 /nfs/dbraw/zinc/48/96/47/923489647.db2.gz VRBDEKSMRNYJPJ-OAQYLSRUSA-N 0 3 411.565 4.346 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N(C)CCCc3ccc(OC)cc3)c(C)c2)CC1 ZINC000516078297 923531983 /nfs/dbraw/zinc/53/19/83/923531983.db2.gz KFMMGOAIKMUICL-UHFFFAOYSA-N 0 3 424.589 4.242 20 0 HIADHN CN(CCc1nc(-c2ccccc2)no1)Cc1ccccc1OCc1ccccn1 ZINC000516116364 923553220 /nfs/dbraw/zinc/55/32/20/923553220.db2.gz JLZZLNHUUWOSRK-UHFFFAOYSA-N 0 3 400.482 4.385 20 0 HIADHN O=C1[C@H](NC2(c3ccc(F)cc3)CCOCC2)CCN1c1ccc(Cl)c(F)c1 ZINC000516145721 923574738 /nfs/dbraw/zinc/57/47/38/923574738.db2.gz KLTDICYDBVUYAL-LJQANCHMSA-N 0 3 406.860 4.019 20 0 HIADHN CCCC(=O)Nc1cccc(CNC(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)c1 ZINC000516163838 923582404 /nfs/dbraw/zinc/58/24/04/923582404.db2.gz ZXDJWFSBFFGALI-XMSQKQJNSA-N 0 3 408.546 4.060 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N2CCC[C@@H]2c2ccc3c(c2)OCCO3)C1 ZINC000516165661 923584301 /nfs/dbraw/zinc/58/43/01/923584301.db2.gz UVZDFEGSDVBJHT-BVYCBKJFSA-N 0 3 421.541 4.140 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)c2cccc(NC(=O)C3CCCCC3)c2)cc1 ZINC000516190230 923590613 /nfs/dbraw/zinc/59/06/13/923590613.db2.gz PNRHLTHZUZCAPQ-HSZRJFAPSA-N 0 3 423.557 4.247 20 0 HIADHN COc1ccc(C(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)cc1Br ZINC000516204846 923597498 /nfs/dbraw/zinc/59/74/98/923597498.db2.gz WJYKMZDBKSHKTR-YOEHRIQHSA-N 0 3 403.320 4.023 20 0 HIADHN CSc1cccc(N(C(=O)c2cc3ccccc3c(=O)n2C)C2CCN(C)CC2)c1 ZINC000516338895 923675078 /nfs/dbraw/zinc/67/50/78/923675078.db2.gz BYZITWQONPLOSO-UHFFFAOYSA-N 0 3 421.566 4.001 20 0 HIADHN CC[C@H](N[C@H](C)c1ccc(OC)c(OC)c1C)c1ccccc1OCC(=O)N(C)C ZINC000516498486 923760061 /nfs/dbraw/zinc/76/00/61/923760061.db2.gz BJHGVPHINQNFMX-XLIONFOSSA-N 0 3 414.546 4.281 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1cc(C)n(-c2ccc(F)cc2F)n1)c1ccco1 ZINC000516600597 923808728 /nfs/dbraw/zinc/80/87/28/923808728.db2.gz VMIQGQOUODZEHF-SUMWQHHRSA-N 0 3 417.460 4.303 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)Nc1cc(C)n(-c2ccc(F)cc2F)n1)c1ccco1 ZINC000516600595 923809093 /nfs/dbraw/zinc/80/90/93/923809093.db2.gz VMIQGQOUODZEHF-DYVFJYSZSA-N 0 3 417.460 4.303 20 0 HIADHN O=C(N1CCC=C(c2cccnc2)C1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000516602887 923811199 /nfs/dbraw/zinc/81/11/99/923811199.db2.gz CXTRFRYXZRDLHK-JOCHJYFZSA-N 0 3 415.459 4.152 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CN1CC[C@](CO)(Cc2ccc(F)cc2)C1 ZINC000516604028 923811408 /nfs/dbraw/zinc/81/14/08/923811408.db2.gz LTKKXECKICELKO-VWLOTQADSA-N 0 3 407.533 4.114 20 0 HIADHN CC(C)CC(=O)Nc1ccc(NC(=O)N[C@H]2CCN(Cc3ccccc3)[C@H]2C)cc1 ZINC000516657338 923830585 /nfs/dbraw/zinc/83/05/85/923830585.db2.gz XZMCBUSEAZIFKS-AVRDEDQJSA-N 0 3 408.546 4.456 20 0 HIADHN CC[C@@H](CNC(=O)c1ccc(Oc2cccnc2)cc1)N1CCc2ccccc2C1 ZINC000516818649 923902598 /nfs/dbraw/zinc/90/25/98/923902598.db2.gz KLARORIIZOBYTE-QFIPXVFZSA-N 0 3 401.510 4.441 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1cc(F)ccc1OC[C@H]1CCCO1)c1ccco1 ZINC000516885565 923925336 /nfs/dbraw/zinc/92/53/36/923925336.db2.gz OBBZJHCUOMCVOG-KVSKMBFKSA-N 0 3 419.497 4.227 20 0 HIADHN C[C@H](C(=O)N1Cc2cnn(-c3ccccc3)c2C1)N1CCC(Cc2ccccc2)CC1 ZINC000516890151 923929028 /nfs/dbraw/zinc/92/90/28/923929028.db2.gz WTKZTURINHFCCY-HXUWFJFHSA-N 0 3 414.553 4.058 20 0 HIADHN CCc1cccc(C)c1NC(=O)CN[C@@H]1CCN(CC)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000516982845 923951062 /nfs/dbraw/zinc/95/10/62/923951062.db2.gz UBVMMZBSUIBMMN-AUSIDOKSSA-N 0 3 419.491 4.338 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)N1CCn2cccc2[C@H]1c1ccccc1 ZINC000517111656 924003484 /nfs/dbraw/zinc/00/34/84/924003484.db2.gz WFOWCCRTMPZMNI-LOSJGSFVSA-N 0 3 414.553 4.440 20 0 HIADHN COc1ccsc1CN1CCC(O)(Cc2ccc(OC(F)(F)F)cc2)CC1 ZINC000517203016 924051836 /nfs/dbraw/zinc/05/18/36/924051836.db2.gz IGQQZKJLLABREU-UHFFFAOYSA-N 0 3 401.450 4.225 20 0 HIADHN Cc1ccccc1CN1CCCN(C(=O)COc2c(Cl)cccc2Cl)CC1 ZINC000517298707 924086257 /nfs/dbraw/zinc/08/62/57/924086257.db2.gz XZXNZSBHAMUEPO-UHFFFAOYSA-N 0 3 407.341 4.415 20 0 HIADHN CCC(CC)[C@@H](NC(=O)C(=O)Nc1cc(CN(C)C)ccc1OC)c1cccs1 ZINC000517319899 924100626 /nfs/dbraw/zinc/10/06/26/924100626.db2.gz YZQKNRUZJMHDGA-HXUWFJFHSA-N 0 3 417.575 4.051 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)NCc2ccc(Br)cc2)C1 ZINC000517340692 924114741 /nfs/dbraw/zinc/11/47/41/924114741.db2.gz BMZXCELVJFZWPK-KXBFYZLASA-N 0 3 402.336 4.084 20 0 HIADHN COc1ccc(-c2ocnc2C(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)cc1 ZINC000517431385 924180091 /nfs/dbraw/zinc/18/00/91/924180091.db2.gz IQCODPFSQLWNGG-OAQYLSRUSA-N 0 3 405.498 4.226 20 0 HIADHN COc1ccccc1[C@H](C)CC(=O)NCC1(N2CCOC(C)(C)C2)CCCCC1 ZINC000517482000 924221146 /nfs/dbraw/zinc/22/11/46/924221146.db2.gz CIYIMRDGHASEAK-LJQANCHMSA-N 0 3 402.579 4.119 20 0 HIADHN CC(C)OC(=O)C[C@H](NC(=O)N[C@H]1CCN([C@H](C)c2ccccc2)C1)c1ccccc1 ZINC000517543755 924255323 /nfs/dbraw/zinc/25/53/23/924255323.db2.gz JZALOQKZKUXION-OIBXWCBGSA-N 0 3 423.557 4.204 20 0 HIADHN CC(C)Oc1ccc([C@@H](C)NC(=O)N(CCN(C)C)Cc2ccc(F)cc2)cc1 ZINC000517542107 924255613 /nfs/dbraw/zinc/25/56/13/924255613.db2.gz FAYCGWSWPPGPJO-GOSISDBHSA-N 0 3 401.526 4.447 20 0 HIADHN COc1ccc(Cl)cc1CN(C)C(=O)N[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000517544484 924257434 /nfs/dbraw/zinc/25/74/34/924257434.db2.gz CTJLPUOGKWQTLS-UZLBHIALSA-N 0 3 401.938 4.326 20 0 HIADHN O=C(c1ccc(CNCc2ccc(-c3ccccc3F)s2)cc1)N1CCOCC1 ZINC000517550572 924259819 /nfs/dbraw/zinc/25/98/19/924259819.db2.gz DMRGEZRGDGZDRZ-UHFFFAOYSA-N 0 3 410.514 4.316 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2CNC[C@H](O)COc2ccc(F)cc2)o1 ZINC000517549071 924259924 /nfs/dbraw/zinc/25/99/24/924259924.db2.gz WLFGHBVDXJPXGK-NRFANRHFSA-N 0 3 421.472 4.109 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)N(CCN(C)C)Cc2cccc(F)c2)c(Cl)c1 ZINC000517573312 926687090 /nfs/dbraw/zinc/68/70/90/926687090.db2.gz XJGQARGZDFNLIF-UHFFFAOYSA-N 0 3 406.889 4.033 20 0 HIADHN FC(F)Oc1ccc(-c2noc([C@H]3CN(Cc4ccccc4)CCC3(F)F)n2)nc1 ZINC000517623785 926732597 /nfs/dbraw/zinc/73/25/97/926732597.db2.gz FQLBHHCLLBLERT-OAHLLOKOSA-N 0 3 422.382 4.358 20 0 HIADHN c1ccc(C2(c3noc(-c4ccc(CN5CCSCC5)cc4)n3)CCOCC2)cc1 ZINC000517624041 926732740 /nfs/dbraw/zinc/73/27/40/926732740.db2.gz MOCQHPSCBCYHJR-UHFFFAOYSA-N 0 3 421.566 4.382 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1NC(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000517643565 926750256 /nfs/dbraw/zinc/75/02/56/926750256.db2.gz YBLNZNAFAWFTNM-WIYYLYMNSA-N 0 3 403.530 4.446 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1NC(=O)N[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000517643563 926750997 /nfs/dbraw/zinc/75/09/97/926750997.db2.gz YBLNZNAFAWFTNM-NQIIRXRSSA-N 0 3 403.530 4.446 20 0 HIADHN CC1CCN(CCNC(=O)Nc2ccc(Br)cc2C(F)(F)F)CC1 ZINC000517726823 926816218 /nfs/dbraw/zinc/81/62/18/926816218.db2.gz GHJXIUCAYRBTLJ-UHFFFAOYSA-N 0 3 408.262 4.321 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N(C)Cc2ccc(Br)s2)C1 ZINC000517790916 926837979 /nfs/dbraw/zinc/83/79/79/926837979.db2.gz HDXCTBDGIKKAPC-ZBFHGGJFSA-N 0 3 422.392 4.488 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)N(C)Cc2ccc(Br)s2)C1 ZINC000517790915 926838113 /nfs/dbraw/zinc/83/81/13/926838113.db2.gz HDXCTBDGIKKAPC-GOEBONIOSA-N 0 3 422.392 4.488 20 0 HIADHN O=C(NC[C@@H]1CCCO[C@@H]1c1ccccc1)N1CCCN(Cc2ccccc2)CC1 ZINC000517804985 926844247 /nfs/dbraw/zinc/84/42/47/926844247.db2.gz USJYEPAJVOQGOX-BJKOFHAPSA-N 0 3 407.558 4.072 20 0 HIADHN C[C@@H](CN1CCC[C@H](C)C1)NC(=O)C(=O)Nc1ccccc1Sc1ccccc1 ZINC000517816300 926849713 /nfs/dbraw/zinc/84/97/13/926849713.db2.gz WNZNMQPUVLCNKN-ROUUACIJSA-N 0 3 411.571 4.013 20 0 HIADHN O=C(Nc1ccc(OCC(F)(F)C(F)F)nc1)c1cccc(CN2CCCC2)c1 ZINC000517846750 926861897 /nfs/dbraw/zinc/86/18/97/926861897.db2.gz IGZNDMPYKLFEMP-UHFFFAOYSA-N 0 3 411.399 4.209 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)c3cnc(C(C)(C)C)s3)CC2)c1 ZINC000517866064 926868564 /nfs/dbraw/zinc/86/85/64/926868564.db2.gz BOGGKVZRDIZHAV-UHFFFAOYSA-N 0 3 414.619 4.081 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)c1ccc(OC)c(OC2CCCC2)c1)c1ccco1 ZINC000517992890 926935300 /nfs/dbraw/zinc/93/53/00/926935300.db2.gz RNMCUSYSPZNNSJ-QFBILLFUSA-N 0 3 400.519 4.469 20 0 HIADHN COC1CCN(C(C)(C)CNC(=O)[C@@H](C)Sc2cc(Cl)ccc2Cl)CC1 ZINC000518082878 927012527 /nfs/dbraw/zinc/01/25/27/927012527.db2.gz ADSONAJFIOABMH-CYBMUJFWSA-N 0 3 419.418 4.480 20 0 HIADHN CC1CCN(CCNC(=O)c2cn(C(C)(C)C)nc2-c2ccccc2Cl)CC1 ZINC000518117355 927029270 /nfs/dbraw/zinc/02/92/70/927029270.db2.gz MNNWGUSCNAZHGU-UHFFFAOYSA-N 0 3 402.970 4.420 20 0 HIADHN CN(C)[C@@H](CNC(=O)Nc1ccc(OC(F)F)c2ncccc12)c1ccccc1 ZINC000518170333 927061392 /nfs/dbraw/zinc/06/13/92/927061392.db2.gz WSDMSHMNQXZSMQ-KRWDZBQOSA-N 0 3 400.429 4.261 20 0 HIADHN COc1cccc(CNC[C@@H](c2cccc(Cl)c2)N2CCOCC2)c1OC(C)C ZINC000518275838 927133331 /nfs/dbraw/zinc/13/33/31/927133331.db2.gz SWUUGMXYYWLPLL-NRFANRHFSA-N 0 3 418.965 4.299 20 0 HIADHN C[C@H](C(=O)NC1CCCC1)N(C)CCCCCc1cc(-c2ccc(F)cc2)n[nH]1 ZINC000518316705 927180641 /nfs/dbraw/zinc/18/06/41/927180641.db2.gz RCARBZIGYUWXEF-QGZVFWFLSA-N 0 3 400.542 4.308 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)CCC(=O)c1ccc2c(c1)CCC2 ZINC000518318601 927182916 /nfs/dbraw/zinc/18/29/16/927182916.db2.gz NAUQWUHVBZSSDI-XMMPIXPASA-N 0 3 419.569 4.046 20 0 HIADHN CCn1c2ccccc2nc1[C@H](C)NC(=O)c1ccc(N2CCN(C(C)C)CC2)cc1 ZINC000518421991 927259754 /nfs/dbraw/zinc/25/97/54/927259754.db2.gz YXOAANAWBJFNPE-IBGZPJMESA-N 0 3 419.573 4.078 20 0 HIADHN Ic1cccc(CNCc2ccc(N3CCCCCC3)nc2)c1 ZINC000518577015 927357194 /nfs/dbraw/zinc/35/71/94/927357194.db2.gz IGYBPPUFVRTPID-UHFFFAOYSA-N 0 3 421.326 4.356 20 0 HIADHN CCOc1c(OC)cc(CN[C@@H](c2ccc3[nH]c(=O)oc3c2)C(C)C)cc1OC ZINC000518584659 927364185 /nfs/dbraw/zinc/36/41/85/927364185.db2.gz LCPFLVVCILZZPP-HXUWFJFHSA-N 0 3 400.475 4.436 20 0 HIADHN C[C@@H](NC(=O)NC[C@@H](c1ccccc1)N(C)C)c1ccc(OCC(F)(F)F)cc1 ZINC000518629245 927389235 /nfs/dbraw/zinc/38/92/35/927389235.db2.gz RPKPQGUIODIMDP-BEFAXECRSA-N 0 3 409.452 4.291 20 0 HIADHN CCCN1CCC(NS(=O)(=O)c2ccc(Oc3cccc(Cl)c3)cc2)CC1 ZINC000518704650 927446049 /nfs/dbraw/zinc/44/60/49/927446049.db2.gz XIZMQIHHDOFZLT-UHFFFAOYSA-N 0 3 408.951 4.285 20 0 HIADHN COc1ccc([C@H](CNC(=O)CCOc2ccc(F)c(Cl)c2)N2CCCC2)cc1 ZINC000518731448 927461104 /nfs/dbraw/zinc/46/11/04/927461104.db2.gz ZCDJIOVHNWMZAV-NRFANRHFSA-N 0 3 420.912 4.210 20 0 HIADHN Cc1cccc([C@@H](CNCc2ccc(Br)cc2F)N2CCOCC2)c1 ZINC000518762390 927481264 /nfs/dbraw/zinc/48/12/64/927481264.db2.gz WCLGDHXRAHCJBF-HXUWFJFHSA-N 0 3 407.327 4.060 20 0 HIADHN C[C@H]1CN([C@@H](CNCC2=Cc3ccccc3OC2)c2c(F)cccc2Cl)CCO1 ZINC000518765552 927483172 /nfs/dbraw/zinc/48/31/72/927483172.db2.gz LMRGWGGIUNWTSK-KKSFZXQISA-N 0 3 416.924 4.307 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@@H](C)NCc2cnn(Cc3ccccc3)c2)CC1 ZINC000518774645 927486144 /nfs/dbraw/zinc/48/61/44/927486144.db2.gz YHOVFCFFCSXKTC-HXUWFJFHSA-N 0 3 421.564 4.063 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)c1oc2ccc(OC)cc2c1C ZINC000518843300 927544443 /nfs/dbraw/zinc/54/44/43/927544443.db2.gz AOJYGVJZLWWJRL-IBGZPJMESA-N 0 3 407.514 4.272 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1ccc(NC(C)=O)cc1)c1ccc(C(F)(F)F)cc1 ZINC000518892108 927602933 /nfs/dbraw/zinc/60/29/33/927602933.db2.gz GPCIIAJBSVVVMN-FQEVSTJZSA-N 0 3 421.463 4.477 20 0 HIADHN CN(C(=O)CCc1ncc(-c2ccc(Cl)cc2Cl)o1)[C@H]1CCN(C2CC2)C1 ZINC000518899423 927609235 /nfs/dbraw/zinc/60/92/35/927609235.db2.gz WNHJXDLDCQNALB-HNNXBMFYSA-N 0 3 408.329 4.276 20 0 HIADHN Cc1ccc(C2(C(=O)NC[C@H](C(C)C)N3CCc4ccccc4C3)CCOCC2)cc1 ZINC000518920326 927627166 /nfs/dbraw/zinc/62/71/66/927627166.db2.gz RVRMGPQIDMLLDO-RUZDIDTESA-N 0 3 420.597 4.242 20 0 HIADHN CC(C)(CNC(=O)c1cccc(OCc2cccnc2)c1)N1CCc2ccccc2C1 ZINC000518959873 927659114 /nfs/dbraw/zinc/65/91/14/927659114.db2.gz JGSYSIGPICFKHV-UHFFFAOYSA-N 0 3 415.537 4.227 20 0 HIADHN COc1ccc(OCc2nc(CN[C@@H]3CCN(Cc4ccccc4)[C@@H]3C)cs2)cc1 ZINC000519025496 927701857 /nfs/dbraw/zinc/70/18/57/927701857.db2.gz RXBINAYUTHTOJV-WZONZLPQSA-N 0 3 423.582 4.483 20 0 HIADHN COc1ccc([C@@H](Cc2ccc(F)cc2)N[C@@H](C)C(=O)Nc2c(C)nn(C)c2C)cc1 ZINC000519064250 927742458 /nfs/dbraw/zinc/74/24/58/927742458.db2.gz PUCXLQPLFJTUDP-KSFYIVLOSA-N 0 3 424.520 4.085 20 0 HIADHN CCOc1cc2c(cc1NC(=O)NC[C@H](c1ccccc1)N1CCCC1)O[C@H](C)C2 ZINC000519241402 927843295 /nfs/dbraw/zinc/84/32/95/927843295.db2.gz HLYJCTAGHDWAME-DYESRHJHSA-N 0 3 409.530 4.367 20 0 HIADHN CC(C)Sc1ccc(Cl)cc1NC(=O)C(=O)NC[C@@H](C)N1CCC(C)CC1 ZINC000519241296 927843729 /nfs/dbraw/zinc/84/37/29/927843729.db2.gz ZJMFVKPLJMODMS-OAHLLOKOSA-N 0 3 411.999 4.016 20 0 HIADHN CC(C)Sc1ccc(Cl)cc1NC(=O)C(=O)NC[C@H](C)N1CCC(C)CC1 ZINC000519241295 927843887 /nfs/dbraw/zinc/84/38/87/927843887.db2.gz ZJMFVKPLJMODMS-HNNXBMFYSA-N 0 3 411.999 4.016 20 0 HIADHN Cc1ccc(CN(C)C[C@H](O)COc2ccc(Cl)cc2Br)s1 ZINC000519284189 927863252 /nfs/dbraw/zinc/86/32/52/927863252.db2.gz HGDDMWPYBZEEDL-ZDUSSCGKSA-N 0 3 404.757 4.344 20 0 HIADHN CCOc1cccc2cc([C@H](C)N[C@H]3CCCc4cc(S(N)(=O)=O)ccc43)oc21 ZINC000519306074 927873544 /nfs/dbraw/zinc/87/35/44/927873544.db2.gz YFJAPNHASZERFJ-LIRRHRJNSA-N 0 3 414.527 4.207 20 0 HIADHN Cc1c([C@@H](C)NC(=O)NC[C@H](c2ccc(C)cc2)N(C)C)cnn1-c1ccc(F)cc1 ZINC000519342661 927890115 /nfs/dbraw/zinc/89/01/15/927890115.db2.gz GJAVGDRSUGUJJQ-UZUQRXQVSA-N 0 3 423.536 4.291 20 0 HIADHN O=C([C@H]1CCCN(Cc2cccc(F)c2)C1)N1CCC(c2nc3ccccc3[nH]2)CC1 ZINC000519363679 927897789 /nfs/dbraw/zinc/89/77/89/927897789.db2.gz OJKZUNVAMCXNBF-FQEVSTJZSA-N 0 3 420.532 4.320 20 0 HIADHN C[C@@H]1CCC[C@@H](C)N1CCNC(=O)N1CCC(C(=O)c2ccc(Cl)cc2)CC1 ZINC000519388543 927915155 /nfs/dbraw/zinc/91/51/55/927915155.db2.gz SAYNNOFDLRRQMA-IAGOWNOFSA-N 0 3 405.970 4.207 20 0 HIADHN C[C@H]1CCC[C@H](C)N1CCNC(=O)N1CCC(C(=O)c2ccc(Cl)cc2)CC1 ZINC000519388544 927915221 /nfs/dbraw/zinc/91/52/21/927915221.db2.gz SAYNNOFDLRRQMA-IRXDYDNUSA-N 0 3 405.970 4.207 20 0 HIADHN O=C(N[C@H](c1ccc(F)cc1)[C@H]1CCCO1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000519421630 927936913 /nfs/dbraw/zinc/93/69/13/927936913.db2.gz OZIYIPSVMXZUQT-WWPVKYPJSA-N 0 3 414.496 4.213 20 0 HIADHN CCCO[C@H]1CCCN(C(=O)NC[C@@H](c2cccc(OC)c2)N(CC)CC)CC1 ZINC000519452280 927959161 /nfs/dbraw/zinc/95/91/61/927959161.db2.gz WVDRJDAFYZUADP-UNMCSNQZSA-N 0 3 405.583 4.069 20 0 HIADHN c1nc(-c2ccccn2)sc1CN1CCC[C@@H](c2nc(-c3ccccc3)n[nH]2)C1 ZINC000519669228 928044569 /nfs/dbraw/zinc/04/45/69/928044569.db2.gz IELMONFWXPJBSO-QGZVFWFLSA-N 0 3 402.527 4.370 20 0 HIADHN C[C@@H](N[C@@H](Cc1ccccc1Cl)c1ccccc1)C(=O)Nc1ccc(C(N)=O)cc1 ZINC000519876128 928110823 /nfs/dbraw/zinc/11/08/23/928110823.db2.gz WDSOPOGLQXDDCD-ZHRRBRCNSA-N 0 3 421.928 4.340 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N(CCOC)[C@H](C)c3ccccc3)c(C)c2)CC1 ZINC000519908507 928142333 /nfs/dbraw/zinc/14/23/33/928142333.db2.gz AVECDWQWYFDNGY-OAQYLSRUSA-N 0 3 424.589 4.378 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)CCc1nc2cc(Cl)ccc2s1 ZINC000519925552 928158749 /nfs/dbraw/zinc/15/87/49/928158749.db2.gz WFMCSMPIODMCNW-UHFFFAOYSA-N 0 3 401.963 4.473 20 0 HIADHN CN(C)[C@@H](CNC(=O)N[C@@H]1CCCc2cc(OC(F)F)ccc21)c1ccccc1 ZINC000519927883 928161105 /nfs/dbraw/zinc/16/11/05/928161105.db2.gz OKUXCKFCLNWJQI-UXHICEINSA-N 0 3 403.473 4.268 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)Nc1ccc(Br)cc1 ZINC000520044858 928268157 /nfs/dbraw/zinc/26/81/57/928268157.db2.gz BFXOOYNXHFDPQP-UHFFFAOYSA-N 0 3 404.352 4.477 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)NCc2cccc(OCC(F)(F)F)c2)N(C)C)cc1 ZINC000520068098 928291116 /nfs/dbraw/zinc/29/11/16/928291116.db2.gz ZTYXJANTWKTMEJ-LJQANCHMSA-N 0 3 409.452 4.038 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N[C@@H](c2ccc3c(c2)OCCO3)C(C)C)N(C)C)cc1 ZINC000520067741 928291556 /nfs/dbraw/zinc/29/15/56/928291556.db2.gz FNWVBVKCZKNTMU-NFBKMPQASA-N 0 3 411.546 4.065 20 0 HIADHN COc1ccc2[nH]cc(C3=CCN(C(=O)[C@@H]4CCCN4Cc4ccccc4)CC3)c2c1 ZINC000520146561 928340348 /nfs/dbraw/zinc/34/03/48/928340348.db2.gz MUGXXIOZMBDJNP-VWLOTQADSA-N 0 3 415.537 4.457 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)N(Cc2ccccc2)CC(C)C)CC1 ZINC000520162109 928355984 /nfs/dbraw/zinc/35/59/84/928355984.db2.gz FLTFZCQJRHJBGM-UHFFFAOYSA-N 0 3 422.617 4.192 20 0 HIADHN COc1cccc(CNC[C@H](c2ccccc2Cl)N2CCOCC2)c1OC(C)C ZINC000520206774 928388291 /nfs/dbraw/zinc/38/82/91/928388291.db2.gz KVRCWRILVACFAN-OAQYLSRUSA-N 0 3 418.965 4.299 20 0 HIADHN C[C@H](CC(=O)Nc1cccc(N2CCCC2)c1)NCc1cnn(Cc2ccccc2)c1 ZINC000520218595 928395605 /nfs/dbraw/zinc/39/56/05/928395605.db2.gz LXZKWDSAVMCJPF-HXUWFJFHSA-N 0 3 417.557 4.039 20 0 HIADHN Fc1cccc([C@H](CNCc2cc(Cl)ccc2OC(F)F)N2CCOCC2)c1 ZINC000520217986 928395696 /nfs/dbraw/zinc/39/56/96/928395696.db2.gz SOYMXNXIHRUKMB-SFHVURJKSA-N 0 3 414.855 4.244 20 0 HIADHN C[C@H](C(=O)N1CCc2ccccc21)N(C)CCCc1cc(-c2cccc(F)c2)n[nH]1 ZINC000520264255 928428419 /nfs/dbraw/zinc/42/84/19/928428419.db2.gz BFKGSTUJQXEEAE-QGZVFWFLSA-N 0 3 406.505 4.058 20 0 HIADHN CCN1CCCN(C(=O)[C@](C)(Cc2nc3ccccc3s2)c2ccccc2)CC1 ZINC000520312229 928473728 /nfs/dbraw/zinc/47/37/28/928473728.db2.gz RGQAKSLVTCYAKR-XMMPIXPASA-N 0 3 407.583 4.351 20 0 HIADHN C[C@H](N[C@@H]1CCN(C(C)(C)C)[C@H]1c1ccc(Cl)c(F)c1)C(=O)Nc1nccs1 ZINC000520433248 928562754 /nfs/dbraw/zinc/56/27/54/928562754.db2.gz NCLUHGTVGZBXDV-VUCTXSBTSA-N 0 3 424.973 4.466 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)NCc1nc2cc(Cl)ccc2s1 ZINC000520438319 928565656 /nfs/dbraw/zinc/56/56/56/928565656.db2.gz VZWPGOCKVDFBFV-UHFFFAOYSA-N 0 3 420.941 4.362 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N(CC)[C@H]1CCOC(C)(C)C1)c1cccc(OC)c1 ZINC000520469235 928584456 /nfs/dbraw/zinc/58/44/56/928584456.db2.gz HQQBMSKNTPCGOI-PZJWPPBQSA-N 0 3 405.583 4.067 20 0 HIADHN Cc1cc2cc(NC(=O)NCCCCN3CCN(Cc4ccccc4)CC3)ccc2[nH]1 ZINC000520483581 928594265 /nfs/dbraw/zinc/59/42/65/928594265.db2.gz WJVZKFZBEWALLZ-UHFFFAOYSA-N 0 3 419.573 4.196 20 0 HIADHN CC(C)N(C)C(=O)c1ccc(Cl)c(NC(=O)N2CCN(CCC(C)(C)C)CC2)c1 ZINC000520598287 928662585 /nfs/dbraw/zinc/66/25/85/928662585.db2.gz DLKVNXLUGQTCAZ-UHFFFAOYSA-N 0 3 423.001 4.406 20 0 HIADHN COc1ccc([C@@H](Cc2ccc(F)cc2)NC(=O)N(CCN(C)C)CC(C)C)cc1 ZINC000520658066 928704412 /nfs/dbraw/zinc/70/44/12/928704412.db2.gz PGEHEBUZIOZEKD-HSZRJFAPSA-N 0 3 415.553 4.347 20 0 HIADHN CC(C)C[C@H](CNc1nc2c(cnn2C(C)(C)C)c(=O)[nH]1)N[C@@H](C)c1ccccc1 ZINC000520673778 928719477 /nfs/dbraw/zinc/71/94/77/928719477.db2.gz PBGMXBGRCCMYOR-FUHWJXTLSA-N 0 3 410.566 4.464 20 0 HIADHN O=C(N[C@@H](c1ccc(F)cc1)[C@H]1CCCO1)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000520753947 928802020 /nfs/dbraw/zinc/80/20/20/928802020.db2.gz RCXSDJFNQBNBCX-ZLNRFVROSA-N 0 3 411.521 4.010 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)N[C@@H]1C[C@@H]1c1cccc(Br)c1 ZINC000520781683 928814914 /nfs/dbraw/zinc/81/49/14/928814914.db2.gz WHOKQVLRPLTDCJ-WOJBJXKFSA-N 0 3 416.363 4.078 20 0 HIADHN O=C(Nc1cc(F)ccc1OC[C@H]1CCCO1)N1CCN(CC2CCCCC2)CC1 ZINC000520782375 928815775 /nfs/dbraw/zinc/81/57/75/928815775.db2.gz LOHKSZLJCKOVOK-HXUWFJFHSA-N 0 3 419.541 4.113 20 0 HIADHN COCCOc1c(Cl)cccc1NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000520807160 928827755 /nfs/dbraw/zinc/82/77/55/928827755.db2.gz PJQPSNDJYIYTOM-GOSISDBHSA-N 0 3 417.937 4.151 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2ccc(C)cc2OC[C@H]2CCCO2)N(C)C)cc1 ZINC000520826557 928834602 /nfs/dbraw/zinc/83/46/02/928834602.db2.gz DQBKSVRVACCFRZ-IRLDBZIGSA-N 0 3 411.546 4.286 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2ccccc2OC[C@@H]2CCCCO2)N(C)C)cc1 ZINC000520831228 928836064 /nfs/dbraw/zinc/83/60/64/928836064.db2.gz XTEHVIYCQKXRTN-UNMCSNQZSA-N 0 3 411.546 4.367 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)NCc2cccc(NC(=O)C3CCCC3)c2)N(C)C)cc1 ZINC000520903995 928868101 /nfs/dbraw/zinc/86/81/01/928868101.db2.gz PLIIZDZLRUYESB-HSZRJFAPSA-N 0 3 422.573 4.226 20 0 HIADHN C[C@H](C(=O)N(CCN(C)C)Cc1ccc(Br)cc1)c1ccccc1F ZINC000520927268 928877819 /nfs/dbraw/zinc/87/78/19/928877819.db2.gz VYTIKCXYQZRQEL-HNNXBMFYSA-N 0 3 407.327 4.282 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)c1[nH]c2ccc(F)cc2c1Cl ZINC000520990969 928908992 /nfs/dbraw/zinc/90/89/92/928908992.db2.gz PHPMLDNRDCOKBU-UHFFFAOYSA-N 0 3 409.839 4.443 20 0 HIADHN COc1ccc(C2(NC(=O)Nc3ccc(CCN4CCSCC4)cc3)CC2)cc1 ZINC000521008693 928924608 /nfs/dbraw/zinc/92/46/08/928924608.db2.gz YUJHWKOBAKJKGY-UHFFFAOYSA-N 0 3 411.571 4.097 20 0 HIADHN COCCOc1ccc(NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)cc1Cl ZINC000521008837 928925061 /nfs/dbraw/zinc/92/50/61/928925061.db2.gz JUZBEOQXRACOIT-QGZVFWFLSA-N 0 3 420.912 4.355 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)Nc1cccc(OCc2cccnc2)c1 ZINC000521072372 928973303 /nfs/dbraw/zinc/97/33/03/928973303.db2.gz ZRVPKYAKHJXYPJ-UHFFFAOYSA-N 0 3 422.504 4.395 20 0 HIADHN CCC(=O)Nc1ccc(Cl)c(NC(=O)N(CCN(C)C)Cc2cccc(F)c2)c1 ZINC000521072179 928973664 /nfs/dbraw/zinc/97/36/64/928973664.db2.gz RAUVWDZJSRNRDU-UHFFFAOYSA-N 0 3 420.916 4.423 20 0 HIADHN Cc1ccccc1-c1cc(C(=O)N(C)[C@@H]2CCN(C3CC3)C2)c2cnn(C(C)C)c2n1 ZINC000521082368 928980249 /nfs/dbraw/zinc/98/02/49/928980249.db2.gz ZNZNVRWJKCBVRR-LJQANCHMSA-N 0 3 417.557 4.296 20 0 HIADHN C[C@H](CNC(=O)c1cnn(-c2ccccc2)c1C(F)(F)F)N(C)Cc1ccccc1 ZINC000521095763 928991706 /nfs/dbraw/zinc/99/17/06/928991706.db2.gz TWRNTJFQMOSDMP-MRXNPFEDSA-N 0 3 416.447 4.141 20 0 HIADHN CCN1CCCC[C@@H]1CNC(=O)c1ccc(-c2nnc(-c3ccc(C)cc3)o2)cc1 ZINC000521130029 929012999 /nfs/dbraw/zinc/01/29/99/929012999.db2.gz ZWLIXSFKWUWEFW-OAQYLSRUSA-N 0 3 404.514 4.316 20 0 HIADHN Cc1sc2ncnc(SCC(=O)NC[C@H](C)N(C)Cc3ccccc3)c2c1C ZINC000521159437 929032950 /nfs/dbraw/zinc/03/29/50/929032950.db2.gz WQGKHXLYKSYFIV-AWEZNQCLSA-N 0 3 414.600 4.037 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)N1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC000521181722 929048355 /nfs/dbraw/zinc/04/83/55/929048355.db2.gz SJCFUDHNOBLRPH-OAQYLSRUSA-N 0 3 411.977 4.258 20 0 HIADHN CCOCc1cccc(NC(=O)NCC2(N3CCOC(C)(C)C3)CCCCC2)c1 ZINC000521306958 929115958 /nfs/dbraw/zinc/11/59/58/929115958.db2.gz SSFRALDZDMRQMT-UHFFFAOYSA-N 0 3 403.567 4.158 20 0 HIADHN CCN1CCCN(C(=O)c2ccc(OCc3ccc(Cl)cc3)c(OC)c2)CC1 ZINC000521358115 929178054 /nfs/dbraw/zinc/17/80/54/929178054.db2.gz PSWQPJVLDDINQP-UHFFFAOYSA-N 0 3 402.922 4.095 20 0 HIADHN O=C(NC1CCN(CCCOc2cccc(C(F)(F)F)c2)CC1)c1ccsc1 ZINC000521427967 929218163 /nfs/dbraw/zinc/21/81/63/929218163.db2.gz IVEZENWIKPBUOR-UHFFFAOYSA-N 0 3 412.477 4.430 20 0 HIADHN CC(C)COc1cccc(CN2CCC(C(=O)NCCc3cccs3)CC2)c1 ZINC000521451506 929227461 /nfs/dbraw/zinc/22/74/61/929227461.db2.gz TZLVJITTXUFGAL-UHFFFAOYSA-N 0 3 400.588 4.354 20 0 HIADHN O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N[C@@H]1CCSc2ccc(Cl)cc21 ZINC000521450855 929227806 /nfs/dbraw/zinc/22/78/06/929227806.db2.gz OFCIIGMLKJIMCT-IEBWSBKVSA-N 0 3 401.963 4.451 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2ccc(Oc3ncccn3)cc2C)N(C)C)cc1 ZINC000521460002 929231338 /nfs/dbraw/zinc/23/13/38/929231338.db2.gz BWSHGKKXYWYXDO-NRFANRHFSA-N 0 3 405.502 4.310 20 0 HIADHN CC(C)[C@@H](N[C@@H]1CCCc2cc(S(N)(=O)=O)ccc21)c1ccc(Cl)cc1F ZINC000521471465 929236783 /nfs/dbraw/zinc/23/67/83/929236783.db2.gz FPNCUUPISIHMFU-WOJBJXKFSA-N 0 3 410.942 4.491 20 0 HIADHN COCCN1CCC(NC(=O)[C@@H](Sc2ccccc2Cl)c2ccccc2)CC1 ZINC000521577408 929308029 /nfs/dbraw/zinc/30/80/29/929308029.db2.gz JKMFHNVHHYGCTK-NRFANRHFSA-N 0 3 418.990 4.400 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)Nc1ccc(NC(=O)C2CC2)cc1 ZINC000521675911 929360100 /nfs/dbraw/zinc/36/01/00/929360100.db2.gz FZIWERJSMSSJAB-UHFFFAOYSA-N 0 3 414.937 4.284 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)N[C@H]1CCCc2occc21 ZINC000521686008 929367427 /nfs/dbraw/zinc/36/74/27/929367427.db2.gz USMCKAKUBQNSLL-SFHVURJKSA-N 0 3 409.452 4.449 20 0 HIADHN O=C(CSc1nnc(-c2ccc3ccccc3c2)o1)N1CC[C@H](N2CCCCC2)C1 ZINC000521692165 929370103 /nfs/dbraw/zinc/37/01/03/929370103.db2.gz VNJDXCWALLNXSN-FQEVSTJZSA-N 0 3 422.554 4.069 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)NCCCc1c[nH]c2ccccc12 ZINC000521701528 929376104 /nfs/dbraw/zinc/37/61/04/929376104.db2.gz CZCAPIVOVLKHKE-UHFFFAOYSA-N 0 3 414.500 4.152 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)NCc1ccccc1Oc1cccc(F)c1 ZINC000521734566 929397284 /nfs/dbraw/zinc/39/72/84/929397284.db2.gz KEVHLHWBLPTLLB-UHFFFAOYSA-N 0 3 422.504 4.286 20 0 HIADHN CC[C@H](CNC(=O)c1cn(C)nc1-c1ccccc1Cl)N1CCc2ccccc2C1 ZINC000521748248 929409530 /nfs/dbraw/zinc/40/95/30/929409530.db2.gz BIOHWECPEYJAJT-LJQANCHMSA-N 0 3 422.960 4.307 20 0 HIADHN O=S1(=O)CCCN1CCNCc1ccc(N(c2ccccc2)c2ccccc2)cc1 ZINC000521828413 929482399 /nfs/dbraw/zinc/48/23/99/929482399.db2.gz XNEWDCQHGPBROP-UHFFFAOYSA-N 0 3 421.566 4.282 20 0 HIADHN CC(C)CCOc1cccc(NC(=O)N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)c1 ZINC000521876072 929523804 /nfs/dbraw/zinc/52/38/04/929523804.db2.gz ZPQMAFZQJFADLT-BGYRXZFFSA-N 0 3 417.594 4.465 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)NCc1ccccc1Br ZINC000521888999 929538122 /nfs/dbraw/zinc/53/81/22/929538122.db2.gz VTKCCFFNDINNDC-UHFFFAOYSA-N 0 3 418.379 4.155 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)NCc1ccccc1Br ZINC000521891405 929539196 /nfs/dbraw/zinc/53/91/96/929539196.db2.gz LQAJRIHRTOCLSB-UHFFFAOYSA-N 0 3 424.770 4.376 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccc(F)c2)C1)N1CCC(Oc2ccc(F)cc2)CC1 ZINC000524541418 929673770 /nfs/dbraw/zinc/67/37/70/929673770.db2.gz PNJXFCDTLJRHRT-LJQANCHMSA-N 0 3 414.496 4.247 20 0 HIADHN C[S@@](=O)Cc1cc(NC(=O)[C@H]2CCCN(Cc3ccccc3)C2)ccc1Cl ZINC000524545948 929675960 /nfs/dbraw/zinc/67/59/60/929675960.db2.gz PSLSXOYYFFRBPT-CBZJRKILSA-N 0 3 404.963 4.069 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1ccn(Cc2ccccc2)n1 ZINC000524623912 929732063 /nfs/dbraw/zinc/73/20/63/929732063.db2.gz WWFROXBGBOZILV-FQEVSTJZSA-N 0 3 403.530 4.060 20 0 HIADHN COc1ccc2ccccc2c1CNC[C@H](O)COc1ccc(C(F)(F)F)cc1 ZINC000524680699 929793058 /nfs/dbraw/zinc/79/30/58/929793058.db2.gz RDGDDQXDKFZIQS-KRWDZBQOSA-N 0 3 405.416 4.397 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(F)cc2)CC1)c1csc2c1CCCC2 ZINC000524835852 929852453 /nfs/dbraw/zinc/85/24/53/929852453.db2.gz MEPCCHCLBIRTEZ-UHFFFAOYSA-N 0 3 402.535 4.039 20 0 HIADHN Cc1cc(C(=O)NC2CCN(CCOc3ccc(F)cc3)CC2)c(C)n1C(C)C ZINC000524837300 929853063 /nfs/dbraw/zinc/85/30/63/929853063.db2.gz HJEPJEAXLHYOBS-UHFFFAOYSA-N 0 3 401.526 4.098 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)c1cnn(-c2ccc(Cl)cc2)c1 ZINC000524865854 929864659 /nfs/dbraw/zinc/86/46/59/929864659.db2.gz LLHVJQSCHWBTMF-GOSISDBHSA-N 0 3 408.933 4.262 20 0 HIADHN CC[C@@H](C)n1ncc2c1nc(C)cc2C(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C ZINC000524866849 929865112 /nfs/dbraw/zinc/86/51/12/929865112.db2.gz JZCWNYMSBVVKNK-UXHICEINSA-N 0 3 419.573 4.447 20 0 HIADHN CCN(CCc1nc(-c2cccc(Cl)c2)no1)Cc1ccc(OC)cc1OC ZINC000524907208 929883541 /nfs/dbraw/zinc/88/35/41/929883541.db2.gz IDXFIKVGHJDEBM-UHFFFAOYSA-N 0 3 401.894 4.472 20 0 HIADHN CN(C)[C@@H](CNC(=O)NCC1(c2ccccc2Br)CC1)c1ccccc1 ZINC000524992793 929959206 /nfs/dbraw/zinc/95/92/06/929959206.db2.gz UDDDCZQLMFAIPC-IBGZPJMESA-N 0 3 416.363 4.083 20 0 HIADHN O=C(N[C@@H]1C[C@H]1Cc1ccccc1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000525009448 929971255 /nfs/dbraw/zinc/97/12/55/929971255.db2.gz QVKOURNWHPFPCT-KCZVDYSFSA-N 0 3 402.460 4.188 20 0 HIADHN C[C@H](CNC(=O)Cc1ccc(NC(=O)CC(C)(C)C)cc1)N(C)Cc1ccccc1 ZINC000525049305 930002725 /nfs/dbraw/zinc/00/27/25/930002725.db2.gz NFHCXAMWLGLFKY-LJQANCHMSA-N 0 3 409.574 4.241 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)CCc2ccc(Cl)s2)cc1)[C@@H]1CCCN(C)C1 ZINC000525066364 930013521 /nfs/dbraw/zinc/01/35/21/930013521.db2.gz OYWKVELAVNDJDT-QGZVFWFLSA-N 0 3 419.978 4.139 20 0 HIADHN COc1cccc(-c2nn(-c3ccc(C)cc3)cc2C(=O)N(C)[C@@H]2CCCN(C)C2)c1 ZINC000525105222 930038865 /nfs/dbraw/zinc/03/88/65/930038865.db2.gz AEOQCMMYOYPGTD-OAQYLSRUSA-N 0 3 418.541 4.023 20 0 HIADHN CCN(Cc1ccc(OC)c(OC)c1)C(=O)CN1CC[C@H](c2ccccc2)[C@H](C)C1 ZINC000525122237 930049404 /nfs/dbraw/zinc/04/94/04/930049404.db2.gz BRDIZYVJZGOWHZ-KNQAVFIVSA-N 0 3 410.558 4.178 20 0 HIADHN C[C@H](CNC(=O)c1ccc(Sc2ccccc2Cl)nn1)N1CCC(C)CC1 ZINC000525128846 930051816 /nfs/dbraw/zinc/05/18/16/930051816.db2.gz KYAUZOHZCHYNHD-OAHLLOKOSA-N 0 3 404.967 4.131 20 0 HIADHN CC(C)(C)C(=O)NCCNCc1ccc(OCc2ccccc2)c(Br)c1 ZINC000525182171 930078599 /nfs/dbraw/zinc/07/85/99/930078599.db2.gz LVRPUEIEIZOIHH-UHFFFAOYSA-N 0 3 419.363 4.280 20 0 HIADHN Cc1cc(C)cc(-c2ccc(CNCc3ccc([C@]4(C)NC(=O)NC4=O)cc3)cc2)c1 ZINC000525195450 930083224 /nfs/dbraw/zinc/08/32/24/930083224.db2.gz UDXVBJFRLAGNKJ-SANMLTNESA-N 0 3 413.521 4.315 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N3CCC(CCc4ccc(O)cc4)CC3)cc2)CC1 ZINC000525238009 930099540 /nfs/dbraw/zinc/09/95/40/930099540.db2.gz DYOMEURRMOUYLU-UHFFFAOYSA-N 0 3 421.585 4.019 20 0 HIADHN Cc1cc(NC(=O)c2ccccc2Cl)sc1C(=O)NCCN1CC[C@@H](C)C1 ZINC000525292672 930136863 /nfs/dbraw/zinc/13/68/63/930136863.db2.gz NKAQWNGEUABXBL-CYBMUJFWSA-N 0 3 405.951 4.034 20 0 HIADHN CC[C@H](C)[C@@H]1CCCCN1CC(=O)N(C)CC(=O)Nc1ccccc1C(F)(F)F ZINC000525327768 930165098 /nfs/dbraw/zinc/16/50/98/930165098.db2.gz HIBKHFMTEOVZIQ-YJBOKZPZSA-N 0 3 413.484 4.003 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)NC3(c4cccc(F)c4)CC3)CC2)c1 ZINC000525346590 930185052 /nfs/dbraw/zinc/18/50/52/930185052.db2.gz BEAYCBNHSGJULM-UHFFFAOYSA-N 0 3 424.564 4.025 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)Cc1csc(Cc2ccccc2)n1 ZINC000525382406 930208690 /nfs/dbraw/zinc/20/86/90/930208690.db2.gz RHGNTMCXVZIZHC-HXUWFJFHSA-N 0 3 419.594 4.399 20 0 HIADHN Cc1oc(-c2cccs2)nc1CC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C ZINC000525384293 930211064 /nfs/dbraw/zinc/21/10/64/930211064.db2.gz BSEYFFIZIVJZLO-KRWDZBQOSA-N 0 3 409.555 4.377 20 0 HIADHN COc1ccc(C(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)c(Br)c1 ZINC000525384929 930211680 /nfs/dbraw/zinc/21/16/80/930211680.db2.gz LXTDJBFRAAENKW-INIZCTEOSA-N 0 3 417.347 4.194 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1ccccc1C(=O)N1CCCC1 ZINC000525453484 930249392 /nfs/dbraw/zinc/24/93/92/930249392.db2.gz DXVDQZZPVUIHPX-FQEVSTJZSA-N 0 3 420.557 4.051 20 0 HIADHN Cc1cccc(NC2CCN(C(=O)N[C@H]3CCN([C@H](C)c4ccccc4)C3)CC2)c1 ZINC000525498489 930285321 /nfs/dbraw/zinc/28/53/21/930285321.db2.gz ZBSNTLVWSKGXGR-YKSBVNFPSA-N 0 3 406.574 4.416 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)[C@@H]1C[C@H]1c1cccc(F)c1F ZINC000525542260 930315935 /nfs/dbraw/zinc/31/59/35/930315935.db2.gz HOHFPZFRDYVEPT-RBUKOAKNSA-N 0 3 402.510 4.298 20 0 HIADHN Cc1ccccc1C(C)(C)C(=O)Nc1ccc(C(=O)N(C)[C@@H]2CCCN(C)C2)cc1 ZINC000525580578 930343123 /nfs/dbraw/zinc/34/31/23/930343123.db2.gz BYUUIIWEYBDSHG-OAQYLSRUSA-N 0 3 407.558 4.078 20 0 HIADHN Cc1ccccc1C(C)(C)C(=O)Nc1ccc(C(=O)N(C)[C@H]2CCCN(C)C2)cc1 ZINC000525580577 930343582 /nfs/dbraw/zinc/34/35/82/930343582.db2.gz BYUUIIWEYBDSHG-NRFANRHFSA-N 0 3 407.558 4.078 20 0 HIADHN Cc1nc(-c2ccccc2)oc1C(=O)N1CCCN(CCCc2ccccc2)CC1 ZINC000525641695 930379193 /nfs/dbraw/zinc/37/91/93/930379193.db2.gz UZYZEUQOEUBOBL-UHFFFAOYSA-N 0 3 403.526 4.431 20 0 HIADHN CC1CCN([C@@H](CNC(=O)Cc2ccn(-c3ccc(F)cc3)n2)c2ccccc2)CC1 ZINC000525752142 930429302 /nfs/dbraw/zinc/42/93/02/930429302.db2.gz ZWPQWUNDRKAHKP-DEOSSOPVSA-N 0 3 420.532 4.143 20 0 HIADHN CC1CCN([C@H](CNC(=O)Cc2ccn(-c3ccc(F)cc3)n2)c2ccccc2)CC1 ZINC000525752143 930429527 /nfs/dbraw/zinc/42/95/27/930429527.db2.gz ZWPQWUNDRKAHKP-XMMPIXPASA-N 0 3 420.532 4.143 20 0 HIADHN COc1cc(C)ccc1C(=O)Nc1c(C)cnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000525834016 930460274 /nfs/dbraw/zinc/46/02/74/930460274.db2.gz ILVXNVSRQRZRHY-HXUWFJFHSA-N 0 3 404.514 4.208 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3ccc(OCC)cc3)c(OCC)c2)CC1 ZINC000526069681 930519049 /nfs/dbraw/zinc/51/90/49/930519049.db2.gz SKPCDVSEJAHCOL-UHFFFAOYSA-N 0 3 411.546 4.268 20 0 HIADHN COc1ccc2oc(C(=O)NC3CC(N4CCC(C(F)(F)F)CC4)C3)c(C)c2c1 ZINC000526945664 930554559 /nfs/dbraw/zinc/55/45/59/930554559.db2.gz IQJVJFOSJBQTGC-UHFFFAOYSA-N 0 3 410.436 4.285 20 0 HIADHN COC(=O)c1ccsc1N1CC[C@@H](N[C@@H](C)c2cc3ccccc3s2)C1=O ZINC000526944682 930554676 /nfs/dbraw/zinc/55/46/76/930554676.db2.gz UCKNZEOFICEPPN-SWLSCSKDSA-N 0 3 400.525 4.206 20 0 HIADHN CC(C)c1nc2c([nH]1)C[C@H](C(=O)NC[C@H](c1ccccc1Cl)N1CCCC1)CC2 ZINC000526967378 930559553 /nfs/dbraw/zinc/55/95/53/930559553.db2.gz GAMWCVKBLSPKBL-IIBYNOLFSA-N 0 3 414.981 4.245 20 0 HIADHN CC(C)c1nc2c([nH]1)CC[C@@H](C(=O)NC[C@H](c1ccccc1Cl)N1CCCC1)C2 ZINC000526967378 930559559 /nfs/dbraw/zinc/55/95/59/930559559.db2.gz GAMWCVKBLSPKBL-IIBYNOLFSA-N 0 3 414.981 4.245 20 0 HIADHN C[C@@H](CC(=O)Nc1ccc(NC(=O)C2CC2)cc1)N[C@@H]1CCOc2ccc(F)cc21 ZINC000527099720 930590299 /nfs/dbraw/zinc/59/02/99/930590299.db2.gz IDYJEURWNXLZFD-VBKZILBWSA-N 0 3 411.477 4.005 20 0 HIADHN CN1CCN(CCCCNC(=O)Nc2ccc(Cl)cc2-c2ccccc2)CC1 ZINC000527200237 930611092 /nfs/dbraw/zinc/61/10/92/930611092.db2.gz OLVAWGQSUDNQNQ-UHFFFAOYSA-N 0 3 400.954 4.156 20 0 HIADHN CSc1ccc(CN[C@@H](CN2CCC(C(N)=O)CC2)c2ccc(Cl)cc2)cc1 ZINC000527373093 930650841 /nfs/dbraw/zinc/65/08/41/930650841.db2.gz YPTUAKRIZKURIK-NRFANRHFSA-N 0 3 418.006 4.090 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1c[nH]c2ncc(Br)cc12)c1ccsc1 ZINC000527447418 930658123 /nfs/dbraw/zinc/65/81/23/930658123.db2.gz LZOKBUYXZKSVBN-INIZCTEOSA-N 0 3 421.364 4.200 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)Nc3ccc(C(F)(F)F)c(Br)c3)[C@@H]2C1 ZINC000530343706 930688130 /nfs/dbraw/zinc/68/81/30/930688130.db2.gz RXWTXACAJCMHAH-QMTHXVAHSA-N 0 3 406.246 4.026 20 0 HIADHN CC(C)(NC(=O)[C@@H]1CCCN(Cc2cccnc2)C1)c1ccc(OC(F)(F)F)cc1 ZINC000530404074 930702592 /nfs/dbraw/zinc/70/25/92/930702592.db2.gz MRUQAVCATRHOOK-QGZVFWFLSA-N 0 3 421.463 4.244 20 0 HIADHN CC(C)N1CCN([C@@H]2CCN(C(=O)c3ccc(O[C@H](C)c4ccccc4)cc3)C2)CC1 ZINC000530522849 930737171 /nfs/dbraw/zinc/73/71/71/930737171.db2.gz ICMGWFYJQSDQFP-ZJSXRUAMSA-N 0 3 421.585 4.067 20 0 HIADHN O=C(CC1(N2CCOCC2)CCCC1)Nc1ccc(NC(=O)Nc2ccccc2)cc1 ZINC000530566234 930750869 /nfs/dbraw/zinc/75/08/69/930750869.db2.gz JTXFXKGDSMYMKU-UHFFFAOYSA-N 0 3 422.529 4.304 20 0 HIADHN O=C(Nc1ccc(OCc2ccccn2)c(F)c1)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000530602833 930767201 /nfs/dbraw/zinc/76/72/01/930767201.db2.gz JCVWASLITFZLRX-LJQANCHMSA-N 0 3 420.488 4.045 20 0 HIADHN CC(C)(C)[C@H](CN1CCc2ccccc2C1)NC(=O)N1CCC[C@@H]1c1ccccn1 ZINC000530709296 930803146 /nfs/dbraw/zinc/80/31/46/930803146.db2.gz DIMZGOOZLQHQDE-PKTZIBPZSA-N 0 3 406.574 4.401 20 0 HIADHN O=C(NCCNCc1cnc(-c2ccsc2)s1)c1cccc(Br)c1 ZINC000530763813 930818601 /nfs/dbraw/zinc/81/86/01/930818601.db2.gz CMJZULNNKMFTAU-UHFFFAOYSA-N 0 3 422.373 4.154 20 0 HIADHN CN(C)Cc1ccc(-c2noc(-c3cnc4c(cnn4Cc4ccccc4)c3)n2)cc1 ZINC000530871919 930844833 /nfs/dbraw/zinc/84/48/33/930844833.db2.gz PRVGWXLOXGUXNT-UHFFFAOYSA-N 0 3 410.481 4.258 20 0 HIADHN COC(=O)CCC1CCN([C@H](C)C(=O)N[C@H](C)c2ccc(Cl)cc2Cl)CC1 ZINC000531001639 930880967 /nfs/dbraw/zinc/88/09/67/930880967.db2.gz UBPHYPIMOBSRNQ-ZIAGYGMSSA-N 0 3 415.361 4.224 20 0 HIADHN Cc1nnc(-c2cccc(C(=O)N(CCN3CCCC3)Cc3ccc(Cl)cc3)c2)o1 ZINC000531054291 930899242 /nfs/dbraw/zinc/89/92/42/930899242.db2.gz INQYEEGQOXDRNC-UHFFFAOYSA-N 0 3 424.932 4.437 20 0 HIADHN O=C(CN[C@@H](c1ccccc1)C(F)(F)F)N(CCN1CCCC1)c1ccccc1 ZINC000531059661 930901622 /nfs/dbraw/zinc/90/16/22/930901622.db2.gz LUKAMNKKSOFTML-NRFANRHFSA-N 0 3 405.464 4.009 20 0 HIADHN CC(C)c1c(C(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)cnn1-c1ccccn1 ZINC000531066965 930904521 /nfs/dbraw/zinc/90/45/21/930904521.db2.gz TWABINIUWGMXMI-OAQYLSRUSA-N 0 3 417.557 4.127 20 0 HIADHN CC[C@H](CNC(=O)c1cc(-c2ccccc2)c(C)[nH]c1=O)N1CCc2ccccc2C1 ZINC000531163549 930950025 /nfs/dbraw/zinc/95/00/25/930950025.db2.gz GOLNAGFRBNUZLD-JOCHJYFZSA-N 0 3 415.537 4.329 20 0 HIADHN O=C(CC1(N2CCOCC2)CCCC1)Nc1ccc(Cn2cnc3ccccc32)cc1 ZINC000531287716 931002938 /nfs/dbraw/zinc/00/29/38/931002938.db2.gz ILSXJAAOAPKLAK-UHFFFAOYSA-N 0 3 418.541 4.058 20 0 HIADHN CN(C)Cc1ccc(-c2noc(-c3cc(F)ccc3I)n2)cc1 ZINC000531349129 931026688 /nfs/dbraw/zinc/02/66/88/931026688.db2.gz PQGSTINJNORFRH-UHFFFAOYSA-N 0 3 423.229 4.209 20 0 HIADHN CCCC(=O)Nc1ccc(CNCc2ccc(OC)c3oc(C(=O)OC)cc32)cc1 ZINC000531381340 931038890 /nfs/dbraw/zinc/03/88/90/931038890.db2.gz NZRYOFLRALPDOY-UHFFFAOYSA-N 0 3 410.470 4.256 20 0 HIADHN Cc1[nH]c(=O)c(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)cc1-c1ccccc1 ZINC000531407835 931046321 /nfs/dbraw/zinc/04/63/21/931046321.db2.gz YBLIVBOKXVJSCO-OAQYLSRUSA-N 0 3 401.510 4.157 20 0 HIADHN O=C(Nc1cc(F)ccc1OCC(F)(F)F)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000531461305 931066127 /nfs/dbraw/zinc/06/61/27/931066127.db2.gz OBFNBBCDMWBPLL-INIZCTEOSA-N 0 3 411.399 4.163 20 0 HIADHN C[C@H](O)C[C@H](CNCc1nc(-c2cccc(Br)c2)c[nH]1)c1ccccc1 ZINC000531582089 931109267 /nfs/dbraw/zinc/10/92/67/931109267.db2.gz WIMZRZGLSPIIBP-MAUKXSAKSA-N 0 3 414.347 4.484 20 0 HIADHN C[C@H]1CN([C@H](CNCc2cnc(C3CC3)s2)c2c(F)cccc2Cl)CCO1 ZINC000531630197 931132471 /nfs/dbraw/zinc/13/24/71/931132471.db2.gz WXMDUABMOPYPPB-SCLBCKFNSA-N 0 3 409.958 4.365 20 0 HIADHN CN1CCN(c2ncc(CN[C@@H](CCCc3ccccc3)c3ccccc3)cn2)CC1 ZINC000531631650 931133962 /nfs/dbraw/zinc/13/39/62/931133962.db2.gz JDUNWOHTDFZADV-VWLOTQADSA-N 0 3 415.585 4.082 20 0 HIADHN C[C@H](NC[C@@H](c1cccs1)N1CCN(C)CC1)c1sccc1Br ZINC000531677412 931147861 /nfs/dbraw/zinc/14/78/61/931147861.db2.gz VXSWTDGBJNVTLI-ZFWWWQNUSA-N 0 3 414.438 4.211 20 0 HIADHN CC(C)c1ccc([C@@H](C)NCc2cccc(NC(=O)CCN3CCOCC3)c2)cc1 ZINC000531683861 931152038 /nfs/dbraw/zinc/15/20/38/931152038.db2.gz KGBYEHHOSDIHBB-HXUWFJFHSA-N 0 3 409.574 4.322 20 0 HIADHN c1ccc(-c2nc3c(s2)[C@@H](NCc2ccc(N4CCOCC4)nc2)CCC3)cc1 ZINC000531689494 931154061 /nfs/dbraw/zinc/15/40/61/931154061.db2.gz JSUCEWDNANSFIG-IBGZPJMESA-N 0 3 406.555 4.209 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)NCc2cccc(NC(=O)[C@@H]3CCCO3)c2)cc1 ZINC000531695447 931158446 /nfs/dbraw/zinc/15/84/46/931158446.db2.gz VFNIEAQNMJFGKM-SBUREZEXSA-N 0 3 404.514 4.149 20 0 HIADHN COc1ccc([C@H](C)NCc2ccccc2N2CCOCC2)cc1Br ZINC000531697554 931161480 /nfs/dbraw/zinc/16/14/80/931161480.db2.gz KUYSPUCHYILWHO-HNNXBMFYSA-N 0 3 405.336 4.145 20 0 HIADHN Cc1ccc(OC(F)F)c([C@H](C)N[C@@H](CN2CCN(C)CC2)c2ccccc2)c1 ZINC000531710731 931169738 /nfs/dbraw/zinc/16/97/38/931169738.db2.gz VNIOGUXPMOJEOW-RXVVDRJESA-N 0 3 403.517 4.236 20 0 HIADHN COCCOc1cc2c(cc1CNCCc1nc3cc(Cl)ccc3s1)OCO2 ZINC000531777877 931192612 /nfs/dbraw/zinc/19/26/12/931192612.db2.gz DBCMAFICJNCZKL-UHFFFAOYSA-N 0 3 420.918 4.036 20 0 HIADHN CN(CC1(CO)COC1)[C@@H](c1ccc(Cl)cc1)c1ccc(Br)cc1 ZINC000531802255 931204603 /nfs/dbraw/zinc/20/46/03/931204603.db2.gz DGDDCXLJEZLCFZ-GOSISDBHSA-N 0 3 410.739 4.133 20 0 HIADHN CN(C)Cc1ccc(-c2noc(CCc3nnc(-c4ccc(Cl)cc4)o3)n2)cc1 ZINC000531883504 931234404 /nfs/dbraw/zinc/23/44/04/931234404.db2.gz CXIJRHSLCQHPPA-UHFFFAOYSA-N 0 3 409.877 4.287 20 0 HIADHN COc1ccc([C@@H](C)NCc2ccccc2CN2CCCC2=O)cc1Br ZINC000531940747 931254981 /nfs/dbraw/zinc/25/49/81/931254981.db2.gz HOOSDXGEGDKDIR-OAHLLOKOSA-N 0 3 417.347 4.431 20 0 HIADHN CC(C)C[C@H](N[C@@H](C)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccccc1 ZINC000531947483 931259619 /nfs/dbraw/zinc/25/96/19/931259619.db2.gz OXPNCHXMNMXRMT-CVDCTZTESA-N 0 3 416.587 4.146 20 0 HIADHN COc1c(Br)cc(Br)cc1CN[C@H]1CCCc2cn[nH]c21 ZINC000531952362 931262086 /nfs/dbraw/zinc/26/20/86/931262086.db2.gz ULWAEMVFTBJOKJ-ZDUSSCGKSA-N 0 3 415.129 4.111 20 0 HIADHN C[C@H](NCc1ccc(NC(=O)c2cccnc2)cc1)c1ccc2c(c1)CCC(=O)N2 ZINC000531964182 931267548 /nfs/dbraw/zinc/26/75/48/931267548.db2.gz ROFIBULURQADKQ-INIZCTEOSA-N 0 3 400.482 4.069 20 0 HIADHN COc1ccc(OC)c(NC(=O)C[C@H](C)NCc2ccc(Oc3ccccc3)nc2)c1 ZINC000531963863 931267754 /nfs/dbraw/zinc/26/77/54/931267754.db2.gz GXAZFKUQXREODW-KRWDZBQOSA-N 0 3 421.497 4.398 20 0 HIADHN CC(C)(C)OC(=O)C[C@H]1CCCN(C[C@@H](O)COc2c(Cl)cccc2Cl)C1 ZINC000532125176 931322481 /nfs/dbraw/zinc/32/24/81/931322481.db2.gz FXZHHMPVFJLAIX-HUUCEWRRSA-N 0 3 418.361 4.177 20 0 HIADHN CC(C)(C)OC(=O)C[C@@H]1CCCN(C(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)C1 ZINC000532126367 931322827 /nfs/dbraw/zinc/32/28/27/931322827.db2.gz BGDZHFKEGKRXMN-VQTJNVASSA-N 0 3 418.553 4.008 20 0 HIADHN CCC[C@@H](NCc1cnc(N2CCN(C)CC2)nc1)c1ccc(Cl)c(Cl)c1 ZINC000532138845 931327089 /nfs/dbraw/zinc/32/70/89/931327089.db2.gz KBGFBMLJDQMGJJ-LJQANCHMSA-N 0 3 408.377 4.166 20 0 HIADHN Cc1ccc(NC(=O)c2ccc(F)c(I)c2)c(CN(C)C)c1 ZINC000532168184 931335091 /nfs/dbraw/zinc/33/50/91/931335091.db2.gz STJNPOUNMHBMGJ-UHFFFAOYSA-N 0 3 412.246 4.053 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@@H](C)N[C@@H]2CCc3c2cccc3OC)cc1 ZINC000532187118 931341048 /nfs/dbraw/zinc/34/10/48/931341048.db2.gz KFGMMITTWHLXKB-IIBYNOLFSA-N 0 3 402.560 4.064 20 0 HIADHN C[C@H](NCc1ccc(C(=O)N2CCOCC2)cc1)c1ccc(-c2ccncc2)cc1 ZINC000532209730 931352171 /nfs/dbraw/zinc/35/21/71/931352171.db2.gz REVFTBDPXKDBGW-IBGZPJMESA-N 0 3 401.510 4.072 20 0 HIADHN Cc1nc(-c2ccccc2)sc1[C@@H](C)NCc1ccc(C(=O)N2CCOCC2)cc1 ZINC000532209505 931352346 /nfs/dbraw/zinc/35/23/46/931352346.db2.gz LMTFBYSUKLPUPW-QGZVFWFLSA-N 0 3 421.566 4.442 20 0 HIADHN CC[C@@H](N[C@@H](CC)c1ccc2c(c1)OCCO2)c1ccccc1OCC(=O)N(C)C ZINC000532211785 931353822 /nfs/dbraw/zinc/35/38/22/931353822.db2.gz IMMDSVBETBYTMR-VQTJNVASSA-N 0 3 412.530 4.117 20 0 HIADHN C[C@@H](CC(=O)N(C)Cc1cccc(Cl)c1)NCc1ccc(OCC2CC2)nc1 ZINC000532219017 931358121 /nfs/dbraw/zinc/35/81/21/931358121.db2.gz UCDBLQYKWGSRAM-INIZCTEOSA-N 0 3 401.938 4.051 20 0 HIADHN CC[C@@H](C(=O)N[C@H](C)c1sc(-c2ccccc2Br)nc1C)N(C)C ZINC000532226260 931361817 /nfs/dbraw/zinc/36/18/17/931361817.db2.gz RKCPGXQVVXZUJO-ABAIWWIYSA-N 0 3 410.381 4.398 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)NCCc2nc3cc(Cl)ccc3s2)o1 ZINC000532295965 931389528 /nfs/dbraw/zinc/38/95/28/931389528.db2.gz LQGBJOGOTSJERQ-UHFFFAOYSA-N 0 3 420.966 4.167 20 0 HIADHN CC(C)(C)[C@@H](NC(=O)[C@H]1CCCN(Cc2cccnc2)C1)c1ccc(F)cc1F ZINC000532339119 931400238 /nfs/dbraw/zinc/40/02/38/931400238.db2.gz JHNSDMJFBJTNKV-UWJYYQICSA-N 0 3 401.501 4.475 20 0 HIADHN C[C@@H](CC[S@](C)=O)NCc1cc(Br)ccc1OCc1ccccc1 ZINC000532374739 931414792 /nfs/dbraw/zinc/41/47/92/931414792.db2.gz WCPFUNCJIGIKDQ-OWJWWREXSA-N 0 3 410.377 4.275 20 0 HIADHN COc1cc(C(=O)N(C)[C@H]2CCN(C3CC3)C2)ccc1OCc1ccc(Cl)cc1 ZINC000532403673 931423482 /nfs/dbraw/zinc/42/34/82/931423482.db2.gz YYEGCOXOQULOBX-FQEVSTJZSA-N 0 3 414.933 4.236 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@@H](C)N[C@@H](C)c2ccc3c(c2)COC3)cc1 ZINC000532441176 931435443 /nfs/dbraw/zinc/43/54/43/931435443.db2.gz WDCSDRFCHIOLCV-SJORKVTESA-N 0 3 402.560 4.159 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1cnc(C2CC2)s1 ZINC000532456494 931443834 /nfs/dbraw/zinc/44/38/34/931443834.db2.gz XGMFFXQEKFJFRG-GOSISDBHSA-N 0 3 407.543 4.225 20 0 HIADHN Cc1nc(C(C)(C)C)sc1[C@@H](C)NCc1ccc(CS(=O)(=O)NC(C)C)cc1 ZINC000532466228 931447820 /nfs/dbraw/zinc/44/78/20/931447820.db2.gz HLMUFSHJTCXTPG-OAHLLOKOSA-N 0 3 423.648 4.428 20 0 HIADHN CC(C)NS(=O)(=O)Cc1ccc(CN[C@H](C)c2ccc(C(F)(F)F)cc2)cc1 ZINC000532468086 931448487 /nfs/dbraw/zinc/44/84/87/931448487.db2.gz ZXXDVIJBUXEQTF-OAHLLOKOSA-N 0 3 414.493 4.384 20 0 HIADHN CC(C)NS(=O)(=O)Cc1ccc(CN[C@@H](C)c2ccccc2C(F)(F)F)cc1 ZINC000532467751 931448796 /nfs/dbraw/zinc/44/87/96/931448796.db2.gz HHFNWVPJXWMQRG-HNNXBMFYSA-N 0 3 414.493 4.384 20 0 HIADHN CC(C)COc1ccc([C@@H](C)NCc2ccccc2CS(=O)(=O)NC(C)C)cc1 ZINC000532482848 931456644 /nfs/dbraw/zinc/45/66/44/931456644.db2.gz SYSZPZMKAXHEOB-LJQANCHMSA-N 0 3 418.603 4.400 20 0 HIADHN CCCN(Cc1ccc(F)cc1)Cc1cc(=O)n2cc(Br)ccc2n1 ZINC000532489625 931458078 /nfs/dbraw/zinc/45/80/78/931458078.db2.gz NMUGFRYKLAODOV-UHFFFAOYSA-N 0 3 404.283 4.008 20 0 HIADHN Cc1cc(NC(=O)Cc2ccc(C)c(C)c2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000532513682 931469895 /nfs/dbraw/zinc/46/98/95/931469895.db2.gz VYCCAIBDLSKEDX-HSZRJFAPSA-N 0 3 402.542 4.437 20 0 HIADHN COc1ccc([C@H](N[C@@H](C)CCc2ccco2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000532531120 931512466 /nfs/dbraw/zinc/51/24/66/931512466.db2.gz OHUXYQNEKPSYKF-SBUREZEXSA-N 0 3 413.539 4.392 20 0 HIADHN CCOC(=O)c1oc2ccc(Br)cc2c1CN(C)C[C@@H]1CCCOC1 ZINC000532556636 931522618 /nfs/dbraw/zinc/52/26/18/931522618.db2.gz SOSFSHCBTPIZQF-ZDUSSCGKSA-N 0 3 410.308 4.230 20 0 HIADHN C[C@H](NCc1cnn(Cc2ccccc2)c1)[C@H](OC1CCOCC1)c1ccccc1 ZINC000532615535 931555084 /nfs/dbraw/zinc/55/50/84/931555084.db2.gz DLBOMOKSBDFKIF-CPJSRVTESA-N 0 3 405.542 4.346 20 0 HIADHN Cc1cc(NC(=O)C2CCN(Cc3ccc(OCc4ccccc4)cc3)CC2)no1 ZINC000532655984 931571676 /nfs/dbraw/zinc/57/16/76/931571676.db2.gz IISHNXLEYFXUIQ-UHFFFAOYSA-N 0 3 405.498 4.413 20 0 HIADHN CN(C)C(=O)[C@@H](c1ccccc1)N1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1 ZINC000532685728 931584487 /nfs/dbraw/zinc/58/44/87/931584487.db2.gz KECYEFMGRQPZOA-UYAOXDASSA-N 0 3 424.932 4.399 20 0 HIADHN O=C(CN[C@H](c1ccccc1)C1CCC1)N1CCC[C@H]1c1ccc2c(c1)OCCO2 ZINC000532701623 931595295 /nfs/dbraw/zinc/59/52/95/931595295.db2.gz MFPJOOITYZSATJ-SQJMNOBHSA-N 0 3 406.526 4.252 20 0 HIADHN COc1ccc2cc(CNc3ccc4nc(CCN5CCOCC5)[nH]c4c3)ccc2c1 ZINC000532729584 931614571 /nfs/dbraw/zinc/61/45/71/931614571.db2.gz HRTKVOSIQMNGJZ-UHFFFAOYSA-N 0 3 416.525 4.212 20 0 HIADHN Clc1cccc(CNc2ccc3nc(CCN4CCOCC4)[nH]c3c2)c1Cl ZINC000532889868 931681172 /nfs/dbraw/zinc/68/11/72/931681172.db2.gz SZVINYOTBVZQHT-UHFFFAOYSA-N 0 3 405.329 4.357 20 0 HIADHN O=C(CC1CCCC1)NC1CCN(Cc2ccc(OCc3ccncc3)cc2)CC1 ZINC000532960316 931713547 /nfs/dbraw/zinc/71/35/47/931713547.db2.gz MAKYKJNAMLARGK-UHFFFAOYSA-N 0 3 407.558 4.322 20 0 HIADHN C[C@H](O)CN(CC(=O)Nc1cccc(CSc2ccccn2)c1)C1CCCCC1 ZINC000532966486 931717148 /nfs/dbraw/zinc/71/71/48/931717148.db2.gz MWSYDBGYWUCZRI-SFHVURJKSA-N 0 3 413.587 4.328 20 0 HIADHN C[C@@H](c1cccc(NC(=O)c2ccccc2)c1)N(C)C(=O)CN1C[C@@H]2[C@H](C1)C2(C)C ZINC000532974524 931722258 /nfs/dbraw/zinc/72/22/58/931722258.db2.gz SGFDRWXIAAMDGH-BULFRSBZSA-N 0 3 405.542 4.046 20 0 HIADHN CC(C)N1CCN([C@H]2CCN(Cc3csc(-c4ccc(Cl)cc4)n3)C2)CC1 ZINC000532986599 931726914 /nfs/dbraw/zinc/72/69/14/931726914.db2.gz HAGNRHQHGJDMKD-FQEVSTJZSA-N 0 3 405.011 4.064 20 0 HIADHN Cc1[nH]c(=O)c(C(=O)NC2CCN([C@H](C)c3ccncc3)CC2)cc1-c1ccccc1 ZINC000533048004 931752937 /nfs/dbraw/zinc/75/29/37/931752937.db2.gz CRWLEIWFWCWKNV-GOSISDBHSA-N 0 3 416.525 4.113 20 0 HIADHN CN(CC(=O)Nc1ccccc1Cl)C(=O)CN[C@H](c1ccccc1)C1CCCC1 ZINC000533062576 931760007 /nfs/dbraw/zinc/76/00/07/931760007.db2.gz SUTSJSYMEYWWEU-HSZRJFAPSA-N 0 3 413.949 4.258 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccnc2)C1)N1CCC[C@@H](Oc2ccccc2Cl)C1 ZINC000533109540 931773046 /nfs/dbraw/zinc/77/30/46/931773046.db2.gz BEBINNPOQUXLPU-WOJBJXKFSA-N 0 3 413.949 4.017 20 0 HIADHN COc1ccc([C@@H](CNC(=O)Nc2cccc(-c3ncco3)c2)N2CCCC2)cc1 ZINC000533161499 931794422 /nfs/dbraw/zinc/79/44/22/931794422.db2.gz FDJLZCMJJXZQNQ-OAQYLSRUSA-N 0 3 406.486 4.309 20 0 HIADHN CC(C)[C@@H](NCC(=O)N(C)CC(=O)Nc1ccccc1C(F)(F)F)c1ccccc1 ZINC000533229986 931815062 /nfs/dbraw/zinc/81/50/62/931815062.db2.gz VDMQHMMUBCKLRF-OAQYLSRUSA-N 0 3 421.463 4.089 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)CO[C@H]1CCC[C@@H](C)C1 ZINC000533231109 931815074 /nfs/dbraw/zinc/81/50/74/931815074.db2.gz DFKXDNPKXAFCDF-QIJUGHKUSA-N 0 3 410.562 4.172 20 0 HIADHN O=C(CN(Cc1ccccc1)CC1CCOCC1)Nc1ccc(Br)cc1 ZINC000533287322 931828184 /nfs/dbraw/zinc/82/81/84/931828184.db2.gz XSXFAWFFVNWMSS-UHFFFAOYSA-N 0 3 417.347 4.316 20 0 HIADHN CCCCN(CC(=O)N1CCC(NC(=O)c2ccccc2)CC1)[C@@H](C)c1ccccc1 ZINC000533290021 931829990 /nfs/dbraw/zinc/82/99/90/931829990.db2.gz LPAXZIZXELVFGA-NRFANRHFSA-N 0 3 421.585 4.271 20 0 HIADHN CCN(CC(=O)N[C@H](C)c1ccccc1)C1CCN(c2cc(C)nc(C(C)C)n2)CC1 ZINC000533395374 931856618 /nfs/dbraw/zinc/85/66/18/931856618.db2.gz UECGGOFUILLLHB-HXUWFJFHSA-N 0 3 423.605 4.077 20 0 HIADHN O=C(CN(Cc1ccc2c(c1)CCO2)C1CCCC1)N1CCC[C@@H](C(F)(F)F)C1 ZINC000533410980 931861141 /nfs/dbraw/zinc/86/11/41/931861141.db2.gz OEDNQLMJAORRSH-GOSISDBHSA-N 0 3 410.480 4.167 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@H](C)NCc2cnc(CC(C)C)s2)CC1 ZINC000533446548 931871885 /nfs/dbraw/zinc/87/18/85/931871885.db2.gz OLJANMJPIIKWCO-KRWDZBQOSA-N 0 3 404.599 4.473 20 0 HIADHN O=C(CN[C@H](Cc1ccccc1)c1ccccc1)NCCc1cnn(-c2ccccc2)c1 ZINC000533480315 931879972 /nfs/dbraw/zinc/87/99/72/931879972.db2.gz ROFZUGVCKOOSBY-AREMUKBSSA-N 0 3 424.548 4.105 20 0 HIADHN O=C(CN[C@H](c1ccc(F)cc1)C1CCC1)Nc1cc(Cl)ccc1-n1cncn1 ZINC000533505871 931887345 /nfs/dbraw/zinc/88/73/45/931887345.db2.gz LHYOTDZSLSVZNK-NRFANRHFSA-N 0 3 413.884 4.129 20 0 HIADHN Cc1nc(CN[C@@H]2CCCC[C@H](N3C(=O)c4ccccc4C3=O)C2)nc2ccccc12 ZINC000533548204 931898328 /nfs/dbraw/zinc/89/83/28/931898328.db2.gz GEKQBAIYODMUEP-MSOLQXFVSA-N 0 3 414.509 4.025 20 0 HIADHN CCN(CCc1nccs1)C(=O)N[C@@H](CN1CCc2ccccc2C1)C(C)(C)C ZINC000533621721 931929277 /nfs/dbraw/zinc/92/92/77/931929277.db2.gz HMDWTXUGNPYRTI-FQEVSTJZSA-N 0 3 414.619 4.190 20 0 HIADHN COc1ccc(C(=O)N[C@H](CN2CCCC2)c2ccccc2)cc1-c1ccccn1 ZINC000533657136 931951562 /nfs/dbraw/zinc/95/15/62/931951562.db2.gz XDUHMFXZPVYNLC-HSZRJFAPSA-N 0 3 401.510 4.324 20 0 HIADHN Cc1cnc(CCN(C)C(=O)N[C@H](CN2CCc3ccccc3C2)C(C)(C)C)s1 ZINC000533661709 931955651 /nfs/dbraw/zinc/95/56/51/931955651.db2.gz NRFNAXJRKBVMLG-HXUWFJFHSA-N 0 3 414.619 4.108 20 0 HIADHN C[C@@H]1C[C@H](N(C)S(=O)(=O)Cc2ccc(F)c(Cl)c2)CCN1Cc1ccccc1 ZINC000533697619 931975610 /nfs/dbraw/zinc/97/56/10/931975610.db2.gz SCXVTFUDKOBNOE-VQIMIIECSA-N 0 3 424.969 4.294 20 0 HIADHN C[C@H](NCc1cnc([C@@H]2CCCO2)s1)[C@H](OC1CCOCC1)c1ccccc1 ZINC000533756621 932012583 /nfs/dbraw/zinc/01/25/83/932012583.db2.gz NDAHIDUPYHPVSK-NDXORKPFSA-N 0 3 402.560 4.410 20 0 HIADHN COc1ccccc1[C@@H](C)N(C)C(=O)CN1CCC[C@@H]1Cn1c(C)nc2ccccc21 ZINC000533758177 932014549 /nfs/dbraw/zinc/01/45/49/932014549.db2.gz BONZTNVHNRSRIW-UYAOXDASSA-N 0 3 420.557 4.037 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N1CCC[C@@H]1Cn1cnc2ccccc21 ZINC000533767212 932021333 /nfs/dbraw/zinc/02/13/33/932021333.db2.gz OHOIOXWSNOAJAZ-WIYYLYMNSA-N 0 3 423.586 4.109 20 0 HIADHN CN(C)[C@H](CNC(=O)N[C@@H]1CCSc2ccc(Cl)cc21)Cc1ccccc1 ZINC000533810120 932042416 /nfs/dbraw/zinc/04/24/16/932042416.db2.gz BMWIEKFGOYSXGK-PKOBYXMFSA-N 0 3 403.979 4.349 20 0 HIADHN Cc1nc(-c2ccccc2)sc1CNC(=O)NC[C@@H](Cc1ccccc1)N(C)C ZINC000533811710 932043169 /nfs/dbraw/zinc/04/31/69/932043169.db2.gz RRKXFDDRMIFNLQ-HXUWFJFHSA-N 0 3 408.571 4.091 20 0 HIADHN Cc1n[nH]c(C)c1[C@@H](C)CC(=O)N(CCN(C)C)Cc1ccc(C(F)(F)F)cc1 ZINC000533872554 932073958 /nfs/dbraw/zinc/07/39/58/932073958.db2.gz OXZQSAJJNFDARH-AWEZNQCLSA-N 0 3 410.484 4.129 20 0 HIADHN CN1CC[C@H](NC(=O)NCc2nc3cc(Cl)ccc3s2)[C@H]1c1ccccc1 ZINC000533893426 932085543 /nfs/dbraw/zinc/08/55/43/932085543.db2.gz XCAFVZXEWVSTEE-HNAYVOBHSA-N 0 3 400.935 4.194 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)c2cc(F)ccc2I)c1 ZINC000533970782 932148650 /nfs/dbraw/zinc/14/86/50/932148650.db2.gz UIUILVVUAKIOCG-UHFFFAOYSA-N 0 3 412.246 4.053 20 0 HIADHN COc1ccc(C[C@H](C)CNC(=O)N(Cc2ccccc2)C2CCN(C)CC2)cc1 ZINC000533984676 932162045 /nfs/dbraw/zinc/16/20/45/932162045.db2.gz FECCLZBYQZHYKJ-FQEVSTJZSA-N 0 3 409.574 4.180 20 0 HIADHN CN1CC[C@H](NC(=O)CCc2ncc(-c3ccccc3Cl)o2)[C@@H]1c1ccccc1 ZINC000534018315 932199173 /nfs/dbraw/zinc/19/91/73/932199173.db2.gz CGICVGDNUJYYLT-CVDCTZTESA-N 0 3 409.917 4.489 20 0 HIADHN CN1CC[C@H](NC(=O)Cc2ccc(NC(=O)CC(C)(C)C)cc2)[C@H]1c1ccccc1 ZINC000534021186 932202861 /nfs/dbraw/zinc/20/28/61/932202861.db2.gz WLBYSMVSOZCVEF-XUZZJYLKSA-N 0 3 407.558 4.165 20 0 HIADHN CCN(C(=O)c1cccc(OCC(F)F)n1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000534077620 932255466 /nfs/dbraw/zinc/25/54/66/932255466.db2.gz LCMNGJULHUVXPC-WMZOPIPTSA-N 0 3 403.473 4.023 20 0 HIADHN CC(C)Cn1ncc(NC(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)c1C(F)F ZINC000534089629 932269632 /nfs/dbraw/zinc/26/96/32/932269632.db2.gz QFANRTWHWJWSFH-DOTOQJQBSA-N 0 3 405.493 4.261 20 0 HIADHN CC(C)Cn1ncc(NC(=O)NC[C@H](c2ccccc2)N2CCCC2)c1C(F)F ZINC000534090713 932272516 /nfs/dbraw/zinc/27/25/16/932272516.db2.gz WXFIWYXWTIAKTB-GOSISDBHSA-N 0 3 405.493 4.435 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cc(C)n(C(F)F)n1)c1ccc(C(F)(F)F)cc1 ZINC000534150945 932303761 /nfs/dbraw/zinc/30/37/61/932303761.db2.gz PCRQAPPOHCZAQH-MRXNPFEDSA-N 0 3 418.410 4.418 20 0 HIADHN O=C(N[C@H]1CCN(Cc2ccccc2)C[C@@H]1CO)c1cccc(OC2CCCCC2)c1 ZINC000534181966 932319535 /nfs/dbraw/zinc/31/95/35/932319535.db2.gz LJJNEYBAMZXUOM-RDGATRHJSA-N 0 3 422.569 4.011 20 0 HIADHN CN(C)CCN(Cc1cccc(O)c1)C(=O)[C@H]1C[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000534190411 932323052 /nfs/dbraw/zinc/32/30/52/932323052.db2.gz DPJUCOPCSPTJBY-UXHICEINSA-N 0 3 406.448 4.105 20 0 HIADHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)NC1CCC(F)(F)CC1 ZINC000534203519 932329067 /nfs/dbraw/zinc/32/90/67/932329067.db2.gz YHYOXZKAEWFHKR-UHFFFAOYSA-N 0 3 418.326 4.100 20 0 HIADHN COc1ccc(CN2CCC(C(=O)NCC(F)(F)F)CC2)cc1OCCC(C)C ZINC000534342270 932387362 /nfs/dbraw/zinc/38/73/62/932387362.db2.gz GQOPBXOQSQLCIM-UHFFFAOYSA-N 0 3 416.484 4.011 20 0 HIADHN Cc1c(C(=O)N(C)C2CCN(CCc3ccccn3)CC2)cccc1-c1ccccn1 ZINC000534358810 932393239 /nfs/dbraw/zinc/39/32/39/932393239.db2.gz MQPNSTKPNYRWJH-UHFFFAOYSA-N 0 3 414.553 4.231 20 0 HIADHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc(Br)cc(C(F)(F)F)c1 ZINC000534405561 932428051 /nfs/dbraw/zinc/42/80/51/932428051.db2.gz LOPKGKYXEVUZOX-CABCVRRESA-N 0 3 405.258 4.167 20 0 HIADHN O=C([C@@H]1CC[C@@H]2CCCC[C@H]2C1)N1CCC[C@H](CN2CCN(c3ccccn3)CC2)C1 ZINC000534426468 932442852 /nfs/dbraw/zinc/44/28/52/932442852.db2.gz MJAUGLKBEWLNRB-NAVOZUGXSA-N 0 3 424.633 4.049 20 0 HIADHN O=C([C@H]1CCCN(Cc2cccc(F)c2)C1)N1CCC[C@@H]1Cn1cnc2ccccc21 ZINC000534458592 932475657 /nfs/dbraw/zinc/47/56/57/932475657.db2.gz AQOCWRSRQMBOND-RBBKRZOGSA-N 0 3 420.532 4.079 20 0 HIADHN Cc1ccc(NC(=O)NC[C@@H](Cc2ccccc2)N(C)C)cc1NC(=O)C(C)(C)C ZINC000534525327 932545550 /nfs/dbraw/zinc/54/55/50/932545550.db2.gz LGMMNYMJVYAXEG-HXUWFJFHSA-N 0 3 410.562 4.274 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)c2cccc(-c3c(F)cccc3F)c2)CC1 ZINC000534556900 932562965 /nfs/dbraw/zinc/56/29/65/932562965.db2.gz UDNPNHSHGYLPJV-UHFFFAOYSA-N 0 3 402.485 4.251 20 0 HIADHN Cc1cc(Cl)cc(C)c1CNCc1ccc(C(=O)N2C[C@H](C)O[C@@H](C)C2)cc1 ZINC000534560856 932565081 /nfs/dbraw/zinc/56/50/81/932565081.db2.gz KSFHTUIIMYLCCP-ROUUACIJSA-N 0 3 400.950 4.496 20 0 HIADHN O=C(c1cccc(CN2CCCC2)c1)N1CCN(c2ccc(F)cc2Cl)CC1 ZINC000534577100 932576122 /nfs/dbraw/zinc/57/61/22/932576122.db2.gz XTUBYJNXTOXSLV-UHFFFAOYSA-N 0 3 401.913 4.037 20 0 HIADHN FC(F)(F)c1cccc(OCCNCc2ccccc2OCc2cccnc2)n1 ZINC000534611870 932596199 /nfs/dbraw/zinc/59/61/99/932596199.db2.gz JRAAXSSGDLZLKK-UHFFFAOYSA-N 0 3 403.404 4.243 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)c1ccc(C(=O)Nc2ccccc2)cc1 ZINC000534634685 932610332 /nfs/dbraw/zinc/61/03/32/932610332.db2.gz VNAMAHSVANROOD-UHFFFAOYSA-N 0 3 413.521 4.117 20 0 HIADHN O=C(Nc1ccc2[nH]c(-c3ccccc3Cl)nc2c1)[C@H]1CCCN1C1CCOCC1 ZINC000534702242 932673395 /nfs/dbraw/zinc/67/33/95/932673395.db2.gz OGXZHKAVJBORFO-OAQYLSRUSA-N 0 3 424.932 4.465 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)c2ccc(CNC(=O)c3cccs3)cc2)c1 ZINC000534703272 932673979 /nfs/dbraw/zinc/67/39/79/932673979.db2.gz XOQJFBQCDUDQAE-UHFFFAOYSA-N 0 3 407.539 4.300 20 0 HIADHN COc1ccc(-c2noc(CCCC(=O)Nc3cc(C)cc(CN(C)C)c3)n2)cc1 ZINC000534703910 932674873 /nfs/dbraw/zinc/67/48/73/932674873.db2.gz CUQPIFOVRQDIQD-UHFFFAOYSA-N 0 3 408.502 4.077 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)CCn2ccc3cc(Cl)ccc32)CC1 ZINC000534717576 932685342 /nfs/dbraw/zinc/68/53/42/932685342.db2.gz ZAUVPDZSWDXLPC-KRWDZBQOSA-N 0 3 410.949 4.422 20 0 HIADHN COc1ccc(CN(C(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)[C@@H](C)C2CC2)cc1 ZINC000534719574 932686880 /nfs/dbraw/zinc/68/68/80/932686880.db2.gz AEQFBVGJXVSWCY-NTUVXCKYSA-N 0 3 407.558 4.451 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)N1CC[C@@H](Oc2cccc(Cl)c2)C1 ZINC000534777435 932758858 /nfs/dbraw/zinc/75/88/58/932758858.db2.gz TUKSLXXYKPSPRV-GOSISDBHSA-N 0 3 403.910 4.095 20 0 HIADHN COc1ccc(C[C@@H](C)CN(C)[C@@H](C)C(=O)Nc2ccccc2OC(F)F)cc1 ZINC000534913509 932836319 /nfs/dbraw/zinc/83/63/19/932836319.db2.gz ZMLHJSQKBVKEPR-CVEARBPZSA-N 0 3 406.473 4.434 20 0 HIADHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)Nc1scnc1C1CC1 ZINC000534984207 932875225 /nfs/dbraw/zinc/87/52/25/932875225.db2.gz DLSPVSMWTKQWIT-UHFFFAOYSA-N 0 3 423.380 4.379 20 0 HIADHN CC(C)c1nn(-c2ccc(Br)cc2)cc1CNCCOC[C@@H]1CCCO1 ZINC000535001413 932883145 /nfs/dbraw/zinc/88/31/45/932883145.db2.gz MYUBJSNCOCWUEK-IBGZPJMESA-N 0 3 422.367 4.043 20 0 HIADHN CC(C)N(Cc1ccccn1)C(=O)N[C@H](CN1CCc2ccccc2C1)C(C)(C)C ZINC000535081997 932899396 /nfs/dbraw/zinc/89/93/96/932899396.db2.gz GSKGJGYIYISFHL-HSZRJFAPSA-N 0 3 408.590 4.475 20 0 HIADHN c1[nH]nc(-c2ccc3c(c2)OCCO3)c1CN1CCC(OCC2CCCCC2)CC1 ZINC000535083495 932900706 /nfs/dbraw/zinc/90/07/06/932900706.db2.gz KRCTVZPCRIANLD-UHFFFAOYSA-N 0 3 411.546 4.409 20 0 HIADHN Cc1cc(NC(=O)c2cccc(OC(C)C)n2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000535102498 932918253 /nfs/dbraw/zinc/91/82/53/932918253.db2.gz XJTCJKPDIAZGRA-FQEVSTJZSA-N 0 3 419.529 4.073 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)N1CCC[C@H]1Cn1cnc2ccccc21 ZINC000535216643 933022067 /nfs/dbraw/zinc/02/20/67/933022067.db2.gz QKSDOTWYQHEYOB-URXFXBBRSA-N 0 3 417.557 4.047 20 0 HIADHN CN(C)[C@@H](CNC(=O)Nc1ccc(Br)cc1Cl)Cc1ccccc1 ZINC000535254880 933038871 /nfs/dbraw/zinc/03/88/71/933038871.db2.gz FUVSNTBEHDAPOV-OAHLLOKOSA-N 0 3 410.743 4.397 20 0 HIADHN Cc1nn(Cc2ccccc2Cl)c(C)c1C(=O)NC[C@@H](Cc1ccccc1)N(C)C ZINC000535258229 933039930 /nfs/dbraw/zinc/03/99/30/933039930.db2.gz XXCHJPGYHAEOMJ-OAQYLSRUSA-N 0 3 424.976 4.104 20 0 HIADHN CN(C)[C@H](CNC(=O)N1CCC(Oc2ccccc2Cl)CC1)Cc1ccccc1 ZINC000535264581 933042512 /nfs/dbraw/zinc/04/25/12/933042512.db2.gz FUIQVAGYCKPFOX-IBGZPJMESA-N 0 3 415.965 4.066 20 0 HIADHN CC(C)n1cnnc1[C@H]1CCCN(CCC(=O)Nc2cc(Cl)ccc2Cl)C1 ZINC000535271405 933044049 /nfs/dbraw/zinc/04/40/49/933044049.db2.gz UBAHPUQGOZQHJA-AWEZNQCLSA-N 0 3 410.349 4.374 20 0 HIADHN O=C(Nc1ccccc1)c1ccc(C(=O)NC2CCN(Cc3ccccc3)CC2)cc1 ZINC000535328763 933076327 /nfs/dbraw/zinc/07/63/27/933076327.db2.gz DBGRPESHCSZVKP-UHFFFAOYSA-N 0 3 413.521 4.333 20 0 HIADHN COCCSc1ccc([C@H](C)NC(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)cc1 ZINC000535364784 933094338 /nfs/dbraw/zinc/09/43/38/933094338.db2.gz MQKXMIUTTXPJGT-HSQYWUDLSA-N 0 3 413.587 4.231 20 0 HIADHN Cc1cc(C(=O)N2CCN(C3CCCCC3)CC2)ccc1NC(=O)c1cccs1 ZINC000535380063 933104447 /nfs/dbraw/zinc/10/44/47/933104447.db2.gz SLMNKXQODVIDIR-UHFFFAOYSA-N 0 3 411.571 4.399 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)[C@@]23CCC(=O)N2c2cc(Cl)ccc2S3)c1 ZINC000535414201 933124386 /nfs/dbraw/zinc/12/43/86/933124386.db2.gz CBZLBOHZUPKGSR-NRFANRHFSA-N 0 3 415.946 4.278 20 0 HIADHN CCn1c(SCC(=O)Nc2cc(C)cc(CN(C)C)c2)nnc1-c1ccccc1C ZINC000535415695 933125066 /nfs/dbraw/zinc/12/50/66/933125066.db2.gz KSZUTKIRCCMUQB-UHFFFAOYSA-N 0 3 423.586 4.374 20 0 HIADHN COc1ccccc1[C@H](NC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1)c1ccco1 ZINC000535429501 933131126 /nfs/dbraw/zinc/13/11/26/933131126.db2.gz HJLXWKYOFGDCRZ-AJSBUHFISA-N 0 3 405.498 4.122 20 0 HIADHN Cc1cc(C(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)ccc1NC(=O)c1cccs1 ZINC000535470453 933160624 /nfs/dbraw/zinc/16/06/24/933160624.db2.gz WEBOZTFHNZDTHO-UNMCSNQZSA-N 0 3 419.550 4.484 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)CSc1cccc(Br)c1 ZINC000535753876 933376658 /nfs/dbraw/zinc/37/66/58/933376658.db2.gz JBTSBTFGTGICIP-UHFFFAOYSA-N 0 3 409.349 4.250 20 0 HIADHN COc1ccnc2c(NC(=O)N(CCN(C)C)Cc3ccc(F)cc3F)cccc12 ZINC000535770543 933381173 /nfs/dbraw/zinc/38/11/73/933381173.db2.gz QKGFBDUZYGEVCJ-UHFFFAOYSA-N 0 3 414.456 4.117 20 0 HIADHN O=C(NCC(F)(F)F)C1CCN(Cc2cccc(OCc3ccccc3)c2)CC1 ZINC000535785458 933386440 /nfs/dbraw/zinc/38/64/40/933386440.db2.gz FMLJSJIVSRRXFF-UHFFFAOYSA-N 0 3 406.448 4.156 20 0 HIADHN CNC(=O)c1ccc(OC)c(NC(=O)C(Cc2c(C)cc(C)cc2C)C(F)(F)F)c1 ZINC000535895701 933475194 /nfs/dbraw/zinc/47/51/94/933475194.db2.gz ZQWWLSFEDPURCF-QGZVFWFLSA-N 0 3 422.447 4.340 20 0 HIADHN COc1cc(CN[C@@H](C)c2ccc([S@](C)=O)cc2)ccc1OCc1ccncc1 ZINC000535946833 933513530 /nfs/dbraw/zinc/51/35/30/933513530.db2.gz XSGQGBQHNDHVPH-ADKRDUOOSA-N 0 3 410.539 4.257 20 0 HIADHN Cc1cccc(CN(Cc2ccco2)C(=O)NC[C@@H](Cc2ccccc2)N(C)C)c1 ZINC000536014443 933571143 /nfs/dbraw/zinc/57/11/43/933571143.db2.gz UAMMBQNGEQPDJA-HSZRJFAPSA-N 0 3 405.542 4.473 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)[C@@H](C)N[C@@H](c1ccc2c(c1)OCCO2)C1CC1 ZINC000537289735 933699944 /nfs/dbraw/zinc/69/99/44/933699944.db2.gz HSKHHKMTIIZTKZ-LRTDBIEQSA-N 0 3 416.905 4.188 20 0 HIADHN CCCCOC1CCN([C@@H]2CCCN(Cc3cccc(C(F)(F)F)c3)C2=O)CC1 ZINC000537361889 933737915 /nfs/dbraw/zinc/73/79/15/933737915.db2.gz BVEOBMXRMOKMNP-HXUWFJFHSA-N 0 3 412.496 4.478 20 0 HIADHN CCN1CCN(Cc2ccc(N[C@@H](C)c3ccc(NC(=O)NC4CC4)cc3)cc2)CC1 ZINC000537393324 933754705 /nfs/dbraw/zinc/75/47/05/933754705.db2.gz BIKHAHFLDHMEPG-IBGZPJMESA-N 0 3 421.589 4.281 20 0 HIADHN COc1ccc([C@H](C)Nc2ccc(N3CCOCC3)cn2)cc1CN1CCCCC1 ZINC000537393691 933755252 /nfs/dbraw/zinc/75/52/52/933755252.db2.gz FYWVBEHWRMXZQD-IBGZPJMESA-N 0 3 410.562 4.086 20 0 HIADHN Cc1nn(Cc2ccccc2Cl)c(C)c1CN[C@@H]1CCN(c2ncccc2F)C1 ZINC000537396839 933756927 /nfs/dbraw/zinc/75/69/27/933756927.db2.gz QABNOQHGJZVKQV-GOSISDBHSA-N 0 3 413.928 4.104 20 0 HIADHN COc1ccc(OCc2ccccn2)c(CN[C@@H]2CCN(c3ccccc3OC)C2)c1 ZINC000537399336 933758220 /nfs/dbraw/zinc/75/82/20/933758220.db2.gz YNKWOSOUNLVQHI-HXUWFJFHSA-N 0 3 419.525 4.046 20 0 HIADHN Cc1cc(-c2noc([C@@]3(C(F)(F)F)CCN(Cc4ccccc4)C3)n2)ccc1O ZINC000562480819 945086060 /nfs/dbraw/zinc/08/60/60/945086060.db2.gz ODGCVUSTDGNZQM-HXUWFJFHSA-N 0 3 403.404 4.457 20 0 HIADHN O=C(c1cccc(CN2CCCC2)c1)N1CCOc2ccc(Br)cc2C1 ZINC000563227979 945157149 /nfs/dbraw/zinc/15/71/49/945157149.db2.gz KEMLCZVPQMSLRV-UHFFFAOYSA-N 0 3 415.331 4.080 20 0 HIADHN O=C(CCN1CCC(C(=O)Nc2cccc(Br)c2)CC1)c1ccccc1 ZINC000537517701 938315042 /nfs/dbraw/zinc/31/50/42/938315042.db2.gz OZCFFUGJVYUFOO-UHFFFAOYSA-N 0 3 415.331 4.373 20 0 HIADHN COc1cc(C)c(CN2CCC(C(=O)N(Cc3ccccc3)C3CC3)CC2)cc1OC ZINC000537615632 938334154 /nfs/dbraw/zinc/33/41/54/938334154.db2.gz LUMLWRRSMQUEQP-UHFFFAOYSA-N 0 3 422.569 4.415 20 0 HIADHN COc1cc(CN2CCC[C@H]2c2ccc(C(C)C)cc2)cc(OC)c1OCC(N)=O ZINC000537622025 938336652 /nfs/dbraw/zinc/33/66/52/938336652.db2.gz OAKIJKBLYCIPOJ-FQEVSTJZSA-N 0 3 412.530 4.028 20 0 HIADHN Brc1ccc(OCc2ccccn2)c(CN2CC[C@@H]([C@@H]3CCOC3)C2)c1 ZINC000537648006 938345716 /nfs/dbraw/zinc/34/57/16/938345716.db2.gz FZEVRYGKQQQFTQ-IAGOWNOFSA-N 0 3 417.347 4.282 20 0 HIADHN CCN(C[C@@H]1CCN(Cc2c[nH]nc2-c2c(F)cccc2F)C1)CC(F)(F)F ZINC000537649872 938346636 /nfs/dbraw/zinc/34/66/36/938346636.db2.gz KJUYPWXLHIESRD-ZDUSSCGKSA-N 0 3 402.411 4.061 20 0 HIADHN CCNC(=O)COc1ccc(CN(C)C2c3ccccc3-c3ccccc32)cc1OC ZINC000537649150 938346700 /nfs/dbraw/zinc/34/67/00/938346700.db2.gz GVXGFDIOQCBCDH-UHFFFAOYSA-N 0 3 416.521 4.412 20 0 HIADHN CCCN(CC(F)(F)F)C(=O)[C@@H]1CCCN(Cc2ccc(OC)c(OCC)c2)C1 ZINC000537649590 938346733 /nfs/dbraw/zinc/34/67/33/938346733.db2.gz PHMXZBNCHNCBOI-QGZVFWFLSA-N 0 3 416.484 4.107 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)[C@@H]2C[C@@H]2c2c(F)cccc2F)cc1 ZINC000537731500 938365428 /nfs/dbraw/zinc/36/54/28/938365428.db2.gz UQTYWHKUDXZTCL-UEXGIBASSA-N 0 3 400.469 4.030 20 0 HIADHN CC[C@H](NCc1c(Cl)cccc1N1CCN(C)CC1)c1ccc2c(c1)OCCO2 ZINC000537749518 938368923 /nfs/dbraw/zinc/36/89/23/938368923.db2.gz QSUWCSOKWQCCII-FQEVSTJZSA-N 0 3 415.965 4.104 20 0 HIADHN C[C@@H](NC(=O)N1CCO[C@@H](CN(C)C)C1)c1ccc(-c2ccc(Cl)cc2)s1 ZINC000537814598 938383259 /nfs/dbraw/zinc/38/32/59/938383259.db2.gz FGCUPTNCEFKVQO-PBHICJAKSA-N 0 3 407.967 4.102 20 0 HIADHN O=C([C@@H]1CC12CCN(Cc1cccc(OCC(F)(F)F)c1)CC2)N1CCCCC1 ZINC000537846037 938389078 /nfs/dbraw/zinc/38/90/78/938389078.db2.gz HDVVVMBHDRXBOV-IBGZPJMESA-N 0 3 410.480 4.242 20 0 HIADHN COc1ccc([C@H](C)NCc2ccc(S(=O)(=O)N3CCCC3)cc2)c2ccccc12 ZINC000537919459 938413817 /nfs/dbraw/zinc/41/38/17/938413817.db2.gz YXMFIGCDKPFEOP-SFHVURJKSA-N 0 3 424.566 4.484 20 0 HIADHN CC(C)C[C@H](NCc1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1)c1ccccc1 ZINC000537939028 938424410 /nfs/dbraw/zinc/42/44/10/938424410.db2.gz ZUBLHWDUAOPTEP-GMAHTHKFSA-N 0 3 416.587 4.021 20 0 HIADHN C[C@@H]1C[C@H](N[C@H]2CCCN(CC(F)(F)F)C2=O)c2cccc(Br)c21 ZINC000537948299 938428430 /nfs/dbraw/zinc/42/84/30/938428430.db2.gz GMLSZXOWECMRSV-SWHYSGLUSA-N 0 3 405.258 4.140 20 0 HIADHN CC[C@H](N[C@@H](C)c1ccc(NC(C)=O)cc1OC)[C@@H](c1ccc(C)cc1)n1cncn1 ZINC000537948966 938429025 /nfs/dbraw/zinc/42/90/25/938429025.db2.gz NEUSXZLCJQLALV-OZWPHOJSSA-N 0 3 421.545 4.272 20 0 HIADHN CC(C)C[C@H](N[C@H](C)c1ccc(NC(=O)NC(C)C)cc1)C(=O)Nc1nccs1 ZINC000537952596 938430614 /nfs/dbraw/zinc/43/06/14/938430614.db2.gz MBFKIQKYAIAQCK-QAPCUYQASA-N 0 3 417.579 4.377 20 0 HIADHN Cc1nc(-c2ccccc2Br)sc1[C@@H](C)N[C@H]1CC(=O)N(C2CC2)C1 ZINC000537955063 938431302 /nfs/dbraw/zinc/43/13/02/938431302.db2.gz FWBYLBGGBKVVRE-YPMHNXCESA-N 0 3 420.376 4.295 20 0 HIADHN CCn1cc([C@H](C)NCCOc2ccc(Br)cc2C(F)(F)F)cn1 ZINC000537959294 938434783 /nfs/dbraw/zinc/43/47/83/938434783.db2.gz AQAFTHDXTFVOOC-NSHDSACASA-N 0 3 406.246 4.414 20 0 HIADHN CCc1nc([C@H](C)N[C@H](C)CC(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)n[nH]1 ZINC000537961407 938435087 /nfs/dbraw/zinc/43/50/87/938435087.db2.gz JFWGAIMEQACADU-ZJUUUORDSA-N 0 3 403.836 4.107 20 0 HIADHN COc1ccc(C[C@@H](C)CN[C@H](C)c2nnn(-c3ccc(F)cc3)c2C)cc1OC ZINC000537962151 938435673 /nfs/dbraw/zinc/43/56/73/938435673.db2.gz MROOHCMONYOORR-HZPDHXFCSA-N 0 3 412.509 4.261 20 0 HIADHN COc1ccc(CN[C@@H](C)c2ccc(S(=O)(=O)N3CCCCC3)cc2)c(C)c1 ZINC000537963450 938436589 /nfs/dbraw/zinc/43/65/89/938436589.db2.gz LYTBUDVJDBSLPA-SFHVURJKSA-N 0 3 402.560 4.029 20 0 HIADHN COc1ccc(Br)c(CNC2CCC3(CC2)C(=O)Nc2ccccc23)c1 ZINC000537966416 938437861 /nfs/dbraw/zinc/43/78/61/938437861.db2.gz KLNUACBQCANWHV-UHFFFAOYSA-N 0 3 415.331 4.380 20 0 HIADHN CNS(=O)(=O)c1cccc([C@@H](C)N[C@H](Cc2ccccc2)c2cccs2)c1 ZINC000537970512 938440314 /nfs/dbraw/zinc/44/03/14/938440314.db2.gz XVQMVUKPAAXGTM-OXQOHEQNSA-N 0 3 400.569 4.291 20 0 HIADHN COc1cc(F)c([C@H](C)NC[C@H](c2cccc(Cl)c2)N2CCOCC2)cc1OC ZINC000537976617 938444720 /nfs/dbraw/zinc/44/47/20/938444720.db2.gz DHECJTDGADISHC-MGPUTAFESA-N 0 3 422.928 4.220 20 0 HIADHN COC[C@H](N[C@@H](C)CC(=O)Nc1cccc(Br)c1)c1ccc(F)cc1 ZINC000537986754 938449625 /nfs/dbraw/zinc/44/96/25/938449625.db2.gz JZBKIRHVKLPYRR-UGSOOPFHSA-N 0 3 409.299 4.283 20 0 HIADHN COc1cc(CN[C@H](C)c2cc(Cl)cc(Cl)c2)ccc1OCC(=O)N(C)C ZINC000537989504 938451715 /nfs/dbraw/zinc/45/17/15/938451715.db2.gz BTOHKLHJMLGNNU-CYBMUJFWSA-N 0 3 411.329 4.320 20 0 HIADHN C[C@@H](Cc1ccccc1)n1cccc1C(=O)N(CCN(C)C)Cc1cccc(O)c1 ZINC000538015091 938462452 /nfs/dbraw/zinc/46/24/52/938462452.db2.gz HZNKTHZVDUDTGW-FQEVSTJZSA-N 0 3 405.542 4.201 20 0 HIADHN C[C@H](Cc1ccccc1)n1cccc1C(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000538020539 938465821 /nfs/dbraw/zinc/46/58/21/938465821.db2.gz GWNMBFQFGZMXEL-VSKRKVRLSA-N 0 3 423.601 4.253 20 0 HIADHN CN(Cc1ccccc1)CC(C)(C)NCc1nc(-c2cc(F)c(F)c(F)c2)no1 ZINC000538045726 938480879 /nfs/dbraw/zinc/48/08/79/938480879.db2.gz SKXKMIBHKVDZJU-UHFFFAOYSA-N 0 3 404.436 4.154 20 0 HIADHN C[C@H](NCCSCc1cccc2ccccc21)c1cccc(S(N)(=O)=O)c1 ZINC000538100027 938501826 /nfs/dbraw/zinc/50/18/26/938501826.db2.gz KCMOQPQNEJBATG-INIZCTEOSA-N 0 3 400.569 4.071 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(OCc2cccnc2)cc1)C(=O)N(C)Cc1ccccc1 ZINC000538124813 938511347 /nfs/dbraw/zinc/51/13/47/938511347.db2.gz NYAXQGQSZVZSII-WOJBJXKFSA-N 0 3 403.526 4.358 20 0 HIADHN COc1ccc([C@@H](NCC(=O)Nc2cc(C)ccc2-c2n[nH]c(C)n2)C(C)C)cc1 ZINC000538143269 938518852 /nfs/dbraw/zinc/51/88/52/938518852.db2.gz IMGLHHRISFBTML-QFIPXVFZSA-N 0 3 407.518 4.023 20 0 HIADHN CC[C@H](NCCO[C@H]1CCCC[C@H]1C)c1ccccc1OCC(=O)N1CCCC1 ZINC000538149785 938522462 /nfs/dbraw/zinc/52/24/62/938522462.db2.gz DMOGMNVVZZNQSU-HJNYFJLDSA-N 0 3 402.579 4.324 20 0 HIADHN COc1ccc(C[C@H](NCC(=O)NCc2sccc2C)c2ccccc2)cc1OC ZINC000538151063 938522821 /nfs/dbraw/zinc/52/28/21/938522821.db2.gz IQPHDTNNNMZJSK-FQEVSTJZSA-N 0 3 424.566 4.264 20 0 HIADHN C[C@@H](N[C@@H](C)c1cccc(-n2cccn2)c1)C(=O)Nc1nc2ccc(F)cc2s1 ZINC000538187058 938542843 /nfs/dbraw/zinc/54/28/43/938542843.db2.gz FYBPBUCZSZTEDS-UONOGXRCSA-N 0 3 409.490 4.299 20 0 HIADHN C[C@H](N[C@@H]1CCCN(c2ccccc2)C1=O)c1ccc(NC(=O)c2ccncc2)cc1 ZINC000538193731 938548137 /nfs/dbraw/zinc/54/81/37/938548137.db2.gz CKTGVOGZEWIJPN-FDDCHVKYSA-N 0 3 414.509 4.180 20 0 HIADHN COC[C@H](NC[C@H](CO)Cc1ccccc1C(F)(F)F)c1ccc(F)c(F)c1 ZINC000538195883 938549511 /nfs/dbraw/zinc/54/95/11/938549511.db2.gz UJOIELPHRALPPH-YJYMSZOUSA-N 0 3 403.391 4.112 20 0 HIADHN Cc1cc(NC(=O)CN[C@@H](c2ccccc2)[C@H]2CCOC2)ccc1Br ZINC000538197050 938549903 /nfs/dbraw/zinc/54/99/03/938549903.db2.gz KGQSFCROURLSJY-JXFKEZNVSA-N 0 3 403.320 4.063 20 0 HIADHN O=C(CN[C@@H](c1ccc(Cl)cc1)C1CCCC1)Nc1nnc(-c2ccco2)o1 ZINC000538205078 938553348 /nfs/dbraw/zinc/55/33/48/938553348.db2.gz DQMGCEAJQPJZRR-GOSISDBHSA-N 0 3 400.866 4.443 20 0 HIADHN C[C@H](NC[C@H](O)COc1c(Cl)cccc1Cl)c1cccc(N2CCCC2=O)c1 ZINC000538211333 938558503 /nfs/dbraw/zinc/55/85/03/938558503.db2.gz TZSIOUBJRUHOGU-YOEHRIQHSA-N 0 3 423.340 4.211 20 0 HIADHN Cc1cc(NC(=O)CN[C@@H](C[C@@H]2CCOC2)c2ccccc2)n(-c2ccc(F)cc2)n1 ZINC000538232746 938567164 /nfs/dbraw/zinc/56/71/64/938567164.db2.gz HEAQHPDXEPWXBK-AVRDEDQJSA-N 0 3 422.504 4.016 20 0 HIADHN CN(Cc1ccc(OC(F)F)cc1)C(=O)CN[C@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000538233423 938568059 /nfs/dbraw/zinc/56/80/59/938568059.db2.gz MAHIHKSJEAWFKA-GHTZIAJQSA-N 0 3 418.484 4.004 20 0 HIADHN COc1ccc([C@@H](NC(=O)CN[C@H](C)c2ccc(-n3cccn3)cc2)C(C)C)cc1 ZINC000538236439 938569276 /nfs/dbraw/zinc/56/92/76/938569276.db2.gz MSSRVLMBAIHCCP-KOSHJBKYSA-N 0 3 406.530 4.045 20 0 HIADHN COc1ccc([C@@H](NC(=O)CN[C@@H](C)c2ccc(-n3cccn3)cc2)C(C)C)cc1 ZINC000538236441 938569318 /nfs/dbraw/zinc/56/93/18/938569318.db2.gz MSSRVLMBAIHCCP-UUOWRZLLSA-N 0 3 406.530 4.045 20 0 HIADHN C[C@@H](N[C@@H](C)c1cccc(N2CCCC2)c1)C(=O)Nc1cccc(N2CCCC2=O)c1 ZINC000538277412 938581518 /nfs/dbraw/zinc/58/15/18/938581518.db2.gz TXKYXCCNBGPFNL-RBUKOAKNSA-N 0 3 420.557 4.091 20 0 HIADHN CC(C)CN(C(=O)c1cc(OC(F)F)cc(OC(F)F)c1)C1CCN(C)CC1 ZINC000538300093 938587023 /nfs/dbraw/zinc/58/70/23/938587023.db2.gz IDSSWORPHHQQQY-UHFFFAOYSA-N 0 3 406.420 4.082 20 0 HIADHN Cc1nn(-c2ccccc2)c(Oc2cccc(F)c2)c1CN[C@H](C)Cn1ccnc1 ZINC000538346462 938599537 /nfs/dbraw/zinc/59/95/37/938599537.db2.gz SAEYKKFPPARGAB-QGZVFWFLSA-N 0 3 405.477 4.487 20 0 HIADHN CCOC(=O)C1CCN(C(=O)[C@@H](C)N[C@@H](c2ccc(CC(C)C)cc2)C2CC2)CC1 ZINC000538390556 938609345 /nfs/dbraw/zinc/60/93/45/938609345.db2.gz SBEHCVZPILIDAG-JPYJTQIMSA-N 0 3 414.590 4.116 20 0 HIADHN C[C@H](N[C@@H](c1ccc2c(c1)OCCO2)C1CC1)C(=O)N1CCSc2ccccc21 ZINC000538390640 938609556 /nfs/dbraw/zinc/60/95/56/938609556.db2.gz WGHRUVBFCUMXJZ-OYHNWAKOSA-N 0 3 410.539 4.026 20 0 HIADHN C[C@H](N[C@@H]1CCO[C@H]1c1ccc(F)c(F)c1)c1ccc(-n2cncn2)cc1Cl ZINC000538406219 938612932 /nfs/dbraw/zinc/61/29/32/938612932.db2.gz TWVPRJMVLFRTJL-KNMUDHKVSA-N 0 3 404.848 4.380 20 0 HIADHN COc1ccc(S(=O)(=O)Nc2cccc(CNCc3ccc(Cl)cc3)c2)cc1 ZINC000538407820 938613449 /nfs/dbraw/zinc/61/34/49/938613449.db2.gz MIEDIHXJJKHQEV-UHFFFAOYSA-N 0 3 416.930 4.439 20 0 HIADHN CSCC[C@H](CO)NCc1c(C)nn(-c2ccccc2)c1Oc1cccc(F)c1 ZINC000538421479 938617099 /nfs/dbraw/zinc/61/70/99/938617099.db2.gz KAUWWHZVQOLFEK-GOSISDBHSA-N 0 3 415.534 4.316 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N(C)Cc1cc(F)c(F)c(F)c1)c1cccc(OC)c1 ZINC000538516864 938639703 /nfs/dbraw/zinc/63/97/03/938639703.db2.gz UIPZQYDPEJKVRE-HXUWFJFHSA-N 0 3 423.479 4.337 20 0 HIADHN COc1ccc(NC(=O)C[C@@H](C)NC2(c3cccc(Br)c3)CC2)cc1 ZINC000538554048 938647703 /nfs/dbraw/zinc/64/77/03/938647703.db2.gz PLADIDRLTDCVAK-CQSZACIVSA-N 0 3 403.320 4.454 20 0 HIADHN C[C@H](N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1)c1ccc2c(c1)OCCO2 ZINC000538552940 938647805 /nfs/dbraw/zinc/64/78/05/938647805.db2.gz ZRPQYKIIDAKTRL-WMZHIEFXSA-N 0 3 416.521 4.036 20 0 HIADHN C[C@@H](C(=O)c1c[nH]c2ncccc12)N1CCC[C@@H](c2nc(C3CCCCC3)n[nH]2)C1 ZINC000538664592 938678704 /nfs/dbraw/zinc/67/87/04/938678704.db2.gz RLPQFZVPRKVYCU-DOTOQJQBSA-N 0 3 406.534 4.180 20 0 HIADHN O[C@H](COc1ccccc1Cl)CN1CCC[C@@H](c2nnc(C3CCCCC3)[nH]2)C1 ZINC000538665474 938679596 /nfs/dbraw/zinc/67/95/96/938679596.db2.gz GYPPZLQOHQXGOG-MSOLQXFVSA-N 0 3 418.969 4.125 20 0 HIADHN CC(C)(C)c1ccc(-c2ccc(CN3CCC([C@@]4(C)NC(=O)NC4=O)CC3)o2)cc1 ZINC000538722883 938691592 /nfs/dbraw/zinc/69/15/92/938691592.db2.gz WJZONVLIIQRTSG-XMMPIXPASA-N 0 3 409.530 4.054 20 0 HIADHN Brc1ccccc1-c1ccc(CN2CCN(C[C@H]3CCOC3)CC2)s1 ZINC000538723231 938692112 /nfs/dbraw/zinc/69/21/12/938692112.db2.gz QDBKCCNLCADXDX-MRXNPFEDSA-N 0 3 421.404 4.332 20 0 HIADHN COC(=O)[C@H]1CC12CCN(Cc1ccc(OCc3cccs3)c(OC)c1)CC2 ZINC000538729216 938694386 /nfs/dbraw/zinc/69/43/86/938694386.db2.gz XZPQHZDWCHONGT-GOSISDBHSA-N 0 3 401.528 4.111 20 0 HIADHN O=C(NCC(F)(F)F)C1CCN([C@@H]2CCCc3ccc(Br)cc32)CC1 ZINC000538743366 938699215 /nfs/dbraw/zinc/69/92/15/938699215.db2.gz YVFRBOBTNOKCCH-MRXNPFEDSA-N 0 3 419.285 4.217 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)c1cc(OCc2ccccc2)ccc1O ZINC000538748462 938700494 /nfs/dbraw/zinc/70/04/94/938700494.db2.gz KRTGXBHAZSZMCE-UHFFFAOYSA-N 0 3 406.482 4.294 20 0 HIADHN CCCN(CC(F)(F)F)C(=O)[C@@H]1CCCN(Cc2cnc(N(CC)CC)s2)C1 ZINC000538750846 938701353 /nfs/dbraw/zinc/70/13/53/938701353.db2.gz BTELGSZINDIBSC-OAHLLOKOSA-N 0 3 420.545 4.002 20 0 HIADHN COc1cc(CN2CC[C@H](C3CCOCC3)C2)cc(Br)c1OC(F)F ZINC000538751104 938701897 /nfs/dbraw/zinc/70/18/97/938701897.db2.gz PNWXCJGTIWRNHL-AWEZNQCLSA-N 0 3 420.294 4.308 20 0 HIADHN C[C@H](NCc1ccc(S(=O)(=O)N2CCC[C@@H](C)C2)cc1)c1ccccc1N(C)C ZINC000538759975 938703492 /nfs/dbraw/zinc/70/34/92/938703492.db2.gz IRPZORTUCCWCGV-MOPGFXCFSA-N 0 3 415.603 4.024 20 0 HIADHN Cc1cc(NC(=O)C2CCN([C@@H]3CCCc4ccc(Br)cc43)CC2)no1 ZINC000538781665 938709113 /nfs/dbraw/zinc/70/91/13/938709113.db2.gz PUTAKNYGKMCYHI-GOSISDBHSA-N 0 3 418.335 4.474 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)c2ccccc2Br)cc1 ZINC000538831285 938721679 /nfs/dbraw/zinc/72/16/79/938721679.db2.gz RBKYWYTVHUNRDR-IBGZPJMESA-N 0 3 403.320 4.025 20 0 HIADHN COCCn1ccc2ccc(NC(=O)c3ccc(N4CCN(C(C)C)CC4)cc3)cc21 ZINC000538865987 938727994 /nfs/dbraw/zinc/72/79/94/938727994.db2.gz OSLIMSINXHQQDL-UHFFFAOYSA-N 0 3 420.557 4.070 20 0 HIADHN CCC[C@H](N[C@@H](C)c1sc(CCOC)nc1C)C(=O)N1CCc2sccc2C1 ZINC000538869009 938728599 /nfs/dbraw/zinc/72/85/99/938728599.db2.gz UVMIBHPCZYWIQO-YOEHRIQHSA-N 0 3 421.632 4.106 20 0 HIADHN CCN1C[C@@H](C)N(C(=O)Nc2ccc3nc(C(F)(F)C(F)(F)F)[nH]c3c2)C[C@@H]1C ZINC000539010842 938768165 /nfs/dbraw/zinc/76/81/65/938768165.db2.gz MPTCWFRZELTUAF-WDEREUQCSA-N 0 3 419.398 4.163 20 0 HIADHN C[C@H](Cn1ncc2ccccc2c1=O)N[C@H](C)c1ccc(Br)c(F)c1 ZINC000539040423 938777987 /nfs/dbraw/zinc/77/79/87/938777987.db2.gz AYLVLSSIGMYRIS-CHWSQXEVSA-N 0 3 404.283 4.037 20 0 HIADHN C[C@@H](NCc1ccccc1CS(=O)(=O)N1CCCC1)c1cccc(OC(F)F)c1 ZINC000539044740 938780639 /nfs/dbraw/zinc/78/06/39/938780639.db2.gz WWACOIQQIDVCAD-MRXNPFEDSA-N 0 3 424.513 4.064 20 0 HIADHN Cc1nc(-c2ccccc2F)sc1[C@H](C)NCc1cccc(NS(C)(=O)=O)c1 ZINC000539071807 938794111 /nfs/dbraw/zinc/79/41/11/938794111.db2.gz DIRIQIXPVWVMOI-ZDUSSCGKSA-N 0 3 419.547 4.480 20 0 HIADHN COc1ccc(C[C@H](NC[C@H](O)[C@H]2CCOC2)c2cc(Cl)ccc2Cl)cc1 ZINC000539073579 938794736 /nfs/dbraw/zinc/79/47/36/938794736.db2.gz OEIICTBKZRGBQA-JHVJFLLYSA-N 0 3 410.341 4.273 20 0 HIADHN Cc1c([C@H](C)NC2CCN(C(=O)c3ccccc3)CC2)nnn1-c1cccc(Cl)c1 ZINC000539075070 938795497 /nfs/dbraw/zinc/79/54/97/938795497.db2.gz SQLSYTBXVWSZQW-INIZCTEOSA-N 0 3 423.948 4.185 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccccc1C(F)(F)F)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000539086410 938799508 /nfs/dbraw/zinc/79/95/08/938799508.db2.gz LKMRVQVBXWHQDJ-KGLIPLIRSA-N 0 3 400.466 4.368 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(S(=O)(=O)N(C)C)cc1)c1ccccc1C(F)(F)F ZINC000539086411 938799839 /nfs/dbraw/zinc/79/98/39/938799839.db2.gz LKMRVQVBXWHQDJ-UONOGXRCSA-N 0 3 400.466 4.368 20 0 HIADHN COC[C@H](N[C@@H](C)CC(=O)Nc1ccc(Br)cc1)c1ccc(F)cc1 ZINC000539088558 938800069 /nfs/dbraw/zinc/80/00/69/938800069.db2.gz VTWQQAWLLJFRBT-UGSOOPFHSA-N 0 3 409.299 4.283 20 0 HIADHN C[C@@H](NCc1ccc(C(=O)N2C[C@@H](C)O[C@@H](C)C2)cc1)c1cnc2ccsc2c1 ZINC000539089585 938800397 /nfs/dbraw/zinc/80/03/97/938800397.db2.gz AYYLGJBRXUBNEP-IXDOHACOSA-N 0 3 409.555 4.397 20 0 HIADHN Cc1ccccc1COc1ccc([C@@H](C)N[C@@H]2CCCN(c3ccn(C)n3)C2=O)cc1 ZINC000539089068 938800490 /nfs/dbraw/zinc/80/04/90/938800490.db2.gz JELRVGOWIGPZDT-AUSIDOKSSA-N 0 3 418.541 4.154 20 0 HIADHN COc1cc([C@@H](C)NCCOc2cccc(Cl)c2Cl)ccc1S(C)(=O)=O ZINC000539090897 938800989 /nfs/dbraw/zinc/80/09/89/938800989.db2.gz DCCHEAGXGHRILN-GFCCVEGCSA-N 0 3 418.342 4.135 20 0 HIADHN COc1cccc(C[C@H](NCc2ccccc2CS(C)(=O)=O)c2ccccc2)c1 ZINC000539120747 938805687 /nfs/dbraw/zinc/80/56/87/938805687.db2.gz VKLWEULEZXIGOT-DEOSSOPVSA-N 0 3 409.551 4.313 20 0 HIADHN C[C@@H](NC[C@H](c1cccs1)N1CCOCC1)c1nc2ccc(Cl)cc2n1C ZINC000539162131 938814273 /nfs/dbraw/zinc/81/42/73/938814273.db2.gz VNSZYVOACDVUCO-RDTXWAMCSA-N 0 3 404.967 4.012 20 0 HIADHN CCCCn1cc(CN[C@H](C)CC(=O)Nc2cccc(Br)c2)c(C)n1 ZINC000539217753 938820156 /nfs/dbraw/zinc/82/01/56/938820156.db2.gz MFYXKHQPIALNMR-CQSZACIVSA-N 0 3 407.356 4.261 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(OCc2cccnc2)cc1)C(=O)N1CCc2sccc2C1 ZINC000539226386 938821749 /nfs/dbraw/zinc/82/17/49/938821749.db2.gz NGFGRVCUKNSWOM-ZWKOTPCHSA-N 0 3 421.566 4.346 20 0 HIADHN Cc1sc(NC(=O)CNC2(c3ccc4c(c3)OCCO4)CCCC2)c(C)c1C ZINC000539242091 938824103 /nfs/dbraw/zinc/82/41/03/938824103.db2.gz YHYQADRVNMOTAW-UHFFFAOYSA-N 0 3 400.544 4.442 20 0 HIADHN CC(C)C[C@@H](NCc1cc(=O)n2cc(Br)ccc2n1)c1ccccc1 ZINC000539244452 938824815 /nfs/dbraw/zinc/82/48/15/938824815.db2.gz WJKZLFURYGXYKI-GOSISDBHSA-N 0 3 400.320 4.334 20 0 HIADHN CC(C)C[C@H](NCc1cc(=O)n2cc(Br)ccc2n1)c1ccccc1 ZINC000539244454 938824908 /nfs/dbraw/zinc/82/49/08/938824908.db2.gz WJKZLFURYGXYKI-SFHVURJKSA-N 0 3 400.320 4.334 20 0 HIADHN Fc1cccc(CC2(NCc3cn(-c4ccc(F)cc4Cl)nn3)CCOCC2)c1 ZINC000563501784 945207152 /nfs/dbraw/zinc/20/71/52/945207152.db2.gz HICLPJSNHIEGKE-UHFFFAOYSA-N 0 3 418.875 4.080 20 0 HIADHN Cc1cc(NC(=O)CN[C@H](C)c2ccccc2-n2cccn2)ccc1Br ZINC000539261070 938828905 /nfs/dbraw/zinc/82/89/05/938828905.db2.gz XUYRENRNMPEFJL-OAHLLOKOSA-N 0 3 413.319 4.233 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccccc1-n1cccn1)C(=O)N(C)Cc1nc2ccccc2s1 ZINC000539261451 938829171 /nfs/dbraw/zinc/82/91/71/938829171.db2.gz PCLNSJPZMLBTPU-DLBZAZTESA-N 0 3 419.554 4.180 20 0 HIADHN Cc1ccccc1[C@@H](CC(C)C)NCC(=O)Nc1ccc(CN2CCOCC2)cc1 ZINC000539261356 938829283 /nfs/dbraw/zinc/82/92/83/938829283.db2.gz OOULZKAQOGYHKH-XMMPIXPASA-N 0 3 409.574 4.143 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(OCC(F)(F)F)cc1)C(=O)N1CCc2ccccc2C1 ZINC000539264413 938829760 /nfs/dbraw/zinc/82/97/60/938829760.db2.gz DDXIZZKJINSQOO-HZPDHXFCSA-N 0 3 406.448 4.252 20 0 HIADHN Cc1cccc([C@@H](C)NCC(=O)N2c3ccccc3NC(=O)C[C@H]2C(F)(F)F)c1C ZINC000539286118 938833598 /nfs/dbraw/zinc/83/35/98/938833598.db2.gz COERDFODNCQTKQ-BEFAXECRSA-N 0 3 419.447 4.260 20 0 HIADHN O=C(CN[C@H](c1ccccc1)[C@@H]1CCOC1)Nc1ccc2c(c1)OC1(CCCCC1)O2 ZINC000539288769 938834164 /nfs/dbraw/zinc/83/41/64/938834164.db2.gz FDWVDSSQSWOCOO-NTKDMRAZSA-N 0 3 422.525 4.424 20 0 HIADHN C[C@H](N[C@@H](C)c1cccc(-n2cccn2)c1)C(=O)N(C)Cc1nc2ccccc2s1 ZINC000539289642 938834503 /nfs/dbraw/zinc/83/45/03/938834503.db2.gz XIAJKBQNZZGTMO-IRXDYDNUSA-N 0 3 419.554 4.180 20 0 HIADHN Cc1ccc(-c2csc(NC(=O)CN[C@@H](c3ccccc3)[C@@H]3CCOC3)n2)cc1 ZINC000539298347 938836098 /nfs/dbraw/zinc/83/60/98/938836098.db2.gz PATIVFILENJFRC-KNQAVFIVSA-N 0 3 407.539 4.424 20 0 HIADHN CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H](c2ccccc2F)C2CCCC2)cc1 ZINC000539325818 938841903 /nfs/dbraw/zinc/84/19/03/938841903.db2.gz PISBDRHZHOMXGD-CVDCTZTESA-N 0 3 400.494 4.045 20 0 HIADHN CC(=O)Nc1cccc(NC(=O)[C@@H](C)N[C@@H](C)c2ccc(-c3cccnc3)cc2)c1 ZINC000539327489 938842190 /nfs/dbraw/zinc/84/21/90/938842190.db2.gz YXVIXKIHVGNSDP-DLBZAZTESA-N 0 3 402.498 4.385 20 0 HIADHN O=C(CN[C@@H](CC1CCCC1)c1ccccc1)NCc1cccc(C(=O)NC2CC2)c1 ZINC000539328531 938842585 /nfs/dbraw/zinc/84/25/85/938842585.db2.gz GLRYPJAAPFGGIV-DEOSSOPVSA-N 0 3 419.569 4.106 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(-n2ccnn2)cc1)C(=O)Nc1ccc(Cl)cc1Cl ZINC000539328949 938842654 /nfs/dbraw/zinc/84/26/54/938842654.db2.gz UDCMJLKIYVSPJJ-CHWSQXEVSA-N 0 3 404.301 4.252 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)Nc1ccc(OC(F)F)cc1)c1ccc(-n2cccn2)cc1 ZINC000539337601 938844308 /nfs/dbraw/zinc/84/43/08/938844308.db2.gz CXIHWBCUBIMRTP-CABCVRRESA-N 0 3 400.429 4.152 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(-n2cccn2)cc1)C(=O)Nc1ccccc1Br ZINC000539337132 938844311 /nfs/dbraw/zinc/84/43/11/938844311.db2.gz ONDQJTQXAJVIBB-GJZGRUSLSA-N 0 3 413.319 4.313 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(-n2cccn2)cc1)C(=O)Nc1ccccc1Br ZINC000539337136 938844353 /nfs/dbraw/zinc/84/43/53/938844353.db2.gz ONDQJTQXAJVIBB-HUUCEWRRSA-N 0 3 413.319 4.313 20 0 HIADHN CC[C@H](C(=O)NCCCCN1CCN(c2cccc(C)c2)CC1)c1ccc(OC)cc1 ZINC000539398775 938854945 /nfs/dbraw/zinc/85/49/45/938854945.db2.gz LDKBVPGLDWCSCX-VWLOTQADSA-N 0 3 423.601 4.216 20 0 HIADHN COC(=O)[C@H](C)Oc1ccc(CNC2(c3ccc(Br)cc3)CC2)cc1 ZINC000539414986 938857479 /nfs/dbraw/zinc/85/74/79/938857479.db2.gz HPBSNXDRYNPMHT-AWEZNQCLSA-N 0 3 404.304 4.168 20 0 HIADHN COc1cc(CN[C@@H](c2cccc(F)c2)C(C)(C)C)cc(Cl)c1OCC(N)=O ZINC000539489358 938867388 /nfs/dbraw/zinc/86/73/88/938867388.db2.gz XVPDSCYEIGFVBU-FQEVSTJZSA-N 0 3 408.901 4.229 20 0 HIADHN CC(C)(C)C[C@H](NC[C@@H](O)CS(=O)(=O)c1cccs1)c1ccc(Cl)cc1 ZINC000539506856 938870370 /nfs/dbraw/zinc/87/03/70/938870370.db2.gz FONDONQXVAXPNJ-SJORKVTESA-N 0 3 416.008 4.303 20 0 HIADHN CS(=O)(=O)[C@@H]1CCC[C@@H](NCc2cccc(NC(=O)c3ccc(Cl)cc3)c2)C1 ZINC000539520186 938872888 /nfs/dbraw/zinc/87/28/88/938872888.db2.gz XHNDHBOBWHMUTM-UYAOXDASSA-N 0 3 420.962 4.038 20 0 HIADHN CC1CCN(S(=O)(=O)Cc2ccccc2CNCc2ccc(Cl)cc2)CC1 ZINC000539528955 938873949 /nfs/dbraw/zinc/87/39/49/938873949.db2.gz VFSLTXGLXLVHOB-UHFFFAOYSA-N 0 3 406.979 4.192 20 0 HIADHN Cc1cc(NC(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)nn1-c1cccc(F)c1 ZINC000539591681 938884759 /nfs/dbraw/zinc/88/47/59/938884759.db2.gz HUNFMQZBPVTYIH-IBGZPJMESA-N 0 3 421.520 4.448 20 0 HIADHN Cc1ccc([C@H](N[C@@H]2CCO[C@@H](C(C)C)C2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000539611933 938887823 /nfs/dbraw/zinc/88/78/23/938887823.db2.gz MNYLKMSESCGYSM-MZYLBHOOSA-N 0 3 401.572 4.281 20 0 HIADHN CC(C)c1nn(-c2ccccc2)cc1CNC[C@H](Cc1ccccc1Cl)C(N)=O ZINC000539634491 938891159 /nfs/dbraw/zinc/89/11/59/938891159.db2.gz HGZARIFNJOOWJY-SFHVURJKSA-N 0 3 410.949 4.083 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)C1(c2ccc(F)cc2F)CCC1 ZINC000539669416 938897821 /nfs/dbraw/zinc/89/78/21/938897821.db2.gz ILMILVMFQZXTTM-UHFFFAOYSA-N 0 3 414.496 4.230 20 0 HIADHN COc1cc(CN2CCC[C@H]2C2CCOCC2)cc(Br)c1OC(F)F ZINC000539669759 938897867 /nfs/dbraw/zinc/89/78/67/938897867.db2.gz HEDYKUTYQGFALW-HNNXBMFYSA-N 0 3 420.294 4.450 20 0 HIADHN CC1CCN([C@@H](CNC(=O)N2CCCC[C@@H]2c2ccnn2C)c2ccccc2)CC1 ZINC000539712708 938909360 /nfs/dbraw/zinc/90/93/60/938909360.db2.gz MJUJVOKJRCQXDJ-PKTZIBPZSA-N 0 3 409.578 4.130 20 0 HIADHN CN(C)[C@H](CNC(=O)Nc1ccc2nc(-c3ccccn3)oc2c1)Cc1ccccc1 ZINC000539725881 938914156 /nfs/dbraw/zinc/91/41/56/938914156.db2.gz QZGVNQJCYFNEKX-IBGZPJMESA-N 0 3 415.497 4.184 20 0 HIADHN NC(=O)[C@H](N[C@H]1CC=C(c2ccc(F)cc2)CC1)c1ccc(Br)cc1 ZINC000539754173 938922213 /nfs/dbraw/zinc/92/22/13/938922213.db2.gz JNWFXGKYVJQYFU-RBUKOAKNSA-N 0 3 403.295 4.340 20 0 HIADHN Cc1c([C@@H](C)NCc2ccc(Cn3cncn3)cc2)cnn1-c1cc(C)ccc1C ZINC000563571785 945220112 /nfs/dbraw/zinc/22/01/12/945220112.db2.gz COYDNDRVDKGVAF-LJQANCHMSA-N 0 3 400.530 4.288 20 0 HIADHN CCOc1ccc(CN2CCC(n3cc(Br)cn3)CC2)cc1OCC ZINC000539827876 938949396 /nfs/dbraw/zinc/94/93/96/938949396.db2.gz LYDIJHBUHPBBGX-UHFFFAOYSA-N 0 3 408.340 4.280 20 0 HIADHN O=C(CC1CCCC1)NC1CCN(Cc2c[nH]nc2-c2ccc(Cl)cc2)CC1 ZINC000539833656 938952441 /nfs/dbraw/zinc/95/24/41/938952441.db2.gz HEAJQZPLEKHOOQ-UHFFFAOYSA-N 0 3 400.954 4.391 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@@H](C)N[C@@H](C)c2ccccc2N(C)C)cc1 ZINC000539854856 938958808 /nfs/dbraw/zinc/95/88/08/938958808.db2.gz MWBGGNGZUXDFAD-MSOLQXFVSA-N 0 3 403.592 4.195 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(-c2ccc(F)cc2)cc1)C(=O)Nc1ccc(C(N)=O)cc1 ZINC000539853720 938958852 /nfs/dbraw/zinc/95/88/52/938958852.db2.gz KUAGFTGUMBAGSZ-HZPDHXFCSA-N 0 3 405.473 4.269 20 0 HIADHN COc1cc(NC(=O)CCN2[C@H](C)Cc3cc(F)ccc3[C@@H]2C)cc(OC)c1OC ZINC000539887802 938966276 /nfs/dbraw/zinc/96/62/76/938966276.db2.gz YBGPMDPSAVIOLV-CABCVRRESA-N 0 3 416.493 4.188 20 0 HIADHN O=C(c1ncccc1C(F)(F)F)N(CCN1CCCC1)Cc1ccc(Cl)cc1 ZINC000539943832 938979995 /nfs/dbraw/zinc/97/99/95/938979995.db2.gz WEMSIRLSRWKEFP-UHFFFAOYSA-N 0 3 411.855 4.492 20 0 HIADHN CCCC(=O)Nc1ccc(CNCc2c(Cl)cccc2N2CCN(C)CC2)cc1 ZINC000539949205 938980575 /nfs/dbraw/zinc/98/05/75/938980575.db2.gz AONURNHNKWOUSD-UHFFFAOYSA-N 0 3 414.981 4.120 20 0 HIADHN Cc1c([C@H](C)NCc2ccc(Cn3cncn3)cc2)cnn1-c1cc(C)ccc1C ZINC000563571773 945220465 /nfs/dbraw/zinc/22/04/65/945220465.db2.gz COYDNDRVDKGVAF-IBGZPJMESA-N 0 3 400.530 4.288 20 0 HIADHN Cc1c(NC(=O)[C@H]2CCCN(Cc3cccnc3)C2)cnn1-c1ccc(Cl)cc1 ZINC000563578540 945222939 /nfs/dbraw/zinc/22/29/39/945222939.db2.gz YNDVUPBGVZFUHH-SFHVURJKSA-N 0 3 409.921 4.080 20 0 HIADHN CC(C)Cn1cc(NC(=O)NC[C@@H]2CCCN2Cc2ccccc2)c(C(F)F)n1 ZINC000540114215 939077576 /nfs/dbraw/zinc/07/75/76/939077576.db2.gz KSAPDIBQSKMFCM-KRWDZBQOSA-N 0 3 405.493 4.263 20 0 HIADHN COc1ccc2c(c1)CCC[C@@H]2NCc1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000540119677 939079626 /nfs/dbraw/zinc/07/96/26/939079626.db2.gz NENDHYHHHYHTBO-QHCPKHFHSA-N 0 3 414.571 4.037 20 0 HIADHN CCOc1ccc([C@@H](C)N[C@@H](C)c2cccc(NS(C)(=O)=O)c2)cc1OCC ZINC000540121528 939080830 /nfs/dbraw/zinc/08/08/30/939080830.db2.gz ZKNPGDKTEULSBR-JKSUJKDBSA-N 0 3 406.548 4.267 20 0 HIADHN CCN(CC)C(=O)Nc1ccc([C@H](C)N[C@@H]2CCN(Cc3ccccc3)C2=O)cc1 ZINC000540145912 939090766 /nfs/dbraw/zinc/09/07/66/939090766.db2.gz ZJBYUHFZMZTRLK-PGRDOPGGSA-N 0 3 408.546 4.012 20 0 HIADHN Fc1ccc(Br)c2c1CC[C@H]2NCCc1nnc(-c2ccccc2)o1 ZINC000540151973 939092679 /nfs/dbraw/zinc/09/26/79/939092679.db2.gz VBRWUDPOKHESJM-MRXNPFEDSA-N 0 3 402.267 4.458 20 0 HIADHN C[C@H](N[C@H]1CC(=O)N(C)[C@@H]1c1ccc(Cl)cc1)c1cccc(N2CCCC2=O)c1 ZINC000540155828 939094248 /nfs/dbraw/zinc/09/42/48/939094248.db2.gz MOFXFGZXPXJKDA-RWAHWCJQSA-N 0 3 411.933 4.089 20 0 HIADHN COc1ccc2c(c1)[C@H](NCc1ccc(Br)cc1N1CCOCC1)CC2 ZINC000540156980 939094699 /nfs/dbraw/zinc/09/46/99/939094699.db2.gz TZPLBCKVHUXHAL-HXUWFJFHSA-N 0 3 417.347 4.071 20 0 HIADHN C[C@H](NCc1cnc2ccccc2c1)c1ccc(S(=O)(=O)NCc2ccco2)cc1 ZINC000540169308 939100872 /nfs/dbraw/zinc/10/08/72/939100872.db2.gz CURFAMLIWNYBQP-KRWDZBQOSA-N 0 3 421.522 4.157 20 0 HIADHN COc1ccc(OC)c([C@@H](C)NC[C@H](c2cccc(Cl)c2)N2CCOCC2)c1 ZINC000540173435 939103157 /nfs/dbraw/zinc/10/31/57/939103157.db2.gz FBCTXCGODWYBOR-IIBYNOLFSA-N 0 3 404.938 4.081 20 0 HIADHN O=C(NCCN[C@@H]1CCCOc2cc(Br)ccc21)c1ccccc1Cl ZINC000540174671 939104279 /nfs/dbraw/zinc/10/42/79/939104279.db2.gz OBBNTTRJIUIIMO-QGZVFWFLSA-N 0 3 423.738 4.336 20 0 HIADHN CCOc1ccc([C@H](C)N[C@H](C)c2ccc(NS(C)(=O)=O)cc2)cc1OCC ZINC000540190200 939113972 /nfs/dbraw/zinc/11/39/72/939113972.db2.gz GVGHLKMWUWMPPP-CVEARBPZSA-N 0 3 406.548 4.267 20 0 HIADHN O=C(NCc1ccco1)c1cccc(CN[C@@H](C[C@@H]2CCOC2)c2ccccc2)c1 ZINC000540190241 939114449 /nfs/dbraw/zinc/11/44/49/939114449.db2.gz HUDGNVIVLHYMJG-RDPSFJRHSA-N 0 3 404.510 4.467 20 0 HIADHN CCOc1ccc([C@@H](C)N[C@H](C)c2ccc(NS(C)(=O)=O)cc2)cc1OCC ZINC000540190206 939114536 /nfs/dbraw/zinc/11/45/36/939114536.db2.gz GVGHLKMWUWMPPP-HZPDHXFCSA-N 0 3 406.548 4.267 20 0 HIADHN COc1cc(CN[C@@H](C)c2ccc(Cl)c(Cl)c2)ccc1OCC(=O)N(C)C ZINC000540192407 939117259 /nfs/dbraw/zinc/11/72/59/939117259.db2.gz KRBIPHRVKJHXCW-ZDUSSCGKSA-N 0 3 411.329 4.320 20 0 HIADHN COc1ccc2cc([C@@H](C)NCc3ccc(OCC(=O)N(C)C)c(OC)c3)ccc2c1 ZINC000540192836 939118181 /nfs/dbraw/zinc/11/81/81/939118181.db2.gz UPQBTNKLHKVPFJ-QGZVFWFLSA-N 0 3 422.525 4.175 20 0 HIADHN COc1ccc2c(c1)[C@@H](NCc1ccc(S(=O)(=O)N3CCCCC3)cc1)CCC2 ZINC000540195488 939120232 /nfs/dbraw/zinc/12/02/32/939120232.db2.gz WFSUBHKWVCCDSH-QHCPKHFHSA-N 0 3 414.571 4.037 20 0 HIADHN Cc1cc(C)cc(C(=O)N2CCCC[C@@H]2C(=O)Nc2cc(CN(C)C)ccc2C)c1 ZINC000540221582 939135777 /nfs/dbraw/zinc/13/57/77/939135777.db2.gz IMYOBOKIWRIFOY-HSZRJFAPSA-N 0 3 407.558 4.307 20 0 HIADHN C[C@@H](NCCN1c2cccc3cccc(c23)S1(=O)=O)c1cccc(OC(F)F)c1 ZINC000540319146 939192847 /nfs/dbraw/zinc/19/28/47/939192847.db2.gz KXNOUYISZCDOTK-CQSZACIVSA-N 0 3 418.465 4.301 20 0 HIADHN CCOc1ccc([C@H]2CCCN2C(=O)CN[C@@H](C)c2ccccc2-n2cccn2)cc1 ZINC000540359294 939208752 /nfs/dbraw/zinc/20/87/52/939208752.db2.gz HSPMEFFPJOWGII-WMZHIEFXSA-N 0 3 418.541 4.285 20 0 HIADHN COc1cc([C@H](C)NCc2ccc(C(=O)Nc3ccccc3)cc2)ccc1OCCO ZINC000540376318 939216484 /nfs/dbraw/zinc/21/64/84/939216484.db2.gz PJJRCRFZEFGYRL-SFHVURJKSA-N 0 3 420.509 4.169 20 0 HIADHN C[C@@H](NCC(=O)N(Cc1ccccc1)[C@@H](C)C1CC1)c1cccc(-n2cccn2)c1 ZINC000540388882 939226071 /nfs/dbraw/zinc/22/60/71/939226071.db2.gz ZBNMLGPBBSZDSZ-UXHICEINSA-N 0 3 402.542 4.350 20 0 HIADHN COc1cc(C(C)=O)ccc1OC[C@@H](O)CN[C@H](c1ccccc1Cl)C(C)C ZINC000540390386 939228854 /nfs/dbraw/zinc/22/88/54/939228854.db2.gz QDPNYZNLWSTFLW-JTSKRJEESA-N 0 3 405.922 4.278 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N[C@@H]1CCO[C@@H]1c1ccc(Cl)cc1 ZINC000540397562 939233823 /nfs/dbraw/zinc/23/38/23/939233823.db2.gz LJYDRCKNWFOXBX-QWFCFKBJSA-N 0 3 419.978 4.368 20 0 HIADHN Cc1cc(C)cc([C@@H](C)NCC(=O)Nc2cc(C(F)(F)F)ccc2-n2cncn2)c1 ZINC000540406262 939237143 /nfs/dbraw/zinc/23/71/43/939237143.db2.gz FNOGNSBYZFFBFF-OAHLLOKOSA-N 0 3 417.435 4.192 20 0 HIADHN O=C(CN[C@H](c1ccc(F)cc1)C1CCCC1)NC[C@@H]1CCN(c2ccccc2)C1 ZINC000540408309 939238037 /nfs/dbraw/zinc/23/80/37/939238037.db2.gz GMLLKCRDAUMBQW-DFBJGRDBSA-N 0 3 409.549 4.289 20 0 HIADHN O=C(CN[C@@H](c1ccc(F)cc1)C1CCCC1)Nc1cccc(N2CCCC2=O)c1 ZINC000540409854 939238551 /nfs/dbraw/zinc/23/85/51/939238551.db2.gz SRKLGMXJFTUHNW-XMMPIXPASA-N 0 3 409.505 4.412 20 0 HIADHN O=C(CN[C@@H](C[C@@H]1CCOC1)c1ccccc1)Nc1ccnn1CC1CCCCC1 ZINC000540432646 939246801 /nfs/dbraw/zinc/24/68/01/939246801.db2.gz JWNBUECZVCSVFC-UNMCSNQZSA-N 0 3 410.562 4.159 20 0 HIADHN COc1ccc(CNC(=O)[C@@H](C)N[C@H](C)c2ccc(-c3cccnc3)cc2)cc1OC ZINC000540433472 939246858 /nfs/dbraw/zinc/24/68/58/939246858.db2.gz RTTZSUUKPZLURE-QZTJIDSGSA-N 0 3 419.525 4.121 20 0 HIADHN CC(C)N(C)C(=O)C1CCN(C(=O)CN[C@H](CC2CCCC2)c2ccccc2)CC1 ZINC000540434451 939247298 /nfs/dbraw/zinc/24/72/98/939247298.db2.gz LZLWZTZIYCHHGB-HSZRJFAPSA-N 0 3 413.606 4.003 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(-n2cccn2)cc1)C(=O)Nc1ccc(Br)cc1 ZINC000540434957 939247387 /nfs/dbraw/zinc/24/73/87/939247387.db2.gz KPVXWOKVBPTDDU-LSDHHAIUSA-N 0 3 413.319 4.313 20 0 HIADHN COc1ccc(NC(=O)[C@H](C)N[C@H](C)c2ccc(-c3cccnc3)cc2)cc1OC ZINC000540433878 939247415 /nfs/dbraw/zinc/24/74/15/939247415.db2.gz ACNXSYDMIUEDMF-SJORKVTESA-N 0 3 405.498 4.444 20 0 HIADHN CCOC(=O)c1nn(-c2ccccc2)cc1CNC[C@@H]1CCCO[C@H]1c1ccccc1 ZINC000540570596 939308194 /nfs/dbraw/zinc/30/81/94/939308194.db2.gz FAZNXIFLXJFFNP-RDPSFJRHSA-N 0 3 419.525 4.307 20 0 HIADHN Cc1ccc([C@H](NC(=O)CN[C@H](c2ccc3c(c2)OCCO3)C2CC2)C2CC2)cc1 ZINC000540588774 939312031 /nfs/dbraw/zinc/31/20/31/939312031.db2.gz GDELYJFYZYENOH-DQEYMECFSA-N 0 3 406.526 4.074 20 0 HIADHN Cc1ccccc1[C@@H](NCC(=O)N1CCC[C@@H]1c1ccc2c(c1)OCCO2)C1CC1 ZINC000540588852 939312532 /nfs/dbraw/zinc/31/25/32/939312532.db2.gz JOKBTRQCKQQYET-BWKNWUBXSA-N 0 3 406.526 4.171 20 0 HIADHN C[C@H](c1ccc(Cl)cc1)N(C)C(=O)CN[C@H](c1ccc2c(c1)OCCO2)C1CC1 ZINC000540591206 939313127 /nfs/dbraw/zinc/31/31/27/939313127.db2.gz GFTNJOAFRJLCHO-CMJOXMDJSA-N 0 3 414.933 4.372 20 0 HIADHN Cc1nn2c(CNC(C)(C)COc3ncc(Cl)cc3Cl)c(C)nc2s1 ZINC000540622476 939322636 /nfs/dbraw/zinc/32/26/36/939322636.db2.gz LPVFPPTWPQPKRY-UHFFFAOYSA-N 0 3 400.335 4.057 20 0 HIADHN CC(C)n1cc(CNc2cccc(N3CCN(CCc4ccccc4)CC3)c2)cn1 ZINC000540650124 939330549 /nfs/dbraw/zinc/33/05/49/939330549.db2.gz OZWPOWHMPYQUIE-UHFFFAOYSA-N 0 3 403.574 4.441 20 0 HIADHN C[C@@H](N[C@H]1CCN(c2ccc(F)c(Cl)c2)C1=O)c1ccc(NC(=O)C2CC2)cc1 ZINC000540705580 939344573 /nfs/dbraw/zinc/34/45/73/939344573.db2.gz UXEQQVSWCWWVFR-XCLFUZPHSA-N 0 3 415.896 4.284 20 0 HIADHN CNS(=O)(=O)c1ccc([C@@H](C)NC2(c3ccc(Br)cc3)CCC2)cc1 ZINC000540723795 939349916 /nfs/dbraw/zinc/34/99/16/939349916.db2.gz LNWSSOOAIBCHNB-CQSZACIVSA-N 0 3 423.376 4.087 20 0 HIADHN C[C@@H](N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1)c1ccc2c(c1)COC2 ZINC000540751605 939359665 /nfs/dbraw/zinc/35/96/65/939359665.db2.gz IJWSOQSRQADSPM-KBMIEXCESA-N 0 3 400.522 4.295 20 0 HIADHN C[C@H](Nc1cccc(CN2CCSCC2)c1)[C@@H](c1ccccc1)N1CCOCC1 ZINC000540787123 939371813 /nfs/dbraw/zinc/37/18/13/939371813.db2.gz CCZIQYUOYYDSPI-RDPSFJRHSA-N 0 3 411.615 4.109 20 0 HIADHN Cc1nc([C@H]2CCCN([C@H](C)c3nnc(-c4ccc(Cl)c(Cl)c4)o3)C2)n[nH]1 ZINC000540862520 939400614 /nfs/dbraw/zinc/40/06/14/939400614.db2.gz QXBJSAZHLPVBJO-MFKMUULPSA-N 0 3 407.305 4.411 20 0 HIADHN Cc1n[nH]c([C@H]2CCCN([C@H](C)c3nnc(-c4ccc(Cl)c(Cl)c4)o3)C2)n1 ZINC000540862520 939400616 /nfs/dbraw/zinc/40/06/16/939400616.db2.gz QXBJSAZHLPVBJO-MFKMUULPSA-N 0 3 407.305 4.411 20 0 HIADHN Cc1nnc([C@H]2CCCN([C@H](C)c3nnc(-c4ccc(Cl)c(Cl)c4)o3)C2)[nH]1 ZINC000540862520 939400619 /nfs/dbraw/zinc/40/06/19/939400619.db2.gz QXBJSAZHLPVBJO-MFKMUULPSA-N 0 3 407.305 4.411 20 0 HIADHN CC(C)CNC(=O)c1cccc(CN2CCC[C@H](c3nc(-c4ccccc4)n[nH]3)C2)c1 ZINC000540863637 939401308 /nfs/dbraw/zinc/40/13/08/939401308.db2.gz OQWWNESPPZLRGK-QFIPXVFZSA-N 0 3 417.557 4.237 20 0 HIADHN C[C@@]1(NCC(=O)Nc2cc3c(cc2Cl)OCCCO3)CCCc2ccccc21 ZINC000540906938 939415405 /nfs/dbraw/zinc/41/54/05/939415405.db2.gz HCQMTSJARVDVIX-JOCHJYFZSA-N 0 3 400.906 4.281 20 0 HIADHN C[C@H](C[C@@H]1CCCO1)N[C@H](c1cccc(S(C)(=O)=O)c1)c1ccc(F)c(F)c1 ZINC000540913930 939416076 /nfs/dbraw/zinc/41/60/76/939416076.db2.gz NKTLVUTTYDYHGZ-DAESXHAQSA-N 0 3 409.498 4.005 20 0 HIADHN Cc1ccc([C@@H](NCCc2ccc3c(c2)OCO3)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000540915678 939416807 /nfs/dbraw/zinc/41/68/07/939416807.db2.gz PEPTYEIDGQBBEV-XMMPIXPASA-N 0 3 423.534 4.049 20 0 HIADHN Cc1nn(-c2ccccc2)cc1NC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1 ZINC000540978950 939423691 /nfs/dbraw/zinc/42/36/91/939423691.db2.gz CQBYHGYSWHZRBC-IBGZPJMESA-N 0 3 403.530 4.309 20 0 HIADHN CS(=O)(=O)[C@H]1CCC[C@H](NCc2ccc(-c3cccc(C(F)(F)F)c3)o2)C1 ZINC000540979876 939424158 /nfs/dbraw/zinc/42/41/58/939424158.db2.gz SBGAJLWEUGPBRF-RDJZCZTQSA-N 0 3 401.450 4.411 20 0 HIADHN COc1ccc([C@H](NC(=O)CN[C@@H](C)c2ccc(-n3ccnc3C)cc2)C2CC2)cc1 ZINC000541027278 939435241 /nfs/dbraw/zinc/43/52/41/939435241.db2.gz YMZVSIYUSKMKGY-SSOJOUAXSA-N 0 3 418.541 4.107 20 0 HIADHN CC(C)N(CCN(C)C)C(=O)Nc1ccc(C(=O)N2CCC[C@@H]2c2ccccc2)cc1 ZINC000541042020 939439223 /nfs/dbraw/zinc/43/92/23/939439223.db2.gz IXEVUNLTWMJKKW-HSZRJFAPSA-N 0 3 422.573 4.468 20 0 HIADHN COc1cccc(F)c1[C@@H](C)NCC1(CN[C@H](C)c2c(F)cccc2OC)COC1 ZINC000541123697 939469489 /nfs/dbraw/zinc/46/94/89/939469489.db2.gz ZXHCWMHVYLJNRH-HZPDHXFCSA-N 0 3 420.500 4.000 20 0 HIADHN C[C@@H](CCc1n[nH]c2ccccc21)N[C@H](CCO)c1ccccc1Br ZINC000541153019 939478151 /nfs/dbraw/zinc/47/81/51/939478151.db2.gz DEUAVJKARMCAOK-KBXCAEBGSA-N 0 3 402.336 4.360 20 0 HIADHN Cc1ccc2c(c1C)OC[C@@H]2N[C@@H](C)CC(=O)Nc1ccc(NC(=O)C2CC2)cc1 ZINC000541213311 939485944 /nfs/dbraw/zinc/48/59/44/939485944.db2.gz KNFVLSBXNZWCAB-BTYIYWSLSA-N 0 3 407.514 4.092 20 0 HIADHN C[C@@H](CNC(=O)N(C)[C@@H](c1ccc(Cl)cc1)C1CCCC1)CN1CCN(C)CC1 ZINC000541248615 939487584 /nfs/dbraw/zinc/48/75/84/939487584.db2.gz DMOQJBRIASTFBN-PGRDOPGGSA-N 0 3 421.029 4.096 20 0 HIADHN Cc1sc2nc(CN3CCN(CCCc4ccc(C)cc4)CC3)[nH]c(=O)c2c1C ZINC000541282056 939489191 /nfs/dbraw/zinc/48/91/91/939489191.db2.gz SOISODXDNXVSGA-UHFFFAOYSA-N 0 3 410.587 4.073 20 0 HIADHN NC(=O)[C@@H](Cc1ccc(C(F)(F)F)cc1)NCCSc1ccc(Cl)cc1 ZINC000541302075 939490119 /nfs/dbraw/zinc/49/01/19/939490119.db2.gz ITIOJVIABRJPLA-MRXNPFEDSA-N 0 3 402.869 4.137 20 0 HIADHN COc1cccc([C@@H]2[C@@H](c3ccccc3)CCN2C(=O)N[C@@H]2CCN(C3CC3)C2)c1 ZINC000541342962 939492978 /nfs/dbraw/zinc/49/29/78/939492978.db2.gz HEGFTYHAFLKNOC-AGILITTLSA-N 0 3 405.542 4.172 20 0 HIADHN CO[C@@H](c1ccccc1F)[C@@H](C)NCc1cnc2c(C)cc(Br)cn12 ZINC000541378041 939500908 /nfs/dbraw/zinc/50/09/08/939500908.db2.gz JAOTXOJRWWXUGG-FZKQIMNGSA-N 0 3 406.299 4.410 20 0 HIADHN CC(C)(C)c1ccc(OC[C@H](O)CNCc2ccc(C(=O)N3CCCCC3)cc2)cc1 ZINC000563695799 945255165 /nfs/dbraw/zinc/25/51/65/945255165.db2.gz GNZDJWYWMDMBCD-HSZRJFAPSA-N 0 3 424.585 4.140 20 0 HIADHN Cc1nn(-c2ccccc2)c(Oc2ccc(F)cc2)c1CN1C[C@@H]2CC[C@H](O)[C@H]2C1 ZINC000541554430 939554358 /nfs/dbraw/zinc/55/43/58/939554358.db2.gz FTSNXYFOIJVDGI-RTFZILSDSA-N 0 3 407.489 4.315 20 0 HIADHN O=C(Cc1nc(-c2ccc(F)cc2)cs1)N[C@H](CN1CCCC1)c1ccccc1 ZINC000541557330 939554560 /nfs/dbraw/zinc/55/45/60/939554560.db2.gz DTTIKYPAMJREBE-HXUWFJFHSA-N 0 3 409.530 4.445 20 0 HIADHN O=C(CN[C@@H](Cc1ccccc1)c1cccs1)NC[C@@H]1CCN(c2ccccc2)C1 ZINC000541597222 939562868 /nfs/dbraw/zinc/56/28/68/939562868.db2.gz ODABVMVYPIOSAE-GMAHTHKFSA-N 0 3 419.594 4.264 20 0 HIADHN O=C(CN[C@H](Cc1ccccc1)c1cccs1)NC[C@H]1CCN(c2ccccc2)C1 ZINC000541597220 939563110 /nfs/dbraw/zinc/56/31/10/939563110.db2.gz ODABVMVYPIOSAE-FYYLOGMGSA-N 0 3 419.594 4.264 20 0 HIADHN C[C@H](NCC(=O)Nc1ccc2c(c1)OC1(CCCCC1)O2)[C@H]1COc2ccccc21 ZINC000541701361 939609222 /nfs/dbraw/zinc/60/92/22/939609222.db2.gz QVMPNKHVUWFEMC-QFBILLFUSA-N 0 3 408.498 4.211 20 0 HIADHN C[C@H](C(=O)Nc1ccc2c(c1)OC1(CCCCC1)O2)N1CCC2(CCOCC2)[C@H]1C ZINC000541718204 939613521 /nfs/dbraw/zinc/61/35/21/939613521.db2.gz NISHPKMGQFSELJ-QZTJIDSGSA-N 0 3 414.546 4.336 20 0 HIADHN CCCCSc1ccc(Cl)cc1C(=O)N1CC[C@@H](N2CCN(C)CC2)[C@H](C)C1 ZINC000541720493 939614326 /nfs/dbraw/zinc/61/43/26/939614326.db2.gz LSDUMGVLSPONJS-YLJYHZDGSA-N 0 3 424.054 4.330 20 0 HIADHN OC[C@H](CN[C@H](c1ccccc1)c1cncnc1)Cc1ccccc1C(F)(F)F ZINC000541743336 939618871 /nfs/dbraw/zinc/61/88/71/939618871.db2.gz IGTXCUJLVIGJOT-HRAATJIYSA-N 0 3 401.432 4.026 20 0 HIADHN O=C(CCNCc1c(C2CC2)nc2sccn12)Nc1ccc(Br)cc1 ZINC000541761545 939623739 /nfs/dbraw/zinc/62/37/39/939623739.db2.gz DVVYLLMNLKCYTR-UHFFFAOYSA-N 0 3 419.348 4.154 20 0 HIADHN CCC[C@H](NCc1ccccc1CS(=O)(=O)N1CCC(C)CC1)c1cccnc1 ZINC000541767040 939625373 /nfs/dbraw/zinc/62/53/73/939625373.db2.gz QWMMRCMGZCRJKG-QHCPKHFHSA-N 0 3 415.603 4.274 20 0 HIADHN COc1cc(-c2ccccc2)sc1C(=O)N1C[C@@H](N2CCCC2)[C@@H](SC)C1 ZINC000541842760 939646031 /nfs/dbraw/zinc/64/60/31/939646031.db2.gz LCKODKVTPWCITD-APWZRJJASA-N 0 3 402.585 4.076 20 0 HIADHN COC(=O)c1ccc(CNC2(c3ccc(OCc4ccccc4)cc3)CCOCC2)[nH]1 ZINC000541918832 939653975 /nfs/dbraw/zinc/65/39/75/939653975.db2.gz BOUGQTUKOMQWOT-UHFFFAOYSA-N 0 3 420.509 4.176 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CCC(c2ccc(C)nc2)CC1)c1cccc(OC)c1 ZINC000542111533 939718082 /nfs/dbraw/zinc/71/80/82/939718082.db2.gz KADBGLCXUGJMLK-DEOSSOPVSA-N 0 3 424.589 4.371 20 0 HIADHN CC[C@H](NCc1ccc(OCc2ccccc2)cc1)c1cccc(S(N)(=O)=O)c1 ZINC000542134840 939724974 /nfs/dbraw/zinc/72/49/74/939724974.db2.gz JVZYBTZFAJGTIW-QHCPKHFHSA-N 0 3 410.539 4.154 20 0 HIADHN CN(CC[C@H]1CCCCN1C)C(=O)c1ccccc1C(=O)c1ccc(F)c(F)c1 ZINC000542145650 939729703 /nfs/dbraw/zinc/72/97/03/939729703.db2.gz OACPHUVLDVOLQW-QGZVFWFLSA-N 0 3 400.469 4.142 20 0 HIADHN COc1ccc(-c2n[nH]cc2CN2CCC[C@H](n3ccc(C(F)(F)F)n3)C2)cc1 ZINC000542174623 939744446 /nfs/dbraw/zinc/74/44/46/939744446.db2.gz GELRZPRZYQTRSA-INIZCTEOSA-N 0 3 405.424 4.138 20 0 HIADHN Cc1ccc(CNC(=O)c2cccc(CNCc3cc(-n4ccnc4)cs3)c2)cc1 ZINC000542317247 939799046 /nfs/dbraw/zinc/79/90/46/939799046.db2.gz TZAJWDWYKUSWRV-UHFFFAOYSA-N 0 3 416.550 4.462 20 0 HIADHN CCc1cnc(CNCc2ccccc2CN2CCN(c3ccccc3)CC2)s1 ZINC000542320631 939800014 /nfs/dbraw/zinc/80/00/14/939800014.db2.gz SMTQDXDLEFPXDU-UHFFFAOYSA-N 0 3 406.599 4.318 20 0 HIADHN Cc1ccc([C@@H]2CCN(CC(=O)N3CCC[C@@H]3c3ccc4c(c3)OCCCO4)C2)cc1 ZINC000542323107 939800419 /nfs/dbraw/zinc/80/04/19/939800419.db2.gz PINQMURUDZSCMU-DHIUTWEWSA-N 0 3 420.553 4.309 20 0 HIADHN CN(C)[C@@H](CNC(=O)N1CCC[C@@H](c2nnc(C3CCCCC3)[nH]2)C1)c1ccccc1 ZINC000542376529 939810295 /nfs/dbraw/zinc/81/02/95/939810295.db2.gz NTVUSGVQOYCYBS-RTWAWAEBSA-N 0 3 424.593 4.044 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3ccc(-c4ccc[nH]4)cc3)CC2)C[C@@H](C)O1 ZINC000542380148 939810899 /nfs/dbraw/zinc/81/08/99/939810899.db2.gz QWKOWFOYLQRJII-RTBURBONSA-N 0 3 410.562 4.425 20 0 HIADHN C[C@H](N[C@@H]1CCCN(Cc2ccccn2)C1=O)c1ccc(SCC(F)F)cc1 ZINC000542501248 939833485 /nfs/dbraw/zinc/83/34/85/939833485.db2.gz RPZZKDDFCAWDCA-HNAYVOBHSA-N 0 3 405.514 4.281 20 0 HIADHN O=C(CN[C@H](c1cccs1)C1CC1)Nc1c(F)cc(F)cc1Br ZINC000542509027 939834524 /nfs/dbraw/zinc/83/45/24/939834524.db2.gz GNSFUXHZFUANLT-HNNXBMFYSA-N 0 3 401.276 4.468 20 0 HIADHN COC(=O)c1ccc(CNC(=O)[C@H](C)N[C@H](Cc2ccccc2)c2cccs2)cc1 ZINC000542521033 939836634 /nfs/dbraw/zinc/83/66/34/939836634.db2.gz JIANSRPTDBDJCN-LAUBAEHRSA-N 0 3 422.550 4.113 20 0 HIADHN Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)NC[C@@H](O)COc1ccc2ccccc2c1 ZINC000542531948 939838506 /nfs/dbraw/zinc/83/85/06/939838506.db2.gz MMRPIQMVSVEFKP-IFXJQAMLSA-N 0 3 421.463 4.306 20 0 HIADHN Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)NC[C@@H](O)COc1ccccc1C(C)C ZINC000542534607 939839289 /nfs/dbraw/zinc/83/92/89/939839289.db2.gz YQAIBVXQHVRMJX-RHSMWYFYSA-N 0 3 413.484 4.276 20 0 HIADHN C[S@](=O)C[C@H](NCCOc1ccc(Cl)cc1Br)c1ccccc1 ZINC000542539054 939840263 /nfs/dbraw/zinc/84/02/63/939840263.db2.gz UECOYSQFGKJKFU-HJPURHCSSA-N 0 3 416.768 4.191 20 0 HIADHN C[C@H](NCc1csc(-c2ccc(S(C)(=O)=O)cc2)n1)[C@@H](C)c1ccccc1 ZINC000542542576 939841217 /nfs/dbraw/zinc/84/12/17/939841217.db2.gz AECIMHURBZVYHN-CVEARBPZSA-N 0 3 400.569 4.495 20 0 HIADHN Cc1cnc([C@@H](C)CNC(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)s1 ZINC000542554483 939842669 /nfs/dbraw/zinc/84/26/69/939842669.db2.gz JKGYAWPXBPSUOD-RDJZCZTQSA-N 0 3 406.621 4.389 20 0 HIADHN CC(C)C[C@H](NCC(=O)NC1CCN(C(=O)C2CCCCC2)CC1)c1cccs1 ZINC000542556965 939843300 /nfs/dbraw/zinc/84/33/00/939843300.db2.gz VBLCPDRRTICNLI-FQEVSTJZSA-N 0 3 419.635 4.112 20 0 HIADHN Cc1ccc(CN(C(=O)CN(C)[C@@H]2CCO[C@@H](c3ccc(F)cc3)C2)C2CC2)cc1 ZINC000542626260 939850105 /nfs/dbraw/zinc/85/01/05/939850105.db2.gz AELGUAMPCRTUQI-DNQXCXABSA-N 0 3 410.533 4.477 20 0 HIADHN CCN1CCN([C@H](C)CNC(=O)c2cc(Cl)ccc2SC2CCCC2)CC1 ZINC000542659288 939852140 /nfs/dbraw/zinc/85/21/40/939852140.db2.gz NDGMPGKVTXLNTM-MRXNPFEDSA-N 0 3 410.027 4.131 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@@H]2N[C@@H](CCCO)c2ccccc2)cc1 ZINC000542662899 939852507 /nfs/dbraw/zinc/85/25/07/939852507.db2.gz VJGPAXWYLVQPRD-RJGXRXQPSA-N 0 3 401.572 4.183 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@H]2NCc2ccccc2-n2ccnc2)cc1 ZINC000542664429 939852569 /nfs/dbraw/zinc/85/25/69/939852569.db2.gz KQIQDZMZIZLKOU-FYYLOGMGSA-N 0 3 409.555 4.055 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@H]2CCCC[C@H]2NCc2ccc(-n3cccn3)cc2)cc1 ZINC000542672229 939853156 /nfs/dbraw/zinc/85/31/56/939853156.db2.gz XCEVTQWCSORHGZ-PKTZIBPZSA-N 0 3 409.555 4.055 20 0 HIADHN CCn1cc(C(=O)NCc2ccccc2CN2CCCC2)c(=O)c2cc(Cl)ccc21 ZINC000542698268 939855063 /nfs/dbraw/zinc/85/50/63/939855063.db2.gz KUPMEXIZBVPBFR-UHFFFAOYSA-N 0 3 423.944 4.201 20 0 HIADHN CCN(C(=O)Nc1ncn(C2CCCCC2)n1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000542718147 939856459 /nfs/dbraw/zinc/85/64/59/939856459.db2.gz KXSSLCBFKYIIJM-WIYYLYMNSA-N 0 3 410.566 4.473 20 0 HIADHN Cc1cc(NC(=O)[C@@H]2CCCN(Cc3cccnc3)C2)cnc1N1CCCC[C@H]1C ZINC000542816294 939861393 /nfs/dbraw/zinc/86/13/93/939861393.db2.gz PUJCCBNKMKVGLS-TZIWHRDSSA-N 0 3 407.562 4.015 20 0 HIADHN Cc1cc(NC(=O)[C@@H]2CCCN(Cc3cccnc3)C2)cnc1N1CCCC[C@@H]1C ZINC000542816293 939861402 /nfs/dbraw/zinc/86/14/02/939861402.db2.gz PUJCCBNKMKVGLS-PZJWPPBQSA-N 0 3 407.562 4.015 20 0 HIADHN COCC[C@H](Cc1cccc(F)c1)N[C@@H](CCO)c1ccccc1Br ZINC000542852203 939863153 /nfs/dbraw/zinc/86/31/53/939863153.db2.gz VPFBFERTOQNVQU-XLIONFOSSA-N 0 3 410.327 4.249 20 0 HIADHN Cc1cc(NC(=O)C[C@@H]2CCO[C@H](C(C)C)C2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000542886657 939865419 /nfs/dbraw/zinc/86/54/19/939865419.db2.gz JQMJQESAETVNES-VJBWXMMDSA-N 0 3 424.589 4.418 20 0 HIADHN CN(CCC(=O)N1CCCCC1)Cc1cn(-c2ccccc2)nc1-c1cccs1 ZINC000542915324 939877051 /nfs/dbraw/zinc/87/70/51/939877051.db2.gz QKPAHJZURZQWKG-UHFFFAOYSA-N 0 3 408.571 4.435 20 0 HIADHN COc1cc(CNCc2cn(C)nc2-c2ccccc2)ccc1OCc1ccncc1 ZINC000542949615 939884132 /nfs/dbraw/zinc/88/41/32/939884132.db2.gz KJQRWNGNBAOBCH-UHFFFAOYSA-N 0 3 414.509 4.360 20 0 HIADHN O[C@H](CN[C@@H](Cc1ccc(Cl)cc1)c1ccccn1)COc1ccccc1F ZINC000543051763 939909359 /nfs/dbraw/zinc/90/93/59/939909359.db2.gz FTDLALQJSYYIRM-NQIIRXRSSA-N 0 3 400.881 4.187 20 0 HIADHN Cc1nc(-c2ccc(C)cc2NC(=O)CN[C@@H](c2ccc(Cl)cc2)C2CC2)n[nH]1 ZINC000543063541 939915674 /nfs/dbraw/zinc/91/56/74/939915674.db2.gz QQVVWQFCTLVKOX-OAQYLSRUSA-N 0 3 409.921 4.421 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CNC(=O)CN[C@@H](c1ccc(Cl)cc1)C1CC1 ZINC000543063758 939917510 /nfs/dbraw/zinc/91/75/10/939917510.db2.gz OOLIHIDTEDTYDD-XMMPIXPASA-N 0 3 422.960 4.500 20 0 HIADHN COC(=O)CN1CCC(N[C@@H](C)c2nc(-c3ccc(Cl)cc3)c(C)s2)CC1 ZINC000543097498 939942422 /nfs/dbraw/zinc/94/24/22/939942422.db2.gz LYNRESFWNYMQSO-ZDUSSCGKSA-N 0 3 407.967 4.060 20 0 HIADHN O=C(Nc1ccc(O)cc1)C1CCN(CCCc2ccccc2Br)CC1 ZINC000543138397 939966189 /nfs/dbraw/zinc/96/61/89/939966189.db2.gz INSJFFZOWNMAFJ-UHFFFAOYSA-N 0 3 417.347 4.438 20 0 HIADHN O=C1CCCN1C[C@@H](NCCc1cccc(F)c1F)c1cccc(C(F)(F)F)c1 ZINC000543182767 939988972 /nfs/dbraw/zinc/98/89/72/939988972.db2.gz XPHYLUMJIUMKST-GOSISDBHSA-N 0 3 412.402 4.479 20 0 HIADHN C[C@H](CN(C)C(=O)N[C@H](CN1CCc2ccccc2C1)C(C)(C)C)c1nccs1 ZINC000543338202 940035103 /nfs/dbraw/zinc/03/51/03/940035103.db2.gz IJTHHQRWFUTSDZ-YLJYHZDGSA-N 0 3 414.619 4.361 20 0 HIADHN O=C(C1CCC(N[C@H](c2ccccc2)c2ccc(F)cn2)CC1)N1CCSCC1 ZINC000543402873 940052819 /nfs/dbraw/zinc/05/28/19/940052819.db2.gz PIZBVDPIVYVNKT-ZOGYUUGASA-N 0 3 413.562 4.034 20 0 HIADHN Cc1ccc(NC(=O)CN[C@H](C)[C@H]2Oc3ccccc3[C@@H]2C)c(Br)c1 ZINC000543549943 940105489 /nfs/dbraw/zinc/10/54/89/940105489.db2.gz ZJPPHAHDRMAZEN-MNVSYLFESA-N 0 3 403.320 4.239 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)Nc1csc(-c2ccccn2)n1 ZINC000543621055 940136044 /nfs/dbraw/zinc/13/60/44/940136044.db2.gz CWNQXMXTJCVCQB-UHFFFAOYSA-N 0 3 415.950 4.454 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCC[C@H]1C(C)(C)O)c1ccc(C(F)(F)F)cc1 ZINC000543691664 940161040 /nfs/dbraw/zinc/16/10/40/940161040.db2.gz WVEWTTLQQJLYNV-MSOLQXFVSA-N 0 3 415.500 4.033 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)N[C@@H](c1c(F)cccc1F)C(F)(F)F ZINC000543737236 940172343 /nfs/dbraw/zinc/17/23/43/940172343.db2.gz IZTOWHIJRHECIW-KRWDZBQOSA-N 0 3 417.378 4.460 20 0 HIADHN CC[C@H](CNC(=O)Nc1cn(-c2ccccc2)nc1C)N1CCc2ccccc2C1 ZINC000543766797 940179292 /nfs/dbraw/zinc/17/92/92/940179292.db2.gz LNNAUQMEZDUXLJ-OAQYLSRUSA-N 0 3 403.530 4.139 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)NCC(=O)Nc2ccnn2CC2CCCCC2)cc1 ZINC000543813864 940195907 /nfs/dbraw/zinc/19/59/07/940195907.db2.gz XYNOHPUQWJTHFC-GOSISDBHSA-N 0 3 420.561 4.247 20 0 HIADHN COc1cccc2c1CCN(CCC(=O)N[C@H](c1cccs1)c1ccccc1)C2 ZINC000543875945 940220981 /nfs/dbraw/zinc/22/09/81/940220981.db2.gz LTMMRWWPIVWKII-DEOSSOPVSA-N 0 3 406.551 4.411 20 0 HIADHN Cn1nccc1[C@@H]1CCCCN1C(=O)N[C@@H](CN1CCc2ccccc2C1)C(C)(C)C ZINC000543877252 940221446 /nfs/dbraw/zinc/22/14/46/940221446.db2.gz SLXOTRRVFAGZAS-GOTSBHOMSA-N 0 3 423.605 4.130 20 0 HIADHN Cc1ccnc(OC2CCN(CCC(=O)Nc3ccccc3C(F)(F)F)CC2)c1 ZINC000543907746 940236893 /nfs/dbraw/zinc/23/68/93/940236893.db2.gz XWSWCAOPHIPBNT-UHFFFAOYSA-N 0 3 407.436 4.281 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cc(-c2cnn(C)c2)ccc1F)c1ccsc1 ZINC000543932828 940251818 /nfs/dbraw/zinc/25/18/18/940251818.db2.gz RBSOXURMQOMJST-HXUWFJFHSA-N 0 3 400.523 4.101 20 0 HIADHN NC(=O)C1CCN(c2ncccc2CN[C@H](c2ccccc2)C2CCCCC2)CC1 ZINC000543940952 940256609 /nfs/dbraw/zinc/25/66/09/940256609.db2.gz OOPUUTSDDNULQZ-HSZRJFAPSA-N 0 3 406.574 4.195 20 0 HIADHN CN(C)[C@@H](CNC(=O)N1CCC(CCCn2ccnc2)CC1)c1ccc(Cl)cc1 ZINC000543972384 940278378 /nfs/dbraw/zinc/27/83/78/940278378.db2.gz UANXHVHIMZZNGY-NRFANRHFSA-N 0 3 417.985 4.041 20 0 HIADHN C[C@@H](C(=O)N1CCC[C@@H]1c1cccs1)N1CCC(CCCn2ccnc2)CC1 ZINC000543987775 940284160 /nfs/dbraw/zinc/28/41/60/940284160.db2.gz INFUPFXDJIZPDD-AZUAARDMSA-N 0 3 400.592 4.189 20 0 HIADHN COc1cc(Cl)ccc1CN[C@@H](C)CC(=O)Nc1ccc(NC(=O)C2CC2)cc1 ZINC000544011016 940298164 /nfs/dbraw/zinc/29/81/64/940298164.db2.gz MSYKHCMWRUMIHG-AWEZNQCLSA-N 0 3 415.921 4.204 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)NC2(c3ccc(Cl)c(Cl)c3)CC2)CC1 ZINC000544026136 940303735 /nfs/dbraw/zinc/30/37/35/940303735.db2.gz ITYVIAPXAVAQBM-UHFFFAOYSA-N 0 3 414.377 4.171 20 0 HIADHN CC(C)(C)N(Cc1ccccc1)C(=O)CN[C@@H]1c2ccccc2CC12CCOCC2 ZINC000563839070 945310186 /nfs/dbraw/zinc/31/01/86/945310186.db2.gz AUUZPTDEHCPTIL-XMMPIXPASA-N 0 3 406.570 4.498 20 0 HIADHN COc1ccc(Oc2ccc(CNCc3ccc(NS(C)(=O)=O)cc3)cc2)cc1 ZINC000544189086 940348592 /nfs/dbraw/zinc/34/85/92/940348592.db2.gz CYSICKRWLWLEPY-UHFFFAOYSA-N 0 3 412.511 4.149 20 0 HIADHN C[C@H](CNC(=O)[C@H]1CCn2c(cnc2C2CCCCC2)C1)N(C)Cc1ccccc1 ZINC000544224926 940360072 /nfs/dbraw/zinc/36/00/72/940360072.db2.gz NIAGNQBPKXVCMO-KNQAVFIVSA-N 0 3 408.590 4.130 20 0 HIADHN CC1CCC(N2CCN(C(=O)[C@@H]3CCn4c(cnc4C4CCCCC4)C3)CC2)CC1 ZINC000544225712 940360233 /nfs/dbraw/zinc/36/02/33/940360233.db2.gz ZCXBOONDOYHCDX-NJEKYYFSSA-N 0 3 412.622 4.216 20 0 HIADHN CC(C)Oc1c(F)cc(NC(=O)c2ccc(CN3CCC(CO)CC3)cc2)cc1F ZINC000544239221 940364579 /nfs/dbraw/zinc/36/45/79/940364579.db2.gz FFMFDELNRFUVIQ-UHFFFAOYSA-N 0 3 418.484 4.209 20 0 HIADHN CSc1c(F)cc(NC(=O)N2CCC(CN3C[C@@H](C)O[C@H](C)C3)CC2)cc1F ZINC000544273807 940375859 /nfs/dbraw/zinc/37/58/59/940375859.db2.gz SPHIURHBSGKWAY-ZIAGYGMSSA-N 0 3 413.534 4.040 20 0 HIADHN O=C(NCCc1ccc(F)c(F)c1F)Nc1ccc(CCN2CCSCC2)cc1 ZINC000544278548 940377291 /nfs/dbraw/zinc/37/72/91/940377291.db2.gz ZKRHFGXEMHNTRD-UHFFFAOYSA-N 0 3 423.504 4.059 20 0 HIADHN COc1cccc([C@H]2C[C@@H](C)CN2C(=O)CCCN2CCN(c3ccccc3)CC2)c1 ZINC000544319156 940389145 /nfs/dbraw/zinc/38/91/45/940389145.db2.gz PROFOMUNOWGTAG-PXDATVDWSA-N 0 3 421.585 4.207 20 0 HIADHN Cc1cc([C@H](NC[C@H](c2ccccc2)N2CCOCC2)c2cccnc2)ccc1F ZINC000544359398 940401002 /nfs/dbraw/zinc/40/10/02/940401002.db2.gz ADJYWMLPASXLPK-RPBOFIJWSA-N 0 3 405.517 4.282 20 0 HIADHN CCc1nc(CC(=O)N[C@H](c2ccc(F)c(F)c2)C(C)(C)N2CCCC2)cs1 ZINC000544364378 940402561 /nfs/dbraw/zinc/40/25/61/940402561.db2.gz SYKDCUNADSTLDJ-HXUWFJFHSA-N 0 3 407.530 4.258 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)CN[C@@H](c2cccs2)C2CC2)c(OC)c1 ZINC000544400091 940412573 /nfs/dbraw/zinc/41/25/73/940412573.db2.gz POSQVEACGRRYEH-PGRDOPGGSA-N 0 3 400.544 4.170 20 0 HIADHN O=C(CC[C@@H]1CCCCO1)N(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000563877648 945319152 /nfs/dbraw/zinc/31/91/52/945319152.db2.gz UDMKETKYUSFAKM-RPBOFIJWSA-N 0 3 421.585 4.424 20 0 HIADHN C[C@@H](N[C@@H](CC(N)=O)C1CCCCC1)C(=O)Nc1ccccc1Cc1ccccc1 ZINC000544455459 940438413 /nfs/dbraw/zinc/43/84/13/940438413.db2.gz AYCRFTATCPGXMM-JPYJTQIMSA-N 0 3 407.558 4.018 20 0 HIADHN COc1ccc(C2(C(=O)NC[C@H](c3ccc(C)cc3)N3CCCC3)CCC2)cc1OC ZINC000544523302 940471454 /nfs/dbraw/zinc/47/14/54/940471454.db2.gz WUKHWKCDSCXCGL-JOCHJYFZSA-N 0 3 422.569 4.387 20 0 HIADHN Cc1ccc([C@H](NC(=O)CN[C@H](C)[C@@H]2COc3ccccc32)c2cccs2)cc1 ZINC000544528187 940472053 /nfs/dbraw/zinc/47/20/53/940472053.db2.gz GXGPIONFTDBKEO-YQOVMPOYSA-N 0 3 406.551 4.416 20 0 HIADHN C[C@H](NCC(=O)N[C@@H](c1cccs1)c1ccc(F)cc1)[C@@H]1COc2ccccc21 ZINC000544527782 940472447 /nfs/dbraw/zinc/47/24/47/940472447.db2.gz CTRHUBAUPIDARP-IGCHPXFFSA-N 0 3 410.514 4.247 20 0 HIADHN Cc1ccc(S(=O)(=O)C[C@@H](C)NCCc2nc(C3CCCCC3)cs2)cc1 ZINC000544575452 940482838 /nfs/dbraw/zinc/48/28/38/940482838.db2.gz JQUPNYHTXVCOJS-QGZVFWFLSA-N 0 3 406.617 4.494 20 0 HIADHN CCC[C@@H](NCc1ccc(S(=O)(=O)N2CCC[C@H](C)C2)cc1)c1cccnc1 ZINC000544580335 940484155 /nfs/dbraw/zinc/48/41/55/940484155.db2.gz RBPUONQPHZUZHN-PGRDOPGGSA-N 0 3 401.576 4.133 20 0 HIADHN O=C(Nc1ccc(Br)c(Cl)c1Cl)N1CC[C@H](N2CC=CC2)C1 ZINC000544624142 940492837 /nfs/dbraw/zinc/49/28/37/940492837.db2.gz ANIFQPDABPJGSU-JTQLQIEISA-N 0 3 405.123 4.234 20 0 HIADHN COc1cc2c(cc1CN[C@H](C)[C@H](OC)c1ccc(Br)cc1)OCO2 ZINC000544709558 940505519 /nfs/dbraw/zinc/50/55/19/940505519.db2.gz DLDKVGOFYITCHY-BLVKFPJESA-N 0 3 408.292 4.052 20 0 HIADHN CCN(C(=O)c1ccc(NC(C)=O)c(SC)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000544850837 940519200 /nfs/dbraw/zinc/51/92/00/940519200.db2.gz NWEUKFXCHAADJI-FQEVSTJZSA-N 0 3 411.571 4.104 20 0 HIADHN Cc1cccc(C)c1[C@H](C)NCC(=O)N1CCC[C@@H]1c1ccc2c(c1)OCCCO2 ZINC000544895019 940522537 /nfs/dbraw/zinc/52/25/37/940522537.db2.gz BORXEPZTFWQTKV-PZJWPPBQSA-N 0 3 408.542 4.479 20 0 HIADHN COC[C@H](NCCc1cn2cc(Br)cc(C)c2n1)c1ccc(F)c(F)c1 ZINC000544893464 940522676 /nfs/dbraw/zinc/52/26/76/940522676.db2.gz FRLJKHJATAEAPK-SFHVURJKSA-N 0 3 424.289 4.203 20 0 HIADHN CCO[C@@H]1C[C@@H](NCc2cc(Cl)ccc2OCc2cccnc2)[C@]12CCCO2 ZINC000545351727 940563962 /nfs/dbraw/zinc/56/39/62/940563962.db2.gz QSWNAYMVEMUKNZ-YPAWHYETSA-N 0 3 402.922 4.130 20 0 HIADHN CCC(CC)(C(=O)N[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(OC)c(OC)c1 ZINC000545360743 940565290 /nfs/dbraw/zinc/56/52/90/940565290.db2.gz WWQKAYKLNANNRN-OAQYLSRUSA-N 0 3 410.558 4.152 20 0 HIADHN CCc1nc2c(s1)[C@H](N(C)C(=O)N[C@@H]1CCN(Cc3ccccc3)[C@H]1C)CCC2 ZINC000563963754 945332341 /nfs/dbraw/zinc/33/23/41/945332341.db2.gz IKBXQKFQMSOANB-ILZDJORESA-N 0 3 412.603 4.387 20 0 HIADHN Cc1ccc(S(=O)(=O)N[C@@H](CNC(C)(C)c2ccc(C)nc2)c2ccccc2)cc1 ZINC000545398511 940568231 /nfs/dbraw/zinc/56/82/31/940568231.db2.gz QNDYYUGOMBQLDM-QHCPKHFHSA-N 0 3 423.582 4.243 20 0 HIADHN O=C(c1ccc(CN2CCC(CO)CC2)cc1)N1CCc2c1cccc2C(F)(F)F ZINC000545451224 940570541 /nfs/dbraw/zinc/57/05/41/940570541.db2.gz UQMGNAKHKNXTLJ-UHFFFAOYSA-N 0 3 418.459 4.113 20 0 HIADHN Cc1csc([C@H](C)NC2CCN(C(=O)c3ccc(Br)cc3C)CC2)n1 ZINC000545460537 940570868 /nfs/dbraw/zinc/57/08/68/940570868.db2.gz KFOVOKXGSUTNRG-AWEZNQCLSA-N 0 3 422.392 4.478 20 0 HIADHN CCO[C@@H]1C[C@@H](NCc2cccc(NC(=O)c3ccc(Cl)cc3)c2)[C@]12CCCO2 ZINC000545547901 940574238 /nfs/dbraw/zinc/57/42/38/940574238.db2.gz LCCKUBKOAXVXJJ-MQSCRBSSSA-N 0 3 414.933 4.409 20 0 HIADHN CC(C)[C@H](Cc1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1)c1ccccc1 ZINC000545654644 940579081 /nfs/dbraw/zinc/57/90/81/940579081.db2.gz QRJORTYJYSNOAJ-NRFANRHFSA-N 0 3 405.546 4.256 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(-c4cc(Cl)cc(Cl)c4)n3)cn2)CC1 ZINC000545657031 940579211 /nfs/dbraw/zinc/57/92/11/940579211.db2.gz HUBZRDIYOYAVKC-UHFFFAOYSA-N 0 3 404.301 4.247 20 0 HIADHN Cc1ccc(SCc2nc(-c3ccc(N4CCCN(C)CC4)nc3)no2)c(C)c1 ZINC000545659220 940579287 /nfs/dbraw/zinc/57/92/87/940579287.db2.gz GBPPFQLBPPPUDT-UHFFFAOYSA-N 0 3 409.559 4.183 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(-c4ccc(Cl)cc4Cl)n3)cn2)CC1 ZINC000545660500 940579339 /nfs/dbraw/zinc/57/93/39/940579339.db2.gz YTVLZVAXJFBYAY-UHFFFAOYSA-N 0 3 404.301 4.247 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(/C=C\c4cc5ccccc5o4)n3)cn2)CC1 ZINC000545660792 940579414 /nfs/dbraw/zinc/57/94/14/940579414.db2.gz XATPCESSOLZUQX-NTMALXAHSA-N 0 3 401.470 4.190 20 0 HIADHN Cc1cc2occ(Cc3nc(-c4ccc(N5CCCN(C)CC5)nc4)no3)c2cc1C ZINC000545660995 940579463 /nfs/dbraw/zinc/57/94/63/940579463.db2.gz XNORXAHKUIRXSL-UHFFFAOYSA-N 0 3 417.513 4.227 20 0 HIADHN CCC(CC)n1nc(C)cc1C(=O)NC[C@H](c1ccc(OC(C)C)cc1)N(C)C ZINC000563991319 945338424 /nfs/dbraw/zinc/33/84/24/945338424.db2.gz LRZUWQSLTTVICG-JOCHJYFZSA-N 0 3 400.567 4.373 20 0 HIADHN Cc1ccc(CN2CCSCC2)cc1N[C@@H](C)Cn1cc(Br)cn1 ZINC000545954418 940664699 /nfs/dbraw/zinc/66/46/99/940664699.db2.gz PDHIAGVDGOYVSQ-HNNXBMFYSA-N 0 3 409.397 4.003 20 0 HIADHN CCO[C@@H]1C[C@H](NCc2cnc(-c3ccc(Br)cc3)s2)[C@@]12CCCO2 ZINC000546058988 940685137 /nfs/dbraw/zinc/68/51/37/940685137.db2.gz JVVDELHBHPWWNF-SCTDSRPQSA-N 0 3 423.376 4.389 20 0 HIADHN CCO[C@@H]1C[C@H](NCc2c(C)nn(Cc3ccccc3Cl)c2C)[C@]12CCCO2 ZINC000546255725 940749756 /nfs/dbraw/zinc/74/97/56/940749756.db2.gz KPKBRSRHNWNZMM-BHDDXSALSA-N 0 3 403.954 4.018 20 0 HIADHN CCCN(C(=O)NC[C@@H](C)c1nccs1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000546747685 940875653 /nfs/dbraw/zinc/87/56/53/940875653.db2.gz YZMLLKYCVKDMPU-QUCCMNQESA-N 0 3 400.592 4.333 20 0 HIADHN COc1ccc(C(=O)CCCCC(=O)NC2CCN([C@@H](C)c3ccncc3)CC2)cc1 ZINC000546830327 940889952 /nfs/dbraw/zinc/88/99/52/940889952.db2.gz YQASUIQBWREASE-IBGZPJMESA-N 0 3 423.557 4.175 20 0 HIADHN CCN(C(=O)c1cccc(OCc2cscn2)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000546889883 940902998 /nfs/dbraw/zinc/90/29/98/940902998.db2.gz WERNMROYLDDTIG-QFIPXVFZSA-N 0 3 421.566 4.459 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)NCCC[C@@H]1CCCCO1 ZINC000546908476 940909044 /nfs/dbraw/zinc/90/90/44/940909044.db2.gz NTDIMXIBUNBSDY-IBGZPJMESA-N 0 3 415.500 4.128 20 0 HIADHN C[C@@H](Cc1cccc(Cl)c1)c1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1 ZINC000547069113 940982511 /nfs/dbraw/zinc/98/25/11/940982511.db2.gz PJCJBJHOZPCJHX-INIZCTEOSA-N 0 3 411.937 4.273 20 0 HIADHN Cc1c2cccc(C)c2oc1-c1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1 ZINC000547072592 940983949 /nfs/dbraw/zinc/98/39/49/940983949.db2.gz SBARRRZWOSXRRV-UHFFFAOYSA-N 0 3 403.486 4.304 20 0 HIADHN CC(C)Oc1ccc([C@H](CNc2ncccc2C(=O)N2CCCCC2)N(C)C)cc1 ZINC000564056600 945365307 /nfs/dbraw/zinc/36/53/07/945365307.db2.gz UYTPZUSQTHSBSN-QFIPXVFZSA-N 0 3 410.562 4.210 20 0 HIADHN CCOc1ccc(-c2noc([C@]3(C(F)(F)F)CCN(Cc4ccccc4)C3)n2)cn1 ZINC000547082153 940987852 /nfs/dbraw/zinc/98/78/52/940987852.db2.gz MTPVUVNQYRMWFQ-FQEVSTJZSA-N 0 3 418.419 4.236 20 0 HIADHN Cc1nc(-c2cccc(-c3noc(-c4ccc(CN5CCSCC5)cc4)n3)c2)n[nH]1 ZINC000547179852 941023389 /nfs/dbraw/zinc/02/33/89/941023389.db2.gz XCAAMWOVLRUKDZ-UHFFFAOYSA-N 0 3 418.526 4.046 20 0 HIADHN CCN(C(=O)c1cnn(-c2ccccc2C)c1N)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000547388724 941060005 /nfs/dbraw/zinc/06/00/05/941060005.db2.gz BPGLRNPCUCXXQJ-PZJWPPBQSA-N 0 3 417.557 4.061 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccnc2)C1)N1CCC(Cc2ccc(F)c(F)c2)CC1 ZINC000547424952 941061878 /nfs/dbraw/zinc/06/18/78/941061878.db2.gz SPYFNVACSNQFKY-OAQYLSRUSA-N 0 3 413.512 4.053 20 0 HIADHN CSc1ccc([C@@H](C)NCc2ccc(N3CCCS3(=O)=O)c(F)c2)cc1F ZINC000547831559 941077600 /nfs/dbraw/zinc/07/76/00/941077600.db2.gz ISCKBNGCJOEGKZ-CYBMUJFWSA-N 0 3 412.527 4.077 20 0 HIADHN Cc1cc(C)c(NC(=O)[C@H]2CCCN(Cc3cccnc3)C2)cc1Br ZINC000547957286 941080879 /nfs/dbraw/zinc/08/08/79/941080879.db2.gz NNKXGUNMWFKLCR-KRWDZBQOSA-N 0 3 402.336 4.312 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)N[C@H](c1ccccc1)C(F)(F)F ZINC000548498563 941110212 /nfs/dbraw/zinc/11/02/12/941110212.db2.gz DLENNTQBIPWIID-GOSISDBHSA-N 0 3 415.406 4.342 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](N[C@H]2CCC23CCOCC3)c2ccc(Cl)cc2)c1 ZINC000548858643 941126824 /nfs/dbraw/zinc/12/68/24/941126824.db2.gz VUXWNVSAVGOQBQ-SFTDATJTSA-N 0 3 419.974 4.382 20 0 HIADHN O=C(Nc1c[nH]nc1[C@@H]1CCCN(C[C@@H]2CCC3(CCCC3)O2)C1)c1ccccc1 ZINC000548916769 941129112 /nfs/dbraw/zinc/12/91/12/941129112.db2.gz MRTQRQPEWLBDLM-UXHICEINSA-N 0 3 408.546 4.333 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)Nc1c(F)cccc1Cl ZINC000548926534 941129692 /nfs/dbraw/zinc/12/96/92/941129692.db2.gz XCTBHUPNBWBMBK-UHFFFAOYSA-N 0 3 404.917 4.203 20 0 HIADHN CCN1CC[C@H](NCC(=O)N[C@H](C)c2cccs2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000549111882 941160765 /nfs/dbraw/zinc/16/07/65/941160765.db2.gz DNEZIYAZFHRCNF-VOWSPCBNSA-N 0 3 409.958 4.143 20 0 HIADHN CCN1CC[C@H](NCC(=O)Nc2cc(F)ccc2F)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000549111343 941160788 /nfs/dbraw/zinc/16/07/88/941160788.db2.gz PLUOQMOJIVTNAV-PXNSSMCTSA-N 0 3 411.855 4.121 20 0 HIADHN Brc1ccc2c(c1)CCCC[C@H]2NCc1cccnc1N1CCOCC1 ZINC000549143053 941165030 /nfs/dbraw/zinc/16/50/30/941165030.db2.gz SXXLSSKMXNFTHO-HXUWFJFHSA-N 0 3 416.363 4.238 20 0 HIADHN CCOc1c(Cl)cc(CNC[C@H](O)COc2c(C)ccc(C)c2C)cc1OC ZINC000549151690 941165992 /nfs/dbraw/zinc/16/59/92/941165992.db2.gz BTSIPGQFFLCZAV-SFHVURJKSA-N 0 3 407.938 4.202 20 0 HIADHN CCCN(C[C@@H]1CCN(C(=O)c2ccccc2)C1)[C@@H](C)C(=O)Nc1ccccc1C ZINC000549172482 941168266 /nfs/dbraw/zinc/16/82/66/941168266.db2.gz JIACMXJVHXGGOH-SFTDATJTSA-N 0 3 407.558 4.196 20 0 HIADHN CCN1CC[C@@H](NCC(=O)Nc2c(F)cccc2F)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000549471412 941193313 /nfs/dbraw/zinc/19/33/13/941193313.db2.gz IUXUYPAKUYUPHG-XLIONFOSSA-N 0 3 411.855 4.121 20 0 HIADHN CCN1CC[C@@H](NCC(=O)Nc2cccc(SC)c2)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000549472362 941193720 /nfs/dbraw/zinc/19/37/20/941193720.db2.gz MZKYJMFZFJMZFM-WIYYLYMNSA-N 0 3 423.504 4.189 20 0 HIADHN CCn1c(CN[C@H]2CCN(C3CC3)[C@@H]2c2cccc(OC)c2)nc2c1cccc2F ZINC000549475375 941194237 /nfs/dbraw/zinc/19/42/37/941194237.db2.gz DFTKVHVGFBZCON-GBXCKJPGSA-N 0 3 408.521 4.272 20 0 HIADHN Cc1cc(NC(=O)[C@H](C)N[C@H]2CCN(C(C)(C)C)[C@@H]2c2ccc(Cl)c(F)c2)on1 ZINC000549476047 941194382 /nfs/dbraw/zinc/19/43/82/941194382.db2.gz BWQKSSSDHBLJNE-SOVGHPHASA-N 0 3 422.932 4.306 20 0 HIADHN CCc1cccc(CC)c1NC(=O)CN[C@H]1CCN(C2CC2)[C@@H]1c1cccc(OC)c1 ZINC000549477370 941194644 /nfs/dbraw/zinc/19/46/44/941194644.db2.gz JQBZVLZOPNDZCB-JYFHCDHNSA-N 0 3 421.585 4.326 20 0 HIADHN CN(C)C[C@H](NC(=O)NC[C@@H]1CCCO[C@H]1c1ccccc1)c1ccc(Cl)cc1 ZINC000549480504 941194975 /nfs/dbraw/zinc/19/49/75/941194975.db2.gz BEYWTXNYYCTYQC-BVSLBCMMSA-N 0 3 415.965 4.410 20 0 HIADHN CCc1ccc([C@H](CNC(=O)c2ccccc2-c2nc(C(C)C)no2)N(C)C)cc1 ZINC000549530852 941198231 /nfs/dbraw/zinc/19/82/31/941198231.db2.gz FQMZHLCTTRDVKY-NRFANRHFSA-N 0 3 406.530 4.455 20 0 HIADHN CC(=O)c1cccc(OCCCC(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)c1 ZINC000549617873 941201502 /nfs/dbraw/zinc/20/15/02/941201502.db2.gz VEGHBJCNRFLDCE-OAQYLSRUSA-N 0 3 402.922 4.121 20 0 HIADHN CN(C)C[C@@H](NC(=O)c1ccc(OCc2ccncc2)cc1)c1ccc(Cl)cc1 ZINC000549616398 941201534 /nfs/dbraw/zinc/20/15/34/941201534.db2.gz IGCMQHNQSNOJQG-JOCHJYFZSA-N 0 3 409.917 4.347 20 0 HIADHN Cc1sc2nc([C@@H](C)N[C@H](C)C3CCN(CC(F)(F)F)CC3)nc(N)c2c1C ZINC000549633615 941202199 /nfs/dbraw/zinc/20/21/99/941202199.db2.gz NPQYDAPXUPAKAT-VXGBXAGGSA-N 0 3 415.529 4.204 20 0 HIADHN O=S(=O)(CCCNCc1ccccc1OCC(F)(F)F)c1ccc(Cl)cc1 ZINC000549935416 941243338 /nfs/dbraw/zinc/24/33/38/941243338.db2.gz DJKDLJOADVMPHT-UHFFFAOYSA-N 0 3 421.868 4.235 20 0 HIADHN COc1ccc(-c2noc([C@@H](C)N[C@@H](C)C3CCN(CC(F)(F)F)CC3)n2)cc1 ZINC000550024225 941267345 /nfs/dbraw/zinc/26/73/45/941267345.db2.gz FKUJUYOVSSPFCG-UONOGXRCSA-N 0 3 412.456 4.059 20 0 HIADHN CCOc1ccc(-c2nc(CN[C@H](C(C)C)C3(CO)CCC3)cs2)cc1OC ZINC000550462927 941329993 /nfs/dbraw/zinc/32/99/93/941329993.db2.gz GDDIARIOFFDFKZ-HXUWFJFHSA-N 0 3 404.576 4.494 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)c3cc(Cl)c(F)cc3Cl)CC2)C[C@H](C)O1 ZINC000550471341 941330200 /nfs/dbraw/zinc/33/02/00/941330200.db2.gz IWKRQIRXCJNNRM-BETUJISGSA-N 0 3 403.325 4.094 20 0 HIADHN Cc1cc(C)c(NC(=O)CN[C@H]2CCN(C)[C@H]2c2ccc(F)c(F)c2)c(Cl)c1 ZINC000550714525 941357567 /nfs/dbraw/zinc/35/75/67/941357567.db2.gz XQFUQRLLSIOQQQ-RXVVDRJESA-N 0 3 407.892 4.209 20 0 HIADHN CC[C@H](N[C@H]1CCCN([C@@H](C)c2ccc(F)cc2)C1=O)c1ccc2c(c1)OCCO2 ZINC000550894643 941380128 /nfs/dbraw/zinc/38/01/28/941380128.db2.gz ISEPTJYIFMRJSD-NDXORKPFSA-N 0 3 412.505 4.390 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)Nc2ccc(Oc3cccnc3)nc2)CN1Cc1ccccc1 ZINC000551026844 941396820 /nfs/dbraw/zinc/39/68/20/941396820.db2.gz CMCWIGZNGYQNTE-FXAWDEMLSA-N 0 3 403.486 4.053 20 0 HIADHN O[C@@H](CNCc1cc(Cl)c2c(c1)OCCCO2)COc1cccc2ccccc21 ZINC000551236632 941432407 /nfs/dbraw/zinc/43/24/07/941432407.db2.gz VQTMTDNMGQOSHJ-SFHVURJKSA-N 0 3 413.901 4.184 20 0 HIADHN C[C@H](c1ccc(F)cc1)N1CCC[C@H](N[C@@H](C)c2ccc3c(c2)CCC(=O)N3)C1=O ZINC000551274575 941441364 /nfs/dbraw/zinc/44/13/64/941441364.db2.gz SHZANMXUWMJAQF-DMPWYTOCSA-N 0 3 409.505 4.113 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)Nc1ccc(Oc2cccnc2)nc1 ZINC000551392445 941468080 /nfs/dbraw/zinc/46/80/80/941468080.db2.gz DDIOHIDBYFVVQC-UHFFFAOYSA-N 0 3 409.465 4.004 20 0 HIADHN CN(C(=O)c1ccc(NCc2cccc(C(F)(F)F)c2)cc1)[C@@H]1CCCN(C)C1 ZINC000551452438 941482718 /nfs/dbraw/zinc/48/27/18/941482718.db2.gz QPFQNFIHPXPJMG-HXUWFJFHSA-N 0 3 405.464 4.484 20 0 HIADHN COc1ccc2ccc(C(=O)N3CCC(CCN4C[C@@H](C)O[C@H](C)C4)CC3)cc2c1 ZINC000551464987 941484510 /nfs/dbraw/zinc/48/45/10/941484510.db2.gz RCCPUTGZCUQZHI-RTBURBONSA-N 0 3 410.558 4.200 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)c2sc(-c3ccc(F)cc3)nc2C)cc1 ZINC000551533925 941496548 /nfs/dbraw/zinc/49/65/48/941496548.db2.gz KRJRHKPRKXVWPO-LJQANCHMSA-N 0 3 413.518 4.299 20 0 HIADHN COc1ccc([C@H]2C[C@@H]2[C@H](C)NCc2csc(CNC(=O)c3ccccc3)n2)cc1 ZINC000551533032 941496605 /nfs/dbraw/zinc/49/66/05/941496605.db2.gz IYUOMPYSMQEODF-KNXBSLHKSA-N 0 3 421.566 4.364 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)[C@@H](C)c2ccc(Br)s2)cc1 ZINC000551540205 941498123 /nfs/dbraw/zinc/49/81/23/941498123.db2.gz CUQNEFLHGQNDHO-SWLSCSKDSA-N 0 3 411.365 4.042 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)[C@H](C)c2ccc(Br)s2)cc1 ZINC000551540200 941498194 /nfs/dbraw/zinc/49/81/94/941498194.db2.gz CUQNEFLHGQNDHO-DOMZBBRYSA-N 0 3 411.365 4.042 20 0 HIADHN COc1ccc([C@H](NCc2cccc(N3C(=O)N[C@](C)(C4CC4)C3=O)c2)C(C)C)cc1 ZINC000551562952 941502121 /nfs/dbraw/zinc/50/21/21/941502121.db2.gz CZUPXNZBSMZBLD-RCZVLFRGSA-N 0 3 421.541 4.407 20 0 HIADHN C[C@@H](CC(=O)Nc1cccc(C(F)(F)F)c1)NCc1ccnc(OC(F)F)c1 ZINC000551565300 941502558 /nfs/dbraw/zinc/50/25/58/941502558.db2.gz SPQZFILNCARCTG-NSHDSACASA-N 0 3 403.351 4.209 20 0 HIADHN CC(C)(C)c1nn(-c2ccccc2Cl)cc1CN[C@@H](CO)C[C@@H](O)C(C)(C)C ZINC000551571132 941504298 /nfs/dbraw/zinc/50/42/98/941504298.db2.gz KDCIPEGRVYGYEU-VQIMIIECSA-N 0 3 407.986 4.071 20 0 HIADHN CCN(CC)C(=O)c1ccc(CNCc2cccc(I)c2)cc1 ZINC000551574538 941505293 /nfs/dbraw/zinc/50/52/93/941505293.db2.gz VYISGQBLZYTCCE-UHFFFAOYSA-N 0 3 422.310 4.063 20 0 HIADHN CN(C)Cc1ccc(C(N)=O)cc1NCc1cnc(-c2ccc(Cl)cc2)s1 ZINC000551587066 941507891 /nfs/dbraw/zinc/50/78/91/941507891.db2.gz SZUILFHPTXIUEQ-UHFFFAOYSA-N 0 3 400.935 4.236 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)[C@H]1CCCc2cccnc21 ZINC000551646389 941518077 /nfs/dbraw/zinc/51/80/77/941518077.db2.gz NKTJLRXAQHGUOF-YADHBBJMSA-N 0 3 415.541 4.092 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)[C@H]2C[C@H]2c2cccc(C(F)(F)F)c2)cc1 ZINC000551794281 941546093 /nfs/dbraw/zinc/54/60/93/941546093.db2.gz QGOKZURWZJJKFW-UFYCRDLUSA-N 0 3 406.448 4.237 20 0 HIADHN CCCN(CC(=O)Nc1c(F)cccc1F)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000551797395 941546621 /nfs/dbraw/zinc/54/66/21/941546621.db2.gz HXDACRMTWLSSPT-LJQANCHMSA-N 0 3 401.501 4.280 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@@H](N[C@@H](C)c2ccc(S(=O)(=O)CC)cc2)c2ccccc21 ZINC000551812756 941549974 /nfs/dbraw/zinc/54/99/74/941549974.db2.gz NHKLBNUAQKLSAI-KNXBSLHKSA-N 0 3 415.555 4.313 20 0 HIADHN C[C@@H](NCc1ccc(OC2CCCC2)cc1)c1cccc(N2CCCS2(=O)=O)c1 ZINC000551812575 941550236 /nfs/dbraw/zinc/55/02/36/941550236.db2.gz WEJABYZZDZVDQZ-GOSISDBHSA-N 0 3 414.571 4.399 20 0 HIADHN Cc1ccc(-c2n[nH]cc2CN(Cc2ccc(C(=O)NC3CC3)cc2)C2CC2)cc1 ZINC000551941638 941562165 /nfs/dbraw/zinc/56/21/65/941562165.db2.gz AUGPLZZBIWFNHC-UHFFFAOYSA-N 0 3 400.526 4.442 20 0 HIADHN O=C(c1cccn1Cc1cccs1)N1CCN(c2ccnc3ccccc32)CC1 ZINC000552007933 941568047 /nfs/dbraw/zinc/56/80/47/941568047.db2.gz WMBHMFPZCQTYGX-UHFFFAOYSA-N 0 3 402.523 4.109 20 0 HIADHN CO[C@@H]1C[C@@H](c2ccccc2)CC[C@H]1NCC(=O)Nc1ccc(N2CCCC2)cc1C ZINC000552058698 941576438 /nfs/dbraw/zinc/57/64/38/941576438.db2.gz WSLYJBQKHKQELZ-FTBPSBKWSA-N 0 3 421.585 4.475 20 0 HIADHN C[C@H](CC(=O)Nc1cccc(C(F)(F)F)c1)N[C@@H](CC(=O)N(C)C)c1ccccc1 ZINC000552073626 941579755 /nfs/dbraw/zinc/57/97/55/941579755.db2.gz LJZQTADXXIJELX-BEFAXECRSA-N 0 3 421.463 4.232 20 0 HIADHN CN(CCCN(C)C(=O)c1ccc(Br)cc1Cl)Cc1ccncc1 ZINC000552112511 941587542 /nfs/dbraw/zinc/58/75/42/941587542.db2.gz GWIOHVOXOCNZMH-UHFFFAOYSA-N 0 3 410.743 4.092 20 0 HIADHN C[C@H](NC(=O)c1cccc(C(=O)Nc2ccccc2)c1)[C@@H](c1ccccc1)N(C)C ZINC000552162747 941595601 /nfs/dbraw/zinc/59/56/01/941595601.db2.gz FPYKHRJYSMTAPK-MBSDFSHPSA-N 0 3 401.510 4.360 20 0 HIADHN O=C(Nc1c[nH]nc1-c1ccccc1F)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000552216055 941605339 /nfs/dbraw/zinc/60/53/39/941605339.db2.gz VIRCTQDNLUHYGP-QGZVFWFLSA-N 0 3 414.431 4.312 20 0 HIADHN Clc1ccc([C@H](CN[C@@H](c2ncc[nH]2)C2CCCCC2)N2CCOCC2)cc1 ZINC000552248457 941613496 /nfs/dbraw/zinc/61/34/96/941613496.db2.gz HULZMNSFVFKFPJ-LEWJYISDSA-N 0 3 402.970 4.348 20 0 HIADHN C[C@@H](C(=O)N(c1nccs1)C1CCCCC1)N(C)CCCN(C)Cc1ccco1 ZINC000552270951 941619287 /nfs/dbraw/zinc/61/92/87/941619287.db2.gz LYFSZAOFMXMVLZ-SFHVURJKSA-N 0 3 418.607 4.244 20 0 HIADHN c1[nH]nc(-c2ccc3c(c2)OCO3)c1CN1CC[C@@H](OCCCc2ccccc2)C1 ZINC000552326397 941633101 /nfs/dbraw/zinc/63/31/01/941633101.db2.gz PPABFTDUEZGOEM-OAQYLSRUSA-N 0 3 405.498 4.029 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)c3ccccc3N3CCCCC3)CC2)C[C@H](C)O1 ZINC000552342005 941638758 /nfs/dbraw/zinc/63/87/58/941638758.db2.gz BQWDTMNBWCPVNQ-SFTDATJTSA-N 0 3 413.606 4.028 20 0 HIADHN CCN(CC(F)(F)F)C(=O)[C@H]1CCCN(Cc2cc(C)ccc2OC(F)F)C1 ZINC000552346571 941640037 /nfs/dbraw/zinc/64/00/37/941640037.db2.gz SZXMXORADUVBCI-AWEZNQCLSA-N 0 3 408.411 4.219 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)c2cccc(F)c2Br)N(C)C)cc1 ZINC000552457239 941676283 /nfs/dbraw/zinc/67/62/83/941676283.db2.gz LALWIONFWADANI-SFHVURJKSA-N 0 3 423.326 4.408 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)[C@@H]1C[C@H]1c1cccc(C(F)(F)F)c1 ZINC000552514820 941692331 /nfs/dbraw/zinc/69/23/31/941692331.db2.gz OZDNCHHKPIBBLX-SLFFLAALSA-N 0 3 404.432 4.014 20 0 HIADHN COc1ccc(OCc2ccccn2)c(CN2CCC[C@H](c3nnc(C4CC4)[nH]3)C2)c1 ZINC000552522714 941695280 /nfs/dbraw/zinc/69/52/80/941695280.db2.gz BMJOJJQQWPCXRW-SFHVURJKSA-N 0 3 419.529 4.044 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)c1cc(OC)c(OC)c(OC)c1)c1ccc(Cl)cc1 ZINC000552584804 941714549 /nfs/dbraw/zinc/71/45/49/941714549.db2.gz VPNKHOCGBZNRHO-SFHVURJKSA-N 0 3 420.937 4.179 20 0 HIADHN CCCN(C)[C@H](CNC(=O)[C@H]1CCCN(C(=O)C(C)(C)C)C1)c1ccc(Cl)cc1 ZINC000552681028 941736427 /nfs/dbraw/zinc/73/64/27/941736427.db2.gz NBUKUOUOJDCGOS-AZUAARDMSA-N 0 3 422.013 4.124 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)c2cc(-c3ccc(Cl)s3)on2)cc1 ZINC000552813987 941774259 /nfs/dbraw/zinc/77/42/59/941774259.db2.gz SRQUZLANUQKAMM-OAHLLOKOSA-N 0 3 405.907 4.098 20 0 HIADHN O=C(CCC(F)(F)F)N(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000552850080 941787280 /nfs/dbraw/zinc/78/72/80/941787280.db2.gz LWKZGFKJGJLNSC-HXUWFJFHSA-N 0 3 405.464 4.417 20 0 HIADHN COc1ccccc1-c1ccc([C@@H](C)NCc2ccc(OCC(N)=O)c(OC)c2)cc1 ZINC000552919027 941802454 /nfs/dbraw/zinc/80/24/54/941802454.db2.gz YEGXZUZZOGHOAP-QGZVFWFLSA-N 0 3 420.509 4.086 20 0 HIADHN CC(=O)CCc1ccc(OC[C@@H](O)CN[C@@H]2CCSc3ccc(Cl)cc32)cc1 ZINC000553020958 941818436 /nfs/dbraw/zinc/81/84/36/941818436.db2.gz ONSOPYBUPVXUMH-GHTZIAJQSA-N 0 3 419.974 4.428 20 0 HIADHN CO[C@@H]1CCCC[C@H]1C(=O)N(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000553196242 941847394 /nfs/dbraw/zinc/84/73/94/941847394.db2.gz GWMAEPOTRHNFKA-UBFVSLLYSA-N 0 3 421.585 4.280 20 0 HIADHN CCN(CC(=O)N(C)[C@H](C)c1ccc(F)c(F)c1)[C@@H](C)Cc1ccc(OC)cc1 ZINC000553317482 941866525 /nfs/dbraw/zinc/86/65/25/941866525.db2.gz WCBUXJAKMGWNQM-DLBZAZTESA-N 0 3 404.501 4.446 20 0 HIADHN CC(C)c1ccc2occ(C(=O)N[C@H]3CCN(Cc4ccccc4)C[C@H]3CO)c2c1 ZINC000553434667 941884196 /nfs/dbraw/zinc/88/41/96/941884196.db2.gz MKTQSOYCDKGQJA-REWPJTCUSA-N 0 3 406.526 4.169 20 0 HIADHN CN1CCC[C@H](CNc2nnc(-c3ccon3)s2)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000553440075 941885476 /nfs/dbraw/zinc/88/54/76/941885476.db2.gz YHKKLCIRYMLRNJ-CZUORRHYSA-N 0 3 423.464 4.707 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)NCc1nccn1CC(C)C)c1ccc(Cl)cc1 ZINC000553555400 941908137 /nfs/dbraw/zinc/90/81/37/941908137.db2.gz XHZCZHALZQSTQY-IBGZPJMESA-N 0 3 405.974 4.075 20 0 HIADHN COc1cccc(OC(F)(F)F)c1CNC(=O)c1oc2ccccc2c1CN(C)C ZINC000553577699 941912938 /nfs/dbraw/zinc/91/29/38/941912938.db2.gz JQGQSFIGEHCTAG-UHFFFAOYSA-N 0 3 422.403 4.332 20 0 HIADHN COCc1cccc(OCC2(CN3CCC([C@H](O)C(F)(F)F)CC3)CCC2)c1 ZINC000553616017 941921421 /nfs/dbraw/zinc/92/14/21/941921421.db2.gz VUDHLUCASAASQO-IBGZPJMESA-N 0 3 401.469 4.017 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)c2cccc(NC(=O)[C@@H]3C[C@H]3C)c2)N(C)C)cc1 ZINC000553671054 941941243 /nfs/dbraw/zinc/94/12/43/941941243.db2.gz RPHMFNLWMMQBIW-ZQMYSKGWSA-N 0 3 423.557 4.101 20 0 HIADHN CN1CC[C@H](NC(=O)NCc2cc(F)c(C(F)(F)F)cc2F)[C@H]1c1ccccc1 ZINC000553703895 941947265 /nfs/dbraw/zinc/94/72/65/941947265.db2.gz NCSCBGYXFMVPBH-ZWKOTPCHSA-N 0 3 413.390 4.228 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CNC[C@H](O)COc1cccc2ccccc21 ZINC000553716988 941950452 /nfs/dbraw/zinc/95/04/52/941950452.db2.gz IFPSDNKGMGCNOP-QFIPXVFZSA-N 0 3 401.510 4.172 20 0 HIADHN C[C@H](CNC(=O)N(C)Cc1ccc(OCC(F)(F)F)cc1)N(C)Cc1ccccc1 ZINC000553895549 941992631 /nfs/dbraw/zinc/99/26/31/941992631.db2.gz OAFCXELSLSFIIG-QGZVFWFLSA-N 0 3 423.479 4.290 20 0 HIADHN COc1ccc2c(c1)CCC[C@@H]2N(C)C(=O)NCCCN1CCc2ccccc2C1 ZINC000553934798 942002499 /nfs/dbraw/zinc/00/24/99/942002499.db2.gz KRVQFQBIESPHJR-DEOSSOPVSA-N 0 3 407.558 4.162 20 0 HIADHN CC1CCN([C@H](CN2C(=O)[C@H]3c4ccccc4CCN3C2=O)c2cccs2)CC1 ZINC000554034950 942022680 /nfs/dbraw/zinc/02/26/80/942022680.db2.gz PZLVWIBGASOFBU-TZIWHRDSSA-N 0 3 409.555 4.083 20 0 HIADHN COc1ccc(Cl)cc1CC(=O)NC[C@@H](c1ccc(OC(C)C)cc1)N(C)C ZINC000554039994 942023838 /nfs/dbraw/zinc/02/38/38/942023838.db2.gz ZJWCNBFCTLNUMK-FQEVSTJZSA-N 0 3 404.938 4.097 20 0 HIADHN C[C@H](NC1CCN(C(=O)c2ccccc2Cl)CC1)c1nccn1-c1ccccc1 ZINC000554087438 942033779 /nfs/dbraw/zinc/03/37/79/942033779.db2.gz BUVZFZVBSNYSLO-KRWDZBQOSA-N 0 3 408.933 4.481 20 0 HIADHN C[C@@H](NCc1ccc2c(c1)OCCO2)c1ccc(OC[C@@H]2CCCCO2)c(F)c1 ZINC000554114828 942040028 /nfs/dbraw/zinc/04/00/28/942040028.db2.gz QMKIWABSVVADOP-APWZRJJASA-N 0 3 401.478 4.396 20 0 HIADHN Cn1ncc(NC(=O)[C@H]2CN(Cc3ccccc3)CCC2(F)F)c1-c1ccccc1 ZINC000554172438 942056781 /nfs/dbraw/zinc/05/67/81/942056781.db2.gz YSRMXHXLDRCONK-LJQANCHMSA-N 0 3 410.468 4.183 20 0 HIADHN CN(C)C[C@@H](NC(=O)Nc1ccccc1OC[C@H]1CCCCO1)c1ccc(F)cc1 ZINC000554192164 942063584 /nfs/dbraw/zinc/06/35/84/942063584.db2.gz WRWKQBMIBHENOZ-TZIWHRDSSA-N 0 3 415.509 4.198 20 0 HIADHN COc1ccc([C@H](C)NC(=O)NC[C@@H](c2ccccc2)N2CCCC2)c(C)c1OC ZINC000554201606 942065210 /nfs/dbraw/zinc/06/52/10/942065210.db2.gz WEOBOIXZTHREHV-RXVVDRJESA-N 0 3 411.546 4.210 20 0 HIADHN C[C@H](NC(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F)[C@@H]1OCCc2sccc21 ZINC000554208370 942067023 /nfs/dbraw/zinc/06/70/23/942067023.db2.gz HREFLFAEFSYOGS-CVAIRZPRSA-N 0 3 420.525 4.024 20 0 HIADHN Cc1noc([C@@H]2CCCCN2C(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)n1 ZINC000554213494 942069648 /nfs/dbraw/zinc/06/96/48/942069648.db2.gz FCNJRQJZWHSOFP-ZWKOTPCHSA-N 0 3 417.579 4.149 20 0 HIADHN COc1ccc(CN2CC[C@@H](N[C@@H]3CCCc4ccc(Cl)cc43)C2=O)c(OC)c1 ZINC000554355774 942111633 /nfs/dbraw/zinc/11/16/33/942111633.db2.gz ZSXJCDBMNCLFAO-NHCUHLMSSA-N 0 3 414.933 4.125 20 0 HIADHN COc1ccc(CN2CC[C@H](N[C@@H](C)c3cc4ccccc4s3)C2=O)c(OC)c1 ZINC000554355856 942111797 /nfs/dbraw/zinc/11/17/97/942111797.db2.gz JQHMIAYISZZLFG-KXBFYZLASA-N 0 3 410.539 4.370 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1ccc(NC(=O)c2ccco2)cc1)c1ccco1 ZINC000554400836 942127387 /nfs/dbraw/zinc/12/73/87/942127387.db2.gz FJPXYCXZEMPEAW-YJBOKZPZSA-N 0 3 410.474 4.376 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)Nc1ccc(-n2nc(C)cc2C)c(F)c1)c1ccco1 ZINC000554409860 942131737 /nfs/dbraw/zinc/13/17/37/942131737.db2.gz UBBRAGYUZVPHQR-KUHUBIRLSA-N 0 3 413.497 4.472 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1ccc(Oc2ncccn2)cc1C)c1ccco1 ZINC000554413832 942133160 /nfs/dbraw/zinc/13/31/60/942133160.db2.gz AXANFJBUWOVZMD-QFBILLFUSA-N 0 3 409.490 4.421 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1cc2c(cc1SC)OCCO2)c1ccco1 ZINC000554421965 942136385 /nfs/dbraw/zinc/13/63/85/942136385.db2.gz FNIRERWBEBTOKB-DZGCQCFKSA-N 0 3 405.520 4.024 20 0 HIADHN C[C@H](NC(=O)Nc1ccc(OCc2ccncc2)cc1)[C@@H](c1ccccc1)N(C)C ZINC000554440706 942143302 /nfs/dbraw/zinc/14/33/02/942143302.db2.gz CGEFPHMGYYCDLN-MBSDFSHPSA-N 0 3 404.514 4.474 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)N[C@H](c2ccc(Cl)cc2)C2CC2)cc1 ZINC000554468326 942153801 /nfs/dbraw/zinc/15/38/01/942153801.db2.gz NKQDAKAWRAMKNI-RTWAWAEBSA-N 0 3 401.938 4.402 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)c1ccc(-c2noc(C(F)F)n2)cc1)c1ccco1 ZINC000554633722 942180918 /nfs/dbraw/zinc/18/09/18/942180918.db2.gz ZENRCLXHDPGMPZ-SWLSCSKDSA-N 0 3 404.417 4.126 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)c1ccccc1OCc1c(C)noc1C)c1ccco1 ZINC000554633091 942180961 /nfs/dbraw/zinc/18/09/61/942180961.db2.gz SNLOHPZUNHBZOZ-QRWLVFNGSA-N 0 3 411.502 4.323 20 0 HIADHN Cc1cccc([C@H](NC(=O)N[C@H](C)CN(C)Cc2ccccc2)c2ccccn2)c1 ZINC000554706500 942206590 /nfs/dbraw/zinc/20/65/90/942206590.db2.gz OLBRZAAUELVSTR-YKSBVNFPSA-N 0 3 402.542 4.299 20 0 HIADHN COc1ccc(NC(=O)N[C@@H]2CCN(Cc3ccccc3)[C@H]2C)c(Br)c1 ZINC000554748863 942219195 /nfs/dbraw/zinc/21/91/95/942219195.db2.gz LEENRRPUKAZNPL-KBXCAEBGSA-N 0 3 418.335 4.242 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3nc(-c4cccc(F)c4)cs3)cc2)CC1 ZINC000554785396 942236046 /nfs/dbraw/zinc/23/60/46/942236046.db2.gz MIKMICJVYSKROG-UHFFFAOYSA-N 0 3 410.518 4.343 20 0 HIADHN Cn1ncc2ccc(-c3noc([C@@H]4CN(Cc5ccccc5)CCC4(F)F)n3)cc21 ZINC000554807540 942250916 /nfs/dbraw/zinc/25/09/16/942250916.db2.gz DCBYQIORNFTAEL-SFHVURJKSA-N 0 3 409.440 4.248 20 0 HIADHN Cn1cc(C(F)(F)F)nc1[C@@H]1CCCN(Cc2cnn(Cc3ccc(F)cc3)c2)C1 ZINC000554864211 942298012 /nfs/dbraw/zinc/29/80/12/942298012.db2.gz QJWDODOCCOIFJE-QGZVFWFLSA-N 0 3 421.442 4.202 20 0 HIADHN CC(=O)Nc1ccc(CNCc2cccc(-c3nc(CC(F)(F)F)no3)c2)cc1 ZINC000554975164 942340137 /nfs/dbraw/zinc/34/01/37/942340137.db2.gz DVZBMZPBHVBQIU-UHFFFAOYSA-N 0 3 404.392 4.090 20 0 HIADHN CC(C)C(=O)c1ccc([C@@H](C)C(=O)Nc2cccc(CN3CCC(O)CC3)c2)cc1 ZINC000555044044 942368556 /nfs/dbraw/zinc/36/85/56/942368556.db2.gz CCAFERPBAJTOBY-GOSISDBHSA-N 0 3 408.542 4.224 20 0 HIADHN CC(C)N1CC[C@@H](NCC(=O)NCc2cccc(Cl)c2)[C@H]1c1ccc(F)c(F)c1 ZINC000555125202 942393017 /nfs/dbraw/zinc/39/30/17/942393017.db2.gz IIQQUWQCSLQEQM-IFMALSPDSA-N 0 3 421.919 4.048 20 0 HIADHN Cc1ccccc1CNC(=O)[C@H](C)N[C@@H]1CCN(C(C)C)[C@@H]1c1ccc(F)c(F)c1 ZINC000555126534 942393390 /nfs/dbraw/zinc/39/33/90/942393390.db2.gz XIYINMZUKQLYSE-JJEOQYAHSA-N 0 3 415.528 4.092 20 0 HIADHN CCN1CC[C@H](NCC(=O)N(C)[C@H](C)c2ccccc2)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000555129060 942395092 /nfs/dbraw/zinc/39/50/92/942395092.db2.gz JPXYUJDFRZPBOR-ZNRXUEPQSA-N 0 3 419.491 4.048 20 0 HIADHN CCN1CC[C@@H](NCC(=O)Nc2ccc(C(C)=O)cc2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000555131654 942396793 /nfs/dbraw/zinc/39/67/93/942396793.db2.gz OSNLLCOBFSMTEH-IFMALSPDSA-N 0 3 417.912 4.045 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@H](NCc2ccc(OCC(F)(F)F)nc2)c2ccccc21 ZINC000555165280 942412136 /nfs/dbraw/zinc/41/21/36/942412136.db2.gz PRNATXUNRYPAFG-MSOLQXFVSA-N 0 3 408.420 4.294 20 0 HIADHN CN(C)C[C@@H](NC(=O)CCn1c2ccccc2nc1C1CC1)c1ccc(Cl)cc1 ZINC000555231390 942438583 /nfs/dbraw/zinc/43/85/83/942438583.db2.gz RDKSWTCNPYBPLM-HXUWFJFHSA-N 0 3 410.949 4.376 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@@H](N[C@@H](CC(C)C)C(=O)Nc2nccs2)c2ccccc21 ZINC000555236191 942440442 /nfs/dbraw/zinc/44/04/42/942440442.db2.gz RVJRIEWHOMORRP-QRVBRYPASA-N 0 3 415.559 4.268 20 0 HIADHN Fc1cccc(F)c1-c1n[nH]cc1CN(Cc1ccc(-n2cncn2)cc1)C1CC1 ZINC000555365012 942497066 /nfs/dbraw/zinc/49/70/66/942497066.db2.gz FQWDQKGPRYIDMY-UHFFFAOYSA-N 0 3 406.440 4.100 20 0 HIADHN CCC[C@H]1CN(c2nnc(C3CCC3)n2C[C@@H]2CCCO2)CCN1Cc1ccccc1 ZINC000555394870 942511795 /nfs/dbraw/zinc/51/17/95/942511795.db2.gz LXHCVNBSKOJFJI-GOTSBHOMSA-N 0 3 423.605 4.216 20 0 HIADHN CC(=O)CCc1ccc2oc(C(=O)N[C@H](CN(C)C)c3ccc(F)cc3)c(C)c2c1 ZINC000555550549 942638497 /nfs/dbraw/zinc/63/84/97/942638497.db2.gz HRYSZYFXKYSXLS-OAQYLSRUSA-N 0 3 410.489 4.435 20 0 HIADHN COc1ccccc1NC(=O)c1ccc(NC(=O)[C@@H](C)N2CC[C@@H](CC3CC3)C2)cc1 ZINC000555704398 942706088 /nfs/dbraw/zinc/70/60/88/942706088.db2.gz BAEFPHIMDKNARK-MJGOQNOKSA-N 0 3 421.541 4.397 20 0 HIADHN Cc1cc(C)c(-c2csc(NC(=O)CN[C@H](C3CC3)C(C)(C)CO)n2)c(C)c1 ZINC000555734562 942716728 /nfs/dbraw/zinc/71/67/28/942716728.db2.gz BYANVVGRDODDDX-HXUWFJFHSA-N 0 3 401.576 4.061 20 0 HIADHN Cc1cc(C(=O)N(CCN(C)C)Cc2ccccn2)cc(Cl)c1Br ZINC000555882225 942764723 /nfs/dbraw/zinc/76/47/23/942764723.db2.gz UHNXNOJYQLWKMN-UHFFFAOYSA-N 0 3 410.743 4.010 20 0 HIADHN CC(C)(NC(=O)[C@@H]1CCCN(Cc2cccnc2)C1)c1cccc(C(F)(F)F)c1 ZINC000556030906 942789774 /nfs/dbraw/zinc/78/97/74/942789774.db2.gz LVYRGPIPAXPHJO-QGZVFWFLSA-N 0 3 405.464 4.364 20 0 HIADHN CCOc1ccccc1[C@H](CC(C)C)N[C@@H]1CCCc2cc(S(N)(=O)=O)ccc21 ZINC000556078866 942801953 /nfs/dbraw/zinc/80/19/53/942801953.db2.gz ANLXTCVMANQFOD-YADHBBJMSA-N 0 3 416.587 4.487 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)c2csc(-c3ccc(Cl)cc3)c2)CC1 ZINC000556128247 942807949 /nfs/dbraw/zinc/80/79/49/942807949.db2.gz CJMRXYGIJUADCJ-MRXNPFEDSA-N 0 3 405.995 4.072 20 0 HIADHN CS(=O)(=O)CC1CCC(NCc2nc3c(s2)C[C@H](c2ccccc2)CC3)CC1 ZINC000556177694 942814562 /nfs/dbraw/zinc/81/45/62/942814562.db2.gz HFTLUBAICZYOPX-CUYAVPTFSA-N 0 3 418.628 4.109 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)[C@@H](OC1CCOCC1)c1ccccc1 ZINC000556207804 942818983 /nfs/dbraw/zinc/81/89/83/942818983.db2.gz KQOSIHGVDQPNLS-BWKNWUBXSA-N 0 3 422.569 4.046 20 0 HIADHN Brc1cccc2c1OCCC[C@@H]2NCc1cccc(N2CCOCC2)c1 ZINC000556217556 942820067 /nfs/dbraw/zinc/82/00/67/942820067.db2.gz NABPBMWDMGGIII-FQEVSTJZSA-N 0 3 417.347 4.289 20 0 HIADHN C[C@H](c1ccc(F)cc1)N1CCC[C@@H](N[C@@H](C)c2ccc(-n3ccnc3)cc2)C1=O ZINC000556241202 942825252 /nfs/dbraw/zinc/82/52/52/942825252.db2.gz QVGOZMAHYQEPQR-YZZKKUAISA-N 0 3 406.505 4.414 20 0 HIADHN Cc1cc(Cl)cc(C)c1CNCc1cccc(N2C(=O)N[C@@](C)(C3CC3)C2=O)c1 ZINC000556410219 942858976 /nfs/dbraw/zinc/85/89/76/942858976.db2.gz IFCORTFLXYQQKR-QHCPKHFHSA-N 0 3 411.933 4.472 20 0 HIADHN O=C(COc1ccsc1Cl)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000556448219 942869947 /nfs/dbraw/zinc/86/99/47/942869947.db2.gz VLRWHXNSIGPIQD-INIZCTEOSA-N 0 3 416.934 4.063 20 0 HIADHN CC(C)(NCC(=O)N1CCC[C@H]1c1ccc2c(c1)OCCO2)c1ccc(Cl)cc1 ZINC000556518956 942890583 /nfs/dbraw/zinc/89/05/83/942890583.db2.gz HLILQDWNZBIPQP-IBGZPJMESA-N 0 3 414.933 4.300 20 0 HIADHN O=C(CCc1ncc(-c2ccccc2)o1)N1CCN(c2ccnc3ccccc32)CC1 ZINC000556833183 942937709 /nfs/dbraw/zinc/93/77/09/942937709.db2.gz SAOCQDQVTSIYPE-UHFFFAOYSA-N 0 3 412.493 4.171 20 0 HIADHN O=C(c1csc(Cc2ccccc2)n1)N1CCN(c2ccnc3ccccc32)CC1 ZINC000556832364 942937807 /nfs/dbraw/zinc/93/78/07/942937807.db2.gz DEMCMDRSTCEERT-UHFFFAOYSA-N 0 3 414.534 4.245 20 0 HIADHN CS(=O)(=O)Cc1ccc(CN[C@@H](c2cccc(OC(F)(F)F)c2)C2CC2)cc1 ZINC000556859225 942941908 /nfs/dbraw/zinc/94/19/08/942941908.db2.gz ZFGLWIUHLIBIHE-LJQANCHMSA-N 0 3 413.461 4.371 20 0 HIADHN Cn1cccc1[C@H]1CCCCN1C(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000556891053 942953016 /nfs/dbraw/zinc/95/30/16/942953016.db2.gz CBFUKVXBHZRZBK-TZIWHRDSSA-N 0 3 401.501 4.236 20 0 HIADHN Cn1cccc1[C@H]1CCCCN1C(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000556891052 942953531 /nfs/dbraw/zinc/95/35/31/942953531.db2.gz CBFUKVXBHZRZBK-PZJWPPBQSA-N 0 3 401.501 4.236 20 0 HIADHN Brc1cccc([C@H](NCc2cnn3ccccc23)C2CCOCC2)c1 ZINC000556910731 942961096 /nfs/dbraw/zinc/96/10/96/942961096.db2.gz DZWPFMBTWXJAEU-HXUWFJFHSA-N 0 3 400.320 4.354 20 0 HIADHN CCc1nnc(NC(=O)[C@H](C)[C@H](C)N[C@@H](C)c2ccccc2OC(F)(F)F)s1 ZINC000556914025 942964490 /nfs/dbraw/zinc/96/44/90/942964490.db2.gz XCAJISJTINVGPQ-WOPDTQHZSA-N 0 3 416.469 4.313 20 0 HIADHN CCc1nnc(NC(=O)[C@H](C)[C@H](C)N[C@H](C)c2ccccc2OC(F)(F)F)s1 ZINC000556914022 942964520 /nfs/dbraw/zinc/96/45/20/942964520.db2.gz XCAJISJTINVGPQ-GRYCIOLGSA-N 0 3 416.469 4.313 20 0 HIADHN COc1ccc(-c2ccc(C(=O)N(C)CCCN(C)Cc3ccncc3)c(F)c2)cc1 ZINC000556933292 942971599 /nfs/dbraw/zinc/97/15/99/942971599.db2.gz JBXXIEGEPHYBCA-UHFFFAOYSA-N 0 3 421.516 4.490 20 0 HIADHN CN(CCCN(C)C(=O)c1ccc(OC2CCC2)cc1Cl)Cc1ccncc1 ZINC000556932888 942971760 /nfs/dbraw/zinc/97/17/60/942971760.db2.gz DRVCHJOGZUWPKG-UHFFFAOYSA-N 0 3 401.938 4.260 20 0 HIADHN Cc1c[nH]c(-c2ccccc2NC(=O)[C@@H]2CN(Cc3ccccc3)CCC2(F)F)n1 ZINC000556948591 942976590 /nfs/dbraw/zinc/97/65/90/942976590.db2.gz MUEONJUEPTXLAE-IBGZPJMESA-N 0 3 410.468 4.481 20 0 HIADHN CCOCCCn1c([C@@H](CC)c2ccccc2)nnc1N1CCN(C)[C@H](C(C)C)C1 ZINC000556990223 942988721 /nfs/dbraw/zinc/98/87/21/942988721.db2.gz LHTRZAYHZCSXEZ-VXKWHMMOSA-N 0 3 413.610 4.023 20 0 HIADHN Cc1cc(NC(=O)C2CCC(OC(F)F)CC2)cc(N2CCN(C(C)C)CC2)c1 ZINC000557012326 942994038 /nfs/dbraw/zinc/99/40/38/942994038.db2.gz OCENKVVJAVWAQE-UHFFFAOYSA-N 0 3 409.521 4.262 20 0 HIADHN O=C(CCc1cccc(OC2CCCC2)c1)Nc1cccc(CN2CC[C@@H](O)C2)c1 ZINC000557023968 942997089 /nfs/dbraw/zinc/99/70/89/942997089.db2.gz YTPGRRCPNJLHQU-JOCHJYFZSA-N 0 3 408.542 4.146 20 0 HIADHN CN(CCC(F)(F)F)[C@H](CNC(=O)[C@H]1CCCN1C1CC1)c1ccc(Cl)cc1 ZINC000557088150 943017637 /nfs/dbraw/zinc/01/76/37/943017637.db2.gz CVHAMXYYCWRCIV-QZTJIDSGSA-N 0 3 417.903 4.008 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)c2ccc(NC(=O)CC(C)C)c(C)c2)cc1 ZINC000557205390 943050853 /nfs/dbraw/zinc/05/08/53/943050853.db2.gz JZYVJVRPBDBLFC-QFIPXVFZSA-N 0 3 411.546 4.021 20 0 HIADHN Cc1ccc(CC2CCN(C(=O)[C@@H]3CCCN(Cc4cccnc4)C3)CC2)cc1C ZINC000557293822 943066963 /nfs/dbraw/zinc/06/69/63/943066963.db2.gz GLDNZFDCOLOGNC-RUZDIDTESA-N 0 3 405.586 4.392 20 0 HIADHN Cc1cccc(COc2ccc(CN[C@@H](C)c3ccc(S(N)(=O)=O)cc3)cc2)c1 ZINC000557375419 943092670 /nfs/dbraw/zinc/09/26/70/943092670.db2.gz DMAKIMPNLMHUFI-SFHVURJKSA-N 0 3 410.539 4.072 20 0 HIADHN CCC(CC)[C@H](NCC(=O)Nc1cc(C)nn1-c1nc(C)cc(C)n1)c1ccccc1 ZINC000557501529 943172564 /nfs/dbraw/zinc/17/25/64/943172564.db2.gz LRJJQTQJKFAATM-QHCPKHFHSA-N 0 3 420.561 4.293 20 0 HIADHN O=C(c1ccc2c3c(cccc31)CC2)N1CCC[C@H](c2n[nH]cc2CN2CCCC2)C1 ZINC000557642805 943245548 /nfs/dbraw/zinc/24/55/48/943245548.db2.gz BKHCPLLGPWMSRC-FQEVSTJZSA-N 0 3 414.553 4.277 20 0 HIADHN C[C@@H](C(=O)N1CCC[C@@H](c2n[nH]cc2CN2CCCC2)C1)c1cc2ccccc2o1 ZINC000557645884 943246842 /nfs/dbraw/zinc/24/68/42/943246842.db2.gz MGOSEXHLANJQBI-IEBWSBKVSA-N 0 3 406.530 4.261 20 0 HIADHN C[C@H]1[C@@H](NC(=O)Nc2cccc(C(=O)N3CCCCC3)c2)CCN1Cc1ccccc1 ZINC000557884315 943321063 /nfs/dbraw/zinc/32/10/63/943321063.db2.gz BMXZMSHRMCGUAJ-CVDCTZTESA-N 0 3 420.557 4.097 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)c1cc2c(cccc2Br)[nH]1)c1ccco1 ZINC000557911030 943326754 /nfs/dbraw/zinc/32/67/54/943326754.db2.gz ZKXZTBMVPYWMIU-SJCJKPOMSA-N 0 3 404.308 4.383 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)c2cccc(Oc3cnccn3)c2)N(C)C)cc1 ZINC000557937197 943334002 /nfs/dbraw/zinc/33/40/02/943334002.db2.gz WVJFTLMQPWYGIK-JOCHJYFZSA-N 0 3 420.513 4.089 20 0 HIADHN CC(C)Cc1ccc([C@@H](CNC(=O)c2csc([C@@H]3CCCO3)n2)N(C)C)cc1 ZINC000557983078 943346644 /nfs/dbraw/zinc/34/66/44/943346644.db2.gz RPZDDFSMEDEPJO-UXHICEINSA-N 0 3 401.576 4.226 20 0 HIADHN CC1CCN([C@H](CNC(=O)N2CCCC[C@H]2c2ccnn2C)c2cccs2)CC1 ZINC000558003571 943351798 /nfs/dbraw/zinc/35/17/98/943351798.db2.gz QSQPSRIDPCNPQM-VQTJNVASSA-N 0 3 415.607 4.191 20 0 HIADHN C[C@H]1C[C@H]1N1CCN(C(=O)C2(Cc3ccc(OC(F)(F)F)cc3)CC2)C[C@@H](C)C1 ZINC000558027729 943360567 /nfs/dbraw/zinc/36/05/67/943360567.db2.gz SUYJRCBCTJUGNG-TXPKVOOTSA-N 0 3 410.480 4.097 20 0 HIADHN C[C@H]1CCCN(C(=O)CN(C)CCCCCc2cc(-c3cccc(F)c3)no2)C1 ZINC000558097719 943378447 /nfs/dbraw/zinc/37/84/47/943378447.db2.gz AJRCNDKNHZCTLH-SFHVURJKSA-N 0 3 401.526 4.384 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)N1CCC[C@H](c2nc(C)no2)C1)c1ccc(Cl)cc1 ZINC000558107351 943381136 /nfs/dbraw/zinc/38/11/36/943381136.db2.gz LOIILMCRRWHFAQ-HKUYNNGSSA-N 0 3 419.957 4.004 20 0 HIADHN COc1ccc(OCc2ccccn2)c(CNC[C@H](CO)c2ccccc2Cl)c1 ZINC000558117642 943384227 /nfs/dbraw/zinc/38/42/27/943384227.db2.gz CXEWSIOULOEMEK-GOSISDBHSA-N 0 3 412.917 4.188 20 0 HIADHN OC[C@H]1C=C[C@@H](N(Cc2cccs2)C[C@@H](O)Cc2ccccc2C(F)(F)F)C1 ZINC000558139036 943394076 /nfs/dbraw/zinc/39/40/76/943394076.db2.gz LAIYNBNQCUPAQU-JQHSSLGASA-N 0 3 411.489 4.110 20 0 HIADHN CCN1CCCC[C@H]1CNC(=O)c1ccccc1CSc1nc2ccccc2[nH]1 ZINC000558185867 943419668 /nfs/dbraw/zinc/41/96/68/943419668.db2.gz FGEYMSLFKSAEGO-SFHVURJKSA-N 0 3 408.571 4.459 20 0 HIADHN Cc1cc(C)n(-c2ccc(NC(=O)N[C@H](CN(C)C)c3ccc(F)cc3)cc2F)n1 ZINC000558298814 943491761 /nfs/dbraw/zinc/49/17/61/943491761.db2.gz SRAMGEDEEJVYBB-HXUWFJFHSA-N 0 3 413.472 4.192 20 0 HIADHN C[C@H](CCOCc1ccccc1)NC(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000558348583 943520167 /nfs/dbraw/zinc/52/01/67/943520167.db2.gz PAGJBDYXAZJLAZ-QUCCMNQESA-N 0 3 401.576 4.180 20 0 HIADHN C[C@H](NC(=O)Nc1ccc(-c2noc(C(F)F)n2)cc1)[C@@H](c1ccccc1)N(C)C ZINC000558352064 943521751 /nfs/dbraw/zinc/52/17/51/943521751.db2.gz LDCFBVGASCRNNZ-GUYCJALGSA-N 0 3 415.444 4.487 20 0 HIADHN CN(Cc1ccc(OCC(F)(F)F)cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000558361457 943525549 /nfs/dbraw/zinc/52/55/49/943525549.db2.gz KANNLCOUGHXOHE-LJQANCHMSA-N 0 3 421.463 4.044 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1ccc(OC)cc1Br)c1ccco1 ZINC000558361631 943525887 /nfs/dbraw/zinc/52/58/87/943525887.db2.gz PHTFOMOATCAALG-LRDDRELGSA-N 0 3 410.312 4.302 20 0 HIADHN CSc1cccnc1-c1noc([C@H]2CN(Cc3ccccc3)CCC2(F)F)n1 ZINC000558384465 943539870 /nfs/dbraw/zinc/53/98/70/943539870.db2.gz IDRAZVKHYUCVAX-OAHLLOKOSA-N 0 3 402.470 4.478 20 0 HIADHN CC(=O)N(Cc1ccc(NC(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)cc1)C1CC1 ZINC000558389926 943541854 /nfs/dbraw/zinc/54/18/54/943541854.db2.gz CICSNCKAIQKBJT-UZUQRXQVSA-N 0 3 408.546 4.010 20 0 HIADHN Nc1nccc([C@H]2CCCN(Cc3cn(-c4ccccc4)nc3-c3cccs3)C2)n1 ZINC000558407264 943550944 /nfs/dbraw/zinc/55/09/44/943550944.db2.gz KCYUCIDKIYNSOV-KRWDZBQOSA-N 0 3 416.554 4.353 20 0 HIADHN Cc1nc(C2CCCC2)sc1-c1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1 ZINC000558573166 943603738 /nfs/dbraw/zinc/60/37/38/943603738.db2.gz QJRZITLYQNGWEG-UHFFFAOYSA-N 0 3 424.574 4.363 20 0 HIADHN Cc1ccc(NC(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)cc1C(=O)NC(C)C ZINC000558771481 943655359 /nfs/dbraw/zinc/65/53/59/943655359.db2.gz YJAJCKPPDPHUDK-HXUWFJFHSA-N 0 3 416.953 4.211 20 0 HIADHN CCn1cnnc1-c1ccccc1NC(=O)N[C@H](CN(C)C)c1ccc(Cl)cc1 ZINC000558773134 943656555 /nfs/dbraw/zinc/65/65/55/943656555.db2.gz PXSHTSJJVDJIJR-LJQANCHMSA-N 0 3 412.925 4.043 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)CN[C@@H](c2cccc(C(F)(F)F)c2)C2CC2)cc1 ZINC000558867362 943709667 /nfs/dbraw/zinc/70/96/67/943709667.db2.gz LUNQUIABMZKRCS-HXUWFJFHSA-N 0 3 405.420 4.343 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N1CC[C@](F)(c2ccccc2F)C1 ZINC000558884303 943717611 /nfs/dbraw/zinc/71/76/11/943717611.db2.gz AXBMIFFNDNSHQX-WIYYLYMNSA-N 0 3 405.514 4.304 20 0 HIADHN CCN1CC[C@H](NCC(=O)N[C@@H](C)c2ccccc2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000558891549 943724423 /nfs/dbraw/zinc/72/44/23/943724423.db2.gz HFVYZTXXCUPGDE-GJULWVSJSA-N 0 3 403.929 4.081 20 0 HIADHN CC(C)N1CC[C@H](N[C@@H](C)C(=O)Nc2cccc(F)c2)[C@@H]1c1ccc(F)c(F)c1 ZINC000558896298 943729244 /nfs/dbraw/zinc/72/92/44/943729244.db2.gz KVSVYJMSCWHAND-WVFSVQOHSA-N 0 3 405.464 4.245 20 0 HIADHN CC(C)N1CC[C@H](NCC(=O)N[C@@H](C)c2ccc(F)cc2)[C@@H]1c1ccc(F)c(F)c1 ZINC000558895657 943729762 /nfs/dbraw/zinc/72/97/62/943729762.db2.gz LBOYSYIRZDDCHQ-GNOCETLISA-N 0 3 419.491 4.095 20 0 HIADHN CCN1CC[C@H](N[C@H](C)c2cc(C)c(C(=O)OC)o2)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000558897414 943732267 /nfs/dbraw/zinc/73/22/67/943732267.db2.gz PTLORBUYMNGRAE-GFJSAUFNSA-N 0 3 410.436 4.278 20 0 HIADHN c1ccc(Cn2c(-c3cccc4cccnc43)nnc2N2CCN(CC3CC3)CC2)cc1 ZINC000558912411 943743551 /nfs/dbraw/zinc/74/35/51/943743551.db2.gz GACVIDDMWHVJFX-UHFFFAOYSA-N 0 3 424.552 4.074 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)NCC(C)(C)C(F)(F)F ZINC000558945693 943766316 /nfs/dbraw/zinc/76/63/16/943766316.db2.gz GLEIQBYSCUUVNQ-UHFFFAOYSA-N 0 3 413.406 4.367 20 0 HIADHN COCC(=O)Nc1cccc(CN[C@@H]2CCc3cc(Br)cc(C)c32)c1 ZINC000559075567 943827423 /nfs/dbraw/zinc/82/74/23/943827423.db2.gz OOJSDIBQLVSRMV-GOSISDBHSA-N 0 3 403.320 4.120 20 0 HIADHN COc1ccccc1SCc1nnc(N2CCN(CC(C)C)CC2)n1CC(C)C ZINC000559102937 943840406 /nfs/dbraw/zinc/84/04/06/943840406.db2.gz PGCQFLFUKPXLJW-UHFFFAOYSA-N 0 3 417.623 4.013 20 0 HIADHN C[C@H](c1ccc(F)cc1)N1CC[C@@H](N[C@@H](C)c2ccc(NC(=O)C3CC3)cc2)C1=O ZINC000559147387 943853933 /nfs/dbraw/zinc/85/39/33/943853933.db2.gz WHYNRFHHXSUQEI-WJONJSRFSA-N 0 3 409.505 4.187 20 0 HIADHN COc1ccc(CNC2(Cc3cccc(F)c3)CCOCC2)c(Br)c1O ZINC000559326782 943897077 /nfs/dbraw/zinc/89/70/77/943897077.db2.gz CPIXUUOQVHJXRJ-UHFFFAOYSA-N 0 3 424.310 4.184 20 0 HIADHN Brc1cc2c(s1)CC[C@@H]2NCc1cccc(CN2CCOCC2)c1 ZINC000559739562 944041823 /nfs/dbraw/zinc/04/18/23/944041823.db2.gz KSDZXINPUFIYEH-KRWDZBQOSA-N 0 3 407.377 4.120 20 0 HIADHN CN1CC[C@@H](NCC(=O)Nc2ccc3c(c2)OC2(CCCCC2)O3)[C@H]1c1ccccc1 ZINC000559791099 944050919 /nfs/dbraw/zinc/05/09/19/944050919.db2.gz NSNZCXLVPCNRNZ-HYBUGGRVSA-N 0 3 421.541 4.092 20 0 HIADHN COC1(CCN[C@@H](c2ccc(Cl)cc2)c2cccc(S(C)(=O)=O)c2)CCC1 ZINC000559880331 944073513 /nfs/dbraw/zinc/07/35/13/944073513.db2.gz JDAQLZFPGZPRJH-FQEVSTJZSA-N 0 3 407.963 4.382 20 0 HIADHN C[C@H](Cn1cc(Br)ccc1=O)NCc1ccccc1OC1CCCC1 ZINC000559893382 944078150 /nfs/dbraw/zinc/07/81/50/944078150.db2.gz JGCWGZKTCPHJSV-OAHLLOKOSA-N 0 3 405.336 4.111 20 0 HIADHN COc1ccc2c(c1)[C@H](NCCCS(=O)(=O)c1ccc(Cl)cc1)CCS2 ZINC000559920031 944085410 /nfs/dbraw/zinc/08/54/10/944085410.db2.gz VRIGSFVQAQLSRN-GOSISDBHSA-N 0 3 411.976 4.339 20 0 HIADHN CCC[C@@H](C)N1Cc2cccc([N-]S(=O)(=O)c3ccc(C[NH+](C)C)cc3)c2C1 ZINC000559961283 944101170 /nfs/dbraw/zinc/10/11/70/944101170.db2.gz SMMDPIMHDYCCGR-QGZVFWFLSA-N 0 3 401.576 4.053 20 0 HIADHN Cc1c(Cl)cccc1N1CCCN(C(=O)Nc2cccc(CN(C)C)c2)CC1 ZINC000559963917 944102193 /nfs/dbraw/zinc/10/21/93/944102193.db2.gz XBDGOPJIYDXAHX-UHFFFAOYSA-N 0 3 400.954 4.454 20 0 HIADHN Cc1ccc2nc(CNC3CCN(C(=O)c4ccccc4C(F)(F)F)CC3)cn2c1 ZINC000560080695 944151951 /nfs/dbraw/zinc/15/19/51/944151951.db2.gz VDQKUIXNQQZDKC-UHFFFAOYSA-N 0 3 416.447 4.056 20 0 HIADHN COC(=O)[C@H](Cc1ccccc1)[C@@H](C)N[C@@H](C)C(=O)Nc1ccccc1C(F)(F)F ZINC000560177445 944187576 /nfs/dbraw/zinc/18/75/76/944187576.db2.gz ZYZKQPLFIPQEIB-HLLBOEOZSA-N 0 3 422.447 4.042 20 0 HIADHN COC(=O)[C@H](Cc1ccccc1)[C@H](C)N[C@H](C)C(=O)Nc1ccc(Cl)cc1Cl ZINC000560178522 944188181 /nfs/dbraw/zinc/18/81/81/944188181.db2.gz QIXYQUXQSARDGL-JJRVBVJISA-N 0 3 423.340 4.330 20 0 HIADHN COC(=O)[C@H](Cc1ccccc1)[C@@H](C)N[C@@H](C)C(=O)Nc1ccc(Cl)cc1Cl ZINC000560178523 944188503 /nfs/dbraw/zinc/18/85/03/944188503.db2.gz QIXYQUXQSARDGL-JKIFEVAISA-N 0 3 423.340 4.330 20 0 HIADHN COC(=O)[C@H](Cc1ccccc1)[C@@H](C)N[C@H](C)C(=O)Nc1c(C)cc(C)cc1Cl ZINC000560178977 944188526 /nfs/dbraw/zinc/18/85/26/944188526.db2.gz DFMPGHRESVUSIR-ZHALLVOQSA-N 0 3 416.949 4.294 20 0 HIADHN Cc1cccc(CNC(=O)CN[C@@H](c2cccc(C(F)(F)F)c2)C2CCOCC2)c1 ZINC000560179999 944189895 /nfs/dbraw/zinc/18/98/95/944189895.db2.gz JTQIFFSEWZYRQE-JOCHJYFZSA-N 0 3 420.475 4.388 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3cc(-c4ccccc4)cnc3C)cc2)CC1 ZINC000560200886 944195052 /nfs/dbraw/zinc/19/50/52/944195052.db2.gz ZKPOAEIZQQQRPY-UHFFFAOYSA-N 0 3 400.526 4.451 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)[C@@H](C)Cc2ccc(Br)cc2)cc1 ZINC000560248166 944206609 /nfs/dbraw/zinc/20/66/09/944206609.db2.gz CGVCWBIQHISFNV-MGPUTAFESA-N 0 3 419.363 4.055 20 0 HIADHN CCc1ccc([C@H](CNC(=O)C(=O)Nc2cccc(C(F)F)c2)N(CC)CC)cc1 ZINC000560254243 944208456 /nfs/dbraw/zinc/20/84/56/944208456.db2.gz YDLAGNUYXMSWRK-FQEVSTJZSA-N 0 3 417.500 4.324 20 0 HIADHN C[C@@H](N[C@H](c1cncc(Br)c1)C1CC1)c1cccc(N2CCOCC2)c1 ZINC000560269712 944214413 /nfs/dbraw/zinc/21/44/13/944214413.db2.gz XNSMAVXUWQTSEP-VFNWGFHPSA-N 0 3 416.363 4.483 20 0 HIADHN COc1ccc([C@H](Cc2ccncc2)NCc2ccc(OC)c(NC(C)=O)c2)cc1 ZINC000560528661 944244008 /nfs/dbraw/zinc/24/40/08/944244008.db2.gz JPBJJJDTIBKNIA-QFIPXVFZSA-N 0 3 405.498 4.131 20 0 HIADHN COC(=O)c1ccc(C)c(NC(=O)[C@H](C)N[C@@H]2CC[C@H](c3ccccc3)C[C@@H]2OC)c1 ZINC000560539022 944247600 /nfs/dbraw/zinc/24/76/00/944247600.db2.gz ZSORIYOMFPQMKC-DFPDZIMCSA-N 0 3 424.541 4.050 20 0 HIADHN C[C@H](NCc1cnn(-c2ccc(Br)cc2)c1)c1ccccc1-n1ccnn1 ZINC000560545865 944248907 /nfs/dbraw/zinc/24/89/07/944248907.db2.gz YJNFPPRJAANCSV-HNNXBMFYSA-N 0 3 423.318 4.066 20 0 HIADHN COc1cc(Br)ccc1[C@H](C)N[C@H](C)c1ccccc1-n1ccnn1 ZINC000560549345 944249943 /nfs/dbraw/zinc/24/99/43/944249943.db2.gz MDMAPOPEAPAWNY-KGLIPLIRSA-N 0 3 401.308 4.450 20 0 HIADHN Fc1ccc(-c2nn(-c3ccccc3)cc2CN2CCC(O[C@H]3CCOC3)CC2)cc1 ZINC000560567315 944257257 /nfs/dbraw/zinc/25/72/57/944257257.db2.gz SNSDNCJMZMRLDJ-DEOSSOPVSA-N 0 3 421.516 4.448 20 0 HIADHN COc1ccccc1NC(=O)C[C@@H](C)N[C@H](CCO)c1ccc(Cl)c(Cl)c1 ZINC000560585573 944264158 /nfs/dbraw/zinc/26/41/58/944264158.db2.gz UATMESOGWFDWQV-CXAGYDPISA-N 0 3 411.329 4.432 20 0 HIADHN O=C(Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)C1CCC(OC(F)F)CC1 ZINC000560597838 944268038 /nfs/dbraw/zinc/26/80/38/944268038.db2.gz NOEYSMZJMDEKFM-XBMUEBEBSA-N 0 3 418.488 4.067 20 0 HIADHN Cc1cc(NC(=O)[C@@H]2CCC(=O)c3ccccc32)cc(N2CCN(C(C)C)CC2)c1 ZINC000560672346 944288802 /nfs/dbraw/zinc/28/88/02/944288802.db2.gz CPLKFEQVFQVCBD-HSZRJFAPSA-N 0 3 405.542 4.224 20 0 HIADHN Cc1cc(C)c(CNC[C@H](O)COc2ccc(C(C)(C)c3ccccc3)cc2)c(=O)[nH]1 ZINC000560668358 944289386 /nfs/dbraw/zinc/28/93/86/944289386.db2.gz OHAKCAZUTRJGPU-QFIPXVFZSA-N 0 3 420.553 4.259 20 0 HIADHN C[C@H]1CCc2[nH]c3ccc(C(=O)Nc4cccc(CN5CC[C@H](O)C5)c4)cc3c2C1 ZINC000560675347 944289819 /nfs/dbraw/zinc/28/98/19/944289819.db2.gz IDJZFXPYOQJQFN-JXFKEZNVSA-N 0 3 403.526 4.112 20 0 HIADHN Cc1ccc(S(=O)(=O)N[C@H](CCN(C)[C@H](C)c2cccnc2)c2ccccc2)cc1 ZINC000560854230 944358569 /nfs/dbraw/zinc/35/85/69/944358569.db2.gz FMGMRARAYMLCOW-HYBUGGRVSA-N 0 3 423.582 4.493 20 0 HIADHN C[C@H](C(=O)N(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1)C1CCOCC1 ZINC000561077325 944432567 /nfs/dbraw/zinc/43/25/67/944432567.db2.gz SSPMOCXZGTWGFH-SQJMNOBHSA-N 0 3 421.585 4.138 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)c1nc(C2CC2)n(-c2ccccc2Cl)n1 ZINC000561263529 944532514 /nfs/dbraw/zinc/53/25/14/944532514.db2.gz WEEWACYMFFOVQU-UHFFFAOYSA-N 0 3 415.969 4.136 20 0 HIADHN C[C@H](NC(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1)c1c(F)cncc1F ZINC000561434805 944596742 /nfs/dbraw/zinc/59/67/42/944596742.db2.gz MUNTYRKVHDQRJP-YOEHRIQHSA-N 0 3 408.518 4.255 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)c1ccc(NC(=O)CC(C)C)c(F)c1)c1ccco1 ZINC000561610577 944705773 /nfs/dbraw/zinc/70/57/73/944705773.db2.gz NOCJZYGTJKHTHY-KXBFYZLASA-N 0 3 403.498 4.263 20 0 HIADHN Cc1c(C(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)cnn1-c1ccccc1 ZINC000561658010 944733124 /nfs/dbraw/zinc/73/31/24/944733124.db2.gz SVQFXKMPSPTDCQ-QHCPKHFHSA-N 0 3 406.530 4.001 20 0 HIADHN Cc1ccc(CN2CC[C@H](CN(C)C(=O)CCC(=O)c3ccc(F)c(F)c3)C2)s1 ZINC000561698091 944753140 /nfs/dbraw/zinc/75/31/40/944753140.db2.gz MVCFOGBKYOGICN-MRXNPFEDSA-N 0 3 420.525 4.278 20 0 HIADHN C[C@H]1C[C@@H]1N1CCN(C(=O)c2cccc(-c3noc(CC(C)(C)C)n3)c2)C[C@@H](C)C1 ZINC000561761971 944785026 /nfs/dbraw/zinc/78/50/26/944785026.db2.gz PBALVGDGKZEISJ-ZWOKBUDYSA-N 0 3 410.562 4.128 20 0 HIADHN CC(C)Oc1ccc(-c2nc(C(=O)N3CCN([C@@H]4C[C@@H]4C)C[C@H](C)C3)cs2)cc1 ZINC000561762241 944785353 /nfs/dbraw/zinc/78/53/53/944785353.db2.gz LOELSVJPCCQDDL-XGHQBKJUSA-N 0 3 413.587 4.400 20 0 HIADHN CCC[C@@H]1C[C@H](C(=O)Nc2ccc(N3CCN(CCC)CC3)cc2OCC)CCO1 ZINC000561796553 944800329 /nfs/dbraw/zinc/80/03/29/944800329.db2.gz AHLGOSZQDXJYQZ-TZIWHRDSSA-N 0 3 417.594 4.151 20 0 HIADHN FC1(F)CCN(Cc2ccccc2)C[C@H]1c1nc(-c2ccc3nccnc3c2)no1 ZINC000561892825 944840759 /nfs/dbraw/zinc/84/07/59/944840759.db2.gz ILMWBWUQUMLQEN-KRWDZBQOSA-N 0 3 407.424 4.305 20 0 HIADHN COc1cc([C@H](C)NC[C@@H]2CCN(c3cccc(Br)c3)C2)c(F)cn1 ZINC000562018922 944897201 /nfs/dbraw/zinc/89/72/01/944897201.db2.gz YSIFQOLUQZOHJW-KBPBESRZSA-N 0 3 408.315 4.169 20 0 HIADHN CN1CC[C@@H](NCC(=O)N(Cc2ccccc2)C(C)(C)C)[C@@H]1c1ccc(F)c(F)c1 ZINC000562045968 944909371 /nfs/dbraw/zinc/90/93/71/944909371.db2.gz FOFCVRGECRCTQM-GGAORHGYSA-N 0 3 415.528 4.127 20 0 HIADHN C[C@H](N[C@@H]1CCN(C)[C@@H]1c1ccc(Cl)cc1)C(=O)N1CCC[C@H]1c1cccs1 ZINC000562049017 944911284 /nfs/dbraw/zinc/91/12/84/944911284.db2.gz NGFARXLYBWDZGF-DZJZLKLXSA-N 0 3 418.006 4.489 20 0 HIADHN CN1CC[C@H](NCc2cn3ccc(Br)cc3n2)[C@H]1c1ccc(Cl)cc1 ZINC000562067929 944920581 /nfs/dbraw/zinc/92/05/81/944920581.db2.gz AJVTYDVGFIFCOB-PKOBYXMFSA-N 0 3 419.754 4.285 20 0 HIADHN CN(C)C[C@@H](NC(=O)Nc1ccc(-n2cccn2)c(Cl)c1)c1ccc(F)cc1 ZINC000562148974 944979890 /nfs/dbraw/zinc/97/98/90/944979890.db2.gz ZPHQRYRYJJBOPO-GOSISDBHSA-N 0 3 401.873 4.089 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)Nc1ccc(OC)c(Br)c1)c1ccco1 ZINC000562169185 944999779 /nfs/dbraw/zinc/99/97/79/944999779.db2.gz QNTJARXHEWBMQG-IUODEOHRSA-N 0 3 410.312 4.302 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1NC(=O)N[C@@H]1CCN(Cc2ccccc2)[C@H]1C ZINC000564136734 945395692 /nfs/dbraw/zinc/39/56/92/945395692.db2.gz YYODYENFBFNCCC-PGRDOPGGSA-N 0 3 403.530 4.274 20 0 HIADHN CCC(CC)Nc1ccncc1NC(=O)c1ccc(-c2noc(C(F)F)n2)cc1 ZINC000564348489 945521563 /nfs/dbraw/zinc/52/15/63/945521563.db2.gz KYNGKXCYISUMQA-UHFFFAOYSA-N 0 3 401.417 4.344 20 0 HIADHN COC(=O)c1ccc(-c2nc(CN[C@@H]3CCN(C)[C@H]3c3ccccc3)cs2)cc1 ZINC000564393479 945552147 /nfs/dbraw/zinc/55/21/47/945552147.db2.gz NFXXDCPPGPPHHG-RTWAWAEBSA-N 0 3 407.539 4.132 20 0 HIADHN O[C@H]1[C@H](CNCc2cc(C(F)(F)F)ccc2Br)CCC12CCOCC2 ZINC000564413239 945564484 /nfs/dbraw/zinc/56/44/84/945564484.db2.gz CACKQFMEZCPFEO-LRDDRELGSA-N 0 3 422.285 4.125 20 0 HIADHN FC(F)(F)Cc1noc(-c2cccc(CNCc3ccc(N4CCCC4)nc3)c2)n1 ZINC000564413843 945566528 /nfs/dbraw/zinc/56/65/28/945566528.db2.gz FVVOYXDXWMZMGB-UHFFFAOYSA-N 0 3 417.435 4.126 20 0 HIADHN COc1ccc(-c2ocnc2C(=O)NC[C@H](c2ccc(SC)cc2)N(C)C)cc1 ZINC000564484976 945616515 /nfs/dbraw/zinc/61/65/15/945616515.db2.gz AHTGVNKKRQDISI-LJQANCHMSA-N 0 3 411.527 4.105 20 0 HIADHN C[C@H](CC(=O)N(Cc1ccccc1Br)C1CCN(C)CC1)n1cccc1 ZINC000564591344 945691681 /nfs/dbraw/zinc/69/16/81/945691681.db2.gz UKNMTPBEONBCGX-QGZVFWFLSA-N 0 3 418.379 4.325 20 0 HIADHN CC[C@H]1C[C@@H](C(=O)N(Cc2ccccc2Br)C2CCN(C)CC2)CCO1 ZINC000564590972 945691726 /nfs/dbraw/zinc/69/17/26/945691726.db2.gz QRZGZROGCILIHV-LPHOPBHVSA-N 0 3 423.395 4.077 20 0 HIADHN CCc1ncsc1C(=O)N(Cc1ccccc1Br)C1CCN(C)CC1 ZINC000564591455 945691754 /nfs/dbraw/zinc/69/17/54/945691754.db2.gz LGZLZXYQWZFVDM-UHFFFAOYSA-N 0 3 422.392 4.205 20 0 HIADHN CC(=O)N(c1nc(CN2CCCN(C)CC2)cs1)c1ccc(Cl)c(Cl)c1 ZINC000564593959 945692430 /nfs/dbraw/zinc/69/24/30/945692430.db2.gz UBHXJKDZVFZKBG-UHFFFAOYSA-N 0 3 413.374 4.272 20 0 HIADHN CSc1ccc([C@H](CNC(=O)c2cnn(-c3ccccc3F)c2C)N(C)C)cc1 ZINC000564682013 945727653 /nfs/dbraw/zinc/72/76/53/945727653.db2.gz BXJSVKAHXPCXMB-NRFANRHFSA-N 0 3 412.534 4.074 20 0 HIADHN COc1ccc([C@@H]2CCCCCN2C(=O)CN[C@@H]2CCN(C)[C@@H]2c2ccccc2)cc1 ZINC000564760061 945752344 /nfs/dbraw/zinc/75/23/44/945752344.db2.gz ICXBHBKVZHSKAM-RMTZWNOUSA-N 0 3 421.585 4.174 20 0 HIADHN COc1cc(CN[C@@H](C)c2cc[nH]c(=O)c2)cc(Br)c1OC(F)F ZINC000565057481 945764986 /nfs/dbraw/zinc/76/49/86/945764986.db2.gz SJYNGUGKVBKMJS-VIFPVBQESA-N 0 3 403.223 4.011 20 0 HIADHN CCCC[C@@H](N[C@H]1CCCc2ccc(S(N)(=O)=O)cc21)c1ccc(OC)cc1 ZINC000565450170 945833384 /nfs/dbraw/zinc/83/33/84/945833384.db2.gz LAAMRBXQUBAKAR-YADHBBJMSA-N 0 3 402.560 4.241 20 0 HIADHN C[C@@H](c1ccc(Cl)cc1)N1CCN(C[C@H]2CCN(C(=O)c3ccccc3)C2)CC1 ZINC000565490304 945837285 /nfs/dbraw/zinc/83/72/85/945837285.db2.gz DKRNFAIHBBHNHD-VQTJNVASSA-N 0 3 411.977 4.181 20 0 HIADHN C[C@H](c1ccc(Cl)cc1)N1CCN(C[C@H]2CCN(C(=O)c3ccccc3)C2)CC1 ZINC000565490306 945837706 /nfs/dbraw/zinc/83/77/06/945837706.db2.gz DKRNFAIHBBHNHD-WOJBJXKFSA-N 0 3 411.977 4.181 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)c3cc(Cl)c4ccccc4n3)CC2)C[C@H](C)O1 ZINC000565553354 945846680 /nfs/dbraw/zinc/84/66/80/945846680.db2.gz JINUXFIHRATTSB-IRXDYDNUSA-N 0 3 415.965 4.240 20 0 HIADHN C[C@@H]1[C@H](NC(=O)Nc2ccc(F)cc2-c2cnn(C)c2)CCN1Cc1ccccc1 ZINC000565563570 945849367 /nfs/dbraw/zinc/84/93/67/945849367.db2.gz PWDMDWJAKKKDMF-IIBYNOLFSA-N 0 3 407.493 4.011 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)c1ccc(NC(=O)c2ccccc2)cc1)c1ccco1 ZINC000565679164 945865553 /nfs/dbraw/zinc/86/55/53/945865553.db2.gz QZJRFMUARLQKAT-UWJYYQICSA-N 0 3 405.498 4.391 20 0 HIADHN CCOc1ccc(CN(CCCn2ccnc2)Cc2cnc3c(C)cccn23)cc1 ZINC000566036620 945988504 /nfs/dbraw/zinc/98/85/04/945988504.db2.gz PZBZYKWWSMHIIU-UHFFFAOYSA-N 0 3 403.530 4.330 20 0 HIADHN O=C([C@@H]1CN(Cc2ccccc2)CCC1(F)F)N1CCC(CC(F)(F)F)CC1 ZINC000566381389 946014767 /nfs/dbraw/zinc/01/47/67/946014767.db2.gz OXLSHPRJMKDLLA-KRWDZBQOSA-N 0 3 404.423 4.335 20 0 HIADHN CCCN(C)[C@H](CNC(=O)N[C@H](C)c1ccncc1OC)c1ccc(Cl)cc1 ZINC000566553834 946038604 /nfs/dbraw/zinc/03/86/04/946038604.db2.gz YGESXGSFHZBPJG-DNVCBOLYSA-N 0 3 404.942 4.187 20 0 HIADHN C/C(=C/c1cccc(C(F)(F)F)c1)CN(C)[C@@H](C)c1cccc(S(N)(=O)=O)c1 ZINC000566587840 946050068 /nfs/dbraw/zinc/05/00/68/946050068.db2.gz KTSGYMSOKSWZAR-LTBFUDJGSA-N 0 3 412.477 4.449 20 0 HIADHN CC[C@@](C)(COc1ncccc1Cl)NCC(=O)N(C)[C@H](C)c1ccccc1OC ZINC000566669766 946069308 /nfs/dbraw/zinc/06/93/08/946069308.db2.gz MGTUVXZULMOQHY-ZHRRBRCNSA-N 0 3 419.953 4.100 20 0 HIADHN CC[C@H](NCc1cccc(NC(=O)c2ccccn2)c1)c1ccc(C(=O)OC)cc1 ZINC000566692854 946073678 /nfs/dbraw/zinc/07/36/78/946073678.db2.gz HSCNGAIMTUTJAK-NRFANRHFSA-N 0 3 403.482 4.361 20 0 HIADHN Cc1ccc(Cc2nc(C(=O)N(C)CCCN(C)Cc3ccncc3)cs2)cc1 ZINC000567156367 946258316 /nfs/dbraw/zinc/25/83/16/946258316.db2.gz RRUGSAVLKFNJNH-UHFFFAOYSA-N 0 3 408.571 4.031 20 0 HIADHN COc1ccc2c(c1)[C@H](NCCCS(=O)(=O)c1ccc(Cl)cc1)CCCO2 ZINC000567296109 946298658 /nfs/dbraw/zinc/29/86/58/946298658.db2.gz AIRDRDHCQXFVCQ-LJQANCHMSA-N 0 3 409.935 4.016 20 0 HIADHN CN(C)C[C@H](NC(=O)c1cc(F)c(F)cc1Br)c1ccc(Cl)cc1 ZINC000567472329 946344984 /nfs/dbraw/zinc/34/49/84/946344984.db2.gz NDWCIUHTYOUAQP-INIZCTEOSA-N 0 3 417.681 4.413 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)c1ccn(-c2cccc(C(F)(F)F)c2)n1)c1ccco1 ZINC000567538502 946366235 /nfs/dbraw/zinc/36/62/35/946366235.db2.gz VIMCSNGHPMOXLG-KDOFPFPSSA-N 0 3 420.435 4.343 20 0 HIADHN Cc1ccccc1[C@H](CC(F)(F)F)NC(=O)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000567604518 946383527 /nfs/dbraw/zinc/38/35/27/946383527.db2.gz XUKFSQGTHPSUSG-ICSRJNTNSA-N 0 3 405.464 4.412 20 0 HIADHN C[C@H]1CCCCN1CCNC(=O)C(C)(C)c1csc(-c2cc(F)ccc2F)n1 ZINC000567798345 946413811 /nfs/dbraw/zinc/41/38/11/946413811.db2.gz JHNIBBLJJWHTLL-AWEZNQCLSA-N 0 3 407.530 4.357 20 0 HIADHN CCC(CC)Nc1ccncc1NC(=O)c1ccc(S(=O)(=O)C2CCCC2)cc1 ZINC000567966812 946432943 /nfs/dbraw/zinc/43/29/43/946432943.db2.gz BSMGPPLVAPJQJM-UHFFFAOYSA-N 0 3 415.559 4.073 20 0 HIADHN COCCCN(C(=O)c1csc(-c2cccc(Cl)c2)n1)C1CCN(C)CC1 ZINC000567977462 946437876 /nfs/dbraw/zinc/43/78/76/946437876.db2.gz ZTNCNINIJALPHT-UHFFFAOYSA-N 0 3 407.967 4.036 20 0 HIADHN FC(F)(F)c1ccc(-c2n[nH]cc2CN2CCC(OC[C@H]3CCOC3)CC2)cc1 ZINC000567997240 946439801 /nfs/dbraw/zinc/43/98/01/946439801.db2.gz YXRJYMPCWFUWHB-HNNXBMFYSA-N 0 3 409.452 4.113 20 0 HIADHN CC[C@H](C)[C@@H](NCC(=O)Nc1ccccc1SCC(N)=O)c1ccc(Cl)cc1 ZINC000568063781 946453869 /nfs/dbraw/zinc/45/38/69/946453869.db2.gz WOKLHNGCTMPUEY-LHSJRXKWSA-N 0 3 419.978 4.233 20 0 HIADHN OC[C@H]1C=C[C@@H](N(CCOc2ccc(Br)cc2)Cc2cccs2)C1 ZINC000568282893 946490017 /nfs/dbraw/zinc/49/00/17/946490017.db2.gz ZFAQAYFNOZYNAA-DOTOQJQBSA-N 0 3 408.361 4.329 20 0 HIADHN Cc1cnn(-c2ccc(NC(=O)N(CCN(C)C)Cc3cccc(F)c3)cc2F)c1 ZINC000568695773 946663281 /nfs/dbraw/zinc/66/32/81/946663281.db2.gz KXCDGWDJGDSVOI-UHFFFAOYSA-N 0 3 413.472 4.055 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)N[C@@H]2c3ccccc3CC23CCOCC3)CN1Cc1ccccc1 ZINC000569048682 946809329 /nfs/dbraw/zinc/80/93/29/946809329.db2.gz PRKIARVEKWTJKB-WNOPAQSVSA-N 0 3 419.569 4.043 20 0 HIADHN COc1cccc2c1CCC[C@H]2NCc1nnc(-c2ccc(Br)cc2)[nH]1 ZINC000569185451 946835104 /nfs/dbraw/zinc/83/51/04/946835104.db2.gz NOHXYJWYMSVVOQ-QGZVFWFLSA-N 0 3 413.319 4.410 20 0 HIADHN COc1cccc2c1CCC[C@H]2[NH2+]Cc1nnc(-c2ccc(Br)cc2)[n-]1 ZINC000569185451 946835113 /nfs/dbraw/zinc/83/51/13/946835113.db2.gz NOHXYJWYMSVVOQ-QGZVFWFLSA-N 0 3 413.319 4.410 20 0 HIADHN CCOC(=O)CC(C)(C)CC[NH+]1CCC(C(=O)Nc2cc(Cl)ccc2[O-])CC1 ZINC000569255360 946841851 /nfs/dbraw/zinc/84/18/51/946841851.db2.gz PBRPMAHWWKRYHP-UHFFFAOYSA-N 0 3 410.942 4.066 20 0 HIADHN COc1cccc(C(=O)CCCC(=O)N2C[C@H]3CCN(Cc4ccccc4)C[C@H]3C2)c1 ZINC000569636499 946912630 /nfs/dbraw/zinc/91/26/30/946912630.db2.gz KFTMXSSYUKAGTN-PKTZIBPZSA-N 0 3 420.553 4.029 20 0 HIADHN COC(C)(C)c1nc(C)c(C(=O)NC[C@@H]2CCCN(C)[C@@H]2c2cccs2)s1 ZINC000569892881 947039709 /nfs/dbraw/zinc/03/97/09/947039709.db2.gz LVMKUWYBIJHYOE-HOCLYGCPSA-N 0 3 407.605 4.207 20 0 HIADHN COC(=O)c1cc(CN[C@@H](C)c2ccc(OCc3ccccc3)c(OC)c2)cn1C ZINC000569969403 947055861 /nfs/dbraw/zinc/05/58/61/947055861.db2.gz YQWHYYHOBDRGFO-KRWDZBQOSA-N 0 3 408.498 4.250 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)c1nc2ccccc2cc1Cl ZINC000569974618 947059425 /nfs/dbraw/zinc/05/94/25/947059425.db2.gz VBQVXWABOAQZMS-UHFFFAOYSA-N 0 3 422.960 4.220 20 0 HIADHN Cn1c(CNCCc2cccc(C(F)(F)F)n2)nc2cc(C(F)(F)F)ccc21 ZINC000570229688 947153758 /nfs/dbraw/zinc/15/37/58/947153758.db2.gz YZTWZXZOPHUAMR-UHFFFAOYSA-N 0 3 402.342 4.338 20 0 HIADHN CC(=O)Nc1ccc([C@H](C)NCc2ccc(OCCOc3ccccc3)nc2)cc1 ZINC000570238178 947160515 /nfs/dbraw/zinc/16/05/15/947160515.db2.gz RHZVDGNHNWYTIF-SFHVURJKSA-N 0 3 405.498 4.349 20 0 HIADHN OC[C@H](CNCc1conc1Cc1ccccc1)Cc1ccc(C(F)(F)F)cc1 ZINC000570263219 947176577 /nfs/dbraw/zinc/17/65/77/947176577.db2.gz SOZBJNGLMAATBC-SFHVURJKSA-N 0 3 404.432 4.225 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)Cc1c[nH]c2cc(Br)ccc12)c1ccco1 ZINC000570424355 947236208 /nfs/dbraw/zinc/23/62/08/947236208.db2.gz JRQIQLALUYCMBK-ACJLOTCBSA-N 0 3 418.335 4.312 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)N1CCC2(CCOCC2)[C@@H]1C)c1ccc(Cl)cc1 ZINC000570433444 947243694 /nfs/dbraw/zinc/24/36/94/947243694.db2.gz OGVRGYFDNZFULG-PXNSSMCTSA-N 0 3 407.986 4.324 20 0 HIADHN COc1ccc(C[C@@H](NCC(=O)NCc2sccc2C)c2ccc(OC)cc2)cc1 ZINC000570471466 947256284 /nfs/dbraw/zinc/25/62/84/947256284.db2.gz GGSBPJTTYQXLML-JOCHJYFZSA-N 0 3 424.566 4.264 20 0 HIADHN COc1ccc(C[C@H](NCC(=O)NCc2sccc2C)c2ccc(OC)cc2)cc1 ZINC000570471467 947256686 /nfs/dbraw/zinc/25/66/86/947256686.db2.gz GGSBPJTTYQXLML-QFIPXVFZSA-N 0 3 424.566 4.264 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)c2ccc3[nH]c(C(F)F)nc3c2)N(C)C)cc1 ZINC000570751799 947345531 /nfs/dbraw/zinc/34/55/31/947345531.db2.gz NYVJNVJUEKGLAU-LJQANCHMSA-N 0 3 416.472 4.320 20 0 HIADHN CN1CC[C@H](NCC(=O)Nc2ccc(OCc3ccccc3)cc2)[C@@H]1c1ccccc1 ZINC000570762958 947350663 /nfs/dbraw/zinc/35/06/63/947350663.db2.gz XCSDGSUGRBTDMQ-AHWVRZQESA-N 0 3 415.537 4.239 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)N[C@@H](c2ccccc2)C(F)(F)F)c1 ZINC000570771905 947354763 /nfs/dbraw/zinc/35/47/63/947354763.db2.gz ATKNASKUQKRHNY-IBGZPJMESA-N 0 3 409.452 4.072 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)N1CCC(c2c[nH]c3ncccc23)CC1 ZINC000570842901 947367272 /nfs/dbraw/zinc/36/72/72/947367272.db2.gz WETANYPFPGITCW-FQEVSTJZSA-N 0 3 423.586 4.351 20 0 HIADHN COc1ncc([C@H](C)NCc2ccc(CN3C[C@@H](C)O[C@@H](C)C3)cc2)cc1Cl ZINC000570913670 947392215 /nfs/dbraw/zinc/39/22/15/947392215.db2.gz OATQVNLAJMQYKV-BBWFWOEESA-N 0 3 403.954 4.204 20 0 HIADHN CN1CCC(N(Cc2ccccc2Br)C(=O)[C@@H]2CCCSC2)CC1 ZINC000571133602 947526420 /nfs/dbraw/zinc/52/64/20/947526420.db2.gz OSBQPVORXGPZLV-MRXNPFEDSA-N 0 3 411.409 4.015 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)Cc1cc(Cl)ccc1Br)c1ccco1 ZINC000571236889 947560265 /nfs/dbraw/zinc/56/02/65/947560265.db2.gz NDCTYCQOOZSPRX-MLGOLLRUSA-N 0 3 413.743 4.484 20 0 HIADHN CC(C)c1nc(CCNC(=O)Nc2ccc(CCN3CCSCC3)cc2)cs1 ZINC000571265871 947575473 /nfs/dbraw/zinc/57/54/73/947575473.db2.gz CEMPLWXZHZJVNO-UHFFFAOYSA-N 0 3 418.632 4.222 20 0 HIADHN CCN1CC[C@H](NCC(=O)Nc2ccccc2Cl)[C@H]1c1ccc(Cl)c(F)c1 ZINC000571421699 947639870 /nfs/dbraw/zinc/63/98/70/947639870.db2.gz YFEWZIPNPFWLFJ-AZUAARDMSA-N 0 3 410.320 4.496 20 0 HIADHN COc1ccc(C(=O)NC[C@H](c2ccc(SC)cc2)N(C)C)c(OC(C)C)c1 ZINC000571478590 947667109 /nfs/dbraw/zinc/66/71/09/947667109.db2.gz QLPFIQYCQLGMSU-HXUWFJFHSA-N 0 3 402.560 4.237 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@H]3CCc4sc(Cl)cc43)c2)CC1 ZINC000571484781 947674046 /nfs/dbraw/zinc/67/40/46/947674046.db2.gz JFNWNLVIDGDXPT-KRWDZBQOSA-N 0 3 404.967 4.352 20 0 HIADHN Cc1nn(-c2ccncc2)cc1CN(CCn1ccnc1)Cc1cccc(Cl)c1 ZINC000571567438 947706831 /nfs/dbraw/zinc/70/68/31/947706831.db2.gz KSMGTPZBDMUDGU-UHFFFAOYSA-N 0 3 406.921 4.128 20 0 HIADHN COc1ccc(CN[C@@H]2CCN(C)[C@H]2c2ccccc2)c(Br)c1OC ZINC000571690534 947748468 /nfs/dbraw/zinc/74/84/68/947748468.db2.gz FJLJQGCNTGBGCN-APWZRJJASA-N 0 3 405.336 4.001 20 0 HIADHN CCOC(=O)C1CCC(N(CC)Cc2coc(-c3ccc(C(=O)OC)cc3)n2)CC1 ZINC000571779436 947776936 /nfs/dbraw/zinc/77/69/36/947776936.db2.gz SWMWQOAXZDXXIP-UHFFFAOYSA-N 0 3 414.502 4.072 20 0 HIADHN Cc1cc(CN[C@@H]2CCCc3ccc(S(N)(=O)=O)cc32)ccc1-c1ccccc1 ZINC000571783489 947781652 /nfs/dbraw/zinc/78/16/52/947781652.db2.gz FGVNIAZCZGRUMH-XMMPIXPASA-N 0 3 406.551 4.477 20 0 HIADHN CSc1ccc(-c2nsc(NC(=O)N(CCN(C)C)Cc3ccco3)n2)cc1 ZINC000571809076 947791187 /nfs/dbraw/zinc/79/11/87/947791187.db2.gz BWMPGAXRIRPGCZ-UHFFFAOYSA-N 0 3 417.560 4.116 20 0 HIADHN CN(CCN1c2cccc3cccc(c23)S1(=O)=O)[C@H]1CC[C@@H](C(F)(F)F)CC1 ZINC000571956401 947821346 /nfs/dbraw/zinc/82/13/46/947821346.db2.gz DVJIQEKMTQITNZ-IYBDPMFKSA-N 0 3 412.477 4.401 20 0 HIADHN CCCCO[C@@H]1C[C@@H](NCC(=O)Nc2c(C)nn(-c3ccc(C)cc3)c2C)C1(C)C ZINC000572079679 947841256 /nfs/dbraw/zinc/84/12/56/947841256.db2.gz LTAJSTVMQIXUCT-NHCUHLMSSA-N 0 3 412.578 4.309 20 0 HIADHN O=C(C[C@@H]1CCCCO1)N(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000572192365 947859637 /nfs/dbraw/zinc/85/96/37/947859637.db2.gz CVVWCYXCEUCDIV-ZEQRLZLVSA-N 0 3 407.558 4.034 20 0 HIADHN FC(F)(F)c1cccc([C@@H]2CCCN(Cc3cnc(N4CCOCC4)s3)C2)c1 ZINC000572205508 947863721 /nfs/dbraw/zinc/86/37/21/947863721.db2.gz MSDYRRPMLMNLMC-MRXNPFEDSA-N 0 3 411.493 4.378 20 0 HIADHN CCC(CC)(CNCc1c(Br)c(C)nn1C)c1ccc(OC)c(OC)c1 ZINC000572232114 947869225 /nfs/dbraw/zinc/86/92/25/947869225.db2.gz HZUSBSBMVXEVKV-UHFFFAOYSA-N 0 3 424.383 4.356 20 0 HIADHN Cc1nc2cccc(C(=O)Nc3cc(NC(=O)CN4CCCC[C@@H]4C)ccc3F)c2[nH]1 ZINC000572260003 947869959 /nfs/dbraw/zinc/86/99/59/947869959.db2.gz HLCQBRVPXVCFGQ-AWEZNQCLSA-N 0 3 423.492 4.076 20 0 HIADHN Cc1ccc(Cl)cc1NC(=O)C[C@H](C)N[C@@H](CC(=O)N(C)C)c1ccccc1 ZINC000572387589 947892534 /nfs/dbraw/zinc/89/25/34/947892534.db2.gz IIAVJXYXRZSSFN-JXFKEZNVSA-N 0 3 401.938 4.175 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)CCc1cc(F)ccc1Br)c1ccco1 ZINC000572394093 947893111 /nfs/dbraw/zinc/89/31/11/947893111.db2.gz MHDAXVCNGMHTEH-CXAGYDPISA-N 0 3 411.315 4.359 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc(CN[C@@H](C)c2ccc(OC(C)C)cc2)cc1 ZINC000572507590 947920365 /nfs/dbraw/zinc/92/03/65/947920365.db2.gz XQCVWFQJCIXBFW-SFHVURJKSA-N 0 3 404.576 4.355 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)Cc1cc2ccccc2[nH]c1=O)c1ccc(Cl)cc1 ZINC000572708391 947991682 /nfs/dbraw/zinc/99/16/82/947991682.db2.gz JOQDYOSKFMBIFJ-NRFANRHFSA-N 0 3 411.933 4.336 20 0 HIADHN FC(F)(F)[C@]1(c2nc(CCC3CCOCC3)no2)CCN(Cc2ccccc2)C1 ZINC000572905593 948035906 /nfs/dbraw/zinc/03/59/06/948035906.db2.gz XZJPNZZLZGPOHB-HXUWFJFHSA-N 0 3 409.452 4.135 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccc(OCc4cn5cccc(C)c5n4)cc3)C2)c1 ZINC000573375307 948171327 /nfs/dbraw/zinc/17/13/27/948171327.db2.gz BQDVABNPGRGZLU-JOCHJYFZSA-N 0 3 401.514 4.174 20 0 HIADHN C[C@H]1[C@H](NC(=O)N(Cc2ccccc2)CC2CCOCC2)CCN1Cc1ccccc1 ZINC000573398852 948185108 /nfs/dbraw/zinc/18/51/08/948185108.db2.gz VJIDDSQLJQZDDG-SQJMNOBHSA-N 0 3 421.585 4.288 20 0 HIADHN CC[C@H](N[C@@H]1c2ccccc2CC12CCOCC2)c1ccccc1OCC(=O)N(C)C ZINC000573410959 948198102 /nfs/dbraw/zinc/19/81/02/948198102.db2.gz OTBUBKUANAOZGN-WIOPSUGQSA-N 0 3 422.569 4.289 20 0 HIADHN C[C@@H](N[C@H]1c2ccccc2CC12CCOCC2)C(=O)Nc1cccc2ncccc21 ZINC000573490943 948217438 /nfs/dbraw/zinc/21/74/38/948217438.db2.gz UXVUDZJHRYCVIS-HXOBKFHXSA-N 0 3 401.510 4.246 20 0 HIADHN COc1ccc([C@@H](Cc2ccncc2)NCc2cc(C)nc(N3CCCC3)c2)cc1 ZINC000573491810 948217592 /nfs/dbraw/zinc/21/75/92/948217592.db2.gz IGIRVNZOBYZGEE-XMMPIXPASA-N 0 3 402.542 4.467 20 0 HIADHN C[C@@H](C(=O)NC[C@@H]1CCO[C@H]1c1ccccc1)N1CCC(Cc2ccccc2)CC1 ZINC000573588941 948243733 /nfs/dbraw/zinc/24/37/33/948243733.db2.gz QQTLCJJYLLREKJ-OPXMRZJTSA-N 0 3 406.570 4.224 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)Nc3nc4c(s3)CCCC4(C)C)CC2)C[C@H](C)O1 ZINC000573647551 948265612 /nfs/dbraw/zinc/26/56/12/948265612.db2.gz HKATYQOILSZYCY-HOTGVXAUSA-N 0 3 420.623 4.110 20 0 HIADHN CN(CCC(=O)NC(c1ccccc1)c1ccccc1)C[C@H]1COc2ccccc2O1 ZINC000573706407 948277482 /nfs/dbraw/zinc/27/74/82/948277482.db2.gz UVUXHYHYQMTVRJ-QFIPXVFZSA-N 0 3 416.521 4.054 20 0 HIADHN O=C(Nc1ccc(-c2ncc3n2CCCC3)cc1)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000573712233 948280560 /nfs/dbraw/zinc/28/05/60/948280560.db2.gz WSGZUTGXOSYYRZ-NRFANRHFSA-N 0 3 415.541 4.132 20 0 HIADHN COc1ccc(-c2ocnc2C(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)cc1 ZINC000573758584 948290632 /nfs/dbraw/zinc/29/06/32/948290632.db2.gz FSWOPNLHGDJVJO-GOSISDBHSA-N 0 3 405.498 4.087 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)[C@H](C)Oc1ccc(Br)cc1)c1ccco1 ZINC000573875609 948316235 /nfs/dbraw/zinc/31/62/35/948316235.db2.gz VGKMCDHDCKPPKX-KEYYUXOJSA-N 0 3 409.324 4.055 20 0 HIADHN COc1ccc2cc(C(=O)Nc3cc(C)cc(N4CCN(C(C)C)CC4)c3)[nH]c2c1 ZINC000574103702 948365109 /nfs/dbraw/zinc/36/51/09/948365109.db2.gz XDIDIJMMJCXJQW-UHFFFAOYSA-N 0 3 406.530 4.268 20 0 HIADHN CC(C)Oc1ccc([C@H](CN[C@@H](c2cnn(C)c2)c2cccc(F)c2)N(C)C)cc1 ZINC000574184897 948381735 /nfs/dbraw/zinc/38/17/35/948381735.db2.gz LROGEOHZQRHYAL-BJKOFHAPSA-N 0 3 410.537 4.328 20 0 HIADHN CSc1ccc([C@H](CNC(=O)c2cc3sc(N(C)C)nc3s2)N(C)C)cc1 ZINC000574194511 948383681 /nfs/dbraw/zinc/38/36/81/948383681.db2.gz YBOWUINCDKWGLF-AWEZNQCLSA-N 0 3 420.629 4.178 20 0 HIADHN C[C@H](NC[C@H](c1ccc(Cl)cc1)N1CCOCC1)c1ccc(Br)cn1 ZINC000574456539 948447207 /nfs/dbraw/zinc/44/72/07/948447207.db2.gz ZBNUCNQZBJKJEN-IFXJQAMLSA-N 0 3 424.770 4.222 20 0 HIADHN C[C@H](NCc1cccc(I)c1)c1ccc(NC(=O)C2CC2)cc1 ZINC000574469209 948449750 /nfs/dbraw/zinc/44/97/50/948449750.db2.gz IABOHTHNMPSZRK-ZDUSSCGKSA-N 0 3 420.294 4.491 20 0 HIADHN Cc1cccc2cc(C(=O)Nc3ccccc3CN3CCC[C@@H](C(N)=O)C3)sc21 ZINC000574480408 948453260 /nfs/dbraw/zinc/45/32/60/948453260.db2.gz VXWBKKBEUAFQMH-GOSISDBHSA-N 0 3 407.539 4.159 20 0 HIADHN CN(C)Cc1cccc(C(=O)Nc2nc(-c3ccc4c(c3)CCC(=O)N4)cs2)c1 ZINC000574562474 948476909 /nfs/dbraw/zinc/47/69/09/948476909.db2.gz CFTSFTDGDUVZES-UHFFFAOYSA-N 0 3 406.511 4.009 20 0 HIADHN O=C(NCc1cc(-c2ccccc2)on1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000574817281 948535164 /nfs/dbraw/zinc/53/51/64/948535164.db2.gz GCYLZKFQFAAMKV-UHFFFAOYSA-N 0 3 422.554 4.255 20 0 HIADHN Clc1cccc(N2CC[C@H](NCc3cn4ccc(Br)cc4n3)C2)c1 ZINC000574847442 948543740 /nfs/dbraw/zinc/54/37/40/948543740.db2.gz QPNMIWNYLBERAK-HNNXBMFYSA-N 0 3 405.727 4.119 20 0 HIADHN CC(C)C(=O)c1ccc([C@H](C)C(=O)NC[C@@H]2CN(Cc3ccccc3)CCCO2)cc1 ZINC000574858931 948545527 /nfs/dbraw/zinc/54/55/27/948545527.db2.gz KSXFTZXPESLSLU-GBXCKJPGSA-N 0 3 422.569 4.036 20 0 HIADHN CCN(C(=O)[C@H](C)N[C@@H]1CCN(C2CC2)[C@@H]1c1cccc(OC)c1)c1ccccc1 ZINC000574859546 948545689 /nfs/dbraw/zinc/54/56/89/948545689.db2.gz JASBTOQJABQSHR-NTUVXCKYSA-N 0 3 407.558 4.004 20 0 HIADHN COC(=O)c1csc(-c2cccc(CNCc3ccc(OC)c(OC)c3C)c2)n1 ZINC000575190456 948623468 /nfs/dbraw/zinc/62/34/68/948623468.db2.gz XNKVTRGPWZUIDQ-UHFFFAOYSA-N 0 3 412.511 4.212 20 0 HIADHN CCc1ccccc1NC(=O)[C@H](C)N[C@@H]1CCN(CC)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000575198481 948625874 /nfs/dbraw/zinc/62/58/74/948625874.db2.gz LEKYNPODYAFVNR-OTPBECDQSA-N 0 3 419.491 4.418 20 0 HIADHN COCCO[C@H]1CCCN(Cc2cccc(NC(=O)c3ccccc3Cl)c2)C1 ZINC000575334220 948647981 /nfs/dbraw/zinc/64/79/81/948647981.db2.gz JCVALURZMKOTSR-IBGZPJMESA-N 0 3 402.922 4.220 20 0 HIADHN CSc1ccc([C@H](CNC(=O)c2ccc(-n3nc(C)cc3C)cc2)N(C)C)cc1 ZINC000575355130 948652744 /nfs/dbraw/zinc/65/27/44/948652744.db2.gz OWGSALKLXKGQNP-QFIPXVFZSA-N 0 3 408.571 4.244 20 0 HIADHN C[C@H](NC(=O)CN[C@H]1CCN(C)[C@H]1c1ccccc1)c1ccc(Cl)c(Cl)c1 ZINC000575370017 948659794 /nfs/dbraw/zinc/65/97/94/948659794.db2.gz KUURBOQLTBYGOT-JBYOLUDKSA-N 0 3 406.357 4.206 20 0 HIADHN C[C@H]1CN(C2CC2)C[C@H]1NC(=O)C(C)(C)c1csc(-c2c(F)cccc2Cl)n1 ZINC000575631480 948683139 /nfs/dbraw/zinc/68/31/39/948683139.db2.gz PIVFRMPRRDWXAI-BLLLJJGKSA-N 0 3 421.969 4.479 20 0 HIADHN Cc1ccc(-n2cc(CNCCNC(=O)c3ccco3)c(-c3ccc(F)cc3)n2)cc1 ZINC000575736480 948691692 /nfs/dbraw/zinc/69/16/92/948691692.db2.gz QVZFFBNDEQWSBO-UHFFFAOYSA-N 0 3 418.472 4.099 20 0 HIADHN FC(F)(c1cnc(Cl)nc1Cl)N1CCC[C@H]2CN(Cc3ccccc3)C[C@H]21 ZINC001164626445 719055276 /nfs/dbraw/zinc/05/52/76/719055276.db2.gz RFBZCFCRSAVZTF-GOEBONIOSA-N 0 3 413.299 4.429 20 0 HIADHN Clc1ccc2c(c1)nc(Cl)nc2N1CC[C@@H]2[C@H]1CCN2Cc1cccnc1 ZINC001164726889 720382408 /nfs/dbraw/zinc/38/24/08/720382408.db2.gz PVCBEQYCDNNEHX-QZTJIDSGSA-N 0 3 400.313 4.185 20 0 HIADHN Clc1cccc2nc(Cl)nc(N3CC[C@H]4[C@@H]3CCN4Cc3cccnc3)c12 ZINC001164722127 720383617 /nfs/dbraw/zinc/38/36/17/720383617.db2.gz CCGQCVJPESUEEE-IRXDYDNUSA-N 0 3 400.313 4.185 20 0 HIADHN Clc1cc2ncnc(N3CC[C@H]4[C@@H]3CCN4Cc3cccnc3)c2cc1Cl ZINC001164732420 720415200 /nfs/dbraw/zinc/41/52/00/720415200.db2.gz NGTBPGYIJZLBMK-OALUTQOASA-N 0 3 400.313 4.185 20 0 HIADHN c1ccc(Cc2nnc(N3CC[C@H]4[C@@H]3CCN4Cc3cccnc3)c3ccccc23)cc1 ZINC001164727711 720431432 /nfs/dbraw/zinc/43/14/32/720431432.db2.gz DXBLZNFNSQVMNL-UIOOFZCWSA-N 0 3 421.548 4.469 20 0 HIADHN Cc1csc2ncnc(N3CCC(F)(F)[C@]4(CCN(Cc5ccccn5)C4)C3)c12 ZINC001164905755 721583203 /nfs/dbraw/zinc/58/32/03/721583203.db2.gz WAECUYFBGBZGRW-FQEVSTJZSA-N 0 3 415.513 4.132 20 0 HIADHN FC1(F)CCN(c2nc(Cl)nc3ccoc32)C[C@]12CCN(Cc1ccccn1)C2 ZINC001164905509 721586713 /nfs/dbraw/zinc/58/67/13/721586713.db2.gz JPHSFOBLAGHINH-LJQANCHMSA-N 0 3 419.863 4.009 20 0 HIADHN FC1(F)CCN(c2ccnc(-c3ccccc3)n2)C[C@]12CCN(Cc1ccccn1)C2 ZINC001164907025 721587436 /nfs/dbraw/zinc/58/74/36/721587436.db2.gz QIYJUOUVMUSZAP-HSZRJFAPSA-N 0 3 421.495 4.276 20 0 HIADHN O=C(Nc1ccc(Cl)nc1)c1ccc(F)c(N2CCN(C3CCCC3)CC2)c1 ZINC001165027973 721856223 /nfs/dbraw/zinc/85/62/23/721856223.db2.gz FKYKGJAJWIELPU-UHFFFAOYSA-N 0 3 402.901 4.191 20 0 HIADHN Clc1ccc2c(ccnc2N2CC[C@@H]3CN(Cc4cccnc4)CCO[C@@H]3C2)c1 ZINC001164976551 722109862 /nfs/dbraw/zinc/10/98/62/722109862.db2.gz LSSDDMJKTCWOTE-DENIHFKCSA-N 0 3 408.933 4.011 20 0 HIADHN Cc1cc(N2CC[C@@H]3CN(Cc4cccnc4)CCO[C@@H]3C2)nc2cc(Cl)ccc12 ZINC001164979004 722129066 /nfs/dbraw/zinc/12/90/66/722129066.db2.gz ORSBCEHIFOCWLE-AUSIDOKSSA-N 0 3 422.960 4.319 20 0 HIADHN Cc1c(Cl)ccc2ccc(N3CC[C@@H]4CN(Cc5cccnc5)CCO[C@H]4C3)nc21 ZINC001164984224 722135282 /nfs/dbraw/zinc/13/52/82/722135282.db2.gz WOPVHVZZFVZCDQ-IRLDBZIGSA-N 0 3 422.960 4.319 20 0 HIADHN CC(C)c1cc(N2CC[C@H]3CN(Cc4cccnc4)CCO[C@H]3C2)nc(C(C)(C)C)n1 ZINC001164973366 722148154 /nfs/dbraw/zinc/14/81/54/722148154.db2.gz BTZRMCANCIWKJY-UNMCSNQZSA-N 0 3 423.605 4.020 20 0 HIADHN CN(C)CCN(C(=O)Nc1ccc(C(=O)N2CCCCCC2)cc1)C1CCCC1 ZINC000436009252 861299309 /nfs/dbraw/zinc/29/93/09/861299309.db2.gz XDODXOIHOLLWQK-UHFFFAOYSA-N 0 3 400.567 4.041 20 0 HIADHN CS[C@H]1CN(C(=O)c2c(C)onc2-c2ccc(Cl)c(Cl)c2)C[C@@H]1N(C)C ZINC000436152627 861451239 /nfs/dbraw/zinc/45/12/39/861451239.db2.gz WYUSGWVHRLPUAI-GJZGRUSLSA-N 0 3 414.358 4.074 20 0 HIADHN COc1cc(NC(=O)CN[C@H](c2ccc(Cl)cc2)C(C)C)cc(OC)c1OC ZINC000010137437 845623628 /nfs/dbraw/zinc/62/36/28/845623628.db2.gz MBELJANLBZMMHG-FQEVSTJZSA-N 0 3 406.910 4.291 20 0 HIADHN CN(C)Cc1ccccc1CNC(=O)c1ccc2c(c1)C[C@H](c1ccccc1)OC2=O ZINC000010299594 845643275 /nfs/dbraw/zinc/64/32/75/845643275.db2.gz WUVLTOKJKGOZMU-XMMPIXPASA-N 0 3 414.505 4.132 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Cc3nc(C(C)C)c(C)s3)c(C)c2)CC1 ZINC000436281135 861590355 /nfs/dbraw/zinc/59/03/55/861590355.db2.gz OXXCYRVMZLTGLA-UHFFFAOYSA-N 0 3 400.592 4.206 20 0 HIADHN CCN(CC)[C@H](CNC(=O)CCc1nc2ccccc2s1)c1cccc(OC)c1 ZINC000010917459 845727188 /nfs/dbraw/zinc/72/71/88/845727188.db2.gz JVERXQSCDXOZND-HXUWFJFHSA-N 0 3 411.571 4.437 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3c(C)nn(-c4ccccc4)c3Cl)cc2)CC1 ZINC000011944429 845843066 /nfs/dbraw/zinc/84/30/66/845843066.db2.gz LNJIZABHSWAEMI-UHFFFAOYSA-N 0 3 423.948 4.228 20 0 HIADHN O=C(CN1CCCCCCC1)N(Cc1nnc(-c2ccccc2Cl)o1)C1CC1 ZINC000015261592 846025246 /nfs/dbraw/zinc/02/52/46/846025246.db2.gz SBAABWGLICCYRX-UHFFFAOYSA-N 0 3 402.926 4.147 20 0 HIADHN O=S(=O)([N-]Cc1ccc(C[NH+]2CCCCC2)cc1)c1c(Cl)cccc1Cl ZINC000015357163 846040252 /nfs/dbraw/zinc/04/02/52/846040252.db2.gz WZBGBEAIOPWQNT-UHFFFAOYSA-N 0 3 413.370 4.458 20 0 HIADHN Cc1nn(Cc2ccc(C)cc2)c(Cl)c1C(=O)NC[C@H](c1ccccc1)N(C)C ZINC000016599167 846189805 /nfs/dbraw/zinc/18/98/05/846189805.db2.gz AWHNBBZFBUGECJ-HXUWFJFHSA-N 0 3 410.949 4.234 20 0 HIADHN Cc1nn(-c2ccccc2)c(Oc2ccc(Br)cc2)c1CNCCCO ZINC000017309978 846243432 /nfs/dbraw/zinc/24/34/32/846243432.db2.gz BVWXRXBUHJDPMH-UHFFFAOYSA-N 0 3 416.319 4.208 20 0 HIADHN COc1ccc(CNCc2cn(-c3ccccc3)nc2-c2cccnc2)cc1OC ZINC000017310717 846244646 /nfs/dbraw/zinc/24/46/46/846244646.db2.gz JNELKTOISHAFLF-UHFFFAOYSA-N 0 3 400.482 4.241 20 0 HIADHN COc1cccc([C@H](CNC(=O)CCc2nc3ccccc3s2)N2CCCC2)c1 ZINC000017909206 846275891 /nfs/dbraw/zinc/27/58/91/846275891.db2.gz WTHRNQNOSDNIHQ-FQEVSTJZSA-N 0 3 409.555 4.191 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Cc3ccc(Br)cc3)c(C)c2)CC1 ZINC000022067919 846527958 /nfs/dbraw/zinc/52/79/58/846527958.db2.gz JPXHWBSRLGMWAY-UHFFFAOYSA-N 0 3 416.363 4.081 20 0 HIADHN O=C(CCN1CCN(c2ccc(O)cc2)CC1)Nc1ccccc1-c1ccccc1 ZINC000022197790 846544589 /nfs/dbraw/zinc/54/45/89/846544589.db2.gz YSMSLRLTKVQPNL-UHFFFAOYSA-N 0 3 401.510 4.210 20 0 HIADHN COc1ccc(CNCc2ccc(OCc3c(C)noc3C)c(OC)c2)cc1OC ZINC000022772364 846618216 /nfs/dbraw/zinc/61/82/16/846618216.db2.gz RQXMDVYKSCYQAP-UHFFFAOYSA-N 0 3 412.486 4.186 20 0 HIADHN Cc1ccc(CN2CCCN(CC(=O)Nc3ccc(Cl)cc3Cl)CC2)cc1 ZINC000022831123 846626018 /nfs/dbraw/zinc/62/60/18/846626018.db2.gz QNTDRHTYZYMEBY-UHFFFAOYSA-N 0 3 406.357 4.448 20 0 HIADHN Cc1sc2ncnc(N3CCC(C(=O)Nc4ccccc4CN(C)C)CC3)c2c1C ZINC000024810592 846871421 /nfs/dbraw/zinc/87/14/21/846871421.db2.gz KJGTWQLCVGCGDF-UHFFFAOYSA-N 0 3 423.586 4.225 20 0 HIADHN Cc1oc(-c2cccs2)nc1CC(=O)NC[C@@H](C(C)C)N1CCc2ccccc2C1 ZINC000025540437 846995806 /nfs/dbraw/zinc/99/58/06/846995806.db2.gz XCZABGCYWGUMCW-NRFANRHFSA-N 0 3 423.582 4.453 20 0 HIADHN COc1cc(C(C)=O)ccc1OC[C@H](O)CN[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000025664073 847016885 /nfs/dbraw/zinc/01/68/85/847016885.db2.gz YKZZHUBQNXTVNV-SCLBCKFNSA-N 0 3 411.420 4.007 20 0 HIADHN COCCn1c(SCC(=O)C(C#N)c2nc(C)cs2)nc2cc(Cl)ccc21 ZINC000026100483 847083574 /nfs/dbraw/zinc/08/35/74/847083574.db2.gz ILOAYTSXHSHGGC-ZDUSSCGKSA-N 0 3 420.947 4.070 20 0 HIADHN COc1ccc(Cl)cc1CN(C)C(=O)NCC(C)(C)N1CCc2ccccc2C1 ZINC000026163729 847097539 /nfs/dbraw/zinc/09/75/39/847097539.db2.gz BKZZAPDTPKMXOY-UHFFFAOYSA-N 0 3 415.965 4.327 20 0 HIADHN O=c1cc(CN2CCC[C@@H]2COc2ccc(Cl)cc2)nc2ccc(Cl)cn12 ZINC000026723980 847191234 /nfs/dbraw/zinc/19/12/34/847191234.db2.gz UBHPRMSBXDUGDR-QGZVFWFLSA-N 0 3 404.297 4.045 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Cc3coc4cc(OC)ccc34)c(C)c2)CC1 ZINC000026909269 847220781 /nfs/dbraw/zinc/22/07/81/847220781.db2.gz HGTVTDWHZXLQNM-UHFFFAOYSA-N 0 3 407.514 4.073 20 0 HIADHN C/C=C/c1ccc(OCC(=O)N2CCCN(Cc3ccccc3C)CC2)c(OC)c1 ZINC000027387154 847293933 /nfs/dbraw/zinc/29/39/33/847293933.db2.gz FDSFUESTOLOFFV-XBXARRHUSA-N 0 3 408.542 4.150 20 0 HIADHN Cc1ccccc1CN1CCCN(C(=O)CCc2ncc(-c3ccccc3F)o2)CC1 ZINC000027389421 847295078 /nfs/dbraw/zinc/29/50/78/847295078.db2.gz PUNLFINVCTZZED-UHFFFAOYSA-N 0 3 421.516 4.456 20 0 HIADHN COc1ccc(-c2nc(C)c(C(=O)NCC(C)(C)N3CCCCC3)s2)cc1OC ZINC000027413022 847299535 /nfs/dbraw/zinc/29/95/35/847299535.db2.gz JOWRCATYYRUROJ-UHFFFAOYSA-N 0 3 417.575 4.130 20 0 HIADHN CCCOc1c(Cl)cc(C(=O)NC[C@H](Cc2ccccc2)N(C)C)cc1OC ZINC000027581348 847323149 /nfs/dbraw/zinc/32/31/49/847323149.db2.gz HTLNBRHCPCRBFY-SFHVURJKSA-N 0 3 404.938 4.040 20 0 HIADHN COc1cc(CN[C@H](C)c2cccc(C(F)(F)F)c2)cc(Cl)c1OCC(N)=O ZINC000028305782 847405028 /nfs/dbraw/zinc/40/50/28/847405028.db2.gz RZRNZYLRVZSTMV-LLVKDONJSA-N 0 3 416.827 4.082 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)CCC(=O)c3ccc4c(c3)CCC4)c(C)c2)CC1 ZINC000029376680 847555715 /nfs/dbraw/zinc/55/57/15/847555715.db2.gz FRBUGAAYHFXQND-UHFFFAOYSA-N 0 3 419.569 4.227 20 0 HIADHN CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H](c2ccccc2)c2ccc(C)cc2)cc1 ZINC000029701003 847603389 /nfs/dbraw/zinc/60/33/89/847603389.db2.gz XHHGIPHQYBTOHL-UKILVPOCSA-N 0 3 404.510 4.072 20 0 HIADHN COc1ccc([C@@H](CNC(=O)CN(C)[C@@H](C)c2cccs2)N2CCCCC2)cc1 ZINC000029703361 847603662 /nfs/dbraw/zinc/60/36/62/847603662.db2.gz BUJDNBVQYXFRBT-GHTZIAJQSA-N 0 3 415.603 4.093 20 0 HIADHN CC(=O)Nc1ccc(OC[C@H](O)CN(Cc2ccc(C(F)(F)F)cc2)C2CC2)cc1 ZINC000029719507 847608040 /nfs/dbraw/zinc/60/80/40/847608040.db2.gz INEBRWLYWZNIQX-HXUWFJFHSA-N 0 3 422.447 4.068 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCc1nc2ccccc2s1)c1cccc(OC)c1 ZINC000029722931 847608659 /nfs/dbraw/zinc/60/86/59/847608659.db2.gz YLUNMHVCDUDPPE-IBGZPJMESA-N 0 3 412.559 4.187 20 0 HIADHN CNC(=O)c1ccc(CN(C)C[C@H](O)COc2cc(C)c(Cl)cc2C(C)C)cc1 ZINC000030533964 847730660 /nfs/dbraw/zinc/73/06/60/847730660.db2.gz JPSPFSTZBKHFJF-IBGZPJMESA-N 0 3 418.965 4.003 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2CNCc2ccccc2Cn2cncn2)o1 ZINC000030900849 847794504 /nfs/dbraw/zinc/79/45/04/847794504.db2.gz ZENHPNJIKLUPHA-UHFFFAOYSA-N 0 3 424.508 4.370 20 0 HIADHN C[C@H](NC(=O)NC[C@H](c1cccs1)N1CCC(C)CC1)c1ccc2c(c1)OCO2 ZINC000031101870 847823364 /nfs/dbraw/zinc/82/33/64/847823364.db2.gz DCADKESHFNJXSJ-FUHWJXTLSA-N 0 3 415.559 4.310 20 0 HIADHN CCc1ccc([C@H](CNC(=O)c2cc3c(cccc3OC(F)F)[nH]2)N(C)C)cc1 ZINC000031209872 847844787 /nfs/dbraw/zinc/84/47/87/847844787.db2.gz OZLSHQIKYIAFJM-IBGZPJMESA-N 0 3 401.457 4.364 20 0 HIADHN CC1CCN([C@@H](CNC(=O)CCCc2nc(C(C)(C)C)no2)c2cccs2)CC1 ZINC000031209205 847844804 /nfs/dbraw/zinc/84/48/04/847844804.db2.gz OYYYIVQZLJPZAS-KRWDZBQOSA-N 0 3 418.607 4.341 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3csc(-c4ccc(C)o4)n3)c(C)c2)CC1 ZINC000031227401 847846779 /nfs/dbraw/zinc/84/67/79/847846779.db2.gz KEZNWFTZLXDOQT-UHFFFAOYSA-N 0 3 410.543 4.414 20 0 HIADHN O=C(Cc1csc(Cc2ccccc2)n1)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000031541023 847904058 /nfs/dbraw/zinc/90/40/58/847904058.db2.gz ADTNZLDYEDNZBH-NRFANRHFSA-N 0 3 405.567 4.057 20 0 HIADHN CCc1nc2ccc(C(=O)N3CCCN(Cc4ccccc4C)CC3)cc2nc1CC ZINC000031766713 847945909 /nfs/dbraw/zinc/94/59/09/847945909.db2.gz PVIOPFMPPFAWNG-UHFFFAOYSA-N 0 3 416.569 4.411 20 0 HIADHN Cc1[nH]c2ccc(C(=O)NCCCCN3CCN(c4cccc(C)c4)CC3)cc2c1C ZINC000032068252 847984888 /nfs/dbraw/zinc/98/48/88/847984888.db2.gz FBEPFSKULFEMBG-UHFFFAOYSA-N 0 3 418.585 4.425 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)c3cc4cc(Cl)ccc4[nH]3)CC2)c1 ZINC000032066253 847984911 /nfs/dbraw/zinc/98/49/11/847984911.db2.gz BUEZFQMPSVVMLG-UHFFFAOYSA-N 0 3 424.976 4.462 20 0 HIADHN Cc1ccc2[nH]c(C(=O)NCCCCN3CCN(c4cccc(C)c4)CC3)cc2c1 ZINC000032066255 847985185 /nfs/dbraw/zinc/98/51/85/847985185.db2.gz DKLVFTKHOMHZJP-UHFFFAOYSA-N 0 3 404.558 4.117 20 0 HIADHN CCc1ccc([C@H](CNC(=O)c2ccc(C)c(NC(=O)c3ccco3)c2)N(C)C)cc1 ZINC000032246197 847994058 /nfs/dbraw/zinc/99/40/58/847994058.db2.gz VOCZUZVEYIVUOR-QFIPXVFZSA-N 0 3 419.525 4.435 20 0 HIADHN CC(C)c1ccc(C(=O)NC[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)c([O-])c1 ZINC000436565461 861854038 /nfs/dbraw/zinc/85/40/38/861854038.db2.gz MSWMPWJFPJUSNR-QFIPXVFZSA-N 0 3 422.569 4.174 20 0 HIADHN CC(C)c1ccc(C(=O)NC[C@H]2C[N@@H+](Cc3ccccc3)CC23CCOCC3)c([O-])c1 ZINC000436565461 861854041 /nfs/dbraw/zinc/85/40/41/861854041.db2.gz MSWMPWJFPJUSNR-QFIPXVFZSA-N 0 3 422.569 4.174 20 0 HIADHN CCc1ccc([C@H](CNC(=O)CCCc2nc(-c3ccc(F)cc3)no2)N(C)C)cc1 ZINC000032484022 848037607 /nfs/dbraw/zinc/03/76/07/848037607.db2.gz LPAQPYPTJYKJRV-NRFANRHFSA-N 0 3 424.520 4.180 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)CCCc2nc(-c3ccc(F)cc3)no2)N(C)C)cc1 ZINC000032484020 848037987 /nfs/dbraw/zinc/03/79/87/848037987.db2.gz LPAQPYPTJYKJRV-OAQYLSRUSA-N 0 3 424.520 4.180 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)c2cccnc2SCc2cc(C)on2)N(C)C)cc1 ZINC000032733965 848069004 /nfs/dbraw/zinc/06/90/04/848069004.db2.gz RCWJNCXYDDBNBD-OAQYLSRUSA-N 0 3 424.570 4.265 20 0 HIADHN Cc1cc(C(=O)NCCCCN2CCN(c3cccc(C)c3)CC2)c(C)n1C(C)C ZINC000041479219 848218853 /nfs/dbraw/zinc/21/88/53/848218853.db2.gz YSOYEDJNLRIEPM-UHFFFAOYSA-N 0 3 410.606 4.326 20 0 HIADHN CCn1c2ccccc2n(CC(=O)C(C#N)c2nc(-c3ccc(C)cc3)cs2)c1=O ZINC000041512588 848224026 /nfs/dbraw/zinc/22/40/26/848224026.db2.gz OPPUJKSXDDIENT-KRWDZBQOSA-N 0 3 416.506 4.131 20 0 HIADHN C[C@H](NC(=O)c1ccccc1)C(=O)C(C#N)c1nc(-c2ccc(Cl)cc2)cs1 ZINC000041515047 848224748 /nfs/dbraw/zinc/22/47/48/848224748.db2.gz JEPPWZYELFRTHW-GUYCJALGSA-N 0 3 409.898 4.458 20 0 HIADHN CCOC(=O)N[C@H](C(=O)C(C#N)c1nc(-c2ccc(Cl)cc2)cs1)C(C)C ZINC000041514015 848225086 /nfs/dbraw/zinc/22/50/86/848225086.db2.gz VRURLLFUSCAQOA-HOCLYGCPSA-N 0 3 405.907 4.410 20 0 HIADHN CCOC(=O)N[C@@H](C(=O)C(C#N)c1nc2cc(C(F)(F)F)ccc2s1)C(C)C ZINC000041548366 848229992 /nfs/dbraw/zinc/22/99/92/848229992.db2.gz MITNYMVFOZUFOO-SMDDNHRTSA-N 0 3 413.421 4.262 20 0 HIADHN N#CC(C(=O)CC[C@@H]1Cc2ccccc2NC1=O)c1nc2ccccc2n1C(F)F ZINC000041557288 848231637 /nfs/dbraw/zinc/23/16/37/848231637.db2.gz TYBCBFCHPMJPAA-HUUCEWRRSA-N 0 3 408.408 4.199 20 0 HIADHN CC[N@H+](CC(=O)Nc1ccc(NC(=O)c2cc(Cl)ccc2[O-])c(Cl)c1)C1CC1 ZINC000436658738 861884563 /nfs/dbraw/zinc/88/45/63/861884563.db2.gz MRROFPFMLXAVLG-UHFFFAOYSA-N 0 3 422.312 4.374 20 0 HIADHN CC[N@@H+](CC(=O)Nc1ccc(NC(=O)c2cc(Cl)ccc2[O-])c(Cl)c1)C1CC1 ZINC000436658738 861884565 /nfs/dbraw/zinc/88/45/65/861884565.db2.gz MRROFPFMLXAVLG-UHFFFAOYSA-N 0 3 422.312 4.374 20 0 HIADHN CCOc1cc(NC(=O)NC[C@@H](c2ccc(OC)cc2)N2CCCC2)ccc1OC ZINC000043111309 848385245 /nfs/dbraw/zinc/38/52/45/848385245.db2.gz CROUPLJARRRAOE-FQEVSTJZSA-N 0 3 413.518 4.061 20 0 HIADHN CN(Cc1ccc(Br)o1)C(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000043231255 848397843 /nfs/dbraw/zinc/39/78/43/848397843.db2.gz WEKAGZRXLZBUBW-CQSZACIVSA-N 0 3 412.353 4.082 20 0 HIADHN COc1ccc(NC(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)cc1OC ZINC000043268132 848400718 /nfs/dbraw/zinc/40/07/18/848400718.db2.gz RPCRJXPLMNWMQI-KRWDZBQOSA-N 0 3 403.548 4.360 20 0 HIADHN CN(C)C[C@H]1CCc2ccccc2N1C(=O)c1cncc(-c2ccc(N(C)C)cc2)c1 ZINC000436719365 861905752 /nfs/dbraw/zinc/90/57/52/861905752.db2.gz HGSPJLNTMTWEIS-XMMPIXPASA-N 0 3 414.553 4.338 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)COc3ccccc3C(C)(C)C)c(C)c2)CC1 ZINC000045530379 848689668 /nfs/dbraw/zinc/68/96/68/848689668.db2.gz CLNQWRGCROGZOH-UHFFFAOYSA-N 0 3 409.574 4.452 20 0 HIADHN CCNC(=O)COc1ccc(CN[C@H](C)c2ccc(C(F)(F)F)cc2)cc1OC ZINC000045822595 848735468 /nfs/dbraw/zinc/73/54/68/848735468.db2.gz BSKRUJKXBRCKIQ-CQSZACIVSA-N 0 3 410.436 4.080 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1ccc(N2CCC(C)=N2)cc1)c1cccc(OC)c1 ZINC000045878077 848745244 /nfs/dbraw/zinc/74/52/44/848745244.db2.gz JXUGJFVFNMKQCL-HSZRJFAPSA-N 0 3 408.546 4.094 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@@H](C)c1ccc2c(c1)CCC(=O)N2)c1ccsc1 ZINC000046253830 848811807 /nfs/dbraw/zinc/81/18/07/848811807.db2.gz HWRPPERRXCODTL-MGPUTAFESA-N 0 3 414.575 4.076 20 0 HIADHN COc1ccc(C(=O)C2CCN(CCC(=O)Nc3ccc(Cl)cc3F)CC2)cc1 ZINC000046504060 848862249 /nfs/dbraw/zinc/86/22/49/848862249.db2.gz WHDVVSKDUBNCNL-UHFFFAOYSA-N 0 3 418.896 4.411 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)CCOc3ccc(Cl)cc3)c(C)c2)CC1 ZINC000046567881 848875661 /nfs/dbraw/zinc/87/56/61/848875661.db2.gz KUONGRXYVPWKKO-UHFFFAOYSA-N 0 3 401.938 4.198 20 0 HIADHN C[C@@H](NC(=O)N1CCCN(Cc2ccccc2)CC1)c1cccc(OC(F)F)c1 ZINC000046610382 848885290 /nfs/dbraw/zinc/88/52/90/848885290.db2.gz INBZLVFUIPHZKK-QGZVFWFLSA-N 0 3 403.473 4.267 20 0 HIADHN C[C@@H](Cc1cccc(C(F)(F)F)c1)[NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1 ZINC000436767310 861959448 /nfs/dbraw/zinc/95/94/48/861959448.db2.gz GLQDUOJUDUHVDS-HNNXBMFYSA-N 0 3 406.448 4.236 20 0 HIADHN O=C(Nc1ccccc1)c1ccc(CN2CCC[C@@H](C(=O)Nc3ccccn3)C2)cc1 ZINC000047259999 849016332 /nfs/dbraw/zinc/01/63/32/849016332.db2.gz IAVVRQMIMISDIC-OAQYLSRUSA-N 0 3 414.509 4.185 20 0 HIADHN N#CC(C(=O)C1CCN(C(=O)c2ccc(F)cc2F)CC1)c1ccc2ccccc2n1 ZINC000047375530 849034246 /nfs/dbraw/zinc/03/42/46/849034246.db2.gz BTGJTUVYPKJAHN-LJQANCHMSA-N 0 3 419.431 4.242 20 0 HIADHN O=C(NCCCCN1CCN(c2cccc(C(F)(F)F)c2)CC1)C1CCCCC1 ZINC000047460941 849052039 /nfs/dbraw/zinc/05/20/39/849052039.db2.gz QUJLYTCXXVLPSF-UHFFFAOYSA-N 0 3 411.512 4.304 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1cccc(NC(=O)OC)c1)c1cccc(OC)c1 ZINC000047711826 849095987 /nfs/dbraw/zinc/09/59/87/849095987.db2.gz KJCIHXAXVWKOCS-FQEVSTJZSA-N 0 3 414.506 4.078 20 0 HIADHN COc1cc(CNCc2ccc(-n3ccnc3)cc2)ccc1OCc1ccncc1 ZINC000047752004 849104015 /nfs/dbraw/zinc/10/40/15/849104015.db2.gz OJFUPOJXKSZUDQ-UHFFFAOYSA-N 0 3 400.482 4.145 20 0 HIADHN CCOC(=O)Nc1ccc(NC(=O)NC[C@@H](c2cccs2)N2CCCC2)cc1 ZINC000047946168 849141971 /nfs/dbraw/zinc/14/19/71/849141971.db2.gz GWDQXYPRDBSXPV-KRWDZBQOSA-N 0 3 402.520 4.275 20 0 HIADHN CCCOc1ccc(CNC(=O)NC[C@H](c2cccs2)N2CCCC2)cc1OC ZINC000047950895 849144146 /nfs/dbraw/zinc/14/41/46/849144146.db2.gz VHKGBNFOIRTPOL-GOSISDBHSA-N 0 3 417.575 4.182 20 0 HIADHN Cc1ccc(NC(=O)C(C)C)cc1NC(=O)NCC1(N2CCSCC2)CCCC1 ZINC000048256021 849198644 /nfs/dbraw/zinc/19/86/44/849198644.db2.gz POODPGIBGILLJI-UHFFFAOYSA-N 0 3 418.607 4.073 20 0 HIADHN CCC(=O)Nc1ccc(C)c(NC(=O)NC[C@H](CC)N2CCc3ccccc3C2)c1 ZINC000048257043 849199499 /nfs/dbraw/zinc/19/94/99/849199499.db2.gz ZUBGEEKMDUZRAC-NRFANRHFSA-N 0 3 408.546 4.302 20 0 HIADHN COc1ccc(C[C@@H](NCc2cnc(N3CCCC3)nc2)c2ccc(OC)cc2)cc1 ZINC000048683546 849255171 /nfs/dbraw/zinc/25/51/71/849255171.db2.gz HQZGWRXMQGISGN-XMMPIXPASA-N 0 3 418.541 4.168 20 0 HIADHN COc1ccc(C(=O)N2CCC([N@H+](C)Cc3cccc(C(F)(F)F)c3)CC2)c([O-])c1 ZINC000436806579 861996720 /nfs/dbraw/zinc/99/67/20/861996720.db2.gz GPDFYYPPRQXBMP-UHFFFAOYSA-N 0 3 422.447 4.156 20 0 HIADHN COc1ccc(C(=O)N2CCC([N@@H+](C)Cc3cccc(C(F)(F)F)c3)CC2)c([O-])c1 ZINC000436806579 861996735 /nfs/dbraw/zinc/99/67/35/861996735.db2.gz GPDFYYPPRQXBMP-UHFFFAOYSA-N 0 3 422.447 4.156 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)c(C)c1CNCc1ccccc1Cn1cncn1 ZINC000048711268 849257682 /nfs/dbraw/zinc/25/76/82/849257682.db2.gz HGFAAPRRBKECFT-UHFFFAOYSA-N 0 3 406.921 4.072 20 0 HIADHN Cc1nn(-c2ccc(F)cc2F)c(C)c1CNCc1cccc(Cn2ccnc2)c1 ZINC000048711352 849258250 /nfs/dbraw/zinc/25/82/50/849258250.db2.gz ZYAPMGMJIOBZEV-UHFFFAOYSA-N 0 3 407.468 4.302 20 0 HIADHN C[C@H]([NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1)c1cccc(Br)c1 ZINC000436830316 862009519 /nfs/dbraw/zinc/00/95/19/862009519.db2.gz QIBNVSHHFSCCLB-AWEZNQCLSA-N 0 3 403.320 4.110 20 0 HIADHN C[C@H]([NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1)c1cc(Br)ccc1F ZINC000436828400 862010273 /nfs/dbraw/zinc/01/02/73/862010273.db2.gz MFBLRCIYWXHLSI-ZDUSSCGKSA-N 0 3 421.310 4.249 20 0 HIADHN C[C@H]([NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1)[C@H](C)c1nc2ccccc2s1 ZINC000436833774 862014873 /nfs/dbraw/zinc/01/48/73/862014873.db2.gz ZADBQSAKOXBXFG-HOTGVXAUSA-N 0 3 409.555 4.388 20 0 HIADHN COc1cc(CN(C)C[C@@H](O)c2ccc(C(F)(F)F)cc2)ccc1OC(F)F ZINC000051119234 849433265 /nfs/dbraw/zinc/43/32/65/849433265.db2.gz WBQTYLQUHQVDBG-OAHLLOKOSA-N 0 3 405.363 4.481 20 0 HIADHN Cc1ccc(O[C@H](C)C(=O)N(CC(C)C)C2CCN(C)CC2)c(Br)c1 ZINC000053232848 849682836 /nfs/dbraw/zinc/68/28/36/849682836.db2.gz UBLPSFPNOZVHFY-MRXNPFEDSA-N 0 3 411.384 4.104 20 0 HIADHN CCCc1sc(C(=O)Nc2cccc(CN3CCC(C(N)=O)CC3)c2)cc1CC ZINC000053996544 849790046 /nfs/dbraw/zinc/79/00/46/849790046.db2.gz LTRQYFLGQVANLX-UHFFFAOYSA-N 0 3 413.587 4.213 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)CCCc2nc(-c3cccs3)no2)C1 ZINC000054223096 849828958 /nfs/dbraw/zinc/82/89/58/849828958.db2.gz PHKHSAPYETXXBG-AEFFLSMTSA-N 0 3 410.543 4.073 20 0 HIADHN CC(C)OCCCNC(=O)C1CCN(Cc2cc(Cl)cc3cccnc32)CC1 ZINC000054316963 849846618 /nfs/dbraw/zinc/84/66/18/849846618.db2.gz RQNUQZCJTFYKOQ-UHFFFAOYSA-N 0 3 403.954 4.032 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=S)Nc1ccc(OC(F)(F)F)cc1 ZINC000054974381 849949506 /nfs/dbraw/zinc/94/95/06/849949506.db2.gz CCKXIGKQOHWNNN-UHFFFAOYSA-N 0 3 415.456 4.485 20 0 HIADHN Cc1cccc(C)c1NC(=O)CNC1(c2cccc(Br)c2)CCOCC1 ZINC000055055572 849965171 /nfs/dbraw/zinc/96/51/71/849965171.db2.gz OBIJGCBWGFWAIV-UHFFFAOYSA-N 0 3 417.347 4.300 20 0 HIADHN NC(=O)C1CCN(Cc2cccc(NC(=O)CCc3ccc4ccccc4c3)c2)CC1 ZINC000055417623 850017399 /nfs/dbraw/zinc/01/73/99/850017399.db2.gz NSSFYEUOYRBMEY-UHFFFAOYSA-N 0 3 415.537 4.108 20 0 HIADHN Cc1cccc([C@H]2CCCN2CC(=O)N2CCC(C(=O)Nc3ccccc3)CC2)c1 ZINC000055910275 850205735 /nfs/dbraw/zinc/20/57/35/850205735.db2.gz YJHUFOCMNAXANE-HSZRJFAPSA-N 0 3 405.542 4.009 20 0 HIADHN CC(C)(C)CCN1CCN(CC(=O)Nc2ccc(Cl)cc2C(F)(F)F)CC1 ZINC000055936460 850210845 /nfs/dbraw/zinc/21/08/45/850210845.db2.gz SDNCCKFOUYZOMG-UHFFFAOYSA-N 0 3 405.892 4.351 20 0 HIADHN COc1ccccc1NC(=O)N(CCN(C)C)Cc1ccc(Br)cc1 ZINC000056515953 850381954 /nfs/dbraw/zinc/38/19/54/850381954.db2.gz NZFHZCHSTYZYKE-UHFFFAOYSA-N 0 3 406.324 4.053 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)c1ccccc1C(F)(F)F ZINC000057113472 850549437 /nfs/dbraw/zinc/54/94/37/850549437.db2.gz QLBDIDVIVKDABA-UHFFFAOYSA-N 0 3 405.464 4.038 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)[C@@H]1CCC[C@H](C(F)(F)F)C1 ZINC000057114003 850550812 /nfs/dbraw/zinc/55/08/12/850550812.db2.gz JAKGHBWGDJYQME-MOPGFXCFSA-N 0 3 411.512 4.074 20 0 HIADHN Cc1oc(NC(=O)CN[C@H](c2ccc(C(C)(C)C)cc2)C(C)C)c2c1c(C)n[nH]c2=O ZINC000057627015 850684534 /nfs/dbraw/zinc/68/45/34/850684534.db2.gz SFJCQDUXIWDZEJ-NRFANRHFSA-N 0 3 424.545 4.356 20 0 HIADHN CC(=O)N1CCC(NC(=O)CN[C@@H](c2ccc(C3CCCCC3)cc2)C(C)C)CC1 ZINC000057644938 850688120 /nfs/dbraw/zinc/68/81/20/850688120.db2.gz DDZNATAAPBZDRO-RUZDIDTESA-N 0 3 413.606 4.148 20 0 HIADHN CCN1CCC[C@@H](NC(=O)N2CCC(c3nc4cc(Cl)ccc4s3)CC2)C1 ZINC000057869756 850736905 /nfs/dbraw/zinc/73/69/05/850736905.db2.gz HCNCISLOHXIWDB-MRXNPFEDSA-N 0 3 406.983 4.323 20 0 HIADHN CC(=O)c1cccc(OCCCC(=O)N2c3ccc(C)cc3[C@H]3CN(C)CC[C@@H]32)c1 ZINC000058651233 850879784 /nfs/dbraw/zinc/87/97/84/850879784.db2.gz WKRHBTDLWGOSNU-VWNXMTODSA-N 0 3 406.526 4.191 20 0 HIADHN COc1ccccc1-c1nc(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)cs1 ZINC000058784146 850925849 /nfs/dbraw/zinc/92/58/49/850925849.db2.gz HYHHMLGFMXLGFE-FQEVSTJZSA-N 0 3 407.539 4.386 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)CCc1ccccc1Br ZINC000059001159 850977052 /nfs/dbraw/zinc/97/70/52/850977052.db2.gz JNGITXXXPZIOKK-UHFFFAOYSA-N 0 3 407.327 4.111 20 0 HIADHN CCOC(=O)/C=C/c1ccc(NC(=O)NC[C@H](c2ccccc2)N2CCCC2)cc1 ZINC000059039871 850982583 /nfs/dbraw/zinc/98/25/83/850982583.db2.gz QGWNHAACFPUFDC-OWSFEGEDSA-N 0 3 407.514 4.222 20 0 HIADHN CN1CCN(Cc2ccc(CNC(=S)Nc3ccc(Cl)c(Cl)c3)cc2)CC1 ZINC000060432843 851098340 /nfs/dbraw/zinc/09/83/40/851098340.db2.gz BGZQKWHMSZMURA-UHFFFAOYSA-N 0 3 423.413 4.227 20 0 HIADHN O=C(Nc1ccc(C(=O)N[C@@H]2CCN(C3CC3)C2)cc1)c1cc(Cl)cc(Cl)c1 ZINC000060470365 851111175 /nfs/dbraw/zinc/11/11/75/851111175.db2.gz XVVXDHGBVRIDAX-GOSISDBHSA-N 0 3 418.324 4.212 20 0 HIADHN CC1CCN([C@@H](CNC(=O)N2CCO[C@@H](c3ccccc3)C2)c2ccccc2)CC1 ZINC000060630605 851172809 /nfs/dbraw/zinc/17/28/09/851172809.db2.gz LJZAPHZXULTIRB-BJKOFHAPSA-N 0 3 407.558 4.243 20 0 HIADHN CC1CCN([C@H](CNC(=O)N(C)Cc2ccc3c(c2)OCCO3)c2ccccc2)CC1 ZINC000060630819 851172910 /nfs/dbraw/zinc/17/29/10/851172910.db2.gz NNUNNRVOQHYAAJ-JOCHJYFZSA-N 0 3 423.557 4.072 20 0 HIADHN CCNC(=O)COc1ccc(CN[C@H](c2ccc(Cl)cc2)C2CC2)cc1OC ZINC000060843035 851228759 /nfs/dbraw/zinc/22/87/59/851228759.db2.gz YCGRIINGSNGJEE-QFIPXVFZSA-N 0 3 402.922 4.104 20 0 HIADHN O=S(=O)(NCC1CCN(Cc2cccs2)CC1)c1ccc(Cl)c(Cl)c1 ZINC000060923545 851249962 /nfs/dbraw/zinc/24/99/62/851249962.db2.gz IOUZZIJVMDDLIO-UHFFFAOYSA-N 0 3 419.399 4.245 20 0 HIADHN Cc1nn(-c2ccccc2)c(Oc2ccc(Br)cc2)c1CNC[C@@H](C)O ZINC000061011938 851272155 /nfs/dbraw/zinc/27/21/55/851272155.db2.gz YEQYHNHFLSMRJM-CQSZACIVSA-N 0 3 416.319 4.206 20 0 HIADHN Cc1ccccc1CN1CCCN(C(=O)COC(=O)c2cc3ccccc3s2)CC1 ZINC000061032166 851278808 /nfs/dbraw/zinc/27/88/08/851278808.db2.gz QSKGQYLYLVOEMK-UHFFFAOYSA-N 0 3 422.550 4.101 20 0 HIADHN COc1cc(CNCc2csc3ccccc23)ccc1OCC(=O)N1CCCC1 ZINC000061048670 851282924 /nfs/dbraw/zinc/28/29/24/851282924.db2.gz ZYQKVTGDJJQYDM-UHFFFAOYSA-N 0 3 410.539 4.201 20 0 HIADHN CC[C@@H](CNC(=O)c1ccc(Cn2nc(C)cc2C)cc1)N1CCc2ccccc2C1 ZINC000061158105 851307163 /nfs/dbraw/zinc/30/71/63/851307163.db2.gz LIXPKTFTQDEIDZ-VWLOTQADSA-N 0 3 416.569 4.115 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3-n3cccn3)cc2)CC1 ZINC000061165100 851308968 /nfs/dbraw/zinc/30/89/68/851308968.db2.gz IQQHEYSOQLNDON-UHFFFAOYSA-N 0 3 423.948 4.308 20 0 HIADHN COCCCCN(Cc1ccccc1)C(=O)c1ccc(N2CCN(C(C)C)CC2)cc1 ZINC000061194918 851314786 /nfs/dbraw/zinc/31/47/86/851314786.db2.gz AKZFTURCXPJPDV-UHFFFAOYSA-N 0 3 423.601 4.286 20 0 HIADHN CCOc1ccc([C@@H](C)NC(=O)NC[C@@H](c2ccc(CC)cc2)N(C)C)cc1OC ZINC000061223422 851321295 /nfs/dbraw/zinc/32/12/95/851321295.db2.gz MGGSMGSFGHIUNA-UTKZUKDTSA-N 0 3 413.562 4.319 20 0 HIADHN CCN1CCN(c2ccc(NC(=S)NCCSc3ccccc3)c(C)c2)CC1 ZINC000061246869 851330267 /nfs/dbraw/zinc/33/02/67/851330267.db2.gz LYGNOUCAUNVEMK-UHFFFAOYSA-N 0 3 414.644 4.216 20 0 HIADHN CC(C)Oc1ncc(C(=O)Nc2ccc(CCN3CCSCC3)cc2)cc1Cl ZINC000061287438 851338347 /nfs/dbraw/zinc/33/83/47/851338347.db2.gz AIOCOALAEBFHBE-UHFFFAOYSA-N 0 3 419.978 4.366 20 0 HIADHN COC(=O)c1ccc(NC(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)cc1 ZINC000061303807 851342829 /nfs/dbraw/zinc/34/28/29/851342829.db2.gz NHBGIXYOJSDYEO-GOSISDBHSA-N 0 3 401.532 4.129 20 0 HIADHN COCCn1cc(C(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)c2ccccc21 ZINC000061502431 851390260 /nfs/dbraw/zinc/39/02/60/851390260.db2.gz DNMJAZXYDIPQLN-XMMPIXPASA-N 0 3 405.542 4.163 20 0 HIADHN CC[C@@H](C)NC(=O)c1ccc(NC(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)cc1 ZINC000061776220 851447435 /nfs/dbraw/zinc/44/74/35/851447435.db2.gz UVHVQAWAAUYXGO-XXBNENTESA-N 0 3 422.573 4.482 20 0 HIADHN O=C(Nc1ccccc1CN1CCSCC1)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000061789993 851452819 /nfs/dbraw/zinc/45/28/19/851452819.db2.gz NZNJEWKVXRENSJ-JOCHJYFZSA-N 0 3 424.614 4.022 20 0 HIADHN Cc1ccc2nc([C@H]3CCCN3C(=O)NC[C@H](C)N3CCc4ccccc4C3)[nH]c2c1 ZINC000061865297 851463029 /nfs/dbraw/zinc/46/30/29/851463029.db2.gz ZYSQHVJXLLXLAE-FDDCHVKYSA-N 0 3 417.557 4.165 20 0 HIADHN Cc1cccc(Oc2ccc(NC(=O)C(=O)NCC(C)(C)N3CCCCC3)cc2)c1 ZINC000061866068 851463380 /nfs/dbraw/zinc/46/33/80/851463380.db2.gz KUJBFFALOAUFSK-UHFFFAOYSA-N 0 3 409.530 4.107 20 0 HIADHN CC(C)Cc1ccc([C@@H](NC(=O)C(=O)Nc2cccc(CN(C)C)c2)C(C)C)cc1 ZINC000061963383 851481069 /nfs/dbraw/zinc/48/10/69/851481069.db2.gz JBQLTHDTKJVUGT-QHCPKHFHSA-N 0 3 409.574 4.399 20 0 HIADHN Cc1cc(C)n(-c2ccccc2NC(=O)N(CCN(C)C)Cc2cccc(F)c2)n1 ZINC000062387593 851538647 /nfs/dbraw/zinc/53/86/47/851538647.db2.gz GACSZPUNIPNLED-UHFFFAOYSA-N 0 3 409.509 4.224 20 0 HIADHN CC(C)N(C)c1ccc(NC(=O)N(CCN(C)C)Cc2cccc(F)c2)cc1F ZINC000062399255 851540628 /nfs/dbraw/zinc/54/06/28/851540628.db2.gz JYJVGDTVOXYSDZ-UHFFFAOYSA-N 0 3 404.505 4.405 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)Nc1cccc(OCC#N)c1 ZINC000062394434 851540876 /nfs/dbraw/zinc/54/08/76/851540876.db2.gz FPUHYFJXJKKERS-UHFFFAOYSA-N 0 3 420.435 4.203 20 0 HIADHN CCCC(=O)Nc1cccc(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2F)c1 ZINC000062400757 851541990 /nfs/dbraw/zinc/54/19/90/851541990.db2.gz GGIFMBQCNOARDG-UHFFFAOYSA-N 0 3 418.488 4.299 20 0 HIADHN CC(=O)Nc1c(C)ccc(NC(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)c1C ZINC000062404469 851543027 /nfs/dbraw/zinc/54/30/27/851543027.db2.gz WILUWBMMKBHELJ-UHFFFAOYSA-N 0 3 418.488 4.136 20 0 HIADHN COCCOc1ccc(NC(=O)N(CCN(C)C)Cc2cccc(Cl)c2)cc1F ZINC000062410424 851545964 /nfs/dbraw/zinc/54/59/64/851545964.db2.gz LPSZBQMVWDFBQO-UHFFFAOYSA-N 0 3 423.916 4.100 20 0 HIADHN COc1ccc(OC)c([C@H](C)NC(=O)N(CCN(C)C)Cc2cccc(Cl)c2)c1 ZINC000062475793 851558759 /nfs/dbraw/zinc/55/87/59/851558759.db2.gz DBBYXCGCOQCBBZ-INIZCTEOSA-N 0 3 419.953 4.192 20 0 HIADHN COCc1cccc(CNC(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)c1 ZINC000062485519 851562531 /nfs/dbraw/zinc/56/25/31/851562531.db2.gz UPPPJFFFWQELEM-UHFFFAOYSA-N 0 3 423.479 4.125 20 0 HIADHN CCOCc1ccccc1CNC(=O)N(CCN(C)C)Cc1cccc(Cl)c1 ZINC000062485580 851562556 /nfs/dbraw/zinc/56/25/56/851562556.db2.gz RTCNJVSAFCXJDV-UHFFFAOYSA-N 0 3 403.954 4.150 20 0 HIADHN CC(C)Oc1cccc(CNC(=O)N(CCN(C)C)Cc2cccc(Cl)c2)c1 ZINC000062488832 851563464 /nfs/dbraw/zinc/56/34/64/851563464.db2.gz YVWLQSNHNXIPKG-UHFFFAOYSA-N 0 3 403.954 4.401 20 0 HIADHN C[C@@H](Cc1ccsc1)NC(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1 ZINC000062499358 851566564 /nfs/dbraw/zinc/56/65/64/851566564.db2.gz NZDRKCUOVFANFD-HNNXBMFYSA-N 0 3 413.509 4.471 20 0 HIADHN S=C(NC1CCN(Cc2ccccc2)CC1)N1CCC(OCc2ccccc2)CC1 ZINC000063145942 851620961 /nfs/dbraw/zinc/62/09/61/851620961.db2.gz ARESBUGERHDONC-UHFFFAOYSA-N 0 3 423.626 4.207 20 0 HIADHN C[C@@H](NC(=S)NC1CCN(Cc2ccccc2)CC1)c1cccc(OC(F)F)c1 ZINC000063148871 851621016 /nfs/dbraw/zinc/62/10/16/851621016.db2.gz WCHHQBDTIZEDRW-MRXNPFEDSA-N 0 3 419.541 4.478 20 0 HIADHN Fc1cccc2c1SCC[C@@H]2NC(=S)NC1CCN(Cc2ccccc2)CC1 ZINC000063145840 851622061 /nfs/dbraw/zinc/62/20/61/851622061.db2.gz FXZHLRCJEDCOHY-FQEVSTJZSA-N 0 3 415.603 4.491 20 0 HIADHN Cc1ccc(NC(=O)C2CC2)cc1NC(=S)NC1CCN(Cc2ccccc2)CC1 ZINC000063149113 851622127 /nfs/dbraw/zinc/62/21/27/851622127.db2.gz SPSOOBAGOMIENL-UHFFFAOYSA-N 0 3 422.598 4.295 20 0 HIADHN COc1cccc([C@@H]2CCCN2C(=S)NC2CCN(Cc3ccccc3)CC2)c1 ZINC000063146522 851622205 /nfs/dbraw/zinc/62/22/05/851622205.db2.gz KACURVDEUVBNHE-QHCPKHFHSA-N 0 3 409.599 4.371 20 0 HIADHN Cc1ccccc1OCCCN(C)C(=S)NC1CCN(Cc2ccccc2)CC1 ZINC000063150158 851624057 /nfs/dbraw/zinc/62/40/57/851624057.db2.gz DSTWMCMCYJESQC-UHFFFAOYSA-N 0 3 411.615 4.235 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)Nc3ccnn3-c3ccc(Cl)cc3)cc2)CC1 ZINC000437071064 862267463 /nfs/dbraw/zinc/26/74/63/862267463.db2.gz WZCSSWNSEOHPTD-UHFFFAOYSA-N 0 3 423.948 4.308 20 0 HIADHN CCOCCOc1c(Cl)cccc1NC(=O)N1CCN(CCC(C)(C)C)CC1 ZINC000063397474 851677202 /nfs/dbraw/zinc/67/72/02/851677202.db2.gz KWONKSRZUUEFRN-UHFFFAOYSA-N 0 3 411.974 4.341 20 0 HIADHN COc1ccc(Br)c(C(=O)N(CCCc2ccccc2)CCN(C)C)c1 ZINC000063485958 851701895 /nfs/dbraw/zinc/70/18/95/851701895.db2.gz BUXCRMINBICWLM-UHFFFAOYSA-N 0 3 419.363 4.094 20 0 HIADHN C[C@H]1CN(Cc2cccc(CNCc3ccccc3OCc3ccncc3)c2)CCO1 ZINC000063524238 851707389 /nfs/dbraw/zinc/70/73/89/851707389.db2.gz LDPLATMYUWVBSV-NRFANRHFSA-N 0 3 417.553 4.171 20 0 HIADHN CC(C)(NCC(=O)Nc1ccnn1C1CCCC1)c1ccc(Br)cc1 ZINC000063522066 851707725 /nfs/dbraw/zinc/70/77/25/851707725.db2.gz ZMFAKIAJMDNCHG-UHFFFAOYSA-N 0 3 405.340 4.224 20 0 HIADHN FC1(F)Oc2ccc(NC(=S)NC[C@@H](c3cccs3)N3CCCC3)cc2O1 ZINC000063540793 851710667 /nfs/dbraw/zinc/71/06/67/851710667.db2.gz YFRAQMLVJQWLRZ-ZDUSSCGKSA-N 0 3 411.499 4.193 20 0 HIADHN C[C@@H]1CN(C(=O)c2ccc(CNCc3ccccc3C(F)(F)F)cc2)C[C@@H](C)O1 ZINC000063561857 851715056 /nfs/dbraw/zinc/71/50/56/851715056.db2.gz WKLAFDUSXUYZHL-HZPDHXFCSA-N 0 3 406.448 4.245 20 0 HIADHN Cc1ccc2c(CN3CCC[C@@H](CNC(=O)OC(C)(C)C)C3)cc(=O)oc2c1C ZINC000063626492 851728306 /nfs/dbraw/zinc/72/83/06/851728306.db2.gz WZNKUILVGBTVQB-KRWDZBQOSA-N 0 3 400.519 4.147 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CNC(=O)c1cccc(CN2CCCC2)c1 ZINC000063914501 851792312 /nfs/dbraw/zinc/79/23/12/851792312.db2.gz VCVCJBKXUCTZOT-UHFFFAOYSA-N 0 3 402.542 4.074 20 0 HIADHN O=C(NCc1cc(Cl)c2c(c1)OCCCO2)c1cccc(CN2CCCC2)c1 ZINC000063913865 851792576 /nfs/dbraw/zinc/79/25/76/851792576.db2.gz MANYLKVWARUHSK-UHFFFAOYSA-N 0 3 400.906 4.027 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)c1coc(Br)c1 ZINC000064470512 851905261 /nfs/dbraw/zinc/90/52/61/851905261.db2.gz HALJQCMUZLXCRG-UHFFFAOYSA-N 0 3 419.241 4.265 20 0 HIADHN CC(C)(C)C(=O)N1CCC[C@@H]1C(=O)C(C#N)c1nc(-c2c(F)cccc2F)cs1 ZINC000064715214 851964890 /nfs/dbraw/zinc/96/48/90/851964890.db2.gz GOFXQMMAGGWSCU-MLGOLLRUSA-N 0 3 417.481 4.302 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)NCCCc1ccccc1 ZINC000064753198 851976782 /nfs/dbraw/zinc/97/67/82/851976782.db2.gz HFUBVPJFQVVRTD-UHFFFAOYSA-N 0 3 407.480 4.411 20 0 HIADHN COc1ccccc1CCNC(=O)N(CCN(C)C)Cc1ccc(C(F)(F)F)cc1 ZINC000064753677 851977399 /nfs/dbraw/zinc/97/73/99/851977399.db2.gz RRDLAAYFMFWXIX-UHFFFAOYSA-N 0 3 423.479 4.030 20 0 HIADHN CC(C)CC(=O)Nc1cccc(CNC(=O)NC[C@H](c2ccccc2)N2CCCC2)c1 ZINC000064772148 851981711 /nfs/dbraw/zinc/98/17/11/851981711.db2.gz YHGVGMJZZDYEFD-HSZRJFAPSA-N 0 3 422.573 4.308 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Cc1ccc(OC)cc1)c1ccc(C(F)(F)F)cc1 ZINC000065121994 852072192 /nfs/dbraw/zinc/07/21/92/852072192.db2.gz REOGYFZXBMNTMV-FQEVSTJZSA-N 0 3 408.464 4.456 20 0 HIADHN CCN(CC)[C@H](CNC(=O)CCc1c(C)noc1C)c1ccc(C(F)(F)F)cc1 ZINC000065121893 852072208 /nfs/dbraw/zinc/07/22/08/852072208.db2.gz YTVNLTCIFOYOMX-LJQANCHMSA-N 0 3 411.468 4.442 20 0 HIADHN O=C(CN(Cc1ccccc1)CC1CCC1)N1CCC[C@@H]1c1ccc2c(c1)OCCO2 ZINC000065161422 852082800 /nfs/dbraw/zinc/08/28/00/852082800.db2.gz DGLXPTSAVACRMU-HSZRJFAPSA-N 0 3 420.553 4.424 20 0 HIADHN CCN(CC)C(=O)c1cccc(NC(=O)NC[C@H]2CCCCN2Cc2ccccc2)c1 ZINC000065358534 852113519 /nfs/dbraw/zinc/11/35/19/852113519.db2.gz SMTCKBLWCRFSGT-HSZRJFAPSA-N 0 3 422.573 4.345 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)NCCc1c[nH]c2cc(F)ccc12 ZINC000065387907 852120368 /nfs/dbraw/zinc/12/03/68/852120368.db2.gz BSFXJWDSHDBDIS-UHFFFAOYSA-N 0 3 410.537 4.056 20 0 HIADHN COc1cc([C@@H](C)NC(=O)NC[C@@H](c2ccc(C)cc2)N(C)C)ccc1OC(C)C ZINC000065469392 852144729 /nfs/dbraw/zinc/14/47/29/852144729.db2.gz MQEAWLUQUGPLFF-NQIIRXRSSA-N 0 3 413.562 4.454 20 0 HIADHN COc1cccc(CN2CCC(NC(=O)CCSc3ccccc3F)CC2)c1 ZINC000065506348 852160513 /nfs/dbraw/zinc/16/05/13/852160513.db2.gz HWODTLKUBFDVBJ-UHFFFAOYSA-N 0 3 402.535 4.097 20 0 HIADHN CN(CCNC(=O)NCc1ccc(-c2nc3ccccc3s2)o1)Cc1ccccc1 ZINC000065541370 852171497 /nfs/dbraw/zinc/17/14/97/852171497.db2.gz QRDPWZMOMWJGAX-UHFFFAOYSA-N 0 3 420.538 4.488 20 0 HIADHN COc1cc(Br)cc(C)c1NC(=O)NC[C@H](Cc1ccccc1)N(C)C ZINC000065752938 852245643 /nfs/dbraw/zinc/24/56/43/852245643.db2.gz FJGUSEAMWXCDRI-KRWDZBQOSA-N 0 3 420.351 4.061 20 0 HIADHN O=C(N[C@@H](c1ccc2c(c1)OCCO2)C1CC1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000065875927 852297157 /nfs/dbraw/zinc/29/71/57/852297157.db2.gz RBJSRRQXUIXEOL-HYBUGGRVSA-N 0 3 424.516 4.076 20 0 HIADHN Cc1ccc(-c2nc(CC(=O)N(CCN(C)C)Cc3ccccc3F)cs2)cc1 ZINC000065893728 852307178 /nfs/dbraw/zinc/30/71/78/852307178.db2.gz UMGHMKLEWXQEBM-UHFFFAOYSA-N 0 3 411.546 4.391 20 0 HIADHN O=C(Nc1ccc2[nH]c([C@H]3CCCO3)nc2c1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000065905673 852310322 /nfs/dbraw/zinc/31/03/22/852310322.db2.gz YKMGDDUKGOZVPW-HTAPYJJXSA-N 0 3 422.504 4.404 20 0 HIADHN CN(C)CCN(Cc1cccc(C#N)c1)C(=O)/C=C/c1ccccc1OC(F)(F)F ZINC000065930562 852320587 /nfs/dbraw/zinc/32/05/87/852320587.db2.gz ZFPOEWBJQKHZBW-ZHACJKMWSA-N 0 3 417.431 4.060 20 0 HIADHN CN(C)CCN(Cc1cccc(C#N)c1)C(=O)/C=C/c1ccc2ccc(Cl)cc2n1 ZINC000065930074 852320642 /nfs/dbraw/zinc/32/06/42/852320642.db2.gz PTJLMJYWECXISJ-ZHACJKMWSA-N 0 3 418.928 4.363 20 0 HIADHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)c1ccc2cc[nH]c2c1 ZINC000065931847 852322623 /nfs/dbraw/zinc/32/26/23/852322623.db2.gz ABCWFGGWQUNUMZ-UHFFFAOYSA-N 0 3 400.320 4.134 20 0 HIADHN Cc1cc(CNCc2ccccc2N2CCOCC2)cc(C)c1OCc1ccccn1 ZINC000065934741 852323067 /nfs/dbraw/zinc/32/30/67/852323067.db2.gz DCGXUIVHLAAZLH-UHFFFAOYSA-N 0 3 417.553 4.404 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)c1cc2sc(N(C)C)nc2s1 ZINC000065936577 852324699 /nfs/dbraw/zinc/32/46/99/852324699.db2.gz YUHQFSVJMHFNER-UHFFFAOYSA-N 0 3 423.007 4.281 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)CCc1nc2ccccc2[nH]1 ZINC000065936360 852325107 /nfs/dbraw/zinc/32/51/07/852325107.db2.gz JEANSHBCQIJJQM-UHFFFAOYSA-N 0 3 418.463 4.105 20 0 HIADHN COc1ccc(CCC(=O)N(CCN(C)C)Cc2ccc(F)cc2F)cc1Cl ZINC000065937806 852326184 /nfs/dbraw/zinc/32/61/84/852326184.db2.gz VZKFJMIKZGGTAC-UHFFFAOYSA-N 0 3 410.892 4.150 20 0 HIADHN CCOc1ccc2cc(C(=O)N(CCN(C)C)Cc3ccc(F)cc3F)[nH]c2c1 ZINC000065937539 852326812 /nfs/dbraw/zinc/32/68/12/852326812.db2.gz ATSBDTTXBBEFFF-UHFFFAOYSA-N 0 3 401.457 4.049 20 0 HIADHN Cc1oc(-c2cccs2)nc1C(=O)N(CCN(C)C)Cc1ccc(F)c(F)c1 ZINC000065938483 852327911 /nfs/dbraw/zinc/32/79/11/852327911.db2.gz PLYXTGMQMRMJEL-UHFFFAOYSA-N 0 3 405.470 4.194 20 0 HIADHN CCOc1ccc(C(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)cc1OC ZINC000065938991 852327943 /nfs/dbraw/zinc/32/79/43/852327943.db2.gz RQSCKOOXXXJLCE-UHFFFAOYSA-N 0 3 424.463 4.317 20 0 HIADHN Cc1ccc(-n2nc(C(=O)N(CCN(C)C)Cc3cccc(F)c3)c3c2CCC3)cc1 ZINC000065939633 852328439 /nfs/dbraw/zinc/32/84/39/852328439.db2.gz JQDPMIKKEZAMDX-UHFFFAOYSA-N 0 3 420.532 4.013 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)c1cnc(-c2ccccc2F)s1 ZINC000065939267 852328529 /nfs/dbraw/zinc/32/85/29/852328529.db2.gz FLZPGZMWZVRCPE-UHFFFAOYSA-N 0 3 401.482 4.292 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)c1cc(-c2ccccc2Cl)n[nH]1 ZINC000065939828 852329754 /nfs/dbraw/zinc/32/97/54/852329754.db2.gz MGBPQTGGRAFROL-UHFFFAOYSA-N 0 3 400.885 4.073 20 0 HIADHN CCCCNC(=O)c1ccc(CNCc2ccc(OC)c(Br)c2)cc1 ZINC000065981160 852338959 /nfs/dbraw/zinc/33/89/59/852338959.db2.gz XMLHLPCSKHAAHP-UHFFFAOYSA-N 0 3 405.336 4.277 20 0 HIADHN Clc1ccc([C@H](CNCc2ccccc2Br)N2CCOCC2)cc1 ZINC000065981621 852340119 /nfs/dbraw/zinc/34/01/19/852340119.db2.gz KINFVNKPFNALOI-IBGZPJMESA-N 0 3 409.755 4.266 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)Nc1nc(-c2ccccc2)ns1 ZINC000065984289 852341058 /nfs/dbraw/zinc/34/10/58/852341058.db2.gz AVYDOIBIOQUXCO-UHFFFAOYSA-N 0 3 417.485 4.079 20 0 HIADHN CN(Cc1csc(Br)c1)C(=O)NCCCN1CCc2ccccc2C1 ZINC000066001722 852351739 /nfs/dbraw/zinc/35/17/39/852351739.db2.gz ZPPKSSOCJIFGLX-UHFFFAOYSA-N 0 3 422.392 4.100 20 0 HIADHN CCN1CCC[C@H]1CNC(=O)c1cccnc1Sc1ccc(Br)cc1 ZINC000068712526 852368019 /nfs/dbraw/zinc/36/80/19/852368019.db2.gz SFTYHUBXQMIOCF-HNNXBMFYSA-N 0 3 420.376 4.209 20 0 HIADHN CCOc1ccccc1OCC(=O)NC[C@H](c1cccs1)N1CCC(C)CC1 ZINC000068939312 852376754 /nfs/dbraw/zinc/37/67/54/852376754.db2.gz GSMDYLITEOOATL-GOSISDBHSA-N 0 3 402.560 4.115 20 0 HIADHN O=C(CCc1nc2ccccc2n1-c1ccccc1)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000069274258 852390928 /nfs/dbraw/zinc/39/09/28/852390928.db2.gz JBFSIKVQDRDKQP-QFIPXVFZSA-N 0 3 424.548 4.349 20 0 HIADHN Cc1nn(Cc2ccccc2Cl)c(C)c1C(=O)NC[C@@H](c1ccccc1)N(C)C ZINC000069343753 852391804 /nfs/dbraw/zinc/39/18/04/852391804.db2.gz QSTRMQGPRHPACX-NRFANRHFSA-N 0 3 410.949 4.234 20 0 HIADHN CC1CCN([C@H](CNC(=O)Cc2coc(-c3ccccc3)n2)c2ccccc2)CC1 ZINC000072006676 852462331 /nfs/dbraw/zinc/46/23/31/852462331.db2.gz UKGVWBSWOWYZMX-HSZRJFAPSA-N 0 3 403.526 4.474 20 0 HIADHN CCN(C(=O)c1cc(OC)c(OC)c(OC)c1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000072014722 852466998 /nfs/dbraw/zinc/46/69/98/852466998.db2.gz BKMJYGJFPWHXGR-PXNSSMCTSA-N 0 3 412.530 4.010 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N(Cc3ccccc3)CC(F)F)cc2)CC1 ZINC000437167792 862361673 /nfs/dbraw/zinc/36/16/73/862361673.db2.gz URWWGKOOTXULIL-UHFFFAOYSA-N 0 3 401.501 4.125 20 0 HIADHN O=c1[nH]c2ccccc2cc1CN1CCN(C(c2ccccc2)c2ccccc2)CC1 ZINC000078873987 852531100 /nfs/dbraw/zinc/53/11/00/852531100.db2.gz APURAGUHLACOTO-UHFFFAOYSA-N 0 3 409.533 4.435 20 0 HIADHN C[C@H](CN1CCCCC1)NC(=O)c1ccc(COc2cccc(Br)c2)o1 ZINC000078957068 852536616 /nfs/dbraw/zinc/53/66/16/852536616.db2.gz XQRYYBWEFWVLOZ-OAHLLOKOSA-N 0 3 421.335 4.225 20 0 HIADHN Cc1ccc(C[C@@H]2CCCN2CC(=O)N2CCC[C@@H]2c2ccc3c(c2)OCCO3)cc1 ZINC000079097469 852539784 /nfs/dbraw/zinc/53/97/84/852539784.db2.gz VCINOUOQNNORTH-XZOQPEGZSA-N 0 3 420.553 4.137 20 0 HIADHN CN(C)[C@@H](CNC(=O)c1ccc(NC(=O)Nc2ccccc2)s1)c1ccccc1 ZINC000097133627 852584756 /nfs/dbraw/zinc/58/47/56/852584756.db2.gz UQBUWGPSFCIKJA-SFHVURJKSA-N 0 3 408.527 4.425 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccsc1 ZINC000097327268 852601608 /nfs/dbraw/zinc/60/16/08/852601608.db2.gz LSVWLCGVIUDCSZ-MSOLQXFVSA-N 0 3 419.616 4.004 20 0 HIADHN CC[C@@H](C)[C@@H](C(=O)Nc1cccc(CN2CCC(C(N)=O)CC2)c1)c1ccccc1 ZINC000097393399 852606808 /nfs/dbraw/zinc/60/68/08/852606808.db2.gz PEJLRFLWTYGKBK-WZONZLPQSA-N 0 3 407.558 4.152 20 0 HIADHN CC(C)[C@@H](NC(=O)N[C@@H](CN1CCCC1)c1ccccc1)c1nc2ccccc2[nH]1 ZINC000097394679 852607014 /nfs/dbraw/zinc/60/70/14/852607014.db2.gz FUEUXJYQUNMUDK-FCHUYYIVSA-N 0 3 405.546 4.396 20 0 HIADHN CCOc1ccc(-c2nc(CN3CCN(C4CCCC4)CC3)cs2)cc1OC ZINC000105902024 852737959 /nfs/dbraw/zinc/73/79/59/852737959.db2.gz OGOIEJNSAOWBOO-UHFFFAOYSA-N 0 3 401.576 4.278 20 0 HIADHN CN(C)[C@H](CNC(=O)CCSc1ccccc1Br)c1ccccc1 ZINC000107535847 852774126 /nfs/dbraw/zinc/77/41/26/852774126.db2.gz MHBLLJLTIUGYMI-QGZVFWFLSA-N 0 3 407.377 4.350 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Nc1cc(C2CC2)nn1-c1ccccc1 ZINC000437204238 862394271 /nfs/dbraw/zinc/39/42/71/862394271.db2.gz XFFAWISUEMAHHF-UHFFFAOYSA-N 0 3 409.559 4.407 20 0 HIADHN CC[C@H](CNC(=O)N(C)Cc1ccccc1N1CCCC1)N1CCc2ccccc2C1 ZINC000107968357 852813227 /nfs/dbraw/zinc/81/32/27/852813227.db2.gz XMJKHMUXSGLINM-XMMPIXPASA-N 0 3 420.601 4.265 20 0 HIADHN O=C(Cc1ccc2ccccc2c1)NCCCCN1CCN(c2ccccc2)CC1 ZINC000108224530 852829795 /nfs/dbraw/zinc/82/97/95/852829795.db2.gz RMHVAEPNOAUWKF-UHFFFAOYSA-N 0 3 401.554 4.101 20 0 HIADHN O=C(NCCCCN1CCN(Cc2ccccc2)CC1)c1occc1-c1ccccc1 ZINC000108480320 852854740 /nfs/dbraw/zinc/85/47/40/852854740.db2.gz RYGCXEIVTCYOIS-UHFFFAOYSA-N 0 3 417.553 4.274 20 0 HIADHN CN(Cc1ccc(OC(F)F)cc1)C(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000109016982 852908642 /nfs/dbraw/zinc/90/86/42/852908642.db2.gz LHWCIULJUVDIHI-SFHVURJKSA-N 0 3 406.448 4.298 20 0 HIADHN C[C@H](NC(=O)N[C@H]1CCN(Cc2ccccc2)C1)c1ccc(OCC(F)(F)F)cc1 ZINC000109040136 852912963 /nfs/dbraw/zinc/91/29/63/852912963.db2.gz NYJQBOMKCUATBI-LPHOPBHVSA-N 0 3 421.463 4.262 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)c3ccc(Oc4cccnc4)cc3)cc2)CC1 ZINC000109070352 852916961 /nfs/dbraw/zinc/91/69/61/852916961.db2.gz JFZSJCFCGURQBX-UHFFFAOYSA-N 0 3 416.525 4.264 20 0 HIADHN CN(Cc1ccc(Br)cc1)C(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000109338760 852955803 /nfs/dbraw/zinc/95/58/03/852955803.db2.gz JHVAYJNIKGUYBF-GOSISDBHSA-N 0 3 419.338 4.459 20 0 HIADHN Cc1cc(C(=O)Nc2ccc(CCN3CCSCC3)cc2)nn1-c1ccccc1 ZINC000109484630 852975738 /nfs/dbraw/zinc/97/57/38/852975738.db2.gz ZMZOPKHBYSIROJ-UHFFFAOYSA-N 0 3 406.555 4.024 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2ccc(NC(=O)[C@H]3C[C@@H]3C)cc2)N2CCCC2)cc1 ZINC000109505374 852978305 /nfs/dbraw/zinc/97/83/05/852978305.db2.gz JZZPKQPRRIKOHS-TZYHBYERSA-N 0 3 405.542 4.156 20 0 HIADHN Cc1[nH]c(C(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)c(C)c1C(=O)OC(C)C ZINC000109503336 852978622 /nfs/dbraw/zinc/97/86/22/852978622.db2.gz WDZORBNLYQINTQ-HXUWFJFHSA-N 0 3 411.546 4.072 20 0 HIADHN NC(=O)[C@H]1CCCN(Cc2ccccc2NC(=O)c2ccc(-c3ccc(F)cc3)o2)C1 ZINC000109939772 853037405 /nfs/dbraw/zinc/03/74/05/853037405.db2.gz QPAWKFOXRVPKBW-SFHVURJKSA-N 0 3 421.472 4.035 20 0 HIADHN COC(=O)c1ccc(NC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)c(C)c1 ZINC000110121717 853062448 /nfs/dbraw/zinc/06/24/48/853062448.db2.gz DPRIIIYFCZSJAC-OAQYLSRUSA-N 0 3 420.431 4.175 20 0 HIADHN CC(C)COC(=O)N1CCCN(CCC(=O)Nc2ccccc2-c2ccccc2)CC1 ZINC000110188768 853070635 /nfs/dbraw/zinc/07/06/35/853070635.db2.gz IWRJNTZUKJGJGJ-UHFFFAOYSA-N 0 3 423.557 4.483 20 0 HIADHN COc1ccc(CCC(=O)N2CCCN(CCCOc3ccc(C)c(C)c3)CC2)cc1 ZINC000110192291 853071595 /nfs/dbraw/zinc/07/15/95/853071595.db2.gz KQPCOTCJAZWOIM-UHFFFAOYSA-N 0 3 424.585 4.248 20 0 HIADHN CCCN(CC(=O)Nc1ccc(C)c(F)c1)C1CCN(C(=O)c2ccccc2)CC1 ZINC000110289465 853083509 /nfs/dbraw/zinc/08/35/09/853083509.db2.gz CXIGPXBJCUAGBE-UHFFFAOYSA-N 0 3 411.521 4.089 20 0 HIADHN Cc1nc(-c2ccccc2)ccc1C(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000110413819 853096879 /nfs/dbraw/zinc/09/68/79/853096879.db2.gz YPKLALQJHXPVQW-RTBURBONSA-N 0 3 407.558 4.018 20 0 HIADHN Cc1c2cccc(Cl)c2oc1C(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000110455482 853102281 /nfs/dbraw/zinc/10/22/81/853102281.db2.gz RMKJHQUYZLIBJL-HUUCEWRRSA-N 0 3 404.938 4.356 20 0 HIADHN Cc1ccc(-c2nc(C(=O)N3CCC(CN4C[C@@H](C)O[C@@H](C)C4)CC3)cs2)cc1 ZINC000110456172 853102457 /nfs/dbraw/zinc/10/24/57/853102457.db2.gz RAMVRISFWQGXDC-HDICACEKSA-N 0 3 413.587 4.080 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)C3(c4ccc(Cl)cc4)CCCC3)CC2)C[C@H](C)O1 ZINC000110458204 853102534 /nfs/dbraw/zinc/10/25/34/853102534.db2.gz ZSWFFVCDWSOWCD-KDURUIRLSA-N 0 3 419.009 4.500 20 0 HIADHN Cc1ccc(NC(=O)N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)c(Br)c1 ZINC000110720842 853143838 /nfs/dbraw/zinc/14/38/38/853143838.db2.gz RKRJTIMJTDIBTR-IYBDPMFKSA-N 0 3 424.383 4.111 20 0 HIADHN CC(C)(C)[S@](=O)Cc1cccc(NC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000112637005 853235291 /nfs/dbraw/zinc/23/52/91/853235291.db2.gz ODAUXAZPGGSXGO-PBBNMVCDSA-N 0 3 413.587 4.130 20 0 HIADHN CN(CCCc1cc(-c2ccc(F)cc2)n(C)n1)C[C@H](O)c1c(F)cccc1F ZINC000139979639 853428988 /nfs/dbraw/zinc/42/89/88/853428988.db2.gz RVVMUSZVVOVWCA-NRFANRHFSA-N 0 3 403.448 4.102 20 0 HIADHN CN(CCCc1cc(-c2ccc(F)cc2)n(C)n1)C[C@@H](O)c1c(F)cccc1F ZINC000139979754 853429440 /nfs/dbraw/zinc/42/94/40/853429440.db2.gz RVVMUSZVVOVWCA-OAQYLSRUSA-N 0 3 403.448 4.102 20 0 HIADHN Cc1cc(C)c(NC(=O)[C@H](C)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c(Cl)c1 ZINC000140190822 853437565 /nfs/dbraw/zinc/43/75/65/853437565.db2.gz WPFAAYSOLYIJJE-ROUUACIJSA-N 0 3 415.965 4.471 20 0 HIADHN Cc1sc2nc([C@@H](C)NCC3(c4ccc(F)cc4)CCOCC3)[nH]c(=O)c2c1C ZINC000140279058 853441120 /nfs/dbraw/zinc/44/11/20/853441120.db2.gz DHFVVIPLIZCLQD-CQSZACIVSA-N 0 3 415.534 4.140 20 0 HIADHN C[C@H](NCc1cccc(OCc2ccccn2)c1)c1cccc(N2CCOC2=O)c1 ZINC000142693167 853497997 /nfs/dbraw/zinc/49/79/97/853497997.db2.gz FNBRLWRADDRCFO-SFHVURJKSA-N 0 3 403.482 4.468 20 0 HIADHN COC(=O)Nc1ccc(CNC(=O)CN2CCC[C@@H]2c2cccc3ccccc32)cc1 ZINC000142756045 853498896 /nfs/dbraw/zinc/49/88/96/853498896.db2.gz YVRJQCQQNHETGY-HSZRJFAPSA-N 0 3 417.509 4.471 20 0 HIADHN CC(C)(C)OC(=O)NC[C@@H]1CCCN(Cc2ccc(OCc3ccncc3)cc2)C1 ZINC000143525078 853516961 /nfs/dbraw/zinc/51/69/61/853516961.db2.gz HUQBZPAJUNOSQV-NRFANRHFSA-N 0 3 411.546 4.397 20 0 HIADHN S=C(Nc1cccc(Oc2cnccn2)c1)NC1CCN(Cc2ccccc2)CC1 ZINC000145606590 853554230 /nfs/dbraw/zinc/55/42/30/853554230.db2.gz DLIYIAAKSJFLGQ-UHFFFAOYSA-N 0 3 419.554 4.220 20 0 HIADHN Cc1ccc(-c2nc(COC(=O)C3CCN(c4ccc(F)c(F)c4)C3=O)co2)cc1 ZINC000147480270 853588602 /nfs/dbraw/zinc/58/86/02/853588602.db2.gz MYUWBTLQSYGVCB-KRWDZBQOSA-N 0 3 412.392 4.025 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2CN2CCC(CC(N)=O)CC2)cc1C ZINC000195601738 853707823 /nfs/dbraw/zinc/70/78/23/853707823.db2.gz YSIRZUIJOWSCOF-UHFFFAOYSA-N 0 3 402.542 4.244 20 0 HIADHN O=C(N[C@H]1CCCN(Cc2ccccc2)C1)N1CCC[C@@H](c2nc3ccccc3o2)C1 ZINC000195648562 853737004 /nfs/dbraw/zinc/73/70/04/853737004.db2.gz ZAVMLGCAMYBAFK-RTWAWAEBSA-N 0 3 418.541 4.381 20 0 HIADHN CCN1CCN(CCCNC(=O)C2(c3ccc(C(C)(C)C)cc3)CCCCC2)CC1 ZINC000195680336 853754999 /nfs/dbraw/zinc/75/49/99/853754999.db2.gz AKQGJFFEVOVDPX-UHFFFAOYSA-N 0 3 413.650 4.330 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)c3cc(C)nc4onc(C(C)C)c43)cc2)CC1 ZINC000195694142 853762965 /nfs/dbraw/zinc/76/29/65/853762965.db2.gz HKWPITMPNMFYGE-UHFFFAOYSA-N 0 3 421.545 4.044 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3cnc(-c4ccccc4)nc3)c(C)c2)CC1 ZINC000195700848 853766134 /nfs/dbraw/zinc/76/61/34/853766134.db2.gz BURLLLOYBMVCRL-UHFFFAOYSA-N 0 3 416.529 4.238 20 0 HIADHN COc1cccc([C@@H](CNC(=O)NCCc2ccccc2Cl)N2CCCC2)c1 ZINC000195720612 853777449 /nfs/dbraw/zinc/77/74/49/853777449.db2.gz UCMUPPBEIDYBGT-OAQYLSRUSA-N 0 3 401.938 4.027 20 0 HIADHN Cc1ccc(-c2nn(-c3ccc(F)cc3)cc2C(=O)N(C)C2CCN(C)CC2)cc1 ZINC000215836339 853838781 /nfs/dbraw/zinc/83/87/81/853838781.db2.gz LKARLKIMSONHGB-UHFFFAOYSA-N 0 3 406.505 4.153 20 0 HIADHN Brc1ccc(-c2c[nH]c(CNCCCc3nc4ccccc4[nH]3)n2)cc1 ZINC000236621633 853903760 /nfs/dbraw/zinc/90/37/60/853903760.db2.gz RXSLYYXPOLDXCE-UHFFFAOYSA-N 0 3 410.319 4.438 20 0 HIADHN Brc1cccc(-c2c[nH]c(CNCCCn3cnc4ccccc43)n2)c1 ZINC000236661102 853908427 /nfs/dbraw/zinc/90/84/27/853908427.db2.gz CGPGCWOIMLPRFG-UHFFFAOYSA-N 0 3 410.319 4.369 20 0 HIADHN CC(C)[C@@H](CNCc1csc(-c2cccc(Br)c2)n1)N1CCOCC1 ZINC000236708061 853914202 /nfs/dbraw/zinc/91/42/02/853914202.db2.gz VSDJYEKSJOZOLO-GOSISDBHSA-N 0 3 424.408 4.019 20 0 HIADHN CC(C)(CNCc1cccc2[nH]ccc21)S(=O)(=O)c1ccc(Br)cc1 ZINC000236737565 853917320 /nfs/dbraw/zinc/91/73/20/853917320.db2.gz FMTPMYGQEHFBLN-UHFFFAOYSA-N 0 3 421.360 4.273 20 0 HIADHN CC(C)(C)c1n[nH]cc1CN[C@@H]1CCN(c2ncc(C(F)(F)F)cc2Cl)C1 ZINC000236764936 853920611 /nfs/dbraw/zinc/92/06/11/853920611.db2.gz LSHXAMUTGGEORL-CYBMUJFWSA-N 0 3 401.864 4.143 20 0 HIADHN CCN(CC)[C@@H](CNCc1cc(OC)c(OC)cc1Br)c1ccco1 ZINC000236845148 853928939 /nfs/dbraw/zinc/92/89/39/853928939.db2.gz MNIJAQHFBJDVNH-INIZCTEOSA-N 0 3 411.340 4.232 20 0 HIADHN CCOc1cc(CNCc2ccc(C3OCCO3)cc2)ccc1OCC(F)(F)F ZINC000236864919 853929849 /nfs/dbraw/zinc/92/98/49/853929849.db2.gz SHFIVPFXDKYWKK-UHFFFAOYSA-N 0 3 411.420 4.362 20 0 HIADHN CCNC(=O)COc1ccc(CN[C@@H](C)c2ccc(-c3ccncc3)cc2)cc1OC ZINC000236908881 853936259 /nfs/dbraw/zinc/93/62/59/853936259.db2.gz RPKDCZVPGRSDOO-SFHVURJKSA-N 0 3 419.525 4.123 20 0 HIADHN CCNC(=O)c1ccc(CNCc2cc(C)c(OCc3ccccn3)c(C)c2)cc1 ZINC000236978461 853946297 /nfs/dbraw/zinc/94/62/97/853946297.db2.gz KHILVZSPLIIQMH-UHFFFAOYSA-N 0 3 403.526 4.317 20 0 HIADHN CN(C(=O)[C@H](Cc1ccccc1)NCc1ccc(-n2cccn2)cc1)c1ccccc1 ZINC000237076819 853961023 /nfs/dbraw/zinc/96/10/23/853961023.db2.gz ZYASTZJCUIMRLD-VWLOTQADSA-N 0 3 410.521 4.236 20 0 HIADHN Cc1ccc(COc2ccc(CNCc3ccnc(N4CCN(C)CC4)c3)cc2)cc1 ZINC000237105216 853965602 /nfs/dbraw/zinc/96/56/02/853965602.db2.gz ROMVTHHWHZZOIR-UHFFFAOYSA-N 0 3 416.569 4.011 20 0 HIADHN COc1cc(Br)cc(C[NH2+]C[C@@H](O)c2cccc(C(F)(F)F)c2)c1[O-] ZINC000237211587 853983147 /nfs/dbraw/zinc/98/31/47/853983147.db2.gz GSTQDBLTDUCHKS-CQSZACIVSA-N 0 3 420.225 4.005 20 0 HIADHN COc1cc(CNCc2ccccc2Cn2cccn2)ccc1OCC(F)(F)F ZINC000237217234 853984189 /nfs/dbraw/zinc/98/41/89/853984189.db2.gz GOEVPIXJYPPYOY-UHFFFAOYSA-N 0 3 405.420 4.171 20 0 HIADHN COc1cc(CNCc2ccccc2CN2C[C@H](C)O[C@@H](C)C2)cc(Cl)c1OC ZINC000237215963 853984722 /nfs/dbraw/zinc/98/47/22/853984722.db2.gz UJTRPGZTZIOKIN-IRXDYDNUSA-N 0 3 418.965 4.256 20 0 HIADHN COc1cc(CNCc2c[nH]nc2-c2cccc(C)c2)cc(Br)c1OC ZINC000237227615 853986856 /nfs/dbraw/zinc/98/68/56/853986856.db2.gz XKANXPCKYUTCLM-UHFFFAOYSA-N 0 3 416.319 4.455 20 0 HIADHN COCc1cc(CNCc2ccc(OCc3c(C)noc3C)c(OC)c2)ccc1F ZINC000237246993 853990142 /nfs/dbraw/zinc/99/01/42/853990142.db2.gz KSNZYOPWHRQDOI-UHFFFAOYSA-N 0 3 414.477 4.454 20 0 HIADHN COc1cc(CNCc2ccc(-c3cc(C)cc(C)c3)cc2)ccc1OCC(N)=O ZINC000237261358 853992931 /nfs/dbraw/zinc/99/29/31/853992931.db2.gz AOJBWBJXGAOZFE-UHFFFAOYSA-N 0 3 404.510 4.133 20 0 HIADHN COc1ccc(NC(=O)C[C@@H](C)NCc2ccccc2OC(F)(F)F)c(OC)c1 ZINC000237301394 854001633 /nfs/dbraw/zinc/00/16/33/854001633.db2.gz BLGQBLYJAAPYAQ-CYBMUJFWSA-N 0 3 412.408 4.109 20 0 HIADHN COc1ccc(NC(=O)C[C@H](C)N[C@@H]2CCOc3c(Cl)cccc32)c(OC)c1 ZINC000237306087 854003001 /nfs/dbraw/zinc/00/30/01/854003001.db2.gz MCJAJJQWZCENKZ-SUMWQHHRSA-N 0 3 404.894 4.188 20 0 HIADHN COc1ccc(NC(=O)C[C@H](C)N[C@H]2CCSc3ccc(F)cc32)c(OC)c1 ZINC000237307567 854003671 /nfs/dbraw/zinc/00/36/71/854003671.db2.gz HISUYOJOQCKHCQ-GUYCJALGSA-N 0 3 404.507 4.387 20 0 HIADHN COc1cc(CNCc2ccc(C(N)=O)cc2)ccc1OCc1ccc(Cl)cc1 ZINC000237309152 854003723 /nfs/dbraw/zinc/00/37/23/854003723.db2.gz LRCKVOXXJLFAHT-UHFFFAOYSA-N 0 3 410.901 4.316 20 0 HIADHN COc1ccc([C@H](CNCc2cc(OC)c(OC)cc2OC)N2CCCCC2)cc1 ZINC000237335070 854008531 /nfs/dbraw/zinc/00/85/31/854008531.db2.gz CHMKKTXJNSBJJA-NRFANRHFSA-N 0 3 414.546 4.038 20 0 HIADHN COc1ccc([C@H](CNCc2cc(C(F)(F)F)ccc2F)N2CCOCC2)cc1 ZINC000237333483 854008714 /nfs/dbraw/zinc/00/87/14/854008714.db2.gz KFXWSPJBUHIXAC-FQEVSTJZSA-N 0 3 412.427 4.016 20 0 HIADHN COc1cc(CN[C@H]2c3ccccc3C[C@@H]2C)cc(I)c1OC ZINC000237361344 854013618 /nfs/dbraw/zinc/01/36/18/854013618.db2.gz FSSCAPUFOZMTMV-KPZWWZAWSA-N 0 3 423.294 4.332 20 0 HIADHN COc1cc(Br)cc(C[NH2+][C@H](c2ccc3c(c2)OCCO3)C2CC2)c1[O-] ZINC000237380766 854018492 /nfs/dbraw/zinc/01/84/92/854018492.db2.gz MNMYQBCABYAVPH-IBGZPJMESA-N 0 3 420.303 4.175 20 0 HIADHN COc1cccc(CNC[C@@H](c2c(F)cccc2Cl)N2CCO[C@@H](C)C2)c1OC ZINC000237384046 854019533 /nfs/dbraw/zinc/01/95/33/854019533.db2.gz RDNOZVGROFMLCT-KXBFYZLASA-N 0 3 422.928 4.048 20 0 HIADHN CNS(=O)(=O)c1ccc([C@H](C)NCc2ccc(OCc3ccc(C)cc3)cc2)cc1 ZINC000237391169 854021324 /nfs/dbraw/zinc/02/13/24/854021324.db2.gz GCQFGKXAMPHGJK-IBGZPJMESA-N 0 3 424.566 4.333 20 0 HIADHN COc1ccc(OC)c(NC(=O)C[C@@H](C)NCc2c(C)nn(-c3ccccc3)c2C)c1 ZINC000237395489 854022774 /nfs/dbraw/zinc/02/27/74/854022774.db2.gz NQZHXYFKYVHUGZ-MRXNPFEDSA-N 0 3 422.529 4.013 20 0 HIADHN COc1ccc(OC)c(NC(=O)C[C@H](C)N[C@@H]2CCSc3ccc(F)cc32)c1 ZINC000237402798 854024501 /nfs/dbraw/zinc/02/45/01/854024501.db2.gz DWOHQMPIBLSNAP-SUMWQHHRSA-N 0 3 404.507 4.387 20 0 HIADHN COc1ccc(OC)c(NC(=O)C[C@H](C)N[C@H]2CCSc3ccc(F)cc32)c1 ZINC000237403424 854024605 /nfs/dbraw/zinc/02/46/05/854024605.db2.gz DWOHQMPIBLSNAP-GUYCJALGSA-N 0 3 404.507 4.387 20 0 HIADHN COc1ccc(OC)c([C@H](O)CNCC2=Cc3cc(Cl)cc(Cl)c3OC2)c1 ZINC000237416017 854027549 /nfs/dbraw/zinc/02/75/49/854027549.db2.gz JRLYUTSZWVQKML-GOSISDBHSA-N 0 3 410.297 4.110 20 0 HIADHN COc1ccc(-c2ccc(CNC[C@H](O)c3ccc(Cl)cc3)o2)c([N+](=O)[O-])c1 ZINC000237430167 854031668 /nfs/dbraw/zinc/03/16/68/854031668.db2.gz ZDCFJXCFSQCEEE-IBGZPJMESA-N 0 3 402.834 4.340 20 0 HIADHN COc1ccc(-c2ccc(CN[C@@H](C)[C@H](O)c3ccc(F)cc3)o2)c([N+](=O)[O-])c1 ZINC000237437301 854033775 /nfs/dbraw/zinc/03/37/75/854033775.db2.gz VRMUOLOXURCWSN-ZSEKCTLFSA-N 0 3 400.406 4.214 20 0 HIADHN COc1cc(OC)cc(Oc2ccc(CNCc3ccnc(-n4ccnc4)c3)cc2)c1 ZINC000237459828 854036968 /nfs/dbraw/zinc/03/69/68/854036968.db2.gz VWJNUXUSJFXOKT-UHFFFAOYSA-N 0 3 416.481 4.367 20 0 HIADHN Cc1nn(-c2ccccc2)cc1CNCc1ccccc1CN1C[C@@H](C)O[C@H](C)C1 ZINC000237575219 854057021 /nfs/dbraw/zinc/05/70/21/854057021.db2.gz ATRDFPMDHNVDMW-WOJBJXKFSA-N 0 3 404.558 4.080 20 0 HIADHN C[C@H](NCc1cn(-c2ccccc2)nc1-c1cccnc1)c1ccc(NC(N)=O)cc1 ZINC000237610500 854061783 /nfs/dbraw/zinc/06/17/83/854061783.db2.gz LTKBHHWNKLSXFP-KRWDZBQOSA-N 0 3 412.497 4.276 20 0 HIADHN Cc1nn(Cc2ccc(F)cc2)c(Cl)c1CNCCCNC(=O)OC(C)(C)C ZINC000237609277 854061928 /nfs/dbraw/zinc/06/19/28/854061928.db2.gz CKTBLZUCWCLBME-UHFFFAOYSA-N 0 3 410.921 4.037 20 0 HIADHN Cc1nn(Cc2ccc(F)cc2)c(Cl)c1CNC[C@@H]1CCN(CC(F)(F)F)C1 ZINC000237612961 854062631 /nfs/dbraw/zinc/06/26/31/854062631.db2.gz CQEBQMYMIUCMRT-HNNXBMFYSA-N 0 3 418.866 4.006 20 0 HIADHN Cc1nn(-c2ccc(Br)cc2)c(C)c1CNC[C@@H](O)c1ccccc1F ZINC000237700303 854078952 /nfs/dbraw/zinc/07/89/52/854078952.db2.gz JUNCTVNXAQQBCK-HXUWFJFHSA-N 0 3 418.310 4.214 20 0 HIADHN Cc1c(CNCc2ccc(OCc3ccccc3)cc2)c(=O)n(-c2ccccc2)n1C ZINC000237753958 854089156 /nfs/dbraw/zinc/08/91/56/854089156.db2.gz OYHUCGSXNQEHCO-UHFFFAOYSA-N 0 3 413.521 4.353 20 0 HIADHN Cc1cccc(OC[C@@H](O)CNCc2cccc(NC(=O)c3ccccc3Cl)c2)c1 ZINC000237772212 854093978 /nfs/dbraw/zinc/09/39/78/854093978.db2.gz ZRZIZVGOHFSBDW-FQEVSTJZSA-N 0 3 424.928 4.430 20 0 HIADHN Clc1nc2ccccn2c1CNC[C@@H]1CCN(c2cccc(Br)c2)C1 ZINC000237805186 854101053 /nfs/dbraw/zinc/10/10/53/854101053.db2.gz SRTRQBVQSUVECR-AWEZNQCLSA-N 0 3 419.754 4.366 20 0 HIADHN Fc1cc(CNCC2=Cc3cc(Br)ccc3OC2)ccc1-n1ccnc1 ZINC000237845747 854107588 /nfs/dbraw/zinc/10/75/88/854107588.db2.gz PVZISOSIQPDKKR-UHFFFAOYSA-N 0 3 414.278 4.340 20 0 HIADHN Cn1c(CNC2CCN(Cc3cccc(C(F)(F)F)c3)CC2)nc2ccccc21 ZINC000237856410 854108763 /nfs/dbraw/zinc/10/87/63/854108763.db2.gz FDELAMVPXLGVTM-UHFFFAOYSA-N 0 3 402.464 4.346 20 0 HIADHN FC(F)(F)c1ccc(-c2nc(CNCCCOC[C@H]3CCOC3)cs2)cc1 ZINC000237909280 854118234 /nfs/dbraw/zinc/11/82/34/854118234.db2.gz UCGSQAKSDNDERQ-CQSZACIVSA-N 0 3 400.466 4.362 20 0 HIADHN N#CCCCOc1cccc(C[NH2+][C@H]2CCCN(Cc3cc(Cl)ccc3[O-])C2)c1 ZINC000238060510 854139557 /nfs/dbraw/zinc/13/95/57/854139557.db2.gz NFMAQCMFMNQPQL-NRFANRHFSA-N 0 3 413.949 4.482 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2ccc(NC(=O)[C@@H]3C[C@H]3C)cc2)N2CCCC2)cc1 ZINC000248151139 854182488 /nfs/dbraw/zinc/18/24/88/854182488.db2.gz JZZPKQPRRIKOHS-YSZBQJHXSA-N 0 3 405.542 4.156 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N[C@@H](c1ccc(F)cc1)[C@H]1CCCO1 ZINC000250084766 854192969 /nfs/dbraw/zinc/19/29/69/854192969.db2.gz KVNGTLKPYGYVPA-SBHAEUEKSA-N 0 3 417.550 4.244 20 0 HIADHN O=C(CN1CCC[C@@H](c2ccccc2)CC1)N1CCC[C@H]1c1ccc2c(c1)OCCO2 ZINC000250800377 854195493 /nfs/dbraw/zinc/19/54/93/854195493.db2.gz DVFHSUWGDVTCGA-GGAORHGYSA-N 0 3 420.553 4.391 20 0 HIADHN COc1ccc([C@H](CNC(=O)/C=C/c2ccc(OC)c(OC)c2)N2CCCCC2)cc1 ZINC000255943285 854225922 /nfs/dbraw/zinc/22/59/22/854225922.db2.gz ACYKALGACDNJPW-GXUSPISNSA-N 0 3 424.541 4.069 20 0 HIADHN CC[C@H](C)c1ccccc1NC(=O)[C@@H](C)NC[C@H](c1cccs1)N1CCOCC1 ZINC000255953261 854228791 /nfs/dbraw/zinc/22/87/91/854228791.db2.gz OBHBNKQQQLCPIM-WAOWUJCRSA-N 0 3 415.603 4.252 20 0 HIADHN CC[C@H]1c2ccsc2CCN1C(=O)CNC1(c2ccc(F)cc2)CCOCC1 ZINC000261440419 854263074 /nfs/dbraw/zinc/26/30/74/854263074.db2.gz MBOVPLAGOUZYOO-IBGZPJMESA-N 0 3 402.535 4.019 20 0 HIADHN O=C(NCc1ccco1)c1cccc(CNC2(c3ccc(F)cc3)CCOCC2)c1 ZINC000261447717 854265895 /nfs/dbraw/zinc/26/58/95/854265895.db2.gz PDWHVVFEIKFDOX-UHFFFAOYSA-N 0 3 408.473 4.144 20 0 HIADHN CN1CCN(C[C@H](Nc2nc(-c3cccnc3)nc3ccccc32)c2ccccc2)CC1 ZINC000301141152 854309281 /nfs/dbraw/zinc/30/92/81/854309281.db2.gz BMCIMACQYZFPLT-DEOSSOPVSA-N 0 3 424.552 4.092 20 0 HIADHN FC(F)(F)c1cc(NC[C@@H](c2ccco2)N2CCCC2)nc(-c2cccnc2)n1 ZINC000301174941 854319339 /nfs/dbraw/zinc/31/93/39/854319339.db2.gz HVIKLQLKOHNUOP-HNNXBMFYSA-N 0 3 403.408 4.399 20 0 HIADHN O=C(c1ccc(NC[C@@H](c2ccco2)N2CCCC2)nc1)N1CCc2ccccc21 ZINC000301225458 854333075 /nfs/dbraw/zinc/33/30/75/854333075.db2.gz FZCXKFSYXHBNOO-NRFANRHFSA-N 0 3 402.498 4.127 20 0 HIADHN CN(C)[C@H](CNc1ccc(C(=O)N2CCc3ccccc32)cn1)c1ccc(F)cc1 ZINC000301242095 854337557 /nfs/dbraw/zinc/33/75/57/854337557.db2.gz OKAFBFFZFLDRMG-JOCHJYFZSA-N 0 3 404.489 4.138 20 0 HIADHN CN(C)[C@H](CNc1cc(C(F)(F)F)nc(-c2ccncc2)n1)c1cccc(F)c1 ZINC000301347827 854366261 /nfs/dbraw/zinc/36/62/61/854366261.db2.gz LHRMURVUZKMRIR-MRXNPFEDSA-N 0 3 405.399 4.411 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(NC[C@@H]3CCC[N@H+](C)[C@H]3c3cccs3)nc2)n1 ZINC000301421495 854390002 /nfs/dbraw/zinc/39/00/02/854390002.db2.gz NSQHXNCWYBWQKH-YCRPNKLZSA-N 0 3 409.559 4.363 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(NC[C@@H]3CCC[N@@H+](C)[C@H]3c3cccs3)nc2)n1 ZINC000301421495 854390008 /nfs/dbraw/zinc/39/00/08/854390008.db2.gz NSQHXNCWYBWQKH-YCRPNKLZSA-N 0 3 409.559 4.363 20 0 HIADHN Cc1nc(-c2ccc(NC[C@@H]3CCC[N@@H+](C)[C@H]3c3cccs3)nc2)[n-]c(=O)c1C ZINC000301448294 854396673 /nfs/dbraw/zinc/39/66/73/854396673.db2.gz WHCPVCIDWWKYIK-OXJNMPFZSA-N 0 3 409.559 4.418 20 0 HIADHN Cc1nc(-c2ccc(NC[C@@H]3CCC[N@H+](C)[C@H]3c3cccs3)nc2)[n-]c(=O)c1C ZINC000301448294 854396685 /nfs/dbraw/zinc/39/66/85/854396685.db2.gz WHCPVCIDWWKYIK-OXJNMPFZSA-N 0 3 409.559 4.418 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(N[C@H]3CC[N@H+](Cc4ccccc4)[C@H](C)C3)nc2)n1 ZINC000301532281 854414436 /nfs/dbraw/zinc/41/44/36/854414436.db2.gz KNFGGICKAACYIP-UTKZUKDTSA-N 0 3 403.530 4.272 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(N[C@H]3CC[N@@H+](Cc4ccccc4)[C@H](C)C3)nc2)n1 ZINC000301532281 854414444 /nfs/dbraw/zinc/41/44/44/854414444.db2.gz KNFGGICKAACYIP-UTKZUKDTSA-N 0 3 403.530 4.272 20 0 HIADHN COc1ccccc1[C@@H](CNc1ccc(-c2nc(C)c(C)c(=O)[n-]2)cn1)[NH+]1CCCC1 ZINC000301547511 854418116 /nfs/dbraw/zinc/41/81/16/854418116.db2.gz UIPDEBOXRHRWNZ-HXUWFJFHSA-N 0 3 419.529 4.119 20 0 HIADHN Cc1c2nnc(C(F)(F)F)n2nc(NC[C@H](c2cccs2)N2CCCC2)c1C ZINC000301731996 854454431 /nfs/dbraw/zinc/45/44/31/854454431.db2.gz FHMNAGWCSZSQOX-CYBMUJFWSA-N 0 3 410.469 4.070 20 0 HIADHN Cc1ccc([C@@H](CNc2nn3cc(-c4cccnc4)nc3s2)N2CCCC2)cc1 ZINC000302073627 854527248 /nfs/dbraw/zinc/52/72/48/854527248.db2.gz GCASBRVCKSFKQJ-HXUWFJFHSA-N 0 3 404.543 4.410 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)Nc2nn3cc(-c4cccnc4)nc3s2)cc1 ZINC000302114466 854532545 /nfs/dbraw/zinc/53/25/45/854532545.db2.gz BYSFQFJLMXBAGK-IBGZPJMESA-N 0 3 420.542 4.110 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CC[C@H]1Nc1nn2cc(-c3cccnc3)nc2s1 ZINC000302193552 854547296 /nfs/dbraw/zinc/54/72/96/854547296.db2.gz RVGFXLQELTVQOC-QFBILLFUSA-N 0 3 404.543 4.175 20 0 HIADHN Brc1cc(CNC[C@H](c2ccco2)N2CCCCC2)cc2c1OCO2 ZINC000302222688 854552956 /nfs/dbraw/zinc/55/29/56/854552956.db2.gz PGSMDBCKXRPTKN-MRXNPFEDSA-N 0 3 407.308 4.088 20 0 HIADHN COc1ccc([C@H](CNc2ccc3nnc(C(C)(C)C)n3n2)N2CCCCC2)cc1 ZINC000302281265 854559034 /nfs/dbraw/zinc/55/90/34/854559034.db2.gz JCAAGSQKNFDSED-IBGZPJMESA-N 0 3 408.550 4.070 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)c1cccc(NC(=O)c2cccs2)c1 ZINC000302662416 854599292 /nfs/dbraw/zinc/59/92/92/854599292.db2.gz YVLMJEWONJUZQD-UHFFFAOYSA-N 0 3 407.539 4.204 20 0 HIADHN COc1ccc([C@H](CNC(=O)N[C@@H](C)c2ccc(F)cc2F)N2CCCC2)cc1 ZINC000302816656 854644739 /nfs/dbraw/zinc/64/47/39/854644739.db2.gz VDCKKDQUIFMCKB-BTYIYWSLSA-N 0 3 403.473 4.171 20 0 HIADHN COc1ccc([C@@H](C)NC(=O)NC[C@@H](c2ccccc2)N(C)C)cc1Br ZINC000302896579 854670202 /nfs/dbraw/zinc/67/02/02/854670202.db2.gz LGBNSRNDIHUCSV-KDOFPFPSSA-N 0 3 420.351 4.121 20 0 HIADHN COc1cccc([C@@H](CNC(=O)N[C@@H](C)c2ccc(F)cc2F)N2CCCC2)c1 ZINC000302900669 854672431 /nfs/dbraw/zinc/67/24/31/854672431.db2.gz QIDSVSMTIAVRRJ-YCRPNKLZSA-N 0 3 403.473 4.171 20 0 HIADHN O=C(Nc1ccc(OCC(F)(F)F)nc1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000302958929 854696617 /nfs/dbraw/zinc/69/66/17/854696617.db2.gz FSVJGSHFTAEURB-HNNXBMFYSA-N 0 3 411.399 4.013 20 0 HIADHN Clc1ccc(CN2CCC[C@H](CN3CCN(c4ccccn4)CC3)C2)cc1Cl ZINC000302965858 854699344 /nfs/dbraw/zinc/69/93/44/854699344.db2.gz AHKXBRXPYYIUNT-LJQANCHMSA-N 0 3 419.400 4.423 20 0 HIADHN Cc1nc(-c2ccsc2)ccc1C(=O)NCC1(N2CCSCC2)CCCC1 ZINC000303092360 854757224 /nfs/dbraw/zinc/75/72/24/854757224.db2.gz DNOUUTWOSFZRCA-UHFFFAOYSA-N 0 3 401.601 4.210 20 0 HIADHN C[C@H](Oc1ccccc1Cl)C(=O)N1CCCN(CCCc2ccccc2)CC1 ZINC000303104992 854763221 /nfs/dbraw/zinc/76/32/21/854763221.db2.gz IYZHJXNBWIANJQ-IBGZPJMESA-N 0 3 400.950 4.274 20 0 HIADHN Cc1ccc2c(CN3CCC[C@@H](CN(C)C(=O)OC(C)(C)C)C3)cc(=O)oc2c1C ZINC000303123983 854771992 /nfs/dbraw/zinc/77/19/92/854771992.db2.gz GLFQADXIGRZXMR-SFHVURJKSA-N 0 3 414.546 4.489 20 0 HIADHN COc1cccc([C@@H](CNC(=O)C[C@@H](C)Cc2ccccc2OC)N2CCCC2)c1 ZINC000303288905 854854402 /nfs/dbraw/zinc/85/44/02/854854402.db2.gz KHUGXUPCFULFDE-WMZHIEFXSA-N 0 3 410.558 4.226 20 0 HIADHN O=C(NC[C@@H](O)c1ccc2ccccc2c1)N[C@H](CN1CCCC1)c1ccccc1 ZINC000303345757 854884777 /nfs/dbraw/zinc/88/47/77/854884777.db2.gz DVJWVGSLNINTAA-DNQXCXABSA-N 0 3 403.526 4.010 20 0 HIADHN CCCOc1ccc(NC(=O)N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)c(C)c1 ZINC000303350508 854887006 /nfs/dbraw/zinc/88/70/06/854887006.db2.gz FTPPDGLEBDAZAB-KDURUIRLSA-N 0 3 403.567 4.137 20 0 HIADHN CCCOc1ccc(NC(=O)N2CCC(CN3C[C@@H](C)O[C@H](C)C3)CC2)c(C)c1 ZINC000303350510 854887211 /nfs/dbraw/zinc/88/72/11/854887211.db2.gz FTPPDGLEBDAZAB-RTBURBONSA-N 0 3 403.567 4.137 20 0 HIADHN CN(C)[C@H](CNC(=O)c1ccn(-c2ccc(Cl)c(Cl)c2)n1)c1ccccc1 ZINC000303354595 854888850 /nfs/dbraw/zinc/88/88/50/854888850.db2.gz ZDKAPRCYCOZWIS-LJQANCHMSA-N 0 3 403.313 4.212 20 0 HIADHN CCCO[C@@H]1CCCN([C@H](C)C(=O)N(C)Cc2ccc3cc(OC)ccc3c2)CC1 ZINC000303417198 854918524 /nfs/dbraw/zinc/91/85/24/854918524.db2.gz WXMAODYLBUOKED-AUSIDOKSSA-N 0 3 412.574 4.476 20 0 HIADHN C[C@H](CNC(=O)c1ccc(NC(=O)c2cccs2)cc1)N(C)Cc1ccccc1 ZINC000303457031 854957795 /nfs/dbraw/zinc/95/77/95/854957795.db2.gz KURZSBHJHINWGA-QGZVFWFLSA-N 0 3 407.539 4.251 20 0 HIADHN O=S(=O)(NC1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1)c1ccccc1C(F)(F)F ZINC000303494064 854982894 /nfs/dbraw/zinc/98/28/94/854982894.db2.gz SUAZCZDOPCBGIY-AYHJJNSGSA-N 0 3 424.488 4.179 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)Nc1ccc(F)cc1OCC(F)(F)F ZINC000303503257 854992227 /nfs/dbraw/zinc/99/22/27/854992227.db2.gz AWGOLNDUSGBELR-UHFFFAOYSA-N 0 3 413.415 4.363 20 0 HIADHN Cc1cccn2c(=O)cc(CN3CCC[C@H](c4nc5ccccc5n4C(C)C)C3)nc12 ZINC000303506764 854995146 /nfs/dbraw/zinc/99/51/46/854995146.db2.gz BLGZOHONZPONOL-IBGZPJMESA-N 0 3 415.541 4.313 20 0 HIADHN Cc1noc2nc(C)cc(C(=O)N(CCN3CCCC3)Cc3ccc(Cl)cc3)c12 ZINC000303529250 855016753 /nfs/dbraw/zinc/01/67/53/855016753.db2.gz RJHHFCVBYZULBL-UHFFFAOYSA-N 0 3 412.921 4.231 20 0 HIADHN C[C@@H](CNC(=O)C1(c2ccccc2Cl)CCOCC1)N(C)Cc1ccccc1 ZINC000303541576 855026953 /nfs/dbraw/zinc/02/69/53/855026953.db2.gz YOXBKQCKNVIUID-SFHVURJKSA-N 0 3 400.950 4.025 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)[C@@H]3C[C@@H]3c3cccc(C(F)(F)F)c3)CC2)C[C@@H](C)O1 ZINC000303541701 855027941 /nfs/dbraw/zinc/02/79/41/855027941.db2.gz UOSFIYPXGRQHLX-IMAQQZIHSA-N 0 3 424.507 4.157 20 0 HIADHN CCN(CC)[C@H](CNC(=O)[C@H]1C[C@@H]1c1ccc(F)cc1F)c1cccc(OC)c1 ZINC000303554799 855036910 /nfs/dbraw/zinc/03/69/10/855036910.db2.gz WDIJHVXPVFZFJE-RZUBCFFCSA-N 0 3 402.485 4.276 20 0 HIADHN COc1cc([C@@H](C)NC(=O)[C@H](C)N2CCCCCC2)ccc1OCc1ccncc1 ZINC000303568346 855044955 /nfs/dbraw/zinc/04/49/55/855044955.db2.gz OLZKFZFAMWJTOR-MOPGFXCFSA-N 0 3 411.546 4.111 20 0 HIADHN O=C(CCCc1nc(-c2ccc(F)cc2)no1)O[C@@H]1CCN(Cc2ccccc2)C1 ZINC000303637388 855093441 /nfs/dbraw/zinc/09/34/41/855093441.db2.gz AFHZHEUBJOHFJM-HXUWFJFHSA-N 0 3 409.461 4.016 20 0 HIADHN C[C@H](CC(=O)NCCCCN1CCN(Cc2ccccc2)CC1)c1cccc(F)c1 ZINC000303702363 855141046 /nfs/dbraw/zinc/14/10/46/855141046.db2.gz XLXYPSAMMQGZFU-OAQYLSRUSA-N 0 3 411.565 4.034 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)c2csc(Cc3ccccc3F)n2)c1 ZINC000303702650 855141893 /nfs/dbraw/zinc/14/18/93/855141893.db2.gz RVPRQUFZDPUVRP-UHFFFAOYSA-N 0 3 411.546 4.385 20 0 HIADHN CC(C)(CNC(=O)NCc1csc(-c2ccccc2)n1)N1CCc2ccccc2C1 ZINC000303714585 855147475 /nfs/dbraw/zinc/14/74/75/855147475.db2.gz QKMPYWBUJTXRMN-UHFFFAOYSA-N 0 3 420.582 4.446 20 0 HIADHN CC1CCN(c2cccc(NC(=O)NCC3(N4CCSCC4)CCCC3)c2)CC1 ZINC000303838874 855236565 /nfs/dbraw/zinc/23/65/65/855236565.db2.gz PXZGDOCIQPZYKD-UHFFFAOYSA-N 0 3 416.635 4.406 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2ccc(C(C)(C)C)cc2)cc1)[C@@H]1CCCN(C)C1 ZINC000303885451 855269683 /nfs/dbraw/zinc/26/96/83/855269683.db2.gz JTKMFTCAGNKCDO-JOCHJYFZSA-N 0 3 407.558 4.403 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)Cc1ccc(OC(F)(F)F)cc1 ZINC000303919374 855291191 /nfs/dbraw/zinc/29/11/91/855291191.db2.gz VOEMWKKFGDRLSN-KRWDZBQOSA-N 0 3 406.448 4.251 20 0 HIADHN Cc1c(C(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)cnn1-c1ccccc1F ZINC000303939734 855305812 /nfs/dbraw/zinc/30/58/12/855305812.db2.gz YJIATSYEPDNZRK-SFHVURJKSA-N 0 3 406.505 4.056 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2ccccc2C(F)(F)F)cc1)[C@@H]1CCCN(C)C1 ZINC000303953644 855317117 /nfs/dbraw/zinc/31/71/17/855317117.db2.gz UJXAWWWMKHIGJA-QGZVFWFLSA-N 0 3 419.447 4.124 20 0 HIADHN COc1ccc(Br)cc1CC(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000303959032 855321536 /nfs/dbraw/zinc/32/15/36/855321536.db2.gz MFEJIGJGTLLDGF-INIZCTEOSA-N 0 3 423.376 4.015 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)[C@@]2(C)CCCc3ccccc32)cc1)[C@H]1CCCN(C)C1 ZINC000303960707 855322295 /nfs/dbraw/zinc/32/22/95/855322295.db2.gz WNHCGRDEVADICF-NVQXNPDNSA-N 0 3 419.569 4.086 20 0 HIADHN CC(C)(C)OC(=O)N[C@@H](CNCc1cnn(Cc2ccccc2)c1)c1ccccc1 ZINC000378925682 855424218 /nfs/dbraw/zinc/42/42/18/855424218.db2.gz SQCZMPJRRNLVQF-QFIPXVFZSA-N 0 3 406.530 4.287 20 0 HIADHN COc1ccc(Br)c(C(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)c1 ZINC000383019528 855434852 /nfs/dbraw/zinc/43/48/52/855434852.db2.gz NWPKVYWWYABDRQ-INIZCTEOSA-N 0 3 417.347 4.194 20 0 HIADHN COc1ccc(Br)cc1C(=O)N1CCCN(Cc2ccccc2)C[C@H]1C ZINC000383043537 855435785 /nfs/dbraw/zinc/43/57/85/855435785.db2.gz DNVHKFFBGNNKPZ-MRXNPFEDSA-N 0 3 417.347 4.194 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc2c(c1)OCCO2)c1ccc(I)cc1 ZINC000386057067 855441737 /nfs/dbraw/zinc/44/17/37/855441737.db2.gz GTKGMASSHIDAPZ-CHWSQXEVSA-N 0 3 409.267 4.474 20 0 HIADHN CN(CCNC(=O)c1cc(C(F)(F)F)ccc1Br)Cc1ccccc1 ZINC000386698618 855443934 /nfs/dbraw/zinc/44/39/34/855443934.db2.gz UHMHCVHYDUVZKH-UHFFFAOYSA-N 0 3 415.253 4.330 20 0 HIADHN COc1cc(Br)ccc1C(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000388600346 855448147 /nfs/dbraw/zinc/44/81/47/855448147.db2.gz VMQMCJJNOWEUMU-SFHVURJKSA-N 0 3 417.347 4.194 20 0 HIADHN CN(C(=O)c1ccc(Br)c(F)c1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000388857678 855448966 /nfs/dbraw/zinc/44/89/66/855448966.db2.gz OVZZPVRCSJFJHV-KRWDZBQOSA-N 0 3 405.311 4.325 20 0 HIADHN CN(C(=O)c1ccc(F)c(Br)c1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000388898856 855449012 /nfs/dbraw/zinc/44/90/12/855449012.db2.gz SGRYTJXKBCEEOU-KRWDZBQOSA-N 0 3 405.311 4.325 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1cc(Cl)cc(Br)c1 ZINC000389850516 855452397 /nfs/dbraw/zinc/45/23/97/855452397.db2.gz URKRFMUNIBXRTG-SCLBCKFNSA-N 0 3 407.739 4.353 20 0 HIADHN C[C@@H](NC[C@H]1CN(Cc2ccccc2)CCCO1)c1sccc1Br ZINC000390846078 855457430 /nfs/dbraw/zinc/45/74/30/855457430.db2.gz FLHILXJUUCWOQJ-WBVHZDCISA-N 0 3 409.393 4.452 20 0 HIADHN C[C@@]1(CNC(=O)c2cc(Cl)ncc2Br)CCCN1Cc1ccccc1 ZINC000397976950 855474063 /nfs/dbraw/zinc/47/40/63/855474063.db2.gz KUSZGPLOLQXRCR-IBGZPJMESA-N 0 3 422.754 4.282 20 0 HIADHN CN(C)Cc1ccccc1CNC(=O)[C@H]1C[C@@]12CCc1cc(Br)ccc12 ZINC000409479598 855502209 /nfs/dbraw/zinc/50/22/09/855502209.db2.gz MNYZXBYZBNAZLN-IFMALSPDSA-N 0 3 413.359 4.031 20 0 HIADHN Cc1ccccc1C1(C(=O)NC2CCN(CCOc3ccc(F)cc3)CC2)CCC1 ZINC000409572406 855545680 /nfs/dbraw/zinc/54/56/80/855545680.db2.gz ZAAKMVMMHNHPOF-UHFFFAOYSA-N 0 3 410.533 4.215 20 0 HIADHN CC(C)(Cc1nc2ccccc2[nH]1)C(=O)NC[C@@H]1CCCCN1Cc1ccccc1 ZINC000409594410 855557385 /nfs/dbraw/zinc/55/73/85/855557385.db2.gz BRHXCNYAUGWFRE-FQEVSTJZSA-N 0 3 404.558 4.303 20 0 HIADHN CSc1ccccc1[C@@H](C)NC(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000409630097 855572623 /nfs/dbraw/zinc/57/26/23/855572623.db2.gz KCXXIBSNJYMZFR-QUCCMNQESA-N 0 3 413.587 4.060 20 0 HIADHN C[C@@H](CNC(=O)[C@@H]1CCO[C@H]1c1ccc(Cl)c(F)c1)N(C)Cc1ccccc1 ZINC000409680571 855599282 /nfs/dbraw/zinc/59/92/82/855599282.db2.gz XBHPDCBRXBNZBJ-KLHJMIIUSA-N 0 3 404.913 4.193 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)CC2CC(c3ccccc3)C2)cc1)[C@@H]1CCCN(C)C1 ZINC000409738241 855628860 /nfs/dbraw/zinc/62/88/60/855628860.db2.gz DYFKZFPFTSYSGV-MXJXRJBTSA-N 0 3 419.569 4.375 20 0 HIADHN Cc1ccc(Cl)cc1NC(=O)NCCCCN1CCN(Cc2ccccc2)CC1 ZINC000409751785 855635870 /nfs/dbraw/zinc/63/58/70/855635870.db2.gz NOYULUUJQKVHPE-UHFFFAOYSA-N 0 3 414.981 4.368 20 0 HIADHN CCN(C(=O)c1ccc2c(c1)nc(C(F)F)n2C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000409939078 855735132 /nfs/dbraw/zinc/73/51/32/855735132.db2.gz VBIZGRQPEBZJNK-GOSISDBHSA-N 0 3 412.484 4.248 20 0 HIADHN O=C(N[C@H]1C[C@@H]1c1ccccc1OC(F)F)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000437389616 862714177 /nfs/dbraw/zinc/71/41/77/862714177.db2.gz DXJFUPDATXBDSG-DBVUQKKJSA-N 0 3 418.459 4.311 20 0 HIADHN Cc1cc(NC(=O)[C@H]2CCCC(F)(F)C2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000409980708 855759781 /nfs/dbraw/zinc/75/97/81/855759781.db2.gz PWCMROHAWOCBPG-OALUTQOASA-N 0 3 402.489 4.403 20 0 HIADHN CCCc1noc2nc(CC)cc(C(=O)N(C)[C@H]3CCN(Cc4ccccc4)C3)c12 ZINC000410005634 855774987 /nfs/dbraw/zinc/77/49/87/855774987.db2.gz SSDVGYRNYDEXOL-IBGZPJMESA-N 0 3 406.530 4.084 20 0 HIADHN CC(C)n1ncc2cc(C(=O)N[C@H](CN3CCc4ccccc4C3)C(C)(C)C)cnc21 ZINC000410052842 855802468 /nfs/dbraw/zinc/80/24/68/855802468.db2.gz KNHDTFYOSNIFHL-JOCHJYFZSA-N 0 3 419.573 4.215 20 0 HIADHN CC1CCN([C@@H](CNC(=O)N[C@H]2CCCC23CCOCC3)c2cccs2)CC1 ZINC000410091245 855814483 /nfs/dbraw/zinc/81/44/83/855814483.db2.gz YTDDCQJLHHQWEE-ICSRJNTNSA-N 0 3 405.608 4.170 20 0 HIADHN C[C@H](c1cc2ccccc2o1)N(C)C(=O)NCc1ccc(CN2CCN(C)CC2)cc1 ZINC000410368088 855955160 /nfs/dbraw/zinc/95/51/60/855955160.db2.gz SUFUBAPGNJOYRU-LJQANCHMSA-N 0 3 420.557 4.083 20 0 HIADHN CC[C@@H](CSc1ccc(C)c(C)c1)NC(=O)N1CCN(C2CCOCC2)C[C@H]1C ZINC000425914006 855996007 /nfs/dbraw/zinc/99/60/07/855996007.db2.gz DRCYCOQBHDOIIG-UXHICEINSA-N 0 3 419.635 4.069 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000426021582 856051650 /nfs/dbraw/zinc/05/16/50/856051650.db2.gz OGHRNNIHHWYBLR-IYBDPMFKSA-N 0 3 409.958 4.092 20 0 HIADHN Cc1cccc2nc(CCC(=O)N3CCN(Cc4cccc5ccccc54)CC3)[nH]c21 ZINC000426048821 856072734 /nfs/dbraw/zinc/07/27/34/856072734.db2.gz VMZBWGHGTNLNGE-UHFFFAOYSA-N 0 3 412.537 4.302 20 0 HIADHN CCCn1ccc2cc(NC(=O)N[C@H]3CCN(Cc4ccccc4)C[C@H]3CO)ccc21 ZINC000426106580 856111677 /nfs/dbraw/zinc/11/16/77/856111677.db2.gz PBEPPMDWLUVWQG-GMAHTHKFSA-N 0 3 420.557 4.056 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3ccc(OC)c4ncccc34)c(C)c2)CC1 ZINC000426109182 856113556 /nfs/dbraw/zinc/11/35/56/856113556.db2.gz AQYHCSYLUOQLBC-UHFFFAOYSA-N 0 3 419.529 4.338 20 0 HIADHN O=C(Nc1c[nH]nc1[C@@H]1CCCN(Cc2scnc2C2CC2)C1)c1ccccc1 ZINC000426144243 856138140 /nfs/dbraw/zinc/13/81/40/856138140.db2.gz CNPSXHBUGLNZFH-QGZVFWFLSA-N 0 3 407.543 4.376 20 0 HIADHN CCCN(CCN1CCN(CC)CC1)C(=O)c1ccccc1Sc1ccccc1 ZINC000426147382 856140119 /nfs/dbraw/zinc/14/01/19/856140119.db2.gz BCOJSCBSSBUISR-UHFFFAOYSA-N 0 3 411.615 4.328 20 0 HIADHN CC(C)c1nnc(CCN[C@H](C)c2ccc(S(=O)(=O)C3CCCC3)cc2)s1 ZINC000426287903 856223126 /nfs/dbraw/zinc/22/31/26/856223126.db2.gz HHKSTXUFTWIGIX-OAHLLOKOSA-N 0 3 407.605 4.271 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N[C@H]2c3ccccc3CC[C@@H]2n2ccnc2)N(C)C)cc1 ZINC000426304541 856234109 /nfs/dbraw/zinc/23/41/09/856234109.db2.gz CWACNSFDVCYYPR-HJOGWXRNSA-N 0 3 417.557 4.022 20 0 HIADHN CN(C)CC1(C(=O)Nc2cccc(CS(=O)(=O)c3ccccc3)c2)CCCCC1 ZINC000426313345 856240150 /nfs/dbraw/zinc/24/01/50/856240150.db2.gz MSWLHAIKZLOFGE-UHFFFAOYSA-N 0 3 414.571 4.111 20 0 HIADHN C[C@@H](N[C@H]1c2cccc(Br)c2CC1(C)C)c1ccc(S(N)(=O)=O)cc1 ZINC000426323425 856245257 /nfs/dbraw/zinc/24/52/57/856245257.db2.gz NBVACIGJFYFSMI-XIKOKIGWSA-N 0 3 423.376 4.071 20 0 HIADHN Cc1cc(CNC2CC(c3ccc(Br)cc3)C2)nc(N2CCCC2)n1 ZINC000426333947 856250906 /nfs/dbraw/zinc/25/09/06/856250906.db2.gz VXKJDHLJUWMWFW-UHFFFAOYSA-N 0 3 401.352 4.184 20 0 HIADHN COc1cc(CN(C)C[C@@H](O)COc2ccc(Oc3ccccc3)cc2)ccc1O ZINC000426418192 856281540 /nfs/dbraw/zinc/28/15/40/856281540.db2.gz FMIPEBVYEGPQEJ-LJQANCHMSA-N 0 3 409.482 4.065 20 0 HIADHN CCc1ccc(NC(=O)Cc2noc([C@@H]3CN(C(C)(C)C)C[C@H]3C(F)(F)F)n2)cc1 ZINC000426440550 856291432 /nfs/dbraw/zinc/29/14/32/856291432.db2.gz QPTZAYXLTFURIK-HZPDHXFCSA-N 0 3 424.467 4.189 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)N[C@@H]1CCOC2(CCCCC2)C1 ZINC000426501965 856322170 /nfs/dbraw/zinc/32/21/70/856322170.db2.gz WDGOLIMXHJXEEW-JOCHJYFZSA-N 0 3 401.595 4.074 20 0 HIADHN CC(C)COc1ccc(NC(=O)C(=O)Nc2cccc(CN(C)C)c2)cc1Cl ZINC000437418507 862790333 /nfs/dbraw/zinc/79/03/33/862790333.db2.gz MYZMQEWQVHARLK-UHFFFAOYSA-N 0 3 403.910 4.014 20 0 HIADHN C[C@H](NC(=O)N(CCN(C)C)Cc1cccc(F)c1)c1nc(C(F)(F)F)cs1 ZINC000426656602 856397102 /nfs/dbraw/zinc/39/71/02/856397102.db2.gz IZXZYRXNGGSYHP-LBPRGKRZSA-N 0 3 418.460 4.135 20 0 HIADHN C[C@@H](CSc1ccc(F)cc1)C(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000426656072 856397597 /nfs/dbraw/zinc/39/75/97/856397597.db2.gz WHIIPRKPPUSBCW-GBESFXJTSA-N 0 3 422.610 4.292 20 0 HIADHN CCOc1ccc(C(=O)N2CCCCC2)cc1NC(=O)Nc1cccc(CN(C)C)c1 ZINC000426662956 856400661 /nfs/dbraw/zinc/40/06/61/856400661.db2.gz YWYAJUBDEABMIR-UHFFFAOYSA-N 0 3 424.545 4.417 20 0 HIADHN CN(C)Cc1cccc(NC(=O)C(=O)N(Cc2ccccc2)Cc2ccc(F)cc2)c1 ZINC000437425858 862801293 /nfs/dbraw/zinc/80/12/93/862801293.db2.gz HOXXXXLXFDPUGK-UHFFFAOYSA-N 0 3 419.500 4.055 20 0 HIADHN COc1ccc2ccccc2c1-c1cc(CN2CCC(Cn3cncn3)CC2)on1 ZINC000426743734 856448500 /nfs/dbraw/zinc/44/85/00/856448500.db2.gz VFHIKLBYQRVOMZ-UHFFFAOYSA-N 0 3 403.486 4.007 20 0 HIADHN Cc1cc(C)c(NC(=O)CN2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)c(Cl)c1 ZINC000426777841 856473070 /nfs/dbraw/zinc/47/30/70/856473070.db2.gz RBKJNUGDUYPNMS-OALUTQOASA-N 0 3 422.013 4.107 20 0 HIADHN Cc1ccc(NC(=O)[C@@H](C)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)c(Cl)c1 ZINC000426789987 856479287 /nfs/dbraw/zinc/47/92/87/856479287.db2.gz ZJYMYRPGNQZVDD-CEXWTWQISA-N 0 3 422.013 4.187 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)NCc1nc(-c2ccccc2F)cs1 ZINC000426895950 856530845 /nfs/dbraw/zinc/53/08/45/856530845.db2.gz KCQWRHBJPNOFDM-UHFFFAOYSA-N 0 3 412.534 4.223 20 0 HIADHN C[C@@H](C(=O)Nc1ccc(C(=O)N(C)[C@@H]2CCCN(C)C2)cc1)c1ccc(Cl)s1 ZINC000426947407 856556959 /nfs/dbraw/zinc/55/69/59/856556959.db2.gz DYIVKKROXCDRMW-RHSMWYFYSA-N 0 3 419.978 4.310 20 0 HIADHN CCc1oc(C(=O)OC)cc1CN1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1 ZINC000427013508 856595634 /nfs/dbraw/zinc/59/56/34/856595634.db2.gz DAAGGQPMXUBPLH-OAHLLOKOSA-N 0 3 413.449 4.197 20 0 HIADHN CCc1c(C(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)cnn1CCC(C)C ZINC000427025123 856601158 /nfs/dbraw/zinc/60/11/58/856601158.db2.gz ZXLZEJIBQSMPFQ-UHFFFAOYSA-N 0 3 411.594 4.274 20 0 HIADHN CN(C)CCN(Cc1cccc(O)c1)C(=O)c1cc2ccccc2n1CC(F)(F)F ZINC000427061766 856616053 /nfs/dbraw/zinc/61/60/53/856616053.db2.gz NOGSCWDZKXDVBI-UHFFFAOYSA-N 0 3 419.447 4.113 20 0 HIADHN CCOC(=O)c1cc2cc(C(=O)N3CC[C@@H](C)N(Cc4ccccc4)CC3)ccc2[nH]1 ZINC000437459363 862822377 /nfs/dbraw/zinc/82/23/77/862822377.db2.gz CSKBXLKLUONDLT-GOSISDBHSA-N 0 3 419.525 4.081 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)c1c[nH]nc1-c1ccc(Cl)s1 ZINC000427165847 856685002 /nfs/dbraw/zinc/68/50/02/856685002.db2.gz XSJHLTVQUAMBOR-UHFFFAOYSA-N 0 3 416.934 4.001 20 0 HIADHN O=C(N[C@@H]1CCOC2(CCCC2)C1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000427274742 856746788 /nfs/dbraw/zinc/74/67/88/856746788.db2.gz NEQHSBICXBGLPJ-NQIIRXRSSA-N 0 3 410.480 4.049 20 0 HIADHN Cc1ccc(S[C@H](C)C(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)cc1 ZINC000427286475 856751125 /nfs/dbraw/zinc/75/11/25/856751125.db2.gz GADGKTDOXFFABA-SLFFLAALSA-N 0 3 404.620 4.214 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)C3(c4cccc(Cl)c4)CC3)CC2)C[C@@H](C)O1 ZINC000427286536 856751303 /nfs/dbraw/zinc/75/13/03/856751303.db2.gz GHICCURAIYBKBV-QZTJIDSGSA-N 0 3 404.982 4.110 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Cc3ccc(Cl)c(Cl)c3)CC2)C[C@@H](C)O1 ZINC000427285950 856751425 /nfs/dbraw/zinc/75/14/25/856751425.db2.gz BAYWFWQWZWCOHA-HZPDHXFCSA-N 0 3 413.389 4.274 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3csc(-c4cccs4)n3)CC2)C[C@H](C)O1 ZINC000427287775 856752726 /nfs/dbraw/zinc/75/27/26/856752726.db2.gz MIVNUYDKEJHYHH-IYBDPMFKSA-N 0 3 419.616 4.223 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3cnc(-c4ccsc4)s3)CC2)C[C@H](C)O1 ZINC000427291852 856755551 /nfs/dbraw/zinc/75/55/51/856755551.db2.gz KLFLIHNXRYAZLD-IYBDPMFKSA-N 0 3 419.616 4.223 20 0 HIADHN Cc1cc(C(=O)CCC(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)c(C)s1 ZINC000427291387 856755605 /nfs/dbraw/zinc/75/56/05/856755605.db2.gz FUGJCUULRYYNRW-IAGOWNOFSA-N 0 3 420.619 4.066 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3ccc(Oc4ccccc4)o3)CC2)C[C@H](C)O1 ZINC000427297893 856758667 /nfs/dbraw/zinc/75/86/67/856758667.db2.gz XPZGQHSRBRWSTB-KDURUIRLSA-N 0 3 412.530 4.423 20 0 HIADHN Cc1c(C(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)sc2nccc(C)c12 ZINC000427304271 856760803 /nfs/dbraw/zinc/76/08/03/856760803.db2.gz ISZQPDZDQYMJEN-CALCHBBNSA-N 0 3 415.603 4.265 20 0 HIADHN Cc1ccc(C(=O)CCC(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)cc1C ZINC000427303904 856761115 /nfs/dbraw/zinc/76/11/15/856761115.db2.gz FHKVPKLBGGWTCW-SFTDATJTSA-N 0 3 414.590 4.004 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3cc(Cl)cc4cccnc43)CC2)C[C@H](C)O1 ZINC000427322939 856771526 /nfs/dbraw/zinc/77/15/26/856771526.db2.gz VKSOBOLEIYTUMU-CALCHBBNSA-N 0 3 415.965 4.240 20 0 HIADHN CSCc1cc(C(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)ccc1F ZINC000427322958 856771639 /nfs/dbraw/zinc/77/16/39/856771639.db2.gz VZMWJOWIARRHHP-CALCHBBNSA-N 0 3 408.583 4.040 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3c[nH]cc3-c3ccc(F)cc3)CC2)C[C@H](C)O1 ZINC000427342131 856781804 /nfs/dbraw/zinc/78/18/04/856781804.db2.gz LKQPBAZDAISFHG-HDICACEKSA-N 0 3 413.537 4.172 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)Cc3csc4ccccc34)CC2)C[C@H](C)O1 ZINC000427360247 856792546 /nfs/dbraw/zinc/79/25/46/856792546.db2.gz YPAJFYUGOVEYIE-ROUUACIJSA-N 0 3 400.588 4.182 20 0 HIADHN O=C(Cc1csc(Cc2cccc(Cl)c2)n1)NC[C@@H]1CCCCN1C1CC1 ZINC000427445234 856823283 /nfs/dbraw/zinc/82/32/83/856823283.db2.gz ZFPSRDWMSNFLHI-IBGZPJMESA-N 0 3 403.979 4.063 20 0 HIADHN C[C@]1(CNC(=O)C(=O)Nc2csc3ccccc23)CCCN1Cc1ccccc1 ZINC000427492935 856840229 /nfs/dbraw/zinc/84/02/29/856840229.db2.gz OJKBUHJTXVVROL-HSZRJFAPSA-N 0 3 407.539 4.011 20 0 HIADHN COc1ccccc1N1CC[C@H](CN[C@@H](C)c2ncc(Br)cc2F)C1 ZINC000427686481 856908844 /nfs/dbraw/zinc/90/88/44/856908844.db2.gz RGKXFNBQBJLQMX-UONOGXRCSA-N 0 3 408.315 4.169 20 0 HIADHN O=C1C[C@H](N[C@@H]2CCCc3ncc(C(F)(F)F)cc32)CN1[C@@H]1C[C@@H]1c1ccccc1 ZINC000427711168 856919055 /nfs/dbraw/zinc/91/90/55/856919055.db2.gz RSFLJLJUBAOZJS-XWDORNJCSA-N 0 3 415.459 4.224 20 0 HIADHN NC(=O)[C@@H](Cc1ccccc1)NC[C@H](OCc1ccccc1)c1ccc(Cl)cc1 ZINC000427816346 856967469 /nfs/dbraw/zinc/96/74/69/856967469.db2.gz ICVXCKAAARSERE-PKTZIBPZSA-N 0 3 408.929 4.284 20 0 HIADHN Fc1ccccc1[C@@H](N[C@@H]1CCn2ccnc2C1)c1ccc(Br)cc1 ZINC000427865889 856986752 /nfs/dbraw/zinc/98/67/52/856986752.db2.gz OGZGOKWSAKKHDP-UZLBHIALSA-N 0 3 400.295 4.479 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)CCCC(=O)c3cccc(OC)c3)c(C)c2)CC1 ZINC000427994521 857035260 /nfs/dbraw/zinc/03/52/60/857035260.db2.gz HPRPFGOFONMVIU-UHFFFAOYSA-N 0 3 423.557 4.137 20 0 HIADHN Cc1ccc(Br)cc1-c1nnc(N2CCC[C@H]3CN(C)CC[C@H]32)s1 ZINC000428170500 857095641 /nfs/dbraw/zinc/09/56/41/857095641.db2.gz IWHNGELGCUSTPP-XJKSGUPXSA-N 0 3 407.381 4.197 20 0 HIADHN Cc1nc([C@@H]2CCCOC2)sc1C(=O)NC[C@@H]1CCCN(Cc2cccs2)C1 ZINC000428200844 857108874 /nfs/dbraw/zinc/10/88/74/857108874.db2.gz QIVOXSHFNOINOF-DLBZAZTESA-N 0 3 419.616 4.049 20 0 HIADHN Cc1nc([C@H]2CCCOC2)sc1C(=O)NC[C@H]1CCCN(Cc2cccs2)C1 ZINC000428200847 857109022 /nfs/dbraw/zinc/10/90/22/857109022.db2.gz QIVOXSHFNOINOF-SJORKVTESA-N 0 3 419.616 4.049 20 0 HIADHN COc1cc(CN2CC[C@H](O)[C@@H](C)C2)ccc1OCCOc1ccccc1Cl ZINC000428454644 857207279 /nfs/dbraw/zinc/20/72/79/857207279.db2.gz DEVOBHDQFYIRQI-LPHOPBHVSA-N 0 3 405.922 4.009 20 0 HIADHN C[C@@H](c1cccc(N2CCCS2(=O)=O)c1)N(C)Cc1cc2cc(F)ccc2o1 ZINC000428486986 857222435 /nfs/dbraw/zinc/22/24/35/857222435.db2.gz SCQGCCBUTGHXCC-HNNXBMFYSA-N 0 3 402.491 4.305 20 0 HIADHN O=C(N[C@H]1CCCN(Cc2ccccc2)C1)N1CCC(c2ncccc2Cl)CC1 ZINC000428489467 857224481 /nfs/dbraw/zinc/22/44/81/857224481.db2.gz XCBZJXJEIBGBJB-FQEVSTJZSA-N 0 3 412.965 4.289 20 0 HIADHN CCCOc1cccnc1C(=O)Nc1cc(C)nn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000428519726 857238055 /nfs/dbraw/zinc/23/80/55/857238055.db2.gz PWSPFZZXHJQQEZ-HXUWFJFHSA-N 0 3 419.529 4.075 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@@H](O)C2)c1)C12C[C@H]3C[C@@H](C1)CC(C(F)(F)F)(C3)C2 ZINC000428531204 857243816 /nfs/dbraw/zinc/24/38/16/857243816.db2.gz FHIQAZUYEJOUOM-HYXNDKIJSA-N 0 3 422.491 4.341 20 0 HIADHN CC(C)Cn1ncc(C(=O)Nc2cccc(CN3CC[C@@H](O)C3)c2)c1-c1ccccc1 ZINC000428539852 857250525 /nfs/dbraw/zinc/25/05/25/857250525.db2.gz QQEZWCAJIFMSHS-JOCHJYFZSA-N 0 3 418.541 4.025 20 0 HIADHN CCCCOc1ccc(C(=O)Nc2cccc(CN3CC[C@H](O)C3)c2)c(Cl)c1 ZINC000428538131 857250914 /nfs/dbraw/zinc/25/09/14/857250914.db2.gz PPOSAEBAZVHODP-SFHVURJKSA-N 0 3 402.922 4.338 20 0 HIADHN Cc1nc(-c2ccccc2C)sc1C(=O)Nc1cccc(CN2CC[C@H](O)C2)c1 ZINC000428541864 857253316 /nfs/dbraw/zinc/25/33/16/857253316.db2.gz QBRNRRPZZGRWHS-IBGZPJMESA-N 0 3 407.539 4.246 20 0 HIADHN CC(C)(C)n1ncc(C(=O)Nc2cccc(CN3CC[C@H](O)C3)c2)c1-c1ccccc1 ZINC000428546976 857258116 /nfs/dbraw/zinc/25/81/16/857258116.db2.gz NXHCLCNQKBAVFY-NRFANRHFSA-N 0 3 418.541 4.124 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)[C@@H](Oc1ccccc1)c1ccccc1 ZINC000428550286 857260432 /nfs/dbraw/zinc/26/04/32/857260432.db2.gz QRARRKOCCPFQMF-UPVQGACJSA-N 0 3 402.494 4.012 20 0 HIADHN C[C@H](Oc1ccc(Cl)c2ccccc12)C(=O)Nc1cccc(CN2CC[C@@H](O)C2)c1 ZINC000428552169 857261433 /nfs/dbraw/zinc/26/14/33/857261433.db2.gz VAVKVHAWFHSZOT-QFBILLFUSA-N 0 3 424.928 4.466 20 0 HIADHN CC[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)Nc1cccc(CN2CC[C@H](O)C2)c1 ZINC000428555203 857264343 /nfs/dbraw/zinc/26/43/43/857264343.db2.gz XKQLIBZHLLBFNM-RXVVDRJESA-N 0 3 420.475 4.479 20 0 HIADHN COc1cccc(CNC[C@@H]2CSCCN2Cc2ccccc2)c1OC(F)F ZINC000428557274 857265362 /nfs/dbraw/zinc/26/53/62/857265362.db2.gz CAKGLQKEWFJDBO-GOSISDBHSA-N 0 3 408.514 4.004 20 0 HIADHN O=C(Nc1ccc(Cc2nc3ccccc3s2)cc1)N1CC[C@H](N2CC=CC2)C1 ZINC000437570584 862891697 /nfs/dbraw/zinc/89/16/97/862891697.db2.gz UBWZYYOJAHRFSU-IBGZPJMESA-N 0 3 404.539 4.365 20 0 HIADHN CC[C@@H](NC(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1)c1ccc(F)cc1F ZINC000428633650 857283957 /nfs/dbraw/zinc/28/39/57/857283957.db2.gz PXOZABSHSIOKBM-SIKLNZKXSA-N 0 3 417.500 4.006 20 0 HIADHN COc1cc(NC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)c(OC)cc1Cl ZINC000437574400 862893931 /nfs/dbraw/zinc/89/39/31/862893931.db2.gz FHUQFWNDZRUBKV-MRXNPFEDSA-N 0 3 417.937 4.486 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)N1CCC(c2ncccc2Cl)CC1 ZINC000428696976 857300388 /nfs/dbraw/zinc/30/03/88/857300388.db2.gz XHLPKFHPMPMYAF-NRFANRHFSA-N 0 3 412.965 4.461 20 0 HIADHN COC(=O)[C@@H]1CCO[C@H]1C1CCN([C@@H]2CCCc3ccc(Br)cc32)CC1 ZINC000428730042 857311987 /nfs/dbraw/zinc/31/19/87/857311987.db2.gz IVAVGDIQVHWOAT-RLLQIKCJSA-N 0 3 422.363 4.117 20 0 HIADHN CCOC(=O)Cn1nc(C)c(CN2CCC(c3nc4ccccc4s3)CC2)c1C ZINC000437584357 862899173 /nfs/dbraw/zinc/89/91/73/862899173.db2.gz ZWFNVABKHANNMZ-UHFFFAOYSA-N 0 3 412.559 4.052 20 0 HIADHN COc1cc(CN(Cc2ccncc2)[C@@H]2CCCN(Cc3ccccc3)C2)ccn1 ZINC000428797561 857347055 /nfs/dbraw/zinc/34/70/55/857347055.db2.gz DMCBAKVZDGLGEA-XMMPIXPASA-N 0 3 402.542 4.152 20 0 HIADHN C[C@H](NC(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1)c1c(F)cccc1Cl ZINC000428818204 857358855 /nfs/dbraw/zinc/35/88/55/857358855.db2.gz MKGZUYGECXLBMG-WMZOPIPTSA-N 0 3 419.928 4.130 20 0 HIADHN C[C@H](NC(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1)c1c(F)cccc1Cl ZINC000428818200 857359049 /nfs/dbraw/zinc/35/90/49/857359049.db2.gz MKGZUYGECXLBMG-FUHWJXTLSA-N 0 3 419.928 4.130 20 0 HIADHN CCOc1ccccc1[C@@H](C)NC(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000428835498 857366107 /nfs/dbraw/zinc/36/61/07/857366107.db2.gz YSXJKUCJDDSQSA-HSALFYBXSA-N 0 3 417.594 4.067 20 0 HIADHN O=C(NCCNCc1ccc(C(F)(F)F)s1)c1ccc(Br)cc1 ZINC000428860039 857375150 /nfs/dbraw/zinc/37/51/50/857375150.db2.gz FCXHGDHTVGBVAT-UHFFFAOYSA-N 0 3 407.255 4.049 20 0 HIADHN C[C@H](c1ccccc1)[C@@H](NCc1c(-c2ccc(Cl)cc2)nc2sccn21)C(N)=O ZINC000428866333 857378854 /nfs/dbraw/zinc/37/88/54/857378854.db2.gz YLVIDKZOTISZAO-AUUYWEPGSA-N 0 3 424.957 4.463 20 0 HIADHN CC(C)N(CC(=O)N1CCC(C(=O)Nc2ccccc2)CC1)[C@@H](C)c1ccccc1 ZINC000428868895 857380147 /nfs/dbraw/zinc/38/01/47/857380147.db2.gz SROIFMYRJRCICW-FQEVSTJZSA-N 0 3 407.558 4.335 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)Nc3cc(Cl)ccc3N(C)C)CC2)C[C@H](C)O1 ZINC000428897282 857398456 /nfs/dbraw/zinc/39/84/56/857398456.db2.gz FYKQDNHJIPCKIV-IRXDYDNUSA-N 0 3 423.001 4.149 20 0 HIADHN CCn1cnnc1-c1ccccc1NC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C ZINC000428898046 857398710 /nfs/dbraw/zinc/39/87/10/857398710.db2.gz UDTISHHSLGZFDZ-IBGZPJMESA-N 0 3 418.545 4.093 20 0 HIADHN C[C@@H](CN(C)Cc1ccccc1)NC(=O)N1CCC(c2ncccc2Cl)CC1 ZINC000428958024 857434808 /nfs/dbraw/zinc/43/48/08/857434808.db2.gz BKWAVPMCBXXFCJ-KRWDZBQOSA-N 0 3 400.954 4.145 20 0 HIADHN Cc1ccc(S(=O)(=O)NC[C@@H]2CCCN(Cc3ccc4nc(C)ccc4c3)C2)cc1 ZINC000437601337 862914166 /nfs/dbraw/zinc/91/41/66/862914166.db2.gz LDYSZRSVEFOAAJ-NRFANRHFSA-N 0 3 423.582 4.042 20 0 HIADHN CCN(C(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1)[C@@H](C)c1ccc(F)cc1 ZINC000429039843 857470193 /nfs/dbraw/zinc/47/01/93/857470193.db2.gz GCKPOEBJMRBULO-CVDCTZTESA-N 0 3 413.537 4.209 20 0 HIADHN CCCOc1ccc(NC(=O)NC[C@H]2CN(Cc3ccccc3)CCCO2)c(C)c1 ZINC000429044138 857473448 /nfs/dbraw/zinc/47/34/48/857473448.db2.gz QFXPTJUNSYJTSU-QFIPXVFZSA-N 0 3 411.546 4.196 20 0 HIADHN CCO[C@H]1C[C@H](O)C12CCN(Cc1cccc3c(Br)cccc13)CC2 ZINC000429046824 857474760 /nfs/dbraw/zinc/47/47/60/857474760.db2.gz JIPUSBSPBLWBRS-PMACEKPBSA-N 0 3 404.348 4.354 20 0 HIADHN CC(C)OCc1ccc(NC(=O)NC[C@H]2CN(Cc3ccccc3)CCCO2)cc1 ZINC000429056765 857482748 /nfs/dbraw/zinc/48/27/48/857482748.db2.gz ZADDIEGHJAJAFC-QHCPKHFHSA-N 0 3 411.546 4.024 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3cccc(OC(F)F)c3)CC2)C[C@H](C)O1 ZINC000429102581 857509755 /nfs/dbraw/zinc/50/97/55/857509755.db2.gz AJPQMPQKCPNZIN-IYBDPMFKSA-N 0 3 411.493 4.031 20 0 HIADHN CCOc1ccccc1Oc1ccc(CNC(=O)NC[C@@H]2CCCCN2C2CC2)cn1 ZINC000429104800 857510964 /nfs/dbraw/zinc/51/09/64/857510964.db2.gz RPKSZOOAZPDZOX-FQEVSTJZSA-N 0 3 424.545 4.089 20 0 HIADHN CC(C)Oc1ccccc1NC(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000429106764 857512132 /nfs/dbraw/zinc/51/21/32/857512132.db2.gz MVKRLSRPQGUIJT-KDURUIRLSA-N 0 3 403.567 4.217 20 0 HIADHN CC(C)Oc1ccccc1NC(=O)N1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000429106766 857512312 /nfs/dbraw/zinc/51/23/12/857512312.db2.gz MVKRLSRPQGUIJT-OALUTQOASA-N 0 3 403.567 4.217 20 0 HIADHN C[C@H](NCC[S@@](=O)c1cc(Cl)ccc1Cl)[C@@H]1OCCc2sccc21 ZINC000429168789 857539153 /nfs/dbraw/zinc/53/91/53/857539153.db2.gz QUZPPTZKOCXELJ-PIEXMASVSA-N 0 3 404.384 4.455 20 0 HIADHN C[C@H](NCC[S@](=O)c1cc(Cl)ccc1Cl)[C@H]1OCCc2sccc21 ZINC000429168787 857539536 /nfs/dbraw/zinc/53/95/36/857539536.db2.gz QUZPPTZKOCXELJ-BQFWXCIGSA-N 0 3 404.384 4.455 20 0 HIADHN CCCn1ccnc1CCCN(C)CC(=O)N[C@@H](C)c1ccc(Cl)c(Cl)c1 ZINC000429237356 857568206 /nfs/dbraw/zinc/56/82/06/857568206.db2.gz OSTIMZKFLVDPBT-HNNXBMFYSA-N 0 3 411.377 4.342 20 0 HIADHN CCCn1ccnc1CCCN(C)CC(=O)N1CC[C@@H](C)Sc2ccccc21 ZINC000429247023 857572796 /nfs/dbraw/zinc/57/27/96/857572796.db2.gz VDGKGIJXXBGJQN-GOSISDBHSA-N 0 3 400.592 4.075 20 0 HIADHN CCCn1ccnc1CCCN(C)CC(=O)Nc1cccc(-c2csc(C)n2)c1 ZINC000429258763 857578638 /nfs/dbraw/zinc/57/86/38/857578638.db2.gz VVVJBYZRCLUJBK-UHFFFAOYSA-N 0 3 411.575 4.228 20 0 HIADHN Cc1cnc([C@H](C)NC(=O)N[C@@H](CN2CCc3ccccc3C2)C(C)(C)C)s1 ZINC000429321837 857602155 /nfs/dbraw/zinc/60/21/55/857602155.db2.gz FZKJFFJWMQLIDJ-LPHOPBHVSA-N 0 3 400.592 4.285 20 0 HIADHN COC(=O)[C@H]1CCN([C@H](C)c2nc(-c3cccc(C(F)(F)F)c3)no2)[C@H]1C(C)C ZINC000429376503 857631546 /nfs/dbraw/zinc/63/15/46/857631546.db2.gz AGDHDSIIHMVSFU-KCXAZCMYSA-N 0 3 411.424 4.336 20 0 HIADHN O=S1(=O)CCCN1c1cccc(CN[C@H](Cc2ccccc2F)c2ccccc2)c1 ZINC000429414640 857654438 /nfs/dbraw/zinc/65/44/38/857654438.db2.gz CAQQKFFLATWOQG-XMMPIXPASA-N 0 3 424.541 4.439 20 0 HIADHN OC[C@@H](CN[C@@H](c1ccccc1)c1ccccn1)Cc1cccc(Br)c1 ZINC000429418624 857655410 /nfs/dbraw/zinc/65/54/10/857655410.db2.gz OGKJIOXEJHWHRS-GCJKJVERSA-N 0 3 411.343 4.374 20 0 HIADHN Fc1ccccc1C[C@@H](NCc1cnc(N2CCOCC2)c(F)c1)c1ccccc1 ZINC000429418907 857656716 /nfs/dbraw/zinc/65/67/16/857656716.db2.gz PGVJBFLKMDDCAW-HSZRJFAPSA-N 0 3 409.480 4.270 20 0 HIADHN C[C@H](CNC(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1)Sc1ccccc1 ZINC000429427149 857661243 /nfs/dbraw/zinc/66/12/43/857661243.db2.gz OOWYDBZIFSWGRJ-HSALFYBXSA-N 0 3 419.635 4.088 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)N(Cc2ccccc2)[C@@H]2CCCC2(C)C)CC1 ZINC000429426382 857661262 /nfs/dbraw/zinc/66/12/62/857661262.db2.gz FTXPBWSSCSUMKD-FYYLOGMGSA-N 0 3 414.638 4.051 20 0 HIADHN COCCS(=O)(=O)c1ccc(CN[C@@H](c2ccc(C)cc2)C2CCCC2)cc1 ZINC000429445377 857673613 /nfs/dbraw/zinc/67/36/13/857673613.db2.gz PIZJIGQUYOTTGV-HSZRJFAPSA-N 0 3 401.572 4.436 20 0 HIADHN Fc1ccc([C@@H](NC[C@@H]2CN(Cc3ccccc3)CCCO2)c2cccnc2)cc1 ZINC000429445259 857673733 /nfs/dbraw/zinc/67/37/33/857673733.db2.gz FSBBLZKZQLRXJE-JWQCQUIFSA-N 0 3 405.517 4.191 20 0 HIADHN Fc1ccc([C@@H](NC[C@H]2CN(Cc3ccccc3)CCCO2)c2cccnc2)c(F)c1 ZINC000429452891 857676798 /nfs/dbraw/zinc/67/67/98/857676798.db2.gz ZIXICSCTZDLQNG-DHLKQENFSA-N 0 3 423.507 4.330 20 0 HIADHN Fc1ccc([C@H](NC[C@@H]2CN(Cc3ccccc3)CCCO2)c2cccnc2)c(F)c1 ZINC000429452896 857677048 /nfs/dbraw/zinc/67/70/48/857677048.db2.gz ZIXICSCTZDLQNG-RCZVLFRGSA-N 0 3 423.507 4.330 20 0 HIADHN CC(C)N(Cc1cccnc1)C(=O)N[C@@H](CN1CCc2ccccc2C1)C(C)(C)C ZINC000429481395 857690132 /nfs/dbraw/zinc/69/01/32/857690132.db2.gz BKQAHNVARWDVAL-QHCPKHFHSA-N 0 3 408.590 4.475 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)NC[C@@H](c2ccccc2)C(C)(C)CO)CC1 ZINC000437623568 862942748 /nfs/dbraw/zinc/94/27/48/862942748.db2.gz VRVOHSNIYQCUIX-DEOSSOPVSA-N 0 3 423.601 4.095 20 0 HIADHN Clc1ccccc1[C@H]1CN(C[C@@H]2CN(Cc3ccccc3)CCCO2)CCO1 ZINC000429685730 857834857 /nfs/dbraw/zinc/83/48/57/857834857.db2.gz XOKHXKRZDYTXHN-NZQKXSOJSA-N 0 3 400.950 4.004 20 0 HIADHN COc1cccc(-c2nc(CN[C@@H]3[C@H]4CCO[C@@H]4C34CCCC4)cs2)c1OC ZINC000429711572 857845814 /nfs/dbraw/zinc/84/58/14/857845814.db2.gz FSIONRNNINZEPC-AHRSYUTCSA-N 0 3 400.544 4.265 20 0 HIADHN C[C@H](c1cc(Cl)ccc1Cl)n1nccc1NC(=O)N1CC[C@@H]2CCN(C)C[C@@H]21 ZINC000429718215 857848262 /nfs/dbraw/zinc/84/82/62/857848262.db2.gz JFPAMNJUIFZMLD-GLJUWKHASA-N 0 3 422.360 4.357 20 0 HIADHN Cc1coc(-c2cccc(NC(=O)NC[C@@H]3CN(Cc4ccccc4)CCCO3)c2)n1 ZINC000429744782 857865791 /nfs/dbraw/zinc/86/57/91/857865791.db2.gz BOMMXUKXIOCIMK-JOCHJYFZSA-N 0 3 420.513 4.063 20 0 HIADHN O=C(NC[C@H]1CN(Cc2ccccc2)CCCO1)Nc1cccc(COCC2CC2)c1 ZINC000429752622 857871030 /nfs/dbraw/zinc/87/10/30/857871030.db2.gz UWUSBNQYYWECCK-DEOSSOPVSA-N 0 3 423.557 4.026 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N(CC(C)(C)O)C1CC1)c1ccc(C(F)(F)F)cc1 ZINC000429774911 857880615 /nfs/dbraw/zinc/88/06/15/857880615.db2.gz NVKYXXOJZNWGOA-GOSISDBHSA-N 0 3 415.500 4.033 20 0 HIADHN CCO[C@@H]1C[C@@H](NCC(=O)Nc2c(C)nn(-c3ccc(C)cc3)c2C)C12CCCCC2 ZINC000429792764 857885903 /nfs/dbraw/zinc/88/59/03/857885903.db2.gz UWCIGQGJSMHXTP-FGZHOGPDSA-N 0 3 424.589 4.454 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1cccc(Br)c1F ZINC000429812879 857893936 /nfs/dbraw/zinc/89/39/36/857893936.db2.gz ZZGDEBZOXUXWBQ-UHFFFAOYSA-N 0 3 421.310 4.045 20 0 HIADHN C[C@@H]1CCCN(CCNC(=O)C(C)(C)c2csc(-c3c(F)cccc3F)n2)C1 ZINC000429847598 857909988 /nfs/dbraw/zinc/90/99/88/857909988.db2.gz QILCKDGPSXOWEX-CQSZACIVSA-N 0 3 407.530 4.214 20 0 HIADHN CCN(CC)[C@H](CNC(=O)[C@H](C)[C@H]1OCCc2sccc21)c1cccc(OC)c1 ZINC000429857703 857913600 /nfs/dbraw/zinc/91/36/00/857913600.db2.gz KPFAWPOGFSJZBF-BSLALVQMSA-N 0 3 416.587 4.206 20 0 HIADHN Fc1ccc([C@H]2C[C@H](NCc3nccn3CC(F)(F)F)C2)cc1Br ZINC000430071956 858020018 /nfs/dbraw/zinc/02/00/18/858020018.db2.gz QCOZEWWPPSFUDB-HAQNSBGRSA-N 0 3 406.221 4.383 20 0 HIADHN CCCn1c(SC[C@@H]2CN(Cc3ccccc3)CCCO2)nnc1-c1ccncc1 ZINC000430096240 858029878 /nfs/dbraw/zinc/02/98/78/858029878.db2.gz DZEJJJFNHULQCR-NRFANRHFSA-N 0 3 423.586 4.133 20 0 HIADHN COC(=O)CCn1nc(C)c(CN2CC[C@@H](Sc3cccc(Cl)c3)C2)c1C ZINC000430198311 858077549 /nfs/dbraw/zinc/07/75/49/858077549.db2.gz RBLRNPNDTYOYSO-GOSISDBHSA-N 0 3 407.967 4.083 20 0 HIADHN O=C(N[C@@H]1CCc2ccc(-c3ccccc3)cc21)N1CCN(CC2CCOCC2)CC1 ZINC000430210655 858083213 /nfs/dbraw/zinc/08/32/13/858083213.db2.gz UUMMCBCLLZFNGM-RUZDIDTESA-N 0 3 419.569 4.095 20 0 HIADHN O=C(N[C@H](CC1CC1)c1cc(F)cc(Br)c1)N1CC[C@@H](N2CC=CC2)C1 ZINC000430291303 858110886 /nfs/dbraw/zinc/11/08/86/858110886.db2.gz GEKVSELDMPESFM-RTBURBONSA-N 0 3 422.342 4.085 20 0 HIADHN O[C@@H](Cc1ccc(C(F)(F)F)cc1)CN(CCc1ccccn1)Cc1cccnc1 ZINC000430331841 858124250 /nfs/dbraw/zinc/12/42/50/858124250.db2.gz OLNUNDPGGIUXOP-QFIPXVFZSA-N 0 3 415.459 4.144 20 0 HIADHN CC[C@H](N[C@H](C)c1ccc(Br)c(S(N)(=O)=O)c1)c1ccc(C)cc1 ZINC000430692908 858271276 /nfs/dbraw/zinc/27/12/76/858271276.db2.gz XFPWMNCOVHIMKP-DYVFJYSZSA-N 0 3 411.365 4.207 20 0 HIADHN CC(C)[C@@H](N[C@H](C)c1ccc(Br)c(S(N)(=O)=O)c1)c1ccccc1 ZINC000430694430 858272515 /nfs/dbraw/zinc/27/25/15/858272515.db2.gz DOGCHZZRZLNVDD-FZKQIMNGSA-N 0 3 411.365 4.144 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(Cl)cc2)CC1)c1cc(F)c(F)cc1F ZINC000437665973 863006240 /nfs/dbraw/zinc/00/62/40/863006240.db2.gz IZUMYDNGOJCETQ-UHFFFAOYSA-N 0 3 412.839 4.031 20 0 HIADHN CNC(=O)[C@]1(C)CCN(Cc2c(C)nn(-c3ccccc3)c2Oc2ccc(F)cc2)C1 ZINC000430777108 858301251 /nfs/dbraw/zinc/30/12/51/858301251.db2.gz SYHQNFKYFHLJAO-XMMPIXPASA-N 0 3 422.504 4.070 20 0 HIADHN C[C@@H]1[C@H](C(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)[C@H]1c1ccccc1 ZINC000430828477 858320043 /nfs/dbraw/zinc/32/00/43/858320043.db2.gz TXNYMBFBNJOTQD-CJOZULMCSA-N 0 3 400.526 4.318 20 0 HIADHN CCN(CC)[C@@H](CN1C(=O)[C@H](Cc2ccccc2)N(C2CC2)C1=O)c1ccsc1 ZINC000430874468 858349766 /nfs/dbraw/zinc/34/97/66/858349766.db2.gz DEASDQQIZGJAJF-SFTDATJTSA-N 0 3 411.571 4.169 20 0 HIADHN CC1CCN([C@@H](CN2C(=O)[C@@H](Cc3ccccc3)N(C)C2=O)c2cccs2)CC1 ZINC000430955314 858381314 /nfs/dbraw/zinc/38/13/14/858381314.db2.gz LXPSLGXORASVJQ-UXHICEINSA-N 0 3 411.571 4.026 20 0 HIADHN O=C1N[C@H](Cc2cccc3ccccc32)C(=O)N1C[C@H](c1cccs1)N1CCCC1 ZINC000430979728 858390318 /nfs/dbraw/zinc/39/03/18/858390318.db2.gz QDAVHQCMSSLZBZ-NHCUHLMSSA-N 0 3 419.550 4.201 20 0 HIADHN Cc1c(C(=O)N[C@@H]2CCN(Cc3ccccc3)[C@H](C)C2)[nH]c2c1C(=O)CC(C)(C)C2 ZINC000431053396 858421667 /nfs/dbraw/zinc/42/16/67/858421667.db2.gz NEFAWQZZRZWMRQ-VQIMIIECSA-N 0 3 407.558 4.261 20 0 HIADHN Cc1ccc([C@H](CN2C(=O)[C@@H](Cc3ccccc3)N(C3CC3)C2=O)N2CCCC2)cc1 ZINC000431061229 858427666 /nfs/dbraw/zinc/42/76/66/858427666.db2.gz JEKLDLBATXLDIM-RPWUZVMVSA-N 0 3 417.553 4.170 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)NC[C@H]1CCC(F)(F)C1 ZINC000431098020 858446206 /nfs/dbraw/zinc/44/62/06/858446206.db2.gz OHIBXVIKHURCCI-HNNXBMFYSA-N 0 3 407.427 4.214 20 0 HIADHN CCc1noc(-c2ccc(C)c(NC(=O)N[C@H]3CCCN(Cc4ccccc4)C3)c2)n1 ZINC000431132148 858461444 /nfs/dbraw/zinc/46/14/44/858461444.db2.gz IUXSBTXOZHLGRH-FQEVSTJZSA-N 0 3 419.529 4.394 20 0 HIADHN CC(C)c1cccc2c1OCCC[C@@H]2NCCOc1ccc(S(C)(=O)=O)cc1 ZINC000431335862 858570890 /nfs/dbraw/zinc/57/08/90/858570890.db2.gz FRVCWCAWNAVQIL-NRFANRHFSA-N 0 3 403.544 4.096 20 0 HIADHN Cc1cc(Cl)cc2c1OCCC[C@@H]2NCCCS(=O)(=O)Cc1ccccc1 ZINC000431354063 858576401 /nfs/dbraw/zinc/57/64/01/858576401.db2.gz XQGFRWCXTBNJOU-FQEVSTJZSA-N 0 3 407.963 4.457 20 0 HIADHN C[C@@H](NC(=O)c1cccc(CN2CCCC2)c1)c1noc(-c2ccc(Cl)cc2)n1 ZINC000431514026 858651389 /nfs/dbraw/zinc/65/13/89/858651389.db2.gz OKLQEQIJZXFNAD-OAHLLOKOSA-N 0 3 410.905 4.477 20 0 HIADHN C[C@@H](CCSc1ccccc1)N1CCC(NS(=O)(=O)c2ccccc2)CC1 ZINC000431600018 858683405 /nfs/dbraw/zinc/68/34/05/858683405.db2.gz LPJHCKPWRHKBOH-SFHVURJKSA-N 0 3 404.601 4.000 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3cc(OC)c(C)c(OC)c3)c(C)c2)CC1 ZINC000431703621 858752536 /nfs/dbraw/zinc/75/25/36/858752536.db2.gz HOMDDCILAPILPE-UHFFFAOYSA-N 0 3 412.534 4.107 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cccc(F)c1Br)c1cccc(OC)c1 ZINC000431740300 858777426 /nfs/dbraw/zinc/77/74/26/858777426.db2.gz GOCXRSLGTFUTCF-SFHVURJKSA-N 0 3 423.326 4.410 20 0 HIADHN O=C(Cc1cccc(OCC(F)(F)F)c1)NC[C@@H](c1cccs1)N1CCCC1 ZINC000431769100 858803482 /nfs/dbraw/zinc/80/34/82/858803482.db2.gz HDQSNPYPLXWAHV-KRWDZBQOSA-N 0 3 412.477 4.185 20 0 HIADHN C[C@@H]1CCN(C(=O)CCc2cccc(OC(C)(C)C)n2)CCN1Cc1ccccc1 ZINC000467530507 881349395 /nfs/dbraw/zinc/34/93/95/881349395.db2.gz SSCXOJIXDOHWLS-HXUWFJFHSA-N 0 3 409.574 4.315 20 0 HIADHN Cc1cc(C)c(NC(=O)NC[C@@H](Cc2ccccc2)N(C)C)c(Br)c1 ZINC000431986302 858906111 /nfs/dbraw/zinc/90/61/11/858906111.db2.gz LRNHWLVIZATZGY-QGZVFWFLSA-N 0 3 404.352 4.360 20 0 HIADHN CCCN(C(=O)c1cccs1)C1CCN(CCc2nc3ccccc3n2C)CC1 ZINC000432024079 858935596 /nfs/dbraw/zinc/93/55/96/858935596.db2.gz JBLWGPXJUMYUQW-UHFFFAOYSA-N 0 3 410.587 4.194 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)C1(Cc2cccc(F)c2)CCOCC1 ZINC000432061272 858959342 /nfs/dbraw/zinc/95/93/42/858959342.db2.gz MEWXHHLOGXHZHB-FQEVSTJZSA-N 0 3 416.562 4.180 20 0 HIADHN Cc1cc(NC(=O)N2Cc3ccc(C)cc3C2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000432277788 859082145 /nfs/dbraw/zinc/08/21/45/859082145.db2.gz UGFMIRTVRCFPPU-QHCPKHFHSA-N 0 3 415.541 4.495 20 0 HIADHN COc1ccc([C@H](CNC(=O)NCc2ccc(C(C)(F)F)cc2)N2CCCC2)cc1 ZINC000432568596 859231469 /nfs/dbraw/zinc/23/14/69/859231469.db2.gz LWZDUAUCRICEKN-NRFANRHFSA-N 0 3 417.500 4.443 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)c1cncc(-c2ccc3c(c2)CCO3)c1 ZINC000432656058 859275860 /nfs/dbraw/zinc/27/58/60/859275860.db2.gz HRITVSHYAURQGU-UHFFFAOYSA-N 0 3 419.500 4.027 20 0 HIADHN CN(CCC1CCOCC1)Cc1cccc(Br)c1OC[C@H]1CCCO1 ZINC000432795659 859364008 /nfs/dbraw/zinc/36/40/08/859364008.db2.gz XLTUSJCJXKYHFE-GOSISDBHSA-N 0 3 412.368 4.255 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)C2(Cc3cccc(F)c3)CCOCC2)C1 ZINC000432881282 859405191 /nfs/dbraw/zinc/40/51/91/859405191.db2.gz QOOQBXLBOYRHTM-AUSIDOKSSA-N 0 3 410.533 4.117 20 0 HIADHN FC(F)(F)c1ccc(CN2C[C@H]3CCC[C@@]3(c3nc(-c4cnccn4)no3)C2)s1 ZINC000432927229 859433470 /nfs/dbraw/zinc/43/34/70/859433470.db2.gz KVMCFXFNRISPMO-KZULUSFZSA-N 0 3 421.448 4.161 20 0 HIADHN C[C@@H]1OCC[C@@]1(O)CN[C@@H](Cc1ccccc1F)c1ccccc1Br ZINC000433004498 859474117 /nfs/dbraw/zinc/47/41/17/859474117.db2.gz YXGFHUWBDWALDN-PNHOKKKMSA-N 0 3 408.311 4.002 20 0 HIADHN Cc1ccc([C@H](CNC(=O)NCCC2CC(OC(C)(C)C)C2)N2CCCC2)cc1 ZINC000433040049 859494206 /nfs/dbraw/zinc/49/42/06/859494206.db2.gz OTHRNHWZYZEBOF-VTLFHKLASA-N 0 3 401.595 4.415 20 0 HIADHN CCc1ccc([C@H](CN2CCOCC2)NCc2cccc(-c3cccnc3)c2)cc1 ZINC000467641896 881437084 /nfs/dbraw/zinc/43/70/84/881437084.db2.gz UGRKLMQUVKGPOW-SANMLTNESA-N 0 3 401.554 4.474 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N2CCC(c3ncc(C)s3)CC2)N(C)C)cc1 ZINC000433279986 859613165 /nfs/dbraw/zinc/61/31/65/859613165.db2.gz XVSIGSTZKLUHBC-FQEVSTJZSA-N 0 3 400.592 4.206 20 0 HIADHN CN(C)Cc1ccccc1C(=O)NCC1(c2cccc(C(F)(F)F)c2)CCOCC1 ZINC000433311469 859632264 /nfs/dbraw/zinc/63/22/64/859632264.db2.gz HILHMKGJKBERQZ-UHFFFAOYSA-N 0 3 420.475 4.245 20 0 HIADHN Cc1cccc(OC[C@H](O)CN[C@H](C)c2ccc(OC[C@@H]3CCCCO3)c(F)c2)c1 ZINC000433397128 859675839 /nfs/dbraw/zinc/67/58/39/859675839.db2.gz IHPOQKKGOPEGOZ-UZKOGDIHSA-N 0 3 417.521 4.173 20 0 HIADHN C[C@H](NC(=O)NC[C@H]1CCCCN1C1CC1)c1cccc(OCc2ccccn2)c1 ZINC000433553297 859773253 /nfs/dbraw/zinc/77/32/53/859773253.db2.gz DYNFYIQSMLXQDP-PGRDOPGGSA-N 0 3 408.546 4.038 20 0 HIADHN Cc1nc(-c2ccccc2NC(=O)NC2CCN(CCOC(C)C)CC2)cs1 ZINC000433808810 859904856 /nfs/dbraw/zinc/90/48/56/859904856.db2.gz GBESUJQLPKJZRZ-UHFFFAOYSA-N 0 3 402.564 4.129 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)[C@H]3CCCc4sccc43)CC2)c1 ZINC000433828624 859919175 /nfs/dbraw/zinc/91/91/75/859919175.db2.gz NLHQYXLVVKCEDO-QFIPXVFZSA-N 0 3 411.615 4.195 20 0 HIADHN O=C(Cc1cc(Br)ccc1F)NC[C@H](c1ccccc1)N1CCCC1 ZINC000433866286 859941954 /nfs/dbraw/zinc/94/19/54/859941954.db2.gz DEFVGNHRHUXWNX-LJQANCHMSA-N 0 3 405.311 4.084 20 0 HIADHN COc1ccccc1-c1ccc([C@@H](C)NS(=O)(=O)c2ccc(CN(C)C)cc2)cc1 ZINC000433874872 859946761 /nfs/dbraw/zinc/94/67/61/859946761.db2.gz MWMXFVAXMIJNAZ-GOSISDBHSA-N 0 3 424.566 4.463 20 0 HIADHN CCN([C@@H](c1ccc(C)cc1)c1cccnc1)S(=O)(=O)c1ccc(CN(C)C)cc1 ZINC000433880655 859949721 /nfs/dbraw/zinc/94/97/21/859949721.db2.gz BHFOKWNCKMVUIS-DEOSSOPVSA-N 0 3 423.582 4.252 20 0 HIADHN CN(C)Cc1cccc(NC(=O)C(=O)N[C@@H](c2cccc(Cl)c2)C2CCCC2)c1 ZINC000433886336 859951607 /nfs/dbraw/zinc/95/16/07/859951607.db2.gz CCHGDWNBTCENIW-OAQYLSRUSA-N 0 3 413.949 4.388 20 0 HIADHN CC(C)n1nc(-c2ccco2)cc1NC(=O)N(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1 ZINC000433893547 859954077 /nfs/dbraw/zinc/95/40/77/859954077.db2.gz KFFWIODQGZVULG-AVRDEDQJSA-N 0 3 422.533 4.276 20 0 HIADHN CC[C@@H](CNC(=O)c1ccccc1NCc1cccnc1)N1CCc2ccccc2C1 ZINC000433947668 859994994 /nfs/dbraw/zinc/99/49/94/859994994.db2.gz APKCLQWMKYUXIZ-QHCPKHFHSA-N 0 3 414.553 4.260 20 0 HIADHN C[C@@H]1CCN(C(=O)Nc2cnn(Cc3ccccc3)c2)CCN1Cc1ccccc1 ZINC000467693934 881487206 /nfs/dbraw/zinc/48/72/06/881487206.db2.gz DIDIJKDLFSMMDT-HXUWFJFHSA-N 0 3 403.530 4.060 20 0 HIADHN COc1cccc(C(NC(=O)NC[C@@H]2CCCCN2C2CC2)c2cccc(OC)c2)c1 ZINC000433955306 860000941 /nfs/dbraw/zinc/00/09/41/860000941.db2.gz MKCOHTXTPUVZCU-NRFANRHFSA-N 0 3 423.557 4.109 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)Nc1cccc(-c2noc(C3CC3)n2)c1 ZINC000434060624 860072280 /nfs/dbraw/zinc/07/22/80/860072280.db2.gz ZOWNSDREYDMWHG-NRFANRHFSA-N 0 3 417.513 4.400 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)Nc2cc(-c3ccccc3F)on2)CC1 ZINC000434062312 860072929 /nfs/dbraw/zinc/07/29/29/860072929.db2.gz LPGUOAACSNTGBX-UHFFFAOYSA-N 0 3 408.477 4.609 20 0 HIADHN Cc1ccn(C2CCN(C(=O)N[C@@H](CN3CCc4ccccc4C3)C(C)(C)C)CC2)n1 ZINC000434188436 860177257 /nfs/dbraw/zinc/17/72/57/860177257.db2.gz HSLDAFQXHLRGEB-QHCPKHFHSA-N 0 3 423.605 4.011 20 0 HIADHN CN(C)[C@H](CNC(=O)C12C[C@H]3C[C@@H](C1)CC(C(F)(F)F)(C3)C2)Cc1ccccc1 ZINC000434217059 860202167 /nfs/dbraw/zinc/20/21/67/860202167.db2.gz JVDYEBAXTUBJIR-ITPHGFLGSA-N 0 3 408.508 4.424 20 0 HIADHN C[C@H]1CN(C2CC2)C[C@H]1NC(=O)c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1 ZINC000467713347 881511299 /nfs/dbraw/zinc/51/12/99/881511299.db2.gz LUVSNIBUTYKLCN-SCLBCKFNSA-N 0 3 405.420 4.105 20 0 HIADHN CCc1ccc([C@H](CNC(=O)c2ccc(-c3nc(C4CC4)no3)cc2)N(C)C)cc1 ZINC000434221346 860205740 /nfs/dbraw/zinc/20/57/40/860205740.db2.gz WHPOGMKCXKBUDG-NRFANRHFSA-N 0 3 404.514 4.209 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)[C@@H](C)Oc1ccccc1F ZINC000434320439 860280977 /nfs/dbraw/zinc/28/09/77/860280977.db2.gz CESNSGDVFLCECO-QUCCMNQESA-N 0 3 422.504 4.184 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1cc2nc(C)ccc2o1 ZINC000434321043 860281140 /nfs/dbraw/zinc/28/11/40/860281140.db2.gz JDENIVXBYUPJPT-IBGZPJMESA-N 0 3 415.497 4.340 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)[C@@H](C)Oc1cccc(F)c1 ZINC000434323307 860284969 /nfs/dbraw/zinc/28/49/69/860284969.db2.gz HWUSNOVHYQVFHY-NQIIRXRSSA-N 0 3 422.504 4.184 20 0 HIADHN Cc1cc(C)n([C@H](C)CC(=O)Nc2c(C)cnn2[C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000434324443 860285728 /nfs/dbraw/zinc/28/57/28/860285728.db2.gz DEGHEODPCRIMEX-IRLDBZIGSA-N 0 3 420.561 4.042 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1cc(C)n(C(C)(C)C)n1 ZINC000434324476 860285790 /nfs/dbraw/zinc/28/57/90/860285790.db2.gz DLALDMHCMJRQST-HXUWFJFHSA-N 0 3 420.561 4.151 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1ccc(F)c(F)c1F ZINC000434326056 860287884 /nfs/dbraw/zinc/28/78/84/860287884.db2.gz LHXKTIVMTOOCEJ-MRXNPFEDSA-N 0 3 414.431 4.308 20 0 HIADHN CCC(=O)c1ccc(C(=O)Nc2c(C)cnn2[C@@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000434330177 860292296 /nfs/dbraw/zinc/29/22/96/860292296.db2.gz JVBUKMLDYAQCKY-JOCHJYFZSA-N 0 3 416.525 4.484 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)Cc1ccc(Cl)cc1 ZINC000434333097 860295308 /nfs/dbraw/zinc/29/53/08/860295308.db2.gz KZFUYXUWDMVCJR-OAQYLSRUSA-N 0 3 408.933 4.473 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)COc1ccccc1Cl ZINC000434334703 860296746 /nfs/dbraw/zinc/29/67/46/860296746.db2.gz RTOFLQSZFYIONS-IBGZPJMESA-N 0 3 424.932 4.309 20 0 HIADHN O=C(NCc1cccc(NC(=O)Nc2ccccc2)c1)NC[C@@H]1CCCCN1C1CC1 ZINC000434348048 860304313 /nfs/dbraw/zinc/30/43/13/860304313.db2.gz AAFXDUPECPRXHA-QFIPXVFZSA-N 0 3 421.545 4.147 20 0 HIADHN O=C(NC[C@H]1CCCCN1C1CC1)N1CCC(c2nc3cc(Cl)ccc3o2)CC1 ZINC000434357645 860308844 /nfs/dbraw/zinc/30/88/44/860308844.db2.gz MKLRDWNNGORRJO-GOSISDBHSA-N 0 3 416.953 4.387 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)NCc1nccn1CCCc1ccccc1 ZINC000434365020 860314833 /nfs/dbraw/zinc/31/48/33/860314833.db2.gz YZVHOXYAPCKSIY-UHFFFAOYSA-N 0 3 416.525 4.254 20 0 HIADHN O=C(NC[C@@H]1CCCCN1C1CC1)c1ccc(Oc2cccc(Cl)c2Cl)nn1 ZINC000434421119 860343218 /nfs/dbraw/zinc/34/32/18/860343218.db2.gz KFGWTASVDMDKTB-AWEZNQCLSA-N 0 3 421.328 4.322 20 0 HIADHN O=C(Nc1cc(C(=O)NC[C@@H]2CCCCN2C2CC2)ccc1Cl)c1cccs1 ZINC000434425549 860343866 /nfs/dbraw/zinc/34/38/66/860343866.db2.gz PIXJTVWJAJQRJS-INIZCTEOSA-N 0 3 417.962 4.401 20 0 HIADHN Cc1cc2sc(NC(=O)N(C)C[C@@H]3CCN(C)[C@H]3c3cccnc3)nc2cc1F ZINC000434464272 860360997 /nfs/dbraw/zinc/36/09/97/860360997.db2.gz ADAZJQGJYBGZFA-KXBFYZLASA-N 0 3 413.522 4.296 20 0 HIADHN CCC[C@@H](NC(=O)[C@H](C)N1CCC(c2ncc3n2CCCC3)CC1)c1ccccc1 ZINC000434682736 860458157 /nfs/dbraw/zinc/45/81/57/860458157.db2.gz DFHDROYPDFVLRB-WMZHIEFXSA-N 0 3 408.590 4.445 20 0 HIADHN CC(C)[C@@H](NC(=O)CN1CCC(c2ncc3n2CCCC3)CC1)c1ccc(F)cc1 ZINC000434683405 860458313 /nfs/dbraw/zinc/45/83/13/860458313.db2.gz GJQXTKQPZATQGT-HSZRJFAPSA-N 0 3 412.553 4.051 20 0 HIADHN c1nc(C2CCN(Cc3csc(-c4ccc5c(c4)OCO5)n3)CC2)n2c1CCCC2 ZINC000434687334 860460892 /nfs/dbraw/zinc/46/08/92/860460892.db2.gz WVDWZDZUKRXREU-UHFFFAOYSA-N 0 3 422.554 4.451 20 0 HIADHN CC(C)(C)N(Cc1ccccc1)C(=O)CN1CCC(c2ncc3n2CCCC3)CC1 ZINC000434689894 860462855 /nfs/dbraw/zinc/46/28/55/860462855.db2.gz CZKKAXCHMMLLLU-UHFFFAOYSA-N 0 3 408.590 4.226 20 0 HIADHN C[C@@H](NC(=O)CN1CCC(c2ncc3n2CCCC3)CC1)c1ccc2c(c1)CCCC2 ZINC000434760206 860484336 /nfs/dbraw/zinc/48/43/36/860484336.db2.gz YPBSIZOGKWMCLU-LJQANCHMSA-N 0 3 420.601 4.155 20 0 HIADHN C[C@H]1CN(CCCCNC(=O)CCCc2ccc(Cl)c(Cl)c2)C[C@H](C)O1 ZINC000434782811 860493681 /nfs/dbraw/zinc/49/36/81/860493681.db2.gz FJORRWVZLBXBNV-HOTGVXAUSA-N 0 3 401.378 4.322 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)c2ccccc2OCc2ccc(F)cc2)C[C@H](C)O1 ZINC000434789058 860494456 /nfs/dbraw/zinc/49/44/56/860494456.db2.gz LTBMUULVLPVCCD-KDURUIRLSA-N 0 3 414.521 4.024 20 0 HIADHN O[C@@H](COCc1ccccc1F)CN1CCC[C@@H](c2nc(C(F)(F)F)cs2)C1 ZINC000434885625 860535820 /nfs/dbraw/zinc/53/58/20/860535820.db2.gz IWRYTLLZAOBKOR-UKRRQHHQSA-N 0 3 418.456 4.058 20 0 HIADHN C[C@@H]1[C@@H](c2ccccc2)CCN1CC(=O)N1CCC[C@@H]1c1ccc2c(c1)OCCCO2 ZINC000434898513 860543825 /nfs/dbraw/zinc/54/38/25/860543825.db2.gz VRDZNMJHULWCPI-WTIAFYNJSA-N 0 3 420.553 4.389 20 0 HIADHN CC(=O)Nc1ccccc1CN1CCC(Nc2cccc(Br)c2)CC1 ZINC000435024801 860604310 /nfs/dbraw/zinc/60/43/10/860604310.db2.gz GIVKBANLPBXLQZ-UHFFFAOYSA-N 0 3 402.336 4.484 20 0 HIADHN Cc1c(C(=O)NC2CCN(Cc3ccccc3)CC2)cnn1-c1cc(C)ccc1C ZINC000435047520 860613995 /nfs/dbraw/zinc/61/39/95/860613995.db2.gz HIWAAJGKHUZOKD-UHFFFAOYSA-N 0 3 402.542 4.192 20 0 HIADHN Cc1cccc(N2CCN(CCCN[C@@H](C)c3nc(C(F)(F)F)cs3)CC2)c1 ZINC000467755296 881569043 /nfs/dbraw/zinc/56/90/43/881569043.db2.gz YHHWARRJHHHMPQ-INIZCTEOSA-N 0 3 412.525 4.333 20 0 HIADHN Cc1cc(NC(=O)Cc2ccc(Cl)cc2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435268978 860709233 /nfs/dbraw/zinc/70/92/33/860709233.db2.gz QFWHEMDQHSYKMY-NRFANRHFSA-N 0 3 408.933 4.473 20 0 HIADHN CCc1ccccc1OCC(=O)Nc1cc(C)nn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435271223 860710523 /nfs/dbraw/zinc/71/05/23/860710523.db2.gz WWRAHYVRVMUNTC-QFIPXVFZSA-N 0 3 418.541 4.218 20 0 HIADHN CCc1ccc(OCC(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000435275938 860713296 /nfs/dbraw/zinc/71/32/96/860713296.db2.gz BOCASOVVPNXSBP-QFIPXVFZSA-N 0 3 418.541 4.218 20 0 HIADHN Cc1cc(NC(=O)[C@H](C)Oc2ccc(F)cc2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435276605 860713326 /nfs/dbraw/zinc/71/33/26/860713326.db2.gz ZUCJOEMJPAXHQS-RXVVDRJESA-N 0 3 422.504 4.184 20 0 HIADHN Cc1cc(NC(=O)c2cncc(OC(C)C)c2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435281394 860716256 /nfs/dbraw/zinc/71/62/56/860716256.db2.gz WIULMRYMFMUTJD-NRFANRHFSA-N 0 3 419.529 4.073 20 0 HIADHN Cc1cc(NC(=O)COc2ccc(Cl)cc2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435282391 860717353 /nfs/dbraw/zinc/71/73/53/860717353.db2.gz UQDWTLQPBBFRQR-HXUWFJFHSA-N 0 3 424.932 4.309 20 0 HIADHN Cc1cc(NC(=O)c2ccc(OC(C)C)nc2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435284788 860719383 /nfs/dbraw/zinc/71/93/83/860719383.db2.gz LDCKTMJLLJTKON-OAQYLSRUSA-N 0 3 419.529 4.073 20 0 HIADHN CCCn1nc(C)c(C(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)c1C ZINC000435287338 860719743 /nfs/dbraw/zinc/71/97/43/860719743.db2.gz HBQPJLVOFJGCNM-NRFANRHFSA-N 0 3 420.561 4.114 20 0 HIADHN Cc1cc(NC(=O)CCCOc2ccccc2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435292221 860722193 /nfs/dbraw/zinc/72/21/93/860722193.db2.gz RCILBMCEXHSUBL-JOCHJYFZSA-N 0 3 418.541 4.436 20 0 HIADHN Cc1cc(NC(=O)c2ccc3ncccc3c2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435292366 860722326 /nfs/dbraw/zinc/72/23/26/860722326.db2.gz RLOYGSOUWOMLQO-QFIPXVFZSA-N 0 3 411.509 4.439 20 0 HIADHN Cc1cc(NC(=O)c2cncc3ccccc32)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435295979 860724868 /nfs/dbraw/zinc/72/48/68/860724868.db2.gz QMUXPQWSJRHWED-NRFANRHFSA-N 0 3 411.509 4.439 20 0 HIADHN CCOc1ccc(C(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000435296641 860724979 /nfs/dbraw/zinc/72/49/79/860724979.db2.gz SOYVTZXAFSRMQQ-NRFANRHFSA-N 0 3 404.514 4.290 20 0 HIADHN Cc1cc(NC(=O)c2csc(C3CC3)n2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435299497 860726687 /nfs/dbraw/zinc/72/66/87/860726687.db2.gz QVNLTRMGBYZPOJ-SFHVURJKSA-N 0 3 407.543 4.225 20 0 HIADHN CCOc1ccc(CCC(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000435364578 860763739 /nfs/dbraw/zinc/76/37/39/860763739.db2.gz CRSOBAGBMHLCMN-QFIPXVFZSA-N 0 3 418.541 4.300 20 0 HIADHN O=C(Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)c1ccc(-n2cccc2)cc1 ZINC000435368563 860766320 /nfs/dbraw/zinc/76/63/20/860766320.db2.gz BGIQFPIGNZGGPA-QHCPKHFHSA-N 0 3 411.509 4.373 20 0 HIADHN CC(C)c1ccc(OCC(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000435369387 860767141 /nfs/dbraw/zinc/76/71/41/860767141.db2.gz LACWRTGIPJHMKO-JOCHJYFZSA-N 0 3 418.541 4.471 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)c1cccc(OC(F)F)c1 ZINC000435371005 860768202 /nfs/dbraw/zinc/76/82/02/860768202.db2.gz KWYRNGFSHMIWAV-GOSISDBHSA-N 0 3 412.440 4.184 20 0 HIADHN O=C(CCc1cc(F)ccc1F)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435370316 860768384 /nfs/dbraw/zinc/76/83/84/860768384.db2.gz OJHQWOFJPIUJRE-FQEVSTJZSA-N 0 3 410.468 4.180 20 0 HIADHN COc1cccc([C@@H]2C[C@@H]2C(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000435373955 860771948 /nfs/dbraw/zinc/77/19/48/860771948.db2.gz ONQVIKGRMMBCPF-PMVMPFDFSA-N 0 3 416.525 4.081 20 0 HIADHN C[C@H](Cc1cccc(F)c1)C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435374658 860772802 /nfs/dbraw/zinc/77/28/02/860772802.db2.gz JLBDLXAFQUCQAT-GCJKJVERSA-N 0 3 406.505 4.287 20 0 HIADHN C[C@@H](Sc1ccccc1)C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435374099 860773171 /nfs/dbraw/zinc/77/31/71/860773171.db2.gz WGQDNRVYRNYFSS-UYAOXDASSA-N 0 3 406.555 4.449 20 0 HIADHN Cc1cccc(O[C@@H](C)C(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000435375826 860773750 /nfs/dbraw/zinc/77/37/50/860773750.db2.gz WYTKHHJCBSBXQW-PZJWPPBQSA-N 0 3 404.514 4.045 20 0 HIADHN O=C(COc1ccccc1Cl)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435375502 860773901 /nfs/dbraw/zinc/77/39/01/860773901.db2.gz MRKJAZJGJYFESE-GOSISDBHSA-N 0 3 410.905 4.001 20 0 HIADHN Cc1cccc(O[C@H](C)C(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000435375824 860774167 /nfs/dbraw/zinc/77/41/67/860774167.db2.gz WYTKHHJCBSBXQW-CTNGQTDRSA-N 0 3 404.514 4.045 20 0 HIADHN Cc1cc(C(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)nc2ccccc12 ZINC000435379501 860775796 /nfs/dbraw/zinc/77/57/96/860775796.db2.gz MOETWJRSNPGWIT-HXUWFJFHSA-N 0 3 411.509 4.439 20 0 HIADHN O=C(CCCOc1ccccc1)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435378448 860776261 /nfs/dbraw/zinc/77/62/61/860776261.db2.gz ILZZRFUOOGLLHA-NRFANRHFSA-N 0 3 404.514 4.128 20 0 HIADHN CC[C@@H](OC1CCCCC1)C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435381725 860777649 /nfs/dbraw/zinc/77/76/49/860777649.db2.gz XPINQQMVKIARGZ-IFMALSPDSA-N 0 3 410.562 4.397 20 0 HIADHN CC[C@H](Oc1ccccc1F)C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435381743 860778312 /nfs/dbraw/zinc/77/83/12/860778312.db2.gz XRNGXRCEVDLMLD-FPOVZHCZSA-N 0 3 422.504 4.265 20 0 HIADHN C[C@@H]1CC[C@@H](C)N1[C@H]1CCCN(S(=O)(=O)c2c(Cl)cc(F)cc2Cl)C1 ZINC000435423281 860795855 /nfs/dbraw/zinc/79/58/55/860795855.db2.gz SJBMWTKMQXQIDL-BZPMIXESSA-N 0 3 409.354 4.158 20 0 HIADHN Cc1cc(NC(=O)N(C)[C@H](C)c2ccco2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435518309 860836042 /nfs/dbraw/zinc/83/60/42/860836042.db2.gz IQVFEUSPLRHVSF-QUCCMNQESA-N 0 3 407.518 4.456 20 0 HIADHN Cc1cc(NC(=O)N(C)[C@@H](C)c2ccco2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435518307 860836272 /nfs/dbraw/zinc/83/62/72/860836272.db2.gz IQVFEUSPLRHVSF-AZUAARDMSA-N 0 3 407.518 4.456 20 0 HIADHN Cc1cc(NC(=O)NCc2ccc(F)c(C)c2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435526204 860841989 /nfs/dbraw/zinc/84/19/89/860841989.db2.gz HBYNDNXKIGFHMT-NRFANRHFSA-N 0 3 421.520 4.408 20 0 HIADHN CN(C)[C@@H](CNC(=O)NCc1csc(CCc2ccccc2)n1)c1ccccc1 ZINC000435532925 860848573 /nfs/dbraw/zinc/84/85/73/860848573.db2.gz SNFQSIDQGZZNGA-NRFANRHFSA-N 0 3 408.571 4.030 20 0 HIADHN COc1ccc(-c2ncc(C(=O)N(CCN(C)C)C3CCCCC3)s2)cc1OC ZINC000435539565 860853433 /nfs/dbraw/zinc/85/34/33/860853433.db2.gz JBJUJLBJJWSQDP-UHFFFAOYSA-N 0 3 417.575 4.164 20 0 HIADHN Cc1c(NC(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)cnn1-c1ccccc1 ZINC000435542615 860857402 /nfs/dbraw/zinc/85/74/02/860857402.db2.gz GARLLEXBFVZELC-HSZRJFAPSA-N 0 3 403.530 4.448 20 0 HIADHN Cc1c(NC(=O)N(CCCc2ccccc2)CCN(C)C)cnn1-c1ccccc1F ZINC000435552177 860868751 /nfs/dbraw/zinc/86/87/51/860868751.db2.gz ZDVOYHOYZGBDHG-UHFFFAOYSA-N 0 3 423.536 4.348 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1cnn(-c2ccccc2)c1C)c1cccc(OC)c1 ZINC000435565674 860886788 /nfs/dbraw/zinc/88/67/88/860886788.db2.gz LKSAONVEGRFJBS-QHCPKHFHSA-N 0 3 421.545 4.394 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)N1CCC(OCC2CCCC2)CC1 ZINC000435577690 860893526 /nfs/dbraw/zinc/89/35/26/860893526.db2.gz KHKFFZOVPQGYND-FQEVSTJZSA-N 0 3 405.608 4.266 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)N[C@@H]1[C@H]2CCc3ccccc3[C@@H]12 ZINC000435600876 860905999 /nfs/dbraw/zinc/90/59/99/860905999.db2.gz GZRRXJWKTFHUEH-YTFSRNRJSA-N 0 3 407.583 4.128 20 0 HIADHN COc1cccc(CCC(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000435690137 860971662 /nfs/dbraw/zinc/97/16/62/860971662.db2.gz BKXXSOPSAJYUCU-JOCHJYFZSA-N 0 3 418.541 4.218 20 0 HIADHN Cc1cc(NC(=O)c2nccc3ccccc32)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435692948 860974181 /nfs/dbraw/zinc/97/41/81/860974181.db2.gz RWCSACNEXYUZQB-NRFANRHFSA-N 0 3 411.509 4.439 20 0 HIADHN CCOc1ccc([C@@H]2C[C@H]2NC(=O)Nc2ccc(N3CCN(CC)CC3)cc2C)cc1 ZINC000435739477 861020497 /nfs/dbraw/zinc/02/04/97/861020497.db2.gz ARYYCGJVVSYYRG-LADGPHEKSA-N 0 3 422.573 4.213 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(Br)s1 ZINC000435861047 861119694 /nfs/dbraw/zinc/11/96/94/861119694.db2.gz HZURJGWHIUCIHX-DZGCQCFKSA-N 0 3 408.365 4.145 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(Br)cc1)C(=O)NCCc1c[nH]c2ccccc12 ZINC000435893621 861149864 /nfs/dbraw/zinc/14/98/64/861149864.db2.gz QTUXBLYDWSXDFC-LSDHHAIUSA-N 0 3 414.347 4.328 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3ncsc3-c3ccccc3)CC2)C[C@H](C)O1 ZINC000437899025 863270944 /nfs/dbraw/zinc/27/09/44/863270944.db2.gz RGWONQBGCJCFDI-HDICACEKSA-N 0 3 413.587 4.162 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCc3ccccc3N(C)C(C)C)c(C)c2)CC1 ZINC000437935266 863310840 /nfs/dbraw/zinc/31/08/40/863310840.db2.gz PXKCUNZKNBOCSE-UHFFFAOYSA-N 0 3 423.605 4.303 20 0 HIADHN CO[C@@H](C)c1nc(CN2CCCN(Cc3ccc4nc(C)ccc4c3)CC2)cs1 ZINC000438109878 863523060 /nfs/dbraw/zinc/52/30/60/863523060.db2.gz QDQFCOMOSXCFNJ-SFHVURJKSA-N 0 3 410.587 4.415 20 0 HIADHN CCOc1ccc(NC(=O)CN2CCN([C@@H]3CC[C@@](C)(c4ccccc4)C3)CC2)cc1 ZINC000438122882 863541266 /nfs/dbraw/zinc/54/12/66/863541266.db2.gz ROVGACZRLJKHSL-ZEQKJWHPSA-N 0 3 421.585 4.152 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N[C@@H]1C[C@H]1c1cc(F)c(F)c(F)c1 ZINC000438204756 863636625 /nfs/dbraw/zinc/63/66/25/863636625.db2.gz VAGRWFIJINUDQP-IAOVAPTHSA-N 0 3 409.477 4.158 20 0 HIADHN C[C@@H](NC(=O)c1cccc(CN2CCCC2)c1)[C@@H](OC1CCOCC1)c1ccccc1 ZINC000438244801 863702816 /nfs/dbraw/zinc/70/28/16/863702816.db2.gz GOGRQXXPGANIFO-CJFMBICVSA-N 0 3 422.569 4.338 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)Nc2cccc(C(=O)N3CCCC3)c2)CC1 ZINC000438316214 863795951 /nfs/dbraw/zinc/79/59/51/863795951.db2.gz VWAFIXHYISNFJX-UHFFFAOYSA-N 0 3 420.557 4.051 20 0 HIADHN COc1ccc(OC)c(-c2nn(-c3ccccc3)cc2CN2CC[C@H](O)C(C)(C)C2)c1 ZINC000438337908 863810598 /nfs/dbraw/zinc/81/05/98/863810598.db2.gz OBRUFKYJHWZRTG-QHCPKHFHSA-N 0 3 421.541 4.149 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3ccc(CC(F)(F)F)cc3)CC2)C[C@@H](C)O1 ZINC000438373935 863832874 /nfs/dbraw/zinc/83/28/74/863832874.db2.gz KIYFQEQTPCQIIU-HZPDHXFCSA-N 0 3 413.484 4.145 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)Nc3ccc(OC(C)(C)C)cc3)CC2)C[C@H](C)O1 ZINC000438390084 863842749 /nfs/dbraw/zinc/84/27/49/863842749.db2.gz GRMCDVGPESBDGW-ROUUACIJSA-N 0 3 403.567 4.217 20 0 HIADHN Cc1cccc(Oc2ccc(NC(=O)N(CCN(C)C)Cc3ccccn3)cn2)c1C ZINC000438393499 863843757 /nfs/dbraw/zinc/84/37/57/863843757.db2.gz GOICQQGTUSOGIG-UHFFFAOYSA-N 0 3 419.529 4.481 20 0 HIADHN COc1ccc(Oc2ccc(NC(=O)NC[C@H](c3ccccc3)N(C)C)cn2)cc1 ZINC000438402445 863850127 /nfs/dbraw/zinc/85/01/27/863850127.db2.gz ORVYQRWEJSYPLG-OAQYLSRUSA-N 0 3 406.486 4.307 20 0 HIADHN CC1CCN([C@@H](CNC(=O)Nc2ccc3c(c2)NC(=O)CC3)c2cccs2)CC1 ZINC000438424355 863860013 /nfs/dbraw/zinc/86/00/13/863860013.db2.gz USZBIGDCZHRUQM-IBGZPJMESA-N 0 3 412.559 4.228 20 0 HIADHN Cc1cc(NC(=O)N(C)C2CCN(CCc3ccccn3)CC2)ccc1OC(C)C ZINC000438433836 863863744 /nfs/dbraw/zinc/86/37/44/863863744.db2.gz GULZZXZIESBJLH-UHFFFAOYSA-N 0 3 410.562 4.348 20 0 HIADHN COc1ccc(Oc2ccc(NC(=O)NCCN(C)Cc3ccccc3)cn2)cc1 ZINC000438441429 863868393 /nfs/dbraw/zinc/86/83/93/863868393.db2.gz HGQSEVAIDZZLSP-UHFFFAOYSA-N 0 3 406.486 4.136 20 0 HIADHN Cc1c(CSC(C)C)cccc1NC(=O)N1CCN(CC2CCOCC2)CC1 ZINC000438443815 863869259 /nfs/dbraw/zinc/86/92/59/863869259.db2.gz MLISYDYASMUKDL-UHFFFAOYSA-N 0 3 405.608 4.213 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)[C@H]1C[C@H]1c1ccc(Br)cc1 ZINC000438456809 863880697 /nfs/dbraw/zinc/88/06/97/863880697.db2.gz GTRKNKPMOQXAJM-ROUUACIJSA-N 0 3 407.377 4.205 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)[C@@H]1C[C@@H]1c1ccc(Br)cc1 ZINC000438456807 863880905 /nfs/dbraw/zinc/88/09/05/863880905.db2.gz GTRKNKPMOQXAJM-QZTJIDSGSA-N 0 3 407.377 4.205 20 0 HIADHN COC(=O)C(C)(C)c1ccc(NC(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)cc1 ZINC000438458396 863881680 /nfs/dbraw/zinc/88/16/80/863881680.db2.gz SQNMGXXIBIZOFD-UWJYYQICSA-N 0 3 409.530 4.094 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)c1csc(-c2c(F)cccc2F)n1 ZINC000438465458 863887448 /nfs/dbraw/zinc/88/74/48/863887448.db2.gz KLNIBCIDVRPQNL-UHFFFAOYSA-N 0 3 407.511 4.354 20 0 HIADHN CCOc1cc(CN2CC[C@@H](CO)C2)ccc1OCCOc1cccc(Cl)c1 ZINC000438482429 863898418 /nfs/dbraw/zinc/89/84/18/863898418.db2.gz APEHEWHBNMTLTF-GOSISDBHSA-N 0 3 405.922 4.011 20 0 HIADHN COC(=O)c1ccc(NC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)cc1Cl ZINC000438487453 863905458 /nfs/dbraw/zinc/90/54/58/863905458.db2.gz DZNFTUDGQJXGPR-INIZCTEOSA-N 0 3 415.921 4.255 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)c1cccc(C(=O)N(C)c2ccccc2)c1 ZINC000438536172 863962910 /nfs/dbraw/zinc/96/29/10/863962910.db2.gz OZRLGSSUQWZXKS-UHFFFAOYSA-N 0 3 421.566 4.229 20 0 HIADHN CCc1cnc(NC(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)s1 ZINC000438548270 863977981 /nfs/dbraw/zinc/97/79/81/863977981.db2.gz WNTCLVNLTHDHNK-UHFFFAOYSA-N 0 3 400.470 4.320 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)c2cnc3onc(C(C)(C)C)c3c2)CC1 ZINC000438550082 863979341 /nfs/dbraw/zinc/97/93/41/863979341.db2.gz ARHMKBPTLZWARB-UHFFFAOYSA-N 0 3 406.530 4.257 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)c2ccc(-c3nc(C4CC4)no3)cc2)CC1 ZINC000438551563 863981213 /nfs/dbraw/zinc/98/12/13/863981213.db2.gz MFKOVRGMYVCXCI-UHFFFAOYSA-N 0 3 416.525 4.351 20 0 HIADHN CC[C@@H](C)n1ncc2c1nc(C)cc2C(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000438557938 863989236 /nfs/dbraw/zinc/98/92/36/863989236.db2.gz GDPXJAKPMLUQMY-LJQANCHMSA-N 0 3 419.573 4.447 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)c2cccc(Oc3cnccn3)c2)CC1 ZINC000438558687 863990984 /nfs/dbraw/zinc/99/09/84/863990984.db2.gz SFBFAGRAVULTFA-UHFFFAOYSA-N 0 3 402.498 4.006 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)c2cccc(-c3noc(C4CC4)n3)c2)CC1 ZINC000438559366 863991019 /nfs/dbraw/zinc/99/10/19/863991019.db2.gz RGJMFUDURFZPGN-UHFFFAOYSA-N 0 3 416.525 4.351 20 0 HIADHN COc1cc(C(=O)N(Cc2ccccc2)C2CCN(C)CC2)ccc1OCC(C)C ZINC000438563661 863997544 /nfs/dbraw/zinc/99/75/44/863997544.db2.gz WLTSKGUCFZHQDS-UHFFFAOYSA-N 0 3 410.558 4.467 20 0 HIADHN CC(=O)N1CCCc2cc(NC(=O)N(Cc3ccccc3)C3CCN(C)CC3)ccc21 ZINC000438603471 864029705 /nfs/dbraw/zinc/02/97/05/864029705.db2.gz XDNJINQPNNNWPX-UHFFFAOYSA-N 0 3 420.557 4.114 20 0 HIADHN O=C(Nc1c(F)cc(Br)cc1F)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000438649959 864089732 /nfs/dbraw/zinc/08/97/32/864089732.db2.gz WGVIFXUSQOCXHW-AWEZNQCLSA-N 0 3 410.262 4.123 20 0 HIADHN CCN(C(=O)C(=O)Nc1cccc(SC)c1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000438667419 864124753 /nfs/dbraw/zinc/12/47/53/864124753.db2.gz XIKVIMSTWNOBBD-YLJYHZDGSA-N 0 3 411.571 4.031 20 0 HIADHN Cc1cc(Oc2ncccn2)ccc1NC(=O)N(CCN(C)C)Cc1cccs1 ZINC000438689367 864156699 /nfs/dbraw/zinc/15/66/99/864156699.db2.gz BXFAZAMQTGWQNT-UHFFFAOYSA-N 0 3 411.531 4.235 20 0 HIADHN C[C@H](SCC(=O)N(Cc1ccccc1)C1CCN(C)CC1)c1nc2ccccc2[nH]1 ZINC000438712445 864193193 /nfs/dbraw/zinc/19/31/93/864193193.db2.gz HWDLSVILVMOTDC-SFHVURJKSA-N 0 3 422.598 4.480 20 0 HIADHN COc1ccc2nc(C)cc(C(=O)N(Cc3ccccc3)C3CCN(C)CC3)c2c1 ZINC000438713038 864194138 /nfs/dbraw/zinc/19/41/38/864194138.db2.gz IXISGCWBPAYJCI-UHFFFAOYSA-N 0 3 403.526 4.288 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)CN[C@@H](c2ccccc2)C(F)(F)F)CC1 ZINC000438712393 864194850 /nfs/dbraw/zinc/19/48/50/864194850.db2.gz POTROYYMMVXLRT-QFIPXVFZSA-N 0 3 419.491 4.003 20 0 HIADHN CCOC(=O)c1c(C2CC2)csc1NC(=O)N(CCN(C)C)Cc1cccs1 ZINC000438779300 864273100 /nfs/dbraw/zinc/27/31/00/864273100.db2.gz ZBVGEYXCBBGZPW-UHFFFAOYSA-N 0 3 421.588 4.459 20 0 HIADHN COc1cc2c(cc1OC)[C@H](c1ccccc1)N(CCC(=O)N1CCC[C@@H]1C)CC2 ZINC000438790637 864283074 /nfs/dbraw/zinc/28/30/74/864283074.db2.gz LIPMNKVNTWRMOI-BVZFJXPGSA-N 0 3 408.542 4.052 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)[C@@H]3C[C@]34CCCc3ccccc34)c(C)c2)CC1 ZINC000438893560 864375238 /nfs/dbraw/zinc/37/52/38/864375238.db2.gz LFRUZPAPYTVLPZ-OZXSUGGESA-N 0 3 403.570 4.370 20 0 HIADHN O[C@@H]1CCCC[C@H]1[C@H]1CCCCN1Cc1nc(-c2cccc(Br)c2)no1 ZINC000439012300 864463666 /nfs/dbraw/zinc/46/36/66/864463666.db2.gz XJNICRJVWGKWMO-RCCFBDPRSA-N 0 3 420.351 4.405 20 0 HIADHN CN(C)CCN(C(=O)Nc1ccc(C(=O)NC2CCCCC2)cc1)C1CCCC1 ZINC000467905072 881768457 /nfs/dbraw/zinc/76/84/57/881768457.db2.gz ZJYTZBBFOQDZEQ-UHFFFAOYSA-N 0 3 400.567 4.087 20 0 HIADHN Cc1ccc(C(=O)N(CCN(C)C)Cc2cccs2)cc1NC(=O)NC(C)(C)C ZINC000439030027 864484612 /nfs/dbraw/zinc/48/46/12/864484612.db2.gz STQLOOBFTPMWHC-UHFFFAOYSA-N 0 3 416.591 4.181 20 0 HIADHN CS(=O)(=O)Cc1cccc(CN[C@H](c2ccc(Br)s2)C2CC2)c1 ZINC000439135983 864568264 /nfs/dbraw/zinc/56/82/64/864568264.db2.gz QEKGANXHARBTMF-KRWDZBQOSA-N 0 3 414.390 4.296 20 0 HIADHN C[C@H](NC(=O)N(CCN(C)C)Cc1cccs1)c1ccc(OC(F)(F)F)cc1 ZINC000439217397 864636006 /nfs/dbraw/zinc/63/60/06/864636006.db2.gz WBNAVINBWUMFTR-AWEZNQCLSA-N 0 3 415.481 4.481 20 0 HIADHN CCN(C[C@@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)c1ccc(C)c2ncccc12 ZINC000439235599 864651976 /nfs/dbraw/zinc/65/19/76/864651976.db2.gz KEWIGHTWRCPJMD-OAQYLSRUSA-N 0 3 423.582 4.076 20 0 HIADHN CCCOc1ccc(S(=O)(=O)N(CC)C[C@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000439240605 864656868 /nfs/dbraw/zinc/65/68/68/864656868.db2.gz WWIFJTHLYILEJT-NRFANRHFSA-N 0 3 416.587 4.008 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)NCc1ccnc(OC2CCCCC2)c1 ZINC000439321427 864758170 /nfs/dbraw/zinc/75/81/70/864758170.db2.gz CIOZTIPMWJSTRM-UHFFFAOYSA-N 0 3 416.591 4.128 20 0 HIADHN CO[C@H](c1ccc(Cl)cc1)[C@H](C)NC(=O)N(CCN(C)C)Cc1cccs1 ZINC000439355167 864796218 /nfs/dbraw/zinc/79/62/18/864796218.db2.gz ITUAWMLYGISYGU-KXBFYZLASA-N 0 3 409.983 4.251 20 0 HIADHN CO[C@H](c1ccc(Cl)cc1)[C@@H](C)NC(=O)N(CCN(C)C)Cc1cccs1 ZINC000439355162 864797788 /nfs/dbraw/zinc/79/77/88/864797788.db2.gz ITUAWMLYGISYGU-BEFAXECRSA-N 0 3 409.983 4.251 20 0 HIADHN Clc1ccc(OC[C@H]2CCCO2)c(CNCCN2CCc3ccccc3C2)c1 ZINC000439473347 864844782 /nfs/dbraw/zinc/84/47/82/864844782.db2.gz LCAODEOUQFUFLC-JOCHJYFZSA-N 0 3 400.950 4.046 20 0 HIADHN CN(C)[C@@H](CNCc1cc(Cl)ccc1OC[C@H]1CCCO1)c1ccc(F)cc1 ZINC000439478424 864845484 /nfs/dbraw/zinc/84/54/84/864845484.db2.gz MRNMWWFEAVHKSE-RTWAWAEBSA-N 0 3 406.929 4.429 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(Cl)cc2)CC1)[C@H]1C[C@@]12CCc1ccccc12 ZINC000439536505 864869163 /nfs/dbraw/zinc/86/91/63/864869163.db2.gz VQNKXVDRZYTRSV-ILBGXUMGSA-N 0 3 424.972 4.204 20 0 HIADHN COc1ccc(NC(=O)[C@H](C)NCc2ccccc2CN(C)Cc2ccco2)cc1 ZINC000439610868 864932434 /nfs/dbraw/zinc/93/24/34/864932434.db2.gz MSGTVOQNRHRTIV-SFHVURJKSA-N 0 3 407.514 4.037 20 0 HIADHN CN(C)Cc1cccc(NC(=O)C(=O)N(Cc2ccccc2Cl)C2CCCC2)c1 ZINC000439615277 864938920 /nfs/dbraw/zinc/93/89/20/864938920.db2.gz BTIWCSXSXPJUJZ-UHFFFAOYSA-N 0 3 413.949 4.312 20 0 HIADHN Cc1nn(Cc2ccc(F)cc2)c2sc(C(=O)N(CCN(C)C)C(C)C)cc12 ZINC000439622808 864947630 /nfs/dbraw/zinc/94/76/30/864947630.db2.gz OVCCHBKDLRKBBN-UHFFFAOYSA-N 0 3 402.539 4.006 20 0 HIADHN CCc1ccccc1CC(=O)Nc1cc(C)nn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000467958376 881820635 /nfs/dbraw/zinc/82/06/35/881820635.db2.gz KMXDPLHGFOJXSF-QHCPKHFHSA-N 0 3 402.542 4.382 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N(Cc3ccccc3)C[C@](C)(O)CC)c2)CC1 ZINC000439694981 865031198 /nfs/dbraw/zinc/03/11/98/865031198.db2.gz PJTBJMDPQJYLOJ-RUZDIDTESA-N 0 3 424.589 4.024 20 0 HIADHN CC[C@](C)(O)CN(Cc1ccccc1)C(=O)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000439700176 865036813 /nfs/dbraw/zinc/03/68/13/865036813.db2.gz RAUGOHNJHCCVGI-ZCYQVOJMSA-N 0 3 409.574 4.196 20 0 HIADHN CCOc1c(Cl)cc(C(=O)NC2CCN([C@@H](C)c3ccncc3)CC2)cc1OC ZINC000439735568 865067552 /nfs/dbraw/zinc/06/75/52/865067552.db2.gz SUXQYZHGEQYMSP-HNNXBMFYSA-N 0 3 417.937 4.098 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)CCc2ccc(-c3ccccc3)[nH]2)CC1 ZINC000439747551 865077045 /nfs/dbraw/zinc/07/70/45/865077045.db2.gz UBOOBXQEYLJMSP-LJQANCHMSA-N 0 3 402.542 4.351 20 0 HIADHN Cc1ccc(-c2nc(CC(=O)NC3CCN([C@@H](C)c4ccncc4)CC3)cs2)cc1 ZINC000439749481 865079170 /nfs/dbraw/zinc/07/91/70/865079170.db2.gz FGUKRKAWUIOYEM-SFHVURJKSA-N 0 3 420.582 4.398 20 0 HIADHN CC(C)[C@H]1CC[C@@H](C)C[C@H]1OCC(=O)NC1CCN([C@@H](C)c2ccncc2)CC1 ZINC000439759019 865085780 /nfs/dbraw/zinc/08/57/80/865085780.db2.gz SBGYPBMBKLCCJO-IYRWYFENSA-N 0 3 401.595 4.201 20 0 HIADHN CCCCOc1ccc(C(=O)NC2CCN([C@@H](C)c3ccncc3)CC2)cc1OC ZINC000439764037 865088628 /nfs/dbraw/zinc/08/86/28/865088628.db2.gz BFIVVENQVYMUTE-SFHVURJKSA-N 0 3 411.546 4.225 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)CCCOc2ccc(Cl)cc2)CC1 ZINC000439765396 865090149 /nfs/dbraw/zinc/09/01/49/865090149.db2.gz ZSCHWJVTSPNIOY-KRWDZBQOSA-N 0 3 401.938 4.236 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)CCc2cc(Br)cs2)CC1 ZINC000439767506 865092112 /nfs/dbraw/zinc/09/21/12/865092112.db2.gz PMAHHBSNMKYKQM-CQSZACIVSA-N 0 3 422.392 4.180 20 0 HIADHN C[C@H](C(=O)Nc1ccccc1CN1CCC[C@@H](C(N)=O)C1)c1ccc2ccccc2c1 ZINC000439796821 865117516 /nfs/dbraw/zinc/11/75/16/865117516.db2.gz ZFOLWALJMPEVQL-FDDCHVKYSA-N 0 3 415.537 4.279 20 0 HIADHN CCN1CCC[C@@H](CN(C)C(=O)Nc2ccc(F)c(C3CC3)c2)[C@@H]1c1cnn(C)c1 ZINC000439805480 865123034 /nfs/dbraw/zinc/12/30/34/865123034.db2.gz KIRGJALOXGJWPT-HTAPYJJXSA-N 0 3 413.541 4.374 20 0 HIADHN CC(=O)Nc1cccc(C(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)c1C ZINC000468011789 881850466 /nfs/dbraw/zinc/85/04/66/881850466.db2.gz NFBQWDKYVAAXDE-UHFFFAOYSA-N 0 3 421.463 4.176 20 0 HIADHN Cc1ccc(-c2ccnn2C)cc1NC(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000439973227 865266908 /nfs/dbraw/zinc/26/69/08/865266908.db2.gz CBXBTKODYJEOGE-HXUWFJFHSA-N 0 3 409.559 4.416 20 0 HIADHN C[C@@H](N[C@H]1CC(=O)N(Cc2ccccc2C(F)(F)F)C1)c1ccc2c(c1)COC2 ZINC000468027074 881860718 /nfs/dbraw/zinc/86/07/18/881860718.db2.gz BNGWHQQZQDJXSX-KUHUBIRLSA-N 0 3 404.432 4.187 20 0 HIADHN Cc1c([C@H](C)NC[C@@]2(C)CCO[C@H]2C2CC2)nnn1-c1cccc(Br)c1 ZINC000468038659 881868528 /nfs/dbraw/zinc/86/85/28/881868528.db2.gz QJUHHSBSHHEXRT-QTJFZDIUSA-N 0 3 419.367 4.194 20 0 HIADHN CC(C)[C@@H](NC(=O)N1CCN(C2CCC(C(C)C)CC2)CC1)c1nc(C2CC2)no1 ZINC000440146838 865381090 /nfs/dbraw/zinc/38/10/90/865381090.db2.gz DFIJJPKUVHJNCO-LYBXBRPPSA-N 0 3 417.598 4.186 20 0 HIADHN O=C(NCc1cccc(-c2ccccn2)c1)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000440207177 865439947 /nfs/dbraw/zinc/43/99/47/865439947.db2.gz OMZAUDPDIBALIU-DEOSSOPVSA-N 0 3 400.526 4.385 20 0 HIADHN CC(C)N(CCN(C)C)C(=O)NCc1csc(-c2ccc(C(F)(F)F)cc2)n1 ZINC000440243466 865482527 /nfs/dbraw/zinc/48/25/27/865482527.db2.gz IMSNDYVVHHASAQ-UHFFFAOYSA-N 0 3 414.497 4.311 20 0 HIADHN CCc1nc(C)c([C@H](C)N[C@@H]2CC(=O)N(Cc3ccccc3C(F)(F)F)C2)s1 ZINC000468050021 881876208 /nfs/dbraw/zinc/87/62/08/881876208.db2.gz WQHLJKCOOHMOMZ-SWLSCSKDSA-N 0 3 411.493 4.484 20 0 HIADHN CC(C)n1cnnc1-c1ccccc1NC(=O)NCCCN1CCc2ccccc2C1 ZINC000440298617 865557954 /nfs/dbraw/zinc/55/79/54/865557954.db2.gz VKULZSRUFWEGQU-UHFFFAOYSA-N 0 3 418.545 4.096 20 0 HIADHN CCOc1ccccc1NC(=O)[C@@H](C)N1CCN(C2CCC(C(C)C)CC2)CC1 ZINC000440319098 865588343 /nfs/dbraw/zinc/58/83/43/865588343.db2.gz WPWVYFQQMZWHMA-QNGMFEMESA-N 0 3 401.595 4.245 20 0 HIADHN COc1ccc([C@@H](NC[C@H](O)COCc2ccccc2F)c2ccc(F)cc2)cc1 ZINC000440414333 865708580 /nfs/dbraw/zinc/70/85/80/865708580.db2.gz KIWMQMMJSXSVJW-URXFXBBRSA-N 0 3 413.464 4.230 20 0 HIADHN CCCN(Cc1ccn(-c2ccc(F)cc2)n1)C1CCN(c2cc(C)nc(C)n2)CC1 ZINC000440449174 865753563 /nfs/dbraw/zinc/75/35/63/865753563.db2.gz GIUQGZXGVMDDRI-UHFFFAOYSA-N 0 3 422.552 4.299 20 0 HIADHN C[C@@H](C(=O)N1[C@H](C)CCC[C@@H]1C)N1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1 ZINC000440468944 865772884 /nfs/dbraw/zinc/77/28/84/865772884.db2.gz YFOQTHSXOPISOO-XHSDSOJGSA-N 0 3 423.960 4.308 20 0 HIADHN CC(C)[C@@H](C(=O)NC1CCN(CCOc2ccc(Cl)cc2)CC1)c1ccncc1 ZINC000468099551 881906270 /nfs/dbraw/zinc/90/62/70/881906270.db2.gz GCCOZDQXUHTQTO-JOCHJYFZSA-N 0 3 415.965 4.134 20 0 HIADHN O=C(NC[C@@]1(O)CCN(Cc2ccccc2)C1)c1cc(-c2ccccc2)ccc1Cl ZINC000440527653 865804717 /nfs/dbraw/zinc/80/47/17/865804717.db2.gz ZQOVCLOSEUITTL-VWLOTQADSA-N 0 3 420.940 4.374 20 0 HIADHN CCC(CC)(C(=O)Nc1ccc(C(=O)NCCN2CCCC2)cc1)c1ccccc1 ZINC000440638569 865852168 /nfs/dbraw/zinc/85/21/68/865852168.db2.gz MEPGHZYFPNPHTM-UHFFFAOYSA-N 0 3 407.558 4.209 20 0 HIADHN CC(C)n1c2ccccc2nc1[C@@H]1CCCN(C[C@H](O)COc2ccccc2F)C1 ZINC000440655017 865857572 /nfs/dbraw/zinc/85/75/72/865857572.db2.gz OIZBFGDZWNKZKQ-MOPGFXCFSA-N 0 3 411.521 4.376 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)c2cnn(-c3cccc(C(F)(F)F)c3)c2C2CC2)CN1C1CC1 ZINC000440924998 866021511 /nfs/dbraw/zinc/02/15/11/866021511.db2.gz VXGIZSHXLCYWCJ-XJKSGUPXSA-N 0 3 418.463 4.124 20 0 HIADHN CC(C)n1ncc2c1nc(-c1cccs1)cc2C(=O)N[C@H]1C[C@@H](C)N(C2CC2)C1 ZINC000440930720 866027008 /nfs/dbraw/zinc/02/70/08/866027008.db2.gz IDLBJIQVSUONJU-CABCVRRESA-N 0 3 409.559 4.096 20 0 HIADHN CC(=O)CCc1ccc(OCc2cccc(C(=O)N[C@@H]3C[C@H](C)N(C4CC4)C3)c2)cc1 ZINC000440931900 866027989 /nfs/dbraw/zinc/02/79/89/866027989.db2.gz LRZCDDCTGZGZFJ-FDDCHVKYSA-N 0 3 420.553 4.142 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)c2ccc(CSc3nc4ccccc4[nH]3)cc2)CN1C1CC1 ZINC000440931034 866029240 /nfs/dbraw/zinc/02/92/40/866029240.db2.gz IIVZXVHYYPOUCP-QAPCUYQASA-N 0 3 406.555 4.210 20 0 HIADHN Cc1cc(Sc2ccccc2)ccc1NC(=O)NCCN1CCN(C)C(C)(C)C1 ZINC000440932958 866030451 /nfs/dbraw/zinc/03/04/51/866030451.db2.gz ACSNCMOZZHPYLU-UHFFFAOYSA-N 0 3 412.603 4.294 20 0 HIADHN Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)NCCN1CCN(C)C(C)(C)C1 ZINC000440979210 866062009 /nfs/dbraw/zinc/06/20/09/866062009.db2.gz ZRAMBGUITKVTNL-FQEVSTJZSA-N 0 3 424.589 4.283 20 0 HIADHN CNC(=O)Cc1nc(CN2CCc3ccccc3[C@H](c3ccccc3)[C@H]2C)cs1 ZINC000441063890 866145855 /nfs/dbraw/zinc/14/58/55/866145855.db2.gz HJGPLGBLAFEVQX-OSPHWJPCSA-N 0 3 405.567 4.010 20 0 HIADHN CC1(C)CN(CC(=O)N2CCC(OCc3ccccc3)CC2)C[C@H]1c1ccccc1 ZINC000441085150 866179700 /nfs/dbraw/zinc/17/97/00/866179700.db2.gz BDPNFHNSKOODBL-DEOSSOPVSA-N 0 3 406.570 4.320 20 0 HIADHN O=C(CCN1CCC[C@@H](c2nc(C(F)(F)F)cs2)C1)N1CCc2ccccc21 ZINC000441105732 866202213 /nfs/dbraw/zinc/20/22/13/866202213.db2.gz PUQRPGZKGWFPLM-OAHLLOKOSA-N 0 3 409.477 4.321 20 0 HIADHN O=C(CN1CCC[C@H]([C@@H]2CCOC2)C1)N1CCC[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000441199763 866271741 /nfs/dbraw/zinc/27/17/41/866271741.db2.gz DRVAARHRIPHUCW-QKLQHJQFSA-N 0 3 411.373 4.405 20 0 HIADHN CC[C@](C)(COc1ncccc1Cl)NCC(=O)Nc1cc(Cl)ccc1OC ZINC000441304564 866377112 /nfs/dbraw/zinc/37/71/12/866377112.db2.gz HDJHPXMVAYPBPZ-LJQANCHMSA-N 0 3 412.317 4.173 20 0 HIADHN Cc1ccc([C@@H]2CCC[C@@H]2N(C)CC(=O)Nc2ccc(CN3CCOCC3)cc2)cc1 ZINC000441322422 866392121 /nfs/dbraw/zinc/39/21/21/866392121.db2.gz KBTDJLBTMHTIMH-DQEYMECFSA-N 0 3 421.585 4.034 20 0 HIADHN COc1cc(CN(C)C(=O)N[C@H]2C[C@H](C)N(C3CC3)C2)ccc1OCc1ccccc1 ZINC000441357001 866427566 /nfs/dbraw/zinc/42/75/66/866427566.db2.gz MWFRSVUNKPDOGN-RXVVDRJESA-N 0 3 423.557 4.041 20 0 HIADHN C[C@H](C(=O)N(C)Cc1c(F)cccc1Cl)N1CC[C@H](COCc2ccccc2)C1 ZINC000441383700 866456038 /nfs/dbraw/zinc/45/60/38/866456038.db2.gz WSKPEUGPETYTQX-MJGOQNOKSA-N 0 3 418.940 4.365 20 0 HIADHN COc1cc(-c2nnc(CN3CCC[C@H]3Cc3ccccc3C)o2)cc(OC)c1OC ZINC000441386676 866459384 /nfs/dbraw/zinc/45/93/84/866459384.db2.gz QMMFPZOIHVTYAF-IBGZPJMESA-N 0 3 423.513 4.278 20 0 HIADHN COc1cc(-c2nnc(CN3CCC[C@H]3Cc3ccc(C)cc3)o2)cc(OC)c1OC ZINC000441389580 866461169 /nfs/dbraw/zinc/46/11/69/866461169.db2.gz WPCXPLYPZMLWCQ-IBGZPJMESA-N 0 3 423.513 4.278 20 0 HIADHN COCCN(C(=O)N[C@@H]1C[C@H](C)N(C2CC2)C1)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000441397334 866469945 /nfs/dbraw/zinc/46/99/45/866469945.db2.gz QLKFEEXJEABSBB-RLFYNMQTSA-N 0 3 413.484 4.050 20 0 HIADHN CN(C)[C@H](CNC(=O)N1CCC[C@H]1c1nc2cc(Cl)ccc2[nH]1)c1ccccc1 ZINC000441417892 866494368 /nfs/dbraw/zinc/49/43/68/866494368.db2.gz HATFWQXSIRHVJN-VQTJNVASSA-N 0 3 411.937 4.366 20 0 HIADHN O=c1nc(CN2CC[C@H]3[C@H](CCC[N@@H+]3C3CC3)C2)[n-]c2scc(-c3ccco3)c21 ZINC000441421787 866498145 /nfs/dbraw/zinc/49/81/45/866498145.db2.gz OQLJQTCRKCEPKN-PBHICJAKSA-N 0 3 410.543 4.106 20 0 HIADHN O=c1nc(CN2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)[n-]c2scc(-c3ccco3)c21 ZINC000441421787 866498147 /nfs/dbraw/zinc/49/81/47/866498147.db2.gz OQLJQTCRKCEPKN-PBHICJAKSA-N 0 3 410.543 4.106 20 0 HIADHN CC(C)c1ncc(CN(C)C(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)cn1 ZINC000441424238 866502005 /nfs/dbraw/zinc/50/20/05/866502005.db2.gz PEVMMYGTNOSEAK-OAQYLSRUSA-N 0 3 420.479 4.013 20 0 HIADHN CSc1ccc(CN(C)C(=O)CN2CC[C@@H](CSc3ccccc3)C2)cc1 ZINC000441510432 866590339 /nfs/dbraw/zinc/59/03/39/866590339.db2.gz CYWHHVXZUQXUFN-LJQANCHMSA-N 0 3 400.613 4.481 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)NC[C@@]1(C)CCCS1 ZINC000468140051 881994660 /nfs/dbraw/zinc/99/46/60/881994660.db2.gz KJLXPMXPABXALE-GOSISDBHSA-N 0 3 403.514 4.064 20 0 HIADHN C[C@@H](NC(=O)C(=O)Nc1ccc2c(c1)Cc1ccccc1-2)[C@@H](c1ccccc1)N(C)C ZINC000441705073 866813674 /nfs/dbraw/zinc/81/36/74/866813674.db2.gz RGBHGQVCILXVSR-OSPHWJPCSA-N 0 3 413.521 4.004 20 0 HIADHN Cc1nn(C(C)(C)C)cc1[C@H](C)NC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000468159183 882024854 /nfs/dbraw/zinc/02/48/54/882024854.db2.gz KZLSXIVZTARLAN-RXVVDRJESA-N 0 3 411.594 4.314 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)CC(C)(C)CC(=O)c3ccccc3)CC2)C[C@H](C)O1 ZINC000442024237 867071719 /nfs/dbraw/zinc/07/17/19/867071719.db2.gz XZEBMYLPIDHXEY-PMACEKPBSA-N 0 3 414.590 4.024 20 0 HIADHN Cc1nc(-c2ccc(C(=O)N(C)C3CCN(CCc4ccccn4)CC3)cc2)cs1 ZINC000442037124 867079042 /nfs/dbraw/zinc/07/90/42/867079042.db2.gz UWKHMRCIXCDAHC-UHFFFAOYSA-N 0 3 420.582 4.293 20 0 HIADHN Cc1c(NC(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)cnn1CCC(C)C ZINC000442163238 867184866 /nfs/dbraw/zinc/18/48/66/867184866.db2.gz GIGWPTBWCSTDKE-UHFFFAOYSA-N 0 3 407.509 4.112 20 0 HIADHN COCCc1ccccc1NC(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000468203284 882083094 /nfs/dbraw/zinc/08/30/94/882083094.db2.gz ZIXQDDZAWRLFAB-OAQYLSRUSA-N 0 3 406.448 4.269 20 0 HIADHN CC(C)c1ccc([C@H]2CCCCN2C(=O)NCCN2CCN(C)C(C)(C)C2)cc1 ZINC000442611434 867556721 /nfs/dbraw/zinc/55/67/21/867556721.db2.gz SSIGWDQEEVEBIN-JOCHJYFZSA-N 0 3 400.611 4.073 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](N[C@H]2Cc3[nH]c4ccccc4c3C2)c2ccccc2)c1 ZINC000442789502 867675471 /nfs/dbraw/zinc/67/54/71/867675471.db2.gz HIEXPCGNFQXPIG-KBMIEXCESA-N 0 3 416.546 4.418 20 0 HIADHN COCc1nc(CNC2CCN(Cc3cccnc3)CC2)c(-c2ccccc2)s1 ZINC000442863456 867702016 /nfs/dbraw/zinc/70/20/16/867702016.db2.gz RBSAEDTVNMWEBV-UHFFFAOYSA-N 0 3 408.571 4.106 20 0 HIADHN C[C@@H](NC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1)c1ccc(Br)s1 ZINC000443166802 867853950 /nfs/dbraw/zinc/85/39/50/867853950.db2.gz JLQHRPJADBDAFC-MRRJBJDNSA-N 0 3 408.365 4.316 20 0 HIADHN C[C@@H](NC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1)c1ccc(Br)s1 ZINC000443166799 867854074 /nfs/dbraw/zinc/85/40/74/867854074.db2.gz JLQHRPJADBDAFC-IFIJOSMWSA-N 0 3 408.365 4.316 20 0 HIADHN C[C@@H](NCCCS(=O)(=O)c1ccc(F)cc1)c1ccc(Br)s1 ZINC000443337812 867912967 /nfs/dbraw/zinc/91/29/67/867912967.db2.gz UHOJKVUINITJFQ-LLVKDONJSA-N 0 3 406.342 4.164 20 0 HIADHN O[C@H](Cc1ccccc1C(F)(F)F)CN1CCC[C@@H]1c1cccc2c1OCCO2 ZINC000443624481 868194537 /nfs/dbraw/zinc/19/45/37/868194537.db2.gz FBZRSORYJUMJRV-VQIMIIECSA-N 0 3 407.432 4.217 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N(CCCO)[C@@H]1CCc2ccccc21)c1ccsc1 ZINC000443630775 868205812 /nfs/dbraw/zinc/20/58/12/868205812.db2.gz VTEZLMWPBFQUKM-YADHBBJMSA-N 0 3 415.603 4.213 20 0 HIADHN C[C@H]1CN(CCCCNC(=O)CSCc2ccc(Cl)cc2Cl)C[C@H](C)O1 ZINC000443671713 868279108 /nfs/dbraw/zinc/27/91/08/868279108.db2.gz DCYQQVMHXVLZSJ-GJZGRUSLSA-N 0 3 419.418 4.232 20 0 HIADHN Cc1nc(-c2ccc(C)cc2C)sc1C(=O)NCCCCN1C[C@@H](C)O[C@H](C)C1 ZINC000443674687 868280391 /nfs/dbraw/zinc/28/03/91/868280391.db2.gz NAAUDSDBQTZNFT-QZTJIDSGSA-N 0 3 415.603 4.355 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)CCCOc2ccc(Cl)cc2Cl)C[C@@H](C)O1 ZINC000443675547 868282107 /nfs/dbraw/zinc/28/21/07/868282107.db2.gz NRLWLYSLAYGRSM-HZPDHXFCSA-N 0 3 417.377 4.158 20 0 HIADHN C[C@H]1CN(CCCCNC(=O)Cc2csc(-c3ccc(Cl)cc3)n2)C[C@H](C)O1 ZINC000443684590 868288662 /nfs/dbraw/zinc/28/86/62/868288662.db2.gz TYVCWFKKCHAHTD-HOTGVXAUSA-N 0 3 421.994 4.012 20 0 HIADHN CC[C@H](CC(=O)Nc1cccc(CN2CCC(CO)CC2)c1)c1ccc(OC)cc1 ZINC000443802466 868339085 /nfs/dbraw/zinc/33/90/85/868339085.db2.gz OOOORQAUWPAGFF-OAQYLSRUSA-N 0 3 410.558 4.422 20 0 HIADHN CCOC(=O)c1c2c(sc1NC(=O)c1cncc(C)c1)C(C)(C)NC(C)(C)C2 ZINC000443816072 868350346 /nfs/dbraw/zinc/35/03/46/868350346.db2.gz MBGNECCWDHSLPV-UHFFFAOYSA-N 0 3 401.532 4.040 20 0 HIADHN CC(C)CN(CCN(C)C)C(=O)Nc1cccc(C(=O)Nc2ccc(Cl)cn2)c1 ZINC000443911153 868446839 /nfs/dbraw/zinc/44/68/39/868446839.db2.gz WQKNAHXSRGMBBI-UHFFFAOYSA-N 0 3 417.941 4.039 20 0 HIADHN COc1ccc(CNCCc2nc(C(F)(F)F)cs2)c(OCc2cccnc2)c1 ZINC000443997626 868518150 /nfs/dbraw/zinc/51/81/50/868518150.db2.gz XQMAJDIGTFREES-UHFFFAOYSA-N 0 3 423.460 4.477 20 0 HIADHN COc1ccc(C2(NCc3cc(Cl)c(OC)c(OC)c3)CCOCC2)cc1F ZINC000444007296 868530406 /nfs/dbraw/zinc/53/04/06/868530406.db2.gz AYAOESNUDVJPPD-UHFFFAOYSA-N 0 3 409.885 4.300 20 0 HIADHN CC(=O)N(c1nc(CNCCN2CCCC(C)(C)C2)cs1)c1ccc(F)cc1 ZINC000444013916 868536512 /nfs/dbraw/zinc/53/65/12/868536512.db2.gz OFJSRIAEHAGCEE-UHFFFAOYSA-N 0 3 404.555 4.178 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)N[C@H](CC(F)(F)F)c3ccc(C(F)(F)F)cc3)[C@H]2C1 ZINC000444021298 868548594 /nfs/dbraw/zinc/54/85/94/868548594.db2.gz DWWRWGJFAAQKNY-BMFZPTHFSA-N 0 3 423.401 4.435 20 0 HIADHN Cc1c(CN2CCSCC2)cccc1NS(=O)(=O)c1cc(F)cc(Cl)c1 ZINC000444028553 868560302 /nfs/dbraw/zinc/56/03/02/868560302.db2.gz GQBCEZAVMUMBPG-UHFFFAOYSA-N 0 3 414.955 4.137 20 0 HIADHN Cc1ccc([C@@H]2CCC[C@@H]2N(C)CC(=O)Nc2cccc(C(=O)NC3CC3)c2)cc1 ZINC000444240905 868689248 /nfs/dbraw/zinc/68/92/48/868689248.db2.gz MRHCDYLJVCYKSZ-GOTSBHOMSA-N 0 3 405.542 4.094 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)CCCSc3ccc(OC)cc3)c2)CC1 ZINC000444334874 868761674 /nfs/dbraw/zinc/76/16/74/868761674.db2.gz DORNPFDBRZIRLY-UHFFFAOYSA-N 0 3 413.587 4.348 20 0 HIADHN COc1ccc2sc(C(=O)Nc3cccc(CN4CCC(O)CC4)c3)c(C)c2c1 ZINC000444462734 868837809 /nfs/dbraw/zinc/83/78/09/868837809.db2.gz VSCQGDCFXCXMEW-UHFFFAOYSA-N 0 3 410.539 4.427 20 0 HIADHN C[C@@H](Sc1ccc(Cl)cc1)C(=O)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000444462068 868838216 /nfs/dbraw/zinc/83/82/16/868838216.db2.gz UNHQKEACBDGMMJ-OAHLLOKOSA-N 0 3 404.963 4.416 20 0 HIADHN C[C@H](NCCCS(=O)(=O)c1ccc(F)cc1)c1ccc(Br)s1 ZINC000444768531 868993829 /nfs/dbraw/zinc/99/38/29/868993829.db2.gz UHOJKVUINITJFQ-NSHDSACASA-N 0 3 406.342 4.164 20 0 HIADHN C[C@@H](c1nc(Cc2ccc(F)cc2)no1)N1CCC[C@H](c2ncc(C(F)(F)F)[nH]2)C1 ZINC000444801368 869014736 /nfs/dbraw/zinc/01/47/36/869014736.db2.gz BQTXIOZUWVQLKA-JSGCOSHPSA-N 0 3 423.414 4.482 20 0 HIADHN Cc1cc(CN(C)C(=O)Nc2ccc(CCN3CCSCC3)cc2)ccc1F ZINC000445241798 869297098 /nfs/dbraw/zinc/29/70/98/869297098.db2.gz SDFOLUBWVYDFKF-UHFFFAOYSA-N 0 3 401.551 4.389 20 0 HIADHN C[C@H](c1nc(-c2csc(I)c2)no1)N1[C@H](C)CC[C@H]1C ZINC000445301824 869355098 /nfs/dbraw/zinc/35/50/98/869355098.db2.gz VKLODUYLLCSZDG-OPRDCNLKSA-N 0 3 403.289 4.337 20 0 HIADHN Cc1ccc(NC(=O)Cc2noc([C@H]3CCCN(Cc4cccc(F)c4)C3)n2)c(C)c1 ZINC000445356525 869422623 /nfs/dbraw/zinc/42/26/23/869422623.db2.gz KNRWJYMRMZSWQM-IBGZPJMESA-N 0 3 422.504 4.386 20 0 HIADHN Fc1cccc(CN2CCC[C@H](c3nc(-c4ccc(OC(F)F)cn4)no3)C2)c1 ZINC000445514023 869576592 /nfs/dbraw/zinc/57/65/92/869576592.db2.gz OEYFHQSHCFPJLG-AWEZNQCLSA-N 0 3 404.392 4.252 20 0 HIADHN COc1cccc([C@@H](CNC(=O)CCc2cn(C)c3ccccc23)N2CCCC2)c1 ZINC000445651697 869722021 /nfs/dbraw/zinc/72/20/21/869722021.db2.gz DIFAXTSPOOJEAA-XMMPIXPASA-N 0 3 405.542 4.073 20 0 HIADHN COc1cc(F)c(NC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)cc1F ZINC000468385677 882330546 /nfs/dbraw/zinc/33/05/46/882330546.db2.gz XACUPXYPBXRNNQ-LJQANCHMSA-N 0 3 414.374 4.367 20 0 HIADHN C[C@H](N[C@@H]1CCCC[C@H]1C(N)=O)c1nc2cc(Cl)ccc2n1Cc1ccccc1 ZINC000445788203 869824938 /nfs/dbraw/zinc/82/49/38/869824938.db2.gz YPISJWOKFNWTSC-KFKAGJAMSA-N 0 3 410.949 4.433 20 0 HIADHN CN(CCC(=O)Nc1ccccc1F)[C@H]1CCOc2ccc(Br)cc21 ZINC000445881753 869870469 /nfs/dbraw/zinc/87/04/69/869870469.db2.gz VPWIQOUNFYCXBP-KRWDZBQOSA-N 0 3 407.283 4.372 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)CCCc2cc(Cl)sc2Cl)CC1 ZINC000445924588 869891137 /nfs/dbraw/zinc/89/11/37/869891137.db2.gz IISCUHDMGKAUHZ-UHFFFAOYSA-N 0 3 407.407 4.383 20 0 HIADHN O=C(Cc1ccc(Cl)c(F)c1)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000468412354 882356654 /nfs/dbraw/zinc/35/66/54/882356654.db2.gz SBHCXFXNYXRQDR-SFHVURJKSA-N 0 3 412.896 4.304 20 0 HIADHN Cn1c(CN[C@@H]2CCC[C@@H]2c2ccccc2C(F)(F)F)nc2ccccc2c1=O ZINC000446005226 869970676 /nfs/dbraw/zinc/97/06/76/869970676.db2.gz XOXWQMJHRPQOHS-CRAIPNDOSA-N 0 3 401.432 4.378 20 0 HIADHN C[C@H]1CN(c2cccc3cnccc32)CCN1C(=O)Nc1cccc(CN(C)C)c1 ZINC000446111809 870059239 /nfs/dbraw/zinc/05/92/39/870059239.db2.gz BUQNCKDQQBSLCW-SFHVURJKSA-N 0 3 403.530 4.039 20 0 HIADHN Cn1cc(NC(=O)N[C@@H](CN2CCc3ccccc3C2)C(C)(C)C)c(C(F)(F)F)n1 ZINC000446276898 870211679 /nfs/dbraw/zinc/21/16/79/870211679.db2.gz NMTQTBXFHCZRPS-KRWDZBQOSA-N 0 3 423.483 4.033 20 0 HIADHN CC(C)Oc1cc(Br)cc(C(=O)N(CCN(C)C)Cc2ccco2)c1 ZINC000446441342 870359912 /nfs/dbraw/zinc/35/99/12/870359912.db2.gz WGEUNTGPFHZJHJ-UHFFFAOYSA-N 0 3 409.324 4.033 20 0 HIADHN Cc1ccc(C(=O)N(CCN(C)C)Cc2ccco2)cc1NC(=O)c1ccccc1 ZINC000446445203 870364714 /nfs/dbraw/zinc/36/47/14/870364714.db2.gz SORSFLFAXWHSGK-UHFFFAOYSA-N 0 3 405.498 4.044 20 0 HIADHN COc1ccccc1-c1csc([C@H]2CCCN(C(=O)[C@H](C(C)C)N(C)C)C2)n1 ZINC000446489374 870402587 /nfs/dbraw/zinc/40/25/87/870402587.db2.gz YEERTFGCTBENHX-JXFKEZNVSA-N 0 3 401.576 4.111 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)Nc2cccnc2-c2ccc(Cl)s2)CC1 ZINC000446590874 870499333 /nfs/dbraw/zinc/49/93/33/870499333.db2.gz QCZWZABVVWYAMI-UHFFFAOYSA-N 0 3 422.982 4.474 20 0 HIADHN CC(C)CC1(CNC(=O)NCc2ccccc2CN2CCC(O)CC2)CCCC1 ZINC000446748897 870656127 /nfs/dbraw/zinc/65/61/27/870656127.db2.gz VDGKSYXOWIYAQN-UHFFFAOYSA-N 0 3 401.595 4.049 20 0 HIADHN COc1ccc2c(c1)[C@@H](N[C@H](C)c1ccc(S(=O)(=O)N(C)C)cc1)CCCS2 ZINC000446749904 870658607 /nfs/dbraw/zinc/65/86/07/870658607.db2.gz CTSMQNKYANKVFV-QRWLVFNGSA-N 0 3 420.600 4.223 20 0 HIADHN COc1ccc([C@@H](CCn2cncn2)NCc2csc(Br)c2)cc1 ZINC000446753159 870662743 /nfs/dbraw/zinc/66/27/43/870662743.db2.gz QSTMWBMCDAMAOO-MRXNPFEDSA-N 0 3 407.337 4.032 20 0 HIADHN COc1ccc([C@H](CCn2cncn2)NCc2csc(Br)c2)cc1 ZINC000446753156 870663931 /nfs/dbraw/zinc/66/39/31/870663931.db2.gz QSTMWBMCDAMAOO-INIZCTEOSA-N 0 3 407.337 4.032 20 0 HIADHN Cc1nn(-c2ccc(Br)cc2)cc1CN1CCC[C@H](c2nccn2C)C1 ZINC000446830854 870746209 /nfs/dbraw/zinc/74/62/09/870746209.db2.gz XOPCNYNULZWOJV-INIZCTEOSA-N 0 3 414.351 4.056 20 0 HIADHN FC(F)(F)c1cccc(C2(NCc3cc(-c4cccnc4)n[nH]3)CCOCC2)c1 ZINC000446831608 870747782 /nfs/dbraw/zinc/74/77/82/870747782.db2.gz GUIQJCYHMNTXSV-UHFFFAOYSA-N 0 3 402.420 4.286 20 0 HIADHN COc1ccc([C@@H](CCn2cncn2)NCc2ccc(Oc3ccccc3)nc2)cc1 ZINC000446838249 870756149 /nfs/dbraw/zinc/75/61/49/870756149.db2.gz GIRBXPANBDKPFT-HSZRJFAPSA-N 0 3 415.497 4.395 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1cc(Cl)ccc1OC[C@H]1CCCO1 ZINC000446912192 870828723 /nfs/dbraw/zinc/82/87/23/870828723.db2.gz WZMNKDIUACNJEH-GOSISDBHSA-N 0 3 421.925 4.087 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1ccc(-n2nccc2C(F)(F)F)cc1 ZINC000446925842 870839513 /nfs/dbraw/zinc/83/95/13/870839513.db2.gz SQMFIMGIDZWTCA-UHFFFAOYSA-N 0 3 421.423 4.080 20 0 HIADHN Cc1nc(-c2ccc(C)c(NC(=O)N3CC[C@H](C)N(Cc4ccccc4)CC3)c2)n[nH]1 ZINC000447054123 870932453 /nfs/dbraw/zinc/93/24/53/870932453.db2.gz KMMBSRABVGJEOH-SFHVURJKSA-N 0 3 418.545 4.217 20 0 HIADHN CS(=O)(=O)c1ccc(CNC/C=C/c2ccc(F)cc2F)cc1C(F)(F)F ZINC000447093629 870987751 /nfs/dbraw/zinc/98/77/51/870987751.db2.gz LHCQVASLUGBQQC-NSCUHMNNSA-N 0 3 405.388 4.190 20 0 HIADHN COCCN(CCN(C)C)C(=O)N[C@@H](C)c1nc(-c2ccc(Cl)cc2)c(C)s1 ZINC000447121235 871022301 /nfs/dbraw/zinc/02/23/01/871022301.db2.gz KFCPSRSPZGLTCM-AWEZNQCLSA-N 0 3 424.998 4.053 20 0 HIADHN O=C(NCC1(c2c(Cl)cccc2Cl)CCC1)[C@@H]1CCCN1C1CCOCC1 ZINC000447183617 871076332 /nfs/dbraw/zinc/07/63/32/871076332.db2.gz LTNOZBPPGKYYII-SFHVURJKSA-N 0 3 411.373 4.175 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1cnn(-c2ccccc2F)c1 ZINC000447191167 871083584 /nfs/dbraw/zinc/08/35/84/871083584.db2.gz INVCGWYJLJLBDL-GOSISDBHSA-N 0 3 407.493 4.140 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N[C@@H](C)c1ccc(Cl)cc1Cl ZINC000447366226 871272920 /nfs/dbraw/zinc/27/29/20/871272920.db2.gz RFSVWCWLNKBERF-ZDUSSCGKSA-N 0 3 408.329 4.179 20 0 HIADHN CCOc1ccccc1NC(=O)CCN1CCN(c2cccc3cnccc32)C[C@H]1C ZINC000447386708 871293329 /nfs/dbraw/zinc/29/33/29/871293329.db2.gz RNJYQWYCTRKVKS-LJQANCHMSA-N 0 3 418.541 4.173 20 0 HIADHN COc1ccccc1-c1csc([C@H]2CCCN(C[C@H](O)COc3ccccc3)C2)n1 ZINC000447388175 871300050 /nfs/dbraw/zinc/30/00/50/871300050.db2.gz WAFNPMNDHJLFFW-OALUTQOASA-N 0 3 424.566 4.438 20 0 HIADHN COc1ccccc1-c1csc([C@H]2CCCN(C[C@H](O)CC(F)(F)F)C2)n1 ZINC000447402631 871311757 /nfs/dbraw/zinc/31/17/57/871311757.db2.gz LBFLQXJPKBIXPA-UONOGXRCSA-N 0 3 400.466 4.311 20 0 HIADHN Cc1ccc(CN[C@H](c2ccc(Br)cc2)C2CC2)cc1S(C)(=O)=O ZINC000447571404 871470337 /nfs/dbraw/zinc/47/03/37/871470337.db2.gz YAIBKJGBMRWYPK-IBGZPJMESA-N 0 3 408.361 4.402 20 0 HIADHN CCOC1CC(CN[C@H]2CCCc3c(Cl)sc(Cl)c32)(N2CCOCC2)C1 ZINC000447581664 871485504 /nfs/dbraw/zinc/48/55/04/871485504.db2.gz UMSRUYMJCUJBBL-BTUGKURYSA-N 0 3 419.418 4.292 20 0 HIADHN CCOC(=O)c1oc2c(c1C)[C@@H](N[C@H]1CCN(c3ncccc3Cl)C1)CCC2 ZINC000447587465 871494239 /nfs/dbraw/zinc/49/42/39/871494239.db2.gz QKIWYXHOIOLJJG-HOCLYGCPSA-N 0 3 403.910 4.059 20 0 HIADHN CCOC(=O)c1oc2c(c1C)[C@@H](N[C@@H]1CCN(c3ncccc3Cl)C1)CCC2 ZINC000447587466 871494952 /nfs/dbraw/zinc/49/49/52/871494952.db2.gz QKIWYXHOIOLJJG-ZBFHGGJFSA-N 0 3 403.910 4.059 20 0 HIADHN FC(F)C(F)(F)COCCN[C@H]1CCCOc2ccc(Br)cc21 ZINC000447599870 871508636 /nfs/dbraw/zinc/50/86/36/871508636.db2.gz ZADNAZOBEQWLKG-LBPRGKRZSA-N 0 3 400.210 4.169 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N3CCC(F)(c4ccccc4)CC3)cc2)CC1 ZINC000447606070 871514677 /nfs/dbraw/zinc/51/46/77/871514677.db2.gz BYVFWFJPIPQMIB-UHFFFAOYSA-N 0 3 409.549 4.318 20 0 HIADHN COc1ccc(CNC(=O)C2CCN(CCCc3c(F)cccc3Cl)CC2)cc1 ZINC000447742521 871688991 /nfs/dbraw/zinc/68/89/91/871688991.db2.gz QFKXRICATUSNTE-UHFFFAOYSA-N 0 3 418.940 4.449 20 0 HIADHN Cc1nc2ccc(Br)cc2c(N2C[C@H](C)OC3(CCOCC3)C2)c1C ZINC000447816368 871747563 /nfs/dbraw/zinc/74/75/63/871747563.db2.gz KDGBZTCTVWZEDJ-ZDUSSCGKSA-N 0 3 405.336 4.388 20 0 HIADHN CO[C@H]1CCOc2c(NC(=O)N3CCCN(Cc4ccccc4)C[C@H]3C)cccc21 ZINC000448040941 871873530 /nfs/dbraw/zinc/87/35/30/871873530.db2.gz ZEZLIOMTEACODO-GCJKJVERSA-N 0 3 409.530 4.285 20 0 HIADHN CCN(C(=O)Nc1cccc2c1OCC[C@@H]2OC)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000448042045 871874755 /nfs/dbraw/zinc/87/47/55/871874755.db2.gz HQAXEOMIKNDCQV-KNQAVFIVSA-N 0 3 409.530 4.285 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1cccc2c1OCC[C@H]2OC)c1ccsc1 ZINC000448043852 871876098 /nfs/dbraw/zinc/87/60/98/871876098.db2.gz OWRSBZXPEJOBRD-RTBURBONSA-N 0 3 403.548 4.423 20 0 HIADHN CO[C@H]1CCOc2c(NC(=O)NC[C@@H](C(C)C)N3CCc4ccccc4C3)cccc21 ZINC000448053520 871884019 /nfs/dbraw/zinc/88/40/19/871884019.db2.gz ZAXYWHZLEMQYSU-GOTSBHOMSA-N 0 3 423.557 4.361 20 0 HIADHN CO[C@H]1CCOc2c(NC(=O)N3CC[C@H](C)N(Cc4ccccc4)CC3)cccc21 ZINC000448055046 871884939 /nfs/dbraw/zinc/88/49/39/871884939.db2.gz FDFQOANMOGMSDG-AVRDEDQJSA-N 0 3 409.530 4.285 20 0 HIADHN CCN(Cc1nc(-c2ccc(C)c(OC)c2)no1)CC1CCN(c2ccccn2)CC1 ZINC000448120778 871987133 /nfs/dbraw/zinc/98/71/33/871987133.db2.gz AZZCCIUVLJSMLM-UHFFFAOYSA-N 0 3 421.545 4.187 20 0 HIADHN O=S(=O)(c1c(Cl)cc(Cl)cc1Cl)N1CC[C@H]2[C@@H](CCCN2C2CC2)C1 ZINC000448164133 872041102 /nfs/dbraw/zinc/04/11/02/872041102.db2.gz IETAESTWAIWYNQ-ZBEGNZNMSA-N 0 3 423.793 4.284 20 0 HIADHN C[C@H](CSCc1ccccc1)C(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000448240585 872156115 /nfs/dbraw/zinc/15/61/15/872156115.db2.gz OEOYVQWAWJMAJP-LJQANCHMSA-N 0 3 412.599 4.399 20 0 HIADHN CCOc1c(Br)cc(CN(CCOC)[C@@H]2CCCSC2)cc1OC ZINC000448361526 872310887 /nfs/dbraw/zinc/31/08/87/872310887.db2.gz XJUPCUXIGTVVEP-OAHLLOKOSA-N 0 3 418.397 4.200 20 0 HIADHN CCCN(CCN1CCN(CC)CC1)C(=O)N[C@@H](C)c1ccc(C(C)(C)C)cc1 ZINC000460119075 872588958 /nfs/dbraw/zinc/58/89/58/872588958.db2.gz XDBXGJCSOCLOGF-FQEVSTJZSA-N 0 3 402.627 4.104 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)c2ccc(NC(=O)CC(C)C)c(F)c2)c1 ZINC000460149465 872669633 /nfs/dbraw/zinc/66/96/33/872669633.db2.gz HVJSXGKPFVMXPU-UHFFFAOYSA-N 0 3 413.537 4.323 20 0 HIADHN Cc1nnc(-c2ccc(C(=O)N[C@H](CN3CCc4ccccc4C3)C(C)(C)C)cc2)o1 ZINC000468575152 882643547 /nfs/dbraw/zinc/64/35/47/882643547.db2.gz LPFOSGDSBFJZPB-JOCHJYFZSA-N 0 3 418.541 4.248 20 0 HIADHN CCCN(CCN1CCN(CC)CC1)C(=O)N[C@H](C)c1ccc(SC(C)C)cc1 ZINC000460254254 872843594 /nfs/dbraw/zinc/84/35/94/872843594.db2.gz DDIGGBVHMFPOQQ-HXUWFJFHSA-N 0 3 420.667 4.307 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)Nc1ccc(NC(=O)c2ccccc2)nc1 ZINC000460268967 872858431 /nfs/dbraw/zinc/85/84/31/872858431.db2.gz JMYIDPGBAARIII-UHFFFAOYSA-N 0 3 414.465 4.394 20 0 HIADHN O=C(CC1(N2CCOCC2)CCCC1)N1CCC[C@H]1Cc1c(F)cccc1Cl ZINC000468594109 882683502 /nfs/dbraw/zinc/68/35/02/882683502.db2.gz DLCPAJDXDCIHHZ-KRWDZBQOSA-N 0 3 408.945 4.048 20 0 HIADHN COc1ccc(CNCc2ccc(C)nc2-n2cc(Cl)cn2)cc1OC(F)F ZINC000468598559 882694960 /nfs/dbraw/zinc/69/49/60/882694960.db2.gz MQJSTVCXNVCZTM-UHFFFAOYSA-N 0 3 408.836 4.129 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)c3cc(Br)ccc3C)cc2)CC1 ZINC000460708092 873492279 /nfs/dbraw/zinc/49/22/79/873492279.db2.gz HDKLAVCFGUDRLX-UHFFFAOYSA-N 0 3 416.363 4.147 20 0 HIADHN CCOc1ccc(NC(=O)c2ccc(CN3CCC(CO)CC3)cc2)c2ncccc12 ZINC000468619420 882739089 /nfs/dbraw/zinc/73/90/89/882739089.db2.gz HFRXWTOABSDVTD-UHFFFAOYSA-N 0 3 419.525 4.090 20 0 HIADHN CC[C@@H](CNC(=O)c1ccc(OCc2ccccn2)cc1)N1CCc2ccccc2C1 ZINC000460772954 873622419 /nfs/dbraw/zinc/62/24/19/873622419.db2.gz YYGUJOUEWKOARY-DEOSSOPVSA-N 0 3 415.537 4.227 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)c1ccc(OCc2ccccn2)cc1 ZINC000460784070 873640750 /nfs/dbraw/zinc/64/07/50/873640750.db2.gz RCIGHOAURYSYCI-NRFANRHFSA-N 0 3 407.539 4.289 20 0 HIADHN Fc1cccc(CN2CCC[C@H](c3nc(-c4ccc(Br)cn4)no3)C2)c1 ZINC000460822647 873706883 /nfs/dbraw/zinc/70/68/83/873706883.db2.gz FUHTUBHQADTYOG-AWEZNQCLSA-N 0 3 417.282 4.413 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N1CCCC[C@H]1c1nnc(C2CCC2)o1 ZINC000460901198 873810075 /nfs/dbraw/zinc/81/00/75/873810075.db2.gz WXUJJILJTGSCHX-UIFIKXQLSA-N 0 3 423.561 4.094 20 0 HIADHN CC(C)C[C@@H](C)NC(=O)N(Cc1ccccc1Br)C1CCN(C)CC1 ZINC000460943822 873842861 /nfs/dbraw/zinc/84/28/61/873842861.db2.gz AYYRNJVLGYMMHQ-MRXNPFEDSA-N 0 3 410.400 4.490 20 0 HIADHN CC1CCN([C@H](CNC(=O)c2ccc(OC3CCOCC3)cc2)c2ccccc2)CC1 ZINC000460966069 873862719 /nfs/dbraw/zinc/86/27/19/873862719.db2.gz VJNJJUPJVUKGCP-RUZDIDTESA-N 0 3 422.569 4.447 20 0 HIADHN Cc1cccc(C)c1NCC(=O)NC1CCN(CCOc2ccc(Cl)cc2)CC1 ZINC000461057342 873932641 /nfs/dbraw/zinc/93/26/41/873932641.db2.gz NCOIIGVEIPIPKL-UHFFFAOYSA-N 0 3 415.965 4.028 20 0 HIADHN O=C(NCc1ccccc1)[C@@H](NC[C@H]1CCN(c2ccccc2F)C1)c1ccccc1 ZINC000461077183 873978508 /nfs/dbraw/zinc/97/85/08/873978508.db2.gz SPFMBRJTIQSOSN-BWKNWUBXSA-N 0 3 417.528 4.299 20 0 HIADHN Cc1ccccc1[C@@H]1CN(C(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)[C@@H](C)CO1 ZINC000461251394 874255299 /nfs/dbraw/zinc/25/52/99/874255299.db2.gz CXDWFKHYYLXVOL-LEEZEASISA-N 0 3 410.533 4.335 20 0 HIADHN C[C@@H](C(=O)N1CC[C@@H](COCc2ccccc2)C1)N1CCC(Cc2ccccc2)CC1 ZINC000461372548 874376244 /nfs/dbraw/zinc/37/62/44/874376244.db2.gz CKRJCDPLVIQUBN-BKMJKUGQSA-N 0 3 420.597 4.395 20 0 HIADHN Cc1ccc(C(=O)CCC(=O)N2C[C@H]3CN(Cc4ccccc4)CC[C@@H]3C2)cc1C ZINC000461439475 874492509 /nfs/dbraw/zinc/49/25/09/874492509.db2.gz RQMGPEOBOZRRPL-DNQXCXABSA-N 0 3 404.554 4.247 20 0 HIADHN Cc1cc(C(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)nn1-c1c(F)cccc1F ZINC000468744883 882839505 /nfs/dbraw/zinc/83/95/05/882839505.db2.gz SLZUSWGUMHANRC-FUHWJXTLSA-N 0 3 410.468 4.024 20 0 HIADHN C[C@H](CN(C)C(=O)N[C@H](C)C1=CCN(C)CC1)Oc1ccc(Cl)c(Cl)c1 ZINC000468746551 882840260 /nfs/dbraw/zinc/84/02/60/882840260.db2.gz ZDAHDUFKQNLMJG-ZIAGYGMSSA-N 0 3 400.350 4.053 20 0 HIADHN O=C(CC1(N2CCOCC2)CCCC1)N1Cc2ccccc2C[C@@H]1c1ccccc1 ZINC000468794613 882863070 /nfs/dbraw/zinc/86/30/70/882863070.db2.gz CGQNEIGWQKAFIH-XMMPIXPASA-N 0 3 404.554 4.348 20 0 HIADHN CCN1C[C@H](C)N(c2nnc(-c3cccc4ccccc43)n2C[C@@H]2CCOC2)C[C@@H]1C ZINC000461704899 874854456 /nfs/dbraw/zinc/85/44/56/874854456.db2.gz RRTXQOAOHRCUGH-UFYCRDLUSA-N 0 3 419.573 4.054 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)N(C)[C@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000461710862 874859696 /nfs/dbraw/zinc/85/96/96/874859696.db2.gz ULPSLFDULKVVDY-YFXJRYMSSA-N 0 3 413.537 4.208 20 0 HIADHN COc1ccc(Oc2cc(CN[C@@H](C)Cn3cc(Br)cn3)ccn2)cc1 ZINC000468821886 882876551 /nfs/dbraw/zinc/87/65/51/882876551.db2.gz DHRBSBCOHFKCOI-AWEZNQCLSA-N 0 3 417.307 4.020 20 0 HIADHN C[C@@H]1CN(c2nnc(C3CCC3)n2C[C@H]2CCCCO2)[C@H](C)CN1Cc1ccccc1 ZINC000461826685 874954886 /nfs/dbraw/zinc/95/48/86/874954886.db2.gz IXDCGKNBXDAGKB-TXTKFYIRSA-N 0 3 423.605 4.214 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1c(C)nc(C2CC2)nc1SC)c1ccsc1 ZINC000461892234 875039655 /nfs/dbraw/zinc/03/96/55/875039655.db2.gz ZBTALIVFOZDWHW-INIZCTEOSA-N 0 3 404.605 4.259 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)N3CCCCC[C@H]3c3ccncc3)CC2)c1 ZINC000461895215 875041456 /nfs/dbraw/zinc/04/14/56/875041456.db2.gz OIAIOVLYOSPPCY-DEOSSOPVSA-N 0 3 406.574 4.046 20 0 HIADHN COCCOCc1ccc(C(=O)NC[C@@H](c2ccccc2)N2CCC(C)CC2)cc1 ZINC000461921345 875061610 /nfs/dbraw/zinc/06/16/10/875061610.db2.gz LFJJHFSILTYHKR-DEOSSOPVSA-N 0 3 410.558 4.053 20 0 HIADHN O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)N[C@@H]1CCCc2cn(C3CCCC3)nc21 ZINC000461945571 875078637 /nfs/dbraw/zinc/07/86/37/875078637.db2.gz DQPRIXLUKVATTB-FYYLOGMGSA-N 0 3 421.589 4.339 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)Nc3ccc(NC(=O)CC(C)C)cc3)CC2)c1 ZINC000462019945 875135735 /nfs/dbraw/zinc/13/57/35/875135735.db2.gz GJANIWJTCHCHKV-UHFFFAOYSA-N 0 3 422.573 4.130 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)N[C@@H]1CCCc2cn(C3CCCC3)nc21 ZINC000462129506 875230354 /nfs/dbraw/zinc/23/03/54/875230354.db2.gz FWQCLAUYFBNBJU-HSZRJFAPSA-N 0 3 421.589 4.123 20 0 HIADHN CC(C)n1ncc2c1nc(C1CC1)cc2C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C ZINC000462186871 875288585 /nfs/dbraw/zinc/28/85/85/875288585.db2.gz GOYXCVBOQHOKPK-UZUQRXQVSA-N 0 3 417.557 4.140 20 0 HIADHN C[C@H](NC(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C)c1nc(C(C)(C)C)cs1 ZINC000462191424 875297935 /nfs/dbraw/zinc/29/79/35/875297935.db2.gz SINFKXCLEBEZKS-BQFCYCMXSA-N 0 3 400.592 4.321 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)C1(c2ccc(Cl)cc2)CCOCC1 ZINC000462195777 875304587 /nfs/dbraw/zinc/30/45/87/875304587.db2.gz MQGYETCWVSPWQX-XMSQKQJNSA-N 0 3 412.961 4.025 20 0 HIADHN C[C@H]1CCCN(c2cc(C(=O)N(C)[C@H]3CCCN(Cc4ccccc4)C3)ccn2)C1 ZINC000462196793 875304841 /nfs/dbraw/zinc/30/48/41/875304841.db2.gz BGTPZNZABHHBJI-REWPJTCUSA-N 0 3 406.574 4.055 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)CCCc1ncc(-c2ccccc2)o1 ZINC000462197940 875306519 /nfs/dbraw/zinc/30/65/19/875306519.db2.gz WUNYHNRKSRGBOT-KNQAVFIVSA-N 0 3 403.526 4.301 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)Nc1ccc(OCc2ccncc2)cc1 ZINC000462243859 875359912 /nfs/dbraw/zinc/35/99/12/875359912.db2.gz CVARYHNQVWNRSK-DVECYGJZSA-N 0 3 416.525 4.303 20 0 HIADHN COCCOc1ccc(NC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)cc1Cl ZINC000462248266 875367099 /nfs/dbraw/zinc/36/70/99/875367099.db2.gz SPFACGOWQOYSJP-OXQOHEQNSA-N 0 3 417.937 4.007 20 0 HIADHN Cc1cc(N2CCSCC2)ccc1NC(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C ZINC000462271188 875398049 /nfs/dbraw/zinc/39/80/49/875398049.db2.gz WNGSMYGNEXYASQ-AUSIDOKSSA-N 0 3 424.614 4.190 20 0 HIADHN Cc1ccnc(Oc2ccc(NC(=O)N[C@@H]3CN(Cc4ccccc4)C[C@@H]3C)cc2)n1 ZINC000462277141 875404928 /nfs/dbraw/zinc/40/49/28/875404928.db2.gz JWAHEWLZBQFHOB-HTAPYJJXSA-N 0 3 417.513 4.219 20 0 HIADHN Cc1nc2ccc(Br)cc2c(NCc2ccc(OCCO)cc2)c1C ZINC000462383910 875496726 /nfs/dbraw/zinc/49/67/26/875496726.db2.gz JYQBDJMKOSIQHC-UHFFFAOYSA-N 0 3 401.304 4.019 20 0 HIADHN Cc1cccnc1C(C)(C)CNC(=O)N(CCN(C)C)Cc1cccc(Cl)c1 ZINC000462430075 875534709 /nfs/dbraw/zinc/53/47/09/875534709.db2.gz GTHVSGZCZKAPAY-UHFFFAOYSA-N 0 3 402.970 4.094 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3ccc(Oc4ccccc4)cn3)cc2)CC1 ZINC000468895527 882943132 /nfs/dbraw/zinc/94/31/32/882943132.db2.gz IUXSBNDNJOKWMF-UHFFFAOYSA-N 0 3 402.498 4.268 20 0 HIADHN C[C@@H](NCC(=O)Nc1cccc(C(=O)N(C)C)c1)c1ccc(Cl)c2ccccc21 ZINC000462465964 875573775 /nfs/dbraw/zinc/57/37/75/875573775.db2.gz MXZQKQFUCSYKFF-OAHLLOKOSA-N 0 3 409.917 4.484 20 0 HIADHN C[C@H](NCc1cnn([C@]2(C)CCS(=O)(=O)C2)c1)c1ccc(Cl)c2ccccc21 ZINC000462527612 875644950 /nfs/dbraw/zinc/64/49/50/875644950.db2.gz SRUYVQCVOMFOOA-YCRPNKLZSA-N 0 3 417.962 4.074 20 0 HIADHN CN(C)CCN(CC1CCCCC1)C(=O)N[C@@H]1c2ccccc2CC12CCOCC2 ZINC000462535814 875655826 /nfs/dbraw/zinc/65/58/26/875655826.db2.gz GTDKZMDQIXSWTL-HSZRJFAPSA-N 0 3 413.606 4.234 20 0 HIADHN C[C@@H](C(=O)N(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1)c1cccc(Br)c1 ZINC000462539515 875660142 /nfs/dbraw/zinc/66/01/42/875660142.db2.gz SNTYRBUMHVCCRS-BPAFIMBUSA-N 0 3 416.363 4.099 20 0 HIADHN Cc1ccnc(-c2ccc(NC(=O)N[C@@H]3CN(Cc4ccccc4)C[C@H]3C)cc2)n1 ZINC000462556946 875683305 /nfs/dbraw/zinc/68/33/05/875683305.db2.gz GJEHTSBRQNLCJB-VGOFRKELSA-N 0 3 401.514 4.094 20 0 HIADHN CC(=O)N(Cc1ccc(NC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)cc1)C(C)C ZINC000462561409 875688591 /nfs/dbraw/zinc/68/85/91/875688591.db2.gz USCYYXRPCDSSHQ-YADARESESA-N 0 3 422.573 4.086 20 0 HIADHN CCOc1cc(CNCc2ccc(C(F)F)cc2)ccc1O[C@H](C)C(=O)N(C)C ZINC000462658691 875763072 /nfs/dbraw/zinc/76/30/72/875763072.db2.gz PVJHVMAREROSFD-OAHLLOKOSA-N 0 3 406.473 4.168 20 0 HIADHN COc1cc(NC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)cc(OC)c1C(C)C ZINC000462705279 875791408 /nfs/dbraw/zinc/79/14/08/875791408.db2.gz PBSQWMZXGWJYBP-YLJYHZDGSA-N 0 3 411.546 4.469 20 0 HIADHN COc1ccccc1O[C@H](C)CNCc1cnn(-c2ccc(Br)cc2)c1 ZINC000462737578 875810369 /nfs/dbraw/zinc/81/03/69/875810369.db2.gz IMKGFZCOTBFUCE-OAHLLOKOSA-N 0 3 416.319 4.201 20 0 HIADHN COc1cc(CN[C@@H]2CC(=O)N([C@H]3C[C@@H]3C)C2)ccc1OCc1ccc(Cl)cc1 ZINC000462755382 875819965 /nfs/dbraw/zinc/81/99/65/875819965.db2.gz KLVHKBNUMCPFGY-BEVDRBHNSA-N 0 3 414.933 4.027 20 0 HIADHN CC(C)(C)OC(=O)c1ccc(CN2CCC(c3nc(-c4ccccn4)no3)CC2)cc1 ZINC000462787323 875840245 /nfs/dbraw/zinc/84/02/45/875840245.db2.gz AUWUWJGACUANRT-UHFFFAOYSA-N 0 3 420.513 4.467 20 0 HIADHN CC(C)(C)OC(=O)c1ccc(CN2CCC(C(=O)Nc3ccc(O)cc3)CC2)cc1 ZINC000462794587 875844326 /nfs/dbraw/zinc/84/43/26/875844326.db2.gz ZDNIXMHYBZBSAY-UHFFFAOYSA-N 0 3 410.514 4.198 20 0 HIADHN O=S1(=O)CCCN1c1cccc(CN[C@@H](c2ccc(F)cc2)C2CCCC2)c1 ZINC000462830904 875865834 /nfs/dbraw/zinc/86/58/34/875865834.db2.gz BVOAKBASARCWCA-JOCHJYFZSA-N 0 3 402.535 4.387 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](N[C@H]2CCO[C@H](C3CC3)C2)c2ccc(Cl)cc2)c1 ZINC000462837207 875871107 /nfs/dbraw/zinc/87/11/07/875871107.db2.gz ZEIDSWGZYYBTAJ-ILWGZMRPSA-N 0 3 419.974 4.380 20 0 HIADHN Fc1cc(CN[C@H](c2ccc(Br)cc2)C2CC2)cnc1N1CCOCC1 ZINC000462847207 875881792 /nfs/dbraw/zinc/88/17/92/875881792.db2.gz DPBZKIULIANRIX-IBGZPJMESA-N 0 3 420.326 4.061 20 0 HIADHN COc1cc(Br)c(CNC[C@H]2CCN(c3ccccc3F)C2)c(OC)c1 ZINC000462902875 875928012 /nfs/dbraw/zinc/92/80/12/875928012.db2.gz ABGXWDJEOYUZHR-CQSZACIVSA-N 0 3 423.326 4.222 20 0 HIADHN CCN(CC)C(=O)Nc1ccc([C@@H](C)N[C@@H]2CC(=O)N(c3ccccc3F)C2)cc1 ZINC000462944618 875966674 /nfs/dbraw/zinc/96/66/74/875966674.db2.gz FVVNGNHKRMLDMZ-VQIMIIECSA-N 0 3 412.509 4.156 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3cnccc3Oc3ccccc3)cc2)CC1 ZINC000468925965 882985562 /nfs/dbraw/zinc/98/55/62/882985562.db2.gz KKQXPEAWGNUVFZ-UHFFFAOYSA-N 0 3 402.498 4.268 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N[C@@H](c1nccs1)c1ccccc1 ZINC000463013030 876030362 /nfs/dbraw/zinc/03/03/62/876030362.db2.gz RIKQXEIOPOEPTR-DUXKGJEZSA-N 0 3 406.555 4.052 20 0 HIADHN CCc1nc(C)c([C@H](C)N(C)C(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)s1 ZINC000463018266 876035223 /nfs/dbraw/zinc/03/52/23/876035223.db2.gz BYLAEPALYBXKJB-AYBZRNKSSA-N 0 3 400.592 4.237 20 0 HIADHN CC(C)O[C@@H]1C[C@@H](N[C@@H](c2ccccc2)c2cccc(S(C)(=O)=O)c2)C1(C)C ZINC000463028183 876047209 /nfs/dbraw/zinc/04/72/09/876047209.db2.gz JRIYQQNRGHYELN-VSKRKVRLSA-N 0 3 401.572 4.361 20 0 HIADHN CC(C)O[C@@H]1C[C@H](N[C@@H](c2ccccc2)c2cccc(S(C)(=O)=O)c2)C1(C)C ZINC000463028181 876047554 /nfs/dbraw/zinc/04/75/54/876047554.db2.gz JRIYQQNRGHYELN-BDTNDASRSA-N 0 3 401.572 4.361 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](Nc2ccnc3ccccc32)c2ccc(F)cc2)c1 ZINC000463080739 876113071 /nfs/dbraw/zinc/11/30/71/876113071.db2.gz DZUAQHVGKGHGCK-HSZRJFAPSA-N 0 3 406.482 4.401 20 0 HIADHN CN(C(=O)c1ccc(Cl)cc1)c1ccc(Oc2ncnc3c2CN(C)CC3)cc1 ZINC000463083225 876114657 /nfs/dbraw/zinc/11/46/57/876114657.db2.gz QPUPRZISKVZQPJ-UHFFFAOYSA-N 0 3 408.889 4.187 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)cc1C(=O)N[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000463167148 876222295 /nfs/dbraw/zinc/22/22/95/876222295.db2.gz VMODPQBLCCNESL-XLIONFOSSA-N 0 3 408.933 4.399 20 0 HIADHN COCC1(CN2CCC[C@@H]2c2nc(-c3ccccc3Br)no2)CCC1 ZINC000463196780 876257325 /nfs/dbraw/zinc/25/73/25/876257325.db2.gz FNHJKWVCLAUEMA-MRXNPFEDSA-N 0 3 406.324 4.453 20 0 HIADHN OC[C@@]1(Cc2ccccc2)CCCN1Cc1nc2ccc(Br)cc2o1 ZINC000463203449 876264171 /nfs/dbraw/zinc/26/41/71/876264171.db2.gz OQLZJMGUQZXAAF-FQEVSTJZSA-N 0 3 401.304 4.160 20 0 HIADHN C[C@@H]1CC[C@H](O)[C@H]([C@H]2CCCCN2Cc2nc3ccc(Br)cc3n2C)C1 ZINC000463214388 876272759 /nfs/dbraw/zinc/27/27/59/876272759.db2.gz PVSOPDGRHLTBNT-CAUGKJMWSA-N 0 3 420.395 4.487 20 0 HIADHN CN(C(=O)N[C@@H]1CCO[C@H](c2ccccc2)C1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000463225314 876283021 /nfs/dbraw/zinc/28/30/21/876283021.db2.gz HHHUSJLFHJXMMD-SMIHKQSGSA-N 0 3 407.558 4.213 20 0 HIADHN COCc1nc(CNC2CCN(c3nccs3)CC2)c(-c2ccccc2)s1 ZINC000463246658 876304248 /nfs/dbraw/zinc/30/42/48/876304248.db2.gz RWROFJGCMKCYAA-UHFFFAOYSA-N 0 3 400.573 4.172 20 0 HIADHN COc1cccc(Oc2ncccc2CN[C@H](C)Cn2cc(Br)cn2)c1 ZINC000468951331 883015987 /nfs/dbraw/zinc/01/59/87/883015987.db2.gz KCBYOEXSLSSVIB-CQSZACIVSA-N 0 3 417.307 4.020 20 0 HIADHN C[C@H](C(=O)NCCCN1CCc2ccccc2C1)c1ccc(Br)s1 ZINC000463414495 876468299 /nfs/dbraw/zinc/46/82/99/876468299.db2.gz FVSOZOZLGBCBMP-AWEZNQCLSA-N 0 3 407.377 4.179 20 0 HIADHN CC(=O)c1ccc(NC(=O)CCN(C)CCc2cccc(Br)c2)cc1 ZINC000463430284 876486058 /nfs/dbraw/zinc/48/60/58/876486058.db2.gz UMRHKKWAQWJZRE-UHFFFAOYSA-N 0 3 403.320 4.155 20 0 HIADHN OC[C@@]1(Cc2ccccc2)CCCN(C[C@H](O)COc2c(Cl)cccc2Cl)C1 ZINC000463446077 876504100 /nfs/dbraw/zinc/50/41/00/876504100.db2.gz BMVITNWJEVHRPU-PGRDOPGGSA-N 0 3 424.368 4.050 20 0 HIADHN CC(C)c1nn(C)c2sc(C(=O)N(CCN(C)C)Cc3ccc(F)cc3)cc12 ZINC000463510115 876572360 /nfs/dbraw/zinc/57/23/60/876572360.db2.gz WYODVMVOJXEZNC-UHFFFAOYSA-N 0 3 402.539 4.101 20 0 HIADHN Cc1nc(-c2cccc(C(=O)N3CCC(CN4C[C@H](C)O[C@@H](C)C4)CC3)c2)cs1 ZINC000463560119 876647033 /nfs/dbraw/zinc/64/70/33/876647033.db2.gz PNJQCGWTHODATO-IRXDYDNUSA-N 0 3 413.587 4.080 20 0 HIADHN CCOc1c(F)cccc1C(=O)NC1CCN(CCOc2ccc(Cl)cc2)CC1 ZINC000463666151 876787759 /nfs/dbraw/zinc/78/77/59/876787759.db2.gz CQONGLRRZXHBPK-UHFFFAOYSA-N 0 3 420.912 4.151 20 0 HIADHN C[C@@H]1CC[C@@H](CC(=O)NC2CCN(CCOc3ccc(Br)cc3)CC2)C1 ZINC000469009205 883075997 /nfs/dbraw/zinc/07/59/97/883075997.db2.gz RNFCLHVMNHBHAZ-IAGOWNOFSA-N 0 3 423.395 4.235 20 0 HIADHN CN(C(=O)C1(c2cccc(Br)c2)CCCCC1)[C@H]1CCN(C2CC2)C1 ZINC000463841407 876963152 /nfs/dbraw/zinc/96/31/52/876963152.db2.gz MZVYUTNVBCUCLA-IBGZPJMESA-N 0 3 405.380 4.346 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1ccc2c(C)nn(C)c2c1)c1cccc(OC)c1 ZINC000463845756 876968078 /nfs/dbraw/zinc/96/80/78/876968078.db2.gz IVCFXHMBJDRLOQ-QFIPXVFZSA-N 0 3 409.534 4.095 20 0 HIADHN CCN1CCN(c2ccc(N[C@H](C)c3nc(Cc4ccccc4)no3)c(C)c2)CC1 ZINC000463900032 877022667 /nfs/dbraw/zinc/02/26/67/877022667.db2.gz YYTFETVGMDLFNG-LJQANCHMSA-N 0 3 405.546 4.284 20 0 HIADHN COc1cccc([C@H](NC(=O)NCCN2CCCCC2)c2ccccc2Cl)c1 ZINC000463959084 877083355 /nfs/dbraw/zinc/08/33/55/877083355.db2.gz PXZWMICEVNSMNK-NRFANRHFSA-N 0 3 401.938 4.223 20 0 HIADHN Clc1ccc(Br)c(CNC[C@@H](c2cccs2)N2CCOCC2)c1 ZINC000464048662 877188654 /nfs/dbraw/zinc/18/86/54/877188654.db2.gz NOULCEJUPWCMIV-INIZCTEOSA-N 0 3 415.784 4.327 20 0 HIADHN Cc1cccc(S(=O)(=O)CCCN2CCC(CN(C)Cc3ccccc3)CC2)c1 ZINC000464099397 877255976 /nfs/dbraw/zinc/25/59/76/877255976.db2.gz PNOXAZYPLFTQIW-UHFFFAOYSA-N 0 3 414.615 4.003 20 0 HIADHN O=C1[C@H](N2CCC(c3ccc(O)cc3)CC2)CCCN1Cc1ccc(F)cc1F ZINC000469044200 883114564 /nfs/dbraw/zinc/11/45/64/883114564.db2.gz RBVIKEDAJIUZCK-JOCHJYFZSA-N 0 3 400.469 4.041 20 0 HIADHN Cc1nn(C(C)(C)C)cc1[C@H](C)NC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C ZINC000464144477 877310599 /nfs/dbraw/zinc/31/05/99/877310599.db2.gz DSYVESLAZVDYTA-OALUTQOASA-N 0 3 411.594 4.314 20 0 HIADHN C[C@@H]1C[C@@H](c2ccccc2F)N(C(=O)CCCN2CCN(c3ccccc3)CC2)C1 ZINC000464229733 877405790 /nfs/dbraw/zinc/40/57/90/877405790.db2.gz FHCCXHMFOIGSIX-YKSBVNFPSA-N 0 3 409.549 4.338 20 0 HIADHN CN1CCC[C@H](CNC(=O)c2ccn(-c3ccc(F)cc3F)n2)[C@H]1c1cccs1 ZINC000464338397 877528926 /nfs/dbraw/zinc/52/89/26/877528926.db2.gz FVFWONTVZYAUEU-VLIAUNLRSA-N 0 3 416.497 4.025 20 0 HIADHN CN1CCC[C@@H](CNC(=O)c2ccn(-c3ccc(F)cc3F)n2)[C@H]1c1cccs1 ZINC000464338398 877529313 /nfs/dbraw/zinc/52/93/13/877529313.db2.gz FVFWONTVZYAUEU-XOBRGWDASA-N 0 3 416.497 4.025 20 0 HIADHN COc1ccc2oc([C@@H](C)NCCCS(=O)(=O)c3ccccc3OC)c(C)c2c1 ZINC000464497159 877716632 /nfs/dbraw/zinc/71/66/32/877716632.db2.gz FXVLRITVCQULHH-MRXNPFEDSA-N 0 3 417.527 4.273 20 0 HIADHN C[C@H](NC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1)c1nc(C2CCCCC2)no1 ZINC000464721763 877951938 /nfs/dbraw/zinc/95/19/38/877951938.db2.gz YFJIYOIVGWCDPL-QFBILLFUSA-N 0 3 414.525 4.346 20 0 HIADHN CCCN(CC(F)(F)F)C(=O)[C@@H]1CCCN(CCSc2ccccc2F)C1 ZINC000464727731 877963141 /nfs/dbraw/zinc/96/31/41/877963141.db2.gz CXEZWKCZBIXBPA-OAHLLOKOSA-N 0 3 406.489 4.431 20 0 HIADHN CC(=O)Nc1ccc(OC[C@@H](O)CN2Cc3ccccc3C[C@H]2c2ccccc2)cc1 ZINC000464739345 877973334 /nfs/dbraw/zinc/97/33/34/877973334.db2.gz PUPNOHTYVRUAHD-AHWVRZQESA-N 0 3 416.521 4.184 20 0 HIADHN C[C@H](C(=O)NCCc1c[nH]c2ccccc12)N1CC[C@H](CSc2ccccc2)C1 ZINC000464754047 877991763 /nfs/dbraw/zinc/99/17/63/877991763.db2.gz CTFVIUXHZVFXIP-MOPGFXCFSA-N 0 3 407.583 4.329 20 0 HIADHN COc1ccc(NC(=O)[C@H](C(C)C)N(C)C)cc1NC(=O)c1ccc(Cl)cc1F ZINC000464783685 878029884 /nfs/dbraw/zinc/02/98/84/878029884.db2.gz OFRQMBMFFWVGIL-IBGZPJMESA-N 0 3 421.900 4.265 20 0 HIADHN O=C(CCN1CCC(OCC2CC2)CC1)Nc1ccccc1C(=O)c1ccccc1 ZINC000464819946 878072880 /nfs/dbraw/zinc/07/28/80/878072880.db2.gz URLNQVRKXYJJON-UHFFFAOYSA-N 0 3 406.526 4.137 20 0 HIADHN C[C@@H](C(=O)Nc1ccccc1OC(F)F)N1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC000464838811 878103009 /nfs/dbraw/zinc/10/30/09/878103009.db2.gz OKBPDIDSNAMBLA-MSOLQXFVSA-N 0 3 417.500 4.211 20 0 HIADHN C[C@@H]1CCCN1CC(=O)N[C@H](c1ccccc1)c1ccc2[nH]c(C(F)(F)F)nc2c1 ZINC000464840373 878109360 /nfs/dbraw/zinc/10/93/60/878109360.db2.gz UODXDGWEBKBQSB-JLTOFOAXSA-N 0 3 416.447 4.272 20 0 HIADHN C[C@@H]1CCCN1CC(=O)N[C@H](c1ccccc1)c1ccc2nc(C(F)(F)F)[nH]c2c1 ZINC000464840373 878109367 /nfs/dbraw/zinc/10/93/67/878109367.db2.gz UODXDGWEBKBQSB-JLTOFOAXSA-N 0 3 416.447 4.272 20 0 HIADHN C[C@H]1CCN(CC(=O)Nc2ccccc2C(F)(F)F)CCN1Cc1ccccc1 ZINC000464842328 878111490 /nfs/dbraw/zinc/11/14/90/878111490.db2.gz GHDRICFECHGIKE-KRWDZBQOSA-N 0 3 405.464 4.240 20 0 HIADHN CC[C@H](C)NC(=O)[C@@H]1C[C@H](C)N(Cc2cnn(C)c2C(F)(F)F)[C@H]2CCCC[C@H]12 ZINC000464868215 878153264 /nfs/dbraw/zinc/15/32/64/878153264.db2.gz XZNUCEIQUKVOSL-TVNOUSRMSA-N 0 3 414.516 4.123 20 0 HIADHN COc1ccc(CCC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)cc1Cl ZINC000464895564 878201382 /nfs/dbraw/zinc/20/13/82/878201382.db2.gz MOSOVKNGZCRGES-SFHVURJKSA-N 0 3 400.950 4.404 20 0 HIADHN C[C@@H]1CCN(C(=O)c2cnn(Cc3ccccc3Cl)c2)CCN1Cc1ccccc1 ZINC000464898656 878206506 /nfs/dbraw/zinc/20/65/06/878206506.db2.gz YTCMIAKNWYZHEP-LJQANCHMSA-N 0 3 422.960 4.321 20 0 HIADHN CCN(C[C@@H]1CCN(Cc2ccccc2)C1)C(=O)[C@H](C)CC(=O)c1ccccc1F ZINC000464960542 878300919 /nfs/dbraw/zinc/30/09/19/878300919.db2.gz KRKYECMIKGXXDH-TZIWHRDSSA-N 0 3 410.533 4.405 20 0 HIADHN CN1CCN(CCCNC(=O)c2ccc(Oc3ccc(Cl)cc3Cl)cc2)CC1 ZINC000465050114 878414546 /nfs/dbraw/zinc/41/45/46/878414546.db2.gz HQDAKIYXLBWDQB-UHFFFAOYSA-N 0 3 422.356 4.153 20 0 HIADHN COC(=O)c1ccsc1N1CC[C@@H](N[C@H](Cc2ccccc2)c2ccccc2)C1=O ZINC000465081348 878442989 /nfs/dbraw/zinc/44/29/89/878442989.db2.gz VGQFUEAODOQOTL-NHCUHLMSSA-N 0 3 420.534 4.214 20 0 HIADHN COC(=O)c1ccsc1N1CC[C@@H](N[C@@H](Cc2ccccc2)c2ccccc2)C1=O ZINC000465081349 878443200 /nfs/dbraw/zinc/44/32/00/878443200.db2.gz VGQFUEAODOQOTL-RTWAWAEBSA-N 0 3 420.534 4.214 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N3CCC(=Cc4ccccc4F)CC3)cc2)CC1 ZINC000465084634 878445869 /nfs/dbraw/zinc/44/58/69/878445869.db2.gz OVIRSRJJJVOXQK-UHFFFAOYSA-N 0 3 407.533 4.287 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N(Cc2cccc(F)c2)C2CCCC2)CC1 ZINC000465283063 878719401 /nfs/dbraw/zinc/71/94/01/878719401.db2.gz FUFYWQKDUWFHSV-UHFFFAOYSA-N 0 3 405.558 4.169 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N[C@@H](c2cccc(F)c2)C2CCCC2)CC1 ZINC000465285477 878722590 /nfs/dbraw/zinc/72/25/90/878722590.db2.gz MAOQUDJQQIHJCR-JOCHJYFZSA-N 0 3 405.558 4.246 20 0 HIADHN CC1CCN([C@@H](CNC(=O)N2CCC(OCC3CC3)CC2)c2cccs2)CC1 ZINC000465422011 878850944 /nfs/dbraw/zinc/85/09/44/878850944.db2.gz MOABUSRZIUTIKU-FQEVSTJZSA-N 0 3 405.608 4.122 20 0 HIADHN COc1ccccc1C[C@H](C)N(C)C(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000465423563 878852596 /nfs/dbraw/zinc/85/25/96/878852596.db2.gz NHQILFASAHAICU-HKUYNNGSSA-N 0 3 401.576 4.166 20 0 HIADHN C[C@H](NC(=O)NC[C@@H](c1cccs1)N1CCCC1)c1ccc(-n2cccn2)cc1 ZINC000465422363 878852982 /nfs/dbraw/zinc/85/29/82/878852982.db2.gz NKZOTZYNPZFEAN-PXNSSMCTSA-N 0 3 409.559 4.131 20 0 HIADHN O=C(N[C@H]1COc2c1ccc(Cl)c2Cl)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000465434602 878866808 /nfs/dbraw/zinc/86/68/08/878866808.db2.gz RHJQXHVUBIZDRQ-YOEHRIQHSA-N 0 3 406.313 4.001 20 0 HIADHN O=C(NCc1ccc(-c2cccnc2)cc1)NC[C@H](c1ccccc1)N1CCCC1 ZINC000465436959 878869312 /nfs/dbraw/zinc/86/93/12/878869312.db2.gz DZQILSQXIPEUSE-XMMPIXPASA-N 0 3 400.526 4.385 20 0 HIADHN CO[C@H](CNC(=O)NC[C@@H](c1cccs1)N1CCCC1)c1ccc(Cl)cc1 ZINC000465440036 878871498 /nfs/dbraw/zinc/87/14/98/878871498.db2.gz ZJRZFBLPOQQRID-ZWKOTPCHSA-N 0 3 407.967 4.225 20 0 HIADHN C[C@H](NC(=O)NC[C@H](c1ccccc1)N1CCCC1)c1cccc(-n2cccn2)c1 ZINC000465447657 878879011 /nfs/dbraw/zinc/87/90/11/878879011.db2.gz ZECCVAABYXIHBL-WMZHIEFXSA-N 0 3 403.530 4.070 20 0 HIADHN COc1ccc([C@H](CNC(=O)NCc2cc(F)ccc2SC)N2CCCC2)cc1 ZINC000465460349 878891342 /nfs/dbraw/zinc/89/13/42/878891342.db2.gz RQTLOJLTDPKBFZ-FQEVSTJZSA-N 0 3 417.550 4.193 20 0 HIADHN CCC(CC)c1cc(CNC(=O)NC[C@H](c2cccc(OC)c2)N2CCCC2)on1 ZINC000465465362 878899584 /nfs/dbraw/zinc/89/95/84/878899584.db2.gz IOTANSXCYBBKPM-JOCHJYFZSA-N 0 3 414.550 4.223 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)NC(=O)c2oc3ccccc3c2CN(C)C)cc1 ZINC000465466806 878902152 /nfs/dbraw/zinc/90/21/52/878902152.db2.gz ORNPMDNAQFODQX-MRXNPFEDSA-N 0 3 402.498 4.480 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)NC(=O)c2ccc(CN3CCSCC3)cc2)cc1 ZINC000465472837 878910599 /nfs/dbraw/zinc/91/05/99/878910599.db2.gz XUFQPEYCGIIFNF-SFHVURJKSA-N 0 3 420.582 4.221 20 0 HIADHN COc1cccc([C@@H](CNC(=O)NC[C@H](C)c2ccc(F)cc2F)N2CCCC2)c1 ZINC000465482105 878921752 /nfs/dbraw/zinc/92/17/52/878921752.db2.gz WXBFBHPVBJQJEX-KSFYIVLOSA-N 0 3 417.500 4.213 20 0 HIADHN CN(C)CCN(C[C@H]1CCCO1)C(=O)N[C@@H](c1cc2ccccc2o1)c1ccccc1 ZINC000465497423 878936175 /nfs/dbraw/zinc/93/61/75/878936175.db2.gz FLCHKCBZTNTWBC-ZJSXRUAMSA-N 0 3 421.541 4.274 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@H](c1ncc(C)s1)C1CC1)c1cccc(OC)c1 ZINC000465504788 878941790 /nfs/dbraw/zinc/94/17/90/878941790.db2.gz SGCRTRBITSMLKX-UXHICEINSA-N 0 3 416.591 4.294 20 0 HIADHN O[C@H](COc1ccc(Cl)cc1Cl)CN1CCC[C@H](c2ncc3n2CCCC3)C1 ZINC000503416602 912404323 /nfs/dbraw/zinc/40/43/23/912404323.db2.gz RKTWALIPNSWAMA-YJBOKZPZSA-N 0 3 424.372 4.146 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)N1CC[C@H](COCc2ccccc2)C1 ZINC000465533424 878989778 /nfs/dbraw/zinc/98/97/78/878989778.db2.gz XVTWTADOTDOYGC-UPVQGACJSA-N 0 3 407.558 4.072 20 0 HIADHN CC[C@H](CNC(=O)NCc1coc(-c2ccc(C)cc2)n1)N1CCc2ccccc2C1 ZINC000465533432 878989998 /nfs/dbraw/zinc/98/99/98/878989998.db2.gz XWJQLIKHFWGNNQ-HSZRJFAPSA-N 0 3 418.541 4.286 20 0 HIADHN CCCC(=O)Nc1ccc(CNC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)cc1 ZINC000465537181 878998809 /nfs/dbraw/zinc/99/88/09/878998809.db2.gz DQIGGWUJZCQJMU-FQEVSTJZSA-N 0 3 422.573 4.231 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)N3C[C@H](C)[C@H]3c3ccccc3)CC2)c1 ZINC000465538190 878999128 /nfs/dbraw/zinc/99/91/28/878999128.db2.gz ASSWTERIWUMETG-DHLKQENFSA-N 0 3 420.601 4.300 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)N1CC[C@H](CSc2ccccc2)C1 ZINC000465552404 879016948 /nfs/dbraw/zinc/01/69/48/879016948.db2.gz VRTGFAZFQQILIB-FQEVSTJZSA-N 0 3 409.599 4.259 20 0 HIADHN COc1ccc(OC)c([C@@H](C)NC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)c1 ZINC000465568095 879042684 /nfs/dbraw/zinc/04/26/84/879042684.db2.gz JHALTNIZOQDOJY-RBUKOAKNSA-N 0 3 411.546 4.071 20 0 HIADHN COc1ccc(OC)c([C@H](C)NC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)c1 ZINC000465568092 879042717 /nfs/dbraw/zinc/04/27/17/879042717.db2.gz JHALTNIZOQDOJY-MOPGFXCFSA-N 0 3 411.546 4.071 20 0 HIADHN CN1CCN(Cc2ccc(CNC(=O)N(Cc3ccoc3)C3CCCCC3)cc2)CC1 ZINC000465570431 879044260 /nfs/dbraw/zinc/04/42/60/879044260.db2.gz IUSVAYFCJCZGGS-UHFFFAOYSA-N 0 3 424.589 4.072 20 0 HIADHN C[C@@H]1CCN(C(=O)NCCCN2CCN(C)C[C@H]2c2ccccc2)[C@@H](c2ccco2)C1 ZINC000465588805 879070206 /nfs/dbraw/zinc/07/02/06/879070206.db2.gz DPKFVLNCHBGOGL-MZYLBHOOSA-N 0 3 424.589 4.141 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)N[C@@H](CCC(C)C)c2ccc(Cl)cc2)CC1 ZINC000465657821 879185941 /nfs/dbraw/zinc/18/59/41/879185941.db2.gz JYVQEPQHPCLHKT-UGKGYDQZSA-N 0 3 423.045 4.390 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1)c1nc(C2CCCCC2)no1 ZINC000465703292 879267771 /nfs/dbraw/zinc/26/77/71/879267771.db2.gz YEPTVVQXDOETMS-FXAWDEMLSA-N 0 3 411.550 4.142 20 0 HIADHN CO[C@H](CNC(=O)N[C@H]1CCN([C@H](C)c2ccccc2)C1)c1cccc(Cl)c1 ZINC000465761301 879356769 /nfs/dbraw/zinc/35/67/69/879356769.db2.gz QNBMBHIDEQJQQG-TYCQWZJGSA-N 0 3 401.938 4.162 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N[C@@H](C)c2ccc(-n3cccn3)cc2)N2CCCC2)cc1 ZINC000465825105 879456317 /nfs/dbraw/zinc/45/63/17/879456317.db2.gz BHWOYTQOYBGCFG-RDPSFJRHSA-N 0 3 417.557 4.378 20 0 HIADHN C[C@@H]1CCN(C(=O)NCc2cc(-c3ccccc3)on2)CCN1Cc1ccccc1 ZINC000465840395 879479632 /nfs/dbraw/zinc/47/96/32/879479632.db2.gz OFGZDARVTSSUSN-LJQANCHMSA-N 0 3 404.514 4.148 20 0 HIADHN CCC[C@@H](NC(=O)N(CCN(C)C)C[C@H]1CCCO1)c1cccc(C(F)(F)F)c1 ZINC000465844950 879485087 /nfs/dbraw/zinc/48/50/87/879485087.db2.gz MUHWWKUBKNQDDT-RTBURBONSA-N 0 3 415.500 4.299 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@H]2CNC(=O)NC[C@H](C)N(C)Cc2ccccc2)cc1 ZINC000465894181 879550855 /nfs/dbraw/zinc/55/08/55/879550855.db2.gz UIHFGHMUBKRKTR-OYDLWJJNSA-N 0 3 409.574 4.282 20 0 HIADHN Cc1ccccc1[C@H](NC(=O)NC[C@H](C)CN1CCN(C)CC1)[C@@H]1CCC[C@H](C)C1 ZINC000465935179 879600738 /nfs/dbraw/zinc/60/07/38/879600738.db2.gz UPLKTJDAZPVPGW-CXFRRJOOSA-N 0 3 414.638 4.045 20 0 HIADHN C[C@@H](NC(=O)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1)c1cnn(C)c1 ZINC000465956640 879623992 /nfs/dbraw/zinc/62/39/92/879623992.db2.gz ILIWNAFTGQNUQD-OAHLLOKOSA-N 0 3 424.376 4.096 20 0 HIADHN CC[C@@H](NC(=O)N(CCN(C)C)Cc1ccc(C(F)(F)F)cc1)c1ccncc1 ZINC000465961481 879629097 /nfs/dbraw/zinc/62/90/97/879629097.db2.gz USUYPMYBMKHUFK-LJQANCHMSA-N 0 3 408.468 4.325 20 0 HIADHN C[C@@H](CNC(=O)N[C@@H](CC(C)(C)C)c1ccc(Cl)cc1)CN1CCN(C)CC1 ZINC000465964864 879633040 /nfs/dbraw/zinc/63/30/40/879633040.db2.gz CRNTWQURJIYINW-PXNSSMCTSA-N 0 3 409.018 4.000 20 0 HIADHN CC[C@H](NC(=O)N1CCC(CN2C[C@H](C)O[C@@H](C)C2)CC1)C(C)(C)c1ccccc1 ZINC000465965871 879635024 /nfs/dbraw/zinc/63/50/24/879635024.db2.gz FURKBVAZHFGHQA-JTAQYXEDSA-N 0 3 415.622 4.274 20 0 HIADHN C[C@@H]1CCN(C(=O)NC[C@H]2CCCO[C@@H]2C(C)(C)C)CCN1Cc1ccccc1 ZINC000465982290 879653205 /nfs/dbraw/zinc/65/32/05/879653205.db2.gz IEGYNCBGUANAJC-FCEUIQTBSA-N 0 3 401.595 4.134 20 0 HIADHN O=C(N[C@@H]1CCN(C2CC2)C1)N(Cc1ccccc1OC(F)(F)F)C1CCCC1 ZINC000466022769 879710421 /nfs/dbraw/zinc/71/04/21/879710421.db2.gz OQNGXTMZMVETKF-MRXNPFEDSA-N 0 3 411.468 4.276 20 0 HIADHN CSc1cccc([C@@H](NC(=O)N[C@H]2CCN(C3CC3)C2)c2ccc(F)c(F)c2)c1 ZINC000466023452 879710571 /nfs/dbraw/zinc/71/05/71/879710571.db2.gz SVNSCDYMRBXBNE-HRAATJIYSA-N 0 3 417.525 4.312 20 0 HIADHN COc1ccc([C@H](C)CCNC(=O)N(CCN(C)C)Cc2ccc(F)cc2F)cc1 ZINC000466030135 879716579 /nfs/dbraw/zinc/71/65/79/879716579.db2.gz BCBOKTSIJFUSQQ-QGZVFWFLSA-N 0 3 419.516 4.240 20 0 HIADHN COc1cccc([C@H](NC(=O)N(C)[C@H]2CCN(C3CC3)C2)c2ccccc2Cl)c1 ZINC000466031466 879718754 /nfs/dbraw/zinc/71/87/54/879718754.db2.gz GBKMORBAXAXEIO-AVRDEDQJSA-N 0 3 413.949 4.316 20 0 HIADHN COc1cccc([C@H](Cc2cc(C)cc(C)c2)NC(=O)N(C)[C@@H]2CCN(C3CC3)C2)c1 ZINC000466033186 879721098 /nfs/dbraw/zinc/72/10/98/879721098.db2.gz JRKREKYNVJEKQE-NOZRDPDXSA-N 0 3 421.585 4.474 20 0 HIADHN COc1ccc([C@@H](C)CCNC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)cc1 ZINC000466055974 879748497 /nfs/dbraw/zinc/74/84/97/879748497.db2.gz ODAYVOHMYVEHJU-LEWJYISDSA-N 0 3 409.574 4.495 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)N2CCC(c3cccc4ccccc43)CC2)CC1 ZINC000466115023 879827796 /nfs/dbraw/zinc/82/77/96/879827796.db2.gz XQEPUQZTSYBQJH-OAQYLSRUSA-N 0 3 422.617 4.002 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)NCCc2c[nH]c3ccc(Cl)cc23)o1 ZINC000466160554 879863705 /nfs/dbraw/zinc/86/37/05/879863705.db2.gz GTGJAJSBXMYVPS-UHFFFAOYSA-N 0 3 402.926 4.039 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)N[C@H]2COc3c2ccc(Cl)c3Cl)o1 ZINC000466193666 879886670 /nfs/dbraw/zinc/88/66/70/879886670.db2.gz GUWBRJUMLASDTA-INIZCTEOSA-N 0 3 412.317 4.102 20 0 HIADHN CC[C@H](C)C(=O)Nc1cccc(CNC(=O)N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)c1 ZINC000466214165 879906423 /nfs/dbraw/zinc/90/64/23/879906423.db2.gz APRDLLJRVMCCST-YDHSSHFGSA-N 0 3 422.573 4.133 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NC[C@H](C)Oc3cccc(C)c3)c(C)c2)CC1 ZINC000466220033 879916203 /nfs/dbraw/zinc/91/62/03/879916203.db2.gz DEQVFTIJRPNRMO-FQEVSTJZSA-N 0 3 410.562 4.034 20 0 HIADHN COc1ccc([C@H](CNC(=O)Nc2ccc(Br)cc2)N2CCCC2)cc1 ZINC000503481243 912523813 /nfs/dbraw/zinc/52/38/13/912523813.db2.gz YZHBINJQWMSUQN-IBGZPJMESA-N 0 3 418.335 4.416 20 0 HIADHN C[C@H](CNC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1)c1ccc(F)cc1F ZINC000466430131 880205048 /nfs/dbraw/zinc/20/50/48/880205048.db2.gz CXFVEZKROMXBEX-MSOLQXFVSA-N 0 3 401.501 4.374 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccc(O)cc1)C(=O)c1cc(F)c(F)c(F)c1F ZINC000503495705 912543824 /nfs/dbraw/zinc/54/38/24/912543824.db2.gz GNTRWAZCPWLFKW-AWEZNQCLSA-N 0 3 410.411 4.075 20 0 HIADHN CCOc1ccc(CN[C@@H]2CC(=O)N(Cc3ccccc3C(F)(F)F)C2)cc1OC ZINC000466446055 880223467 /nfs/dbraw/zinc/22/34/67/880223467.db2.gz MVJHKABLWGUORA-QGZVFWFLSA-N 0 3 422.447 4.003 20 0 HIADHN Cc1nc(COc2ccc(CN[C@H]3CC(=O)N(Cc4ccccc4)[C@@H]3C)cc2)cs1 ZINC000466476857 880257977 /nfs/dbraw/zinc/25/79/77/880257977.db2.gz BHOPGFGJAPKBSS-HXOBKFHXSA-N 0 3 421.566 4.310 20 0 HIADHN Cc1nc(COc2ccc(CN[C@@H]3CC(=O)N(Cc4ccccc4)[C@H]3C)cc2)cs1 ZINC000466476856 880258614 /nfs/dbraw/zinc/25/86/14/880258614.db2.gz BHOPGFGJAPKBSS-GAJHUEQPSA-N 0 3 421.566 4.310 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)NCc2ccc(-c3cccnc3)cc2)CN1Cc1ccccc1 ZINC000466511359 880285897 /nfs/dbraw/zinc/28/58/97/880285897.db2.gz AJBBJCIOHLETNX-DVECYGJZSA-N 0 3 400.526 4.211 20 0 HIADHN COc1ccc(OC(F)F)c(NC(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)c1 ZINC000466513196 880288122 /nfs/dbraw/zinc/28/81/22/880288122.db2.gz HNVJAZFXBFLWOL-GOEBONIOSA-N 0 3 405.445 4.081 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)N(Cc2ccccc2)CC2CCOCC2)CN1Cc1ccccc1 ZINC000466514552 880289408 /nfs/dbraw/zinc/28/94/08/880289408.db2.gz LDRZUGBMGDRXBG-BWKNWUBXSA-N 0 3 421.585 4.288 20 0 HIADHN C[C@H]1C[C@H](NC(=O)N2CCC(c3nc4ccccc4[nH]3)CC2)CN1Cc1ccccc1 ZINC000466521274 880297021 /nfs/dbraw/zinc/29/70/21/880297021.db2.gz WIQAYNZWGQYFAQ-RXVVDRJESA-N 0 3 417.557 4.115 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)Nc2cccc(C(=O)N3CCCCC3)c2)CN1Cc1ccccc1 ZINC000466523216 880299631 /nfs/dbraw/zinc/29/96/31/880299631.db2.gz VAMYGKVVZWFXOD-XXBNENTESA-N 0 3 420.557 4.097 20 0 HIADHN COCCOc1ccc(NC(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)cc1Cl ZINC000466537785 880312515 /nfs/dbraw/zinc/31/25/15/880312515.db2.gz BPNGCSUBULEHMS-QFBILLFUSA-N 0 3 417.937 4.150 20 0 HIADHN CCc1nc(C)c([C@H](C)N(C)C(=O)N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)s1 ZINC000466542558 880316830 /nfs/dbraw/zinc/31/68/30/880316830.db2.gz VNZDUWHBPMXFOI-IEZWGBDMSA-N 0 3 400.592 4.379 20 0 HIADHN CCc1nc(C)c([C@H](C)N(C)C(=O)N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)s1 ZINC000466542556 880317049 /nfs/dbraw/zinc/31/70/49/880317049.db2.gz VNZDUWHBPMXFOI-HHXXYDBFSA-N 0 3 400.592 4.379 20 0 HIADHN O=C(Nc1cc(Br)c(F)cc1F)N1CCN(C2CCCCC2)CC1 ZINC000466661518 880441366 /nfs/dbraw/zinc/44/13/66/880441366.db2.gz QSYLGZHEVIZZCW-UHFFFAOYSA-N 0 3 402.283 4.210 20 0 HIADHN COC(=O)c1ccc(C(C)C)c(NC(=O)N(C)C[C@@H]2CCN(C)[C@H]2c2cccnc2)c1 ZINC000466670618 880456475 /nfs/dbraw/zinc/45/64/75/880456475.db2.gz WEPYUNYMDDAHCY-UGKGYDQZSA-N 0 3 424.545 4.148 20 0 HIADHN CSc1ccc(F)cc1CNC(=O)N(CCN(C)C)Cc1ccc(F)cc1F ZINC000466825455 880596177 /nfs/dbraw/zinc/59/61/77/880596177.db2.gz MJYZHTPURAGBMZ-UHFFFAOYSA-N 0 3 411.493 4.099 20 0 HIADHN COCC[C@H]1CCCCN(C(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)C1 ZINC000466847010 880616012 /nfs/dbraw/zinc/61/60/12/880616012.db2.gz SQXLXECHOKYDOZ-CTNGQTDRSA-N 0 3 412.496 4.106 20 0 HIADHN CCOc1cc(CNCc2cccc3cc[nH]c32)ccc1OCC(=O)N1CCCCC1 ZINC000466899256 880666188 /nfs/dbraw/zinc/66/61/88/880666188.db2.gz ISXGOBZUUOXMJB-UHFFFAOYSA-N 0 3 421.541 4.248 20 0 HIADHN COc1cccc([C@@H](CNC(=O)Nc2cccc(-c3cc[nH]n3)c2)N2CCCC2)c1 ZINC000466898992 880666569 /nfs/dbraw/zinc/66/65/69/880666569.db2.gz FEKGFQJAWNPKOO-JOCHJYFZSA-N 0 3 405.502 4.044 20 0 HIADHN CN(CCN(Cc1noc(C2CCOCC2)n1)Cc1ccccc1)Cc1ccccc1 ZINC000466940459 880709878 /nfs/dbraw/zinc/70/98/78/880709878.db2.gz OSOQZEYZCWMUAH-UHFFFAOYSA-N 0 3 420.557 4.098 20 0 HIADHN C[C@@H](NC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C)c1ccc(-n2cccn2)cc1 ZINC000466956922 880739824 /nfs/dbraw/zinc/73/98/24/880739824.db2.gz COLBVTROMPEALX-NHCUHLMSSA-N 0 3 417.557 4.239 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)C(C)(C)Cc2ccc(C(F)(F)F)cc2)CC1 ZINC000466988296 880801757 /nfs/dbraw/zinc/80/17/57/880801757.db2.gz JPUYFAMNQYOSKZ-UHFFFAOYSA-N 0 3 414.512 4.280 20 0 HIADHN Cc1nc(CCC(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)oc1-c1ccccc1 ZINC000467028899 880828569 /nfs/dbraw/zinc/82/85/69/880828569.db2.gz NTUQBJOMFPLLMP-PGRDOPGGSA-N 0 3 403.526 4.362 20 0 HIADHN CCS[C@@H]1CC[C@H](N(C)C(=O)Nc2ccc(CCN3CCSCC3)cc2)C1 ZINC000467105700 880865823 /nfs/dbraw/zinc/86/58/23/880865823.db2.gz GJAUZWWNRKWZOE-VQTJNVASSA-N 0 3 407.649 4.416 20 0 HIADHN COCc1ccc([C@@H]2CCCN2CCC(=O)Nc2cccc(Br)c2)o1 ZINC000467120956 880876647 /nfs/dbraw/zinc/87/66/47/880876647.db2.gz RXKJQXKVSXNMDF-KRWDZBQOSA-N 0 3 407.308 4.354 20 0 HIADHN C[C@H](c1cccc(N2CCCS2(=O)=O)c1)N(C)C[C@@H]1CCC2(CCCCC2)O1 ZINC000467189951 880917178 /nfs/dbraw/zinc/91/71/78/880917178.db2.gz DISPJFALWUTBAD-NQIIRXRSSA-N 0 3 406.592 4.101 20 0 HIADHN C[C@@H](c1cccc(N2CCCS2(=O)=O)c1)N(C)C[C@@H]1CCC2(CCCCC2)O1 ZINC000467189953 880917206 /nfs/dbraw/zinc/91/72/06/880917206.db2.gz DISPJFALWUTBAD-RXVVDRJESA-N 0 3 406.592 4.101 20 0 HIADHN O=C(Nc1ccc(O)cc1)C1CCN(CCOc2ccc(OC(F)(F)F)cc2)CC1 ZINC000467195576 880924553 /nfs/dbraw/zinc/92/45/53/880924553.db2.gz MHRBIWSHCOINHC-UHFFFAOYSA-N 0 3 424.419 4.020 20 0 HIADHN CO[C@@H](C)c1nc(CN2CCCN(C[C@H]3CCC4(CCCCC4)O3)CC2)cs1 ZINC000467200429 880930243 /nfs/dbraw/zinc/93/02/43/880930243.db2.gz HWHKBQNOMLOIHC-AZUAARDMSA-N 0 3 407.624 4.240 20 0 HIADHN O=C(NCCN1CCCC1)c1ccc(CNCc2ccc(Oc3ccccc3)o2)cc1 ZINC000503557852 912631563 /nfs/dbraw/zinc/63/15/63/912631563.db2.gz MHOQAAPWQPMUDW-UHFFFAOYSA-N 0 3 419.525 4.187 20 0 HIADHN OCCOc1ccccc1CN[C@@H](c1cccc(Br)c1)C1CCOCC1 ZINC000467410163 881196870 /nfs/dbraw/zinc/19/68/70/881196870.db2.gz DUFJZZRADCUDHR-OAQYLSRUSA-N 0 3 420.347 4.078 20 0 HIADHN Cc1ccc(NC(=O)C[C@@H](C)NCc2cc(Cl)ccc2N2CCOCC2)c(C)c1 ZINC000467414740 881200783 /nfs/dbraw/zinc/20/07/83/881200783.db2.gz WMWGTMFNQOWVNO-GOSISDBHSA-N 0 3 415.965 4.300 20 0 HIADHN COc1cc(C(C)=O)ccc1OC[C@H](O)CN(C1CC1)[C@H]1CCCc2ccccc21 ZINC000503572797 912654045 /nfs/dbraw/zinc/65/40/45/912654045.db2.gz HRKWFVJQLXBAPW-GGAORHGYSA-N 0 3 409.526 4.180 20 0 HIADHN C[C@@H]1[C@@H](N[C@@H]2CCCc3ncc(C(F)(F)F)cc32)CC(=O)N1Cc1ccccc1 ZINC000467436708 881235671 /nfs/dbraw/zinc/23/56/71/881235671.db2.gz ZGEDREHQPBUKKZ-XMCHAPAWSA-N 0 3 403.448 4.257 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1cccc2c1CCC2 ZINC000467463868 881274650 /nfs/dbraw/zinc/27/46/50/881274650.db2.gz JGGBFCZKDOJBJJ-OAQYLSRUSA-N 0 3 400.526 4.380 20 0 HIADHN CC(C)n1cnnc1-c1ccccc1NC(=O)N[C@@H]1C[C@H](C)N(Cc2ccccc2)C1 ZINC000467466958 881281104 /nfs/dbraw/zinc/28/11/04/881281104.db2.gz TYMHGLICOVEGHB-AZUAARDMSA-N 0 3 418.545 4.311 20 0 HIADHN Cc1ccnc(-c2cccc(NC(=O)N[C@H]3C[C@H](C)N(Cc4ccccc4)C3)c2)n1 ZINC000467469551 881286188 /nfs/dbraw/zinc/28/61/88/881286188.db2.gz OSKPPHUVGYTBNN-AVRDEDQJSA-N 0 3 401.514 4.237 20 0 HIADHN O=C(Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)[C@@H]1C[C@H]1c1ccc(F)cc1 ZINC000467476091 881295206 /nfs/dbraw/zinc/29/52/06/881295206.db2.gz NASYOAHUBYKCEC-FDFHNCONSA-N 0 3 404.489 4.211 20 0 HIADHN Cc1ccc(C)c(OCCCCC(=O)NCc2ccccc2CN2CCC(O)CC2)c1 ZINC000467493709 881311673 /nfs/dbraw/zinc/31/16/73/881311673.db2.gz HJJSLHZUWBZQQI-UHFFFAOYSA-N 0 3 424.585 4.126 20 0 HIADHN O=C(CCc1ccc(Cl)cc1Cl)NCc1ccccc1CN1CCC(O)CC1 ZINC000467498602 881315459 /nfs/dbraw/zinc/31/54/59/881315459.db2.gz JNZLGRHVMXZNIL-UHFFFAOYSA-N 0 3 421.368 4.199 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)c1ccccc1Nc1ccccc1 ZINC000467503295 881318339 /nfs/dbraw/zinc/31/83/39/881318339.db2.gz ODXLPWBQMBFTLF-UHFFFAOYSA-N 0 3 415.537 4.317 20 0 HIADHN CC1(C)OCc2cc(CN3CCC[C@@H](C(=O)Nc4ccc(Cl)cn4)C3)ccc2O1 ZINC000469065876 883143731 /nfs/dbraw/zinc/14/37/31/883143731.db2.gz QOTYLZFJUFAWQW-MRXNPFEDSA-N 0 3 415.921 4.231 20 0 HIADHN CN(C(=O)NCC1(c2cc(C(F)(F)F)ccc2Cl)CC1)[C@@H]1CCN(C2CC2)C1 ZINC000469113719 883205566 /nfs/dbraw/zinc/20/55/66/883205566.db2.gz JQISJQAOOYWRAE-OAHLLOKOSA-N 0 3 415.887 4.269 20 0 HIADHN COc1cc([C@@H](C)NCc2ccc(C)nc2-n2cc(Cl)cn2)cc(OC)c1OC ZINC000469151454 883248701 /nfs/dbraw/zinc/24/87/01/883248701.db2.gz RXUPMHHESMXIHL-CQSZACIVSA-N 0 3 416.909 4.106 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)c1ccc(C(=O)c2cc[nH]c2)cc1 ZINC000469157543 883255838 /nfs/dbraw/zinc/25/58/38/883255838.db2.gz ZQZVSTDECHTJDA-UHFFFAOYSA-N 0 3 419.550 4.089 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3ccc(OCC(F)(F)F)c(C)c3)cc2)CC1 ZINC000469189548 883289371 /nfs/dbraw/zinc/28/93/71/883289371.db2.gz HEWNXAHWQAYVMK-UHFFFAOYSA-N 0 3 421.463 4.330 20 0 HIADHN CC[C@@H]1C[C@H](CN[C@@H](c2cccc(S(C)(=O)=O)c2)c2ccc(F)c(F)c2)CCO1 ZINC000503602013 912692231 /nfs/dbraw/zinc/69/22/31/912692231.db2.gz JRJIOERMAPRUEB-LDJQZATESA-N 0 3 423.525 4.253 20 0 HIADHN CCCN(CC)c1ccc(C(=O)N(C)C2CCN(CCc3ccccn3)CC2)cc1 ZINC000503602421 912694341 /nfs/dbraw/zinc/69/43/41/912694341.db2.gz MAFODDBBPGZOFY-UHFFFAOYSA-N 0 3 408.590 4.097 20 0 HIADHN CCOc1ccc([C@@H](C)N[C@H]2CCCN(Cc3ccc(F)cc3F)C2=O)cc1OC ZINC000469230951 883329872 /nfs/dbraw/zinc/32/98/72/883329872.db2.gz KGQJXPBVVPJBLM-QRWLVFNGSA-N 0 3 418.484 4.214 20 0 HIADHN CCOC(=O)[C@](C)(CN[C@H](C)C(=O)Nc1ccc(Cl)cc1C)c1ccccc1 ZINC000469305901 883406353 /nfs/dbraw/zinc/40/63/53/883406353.db2.gz UTZCKMFEQGKFFN-OPAMFIHVSA-N 0 3 402.922 4.086 20 0 HIADHN CC(C)[C@@H](CNC(=O)N(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1)Cc1ccccc1 ZINC000469335220 883446481 /nfs/dbraw/zinc/44/64/81/883446481.db2.gz LJVPWWCRHXIVJS-VXNXHJTFSA-N 0 3 408.590 4.231 20 0 HIADHN CC1CCN([C@@H](CNC(=O)c2ccc(O[C@H]3CCOC3)cc2)c2ccccc2)CC1 ZINC000469335549 883447019 /nfs/dbraw/zinc/44/70/19/883447019.db2.gz KNKDCPBMTSGRRQ-ZEQRLZLVSA-N 0 3 408.542 4.057 20 0 HIADHN O=C(CCCc1ccc([O-])c(F)c1)N1CC[C@@]2(C1)CCC[N@H+](Cc1ccccc1)C2 ZINC000469427423 883606611 /nfs/dbraw/zinc/60/66/11/883606611.db2.gz BYUJBGSLBLTNFR-VWLOTQADSA-N 0 3 410.533 4.369 20 0 HIADHN O=C(CCCc1ccc([O-])c(F)c1)N1CC[C@@]2(C1)CCC[N@@H+](Cc1ccccc1)C2 ZINC000469427423 883606647 /nfs/dbraw/zinc/60/66/47/883606647.db2.gz BYUJBGSLBLTNFR-VWLOTQADSA-N 0 3 410.533 4.369 20 0 HIADHN Cc1cnc([C@H](NC(=O)N[C@@H](CN(C)Cc2ccccc2)C(C)C)C2CC2)s1 ZINC000469438758 883627197 /nfs/dbraw/zinc/62/71/97/883627197.db2.gz OHDBVKJYATXOQN-VQTJNVASSA-N 0 3 400.592 4.358 20 0 HIADHN O=C(CCN1CCC(=Cc2ccc(F)c(F)c2)CC1)N1CCc2sccc2C1 ZINC000469445534 883641570 /nfs/dbraw/zinc/64/15/70/883641570.db2.gz CTLBLKWGHNPRGV-UHFFFAOYSA-N 0 3 402.510 4.481 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3ccc(Oc4ccccn4)cc3)cc2)CC1 ZINC000469520174 883785228 /nfs/dbraw/zinc/78/52/28/883785228.db2.gz GFSWJMVGPACJSS-UHFFFAOYSA-N 0 3 402.498 4.268 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)C2(c3c(Cl)cccc3Cl)CCC2)CC1 ZINC000469541112 883807117 /nfs/dbraw/zinc/80/71/17/883807117.db2.gz ZHADCYAUNVCUMK-UHFFFAOYSA-N 0 3 413.389 4.421 20 0 HIADHN Cc1cc(NC[C@H](c2cccc(C(F)(F)F)c2)N(C)C)nc(-c2ccncc2)n1 ZINC000469549116 883809520 /nfs/dbraw/zinc/80/95/20/883809520.db2.gz HDAJHGYVXQDVFD-GOSISDBHSA-N 0 3 401.436 4.003 20 0 HIADHN COc1cc(OC)c(CNC[C@@H](c2cccc(C(F)(F)F)c2)N(C)C)c(OC)c1 ZINC000469564300 883815760 /nfs/dbraw/zinc/81/57/60/883815760.db2.gz WRAHSAMDWMJUNV-SFHVURJKSA-N 0 3 412.452 4.124 20 0 HIADHN Cc1[nH]cnc1CC(=O)N[C@@H](c1ccccc1)c1ccc(Br)cc1F ZINC000469563175 883816229 /nfs/dbraw/zinc/81/62/29/883816229.db2.gz DEMLEQZRRFHLCS-IBGZPJMESA-N 0 3 402.267 4.068 20 0 HIADHN Cc1ccc(F)c(C(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)c1Br ZINC000469584440 883823874 /nfs/dbraw/zinc/82/38/74/883823874.db2.gz GQUDRPMISOHYBT-GOEBONIOSA-N 0 3 405.311 4.289 20 0 HIADHN CCN1CCN(CCC(=O)NC2(c3cccc(C(F)(F)F)c3)CCCCC2)CC1 ZINC000469587179 883825621 /nfs/dbraw/zinc/82/56/21/883825621.db2.gz PHGIMWLATTZGCQ-UHFFFAOYSA-N 0 3 411.512 4.009 20 0 HIADHN C[C@@H]1CC[C@@H](C)N1CC(=O)NCc1ccc(Oc2ccccc2C(F)(F)F)nc1 ZINC000469605707 883831641 /nfs/dbraw/zinc/83/16/41/883831641.db2.gz WPFWNSBKBMABIT-HUUCEWRRSA-N 0 3 407.436 4.382 20 0 HIADHN Nc1c(Cl)ccc(C(=O)N2CCCN(CCCc3ccccc3)CC2)c1Cl ZINC000469644068 883846666 /nfs/dbraw/zinc/84/66/66/883846666.db2.gz MVBDCWHRFBNKDM-UHFFFAOYSA-N 0 3 406.357 4.356 20 0 HIADHN Cc1ccn(-c2ccccc2NC(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)n1 ZINC000469646895 883847137 /nfs/dbraw/zinc/84/71/37/883847137.db2.gz ALDUBRIFQZWUGY-FQEVSTJZSA-N 0 3 403.530 4.309 20 0 HIADHN Cc1ccn(-c2ccccc2NC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)n1 ZINC000469665569 883857859 /nfs/dbraw/zinc/85/78/59/883857859.db2.gz OWJKRTSQQSDLHM-HXUWFJFHSA-N 0 3 403.530 4.309 20 0 HIADHN Cc1cccc(NC(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)c1Br ZINC000469664923 883857953 /nfs/dbraw/zinc/85/79/53/883857953.db2.gz KJOBOLZRVZKOTF-QGZVFWFLSA-N 0 3 402.336 4.496 20 0 HIADHN Cc1ccn(-c2ccccc2NC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)n1 ZINC000469665568 883858068 /nfs/dbraw/zinc/85/80/68/883858068.db2.gz OWJKRTSQQSDLHM-FQEVSTJZSA-N 0 3 403.530 4.309 20 0 HIADHN CCN1CCN(CCC(=O)N(Cc2ccc(-c3ccccc3OC)cc2)C(C)C)CC1 ZINC000469717422 883884504 /nfs/dbraw/zinc/88/45/04/883884504.db2.gz MULZUDYVYFIRJS-UHFFFAOYSA-N 0 3 423.601 4.127 20 0 HIADHN C[C@H](N[C@H]1CCN(c2ccccc2C(F)(F)F)C1=O)c1cccc(-n2ccnc2)c1 ZINC000469767118 883937768 /nfs/dbraw/zinc/93/77/68/883937768.db2.gz YJVGQEQWLJLERH-KXBFYZLASA-N 0 3 414.431 4.347 20 0 HIADHN CN(C)[C@@H](CN[C@@H](c1ccccc1)c1cncnc1)c1cccc(C(F)(F)F)c1 ZINC000469789599 883964460 /nfs/dbraw/zinc/96/44/60/883964460.db2.gz FSCOJIDZTZSQQO-SFTDATJTSA-N 0 3 400.448 4.477 20 0 HIADHN O=C(CCc1ccc2ccccc2c1)NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000469839961 884020704 /nfs/dbraw/zinc/02/07/04/884020704.db2.gz WIXHQUWSCCLAQQ-RUZDIDTESA-N 0 3 402.538 4.180 20 0 HIADHN CC1CCN([C@H](CNC(=O)N2CC[C@H](C)[C@H](n3ccnc3)C2)c2cccs2)CC1 ZINC000469863827 884052387 /nfs/dbraw/zinc/05/23/87/884052387.db2.gz SYJYWSBUGMXJME-XUVXKRRUSA-N 0 3 415.607 4.010 20 0 HIADHN O=C(NC[C@H]1CN(Cc2ccccc2)CCCO1)C1(c2cccc(F)c2)CCCC1 ZINC000469865575 884055051 /nfs/dbraw/zinc/05/50/51/884055051.db2.gz VYTJDXDXWHPBHK-QHCPKHFHSA-N 0 3 410.533 4.045 20 0 HIADHN CCSc1cc(Cl)ccc1C(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000469868448 884058485 /nfs/dbraw/zinc/05/84/85/884058485.db2.gz CDMPCDGIEVNLQO-LJQANCHMSA-N 0 3 418.990 4.473 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)c2ccc(Cl)c(N)c2Cl)cc1 ZINC000469878922 884070310 /nfs/dbraw/zinc/07/03/10/884070310.db2.gz DATZBKBGBNKBFU-QGZVFWFLSA-N 0 3 408.329 4.151 20 0 HIADHN CCC[C@@H]1C[C@H](C(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)CCO1 ZINC000503678464 912784992 /nfs/dbraw/zinc/78/49/92/912784992.db2.gz GEALXJNUWYQBFE-YPAWHYETSA-N 0 3 410.562 4.172 20 0 HIADHN CC(C)C[C@H](C)n1nccc1NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000469900201 884090642 /nfs/dbraw/zinc/09/06/42/884090642.db2.gz MYERUVWFBFUXEE-OOHWJJMZSA-N 0 3 415.504 4.417 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3cc(NC(=O)C(C)(C)C)ccc3C)cc2)CC1 ZINC000469962965 884170576 /nfs/dbraw/zinc/17/05/76/884170576.db2.gz NGSGIOMLYKEDNQ-UHFFFAOYSA-N 0 3 422.573 4.374 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@H]2NC(=O)NC[C@H]2CCCN2Cc2ccccc2)cc1 ZINC000470023863 884242689 /nfs/dbraw/zinc/24/26/89/884242689.db2.gz GINLYTNDHUOEKC-SMIHKQSGSA-N 0 3 407.558 4.179 20 0 HIADHN Cc1ccc([C@H]2OCCC[C@@H]2NC(=O)N2CCCN(Cc3ccccc3)CC2)cc1 ZINC000470052602 884300052 /nfs/dbraw/zinc/30/00/52/884300052.db2.gz BZEJDJWWOBKIQG-BJKOFHAPSA-N 0 3 407.558 4.133 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)NCc1cc(N(C)C)nc2ccccc12 ZINC000470085334 884344840 /nfs/dbraw/zinc/34/48/40/884344840.db2.gz YMLHQGSJNMNGJK-UHFFFAOYSA-N 0 3 402.498 4.039 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)Nc3cc(F)ccc3OC(F)F)cc2)CC1 ZINC000470096658 884354589 /nfs/dbraw/zinc/35/45/89/884354589.db2.gz ZQTUYWCXAYOUIP-UHFFFAOYSA-N 0 3 407.436 4.210 20 0 HIADHN CC(C)Nc1ccc(Br)cc1NC(=O)CC1(N2CCOCC2)CCCC1 ZINC000470116900 884377135 /nfs/dbraw/zinc/37/71/35/884377135.db2.gz ILZVLHFRZVJAHK-UHFFFAOYSA-N 0 3 424.383 4.243 20 0 HIADHN Cc1c(C(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)cnn1Cc1ccccc1 ZINC000503765971 912818933 /nfs/dbraw/zinc/81/89/33/912818933.db2.gz SOAKLQICZDLGPW-UHFFFAOYSA-N 0 3 417.557 4.023 20 0 HIADHN O=C(Nc1cccc(-n2cccc2)c1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000470142798 884408839 /nfs/dbraw/zinc/40/88/39/884408839.db2.gz PTIYKEKQKYNQHR-UHFFFAOYSA-N 0 3 406.452 4.404 20 0 HIADHN CC(C)N(CCN(C)C)C(=O)Nc1ccc(OC(F)(F)F)c(Br)c1 ZINC000470152424 884421748 /nfs/dbraw/zinc/42/17/48/884421748.db2.gz MQGDKDUGAOLMIW-UHFFFAOYSA-N 0 3 412.250 4.152 20 0 HIADHN Cc1cccc2[nH]cc(CCNC(=O)N(CCN(C)C)Cc3cccc(Cl)c3)c21 ZINC000503799197 912827172 /nfs/dbraw/zinc/82/71/72/912827172.db2.gz VBGXFQYYIBFZMZ-UHFFFAOYSA-N 0 3 412.965 4.446 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N[C@@H](C)c3ccc(-c4ccncc4)cc3)cc2)CC1 ZINC000470196154 884503905 /nfs/dbraw/zinc/50/39/05/884503905.db2.gz SJRVMYHXUICJKW-FQEVSTJZSA-N 0 3 414.553 4.382 20 0 HIADHN CCCNC(=O)C1(NCc2cc(Br)cc3cccnc32)CCCCC1 ZINC000470200602 884513409 /nfs/dbraw/zinc/51/34/09/884513409.db2.gz CAJCSGVVOSKDFQ-UHFFFAOYSA-N 0 3 404.352 4.316 20 0 HIADHN O=C(CN[C@@H](c1ccc(Br)cc1)C1CC1)N[C@H]1CCOc2ccccc21 ZINC000503852866 912841056 /nfs/dbraw/zinc/84/10/56/912841056.db2.gz ANTVOLHXYRXHIJ-GHTZIAJQSA-N 0 3 415.331 4.130 20 0 HIADHN Cc1ccc(-n2cccn2)cc1NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000470260351 884603132 /nfs/dbraw/zinc/60/31/32/884603132.db2.gz BLBVWSHFSYDSQR-UHFFFAOYSA-N 0 3 421.467 4.108 20 0 HIADHN Cc1ccc([C@H](Cc2ccccc2Br)N[C@@H](C)C(=O)NCCF)cc1 ZINC000503883265 912850012 /nfs/dbraw/zinc/85/00/12/912850012.db2.gz CRLXDEJZFUEEJA-KXBFYZLASA-N 0 3 407.327 4.105 20 0 HIADHN Cc1cccc([C@@H](N[C@H](C)CCCOc2ccccc2C(N)=O)c2ccccn2)c1 ZINC000470306749 884683757 /nfs/dbraw/zinc/68/37/57/884683757.db2.gz HCKCDQWBDHNANU-NTKDMRAZSA-N 0 3 403.526 4.416 20 0 HIADHN C[C@H](CO)N1CCCN(C(=O)Nc2ccc(Sc3ccccc3)c(Cl)c2)CC1 ZINC000470364751 884758355 /nfs/dbraw/zinc/75/83/55/884758355.db2.gz MTBDTZCWEAMAEN-MRXNPFEDSA-N 0 3 419.978 4.412 20 0 HIADHN O=C(CN[C@H](Cc1ccc(F)cc1)c1ccccc1)N[C@H]1CCOc2ccccc21 ZINC000503920179 912864679 /nfs/dbraw/zinc/86/46/79/912864679.db2.gz KXEQGGJIIJXFLN-XZOQPEGZSA-N 0 3 404.485 4.339 20 0 HIADHN Cc1cccc(NC(=O)C[C@@H](C)N[C@H](Cn2ccccc2=O)c2ccccc2)c1C ZINC000503927299 912868158 /nfs/dbraw/zinc/86/81/58/912868158.db2.gz PDIMCZWOSIQLED-AUSIDOKSSA-N 0 3 403.526 4.213 20 0 HIADHN C[C@@H](NCC1(OCCO)CCOCC1)c1ccc(Oc2ccc(F)cc2)cc1Cl ZINC000503931018 912869263 /nfs/dbraw/zinc/86/92/63/912869263.db2.gz UYLLRMILISBDKW-MRXNPFEDSA-N 0 3 423.912 4.480 20 0 HIADHN COc1cccc(-c2noc([C@@H](C)NC(=O)c3oc4ccccc4c3CN(C)C)n2)c1 ZINC000470520577 884912539 /nfs/dbraw/zinc/91/25/39/884912539.db2.gz SVAKKYZJTZKYPD-CQSZACIVSA-N 0 3 420.469 4.044 20 0 HIADHN COC[C@@H](C)Oc1ccc(Cl)cc1NC(=O)N(CCN(C)C)Cc1ccccc1 ZINC000470521806 884913973 /nfs/dbraw/zinc/91/39/73/884913973.db2.gz VKEUTDVXESPYRB-QGZVFWFLSA-N 0 3 419.953 4.349 20 0 HIADHN CN(C(=O)c1cnn(Cc2ccccc2Cl)c1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470656901 885080533 /nfs/dbraw/zinc/08/05/33/885080533.db2.gz JTXZKDSJDUWRSY-QFIPXVFZSA-N 0 3 422.960 4.321 20 0 HIADHN CN(C(=O)Cc1coc(-c2ccc(F)cc2)n1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470657058 885081350 /nfs/dbraw/zinc/08/13/50/885081350.db2.gz QPGWCHAXGRKUHR-QFIPXVFZSA-N 0 3 407.489 4.146 20 0 HIADHN C[C@@H]1C[C@@H]1C(=O)Nc1cccc(C(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000470665717 885092571 /nfs/dbraw/zinc/09/25/71/885092571.db2.gz GKDJSHOMPIRVRF-YSZBQJHXSA-N 0 3 405.542 4.018 20 0 HIADHN CN(C(=O)Cc1ccc(Br)cc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470669212 885097814 /nfs/dbraw/zinc/09/78/14/885097814.db2.gz RFAFCHVTBWUHSO-FQEVSTJZSA-N 0 3 401.348 4.115 20 0 HIADHN Cc1cccc2nc(CN3CCCN(Cc4ccc(C(F)(F)F)cc4)CC3)cn21 ZINC000503985675 912898028 /nfs/dbraw/zinc/89/80/28/912898028.db2.gz KBWFBEHQSWXSSN-UHFFFAOYSA-N 0 3 402.464 4.369 20 0 HIADHN CN(C(=O)Cc1cccc(Br)c1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470675824 885106567 /nfs/dbraw/zinc/10/65/67/885106567.db2.gz UTKIPLYWJXSLCG-FQEVSTJZSA-N 0 3 401.348 4.115 20 0 HIADHN CN(C(=O)c1cnn(-c2ccc(Cl)cc2)c1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470683047 885115876 /nfs/dbraw/zinc/11/58/76/885115876.db2.gz OSBMOXZBTOVBCN-QFIPXVFZSA-N 0 3 408.933 4.262 20 0 HIADHN CN(C(=O)NCCc1c[nH]c2cc(F)ccc12)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470719178 885162366 /nfs/dbraw/zinc/16/23/66/885162366.db2.gz CFMBAJVGAXXWJG-NRFANRHFSA-N 0 3 408.521 4.156 20 0 HIADHN CN(C(=O)N[C@@H]1CCCOc2ccc(F)cc21)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470720281 885164780 /nfs/dbraw/zinc/16/47/80/885164780.db2.gz RWXCCCBVMOFLNT-IFMALSPDSA-N 0 3 411.521 4.345 20 0 HIADHN O=C(c1cccc(Cl)c1)N1CCCN(C[C@@H](O)Cc2ccc3ccccc3c2)CC1 ZINC000470720685 885166298 /nfs/dbraw/zinc/16/62/98/885166298.db2.gz YCQMDZSABNYSRY-DEOSSOPVSA-N 0 3 422.956 4.245 20 0 HIADHN COc1ccc(Cl)cc1CNC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470723079 885171388 /nfs/dbraw/zinc/17/13/88/885171388.db2.gz MXHXWTMYGYRBGZ-FQEVSTJZSA-N 0 3 401.938 4.155 20 0 HIADHN CN(C(=O)NC[C@@H]1CCCO[C@H]1c1ccccc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470726960 885177328 /nfs/dbraw/zinc/17/73/28/885177328.db2.gz PYBCQYPMYRMOPS-SDHOMARFSA-N 0 3 421.585 4.460 20 0 HIADHN CN(C(=O)NC[C@@H]1CCCO[C@@H]1c1ccccc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470726955 885177681 /nfs/dbraw/zinc/17/76/81/885177681.db2.gz PYBCQYPMYRMOPS-CCDWMCETSA-N 0 3 421.585 4.460 20 0 HIADHN CN(C(=O)NCCCCOc1ccc(F)cc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470736638 885193641 /nfs/dbraw/zinc/19/36/41/885193641.db2.gz IXHBYAQRROFHII-JOCHJYFZSA-N 0 3 413.537 4.291 20 0 HIADHN CN(C(=O)NCCc1cccc2cccnc21)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470742282 885204313 /nfs/dbraw/zinc/20/43/13/885204313.db2.gz AYBGBQOZBWTPFG-QHCPKHFHSA-N 0 3 402.542 4.083 20 0 HIADHN CN(C(=O)N[C@H](c1ccccc1)c1ccccn1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470750178 885214272 /nfs/dbraw/zinc/21/42/72/885214272.db2.gz CFYGLSYNLJCMJP-ILBGXUMGSA-N 0 3 414.553 4.477 20 0 HIADHN COc1ccc([C@@H](CNC(=O)CCc2cnc3ccccc3c2)N2CCCC2)cc1 ZINC000470750380 885215104 /nfs/dbraw/zinc/21/51/04/885215104.db2.gz DJOOHSPZDDPXPY-XMMPIXPASA-N 0 3 403.526 4.129 20 0 HIADHN Cc1cc(-c2cc(C(=O)N3CCN4CCC3CC4)c3cnn(C(C)C)c3n2)c(C)s1 ZINC000470843105 885338966 /nfs/dbraw/zinc/33/89/66/885338966.db2.gz BQOXYCRLDBAMRQ-UHFFFAOYSA-N 0 3 423.586 4.278 20 0 HIADHN Cc1ccc(Oc2ccc(NC(=O)N(CCN(C)C)Cc3ccccn3)cn2)cc1C ZINC000504022369 912926518 /nfs/dbraw/zinc/92/65/18/912926518.db2.gz RVUYNBQOBPJBOZ-UHFFFAOYSA-N 0 3 419.529 4.481 20 0 HIADHN CN(C(=O)NCc1ccccc1OC1CCC1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470882491 885375603 /nfs/dbraw/zinc/37/56/03/885375603.db2.gz DQHVYUYNMGUCHC-JOCHJYFZSA-N 0 3 407.558 4.424 20 0 HIADHN CN(C(=O)CN1CCN(C)CC12CCCCC2)C(c1ccccc1)c1ccccc1 ZINC000471037832 885547562 /nfs/dbraw/zinc/54/75/62/885547562.db2.gz MRLOPCVWQNQSIQ-UHFFFAOYSA-N 0 3 405.586 4.185 20 0 HIADHN Cc1cc(NC(=O)c2cccc3oc(C)nc32)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000471052338 885565208 /nfs/dbraw/zinc/56/52/08/885565208.db2.gz JTUTUKQQSIRFTN-IBGZPJMESA-N 0 3 415.497 4.340 20 0 HIADHN Cc1cccc(I)c1C(=O)N[C@H](C)[C@@H](c1ccccc1)N(C)C ZINC000471139722 885683337 /nfs/dbraw/zinc/68/33/37/885683337.db2.gz KBROLAINIOASLR-KDOFPFPSSA-N 0 3 422.310 4.021 20 0 HIADHN Cc1noc(C)c1CSc1ncccc1C(=O)N[C@H](C)[C@@H](c1ccccc1)N(C)C ZINC000471141170 885685204 /nfs/dbraw/zinc/68/52/04/885685204.db2.gz UKUPLLBRJWRLHD-IERDGZPVSA-N 0 3 424.570 4.400 20 0 HIADHN CC1(C)Oc2ccc(NC(=O)NC3CC(N4CCC(C(F)(F)F)CC4)C3)cc2O1 ZINC000471240621 885817201 /nfs/dbraw/zinc/81/72/01/885817201.db2.gz MMBRSKGXZKMTOG-UHFFFAOYSA-N 0 3 413.440 4.121 20 0 HIADHN CSc1nc(C(C)(C)C)nc(C)c1C(=O)NC[C@H](C)N(C)Cc1ccccc1 ZINC000471260921 885839616 /nfs/dbraw/zinc/83/96/16/885839616.db2.gz FOMOSBIMSVQXMX-HNNXBMFYSA-N 0 3 400.592 4.055 20 0 HIADHN COc1ccc2cc(NC(=O)NC3CC(N4CCC(C(F)(F)F)CC4)C3)ccc2n1 ZINC000471289563 885874144 /nfs/dbraw/zinc/87/41/44/885874144.db2.gz UAJXBCUQSFBSMK-UHFFFAOYSA-N 0 3 422.451 4.170 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)C3(CCOCc4ccccc4)CC3)c(C)c2)CC1 ZINC000471351174 885966858 /nfs/dbraw/zinc/96/68/58/885966858.db2.gz ULFYGQQJIOQADC-UHFFFAOYSA-N 0 3 421.585 4.463 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(Cl)cc2)CC1)c1coc(C2CCCC2)n1 ZINC000471383658 886032508 /nfs/dbraw/zinc/03/25/08/886032508.db2.gz LYXPOMRXXAJJAK-UHFFFAOYSA-N 0 3 417.937 4.259 20 0 HIADHN C[C@H]1[C@H](NC(=O)N[C@H]2C[C@@H]2c2ccccc2OC(F)F)CCN1Cc1ccccc1 ZINC000504103815 913012916 /nfs/dbraw/zinc/01/29/16/913012916.db2.gz MTPOLWAODZDSOX-OBZTUIKSSA-N 0 3 415.484 4.106 20 0 HIADHN Cc1cc(NC(=O)C(C)(C)C)sc1C(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C ZINC000471528070 886230910 /nfs/dbraw/zinc/23/09/10/886230910.db2.gz DEXNSGNJDANQOM-MAUKXSAKSA-N 0 3 401.576 4.462 20 0 HIADHN C[C@H](NC(=O)c1ccc(NC(=O)c2cccs2)cc1)[C@H](c1ccccc1)N(C)C ZINC000471548386 886256722 /nfs/dbraw/zinc/25/67/22/886256722.db2.gz RIFAHZCOZXGPSF-HRAATJIYSA-N 0 3 407.539 4.422 20 0 HIADHN Cc1nc(COc2cccc(C(=O)N[C@@H](C)[C@@H](c3ccccc3)N(C)C)c2)cs1 ZINC000471556057 886264403 /nfs/dbraw/zinc/26/44/03/886264403.db2.gz PCOPSMQLEVQCBT-AOMKIAJQSA-N 0 3 409.555 4.452 20 0 HIADHN C[C@H](NC(=O)c1ccc(NC(=O)c2ccccc2)cc1)[C@H](c1ccccc1)N(C)C ZINC000471575162 886285984 /nfs/dbraw/zinc/28/59/84/886285984.db2.gz VYSZUIKHIKHRII-FDDCHVKYSA-N 0 3 401.510 4.360 20 0 HIADHN C[C@H](NC(=O)c1nn(-c2ccc(F)c(F)c2)c2c1CCC2)[C@H](c1ccccc1)N(C)C ZINC000471577404 886290059 /nfs/dbraw/zinc/29/00/59/886290059.db2.gz KAKLWBYMZXFOIG-NPMXOYFQSA-N 0 3 424.495 4.060 20 0 HIADHN CCc1ccc([C@H](NC2CC(OC(C)C)C2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000471590684 886302843 /nfs/dbraw/zinc/30/28/43/886302843.db2.gz NSYSRVFLUIIXRA-BBHUYCHWSA-N 0 3 401.572 4.288 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)C3(CCOCc4ccccc4)CC3)c2)CC1 ZINC000471633657 886351137 /nfs/dbraw/zinc/35/11/37/886351137.db2.gz JZLDRCQFVPFTDB-UHFFFAOYSA-N 0 3 407.558 4.154 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)c3cc(C)nc4onc(C(C)C)c43)c2)CC1 ZINC000471666001 886379266 /nfs/dbraw/zinc/37/92/66/886379266.db2.gz UMVVSOXOQNUENS-UHFFFAOYSA-N 0 3 407.518 4.049 20 0 HIADHN CC(C)(C(=O)NCCCCN1CCN(c2cccc(C(F)(F)F)c2)CC1)C(F)F ZINC000471735814 886458169 /nfs/dbraw/zinc/45/81/69/886458169.db2.gz IPOOMYBDUGGEBI-UHFFFAOYSA-N 0 3 421.454 4.015 20 0 HIADHN CCc1c(C(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)cnn1-c1ccc(OC)cc1 ZINC000471739646 886462012 /nfs/dbraw/zinc/46/20/12/886462012.db2.gz VNWYSBGWUHFYMT-AZUAARDMSA-N 0 3 418.541 4.009 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)c1ccc(Cl)cc1C(F)(F)F ZINC000471741830 886464159 /nfs/dbraw/zinc/46/41/59/886464159.db2.gz TXNLQIZQRMZHBR-UHFFFAOYSA-N 0 3 406.901 4.450 20 0 HIADHN O=C(NCCCc1cccc(Cl)c1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000471755338 886485804 /nfs/dbraw/zinc/48/58/04/886485804.db2.gz DJHUFRNBLQRMJS-UHFFFAOYSA-N 0 3 417.903 4.377 20 0 HIADHN CC(C)(C)OCc1cc(C(=O)N(CCN2CCCC2)Cc2ccc(Cl)cc2)no1 ZINC000471806557 886544638 /nfs/dbraw/zinc/54/46/38/886544638.db2.gz ZGLZXHAVIKCTEG-UHFFFAOYSA-N 0 3 419.953 4.381 20 0 HIADHN CC(C)(CNC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1ccccc1F ZINC000471809738 886547814 /nfs/dbraw/zinc/54/78/14/886547814.db2.gz LJJUUQXFESMIPP-UHFFFAOYSA-N 0 3 415.475 4.208 20 0 HIADHN CC(=O)Nc1cc(C(=O)N(CCN(C)C)CC2CCCCC2)cc(C(F)(F)F)c1 ZINC000471820732 886563969 /nfs/dbraw/zinc/56/39/69/886563969.db2.gz IAJZFTARGICDNP-UHFFFAOYSA-N 0 3 413.484 4.248 20 0 HIADHN Cc1cn([C@H](C)c2ccccc2)nc1NC(=O)N[C@@H](C)CN(C)Cc1ccccc1 ZINC000471832560 886584028 /nfs/dbraw/zinc/58/40/28/886584028.db2.gz ATNKDGAXBWMDHY-VQTJNVASSA-N 0 3 405.546 4.443 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N[C@@H]1CCC[C@@H]1c1ccccc1 ZINC000471871396 886650720 /nfs/dbraw/zinc/65/07/20/886650720.db2.gz LHZXMIAGWFPUIJ-NTFDOXNWSA-N 0 3 409.496 4.427 20 0 HIADHN O=C(Cc1ncccc1F)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000471918441 886706437 /nfs/dbraw/zinc/70/64/37/886706437.db2.gz LMHGGJIWMQDWAT-UHFFFAOYSA-N 0 3 410.320 4.195 20 0 HIADHN CN1CC[C@H](NC(=O)N[C@H](c2cccc(F)c2F)C(F)(F)F)[C@@H]1c1ccccc1 ZINC000471935211 886732352 /nfs/dbraw/zinc/73/23/52/886732352.db2.gz ZZQKKWVPWHZNSV-RYQLBKOJSA-N 0 3 413.390 4.313 20 0 HIADHN CC(C)(CNC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1cccc(F)c1 ZINC000471937286 886734891 /nfs/dbraw/zinc/73/48/91/886734891.db2.gz QIPINHZBLWXMEO-UHFFFAOYSA-N 0 3 415.475 4.208 20 0 HIADHN C[C@@H](NC(=O)NC[C@@H](Cc1ccccc1)N(C)C)c1nc(-c2ccccc2)cs1 ZINC000504191616 913074836 /nfs/dbraw/zinc/07/48/36/913074836.db2.gz VYZFIUZYJGZNTE-YLJYHZDGSA-N 0 3 408.571 4.343 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2ccc(OC(F)F)c3cccnc23)[C@H]1c1ccccc1 ZINC000471952302 886759752 /nfs/dbraw/zinc/75/97/52/886759752.db2.gz MRPOJGSDNWBBKE-YLJYHZDGSA-N 0 3 412.440 4.403 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2ccccc2CC(=O)OC(C)(C)C)[C@@H]1c1ccccc1 ZINC000471985108 886812165 /nfs/dbraw/zinc/81/21/65/886812165.db2.gz JSKTVQBDMOLHJM-IRLDBZIGSA-N 0 3 409.530 4.138 20 0 HIADHN CCO[C@H](CCNC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1)C1CCCC1 ZINC000471985525 886813429 /nfs/dbraw/zinc/81/34/29/886813429.db2.gz SGGYJXBLIONLBM-CTWPCTMYSA-N 0 3 419.532 4.076 20 0 HIADHN CCO[C@@H]1C[C@@H](NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)C1(CC)CC ZINC000471989790 886816254 /nfs/dbraw/zinc/81/62/54/886816254.db2.gz BYRPQWNWELFLDH-OPQOLIRYSA-N 0 3 419.532 4.075 20 0 HIADHN Cc1cnc([C@H](NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)C2CC2)s1 ZINC000471995291 886820624 /nfs/dbraw/zinc/82/06/24/886820624.db2.gz KQQXRCOWULXRIF-UYSNPLJNSA-N 0 3 416.513 4.007 20 0 HIADHN C[C@H](CNC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1ccc(F)cc1F ZINC000472004083 886829158 /nfs/dbraw/zinc/82/91/58/886829158.db2.gz XDDRULOKTKGJTG-UWTIGNOOSA-N 0 3 419.438 4.173 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2ccc(OCC3CCOCC3)cc2)[C@@H]1c1ccccc1 ZINC000472017436 886839720 /nfs/dbraw/zinc/83/97/20/886839720.db2.gz PALNNNCUIULFDL-PKTZIBPZSA-N 0 3 409.530 4.059 20 0 HIADHN Cc1ccc([C@H](NC(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)c2ccccn2)cc1 ZINC000472111126 886898050 /nfs/dbraw/zinc/89/80/50/886898050.db2.gz SRFUZVNPEROCCB-SGNDLWITSA-N 0 3 400.526 4.224 20 0 HIADHN C[C@@H](CCN1CCN(C)CC1)NC(=O)c1ccccc1-c1ccc(C(F)(F)F)cc1 ZINC000472120594 886907550 /nfs/dbraw/zinc/90/75/50/886907550.db2.gz RYVYVFBKRBDTLA-KRWDZBQOSA-N 0 3 419.491 4.128 20 0 HIADHN C[C@@H](CCCC(F)(F)F)NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472193953 886994534 /nfs/dbraw/zinc/99/45/34/886994534.db2.gz SZOAIKQGPVULDR-XGNXJENSSA-N 0 3 403.411 4.212 20 0 HIADHN COc1ccc(OC)c([C@@H]2C[C@@H]2C(=O)N(CCN(C)C)Cc2cccc(Cl)c2)c1 ZINC000472217970 887019146 /nfs/dbraw/zinc/01/91/46/887019146.db2.gz ZZYUXIIYPHASPN-FPOVZHCZSA-N 0 3 416.949 4.051 20 0 HIADHN C[C@@H](COc1ccccc1)C(=O)NC1CCN(CCOc2ccc(Cl)cc2)CC1 ZINC000472242261 887050858 /nfs/dbraw/zinc/05/08/58/887050858.db2.gz TXQPLAGLZLYBIR-SFHVURJKSA-N 0 3 416.949 4.015 20 0 HIADHN COCCOc1ccc(C(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)c(Cl)c1 ZINC000472290921 887110511 /nfs/dbraw/zinc/11/05/11/887110511.db2.gz ATXFONCGTWIEGS-GOSISDBHSA-N 0 3 416.949 4.102 20 0 HIADHN CC(C)OCCOCc1cccc(NC(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)c1 ZINC000472303826 887125933 /nfs/dbraw/zinc/12/59/33/887125933.db2.gz FTHJUQJEBCSFAP-PKTZIBPZSA-N 0 3 411.546 4.195 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2ccc3oc(C(F)(F)F)nc3c2)[C@@H]1c1ccccc1 ZINC000472316219 887148156 /nfs/dbraw/zinc/14/81/56/887148156.db2.gz DTXHOALTRUASFF-PBHICJAKSA-N 0 3 404.392 4.414 20 0 HIADHN COc1ccc(NC(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)cc1Br ZINC000472319773 887152265 /nfs/dbraw/zinc/15/22/65/887152265.db2.gz MUPVHRVTRCQSAQ-WMZOPIPTSA-N 0 3 404.308 4.025 20 0 HIADHN Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000472328844 887162802 /nfs/dbraw/zinc/16/28/02/887162802.db2.gz OXDUPPYNDNNDOM-DHIUTWEWSA-N 0 3 420.557 4.234 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2cccc(NC(=O)c3ccoc3)c2)[C@@H]1c1ccccc1 ZINC000472334407 887170792 /nfs/dbraw/zinc/17/07/92/887170792.db2.gz IILLSCOJBBIMCV-SFTDATJTSA-N 0 3 404.470 4.099 20 0 HIADHN C[C@H](Cc1ccc(Cl)cc1Cl)NC(=O)N(CCN(C)C)Cc1ccccn1 ZINC000504269690 913129126 /nfs/dbraw/zinc/12/91/26/913129126.db2.gz BZFPSYARBOKAHL-OAHLLOKOSA-N 0 3 409.361 4.093 20 0 HIADHN CC(C)(NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1cccc(F)c1 ZINC000472442921 887293679 /nfs/dbraw/zinc/29/36/79/887293679.db2.gz FIDWNNKCGKKHQV-UHFFFAOYSA-N 0 3 401.448 4.165 20 0 HIADHN CN(Cc1ccc(Cl)c(F)c1)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472444699 887295861 /nfs/dbraw/zinc/29/58/61/887295861.db2.gz SECFOWPQTCYGAP-UHFFFAOYSA-N 0 3 421.866 4.426 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N1CCC[C@@H]1Cc1ccccc1 ZINC000472449780 887302169 /nfs/dbraw/zinc/30/21/69/887302169.db2.gz GGXNYBODRKHEMZ-IOJLRTSASA-N 0 3 409.496 4.208 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N1CCC[C@H]1c1ccc(F)cc1 ZINC000472449448 887302348 /nfs/dbraw/zinc/30/23/48/887302348.db2.gz QUHUQAAWXVGXPS-ACBHZAAOSA-N 0 3 413.459 4.478 20 0 HIADHN C[C@@H](c1ccc(F)c(F)c1)N(C)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472451039 887303282 /nfs/dbraw/zinc/30/32/82/887303282.db2.gz VJWNGAAKEVOZAW-JQRITLKVSA-N 0 3 419.438 4.473 20 0 HIADHN CCN(Cc1c(F)cccc1F)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472454323 887307056 /nfs/dbraw/zinc/30/70/56/887307056.db2.gz OIHGSBISXRIYNF-UHFFFAOYSA-N 0 3 419.438 4.302 20 0 HIADHN CCOc1ccccc1CN(C)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472455297 887309665 /nfs/dbraw/zinc/30/96/65/887309665.db2.gz SZWAUDFWBBIHSU-UHFFFAOYSA-N 0 3 413.484 4.032 20 0 HIADHN CN(C)Cc1cccc(C(=O)NCc2ccc(C(=O)Nc3ccc(F)cc3)cc2)c1 ZINC000472457954 887312949 /nfs/dbraw/zinc/31/29/49/887312949.db2.gz UFKALGSJWLCZOP-UHFFFAOYSA-N 0 3 405.473 4.070 20 0 HIADHN CCS[C@@H]1CCCCN(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)C1 ZINC000472460233 887318079 /nfs/dbraw/zinc/31/80/79/887318079.db2.gz SPHCUOCHRKCBND-OFLPRAFFSA-N 0 3 407.546 4.109 20 0 HIADHN CN(CC(=O)Nc1ccccc1C(F)(F)F)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000472473006 887333174 /nfs/dbraw/zinc/33/31/74/887333174.db2.gz YDZVEIVKLZDSBU-GOSISDBHSA-N 0 3 405.464 4.240 20 0 HIADHN C[C@H](CO)N(CC(=O)N1N=C(c2cccs2)C[C@H]1c1cccs1)C1CCCC1 ZINC000472639501 887504568 /nfs/dbraw/zinc/50/45/68/887504568.db2.gz UXHHSTMANODNGQ-QAPCUYQASA-N 0 3 417.600 4.113 20 0 HIADHN CN(C(=O)Nc1nnc(-c2ccsc2)s1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000472718448 887565466 /nfs/dbraw/zinc/56/54/66/887565466.db2.gz YQRBSOHRPYQMGB-QGZVFWFLSA-N 0 3 413.572 4.395 20 0 HIADHN CN(C(=O)Nc1ccc(C(=O)N2CCCC2)cc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000472768978 887614879 /nfs/dbraw/zinc/61/48/79/887614879.db2.gz JRROZELFSNSJJV-HSZRJFAPSA-N 0 3 420.557 4.051 20 0 HIADHN CN(C(=O)Nc1cccc(C(=O)N2CCCC2)c1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000472791519 887637632 /nfs/dbraw/zinc/63/76/32/887637632.db2.gz OORBYRBUKUMFLZ-QHCPKHFHSA-N 0 3 420.557 4.051 20 0 HIADHN C[C@@H](CNC(=O)Nc1ccc(OCc2ccccn2)c(F)c1)N(C)Cc1ccccc1 ZINC000472896425 887744594 /nfs/dbraw/zinc/74/45/94/887744594.db2.gz JULJNINXTDGXNB-SFHVURJKSA-N 0 3 422.504 4.442 20 0 HIADHN CN(CCNC(=O)Nc1ccc(F)cc1-c1nc(C2CC2)no1)Cc1ccccc1 ZINC000472919770 887765774 /nfs/dbraw/zinc/76/57/74/887765774.db2.gz ICJZTMKKYFQQEM-UHFFFAOYSA-N 0 3 409.465 4.007 20 0 HIADHN O=C(Nc1ccc(F)cc1-c1nc(C2CC2)no1)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000472922288 887768478 /nfs/dbraw/zinc/76/84/78/887768478.db2.gz HFPZEPJKBFIFIT-SFHVURJKSA-N 0 3 421.476 4.149 20 0 HIADHN COc1cccc(C=C2CCN(C[C@H](O)Cn3cnc4cc(C)c(C)cc43)CC2)c1 ZINC000472940490 887789288 /nfs/dbraw/zinc/78/92/88/887789288.db2.gz NBFINXQXBRYQME-QFIPXVFZSA-N 0 3 405.542 4.202 20 0 HIADHN CC(=O)CC(C)(C)CC(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1 ZINC000473023715 887848308 /nfs/dbraw/zinc/84/83/08/887848308.db2.gz NXRGGFJOSUQQER-UHFFFAOYSA-N 0 3 421.585 4.385 20 0 HIADHN CCC(CC)(C(=O)OC)c1csc(NC2CCN(Cc3ccccc3)CC2)n1 ZINC000504396160 913216867 /nfs/dbraw/zinc/21/68/67/913216867.db2.gz XZHZDLCDSGWJSY-UHFFFAOYSA-N 0 3 401.576 4.450 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCc1oc2ccccc2c1OC)c1ccsc1 ZINC000473463399 888186476 /nfs/dbraw/zinc/18/64/76/888186476.db2.gz SFYVXTVHMXXYFH-QGZVFWFLSA-N 0 3 401.532 4.385 20 0 HIADHN COc1ccc(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)c(OC(C)C)c1 ZINC000473517810 888249670 /nfs/dbraw/zinc/24/96/70/888249670.db2.gz BJJVPXRKFFBVNA-UHFFFAOYSA-N 0 3 414.468 4.018 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)[C@H]1CCC[C@H](C(F)(F)F)C1 ZINC000473517999 888249929 /nfs/dbraw/zinc/24/99/29/888249929.db2.gz KIXSMRBFQZJABA-UJHNXHIOSA-N 0 3 400.407 4.277 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)[C@@H]1C[C@@H]1c1ccccc1Cl ZINC000473519184 888251731 /nfs/dbraw/zinc/25/17/31/888251731.db2.gz BCSYOGHHEKLVNN-GMGZGELVSA-N 0 3 400.872 4.365 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1ccc([C@H]2CCCOC2)cc1 ZINC000473519798 888253188 /nfs/dbraw/zinc/25/31/88/888253188.db2.gz OHWUVDWFCBSLJY-KKXNLOMOSA-N 0 3 410.480 4.116 20 0 HIADHN C[C@H](C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1cn(C)c2ccccc12 ZINC000473520831 888254825 /nfs/dbraw/zinc/25/48/25/888254825.db2.gz POHIVZNSZWPFIE-OOHWJJMZSA-N 0 3 407.480 4.203 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1ccn(Cc2ccccc2)c1 ZINC000473520702 888255032 /nfs/dbraw/zinc/25/50/32/888255032.db2.gz CKRMRSXHAYKNDV-UHFFFAOYSA-N 0 3 405.464 4.072 20 0 HIADHN Cc1cc(Br)cc(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)c1 ZINC000473520680 888255271 /nfs/dbraw/zinc/25/52/71/888255271.db2.gz NUWCGWNPTULKIF-UHFFFAOYSA-N 0 3 419.285 4.293 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000473522195 888257173 /nfs/dbraw/zinc/25/71/73/888257173.db2.gz PWDBYMHEXXFWIF-NWINJMCUSA-N 0 3 406.901 4.427 20 0 HIADHN O=C(Cc1cccc(Cl)c1Cl)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473522365 888257590 /nfs/dbraw/zinc/25/75/90/888257590.db2.gz FTHUGRRGNFRPER-UHFFFAOYSA-N 0 3 409.279 4.457 20 0 HIADHN CC(C)Cn1ncc(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)c1C(F)F ZINC000473522838 888258544 /nfs/dbraw/zinc/25/85/44/888258544.db2.gz VABQPAWPMBMUNW-UHFFFAOYSA-N 0 3 422.442 4.012 20 0 HIADHN CCc1c(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cnn1C1CCCC1 ZINC000473526145 888263782 /nfs/dbraw/zinc/26/37/82/888263782.db2.gz XQSGCLKCGWMVPZ-UHFFFAOYSA-N 0 3 412.500 4.096 20 0 HIADHN CCN1CCN(CCC(=O)N2CCCCC[C@H]2c2ccc(C(F)(F)F)cc2)CC1 ZINC000473526877 888264070 /nfs/dbraw/zinc/26/40/70/888264070.db2.gz SJSLLHIRRUPSDG-FQEVSTJZSA-N 0 3 411.512 4.177 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1cc(Br)cs1 ZINC000473526332 888264260 /nfs/dbraw/zinc/26/42/60/888264260.db2.gz QIXGPLMNRDJHTN-UHFFFAOYSA-N 0 3 411.287 4.046 20 0 HIADHN COc1ccccc1C[C@H](C)CC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473527770 888265457 /nfs/dbraw/zinc/26/54/57/888265457.db2.gz SAGLOKOBJDYKRA-MNNVXMFVSA-N 0 3 412.496 4.185 20 0 HIADHN O=C(COc1ccc2ccccc2c1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473532150 888270279 /nfs/dbraw/zinc/27/02/79/888270279.db2.gz QPEWDVWDNIKDQV-UHFFFAOYSA-N 0 3 406.448 4.140 20 0 HIADHN CC[C@H](O[C@@H]1CCC[C@@H](C)C1)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473534071 888271804 /nfs/dbraw/zinc/27/18/04/888271804.db2.gz UMBKGSAOFSPFGP-WHIREDKFSA-N 0 3 404.517 4.282 20 0 HIADHN C[C@@H]1CCc2ccccc2N1CCC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473535349 888272664 /nfs/dbraw/zinc/27/26/64/888272664.db2.gz XQBLBZWDYYNUSO-PBPGXSGUSA-N 0 3 423.523 4.139 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1cccn1Cc1cccs1 ZINC000473535978 888273134 /nfs/dbraw/zinc/27/31/34/888273134.db2.gz UJSJYMVATUKCLB-UHFFFAOYSA-N 0 3 411.493 4.133 20 0 HIADHN C[C@H](CCN1CCN(C)CC1)NC(=O)Nc1ccccc1Oc1ccc(Cl)cc1 ZINC000473664742 888419250 /nfs/dbraw/zinc/41/92/50/888419250.db2.gz UTKBJACBIRAFKO-QGZVFWFLSA-N 0 3 416.953 4.280 20 0 HIADHN Cc1c(COc2ccccc2)cccc1NC(=O)NC(C)(C)CCN1CCN(C)CC1 ZINC000473707146 888483793 /nfs/dbraw/zinc/48/37/93/888483793.db2.gz SZIOFHKDVBLHHD-UHFFFAOYSA-N 0 3 424.589 4.112 20 0 HIADHN O=C(N[C@@H](c1ccccc1)c1ccc2c(c1)CCCO2)N1CCN(C2CCCC2)CC1 ZINC000504449214 913258426 /nfs/dbraw/zinc/25/84/26/913258426.db2.gz QHFSHYWVZQZWKL-VWLOTQADSA-N 0 3 419.569 4.371 20 0 HIADHN Cc1cc(Cl)c2ccccc2c1NC(=O)NC(C)(C)CCN1CCN(C)CC1 ZINC000473781106 888586038 /nfs/dbraw/zinc/58/60/38/888586038.db2.gz XNDZSABPJUEXCO-UHFFFAOYSA-N 0 3 402.970 4.339 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CCCCC[C@H]3c3c(C)n[nH]c3C)c2)CC1 ZINC000473812402 888638416 /nfs/dbraw/zinc/63/84/16/888638416.db2.gz XXKJAEQFTCNAEL-QFIPXVFZSA-N 0 3 424.593 4.318 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)NCc1ccsc1Br)c1ccco1 ZINC000504459549 913264734 /nfs/dbraw/zinc/26/47/34/913264734.db2.gz ZZRRFPJYRZAVLP-YPMHNXCESA-N 0 3 400.342 4.032 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@@H](C[C@@H]3CCOC3)c3ccccc3)c2)CC1 ZINC000473819972 888650681 /nfs/dbraw/zinc/65/06/81/888650681.db2.gz PBCBRJOUNFPVQJ-RDPSFJRHSA-N 0 3 422.573 4.118 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@H]3CCC[C@H]3OCc3ccccc3)c2)CC1 ZINC000473830273 888663555 /nfs/dbraw/zinc/66/35/55/888663555.db2.gz PCPBGTUODIASST-BJKOFHAPSA-N 0 3 422.573 4.088 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)NCc3ccc(-c4ccncc4)cc3)c2)CC1 ZINC000473834437 888670183 /nfs/dbraw/zinc/67/01/83/888670183.db2.gz FYTUFRVJQLVJHC-UHFFFAOYSA-N 0 3 415.541 4.212 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N(CCc3cccc(F)c3)C3CC3)c2)CC1 ZINC000473835739 888672378 /nfs/dbraw/zinc/67/23/78/888672378.db2.gz LMCXMLOIQSFGGA-UHFFFAOYSA-N 0 3 410.537 4.207 20 0 HIADHN C[C@@H](NC(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1)c1cc2cccc(F)c2o1 ZINC000473863296 888718209 /nfs/dbraw/zinc/71/82/09/888718209.db2.gz ISOVHLLZKTZLLU-IXDOHACOSA-N 0 3 417.525 4.164 20 0 HIADHN C[C@H](NC(=O)N1CC[C@@H](CN(C)Cc2cccnc2)C1)c1cc2cccc(F)c2o1 ZINC000473873910 888736935 /nfs/dbraw/zinc/73/69/35/888736935.db2.gz HTJOWDMTVLGVLQ-WMZOPIPTSA-N 0 3 410.493 4.191 20 0 HIADHN C[C@@H](NC(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1)c1cc2ccccc2s1 ZINC000504480541 913274589 /nfs/dbraw/zinc/27/45/89/913274589.db2.gz OVYZLSMXIQZDBR-FGTMMUONSA-N 0 3 415.603 4.493 20 0 HIADHN CN(C)[C@@H](CNC(=O)N[C@@H](c1cccc(Cl)c1)c1ccccn1)Cc1ccccc1 ZINC000473885959 888753647 /nfs/dbraw/zinc/75/36/47/888753647.db2.gz MQNMHURBGVIORY-GGAORHGYSA-N 0 3 422.960 4.297 20 0 HIADHN C[C@@H](NC(=O)N[C@H](CN1CCCC1)c1ccccc1)c1ccc(Br)cn1 ZINC000474034484 888880822 /nfs/dbraw/zinc/88/08/22/888880822.db2.gz PPKSSNWMRHXPHB-DNVCBOLYSA-N 0 3 417.351 4.041 20 0 HIADHN COc1ccc2c(c1)C(C)(C)C[C@@H]2NCc1cccc(C(=O)NC[C@@H]2CCCO2)c1 ZINC000474054882 888893356 /nfs/dbraw/zinc/89/33/56/888893356.db2.gz IQSFRBQORFCSFB-REWPJTCUSA-N 0 3 408.542 4.116 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)[C@@H]3CCN(c4ccccc4)[C@H]3C)c2)CC1 ZINC000474151533 888980975 /nfs/dbraw/zinc/98/09/75/888980975.db2.gz NVZIWIBMPMZHLA-GBXCKJPGSA-N 0 3 406.574 4.071 20 0 HIADHN CCc1cccc2c(C3CCN(Cc4cnc(-c5cnn(C)c5)nc4)CC3)c[nH]c21 ZINC000474153334 888986056 /nfs/dbraw/zinc/98/60/56/888986056.db2.gz MWQCQZNZBRIOGD-UHFFFAOYSA-N 0 3 400.530 4.300 20 0 HIADHN CC(C)c1nc2c([nH]1)C[C@@H](C(=O)NC[C@H](c1cccs1)N1CCC(C)CC1)CC2 ZINC000474203504 889041059 /nfs/dbraw/zinc/04/10/59/889041059.db2.gz IOWGQRFHDWNZFQ-FXAWDEMLSA-N 0 3 414.619 4.289 20 0 HIADHN CC(C)c1nc2c([nH]1)CC[C@H](C(=O)NC[C@H](c1cccs1)N1CCC(C)CC1)C2 ZINC000474203504 889041067 /nfs/dbraw/zinc/04/10/67/889041067.db2.gz IOWGQRFHDWNZFQ-FXAWDEMLSA-N 0 3 414.619 4.289 20 0 HIADHN COc1cccc(Cl)c1-c1noc(C)c1C(=O)NC[C@@H](c1ccccc1)N(C)C ZINC000474208698 889046701 /nfs/dbraw/zinc/04/67/01/889046701.db2.gz DYSWRLFMUAHVBZ-KRWDZBQOSA-N 0 3 413.905 4.345 20 0 HIADHN Cc1ccc(C)c([C@@H]2CCCN2CC(=O)N2CCC(C(=O)Nc3ccccc3)CC2)c1 ZINC000474208157 889047094 /nfs/dbraw/zinc/04/70/94/889047094.db2.gz BTRUYZNJMAQLEC-DEOSSOPVSA-N 0 3 419.569 4.318 20 0 HIADHN CC(C)n1c2ccccc2nc1[C@H]1CCCN(Cc2cnc(-c3cnn(C)c3)nc2)C1 ZINC000474266779 889127897 /nfs/dbraw/zinc/12/78/97/889127897.db2.gz LKLLLZFYVRAXJK-IBGZPJMESA-N 0 3 415.545 4.187 20 0 HIADHN C[C@H]1CCN(Cc2cnc(-c3cnn(C)c3)nc2)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000474270925 889132653 /nfs/dbraw/zinc/13/26/53/889132653.db2.gz PSMGDYZFNXNARM-IFXJQAMLSA-N 0 3 401.436 4.479 20 0 HIADHN COc1ccc2nc(CNC3CCN(Cc4ccc(F)c(F)c4)CC3)sc2c1 ZINC000474378155 889254905 /nfs/dbraw/zinc/25/49/05/889254905.db2.gz YMTDZWLFDSGRAQ-UHFFFAOYSA-N 0 3 403.498 4.337 20 0 HIADHN C[C@H](NC(=O)Nc1cccc(CN2CCCCC2=O)c1)[C@H](c1ccccc1)N(C)C ZINC000474425964 889291225 /nfs/dbraw/zinc/29/12/25/889291225.db2.gz IRDOAECXHSUPOS-FDDCHVKYSA-N 0 3 408.546 4.012 20 0 HIADHN CN(CCN(Cc1ccccc1)C(=O)c1cc(=O)[nH]c(C2CC2)c1)Cc1ccccc1 ZINC000474477471 889339162 /nfs/dbraw/zinc/33/91/62/889339162.db2.gz MPCUGTHGNLPPDM-UHFFFAOYSA-N 0 3 415.537 4.439 20 0 HIADHN CN1CCN(CCCNC(=O)c2c(Cl)cccc2Cl)[C@@H](c2ccccc2)C1 ZINC000474510131 889374772 /nfs/dbraw/zinc/37/47/72/889374772.db2.gz JOCODISXGRKCFK-LJQANCHMSA-N 0 3 406.357 4.102 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N2CCC(C)(c3cccc(Cl)c3)CC2)CC1 ZINC000474515654 889382543 /nfs/dbraw/zinc/38/25/43/889382543.db2.gz PCRWGZAZZNTBJH-UHFFFAOYSA-N 0 3 422.013 4.293 20 0 HIADHN C[C@H](NC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1)c1noc(-c2ccccc2)n1 ZINC000474527162 889398480 /nfs/dbraw/zinc/39/84/80/889398480.db2.gz VBAHHWUFXVZJIH-RXVVDRJESA-N 0 3 419.529 4.104 20 0 HIADHN C[C@H](NC(=O)N(Cc1ccccc1)C1CCN(C)CC1)c1noc(-c2ccccc2)n1 ZINC000474528708 889400417 /nfs/dbraw/zinc/40/04/17/889400417.db2.gz RMOJTLMFUKWUTN-SFHVURJKSA-N 0 3 419.529 4.104 20 0 HIADHN CN1CC[C@H](NC(=O)N[C@@H]2C[C@H]2c2ccc(Br)s2)[C@H]1c1ccccc1 ZINC000474540412 889416261 /nfs/dbraw/zinc/41/62/61/889416261.db2.gz NVXGZMCHOVJYIZ-BASYENTBSA-N 0 3 420.376 4.111 20 0 HIADHN COCCOc1ccc(C(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)c(Cl)c1 ZINC000474549361 889426409 /nfs/dbraw/zinc/42/64/09/889426409.db2.gz BRSWGFGINPGWJZ-GOSISDBHSA-N 0 3 416.949 4.102 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)CCCc2cccc(C(F)(F)F)c2)CC1 ZINC000474552287 889429515 /nfs/dbraw/zinc/42/95/15/889429515.db2.gz AWZOGHIXOMZSAW-UHFFFAOYSA-N 0 3 400.485 4.034 20 0 HIADHN CN(C(=O)Nc1ccc(Br)cc1F)[C@H]1CCN(Cc2ccccc2)C1 ZINC000474567746 889443962 /nfs/dbraw/zinc/44/39/62/889443962.db2.gz ZVMRPUUTJKMQLZ-INIZCTEOSA-N 0 3 406.299 4.326 20 0 HIADHN CN(C(=O)Nc1ccc(Br)cc1F)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000474567747 889444225 /nfs/dbraw/zinc/44/42/25/889444225.db2.gz ZVMRPUUTJKMQLZ-MRXNPFEDSA-N 0 3 406.299 4.326 20 0 HIADHN Cc1ccnc(Oc2ccc(NC(=O)N(C)[C@H]3CCN(Cc4ccccc4)C3)cc2)n1 ZINC000474595112 889463488 /nfs/dbraw/zinc/46/34/88/889463488.db2.gz XVMLLSZLEIUASV-NRFANRHFSA-N 0 3 417.513 4.316 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)c(Cl)c1 ZINC000474624647 889487494 /nfs/dbraw/zinc/48/74/94/889487494.db2.gz UCOUWPBOHZGHFF-GOSISDBHSA-N 0 3 400.910 4.037 20 0 HIADHN Cc1ccccc1-n1nccc1CNC[C@@H](O)COc1cccc(Cl)c1Cl ZINC000474631140 889493211 /nfs/dbraw/zinc/49/32/11/889493211.db2.gz MOCUVHZOVFYRCI-MRXNPFEDSA-N 0 3 406.313 4.017 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)c1cc(-c2ccc(F)cc2)on1 ZINC000474717604 889575597 /nfs/dbraw/zinc/57/55/97/889575597.db2.gz YLPKFLDQOHHGCL-HXUWFJFHSA-N 0 3 408.477 4.002 20 0 HIADHN Cc1cc(C)n(-c2cccc(NC(=O)N(C)[C@H]3CCN(Cc4ccccc4)C3)c2)n1 ZINC000474737756 889592977 /nfs/dbraw/zinc/59/29/77/889592977.db2.gz FEXCDDUIMQBJDH-QHCPKHFHSA-N 0 3 403.530 4.227 20 0 HIADHN CCC(=O)Nc1ccc(Cl)c(NC(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000474745198 889600704 /nfs/dbraw/zinc/60/07/04/889600704.db2.gz MQWWBBQKBJQLDI-SFHVURJKSA-N 0 3 414.937 4.427 20 0 HIADHN COCCOc1ccc(NC(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)cc1Cl ZINC000474748673 889605041 /nfs/dbraw/zinc/60/50/41/889605041.db2.gz KCDLRURQKHTSNG-IBGZPJMESA-N 0 3 417.937 4.103 20 0 HIADHN Cc1ccc(Br)cc1NC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000474749118 889607242 /nfs/dbraw/zinc/60/72/42/889607242.db2.gz KOUQRVLLAIVCPI-GOSISDBHSA-N 0 3 402.336 4.496 20 0 HIADHN CN1CCN(CCC(C)(C)NC(=O)CC(Cc2ccccc2)Cc2ccccc2)CC1 ZINC000474801996 889653530 /nfs/dbraw/zinc/65/35/30/889653530.db2.gz OCAPFTRNLBTCAH-UHFFFAOYSA-N 0 3 421.629 4.010 20 0 HIADHN C[C@H](CN1CCC[C@H](C)C1)NC(=O)c1ccc(NC(=O)Nc2ccccc2)s1 ZINC000474826931 889682533 /nfs/dbraw/zinc/68/25/33/889682533.db2.gz YPTBEZNGMALWDB-JKSUJKDBSA-N 0 3 400.548 4.242 20 0 HIADHN CC(C)C[C@@H]([NH2+][C@H](C)C1CCC(C(F)(F)F)CC1)c1nc(-c2nc[n-]n2)no1 ZINC000474884505 889740145 /nfs/dbraw/zinc/74/01/45/889740145.db2.gz AEDAXWPIQHFZPT-BLYZHGLHSA-N 0 3 400.449 4.289 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)CCc2ccc(-c3ccccc3F)o2)CC1 ZINC000474890177 889747461 /nfs/dbraw/zinc/74/74/61/889747461.db2.gz JQQMCQOBEKQDEL-UHFFFAOYSA-N 0 3 402.510 4.024 20 0 HIADHN COc1cccc(Nc2ccccc2C(=O)NC2CCN(CCOC(C)C)CC2)c1 ZINC000474892844 889750707 /nfs/dbraw/zinc/75/07/07/889750707.db2.gz LIXGDJRFXCPJDE-UHFFFAOYSA-N 0 3 411.546 4.058 20 0 HIADHN CC(C)(C)[C@H]1C[C@H](NCc2c(F)ccc(I)c2F)CCO1 ZINC000474894836 889753053 /nfs/dbraw/zinc/75/30/53/889753053.db2.gz UAUUHZFFULLAID-QMTHXVAHSA-N 0 3 409.258 4.253 20 0 HIADHN C[C@@H](O)CCCN(Cc1ccco1)C[C@@H](O)Cn1c2ccccc2c2ccccc21 ZINC000474954171 889809402 /nfs/dbraw/zinc/80/94/02/889809402.db2.gz JOZMRQYQUQXQSW-WOJBJXKFSA-N 0 3 406.526 4.412 20 0 HIADHN CCN(C(=O)Nc1cc(F)ccc1-n1cccn1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475001846 889853283 /nfs/dbraw/zinc/85/32/83/889853283.db2.gz LNCUIEXHQOTGSA-HXUWFJFHSA-N 0 3 407.493 4.140 20 0 HIADHN CCN(C(=O)Nc1nnc(/C=C/c2ccco2)s1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475006929 889859398 /nfs/dbraw/zinc/85/93/98/889859398.db2.gz BKACMQYPDLNPSI-ZGKFYVQTSA-N 0 3 423.542 4.430 20 0 HIADHN CC(C)[C@@H](NC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1)c1ccc2c(c1)OCCO2 ZINC000475007959 889860271 /nfs/dbraw/zinc/86/02/71/889860271.db2.gz JZWJFYDZAPYXOT-ZJSXRUAMSA-N 0 3 423.557 4.071 20 0 HIADHN CCN1CCN(c2cccc(NCc3cccc(Br)c3OC)c2)CC1 ZINC000475091774 889939533 /nfs/dbraw/zinc/93/95/33/889939533.db2.gz SSTWYXHLKYCQPF-UHFFFAOYSA-N 0 3 404.352 4.212 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N[C@H](C)C1CCOCC1)c1ccc(C(F)(F)F)cc1 ZINC000475133793 889998665 /nfs/dbraw/zinc/99/86/65/889998665.db2.gz BELAKRRLIQFSKS-BEFAXECRSA-N 0 3 415.500 4.203 20 0 HIADHN CCN(C(=O)N[C@H](c1ccccc1)[C@H]1CCOC1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475172771 890040290 /nfs/dbraw/zinc/04/02/90/890040290.db2.gz GFCADHZGTVAJJI-KMDXXIMOSA-N 0 3 407.558 4.070 20 0 HIADHN CN(C(=O)NCCc1csc(-c2ccccc2)n1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475264370 890159528 /nfs/dbraw/zinc/15/95/28/890159528.db2.gz DZTZIHWUCTXZOE-QFIPXVFZSA-N 0 3 420.582 4.269 20 0 HIADHN C[C@H](NC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1)c1cccc(N2CCCC2)c1 ZINC000475289866 890191506 /nfs/dbraw/zinc/19/15/06/890191506.db2.gz CXLXGZGGNKMBLR-RDPSFJRHSA-N 0 3 406.574 4.264 20 0 HIADHN COc1ccc(-c2cncc(C(=O)N(C)[C@H]3CCN(Cc4ccccc4)C3)c2)cc1 ZINC000475300799 890207664 /nfs/dbraw/zinc/20/76/64/890207664.db2.gz VJQLQQDQSFPCOY-QHCPKHFHSA-N 0 3 401.510 4.104 20 0 HIADHN Cc1ccc(OCc2cccc(C(=O)N(C)[C@@H]3CCN(Cc4ccccc4)C3)c2)cn1 ZINC000475302539 890209938 /nfs/dbraw/zinc/20/99/38/890209938.db2.gz MSZMGYOSIBHRBI-XMMPIXPASA-N 0 3 415.537 4.316 20 0 HIADHN CN(C(=O)Cc1csc(-c2cccc(F)c2)n1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475320920 890240575 /nfs/dbraw/zinc/24/05/75/890240575.db2.gz XGUYGTPMURLNDE-OAQYLSRUSA-N 0 3 409.530 4.225 20 0 HIADHN CCN(C(=O)c1ccn(Cc2ccccc2)n1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000475325690 890245807 /nfs/dbraw/zinc/24/58/07/890245807.db2.gz WWWKLBFLCYACJF-OFNKIYASSA-N 0 3 402.542 4.229 20 0 HIADHN Cn1cc(CNCc2ccc3ncccc3c2)c(-c2ccc3c(c2)OCCCO3)n1 ZINC000475347422 890269448 /nfs/dbraw/zinc/26/94/48/890269448.db2.gz RLSUHFPZIGRSNN-UHFFFAOYSA-N 0 3 400.482 4.086 20 0 HIADHN Cc1ccc(CCC(=O)N(Cc2ccco2)C2CCN(C)CC2)c(Br)c1 ZINC000475391935 890319177 /nfs/dbraw/zinc/31/91/77/890319177.db2.gz UEXBJYREKYTOKP-UHFFFAOYSA-N 0 3 419.363 4.406 20 0 HIADHN COc1ccc([C@@H](CNC(=O)N[C@@H](C)c2cc(F)ccc2OC)N2CCCC2)cc1 ZINC000504708415 913441334 /nfs/dbraw/zinc/44/13/34/913441334.db2.gz QUBQWPQCCAMXAD-HRAATJIYSA-N 0 3 415.509 4.040 20 0 HIADHN CN(C(=O)[C@@H]1C[C@H]1c1ccccc1OC(F)F)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475423560 890345152 /nfs/dbraw/zinc/34/51/52/890345152.db2.gz QWOLOPVQZZXSRZ-YZGWKJHDSA-N 0 3 400.469 4.124 20 0 HIADHN C[C@H](N[C@H](C(N)=O)c1cccc(Br)c1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000475427720 890347863 /nfs/dbraw/zinc/34/78/63/890347863.db2.gz HWBFEVCTZPWXIX-UYAPLQMOSA-N 0 3 413.768 4.472 20 0 HIADHN C[C@@H](CCc1ccc(Cl)s1)N[C@H](C(N)=O)c1cccc(Br)c1 ZINC000475438670 890357228 /nfs/dbraw/zinc/35/72/28/890357228.db2.gz HZGXCKFXQCLJLK-BONVTDFDSA-N 0 3 401.757 4.301 20 0 HIADHN C[C@H](N[C@H](C(N)=O)c1cccc(Br)c1)C1CCC(C(F)(F)F)CC1 ZINC000475442478 890360256 /nfs/dbraw/zinc/36/02/56/890360256.db2.gz QQFUQROAAIBOJR-LFBRFLDLSA-N 0 3 407.274 4.322 20 0 HIADHN CN(C(=O)N[C@@H]1C[C@H]1c1ccc(OC(F)F)cc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475485587 890392008 /nfs/dbraw/zinc/39/20/08/890392008.db2.gz GYFKITWPFCSTRG-SESVDKBCSA-N 0 3 415.484 4.060 20 0 HIADHN CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)N[C@@H]1CC[C@@H](c2cccc(F)c2)C1 ZINC000475517743 890435806 /nfs/dbraw/zinc/43/58/06/890435806.db2.gz KBNFPPSUIVFCPV-IYSOMAHNSA-N 0 3 410.537 4.191 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)N[C@@H]1C[C@H]1c1ccc(OC(F)F)cc1 ZINC000475519025 890437556 /nfs/dbraw/zinc/43/75/56/890437556.db2.gz NGRADIRYGSZXOY-VQTJNVASSA-N 0 3 421.463 4.056 20 0 HIADHN Cc1ccc(C(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)cc1NC(=O)NC(C)(C)C ZINC000475553455 890478818 /nfs/dbraw/zinc/47/88/18/890478818.db2.gz KDSWSUNTGPIQLQ-NRFANRHFSA-N 0 3 422.573 4.262 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)Nc2cccc(N3CCCCCC3)c2)CC1 ZINC000475598792 890524361 /nfs/dbraw/zinc/52/43/61/890524361.db2.gz BTGMEFAZWVHWBW-UHFFFAOYSA-N 0 3 402.583 4.078 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)Nc2ccc3c(c2)OC2(CCCCC2)O3)CC1 ZINC000475649131 890592700 /nfs/dbraw/zinc/59/27/00/890592700.db2.gz JBDFLPJYPUXGRF-UHFFFAOYSA-N 0 3 417.550 4.129 20 0 HIADHN CCN(C(=O)c1ccc(OCCCOC)cc1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000475656979 890602885 /nfs/dbraw/zinc/60/28/85/890602885.db2.gz RRKXBGPWUOOPOF-REWPJTCUSA-N 0 3 410.558 4.400 20 0 HIADHN CCc1nnc(-c2ccc(NC(=O)NC[C@@H](c3ccc(CC)cc3)N(C)C)cc2)o1 ZINC000475695631 890635298 /nfs/dbraw/zinc/63/52/98/890635298.db2.gz KIJGWXWDQRDIOS-FQEVSTJZSA-N 0 3 407.518 4.286 20 0 HIADHN COc1ccc2cc(CN(C)C(=O)[C@H](C)N3CCC[C@@]4(CCCOC4)C3)ccc2c1 ZINC000475739905 890682454 /nfs/dbraw/zinc/68/24/54/890682454.db2.gz YFSUYCHYYFUYSL-UQBPGWFLSA-N 0 3 410.558 4.088 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N[C@H](c2ccc(F)cc2)C2CCCC2)CC1 ZINC000475906519 890835975 /nfs/dbraw/zinc/83/59/75/890835975.db2.gz CFLJPRDTLOXEJI-QFIPXVFZSA-N 0 3 405.558 4.246 20 0 HIADHN C[C@H](c1ccc([S@@](C)=O)cc1)N(C)C(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000475956680 890877872 /nfs/dbraw/zinc/87/78/72/890877872.db2.gz KOQNRAZVWFQTBG-HNDADQJNSA-N 0 3 419.616 4.025 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)NCCCc2ccc(Cl)cc2Cl)CC1 ZINC000476036818 890968504 /nfs/dbraw/zinc/96/85/04/890968504.db2.gz VMIPXNRUIUAPBB-UHFFFAOYSA-N 0 3 416.393 4.115 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N[C@@H](C)C(c2ccccc2)c2ccccc2)CC1 ZINC000476051772 890982219 /nfs/dbraw/zinc/98/22/19/890982219.db2.gz RWMXUXWGJIGQRG-NRFANRHFSA-N 0 3 423.601 4.396 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)[C@H](C)c3cn(C)c4ccccc34)c2)CC1 ZINC000476246126 891169997 /nfs/dbraw/zinc/16/99/97/891169997.db2.gz AOFBHZFATHONQY-LJQANCHMSA-N 0 3 404.558 4.451 20 0 HIADHN CC(C)(C(=O)Nc1cccc(CN2CCC(O)CC2)c1)c1ccc(Cl)cc1F ZINC000476261268 891184771 /nfs/dbraw/zinc/18/47/71/891184771.db2.gz SZLILHDAYCXGHV-UHFFFAOYSA-N 0 3 404.913 4.352 20 0 HIADHN CCc1onc(-c2ccc(Br)cc2)c1C(=O)N[C@@H]1C[C@@H](C)N(C2CC2)C1 ZINC000476297294 891210946 /nfs/dbraw/zinc/21/09/46/891210946.db2.gz DGBAFUDDMNTCHR-IUODEOHRSA-N 0 3 418.335 4.022 20 0 HIADHN CCOc1ccc([C@@H](NC(=O)N(C)[C@H]2CCN(C3CC3)C2)C(C)C)cc1OCC ZINC000476372710 891285081 /nfs/dbraw/zinc/28/50/81/891285081.db2.gz BGJCYZLYEZKGRB-UGKGYDQZSA-N 0 3 403.567 4.059 20 0 HIADHN CO[C@@H]1CCC[C@@H](CC(=O)Nc2c(C)cnn2[C@@H]2CCN(Cc3ccccc3)C2)C1 ZINC000476414463 891327138 /nfs/dbraw/zinc/32/71/38/891327138.db2.gz WWYOLEHNSZUCHA-YPAWHYETSA-N 0 3 410.562 4.172 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N(C)[C@H](C)[C@@H](C)c2ccc(Cl)cc2)CC1 ZINC000476437676 891349567 /nfs/dbraw/zinc/34/95/67/891349567.db2.gz RVMBKBSHVYHCEV-QZTJIDSGSA-N 0 3 410.002 4.363 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N(Cc2ccccc2)Cc2ccccc2)CC1 ZINC000476451999 891364010 /nfs/dbraw/zinc/36/40/10/891364010.db2.gz KZLBAOQZFKIULN-UHFFFAOYSA-N 0 3 409.574 4.288 20 0 HIADHN Cc1onc(-c2ccccc2C)c1C(=O)Nc1cccc2c1CCN(CC(C)(C)O)C2 ZINC000476648711 891588948 /nfs/dbraw/zinc/58/89/48/891588948.db2.gz ZJDWWDJFKLYQFD-UHFFFAOYSA-N 0 3 419.525 4.340 20 0 HIADHN CC1CCN([C@H](CNC(=O)c2cncnc2-c2ccccc2)c2cccs2)CC1 ZINC000476652549 891595388 /nfs/dbraw/zinc/59/53/88/891595388.db2.gz KTRNRXHMUKXDTR-HXUWFJFHSA-N 0 3 406.555 4.408 20 0 HIADHN C[C@@H]1CO[C@H](c2ccccc2Cl)CN1C(=O)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000476657573 891604944 /nfs/dbraw/zinc/60/49/44/891604944.db2.gz PTQSBRQVKUMXSS-LZNRXBQRSA-N 0 3 413.949 4.086 20 0 HIADHN Cc1nc(C(=O)Nc2cccc(CN(C)C)c2)nn1-c1c(Cl)cccc1Cl ZINC000476739590 891707585 /nfs/dbraw/zinc/70/75/85/891707585.db2.gz OGNMRAOLYBOVND-UHFFFAOYSA-N 0 3 404.301 4.196 20 0 HIADHN C[C@@H](CNC(=O)c1cn(C2CC2)c2cc(Cl)c(F)cc2c1=O)N1CCCC[C@H]1C ZINC000476763679 891735639 /nfs/dbraw/zinc/73/56/39/891735639.db2.gz NKAYUAMFNCUIPE-KGLIPLIRSA-N 0 3 419.928 4.122 20 0 HIADHN COc1cc(N[C@@H]2CCCN(C(=O)c3cccc(CN4CCCC4)c3)C2)cc(OC)c1 ZINC000476779810 891759170 /nfs/dbraw/zinc/75/91/70/891759170.db2.gz OJMDTUWGOJZTBP-OAQYLSRUSA-N 0 3 423.557 4.016 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)N(CCCO)[C@@H]1CCCc2ccccc21 ZINC000476833872 891814409 /nfs/dbraw/zinc/81/44/09/891814409.db2.gz WKHNZXMIFFOUHX-JWQCQUIFSA-N 0 3 421.585 4.295 20 0 HIADHN CC(C)[C@H](CNC(=O)Nc1cccc(NC(=O)C2CC2)c1)N1CCc2ccccc2C1 ZINC000504871426 913599014 /nfs/dbraw/zinc/59/90/14/913599014.db2.gz YBGMAXWKDSNXDK-QHCPKHFHSA-N 0 3 420.557 4.240 20 0 HIADHN O=C(Nc1ccc(OC[C@H]2CCCO2)cc1)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000504877515 913605887 /nfs/dbraw/zinc/60/58/87/913605887.db2.gz UVSRVHPLTCHFSZ-JTHBVZDNSA-N 0 3 409.530 4.031 20 0 HIADHN COc1ccc([C@@H](C)NC(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)cc1F ZINC000476905745 891859530 /nfs/dbraw/zinc/85/95/30/891859530.db2.gz VIWCPFWQUVBZFQ-IERDGZPVSA-N 0 3 417.525 4.285 20 0 HIADHN Clc1ccc(-c2nc3sccn3c2CN2CCN(C3CCOCC3)CC2)cc1 ZINC000477015483 891943574 /nfs/dbraw/zinc/94/35/74/891943574.db2.gz XQAIGSHWMHDDTH-UHFFFAOYSA-N 0 3 416.978 4.013 20 0 HIADHN COc1ccc([C@@H]2CCCCCN2C(=O)CN2CCC[C@]3(CCCOC3)C2)cc1 ZINC000477051837 891981033 /nfs/dbraw/zinc/98/10/33/891981033.db2.gz TVAYDVLMGXGTKH-UPVQGACJSA-N 0 3 400.563 4.032 20 0 HIADHN COc1ccc([C@@H]2CCCCCN2C(=O)CN2CCC[C@@]3(CCCOC3)C2)cc1 ZINC000477051834 891981390 /nfs/dbraw/zinc/98/13/90/891981390.db2.gz TVAYDVLMGXGTKH-LADGPHEKSA-N 0 3 400.563 4.032 20 0 HIADHN COc1ccc([C@H]2CCCN2C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)c(OC)c1 ZINC000504887570 913619327 /nfs/dbraw/zinc/61/93/27/913619327.db2.gz CSOUZSSUQYBOKS-NFBKMPQASA-N 0 3 423.557 4.215 20 0 HIADHN COCCN1CCC[C@@H]1CNC(=O)N(Cc1ccc(C)cc1)[C@H]1CCc2ccccc21 ZINC000477112297 892043198 /nfs/dbraw/zinc/04/31/98/892043198.db2.gz UVQJNNIAWUGHDZ-NOZRDPDXSA-N 0 3 421.585 4.305 20 0 HIADHN Cc1ccnc(Oc2ccc(NC(=O)N[C@@H](CN(C)C)c3ccc(F)cc3)cc2)n1 ZINC000477135305 892062568 /nfs/dbraw/zinc/06/25/68/892062568.db2.gz PSVFJEDNOJBJIS-FQEVSTJZSA-N 0 3 409.465 4.141 20 0 HIADHN CCN(Cc1ccc(OCc2ccncc2)cc1)Cc1ccc(C(=O)N(C)C)cc1 ZINC000477158167 892080608 /nfs/dbraw/zinc/08/06/08/892080608.db2.gz FEDIWJUBZDHQFL-UHFFFAOYSA-N 0 3 403.526 4.385 20 0 HIADHN CCc1noc(-c2ccc(C)c(NC(=O)NC[C@@H](N[C@H](C)CC)c3ccco3)c2)n1 ZINC000477160110 892081986 /nfs/dbraw/zinc/08/19/86/892081986.db2.gz HQORMDNSZOSQHJ-CRAIPNDOSA-N 0 3 411.506 4.451 20 0 HIADHN CC[C@@H](c1ccccc1)[C@H]1CCCN1CC(=O)Nc1ccccc1N1CCCC1=O ZINC000477225344 892160213 /nfs/dbraw/zinc/16/02/13/892160213.db2.gz WTKBDSXAZMHORI-RBBKRZOGSA-N 0 3 405.542 4.410 20 0 HIADHN CCn1ncc2ccc(NC(=O)NC[C@H](c3ccc(OC)cc3)N3CCCC3)cc21 ZINC000477416173 892369861 /nfs/dbraw/zinc/36/98/61/892369861.db2.gz ITVWPNJIWGFZIJ-JOCHJYFZSA-N 0 3 407.518 4.023 20 0 HIADHN CCN(C(=O)c1ccncc1Br)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000477467931 892441904 /nfs/dbraw/zinc/44/19/04/892441904.db2.gz ANTNNJSJODLZCK-WBVHZDCISA-N 0 3 402.336 4.142 20 0 HIADHN COc1cc(NC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)c(OC)cc1Cl ZINC000504929806 913670148 /nfs/dbraw/zinc/67/01/48/913670148.db2.gz LEZUPIYTSDGUTR-INIZCTEOSA-N 0 3 403.910 4.143 20 0 HIADHN Cc1ccc(-c2cccnc2)cc1NC(=O)CCN1CCN(c2ccccc2)CC1 ZINC000477515367 892528271 /nfs/dbraw/zinc/52/82/71/892528271.db2.gz MOIKNYORIXRZNG-UHFFFAOYSA-N 0 3 400.526 4.208 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)NCc1ccc(F)cc1C(F)(F)F)c1ccco1 ZINC000477608072 892692719 /nfs/dbraw/zinc/69/27/19/892692719.db2.gz BBFRYVTZVACTHU-WBMJQRKESA-N 0 3 401.404 4.366 20 0 HIADHN CCc1onc(C)c1C(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1 ZINC000477615198 892708282 /nfs/dbraw/zinc/70/82/82/892708282.db2.gz YNKSKESXTUYLBC-UHFFFAOYSA-N 0 3 418.541 4.162 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N[C@@H]1CCCc2ccc(C(C)C)cc21 ZINC000477638396 892759530 /nfs/dbraw/zinc/75/95/30/892759530.db2.gz CRWPZFMUJFRFOQ-JOCHJYFZSA-N 0 3 407.558 4.312 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Nc1ccc(OCC(F)(F)F)c(F)c1 ZINC000504960481 913697498 /nfs/dbraw/zinc/69/74/98/913697498.db2.gz YPECTZAMOARIBU-UHFFFAOYSA-N 0 3 419.444 4.424 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)N(Cc1ccco1)Cc1ccccc1 ZINC000504965122 913702539 /nfs/dbraw/zinc/70/25/39/913702539.db2.gz ICIAPOJNHICWMB-UHFFFAOYSA-N 0 3 413.587 4.353 20 0 HIADHN O=C(CCc1ccc(OC(F)F)cc1)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000477736539 892834551 /nfs/dbraw/zinc/83/45/51/892834551.db2.gz BKXCSMJIUVLPDJ-UHFFFAOYSA-N 0 3 418.484 4.064 20 0 HIADHN Cc1cc(C)c(C)c(OCCC(=O)Nc2cccc(CN3CCC(CO)CC3)c2)c1 ZINC000477738022 892834816 /nfs/dbraw/zinc/83/48/16/892834816.db2.gz FCHHYOUHFHERGN-UHFFFAOYSA-N 0 3 410.558 4.224 20 0 HIADHN Cc1ccc(C(=O)Nc2cccc(CN3CCC(CO)CC3)c2)cc1Br ZINC000477742448 892837995 /nfs/dbraw/zinc/83/79/95/892837995.db2.gz JHEIHWAYLUFJEJ-UHFFFAOYSA-N 0 3 417.347 4.214 20 0 HIADHN CC[C@H](O[C@H]1CCC[C@@H](C)C1)C(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000477752904 892844493 /nfs/dbraw/zinc/84/44/93/892844493.db2.gz YAYPEFZFNXKIET-LEOXJPRUSA-N 0 3 402.579 4.203 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1ccc(OCC(F)(F)F)cc1 ZINC000477755908 892847170 /nfs/dbraw/zinc/84/71/70/892847170.db2.gz OWOBPEJTOWUOHK-UHFFFAOYSA-N 0 3 422.447 4.084 20 0 HIADHN Cc1noc2nc(C(C)C)cc(C(=O)Nc3cccc(CN4CCC(CO)CC4)c3)c12 ZINC000477757107 892847907 /nfs/dbraw/zinc/84/79/07/892847907.db2.gz RVZJZWVYIJDKIG-UHFFFAOYSA-N 0 3 422.529 4.111 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)[C@H]1C[C@@H]1c1c(F)cccc1Cl ZINC000477758145 892848731 /nfs/dbraw/zinc/84/87/31/892848731.db2.gz ZHPLDOWUJQHTEM-OALUTQOASA-N 0 3 416.924 4.426 20 0 HIADHN C[C@@H](NC(=O)NCc1ccc(OCC(F)(F)F)cc1)[C@@H](c1ccccc1)N(C)C ZINC000477902776 892973931 /nfs/dbraw/zinc/97/39/31/892973931.db2.gz BFEUHIJQISJBEC-BEFAXECRSA-N 0 3 409.452 4.118 20 0 HIADHN CC(C)Cc1ccc([C@@H](CNC(=O)Nc2ccn(CC(F)(F)F)n2)N(C)C)cc1 ZINC000477908430 892982177 /nfs/dbraw/zinc/98/21/77/892982177.db2.gz LAWOCWGNASLVCL-QGZVFWFLSA-N 0 3 411.472 4.068 20 0 HIADHN Cc1ccc(CN2CC[C@H](N[C@H](C)c3ccc(OCC(F)(F)F)cc3)C2=O)cc1 ZINC000477919352 893004571 /nfs/dbraw/zinc/00/45/71/893004571.db2.gz QJESQCBUHMCYBP-UZLBHIALSA-N 0 3 406.448 4.388 20 0 HIADHN CC(C)(C)C[C@@H](NCc1ccc(S(=O)(=O)CCO)cc1)c1ccc(Cl)cc1 ZINC000477923430 893010443 /nfs/dbraw/zinc/01/04/43/893010443.db2.gz AJVFLWSAADQCFA-HXUWFJFHSA-N 0 3 409.979 4.373 20 0 HIADHN Cc1cc([C@@H](NC[C@H](CO)Cc2ccc(F)c(F)c2)c2cccnc2)ccc1F ZINC000477931258 893021861 /nfs/dbraw/zinc/02/18/61/893021861.db2.gz MOSVRMFTCSVXRX-UZUQRXQVSA-N 0 3 400.444 4.338 20 0 HIADHN Cc1ccc(CN2CC[C@@H](N[C@H](C)CC(=O)Nc3cc(Cl)ccc3C)C2=O)cc1 ZINC000477937525 893025861 /nfs/dbraw/zinc/02/58/61/893025861.db2.gz ZTJARGBQBCZHBN-YLJYHZDGSA-N 0 3 413.949 4.065 20 0 HIADHN CCCCn1ncc(NC(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)c1C ZINC000477936481 893027044 /nfs/dbraw/zinc/02/70/44/893027044.db2.gz IALSCFBDIHEJHV-NRFANRHFSA-N 0 3 401.555 4.203 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)N[C@H]1CCC[C@@H]1c1ccccc1 ZINC000478021618 893141411 /nfs/dbraw/zinc/14/14/11/893141411.db2.gz OTOXHZKWWHJWIA-IRLDBZIGSA-N 0 3 401.501 4.374 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)N[C@H]1CCC[C@H]1c1ccccc1 ZINC000478021624 893141795 /nfs/dbraw/zinc/14/17/95/893141795.db2.gz OTOXHZKWWHJWIA-UNMCSNQZSA-N 0 3 401.501 4.374 20 0 HIADHN CCN1CCC[C@@H](CN(C)C(=O)Nc2cccc(-n3cccc3)c2)[C@@H]1c1cnn(C)c1 ZINC000478077244 893239456 /nfs/dbraw/zinc/23/94/56/893239456.db2.gz CBMJZRHCFJTSAW-WMZHIEFXSA-N 0 3 420.561 4.148 20 0 HIADHN Cc1nc(C(=O)N(CC(C)C)C2CCN(C)CC2)nn1-c1c(Cl)cccc1Cl ZINC000478161550 893330653 /nfs/dbraw/zinc/33/06/53/893330653.db2.gz QTEDUJZBLPBREG-UHFFFAOYSA-N 0 3 424.376 4.075 20 0 HIADHN CCN(CC(=O)Nc1c(Cl)cccc1Cl)C(=O)[C@H](C)N1[C@@H](C)CC[C@@H]1C ZINC000478231931 893393530 /nfs/dbraw/zinc/39/35/30/893393530.db2.gz HEXRGXRXFXTTIV-IHRRRGAJSA-N 0 3 400.350 4.042 20 0 HIADHN CCCN(C(=O)c1ccc(N2CCCC2=O)cc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000505036256 913776203 /nfs/dbraw/zinc/77/62/03/913776203.db2.gz UUYGNEPTHPYRQG-XMMPIXPASA-N 0 3 419.569 4.330 20 0 HIADHN CCCN(C(=O)C[C@H](NC(C)=O)c1ccccc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000505036595 913776551 /nfs/dbraw/zinc/77/65/51/913776551.db2.gz YBHKFTODUCBEEE-DQEYMECFSA-N 0 3 421.585 4.157 20 0 HIADHN CC[C@@H](C)n1ncc(C(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)c1C ZINC000478333464 893567105 /nfs/dbraw/zinc/56/71/05/893567105.db2.gz DWRBGSFSLMEOMF-NQIIRXRSSA-N 0 3 420.561 4.367 20 0 HIADHN O=S1(=O)CCCN1c1ccc(CN[C@H](Cc2ccccc2)c2ccccc2)cc1F ZINC000478417142 893707625 /nfs/dbraw/zinc/70/76/25/893707625.db2.gz PSFYCGIGSWZBFB-HSZRJFAPSA-N 0 3 424.541 4.439 20 0 HIADHN CN1C[C@H](NC(=O)CCc2ncc(-c3ccccc3Cl)o2)[C@H](c2ccccc2)C1 ZINC000478453020 893770031 /nfs/dbraw/zinc/77/00/31/893770031.db2.gz SGWGSXOTWHFIFU-ICSRJNTNSA-N 0 3 409.917 4.142 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)N1CCC[C@H](Nc2ccccc2)C1 ZINC000478662760 893908450 /nfs/dbraw/zinc/90/84/50/893908450.db2.gz AZUAJBGEKLAFOZ-QHCPKHFHSA-N 0 3 424.614 4.386 20 0 HIADHN CCCCN(C)C(=O)NCCCCN1CCN(c2cccc(C(F)(F)F)c2)CC1 ZINC000505133472 913834474 /nfs/dbraw/zinc/83/44/74/913834474.db2.gz JDSFUAKHELSDGO-UHFFFAOYSA-N 0 3 414.516 4.049 20 0 HIADHN Cc1cc(Br)cc(Cl)c1C(=O)NCCCCN1C[C@@H](C)O[C@H](C)C1 ZINC000478873739 894151023 /nfs/dbraw/zinc/15/10/23/894151023.db2.gz MKXUKRGLBYRPCE-ZIAGYGMSSA-N 0 3 417.775 4.030 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1cc(Br)cc(OC)c1)c1ccco1 ZINC000478927181 894207956 /nfs/dbraw/zinc/20/79/56/894207956.db2.gz GBTRMXVRNASPHV-BLLLJJGKSA-N 0 3 410.312 4.302 20 0 HIADHN Cc1csc(CCCCN[C@H](C)c2cc(S(N)(=O)=O)c(Cl)cc2Cl)n1 ZINC000479060473 894320569 /nfs/dbraw/zinc/32/05/69/894320569.db2.gz ACZYYOIZYLFASC-LLVKDONJSA-N 0 3 422.403 4.079 20 0 HIADHN C[C@@H](NCCc1ccccc1Cl)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479064628 894325975 /nfs/dbraw/zinc/32/59/75/894325975.db2.gz GYVAGXPUYKMELS-SNVBAGLBSA-N 0 3 407.750 4.188 20 0 HIADHN C[C@@H](CN[C@@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl)c1ccc(F)cc1 ZINC000479065897 894328362 /nfs/dbraw/zinc/32/83/62/894328362.db2.gz HTVSORIXQFNRKR-QWRGUYRKSA-N 0 3 405.322 4.234 20 0 HIADHN CCC[C@H](N[C@H]1CCc2cc(OC)c(OC)cc21)C(=O)N1CCc2sccc2C1 ZINC000479065587 894329114 /nfs/dbraw/zinc/32/91/14/894329114.db2.gz UWXIWPSRVILZQD-OALUTQOASA-N 0 3 414.571 4.096 20 0 HIADHN Cc1ccc(CC[C@H](C)N[C@H](C)c2cc(S(N)(=O)=O)c(Cl)cc2Cl)o1 ZINC000479074322 894337556 /nfs/dbraw/zinc/33/75/56/894337556.db2.gz ZZSVEAACMZTRIS-CMPLNLGQSA-N 0 3 405.347 4.214 20 0 HIADHN Cc1ccc(CC[C@H](C)N[C@@H](C)c2cc(S(N)(=O)=O)c(Cl)cc2Cl)o1 ZINC000479074323 894338122 /nfs/dbraw/zinc/33/81/22/894338122.db2.gz ZZSVEAACMZTRIS-JQWIXIFHSA-N 0 3 405.347 4.214 20 0 HIADHN C[C@@H](NCc1ccc(C(N)=O)cc1)c1ccc(Br)cc1C(F)(F)F ZINC000479253390 894518495 /nfs/dbraw/zinc/51/84/95/894518495.db2.gz CYFVZYKYVJDFJP-SNVBAGLBSA-N 0 3 401.226 4.418 20 0 HIADHN O=C(Nc1cc(Br)ccc1N1CCCC1)N1CCN(C2CCCC2)CC1 ZINC000479295135 894577979 /nfs/dbraw/zinc/57/79/79/894577979.db2.gz KEMGJFXHEAKNEE-UHFFFAOYSA-N 0 3 421.383 4.141 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)N[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1 ZINC000479307680 894593692 /nfs/dbraw/zinc/59/36/92/894593692.db2.gz GNSMIZXLRYEOPM-CQSZACIVSA-N 0 3 415.896 4.296 20 0 HIADHN C[C@@H](NCCc1ccc(Cl)cc1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479330502 894623684 /nfs/dbraw/zinc/62/36/84/894623684.db2.gz YONPTUZRGQXQFT-SNVBAGLBSA-N 0 3 407.750 4.188 20 0 HIADHN CO[C@H](c1ccc(Cl)cc1)[C@H](C)N[C@H](C)c1cc(S(N)(=O)=O)c(C)cc1C ZINC000479405183 894711296 /nfs/dbraw/zinc/71/12/96/894711296.db2.gz FPOOSFAKONBGHB-SIFCLUCFSA-N 0 3 410.967 4.031 20 0 HIADHN CCS(=O)(=O)c1ccc(CN[C@H]2CCCc3cc(Br)ccc32)cc1 ZINC000479427051 894739037 /nfs/dbraw/zinc/73/90/37/894739037.db2.gz WTGXJVUONZPZJH-IBGZPJMESA-N 0 3 408.361 4.410 20 0 HIADHN CCC(CC)[C@@H]1C[C@@H](N[C@H](C)c2cc(S(N)(=O)=O)c(Cl)cc2Cl)CCO1 ZINC000479434365 894749085 /nfs/dbraw/zinc/74/90/85/894749085.db2.gz DJHDLGXWINDNCA-ZUCKAHLUSA-N 0 3 423.406 4.275 20 0 HIADHN Fc1ccc([C@H](NCCCCn2cc(Br)cn2)c2cccnc2)cc1 ZINC000479462564 894786648 /nfs/dbraw/zinc/78/66/48/894786648.db2.gz GMLNGYZRKMIWSP-IBGZPJMESA-N 0 3 403.299 4.339 20 0 HIADHN Cc1cccc(CCN[C@@H](c2ccc(Cl)cc2)c2cccc(S(C)(=O)=O)c2)n1 ZINC000479468396 894792573 /nfs/dbraw/zinc/79/25/73/894792573.db2.gz RZJOXQUWSJWOSY-QFIPXVFZSA-N 0 3 414.958 4.369 20 0 HIADHN COc1cccc(NC(=O)[C@@H](N[C@H]2CCc3cnn(C(C)C)c3C2)c2ccccc2)c1 ZINC000479484285 894807098 /nfs/dbraw/zinc/80/70/98/894807098.db2.gz AUNQBLRBHZHHRU-URXFXBBRSA-N 0 3 418.541 4.300 20 0 HIADHN CCOC(=O)[C@H](NC1CCN([C@H](C)c2ccncc2)CC1)c1cccc(Cl)c1 ZINC000479492459 894811794 /nfs/dbraw/zinc/81/17/94/894811794.db2.gz VMVQFXAJTYNSCZ-IIBYNOLFSA-N 0 3 401.938 4.154 20 0 HIADHN COc1ccc(-c2ccncc2)cc1CNCCNc1ccc(-c2ccccc2)nn1 ZINC000479569601 894863454 /nfs/dbraw/zinc/86/34/54/894863454.db2.gz MCCCBGBTGPGBHB-UHFFFAOYSA-N 0 3 411.509 4.416 20 0 HIADHN O=S1(=O)CCCN1c1ccc(CNCc2ccc(-c3ccccc3)s2)cc1F ZINC000479594729 894876266 /nfs/dbraw/zinc/87/62/66/894876266.db2.gz UCRYZWKHRKSNTQ-UHFFFAOYSA-N 0 3 416.543 4.384 20 0 HIADHN CCCN(Cc1csc(N(CC)C(C)=O)n1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000479696690 894986853 /nfs/dbraw/zinc/98/68/53/894986853.db2.gz ZYJBTFFUMPCMFE-JOCHJYFZSA-N 0 3 414.619 4.393 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)N[C@H](C)c1ccc(NC(=O)C2CC2)cc1 ZINC000479726851 895024638 /nfs/dbraw/zinc/02/46/38/895024638.db2.gz JGMTXHXJZOYUNS-GOSISDBHSA-N 0 3 400.567 4.004 20 0 HIADHN COc1ccc(CN2CCCN(Cc3ccccc3OCc3ccncc3)CC2)cc1 ZINC000505270562 913927398 /nfs/dbraw/zinc/92/73/98/913927398.db2.gz CBCNMWGUZJJHMP-UHFFFAOYSA-N 0 3 417.553 4.377 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)N1C[C@H](c2ccccc2)[C@@H]2COCC[C@@H]21 ZINC000479742905 895040983 /nfs/dbraw/zinc/04/09/83/895040983.db2.gz FKCMFSQQCOOTBN-RCTAOEEJSA-N 0 3 419.569 4.038 20 0 HIADHN CC[C@@H](NC(=O)N[C@@H](CN(C)C)c1ccc(OC)cc1)c1ccccc1OC(F)F ZINC000479760640 895061566 /nfs/dbraw/zinc/06/15/66/895061566.db2.gz UBGWDTQPOJGTJU-MOPGFXCFSA-N 0 3 421.488 4.350 20 0 HIADHN COc1cc(CN2CCCCC[C@H]2c2ccncc2)ccc1OCC(=O)N1CCCC1 ZINC000505273961 913931542 /nfs/dbraw/zinc/93/15/42/913931542.db2.gz QORWUBBPCBQCQU-QFIPXVFZSA-N 0 3 423.557 4.209 20 0 HIADHN COc1ccc(CCN[C@H](C)c2ccccc2I)cc1OC ZINC000479775276 895076798 /nfs/dbraw/zinc/07/67/98/895076798.db2.gz RZCMDROGRHUCKY-CYBMUJFWSA-N 0 3 411.283 4.202 20 0 HIADHN COc1cc(OC)c([C@@H](C)NC[C@@H](c2cccs2)N2CCOCC2)cc1Cl ZINC000479849171 895181893 /nfs/dbraw/zinc/18/18/93/895181893.db2.gz HJMHCBQDLVAGBB-PBHICJAKSA-N 0 3 410.967 4.143 20 0 HIADHN C[C@@H](NC[C@H](c1ccco1)N1CCCC1)c1ccccc1I ZINC000479853181 895187085 /nfs/dbraw/zinc/18/70/85/895187085.db2.gz PDIOYIHGLHPREA-RHSMWYFYSA-N 0 3 410.299 4.372 20 0 HIADHN O=C(CCCc1nc(C2CC2)no1)N1CCN(Cc2ccccc2)C2(CCCCC2)C1 ZINC000479853735 895187382 /nfs/dbraw/zinc/18/73/82/895187382.db2.gz RHBASQXCJRBNKF-UHFFFAOYSA-N 0 3 422.573 4.317 20 0 HIADHN COc1ccccc1[C@@H](CN[C@@H](C)c1cc(OC)c(OC)cc1F)N1CCCC1 ZINC000479875487 895216390 /nfs/dbraw/zinc/21/63/90/895216390.db2.gz QTLRZSFTAVGIDG-OXJNMPFZSA-N 0 3 402.510 4.339 20 0 HIADHN C[C@@H](NCc1ccccc1CN1CCOCC1)c1ccc(F)c(Br)c1 ZINC000479876723 895219099 /nfs/dbraw/zinc/21/90/99/895219099.db2.gz UPIBRDBMJGKSPV-OAHLLOKOSA-N 0 3 407.327 4.271 20 0 HIADHN COc1ccc([C@H](CN[C@@H](C)c2ccc(F)cc2Cl)N2CCOCC2)cc1OC ZINC000479890605 895236929 /nfs/dbraw/zinc/23/69/29/895236929.db2.gz VRODHPJFTLYUDI-YWZLYKJASA-N 0 3 422.928 4.220 20 0 HIADHN Cc1c([C@@H](C)NCc2ccc(CN3CCOCC3)cc2)cnn1-c1ccc(F)cc1 ZINC000479900778 895247307 /nfs/dbraw/zinc/24/73/07/895247307.db2.gz LBIFAYMVNBKKNB-GOSISDBHSA-N 0 3 408.521 4.003 20 0 HIADHN CC[C@@H](c1ccccc1)[C@H]1CCCN1Cc1nc2cc(C(=O)OC)ccc2c(=O)[nH]1 ZINC000480041634 895391494 /nfs/dbraw/zinc/39/14/94/895391494.db2.gz FHZLHVGYUNENSB-GHTZIAJQSA-N 0 3 405.498 4.280 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)Nc1cc(C(C)(C)C)nn1-c1ccccn1 ZINC000480063993 895413390 /nfs/dbraw/zinc/41/33/90/895413390.db2.gz CRTXFQKGYRUYFF-UHFFFAOYSA-N 0 3 412.582 4.295 20 0 HIADHN COc1cccc([C@@H](CN[C@H](C)c2cc(OC)c(OC)cc2F)N2CCCC2)c1 ZINC000480080241 895436131 /nfs/dbraw/zinc/43/61/31/895436131.db2.gz AAMAKJQXUJEGSZ-IIBYNOLFSA-N 0 3 402.510 4.339 20 0 HIADHN Cc1ccc([C@@H](C)CN[C@H]2CCS(=O)(=O)c3ccc(Br)cc32)cc1 ZINC000480147780 895529309 /nfs/dbraw/zinc/52/93/09/895529309.db2.gz LCLPGAJPTOIQBQ-KSSFIOAISA-N 0 3 408.361 4.369 20 0 HIADHN c1[nH]nc(-c2cccnc2)c1CN1CCN(C(c2ccccc2)c2ccccc2)CC1 ZINC000505315166 913977238 /nfs/dbraw/zinc/97/72/38/913977238.db2.gz VXELRZOLWKMJIK-UHFFFAOYSA-N 0 3 409.537 4.379 20 0 HIADHN Cc1cccc([C@H](C)CN[C@H]2CCS(=O)(=O)c3ccc(Br)cc32)c1 ZINC000480202986 895603003 /nfs/dbraw/zinc/60/30/03/895603003.db2.gz ZOBKRQAKILXTQN-KDOFPFPSSA-N 0 3 408.361 4.369 20 0 HIADHN CC[C@@H](Cc1ccccc1)N[C@@H]1CCS(=O)(=O)c2ccc(Br)cc21 ZINC000480206572 895609305 /nfs/dbraw/zinc/60/93/05/895609305.db2.gz ACMAJNHWBFSWMI-FUHWJXTLSA-N 0 3 408.361 4.279 20 0 HIADHN O=S1(=O)CC[C@@H](NCC2(Cc3ccccc3)CC2)c2cc(Br)ccc21 ZINC000480212345 895615414 /nfs/dbraw/zinc/61/54/14/895615414.db2.gz GWOXTIOTOJPIOO-GOSISDBHSA-N 0 3 420.372 4.280 20 0 HIADHN COc1ccc(OC)c([C@H](C)NC[C@H](c2ccccc2Cl)N2CCOCC2)c1 ZINC000480262493 895670003 /nfs/dbraw/zinc/67/00/03/895670003.db2.gz KNLZUJPVWUMMCV-HRAATJIYSA-N 0 3 404.938 4.081 20 0 HIADHN Cc1cc([C@@H]2CN(C(=O)N[C@H](CN3CCCC3)c3ccccc3)CCO2)ccc1F ZINC000480264418 895672547 /nfs/dbraw/zinc/67/25/47/895672547.db2.gz YIGYABBPFUJMML-PKTZIBPZSA-N 0 3 411.521 4.054 20 0 HIADHN CC(C)(C)n1cc(CNc2cccc(N3CCN(CCc4ccccc4)CC3)c2)nn1 ZINC000480272551 895681057 /nfs/dbraw/zinc/68/10/57/895681057.db2.gz DBBOWCHCPBQBPW-UHFFFAOYSA-N 0 3 418.589 4.010 20 0 HIADHN CC[C@@H](N[C@H](C)c1ccc(S(=O)(=O)N2CCOCC2)cc1)c1ccc(Cl)cc1 ZINC000480283617 895688377 /nfs/dbraw/zinc/68/83/77/895688377.db2.gz OOPDTAAVOVZCSQ-IIBYNOLFSA-N 0 3 422.978 4.163 20 0 HIADHN COCCN(C)c1ccc(CN[C@H](c2cc(F)cc(Br)c2)C2CC2)cn1 ZINC000480291230 895696041 /nfs/dbraw/zinc/69/60/41/895696041.db2.gz XRZGQAVURSAHOV-FQEVSTJZSA-N 0 3 422.342 4.307 20 0 HIADHN O=S1(=O)CC[C@H](NCCc2ccc(Cl)cc2)c2cc(Br)ccc21 ZINC000480327058 895729320 /nfs/dbraw/zinc/72/93/20/895729320.db2.gz CRSUMXSJIWMDDW-INIZCTEOSA-N 0 3 414.752 4.153 20 0 HIADHN C[C@@H](CCc1ccccc1)N[C@@H]1CCS(=O)(=O)c2ccc(Br)cc21 ZINC000480327972 895731249 /nfs/dbraw/zinc/73/12/49/895731249.db2.gz MZHXVJVAYIKFFE-KBXCAEBGSA-N 0 3 408.361 4.279 20 0 HIADHN CC(C)Cc1ccc([C@H](CNC(=O)Nc2cccc(-c3ncn(C)n3)c2)N(C)C)cc1 ZINC000480349661 895754761 /nfs/dbraw/zinc/75/47/61/895754761.db2.gz RKIJZGIUZDPCRU-QFIPXVFZSA-N 0 3 420.561 4.105 20 0 HIADHN CCN(Cc1cccc(Br)c1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000480367800 895774966 /nfs/dbraw/zinc/77/49/66/895774966.db2.gz PYNXQEXLEHKAHT-HXUWFJFHSA-N 0 3 416.363 4.255 20 0 HIADHN FC(F)(F)Oc1ccc2c(c1)[C@H](N[C@@H](CN1CCOCC1)c1ccccc1)CC2 ZINC000480415087 895813937 /nfs/dbraw/zinc/81/39/37/895813937.db2.gz JVCLGNIEQPSTFG-RTWAWAEBSA-N 0 3 406.448 4.236 20 0 HIADHN O=C1[C@H](NCc2ccc(-n3cnc4ccccc43)cc2)CCN1Cc1ccc(F)cc1 ZINC000480485420 895861451 /nfs/dbraw/zinc/86/14/51/895861451.db2.gz CKPZQWTVKXVULO-HSZRJFAPSA-N 0 3 414.484 4.055 20 0 HIADHN c1csc(-c2noc(CCCN3CCN(CCCCc4ccccc4)CC3)n2)c1 ZINC000480519876 895884419 /nfs/dbraw/zinc/88/44/19/895884419.db2.gz BKYHTXFSCUPEIS-UHFFFAOYSA-N 0 3 410.587 4.371 20 0 HIADHN C[C@H](NCCCN1C(=O)NC2(CCCCC2)C1=O)c1cc(Cl)sc1Cl ZINC000480537173 895899357 /nfs/dbraw/zinc/89/93/57/895899357.db2.gz NDDJTTYTYXJEBK-NSHDSACASA-N 0 3 404.363 4.350 20 0 HIADHN COc1cc([C@H](C)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)nc2)ccc1SC ZINC000480599728 895962960 /nfs/dbraw/zinc/96/29/60/895962960.db2.gz COLJXDXDDJPBGS-ZACQAIPSSA-N 0 3 401.576 4.277 20 0 HIADHN C[C@@H]1C[C@H](NCc2ccc(N3CCO[C@H](C)C3)nc2)c2cccc(Br)c21 ZINC000480620590 895988121 /nfs/dbraw/zinc/98/81/21/895988121.db2.gz VNGNUKOJCSWDDC-CLCXKQKWSA-N 0 3 416.363 4.407 20 0 HIADHN CCCN1C(=O)CCc2cc(NC(=O)NC[C@H](N[C@@H](C)CC)c3ccco3)ccc21 ZINC000480684902 896047550 /nfs/dbraw/zinc/04/75/50/896047550.db2.gz PXSQYRZUYUUHHQ-LPHOPBHVSA-N 0 3 412.534 4.220 20 0 HIADHN CCCN1C(=O)CCc2cc(NC(=O)NC[C@@H](N[C@H](C)CC)c3ccco3)ccc21 ZINC000480684904 896048075 /nfs/dbraw/zinc/04/80/75/896048075.db2.gz PXSQYRZUYUUHHQ-VQIMIIECSA-N 0 3 412.534 4.220 20 0 HIADHN Cc1onc(-c2ccncc2)c1C(=O)NC[C@@H](c1ccccc1)N1CCC(C)CC1 ZINC000480689169 896051219 /nfs/dbraw/zinc/05/12/19/896051219.db2.gz MBAOAWPRUFWAQJ-NRFANRHFSA-N 0 3 404.514 4.248 20 0 HIADHN CC[C@H](NCc1ccc(N2CCN(CC)CC2)nc1)c1cc(Cl)ccc1OC ZINC000480699364 896060683 /nfs/dbraw/zinc/06/06/83/896060683.db2.gz PKVRJMKEKCGERL-FQEVSTJZSA-N 0 3 402.970 4.126 20 0 HIADHN CCSc1ccccc1[C@H](C)NCc1ccc(N2CCCS2(=O)=O)c(F)c1 ZINC000480700353 896062153 /nfs/dbraw/zinc/06/21/53/896062153.db2.gz RRSXDBFLQNJNPC-HNNXBMFYSA-N 0 3 408.564 4.328 20 0 HIADHN COCCOc1ccc([C@H](C)NCc2ccc(N3CCC(C)CC3)nc2)cc1OC ZINC000480703517 896065298 /nfs/dbraw/zinc/06/52/98/896065298.db2.gz ZTNBPCGRRRGKGK-IBGZPJMESA-N 0 3 413.562 4.203 20 0 HIADHN C[C@H](NCc1ccnc(N2CCN(C)CC2)c1)c1ccc(SCC(F)(F)F)cc1 ZINC000480705458 896067020 /nfs/dbraw/zinc/06/70/20/896067020.db2.gz HEQIQWMAFQKFNU-INIZCTEOSA-N 0 3 424.536 4.339 20 0 HIADHN C[C@H](NCc1ccc(N2CCCS2(=O)=O)c(F)c1)c1cc2c(s1)CCCC2 ZINC000480717286 896077866 /nfs/dbraw/zinc/07/78/66/896077866.db2.gz LYXCTUVDGCAKIC-AWEZNQCLSA-N 0 3 408.564 4.157 20 0 HIADHN CN1CCN(c2cc(CN[C@@H]3CCCOc4c(Cl)c(Cl)ccc43)ccn2)CC1 ZINC000480720222 896079417 /nfs/dbraw/zinc/07/94/17/896079417.db2.gz JFRFDUGAVYFWGX-GOSISDBHSA-N 0 3 421.372 4.144 20 0 HIADHN COc1ccc(Cl)cc1[C@H](CC(C)C)NCc1ccnc(N2CCN(C)CC2)c1 ZINC000480724791 896084935 /nfs/dbraw/zinc/08/49/35/896084935.db2.gz WGAHREPNHVEEBG-NRFANRHFSA-N 0 3 416.997 4.372 20 0 HIADHN CC(C)Cc1ccc([C@H](C)NCc2ccc(N3CCCS3(=O)=O)c(F)c2)cc1 ZINC000480723469 896085148 /nfs/dbraw/zinc/08/51/48/896085148.db2.gz ZFZFGXKYFYTQCD-KRWDZBQOSA-N 0 3 404.551 4.415 20 0 HIADHN COc1ccc([C@H](C)N[C@@H](C)c2ccc(NC(=O)NC3CC3)cc2)cc1NC(C)=O ZINC000480739058 896098672 /nfs/dbraw/zinc/09/86/72/896098672.db2.gz RRAJAMWQMXNMTI-GJZGRUSLSA-N 0 3 410.518 4.349 20 0 HIADHN CCCNC(=O)CN1CCC(N[C@H]2CCCc3c(Cl)sc(Cl)c32)CC1 ZINC000480768958 896130757 /nfs/dbraw/zinc/13/07/57/896130757.db2.gz HCBAQSIRCAVWIW-AWEZNQCLSA-N 0 3 404.407 4.013 20 0 HIADHN C[C@H]1CC[C@H](NCc2cccc(NC(=O)CCN3CCOCC3)c2)c2ccccc21 ZINC000480912370 896270320 /nfs/dbraw/zinc/27/03/20/896270320.db2.gz MWPGFEBZXYXSPU-CYFREDJKSA-N 0 3 407.558 4.076 20 0 HIADHN Cc1c2ccccc2oc1[C@@H](C)NCc1cccc(NC(=O)CCN2CCOCC2)c1 ZINC000480913542 896271205 /nfs/dbraw/zinc/27/12/05/896271205.db2.gz UDKQDEOGGUGADU-LJQANCHMSA-N 0 3 421.541 4.253 20 0 HIADHN CNS(=O)(=O)c1cccc(CN[C@H](Cc2ccc(Cl)cc2)c2ccccc2)c1 ZINC000481018389 896347879 /nfs/dbraw/zinc/34/78/79/896347879.db2.gz DVIGMLICSGDYJI-JOCHJYFZSA-N 0 3 414.958 4.322 20 0 HIADHN C[C@H](NC[C@@H](c1ccccc1)N1CCC(C)CC1)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000481053134 896377289 /nfs/dbraw/zinc/37/72/89/896377289.db2.gz ZPDTZRSSUBGROM-AVRDEDQJSA-N 0 3 418.578 4.353 20 0 HIADHN COc1ccc2ccccc2c1-c1cc(CN2CCC(Cn3ccnn3)CC2)on1 ZINC000481124401 896452363 /nfs/dbraw/zinc/45/23/63/896452363.db2.gz YQQXFQZALOBCKG-UHFFFAOYSA-N 0 3 403.486 4.007 20 0 HIADHN COc1ccc([C@H](C)N[C@H](C)c2ccc(OCCO)c(OC)c2)cc1Br ZINC000481187123 896536775 /nfs/dbraw/zinc/53/67/75/896536775.db2.gz WWIQOGJDSQQNKJ-UONOGXRCSA-N 0 3 424.335 4.249 20 0 HIADHN O=C(CN[C@H](CC1CCC1)c1ccccc1)NCC1(c2ccccc2)CCOCC1 ZINC000481221891 896573379 /nfs/dbraw/zinc/57/33/79/896573379.db2.gz CQFGBRGODMVODK-XMMPIXPASA-N 0 3 406.570 4.372 20 0 HIADHN Cc1cc(NC(=O)CN[C@H](CC2CCC2)c2ccccc2)n(-c2nc(C)cc(C)n2)n1 ZINC000481230309 896581344 /nfs/dbraw/zinc/58/13/44/896581344.db2.gz PDWXNDGVPGPORD-OAQYLSRUSA-N 0 3 418.545 4.047 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)NCc2nccc3ccccc32)N(C)C)cc1 ZINC000481232013 896583656 /nfs/dbraw/zinc/58/36/56/896583656.db2.gz FZZPBWBCQAFERV-QHCPKHFHSA-N 0 3 406.530 4.124 20 0 HIADHN COc1cc(OC)c([C@@H](C)NC[C@H](c2cccc(F)c2)N2CCOCC2)cc1Cl ZINC000481239173 896588881 /nfs/dbraw/zinc/58/88/81/896588881.db2.gz FVHZOVKSIQKMSQ-FOIQADDNSA-N 0 3 422.928 4.220 20 0 HIADHN Cc1ccsc1[C@H](Cc1ccccc1)NCc1cccnc1N1CCN(C)CC1 ZINC000481239607 896590330 /nfs/dbraw/zinc/59/03/30/896590330.db2.gz GJYJVWZWSGETMD-QFIPXVFZSA-N 0 3 406.599 4.277 20 0 HIADHN CN(C(=O)CCc1cc(Cl)cc(Cl)c1)C1CCN(CCc2ccccn2)CC1 ZINC000481244108 896595571 /nfs/dbraw/zinc/59/55/71/896595571.db2.gz ZTNQQMLMJCNKSA-UHFFFAOYSA-N 0 3 420.384 4.487 20 0 HIADHN CN1CCN(c2ncccc2CN[C@@H]2CCCOc3c(Cl)c(Cl)ccc32)CC1 ZINC000481246762 896598540 /nfs/dbraw/zinc/59/85/40/896598540.db2.gz QZKHPPCGFPNCLA-GOSISDBHSA-N 0 3 421.372 4.144 20 0 HIADHN Cc1nc(-c2ccccc2)sc1[C@@H](C)NCc1cccnc1N1CCN(C)CC1 ZINC000481246876 896599386 /nfs/dbraw/zinc/59/93/86/896599386.db2.gz PCQCMZWBDKWZNH-QGZVFWFLSA-N 0 3 407.587 4.116 20 0 HIADHN COc1cc2c(cc1OC)CN(C(=O)CN[C@H](CC1CCC1)c1ccccc1)CC2 ZINC000481284351 896631861 /nfs/dbraw/zinc/63/18/61/896631861.db2.gz LPKONKNUZCCYFK-JOCHJYFZSA-N 0 3 408.542 4.110 20 0 HIADHN Cc1nc2c(s1)[C@H](NCc1ccc(S(=O)(=O)N3CCC[C@H](C)C3)cc1)CCC2 ZINC000481303053 896648749 /nfs/dbraw/zinc/64/87/49/896648749.db2.gz FOJFHOGNWHYGDL-HNAYVOBHSA-N 0 3 419.616 4.039 20 0 HIADHN COc1ccc([C@H](C)NCc2cccc(CN3CCOCC3)c2)cc1Br ZINC000481312412 896660387 /nfs/dbraw/zinc/66/03/87/896660387.db2.gz IHFRNSAUXWGSIG-INIZCTEOSA-N 0 3 419.363 4.141 20 0 HIADHN Cc1nc(-c2ccccc2)sc1[C@H](C)NCc1cccc(OCC(=O)N(C)C)c1 ZINC000481315259 896664250 /nfs/dbraw/zinc/66/42/50/896664250.db2.gz QMZKCCVKIFCHBW-INIZCTEOSA-N 0 3 409.555 4.436 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N[C@H](c1ccc(OC)cc1)C(F)(F)F)c1ccco1 ZINC000481316804 896667371 /nfs/dbraw/zinc/66/73/71/896667371.db2.gz LBTVZOWFJGMOOM-FDQGKXFDSA-N 0 3 413.440 4.320 20 0 HIADHN C[C@@H]1C[C@H](NCc2cccc(OCC(=O)N(C)C)c2)c2cccc(Br)c21 ZINC000481317684 896670211 /nfs/dbraw/zinc/67/02/11/896670211.db2.gz QMBCPHOYSIUITJ-KUHUBIRLSA-N 0 3 417.347 4.254 20 0 HIADHN CCCN(CCN1CCCC1)C(=O)Nc1nnc(-c2c(F)cccc2Cl)s1 ZINC000481336319 896701011 /nfs/dbraw/zinc/70/10/11/896701011.db2.gz AQGJQEHAOSNYEQ-UHFFFAOYSA-N 0 3 411.934 4.337 20 0 HIADHN CN(C)C[C@H](NC(=O)Nc1ccc(OC(F)F)c2cccnc12)c1ccc(F)cc1 ZINC000481342012 896708825 /nfs/dbraw/zinc/70/88/25/896708825.db2.gz GYVAAZLOVCXMSP-KRWDZBQOSA-N 0 3 418.419 4.400 20 0 HIADHN Cc1nc(NC(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)ccc1Br ZINC000481343273 896711658 /nfs/dbraw/zinc/71/16/58/896711658.db2.gz QHVXKOGXTOUGQY-GOEBONIOSA-N 0 3 403.324 4.110 20 0 HIADHN CN(CCCN(C)C(=O)Nc1nnc(-c2cccc(Cl)c2)s1)Cc1ccco1 ZINC000481448131 896844878 /nfs/dbraw/zinc/84/48/78/896844878.db2.gz VWTAGUCDOOEIOA-UHFFFAOYSA-N 0 3 419.938 4.437 20 0 HIADHN COc1ccc([C@@H](CNC(=O)Nc2ccnn2[C@H](C)CC(C)C)N2CCCC2)cc1 ZINC000481452097 896848219 /nfs/dbraw/zinc/84/82/19/896848219.db2.gz SLMMOQZMIRTRKY-WIYYLYMNSA-N 0 3 413.566 4.457 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)c1ccnn1C1CCCC1 ZINC000481475396 896862127 /nfs/dbraw/zinc/86/21/27/896862127.db2.gz DBMRRBVUPGRFCV-UHFFFAOYSA-N 0 3 408.468 4.221 20 0 HIADHN C[C@@H](NC[C@@H](O)COc1cccc(Cl)c1Cl)c1cccc(N2CCCC2=O)c1 ZINC000481551314 896917680 /nfs/dbraw/zinc/91/76/80/896917680.db2.gz GHCVGFAPLAOLNN-RHSMWYFYSA-N 0 3 423.340 4.211 20 0 HIADHN CSc1ccc(CN[C@H](C)c2ccc(S(=O)(=O)NCc3ccco3)cc2)cc1 ZINC000481554601 896926136 /nfs/dbraw/zinc/92/61/36/896926136.db2.gz BREQUBVNOYAKCH-MRXNPFEDSA-N 0 3 416.568 4.331 20 0 HIADHN O=C(Nc1cccc(CN[C@H]2CCc3cc(Br)ccc32)c1)[C@@H]1CCCO1 ZINC000481569930 896947929 /nfs/dbraw/zinc/94/79/29/896947929.db2.gz KMCGVMAFLUNGEU-PMACEKPBSA-N 0 3 415.331 4.344 20 0 HIADHN CC[C@@H](NCc1ccc(-n2ccnc2C)c(F)c1)c1ccccc1OCC(=O)N(C)C ZINC000481579242 896959190 /nfs/dbraw/zinc/95/91/90/896959190.db2.gz HWRXSUIXKIJCQF-OAQYLSRUSA-N 0 3 424.520 4.028 20 0 HIADHN Cc1cc(C)n(-c2ccc(CN[C@@H]3CCCc4c3cnn4C)c(C(F)(F)F)c2)n1 ZINC000481579811 896959469 /nfs/dbraw/zinc/95/94/69/896959469.db2.gz WSTZSVSKAYKXDB-LJQANCHMSA-N 0 3 403.452 4.409 20 0 HIADHN Cc1csc(=O)n1CCN1CCC(COc2ccccc2C(F)(F)F)CC1 ZINC000481604586 896984320 /nfs/dbraw/zinc/98/43/20/896984320.db2.gz DFFYYDDMAQGHEH-UHFFFAOYSA-N 0 3 400.466 4.028 20 0 HIADHN OC1(Cc2ccc(F)cc2)CCN(Cc2ccc(OCc3ccncc3)cc2)CC1 ZINC000481609444 896991160 /nfs/dbraw/zinc/99/11/60/896991160.db2.gz GTDAUBMIGYGKDO-UHFFFAOYSA-N 0 3 406.501 4.369 20 0 HIADHN Cc1cc(NC(=O)c2ccc(C(F)(F)F)nc2C)cc(N2CCN(C(C)C)CC2)c1 ZINC000481661525 897045323 /nfs/dbraw/zinc/04/53/23/897045323.db2.gz LVRFKQYJUPPJNY-UHFFFAOYSA-N 0 3 420.479 4.500 20 0 HIADHN Cc1cc(NC(=O)c2cccc([C@H]3CCOC3)c2)cc(N2CCN(C(C)C)CC2)c1 ZINC000481669845 897053637 /nfs/dbraw/zinc/05/36/37/897053637.db2.gz NNRAXHDWBGQWRR-QFIPXVFZSA-N 0 3 407.558 4.282 20 0 HIADHN O=C(CCN1CCC[C@]2(C1)OCc1ccccc12)Nc1ccccc1Br ZINC000481700433 897088020 /nfs/dbraw/zinc/08/80/20/897088020.db2.gz WRDWNRBAPYGONK-OAQYLSRUSA-N 0 3 415.331 4.299 20 0 HIADHN COc1ccc([C@@H](C)N[C@@H](C)c2ccc(S(=O)(=O)NCc3ccco3)cc2)cc1 ZINC000481738584 897133041 /nfs/dbraw/zinc/13/30/41/897133041.db2.gz QVIMZPTWZGXKFE-SJORKVTESA-N 0 3 414.527 4.179 20 0 HIADHN CCc1ccc(-c2nc(CC(=O)N[C@@H]3CN(C)C[C@H]3c3ccccc3)cs2)cc1 ZINC000481753139 897144358 /nfs/dbraw/zinc/14/43/58/897144358.db2.gz GWTHRNYRYQKQFE-FCHUYYIVSA-N 0 3 405.567 4.129 20 0 HIADHN CC(C)C[C@H]1OCCC[C@@H]1NCC(=O)Nc1ccc(Br)cc1Cl ZINC000481760758 897148697 /nfs/dbraw/zinc/14/86/97/897148697.db2.gz KSPDBCUKMVKZGL-JKSUJKDBSA-N 0 3 403.748 4.224 20 0 HIADHN CC[C@@H](CN(CC)CC(=O)NCc1ccc(C(=O)N2CCCC2)cc1)c1ccccc1 ZINC000481769458 897155438 /nfs/dbraw/zinc/15/54/38/897155438.db2.gz TVHUYEBKXNKWIN-QFIPXVFZSA-N 0 3 421.585 4.055 20 0 HIADHN COc1ccc(COC[C@H](O)CN2CC=C(c3cccc(Cl)c3)CC2)cc1OC ZINC000481781287 897163929 /nfs/dbraw/zinc/16/39/29/897163929.db2.gz BTFVZQXTWAGCJU-OAQYLSRUSA-N 0 3 417.933 4.024 20 0 HIADHN CC(C)[C@@]1(C)C[C@@H]1C(=O)NC1CCN(CCOc2ccc(Br)cc2)CC1 ZINC000481803111 897180636 /nfs/dbraw/zinc/18/06/36/897180636.db2.gz DYFOGQMLIDCRLK-TZIWHRDSSA-N 0 3 423.395 4.091 20 0 HIADHN COC(=O)C1(c2ccccc2)CCN(Cc2cc(-c3ccncc3)ccc2OC)CC1 ZINC000481903433 897283302 /nfs/dbraw/zinc/28/33/02/897283302.db2.gz IWLOIDWDLUIVIY-UHFFFAOYSA-N 0 3 416.521 4.464 20 0 HIADHN COC(=O)c1ccc(-c2ccc(CN3CCC(c4nnc5ccccn54)CC3)o2)cc1 ZINC000481907544 897289512 /nfs/dbraw/zinc/28/95/12/897289512.db2.gz IJKUZTCXXZWUJW-UHFFFAOYSA-N 0 3 416.481 4.156 20 0 HIADHN C[C@H]1CCCN(S(=O)(=O)c2ccc(CN[C@H](c3cccnc3)C3CCC3)cc2)C1 ZINC000481915635 897299024 /nfs/dbraw/zinc/29/90/24/897299024.db2.gz MSAZHHBFDJFROV-MBSDFSHPSA-N 0 3 413.587 4.133 20 0 HIADHN CC1(C)CC[C@H](NCc2cccc(NC(=O)CCN3CCOCC3)c2)c2ccccc21 ZINC000481917111 897300074 /nfs/dbraw/zinc/30/00/74/897300074.db2.gz PHGZKOAAVVBXPW-DEOSSOPVSA-N 0 3 421.585 4.250 20 0 HIADHN COc1ccc(-c2ccncc2)cc1CN1CCC(C(=O)N2CCC[C@H](C)C2)CC1 ZINC000481918712 897302172 /nfs/dbraw/zinc/30/21/72/897302172.db2.gz RPZDJMRZYCOHHC-IBGZPJMESA-N 0 3 407.558 4.228 20 0 HIADHN CC1(C)CC[C@@H](NCC2(S(C)(=O)=O)CCC2)c2cc(Br)ccc21 ZINC000481992976 897387864 /nfs/dbraw/zinc/38/78/64/897387864.db2.gz QISDJHGOTHWBCB-MRXNPFEDSA-N 0 3 400.382 4.119 20 0 HIADHN O=C1C[C@@H](N[C@@H](c2cccnc2)C2CCC2)CN1Cc1ccccc1C(F)(F)F ZINC000481992031 897388646 /nfs/dbraw/zinc/38/86/46/897388646.db2.gz MWYUWZGXJHPJNE-WIYYLYMNSA-N 0 3 403.448 4.332 20 0 HIADHN CCN(CC)C(=O)Nc1ccc([C@H](C)N[C@H]2CC(=O)N(c3cccc(OC)c3)C2)cc1 ZINC000482032003 897443288 /nfs/dbraw/zinc/44/32/88/897443288.db2.gz ZMPMELJYWSDHFN-PXNSSMCTSA-N 0 3 424.545 4.025 20 0 HIADHN Cn1c2ccccc2nc1[C@H](NC1CCN(Cc2cccnc2)CC1)c1ccccc1 ZINC000482037123 897452795 /nfs/dbraw/zinc/45/27/95/897452795.db2.gz WMXHWXGGROHPKL-RUZDIDTESA-N 0 3 411.553 4.312 20 0 HIADHN CC1(C)CN(C(=O)CCCN2CCN(c3ccccc3)CC2)CC[C@@H]1C(F)(F)F ZINC000482048455 897472432 /nfs/dbraw/zinc/47/24/32/897472432.db2.gz NOHSCZCPKCBEGU-IBGZPJMESA-N 0 3 411.512 4.026 20 0 HIADHN CO[C@H](C)c1nc(C)c(C(=O)Nc2cc(C)cc(N3CCN(C(C)C)CC3)c2)s1 ZINC000482054748 897481585 /nfs/dbraw/zinc/48/15/85/897481585.db2.gz JPLOIHMFVDGCFV-QGZVFWFLSA-N 0 3 416.591 4.250 20 0 HIADHN Cc1nc(-c2ccccc2)sc1[C@@H](C)NCc1ccc([C@@]2(C)NC(=O)NC2=O)cc1 ZINC000482073195 897508883 /nfs/dbraw/zinc/50/88/83/897508883.db2.gz JRVPAZWZHIVYSY-QKFKETGDSA-N 0 3 420.538 4.024 20 0 HIADHN COc1ccc([C@H](C)NCc2ccc(NC(=O)c3cccnc3)cc2)cc1NC(C)=O ZINC000482110937 897561784 /nfs/dbraw/zinc/56/17/84/897561784.db2.gz BGDCOHGXGNNIEQ-INIZCTEOSA-N 0 3 418.497 4.152 20 0 HIADHN CCO[C@@H]1C[C@H](NCC(=O)Nc2c(C)nn(-c3ccc(C)cc3)c2C)C1(CC)CC ZINC000482148401 897610780 /nfs/dbraw/zinc/61/07/80/897610780.db2.gz LAHMHHZJERRENS-LEWJYISDSA-N 0 3 412.578 4.309 20 0 HIADHN COc1ccc(OC)c(-c2nn(-c3ccccc3)cc2CN(C)C[C@@H]2CCCO2)c1 ZINC000482288613 897783223 /nfs/dbraw/zinc/78/32/23/897783223.db2.gz KZDDJRNZNHYYKS-NRFANRHFSA-N 0 3 407.514 4.167 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)N[C@H](c1ccc(Cl)cc1)C(F)(F)F ZINC000482327369 897829234 /nfs/dbraw/zinc/82/92/34/897829234.db2.gz PFWSTONKYBSDCP-QGZVFWFLSA-N 0 3 414.859 4.112 20 0 HIADHN CN(C)C[C@H](NC(=O)Nc1c(F)cc(F)cc1Br)c1ccc(F)cc1 ZINC000482331211 897835634 /nfs/dbraw/zinc/83/56/34/897835634.db2.gz FWALHAOTEUUPJC-HNNXBMFYSA-N 0 3 416.241 4.291 20 0 HIADHN Cc1[nH]c2c(cc(C)cc2CN[C@H](C)c2cccc(N3CCCS3(=O)=O)c2)c1C ZINC000482336818 897843233 /nfs/dbraw/zinc/84/32/33/897843233.db2.gz STFRPWAMEOYRLS-GOSISDBHSA-N 0 3 411.571 4.484 20 0 HIADHN COc1ccc([C@H](NC(=O)N(CCN(C)C)Cc2ccccc2)C(F)(F)F)cc1 ZINC000482362342 897880936 /nfs/dbraw/zinc/88/09/36/897880936.db2.gz TUQBRVAKAHTQBK-IBGZPJMESA-N 0 3 409.452 4.072 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)Nc1cc(C(=O)OC)ccc1C(C)C)c1ccco1 ZINC000482425845 897979007 /nfs/dbraw/zinc/97/90/07/897979007.db2.gz YBLYYSNRMWZAFI-BEFAXECRSA-N 0 3 401.507 4.441 20 0 HIADHN O=C(N[C@H](c1ccc(OC(F)F)cc1)C(F)(F)F)N1CCN(C2CCCC2)CC1 ZINC000482438306 897998304 /nfs/dbraw/zinc/99/83/04/897998304.db2.gz PTHGLCKWLVUAAU-MRXNPFEDSA-N 0 3 421.410 4.161 20 0 HIADHN C[C@@H](C1CC1)n1nccc1NC(=O)N(CCN(C)C)Cc1ccc(C(F)(F)F)cc1 ZINC000482442369 898003471 /nfs/dbraw/zinc/00/34/71/898003471.db2.gz WXTJMCDSLQGPFC-HNNXBMFYSA-N 0 3 423.483 4.469 20 0 HIADHN CCC[C@@H](NCc1cccnc1N1CCC(C(N)=O)CC1)c1ccc(Cl)cc1 ZINC000482445718 898009118 /nfs/dbraw/zinc/00/91/18/898009118.db2.gz OWCWKTWJGROGBJ-HXUWFJFHSA-N 0 3 400.954 4.068 20 0 HIADHN CCN(Cc1c(C)nn(C)c1N1CCOCC1)[C@@H](C)Cc1ccccc1C(F)(F)F ZINC000482461478 898033949 /nfs/dbraw/zinc/03/39/49/898033949.db2.gz SLGOJLPPKDQYJI-INIZCTEOSA-N 0 3 424.511 4.037 20 0 HIADHN Cc1c([C@@H](C)N[C@H](C)Cc2ccc(O)cc2)nnn1-c1cccc(Br)c1 ZINC000482502462 898084738 /nfs/dbraw/zinc/08/47/38/898084738.db2.gz COLPWRPWELMXRO-ZIAGYGMSSA-N 0 3 415.335 4.326 20 0 HIADHN COc1ccc(-c2ccncc2)cc1CN1CCC(O)(Cc2cccc(F)c2)CC1 ZINC000482522543 898110123 /nfs/dbraw/zinc/11/01/23/898110123.db2.gz JPZRDHOHZNMXST-UHFFFAOYSA-N 0 3 406.501 4.466 20 0 HIADHN COCCN(C)CCOc1cccc(CNC(=O)Nc2ccc3occ(C)c3c2)c1 ZINC000482540072 898128189 /nfs/dbraw/zinc/12/81/89/898128189.db2.gz DRROVUNCLQRDRD-UHFFFAOYSA-N 0 3 411.502 4.020 20 0 HIADHN COCCOc1ccc([C@@H](C)N[C@@H](C)c2cc(F)ccc2N2CCN(C)CC2)cc1 ZINC000482564865 898156314 /nfs/dbraw/zinc/15/63/14/898156314.db2.gz LXHJNKWRSACURB-MOPGFXCFSA-N 0 3 415.553 4.015 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@H](C)N[C@H](C)c2ccc(OC)cc2OC)CC1 ZINC000482570412 898165358 /nfs/dbraw/zinc/16/53/58/898165358.db2.gz WNNIAMORQMADQT-MSOLQXFVSA-N 0 3 415.553 4.397 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1 ZINC000482586802 898183782 /nfs/dbraw/zinc/18/37/82/898183782.db2.gz MXKBQMSJUBFINB-DEOSSOPVSA-N 0 3 415.537 4.036 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)c1cc(N2CCCC2=O)cc(C(F)(F)F)c1 ZINC000482588890 898187668 /nfs/dbraw/zinc/18/76/68/898187668.db2.gz XLJDTYPIEQXUHY-UHFFFAOYSA-N 0 3 419.447 4.455 20 0 HIADHN CCn1c(SCC(=O)Nc2cc(CN(C)C)ccc2C)nnc1-c1cccc(C)c1 ZINC000482597414 898198530 /nfs/dbraw/zinc/19/85/30/898198530.db2.gz KLTXLLMOFCSCMZ-UHFFFAOYSA-N 0 3 423.586 4.374 20 0 HIADHN CCCOc1cn(-c2ccccc2)nc1C(=O)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000482607200 898207281 /nfs/dbraw/zinc/20/72/81/898207281.db2.gz RFEOWDXERBJGKP-QFIPXVFZSA-N 0 3 418.541 4.228 20 0 HIADHN Cc1noc2nc(C(C)C)cc(C(=O)NCC3(N4CCSCC4)CCCCC3)c12 ZINC000482703472 898303712 /nfs/dbraw/zinc/30/37/12/898303712.db2.gz CJGBWQCSFCTTPN-UHFFFAOYSA-N 0 3 416.591 4.136 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)NCc1ccc(Br)s1)c1ccco1 ZINC000482705680 898305454 /nfs/dbraw/zinc/30/54/54/898305454.db2.gz IDYAJLRPUHBFCZ-AAEUAGOBSA-N 0 3 400.342 4.032 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)NCc1ccc(Br)s1)c1ccco1 ZINC000482705682 898305644 /nfs/dbraw/zinc/30/56/44/898305644.db2.gz IDYAJLRPUHBFCZ-WCQYABFASA-N 0 3 400.342 4.032 20 0 HIADHN CCCCn1ncc(NC(=O)c2ccc(CN3CCC(CO)CC3)cc2)c1C(C)C ZINC000482722234 898324458 /nfs/dbraw/zinc/32/44/58/898324458.db2.gz LKDAEZKMICEPSV-UHFFFAOYSA-N 0 3 412.578 4.263 20 0 HIADHN CN1C(=O)C[C@@H](NCc2ccc(OCc3ccncc3)cc2)[C@H]1c1ccc(F)c(F)c1 ZINC000482727420 898328959 /nfs/dbraw/zinc/32/89/59/898328959.db2.gz XJURCXNLTOXCLF-ISKFKSNPSA-N 0 3 423.463 4.000 20 0 HIADHN CCSc1ccc(CC(=O)NC2CCN(CCOc3ccc(F)cc3)CC2)cc1 ZINC000505548794 914250442 /nfs/dbraw/zinc/25/04/42/914250442.db2.gz FRUKZPKXQCXJGN-UHFFFAOYSA-N 0 3 416.562 4.140 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCCC1)c1ccc(Oc2cccnc2)cc1 ZINC000482846741 898458434 /nfs/dbraw/zinc/45/84/34/898458434.db2.gz CCSCYCHBOSFRKE-UHFFFAOYSA-N 0 3 411.571 4.355 20 0 HIADHN COc1ccccc1Oc1ccc(CN[C@@H](C)c2ccc(-n3cnnn3)cc2)cc1 ZINC000482896157 898515184 /nfs/dbraw/zinc/51/51/84/898515184.db2.gz ZDWYRHMVIIDNKU-KRWDZBQOSA-N 0 3 401.470 4.314 20 0 HIADHN COc1ccc([C@@H](C)NCc2cccc(COC3CCOCC3)c2)cc1NC(C)=O ZINC000482907781 898526199 /nfs/dbraw/zinc/52/61/99/898526199.db2.gz YWSFSUJFYKOIPW-QGZVFWFLSA-N 0 3 412.530 4.200 20 0 HIADHN Cc1cccc(CC2(O)CCN(C[C@H](O)COc3c(Cl)cccc3Cl)CC2)c1 ZINC000482933417 898555197 /nfs/dbraw/zinc/55/51/97/898555197.db2.gz CWBPKBPCUBZAGG-SFHVURJKSA-N 0 3 424.368 4.111 20 0 HIADHN CCN(CC)C(=O)c1ccc(NC(=O)N2CCN(C3CCCCC3)CC2)cc1Cl ZINC000483030773 898694492 /nfs/dbraw/zinc/69/44/92/898694492.db2.gz WORPWZLITZMZGF-UHFFFAOYSA-N 0 3 420.985 4.304 20 0 HIADHN CC(C)c1ccc(NC(=O)N2CC[C@@H](N3CCN(C)CC3)[C@H](C)C2)c(C(C)C)c1 ZINC000483040010 898708119 /nfs/dbraw/zinc/70/81/19/898708119.db2.gz KMHBJQLPYULGCR-AUSIDOKSSA-N 0 3 400.611 4.423 20 0 HIADHN CC(C)C[C@](C)(NCC(=O)N(C)c1nccs1)c1cccc(Br)c1 ZINC000483048330 898719129 /nfs/dbraw/zinc/71/91/29/898719129.db2.gz HQOCKAMYURSIII-SFHVURJKSA-N 0 3 410.381 4.420 20 0 HIADHN Cc1ccccc1[C@@H](N[C@H](C)c1cccc(S(=O)(=O)N2CCOCC2)c1)C(C)C ZINC000483117028 898805602 /nfs/dbraw/zinc/80/56/02/898805602.db2.gz WVOIDOLKEHWULU-XXBNENTESA-N 0 3 416.587 4.064 20 0 HIADHN C[C@H](NC(=O)[C@@H]1CCn2c(cnc2C2CCCCC2)C1)[C@H](c1ccccc1)N(C)C ZINC000505580460 914287736 /nfs/dbraw/zinc/28/77/36/914287736.db2.gz GQTGZYXWGQUTPO-QTGUNEKASA-N 0 3 408.590 4.301 20 0 HIADHN Brc1ccc2c(c1)[C@H](NCc1cccc(-n3cncn3)c1)CCS2 ZINC000483174995 898841323 /nfs/dbraw/zinc/84/13/23/898841323.db2.gz SPQCVTIWCBESJH-QGZVFWFLSA-N 0 3 401.333 4.357 20 0 HIADHN Cc1c2ccccc2oc1[C@@H](NC(=O)C(=O)Nc1cccc(CN(C)C)c1)C(C)C ZINC000483256525 898897459 /nfs/dbraw/zinc/89/74/59/898897459.db2.gz ICKFWNLIWJXITE-NRFANRHFSA-N 0 3 407.514 4.255 20 0 HIADHN O=C(Nc1ccc(OCc2ccccn2)c(F)c1)N1CCN(C2CCCCC2)CC1 ZINC000483286578 898923568 /nfs/dbraw/zinc/92/35/68/898923568.db2.gz OYQZZZVVIYEXDF-UHFFFAOYSA-N 0 3 412.509 4.282 20 0 HIADHN Cc1cc(N2CCSCC2)ccc1NC(=O)N1CCN(C2CCCCC2)CC1 ZINC000483361196 898998845 /nfs/dbraw/zinc/99/88/45/898998845.db2.gz VQASTXJYFJFZKO-UHFFFAOYSA-N 0 3 402.608 4.030 20 0 HIADHN CC(C)n1ncc2c1nc(C1CC1)cc2C(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C ZINC000505601210 914306384 /nfs/dbraw/zinc/30/63/84/914306384.db2.gz CSQLAMZMTHADRL-KSFYIVLOSA-N 0 3 405.546 4.311 20 0 HIADHN CC(C)n1ncc2c1nc(C1CC1)cc2C(=O)N[C@H](C)[C@@H](c1ccccc1)N(C)C ZINC000505601212 914306591 /nfs/dbraw/zinc/30/65/91/914306591.db2.gz CSQLAMZMTHADRL-ZHRRBRCNSA-N 0 3 405.546 4.311 20 0 HIADHN CS[C@@H]1CN(C(=O)c2sc(-c3ccc(F)c(F)c3)nc2C)C[C@@H]1N1CCCC1 ZINC000483393967 899028420 /nfs/dbraw/zinc/02/84/20/899028420.db2.gz IPBIBSVDSBDPMG-DLBZAZTESA-N 0 3 423.554 4.049 20 0 HIADHN CS[C@@H]1CN(C(=O)CCC(=O)c2cc(Cl)sc2Cl)C[C@H]1N1CCCC1 ZINC000483394633 899028921 /nfs/dbraw/zinc/02/89/21/899028921.db2.gz NURUZNRCVQNAOF-TZMCWYRMSA-N 0 3 421.415 4.056 20 0 HIADHN CCOc1cc(CN2CCSCC[C@@H]2C)ccc1OCC(=O)N(C(C)C)C(C)C ZINC000483411050 899040025 /nfs/dbraw/zinc/04/00/25/899040025.db2.gz ANUOEUUVUBBCBU-IBGZPJMESA-N 0 3 422.635 4.437 20 0 HIADHN CCOc1cc(CN2CCSCC[C@H]2C)ccc1OCC(=O)Nc1ccccc1 ZINC000483423994 899052933 /nfs/dbraw/zinc/05/29/33/899052933.db2.gz BXCRHAYBQLIHMG-GOSISDBHSA-N 0 3 414.571 4.430 20 0 HIADHN CCS[C@H]1CCC[C@H](NC(=O)Nc2ccc(N3CCN(CC)CC3)cc2C)C1 ZINC000483435962 899068717 /nfs/dbraw/zinc/06/87/17/899068717.db2.gz BWUCYWYPQCMCAD-ICSRJNTNSA-N 0 3 404.624 4.323 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1c[nH]c(C(F)(F)F)c1 ZINC000483465894 899106653 /nfs/dbraw/zinc/10/66/53/899106653.db2.gz DOJBYDPDPSVRPP-KRWDZBQOSA-N 0 3 417.435 4.238 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3ccc(OC4CCC4)c(F)c3)CC2)C[C@H](C)O1 ZINC000483513421 899175359 /nfs/dbraw/zinc/17/53/59/899175359.db2.gz OHCGWPKHEWJVJW-CALCHBBNSA-N 0 3 419.541 4.110 20 0 HIADHN Cc1ccccc1[C@H](NC(=O)N1CCC(CN2C[C@H](C)O[C@@H](C)C2)CC1)C(C)C ZINC000483601846 899253374 /nfs/dbraw/zinc/25/33/74/899253374.db2.gz OWVQPFYXHHNMGM-SXWKCWPCSA-N 0 3 401.595 4.223 20 0 HIADHN CC(C)C(=O)Nc1cccc(NC(=O)[C@H]2CN(Cc3ccccc3)CCC2(F)F)c1 ZINC000505632437 914332427 /nfs/dbraw/zinc/33/24/27/914332427.db2.gz JRRIZOFCFSQFBN-HXUWFJFHSA-N 0 3 415.484 4.377 20 0 HIADHN CCCN(CCC)C(=O)c1cccc(C(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)c1 ZINC000505634004 914334244 /nfs/dbraw/zinc/33/42/44/914334244.db2.gz QGMXMXMTGQXMOW-WMZHIEFXSA-N 0 3 409.574 4.370 20 0 HIADHN COc1ccc2[nH]c3c(c2c1)C[C@H](N[C@H](C)c1nc(-c2cccc(OC)c2)no1)CC3 ZINC000483655336 899314304 /nfs/dbraw/zinc/31/43/04/899314304.db2.gz PRPACZLYFXTRNT-GDBMZVCRSA-N 0 3 418.497 4.443 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2ccc(OC(C)C)cc2F)c1 ZINC000483678633 899338209 /nfs/dbraw/zinc/33/82/09/899338209.db2.gz CYVZLFSZYZOGPD-UHFFFAOYSA-N 0 3 403.498 4.217 20 0 HIADHN CN(C)CCN(C(=O)c1cc(-c2ccc(F)cc2)nc2onc(C3CC3)c21)C1CC1 ZINC000505653968 914351720 /nfs/dbraw/zinc/35/17/20/914351720.db2.gz ALXGDODYMZWMHF-UHFFFAOYSA-N 0 3 408.477 4.073 20 0 HIADHN CC[C@H](N[C@@H](C)c1cccc(-n2ccnc2)c1)c1ccccc1OCC(=O)N(C)C ZINC000483816104 899494542 /nfs/dbraw/zinc/49/45/42/899494542.db2.gz DMBSNGYKMYTMJZ-AVRDEDQJSA-N 0 3 406.530 4.141 20 0 HIADHN Cc1ccc(NC(=O)Cn2c3ccccc3nc2-c2cscn2)c(CN(C)C)c1 ZINC000505663031 914360975 /nfs/dbraw/zinc/36/09/75/914360975.db2.gz QMPOVEQELKPLRQ-UHFFFAOYSA-N 0 3 405.527 4.169 20 0 HIADHN C[C@H](NCc1ccc(-c2cccnc2)cc1)c1cccc(N2CCCS2(=O)=O)c1 ZINC000483844666 899524575 /nfs/dbraw/zinc/52/45/75/899524575.db2.gz ALBJIEOHSUPHAU-SFHVURJKSA-N 0 3 407.539 4.139 20 0 HIADHN CC[C@@H]1Oc2cc([C@H](C)N[C@@H](C)c3ccc4c(c3)C(C)(C)C(=O)N4)ccc2NC1=O ZINC000483857133 899541188 /nfs/dbraw/zinc/54/11/88/899541188.db2.gz JZZYGRDMNOTLQQ-YRVVQQKDSA-N 0 3 407.514 4.438 20 0 HIADHN C[C@@H](NCCc1nc(C(F)(F)F)cs1)c1ccc(-n2cncn2)cc1Cl ZINC000483867904 899549345 /nfs/dbraw/zinc/54/93/45/899549345.db2.gz LVOCEPRLNDCITN-SNVBAGLBSA-N 0 3 401.845 4.289 20 0 HIADHN Cc1ccc(F)cc1-c1nnc(NC(=O)N[C@H](CN(C)C)c2ccc(F)cc2)s1 ZINC000483917543 899584097 /nfs/dbraw/zinc/58/40/97/899584097.db2.gz QTACKZGGUGNFMM-QGZVFWFLSA-N 0 3 417.485 4.216 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N[C@H](c1ccc(Cl)cc1)[C@H]1C[C@H]1C ZINC000483978362 899621094 /nfs/dbraw/zinc/62/10/94/899621094.db2.gz KOFPPYQSIPQTII-MFMILTCTSA-N 0 3 413.949 4.162 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)NC[C@@H]1CCCC[C@@H]1C(F)(F)F ZINC000484048929 899680190 /nfs/dbraw/zinc/68/01/90/899680190.db2.gz VZVMJLUVDRJEMN-HOTGVXAUSA-N 0 3 421.454 4.407 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2cccc(-c3ncc(C)o3)c2)c1 ZINC000484100481 899727932 /nfs/dbraw/zinc/72/79/32/899727932.db2.gz CZIUTRPUJSJMCW-UHFFFAOYSA-N 0 3 408.502 4.254 20 0 HIADHN O=C(Nc1nnc(/C=C\c2ccco2)s1)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000484160653 899780941 /nfs/dbraw/zinc/78/09/41/899780941.db2.gz HIBUZEFABRFXGK-LENZSSGSSA-N 0 3 409.515 4.260 20 0 HIADHN CSc1cccc(N(C(=O)c2cc(C)nc3n[nH]c(C)c32)C2CCN(C)CC2)c1 ZINC000484282194 899849951 /nfs/dbraw/zinc/84/99/51/899849951.db2.gz JTLOBRPBZWUMKB-UHFFFAOYSA-N 0 3 409.559 4.038 20 0 HIADHN CSc1cccc(N(C(=O)c2cc(-c3cccnc3)on2)C2CCN(C)CC2)c1 ZINC000484287936 899854404 /nfs/dbraw/zinc/85/44/04/899854404.db2.gz WSGKPDSSVCAVDE-UHFFFAOYSA-N 0 3 408.527 4.200 20 0 HIADHN CSc1cccc(N(C(=O)c2cc3c(s2)CCOC3)C2CCN(C)CC2)c1 ZINC000484297395 899860390 /nfs/dbraw/zinc/86/03/90/899860390.db2.gz QCZPCFMIPIZEAH-UHFFFAOYSA-N 0 3 402.585 4.284 20 0 HIADHN Cc1ccc(CN[C@H](C)c2ccc(NC(=O)NC(C)C)cc2)c(N2CCOCC2)c1 ZINC000484301406 899863925 /nfs/dbraw/zinc/86/39/25/899863925.db2.gz NFZJDZZENXBZBB-LJQANCHMSA-N 0 3 410.562 4.212 20 0 HIADHN CSc1cccc(N(C(=O)[C@H](C)Oc2ccccc2F)C2CCN(C)CC2)c1 ZINC000484397898 899925018 /nfs/dbraw/zinc/92/50/18/899925018.db2.gz ASNJYRZBOHONDW-INIZCTEOSA-N 0 3 402.535 4.442 20 0 HIADHN COc1ccc(C(=O)N(c2cccc(SC)c2)C2CCN(C)CC2)c(OC)c1 ZINC000484401563 899927267 /nfs/dbraw/zinc/92/72/67/899927267.db2.gz IEHFTXLJWPKOMJ-UHFFFAOYSA-N 0 3 400.544 4.167 20 0 HIADHN COc1cccc(C(=O)N(c2cccc(SC)c2)C2CCN(C)CC2)c1OC ZINC000484405488 899928829 /nfs/dbraw/zinc/92/88/29/899928829.db2.gz ONCSNMWXWLBKMY-UHFFFAOYSA-N 0 3 400.544 4.167 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2ccnc(-c3ccccc3)c2)c1 ZINC000484470601 899963515 /nfs/dbraw/zinc/96/35/15/899963515.db2.gz GSWYUNALHQOACG-UHFFFAOYSA-N 0 3 404.514 4.353 20 0 HIADHN CC[C@H](C)n1ncc(NC(=O)N(CCN(C)C)Cc2cccc(OC)c2)c1C1CC1 ZINC000484471257 899964769 /nfs/dbraw/zinc/96/47/69/899964769.db2.gz HRTHEMLNDXBNTG-KRWDZBQOSA-N 0 3 413.566 4.336 20 0 HIADHN COc1cc(Cl)c(C)cc1NC(=O)CCN[C@@H](C)c1cccc(NC(C)=O)c1 ZINC000484481621 899974652 /nfs/dbraw/zinc/97/46/52/899974652.db2.gz WQIYYAYKWZVQTK-AWEZNQCLSA-N 0 3 403.910 4.295 20 0 HIADHN COc1ccc([C@@H](C)NCCC(=O)Nc2cc(C)c(Cl)cc2OC)c(OC)c1 ZINC000484491052 899982958 /nfs/dbraw/zinc/98/29/58/899982958.db2.gz ILJXSFBNEJSVQP-CQSZACIVSA-N 0 3 406.910 4.354 20 0 HIADHN C[C@H](N[C@@H]1CCN(C(=O)CCc2ccccc2)C1)c1ccc(Br)s1 ZINC000484504530 899994916 /nfs/dbraw/zinc/99/49/16/899994916.db2.gz OFSNXHKDAMYOQA-GOEBONIOSA-N 0 3 407.377 4.395 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2ccc(OC3CCC3)c(F)c2)c1 ZINC000484520784 900009388 /nfs/dbraw/zinc/00/93/88/900009388.db2.gz UWJITNFSEPUSRJ-UHFFFAOYSA-N 0 3 415.509 4.361 20 0 HIADHN Cc1nn(C)c(=O)c(-c2nc(CN[C@H]3CCCC[C@H]3c3ccccc3)cs2)c1C ZINC000484640911 900087932 /nfs/dbraw/zinc/08/79/32/900087932.db2.gz AANMJHHTMIZJOJ-PMACEKPBSA-N 0 3 408.571 4.337 20 0 HIADHN Cc1nn(C)c(=O)c(-c2nc(CN[C@@H]3CCCC[C@H]3c3ccccc3)cs2)c1C ZINC000484640917 900088300 /nfs/dbraw/zinc/08/83/00/900088300.db2.gz AANMJHHTMIZJOJ-VQTJNVASSA-N 0 3 408.571 4.337 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N2C[C@H](c3ccccc3)[C@H]3COCC[C@H]32)C1 ZINC000484693511 900130710 /nfs/dbraw/zinc/13/07/10/900130710.db2.gz GCEBSNOMRGENID-BHEUDDMMSA-N 0 3 419.569 4.036 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)NC2CCN(c3ccccc3)CC2)N(C)C)cc1 ZINC000484694996 900131236 /nfs/dbraw/zinc/13/12/36/900131236.db2.gz RCHVAGTVHLMHKE-DEOSSOPVSA-N 0 3 424.589 4.045 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)NCc1ccc(F)cc1Br)c1ccco1 ZINC000484721018 900151703 /nfs/dbraw/zinc/15/17/03/900151703.db2.gz WQXJSSOCDPCQBZ-LRDDRELGSA-N 0 3 412.303 4.110 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)NCc1ccc(F)cc1Br)c1ccco1 ZINC000484721020 900151716 /nfs/dbraw/zinc/15/17/16/900151716.db2.gz WQXJSSOCDPCQBZ-WBMJQRKESA-N 0 3 412.303 4.110 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2cccc(C)c2Br)c1 ZINC000484788412 900196346 /nfs/dbraw/zinc/19/63/46/900196346.db2.gz YENYAAWGATZHEL-UHFFFAOYSA-N 0 3 420.351 4.362 20 0 HIADHN Cc1ccc(-n2ncc(NC(=O)N(CCN(C)C)Cc3ccccn3)c2C(C)C)cc1 ZINC000484836420 900237693 /nfs/dbraw/zinc/23/76/93/900237693.db2.gz QUNBKJCJAOYQQW-UHFFFAOYSA-N 0 3 420.561 4.295 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCCC1)c1cccn1Cc1cccs1 ZINC000484891661 900275445 /nfs/dbraw/zinc/27/54/45/900275445.db2.gz RAZOKKTVYHSTEM-UHFFFAOYSA-N 0 3 403.617 4.079 20 0 HIADHN CCOc1cc(CN2CCC[C@@H](c3ccccc3)CC2)nc2nc(C(F)(F)F)nn21 ZINC000485085001 900400065 /nfs/dbraw/zinc/40/00/65/900400065.db2.gz JQTXGHLPJKYMDE-MRXNPFEDSA-N 0 3 419.451 4.312 20 0 HIADHN CC[C@H](C)NC(=O)[C@@H]1C[C@H](C)N(Cc2csc(N(C)C3CC3)n2)[C@H]2CCCC[C@@H]12 ZINC000485091339 900402994 /nfs/dbraw/zinc/40/29/94/900402994.db2.gz FYPMJIJERHKCFS-WYZBVHOTSA-N 0 3 418.651 4.426 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1cccc(Cl)c1Br ZINC000485262904 900546017 /nfs/dbraw/zinc/54/60/17/900546017.db2.gz RWFXMKQSFFPSHV-UHFFFAOYSA-N 0 3 400.704 4.291 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2cc(F)c(Cl)cc2F)cc1)[C@@H]1CCCN(C)C1 ZINC000485280285 900558264 /nfs/dbraw/zinc/55/82/64/900558264.db2.gz CELIPHXMAYPAMX-OAHLLOKOSA-N 0 3 421.875 4.037 20 0 HIADHN C[C@H](NC(=O)N1CCN(C2CCCCC2)CC1)c1nc2ccccc2n1C(F)F ZINC000485299757 900579200 /nfs/dbraw/zinc/57/92/00/900579200.db2.gz PZQQVVHBORCPPL-HNNXBMFYSA-N 0 3 405.493 4.152 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)Nc3cccc(Oc4ccncc4)c3)CC2)C[C@H](C)O1 ZINC000485317047 900596506 /nfs/dbraw/zinc/59/65/06/900596506.db2.gz JFWZTUMSYHCEQL-OALUTQOASA-N 0 3 424.545 4.227 20 0 HIADHN CCc1c(NC(=O)N2CC[C@H]3CCN(C)C[C@@H]32)cnn1-c1cccc(C(F)(F)F)c1 ZINC000485319137 900598755 /nfs/dbraw/zinc/59/87/55/900598755.db2.gz GRCONVSMBNAGDY-KUHUBIRLSA-N 0 3 421.467 4.011 20 0 HIADHN O=C(Cc1cnc2ccccc2c1)NC1CCN(CCOc2ccc(Cl)cc2)CC1 ZINC000485406743 900705678 /nfs/dbraw/zinc/70/56/78/900705678.db2.gz CXOFYNFZDNSURT-UHFFFAOYSA-N 0 3 423.944 4.090 20 0 HIADHN COC(=O)c1cc(NC(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)cc(Cl)c1F ZINC000485412631 900710883 /nfs/dbraw/zinc/71/08/83/900710883.db2.gz SWXGAVYQADWJBZ-INIZCTEOSA-N 0 3 419.884 4.004 20 0 HIADHN Cc1ccc(S(=O)(=O)[N-]c2ccc(NC(=O)c3ccccc3C[NH+](C)C)cc2)cc1 ZINC000485422002 900720221 /nfs/dbraw/zinc/72/02/21/900720221.db2.gz NIBXYLWGYPJGGZ-UHFFFAOYSA-N 0 3 423.538 4.110 20 0 HIADHN COc1ccc2ccccc2c1-c1cc(CNC(=O)[C@H](C)N2[C@@H](C)CC[C@@H]2C)on1 ZINC000485433676 900731044 /nfs/dbraw/zinc/73/10/44/900731044.db2.gz RFOXEVFDJRJRDQ-ULQDDVLXSA-N 0 3 407.514 4.381 20 0 HIADHN O=C(N[C@H](c1ccccc1)c1ccc(Br)cc1)N1CCN2CCC1CC2 ZINC000485437828 900735656 /nfs/dbraw/zinc/73/56/56/900735656.db2.gz OYTPSDBWCCIJQY-HXUWFJFHSA-N 0 3 414.347 4.028 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@H]1CCCc2c[nH]nc21)c1ccc(C(F)(F)F)cc1 ZINC000485613327 900871118 /nfs/dbraw/zinc/87/11/18/900871118.db2.gz LSONQVLRLMUVQH-ZWKOTPCHSA-N 0 3 423.483 4.188 20 0 HIADHN CN(C)Cc1ccccc1C(=O)Nc1ccc(C(=O)NCc2ccccc2F)cc1 ZINC000485784181 901039103 /nfs/dbraw/zinc/03/91/03/901039103.db2.gz MWXKQVKQAQPDML-UHFFFAOYSA-N 0 3 405.473 4.070 20 0 HIADHN CCCN(Cc1nc2ccc(Br)cc2n1C)[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC000485819381 901067692 /nfs/dbraw/zinc/06/76/92/901067692.db2.gz XKMSURCPGAREPV-KYNGSXCRSA-N 0 3 406.368 4.361 20 0 HIADHN CN(C)Cc1ccccc1C(=O)Nc1ccc(CC(=O)N(C)c2ccccc2)cc1 ZINC000485976375 901193477 /nfs/dbraw/zinc/19/34/77/901193477.db2.gz JFZQZMWRSROFKT-UHFFFAOYSA-N 0 3 401.510 4.206 20 0 HIADHN CCc1ccc(-c2noc([C@H](C)NC(=O)N3CCN(C4CCCCC4)CC3)n2)cc1 ZINC000485995058 901213108 /nfs/dbraw/zinc/21/31/08/901213108.db2.gz YCZFBOZRWZDNMM-KRWDZBQOSA-N 0 3 411.550 4.020 20 0 HIADHN CN(C)Cc1ccccc1C(=O)Nc1ccc(Oc2ccc(S(C)(=O)=O)cc2)cc1 ZINC000486073475 901265037 /nfs/dbraw/zinc/26/50/37/901265037.db2.gz YZKAYAFUVCUOOF-UHFFFAOYSA-N 0 3 424.522 4.196 20 0 HIADHN CN(C)Cc1ccccc1C(=O)N1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1 ZINC000486082466 901271672 /nfs/dbraw/zinc/27/16/72/901271672.db2.gz QCMCRVITJFWDIR-SFHVURJKSA-N 0 3 424.932 4.471 20 0 HIADHN CN(C)Cc1ccccc1C(=O)N1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1 ZINC000486082465 901271899 /nfs/dbraw/zinc/27/18/99/901271899.db2.gz QCMCRVITJFWDIR-GOSISDBHSA-N 0 3 424.932 4.471 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)NC[C@@H](c1ccccc1)C(F)(F)F ZINC000486140368 901327562 /nfs/dbraw/zinc/32/75/62/901327562.db2.gz WGVXXEJTARXRFQ-FQEVSTJZSA-N 0 3 405.464 4.080 20 0 HIADHN CN(C)Cc1ccccc1C(=O)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000486226564 901410382 /nfs/dbraw/zinc/41/03/82/901410382.db2.gz MHBLJXFGWCSZGP-UHFFFAOYSA-N 0 3 420.384 4.449 20 0 HIADHN CN(C)Cc1ccccc1C(=O)Nc1cccc(CS(=O)(=O)C2CCCCC2)c1 ZINC000486340460 901515106 /nfs/dbraw/zinc/51/51/06/901515106.db2.gz CHIHKYCUJYWIFO-UHFFFAOYSA-N 0 3 414.571 4.248 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(NC[C@@H](c3ccccc3OC)[NH+]3CCCC3)nc2)n1 ZINC000486443699 901601963 /nfs/dbraw/zinc/60/19/63/901601963.db2.gz UBRKLRBOTCTNLV-FQEVSTJZSA-N 0 3 419.529 4.064 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1c(F)cccc1Br)c1cccc(OC)c1 ZINC000486627539 901762094 /nfs/dbraw/zinc/76/20/94/901762094.db2.gz KGZVYMBTLZQADM-GOSISDBHSA-N 0 3 423.326 4.410 20 0 HIADHN Fc1ccc2cc(CNCc3ccc(Br)cc3N3CCOCC3)[nH]c2c1 ZINC000486682364 901793776 /nfs/dbraw/zinc/79/37/76/901793776.db2.gz LSWLATDIVJDXFX-UHFFFAOYSA-N 0 3 418.310 4.196 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N[C@@H]3CCOC4(CCCCC4)C3)c(C)c2)CC1 ZINC000486743164 901825695 /nfs/dbraw/zinc/82/56/95/901825695.db2.gz DZEGIUMXLAFICJ-HXUWFJFHSA-N 0 3 414.594 4.140 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3CCc4ccc(F)c(F)c4C3)c(C)c2)CC1 ZINC000486758791 901835003 /nfs/dbraw/zinc/83/50/03/901835003.db2.gz DCZOXFXMOPKNRR-UHFFFAOYSA-N 0 3 414.500 4.005 20 0 HIADHN O=C(CN1CCC[C@H]1CCC1CCCC1)NC1CCN(C(=O)C2CCCCC2)CC1 ZINC000486801217 901861998 /nfs/dbraw/zinc/86/19/98/901861998.db2.gz QHYVRPMCJOEMNA-QHCPKHFHSA-N 0 3 417.638 4.109 20 0 HIADHN CCOc1cc(CN2CCC(c3ccsc3)CC2)ccc1O[C@H](C)C(=O)N(C)C ZINC000486923893 901965880 /nfs/dbraw/zinc/96/58/80/901965880.db2.gz ZXKXRKAVSJYRFZ-QGZVFWFLSA-N 0 3 416.587 4.382 20 0 HIADHN O=C(NC[C@H]1CCCN1Cc1ccccc1)Nc1nnc(/C=C/c2ccco2)s1 ZINC000486943690 901980694 /nfs/dbraw/zinc/98/06/94/901980694.db2.gz NGGYKCMUVWFXOT-SXSDINLZSA-N 0 3 409.515 4.088 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)C1(c2ccccc2F)CCCC1 ZINC000486981782 902002393 /nfs/dbraw/zinc/00/23/93/902002393.db2.gz DMXUJYQBUGELBP-UHFFFAOYSA-N 0 3 423.576 4.356 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3ccc(C(=O)C4CCC4)cc3)CC2)C[C@H](C)O1 ZINC000487062725 902043387 /nfs/dbraw/zinc/04/33/87/902043387.db2.gz ZAPDHBIDJRSRTI-HDICACEKSA-N 0 3 413.562 4.023 20 0 HIADHN CC(C)([C@@H](NC(=O)c1cc(=O)[nH]c(C2CC2)c1)c1ccc(F)c(F)c1)N1CCCC1 ZINC000487073212 902048078 /nfs/dbraw/zinc/04/80/78/902048078.db2.gz PJIUNAANXLEOAP-NRFANRHFSA-N 0 3 415.484 4.288 20 0 HIADHN CC(C)([C@H](NC(=O)Cn1cc2ccccc2n1)c1ccc(F)c(F)c1)N1CCCC1 ZINC000487123610 902067474 /nfs/dbraw/zinc/06/74/74/902067474.db2.gz WIAJPNFDKQORCS-JOCHJYFZSA-N 0 3 412.484 4.046 20 0 HIADHN Brc1cccc(N2CC[C@@H](NCc3cnc([C@H]4CCCO4)s3)C2)c1 ZINC000487176575 902087142 /nfs/dbraw/zinc/08/71/42/902087142.db2.gz YLBILLDAGBFWEO-RHSMWYFYSA-N 0 3 408.365 4.126 20 0 HIADHN CC[C@@H](Cc1ccccc1Br)NCc1c(Br)cnn1C ZINC000487304989 902143801 /nfs/dbraw/zinc/14/38/01/902143801.db2.gz BJQIKPPMESLAKH-LBPRGKRZSA-N 0 3 401.146 4.056 20 0 HIADHN Cc1nc(-c2ccc(C)cc2NC(=O)CN2CCC[C@H]2Cc2ccccc2C)n[nH]1 ZINC000487433542 902208292 /nfs/dbraw/zinc/20/82/92/902208292.db2.gz SXDVFPIYEITPDG-FQEVSTJZSA-N 0 3 403.530 4.043 20 0 HIADHN COc1cc(-c2noc(CN3CCC[C@H]3Cc3ccccc3C)n2)cc(OC)c1OC ZINC000487437778 902211246 /nfs/dbraw/zinc/21/12/46/902211246.db2.gz ZSNZHMLYIHDXKN-IBGZPJMESA-N 0 3 423.513 4.278 20 0 HIADHN COc1ccccc1OCc1ccc(C(=O)N(CCN(C)C)Cc2cccc(C)c2)o1 ZINC000487647542 902273216 /nfs/dbraw/zinc/27/32/16/902273216.db2.gz GRPFOBNVDLLBSB-UHFFFAOYSA-N 0 3 422.525 4.380 20 0 HIADHN CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)N[C@@H]1CCC[C@@H](c2ccccc2)C1 ZINC000487747083 902338241 /nfs/dbraw/zinc/33/82/41/902338241.db2.gz GLECXBYJXNIVSM-ONTLXTELSA-N 0 3 406.574 4.442 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)C2(c3ccc(Cl)c(Cl)c3)CCC2)CC1 ZINC000487779507 902359237 /nfs/dbraw/zinc/35/92/37/902359237.db2.gz FHJNWGRSIYDJLQ-UHFFFAOYSA-N 0 3 413.389 4.421 20 0 HIADHN COc1ccc(CCNC(=O)[C@@H](C)N[C@@H](C)c2ccc(F)c3ccccc32)cc1OC ZINC000487870993 902416763 /nfs/dbraw/zinc/41/67/63/902416763.db2.gz BMDYHKPJXHQTQG-DLBZAZTESA-N 0 3 424.516 4.394 20 0 HIADHN CCc1ccccc1N(C(C)=O)c1nc(CN2CCN(C)[C@@H](C(C)C)C2)cs1 ZINC000488004845 902524785 /nfs/dbraw/zinc/52/47/85/902524785.db2.gz XSCAXWYSUPBZHW-OAQYLSRUSA-N 0 3 400.592 4.162 20 0 HIADHN CC(C)c1nc(C2CCN(C[C@@H](O)CO[C@H](C)c3ccc(Cl)cc3)CC2)no1 ZINC000505982264 914645417 /nfs/dbraw/zinc/64/54/17/914645417.db2.gz PEUUSVVHGKIENN-DNVCBOLYSA-N 0 3 407.942 4.165 20 0 HIADHN Cc1ccc(C(=O)NC2CCN(CCOC(C)C)CC2)c(Sc2ccccc2)n1 ZINC000488138896 902635300 /nfs/dbraw/zinc/63/53/00/902635300.db2.gz XTPYGWCFQYCDTD-UHFFFAOYSA-N 0 3 413.587 4.160 20 0 HIADHN CC(C)(C)OCCN1CCC(c2nc(-c3ccccc3Br)no2)CC1 ZINC000488181914 902669718 /nfs/dbraw/zinc/66/97/18/902669718.db2.gz KCLDKHZMYAZHRB-UHFFFAOYSA-N 0 3 408.340 4.494 20 0 HIADHN C[C@@H](NC(=O)N1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1)c1cccc(Cl)c1 ZINC000488268074 902736589 /nfs/dbraw/zinc/73/65/89/902736589.db2.gz RVMSOGUCFUNEJY-OKZBNKHCSA-N 0 3 407.986 4.322 20 0 HIADHN C[C@H](NCC1(c2ccc3c(c2)OCO3)CCOCC1)c1nccn1-c1ccccc1 ZINC000488286480 902750225 /nfs/dbraw/zinc/75/02/25/902750225.db2.gz HEWBMVGWXXSWAW-SFHVURJKSA-N 0 3 405.498 4.000 20 0 HIADHN CC(C)(C)[C@@H]1C[C@@H](NCc2cccnc2Oc2cccc(S(C)(=O)=O)c2)CS1 ZINC000488405841 902811788 /nfs/dbraw/zinc/81/17/88/902811788.db2.gz BRAODDCBPMBFLM-APWZRJJASA-N 0 3 420.600 4.287 20 0 HIADHN CCn1cc([C@@H]2NC(=O)CC[C@H]2N[C@H](C)c2ccccc2OCc2ccccc2)cn1 ZINC000488464396 902838921 /nfs/dbraw/zinc/83/89/21/902838921.db2.gz RZPFVOVJUXKLJJ-KPCPBYSCSA-N 0 3 418.541 4.153 20 0 HIADHN CC(C)(C)n1ncc(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)c1-c1ccccc1 ZINC000488577306 902889398 /nfs/dbraw/zinc/88/93/98/902889398.db2.gz OUIGFBLLENIJNP-OAQYLSRUSA-N 0 3 402.542 4.309 20 0 HIADHN C[C@H](Sc1ccccc1Cl)C(=O)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000488665605 902928568 /nfs/dbraw/zinc/92/85/68/902928568.db2.gz MXVSHRKWKXMQKI-HNNXBMFYSA-N 0 3 404.963 4.416 20 0 HIADHN C[C@H](Cc1cccc(C(F)(F)F)c1)C(=O)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000488674790 902935968 /nfs/dbraw/zinc/93/59/68/902935968.db2.gz LKAJDTOWIIUOPK-MRXNPFEDSA-N 0 3 420.475 4.479 20 0 HIADHN Cc1c(C(=O)N(Cc2ccccc2)C2CCN(C)CC2)cnn1-c1ccccc1C ZINC000488693395 902946788 /nfs/dbraw/zinc/94/67/88/902946788.db2.gz VYBYOEWXLRWYJD-UHFFFAOYSA-N 0 3 402.542 4.226 20 0 HIADHN COc1ccc(C(=O)N(Cc2ccccc2)C2CCN(C)CC2)cc1OC(F)F ZINC000488693999 902948127 /nfs/dbraw/zinc/94/81/27/902948127.db2.gz XDPBKHMSLSYTOO-UHFFFAOYSA-N 0 3 404.457 4.033 20 0 HIADHN CC[C@@H](c1nnc(SCC(=O)NC[C@H](c2ccccc2)N(C)C)o1)c1ccccc1 ZINC000488847442 903040179 /nfs/dbraw/zinc/04/01/79/903040179.db2.gz BPIJQOAOEMXKOW-WOJBJXKFSA-N 0 3 424.570 4.123 20 0 HIADHN CC[C@H](c1nnc(SCC(=O)NC[C@H](c2ccccc2)N(C)C)o1)c1ccccc1 ZINC000488847441 903040586 /nfs/dbraw/zinc/04/05/86/903040586.db2.gz BPIJQOAOEMXKOW-VQTJNVASSA-N 0 3 424.570 4.123 20 0 HIADHN CC(C)n1ncc(C(=O)N(C)C[C@@H]2CCN(C)[C@H]2c2cccnc2)c1-c1ccccc1 ZINC000488906708 903071156 /nfs/dbraw/zinc/07/11/56/903071156.db2.gz ZHQQGRQIRFIQMG-GMAHTHKFSA-N 0 3 417.557 4.291 20 0 HIADHN COc1ccccc1[C@H](C)NC(=O)[C@H](C)N[C@H](COc1ccccc1F)C(C)(C)C ZINC000489029533 903134293 /nfs/dbraw/zinc/13/42/93/903134293.db2.gz ZICOFUKLCJFRCH-PNLZDCPESA-N 0 3 416.537 4.483 20 0 HIADHN CC[C@H](C)[C@](C)(O)CNCc1cc(Br)cc(Br)c1OC ZINC000489062564 903165958 /nfs/dbraw/zinc/16/59/58/903165958.db2.gz GNQGOFIOLCYAAL-ZUZCIYMTSA-N 0 3 409.162 4.107 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)NCc1sccc1Br)c1ccco1 ZINC000489199168 903259044 /nfs/dbraw/zinc/25/90/44/903259044.db2.gz RNBFWFHEHJGHEU-YPMHNXCESA-N 0 3 400.342 4.032 20 0 HIADHN C[C@H](CNC(=O)N(Cc1ccccc1)C1CCN(C)CC1)COCc1ccccc1 ZINC000489328163 903332563 /nfs/dbraw/zinc/33/25/63/903332563.db2.gz STFHFTUAPVHZMZ-OAQYLSRUSA-N 0 3 409.574 4.145 20 0 HIADHN C[C@@H](CNC(=O)N(Cc1ccccc1)C1CCN(C)CC1)COCc1ccccc1 ZINC000489328162 903332965 /nfs/dbraw/zinc/33/29/65/903332965.db2.gz STFHFTUAPVHZMZ-NRFANRHFSA-N 0 3 409.574 4.145 20 0 HIADHN COCCN(Cc1c(-c2ccc(Cl)cc2)nc2sccn12)[C@H]1CCO[C@@H]1C ZINC000489437028 903383029 /nfs/dbraw/zinc/38/30/29/903383029.db2.gz FTBZIFGLTPTFME-PBHICJAKSA-N 0 3 405.951 4.342 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)NCC(C)(C)[NH2+][C@@H](C)c3ccccc3)cc2)cc(=O)[n-]1 ZINC000489492948 903420429 /nfs/dbraw/zinc/42/04/29/903420429.db2.gz YMVJDRRFOXZPOY-INIZCTEOSA-N 0 3 419.529 4.409 20 0 HIADHN Cc1nn(C)cc1[C@H](C)NC(=O)N(CCN(C)Cc1ccccc1)Cc1ccccc1 ZINC000489538882 903449319 /nfs/dbraw/zinc/44/93/19/903449319.db2.gz CXUCFKDMOIYLMM-FQEVSTJZSA-N 0 3 419.573 4.133 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3ccccc3N3CCCCC3)c(C)c2)CC1 ZINC000506034367 914718320 /nfs/dbraw/zinc/71/83/20/914718320.db2.gz CFLDNQYHSLZYIG-UHFFFAOYSA-N 0 3 406.574 4.380 20 0 HIADHN C[C@H](c1ccc(S(N)(=O)=O)cc1)N(C)Cc1ccc(-c2ccccc2F)s1 ZINC000506035774 914721185 /nfs/dbraw/zinc/72/11/85/914721185.db2.gz SPTWRRQHHUTBGC-CQSZACIVSA-N 0 3 404.532 4.395 20 0 HIADHN CC(C)CC[C@H](NC(=O)NCc1ccccc1CN1CCC(O)CC1)C(C)(C)C ZINC000489589966 903481645 /nfs/dbraw/zinc/48/16/45/903481645.db2.gz VVDZMVANZOHTPK-QFIPXVFZSA-N 0 3 403.611 4.293 20 0 HIADHN Cc1nc(C(=O)Nc2cccc(CN3CCC(O)CC3)c2)c(-c2ccccc2)s1 ZINC000489593166 903484832 /nfs/dbraw/zinc/48/48/32/903484832.db2.gz HHBKFOGNKMUJKH-UHFFFAOYSA-N 0 3 407.539 4.328 20 0 HIADHN Cc1ccc(C[C@@H](C)C(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000489658119 903523813 /nfs/dbraw/zinc/52/38/13/903523813.db2.gz ZIWMZODQEMLKAG-OFNKIYASSA-N 0 3 402.542 4.456 20 0 HIADHN Cc1nn(C)c2nc(C3CC3)cc(C(=O)NC[C@H](c3ccc(C)cc3)N3CCCC3)c12 ZINC000489732930 903566533 /nfs/dbraw/zinc/56/65/33/903566533.db2.gz IXPNBPLMNXGPFX-JOCHJYFZSA-N 0 3 417.557 4.029 20 0 HIADHN CN(C)Cc1ccc(C(=O)Nc2cc(-c3cccc(C(F)(F)F)c3)nn2C)cc1 ZINC000489994130 903715939 /nfs/dbraw/zinc/71/59/39/903715939.db2.gz NPIGHHQQYQEEGP-UHFFFAOYSA-N 0 3 402.420 4.420 20 0 HIADHN O=c1cc(CN2CCC[C@@H](c3nc4c(s3)CCCC4)C2)nc2ccc(Cl)cn12 ZINC000490011958 903723202 /nfs/dbraw/zinc/72/32/02/903723202.db2.gz LPEPVLQPBKRIDN-CQSZACIVSA-N 0 3 414.962 4.063 20 0 HIADHN COc1cc(-c2nnc(CN3C[C@@H](c4ccc(C)cc4)C[C@H]3C)o2)cc(OC)c1OC ZINC000490045105 903739703 /nfs/dbraw/zinc/73/97/03/903739703.db2.gz NAXIHTDXIMSFQK-APWZRJJASA-N 0 3 423.513 4.449 20 0 HIADHN Cc1ccc(C)c([C@H](NCc2ccnc(N3CCN(C)CC3)c2)c2ccccc2)c1 ZINC000490128849 903781641 /nfs/dbraw/zinc/78/16/41/903781641.db2.gz ATUNQPQMPIMVTC-AREMUKBSSA-N 0 3 400.570 4.329 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](NCCc2ccc(O)cc2)c2ccc(Cl)cc2)c1 ZINC000490142791 903789598 /nfs/dbraw/zinc/78/95/98/903789598.db2.gz JWYZEAMOZCDEQU-QFIPXVFZSA-N 0 3 415.942 4.371 20 0 HIADHN COc1ccc(Oc2cc(CN[C@H]3CCN(C(C)=O)Cc4ccccc43)ccn2)cc1 ZINC000490184912 903815045 /nfs/dbraw/zinc/81/50/45/903815045.db2.gz PQJVCKUHUBTFRP-DEOSSOPVSA-N 0 3 417.509 4.466 20 0 HIADHN CCC(CC)[C@H](CN[C@H](c1ccc(F)cc1)c1cccc(S(C)(=O)=O)c1)N(C)C ZINC000490190402 903817480 /nfs/dbraw/zinc/81/74/80/903817480.db2.gz IRMBOYMQQYXZLH-XZOQPEGZSA-N 0 3 420.594 4.275 20 0 HIADHN CCCNC(=O)CN1CCC(N[C@@H](c2cccc(F)c2)c2cccc(Cl)c2)CC1 ZINC000490191553 903818509 /nfs/dbraw/zinc/81/85/09/903818509.db2.gz UKZIFHBYMPOIAX-HSZRJFAPSA-N 0 3 417.956 4.149 20 0 HIADHN Cc1occc1-c1cc(NC(=O)N(CCN(C)C)Cc2cccc(Cl)c2)no1 ZINC000490207972 903828868 /nfs/dbraw/zinc/82/88/68/903828868.db2.gz SHLULHYINWATMR-UHFFFAOYSA-N 0 3 402.882 4.492 20 0 HIADHN C[C@@H]1CCC[C@H](N(Cc2ccc(C(=O)N(C)C)[nH]2)Cc2ccc3c(c2)OCO3)[C@H]1C ZINC000506055204 914753780 /nfs/dbraw/zinc/75/37/80/914753780.db2.gz IELLZLPYWILIFZ-WWMYMODYSA-N 0 3 411.546 4.272 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)Cc3csc(-c4ccc(Cl)cc4Cl)n3)[C@@H]2C1 ZINC000490212631 903830387 /nfs/dbraw/zinc/83/03/87/903830387.db2.gz MHCSUKJPVPTQSI-SJKOYZFVSA-N 0 3 410.370 4.212 20 0 HIADHN CN(Cc1cn(-c2ccccc2)nc1-c1cccs1)C[C@H](O)COCc1ccco1 ZINC000490290023 903879240 /nfs/dbraw/zinc/87/92/40/903879240.db2.gz RWTPLPCXIZODKN-FQEVSTJZSA-N 0 3 423.538 4.203 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N(C)Cc1ccc(OC)c(C)c1)c1cccc(OC)c1 ZINC000490292101 903880366 /nfs/dbraw/zinc/88/03/66/903880366.db2.gz WIXBKRUJMCNXNC-JOCHJYFZSA-N 0 3 413.562 4.237 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)c3ccc(Oc4cccc(Cl)c4Cl)nc3)[C@H]2C1 ZINC000490315618 903896630 /nfs/dbraw/zinc/89/66/30/903896630.db2.gz VESSKSHKWJCYRW-BBRMVZONSA-N 0 3 406.313 4.347 20 0 HIADHN C[C@H](c1cccc(N2CCCS2(=O)=O)c1)N(C)Cc1cccc(C(F)(F)F)c1 ZINC000490336746 903926571 /nfs/dbraw/zinc/92/65/71/903926571.db2.gz SEQMOSHTKXTZCZ-OAHLLOKOSA-N 0 3 412.477 4.438 20 0 HIADHN COC(=O)[C@@H]1CC12CCN(Cc1cc(Br)cc(C)c1OC(F)F)CC2 ZINC000490403148 903986983 /nfs/dbraw/zinc/98/69/83/903986983.db2.gz OPGDMEJBMJJQSE-AWEZNQCLSA-N 0 3 418.278 4.134 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2cc(F)cc(Br)c2F)[C@H]1c1ccccc1 ZINC000490515219 904064949 /nfs/dbraw/zinc/06/49/49/904064949.db2.gz VHONSVHJBBYCLC-RHSMWYFYSA-N 0 3 410.262 4.294 20 0 HIADHN CCOC(=O)CC(C)(C)N(C)Cc1ccnc(-c2ccc(Br)cc2)n1 ZINC000490608116 904132477 /nfs/dbraw/zinc/13/24/77/904132477.db2.gz NNJVEDWOCRZNAS-UHFFFAOYSA-N 0 3 406.324 4.070 20 0 HIADHN CN(C)CCN(CC1CCCCC1)C(=O)c1cnc(-c2ccc3c(c2)OCO3)s1 ZINC000490626926 904145438 /nfs/dbraw/zinc/14/54/38/904145438.db2.gz LYKLBERAJDRCLT-UHFFFAOYSA-N 0 3 415.559 4.123 20 0 HIADHN O=C(CN1CCCC[C@H]1[C@H]1CNC(=O)C1)c1c2ccccc2[nH]c1-c1ccccc1 ZINC000490631939 904147191 /nfs/dbraw/zinc/14/71/91/904147191.db2.gz QCRJIEFFNZQEKA-NQIIRXRSSA-N 0 3 401.510 4.008 20 0 HIADHN O=C1C[C@H]([C@@H]2CCCCN2Cc2csc(-c3ccc(Br)cc3)n2)CN1 ZINC000490674526 904167952 /nfs/dbraw/zinc/16/79/52/904167952.db2.gz NYRLWYJFBSEBRI-YOEHRIQHSA-N 0 3 420.376 4.063 20 0 HIADHN Cc1ccc(-c2nc(CCNC(=O)N[C@H](C)[C@@H](c3ccccc3)N(C)C)co2)cc1 ZINC000490762106 904215348 /nfs/dbraw/zinc/21/53/48/904215348.db2.gz WYLMKFRANONNLA-GCJKJVERSA-N 0 3 406.530 4.183 20 0 HIADHN O=C(NCCc1cccc2cccnc21)Nc1ccc(CCN2CCSCC2)cc1 ZINC000490957423 904336290 /nfs/dbraw/zinc/33/62/90/904336290.db2.gz YRFCDNMOTBWGJR-UHFFFAOYSA-N 0 3 420.582 4.190 20 0 HIADHN CCN(CCc1cccs1)C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000490980372 904348014 /nfs/dbraw/zinc/34/80/14/904348014.db2.gz JBVFQSWQZGLCSP-UHFFFAOYSA-N 0 3 403.617 4.436 20 0 HIADHN CCCN(C)[C@H](CNC(=O)NCCc1nnc(C(C)C)s1)c1ccc(Cl)cc1 ZINC000490990012 904354704 /nfs/dbraw/zinc/35/47/04/904354704.db2.gz QBPQLWNLQFVZIK-QGZVFWFLSA-N 0 3 424.014 4.240 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)N1CCC(n2ccc(C(F)(F)F)n2)CC1 ZINC000491002430 904360937 /nfs/dbraw/zinc/36/09/37/904360937.db2.gz BLLOUWBCXFBIBI-UHFFFAOYSA-N 0 3 420.435 4.187 20 0 HIADHN Cc1ccc([C@H](NC[C@H](O)C2CCCCC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000491008949 904368230 /nfs/dbraw/zinc/36/82/30/904368230.db2.gz QDAMKENMAPMDPQ-GOTSBHOMSA-N 0 3 401.572 4.019 20 0 HIADHN CSc1cccc([C@H](NC[C@H](C)N2CCN(C)CC2)c2cc(F)ccc2F)c1 ZINC000491036726 904389237 /nfs/dbraw/zinc/38/92/37/904389237.db2.gz ZFZHGITYTADRPI-AOMKIAJQSA-N 0 3 405.558 4.002 20 0 HIADHN Cc1ccc([C@H](N[C@@H]2CCN(C3CCCC3)C2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000491056486 904399456 /nfs/dbraw/zinc/39/94/56/904399456.db2.gz UZEGNLSKKOQMMY-QPPBQGQZSA-N 0 3 412.599 4.094 20 0 HIADHN O=C(NC[C@H]1CCCN1Cc1ccccc1)Nc1cc(F)c(OC(F)F)cc1F ZINC000491281212 904517477 /nfs/dbraw/zinc/51/74/77/904517477.db2.gz DMJXUPGLKRZCAK-CQSZACIVSA-N 0 3 411.399 4.352 20 0 HIADHN Cc1cccn2c(CN3CCC[C@H](c4nnc5ccc(C(F)(F)F)cn54)C3)cnc12 ZINC000506137727 914819181 /nfs/dbraw/zinc/81/91/81/914819181.db2.gz PPTMVZWDSBQSQZ-HNNXBMFYSA-N 0 3 414.435 4.084 20 0 HIADHN CC[C@H](C)[C@H](NC(=O)N1CC[C@@H](N2CCN(C)CC2)[C@H](C)C1)c1ccc(Cl)cc1 ZINC000491313028 904530476 /nfs/dbraw/zinc/53/04/76/904530476.db2.gz RROISDKEDITUEV-KKXYHZGYSA-N 0 3 421.029 4.095 20 0 HIADHN NS(=O)(=O)c1ccc(CCN[C@H](c2ccc(F)cc2)c2ccccc2Cl)cc1 ZINC000491329004 904538836 /nfs/dbraw/zinc/53/88/36/904538836.db2.gz KOKIIYKVIQUVMB-OAQYLSRUSA-N 0 3 418.921 4.048 20 0 HIADHN CC(=O)Nc1ccccc1CN1CCC[C@@H](c2nnc3ccc(C(F)(F)F)cn32)C1 ZINC000506141075 914820596 /nfs/dbraw/zinc/82/05/96/914820596.db2.gz ORDXLSMFVWVNST-MRXNPFEDSA-N 0 3 417.435 4.086 20 0 HIADHN Cc1ccc([C@H](NC[C@H](c2ccccc2)N(C)C)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000491343599 904547980 /nfs/dbraw/zinc/54/79/80/904547980.db2.gz PKTPCFMSDIGBNK-RPBOFIJWSA-N 0 3 422.594 4.380 20 0 HIADHN Cc1ccc(C)c([C@H](NC2CCN(S(C)(=O)=O)CC2)c2ccccc2Cl)c1 ZINC000491344183 904548209 /nfs/dbraw/zinc/54/82/09/904548209.db2.gz XHTYZNPPOVCTDG-OAQYLSRUSA-N 0 3 406.979 4.060 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)Nc1ccc2c(c1)CCCC(=O)N2 ZINC000491358289 904557312 /nfs/dbraw/zinc/55/73/12/904557312.db2.gz IIESLQREJCLPQB-UHFFFAOYSA-N 0 3 414.937 4.211 20 0 HIADHN CC(=O)Nc1cccc(NC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)c1 ZINC000491436854 904597181 /nfs/dbraw/zinc/59/71/81/904597181.db2.gz XXKGUVGDFPTPEU-FQEVSTJZSA-N 0 3 405.420 4.038 20 0 HIADHN COc1ccc(NC(=O)N(CCN(C)C)Cc2cccc(C)c2)c(Br)c1 ZINC000491477714 904615137 /nfs/dbraw/zinc/61/51/37/904615137.db2.gz AAZZBFAFPUXGNU-UHFFFAOYSA-N 0 3 420.351 4.362 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3ccc(Cl)cc3OCC(F)F)cc2)CC1 ZINC000491498321 904624434 /nfs/dbraw/zinc/62/44/34/904624434.db2.gz BKVPABKNJAYHOB-UHFFFAOYSA-N 0 3 423.891 4.378 20 0 HIADHN O=C(Nc1ccc(F)c(F)c1F)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000491522121 904633772 /nfs/dbraw/zinc/63/37/72/904633772.db2.gz QORWGOKNAPTODN-SFHVURJKSA-N 0 3 402.338 4.497 20 0 HIADHN O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCC[C@H](c2nc3ccc(F)cc3o2)C1 ZINC000506166772 914830836 /nfs/dbraw/zinc/83/08/36/914830836.db2.gz QDLGFTWSENALSW-AZUAARDMSA-N 0 3 422.504 4.130 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)Nc2cccc(Cl)c2-n2cccn2)c1 ZINC000491685380 904684115 /nfs/dbraw/zinc/68/41/15/904684115.db2.gz NLBDPUUYMXKCRC-UHFFFAOYSA-N 0 3 411.937 4.430 20 0 HIADHN CC(=O)Nc1ccc(Cl)c(NC(=O)N(CCN(C)C)Cc2cccc(C)c2)c1 ZINC000491686943 904684716 /nfs/dbraw/zinc/68/47/16/904684716.db2.gz WNNXXXHJDJOSDV-UHFFFAOYSA-N 0 3 402.926 4.203 20 0 HIADHN Cc1noc(C)c1[C@@H](C)CNC(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1 ZINC000506182378 914837006 /nfs/dbraw/zinc/83/70/06/914837006.db2.gz FWYMONBBMOIWSN-YJBOKZPZSA-N 0 3 404.580 4.229 20 0 HIADHN Cc1cc(Br)cc2c1[C@@H](NCc1ccccc1N1CCOCC1)CC2 ZINC000491913344 904729049 /nfs/dbraw/zinc/72/90/49/904729049.db2.gz MSTALWAWXHQWPR-IBGZPJMESA-N 0 3 401.348 4.371 20 0 HIADHN Cc1nn(-c2ccc(Br)cc2)cc1CNCCc1nnc(C(C)C)s1 ZINC000492108363 904801049 /nfs/dbraw/zinc/80/10/49/904801049.db2.gz QBFZWMYFPKAVLS-UHFFFAOYSA-N 0 3 420.380 4.250 20 0 HIADHN CC[C@H](C)[C@](C)(O)CN[C@@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000492177788 904810925 /nfs/dbraw/zinc/81/09/25/904810925.db2.gz INCBPPZZTDLUMZ-ONGXBYRLSA-N 0 3 409.979 4.220 20 0 HIADHN C[C@@H]1[C@H](NC(=O)N[C@H](c2ccccc2)c2cccnc2)CCN1Cc1ccccc1 ZINC000492489645 904858468 /nfs/dbraw/zinc/85/84/68/904858468.db2.gz NOUDKBRSVRTMFX-CTUHWIOQSA-N 0 3 400.526 4.133 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)C(C)(C)Oc3cccc(Cl)c3)cc2)CC1 ZINC000492515837 904863113 /nfs/dbraw/zinc/86/31/13/904863113.db2.gz QKDGKJLDRNYNSH-UHFFFAOYSA-N 0 3 415.965 4.274 20 0 HIADHN CC(C)(C)c1ccc(OC[C@H](O)CN2CCC3(CC2)OCCc2ccsc23)cc1 ZINC000492599991 904874602 /nfs/dbraw/zinc/87/46/02/904874602.db2.gz FTMOMWRFHNUQOL-HXUWFJFHSA-N 0 3 415.599 4.349 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)C[C@@H](C)c1c(C)n[nH]c1C ZINC000492594391 904874895 /nfs/dbraw/zinc/87/48/95/904874895.db2.gz ZEZDBTQSKKHNMY-IERDGZPVSA-N 0 3 420.561 4.111 20 0 HIADHN CC(C)(C)c1ccc(OC[C@@H](O)CN2CCC3(CC2)OCCc2ccsc23)cc1 ZINC000492599990 904874959 /nfs/dbraw/zinc/87/49/59/904874959.db2.gz FTMOMWRFHNUQOL-FQEVSTJZSA-N 0 3 415.599 4.349 20 0 HIADHN O[C@H](COc1cccc2ccccc21)CN1CCC2(CC1)OCCc1ccsc12 ZINC000492784761 904904973 /nfs/dbraw/zinc/90/49/73/904904973.db2.gz QRKBIPGRSZJYTI-FQEVSTJZSA-N 0 3 409.551 4.205 20 0 HIADHN O=C(Nc1nc(-c2ccccc2)cs1)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000492930844 904954520 /nfs/dbraw/zinc/95/45/20/904954520.db2.gz QTVZVTMGDIXWOM-UHFFFAOYSA-N 0 3 407.539 4.267 20 0 HIADHN CCOc1ccc(CCC2CCN(Cc3cnc(N4CCOCC4)s3)CC2)cc1 ZINC000506245189 914860823 /nfs/dbraw/zinc/86/08/23/914860823.db2.gz JWGIJTDELAVHJO-UHFFFAOYSA-N 0 3 415.603 4.223 20 0 HIADHN COC1CCC(CN[C@H](c2cccc(S(C)(=O)=O)c2)c2ccc(F)c(F)c2)CC1 ZINC000493009967 904988004 /nfs/dbraw/zinc/98/80/04/904988004.db2.gz PFBIKYFOYONNFA-IVMBPFOVSA-N 0 3 423.525 4.253 20 0 HIADHN Cc1ccc([C@H](NCC2(CCO)CCCCC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000493033461 904993961 /nfs/dbraw/zinc/99/39/61/904993961.db2.gz FOSRODGEZSNWTC-QHCPKHFHSA-N 0 3 415.599 4.410 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](NCC2(CCO)CCCCC2)c2ccc(F)cc2)c1 ZINC000493038192 904999381 /nfs/dbraw/zinc/99/93/81/904999381.db2.gz UAEOCJNUGGFRHL-JOCHJYFZSA-N 0 3 419.562 4.241 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](NCC2(CCO)CCCC2)c2ccc(Cl)cc2)c1 ZINC000493058352 905006691 /nfs/dbraw/zinc/00/66/91/905006691.db2.gz NKWLPMJZFSXIFE-NRFANRHFSA-N 0 3 421.990 4.365 20 0 HIADHN CCc1ccc([C@H](NCCc2cscn2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000493061434 905007233 /nfs/dbraw/zinc/00/72/33/905007233.db2.gz RJBUYSKQZOCMST-NRFANRHFSA-N 0 3 400.569 4.031 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](NCCCC(F)(F)F)c2ccc(F)c(F)c2)c1 ZINC000493106116 905019953 /nfs/dbraw/zinc/01/99/53/905019953.db2.gz SMJLTQDSMMUVKO-QGZVFWFLSA-N 0 3 407.404 4.390 20 0 HIADHN CCC1(CN[C@H](c2ccc(F)cc2)c2cccc(S(C)(=O)=O)c2)CCOCC1 ZINC000493226114 905056734 /nfs/dbraw/zinc/05/67/34/905056734.db2.gz HQZPWLQCFQFNSK-OAQYLSRUSA-N 0 3 405.535 4.115 20 0 HIADHN Cc1ccc([C@@H](NC[C@@H](O)CC(C)(C)C)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000493236203 905061511 /nfs/dbraw/zinc/06/15/11/905061511.db2.gz ZVAQKRPMTHPETL-UGKGYDQZSA-N 0 3 403.588 4.183 20 0 HIADHN Fc1ccccc1[C@@H](NCCCO[C@@H]1CCOC1)c1ccc(Br)cc1 ZINC000493250897 905067943 /nfs/dbraw/zinc/06/79/43/905067943.db2.gz SSJJYZGNWQBEDD-XLIONFOSSA-N 0 3 408.311 4.463 20 0 HIADHN CCN(CC)[C@H](CNC(=O)[C@@H]1CCCc2sc(C)nc21)c1cccc(OC)c1 ZINC000493253075 905069174 /nfs/dbraw/zinc/06/91/74/905069174.db2.gz JIYFEUGKHUVCRG-RTBURBONSA-N 0 3 401.576 4.079 20 0 HIADHN COc1cc(-c2noc(CN[C@@H]3CCC[C@@H]3Cc3ccccc3)n2)cc(OC)c1OC ZINC000493541083 905155553 /nfs/dbraw/zinc/15/55/53/905155553.db2.gz DHTDISZBHYVOKI-IEBWSBKVSA-N 0 3 423.513 4.263 20 0 HIADHN CS(=O)(=O)c1ccc(-c2nc(CN[C@H]3CCC[C@H]3Cc3ccccc3)co2)cc1 ZINC000493576127 905167665 /nfs/dbraw/zinc/16/76/65/905167665.db2.gz VYVXGIXNWDQQAF-UGKGYDQZSA-N 0 3 410.539 4.246 20 0 HIADHN Cc1cccnc1NC(=O)N(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000493916414 905267229 /nfs/dbraw/zinc/26/72/29/905267229.db2.gz JOWMBWXFOLGKIC-HSZRJFAPSA-N 0 3 415.541 4.484 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3CC(C)(C)[C@@H]3c3cccnc3)c(C)c2)CC1 ZINC000493934990 905288627 /nfs/dbraw/zinc/28/86/27/905288627.db2.gz HCIVPRHDZLUVEZ-QFIPXVFZSA-N 0 3 407.562 4.147 20 0 HIADHN COCCSc1ccc([C@@H](C)NC(=O)N[C@H](CN(C)C)c2ccc(F)cc2)cc1 ZINC000493939521 905292119 /nfs/dbraw/zinc/29/21/19/905292119.db2.gz FJKSJCKDRAWMGX-IIBYNOLFSA-N 0 3 419.566 4.227 20 0 HIADHN O=[S@](CCN[C@H]1CCO[C@H]1c1ccc(F)c(F)c1)c1cc(Cl)ccc1Cl ZINC000493983358 905327803 /nfs/dbraw/zinc/32/78/03/905327803.db2.gz DIOAXRQCCBGCFL-KLHYBKMASA-N 0 3 420.308 4.499 20 0 HIADHN CCN1CCN(c2ccc(N[C@H](C(=O)N3CCCCC3)c3ccccc3)c(C)c2)CC1 ZINC000493984350 905328445 /nfs/dbraw/zinc/32/84/45/905328445.db2.gz RSKXFQSPIULLRS-VWLOTQADSA-N 0 3 420.601 4.303 20 0 HIADHN COCCC(=O)N1CCC(N[C@H](c2ccc(F)cc2)c2ccccc2Cl)CC1 ZINC000493996006 905337406 /nfs/dbraw/zinc/33/74/06/905337406.db2.gz HPVVCFKMOQUWKL-JOCHJYFZSA-N 0 3 404.913 4.186 20 0 HIADHN COc1ccc([C@@H](NC2CCC(S(C)(=O)=O)CC2)c2ccccc2Cl)cc1 ZINC000493996651 905340479 /nfs/dbraw/zinc/34/04/79/905340479.db2.gz MRTZSLLPVNAHRZ-QYGXFBIXSA-N 0 3 407.963 4.383 20 0 HIADHN O=S(=O)(C1CC1)N1CCC(N[C@H](c2ccc(F)cc2)c2ccccc2Cl)CC1 ZINC000494021497 905364085 /nfs/dbraw/zinc/36/40/85/905364085.db2.gz XDSHXKJNSUNNLS-OAQYLSRUSA-N 0 3 422.953 4.115 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](NCCc2cccc(F)c2F)c2ccccc2)c1 ZINC000494026923 905367441 /nfs/dbraw/zinc/36/74/41/905367441.db2.gz FLOHYRSQEZLZSN-JOCHJYFZSA-N 0 3 401.478 4.290 20 0 HIADHN COc1cc(-c2ccccc2)ccc1CNCc1ccc(CN2CCOCC2)cc1 ZINC000512410649 921142506 /nfs/dbraw/zinc/14/25/06/921142506.db2.gz KNLFOBTWPPWHRL-UHFFFAOYSA-N 0 3 402.538 4.484 20 0 HIADHN COc1ccc(C(=O)N[C@H]2CCN(Cc3ccccc3)[C@H]2C)cc1-c1ccccn1 ZINC000494046616 905386035 /nfs/dbraw/zinc/38/60/35/905386035.db2.gz GXSDKJRNDSHPPA-AVRDEDQJSA-N 0 3 401.510 4.150 20 0 HIADHN O[C@@H](CN[C@@H](c1cccc(F)c1)c1cccc(Br)c1)C1CCOCC1 ZINC000494047023 905386875 /nfs/dbraw/zinc/38/68/75/905386875.db2.gz FZIBKPZKJNTSKY-VQTJNVASSA-N 0 3 408.311 4.055 20 0 HIADHN CC(C)n1ncc2c1nc(C1CC1)cc2C(=O)N[C@H]1CCN(Cc2ccccc2)[C@@H]1C ZINC000494070614 905408333 /nfs/dbraw/zinc/40/83/33/905408333.db2.gz XYTNCPQJFNPJCI-VGSWGCGISA-N 0 3 417.557 4.282 20 0 HIADHN CC(C)CC(=O)Nc1ccc(C(=O)N[C@H]2CCN(Cc3ccccc3)[C@H]2C)cc1F ZINC000494070297 905409302 /nfs/dbraw/zinc/40/93/02/905409302.db2.gz WISGXWMMGUYSHA-UWJYYQICSA-N 0 3 411.521 4.203 20 0 HIADHN C[C@H]1[C@H](NC(=O)Cc2csc(Cc3ccc(F)cc3)n2)CCN1Cc1ccccc1 ZINC000494076638 905412916 /nfs/dbraw/zinc/41/29/16/905412916.db2.gz CQYNVZYGRCXRLT-HTAPYJJXSA-N 0 3 423.557 4.195 20 0 HIADHN CC(C)(CCCc1ccccc1)C(=O)Nc1cccc(CN2CCC(C(N)=O)CC2)c1 ZINC000494093279 905428106 /nfs/dbraw/zinc/42/81/06/905428106.db2.gz YSHFYGWLCZOZTQ-UHFFFAOYSA-N 0 3 421.585 4.372 20 0 HIADHN CCCn1ccc2ccc(NC(=O)N[C@@H]3CCN(Cc4ccccc4)C[C@@H]3CO)cc21 ZINC000494152228 905489574 /nfs/dbraw/zinc/48/95/74/905489574.db2.gz IITWDGXHDRIJLU-FYYLOGMGSA-N 0 3 420.557 4.056 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1nc(C2CCOCC2)cs1 ZINC000494387558 905684003 /nfs/dbraw/zinc/68/40/03/905684003.db2.gz UQKGXQKRDOJHQN-QGZVFWFLSA-N 0 3 414.575 4.165 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)N1CCC[C@@H]1CCC1CCCC1 ZINC000494417827 905705695 /nfs/dbraw/zinc/70/56/95/905705695.db2.gz NDTIGAPCAINVEN-HSZRJFAPSA-N 0 3 413.606 4.288 20 0 HIADHN COC[C@H](NC(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1)c1ccc(Cl)cc1 ZINC000494426363 905714869 /nfs/dbraw/zinc/71/48/69/905714869.db2.gz AVYVUQADDPFGSR-DQLDELGASA-N 0 3 401.938 4.162 20 0 HIADHN Cc1cccc2sc(N(Cc3ccccc3)C(=O)CN[C@H]3CCO[C@@H]3C3CC3)nc21 ZINC000494475807 905756682 /nfs/dbraw/zinc/75/66/82/905756682.db2.gz MXBIFEHHNKTKSQ-WMZHIEFXSA-N 0 3 421.566 4.295 20 0 HIADHN COC[C@@H](N[C@@H](C)CC(=O)Nc1ccc(OC)cc1OC)c1ccc(Cl)cc1 ZINC000494510859 905802171 /nfs/dbraw/zinc/80/21/71/905802171.db2.gz PFAJOJAUWDBFNU-IFXJQAMLSA-N 0 3 406.910 4.052 20 0 HIADHN CCCC(=O)NC[C@H]1CCCN(Cc2c(C)nn(-c3ccc(Cl)cc3)c2C)C1 ZINC000512469514 921181461 /nfs/dbraw/zinc/18/14/61/921181461.db2.gz RDLHLKOHSFLKSX-GOSISDBHSA-N 0 3 402.970 4.271 20 0 HIADHN Cc1c(Br)cccc1NC(=O)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000494679883 905897092 /nfs/dbraw/zinc/89/70/92/905897092.db2.gz PYIJIVSFRLBFDW-UHFFFAOYSA-N 0 3 417.347 4.214 20 0 HIADHN COC[C@@H](N[C@@H]1CCc2nnc(-c3ccc(F)cc3)n2C1)c1ccc(Cl)cc1 ZINC000494759635 905957453 /nfs/dbraw/zinc/95/74/53/905957453.db2.gz WMMJRRYWHBQINX-RTBURBONSA-N 0 3 400.885 4.030 20 0 HIADHN CN(C)CCN(Cc1cccc(O)c1)C(=O)[C@H]1C[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000494794731 905996392 /nfs/dbraw/zinc/99/63/92/905996392.db2.gz YYXSWFXHPTYKNL-ROUUACIJSA-N 0 3 407.341 4.393 20 0 HIADHN CSCC[C@H](NCCCC(=O)Nc1c(C)cccc1C)c1nnc2ccccn21 ZINC000494804958 906006310 /nfs/dbraw/zinc/00/63/10/906006310.db2.gz OKIHNXGKSBVNHA-SFHVURJKSA-N 0 3 411.575 4.149 20 0 HIADHN CN(Cc1ccc(Br)c(F)c1)C(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000494839478 906029910 /nfs/dbraw/zinc/02/99/10/906029910.db2.gz XSTFMLGBWMMAML-RBUKOAKNSA-N 0 3 420.326 4.175 20 0 HIADHN O=C(c1cn[nH]c1-c1ccc(Cl)s1)N1CCCN(Cc2ccc(F)cc2)CC1 ZINC000494892576 906068501 /nfs/dbraw/zinc/06/85/01/906068501.db2.gz MJMXAJDEIKGWAN-UHFFFAOYSA-N 0 3 418.925 4.279 20 0 HIADHN Cc1cccc(Oc2ccccc2CNC(=O)N2CCN(C3CCOCC3)C[C@H]2C)c1 ZINC000494910537 906085019 /nfs/dbraw/zinc/08/50/19/906085019.db2.gz QXDWFKDWWCEHBS-HXUWFJFHSA-N 0 3 423.557 4.182 20 0 HIADHN C[C@@H]1CN(c2ccc(CN[C@H](C[C@@H]3CCOC3)c3ccc(F)cc3)cn2)C[C@@H](C)O1 ZINC000494917410 906091035 /nfs/dbraw/zinc/09/10/35/906091035.db2.gz AYWHCEHPCYEPKJ-CROMWVBPSA-N 0 3 413.537 4.092 20 0 HIADHN Cc1ccc(NC(=O)c2ccc(CN3CCC(CO)CC3)cc2)cc1OCC(F)F ZINC000494948426 906121477 /nfs/dbraw/zinc/12/14/77/906121477.db2.gz TVVDVCPEQMSTJR-UHFFFAOYSA-N 0 3 418.484 4.096 20 0 HIADHN O=C(CN[C@@H](C[C@H]1CCOC1)c1ccc(F)cc1)Nc1cccc(Br)c1 ZINC000494956028 906127712 /nfs/dbraw/zinc/12/77/12/906127712.db2.gz IIDJZQGAGVJWLN-KUHUBIRLSA-N 0 3 421.310 4.284 20 0 HIADHN C[C@H](NC(=O)N(CCN(C)C)Cc1cccc(Cl)c1)[C@@H]1OCCc2sccc21 ZINC000494962291 906131725 /nfs/dbraw/zinc/13/17/25/906131725.db2.gz XEANFQPFPIECTP-YWZLYKJASA-N 0 3 421.994 4.177 20 0 HIADHN CCc1ccc([C@@H](NCC2([C@@H](O)C(C)C)CC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000494966967 906135468 /nfs/dbraw/zinc/13/54/68/906135468.db2.gz CUAQPIOZUSMMGY-PKTZIBPZSA-N 0 3 415.599 4.129 20 0 HIADHN C[C@H](NC(=O)N(Cc1ccccc1)C1CCN(C)CC1)[C@H]1OCCc2sccc21 ZINC000494970567 906139500 /nfs/dbraw/zinc/13/95/00/906139500.db2.gz CZOXGWQAWYSIFY-HTAPYJJXSA-N 0 3 413.587 4.056 20 0 HIADHN C[C@@H](NC(=O)NC[C@H](C)N(C)Cc1ccccc1)c1nc(C(F)(F)F)cs1 ZINC000494996485 906159281 /nfs/dbraw/zinc/15/92/81/906159281.db2.gz IPWNNJWKPUXVDB-QWHCGFSZSA-N 0 3 400.470 4.043 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N(Cc2ccc(F)cc2)C2CCOCC2)N(C)C)cc1 ZINC000494998846 906160653 /nfs/dbraw/zinc/16/06/53/906160653.db2.gz QPDFECYTWRDUNO-HSZRJFAPSA-N 0 3 413.537 4.128 20 0 HIADHN CCc1ccc(C(C)(C)C(=O)Nc2ccc(C(=O)N(C)[C@@H]3CCCN(C)C3)cc2)cc1 ZINC000495005311 906166055 /nfs/dbraw/zinc/16/60/55/906166055.db2.gz IXGWBBVGWPRFKV-HSZRJFAPSA-N 0 3 421.585 4.332 20 0 HIADHN COc1cccc([C@H](CNC(=O)N[C@H](C)CCCC(F)(F)F)N2CCCC2)c1 ZINC000495013324 906171390 /nfs/dbraw/zinc/17/13/90/906171390.db2.gz ASBPWICSZHIAEK-QAPCUYQASA-N 0 3 401.473 4.252 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)Nc1cccc(F)c1Cl ZINC000495044916 906200668 /nfs/dbraw/zinc/20/06/68/906200668.db2.gz GMSHQNJYOWYQFA-UHFFFAOYSA-N 0 3 404.917 4.203 20 0 HIADHN O=C1C[C@H](N[C@H](C[C@H]2CCOC2)c2ccc(F)cc2)CN1c1ccccc1Cl ZINC000495056116 906210344 /nfs/dbraw/zinc/21/03/44/906210344.db2.gz BMJQMKBGVLZZJA-MOXGXCLJSA-N 0 3 402.897 4.342 20 0 HIADHN O=C1C[C@H](N[C@H](C[C@@H]2CCOC2)c2ccc(F)cc2)CN1c1ccccc1Cl ZINC000495056118 906210592 /nfs/dbraw/zinc/21/05/92/906210592.db2.gz BMJQMKBGVLZZJA-ZAAXVRCTSA-N 0 3 402.897 4.342 20 0 HIADHN Fc1ccc([C@H](C[C@H]2CCOC2)NCc2ccnc(OC3CCOCC3)c2)cc1 ZINC000495079308 906226269 /nfs/dbraw/zinc/22/62/69/906226269.db2.gz NLTRKSNHQHKYCA-GCJKJVERSA-N 0 3 400.494 4.036 20 0 HIADHN Brc1ccc(N2CC[C@H](N[C@@H](c3nc[nH]n3)C3CCCCC3)C2)cc1 ZINC000495081639 906227385 /nfs/dbraw/zinc/22/73/85/906227385.db2.gz UHJGGSPORDTIRS-FUHWJXTLSA-N 0 3 404.356 4.057 20 0 HIADHN C[C@@H](NC(=O)NC[C@@H]1CCCN1Cc1ccccc1)c1nc(C(F)(F)F)cs1 ZINC000495205595 906307221 /nfs/dbraw/zinc/30/72/21/906307221.db2.gz UKDZPEDHUSXLOZ-HIFRSBDPSA-N 0 3 412.481 4.187 20 0 HIADHN C[C@@H]1CCCN(CCNC(=O)c2ccc(COc3ccc(Br)cc3)o2)C1 ZINC000495308724 906369374 /nfs/dbraw/zinc/36/93/74/906369374.db2.gz SGWCADMYZGTITI-OAHLLOKOSA-N 0 3 421.335 4.083 20 0 HIADHN CCN(C)C(=O)c1cccc(NC(=O)N(CCN(C)C)Cc2cccc(Cl)c2)c1 ZINC000495340896 906387872 /nfs/dbraw/zinc/38/78/72/906387872.db2.gz BGHZPEWQNUMRQR-UHFFFAOYSA-N 0 3 416.953 4.028 20 0 HIADHN Fc1ccccc1-c1n[nH]cc1CN1CCC(c2nc(-c3ccccc3)n[nH]2)CC1 ZINC000512557043 921234004 /nfs/dbraw/zinc/23/40/04/921234004.db2.gz KOXUYFYOXZHMDU-UHFFFAOYSA-N 0 3 402.477 4.381 20 0 HIADHN COCCC[C@H](CNCc1c(Br)cnn1C)c1ccc(Cl)cc1 ZINC000512557771 921234775 /nfs/dbraw/zinc/23/47/75/921234775.db2.gz XRCNXEQYJUCCQX-CQSZACIVSA-N 0 3 400.748 4.136 20 0 HIADHN COc1ccc(NC(=O)C[C@@H](C)N[C@@H]2CCCOc3c(F)cccc32)c(OC)c1 ZINC000495425470 906442830 /nfs/dbraw/zinc/44/28/30/906442830.db2.gz BJAMGLRGDYWFCV-RDTXWAMCSA-N 0 3 402.466 4.064 20 0 HIADHN COc1ccc(OC)c(NC(=O)C[C@H](C)N[C@@H]2CCCOc3c(F)cccc32)c1 ZINC000495435512 906450251 /nfs/dbraw/zinc/45/02/51/906450251.db2.gz XOBLGXDFQDNOCS-KBXCAEBGSA-N 0 3 402.466 4.064 20 0 HIADHN CCC[C@H](C)NC(=O)[C@H]1CCCN(Cc2ccc(OCC(F)(F)F)c(OC)c2)C1 ZINC000512561597 921237958 /nfs/dbraw/zinc/23/79/58/921237958.db2.gz LXXFHCVCXQZYIF-RDJZCZTQSA-N 0 3 416.484 4.153 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1 ZINC000496000393 906595181 /nfs/dbraw/zinc/59/51/81/906595181.db2.gz UHGMXDOMHDCXMD-VQTJNVASSA-N 0 3 401.348 4.143 20 0 HIADHN O=C(NC1CCN(CCOc2ccccc2C(F)(F)F)CC1)c1ccc(F)cc1 ZINC000496113591 906611149 /nfs/dbraw/zinc/61/11/49/906611149.db2.gz WZTUQAAWFMSMFB-UHFFFAOYSA-N 0 3 410.411 4.118 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)c1nc(-c2ccccc2)oc1C ZINC000496261566 906639886 /nfs/dbraw/zinc/63/98/86/906639886.db2.gz IRPWUVICCUASID-OAQYLSRUSA-N 0 3 404.514 4.172 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)c1csc(-c2ccccc2)n1 ZINC000496248090 906640078 /nfs/dbraw/zinc/64/00/78/906640078.db2.gz YSGBZBLZVVHWQG-FQEVSTJZSA-N 0 3 406.555 4.332 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)CSc1ccccc1Cl ZINC000496259504 906640281 /nfs/dbraw/zinc/64/02/81/906640281.db2.gz ALCOFUSWAIBGBX-SFHVURJKSA-N 0 3 403.979 4.340 20 0 HIADHN CCCCOc1cc(CN2CCC(C(=O)Nc3ccc(O)cc3)CC2)ccc1OC ZINC000512612359 921260984 /nfs/dbraw/zinc/26/09/84/921260984.db2.gz FNBWAIGJLVIKHY-UHFFFAOYSA-N 0 3 412.530 4.430 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)N[C@H]2CCOc3ccc(F)cc32)N(C)C)cc1 ZINC000496689558 906735966 /nfs/dbraw/zinc/73/59/66/906735966.db2.gz LZIIJXLAZLLTRT-SFTDATJTSA-N 0 3 415.509 4.039 20 0 HIADHN CSc1cccc(NC(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)n1 ZINC000496768832 906753303 /nfs/dbraw/zinc/75/33/03/906753303.db2.gz ITKZJDMMSPEUKI-UHFFFAOYSA-N 0 3 412.481 4.418 20 0 HIADHN COc1ccc([C@@H]2CCCN2C[C@@H](O)CO[C@@H]2CCCc3ccccc32)cc1OC ZINC000497096232 906805137 /nfs/dbraw/zinc/80/51/37/906805137.db2.gz HXHVGNOXJJPUDE-AKIFATBCSA-N 0 3 411.542 4.296 20 0 HIADHN Cc1nn(Cc2ccc(C)cc2)c(C)c1CN1CCC(C(=O)N[C@@H](C)C(C)C)CC1 ZINC000512634965 921269595 /nfs/dbraw/zinc/26/95/95/921269595.db2.gz VWLWRYVYKBRZRI-IBGZPJMESA-N 0 3 410.606 4.229 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)cc1CN1CCC(C(=O)N[C@H](C)C(C)C)CC1 ZINC000512639366 921270662 /nfs/dbraw/zinc/27/06/62/921270662.db2.gz WTMUUMGXUPCWQH-MRXNPFEDSA-N 0 3 402.970 4.207 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)c2cc3c(cccc3OC(F)F)[nH]2)CC1 ZINC000497354002 906847373 /nfs/dbraw/zinc/84/73/73/906847373.db2.gz ZICKJGPEGSXNTF-UHFFFAOYSA-N 0 3 403.429 4.099 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)c2cccc(OCc3cscn3)c2)CC1 ZINC000497362574 906853934 /nfs/dbraw/zinc/85/39/34/906853934.db2.gz INMZJWIHGRBVBD-UHFFFAOYSA-N 0 3 411.527 4.052 20 0 HIADHN CN(C)[C@@H](CNC(=O)CSCc1cc(-c2cccs2)on1)c1ccccc1 ZINC000497367472 906856955 /nfs/dbraw/zinc/85/69/55/906856955.db2.gz PZELFWMRKCZKFO-KRWDZBQOSA-N 0 3 401.557 4.055 20 0 HIADHN CC(C)CC[C@H](NC(=O)N(C)CCCN1CCN(C)CC1)c1ccc(Cl)cc1 ZINC000497393634 906876347 /nfs/dbraw/zinc/87/63/47/906876347.db2.gz YKYITKUQXTVRED-NRFANRHFSA-N 0 3 409.018 4.096 20 0 HIADHN Cc1cn(-c2ccc(F)cc2)nc1C(=O)NC[C@H](c1ccc(C)cc1)N1CCCC1 ZINC000512651164 921274633 /nfs/dbraw/zinc/27/46/33/921274633.db2.gz PNMDAZIDOGKDNH-JOCHJYFZSA-N 0 3 406.505 4.195 20 0 HIADHN CCCOc1ccc(CC(=O)N[C@@H]2CN(C)C[C@@H]2c2ccccc2)cc1OCCC ZINC000497415943 906890784 /nfs/dbraw/zinc/89/07/84/906890784.db2.gz JEOJMOJOAVAFGA-FGZHOGPDSA-N 0 3 410.558 4.021 20 0 HIADHN Cc1cc(C(=O)N[C@H]2CN(C)C[C@@H]2c2ccccc2)ccc1NC(=O)c1cccs1 ZINC000497416816 906891969 /nfs/dbraw/zinc/89/19/69/906891969.db2.gz LLOALBYXTNYFGT-CTNGQTDRSA-N 0 3 419.550 4.136 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)NC[C@@H]3CC4c5ccccc5C3c3ccccc34)[C@@H]2C1 ZINC000497483047 906964601 /nfs/dbraw/zinc/96/46/01/906964601.db2.gz LTYYQIAIKNWPBT-OOTXOBGZSA-N 0 3 401.554 4.019 20 0 HIADHN Cc1ccc(CNC(=O)C2CCN(Cc3ccc(OC(F)(F)F)cc3)CC2)cc1 ZINC000512673489 921283514 /nfs/dbraw/zinc/28/35/14/921283514.db2.gz PAKXLYYDYFOCLO-UHFFFAOYSA-N 0 3 406.448 4.422 20 0 HIADHN COc1ccc([C@H](CNC(=O)[C@@H]2C[C@@H]2c2ccc(F)cc2F)N2CCCC2)cc1 ZINC000497556105 907044858 /nfs/dbraw/zinc/04/48/58/907044858.db2.gz HUVNJSZHQCUXKU-SJBKTWHCSA-N 0 3 400.469 4.030 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)c1ccc(Oc2ccccc2)nc1 ZINC000512703635 921292531 /nfs/dbraw/zinc/29/25/31/921292531.db2.gz GSSGPZASVWHCAT-QFIPXVFZSA-N 0 3 416.525 4.396 20 0 HIADHN COc1cc(C)c([C@H](C)NC(=O)NC[C@H]2CCCN2Cc2ccccc2)cc1OC ZINC000497668525 907166321 /nfs/dbraw/zinc/16/63/21/907166321.db2.gz LIAZCEPOKOLQRW-AZUAARDMSA-N 0 3 411.546 4.037 20 0 HIADHN C[C@H](Sc1nnnn1CCN(C)C)c1ncc(-c2ccc(Cl)cc2Cl)o1 ZINC000512742217 921300197 /nfs/dbraw/zinc/30/01/97/921300197.db2.gz JHLARYIYUNSASV-JTQLQIEISA-N 0 3 413.334 4.050 20 0 HIADHN C[C@H]1[C@@H](NC(=O)NCc2ccc(-c3ccncc3)cc2)CCN1Cc1ccccc1 ZINC000497706995 907211960 /nfs/dbraw/zinc/21/19/60/907211960.db2.gz XZTAKXQSNTYYOX-CYFREDJKSA-N 0 3 400.526 4.211 20 0 HIADHN C[C@@H](NC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1)c1nccn1-c1ccccc1 ZINC000512780316 921310206 /nfs/dbraw/zinc/31/02/06/921310206.db2.gz YRXVCSBTNMFAAX-OFNKIYASSA-N 0 3 417.557 4.239 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)N(C)Cc2cc(F)c(F)c(F)c2)N(C)C)cc1 ZINC000512802915 921314803 /nfs/dbraw/zinc/31/48/03/921314803.db2.gz PUBBGJBCOQVMGF-FQEVSTJZSA-N 0 3 423.479 4.335 20 0 HIADHN Cc1ccc(-c2nc(CC(=O)NC[C@@H](C(C)C)N3CCc4ccccc4C3)cs2)o1 ZINC000512810514 921316921 /nfs/dbraw/zinc/31/69/21/921316921.db2.gz SFTITAARDAPGTD-NRFANRHFSA-N 0 3 423.582 4.453 20 0 HIADHN CC(C)C[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)Nc1cccc(CN(C)C)c1 ZINC000497970330 907440259 /nfs/dbraw/zinc/44/02/59/907440259.db2.gz ZWASKQSIVSHQSC-FQEVSTJZSA-N 0 3 401.938 4.185 20 0 HIADHN COc1ccc([C@@H](CNC(=O)CCc2ccc(OC)c(Cl)c2)N2CCCC2)cc1 ZINC000497993721 907472711 /nfs/dbraw/zinc/47/27/11/907472711.db2.gz IASAKCLQWAPKTA-OAQYLSRUSA-N 0 3 416.949 4.243 20 0 HIADHN CCN(CC(=O)Nc1c(Cl)cccc1Cl)C(=O)c1ccccc1CN(C)C ZINC000498010880 907503150 /nfs/dbraw/zinc/50/31/50/907503150.db2.gz DCWUKZJGSJSXES-UHFFFAOYSA-N 0 3 408.329 4.156 20 0 HIADHN O=C(NCc1ccccc1N1CCCCC1)NC[C@H](c1cccs1)N1CCCC1 ZINC000498110242 907620606 /nfs/dbraw/zinc/62/06/06/907620606.db2.gz AVMSBCYOYVMNGD-OAQYLSRUSA-N 0 3 412.603 4.375 20 0 HIADHN CCOC1CC2(C1)CCN([C@@H](C)C(=O)N(C)Cc1ccc3cc(OC)ccc3c1)C2 ZINC000512835558 921339286 /nfs/dbraw/zinc/33/92/86/921339286.db2.gz XIVDFVDUQSGGPY-KETPHWKMSA-N 0 3 410.558 4.086 20 0 HIADHN C[C@@H](NC(=O)Nc1ccc(OCc2cccc(F)c2)c(F)c1)C1=CCN(C)CC1 ZINC000512838596 921342925 /nfs/dbraw/zinc/34/29/25/921342925.db2.gz ODPUSFJTDIXZQA-OAHLLOKOSA-N 0 3 401.457 4.316 20 0 HIADHN O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)[C@@H]1C[C@@H]1c1cccc(Br)c1 ZINC000498168434 907696741 /nfs/dbraw/zinc/69/67/41/907696741.db2.gz CZQJOQMJBYCBCA-NJDAHSKKSA-N 0 3 413.359 4.333 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)N[C@H](c1cccc(F)c1)c1ccccn1 ZINC000498222755 907753692 /nfs/dbraw/zinc/75/36/92/907753692.db2.gz XNMZOCIMQYAXLA-XMMPIXPASA-N 0 3 418.516 4.058 20 0 HIADHN C[C@@H](SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)NCCN1CCC[C@@H](C)C1 ZINC000498344430 907849719 /nfs/dbraw/zinc/84/97/19/907849719.db2.gz MTROSQXORSGYFC-HZPDHXFCSA-N 0 3 421.994 4.465 20 0 HIADHN O=C(N[C@H](CC1CCC1)c1ccccc1)N[C@H]1CCN(Cc2ccccc2)C[C@H]1CO ZINC000498359886 907856989 /nfs/dbraw/zinc/85/69/89/907856989.db2.gz MWSXSHFQFYIPEE-CCDWMCETSA-N 0 3 421.585 4.100 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)c2oc3c(cccc3C)c2C)CC1 ZINC000498365673 907860104 /nfs/dbraw/zinc/86/01/04/907860104.db2.gz SRTZAQNVRUGXKP-UHFFFAOYSA-N 0 3 405.542 4.117 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)c2ccc(Oc3cccc(Cl)c3)cc2)CC1 ZINC000498422319 907894872 /nfs/dbraw/zinc/89/48/72/907894872.db2.gz IXAIYBZNEMXUCM-GOSISDBHSA-N 0 3 415.965 4.136 20 0 HIADHN C[C@@H](Oc1cccc(Cl)c1Cl)C(=O)N(Cc1ccco1)C1CCN(C)CC1 ZINC000498451951 907916452 /nfs/dbraw/zinc/91/64/52/907916452.db2.gz IRTRJCUOXCKIIL-CQSZACIVSA-N 0 3 411.329 4.477 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N2CCC[C@@](C)(c3ccccc3)CC2)CC1 ZINC000498586603 908039993 /nfs/dbraw/zinc/03/99/93/908039993.db2.gz FHYHRHLXHJOWHR-XMMPIXPASA-N 0 3 401.595 4.029 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)c1ccnc(OCc2ccccc2)c1 ZINC000498710695 908136404 /nfs/dbraw/zinc/13/64/04/908136404.db2.gz LHHNTOPUZDIAIO-UHFFFAOYSA-N 0 3 407.489 4.004 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)N[C@@H](C)c2ccc(-c3ccncc3)cc2)cc1 ZINC000498714792 908140612 /nfs/dbraw/zinc/14/06/12/908140612.db2.gz MIDZREMTVYABHG-MHECFPHRSA-N 0 3 418.541 4.420 20 0 HIADHN C[C@@H](NCc1ccc(-c2ccccc2Br)s1)C1(S(C)(=O)=O)CC1 ZINC000512891097 921384781 /nfs/dbraw/zinc/38/47/81/921384781.db2.gz ODWVHLNIQOBJGP-GFCCVEGCSA-N 0 3 414.390 4.233 20 0 HIADHN COc1cc(C(=O)N2CCN(C)CC[C@H]2C)ccc1OCc1ccccc1Cl ZINC000498732830 908159935 /nfs/dbraw/zinc/15/99/35/908159935.db2.gz BJXDSWJWPZMHTD-MRXNPFEDSA-N 0 3 402.922 4.094 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)NC[C@H]1CCCO[C@H]1c1ccc(C)cc1)c1ccco1 ZINC000498739485 908167931 /nfs/dbraw/zinc/16/79/31/908167931.db2.gz UPBJQCFBIAYSOW-NQAVQENRSA-N 0 3 413.562 4.484 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)NC[C@@H]1CCCO[C@H]1c1ccc(C)cc1)c1ccco1 ZINC000498739484 908168686 /nfs/dbraw/zinc/16/86/86/908168686.db2.gz UPBJQCFBIAYSOW-DXKRWKNPSA-N 0 3 413.562 4.484 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)N2CC[C@@H](CC(F)(F)F)C2)N(C)C)cc1 ZINC000512900935 921392976 /nfs/dbraw/zinc/39/29/76/921392976.db2.gz GARLAMPURDUEJE-MAUKXSAKSA-N 0 3 401.473 4.060 20 0 HIADHN C[C@H](C(=O)N[C@@H](C)c1ccc2c(c1)CCCC2)N1CCC[C@@H](c2nc(C3CC3)n[nH]2)C1 ZINC000498903821 908311898 /nfs/dbraw/zinc/31/18/98/908311898.db2.gz DCUBRDHHLPCUAT-GSHUGGBRSA-N 0 3 421.589 4.006 20 0 HIADHN C[C@H](C(=O)N[C@@H](C)c1ccc2c(c1)CCCC2)N1CCC[C@@H](c2n[nH]c(C3CC3)n2)C1 ZINC000498903821 908311913 /nfs/dbraw/zinc/31/19/13/908311913.db2.gz DCUBRDHHLPCUAT-GSHUGGBRSA-N 0 3 421.589 4.006 20 0 HIADHN O=C(CN1CCC[C@H](c2nc(C3CC3)n[nH]2)C1)N(Cc1ccccc1)c1ccccc1 ZINC000498928538 908338866 /nfs/dbraw/zinc/33/88/66/908338866.db2.gz YCMSOCBIPUQHKQ-NRFANRHFSA-N 0 3 415.541 4.095 20 0 HIADHN O=C(CN1CCC[C@H](c2n[nH]c(C3CC3)n2)C1)N(Cc1ccccc1)c1ccccc1 ZINC000498928538 908338878 /nfs/dbraw/zinc/33/88/78/908338878.db2.gz YCMSOCBIPUQHKQ-NRFANRHFSA-N 0 3 415.541 4.095 20 0 HIADHN CN(C)C(=O)[C@@H]1CCC[C@@H](N[C@@H](c2ccco2)c2ccc(Br)cc2)C1 ZINC000498938773 908345192 /nfs/dbraw/zinc/34/51/92/908345192.db2.gz DVSKYKFYKCPJJP-SZVBFZGTSA-N 0 3 405.336 4.368 20 0 HIADHN Cc1cccc([C@H](NC(=O)N(CCN(C)C)Cc2ccccc2F)c2ccccn2)c1 ZINC000499012216 908387558 /nfs/dbraw/zinc/38/75/58/908387558.db2.gz HIZCLHXMNVJZIZ-DEOSSOPVSA-N 0 3 420.532 4.392 20 0 HIADHN Cc1cccc([C@@H](NC(=O)N(CCN(C)C)Cc2cccs2)c2ccccn2)c1 ZINC000499020502 908394977 /nfs/dbraw/zinc/39/49/77/908394977.db2.gz FBMBVYUNNVRWTI-JOCHJYFZSA-N 0 3 408.571 4.314 20 0 HIADHN CC[C@@H](NC(=O)NC[C@H](c1ccc(OC(C)C)cc1)N(C)C)c1nc2ccccc2[nH]1 ZINC000512913852 921407873 /nfs/dbraw/zinc/40/78/73/921407873.db2.gz XOCAQLULJUGPIY-DENIHFKCSA-N 0 3 423.561 4.403 20 0 HIADHN COc1ccc(C[C@H](NCC(=O)Nc2ccccc2OC)c2ccc(OC)cc2)cc1 ZINC000499055210 908425291 /nfs/dbraw/zinc/42/52/91/908425291.db2.gz VNNROILOTYTAOS-QHCPKHFHSA-N 0 3 420.509 4.225 20 0 HIADHN COc1ccc(COCc2cccc(NC(=O)N[C@H](C)C3=CCN(C)CC3)c2)cc1 ZINC000512916010 921410442 /nfs/dbraw/zinc/41/04/42/921410442.db2.gz AITAYRPVTUJJDI-GOSISDBHSA-N 0 3 409.530 4.184 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)N[C@H](c2cccc(F)c2)c2ccccn2)N(C)C)cc1 ZINC000499086186 908449676 /nfs/dbraw/zinc/44/96/76/908449676.db2.gz YBMOCKDJZBECIR-DNQXCXABSA-N 0 3 420.532 4.475 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2nc(C3CC3)n(-c3ccccc3Cl)n2)N(C)C)cc1 ZINC000499158540 908514380 /nfs/dbraw/zinc/51/43/80/908514380.db2.gz RBRMRALZNUWTJW-HXUWFJFHSA-N 0 3 423.948 4.139 20 0 HIADHN Cc1ccc([C@H](CNC(=O)[C@@H]2C[C@H]2c2cccc(Br)c2)N(C)C)cc1 ZINC000499162379 908516893 /nfs/dbraw/zinc/51/68/93/908516893.db2.gz UVTRTRACAHJHCE-ZCNNSNEGSA-N 0 3 401.348 4.280 20 0 HIADHN Cc1cn(-c2ccccc2Cl)nc1C(=O)NCCCN1CCc2ccccc2C1 ZINC000499189060 908543755 /nfs/dbraw/zinc/54/37/55/908543755.db2.gz FHADLXUHAISAIK-UHFFFAOYSA-N 0 3 408.933 4.012 20 0 HIADHN C[C@H]1CN(C2CC2)C[C@@H]1NC(=O)N1CCc2nc(-c3ccccc3Cl)sc2C1 ZINC000499194202 908548761 /nfs/dbraw/zinc/54/87/61/908548761.db2.gz SAFMRMPPMGDYPL-UGSOOPFHSA-N 0 3 416.978 4.014 20 0 HIADHN CN(C)Cc1ccc(N2CCN(C(=O)c3ccc4c(c3)oc3ccccc34)CC2)nc1 ZINC000512925906 921419815 /nfs/dbraw/zinc/41/98/15/921419815.db2.gz PUPNSEZFIOIEAD-UHFFFAOYSA-N 0 3 414.509 4.005 20 0 HIADHN Cc1ccc(C[C@H]2CCCN2C(=O)CCCN2CCN(c3ccccc3)CC2)cc1 ZINC000499234072 908596496 /nfs/dbraw/zinc/59/64/96/908596496.db2.gz AEZCICSLECFONQ-RUZDIDTESA-N 0 3 405.586 4.131 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)CSc2cccc(Br)c2)CC1 ZINC000499289458 908663302 /nfs/dbraw/zinc/66/33/02/908663302.db2.gz GIXUOSGOEXURBW-UHFFFAOYSA-N 0 3 423.376 4.257 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)N[C@@H](c2cccc(F)c2)c2ccccn2)c1 ZINC000499304280 908675090 /nfs/dbraw/zinc/67/50/90/908675090.db2.gz AKIQAROQHKWYNM-DEOSSOPVSA-N 0 3 420.532 4.392 20 0 HIADHN C[C@H]1C[C@H](NC(=O)N2CCc3nc(-c4ccccc4Cl)sc3C2)CN1C1CC1 ZINC000499304444 908675508 /nfs/dbraw/zinc/67/55/08/908675508.db2.gz RLQCBOBQAYTKGQ-KBPBESRZSA-N 0 3 416.978 4.156 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)N[C@@H](c1cccc(F)c1)c1ccccn1 ZINC000499307634 908680813 /nfs/dbraw/zinc/68/08/13/908680813.db2.gz NMKMTJPENBFAHF-QHCPKHFHSA-N 0 3 424.495 4.223 20 0 HIADHN CC(C)[C@@H](CNC(=O)Cc1coc(-c2ccc(F)cc2)n1)N1CCc2ccccc2C1 ZINC000499389820 908750417 /nfs/dbraw/zinc/75/04/17/908750417.db2.gz QZYRCJCXQABBGJ-HSZRJFAPSA-N 0 3 421.516 4.222 20 0 HIADHN COc1ccc([C@H](CNC(=O)N[C@H](C)c2cccc(F)c2F)N2CCCC2)cc1 ZINC000499477558 908811004 /nfs/dbraw/zinc/81/10/04/908811004.db2.gz BYSHRTHXGNGLMU-QRWLVFNGSA-N 0 3 403.473 4.171 20 0 HIADHN Cc1cc(C(=O)N(C)C2CCN(Cc3ccccc3)CC2)c2c(n1)onc2C(C)C ZINC000499530595 908831557 /nfs/dbraw/zinc/83/15/57/908831557.db2.gz CWVGMYAAPHBSBZ-UHFFFAOYSA-N 0 3 406.530 4.391 20 0 HIADHN O=C(NC[C@@H]1CCCC(F)(F)C1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000499558945 908840406 /nfs/dbraw/zinc/84/04/06/908840406.db2.gz MGMCPHCDFAQMHA-AEFFLSMTSA-N 0 3 404.423 4.383 20 0 HIADHN O=C(NC[C@@H]1CCCC(F)(F)C1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000499558947 908840435 /nfs/dbraw/zinc/84/04/35/908840435.db2.gz MGMCPHCDFAQMHA-SJLPKXTDSA-N 0 3 404.423 4.383 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)NCc2ncoc2-c2ccccc2)N(C)C)cc1 ZINC000499567468 908843007 /nfs/dbraw/zinc/84/30/07/908843007.db2.gz QZIXUCLEMDJPEX-QFIPXVFZSA-N 0 3 422.529 4.231 20 0 HIADHN CCCOc1ccc(CNC(=O)NC[C@@H](c2ccc(OC)cc2)N2CCCC2)cc1 ZINC000499672624 908872615 /nfs/dbraw/zinc/87/26/15/908872615.db2.gz DNJHTXMGJDDAGH-QHCPKHFHSA-N 0 3 411.546 4.120 20 0 HIADHN Cc1nn(-c2ccccc2)c(Oc2cccc(F)c2)c1CN[C@@H]1CCc2c[nH]nc2C1 ZINC000499678579 908874409 /nfs/dbraw/zinc/87/44/09/908874409.db2.gz AYRGZWFHXXFZJU-LJQANCHMSA-N 0 3 417.488 4.482 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)c1cccc([C@H]2CCCOC2)c1 ZINC000499724568 908890983 /nfs/dbraw/zinc/89/09/83/908890983.db2.gz IGTJSSTXROEJSO-FQEVSTJZSA-N 0 3 402.485 4.063 20 0 HIADHN O=C(NCc1cccnc1OC1CCCC1)N[C@H](CN1CCCC1)c1ccccc1 ZINC000499760808 908901070 /nfs/dbraw/zinc/90/10/70/908901070.db2.gz XEAXIXJAMKXREH-JOCHJYFZSA-N 0 3 408.546 4.039 20 0 HIADHN Cc1cc(CCNCc2cc(Br)ccc2OCc2ccccn2)on1 ZINC000513012472 921476758 /nfs/dbraw/zinc/47/67/58/921476758.db2.gz QFGQNCXGHDUHIB-UHFFFAOYSA-N 0 3 402.292 4.052 20 0 HIADHN CCOc1ccc(CN2CCC(C(=O)Nc3cccc(F)c3)CC2)cc1OCC ZINC000513021517 921483998 /nfs/dbraw/zinc/48/39/98/921483998.db2.gz DUJWZNULFPIMMD-UHFFFAOYSA-N 0 3 400.494 4.474 20 0 HIADHN CC(C)(C)n1cc(CNCC2(S(C)(=O)=O)CCCC2)c(-c2ccccc2Cl)n1 ZINC000513022729 921484335 /nfs/dbraw/zinc/48/43/35/921484335.db2.gz XWDAPDHINHCNNM-UHFFFAOYSA-N 0 3 424.010 4.406 20 0 HIADHN COc1ccccc1C[C@H](C)CC(=O)N(CCN(C)C)Cc1ccc(F)cc1F ZINC000499973446 909416302 /nfs/dbraw/zinc/41/63/02/909416302.db2.gz BYYNRPKSKLXZFY-KRWDZBQOSA-N 0 3 404.501 4.133 20 0 HIADHN C[C@@H]1C[C@@H]1c1ccc([C@@H]2C[C@H]2C(=O)N(CCN(C)C)Cc2ccc(F)cc2F)o1 ZINC000499976328 909421252 /nfs/dbraw/zinc/42/12/52/909421252.db2.gz JRYFPKHSGGKVTG-ZWQIFLOQSA-N 0 3 402.485 4.375 20 0 HIADHN CCc1nnc(NC(=O)[C@H](C)[C@@H](C)NCc2ccc(Oc3ccccc3)o2)s1 ZINC000513041876 921501956 /nfs/dbraw/zinc/50/19/56/921501956.db2.gz SSLIGHMOYBTUME-ZIAGYGMSSA-N 0 3 400.504 4.239 20 0 HIADHN CN(C(=O)CCCc1c[nH]c2ccccc12)C1CCN(CCc2ccccn2)CC1 ZINC000500061820 909527509 /nfs/dbraw/zinc/52/75/09/909527509.db2.gz IJYQNKCEUBUSKO-UHFFFAOYSA-N 0 3 404.558 4.051 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N[C@@H](Cn1ccnc1)c1ccc(C)cc1C)c1ccco1 ZINC000500113759 909596305 /nfs/dbraw/zinc/59/63/05/909596305.db2.gz PVFBQWYWYLMJRN-BVSLBCMMSA-N 0 3 423.561 4.263 20 0 HIADHN CN(C)[C@@H](CNC(=O)NCc1ccc(Oc2ccc(F)cc2)nc1)c1ccccc1 ZINC000500124982 909606404 /nfs/dbraw/zinc/60/64/04/909606404.db2.gz OZQAREOUXHNSBY-NRFANRHFSA-N 0 3 408.477 4.115 20 0 HIADHN O=C(Nc1ccccc1)Nc1ccc(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000500152407 909628399 /nfs/dbraw/zinc/62/83/99/909628399.db2.gz PHXZGYPAMINTJX-HSZRJFAPSA-N 0 3 414.509 4.335 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N[C@@H](c1ccco1)c1ccccc1OC)c1ccco1 ZINC000500181772 909677936 /nfs/dbraw/zinc/67/79/36/909677936.db2.gz KFAGMRNPCXUWHP-SGXKBVARSA-N 0 3 411.502 4.399 20 0 HIADHN Cc1ccc(C[C@H]2CCCN2CC(=O)N2CCC(OCc3ccccc3)CC2)cc1 ZINC000500204811 909694557 /nfs/dbraw/zinc/69/45/57/909694557.db2.gz AEDJHDWOSUUABP-XMMPIXPASA-N 0 3 406.570 4.210 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)[C@@H]3C[C@@H]3c3ccc([C@H]4C[C@@H]4C)o3)cc2)CC1 ZINC000500203636 909694593 /nfs/dbraw/zinc/69/45/93/909694593.db2.gz JBQDFDRTQWNMDX-AGOPTVSRSA-N 0 3 407.558 4.283 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@@H](C)N[C@@H](C)c2ccc(SC)cc2)cc1OC ZINC000500226489 909716864 /nfs/dbraw/zinc/71/68/64/909716864.db2.gz QCNWGIJUAKIWAW-JKSUJKDBSA-N 0 3 402.560 4.123 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCCc1nc2c(cccc2C)o1)c1cccc(OC)c1 ZINC000500270917 909750994 /nfs/dbraw/zinc/75/09/94/909750994.db2.gz VNVOQPYTSVTOQE-HXUWFJFHSA-N 0 3 424.545 4.070 20 0 HIADHN C[S@](=O)Cc1ccc(CNCc2cn(-c3ccccc3)nc2-c2ccncc2)cc1 ZINC000513069078 921524462 /nfs/dbraw/zinc/52/44/62/921524462.db2.gz MBUIBTKBKOIDSE-PMERELPUSA-N 0 3 416.550 4.103 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)c2cccc([C@@H]3CCCOC3)c2)cc1 ZINC000500387399 909829170 /nfs/dbraw/zinc/82/91/70/909829170.db2.gz GWPPPQIXGPRPPL-VWNXMTODSA-N 0 3 408.542 4.156 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)c2cc(-c3csc(C)n3)c[nH]2)cc1 ZINC000500392277 909831891 /nfs/dbraw/zinc/83/18/91/909831891.db2.gz IDYPMGJJVGKPPZ-HXUWFJFHSA-N 0 3 410.543 4.022 20 0 HIADHN Brc1cnc(CN[C@@H]2CCCC23CCOCC3)c(Br)c1 ZINC000500424331 909848521 /nfs/dbraw/zinc/84/85/21/909848521.db2.gz DLCUSNXBDBKZJW-CQSZACIVSA-N 0 3 404.146 4.046 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)Cc2c[nH]c3ccc(Cl)cc23)cc1 ZINC000500433918 909854606 /nfs/dbraw/zinc/85/46/06/909854606.db2.gz VFQKBMLSEHOPKB-JOCHJYFZSA-N 0 3 411.933 4.326 20 0 HIADHN Cn1cnc2cc(CNCc3ccc(I)c(Cl)c3)ccc21 ZINC000500448350 909865609 /nfs/dbraw/zinc/86/56/09/909865609.db2.gz QBGDZBSLLKGMLM-UHFFFAOYSA-N 0 3 411.674 4.121 20 0 HIADHN C/C(=C\c1ccccc1C(F)(F)F)CNCc1cccc(C(=O)N2CCOCC2)c1 ZINC000500451602 909868637 /nfs/dbraw/zinc/86/86/37/909868637.db2.gz MIQQZZUKYGJAMA-GHRIWEEISA-N 0 3 418.459 4.371 20 0 HIADHN COc1ccccc1[C@H](NC(=O)N[C@H](C)[C@@H](c1ccccc1)N(C)C)c1ccccn1 ZINC000500525022 909906403 /nfs/dbraw/zinc/90/64/03/909906403.db2.gz IVQGYGHVZPSOAB-DKLXNKCPSA-N 0 3 418.541 4.170 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)N[C@H](c1ccccn1)c1ccccc1OC ZINC000500551728 909923072 /nfs/dbraw/zinc/92/30/72/909923072.db2.gz RPOABAMVSVGVRD-QHCPKHFHSA-N 0 3 410.562 4.087 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N[C@H](C)c1cnn(Cc2ccccc2)c1)c1ccco1 ZINC000500601236 909958339 /nfs/dbraw/zinc/95/83/39/909958339.db2.gz KTTMSJHDOVEDBQ-UEXGIBASSA-N 0 3 409.534 4.014 20 0 HIADHN Cc1cc(Br)ccc1SCC(=O)N(CC(C)C)C1CCN(C)CC1 ZINC000500680393 910017080 /nfs/dbraw/zinc/01/70/80/910017080.db2.gz PAKOZTUQONLALA-UHFFFAOYSA-N 0 3 413.425 4.428 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)c1csc(-c2cccc(Cl)c2)n1 ZINC000500798129 910088072 /nfs/dbraw/zinc/08/80/72/910088072.db2.gz WHTRQMLVELZJGA-UHFFFAOYSA-N 0 3 400.935 4.063 20 0 HIADHN CC[C@@H]1CCCCN1CCNC(=O)N1CCC(C(=O)c2ccc(Cl)cc2)CC1 ZINC000500837389 910113223 /nfs/dbraw/zinc/11/32/23/910113223.db2.gz PHPLOAAANHPUNO-HXUWFJFHSA-N 0 3 405.970 4.209 20 0 HIADHN COc1cc(C(C)=O)ccc1OCCCC(=O)N[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000500835079 910113528 /nfs/dbraw/zinc/11/35/28/910113528.db2.gz CHZWCQOWOSFWCQ-GCJKJVERSA-N 0 3 424.541 4.009 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)C2(c3ccc(Cl)cc3)CCOCC2)C1 ZINC000500852316 910124395 /nfs/dbraw/zinc/12/43/95/910124395.db2.gz MRUXLPMBNDEYNL-XMSQKQJNSA-N 0 3 412.961 4.340 20 0 HIADHN COCCN(Cc1ccc(F)cc1Cl)C(=O)c1cccc(CN2CCCC2)c1 ZINC000500879278 910151627 /nfs/dbraw/zinc/15/16/27/910151627.db2.gz ABCNVCGZRMOREN-UHFFFAOYSA-N 0 3 404.913 4.364 20 0 HIADHN COc1ccc2ccccc2c1CNCCNC(=O)c1cccc(Br)c1 ZINC000500905590 910175094 /nfs/dbraw/zinc/17/50/94/910175094.db2.gz XSLZLHZPDSMCIH-UHFFFAOYSA-N 0 3 413.315 4.131 20 0 HIADHN NC(=O)[C@@H]1CCCN(Cc2ccccc2NC(=O)CCCCCc2cccs2)C1 ZINC000500929510 910190751 /nfs/dbraw/zinc/19/07/51/910190751.db2.gz SVLPKWQSSBCVDT-LJQANCHMSA-N 0 3 413.587 4.187 20 0 HIADHN CC(C)(COCc1ccccc1)NCC(=O)Nc1cc2c(cc1Cl)OCCCO2 ZINC000500957106 910205661 /nfs/dbraw/zinc/20/56/61/910205661.db2.gz JJQPJEHQQHUKBU-UHFFFAOYSA-N 0 3 418.921 4.025 20 0 HIADHN CSc1ccc(C(=O)N(CCN(C)C)Cc2ccc(Br)cc2)cc1 ZINC000500962274 910208074 /nfs/dbraw/zinc/20/80/74/910208074.db2.gz YURPHWHHOSXBPB-UHFFFAOYSA-N 0 3 407.377 4.375 20 0 HIADHN CCn1c(C)cc(C(=O)N(CCN(C)C)Cc2ccc(Br)cc2)c1C ZINC000500963835 910210016 /nfs/dbraw/zinc/21/00/16/910210016.db2.gz JHQFRFDCJQVCJN-UHFFFAOYSA-N 0 3 406.368 4.091 20 0 HIADHN O=C([C@@H]1CC12CCN(Cc1ccccc1OCc1ccncc1)CC2)N1CCCCC1 ZINC000501083832 910282431 /nfs/dbraw/zinc/28/24/31/910282431.db2.gz CZOXGECIIAVTKZ-QHCPKHFHSA-N 0 3 419.569 4.275 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N[C@H](c1cccc(F)c1)c1ccccn1)c1ccco1 ZINC000501087220 910286033 /nfs/dbraw/zinc/28/60/33/910286033.db2.gz LTPNKXPTJFWGAT-SAWYMBPVSA-N 0 3 410.493 4.332 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)N[C@H](c2cccc(F)c2)c2ccccn2)CCN1Cc1ccccc1 ZINC000501111215 910299169 /nfs/dbraw/zinc/29/91/69/910299169.db2.gz AEDFQHUNZLIRQH-RVSNTGDXSA-N 0 3 418.516 4.272 20 0 HIADHN Cc1c(NC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)cccc1C(=O)N1CCCC1 ZINC000501159896 910330090 /nfs/dbraw/zinc/33/00/90/910330090.db2.gz AZFLYMAOYBZBPO-OAQYLSRUSA-N 0 3 420.557 4.017 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)Nc2cccc(C(=O)N3CCCC3)c2C)N(C)C)cc1 ZINC000501163143 910333358 /nfs/dbraw/zinc/33/33/58/910333358.db2.gz IJXHRHZLGCFIML-HSZRJFAPSA-N 0 3 422.573 4.218 20 0 HIADHN CC[C@H](C)NC(=O)CCNCc1cc(Br)ccc1OCc1ccccc1 ZINC000513132346 921574935 /nfs/dbraw/zinc/57/49/35/921574935.db2.gz SPODJTJKMFGFRZ-INIZCTEOSA-N 0 3 419.363 4.423 20 0 HIADHN Cc1cccn2cc(COc3ccc(CN4CCC[C@H](n5cccn5)C4)cc3)nc12 ZINC000513145538 921584441 /nfs/dbraw/zinc/58/44/41/921584441.db2.gz UXRGVXUDQHEPBF-QFIPXVFZSA-N 0 3 401.514 4.255 20 0 HIADHN CCOc1ccc(C(=O)Nc2ccc(CCN3CCSCC3)cc2)cc1OCC ZINC000501406761 910540186 /nfs/dbraw/zinc/54/01/86/910540186.db2.gz AWRDJSAOOXQXKZ-UHFFFAOYSA-N 0 3 414.571 4.328 20 0 HIADHN Cc1cc(NC(=O)c2cnn(CC(C)C)c2C)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000501510599 910621804 /nfs/dbraw/zinc/62/18/04/910621804.db2.gz NGSXGIAFRKOQCJ-NRFANRHFSA-N 0 3 420.561 4.052 20 0 HIADHN FC(F)(F)C(F)(F)COCCN[C@H]1CCOc2c(Br)cccc21 ZINC000501531656 910641696 /nfs/dbraw/zinc/64/16/96/910641696.db2.gz LYOXUQVNKSDXKW-NSHDSACASA-N 0 3 404.173 4.077 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)N[C@@H]2CCCOc3c(Cl)cccc32)cc1 ZINC000501546253 910648731 /nfs/dbraw/zinc/64/87/31/910648731.db2.gz XREDDAVOXAHTIN-UXHICEINSA-N 0 3 417.937 4.164 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)N[C@H]2CCCOc3cc(Cl)ccc32)cc1 ZINC000501555160 910658108 /nfs/dbraw/zinc/65/81/08/910658108.db2.gz NNOYDCFZFHESJH-PMACEKPBSA-N 0 3 417.937 4.164 20 0 HIADHN CCCn1nccc1C1CCN(C[C@H](O)COc2ccc(Cl)cc2Cl)CC1 ZINC000501560057 910665830 /nfs/dbraw/zinc/66/58/30/910665830.db2.gz DLVWVNFXPQFZTR-KRWDZBQOSA-N 0 3 412.361 4.219 20 0 HIADHN Cc1nc([C@@H]2CCCOC2)sc1C(=O)NC[C@]1(C)CCCN1Cc1ccccc1 ZINC000501601141 910707738 /nfs/dbraw/zinc/70/77/38/910707738.db2.gz AKFLXIJZGKEVTA-XXBNENTESA-N 0 3 413.587 4.130 20 0 HIADHN Cc1nc2ccccc2nc1CN[C@@]1(Cc2ccc(C(F)(F)F)cc2)CCOC1 ZINC000513173668 921600935 /nfs/dbraw/zinc/60/09/35/921600935.db2.gz LDVOJBREEOEYNC-OAQYLSRUSA-N 0 3 401.432 4.448 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)Cc2ccc(OCc3ccccn3)cc2)c1 ZINC000501645297 910734183 /nfs/dbraw/zinc/73/41/83/910734183.db2.gz DWVSKZAABHFSKE-UHFFFAOYSA-N 0 3 417.553 4.102 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)Nc1ccc(NC(=O)c2ccco2)cc1 ZINC000501733820 910795523 /nfs/dbraw/zinc/79/55/23/910795523.db2.gz KXNBANZMJZCZLY-UHFFFAOYSA-N 0 3 418.497 4.102 20 0 HIADHN C[C@H](NC(=O)N[C@H]1CCCc2cn(C3CCCC3)nc21)[C@@H](c1ccccc1)N(C)C ZINC000501766714 910822011 /nfs/dbraw/zinc/82/20/11/910822011.db2.gz HJHONABRDFVFJZ-HYVJGQCMSA-N 0 3 409.578 4.366 20 0 HIADHN CCOc1cc2c(cc1NC(=O)N[C@H](CN1CCCC1)c1ccccc1)O[C@@H](C)C2 ZINC000501806978 910858232 /nfs/dbraw/zinc/85/82/32/910858232.db2.gz YZHDUYBFFRCULV-LAUBAEHRSA-N 0 3 409.530 4.367 20 0 HIADHN COc1cccc(C(=O)NC[C@@H](C(C)C)N2CCc3ccccc3C2)c1OC(F)F ZINC000501819586 910867745 /nfs/dbraw/zinc/86/77/45/910867745.db2.gz IJQRLJGBWSSRON-IBGZPJMESA-N 0 3 418.484 4.109 20 0 HIADHN C[C@H](NC(=O)N[C@H](CN1CCCC1)c1ccccc1)c1ccc(NC(=O)C2CC2)cc1 ZINC000501834877 910876407 /nfs/dbraw/zinc/87/64/07/910876407.db2.gz ZTDXPSUOXJQLTH-FDDCHVKYSA-N 0 3 420.557 4.232 20 0 HIADHN CC(C)NC(=O)c1ccc(C(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)cc1 ZINC000502239381 911192588 /nfs/dbraw/zinc/19/25/88/911192588.db2.gz SSEWTRPUGDFXNM-FQEVSTJZSA-N 0 3 413.587 4.089 20 0 HIADHN CCc1ccc([C@H](CNC(=O)c2cc(NC(=O)N(C)C)ccc2Cl)N(C)C)cc1 ZINC000502288822 911245744 /nfs/dbraw/zinc/24/57/44/911245744.db2.gz QYXAHBOXBPTIOG-FQEVSTJZSA-N 0 3 416.953 4.029 20 0 HIADHN CC(=O)Nc1cccc(CN2CCC[C@@H](c3n[nH]cc3NC(=O)c3ccccc3)C2)c1 ZINC000502298545 911257596 /nfs/dbraw/zinc/25/75/96/911257596.db2.gz FUASDJZWMSCQJO-HXUWFJFHSA-N 0 3 417.513 4.000 20 0 HIADHN C[C@@H]1CCCC[C@H]1OCCN1CCC[C@@H](c2n[nH]cc2NC(=O)C2CCCC2)C1 ZINC000502339821 911318944 /nfs/dbraw/zinc/31/89/44/911318944.db2.gz OPOIZAFQXSJJMV-YFVAEKQCSA-N 0 3 402.583 4.313 20 0 HIADHN Cc1cc(Cl)ccc1NC(=O)NCCCN1CCN(C)C[C@@H]1c1ccccc1 ZINC000502354315 911335447 /nfs/dbraw/zinc/33/54/47/911335447.db2.gz MUFSVSKCDWDMPR-OAQYLSRUSA-N 0 3 400.954 4.149 20 0 HIADHN C[C@H](CC(=O)N(C)c1ccccc1)N[C@@H]1CCOc2c(Br)cccc21 ZINC000502369812 911356342 /nfs/dbraw/zinc/35/63/42/911356342.db2.gz UJFJRAGWOARMFD-RDTXWAMCSA-N 0 3 403.320 4.304 20 0 HIADHN CC(C)[C@H](N[C@@H](C)C(=O)N[C@@H](C)c1ccc2c(c1)OCCO2)c1ccc(F)cc1 ZINC000502507318 911510976 /nfs/dbraw/zinc/51/09/76/911510976.db2.gz GTICGSRJCZHNAI-WCJKSRRJSA-N 0 3 400.494 4.150 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1ccc([C@H]2CCCOC2)cc1)c1cccc(OC)c1 ZINC000502526669 911530640 /nfs/dbraw/zinc/53/06/40/911530640.db2.gz NOUQSVHEHCAZOU-UPVQGACJSA-N 0 3 410.558 4.402 20 0 HIADHN COc1ccc([C@@H](CO)N(C)C[C@H](O)COc2cc(C)c(Cl)cc2C(C)C)cc1 ZINC000502547169 911553935 /nfs/dbraw/zinc/55/39/35/911553935.db2.gz TXMDNIUPUBDROA-PGRDOPGGSA-N 0 3 421.965 4.186 20 0 HIADHN COc1cc(C)c([C@@H](C)NC(=O)CN[C@@H](c2ccc(F)cc2)C(C)C)cc1OC ZINC000502578456 911586168 /nfs/dbraw/zinc/58/61/68/911586168.db2.gz JONYGGFNPCFIGT-WAIKUNEKSA-N 0 3 402.510 4.315 20 0 HIADHN CC[C@H]1c2ccsc2CCN1C(=O)CN[C@@]1(Cc2ccc(Cl)cc2)CCOC1 ZINC000502597456 911600218 /nfs/dbraw/zinc/60/02/18/911600218.db2.gz USYGKGDTKGAZHD-SIKLNZKXSA-N 0 3 418.990 4.229 20 0 HIADHN COc1cc([C@@H](C)NC(=O)NC[C@H](Cc2ccccc2)N(C)C)ccc1OC(C)C ZINC000502629419 911657777 /nfs/dbraw/zinc/65/77/77/911657777.db2.gz WZCUULPNVAHHBU-NQIIRXRSSA-N 0 3 413.562 4.016 20 0 HIADHN CSc1nc(-c2ccco2)nc(C)c1C(=O)NC[C@H]1CCCN1Cc1ccccc1 ZINC000513285337 921684232 /nfs/dbraw/zinc/68/42/32/921684232.db2.gz XWZPTUYCJSSFCZ-GOSISDBHSA-N 0 3 422.554 4.161 20 0 HIADHN C[C@@H](NC(=O)N1CCCN(Cc2ccccc2)CC1)c1ccc(NC(=O)C2CC2)cc1 ZINC000502666513 911706550 /nfs/dbraw/zinc/70/65/50/911706550.db2.gz KTDVVJZWKVLQCU-LJQANCHMSA-N 0 3 420.557 4.014 20 0 HIADHN Cc1nc(COc2cccc(C(=O)NC[C@H]3CCCN3Cc3ccccc3)c2)cs1 ZINC000513288292 921686272 /nfs/dbraw/zinc/68/62/72/921686272.db2.gz AWZONPYJSNDKPE-JOCHJYFZSA-N 0 3 421.566 4.425 20 0 HIADHN Cc1nc(COc2cccc(C(=O)NC[C@@H]3CCCN3Cc3ccccc3)c2)cs1 ZINC000513288293 921686670 /nfs/dbraw/zinc/68/66/70/921686670.db2.gz AWZONPYJSNDKPE-QFIPXVFZSA-N 0 3 421.566 4.425 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)N[C@H](CC(F)(F)F)C(C)C)N(C)C)cc1 ZINC000502694509 911731541 /nfs/dbraw/zinc/73/15/41/911731541.db2.gz OFTNKNFSSFSCBO-MSOLQXFVSA-N 0 3 403.489 4.353 20 0 HIADHN CC(C)(NCc1cc(Br)cc2cccnc21)C(=O)NCC1CCCC1 ZINC000502778016 911801669 /nfs/dbraw/zinc/80/16/69/911801669.db2.gz CPXWBCMYJZIMPP-UHFFFAOYSA-N 0 3 404.352 4.172 20 0 HIADHN COCCN1CCC(NC(=O)N[C@H](c2ccccc2C)[C@H]2CCC[C@H](C)C2)CC1 ZINC000502811157 911827800 /nfs/dbraw/zinc/82/78/00/911827800.db2.gz BJXHOHDNBVIRAZ-LEDOBFOHSA-N 0 3 401.595 4.272 20 0 HIADHN O=C(CCC(=O)N1CC[C@]2(C1)CCCN(Cc1ccccc1)C2)c1cccc(F)c1 ZINC000502851347 911861108 /nfs/dbraw/zinc/86/11/08/911861108.db2.gz KNSVJEIWNWRNGZ-RUZDIDTESA-N 0 3 408.517 4.303 20 0 HIADHN Cc1nc(-c2ccccn2)sc1C(=O)Nc1cccc(N2CCN(C(C)C)CC2)c1 ZINC000502880658 911880985 /nfs/dbraw/zinc/88/09/85/911880985.db2.gz HTFLMUDEKGMZME-UHFFFAOYSA-N 0 3 421.570 4.296 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)Cc3cccc(C(F)(F)F)c3)c2)CC1 ZINC000502882477 911882753 /nfs/dbraw/zinc/88/27/53/911882753.db2.gz YOGBRLAFJXTGGP-UHFFFAOYSA-N 0 3 405.464 4.417 20 0 HIADHN Cc1cccc(COc2c(C)cc(CN(C)CC3CCS(=O)(=O)CC3)cc2C)c1 ZINC000502882259 911882847 /nfs/dbraw/zinc/88/28/47/911882847.db2.gz YRGRGDXSBNDAMQ-UHFFFAOYSA-N 0 3 415.599 4.447 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)Cc3csc(-c4ccoc4)n3)c2)CC1 ZINC000502894011 911888378 /nfs/dbraw/zinc/88/83/78/911888378.db2.gz XHDOTGPUWRGMQB-UHFFFAOYSA-N 0 3 410.543 4.115 20 0 HIADHN Cc1c(C(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)cnn1-c1cccc(C)c1 ZINC000502903818 911893006 /nfs/dbraw/zinc/89/30/06/911893006.db2.gz LIVFIWVPQBDQJO-UHFFFAOYSA-N 0 3 417.557 4.272 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N[C@H](c2ccccc2)c2ccncc2)N(C)C)cc1 ZINC000503024788 911996091 /nfs/dbraw/zinc/99/60/91/911996091.db2.gz OHJOFTFYPMPCPS-BJKOFHAPSA-N 0 3 402.542 4.336 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)N[C@H](c1ccccc1)c1ccncc1 ZINC000503026349 911997601 /nfs/dbraw/zinc/99/76/01/911997601.db2.gz SOBARIHZASJVPQ-RBBKRZOGSA-N 0 3 406.555 4.369 20 0 HIADHN CCC(CC)c1cc(CNC(=O)[C@@H]2CN(Cc3ccccc3)CCC2(F)F)on1 ZINC000513320048 921711393 /nfs/dbraw/zinc/71/13/93/921711393.db2.gz IOGZUYZWTQTQRU-IBGZPJMESA-N 0 3 405.489 4.352 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)c1csc(-c2ccc(F)c(F)c2)n1 ZINC000503155118 912119972 /nfs/dbraw/zinc/11/99/72/912119972.db2.gz CYWKCUFUTOZAAK-UHFFFAOYSA-N 0 3 419.472 4.431 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CN1CCC[C@@H](C(=O)Nc2ccccc2)C1 ZINC000506280208 914880832 /nfs/dbraw/zinc/88/08/32/914880832.db2.gz NIPQVKADEHMHOY-JOCHJYFZSA-N 0 3 402.542 4.399 20 0 HIADHN COc1ccc(OC(F)F)c(NC(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)c1 ZINC000506282252 914881959 /nfs/dbraw/zinc/88/19/59/914881959.db2.gz OMEWQTHDURRHNU-GDBMZVCRSA-N 0 3 405.445 4.254 20 0 HIADHN C[C@H](NC(=O)Nc1cccc(CN(C)C)c1)c1ccc(NC(=O)c2ccncc2)cc1 ZINC000506286769 914885011 /nfs/dbraw/zinc/88/50/11/914885011.db2.gz XBSXZYADTPUKJN-KRWDZBQOSA-N 0 3 417.513 4.278 20 0 HIADHN CC(C)Cc1ccc([C@H](CNC(=O)N2CCC3(CCOCC3)CC2)N(C)C)cc1 ZINC000513345718 921728979 /nfs/dbraw/zinc/72/89/79/921728979.db2.gz MYNVYEHJRRIMSK-QFIPXVFZSA-N 0 3 401.595 4.090 20 0 HIADHN CCOCCOCc1cccc(NC(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)c1 ZINC000506293148 914888896 /nfs/dbraw/zinc/88/88/96/914888896.db2.gz DNLWYZYHUUBDBO-AUSIDOKSSA-N 0 3 411.546 4.197 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)Nc2cccc(Cl)c2-n2cccn2)C1 ZINC000506295817 914890775 /nfs/dbraw/zinc/89/07/75/914890775.db2.gz UQFGBGVLMQMYIB-SJLPKXTDSA-N 0 3 409.921 4.483 20 0 HIADHN CNC(=O)c1cccc(CN2CCC[C@@H](c3nc(-c4ccc(Cl)cc4)no3)C2)c1 ZINC000506470971 915068616 /nfs/dbraw/zinc/06/86/16/915068616.db2.gz OGZIVTUOFSUYBH-GOSISDBHSA-N 0 3 410.905 4.129 20 0 HIADHN COc1ccc(Br)c(NC(=O)N2CCN(CC3CCCCC3)CC2)c1 ZINC000506528198 915167998 /nfs/dbraw/zinc/16/79/98/915167998.db2.gz CPJJLOZYLGJSOD-UHFFFAOYSA-N 0 3 410.356 4.188 20 0 HIADHN Cc1noc(C2(C)CCN(Cc3cn(-c4ccccc4)nc3-c3ccncc3)CC2)n1 ZINC000513381521 921755760 /nfs/dbraw/zinc/75/57/60/921755760.db2.gz BHOXQKQDYJNVFL-UHFFFAOYSA-N 0 3 414.513 4.179 20 0 HIADHN CC[C@@H](N[C@@H](C)C(=O)N1CCSc2ccccc21)c1ccc(OC)c(OC)c1 ZINC000506601898 915254842 /nfs/dbraw/zinc/25/48/42/915254842.db2.gz MQJZWRDBETVGGY-DOTOQJQBSA-N 0 3 400.544 4.272 20 0 HIADHN COc1cc(CN2CC[C@H](n3ncc4ccccc43)C2)ccc1OCC(F)(F)F ZINC000513391281 921761381 /nfs/dbraw/zinc/76/13/81/921761381.db2.gz XOFVZNAMFIJQQX-KRWDZBQOSA-N 0 3 405.420 4.433 20 0 HIADHN COc1cc(CN2CC[C@@H](n3ncc4ccccc43)C2)ccc1OCC(F)(F)F ZINC000513391283 921762168 /nfs/dbraw/zinc/76/21/68/921762168.db2.gz XOFVZNAMFIJQQX-QGZVFWFLSA-N 0 3 405.420 4.433 20 0 HIADHN Cn1cc(CN2CCC[C@@H](c3nnc4n3CCCCC4)C2)c(-c2ccccc2Cl)n1 ZINC000506652272 915323881 /nfs/dbraw/zinc/32/38/81/915323881.db2.gz DVXAPDVENPVNNN-QGZVFWFLSA-N 0 3 424.980 4.438 20 0 HIADHN COC(=O)C(C)(C)CCN[C@@H](C)C(=O)Nc1ccccc1Sc1ccccc1 ZINC000506659796 915334314 /nfs/dbraw/zinc/33/43/14/915334314.db2.gz GEGYDLPYIVLHTI-INIZCTEOSA-N 0 3 400.544 4.344 20 0 HIADHN CC[C@H](N[C@H](C)C(=O)N[C@@H](C)c1ccccc1OC)c1ccc(OC)c(OC)c1 ZINC000506663516 915339402 /nfs/dbraw/zinc/33/94/02/915339402.db2.gz SAKOLXXYXXRMQU-FCEWJHQRSA-N 0 3 400.519 4.019 20 0 HIADHN O=C(N[C@H]1COc2cc(F)c(Br)cc21)c1cccc(CN2CCCC2)c1 ZINC000506675102 915351528 /nfs/dbraw/zinc/35/15/28/915351528.db2.gz ZRNGZDIFFJHFEG-SFHVURJKSA-N 0 3 419.294 4.048 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)NC1CC(C(F)(F)F)C1 ZINC000513397420 921767514 /nfs/dbraw/zinc/76/75/14/921767514.db2.gz UZHNUQGBDOXSLG-UHFFFAOYSA-N 0 3 411.390 4.120 20 0 HIADHN CCc1ccc([C@@H]2CCCN(C[C@H](O)COc3ccc(C(C)=O)cc3OC)C2)cc1 ZINC000513406916 921775327 /nfs/dbraw/zinc/77/53/27/921775327.db2.gz ZEOYVBNXZHQZPY-PKTZIBPZSA-N 0 3 411.542 4.080 20 0 HIADHN Cc1nn(C)c2nc(-c3cccs3)cc(C(=O)Nc3cccc(CN(C)C)c3)c12 ZINC000506782653 915506315 /nfs/dbraw/zinc/50/63/15/915506315.db2.gz REXIUNJXZWNVPJ-UHFFFAOYSA-N 0 3 405.527 4.319 20 0 HIADHN CCOc1cc(CN(Cc2cccs2)C(C)C)ccc1O[C@@H](C)C(=O)N(C)C ZINC000507020893 915826755 /nfs/dbraw/zinc/82/67/55/915826755.db2.gz KOSAJAAULXRVOX-KRWDZBQOSA-N 0 3 404.576 4.413 20 0 HIADHN CC1CCN([C@@H](CNC(=O)c2cn(C)nc2-c2cccs2)c2cccs2)CC1 ZINC000507037312 915834150 /nfs/dbraw/zinc/83/41/50/915834150.db2.gz RTGNWSGWUDJSQU-KRWDZBQOSA-N 0 3 414.600 4.413 20 0 HIADHN CCCn1nccc1C1CCN(C(=O)NC[C@@H](c2ccc(CC)cc2)N(C)C)CC1 ZINC000507036032 915834728 /nfs/dbraw/zinc/83/47/28/915834728.db2.gz HLSHLQBRHHQVOF-QHCPKHFHSA-N 0 3 411.594 4.047 20 0 HIADHN CC(C)(C)[C@@H](NCC(=O)NCc1ccccc1Cn1cccn1)c1ccc(F)cc1 ZINC000507041777 915836405 /nfs/dbraw/zinc/83/64/05/915836405.db2.gz VOQSRUJILZHECL-QHCPKHFHSA-N 0 3 408.521 4.064 20 0 HIADHN CCOCCCNC(=O)C1CCN(Cc2ccc(-c3cccc(F)c3C)o2)CC1 ZINC000507133556 915883032 /nfs/dbraw/zinc/88/30/32/915883032.db2.gz AFBVCVPNYRBMKF-UHFFFAOYSA-N 0 3 402.510 4.149 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)CN2CC[C@@H](c3ccccc3C)C2)cc1OC ZINC000507218566 915969880 /nfs/dbraw/zinc/96/98/80/915969880.db2.gz LGOSAAXRUFFEMQ-IRLDBZIGSA-N 0 3 408.542 4.165 20 0 HIADHN CC(C)c1c(C(=O)NCCN2CCCC[C@@H]2C)cnn1-c1ccc(C(F)(F)F)cn1 ZINC000507337032 916092423 /nfs/dbraw/zinc/09/24/23/916092423.db2.gz AVHPIENZRVZLPP-HNNXBMFYSA-N 0 3 423.483 4.014 20 0 HIADHN CN1CCC[C@@H](CNC(=O)c2cc(C3CC3)no2)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000507356668 916111024 /nfs/dbraw/zinc/11/10/24/916111024.db2.gz HOSDCVXERHDQCR-HNAYVOBHSA-N 0 3 407.436 4.384 20 0 HIADHN CC[C@H](CSc1ccccc1)NC(=O)N(Cc1ccco1)C1CCN(C)CC1 ZINC000507436411 916205780 /nfs/dbraw/zinc/20/57/80/916205780.db2.gz URSQUDZRMPHBDB-GOSISDBHSA-N 0 3 401.576 4.456 20 0 HIADHN COCCSc1ccc([C@H](C)N[C@@H](C)C(=O)N[C@@H]2CCOc3ccccc32)cc1 ZINC000507449445 916220324 /nfs/dbraw/zinc/22/03/24/916220324.db2.gz HXNIWZPMBXYWEG-XGHQBKJUSA-N 0 3 414.571 4.104 20 0 HIADHN COCCSc1ccc([C@@H](C)N[C@H](C)C(=O)N(C)Cc2ccccc2C)cc1 ZINC000507567040 916322037 /nfs/dbraw/zinc/32/20/37/916322037.db2.gz MLZRSALVUFZWSC-RTBURBONSA-N 0 3 400.588 4.431 20 0 HIADHN CCCN(CC(=O)Nc1ccc(C)cc1F)C1CCN(C(=O)c2ccccc2)CC1 ZINC000507577528 916330373 /nfs/dbraw/zinc/33/03/73/916330373.db2.gz JFNHQZILYZFPOP-UHFFFAOYSA-N 0 3 411.521 4.089 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)[C@H](C)c3ccccc3F)c(OCC)c2)CC1 ZINC000507610257 916367773 /nfs/dbraw/zinc/36/77/73/916367773.db2.gz JAZZOQGBVQOTJY-GOSISDBHSA-N 0 3 413.537 4.499 20 0 HIADHN C[C@@H](N[C@@H]1CCc2nnc(-c3ccc(F)cc3)n2C1)c1nc2ccc(Cl)cc2n1C ZINC000507609998 916368705 /nfs/dbraw/zinc/36/87/05/916368705.db2.gz GULZWSBQABEKEV-CXAGYDPISA-N 0 3 424.911 4.290 20 0 HIADHN CC[C@@H]1C[C@H](CN2CCN(Cc3csc(-c4ccc(OC)cc4)n3)CC2)CCO1 ZINC000507615850 916374377 /nfs/dbraw/zinc/37/43/77/916374377.db2.gz BNCFMPVXTJUOHR-WIYYLYMNSA-N 0 3 415.603 4.142 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)CCCc2nc(-c3ccc(F)cc3)no2)C1 ZINC000507616993 916376018 /nfs/dbraw/zinc/37/60/18/916376018.db2.gz MWUDGBXXIIWNMD-LAUBAEHRSA-N 0 3 422.504 4.150 20 0 HIADHN Cc1noc([C@@H]2CCCN(C[C@H](O)CO[C@H](c3ccccc3)c3ccccc3C)C2)n1 ZINC000507688167 916459506 /nfs/dbraw/zinc/45/95/06/916459506.db2.gz OXZUTCLQTXWTNJ-AOHZBQACSA-N 0 3 421.541 4.033 20 0 HIADHN Clc1cnn(C2CCN(CC3=Cc4cc(Br)ccc4OC3)CC2)c1 ZINC000507713095 916505289 /nfs/dbraw/zinc/50/52/89/916505289.db2.gz HUEPPYLLQFGEGA-UHFFFAOYSA-N 0 3 408.727 4.412 20 0 HIADHN CC[C@H](C)N(CC(=O)N1CCC[C@H]1c1ccc2c(c1)OCCO2)Cc1ccccc1 ZINC000507724329 916518955 /nfs/dbraw/zinc/51/89/55/916518955.db2.gz IFSDIVCLAPEZCI-UGKGYDQZSA-N 0 3 408.542 4.422 20 0 HIADHN O=C(Nc1ccc(-n2ccnc2)c(F)c1)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000507749774 916539391 /nfs/dbraw/zinc/53/93/91/916539391.db2.gz TZTPOKZNRMWUFI-SFHVURJKSA-N 0 3 414.431 4.107 20 0 HIADHN CC[C@@H]1C[C@H](C[N@H+](C)Cc2cccc([N-]S(=O)(=O)c3ccccc3)c2)CCO1 ZINC000507776620 916560668 /nfs/dbraw/zinc/56/06/68/916560668.db2.gz OCWCWTXLDXUVPG-TZIWHRDSSA-N 0 3 402.560 4.124 20 0 HIADHN CC[C@@H]1C[C@H](C[N@@H+](C)Cc2cccc([N-]S(=O)(=O)c3ccccc3)c2)CCO1 ZINC000507776620 916560689 /nfs/dbraw/zinc/56/06/89/916560689.db2.gz OCWCWTXLDXUVPG-TZIWHRDSSA-N 0 3 402.560 4.124 20 0 HIADHN COc1ccc(NC(=O)[C@H](NCCc2c[nH]c3ncccc23)c2ccccc2)cc1 ZINC000507809526 916597123 /nfs/dbraw/zinc/59/71/23/916597123.db2.gz GDACZCHWFIMWEI-JOCHJYFZSA-N 0 3 400.482 4.084 20 0 HIADHN CCS(=O)(=O)c1ccc(N2CCC(N[C@H]3CCc4c3c(F)ccc4F)CC2)cc1 ZINC000507810073 916597495 /nfs/dbraw/zinc/59/74/95/916597495.db2.gz SXRPTVCCSLJWFC-NRFANRHFSA-N 0 3 420.525 4.004 20 0 HIADHN COc1ccc(NC(=O)[C@@H](NCCc2c[nH]c3ncccc23)c2ccccc2)cc1 ZINC000507809528 916598154 /nfs/dbraw/zinc/59/81/54/916598154.db2.gz GDACZCHWFIMWEI-QFIPXVFZSA-N 0 3 400.482 4.084 20 0 HIADHN CN1CCN(C(=O)c2ccc(CN[C@H]3CCc4c3cc(Cl)cc4Cl)cc2)CC1 ZINC000507813736 916607243 /nfs/dbraw/zinc/60/72/43/916607243.db2.gz SPJTXGPVKFDRIQ-NRFANRHFSA-N 0 3 418.368 4.158 20 0 HIADHN CN1C(=O)C[C@@H](NCc2ccc(OCc3cccnc3)cc2)[C@H]1c1ccc(Cl)cc1 ZINC000507819921 916615240 /nfs/dbraw/zinc/61/52/40/916615240.db2.gz VDDFDKBZXQUWMB-ISKFKSNPSA-N 0 3 421.928 4.376 20 0 HIADHN CN1C(=O)C[C@@H](NCc2ccc(OCc3ccccn3)cc2)[C@H]1c1ccc(Cl)cc1 ZINC000507834904 916641294 /nfs/dbraw/zinc/64/12/94/916641294.db2.gz VEAVPNCGETYILX-ISKFKSNPSA-N 0 3 421.928 4.376 20 0 HIADHN Fc1ccc(-c2nnc3n2C[C@H](NCc2ccc(-c4ccncc4)cc2F)CC3)cc1 ZINC000507879294 916719310 /nfs/dbraw/zinc/71/93/10/916719310.db2.gz YMTSVCUNVZTUFR-OAQYLSRUSA-N 0 3 417.463 4.390 20 0 HIADHN Cn1cc(CN2CCC(Oc3ccccc3)CC2)c(-c2ccc3c(c2)OCCCO3)n1 ZINC000507993957 916835286 /nfs/dbraw/zinc/83/52/86/916835286.db2.gz BIOKDXPKMPQXBG-UHFFFAOYSA-N 0 3 419.525 4.292 20 0 HIADHN Cc1ccc(NC(=O)[C@@H]2CCCN(Cc3ccc(OCc4cccnc4)cc3)C2)nc1 ZINC000508012728 916850030 /nfs/dbraw/zinc/85/00/30/916850030.db2.gz LQYRDYXPNYASRP-JOCHJYFZSA-N 0 3 416.525 4.215 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(C)c1CN1CCC[C@H](C(=O)Nc2cccc(C)n2)C1 ZINC000508029032 916863700 /nfs/dbraw/zinc/86/37/00/916863700.db2.gz RRIACJRHUZZJAQ-IBGZPJMESA-N 0 3 421.520 4.182 20 0 HIADHN Cc1ccc(OC2CCN(Cc3c[nH]nc3-c3ccc4c(c3)OCCO4)CC2)cc1 ZINC000508040351 916869327 /nfs/dbraw/zinc/86/93/27/916869327.db2.gz LCNMIKSBUPXGMC-UHFFFAOYSA-N 0 3 405.498 4.200 20 0 HIADHN CC(C)c1cccc(O[C@@H](C)C(=O)Nc2cccc(CN3CCC(CO)CC3)c2)c1 ZINC000508071992 916893252 /nfs/dbraw/zinc/89/32/52/916893252.db2.gz PTCYYBMEHLTLSW-IBGZPJMESA-N 0 3 410.558 4.420 20 0 HIADHN Cc1cc(C(=O)NC2CCN([C@@H](C)c3ccncc3)CC2)c(C)cc1Br ZINC000508142341 916963267 /nfs/dbraw/zinc/96/32/67/916963267.db2.gz KLPHVDGBKBBHDO-INIZCTEOSA-N 0 3 416.363 4.416 20 0 HIADHN FC(F)Cn1cc(CN2CCC[C@H](c3nc(-c4ccc(Cl)cc4)no3)C2)cn1 ZINC000508161895 916983525 /nfs/dbraw/zinc/98/35/25/916983525.db2.gz LRYIXISFXVPYHD-HNNXBMFYSA-N 0 3 407.852 4.231 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)N1CCC[C@H]1/C=C\c1ccccc1 ZINC000508296486 917105307 /nfs/dbraw/zinc/10/53/07/917105307.db2.gz DBCILZRICARHPZ-UMHMGIAYSA-N 0 3 419.569 4.031 20 0 HIADHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)[C@H]1CC[C@H](C(F)(F)F)C1 ZINC000508535385 917315947 /nfs/dbraw/zinc/31/59/47/917315947.db2.gz SSJVTLPGYVTYLJ-GJZGRUSLSA-N 0 3 421.301 4.318 20 0 HIADHN NC(=O)CC1CCN(Cc2cn(Cc3ccccc3)nc2-c2ccc(Cl)cc2)CC1 ZINC000508594528 917364770 /nfs/dbraw/zinc/36/47/70/917364770.db2.gz JXBRATJQMYUGSK-UHFFFAOYSA-N 0 3 422.960 4.339 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)NCCCc1c[nH]c2ccc(F)cc12 ZINC000508619083 917386339 /nfs/dbraw/zinc/38/63/39/917386339.db2.gz FSFGXQHZXDDGBI-UHFFFAOYSA-N 0 3 402.539 4.075 20 0 HIADHN CC[C@H](C)NC(=O)[C@@H]1C[C@H](C)N(Cc2nc(-c3ccco3)no2)[C@H]2CCCC[C@H]12 ZINC000508679808 917443803 /nfs/dbraw/zinc/44/38/03/917443803.db2.gz SXRCENPCBKBVJZ-AVEIZBFRSA-N 0 3 400.523 4.014 20 0 HIADHN CCN(CC)C(=O)Nc1ccc([C@@H](C)NCc2ccccc2Cn2cncn2)cc1 ZINC000508741138 917500142 /nfs/dbraw/zinc/50/01/42/917500142.db2.gz VBKZNNCQOJNCMR-GOSISDBHSA-N 0 3 406.534 4.051 20 0 HIADHN CCN(CC1CCN(c2ccccn2)CC1)C(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C ZINC000508857339 917611890 /nfs/dbraw/zinc/61/18/90/917611890.db2.gz WWYCTJWVOGNULM-RDPSFJRHSA-N 0 3 423.605 4.021 20 0 HIADHN C[C@@H](NC(=O)N1CCC(c2c[nH]c3ncccc23)CC1)[C@@H](c1ccccc1)N(C)C ZINC000508869543 917623420 /nfs/dbraw/zinc/62/34/20/917623420.db2.gz YFYASYXAAJHVPJ-VGSWGCGISA-N 0 3 405.546 4.143 20 0 HIADHN C[C@@H](NC(=O)N1CCC(c2c[nH]c3ncccc23)CC1)[C@H](c1ccccc1)N(C)C ZINC000508869542 917623715 /nfs/dbraw/zinc/62/37/15/917623715.db2.gz YFYASYXAAJHVPJ-VGOFRKELSA-N 0 3 405.546 4.143 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)cc1OC ZINC000508880331 917634030 /nfs/dbraw/zinc/63/40/30/917634030.db2.gz LGBWAFSMPKLECE-KPDCDPCYSA-N 0 3 411.546 4.242 20 0 HIADHN Cc1nc2ccccc2n1C1CCN(C(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)CC1 ZINC000508891789 917645338 /nfs/dbraw/zinc/64/53/38/917645338.db2.gz CDPIYCHXRVBDHU-KOSHJBKYSA-N 0 3 419.573 4.383 20 0 HIADHN C[C@@H](NC(=O)N(C)Cc1ccc(Br)cc1)[C@H](c1ccccc1)N(C)C ZINC000508891279 917646221 /nfs/dbraw/zinc/64/62/21/917646221.db2.gz BHUIDQNVDUDZJI-DNVCBOLYSA-N 0 3 404.352 4.282 20 0 HIADHN C[C@@H](NC(=O)N(CCO)Cc1ccc(Cl)c(Cl)c1)[C@H](c1ccccc1)N(C)C ZINC000508893935 917649268 /nfs/dbraw/zinc/64/92/68/917649268.db2.gz JPYAXTCPYMWASE-FOIQADDNSA-N 0 3 424.372 4.189 20 0 HIADHN C[C@H](NC(=O)N(CCCO)[C@@H]1CCCc2ccccc21)[C@H](c1ccccc1)N(C)C ZINC000508894227 917649616 /nfs/dbraw/zinc/64/96/16/917649616.db2.gz FYLDZKTXYWSXBV-WUMKDDEVSA-N 0 3 409.574 4.149 20 0 HIADHN C[C@H](NC(=O)N1CCOC[C@@H]1c1nc2ccccc2s1)[C@H](c1ccccc1)N(C)C ZINC000508898050 917652858 /nfs/dbraw/zinc/65/28/58/917652858.db2.gz ORENMOVVNDYGRX-LDQXTDLNSA-N 0 3 424.570 4.071 20 0 HIADHN C[C@@H](NC(=O)N1CCC(OCCc2ccccc2)CC1)[C@H](c1ccccc1)N(C)C ZINC000508902384 917658710 /nfs/dbraw/zinc/65/87/10/917658710.db2.gz DBNWMXRGAFFKIT-HYBUGGRVSA-N 0 3 409.574 4.111 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)c(OC)c1 ZINC000508905493 917662299 /nfs/dbraw/zinc/66/22/99/917662299.db2.gz LKAFTBCGHBCQDW-FHZYATBESA-N 0 3 411.546 4.242 20 0 HIADHN COc1cc(CN(C)C(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)ccc1SC ZINC000508907776 917663367 /nfs/dbraw/zinc/66/33/67/917663367.db2.gz QZTJXTYHNAZMMO-IERDGZPVSA-N 0 3 401.576 4.250 20 0 HIADHN C[C@H](NC(=O)N1CCO[C@@H](c2ccc(F)cc2Cl)C1)[C@H](c1ccccc1)N(C)C ZINC000508907767 917663982 /nfs/dbraw/zinc/66/39/82/917663982.db2.gz QZGYLSWZVFKGCF-IWMITWMQSA-N 0 3 419.928 4.253 20 0 HIADHN C[C@H](NC(=O)N1CCC(C(F)(F)F)(C(F)(F)F)C1)[C@H](c1ccccc1)N(C)C ZINC000508909047 917665582 /nfs/dbraw/zinc/66/55/82/917665582.db2.gz UHPZSEOUTBOSDI-GXTWGEPZSA-N 0 3 411.390 4.204 20 0 HIADHN CC(=O)Nc1cc(NC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)ccc1C ZINC000508948379 917705392 /nfs/dbraw/zinc/70/53/92/917705392.db2.gz LRHNAYCKSMHRQV-NRFANRHFSA-N 0 3 419.447 4.347 20 0 HIADHN Cc1nc2sccn2c(=O)c1CCN1CCC[C@@H]1c1nc2ccccc2n1C(C)C ZINC000509027525 917782334 /nfs/dbraw/zinc/78/23/34/917782334.db2.gz FKUZMWGIEVJKTO-HXUWFJFHSA-N 0 3 421.570 4.375 20 0 HIADHN COc1ccc([C@@H]2CCN(C(=O)[C@H]3CN(Cc4ccccc4)CCC3(F)F)C2)cc1 ZINC000509072106 917816962 /nfs/dbraw/zinc/81/69/62/917816962.db2.gz WUBCGWWRJNZDLH-IFMALSPDSA-N 0 3 414.496 4.169 20 0 HIADHN O=C(N1CC2C[C@@H]3CC1C[C@H](C2)C3)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000509124000 917856722 /nfs/dbraw/zinc/85/67/22/917856722.db2.gz NIUMIIGZANBWMR-LRAOBDPGSA-N 0 3 406.492 4.478 20 0 HIADHN O=C(N1CC[C@@H](c2ccccc2)C1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000509142365 917867575 /nfs/dbraw/zinc/86/75/75/917867575.db2.gz VHYAYCNBXXWFOA-IFMALSPDSA-N 0 3 402.460 4.457 20 0 HIADHN CCCN(C(=O)c1ccccc1OCCOC)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000509179636 917890541 /nfs/dbraw/zinc/89/05/41/917890541.db2.gz APUISLMRTHRYAD-JOCHJYFZSA-N 0 3 410.558 4.229 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)c1cc(N(C)C)nc2ccccc21 ZINC000509200459 917904538 /nfs/dbraw/zinc/90/45/38/917904538.db2.gz MTOOYGGNLNYDDK-IBGZPJMESA-N 0 3 402.542 4.037 20 0 HIADHN O=C(Nc1ccc(Cl)cn1)C1CCN(Cc2ccc(OCC(F)F)cc2)CC1 ZINC000509340852 918006878 /nfs/dbraw/zinc/00/68/78/918006878.db2.gz CTCOTDLSNRSIAD-UHFFFAOYSA-N 0 3 409.864 4.230 20 0 HIADHN Cc1noc([C@@H]2CCCN(Cc3ccc(OCc4cn5cccc(C)c5n4)cc3)C2)n1 ZINC000509359619 918024451 /nfs/dbraw/zinc/02/44/51/918024451.db2.gz SVGNLCGIPKUTSX-HXUWFJFHSA-N 0 3 417.513 4.293 20 0 HIADHN COc1cc(CN2CCC[C@@H](c3nc(C)no3)C2)ccc1OCc1ccc(F)cc1 ZINC000509367319 918031758 /nfs/dbraw/zinc/03/17/58/918031758.db2.gz RVJLDHHSLCPWHO-LJQANCHMSA-N 0 3 411.477 4.484 20 0 HIADHN COCCCOc1cccc(CN2CCC[C@@H](C(=O)Nc3ccc(Cl)cn3)C2)c1 ZINC000509404758 918069466 /nfs/dbraw/zinc/06/94/66/918069466.db2.gz SGWUSJYEDJEYHH-GOSISDBHSA-N 0 3 417.937 4.001 20 0 HIADHN COc1cc2c(cc1F)CC[C@H]2NCc1cn(C)nc1-c1ccc2c(c1)OCCCO2 ZINC000509412108 918075633 /nfs/dbraw/zinc/07/56/33/918075633.db2.gz YTTYKIRRYJLUOV-HXUWFJFHSA-N 0 3 423.488 4.173 20 0 HIADHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)c1coc(C2CCCC2)n1 ZINC000509427958 918087905 /nfs/dbraw/zinc/08/79/05/918087905.db2.gz BPILGHAUMPHYLQ-UHFFFAOYSA-N 0 3 420.351 4.299 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)c1ccc(Cl)c2ncccc12 ZINC000509444216 918098172 /nfs/dbraw/zinc/09/81/72/918098172.db2.gz MXUNOJKMQYGPCG-UHFFFAOYSA-N 0 3 403.860 4.370 20 0 HIADHN CS(=O)(=O)CC1(CNCc2ccc(-c3ccccc3Br)cc2)CC1 ZINC000509461181 918111257 /nfs/dbraw/zinc/11/12/57/918111257.db2.gz BSTSYGJUJLHGIM-UHFFFAOYSA-N 0 3 408.361 4.031 20 0 HIADHN Cc1ccc(C)n1-c1nc(CC(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)cs1 ZINC000509509733 918156828 /nfs/dbraw/zinc/15/68/28/918156828.db2.gz REBDFURLDGJARB-UYAOXDASSA-N 0 3 408.571 4.045 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)CCCc2nc(-c3cccs3)no2)C1 ZINC000509516976 918164840 /nfs/dbraw/zinc/16/48/40/918164840.db2.gz PHKHSAPYETXXBG-FUHWJXTLSA-N 0 3 410.543 4.073 20 0 HIADHN Brc1cccc(-c2ccc(CN3CCN(C4CCOCC4)CC3)s2)c1 ZINC000509545204 918194645 /nfs/dbraw/zinc/19/46/45/918194645.db2.gz RKMHKJSTDGZKJU-UHFFFAOYSA-N 0 3 421.404 4.474 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N1CCC(Nc2ccc(F)cc2)CC1)c1ccco1 ZINC000509570204 918220412 /nfs/dbraw/zinc/22/04/12/918220412.db2.gz OSWOVWRDXAZEMD-OXJNMPFZSA-N 0 3 402.514 4.134 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)N1CCC(Nc2ccc(F)cc2)CC1)c1ccco1 ZINC000509570208 918222123 /nfs/dbraw/zinc/22/21/23/918222123.db2.gz OSWOVWRDXAZEMD-UZLBHIALSA-N 0 3 402.514 4.134 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N(Cc1ccc(F)cc1)C1CCOCC1)c1ccco1 ZINC000509574867 918224315 /nfs/dbraw/zinc/22/43/15/918224315.db2.gz UDWAVSPCXCEBSV-UWJYYQICSA-N 0 3 417.525 4.239 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)N1CCC(Nc2cccc(OC)c2)CC1)c1ccco1 ZINC000509575072 918225512 /nfs/dbraw/zinc/22/55/12/918225512.db2.gz VDHRMKYTZAUGMM-DYESRHJHSA-N 0 3 414.550 4.004 20 0 HIADHN COc1cc(CN2CCC(C(=O)N(C)C(C)C)CC2)ccc1OCc1cccs1 ZINC000509577942 918226987 /nfs/dbraw/zinc/22/69/87/918226987.db2.gz FBUALNSMGZAHCN-UHFFFAOYSA-N 0 3 416.587 4.415 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)NC(C)(C)c1nc(C(F)(F)F)cs1)c1ccco1 ZINC000509579827 918227764 /nfs/dbraw/zinc/22/77/64/918227764.db2.gz XARBQFUNUFXMNX-VXGBXAGGSA-N 0 3 418.485 4.419 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N1CC[C@@H](C(F)(F)F)C2(CCC2)C1)c1ccco1 ZINC000509592646 918240089 /nfs/dbraw/zinc/24/00/89/918240089.db2.gz UNVPSQMVCAQTDU-ZMSDIMECSA-N 0 3 401.473 4.473 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N1CC[C@@H](Oc2ccccc2Cl)C1)c1ccco1 ZINC000509611980 918259180 /nfs/dbraw/zinc/25/91/80/918259180.db2.gz VZWPDGBIPAQVGH-JZXOWHBKSA-N 0 3 405.926 4.225 20 0 HIADHN CC[C@H](NC(=O)N(Cc1ccco1)C1CCN(C)CC1)c1ccc(OC)c(OC)c1 ZINC000509611977 918259249 /nfs/dbraw/zinc/25/92/49/918259249.db2.gz VZWHWNMTDQEZDB-FQEVSTJZSA-N 0 3 415.534 4.054 20 0 HIADHN CCc1nc2c(s1)[C@H](N(C)C(=O)NC[C@H](N[C@@H](C)CC)c1ccco1)CCC2 ZINC000509615379 918264539 /nfs/dbraw/zinc/26/45/39/918264539.db2.gz UTNIJWTUIWWMGP-BHYGNILZSA-N 0 3 404.580 4.447 20 0 HIADHN Fc1ccc([C@H]2CN(CCCN3CCN(c4ccccc4)CC3)CCO2)cc1Cl ZINC000509668642 918301153 /nfs/dbraw/zinc/30/11/53/918301153.db2.gz VBESFLHUEPJYFT-HSZRJFAPSA-N 0 3 417.956 4.065 20 0 HIADHN CCOC[C@H]1CCCN([C@H]2CCCN(c3c(C)cc(Br)cc3C)C2=O)C1 ZINC000509701113 918331301 /nfs/dbraw/zinc/33/13/01/918331301.db2.gz UULIGQCJXFWWCF-HKUYNNGSSA-N 0 3 423.395 4.310 20 0 HIADHN O=C(N[C@H](C[C@@H]1CCOC1)c1ccccc1)N[C@H](CN1CCCC1)c1ccccc1 ZINC000509751273 918369049 /nfs/dbraw/zinc/36/90/49/918369049.db2.gz MXWBZDKXQAXLTA-TUACAJSNSA-N 0 3 407.558 4.291 20 0 HIADHN Cc1nc2sccn2c(=O)c1CCN(Cc1cccs1)Cc1cccs1 ZINC000509821423 918424558 /nfs/dbraw/zinc/42/45/58/918424558.db2.gz UUMNFQHTPCGVJE-UHFFFAOYSA-N 0 3 401.582 4.432 20 0 HIADHN CCOc1ccc(CN(C(=O)NCC2(N3CCSCC3)CCCC2)C(C)C)cc1 ZINC000509825003 918426023 /nfs/dbraw/zinc/42/60/23/918426023.db2.gz CLYXXUOZABEQED-UHFFFAOYSA-N 0 3 419.635 4.367 20 0 HIADHN Cc1cccc([C@H](CNCc2ccc(Sc3ccccn3)o2)N2CCOCC2)c1 ZINC000509863127 918465882 /nfs/dbraw/zinc/46/58/82/918465882.db2.gz HDQRVAWNWAQOJH-NRFANRHFSA-N 0 3 409.555 4.297 20 0 HIADHN Cc1noc2nc(-c3ccccc3)cc(C(=O)N(CC(C)C)C3CCN(C)CC3)c12 ZINC000509915588 918515477 /nfs/dbraw/zinc/51/54/77/918515477.db2.gz IMLKRWXFVMTMCU-UHFFFAOYSA-N 0 3 406.530 4.391 20 0 HIADHN CCc1cccc2c1OCC[C@@H]2NC(=O)Nc1ccc(N2CCN(CC)CC2)cc1C ZINC000510060659 918630659 /nfs/dbraw/zinc/63/06/59/918630659.db2.gz KXRPZILBCLMSGT-QHCPKHFHSA-N 0 3 422.573 4.345 20 0 HIADHN CC(C)(CNC(=O)Cc1ccc(Br)s1)N1CCc2ccccc2C1 ZINC000510087821 918653647 /nfs/dbraw/zinc/65/36/47/918653647.db2.gz IBUHKJCAALEWRI-UHFFFAOYSA-N 0 3 407.377 4.006 20 0 HIADHN CN(Cc1c[nH]nc1-c1cccs1)C[C@@H](O)COc1ccc(C(F)(F)F)cc1 ZINC000510191949 918740263 /nfs/dbraw/zinc/74/02/63/918740263.db2.gz JIEUIACVALLZMO-OAHLLOKOSA-N 0 3 411.449 4.029 20 0 HIADHN CC[C@H](NCC(=O)N(C)Cc1ccc(SC)cc1)c1ccc(OC)c(OC)c1 ZINC000510245543 918782720 /nfs/dbraw/zinc/78/27/20/918782720.db2.gz ULVXIWZQGTXRQL-IBGZPJMESA-N 0 3 402.560 4.125 20 0 HIADHN CCc1cc(C(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)c2c(n1)onc2C(C)C ZINC000510259540 918792139 /nfs/dbraw/zinc/79/21/39/918792139.db2.gz QWOCSMZRVJCUBD-IBGZPJMESA-N 0 3 406.530 4.255 20 0 HIADHN CC(C)(C)c1csc(CNC(=O)[C@H]2CN(Cc3ccccc3)CCC2(F)F)n1 ZINC000510316010 918825717 /nfs/dbraw/zinc/82/57/17/918825717.db2.gz TXHDBHVOIGKIGU-MRXNPFEDSA-N 0 3 407.530 4.214 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)NCc1cccc(OCC(F)(F)F)c1 ZINC000510325945 918833015 /nfs/dbraw/zinc/83/30/15/918833015.db2.gz VKOHCGZEUZMZRR-UHFFFAOYSA-N 0 3 406.404 4.366 20 0 HIADHN Cc1ccc(F)cc1NC(=O)N(CCN(C)C)Cc1ccc(Br)cc1 ZINC000510330320 918835079 /nfs/dbraw/zinc/83/50/79/918835079.db2.gz FMMCHGPUNQRPKZ-UHFFFAOYSA-N 0 3 408.315 4.492 20 0 HIADHN CCOc1ccc([C@@H]2CCCN2C(=O)c2ccc(N3CCN(CC)CC3)cc2)cc1 ZINC000510352223 918847772 /nfs/dbraw/zinc/84/77/72/918847772.db2.gz IXYKVTHNWOJEMQ-DEOSSOPVSA-N 0 3 407.558 4.205 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3ccccc3OCC(F)(F)F)cc2)CC1 ZINC000510375867 918860688 /nfs/dbraw/zinc/86/06/88/918860688.db2.gz HKLREZRIVGLZQV-UHFFFAOYSA-N 0 3 407.436 4.022 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3cc(C(F)(F)F)ccc3N(C)C)cc2)CC1 ZINC000510381856 918863433 /nfs/dbraw/zinc/86/34/33/918863433.db2.gz ZTECSEHEKBVALN-UHFFFAOYSA-N 0 3 420.479 4.166 20 0 HIADHN CC1CCN(C(=O)C2CCN(Cc3ccccc3OCc3cccnc3)CC2)CC1 ZINC000510417879 918884876 /nfs/dbraw/zinc/88/48/76/918884876.db2.gz YHMRGAZAZAFQKA-UHFFFAOYSA-N 0 3 407.558 4.131 20 0 HIADHN CC(C)c1[nH+]ccn1CCC(=O)Nc1ccccc1-c1nnc(-c2ccccc2)[n-]1 ZINC000510422547 918888247 /nfs/dbraw/zinc/88/82/47/918888247.db2.gz AOAUQSUZTRRFMV-UHFFFAOYSA-N 0 3 400.486 4.487 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3ncc(Cc4ccc(F)cc4)s3)cc2)CC1 ZINC000510426241 918890798 /nfs/dbraw/zinc/89/07/98/918890798.db2.gz PSZVEAQJNSHOTM-UHFFFAOYSA-N 0 3 424.545 4.267 20 0 HIADHN CCCCN(C)C(=O)C1CCN(Cc2c(C)nn(Cc3ccc(C)cc3)c2C)CC1 ZINC000510428073 918891903 /nfs/dbraw/zinc/89/19/03/918891903.db2.gz GVYHIWGIOSRWAU-UHFFFAOYSA-N 0 3 410.606 4.327 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)Nc2cccc(C(=O)NC(C)(C)C)c2)N(C)C)cc1 ZINC000510462440 918918200 /nfs/dbraw/zinc/91/82/00/918918200.db2.gz PQQRXLLKXXCSQJ-OAQYLSRUSA-N 0 3 410.562 4.202 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)NCc1ccc(F)cc1Br ZINC000510469574 918924601 /nfs/dbraw/zinc/92/46/01/918924601.db2.gz FIAMAVCZRLTVKX-UHFFFAOYSA-N 0 3 405.267 4.326 20 0 HIADHN COc1cc([C@@H](C)NC(=O)N[C@H](C)C2=CCN(C)CC2)ccc1OCCC(C)C ZINC000510528529 918974395 /nfs/dbraw/zinc/97/43/95/918974395.db2.gz XJTNKGUJHZDEQS-QZTJIDSGSA-N 0 3 403.567 4.131 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)NCCc2ccc(Br)s2)C1 ZINC000510530938 918976092 /nfs/dbraw/zinc/97/60/92/918976092.db2.gz JXQQVTVKRFRKTI-ZBFHGGJFSA-N 0 3 422.392 4.188 20 0 HIADHN C[C@H]1CN(C2CCN(Cc3cc(Br)cc(C(F)(F)F)c3)CC2)CCO1 ZINC000510533521 918979069 /nfs/dbraw/zinc/97/90/69/918979069.db2.gz LCVGZIUSEPSYDW-ZDUSSCGKSA-N 0 3 421.301 4.153 20 0 HIADHN Cc1n[nH]c(C)c1[C@@H]1CCCCCN1C(=O)NCC1(N2CCSCC2)CCCC1 ZINC000510561356 919004207 /nfs/dbraw/zinc/00/42/07/919004207.db2.gz NKDIIXJWVYVCAA-IBGZPJMESA-N 0 3 419.639 4.015 20 0 HIADHN CN(Cc1c[nH]nc1-c1cccs1)C[C@@H](O)COc1ccccc1C(F)(F)F ZINC000510632908 919075100 /nfs/dbraw/zinc/07/51/00/919075100.db2.gz XLOMHEPGQUFWGY-CQSZACIVSA-N 0 3 411.449 4.029 20 0 HIADHN CN(Cc1c(-c2ccccc2)nc2ccccn21)C[C@H](O)COCc1ccccc1 ZINC000510691457 919127870 /nfs/dbraw/zinc/12/78/70/919127870.db2.gz SKXZNMOZJDWFSL-QFIPXVFZSA-N 0 3 401.510 4.011 20 0 HIADHN O=C(c1csc2cncn21)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000510711688 919151559 /nfs/dbraw/zinc/15/15/59/919151559.db2.gz BVQZBLVYCWRLDT-UHFFFAOYSA-N 0 3 423.369 4.441 20 0 HIADHN Cc1cc(OCCC[C@H](C)Nc2cc(C(N)=O)ccc2CN(C)C)ccc1Cl ZINC000510740616 919187102 /nfs/dbraw/zinc/18/71/02/919187102.db2.gz VDCIIBVRCJUJGO-INIZCTEOSA-N 0 3 403.954 4.469 20 0 HIADHN Cc1ccc(NC(=O)NCCCN2CCc3ccccc3C2)c(OC[C@@H]2CCCO2)c1 ZINC000510752206 919204482 /nfs/dbraw/zinc/20/44/82/919204482.db2.gz NJHROWLQEFYMOG-QFIPXVFZSA-N 0 3 423.557 4.123 20 0 HIADHN C[C@H](NC(=O)[C@H](C)SCc1ncc(-c2ccc(Cl)cc2)o1)C1=CCN(C)CC1 ZINC000510774158 919232642 /nfs/dbraw/zinc/23/26/42/919232642.db2.gz ZYNWCXNVGKLJEG-GJZGRUSLSA-N 0 3 419.978 4.383 20 0 HIADHN OC[C@@]1(Cc2ccccc2)CCCN1Cc1nc2cc(Br)ccc2o1 ZINC000510781947 919243011 /nfs/dbraw/zinc/24/30/11/919243011.db2.gz PTNRAZWSEARPOR-FQEVSTJZSA-N 0 3 401.304 4.160 20 0 HIADHN C[C@H](NC(=O)CCc1ncc(-c2ccc(Cl)cc2Cl)o1)C1=CCN(C)CC1 ZINC000510795780 919265851 /nfs/dbraw/zinc/26/58/51/919265851.db2.gz SBALQJWVFMMPOR-ZDUSSCGKSA-N 0 3 408.329 4.348 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)N1CCC(C(=O)Nc2cccc(F)c2)CC1 ZINC000510812105 919286538 /nfs/dbraw/zinc/28/65/38/919286538.db2.gz LYPUAUODPSPEBW-UHFFFAOYSA-N 0 3 423.488 4.124 20 0 HIADHN CO[C@]1(C)CCCN([C@@H]2CCCN(c3c(C)cc(Br)cc3C)C2=O)CC1 ZINC000510814955 919292472 /nfs/dbraw/zinc/29/24/72/919292472.db2.gz URXWLIRUUBVVLR-WIYYLYMNSA-N 0 3 423.395 4.452 20 0 HIADHN O=C([C@H]1CN(Cc2ccccc2)CCC1(F)F)N1CCC[C@H](c2nccs2)C1 ZINC000510824594 919303821 /nfs/dbraw/zinc/30/38/21/919303821.db2.gz FHSRCMVRELNNCB-ZWKOTPCHSA-N 0 3 405.514 4.007 20 0 HIADHN COc1ccc(C[C@@H](NCC(=O)N(C)c2ccccc2)c2ccc(OC)cc2)cc1 ZINC000510856262 919345508 /nfs/dbraw/zinc/34/55/08/919345508.db2.gz GFIIFKDNHVSGMF-XMMPIXPASA-N 0 3 404.510 4.240 20 0 HIADHN Cc1cc(C)n(-c2ccc(NC(=O)N(CCN(C)C)Cc3ccccc3)cc2F)n1 ZINC000510878911 919374387 /nfs/dbraw/zinc/37/43/87/919374387.db2.gz AQUDGFIZUWAKIV-UHFFFAOYSA-N 0 3 409.509 4.224 20 0 HIADHN CC(C)(C)CCN1CCN(C(=O)Nc2ccccc2OC[C@@H]2CCCCO2)CC1 ZINC000510921185 919434326 /nfs/dbraw/zinc/43/43/26/919434326.db2.gz XUYBYYRNLYGAGY-IBGZPJMESA-N 0 3 403.567 4.220 20 0 HIADHN CC[C@@H](NCCc1nnnn1-c1ccccc1)c1ccc(Br)cc1Cl ZINC000511001875 919559677 /nfs/dbraw/zinc/55/96/77/919559677.db2.gz RZZBIWOQCDBYLK-QGZVFWFLSA-N 0 3 420.742 4.362 20 0 HIADHN COc1cccc(NC(=O)[C@@H](N[C@@H](Cc2ccccc2)CN(C)C)c2ccccc2)c1 ZINC000511012082 919578830 /nfs/dbraw/zinc/57/88/30/919578830.db2.gz RQZYBLZWEWKEEJ-ZCYQVOJMSA-N 0 3 417.553 4.138 20 0 HIADHN O=C(Nc1ccccc1)N1CC[C@H](N[C@@H]2CCCc3ncc(C(F)(F)F)cc32)C1 ZINC000511035205 919618473 /nfs/dbraw/zinc/61/84/73/919618473.db2.gz SRMSNBYAMRCUCE-QFBILLFUSA-N 0 3 404.436 4.374 20 0 HIADHN Cc1cccc(-n2ccnc2SCC(=O)N(CC(C)C)C2CCN(C)CC2)c1C ZINC000511044415 919632762 /nfs/dbraw/zinc/63/27/62/919632762.db2.gz ILCHCODEWCHPQZ-UHFFFAOYSA-N 0 3 414.619 4.160 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)Nc1cc(F)c(Br)cc1F ZINC000511062931 919660264 /nfs/dbraw/zinc/66/02/64/919660264.db2.gz HVGYNVQUWVIOEK-UHFFFAOYSA-N 0 3 412.278 4.323 20 0 HIADHN Cc1ccc2nc(CN3CCC(C)(c4nc5ccccc5s4)CC3)cc(=O)n2c1 ZINC000511064173 919662208 /nfs/dbraw/zinc/66/22/08/919662208.db2.gz JXORSXKDNRDJKA-UHFFFAOYSA-N 0 3 404.539 4.166 20 0 HIADHN Cc1ccc2nc(CN3CCC[C@@H](c4cccc(C(F)(F)F)c4)C3)cc(=O)n2c1 ZINC000511066521 919667180 /nfs/dbraw/zinc/66/71/80/919667180.db2.gz RQOMRLICYWSPQV-QGZVFWFLSA-N 0 3 401.432 4.401 20 0 HIADHN C[C@@H]1CN(c2ccccc2NC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)C[C@H](C)O1 ZINC000511080038 919682464 /nfs/dbraw/zinc/68/24/64/919682464.db2.gz MOTDLXQTLFQYDB-RZUBCFFCSA-N 0 3 422.573 4.086 20 0 HIADHN O=c1c2ccccc2ncn1CCN1CCC[C@H](c2cccc(C(F)(F)F)c2)C1 ZINC000511087688 919690385 /nfs/dbraw/zinc/69/03/85/919690385.db2.gz ADVXUIIHQACRNL-KRWDZBQOSA-N 0 3 401.432 4.295 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)c2cc(C)nc3c2cnn3[C@H](C)CC)N(C)C)cc1 ZINC000511091472 919694724 /nfs/dbraw/zinc/69/47/24/919694724.db2.gz PWWFVAGWSBPKKW-VGOFRKELSA-N 0 3 407.562 4.306 20 0 HIADHN Cc1cccc2nc(CN3CCC[C@H](c4cccc(C(F)(F)F)c4)C3)cc(=O)n12 ZINC000511110338 919718734 /nfs/dbraw/zinc/71/87/34/919718734.db2.gz QYFYYWZPJVJNHX-KRWDZBQOSA-N 0 3 401.432 4.401 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)Nc1cc2c(cc1Cl)OCCCO2 ZINC000511206914 919819550 /nfs/dbraw/zinc/81/95/50/919819550.db2.gz PHEOYLSPWGZFHV-UHFFFAOYSA-N 0 3 421.900 4.236 20 0 HIADHN CC[C@@H](C)n1ncc2c1nc(C)cc2C(=O)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000511207403 919819845 /nfs/dbraw/zinc/81/98/45/919819845.db2.gz NZOJXKWDZUFYIY-QUCCMNQESA-N 0 3 405.546 4.105 20 0 HIADHN Cc1ccc(NC(=O)Nc2ccccc2)cc1NC(=O)N[C@H](C)C1=CCN(C)CC1 ZINC000511215207 919825969 /nfs/dbraw/zinc/82/59/69/919825969.db2.gz HEDDBUBYEQGCOC-QGZVFWFLSA-N 0 3 407.518 4.411 20 0 HIADHN COc1cccc([C@@H](NC(=O)N[C@H](C)C2=CCN(C)CC2)c2ccccc2Cl)c1 ZINC000511231847 919836443 /nfs/dbraw/zinc/83/64/43/919836443.db2.gz IWZWBTSZLAZUQY-OPAMFIHVSA-N 0 3 413.949 4.388 20 0 HIADHN COc1ccc2c(c1)CN(C(=O)N[C@H](C)C1=CCN(C)CC1)[C@H](C1CCCCC1)C2 ZINC000511249822 919850070 /nfs/dbraw/zinc/85/00/70/919850070.db2.gz PLMXLFFHVFLQDH-KOSHJBKYSA-N 0 3 411.590 4.362 20 0 HIADHN C[C@H](NC(=O)Nc1ccc(Br)cc1C(F)(F)F)C1=CCN(C)CC1 ZINC000511282971 919878388 /nfs/dbraw/zinc/87/83/88/919878388.db2.gz CEZDYTZPLSNMDW-JTQLQIEISA-N 0 3 406.246 4.240 20 0 HIADHN Cc1cccc(-c2nn(-c3ccc(F)cc3)cc2C(=O)N[C@@H](C)C2=CCN(C)CC2)c1 ZINC000511325505 919916138 /nfs/dbraw/zinc/91/61/38/919916138.db2.gz MSJJXFSCTPARJS-SFHVURJKSA-N 0 3 418.516 4.367 20 0 HIADHN C[C@H](NC(=O)c1cc(-c2ccco2)n(-c2ccc(Cl)cc2)n1)C1=CCN(C)CC1 ZINC000511346277 919940104 /nfs/dbraw/zinc/94/01/04/919940104.db2.gz QXBCGDVOFXASOR-HNNXBMFYSA-N 0 3 410.905 4.166 20 0 HIADHN Cc1ccc(NC(=O)CSc2ccccc2C(=O)N[C@H](C)C2=CCN(C)CC2)cc1 ZINC000511376885 919975542 /nfs/dbraw/zinc/97/55/42/919975542.db2.gz GQEOOTSPDHDDNX-GOSISDBHSA-N 0 3 423.582 4.106 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Cc3cc4c(ccc5ccccc45)o3)CC2)C[C@@H](C)O1 ZINC000511479321 920090320 /nfs/dbraw/zinc/09/03/20/920090320.db2.gz AQTIPJNCCMCSOM-RTBURBONSA-N 0 3 420.553 4.476 20 0 HIADHN Cc1cc(OC(F)F)c(C(=O)NC[C@@H]2CCCN(Cc3cccs3)C2)s1 ZINC000511550243 920181397 /nfs/dbraw/zinc/18/13/97/920181397.db2.gz DBEXCVQOEOIVJJ-ZDUSSCGKSA-N 0 3 400.516 4.361 20 0 HIADHN CN(Cc1cccc(OC(F)F)c1)C[C@@H](O)COc1ccc(C(F)(F)F)cc1 ZINC000511590052 920236064 /nfs/dbraw/zinc/23/60/64/920236064.db2.gz DRVABYKGOPCEQG-OAHLLOKOSA-N 0 3 405.363 4.179 20 0 HIADHN O=C(CCN1CC[C@H](C(F)(F)F)[C@H](CO)C1)Nc1ccccc1Oc1ccccc1 ZINC000511640919 920306086 /nfs/dbraw/zinc/30/60/86/920306086.db2.gz PHAMDEDPQPYRCX-WMZOPIPTSA-N 0 3 422.447 4.300 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)N[C@@H](C)c2ccc3n[nH]cc3c2)N(C)C)cc1 ZINC000511642100 920307839 /nfs/dbraw/zinc/30/78/39/920307839.db2.gz VZCVPFUXSAMPHT-KSFYIVLOSA-N 0 3 409.534 4.013 20 0 HIADHN Cc1nc(CC2CC2)oc1C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1c1ccccc1 ZINC000511751676 920430777 /nfs/dbraw/zinc/43/07/77/920430777.db2.gz FSNXCSNXWDZRFG-XZOQPEGZSA-N 0 3 415.537 4.334 20 0 HIADHN C[C@@]1(n2cc(CN(CC3CCCCC3)CC3CCCCC3)cn2)CCS(=O)(=O)C1 ZINC000511765615 920449498 /nfs/dbraw/zinc/44/94/98/920449498.db2.gz UBUSKAIXJPZXBM-HSZRJFAPSA-N 0 3 421.651 4.379 20 0 HIADHN Cc1cc(CN2CCCN(c3nccs3)CC2)cc(C)c1OCc1ccccn1 ZINC000511777830 920466953 /nfs/dbraw/zinc/46/69/53/920466953.db2.gz XVEFJHFNTJXUGU-UHFFFAOYSA-N 0 3 408.571 4.446 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)c(C)c1CC(=O)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000511810495 920506516 /nfs/dbraw/zinc/50/65/16/920506516.db2.gz XUVPWJNWPDPVHQ-NRFANRHFSA-N 0 3 422.960 4.076 20 0 HIADHN CCN(C)[C@@H](C(=O)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1 ZINC000511847265 920567995 /nfs/dbraw/zinc/56/79/95/920567995.db2.gz PYUYXLHABJHWDZ-LEWJYISDSA-N 0 3 419.491 4.089 20 0 HIADHN COc1cc(F)c([C@@H](C)NC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)cc1OC ZINC000511915122 920659642 /nfs/dbraw/zinc/65/96/42/920659642.db2.gz DRKLQDUQQGOQIQ-WBVHZDCISA-N 0 3 418.484 4.071 20 0 HIADHN Cc1ccc(Cc2cnc(NC(=O)N[C@H](C)C3=CCN(C)CC3)s2)cc1Cl ZINC000511921799 920665888 /nfs/dbraw/zinc/66/58/88/920665888.db2.gz IHRFOVWSNAXZJP-CQSZACIVSA-N 0 3 404.967 4.468 20 0 HIADHN CN(C)Cc1cc(CNCc2cnn(-c3ccc(C(F)(F)F)cc3)c2)ccc1F ZINC000512011043 920784097 /nfs/dbraw/zinc/78/40/97/920784097.db2.gz VADVGHOEIOJDNC-UHFFFAOYSA-N 0 3 406.427 4.382 20 0 HIADHN COc1ccc(C(=O)c2ccccc2C(=O)N2CCCC[C@@H](N3CCCC3)C2)cc1 ZINC000512028072 920802045 /nfs/dbraw/zinc/80/20/45/920802045.db2.gz PCIAGXJHLVREQI-HXUWFJFHSA-N 0 3 406.526 4.017 20 0 HIADHN CCc1nc([C@H](C)N[C@H](C)CC(=O)Nc2cc(C(F)(F)F)ccc2Cl)n[nH]1 ZINC000512068365 920834900 /nfs/dbraw/zinc/83/49/00/920834900.db2.gz QZUCGWRWXNYJJD-ZJUUUORDSA-N 0 3 403.836 4.107 20 0 HIADHN COc1cccc(CN(Cc2ccc(OCc3noc(C)n3)cc2)C[C@@H]2CCCO2)c1 ZINC000512070453 920837443 /nfs/dbraw/zinc/83/74/43/920837443.db2.gz FSLFEXKTDMIAOQ-QHCPKHFHSA-N 0 3 423.513 4.147 20 0 HIADHN Cc1nn(C)cc1[C@@H](C)N[C@@H](C)CC(=O)Nc1cc(C(F)(F)F)ccc1Cl ZINC000512087349 920851445 /nfs/dbraw/zinc/85/14/45/920851445.db2.gz IRTZVDXFJWEKCQ-WDEREUQCSA-N 0 3 402.848 4.469 20 0 HIADHN CO[C@@H]1C[C@H](c2ccccc2)CC[C@@H]1NC(=O)N(CCN(C)C)Cc1cccs1 ZINC000512098825 920859058 /nfs/dbraw/zinc/85/90/58/920859058.db2.gz SHJQSFAGZWLRAO-BAGYTPMASA-N 0 3 415.603 4.173 20 0 HIADHN CC(C)C[C@@H](Cc1cccc(Br)c1)C(=O)N[C@H](C)C1=CCN(C)CC1 ZINC000512129099 920877813 /nfs/dbraw/zinc/87/78/13/920877813.db2.gz SYGUHOKKUVUSOC-APWZRJJASA-N 0 3 407.396 4.421 20 0 HIADHN C[C@H](NC(=O)c1cccnc1Oc1cccc(Br)c1)C1=CCN(C)CC1 ZINC000512128355 920877838 /nfs/dbraw/zinc/87/78/38/920877838.db2.gz QUPJXANEUJVCQJ-AWEZNQCLSA-N 0 3 416.319 4.017 20 0 HIADHN Cc1ccc(-n2cc(C(=O)N[C@H](C)C3=CCN(C)CC3)c(-c3ccccc3)n2)cc1 ZINC000512134887 920882766 /nfs/dbraw/zinc/88/27/66/920882766.db2.gz ZOHLBTXUWZKFJI-LJQANCHMSA-N 0 3 400.526 4.228 20 0 HIADHN Cc1cccc(-c2nnc(-c3ccc(C(=O)N[C@H](C)C4=CCN(C)CC4)cc3)o2)c1 ZINC000512137690 920883660 /nfs/dbraw/zinc/88/36/60/920883660.db2.gz JPOZZONBECLDJQ-QGZVFWFLSA-N 0 3 402.498 4.092 20 0 HIADHN C[C@@H]1CC[C@H](c2ccccc2)N(CC(=O)N2CCC(C(=O)Nc3ccccc3)CC2)C1 ZINC000512154530 920894931 /nfs/dbraw/zinc/89/49/31/920894931.db2.gz YVHLZKIWNMWBAK-HYBUGGRVSA-N 0 3 419.569 4.337 20 0 HIADHN OCC[C@@H](NC[C@H](O)COCc1ccc(Cl)cc1)c1ccc(Cl)c(Cl)c1 ZINC000512211210 920957193 /nfs/dbraw/zinc/95/71/93/920957193.db2.gz GTLZSBDZQCQTKJ-QFBILLFUSA-N 0 3 418.748 4.238 20 0 HIADHN COc1ccc(C)cc1NC(=O)[C@H](NCCc1ccc2c(c1)CCO2)c1ccccc1 ZINC000512233411 920987989 /nfs/dbraw/zinc/98/79/89/920987989.db2.gz IVDCEXDNQZLAHQ-RUZDIDTESA-N 0 3 416.521 4.451 20 0 HIADHN Fc1ccc(-n2cc(CN[C@H]3CCN(c4cccc(OC(F)(F)F)c4)C3)cn2)cc1 ZINC000512241539 920998838 /nfs/dbraw/zinc/99/88/38/920998838.db2.gz KNIGVXNZUNDBQB-KRWDZBQOSA-N 0 3 420.410 4.279 20 0 HIADHN O=C(N[C@H](C[C@H]1CCOC1)c1ccccc1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000512250148 921009444 /nfs/dbraw/zinc/00/94/44/921009444.db2.gz OOXJOBMFCPOLFU-JCTONOIOSA-N 0 3 410.533 4.322 20 0 HIADHN CCC[C@]1(NCC(=O)N2N=C(c3ccc(Cl)cc3)C[C@H]2c2ccco2)CCOC1 ZINC000512256742 921015452 /nfs/dbraw/zinc/01/54/52/921015452.db2.gz ASUPRAGBWZGAHU-UGKGYDQZSA-N 0 3 415.921 4.160 20 0 HIADHN O=C(C1CCN(Cc2ccc(Oc3cnccn3)cc2)CC1)N1CCc2ccccc21 ZINC000512291192 921047303 /nfs/dbraw/zinc/04/73/03/921047303.db2.gz FZEFRHRNCFKFBY-UHFFFAOYSA-N 0 3 414.509 4.070 20 0 HIADHN CC(=O)N(C)C1CCN(Cc2cn(-c3ccccc3)nc2-c2ccc(F)cc2)CC1 ZINC000512298122 921053587 /nfs/dbraw/zinc/05/35/87/921053587.db2.gz CRPNEJKCKXKSLI-UHFFFAOYSA-N 0 3 406.505 4.121 20 0 HIADHN CN(CC(=O)NCc1cccc(COCc2ccco2)c1)[C@@H]1CCc2ccccc2C1 ZINC000512318355 921067554 /nfs/dbraw/zinc/06/75/54/921067554.db2.gz OFZUKDIITFHDBM-XMMPIXPASA-N 0 3 418.537 4.102 20 0 HIADHN CCc1ccc2occ(C(=O)Nc3ccc(C(=O)N(C)[C@H]4CCCN(C)C4)cc3)c2c1 ZINC000513451477 921818055 /nfs/dbraw/zinc/81/80/55/921818055.db2.gz QNXGUYWFIGPIDB-FQEVSTJZSA-N 0 3 419.525 4.414 20 0 HIADHN CCOc1cc(CN2CC[C@H](c3cccc(F)c3)C2)ccc1O[C@@H](C)C(=O)N(C)C ZINC000513460266 921824735 /nfs/dbraw/zinc/82/47/35/921824735.db2.gz DGDVAPCQNARUSQ-PXNSSMCTSA-N 0 3 414.521 4.069 20 0 HIADHN Cn1c2ccc(CN3CCC(c4cccc(Br)c4)CC3)cc2oc1=O ZINC000513486181 921839867 /nfs/dbraw/zinc/83/98/67/921839867.db2.gz WHOQJVFNMBMHRB-UHFFFAOYSA-N 0 3 401.304 4.274 20 0 HIADHN CC(=O)c1cccc(OC[C@@H](O)CN(Cc2ccc(Br)cc2)C(C)C)c1 ZINC000513492056 921843787 /nfs/dbraw/zinc/84/37/87/921843787.db2.gz XRISPMZTSPBEJC-FQEVSTJZSA-N 0 3 420.347 4.302 20 0 HIADHN c1cnn(-c2ccccc2CNCc2cn(-c3ccccc3)nc2-c2ccncc2)c1 ZINC000513528525 921871944 /nfs/dbraw/zinc/87/19/44/921871944.db2.gz ZCXZLRAIUZAIDE-UHFFFAOYSA-N 0 3 406.493 4.410 20 0 HIADHN CCOc1cc(C[NH2+]C2CCN(Cc3ccc(F)c(F)c3)CC2)cc(Cl)c1[O-] ZINC000513622736 921951344 /nfs/dbraw/zinc/95/13/44/921951344.db2.gz XVOJCMVHOOMCJJ-UHFFFAOYSA-N 0 3 410.892 4.477 20 0 HIADHN CN1CCN(c2ccc(CN[C@H]3CC4(CCCCC4)Oc4ccccc43)cn2)CC1 ZINC000513788425 922114847 /nfs/dbraw/zinc/11/48/47/922114847.db2.gz QQRPJYXHRDMLRU-QFIPXVFZSA-N 0 3 406.574 4.150 20 0 HIADHN COc1ccc(C(=O)CCCC(=O)N[C@@H]2CCN(Cc3ccccc3)CC2(C)C)cc1 ZINC000513798401 922124630 /nfs/dbraw/zinc/12/46/30/922124630.db2.gz ZDHRXRXOIVDJQP-XMMPIXPASA-N 0 3 422.569 4.465 20 0 HIADHN O=C(Nc1cccc(CN[C@@H]2CCc3c2cccc3Br)c1)[C@@H]1CCCO1 ZINC000513873515 922202779 /nfs/dbraw/zinc/20/27/79/922202779.db2.gz ZELFQAJBFAHEOE-UXHICEINSA-N 0 3 415.331 4.344 20 0 HIADHN CCOc1cc2c(cc1OCC)CN(C[C@@H]1CCN(C(=O)c3ccccc3)C1)CC2 ZINC000513899600 922223313 /nfs/dbraw/zinc/22/33/13/922223313.db2.gz FZQKZJXPGULJPT-IBGZPJMESA-N 0 3 408.542 4.004 20 0 HIADHN Cc1nn(-c2ccccc2C)c(C)c1CN(C)C[C@H]1CCN(C(=O)c2ccccc2)C1 ZINC000513903115 922226103 /nfs/dbraw/zinc/22/61/03/922226103.db2.gz ALHSKSMBZHNKEB-JOCHJYFZSA-N 0 3 416.569 4.392 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)NC[C@@H]1CCCO[C@H]1c1ccccc1 ZINC000513911260 922234354 /nfs/dbraw/zinc/23/43/54/922234354.db2.gz MUBIGPKRWNWZLF-VXNXHJTFSA-N 0 3 407.558 4.291 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)N1CCC(Nc2ccc(F)cc2)CC1 ZINC000513912104 922234723 /nfs/dbraw/zinc/23/47/23/922234723.db2.gz YQIJQLQWLIZRLV-HSZRJFAPSA-N 0 3 410.537 4.249 20 0 HIADHN CSc1cc2c(cc1NC(=O)N[C@H]1CCN([C@@H](C)c3ccccc3)C1)OCCO2 ZINC000513972396 922291459 /nfs/dbraw/zinc/29/14/59/922291459.db2.gz BPEZZEXYKGSBQN-RDJZCZTQSA-N 0 3 413.543 4.137 20 0 HIADHN COc1cc(Cl)c(C(=O)N(Cc2ccccc2)C2CCN(C)CC2)cc1OC ZINC000514010401 922334103 /nfs/dbraw/zinc/33/41/03/922334103.db2.gz ZCJUGUMTRIGWDV-UHFFFAOYSA-N 0 3 402.922 4.094 20 0 HIADHN CC(C)Cc1ccc(CCCC(=O)NCc2ccccc2CN2CCC(O)CC2)cc1 ZINC000514012156 922336481 /nfs/dbraw/zinc/33/64/81/922336481.db2.gz YJJVWQXKVDRBCP-UHFFFAOYSA-N 0 3 422.613 4.481 20 0 HIADHN O=C(c1cccc(CN2CCCC2)c1)N1CCC(N2CCc3cc(F)ccc32)CC1 ZINC000514044260 922364559 /nfs/dbraw/zinc/36/45/59/922364559.db2.gz HIMKRRGNWJYZCP-UHFFFAOYSA-N 0 3 407.533 4.089 20 0 HIADHN CO[C@H](C)c1nc(CN2CCCN(C[C@H](OC)c3ccc(Cl)cc3)CC2)cs1 ZINC000514108074 922437903 /nfs/dbraw/zinc/43/79/03/922437903.db2.gz UUXRQWWQUXNRJS-UZLBHIALSA-N 0 3 424.010 4.399 20 0 HIADHN COc1cc2c(c(OC)c1OC)CCN(C[C@@H](OC)c1ccc(Cl)cc1)CC2 ZINC000514118237 922452227 /nfs/dbraw/zinc/45/22/27/922452227.db2.gz GQQLHFOCWCUPBM-HXUWFJFHSA-N 0 3 405.922 4.154 20 0 HIADHN CN(CCCc1cc(-c2ccccc2)no1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000514148586 922483018 /nfs/dbraw/zinc/48/30/18/922483018.db2.gz GDPNGKNHDABVRR-JOCHJYFZSA-N 0 3 418.541 4.190 20 0 HIADHN O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N[C@@H]1CCCc2cc(OC(F)F)ccc21 ZINC000514159036 922496828 /nfs/dbraw/zinc/49/68/28/922496828.db2.gz ZAPUIERKEDLAIL-WIYYLYMNSA-N 0 3 415.484 4.239 20 0 HIADHN COc1cccc([C@H](CNC(=O)N[C@@H]2CCCOc3ccccc32)N2CCCC2)c1 ZINC000514173096 922510904 /nfs/dbraw/zinc/51/09/04/922510904.db2.gz UHCDSHJHSPYOBP-YADHBBJMSA-N 0 3 409.530 4.045 20 0 HIADHN CCCN(C(=O)NCc1noc2c1CCCC2)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000514174662 922512541 /nfs/dbraw/zinc/51/25/41/922512541.db2.gz PAXCVEKOJSSOLB-HXUWFJFHSA-N 0 3 410.562 4.140 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)NC[C@@H]1CCCO[C@@H]1c1ccccc1 ZINC000514176689 922514319 /nfs/dbraw/zinc/51/43/19/922514319.db2.gz UIUPDMWAOHPKPG-JAXLGGSGSA-N 0 3 413.587 4.352 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)NC[C@@H]1CCCO[C@@H]1c1ccccc1 ZINC000514176691 922514797 /nfs/dbraw/zinc/51/47/97/922514797.db2.gz UIUPDMWAOHPKPG-TUNNFDKTSA-N 0 3 413.587 4.352 20 0 HIADHN Cc1ccccc1C[C@H]1CCCN1CC(=O)N1CCC[C@@H]1c1ccc2c(c1)OCCO2 ZINC000514185710 922523860 /nfs/dbraw/zinc/52/38/60/922523860.db2.gz KITPFIDIOLBNKX-DHIUTWEWSA-N 0 3 420.553 4.137 20 0 HIADHN CC(C)[C@H]1C[C@H](CC(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)CCO1 ZINC000514194692 922533869 /nfs/dbraw/zinc/53/38/69/922533869.db2.gz KUTOUYWXJZQOHU-YLJYHZDGSA-N 0 3 414.512 4.437 20 0 HIADHN CC1CCN(CCNC(=O)N2CCC(c3nc4cc(Cl)ccc4o3)CC2)CC1 ZINC000514212744 922547552 /nfs/dbraw/zinc/54/75/52/922547552.db2.gz ABZGYWALYAWUQT-UHFFFAOYSA-N 0 3 404.942 4.102 20 0 HIADHN Cc1cc(NC(=O)c2ccccc2Cl)sc1C(=O)N(C)C1CCN(C)CC1 ZINC000514463332 922636847 /nfs/dbraw/zinc/63/68/47/922636847.db2.gz DEXTXEBJGPTURC-UHFFFAOYSA-N 0 3 405.951 4.128 20 0 HIADHN O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCC(c2c[nH]c3ccccc32)CC1 ZINC000514564612 922703017 /nfs/dbraw/zinc/70/30/17/922703017.db2.gz MEBJIJFOPBYMDL-NRFANRHFSA-N 0 3 402.542 4.331 20 0 HIADHN COc1cc(C)c(NC(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)cc1OC ZINC000514623442 922729203 /nfs/dbraw/zinc/72/92/03/922729203.db2.gz KMQCRJSDXMDLEG-HXUWFJFHSA-N 0 3 415.534 4.224 20 0 HIADHN O=C(CCNCc1ccc(Oc2cccnc2)c(F)c1)Nc1cc(F)cc(F)c1 ZINC000514666099 922749869 /nfs/dbraw/zinc/74/98/69/922749869.db2.gz LPQDCPATRIUMNE-UHFFFAOYSA-N 0 3 401.388 4.410 20 0 HIADHN C[C@H](c1ccc(F)cc1)N1CCC[C@@H](NCc2ccc(OCC(F)F)cc2)C1=O ZINC000514680752 922751333 /nfs/dbraw/zinc/75/13/33/922751333.db2.gz KSZWAHCGDFOIPN-FOIQADDNSA-N 0 3 406.448 4.311 20 0 HIADHN CSc1ccc([C@H](CNC(=O)[C@@H]2C[C@@H]2c2cc(F)c(F)c(F)c2)N(C)C)cc1 ZINC000514786130 922801951 /nfs/dbraw/zinc/80/19/51/922801951.db2.gz WTMRELFRUOJIOB-MDZRGWNJSA-N 0 3 408.489 4.348 20 0 HIADHN CCOC(=O)c1nnc(-c2cccc(C[NH2+]C3CC(c4ccccc4Cl)C3)c2)[n-]1 ZINC000514957962 922853804 /nfs/dbraw/zinc/85/38/04/922853804.db2.gz YSDLXMCMYMOGFR-UHFFFAOYSA-N 0 3 410.905 4.338 20 0 HIADHN CCOC(=O)c1nc(-c2cccc(C[NH2+]C3CC(c4ccccc4Cl)C3)c2)n[n-]1 ZINC000514957962 922853811 /nfs/dbraw/zinc/85/38/11/922853811.db2.gz YSDLXMCMYMOGFR-UHFFFAOYSA-N 0 3 410.905 4.338 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)Cc1ccc(OCc2c(C)noc2C)cc1 ZINC000515030415 922886120 /nfs/dbraw/zinc/88/61/20/922886120.db2.gz QMWSGGWCMXNHTJ-UHFFFAOYSA-N 0 3 423.513 4.122 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1cccc(N2CCCC2=O)c1)c1cccc(OC)c1 ZINC000515104896 922918493 /nfs/dbraw/zinc/91/84/93/922918493.db2.gz CAPIZGKIENXVJW-QFIPXVFZSA-N 0 3 424.545 4.027 20 0 HIADHN COc1cccc([C@@H](CNC(=O)Nc2cccc(Cl)c2N(C)C)N2CCCC2)c1 ZINC000515263224 923024466 /nfs/dbraw/zinc/02/44/66/923024466.db2.gz XAVHJYMAFBYCKI-HXUWFJFHSA-N 0 3 416.953 4.373 20 0 HIADHN COc1ccc(Cl)cc1CN(C)C(=O)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000515294327 923039872 /nfs/dbraw/zinc/03/98/72/923039872.db2.gz RNCDWNMIAOMMCJ-FQEVSTJZSA-N 0 3 401.938 4.327 20 0 HIADHN COc1ccc([C@@H](CNc2nc(C)nc3sc4c(c32)CCC4)N(C)C)cc1OC ZINC000515334224 923057252 /nfs/dbraw/zinc/05/72/52/923057252.db2.gz ZEGIURXXGWEIRU-MRXNPFEDSA-N 0 3 412.559 4.220 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(-c4ccc(-c5ccccc5)o4)n3)cn2)CC1 ZINC000515335092 923057309 /nfs/dbraw/zinc/05/73/09/923057309.db2.gz ULRIQDLAXZCSHX-UHFFFAOYSA-N 0 3 401.470 4.201 20 0 HIADHN COc1cccc(-c2nc(C)c(C(=O)NC[C@@H](c3ccc(SC)cc3)N(C)C)[nH]2)c1 ZINC000515409408 923087511 /nfs/dbraw/zinc/08/75/11/923087511.db2.gz SKNWRPCIERMYFL-FQEVSTJZSA-N 0 3 424.570 4.148 20 0 HIADHN CN(C)[C@@H](CNC(=O)NCc1cccc(COc2ccccc2)c1)c1ccccc1 ZINC000515456265 923115200 /nfs/dbraw/zinc/11/52/00/923115200.db2.gz ZBYRSHNULNHLTI-DEOSSOPVSA-N 0 3 403.526 4.368 20 0 HIADHN CCCC(=O)Nc1cccc(CNC(=O)NC[C@@H](CC)N2CCc3ccccc3C2)c1 ZINC000515462953 923120884 /nfs/dbraw/zinc/12/08/84/923120884.db2.gz BEYMHPKDQCBDKF-HSZRJFAPSA-N 0 3 422.573 4.061 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCCN(c2ccccc2)CC1)c1cccc(OC)c1 ZINC000515528512 923157328 /nfs/dbraw/zinc/15/73/28/923157328.db2.gz BAQRYCSUMKVCGK-XMMPIXPASA-N 0 3 424.589 4.000 20 0 HIADHN Cc1ccc2nc(CN3CCCN(Cc4ccc(C(F)(F)F)cc4)CC3)cn2c1 ZINC000515541096 923164418 /nfs/dbraw/zinc/16/44/18/923164418.db2.gz LRTHASHCIRDZNZ-UHFFFAOYSA-N 0 3 402.464 4.369 20 0 HIADHN Cc1cnc(C2CCN(C(=O)[C@@H]3CN(Cc4ccccc4)CCC3(F)F)CC2)s1 ZINC000515683651 923268504 /nfs/dbraw/zinc/26/85/04/923268504.db2.gz QOZFKDFMDLOLJG-IBGZPJMESA-N 0 3 419.541 4.315 20 0 HIADHN COc1cccc([C@@H](C)N[C@H](C)C(=O)N(C)Cc2ccc(Br)cc2)c1 ZINC000515736650 923312415 /nfs/dbraw/zinc/31/24/15/923312415.db2.gz OGQAKBNILFCXAU-HUUCEWRRSA-N 0 3 405.336 4.155 20 0 HIADHN Cc1ccc(C)n1-c1nc(CC(=O)N[C@@H](CN2CCCC2)c2ccccc2)cs1 ZINC000515774639 923343043 /nfs/dbraw/zinc/34/30/43/923343043.db2.gz BJPHXMNVCCKXBF-NRFANRHFSA-N 0 3 408.571 4.046 20 0 HIADHN COc1ccc([C@@H](NC(=O)N(CCN(C)C)Cc2ccc(F)cc2)C(C)C)cc1 ZINC000515789165 923349673 /nfs/dbraw/zinc/34/96/73/923349673.db2.gz OAVZMFWLBITEOZ-QFIPXVFZSA-N 0 3 401.526 4.305 20 0 HIADHN C[C@H](NC(=O)N1CCN(CCC(C)(C)C)CC1)c1cccc(OCc2ccccn2)c1 ZINC000515791268 923351474 /nfs/dbraw/zinc/35/14/74/923351474.db2.gz PPFPWCXLOGHQEF-FQEVSTJZSA-N 0 3 424.589 4.485 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)NCc2ccc(OCc3ccccc3)cc2)o1 ZINC000515802354 923360138 /nfs/dbraw/zinc/36/01/38/923360138.db2.gz IPUIZNBZYNWRBX-UHFFFAOYSA-N 0 3 421.541 4.440 20 0 HIADHN CC[C@H](NC(=O)NC[C@@H](c1ccccc1)N1CCCC1)c1ccc2c(c1)OCCO2 ZINC000515865644 923399252 /nfs/dbraw/zinc/39/92/52/923399252.db2.gz QAHKFBUBDLRHLW-SFTDATJTSA-N 0 3 409.530 4.045 20 0 HIADHN O=C(NCCCCN1CCN(Cc2ccccc2)CC1)N1CCC[C@@H]1c1ccccc1 ZINC000515908409 923427109 /nfs/dbraw/zinc/42/71/09/923427109.db2.gz OVRIJRZZBZERFJ-RUZDIDTESA-N 0 3 420.601 4.131 20 0 HIADHN Cc1cc(-c2noc(CCC(=O)N[C@@H](CN3CCCC3)c3ccccc3)n2)ccc1F ZINC000516042724 923516505 /nfs/dbraw/zinc/51/65/05/923516505.db2.gz FVXWZOAMVYMOHE-NRFANRHFSA-N 0 3 422.504 4.070 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)NCc2ccnc(OC3CCCC3)c2)C1 ZINC000516163827 923581435 /nfs/dbraw/zinc/58/14/35/923581435.db2.gz ZFMXPJQDNOGMIU-WIYYLYMNSA-N 0 3 408.546 4.038 20 0 HIADHN COc1cc(NC(=O)CN[C@H](C)c2ccc(F)c3ccccc32)cc(OC)c1OC ZINC000516210820 923603232 /nfs/dbraw/zinc/60/32/32/923603232.db2.gz ZIUVDKQUPHVHEV-CQSZACIVSA-N 0 3 412.461 4.294 20 0 HIADHN COc1ccccc1[C@@H](C)NC(=O)[C@@H](C)N1CCC(CCc2ccc(O)cc2)CC1 ZINC000516298245 923652151 /nfs/dbraw/zinc/65/21/51/923652151.db2.gz BPLAXPQQKJDPNR-RTBURBONSA-N 0 3 410.558 4.311 20 0 HIADHN CC1CCN([C@@H](CNC(=O)N(C)Cc2ccc3c(c2)OCO3)c2ccccc2)CC1 ZINC000516558745 923795680 /nfs/dbraw/zinc/79/56/80/923795680.db2.gz IANDCRWLACAWJJ-NRFANRHFSA-N 0 3 409.530 4.030 20 0 HIADHN CC(C)[C@H](NC(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1)c1ccc2c(c1)OCCO2 ZINC000516578719 923800810 /nfs/dbraw/zinc/80/08/10/923800810.db2.gz LFOIOFTUUAGXKD-JLGINSKQSA-N 0 3 423.557 4.290 20 0 HIADHN COc1ccc(OC2CCN(C(=O)N[C@@H]3CCN([C@H](C)c4ccccc4)C3)CC2)cc1 ZINC000516581463 923802278 /nfs/dbraw/zinc/80/22/78/923802278.db2.gz GMWFPQSXWCOXFB-TZIWHRDSSA-N 0 3 423.557 4.084 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N(C)Cc2cc(Br)cs2)C1 ZINC000516581243 923802416 /nfs/dbraw/zinc/80/24/16/923802416.db2.gz IGDZRTNMCSHMRB-RHSMWYFYSA-N 0 3 422.392 4.488 20 0 HIADHN CCc1cccc(C)c1NC(=O)CN[C@@H]1CCN(CC)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000516982848 923950971 /nfs/dbraw/zinc/95/09/71/923950971.db2.gz UBVMMZBSUIBMMN-XXBNENTESA-N 0 3 419.491 4.338 20 0 HIADHN COc1ccc(Cn2nc(C)c(CNCCNc3ccc4ccccc4n3)c2C)cc1 ZINC000517004097 923963365 /nfs/dbraw/zinc/96/33/65/923963365.db2.gz LQZZKXMFKUZHTB-UHFFFAOYSA-N 0 3 415.541 4.307 20 0 HIADHN C[C@@H]1CCCN(CCNC(=O)c2ccccc2SCc2cn3ccccc3n2)C1 ZINC000517085161 923988545 /nfs/dbraw/zinc/98/85/45/923988545.db2.gz QOOGQYICMLXSPI-GOSISDBHSA-N 0 3 408.571 4.088 20 0 HIADHN CCC[C@@H]1CN(c2nnc(C(C)C)n2C[C@H]2CCCO2)CCN1Cc1ccccc1 ZINC000517248746 924059659 /nfs/dbraw/zinc/05/96/59/924059659.db2.gz AQAXYTVDXGSRDP-FGZHOGPDSA-N 0 3 411.594 4.071 20 0 HIADHN CCCCOc1cccc(NC(=O)N(C)C2CCN(CCc3ccccn3)CC2)c1 ZINC000517288316 924078555 /nfs/dbraw/zinc/07/85/55/924078555.db2.gz OJEKHUHNNCBODI-UHFFFAOYSA-N 0 3 410.562 4.431 20 0 HIADHN COCCN(CCN(C)C)C(=O)N[C@@H](C)c1sc(-c2ccc(Cl)cc2)nc1C ZINC000517368576 924138246 /nfs/dbraw/zinc/13/82/46/924138246.db2.gz SOUSBIWRUHZYOH-HNNXBMFYSA-N 0 3 424.998 4.053 20 0 HIADHN CN(C)CCn1c2cc(NC(=O)[C@H]3C[C@@H]3c3ccc4ccccc4c3)ccc2oc1=O ZINC000517487052 924224865 /nfs/dbraw/zinc/22/48/65/924224865.db2.gz FWFWWNLTBMTLPI-RTWAWAEBSA-N 0 3 415.493 4.052 20 0 HIADHN CCN(C(=O)NC[C@@H](c1ccccc1)N1CCCC1)[C@@H](C)Cc1ccc(OC)cc1 ZINC000517532022 924249358 /nfs/dbraw/zinc/24/93/58/924249358.db2.gz IPFWTIRYNHAPMK-RDPSFJRHSA-N 0 3 409.574 4.495 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)NCc2cccnc2OC2CCCC2)C1 ZINC000517541773 924253572 /nfs/dbraw/zinc/25/35/72/924253572.db2.gz VULAPDLWNLCAJL-RXVVDRJESA-N 0 3 408.546 4.038 20 0 HIADHN CC(C)OC(=O)C[C@H](NC(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1)c1ccccc1 ZINC000517543756 924254742 /nfs/dbraw/zinc/25/47/42/924254742.db2.gz JZALOQKZKUXION-PMOQBDJRSA-N 0 3 423.557 4.204 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N2CCC(c3noc4cc(F)ccc43)CC2)N(C)C)cc1 ZINC000517636797 926745573 /nfs/dbraw/zinc/74/55/73/926745573.db2.gz GLQFEBZLFLELJA-OAQYLSRUSA-N 0 3 424.520 4.467 20 0 HIADHN CCN1CCCC[C@H]1CNC(=O)c1ccc(-c2nnc(-c3cccc(C)c3)o2)cc1 ZINC000517642770 926751080 /nfs/dbraw/zinc/75/10/80/926751080.db2.gz IWOLVMRJWAEDCJ-NRFANRHFSA-N 0 3 404.514 4.316 20 0 HIADHN CC(=O)CCc1ccc(OCc2cccc(C(=O)N(C)[C@@H]3CCN(C4CC4)C3)c2)cc1 ZINC000517647219 926754403 /nfs/dbraw/zinc/75/44/03/926754403.db2.gz ACGHRDFIAHXVQL-XMMPIXPASA-N 0 3 420.553 4.096 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)Nc1c(C)cccc1C(=O)N1CCCC1)c1ccco1 ZINC000517768832 926828534 /nfs/dbraw/zinc/82/85/34/926828534.db2.gz PKSLBOYHMLYRIZ-MJGOQNOKSA-N 0 3 412.534 4.075 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3Cc4ccccc4OC(C)(C)C3)c(C)c2)CC1 ZINC000517778638 926831736 /nfs/dbraw/zinc/83/17/36/926831736.db2.gz ZUOIONQGJQXRCD-UHFFFAOYSA-N 0 3 422.573 4.342 20 0 HIADHN CCO[C@@H]1C[C@H](N[C@H](C)C(=O)Nc2c(C)nn(-c3ccccc3)c2C)C12CCCC2 ZINC000517781827 926833751 /nfs/dbraw/zinc/83/37/51/926833751.db2.gz IIMQUIAGEYDHCX-JRGCBEDISA-N 0 3 410.562 4.144 20 0 HIADHN CCCN(CCN1CCCCCC1)C(=O)c1cn(CC)c2ccc(Cl)cc2c1=O ZINC000517865647 926868685 /nfs/dbraw/zinc/86/86/85/926868685.db2.gz VUXPTDXIDJSTSX-UHFFFAOYSA-N 0 3 417.981 4.403 20 0 HIADHN CC[C@@H](C)[C@@H](C)N(CC(=O)N(C)CC(=O)Nc1ccccc1C(F)(F)F)C1CC1 ZINC000517908942 926886564 /nfs/dbraw/zinc/88/65/64/926886564.db2.gz RTVWDUXPEBMUQJ-HUUCEWRRSA-N 0 3 413.484 4.001 20 0 HIADHN O=C([C@H](Sc1ccc(F)c(F)c1)c1ccccc1)N1CC[C@@H](N2CCCC2)C1 ZINC000517990324 926933235 /nfs/dbraw/zinc/93/32/35/926933235.db2.gz AKEHQIBAELNDAN-DYESRHJHSA-N 0 3 402.510 4.495 20 0 HIADHN O=C([C@@H](Sc1ccc(F)c(F)c1)c1ccccc1)N1CC[C@H](N2CCCC2)C1 ZINC000517990327 926933553 /nfs/dbraw/zinc/93/35/53/926933553.db2.gz AKEHQIBAELNDAN-UWJYYQICSA-N 0 3 402.510 4.495 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)[C@@H]1CCO[C@H]1c1ccc(Cl)c(F)c1)c1ccco1 ZINC000517993027 926936080 /nfs/dbraw/zinc/93/60/80/926936080.db2.gz XNGACOMEWNCEKA-FSPMTTQMSA-N 0 3 408.901 4.395 20 0 HIADHN COc1cccc([C@H](CNC(=O)Cc2ccc(OCC(C)C)cc2)N2CCCC2)c1 ZINC000518040638 926978323 /nfs/dbraw/zinc/97/83/23/926978323.db2.gz LOESDRKVFSHYGW-DEOSSOPVSA-N 0 3 410.558 4.226 20 0 HIADHN CN(C)[C@H](CNC(=O)Nc1ccc(OC(F)F)c2ncccc12)c1ccccc1 ZINC000518170335 927062022 /nfs/dbraw/zinc/06/20/22/927062022.db2.gz WSDMSHMNQXZSMQ-QGZVFWFLSA-N 0 3 400.429 4.261 20 0 HIADHN COCCOc1ccc(NC(=O)NC[C@H](c2cccs2)N2CCCC2)cc1Cl ZINC000518196407 927077332 /nfs/dbraw/zinc/07/73/32/927077332.db2.gz KLQFYHUUXSTVTA-QGZVFWFLSA-N 0 3 423.966 4.385 20 0 HIADHN CC1(C)CN(C2(CNC(=O)N[C@@H](c3cccs3)C3CC3)CCCCC2)CCO1 ZINC000518221135 927087390 /nfs/dbraw/zinc/08/73/90/927087390.db2.gz WSVKOAPJPMQOEN-LJQANCHMSA-N 0 3 405.608 4.312 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)NCc2cccc(NC(=O)C3CCC3)c2)C1 ZINC000518403889 927244353 /nfs/dbraw/zinc/24/43/53/927244353.db2.gz WPJIIASSUMHTKA-JPYJTQIMSA-N 0 3 420.557 4.060 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)NCc2cccc(NC(=O)C3CCC3)c2)C1 ZINC000518403891 927244959 /nfs/dbraw/zinc/24/49/59/927244959.db2.gz WPJIIASSUMHTKA-WZONZLPQSA-N 0 3 420.557 4.060 20 0 HIADHN COc1cccc(CN(C)C(=O)CN(Cc2ccccc2)C2CCCCC2)c1OC ZINC000518474176 927297277 /nfs/dbraw/zinc/29/72/77/927297277.db2.gz ULJVCJDMTHONPJ-UHFFFAOYSA-N 0 3 410.558 4.497 20 0 HIADHN Cc1cc(C(=O)N(C)C2CCN(CCc3ccccn3)CC2)cc(C)c1OC(F)F ZINC000518599141 927372667 /nfs/dbraw/zinc/37/26/67/927372667.db2.gz RZQLFOVWHUQFEO-UHFFFAOYSA-N 0 3 417.500 4.079 20 0 HIADHN CCOc1cc(CNCc2ccc(CC)s2)ccc1OCC(=O)N1CCCCC1 ZINC000518764414 927481763 /nfs/dbraw/zinc/48/17/63/927481763.db2.gz NAPGLEXCVYTGND-UHFFFAOYSA-N 0 3 416.587 4.390 20 0 HIADHN CC(C)c1c(C(=O)NC[C@@H](C)N(C)Cc2ccccc2)cnn1-c1ccc(F)cc1 ZINC000518908356 927618849 /nfs/dbraw/zinc/61/88/49/927618849.db2.gz YUVQPPHNRRXDOT-GOSISDBHSA-N 0 3 408.521 4.385 20 0 HIADHN C[C@H](CNC(=O)c1cccc(C(=O)N(C)c2ccccc2)c1)N(C)Cc1ccccc1 ZINC000518909763 927618971 /nfs/dbraw/zinc/61/89/71/927618971.db2.gz DCFCYJRQZDOSOV-HXUWFJFHSA-N 0 3 415.537 4.214 20 0 HIADHN COc1ccc(N(C(=O)CCCN2CCN(c3ccccc3)CC2)C(C)C)cc1F ZINC000518910485 927620235 /nfs/dbraw/zinc/62/02/35/927620235.db2.gz DMVFRPRYLLMNGW-UHFFFAOYSA-N 0 3 413.537 4.178 20 0 HIADHN COc1cccc(CN(C[C@H]2CCCO2)C(=O)c2cccc(CN3CCCC3)c2)c1 ZINC000518917821 927625391 /nfs/dbraw/zinc/62/53/91/927625391.db2.gz WPVJAEPTXCNWFD-XMMPIXPASA-N 0 3 408.542 4.112 20 0 HIADHN COc1cc(CN(C)C(=O)NC[C@@H](C)N(C)Cc2ccccc2)ccc1SC ZINC000518966311 927662943 /nfs/dbraw/zinc/66/29/43/927662943.db2.gz FYDTXJIETKKJAA-QGZVFWFLSA-N 0 3 401.576 4.079 20 0 HIADHN CCCN(CC)C(=O)c1ccc(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)cc1 ZINC000519085230 927758297 /nfs/dbraw/zinc/75/82/97/927758297.db2.gz SVKXMQNIQCNCKO-QHCPKHFHSA-N 0 3 407.558 4.126 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)Cc2coc(-c3ccc(Cl)cc3)n2)C1 ZINC000519107820 927776340 /nfs/dbraw/zinc/77/63/40/927776340.db2.gz IKDQXFBAEBTTLL-OXQOHEQNSA-N 0 3 409.917 4.489 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)Nc2cccc([C@H](C)N3CCOCC3)c2)N(C)C)cc1 ZINC000519199226 927823428 /nfs/dbraw/zinc/82/34/28/927823428.db2.gz SXTYPRAVDIQBTM-YADARESESA-N 0 3 424.589 4.067 20 0 HIADHN CCc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@H](c1ccc(OC)cc1)N1CCCC1 ZINC000519237541 927841777 /nfs/dbraw/zinc/84/17/77/927841777.db2.gz LFOIIDKFRRFFAO-OAQYLSRUSA-N 0 3 412.490 4.124 20 0 HIADHN C[C@@H]1C[C@@H]1C(=O)Nc1cccc(C(=O)NC[C@H]2CCCCN2Cc2ccccc2)c1 ZINC000519271914 927858044 /nfs/dbraw/zinc/85/80/44/927858044.db2.gz XGFNBOOKZAURJB-YSZBQJHXSA-N 0 3 405.542 4.066 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2cccc(NC(=O)c3cccs3)c2)N(C)C)cc1 ZINC000519278849 927860502 /nfs/dbraw/zinc/86/05/02/927860502.db2.gz XMJGDBNOMPOFRH-FQEVSTJZSA-N 0 3 407.539 4.342 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)Nc2ccc(-c3ccc(Cl)s3)nc2)CC1 ZINC000519350395 927893536 /nfs/dbraw/zinc/89/35/36/927893536.db2.gz HNHCNJGWSSAWDT-UHFFFAOYSA-N 0 3 422.982 4.474 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)NCCCc3c[nH]c4ccccc34)cc2)CC1 ZINC000519350483 927893619 /nfs/dbraw/zinc/89/36/19/927893619.db2.gz JCECWDFFMSISQW-UHFFFAOYSA-N 0 3 404.558 4.061 20 0 HIADHN CCOc1cc2c(cc1[C@@H]1C[C@@H]1NC(=O)c1cccc(CN3CCCC3)c1)O[C@@H](C)C2 ZINC000519365317 927898027 /nfs/dbraw/zinc/89/80/27/927898027.db2.gz WOOIHFVVICEOKG-HYVJGQCMSA-N 0 3 420.553 4.290 20 0 HIADHN O=C(N[C@H](c1ccc(F)cc1)[C@@H]1CCCO1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000519421627 927937327 /nfs/dbraw/zinc/93/73/27/927937327.db2.gz OZIYIPSVMXZUQT-AJSBUHFISA-N 0 3 414.496 4.213 20 0 HIADHN O=C(N[C@H]1CCOc2c(Cl)cccc21)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000519432591 927943732 /nfs/dbraw/zinc/94/37/32/927943732.db2.gz XIIYLJPHIUROGG-JXFKEZNVSA-N 0 3 402.897 4.331 20 0 HIADHN COc1ccc(Cl)cc1NCCC(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000519432313 927943865 /nfs/dbraw/zinc/94/38/65/927943865.db2.gz DPJVUVBIXIGRTR-QFBILLFUSA-N 0 3 401.938 4.102 20 0 HIADHN Cc1nc(C2(NC(=O)[C@@H]3CCCN(Cc4cccc(F)c4)C3)CCCCCC2)no1 ZINC000519442729 927951144 /nfs/dbraw/zinc/95/11/44/927951144.db2.gz FAWWRYGMQNHKFT-LJQANCHMSA-N 0 3 414.525 4.095 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2nnc(Cc3ccccc3F)s2)N(C)C)cc1 ZINC000519450269 927957346 /nfs/dbraw/zinc/95/73/46/927957346.db2.gz YPUDXAPDEGDPDH-SFHVURJKSA-N 0 3 413.522 4.001 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)NC[C@@H]1CCCO[C@@H]1c1ccccc1 ZINC000519453045 927960649 /nfs/dbraw/zinc/96/06/49/927960649.db2.gz UYCOABKDSZLZRR-JTHBVZDNSA-N 0 3 413.537 4.067 20 0 HIADHN C[C@@H](N[C@H]1c2ccccc2CC12CCOCC2)C(=O)NC12CC3CC(CC(C3)C1)C2 ZINC000519482947 927979641 /nfs/dbraw/zinc/97/96/41/927979641.db2.gz GOKKSPNUQLDELI-HKLCMNTNSA-N 0 3 408.586 4.144 20 0 HIADHN CC(=O)Nc1cccc(NC(=O)N(CCN(C)C)Cc2cccc(Cl)c2)c1C ZINC000519503796 927996719 /nfs/dbraw/zinc/99/67/19/927996719.db2.gz IIQCPBKUQRLQCU-UHFFFAOYSA-N 0 3 402.926 4.203 20 0 HIADHN C[C@@H](Cc1ccc(O)cc1)NC(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1 ZINC000519506455 927998238 /nfs/dbraw/zinc/99/82/38/927998238.db2.gz NBYCOJFEWVKUSA-INIZCTEOSA-N 0 3 423.479 4.115 20 0 HIADHN CC1CCC(N(C)C(=O)CNC2(c3cccc(C(F)(F)F)c3)CCOCC2)CC1 ZINC000519623173 928031314 /nfs/dbraw/zinc/03/13/14/928031314.db2.gz IXPKJNMTSGKBLD-UHFFFAOYSA-N 0 3 412.496 4.338 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N[C@H](C)c1n[nH]c(C(C)C)n1)c1ccccc1Cl ZINC000519651419 928035912 /nfs/dbraw/zinc/03/59/12/928035912.db2.gz GKVWJIQPEWKPCH-PBHICJAKSA-N 0 3 406.962 4.025 20 0 HIADHN C[C@@H](NC(=O)[C@H]1CCCN(Cc2cccnc2)C1)c1ccc(Oc2cccnc2)cc1 ZINC000519792711 928079609 /nfs/dbraw/zinc/07/96/09/928079609.db2.gz QHDKYOJQUKIABX-KNQAVFIVSA-N 0 3 416.525 4.358 20 0 HIADHN C[C@H](NC(=O)[C@@H]1CCCN(Cc2cccnc2)C1)c1ccc(Oc2cccnc2)cc1 ZINC000519792719 928079720 /nfs/dbraw/zinc/07/97/20/928079720.db2.gz QHDKYOJQUKIABX-SIKLNZKXSA-N 0 3 416.525 4.358 20 0 HIADHN CC[C@H](c1ccccc1)N(CC)C(=O)NCc1ccc(CN2CCN(C)CC2)cc1 ZINC000519896727 928131100 /nfs/dbraw/zinc/13/11/00/928131100.db2.gz CJQDACSLIFBAHS-XMMPIXPASA-N 0 3 408.590 4.117 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)c1nn(-c2ccc(C)cc2F)c2c1CCC2 ZINC000519929758 928163302 /nfs/dbraw/zinc/16/33/02/928163302.db2.gz FEKRZTZETARSTO-UHFFFAOYSA-N 0 3 422.504 4.131 20 0 HIADHN CCOc1ccc(-c2nc(CC(=O)NC[C@@H](c3ccc(C)cc3)N(C)C)cs2)cc1 ZINC000520064501 928289939 /nfs/dbraw/zinc/28/99/39/928289939.db2.gz LLIFRYNRWGGAOD-QFIPXVFZSA-N 0 3 423.582 4.479 20 0 HIADHN C[C@H]1C[C@@H]1C(=O)Nc1ccc(C(=O)N(CCN(C)C)Cc2cccc(Cl)c2)cc1 ZINC000520106237 928315140 /nfs/dbraw/zinc/31/51/40/928315140.db2.gz MFHXCTJTMVFZHA-KKSFZXQISA-N 0 3 413.949 4.139 20 0 HIADHN O=C(Nc1cccc(C(=O)N2CCCCC2)c1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000520112835 928318867 /nfs/dbraw/zinc/31/88/67/928318867.db2.gz YCQGYDDIOUDUBD-OAQYLSRUSA-N 0 3 423.532 4.303 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)N[C@@H]1CCc2c1cccc2Cl ZINC000520129954 928326582 /nfs/dbraw/zinc/32/65/82/928326582.db2.gz GGKUTNGEWCMFLV-HXUWFJFHSA-N 0 3 407.892 4.379 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)N[C@@H](c1ccccc1)c1ccccn1 ZINC000520127815 928327559 /nfs/dbraw/zinc/32/75/59/928327559.db2.gz DBEKXJSAXPIXSH-QHCPKHFHSA-N 0 3 406.505 4.084 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3ccc(Cl)c(Cl)c3)CC2)C[C@@H](C)O1 ZINC000520265014 928429708 /nfs/dbraw/zinc/42/97/08/928429708.db2.gz HIRLTTSIUORXME-ZIAGYGMSSA-N 0 3 400.350 4.347 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)NCC1(Sc2ccccc2)CC1 ZINC000520286634 928448298 /nfs/dbraw/zinc/44/82/98/928448298.db2.gz PDMSLBVWNYPKCS-UHFFFAOYSA-N 0 3 419.541 4.363 20 0 HIADHN CCOc1cc(C[NH2+]CCCOc2ccc(OC)cc2)cc(Br)c1[O-] ZINC000520439230 928565857 /nfs/dbraw/zinc/56/58/57/928565857.db2.gz ACFJFSLXESCVLA-UHFFFAOYSA-N 0 3 410.308 4.121 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N(CC)[C@H]1CCOC(C)(C)C1)c1cccc(OC)c1 ZINC000520469234 928584171 /nfs/dbraw/zinc/58/41/71/928584171.db2.gz HQQBMSKNTPCGOI-FPOVZHCZSA-N 0 3 405.583 4.067 20 0 HIADHN Cc1ccc(C)n1-c1nc(CC(=O)NCC(C)(C)N2CCc3ccccc3C2)cs1 ZINC000520494678 928598377 /nfs/dbraw/zinc/59/83/77/928598377.db2.gz HDHDTWTXAFWCGA-UHFFFAOYSA-N 0 3 422.598 4.046 20 0 HIADHN Fc1cccnc1OC1CCN(CCc2nc(-c3ccc(Cl)cc3)no2)CC1 ZINC000520500005 928603559 /nfs/dbraw/zinc/60/35/59/928603559.db2.gz YNXHRUWOVXOLRY-UHFFFAOYSA-N 0 3 402.857 4.010 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)N(CCN(C)C)Cc2ccccc2)c(C)c1 ZINC000520598134 928661798 /nfs/dbraw/zinc/66/17/98/928661798.db2.gz UAJSKQDQJWHTAC-IBGZPJMESA-N 0 3 410.562 4.119 20 0 HIADHN COc1cccc(OC)c1OC[C@H](O)CN(C)[C@H](C)c1ccc(Cl)c(Cl)c1 ZINC000520695053 928743525 /nfs/dbraw/zinc/74/35/25/928743525.db2.gz MENAOKOWQACWPM-UKRRQHHQSA-N 0 3 414.329 4.443 20 0 HIADHN C[C@@H](NC(=O)NC[C@H]1CCCCN1C1CC1)c1ccc(OCc2cccnc2)cc1 ZINC000520706555 928754437 /nfs/dbraw/zinc/75/44/37/928754437.db2.gz WMQADKQUXPXHHR-XMSQKQJNSA-N 0 3 408.546 4.038 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)c1ccc(N2CCCC2)c(F)c1 ZINC000520733904 928782783 /nfs/dbraw/zinc/78/27/83/928782783.db2.gz UVNPHDHPIBHYKP-UHFFFAOYSA-N 0 3 413.562 4.270 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)c1nn(-c2ccccc2)cc1OCC(C)C ZINC000520755603 928803278 /nfs/dbraw/zinc/80/32/78/928803278.db2.gz RRQAHKJIWKOLHA-UHFFFAOYSA-N 0 3 422.529 4.230 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)N[C@H](c1ccc(F)cc1)[C@@H]1CCCO1 ZINC000520816047 928830852 /nfs/dbraw/zinc/83/08/52/928830852.db2.gz LBJCATJIYUISQK-XPWALMASSA-N 0 3 411.521 4.182 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2cc(C3CC3)nc3c2cnn3C(C)C)N(C)C)cc1 ZINC000520859817 928848028 /nfs/dbraw/zinc/84/80/28/928848028.db2.gz GBAHYAAAJYRWDO-QFIPXVFZSA-N 0 3 405.546 4.231 20 0 HIADHN COCCOc1c(Cl)cccc1NC(=O)N[C@H]1CCN(Cc2ccccc2)[C@H]1C ZINC000520882570 928857804 /nfs/dbraw/zinc/85/78/04/928857804.db2.gz AUSWUKRBHBGPKA-LPHOPBHVSA-N 0 3 417.937 4.150 20 0 HIADHN COc1cc(CN[C@@H]2CCc3c2cccc3C)cc(I)c1OC ZINC000520959397 928890825 /nfs/dbraw/zinc/89/08/25/928890825.db2.gz GVLCDLBCSAVLDC-QGZVFWFLSA-N 0 3 423.294 4.394 20 0 HIADHN CCOc1cc(CNCc2ccc3[nH]c(C)c(C)c3c2)ccc1O[C@@H](C)C(=O)N(C)C ZINC000520963532 928891657 /nfs/dbraw/zinc/89/16/57/928891657.db2.gz PPVUEACBPGUQND-SFHVURJKSA-N 0 3 423.557 4.329 20 0 HIADHN COc1ccc(Cl)cc1CNC(=O)N(CCN(C)C)Cc1cccc(Cl)c1 ZINC000521015738 928933105 /nfs/dbraw/zinc/93/31/05/928933105.db2.gz CSNIOQWQPQOYGX-UHFFFAOYSA-N 0 3 410.345 4.275 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)NCc1ccc(C(F)(F)F)cc1 ZINC000521067224 928970715 /nfs/dbraw/zinc/97/07/15/928970715.db2.gz DVNJNCFPNLZWTF-UHFFFAOYSA-N 0 3 415.406 4.257 20 0 HIADHN C[C@@H](CNC(=O)c1cccc(NC(=O)C2CCCCC2)c1)N(C)Cc1ccccc1 ZINC000521096404 928991604 /nfs/dbraw/zinc/99/16/04/928991604.db2.gz IKXFDKANHIFLLG-IBGZPJMESA-N 0 3 407.558 4.456 20 0 HIADHN CN(C(=O)c1ccccc1CSc1nc2ccccc2[nH]1)[C@@H]1CCN(C2CC2)C1 ZINC000521150874 929026624 /nfs/dbraw/zinc/02/66/24/929026624.db2.gz XREUFFFLCNPBEO-GOSISDBHSA-N 0 3 406.555 4.164 20 0 HIADHN C[C@H](CNC(=O)N(C)CCCc1cc(-c2ccccc2)n[nH]1)N(C)Cc1ccccc1 ZINC000521163881 929036773 /nfs/dbraw/zinc/03/67/73/929036773.db2.gz FVPBTJNILNYLMQ-HXUWFJFHSA-N 0 3 419.573 4.171 20 0 HIADHN C[C@H](NC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1)c1nc(-c2ccncc2)cs1 ZINC000521357942 929177278 /nfs/dbraw/zinc/17/72/78/929177278.db2.gz DRWDLXIJKICGAV-QFBILLFUSA-N 0 3 424.545 4.434 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)c1ccc(N2CCCCCC2)nc1 ZINC000521462457 929232864 /nfs/dbraw/zinc/23/28/64/929232864.db2.gz MTGJMXIPPYAIIE-UHFFFAOYSA-N 0 3 408.590 4.099 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)NC[C@@H](c2ccc(C)cc2)N(C)C)c(C)c1 ZINC000521466637 929233810 /nfs/dbraw/zinc/23/38/10/929233810.db2.gz GHKJBPINBXNQNP-AVRDEDQJSA-N 0 3 410.562 4.256 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2ccc(NC(=O)c3cccs3)cc2)N(C)C)cc1 ZINC000521490649 929249804 /nfs/dbraw/zinc/24/98/04/929249804.db2.gz SZSSCWZJOADVEG-FQEVSTJZSA-N 0 3 407.539 4.342 20 0 HIADHN CC(C)N1CCCN(C(=O)C(C)(C)c2csc(-c3cc(F)ccc3F)n2)CC1 ZINC000521520904 929272681 /nfs/dbraw/zinc/27/26/81/929272681.db2.gz KJAFMKLKZJNENO-UHFFFAOYSA-N 0 3 407.530 4.309 20 0 HIADHN O=C(NCCCCOc1ccc(F)cc1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000521532340 929277892 /nfs/dbraw/zinc/27/78/92/929277892.db2.gz JZINEPZQIBLVBW-IBGZPJMESA-N 0 3 402.485 4.152 20 0 HIADHN CC(C)Sc1ccc(Cl)cc1NC(=O)C(=O)N[C@H](C)CN1CCC[C@H](C)C1 ZINC000521545412 929287710 /nfs/dbraw/zinc/28/77/10/929287710.db2.gz MWFSELFNLYLMHU-LSDHHAIUSA-N 0 3 411.999 4.016 20 0 HIADHN CC(C)Sc1ccc(Cl)cc1NC(=O)C(=O)N[C@@H](C)CN1CCC[C@H](C)C1 ZINC000521545410 929288194 /nfs/dbraw/zinc/28/81/94/929288194.db2.gz MWFSELFNLYLMHU-GJZGRUSLSA-N 0 3 411.999 4.016 20 0 HIADHN NS(=O)(=O)c1ccc2c(c1)CCC[C@H]2N[C@@H]1CCc2c1ccc(Cl)c2Cl ZINC000521595077 929316735 /nfs/dbraw/zinc/31/67/35/929316735.db2.gz QWTGHVZJJBJWOF-QZTJIDSGSA-N 0 3 411.354 4.295 20 0 HIADHN Cc1noc(-c2ccc(C)c(NC(=O)[C@@H]3CCCN(Cc4cccc(F)c4)C3)c2)n1 ZINC000521601553 929323597 /nfs/dbraw/zinc/32/35/97/929323597.db2.gz AYSFSVXXLWUAHM-LJQANCHMSA-N 0 3 408.477 4.343 20 0 HIADHN COc1ccc2oc([C@H](C)NC(=O)N(CCN(C)C)Cc3ccc(C)o3)c(C)c2c1 ZINC000521609500 929327316 /nfs/dbraw/zinc/32/73/16/929327316.db2.gz VUDMAZQPUIYLML-KRWDZBQOSA-N 0 3 413.518 4.486 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCc1cccc2cccnc21)c1cccc(OC)c1 ZINC000521715360 929384100 /nfs/dbraw/zinc/38/41/00/929384100.db2.gz NQCSJXPFMURWDH-JOCHJYFZSA-N 0 3 406.530 4.126 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)NC[C@@H]2CCCCN2Cc2ccccc2)c(Cl)c1 ZINC000521853949 929504039 /nfs/dbraw/zinc/50/40/39/929504039.db2.gz NHQDOKOHBWTYEL-IBGZPJMESA-N 0 3 414.937 4.475 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)c1cnn(-c2ccc(C)cc2)c1C ZINC000521883225 929532843 /nfs/dbraw/zinc/53/28/43/929532843.db2.gz MMIQMXRLHFGUQL-HSZRJFAPSA-N 0 3 417.557 4.011 20 0 HIADHN O=C(NC[C@H]1CN(Cc2ccccc2)CCCO1)N1CC[C@H]1c1ccc(Cl)cc1 ZINC000521926376 929567541 /nfs/dbraw/zinc/56/75/41/929567541.db2.gz LBVYMSCSZVTUTI-VXKWHMMOSA-N 0 3 413.949 4.088 20 0 HIADHN CC(C)N(C)S(=O)(=O)c1ccc(CN[C@H]2CCCc3c4ccccc4[nH]c32)cc1 ZINC000521937970 929575826 /nfs/dbraw/zinc/57/58/26/929575826.db2.gz FTGGSOQBOMPMDN-QFIPXVFZSA-N 0 3 411.571 4.364 20 0 HIADHN CCCc1c(C(=O)NC[C@H](C)N(C)Cc2ccccc2)cnn1Cc1ccccc1 ZINC000521957202 929593134 /nfs/dbraw/zinc/59/31/34/929593134.db2.gz WRETUYUSDCKINC-FQEVSTJZSA-N 0 3 404.558 4.134 20 0 HIADHN Cc1nn(Cc2ccccc2Cl)c(C)c1C(=O)NC[C@H](C)N(C)Cc1ccccc1 ZINC000521957021 929593682 /nfs/dbraw/zinc/59/36/82/929593682.db2.gz MRYSRFHJBWGLMN-KRWDZBQOSA-N 0 3 424.976 4.452 20 0 HIADHN CCCc1c(NC(=O)[C@@H]2CCCN(Cc3cccnc3)C2)cnn1-c1ccc(F)cc1 ZINC000522057092 929625141 /nfs/dbraw/zinc/62/51/41/929625141.db2.gz IWRKUXCWTGDGHK-LJQANCHMSA-N 0 3 421.520 4.210 20 0 HIADHN COc1ccc(OC(F)F)c(NC(=O)NC[C@@H]2CCCN2Cc2ccccc2)c1 ZINC000524483029 929631815 /nfs/dbraw/zinc/63/18/15/929631815.db2.gz CBUUSZAZYNCHBP-INIZCTEOSA-N 0 3 405.445 4.083 20 0 HIADHN COCCOc1ccc(NC(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)c(C)c1 ZINC000524623107 929731147 /nfs/dbraw/zinc/73/11/47/929731147.db2.gz ZPIRFJMIGAKLIR-HXUWFJFHSA-N 0 3 411.546 4.149 20 0 HIADHN CCCN(C(=O)NC[C@H](c1cccs1)N1CCCC1)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000524630445 929738419 /nfs/dbraw/zinc/73/84/19/929738419.db2.gz GJDAZPHPLBUBBS-LFGUQSLTSA-N 0 3 405.608 4.120 20 0 HIADHN CN(C)Cc1cccc(C(=O)N2CCC(c3nc(-c4ccncc4)cs3)CC2)c1 ZINC000524675934 929789607 /nfs/dbraw/zinc/78/96/07/929789607.db2.gz FROJAODLLZMBSP-UHFFFAOYSA-N 0 3 406.555 4.287 20 0 HIADHN Cc1c(C(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)cnn1-c1ccc(C)cc1 ZINC000524707658 929806543 /nfs/dbraw/zinc/80/65/43/929806543.db2.gz LTFJEMZTBDRRFW-FQEVSTJZSA-N 0 3 402.542 4.226 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)CN2C[C@@H](c3ccccc3)C[C@@H]2C)c(OC)c1 ZINC000524755280 929820152 /nfs/dbraw/zinc/82/01/52/929820152.db2.gz MDAORBFWRJKKLA-LEDOBFOHSA-N 0 3 408.542 4.245 20 0 HIADHN C[C@H](NC(=O)NCC1(N2CCSCC2)CCCC1)c1ccccc1C(F)(F)F ZINC000524777644 929826389 /nfs/dbraw/zinc/82/63/89/929826389.db2.gz ZBCGVDCWJNNUCN-HNNXBMFYSA-N 0 3 415.525 4.427 20 0 HIADHN COc1cccc([C@H](CNC(=O)NCc2ccc3ccccc3c2)N2CCCC2)c1 ZINC000524779908 929827200 /nfs/dbraw/zinc/82/72/00/929827200.db2.gz PVWBBAISKUUJMT-DEOSSOPVSA-N 0 3 403.526 4.485 20 0 HIADHN COc1cccc(NC2CCN(C[C@H](O)COc3ccc(C(C)(C)C)cc3)CC2)c1 ZINC000524791942 929829840 /nfs/dbraw/zinc/82/98/40/929829840.db2.gz FDYOMYFXDAZMCA-QFIPXVFZSA-N 0 3 412.574 4.309 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)N[C@H](C)c2ncc(-c3ccccc3)o2)c1 ZINC000524802676 929835848 /nfs/dbraw/zinc/83/58/48/929835848.db2.gz GYWBBGRTJKDELO-LJQANCHMSA-N 0 3 406.530 4.484 20 0 HIADHN CCOC(=O)CCc1ccc(NC(=O)NC[C@H](CC)N2CCc3ccccc3C2)cc1 ZINC000524829097 929848782 /nfs/dbraw/zinc/84/87/82/929848782.db2.gz JRBKXCPSZWQXSL-QHCPKHFHSA-N 0 3 423.557 4.141 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)[C@@H]1C[C@H]1c1c(F)cccc1Cl ZINC000524833444 929851244 /nfs/dbraw/zinc/85/12/44/929851244.db2.gz CIEIQZFVDGGNIA-HUUCEWRRSA-N 0 3 410.867 4.451 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)[C@@H]1C[C@@H]1c1c(F)cccc1Cl ZINC000524833446 929851317 /nfs/dbraw/zinc/85/13/17/929851317.db2.gz CIEIQZFVDGGNIA-LSDHHAIUSA-N 0 3 410.867 4.451 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)c1ccccc1OCc1ccncc1 ZINC000524865686 929864810 /nfs/dbraw/zinc/86/48/10/929864810.db2.gz BOAXGYZAQSOWAO-OAQYLSRUSA-N 0 3 415.537 4.397 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)c1ccc(N2CCCCCC2)nc1 ZINC000524868206 929865385 /nfs/dbraw/zinc/86/53/85/929865385.db2.gz JNIDCHITYKTDDY-OAQYLSRUSA-N 0 3 406.574 4.199 20 0 HIADHN CCOc1cc(CNCc2ccccc2CC)ccc1OCC(=O)N1CCCCC1 ZINC000524885555 929872625 /nfs/dbraw/zinc/87/26/25/929872625.db2.gz XXVHVBTWMQJMPE-UHFFFAOYSA-N 0 3 410.558 4.329 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)[C@H]2C[C@H]2c2ccccc2OC(F)(F)F)o1 ZINC000524959024 929921788 /nfs/dbraw/zinc/92/17/88/929921788.db2.gz IJISZDZREHTLGD-ROUUACIJSA-N 0 3 410.436 4.181 20 0 HIADHN CCN(C)[C@H](C(=O)NCc1ccccc1CN(C)Cc1ccco1)c1ccccc1 ZINC000525098176 930034135 /nfs/dbraw/zinc/03/41/35/930034135.db2.gz QGOVHFLKJGLHFL-DEOSSOPVSA-N 0 3 405.542 4.221 20 0 HIADHN Cc1cc(C)n(-c2ccc(CC(=O)N3CC[C@H](C)N(Cc4ccccc4)CC3)cc2)n1 ZINC000525223712 930092278 /nfs/dbraw/zinc/09/22/78/930092278.db2.gz QFFVGVYVAAAQSN-NRFANRHFSA-N 0 3 416.569 4.155 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(F)cc2)CC1)c1cc2cc(Cl)ccc2o1 ZINC000525335639 930172282 /nfs/dbraw/zinc/17/22/82/930172282.db2.gz XFYYTSJPAPGBTQ-UHFFFAOYSA-N 0 3 416.880 4.499 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N[C@@H]3C[C@@H]3c3c(F)cccc3Cl)cc2)CC1 ZINC000525338202 930176014 /nfs/dbraw/zinc/17/60/14/930176014.db2.gz ATGNKIHWVILTJN-GHTZIAJQSA-N 0 3 415.940 4.295 20 0 HIADHN Cc1ccc(C(=O)NC[C@@H](C)N(C)Cc2ccccc2)cc1NC(=O)NC(C)(C)C ZINC000525376298 930205439 /nfs/dbraw/zinc/20/54/39/930205439.db2.gz GDXXMSWUJWYSDH-GOSISDBHSA-N 0 3 410.562 4.165 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)c1cc(C2CC2)nn1-c1ccccc1 ZINC000525381549 930208420 /nfs/dbraw/zinc/20/84/20/930208420.db2.gz UXZNKRYLMNZDJZ-FQEVSTJZSA-N 0 3 414.553 4.486 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)c1ccnc(SCC(F)(F)F)c1 ZINC000525383153 930210558 /nfs/dbraw/zinc/21/05/58/930210558.db2.gz YIXBTOWBNBMFMK-INIZCTEOSA-N 0 3 423.504 4.473 20 0 HIADHN CC(C)c1n[nH]c(C(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)c1Br ZINC000525392915 930214891 /nfs/dbraw/zinc/21/48/91/930214891.db2.gz FKEJIJCAMVXTNG-OAHLLOKOSA-N 0 3 419.367 4.032 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)NCCc1ccc(OC(F)F)cc1 ZINC000525399877 930220025 /nfs/dbraw/zinc/22/00/25/930220025.db2.gz DCFLBTVCQZWYIZ-SFHVURJKSA-N 0 3 417.500 4.137 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1ccc(OC[C@@H]2CCCO2)cc1 ZINC000525412465 930225568 /nfs/dbraw/zinc/22/55/68/930225568.db2.gz AQJKYHFSJTWIRS-RDPSFJRHSA-N 0 3 423.557 4.373 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1cccc(OC[C@H]2CCCO2)c1 ZINC000525415275 930227803 /nfs/dbraw/zinc/22/78/03/930227803.db2.gz IYNKIJINALTCQQ-HYBUGGRVSA-N 0 3 423.557 4.373 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1cccc(OC[C@H]2CCCO2)c1 ZINC000525415274 930228000 /nfs/dbraw/zinc/22/80/00/930228000.db2.gz IYNKIJINALTCQQ-GBXCKJPGSA-N 0 3 423.557 4.373 20 0 HIADHN COc1cc(CN(C(=O)c2cccc(CN(C)C)c2)C2CC2)ccc1OC(F)F ZINC000525490162 930277837 /nfs/dbraw/zinc/27/78/37/930277837.db2.gz ICDFTCKUYHNJEB-UHFFFAOYSA-N 0 3 404.457 4.163 20 0 HIADHN COc1ccc(C[C@@H](NC(=O)c2cccc(CN(C)C)c2)c2ccccc2)cc1OC ZINC000525490302 930277893 /nfs/dbraw/zinc/27/78/93/930277893.db2.gz OOCGSKGHCZHKNX-HSZRJFAPSA-N 0 3 418.537 4.479 20 0 HIADHN CC(C)C(=O)Nc1ccc(Cl)c(C(=O)NC[C@H]2CCCN2Cc2ccccc2)c1 ZINC000525499973 930285940 /nfs/dbraw/zinc/28/59/40/930285940.db2.gz JQEIIPHOUBYALF-LJQANCHMSA-N 0 3 413.949 4.329 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2cc3ccccc3s2)cc1)[C@@H]1CCCN(C)C1 ZINC000525581408 930343159 /nfs/dbraw/zinc/34/31/59/930343159.db2.gz XTRJPZVPFJTRRP-LJQANCHMSA-N 0 3 407.539 4.320 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N3c4ccccc4N(C)CC[C@@H]3C)cc2)CC1 ZINC000525596086 930353733 /nfs/dbraw/zinc/35/37/33/930353733.db2.gz OVVUXBAKHNHJTQ-FQEVSTJZSA-N 0 3 406.574 4.092 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)c1ccc(NC(=O)CC(C)C)c(F)c1 ZINC000525675743 930400142 /nfs/dbraw/zinc/40/01/42/930400142.db2.gz PZTZUPAXYQNNNX-UHFFFAOYSA-N 0 3 401.482 4.133 20 0 HIADHN FC(F)Oc1cc2c(cc1CNCCc1nc(-c3cccc(Cl)c3)no1)OCO2 ZINC000525696306 930406826 /nfs/dbraw/zinc/40/68/26/930406826.db2.gz WLDQSCTUSHKLIJ-UHFFFAOYSA-N 0 3 423.803 4.052 20 0 HIADHN COCCOc1cccc(CNC2(c3ccc(Br)cc3)CCOCC2)c1 ZINC000525697368 930407986 /nfs/dbraw/zinc/40/79/86/930407986.db2.gz OYOWUENFSYAEBJ-UHFFFAOYSA-N 0 3 420.347 4.270 20 0 HIADHN CN(CC(C)(C)C)C(=O)c1cccc(C(=O)NC[C@@H]2CCCN2Cc2ccccc2)c1 ZINC000525754655 930431343 /nfs/dbraw/zinc/43/13/43/930431343.db2.gz JEZSAXZEZLQJNG-QHCPKHFHSA-N 0 3 421.585 4.199 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCO[C@@H](c2ccccc2C)C1)c1ccsc1 ZINC000525756638 930432247 /nfs/dbraw/zinc/43/22/47/930432247.db2.gz KXMABCXOWGCUCW-NHCUHLMSSA-N 0 3 401.576 4.223 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CCO[C@@H](c2ccccc2C)C1)c1ccsc1 ZINC000525756637 930432506 /nfs/dbraw/zinc/43/25/06/930432506.db2.gz KXMABCXOWGCUCW-LEWJYISDSA-N 0 3 401.576 4.223 20 0 HIADHN CCN1CCCC[C@@H]1C(=O)N1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1 ZINC000525763292 930434924 /nfs/dbraw/zinc/43/49/24/930434924.db2.gz VDQJHPGFLBQWNX-GOSISDBHSA-N 0 3 412.361 4.045 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)Nc2ccc(Cl)cc2Cl)CC1 ZINC000525778278 930440832 /nfs/dbraw/zinc/44/08/32/930440832.db2.gz UPFFFNBEVLZJEL-UHFFFAOYSA-N 0 3 421.372 4.453 20 0 HIADHN C[C@@H]1c2c(F)cccc2CCN1C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000525928412 930485230 /nfs/dbraw/zinc/48/52/30/930485230.db2.gz JBQDZGDXJKWRCB-NVPAJSRCSA-N 0 3 413.459 4.260 20 0 HIADHN C[C@@H](CN[C@H](C(N)=O)c1ccc(Br)cc1)c1ccc(C(F)(F)F)cc1 ZINC000525951893 930492341 /nfs/dbraw/zinc/49/23/41/930492341.db2.gz ISLHTVOLDINLFQ-ZBEGNZNMSA-N 0 3 415.253 4.388 20 0 HIADHN Cc1ccc([C@@H](CCn2cncn2)NCc2ccc(N3CCCCCC3)nc2)cc1 ZINC000526107101 930536329 /nfs/dbraw/zinc/53/63/29/930536329.db2.gz VMKFZFDWXDJTAP-HSZRJFAPSA-N 0 3 404.562 4.283 20 0 HIADHN CC[C@H](N[C@@H]1CCC[C@H](S(C)(=O)=O)C1)c1ccc(Br)cc1Cl ZINC000526117032 930538881 /nfs/dbraw/zinc/53/88/81/930538881.db2.gz PQQBJLXWOJPRJM-WWGRRREGSA-N 0 3 408.789 4.499 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3cccc(F)c3F)c(OCC)c2)CC1 ZINC000530348335 930688774 /nfs/dbraw/zinc/68/87/74/930688774.db2.gz IYMIBJUUTIQMLR-UHFFFAOYSA-N 0 3 403.473 4.148 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1cnc(-c2ccccc2)nc1 ZINC000530625465 930776237 /nfs/dbraw/zinc/77/62/37/930776237.db2.gz BAEOPJADSYPOKL-LJQANCHMSA-N 0 3 401.514 4.272 20 0 HIADHN CN(C)Cc1ccc(-c2noc(CCSc3ccc4c(c3)OCCCO4)n2)cc1 ZINC000530632702 930779912 /nfs/dbraw/zinc/77/99/12/930779912.db2.gz DAFNMEVMKLPPFS-UHFFFAOYSA-N 0 3 411.527 4.294 20 0 HIADHN C[C@@H](Sc1ccccc1)c1ccc(NC(=O)C(=O)N2CC[C@@H](N3CCCC3)C2)cc1 ZINC000530747093 930815576 /nfs/dbraw/zinc/81/55/76/930815576.db2.gz VJZSLSMMKJKFAR-WIYYLYMNSA-N 0 3 423.582 4.175 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)NCc1ccc(OC2CCCCC2)nc1 ZINC000530752206 930816830 /nfs/dbraw/zinc/81/68/30/930816830.db2.gz RRUTXTKFYFUPRY-UHFFFAOYSA-N 0 3 416.591 4.128 20 0 HIADHN Cc1cccc(Oc2ccc(NC(=O)[C@]3(O)CCN(Cc4ccccc4)C3)cn2)c1C ZINC000530823910 930832484 /nfs/dbraw/zinc/83/24/84/930832484.db2.gz VVBDVWMKQWVGAV-VWLOTQADSA-N 0 3 417.509 4.066 20 0 HIADHN CC(C)OCc1ccccc1CNC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000530826621 930832730 /nfs/dbraw/zinc/83/27/30/930832730.db2.gz ZRKLWRBCNYOOJY-XMMPIXPASA-N 0 3 409.574 4.418 20 0 HIADHN CN(C(=O)c1cnn(-c2ccccc2Cl)c1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000530825195 930832745 /nfs/dbraw/zinc/83/27/45/930832745.db2.gz FHZVAXANXUZNDG-FQEVSTJZSA-N 0 3 408.933 4.262 20 0 HIADHN COc1cc(C[C@@H](CO)CNCc2csc(-c3ccc(C)cc3)n2)cc(OC)c1 ZINC000530870468 930844189 /nfs/dbraw/zinc/84/41/89/930844189.db2.gz FBWQHKQUGVZSIH-GOSISDBHSA-N 0 3 412.555 4.077 20 0 HIADHN COc1ccc(OC)c(-c2nn(-c3ccccc3)cc2CNCc2ccn(C)c2)c1 ZINC000530879367 930847469 /nfs/dbraw/zinc/84/74/69/930847469.db2.gz FHGXJXGKQJCMHG-UHFFFAOYSA-N 0 3 402.498 4.185 20 0 HIADHN Cc1c(C(=O)N(Cc2ccccc2)C2CCN(C)CC2)cnn1-c1ccc(C)cc1 ZINC000530983667 930876197 /nfs/dbraw/zinc/87/61/97/930876197.db2.gz ULSDCQJJECGZOG-UHFFFAOYSA-N 0 3 402.542 4.226 20 0 HIADHN C[C@@H](Oc1ccc(C(=O)N(CCN(C)C)Cc2cccs2)cn1)c1ccccc1 ZINC000530988237 930877705 /nfs/dbraw/zinc/87/77/05/930877705.db2.gz PASDDRWQSMVUPR-GOSISDBHSA-N 0 3 409.555 4.487 20 0 HIADHN Fc1ccc(-c2n[nH]c(CNCc3ccc(-n4ccc(C(F)(F)F)n4)cc3)n2)cc1 ZINC000531018079 930886250 /nfs/dbraw/zinc/88/62/50/930886250.db2.gz QUBDGVLMLISVIE-UHFFFAOYSA-N 0 3 416.382 4.105 20 0 HIADHN Fc1ccc(-c2nnc(C[NH2+]Cc3ccc(-n4ccc(C(F)(F)F)n4)cc3)[n-]2)cc1 ZINC000531018079 930886254 /nfs/dbraw/zinc/88/62/54/930886254.db2.gz QUBDGVLMLISVIE-UHFFFAOYSA-N 0 3 416.382 4.105 20 0 HIADHN CCN(Cc1cccc(-c2ccncc2)c1)C(=O)CC1(N2CCOCC2)CCCC1 ZINC000531059247 930900754 /nfs/dbraw/zinc/90/07/54/930900754.db2.gz PWHXDJUIWXNQJH-UHFFFAOYSA-N 0 3 407.558 4.132 20 0 HIADHN FC(F)(F)[C@]1(c2nc(COc3ccccc3)no2)CCN(Cc2ccccc2)C1 ZINC000531117878 930930324 /nfs/dbraw/zinc/93/03/24/930930324.db2.gz RUASBCOIMSXKCM-HXUWFJFHSA-N 0 3 403.404 4.355 20 0 HIADHN O=C(Nc1ccc(Cl)c(Br)c1)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000531279909 930998847 /nfs/dbraw/zinc/99/88/47/930998847.db2.gz HEQOHMMHCPWQBT-CQSZACIVSA-N 0 3 408.727 4.348 20 0 HIADHN COc1ccc([C@@H](CNC(=O)[C@H]2CCCCN2Cc2ccccc2)N2CCCC2)cc1 ZINC000531281676 930999601 /nfs/dbraw/zinc/99/96/01/930999601.db2.gz XZYVKKFYFUIDNW-JWQCQUIFSA-N 0 3 421.585 4.003 20 0 HIADHN C[C@H](NC(=O)CC1(N2CCOCC2)CCCC1)c1cc(F)c(Cl)cc1Cl ZINC000531282577 931000330 /nfs/dbraw/zinc/00/03/30/931000330.db2.gz VDJZJHFIOGDBRH-ZDUSSCGKSA-N 0 3 403.325 4.345 20 0 HIADHN CCN(CC)[C@@H](C(=O)NC[C@@H](C)Cn1ccnc1C)c1cccc(C(F)(F)F)c1 ZINC000531285124 931000591 /nfs/dbraw/zinc/00/05/91/931000591.db2.gz DAWDGTZFCYYMCJ-DNVCBOLYSA-N 0 3 410.484 4.046 20 0 HIADHN CCc1nc(CN(C)C(=O)N[C@H](CN2CCc3ccccc3C2)C(C)(C)C)cs1 ZINC000531423976 931051513 /nfs/dbraw/zinc/05/15/13/931051513.db2.gz LIVFHGZIFSKKKW-HXUWFJFHSA-N 0 3 414.619 4.320 20 0 HIADHN COc1ccc(-c2ccccc2)cc1CNCc1ccc(CN2CCOCC2)cc1 ZINC000531536104 931095992 /nfs/dbraw/zinc/09/59/92/931095992.db2.gz CVSVZVNOLQHLPV-UHFFFAOYSA-N 0 3 402.538 4.484 20 0 HIADHN COc1cc(CNCc2cccc(-c3ccc(C)cc3)c2)ccc1OCC(=O)N(C)C ZINC000531554214 931101469 /nfs/dbraw/zinc/10/14/69/931101469.db2.gz ODYOYDUPQLHGHL-UHFFFAOYSA-N 0 3 418.537 4.427 20 0 HIADHN CCCn1nc(C)c(CNC[C@H](c2c(F)cccc2Cl)N2CCO[C@@H](C)C2)c1C ZINC000531596555 931115839 /nfs/dbraw/zinc/11/58/39/931115839.db2.gz WYCCYZPTOTYBJB-YCRPNKLZSA-N 0 3 422.976 4.254 20 0 HIADHN CC[C@H](C)NC(=O)c1cccc(CN[C@H](C)c2ccc(OCc3nccn3C)cc2)c1 ZINC000531682135 931150912 /nfs/dbraw/zinc/15/09/12/931150912.db2.gz NLLILKOVBYWYSB-RBUKOAKNSA-N 0 3 420.557 4.378 20 0 HIADHN CC(C)NS(=O)(=O)Cc1ccc(CN[C@H]2CCCOc3c(Cl)cccc32)cc1 ZINC000531694727 931157413 /nfs/dbraw/zinc/15/74/13/931157413.db2.gz FIBAOAYLXAXJCY-FQEVSTJZSA-N 0 3 422.978 4.171 20 0 HIADHN CC(=O)N1CCN(c2ccccc2CN[C@@H](C)c2ccccc2C(F)(F)F)CC1 ZINC000531706377 931167042 /nfs/dbraw/zinc/16/70/42/931167042.db2.gz PVEPJBSHCAQALM-INIZCTEOSA-N 0 3 405.464 4.225 20 0 HIADHN CN1CCN(C[C@@H](N[C@H]2CCSc3ccc(Cl)cc32)c2ccccc2)CC1 ZINC000531710111 931169132 /nfs/dbraw/zinc/16/91/32/931169132.db2.gz KKHSZGILHXDBGF-LEWJYISDSA-N 0 3 402.007 4.455 20 0 HIADHN Cc1noc(-c2ccc(C)c(NC(=O)N[C@@H]3C[C@H](C)N(Cc4ccccc4)C3)c2)n1 ZINC000531812330 931206574 /nfs/dbraw/zinc/20/65/74/931206574.db2.gz JMJUCFJZKHQIJV-OXJNMPFZSA-N 0 3 405.502 4.138 20 0 HIADHN CC(C)N1CCN([C@@H]2CCN(C(=O)c3cc4c(s3)CC[C@@H](C(C)(C)C)C4)C2)CC1 ZINC000531832315 931211849 /nfs/dbraw/zinc/21/18/49/931211849.db2.gz TZHOKVFXSCGPIW-WOJBJXKFSA-N 0 3 417.663 4.140 20 0 HIADHN CC[C@H](C)[C@@H](NC(=O)N1CC[C@@H](N2CCN(C(C)C)CC2)C1)c1ccc(Cl)cc1 ZINC000531839690 931216166 /nfs/dbraw/zinc/21/61/66/931216166.db2.gz MKOARJVCPSKZHX-VLCRHTCISA-N 0 3 421.029 4.237 20 0 HIADHN Cc1cc(-c2ccccc2)ccc1NC(=O)N1CC[C@@H](N2CCN(C(C)C)CC2)C1 ZINC000531839996 931216325 /nfs/dbraw/zinc/21/63/25/931216325.db2.gz YYGCFUZTDPFNSP-HSZRJFAPSA-N 0 3 406.574 4.294 20 0 HIADHN CCCO[C@@H]1CCCN(CC(=O)N[C@H](C)c2ccc(OC(F)(F)F)cc2)CC1 ZINC000531904939 931241656 /nfs/dbraw/zinc/24/16/56/931241656.db2.gz SAKAUFWLRSXDTF-NVXWUHKLSA-N 0 3 402.457 4.044 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@H](C)N[C@@H]2CCc3ccc(OC)cc32)cc1 ZINC000531931028 931249673 /nfs/dbraw/zinc/24/96/73/931249673.db2.gz DPJOYQJWKCAYBZ-KSFYIVLOSA-N 0 3 402.560 4.064 20 0 HIADHN C[C@@H](NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)nc1)c1ccc(Br)cc1 ZINC000531936279 931253088 /nfs/dbraw/zinc/25/30/88/931253088.db2.gz JGJPUCYFTNBOHQ-BZUAXINKSA-N 0 3 404.352 4.309 20 0 HIADHN COc1ccc(NC(=O)C[C@H](C)NCc2ccc(F)cc2C(F)(F)F)c(OC)c1 ZINC000531937476 931254286 /nfs/dbraw/zinc/25/42/86/931254286.db2.gz BXPZZAYIRZAEBB-LBPRGKRZSA-N 0 3 414.399 4.369 20 0 HIADHN COc1ccc(Cl)cc1[C@@H](CC(C)C)NCc1ccc(N2CCN(C)CC2)nc1 ZINC000531942257 931255667 /nfs/dbraw/zinc/25/56/67/931255667.db2.gz DJHPNYKMLQZKRL-OAQYLSRUSA-N 0 3 416.997 4.372 20 0 HIADHN Cc1nc(C(C)C)sc1[C@H](C)NCc1ccc(CS(=O)(=O)NC(C)C)cc1 ZINC000531951635 931260910 /nfs/dbraw/zinc/26/09/10/931260910.db2.gz MDXYNRXFJRWJIC-HNNXBMFYSA-N 0 3 409.621 4.254 20 0 HIADHN C[C@@H](N[C@@H](CN1CCN(C)CC1)c1ccccc1)c1sccc1Br ZINC000531965609 931268639 /nfs/dbraw/zinc/26/86/39/931268639.db2.gz FBBAZDYNXWETSN-QAPCUYQASA-N 0 3 408.409 4.150 20 0 HIADHN COc1ccc([C@@H](C)[C@H](C)NCc2csc(CNC(=O)c3ccccc3)n2)cc1 ZINC000531977201 931272895 /nfs/dbraw/zinc/27/28/95/931272895.db2.gz OUSKPQLCXIWFNY-IRXDYDNUSA-N 0 3 409.555 4.364 20 0 HIADHN O=C([C@H]1CCCN(Cc2cccnc2)C1)N(CCc1cccc(F)c1)C1CCCC1 ZINC000532051327 931297489 /nfs/dbraw/zinc/29/74/89/931297489.db2.gz QWCVXBVIMBYHRE-QFIPXVFZSA-N 0 3 409.549 4.447 20 0 HIADHN CC(C)N1CCN([C@@H]2CCN(C(=O)C3(Cc4cccc(Cl)c4)CCCC3)C2)CC1 ZINC000532088637 931307790 /nfs/dbraw/zinc/30/77/90/931307790.db2.gz CABZHKUXJICGOM-JOCHJYFZSA-N 0 3 418.025 4.070 20 0 HIADHN CCC(=O)N1CC[C@H](NCc2cccc(NC(=O)c3ccc(Cl)cc3Cl)c2)C1 ZINC000532139509 931326592 /nfs/dbraw/zinc/32/65/92/931326592.db2.gz KLQUKROWEIBQFP-KRWDZBQOSA-N 0 3 420.340 4.346 20 0 HIADHN CCCNC(=O)c1cccc(CN[C@H](C)CC(=O)N(C)Cc2cccc(Cl)c2)c1 ZINC000532192953 931343229 /nfs/dbraw/zinc/34/32/29/931343229.db2.gz JQDPKILKWRZAEB-QGZVFWFLSA-N 0 3 415.965 4.007 20 0 HIADHN C[C@H](NC[C@@H](c1ccccc1Cl)N1CCCC1)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000532204378 931349203 /nfs/dbraw/zinc/34/92/03/931349203.db2.gz ZFLOPOVWKKASNA-YWZLYKJASA-N 0 3 424.969 4.370 20 0 HIADHN C[C@@H](NC[C@@H](O)COc1cccc(C(F)(F)F)c1)c1ccccc1OC(F)F ZINC000532207419 931350911 /nfs/dbraw/zinc/35/09/11/931350911.db2.gz JAXPIPLALKXKHT-TZMCWYRMSA-N 0 3 405.363 4.397 20 0 HIADHN COc1ccc(CN[C@H](C)CC(=O)Nc2ccc(OC(F)(F)F)cc2)c(OC)c1 ZINC000532208729 931352147 /nfs/dbraw/zinc/35/21/47/931352147.db2.gz QPVXYWNWMCHSMD-CYBMUJFWSA-N 0 3 412.408 4.109 20 0 HIADHN COc1cccc(COc2cccc(Cl)c2CN[C@H]2CCC[C@@H](C(N)=O)C2)c1 ZINC000532210322 931353067 /nfs/dbraw/zinc/35/30/67/931353067.db2.gz VADFEPRBZVYIOS-SJORKVTESA-N 0 3 402.922 4.061 20 0 HIADHN COc1cccc(CN[C@@H](C)CC(=O)Nc2ccc(OC(F)(F)F)cc2)c1OC ZINC000532210830 931354245 /nfs/dbraw/zinc/35/42/45/931354245.db2.gz JSVJUHRENGXNOS-ZDUSSCGKSA-N 0 3 412.408 4.109 20 0 HIADHN CCOc1ccc(Cl)cc1[C@H](C)N[C@H](CN1CCN(C)CC1)c1ccccc1 ZINC000532221239 931359709 /nfs/dbraw/zinc/35/97/09/931359709.db2.gz HIYCGAMGBPOAHT-PGRDOPGGSA-N 0 3 401.982 4.378 20 0 HIADHN CCN(CC)C(=O)Nc1ccc([C@H](C)N[C@@H]2CCCN(c3ccccc3)C2=O)cc1 ZINC000532222611 931360369 /nfs/dbraw/zinc/36/03/69/931360369.db2.gz UNEUTXQYLUFJGR-PGRDOPGGSA-N 0 3 408.546 4.407 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)N[C@@H](C)c2cccc(N3CCCS3(=O)=O)c2)cc1 ZINC000532233016 931365463 /nfs/dbraw/zinc/36/54/63/931365463.db2.gz JSAYGSLCYAFPFJ-MSOLQXFVSA-N 0 3 424.570 4.132 20 0 HIADHN COc1ccc(CNC(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)c(C)c1 ZINC000532255618 931372961 /nfs/dbraw/zinc/37/29/61/931372961.db2.gz GMRBATPSZKJLCW-UHFFFAOYSA-N 0 3 423.479 4.296 20 0 HIADHN COc1ccc([C@@H](C)NCc2ccc(OCCN3CCOCC3)c(Cl)c2)cc1F ZINC000532346607 931403327 /nfs/dbraw/zinc/40/33/27/931403327.db2.gz RHLNABSWSWVMRQ-MRXNPFEDSA-N 0 3 422.928 4.050 20 0 HIADHN Cc1ccc(Oc2ccccc2)c(NC(=O)N2CC[C@@H](N3CCN(C(C)C)CC3)C2)c1 ZINC000532350921 931404917 /nfs/dbraw/zinc/40/49/17/931404917.db2.gz ZJODDZFNLNXHHI-OAQYLSRUSA-N 0 3 422.573 4.420 20 0 HIADHN c1cnn(-c2cccc(CNCc3ccc(OCCOc4ccccc4)nc3)c2)c1 ZINC000532366465 931411447 /nfs/dbraw/zinc/41/14/47/931411447.db2.gz HZRYMEAPOJARNG-UHFFFAOYSA-N 0 3 400.482 4.015 20 0 HIADHN C[C@H](CC[S@](C)=O)NCc1cc(Br)ccc1OCc1ccccc1 ZINC000532374738 931415111 /nfs/dbraw/zinc/41/51/11/931415111.db2.gz WCPFUNCJIGIKDQ-MYYSRTQBSA-N 0 3 410.377 4.275 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@H](C)N[C@H]2CCCc3ccc(OC)cc32)cc1 ZINC000532441348 931435787 /nfs/dbraw/zinc/43/57/87/931435787.db2.gz CAEOWNCDEGHSFB-SBUREZEXSA-N 0 3 416.587 4.454 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)NCc2ccc(N3C[C@@H](C)O[C@@H](C)C3)nc2)cc1 ZINC000532446761 931438950 /nfs/dbraw/zinc/43/89/50/931438950.db2.gz XPOSRUPDMVWROA-CEXWTWQISA-N 0 3 405.546 4.040 20 0 HIADHN C[C@H](CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)NCc1cccnc1N(C)C ZINC000532450775 931439564 /nfs/dbraw/zinc/43/95/64/931439564.db2.gz BVBJSHXFHSSXCO-GFCCVEGCSA-N 0 3 414.859 4.327 20 0 HIADHN C[C@H]1CSc2ccc(Br)cc2[C@H]1NCc1ccc2c(c1)nnn2C ZINC000532479127 931454596 /nfs/dbraw/zinc/45/45/96/931454596.db2.gz DSIJURNPQFVJRW-VOJFVSQTSA-N 0 3 403.349 4.304 20 0 HIADHN CC(C)NS(=O)(=O)Cc1ccccc1CN[C@@H](C)c1ccccc1C(F)(F)F ZINC000532482789 931456409 /nfs/dbraw/zinc/45/64/09/931456409.db2.gz IRRQLNPYPUDKAZ-HNNXBMFYSA-N 0 3 414.493 4.384 20 0 HIADHN CC(=O)N1CCN(c2ccccc2CN[C@@H](C)c2cccc(OC(F)(F)F)c2)CC1 ZINC000532488076 931458184 /nfs/dbraw/zinc/45/81/84/931458184.db2.gz MEEXXHWQKCHBMX-INIZCTEOSA-N 0 3 421.463 4.105 20 0 HIADHN C[C@@H](N[C@@H](CN1CCN(C)CC1)c1ccccc1)c1ccc(F)c(Br)c1 ZINC000532497603 931462918 /nfs/dbraw/zinc/46/29/18/931462918.db2.gz AMQWCFNYKLLXAB-IERDGZPVSA-N 0 3 420.370 4.228 20 0 HIADHN Cc1ccc2cccc(C(=O)Nc3ccnn3[C@@H]3CCN(Cc4ccccc4)C3)c2n1 ZINC000532521178 931473301 /nfs/dbraw/zinc/47/33/01/931473301.db2.gz YQAQMKGYRFRNNV-OAQYLSRUSA-N 0 3 411.509 4.439 20 0 HIADHN COc1ccc([C@@H](N[C@H](C)Cc2ccsc2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000532531084 931512653 /nfs/dbraw/zinc/51/26/53/931512653.db2.gz KHSIFIDRDNVGII-OPAMFIHVSA-N 0 3 415.580 4.470 20 0 HIADHN CCN(CC(=O)NC[C@H](c1c[nH]c2ccccc21)c1ccc(OC)cc1)C1CCC1 ZINC000532574954 931535516 /nfs/dbraw/zinc/53/55/16/931535516.db2.gz KTHVBGDVNUMVFE-QFIPXVFZSA-N 0 3 405.542 4.299 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)CN2C[C@H](c3ccccc3)C[C@H]2C)cc1OC ZINC000532582848 931540299 /nfs/dbraw/zinc/54/02/99/931540299.db2.gz YYAAPHGKCWUFHR-QIJUGHKUSA-N 0 3 408.542 4.245 20 0 HIADHN C[C@@H](NCc1cnn(Cc2ccccc2)c1)[C@H](OC1CCOCC1)c1ccccc1 ZINC000532615537 931555294 /nfs/dbraw/zinc/55/52/94/931555294.db2.gz DLBOMOKSBDFKIF-NLFFAJNJSA-N 0 3 405.542 4.346 20 0 HIADHN CCc1ccccc1NC(=O)CN(C)C(=O)[C@@H](C)N[C@H](c1ccccc1)C1CCC1 ZINC000532686184 931584237 /nfs/dbraw/zinc/58/42/37/931584237.db2.gz DCKGFMQOOBQKDK-HOYKHHGWSA-N 0 3 407.558 4.165 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CNC(=O)CN[C@H](c1ccccc1)C1CCC1 ZINC000532687579 931585003 /nfs/dbraw/zinc/58/50/03/931585003.db2.gz FGQLBMMRXGVTGY-RUZDIDTESA-N 0 3 402.542 4.236 20 0 HIADHN O=C(CNC1(c2ccc(F)cc2)CCCC1)N1CCC(C(=O)Nc2ccccc2)CC1 ZINC000532698675 931593296 /nfs/dbraw/zinc/59/32/96/931593296.db2.gz LCCFNILTTOBJLZ-UHFFFAOYSA-N 0 3 423.532 4.062 20 0 HIADHN COc1ccccc1[C@@H](C)N(C)C(=O)CNC1(c2ccc(Cl)cc2)CCOCC1 ZINC000532713946 931604215 /nfs/dbraw/zinc/60/42/15/931604215.db2.gz BEVARFCFWCYJMD-QGZVFWFLSA-N 0 3 416.949 4.164 20 0 HIADHN CCCN1CCN(c2ccccc2CNc2ccc(N3CCCC3=O)c(F)c2)CC1 ZINC000532743613 931619221 /nfs/dbraw/zinc/61/92/21/931619221.db2.gz IGWBLCAFHXFCKP-UHFFFAOYSA-N 0 3 410.537 4.097 20 0 HIADHN O=C(CN1CCN(CC2CCCC2)CC1)Nc1ccc(Cl)c(C(F)(F)F)c1 ZINC000532773206 931628689 /nfs/dbraw/zinc/62/86/89/931628689.db2.gz SKSGUSJUIDQFNK-UHFFFAOYSA-N 0 3 403.876 4.105 20 0 HIADHN CC(C)N1CCN([C@@H]2CCN(C(=O)C(C)(C)c3ccc(-c4ccccc4)cc3)C2)CC1 ZINC000532783474 931630633 /nfs/dbraw/zinc/63/06/33/931630633.db2.gz OJQSAMLLNRISFJ-RUZDIDTESA-N 0 3 419.613 4.258 20 0 HIADHN COc1ccc(CNCc2ccccc2CS(=O)(=O)N2CCCC2)c2ccccc12 ZINC000532856883 931665981 /nfs/dbraw/zinc/66/59/81/931665981.db2.gz OIUNDECXSGYRKL-UHFFFAOYSA-N 0 3 424.566 4.064 20 0 HIADHN COc1ccccc1/C=C\CNCc1ccc(Br)cc1N1CCOCC1 ZINC000532886738 931679028 /nfs/dbraw/zinc/67/90/28/931679028.db2.gz PRXBLJDAUJEFRM-XQRVVYSFSA-N 0 3 417.347 4.097 20 0 HIADHN CC(=O)N(c1nc(CN2CCN(CC(C)C)CC2)cs1)c1ccc(C)c(C)c1 ZINC000532897725 931683871 /nfs/dbraw/zinc/68/38/71/931683871.db2.gz BWINDBOOIRBNKI-UHFFFAOYSA-N 0 3 400.592 4.218 20 0 HIADHN CC(C)[C@H](NCC(=O)NCc1ccccc1Cn1cccn1)c1ccc(Cl)cc1 ZINC000532902571 931685699 /nfs/dbraw/zinc/68/56/99/931685699.db2.gz DTTWKCBKBLTTOC-QHCPKHFHSA-N 0 3 410.949 4.188 20 0 HIADHN COc1cc(CN(C)Cc2ccc(OCc3nccn3C)cc2)ccc1OC(F)F ZINC000532912588 931690387 /nfs/dbraw/zinc/69/03/87/931690387.db2.gz MERJRIVPXGNWAA-UHFFFAOYSA-N 0 3 417.456 4.241 20 0 HIADHN O=C(CN1CCC(CCc2ccc(O)cc2)CC1)N1CCc2[nH]c3ccccc3c2C1 ZINC000532922822 931696081 /nfs/dbraw/zinc/69/60/81/931696081.db2.gz MLRHWNXSSVPXOZ-UHFFFAOYSA-N 0 3 417.553 4.103 20 0 HIADHN Cc1cc(C)c(CC(C(=O)Nc2ccc3c(c2)OCC(=O)N3C)C(F)(F)F)c(C)c1 ZINC000532932008 931701255 /nfs/dbraw/zinc/70/12/55/931701255.db2.gz FVNYZQLOCNPIQD-QGZVFWFLSA-N 0 3 420.431 4.327 20 0 HIADHN CCN1CCCN(CC(=O)N(Cc2ccccc2)c2nc3c(cccc3C)s2)CC1 ZINC000532943302 931705690 /nfs/dbraw/zinc/70/56/90/931705690.db2.gz YNDKQJGXIUNJTO-UHFFFAOYSA-N 0 3 422.598 4.166 20 0 HIADHN C[C@H](N[C@H](c1ccc(F)cc1)C1CCC1)C(=O)Nc1ccc(N2CCCC2=O)cc1 ZINC000533054874 931755595 /nfs/dbraw/zinc/75/55/95/931755595.db2.gz YDYUVASEXNJOMX-HJPURHCSSA-N 0 3 409.505 4.411 20 0 HIADHN CN(C(=O)CNC1(c2ccc(Cl)cc2)CCOCC1)[C@@H]1CCCc2ccccc21 ZINC000533062819 931760040 /nfs/dbraw/zinc/76/00/40/931760040.db2.gz YYTYOECMVOWOSD-JOCHJYFZSA-N 0 3 412.961 4.471 20 0 HIADHN O=C([C@H]1CCCN(Cc2cccnc2)C1)N1CCC(Oc2ccccc2Cl)CC1 ZINC000533126370 931776261 /nfs/dbraw/zinc/77/62/61/931776261.db2.gz UXOTUSKALILCKX-IBGZPJMESA-N 0 3 413.949 4.017 20 0 HIADHN CCOC(=O)c1cc2cc(NC(=O)[C@@H]3CCCN(Cc4cccnc4)C3)ccc2s1 ZINC000533145933 931783883 /nfs/dbraw/zinc/78/38/83/931783883.db2.gz SUEVJECCJBKISE-QGZVFWFLSA-N 0 3 423.538 4.324 20 0 HIADHN C[C@@H](CNCc1nc(-c2cc(Cl)ccc2Cl)cs1)CN1CCOCC1 ZINC000533149411 931787885 /nfs/dbraw/zinc/78/78/85/931787885.db2.gz SOJFRZXWKUBEOY-ZDUSSCGKSA-N 0 3 400.375 4.175 20 0 HIADHN O[C@@]1(CNCc2ccc(OCc3ccccc3)cc2OCc2ccccc2)CCOC1 ZINC000533178882 931802635 /nfs/dbraw/zinc/80/26/35/931802635.db2.gz KRXJXFLGNLFAKD-AREMUKBSSA-N 0 3 419.521 4.086 20 0 HIADHN CCCOc1cccc(CNCc2ccc(Br)cc2N2CCOCC2)c1 ZINC000533200924 931807577 /nfs/dbraw/zinc/80/75/77/931807577.db2.gz UBUZFVNOTANGPS-UHFFFAOYSA-N 0 3 419.363 4.364 20 0 HIADHN O=C(NCC(F)(F)F)C1CCN(Cc2ccc(OCc3ccc(F)cc3)cc2)CC1 ZINC000533221626 931813582 /nfs/dbraw/zinc/81/35/82/931813582.db2.gz XDEIMYUBRKBSPS-UHFFFAOYSA-N 0 3 424.438 4.295 20 0 HIADHN CC(C)[C@H](NCC(=O)N(C)CC(=O)Nc1ccccc1C(F)(F)F)c1ccccc1 ZINC000533229985 931814970 /nfs/dbraw/zinc/81/49/70/931814970.db2.gz VDMQHMMUBCKLRF-NRFANRHFSA-N 0 3 421.463 4.089 20 0 HIADHN COC(=O)c1sc2[nH]c(CN(C)C3CCC(C(C)(C)C)CC3)nc(=O)c2c1C ZINC000533248649 931818578 /nfs/dbraw/zinc/81/85/78/931818578.db2.gz CDRUTRFHAWDDIA-UHFFFAOYSA-N 0 3 405.564 4.116 20 0 HIADHN CC(C)N(Cc1ccc(F)cc1)Cc1cc(=O)n2cc(Br)ccc2n1 ZINC000533250712 931819005 /nfs/dbraw/zinc/81/90/05/931819005.db2.gz JNNDIGODHQAPBA-UHFFFAOYSA-N 0 3 404.283 4.007 20 0 HIADHN Cc1cc(NC(=O)CO[C@@H]2CCC[C@@H](C)C2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000533261240 931821743 /nfs/dbraw/zinc/82/17/43/931821743.db2.gz FWVXTVAAGUEXRY-BVYCBKJFSA-N 0 3 410.562 4.172 20 0 HIADHN CN(C)[C@@H]1CCCN(Cc2nc(=O)c3c(-c4ccccc4Cl)csc3[nH]2)C1 ZINC000533276008 931825342 /nfs/dbraw/zinc/82/53/42/931825342.db2.gz UFMGXSDKMLNVOP-CYBMUJFWSA-N 0 3 402.951 4.243 20 0 HIADHN C[C@@H]1C[N@H+](Cc2ccccc2)CCCN1Cc1nc2c3ccccc3oc2c(=O)[n-]1 ZINC000533295140 931831831 /nfs/dbraw/zinc/83/18/31/931831831.db2.gz WEDBTRKKVQMMGW-QGZVFWFLSA-N 0 3 402.498 4.178 20 0 HIADHN C[C@@H]1C[N@@H+](Cc2ccccc2)CCCN1Cc1nc2c3ccccc3oc2c(=O)[n-]1 ZINC000533295140 931831832 /nfs/dbraw/zinc/83/18/32/931831832.db2.gz WEDBTRKKVQMMGW-QGZVFWFLSA-N 0 3 402.498 4.178 20 0 HIADHN Cc1ccc(C)c([C@H](C)N(C)Cc2cc(=O)n3cc(Br)ccc3n2)c1 ZINC000533299630 931832966 /nfs/dbraw/zinc/83/29/66/931832966.db2.gz GDNAUOKBEVRWHP-HNNXBMFYSA-N 0 3 400.320 4.267 20 0 HIADHN COc1cc(OC)c(OC)cc1CN[C@@H](C)[C@@H](OC1CCOCC1)c1ccccc1 ZINC000533329421 931839856 /nfs/dbraw/zinc/83/98/56/931839856.db2.gz GYJLVDNSHSTXEP-BXKMTCNYSA-N 0 3 415.530 4.127 20 0 HIADHN CC(C)(CO)[C@H](CNCc1csc(-c2ccc3c(c2)OCO3)n1)c1ccccc1 ZINC000533330588 931840239 /nfs/dbraw/zinc/84/02/39/931840239.db2.gz YIUMAXQVMVHALA-LJQANCHMSA-N 0 3 410.539 4.431 20 0 HIADHN COc1cc(C)c([C@@H](C)NC(=O)CN[C@@H](c2ccc(F)cc2)C2CCC2)cc1OC ZINC000533367897 931850341 /nfs/dbraw/zinc/85/03/41/931850341.db2.gz ZZSHDWMFBREHDL-VOIUYBSRSA-N 0 3 414.521 4.460 20 0 HIADHN C/C=C\c1ccc(OC[C@H](O)CN(C)[C@H]2CCCc3nc(C)sc32)c(OC)c1 ZINC000533386190 931854392 /nfs/dbraw/zinc/85/43/92/931854392.db2.gz FMSFMFZJTPIRAW-JVEIWDLLSA-N 0 3 402.560 4.242 20 0 HIADHN C[C@H](c1ccc(F)c(F)c1)N(C)C(=O)CNC1(c2ccc(Cl)cc2)CCOCC1 ZINC000533385445 931854669 /nfs/dbraw/zinc/85/46/69/931854669.db2.gz MLMSSFLVTMPAOK-OAHLLOKOSA-N 0 3 422.903 4.433 20 0 HIADHN CCOC(=O)c1c(-c2ccco2)csc1NC(=O)CN(C(C)C)C1CCOCC1 ZINC000533396036 931857535 /nfs/dbraw/zinc/85/75/35/931857535.db2.gz KPDAQJYAZIAMRM-UHFFFAOYSA-N 0 3 420.531 4.013 20 0 HIADHN Cc1cc(NC(=O)COc2cc(C)cc(C)c2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000533398431 931858086 /nfs/dbraw/zinc/85/80/86/931858086.db2.gz ZPIHFSQLUVFHPE-QFIPXVFZSA-N 0 3 418.541 4.273 20 0 HIADHN COc1ccc(CCN(Cc2nc3ccsc3c(=O)[nH]2)CC(C)C)cc1OC ZINC000533434852 931867671 /nfs/dbraw/zinc/86/76/71/931867671.db2.gz CFDNDGGFLSMQSA-UHFFFAOYSA-N 0 3 401.532 4.115 20 0 HIADHN CCCCOc1ccc([C@H](C)N[C@@H]2CCCN(CC(F)(F)F)C2=O)cc1OC ZINC000533449117 931872528 /nfs/dbraw/zinc/87/25/28/931872528.db2.gz MKDJZMGHSNWLSW-GOEBONIOSA-N 0 3 402.457 4.078 20 0 HIADHN O=C(CN[C@H](c1ccc(F)cc1)C1CCC1)N1CCC(C(=O)Nc2ccccc2)CC1 ZINC000533505249 931887330 /nfs/dbraw/zinc/88/73/30/931887330.db2.gz GONZSRKSGWTEGF-DEOSSOPVSA-N 0 3 423.532 4.134 20 0 HIADHN C[C@H](C(=O)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1)C1CCOCC1 ZINC000533715419 931986433 /nfs/dbraw/zinc/98/64/33/931986433.db2.gz BRLUQVOWPJNJSZ-INIZCTEOSA-N 0 3 413.389 4.481 20 0 HIADHN C[C@H](CC(=O)Nc1cccc(N2CCCC2)c1)NCc1cnc([C@@H]2CCCO2)s1 ZINC000533753829 932010662 /nfs/dbraw/zinc/01/06/62/932010662.db2.gz CPCHRFZNXZZQSN-UZLBHIALSA-N 0 3 414.575 4.102 20 0 HIADHN CN(C)[C@@H](CNC(=O)C(C)(C)c1cccc(Br)c1)Cc1ccccc1 ZINC000533811233 932043091 /nfs/dbraw/zinc/04/30/91/932043091.db2.gz MWFRMEKTHRYDIA-LJQANCHMSA-N 0 3 403.364 4.016 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N[C@H](C)Cc2c(Cl)cccc2Cl)CC1 ZINC000533902536 932090747 /nfs/dbraw/zinc/09/07/47/932090747.db2.gz HLRZXCCFNJIOTA-OAHLLOKOSA-N 0 3 416.393 4.113 20 0 HIADHN Cc1ccc([C@H](CNC(=O)[C@H](OC2CCOCC2)c2ccccc2)N2CCCC2)cc1 ZINC000533907149 932093873 /nfs/dbraw/zinc/09/38/73/932093873.db2.gz NUKQFQKQKNZTOV-LOSJGSFVSA-N 0 3 422.569 4.185 20 0 HIADHN CN1CC[C@@H](NC(=O)NCc2cccnc2Oc2cccc(F)c2)[C@H]1c1ccccc1 ZINC000533929569 932106326 /nfs/dbraw/zinc/10/63/26/932106326.db2.gz ZPHROISRCQGAEJ-FGZHOGPDSA-N 0 3 420.488 4.258 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)Cc2c[nH]c3cc(Br)ccc23)c1 ZINC000533967821 932145892 /nfs/dbraw/zinc/14/58/92/932145892.db2.gz BXAYORQKVIDJGN-UHFFFAOYSA-N 0 3 400.320 4.482 20 0 HIADHN CN1CC[C@@H](NC(=O)C2CCN(c3nc4ccccc4s3)CC2)[C@H]1c1ccccc1 ZINC000534017958 932199547 /nfs/dbraw/zinc/19/95/47/932199547.db2.gz LTLQCZOTIPSSQI-IFMALSPDSA-N 0 3 420.582 4.074 20 0 HIADHN CC(C)n1ncc2c1nc(C1CC1)cc2C(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000534020397 932202417 /nfs/dbraw/zinc/20/24/17/932202417.db2.gz VKWVNALKCXXSIB-IRLDBZIGSA-N 0 3 403.530 4.065 20 0 HIADHN O[C@H]1C[C@@H](CNCc2ccc(-c3nc4ccccc4s3)o2)N(Cc2ccccc2)C1 ZINC000534083635 932262993 /nfs/dbraw/zinc/26/29/93/932262993.db2.gz JZUZVJMZUBVIGH-OALUTQOASA-N 0 3 419.550 4.281 20 0 HIADHN O=C(Nc1ccc2nc(C(F)F)[nH]c2c1)c1ccc(CN2CCSCC2)cc1 ZINC000534084565 932264333 /nfs/dbraw/zinc/26/43/33/932264333.db2.gz IDARWKWIATVFLQ-UHFFFAOYSA-N 0 3 402.470 4.302 20 0 HIADHN O=C(CC1CCC(c2ccccc2)CC1)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1CO ZINC000534183252 932320022 /nfs/dbraw/zinc/32/00/22/932320022.db2.gz BUUIDIWZHFIXTA-GLRQHGBSSA-N 0 3 420.597 4.350 20 0 HIADHN O=C(N[C@@H]1CCN(Cc2ccccc2)C[C@H]1CO)c1ccc(OC2CCCCC2)cc1 ZINC000534182681 932320098 /nfs/dbraw/zinc/32/00/98/932320098.db2.gz WMMMPURGOFINJD-WIOPSUGQSA-N 0 3 422.569 4.011 20 0 HIADHN NC(=O)c1ccc(NC(=O)CCN2CCC(=Cc3cccc(F)c3)CC2)cc1Cl ZINC000534309315 932380187 /nfs/dbraw/zinc/38/01/87/932380187.db2.gz FLFXTAYIJHBUIM-UHFFFAOYSA-N 0 3 415.896 4.086 20 0 HIADHN CC1(C)CCC[C@@H](CN2CCN(CC(=O)Nc3ccccc3C(F)(F)F)CC2)C1 ZINC000534333200 932384308 /nfs/dbraw/zinc/38/43/08/932384308.db2.gz BMYXMQPSSJLJSG-QGZVFWFLSA-N 0 3 411.512 4.478 20 0 HIADHN O=C(NCC(F)(F)F)C1CCN(Cc2cccc(OCc3ccc(F)cc3)c2)CC1 ZINC000534341797 932386895 /nfs/dbraw/zinc/38/68/95/932386895.db2.gz YBNJCMWERXWBCG-UHFFFAOYSA-N 0 3 424.438 4.295 20 0 HIADHN Brc1ccccc1N1CC[C@H](NCc2cnc([C@H]3CCCO3)s2)C1 ZINC000534464057 932481597 /nfs/dbraw/zinc/48/15/97/932481597.db2.gz AGHMNCOMSYLTHJ-SUMWQHHRSA-N 0 3 408.365 4.126 20 0 HIADHN Cc1nc2ccccc2n1C[C@@H]1CCCN1CC(=O)NC1(c2ccccc2)CCC1 ZINC000534473909 932502177 /nfs/dbraw/zinc/50/21/77/932502177.db2.gz ZQCWRYCMXGASLW-NRFANRHFSA-N 0 3 402.542 4.005 20 0 HIADHN Cc1cc(C)c(CC(C(=O)Nc2ccc3c(c2)oc(=O)n3C)C(F)(F)F)c(C)c1 ZINC000534474539 932503774 /nfs/dbraw/zinc/50/37/74/932503774.db2.gz NCVHZCOONLNJJT-MRXNPFEDSA-N 0 3 406.404 4.416 20 0 HIADHN CC[C@H](NC(=O)NC[C@H](c1cccc(OC)c1)N(CC)CC)c1c(C)noc1C ZINC000534518429 932542469 /nfs/dbraw/zinc/54/24/69/932542469.db2.gz TUJQIHUBAZPRMZ-VQTJNVASSA-N 0 3 402.539 4.133 20 0 HIADHN CN1CC[C@H](NC(=O)NCc2ccc(COCC(F)(F)F)cc2)[C@H]1c1ccccc1 ZINC000534610360 932594013 /nfs/dbraw/zinc/59/40/13/932594013.db2.gz RHAUKHOAUKZEEW-VQTJNVASSA-N 0 3 421.463 4.010 20 0 HIADHN Cc1cc(C(=O)NC[C@@H](Cc2ccccc2)N(C)C)ccc1NC(=O)c1cccs1 ZINC000534649793 932621827 /nfs/dbraw/zinc/62/18/27/932621827.db2.gz ZGZWLULMZMDJDH-HXUWFJFHSA-N 0 3 421.566 4.212 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cc(OC)c(Br)s1)c1ccsc1 ZINC000534652802 932623248 /nfs/dbraw/zinc/62/32/48/932623248.db2.gz RJSBCFPFZCCZRU-GFCCVEGCSA-N 0 3 417.394 4.394 20 0 HIADHN CN1CC[C@H](NC(=O)N2CCC[C@H](c3nc4c(s3)CCCC4)C2)[C@@H]1c1ccccc1 ZINC000534682388 932651555 /nfs/dbraw/zinc/65/15/55/932651555.db2.gz QPWFKXRNIKHNNB-VCOUNFBDSA-N 0 3 424.614 4.356 20 0 HIADHN Cc1cccc(NC(=O)N2CCC[C@H](C(=O)Nc3cc(C)cc(CN(C)C)c3)C2)c1 ZINC000534707124 932678848 /nfs/dbraw/zinc/67/88/48/932678848.db2.gz QXSRCOZIQSNYRF-FQEVSTJZSA-N 0 3 408.546 4.248 20 0 HIADHN CC[C@H](NC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1)c1nc(-c2ccccc2)c[nH]1 ZINC000534713657 932682891 /nfs/dbraw/zinc/68/28/91/932682891.db2.gz HEHUWYSKCHRSRI-VWPQPMDRSA-N 0 3 403.530 4.272 20 0 HIADHN CN1CC[C@H](NC(=O)[C@@H]2C[C@@H]2c2ccccc2OC(F)(F)F)[C@@H]1c1ccccc1 ZINC000534754857 932732469 /nfs/dbraw/zinc/73/24/69/932732469.db2.gz MPMGOWSWERVIKO-XSYGEPLQSA-N 0 3 404.432 4.250 20 0 HIADHN Cc1cc(C)c(CC(C(=O)N2CC[C@H](C(N)=O)c3ccccc32)C(F)(F)F)c(C)c1 ZINC000534781257 932762043 /nfs/dbraw/zinc/76/20/43/932762043.db2.gz SPXGQMDBGRYTMJ-PKOBYXMFSA-N 0 3 418.459 4.339 20 0 HIADHN Fc1ccc(Br)c2c1CC[C@@H]2NC1CCN(Cc2ccccn2)CC1 ZINC000534793219 932773640 /nfs/dbraw/zinc/77/36/40/932773640.db2.gz IOBPCDYKOVFAFB-IBGZPJMESA-N 0 3 404.327 4.225 20 0 HIADHN CC(=O)N1CCN(c2ccccc2CN[C@H]2CCc3c2cc(Cl)cc3Cl)CC1 ZINC000534793989 932774909 /nfs/dbraw/zinc/77/49/09/932774909.db2.gz GPLJWBLLFRKOHP-NRFANRHFSA-N 0 3 418.368 4.439 20 0 HIADHN Cc1cc(NC(=O)N2CCc3ccsc3C2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000534824900 932795597 /nfs/dbraw/zinc/79/55/97/932795597.db2.gz NZJACAUCBBVMFS-FQEVSTJZSA-N 0 3 421.570 4.290 20 0 HIADHN CC(C)c1cc(Br)ccc1NC(=O)N1CCN(CC2CCOCC2)CC1 ZINC000534825660 932796386 /nfs/dbraw/zinc/79/63/86/932796386.db2.gz FJLDDRLGMMPENP-UHFFFAOYSA-N 0 3 424.383 4.149 20 0 HIADHN O=C1NCCN1[C@@H]1CCCN(Cc2ccc(-c3ccccc3Br)s2)C1 ZINC000535083018 932899735 /nfs/dbraw/zinc/89/97/35/932899735.db2.gz GQXAMRHIYBEIRS-CQSZACIVSA-N 0 3 420.376 4.167 20 0 HIADHN O=C(Nc1ccccc1)NC1CCN(Cc2ccc(OC[C@H]3CCCO3)cc2)CC1 ZINC000535084621 932901475 /nfs/dbraw/zinc/90/14/75/932901475.db2.gz LOZVRESHKKDEAZ-HSZRJFAPSA-N 0 3 409.530 4.031 20 0 HIADHN Cc1c(C(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)cccc1-c1ccccn1 ZINC000535097886 932914235 /nfs/dbraw/zinc/91/42/35/932914235.db2.gz AORUXTVRIIRYEM-WOJBJXKFSA-N 0 3 421.585 4.409 20 0 HIADHN Cc1cc(C)c(C[C@H](C(=O)N(CCN(C)C)Cc2ccccn2)C(F)(F)F)c(C)c1 ZINC000535153879 932970683 /nfs/dbraw/zinc/97/06/83/932970683.db2.gz ZXHFCPGTZDUWHG-OAQYLSRUSA-N 0 3 421.507 4.318 20 0 HIADHN CC[C@H](NCc1ccc(OC)c(OC)c1Cl)[C@@H](c1ccc(C)cc1)n1cncn1 ZINC000535185803 933001575 /nfs/dbraw/zinc/00/15/75/933001575.db2.gz MNBQVXIERAFDIF-GHTZIAJQSA-N 0 3 414.937 4.415 20 0 HIADHN CN(C)[C@H](CNC(=O)Nc1ccc(Br)cc1Cl)Cc1ccccc1 ZINC000535254867 933038640 /nfs/dbraw/zinc/03/86/40/933038640.db2.gz FUVSNTBEHDAPOV-HNNXBMFYSA-N 0 3 410.743 4.397 20 0 HIADHN CN(C)[C@@H](CNC(=O)c1cccnc1SCc1ccc(F)cc1)Cc1ccccc1 ZINC000535257594 933039823 /nfs/dbraw/zinc/03/98/23/933039823.db2.gz OAIBCRQKJUQZHQ-OAQYLSRUSA-N 0 3 423.557 4.416 20 0 HIADHN Cc1c(NC(=O)NC[C@@H](Cc2ccccc2)N(C)C)cccc1OCC(F)(F)F ZINC000535258699 933040504 /nfs/dbraw/zinc/04/05/04/933040504.db2.gz WRIZRQZOIPXSRK-QGZVFWFLSA-N 0 3 409.452 4.231 20 0 HIADHN Cc1ccc(C[C@@H](NC(=O)NC[C@@H](Cc2ccccc2)N(C)C)c2ccccn2)cc1 ZINC000535263388 933041446 /nfs/dbraw/zinc/04/14/46/933041446.db2.gz YTOVBHIGCVFFBN-ILBGXUMGSA-N 0 3 416.569 4.146 20 0 HIADHN Cc1nc(C(C)C)sc1[C@H](C)N(C)C(=O)NC[C@@H](Cc1ccccc1)N(C)C ZINC000535266577 933042033 /nfs/dbraw/zinc/04/20/33/933042033.db2.gz XACAMUFQBDBCEY-PKOBYXMFSA-N 0 3 402.608 4.450 20 0 HIADHN CC[C@H](NC(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1)c1c(C)noc1C ZINC000535278733 933046507 /nfs/dbraw/zinc/04/65/07/933046507.db2.gz XPNYXKRAHLVSRY-PXNSSMCTSA-N 0 3 409.452 4.313 20 0 HIADHN Cc1cc(C(=O)NC[C@@H](c2ccccc2)N(C)C)ccc1NC(=O)c1cccs1 ZINC000535329825 933076601 /nfs/dbraw/zinc/07/66/01/933076601.db2.gz MSZSGKNBNCFXOV-FQEVSTJZSA-N 0 3 407.539 4.342 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1)c1nc2ccccc2n1C(F)F ZINC000535340427 933081878 /nfs/dbraw/zinc/08/18/78/933081878.db2.gz OCCRSJSOZDHAJD-YJLNNSPDSA-N 0 3 413.472 4.237 20 0 HIADHN CN(Cc1ccccc1OC(F)(F)F)C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000535395081 933112821 /nfs/dbraw/zinc/11/28/21/933112821.db2.gz DKAOAODLNFSXGR-IEBWSBKVSA-N 0 3 407.436 4.172 20 0 HIADHN CN(C)Cc1ccc(-c2noc([C@@H]3COc4ccc(Br)cc43)n2)cc1 ZINC000535406358 933120149 /nfs/dbraw/zinc/12/01/49/933120149.db2.gz OKESZPSOZDXNAZ-MRXNPFEDSA-N 0 3 400.276 4.085 20 0 HIADHN CN1CC[C@H](NC(=O)c2cccc(NC(=O)c3ccc(F)cc3)c2)[C@H]1c1ccccc1 ZINC000535467050 933155948 /nfs/dbraw/zinc/15/59/48/933155948.db2.gz APKLOPMXHFUUAK-XZOQPEGZSA-N 0 3 417.484 4.253 20 0 HIADHN CN1CC[C@H](NC(=O)Cc2c[nH]c3cccc(Br)c23)[C@H]1c1ccccc1 ZINC000535468395 933159012 /nfs/dbraw/zinc/15/90/12/933159012.db2.gz JISQDXMDGHWAPJ-GHTZIAJQSA-N 0 3 412.331 4.035 20 0 HIADHN CC1CCN([C@H](CNC(=O)Nc2cccc3c2OCCO3)c2cccs2)CC1 ZINC000535471481 933162546 /nfs/dbraw/zinc/16/25/46/933162546.db2.gz HYYFVPVAHZUSOL-QGZVFWFLSA-N 0 3 401.532 4.114 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)CCCc3cc(F)ccc3F)CC2)C[C@H](C)O1 ZINC000535608852 933265647 /nfs/dbraw/zinc/26/56/47/933265647.db2.gz GPMJISDIMTUFAJ-HDICACEKSA-N 0 3 408.533 4.025 20 0 HIADHN O=C(CCCc1csc2ccccc12)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1CO ZINC000535632346 933274893 /nfs/dbraw/zinc/27/48/93/933274893.db2.gz QCEMFBXWTGNQAG-FYYLOGMGSA-N 0 3 422.594 4.223 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)c1cc(-c2ccccn2)ccc1Cl ZINC000535841343 933425981 /nfs/dbraw/zinc/42/59/81/933425981.db2.gz NNFJPHSTFBQXPB-UHFFFAOYSA-N 0 3 415.990 4.493 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1cccc(OC(C)C)n1 ZINC000535864286 933447912 /nfs/dbraw/zinc/44/79/12/933447912.db2.gz GMXMLZRHGQEMDM-HXUWFJFHSA-N 0 3 419.529 4.073 20 0 HIADHN CC(C)(C)[C@H](CN1CCc2ccccc2C1)NC(=O)c1csc([C@H]2CCCO2)n1 ZINC000535879468 933460970 /nfs/dbraw/zinc/46/09/70/933460970.db2.gz GPUJGKKCVJHMDS-UXHICEINSA-N 0 3 413.587 4.197 20 0 HIADHN Cc1nc2ccccc2n1C[C@@H]1CCCN1CC(=O)N[C@@H](c1ccccc1)C1CC1 ZINC000535966172 933527836 /nfs/dbraw/zinc/52/78/36/933527836.db2.gz XZDSFRYVAIIPRO-OFVILXPXSA-N 0 3 402.542 4.077 20 0 HIADHN Cc1cc(Sc2ncccn2)ccc1NC(=O)NC[C@H](Cc1ccccc1)N(C)C ZINC000536019219 933574915 /nfs/dbraw/zinc/57/49/15/933574915.db2.gz UTKUHEBUOAOANY-IBGZPJMESA-N 0 3 421.570 4.231 20 0 HIADHN CC(C)(NC(=O)[C@H]1CCCN(Cc2cccnc2)C1)c1ccccc1Br ZINC000536062536 933614223 /nfs/dbraw/zinc/61/42/23/933614223.db2.gz LSBNLNVOVJKRPJ-KRWDZBQOSA-N 0 3 416.363 4.108 20 0 HIADHN Cc1nc(-c2ccccc2)sc1CNC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000536095415 933645891 /nfs/dbraw/zinc/64/58/91/933645891.db2.gz LDWAUYRMMJTZQX-TZIWHRDSSA-N 0 3 406.555 4.363 20 0 HIADHN O=C(Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1)Nc1ccccn1 ZINC000536131219 933679771 /nfs/dbraw/zinc/67/97/71/933679771.db2.gz ZZSAHKYEDFISSP-UHFFFAOYSA-N 0 3 401.514 4.090 20 0 HIADHN Clc1cc(Br)cc2c1CC[C@H]2NCc1cccnc1-n1cccn1 ZINC000536153615 933689470 /nfs/dbraw/zinc/68/94/70/933689470.db2.gz WANVDCVJGJIZDE-QGZVFWFLSA-N 0 3 403.711 4.460 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@@H]2CNC(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)cc1 ZINC000536155145 933691047 /nfs/dbraw/zinc/69/10/47/933691047.db2.gz MUAKBJGQVUUVPF-LWSSLDFYSA-N 0 3 407.558 4.207 20 0 HIADHN O=C(CN[C@H](c1ccccc1)C1CC1)N1CCC[C@@H]1c1ccc2c(c1)OCCCO2 ZINC000537288361 933698699 /nfs/dbraw/zinc/69/86/99/933698699.db2.gz UTCCGLTUXSTUBE-PXDATVDWSA-N 0 3 406.526 4.252 20 0 HIADHN CC[C@H](NCc1ccc(N2CCO[C@H](C)C2)nc1)c1cc(F)cc(Br)c1 ZINC000537294942 933701979 /nfs/dbraw/zinc/70/19/79/933701979.db2.gz HGHLFGBHSIZBBU-KUHUBIRLSA-N 0 3 422.342 4.449 20 0 HIADHN CCN1CCN(CCC(=O)N(Cc2cccc3ccccc32)c2ccccc2)CC1 ZINC000537417177 933766742 /nfs/dbraw/zinc/76/67/42/933766742.db2.gz SIUOWCRIHIUPJI-UHFFFAOYSA-N 0 3 401.554 4.401 20 0 HIADHN CCN1CCN(Cc2ccc(N[C@H](C)c3ccc4c(c3)C(C)(C)C(=O)N4)cc2)CC1 ZINC000537434406 933774053 /nfs/dbraw/zinc/77/40/53/933774053.db2.gz NPKDYOSFCWWEJB-GOSISDBHSA-N 0 3 406.574 4.227 20 0 HIADHN C[C@@H](CC(=O)N(C)Cc1cccc(Cl)c1)NC1(c2ccc3c(c2)OCO3)CC1 ZINC000537448869 933778005 /nfs/dbraw/zinc/77/80/05/933778005.db2.gz UQYZWXUAVBTZEC-HNNXBMFYSA-N 0 3 400.906 4.085 20 0 HIADHN CN(CCCN(C)C(=O)[C@H]1C[C@@H]1c1cc(Cl)cc(Cl)c1)Cc1ccncc1 ZINC000562857288 945128599 /nfs/dbraw/zinc/12/85/99/945128599.db2.gz OCAXNQGJIFXARP-UXHICEINSA-N 0 3 406.357 4.472 20 0 HIADHN COCc1cccc(CN2CCC(O)(Cc3ccc(OC(F)(F)F)cc3)CC2)c1 ZINC000537533231 938317414 /nfs/dbraw/zinc/31/74/14/938317414.db2.gz JTTJJYFRJDLEHG-UHFFFAOYSA-N 0 3 409.448 4.301 20 0 HIADHN Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)C(=O)N[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000537551894 938321634 /nfs/dbraw/zinc/32/16/34/938321634.db2.gz RRCWPJZOZVETOQ-GMBSWORKSA-N 0 3 422.495 4.117 20 0 HIADHN CCOCc1cc(CN2CCC(n3cc(Br)cn3)CC2)ccc1OC ZINC000537626657 938338307 /nfs/dbraw/zinc/33/83/07/938338307.db2.gz CDWSHUYBKWUYCZ-UHFFFAOYSA-N 0 3 408.340 4.028 20 0 HIADHN FC(F)Oc1cc2c(cc1CN(Cc1ccccc1)CC1CCOCC1)OCO2 ZINC000537626965 938339169 /nfs/dbraw/zinc/33/91/69/938339169.db2.gz JDVNBDPXWDRDRK-UHFFFAOYSA-N 0 3 405.441 4.446 20 0 HIADHN CC1CCC(OC2CCN(Cc3ccccc3OCC(=O)N3CCCC3)CC2)CC1 ZINC000537629934 938340764 /nfs/dbraw/zinc/34/07/64/938340764.db2.gz HPVGPSVVDASERN-UHFFFAOYSA-N 0 3 414.590 4.248 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)CCn2c3ccccc3nc2C2CC2)CC1 ZINC000537672447 938350868 /nfs/dbraw/zinc/35/08/68/938350868.db2.gz XCKUZQZKDFWQTR-SFHVURJKSA-N 0 3 417.557 4.041 20 0 HIADHN CCOC(=O)c1c2c(sc1NC(=O)C1C[C@H](C)O[C@@H](C)C1)C(C)(C)NC(C)(C)C2 ZINC000537710523 938361340 /nfs/dbraw/zinc/36/13/40/938361340.db2.gz PWJSFJJWILEDTH-STQMWFEESA-N 0 3 422.591 4.226 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@@H](C)Oc2ccccc2Cl)cc1 ZINC000537731304 938364935 /nfs/dbraw/zinc/36/49/35/938364935.db2.gz TUJGFKOUDGIWLG-OXQOHEQNSA-N 0 3 402.922 4.069 20 0 HIADHN O=C(Cc1cccc(OCc2cccnc2)c1)NC[C@@H](c1cccs1)N1CCCC1 ZINC000537757729 938370803 /nfs/dbraw/zinc/37/08/03/938370803.db2.gz UCFYPUKFMZDPHX-QFIPXVFZSA-N 0 3 421.566 4.218 20 0 HIADHN O=C([C@@H]1CC12CCN(Cc1ccc(OCc3cccnc3)cc1)CC2)N1CCCCC1 ZINC000537849629 938389778 /nfs/dbraw/zinc/38/97/78/938389778.db2.gz YMZXBONDNNKAST-DEOSSOPVSA-N 0 3 419.569 4.275 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@H](c1ccccc1)[C@H]1CCOC1)c1ccsc1 ZINC000537856428 938391398 /nfs/dbraw/zinc/39/13/98/938391398.db2.gz FUFIGZJETUNHNK-CEWLAPEOSA-N 0 3 401.576 4.208 20 0 HIADHN Cc1cc([C@@H](C)NCc2ccccc2CS(=O)(=O)N2CCCC2)cc(C)c1F ZINC000537938197 938423699 /nfs/dbraw/zinc/42/36/99/938423699.db2.gz PKYNMIILUOYYKJ-GOSISDBHSA-N 0 3 404.551 4.219 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)N[C@@H](CO)c2ccc(Br)cc2)cc1 ZINC000537941551 938425372 /nfs/dbraw/zinc/42/53/72/938425372.db2.gz VCLSPADKFDDTCK-VLIAUNLRSA-N 0 3 400.320 4.327 20 0 HIADHN COC(=O)c1ccc(CN[C@H](C)CC(=O)Nc2cccc(C(F)(F)F)c2)cc1OC ZINC000537942592 938426063 /nfs/dbraw/zinc/42/60/63/938426063.db2.gz IURRJGULWRAFKN-CYBMUJFWSA-N 0 3 424.419 4.008 20 0 HIADHN COc1ccc(C[C@H](C)CN[C@H](C)c2nnn(-c3ccc(F)cc3)c2C)cc1OC ZINC000537962152 938435591 /nfs/dbraw/zinc/43/55/91/938435591.db2.gz MROOHCMONYOORR-JKSUJKDBSA-N 0 3 412.509 4.261 20 0 HIADHN COCCNS(=O)(=O)c1ccc(CN[C@H](C)c2cccc(-c3ccccc3)c2)cc1 ZINC000537966515 938437809 /nfs/dbraw/zinc/43/78/09/938437809.db2.gz OTVUSEXQZBTQMH-LJQANCHMSA-N 0 3 424.566 4.129 20 0 HIADHN COc1cc([C@H](C)N[C@H](C)[C@@H](OC)c2ccc(Cl)cc2)ccc1S(C)(=O)=O ZINC000537969644 938439702 /nfs/dbraw/zinc/43/97/02/938439702.db2.gz JDFYKEFYSWPVRS-LRDNONRASA-N 0 3 411.951 4.179 20 0 HIADHN Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)NCc1cccc(NS(C)(=O)=O)c1 ZINC000537973128 938442035 /nfs/dbraw/zinc/44/20/35/938442035.db2.gz VMTWAMUYGBQCDM-ZDUSSCGKSA-N 0 3 419.547 4.480 20 0 HIADHN C[C@H](N[C@@H]1CCN(CC(F)(F)F)C1=O)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000537976756 938444571 /nfs/dbraw/zinc/44/45/71/938444571.db2.gz IGCPROZKJMISDX-IFXJQAMLSA-N 0 3 410.411 4.219 20 0 HIADHN COC(=O)COc1cccc(CN[C@@H](C)c2sc(Cc3ccccc3)nc2C)c1 ZINC000537981345 938446179 /nfs/dbraw/zinc/44/61/79/938446179.db2.gz HXIQTTNONRAHLY-INIZCTEOSA-N 0 3 410.539 4.445 20 0 HIADHN CS(=O)(=O)Nc1ccc(CN[C@@H](Cc2cccc(F)c2)c2cccc(F)c2)cc1 ZINC000537985635 938449080 /nfs/dbraw/zinc/44/90/80/938449080.db2.gz CVCRDWOCUJTZIR-QFIPXVFZSA-N 0 3 416.493 4.410 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)c3ccccc3COC(C)(C)C)cc2)CC1 ZINC000538008212 938459484 /nfs/dbraw/zinc/45/94/84/938459484.db2.gz FHCNWUKQRGXCGR-UHFFFAOYSA-N 0 3 409.574 4.392 20 0 HIADHN C[C@H](Cc1ccccc1)n1cccc1C(=O)N(CCN(C)C)Cc1cccc(O)c1 ZINC000538015095 938462494 /nfs/dbraw/zinc/46/24/94/938462494.db2.gz HZNKTHZVDUDTGW-HXUWFJFHSA-N 0 3 405.542 4.201 20 0 HIADHN C[C@@H](NCc1ccc(-c2ccc3c(c2)C[C@H](C)O3)cc1)c1ccc(S(N)(=O)=O)cc1 ZINC000538116040 938505968 /nfs/dbraw/zinc/50/59/68/938505968.db2.gz HTBGVFNLQRIMSA-DLBZAZTESA-N 0 3 422.550 4.175 20 0 HIADHN C[C@@H](NCCN1c2cccc3cccc(c23)S1(=O)=O)c1ccc(OC(F)F)cc1 ZINC000538122197 938509556 /nfs/dbraw/zinc/50/95/56/938509556.db2.gz REWRVAORLSXEAH-CQSZACIVSA-N 0 3 418.465 4.301 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(OCc2cccnc2)cc1)C(=O)NCCc1ccc(F)cc1 ZINC000538123130 938509933 /nfs/dbraw/zinc/50/99/33/938509933.db2.gz FMNZCPBPURTMSK-OALUTQOASA-N 0 3 421.516 4.198 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(OCc2cccnc2)cc1)C(=O)NCCc1ccc(F)cc1 ZINC000538123131 938510250 /nfs/dbraw/zinc/51/02/50/938510250.db2.gz FMNZCPBPURTMSK-RBUKOAKNSA-N 0 3 421.516 4.198 20 0 HIADHN COc1ccc(C[C@H](NCC(=O)Nc2ccc(F)cc2)c2ccccc2)cc1OC ZINC000538160049 938529203 /nfs/dbraw/zinc/52/92/03/938529203.db2.gz PKMMYIRPOJXLMY-NRFANRHFSA-N 0 3 408.473 4.355 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(OCC(F)(F)F)cc1)C(=O)NC(=O)Nc1ccccc1 ZINC000538163005 938530905 /nfs/dbraw/zinc/53/09/05/938530905.db2.gz HYJVXAILHLHZQE-KBPBESRZSA-N 0 3 409.408 4.015 20 0 HIADHN Cc1ccc(S(=O)(=O)CCCNC2(c3ccc(Br)cc3)CC2)cc1 ZINC000538181754 938540870 /nfs/dbraw/zinc/54/08/70/938540870.db2.gz YWFHHMMARVSDSZ-UHFFFAOYSA-N 0 3 408.361 4.200 20 0 HIADHN COC[C@@H](NC[C@@H](CO)Cc1ccccc1C(F)(F)F)c1ccc(F)c(F)c1 ZINC000538195879 938549454 /nfs/dbraw/zinc/54/94/54/938549454.db2.gz UJOIELPHRALPPH-ORAYPTAESA-N 0 3 403.391 4.112 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@H](C)NCc2cc(-c3ccccc3)no2)CC1 ZINC000538209337 938556826 /nfs/dbraw/zinc/55/68/26/938556826.db2.gz BFVCFSHGNZKUJQ-SFHVURJKSA-N 0 3 408.521 4.473 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)Nc1ccc2c(c1)OCCO2)c1ccc(-c2cccnc2)cc1 ZINC000538223521 938563305 /nfs/dbraw/zinc/56/33/05/938563305.db2.gz PFOCNKFXURBSGB-SJORKVTESA-N 0 3 403.482 4.198 20 0 HIADHN Cc1ccc(NC(=O)CN[C@H](C[C@H]2CCOC2)c2ccccc2)c(Br)c1 ZINC000538234606 938568786 /nfs/dbraw/zinc/56/87/86/938568786.db2.gz UBPMZUCIGJEGHX-OXQOHEQNSA-N 0 3 417.347 4.454 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)Nc1ccc(OC(F)(F)F)cc1)c1ccc(-n2cccn2)cc1 ZINC000538236151 938569180 /nfs/dbraw/zinc/56/91/80/938569180.db2.gz YJXPHJCUGMUCFJ-CABCVRRESA-N 0 3 418.419 4.449 20 0 HIADHN C[C@H](NCC(=O)N1CCc2[nH]c3ccccc3c2C1)c1ccc(-c2ccncc2)cc1 ZINC000538237137 938570082 /nfs/dbraw/zinc/57/00/82/938570082.db2.gz JZNJEBNNMVYPKU-SFHVURJKSA-N 0 3 410.521 4.465 20 0 HIADHN CCOc1ccc(CN(C)C(=O)CN[C@@H](C)c2ccc(-c3ccncc3)cc2)cc1 ZINC000538240189 938571087 /nfs/dbraw/zinc/57/10/87/938571087.db2.gz WTRFKGZFJQNMNQ-IBGZPJMESA-N 0 3 403.526 4.457 20 0 HIADHN O=C(CN[C@H](c1cccs1)C1CC1)Nc1ccnn1Cc1ccccc1Cl ZINC000538262724 938577738 /nfs/dbraw/zinc/57/77/38/938577738.db2.gz HMZVMGKQFYKJDH-FQEVSTJZSA-N 0 3 400.935 4.326 20 0 HIADHN C[C@@H](CS(=O)(=O)c1ccccc1)NCCc1csc(-c2ccc(Cl)cc2)n1 ZINC000538308100 938589431 /nfs/dbraw/zinc/58/94/31/938589431.db2.gz KTTWQQAMENHXEF-HNNXBMFYSA-N 0 3 420.987 4.458 20 0 HIADHN Cc1c(Cl)cccc1NC(=O)[C@H](C)N[C@@H](c1ccc2c(c1)OCCO2)C1CC1 ZINC000538389844 938609049 /nfs/dbraw/zinc/60/90/49/938609049.db2.gz JMIQNGAWHGQRTJ-LHSJRXKWSA-N 0 3 400.906 4.488 20 0 HIADHN CCc1c2cc(C)ccc2oc1[C@H](C)NC[C@H](O)COc1ccc2c(c1)CCC(=O)N2 ZINC000538396943 938610483 /nfs/dbraw/zinc/61/04/83/938610483.db2.gz JWZVHPUCRVWDJU-WMZOPIPTSA-N 0 3 422.525 4.279 20 0 HIADHN COc1ccc([C@H](C)NCCCNC(=O)c2ccc(F)cc2)c(Br)c1 ZINC000538405938 938612953 /nfs/dbraw/zinc/61/29/53/938612953.db2.gz JPJYAPGYLIASPB-ZDUSSCGKSA-N 0 3 409.299 4.068 20 0 HIADHN CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NCc1ccc(OCc2ccccc2)cc1 ZINC000538418023 938616098 /nfs/dbraw/zinc/61/60/98/938616098.db2.gz SHCXKPZCSXRURO-VWLOTQADSA-N 0 3 413.521 4.194 20 0 HIADHN COc1cc2c(c(CN[C@H](C)[C@@H](OC3CCOCC3)c3ccccc3)c1)O[C@@H](C)C2 ZINC000538422152 938616716 /nfs/dbraw/zinc/61/67/16/938616716.db2.gz JLMILOAYJOEQSD-HOOSLVGPSA-N 0 3 411.542 4.434 20 0 HIADHN Brc1ccc(-c2c[nH]c(CN[C@@H]3[C@H]4CCO[C@@H]4C34CCCC4)n2)cc1 ZINC000538422888 938617046 /nfs/dbraw/zinc/61/70/46/938617046.db2.gz SCCPYBROZVWTQB-LZQZEXGQSA-N 0 3 402.336 4.277 20 0 HIADHN CCN1CCN(c2ccc(N[C@H](C)c3ccc(OC)c(NC(C)=O)c3)c(C)c2)CC1 ZINC000538508406 938638299 /nfs/dbraw/zinc/63/82/99/938638299.db2.gz LGBPQMMPAPZBFB-GOSISDBHSA-N 0 3 410.562 4.277 20 0 HIADHN COc1ccc(C2(C(=O)N[C@H]3CCN([C@H](C)c4ccccc4)C3)CCCC2)cc1OC ZINC000538529578 938642310 /nfs/dbraw/zinc/64/23/10/938642310.db2.gz RBECAZRCSNEXMQ-KNQAVFIVSA-N 0 3 422.569 4.467 20 0 HIADHN CCN1CCN(c2ccccc2N[C@@H](C)c2nnn(-c3ccc(F)cc3)c2C)CC1 ZINC000538545575 938645676 /nfs/dbraw/zinc/64/56/76/938645676.db2.gz FHWLKSWEZWYUDD-KRWDZBQOSA-N 0 3 408.525 4.030 20 0 HIADHN COc1ccc(NC(=O)C[C@H](C)NC2(c3cccc(Br)c3)CC2)cc1 ZINC000538554047 938647775 /nfs/dbraw/zinc/64/77/75/938647775.db2.gz PLADIDRLTDCVAK-AWEZNQCLSA-N 0 3 403.320 4.454 20 0 HIADHN Cc1cc(C)n2c(CNCc3ccc(NC(=O)c4ccc(F)cc4)cc3)cnc2n1 ZINC000538603891 938660113 /nfs/dbraw/zinc/66/01/13/938660113.db2.gz LWFLHMOBBAJXSN-UHFFFAOYSA-N 0 3 403.461 4.027 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)Nc1ccc2nc(-c3ccccn3)oc2c1 ZINC000538626007 938666022 /nfs/dbraw/zinc/66/60/22/938666022.db2.gz PCPAAIRSKQGNIR-UHFFFAOYSA-N 0 3 415.497 4.486 20 0 HIADHN Cc1ccc(NC(=O)CN[C@H]2CCN(C(C)C)[C@@H]2c2ccc(F)c(F)c2)c(C)c1 ZINC000563472884 945194356 /nfs/dbraw/zinc/19/43/56/945194356.db2.gz UEFVJMOWLHLGBB-JTHBVZDNSA-N 0 3 401.501 4.334 20 0 HIADHN O[C@@H](COc1ccccc1Cl)CN1CCC[C@H](c2nnc(C3CCCCC3)[nH]2)C1 ZINC000538665479 938679673 /nfs/dbraw/zinc/67/96/73/938679673.db2.gz GYPPZLQOHQXGOG-ZWKOTPCHSA-N 0 3 418.969 4.125 20 0 HIADHN COc1ccc(OC)c([C@H]2CCCN2C(=O)CN[C@]2(C)CCCc3ccccc32)c1 ZINC000538707211 938687065 /nfs/dbraw/zinc/68/70/65/938687065.db2.gz AQOQRQICHZFCAQ-RCZVLFRGSA-N 0 3 408.542 4.209 20 0 HIADHN Brc1cccc(-c2ccc(CN3CCN(C4CCOCC4)CC3)o2)c1 ZINC000538716834 938688934 /nfs/dbraw/zinc/68/89/34/938688934.db2.gz FOKOPSVVBFVHAW-UHFFFAOYSA-N 0 3 405.336 4.006 20 0 HIADHN CNC(=O)CC1CCN(Cc2cn(-c3ccccc3Cl)nc2C(C)(C)C)CC1 ZINC000538719530 938690188 /nfs/dbraw/zinc/69/01/88/938690188.db2.gz RBDYSEUZOAVTCX-UHFFFAOYSA-N 0 3 402.970 4.171 20 0 HIADHN CCc1nn(C)c(CC)c1CN1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1 ZINC000538728942 938694086 /nfs/dbraw/zinc/69/40/86/938694086.db2.gz HKMSFLXPVJQBBN-UHFFFAOYSA-N 0 3 406.933 4.188 20 0 HIADHN CC(C)(C)n1cc(CN2CC[C@H](CN3CCOCC3)C2)c(-c2ccccc2Cl)n1 ZINC000538733698 938696379 /nfs/dbraw/zinc/69/63/79/938696379.db2.gz REFGTOHZSFNJJN-GOSISDBHSA-N 0 3 416.997 4.113 20 0 HIADHN CCCN(CC(F)(F)F)C(=O)[C@@H]1CCCN(Cc2c[nH]nc2-c2cccs2)C1 ZINC000538751376 938702202 /nfs/dbraw/zinc/70/22/02/938702202.db2.gz IRQSEGIFJIRDHX-CQSZACIVSA-N 0 3 414.497 4.151 20 0 HIADHN CCCOc1cc(CN2CCC[C@@H](C(=O)N(CC)CC(F)(F)F)C2)ccc1OC ZINC000538752470 938702522 /nfs/dbraw/zinc/70/25/22/938702522.db2.gz NLMXGKLIRFIQCN-QGZVFWFLSA-N 0 3 416.484 4.107 20 0 HIADHN CCc1ccc([O-])c(C(=O)N(C[C@H]2CC[N@H+](Cc3ccccc3)C2)CC(F)(F)F)c1 ZINC000538775376 938707187 /nfs/dbraw/zinc/70/71/87/938707187.db2.gz FYBZACPOTVRTNE-IBGZPJMESA-N 0 3 420.475 4.481 20 0 HIADHN CCc1ccc([O-])c(C(=O)N(C[C@H]2CC[N@@H+](Cc3ccccc3)C2)CC(F)(F)F)c1 ZINC000538775376 938707189 /nfs/dbraw/zinc/70/71/89/938707189.db2.gz FYBZACPOTVRTNE-IBGZPJMESA-N 0 3 420.475 4.481 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)[C@H]2C[C@H]2c2cccc(F)c2F)cc1 ZINC000538830402 938721274 /nfs/dbraw/zinc/72/12/74/938721274.db2.gz MJTFNFALJDBQQY-ZJOUEHCJSA-N 0 3 400.469 4.030 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)[C@H]2C[C@@H]2c2ccc(F)cc2F)cc1 ZINC000538830777 938721683 /nfs/dbraw/zinc/72/16/83/938721683.db2.gz PDMIBGNVELRZLG-URVUXULASA-N 0 3 400.469 4.030 20 0 HIADHN CNS(=O)(=O)c1cccc([C@@H](C)N[C@@H]2CCCc3ccc(Br)cc32)c1 ZINC000538868637 938728586 /nfs/dbraw/zinc/72/85/86/938728586.db2.gz BXPJYWXMDAJLBG-BFUOFWGJSA-N 0 3 423.376 4.085 20 0 HIADHN O=C(Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1)c1ccncc1Cl ZINC000538918897 938737959 /nfs/dbraw/zinc/73/79/59/938737959.db2.gz PRSFIZYWMJIDOU-UHFFFAOYSA-N 0 3 420.944 4.352 20 0 HIADHN C[C@H](NC[C@@H](CO)Cc1ccccc1OC(F)(F)F)c1nc2c(s1)CCCC2 ZINC000538985998 938760198 /nfs/dbraw/zinc/76/01/98/938760198.db2.gz ZSEHYJVLRRRBCS-KBPBESRZSA-N 0 3 414.493 4.422 20 0 HIADHN C[C@@H](NCc1ccc(NS(C)(=O)=O)cc1)c1cccc(OCc2ccccc2)c1 ZINC000539020650 938771035 /nfs/dbraw/zinc/77/10/35/938771035.db2.gz HPBQFHLVDZTMIY-GOSISDBHSA-N 0 3 410.539 4.488 20 0 HIADHN C[C@@H](N[C@@H](C)Cn1ncc2ccccc2c1=O)c1ccc(Br)c(F)c1 ZINC000539040425 938778154 /nfs/dbraw/zinc/77/81/54/938778154.db2.gz AYLVLSSIGMYRIS-QWHCGFSZSA-N 0 3 404.283 4.037 20 0 HIADHN C[C@@H](NCc1ccccc1CS(=O)(=O)N1CCCC1)c1ccc(OC(F)F)cc1 ZINC000539044953 938780066 /nfs/dbraw/zinc/78/00/66/938780066.db2.gz ZYJMZOKIZQXMSA-MRXNPFEDSA-N 0 3 424.513 4.064 20 0 HIADHN CC(C)NC(=O)Nc1ccc([C@H](C)N[C@H]2CCN(CCCc3ccccc3)C2=O)cc1 ZINC000539045637 938781025 /nfs/dbraw/zinc/78/10/25/938781025.db2.gz DLBSQIJGACOVMJ-CVDCTZTESA-N 0 3 422.573 4.101 20 0 HIADHN Cc1ccc(NC(=O)C[C@@H](C)N[C@@H](CO)c2ccc(Br)cc2)c(C)c1 ZINC000539045731 938781252 /nfs/dbraw/zinc/78/12/52/938781252.db2.gz BLLSPJJGFXJRQM-BEFAXECRSA-N 0 3 405.336 4.106 20 0 HIADHN CCC[C@@H](NC[C@@H](O)CS(=O)(=O)c1cccs1)c1cccc(C(F)(F)F)c1 ZINC000539049067 938782472 /nfs/dbraw/zinc/78/24/72/938782472.db2.gz ACTLIEVKVUYORE-HZPDHXFCSA-N 0 3 421.506 4.033 20 0 HIADHN C[C@@H](NCCOc1ncccc1Cl)c1ccc(S(=O)(=O)C2CCCC2)cc1 ZINC000539058231 938786314 /nfs/dbraw/zinc/78/63/14/938786314.db2.gz PLVGJDITRGTWJB-OAHLLOKOSA-N 0 3 408.951 4.181 20 0 HIADHN Cc1c([C@H](C)NCCNC(=O)c2ccccc2F)cnn1-c1cccc(Cl)c1 ZINC000539063387 938788967 /nfs/dbraw/zinc/78/89/67/938788967.db2.gz CBDFSABOTJGTDI-AWEZNQCLSA-N 0 3 400.885 4.054 20 0 HIADHN Cc1ccc2c(c1)OCCC[C@@H]2NC[C@H](O)COc1ccccc1Br ZINC000539064417 938789582 /nfs/dbraw/zinc/78/95/82/938789582.db2.gz APWIRTJNSTTXTB-YJBOKZPZSA-N 0 3 406.320 4.001 20 0 HIADHN C[C@H](N[C@@H](C)[C@H](c1ccccc1)N1CCOCC1)c1nc(-c2ccncc2)cs1 ZINC000539070182 938792791 /nfs/dbraw/zinc/79/27/91/938792791.db2.gz IFDFTHQOJOACPE-NPPFBWRTSA-N 0 3 408.571 4.318 20 0 HIADHN O=C(Nc1ccccc1)[C@@H](NC1CCN(Cc2ccccn2)CC1)c1ccccc1 ZINC000539074014 938794869 /nfs/dbraw/zinc/79/48/69/938794869.db2.gz SQNUSVHIBMXOJW-DEOSSOPVSA-N 0 3 400.526 4.016 20 0 HIADHN COc1ccc(Cc2nc(C)c([C@H](C)NCCC(=O)NC(C)(C)C)s2)cc1OC ZINC000539075269 938795602 /nfs/dbraw/zinc/79/56/02/938795602.db2.gz BGJDICFCXYEPPF-AWEZNQCLSA-N 0 3 419.591 4.015 20 0 HIADHN COc1ccc([C@H](C)NCCc2nc(-c3ccc(Cl)cc3)no2)cc1NC(C)=O ZINC000539080514 938797803 /nfs/dbraw/zinc/79/78/03/938797803.db2.gz ULPBJLNLPXTXOX-ZDUSSCGKSA-N 0 3 414.893 4.250 20 0 HIADHN CC[C@H](N[C@H]1CCN(c2cc(OC)cc(OC)c2)C1=O)c1ccc(OC(F)F)cc1 ZINC000539088535 938800125 /nfs/dbraw/zinc/80/01/25/938800125.db2.gz VAYOMLHCEJABOS-PMACEKPBSA-N 0 3 420.456 4.151 20 0 HIADHN COc1ccc([C@H](C)NCc2ccc(C(=O)N3C[C@@H](C)O[C@H](C)C3)cc2)cc1Cl ZINC000539093459 938801596 /nfs/dbraw/zinc/80/15/96/938801596.db2.gz LQIIWYNMQRHLRT-ZACQAIPSSA-N 0 3 416.949 4.449 20 0 HIADHN CC[C@H](NCc1ccc(C(=O)N2C[C@H](C)O[C@@H](C)C2)cc1)c1cc(C)ccc1OC ZINC000539093662 938801865 /nfs/dbraw/zinc/80/18/65/938801865.db2.gz PLAGBVHTKVFLSQ-YDHSSHFGSA-N 0 3 410.558 4.494 20 0 HIADHN Cc1cccn2c(=O)cc(CN3CCC(c4ccc(C(F)(F)F)cc4)CC3)nc12 ZINC000539099120 938802780 /nfs/dbraw/zinc/80/27/80/938802780.db2.gz WFEMCQLYQZAJOX-UHFFFAOYSA-N 0 3 401.432 4.401 20 0 HIADHN Cc1cccc(C)c1CNCc1ccccc1CS(=O)(=O)N1CCC(C)CC1 ZINC000539104550 938803751 /nfs/dbraw/zinc/80/37/51/938803751.db2.gz VATVUHOYDTYJSF-UHFFFAOYSA-N 0 3 400.588 4.155 20 0 HIADHN CCN1CCN(CCCNC(=O)c2ccc(Sc3ccc(Cl)cc3)cc2)CC1 ZINC000539110159 938804514 /nfs/dbraw/zinc/80/45/14/938804514.db2.gz CDKWBJSOOLUNOU-UHFFFAOYSA-N 0 3 418.006 4.249 20 0 HIADHN CCN1CC[C@@H](NC(=O)c2cccc(CN(C)C)c2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000539128277 938807650 /nfs/dbraw/zinc/80/76/50/938807650.db2.gz QMBAIBWYYYCRJB-NHCUHLMSSA-N 0 3 403.929 4.106 20 0 HIADHN CNS(=O)(=O)c1cccc(CN[C@H](c2ccc(C(F)(F)F)cc2)C(C)C)c1 ZINC000539162744 938814404 /nfs/dbraw/zinc/81/44/04/938814404.db2.gz HBTVTSJBIPXKHA-SFHVURJKSA-N 0 3 400.466 4.100 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@@H](C)N[C@@H](C)c2cccc(OC(C)C)c2)cc1OC ZINC000539226131 938821828 /nfs/dbraw/zinc/82/18/28/938821828.db2.gz LFTUCWDVGSWSQQ-ZWKOTPCHSA-N 0 3 414.546 4.189 20 0 HIADHN O=C(Nc1ccccc1)c1ccc(CN2CCC[C@H](c3nncn3C3CC3)C2)cc1 ZINC000539239967 938823547 /nfs/dbraw/zinc/82/35/47/938823547.db2.gz UQOMJFFNOMYMFL-FQEVSTJZSA-N 0 3 401.514 4.245 20 0 HIADHN O=S(=O)(c1ccc(F)c(C(F)(F)F)c1)N1C[C@@H]2CCCN2Cc2ccccc21 ZINC000539238866 938823741 /nfs/dbraw/zinc/82/37/41/938823741.db2.gz ZJLDEXKOIXDXTB-AWEZNQCLSA-N 0 3 414.424 4.018 20 0 HIADHN CC(C)C[C@H](NCC(=O)NC1CCN(C(=O)C2CCCCC2)CC1)c1ccccc1 ZINC000539242254 938823996 /nfs/dbraw/zinc/82/39/96/938823996.db2.gz ZNDKJOIJAVYSFQ-QHCPKHFHSA-N 0 3 413.606 4.051 20 0 HIADHN COc1ccc([C@@H](NCC(=O)N2CCC(OCc3ccccc3)CC2)C(C)C)cc1 ZINC000539244023 938824474 /nfs/dbraw/zinc/82/44/74/938824474.db2.gz PEGUTABUCIRIFJ-VWLOTQADSA-N 0 3 410.558 4.190 20 0 HIADHN CC[C@H](NCC(=O)N1CCC(C(=O)Nc2ccccc2)CC1)c1cccc(Cl)c1 ZINC000539245699 938824817 /nfs/dbraw/zinc/82/48/17/938824817.db2.gz FMQAZDOBNZLFRQ-NRFANRHFSA-N 0 3 413.949 4.258 20 0 HIADHN CC[C@H](N[C@H](C)C(=O)N1CCC[C@H]1c1cccs1)c1ccc2c(c1)OCCO2 ZINC000539276853 938831825 /nfs/dbraw/zinc/83/18/25/938831825.db2.gz QTOZIXWIVMVIBV-NJAFHUGGSA-N 0 3 400.544 4.312 20 0 HIADHN CC[C@H](NCC(=O)N(CC)[C@@H](C)c1ccc(F)cc1)c1ccc2c(c1)OCCO2 ZINC000539278602 938832079 /nfs/dbraw/zinc/83/20/79/938832079.db2.gz DKUKBYDFRFQDFD-JXFKEZNVSA-N 0 3 400.494 4.247 20 0 HIADHN Cc1cccc([C@H](C)NCC(=O)N2c3ccccc3NC(=O)C[C@H]2C(F)(F)F)c1C ZINC000539286124 938833653 /nfs/dbraw/zinc/83/36/53/938833653.db2.gz COERDFODNCQTKQ-KXBFYZLASA-N 0 3 419.447 4.260 20 0 HIADHN COc1cc(F)c([C@@H](C)NC[C@@H](O)Cc2ccc(C(F)(F)F)cc2)cc1OC ZINC000539288709 938834081 /nfs/dbraw/zinc/83/40/81/938834081.db2.gz DUZSOWRUJJONCX-DOMZBBRYSA-N 0 3 401.400 4.116 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CNC(=O)CN[C@H](C)c1cccc(C)c1C ZINC000539289341 938834251 /nfs/dbraw/zinc/83/42/51/938834251.db2.gz LBOGMGCIWIPRPW-LJQANCHMSA-N 0 3 404.558 4.132 20 0 HIADHN C[C@H](NC(=O)CN[C@@H](c1ccccc1)[C@@H]1CCOC1)c1ccc(OC(F)(F)F)cc1 ZINC000539290366 938834451 /nfs/dbraw/zinc/83/44/51/938834451.db2.gz ZNOGULJRBIXNAQ-KLHJMIIUSA-N 0 3 422.447 4.130 20 0 HIADHN C[C@@H](N[C@@H](C)c1cccc(-n2cccn2)c1)C(=O)N(C)Cc1nc2ccccc2s1 ZINC000539289638 938834562 /nfs/dbraw/zinc/83/45/62/938834562.db2.gz XIAJKBQNZZGTMO-DLBZAZTESA-N 0 3 419.554 4.180 20 0 HIADHN CCOC(=O)c1c2c(sc1NC(=O)[C@H]1CCC(=O)[C@H](C)C1)C(C)(C)NC(C)(C)C2 ZINC000539298205 938836090 /nfs/dbraw/zinc/83/60/90/938836090.db2.gz PTJMRCBQBQWRCM-OLZOCXBDSA-N 0 3 420.575 4.028 20 0 HIADHN COC(=O)c1ccc(CNC(=O)[C@@H](C)N[C@@H](C)c2ccc(SC(C)C)cc2)cc1 ZINC000539300414 938836833 /nfs/dbraw/zinc/83/68/33/938836833.db2.gz GICCQRHOLOXXAD-DLBZAZTESA-N 0 3 414.571 4.329 20 0 HIADHN O=C(CN[C@H](c1ccc(Cl)cc1)C1CCC1)Nc1cccc(C(=O)NC2CC2)c1 ZINC000539304914 938837742 /nfs/dbraw/zinc/83/77/42/938837742.db2.gz RCCPUOBIIRYSFO-QFIPXVFZSA-N 0 3 411.933 4.302 20 0 HIADHN O=C(CN[C@@H](c1ccc(Cl)cc1)C1CCC1)Nc1cccc(C(=O)NC2CC2)c1 ZINC000539304913 938837747 /nfs/dbraw/zinc/83/77/47/938837747.db2.gz RCCPUOBIIRYSFO-JOCHJYFZSA-N 0 3 411.933 4.302 20 0 HIADHN COC[C@H](NCc1ccc(CN2C[C@@H](C)O[C@H](C)C2)cc1)c1ccc(F)c(F)c1 ZINC000539307816 938838367 /nfs/dbraw/zinc/83/83/67/938838367.db2.gz ALBJNBCGODYWGQ-QZMQVMSPSA-N 0 3 404.501 4.051 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@@H](C)NCc2ccccc2OC(F)F)CC1 ZINC000539309869 938838543 /nfs/dbraw/zinc/83/85/43/938838543.db2.gz BNRRPYIXZKMAQD-MRXNPFEDSA-N 0 3 407.480 4.420 20 0 HIADHN COC(=O)c1sc2[nH]c(CN[C@@H](c3cccc(C)c3)C(C)(C)C)nc(=O)c2c1C ZINC000539337762 938844302 /nfs/dbraw/zinc/84/43/02/938844302.db2.gz WKCLRRZTIRSWER-SFHVURJKSA-N 0 3 413.543 4.265 20 0 HIADHN C[C@H](C1CC1)N(Cc1ccccc1)C(=O)CN[C@@H](C)c1ccc(-n2cccn2)cc1 ZINC000539337344 938844429 /nfs/dbraw/zinc/84/44/29/938844429.db2.gz POBNEELEIANEES-VQTJNVASSA-N 0 3 402.542 4.350 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(-n2cccn2)cc1)C(=O)Nc1ccc(OC(F)F)cc1 ZINC000539337604 938844437 /nfs/dbraw/zinc/84/44/37/938844437.db2.gz CXIHWBCUBIMRTP-HUUCEWRRSA-N 0 3 400.429 4.152 20 0 HIADHN COc1cc(OC)c(OC)cc1CNC(=O)CN[C@H](c1cccc(C)c1)C(C)(C)C ZINC000539338647 938844653 /nfs/dbraw/zinc/84/46/53/938844653.db2.gz YRNATDIJMOEFEB-HSZRJFAPSA-N 0 3 414.546 4.014 20 0 HIADHN CC(=O)c1cccc(OC[C@H](O)CN[C@H](Cc2ccccc2)c2ccccc2F)c1 ZINC000539360917 938848367 /nfs/dbraw/zinc/84/83/67/938848367.db2.gz XWKJBLDINGZOMD-PXDATVDWSA-N 0 3 407.485 4.342 20 0 HIADHN CC(=O)c1cccc(OC[C@@H](O)CN[C@@H](Cc2ccccc2)c2ccccc2F)c1 ZINC000539360915 938848551 /nfs/dbraw/zinc/84/85/51/938848551.db2.gz XWKJBLDINGZOMD-OFVILXPXSA-N 0 3 407.485 4.342 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)N[C@@H](C)C(=O)NC23CC4CC(CC(C4)C2)C3)cc1 ZINC000539363199 938848682 /nfs/dbraw/zinc/84/86/82/938848682.db2.gz QXNHYMJBNLANDI-HKFPXXJESA-N 0 3 406.574 4.305 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)NCC(=O)N(C)[C@@H]2CCCc3ccccc32)cc1 ZINC000539368646 938849769 /nfs/dbraw/zinc/84/97/69/938849769.db2.gz PLFHZVOESAHIDQ-HOYKHHGWSA-N 0 3 402.542 4.367 20 0 HIADHN C[C@@H](N[C@@H](C)c1cccc(N2CCCC2)c1)C(=O)NCCc1c[nH]c2ccccc12 ZINC000539379934 938851778 /nfs/dbraw/zinc/85/17/78/938851778.db2.gz JRFPNDUWKIJUAA-RBUKOAKNSA-N 0 3 404.558 4.166 20 0 HIADHN Cc1ccc(NC(=O)NC(=O)[C@H](C)N[C@@H](C)c2cccc(N3CCCC3)c2)c(C)c1 ZINC000539379317 938851883 /nfs/dbraw/zinc/85/18/83/938851883.db2.gz QBIXOHMIFRWFLO-OALUTQOASA-N 0 3 408.546 4.291 20 0 HIADHN CCC(CC)n1nc(C)cc1C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000539382911 938852184 /nfs/dbraw/zinc/85/21/84/938852184.db2.gz VZLXTLYLNMTMSU-NRFANRHFSA-N 0 3 420.561 4.448 20 0 HIADHN Cc1sc(CCN[C@H](C)CS(=O)(=O)c2ccccc2)nc1-c1ccccc1 ZINC000539394727 938854083 /nfs/dbraw/zinc/85/40/83/938854083.db2.gz IYUAKTWCJITILE-MRXNPFEDSA-N 0 3 400.569 4.113 20 0 HIADHN Cc1ccc(NC(=O)NC[C@@H]2CCCN(Cc3cn(C)nc3-c3cccs3)C2)cc1 ZINC000539408522 938856514 /nfs/dbraw/zinc/85/65/14/938856514.db2.gz LBZCEQXNOZTFIU-SFHVURJKSA-N 0 3 423.586 4.491 20 0 HIADHN CC(C)n1cnnc1[C@H]1CCCN(CCc2cc(Cl)c3c(c2)OCCCO3)C1 ZINC000539456900 938863587 /nfs/dbraw/zinc/86/35/87/938863587.db2.gz WMRWGZGZSOZKPZ-KRWDZBQOSA-N 0 3 404.942 4.096 20 0 HIADHN COc1ccc([C@H](NCC(=O)Nc2cc(C)nn2-c2ccccc2F)C2CC2)cc1 ZINC000539491907 938867852 /nfs/dbraw/zinc/86/78/52/938867852.db2.gz WTTMNJSMLFNOJP-HSZRJFAPSA-N 0 3 408.477 4.008 20 0 HIADHN C[C@H](N[C@H](c1ccc2c(c1)OCCO2)C1CC1)C(=O)Nc1ccc(F)cc1Cl ZINC000539492058 938867880 /nfs/dbraw/zinc/86/78/80/938867880.db2.gz XLGROWMQFJGHCK-YUNKPMOVSA-N 0 3 404.869 4.318 20 0 HIADHN COc1ccc([C@@H](NCC(=O)N(C)Cc2cc(Br)cs2)C2CC2)cc1 ZINC000539493125 938868265 /nfs/dbraw/zinc/86/82/65/938868265.db2.gz MYLCUMKHNGWQMY-IBGZPJMESA-N 0 3 423.376 4.219 20 0 HIADHN CCc1c2ccccc2oc1[C@@H](C)NCc1ccc(C(=O)N2CCN(C)CC2)cc1 ZINC000539498746 938869100 /nfs/dbraw/zinc/86/91/00/938869100.db2.gz WLEUYXQFLXRWNH-GOSISDBHSA-N 0 3 405.542 4.234 20 0 HIADHN CO[C@H](c1ccc(Br)cc1)[C@@H](C)NCc1c(C)nc2sc(C)nn12 ZINC000539545547 938877556 /nfs/dbraw/zinc/87/75/56/938877556.db2.gz VDVSCNRNZQIFJR-BZNIZROVSA-N 0 3 409.353 4.036 20 0 HIADHN CC(C)N1CCN([C@@H]2CCN(C(=O)N[C@@H]3C[C@@H]4CCC(C)(C)c5cccc3c54)C2)CC1 ZINC000539566723 938880961 /nfs/dbraw/zinc/88/09/61/938880961.db2.gz SOIGJKBHNFRCPX-MIZPHKNDSA-N 0 3 424.633 4.096 20 0 HIADHN COc1ccc(NC(=O)C[C@@H](C)NC2(c3ccc(F)cc3F)CCC2)c(OC)c1 ZINC000539649629 938893934 /nfs/dbraw/zinc/89/39/34/938893934.db2.gz WHXQVTYWLPOGGU-CQSZACIVSA-N 0 3 404.457 4.368 20 0 HIADHN Cc1cc(C(=O)N2CC[C@H](N3CCCCC3)C2)nn1-c1ccc(Cl)c(Cl)c1 ZINC000539722209 938913178 /nfs/dbraw/zinc/91/31/78/938913178.db2.gz DHYHXGYSVNQGDP-INIZCTEOSA-N 0 3 407.345 4.188 20 0 HIADHN OCCOC1CCN(Cc2cn(-c3ccccc3)nc2-c2ccc(Cl)cc2)CC1 ZINC000539825510 938947045 /nfs/dbraw/zinc/94/70/45/938947045.db2.gz PHOXVOPKSZUVBC-UHFFFAOYSA-N 0 3 411.933 4.166 20 0 HIADHN CCCN(CC(F)(F)F)C(=O)[C@H]1CCCN(Cc2cnc(CC(C)C)s2)C1 ZINC000539850021 938956832 /nfs/dbraw/zinc/95/68/32/938956832.db2.gz AAHSCFOOAOTIHG-HNNXBMFYSA-N 0 3 405.530 4.355 20 0 HIADHN CCCOc1ccc(CN2CCC[C@@H](C(=O)N(CC)CC(F)(F)F)C2)cc1OC ZINC000539850782 938957376 /nfs/dbraw/zinc/95/73/76/938957376.db2.gz JRURWGMTQGSJBA-QGZVFWFLSA-N 0 3 416.484 4.107 20 0 HIADHN CCN(CCc1nccs1)Cc1cn(-c2ccc(Br)cc2)nc1C ZINC000539851400 938957704 /nfs/dbraw/zinc/95/77/04/938957704.db2.gz SQKYAMYZQARELR-UHFFFAOYSA-N 0 3 405.365 4.464 20 0 HIADHN COCCOCCN(Cc1c[nH]nc1-c1c(F)cccc1F)Cc1ccccc1 ZINC000539860565 938959774 /nfs/dbraw/zinc/95/97/74/938959774.db2.gz USEGOBLDMLJNOB-UHFFFAOYSA-N 0 3 401.457 4.020 20 0 HIADHN COC(=O)CCn1nc(C)c(CN2CCC[C@@H](COc3ccccc3Cl)C2)c1C ZINC000539863736 938960498 /nfs/dbraw/zinc/96/04/98/938960498.db2.gz PELRUVZSIDTWQR-GOSISDBHSA-N 0 3 419.953 4.007 20 0 HIADHN CC(C)[C@@H](Oc1cccc(Cl)c1)C(=O)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000539877602 938964129 /nfs/dbraw/zinc/96/41/29/938964129.db2.gz RIJSIKJHDYVIIK-JOCHJYFZSA-N 0 3 416.949 4.339 20 0 HIADHN Brc1ccc2c(c1)[C@@H](N1CCC[C@@H](c3nnc4n3CCC4)C1)CCC2 ZINC000539882906 938965386 /nfs/dbraw/zinc/96/53/86/938965386.db2.gz YSCVAPXLIKCJOB-QAPCUYQASA-N 0 3 401.352 4.244 20 0 HIADHN CC[C@H]1CN(Cc2ccc(OCCOc3ccccc3Cl)c(OC)c2)C[C@H]1O ZINC000539897651 938971437 /nfs/dbraw/zinc/97/14/37/938971437.db2.gz UVASEBNFLSTWGQ-PKOBYXMFSA-N 0 3 405.922 4.009 20 0 HIADHN COCCC[C@H](NCc1cccnc1-n1cccn1)c1ccc(Br)cc1 ZINC000539969531 938982339 /nfs/dbraw/zinc/98/23/39/938982339.db2.gz NPQLOMYWGIXANW-IBGZPJMESA-N 0 3 415.335 4.287 20 0 HIADHN C[C@@H]1CN(c2ccc(CN[C@H]3CCCc4ccc(Br)cc43)cn2)CCO1 ZINC000539969698 938982497 /nfs/dbraw/zinc/98/24/97/938982497.db2.gz RRASELOAKHKKQC-QRWLVFNGSA-N 0 3 416.363 4.236 20 0 HIADHN COc1cccc(COc2cccc(Cl)c2CN[C@@H]2CCO[C@@]3(CCOC3)C2)c1 ZINC000539976869 939028501 /nfs/dbraw/zinc/02/85/01/939028501.db2.gz FNVOOKDIWCANKE-JPYJTQIMSA-N 0 3 417.933 4.355 20 0 HIADHN Brc1cc(CN[C@H](c2ccccc2)[C@@H]2CCOC2)cc2c1OCCCO2 ZINC000540067907 939057299 /nfs/dbraw/zinc/05/72/99/939057299.db2.gz DNGMEVNZJSZDCM-YLJYHZDGSA-N 0 3 418.331 4.478 20 0 HIADHN CC(C)Cn1cc(NC(=O)NC[C@H]2CCCN2Cc2ccccc2)c(C(F)F)n1 ZINC000540114216 939077694 /nfs/dbraw/zinc/07/76/94/939077694.db2.gz KSAPDIBQSKMFCM-QGZVFWFLSA-N 0 3 405.493 4.263 20 0 HIADHN COc1ccccc1-c1ccc([C@@H](C)NCc2ccc(S(=O)(=O)N(C)C)cc2)cc1 ZINC000540117330 939078596 /nfs/dbraw/zinc/07/85/96/939078596.db2.gz DANRQOGBYXHBNZ-GOSISDBHSA-N 0 3 424.566 4.463 20 0 HIADHN C[C@@H](NC[C@H](C)S(C)(=O)=O)c1ccc(-c2ccc(Br)cc2)s1 ZINC000540141192 939088802 /nfs/dbraw/zinc/08/88/02/939088802.db2.gz YWOKKFMHCSWEBR-NWDGAFQWSA-N 0 3 402.379 4.261 20 0 HIADHN COc1ccc(CN[C@H](C)c2ccc(S(=O)(=O)N3CCCCC3)cc2)cc1Cl ZINC000540157685 939094711 /nfs/dbraw/zinc/09/47/11/939094711.db2.gz DIJYLZVAQRXRGY-MRXNPFEDSA-N 0 3 422.978 4.374 20 0 HIADHN CC(C)C[C@@H](N[C@H](C)c1ccc2c(c1)C(C)(C)C(=O)N2)C(=O)Nc1nccs1 ZINC000540165862 939099058 /nfs/dbraw/zinc/09/90/58/939099058.db2.gz ZHALOFHWFAKEED-CXAGYDPISA-N 0 3 400.548 4.077 20 0 HIADHN COCCSc1ccc([C@@H](C)N[C@H](C)c2cccc(NS(C)(=O)=O)c2)cc1 ZINC000540173668 939103884 /nfs/dbraw/zinc/10/38/84/939103884.db2.gz HOWUGHCGSZXWJZ-HZPDHXFCSA-N 0 3 408.589 4.208 20 0 HIADHN C[C@H](N[C@H]1CC(=O)N(c2ccccc2Cl)C1)c1ccc(NC(=O)NC2CC2)cc1 ZINC000540180461 939107640 /nfs/dbraw/zinc/10/76/40/939107640.db2.gz DTTVTTHGFQSCNJ-KSSFIOAISA-N 0 3 412.921 4.080 20 0 HIADHN C[C@@H]1CN(C(=O)c2ccc(CN[C@@H]3c4cccc(F)c4CC[C@H]3C)cc2)C[C@H](C)O1 ZINC000540190281 939114668 /nfs/dbraw/zinc/11/46/68/939114668.db2.gz FQSCUZUEVOHNGC-SXTKOZQMSA-N 0 3 410.533 4.488 20 0 HIADHN CC[C@@H](NCc1ccccc1OCC(=O)NC[C@H]1CCCO1)c1cccc(Cl)c1 ZINC000540191543 939115455 /nfs/dbraw/zinc/11/54/55/939115455.db2.gz PXNZBQSXHSSGKY-NHCUHLMSSA-N 0 3 416.949 4.255 20 0 HIADHN COc1ccc([C@@H](C)N[C@H](C)c2ccc(-n3cncn3)cc2)cc1Br ZINC000540191219 939115513 /nfs/dbraw/zinc/11/55/13/939115513.db2.gz MYGJZCIZICMCQB-ZIAGYGMSSA-N 0 3 401.308 4.450 20 0 HIADHN Cc1ccc2c(c1)[C@H](NCc1ccc(C(=O)N3C[C@H](C)O[C@@H](C)C3)cc1)CCCO2 ZINC000540192092 939117672 /nfs/dbraw/zinc/11/76/72/939117672.db2.gz ZXAJHXLKNNLEOH-SFYKDHMMSA-N 0 3 408.542 4.248 20 0 HIADHN COc1ccc(CCN[C@@H](C)c2nc3ccc(Cl)cc3n2C)c(OC)c1OC ZINC000540299618 939186603 /nfs/dbraw/zinc/18/66/03/939186603.db2.gz OAMFPRCRLMEWHF-ZDUSSCGKSA-N 0 3 403.910 4.146 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(OCc2cccnc2)cc1)C(=O)Nc1ccc2c(c1)OCO2 ZINC000540325431 939195211 /nfs/dbraw/zinc/19/52/11/939195211.db2.gz HHXXNSDKOKISPY-IRXDYDNUSA-N 0 3 419.481 4.067 20 0 HIADHN CC(=O)Nc1cc(S(=O)(=O)[N-]c2ccc(C[N@H+]3CCCC[C@@H]3C)cc2)ccc1C ZINC000540330485 939196932 /nfs/dbraw/zinc/19/69/32/939196932.db2.gz ISNUJJWJYIKWGH-KRWDZBQOSA-N 0 3 415.559 4.129 20 0 HIADHN CC(=O)Nc1cc(S(=O)(=O)[N-]c2ccc(C[N@@H+]3CCCC[C@@H]3C)cc2)ccc1C ZINC000540330485 939196933 /nfs/dbraw/zinc/19/69/33/939196933.db2.gz ISNUJJWJYIKWGH-KRWDZBQOSA-N 0 3 415.559 4.129 20 0 HIADHN Cc1ccc([C@@H](C)NCC(=O)Nc2cc(C(F)(F)F)ccc2N2CCOCC2)cc1 ZINC000540330697 939197142 /nfs/dbraw/zinc/19/71/42/939197142.db2.gz ZEQUBRATFYZSIR-MRXNPFEDSA-N 0 3 421.463 4.140 20 0 HIADHN Cc1ccc(S(=O)(=O)CCCN(C)[C@H]2CCN(Cc3ccccc3)[C@H](C)C2)cc1 ZINC000540345687 939201661 /nfs/dbraw/zinc/20/16/61/939201661.db2.gz DANOXGYHNJSIKS-GGAORHGYSA-N 0 3 414.615 4.144 20 0 HIADHN CC(C)(C)C[C@H](NCC(=O)N1CCC(NC(=O)c2ccccc2)CC1)c1ccccc1 ZINC000540351594 939203790 /nfs/dbraw/zinc/20/37/90/939203790.db2.gz KYUGXOGSHAZCOH-QHCPKHFHSA-N 0 3 421.585 4.175 20 0 HIADHN C[C@H](N[C@@H](C)c1cccc(OCc2ccccn2)c1)C(=O)N1CCc2ccccc2C1 ZINC000540353634 939204824 /nfs/dbraw/zinc/20/48/24/939204824.db2.gz ZECWUDOAPCDIJT-PMACEKPBSA-N 0 3 415.537 4.285 20 0 HIADHN CC(C)(C)C[C@H](NCC(=O)NCc1ccc(C(=O)N2CCCC2)cc1)c1ccccc1 ZINC000540355027 939205721 /nfs/dbraw/zinc/20/57/21/939205721.db2.gz XHXIHAJGHPKGDY-QHCPKHFHSA-N 0 3 421.585 4.306 20 0 HIADHN COCc1cccc(CNC(=O)CN[C@@H](c2cccc(C(F)(F)F)c2)C(C)C)c1 ZINC000540358806 939208590 /nfs/dbraw/zinc/20/85/90/939208590.db2.gz MGMHUNABWPINPE-OAQYLSRUSA-N 0 3 408.464 4.455 20 0 HIADHN C[C@H](N[C@@H](C)c1ccccc1-n1cccn1)C(=O)Nc1ccc(Br)cc1 ZINC000540361957 939210058 /nfs/dbraw/zinc/21/00/58/939210058.db2.gz CGDKWAGZLJRPFH-GJZGRUSLSA-N 0 3 413.319 4.313 20 0 HIADHN Cc1cc2ncn(C[C@H](O)CN[C@@H](CC(F)(F)F)c3ccc(F)cc3)c2cc1C ZINC000540377777 939218157 /nfs/dbraw/zinc/21/81/57/939218157.db2.gz WBVOTNDQWWAFOU-MJGOQNOKSA-N 0 3 409.427 4.436 20 0 HIADHN COc1cc2c(cc1OC)CN(C(=O)CN[C@H](CC(C)(C)C)c1ccccc1)CC2 ZINC000540379901 939218932 /nfs/dbraw/zinc/21/89/32/939218932.db2.gz QSESUFAAKCZJPO-OAQYLSRUSA-N 0 3 410.558 4.356 20 0 HIADHN O=C(CN[C@@H](c1ccccc1)[C@@H]1CCOC1)Nc1ccc(Br)cc1Cl ZINC000540395506 939233188 /nfs/dbraw/zinc/23/31/88/939233188.db2.gz VRGMVXQFPWKROV-KUHUBIRLSA-N 0 3 423.738 4.408 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N[C@H]1CCO[C@@H]1c1ccc(Cl)cc1 ZINC000540397560 939233721 /nfs/dbraw/zinc/23/37/21/939233721.db2.gz LJYDRCKNWFOXBX-NLWGTHIKSA-N 0 3 419.978 4.368 20 0 HIADHN O=C(CN[C@@H](C[C@@H]1CCOC1)c1ccccc1)NCCc1cccc(Cl)c1Cl ZINC000540433898 939247235 /nfs/dbraw/zinc/24/72/35/939247235.db2.gz AXNSHOABSHEKJR-JXFKEZNVSA-N 0 3 421.368 4.410 20 0 HIADHN COc1ccc(NC(=O)[C@@H](C)N[C@H](C)c2ccc(-c3cccnc3)cc2)cc1OC ZINC000540433876 939247237 /nfs/dbraw/zinc/24/72/37/939247237.db2.gz ACNXSYDMIUEDMF-IAGOWNOFSA-N 0 3 405.498 4.444 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)N[C@H]1CCOc2ccccc21)c1ccc(-c2ccncc2)cc1 ZINC000540440709 939251030 /nfs/dbraw/zinc/25/10/30/939251030.db2.gz ZOMJLBNDOPLHGA-STSQHVNTSA-N 0 3 401.510 4.428 20 0 HIADHN Cc1ccc([C@@H](NCc2ccc(CS(=O)(=O)NC(C)C)cc2)C2CCCC2)o1 ZINC000540474658 939266526 /nfs/dbraw/zinc/26/65/26/939266526.db2.gz GEUNITYVHXWCDB-QFIPXVFZSA-N 0 3 404.576 4.437 20 0 HIADHN C[C@@H](NCC(=O)N(C)Cc1c(F)cccc1Cl)c1cccc(N2CCCC2)c1 ZINC000540476786 939268253 /nfs/dbraw/zinc/26/82/53/939268253.db2.gz RGGIAPGEOFLFTH-MRXNPFEDSA-N 0 3 403.929 4.389 20 0 HIADHN CSc1ccc(C)c(NC(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)c1 ZINC000540520727 939286051 /nfs/dbraw/zinc/28/60/51/939286051.db2.gz QIDRVUYCCIUWMC-QZTJIDSGSA-N 0 3 405.608 4.460 20 0 HIADHN CN(CC(F)(F)F)C(=O)CN[C@H](c1ccc(Cl)c(C(F)(F)F)c1)C1CC1 ZINC000540524340 939288232 /nfs/dbraw/zinc/28/82/32/939288232.db2.gz DVERICKYXJWVER-AWEZNQCLSA-N 0 3 402.766 4.420 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)c1ccnc(-c2ccccc2)c1N ZINC000540530003 939291430 /nfs/dbraw/zinc/29/14/30/939291430.db2.gz QUOLGHQIGUNKGA-IBGZPJMESA-N 0 3 400.526 4.067 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)c3ccccc3NC3CCCCC3)CC2)C[C@@H](C)O1 ZINC000540545981 939300399 /nfs/dbraw/zinc/30/03/99/939300399.db2.gz VYLVNUVGLNAHBK-WOJBJXKFSA-N 0 3 413.606 4.393 20 0 HIADHN COc1cccc2cc([C@@H](C)NCc3cccc(OCCN4CCOCC4)c3)oc21 ZINC000540598471 939315832 /nfs/dbraw/zinc/31/58/32/939315832.db2.gz MLUARQXQIGKAAS-GOSISDBHSA-N 0 3 410.514 4.003 20 0 HIADHN CCc1nn(C)c(CC)c1CNC1(c2ccc(Br)cc2)CCOCC1 ZINC000540598190 939315841 /nfs/dbraw/zinc/31/58/41/939315841.db2.gz QWGILQXKMAEUEM-UHFFFAOYSA-N 0 3 406.368 4.103 20 0 HIADHN CC[C@@H](N[C@H]1CCCN(CC(F)(F)F)C1=O)c1cc(F)cc(Br)c1 ZINC000540605989 939317394 /nfs/dbraw/zinc/31/73/94/939317394.db2.gz JGZRCNWFOVPPSN-KGLIPLIRSA-N 0 3 411.237 4.182 20 0 HIADHN COCCNc1ccc(CNCc2cn(-c3ccccc3)nc2-c2ccncc2)cc1 ZINC000540609187 939318485 /nfs/dbraw/zinc/31/84/85/939318485.db2.gz GQEFYDWURLRRTL-UHFFFAOYSA-N 0 3 413.525 4.282 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@H](C)NCc2c(C)nn(C(C)(C)C)c2C)CC1 ZINC000540609558 939318737 /nfs/dbraw/zinc/31/87/37/939318737.db2.gz UXBFKNYMDLUMLJ-KRWDZBQOSA-N 0 3 415.601 4.387 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)N[C@@H]1C[C@H]2CCC(C)(C)c3cccc1c32 ZINC000540665552 939334367 /nfs/dbraw/zinc/33/43/67/939334367.db2.gz OWLPUNAFVCBDED-XMSQKQJNSA-N 0 3 406.574 4.455 20 0 HIADHN COc1ccc(NC(=O)C[C@@H](C)N[C@H]2CCCOc3cc(F)ccc32)c(OC)c1 ZINC000540778591 939369047 /nfs/dbraw/zinc/36/90/47/939369047.db2.gz LRXKHIJNKIIBIK-KDOFPFPSSA-N 0 3 402.466 4.064 20 0 HIADHN COCCNC(=O)[C@H](CC(C)C)N[C@H]1CCCc2nc(-c3ccccc3F)sc21 ZINC000540789091 939373132 /nfs/dbraw/zinc/37/31/32/939373132.db2.gz KXVXOWPKQPZXKO-HKUYNNGSSA-N 0 3 419.566 4.094 20 0 HIADHN Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)C(=O)N[C@H](CN1CCCC1)c1ccccc1 ZINC000540895967 939413302 /nfs/dbraw/zinc/41/33/02/939413302.db2.gz OMBCNVNUQFFYHA-HNAYVOBHSA-N 0 3 422.495 4.119 20 0 HIADHN O=c1cc(CN2CCC[C@@H]2/C=C/c2ccccc2)nc2ccc(Br)cn12 ZINC000540944605 939419436 /nfs/dbraw/zinc/41/94/36/939419436.db2.gz PZWVGHLQGLLHJM-LHUXKHBRSA-N 0 3 410.315 4.135 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)NCC(=O)N[C@H](c2ccc(F)cc2)C(C)C)cc1 ZINC000541027521 939435140 /nfs/dbraw/zinc/43/51/40/939435140.db2.gz BCNMJSFLXXNQGO-OSPHWJPCSA-N 0 3 408.521 4.484 20 0 HIADHN Cc1ccnc(OC2CCN(CCC(=O)Nc3cccc(Br)c3)CC2)c1 ZINC000541121450 939468390 /nfs/dbraw/zinc/46/83/90/939468390.db2.gz JPEUIWFRQBFDLC-UHFFFAOYSA-N 0 3 418.335 4.025 20 0 HIADHN CCN(CC)C(=O)CCC1CCN(Cc2cnn(-c3ccc(Cl)cc3)c2)CC1 ZINC000541255359 939487869 /nfs/dbraw/zinc/48/78/69/939487869.db2.gz LFGYSKNIDXNODL-UHFFFAOYSA-N 0 3 402.970 4.386 20 0 HIADHN Cc1cn(C2CCCCC2)nc1NC(=O)CCCN1CCN(c2ccccc2)CC1 ZINC000541280089 939489091 /nfs/dbraw/zinc/48/90/91/939489091.db2.gz OQUKJJPMSIHKLG-UHFFFAOYSA-N 0 3 409.578 4.238 20 0 HIADHN NC(=O)[C@H](Cc1ccc(F)cc1)NCc1ccccc1COc1ccccc1Cl ZINC000541302922 939490187 /nfs/dbraw/zinc/49/01/87/939490187.db2.gz OLQAKVYBIDNPQY-NRFANRHFSA-N 0 3 412.892 4.244 20 0 HIADHN CCOC(=O)c1c(CN2C[C@@H]3CC[C@H](O)[C@@H]3C2)nc2ccccc2c1-c1ccccc1 ZINC000541315756 939490525 /nfs/dbraw/zinc/49/05/25/939490525.db2.gz KAJMSZROXKOHLW-NOXFTYBFSA-N 0 3 416.521 4.281 20 0 HIADHN COc1cccc([C@@H]2[C@H](c3ccccc3)CCN2C(=O)N[C@@H]2CCN(C3CC3)C2)c1 ZINC000541342963 939493151 /nfs/dbraw/zinc/49/31/51/939493151.db2.gz HEGFTYHAFLKNOC-FGCOXFRFSA-N 0 3 405.542 4.172 20 0 HIADHN COc1ccc(C(=O)NC2CCN([C@H](C)c3ccncc3)CC2)cc1OC1CCCC1 ZINC000541514095 939541693 /nfs/dbraw/zinc/54/16/93/939541693.db2.gz FOJOSCOQXNHRLN-GOSISDBHSA-N 0 3 423.557 4.367 20 0 HIADHN Fc1ccc(-c2nn(-c3ccccc3)cc2CN2CCOCC3(CCOCC3)C2)cc1 ZINC000541535204 939546391 /nfs/dbraw/zinc/54/63/91/939546391.db2.gz CWBPKCLLEJSMMD-UHFFFAOYSA-N 0 3 421.516 4.307 20 0 HIADHN Cc1nc(-c2ccccc2)sc1[C@@H](C)N[C@H]1CCCN(Cc2ccccn2)C1=O ZINC000541568511 939556937 /nfs/dbraw/zinc/55/69/37/939556937.db2.gz UGSZWYLQPCUEHY-UZLBHIALSA-N 0 3 406.555 4.355 20 0 HIADHN Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)N[C@H]1CCCN(Cc2ccccn2)C1=O ZINC000541568407 939557094 /nfs/dbraw/zinc/55/70/94/939557094.db2.gz QEKMDUWEMCTVPH-YWZLYKJASA-N 0 3 424.545 4.494 20 0 HIADHN Brc1cnc(CNC[C@H]2[C@@H]3c4ccccc4C[C@H]23)c(Br)c1 ZINC000541587671 939561174 /nfs/dbraw/zinc/56/11/74/939561174.db2.gz RPSMZHMFQDOGQU-CKEIUWERSA-N 0 3 408.137 4.282 20 0 HIADHN Cc1cccc(C)c1NC(=O)CNC(=O)[C@@H](C)N[C@H](CC(C)C)c1cccs1 ZINC000541626164 939574388 /nfs/dbraw/zinc/57/43/88/939574388.db2.gz GTZLCIARSHGLJY-QZTJIDSGSA-N 0 3 401.576 4.185 20 0 HIADHN CCc1ccc([C@@H](NC(=O)CN2CCC3(CCOCC3)[C@@H]2C)c2cccs2)cc1 ZINC000541718311 939613665 /nfs/dbraw/zinc/61/36/65/939613665.db2.gz OCIBLMDMQCQOLV-FDDCHVKYSA-N 0 3 412.599 4.407 20 0 HIADHN Cc1cc(Br)ccc1NC(=O)CCNCc1c[nH]c(-c2ccccc2)n1 ZINC000541761997 939623682 /nfs/dbraw/zinc/62/36/82/939623682.db2.gz IWTDQWNHHLDBMB-UHFFFAOYSA-N 0 3 413.319 4.266 20 0 HIADHN Cc1cc(Br)ccc1NC(=O)CCNCc1cnc(-c2ccccc2)[nH]1 ZINC000541761997 939623686 /nfs/dbraw/zinc/62/36/86/939623686.db2.gz IWTDQWNHHLDBMB-UHFFFAOYSA-N 0 3 413.319 4.266 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N[C@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000541798037 939635340 /nfs/dbraw/zinc/63/53/40/939635340.db2.gz XVOIPJQNBCCYLW-XUVXKRRUSA-N 0 3 417.550 4.244 20 0 HIADHN CS[C@@H]1CN(C(=O)c2csc(-c3ccc(Cl)cc3)n2)C[C@@H]1N1CCCC1 ZINC000541844077 939645960 /nfs/dbraw/zinc/64/59/60/939645960.db2.gz YKWMUAKLNZBDGK-DLBZAZTESA-N 0 3 407.992 4.115 20 0 HIADHN C[C@@H]1C[C@@H](N[C@H](c2ccc(Cl)cc2)c2cccc(S(C)(=O)=O)c2)C[C@H](C)O1 ZINC000541847725 939646673 /nfs/dbraw/zinc/64/66/73/939646673.db2.gz BCTCYXUFZCVPSI-OGZLKCIRSA-N 0 3 407.963 4.379 20 0 HIADHN C[C@@H]1CC(N[C@@H](c2cccc(S(C)(=O)=O)c2)c2ccc(F)c(F)c2)C[C@@H](C)O1 ZINC000541847741 939646686 /nfs/dbraw/zinc/64/66/86/939646686.db2.gz FJDHFMDPWLDBKW-LKBUQDJMSA-N 0 3 409.498 4.003 20 0 HIADHN CC(=O)Nc1ccc([C@@H](C)[NH2+]Cc2nnc(-c3ccc(Br)cc3)[n-]2)cc1 ZINC000541912573 939651836 /nfs/dbraw/zinc/65/18/36/939651836.db2.gz BEZFTJISWUOPPB-GFCCVEGCSA-N 0 3 414.307 4.043 20 0 HIADHN COc1cccc(C(=O)NCCN[C@H](CSC)c2ccc(C(F)(F)F)cc2)c1 ZINC000541914771 939652269 /nfs/dbraw/zinc/65/22/69/939652269.db2.gz JUTBNDQVLWQXCN-GOSISDBHSA-N 0 3 412.477 4.138 20 0 HIADHN CCN1CC[C@H](NCc2cc(OC)c(OC)cc2OC)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000541992107 939671928 /nfs/dbraw/zinc/67/19/28/939671928.db2.gz NFTYHBZUKBMPHY-HTAPYJJXSA-N 0 3 424.463 4.055 20 0 HIADHN C[C@@H](c1ccc(Cl)cc1)N(C)C(=O)CN1CCC(CCCn2ccnc2)CC1 ZINC000542132379 939724554 /nfs/dbraw/zinc/72/45/54/939724554.db2.gz ZAWOZGXYNBBECW-SFHVURJKSA-N 0 3 402.970 4.248 20 0 HIADHN CCc1cccc2c1OCC[C@@H]2N[C@@H](C)CC(=O)Nc1ccc(NC(=O)C2CC2)cc1 ZINC000542143106 939728878 /nfs/dbraw/zinc/72/88/78/939728878.db2.gz GBOYULXSRVYXAV-AOMKIAJQSA-N 0 3 421.541 4.428 20 0 HIADHN C[C@H](Cc1ccsc1)N1CCN(CCCc2nc(-c3cccs3)no2)CC1 ZINC000542151880 939732645 /nfs/dbraw/zinc/73/26/45/939732645.db2.gz VMSYVBUSTVUJDS-MRXNPFEDSA-N 0 3 402.589 4.041 20 0 HIADHN Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)N[C@H]1CCCN(Cc2nccn2C)C1=O ZINC000542158307 939736387 /nfs/dbraw/zinc/73/63/87/939736387.db2.gz VSKYEMXZPRZLJH-APWZRJJASA-N 0 3 423.586 4.002 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2ccc(-c3ccccc3)o2)cc1)[C@@H]1CCCN(C)C1 ZINC000542191997 939751022 /nfs/dbraw/zinc/75/10/22/939751022.db2.gz CNWXZOBQNRVQBY-OAQYLSRUSA-N 0 3 417.509 4.365 20 0 HIADHN CCOc1cc(CN2CC[C@@H](c3cc(C)cc(C)c3)C2)nc2nc(C(F)(F)F)nn21 ZINC000542317132 939798851 /nfs/dbraw/zinc/79/88/51/939798851.db2.gz ASTFZAHSKOICRO-OAHLLOKOSA-N 0 3 419.451 4.148 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@@H](C)NCc2cc(C)c3ncccc3c2)cc1 ZINC000542318835 939798980 /nfs/dbraw/zinc/79/89/80/939798980.db2.gz HEIVFRSVHQLFRM-GOSISDBHSA-N 0 3 411.571 4.425 20 0 HIADHN COc1cc(-c2nnc(CN3CC[C@@H](c4ccc(C)cc4)C3)o2)cc(OC)c1OC ZINC000542317333 939799036 /nfs/dbraw/zinc/79/90/36/939799036.db2.gz FZGJFEHQYJFBSD-QGZVFWFLSA-N 0 3 409.486 4.060 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)CN2CC[C@H](c3ccc(C)cc3)C2)c(OC)c1 ZINC000542323500 939800260 /nfs/dbraw/zinc/80/02/60/939800260.db2.gz VZJWFCGQDCGLHL-REWPJTCUSA-N 0 3 408.542 4.165 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)[C@H]1CCn2c(cnc2C2CCCCC2)C1 ZINC000542335712 939802669 /nfs/dbraw/zinc/80/26/69/939802669.db2.gz CQXUVKGMWGQIFE-LADGPHEKSA-N 0 3 420.601 4.447 20 0 HIADHN COC(=O)[C@H](NC(=O)c1cccc(CN2CCCC2)c1)c1ccc(Cl)cc1Cl ZINC000542375607 939810152 /nfs/dbraw/zinc/81/01/52/939810152.db2.gz XODHBBJVCDFWND-LJQANCHMSA-N 0 3 421.324 4.233 20 0 HIADHN O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1cccc2nc[nH]c21 ZINC000542387313 939812278 /nfs/dbraw/zinc/81/22/78/939812278.db2.gz WDKFEKMKXDDXTP-UHFFFAOYSA-N 0 3 403.313 4.264 20 0 HIADHN CCCc1c(NC(=O)N(CCN(C)C)Cc2ccco2)cnn1-c1cccc(F)c1 ZINC000542435638 939822009 /nfs/dbraw/zinc/82/20/09/939822009.db2.gz MDQVNHRMOWFQEI-UHFFFAOYSA-N 0 3 413.497 4.153 20 0 HIADHN COc1cccc(CC(=O)N[C@H](c2ccc(F)c(F)c2)C(C)(C)N2CCCC2)c1 ZINC000542472024 939828755 /nfs/dbraw/zinc/82/87/55/939828755.db2.gz XGXSORFYIGVMRS-JOCHJYFZSA-N 0 3 402.485 4.248 20 0 HIADHN Cc1nc(CN2CCC(CN[C@@H](c3ccccc3)c3ccc(F)cn3)CC2)oc1C ZINC000542475507 939829307 /nfs/dbraw/zinc/82/93/07/939829307.db2.gz XWQGQJAHCQEEJF-DEOSSOPVSA-N 0 3 408.521 4.417 20 0 HIADHN Cc1cc([C@H](NC2CCN(C(=O)CC(F)(F)F)CC2)c2cccnc2)ccc1F ZINC000542493888 939832605 /nfs/dbraw/zinc/83/26/05/939832605.db2.gz HUMYJLUSVXDLNX-FQEVSTJZSA-N 0 3 409.427 4.152 20 0 HIADHN COC(=O)c1ccc(CNC(=O)[C@@H](C)N[C@@H](Cc2ccccc2)c2cccs2)cc1 ZINC000542521035 939836499 /nfs/dbraw/zinc/83/64/99/939836499.db2.gz JIANSRPTDBDJCN-UTKZUKDTSA-N 0 3 422.550 4.113 20 0 HIADHN COc1cc(CN(C)C[C@@H](O)COc2cc(C)ccc2Cl)ccc1OC(F)F ZINC000542522650 939836864 /nfs/dbraw/zinc/83/68/64/939836864.db2.gz YCGFCMUNXUZNKJ-OAHLLOKOSA-N 0 3 415.864 4.130 20 0 HIADHN C[C@@H](N[C@@H](Cc1ccccc1)c1cccs1)C(=O)Nc1ccc2c(c1)OCCO2 ZINC000542525819 939837405 /nfs/dbraw/zinc/83/74/05/939837405.db2.gz MQBRJRPSLVTPQR-APWZRJJASA-N 0 3 408.523 4.420 20 0 HIADHN Cc1c([C@@H](C)NCCCS(=O)(=O)c2ccc(C)cc2)cnn1-c1ccc(F)cc1 ZINC000542538298 939840294 /nfs/dbraw/zinc/84/02/94/939840294.db2.gz ATIAYOOYWQCJSO-QGZVFWFLSA-N 0 3 415.534 4.143 20 0 HIADHN Cc1csc([C@H](C)CNC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)n1 ZINC000542582286 939846103 /nfs/dbraw/zinc/84/61/03/939846103.db2.gz SFUVAHXECAFPNM-KUHUBIRLSA-N 0 3 411.493 4.126 20 0 HIADHN C[C@H](NCC(=O)Nc1ccc(OCc2ccccc2)cc1)[C@@H]1COc2ccccc21 ZINC000542624664 939849965 /nfs/dbraw/zinc/84/99/65/939849965.db2.gz AAXFODDFLNOHGU-MBSDFSHPSA-N 0 3 402.494 4.358 20 0 HIADHN Cc1ccc(CN(C(=O)CN(C)[C@H]2CCO[C@H](c3ccc(F)cc3)C2)C2CC2)cc1 ZINC000542626264 939850055 /nfs/dbraw/zinc/85/00/55/939850055.db2.gz AELGUAMPCRTUQI-ZEQRLZLVSA-N 0 3 410.533 4.477 20 0 HIADHN C[C@@H](NCC(=O)Nc1cc(C(C)(C)C)nn1-c1ccccc1)[C@H]1COc2ccccc21 ZINC000542626224 939850142 /nfs/dbraw/zinc/85/01/42/939850142.db2.gz GXHJZUFGAIGAAT-YLJYHZDGSA-N 0 3 418.541 4.263 20 0 HIADHN O=C(Nc1cccc(C(F)F)c1Cl)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1CO ZINC000542721575 939856745 /nfs/dbraw/zinc/85/67/45/939856745.db2.gz IAQGPTSZURQVLZ-DOTOQJQBSA-N 0 3 423.891 4.282 20 0 HIADHN Cc1cc(NC(=O)[C@H]2CCCN(Cc3cccnc3)C2)cnc1N1CCCC[C@H]1C ZINC000542816287 939861215 /nfs/dbraw/zinc/86/12/15/939861215.db2.gz PUJCCBNKMKVGLS-CTNGQTDRSA-N 0 3 407.562 4.015 20 0 HIADHN CC[C@H]1c2ccsc2CCN1C(=O)CN[C@@H](C)c1ccc(-n2ccnc2C)cc1 ZINC000542886142 939865276 /nfs/dbraw/zinc/86/52/76/939865276.db2.gz SYNYKTPPXCMSBE-KKSFZXQISA-N 0 3 408.571 4.429 20 0 HIADHN CSc1ccc(CN(C)C(=O)CN[C@@H](C)c2ccc(-n3ccnc3C)cc2)cc1 ZINC000542885266 939865374 /nfs/dbraw/zinc/86/53/74/939865374.db2.gz YXBJCLOECXNSCT-KRWDZBQOSA-N 0 3 408.571 4.212 20 0 HIADHN CC[C@@H]1c2ccsc2CCN1C(=O)CN[C@@H](C)c1ccc(-n2ccnc2C)cc1 ZINC000542886139 939865380 /nfs/dbraw/zinc/86/53/80/939865380.db2.gz SYNYKTPPXCMSBE-HRAATJIYSA-N 0 3 408.571 4.429 20 0 HIADHN CC(C)N(CCN(C)C)C(=O)Nc1ccc(OCC(F)(F)F)c(C(F)(F)F)c1 ZINC000542902033 939875422 /nfs/dbraw/zinc/87/54/22/939875422.db2.gz MLEGMPGKMOBKTR-UHFFFAOYSA-N 0 3 415.378 4.450 20 0 HIADHN COC(=O)COc1ccc(CN2CCC[C@@H](c3nc(C(F)(F)F)cs3)C2)cc1 ZINC000543092623 939938873 /nfs/dbraw/zinc/93/88/73/939938873.db2.gz IFNYLIUIONKJKM-CQSZACIVSA-N 0 3 414.449 4.093 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3ccc(SC4CC4)cc3)CC2)C[C@H](C)O1 ZINC000543104582 939946597 /nfs/dbraw/zinc/94/65/97/939946597.db2.gz HAYVGQMMENWNTA-HDICACEKSA-N 0 3 402.604 4.293 20 0 HIADHN NC(=O)[C@H](Cc1ccc(C(F)(F)F)cc1)NCCOc1cccc(Cl)c1Cl ZINC000543163491 939982444 /nfs/dbraw/zinc/98/24/44/939982444.db2.gz KINAKOGTYMENKC-AWEZNQCLSA-N 0 3 421.246 4.077 20 0 HIADHN C[C@@H](CN(C)C(=O)NC[C@@H](c1ccccc1)N1CCC(C)CC1)c1nccs1 ZINC000543201515 939993890 /nfs/dbraw/zinc/99/38/90/939993890.db2.gz ZDJHPRJHEBUDGW-ICSRJNTNSA-N 0 3 400.592 4.361 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)c2cccc(OCc3cccnc3)c2)CCN1Cc1ccccc1 ZINC000563760447 945287748 /nfs/dbraw/zinc/28/77/48/945287748.db2.gz RPKNAVUBCFRGPW-DVECYGJZSA-N 0 3 401.510 4.053 20 0 HIADHN COc1ccc(OC)c([C@H]2CCCN2C(=O)CN2CC[C@@H](c3ccc(C)cc3)C2)c1 ZINC000543247153 940007635 /nfs/dbraw/zinc/00/76/35/940007635.db2.gz UQKNONLJBLXZOK-NFBKMPQASA-N 0 3 408.542 4.165 20 0 HIADHN Cc1nn(-c2ccncc2)cc1CNCc1cccc(NC(=O)c2cccc(F)c2)c1 ZINC000543251006 940008065 /nfs/dbraw/zinc/00/80/65/940008065.db2.gz XEIZCFQQGROWPB-UHFFFAOYSA-N 0 3 415.472 4.257 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)CN2CC[C@H](c3ccc(C)cc3)C2)cc1OC ZINC000543254160 940009238 /nfs/dbraw/zinc/00/92/38/940009238.db2.gz UCPJFUHGQNDKRL-VXKWHMMOSA-N 0 3 408.542 4.165 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)[C@H]1CCn2c(cnc2C2CCCCC2)C1 ZINC000543268082 940013232 /nfs/dbraw/zinc/01/32/32/940013232.db2.gz MWNODGJRESGFAL-LADGPHEKSA-N 0 3 420.601 4.447 20 0 HIADHN Cc1cc([C@@H](NCc2ccc(CN3CCN(C)CC3)cc2)c2cccnc2)ccc1F ZINC000543405623 940054066 /nfs/dbraw/zinc/05/40/66/940054066.db2.gz AVGHUHNVWVMSJF-AREMUKBSSA-N 0 3 418.560 4.156 20 0 HIADHN C[C@H](C[S@](C)=O)NCc1cn(Cc2ccccc2)nc1-c1cc2ccccc2o1 ZINC000543410487 940056955 /nfs/dbraw/zinc/05/69/55/940056955.db2.gz SFRHGYRJSVUQOX-JWRCQZCYSA-N 0 3 407.539 4.201 20 0 HIADHN Cc1ccsc1[C@@H](Cc1ccccc1)NCC(=O)Nc1ccc2c(c1)OCCO2 ZINC000543454087 940067816 /nfs/dbraw/zinc/06/78/16/940067816.db2.gz YRFMTQARWIUHFU-LJQANCHMSA-N 0 3 408.523 4.340 20 0 HIADHN COc1cc(Br)c(CN[C@@H]2CCO[C@@H](c3ccc(F)cc3)C2)cc1O ZINC000543617676 940133619 /nfs/dbraw/zinc/13/36/19/940133619.db2.gz DJFNPWOYDBGBBB-CRAIPNDOSA-N 0 3 410.283 4.312 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)Nc2csc(-c3ccccn3)n2)CC1 ZINC000543619772 940135972 /nfs/dbraw/zinc/13/59/72/940135972.db2.gz ZGSSJWQGCVRMGP-UHFFFAOYSA-N 0 3 407.543 4.333 20 0 HIADHN Fc1ccc([C@@H]2C[C@@H](NCc3cc4c(cc3Br)OCO4)CCO2)cc1 ZINC000543623406 940138701 /nfs/dbraw/zinc/13/87/01/940138701.db2.gz BMDKDFHDCIYBIO-RDJZCZTQSA-N 0 3 408.267 4.327 20 0 HIADHN Cc1cc(NC(=O)NC[C@@H](C)c2nccs2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000543632141 940143760 /nfs/dbraw/zinc/14/37/60/940143760.db2.gz UEBXMGICOQHXBT-VQIMIIECSA-N 0 3 424.574 4.020 20 0 HIADHN CN(C)Cc1cccc(NC(=O)N2CCc3c(Br)ccc(F)c3C2)c1 ZINC000543643651 940147898 /nfs/dbraw/zinc/14/78/98/940147898.db2.gz LWDIGPYQDOJGOP-UHFFFAOYSA-N 0 3 406.299 4.240 20 0 HIADHN C[C@H](CNC(=O)N[C@H](CN1CCc2ccccc2C1)C(C)(C)C)c1nccs1 ZINC000543673571 940157507 /nfs/dbraw/zinc/15/75/07/940157507.db2.gz CZHCGTRZLXBWRO-VQIMIIECSA-N 0 3 400.592 4.019 20 0 HIADHN CS[C@H]1CN(C(=O)c2ccc(-c3nc4ccccc4s3)o2)C[C@@H]1N1CCCC1 ZINC000543700137 940163346 /nfs/dbraw/zinc/16/33/46/940163346.db2.gz YYAGLRPZQNZGBQ-KXBFYZLASA-N 0 3 413.568 4.208 20 0 HIADHN CC(=O)Nc1ccc([C@H](C)N[C@@H](Cc2ccccc2)C(=O)NCc2ccccc2)cc1 ZINC000543776984 940183140 /nfs/dbraw/zinc/18/31/40/940183140.db2.gz HZLMUGDXYBUYMT-DFBJGRDBSA-N 0 3 415.537 4.223 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)N[C@@H](C)C(=O)NC(=O)Nc2ccc(C)cc2C)cc1 ZINC000543812966 940194939 /nfs/dbraw/zinc/19/49/39/940194939.db2.gz WCTLWCVBVAZMMT-MSOLQXFVSA-N 0 3 419.529 4.185 20 0 HIADHN CCN1CC[C@@H](NCc2cccc3c2OCCCO3)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000543870516 940218347 /nfs/dbraw/zinc/21/83/47/940218347.db2.gz BQNRTZCGOYPDMJ-NQIIRXRSSA-N 0 3 406.448 4.190 20 0 HIADHN COc1cc(CN2CCC(Cc3cccnc3)CC2)cc(OC)c1OCC(F)F ZINC000563841031 945311240 /nfs/dbraw/zinc/31/12/40/945311240.db2.gz HKXVHZRCBIIRDX-UHFFFAOYSA-N 0 3 406.473 4.197 20 0 HIADHN O[C@H](COc1ccccc1C(F)(F)F)CN1CC=C(c2c[nH]c3ncccc23)CC1 ZINC000544146796 940337834 /nfs/dbraw/zinc/33/78/34/940337834.db2.gz VRHWTKBLYUOSBB-INIZCTEOSA-N 0 3 417.431 4.111 20 0 HIADHN Cc1ccc([C@H](CNC(=O)[C@@H]2CCn3c(cnc3C3CCCCC3)C2)N(C)C)cc1 ZINC000544198852 940352076 /nfs/dbraw/zinc/35/20/76/940352076.db2.gz FJWKAQIXVHVXHC-GGAORHGYSA-N 0 3 408.590 4.221 20 0 HIADHN C[C@H](CNC(=O)[C@@H]1CCn2c(cnc2C2CCCCC2)C1)N(C)Cc1ccccc1 ZINC000544224925 940360177 /nfs/dbraw/zinc/36/01/77/940360177.db2.gz NIAGNQBPKXVCMO-DENIHFKCSA-N 0 3 408.590 4.130 20 0 HIADHN Cc1cccc(CSCc2nc(-c3ccc(N4CCCN(C)CC4)nc3)no2)c1 ZINC000544335558 940393441 /nfs/dbraw/zinc/39/34/41/940393441.db2.gz BDYQAEHSPNJNPS-UHFFFAOYSA-N 0 3 409.559 4.015 20 0 HIADHN CN1CCCN(c2ccc(-c3noc([C@@H]4C[C@H]4c4cccc(Cl)c4)n3)cn2)CC1 ZINC000544346423 940396380 /nfs/dbraw/zinc/39/63/80/940396380.db2.gz QEAOVMBDDHCVFL-RBUKOAKNSA-N 0 3 409.921 4.198 20 0 HIADHN Cc1cccc([C@H](CN[C@@H](c2ccc(F)cc2)c2cccnc2)N2CCOCC2)c1 ZINC000544359243 940400165 /nfs/dbraw/zinc/40/01/65/940400165.db2.gz FUFNEFMALDQXQT-DQEYMECFSA-N 0 3 405.517 4.282 20 0 HIADHN O=C(C1CCC(N[C@@H](c2ccc(F)cc2)c2cccnc2)CC1)N1CCSCC1 ZINC000544359331 940400718 /nfs/dbraw/zinc/40/07/18/940400718.db2.gz ODKULACGVWNSQJ-UDJZJCJKSA-N 0 3 413.562 4.034 20 0 HIADHN Fc1ccc([C@H](CN[C@H](c2ccc(F)cc2)c2cccnc2)N2CCOCC2)cc1 ZINC000544363212 940401973 /nfs/dbraw/zinc/40/19/73/940401973.db2.gz UHULCCFIXUJGQR-BJKOFHAPSA-N 0 3 409.480 4.112 20 0 HIADHN O=C(CN[C@@H](c1cccs1)C1CC1)Nc1ccccc1I ZINC000544397479 940411342 /nfs/dbraw/zinc/41/13/42/940411342.db2.gz JGNPSKMBAOGCRR-MRXNPFEDSA-N 0 3 412.296 4.032 20 0 HIADHN COc1cccc(NC(=O)CN[C@@H](c2ccc(F)c(F)c2)C(C)(C)N2CCCC2)c1 ZINC000544408826 940415686 /nfs/dbraw/zinc/41/56/86/940415686.db2.gz VQAFXHKMCFJRIE-QFIPXVFZSA-N 0 3 417.500 4.117 20 0 HIADHN O=C(CN[C@H](Cc1ccccc1)c1cccs1)Nc1ccccc1N1CCCC1=O ZINC000544412645 940416850 /nfs/dbraw/zinc/41/68/50/940416850.db2.gz NTGFNEXGYHEMMH-HXUWFJFHSA-N 0 3 419.550 4.387 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)N[C@H]2CCO[C@H](c3ccc(F)cc3)C2)CN1Cc1ccccc1 ZINC000544427718 940425737 /nfs/dbraw/zinc/42/57/37/940425737.db2.gz UBQMCGXGYPTMCH-SZOBAZRNSA-N 0 3 411.521 4.008 20 0 HIADHN COC[C@H](NCC(=O)N(Cc1ccccc1)c1nc2c(cccc2C)s1)C1CC1 ZINC000544442082 940432473 /nfs/dbraw/zinc/43/24/73/940432473.db2.gz BWPSVPMKCBQSSM-IBGZPJMESA-N 0 3 409.555 4.153 20 0 HIADHN C[C@H](N[C@@H](CC(N)=O)C1CCCCC1)C(=O)Nc1ccccc1Cc1ccccc1 ZINC000544455460 940438072 /nfs/dbraw/zinc/43/80/72/940438072.db2.gz AYCRFTATCPGXMM-MBSDFSHPSA-N 0 3 407.558 4.018 20 0 HIADHN COc1cc(CNC(=O)CNC(C)(C)c2cccs2)ccc1OCc1ccccc1 ZINC000544468025 940443966 /nfs/dbraw/zinc/44/39/66/940443966.db2.gz FWHAJNZGJQYLAG-UHFFFAOYSA-N 0 3 424.566 4.477 20 0 HIADHN C[C@@H](NCC(=O)Nc1cccc(CSc2ccccn2)c1)[C@H]1COc2ccccc21 ZINC000544523406 940471251 /nfs/dbraw/zinc/47/12/51/940471251.db2.gz ULCMGOXPCHREDN-DYESRHJHSA-N 0 3 419.550 4.467 20 0 HIADHN COc1ccc(-c2csc(NC(=O)[C@H](C)N[C@@H](C)[C@@H]3COc4ccccc43)n2)cc1 ZINC000544526693 940471923 /nfs/dbraw/zinc/47/19/23/940471923.db2.gz BEMXBEOBQYLMEP-DOXZYTNZSA-N 0 3 423.538 4.300 20 0 HIADHN C[C@@H](NCC(=O)N(C)C(c1ccccc1)c1ccccc1)[C@H]1COc2ccccc21 ZINC000544530605 940472937 /nfs/dbraw/zinc/47/29/37/940472937.db2.gz ZNDGRQZPYVRYDH-AUSIDOKSSA-N 0 3 400.522 4.389 20 0 HIADHN C[C@H]1N(CC(=O)N2CCc3sccc3[C@@H]2c2ccccc2)CCC12CCOCC2 ZINC000544546406 940476140 /nfs/dbraw/zinc/47/61/40/940476140.db2.gz HTVRLBSGDHUMMC-JPYJTQIMSA-N 0 3 410.583 4.113 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@H]2NCc2cccc(Cn3ccnc3)c2)cc1 ZINC000544579226 940483760 /nfs/dbraw/zinc/48/37/60/940483760.db2.gz NRPQKPRVAYHJGT-DNQXCXABSA-N 0 3 423.582 4.115 20 0 HIADHN Cc1ncc(CN[C@H](C)CC(=O)Nc2cccc(N3CCCC3)c2)n1-c1ccccc1 ZINC000544608466 940489839 /nfs/dbraw/zinc/48/98/39/940489839.db2.gz WBLOJMUAPCTCHH-LJQANCHMSA-N 0 3 417.557 4.288 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)NCc2nc3ccccc3n2C2CC2)N(C)C)cc1 ZINC000544779120 940513251 /nfs/dbraw/zinc/51/32/51/940513251.db2.gz YTGOHFBTHJHYHK-JOCHJYFZSA-N 0 3 405.546 4.036 20 0 HIADHN CCN(C(=O)c1cnc(Oc2ccccc2)cn1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000544848124 940518902 /nfs/dbraw/zinc/51/89/02/940518902.db2.gz FYLJNOZEFFNLOL-HXUWFJFHSA-N 0 3 402.498 4.006 20 0 HIADHN CCN(C(=O)Cc1c(C)nn(-c2ccccc2)c1C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000544848689 940518960 /nfs/dbraw/zinc/51/89/60/940518960.db2.gz HHWHITLIGMRNCA-DEOSSOPVSA-N 0 3 416.569 4.155 20 0 HIADHN CCN(C(=O)c1cc(-c2ccccc2)c(C)[nH]c1=O)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000544877574 940521201 /nfs/dbraw/zinc/52/12/01/940521201.db2.gz SXMROVXFYFQWGR-JOCHJYFZSA-N 0 3 415.537 4.499 20 0 HIADHN COc1cccc2[nH]cc(Cc3noc(-c4ccc(CN5CCSCC5)cc4)n3)c21 ZINC000545020333 940534174 /nfs/dbraw/zinc/53/41/74/940534174.db2.gz RKCBPMCNWUPLEV-UHFFFAOYSA-N 0 3 420.538 4.366 20 0 HIADHN Fc1cccc(CN2CCC[C@@H](c3nc(-c4cccnc4OCC(F)F)no3)C2)c1 ZINC000545135460 940547734 /nfs/dbraw/zinc/54/77/34/940547734.db2.gz IHQZGCMKCJMESM-OAHLLOKOSA-N 0 3 418.419 4.294 20 0 HIADHN COCC[C@H]1CCCCN(c2cc(N3CCCC[C@@H](CCOC)C3)nc(C)n2)C1 ZINC000545219684 940556618 /nfs/dbraw/zinc/55/66/18/940556618.db2.gz ZJXAVXLYLFZNBI-OYRHEFFESA-N 0 3 404.599 4.071 20 0 HIADHN O=C(c1ccoc1)N1CCC(NCc2nc3c(s2)C[C@@H](c2ccccc2)CC3)CC1 ZINC000545220514 940556700 /nfs/dbraw/zinc/55/67/00/940556700.db2.gz BSHNZBKUJLYJEH-SFHVURJKSA-N 0 3 421.566 4.403 20 0 HIADHN CN(CCN(Cc1ccccc1)C(=O)N[C@H]1CCOC(C)(C)C1)Cc1ccccc1 ZINC000545240788 940558027 /nfs/dbraw/zinc/55/80/27/940558027.db2.gz JLTIXXWHHVSSSR-QHCPKHFHSA-N 0 3 409.574 4.288 20 0 HIADHN CN(CCN(Cc1ccccc1)C(=O)N[C@@H]1CCOC(C)(C)C1)Cc1ccccc1 ZINC000545240787 940558056 /nfs/dbraw/zinc/55/80/56/940558056.db2.gz JLTIXXWHHVSSSR-HSZRJFAPSA-N 0 3 409.574 4.288 20 0 HIADHN CN(C)CCN(CC1CCCCC1)C(=O)N[C@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000545340293 940562963 /nfs/dbraw/zinc/56/29/63/940562963.db2.gz DTHGDCFTOWHFFR-VXKWHMMOSA-N 0 3 405.558 4.199 20 0 HIADHN CS(=O)(=O)Cc1ccccc1CN[C@H](Cc1cccnc1)c1ccc(Cl)cc1 ZINC000545457369 940570820 /nfs/dbraw/zinc/57/08/20/940570820.db2.gz DDGCPKYPIOXUQN-JOCHJYFZSA-N 0 3 414.958 4.353 20 0 HIADHN CCN(C(=O)c1ccc(-n2nc(C)cc2C)cc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000545476994 940571406 /nfs/dbraw/zinc/57/14/06/940571406.db2.gz SICBRPQFTPUAME-XMMPIXPASA-N 0 3 402.542 4.226 20 0 HIADHN COc1ccc(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2)cc1OC(C)C ZINC000545510498 940572484 /nfs/dbraw/zinc/57/24/84/940572484.db2.gz LABGSZCHDFTLRL-UHFFFAOYSA-N 0 3 403.498 4.217 20 0 HIADHN CCO[C@@H]1C[C@@H](NCc2cccc(NC(=O)c3ccc(Cl)cc3)c2)[C@@]12CCCO2 ZINC000545547908 940574270 /nfs/dbraw/zinc/57/42/70/940574270.db2.gz LCCKUBKOAXVXJJ-XPNTWCBSSA-N 0 3 414.933 4.409 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(/C=C/c4cnc(C(C)(C)C)s4)n3)cn2)CC1 ZINC000545650686 940578860 /nfs/dbraw/zinc/57/88/60/940578860.db2.gz FSNXGPQKNJILFN-VQHVLOKHSA-N 0 3 424.574 4.198 20 0 HIADHN CCCOc1ccc(/C=C\c2nc(-c3ccc(N4CCCN(C)CC4)nc3)no2)cc1 ZINC000545650785 940578931 /nfs/dbraw/zinc/57/89/31/940578931.db2.gz HEBATQJDSQOVQZ-GHXNOFRVSA-N 0 3 419.529 4.233 20 0 HIADHN Fc1cccc(CN2CCC[C@@H](c3nc(-c4cccnc4N4CCCC4)no3)C2)c1 ZINC000545668270 940579788 /nfs/dbraw/zinc/57/97/88/940579788.db2.gz SSWIWDFJMYVEIF-GOSISDBHSA-N 0 3 407.493 4.251 20 0 HIADHN c1cc(OC2CCC2)cc(-c2noc(-c3ccc(CN4CCSCC4)cc3)n2)n1 ZINC000545804356 940603181 /nfs/dbraw/zinc/60/31/81/940603181.db2.gz YYXDQIYPGPMRML-UHFFFAOYSA-N 0 3 408.527 4.279 20 0 HIADHN Fc1cccc(CN2CCC[C@H](c3nc(-c4ccnc(OCC(F)F)c4)no3)C2)c1 ZINC000545845330 940629455 /nfs/dbraw/zinc/62/94/55/940629455.db2.gz ZYFPPOMMYMVDBZ-INIZCTEOSA-N 0 3 418.419 4.294 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)[C@@H](C)c1c(C)nn(CC(F)(F)F)c1C)c1ccco1 ZINC000563986612 945336465 /nfs/dbraw/zinc/33/64/65/945336465.db2.gz AYYJEKXZECIHPY-HEHGZKQESA-N 0 3 414.472 4.004 20 0 HIADHN CC[C@H](CNC(=O)C(C)(C)Cc1nc2ccccc2[nH]1)N1CCc2ccccc2C1 ZINC000545965879 940666963 /nfs/dbraw/zinc/66/69/63/940666963.db2.gz BXGBBSVDLVBZKT-HXUWFJFHSA-N 0 3 404.558 4.085 20 0 HIADHN CCO[C@@H]1C[C@@H](NCc2cnc(-c3ccc(Br)cc3)s2)[C@@]12CCCO2 ZINC000546058987 940684712 /nfs/dbraw/zinc/68/47/12/940684712.db2.gz JVVDELHBHPWWNF-LMMKCTJWSA-N 0 3 423.376 4.389 20 0 HIADHN CC[C@@H](C)n1ncc2c1nc(C)cc2C(=O)N(CC)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000546183389 940723176 /nfs/dbraw/zinc/72/31/76/940723176.db2.gz FCANNOCYVFFUNU-TZIWHRDSSA-N 0 3 419.573 4.447 20 0 HIADHN Cc1cccc(C)c1[C@@H](C)NCC(=O)Nc1cc(C(F)(F)F)ccc1-n1cncn1 ZINC000546225013 940735086 /nfs/dbraw/zinc/73/50/86/940735086.db2.gz ZGAWERMQGVRBLP-OAHLLOKOSA-N 0 3 417.435 4.192 20 0 HIADHN COCCn1cc2c(n1)[C@H](N[C@@H](C)Cc1ccc(Br)c(F)c1)CCC2 ZINC000546227792 940735630 /nfs/dbraw/zinc/73/56/30/940735630.db2.gz QBKOYCSVUHTUGF-SCLBCKFNSA-N 0 3 410.331 4.029 20 0 HIADHN Cc1noc(C)c1CO[C@@H]1CCN(CCC(=O)Nc2cc(Cl)ccc2Cl)C1 ZINC000546587547 940858739 /nfs/dbraw/zinc/85/87/39/940858739.db2.gz NCJBKOBSWPMJGQ-OAHLLOKOSA-N 0 3 412.317 4.218 20 0 HIADHN CCN1CCN([C@H](C)CNC(=O)c2cc(Cl)ccc2Sc2ccccc2)CC1 ZINC000546797891 940885054 /nfs/dbraw/zinc/88/50/54/940885054.db2.gz MHLJGWJLHMCXOI-QGZVFWFLSA-N 0 3 418.006 4.247 20 0 HIADHN CS(=O)(=O)Cc1ccc(CN[C@@H](Cc2cccnc2)c2ccc(Cl)cc2)cc1 ZINC000546873470 940899190 /nfs/dbraw/zinc/89/91/90/940899190.db2.gz ZJUMPFWWAYALEW-QFIPXVFZSA-N 0 3 414.958 4.353 20 0 HIADHN CC(C)Cc1ccc([C@@H](CNC(=O)[C@@H]2CCc3nc(C(C)C)[nH]c3C2)N(C)C)cc1 ZINC000564030224 945358309 /nfs/dbraw/zinc/35/83/09/945358309.db2.gz VJCNIHBGHNAWDJ-NFBKMPQASA-N 0 3 410.606 4.256 20 0 HIADHN CC(C)C(=O)Nc1cccc(-c2noc([C@H]3CCCN(Cc4cccnc4)C3)n2)c1 ZINC000547004478 940951435 /nfs/dbraw/zinc/95/14/35/940951435.db2.gz PRLAMHBWPMPIHR-IBGZPJMESA-N 0 3 405.502 4.106 20 0 HIADHN COc1ccc(C[C@H](C)CN2CCCN(C(=O)c3ccccc3F)CC2)cc1F ZINC000547014064 940956751 /nfs/dbraw/zinc/95/67/51/940956751.db2.gz SIPRAYHYJJBCCP-KRWDZBQOSA-N 0 3 402.485 4.000 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(C4(c5cccc(Cl)c5)CC4)n3)cn2)CC1 ZINC000547070803 940983121 /nfs/dbraw/zinc/98/31/21/940983121.db2.gz OLNRDDWHNCMALO-UHFFFAOYSA-N 0 3 409.921 4.007 20 0 HIADHN COc1ccc2cc([C@H](C)C(=O)N(CCN(C)C)Cc3cccc(O)c3)ccc2c1 ZINC000547457183 941063790 /nfs/dbraw/zinc/06/37/90/941063790.db2.gz CYOMVWBJSJYYQY-SFHVURJKSA-N 0 3 406.526 4.248 20 0 HIADHN CCN(C(=O)NCc1ncc(-c2ccccc2)o1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000547465598 941064112 /nfs/dbraw/zinc/06/41/12/941064112.db2.gz WHEMWCPCLLUBNT-NRFANRHFSA-N 0 3 404.514 4.148 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCc1nc2cc(Cl)ccc2n1C)c1ccsc1 ZINC000547629180 941069370 /nfs/dbraw/zinc/06/93/70/941069370.db2.gz WJEHOLKFUOZXOD-SFHVURJKSA-N 0 3 419.982 4.171 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCc1nc2cc(Cl)ccc2n1C)c1ccsc1 ZINC000547629179 941069419 /nfs/dbraw/zinc/06/94/19/941069419.db2.gz WJEHOLKFUOZXOD-GOSISDBHSA-N 0 3 419.982 4.171 20 0 HIADHN C[C@H](CN[C@H]1CCS(=O)(=O)c2ccc(Br)cc21)C1CCCCC1 ZINC000548155972 941089617 /nfs/dbraw/zinc/08/96/17/941089617.db2.gz YWJDHFJEPMQQGS-DYVFJYSZSA-N 0 3 400.382 4.474 20 0 HIADHN CC(C)c1c(C(=O)NC[C@@]2(C)CCCN2Cc2ccccc2)cnn1-c1ccccn1 ZINC000548294801 941094196 /nfs/dbraw/zinc/09/41/96/941094196.db2.gz XAEFHKOVLCFPAO-RUZDIDTESA-N 0 3 417.557 4.175 20 0 HIADHN C[C@H](N[C@@H]1CCCc2ncc(C(F)(F)F)cc21)[C@H]1CN(Cc2ccccc2)CCO1 ZINC000548306524 941094967 /nfs/dbraw/zinc/09/49/67/941094967.db2.gz POAAPJKDDMSATB-KNXBSLHKSA-N 0 3 419.491 4.357 20 0 HIADHN C[C@@H](c1ccccc1)n1c(SCCCN2CCN(C)CC2)nnc1-c1ccccc1 ZINC000548475856 941106981 /nfs/dbraw/zinc/10/69/81/941106981.db2.gz CDXHYKCHJFJVBN-FQEVSTJZSA-N 0 3 421.614 4.284 20 0 HIADHN CC[NH+](CC)Cc1cccc([N-]S(=O)(=O)c2ccc(NC(=O)C(C)(C)C)cc2)c1 ZINC000548697584 941120224 /nfs/dbraw/zinc/12/02/24/941120224.db2.gz XRRQZQAIRBESCJ-UHFFFAOYSA-N 0 3 417.575 4.314 20 0 HIADHN Cc1c(NC(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)cnn1-c1ccccc1F ZINC000548957822 941134132 /nfs/dbraw/zinc/13/41/32/941134132.db2.gz UCVHHKVGFLPSMY-IBGZPJMESA-N 0 3 415.900 4.398 20 0 HIADHN Cc1ccc(NC(=O)CN[C@@H]2CCN(C(C)C)[C@@H]2c2ccc(F)c(F)c2)c(F)c1 ZINC000549114129 941161168 /nfs/dbraw/zinc/16/11/68/941161168.db2.gz ULCCMXQRUKCTFV-IFMALSPDSA-N 0 3 405.464 4.164 20 0 HIADHN Cc1cccc(NC(=O)CN[C@@H]2CCN(C(C)C)[C@@H]2c2ccc(F)c(F)c2)c1C ZINC000549113886 941161191 /nfs/dbraw/zinc/16/11/91/941161191.db2.gz UBUCFWONJHCGMR-FYYLOGMGSA-N 0 3 401.501 4.334 20 0 HIADHN CCN1CC[C@H](NCC(=O)Nc2cc(C)ccc2OC)[C@H]1c1ccc(Cl)c(F)c1 ZINC000549113496 941161223 /nfs/dbraw/zinc/16/12/23/941161223.db2.gz PZCLHWJGCDRERN-PGRDOPGGSA-N 0 3 419.928 4.160 20 0 HIADHN CCN1CC[C@@H](NCC(=O)Nc2cccc(C)c2C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000549115386 941161404 /nfs/dbraw/zinc/16/14/04/941161404.db2.gz GWWGQZJGSUYFIQ-IRLDBZIGSA-N 0 3 403.929 4.460 20 0 HIADHN CCN1CC[C@H](NCC(=O)Nc2ccc(C)c(C)c2)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000549117871 941161858 /nfs/dbraw/zinc/16/18/58/941161858.db2.gz YLLPIXJMFJSRKI-UGKGYDQZSA-N 0 3 405.464 4.084 20 0 HIADHN COc1cc(NC(=O)CCN2CCC(C)=C(c3ccco3)C2)c(OC)cc1Cl ZINC000549159864 941167050 /nfs/dbraw/zinc/16/70/50/941167050.db2.gz SEVPRZWOADPUEQ-UHFFFAOYSA-N 0 3 404.894 4.458 20 0 HIADHN COc1ccccc1NC(=O)CN[C@H]1CCN(C(C)C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000549345357 941181574 /nfs/dbraw/zinc/18/15/74/941181574.db2.gz NDFMXIOHQOFJMY-SIKLNZKXSA-N 0 3 419.928 4.240 20 0 HIADHN CCOCCCn1c(-c2ccc(Cl)cc2)nnc1N1CCN(C2CCCC2)CC1 ZINC000549347524 941181716 /nfs/dbraw/zinc/18/17/16/941181716.db2.gz FABOVWBVGKXMSO-UHFFFAOYSA-N 0 3 417.985 4.090 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1cccc(Br)c1Cl ZINC000549368146 941183252 /nfs/dbraw/zinc/18/32/52/941183252.db2.gz KJGWHAMMLBSCRW-UHFFFAOYSA-N 0 3 400.704 4.291 20 0 HIADHN COc1ccc(-c2ccc(C)c(NC(=O)NC[C@H](c3ccccc3)N(C)C)c2)cn1 ZINC000549389962 941185267 /nfs/dbraw/zinc/18/52/67/941185267.db2.gz RJEIMIFAAVRGGY-JOCHJYFZSA-N 0 3 404.514 4.490 20 0 HIADHN Cc1ccc([C@H](CNC(=O)NCc2cc(-c3ccccc3)on2)N2CCCC2)cc1 ZINC000549403141 941186399 /nfs/dbraw/zinc/18/63/99/941186399.db2.gz OPQBFPKZCXXQLC-QFIPXVFZSA-N 0 3 404.514 4.286 20 0 HIADHN c1ncn(-c2ccc(CN(Cc3ccc(OCc4cccnc4)cc3)C3CC3)cc2)n1 ZINC000549404344 941186663 /nfs/dbraw/zinc/18/66/63/941186663.db2.gz OGWKCGXPKMMKFG-UHFFFAOYSA-N 0 3 411.509 4.406 20 0 HIADHN CC(C)N1CC[C@H](NCC(=O)NCc2ccc(Cl)cc2)[C@H]1c1ccc(F)c(F)c1 ZINC000549472344 941193670 /nfs/dbraw/zinc/19/36/70/941193670.db2.gz MTTFFUWKVHRDSM-RBBKRZOGSA-N 0 3 421.919 4.048 20 0 HIADHN CC[C@@H](C)c1nnc(N2CCN(Cc3ccccc3)C(C)(C)C2)n1C[C@H]1CCCO1 ZINC000549473607 941193879 /nfs/dbraw/zinc/19/38/79/941193879.db2.gz NYINAISAAULZNF-TZIWHRDSSA-N 0 3 411.594 4.071 20 0 HIADHN COc1ccc(C)cc1NC(=O)CN[C@H]1CCN(C(C)C)[C@@H]1c1ccc(F)c(F)c1 ZINC000549475051 941194135 /nfs/dbraw/zinc/19/41/35/941194135.db2.gz CBEMRTCSFFRRQH-WMZHIEFXSA-N 0 3 417.500 4.034 20 0 HIADHN CCn1c(CN[C@@H]2CCN(C3CC3)[C@H]2c2cccc(OC)c2)nc2c1cccc2F ZINC000549475378 941194191 /nfs/dbraw/zinc/19/41/91/941194191.db2.gz DFTKVHVGFBZCON-YKSBVNFPSA-N 0 3 408.521 4.272 20 0 HIADHN COCCc1ccc(OC[C@@H](O)CN2CCCC[C@H]2c2cc3ccccc3[nH]2)cc1 ZINC000549527822 941198097 /nfs/dbraw/zinc/19/80/97/941198097.db2.gz VXVSHTILOAWHOJ-OFVILXPXSA-N 0 3 408.542 4.324 20 0 HIADHN Cc1ccc(OC(F)F)c(CNc2ccc(C(=O)NCCN3CCCC3)cc2)c1 ZINC000549686679 941204473 /nfs/dbraw/zinc/20/44/73/941204473.db2.gz DDHLKUUKELGUFR-UHFFFAOYSA-N 0 3 403.473 4.034 20 0 HIADHN CC1CCN(Cc2ccccc2CNS(=O)(=O)Cc2ccc(C(F)F)cc2)CC1 ZINC000549721765 941205643 /nfs/dbraw/zinc/20/56/43/941205643.db2.gz ICSFMLKAPJUNKL-UHFFFAOYSA-N 0 3 422.541 4.476 20 0 HIADHN COc1ccc(F)c(CN[C@@H]2CCN(c3ncc(C(F)(F)F)cc3Cl)C2)c1 ZINC000549780892 941207257 /nfs/dbraw/zinc/20/72/57/941207257.db2.gz WLSIZRJHWVBWJH-CYBMUJFWSA-N 0 3 403.807 4.270 20 0 HIADHN C[C@@H](c1ccc(F)cc1)N1CC[C@@H](N(C)CCCc2cc(-c3ccccc3)n[nH]2)C1=O ZINC000549806322 941207927 /nfs/dbraw/zinc/20/79/27/941207927.db2.gz QMQPAQIRQGOVGG-MHECFPHRSA-N 0 3 420.532 4.442 20 0 HIADHN C[C@H](c1ccc(F)cc1)N1CC[C@@H](N(C)CCCc2cc(-c3ccccc3)n[nH]2)C1=O ZINC000549806320 941207931 /nfs/dbraw/zinc/20/79/31/941207931.db2.gz QMQPAQIRQGOVGG-HOYKHHGWSA-N 0 3 420.532 4.442 20 0 HIADHN NC(=O)C1CCN(Cc2cccc(NC(=O)c3cc(Cl)c(F)cc3Cl)c2)CC1 ZINC000549822321 941208624 /nfs/dbraw/zinc/20/86/24/941208624.db2.gz QLOOBFCQYCZBEO-UHFFFAOYSA-N 0 3 424.303 4.082 20 0 HIADHN CCO[C@@H]1C[C@H](NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1n1cccn1 ZINC000549942562 941243803 /nfs/dbraw/zinc/24/38/03/941243803.db2.gz XAZHJDRXSCGABE-ARFHVFGLSA-N 0 3 407.358 4.429 20 0 HIADHN CC(C)[C@@](C)(Cc1ccc(Cl)cc1)NCc1csc(CS(C)(=O)=O)n1 ZINC000549988289 941260149 /nfs/dbraw/zinc/26/01/49/941260149.db2.gz QXGXVLHTXYUURC-GOSISDBHSA-N 0 3 400.997 4.088 20 0 HIADHN CCOc1ccc(-c2nc(CN[C@H](C)C3CCN(CC(F)(F)F)CC3)co2)cc1 ZINC000550078050 941280766 /nfs/dbraw/zinc/28/07/66/941280766.db2.gz OVHAJIYZUNXEHA-OAHLLOKOSA-N 0 3 411.468 4.493 20 0 HIADHN COc1ccc(F)c(CNC[C@H](c2ccc(C(F)(F)F)cc2)N2CCOCC2)c1 ZINC000550122333 941287033 /nfs/dbraw/zinc/28/70/33/941287033.db2.gz GMMNLLCKUXTANV-HXUWFJFHSA-N 0 3 412.427 4.016 20 0 HIADHN C[C@@H](c1ccc(F)cc1)N1CCC[C@H](NCc2ccc(Oc3cnccn3)cc2)C1=O ZINC000550292749 941310091 /nfs/dbraw/zinc/31/00/91/941310091.db2.gz CBUKGHXVVDRHJT-JTSKRJEESA-N 0 3 420.488 4.250 20 0 HIADHN COc1cc(C(=O)Nc2cc(C)cc(CN(C)C)c2)cc(Br)c1OC ZINC000550303585 941311837 /nfs/dbraw/zinc/31/18/37/941311837.db2.gz HPTDIDDQNAAPQP-UHFFFAOYSA-N 0 3 407.308 4.089 20 0 HIADHN O=C(Nc1cccc(OC[C@@H]2CN(Cc3ccccc3)CCCO2)c1)c1ccco1 ZINC000550823622 941371210 /nfs/dbraw/zinc/37/12/10/941371210.db2.gz YASVMOISDUBTEX-QFIPXVFZSA-N 0 3 406.482 4.202 20 0 HIADHN CC[C@H](N[C@@H]1CCCN([C@@H](C)c2ccc(F)cc2)C1=O)c1ccc2c(c1)OCCO2 ZINC000550894644 941380184 /nfs/dbraw/zinc/38/01/84/941380184.db2.gz ISEPTJYIFMRJSD-ORYQWCPZSA-N 0 3 412.505 4.390 20 0 HIADHN NC(=O)[C@@H](NCCCCc1ccc(Cl)s1)c1cccc(Br)c1 ZINC000551002828 941393391 /nfs/dbraw/zinc/39/33/91/941393391.db2.gz CWCOYZXACIYQLL-HNNXBMFYSA-N 0 3 401.757 4.303 20 0 HIADHN Cc1cccc(C(C)C)c1NC(=O)CN[C@H]1CCN(C)[C@H]1c1ccc(F)c(F)c1 ZINC000551066577 941403939 /nfs/dbraw/zinc/40/39/39/941403939.db2.gz UCRCCOZNMUDIQU-REWPJTCUSA-N 0 3 401.501 4.370 20 0 HIADHN O=C(NC[C@H]1CCCCN1Cc1ccccc1)N1CCC(F)(c2cccnc2)CC1 ZINC000551215790 941429454 /nfs/dbraw/zinc/42/94/54/941429454.db2.gz PVLJJYSYQREZAT-JOCHJYFZSA-N 0 3 410.537 4.107 20 0 HIADHN CN(C)Cc1ccc(S(=O)(=O)N(C)[C@@H](c2ccc(Cl)cc2)C(F)(F)F)cc1 ZINC000551386861 941466823 /nfs/dbraw/zinc/46/68/23/941466823.db2.gz XRMXEAMQKUVVHG-KRWDZBQOSA-N 0 3 420.884 4.326 20 0 HIADHN CCS(=O)(=O)c1ccc([C@H](C)N[C@H](C)CC(=O)Nc2ccc(C)cc2C)cc1 ZINC000551564908 941502448 /nfs/dbraw/zinc/50/24/48/941502448.db2.gz RHUQNZQRFOIXMC-MSOLQXFVSA-N 0 3 402.560 4.165 20 0 HIADHN COc1ccc2c(c1)CCC[C@H]2NCc1cccc(N2C(=O)N[C@](C)(C3CC3)C2=O)c1 ZINC000551572509 941504983 /nfs/dbraw/zinc/50/49/83/941504983.db2.gz ZPTUOFNXNGHGTA-RCZVLFRGSA-N 0 3 419.525 4.087 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1cccnc1OC(C)C ZINC000551648525 941518300 /nfs/dbraw/zinc/51/83/00/941518300.db2.gz XEVWOERYCRNAMK-HXUWFJFHSA-N 0 3 419.529 4.073 20 0 HIADHN Cc1ccc(C(=O)C2CCN(C[C@H]3CN(Cc4ccccc4)CCCO3)CC2)c(C)c1 ZINC000551697998 941528731 /nfs/dbraw/zinc/52/87/31/941528731.db2.gz HTMFSVFSLXFCFF-VWLOTQADSA-N 0 3 420.597 4.489 20 0 HIADHN CCc1nc(C(C)C)ccc1C(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000551750541 941538385 /nfs/dbraw/zinc/53/83/85/941538385.db2.gz RYEJXQQPZZHJTB-KDURUIRLSA-N 0 3 401.595 4.119 20 0 HIADHN CC(C)CO[C@@H]1C[C@H](NCc2cc(C(F)(F)F)cc(S(C)(=O)=O)c2)C1(C)C ZINC000551781146 941544522 /nfs/dbraw/zinc/54/45/22/941544522.db2.gz WOHOAHICVCVHKX-DLBZAZTESA-N 0 3 407.498 4.038 20 0 HIADHN CC(C)CN(Cc1cnc(N2CCN(C)CC2)nc1)[C@H](C)c1ccccc1Cl ZINC000551813087 941550270 /nfs/dbraw/zinc/55/02/70/941550270.db2.gz QWLGHGKVNUHDCA-GOSISDBHSA-N 0 3 401.986 4.101 20 0 HIADHN CNC(=O)COc1cccc(CN[C@@H](C)c2ccc(SCC(F)(F)F)cc2)c1 ZINC000552075496 941580245 /nfs/dbraw/zinc/58/02/45/941580245.db2.gz ZJHASQOGUQJSKR-AWEZNQCLSA-N 0 3 412.477 4.317 20 0 HIADHN FC(F)(F)[C@H](CN[C@H]1CCCc2nc(-c3ccccc3)sc21)N1CCOCC1 ZINC000552097197 941584277 /nfs/dbraw/zinc/58/42/77/941584277.db2.gz WFXPDFWJBJEIPQ-RDJZCZTQSA-N 0 3 411.493 4.040 20 0 HIADHN C[C@H](Cc1cccc(C(F)(F)F)c1)C(=O)N(C)CCCN(C)Cc1ccncc1 ZINC000552112506 941587451 /nfs/dbraw/zinc/58/74/51/941587451.db2.gz GRMCFLCNHKGKRZ-QGZVFWFLSA-N 0 3 407.480 4.260 20 0 HIADHN Cc1ccc(C2CCN(C(=O)[C@@H]3CN(Cc4ccccc4)CCC3(F)F)CC2)cn1 ZINC000552142005 941592629 /nfs/dbraw/zinc/59/26/29/941592629.db2.gz FOKNUJJIAFHPIY-QFIPXVFZSA-N 0 3 413.512 4.253 20 0 HIADHN O=C(c1cc(Br)ccc1F)N1CCN(c2ccnc3ccccc32)CC1 ZINC000552148615 941593622 /nfs/dbraw/zinc/59/36/22/941593622.db2.gz WHTBGOJRTWIJQP-UHFFFAOYSA-N 0 3 414.278 4.099 20 0 HIADHN Cc1oc(-c2cccs2)nc1CC(=O)N1CCN(c2ccnc3ccccc32)CC1 ZINC000552148541 941593861 /nfs/dbraw/zinc/59/38/61/941593861.db2.gz POGUIMKKKQQFFX-UHFFFAOYSA-N 0 3 418.522 4.151 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)CCc1nc(-c2ccco2)no1)c1ccc(Cl)cc1 ZINC000552242334 941611528 /nfs/dbraw/zinc/61/15/28/941611528.db2.gz XAYCQHCAWUKNKI-KRWDZBQOSA-N 0 3 416.909 4.115 20 0 HIADHN COc1ccc([C@H](C)N[C@@H]2CCCN(c3ccc(F)cc3C)C2=O)c(C)c1OC ZINC000552252617 941614611 /nfs/dbraw/zinc/61/46/11/941614611.db2.gz RQVWYZQDYRFCQA-QFBILLFUSA-N 0 3 400.494 4.306 20 0 HIADHN CCOc1cc(C[NH2+][C@@H](C)COc2ccc(F)cc2F)cc(Br)c1[O-] ZINC000552295465 941624648 /nfs/dbraw/zinc/62/46/48/941624648.db2.gz LEJWXIQFIKXDFU-NSHDSACASA-N 0 3 416.262 4.389 20 0 HIADHN C[C@H](Cn1cc(Br)cn1)N[C@@H](CCO)c1ccc(Cl)c(Cl)c1 ZINC000552342545 941638769 /nfs/dbraw/zinc/63/87/69/941638769.db2.gz OCSKAONNQOPKKU-BMIGLBTASA-N 0 3 407.139 4.054 20 0 HIADHN CCC(C)(C)C1CCC2(C[C@@H]2C(=O)N2CC[C@H](N3CCN(C(C)C)CC3)C2)CC1 ZINC000552354577 941642713 /nfs/dbraw/zinc/64/27/13/941642713.db2.gz JNJNIWLZWTXRKW-ZKKFKWFVSA-N 0 3 403.655 4.246 20 0 HIADHN Cc1ccc(OCc2cccc(C(=O)N(C)CCCN(C)Cc3ccco3)c2)cn1 ZINC000552393358 941655228 /nfs/dbraw/zinc/65/52/28/941655228.db2.gz UUYRXQYEERWDIV-UHFFFAOYSA-N 0 3 407.514 4.156 20 0 HIADHN COc1ccc(-c2cnc(CCC(=O)NCCN3CC=C(C(C)(C)C)CC3)o2)cc1 ZINC000552460105 941676096 /nfs/dbraw/zinc/67/60/96/941676096.db2.gz ZUIAHZOBXVRVKL-UHFFFAOYSA-N 0 3 411.546 4.077 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)[C@H]1C[C@@H]1c1cccc(Cl)c1Cl ZINC000552515909 941692462 /nfs/dbraw/zinc/69/24/62/941692462.db2.gz CTJJUGCPVQGGQF-JQHSSLGASA-N 0 3 405.325 4.302 20 0 HIADHN C[C@@H](NCc1ccc(S(=O)(=O)N(C)C)cc1)c1ccc(SCC(F)F)cc1 ZINC000552536449 941700740 /nfs/dbraw/zinc/70/07/40/941700740.db2.gz FOQUUABULANWKN-CQSZACIVSA-N 0 3 414.543 4.145 20 0 HIADHN CCCN(C)[C@H](CNC(=O)c1ccc(C(=O)NC2CC2)cc1)c1ccc(Cl)cc1 ZINC000552582066 941712916 /nfs/dbraw/zinc/71/29/16/941712916.db2.gz VTOZCFKZLSEDMM-OAQYLSRUSA-N 0 3 413.949 4.045 20 0 HIADHN CO[C@H]1CCC[C@@H](C(=O)N(Cc2ccccc2Br)C2CCN(C)CC2)C1 ZINC000552748252 941751255 /nfs/dbraw/zinc/75/12/55/941751255.db2.gz ORHXLUSURWNWQQ-APWZRJJASA-N 0 3 423.395 4.077 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)c2cccc(OCc3cccs3)c2)cc1 ZINC000552817236 941775931 /nfs/dbraw/zinc/77/59/31/941775931.db2.gz HSMYMFGFVPGKJL-QFIPXVFZSA-N 0 3 410.539 4.368 20 0 HIADHN O=C(Cc1ccccc1O)N(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000552851270 941787647 /nfs/dbraw/zinc/78/76/47/941787647.db2.gz RFHPSEZRUKNDPN-XMMPIXPASA-N 0 3 415.537 4.023 20 0 HIADHN CN(CC(F)(F)F)C(=O)N(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000552851003 941787706 /nfs/dbraw/zinc/78/77/06/941787706.db2.gz GIJFDGVGRRSPGN-HXUWFJFHSA-N 0 3 420.479 4.162 20 0 HIADHN CS(=O)(=O)CCCN[C@@H](Cc1cccc(F)c1)c1ccc(Cl)c(Cl)c1 ZINC000552904868 941800713 /nfs/dbraw/zinc/80/07/13/941800713.db2.gz ZQNXUYWUNCQIBJ-SFHVURJKSA-N 0 3 404.334 4.441 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)c1ccncc1Br)c1ccc(Cl)cc1 ZINC000553027238 941819584 /nfs/dbraw/zinc/81/95/84/941819584.db2.gz SBJBMQVZDVBKLT-KRWDZBQOSA-N 0 3 410.743 4.310 20 0 HIADHN C[C@@H](N[C@@H](C)c1cccc(N2CCCC2)c1)C(=O)Nc1ccc(N2CCCC2=O)cc1 ZINC000553076115 941829007 /nfs/dbraw/zinc/82/90/07/941829007.db2.gz DWODYYKXAYXSRH-RBUKOAKNSA-N 0 3 420.557 4.091 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)C[C@H](c1ncc[nH]1)c1ccccc1 ZINC000553143241 941839994 /nfs/dbraw/zinc/83/99/94/941839994.db2.gz DFLLRTJGWWBSOH-REWPJTCUSA-N 0 3 402.542 4.055 20 0 HIADHN Cc1nn(-c2ccccc2C)c2sc(C(=O)N3C[C@@H](N4CCCC4)C[C@@H]3C)cc12 ZINC000553168237 941843590 /nfs/dbraw/zinc/84/35/90/941843590.db2.gz CJBOKELYYPEYKI-WMZOPIPTSA-N 0 3 408.571 4.403 20 0 HIADHN C[C@H](C(=O)N(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1)C(C)(F)F ZINC000553196101 941847474 /nfs/dbraw/zinc/84/74/74/941847474.db2.gz CTAWYTMNHGWZSR-WIYYLYMNSA-N 0 3 401.501 4.366 20 0 HIADHN Cc1cccc(C)c1NC(=O)CNC(=O)[C@@H](C)N[C@@H](c1ccc(Cl)cc1)C(C)C ZINC000553368179 941873748 /nfs/dbraw/zinc/87/37/48/941873748.db2.gz USLCTNMTQXQVLY-DYESRHJHSA-N 0 3 415.965 4.387 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(Cl)cc2)CC1)c1cnc2ccccc2c1 ZINC000553482221 941892856 /nfs/dbraw/zinc/89/28/56/941892856.db2.gz WMNCHWVEKFJEIX-UHFFFAOYSA-N 0 3 409.917 4.161 20 0 HIADHN Cc1ccc(S[C@H](C)C(=O)N2CCC[C@H](c3n[nH]cc3CN3CCCC3)C2)cc1 ZINC000553512605 941899921 /nfs/dbraw/zinc/89/99/21/941899921.db2.gz GEFXELHGRFQDAK-MOPGFXCFSA-N 0 3 412.603 4.201 20 0 HIADHN C[C@H]1CN(C(=O)c2ccccc2CN(C)C)C[C@H](c2cccc(C(F)(F)F)c2)O1 ZINC000553722151 941952524 /nfs/dbraw/zinc/95/25/24/941952524.db2.gz GCIMFELXBBYLCU-MGPUTAFESA-N 0 3 406.448 4.369 20 0 HIADHN C[C@H]1C[C@H]1N1CCN(C(=O)c2cc(NC(=O)NC(C)(C)C)ccc2Cl)C[C@@H](C)C1 ZINC000553767784 941963139 /nfs/dbraw/zinc/96/31/39/941963139.db2.gz JYARFPZWTDGSRN-YZVOILCLSA-N 0 3 420.985 4.062 20 0 HIADHN CCOc1ccc(-c2nc(CC)c(C(=O)N3CC[C@H](N4CCCC4)[C@H]3C)s2)cc1 ZINC000553775502 941965335 /nfs/dbraw/zinc/96/53/35/941965335.db2.gz XCRLGBWCOAEBQN-UZLBHIALSA-N 0 3 413.587 4.470 20 0 HIADHN C[C@H]1C[C@@H]1N1CCN(C(=O)c2ccc(Br)cc2C(F)(F)F)C[C@@H](C)C1 ZINC000553781484 941967199 /nfs/dbraw/zinc/96/71/99/941967199.db2.gz AAMWFNZBOBUXAJ-MKBNYLNASA-N 0 3 419.285 4.270 20 0 HIADHN C[C@@H]1C[C@H]1N1CCN(C(=O)c2ccc(Br)cc2C(F)(F)F)C[C@@H](C)C1 ZINC000553781483 941967236 /nfs/dbraw/zinc/96/72/36/941967236.db2.gz AAMWFNZBOBUXAJ-HWWQOWPSSA-N 0 3 419.285 4.270 20 0 HIADHN CCN1CCN(CCC(=O)N[C@H](c2ccccc2)c2ccc3ccccc3c2)CC1 ZINC000553786490 941968521 /nfs/dbraw/zinc/96/85/21/941968521.db2.gz JKBCGHYYXUPYKX-AREMUKBSSA-N 0 3 401.554 4.073 20 0 HIADHN Cc1nc2cc(C(=O)N3CCN([C@@H]4C[C@@H]4C)C[C@H](C)C3)ccc2n1Cc1ccsc1 ZINC000553784137 941968602 /nfs/dbraw/zinc/96/86/02/941968602.db2.gz MVSCXXMWAYDZBZ-HKARXFIJSA-N 0 3 422.598 4.257 20 0 HIADHN O=C(Nc1ccccc1NC(=O)N1CCCC1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000553807826 941973933 /nfs/dbraw/zinc/97/39/33/941973933.db2.gz PQEJGXNJTHQPQM-LJQANCHMSA-N 0 3 424.520 4.304 20 0 HIADHN COC(=O)c1cn(C2CCN(Cc3cccc(SCc4ccccc4)c3)CC2)nn1 ZINC000553907999 941995945 /nfs/dbraw/zinc/99/59/45/941995945.db2.gz TXDYZQVVHHIGAF-UHFFFAOYSA-N 0 3 422.554 4.194 20 0 HIADHN Cc1nc(-c2c[nH]c(C(=O)NC[C@H](c3ccc(OC(C)C)cc3)N(C)C)c2)cs1 ZINC000554016676 942019864 /nfs/dbraw/zinc/01/98/64/942019864.db2.gz JNVNYRNFFUVKEH-OAQYLSRUSA-N 0 3 412.559 4.267 20 0 HIADHN CC1CCN([C@H](CN2C(=O)[C@@H]3c4ccccc4CCN3C2=O)c2cccs2)CC1 ZINC000554034947 942022774 /nfs/dbraw/zinc/02/27/74/942022774.db2.gz PZLVWIBGASOFBU-CTNGQTDRSA-N 0 3 409.555 4.083 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](NC[C@H]2CCCSC2)c2ccc(F)c(F)c2)c1 ZINC000554068436 942028984 /nfs/dbraw/zinc/02/89/84/942028984.db2.gz COTUSWMMFVOFAY-VLIAUNLRSA-N 0 3 411.539 4.191 20 0 HIADHN CC(C)Cc1ccc([C@@H](CNC(=O)Cc2csc(-c3ccccn3)n2)N(C)C)cc1 ZINC000554078118 942031395 /nfs/dbraw/zinc/03/13/95/942031395.db2.gz DMVBNWOXWOKULX-JOCHJYFZSA-N 0 3 422.598 4.365 20 0 HIADHN CC(C)Cc1ccc([C@H](CNC(=O)CCc2nnc(-c3ccccc3)o2)N(C)C)cc1 ZINC000554084717 942033439 /nfs/dbraw/zinc/03/34/39/942033439.db2.gz XAIDQAFGXRXLEE-QFIPXVFZSA-N 0 3 420.557 4.287 20 0 HIADHN CCc1nc(-c2ccc(Cl)cc2)[nH]c1C(=O)N1CCN([C@@H]2C[C@H]2C)C[C@H](C)C1 ZINC000554113342 942039247 /nfs/dbraw/zinc/03/92/47/942039247.db2.gz MMESCRWTMJPGGS-QMTMVMCOSA-N 0 3 400.954 4.095 20 0 HIADHN COc1cccc(Cl)c1-c1noc(C)c1C(=O)N1CCN([C@@H]2C[C@H]2C)C[C@@H](C)C1 ZINC000554128435 942043628 /nfs/dbraw/zinc/04/36/28/942043628.db2.gz KGRDNNNEDXTBCY-CKEIUWERSA-N 0 3 417.937 4.114 20 0 HIADHN CSCc1ccc(CNC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cc1 ZINC000554144948 942049024 /nfs/dbraw/zinc/04/90/24/942049024.db2.gz MWRABZUKOKIMGM-UHFFFAOYSA-N 0 3 415.525 4.154 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1ccccc1N1C[C@@H](C)O[C@H](C)C1)c1ccco1 ZINC000554150050 942050708 /nfs/dbraw/zinc/05/07/08/942050708.db2.gz HFXGCRBVKBYPFW-JRBPQWBISA-N 0 3 414.550 4.144 20 0 HIADHN CN(CC(=O)Nc1ccc(NC(=O)c2cccs2)cc1)C1CCC(F)(F)CC1 ZINC000554309791 942098451 /nfs/dbraw/zinc/09/84/51/942098451.db2.gz VSSQHSRFXLTSQW-UHFFFAOYSA-N 0 3 407.486 4.449 20 0 HIADHN CN(C)C[C@H](NC(=O)Nc1cccc(Cl)c1-n1cccn1)c1ccc(F)cc1 ZINC000554396661 942125196 /nfs/dbraw/zinc/12/51/96/942125196.db2.gz LDIAOFFIRDXEKG-SFHVURJKSA-N 0 3 401.873 4.089 20 0 HIADHN CCCN(C)[C@H](CNC(=O)Nc1ccc2c(c1)CCC(=O)N2)c1ccc(Cl)cc1 ZINC000554403102 942128391 /nfs/dbraw/zinc/12/83/91/942128391.db2.gz LHJSZDDDYSAYPG-HXUWFJFHSA-N 0 3 414.937 4.429 20 0 HIADHN C[C@H](NC(=O)Nc1cccc(C(=O)N2CCCCC2)c1)[C@H](c1ccccc1)N(C)C ZINC000554418786 942134896 /nfs/dbraw/zinc/13/48/96/942134896.db2.gz FZWPQXITOWBLOU-PGRDOPGGSA-N 0 3 408.546 4.126 20 0 HIADHN Cc1ccc(NC(=O)N[C@H](CN(C)C)c2ccc(F)cc2)c(OCC(F)(F)F)c1 ZINC000554435954 942142734 /nfs/dbraw/zinc/14/27/34/942142734.db2.gz ZGAKGFWEBYZVKE-QGZVFWFLSA-N 0 3 413.415 4.500 20 0 HIADHN CCOC(=O)Cn1ccc2cc(NC(=O)N[C@@H](C)[C@H](c3ccccc3)N(C)C)ccc21 ZINC000554440683 942143675 /nfs/dbraw/zinc/14/36/75/942143675.db2.gz CEBDGBLIDVLQIQ-GAJHUEQPSA-N 0 3 422.529 4.017 20 0 HIADHN O=C(Nc1ccc([C@H]2CCOC2)cc1)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000554620426 942177991 /nfs/dbraw/zinc/17/79/91/942177991.db2.gz YPZJKLXOPTUZMP-PZJWPPBQSA-N 0 3 400.469 4.286 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)c1nn(-c2ccccc2C)c2c1CCC2)c1ccco1 ZINC000554632023 942180979 /nfs/dbraw/zinc/18/09/79/942180979.db2.gz JNGNLOONEZHMDI-PKOBYXMFSA-N 0 3 406.530 4.122 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)c1ccc(OC2CCCC2)c(OC)c1)c1ccco1 ZINC000554634398 942182044 /nfs/dbraw/zinc/18/20/44/942182044.db2.gz YCSNDCATMYLATH-LPHOPBHVSA-N 0 3 400.519 4.469 20 0 HIADHN CCN(CC)C(=O)c1cccc(NC(=O)CN(C)[C@H]2CC[C@@H](C(F)(F)F)CC2)c1 ZINC000554745353 942218182 /nfs/dbraw/zinc/21/81/82/942218182.db2.gz IXXLCYPQMMCTHY-MAEOIBBWSA-N 0 3 413.484 4.160 20 0 HIADHN O=C(c1ccncc1)N1CCC(NCc2csc(-c3ccc(Cl)cc3)n2)CC1 ZINC000554790658 942239399 /nfs/dbraw/zinc/23/93/99/942239399.db2.gz CFSNYYGYZUOHTP-UHFFFAOYSA-N 0 3 412.946 4.253 20 0 HIADHN CN(C)c1noc([C@@H]2CCCN(CCOC(c3ccccc3)c3ccccc3)C2)n1 ZINC000554830279 942269026 /nfs/dbraw/zinc/26/90/26/942269026.db2.gz LGIHOUSZPTVFKS-OAQYLSRUSA-N 0 3 406.530 4.121 20 0 HIADHN CCOc1c(Cl)cc(CNC[C@@H](O)CO[C@@H]2CCCc3ccccc32)cc1OC ZINC000554831634 942270534 /nfs/dbraw/zinc/27/05/34/942270534.db2.gz WTTNSUGNQZLFRM-WIYYLYMNSA-N 0 3 419.949 4.292 20 0 HIADHN CC(C)C(=O)Nc1cccc(NC(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)c1 ZINC000554862801 942295868 /nfs/dbraw/zinc/29/58/68/942295868.db2.gz ADRLURWDWLNHRB-LJQANCHMSA-N 0 3 402.926 4.359 20 0 HIADHN CCOC(=O)c1ccn(-c2cccc(CNCc3cccc4c3OC(C)(C)C4)c2)n1 ZINC000554884313 942307479 /nfs/dbraw/zinc/30/74/79/942307479.db2.gz YQJOEACWTVCGEF-UHFFFAOYSA-N 0 3 405.498 4.052 20 0 HIADHN CC(=O)N1CCCc2cc(NC(=O)N[C@@H](CN(C)C)c3ccc(Cl)cc3)ccc21 ZINC000554907943 942314773 /nfs/dbraw/zinc/31/47/73/942314773.db2.gz FDYZYFXOPICTNA-FQEVSTJZSA-N 0 3 414.937 4.064 20 0 HIADHN Cc1nn(-c2ccccn2)c(C)c1CNCCNc1ncc(C(F)(F)F)cc1Cl ZINC000554924695 942321580 /nfs/dbraw/zinc/32/15/80/942321580.db2.gz FBHLTNPWLOGGNT-UHFFFAOYSA-N 0 3 424.858 4.153 20 0 HIADHN CC(C)[C@H](NC(=O)CN[C@@H]1c2ccccc2CC12CCOCC2)c1ccc(F)cc1 ZINC000554972577 942338782 /nfs/dbraw/zinc/33/87/82/942338782.db2.gz LHEDFBKIFXQTCJ-BJKOFHAPSA-N 0 3 410.533 4.323 20 0 HIADHN C[C@@H](CNC(=O)Nc1ccc(Oc2ccc(Cl)cc2)cc1)CN1CCN(C)CC1 ZINC000555012437 942356002 /nfs/dbraw/zinc/35/60/02/942356002.db2.gz ZSCXXAXCOZVCBF-KRWDZBQOSA-N 0 3 416.953 4.137 20 0 HIADHN CC(C)c1noc(Cc2ccc(NC(=O)N3CCN(C4CCCCC4)CC3)cc2)n1 ZINC000555046913 942369556 /nfs/dbraw/zinc/36/95/56/942369556.db2.gz HCJWLLBAADAHKV-UHFFFAOYSA-N 0 3 411.550 4.266 20 0 HIADHN COC(=O)c1ccc(C)c(NC(=O)CN[C@@H](c2cccc(C(F)(F)F)c2)C2CC2)c1 ZINC000555071282 942376671 /nfs/dbraw/zinc/37/66/71/942376671.db2.gz QHJPROTZPDBAFX-HXUWFJFHSA-N 0 3 420.431 4.480 20 0 HIADHN CCc1ccccc1NC(=O)CN[C@H]1CCN(CC)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000555124918 942392051 /nfs/dbraw/zinc/39/20/51/942392051.db2.gz CQWPZKQFYCVMMJ-SIKLNZKXSA-N 0 3 405.464 4.030 20 0 HIADHN CC[C@@H]1CCCCN1C(=O)[C@H](C)N[C@H]1CCN(CC)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000555125942 942392486 /nfs/dbraw/zinc/39/24/86/942392486.db2.gz SCBKMVDVROMGJQ-RPQWFQIESA-N 0 3 411.512 4.008 20 0 HIADHN CCN1CC[C@@H](NCC(=O)Nc2cc(C)ccc2C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000555132448 942396467 /nfs/dbraw/zinc/39/64/67/942396467.db2.gz ISPKUBRYHFPAJD-KNQAVFIVSA-N 0 3 403.929 4.460 20 0 HIADHN COc1cc(C)c([C@H](C)NC(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)cc1OC ZINC000555132527 942397684 /nfs/dbraw/zinc/39/76/84/942397684.db2.gz VYKVQJBBXJPZNG-HNAYVOBHSA-N 0 3 419.953 4.329 20 0 HIADHN COc1cccc([C@@H]2[C@@H](NCC(=O)Nc3cc(Cl)ccc3C)CCN2C2CC2)c1 ZINC000555133533 942397744 /nfs/dbraw/zinc/39/77/44/942397744.db2.gz UJMIIZZRPYSOSV-NZQKXSOJSA-N 0 3 413.949 4.163 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)N[C@@H](c1cccc(C(F)(F)F)c1)C1CC1 ZINC000555251633 942446927 /nfs/dbraw/zinc/44/69/27/942446927.db2.gz FNVOLXGVTGENHG-HXUWFJFHSA-N 0 3 420.479 4.325 20 0 HIADHN Cc1ccc(CN(CCO)Cc2ccc(Br)s2)c(-c2ccnn2C)c1 ZINC000555340456 942484873 /nfs/dbraw/zinc/48/48/73/942484873.db2.gz IAMWJURTYGEVPI-UHFFFAOYSA-N 0 3 420.376 4.214 20 0 HIADHN C[C@@H](c1ccccc1F)N1CCC[C@@H](NCc2ccc(Oc3cnccn3)cc2)C1=O ZINC000555607164 942666653 /nfs/dbraw/zinc/66/66/53/942666653.db2.gz WTRSPRYFRHBOOY-HTAPYJJXSA-N 0 3 420.488 4.250 20 0 HIADHN O=C(CN1CC[C@@H](CC2CC2)C1)N(Cc1nnc(-c2ccccc2Cl)o1)C1CC1 ZINC000555696587 942703349 /nfs/dbraw/zinc/70/33/49/942703349.db2.gz HTGHCGQOLXSXRD-INIZCTEOSA-N 0 3 414.937 4.003 20 0 HIADHN COc1cc([C@@H](C)N[C@H]2CCc3sc(Br)cc32)ccc1OCCO ZINC000556060479 942799171 /nfs/dbraw/zinc/79/91/71/942799171.db2.gz IFLCTTGMISIUFD-RISCZKNCSA-N 0 3 412.349 4.228 20 0 HIADHN C[C@H](N[C@H]1CCCc2cc(S(N)(=O)=O)ccc21)c1ccc(-c2ccncc2)cc1 ZINC000556079411 942802237 /nfs/dbraw/zinc/80/22/37/942802237.db2.gz MKKMDKNGFYBDEJ-HJPURHCSSA-N 0 3 407.539 4.124 20 0 HIADHN CCOc1ccccc1[C@@H](CC(C)C)N[C@H]1CCCc2cc(S(N)(=O)=O)ccc21 ZINC000556078863 942802298 /nfs/dbraw/zinc/80/22/98/942802298.db2.gz ANLXTCVMANQFOD-FCHUYYIVSA-N 0 3 416.587 4.487 20 0 HIADHN Clc1cccc(CN2CCCC[C@@H]2CN[C@H](c2cccs2)c2nnc[nH]2)c1 ZINC000556094474 942804520 /nfs/dbraw/zinc/80/45/20/942804520.db2.gz XZDQGBPESBZIPG-IEBWSBKVSA-N 0 3 401.967 4.253 20 0 HIADHN NS(=O)(=O)c1ccc2c(c1)CCC[C@@H]2NCc1ccc(COc2ccccc2)cc1 ZINC000556103619 942805959 /nfs/dbraw/zinc/80/59/59/942805959.db2.gz FWRUHDRPWDFMNH-DEOSSOPVSA-N 0 3 422.550 4.080 20 0 HIADHN C[C@@H](NCc1nnc(-c2ccc(Cl)cc2)o1)C1CCN(CC(F)(F)F)CC1 ZINC000556124352 942808007 /nfs/dbraw/zinc/80/80/07/942808007.db2.gz DNIVBEYYJJUNPY-GFCCVEGCSA-N 0 3 402.848 4.142 20 0 HIADHN CC(C)c1ccccc1NC(=O)[C@H](C)N[C@@H]1CCN(C)[C@@H]1c1ccc(F)c(F)c1 ZINC000556126826 942808103 /nfs/dbraw/zinc/80/81/03/942808103.db2.gz WTVYYXRGGOEVCS-ITEAAPOESA-N 0 3 401.501 4.450 20 0 HIADHN Cc1cccc(C)c1OC[C@H](N[C@H]1CCC[C@H](S(C)(=O)=O)C1)c1ccccc1 ZINC000556263042 942828013 /nfs/dbraw/zinc/82/80/13/942828013.db2.gz XAUAYFMMBZVNCN-FKBYEOEOSA-N 0 3 401.572 4.369 20 0 HIADHN Cc1cccc(C)c1OC[C@H](N[C@@H]1CCC[C@H](S(C)(=O)=O)C1)c1ccccc1 ZINC000556263044 942828128 /nfs/dbraw/zinc/82/81/28/942828128.db2.gz XAUAYFMMBZVNCN-FSSWDIPSSA-N 0 3 401.572 4.369 20 0 HIADHN O=C(CN1CCCN(Cc2ccccc2)CC1)Nc1nc(-c2cccs2)cs1 ZINC000556291906 942834066 /nfs/dbraw/zinc/83/40/66/942834066.db2.gz FQRSPLHVUHXTLD-UHFFFAOYSA-N 0 3 412.584 4.018 20 0 HIADHN C(=Cc1ccccc1)c1nc(SC[C@@H]2CN(Cc3ccccc3)CCCO2)n[nH]1 ZINC000556314616 942839366 /nfs/dbraw/zinc/83/93/66/942839366.db2.gz KZEWCWUIBCEHSD-IWGBCORSSA-N 0 3 406.555 4.358 20 0 HIADHN COc1ccccc1[C@@H](NC(=O)N1CCN(C2CCC(C)CC2)CC1)c1ccccn1 ZINC000556332212 942843674 /nfs/dbraw/zinc/84/36/74/942843674.db2.gz OWGDLFHTHJFXEB-ZSHKSDETSA-N 0 3 422.573 4.086 20 0 HIADHN Clc1cc(CNCc2cccc(I)c2)cc2c1OCCO2 ZINC000556385821 942854282 /nfs/dbraw/zinc/85/42/82/942854282.db2.gz JPCOIYPDUZYXCP-UHFFFAOYSA-N 0 3 415.658 4.006 20 0 HIADHN Cc1cc(CNCc2cccc(N3C(=O)N[C@](C)(C4CC4)C3=O)c2)cc2cccnc12 ZINC000556411734 942859688 /nfs/dbraw/zinc/85/96/88/942859688.db2.gz IGJDBJXJUBWBTI-RUZDIDTESA-N 0 3 414.509 4.058 20 0 HIADHN Fc1ccc([C@H]2CN(C[C@H]3CN(Cc4ccccc4)CCCO3)CCO2)cc1Cl ZINC000556498053 942884829 /nfs/dbraw/zinc/88/48/29/942884829.db2.gz UZGVOUNXMJEBKP-NFBKMPQASA-N 0 3 418.940 4.144 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)c2cc(C)cc(C)c2Br)cc1 ZINC000556587300 942907486 /nfs/dbraw/zinc/90/74/86/942907486.db2.gz ALZGMSCBKRWMOS-SFHVURJKSA-N 0 3 405.336 4.107 20 0 HIADHN Cc1cc([C@H](C)NCc2ccc(C(=O)N3CCOCC3)cc2)sc1Br ZINC000556815666 942935329 /nfs/dbraw/zinc/93/53/29/942935329.db2.gz SBBNEPCEYXVISX-AWEZNQCLSA-N 0 3 423.376 4.142 20 0 HIADHN O[C@H](CN[C@H]1CCOc2c(Cl)cccc21)COc1ccc(Cl)cc1Cl ZINC000556859920 942942382 /nfs/dbraw/zinc/94/23/82/942942382.db2.gz QVOFZTVKFPCLDE-WBMJQRKESA-N 0 3 402.705 4.500 20 0 HIADHN CO[C@@H]1C[C@@H](c2ccccc2)CC[C@@H]1NCC(=O)Nc1nc(-c2ccco2)cs1 ZINC000556875382 942946830 /nfs/dbraw/zinc/94/68/30/942946830.db2.gz AKBOKXCJTULEOO-ABSDTBQOSA-N 0 3 411.527 4.283 20 0 HIADHN OC[C@@H](CN[C@H](c1ncc[nH]1)C1CCCCC1)Cc1ccccc1Br ZINC000556880097 942949112 /nfs/dbraw/zinc/94/91/12/942949112.db2.gz JFIIRURULOBPLG-BEFAXECRSA-N 0 3 406.368 4.234 20 0 HIADHN COc1ccc([C@@H](Cc2ccncc2)NCc2ccc(C)cc2N2CCOCC2)cc1 ZINC000556886656 942951031 /nfs/dbraw/zinc/95/10/31/942951031.db2.gz ZRZLTDMSYNQTQH-RUZDIDTESA-N 0 3 417.553 4.309 20 0 HIADHN C[C@H](NC(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F)c1cccc(-n2cccn2)c1 ZINC000556892566 942954340 /nfs/dbraw/zinc/95/43/40/942954340.db2.gz KQEWGPOZTKPHQV-PGRDOPGGSA-N 0 3 424.495 4.207 20 0 HIADHN CC[C@H](NCc1ccc2[nH]c(C)cc2c1)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000556897449 942957096 /nfs/dbraw/zinc/95/70/96/942957096.db2.gz LSIDJSJPMQPURI-SFHVURJKSA-N 0 3 405.951 4.279 20 0 HIADHN O=C(NCc1csc(-c2ccco2)n1)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000556919979 942966236 /nfs/dbraw/zinc/96/62/36/942966236.db2.gz RQTQVJGRKGDHMI-QGZVFWFLSA-N 0 3 417.481 4.177 20 0 HIADHN C[C@@H](Cn1ccc2ccccc21)C(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000556922410 942967171 /nfs/dbraw/zinc/96/71/71/942967171.db2.gz KLPVEJUJKYICTD-PWRODBHTSA-N 0 3 411.590 4.015 20 0 HIADHN Cc1cc(NC(=O)c2nc(C3CC3)oc2C)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000556939263 942974780 /nfs/dbraw/zinc/97/47/80/942974780.db2.gz GOOOYMTVESMUTK-IBGZPJMESA-N 0 3 405.502 4.065 20 0 HIADHN O=C([C@@H]1CN(Cc2ccccc2)CCC1(F)F)N1CC[C@@H](COc2ccccc2)C1 ZINC000556967256 942981890 /nfs/dbraw/zinc/98/18/90/942981890.db2.gz YZHTWXNZNFFESH-IRLDBZIGSA-N 0 3 414.496 4.071 20 0 HIADHN CCOCCCn1c([C@@H](CC)c2ccccc2)nnc1N1CCN(C)[C@@H](C(C)C)C1 ZINC000556990218 942988913 /nfs/dbraw/zinc/98/89/13/942988913.db2.gz LHTRZAYHZCSXEZ-FCHUYYIVSA-N 0 3 413.610 4.023 20 0 HIADHN O[C@@H](CN[C@@H]1CCSc2ccc(F)cc21)COc1ccc(Br)cc1 ZINC000557014776 942995031 /nfs/dbraw/zinc/99/50/31/942995031.db2.gz XBOYVKOYDMCKAF-WMLDXEAASA-N 0 3 412.324 4.155 20 0 HIADHN C[C@@H](CC(=O)N1CC[C@]2(CCN(Cc3ccccc3)C2)C1)C(=O)c1cccc(F)c1 ZINC000557127528 943026196 /nfs/dbraw/zinc/02/61/96/943026196.db2.gz PUZYWKZUJAEYPM-DFBJGRDBSA-N 0 3 408.517 4.159 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)N[C@H](c1ccccc1)[C@@H]1CCOC1 ZINC000557228328 943056271 /nfs/dbraw/zinc/05/62/71/943056271.db2.gz RHRQFHXTCOCICR-IFMALSPDSA-N 0 3 415.965 4.191 20 0 HIADHN CC(C)C[C@@H](NCc1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1)c1cccs1 ZINC000557271816 943064295 /nfs/dbraw/zinc/06/42/95/943064295.db2.gz FLQBIUPIMPASJY-AZUAARDMSA-N 0 3 422.616 4.082 20 0 HIADHN Cc1nn(C(C)C)c(C)c1CC(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1 ZINC000557434234 943124216 /nfs/dbraw/zinc/12/42/16/943124216.db2.gz KWWSWLHIABUZSI-FQEVSTJZSA-N 0 3 402.608 4.274 20 0 HIADHN COCCC[C@H](C)C(=O)N(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000557449266 943134258 /nfs/dbraw/zinc/13/42/58/943134258.db2.gz SKKHIWVBFFMLHB-URXFXBBRSA-N 0 3 409.574 4.138 20 0 HIADHN CCCCO[C@H]1C[C@@H](NCC(=O)Nc2c(F)cc(F)cc2Br)C1(C)C ZINC000557520483 943188437 /nfs/dbraw/zinc/18/84/37/943188437.db2.gz HVQMGTGIZSVROQ-CABCVRRESA-N 0 3 419.310 4.239 20 0 HIADHN CCCc1csc(CN(C)C2CCN(Cc3ncc(C)c(OC)c3C)CC2)n1 ZINC000557523615 943189529 /nfs/dbraw/zinc/18/95/29/943189529.db2.gz MZKAFPDYLNJUDX-UHFFFAOYSA-N 0 3 402.608 4.212 20 0 HIADHN CCc1cncc(C(=O)N(Cc2ccccc2Br)C2CCN(C)CC2)c1 ZINC000557549959 943204069 /nfs/dbraw/zinc/20/40/69/943204069.db2.gz SHKCMKLOADIVPQ-UHFFFAOYSA-N 0 3 416.363 4.143 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)[C@H]1CCn2c(cnc2C2CCCCC2)C1 ZINC000557630523 943239256 /nfs/dbraw/zinc/23/92/56/943239256.db2.gz RQARHNZKCOYAQB-NRFANRHFSA-N 0 3 400.611 4.218 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)c1cccc(CSc2nccn2C)c1 ZINC000557632582 943240688 /nfs/dbraw/zinc/24/06/88/943240688.db2.gz SEYFWYLKHHGVBT-UHFFFAOYSA-N 0 3 400.592 4.051 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)c1cc2c(cccc2Br)[nH]1)c1ccco1 ZINC000557911031 943326927 /nfs/dbraw/zinc/32/69/27/943326927.db2.gz ZKXZTBMVPYWMIU-SJKOYZFVSA-N 0 3 404.308 4.383 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)C1CCC(NC(=O)CC2CCCC2)CC1)c1ccco1 ZINC000557912639 943327755 /nfs/dbraw/zinc/32/77/55/943327755.db2.gz WCWOHHIJDQCAAU-WYNBGMTASA-N 0 3 417.594 4.080 20 0 HIADHN CCCN(C)[C@H](CNC(=O)N(C)CCc1ncc(C)s1)c1ccc(Cl)cc1 ZINC000558106334 943381494 /nfs/dbraw/zinc/38/14/94/943381494.db2.gz BNHNJHATSRFGOY-GOSISDBHSA-N 0 3 408.999 4.372 20 0 HIADHN CCN1CCCC[C@@H]1CNC(=O)c1ccccc1CSc1nc2ccccc2[nH]1 ZINC000558185865 943419419 /nfs/dbraw/zinc/41/94/19/943419419.db2.gz FGEYMSLFKSAEGO-GOSISDBHSA-N 0 3 408.571 4.459 20 0 HIADHN COc1cc(CN[C@@H](C)c2cccc(-n3ccnn3)c2)ccc1OCC(F)(F)F ZINC000558220453 943440909 /nfs/dbraw/zinc/44/09/09/943440909.db2.gz PNNQAIKSCGQMDT-AWEZNQCLSA-N 0 3 406.408 4.068 20 0 HIADHN CN(C)C[C@H](NC(=O)Nc1cc(C2CC2)nn1-c1ccccc1)c1ccc(F)cc1 ZINC000558238600 943451630 /nfs/dbraw/zinc/45/16/30/943451630.db2.gz SRNQBCNSWVPCTK-NRFANRHFSA-N 0 3 407.493 4.313 20 0 HIADHN CCC(=O)Nc1ccc(NC(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)cc1 ZINC000558307629 943496260 /nfs/dbraw/zinc/49/62/60/943496260.db2.gz LTVQDXWDXYKSEW-NRFANRHFSA-N 0 3 412.534 4.247 20 0 HIADHN COc1nc2ccccc2cc1CN1CCC[C@@H](c2nc(C(F)(F)F)cn2C)C1 ZINC000558407522 943551513 /nfs/dbraw/zinc/55/15/13/943551513.db2.gz PBLGGZLBPMTPSW-OAHLLOKOSA-N 0 3 404.436 4.375 20 0 HIADHN Fc1ccc(-n2cc(CN3C[C@H](c4ccccc4)[C@H]4COCC[C@@H]43)nn2)c(Cl)c1 ZINC000558412317 943553014 /nfs/dbraw/zinc/55/30/14/943553014.db2.gz VYJXHYSOJWIPFE-SBHAEUEKSA-N 0 3 412.896 4.064 20 0 HIADHN C[C@H](N[C@H]1CCN(C)[C@@H]1c1ccc(F)c(F)c1)C(=O)Nc1cc(Cl)ccc1F ZINC000558475920 943569152 /nfs/dbraw/zinc/56/91/52/943569152.db2.gz MRPHQJRHLVWELT-WOVYWWTOSA-N 0 3 411.855 4.119 20 0 HIADHN COCCN(C)c1ccc(CNC(C)(C)c2ccc(Br)c(C)c2)cn1 ZINC000558493402 943574788 /nfs/dbraw/zinc/57/47/88/943574788.db2.gz PFIORKTZHHIIKS-UHFFFAOYSA-N 0 3 406.368 4.260 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)N[C@@H]1c2ccccc2CC12CCOCC2 ZINC000558606392 943616291 /nfs/dbraw/zinc/61/62/91/943616291.db2.gz FHKZMGFZKJNGOA-BJKOFHAPSA-N 0 3 419.569 4.217 20 0 HIADHN CN(C)c1noc([C@@H]2CCCN([C@H]3CCCc4ccc(Br)cc43)C2)n1 ZINC000558728891 943633900 /nfs/dbraw/zinc/63/39/00/943633900.db2.gz BAPNAWCWHVBEOS-PBHICJAKSA-N 0 3 405.340 4.155 20 0 HIADHN COc1cc(OC)c(NC(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)cc1Cl ZINC000558749592 943640838 /nfs/dbraw/zinc/64/08/38/943640838.db2.gz SHRJVHHBYIIUFE-INIZCTEOSA-N 0 3 412.317 4.435 20 0 HIADHN CN(C)C[C@@H](NC(=O)Nc1cccc(NC(=O)C2CC2)c1)c1ccc(Cl)cc1 ZINC000558767705 943653210 /nfs/dbraw/zinc/65/32/10/943653210.db2.gz MKEJKWZCDNPHSW-LJQANCHMSA-N 0 3 400.910 4.113 20 0 HIADHN CCN1CC[C@H](NCC(=O)N[C@H](C)c2ccccc2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000558891551 943725354 /nfs/dbraw/zinc/72/53/54/943725354.db2.gz HFVYZTXXCUPGDE-PDXHDDNESA-N 0 3 403.929 4.081 20 0 HIADHN CC(C)N1CC[C@H](N[C@@H](C)C(=O)Nc2cccc(F)c2)[C@H]1c1ccc(F)c(F)c1 ZINC000558896297 943729688 /nfs/dbraw/zinc/72/96/88/943729688.db2.gz KVSVYJMSCWHAND-SZFUDVHCSA-N 0 3 405.464 4.245 20 0 HIADHN CCN1CC[C@H](NCc2nc3ccccc3nc2C)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000558895831 943729707 /nfs/dbraw/zinc/72/97/07/943729707.db2.gz PHZNMOXCWCPBDE-UGKGYDQZSA-N 0 3 400.448 4.281 20 0 HIADHN COc1cccc([C@@H]2[C@@H](N[C@@H](C)C(=O)Nc3ccc(C)cc3F)CCN2C2CC2)c1 ZINC000558896427 943729838 /nfs/dbraw/zinc/72/98/38/943729838.db2.gz SRIFWXCISAGFSS-IRBZQWRBSA-N 0 3 411.521 4.037 20 0 HIADHN CCN1CC[C@H](NCC(=O)Nc2cc(C(C)(C)C)no2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000558895630 943729932 /nfs/dbraw/zinc/72/99/32/943729932.db2.gz KIYCIANMSJFIEF-JXFKEZNVSA-N 0 3 422.932 4.128 20 0 HIADHN CCN1CC[C@H](NCC(=O)Nc2cccc(C(C)=O)c2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000558896845 943730762 /nfs/dbraw/zinc/73/07/62/943730762.db2.gz OBDDWNYLALOVHG-RBBKRZOGSA-N 0 3 417.912 4.045 20 0 HIADHN CCN1CC[C@H](N[C@H](C)c2cc(C)c(C(=O)OC)o2)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000558897419 943732492 /nfs/dbraw/zinc/73/24/92/943732492.db2.gz PTLORBUYMNGRAE-RNRVQEDPSA-N 0 3 410.436 4.278 20 0 HIADHN CSc1cccc(NC(=O)CN[C@@H]2CCN(C(C)C)[C@H]2c2ccc(F)c(F)c2)c1 ZINC000558902638 943737248 /nfs/dbraw/zinc/73/72/48/943737248.db2.gz SRJXEXPKYYGJFP-IRLDBZIGSA-N 0 3 419.541 4.439 20 0 HIADHN CN(C)C[C@H](NC(=O)NC[C@H]1CCCN(c2ccccc2)C1)c1ccc(Cl)cc1 ZINC000558950445 943768797 /nfs/dbraw/zinc/76/87/97/943768797.db2.gz OQQOESXXNFXAOJ-GCJKJVERSA-N 0 3 414.981 4.159 20 0 HIADHN Cc1cn(-c2ccc(F)cc2)nc1C(=O)N[C@@H](CN(C)C)c1ccc(Cl)cc1 ZINC000558972919 943777504 /nfs/dbraw/zinc/77/75/04/943777504.db2.gz SGRFCCZURVRQMG-IBGZPJMESA-N 0 3 400.885 4.006 20 0 HIADHN CCc1oc(CNC2CCN(Cc3cccc(C(F)(F)F)c3)CC2)cc1C(=O)OC ZINC000559069631 943823068 /nfs/dbraw/zinc/82/30/68/943823068.db2.gz RTVXBTJYHRWGDE-UHFFFAOYSA-N 0 3 424.463 4.402 20 0 HIADHN Cc1nc2cc(CNC(=O)c3oc4ccccc4c3CN(C)C)ccc2n1C1CC1 ZINC000559286915 943890740 /nfs/dbraw/zinc/89/07/40/943890740.db2.gz GGWRJDWCWGMPIA-UHFFFAOYSA-N 0 3 402.498 4.417 20 0 HIADHN CCS(=O)(=O)c1ccc([C@H](C)N[C@@H](C)c2ccc(NC(=O)NC(C)C)cc2)cc1 ZINC000559421234 943944225 /nfs/dbraw/zinc/94/42/25/943944225.db2.gz WCAVBSQXZYSVIY-IRXDYDNUSA-N 0 3 417.575 4.422 20 0 HIADHN O=C(NC[C@@H]1CCCOC1)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000559548651 944001414 /nfs/dbraw/zinc/00/14/14/944001414.db2.gz LHMTVBKOTNKDPE-KRWDZBQOSA-N 0 3 414.377 4.027 20 0 HIADHN CCOc1cc(CNCc2ccccc2N2CCO[C@H](C)C2)ccc1OC(F)F ZINC000559601553 944015797 /nfs/dbraw/zinc/01/57/97/944015797.db2.gz ZCOZEUFYRZNKBQ-MRXNPFEDSA-N 0 3 406.473 4.202 20 0 HIADHN COCCS(=O)(=O)c1ccc(CN[C@H](C)c2ccc(F)c3ccccc32)cc1 ZINC000559843339 944065164 /nfs/dbraw/zinc/06/51/64/944065164.db2.gz VFCINHUSMRPJRE-MRXNPFEDSA-N 0 3 401.503 4.250 20 0 HIADHN C[C@@H]1CCN(C)CCN1C(=O)Nc1ccc(N(C)C(=O)c2ccc(Cl)cc2)cc1 ZINC000559848697 944067462 /nfs/dbraw/zinc/06/74/62/944067462.db2.gz DKMKWWGDQPSXIH-MRXNPFEDSA-N 0 3 414.937 4.175 20 0 HIADHN COCCOc1ccc([C@H](C)N[C@@H]2CCCN([C@@H](C)c3ccccc3F)C2=O)cc1 ZINC000559878866 944072642 /nfs/dbraw/zinc/07/26/42/944072642.db2.gz OKLXKHIXBOREBR-IUKKYPGJSA-N 0 3 414.521 4.254 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)Nc1ccc(Oc2cccnc2)nc1 ZINC000559966719 944103957 /nfs/dbraw/zinc/10/39/57/944103957.db2.gz RYIIMWHIDKCGDT-GOSISDBHSA-N 0 3 409.515 4.289 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2cc(F)c3ccccc3c2)cc1)[C@H]1CCCN(C)C1 ZINC000559981136 944108915 /nfs/dbraw/zinc/10/89/15/944108915.db2.gz GCKMETGSCNQDEH-NRFANRHFSA-N 0 3 419.500 4.397 20 0 HIADHN COc1ccc(C[C@H](C)CN(C)CC(=O)N[C@H](c2nccs2)c2ccccc2)cc1 ZINC000560112604 944163631 /nfs/dbraw/zinc/16/36/31/944163631.db2.gz QMEGRMWYPSYCEY-MBSDFSHPSA-N 0 3 423.582 4.168 20 0 HIADHN COC1CCN(C(C)(C)CNC(=O)[C@H](C)Oc2ccc(-c3ccccc3)cc2)CC1 ZINC000560229729 944202242 /nfs/dbraw/zinc/20/22/42/944202242.db2.gz GNGIYJZMSUSRQZ-IBGZPJMESA-N 0 3 410.558 4.127 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)[C@@H](C)Cc2cccc(C(F)(F)F)c2)cc1 ZINC000560252751 944207730 /nfs/dbraw/zinc/20/77/30/944207730.db2.gz WMPGIUASABZDOG-YWZLYKJASA-N 0 3 408.464 4.312 20 0 HIADHN C[C@@H]1Cc2ccc(F)cc2[C@H]1NCc1cccc(N2C(=O)N[C@@](C)(C3CC3)C2=O)c1 ZINC000560269675 944214308 /nfs/dbraw/zinc/21/43/08/944214308.db2.gz WSISLSAGCDYCMN-QIAKTKIMSA-N 0 3 407.489 4.074 20 0 HIADHN COc1cc(Br)ccc1[C@H](C)N[C@@H](C)c1ccccc1-n1ccnn1 ZINC000560549336 944249633 /nfs/dbraw/zinc/24/96/33/944249633.db2.gz MDMAPOPEAPAWNY-KBPBESRZSA-N 0 3 401.308 4.450 20 0 HIADHN COc1ccc(-c2nc(C)c([C@H](C)NCC3(S(C)(=O)=O)CCCC3)s2)cc1 ZINC000560580702 944262035 /nfs/dbraw/zinc/26/20/35/944262035.db2.gz HZDWFIVXAYNCIL-AWEZNQCLSA-N 0 3 408.589 4.135 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)c1ccc2c(c1)CCN2C(C)=O)c1ccc(Cl)cc1 ZINC000560709524 944303668 /nfs/dbraw/zinc/30/36/68/944303668.db2.gz HKCAVYPDCJUVDH-QFIPXVFZSA-N 0 3 413.949 4.062 20 0 HIADHN Cc1ccc(S(=O)(=O)N[C@@H](CCN(C)[C@H](C)c2cccnc2)c2ccccc2)cc1 ZINC000560854232 944358021 /nfs/dbraw/zinc/35/80/21/944358021.db2.gz FMGMRARAYMLCOW-YKSBVNFPSA-N 0 3 423.582 4.493 20 0 HIADHN Cc1ccc(S(=O)(=O)N[C@@H](CCN(C)[C@@H](C)c2cccnc2)c2ccccc2)cc1 ZINC000560854231 944358236 /nfs/dbraw/zinc/35/82/36/944358236.db2.gz FMGMRARAYMLCOW-RDPSFJRHSA-N 0 3 423.582 4.493 20 0 HIADHN CC(C)c1ccc2occ(C(=O)Nc3ccc4oc(=O)n(CCN(C)C)c4c3)c2c1 ZINC000561097621 944449432 /nfs/dbraw/zinc/44/94/32/944449432.db2.gz BDBLWVBZVHZMFP-UHFFFAOYSA-N 0 3 407.470 4.278 20 0 HIADHN CCCN(CCN1CCCC1)C(=O)c1coc(-c2ccc(Br)cc2F)n1 ZINC000561200529 944511841 /nfs/dbraw/zinc/51/18/41/944511841.db2.gz HZPAYGCBEVFNOW-UHFFFAOYSA-N 0 3 424.314 4.191 20 0 HIADHN Cc1c(C(=O)N2CC[C@]3(CCN(Cc4ccccc4)C3)C2)[nH]c2c1C(=O)CC(C)(C)C2 ZINC000561282266 944538604 /nfs/dbraw/zinc/53/86/04/944538604.db2.gz RXBBSUQESHSPHI-SANMLTNESA-N 0 3 419.569 4.216 20 0 HIADHN CC(=O)c1c(C)[nH]c(C(=O)N2CC[C@]3(CCN(Cc4ccccc4)C3)C2)c1C(C)C ZINC000561282763 944539396 /nfs/dbraw/zinc/53/93/96/944539396.db2.gz YWBYQFQVRAWJNZ-VWLOTQADSA-N 0 3 407.558 4.387 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@@H](O)C2)c1)c1cc(C2CC2)nc2ccc(F)cc21 ZINC000561320400 944550205 /nfs/dbraw/zinc/55/02/05/944550205.db2.gz CAGCEUAGVQPLEY-LJQANCHMSA-N 0 3 405.473 4.070 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)NCc2c(F)cccc2N2CCCC2)C1 ZINC000561506544 944642060 /nfs/dbraw/zinc/64/20/60/944642060.db2.gz SAYJTDBQAIXBDE-QUCCMNQESA-N 0 3 410.537 4.061 20 0 HIADHN CCSc1ccc(-c2nn(-c3ccccc3)cc2CNC[C@@H](O)C(F)F)cc1 ZINC000561527625 944657172 /nfs/dbraw/zinc/65/71/72/944657172.db2.gz IWPRENZMAYUJNO-LJQANCHMSA-N 0 3 403.498 4.367 20 0 HIADHN O=C(NCc1cccc(OCc2ccccc2)c1)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000561639894 944721789 /nfs/dbraw/zinc/72/17/89/944721789.db2.gz GBFLUXJNYSPNEB-DEOSSOPVSA-N 0 3 415.537 4.189 20 0 HIADHN CSc1ccc([C@H](CNC(=O)c2ccc3[nH]c(C(F)F)nc3c2)N(C)C)cc1 ZINC000561728142 944767109 /nfs/dbraw/zinc/76/71/09/944767109.db2.gz NVCIQMPOERLCSA-KRWDZBQOSA-N 0 3 404.486 4.255 20 0 HIADHN C[C@@H]1C[C@@H]1N1CCN(C(=O)c2cc(F)c(Br)c(Cl)c2)C[C@@H](C)C1 ZINC000561761571 944785424 /nfs/dbraw/zinc/78/54/24/944785424.db2.gz MTEODRYMCCGORL-RWSFTLGLSA-N 0 3 403.723 4.044 20 0 HIADHN C[C@@H]1C[C@@H]1N1CCN(C(=O)c2cccc(-c3noc(CC(C)(C)C)n3)c2)C[C@@H](C)C1 ZINC000561761969 944785554 /nfs/dbraw/zinc/78/55/54/944785554.db2.gz PBALVGDGKZEISJ-QKLQHJQFSA-N 0 3 410.562 4.128 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)N[C@H]2CCN(Cc3ccccc3)[C@H]2C)c(Cl)c1 ZINC000561800399 944802627 /nfs/dbraw/zinc/80/26/27/944802627.db2.gz TYGZASOALMUKAW-LIRRHRJNSA-N 0 3 400.910 4.083 20 0 HIADHN COc1cc(Cl)c(NC(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)cc1C ZINC000561817055 944809450 /nfs/dbraw/zinc/80/94/50/944809450.db2.gz ONKOTFVVCJIPEM-IRXDYDNUSA-N 0 3 423.985 4.400 20 0 HIADHN COc1cc(CN(CCCO)C(c2ccccc2)c2ccccc2)cc(OC)c1O ZINC000561949846 944871923 /nfs/dbraw/zinc/87/19/23/944871923.db2.gz LAUFOJRMIPHZPH-UHFFFAOYSA-N 0 3 407.510 4.383 20 0 HIADHN Cn1cc(C(F)(F)F)nc1[C@@H]1CCCN(Cc2ccc3c(c2)COC(C)(C)O3)C1 ZINC000561956329 944874131 /nfs/dbraw/zinc/87/41/31/944874131.db2.gz FPXHSXXUOMTURI-OAHLLOKOSA-N 0 3 409.452 4.464 20 0 HIADHN Cn1cc(C(F)(F)F)nc1[C@H]1CCCN(Cc2ccc3c(c2)COC(C)(C)O3)C1 ZINC000561956328 944874711 /nfs/dbraw/zinc/87/47/11/944874711.db2.gz FPXHSXXUOMTURI-HNNXBMFYSA-N 0 3 409.452 4.464 20 0 HIADHN CCC(CC)Nc1ccncc1NC(=O)c1cc(N2CCCC2=O)ccc1Cl ZINC000562004453 944891073 /nfs/dbraw/zinc/89/10/73/944891073.db2.gz LIORGNPKFFQXQF-UHFFFAOYSA-N 0 3 400.910 4.137 20 0 HIADHN COC[C@H](NC1CCN(C(=O)NC2CCCCC2)CC1)c1cccc(Cl)c1F ZINC000562060235 944916483 /nfs/dbraw/zinc/91/64/83/944916483.db2.gz WGXBUHYQDSKEPT-IBGZPJMESA-N 0 3 411.949 4.263 20 0 HIADHN COc1ccc([C@H](Cc2ccccc2)NCc2cnc(N3CCOCC3)s2)cc1 ZINC000562083222 944929402 /nfs/dbraw/zinc/92/94/02/944929402.db2.gz GVSYHPQNPMPZDK-QFIPXVFZSA-N 0 3 409.555 4.062 20 0 HIADHN C[C@@H](NC(=O)NCc1cccc(COCc2ccco2)c1)[C@@H](c1ccccc1)N(C)C ZINC000562248029 945043123 /nfs/dbraw/zinc/04/31/23/945043123.db2.gz JKJOKBHBGQATKO-DVECYGJZSA-N 0 3 421.541 4.487 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1cc(-c2ccc(F)cc2F)nn1C)c1ccco1 ZINC000562276384 945052307 /nfs/dbraw/zinc/05/23/07/945052307.db2.gz DMOMOYBCVIZVMI-SCLBCKFNSA-N 0 3 417.460 4.209 20 0 HIADHN C[C@H](N[C@H]1CCN(C)[C@@H]1c1ccc(Cl)c(F)c1)C(=O)Nc1ccccc1Cl ZINC000564069897 945370629 /nfs/dbraw/zinc/37/06/29/945370629.db2.gz KKGVNRUCNVSGSH-YXKWSERDSA-N 0 3 410.320 4.495 20 0 HIADHN CCc1nnc(-c2ccc(NC(=O)N[C@@H]3CCN(Cc4ccccc4)[C@@H]3C)cc2)o1 ZINC000564165772 945411373 /nfs/dbraw/zinc/41/13/73/945411373.db2.gz NSAVMZHULBGTDX-OXQOHEQNSA-N 0 3 405.502 4.084 20 0 HIADHN CC(C)N1CC[C@H](NCC(=O)N(C)[C@H](C)c2ccccc2)[C@@H]1c1ccc(F)c(F)c1 ZINC000564232162 945446561 /nfs/dbraw/zinc/44/65/61/945446561.db2.gz UWIZCYCKCVOXTN-UWSIMGETSA-N 0 3 415.528 4.298 20 0 HIADHN COc1cc(CN(Cc2cn(-c3ccncc3)nc2C)C2CC2)ccc1OC(F)F ZINC000564239748 945457006 /nfs/dbraw/zinc/45/70/06/945457006.db2.gz GTBFWBFEZBQXMV-UHFFFAOYSA-N 0 3 414.456 4.350 20 0 HIADHN COc1ccc(-c2nsc(NC(=O)N[C@@H](CN3CCCC3)c3ccccc3)n2)cc1 ZINC000564367292 945532824 /nfs/dbraw/zinc/53/28/24/945532824.db2.gz FJLJTAYXOJKLNC-IBGZPJMESA-N 0 3 423.542 4.172 20 0 HIADHN C[C@@H](NCc1cc(O)cc(C(F)(F)F)c1)c1cc(F)ccc1N1CCN(C)CC1 ZINC000564407593 945559607 /nfs/dbraw/zinc/55/96/07/945559607.db2.gz IHKBYOGEAVBKQA-CQSZACIVSA-N 0 3 411.443 4.153 20 0 HIADHN O=C(CN[C@H]1c2ccccc2CC12CCOCC2)NCC1(c2ccccc2)CCCC1 ZINC000564411532 945562525 /nfs/dbraw/zinc/56/25/25/945562525.db2.gz UMIZRCSKUVDYES-VWLOTQADSA-N 0 3 418.581 4.298 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)CCCCc2nc3ccccc3s2)cc1 ZINC000564478268 945612210 /nfs/dbraw/zinc/61/22/10/945612210.db2.gz ZBJMWANKGHHPLP-HXUWFJFHSA-N 0 3 411.571 4.437 20 0 HIADHN COc1cccc(OC)c1OCCCCN(C)Cc1cc(Br)cn1C ZINC000564606937 945703497 /nfs/dbraw/zinc/70/34/97/945703497.db2.gz CZNWZUNRRROJRG-UHFFFAOYSA-N 0 3 411.340 4.096 20 0 HIADHN Cc1nc(-c2cccc(NC(=O)CN(C)CCCN(C)Cc3ccco3)c2)cs1 ZINC000564675330 945724437 /nfs/dbraw/zinc/72/44/37/945724437.db2.gz OMQHSCMGHKULPN-UHFFFAOYSA-N 0 3 412.559 4.104 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNc2cnn(C(C)(C)C)c(=O)c2Cl)N(C)C)cc1 ZINC000564681009 945727514 /nfs/dbraw/zinc/72/75/14/945727514.db2.gz GQPJJQHENUCWSG-GOSISDBHSA-N 0 3 406.958 4.154 20 0 HIADHN CCN(C[C@@H]1CCCN1CC)C(=O)c1sc(COc2ccc(F)cc2)nc1C ZINC000564700340 945737526 /nfs/dbraw/zinc/73/75/26/945737526.db2.gz ZJPBDTKCFPMIIV-KRWDZBQOSA-N 0 3 405.539 4.116 20 0 HIADHN CCN1CCN(Cc2ccc(N[C@@H](C)c3ccc(Br)cn3)cc2)CC1 ZINC000564783722 945757202 /nfs/dbraw/zinc/75/72/02/945757202.db2.gz UDENITQQVGTOOZ-INIZCTEOSA-N 0 3 403.368 4.155 20 0 HIADHN CC(C)(C)OC(=O)Cc1cccc(NC(=O)N2CCN(C3CCCCC3)CC2)c1 ZINC000564823993 945762032 /nfs/dbraw/zinc/76/20/32/945762032.db2.gz PUMGSBDWBZLJNM-UHFFFAOYSA-N 0 3 401.551 4.053 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CC[C@@H](C(F)(F)F)C4(CCC4)C3)c2)CC1 ZINC000565066083 945766121 /nfs/dbraw/zinc/76/61/21/945766121.db2.gz DUNMVWNXVPKASW-LJQANCHMSA-N 0 3 424.511 4.415 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@H]2CCCC[C@@H]2NCc2ccccc2Cn2ccnc2)cc1 ZINC000565369424 945817649 /nfs/dbraw/zinc/81/76/49/945817649.db2.gz XHQXHFMVHXSWTB-ZEQRLZLVSA-N 0 3 423.582 4.115 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@H]2NCc2ccccc2Cn2ccnc2)cc1 ZINC000565369422 945817905 /nfs/dbraw/zinc/81/79/05/945817905.db2.gz XHQXHFMVHXSWTB-DNQXCXABSA-N 0 3 423.582 4.115 20 0 HIADHN CN(C)C[C@H](NC(=O)CCc1nc2cc(Cl)ccc2s1)c1ccc(F)cc1 ZINC000565441346 945830370 /nfs/dbraw/zinc/83/03/70/945830370.db2.gz JCENEYLFLANVDI-KRWDZBQOSA-N 0 3 405.926 4.441 20 0 HIADHN CSc1ccc([C@H](CNC(=O)Cc2cscc2Br)N(C)C)cc1 ZINC000565532735 945845829 /nfs/dbraw/zinc/84/58/29/945845829.db2.gz ZKJKYGUENXTBEP-INIZCTEOSA-N 0 3 413.406 4.194 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)N1CCC(Cc2nc3ccccc3[nH]2)CC1 ZINC000565791349 945883614 /nfs/dbraw/zinc/88/36/14/945883614.db2.gz ZZCSVHXQZANABP-UHFFFAOYSA-N 0 3 416.525 4.466 20 0 HIADHN FC(F)(F)c1cscc1CN1CCC[C@@H](CN2CCN(c3ccccn3)CC2)C1 ZINC000565922597 945926806 /nfs/dbraw/zinc/92/68/06/945926806.db2.gz LISXHUYXORRHDH-KRWDZBQOSA-N 0 3 424.536 4.196 20 0 HIADHN C[C@H]1[C@@H](NC(=O)C2(c3cccc(Cl)c3)CCOCC2)CCN1Cc1ccccc1 ZINC000566580735 946045521 /nfs/dbraw/zinc/04/55/21/946045521.db2.gz CCZYGIMGAZVSQF-AVRDEDQJSA-N 0 3 412.961 4.167 20 0 HIADHN COc1cc(CNCc2cn(C)nc2-c2ccccc2)cc(OC)c1OCC(F)F ZINC000566641864 946062362 /nfs/dbraw/zinc/06/23/62/946062362.db2.gz APDUBTKJHWJSBY-UHFFFAOYSA-N 0 3 417.456 4.038 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)c1nc2ccccc2cc1Br ZINC000566877540 946145800 /nfs/dbraw/zinc/14/58/00/946145800.db2.gz PFYVJHZDIMTXGA-UHFFFAOYSA-N 0 3 414.303 4.320 20 0 HIADHN CCc1cccc(C)c1NC(=O)CN[C@@H]1CCN(C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000566885168 946153853 /nfs/dbraw/zinc/15/38/53/946153853.db2.gz ZLUDXHAVZXKLDZ-KNQAVFIVSA-N 0 3 403.929 4.323 20 0 HIADHN c1ccc2c(c1)[nH]c1c2CCC[C@H]1NCc1ccccc1OCCN1CCOCC1 ZINC000567141725 946250648 /nfs/dbraw/zinc/25/06/48/946250648.db2.gz RCLMWFGWTRXBQN-HSZRJFAPSA-N 0 3 405.542 4.046 20 0 HIADHN C[C@@H](Cc1cncc2ccccc21)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000567224674 946275767 /nfs/dbraw/zinc/27/57/67/946275767.db2.gz POPKGKKLODUBTO-VMEOHVCESA-N 0 3 419.491 4.335 20 0 HIADHN CCCc1cccc(C(C)C)c1NC(=O)N1CC[C@H](N2CCN(C(C)C)CC2)C1 ZINC000567298102 946300998 /nfs/dbraw/zinc/30/09/98/946300998.db2.gz OXOQRUDPQPGPMB-NRFANRHFSA-N 0 3 400.611 4.395 20 0 HIADHN Cc1nc(CCC(=O)N[C@H]2CCN(Cc3ccccc3)[C@H]2C)oc1-c1ccccc1 ZINC000567304376 946303203 /nfs/dbraw/zinc/30/32/03/946303203.db2.gz YCEKEQRUWYRGNX-UGKGYDQZSA-N 0 3 403.526 4.362 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)c1ccn(-c2cccc(C(F)(F)F)c2)n1)c1ccco1 ZINC000567538503 946365523 /nfs/dbraw/zinc/36/55/23/946365523.db2.gz VIMCSNGHPMOXLG-KSSFIOAISA-N 0 3 420.435 4.343 20 0 HIADHN CC(C)Cc1ccc([C@@H](CNC(=O)Cc2cncn2Cc2ccccc2)N(C)C)cc1 ZINC000567656919 946395530 /nfs/dbraw/zinc/39/55/30/946395530.db2.gz VYDWDRIQLJNEBV-RUZDIDTESA-N 0 3 418.585 4.092 20 0 HIADHN CN(C)Cc1ccccc1CNC(=O)c1ccc2c(c1)nc(Cc1cccs1)n2C ZINC000567934622 946427711 /nfs/dbraw/zinc/42/77/11/946427711.db2.gz DDSSTUVGIACFHS-UHFFFAOYSA-N 0 3 418.566 4.217 20 0 HIADHN COc1ccccc1C[C@@H](C)CC(=O)N1CCN(c2ccnc3ccccc32)CC1 ZINC000568130369 946472660 /nfs/dbraw/zinc/47/26/60/946472660.db2.gz WZSIQKPJSPZROV-LJQANCHMSA-N 0 3 403.526 4.161 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)CCc1nnc(-c2cc3ccccc3o2)o1)c1ccco1 ZINC000568313553 946501333 /nfs/dbraw/zinc/50/13/33/946501333.db2.gz RFDQDDYXBMFJGQ-RDJZCZTQSA-N 0 3 422.485 4.254 20 0 HIADHN CCSc1cccc(Br)c1NC(=O)N1C[C@@H](SC)[C@H](N(C)C)C1 ZINC000568333570 946514169 /nfs/dbraw/zinc/51/41/69/946514169.db2.gz DKKQSYZICJLDNF-TZMCWYRMSA-N 0 3 418.426 4.070 20 0 HIADHN CN1CCC(N(Cc2ccccc2Br)C(=O)c2ncccc2Cl)CC1 ZINC000568425448 946537988 /nfs/dbraw/zinc/53/79/88/946537988.db2.gz GTFYPPQPYJERNO-UHFFFAOYSA-N 0 3 422.754 4.234 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)c2sc(NC(=O)C(C)(C)C)cc2C)cc1 ZINC000568493277 946568416 /nfs/dbraw/zinc/56/84/16/946568416.db2.gz JKNBJKLVKRTLDG-KRWDZBQOSA-N 0 3 417.575 4.082 20 0 HIADHN CC(C)Cn1cc(NC(=O)N[C@@H]2CCN(Cc3ccccc3)[C@@H]2C)c(C(F)F)n1 ZINC000568524646 946576650 /nfs/dbraw/zinc/57/66/50/946576650.db2.gz APRZCTCNCGOCOX-NVXWUHKLSA-N 0 3 405.493 4.261 20 0 HIADHN O=C([C@@H]1C[C@H]1c1ccccc1Cl)N1CCC[C@H](c2n[nH]cc2CN2CCCC2)C1 ZINC000568612344 946624592 /nfs/dbraw/zinc/62/45/92/946624592.db2.gz GZVZYXUQXHUECN-FFZOFVMBSA-N 0 3 412.965 4.169 20 0 HIADHN CN(C)C[C@H](NC(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1)c1ccc(F)cc1 ZINC000568789292 946687357 /nfs/dbraw/zinc/68/73/57/946687357.db2.gz BESOGGJHNBAEAR-OTWHNJEPSA-N 0 3 405.311 4.111 20 0 HIADHN Cc1c(C(=O)N[C@@H](CN(C)C)c2ccc(F)cc2)cnn1-c1ccccc1Cl ZINC000568802348 946702243 /nfs/dbraw/zinc/70/22/43/946702243.db2.gz VSUOXEIUTIUELD-IBGZPJMESA-N 0 3 400.885 4.006 20 0 HIADHN COCCOc1ccc(Cl)cc1C(=O)NC[C@@H](c1ccc(SC)cc1)N(C)C ZINC000569147756 946823346 /nfs/dbraw/zinc/82/33/46/946823346.db2.gz WKLDMJHZTJXUHZ-IBGZPJMESA-N 0 3 422.978 4.120 20 0 HIADHN COc1cccc2c1CCC[C@@H]2NCc1nnc(-c2ccc(Br)cc2)[nH]1 ZINC000569185450 946835524 /nfs/dbraw/zinc/83/55/24/946835524.db2.gz NOHXYJWYMSVVOQ-KRWDZBQOSA-N 0 3 413.319 4.410 20 0 HIADHN COc1cccc2c1CCC[C@@H]2[NH2+]Cc1nnc(-c2ccc(Br)cc2)[n-]1 ZINC000569185450 946835536 /nfs/dbraw/zinc/83/55/36/946835536.db2.gz NOHXYJWYMSVVOQ-KRWDZBQOSA-N 0 3 413.319 4.410 20 0 HIADHN COc1ccc(S(=O)(=O)N(C)[C@H]2CCN(Cc3ccccc3)[C@H](C)C2)c(Cl)c1 ZINC000569284807 946849830 /nfs/dbraw/zinc/84/98/30/946849830.db2.gz QAWLTFPXHJTTIV-AEFFLSMTSA-N 0 3 422.978 4.022 20 0 HIADHN CCN1CC[C@H](NCc2cnn(C)c2C(F)(F)F)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000569359147 946860497 /nfs/dbraw/zinc/86/04/97/946860497.db2.gz DINBGQSHFMQUOM-HOTGVXAUSA-N 0 3 404.839 4.157 20 0 HIADHN C[C@H](NC[C@@]1(CO)C[C@H]1c1ccccc1)c1ccccc1I ZINC000569397068 946866596 /nfs/dbraw/zinc/86/65/96/946866596.db2.gz ZRVJPTVZUNAXNC-UCLAIMLFSA-N 0 3 407.295 4.108 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@@H](O)C2)c1)c1cncc(-c2ccc(Cl)cc2)c1 ZINC000569754701 946982552 /nfs/dbraw/zinc/98/25/52/946982552.db2.gz LGGKQQALZZDTDA-JOCHJYFZSA-N 0 3 407.901 4.221 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)Nc1ccc(CNC(C)=O)cc1)c1ccc(Cl)cc1 ZINC000569837584 947016309 /nfs/dbraw/zinc/01/63/09/947016309.db2.gz BFQKKKKNHOWUQS-NRFANRHFSA-N 0 3 416.953 4.181 20 0 HIADHN COc1cc(OC)cc(Oc2ccc(CN3CCC[C@@H](c4ccnc(N)n4)C3)cc2)c1 ZINC000569888040 947036282 /nfs/dbraw/zinc/03/62/82/947036282.db2.gz BIUWMLSFJZXFGK-GOSISDBHSA-N 0 3 420.513 4.248 20 0 HIADHN Cc1cc(C)c(S(N)(=O)=O)cc1[C@H](C)NC[C@H](Cc1ccccc1)C(F)(F)F ZINC000569892989 947038599 /nfs/dbraw/zinc/03/85/99/947038599.db2.gz WNCDQBPZALNCLT-RDJZCZTQSA-N 0 3 414.493 4.023 20 0 HIADHN COc1ccc([C@H](C)NC[C@]2(CO)C[C@@H]2c2ccc(F)cc2)c(Br)c1 ZINC000570084470 947090108 /nfs/dbraw/zinc/09/01/08/947090108.db2.gz DRKHCBZDCCUDNE-VIZZQPHQSA-N 0 3 408.311 4.414 20 0 HIADHN C[C@H](c1ccc(F)cc1)N1CCC[C@@H](N[C@@H](C)c2ccc3c(c2)OCCCO3)C1=O ZINC000570111087 947096443 /nfs/dbraw/zinc/09/64/43/947096443.db2.gz IBERXOWWFISPEG-CSODHUTKSA-N 0 3 412.505 4.390 20 0 HIADHN Cc1csc(NC(=O)CN[C@H](c2cccc(C(F)(F)F)c2)C2CCOCC2)n1 ZINC000570230441 947154215 /nfs/dbraw/zinc/15/42/15/947154215.db2.gz CSJDREAVCJKWKM-KRWDZBQOSA-N 0 3 413.465 4.166 20 0 HIADHN CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC/C(C)=C/c1ccccc1OC(F)F ZINC000570321756 947201051 /nfs/dbraw/zinc/20/10/51/947201051.db2.gz SZNIHFWHAITIJD-RNTFSAEZSA-N 0 3 413.468 4.120 20 0 HIADHN COc1ccc([C@@H](Cc2ccccc2)NCC(=O)N(C)Cc2ccccc2OC)cc1 ZINC000570323955 947202492 /nfs/dbraw/zinc/20/24/92/947202492.db2.gz SGBSGRIMSDBSLA-XMMPIXPASA-N 0 3 418.537 4.236 20 0 HIADHN CC[C@@]1(CNCc2cn3ccc(Br)cc3n2)OCCc2ccccc21 ZINC000570438730 947248179 /nfs/dbraw/zinc/24/81/79/947248179.db2.gz MZMAIFYLQRYSNM-FQEVSTJZSA-N 0 3 400.320 4.065 20 0 HIADHN C[C@H](N[C@H]1CCN(C)[C@@H]1c1ccc(F)c(F)c1)C(=O)Nc1ccc(F)cc1Cl ZINC000570487427 947264459 /nfs/dbraw/zinc/26/44/59/947264459.db2.gz CGWHZCDXBKGMLJ-KQPNJSLMSA-N 0 3 411.855 4.119 20 0 HIADHN C[C@@H]1CN(CCOC2CCN(Cc3cnc(C4CCCCC4)s3)CC2)C[C@@H](C)O1 ZINC000570551708 947290405 /nfs/dbraw/zinc/29/04/05/947290405.db2.gz NGKOLKOEHOJCJT-RTBURBONSA-N 0 3 421.651 4.281 20 0 HIADHN Fc1ccc(CC2(NCc3cn(-c4ccc(F)cc4Cl)nn3)CCOCC2)cc1 ZINC000570829295 947362868 /nfs/dbraw/zinc/36/28/68/947362868.db2.gz IKOAOOMQYJADQM-UHFFFAOYSA-N 0 3 418.875 4.080 20 0 HIADHN C[C@H](Cc1ccccc1C(F)(F)F)N(C)S(=O)(=O)c1ccc(CN(C)C)cc1 ZINC000570855823 947369808 /nfs/dbraw/zinc/36/98/08/947369808.db2.gz YXQCRPPDLKSJQD-OAHLLOKOSA-N 0 3 414.493 4.019 20 0 HIADHN COc1ccc(F)c2[nH]c(C(=O)NC[C@@H](c3ccc(OC(C)C)cc3)N(C)C)cc21 ZINC000570878388 947380118 /nfs/dbraw/zinc/38/01/18/947380118.db2.gz DHUPWCFFJVBMMO-FQEVSTJZSA-N 0 3 413.493 4.136 20 0 HIADHN Cc1nn(C)c2sc([C@H](C)N[C@H]3CCCN([C@H](C)c4ccccc4F)C3=O)cc12 ZINC000571067145 947463591 /nfs/dbraw/zinc/46/35/91/947463591.db2.gz MSKBSOOUPAJYNC-KHYOSLBOSA-N 0 3 414.550 4.485 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1ccc(-n2cccn2)c(Cl)c1)c1ccco1 ZINC000571114812 947510759 /nfs/dbraw/zinc/51/07/59/947510759.db2.gz OJMOWMWLDUWCMO-WMLDXEAASA-N 0 3 401.898 4.370 20 0 HIADHN F[C@@]1(c2ccccc2)CCN(CC2(CN3CC[C@](F)(c4ccccc4)C3)COC2)C1 ZINC000571181604 947533206 /nfs/dbraw/zinc/53/32/06/947533206.db2.gz OYQDROLXMSIBAH-PLQXJYEYSA-N 0 3 412.524 4.144 20 0 HIADHN C[C@@H]1[C@H](NC(=O)CCc2ncc(-c3ccccc3F)o2)CCN1Cc1ccccc1 ZINC000571314426 947591816 /nfs/dbraw/zinc/59/18/16/947591816.db2.gz JMYGZCFFVCELAW-DYESRHJHSA-N 0 3 407.489 4.193 20 0 HIADHN COc1cc(Br)ccc1CN1C[C@H](c2ccccc2)[C@@H]2COCC[C@@H]21 ZINC000571412787 947636643 /nfs/dbraw/zinc/63/66/43/947636643.db2.gz AFNSEIZWSFNNTN-AABGKKOBSA-N 0 3 402.332 4.462 20 0 HIADHN Fc1cccc(CC2(NCc3cn(-c4ccc(F)c(Cl)c4)nn3)CCOCC2)c1 ZINC000571466137 947660772 /nfs/dbraw/zinc/66/07/72/947660772.db2.gz KITXIUIIZOBPAS-UHFFFAOYSA-N 0 3 418.875 4.080 20 0 HIADHN COc1ccc([C@H](C)N[C@H](C)C(=O)N2CCC[C@@H]2c2cccs2)c(C)c1OC ZINC000571590992 947720724 /nfs/dbraw/zinc/72/07/24/947720724.db2.gz GJWXTRYJLDKNKR-LZLYRXPVSA-N 0 3 402.560 4.477 20 0 HIADHN COCc1ncc(C(=O)N(CCN(C)Cc2ccccc2)Cc2ccccc2)s1 ZINC000571628457 947734355 /nfs/dbraw/zinc/73/43/55/947734355.db2.gz SIVSFNVGCDTQQI-UHFFFAOYSA-N 0 3 409.555 4.064 20 0 HIADHN CSc1ccc([C@@H](CNC(=O)c2ccc(F)cc2Br)N(C)C)cc1 ZINC000571664318 947739558 /nfs/dbraw/zinc/73/95/58/947739558.db2.gz OECXUIMJXJQMEK-QGZVFWFLSA-N 0 3 411.340 4.343 20 0 HIADHN COC(=O)c1ccccc1-c1ccc(CN[C@@H]2CCN(C(=O)Nc3ccccc3)C2)o1 ZINC000571704461 947754660 /nfs/dbraw/zinc/75/46/60/947754660.db2.gz YRXQOFXNPJCWCP-GOSISDBHSA-N 0 3 419.481 4.129 20 0 HIADHN CCN1CC[C@@H](NCc2cc(-c3cnn(C)c3C)no2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000571823375 947795461 /nfs/dbraw/zinc/79/54/61/947795461.db2.gz ZLSUWIXONRZJNA-CTNGQTDRSA-N 0 3 417.916 4.101 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N[C@H]2c3ccccc3CC23CCOCC3)C1 ZINC000571936272 947817214 /nfs/dbraw/zinc/81/72/14/947817214.db2.gz UNRJPMAEMBYLCZ-UCFCWBNQSA-N 0 3 419.569 4.215 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@@H](C)c1ccc2n[nH]cc2c1)c1cccc(OC)c1 ZINC000572025353 947830266 /nfs/dbraw/zinc/83/02/66/947830266.db2.gz BRELXEDVNGDVHI-KSFYIVLOSA-N 0 3 409.534 4.015 20 0 HIADHN FC(F)(F)c1cccc([C@H]2CCCN(Cc3cnc(N4CCOCC4)s3)C2)c1 ZINC000572205507 947863296 /nfs/dbraw/zinc/86/32/96/947863296.db2.gz MSDYRRPMLMNLMC-INIZCTEOSA-N 0 3 411.493 4.378 20 0 HIADHN O=[N+]([O-])c1ccc(-c2noc([C@H]3CN(Cc4ccccc4)CCC3(F)F)n2)s1 ZINC000572284502 947875899 /nfs/dbraw/zinc/87/58/99/947875899.db2.gz OTFYATINXQNNFA-CYBMUJFWSA-N 0 3 406.414 4.331 20 0 HIADHN CCNC(=O)Nc1cccc(NC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)c1C ZINC000572349633 947888247 /nfs/dbraw/zinc/88/82/47/947888247.db2.gz NLJBSOVUSUMAAL-SFHVURJKSA-N 0 3 412.509 4.126 20 0 HIADHN CCCN(C)[C@H](CNC(=O)c1cc2c(cc1F)NC(=O)CC2)c1ccc(Cl)cc1 ZINC000572370317 947890003 /nfs/dbraw/zinc/89/00/03/947890003.db2.gz LZKZKEBCTHEVOR-HXUWFJFHSA-N 0 3 417.912 4.177 20 0 HIADHN Cc1ccccc1C1(c2nc(-c3ccc(N4CCCN(C)CC4)nc3)no2)CCC1 ZINC000572745269 947999023 /nfs/dbraw/zinc/99/90/23/947999023.db2.gz LURJBNTWDXZXDB-UHFFFAOYSA-N 0 3 403.530 4.052 20 0 HIADHN COc1cccc([C@@H]2[C@H](N[C@@H](C)C(=O)Nc3ccc(C)cc3C)CCN2C2CC2)c1 ZINC000572902583 948033503 /nfs/dbraw/zinc/03/35/03/948033503.db2.gz ITTLZGXVHIBZDZ-NTUVXCKYSA-N 0 3 407.558 4.207 20 0 HIADHN Cc1cc(NC(=O)N2CCCc3occc3C2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000572917142 948039593 /nfs/dbraw/zinc/03/95/93/948039593.db2.gz ABCIFFFJPMWQPU-NRFANRHFSA-N 0 3 419.529 4.212 20 0 HIADHN C[C@@H](NC(=O)N(Cc1ccco1)C1CCN(C)CC1)c1ccc(Br)cc1 ZINC000572989564 948052973 /nfs/dbraw/zinc/05/29/73/948052973.db2.gz ULAKYUDHWBPHHR-OAHLLOKOSA-N 0 3 420.351 4.409 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(CN[C@H]3COc4ccc(F)cc4C3)c2)cc1 ZINC000573010507 948057078 /nfs/dbraw/zinc/05/70/78/948057078.db2.gz FEUCZVNBBUSOAH-OAQYLSRUSA-N 0 3 406.457 4.180 20 0 HIADHN CSc1ccc([C@@H](CNC(=O)c2cccc(Oc3cnccn3)c2)N(C)C)cc1 ZINC000573040043 948066916 /nfs/dbraw/zinc/06/69/16/948066916.db2.gz NIFDFOAQEJTLLN-HXUWFJFHSA-N 0 3 408.527 4.024 20 0 HIADHN Cc1ccc([C@@H](NC[C@H]2COc3ccccc32)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000573133337 948083628 /nfs/dbraw/zinc/08/36/28/948083628.db2.gz RJSGVJSDBXMIQU-GBXCKJPGSA-N 0 3 407.535 4.254 20 0 HIADHN Cc1cccc(NC(=O)N[C@H]2CCN(Cc3ccccc3)[C@@H]2C)c1C(=O)N1CCCC1 ZINC000573474727 948212548 /nfs/dbraw/zinc/21/25/48/948212548.db2.gz FRBXJIPVYWEMAT-CTNGQTDRSA-N 0 3 420.557 4.016 20 0 HIADHN CCN1CC[C@H](NCC(=O)N(C)Cc2ccccc2F)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000573627107 948254882 /nfs/dbraw/zinc/25/48/82/948254882.db2.gz CGTSWQJREGZLLJ-UNMCSNQZSA-N 0 3 421.919 4.002 20 0 HIADHN CSCC[C@H](N[C@@H]1CCCc2c3cc(Br)ccc3[nH]c21)C(=O)N(C)C ZINC000573759623 948291128 /nfs/dbraw/zinc/29/11/28/948291128.db2.gz WWVNSYSQUSSJEP-SJORKVTESA-N 0 3 424.408 4.107 20 0 HIADHN CC(C)c1nc(C2CCN(CCc3nc(-c4ccc(Cl)cc4)no3)CC2)no1 ZINC000573850951 948310139 /nfs/dbraw/zinc/31/01/39/948310139.db2.gz HUVOEHQVDHLSAY-UHFFFAOYSA-N 0 3 401.898 4.319 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)[C@H](C)Oc1ccc(Br)cc1)c1ccco1 ZINC000573875605 948316691 /nfs/dbraw/zinc/31/66/91/948316691.db2.gz VGKMCDHDCKPPKX-GRDNDAEWSA-N 0 3 409.324 4.055 20 0 HIADHN CC(C)(C)c1ncc(CNCc2ccccc2-c2ccc(Cn3cncn3)cc2)cn1 ZINC000573986865 948341736 /nfs/dbraw/zinc/34/17/36/948341736.db2.gz CBNSZNBEYHOWPR-UHFFFAOYSA-N 0 3 412.541 4.371 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)N[C@H]1c2ccccc2CC12CCOCC2 ZINC000574093964 948363687 /nfs/dbraw/zinc/36/36/87/948363687.db2.gz UNBGLJZZMGYTCC-ZEQRLZLVSA-N 0 3 419.569 4.217 20 0 HIADHN Cc1cc(NC(=O)[C@H]2CCCN(Cc3cccnc3)C2)cc(C)c1Br ZINC000574136606 948374697 /nfs/dbraw/zinc/37/46/97/948374697.db2.gz RVRNDYVNJNGBBQ-KRWDZBQOSA-N 0 3 402.336 4.312 20 0 HIADHN COc1ccc([C@@H](Cc2ccccc2)NS(=O)(=O)c2ccc(CN(C)C)cc2)cc1 ZINC000574243107 948396709 /nfs/dbraw/zinc/39/67/09/948396709.db2.gz MEJAWFLBSDXKGW-XMMPIXPASA-N 0 3 424.566 4.019 20 0 HIADHN COc1coc(CN[C@H]2CCN(C(C)(C)C)[C@H]2c2ccc(Cl)c(F)c2)cc1=O ZINC000574341604 948415945 /nfs/dbraw/zinc/41/59/45/948415945.db2.gz CSOIYIXVMCSCGU-PXNSSMCTSA-N 0 3 408.901 4.145 20 0 HIADHN CCOC(=O)c1nnc(C2CC[NH+](C/C(C)=C\c3cccc(C(F)(F)F)c3)CC2)[n-]1 ZINC000574559560 948474712 /nfs/dbraw/zinc/47/47/12/948474712.db2.gz YXIHQCMCRFNZEQ-KAMYIIQDSA-N 0 3 422.451 4.283 20 0 HIADHN CN(C(=O)CN[C@H]1c2ccccc2CC12CCOCC2)[C@H]1CCCc2ccccc21 ZINC000574560908 948474757 /nfs/dbraw/zinc/47/47/57/948474757.db2.gz VDGSJCADJLXXHH-ZCYQVOJMSA-N 0 3 404.554 4.206 20 0 HIADHN C/C=C\c1ccc(OC[C@@H](O)CNCc2cc(Br)cs2)c(OC)c1 ZINC000574772531 948522868 /nfs/dbraw/zinc/52/28/68/948522868.db2.gz QTXJMHGKDSTPCS-JZIMQPMSSA-N 0 3 412.349 4.082 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)c1cccc(C(=O)Nc2ccccc2)c1)c1ccco1 ZINC000575085409 948588380 /nfs/dbraw/zinc/58/83/80/948588380.db2.gz LYVMYBGSDFMKSM-LAUBAEHRSA-N 0 3 405.498 4.391 20 0 HIADHN COc1cc(CN(C)[C@H](C)[C@H]2Cc3ccccc3O2)cc(OC)c1OCC(F)F ZINC000575095106 948592100 /nfs/dbraw/zinc/59/21/00/948592100.db2.gz XCMRREXSCUJOSQ-RDTXWAMCSA-N 0 3 407.457 4.172 20 0 HIADHN COc1ccccc1CN(CCC(=O)Nc1cccc(Br)c1)C1CC1 ZINC000575555767 948678367 /nfs/dbraw/zinc/67/83/67/948678367.db2.gz JLNWENHSRUTSKT-UHFFFAOYSA-N 0 3 403.320 4.451 20 0 HIADHN COCCOCc1ccc(CNc2cccc(CN3CCSCC3)c2C)cc1 ZINC000575780871 948704521 /nfs/dbraw/zinc/70/45/21/948704521.db2.gz SLRNRPIDIHBBQP-UHFFFAOYSA-N 0 3 400.588 4.319 20 0 HIADHN C[C@H](NCc1ccc(C[S@@](C)=O)cc1)c1ccc(I)cc1 ZINC000575855705 948743548 /nfs/dbraw/zinc/74/35/48/948743548.db2.gz RKAAULWRWWFPDI-YEJXKQKISA-N 0 3 413.324 4.021 20 0 HIADHN CC(=O)N1C[C@@H]2CCC[C@H](N[C@H](C(=O)c3c[nH]c4ccccc34)c3ccccc3)[C@H]2C1 ZINC000575903201 948767280 /nfs/dbraw/zinc/76/72/80/948767280.db2.gz SNTMZQMXJHXADS-LHXUXXTBSA-N 0 3 415.537 4.329 20 0 HIADHN FC(F)(c1cnc(Cl)c(-c2ccc(Cl)cc2)c1)N1CC[C@@H]2NCCO[C@@H]2C1 ZINC001164391778 718826437 /nfs/dbraw/zinc/82/64/37/718826437.db2.gz XGGHSIYUKMYPTA-DLBZAZTESA-N 0 3 414.283 4.167 20 0 HIADHN FC(F)(c1cnc(Cl)nc1Cl)N1CCC[C@@H]2CN(Cc3ccccc3)C[C@@H]21 ZINC001164626447 719055024 /nfs/dbraw/zinc/05/50/24/719055024.db2.gz RFBZCFCRSAVZTF-ZBFHGGJFSA-N 0 3 413.299 4.429 20 0 HIADHN CC(C)N(C)Cc1nn(C(F)(F)c2ccc3ccnc(Cl)c3c2)c2c1CCNC2 ZINC001164681220 719618017 /nfs/dbraw/zinc/61/80/17/719618017.db2.gz DJKPHUQCXRGCON-UHFFFAOYSA-N 0 3 419.907 4.168 20 0 HIADHN Clc1cc2c(Cl)ccnc2c(N2CC[C@H]3[C@@H]2CCN3Cc2cccnc2)n1 ZINC001164727147 720378854 /nfs/dbraw/zinc/37/88/54/720378854.db2.gz QMUUMLYTZZGYEO-IRXDYDNUSA-N 0 3 400.313 4.185 20 0 HIADHN C[C@@H]1CCc2c(sc3ncnc(N4CC[C@H]5[C@H]4CCN5Cc4cccnc4)c23)C1 ZINC001164725075 720379719 /nfs/dbraw/zinc/37/97/19/720379719.db2.gz LPYPMRJFBOHDHA-AYOQOUSVSA-N 0 3 405.571 4.064 20 0 HIADHN c1cc2c(nc(-c3ccccn3)nc2N2CC[C@@H]3[C@@H]2CCN3Cc2cccnc2)s1 ZINC001164730592 720468797 /nfs/dbraw/zinc/46/87/97/720468797.db2.gz UOZXMRXHPBMXME-UXHICEINSA-N 0 3 414.538 4.002 20 0 HIADHN FC(F)c1nc2ccc(Cl)cc2c(N2CC[C@H]3[C@@H]2CCN3Cc2cccnc2)n1 ZINC001164724340 720470350 /nfs/dbraw/zinc/47/03/50/720470350.db2.gz FCLZPQUNFIHBCA-ROUUACIJSA-N 0 3 415.875 4.469 20 0 HIADHN Fc1ccc(F)c2c(N3CC[C@@H]4[C@H]3CCN4Cc3cccnc3)cc(Cl)nc12 ZINC001164727650 720481723 /nfs/dbraw/zinc/48/17/23/720481723.db2.gz NRMYJYQHMKUHGB-IAGOWNOFSA-N 0 3 400.860 4.415 20 0 HIADHN FC(F)(c1cnc(Cl)c(Cl)c1)N1CCCn2cnc(CNC3CCC3)c2C1 ZINC001164838914 720737251 /nfs/dbraw/zinc/73/72/51/720737251.db2.gz ZHWKQVDHUFPWDL-UHFFFAOYSA-N 0 3 416.303 4.182 20 0 HIADHN FC(F)(N1CCCn2cnc(CNC3CCC3)c2C1)C1(c2ccnc(Cl)c2)CC1 ZINC001164844326 720740683 /nfs/dbraw/zinc/74/06/83/720740683.db2.gz PURGQJXMRLNHQV-UHFFFAOYSA-N 0 3 421.923 4.104 20 0 HIADHN Cn1cc(CN2CC[C@H]3CN(c4cc(-c5ccccc5)cc(Cl)n4)C[C@@H]3C2)cn1 ZINC001164772255 721127617 /nfs/dbraw/zinc/12/76/17/721127617.db2.gz UUTKCVBAHINURE-FPOVZHCZSA-N 0 3 407.949 4.094 20 0 HIADHN Cc1cncc(COC[C@]23CCC[C@H]2CN(c2ccc(CN4CCCC4)cn2)C3)c1 ZINC001164804342 721601504 /nfs/dbraw/zinc/60/15/04/721601504.db2.gz YHBWPYBFWRMFIV-UKILVPOCSA-N 0 3 406.574 4.204 20 0 HIADHN FC1(F)CCN(c2nccc3c4c([nH]c32)CCC4)C[C@]12CCN(Cc1ccccn1)C2 ZINC001164909124 721736449 /nfs/dbraw/zinc/73/64/49/721736449.db2.gz BYKSQLMLYHJMME-HSZRJFAPSA-N 0 3 423.511 4.184 20 0 HIADHN Clc1cc(N2CC[C@@H]3CN(Cc4cccnc4)CCO[C@@H]3C2)c2ccccc2n1 ZINC001164980841 722099291 /nfs/dbraw/zinc/09/92/91/722099291.db2.gz KOQXWPCJAOXQQE-XMSQKQJNSA-N 0 3 408.933 4.011 20 0 HIADHN Cc1ccc(F)c2cc(C)c(N3CC[C@@H]4CN(Cc5cccnc5)CCO[C@@H]4C3)nc12 ZINC001164976439 722128355 /nfs/dbraw/zinc/12/83/55/722128355.db2.gz LOSMSEHBZJDKKZ-NFBKMPQASA-N 0 3 420.532 4.113 20 0 HIADHN Cc1cc(N2CC[C@H]3CN(Cc4cccnc4)CCO[C@H]3C2)nc2cc(Cl)ccc12 ZINC001164979006 722128840 /nfs/dbraw/zinc/12/88/40/722128840.db2.gz ORSBCEHIFOCWLE-CVDCTZTESA-N 0 3 422.960 4.319 20 0 HIADHN Cc1cc(N2CC[C@H]3CN(Cc4cccnc4)CCO[C@H]3C2)nc2c(Cl)cccc12 ZINC001164984658 722133131 /nfs/dbraw/zinc/13/31/31/722133131.db2.gz YGGYPQNWHBOKRV-UGKGYDQZSA-N 0 3 422.960 4.319 20 0 HIADHN Cc1ccc2c(C)cc(N3CC[C@H]4CN(Cc5cccnc5)CCO[C@H]4C3)nc2c1C ZINC001164982772 722144128 /nfs/dbraw/zinc/14/41/28/722144128.db2.gz SHXUQSRFTJICBL-UPVQGACJSA-N 0 3 416.569 4.282 20 0 HIADHN CC(C)c1nc(N2CC[C@@H]3CN(Cc4cccnc4)CCO[C@@H]3C2)cc(C(C)(C)C)n1 ZINC001164977984 722147892 /nfs/dbraw/zinc/14/78/92/722147892.db2.gz JBDYSLCFLXTQFF-NHCUHLMSSA-N 0 3 423.605 4.020 20 0 HIADHN CC(C)c1nc(N2CC[C@H]3CN(Cc4cccnc4)CCO[C@@H]3C2)cc(C(C)(C)C)n1 ZINC001164977982 722148186 /nfs/dbraw/zinc/14/81/86/722148186.db2.gz JBDYSLCFLXTQFF-LEWJYISDSA-N 0 3 423.605 4.020 20 0 HIADHN CCn1ccnc1[C@H]1CCCCN1C(=O)[C@H](C)N1CCC(Cc2ccccc2)CC1 ZINC000435991575 861270468 /nfs/dbraw/zinc/27/04/68/861270468.db2.gz JJDSZAWOEXMCNZ-NZQKXSOJSA-N 0 3 408.590 4.300 20 0 HIADHN O=C(Nc1ccc(Cl)c(CN2CCOCC2)c1)c1cccc(CN2CCCC2)c1 ZINC000436038459 861330216 /nfs/dbraw/zinc/33/02/16/861330216.db2.gz WUGBKWZPHVPDDL-UHFFFAOYSA-N 0 3 413.949 4.020 20 0 HIADHN Cc1csc(C(C#N)C(=O)CSc2nnc(Nc3cccc(C)c3)s2)n1 ZINC000006912904 845224272 /nfs/dbraw/zinc/22/42/72/845224272.db2.gz JPCFYLVLLFUKDR-CYBMUJFWSA-N 0 3 401.542 4.324 20 0 HIADHN O=C1c2ccccc2C(=O)N1C1CCC(NCc2coc(-c3ccccc3)n2)CC1 ZINC000436238943 861548443 /nfs/dbraw/zinc/54/84/43/861548443.db2.gz MZRDNCNYXUWEIY-UHFFFAOYSA-N 0 3 401.466 4.039 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc2c(c1)CCCC2)C(=O)Nc1ccc(N2CCOCC2)cc1 ZINC000007370717 845318112 /nfs/dbraw/zinc/31/81/12/845318112.db2.gz UJYMAGOEOYMQLA-OALUTQOASA-N 0 3 407.558 4.080 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc2c(c1)CCCC2)C(=O)Nc1ccc(N2CCOCC2)cc1 ZINC000007370728 845318231 /nfs/dbraw/zinc/31/82/31/845318231.db2.gz UJYMAGOEOYMQLA-RTBURBONSA-N 0 3 407.558 4.080 20 0 HIADHN CCOc1ccc(C(=O)CCC(=O)NCc2ccccc2CN2CCCCC2)cc1 ZINC000007850130 845430425 /nfs/dbraw/zinc/43/04/25/845430425.db2.gz DZZDYPHNBITNCW-UHFFFAOYSA-N 0 3 408.542 4.351 20 0 HIADHN O=C(CN1CCC[C@@H]1C1CCC1)N(Cc1nnc(-c2ccccc2Cl)o1)C1CC1 ZINC000436259843 861571589 /nfs/dbraw/zinc/57/15/89/861571589.db2.gz LRWFKXSNSUWJCF-LJQANCHMSA-N 0 3 414.937 4.146 20 0 HIADHN O=C(N[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)N[C@@H]1CCN(C2CC2)C1 ZINC000436261534 861572595 /nfs/dbraw/zinc/57/25/95/861572595.db2.gz PDIMLYGDYBACIM-HIFRSBDPSA-N 0 3 409.374 4.235 20 0 HIADHN CC(C)[C@@H](NCC(=O)Nc1sc2c(c1C(N)=O)CCCC2)c1ccc(Cl)cc1 ZINC000010137523 845623662 /nfs/dbraw/zinc/62/36/62/845623662.db2.gz YELOIQPUYVJQJU-LJQANCHMSA-N 0 3 419.978 4.305 20 0 HIADHN COCCC1(CNCc2csc(CNC(=O)c3ccccc3)n2)CCCCC1 ZINC000436290580 861595528 /nfs/dbraw/zinc/59/55/28/861595528.db2.gz ZIUBAKLAWHHFGD-UHFFFAOYSA-N 0 3 401.576 4.150 20 0 HIADHN CCCOc1ccc(C(=O)Nc2ccc(N3CCN(CC)CC3)cc2)cc1OCC ZINC000011944384 845843169 /nfs/dbraw/zinc/84/31/69/845843169.db2.gz KASBEWJMFCNFGQ-UHFFFAOYSA-N 0 3 411.546 4.268 20 0 HIADHN O=S(=O)(/C=C/c1ccc(Cl)cc1)NCc1ccccc1CN1CCCCC1 ZINC000015360786 846039785 /nfs/dbraw/zinc/03/97/85/846039785.db2.gz KOXUGBCBLSBJBY-NTCAYCPXSA-N 0 3 404.963 4.416 20 0 HIADHN CCc1ccc([C@H](NCC(=O)Nc2cc(OC)c(OC)c(OC)c2)C(C)C)cc1 ZINC000015522488 846058439 /nfs/dbraw/zinc/05/84/39/846058439.db2.gz PKGMGDMJYLHVFK-JOCHJYFZSA-N 0 3 400.519 4.200 20 0 HIADHN C[C@@H](c1ccc(-n2cncn2)cc1)N(C)Cc1cc(=O)oc2cc3c(cc12)CCC3 ZINC000017306111 846242634 /nfs/dbraw/zinc/24/26/34/846242634.db2.gz WGJWOMFRQKEZGP-INIZCTEOSA-N 0 3 400.482 4.055 20 0 HIADHN CCCCOc1ccc(CNCc2ccc(S(=O)(=O)N3CCCCC3)cc2)cc1 ZINC000017317625 846244758 /nfs/dbraw/zinc/24/47/58/846244758.db2.gz XLROBKDUPQXZFG-UHFFFAOYSA-N 0 3 416.587 4.330 20 0 HIADHN O=C(NC1CCN(Cc2ccccc2)CC1)c1cc(Br)ccc1Cl ZINC000017362931 846250712 /nfs/dbraw/zinc/25/07/12/846250712.db2.gz NWAQKWINURMSKL-UHFFFAOYSA-N 0 3 407.739 4.497 20 0 HIADHN Cc1sc2nc(C)nc(SCC(=O)NC[C@H](c3ccccc3)N(C)C)c2c1C ZINC000022622887 846595587 /nfs/dbraw/zinc/59/55/87/846595587.db2.gz XHQGRNZYIXFBFC-QGZVFWFLSA-N 0 3 414.600 4.128 20 0 HIADHN Cc1sc2nc(C)nc(SCC(=O)NC[C@@H](c3ccccc3)N(C)C)c2c1C ZINC000022622884 846595810 /nfs/dbraw/zinc/59/58/10/846595810.db2.gz XHQGRNZYIXFBFC-KRWDZBQOSA-N 0 3 414.600 4.128 20 0 HIADHN CC1CCN([C@@H](CNC(=O)CCc2nnc(-c3ccccc3)o2)c2cccs2)CC1 ZINC000022680983 846603322 /nfs/dbraw/zinc/60/33/22/846603322.db2.gz HTUYMFNVSJSGFV-IBGZPJMESA-N 0 3 424.570 4.320 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1sc(-c2ccccn2)nc1C)c1cccc(OC)c1 ZINC000022700729 846606247 /nfs/dbraw/zinc/60/62/47/846606247.db2.gz BRCOAYCFFLCBJJ-FQEVSTJZSA-N 0 3 424.570 4.335 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1ccc(Br)cc1)c1cccc(OC)c1 ZINC000022700474 846606345 /nfs/dbraw/zinc/60/63/45/846606345.db2.gz YXNCUQHNOAHKKJ-IBGZPJMESA-N 0 3 405.336 4.271 20 0 HIADHN COc1ccc2ccc(O)c(CN3CCN(Cc4cc(F)ccc4OC)CC3)c2c1 ZINC000022777857 846619740 /nfs/dbraw/zinc/61/97/40/846619740.db2.gz BWMNKYCMRPMFLQ-UHFFFAOYSA-N 0 3 410.489 4.020 20 0 HIADHN COc1ccc2ccc([O-])c(C[NH+]3CCN(Cc4cc(F)ccc4OC)CC3)c2c1 ZINC000022777857 846619745 /nfs/dbraw/zinc/61/97/45/846619745.db2.gz BWMNKYCMRPMFLQ-UHFFFAOYSA-N 0 3 410.489 4.020 20 0 HIADHN CCOc1cc(CN[C@H](C)c2cccc(Cl)c2)ccc1O[C@@H](C)C(=O)N(C)C ZINC000022781848 846620816 /nfs/dbraw/zinc/62/08/16/846620816.db2.gz DIGMOVZICCSIQB-CVEARBPZSA-N 0 3 404.938 4.445 20 0 HIADHN C[C@H]1CCN(C(=O)CN2CCCN(Cc3ccccc3)CC2)c2ccccc2S1 ZINC000022807245 846623620 /nfs/dbraw/zinc/62/36/20/846623620.db2.gz SBLKRFFWHZSCCP-FQEVSTJZSA-N 0 3 409.599 4.112 20 0 HIADHN O=C(CN1CCCN(Cc2ccccc2)CC1)Nc1ccc(OC(F)F)c(Cl)c1 ZINC000022807309 846623865 /nfs/dbraw/zinc/62/38/65/846623865.db2.gz FDOFROZBWLWZET-UHFFFAOYSA-N 0 3 423.891 4.088 20 0 HIADHN CCn1c(=S)n(CN2CCN(Cc3cccc4ccccc43)CC2)nc1C1CC1 ZINC000023475383 846705066 /nfs/dbraw/zinc/70/50/66/846705066.db2.gz LWCFARNBBNNNKQ-UHFFFAOYSA-N 0 3 407.587 4.240 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2C(=O)NCc2ccccc2CN(C)C)o1 ZINC000024084091 846786894 /nfs/dbraw/zinc/78/68/94/846786894.db2.gz JWPAWBWVYYVPKS-UHFFFAOYSA-N 0 3 414.509 4.432 20 0 HIADHN CCOC(=O)c1sc2ncnc(NC[C@H](c3cccc(F)c3)N(C)C)c2c1C ZINC000024107880 846791279 /nfs/dbraw/zinc/79/12/79/846791279.db2.gz XTJGXEKVZJEVCD-OAHLLOKOSA-N 0 3 402.495 4.030 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)c1ccc(OCc2cccnc2)cc1 ZINC000024556171 846837319 /nfs/dbraw/zinc/83/73/19/846837319.db2.gz YKDSVYRQHLRMFY-NRFANRHFSA-N 0 3 407.539 4.289 20 0 HIADHN C[C@H](C1CC1)N(CC(=O)Nc1cc(Cl)ccc1-n1cncn1)Cc1ccccc1 ZINC000024674027 846851823 /nfs/dbraw/zinc/85/18/23/846851823.db2.gz ZLGUOAIGYZYRRU-MRXNPFEDSA-N 0 3 409.921 4.160 20 0 HIADHN CN(CCC(=O)Nc1ccccc1C(=O)NC1CC1)Cc1ccc(Cl)c(Cl)c1 ZINC000024897786 846884300 /nfs/dbraw/zinc/88/43/00/846884300.db2.gz MGEAQCYZHXTBBI-UHFFFAOYSA-N 0 3 420.340 4.346 20 0 HIADHN O=C(NCCNCc1cn(-c2ccccc2)nc1-c1cccc(Cl)c1)c1ccco1 ZINC000025052410 846912981 /nfs/dbraw/zinc/91/29/81/846912981.db2.gz LIEGAXAYWKGEEN-UHFFFAOYSA-N 0 3 420.900 4.305 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)COc3cccc(C(F)(F)F)c3)c(C)c2)CC1 ZINC000025185612 846939346 /nfs/dbraw/zinc/93/93/46/846939346.db2.gz ZWMUFZJXUKPIOQ-UHFFFAOYSA-N 0 3 421.463 4.173 20 0 HIADHN CCN(Cc1ccc(OC)c(OC)c1)C[C@@H](O)COc1cc(Cl)ccc1Cl ZINC000025234713 846945040 /nfs/dbraw/zinc/94/50/40/846945040.db2.gz AKCRQGZBPPKJDU-MRXNPFEDSA-N 0 3 414.329 4.272 20 0 HIADHN Cc1ccc([C@@H](OC[C@H](O)CN(C)Cc2ccc3c(c2)OCO3)c2ccccc2)cc1 ZINC000025368605 846969234 /nfs/dbraw/zinc/96/92/34/846969234.db2.gz ZFVGOXGCGIWZGH-BVAGGSTKSA-N 0 3 419.521 4.323 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)c1c[nH]nc1-c1ccc(Cl)cc1 ZINC000025383975 846971384 /nfs/dbraw/zinc/97/13/84/846971384.db2.gz TWORCFJQCMSZCJ-QGZVFWFLSA-N 0 3 400.935 4.359 20 0 HIADHN CN(C)[C@@H](CNC(=O)c1ccccc1OCCOc1ccccc1)c1ccccc1 ZINC000025420613 846974954 /nfs/dbraw/zinc/97/49/54/846974954.db2.gz GFEJAGSQGUPVAZ-QHCPKHFHSA-N 0 3 404.510 4.177 20 0 HIADHN CN(C)[C@H](CNC(=O)c1ccccc1OCCOc1ccccc1)c1ccccc1 ZINC000025420617 846975399 /nfs/dbraw/zinc/97/53/99/846975399.db2.gz GFEJAGSQGUPVAZ-HSZRJFAPSA-N 0 3 404.510 4.177 20 0 HIADHN Cc1oc(-c2cccs2)nc1CC(=O)NC[C@H](C(C)C)N1CCc2ccccc2C1 ZINC000025540432 846996578 /nfs/dbraw/zinc/99/65/78/846996578.db2.gz XCZABGCYWGUMCW-OAQYLSRUSA-N 0 3 423.582 4.453 20 0 HIADHN COc1cc(C(C)=O)ccc1OC[C@H](O)CN[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000025664082 847017160 /nfs/dbraw/zinc/01/71/60/847017160.db2.gz YKZZHUBQNXTVNV-FZKQIMNGSA-N 0 3 411.420 4.007 20 0 HIADHN COc1ccc(C(=O)C2CCN(CCC(=O)Nc3ccccc3Cl)CC2)cc1 ZINC000025947106 847061263 /nfs/dbraw/zinc/06/12/63/847061263.db2.gz NVFDTELZODDZDR-UHFFFAOYSA-N 0 3 400.906 4.272 20 0 HIADHN Cn1c2ccc(C(F)(F)F)cc2nc1CNC[C@@]1(O)CCC[C@H](C(F)(F)F)C1 ZINC000436408769 861758160 /nfs/dbraw/zinc/75/81/60/861758160.db2.gz WWPPWEUCVVDULJ-BLLLJJGKSA-N 0 3 409.374 4.165 20 0 HIADHN Fc1ccc(Cn2cc(CN[C@H]3CCO[C@@H]3c3ccc(Cl)c(F)c3)cn2)cc1 ZINC000436408800 861759380 /nfs/dbraw/zinc/75/93/80/861759380.db2.gz LFTJZUVCTNPJMF-LEWJYISDSA-N 0 3 403.860 4.483 20 0 HIADHN COc1ccc2ccc([O-])c(C[N@@H+]3CCCN(C(=O)c4cccc(F)c4)CC3)c2c1 ZINC000026616840 847177019 /nfs/dbraw/zinc/17/70/19/847177019.db2.gz FQGKTMQGFAEILQ-UHFFFAOYSA-N 0 3 408.473 4.041 20 0 HIADHN COc1ccc2ccc([O-])c(C[N@H+]3CCCN(C(=O)c4cccc(F)c4)CC3)c2c1 ZINC000026616840 847177021 /nfs/dbraw/zinc/17/70/21/847177021.db2.gz FQGKTMQGFAEILQ-UHFFFAOYSA-N 0 3 408.473 4.041 20 0 HIADHN Cc1[nH]c2ccccc2c1C(=O)NCCCCN1CCN(c2cccc(C)c2)CC1 ZINC000026958906 847226594 /nfs/dbraw/zinc/22/65/94/847226594.db2.gz SIRIPIXKYLFPNL-UHFFFAOYSA-N 0 3 404.558 4.117 20 0 HIADHN Cc1noc2nc(C3CC3)cc(C(=O)N3CCCN(Cc4ccccc4C)CC3)c12 ZINC000027389312 847295112 /nfs/dbraw/zinc/29/51/12/847295112.db2.gz SJGICXPMBIULNR-UHFFFAOYSA-N 0 3 404.514 4.065 20 0 HIADHN CN(C)[C@H](CNC(=O)c1ccc(NC(=O)Nc2ccccc2)cc1)Cc1ccccc1 ZINC000027584072 847323905 /nfs/dbraw/zinc/32/39/05/847323905.db2.gz CNQNZEFXFLQJCO-QHCPKHFHSA-N 0 3 416.525 4.233 20 0 HIADHN Cc1noc(C)c1COc1ccccc1C(=O)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000027602575 847326249 /nfs/dbraw/zinc/32/62/49/847326249.db2.gz RAQNFYUTSKDFEI-QHCPKHFHSA-N 0 3 419.525 4.437 20 0 HIADHN O=C(c1cc(-c2ccc(Cl)cc2)[nH]n1)N1CCCN(Cc2ccc(F)cc2)CC1 ZINC000029091824 847502987 /nfs/dbraw/zinc/50/29/87/847502987.db2.gz UFWGKCYVOAZAHR-UHFFFAOYSA-N 0 3 412.896 4.217 20 0 HIADHN O=C(C1CCN(Cc2cn(-c3ccccc3)nc2-c2ccccc2)CC1)N1CCCC1 ZINC000029160308 847516707 /nfs/dbraw/zinc/51/67/07/847516707.db2.gz KIZBGPHJCFTLHS-UHFFFAOYSA-N 0 3 414.553 4.374 20 0 HIADHN CC(C)(C)OC(=O)NCc1ccc(C(=O)N[C@@H](CN2CCCC2)c2ccccc2)cc1 ZINC000029178660 847520702 /nfs/dbraw/zinc/52/07/02/847520702.db2.gz WNLIRDKEQMECCN-QFIPXVFZSA-N 0 3 423.557 4.278 20 0 HIADHN O=C(Cn1c2ccccc2nc1C(F)(F)F)N[C@H](CN1CCCC1)c1ccccc1 ZINC000029177817 847521027 /nfs/dbraw/zinc/52/10/27/847521027.db2.gz ITFWZNWWPOHAKO-GOSISDBHSA-N 0 3 416.447 4.008 20 0 HIADHN COc1ccc2ccccc2c1CNC(=O)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000029729774 847609882 /nfs/dbraw/zinc/60/98/82/847609882.db2.gz WGNWMCDOWJJZMM-QHCPKHFHSA-N 0 3 403.526 4.485 20 0 HIADHN CC(C)(CNC(=O)N[C@@H](c1ccccc1)c1ccccn1)N1CCc2ccccc2C1 ZINC000029731693 847610797 /nfs/dbraw/zinc/61/07/97/847610797.db2.gz RGSOLZYUCDYHHM-DEOSSOPVSA-N 0 3 414.553 4.307 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)c1ccc(OCc2ccncc2)cc1 ZINC000029754983 847613626 /nfs/dbraw/zinc/61/36/26/847613626.db2.gz NEQVISUJVRXYCN-DEOSSOPVSA-N 0 3 401.510 4.228 20 0 HIADHN O=C(CCN1CCCN(C(=O)c2ccccc2)CC1)Nc1cccc2ccccc21 ZINC000029842330 847630852 /nfs/dbraw/zinc/63/08/52/847630852.db2.gz HYBLBTKAUSYIPC-UHFFFAOYSA-N 0 3 401.510 4.017 20 0 HIADHN CC[C@H](CNC(=O)CCc1c(C)nn(CC(C)C)c1C)N1CCc2ccccc2C1 ZINC000029911100 847648223 /nfs/dbraw/zinc/64/82/23/847648223.db2.gz GCCPLQZXEVPDPA-HSZRJFAPSA-N 0 3 410.606 4.042 20 0 HIADHN Cc1ccc(NC(=O)[C@@H](NCCc2ccc3c(c2)OCCO3)c2ccccc2)cc1 ZINC000030007760 847669272 /nfs/dbraw/zinc/66/92/72/847669272.db2.gz IKFURLGEGLYLCH-DEOSSOPVSA-N 0 3 402.494 4.278 20 0 HIADHN CC(C)c1noc([C@@H](C)NCc2ccccc2CN2CCN(c3ccccc3)CC2)n1 ZINC000030512317 847726024 /nfs/dbraw/zinc/72/60/24/847726024.db2.gz WDUVBIOJLIMLHR-HXUWFJFHSA-N 0 3 419.573 4.366 20 0 HIADHN Cc1cc(CNCc2ccc(Cn3cncn3)cc2)cc(C)c1OCc1ccccn1 ZINC000030633848 847748519 /nfs/dbraw/zinc/74/85/19/847748519.db2.gz XZCRRMBYOSCCAA-UHFFFAOYSA-N 0 3 413.525 4.207 20 0 HIADHN CNC(=O)c1ccc(CNCc2ccc(OC(F)(F)[C@@H](F)C(F)(F)F)cc2)cc1 ZINC000030671823 847756525 /nfs/dbraw/zinc/75/65/25/847756525.db2.gz LFRWIGAJPQKRGL-KRWDZBQOSA-N 0 3 420.353 4.208 20 0 HIADHN Cc1ccccc1CN1CCCN([C@@H](C)C(=O)Nc2ccc(OC(F)F)cc2)CC1 ZINC000030970786 847802811 /nfs/dbraw/zinc/80/28/11/847802811.db2.gz CXGUDIIPZUGNER-SFHVURJKSA-N 0 3 417.500 4.131 20 0 HIADHN Cc1ccccc1CN1CCCN(C(=O)NCc2ccc(NC(=O)C(C)C)cc2)CC1 ZINC000031086172 847821072 /nfs/dbraw/zinc/82/10/72/847821072.db2.gz MKASAHRRQCGWIH-UHFFFAOYSA-N 0 3 422.573 4.007 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N[C@H](C)c1cc(OC)ccc1OC)c1ccsc1 ZINC000031193933 847839756 /nfs/dbraw/zinc/83/97/56/847839756.db2.gz MFBHIWQZOJMKNG-BEFAXECRSA-N 0 3 405.564 4.209 20 0 HIADHN CC1CCN([C@H](CNC(=O)CCCc2nc(C(C)(C)C)no2)c2cccs2)CC1 ZINC000031209209 847844552 /nfs/dbraw/zinc/84/45/52/847844552.db2.gz OYYYIVQZLJPZAS-QGZVFWFLSA-N 0 3 418.607 4.341 20 0 HIADHN C[C@H]1CCC[C@H](C)N1C(=O)COc1ccc(C(=O)Nc2ccccc2CN(C)C)cc1 ZINC000031232680 847848248 /nfs/dbraw/zinc/84/82/48/847848248.db2.gz KNHDKKRWDIKLFP-OALUTQOASA-N 0 3 423.557 4.169 20 0 HIADHN O=C(Cc1csc(Cc2ccccc2)n1)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000031541018 847903676 /nfs/dbraw/zinc/90/36/76/847903676.db2.gz ADTNZLDYEDNZBH-OAQYLSRUSA-N 0 3 405.567 4.057 20 0 HIADHN Cc1cccc(-c2nc(CC(=O)N[C@H]3CCCN(Cc4ccccc4)C3)cs2)c1 ZINC000031565567 847909015 /nfs/dbraw/zinc/90/90/15/847909015.db2.gz XWLXEEJOWWJLKV-NRFANRHFSA-N 0 3 405.567 4.442 20 0 HIADHN Cc1ccc(-c2nc(CC(=O)N[C@@H]3CCCN(Cc4ccccc4)C3)cs2)cc1 ZINC000031565521 847909116 /nfs/dbraw/zinc/90/91/16/847909116.db2.gz OPNNDNAGQHKMQU-OAQYLSRUSA-N 0 3 405.567 4.442 20 0 HIADHN Cc1ccc(-c2cnc(CCC(=O)NCC3(N4CCSCC4)CCCC3)o2)cc1 ZINC000031958531 847971871 /nfs/dbraw/zinc/97/18/71/847971871.db2.gz RNADTLWAAIZUGX-UHFFFAOYSA-N 0 3 413.587 4.060 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)c1cc(Br)ccc1Cl ZINC000031960576 847972195 /nfs/dbraw/zinc/97/21/95/847972195.db2.gz GOTDZGPQMKVDCG-UHFFFAOYSA-N 0 3 417.800 4.194 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Cn1c2ccccc2nc1C(F)(F)F)c1ccsc1 ZINC000031988689 847975861 /nfs/dbraw/zinc/97/58/61/847975861.db2.gz KPORCFXYTCFQFG-KRWDZBQOSA-N 0 3 424.492 4.316 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)[C@H](NC(=O)c1ccc(C)cc1)C(C)C)c1ccsc1 ZINC000031987895 847976018 /nfs/dbraw/zinc/97/60/18/847976018.db2.gz DJZGBANKFGFXLD-LEWJYISDSA-N 0 3 415.603 4.010 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1C(=O)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000032217494 847992098 /nfs/dbraw/zinc/99/20/98/847992098.db2.gz FBHYPOLAKJFCDF-QHCPKHFHSA-N 0 3 402.542 4.115 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cnn(-c4ccccc4C)c3C)c(C)c2)CC1 ZINC000032235522 847993508 /nfs/dbraw/zinc/99/35/08/847993508.db2.gz BNSKYRCNKIHSEK-UHFFFAOYSA-N 0 3 417.557 4.192 20 0 HIADHN CC[NH+]1CCC(n2nccc2NC(=O)c2cc(Oc3ccccc3)ccc2[O-])CC1 ZINC000436571542 861856022 /nfs/dbraw/zinc/85/60/22/861856022.db2.gz WAZAEUPVBLWEKA-UHFFFAOYSA-N 0 3 406.486 4.290 20 0 HIADHN CC(C)n1ncc2c1nc(C1CC1)cc2C(=O)NCCCN1CCc2ccccc2C1 ZINC000032400433 848018925 /nfs/dbraw/zinc/01/89/25/848018925.db2.gz UVPPKNAOGMSRRX-UHFFFAOYSA-N 0 3 417.557 4.068 20 0 HIADHN CC[C@@H](CNC(=O)/C=C/c1ccc(Br)o1)N1CCc2ccccc2C1 ZINC000032445841 848028938 /nfs/dbraw/zinc/02/89/38/848028938.db2.gz XYQUGYGGCFLSEU-VMSUTVGLSA-N 0 3 403.320 4.008 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)c1nn(-c2ccccc2F)c2c1CCC2 ZINC000032485283 848037727 /nfs/dbraw/zinc/03/77/27/848037727.db2.gz BKVQKAWTDDNOLJ-QHCPKHFHSA-N 0 3 418.516 4.067 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3c4c(nc5ccccc53)CCC4)cc2)CC1 ZINC000039496473 848185190 /nfs/dbraw/zinc/18/51/90/848185190.db2.gz ZCJYQUMVBGPWKJ-UHFFFAOYSA-N 0 3 400.526 4.118 20 0 HIADHN Cc1ccc(-c2nc(CC(=O)N3CCCN(Cc4ccccc4C)CC3)cs2)o1 ZINC000041314923 848210889 /nfs/dbraw/zinc/21/08/89/848210889.db2.gz ZZZDWNKLXPWTNV-UHFFFAOYSA-N 0 3 409.555 4.297 20 0 HIADHN CCOC(=O)N[C@H](C(=O)C(C#N)c1nc(-c2ccc(Cl)cc2)cs1)C(C)C ZINC000041514009 848224495 /nfs/dbraw/zinc/22/44/95/848224495.db2.gz VRURLLFUSCAQOA-ZBFHGGJFSA-N 0 3 405.907 4.410 20 0 HIADHN CC1CCN([C@H](CNC(=O)C2(c3ccccc3)CCOCC2)c2cccs2)CC1 ZINC000041774818 848249701 /nfs/dbraw/zinc/24/97/01/848249701.db2.gz FYUUOXFENJTDPB-OAQYLSRUSA-N 0 3 412.599 4.386 20 0 HIADHN COc1cc(-c2nc(CN3CCCC[C@@H]3[C@H]3CCCC[C@H]3O)cs2)ccc1O ZINC000436659800 861885177 /nfs/dbraw/zinc/88/51/77/861885177.db2.gz AZOPZUPFRBUVAW-GUDVDZBRSA-N 0 3 402.560 4.430 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@H](C)c1cccc(NC(C)=O)c1)c1ccsc1 ZINC000042346521 848320120 /nfs/dbraw/zinc/32/01/20/848320120.db2.gz JNVWIQWSKNYQGJ-FOIQADDNSA-N 0 3 402.564 4.150 20 0 HIADHN COc1cc(OC)c(NC(=O)N2CCCN(Cc3ccccc3C)CC2)cc1Cl ZINC000043413481 848421142 /nfs/dbraw/zinc/42/11/42/848421142.db2.gz DZBVQPCHELGAKI-UHFFFAOYSA-N 0 3 417.937 4.405 20 0 HIADHN CCc1ccc([C@H](CNC(=O)Nc2cccc(C(=O)N(CC)CC)c2)N(C)C)cc1 ZINC000043499233 848432066 /nfs/dbraw/zinc/43/20/66/848432066.db2.gz XGKQAXGOLHJTPH-QFIPXVFZSA-N 0 3 410.562 4.155 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1ccc(C(=O)N2CCCC2)cc1)c1ccsc1 ZINC000044014071 848499771 /nfs/dbraw/zinc/49/97/71/848499771.db2.gz TVUQUGCSIUVHOL-HXUWFJFHSA-N 0 3 414.575 4.189 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1ccc(NC(C)=O)c(C)c1)c1cccc(OC)c1 ZINC000044047819 848507345 /nfs/dbraw/zinc/50/73/45/848507345.db2.gz MXVYDCMWTMCZSA-JOCHJYFZSA-N 0 3 412.534 4.167 20 0 HIADHN CC(C)C(=O)Nc1cccc(NC(=O)NC[C@@H](c2cccs2)N2CCCC2)c1 ZINC000044084341 848512941 /nfs/dbraw/zinc/51/29/41/848512941.db2.gz RYPVGTWWAMJREX-SFHVURJKSA-N 0 3 400.548 4.301 20 0 HIADHN CN(C)C[C@@H]1CCc2ccccc2N1C(=O)Cc1csc(-c2cccc(F)c2)n1 ZINC000436727507 861914830 /nfs/dbraw/zinc/91/48/30/861914830.db2.gz ZFYUMNHVNLWNJQ-FQEVSTJZSA-N 0 3 409.530 4.401 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)Cc1ccc(NC(=O)OC(C)(C)C)cc1 ZINC000044390113 848555970 /nfs/dbraw/zinc/55/59/70/848555970.db2.gz PJWSYNRUYNXSEU-UHFFFAOYSA-N 0 3 411.546 4.167 20 0 HIADHN Cc1cc(O)c(C(C)C)cc1C(=O)N1CCC[C@@H](c2n[nH]cc2CN2CCCC2)C1 ZINC000436732758 861917824 /nfs/dbraw/zinc/91/78/24/861917824.db2.gz ALNMSQMGKGNEGP-GOSISDBHSA-N 0 3 410.562 4.163 20 0 HIADHN CC(=O)Nc1cc(C(=O)N[C@@H](CN2CCc3ccccc3C2)C(C)(C)C)ccc1C ZINC000044770436 848599918 /nfs/dbraw/zinc/59/99/18/848599918.db2.gz YIZMUNPMURILGA-QHCPKHFHSA-N 0 3 407.558 4.156 20 0 HIADHN Cc1noc(C)c1CSCC(=O)N[C@H](CN1CCc2ccccc2C1)C(C)(C)C ZINC000044770296 848599998 /nfs/dbraw/zinc/59/99/98/848599998.db2.gz MFBHQZXFHPTRCJ-OAQYLSRUSA-N 0 3 415.603 4.114 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1c(C)nn(C(C)(C)C)c1C)c1cccc(OC)c1 ZINC000045056290 848629459 /nfs/dbraw/zinc/62/94/59/848629459.db2.gz GZZAOCQCQWSOSO-FQEVSTJZSA-N 0 3 400.567 4.076 20 0 HIADHN CCc1ccc([C@H](CNC(=O)Nc2ccccc2CN(CC)C(C)=O)N(C)C)cc1 ZINC000045686185 848713793 /nfs/dbraw/zinc/71/37/93/848713793.db2.gz XDZQTLNFJQFWOD-QHCPKHFHSA-N 0 3 410.562 4.042 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)Cc2csc(Cc3ccccc3)n2)N(C)C)cc1 ZINC000046699505 848914059 /nfs/dbraw/zinc/91/40/59/848914059.db2.gz WHTXRUGWYQHFSU-JOCHJYFZSA-N 0 3 407.583 4.258 20 0 HIADHN CCN(CC)Cc1cccc(NC(=O)C(=O)c2c(C)nn(-c3ccccc3)c2C)c1 ZINC000046735943 848922717 /nfs/dbraw/zinc/92/27/17/848922717.db2.gz XPTMAKPLPLRSQM-UHFFFAOYSA-N 0 3 404.514 4.152 20 0 HIADHN N#CC(C(=O)C1CCN(C(=O)/C=C\c2ccccc2)CC1)c1ccc2ccccc2n1 ZINC000047376881 849035125 /nfs/dbraw/zinc/03/51/25/849035125.db2.gz OWHGHLSBMQTTCW-JQCPSUHGSA-N 0 3 409.489 4.363 20 0 HIADHN Cc1cc(C(=O)Nc2cccc(CN(C)C)c2)c2cnn(Cc3cccs3)c2n1 ZINC000047454056 849051061 /nfs/dbraw/zinc/05/10/61/849051061.db2.gz VCWJKFSPARMHQG-UHFFFAOYSA-N 0 3 405.527 4.163 20 0 HIADHN CCn1c(SCC(=O)Nc2ccccc2CN(C)C)nnc1-c1cccc(C)c1 ZINC000048174060 849185248 /nfs/dbraw/zinc/18/52/48/849185248.db2.gz TXTKNUYVWBCOKL-UHFFFAOYSA-N 0 3 409.559 4.066 20 0 HIADHN CCn1c(SCC(=O)Nc2ccccc2CN(C)C)nnc1-c1ccccc1C ZINC000048174224 849185720 /nfs/dbraw/zinc/18/57/20/849185720.db2.gz HEDLQQRWIRUEOI-UHFFFAOYSA-N 0 3 409.559 4.066 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1cc(NC(C)=O)ccc1C)c1cccc(OC)c1 ZINC000048274832 849202694 /nfs/dbraw/zinc/20/26/94/849202694.db2.gz ODCPUGNWBBCEAC-QFIPXVFZSA-N 0 3 412.534 4.167 20 0 HIADHN O=C(Nc1cccc(C(=O)NC[C@H](c2ccccc2)N2CCCC2)c1)c1ccco1 ZINC000048381680 849214737 /nfs/dbraw/zinc/21/47/37/849214737.db2.gz CAWOKMNCENQNIV-OAQYLSRUSA-N 0 3 403.482 4.099 20 0 HIADHN COc1ccc(NC(=O)NCC2(N3CCSCC3)CCCC2)c(C(F)(F)F)c1 ZINC000048550469 849242462 /nfs/dbraw/zinc/24/24/62/849242462.db2.gz MOTKFZHKPQOLBH-UHFFFAOYSA-N 0 3 417.497 4.197 20 0 HIADHN N#CC(C(=O)[C@@H]1CCCN(C(=O)c2ccc(F)cc2)C1)c1ccc2ccccc2n1 ZINC000048855294 849275190 /nfs/dbraw/zinc/27/51/90/849275190.db2.gz FTSZWTOUBNBPKT-UYAOXDASSA-N 0 3 401.441 4.103 20 0 HIADHN CC[C@H]([NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1)c1cc(Cl)ccc1OC ZINC000436826162 862007799 /nfs/dbraw/zinc/00/77/99/862007799.db2.gz GJCZTLBVZPWLPO-IBGZPJMESA-N 0 3 402.922 4.400 20 0 HIADHN C[C@H]([NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1)c1ccc(Br)cc1 ZINC000436826008 862008438 /nfs/dbraw/zinc/00/84/38/862008438.db2.gz GFSFRVDXUGNECJ-AWEZNQCLSA-N 0 3 403.320 4.110 20 0 HIADHN COc1cc(CN(C)C[C@H](O)c2ccc(C(F)(F)F)cc2)ccc1OC(F)F ZINC000051119228 849433350 /nfs/dbraw/zinc/43/33/50/849433350.db2.gz WBQTYLQUHQVDBG-HNNXBMFYSA-N 0 3 405.363 4.481 20 0 HIADHN COc1ccc(NC(=O)[C@H](C)N(C)C[C@@H]2CCCO[C@@H]2c2ccccc2)cc1OC ZINC000051132883 849434298 /nfs/dbraw/zinc/43/42/98/849434298.db2.gz PWYXLNFTYPVQQH-WCAVRKLYSA-N 0 3 412.530 4.131 20 0 HIADHN O=C(CN[C@@H](c1ccc(Cl)cc1)C1CC1)NCC1(c2ccccc2)CCOCC1 ZINC000052515404 849590356 /nfs/dbraw/zinc/59/03/56/849590356.db2.gz AHLSKFLSMJBJKG-HSZRJFAPSA-N 0 3 412.961 4.245 20 0 HIADHN CCc1cc2c(CNCc3ccccc3C[NH+]3CCCCC3)cc(=O)oc2cc1[O-] ZINC000052816759 849630646 /nfs/dbraw/zinc/63/06/46/849630646.db2.gz MFJGPXFNIUAURN-UHFFFAOYSA-N 0 3 406.526 4.337 20 0 HIADHN CN(Cc1cc(=O)n2cc(Br)ccc2n1)Cc1cccc2ccccc21 ZINC000053017100 849655257 /nfs/dbraw/zinc/65/52/57/849655257.db2.gz MNZUJDHAMLZQSD-UHFFFAOYSA-N 0 3 408.299 4.242 20 0 HIADHN Cc1nn(Cc2ccccc2Cl)c(C)c1C(=O)NCCN(C)Cc1ccccc1 ZINC000053349468 849698079 /nfs/dbraw/zinc/69/80/79/849698079.db2.gz UXWULUFCZALYAO-UHFFFAOYSA-N 0 3 410.949 4.063 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1ccc(CN2CCCCC2=O)cc1)c1ccsc1 ZINC000053501833 849722293 /nfs/dbraw/zinc/72/22/93/849722293.db2.gz VXMKWKCZKXYPKM-OAQYLSRUSA-N 0 3 413.587 4.074 20 0 HIADHN CC1CCN([C@@H](CNC(=O)N(C)Cc2ccc3c(c2)OCO3)c2cccs2)CC1 ZINC000053537117 849727479 /nfs/dbraw/zinc/72/74/79/849727479.db2.gz UPTCHKMIEYAYFJ-SFHVURJKSA-N 0 3 415.559 4.091 20 0 HIADHN O=C(NCc1coc(-c2cccs2)n1)NC[C@H](c1cccs1)N1CCCC1 ZINC000054376765 849854244 /nfs/dbraw/zinc/85/42/44/849854244.db2.gz OPOSHALBMOQLFM-OAHLLOKOSA-N 0 3 402.545 4.101 20 0 HIADHN CCc1ccccc1NC(=O)CNC1(c2ccc(Br)cc2)CCOCC1 ZINC000054394295 849859273 /nfs/dbraw/zinc/85/92/73/849859273.db2.gz AVDVBOXPFNGQEM-UHFFFAOYSA-N 0 3 417.347 4.246 20 0 HIADHN CC1CCN(CCNC(=O)Cc2csc(-c3ccc(C(F)(F)F)cc3)n2)CC1 ZINC000054779802 849921561 /nfs/dbraw/zinc/92/15/61/849921561.db2.gz UPRYUXSZMBCSPV-UHFFFAOYSA-N 0 3 411.493 4.220 20 0 HIADHN O=C(c1cccc(CN2CCCN(Cc3ccc(F)cc3)CC2)c1)N1CCCCC1 ZINC000054808473 849925760 /nfs/dbraw/zinc/92/57/60/849925760.db2.gz HXMGZCHCOHFZKO-UHFFFAOYSA-N 0 3 409.549 4.160 20 0 HIADHN C[C@@H](c1ccc(-n2cncn2)cc1)N(C)Cc1cccc(C(=O)N2CCCCC2)c1 ZINC000054808085 849926153 /nfs/dbraw/zinc/92/61/53/849926153.db2.gz FCVMSEZNURBPBK-IBGZPJMESA-N 0 3 403.530 4.086 20 0 HIADHN Cc1cc(C(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)c(C)n1Cc1ccccn1 ZINC000056168645 850269043 /nfs/dbraw/zinc/26/90/43/850269043.db2.gz OAXMCYCHBYYULB-WMZHIEFXSA-N 0 3 402.542 4.114 20 0 HIADHN CCN1CCN(c2ccc(N[C@H](C)C(=O)N[C@H](C)c3ccccc3C)c(C)c2)CC1 ZINC000056170383 850270090 /nfs/dbraw/zinc/27/00/90/850270090.db2.gz FIVYMTMTKGNNSL-NHCUHLMSSA-N 0 3 408.590 4.123 20 0 HIADHN CCN1CCN(c2ccc(N[C@@H](C)C(=O)Nc3cc(Cl)ccc3F)c(C)c2)CC1 ZINC000056170396 850270583 /nfs/dbraw/zinc/27/05/83/850270583.db2.gz RQDLEIHXBOJELV-INIZCTEOSA-N 0 3 418.944 4.369 20 0 HIADHN O=C(c1ccccc1[O-])N1CCC([NH2+][C@H](C[C@H]2CCCO2)c2ccc(F)cc2)CC1 ZINC000436942054 862119265 /nfs/dbraw/zinc/11/92/65/862119265.db2.gz UBAPXCODZDJFCG-IFMALSPDSA-N 0 3 412.505 4.036 20 0 HIADHN Cc1c(C(=O)Nc2cccc(CN3CCC(C(N)=O)CC3)c2)oc2c1c(C)ccc2C ZINC000056413374 850353396 /nfs/dbraw/zinc/35/33/96/850353396.db2.gz LSXLBRSYWGBQDH-UHFFFAOYSA-N 0 3 419.525 4.308 20 0 HIADHN Cc1ccsc1CNC(=O)N(CCN(C)C)Cc1ccc(Br)cc1 ZINC000056661610 850436415 /nfs/dbraw/zinc/43/64/15/850436415.db2.gz GJRMBZUYFGESDC-UHFFFAOYSA-N 0 3 410.381 4.092 20 0 HIADHN CC(=O)Nc1c(C)ccc(NC(=O)NC[C@H](c2cccs2)N2CCCC2)c1C ZINC000056691472 850440555 /nfs/dbraw/zinc/44/05/55/850440555.db2.gz BTUMMTUORPTBCG-GOSISDBHSA-N 0 3 400.548 4.282 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCc1ccc(N2CCCC2)cc1)c1cccc(OC)c1 ZINC000057562156 850669027 /nfs/dbraw/zinc/66/90/27/850669027.db2.gz PNJVFIANUHYRDY-DEOSSOPVSA-N 0 3 424.589 4.178 20 0 HIADHN CN(C)CCN(CCc1ccccc1)C(=O)Nc1ccc(F)cc1Br ZINC000057757368 850709730 /nfs/dbraw/zinc/70/97/30/850709730.db2.gz RNFOENZJHBYOSI-UHFFFAOYSA-N 0 3 408.315 4.226 20 0 HIADHN O=C(Nc1ccc(F)cc1Br)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000057758331 850710084 /nfs/dbraw/zinc/71/00/84/850710084.db2.gz NYPYRNFCHUOYNY-INIZCTEOSA-N 0 3 406.299 4.374 20 0 HIADHN CN(C)CCn1c2cc(NC(=O)Cc3ccc(-c4ccccc4)cc3)ccc2oc1=O ZINC000058737510 850907988 /nfs/dbraw/zinc/90/79/88/850907988.db2.gz UECQZHFHJGEJQZ-UHFFFAOYSA-N 0 3 415.493 4.004 20 0 HIADHN CC(=O)c1cccc(OCCCC(=O)N2CCCN(Cc3ccccc3C)CC2)c1 ZINC000058804722 850932792 /nfs/dbraw/zinc/93/27/92/850932792.db2.gz JVJSBVIAPAWNGZ-UHFFFAOYSA-N 0 3 408.542 4.091 20 0 HIADHN COc1ccc(C2(C(=O)NC3CCN(Cc4cccc(OC)c4)CC3)CCCC2)cc1 ZINC000058820138 850937889 /nfs/dbraw/zinc/93/78/89/850937889.db2.gz ATCKPVRJDMTIOT-UHFFFAOYSA-N 0 3 422.569 4.296 20 0 HIADHN COc1cc(NC(=O)NC[C@H](c2cccs2)N2CCCC2)c(OC)cc1Cl ZINC000058863396 850946965 /nfs/dbraw/zinc/94/69/65/850946965.db2.gz NETOOLGGPOTWHU-OAHLLOKOSA-N 0 3 409.939 4.377 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)CCC(=O)c3cc(C)ccc3C)cc2)CC1 ZINC000058954380 850967910 /nfs/dbraw/zinc/96/79/10/850967910.db2.gz PTCUVCOWTIVOMO-UHFFFAOYSA-N 0 3 407.558 4.043 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)c1cccc(OCc2cccnc2)c1 ZINC000059000913 850976635 /nfs/dbraw/zinc/97/66/35/850976635.db2.gz SRNDAUMUDROXEO-UHFFFAOYSA-N 0 3 407.489 4.004 20 0 HIADHN CCCOc1c(Cl)cc(C(=O)N(CCN(C)C)Cc2ccccc2F)cc1OC ZINC000059923833 851024127 /nfs/dbraw/zinc/02/41/27/851024127.db2.gz ZIENZMNSWSFIPH-UHFFFAOYSA-N 0 3 422.928 4.481 20 0 HIADHN COc1cc2c(cc1OC)[C@H](c1ccccc1)N(CCC(=O)NC1CCCC1)CC2 ZINC000059931225 851026112 /nfs/dbraw/zinc/02/61/12/851026112.db2.gz HQVKUHKNYMKDMD-VWLOTQADSA-N 0 3 408.542 4.100 20 0 HIADHN COc1ccc(-c2nc(C(=O)N[C@H]3CCN([C@@H](C)c4ccccc4)C3)cs2)cc1 ZINC000059989737 851029535 /nfs/dbraw/zinc/02/95/35/851029535.db2.gz MLLPRZCUGFYJOB-LPHOPBHVSA-N 0 3 407.539 4.384 20 0 HIADHN Cc1ccc([C@H](CNC(=O)C2(c3cccc(Cl)c3)CCOCC2)N(C)C)cc1 ZINC000060155620 851045757 /nfs/dbraw/zinc/04/57/57/851045757.db2.gz FQTRFRRSHLXKKT-NRFANRHFSA-N 0 3 400.950 4.116 20 0 HIADHN COc1ccc(N(C(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)C(C)C)cc1F ZINC000060353533 851074292 /nfs/dbraw/zinc/07/42/92/851074292.db2.gz RZLIZYGGIPNZTL-UHFFFAOYSA-N 0 3 413.537 4.420 20 0 HIADHN CCn1c2ccccc2nc1SCC(=O)NC[C@H](c1ccccc1)N1CCCC1 ZINC000060391021 851086708 /nfs/dbraw/zinc/08/67/08/851086708.db2.gz LYDYBUNHLGGERK-OAQYLSRUSA-N 0 3 408.571 4.102 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)CCc2ncc(-c3ccccc3Cl)o2)o1 ZINC000060407366 851089449 /nfs/dbraw/zinc/08/94/49/851089449.db2.gz KACQHHILONPVIN-UHFFFAOYSA-N 0 3 415.921 4.419 20 0 HIADHN CN(C)[C@H](CNC(=O)C(C)(C)c1ccc(Br)cc1)Cc1ccccc1 ZINC000060489927 851117585 /nfs/dbraw/zinc/11/75/85/851117585.db2.gz QYXORJJKJNSMTF-IBGZPJMESA-N 0 3 403.364 4.016 20 0 HIADHN COc1cc(Cl)c(C)cc1NC(=O)[C@H](C)N1CCN(CC2CCCCC2)CC1 ZINC000060569202 851150619 /nfs/dbraw/zinc/15/06/19/851150619.db2.gz GDBZYRQSXSVWSI-KRWDZBQOSA-N 0 3 407.986 4.182 20 0 HIADHN O=C(CN1CCN(CC2CCCCC2)CC1)Nc1nc(-c2ccc(F)cc2)cs1 ZINC000060569178 851150931 /nfs/dbraw/zinc/15/09/31/851150931.db2.gz PSLOAOJENWVWNE-UHFFFAOYSA-N 0 3 416.566 4.086 20 0 HIADHN Cc1c([O-])ccc2c(CNc3ccc(CC[NH+]4CCSCC4)cc3)cc(=O)oc12 ZINC000060926561 851250506 /nfs/dbraw/zinc/25/05/06/851250506.db2.gz GAWQZCYQFZEGIM-UHFFFAOYSA-N 0 3 410.539 4.010 20 0 HIADHN COc1cc([C@@H](C)NC(=O)NC[C@@H](Cc2ccccc2)N(C)C)ccc1OC(C)C ZINC000061195466 851315133 /nfs/dbraw/zinc/31/51/33/851315133.db2.gz WZCUULPNVAHHBU-WIYYLYMNSA-N 0 3 413.562 4.016 20 0 HIADHN CN(C)[C@H](CNC(=O)N[C@@H](c1cccs1)c1ccc(F)cc1)Cc1ccccc1 ZINC000061195819 851315245 /nfs/dbraw/zinc/31/52/45/851315245.db2.gz NBBOLBQZJUXCFJ-RBBKRZOGSA-N 0 3 411.546 4.449 20 0 HIADHN O=C(NCc1ccc(Br)s1)NC[C@H](c1ccccc1)N1CCCC1 ZINC000061230525 851323651 /nfs/dbraw/zinc/32/36/51/851323651.db2.gz CVXYVTKUETVZLX-MRXNPFEDSA-N 0 3 408.365 4.147 20 0 HIADHN O=C(NCc1cccc(NC(=O)C2CCC2)c1)NC[C@H](c1ccccc1)N1CCCC1 ZINC000061230860 851324394 /nfs/dbraw/zinc/32/43/94/851324394.db2.gz AMOXRRUQUQFEBJ-HSZRJFAPSA-N 0 3 420.557 4.062 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000061289726 851339300 /nfs/dbraw/zinc/33/93/00/851339300.db2.gz HMVQHDQKEHOOGZ-UHFFFAOYSA-N 0 3 405.907 4.092 20 0 HIADHN COc1ccc(C(=O)CCC(=O)NCc2ccccc2CN2CCC(C)CC2)cc1 ZINC000061401335 851367098 /nfs/dbraw/zinc/36/70/98/851367098.db2.gz OZUDAXYYOLEZJH-UHFFFAOYSA-N 0 3 408.542 4.206 20 0 HIADHN Cc1nc2ccccc2n1CCNCc1cc(Br)ccc1OC(F)F ZINC000061556766 851404586 /nfs/dbraw/zinc/40/45/86/851404586.db2.gz YOWVXDDXCNZXKX-UHFFFAOYSA-N 0 3 410.262 4.498 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)c1cccn1Cc1cccs1 ZINC000061572047 851408779 /nfs/dbraw/zinc/40/87/79/851408779.db2.gz GUNWBHZCJGHGKY-UHFFFAOYSA-N 0 3 411.596 4.442 20 0 HIADHN O=C(NC[C@@H]1CN2CCC[C@H]2CO1)c1cccc(Oc2cccc(C(F)(F)F)c2)c1 ZINC000061649809 851419882 /nfs/dbraw/zinc/41/98/82/851419882.db2.gz ODGUNKCJQQNEFH-FXAWDEMLSA-N 0 3 420.431 4.091 20 0 HIADHN CCc1oc2ccccc2c1CNCc1ccc(S(=O)(=O)N(CC)CC)cc1 ZINC000061743466 851436716 /nfs/dbraw/zinc/43/67/16/851436716.db2.gz VYJLAFLBQSJNEH-UHFFFAOYSA-N 0 3 400.544 4.316 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2ccc(C(=O)NC(C)C)cc2C)N2CCCC2)cc1 ZINC000061775943 851447670 /nfs/dbraw/zinc/44/76/70/851447670.db2.gz AGURMKYKNMNWOZ-QHCPKHFHSA-N 0 3 422.573 4.400 20 0 HIADHN O=C(NCCc1ccc(Cl)cc1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000061792665 851454237 /nfs/dbraw/zinc/45/42/37/851454237.db2.gz FQGYNLZMJGICKA-UHFFFAOYSA-N 0 3 403.979 4.296 20 0 HIADHN COCCN(Cc1cccs1)C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000061793184 851455305 /nfs/dbraw/zinc/45/53/05/851455305.db2.gz CTJSITDZZYDSCF-UHFFFAOYSA-N 0 3 419.616 4.020 20 0 HIADHN Cc1ccc(OCCN(C)C(=O)Nc2ccc(CCN3CCSCC3)cc2)cc1 ZINC000061792916 851455521 /nfs/dbraw/zinc/45/55/21/851455521.db2.gz XSXOCYLXERGYAJ-UHFFFAOYSA-N 0 3 413.587 4.129 20 0 HIADHN C[C@@H]1c2ccsc2CCN1C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000061792998 851455723 /nfs/dbraw/zinc/45/57/23/851455723.db2.gz DZHDOVCMUZPIBF-MRXNPFEDSA-N 0 3 401.601 4.491 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCc1ccc(N2CCCC2)cc1)c1ccsc1 ZINC000061941496 851475772 /nfs/dbraw/zinc/47/57/72/851475772.db2.gz UXDJAXHIXKMOBV-NRFANRHFSA-N 0 3 400.592 4.231 20 0 HIADHN C[C@H](NC(=O)NCC1(N2CCSCC2)CCCC1)c1cccc(OC(F)F)c1 ZINC000061966533 851482459 /nfs/dbraw/zinc/48/24/59/851482459.db2.gz HXVTUMKEQHZMLC-HNNXBMFYSA-N 0 3 413.534 4.010 20 0 HIADHN CCCC(=O)Nc1ccc(CNC(=O)NCC(C)(C)N2CCc3ccccc3C2)cc1 ZINC000061981893 851487008 /nfs/dbraw/zinc/48/70/08/851487008.db2.gz JWDXVVXLIZYTCP-UHFFFAOYSA-N 0 3 422.573 4.061 20 0 HIADHN O=C(NC[C@@H]1CCCCN1Cc1ccccc1)C1(c2ccc(F)cc2)CCOCC1 ZINC000062227882 851511071 /nfs/dbraw/zinc/51/10/71/851511071.db2.gz TUIIKBKZHWKOLA-QHCPKHFHSA-N 0 3 410.533 4.045 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000062374087 851531833 /nfs/dbraw/zinc/53/18/33/851531833.db2.gz BLNAOVXNNHKCOX-UHFFFAOYSA-N 0 3 411.289 4.497 20 0 HIADHN CCCC(=O)Nc1cccc(NC(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)c1 ZINC000062400755 851541712 /nfs/dbraw/zinc/54/17/12/851541712.db2.gz ZUVFWSAPFGSYGE-UHFFFAOYSA-N 0 3 418.488 4.299 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)Nc1nnc(-c2ccsc2)s1 ZINC000062406807 851544258 /nfs/dbraw/zinc/54/42/58/851544258.db2.gz RKWDLVVVGAYXMS-UHFFFAOYSA-N 0 3 405.524 4.001 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)Nc1cccc(COCC2CC2)c1 ZINC000062411772 851546679 /nfs/dbraw/zinc/54/66/79/851546679.db2.gz CMUAOFZANXWCJF-UHFFFAOYSA-N 0 3 417.500 4.487 20 0 HIADHN Cc1cc(Oc2ncccn2)ccc1NC(=O)N(CCN(C)C)Cc1cccc(F)c1 ZINC000062411835 851546904 /nfs/dbraw/zinc/54/69/04/851546904.db2.gz XBSJYJXUINFPBW-UHFFFAOYSA-N 0 3 423.492 4.312 20 0 HIADHN Cc1c(C(=O)N(C)C[C@@H]2CCN(Cc3ccccc3)C2)[nH]c2c1C(=O)CC(C)(C)C2 ZINC000437058893 862255453 /nfs/dbraw/zinc/25/54/53/862255453.db2.gz XZOVIIKIVKWHSK-IBGZPJMESA-N 0 3 407.558 4.072 20 0 HIADHN C[C@@H](NCc1ccc(OCc2ccccc2)cc1)c1cccc(NS(C)(=O)=O)c1 ZINC000062421205 851549250 /nfs/dbraw/zinc/54/92/50/851549250.db2.gz QPVIAFYYHTXTHA-GOSISDBHSA-N 0 3 410.539 4.488 20 0 HIADHN COc1ccc([C@H](NC(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)C(C)C)cc1 ZINC000062476211 851558734 /nfs/dbraw/zinc/55/87/34/851558734.db2.gz ASLQXMYMDHAICW-JOCHJYFZSA-N 0 3 419.516 4.444 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)NCCCn1ccc2ccccc21 ZINC000062473472 851558981 /nfs/dbraw/zinc/55/89/81/851558981.db2.gz XRBNTBVPVPTPOW-UHFFFAOYSA-N 0 3 414.500 4.083 20 0 HIADHN CC(C)Oc1ccc(CNC(=O)N(CCN(C)C)Cc2cccc(Cl)c2)cc1 ZINC000062478556 851560055 /nfs/dbraw/zinc/56/00/55/851560055.db2.gz UEGNIGAUUAGYPG-UHFFFAOYSA-N 0 3 403.954 4.401 20 0 HIADHN COc1cccc(CCNC(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)c1 ZINC000062484549 851563128 /nfs/dbraw/zinc/56/31/28/851563128.db2.gz ZEEKYKGFAZSOKF-UHFFFAOYSA-N 0 3 423.479 4.030 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)N[C@@H](c1ccccc1)C(F)(F)F ZINC000062487120 851563892 /nfs/dbraw/zinc/56/38/92/851563892.db2.gz DLENNTQBIPWIID-SFHVURJKSA-N 0 3 415.406 4.342 20 0 HIADHN CC(C)Oc1ccccc1CNC(=O)N(CCN(C)C)Cc1ccc(F)cc1F ZINC000062498981 851565821 /nfs/dbraw/zinc/56/58/21/851565821.db2.gz AIGSNTIEJJWMLS-UHFFFAOYSA-N 0 3 405.489 4.025 20 0 HIADHN COc1ccc(CC[C@@H](C)NC(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)cc1 ZINC000062503231 851565923 /nfs/dbraw/zinc/56/59/23/851565923.db2.gz DRASQKVUJXXOIP-QGZVFWFLSA-N 0 3 419.516 4.068 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)C(=O)Nc1ccccc1-c1ccccc1 ZINC000062593743 851579798 /nfs/dbraw/zinc/57/97/98/851579798.db2.gz QISPNUATNFIHTK-UHFFFAOYSA-N 0 3 419.500 4.022 20 0 HIADHN COc1ccccc1C(C)(C)CNC(=S)NC1CCN(Cc2ccccc2)CC1 ZINC000062863161 851591528 /nfs/dbraw/zinc/59/15/28/851591528.db2.gz LOFDUBSTZRBABH-UHFFFAOYSA-N 0 3 411.615 4.102 20 0 HIADHN FC(F)(F)CN(Cc1ccco1)C(=S)NC1CCN(Cc2ccccc2)CC1 ZINC000063144739 851619769 /nfs/dbraw/zinc/61/97/69/851619769.db2.gz NVIPYWFKXWZDCB-UHFFFAOYSA-N 0 3 411.493 4.183 20 0 HIADHN S=C(NCc1ccc(Br)s1)NC1CCN(Cc2ccccc2)CC1 ZINC000063147930 851622339 /nfs/dbraw/zinc/62/23/39/851622339.db2.gz IRKBNVTZOGCADB-UHFFFAOYSA-N 0 3 424.433 4.139 20 0 HIADHN Fc1ccc2c(c1)[C@H](NC(=S)NC1CCN(Cc3ccccc3)CC1)CCCO2 ZINC000063150868 851623365 /nfs/dbraw/zinc/62/33/65/851623365.db2.gz KGQCSXIUSIGTDV-OAQYLSRUSA-N 0 3 413.562 4.168 20 0 HIADHN C[C@H]1CCCCN1CCNC(=O)C(=O)Nc1ccccc1Oc1ccc(Cl)cc1 ZINC000063204758 851632531 /nfs/dbraw/zinc/63/25/31/851632531.db2.gz KBGRRCRBCACVMD-INIZCTEOSA-N 0 3 415.921 4.061 20 0 HIADHN CCN(CC)c1ccc(/C=[NH+]/C[C@H](O)COc2cccc(Cl)c2Cl)c([O-])c1 ZINC000063427777 851686618 /nfs/dbraw/zinc/68/66/18/851686618.db2.gz GKHQTEMBCQUTAH-IMQYADFFSA-N 0 3 411.329 4.404 20 0 HIADHN CN(Cc1ccc(OC(F)F)cc1)C[C@@H](O)COc1cccc(C(F)(F)F)c1 ZINC000063482263 851701429 /nfs/dbraw/zinc/70/14/29/851701429.db2.gz SETRYWSOFKEAIM-OAHLLOKOSA-N 0 3 405.363 4.179 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)c2ccc(NC(=O)OC(C)(C)C)cc2)o1 ZINC000063497813 851703632 /nfs/dbraw/zinc/70/36/32/851703632.db2.gz CLWDEGNJIFMCAN-UHFFFAOYSA-N 0 3 401.507 4.139 20 0 HIADHN CCc1oc2ccccc2c1CNCc1ccc(CS(=O)(=O)NC(C)C)cc1 ZINC000063549797 851713289 /nfs/dbraw/zinc/71/32/89/851713289.db2.gz DXPOSRNOKBSLBS-UHFFFAOYSA-N 0 3 400.544 4.113 20 0 HIADHN C[C@@H]1CN(C(=O)c2ccc(CNCc3ccc(C(F)(F)F)cc3)cc2)C[C@@H](C)O1 ZINC000063561825 851714680 /nfs/dbraw/zinc/71/46/80/851714680.db2.gz WLECWGPQXSKIIE-HZPDHXFCSA-N 0 3 406.448 4.245 20 0 HIADHN O[C@@H](CNCc1ccc(F)c(Br)c1)COc1cccc(Cl)c1Cl ZINC000063566049 851715528 /nfs/dbraw/zinc/71/55/28/851715528.db2.gz WOLMUKHOHQMRRB-NSHDSACASA-N 0 3 423.109 4.425 20 0 HIADHN O=C(CCC(=O)c1ccc2c(c1)CCC2)NC[C@H]1CCCN(Cc2ccccc2)C1 ZINC000063702480 851744407 /nfs/dbraw/zinc/74/44/07/851744407.db2.gz VFXWZILUBYQOMU-OAQYLSRUSA-N 0 3 404.554 4.167 20 0 HIADHN Cc1cccc(-n2ncc(C(=O)N3CCCN(C(C)(C)C)CC3)c2C(F)(F)F)c1 ZINC000063723422 851748859 /nfs/dbraw/zinc/74/88/59/851748859.db2.gz BAGBNCRUKRZOHM-UHFFFAOYSA-N 0 3 408.468 4.146 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)c1c[nH]cc1-c1ccc(Cl)s1 ZINC000063915738 851793522 /nfs/dbraw/zinc/79/35/22/851793522.db2.gz IIYBQYSYQFWHIA-UHFFFAOYSA-N 0 3 410.008 4.488 20 0 HIADHN Cc1ccc2nc([C@@H]3CCCN3C(=O)NC[C@@H](c3ccc(F)cc3)N(C)C)[nH]c2c1 ZINC000064225105 851851493 /nfs/dbraw/zinc/85/14/93/851851493.db2.gz KMVIIDKCSOPXAT-SFTDATJTSA-N 0 3 409.509 4.160 20 0 HIADHN Cc1ccc([C@H](CNC(=O)NCc2ncc(-c3ccccc3)o2)N2CCCC2)cc1 ZINC000064237203 851855208 /nfs/dbraw/zinc/85/52/08/851855208.db2.gz HSYLUDNERRSODB-NRFANRHFSA-N 0 3 404.514 4.286 20 0 HIADHN Cc1ccc([C@H](CNC(=O)NCc2csc(Br)c2)N2CCCC2)cc1 ZINC000064237204 851855339 /nfs/dbraw/zinc/85/53/39/851855339.db2.gz HIGMRFBQOGJWLO-KRWDZBQOSA-N 0 3 422.392 4.455 20 0 HIADHN COc1ccc(OC)c([C@H](C)NC(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)c1 ZINC000064237365 851855427 /nfs/dbraw/zinc/85/54/27/851855427.db2.gz ANAWYSGJDSHGRV-AVRDEDQJSA-N 0 3 411.546 4.210 20 0 HIADHN CCN(C[C@H](O)COc1ccc(C(C)=O)cc1OC)[C@@H](C)c1cc2ccccc2o1 ZINC000064348815 851876663 /nfs/dbraw/zinc/87/66/63/851876663.db2.gz JKTXKVQXHNBXDD-JXFKEZNVSA-N 0 3 411.498 4.467 20 0 HIADHN COCc1cccc(NC(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)c1 ZINC000064529601 851921056 /nfs/dbraw/zinc/92/10/56/851921056.db2.gz DQPIWPQKJXJQKW-UHFFFAOYSA-N 0 3 409.452 4.448 20 0 HIADHN CCCC(=O)N1CCC[C@@H]1C(=O)C(C#N)c1nc(-c2c(F)cccc2F)cs1 ZINC000064715412 851964843 /nfs/dbraw/zinc/96/48/43/851964843.db2.gz QPXRVLAMQBGFGC-MLGOLLRUSA-N 0 3 403.454 4.056 20 0 HIADHN COCc1cccc(CNC(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)c1 ZINC000064755597 851977624 /nfs/dbraw/zinc/97/76/24/851977624.db2.gz VSHFPPSLWJZYGN-UHFFFAOYSA-N 0 3 423.479 4.125 20 0 HIADHN COC(=O)Nc1ccc(CNC(=O)CN2CCC[C@H]2c2cccc3ccccc32)cc1 ZINC000064791833 851985915 /nfs/dbraw/zinc/98/59/15/851985915.db2.gz YVRJQCQQNHETGY-QHCPKHFHSA-N 0 3 417.509 4.471 20 0 HIADHN C[C@H](Sc1ccc(Br)cc1)C(=O)NCCN(C)Cc1ccccc1 ZINC000064805198 851987348 /nfs/dbraw/zinc/98/73/48/851987348.db2.gz WRWDRJNALXKTGM-HNNXBMFYSA-N 0 3 407.377 4.178 20 0 HIADHN COc1ccc(CCN(Cc2ccccc2)Cc2cc(=O)n3cc(C)ccc3n2)cc1 ZINC000064807295 851989389 /nfs/dbraw/zinc/98/93/89/851989389.db2.gz KKASMLBGUDOXAO-UHFFFAOYSA-N 0 3 413.521 4.256 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1c[nH]c2ncccc12)c1ccc(C(F)(F)F)cc1 ZINC000065121599 852070405 /nfs/dbraw/zinc/07/04/05/852070405.db2.gz PMBYTRAOYQMIEV-GOSISDBHSA-N 0 3 404.436 4.395 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)COc1ccccc1OC)c1ccc(C(F)(F)F)cc1 ZINC000065121944 852071786 /nfs/dbraw/zinc/07/17/86/852071786.db2.gz BXLNDLRUDFPAKR-SFHVURJKSA-N 0 3 424.463 4.292 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)COc2ccc(Cl)c3cccnc23)C1 ZINC000065140340 852076035 /nfs/dbraw/zinc/07/60/35/852076035.db2.gz WLLDKLICXADIEG-AEFFLSMTSA-N 0 3 409.917 4.219 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)CCc2ccccc2Br)C1 ZINC000065141110 852076422 /nfs/dbraw/zinc/07/64/22/852076422.db2.gz ZLKPMWZXSBFYEW-APWZRJJASA-N 0 3 401.348 4.333 20 0 HIADHN CCOC(=O)C1=C(C)NC(SC[C@@H](O)c2cccc(F)c2)=N[C@@H]1c1ccccc1 ZINC000065271026 852096579 /nfs/dbraw/zinc/09/65/79/852096579.db2.gz VCITZOODUKUECZ-UYAOXDASSA-N 0 3 414.502 4.130 20 0 HIADHN Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000065377010 852116621 /nfs/dbraw/zinc/11/66/21/852116621.db2.gz VOPJVVUSHLRHMN-QHCPKHFHSA-N 0 3 422.573 4.339 20 0 HIADHN CCC(C)(C)NC(=O)c1ccc(NC(=O)N2CCN(CC3CCCCC3)CC2)cc1 ZINC000065413477 852123304 /nfs/dbraw/zinc/12/33/04/852123304.db2.gz DVENYUIVIIZKBN-UHFFFAOYSA-N 0 3 414.594 4.335 20 0 HIADHN O=C(Nc1cc(F)c(N2CCCC2)c(F)c1)N1CCN(CC2CCCCC2)CC1 ZINC000065413651 852123653 /nfs/dbraw/zinc/12/36/53/852123653.db2.gz LWRBVNVVSBZIOS-UHFFFAOYSA-N 0 3 406.521 4.295 20 0 HIADHN COCCOc1ccc(NC(=O)NC[C@@H](c2ccc(C)cc2)N(C)C)cc1Cl ZINC000065415890 852124515 /nfs/dbraw/zinc/12/45/15/852124515.db2.gz RECIKDPILLTFKW-IBGZPJMESA-N 0 3 405.926 4.098 20 0 HIADHN CNC(=O)c1ccc(CNCc2ccc(Oc3cc(OC)cc(OC)c3)cc2)cc1 ZINC000065428792 852129271 /nfs/dbraw/zinc/12/92/71/852129271.db2.gz JQVIMTBGOYPLIV-UHFFFAOYSA-N 0 3 406.482 4.146 20 0 HIADHN Cc1cc(NC(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)n(Cc2ccccc2)n1 ZINC000065442793 852135135 /nfs/dbraw/zinc/13/51/35/852135135.db2.gz VUYNPGBGMACJRY-KNQAVFIVSA-N 0 3 403.530 4.197 20 0 HIADHN CN(CCNC(=O)Nc1ccccc1C(=O)N(C)C1CCCCC1)Cc1ccccc1 ZINC000065450672 852138637 /nfs/dbraw/zinc/13/86/37/852138637.db2.gz OXUIEKXSFCZEKB-UHFFFAOYSA-N 0 3 422.573 4.345 20 0 HIADHN CC[C@@H](C)NC(=O)c1ccc(NC(=O)NC[C@H](CC)N2CCc3ccccc3C2)cc1 ZINC000065458172 852141497 /nfs/dbraw/zinc/14/14/97/852141497.db2.gz ZFCOKIUMYJXOIY-JPYJTQIMSA-N 0 3 422.573 4.173 20 0 HIADHN COc1cccc(CN2CCC(NC(=O)c3cc(-c4ccc(Cl)cc4)n[nH]3)CC2)c1 ZINC000065506411 852160951 /nfs/dbraw/zinc/16/09/51/852160951.db2.gz QNUKEOCBEUAQRX-UHFFFAOYSA-N 0 3 424.932 4.133 20 0 HIADHN O=C(CNC1(c2cccc(Br)c2)CCOCC1)NC1CCCCCCC1 ZINC000065604391 852196024 /nfs/dbraw/zinc/19/60/24/852196024.db2.gz JJOWTBMWTUHVSM-UHFFFAOYSA-N 0 3 423.395 4.274 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)Nc1cccnc1Cl ZINC000065828603 852271700 /nfs/dbraw/zinc/27/17/00/852271700.db2.gz COIKOPWRDRWKIO-UHFFFAOYSA-N 0 3 400.832 4.350 20 0 HIADHN Cc1noc2nc(-c3ccc(F)cc3)cc(C(=O)NCCN(C)Cc3ccccc3)c12 ZINC000065834257 852275455 /nfs/dbraw/zinc/27/54/55/852275455.db2.gz KUJDBNGWDOIKFB-UHFFFAOYSA-N 0 3 418.472 4.199 20 0 HIADHN CCOc1ccc([C@@H](C)NC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)cc1OC ZINC000065866506 852290951 /nfs/dbraw/zinc/29/09/51/852290951.db2.gz ONIFYVXOHNWPIM-XLIONFOSSA-N 0 3 414.521 4.322 20 0 HIADHN COCCOc1ccc(NC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)c(C)c1 ZINC000065873110 852296367 /nfs/dbraw/zinc/29/63/67/852296367.db2.gz JAENCPCMALLZRZ-IBGZPJMESA-N 0 3 400.494 4.010 20 0 HIADHN COCCOc1ccc(NC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)cc1Cl ZINC000065876193 852297359 /nfs/dbraw/zinc/29/73/59/852297359.db2.gz JUZBEOQXRACOIT-KRWDZBQOSA-N 0 3 420.912 4.355 20 0 HIADHN C[C@H](NC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1)c1ccc(N2CCCC2=O)cc1 ZINC000065898828 852308267 /nfs/dbraw/zinc/30/82/67/852308267.db2.gz XUZNXMHATBQPMX-RXVVDRJESA-N 0 3 423.532 4.042 20 0 HIADHN CN(C)CCN(Cc1cccc(C#N)c1)C(=O)c1cccc(NC(=O)OC(C)(C)C)c1 ZINC000065931048 852321862 /nfs/dbraw/zinc/32/18/62/852321862.db2.gz UHHFHRATMUJTSY-UHFFFAOYSA-N 0 3 422.529 4.109 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)CSc1nc2ccccc2s1 ZINC000065931391 852322457 /nfs/dbraw/zinc/32/24/57/852322457.db2.gz WVVLLBUZDCSTJB-UHFFFAOYSA-N 0 3 403.548 4.118 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)Cc1ccc(Cl)c(Cl)c1 ZINC000065938183 852326262 /nfs/dbraw/zinc/32/62/62/852326262.db2.gz YZMXSNNBWCDIAO-UHFFFAOYSA-N 0 3 401.284 4.405 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)c1cc(-c2ccc(Cl)s2)on1 ZINC000065939540 852328335 /nfs/dbraw/zinc/32/83/35/852328335.db2.gz TYJHQJXXMBDBDF-UHFFFAOYSA-N 0 3 407.898 4.400 20 0 HIADHN O=C(NCc1cc(Br)cs1)NC[C@H](c1ccccc1)N1CCCC1 ZINC000071919671 852431474 /nfs/dbraw/zinc/43/14/74/852431474.db2.gz WVJMMTQIFKXMNW-QGZVFWFLSA-N 0 3 408.365 4.147 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)N2CCC[C@@H]2c2ccc3c(c2)OCCO3)N(C)C)cc1 ZINC000071923233 852432459 /nfs/dbraw/zinc/43/24/59/852432459.db2.gz AJJRWUMASWKZDC-FGZHOGPDSA-N 0 3 423.557 4.170 20 0 HIADHN CC1CCN([C@H](CNC(=O)Cc2csc(-c3cccnc3)n2)c2ccccc2)CC1 ZINC000072006578 852462297 /nfs/dbraw/zinc/46/22/97/852462297.db2.gz OHFZTVSWCPNRRY-JOCHJYFZSA-N 0 3 420.582 4.337 20 0 HIADHN Cc1ccc(-c2nc(CCNC(=O)NC[C@@H](c3cccs3)N3CCCC3)co2)cc1 ZINC000072083947 852501560 /nfs/dbraw/zinc/50/15/60/852501560.db2.gz HOWYZLQYFWYDQQ-FQEVSTJZSA-N 0 3 424.570 4.390 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)Cc1c[nH]c2cc(Cl)ccc12 ZINC000072094501 852507703 /nfs/dbraw/zinc/50/77/03/852507703.db2.gz ATXHTFZHCMMQIF-UHFFFAOYSA-N 0 3 405.876 4.232 20 0 HIADHN CCc1ccc(-c2noc(CNc3ccccc3CN3CCC(CO)CC3)n2)cc1 ZINC000078404941 852513144 /nfs/dbraw/zinc/51/31/44/852513144.db2.gz ZIXFHPTWZYGOPJ-UHFFFAOYSA-N 0 3 406.530 4.115 20 0 HIADHN O=C(Nc1ccccc1)C1CCN(CCOc2cccc(Br)c2)CC1 ZINC000096956146 852563167 /nfs/dbraw/zinc/56/31/67/852563167.db2.gz IPFCEIWFBDWDIQ-UHFFFAOYSA-N 0 3 403.320 4.179 20 0 HIADHN CSc1nc(-c2ccco2)nc(C)c1C(=O)NC[C@H](c1ccccc1)N1CCCC1 ZINC000097089771 852581841 /nfs/dbraw/zinc/58/18/41/852581841.db2.gz HFGUZQIDJAVRDU-GOSISDBHSA-N 0 3 422.554 4.334 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)c2cc(C)n(Cc3ccccn3)c2C)N(C)C)cc1 ZINC000097285724 852596517 /nfs/dbraw/zinc/59/65/17/852596517.db2.gz ADDBBACZUBLLBP-XMMPIXPASA-N 0 3 404.558 4.143 20 0 HIADHN O[C@H](CNCc1ccc(OCc2ccccc2)c(Br)c1)c1ccco1 ZINC000097287512 852597576 /nfs/dbraw/zinc/59/75/76/852597576.db2.gz YNLVHMCJVKBSOG-GOSISDBHSA-N 0 3 402.288 4.444 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)N1CCCCC[C@@H]1c1ccncc1 ZINC000097438571 852612919 /nfs/dbraw/zinc/61/29/19/852612919.db2.gz BOOJCERBECWOJK-HXUWFJFHSA-N 0 3 402.608 4.070 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)Nc1cccc(C[S@](=O)C(C)(C)C)c1 ZINC000097573806 852634427 /nfs/dbraw/zinc/63/44/27/852634427.db2.gz CCLPKXOWXXZFQL-GDLZYMKVSA-N 0 3 415.603 4.330 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(Cl)cc2)CC1)c1ccc(OC(F)F)cc1 ZINC000097590246 852639623 /nfs/dbraw/zinc/63/96/23/852639623.db2.gz TVMRDCHBZIMUKZ-UHFFFAOYSA-N 0 3 424.875 4.215 20 0 HIADHN CCOc1cc2c(cc1/C=C/C(=O)N1CCCN(Cc3ccccc3)CC1)O[C@@H](C)C2 ZINC000105307245 852697388 /nfs/dbraw/zinc/69/73/88/852697388.db2.gz GHGVAFRSBQKXRF-CFGKVWFZSA-N 0 3 420.553 4.156 20 0 HIADHN CC(C)[C@@H]1CN(C(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)CCS1 ZINC000437202344 862392111 /nfs/dbraw/zinc/39/21/11/862392111.db2.gz LLVYMEXRNLHCMC-PKOBYXMFSA-N 0 3 400.510 4.041 20 0 HIADHN C[C@@H]1CCCN(CCNC(=O)c2cnn(-c3cccc(C(F)(F)F)c3)c2C2CC2)C1 ZINC000107632023 852783212 /nfs/dbraw/zinc/78/32/12/852783212.db2.gz FBNVPQQFCGBJSH-OAHLLOKOSA-N 0 3 420.479 4.230 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cc(F)cc2nc(C)c(C)nc21)c1cccc(OC)c1 ZINC000108064560 852820206 /nfs/dbraw/zinc/82/02/06/852820206.db2.gz FDIBMHYVWSPPRF-QFIPXVFZSA-N 0 3 424.520 4.207 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)c3cc(-c4ccc(C)cc4)no3)cc2)CC1 ZINC000108147347 852826044 /nfs/dbraw/zinc/82/60/44/852826044.db2.gz DPRHDNLHRNNOTA-UHFFFAOYSA-N 0 3 404.514 4.040 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)c3c(C)oc4ccc(OC)cc43)cc2)CC1 ZINC000108143546 852826158 /nfs/dbraw/zinc/82/61/58/852826158.db2.gz CPQOUDSBNILIBS-UHFFFAOYSA-N 0 3 407.514 4.140 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Cc1ccc(F)c(Br)c1)c1ccsc1 ZINC000108316782 852838296 /nfs/dbraw/zinc/83/82/96/852838296.db2.gz CIKTVIKRORLUKB-QGZVFWFLSA-N 0 3 413.356 4.392 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cccn1Cc1cccs1)c1cccc(OC)c1 ZINC000108467464 852853503 /nfs/dbraw/zinc/85/35/03/852853503.db2.gz CGZVDOXACYSHQS-QFIPXVFZSA-N 0 3 411.571 4.419 20 0 HIADHN O=C(Cc1cn(-c2ccccc2)nc1-c1ccc(Cl)cc1)N[C@H]1CCN(C2CC2)C1 ZINC000109029129 852911014 /nfs/dbraw/zinc/91/10/14/852911014.db2.gz OYCYCONIZBAQBR-FQEVSTJZSA-N 0 3 420.944 4.088 20 0 HIADHN Cc1ccccc1-n1nc(C(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)c2c1CCC2 ZINC000109183071 852931911 /nfs/dbraw/zinc/93/19/11/852931911.db2.gz QEYZODNMDWWFRW-FPOVZHCZSA-N 0 3 414.553 4.235 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)[C@H]1COc2ccc(Cl)cc2C1 ZINC000109498923 852977065 /nfs/dbraw/zinc/97/70/65/852977065.db2.gz RDJKEZNHRDVWFM-GOSISDBHSA-N 0 3 416.974 4.121 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2cc(Br)ccc2F)N2CCCC2)cc1 ZINC000109504174 852978740 /nfs/dbraw/zinc/97/87/40/852978740.db2.gz DRCKPIGKHDQSGO-IBGZPJMESA-N 0 3 405.311 4.464 20 0 HIADHN Cc1nc(COc2ccc(Cl)cc2)sc1C(=O)N1CCC[C@@H]1CN1CCCC1 ZINC000109687903 852999488 /nfs/dbraw/zinc/99/94/88/852999488.db2.gz PRCORAISHLYMKY-QGZVFWFLSA-N 0 3 419.978 4.384 20 0 HIADHN Cc1cc(NC(=O)c2cccc(F)c2)sc1C(=O)N1CCC[C@@H]1CN1CCCC1 ZINC000109688416 852999767 /nfs/dbraw/zinc/99/97/67/852999767.db2.gz KGNXTVIRBPCTEI-GOSISDBHSA-N 0 3 415.534 4.148 20 0 HIADHN COc1cccc(C[C@H]2CCCN2C(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)c1 ZINC000109900213 853031537 /nfs/dbraw/zinc/03/15/37/853031537.db2.gz WLOGOEYFNHIKRP-XMMPIXPASA-N 0 3 421.585 4.073 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)CSc3ccc(C(C)(C)C)cc3)CC2)C[C@H](C)O1 ZINC000110416845 853097387 /nfs/dbraw/zinc/09/73/87/853097387.db2.gz LGSCAVFOAHZXFA-KDURUIRLSA-N 0 3 418.647 4.424 20 0 HIADHN Cc1c2cc(Cl)ccc2oc1C(=O)N1CCC(CN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000110456869 853102183 /nfs/dbraw/zinc/10/21/83/853102183.db2.gz WWWMBQJIJUJOIP-GJZGRUSLSA-N 0 3 404.938 4.356 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)c3ccccc3Oc3ccccc3)CC2)C[C@H](C)O1 ZINC000110457575 853102360 /nfs/dbraw/zinc/10/23/60/853102360.db2.gz LLSXILXCUBADMF-PMACEKPBSA-N 0 3 408.542 4.440 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)CSc3ccc4ccccc4c3)CC2)C[C@@H](C)O1 ZINC000110456273 853102432 /nfs/dbraw/zinc/10/24/32/853102432.db2.gz ISQRXWZNGYQITI-RTBURBONSA-N 0 3 412.599 4.280 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3sc(CC(C)C)nc3C)c(C)c2)CC1 ZINC000110591921 853124184 /nfs/dbraw/zinc/12/41/84/853124184.db2.gz BETQXERYBURAIB-UHFFFAOYSA-N 0 3 400.592 4.353 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3ccccc3N3CCCCC3)CC2)C[C@@H](C)O1 ZINC000110720095 853143973 /nfs/dbraw/zinc/14/39/73/853143973.db2.gz FWNSGARLCHBOJK-WOJBJXKFSA-N 0 3 414.594 4.030 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)Nc3ccc(-c4nccs4)cc3)CC2)C[C@H](C)O1 ZINC000110723266 853144975 /nfs/dbraw/zinc/14/49/75/853144975.db2.gz DVIACHVDMWMXSV-IRXDYDNUSA-N 0 3 414.575 4.163 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3ccc4[nH]c(C(F)F)nc4c3)c(C)c2)CC1 ZINC000110946405 853172141 /nfs/dbraw/zinc/17/21/41/853172141.db2.gz UDKQLHTUKUFBMK-UHFFFAOYSA-N 0 3 413.472 4.203 20 0 HIADHN CC(C)(C)OC(=O)NC1CCN(CCC(=O)Nc2c(Cl)cccc2Cl)CC1 ZINC000110981999 853178530 /nfs/dbraw/zinc/17/85/30/853178530.db2.gz UURRGWSXCMSHAP-UHFFFAOYSA-N 0 3 416.349 4.311 20 0 HIADHN O=C(Nc1ccc(Cl)cn1)[C@H]1CCCN(Cc2ccc(OC(F)(F)F)cc2)C1 ZINC000110983798 853179389 /nfs/dbraw/zinc/17/93/89/853179389.db2.gz NKHCTTPDARITHI-AWEZNQCLSA-N 0 3 413.827 4.484 20 0 HIADHN C[C@H](NC(C)(C)CNS(=O)(=O)Cc1cccc(C(F)(F)F)c1)c1ccccc1 ZINC000111049853 853194503 /nfs/dbraw/zinc/19/45/03/853194503.db2.gz DCSGYIYUEDMTNX-HNNXBMFYSA-N 0 3 414.493 4.254 20 0 HIADHN C[C@H]1Cc2ccccc2N1Cc1occc1C(=O)NCc1ccccc1CN(C)C ZINC000111151014 853211273 /nfs/dbraw/zinc/21/12/73/853211273.db2.gz YTLSUTROTBVXPJ-SFHVURJKSA-N 0 3 403.526 4.222 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)c2sc(-c3ccc(F)cc3)nc2C)o1 ZINC000115672037 853259744 /nfs/dbraw/zinc/25/97/44/853259744.db2.gz VNXLBPRLASTHGH-UHFFFAOYSA-N 0 3 401.507 4.363 20 0 HIADHN Cc1noc(CSc2ccc(C(=O)N[C@@H]3CCN([C@@H](C)c4ccccc4)C3)cc2)n1 ZINC000115759676 853264359 /nfs/dbraw/zinc/26/43/59/853264359.db2.gz QPOYQUWVADLEAV-OXJNMPFZSA-N 0 3 422.554 4.236 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)[C@@H]2CCCN(c3nc4ccccc4s3)C2)N(C)C)cc1 ZINC000116026840 853280239 /nfs/dbraw/zinc/28/02/39/853280239.db2.gz YGWYTZZPYIAHSR-TZIWHRDSSA-N 0 3 422.598 4.240 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1NC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000116059947 853281271 /nfs/dbraw/zinc/28/12/71/853281271.db2.gz YEBCWVXKYBOWIR-FQEVSTJZSA-N 0 3 406.505 4.479 20 0 HIADHN Cc1nccc(-c2cccc(NC(=O)[C@@H]3CCCN(Cc4cccc(F)c4)C3)c2)n1 ZINC000116060614 853281322 /nfs/dbraw/zinc/28/13/22/853281322.db2.gz AQWMXSFNYLPIGM-HXUWFJFHSA-N 0 3 404.489 4.442 20 0 HIADHN CCn1c2ccccc2nc1[C@H]1CCCN1C(=O)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000116596175 853318709 /nfs/dbraw/zinc/31/87/09/853318709.db2.gz BOFWDOSWAHVCOO-NZQKXSOJSA-N 0 3 417.557 4.027 20 0 HIADHN COc1ccc(C(NC(=O)CNC(C)(C)c2ccccc2)c2ccc(OC)cc2)cc1 ZINC000116602591 853319383 /nfs/dbraw/zinc/31/93/83/853319383.db2.gz ZSELKDRHTYLLNI-UHFFFAOYSA-N 0 3 418.537 4.434 20 0 HIADHN COc1ccc(C(=O)NC[C@H](C(C)C)N2CCc3ccccc3C2)cc1OC(F)F ZINC000117174570 853347471 /nfs/dbraw/zinc/34/74/71/853347471.db2.gz AJSSGSZDBBIZJS-LJQANCHMSA-N 0 3 418.484 4.109 20 0 HIADHN CC(C)(C)n1nc(C(=O)NC[C@@H]2CCCN(Cc3cccs3)C2)cc1C1CC1 ZINC000139986947 853429344 /nfs/dbraw/zinc/42/93/44/853429344.db2.gz YHCZOTQMUGVIPB-INIZCTEOSA-N 0 3 400.592 4.219 20 0 HIADHN C[C@@H](NC1(CNS(=O)(=O)c2cccc3ccccc32)CCOCC1)c1ccccc1 ZINC000437246206 862464166 /nfs/dbraw/zinc/46/41/66/862464166.db2.gz MLDKMSOUHXBYCJ-LJQANCHMSA-N 0 3 424.566 4.018 20 0 HIADHN Cc1ccc(Cl)cc1NC(=O)[C@@H](C)N[C@@H](C)c1ccc(N2CCOCC2)cc1 ZINC000140194343 853437900 /nfs/dbraw/zinc/43/79/00/853437900.db2.gz ZACRFPJHXFZGEI-DLBZAZTESA-N 0 3 401.938 4.163 20 0 HIADHN C[C@H](NCc1ccccc1-c1ccc(Cn2cncn2)cc1)C(=O)Nc1ccccc1 ZINC000140232962 853438984 /nfs/dbraw/zinc/43/89/84/853438984.db2.gz MLCKBJFILOVRBI-IBGZPJMESA-N 0 3 411.509 4.110 20 0 HIADHN C[C@@H](NCc1cccc(OCc2ccccn2)c1)c1ccc(N2CCOC2=O)cc1 ZINC000142724951 853498994 /nfs/dbraw/zinc/49/89/94/853498994.db2.gz TUCBZIWKGHCHOU-GOSISDBHSA-N 0 3 403.482 4.468 20 0 HIADHN C[C@H](NCc1ccc(OCc2cccnc2)cc1)c1ccc(N2CCOC2=O)cc1 ZINC000142723373 853499028 /nfs/dbraw/zinc/49/90/28/853499028.db2.gz AMBJAQFWUPNGBV-SFHVURJKSA-N 0 3 403.482 4.468 20 0 HIADHN COCCN1CCC(NC(=O)Nc2ccc(OCc3ccccc3Cl)cc2)CC1 ZINC000144265399 853532460 /nfs/dbraw/zinc/53/24/60/853532460.db2.gz ZMSXVQSGLNEOEP-UHFFFAOYSA-N 0 3 417.937 4.151 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3CCCc4cc(OC)ccc43)c(C)c2)CC1 ZINC000146327679 853567634 /nfs/dbraw/zinc/56/76/34/853567634.db2.gz WXVSAXHXIPOSQN-UHFFFAOYSA-N 0 3 408.546 4.130 20 0 HIADHN COCCc1ccc(OC(=O)C2CCN(c3cc(Cl)ccc3Cl)C2=O)cc1 ZINC000148092340 853600644 /nfs/dbraw/zinc/60/06/44/853600644.db2.gz BURNFOSZPOWNKC-INIZCTEOSA-N 0 3 408.281 4.141 20 0 HIADHN COc1ccc2ccccc2c1CNCc1ccc(C(=O)N2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000165975772 853654097 /nfs/dbraw/zinc/65/40/97/853654097.db2.gz GGQDPOISJYESIO-KDURUIRLSA-N 0 3 418.537 4.388 20 0 HIADHN Cc1c(C(=O)N(Cc2ccco2)C2CCN(C)CC2)cnn1-c1cccc(Cl)c1 ZINC000195540983 853674713 /nfs/dbraw/zinc/67/47/13/853674713.db2.gz ZDEUFYMZGHRTGR-UHFFFAOYSA-N 0 3 412.921 4.164 20 0 HIADHN Cc1cc(C)n(-c2ccc(CN3CCC(NC(=O)Nc4ccccc4)CC3)cc2)n1 ZINC000195616838 853716074 /nfs/dbraw/zinc/71/60/74/853716074.db2.gz ZIRVOLJAUSEUCX-UHFFFAOYSA-N 0 3 403.530 4.275 20 0 HIADHN COc1ccc([C@@H](NCC(=O)N2CCC[C@@H]2c2ccc(OC)cc2OC)C2CC2)cc1 ZINC000195667936 853747780 /nfs/dbraw/zinc/74/77/80/853747780.db2.gz IZDMFKNADNVTGZ-RDGATRHJSA-N 0 3 424.541 4.117 20 0 HIADHN NC(=O)C1CCN(Cc2cccc(NC(=O)c3ccc(-c4ccccc4)s3)c2)CC1 ZINC000195682468 853755676 /nfs/dbraw/zinc/75/56/76/853755676.db2.gz YGNYSRVFEUMNBW-UHFFFAOYSA-N 0 3 419.550 4.365 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccc(F)c2)C1)N1CCc2[nH]c3ccc(F)cc3c2C1 ZINC000195722621 853778439 /nfs/dbraw/zinc/77/84/39/853778439.db2.gz WAQPVVROEFUFBQ-QGZVFWFLSA-N 0 3 409.480 4.243 20 0 HIADHN CN(C)CCn1c2cc(NC(=O)C34CC5C[C@@](C)(C3)C[C@](C)(C5)C4)ccc2oc1=O ZINC000195738807 853787475 /nfs/dbraw/zinc/78/74/75/853787475.db2.gz VDFCNYAXGNYNIR-XARYMXHKSA-N 0 3 411.546 4.091 20 0 HIADHN CC(C)CCOC1CCN(C(=O)Nc2ccc(CCN3CCSCC3)cc2)CC1 ZINC000195746293 853791807 /nfs/dbraw/zinc/79/18/07/853791807.db2.gz RAHSNHCIBPWORH-UHFFFAOYSA-N 0 3 419.635 4.337 20 0 HIADHN C[C@H](NC[C@H](c1cccs1)N1CCOCC1)C(=O)Nc1ccc(C(C)(C)C)cc1 ZINC000216379898 853851027 /nfs/dbraw/zinc/85/10/27/853851027.db2.gz ZEQZGGVZASHNHQ-FXAWDEMLSA-N 0 3 415.603 4.036 20 0 HIADHN Cc1nn(-c2ccccc2Cl)c2sc(C(=O)N(C)C3CCN(C)CC3)cc12 ZINC000216537775 853855313 /nfs/dbraw/zinc/85/53/13/853855313.db2.gz YPLLAFPEZFBZHN-UHFFFAOYSA-N 0 3 402.951 4.215 20 0 HIADHN CCN(CC)C(=O)c1cccc(NC(=O)[C@@H](C)N[C@H](c2ccc(OC)cc2)C2CC2)c1 ZINC000218865739 853864776 /nfs/dbraw/zinc/86/47/76/853864776.db2.gz GHHMNRARKOGERZ-HXOBKFHXSA-N 0 3 423.557 4.245 20 0 HIADHN Brc1cccc(-c2c[nH]c(CNCCCCNc3ccccn3)n2)c1 ZINC000236576530 853899639 /nfs/dbraw/zinc/89/96/39/853899639.db2.gz CNRQBDDLGWEOCW-UHFFFAOYSA-N 0 3 400.324 4.216 20 0 HIADHN Brc1ccc([C@@H](NCc2cnc(N3CCOCC3)s2)C2CCC2)cc1 ZINC000236616447 853902527 /nfs/dbraw/zinc/90/25/27/853902527.db2.gz XHUVGBHKVLJHJC-SFHVURJKSA-N 0 3 422.392 4.373 20 0 HIADHN Brc1cc(CNC[C@H](c2ccco2)N2CCCC2)cc2c1OCCCO2 ZINC000236650433 853907359 /nfs/dbraw/zinc/90/73/59/853907359.db2.gz GVMHOKKRMGAGDJ-QGZVFWFLSA-N 0 3 421.335 4.130 20 0 HIADHN c1nn(-c2ccccc2)cc1CCNCc1csc(-c2ccc3c(c2)OCO3)n1 ZINC000236754454 853919457 /nfs/dbraw/zinc/91/94/57/853919457.db2.gz SSIHHIYMJHLHIB-UHFFFAOYSA-N 0 3 404.495 4.057 20 0 HIADHN CCOc1cc(CNC[C@H](c2ccco2)N2CCCC2)cc(Br)c1OC ZINC000236850418 853928900 /nfs/dbraw/zinc/92/89/00/853928900.db2.gz KSSVASJGFSRCII-QGZVFWFLSA-N 0 3 423.351 4.376 20 0 HIADHN CCOc1cc(CN[C@H]2CCSc3ccccc32)ccc1O[C@H](C)C(=O)N(C)C ZINC000236913468 853936920 /nfs/dbraw/zinc/93/69/20/853936920.db2.gz MPWSHLRZZGUOSF-APWZRJJASA-N 0 3 414.571 4.268 20 0 HIADHN CCOc1ccccc1Oc1ccc(CNCc2ccc(-n3cncn3)c(C)c2)cn1 ZINC000236980513 853946180 /nfs/dbraw/zinc/94/61/80/853946180.db2.gz YLULYSBSZUBOEF-UHFFFAOYSA-N 0 3 415.497 4.452 20 0 HIADHN CCN(CC)c1ncc(CN[C@H](C)CC(=O)Nc2cccc(N3CCCC3)c2)s1 ZINC000237000082 853949326 /nfs/dbraw/zinc/94/93/26/853949326.db2.gz PAVSYMDXELUFER-QGZVFWFLSA-N 0 3 415.607 4.096 20 0 HIADHN CN(C)[C@H](CNCc1nc(-c2cccc(Br)c2)c[nH]1)c1ccc(F)cc1 ZINC000237040284 853955828 /nfs/dbraw/zinc/95/58/28/853955828.db2.gz SOGPKYLDIHTBEA-LJQANCHMSA-N 0 3 417.326 4.371 20 0 HIADHN CCc1nn(C)c(Cl)c1CNC[C@H]1CCN(c2cccc(Br)c2)C1 ZINC000237062806 853959043 /nfs/dbraw/zinc/95/90/43/853959043.db2.gz KPHFABVPVCXFCE-CYBMUJFWSA-N 0 3 411.775 4.015 20 0 HIADHN CN(C)Cc1cc(CNCc2cn(-c3ccccc3)nc2-c2ccncc2)ccc1F ZINC000237077622 853961160 /nfs/dbraw/zinc/96/11/60/853961160.db2.gz KIIISABTKLQZDU-UHFFFAOYSA-N 0 3 415.516 4.425 20 0 HIADHN COC(=O)c1cc(CN[C@@H](Cc2ccccc2C)c2ccc(OC)c(OC)c2)c[nH]1 ZINC000237079842 853962016 /nfs/dbraw/zinc/96/20/16/853962016.db2.gz BJZSGDNTEOFERB-FQEVSTJZSA-N 0 3 408.498 4.201 20 0 HIADHN COc1ccccc1N1CC[C@@H](CNCc2csc(-c3ccc4c(c3)OCO4)n2)C1 ZINC000237125788 853967449 /nfs/dbraw/zinc/96/74/49/853967449.db2.gz CJGLFYUDOOFTRG-INIZCTEOSA-N 0 3 423.538 4.164 20 0 HIADHN COC(=O)COc1c(C)cc(CNCc2ccc(OC)cc2C(F)(F)F)cc1C ZINC000237171541 853975347 /nfs/dbraw/zinc/97/53/47/853975347.db2.gz LRSFFOUSEYRFLQ-UHFFFAOYSA-N 0 3 411.420 4.172 20 0 HIADHN COc1cc(CNCc2ccc(C3OCCO3)cc2)ccc1OCc1c(C)noc1C ZINC000237240470 853988865 /nfs/dbraw/zinc/98/88/65/853988865.db2.gz RNJJRECGRJUNQQ-UHFFFAOYSA-N 0 3 424.497 4.214 20 0 HIADHN COc1cc(CNC[C@@](C)(O)c2ccccc2)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000237251393 853991118 /nfs/dbraw/zinc/99/11/18/853991118.db2.gz JBTXNFBTTRXGSH-XMMPIXPASA-N 0 3 422.481 4.180 20 0 HIADHN COc1ccc(OC)c([C@@H](C)N[C@H](C)CC(=O)Nc2cc(Cl)ccc2OC)c1 ZINC000237265503 853994406 /nfs/dbraw/zinc/99/44/06/853994406.db2.gz SHPBPPIUPYMUKL-ZIAGYGMSSA-N 0 3 406.910 4.434 20 0 HIADHN COc1ccc(OC)c([C@H](C)N[C@@H](C)CC(=O)Nc2cc(Cl)ccc2OC)c1 ZINC000237275050 853995581 /nfs/dbraw/zinc/99/55/81/853995581.db2.gz SHPBPPIUPYMUKL-KBPBESRZSA-N 0 3 406.910 4.434 20 0 HIADHN CSCC[C@@H](N)C(=O)NC[C@@H](c1c[nH]c2ccccc21)c1ccccc1Cl ZINC000237276335 853996454 /nfs/dbraw/zinc/99/64/54/853996454.db2.gz OBDRLBAWCFHNJU-VQIMIIECSA-N 0 3 401.963 4.150 20 0 HIADHN COc1cc(CNCc2ccnc(N3CCCCC3)c2)ccc1OCC(F)(F)F ZINC000237287473 853998197 /nfs/dbraw/zinc/99/81/97/853998197.db2.gz FSBXJDCFWYMEIP-UHFFFAOYSA-N 0 3 409.452 4.311 20 0 HIADHN COc1cc(CNCc2ccc(C(C)(C)C)cc2)ccc1OCC(=O)N1CCCC1 ZINC000237307510 854003679 /nfs/dbraw/zinc/00/36/79/854003679.db2.gz RLYCSNVJQWDGLY-UHFFFAOYSA-N 0 3 410.558 4.284 20 0 HIADHN C[C@@H](CC(=O)Nc1ccccc1)N[C@@H](Cc1ccccc1)C(=O)N(C)c1ccccc1 ZINC000237318094 854006002 /nfs/dbraw/zinc/00/60/02/854006002.db2.gz PMCLQOBERWFSIB-RDPSFJRHSA-N 0 3 415.537 4.268 20 0 HIADHN COc1cc(CN[C@H](c2ccc(Cl)cc2)C2CC2)cc(Cl)c1OCC(N)=O ZINC000237332820 854008760 /nfs/dbraw/zinc/00/87/60/854008760.db2.gz HSLXSHJZMUDYSF-IBGZPJMESA-N 0 3 409.313 4.107 20 0 HIADHN COc1cc(CNC2(c3cccc(F)c3)CCOCC2)cc(Br)c1O ZINC000237344621 854010331 /nfs/dbraw/zinc/01/03/31/854010331.db2.gz ZPIYHGGGOMVYTM-UHFFFAOYSA-N 0 3 410.283 4.098 20 0 HIADHN COc1cc(CN[C@H]2c3ccccc3C[C@H]2C)cc(I)c1OC ZINC000237361893 854014583 /nfs/dbraw/zinc/01/45/83/854014583.db2.gz FSSCAPUFOZMTMV-KZULUSFZSA-N 0 3 423.294 4.332 20 0 HIADHN COc1ccc(OC)c(NC(=O)C[C@@H](C)N[C@H](c2nc3ccccc3[nH]2)C(C)C)c1 ZINC000237396680 854022641 /nfs/dbraw/zinc/02/26/41/854022641.db2.gz UMHWZTHBIQJIRT-QRQCRPRQSA-N 0 3 410.518 4.284 20 0 HIADHN COc1cc(-c2noc(CCCCCNCc3c(F)cccc3F)n2)ccc1O ZINC000237402220 854023765 /nfs/dbraw/zinc/02/37/65/854023765.db2.gz WJIXUTHTOHSNIJ-UHFFFAOYSA-N 0 3 403.429 4.232 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2CNCc2ccc(Br)cc2F)C[C@@H](C)O1 ZINC000237411684 854026455 /nfs/dbraw/zinc/02/64/55/854026455.db2.gz LQKIMEXRZKFYGC-HZPDHXFCSA-N 0 3 421.354 4.487 20 0 HIADHN COc1ccc(-c2ccc(CNC[C@@H](O)c3ccccc3Cl)o2)c([N+](=O)[O-])c1 ZINC000237429139 854031773 /nfs/dbraw/zinc/03/17/73/854031773.db2.gz IGDKXQLXWUGWHJ-LJQANCHMSA-N 0 3 402.834 4.340 20 0 HIADHN COc1cc(OC)cc(Oc2ccc(CNCc3ccc(-n4cncn4)cc3)cc2)c1 ZINC000237459596 854036690 /nfs/dbraw/zinc/03/66/90/854036690.db2.gz YNHPKNCYWPYSSW-UHFFFAOYSA-N 0 3 416.481 4.367 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(CNC[C@H](O)c3ccccc3Cl)c2)cc1 ZINC000237466586 854037941 /nfs/dbraw/zinc/03/79/41/854037941.db2.gz YDPZTGUPKROWEG-QFIPXVFZSA-N 0 3 410.901 4.424 20 0 HIADHN COc1cc(CNCc2c[nH]nc2-c2cccs2)cc(Br)c1OC ZINC000237470294 854040540 /nfs/dbraw/zinc/04/05/40/854040540.db2.gz NFZHHBJQKCGRPZ-UHFFFAOYSA-N 0 3 408.321 4.208 20 0 HIADHN C[C@H](NCc1cn(-c2ccccc2)nc1-c1ccncc1)c1ccc(NC(N)=O)cc1 ZINC000237610591 854061329 /nfs/dbraw/zinc/06/13/29/854061329.db2.gz USOVSAPOUFPBGY-KRWDZBQOSA-N 0 3 412.497 4.276 20 0 HIADHN C[C@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@H]1CNCc1cnc(-c2ccccn2)s1 ZINC000237675953 854072908 /nfs/dbraw/zinc/07/29/08/854072908.db2.gz HJPHASOOLAUEAG-PBHICJAKSA-N 0 3 418.563 4.055 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)c(C)c1CNCc1cccc(CN2CCOCC2)c1 ZINC000237725406 854083969 /nfs/dbraw/zinc/08/39/69/854083969.db2.gz XNEKGJLRGVOEIJ-UHFFFAOYSA-N 0 3 424.976 4.265 20 0 HIADHN Cn1ncc2c1CCC[C@@H]2NCc1ccc(OC(F)(F)[C@H](F)C(F)(F)F)cc1 ZINC000237733583 854085564 /nfs/dbraw/zinc/08/55/64/854085564.db2.gz WXEUCUPBFWXINC-GOEBONIOSA-N 0 3 407.358 4.459 20 0 HIADHN Cc1cc(CNCc2cccc(NC(=O)c3ccc(F)cc3)c2)ccc1-n1cncn1 ZINC000237756990 854090116 /nfs/dbraw/zinc/09/01/16/854090116.db2.gz NTUQDAYYZASVRG-UHFFFAOYSA-N 0 3 415.472 4.257 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(Cl)c1CNCCc1csc(N2CCCC2)n1 ZINC000237775363 854095066 /nfs/dbraw/zinc/09/50/66/854095066.db2.gz FSZBQSGVWGOTAQ-UHFFFAOYSA-N 0 3 419.957 4.362 20 0 HIADHN Cn1cc(N2CC[C@@H](NCc3ccc(-c4ccc(C(F)(F)F)cc4)s3)C2=O)cn1 ZINC000237794646 854098982 /nfs/dbraw/zinc/09/89/82/854098982.db2.gz SEOVQOPEESBWQL-QGZVFWFLSA-N 0 3 420.460 4.063 20 0 HIADHN Fc1cc(CNC2(c3ccc(Br)cc3)CC2)ccc1N1CCOCC1 ZINC000237843071 854106302 /nfs/dbraw/zinc/10/63/02/854106302.db2.gz DOHZQMZLOFXHBG-UHFFFAOYSA-N 0 3 405.311 4.204 20 0 HIADHN Cc1nn(Cc2ccc(Cl)cc2)c(C)c1CNC[C@@H](O)c1c(F)cccc1F ZINC000237882739 854113715 /nfs/dbraw/zinc/11/37/15/854113715.db2.gz TZYXXEDKYGXJMC-HXUWFJFHSA-N 0 3 405.876 4.303 20 0 HIADHN Cc1nn(Cc2ccc(C)cc2)c(Cl)c1CNC1CCN(Cc2ccccn2)CC1 ZINC000237900451 854117072 /nfs/dbraw/zinc/11/70/72/854117072.db2.gz HCLFLCIPPCDFEG-UHFFFAOYSA-N 0 3 423.992 4.351 20 0 HIADHN O[C@@H](CNCc1cn(Cc2ccccc2)nc1-c1cccnc1)c1c(F)cccc1F ZINC000238072049 854140771 /nfs/dbraw/zinc/14/07/71/854140771.db2.gz YYVWYGUYJVLKPE-QFIPXVFZSA-N 0 3 420.463 4.095 20 0 HIADHN Cc1cc2ncn(C[C@@H](O)CN3CCC[C@H]3c3nc4ccccc4s3)c2cc1C ZINC000250930061 854196446 /nfs/dbraw/zinc/19/64/46/854196446.db2.gz WLECEMGLMPGSRK-PXNSSMCTSA-N 0 3 406.555 4.461 20 0 HIADHN COc1ccc([C@H](CNC(=O)Cc2coc3cc4c(cc23)CCC4)N2CCCC2)cc1 ZINC000255941409 854224875 /nfs/dbraw/zinc/22/48/75/854224875.db2.gz RBDVHOAMLKLDEI-DEOSSOPVSA-N 0 3 418.537 4.426 20 0 HIADHN CCN(C(=O)c1ccc(Br)cn1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000261400966 854248987 /nfs/dbraw/zinc/24/89/87/854248987.db2.gz GKBKADJQNZSJHD-CRAIPNDOSA-N 0 3 402.336 4.142 20 0 HIADHN CCN(CC(=O)NC[C@H](c1c[nH]c2ccccc21)c1ccc(OC)cc1)CC1CC1 ZINC000261415242 854254335 /nfs/dbraw/zinc/25/43/35/854254335.db2.gz MBNTUSFGDFUVMS-QFIPXVFZSA-N 0 3 405.542 4.157 20 0 HIADHN Cc1nn(C)c2ncc(CN(C[C@@H](O)COc3cccc4ccccc43)C(C)C)cc12 ZINC000261456396 854269456 /nfs/dbraw/zinc/26/94/56/854269456.db2.gz NTKJJWCXAPOKFD-OAQYLSRUSA-N 0 3 418.541 4.080 20 0 HIADHN COc1cc(CN2CC[C@H](Nc3nc(C(F)F)nc4ccccc43)C2)cc(OC)c1 ZINC000301583783 854424578 /nfs/dbraw/zinc/42/45/78/854424578.db2.gz UZLZJNMPSYIXET-HNNXBMFYSA-N 0 3 414.456 4.271 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(N[C@H]3CC[N@H+](Cc4ccccc4)C[C@H]3C)nc2)n1 ZINC000301588458 854425188 /nfs/dbraw/zinc/42/51/88/854425188.db2.gz PWTJWQKSBPCYJR-UTKZUKDTSA-N 0 3 403.530 4.129 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(N[C@H]3CC[N@@H+](Cc4ccccc4)C[C@H]3C)nc2)n1 ZINC000301588458 854425195 /nfs/dbraw/zinc/42/51/95/854425195.db2.gz PWTJWQKSBPCYJR-UTKZUKDTSA-N 0 3 403.530 4.129 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(N[C@@H]3CC[N@H+](Cc4ccccc4)C[C@H]3C)nc2)n1 ZINC000301588456 854425282 /nfs/dbraw/zinc/42/52/82/854425282.db2.gz PWTJWQKSBPCYJR-DYESRHJHSA-N 0 3 403.530 4.129 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(N[C@@H]3CC[N@@H+](Cc4ccccc4)C[C@H]3C)nc2)n1 ZINC000301588456 854425286 /nfs/dbraw/zinc/42/52/86/854425286.db2.gz PWTJWQKSBPCYJR-DYESRHJHSA-N 0 3 403.530 4.129 20 0 HIADHN O=S(=O)(c1ccccc1N1CC[C@H]2[C@H](CCCN2Cc2ccccc2)C1)C(F)F ZINC000301706666 854449111 /nfs/dbraw/zinc/44/91/11/854449111.db2.gz ISBNBOZIAOOSMY-MOPGFXCFSA-N 0 3 420.525 4.174 20 0 HIADHN Cc1cc(C)n(-c2cncc(N3CCN(C4c5ccccc5-c5ccccc54)CC3)n2)n1 ZINC000301778171 854464035 /nfs/dbraw/zinc/46/40/35/854464035.db2.gz PXRHSMCSWKMWPW-UHFFFAOYSA-N 0 3 422.536 4.171 20 0 HIADHN COc1ccc([C@@H](CNc2nn3cc(-c4cccnc4)nc3s2)N2CCCC2)cc1 ZINC000302108533 854531551 /nfs/dbraw/zinc/53/15/51/854531551.db2.gz STCCPUAPCXZGJR-HXUWFJFHSA-N 0 3 420.542 4.110 20 0 HIADHN CC(C)(C)OC(=O)NC[C@@H](NCc1cccc(Br)n1)C1CCCCC1 ZINC000302115297 854532539 /nfs/dbraw/zinc/53/25/39/854532539.db2.gz RBPYJZIQPKHGRS-MRXNPFEDSA-N 0 3 412.372 4.407 20 0 HIADHN COc1ccc([C@@H](C[NH+]2CCCC2)Nc2ccc(-c3nc(C)c(C)c(=O)[n-]3)cn2)cc1 ZINC000302138373 854535837 /nfs/dbraw/zinc/53/58/37/854535837.db2.gz NRVQUICVHKSYBK-OAQYLSRUSA-N 0 3 419.529 4.119 20 0 HIADHN C[C@H]1C[C@@H](N(C)c2nn3cc(-c4cccnc4)nc3s2)CCN1Cc1ccccc1 ZINC000302152449 854538346 /nfs/dbraw/zinc/53/83/46/854538346.db2.gz HYNCJQJCXAVAQE-PXNSSMCTSA-N 0 3 418.570 4.342 20 0 HIADHN CN(C)[C@H](CNc1ncnc2c1cnn2C(C)(C)C)c1cccc(C(F)(F)F)c1 ZINC000302225913 854553401 /nfs/dbraw/zinc/55/34/01/854553401.db2.gz SABQLAVVETUSJE-MRXNPFEDSA-N 0 3 406.456 4.315 20 0 HIADHN CN(C)[C@@H](CNc1ncnc2c1cnn2C(C)(C)C)c1cccc(C(F)(F)F)c1 ZINC000302225912 854553823 /nfs/dbraw/zinc/55/38/23/854553823.db2.gz SABQLAVVETUSJE-INIZCTEOSA-N 0 3 406.456 4.315 20 0 HIADHN CC(C)(CNc1ccc2nnc(-c3ccsc3)n2n1)N1CCc2ccccc2C1 ZINC000302267550 854559233 /nfs/dbraw/zinc/55/92/33/854559233.db2.gz FXOWVHTXPOMGGF-UHFFFAOYSA-N 0 3 404.543 4.102 20 0 HIADHN COc1ccccc1[C@@H](CNc1ccc2nnc(C(C)(C)C)n2n1)N1CCCCC1 ZINC000302598970 854590352 /nfs/dbraw/zinc/59/03/52/854590352.db2.gz YAVDYYGQDIKSBF-GOSISDBHSA-N 0 3 408.550 4.070 20 0 HIADHN CN(C)Cc1ccccc1CNC(=O)c1c2c(sc1-n1cccc1)CSCC2 ZINC000302816163 854644543 /nfs/dbraw/zinc/64/45/43/854644543.db2.gz PGWPDGPFOZRGHZ-UHFFFAOYSA-N 0 3 411.596 4.320 20 0 HIADHN CN(C[C@@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)c1cc(Cl)sc1Cl ZINC000437320831 862589064 /nfs/dbraw/zinc/58/90/64/862589064.db2.gz IMRDDPGBTGNRSL-AWEZNQCLSA-N 0 3 419.399 4.198 20 0 HIADHN COc1ccc([C@H](CNC(=O)NCCc2cccc(Cl)c2)N2CCCC2)cc1 ZINC000302853759 854657592 /nfs/dbraw/zinc/65/75/92/854657592.db2.gz ZPBITEOBXGUKSK-NRFANRHFSA-N 0 3 401.938 4.027 20 0 HIADHN CN(Cc1ccc(Br)s1)C(=O)NC[C@H](c1ccccc1)N1CCCC1 ZINC000302895341 854669968 /nfs/dbraw/zinc/66/99/68/854669968.db2.gz JWRMZWRUCVSJMU-QGZVFWFLSA-N 0 3 422.392 4.489 20 0 HIADHN CCNC(=O)c1cccc(NC(=O)CN2CCC[C@H]2c2cccc3ccccc32)c1 ZINC000302944920 854690623 /nfs/dbraw/zinc/69/06/23/854690623.db2.gz AYNCWQISEOZBOF-QHCPKHFHSA-N 0 3 401.510 4.365 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)c1ccn(-c2cccc(Cl)c2)n1 ZINC000302959102 854696659 /nfs/dbraw/zinc/69/66/59/854696659.db2.gz GCRSAVOYGDTOHC-UHFFFAOYSA-N 0 3 418.875 4.008 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2ccc(C(=O)N3CCCCCC3)cc2)N(C)C)cc1 ZINC000302961446 854697074 /nfs/dbraw/zinc/69/70/74/854697074.db2.gz GDVJZWOISDURPR-QHCPKHFHSA-N 0 3 422.573 4.436 20 0 HIADHN O=C(Nc1cccc(OC[C@@H]2CCCO2)c1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000302963110 854698756 /nfs/dbraw/zinc/69/87/56/854698756.db2.gz GLTSYYXPJJPGJM-XXBNENTESA-N 0 3 412.505 4.234 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Cc2ccc(Br)cc2)N2CCCC2)cc1 ZINC000302977468 854705344 /nfs/dbraw/zinc/70/53/44/854705344.db2.gz CHIPAOULUIMPEN-HXUWFJFHSA-N 0 3 401.348 4.253 20 0 HIADHN Cc1c(C(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)cnn1Cc1ccccc1 ZINC000302980489 854707514 /nfs/dbraw/zinc/70/75/14/854707514.db2.gz CXNYSGJBYVXYDM-XMMPIXPASA-N 0 3 402.542 4.115 20 0 HIADHN COc1nc(C(=O)Nc2ccc(CCN3CCSCC3)cc2)cc2ccccc21 ZINC000302981392 854707742 /nfs/dbraw/zinc/70/77/42/854707742.db2.gz DDGJKBZEDKJKTM-UHFFFAOYSA-N 0 3 407.539 4.087 20 0 HIADHN Clc1nc(N2CCC[C@@H](CN3CCN(c4ccccn4)CC3)C2)cc2ccccc21 ZINC000302994027 854713854 /nfs/dbraw/zinc/71/38/54/854713854.db2.gz GLXVDLMNMBFWGU-IBGZPJMESA-N 0 3 421.976 4.322 20 0 HIADHN COc1cccc([C@@H](CNC(=O)CCCOc2ccccc2Cl)N2CCCC2)c1 ZINC000303060168 854743783 /nfs/dbraw/zinc/74/37/83/854743783.db2.gz UJBBVYJOVIYFJE-OAQYLSRUSA-N 0 3 416.949 4.461 20 0 HIADHN COc1ccc(Cl)cc1CC(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000303069838 854747826 /nfs/dbraw/zinc/74/78/26/854747826.db2.gz WVYMYJDPEWWSOU-UHFFFAOYSA-N 0 3 404.963 4.121 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2cc3cc(Br)ccc3[nH]2)N(C)C)cc1 ZINC000303085996 854754181 /nfs/dbraw/zinc/75/41/81/854754181.db2.gz XPFPSSNTYONGTC-IBGZPJMESA-N 0 3 400.320 4.272 20 0 HIADHN COc1ccc(Cl)cc1N1CC[C@H](NCc2c(F)cccc2N2CCCC2)C1 ZINC000303101007 854759801 /nfs/dbraw/zinc/75/98/01/854759801.db2.gz CCWKANMTUFQNKV-KRWDZBQOSA-N 0 3 403.929 4.456 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Cc1cccc(Br)c1)c1cccc(OC)c1 ZINC000303148154 854785633 /nfs/dbraw/zinc/78/56/33/854785633.db2.gz SGCYFXUWKHVUBP-HXUWFJFHSA-N 0 3 419.363 4.200 20 0 HIADHN CCN1CCN(Cc2ccc(CNC(=O)N(CC3CC3)C3CCCCC3)cc2)CC1 ZINC000303216926 854821458 /nfs/dbraw/zinc/82/14/58/854821458.db2.gz TTYIDDPVOREZLS-UHFFFAOYSA-N 0 3 412.622 4.078 20 0 HIADHN CCN(CC)[C@H](C(=O)NC[C@@H](c1cccc(OC)c1)N1CCCC1)c1ccccc1 ZINC000303306582 854863038 /nfs/dbraw/zinc/86/30/38/854863038.db2.gz ZVNQNCDUNPJWOL-ZEQRLZLVSA-N 0 3 409.574 4.031 20 0 HIADHN O=C(NC[C@@H](O)c1ccc2ccccc2c1)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000303345754 854884825 /nfs/dbraw/zinc/88/48/25/854884825.db2.gz DVJWVGSLNINTAA-BJKOFHAPSA-N 0 3 403.526 4.010 20 0 HIADHN Cc1ccc([C@H](CNC(=O)C2(c3ccccc3Cl)CCOCC2)N(C)C)cc1 ZINC000303355178 854889475 /nfs/dbraw/zinc/88/94/75/854889475.db2.gz YNDYVOHKPAKXKL-NRFANRHFSA-N 0 3 400.950 4.116 20 0 HIADHN COCCN(CCN(C)C)C(=O)Nc1ccc(F)cc1-c1nc2ccccc2s1 ZINC000303355877 854889587 /nfs/dbraw/zinc/88/95/87/854889587.db2.gz YPXRXENTECNVNW-UHFFFAOYSA-N 0 3 416.522 4.144 20 0 HIADHN Cc1ccc(-c2nc(CCNC(=O)NC[C@H](C)N(C)Cc3ccccc3)co2)cc1 ZINC000303435930 854936576 /nfs/dbraw/zinc/93/65/76/854936576.db2.gz DLQNPMYTDAMTLW-IBGZPJMESA-N 0 3 406.530 4.012 20 0 HIADHN C[C@@H](CNC(=O)N(C)Cc1ccc(Br)s1)N(C)Cc1ccccc1 ZINC000303477340 854972579 /nfs/dbraw/zinc/97/25/79/854972579.db2.gz PDSCKXXYXXVVFK-AWEZNQCLSA-N 0 3 410.381 4.173 20 0 HIADHN Cc1ccc(C)c(NC(=O)[C@H](c2ccccc2)N2CCC[C@@H](CN3CCOCC3)C2)c1 ZINC000303499051 854988148 /nfs/dbraw/zinc/98/81/48/854988148.db2.gz YBLPVWRSFUKHJH-DHLKQENFSA-N 0 3 421.585 4.027 20 0 HIADHN CCN(CC)[C@H](CNC(=O)[C@@H]1C[C@H]1c1ccc(F)cc1F)c1cccc(OC)c1 ZINC000303554800 855036550 /nfs/dbraw/zinc/03/65/50/855036550.db2.gz WDIJHVXPVFZFJE-TUNNFDKTSA-N 0 3 402.485 4.276 20 0 HIADHN COc1ccc(CN(C)C(=O)CN(Cc2ccc3c(c2)CCO3)C2CCCC2)cc1 ZINC000303636485 855092321 /nfs/dbraw/zinc/09/23/21/855092321.db2.gz PXHDMUURSIDJGA-UHFFFAOYSA-N 0 3 408.542 4.033 20 0 HIADHN Cc1cc(F)ccc1-c1ccc(C(=O)N(CCN(C)C)C[C@@H]2CCCO2)cc1F ZINC000303655392 855109973 /nfs/dbraw/zinc/10/99/73/855109973.db2.gz GAEDAZPZNAFEEI-IBGZPJMESA-N 0 3 402.485 4.123 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)N[C@H](C)c2cccc(C)c2C)CC1 ZINC000303728662 855155714 /nfs/dbraw/zinc/15/57/14/855155714.db2.gz UGAJDHGOBJLSGZ-OAQYLSRUSA-N 0 3 408.590 4.001 20 0 HIADHN CCOC(=O)CCCCN1CCc2cc(OC)c(OC)cc2[C@@H]1c1cccs1 ZINC000303755204 855175278 /nfs/dbraw/zinc/17/52/78/855175278.db2.gz BHLSPCFHMIPMTJ-JOCHJYFZSA-N 0 3 403.544 4.446 20 0 HIADHN COc1cc(C(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)ccc1OC(F)F ZINC000303779015 855193945 /nfs/dbraw/zinc/19/39/45/855193945.db2.gz CPRDSIXBZMAERL-INIZCTEOSA-N 0 3 404.457 4.033 20 0 HIADHN COc1cc(Br)ccc1C(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C ZINC000303789127 855199513 /nfs/dbraw/zinc/19/95/13/855199513.db2.gz FBILLOONFBGZCA-INIZCTEOSA-N 0 3 417.347 4.194 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)COc1ccc(Cl)c2cccnc12 ZINC000303789211 855199576 /nfs/dbraw/zinc/19/95/76/855199576.db2.gz FCIUPSFLSJMXDH-GOSISDBHSA-N 0 3 423.944 4.390 20 0 HIADHN Cc1ccc(C[C@H](C)N(C)C(=O)NCCCCN2CCN(c3ccccc3)CC2)cc1 ZINC000303805207 855209735 /nfs/dbraw/zinc/20/97/35/855209735.db2.gz MLVKHAQGQFNGGK-QHCPKHFHSA-N 0 3 422.617 4.170 20 0 HIADHN Cc1ccc(S(=O)(=O)N(C)[C@H]2CCN(Cc3ccccc3)[C@H](C)C2)c2cccnc12 ZINC000303817221 855219189 /nfs/dbraw/zinc/21/91/89/855219189.db2.gz OPYBHXAJNVBQDO-CTNGQTDRSA-N 0 3 423.582 4.217 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1ccc(C(=O)N2CCCC2)cc1 ZINC000303822100 855223781 /nfs/dbraw/zinc/22/37/81/855223781.db2.gz FSGMAOWGGNGJLQ-HXUWFJFHSA-N 0 3 420.557 4.051 20 0 HIADHN Cc1ccc(Cl)cc1S(=O)(=O)N(C)[C@H]1CCN(Cc2ccccc2)[C@@H](C)C1 ZINC000303848717 855244958 /nfs/dbraw/zinc/24/49/58/855244958.db2.gz UQXXKYMMYIWGJI-PXNSSMCTSA-N 0 3 406.979 4.322 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)CCc2ccccc2Cl)cc1)[C@H]1CCCN(C)C1 ZINC000303851342 855247187 /nfs/dbraw/zinc/24/71/87/855247187.db2.gz FSASAZAGGVTWJQ-FQEVSTJZSA-N 0 3 413.949 4.078 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)NC[C@H]1CCCO[C@H]1c1ccccc1 ZINC000303951111 855314111 /nfs/dbraw/zinc/31/41/11/855314111.db2.gz ZWZYJRSJPBKZRS-SDUSCBPUSA-N 0 3 421.585 4.460 20 0 HIADHN Cc1ccc([C@H](CNC(=O)CCc2nnc(-c3ccc(Cl)cc3)o2)N(C)C)cc1 ZINC000303952097 855314877 /nfs/dbraw/zinc/31/48/77/855314877.db2.gz VYMSGQAHKVOLNQ-IBGZPJMESA-N 0 3 412.921 4.050 20 0 HIADHN O=C(c1cc(C(F)(F)F)ccc1Br)N1CC[C@H](N2CCCCC2)C1 ZINC000325552266 855404608 /nfs/dbraw/zinc/40/46/08/855404608.db2.gz VJNWECZVYMSENN-ZDUSSCGKSA-N 0 3 405.258 4.168 20 0 HIADHN COc1ccc(Br)c(C(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)c1 ZINC000383019529 855434761 /nfs/dbraw/zinc/43/47/61/855434761.db2.gz NWPKVYWWYABDRQ-MRXNPFEDSA-N 0 3 417.347 4.194 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)c1ccc(Br)cc1F ZINC000383040375 855436046 /nfs/dbraw/zinc/43/60/46/855436046.db2.gz ABQFZHQKKDXVJR-HNNXBMFYSA-N 0 3 405.311 4.325 20 0 HIADHN CCOc1c(Br)cc(Br)cc1CN[C@@H]1C[C@@H](C)O[C@@H]1C ZINC000384964270 855440945 /nfs/dbraw/zinc/44/09/45/855440945.db2.gz XDKDVYPVWIIMQQ-GPCCPHFNSA-N 0 3 407.146 4.266 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)c1cc(Br)ccc1Cl ZINC000390799264 855457659 /nfs/dbraw/zinc/45/76/59/855457659.db2.gz MXHOWERZWFHATO-INIZCTEOSA-N 0 3 407.739 4.497 20 0 HIADHN O[C@@H](CNCc1cc(Br)cc2c1OCC2)c1ccc(C(F)(F)F)cc1 ZINC000392854740 855466894 /nfs/dbraw/zinc/46/68/94/855466894.db2.gz KDKMHUDWHAYZSQ-INIZCTEOSA-N 0 3 416.237 4.226 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)c2ccc(Cl)cc2Br)CN1Cc1ccccc1 ZINC000398163071 855476560 /nfs/dbraw/zinc/47/65/60/855476560.db2.gz WLACXCIGRUHWDC-CZUORRHYSA-N 0 3 407.739 4.495 20 0 HIADHN Brc1ccc(-n2cc(CNC[C@H](c3ccco3)N3CCCC3)cn2)cc1 ZINC000409488646 855506076 /nfs/dbraw/zinc/50/60/76/855506076.db2.gz WJXOEDIIMPYJMU-LJQANCHMSA-N 0 3 415.335 4.155 20 0 HIADHN C[C@@H](Oc1ccc(C(=O)N(CCN(C)C)Cc2ccccn2)cc1)c1ccccc1 ZINC000409535669 855529778 /nfs/dbraw/zinc/52/97/78/855529778.db2.gz KUXMHXKHZJEJNQ-HXUWFJFHSA-N 0 3 403.526 4.426 20 0 HIADHN CC[C@H](C(=O)N1CCC(NC(=O)Nc2cccc(CN(C)C)c2)CC1)c1ccccc1 ZINC000409547377 855536407 /nfs/dbraw/zinc/53/64/07/855536407.db2.gz IOMSDXDYWZAECC-QHCPKHFHSA-N 0 3 422.573 4.055 20 0 HIADHN CSc1cccc(F)c1C(=O)NC1CCN(CCOc2ccc(Cl)cc2)CC1 ZINC000409722536 855620441 /nfs/dbraw/zinc/62/04/41/855620441.db2.gz WRKAJWUFGWOQPK-UHFFFAOYSA-N 0 3 422.953 4.474 20 0 HIADHN CC[C@H](NCC(=O)N[C@@H]1CCOc2ccccc21)c1ccc(Br)cc1 ZINC000409862334 855693262 /nfs/dbraw/zinc/69/32/62/855693262.db2.gz ZJVXHKUZFHVKJO-ZWKOTPCHSA-N 0 3 403.320 4.130 20 0 HIADHN C[C@H](NC(=O)NCc1ccc(CN2CCN(C)CC2)cc1)c1cccc2ccccc21 ZINC000410376691 855960839 /nfs/dbraw/zinc/96/08/39/855960839.db2.gz VWEUIJMOAYJSDG-FQEVSTJZSA-N 0 3 416.569 4.148 20 0 HIADHN CC(C)CN(CCN(C)C)C(=O)NCc1ccc(OCc2cccc(F)c2)cc1 ZINC000410387806 855966866 /nfs/dbraw/zinc/96/68/66/855966866.db2.gz OEYBTIKTTREDPP-UHFFFAOYSA-N 0 3 401.526 4.134 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](NCC2CC(F)(F)C2)c2ccc(F)c(F)c2)c1 ZINC000425948757 856013491 /nfs/dbraw/zinc/01/34/91/856013491.db2.gz BVXGHLUAYILQSL-GOSISDBHSA-N 0 3 401.425 4.093 20 0 HIADHN C[C@H]1CN(c2ccc(CN[C@H](Cc3cccnc3)c3cccc(Cl)c3)cn2)CCO1 ZINC000425949228 856015018 /nfs/dbraw/zinc/01/50/18/856015018.db2.gz GXHYIYGJXFQHQY-FDDCHVKYSA-N 0 3 422.960 4.429 20 0 HIADHN Cc1ccc([C@@H]2C[C@@H](C)N(C(=O)NCc3ccccc3CN3CCC(O)CC3)C2)cc1 ZINC000426041626 856066902 /nfs/dbraw/zinc/06/69/02/856066902.db2.gz GNDRFGPVCGZRKN-HYBUGGRVSA-N 0 3 421.585 4.039 20 0 HIADHN Cc1cccc(C(NC(=O)N2CCN(C3CCOCC3)C[C@@H]2C)c2cccc(C)c2)c1 ZINC000426056822 856077722 /nfs/dbraw/zinc/07/77/22/856077722.db2.gz CQANTARTNYRFCJ-NRFANRHFSA-N 0 3 421.585 4.288 20 0 HIADHN C[C@@H](CCCC(F)(F)F)N[C@H]1CCS(=O)(=O)c2ccc(Br)cc21 ZINC000426065373 856082966 /nfs/dbraw/zinc/08/29/66/856082966.db2.gz AVFLUXGWXUUPKM-GWCFXTLKSA-N 0 3 414.287 4.378 20 0 HIADHN CCOc1ccccc1[C@@H](CC(C)C)NC(=O)N1CCN(C2CCOCC2)C[C@@H]1C ZINC000426068644 856085377 /nfs/dbraw/zinc/08/53/77/856085377.db2.gz CSABJFSQAPDBPV-SIKLNZKXSA-N 0 3 417.594 4.067 20 0 HIADHN CSc1ccc(Cl)cc1NC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1CO ZINC000426098071 856107002 /nfs/dbraw/zinc/10/70/02/856107002.db2.gz FEIMIWOZPIPZPO-SJLPKXTDSA-N 0 3 419.978 4.066 20 0 HIADHN Nc1nc(C2CCCC2)ncc1-c1noc([C@H]2CCCN(Cc3cccc(F)c3)C2)n1 ZINC000426190154 856165605 /nfs/dbraw/zinc/16/56/05/856165605.db2.gz DTQUJQCXHYPHAM-KRWDZBQOSA-N 0 3 422.508 4.285 20 0 HIADHN C[C@H]1CN(C2CCOCC2)CCN1C(=O)N[C@@H]1C[C@@H]2CCC(C)(C)c3cccc1c32 ZINC000426217221 856182812 /nfs/dbraw/zinc/18/28/12/856182812.db2.gz XMMOQMIOJROZQB-NPPFBWRTSA-N 0 3 411.590 4.181 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)NC12CCC(C(F)(F)F)(CC1)CC2 ZINC000426246895 856200248 /nfs/dbraw/zinc/20/02/48/856200248.db2.gz WTWZJXNVMWDEOG-QVKFIVLNSA-N 0 3 409.496 4.461 20 0 HIADHN CC(C)c1nnc(CCN[C@H](C)c2ccccc2I)s1 ZINC000426299805 856230765 /nfs/dbraw/zinc/23/07/65/856230765.db2.gz ASFBJIGPABXFOC-LLVKDONJSA-N 0 3 401.317 4.159 20 0 HIADHN C[C@H](N[C@H]1c2cccc(Br)c2CC1(C)C)c1cccc(S(N)(=O)=O)c1 ZINC000426330168 856249728 /nfs/dbraw/zinc/24/97/28/856249728.db2.gz JGMDCWCGLPBOFG-SGTLLEGYSA-N 0 3 423.376 4.071 20 0 HIADHN COc1ccccc1[C@H](NC(=O)NC[C@@H](C)N(C)Cc1ccccc1)c1ccco1 ZINC000426351080 856255926 /nfs/dbraw/zinc/25/59/26/856255926.db2.gz HLEVBDIUYCRFOX-JPYJTQIMSA-N 0 3 407.514 4.197 20 0 HIADHN COc1ccccc1[C@@H](NC(=O)NC[C@@H](C)N(C)Cc1ccccc1)c1ccco1 ZINC000426351082 856256322 /nfs/dbraw/zinc/25/63/22/856256322.db2.gz HLEVBDIUYCRFOX-WZONZLPQSA-N 0 3 407.514 4.197 20 0 HIADHN COC[C@@H](NC(=O)N(Cc1ccccc1)C1CCN(C)CC1)c1ccc(Cl)cc1 ZINC000426593262 856364321 /nfs/dbraw/zinc/36/43/21/856364321.db2.gz LXPRGBMFAAWSEE-JOCHJYFZSA-N 0 3 415.965 4.334 20 0 HIADHN CCN(C(=O)c1cc(C)nc(C(F)(F)F)n1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000426640139 856389416 /nfs/dbraw/zinc/38/94/16/856389416.db2.gz QEVJGJRQQYGGCM-WBVHZDCISA-N 0 3 406.452 4.101 20 0 HIADHN C[C@@H](NC(=O)N(CCN(C)C)Cc1cccc(F)c1)c1nc(C(F)(F)F)cs1 ZINC000426656601 856396894 /nfs/dbraw/zinc/39/68/94/856396894.db2.gz IZXZYRXNGGSYHP-GFCCVEGCSA-N 0 3 418.460 4.135 20 0 HIADHN COc1ccccc1NC(=O)c1ccc(NC(=O)[C@H](C)N2C[C@@H]3CCCC[C@@H]3C2)cc1 ZINC000426817973 856494993 /nfs/dbraw/zinc/49/49/93/856494993.db2.gz QNMHAVWEBXFURR-YSIASYRMSA-N 0 3 421.541 4.397 20 0 HIADHN O=C(NCc1ccnc(Oc2ccccc2F)c1)N1CCN(C2CCCCC2)CC1 ZINC000426833621 856505477 /nfs/dbraw/zinc/50/54/77/856505477.db2.gz LRAZNTXFKQKUPQ-UHFFFAOYSA-N 0 3 412.509 4.173 20 0 HIADHN Cc1cccc(OCCCNC(=O)N(Cc2ccccc2)C2CCN(C)CC2)c1C ZINC000426863774 856517741 /nfs/dbraw/zinc/51/77/41/856517741.db2.gz HAGHZBFIBMAZFL-UHFFFAOYSA-N 0 3 409.574 4.378 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)N[C@H](c3ccco3)c3ccccc3)CC2)c1 ZINC000426889198 856528186 /nfs/dbraw/zinc/52/81/86/856528186.db2.gz DJXKZXCARGAWSW-VWLOTQADSA-N 0 3 403.526 4.006 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)C/C=C/c2ccccc2F)cc1)[C@@H]1CCCN(C)C1 ZINC000426948128 856557024 /nfs/dbraw/zinc/55/70/24/856557024.db2.gz KGYSUFCOVYYYTL-WKOQKXSESA-N 0 3 409.505 4.034 20 0 HIADHN Cc1cc(NC(=O)c2ccc(NC(C)C)nc2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000427059649 856615113 /nfs/dbraw/zinc/61/51/13/856615113.db2.gz BQRILCXMBLASRI-OAQYLSRUSA-N 0 3 418.545 4.106 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)CCCCCc3ccc(F)cc3)CC2)C[C@H](C)O1 ZINC000427127053 856654901 /nfs/dbraw/zinc/65/49/01/856654901.db2.gz SMBATKBCRHJPBT-BGYRXZFFSA-N 0 3 404.570 4.276 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)c3cc(Cl)cc(C(F)(F)F)c3)CC2)C[C@H](C)O1 ZINC000427128132 856656827 /nfs/dbraw/zinc/65/68/27/856656827.db2.gz YURNHJBDFAZKEY-OKILXGFUSA-N 0 3 418.887 4.320 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)CSc3ccccc3Cl)CC2)C[C@H](C)O1 ZINC000427287143 856752319 /nfs/dbraw/zinc/75/23/19/856752319.db2.gz IXYDGEJOMOJDKM-CALCHBBNSA-N 0 3 411.011 4.170 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N(Cc1cccc(F)c1)C1CCCC1 ZINC000437471958 862832870 /nfs/dbraw/zinc/83/28/70/862832870.db2.gz JMBFQWRSSXRGTH-UHFFFAOYSA-N 0 3 411.521 4.106 20 0 HIADHN Cc1c(Br)cccc1C(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000427296005 856757399 /nfs/dbraw/zinc/75/73/99/856757399.db2.gz LUNYJDOTLUZQEF-IYBDPMFKSA-N 0 3 423.395 4.109 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)c3cc4cc(Cl)ccc4o3)CC2)C[C@H](C)O1 ZINC000427297651 856758345 /nfs/dbraw/zinc/75/83/45/856758345.db2.gz VPHVKZWASJWYMZ-HOTGVXAUSA-N 0 3 404.938 4.438 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3ccc(F)c(C(F)(F)F)c3)CC2)C[C@H](C)O1 ZINC000427301478 856759993 /nfs/dbraw/zinc/75/99/93/856759993.db2.gz XUTXLTMKGFRZCQ-GASCZTMLSA-N 0 3 416.459 4.196 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3ccc(F)c(C(F)(F)F)c3)CC2)C[C@@H](C)O1 ZINC000427301482 856760020 /nfs/dbraw/zinc/76/00/20/856760020.db2.gz XUTXLTMKGFRZCQ-HUUCEWRRSA-N 0 3 416.459 4.196 20 0 HIADHN CCc1c(C(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)cnn1-c1ccc(F)cc1 ZINC000437471414 862833217 /nfs/dbraw/zinc/83/32/17/862833217.db2.gz KQGMIILINDZTTO-LJQANCHMSA-N 0 3 420.532 4.310 20 0 HIADHN C[C@@H](SCc1ccccc1)C(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000427306144 856762191 /nfs/dbraw/zinc/76/21/91/856762191.db2.gz ZRCWIQCDPCBIKW-HSALFYBXSA-N 0 3 404.620 4.046 20 0 HIADHN Cc1cc(C(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)cc(C)c1OC(F)F ZINC000427312447 856764516 /nfs/dbraw/zinc/76/45/16/856764516.db2.gz JKDDMCDPFAPMRA-QZTJIDSGSA-N 0 3 424.532 4.256 20 0 HIADHN COc1ccc(Cl)cc1NCCC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1 ZINC000437473090 862834274 /nfs/dbraw/zinc/83/42/74/862834274.db2.gz NRCREZMUEPXUDN-SFHVURJKSA-N 0 3 415.965 4.274 20 0 HIADHN COc1ccccc1C[C@H](C)CC(=O)N1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000427330995 856774944 /nfs/dbraw/zinc/77/49/44/856774944.db2.gz OMGBASKGSWFCGL-ACRUOGEOSA-N 0 3 416.606 4.002 20 0 HIADHN C[C@@H]1CCN(C(=O)c2c[nH]nc2-c2ccc(Cl)cc2)CCN1Cc1ccccc1 ZINC000437477026 862837274 /nfs/dbraw/zinc/83/72/74/862837274.db2.gz SPUXXDXGDQDOBJ-QGZVFWFLSA-N 0 3 408.933 4.467 20 0 HIADHN CC(C)CC(=O)N[C@H](C(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1)c1ccccc1 ZINC000437477069 862837307 /nfs/dbraw/zinc/83/73/07/862837307.db2.gz RYMDZZHMBUKJCG-BWKNWUBXSA-N 0 3 421.585 4.013 20 0 HIADHN CCOC(=O)c1c2c(sc1NC(=O)c1ncccc1C)C(C)(C)NC(C)(C)C2 ZINC000427484805 856838640 /nfs/dbraw/zinc/83/86/40/856838640.db2.gz WGZMRUZLJVXSGR-UHFFFAOYSA-N 0 3 401.532 4.040 20 0 HIADHN CCN1CCC[C@@H](CN(C)C(=O)C[C@H](C)c2c[nH]c3ccccc32)[C@@H]1c1cnn(C)c1 ZINC000427490121 856839383 /nfs/dbraw/zinc/83/93/83/856839383.db2.gz HFIHAUDMNZBUHP-XHNVNVPESA-N 0 3 421.589 4.327 20 0 HIADHN COc1cc([C@H](C)N[C@@H]2CCCc3ncc(C(F)(F)F)cc32)ccc1OCCO ZINC000427583929 856877631 /nfs/dbraw/zinc/87/76/31/856877631.db2.gz SDZYQGFKGONXGG-SCLBCKFNSA-N 0 3 410.436 4.208 20 0 HIADHN CSc1cc(C(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)ccc1NC(C)=O ZINC000437488171 862845805 /nfs/dbraw/zinc/84/58/05/862845805.db2.gz CSGUBCMLJLGWBO-KRWDZBQOSA-N 0 3 411.571 4.104 20 0 HIADHN Cc1cc2c(cc1C)[C@@H](NCc1ccc(C(=O)N3CCN(C)CC3)cc1)CCS2 ZINC000427593725 856881097 /nfs/dbraw/zinc/88/10/97/856881097.db2.gz LZSZTDUYKKOYSM-QFIPXVFZSA-N 0 3 409.599 4.018 20 0 HIADHN Cc1cc2c(cc1C)[C@@H](NCc1cccc(OCCN3CCOCC3)c1)CCS2 ZINC000427605938 856886305 /nfs/dbraw/zinc/88/63/05/856886305.db2.gz FJVMEIORYLKFRL-QHCPKHFHSA-N 0 3 412.599 4.341 20 0 HIADHN O=C(CCc1ccccc1)N1CC[C@H](N[C@@H]2CCCc3ncc(C(F)(F)F)cc32)C1 ZINC000427698462 856913446 /nfs/dbraw/zinc/91/34/46/856913446.db2.gz TVUSUGABDANGOU-GHTZIAJQSA-N 0 3 417.475 4.301 20 0 HIADHN Cc1cnc([C@@H](C)Nc2cccc(N3CCN(CCc4ccccc4)CC3)c2)cn1 ZINC000427830806 856974164 /nfs/dbraw/zinc/97/41/64/856974164.db2.gz HTWQUOAVNUBRHZ-OAQYLSRUSA-N 0 3 401.558 4.323 20 0 HIADHN Fc1ccccc1[C@H](N[C@@H]1CCn2ccnc2C1)c1ccc(Br)cc1 ZINC000427865888 856987215 /nfs/dbraw/zinc/98/72/15/856987215.db2.gz OGZGOKWSAKKHDP-OXQOHEQNSA-N 0 3 400.295 4.479 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1sc([C@H]2CCCOC2)nc1C)c1ccsc1 ZINC000428179699 857099375 /nfs/dbraw/zinc/09/93/75/857099375.db2.gz YUWAWKFXZQQQPB-RDJZCZTQSA-N 0 3 407.605 4.220 20 0 HIADHN CCCc1nc(C)c(CN2CCC[C@H](c3nnc4ccc(C(F)(F)F)cn43)C2)o1 ZINC000428380436 857183648 /nfs/dbraw/zinc/18/36/48/857183648.db2.gz CVDLNLSNFKMQDY-AWEZNQCLSA-N 0 3 407.440 4.377 20 0 HIADHN CC[C@]1(O)CCN(Cc2ccc(OCCOc3ccccc3Cl)c(OC)c2)C1 ZINC000428422670 857199686 /nfs/dbraw/zinc/19/96/86/857199686.db2.gz MUOJBDXDFZUVOL-QFIPXVFZSA-N 0 3 405.922 4.153 20 0 HIADHN C[C@@H](c1cccc(N2CCCS2(=O)=O)c1)N(C)Cc1ccc(OCC(F)F)cc1 ZINC000428473063 857214667 /nfs/dbraw/zinc/21/46/67/857214667.db2.gz DAWJNEWTVNANSL-INIZCTEOSA-N 0 3 424.513 4.063 20 0 HIADHN CN(C(=O)c1cc(Br)c(F)cc1F)[C@H]1CCN(Cc2ccccc2)C1 ZINC000428527220 857241666 /nfs/dbraw/zinc/24/16/66/857241666.db2.gz KTGWAXVWQIUCAB-AWEZNQCLSA-N 0 3 409.274 4.074 20 0 HIADHN Cc1ccccc1-n1ncc(C(=O)Nc2cccc(CN3CC[C@H](O)C3)c2)c1C(C)C ZINC000428533227 857245686 /nfs/dbraw/zinc/24/56/86/857245686.db2.gz MUZRYGAKXPZLFT-NRFANRHFSA-N 0 3 418.541 4.123 20 0 HIADHN O=C(CSc1cc(Cl)ccc1Cl)Nc1cccc(CN2CC[C@H](O)C2)c1 ZINC000428539148 857250564 /nfs/dbraw/zinc/25/05/64/857250564.db2.gz PJKRDKALMPPGRK-INIZCTEOSA-N 0 3 411.354 4.291 20 0 HIADHN CC(C)COc1ccc(C2(C(=O)Nc3cccc(CN4CC[C@@H](O)C4)c3)CCC2)cc1 ZINC000428539634 857250669 /nfs/dbraw/zinc/25/06/69/857250669.db2.gz QKMOCHJWQFRLTB-HSZRJFAPSA-N 0 3 422.569 4.348 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)c1cc2ccccc2cc1OC(F)F ZINC000428541503 857252481 /nfs/dbraw/zinc/25/24/81/857252481.db2.gz PKHHOZNZQOOLHX-IBGZPJMESA-N 0 3 412.436 4.260 20 0 HIADHN CC(C)(C(=O)Nc1cccc(CN2CC[C@@H](O)C2)c1)c1ccc(OC(F)(F)F)cc1 ZINC000428542499 857254969 /nfs/dbraw/zinc/25/49/69/857254969.db2.gz FYMLDZAHPDAGKN-GOSISDBHSA-N 0 3 422.447 4.068 20 0 HIADHN OC[C@H](CNCc1nc2ccc(F)cc2s1)Cc1cccc(Br)c1 ZINC000428548731 857258535 /nfs/dbraw/zinc/25/85/35/857258535.db2.gz OZLRVSUSEPVJPN-ZDUSSCGKSA-N 0 3 409.324 4.139 20 0 HIADHN CCCn1c2ccccc2nc1CNC[C@H](CO)Cc1ccccc1Br ZINC000428550009 857260001 /nfs/dbraw/zinc/26/00/01/857260001.db2.gz QTFOLKOTGOWROO-MRXNPFEDSA-N 0 3 416.363 4.150 20 0 HIADHN Cc1ccc(C(=O)Nc2cccc(CN3CC[C@@H](O)C3)c2)cc1Oc1ccncc1 ZINC000428553553 857261595 /nfs/dbraw/zinc/26/15/95/857261595.db2.gz XJHQXFCOVVGZPT-OAQYLSRUSA-N 0 3 403.482 4.001 20 0 HIADHN O=C(Nc1ccc(Cc2nc3ccccc3s2)cc1)N1CC[C@@H](N2CC=CC2)C1 ZINC000437570587 862891803 /nfs/dbraw/zinc/89/18/03/862891803.db2.gz UBWZYYOJAHRFSU-LJQANCHMSA-N 0 3 404.539 4.365 20 0 HIADHN CN1CCC[C@@H](CNC(=O)c2ncc(F)cc2F)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000428716612 857307958 /nfs/dbraw/zinc/30/79/58/857307958.db2.gz ALEUNYMHDDXMQW-SCLBCKFNSA-N 0 3 413.390 4.192 20 0 HIADHN CN1CCC[C@@H](CNC(=O)c2ncc(F)cc2F)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000428716614 857308204 /nfs/dbraw/zinc/30/82/04/857308204.db2.gz ALEUNYMHDDXMQW-UGSOOPFHSA-N 0 3 413.390 4.192 20 0 HIADHN FC(F)n1ccnc1CN(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000428807827 857353024 /nfs/dbraw/zinc/35/30/24/857353024.db2.gz SUUFKXVDURJMAC-NRFANRHFSA-N 0 3 411.500 4.340 20 0 HIADHN CCOc1ccccc1[C@H](C)NC(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000428835497 857366287 /nfs/dbraw/zinc/36/62/87/857366287.db2.gz YSXJKUCJDDSQSA-AQNXPRMDSA-N 0 3 417.594 4.067 20 0 HIADHN CCOc1ccc(C(=O)N2CCC(NCc3nc4ccc(F)cc4s3)CC2)cc1 ZINC000428851037 857371857 /nfs/dbraw/zinc/37/18/57/857371857.db2.gz OXIZYDUQAGCBCP-UHFFFAOYSA-N 0 3 413.518 4.229 20 0 HIADHN CO[C@@H](C)c1nc(CNC(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)cs1 ZINC000428918602 857414379 /nfs/dbraw/zinc/41/43/79/857414379.db2.gz GOUCZJUHZSNRRM-DOTOQJQBSA-N 0 3 422.620 4.184 20 0 HIADHN CCCN(Cc1ccc(F)cc1)C(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000429005323 857452651 /nfs/dbraw/zinc/45/26/51/857452651.db2.gz RZCITIVDPIBIJG-QHCPKHFHSA-N 0 3 413.537 4.038 20 0 HIADHN C[C@@H](c1cc2ccccc2o1)N(C)C(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000429013016 857456524 /nfs/dbraw/zinc/45/65/24/857456524.db2.gz VRZLQDNVCAQKOH-UGKGYDQZSA-N 0 3 421.541 4.426 20 0 HIADHN Cc1ccc(C)c([C@H](C)N(C)C(=O)NC[C@@H]2CN(Cc3ccccc3)CCCO2)c1 ZINC000429017508 857459499 /nfs/dbraw/zinc/45/94/99/857459499.db2.gz FNNBMMDUJVHTRS-JTHBVZDNSA-N 0 3 409.574 4.297 20 0 HIADHN Cc1ccc([C@H](C)N(C)C(=O)NC[C@@H]2CN(Cc3ccccc3)CCCO2)c(C)c1 ZINC000429017752 857459709 /nfs/dbraw/zinc/45/97/09/857459709.db2.gz GMBHNDMVBUZCFW-JTHBVZDNSA-N 0 3 409.574 4.297 20 0 HIADHN Cc1ccc(S(=O)(=O)NC[C@H]2CCCN(Cc3ccc4nc(C)ccc4c3)C2)cc1 ZINC000437601339 862914432 /nfs/dbraw/zinc/91/44/32/862914432.db2.gz LDYSZRSVEFOAAJ-OAQYLSRUSA-N 0 3 423.582 4.042 20 0 HIADHN CC(C)[C@H](c1ccccc1)N(C)C(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000429036688 857469134 /nfs/dbraw/zinc/46/91/34/857469134.db2.gz UEXBOWAMFFJYJO-BJKOFHAPSA-N 0 3 409.574 4.316 20 0 HIADHN CC(C)COc1ccccc1NC(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000429044724 857473515 /nfs/dbraw/zinc/47/35/15/857473515.db2.gz DSLIIKKZIGRJLS-WOJBJXKFSA-N 0 3 417.594 4.465 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3ccc4ncsc4c3)CC2)C[C@@H](C)O1 ZINC000429076212 857497090 /nfs/dbraw/zinc/49/70/90/857497090.db2.gz MMCXMFIVUQZHRO-HZPDHXFCSA-N 0 3 402.564 4.040 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1)c1cccc(N2CCCC2)c1 ZINC000429080714 857499041 /nfs/dbraw/zinc/49/90/41/857499041.db2.gz ONLBZMDUDUNMDA-SXWKCWPCSA-N 0 3 406.574 4.483 20 0 HIADHN CC(=O)N1CCC(N(Cc2cncs2)C[C@H](OC(C)C)c2ccccc2)CC1 ZINC000429116753 857517851 /nfs/dbraw/zinc/51/78/51/857517851.db2.gz OAVKCRBIAQCDLK-QFIPXVFZSA-N 0 3 401.576 4.122 20 0 HIADHN CC(=O)N1CCC(N(CCCOc2cccc(Cl)c2)Cc2cncs2)CC1 ZINC000429164767 857537578 /nfs/dbraw/zinc/53/75/78/857537578.db2.gz XPHKIBKNGFOWAT-UHFFFAOYSA-N 0 3 407.967 4.079 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)N[C@@H]3CCC[C@@H](C(F)(F)F)C3)CC2)C[C@@H](C)O1 ZINC000429211630 857557684 /nfs/dbraw/zinc/55/76/84/857557684.db2.gz DVVSQFVKULMUAH-PSBWJHGTSA-N 0 3 419.532 4.028 20 0 HIADHN CCCn1ccnc1CCCN(C)[C@@H](C)C(=O)N(c1nccs1)C1CCCCC1 ZINC000429225140 857563174 /nfs/dbraw/zinc/56/31/74/857563174.db2.gz DEUBIFASZDBYTA-SFHVURJKSA-N 0 3 417.623 4.368 20 0 HIADHN Cc1cc(CC(C)(C)NCc2nc3ccccc3c(=O)n2C)ccc1Br ZINC000429239678 857568807 /nfs/dbraw/zinc/56/88/07/857568807.db2.gz HDYAHFXJOPDZSC-UHFFFAOYSA-N 0 3 414.347 4.115 20 0 HIADHN CSC[C@H]1CCCN(CC(=O)N(C)[C@H](c2ccccc2)c2ccc(F)cc2)C1 ZINC000429275248 857586258 /nfs/dbraw/zinc/58/62/58/857586258.db2.gz KQMZSSRIILZVBZ-FDDCHVKYSA-N 0 3 400.563 4.449 20 0 HIADHN CSC[C@@H]1CCCN(CC(=O)N(C)[C@H](c2ccccc2)c2ccc(F)cc2)C1 ZINC000429275255 857586371 /nfs/dbraw/zinc/58/63/71/857586371.db2.gz KQMZSSRIILZVBZ-WZONZLPQSA-N 0 3 400.563 4.449 20 0 HIADHN O=C(CN[C@@H]1Cc2cccc(O)c2C1)Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000429295504 857594595 /nfs/dbraw/zinc/59/45/95/857594595.db2.gz BBRIYSICBIZKBC-CYBMUJFWSA-N 0 3 418.337 4.125 20 0 HIADHN CCC1(CC)[C@H](NCC(=O)Nc2ccc(NC(=O)c3cccs3)cc2)C[C@@H]1OC ZINC000429303454 857597174 /nfs/dbraw/zinc/59/71/74/857597174.db2.gz WIBNXFBVSWJLTH-MOPGFXCFSA-N 0 3 415.559 4.122 20 0 HIADHN COC(=O)[C@H]1CCN([C@@H](C)c2nc(-c3cccc(C(F)(F)F)c3)no2)[C@H]1C(C)C ZINC000429376504 857631479 /nfs/dbraw/zinc/63/14/79/857631479.db2.gz AGDHDSIIHMVSFU-RCBQFDQVSA-N 0 3 411.424 4.336 20 0 HIADHN COC(=O)[C@H]1CCN(Cc2coc(-c3ccc(Br)cc3)n2)[C@H]1C(C)C ZINC000429379837 857632513 /nfs/dbraw/zinc/63/25/13/857632513.db2.gz DPDZUUCTDZTMQB-IRXDYDNUSA-N 0 3 407.308 4.124 20 0 HIADHN COCCS(=O)(=O)c1ccc(CN[C@@H]2CCCc3c4ccccc4sc32)cc1 ZINC000429407605 857649605 /nfs/dbraw/zinc/64/96/05/857649605.db2.gz JWWMGLGURVQVEA-HXUWFJFHSA-N 0 3 415.580 4.489 20 0 HIADHN COCCS(=O)(=O)c1ccc(CN[C@H]2CCCc3ccc(C(C)C)cc32)cc1 ZINC000429417088 857655415 /nfs/dbraw/zinc/65/54/15/857655415.db2.gz MLOMAXYZYZGADB-QHCPKHFHSA-N 0 3 401.572 4.397 20 0 HIADHN CCO[C@H]1C[C@@H](NC(=O)N(Cc2ccco2)C2CCN(C)CC2)C12CCCCC2 ZINC000429463415 857684389 /nfs/dbraw/zinc/68/43/89/857684389.db2.gz BPNNMYYKGUBGNI-RTWAWAEBSA-N 0 3 403.567 4.013 20 0 HIADHN CC(C)(C)[C@@H](CN1CCc2ccccc2C1)NC(=O)N1CCC[C@@H]1c1ccncc1 ZINC000429492715 857694675 /nfs/dbraw/zinc/69/46/75/857694675.db2.gz QLPWDHQRRNPXNC-DHIUTWEWSA-N 0 3 406.574 4.401 20 0 HIADHN CC(C)(C)[C@@H](CN1CCc2ccccc2C1)NC(=O)N1CCCC[C@H]1c1ncc[nH]1 ZINC000429499676 857699262 /nfs/dbraw/zinc/69/92/62/857699262.db2.gz UHOOMLRFOXRCJZ-LEWJYISDSA-N 0 3 409.578 4.119 20 0 HIADHN Cc1ccc([C@@H](C)CNC(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)cc1 ZINC000429504242 857702189 /nfs/dbraw/zinc/70/21/89/857702189.db2.gz PDVNAIXLSQPBAR-PCCBWWKXSA-N 0 3 401.595 4.019 20 0 HIADHN C[C@H](NC(=O)Nc1ccnn1Cc1cccc(Cl)c1Cl)C1=CCN(C)CC1 ZINC000429539582 857732201 /nfs/dbraw/zinc/73/22/01/857732201.db2.gz QQGNNBBYWJODJO-ZDUSSCGKSA-N 0 3 408.333 4.010 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1ccnn1Cc1ccc(F)cc1 ZINC000429567901 857753303 /nfs/dbraw/zinc/75/33/03/857753303.db2.gz HOAQGQRLEYMXEX-LJQANCHMSA-N 0 3 421.520 4.199 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)Nc1ccnn1Cc1ccc(F)cc1 ZINC000429576998 857762833 /nfs/dbraw/zinc/76/28/33/857762833.db2.gz ZSWQRKXLOHJUCY-SFHVURJKSA-N 0 3 413.522 4.091 20 0 HIADHN CCOC(=O)c1csc(C2CCN(CCC(=O)Nc3ccc(Cl)cc3)CC2)n1 ZINC000429578376 857764352 /nfs/dbraw/zinc/76/43/52/857764352.db2.gz NEILPFDUPGDRDU-UHFFFAOYSA-N 0 3 421.950 4.181 20 0 HIADHN O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)Nc1ccc(C(=O)C2CCC2)cc1 ZINC000429622533 857802641 /nfs/dbraw/zinc/80/26/41/857802641.db2.gz XROMZDXLHDHODB-HSZRJFAPSA-N 0 3 421.541 4.082 20 0 HIADHN Cc1c(NC(=O)NC[C@@H]2CN(Cc3ccccc3)CCCO2)cccc1C(F)(F)F ZINC000429622944 857803762 /nfs/dbraw/zinc/80/37/62/857803762.db2.gz GZDSWRILXGVTAO-GOSISDBHSA-N 0 3 421.463 4.426 20 0 HIADHN Cc1cnc(-c2cccc(NC(=O)NC[C@@H]3CN(Cc4ccccc4)CCCO3)c2)o1 ZINC000429737313 857859466 /nfs/dbraw/zinc/85/94/66/857859466.db2.gz LBQNDTAOKDPUGP-JOCHJYFZSA-N 0 3 420.513 4.063 20 0 HIADHN Cc1ccc(NC(=O)NC[C@@H]2CN(Cc3ccccc3)CCCO2)cc1OC(F)F ZINC000429753534 857872438 /nfs/dbraw/zinc/87/24/38/857872438.db2.gz RRLJFAJFEANSBI-LJQANCHMSA-N 0 3 419.472 4.009 20 0 HIADHN CC(C)N1CC[C@@H](N[C@@H](C)C(=O)Nc2nccs2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000429791486 857886341 /nfs/dbraw/zinc/88/63/41/857886341.db2.gz VYBAAHQYDPOZNK-VUCTXSBTSA-N 0 3 410.946 4.076 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1cccc(-c2ncc3n2CCCC3)c1 ZINC000429935210 857957718 /nfs/dbraw/zinc/95/77/18/857957718.db2.gz ARKJXLSXOQTKHY-UHFFFAOYSA-N 0 3 407.518 4.075 20 0 HIADHN CN(C)Cc1cccc(NC(=O)C(=O)Nc2ccc(C(C)(C)C(F)(F)F)cc2)c1 ZINC000429951527 857965912 /nfs/dbraw/zinc/96/59/12/857965912.db2.gz JAOPQHAENFYPBQ-UHFFFAOYSA-N 0 3 407.436 4.165 20 0 HIADHN CCN1CCN(c2cccc(NCc3ccccc3OCc3ccccn3)c2)CC1 ZINC000430011519 857996400 /nfs/dbraw/zinc/99/64/00/857996400.db2.gz OCVKWXMOZQWAAA-UHFFFAOYSA-N 0 3 402.542 4.415 20 0 HIADHN COc1ccccc1-c1ncc(CN2C[C@@H]3CCC[C@@]3(C(=O)OC(C)(C)C)C2)cn1 ZINC000430066951 858019029 /nfs/dbraw/zinc/01/90/29/858019029.db2.gz NZFJFDGAPGSJJI-MHECFPHRSA-N 0 3 409.530 4.096 20 0 HIADHN c1c(CN2CCOC[C@@H](C3CCC3)C2)c(-c2cccnc2)nn1Cc1ccccc1 ZINC000430129535 858045479 /nfs/dbraw/zinc/04/54/79/858045479.db2.gz ZWYIYAJTQGWKKE-DEOSSOPVSA-N 0 3 402.542 4.242 20 0 HIADHN CN(CCSc1nnc(COc2ccccc2Cl)n1C)Cc1ccccc1 ZINC000430138213 858049654 /nfs/dbraw/zinc/04/96/54/858049654.db2.gz HMHJIVQFDCEQIL-UHFFFAOYSA-N 0 3 402.951 4.272 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCc1c(F)cc(F)c(F)c1F)c1ccsc1 ZINC000430200296 858079327 /nfs/dbraw/zinc/07/93/27/858079327.db2.gz UHMCEXGWVHKEKU-OAHLLOKOSA-N 0 3 403.445 4.187 20 0 HIADHN CNC(=O)[C@]1(C)CCN([C@H](C)c2nc3cc(Cl)ccc3n2Cc2ccccc2)C1 ZINC000430251039 858096270 /nfs/dbraw/zinc/09/62/70/858096270.db2.gz BVUWZIDSNAPBPR-WAIKUNEKSA-N 0 3 410.949 4.257 20 0 HIADHN COCc1cccc(OCC2(CN3C[C@H](C)O[C@@]4(CCO[C@H](C)C4)C3)CCC2)c1 ZINC000430257543 858098329 /nfs/dbraw/zinc/09/83/29/858098329.db2.gz MERHLKYOHHQYJF-JXALWOEJSA-N 0 3 403.563 4.041 20 0 HIADHN C[C@@H]1CN(CCC(=O)Nc2ccccc2Oc2ccccc2)C[C@]2(CCO[C@H](C)C2)O1 ZINC000430270696 858103899 /nfs/dbraw/zinc/10/38/99/858103899.db2.gz SLRXNSNRFBKJHE-UMEGOILYSA-N 0 3 424.541 4.466 20 0 HIADHN CN(C(=O)N[C@@H](CC1CC1)c1cc(F)cc(Br)c1)[C@@H]1CCN(C2CC2)C1 ZINC000430295536 858111659 /nfs/dbraw/zinc/11/16/59/858111659.db2.gz CYGILVIMKDYZCI-MOPGFXCFSA-N 0 3 424.358 4.308 20 0 HIADHN CN(C(=O)[C@H]1CCN(CCc2cc(Cl)c3c(c2)OCCCO3)C1)c1ccccc1 ZINC000430296253 858112517 /nfs/dbraw/zinc/11/25/17/858112517.db2.gz INFPRHMUHBBWFX-SFHVURJKSA-N 0 3 414.933 4.029 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)NC[C@]1(Cc2ccc(F)cc2)CCC[C@@H]1O ZINC000430481595 858190597 /nfs/dbraw/zinc/19/05/97/858190597.db2.gz GUNZKYUNFQNTIW-WIOPSUGQSA-N 0 3 424.516 4.137 20 0 HIADHN C[C@H](N[C@@H]1c2ccccc2CC[C@H]1C)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000430694102 858271176 /nfs/dbraw/zinc/27/11/76/858271176.db2.gz IYWIXECIIYCMSX-NQCMUKECSA-N 0 3 423.376 4.071 20 0 HIADHN CC(C)[C@H](N[C@H](C)c1ccc(Br)c(S(N)(=O)=O)c1)c1ccccc1 ZINC000430694428 858271431 /nfs/dbraw/zinc/27/14/31/858271431.db2.gz DOGCHZZRZLNVDD-ACJLOTCBSA-N 0 3 411.365 4.144 20 0 HIADHN C[C@@H](N[C@@H]1CC(C)(C)c2ccccc21)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000430704712 858273875 /nfs/dbraw/zinc/27/38/75/858273875.db2.gz JJRZUKPHHCQVMR-SJKOYZFVSA-N 0 3 423.376 4.170 20 0 HIADHN C[C@@H]1[C@H](C(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)[C@H]1c1ccccc1 ZINC000430828478 858319631 /nfs/dbraw/zinc/31/96/31/858319631.db2.gz TXNYMBFBNJOTQD-DAQNBYSMSA-N 0 3 400.526 4.318 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)N2CCC[C@H]2c2ccc(Br)c(F)c2)CN1C1CC1 ZINC000430855408 858335777 /nfs/dbraw/zinc/33/57/77/858335777.db2.gz STXWUGCGLNNAKX-DFHBCGBQSA-N 0 3 410.331 4.060 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)N2CCC[C@@H]2c2ccc(Br)c(F)c2)CN1C1CC1 ZINC000430855410 858336185 /nfs/dbraw/zinc/33/61/85/858336185.db2.gz STXWUGCGLNNAKX-RVZJWNSFSA-N 0 3 410.331 4.060 20 0 HIADHN CN(C(=O)[C@@H]1CCN(Cc2cn(C)nc2-c2ccccc2Cl)C1)c1ccccc1 ZINC000430865964 858345130 /nfs/dbraw/zinc/34/51/30/858345130.db2.gz PMFRWYWWXNKLEZ-QGZVFWFLSA-N 0 3 408.933 4.225 20 0 HIADHN CCN(CC)[C@H](CN1C(=O)N[C@@H](c2ccc(OC)c(Cl)c2)C1=O)c1ccsc1 ZINC000430870819 858347896 /nfs/dbraw/zinc/34/78/96/858347896.db2.gz VLZUVSNELKDXSF-AEFFLSMTSA-N 0 3 421.950 4.086 20 0 HIADHN Cc1cc([C@@H]2CCCN2C(=O)N[C@@H](C)C2=CCN(C)CC2)ccc1Br ZINC000430886528 858354855 /nfs/dbraw/zinc/35/48/55/858354855.db2.gz UJHDJBOPFGGKKN-KXBFYZLASA-N 0 3 406.368 4.254 20 0 HIADHN COc1cccc([C@@H](CNC(=O)Cc2c[nH]c3cccc(Cl)c23)N2CCCC2)c1 ZINC000430892592 858357404 /nfs/dbraw/zinc/35/74/04/858357404.db2.gz AKSNSNPSBKBPJC-OAQYLSRUSA-N 0 3 411.933 4.326 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)NCc1c(F)cc(F)c(F)c1F ZINC000430936765 858375324 /nfs/dbraw/zinc/37/53/24/858375324.db2.gz WTJBWEVEAHLISR-CQSZACIVSA-N 0 3 409.427 4.049 20 0 HIADHN COc1ccc([C@@H](CN2C(=O)CN([C@H](C)c3ccccc3)C2=O)N2CCCCC2)cc1 ZINC000430953524 858381429 /nfs/dbraw/zinc/38/14/29/858381429.db2.gz HHZHACUYSVLLAJ-AUSIDOKSSA-N 0 3 421.541 4.248 20 0 HIADHN CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)N[C@H]1CC[C@H](c2ccccc2F)C1 ZINC000431060558 858427721 /nfs/dbraw/zinc/42/77/21/858427721.db2.gz SQIPQKJLTTYLKQ-UDSSINMLSA-N 0 3 410.537 4.191 20 0 HIADHN O=C1[C@@H]2C[C@@H](C3CCCCC3)CN2C(=O)N1C[C@@H]1CCCN(Cc2cccs2)C1 ZINC000431170265 858484651 /nfs/dbraw/zinc/48/46/51/858484651.db2.gz PCPAXWFZSYNZHD-QFUCXCTJSA-N 0 3 415.603 4.193 20 0 HIADHN CC(C)c1cccc2c1OCCC[C@H]2NCc1ccc(C(=O)N2CCN(C)CC2)cc1 ZINC000431323878 858565451 /nfs/dbraw/zinc/56/54/51/858565451.db2.gz QVDQPUDKJDTFEW-XMMPIXPASA-N 0 3 421.585 4.201 20 0 HIADHN C[C@H]1CN(Cc2cccc(CN[C@H]3CCCOc4cc5c(cc43)CCC5)c2)CCO1 ZINC000431328767 858567823 /nfs/dbraw/zinc/56/78/23/858567823.db2.gz OSYZCAPCDQSYPX-DFBJGRDBSA-N 0 3 406.570 4.400 20 0 HIADHN C[C@H](NC(=O)c1cccc(CN2CCCC2)c1)c1noc(-c2ccc(Cl)cc2)n1 ZINC000431514024 858651691 /nfs/dbraw/zinc/65/16/91/858651691.db2.gz OKLQEQIJZXFNAD-HNNXBMFYSA-N 0 3 410.905 4.477 20 0 HIADHN C[C@@H](CCSc1ccccc1)N1CCC(NS(=O)(=O)c2cccs2)CC1 ZINC000431599404 858682997 /nfs/dbraw/zinc/68/29/97/858682997.db2.gz GQPVYBCQYDPBJE-INIZCTEOSA-N 0 3 410.630 4.062 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)C1(Cc2ccc(F)cc2)CCOCC1 ZINC000431692259 858742033 /nfs/dbraw/zinc/74/20/33/858742033.db2.gz PSZGYNLOXDEBIT-QHCPKHFHSA-N 0 3 410.533 4.118 20 0 HIADHN C[C@@H]1CCc2c(F)cccc2[C@@H]1NC(=O)N(C)C1CCN(CCc2ccccn2)CC1 ZINC000431740370 858778840 /nfs/dbraw/zinc/77/88/40/858778840.db2.gz GWSIWNSBYJJOCL-HOYKHHGWSA-N 0 3 424.564 4.193 20 0 HIADHN Cc1nc2ccc(C(=O)NC3CCN(CCOc4ccc(F)cc4)CC3)cc2s1 ZINC000431818404 858827031 /nfs/dbraw/zinc/82/70/31/858827031.db2.gz PWFZTOQKKZODHU-UHFFFAOYSA-N 0 3 413.518 4.017 20 0 HIADHN Cc1cc(C)c(NC(=O)NC[C@H](Cc2ccccc2)N(C)C)c(Br)c1 ZINC000431986301 858905951 /nfs/dbraw/zinc/90/59/51/858905951.db2.gz LRNHWLVIZATZGY-KRWDZBQOSA-N 0 3 404.352 4.360 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)C1(Cc2cccc(F)c2)CCOCC1 ZINC000432061276 858959609 /nfs/dbraw/zinc/95/96/09/858959609.db2.gz MEWXHHLOGXHZHB-HXUWFJFHSA-N 0 3 416.562 4.180 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)CO[C@@H]3CCCc4ccccc43)c2)CC1 ZINC000432251480 859068151 /nfs/dbraw/zinc/06/81/51/859068151.db2.gz STTQEKGWBCXCHH-XMMPIXPASA-N 0 3 407.558 4.250 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)cc1 ZINC000432329358 859106010 /nfs/dbraw/zinc/10/60/10/859106010.db2.gz OSWSOABNXOQXSU-PGRDOPGGSA-N 0 3 420.532 4.409 20 0 HIADHN COCc1ccc([C@@H]2CCCN2C(=O)NC[C@@H](c2cccs2)N2CCCC2)o1 ZINC000467564932 881388466 /nfs/dbraw/zinc/38/84/66/881388466.db2.gz SWQSCPICMUEGKT-ROUUACIJSA-N 0 3 403.548 4.171 20 0 HIADHN CC1CCN([C@H](CNC(=O)NCCC[C@@H]2CCCC[C@H]2O)c2cccs2)CC1 ZINC000432555680 859225058 /nfs/dbraw/zinc/22/50/58/859225058.db2.gz NFKJEYKPWRVQMC-XUVXKRRUSA-N 0 3 407.624 4.152 20 0 HIADHN O=C(Nc1ccc(Br)c(C(F)(F)F)c1)[C@H]1CCCN1C1CCOCC1 ZINC000432585575 859240118 /nfs/dbraw/zinc/24/01/18/859240118.db2.gz SVFCLGYUYYUCLR-OAHLLOKOSA-N 0 3 421.257 4.050 20 0 HIADHN CC1(C)CN(C(=O)Nc2ccc(CCN3CCSCC3)cc2)[C@@H]1c1cccnc1 ZINC000432766699 859346690 /nfs/dbraw/zinc/34/66/90/859346690.db2.gz IFTFXZOGFACOJR-OAQYLSRUSA-N 0 3 410.587 4.288 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCC(c2ncc(C)s2)CC1)c1ccsc1 ZINC000432870961 859399732 /nfs/dbraw/zinc/39/97/32/859399732.db2.gz FUBNDYXSWRTPSY-GOSISDBHSA-N 0 3 406.621 4.485 20 0 HIADHN C[C@@H]1OCC[C@@]1(O)CN[C@H](Cc1ccccc1F)c1ccccc1Br ZINC000433004499 859473671 /nfs/dbraw/zinc/47/36/71/859473671.db2.gz YXGFHUWBDWALDN-VHKYSDTDSA-N 0 3 408.311 4.002 20 0 HIADHN COc1cc(Br)c(CNC[C@H]2CCCN(c3ccccc3)C2)cc1OC ZINC000433182852 859557682 /nfs/dbraw/zinc/55/76/82/859557682.db2.gz PAAIIEWONCHYAT-MRXNPFEDSA-N 0 3 419.363 4.473 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)c1cccc(F)c1Br ZINC000433248421 859590776 /nfs/dbraw/zinc/59/07/76/859590776.db2.gz SPETWEQRYVIRNY-UHFFFAOYSA-N 0 3 423.351 4.432 20 0 HIADHN Cc1ccc([C@H](CNC(=O)C2(Cc3ccc(F)cc3)CCOCC2)N2CCCC2)cc1 ZINC000433248274 859591063 /nfs/dbraw/zinc/59/10/63/859591063.db2.gz PKEZNKLSHGKFEY-DEOSSOPVSA-N 0 3 424.560 4.427 20 0 HIADHN Cc1cnc(C2CCN(C(=O)NC[C@@H](c3cccs3)N3CCCC3)CC2)s1 ZINC000433286152 859617408 /nfs/dbraw/zinc/61/74/08/859617408.db2.gz UETBWXYNQHTGBN-KRWDZBQOSA-N 0 3 404.605 4.239 20 0 HIADHN C[C@H](C(=O)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1)c1cncnc1 ZINC000433306088 859628662 /nfs/dbraw/zinc/62/86/62/859628662.db2.gz RBMAVMWWNQCPHG-HNNXBMFYSA-N 0 3 407.345 4.012 20 0 HIADHN C[C@@H](NCc1cccc(-n2cncn2)c1)c1ccc(OC[C@H]2CCCCO2)c(F)c1 ZINC000433385917 859668634 /nfs/dbraw/zinc/66/86/34/859668634.db2.gz GWGPAWMQRZPQIM-DYESRHJHSA-N 0 3 410.493 4.205 20 0 HIADHN Cc1ccc(Sc2ccc(NC(=O)C(=O)N3CC[C@H]4CC[C@@H](C3)N4C)cc2)c(C)c1 ZINC000467655643 881450524 /nfs/dbraw/zinc/45/05/24/881450524.db2.gz NUXRKXWSXILRTJ-UXHICEINSA-N 0 3 423.582 4.088 20 0 HIADHN Cc1cccc(Cl)c1NC(=O)NCCCN1CCN(C)C[C@H]1c1ccccc1 ZINC000467661808 881455793 /nfs/dbraw/zinc/45/57/93/881455793.db2.gz JEXKTVVTVVLEBJ-FQEVSTJZSA-N 0 3 400.954 4.149 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N(C)Cc1cc(F)cc(F)c1)c1cccc(OC)c1 ZINC000433562611 859780158 /nfs/dbraw/zinc/78/01/58/859780158.db2.gz BFCFEEOTTBBWIG-OAQYLSRUSA-N 0 3 405.489 4.198 20 0 HIADHN C[C@@H](NC(=O)Nc1ccc(Oc2ncc(Cl)cn2)c(Cl)c1)C1=CCN(C)CC1 ZINC000433658371 859827547 /nfs/dbraw/zinc/82/75/47/859827547.db2.gz BTKQKGZZHLJHAQ-GFCCVEGCSA-N 0 3 422.316 4.348 20 0 HIADHN CC(C)N(CCN(C)C)C(=O)Nc1ccc(Oc2ncc(Cl)cn2)c(Cl)c1 ZINC000433684407 859837890 /nfs/dbraw/zinc/83/78/90/859837890.db2.gz IVKULZZDYUKTTQ-UHFFFAOYSA-N 0 3 412.321 4.380 20 0 HIADHN CCNC(=O)Nc1cccc(NC(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)c1C ZINC000433747335 859872891 /nfs/dbraw/zinc/87/28/91/859872891.db2.gz LOUIDCHKTIWGTG-GOSISDBHSA-N 0 3 423.561 4.265 20 0 HIADHN CCNC(=O)Nc1cccc(NC(=O)NC[C@@H](c2ccsc2)N(CC)CC)c1C ZINC000433748062 859873077 /nfs/dbraw/zinc/87/30/77/859873077.db2.gz JAWYILHIHFIYGT-IBGZPJMESA-N 0 3 417.579 4.403 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@H](c3cc(F)ccc3F)C(F)F)c2)CC1 ZINC000433823593 859914166 /nfs/dbraw/zinc/91/41/66/859914166.db2.gz PCVDRISQUMYNLC-LJQANCHMSA-N 0 3 424.442 4.235 20 0 HIADHN Cc1cc(C(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)ccc1NC(=O)CC(C)C ZINC000467689545 881481665 /nfs/dbraw/zinc/48/16/65/881481665.db2.gz VSKMMVQKQHLWJV-SIKLNZKXSA-N 0 3 407.558 4.372 20 0 HIADHN Cc1cc(C(=O)N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)ccc1NC(=O)CC(C)C ZINC000467689544 881482286 /nfs/dbraw/zinc/48/22/86/881482286.db2.gz VSKMMVQKQHLWJV-KNQAVFIVSA-N 0 3 407.558 4.372 20 0 HIADHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1sc(NC(=O)c2cccc(F)c2)cc1C ZINC000434052726 860066093 /nfs/dbraw/zinc/06/60/93/860066093.db2.gz LPZYDEQIQYXNLL-MSOLQXFVSA-N 0 3 415.534 4.147 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)c2ccc(OCc3ccncc3)cc2)CN1Cc1ccccc1 ZINC000467701063 881497315 /nfs/dbraw/zinc/49/73/15/881497315.db2.gz QKRDRRRIESAKEL-XXBNENTESA-N 0 3 401.510 4.053 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)CCCc2ncc(-c3ccccc3)o2)CN1Cc1ccccc1 ZINC000467701299 881497658 /nfs/dbraw/zinc/49/76/58/881497658.db2.gz TYVAUWUISWIKSZ-DENIHFKCSA-N 0 3 403.526 4.444 20 0 HIADHN CN1CCC[C@H](CNC(=O)c2cc(-c3ccc4c(c3)CCO4)no2)[C@@H]1c1cccs1 ZINC000434152914 860149742 /nfs/dbraw/zinc/14/97/42/860149742.db2.gz KUCJVWITJMJNGL-VGOFRKELSA-N 0 3 423.538 4.151 20 0 HIADHN CC(C)[C@@H](CNC(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1)c1cccnc1 ZINC000434169259 860163885 /nfs/dbraw/zinc/16/38/85/860163885.db2.gz HOFAWHOJYJUKQK-IFMALSPDSA-N 0 3 419.491 4.392 20 0 HIADHN C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1 ZINC000467713345 881511641 /nfs/dbraw/zinc/51/16/41/881511641.db2.gz LUVSNIBUTYKLCN-ACJLOTCBSA-N 0 3 405.420 4.105 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)NC[C@@H]2CCCN(c3ccccc3)C2)C1 ZINC000434263788 860239897 /nfs/dbraw/zinc/23/98/97/860239897.db2.gz KODZPAXHGKQTHY-FUPPJEDESA-N 0 3 406.574 4.038 20 0 HIADHN CN(CCC(=O)Nc1ccc(C(N)=O)c(Cl)c1)Cc1ccc(Cl)c(Cl)c1 ZINC000434298997 860262884 /nfs/dbraw/zinc/26/28/84/860262884.db2.gz JITJHOLICDNZTQ-UHFFFAOYSA-N 0 3 414.720 4.206 20 0 HIADHN CSc1cc(C(=O)Nc2c(C)cnn2[C@@H]2CCN(Cc3ccccc3)C2)ccn1 ZINC000434316140 860277534 /nfs/dbraw/zinc/27/75/34/860277534.db2.gz LITAIUUSYYZGPU-LJQANCHMSA-N 0 3 407.543 4.008 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)C1=Cc2ccccc2OC1 ZINC000434324005 860284658 /nfs/dbraw/zinc/28/46/58/860284658.db2.gz CLHFUIZVIAZCAM-QFIPXVFZSA-N 0 3 414.509 4.053 20 0 HIADHN CCSc1cc(C(=O)Nc2c(C)cnn2[C@H]2CCN(Cc3ccccc3)C2)ccn1 ZINC000434324007 860285092 /nfs/dbraw/zinc/28/50/92/860285092.db2.gz BFQPTLYAAQLTQT-FQEVSTJZSA-N 0 3 421.570 4.398 20 0 HIADHN COc1cccc([C@H](C)C(=O)Nc2c(C)cnn2[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000434325226 860285820 /nfs/dbraw/zinc/28/58/20/860285820.db2.gz HKBBCNHISFCNDH-SIKLNZKXSA-N 0 3 418.541 4.389 20 0 HIADHN COc1cccc([C@H](C)C(=O)Nc2c(C)cnn2[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000434325227 860286427 /nfs/dbraw/zinc/28/64/27/860286427.db2.gz HKBBCNHISFCNDH-UGKGYDQZSA-N 0 3 418.541 4.389 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)[C@H](C)OCc1ccccc1 ZINC000434328711 860291151 /nfs/dbraw/zinc/29/11/51/860291151.db2.gz VXJKNAFQXZCEIY-NZQKXSOJSA-N 0 3 418.541 4.182 20 0 HIADHN O=C(NC[C@H]1CCCCN1C1CC1)N1CCC[C@H]1c1nc2cc(Cl)ccc2[nH]1 ZINC000434349222 860305851 /nfs/dbraw/zinc/30/58/51/860305851.db2.gz GTRNGFKCAAEEEH-APWZRJJASA-N 0 3 401.942 4.080 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)[C@H](C)Sc1ccccn1 ZINC000434412075 860339018 /nfs/dbraw/zinc/33/90/18/860339018.db2.gz OONHHLMIFSOYSR-AZUAARDMSA-N 0 3 421.570 4.153 20 0 HIADHN Cc1ccc(Cl)c(NC(=O)NC[C@H]2CN(Cc3ccccc3)CCCO2)c1C ZINC000434489997 860370371 /nfs/dbraw/zinc/37/03/71/860370371.db2.gz WBNKIGOSYDKXTB-IBGZPJMESA-N 0 3 401.938 4.369 20 0 HIADHN Cc1cc(F)ccc1N1CCC[C@H](N2CCC(c3ncc4n3CCCC4)CC2)C1=O ZINC000434681538 860458187 /nfs/dbraw/zinc/45/81/87/860458187.db2.gz PSHXDYQMJGZRQL-QFIPXVFZSA-N 0 3 410.537 4.042 20 0 HIADHN CCC[C@@H](NC(=O)[C@@H](C)N1CCC(c2ncc3n2CCCC3)CC1)c1ccccc1 ZINC000434682734 860458372 /nfs/dbraw/zinc/45/83/72/860458372.db2.gz DFHDROYPDFVLRB-AUSIDOKSSA-N 0 3 408.590 4.445 20 0 HIADHN CCc1ccc([C@@H](C)NC(=O)[C@@H](C)N2CCC(c3ncc4n3CCCC4)CC2)cc1 ZINC000434685286 860459266 /nfs/dbraw/zinc/45/92/66/860459266.db2.gz NILGVDYQSUKOIH-RTBURBONSA-N 0 3 408.590 4.227 20 0 HIADHN Cc1c(Cl)cccc1NC(=O)[C@H](C)N1CCC(c2ncc3n2CCCC3)CC1 ZINC000434686605 860460682 /nfs/dbraw/zinc/46/06/82/860460682.db2.gz AFPQVCGPWXCMLF-INIZCTEOSA-N 0 3 400.954 4.388 20 0 HIADHN C[C@@H](C(=O)N1c2ccccc2CC[C@@H]1C)N1CCC(c2ncc3n2CCCC3)CC1 ZINC000434686906 860460910 /nfs/dbraw/zinc/46/09/10/860460910.db2.gz BKJGUVYQYSOQAB-OALUTQOASA-N 0 3 406.574 4.155 20 0 HIADHN C[C@H](C(=O)N1CCC[C@H]1c1cccs1)N1CCC(c2ncc3n2CCCC3)CC1 ZINC000434689000 860461828 /nfs/dbraw/zinc/46/18/28/860461828.db2.gz RUNZOBWRYFAXQN-XLIONFOSSA-N 0 3 412.603 4.213 20 0 HIADHN C[C@@H](C1CC1)N(Cc1ccccc1)C(=O)CN1CCC(c2ncc3n2CCCC3)CC1 ZINC000434736915 860476515 /nfs/dbraw/zinc/47/65/15/860476515.db2.gz NOWMJYCGQRZZJJ-FQEVSTJZSA-N 0 3 420.601 4.226 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)c2ccc(-c3nc4ccccc4s3)o2)C[C@H](C)O1 ZINC000434761875 860485590 /nfs/dbraw/zinc/48/55/90/860485590.db2.gz CNWUJYCJHMIZDW-IYBDPMFKSA-N 0 3 413.543 4.176 20 0 HIADHN CCc1ccc([C@H](CNC(=O)c2ccc(NC(=O)N(C)C)cc2Cl)N(C)C)cc1 ZINC000435034187 860608621 /nfs/dbraw/zinc/60/86/21/860608621.db2.gz METMKVIVGCZBFL-FQEVSTJZSA-N 0 3 416.953 4.029 20 0 HIADHN Cc1ccn(C2CCN(Cc3cn(Cc4ccccc4)nc3-c3cccnc3)CC2)n1 ZINC000435050329 860615332 /nfs/dbraw/zinc/61/53/32/860615332.db2.gz RUXWXFYIUZPQIQ-UHFFFAOYSA-N 0 3 412.541 4.335 20 0 HIADHN C[C@@H](CN1CCOCC1)N(C)Cc1cn(C(C)(C)C)nc1-c1ccccc1Cl ZINC000435058405 860620245 /nfs/dbraw/zinc/62/02/45/860620245.db2.gz SRPPWHINAXBTFV-KRWDZBQOSA-N 0 3 404.986 4.111 20 0 HIADHN Cc1cc(C)n([C@H](C)CC(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435269408 860709695 /nfs/dbraw/zinc/70/96/95/860709695.db2.gz IHCPFTBHYATNLH-IFMALSPDSA-N 0 3 420.561 4.042 20 0 HIADHN COc1cc(CC(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)ccc1C ZINC000435275100 860713374 /nfs/dbraw/zinc/71/33/74/860713374.db2.gz OTXJEPQAXLMVSN-JOCHJYFZSA-N 0 3 418.541 4.137 20 0 HIADHN Cc1cc(NC(=O)c2c(F)cc(F)cc2F)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435278105 860714050 /nfs/dbraw/zinc/71/40/50/860714050.db2.gz FAQPXXBFFDFMBI-QGZVFWFLSA-N 0 3 414.431 4.308 20 0 HIADHN CCOc1c(F)cccc1C(=O)Nc1cc(C)nn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435289205 860721376 /nfs/dbraw/zinc/72/13/76/860721376.db2.gz GNTRQZHMGWIINS-IBGZPJMESA-N 0 3 422.504 4.429 20 0 HIADHN Cc1cc(NC(=O)COc2cc(C)ccc2F)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435293713 860723344 /nfs/dbraw/zinc/72/33/44/860723344.db2.gz CAMNOSYDFOJNEG-FQEVSTJZSA-N 0 3 422.504 4.104 20 0 HIADHN Cc1cc(NC(=O)c2ccn(C3CCCC3)n2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435295995 860725012 /nfs/dbraw/zinc/72/50/12/860725012.db2.gz QSMXSNPCUGARBR-NRFANRHFSA-N 0 3 418.545 4.202 20 0 HIADHN CCOc1cccc(C(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000435303400 860728261 /nfs/dbraw/zinc/72/82/61/860728261.db2.gz XNTYZVXVCPOBMB-NRFANRHFSA-N 0 3 404.514 4.290 20 0 HIADHN Cc1c(Cl)cccc1OCC(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435371635 860769254 /nfs/dbraw/zinc/76/92/54/860769254.db2.gz VXNMNYGHDBNFAC-LJQANCHMSA-N 0 3 424.932 4.309 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)[C@H]1CCCc2ccccc21 ZINC000435373834 860771551 /nfs/dbraw/zinc/77/15/51/860771551.db2.gz GDRFYMGMPJDENK-GGAORHGYSA-N 0 3 400.526 4.389 20 0 HIADHN C[C@H](CCOc1ccccc1)C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435374245 860773214 /nfs/dbraw/zinc/77/32/14/860773214.db2.gz PMROWZPYDRRUCK-IRLDBZIGSA-N 0 3 418.541 4.374 20 0 HIADHN COC(=O)[C@H]1CC[C@H](C(=O)N2CCN(Cc3ccccc3)C3(CCCCC3)C2)CC1 ZINC000435451942 860803420 /nfs/dbraw/zinc/80/34/20/860803420.db2.gz MAVRKXQEKYJSJQ-HZCBDIJESA-N 0 3 412.574 4.013 20 0 HIADHN Cc1cc(NC(=O)NCCc2ccccc2C)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435513055 860831342 /nfs/dbraw/zinc/83/13/42/860831342.db2.gz CAZYEWNXQDZFNQ-QHCPKHFHSA-N 0 3 417.557 4.311 20 0 HIADHN Cc1cnn(-c2ccc(C)cc2NC(=O)N(CCN(C)C)Cc2ccc(F)cc2)c1 ZINC000435514952 860832824 /nfs/dbraw/zinc/83/28/24/860832824.db2.gz DTRLGPRJVBNXFQ-UHFFFAOYSA-N 0 3 409.509 4.224 20 0 HIADHN Cc1cc(NC(=O)NCc2ccccc2F)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435516557 860833664 /nfs/dbraw/zinc/83/36/64/860833664.db2.gz MJRLCYBVEZGOSJ-FQEVSTJZSA-N 0 3 407.493 4.099 20 0 HIADHN Cc1cc(NC(=O)N(C)[C@H](C)c2ccco2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435518310 860835988 /nfs/dbraw/zinc/83/59/88/860835988.db2.gz IQVFEUSPLRHVSF-UYAOXDASSA-N 0 3 407.518 4.456 20 0 HIADHN Cc1cc(NC(=O)N[C@@H]2CCc3ccccc32)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435526829 860843924 /nfs/dbraw/zinc/84/39/24/860843924.db2.gz JRHYOKBOMFZNQL-JTHBVZDNSA-N 0 3 415.541 4.448 20 0 HIADHN Cc1cc(NC(=O)N(C)Cc2cnc(C)s2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435529115 860844500 /nfs/dbraw/zinc/84/45/00/860844500.db2.gz DZTRBIZLACTAKQ-IBGZPJMESA-N 0 3 424.574 4.067 20 0 HIADHN Cc1cc(NC(=O)NCc2sccc2C)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435529595 860845586 /nfs/dbraw/zinc/84/55/86/860845586.db2.gz GLEMATZYAPHDIV-LJQANCHMSA-N 0 3 409.559 4.330 20 0 HIADHN Cc1cc(CNCc2c(Cl)cccc2N2CCN(C)CC2)ccc1Br ZINC000467778324 881599204 /nfs/dbraw/zinc/59/92/04/881599204.db2.gz PNSTYAOGZYOHIL-UHFFFAOYSA-N 0 3 422.798 4.453 20 0 HIADHN Cc1cc(NC(=O)[C@H](C)Sc2ccccn2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435689547 860969852 /nfs/dbraw/zinc/96/98/52/860969852.db2.gz AZVHQVXAIKHAQZ-AZUAARDMSA-N 0 3 421.570 4.153 20 0 HIADHN Cc1cc(NC(=O)[C@@H](C)Sc2ccccn2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435689549 860971978 /nfs/dbraw/zinc/97/19/78/860971978.db2.gz AZVHQVXAIKHAQZ-QUCCMNQESA-N 0 3 421.570 4.153 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCCc3ccc(SC)cc3)c(C)c2)CC1 ZINC000435741810 861024010 /nfs/dbraw/zinc/02/40/10/861024010.db2.gz KSTHIKCQWQDMDC-UHFFFAOYSA-N 0 3 412.603 4.223 20 0 HIADHN O=C1N[C@]2(CCN(Cc3ccccc3)C2)C(=O)N1Cc1ccc(-c2ccsc2)cc1 ZINC000435797530 861067709 /nfs/dbraw/zinc/06/77/09/861067709.db2.gz DVLZDIICWIMJCD-DEOSSOPVSA-N 0 3 417.534 4.112 20 0 HIADHN CCCCc1oc2ccccc2c1CN1CC[C@H](N(Cc2noc(CC)n2)C(C)=O)C1 ZINC000435886878 861143770 /nfs/dbraw/zinc/14/37/70/861143770.db2.gz CMBMNWHQQKVQOL-SFHVURJKSA-N 0 3 424.545 4.344 20 0 HIADHN COc1ccccc1[C@@H](C)NC(=O)[C@H](C)N[C@@H](C)c1ccc(Br)cc1 ZINC000435886933 861144039 /nfs/dbraw/zinc/14/40/39/861144039.db2.gz DECZLVFSEXKFGA-ZNMIVQPWSA-N 0 3 405.336 4.374 20 0 HIADHN Cc1ccc([C@@H](NCCc2cccc(OC(F)(F)F)c2)[C@@H](C)S(C)(=O)=O)cc1 ZINC000435906739 861167843 /nfs/dbraw/zinc/16/78/43/861167843.db2.gz HVSZUJZYBXSNLH-BEFAXECRSA-N 0 3 415.477 4.200 20 0 HIADHN Cc1cc(NC(=O)c2ccc(OC(C)C)cn2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435911533 861172292 /nfs/dbraw/zinc/17/22/92/861172292.db2.gz NBOUIJBAJLTKBK-FQEVSTJZSA-N 0 3 419.529 4.073 20 0 HIADHN Cc1cc(-c2cc(C(=O)N[C@H]3CN(C4CC4)C[C@@H]3C)c3cnn(C(C)C)c3n2)c(C)o1 ZINC000467804567 881628364 /nfs/dbraw/zinc/62/83/64/881628364.db2.gz XYLTWIYVDSAJDA-FPTDNZKUSA-N 0 3 421.545 4.102 20 0 HIADHN COc1cc(C)ccc1Oc1ccc(NC(=O)N2CC[C@@H](N3CC=CC3)C2)cc1F ZINC000437832016 863184126 /nfs/dbraw/zinc/18/41/26/863184126.db2.gz FBLATXNGVNFLQQ-GOSISDBHSA-N 0 3 411.477 4.413 20 0 HIADHN CCc1ncsc1NC(=O)N(CCN(C)C)Cc1ccc(C(F)(F)F)cc1 ZINC000437862550 863222189 /nfs/dbraw/zinc/22/21/89/863222189.db2.gz NQRBIJGLHVRSEX-UHFFFAOYSA-N 0 3 400.470 4.320 20 0 HIADHN C[C@@H]1CCN(C(=O)Nc2cccc(C(=O)N3CCCC3)c2)CCN1Cc1ccccc1 ZINC000437922844 863299634 /nfs/dbraw/zinc/29/96/34/863299634.db2.gz OUPKLWZXIGUCTF-HXUWFJFHSA-N 0 3 420.557 4.051 20 0 HIADHN C[C@@H](CNC(=O)Nc1ccc(CCN2CCSCC2)cc1)Oc1ccccc1F ZINC000438095747 863501353 /nfs/dbraw/zinc/50/13/53/863501353.db2.gz HXCFOCMPFOMGSW-KRWDZBQOSA-N 0 3 417.550 4.006 20 0 HIADHN CC(C)c1nccn1CCC(=O)Nc1ccc(-c2nc(-c3ccccc3)n[nH]2)cc1 ZINC000438100293 863508928 /nfs/dbraw/zinc/50/89/28/863508928.db2.gz YZSQSGJKTHKSMK-UHFFFAOYSA-N 0 3 400.486 4.487 20 0 HIADHN C[C@H](NCc1cccc(OCCN2CCOCC2)c1)c1ccc(C(F)(F)F)cc1 ZINC000467843436 881686587 /nfs/dbraw/zinc/68/65/87/881686587.db2.gz ITSGQQYSUXWBOJ-KRWDZBQOSA-N 0 3 408.464 4.267 20 0 HIADHN O=C(Nc1ccc(OCC(F)(F)F)c(C(F)(F)F)c1)N1CC[C@@H](N2CC=CC2)C1 ZINC000438337107 863810912 /nfs/dbraw/zinc/81/09/12/863810912.db2.gz XAFATPNFJOEEIU-CYBMUJFWSA-N 0 3 423.357 4.125 20 0 HIADHN COc1cc(CN(C)CC2(CO)CC2)ccc1OCc1ccc(Br)cc1 ZINC000438338432 863812157 /nfs/dbraw/zinc/81/21/57/863812157.db2.gz KNVIMIHPIKDXOV-UHFFFAOYSA-N 0 3 420.347 4.241 20 0 HIADHN CCSCc1cccc(NC(=O)N2CCC(CN3C[C@H](C)O[C@@H](C)C3)CC2)c1 ZINC000438377219 863835925 /nfs/dbraw/zinc/83/59/25/863835925.db2.gz QJWMRRWBADAUKF-ROUUACIJSA-N 0 3 405.608 4.293 20 0 HIADHN CCSCc1cccc(NC(=O)NCc2ccc(CN3CCN(C)CC3)cc2)c1 ZINC000438403660 863850143 /nfs/dbraw/zinc/85/01/43/863850143.db2.gz VGBOJGDUAZNHAV-UHFFFAOYSA-N 0 3 412.603 4.009 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)N[C@H]1C[C@H](c2cccc(F)c2)C1 ZINC000438441880 863868609 /nfs/dbraw/zinc/86/86/09/863868609.db2.gz BDKQMBWBKFPPNA-UAPYVXQJSA-N 0 3 405.464 4.123 20 0 HIADHN COCc1c(C(=O)N(CCN(C)C)Cc2cccs2)sc2cccc(F)c21 ZINC000438466283 863888733 /nfs/dbraw/zinc/88/87/33/863888733.db2.gz PBFUEFMZEDKWQU-UHFFFAOYSA-N 0 3 406.548 4.452 20 0 HIADHN Cc1nc(COc2cccc(C(=O)N(CCN(C)C)Cc3cccs3)c2)cs1 ZINC000438476295 863893784 /nfs/dbraw/zinc/89/37/84/863893784.db2.gz OTKVQCPNAGJQFG-UHFFFAOYSA-N 0 3 415.584 4.296 20 0 HIADHN CCc1cnc(NC(=O)N(CCN(C)C)Cc2ccc(Br)cc2)s1 ZINC000438521823 863948819 /nfs/dbraw/zinc/94/88/19/863948819.db2.gz COGQVQIOPXSPFH-UHFFFAOYSA-N 0 3 411.369 4.064 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)NC[C@H]3CCC[C@H](C(F)(F)F)C3)cc2)CC1 ZINC000438531955 863957228 /nfs/dbraw/zinc/95/72/28/863957228.db2.gz JISDREWJRFUDTK-HKUYNNGSSA-N 0 3 411.512 4.316 20 0 HIADHN CC(C)C(=O)Nc1ccc(Cl)c(C(=O)N(CCN(C)C)Cc2cccs2)c1 ZINC000438534014 863959331 /nfs/dbraw/zinc/95/93/31/863959331.db2.gz UDGAXYUTMPDLBI-UHFFFAOYSA-N 0 3 407.967 4.200 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)NC[C@@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000438537885 863963575 /nfs/dbraw/zinc/96/35/75/863963575.db2.gz AGSUZNKVIAXRJR-RTBURBONSA-N 0 3 411.512 4.074 20 0 HIADHN COCCO[C@H]1CCN(Cc2cn(Cc3ccccc3)nc2-c2cccc(C)c2)C1 ZINC000438555573 863986367 /nfs/dbraw/zinc/98/63/67/863986367.db2.gz SZXWMDFZSIVPTO-DEOSSOPVSA-N 0 3 405.542 4.144 20 0 HIADHN Cc1ccc(C(=O)N(Cc2ccccc2)C2CCN(C)CC2)cc1Br ZINC000438556178 863988447 /nfs/dbraw/zinc/98/84/47/863988447.db2.gz GHDVQAHNEQJHCM-UHFFFAOYSA-N 0 3 401.348 4.494 20 0 HIADHN COC(=O)c1c(C)c(C)sc1NC(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000438577516 864008202 /nfs/dbraw/zinc/00/82/02/864008202.db2.gz SLZVTPVWYFQQJV-UHFFFAOYSA-N 0 3 415.559 4.280 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Nc1cccc(OCc2cscn2)c1 ZINC000438602994 864029675 /nfs/dbraw/zinc/02/96/75/864029675.db2.gz ZAJDLFFYQFACGY-UHFFFAOYSA-N 0 3 416.572 4.379 20 0 HIADHN C[C@@H](NCCC(=O)Nc1ccc(C(N)=O)c(Cl)c1)c1ccc(Cl)cc1Cl ZINC000438638950 864073272 /nfs/dbraw/zinc/07/32/72/864073272.db2.gz SYPMNILGPGWLTE-SNVBAGLBSA-N 0 3 414.720 4.425 20 0 HIADHN CCCOc1cccc(NC(=O)C(=O)N(CC)[C@@H]2CCN([C@H](C)c3ccccc3)C2)c1 ZINC000438646943 864086088 /nfs/dbraw/zinc/08/60/88/864086088.db2.gz FWRXBJAYEXUXTF-DENIHFKCSA-N 0 3 423.557 4.098 20 0 HIADHN O=C(Nc1c(F)cc(Br)cc1F)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000438649960 864088918 /nfs/dbraw/zinc/08/89/18/864088918.db2.gz WGVIFXUSQOCXHW-CQSZACIVSA-N 0 3 410.262 4.123 20 0 HIADHN C[C@@H](OC[C@@H](O)CN1CC=C(c2c[nH]c3ncccc23)CC1)c1ccc(Cl)cc1 ZINC000438651316 864092492 /nfs/dbraw/zinc/09/24/92/864092492.db2.gz MKNASJUPYJKAOT-UZLBHIALSA-N 0 3 411.933 4.444 20 0 HIADHN CCN(C(=O)C(=O)Nc1cccc(Cl)c1F)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000438663308 864113107 /nfs/dbraw/zinc/11/31/07/864113107.db2.gz CZCFVFZYADMYEE-WBVHZDCISA-N 0 3 417.912 4.102 20 0 HIADHN CC[C@@H](C)NC(=O)c1ccc(NC(=O)N(CCN(C)C)Cc2cccs2)c(C)c1 ZINC000438696754 864165688 /nfs/dbraw/zinc/16/56/88/864165688.db2.gz VTIHYQNFPKFZLG-QGZVFWFLSA-N 0 3 416.591 4.181 20 0 HIADHN Cc1ccsc1[C@H]1C[C@H]1C(=O)NC1CCN(CCOc2ccc(Cl)cc2)CC1 ZINC000438841800 864335223 /nfs/dbraw/zinc/33/52/23/864335223.db2.gz MNVBCFCYCGFQHX-VQTJNVASSA-N 0 3 418.990 4.473 20 0 HIADHN COc1cc(NC(C)=O)ccc1[C@H](C)N[C@@H]1CCN(c2ccccc2OC(F)F)C1 ZINC000438987663 864448599 /nfs/dbraw/zinc/44/85/99/864448599.db2.gz PTPRDGPVBPKIIW-WMLDXEAASA-N 0 3 419.472 4.185 20 0 HIADHN O[C@@H]1CCCC[C@@H]1[C@@H]1CCCCN1Cc1nc(-c2cccc(Br)c2)no1 ZINC000439012297 864463824 /nfs/dbraw/zinc/46/38/24/864463824.db2.gz XJNICRJVWGKWMO-FGTMMUONSA-N 0 3 420.351 4.405 20 0 HIADHN O[C@@H]1CCCC[C@H]1[C@H]1CCCCN1Cc1csc(-c2ccc3c(c2)OCO3)n1 ZINC000439015695 864466224 /nfs/dbraw/zinc/46/62/24/864466224.db2.gz SZSYRWUPLQOFNP-IPMKNSEASA-N 0 3 400.544 4.444 20 0 HIADHN Cc1cc(Br)ccc1NC(=O)CN1CCCC[C@@H]1[C@@H]1C[C@@H](C)CC[C@H]1O ZINC000439014794 864466617 /nfs/dbraw/zinc/46/66/17/864466617.db2.gz KITWZNURCUQHSB-GIPAHHNCSA-N 0 3 423.395 4.348 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)c1cc2cc(Br)ccc2[nH]1 ZINC000439029766 864485442 /nfs/dbraw/zinc/48/54/42/864485442.db2.gz RMVXRQQJDBMHJP-UHFFFAOYSA-N 0 3 406.349 4.196 20 0 HIADHN Cc1cc(C)c(-c2cc(NC(=O)c3oc4ccccc4c3CN(C)C)n[nH]2)cc1C ZINC000439124578 864560319 /nfs/dbraw/zinc/56/03/19/864560319.db2.gz QIPGHVGHAUCBKP-UHFFFAOYSA-N 0 3 402.498 5.062 20 0 HIADHN CS(=O)(=O)Nc1cccc(CN[C@@H](c2ccc(Br)s2)C2CC2)c1 ZINC000439141355 864574189 /nfs/dbraw/zinc/57/41/89/864574189.db2.gz RTZHPYFXJXEVIY-MRXNPFEDSA-N 0 3 415.378 4.123 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)N[C@H]1COc2c1ccc(Cl)c2Cl ZINC000439327876 864765402 /nfs/dbraw/zinc/76/54/02/864765402.db2.gz WCRJUKBFAVNYET-HNNXBMFYSA-N 0 3 414.358 4.262 20 0 HIADHN CC(C)[C@@H](NC(=O)C(=O)Nc1cccc(CN(C)C)c1)c1ccc(C(F)(F)F)cc1 ZINC000439423368 864826892 /nfs/dbraw/zinc/82/68/92/864826892.db2.gz MTTYLGXNEYGZRK-LJQANCHMSA-N 0 3 421.463 4.219 20 0 HIADHN CC(C)[C@H](NC(=O)C(=O)Nc1cccc(CN(C)C)c1)c1ccc(C(F)(F)F)cc1 ZINC000439423367 864827275 /nfs/dbraw/zinc/82/72/75/864827275.db2.gz MTTYLGXNEYGZRK-IBGZPJMESA-N 0 3 421.463 4.219 20 0 HIADHN CN(C)[C@H](CNCc1cc(Cl)ccc1OC[C@H]1CCCO1)c1ccc(F)cc1 ZINC000439478423 864845578 /nfs/dbraw/zinc/84/55/78/864845578.db2.gz MRNMWWFEAVHKSE-NHCUHLMSSA-N 0 3 406.929 4.429 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(C(F)(F)F)cc1)C(=O)N1CCN(c2ccc(F)cc2)CC1 ZINC000439549755 864876709 /nfs/dbraw/zinc/87/67/09/864876709.db2.gz ODXKDOODIQHFPX-HZPDHXFCSA-N 0 3 423.454 4.232 20 0 HIADHN COc1ccc(C2(CN[C@@H](C)c3nnnn3-c3ccccc3)CCCCC2)cc1OC ZINC000439584546 864907070 /nfs/dbraw/zinc/90/70/70/864907070.db2.gz WSAQJEDRNMEFAC-SFHVURJKSA-N 0 3 421.545 4.232 20 0 HIADHN CC(=O)c1cccc(NC(=O)[C@@H](C)NCc2ccccc2CN(C)Cc2ccco2)c1 ZINC000439597795 864920082 /nfs/dbraw/zinc/92/00/82/864920082.db2.gz PGNXWZKVXMMSGP-GOSISDBHSA-N 0 3 419.525 4.231 20 0 HIADHN CN(C)C(=O)c1cccc(CCN[C@@H](C(=O)Nc2ccc(F)cc2)c2ccccc2)c1 ZINC000439607904 864930328 /nfs/dbraw/zinc/93/03/28/864930328.db2.gz RQFHRYFWJQRWIS-HSZRJFAPSA-N 0 3 419.500 4.040 20 0 HIADHN CC(C)N(CCN(C)C)C(=O)Cc1ccc(NC(=O)c2cc3ccccc3o2)cc1 ZINC000439611269 864934881 /nfs/dbraw/zinc/93/48/81/864934881.db2.gz DVZJHKWLJJCKRY-UHFFFAOYSA-N 0 3 407.514 4.026 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)NC[C@@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000439631104 864957070 /nfs/dbraw/zinc/95/70/70/864957070.db2.gz DGRQSOFPUBNFBA-GDBMZVCRSA-N 0 3 421.454 4.407 20 0 HIADHN COc1ccc(OC)c(NC(=O)[C@@H](C)NCC(C)(C)c2c(F)cccc2Cl)c1 ZINC000439647807 864974051 /nfs/dbraw/zinc/97/40/51/864974051.db2.gz OERBYJDXRMXKCL-CYBMUJFWSA-N 0 3 408.901 4.391 20 0 HIADHN Cc1ccc(C(=O)NCC2CC2)cc1NC(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000439683113 865019013 /nfs/dbraw/zinc/01/90/13/865019013.db2.gz GCPQKEJHDYOGRZ-PGRDOPGGSA-N 0 3 420.557 4.092 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N(Cc3ccccc3)C[C@@](C)(O)CC)c2)CC1 ZINC000439694982 865030962 /nfs/dbraw/zinc/03/09/62/865030962.db2.gz PJTBJMDPQJYLOJ-VWLOTQADSA-N 0 3 424.589 4.024 20 0 HIADHN CC[C@@](C)(O)CN(Cc1ccccc1)C(=O)N[C@H](CN1CCCC1)c1ccccc1 ZINC000439700173 865036942 /nfs/dbraw/zinc/03/69/42/865036942.db2.gz RAUGOHNJHCCVGI-ILBGXUMGSA-N 0 3 409.574 4.196 20 0 HIADHN Cc1ccc(C(=O)NCC2CC2)cc1NC(=O)N[C@H](CN1CCCC1)c1ccccc1 ZINC000439708680 865045136 /nfs/dbraw/zinc/04/51/36/865045136.db2.gz ZTQAYVJZONZYRK-HSZRJFAPSA-N 0 3 420.557 4.093 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)CCCc2nc3ccccc3s2)CC1 ZINC000439731334 865064952 /nfs/dbraw/zinc/06/49/52/865064952.db2.gz NDSRZNJVSRBCIU-QGZVFWFLSA-N 0 3 408.571 4.356 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)[C@@H]2C[C@@H]2c2c(F)cccc2Cl)CC1 ZINC000439749388 865079324 /nfs/dbraw/zinc/07/93/24/865079324.db2.gz YKIHRWQQSOKHIW-FHLIZLRMSA-N 0 3 401.913 4.319 20 0 HIADHN C[C@H](Oc1cccc(Cl)c1Cl)C(=O)NC1CCN([C@@H](C)c2ccncc2)CC1 ZINC000439762779 865088135 /nfs/dbraw/zinc/08/81/35/865088135.db2.gz CLNQIJKBSFUQKL-GJZGRUSLSA-N 0 3 422.356 4.498 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)C[C@@H](c2ccccc2)C(F)(F)F)CC1 ZINC000439763318 865088530 /nfs/dbraw/zinc/08/85/30/865088530.db2.gz HSKZUBOFGDFWMO-JXFKEZNVSA-N 0 3 405.464 4.459 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)CCCc2ncc(-c3ccccc3)o2)CC1 ZINC000439772001 865097264 /nfs/dbraw/zinc/09/72/64/865097264.db2.gz FMOQVZYAFCQLAH-LJQANCHMSA-N 0 3 418.541 4.401 20 0 HIADHN COc1ccc(CCC(=O)NC2CCN([C@H](C)c3ccncc3)CC2)cc1Cl ZINC000439772804 865097806 /nfs/dbraw/zinc/09/78/06/865097806.db2.gz HFULXKMHOAESQM-MRXNPFEDSA-N 0 3 401.938 4.018 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)C(=O)Nc1ccccc1NC(C)(C)C ZINC000439844560 865155731 /nfs/dbraw/zinc/15/57/31/865155731.db2.gz VQXYGTQFQBKTPK-JOCHJYFZSA-N 0 3 424.589 4.108 20 0 HIADHN O=C(Nc1cc(Cl)c(Cl)cn1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000467998540 881841780 /nfs/dbraw/zinc/84/17/80/881841780.db2.gz PGTAKDUNVJBFRW-UHFFFAOYSA-N 0 3 411.255 4.315 20 0 HIADHN CCn1ncc(NC(=O)N[C@H](CN(C)Cc2ccccc2)C(C)C)c1C(F)(F)F ZINC000439936917 865237357 /nfs/dbraw/zinc/23/73/57/865237357.db2.gz XTJWOCVDSSVNSZ-QGZVFWFLSA-N 0 3 411.472 4.200 20 0 HIADHN CC[C@H](C)NC(=O)[C@@H]1C[C@H](C)N(Cc2ccsc2C(=O)OC)[C@@H]2CCCC[C@H]12 ZINC000439981964 865281877 /nfs/dbraw/zinc/28/18/77/865281877.db2.gz IURQXRGKZJBIOS-BHEBFOIGSA-N 0 3 406.592 4.219 20 0 HIADHN CC(C)=CCN(Cc1ccc(Cl)cc1)C(=O)C(=O)Nc1cccc(CN(C)C)c1 ZINC000440121151 865369452 /nfs/dbraw/zinc/36/94/52/865369452.db2.gz UVJMUKLGZLUVMC-UHFFFAOYSA-N 0 3 413.949 4.335 20 0 HIADHN Fc1ccc2c(c1)[C@@H](NC1CCN(Cc3ccccc3Br)CC1)CO2 ZINC000468036379 881866348 /nfs/dbraw/zinc/86/63/48/881866348.db2.gz DKSNPXCNAKBJSC-IBGZPJMESA-N 0 3 405.311 4.276 20 0 HIADHN NC(=O)C1CCN(C[C@H](N[C@@H]2CCCc3sccc32)c2ccc(Cl)cc2)CC1 ZINC000468038424 881868731 /nfs/dbraw/zinc/86/87/31/881868731.db2.gz NJTYPGRWMSXXTH-UXHICEINSA-N 0 3 418.006 4.307 20 0 HIADHN COc1cc(CNC(=O)N(CCN(C)C)C2CCCC2)ccc1OC1CCCC1 ZINC000468039321 881869194 /nfs/dbraw/zinc/86/91/94/881869194.db2.gz CNKZOLMWJRSVIF-UHFFFAOYSA-N 0 3 403.567 4.032 20 0 HIADHN COc1cccc([C@@H](NC(=O)N(CCN(C)C)C(C)C)c2ccccc2Cl)c1 ZINC000440241557 865480585 /nfs/dbraw/zinc/48/05/85/865480585.db2.gz GFVJXVDRKYAGMC-OAQYLSRUSA-N 0 3 403.954 4.420 20 0 HIADHN CC(C)n1cnnc1-c1ccccc1NC(=O)N(CCN(C)C)Cc1ccccc1 ZINC000440297976 865555190 /nfs/dbraw/zinc/55/51/90/865555190.db2.gz SNCULNNOPQTLNB-UHFFFAOYSA-N 0 3 406.534 4.122 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)c2ccccc2NCc2cccnc2)CC1 ZINC000440307609 865569149 /nfs/dbraw/zinc/56/91/49/865569149.db2.gz VQGCZDQUJRDSLI-IBGZPJMESA-N 0 3 415.541 4.044 20 0 HIADHN COc1ccccc1[C@H](C)NC(=O)[C@@H](C)N1CCN(C2CCC(C(C)C)CC2)CC1 ZINC000440310481 865577343 /nfs/dbraw/zinc/57/73/43/865577343.db2.gz AFILITLIILLQFV-QINBWVTOSA-N 0 3 415.622 4.093 20 0 HIADHN O=C(CC1(N2CCOCC2)CCCC1)N1CCC[C@@H]1c1ccc(Br)cc1 ZINC000468067246 881884757 /nfs/dbraw/zinc/88/47/57/881884757.db2.gz CKVNOYJZFSOOLM-LJQANCHMSA-N 0 3 421.379 4.148 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N[C@@H](CC(F)(F)F)c3ccccc3)cc2)CC1 ZINC000468079386 881891026 /nfs/dbraw/zinc/89/10/26/881891026.db2.gz MTTLXHPGSFWYFB-FQEVSTJZSA-N 0 3 405.464 4.252 20 0 HIADHN CN1CCC(Oc2ccc(NC(=O)C3(c4ccc(C(F)(F)F)cc4)CC3)cn2)CC1 ZINC000440410026 865705909 /nfs/dbraw/zinc/70/59/09/865705909.db2.gz WCYRADDESMDXPT-UHFFFAOYSA-N 0 3 419.447 4.244 20 0 HIADHN C[C@H](C(=O)N1[C@@H](C)CCC[C@@H]1C)N1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1 ZINC000440468940 865772469 /nfs/dbraw/zinc/77/24/69/865772469.db2.gz YFOQTHSXOPISOO-HRCADAONSA-N 0 3 423.960 4.308 20 0 HIADHN CC(C)=CCSc1ccccc1C(=O)NC[C@]1(O)CCN(Cc2ccccc2)C1 ZINC000440506539 865799604 /nfs/dbraw/zinc/79/96/04/865799604.db2.gz QLRXSMYLZSPUCS-XMMPIXPASA-N 0 3 410.583 4.112 20 0 HIADHN CCN(C[C@@H]1CCN(Cc2ccccc2)C1)C(=O)c1[nH]c2c(c1C)C(=O)CC(C)(C)C2 ZINC000440543787 865812039 /nfs/dbraw/zinc/81/20/39/865812039.db2.gz OOELDNWVHTXXLP-HXUWFJFHSA-N 0 3 421.585 4.462 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)C(C)(C)Cc3cccc(Cl)c3)CC2)C[C@H](C)O1 ZINC000440589899 865827398 /nfs/dbraw/zinc/82/73/98/865827398.db2.gz VUPUCYQSFQDFNZ-HDICACEKSA-N 0 3 406.998 4.257 20 0 HIADHN CCc1nnc(-c2cccc(NC(=O)[C@H]3CCCN(Cc4cccc(F)c4)C3)c2)o1 ZINC000440603487 865833325 /nfs/dbraw/zinc/83/33/25/865833325.db2.gz ZANCIZCBJCUWJA-SFHVURJKSA-N 0 3 408.477 4.289 20 0 HIADHN CCc1nnc(-c2cccc(NC(=O)[C@@H]3CCCN(Cc4cccc(F)c4)C3)c2)o1 ZINC000440603484 865833427 /nfs/dbraw/zinc/83/34/27/865833427.db2.gz ZANCIZCBJCUWJA-GOSISDBHSA-N 0 3 408.477 4.289 20 0 HIADHN C[C@@H](N[C@@H]1CC(C)(C)CCc2ccccc21)C(=O)Nc1ccccc1S(C)(=O)=O ZINC000440610519 865837073 /nfs/dbraw/zinc/83/70/73/865837073.db2.gz HFQRBOJWNOXQAH-OXQOHEQNSA-N 0 3 414.571 4.111 20 0 HIADHN O=C(CNC1(c2ccccc2)CCCCC1)N1CCC(C(=O)Nc2ccccc2)CC1 ZINC000440914431 866011052 /nfs/dbraw/zinc/01/10/52/866011052.db2.gz NBJSFMVENLZEDI-UHFFFAOYSA-N 0 3 419.569 4.313 20 0 HIADHN C[C@@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)NCCN1CCN(C)C(C)(C)C1 ZINC000440975243 866059462 /nfs/dbraw/zinc/05/94/62/866059462.db2.gz FOSRGKDATAZSFA-FQEVSTJZSA-N 0 3 408.590 4.082 20 0 HIADHN CC(C)OC(=O)c1ccc(CN2CCC(c3nc(-c4ccccn4)no3)CC2)cc1 ZINC000441142052 866234808 /nfs/dbraw/zinc/23/48/08/866234808.db2.gz FKBCADVZODJQPN-UHFFFAOYSA-N 0 3 406.486 4.076 20 0 HIADHN COCc1nc(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)c(-c2ccccc2)s1 ZINC000441278172 866352564 /nfs/dbraw/zinc/35/25/64/866352564.db2.gz MQGYMJUCAFTNDH-FXAWDEMLSA-N 0 3 421.566 4.207 20 0 HIADHN CN(C(=O)CN1CCC[C@H]([C@@H]2CCOC2)C1)[C@@H](c1ccccc1)c1ccc(F)cc1 ZINC000441292600 866365942 /nfs/dbraw/zinc/36/59/42/866365942.db2.gz JWLDRGUDCXHVNY-FBLLAGFSSA-N 0 3 410.533 4.122 20 0 HIADHN COc1cc2c(cc1OC)CN(C(=O)CN(C)[C@H]1CCC[C@@H]1c1ccc(C)cc1)CC2 ZINC000441352045 866421996 /nfs/dbraw/zinc/42/19/96/866421996.db2.gz JUKISXPFSAMNTG-PKTZIBPZSA-N 0 3 422.569 4.165 20 0 HIADHN COC(=O)c1ccc(OCCN2CC[C@H](COCc3ccccc3)C2)c(Cl)c1 ZINC000441376634 866444283 /nfs/dbraw/zinc/44/42/83/866444283.db2.gz KUDGOUQDAKGCFH-SFHVURJKSA-N 0 3 403.906 4.044 20 0 HIADHN C[C@@H](C(=O)N(C)Cc1c(F)cccc1Cl)N1CC[C@H](COCc2ccccc2)C1 ZINC000441383695 866456307 /nfs/dbraw/zinc/45/63/07/866456307.db2.gz WSKPEUGPETYTQX-HKUYNNGSSA-N 0 3 418.940 4.365 20 0 HIADHN COc1ccc(CN(C(=O)CN2CCC[C@@H]2c2cccc(N(C)C)c2)C2CC2)cc1 ZINC000441434166 866511979 /nfs/dbraw/zinc/51/19/79/866511979.db2.gz KGZYOIFSDHYAMF-XMMPIXPASA-N 0 3 407.558 4.089 20 0 HIADHN CS(=O)(=O)c1ccc(OCCN(CCc2ccccc2F)C2CCCC2)cc1 ZINC000441553292 866629400 /nfs/dbraw/zinc/62/94/00/866629400.db2.gz SYGIEENWQZENRK-UHFFFAOYSA-N 0 3 405.535 4.095 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)C(=O)Nc1ccc(OC(C)(C)C)cc1)c1ccccc1 ZINC000441597132 866689058 /nfs/dbraw/zinc/68/90/58/866689058.db2.gz JLVFGVNWLPHSJP-NRFANRHFSA-N 0 3 411.546 4.002 20 0 HIADHN COc1ccc2cc(CN(C)C(=O)CCN3CCN(c4ccccc4)CC3)ccc2c1 ZINC000468148328 882009345 /nfs/dbraw/zinc/00/93/45/882009345.db2.gz ZOWKWKALAMDDNU-UHFFFAOYSA-N 0 3 417.553 4.019 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)N[C@H]3CCCc4sc(-c5ccc(F)cc5)nc43)[C@@H]2C1 ZINC000468166642 882041636 /nfs/dbraw/zinc/04/16/36/882041636.db2.gz ZLLLHAVODGXPEK-FHLIZLRMSA-N 0 3 414.550 4.062 20 0 HIADHN CCOC(=O)CC1CCN(Cc2ccnc(-c3ccc(Br)cc3)n2)CC1 ZINC000442004534 867058297 /nfs/dbraw/zinc/05/82/97/867058297.db2.gz SKJMXHJGNNPLLK-UHFFFAOYSA-N 0 3 418.335 4.071 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N1CCCC[C@H]1c1ccc(F)cc1F ZINC000442313018 867320709 /nfs/dbraw/zinc/32/07/09/867320709.db2.gz YBXNPBRHPLVDME-NRFANRHFSA-N 0 3 415.484 4.027 20 0 HIADHN Cc1ccc(C)c(Sc2ccc(NC(=O)C(=O)N[C@@H](C)C3=CCN(C)CC3)cc2)c1 ZINC000442340742 867335079 /nfs/dbraw/zinc/33/50/79/867335079.db2.gz LQZWQWZPRJOWFM-SFHVURJKSA-N 0 3 423.582 4.160 20 0 HIADHN CCCc1ccc(-c2ccc(NC(=O)C(=O)N[C@H](C)C3=CCN(C)CC3)cc2)cc1 ZINC000442341585 867336510 /nfs/dbraw/zinc/33/65/10/867336510.db2.gz LCVMAJNOVQFDHV-GOSISDBHSA-N 0 3 405.542 4.011 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N[C@H](C)C1(c2ccccc2)CCCC1 ZINC000442545902 867521092 /nfs/dbraw/zinc/52/10/92/867521092.db2.gz WAZGEIZZWBXYQN-LJQANCHMSA-N 0 3 407.558 4.012 20 0 HIADHN CC(C)c1ccc([C@@H]2CCCCN2C(=O)NCCN2CCN(C)C(C)(C)C2)cc1 ZINC000442611435 867557457 /nfs/dbraw/zinc/55/74/57/867557457.db2.gz SSIGWDQEEVEBIN-QFIPXVFZSA-N 0 3 400.611 4.073 20 0 HIADHN Cc1ncsc1CN(C)C[C@H]1CCN(C(=O)c2ccncc2Oc2ccccc2)C1 ZINC000442768055 867669070 /nfs/dbraw/zinc/66/90/70/867669070.db2.gz JVRHGSHXGKWWJF-GOSISDBHSA-N 0 3 422.554 4.233 20 0 HIADHN Cc1cccc(C)c1-n1nnnc1CNC(C)(C)Cc1ccc(C(F)(F)F)cc1 ZINC000442780436 867672541 /nfs/dbraw/zinc/67/25/41/867672541.db2.gz GEXDRYWZYUWBRM-UHFFFAOYSA-N 0 3 403.452 4.409 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](N[C@H]2Cc3[nH]c4ccccc4c3C2)c2ccccc2)c1 ZINC000442789497 867676137 /nfs/dbraw/zinc/67/61/37/867676137.db2.gz HIEXPCGNFQXPIG-CLOONOSVSA-N 0 3 416.546 4.418 20 0 HIADHN C[C@@H]1CN(C2CCOCC2)CCN1C(=O)c1[nH]ccc1-c1c(Cl)cccc1Cl ZINC000442797368 867679257 /nfs/dbraw/zinc/67/92/57/867679257.db2.gz HPJIFOHLFDDVHT-CQSZACIVSA-N 0 3 422.356 4.314 20 0 HIADHN C[S@@](=O)C1(CN[C@@H](Cc2ccccc2F)c2ccccc2Br)CC1 ZINC000442826694 867690131 /nfs/dbraw/zinc/69/01/31/867690131.db2.gz XQQRDIDGQIRYAY-MHECFPHRSA-N 0 3 410.352 4.373 20 0 HIADHN COC(=O)COc1ccc(NC(=O)c2cccc(CN3CCCC3)c2)c2ccccc12 ZINC000468223665 882111995 /nfs/dbraw/zinc/11/19/95/882111995.db2.gz GJCUOQZEOUZRFL-UHFFFAOYSA-N 0 3 418.493 4.240 20 0 HIADHN CN(CCc1ccccn1)Cc1cccc(Br)c1OC[C@@H]1CCCO1 ZINC000442883252 867714579 /nfs/dbraw/zinc/71/45/79/867714579.db2.gz GZAUOXJFLYSUIY-SFHVURJKSA-N 0 3 405.336 4.076 20 0 HIADHN C[C@@H](c1nc(-c2ccc(N(C)C(=O)c3ccncc3)cc2)no1)N1[C@H](C)CC[C@H]1C ZINC000443202237 867873529 /nfs/dbraw/zinc/87/35/29/867873529.db2.gz JGMNDRXUNRGZPD-ZACQAIPSSA-N 0 3 405.502 4.342 20 0 HIADHN O[C@H](COCc1cccs1)CN1CCN(C2c3ccccc3-c3ccccc32)CC1 ZINC000443405746 867985689 /nfs/dbraw/zinc/98/56/89/867985689.db2.gz KVXNUNWSGSYQSN-IBGZPJMESA-N 0 3 420.578 4.013 20 0 HIADHN COc1ccc(C(=O)C2CCN(C[C@@H](O)Cc3ccccc3C(F)(F)F)CC2)cc1 ZINC000443467592 868055602 /nfs/dbraw/zinc/05/56/02/868055602.db2.gz SZMUYQIAXKVCSG-IBGZPJMESA-N 0 3 421.459 4.212 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)Nc3ccc(OCC(F)(F)F)cc3)CC2)c1 ZINC000468247183 882153220 /nfs/dbraw/zinc/15/32/20/882153220.db2.gz NXIREHKFXNFNHT-UHFFFAOYSA-N 0 3 421.463 4.087 20 0 HIADHN Cc1cc(CN2CCC[C@@H](CNC(=O)C(C)C)C2)nc(-c2ccc(Cl)cc2)n1 ZINC000443619672 868186726 /nfs/dbraw/zinc/18/67/26/868186726.db2.gz BWIUNJUKXGSYIS-KRWDZBQOSA-N 0 3 400.954 4.090 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N(CCCO)[C@H]1CCc2ccccc21)c1ccsc1 ZINC000443630772 868205754 /nfs/dbraw/zinc/20/57/54/868205754.db2.gz VTEZLMWPBFQUKM-FCHUYYIVSA-N 0 3 415.603 4.213 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N(CCCO)[C@H]1CCc2ccccc21)c1ccsc1 ZINC000443630774 868206882 /nfs/dbraw/zinc/20/68/82/868206882.db2.gz VTEZLMWPBFQUKM-VXKWHMMOSA-N 0 3 415.603 4.213 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)CSc2cc(Cl)ccc2Cl)C[C@@H](C)O1 ZINC000443656676 868255272 /nfs/dbraw/zinc/25/52/72/868255272.db2.gz RFPYPDWQBBVXSJ-ZIAGYGMSSA-N 0 3 405.391 4.091 20 0 HIADHN C[C@H]1CN(CCCCNC(=O)CSc2cc(Cl)ccc2Cl)C[C@H](C)O1 ZINC000443656673 868257147 /nfs/dbraw/zinc/25/71/47/868257147.db2.gz RFPYPDWQBBVXSJ-KBPBESRZSA-N 0 3 405.391 4.091 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)c2csc(-c3ccccc3Cl)n2)C[C@@H](C)O1 ZINC000443671789 868279609 /nfs/dbraw/zinc/27/96/09/868279609.db2.gz DLSSDXADGKCKBK-HUUCEWRRSA-N 0 3 407.967 4.083 20 0 HIADHN C[C@@H](NC(=O)N(CCN(C)C)Cc1ccccc1)c1ccc(Br)s1 ZINC000443733316 868313385 /nfs/dbraw/zinc/31/33/85/868313385.db2.gz LTWIXBSUMHYTQN-CQSZACIVSA-N 0 3 410.381 4.345 20 0 HIADHN Cc1ccccc1[C@H]([C@@H](C)NC(=O)C(=O)Nc1cccc(C(F)(F)F)c1C)N(C)C ZINC000443843052 868374064 /nfs/dbraw/zinc/37/40/64/868374064.db2.gz RDTAZEIMCRRNSQ-BEFAXECRSA-N 0 3 421.463 4.068 20 0 HIADHN Cc1cc(Cl)c(NC(=O)N[C@H]2CCN(Cc3ccccc3)C[C@H]2CO)cc1Cl ZINC000443942502 868478781 /nfs/dbraw/zinc/47/87/81/868478781.db2.gz QLDCJHDDQYVWCR-LPHOPBHVSA-N 0 3 422.356 4.306 20 0 HIADHN COc1cccc(N2CC[C@H](NCc3ccc(OC)cc3OCc3cccnc3)C2)c1 ZINC000443968677 868499300 /nfs/dbraw/zinc/49/93/00/868499300.db2.gz OCAYXXOSJKBTOT-NRFANRHFSA-N 0 3 419.525 4.046 20 0 HIADHN COc1ccc(CNCc2cccc(-n3ccnc3)c2)c(OCc2cccnc2)c1 ZINC000443980927 868507851 /nfs/dbraw/zinc/50/78/51/868507851.db2.gz ODJYKRGOJGWAOC-UHFFFAOYSA-N 0 3 400.482 4.145 20 0 HIADHN C[C@H](NC(=O)N(CCN(C)C)Cc1ccccc1)c1ccc(Br)s1 ZINC000444096837 868614280 /nfs/dbraw/zinc/61/42/80/868614280.db2.gz LTWIXBSUMHYTQN-AWEZNQCLSA-N 0 3 410.381 4.345 20 0 HIADHN CCOc1ccc([C@H]2CCCN2C(=O)CN(C[C@@H]2CCCO2)C2CCCC2)cc1 ZINC000444209783 868668555 /nfs/dbraw/zinc/66/85/55/868668555.db2.gz DOBGAAQNCPIGMO-XZOQPEGZSA-N 0 3 400.563 4.172 20 0 HIADHN CCCN(CC(=O)Nc1ccc2c(c1)OC1(CCCC1)O2)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000444227296 868676479 /nfs/dbraw/zinc/67/64/79/868676479.db2.gz UOILLGSKSSIOKF-YHYVQYDKSA-N 0 3 414.546 4.192 20 0 HIADHN CCCN(CC(=O)N(CC)c1nc2ccccc2s1)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000444231925 868680321 /nfs/dbraw/zinc/68/03/21/868680321.db2.gz LACQKQPJNRBXCV-YSGRDPCXSA-N 0 3 401.576 4.175 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(F)cc2)CC1)C1CCC(C(F)(F)F)CC1 ZINC000444240434 868688927 /nfs/dbraw/zinc/68/89/27/868688927.db2.gz DISMCNUQIQNTMV-UHFFFAOYSA-N 0 3 416.459 4.154 20 0 HIADHN Cc1ccc([C@H]2CCC[C@H]2N(C)CC(=O)Nc2cccc(C(=O)NC3CC3)c2)cc1 ZINC000444240901 868689551 /nfs/dbraw/zinc/68/95/51/868689551.db2.gz MRHCDYLJVCYKSZ-DHIUTWEWSA-N 0 3 405.542 4.094 20 0 HIADHN CCN1CCC[C@@H](CN(C)C(=O)C2CCC(C(F)(F)F)CC2)[C@@H]1c1cnn(C)c1 ZINC000444381529 868801567 /nfs/dbraw/zinc/80/15/67/868801567.db2.gz LPEGONQUNYCBJW-DHRZBBNESA-N 0 3 414.516 4.020 20 0 HIADHN COc1ccc(CN(C(=O)c2cccc(CN(C)C)c2)c2nccs2)c(OC)c1 ZINC000444443722 868830204 /nfs/dbraw/zinc/83/02/04/868830204.db2.gz NQBVQLZGWPBZFS-UHFFFAOYSA-N 0 3 411.527 4.069 20 0 HIADHN CC(C)c1noc(-c2ccccc2C(=O)Nc2cccc(CN3CCC(O)CC3)c2)n1 ZINC000444448618 868831898 /nfs/dbraw/zinc/83/18/98/868831898.db2.gz COLBKNUZRFMIRF-UHFFFAOYSA-N 0 3 420.513 4.069 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)c1cc(-c2ccccc2Cl)on1 ZINC000444460964 868836907 /nfs/dbraw/zinc/83/69/07/868836907.db2.gz MVURSSWDUKKQLA-UHFFFAOYSA-N 0 3 411.889 4.204 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1ccc(F)c(C(F)(F)F)c1 ZINC000444540623 868875173 /nfs/dbraw/zinc/87/51/73/868875173.db2.gz GHJJPWQDRXQFOR-UHFFFAOYSA-N 0 3 410.411 4.301 20 0 HIADHN O=C(Cc1cc(Cl)ccc1Cl)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000444543156 868875869 /nfs/dbraw/zinc/87/58/69/868875869.db2.gz IWSAMEPCTMMVLK-UHFFFAOYSA-N 0 3 407.341 4.379 20 0 HIADHN CC(C)(Oc1cccc(Cl)c1)C(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000444554234 868880631 /nfs/dbraw/zinc/88/06/31/868880631.db2.gz WUWQICRDTYXWFQ-UHFFFAOYSA-N 0 3 416.949 4.340 20 0 HIADHN CCOc1cc(N2CCOC(C)(C)C2)ccc1NC(=O)c1cccc(CN(C)C)c1 ZINC000444563336 868883849 /nfs/dbraw/zinc/88/38/49/868883849.db2.gz ZBFCYXJKMISJBW-UHFFFAOYSA-N 0 3 411.546 4.014 20 0 HIADHN CN(C(=O)NCc1cccc(-c2cccnc2)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000468313437 882240268 /nfs/dbraw/zinc/24/02/68/882240268.db2.gz URWITZXHJLFIBD-DEOSSOPVSA-N 0 3 400.526 4.165 20 0 HIADHN CC1(C)CCCN(CCNC(=O)c2cc(Br)ccc2Br)C1 ZINC000444619613 868911545 /nfs/dbraw/zinc/91/15/45/868911545.db2.gz YSHPZMCBHXJONI-UHFFFAOYSA-N 0 3 418.173 4.063 20 0 HIADHN CO[C@H](C)c1noc(CN2CCCN(Cc3ccc(-c4cccs4)cc3)CC2)n1 ZINC000444650387 868931359 /nfs/dbraw/zinc/93/13/59/868931359.db2.gz SMXJWWCNDSJTMS-QGZVFWFLSA-N 0 3 412.559 4.213 20 0 HIADHN COCCN1CCC(NC(=O)N([C@@H](C)c2cccc(C(F)(F)F)c2)C2CC2)CC1 ZINC000444694751 868961126 /nfs/dbraw/zinc/96/11/26/868961126.db2.gz DBUIUUUAKSPDHI-HNNXBMFYSA-N 0 3 413.484 4.051 20 0 HIADHN COc1cc(NC(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)ccc1F ZINC000444991656 869148213 /nfs/dbraw/zinc/14/82/13/869148213.db2.gz WCPCOGGEJMVVBP-UHFFFAOYSA-N 0 3 413.415 4.449 20 0 HIADHN CN(C)CCN(C)C(=O)Nc1ccc(Oc2nc(C(C)(C)C)ns2)c(Cl)c1 ZINC000445037297 869183698 /nfs/dbraw/zinc/18/36/98/869183698.db2.gz YUVRJGCISVRCRQ-UHFFFAOYSA-N 0 3 411.959 4.307 20 0 HIADHN Cc1cccc(C)c1NC(=O)Cc1noc(-c2ccc(CN3CCSCC3)cc2)n1 ZINC000445321049 869377891 /nfs/dbraw/zinc/37/78/91/869377891.db2.gz NSNOFXYTGKGLIK-UHFFFAOYSA-N 0 3 422.554 4.083 20 0 HIADHN Cc1cccc(C)c1NC(=O)Cc1noc(C2CCN(Cc3ccccc3)CC2)n1 ZINC000445321417 869379461 /nfs/dbraw/zinc/37/94/61/869379461.db2.gz PXEFSSQKDWBSGO-UHFFFAOYSA-N 0 3 404.514 4.247 20 0 HIADHN CCc1ccc(NC(=O)Cc2noc(-c3ccc(CN4CCSCC4)cc3)n2)cc1 ZINC000445325594 869386128 /nfs/dbraw/zinc/38/61/28/869386128.db2.gz WPNAGDTXFSZBCO-UHFFFAOYSA-N 0 3 422.554 4.029 20 0 HIADHN c1nnc(-c2ccc(-c3noc(-c4ccc(CN5CCSCC5)cc4)n3)cc2)o1 ZINC000445394919 869479971 /nfs/dbraw/zinc/47/99/71/869479971.db2.gz VXSHLMNGWNWRAV-UHFFFAOYSA-N 0 3 405.483 4.002 20 0 HIADHN c1nn(-c2ccccc2)cc1-c1noc(-c2ccc(CN3CCSCC3)cc2)n1 ZINC000445435671 869520368 /nfs/dbraw/zinc/52/03/68/869520368.db2.gz JYAOBGZKXCSUFV-UHFFFAOYSA-N 0 3 403.511 4.138 20 0 HIADHN Fc1cccc(CN2CCC[C@@H](c3nc(-c4ccc(OC(F)F)cn4)no3)C2)c1 ZINC000445514024 869576705 /nfs/dbraw/zinc/57/67/05/869576705.db2.gz OEYFHQSHCFPJLG-CQSZACIVSA-N 0 3 404.392 4.252 20 0 HIADHN C[C@H](N[C@H]1CCCC[C@H]1C(N)=O)c1nc2cc(Cl)ccc2n1Cc1ccccc1 ZINC000445788202 869824803 /nfs/dbraw/zinc/82/48/03/869824803.db2.gz YPISJWOKFNWTSC-IPELMVKDSA-N 0 3 410.949 4.433 20 0 HIADHN CN(CCC(=O)N(C)c1ccccc1)[C@@H]1CCOc2ccc(Br)cc21 ZINC000445885237 869872531 /nfs/dbraw/zinc/87/25/31/869872531.db2.gz MQBJAMSOWUICHL-GOSISDBHSA-N 0 3 403.320 4.258 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)c1cc(F)cc(C(F)(F)F)c1 ZINC000445985557 869949710 /nfs/dbraw/zinc/94/97/10/869949710.db2.gz MEHHXZSPDKAEDN-LJQANCHMSA-N 0 3 409.427 4.366 20 0 HIADHN CCN1CC[C@H](N(C)C(=O)CCCC(=O)c2ccc(Br)cc2)C[C@H]1C ZINC000446150573 870091374 /nfs/dbraw/zinc/09/13/74/870091374.db2.gz ZGZPCKYONVWAET-QAPCUYQASA-N 0 3 409.368 4.133 20 0 HIADHN COc1cccc(C)c1NC(=O)NCCCCN1CCN(c2cccc(C)c2)CC1 ZINC000446300695 870226197 /nfs/dbraw/zinc/22/61/97/870226197.db2.gz QCRJAIHZKXRSQR-UHFFFAOYSA-N 0 3 410.562 4.036 20 0 HIADHN O=C(CCCc1ccc(F)c(F)c1)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000446312327 870236721 /nfs/dbraw/zinc/23/67/21/870236721.db2.gz UQSHIKGRUKXAIN-UHFFFAOYSA-N 0 3 420.475 4.086 20 0 HIADHN CC(C)Cn1ccc2c1cccc2C(=O)N(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1 ZINC000446344780 870254539 /nfs/dbraw/zinc/25/45/39/870254539.db2.gz ZDBZBWUIQGGXMD-RDPSFJRHSA-N 0 3 404.558 4.457 20 0 HIADHN Cc1c2cc(Br)ccc2oc1C(=O)N(CCN(C)C)Cc1ccco1 ZINC000446430525 870347948 /nfs/dbraw/zinc/34/79/48/870347948.db2.gz WMHKPAHKUDMLNK-UHFFFAOYSA-N 0 3 405.292 4.301 20 0 HIADHN COc1ccc(CC(C)(C)NC(=O)NC[C@H](c2cccs2)N2CCCC2)cc1 ZINC000446564074 870475731 /nfs/dbraw/zinc/47/57/31/870475731.db2.gz JGOWNJFECRTKMX-LJQANCHMSA-N 0 3 401.576 4.214 20 0 HIADHN CC(C)N(C)c1ccccc1CNC(=O)N(CCN(C)C)Cc1ccc(F)c(F)c1 ZINC000446619853 870522201 /nfs/dbraw/zinc/52/22/01/870522201.db2.gz JWNUGHLDAJMDJK-UHFFFAOYSA-N 0 3 418.532 4.083 20 0 HIADHN CCCN(C(=O)N[C@@H](C)c1ccncc1OC)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000446634739 870540690 /nfs/dbraw/zinc/54/06/90/870540690.db2.gz NZCJBPLCGPQWJP-PZJWPPBQSA-N 0 3 410.562 4.237 20 0 HIADHN CC(C)OC(=O)C[C@H]1CCCN(Cc2cn(-c3ccccc3)nc2-c2ccncc2)C1 ZINC000468471160 882424599 /nfs/dbraw/zinc/42/45/99/882424599.db2.gz DXVKCANVCRZIOV-HXUWFJFHSA-N 0 3 418.541 4.488 20 0 HIADHN CC[C@@H](C)NC(=O)c1cccc(CN[C@@H](CCn2cncn2)c2ccc(C)cc2)c1 ZINC000446757430 870670812 /nfs/dbraw/zinc/67/08/12/870670812.db2.gz UEAYJQCRVSMQRV-XXBNENTESA-N 0 3 405.546 4.036 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N[C@H](c2ccccc2)c2cccc(F)c2)CC1 ZINC000446782666 870700283 /nfs/dbraw/zinc/70/02/83/870700283.db2.gz CIDKLXSCHDANLY-HSZRJFAPSA-N 0 3 413.537 4.104 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1cccc(C(=O)N(C)c2ccccc2)c1 ZINC000446816501 870730753 /nfs/dbraw/zinc/73/07/53/870730753.db2.gz BZEBXIJQAGFVFS-UHFFFAOYSA-N 0 3 420.513 4.152 20 0 HIADHN C[C@@H]([NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1)c1ccc(Br)cc1F ZINC000446841516 870760070 /nfs/dbraw/zinc/76/00/70/870760070.db2.gz QOFDKUGQRNIUOI-CYBMUJFWSA-N 0 3 421.310 4.249 20 0 HIADHN COc1ccc(CN[C@H](CCn2cncn2)c2ccc(C)cc2)cc1Br ZINC000446841851 870760205 /nfs/dbraw/zinc/76/02/05/870760205.db2.gz BFKYLBUMDNMOIO-LJQANCHMSA-N 0 3 415.335 4.279 20 0 HIADHN CSc1cc2c(cc1CN1CCC[C@@H](c3nc(C(F)(F)F)c[nH]3)C1)OCCO2 ZINC000446852216 870773410 /nfs/dbraw/zinc/77/34/10/870773410.db2.gz IBLRESHVFVAKPC-GFCCVEGCSA-N 0 3 413.465 4.301 20 0 HIADHN Cc1nn(CC(=O)OC(C)C)c(C)c1CN[C@@H](C)c1ccc(Br)cc1 ZINC000446909153 870825624 /nfs/dbraw/zinc/82/56/24/870825624.db2.gz VTHVKKFKVDOLTH-ZDUSSCGKSA-N 0 3 408.340 4.065 20 0 HIADHN Cc1ccc(Cc2cnc(NC(=O)N(CCN(C)C)Cc3ccco3)s2)cc1F ZINC000446936243 870847013 /nfs/dbraw/zinc/84/70/13/870847013.db2.gz LDUBAOUEXXYOPZ-UHFFFAOYSA-N 0 3 416.522 4.370 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3CC[C@](C)(c4ccccc4)C3)c(C)c2)CC1 ZINC000446946621 870855072 /nfs/dbraw/zinc/85/50/72/870855072.db2.gz AEAHTEPLDZFJSD-VWLOTQADSA-N 0 3 406.574 4.332 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)Nc2cc(-c3n[nH]c(C)n3)ccc2C)N(C)C)cc1 ZINC000447082092 870970101 /nfs/dbraw/zinc/97/01/01/870970101.db2.gz LXDMORYXHYXYRT-OAQYLSRUSA-N 0 3 406.534 4.075 20 0 HIADHN COc1cc(OC)c(NC(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)cc1F ZINC000447133069 871034300 /nfs/dbraw/zinc/03/43/00/871034300.db2.gz NESXYZPSZVZTGX-IBGZPJMESA-N 0 3 401.482 4.110 20 0 HIADHN C[C@@H]1CCN(C(=O)Nc2cnn(-c3ccccc3F)c2)CCN1Cc1ccccc1 ZINC000447185940 871078222 /nfs/dbraw/zinc/07/82/22/871078222.db2.gz TUZNCCBUEKCZFP-GOSISDBHSA-N 0 3 407.493 4.140 20 0 HIADHN COc1ccc(COC[C@@H](O)CN[C@H](C)c2ccc(Cl)cc2Cl)cc1OC ZINC000447327729 871218305 /nfs/dbraw/zinc/21/83/05/871218305.db2.gz WGUWXIREWHMCNK-CJNGLKHVSA-N 0 3 414.329 4.239 20 0 HIADHN Cc1ccc(-c2noc(CCCN3CCC(Oc4ncccc4F)CC3)n2)cc1F ZINC000447356784 871260420 /nfs/dbraw/zinc/26/04/20/871260420.db2.gz WFMUITOVJLHSDT-UHFFFAOYSA-N 0 3 414.456 4.194 20 0 HIADHN O=C(c1c(F)ccc(Br)c1F)N1C[C@H]2CCCN2Cc2ccccc21 ZINC000447375629 871282439 /nfs/dbraw/zinc/28/24/39/871282439.db2.gz QMFXKXDGSPOUSC-CYBMUJFWSA-N 0 3 407.258 4.352 20 0 HIADHN COc1ccccc1-c1csc([C@@H]2CCCN(CCn3c(C)csc3=O)C2)n1 ZINC000447385881 871295178 /nfs/dbraw/zinc/29/51/78/871295178.db2.gz PLECZUUBGHGYCY-MRXNPFEDSA-N 0 3 415.584 4.230 20 0 HIADHN CN(CCSc1nc2ccccc2c(=O)n1-c1cccnc1)Cc1ccc(F)cc1 ZINC000468504910 882502722 /nfs/dbraw/zinc/50/27/22/882502722.db2.gz CCIBFBKSGYXRPD-UHFFFAOYSA-N 0 3 420.513 4.144 20 0 HIADHN CC(C)[C@@H]1C[C@H](NCc2ccccc2OCC(=O)NC[C@@H]2CCCO2)c2ccccc21 ZINC000447539867 871404500 /nfs/dbraw/zinc/40/45/00/871404500.db2.gz HWNGCJZQUAFGLW-OYDLWJJNSA-N 0 3 422.569 4.335 20 0 HIADHN O=C(NCCCCN1CCN(c2cccc(C(F)(F)F)c2)CC1)[C@H]1[C@@H]2CCCC[C@@H]21 ZINC000468508221 882509903 /nfs/dbraw/zinc/50/99/03/882509903.db2.gz XOXLPHNMUGMVEN-AERCQKQUSA-N 0 3 423.523 4.160 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(S(N)(=O)=O)cc1)c1cccc(OCc2ccccc2)c1 ZINC000447602051 871509682 /nfs/dbraw/zinc/50/96/82/871509682.db2.gz SHLWVYMFDIJWGX-ZWKOTPCHSA-N 0 3 410.539 4.325 20 0 HIADHN COc1ccc(Cn2nc(C)c(CN3CCC(n4cc(Cl)cn4)CC3)c2C)cc1 ZINC000468512471 882516365 /nfs/dbraw/zinc/51/63/65/882516365.db2.gz UNKJQKIAXKCYAH-UHFFFAOYSA-N 0 3 413.953 4.244 20 0 HIADHN O=C1[C@H](N[C@H](c2ccccc2)[C@@H]2CCCc3ccccc32)CCN1C1CCOCC1 ZINC000447888381 871801890 /nfs/dbraw/zinc/80/18/90/871801890.db2.gz JUIIXVGQXJTSJF-UBFVSLLYSA-N 0 3 404.554 4.217 20 0 HIADHN CC(=O)N(c1nc(CNC[C@H]2N(C)CCCC2(C)C)cs1)c1ccc(C)cc1 ZINC000447905492 871810250 /nfs/dbraw/zinc/81/02/50/871810250.db2.gz UKFKFPBWIWJIGS-HXUWFJFHSA-N 0 3 400.592 4.346 20 0 HIADHN CN1CCCC(C)(C)[C@@H]1CNC(=O)Nc1cnn(-c2ccccc2)c1C(F)(F)F ZINC000448006178 871850188 /nfs/dbraw/zinc/85/01/88/871850188.db2.gz BVXJURHFCCKZKC-INIZCTEOSA-N 0 3 409.456 4.133 20 0 HIADHN CO[C@@H]1CCOc2c(NC(=O)NCC(C)(C)N3CCc4ccccc4C3)cccc21 ZINC000448039894 871872610 /nfs/dbraw/zinc/87/26/10/871872610.db2.gz UQGWEXXMLYNKBF-OAQYLSRUSA-N 0 3 409.530 4.115 20 0 HIADHN CC(C)(C)[C@@H](CN1CCc2ccccc2C1)NC(=O)Nc1cccc(N2CCC2=O)c1 ZINC000448051326 871881558 /nfs/dbraw/zinc/88/15/58/871881558.db2.gz ZJAKHFGPXACLPX-JOCHJYFZSA-N 0 3 420.557 4.018 20 0 HIADHN CC[C@@H]1C[C@H](C)CN1CC(=O)N(Cc1nnc(-c2ccccc2Cl)o1)C1CC1 ZINC000448093558 871931404 /nfs/dbraw/zinc/93/14/04/871931404.db2.gz AOHZKOWLNKFRCD-LSDHHAIUSA-N 0 3 402.926 4.001 20 0 HIADHN O=S(=O)(c1c(Cl)cc(Cl)cc1Cl)N1CC[C@@H]2[C@@H](CCCN2C2CC2)C1 ZINC000448164132 872039910 /nfs/dbraw/zinc/03/99/10/872039910.db2.gz IETAESTWAIWYNQ-MEDUHNTESA-N 0 3 423.793 4.284 20 0 HIADHN O=C(CC1(N2CCOCC2)CCCC1)N1CCC(Sc2ccc(Cl)cc2)CC1 ZINC000448176662 872052613 /nfs/dbraw/zinc/05/26/13/872052613.db2.gz IYCLMIOHWGAPDT-UHFFFAOYSA-N 0 3 423.022 4.458 20 0 HIADHN CCCN(CCN1CCN(CC)CC1)C(=O)NCc1ccccc1Oc1ccccc1 ZINC000460143003 872646474 /nfs/dbraw/zinc/64/64/74/872646474.db2.gz MPRCXAGZPIOAIB-UHFFFAOYSA-N 0 3 424.589 4.038 20 0 HIADHN Cc1cn(-c2c(F)cccc2F)nc1C(=O)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000468583651 882664591 /nfs/dbraw/zinc/66/45/91/882664591.db2.gz FHBWJANTSVXWJO-FQEVSTJZSA-N 0 3 410.468 4.026 20 0 HIADHN Cc1ccc(CNCc2ccc(OCc3ccncc3)cc2)c(-n2cc(Cl)cn2)n1 ZINC000468588047 882669335 /nfs/dbraw/zinc/66/93/35/882669335.db2.gz IGASXHHQBCVHAY-UHFFFAOYSA-N 0 3 419.916 4.493 20 0 HIADHN CCCN(CCN(C)C)C(=O)C1(c2ccc(OCc3ccccc3)cc2)CCOCC1 ZINC000460376059 873013934 /nfs/dbraw/zinc/01/39/34/873013934.db2.gz RCTGLEUZCIBCET-UHFFFAOYSA-N 0 3 424.585 4.114 20 0 HIADHN COc1cccc(-n2c3ccccc3nc2NC(=O)c2ccc(CN(C)C)cc2)c1 ZINC000460404427 873056013 /nfs/dbraw/zinc/05/60/13/873056013.db2.gz VNQSHLOBNKVGTN-UHFFFAOYSA-N 0 3 400.482 4.348 20 0 HIADHN CCOC(=O)c1csc(CCNCc2cc(Br)ccc2Cl)n1 ZINC000468595193 882685171 /nfs/dbraw/zinc/68/51/71/882685171.db2.gz CVWMWRKTJRZKDK-UHFFFAOYSA-N 0 3 403.729 4.068 20 0 HIADHN CCCN(CCN1CCN(CC)CC1)C(=O)N[C@H](c1ccc(Cl)cc1)[C@@H]1C[C@H]1C ZINC000460530592 873224293 /nfs/dbraw/zinc/22/42/93/873224293.db2.gz IGPFDAAIIGMCBC-STZQEDGTSA-N 0 3 421.029 4.096 20 0 HIADHN CN1CC[C@H](NC(=O)N2CCCC[C@H]2c2nnc(C3CCC3)o2)[C@H]1c1ccccc1 ZINC000460557467 873279256 /nfs/dbraw/zinc/27/92/56/873279256.db2.gz UYAFDNHQQHYCIW-SLFFLAALSA-N 0 3 409.534 4.019 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)[C@H](C)c3cccc(Cl)c3)CC2)c1 ZINC000460718912 873517406 /nfs/dbraw/zinc/51/74/06/873517406.db2.gz SYWXJVZXIQAUKH-HXUWFJFHSA-N 0 3 413.993 4.471 20 0 HIADHN CCOCCCn1c(-c2ccoc2)nnc1N1C[C@H](C)N(Cc2ccccc2)C[C@@H]1C ZINC000460720810 873518509 /nfs/dbraw/zinc/51/85/09/873518509.db2.gz CSWFQEZJSZAQLN-PMACEKPBSA-N 0 3 423.561 4.064 20 0 HIADHN CC(C)N1CCCN(C(=O)c2cn(C(C)(C)C)nc2-c2ccc(F)cc2F)CC1 ZINC000460882417 873792965 /nfs/dbraw/zinc/79/29/65/873792965.db2.gz QIZIRCOOKORFDW-UHFFFAOYSA-N 0 3 404.505 4.140 20 0 HIADHN CCCN(C(=O)c1ccc(-n2cncn2)cc1C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000460884077 873796917 /nfs/dbraw/zinc/79/69/17/873796917.db2.gz PBKHQWOJSRQAKS-QHCPKHFHSA-N 0 3 417.557 4.093 20 0 HIADHN CC1CCN([C@@H](CNC(=O)c2ccc(OC3CCOCC3)cc2)c2ccccc2)CC1 ZINC000460966071 873862897 /nfs/dbraw/zinc/86/28/97/873862897.db2.gz VJNJJUPJVUKGCP-VWLOTQADSA-N 0 3 422.569 4.447 20 0 HIADHN CC1CCN([C@H](CNC(=O)[C@@H]2C[C@H]2c2ccc3c(c2)OCCO3)c2ccccc2)CC1 ZINC000460967219 873864027 /nfs/dbraw/zinc/86/40/27/873864027.db2.gz YQHCWOFLXPETAK-YTFSRNRJSA-N 0 3 420.553 4.151 20 0 HIADHN CCN(C(=O)c1cccc(OCCCOC)c1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000460971262 873866867 /nfs/dbraw/zinc/86/68/67/873866867.db2.gz SZHZVNVZVPYGTE-OFNKIYASSA-N 0 3 410.558 4.400 20 0 HIADHN CCN(C(=O)c1cccc(OCCCOC)c1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000460971260 873867015 /nfs/dbraw/zinc/86/70/15/873867015.db2.gz SZHZVNVZVPYGTE-NFBKMPQASA-N 0 3 410.558 4.400 20 0 HIADHN CSC1(CNC(=O)CCC(=O)c2ccc(-c3ccccc3)cc2)CCN(C)CC1 ZINC000460979559 873871411 /nfs/dbraw/zinc/87/14/11/873871411.db2.gz LNPXXOGUHUCJRS-UHFFFAOYSA-N 0 3 410.583 4.260 20 0 HIADHN CO[C@H](CNC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1)c1ccc(Cl)cc1 ZINC000461031525 873894870 /nfs/dbraw/zinc/89/48/70/873894870.db2.gz DNKHRHCJZPRSEU-GHTZIAJQSA-N 0 3 404.913 4.195 20 0 HIADHN O=C(NCc1ccccc1)[C@@H](NC[C@@H]1CCN(c2ccccc2F)C1)c1ccccc1 ZINC000461077185 873979357 /nfs/dbraw/zinc/97/93/57/873979357.db2.gz SPFMBRJTIQSOSN-OFVILXPXSA-N 0 3 417.528 4.299 20 0 HIADHN C[C@H](NCc1ccc(N2CCCS2(=O)=O)cc1)c1cc2cc(Cl)ccc2o1 ZINC000461087320 874000518 /nfs/dbraw/zinc/00/05/18/874000518.db2.gz YKSPEEALXCXURT-AWEZNQCLSA-N 0 3 404.919 4.477 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)Nc1ccc(Br)cc1Cl ZINC000461108405 874029885 /nfs/dbraw/zinc/02/98/85/874029885.db2.gz AASMORYGJVIIII-HNNXBMFYSA-N 0 3 424.726 4.313 20 0 HIADHN C[C@H](NC(=O)N1CCCC[C@H]1c1nnc(C2CCC2)o1)[C@@H](c1ccccc1)N(C)C ZINC000461208435 874210968 /nfs/dbraw/zinc/21/09/68/874210968.db2.gz JRYQVIUTHVNIIR-VDGAXYAQSA-N 0 3 411.550 4.265 20 0 HIADHN CCOc1c(Br)cc(CN2CCCC[C@@H](CCOC)C2)cc1OC ZINC000468698414 882819250 /nfs/dbraw/zinc/81/92/50/882819250.db2.gz KMFHBXVGUOZSIN-HNNXBMFYSA-N 0 3 400.357 4.495 20 0 HIADHN O=C(NCc1nc2c(s1)C[C@H](c1ccccc1)CC2)[C@@H]1CCCN1C1CCCC1 ZINC000468731976 882832946 /nfs/dbraw/zinc/83/29/46/882832946.db2.gz BUKXHODADZLIHK-NQIIRXRSSA-N 0 3 409.599 4.439 20 0 HIADHN Cc1cn(-c2c(F)cccc2F)nc1C(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000468745872 882839790 /nfs/dbraw/zinc/83/97/90/882839790.db2.gz WGRXZTJBYYCEBH-FUHWJXTLSA-N 0 3 410.468 4.024 20 0 HIADHN CC[C@@H](CN(C)C(=O)N[C@H](C)C1=CCN(C)CC1)Oc1ccc(Cl)c(Cl)c1 ZINC000468745866 882839960 /nfs/dbraw/zinc/83/99/60/882839960.db2.gz WEIHURNFXBBTLN-ZBFHGGJFSA-N 0 3 414.377 4.443 20 0 HIADHN C[C@H]1CCN(C(=O)CN[C@@H](c2ccccc2)C(F)(F)F)CCN1Cc1ccccc1 ZINC000468800281 882865239 /nfs/dbraw/zinc/86/52/39/882865239.db2.gz BYGJXYUGPQERTC-AVRDEDQJSA-N 0 3 419.491 4.003 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)N(C)[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000461710860 874859607 /nfs/dbraw/zinc/85/96/07/874859607.db2.gz ULPSLFDULKVVDY-SXSPYAJSSA-N 0 3 413.537 4.208 20 0 HIADHN CC[C@@H](NCc1ccc(C)nc1-n1cc(Cl)cn1)c1ccc(OC)c(OC)c1 ZINC000468811174 882871433 /nfs/dbraw/zinc/87/14/33/882871433.db2.gz DFAXRJFNFWOJIX-GOSISDBHSA-N 0 3 400.910 4.487 20 0 HIADHN CC[C@@H](c1nnc(N(C)[C@H]2CCN(C3CC3)C2)n1C[C@H]1CCCCO1)c1ccccc1 ZINC000461817702 874938674 /nfs/dbraw/zinc/93/86/74/874938674.db2.gz AWDZBHKOKPYQCX-YTFSRNRJSA-N 0 3 423.605 4.062 20 0 HIADHN Cc1c([C@H](C)N[C@@H](C)c2cc(F)ccc2N2CCN(C)CC2)cnn1C(C)(C)C ZINC000468835239 882882203 /nfs/dbraw/zinc/88/22/03/882882203.db2.gz FVZXNUXIINEJGY-IRXDYDNUSA-N 0 3 401.574 4.249 20 0 HIADHN CC[C@H](Cc1ccccc1)N(CC)CC(=O)N1CCC(C(=O)Nc2ccccc2)CC1 ZINC000468868679 882899264 /nfs/dbraw/zinc/89/92/64/882899264.db2.gz GVKVDCKPAHGXJW-XMMPIXPASA-N 0 3 421.585 4.207 20 0 HIADHN C[C@@H](NC(=O)CCN1CCN(c2ccccc2)CC1)c1cccc(C(F)(F)F)c1 ZINC000462047890 875161676 /nfs/dbraw/zinc/16/16/76/875161676.db2.gz QTSIQHLZIZLWHS-QGZVFWFLSA-N 0 3 405.464 4.095 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)N[C@H]2CCc3sc(Cl)cc32)c1 ZINC000462051770 875165518 /nfs/dbraw/zinc/16/55/18/875165518.db2.gz OOWBEZKPLNTYNK-KRWDZBQOSA-N 0 3 407.967 4.171 20 0 HIADHN COc1cccc(CN[C@H](C)Cn2cc(Br)cn2)c1OC1CCCC1 ZINC000468871374 882902587 /nfs/dbraw/zinc/90/25/87/882902587.db2.gz GCCXUYFBFBHSNG-CQSZACIVSA-N 0 3 408.340 4.154 20 0 HIADHN Cc1ccccc1-c1cc(NC(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)n(C)n1 ZINC000462088529 875198549 /nfs/dbraw/zinc/19/85/49/875198549.db2.gz NFQSMEPUBFQHQT-ICSRJNTNSA-N 0 3 403.530 4.353 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3cccc(Oc4ccncc4)c3)cc2)CC1 ZINC000462097403 875206719 /nfs/dbraw/zinc/20/67/19/875206719.db2.gz QEUHQOOLQNVTDL-UHFFFAOYSA-N 0 3 402.498 4.268 20 0 HIADHN CN(C(=O)N[C@H]1CCCc2cn(C3CCCC3)nc21)[C@H]1CCN(Cc2ccccc2)C1 ZINC000462154726 875251663 /nfs/dbraw/zinc/25/16/63/875251663.db2.gz JZHRMPIQJRIJJF-GOTSBHOMSA-N 0 3 421.589 4.292 20 0 HIADHN CC(C)Oc1ccc(C(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)nc1 ZINC000468877802 882910716 /nfs/dbraw/zinc/91/07/16/882910716.db2.gz GSKGZCKPQFWXKJ-UHFFFAOYSA-N 0 3 409.452 4.092 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)NCc3ccc4sccc4c3)CC2)C[C@@H](C)O1 ZINC000462164352 875259980 /nfs/dbraw/zinc/25/99/80/875259980.db2.gz HDGBXLPRDPOQHW-QZTJIDSGSA-N 0 3 415.603 4.322 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)NCc3ccc4sccc4c3)CC2)C[C@H](C)O1 ZINC000462164353 875260363 /nfs/dbraw/zinc/26/03/63/875260363.db2.gz HDGBXLPRDPOQHW-ROUUACIJSA-N 0 3 415.603 4.322 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1cnn(-c2ccccc2)c1C1CC1 ZINC000462171585 875268850 /nfs/dbraw/zinc/26/88/50/875268850.db2.gz SSVGKPZBZGJEQN-MBSDFSHPSA-N 0 3 400.526 4.000 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C1(c2ccccc2Cl)CCOCC1 ZINC000462174292 875272211 /nfs/dbraw/zinc/27/22/11/875272211.db2.gz GKTLBSSMOIGUPP-AVRDEDQJSA-N 0 3 412.961 4.025 20 0 HIADHN CC(C)n1ncc2c1nc(C1CC1)cc2C(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C ZINC000462186866 875288982 /nfs/dbraw/zinc/28/89/82/875288982.db2.gz GOYXCVBOQHOKPK-HXOBKFHXSA-N 0 3 417.557 4.140 20 0 HIADHN CC(C)n1ncc2c1nc(C1CC1)cc2C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C ZINC000462186864 875289287 /nfs/dbraw/zinc/28/92/87/875289287.db2.gz GOYXCVBOQHOKPK-GAJHUEQPSA-N 0 3 417.557 4.140 20 0 HIADHN CC(C)CC(=O)Nc1ccc(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)cc1F ZINC000462188569 875290619 /nfs/dbraw/zinc/29/06/19/875290619.db2.gz NSDNFUJKKCXMCR-HTAPYJJXSA-N 0 3 411.521 4.061 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)c1cc(-c2ccccc2C(F)(F)F)on1 ZINC000462215701 875324021 /nfs/dbraw/zinc/32/40/21/875324021.db2.gz RQJSCQUOQFIKLI-UHFFFAOYSA-N 0 3 407.392 4.157 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)NC[C@@H](Cc2ccccc2)C(F)(F)F)cc1 ZINC000462240344 875355624 /nfs/dbraw/zinc/35/56/24/875355624.db2.gz VECBIHQFTWBAHQ-QUCCMNQESA-N 0 3 423.479 4.018 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1NC(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C ZINC000462252284 875373904 /nfs/dbraw/zinc/37/39/04/875373904.db2.gz BCRSYCYOEJMETH-VGSWGCGISA-N 0 3 403.530 4.131 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1NC(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C ZINC000462252283 875374104 /nfs/dbraw/zinc/37/41/04/875374104.db2.gz BCRSYCYOEJMETH-VGOFRKELSA-N 0 3 403.530 4.131 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N[C@H]3CCO[C@H](c4ccccc4)C3)c(C)c2)CC1 ZINC000462257149 875380161 /nfs/dbraw/zinc/38/01/61/875380161.db2.gz NDLWCEAFYQQQKJ-URXFXBBRSA-N 0 3 422.573 4.179 20 0 HIADHN CC(C)(C)[C@@H](Cc1ccccc1C(F)(F)F)NC(=O)N1CC[C@H](N2CC=CC2)C1 ZINC000462305816 875426300 /nfs/dbraw/zinc/42/63/00/875426300.db2.gz MZEXWVQPKHPDAZ-PKOBYXMFSA-N 0 3 409.496 4.318 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)CN[C@@H](c1ccccc1)C(F)(F)F ZINC000468887096 882928285 /nfs/dbraw/zinc/92/82/85/882928285.db2.gz GMUXQLZLMTVTBB-GCJKJVERSA-N 0 3 419.491 4.003 20 0 HIADHN O[C@H](CNCc1ccccc1OCC(F)(F)F)COc1cccc(Cl)c1Cl ZINC000462365176 875477706 /nfs/dbraw/zinc/47/77/06/875477706.db2.gz JYJIVVGILKDBEM-CYBMUJFWSA-N 0 3 424.246 4.464 20 0 HIADHN CC(C)N1CCC(N(C)S(=O)(=O)c2ccc3nc(C(C)(C)C)sc3c2)CC1 ZINC000462444185 875549578 /nfs/dbraw/zinc/54/95/78/875549578.db2.gz CLOKJBRJCOJMNE-UHFFFAOYSA-N 0 3 409.621 4.087 20 0 HIADHN OC[C@H](CNCc1sccc1Br)Cc1ccccc1C(F)(F)F ZINC000462536636 875655142 /nfs/dbraw/zinc/65/51/42/875655142.db2.gz SMVGFNHYEHHKHX-NSHDSACASA-N 0 3 408.283 4.470 20 0 HIADHN CCOc1cc(CNCc2ccc(C(F)F)cc2)ccc1O[C@@H](C)C(=O)N(C)C ZINC000462658690 875762790 /nfs/dbraw/zinc/76/27/90/875762790.db2.gz PVJHVMAREROSFD-HNNXBMFYSA-N 0 3 406.473 4.168 20 0 HIADHN Cc1cc(NC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)ccc1OC1CCOCC1 ZINC000462671293 875768988 /nfs/dbraw/zinc/76/89/88/875768988.db2.gz BJMFMHKPAUDOSO-WMZHIEFXSA-N 0 3 423.557 4.195 20 0 HIADHN Cc1cc(NC(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)ccc1OC1CCOCC1 ZINC000462671294 875769005 /nfs/dbraw/zinc/76/90/05/875769005.db2.gz BJMFMHKPAUDOSO-XXBNENTESA-N 0 3 423.557 4.195 20 0 HIADHN C[C@H](CNCc1cnn(-c2ccc(Br)cc2)c1)Oc1ccccc1F ZINC000462733413 875807391 /nfs/dbraw/zinc/80/73/91/875807391.db2.gz IOWGLWJGRRGFBQ-CQSZACIVSA-N 0 3 404.283 4.331 20 0 HIADHN OC[C@@H](CNCc1ccc(Br)cc1F)Cc1c(F)cccc1Cl ZINC000462740670 875811602 /nfs/dbraw/zinc/81/16/02/875811602.db2.gz SJCMBUWOVOQWBC-LLVKDONJSA-N 0 3 404.682 4.322 20 0 HIADHN COC(=O)c1cc(CN[C@H](C)c2ccc(OC3CCCC3)c(OC)c2)n(C)c1C ZINC000462781949 875836333 /nfs/dbraw/zinc/83/63/33/875836333.db2.gz XCJOWLAZARUOCE-OAHLLOKOSA-N 0 3 400.519 4.301 20 0 HIADHN CC(C)(C)OC(=O)c1ccc(CN2CCC[C@H](c3nnc4n3CCCCC4)C2)cc1 ZINC000462791627 875843090 /nfs/dbraw/zinc/84/30/90/875843090.db2.gz YLHMECYFUFNXKJ-FQEVSTJZSA-N 0 3 410.562 4.339 20 0 HIADHN COc1cc(Br)c(CNC[C@@H]2CCN(c3ccccc3F)C2)c(OC)c1 ZINC000462902874 875928440 /nfs/dbraw/zinc/92/84/40/875928440.db2.gz ABGXWDJEOYUZHR-AWEZNQCLSA-N 0 3 423.326 4.222 20 0 HIADHN COCCOCc1ccc(CNCc2ccc(Br)c3cccnc23)cc1 ZINC000462910637 875935617 /nfs/dbraw/zinc/93/56/17/875935617.db2.gz DGUJGBXJENNVJU-UHFFFAOYSA-N 0 3 415.331 4.450 20 0 HIADHN Cc1nc(COc2ccc(CN[C@H]3CC(=O)N(c4ccccc4F)C3)cc2)cs1 ZINC000463022184 876040158 /nfs/dbraw/zinc/04/01/58/876040158.db2.gz CUJRJTBIAQQSMH-KRWDZBQOSA-N 0 3 411.502 4.065 20 0 HIADHN COc1ccc(-c2nn(Cc3ccccc3)cc2CN2CC[C@H](n3cccn3)C2)cc1 ZINC000463023973 876041622 /nfs/dbraw/zinc/04/16/22/876041622.db2.gz JSQHZIZVJLUESQ-QHCPKHFHSA-N 0 3 413.525 4.251 20 0 HIADHN CCOc1c(Br)cc(CN(CC)[C@H]2CCOC2)cc1Br ZINC000463042169 876068730 /nfs/dbraw/zinc/06/87/30/876068730.db2.gz IMKIUWXPYONHPO-LBPRGKRZSA-N 0 3 407.146 4.221 20 0 HIADHN CCOC(=O)c1nn(-c2ccccc2)cc1CN[C@@H]1CCO[C@@H](c2ccccc2)C1 ZINC000463056921 876084997 /nfs/dbraw/zinc/08/49/97/876084997.db2.gz NUJYTSBSNCHBIP-IFMALSPDSA-N 0 3 405.498 4.059 20 0 HIADHN CC[C@H](O[C@@H]1CCC[C@H](C)C1)C(=O)NCCCCN1CCN(c2ccccc2)CC1 ZINC000463123159 876165106 /nfs/dbraw/zinc/16/51/06/876165106.db2.gz ARXKCNLOJUWQDC-QTJGBDASSA-N 0 3 415.622 4.079 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)c1cc(NC(=O)C(C)(C)C)ccc1F ZINC000463145242 876198987 /nfs/dbraw/zinc/19/89/87/876198987.db2.gz AGBNJVPXAMOHBR-UHFFFAOYSA-N 0 3 417.500 4.153 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)cc1C(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000463167146 876221678 /nfs/dbraw/zinc/22/16/78/876221678.db2.gz VMODPQBLCCNESL-FXAWDEMLSA-N 0 3 408.933 4.399 20 0 HIADHN Cn1c2cc(Br)ccc2nc1CN1CCCC[C@@H]1[C@@H]1CCCC[C@H]1O ZINC000463198210 876257941 /nfs/dbraw/zinc/25/79/41/876257941.db2.gz LISODDAAMPLPAX-KVSKMBFKSA-N 0 3 406.368 4.241 20 0 HIADHN O=C(CN1CCCC[C@@H]1[C@@H]1CCCC[C@@H]1O)N[C@H](c1cccs1)c1ccccc1 ZINC000463200223 876260257 /nfs/dbraw/zinc/26/02/57/876260257.db2.gz AWOXEZXUMKTBMP-XARGGIHNSA-N 0 3 412.599 4.359 20 0 HIADHN CCc1ccc(Cl)c(CC)c1NC(=O)CCCN1CCC(F)(F)[C@H](CO)C1 ZINC000463231737 876286547 /nfs/dbraw/zinc/28/65/47/876286547.db2.gz OWJWUIGPPGALSG-HNNXBMFYSA-N 0 3 402.913 4.133 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)NCc1ccc(-c2cccnc2)cc1 ZINC000463266227 876324681 /nfs/dbraw/zinc/32/46/81/876324681.db2.gz LPGAZNBGSBBZKT-NTKDMRAZSA-N 0 3 400.526 4.068 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)NCc1ccc(-c2ccncc2)cc1 ZINC000463275479 876332938 /nfs/dbraw/zinc/33/29/38/876332938.db2.gz LGSCJIVRRUCQCO-CYFREDJKSA-N 0 3 400.526 4.068 20 0 HIADHN C[C@H](CC(=O)OC(C)(C)C)NCc1cc(Br)cc(Br)c1N ZINC000463296254 876356257 /nfs/dbraw/zinc/35/62/57/876356257.db2.gz CUVNIYOMKXMLBQ-SECBINFHSA-N 0 3 422.161 4.004 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)c1cccc(-c2noc(C3CC3)n2)c1 ZINC000463323496 876380272 /nfs/dbraw/zinc/38/02/72/876380272.db2.gz IGZAOIDUXPQZAT-OAQYLSRUSA-N 0 3 402.498 4.181 20 0 HIADHN O=C(CCN1Cc2ccc(O)cc2C2(CC2)C1)Nc1ccc(Br)cc1F ZINC000463416342 876470658 /nfs/dbraw/zinc/47/06/58/876470658.db2.gz SLIBIJSYKFWXDI-UHFFFAOYSA-N 0 3 419.294 4.170 20 0 HIADHN Oc1ccc2c(c1)C1(CC1)CN(C/C=C/CN1Cc3ccc(O)cc3C3(CC3)C1)C2 ZINC000463422992 876477394 /nfs/dbraw/zinc/47/73/94/876477394.db2.gz BDHTYTBVYBHPAW-OWOJBTEDSA-N 0 3 402.538 4.049 20 0 HIADHN CC[C@H](O[C@@H]1CCC[C@@H](C)C1)C(=O)Nc1ccc(N2CCN(CC)CC2)cc1C ZINC000463429614 876483733 /nfs/dbraw/zinc/48/37/33/876483733.db2.gz JRGJERMXSRIWLZ-AAIMPIBUSA-N 0 3 401.595 4.449 20 0 HIADHN CC(C)N(Cc1ccccc1)C(=O)[C@H](C)N1CCC[C@](CO)(Cc2ccccc2)C1 ZINC000463433543 876489608 /nfs/dbraw/zinc/48/96/08/876489608.db2.gz DSPDNGPFENDFGZ-NVQXNPDNSA-N 0 3 408.586 4.129 20 0 HIADHN O=C(NCc1ccco1)c1cccc(CN2CCC[C@](CO)(Cc3ccccc3)C2)c1 ZINC000463440498 876497743 /nfs/dbraw/zinc/49/77/43/876497743.db2.gz FNRHFUSKCUSKGR-SANMLTNESA-N 0 3 418.537 4.027 20 0 HIADHN COc1cc(-c2nnc(CN[C@@H]3CCCCC34CCCC4)o2)cc(OC)c1OC ZINC000463441382 876498965 /nfs/dbraw/zinc/49/89/65/876498965.db2.gz QWLAEMRZTQNNGA-GOSISDBHSA-N 0 3 401.507 4.355 20 0 HIADHN OC[C@@]1(Cc2ccccc2)CCCN(C[C@@H](O)COc2cc(Cl)ccc2Cl)C1 ZINC000463453893 876514079 /nfs/dbraw/zinc/51/40/79/876514079.db2.gz WDLOTOXYJHQNPI-DENIHFKCSA-N 0 3 424.368 4.050 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)[C@@H]1C[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000463526035 876597500 /nfs/dbraw/zinc/59/75/00/876597500.db2.gz DGIAWMQFESUOCT-HUUCEWRRSA-N 0 3 412.402 4.076 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)cc1C(=O)N(CCN(C)C)Cc1cccc(F)c1 ZINC000463527415 876598444 /nfs/dbraw/zinc/59/84/44/876598444.db2.gz PFPGHHBLTZIJBA-UHFFFAOYSA-N 0 3 414.912 4.177 20 0 HIADHN Cc1nc(C2CCCC2)sc1C(=O)N(C)C1CCN(CCc2ccccn2)CC1 ZINC000463620628 876739683 /nfs/dbraw/zinc/73/96/83/876739683.db2.gz FHZSRZIGIAWDPZ-UHFFFAOYSA-N 0 3 412.603 4.283 20 0 HIADHN CN(C)[C@@H](CNC(=O)Nc1cccc(-c2ncc3n2CCCC3)c1)c1ccccc1 ZINC000463696695 876816693 /nfs/dbraw/zinc/81/66/93/876816693.db2.gz JKLGUNXOVIBZCW-QFIPXVFZSA-N 0 3 403.530 4.311 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)CCc1nc(-c2ccsc2)no1 ZINC000469002277 883068947 /nfs/dbraw/zinc/06/89/47/883068947.db2.gz PHXUWCVMVNNDMG-IBGZPJMESA-N 0 3 412.559 4.004 20 0 HIADHN CSc1cccc(N(C(=O)COc2cc(F)cc(F)c2)C2CCN(C)CC2)c1 ZINC000463806468 876923530 /nfs/dbraw/zinc/92/35/30/876923530.db2.gz DGIZDNQFFWUYFO-UHFFFAOYSA-N 0 3 406.498 4.193 20 0 HIADHN CC(C)n1cc(Br)cc1C(=O)N(Cc1ccco1)C1CCN(C)CC1 ZINC000463820199 876934166 /nfs/dbraw/zinc/93/41/66/876934166.db2.gz DIXZWQGQQUZSIA-UHFFFAOYSA-N 0 3 408.340 4.161 20 0 HIADHN Cn1cc(N2CCC[C@@H](N[C@H](Cc3ccc(Cl)cc3)c3ccccc3)C2=O)cn1 ZINC000463885303 877005555 /nfs/dbraw/zinc/00/55/55/877005555.db2.gz AIPULCAOEVULOL-FGZHOGPDSA-N 0 3 408.933 4.143 20 0 HIADHN CCOC(=O)C1CCN(C(=O)[C@H](C)N[C@@H](CC(C)(C)C)c2ccc(F)cc2)CC1 ZINC000463910210 877031025 /nfs/dbraw/zinc/03/10/25/877031025.db2.gz ISWWRVJHUABQQA-JXFKEZNVSA-N 0 3 406.542 4.083 20 0 HIADHN COc1ccc([C@@H](CNC(=O)NC[C@H](C)c2ccc(F)cc2F)N2CCCC2)cc1 ZINC000463959206 877082876 /nfs/dbraw/zinc/08/28/76/877082876.db2.gz SPOAROXVVDESEO-KSFYIVLOSA-N 0 3 417.500 4.213 20 0 HIADHN CC(C)[C@H](C(=O)Nc1ccc(C(=O)N(C)[C@@H]2CCCN(C)C2)cc1)c1ccccc1 ZINC000464019586 877153294 /nfs/dbraw/zinc/15/32/94/877153294.db2.gz WUDFWANXRZGKBU-PKTZIBPZSA-N 0 3 407.558 4.231 20 0 HIADHN CC(C)[C@@H](C(=O)Nc1ccc(C(=O)N(C)[C@@H]2CCCN(C)C2)cc1)c1ccccc1 ZINC000464019584 877153844 /nfs/dbraw/zinc/15/38/44/877153844.db2.gz WUDFWANXRZGKBU-DHIUTWEWSA-N 0 3 407.558 4.231 20 0 HIADHN CCc1cc(N2CCC[C@H](NCc3cc(Cl)ccc3Br)C2)ncn1 ZINC000464052213 877194176 /nfs/dbraw/zinc/19/41/76/877194176.db2.gz JHMQGCZKSLEPKH-INIZCTEOSA-N 0 3 409.759 4.214 20 0 HIADHN O=C(Cc1cccc(Cl)c1F)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000464190110 877360747 /nfs/dbraw/zinc/36/07/47/877360747.db2.gz ZHAILLJAFLSWES-SFHVURJKSA-N 0 3 412.896 4.304 20 0 HIADHN CC[C@@H](C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)c1ccc(OC)cc1 ZINC000464208032 877378478 /nfs/dbraw/zinc/37/84/78/877378478.db2.gz UEQGCFNHMSUTOI-JTHBVZDNSA-N 0 3 418.541 4.471 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N2Cc3ccc(O)cc3C3(CC3)C2)N2CCCC2)cc1 ZINC000464238104 877414367 /nfs/dbraw/zinc/41/43/67/877414367.db2.gz VTKLJKUXODUBHE-QHCPKHFHSA-N 0 3 405.542 4.095 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)NCc1cccc(-c2cccnc2)c1 ZINC000464292276 877478744 /nfs/dbraw/zinc/47/87/44/877478744.db2.gz DBSUGOYCJLNMKT-CYFREDJKSA-N 0 3 400.526 4.068 20 0 HIADHN CC(C)CN(C(=O)c1cccc(-n2ccc(C(F)(F)F)n2)c1)C1CCN(C)CC1 ZINC000464571161 877791279 /nfs/dbraw/zinc/79/12/79/877791279.db2.gz QXIYKKZEZCMNKH-UHFFFAOYSA-N 0 3 408.468 4.084 20 0 HIADHN Cc1nn(C(C)(C)C)cc1[C@@H](C)NC[C@@H](O)COc1ccc(Cl)cc1Cl ZINC000464609764 877837231 /nfs/dbraw/zinc/83/72/31/877837231.db2.gz QFYRCMXMCBCJPV-IUODEOHRSA-N 0 3 400.350 4.344 20 0 HIADHN Cc1nn(C(C)(C)C)cc1[C@H](C)NC[C@H](O)COc1ccc(Cl)cc1Cl ZINC000464609766 877837975 /nfs/dbraw/zinc/83/79/75/877837975.db2.gz QFYRCMXMCBCJPV-WFASDCNBSA-N 0 3 400.350 4.344 20 0 HIADHN Cc1nn(C(C)(C)C)cc1[C@H](C)NC[C@@H](O)COc1cc(Cl)ccc1Cl ZINC000464632557 877850075 /nfs/dbraw/zinc/85/00/75/877850075.db2.gz XWFMSVNOLCWGNE-SWLSCSKDSA-N 0 3 400.350 4.344 20 0 HIADHN Cc1oc2ccccc2c1CC(=O)NCCCCN1CCN(c2ccccc2)CC1 ZINC000464643415 877862161 /nfs/dbraw/zinc/86/21/61/877862161.db2.gz NBYOEFQPMPSCHU-UHFFFAOYSA-N 0 3 405.542 4.002 20 0 HIADHN Cc1oc2ccccc2c1C(=O)NCCCCN1CCN(Cc2ccccc2)CC1 ZINC000464653351 877873869 /nfs/dbraw/zinc/87/38/69/877873869.db2.gz PMTAOQVJSJOZDT-UHFFFAOYSA-N 0 3 405.542 4.069 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N3C[C@@H](C)Oc4ccc(Cl)cc43)cc2)CC1 ZINC000464672689 877891314 /nfs/dbraw/zinc/89/13/14/877891314.db2.gz WEIOEKJLXLNYTI-QGZVFWFLSA-N 0 3 413.949 4.298 20 0 HIADHN Cc1cccc(S(=O)(=O)CCCN(C)[C@H]2CCN(Cc3ccccc3)[C@H](C)C2)c1 ZINC000464680401 877896514 /nfs/dbraw/zinc/89/65/14/877896514.db2.gz ZKZDUYMAONFDBC-GGAORHGYSA-N 0 3 414.615 4.144 20 0 HIADHN CC[C@H]1CCCCN1CCNC(=O)C(=O)Nc1cc(Cl)ccc1SC(C)C ZINC000503317223 912296858 /nfs/dbraw/zinc/29/68/58/912296858.db2.gz SNIUSMLNWIUFNH-INIZCTEOSA-N 0 3 411.999 4.160 20 0 HIADHN CCS[C@@H]1CC[C@@H](N(C)CC(=O)N[C@@H](c2ccc3c(c2)OCCCO3)C(C)C)C1 ZINC000464766539 878009295 /nfs/dbraw/zinc/00/92/95/878009295.db2.gz ALKSAJHDZNHPTI-DNVFCKCGSA-N 0 3 420.619 4.267 20 0 HIADHN CCN(CC(=O)Nc1ccc(OC)cc1OC)[C@@H](Cc1ccc(F)cc1)C(C)C ZINC000464766999 878009741 /nfs/dbraw/zinc/00/97/41/878009741.db2.gz BLUTXSNTOJCSRD-NRFANRHFSA-N 0 3 402.510 4.371 20 0 HIADHN CCN(CC(=O)Nc1ccc(C(=O)N(C)C)cc1)[C@H](Cc1ccc(F)cc1)C(C)C ZINC000464768465 878010414 /nfs/dbraw/zinc/01/04/14/878010414.db2.gz ASALOIXLWZZZFC-JOCHJYFZSA-N 0 3 413.537 4.055 20 0 HIADHN CC(C)[C@H](Cc1ccc(F)cc1)N(C)CC(=O)Nc1ccnn1Cc1cccs1 ZINC000464789092 878035775 /nfs/dbraw/zinc/03/57/75/878035775.db2.gz NVYIWHKTVGKQRX-FQEVSTJZSA-N 0 3 414.550 4.270 20 0 HIADHN CCc1ccc([C@@H]2C[C@@H](C)CCN2C[C@H](O)COc2ccc(NC(C)=O)cc2)o1 ZINC000464856250 878137610 /nfs/dbraw/zinc/13/76/10/878137610.db2.gz UPWTUFFPBJIHDD-BPXKWBHBSA-N 0 3 400.519 4.013 20 0 HIADHN COc1ccc([C@H](CNC(=O)CN2C[C@H]3CCC[C@@H]3C2)c2c[nH]c3ccccc32)cc1 ZINC000464877354 878169072 /nfs/dbraw/zinc/16/90/72/878169072.db2.gz JEJLCGCAZJIAJN-VIZSFHNOSA-N 0 3 417.553 4.157 20 0 HIADHN COc1cc(-c2nnc(CNC(C)(C)CCc3ccccc3)o2)cc(OC)c1OC ZINC000464883283 878178141 /nfs/dbraw/zinc/17/81/41/878178141.db2.gz BYISBGHWMAZGNT-UHFFFAOYSA-N 0 3 411.502 4.263 20 0 HIADHN CC(=O)CCc1ccc(O[C@@H](C)C(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)cc1 ZINC000464890061 878189763 /nfs/dbraw/zinc/18/97/63/878189763.db2.gz GYPMLWSWJHOCHA-IRLDBZIGSA-N 0 3 422.569 4.099 20 0 HIADHN C[C@@H]1CCN(C(=O)c2cnn(-c3ccc(Cl)cc3)c2)CCN1Cc1ccccc1 ZINC000464891197 878190964 /nfs/dbraw/zinc/19/09/64/878190964.db2.gz JHVAPUGFAGJHDA-GOSISDBHSA-N 0 3 408.933 4.262 20 0 HIADHN C[C@H]1CCN(C(=O)CCc2ncc(-c3ccccc3)o2)CCN1Cc1ccccc1 ZINC000464898098 878202750 /nfs/dbraw/zinc/20/27/50/878202750.db2.gz HBNQDLLEJHHAME-FQEVSTJZSA-N 0 3 403.526 4.397 20 0 HIADHN CC(=O)c1cccc(OCCCC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)c1 ZINC000464903204 878213653 /nfs/dbraw/zinc/21/36/53/878213653.db2.gz VAUVEKFONFCFAW-FQEVSTJZSA-N 0 3 408.542 4.171 20 0 HIADHN C[C@H]1CCN(C(=O)c2cc(F)cc(Br)c2)CCN1Cc1ccccc1 ZINC000464903170 878213723 /nfs/dbraw/zinc/21/37/23/878213723.db2.gz UTEVPBMERUINRY-HNNXBMFYSA-N 0 3 405.311 4.325 20 0 HIADHN Cc1noc2nc(C(C)C)cc(C(=O)N3CC[C@@H](C)N(Cc4ccccc4)CC3)c12 ZINC000464902726 878214701 /nfs/dbraw/zinc/21/47/01/878214701.db2.gz BFGYKNBSPCSOJI-QGZVFWFLSA-N 0 3 406.530 4.391 20 0 HIADHN COc1cc(C(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)ccc1OC(F)F ZINC000464910692 878227553 /nfs/dbraw/zinc/22/75/53/878227553.db2.gz OQESKIMKIIUULH-MRXNPFEDSA-N 0 3 404.457 4.033 20 0 HIADHN Cc1ccc([C@H](NC(=O)N[C@H](CN(C)C)c2ccc(F)cc2)c2ccccn2)cc1 ZINC000503363766 912339753 /nfs/dbraw/zinc/33/97/53/912339753.db2.gz BHBJZARBFFVKCG-PKTZIBPZSA-N 0 3 406.505 4.221 20 0 HIADHN Cc1ccc(-c2nc(CNC(=O)[C@H]3CCCN(Cc4cccc(F)c4)C3)co2)cc1 ZINC000465199145 878603638 /nfs/dbraw/zinc/60/36/38/878603638.db2.gz YRCRBTJXUMIOGB-FQEVSTJZSA-N 0 3 407.489 4.318 20 0 HIADHN Cc1ccc2[nH]c(CNC(=O)NC[C@@H](c3cccs3)N3CCC(C)CC3)nc2c1 ZINC000465421865 878850904 /nfs/dbraw/zinc/85/09/04/878850904.db2.gz HWKJKPLLELDMHJ-IBGZPJMESA-N 0 3 411.575 4.205 20 0 HIADHN Cc1ccc2nc(CNC(=O)NC[C@@H](c3cccs3)N3CCC(C)CC3)[nH]c2c1 ZINC000465421865 878850908 /nfs/dbraw/zinc/85/09/08/878850908.db2.gz HWKJKPLLELDMHJ-IBGZPJMESA-N 0 3 411.575 4.205 20 0 HIADHN CC1CCN([C@@H](CNC(=O)N2CCOC[C@H]2c2ccccc2)c2cccs2)CC1 ZINC000465423946 878852890 /nfs/dbraw/zinc/85/28/90/878852890.db2.gz SFOBGSUYVNIOQU-SFTDATJTSA-N 0 3 413.587 4.304 20 0 HIADHN CCO[C@H](C)c1nc(CN(C)C(=O)NC[C@@H](c2cccs2)N2CCCC2)cs1 ZINC000465430055 878861303 /nfs/dbraw/zinc/86/13/03/878861303.db2.gz XZORXXWWHYGZFA-WBVHZDCISA-N 0 3 422.620 4.281 20 0 HIADHN CO[C@@H](CNC(=O)NC[C@@H](c1cccs1)N1CCCC1)c1cccc(Cl)c1 ZINC000465432438 878863296 /nfs/dbraw/zinc/86/32/96/878863296.db2.gz XEDMOPOJNKJAHJ-ROUUACIJSA-N 0 3 407.967 4.225 20 0 HIADHN COc1ccc([C@H](C)CCNC(=O)NC[C@@H](c2cccs2)N2CCCC2)cc1 ZINC000465433613 878864630 /nfs/dbraw/zinc/86/46/30/878864630.db2.gz NXKLAMUZKNOQLY-XLIONFOSSA-N 0 3 401.576 4.387 20 0 HIADHN CO[C@@H](CNC(=O)NC[C@@H](c1ccccc1)N1CCCC1)c1cccc(Cl)c1 ZINC000465432631 878864963 /nfs/dbraw/zinc/86/49/63/878864963.db2.gz YANFPAFTENMXEF-SFTDATJTSA-N 0 3 401.938 4.164 20 0 HIADHN Cc1ccccc1[C@@H]1CN(C(=O)NC[C@H](c2cccs2)N2CCCC2)[C@@H](C)CO1 ZINC000465433453 878865032 /nfs/dbraw/zinc/86/50/32/878865032.db2.gz MYFASATZEHTUMR-TYPHKJRUSA-N 0 3 413.587 4.365 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)N1CC[C@@H](COCc2ccccc2)C1 ZINC000465436974 878869790 /nfs/dbraw/zinc/86/97/90/878869790.db2.gz FBOWUBLYGSRHCW-ISKFKSNPSA-N 0 3 407.558 4.072 20 0 HIADHN CN(C)[C@@H](CNC(=O)NCc1ccccc1CN(C)Cc1ccco1)c1ccccc1 ZINC000465449923 878880780 /nfs/dbraw/zinc/88/07/80/878880780.db2.gz WGRGBKAHCIFCRB-DEOSSOPVSA-N 0 3 420.557 4.014 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@@H](C)c1c(F)cccc1OC)c1cccc(OC)c1 ZINC000465465939 878899389 /nfs/dbraw/zinc/89/93/89/878899389.db2.gz ASFCWFUTDZERBM-OXJNMPFZSA-N 0 3 417.525 4.286 20 0 HIADHN COc1cccc([C@H](CNC(=O)N[C@H](C)c2c(F)cccc2OC)N2CCCC2)c1 ZINC000465467146 878901132 /nfs/dbraw/zinc/90/11/32/878901132.db2.gz OBEVYXXZIAZYNA-UZLBHIALSA-N 0 3 415.509 4.040 20 0 HIADHN Cc1ccc(C)c(NC(=O)Cc2nc(CN[C@H]3CCCC34CCOCC4)cs2)c1 ZINC000503413437 912397065 /nfs/dbraw/zinc/39/70/65/912397065.db2.gz SMJIAGCKMDDVQY-FQEVSTJZSA-N 0 3 413.587 4.380 20 0 HIADHN COc1cccc([C@H](CNC(=O)N[C@H](c2ncc(C)s2)C2CC2)N2CCCC2)c1 ZINC000465477327 878915788 /nfs/dbraw/zinc/91/57/88/878915788.db2.gz LQCKETQFCQJWCK-PMACEKPBSA-N 0 3 414.575 4.048 20 0 HIADHN COc1cccc([C@@H](CNC(=O)NC[C@@H](C)c2ccc(F)cc2F)N2CCCC2)c1 ZINC000465482106 878921999 /nfs/dbraw/zinc/92/19/99/878921999.db2.gz WXBFBHPVBJQJEX-OPAMFIHVSA-N 0 3 417.500 4.213 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N(Cc1ccc(O)cc1)CC1CC1)c1ccsc1 ZINC000465521670 878971940 /nfs/dbraw/zinc/97/19/40/878971940.db2.gz ITDZXAXKQODLSC-OAQYLSRUSA-N 0 3 401.576 4.458 20 0 HIADHN Cc1ccc([C@H]2OCCC[C@H]2CNC(=O)NCCCN2CCc3ccccc3C2)cc1 ZINC000465535227 878993573 /nfs/dbraw/zinc/99/35/73/878993573.db2.gz XBFVECNSBQHNLM-UKILVPOCSA-N 0 3 421.585 4.210 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@H]2CNC(=O)NCCCN2CCc3ccccc3C2)cc1 ZINC000465535228 878994832 /nfs/dbraw/zinc/99/48/32/878994832.db2.gz XBFVECNSBQHNLM-ZCYQVOJMSA-N 0 3 421.585 4.210 20 0 HIADHN C[C@@H](OCCCNC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1)c1ccccc1 ZINC000465609780 879106377 /nfs/dbraw/zinc/10/63/77/879106377.db2.gz VIVDPJBZWXBHEM-FCHUYYIVSA-N 0 3 409.574 4.460 20 0 HIADHN Cc1ccc(-c2nc(CNC(=O)N[C@H](CN3CCCC3)c3ccccc3)co2)cc1 ZINC000465612099 879110062 /nfs/dbraw/zinc/11/00/62/879110062.db2.gz XTCSOFBIOWRSMB-JOCHJYFZSA-N 0 3 404.514 4.286 20 0 HIADHN CN(C)CCN(C[C@@H]1CCCO1)C(=O)N[C@H](CCc1ccccc1)c1ccccc1 ZINC000465649096 879169165 /nfs/dbraw/zinc/16/91/65/879169165.db2.gz BJNDDUSTQXVPNP-BJKOFHAPSA-N 0 3 409.574 4.113 20 0 HIADHN CN(C)CCN(C[C@@H]1CCCO1)C(=O)N[C@@H](CCc1ccccc1)c1ccccc1 ZINC000465649099 879169500 /nfs/dbraw/zinc/16/95/00/879169500.db2.gz BJNDDUSTQXVPNP-ZEQRLZLVSA-N 0 3 409.574 4.113 20 0 HIADHN C[C@@H]1CCN(C(=O)NCc2csc(Br)c2)CCN1Cc1ccccc1 ZINC000465661870 879192046 /nfs/dbraw/zinc/19/20/46/879192046.db2.gz JKYMARCAFJOWDL-OAHLLOKOSA-N 0 3 422.392 4.317 20 0 HIADHN CCc1nc(C)c([C@@H](C)N(C)C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)s1 ZINC000465695920 879252578 /nfs/dbraw/zinc/25/25/78/879252578.db2.gz SKMGGJOGAVSIEC-IEBWSBKVSA-N 0 3 400.592 4.381 20 0 HIADHN C[C@@H](NC(=O)NCC(C)(C)N1CCc2ccccc2C1)c1ccc(-n2cccn2)cc1 ZINC000465697193 879255151 /nfs/dbraw/zinc/25/51/51/879255151.db2.gz SOQCNUOETMZBCQ-LJQANCHMSA-N 0 3 417.557 4.069 20 0 HIADHN C[C@@H](CNC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1)COCc1ccccc1 ZINC000465757842 879352540 /nfs/dbraw/zinc/35/25/40/879352540.db2.gz PWMPDRSCZKDJFC-VXKWHMMOSA-N 0 3 409.574 4.145 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)NCCc2c[nH]c3ccc(Cl)cc23)C1 ZINC000465765093 879362480 /nfs/dbraw/zinc/36/24/80/879362480.db2.gz VAWQIESTARWBES-UZLBHIALSA-N 0 3 410.949 4.499 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N[C@@H](C)c2nc(-c3cccc(F)c3)no2)C1 ZINC000465767073 879364917 /nfs/dbraw/zinc/36/49/17/879364917.db2.gz YRFPGIRANRCIML-RZQQEMMASA-N 0 3 423.492 4.071 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N(Cc2cc[nH]n2)Cc2ccccc2)N2CCCC2)cc1 ZINC000465806823 879420612 /nfs/dbraw/zinc/42/06/12/879420612.db2.gz HIKVAYXWFGFXLE-XMMPIXPASA-N 0 3 417.557 4.267 20 0 HIADHN CCC[C@H](NC(=O)NC[C@H](C)CN1CCN(C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000465824987 879453198 /nfs/dbraw/zinc/45/31/98/879453198.db2.gz AMWAUNFANAVXIV-KXBFYZLASA-N 0 3 415.409 4.017 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N(Cc2ccc(O)cc2)CC2CC2)N2CCCC2)cc1 ZINC000465825459 879455266 /nfs/dbraw/zinc/45/52/66/879455266.db2.gz FJQZDVDSTUVHTG-DEOSSOPVSA-N 0 3 407.558 4.459 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N[C@H](C)c2ccc(-n3cccn3)cc2)N2CCCC2)cc1 ZINC000465825106 879456146 /nfs/dbraw/zinc/45/61/46/879456146.db2.gz BHWOYTQOYBGCFG-YKSBVNFPSA-N 0 3 417.557 4.378 20 0 HIADHN Cc1cccc(Oc2ccccc2CNC(=O)N(CCN(C)C)C[C@H]2CCCO2)c1 ZINC000465865807 879514701 /nfs/dbraw/zinc/51/47/01/879514701.db2.gz SCPRDNGRIWGSGA-JOCHJYFZSA-N 0 3 411.546 4.040 20 0 HIADHN CC[C@H](NC(=O)NC[C@@H](C)N(C)Cc1ccccc1)c1nc(C(F)(F)F)cs1 ZINC000465865919 879517239 /nfs/dbraw/zinc/51/72/39/879517239.db2.gz AWLRURQPMUVLAP-HIFRSBDPSA-N 0 3 414.497 4.433 20 0 HIADHN CN(C)CCN(C[C@@H]1CCCO1)C(=O)N[C@@H](c1ccc(Cl)cc1)C1CCCC1 ZINC000465890264 879545539 /nfs/dbraw/zinc/54/55/39/879545539.db2.gz LMWAQTIUMDHMLY-LEWJYISDSA-N 0 3 407.986 4.324 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)N[C@H](c2ccc(Cl)cc2)C2CCCC2)CC1 ZINC000465903909 879565243 /nfs/dbraw/zinc/56/52/43/879565243.db2.gz XURFZDGZQHBXBT-AVRDEDQJSA-N 0 3 421.029 4.144 20 0 HIADHN C[C@H]1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CCN1Cc1ccccc1 ZINC000465910408 879571490 /nfs/dbraw/zinc/57/14/90/879571490.db2.gz ZGKUOZHNCMRWQB-FQEVSTJZSA-N 0 3 404.558 4.407 20 0 HIADHN C[C@@H](NC(=O)NC[C@@H]1CCCN1Cc1ccccc1)c1nc(C2CCCCC2)no1 ZINC000465921832 879583997 /nfs/dbraw/zinc/58/39/97/879583997.db2.gz ANTNSPKJQCUTGK-XLIONFOSSA-N 0 3 411.550 4.142 20 0 HIADHN COc1ccc([C@@H](NC(=O)N[C@@H]2CCN(C3CC3)C2)c2ccccc2Cl)c(C)c1 ZINC000466017432 879700227 /nfs/dbraw/zinc/70/02/27/879700227.db2.gz NGEDCQVPNWLYBV-OPAMFIHVSA-N 0 3 413.949 4.282 20 0 HIADHN COc1ccc([C@H](C)CCNC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)cc1 ZINC000466055975 879748184 /nfs/dbraw/zinc/74/81/84/879748184.db2.gz ODAYVOHMYVEHJU-NHCUHLMSSA-N 0 3 409.574 4.495 20 0 HIADHN CC[C@H](C)[C@@H](NC(=O)NC[C@@H](C)CN1CCN(CC)CC1)c1ccc(Cl)cc1 ZINC000466085599 879804900 /nfs/dbraw/zinc/80/49/00/879804900.db2.gz MZAKKTGXUNPCHF-LVCYWYKZSA-N 0 3 409.018 4.000 20 0 HIADHN CCCN(C(=O)N[C@H]1CCc2c1cccc2O)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000466095359 879814015 /nfs/dbraw/zinc/81/40/15/879814015.db2.gz OFCVGYIBTULJFK-OFNKIYASSA-N 0 3 407.558 4.466 20 0 HIADHN COCCN(CCN(C)C)C(=O)N[C@@H](c1ccc(F)c(C)c1)c1ccccc1Cl ZINC000466101411 879818804 /nfs/dbraw/zinc/81/88/04/879818804.db2.gz KPXKTJFTOVKACO-NRFANRHFSA-N 0 3 421.944 4.097 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)N(C)[C@H](C)c2ccc(-c3ccccc3)cc2)CC1 ZINC000466111190 879825456 /nfs/dbraw/zinc/82/54/56/879825456.db2.gz YCUKYBBWXILHQF-FCHUYYIVSA-N 0 3 422.617 4.330 20 0 HIADHN CC1CCN([C@H](CNC(=O)N(C)Cc2cc(Cl)cn2C)c2cccs2)CC1 ZINC000466145640 879855077 /nfs/dbraw/zinc/85/50/77/879855077.db2.gz QBVIRJBRXHTWQB-GOSISDBHSA-N 0 3 408.999 4.355 20 0 HIADHN C[C@H](CNC(=O)N(CCN(C)C)Cc1cccc(Cl)c1)Oc1ccccc1F ZINC000466163135 879866083 /nfs/dbraw/zinc/86/60/83/879866083.db2.gz GYJQGFFMFDRASV-MRXNPFEDSA-N 0 3 407.917 4.020 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)NCCc1c[nH]c2ccc(Cl)cc12 ZINC000466168585 879870182 /nfs/dbraw/zinc/87/01/82/879870182.db2.gz HKGSYJSIPSOXII-UHFFFAOYSA-N 0 3 416.928 4.276 20 0 HIADHN C[C@H](CNC(=O)N1CCCN(Cc2ccccc2)CC1)Oc1ccccc1Cl ZINC000466168871 879870610 /nfs/dbraw/zinc/87/06/10/879870610.db2.gz QVCQUQBQLPBJLC-GOSISDBHSA-N 0 3 401.938 4.025 20 0 HIADHN O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCCN(Cc2ccccc2)CC1 ZINC000466170665 879871940 /nfs/dbraw/zinc/87/19/40/879871940.db2.gz NLCYBHZKOXTNGF-UHFFFAOYSA-N 0 3 410.949 4.281 20 0 HIADHN COc1ccc(C(C)(C)C(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)cc1OC ZINC000466238592 879946130 /nfs/dbraw/zinc/94/61/30/879946130.db2.gz QTRJJMOJCAMOMB-IBGZPJMESA-N 0 3 410.558 4.104 20 0 HIADHN COc1ccc([C@H](NC(=O)N2CCN(C)CC[C@@H]2C)c2ccccc2Cl)c(C)c1 ZINC000466385237 880144815 /nfs/dbraw/zinc/14/48/15/880144815.db2.gz BWUYWFBFFVCRGI-JTSKRJEESA-N 0 3 415.965 4.482 20 0 HIADHN C[C@@H](CCNC(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1)c1ccccc1 ZINC000466389858 880150320 /nfs/dbraw/zinc/15/03/20/880150320.db2.gz RSLDMWXLWOLBJV-PWRODBHTSA-N 0 3 401.595 4.101 20 0 HIADHN O=C(N[C@@H]1CCSC1)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000466403851 880170995 /nfs/dbraw/zinc/17/09/95/880170995.db2.gz HVLHQBIVZWWQMS-OAHLLOKOSA-N 0 3 402.391 4.106 20 0 HIADHN CN(CCC1CCOCC1)CC(=O)N[C@@H](c1ccccc1)c1cccc(Cl)c1 ZINC000466480340 880262793 /nfs/dbraw/zinc/26/27/93/880262793.db2.gz FABNOPHLSCGPPA-QHCPKHFHSA-N 0 3 400.950 4.294 20 0 HIADHN CN(CCC1CCOCC1)CC(=O)N[C@H](c1ccccc1)c1ccc(Cl)cc1 ZINC000466485444 880264939 /nfs/dbraw/zinc/26/49/39/880264939.db2.gz ULFHFZUNAWOTMC-HSZRJFAPSA-N 0 3 400.950 4.294 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)N2CC=C(c3c[nH]c4ncccc34)CC2)CN1Cc1ccccc1 ZINC000466519263 880295704 /nfs/dbraw/zinc/29/57/04/880295704.db2.gz PJFJJLUXCBFUSU-GHTZIAJQSA-N 0 3 415.541 4.025 20 0 HIADHN CCO[C@H](C)c1nc(CN(C)C(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)cs1 ZINC000466537158 880311137 /nfs/dbraw/zinc/31/11/37/880311137.db2.gz VOGWPVCOLWNVGG-YQVWRLOYSA-N 0 3 416.591 4.045 20 0 HIADHN O=C(CC1(N2CCOCC2)CCCC1)N1CCC(F)(c2ccc(Cl)cc2)CC1 ZINC000466546289 880319877 /nfs/dbraw/zinc/31/98/77/880319877.db2.gz SKWMCEAGYCLYIP-UHFFFAOYSA-N 0 3 408.945 4.162 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCC[C@@H]1c1ccc(COC)o1)c1ccsc1 ZINC000466574296 880349902 /nfs/dbraw/zinc/34/99/02/880349902.db2.gz PCSVKLMSRYHJNY-RTBURBONSA-N 0 3 405.564 4.417 20 0 HIADHN CCCN1CCC[C@@H]1C(=O)N[C@@H](C)c1cccc(NC(=O)Cc2ccccc2F)c1 ZINC000503521565 912569821 /nfs/dbraw/zinc/56/98/21/912569821.db2.gz OWJPGDJQJNYNIT-HTAPYJJXSA-N 0 3 411.521 4.059 20 0 HIADHN C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)N(C)CCCCCc1cc(-c2ccccc2)no1 ZINC000466777083 880555764 /nfs/dbraw/zinc/55/57/64/880555764.db2.gz MGMSNPWLZMMRFK-WZONZLPQSA-N 0 3 410.562 4.179 20 0 HIADHN CSc1ccc([C@@H](C)NC(=O)N(C)C2CCN(CCc3ccccn3)CC2)cc1 ZINC000466833365 880602018 /nfs/dbraw/zinc/60/20/18/880602018.db2.gz GLKKXNXIACNITB-GOSISDBHSA-N 0 3 412.603 4.213 20 0 HIADHN COc1cc(CNCCN2CCc3ccccc3C2=O)ccc1OCc1ccccc1 ZINC000466895270 880663742 /nfs/dbraw/zinc/66/37/42/880663742.db2.gz YNJOYDOANYDNLJ-UHFFFAOYSA-N 0 3 416.521 4.062 20 0 HIADHN Cc1nc(CNC(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)sc1C ZINC000466967900 880762790 /nfs/dbraw/zinc/76/27/90/880762790.db2.gz SUZBEIKVIQOTDY-UHFFFAOYSA-N 0 3 414.497 4.052 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)C2(c3cccc(Cl)c3)CCOCC2)CN1Cc1ccccc1 ZINC000467029352 880828358 /nfs/dbraw/zinc/82/83/58/880828358.db2.gz SSFYPZISPXIIRZ-GCJKJVERSA-N 0 3 412.961 4.167 20 0 HIADHN C[C@H]1C[C@H](NC(=O)CCc2cc(Br)cs2)CN1Cc1ccccc1 ZINC000467044738 880839719 /nfs/dbraw/zinc/83/97/19/880839719.db2.gz IDAQBVXGXAIOKS-YOEHRIQHSA-N 0 3 407.377 4.222 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)CCc2nc(-c3ccc(Cl)cc3)no2)CN1Cc1ccccc1 ZINC000467053933 880844356 /nfs/dbraw/zinc/84/43/56/880844356.db2.gz NZTAOSOZLMXXSW-UZLBHIALSA-N 0 3 424.932 4.102 20 0 HIADHN O=C([C@H]1CCCc2n[nH]cc21)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000467104039 880864154 /nfs/dbraw/zinc/86/41/54/880864154.db2.gz XIHNYFUMFRDCPQ-INIZCTEOSA-N 0 3 421.372 4.261 20 0 HIADHN COCCOc1c(Cl)cccc1NC(=O)N[C@@H]1C[C@H](C)N(Cc2ccccc2)C1 ZINC000467113083 880872241 /nfs/dbraw/zinc/87/22/41/880872241.db2.gz OYFGHMQVOIJQIE-FUHWJXTLSA-N 0 3 417.937 4.150 20 0 HIADHN COC[C@H]1CCCCN(CC(=O)N[C@H](c2ccccc2)c2ccc(Cl)cc2)C1 ZINC000467117757 880874561 /nfs/dbraw/zinc/87/45/61/880874561.db2.gz GNKPUKDODFOFLU-FDDCHVKYSA-N 0 3 400.950 4.294 20 0 HIADHN COC[C@@H]1CCCCN([C@H](C)C(=O)Nc2cccc(CSc3ccccn3)c2)C1 ZINC000467121821 880877402 /nfs/dbraw/zinc/87/74/02/880877402.db2.gz GXYXQDXMPQPQRS-UYAOXDASSA-N 0 3 413.587 4.449 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)NCc1nc(-c2ccccc2F)cs1)c1ccco1 ZINC000503550771 912618673 /nfs/dbraw/zinc/61/86/73/912618673.db2.gz IMIBTIYRVHXFIE-RHSMWYFYSA-N 0 3 416.522 4.471 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)NCc1nc(-c2ccccc2F)cs1)c1ccco1 ZINC000503550773 912619455 /nfs/dbraw/zinc/61/94/55/912619455.db2.gz IMIBTIYRVHXFIE-YOEHRIQHSA-N 0 3 416.522 4.471 20 0 HIADHN Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)N1CC[C@@H](N2CC=CC2)C1 ZINC000467276334 881021329 /nfs/dbraw/zinc/02/13/29/881021329.db2.gz AJQDWJKUDYOCET-HXUWFJFHSA-N 0 3 424.932 4.379 20 0 HIADHN Brc1cccc(CN(Cc2cnn3ccccc23)C2CCOCC2)c1 ZINC000467353283 881114109 /nfs/dbraw/zinc/11/41/09/881114109.db2.gz CIXFPZHXDFQMEP-UHFFFAOYSA-N 0 3 400.320 4.278 20 0 HIADHN CN(CC[C@H]1CCCO1)Cc1cc(Br)ccc1OCc1ccccn1 ZINC000467371434 881146083 /nfs/dbraw/zinc/14/60/83/881146083.db2.gz VHKILGNQPFYYTM-LJQANCHMSA-N 0 3 405.336 4.424 20 0 HIADHN CN(Cc1ccccc1Br)C(=O)CCN[C@H](c1cncc(F)c1)C1CC1 ZINC000467379598 881155378 /nfs/dbraw/zinc/15/53/78/881155378.db2.gz ANTLCIPJAPPXIB-FQEVSTJZSA-N 0 3 420.326 4.073 20 0 HIADHN Cc1cc(CN[C@H](C)c2ccc([S@@](C)=O)cc2)ccc1I ZINC000467380176 881158040 /nfs/dbraw/zinc/15/80/40/881158040.db2.gz CQCJPXZQOGYJAS-LRTDBIEQSA-N 0 3 413.324 4.188 20 0 HIADHN COc1cc2c(cc1OC)[C@H](NCc1ccc(I)c(C)c1)CC2 ZINC000467380978 881158119 /nfs/dbraw/zinc/15/81/19/881158119.db2.gz HORVHOOANHBRRM-QGZVFWFLSA-N 0 3 423.294 4.394 20 0 HIADHN CCC[C@@H](N[C@@H]1CCc2cc(F)c(OC)cc21)C(=O)N1CCc2sccc2C1 ZINC000467381623 881161172 /nfs/dbraw/zinc/16/11/72/881161172.db2.gz MGGQRSYPGSMJLE-RTBURBONSA-N 0 3 402.535 4.226 20 0 HIADHN CC(C)Sc1cc(Br)ccc1CNCCC(=O)NCc1cccnc1 ZINC000503575793 912656042 /nfs/dbraw/zinc/65/60/42/912656042.db2.gz JWCJPXHERYWRMT-UHFFFAOYSA-N 0 3 422.392 4.141 20 0 HIADHN CC(C)n1cnnc1-c1ccccc1NC(=O)N[C@@H]1C[C@@H](C)N(Cc2ccccc2)C1 ZINC000467466961 881280336 /nfs/dbraw/zinc/28/03/36/881280336.db2.gz TYMHGLICOVEGHB-UYAOXDASSA-N 0 3 418.545 4.311 20 0 HIADHN Cc1c(C(=O)NCc2ccccc2CN2CCC(O)CC2)sc2cccc(F)c12 ZINC000467490083 881307778 /nfs/dbraw/zinc/30/77/78/881307778.db2.gz NNSIELHYUKLELC-UHFFFAOYSA-N 0 3 412.530 4.236 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)C3(Cc4ccccc4F)CC3)CC2)c1 ZINC000467521471 881337387 /nfs/dbraw/zinc/33/73/87/881337387.db2.gz YTPOBABMOHNGND-UHFFFAOYSA-N 0 3 423.576 4.175 20 0 HIADHN COC(=O)[C@](C)(CN[C@H](C)C(=O)Nc1ccc(Cl)cc1Cl)c1ccccc1 ZINC000469066511 883143514 /nfs/dbraw/zinc/14/35/14/883143514.db2.gz SUBDVDJGPGIJFP-ZUOKHONESA-N 0 3 409.313 4.041 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)N3C[C@H](c4ccc(F)cc4)C[C@@H]3C)CC2)c1 ZINC000469095750 883185112 /nfs/dbraw/zinc/18/51/12/883185112.db2.gz VGSVIKRWNBEICZ-RBBKRZOGSA-N 0 3 409.549 4.051 20 0 HIADHN C[C@H](N[C@H]1CCCN(Cc2ccc(F)cc2F)C1=O)c1cccc(OC(F)F)c1 ZINC000469104087 883195244 /nfs/dbraw/zinc/19/52/44/883195244.db2.gz WSTDZOMHRIDBNO-DJJJIMSYSA-N 0 3 410.411 4.408 20 0 HIADHN CC(C)N1CCC(N(C)S(=O)(=O)c2cc(Cl)ccc2OCC2CCC2)CC1 ZINC000469140955 883237629 /nfs/dbraw/zinc/23/76/29/883237629.db2.gz IPJGAHBEMRDAQJ-UHFFFAOYSA-N 0 3 414.999 4.012 20 0 HIADHN C[C@H](N[C@H]1CCCN(Cc2ccc(F)cc2F)C1=O)c1ccc2ncsc2c1 ZINC000469154357 883252138 /nfs/dbraw/zinc/25/21/38/883252138.db2.gz YTYYRYDGYIWCHR-DJJJIMSYSA-N 0 3 401.482 4.416 20 0 HIADHN CCN1CCN(c2ccc(C(=O)NC3(c4cccc(C(F)(F)F)c4)CC3)cc2)CC1 ZINC000469170985 883268728 /nfs/dbraw/zinc/26/87/28/883268728.db2.gz UJGZVEWSNVFMOA-UHFFFAOYSA-N 0 3 417.475 4.266 20 0 HIADHN COC(=O)[C@@](C)(CN[C@H](C)C(=O)Nc1c(C)cc(C)cc1Cl)c1ccccc1 ZINC000469188176 883286954 /nfs/dbraw/zinc/28/69/54/883286954.db2.gz CTACYSITGHZBAT-ZHRRBRCNSA-N 0 3 402.922 4.004 20 0 HIADHN O=C(NCC1(c2cc(C(F)(F)F)ccc2Cl)CC1)N1CC[C@@H](N2CC=CC2)C1 ZINC000469214118 883315160 /nfs/dbraw/zinc/31/51/60/883315160.db2.gz GOMIEWOIMRUGTN-OAHLLOKOSA-N 0 3 413.871 4.046 20 0 HIADHN CCc1n[nH]c(C(=O)N(CC)[C@@H]2CCN([C@@H](C)c3ccccc3)C2)c1Br ZINC000469225236 883324170 /nfs/dbraw/zinc/32/41/70/883324170.db2.gz JEQCAXJFPHDNCX-GOEBONIOSA-N 0 3 419.367 4.032 20 0 HIADHN COCc1ccc([C@H]2CCCN2C(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)o1 ZINC000469264041 883360697 /nfs/dbraw/zinc/36/06/97/883360697.db2.gz QQVJNWNVAHUFIM-GHTZIAJQSA-N 0 3 400.494 4.141 20 0 HIADHN O=C1[C@H](NCc2ccc(Br)cc2)CCCN1Cc1ccc(F)cc1F ZINC000469291314 883388560 /nfs/dbraw/zinc/38/85/60/883388560.db2.gz ZSOVXOONTGQICA-GOSISDBHSA-N 0 3 409.274 4.008 20 0 HIADHN CCCn1c(C(=O)Nc2cccc(CN3CCC(C(N)=O)CC3)c2)cc2ccccc21 ZINC000469310768 883410150 /nfs/dbraw/zinc/41/01/50/883410150.db2.gz IEPSCGXUMOYFTE-UHFFFAOYSA-N 0 3 418.541 4.001 20 0 HIADHN COc1cccc([C@@H](C)CCCC(=O)N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)c1 ZINC000469318130 883421120 /nfs/dbraw/zinc/42/11/20/883421120.db2.gz XBWFSHWSBRGLIF-PCCBWWKXSA-N 0 3 416.606 4.317 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N[C@H]3C[C@H]3c3ccccc3C(F)(F)F)cc2)CC1 ZINC000469322856 883428659 /nfs/dbraw/zinc/42/86/59/883428659.db2.gz SBXATQKZEBZOFT-FPOVZHCZSA-N 0 3 417.475 4.133 20 0 HIADHN COc1ccc(-c2nc(C)c(C(=O)N(CC(C)C)C3CCN(C)CC3)s2)c(F)c1 ZINC000503618414 912716815 /nfs/dbraw/zinc/71/68/15/912716815.db2.gz SEBUVMYVXLGETB-UHFFFAOYSA-N 0 3 419.566 4.459 20 0 HIADHN CN(C)Cc1cccc(C(=O)Nc2ccc(C(=O)Nc3cccnc3)c(Cl)c2)c1 ZINC000469397416 883558669 /nfs/dbraw/zinc/55/86/69/883558669.db2.gz KMEHNNCBAMAMRM-UHFFFAOYSA-N 0 3 408.889 4.301 20 0 HIADHN CC(=O)Nc1cccc([C@@H](C)NC(=O)N[C@@H](CN(C)Cc2ccccc2)C(C)C)c1 ZINC000469420331 883596775 /nfs/dbraw/zinc/59/67/75/883596775.db2.gz OQKNPTGDFMBYNH-JPYJTQIMSA-N 0 3 410.562 4.162 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)NC[C@@H]1CCO[C@H]1c1ccccc1 ZINC000469436282 883623885 /nfs/dbraw/zinc/62/38/85/883623885.db2.gz LNMOVEQEHGRKGL-HJOGWXRNSA-N 0 3 409.574 4.220 20 0 HIADHN CC(=O)Nc1ccc(F)c(NC(=O)N[C@H](CN(C)Cc2ccccc2)C(C)C)c1 ZINC000469469171 883693951 /nfs/dbraw/zinc/69/39/51/883693951.db2.gz RVRRWBBTQMJPBW-OAQYLSRUSA-N 0 3 400.498 4.062 20 0 HIADHN CCN(CC)C(=O)c1ccc(C(=O)N[C@H](CN(C)Cc2ccccc2)C(C)C)cc1 ZINC000469478798 883710577 /nfs/dbraw/zinc/71/05/77/883710577.db2.gz XIZJYUFRXGNVHX-HSZRJFAPSA-N 0 3 409.574 4.055 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)CCc1nnc(-c2ccsc2)o1 ZINC000469505618 883754784 /nfs/dbraw/zinc/75/47/84/883754784.db2.gz VWUSYQPVSMVRAX-LJQANCHMSA-N 0 3 412.559 4.004 20 0 HIADHN Cn1cc(-c2cc(CN3CCC[C@H](c4nc(-c5ccc(Cl)cc5)no4)C3)on2)cn1 ZINC000469520005 883786481 /nfs/dbraw/zinc/78/64/81/883786481.db2.gz BWCXFRIRTKNDMV-HNNXBMFYSA-N 0 3 424.892 4.158 20 0 HIADHN CN(CCCCCc1cc(-c2ccccc2)n[nH]1)Cc1cc(-c2cnn(C)c2)no1 ZINC000469522221 883791666 /nfs/dbraw/zinc/79/16/66/883791666.db2.gz POUKBWOTZQEKQC-UHFFFAOYSA-N 0 3 404.518 4.310 20 0 HIADHN CCN1CCN(c2ccc(C(=O)NCCCO[C@@H]3CCCc4ccccc43)cc2)CC1 ZINC000469530115 883801402 /nfs/dbraw/zinc/80/14/02/883801402.db2.gz ZKXGCHYWZICNJS-RUZDIDTESA-N 0 3 421.585 4.043 20 0 HIADHN CC(C)n1c2ccccc2nc1[C@@H](C)NC(=O)CCN1CCN(c2ccccc2)CC1 ZINC000469552225 883811421 /nfs/dbraw/zinc/81/14/21/883811421.db2.gz POORONPXRMAFPC-HXUWFJFHSA-N 0 3 419.573 4.007 20 0 HIADHN CN(C)[C@H](CNc1cnn(Cc2ccccc2)c(=O)c1)c1cccc(C(F)(F)F)c1 ZINC000469554593 883812030 /nfs/dbraw/zinc/81/20/30/883812030.db2.gz QIEGVUMBAYOPBS-HXUWFJFHSA-N 0 3 416.447 4.025 20 0 HIADHN CN(C)[C@@H](CNCc1nccn1Cc1ccccc1)c1cccc(C(F)(F)F)c1 ZINC000469553588 883812278 /nfs/dbraw/zinc/81/22/78/883812278.db2.gz FGUUUXUIRGRPIY-FQEVSTJZSA-N 0 3 402.464 4.343 20 0 HIADHN CN(C)C(=O)c1cnc(NC[C@@H](c2cccc(C(F)(F)F)c2)N(C)C)c(Cl)c1 ZINC000469557868 883813690 /nfs/dbraw/zinc/81/36/90/883813690.db2.gz CSRWQDWKFUNDDZ-INIZCTEOSA-N 0 3 414.859 4.170 20 0 HIADHN COc1cc(OC)c(CNC[C@H](c2cccc(C(F)(F)F)c2)N(C)C)c(OC)c1 ZINC000469564299 883815629 /nfs/dbraw/zinc/81/56/29/883815629.db2.gz WRAHSAMDWMJUNV-GOSISDBHSA-N 0 3 412.452 4.124 20 0 HIADHN CCOc1cc(Cl)ccc1NC(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000469612960 883835065 /nfs/dbraw/zinc/83/50/65/883835065.db2.gz GXPVCUOEYBWABT-IYBDPMFKSA-N 0 3 409.958 4.092 20 0 HIADHN COc1ccccc1-n1c2ccccc2nc1NC(=O)c1cccc(CN(C)C)c1 ZINC000469619905 883837106 /nfs/dbraw/zinc/83/71/06/883837106.db2.gz HEGXUQVINWDMCU-UHFFFAOYSA-N 0 3 400.482 4.348 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)Nc1ccccc1O[C@@H]1CCOC1 ZINC000469661242 883855607 /nfs/dbraw/zinc/85/56/07/883855607.db2.gz MAKHTGLSTFOHPB-IRLDBZIGSA-N 0 3 411.546 4.132 20 0 HIADHN Cc1ccc(-c2nnco2)cc1NC(=O)N[C@H](CN(C)Cc1ccccc1)C(C)C ZINC000469674824 883863805 /nfs/dbraw/zinc/86/38/05/883863805.db2.gz LTRFYDGIXZENJL-OAQYLSRUSA-N 0 3 407.518 4.323 20 0 HIADHN O=C1[C@H](N2CCC(c3c[nH]c4ncccc34)CC2)CCCN1Cc1ccc(F)cc1F ZINC000469726474 883888151 /nfs/dbraw/zinc/88/81/51/883888151.db2.gz UHPDGSXDTZXXIG-JOCHJYFZSA-N 0 3 424.495 4.212 20 0 HIADHN CCC[C@@H]1C[C@@H](C(=O)Nc2c(C)cnn2[C@@H]2CCN(Cc3ccccc3)C2)CCO1 ZINC000503670190 912777472 /nfs/dbraw/zinc/77/74/72/912777472.db2.gz KNJMRALZSYCFAL-BHDDXSALSA-N 0 3 410.562 4.172 20 0 HIADHN CCC[C@@H]1C[C@H](C(=O)Nc2c(C)cnn2[C@H]2CCN(Cc3ccccc3)C2)CCO1 ZINC000503670191 912778438 /nfs/dbraw/zinc/77/84/38/912778438.db2.gz KNJMRALZSYCFAL-BHIFYINESA-N 0 3 410.562 4.172 20 0 HIADHN O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)c1cc(F)c(Cl)cc1Cl ZINC000469854565 884039805 /nfs/dbraw/zinc/03/98/05/884039805.db2.gz MQAYNCZGVKJOKS-OAHLLOKOSA-N 0 3 411.304 4.153 20 0 HIADHN Cc1nc(-c2ccccc2)ccc1C(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000469866034 884056280 /nfs/dbraw/zinc/05/62/80/884056280.db2.gz XCLYOYGFBUYTCO-HSZRJFAPSA-N 0 3 415.537 4.078 20 0 HIADHN O=C(NC[C@H]1CN(Cc2ccccc2)CCCO1)[C@@H](OC1CCCC1)c1ccccc1 ZINC000469874526 884064444 /nfs/dbraw/zinc/06/44/44/884064444.db2.gz WGMASYBXRMBVGJ-DQEYMECFSA-N 0 3 422.569 4.094 20 0 HIADHN O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)[C@@H](OC1CCCC1)c1ccccc1 ZINC000469874529 884065713 /nfs/dbraw/zinc/06/57/13/884065713.db2.gz WGMASYBXRMBVGJ-RPBOFIJWSA-N 0 3 422.569 4.094 20 0 HIADHN Brc1ccccc1-c1noc([C@H]2CCCN2CCN2CCCCC2)n1 ZINC000469980458 884194721 /nfs/dbraw/zinc/19/47/21/884194721.db2.gz CYPSJZHRZPBUOI-QGZVFWFLSA-N 0 3 405.340 4.122 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1cnccc1Oc1ccccc1 ZINC000503692400 912797416 /nfs/dbraw/zinc/79/74/16/912797416.db2.gz MZXNSIFDJPMGMY-UHFFFAOYSA-N 0 3 417.509 4.331 20 0 HIADHN CCCN(C(=O)N[C@H](CC)C1CCOCC1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470026681 884248956 /nfs/dbraw/zinc/24/89/56/884248956.db2.gz GNSJPYLOWBVOMD-XZOQPEGZSA-N 0 3 401.595 4.278 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1C[C@@H](C)O[C@@H](c2ccsc2)C1)c1ccsc1 ZINC000470042786 884284138 /nfs/dbraw/zinc/28/41/38/884284138.db2.gz OBJBKGUFZORXTK-ATZDWAIDSA-N 0 3 407.605 4.364 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)Nc1ccc(OCc2ccccc2)cc1 ZINC000503727361 912811843 /nfs/dbraw/zinc/81/18/43/912811843.db2.gz LALBMQHALGWZJF-UHFFFAOYSA-N 0 3 404.514 4.256 20 0 HIADHN CC[C@H](C)n1ncc(NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)c1C ZINC000470123751 884385842 /nfs/dbraw/zinc/38/58/42/884385842.db2.gz XQGLNMJTWRPVCR-JQRITLKVSA-N 0 3 401.477 4.089 20 0 HIADHN COc1ccc2c(c1NC(=O)NC1CC(N3CCC(C(F)(F)F)CC3)C1)CCC2 ZINC000470137744 884401902 /nfs/dbraw/zinc/40/19/02/884401902.db2.gz VIXPAFGCFMLOPH-UHFFFAOYSA-N 0 3 411.468 4.111 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)c1ccc(-c2ccccc2)[nH]c1=O ZINC000470162785 884438107 /nfs/dbraw/zinc/43/81/07/884438107.db2.gz LCIGBZBBMULSLG-QHCPKHFHSA-N 0 3 403.526 4.341 20 0 HIADHN Cc1ccc(C2(C(=O)N[C@H](CN(C)Cc3ccccc3)C(C)C)CCOCC2)cc1 ZINC000470164666 884440053 /nfs/dbraw/zinc/44/00/53/884440053.db2.gz WUVYJVDYNRXYCX-XMMPIXPASA-N 0 3 408.586 4.316 20 0 HIADHN OCCOC1CCN(Cc2ccc(Oc3cccc(Br)c3)cc2)CC1 ZINC000470173291 884453765 /nfs/dbraw/zinc/45/37/65/884453765.db2.gz AKHVKTXQEFCXCT-UHFFFAOYSA-N 0 3 406.320 4.215 20 0 HIADHN CCCCCn1cc(CNC(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)c(C)n1 ZINC000503806276 912828757 /nfs/dbraw/zinc/82/87/57/912828757.db2.gz WWZCCECSVKILEI-FQEVSTJZSA-N 0 3 411.594 4.188 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@H]2NC(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)cc1 ZINC000470262597 884609349 /nfs/dbraw/zinc/60/93/49/884609349.db2.gz BNJSFKCXGAGBMH-RPBOFIJWSA-N 0 3 421.585 4.176 20 0 HIADHN CC[C@H](NCC(=O)N[C@@H]1CCOc2ccccc21)c1cccc(Br)c1 ZINC000503918626 912864066 /nfs/dbraw/zinc/86/40/66/912864066.db2.gz ALJQEBBXXZGCFN-ZWKOTPCHSA-N 0 3 403.320 4.130 20 0 HIADHN O=C(CN[C@@H](Cc1ccc(F)cc1)c1ccccc1)N[C@@H]1CCOc2ccccc21 ZINC000503920178 912865025 /nfs/dbraw/zinc/86/50/25/912865025.db2.gz KXEQGGJIIJXFLN-PKTZIBPZSA-N 0 3 404.485 4.339 20 0 HIADHN C[C@@H]1CN(C2CCOCC2)CCN1C(=O)CC(Cc1ccccc1)Cc1ccccc1 ZINC000470473445 884865210 /nfs/dbraw/zinc/86/52/10/884865210.db2.gz LMTOLGHRPFJYHH-JOCHJYFZSA-N 0 3 420.597 4.190 20 0 HIADHN C[C@@H]1CN(C2CCOCC2)CCN1C(=O)C[C@H](Cc1ccccc1)c1ccccc1 ZINC000470480428 884868550 /nfs/dbraw/zinc/86/85/50/884868550.db2.gz UBLVUFNFCVJAGQ-QPPBQGQZSA-N 0 3 406.570 4.115 20 0 HIADHN C[C@@H](NC(=O)NCC1(N2CCSCC2)CCCC1)c1ccc(-c2ccncc2)cc1 ZINC000470487792 884875102 /nfs/dbraw/zinc/87/51/02/884875102.db2.gz QZECRAPMOSOLSS-LJQANCHMSA-N 0 3 424.614 4.470 20 0 HIADHN C[C@H]1CN(C2CCOCC2)CCN1C(=O)CC(Cc1ccccc1)Cc1ccccc1 ZINC000470492096 884879328 /nfs/dbraw/zinc/87/93/28/884879328.db2.gz LMTOLGHRPFJYHH-QFIPXVFZSA-N 0 3 420.597 4.190 20 0 HIADHN CN(C)Cc1cccc(NC(=O)C2(c3ccc(I)cc3)CC2)c1 ZINC000503973705 912891283 /nfs/dbraw/zinc/89/12/83/912891283.db2.gz GZCZNNMWJXKUCW-UHFFFAOYSA-N 0 3 420.294 4.023 20 0 HIADHN CN(C(=O)c1cccc(OCc2cscn2)c1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470655129 885076289 /nfs/dbraw/zinc/07/62/89/885076289.db2.gz CEVMXNUKZQJKCE-JOCHJYFZSA-N 0 3 421.566 4.459 20 0 HIADHN CC[C@H](C)n1ncc2c1nc(C)cc2C(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470656355 885079231 /nfs/dbraw/zinc/07/92/31/885079231.db2.gz HGYJELALZWJHLG-PZJWPPBQSA-N 0 3 419.573 4.447 20 0 HIADHN CC(C)c1n[nH]c(C(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)c1Br ZINC000470662649 885088177 /nfs/dbraw/zinc/08/81/77/885088177.db2.gz LMODIVIKFWWMGT-INIZCTEOSA-N 0 3 419.367 4.032 20 0 HIADHN Cc1cc(C(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)c(C)n1-c1nccs1 ZINC000470664595 885089706 /nfs/dbraw/zinc/08/97/06/885089706.db2.gz ZPBTYVVJBJPEEF-FQEVSTJZSA-N 0 3 408.571 4.287 20 0 HIADHN CC(C)N1CCC[C@H](NC(=O)c2ccc(SCc3cn4ccccc4n3)cc2)C1 ZINC000470669392 885097657 /nfs/dbraw/zinc/09/76/57/885097657.db2.gz KCXCTUPVXXOQBQ-IBGZPJMESA-N 0 3 408.571 4.229 20 0 HIADHN CN(C(=O)CCCc1nnc(-c2ccccc2)o1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470671952 885101127 /nfs/dbraw/zinc/10/11/27/885101127.db2.gz UDZGPUBDABTJAO-JOCHJYFZSA-N 0 3 418.541 4.182 20 0 HIADHN CCCN(CC)C(=O)c1ccc(C(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000470671290 885101163 /nfs/dbraw/zinc/10/11/63/885101163.db2.gz XMFTZWAIJVBWGN-XMMPIXPASA-N 0 3 421.585 4.295 20 0 HIADHN CCCN(CC)C(=O)c1ccc(C(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000470671288 885101458 /nfs/dbraw/zinc/10/14/58/885101458.db2.gz XMFTZWAIJVBWGN-DEOSSOPVSA-N 0 3 421.585 4.295 20 0 HIADHN O=C(c1ccc(Cl)cc1)N1CCCN(C[C@@H](O)Cc2ccc3ccccc3c2)CC1 ZINC000470720558 885164972 /nfs/dbraw/zinc/16/49/72/885164972.db2.gz WNEDCJDONCIBLA-DEOSSOPVSA-N 0 3 422.956 4.245 20 0 HIADHN CN(C(=O)NCCc1ccc2ccccc2n1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470720254 885165086 /nfs/dbraw/zinc/16/50/86/885165086.db2.gz RKSJCWQWASBPNY-QHCPKHFHSA-N 0 3 402.542 4.083 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)N(C)Cc2nc(C(F)(F)F)cs2)C1 ZINC000470722477 885169049 /nfs/dbraw/zinc/16/90/49/885169049.db2.gz JUCRVHHSQAILSD-ZFWWWQNUSA-N 0 3 412.481 4.139 20 0 HIADHN CN(Cc1cccc(OCc2ccccc2)c1)C[C@@H]1C[C@H](F)CN1Cc1ncccn1 ZINC000470818613 885306182 /nfs/dbraw/zinc/30/61/82/885306182.db2.gz AMDOWRHSRLSOKH-GOTSBHOMSA-N 0 3 420.532 4.100 20 0 HIADHN COc1cccc(C(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)c1OC(F)F ZINC000470820980 885309069 /nfs/dbraw/zinc/30/90/69/885309069.db2.gz LIKJATNOOZKDTP-QGZVFWFLSA-N 0 3 404.457 4.033 20 0 HIADHN CN(C(=O)c1cc(C2CC2)nn1-c1ccccc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470820423 885309727 /nfs/dbraw/zinc/30/97/27/885309727.db2.gz JEISQTIZVQUGHI-HSZRJFAPSA-N 0 3 414.553 4.486 20 0 HIADHN CCOC(=O)c1c2c(sc1NC(=O)[C@@H](C)c1cccnc1)C(C)(C)NC(C)(C)C2 ZINC000470829912 885320659 /nfs/dbraw/zinc/32/06/59/885320659.db2.gz GBLFUARAUXNKSO-ZDUSSCGKSA-N 0 3 415.559 4.221 20 0 HIADHN Cn1nc(C(F)F)c2cc(C(=O)N3C[C@@H]4CCCN4Cc4ccccc43)sc21 ZINC000470848096 885346199 /nfs/dbraw/zinc/34/61/99/885346199.db2.gz KBYTXUHDTQGTEC-ZDUSSCGKSA-N 0 3 402.470 4.197 20 0 HIADHN NC(=O)C1CCN(Cc2cccc(NC(=O)c3cc(F)ccc3-c3ccoc3)c2)CC1 ZINC000470848696 885346979 /nfs/dbraw/zinc/34/69/79/885346979.db2.gz MMSRUSRBPVODEJ-UHFFFAOYSA-N 0 3 421.472 4.035 20 0 HIADHN C[C@H](NC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1)c1ccc(-n2cccn2)cc1 ZINC000470892122 885387268 /nfs/dbraw/zinc/38/72/68/885387268.db2.gz KPIKKVFMIJGIDP-GBXCKJPGSA-N 0 3 417.557 4.239 20 0 HIADHN C[C@@H](NC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1)c1ccc(-n2cccn2)cc1 ZINC000470892123 885387923 /nfs/dbraw/zinc/38/79/23/885387923.db2.gz KPIKKVFMIJGIDP-HYBUGGRVSA-N 0 3 417.557 4.239 20 0 HIADHN Cc1sc(CNC(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)nc1C(C)C ZINC000470900867 885403788 /nfs/dbraw/zinc/40/37/88/885403788.db2.gz SVVRWSSHRKIOTM-IBGZPJMESA-N 0 3 400.592 4.381 20 0 HIADHN COc1ccccc1CN(Cc1cccs1)C(=O)NCCN1CCC(C)CC1 ZINC000470906443 885412753 /nfs/dbraw/zinc/41/27/53/885412753.db2.gz NJTWIGRZVHBSPA-UHFFFAOYSA-N 0 3 401.576 4.200 20 0 HIADHN Cc1cc(C)c(C(=O)N(C)C2CCN(Cc3ccccc3)CC2)c(OC2CCC2)n1 ZINC000470946358 885445784 /nfs/dbraw/zinc/44/57/84/885445784.db2.gz NULDMDQCSYJZTP-UHFFFAOYSA-N 0 3 407.558 4.366 20 0 HIADHN O=C1[C@H](N2CCCCC[C@H]2c2ccc(C(F)(F)F)cc2)CCN1C1CCOCC1 ZINC000471005109 885505088 /nfs/dbraw/zinc/50/50/88/885505088.db2.gz JSXIMUIFCLRQIS-VQTJNVASSA-N 0 3 410.480 4.402 20 0 HIADHN CCOc1cc(CN2CC[C@@H](c3ccc(C)cc3C)C2)nc2nc(C(F)(F)F)nn21 ZINC000471019779 885524909 /nfs/dbraw/zinc/52/49/09/885524909.db2.gz TXZXSFTZSXBRGK-OAHLLOKOSA-N 0 3 419.451 4.148 20 0 HIADHN COCCCC[C@@H](NCCN1c2cccc3cccc(c23)S1(=O)=O)c1ccccc1 ZINC000471026018 885531674 /nfs/dbraw/zinc/53/16/74/885531674.db2.gz SDMJLWDTRHTVPY-OAQYLSRUSA-N 0 3 424.566 4.496 20 0 HIADHN CSc1nc(-c2ccco2)nc(C)c1C(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C ZINC000471136319 885677787 /nfs/dbraw/zinc/67/77/87/885677787.db2.gz JQMCRUUSAWYEKR-HNAYVOBHSA-N 0 3 410.543 4.188 20 0 HIADHN O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)c1cc(F)ccc1-c1ccoc1 ZINC000471164753 885722464 /nfs/dbraw/zinc/72/24/64/885722464.db2.gz IULNROXOTKZEJV-OAQYLSRUSA-N 0 3 408.473 4.107 20 0 HIADHN Cc1c(NC(=O)NC[C@H](c2ccccc2)N2CCCC2)cccc1NC(=O)N(C)C ZINC000471373264 886013809 /nfs/dbraw/zinc/01/38/09/886013809.db2.gz LSUJHBQMYJPPFH-OAQYLSRUSA-N 0 3 409.534 4.047 20 0 HIADHN O=C(CCN1CCc2ccccc2C1)Nc1ccccc1NC(=O)C[C@@H]1C=CCC1 ZINC000471381540 886027783 /nfs/dbraw/zinc/02/77/83/886027783.db2.gz MBDSYHZSZMYUHR-LJQANCHMSA-N 0 3 403.526 4.368 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)NC2CC(F)(c3cccc(Cl)c3)C2)cc1 ZINC000504105603 913017606 /nfs/dbraw/zinc/01/76/06/913017606.db2.gz WCQVRABUHLMWGI-JGBTYHIZSA-N 0 3 419.928 4.278 20 0 HIADHN CCCCCn1nc(C(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)c2ccccc2c1=O ZINC000471528012 886231749 /nfs/dbraw/zinc/23/17/49/886231749.db2.gz DRCSDAUAPNBPIW-WZONZLPQSA-N 0 3 420.557 4.008 20 0 HIADHN C[C@@H](NC(=O)COc1ccc(Oc2ccccn2)cc1)[C@H](c1ccccc1)N(C)C ZINC000471538064 886242793 /nfs/dbraw/zinc/24/27/93/886242793.db2.gz OEIBGTWFLLXKDV-HOYKHHGWSA-N 0 3 405.498 4.060 20 0 HIADHN C[C@@H](NC(=O)Cc1csc2nc(-c3ccccc3)cn12)[C@H](c1ccccc1)N(C)C ZINC000471552144 886259472 /nfs/dbraw/zinc/25/94/72/886259472.db2.gz QJZJZCSLQKKXBQ-UZUQRXQVSA-N 0 3 418.566 4.413 20 0 HIADHN Cc1nc(COc2cccc(C(=O)N[C@H](C)[C@@H](c3ccccc3)N(C)C)c2)cs1 ZINC000471556260 886265042 /nfs/dbraw/zinc/26/50/42/886265042.db2.gz PCOPSMQLEVQCBT-ZHRRBRCNSA-N 0 3 409.555 4.452 20 0 HIADHN COC(=O)c1sc(NC(=O)c2oc3ccccc3c2CN(C)C)nc1C(C)(C)C ZINC000471555846 886265110 /nfs/dbraw/zinc/26/51/10/886265110.db2.gz NYTDLYABCLYCEP-UHFFFAOYSA-N 0 3 415.515 4.287 20 0 HIADHN COc1ccccc1[C@H](CN[C@@H](C)c1ccc(NC(C)=O)cc1OC)OC(C)C ZINC000471593929 886306456 /nfs/dbraw/zinc/30/64/56/886306456.db2.gz NPGCBPGTUXSDMZ-HJPURHCSSA-N 0 3 400.519 4.479 20 0 HIADHN C[C@@H](Cc1ccc(Br)c(F)c1)[NH2+]Cc1nnc(COc2ccccc2)[n-]1 ZINC000471599758 886312707 /nfs/dbraw/zinc/31/27/07/886312707.db2.gz VWPIUAMHWPACIU-ZDUSSCGKSA-N 0 3 419.298 4.006 20 0 HIADHN Cc1ccc([C@H](NC2CC(OC(C)C)C2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000471612866 886327980 /nfs/dbraw/zinc/32/79/80/886327980.db2.gz HDNPVQWIADJTLG-YABDQXBESA-N 0 3 401.572 4.342 20 0 HIADHN C[C@@H](NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1c(F)cccc1F ZINC000471647257 886362027 /nfs/dbraw/zinc/36/20/27/886362027.db2.gz FWMDDBUAZGNSMV-LMWSTFAQSA-N 0 3 405.411 4.130 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)Cc3csc(-c4cccc(C)c4)n3)c2)CC1 ZINC000471653891 886370127 /nfs/dbraw/zinc/37/01/27/886370127.db2.gz QACZVELGPZPMKT-UHFFFAOYSA-N 0 3 420.582 4.442 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)CCc3cc(Br)cs3)c2)CC1 ZINC000471658744 886371841 /nfs/dbraw/zinc/37/18/41/886371841.db2.gz NMNYCYVUZWVWSL-UHFFFAOYSA-N 0 3 422.392 4.224 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)Cc3csc(Cc4ccccc4)n3)c2)CC1 ZINC000471661290 886375077 /nfs/dbraw/zinc/37/50/77/886375077.db2.gz BQYVPWMOBFBPIL-UHFFFAOYSA-N 0 3 420.582 4.057 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N[C@@H](c2ccc(C)cc2)c2ccccn2)N(C)C)cc1 ZINC000471765870 886498740 /nfs/dbraw/zinc/49/87/40/886498740.db2.gz DESVDAHZPJHUEY-ZEQRLZLVSA-N 0 3 402.542 4.390 20 0 HIADHN Cc1cn([C@@H](C)c2ccccc2)nc1NC(=O)N[C@@H](C)CN(C)Cc1ccccc1 ZINC000471832559 886584608 /nfs/dbraw/zinc/58/46/08/886584608.db2.gz ATNKDGAXBWMDHY-PMACEKPBSA-N 0 3 405.546 4.443 20 0 HIADHN Cc1cn([C@H](C)c2ccccc2)nc1NC(=O)NC[C@H](C)N(C)Cc1ccccc1 ZINC000471835479 886592247 /nfs/dbraw/zinc/59/22/47/886592247.db2.gz OPKDHTKDXCSKPP-VQTJNVASSA-N 0 3 405.546 4.443 20 0 HIADHN Cc1cn([C@@H](C)c2ccccc2)nc1NC(=O)NC[C@@H](C)N(C)Cc1ccccc1 ZINC000471835478 886592669 /nfs/dbraw/zinc/59/26/69/886592669.db2.gz OPKDHTKDXCSKPP-UXHICEINSA-N 0 3 405.546 4.443 20 0 HIADHN O=C(c1cccc(CN2CCCC2)c1)N1CCOC[C@@H]1c1nc2ccccc2s1 ZINC000504175547 913059706 /nfs/dbraw/zinc/05/97/06/913059706.db2.gz COPRNAHVJZOVER-HXUWFJFHSA-N 0 3 407.539 4.106 20 0 HIADHN Cc1ccc([C@H](NC(=O)NC[C@@H](C)N(C)Cc2ccccc2)c2ccccn2)cc1 ZINC000471852333 886619844 /nfs/dbraw/zinc/61/98/44/886619844.db2.gz VIOFKVIJDBCCPN-YKSBVNFPSA-N 0 3 402.542 4.299 20 0 HIADHN COc1ccc(NC(=O)[C@H](C)N[C@@H]2C[C@H](OCc3ccccc3)C2(C)C)cc1OC ZINC000471860025 886632400 /nfs/dbraw/zinc/63/24/00/886632400.db2.gz WZEVEXZNVVQNQF-USCONSEESA-N 0 3 412.530 4.004 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Nc1ccc(Cl)cc1-n1cccn1 ZINC000471879463 886661165 /nfs/dbraw/zinc/66/11/65/886661165.db2.gz CITZMPBZHXSFCP-UHFFFAOYSA-N 0 3 403.939 4.183 20 0 HIADHN CN1CC[C@H](NC(=O)N[C@@H](c2cccc(F)c2F)C(F)(F)F)[C@H]1c1ccccc1 ZINC000471935210 886732775 /nfs/dbraw/zinc/73/27/75/886732775.db2.gz ZZQKKWVPWHZNSV-JQHSSLGASA-N 0 3 413.390 4.313 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2cccc3c2CN(c2nccs2)C3)[C@H]1c1ccccc1 ZINC000471964249 886790912 /nfs/dbraw/zinc/79/09/12/886790912.db2.gz ILQOVKMPWAIMSV-NHCUHLMSSA-N 0 3 419.554 4.230 20 0 HIADHN CCCc1c(NC(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)cnn1-c1ccccc1 ZINC000471968990 886800741 /nfs/dbraw/zinc/80/07/41/886800741.db2.gz HYPCCPPVWNSTIS-OFNKIYASSA-N 0 3 403.530 4.392 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2c(F)cc(Br)cc2F)[C@@H]1c1ccccc1 ZINC000471978053 886807836 /nfs/dbraw/zinc/80/78/36/886807836.db2.gz KEUYZUYFLPFKBY-RDJZCZTQSA-N 0 3 410.262 4.294 20 0 HIADHN CCc1noc(-c2ccc(C)c(NC(=O)N[C@H]3CCN(C)[C@@H]3c3ccccc3)c2)n1 ZINC000472019195 886842066 /nfs/dbraw/zinc/84/20/66/886842066.db2.gz YPJKNEWGALHMHG-GHTZIAJQSA-N 0 3 405.502 4.174 20 0 HIADHN Cc1ccc2[nH]c(CNCc3ccc(C(=O)N4C[C@@H](C)O[C@@H](C)C4)cc3)cc2c1C ZINC000472040753 886858080 /nfs/dbraw/zinc/85/80/80/886858080.db2.gz ILXSLJNTYBWZOL-HDICACEKSA-N 0 3 405.542 4.324 20 0 HIADHN Cc1ccc([C@H](NC(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)c2ccccn2)cc1 ZINC000472111124 886898156 /nfs/dbraw/zinc/89/81/56/886898156.db2.gz SRFUZVNPEROCCB-HJOGWXRNSA-N 0 3 400.526 4.224 20 0 HIADHN COc1ccc(OC)c([C@@H]2C[C@@H]2C(=O)NC[C@H](C(C)C)N2CCc3ccccc3C2)c1 ZINC000472121568 886910399 /nfs/dbraw/zinc/91/03/99/886910399.db2.gz DUPYMEPOUWZXFY-OEMFJLHTSA-N 0 3 422.569 4.006 20 0 HIADHN Cc1ccc([C@H](NC(=O)N[C@H](C)CN(C)Cc2ccccc2)c2ccccn2)cc1 ZINC000472143750 886940866 /nfs/dbraw/zinc/94/08/66/886940866.db2.gz HGVKEFYZDWNWNO-YKSBVNFPSA-N 0 3 402.542 4.299 20 0 HIADHN Cc1cc(CNC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)ccc1Cl ZINC000472168436 886968413 /nfs/dbraw/zinc/96/84/13/886968413.db2.gz FFQLMFCZXKEMJG-UHFFFAOYSA-N 0 3 403.876 4.253 20 0 HIADHN CC(C)[C@@H](CC(F)(F)F)NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472174021 886973041 /nfs/dbraw/zinc/97/30/41/886973041.db2.gz JCQAVJIWKVNVFI-JXQTWKCFSA-N 0 3 403.411 4.068 20 0 HIADHN C[C@@H]1CC[C@H](C)N1[C@H]1CCCN(CCS(=O)(=O)c2ccc(C(C)(C)C)cc2)C1 ZINC000472263148 887076090 /nfs/dbraw/zinc/07/60/90/887076090.db2.gz YUKVKKZWBGVNAJ-ZVDOUQERSA-N 0 3 406.636 4.095 20 0 HIADHN COc1ccc(CNC(=O)C2CCN(Cc3c(C)cc(C)c(C(C)=O)c3C)CC2)cc1 ZINC000472309123 887135714 /nfs/dbraw/zinc/13/57/14/887135714.db2.gz HKJJZJUPTRIUNT-UHFFFAOYSA-N 0 3 422.569 4.351 20 0 HIADHN CN(C(=O)c1ccc2nc(C(F)(F)F)cn2c1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000472309934 887137392 /nfs/dbraw/zinc/13/73/92/887137392.db2.gz KAQVADXXMCWYKY-GOSISDBHSA-N 0 3 416.447 4.090 20 0 HIADHN CC[C@@H]1CN(C(C)=O)[C@H](CC)CN1CCC(=O)Nc1c(Cl)cccc1Cl ZINC000472334925 887171422 /nfs/dbraw/zinc/17/14/22/887171422.db2.gz AWGAEHMBFFANAP-HUUCEWRRSA-N 0 3 400.350 4.043 20 0 HIADHN CCN(CC)C(=O)c1ccc(NC(=O)CN2CC[C@H](Cc3ccccc3)[C@H]2C)cc1 ZINC000472343432 887178231 /nfs/dbraw/zinc/17/82/31/887178231.db2.gz AHFFMPXYTAORKL-DENIHFKCSA-N 0 3 407.558 4.060 20 0 HIADHN CCN(CC)C(=O)c1cccc(NC(=O)CN2CC[C@@H](Cc3ccccc3)[C@H]2C)c1 ZINC000472355134 887190148 /nfs/dbraw/zinc/19/01/48/887190148.db2.gz KIDIXWBUTJRIGF-CTNGQTDRSA-N 0 3 407.558 4.060 20 0 HIADHN CC1(C)[C@H](C(F)(F)F)CCN1C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472443465 887293726 /nfs/dbraw/zinc/29/37/26/887293726.db2.gz JLCMBZZYBDTXJA-JXQTWKCFSA-N 0 3 415.422 4.164 20 0 HIADHN Cc1ccccc1C1=CCN(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)C1 ZINC000472451662 887304241 /nfs/dbraw/zinc/30/42/41/887304241.db2.gz KCOCLTOITDGSMW-UHFFFAOYSA-N 0 3 407.480 4.209 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N1CCC[C@H](Cc2ccccc2)C1 ZINC000472456612 887311588 /nfs/dbraw/zinc/31/15/88/887311588.db2.gz RXJVWVPAUDSTBH-KMFTYDHNSA-N 0 3 423.523 4.456 20 0 HIADHN CCN(Cc1ccc(OC)cc1)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472460620 887317943 /nfs/dbraw/zinc/31/79/43/887317943.db2.gz VDJSKWCQSCIHQF-UHFFFAOYSA-N 0 3 413.484 4.032 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N1CCC[C@@H]1c1cccc(F)c1 ZINC000472461592 887320270 /nfs/dbraw/zinc/32/02/70/887320270.db2.gz BNUABGBADBHDFC-CTWPCTMYSA-N 0 3 413.459 4.478 20 0 HIADHN CN(Cc1csc(-c2ccc(C(N)=O)cc2)n1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000472469129 887329177 /nfs/dbraw/zinc/32/91/77/887329177.db2.gz HMFZRHDBGJDUKT-QFIPXVFZSA-N 0 3 420.582 4.005 20 0 HIADHN CN(C(=O)N[C@@H]1CC[C@@H](c2ccc(F)cc2)C1)C1CCN(CCc2ccccn2)CC1 ZINC000472544671 887424268 /nfs/dbraw/zinc/42/42/68/887424268.db2.gz FZICIGVMQJPULL-NFBKMPQASA-N 0 3 424.564 4.205 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3ccc(OC)cc3OCC3CC3)c(C)c2)CC1 ZINC000472659354 887519009 /nfs/dbraw/zinc/51/90/09/887519009.db2.gz JRTULPGWBWQPOG-UHFFFAOYSA-N 0 3 423.557 4.187 20 0 HIADHN CC(C)C(=O)Nc1ccc(NC(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000472769147 887615069 /nfs/dbraw/zinc/61/50/69/887615069.db2.gz IRUJHULADQPAQA-QFIPXVFZSA-N 0 3 408.546 4.409 20 0 HIADHN C[C@@H](CCN1CCN(C)CC1)NC(=O)N[C@@H](CC1CCCCC1)c1ccccc1 ZINC000472904836 887750830 /nfs/dbraw/zinc/75/08/30/887750830.db2.gz MFYOEUKYVDSALS-REWPJTCUSA-N 0 3 400.611 4.023 20 0 HIADHN CCN(C(=O)NC[C@H](c1cccs1)N1CCCC1)[C@H](COC)Cc1ccccc1 ZINC000472916396 887762409 /nfs/dbraw/zinc/76/24/09/887762409.db2.gz DVTQHCZMWLDNPC-LEWJYISDSA-N 0 3 415.603 4.174 20 0 HIADHN CC(C)CC[C@H](NC(=O)N[C@@H](C)CCN1CCN(C)CC1)c1ccc(Cl)cc1 ZINC000472918300 887763745 /nfs/dbraw/zinc/76/37/45/887763745.db2.gz BAZRHIGQZRIQHO-RXVVDRJESA-N 0 3 409.018 4.143 20 0 HIADHN CC(C)(C)CCN1CCN(C(=O)Nc2ccc(OCc3ccccn3)c(F)c2)CC1 ZINC000472942259 887792189 /nfs/dbraw/zinc/79/21/89/887792189.db2.gz WDCDZWXMPBWJMI-UHFFFAOYSA-N 0 3 414.525 4.385 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)NCCCc1ccc(Cl)cc1Cl ZINC000473122426 887917879 /nfs/dbraw/zinc/91/78/79/887917879.db2.gz OQRUEPDZTQCBDQ-UHFFFAOYSA-N 0 3 409.361 4.094 20 0 HIADHN O[C@@H](COc1ccc(Oc2ccccc2)cc1)CN1CC[C@]2(C1)OCc1ccccc12 ZINC000473159367 887937665 /nfs/dbraw/zinc/93/76/65/887937665.db2.gz HJWNDKYHEAIHPF-QFQXNSOFSA-N 0 3 417.505 4.350 20 0 HIADHN O=C(CCSCc1ccccc1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473512581 888242231 /nfs/dbraw/zinc/24/22/31/888242231.db2.gz KHXKKJKZBBVKIE-UHFFFAOYSA-N 0 3 400.510 4.231 20 0 HIADHN CCC(CC)n1nc(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cc1C ZINC000473512784 888242941 /nfs/dbraw/zinc/24/29/41/888242941.db2.gz LOEICSOOLUUMRG-UHFFFAOYSA-N 0 3 400.489 4.088 20 0 HIADHN Cc1ccc(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)c(Br)c1 ZINC000473517108 888249032 /nfs/dbraw/zinc/24/90/32/888249032.db2.gz GGISGYZGTQJAFJ-UHFFFAOYSA-N 0 3 419.285 4.293 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1ccc(F)c(Br)c1 ZINC000473519160 888251683 /nfs/dbraw/zinc/25/16/83/888251683.db2.gz ASGOODIRJBTCRG-UHFFFAOYSA-N 0 3 423.248 4.123 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)[C@H]1C[C@@]12CCCc1ccccc12 ZINC000473520142 888253088 /nfs/dbraw/zinc/25/30/88/888253088.db2.gz IHTGQLLVOHPPEZ-VEDXQQSGSA-N 0 3 406.492 4.202 20 0 HIADHN Cc1ccc(Cl)c(O[C@H](C)C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)c1 ZINC000473520278 888253629 /nfs/dbraw/zinc/25/36/29/888253629.db2.gz IQEJBIVWGHCMQJ-IUDNXUCKSA-N 0 3 418.887 4.337 20 0 HIADHN CCCOc1ccc(CCC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cc1 ZINC000473521104 888254874 /nfs/dbraw/zinc/25/48/74/888254874.db2.gz JNJPGVZYRNUKPG-UHFFFAOYSA-N 0 3 412.496 4.330 20 0 HIADHN CC[C@@H](Oc1ccccc1Cl)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473524671 888260452 /nfs/dbraw/zinc/26/04/52/888260452.db2.gz PIIFPHQVEJXWRI-VMBOVVBDSA-N 0 3 418.887 4.419 20 0 HIADHN C[C@@H]1C[C@@H]1c1ccc([C@@H]2C[C@@H]2C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)o1 ZINC000473523925 888260732 /nfs/dbraw/zinc/26/07/32/888260732.db2.gz HJJYCHBYBFTXHI-QUWQTQNUSA-N 0 3 410.480 4.428 20 0 HIADHN O=C(CCOc1ccc(Cl)cc1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473530675 888268260 /nfs/dbraw/zinc/26/82/60/888268260.db2.gz ORCAQNPIVNEEQD-UHFFFAOYSA-N 0 3 404.860 4.030 20 0 HIADHN C[C@H](CSc1ccc(F)cc1)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473534780 888272893 /nfs/dbraw/zinc/27/28/93/888272893.db2.gz WBGSOXPQMVSYCA-NVPAJSRCSA-N 0 3 418.500 4.475 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1csc(Cc2ccccc2)n1 ZINC000473535647 888273320 /nfs/dbraw/zinc/27/33/20/888273320.db2.gz XWFGUFAKSIFSRO-UHFFFAOYSA-N 0 3 423.504 4.269 20 0 HIADHN CN1CCN(CCC(C)(C)NC(=O)Nc2cc(F)ccc2Oc2ccccc2)CC1 ZINC000473663965 888419504 /nfs/dbraw/zinc/41/95/04/888419504.db2.gz SYGGFHWRHVXLRT-UHFFFAOYSA-N 0 3 414.525 4.156 20 0 HIADHN CN1CCN(CCC(C)(C)NC(=O)Nc2ccc(CCCc3ccccc3)cc2)CC1 ZINC000473673542 888434192 /nfs/dbraw/zinc/43/41/92/888434192.db2.gz FGTXCQXLUZYHML-UHFFFAOYSA-N 0 3 422.617 4.400 20 0 HIADHN C[C@H](CCN1CCN(C)CC1)NC(=O)Nc1cccc(CCCc2ccccc2)c1 ZINC000473673645 888434492 /nfs/dbraw/zinc/43/44/92/888434492.db2.gz GEKOBBQFAYIBIL-OAQYLSRUSA-N 0 3 408.590 4.009 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)c3ccc(Cl)cc3C(F)(F)F)CC2)C[C@H](C)O1 ZINC000473724250 888500758 /nfs/dbraw/zinc/50/07/58/888500758.db2.gz MIOLYGZUFXALDU-KBPBESRZSA-N 0 3 418.887 4.320 20 0 HIADHN CCN(C(=O)Nc1nnc(C(F)(F)F)s1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000473737480 888518765 /nfs/dbraw/zinc/51/87/65/888518765.db2.gz BSYKWMWZMVVOJP-GXTWGEPZSA-N 0 3 413.469 4.246 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1c2c(nn1C(C)C)CCC2)c1cccc(OC)c1 ZINC000473794652 888611088 /nfs/dbraw/zinc/61/10/88/888611088.db2.gz DZJVIQBETKSEEQ-OAQYLSRUSA-N 0 3 413.566 4.166 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@@H]3CCSc4c(F)cccc43)c2)CC1 ZINC000473808383 888633091 /nfs/dbraw/zinc/63/30/91/888633091.db2.gz OKAXRHOQCIODSW-HXUWFJFHSA-N 0 3 414.550 4.326 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@@H](C)c3ccc(OC(C)C)cc3)c2)CC1 ZINC000473815038 888641855 /nfs/dbraw/zinc/64/18/55/888641855.db2.gz BTWNSXFSPKKARB-IBGZPJMESA-N 0 3 410.562 4.498 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N(C)[C@H](C)c3cc(F)ccc3F)c2)CC1 ZINC000473819163 888648925 /nfs/dbraw/zinc/64/89/25/888648925.db2.gz NGCHZZHFCHTGLN-MRXNPFEDSA-N 0 3 402.489 4.332 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N(CCOC)[C@H](C)c3ccccc3)c2)CC1 ZINC000473820167 888649871 /nfs/dbraw/zinc/64/98/71/888649871.db2.gz UMENQJZLBJNOQE-HXUWFJFHSA-N 0 3 410.562 4.070 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CC[C@H](c4cc(C)cc(C)c4)C3)c2)CC1 ZINC000473823121 888655341 /nfs/dbraw/zinc/65/53/41/888655341.db2.gz QLPWOTVRPRVMME-NRFANRHFSA-N 0 3 406.574 4.467 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@H](c3ccco3)c3ccccc3)c2)CC1 ZINC000473826791 888660454 /nfs/dbraw/zinc/66/04/54/888660454.db2.gz ZCCOTKJEIZVSEU-QHCPKHFHSA-N 0 3 404.514 4.333 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@@H](c3ccc(OC)cc3)C3CC3)c2)CC1 ZINC000473828002 888660487 /nfs/dbraw/zinc/66/04/87/888660487.db2.gz INGFEIFMHNSPRN-HSZRJFAPSA-N 0 3 408.546 4.110 20 0 HIADHN CCCN(CCc1cccc(F)c1)C(=O)Nc1cccc(N2CCN(CC)CC2)c1 ZINC000473832071 888667129 /nfs/dbraw/zinc/66/71/29/888667129.db2.gz ACSVXDMVDMZLDA-UHFFFAOYSA-N 0 3 412.553 4.454 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)NCC[C@@H](C)c3ccc(OC)cc3)c2)CC1 ZINC000473832530 888668252 /nfs/dbraw/zinc/66/82/52/888668252.db2.gz WIUZQTYVYUEKGH-LJQANCHMSA-N 0 3 410.562 4.152 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)NCc3csc(-c4ccccc4)n3)c2)CC1 ZINC000473833634 888668410 /nfs/dbraw/zinc/66/84/10/888668410.db2.gz YCCTUERVDZRBTH-UHFFFAOYSA-N 0 3 421.570 4.274 20 0 HIADHN CCc1cccc2c1OCC[C@H]2NC(=O)Nc1cccc(N2CCN(CC)CC2)c1 ZINC000473837214 888676386 /nfs/dbraw/zinc/67/63/86/888676386.db2.gz PRRTXGWYSJMTLG-JOCHJYFZSA-N 0 3 408.546 4.036 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)NCc3ccc(F)cc3C(F)(F)F)c2)CC1 ZINC000473842573 888685296 /nfs/dbraw/zinc/68/52/96/888685296.db2.gz XIICPNUDMMBQIH-UHFFFAOYSA-N 0 3 424.442 4.308 20 0 HIADHN CCNc1ccc(Cl)cc1C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473844524 888690041 /nfs/dbraw/zinc/69/00/41/888690041.db2.gz RKIVBYAKMTYXHM-UHFFFAOYSA-N 0 3 403.876 4.307 20 0 HIADHN CC(C)c1ccc([C@H](NC(=O)NC(C)(C)CCN2CCN(C)CC2)C(C)C)cc1 ZINC000473890455 888759610 /nfs/dbraw/zinc/75/96/10/888759610.db2.gz FWNCAIVZDKZDKI-JOCHJYFZSA-N 0 3 402.627 4.222 20 0 HIADHN CSc1cccc(C)c1NC(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000473974595 888839577 /nfs/dbraw/zinc/83/95/77/888839577.db2.gz BANUICPXODMHMQ-HDICACEKSA-N 0 3 405.608 4.460 20 0 HIADHN Cn1nnc2cc(CN[C@H](Cc3ccccn3)c3ccc(Br)cc3)ccc21 ZINC000474003310 888861381 /nfs/dbraw/zinc/86/13/81/888861381.db2.gz UKWVHUDYEHRPCY-LJQANCHMSA-N 0 3 422.330 4.199 20 0 HIADHN CN1CCN(CCC(C)(C)NC(=O)N[C@H](CC2CCCC2)c2ccccc2)CC1 ZINC000474025219 888876058 /nfs/dbraw/zinc/87/60/58/888876058.db2.gz XJOPXSJFSIORPZ-JOCHJYFZSA-N 0 3 400.611 4.023 20 0 HIADHN CCN(C)C(=O)[C@H](C)N[C@@H]1CCCc2nc(-c3ccccc3Br)sc21 ZINC000474101789 888924822 /nfs/dbraw/zinc/92/48/22/888924822.db2.gz ZVKUJFQQFPAGJB-SWLSCSKDSA-N 0 3 422.392 4.406 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)[C@@H]3CCN(c4ccccc4)[C@@H]3C)c2)CC1 ZINC000474151535 888981759 /nfs/dbraw/zinc/98/17/59/888981759.db2.gz NVZIWIBMPMZHLA-HYBUGGRVSA-N 0 3 406.574 4.071 20 0 HIADHN COc1ccc([C@@H]2CCN(CC(=O)N3CC=C(c4c[nH]c5ccccc54)CC3)C2)cc1 ZINC000504532496 913312774 /nfs/dbraw/zinc/31/27/74/913312774.db2.gz IVJXRGPJYWSRNZ-OAQYLSRUSA-N 0 3 415.537 4.282 20 0 HIADHN CCOc1ccc([C@H]2CCCN2C(=O)CN2CC[C@H](c3ccc(OC)cc3)C2)cc1 ZINC000504533932 913312988 /nfs/dbraw/zinc/31/29/88/913312988.db2.gz PFDNOHXGEYGQSJ-XUZZJYLKSA-N 0 3 408.542 4.247 20 0 HIADHN CN(C(=O)NCc1ccc(OC(F)(F)F)cc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000474336655 889208265 /nfs/dbraw/zinc/20/82/65/889208265.db2.gz IQBKHBFOVJHGKS-GOSISDBHSA-N 0 3 407.436 4.001 20 0 HIADHN Cc1nc2ccccc2n1C1CCN(C(=O)NC[C@@H](C)N(C)Cc2ccccc2)CC1 ZINC000474342184 889215978 /nfs/dbraw/zinc/21/59/78/889215978.db2.gz SZWKVQZBMHHLIB-LJQANCHMSA-N 0 3 419.573 4.212 20 0 HIADHN COCCOc1c(Cl)cccc1NC(=O)N[C@H](C)[C@@H](c1ccccc1)N(C)C ZINC000474428755 889294461 /nfs/dbraw/zinc/29/44/61/889294461.db2.gz DFULEYAIGOXGTH-BEFAXECRSA-N 0 3 405.926 4.178 20 0 HIADHN C[C@@H](NC(=O)Nc1ccc(OCC2CCOCC2)cc1)[C@@H](c1ccccc1)N(C)C ZINC000474434679 889299472 /nfs/dbraw/zinc/29/94/72/889299472.db2.gz AMHLGPYHWIMBQZ-JPYJTQIMSA-N 0 3 411.546 4.305 20 0 HIADHN CC(C)n1cnnc1-c1ccccc1NC(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C ZINC000474440375 889305244 /nfs/dbraw/zinc/30/52/44/889305244.db2.gz SBEDNHPRTNUWJY-UWJYYQICSA-N 0 3 406.534 4.339 20 0 HIADHN CN(C(=O)Nc1ccccc1OCC(F)(F)F)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000474712275 889570066 /nfs/dbraw/zinc/57/00/66/889570066.db2.gz UPVZWFGLXMKERG-QGZVFWFLSA-N 0 3 407.436 4.366 20 0 HIADHN CN(C(=O)Nc1ccc(C(=O)NC2CCCC2)cc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000474729535 889585209 /nfs/dbraw/zinc/58/52/09/889585209.db2.gz WYSDABLTATVJKW-QHCPKHFHSA-N 0 3 420.557 4.097 20 0 HIADHN COC(=O)C[C@H](NC(=O)c1cccc(CN2CCCC2)c1)c1ccc2ccccc2c1 ZINC000474832782 889691502 /nfs/dbraw/zinc/69/15/02/889691502.db2.gz KYGIVRRPQUGIEB-DEOSSOPVSA-N 0 3 416.521 4.470 20 0 HIADHN COc1cc(C)c(NC(=O)[C@@H]2CN(Cc3ccccc3)CCC2(F)F)cc1OC ZINC000504618573 913372500 /nfs/dbraw/zinc/37/25/00/913372500.db2.gz DEIYNKXGVOFYCL-KRWDZBQOSA-N 0 3 404.457 4.108 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)c3c(C)onc3-c3ccccc3C)cc2)CC1 ZINC000474865886 889719997 /nfs/dbraw/zinc/71/99/97/889719997.db2.gz AQFMXVZDYVQDIK-UHFFFAOYSA-N 0 3 418.541 4.348 20 0 HIADHN CC(C)n1nccc1CNCCOc1ccc(Br)cc1C(F)(F)F ZINC000474878695 889733875 /nfs/dbraw/zinc/73/38/75/889733875.db2.gz LUNWKHPQLVEVCF-UHFFFAOYSA-N 0 3 406.246 4.414 20 0 HIADHN COc1ccc(-c2cc(C(=O)NC3CCN(CCOC(C)C)CC3)sc2C)cc1 ZINC000474885794 889741824 /nfs/dbraw/zinc/74/18/24/889741824.db2.gz WNSWKIPYZFYAIP-UHFFFAOYSA-N 0 3 416.587 4.351 20 0 HIADHN Cc1csc([C@@H](C)CNCc2c(F)ccc(I)c2F)n1 ZINC000474924689 889783588 /nfs/dbraw/zinc/78/35/88/889783588.db2.gz IPOGWRTVALYHSC-QMMMGPOBSA-N 0 3 408.255 4.228 20 0 HIADHN Cc1cc(F)c(Br)cc1NC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000474949005 889805195 /nfs/dbraw/zinc/80/51/95/889805195.db2.gz ZIPHNCJBHMOYOZ-FUHWJXTLSA-N 0 3 406.299 4.464 20 0 HIADHN CCN(C(=O)Nc1ccc(C(C)(C)C(=O)OC)cc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000474996397 889847635 /nfs/dbraw/zinc/84/76/35/889847635.db2.gz CGFUOJMSGVMLSW-QFIPXVFZSA-N 0 3 423.557 4.266 20 0 HIADHN CCN(C(=O)Nc1cc2c(cc1Cl)OCO2)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475003990 889856188 /nfs/dbraw/zinc/85/61/88/889856188.db2.gz SWYLNWUXZRZCHV-INIZCTEOSA-N 0 3 401.894 4.197 20 0 HIADHN CCN(C(=O)Nc1ccccc1C(=O)N1CCCC1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475007055 889858764 /nfs/dbraw/zinc/85/87/64/889858764.db2.gz GTHFHLOWAQPXIO-OAQYLSRUSA-N 0 3 420.557 4.051 20 0 HIADHN CCN(C(=O)Nc1cccc(C(=O)N2CCCC2)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475010022 889863716 /nfs/dbraw/zinc/86/37/16/889863716.db2.gz UMJKEBSPQQLUIO-QHCPKHFHSA-N 0 3 420.557 4.051 20 0 HIADHN Cn1ccnc1[C@H]1OCCC[C@@H]1NCc1ccc(Br)cc1C(F)(F)F ZINC000475046046 889896913 /nfs/dbraw/zinc/89/69/13/889896913.db2.gz DDWJDCMVQOHRLV-GJZGRUSLSA-N 0 3 418.257 4.211 20 0 HIADHN C[C@@H](CCN1CCCN(C(=O)c2ccc(Cl)cc2)CC1)OCc1ccccc1 ZINC000475053433 889899695 /nfs/dbraw/zinc/89/96/95/889899695.db2.gz JOGARDDIWJVANG-IBGZPJMESA-N 0 3 400.950 4.483 20 0 HIADHN CN(Cc1ccccc1OCc1ccccc1)C[C@@H]1C[C@H](F)CN1Cc1ncccn1 ZINC000475082956 889929294 /nfs/dbraw/zinc/92/92/94/889929294.db2.gz KFLTZEJKHFKACP-GOTSBHOMSA-N 0 3 420.532 4.100 20 0 HIADHN CN(Cc1ccc(F)cc1C(F)(F)F)C[C@@H]1C[C@H](F)CN1Cc1nccs1 ZINC000475086135 889932813 /nfs/dbraw/zinc/93/28/13/889932813.db2.gz CHUDUJLLPPNGKX-GJZGRUSLSA-N 0 3 405.436 4.345 20 0 HIADHN CCN1CCN(c2cccc(NCc3ccc(OCc4ccncc4)cc3)c2)CC1 ZINC000475087058 889934133 /nfs/dbraw/zinc/93/41/33/889934133.db2.gz JDVCQGFJHQOFGU-UHFFFAOYSA-N 0 3 402.542 4.415 20 0 HIADHN CN(C(=O)N[C@@H](c1ccc(F)cc1)C(F)(F)F)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475094141 889940814 /nfs/dbraw/zinc/94/08/14/889940814.db2.gz IEBMCMBRMPLTLW-MOPGFXCFSA-N 0 3 409.427 4.345 20 0 HIADHN CN(C(=O)N[C@@H](c1nccs1)c1ccccc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475105226 889953842 /nfs/dbraw/zinc/95/38/42/889953842.db2.gz BJVGBPLXDXZGJG-NHCUHLMSSA-N 0 3 406.555 4.148 20 0 HIADHN CCN(C(=O)c1ncccc1Br)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000475105575 889954296 /nfs/dbraw/zinc/95/42/96/889954296.db2.gz DRMHQROJORRICB-NVXWUHKLSA-N 0 3 402.336 4.142 20 0 HIADHN CN(C(=O)NCc1ccccc1OCC(F)(F)F)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475128037 889989579 /nfs/dbraw/zinc/98/95/79/889989579.db2.gz CTKZLLXQZDZUHZ-IBGZPJMESA-N 0 3 421.463 4.044 20 0 HIADHN CN(C(=O)NCc1cc(F)ccc1Br)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475134380 890001007 /nfs/dbraw/zinc/00/10/07/890001007.db2.gz KXLBXNIUOJZUHN-SFHVURJKSA-N 0 3 420.326 4.004 20 0 HIADHN CCN(C(=O)N[C@H](C)c1cccc(NC(C)=O)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475162335 890027395 /nfs/dbraw/zinc/02/73/95/890027395.db2.gz KADRROWAIGCGCR-WZONZLPQSA-N 0 3 408.546 4.012 20 0 HIADHN CCN(C(=O)NCC1(c2ccccc2)CCOCC1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475179231 890048783 /nfs/dbraw/zinc/04/87/83/890048783.db2.gz WCBROAJTUWCPEQ-DEOSSOPVSA-N 0 3 421.585 4.041 20 0 HIADHN CCN(C(=O)NCc1cc(Br)cs1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475179330 890049529 /nfs/dbraw/zinc/04/95/29/890049529.db2.gz BVTANDDGSCCMDZ-QGZVFWFLSA-N 0 3 422.392 4.317 20 0 HIADHN CCOC(=O)c1coc(CN2C[C@H]3CCC[C@@]3(c3nc(-c4ccccc4)no3)C2)c1 ZINC000475216955 890087202 /nfs/dbraw/zinc/08/72/02/890087202.db2.gz QLCPKIFVOYVZLU-WZONZLPQSA-N 0 3 407.470 4.060 20 0 HIADHN C[C@H](NC(=O)Nc1ncccc1OCc1cccc(Cl)c1)C1=CCN(C)CC1 ZINC000475261701 890154877 /nfs/dbraw/zinc/15/48/77/890154877.db2.gz FBEBNSOQXCZEGO-HNNXBMFYSA-N 0 3 400.910 4.086 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@H]2CNC(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000475279540 890175097 /nfs/dbraw/zinc/17/50/97/890175097.db2.gz KCSZHKNWOHUWBO-SDHOMARFSA-N 0 3 421.585 4.379 20 0 HIADHN Cc1ccc(OC(F)F)c(CNC(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000475282554 890180264 /nfs/dbraw/zinc/18/02/64/890180264.db2.gz RSLPSVMDIAVLON-LJQANCHMSA-N 0 3 403.473 4.012 20 0 HIADHN Cc1ccc(OCc2cccc(C(=O)N(C)[C@H]3CCN(Cc4ccccc4)C3)c2)cn1 ZINC000475302537 890209339 /nfs/dbraw/zinc/20/93/39/890209339.db2.gz MSZMGYOSIBHRBI-DEOSSOPVSA-N 0 3 415.537 4.316 20 0 HIADHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)c1cc2[nH]ccc2s1 ZINC000475315244 890229443 /nfs/dbraw/zinc/22/94/43/890229443.db2.gz JSGGNRFZFGCCCX-UHFFFAOYSA-N 0 3 406.349 4.196 20 0 HIADHN Cc1nc2ccc(C(=O)N(CCN(C)C)Cc3ccc(C(F)(F)F)cc3)cc2n1C ZINC000475318732 890235638 /nfs/dbraw/zinc/23/56/38/890235638.db2.gz QLGZKGLGQSGARF-UHFFFAOYSA-N 0 3 418.463 4.105 20 0 HIADHN CC(C)n1ncc2c1nc(C1CC1)cc2C(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475322670 890242839 /nfs/dbraw/zinc/24/28/39/890242839.db2.gz QTRNRLHUBPAFST-FQEVSTJZSA-N 0 3 417.557 4.236 20 0 HIADHN C[C@@H](CCN1CCCN(c2nnc(C(F)(F)F)s2)CC1)OCc1ccccc1 ZINC000475323560 890245150 /nfs/dbraw/zinc/24/51/50/890245150.db2.gz FVDSVVQGVBTFHK-HNNXBMFYSA-N 0 3 414.497 4.064 20 0 HIADHN COCCC[C@@H](Cc1ccccc1)NCc1cn(-c2ccc(F)c(Cl)c2)nn1 ZINC000475332830 890251679 /nfs/dbraw/zinc/25/16/79/890251679.db2.gz KQAWBUVFMIIVNQ-KRWDZBQOSA-N 0 3 402.901 4.187 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3ccc(OC)cc3OC(C)C)c(C)c2)CC1 ZINC000475481903 890388466 /nfs/dbraw/zinc/38/84/66/890388466.db2.gz UPIYAPFECSVKBR-UHFFFAOYSA-N 0 3 411.546 4.185 20 0 HIADHN COc1cc(CN[C@@H]2CCCc3ccc(F)cc32)ccc1OCC(=O)N1CCCC1 ZINC000475502711 890415335 /nfs/dbraw/zinc/41/53/35/890415335.db2.gz JSKZYZVUOSOABV-OAQYLSRUSA-N 0 3 412.505 4.003 20 0 HIADHN CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)N[C@@H]1CC[C@H](c2cccc(F)c2)C1 ZINC000475517744 890435551 /nfs/dbraw/zinc/43/55/51/890435551.db2.gz KBNFPPSUIVFCPV-MHADKKCISA-N 0 3 410.537 4.191 20 0 HIADHN CN(C(=O)c1ccc(OCc2ccncc2)cc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475543701 890469117 /nfs/dbraw/zinc/46/91/17/890469117.db2.gz FKPZJPRKSINJCK-QHCPKHFHSA-N 0 3 401.510 4.007 20 0 HIADHN COc1ccc(CN(CCc2ccccn2)Cc2cn(-c3ccncc3)nc2C)cc1 ZINC000475552029 890476848 /nfs/dbraw/zinc/47/68/48/890476848.db2.gz ZWCFORAHVCBTQX-UHFFFAOYSA-N 0 3 413.525 4.224 20 0 HIADHN CC(C)n1ccc(C[C@@H](C)NCc2ccc(I)cc2Cl)n1 ZINC000475627674 890564536 /nfs/dbraw/zinc/56/45/36/890564536.db2.gz UGRDUJWNWWVRQF-GFCCVEGCSA-N 0 3 417.722 4.443 20 0 HIADHN Cc1nc(CN(C)[C@H]2CCCN(Cc3ccc(-c4ccncc4)cc3F)CC2)no1 ZINC000475631978 890572726 /nfs/dbraw/zinc/57/27/26/890572726.db2.gz CJEFAQPEWWEOCF-NRFANRHFSA-N 0 3 409.509 4.066 20 0 HIADHN Cc1ccc(-n2cccn2)cc1NC(=O)N(CCN(C)C)Cc1cccc(Cl)c1 ZINC000475653901 890597151 /nfs/dbraw/zinc/59/71/51/890597151.db2.gz INNINAGFWDPNIG-UHFFFAOYSA-N 0 3 411.937 4.430 20 0 HIADHN OC[C@]1(Cc2ccccc2)CCCN1Cc1nc(-c2cccc(C(F)(F)F)c2)no1 ZINC000475679241 890621713 /nfs/dbraw/zinc/62/17/13/890621713.db2.gz LPRGQFHNSZKPFC-OAQYLSRUSA-N 0 3 417.431 4.325 20 0 HIADHN CC(C)(CNC(=O)Nc1cc2c(cc1Cl)OCO2)N1CCc2ccccc2C1 ZINC000504737048 913472712 /nfs/dbraw/zinc/47/27/12/913472712.db2.gz HZMLFHAEYOSYGF-UHFFFAOYSA-N 0 3 401.894 4.027 20 0 HIADHN CCc1nnc(-c2ccc(NC(=O)N[C@@H]3CCN([C@H](C)c4ccccc4)C3)cc2)o1 ZINC000475712919 890652037 /nfs/dbraw/zinc/65/20/37/890652037.db2.gz CMTMYDYLOWYIJD-OXQOHEQNSA-N 0 3 405.502 4.256 20 0 HIADHN C[C@@H](c1ccc([S@@](C)=O)cc1)N(C)CCc1nc(-c2cccc(Cl)c2)no1 ZINC000475725628 890663329 /nfs/dbraw/zinc/66/33/29/890663329.db2.gz DBBYACQSILGDSO-PGGUUEOZSA-N 0 3 403.935 4.363 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)Nc2cc(C(F)(F)F)ccc2Cl)CC1 ZINC000475734960 890674883 /nfs/dbraw/zinc/67/48/83/890674883.db2.gz PRUWHQULTMTEBK-UHFFFAOYSA-N 0 3 407.864 4.370 20 0 HIADHN CCOc1cccc2cc([C@H](C)NC(=O)NC3CCN(CCOC(C)C)CC3)oc21 ZINC000475958928 890880077 /nfs/dbraw/zinc/88/00/77/890880077.db2.gz PAJRSBHFNJNYRJ-KRWDZBQOSA-N 0 3 417.550 4.081 20 0 HIADHN C[C@H](NC(=O)NC[C@H](Cc1ccccc1)N(C)C)c1ccc(-c2cccnc2)cc1 ZINC000475972195 890890075 /nfs/dbraw/zinc/89/00/75/890890075.db2.gz CWAXXQRKMXMAGV-CYFREDJKSA-N 0 3 402.542 4.282 20 0 HIADHN Cc1c(COC(C)(C)C)cccc1NC(=O)NC1CCN(CCOC(C)C)CC1 ZINC000475982646 890897931 /nfs/dbraw/zinc/89/79/31/890897931.db2.gz AIGOPZWGYDZBIW-UHFFFAOYSA-N 0 3 405.583 4.321 20 0 HIADHN CN(C(=O)N[C@@H](c1ccc(Br)cc1)C1CCC1)[C@@H]1CCN(C2CC2)C1 ZINC000476154433 891078634 /nfs/dbraw/zinc/07/86/34/891078634.db2.gz MZDKWPMHHQLWCG-RTBURBONSA-N 0 3 406.368 4.168 20 0 HIADHN COc1cc([C@H](C)NC(=O)N(C)[C@@H]2CCN(C3CC3)C2)ccc1OCc1ccccc1 ZINC000476162785 891090061 /nfs/dbraw/zinc/09/00/61/891090061.db2.gz OSPLPFIETLGOML-PGRDOPGGSA-N 0 3 423.557 4.213 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)N[C@@H]2CCSc3ccc(Cl)cc32)cc1 ZINC000476203671 891133831 /nfs/dbraw/zinc/13/38/31/891133831.db2.gz FQVJQUPQFJWWKZ-RTBURBONSA-N 0 3 419.978 4.488 20 0 HIADHN COc1cc(CN(C)C[C@@H](O)CO[C@H]2CCCc3ccccc32)ccc1SC ZINC000476294660 891208615 /nfs/dbraw/zinc/20/86/15/891208615.db2.gz HUESNTUSKZUYAB-CTNGQTDRSA-N 0 3 401.572 4.304 20 0 HIADHN CC[C@H]1CN(C(=O)NC2CCN(CCOC(C)C)CC2)CC[C@H]1c1ccccc1 ZINC000476446565 891357877 /nfs/dbraw/zinc/35/78/77/891357877.db2.gz IQFMUFBMGSAJRI-NZQKXSOJSA-N 0 3 401.595 4.101 20 0 HIADHN CCN(C(=O)NC1CCN(CCOC(C)C)CC1)[C@H](Cc1ccc(F)cc1)C(C)C ZINC000476446167 891357919 /nfs/dbraw/zinc/35/79/19/891357919.db2.gz DUOBSRWWMUWCMN-HSZRJFAPSA-N 0 3 421.601 4.314 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N(C)Cc2c(Cl)cccc2Cl)CC1 ZINC000476451139 891362978 /nfs/dbraw/zinc/36/29/78/891362978.db2.gz IPIOQMSCSOWLKE-UHFFFAOYSA-N 0 3 402.366 4.024 20 0 HIADHN Cc1cccc([C@@H]2CCCCN2C(=O)NC2CCN(CCOC(C)C)CC2)c1C ZINC000476455277 891368402 /nfs/dbraw/zinc/36/84/02/891368402.db2.gz XBRVOSXQSLUFFM-QHCPKHFHSA-N 0 3 401.595 4.429 20 0 HIADHN CC(C)[C@H](CNC(=O)Nc1ccc(N2CCCC2=O)cc1)N1CCc2ccccc2C1 ZINC000504837563 913560398 /nfs/dbraw/zinc/56/03/98/913560398.db2.gz UCBYOLPXSVIEAQ-QHCPKHFHSA-N 0 3 420.557 4.018 20 0 HIADHN C[C@H]1[C@H](c2ccccc2)CCN1CC(=O)NCc1cccc(COCc2ccco2)c1 ZINC000476578842 891502356 /nfs/dbraw/zinc/50/23/56/891502356.db2.gz ZTSCFFYGNONVPE-NBGIEHNGSA-N 0 3 418.537 4.491 20 0 HIADHN CCN(C[C@@H]1CCN(CC(=O)N(C)[C@@H](C)c2ccc(Cl)cc2)C1)CC(F)(F)F ZINC000476579997 891506128 /nfs/dbraw/zinc/50/61/28/891506128.db2.gz WIAJSYNADVMCET-HOTGVXAUSA-N 0 3 419.919 4.066 20 0 HIADHN CCC[C@@H]1CN(C(=O)[C@H]2CCc3nc(C(C)C)[nH]c3C2)CCN1Cc1ccccc1 ZINC000476589499 891520512 /nfs/dbraw/zinc/52/05/12/891520512.db2.gz SBRQADXZPHIBNZ-LEWJYISDSA-N 0 3 408.590 4.151 20 0 HIADHN CCC[C@@H]1CN(C(=O)[C@H]2CCc3[nH]c(C(C)C)nc3C2)CCN1Cc1ccccc1 ZINC000476589499 891520523 /nfs/dbraw/zinc/52/05/23/891520523.db2.gz SBRQADXZPHIBNZ-LEWJYISDSA-N 0 3 408.590 4.151 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N(Cc2ccccc2)CC2CCOCC2)N(C)C)cc1 ZINC000476633577 891569991 /nfs/dbraw/zinc/56/99/91/891569991.db2.gz WNTMSHGYUWCCMD-VWLOTQADSA-N 0 3 423.601 4.490 20 0 HIADHN CCc1onc(-c2ccccc2Cl)c1C(=O)N1C[C@@H](SC)[C@@H](N2CCCC2)C1 ZINC000476670028 891620190 /nfs/dbraw/zinc/62/01/90/891620190.db2.gz AESPGQGLFBWCQA-FUHWJXTLSA-N 0 3 419.978 4.209 20 0 HIADHN CCc1onc(-c2ccc(Br)cc2)c1C(=O)N[C@H]1CCCN(C(C)C)C1 ZINC000476695789 891650787 /nfs/dbraw/zinc/65/07/87/891650787.db2.gz VNLFRGMJSHAQRC-INIZCTEOSA-N 0 3 420.351 4.269 20 0 HIADHN CC(C)N1CCC(N(C)C(=O)c2cn(C3CC3)c3cc(Cl)c(F)cc3c2=O)CC1 ZINC000476714999 891677329 /nfs/dbraw/zinc/67/73/29/891677329.db2.gz JFQNOICSENNDKD-UHFFFAOYSA-N 0 3 419.928 4.074 20 0 HIADHN CC(=O)Nc1ccc(C)c(NC(=O)NC[C@H](C(C)C)N2CCc3ccccc3C2)c1 ZINC000504870503 913599370 /nfs/dbraw/zinc/59/93/70/913599370.db2.gz SEYRJUZRNXQLRE-HSZRJFAPSA-N 0 3 408.546 4.158 20 0 HIADHN CN(C)CCN(C(=O)c1ccc(NC(=O)c2cc(Cl)cc(Cl)c2)cc1)C1CC1 ZINC000476821834 891806359 /nfs/dbraw/zinc/80/63/59/891806359.db2.gz REFRXMLZRXBBNM-UHFFFAOYSA-N 0 3 420.340 4.412 20 0 HIADHN CC(C)[C@@H](CNC(=O)Nc1cccc(NC(=O)C2CC2)c1)N1CCc2ccccc2C1 ZINC000504871425 913599293 /nfs/dbraw/zinc/59/92/93/913599293.db2.gz YBGMAXWKDSNXDK-HSZRJFAPSA-N 0 3 420.557 4.240 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)Nc1ccc(Oc2nccc(C)n2)cc1)c1ccco1 ZINC000477110893 892041586 /nfs/dbraw/zinc/04/15/86/892041586.db2.gz FNLTZAOJBJBTTC-DNVCBOLYSA-N 0 3 409.490 4.421 20 0 HIADHN Cc1cc(NC(=O)c2c(F)ccc(F)c2F)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000477119518 892050103 /nfs/dbraw/zinc/05/01/03/892050103.db2.gz JWTQUQNAUGBVOD-MRXNPFEDSA-N 0 3 414.431 4.308 20 0 HIADHN COc1ccc([C@H]2CCCN2C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)cc1OC ZINC000504895720 913627606 /nfs/dbraw/zinc/62/76/06/913627606.db2.gz QBQIBHYKMKMLRO-FGZHOGPDSA-N 0 3 423.557 4.215 20 0 HIADHN CC[C@H](c1ccccc1)[C@H]1CCCN1CC(=O)Nc1cccc(N2CCCC2=O)c1 ZINC000477218317 892151284 /nfs/dbraw/zinc/15/12/84/892151284.db2.gz HQKWDVSMQFVPMX-DHIUTWEWSA-N 0 3 405.542 4.410 20 0 HIADHN COC(=O)c1cc2cc(NC(=O)N[C@@H]3CCCN(Cc4ccccc4)C3)ccc2o1 ZINC000504904699 913635989 /nfs/dbraw/zinc/63/59/89/913635989.db2.gz XZKMOFQHNPUYRD-LJQANCHMSA-N 0 3 407.470 4.006 20 0 HIADHN O=C(N[C@H]1CCCN(Cc2ccccc2)C1)N1CCC(OCc2ccccc2)CC1 ZINC000504903499 913636189 /nfs/dbraw/zinc/63/61/89/913636189.db2.gz QYVVAFMEDZUDBG-QHCPKHFHSA-N 0 3 407.558 4.042 20 0 HIADHN CCN1CCN([C@H]2CCN([C@@H](C)c3nc(C)c(-c4ccc(Cl)cc4)o3)C2)CC1 ZINC000477287476 892244476 /nfs/dbraw/zinc/24/44/76/892244476.db2.gz PRSCLSZNDFSRAV-PXNSSMCTSA-N 0 3 402.970 4.076 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)Cc2nc(-c3ccc(F)cc3)cs2)CN1Cc1ccccc1 ZINC000477348906 892315655 /nfs/dbraw/zinc/31/56/55/892315655.db2.gz GSNSBWHAHGNPAY-OXJNMPFZSA-N 0 3 409.530 4.271 20 0 HIADHN CC(C)(C)NC(=O)c1ccc(NC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000504914019 913649698 /nfs/dbraw/zinc/64/96/98/913649698.db2.gz JLECHDWINULFQN-OAQYLSRUSA-N 0 3 408.546 4.001 20 0 HIADHN C[C@@H]1CSc2ccc(Br)cc2[C@H]1NC(=O)N(C)[C@@H]1CCN(C2CC2)C1 ZINC000477419838 892372264 /nfs/dbraw/zinc/37/22/64/892372264.db2.gz RQRIKQSVCMYGSQ-DWQUBVKVSA-N 0 3 424.408 4.110 20 0 HIADHN C[C@H](NC(=O)N(C)[C@H]1CCN(C2CC2)C1)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000477445374 892395990 /nfs/dbraw/zinc/39/59/90/892395990.db2.gz PMQBTAUZLFCKBX-JTSKRJEESA-N 0 3 411.521 4.344 20 0 HIADHN Cc1cccc(C(=O)N2CCCC2)c1NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000504922846 913658732 /nfs/dbraw/zinc/65/87/32/913658732.db2.gz DFTMVLRQFLUDQB-OAQYLSRUSA-N 0 3 420.557 4.017 20 0 HIADHN CCN(C(=O)c1cn(CC(F)(F)F)nc1C)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000477469577 892446098 /nfs/dbraw/zinc/44/60/98/892446098.db2.gz IAYFOLXDNWSABL-SJLPKXTDSA-N 0 3 408.468 4.051 20 0 HIADHN CCO[C@@H]1C[C@H](N[C@@H](C)c2c(C)nn(CC(F)(F)F)c2C)[C@@H]1Oc1ccccc1 ZINC000477489304 892487791 /nfs/dbraw/zinc/48/77/91/892487791.db2.gz BIPJLFBPISYFGX-NTCOEUGSSA-N 0 3 411.468 4.338 20 0 HIADHN COc1cc(NC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)c(OC)cc1Cl ZINC000504929807 913669708 /nfs/dbraw/zinc/66/97/08/913669708.db2.gz LEZUPIYTSDGUTR-MRXNPFEDSA-N 0 3 403.910 4.143 20 0 HIADHN O=S(=O)(CCCNC1(c2ccc(Br)cc2)CC1)c1ccc(F)cc1 ZINC000477513179 892525507 /nfs/dbraw/zinc/52/55/07/892525507.db2.gz OEDOTUZXZKRYHI-UHFFFAOYSA-N 0 3 412.324 4.031 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)Cc3c[nH]c4cccc(C)c34)CC2)c1 ZINC000504930775 913672710 /nfs/dbraw/zinc/67/27/10/913672710.db2.gz SSUJFTFQZXQVKS-UHFFFAOYSA-N 0 3 418.585 4.046 20 0 HIADHN C[C@@H](c1ccc(C(F)(F)F)cc1)N(C)S(=O)(=O)c1ccc(CN(C)C)cc1 ZINC000477537852 892574167 /nfs/dbraw/zinc/57/41/67/892574167.db2.gz SGXZRGDHVBLYPD-AWEZNQCLSA-N 0 3 400.466 4.149 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1cccn(Cc2ccc(C)cc2)c1=O)c1ccco1 ZINC000477584389 892651872 /nfs/dbraw/zinc/65/18/72/892651872.db2.gz CQKPGZFMLGHXRV-GHTZIAJQSA-N 0 3 422.529 4.049 20 0 HIADHN O=C(CN1CCC[C@H]1C1CCC1)N(Cc1cccs1)c1ccc2c(c1)OCCO2 ZINC000477618393 892719604 /nfs/dbraw/zinc/71/96/04/892719604.db2.gz VEPFSMWEIZUFAM-FQEVSTJZSA-N 0 3 412.555 4.317 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)CCCC(=O)c3ccc(C)cc3)c(C)c2)CC1 ZINC000477646868 892772885 /nfs/dbraw/zinc/77/28/85/892772885.db2.gz UUKJLXGFLWGXFE-UHFFFAOYSA-N 0 3 407.558 4.437 20 0 HIADHN Cc1c(C(=O)Nc2cccc(CN3CCC(CO)CC3)c2)sc2nccc(C)c12 ZINC000477690143 892811739 /nfs/dbraw/zinc/81/17/39/892811739.db2.gz CMKFYSNBMDKRRA-UHFFFAOYSA-N 0 3 409.555 4.370 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)c1ccc(Br)c(Cl)c1 ZINC000477732337 892830929 /nfs/dbraw/zinc/83/09/29/892830929.db2.gz VZRZGSAWRXXOLL-UHFFFAOYSA-N 0 3 401.757 4.368 20 0 HIADHN COc1ccc(CCC(=O)Nc2cccc(CN3CCC(CO)CC3)c2)cc1Cl ZINC000477731698 892831265 /nfs/dbraw/zinc/83/12/65/892831265.db2.gz NGZVPRPAWQNPCD-UHFFFAOYSA-N 0 3 416.949 4.124 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1ccc(F)c(Br)c1 ZINC000477740392 892836582 /nfs/dbraw/zinc/83/65/82/892836582.db2.gz MTVBFRCKYBCQOX-UHFFFAOYSA-N 0 3 421.310 4.045 20 0 HIADHN CC(C)[C@H]1CC[C@@H](C)C[C@@H]1OCC(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000477749512 892842515 /nfs/dbraw/zinc/84/25/15/892842515.db2.gz ZPGYQMNOGGDKQE-FOVJLYNBSA-N 0 3 416.606 4.307 20 0 HIADHN C[C@H](NC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1)c1ccc(Br)cn1 ZINC000477806337 892878314 /nfs/dbraw/zinc/87/83/14/892878314.db2.gz LUAYOOZTWGZIBJ-HOCLYGCPSA-N 0 3 420.326 4.073 20 0 HIADHN C[C@@H](NC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1)c1ccc(Br)cn1 ZINC000477806339 892878463 /nfs/dbraw/zinc/87/84/63/892878463.db2.gz LUAYOOZTWGZIBJ-ZBFHGGJFSA-N 0 3 420.326 4.073 20 0 HIADHN COC(=O)c1csc(-c2cccc(CN[C@H](C)c3ccc4c(c3)OCCO4)c2)n1 ZINC000477867771 892926288 /nfs/dbraw/zinc/92/62/88/892926288.db2.gz UFXCFHANXFTFJD-CQSZACIVSA-N 0 3 410.495 4.219 20 0 HIADHN C[C@H](N[C@H]1CCCc2nc(-c3ccc(Br)cc3)sc21)C(=O)N(C)C ZINC000477908877 892982596 /nfs/dbraw/zinc/98/25/96/892982596.db2.gz CINCMZFRLNBRFO-FZMZJTMJSA-N 0 3 408.365 4.016 20 0 HIADHN Cc1ccc(CN2CC[C@H](N[C@@H](C)CC(=O)Nc3ccccc3C(C)C)C2=O)cc1 ZINC000477915615 892996150 /nfs/dbraw/zinc/99/61/50/892996150.db2.gz LFSIOKVYCQGQIT-CVDCTZTESA-N 0 3 407.558 4.226 20 0 HIADHN Cc1ccc(CN2CC[C@@H](N[C@@H](C)CC(=O)Nc3ccccc3C(C)C)C2=O)cc1 ZINC000477915617 892996884 /nfs/dbraw/zinc/99/68/84/892996884.db2.gz LFSIOKVYCQGQIT-WMZHIEFXSA-N 0 3 407.558 4.226 20 0 HIADHN Cc1ccc(CN2CC[C@@H](N[C@@H](C)CC(=O)Nc3ccc(C)cc3Cl)C2=O)cc1 ZINC000477917343 892999544 /nfs/dbraw/zinc/99/95/44/892999544.db2.gz NSLVMJXIURFTEM-LAUBAEHRSA-N 0 3 413.949 4.065 20 0 HIADHN CCOC[C@@H]1CCN(C(=O)NC[C@H](c2ccc(C(F)(F)F)cc2)N(CC)CC)C1 ZINC000477922654 893009989 /nfs/dbraw/zinc/00/99/89/893009989.db2.gz ZKOAFJQZXSPYSC-VQIMIIECSA-N 0 3 415.500 4.156 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)c1ccc(-c2cncnc2)cc1F ZINC000477929468 893017444 /nfs/dbraw/zinc/01/74/44/893017444.db2.gz XGGXPCWQPHHGKY-HSZRJFAPSA-N 0 3 406.505 4.169 20 0 HIADHN Cc1c(NC(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)cnn1-c1ccccc1 ZINC000477939758 893031127 /nfs/dbraw/zinc/03/11/27/893031127.db2.gz NBMUZWKQTQWIIB-HSZRJFAPSA-N 0 3 421.545 4.392 20 0 HIADHN CN(C(=O)N[C@@H]1CCC[C@H]1c1ccccc1)C1CCN(CCc2ccccn2)CC1 ZINC000477947078 893038085 /nfs/dbraw/zinc/03/80/85/893038085.db2.gz ZFBHWYTWJNWSAA-BJKOFHAPSA-N 0 3 406.574 4.066 20 0 HIADHN CCCN(C(=O)CCc1nc(-c2ccco2)no1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000504984127 913729196 /nfs/dbraw/zinc/72/91/96/913729196.db2.gz YWWMHADPJRLWLL-HXUWFJFHSA-N 0 3 422.529 4.165 20 0 HIADHN CCCN(C(=O)Cc1ccc(NC(C)=O)cc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000505017541 913759434 /nfs/dbraw/zinc/75/94/34/913759434.db2.gz XJIJOWCFEMTZTK-XMMPIXPASA-N 0 3 407.558 4.091 20 0 HIADHN CCCN(C(=O)c1ccc(-n2cccn2)cc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000505025274 913766247 /nfs/dbraw/zinc/76/62/47/913766247.db2.gz ZWTMJBQMBPUQQE-XMMPIXPASA-N 0 3 402.542 4.389 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)CCNCc1cccc(C(=O)OC(C)(C)C)c1 ZINC000478298994 893515885 /nfs/dbraw/zinc/51/58/85/893515885.db2.gz MMAKHSLMZWXXJB-UHFFFAOYSA-N 0 3 418.921 4.422 20 0 HIADHN CCCN(C(=O)C[C@H](NC(C)=O)c1ccccc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000505036598 913776008 /nfs/dbraw/zinc/77/60/08/913776008.db2.gz YBHKFTODUCBEEE-RPBOFIJWSA-N 0 3 421.585 4.157 20 0 HIADHN CCCN(C(=O)C[C@@H](NC(C)=O)c1ccccc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000505036597 913777426 /nfs/dbraw/zinc/77/74/26/913777426.db2.gz YBHKFTODUCBEEE-LOSJGSFVSA-N 0 3 421.585 4.157 20 0 HIADHN CN1C[C@@H](c2ccccc2)[C@H](NC(=O)Cc2csc(-c3ccccc3Cl)n2)C1 ZINC000478370942 893633363 /nfs/dbraw/zinc/63/33/63/893633363.db2.gz MZHQSIRGROGKDS-AZUAARDMSA-N 0 3 411.958 4.220 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)NCc2c(OC)ccc3ccccc32)c1 ZINC000478380692 893651143 /nfs/dbraw/zinc/65/11/43/893651143.db2.gz RHKXTHMGWAETOQ-UHFFFAOYSA-N 0 3 421.541 4.130 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)N1CC2(CCOCC2)c2ccccc21 ZINC000478428728 893725656 /nfs/dbraw/zinc/72/56/56/893725656.db2.gz JKSOEOCWNDXDTQ-FQEVSTJZSA-N 0 3 411.571 4.163 20 0 HIADHN CCCN(CCN(C)C)C(=O)C[C@@H](NC(=O)c1ccccc1Cl)c1ccccc1 ZINC000478433490 893734735 /nfs/dbraw/zinc/73/47/35/893734735.db2.gz PMIHPXGDDFAIDX-OAQYLSRUSA-N 0 3 415.965 4.001 20 0 HIADHN CN1C[C@@H](NC(=O)CCc2ncc(-c3ccccc3Cl)o2)[C@@H](c2ccccc2)C1 ZINC000478453023 893769375 /nfs/dbraw/zinc/76/93/75/893769375.db2.gz SGWGSXOTWHFIFU-UYAOXDASSA-N 0 3 409.917 4.142 20 0 HIADHN CN(C)[C@@H](CNC(=O)N(C)Cc1ccc(F)cc1Br)c1ccccc1 ZINC000478452143 893769883 /nfs/dbraw/zinc/76/98/83/893769883.db2.gz YQFQGGKJGJPLFU-SFHVURJKSA-N 0 3 408.315 4.033 20 0 HIADHN COc1cnccc1N1CCN(C(=O)c2cc(SC)c(Cl)cc2Cl)CC1 ZINC000478470074 893799811 /nfs/dbraw/zinc/79/98/11/893799811.db2.gz CZBHSFRRSXLOLD-UHFFFAOYSA-N 0 3 412.342 4.081 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)N[C@H](c2nccs2)c2ccccc2)c1 ZINC000478619401 893878835 /nfs/dbraw/zinc/87/88/35/893878835.db2.gz KKBYNGBOFQKRCN-NRFANRHFSA-N 0 3 424.570 4.015 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)N[C@@H](C)c2cccc(OC(F)F)c2)c1 ZINC000478767096 894042659 /nfs/dbraw/zinc/04/26/59/894042659.db2.gz PHYKCTCMELVABM-INIZCTEOSA-N 0 3 421.488 4.131 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)Nc1cccc2c1CN(c1ccccn1)C2)c1ccco1 ZINC000479019439 894285522 /nfs/dbraw/zinc/28/55/22/894285522.db2.gz PYFKWNDXAUAZSF-DYESRHJHSA-N 0 3 419.529 4.446 20 0 HIADHN CCS[C@@H]1CCC[C@H](N[C@@H](C)c2cc(S(N)(=O)=O)c(Cl)cc2Cl)C1 ZINC000479058987 894318275 /nfs/dbraw/zinc/31/82/75/894318275.db2.gz KWYNZFPBNXTBML-SDDRHHMPSA-N 0 3 411.420 4.356 20 0 HIADHN Cc1ccc([C@@H](C)CN[C@H](C)c2cc(S(N)(=O)=O)c(Cl)cc2Cl)cc1 ZINC000479077501 894341395 /nfs/dbraw/zinc/34/13/95/894341395.db2.gz MDUIHZDVBSVZJX-QWHCGFSZSA-N 0 3 401.359 4.404 20 0 HIADHN C[C@H](NC[C@H]1CCCO[C@H]1C(C)(C)C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479080971 894347363 /nfs/dbraw/zinc/34/73/63/894347363.db2.gz OTOBLFKCBRLYSP-XWCIJXRUSA-N 0 3 423.406 4.133 20 0 HIADHN CC[C@H](C)NC(=O)[C@@H]1C[C@H](C)N(Cc2nnc(-c3ccco3)o2)[C@@H]2CCCC[C@@H]12 ZINC000479106958 894371661 /nfs/dbraw/zinc/37/16/61/894371661.db2.gz KAFYMHDDXRVBIC-NNPSNHGLSA-N 0 3 400.523 4.014 20 0 HIADHN CC[C@H](C)NC(=O)[C@@H]1C[C@H](C)N(CC(=O)Nc2ccc(C)cc2C)[C@@H]2CCCC[C@@H]12 ZINC000479107722 894373976 /nfs/dbraw/zinc/37/39/76/894373976.db2.gz SYKYJQVIBYHHIW-YKZCJQPKSA-N 0 3 413.606 4.426 20 0 HIADHN COc1cc2c(cc1OC)[C@@H](NCc1cccc(NC(=O)c3ccccn3)c1)CC2 ZINC000479330414 894623268 /nfs/dbraw/zinc/62/32/68/894623268.db2.gz KITCNFGWCSUAGG-FQEVSTJZSA-N 0 3 403.482 4.128 20 0 HIADHN CNS(=O)(=O)c1ccc([C@H](C)N[C@@H]2CCCc3cc(Br)ccc32)cc1 ZINC000479344516 894639569 /nfs/dbraw/zinc/63/95/69/894639569.db2.gz KZZWESAIKGSLFJ-ORAYPTAESA-N 0 3 423.376 4.085 20 0 HIADHN C[C@@H](Cc1ccccc1F)N[C@@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479354649 894651243 /nfs/dbraw/zinc/65/12/43/894651243.db2.gz CKJBITIOWQHPRJ-QWRGUYRKSA-N 0 3 405.322 4.062 20 0 HIADHN COc1cc2c(cc1OC)[C@H](N[C@H]1CC(=O)N(C)[C@H]1c1ccc(Cl)c(F)c1)CC2 ZINC000479415375 894726037 /nfs/dbraw/zinc/72/60/37/894726037.db2.gz YHFGBZRRXVITLZ-FGSXEWAUSA-N 0 3 418.896 4.045 20 0 HIADHN COc1ccc(-c2ccncc2)cc1CN[C@@H]1CCN(C(=O)CCc2ccccc2)C1 ZINC000479431283 894744994 /nfs/dbraw/zinc/74/49/94/894744994.db2.gz YNUFKIUKOJZFFY-XMMPIXPASA-N 0 3 415.537 4.081 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@H](C)NCc2c(C)c3ccccc3n2C)cc1 ZINC000479440607 894757518 /nfs/dbraw/zinc/75/75/18/894757518.db2.gz WKNKZGDWZAMBTF-SFHVURJKSA-N 0 3 413.587 4.368 20 0 HIADHN CC(C)N1CCC[C@H](NCc2ccccc2-c2ccc(Cn3cccn3)cc2)C1=O ZINC000479443153 894758621 /nfs/dbraw/zinc/75/86/21/894758621.db2.gz YEARFCDRCBODFM-DEOSSOPVSA-N 0 3 402.542 4.087 20 0 HIADHN CC(C)N1CCC[C@@H](NCc2ccccc2-c2ccc(Cn3cccn3)cc2)C1=O ZINC000479443158 894759629 /nfs/dbraw/zinc/75/96/29/894759629.db2.gz YEARFCDRCBODFM-XMMPIXPASA-N 0 3 402.542 4.087 20 0 HIADHN Fc1ccc([C@H](NC2CC(N3CCC(C(F)(F)F)CC3)C2)c2cnccn2)cc1 ZINC000479472763 894795656 /nfs/dbraw/zinc/79/56/56/894795656.db2.gz VBRGKARQPLACAY-QLOJAFMTSA-N 0 3 408.443 4.100 20 0 HIADHN Cn1cc([C@H](NC2CC(N3CCC(C(F)(F)F)CC3)C2)c2cccc(F)c2)cn1 ZINC000479481453 894804472 /nfs/dbraw/zinc/80/44/72/894804472.db2.gz HJHDKKNFRUFJFY-SOAGJPPSSA-N 0 3 410.459 4.044 20 0 HIADHN Cn1ccc([C@H](NC2CC(N3CCC(C(F)(F)F)CC3)C2)c2ccc(F)cc2)n1 ZINC000479482493 894805866 /nfs/dbraw/zinc/80/58/66/894805866.db2.gz TZYYFARJDFNBQA-AFMYVXGZSA-N 0 3 410.459 4.044 20 0 HIADHN CC(=O)N1CCC[C@H](CN[C@@H](c2ccc3c(c2)OCCO3)c2ccccc2Cl)C1 ZINC000479489287 894810573 /nfs/dbraw/zinc/81/05/73/894810573.db2.gz JLBFGHXHZLGQIP-HXOBKFHXSA-N 0 3 414.933 4.049 20 0 HIADHN C[C@H](CNC(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1)Oc1ccccc1 ZINC000505251601 913906155 /nfs/dbraw/zinc/90/61/55/913906155.db2.gz PIMKVUPSKXJPJN-UTKZUKDTSA-N 0 3 406.448 4.025 20 0 HIADHN COc1ccc(-c2nc3c(s2)[C@H](NCC(=O)N2Cc4ccccc4C2)CCC3)cc1 ZINC000479519785 894830858 /nfs/dbraw/zinc/83/08/58/894830858.db2.gz UFECMQDAUAUYEL-HXUWFJFHSA-N 0 3 419.550 4.328 20 0 HIADHN CCN1CCN(c2ccccc2CNc2ccc3c(c2)CCC(=O)N3CC2CC2)CC1 ZINC000479594671 894876368 /nfs/dbraw/zinc/87/63/68/894876368.db2.gz SZDFQAKUBHWUOC-UHFFFAOYSA-N 0 3 418.585 4.130 20 0 HIADHN Cc1cc(C)n2c(CN[C@@H](c3cc(F)cc(Br)c3)C3CC3)cnc2n1 ZINC000479598659 894878733 /nfs/dbraw/zinc/87/87/33/894878733.db2.gz BZVCXMGBOWPYCX-GOSISDBHSA-N 0 3 403.299 4.489 20 0 HIADHN CCOc1ccc([C@H](C)NC(=O)NC[C@H](c2ccc(CC)cc2)N(C)C)cc1OC ZINC000505268582 913924941 /nfs/dbraw/zinc/92/49/41/913924941.db2.gz MGGSMGSFGHIUNA-LAUBAEHRSA-N 0 3 413.562 4.319 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)N[C@@H](C)c1ccc(NC(=O)C2CC2)cc1 ZINC000479726852 895024376 /nfs/dbraw/zinc/02/43/76/895024376.db2.gz JGMTXHXJZOYUNS-SFHVURJKSA-N 0 3 400.567 4.004 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)NCc1ncoc1-c1ccccc1 ZINC000479728002 895025259 /nfs/dbraw/zinc/02/52/59/895025259.db2.gz DYRSLRWDENVMGO-LJQANCHMSA-N 0 3 404.514 4.148 20 0 HIADHN CCc1nc2c(s1)[C@H](N(C)C(=O)N[C@H]1C[C@H](C)N(Cc3ccccc3)C1)CCC2 ZINC000479734013 895033141 /nfs/dbraw/zinc/03/31/41/895033141.db2.gz HLEKRPXYHDNIFU-XKGZKEIXSA-N 0 3 412.603 4.387 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)N1CCCn2c(cc3ccccc32)C1 ZINC000479760918 895062648 /nfs/dbraw/zinc/06/26/48/895062648.db2.gz ZAWZIFHOEVRSLM-UHFFFAOYSA-N 0 3 402.542 4.005 20 0 HIADHN COc1cc([C@H](C)NC(=O)N[C@@H](CN(C)C)c2ccc(F)cc2)ccc1OC(C)C ZINC000479790013 895094703 /nfs/dbraw/zinc/09/47/03/895094703.db2.gz QIGNYEKCNADVFV-JXFKEZNVSA-N 0 3 417.525 4.285 20 0 HIADHN C[C@H](NC[C@H](c1ccco1)N1CCCC1)c1ccccc1I ZINC000479853182 895186819 /nfs/dbraw/zinc/18/68/19/895186819.db2.gz PDIOYIHGLHPREA-WMLDXEAASA-N 0 3 410.299 4.372 20 0 HIADHN FC(F)(F)c1ccccc1N1CC[C@@H](NCc2ccc(Br)cn2)C1 ZINC000479867492 895208758 /nfs/dbraw/zinc/20/87/58/895208758.db2.gz VJKMBHONOQSEEW-CQSZACIVSA-N 0 3 400.242 4.231 20 0 HIADHN COc1ccccc1[C@@H](CN[C@H](C)c1nnn(-c2ccccc2)c1C)N1CCCC1 ZINC000479875099 895217203 /nfs/dbraw/zinc/21/72/03/895217203.db2.gz PPYFKCMYDWGANI-XMSQKQJNSA-N 0 3 405.546 4.072 20 0 HIADHN Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)C(=O)N(CCN(C)C)CC1CCCCC1 ZINC000479881750 895225974 /nfs/dbraw/zinc/22/59/74/895225974.db2.gz DMTQFRYHQMHLLZ-OAHLLOKOSA-N 0 3 416.532 4.136 20 0 HIADHN CC[C@@H](C)n1ncc(C(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)c1C ZINC000479901557 895249351 /nfs/dbraw/zinc/24/93/51/895249351.db2.gz MGQIOLUBYGYUGT-OAHLLOKOSA-N 0 3 410.484 4.385 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cnc(-c4ccccc4)nc3C)c(C)c2)CC1 ZINC000479945709 895300560 /nfs/dbraw/zinc/30/05/60/895300560.db2.gz HNFGSQMIYOUJEN-UHFFFAOYSA-N 0 3 415.541 4.155 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)c1cc2c(ccc3ccccc23)[nH]1 ZINC000479971293 895325383 /nfs/dbraw/zinc/32/53/83/895325383.db2.gz QSJIQQBJHGOZRE-UHFFFAOYSA-N 0 3 413.521 4.208 20 0 HIADHN Cc1nc(-c2cccc(C(=O)NCc3ccccc3CN3CCC(O)CC3)c2)cs1 ZINC000479979772 895332297 /nfs/dbraw/zinc/33/22/97/895332297.db2.gz KCHRBVLMNKRVHE-UHFFFAOYSA-N 0 3 421.566 4.005 20 0 HIADHN CCS(=O)(=O)Nc1ccc([C@@H](C)NCc2c(C)nn(-c3ccccc3)c2C)cc1 ZINC000480016805 895366201 /nfs/dbraw/zinc/36/62/01/895366201.db2.gz OQSPBJLMLRPHOI-MRXNPFEDSA-N 0 3 412.559 4.102 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1c(C)c(C(F)(F)F)nn1C)c1ccsc1 ZINC000480075984 895428735 /nfs/dbraw/zinc/42/87/35/895428735.db2.gz GGWYGOYEWXEZFS-CYBMUJFWSA-N 0 3 403.474 4.013 20 0 HIADHN CC[C@@H](c1ccccc1)[C@@H]1CCCN1CC(=O)NCC(=O)Nc1c(C)cc(C)cc1C ZINC000480078688 895432523 /nfs/dbraw/zinc/43/25/23/895432523.db2.gz ZEYVLBCREXEFNN-GOTSBHOMSA-N 0 3 421.585 4.325 20 0 HIADHN COc1ccc([C@@H](CN[C@@H](C)c2cc(OC)c(OC)cc2F)N2CCCC2)cc1 ZINC000480087502 895448723 /nfs/dbraw/zinc/44/87/23/895448723.db2.gz XEZOSUDUUHJXDB-HRAATJIYSA-N 0 3 402.510 4.339 20 0 HIADHN Cc1ccc(C(=O)N(C)CCN(C)C)cc1OCc1csc(Br)c1 ZINC000480090649 895454022 /nfs/dbraw/zinc/45/40/22/895454022.db2.gz LLKHDJUMOMIKGH-UHFFFAOYSA-N 0 3 411.365 4.032 20 0 HIADHN CN(C)CCN(C)C(=O)C12C[C@H]3C[C@@H](C1)CC(C(F)(F)[C@@H](F)C(F)(F)F)(C3)C2 ZINC000480097660 895464490 /nfs/dbraw/zinc/46/44/90/895464490.db2.gz YVFWPAVZVKYCTN-AUPQCFOMSA-N 0 3 414.434 4.129 20 0 HIADHN C[C@@H](N[C@@H](C)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1cccc2ccccc21 ZINC000480098892 895466286 /nfs/dbraw/zinc/46/62/86/895466286.db2.gz YASSNQXUOJRDFN-RBUKOAKNSA-N 0 3 424.566 4.273 20 0 HIADHN Cc1sc2ncnc(Sc3ccccc3C(=O)N(C)CCN(C)C)c2c1C ZINC000480111082 895482521 /nfs/dbraw/zinc/48/25/21/895482521.db2.gz SKPMHNRSCBJXIB-UHFFFAOYSA-N 0 3 400.573 4.093 20 0 HIADHN CC(C)[C@@H](CN[C@H]1CCS(=O)(=O)c2ccc(Br)cc21)c1cccnc1 ZINC000480173094 895564918 /nfs/dbraw/zinc/56/49/18/895564918.db2.gz VFRHFIPEMFZUPJ-MSOLQXFVSA-N 0 3 423.376 4.092 20 0 HIADHN COc1ccc2c(c1)[C@H](NCc1ccc(CN3C[C@H](C)O[C@@H](C)C3)cc1)CCCO2 ZINC000480241884 895651756 /nfs/dbraw/zinc/65/17/56/895651756.db2.gz QQJCKUBKMOBFOG-AXHZCLLHSA-N 0 3 410.558 4.308 20 0 HIADHN C[C@H](NC[C@H](c1ccsc1)N(C)C)c1ccccc1I ZINC000480245443 895656801 /nfs/dbraw/zinc/65/68/01/895656801.db2.gz IQUUTZCCRHPZBB-BLLLJJGKSA-N 0 3 400.329 4.306 20 0 HIADHN Cc1ccc(CCN[C@@H]2CCS(=O)(=O)c3ccc(Br)cc32)c(C)c1 ZINC000480262262 895670038 /nfs/dbraw/zinc/67/00/38/895670038.db2.gz INHBGVFVKSMEQQ-GOSISDBHSA-N 0 3 408.361 4.117 20 0 HIADHN COc1ccc(OCCN[C@@H](C)c2ccc(S(=O)(=O)C3CCCC3)cc2)cc1 ZINC000480436165 895827354 /nfs/dbraw/zinc/82/73/54/895827354.db2.gz HYZNMWBEEZJWBQ-KRWDZBQOSA-N 0 3 403.544 4.141 20 0 HIADHN Cc1nc(-c2cccnc2)sc1[C@@H](C)N[C@H](CN1CCOCC1)c1ccccc1 ZINC000480457050 895843797 /nfs/dbraw/zinc/84/37/97/895843797.db2.gz WCXFVHZJHILPLJ-DYESRHJHSA-N 0 3 408.571 4.238 20 0 HIADHN COC(=O)c1csc(-c2cccc(CNCc3c[nH]nc3-c3ccccc3F)c2)n1 ZINC000480469320 895851790 /nfs/dbraw/zinc/85/17/90/895851790.db2.gz MXVPVENNEUUAOV-UHFFFAOYSA-N 0 3 422.485 4.416 20 0 HIADHN COc1ccc(CNCCCOc2ccc(C(F)(F)F)cn2)c(Cl)c1OC ZINC000480483177 895860549 /nfs/dbraw/zinc/86/05/49/895860549.db2.gz UCIITBPNNPSESN-UHFFFAOYSA-N 0 3 404.816 4.330 20 0 HIADHN CCOc1c(Cl)cccc1CC(=O)Nc1cccc2c1CCN(CC(C)(C)O)C2 ZINC000480542840 895904463 /nfs/dbraw/zinc/90/44/63/895904463.db2.gz UJJPZCOKRAJEPR-UHFFFAOYSA-N 0 3 416.949 4.049 20 0 HIADHN COc1cc([C@H](C)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)nc2)ccc1SC ZINC000480599727 895962350 /nfs/dbraw/zinc/96/23/50/895962350.db2.gz COLJXDXDDJPBGS-ULQDDVLXSA-N 0 3 401.576 4.277 20 0 HIADHN CC[C@H](C)n1nc(NC(=O)Nc2ccc(CCN3CCSCC3)cc2)cc1C ZINC000480645572 896013569 /nfs/dbraw/zinc/01/35/69/896013569.db2.gz LNWWPILUGGNAAG-INIZCTEOSA-N 0 3 401.580 4.398 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)N1CCC[C@@H]1c1ccc2c(c1)OCO2 ZINC000480652833 896021658 /nfs/dbraw/zinc/02/16/58/896021658.db2.gz XPPOEBRGFIWQQS-RTWAWAEBSA-N 0 3 407.514 4.099 20 0 HIADHN Cc1ccc([C@@H](CNCc2ccc(-c3cccc(F)c3F)o2)N2CCOCC2)o1 ZINC000480660781 896027750 /nfs/dbraw/zinc/02/77/50/896027750.db2.gz HFYNBXIJURQEGS-LJQANCHMSA-N 0 3 402.441 4.289 20 0 HIADHN C[C@@H](NCc1ccnc(N2CCN(C)CC2)c1)c1ccccc1OCc1ccccc1 ZINC000480709125 896070663 /nfs/dbraw/zinc/07/06/63/896070663.db2.gz MQSWGFDMWVNLGZ-OAQYLSRUSA-N 0 3 416.569 4.263 20 0 HIADHN C[C@H](NCc1ccnc(N2CCN(C)CC2)c1)c1ccccc1OCc1ccccc1 ZINC000480709123 896071417 /nfs/dbraw/zinc/07/14/17/896071417.db2.gz MQSWGFDMWVNLGZ-NRFANRHFSA-N 0 3 416.569 4.263 20 0 HIADHN COc1cc([C@@H](C)N[C@H](C)c2ccc(-n3cnnn3)cc2)ccc1OC1CCCC1 ZINC000480731703 896092458 /nfs/dbraw/zinc/09/24/58/896092458.db2.gz CQNYTISMZPMSKO-IAGOWNOFSA-N 0 3 407.518 4.404 20 0 HIADHN C[C@@H](NCc1ccnc(N2CCN(C)CC2)c1)c1ccc(Oc2ccccc2)cc1 ZINC000480734489 896095180 /nfs/dbraw/zinc/09/51/80/896095180.db2.gz IRDSLXDHBDDMHD-HXUWFJFHSA-N 0 3 402.542 4.477 20 0 HIADHN CCCOc1ccc([C@H](C)N[C@H](C)c2ccc(NS(C)(=O)=O)cc2)cc1OC ZINC000480737433 896097539 /nfs/dbraw/zinc/09/75/39/896097539.db2.gz ILFGBNFTFSREJX-CVEARBPZSA-N 0 3 406.548 4.267 20 0 HIADHN C[C@H](NCCCCN1C(=O)NC2(CCCC2)C1=O)c1cc(F)c(Cl)cc1Cl ZINC000480745865 896107488 /nfs/dbraw/zinc/10/74/88/896107488.db2.gz PFAUHAUFSSWMRZ-LBPRGKRZSA-N 0 3 416.324 4.428 20 0 HIADHN COc1ccc2ccccc2c1-c1cc(CN2CCC(N3CCO[C@H](C)C3)CC2)on1 ZINC000480746247 896108043 /nfs/dbraw/zinc/10/80/43/896108043.db2.gz FXCVXJSUKDXLRU-GOSISDBHSA-N 0 3 421.541 4.189 20 0 HIADHN CNS(=O)(=O)c1ccc([C@H](C)NCc2ccccc2COCc2ccccc2)cc1 ZINC000480753962 896115667 /nfs/dbraw/zinc/11/56/67/896115667.db2.gz JZRNERICVWAOOL-IBGZPJMESA-N 0 3 424.566 4.162 20 0 HIADHN COCCOc1ccc(CN[C@@H]2CCCOc3ccc(Br)cc32)cc1 ZINC000480767386 896128368 /nfs/dbraw/zinc/12/83/68/896128368.db2.gz HNRYXYSUADGGMP-LJQANCHMSA-N 0 3 406.320 4.478 20 0 HIADHN COCCOc1ccc(CN[C@H]2CCCOc3ccc(Br)cc32)cc1 ZINC000480767385 896128786 /nfs/dbraw/zinc/12/87/86/896128786.db2.gz HNRYXYSUADGGMP-IBGZPJMESA-N 0 3 406.320 4.478 20 0 HIADHN C[C@H](N[C@@H]1CCCc2c1cnn2C)c1cccc(OCc2cn3ccccc3n2)c1 ZINC000480766439 896129195 /nfs/dbraw/zinc/12/91/95/896129195.db2.gz FMVZSJIFWVJIHA-HTAPYJJXSA-N 0 3 401.514 4.375 20 0 HIADHN CCCN(CC(=O)Nc1ccc(Cl)cc1)CC1CCN(C(=O)C(C)(C)C)CC1 ZINC000480771672 896135840 /nfs/dbraw/zinc/13/58/40/896135840.db2.gz VMBHLILMAFFCLN-UHFFFAOYSA-N 0 3 407.986 4.275 20 0 HIADHN O=C1CCCN1Cc1ccc(CN[C@@H]2CCc3ccc(OC(F)(F)F)cc32)cc1 ZINC000480874215 896233162 /nfs/dbraw/zinc/23/31/62/896233162.db2.gz DQGYMCKXVPARJB-HXUWFJFHSA-N 0 3 404.432 4.485 20 0 HIADHN CCS(=O)(=O)Nc1ccc([C@H](C)NCc2cc(F)cc(Br)c2)cc1 ZINC000480884653 896240087 /nfs/dbraw/zinc/24/00/87/896240087.db2.gz TUXDOMHADJJBLX-LBPRGKRZSA-N 0 3 415.328 4.201 20 0 HIADHN COc1cccc(C[C@@H](NCc2ccc(CS(C)(=O)=O)cc2)c2ccccc2)c1 ZINC000480891905 896249074 /nfs/dbraw/zinc/24/90/74/896249074.db2.gz XTMKTIUIUNRGLT-XMMPIXPASA-N 0 3 409.551 4.313 20 0 HIADHN C[C@@H](NCc1ccc(CN2CCN(C)CC2)cc1)c1ccc(F)cc1Br ZINC000480896469 896252771 /nfs/dbraw/zinc/25/27/71/896252771.db2.gz CNNDEQKQOSSMAT-MRXNPFEDSA-N 0 3 420.370 4.186 20 0 HIADHN C[C@@H](NCCNC(=O)c1ccc(Br)cc1)c1cnc2ccsc2c1 ZINC000480907491 896264128 /nfs/dbraw/zinc/26/41/28/896264128.db2.gz GMHZZUXOTPHKSI-GFCCVEGCSA-N 0 3 404.333 4.139 20 0 HIADHN COCCOc1ccc([C@H](C)NCc2cccc(NC(=O)c3ccncc3)c2)cc1 ZINC000480914370 896272700 /nfs/dbraw/zinc/27/27/00/896272700.db2.gz VJFCJUOWRNERFM-SFHVURJKSA-N 0 3 405.498 4.210 20 0 HIADHN Cc1cc(NC(=O)N(CC2CC2)CC2CC2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000481003756 896334866 /nfs/dbraw/zinc/33/48/66/896334866.db2.gz LBUMWRRUPVOLPK-QFIPXVFZSA-N 0 3 407.562 4.292 20 0 HIADHN CCS[C@@H]1CCCCN(CC(=O)N2CCC[C@H]2c2ccc3c(c2)OCCCO3)C1 ZINC000481078265 896397324 /nfs/dbraw/zinc/39/73/24/896397324.db2.gz QWIRCSBYUBPQQA-UXHICEINSA-N 0 3 418.603 4.119 20 0 HIADHN C[C@H](NCc1cccnc1N1CCN(C)CC1)c1ccccc1OCc1ccccc1 ZINC000481214142 896568824 /nfs/dbraw/zinc/56/88/24/896568824.db2.gz NIQSHSURZWNOKD-NRFANRHFSA-N 0 3 416.569 4.263 20 0 HIADHN O=C(CN[C@H](CC1CCC1)c1ccccc1)NCc1ccc(C(=O)N2CCCC2)cc1 ZINC000481229904 896579887 /nfs/dbraw/zinc/57/98/87/896579887.db2.gz BQVAEDQTLHBEOM-XMMPIXPASA-N 0 3 419.569 4.060 20 0 HIADHN CN1CCN(c2ncccc2CN[C@@H](CCc2ccccc2)c2ccccc2)CC1 ZINC000481242021 896592333 /nfs/dbraw/zinc/59/23/33/896592333.db2.gz MNQHOQSPCZYYGO-VWLOTQADSA-N 0 3 400.570 4.297 20 0 HIADHN Cc1c([C@@H](C)NCCCS(=O)(=O)c2ccccc2)cnn1-c1cc(C)ccc1C ZINC000481242679 896593700 /nfs/dbraw/zinc/59/37/00/896593700.db2.gz PXMYQWWFPHMDIQ-LJQANCHMSA-N 0 3 411.571 4.312 20 0 HIADHN CN(C)C[C@H](NC(=O)N[C@@H](c1cccc(F)c1F)C(F)(F)F)c1ccc(F)cc1 ZINC000481291482 896636679 /nfs/dbraw/zinc/63/66/79/896636679.db2.gz XYSJSBHBBRAOFG-RDJZCZTQSA-N 0 3 419.369 4.309 20 0 HIADHN C[C@H]1CCCN(S(=O)(=O)c2ccc(CN[C@H]3CCCc4sccc43)cc2)C1 ZINC000481302009 896647484 /nfs/dbraw/zinc/64/74/84/896647484.db2.gz BQXXDJXBXZAFEQ-JXFKEZNVSA-N 0 3 404.601 4.336 20 0 HIADHN C[C@@H]1CCCN(S(=O)(=O)c2ccc(CN[C@@H]3CCc4cc(F)ccc43)cc2)C1 ZINC000481308231 896654797 /nfs/dbraw/zinc/65/47/97/896654797.db2.gz GBEKUWHHDJKYGK-OPAMFIHVSA-N 0 3 402.535 4.023 20 0 HIADHN Cc1c([C@H](C)NC2CCN(Cc3ccc(F)cc3)CC2)nnn1-c1ccc(F)cc1 ZINC000481309032 896656491 /nfs/dbraw/zinc/65/64/91/896656491.db2.gz HCGSIBOJHLRICJ-INIZCTEOSA-N 0 3 411.500 4.169 20 0 HIADHN COc1ccc(-c2nnc(NC(=O)N[C@H](C)[C@H](c3ccccc3)N(C)C)s2)cc1 ZINC000481309603 896656710 /nfs/dbraw/zinc/65/67/10/896656710.db2.gz BVNRPIBZGNHPAS-RDTXWAMCSA-N 0 3 411.531 4.027 20 0 HIADHN Cc1cc(C)n(-c2ccc(CN[C@H](C)c3ccc(NC(=O)NC(C)C)cc3)cn2)n1 ZINC000481310936 896658537 /nfs/dbraw/zinc/65/85/37/896658537.db2.gz RKTYIYLLEOOAEE-GOSISDBHSA-N 0 3 406.534 4.265 20 0 HIADHN C[C@H](NCc1ccc(Oc2ccc(F)cc2)nc1)c1ccc(NS(C)(=O)=O)cc1 ZINC000481314810 896664984 /nfs/dbraw/zinc/66/49/84/896664984.db2.gz CGCOORFMDCSZQI-HNNXBMFYSA-N 0 3 415.490 4.235 20 0 HIADHN CC[C@@H](N[C@@H](C)c1ccccc1-n1cccn1)c1ccccc1OCC(=O)N(C)C ZINC000481324366 896681103 /nfs/dbraw/zinc/68/11/03/896681103.db2.gz YNPZYVAPQWZNBC-GHTZIAJQSA-N 0 3 406.530 4.141 20 0 HIADHN CC[C@@H](N[C@@H](C)c1ccc2c(c1)C(C)(C)C(=O)N2)c1ccccc1OCC(=O)N(C)C ZINC000481339730 896705337 /nfs/dbraw/zinc/70/53/37/896705337.db2.gz RFUSDUUWDBWMAR-OXJNMPFZSA-N 0 3 423.557 4.185 20 0 HIADHN C[C@@H](NCc1cccc(OCCN2CCOCC2)c1)c1cccc(OC(F)(F)F)c1 ZINC000481423714 896826444 /nfs/dbraw/zinc/82/64/44/896826444.db2.gz WDHVJTRUUKRLDB-QGZVFWFLSA-N 0 3 424.463 4.147 20 0 HIADHN CC(C)NC(=O)Nc1ccc([C@@H](C)NCc2cccc(NC(=O)[C@@H]3CCCO3)c2)cc1 ZINC000481535042 896896582 /nfs/dbraw/zinc/89/65/82/896896582.db2.gz PGVRMEKSFYWMOY-VGSWGCGISA-N 0 3 424.545 4.185 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)c1ccc(-c2cncnc2)cc1F ZINC000481541756 896900960 /nfs/dbraw/zinc/90/09/60/896900960.db2.gz UGKGKAFWIRHKKN-UHFFFAOYSA-N 0 3 412.896 4.140 20 0 HIADHN CCCOc1ccc([C@@H](C)NCc2ccc(S(=O)(=O)N(C)C(C)C)cc2)cc1 ZINC000481544125 896905025 /nfs/dbraw/zinc/90/50/25/896905025.db2.gz AKZOSSBDJKZLJB-GOSISDBHSA-N 0 3 404.576 4.355 20 0 HIADHN C[C@H](NCc1cccc(CN2CCO[C@@H](C)C2)c1)c1cnn(Cc2ccccc2)c1 ZINC000481550047 896918542 /nfs/dbraw/zinc/91/85/42/896918542.db2.gz ULCJVTSOSUUJOI-SFTDATJTSA-N 0 3 404.558 4.003 20 0 HIADHN COc1ccc(C2(CN[C@@H](C)c3nnn(-c4ccc(F)cc4)c3C)CCOCC2)cc1 ZINC000481562767 896940748 /nfs/dbraw/zinc/94/07/48/896940748.db2.gz MHBRHUMACWSVMW-KRWDZBQOSA-N 0 3 424.520 4.122 20 0 HIADHN C[C@H]1CCCCN(CC(=O)N(Cc2nnc(-c3ccccc3Cl)o2)C2CC2)C1 ZINC000481584640 896965090 /nfs/dbraw/zinc/96/50/90/896965090.db2.gz FXQKSVUVRLMSMF-HNNXBMFYSA-N 0 3 402.926 4.003 20 0 HIADHN CCO[C@@H](C)c1ncc(C(=O)Nc2cc(C)cc(N3CCN(C(C)C)CC3)c2)s1 ZINC000481647569 897032955 /nfs/dbraw/zinc/03/29/55/897032955.db2.gz TXXHEJFMQRJEPH-KRWDZBQOSA-N 0 3 416.591 4.332 20 0 HIADHN CC[C@H](N[C@@H](c1ccccc1)[C@H]1CCOC1)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000481659770 897043750 /nfs/dbraw/zinc/04/37/50/897043750.db2.gz JULHVBCZVKYQLL-CUWPLCDZSA-N 0 3 422.978 4.067 20 0 HIADHN CC1(C)CC[C@H](NCc2ccccc2OCC(=O)NC[C@H]2CCCO2)c2ccccc21 ZINC000481672692 897055435 /nfs/dbraw/zinc/05/54/35/897055435.db2.gz SGRIZMLYBCNTIW-OFNKIYASSA-N 0 3 422.569 4.263 20 0 HIADHN CC(C)(O)CN1CCc2c(cccc2NC(=O)C2(Cc3cccc(F)c3)CCC2)C1 ZINC000481675453 897059013 /nfs/dbraw/zinc/05/90/13/897059013.db2.gz LLGWRZRLCDNBNT-UHFFFAOYSA-N 0 3 410.533 4.306 20 0 HIADHN CCOC(=O)C[C@@](C)(NCC(=O)Nc1cc(C(F)(F)F)ccc1Cl)C(C)C ZINC000481703320 897091529 /nfs/dbraw/zinc/09/15/29/897091529.db2.gz QTTUBNQJCQJLER-QGZVFWFLSA-N 0 3 408.848 4.255 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1ccc2c(c1)CCC(=O)N2CC1CC1)c1ccco1 ZINC000481716998 897109875 /nfs/dbraw/zinc/10/98/75/897109875.db2.gz UWPOTKSSSUTFMO-JXFKEZNVSA-N 0 3 424.545 4.220 20 0 HIADHN CN(C(=O)NCCc1cccc(OCCCc2ccccc2)c1)[C@H]1CCN(C2CC2)C1 ZINC000481717340 897110183 /nfs/dbraw/zinc/11/01/83/897110183.db2.gz WNMPXWDKIBIHOF-DEOSSOPVSA-N 0 3 421.585 4.119 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1cc(F)c(OC)cc1C)c1cccc(OC)c1 ZINC000481724339 897117728 /nfs/dbraw/zinc/11/77/28/897117728.db2.gz HGJMPVREFLNACW-FQEVSTJZSA-N 0 3 403.498 4.356 20 0 HIADHN CC(C)C[C@@H]1OCCC[C@@H]1NCC(=O)N1N=C(c2ccco2)C[C@H]1c1cccs1 ZINC000481725057 897120050 /nfs/dbraw/zinc/12/00/50/897120050.db2.gz NSVSMTMVRNKUAZ-QRFRQXIXSA-N 0 3 415.559 4.202 20 0 HIADHN Cc1nn(-c2ccccc2C)c2sc(C(=O)N3CCC[C@@H](N4CCCC4)C3)cc12 ZINC000481751033 897142582 /nfs/dbraw/zinc/14/25/82/897142582.db2.gz RGZFVOONOZJQSM-GOSISDBHSA-N 0 3 408.571 4.404 20 0 HIADHN Cc1nc(-c2ccccc2C)sc1C(=O)NCCCCN1C[C@@H](C)O[C@H](C)C1 ZINC000481780238 897162284 /nfs/dbraw/zinc/16/22/84/897162284.db2.gz NOIMJHNIXYTGDW-IAGOWNOFSA-N 0 3 401.576 4.046 20 0 HIADHN O=C(NCC1(c2cccc(Cl)c2F)CCCC1)[C@@H]1CCCN1C1CCOCC1 ZINC000481863566 897232610 /nfs/dbraw/zinc/23/26/10/897232610.db2.gz DIWGTGRJSRVFLK-IBGZPJMESA-N 0 3 408.945 4.051 20 0 HIADHN COc1cccc(N2CC[C@@H](CN[C@H](C)c3nnn(-c4ccc(C)cc4)c3C)C2)c1 ZINC000481934423 897319649 /nfs/dbraw/zinc/31/96/49/897319649.db2.gz RUICWHOGHREACI-QUCCMNQESA-N 0 3 405.546 4.070 20 0 HIADHN CC(C)C[C@@H](N[C@@H](C)Cc1ccccc1C(F)(F)F)c1nc(-c2nc[nH]n2)no1 ZINC000481982367 897375573 /nfs/dbraw/zinc/37/55/73/897375573.db2.gz FPAIEDHFHOYQQC-SWLSCSKDSA-N 0 3 408.428 4.182 20 0 HIADHN COc1ccc(CCN[C@H](C)c2nnn(-c3ccc(C)cc3)c2C)cc1OC(F)F ZINC000482029469 897437804 /nfs/dbraw/zinc/43/78/04/897437804.db2.gz FBEKWFKMRQOYMQ-OAHLLOKOSA-N 0 3 416.472 4.387 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1ccc(Cl)cc1-n1cccn1)c1ccco1 ZINC000482044867 897465471 /nfs/dbraw/zinc/46/54/71/897465471.db2.gz GDCPWMAKXZSTBQ-WMLDXEAASA-N 0 3 401.898 4.370 20 0 HIADHN C[C@H](NCc1ccc([C@@]2(C)NC(=O)NC2=O)cc1)c1ccc(Oc2ccccc2)cc1 ZINC000482104224 897552326 /nfs/dbraw/zinc/55/23/26/897552326.db2.gz FNVTZKFDUTWFPW-SSOJOUAXSA-N 0 3 415.493 4.384 20 0 HIADHN C[C@@]1(c2ccc(CN[C@@H]3CCCSc4ccc(Cl)cc43)cc2)NC(=O)NC1=O ZINC000482108581 897558456 /nfs/dbraw/zinc/55/84/56/897558456.db2.gz PMXAPMZPRJKWIY-UTKZUKDTSA-N 0 3 415.946 4.111 20 0 HIADHN C[C@]1(c2ccc(CN[C@H]3CCCSc4ccc(Cl)cc43)cc2)NC(=O)NC1=O ZINC000482108579 897558727 /nfs/dbraw/zinc/55/87/27/897558727.db2.gz PMXAPMZPRJKWIY-LAUBAEHRSA-N 0 3 415.946 4.111 20 0 HIADHN CC(C)NC(=O)Nc1ccc([C@@H](C)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)cc1 ZINC000482118429 897571124 /nfs/dbraw/zinc/57/11/24/897571124.db2.gz DLKSYTWHJPJZBM-AUSIDOKSSA-N 0 3 422.573 4.101 20 0 HIADHN Cc1nc(-c2cccnc2)sc1[C@@H](C)N[C@H](Cc1ccccc1)C(=O)N1CCCC1 ZINC000482125093 897581236 /nfs/dbraw/zinc/58/12/36/897581236.db2.gz JCIGPNMWMZCFKA-DYESRHJHSA-N 0 3 420.582 4.398 20 0 HIADHN C[C@H](NCc1ccc(NC(=O)c2cccnc2)cc1)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000482148569 897610432 /nfs/dbraw/zinc/61/04/32/897610432.db2.gz TYXXOGDLZRKPPJ-INIZCTEOSA-N 0 3 414.509 4.414 20 0 HIADHN CCO[C@H]1C[C@@H](NCC(=O)Nc2c(C)nn(-c3ccc(C)cc3)c2C)C1(CC)CC ZINC000482148404 897610486 /nfs/dbraw/zinc/61/04/86/897610486.db2.gz LAHMHHZJERRENS-RTWAWAEBSA-N 0 3 412.578 4.309 20 0 HIADHN COC(=O)c1ccc(COc2ccc(CNCc3ccc(C)c(F)c3)cc2OC)o1 ZINC000482197736 897673243 /nfs/dbraw/zinc/67/32/43/897673243.db2.gz IYMFORLTBBANOB-UHFFFAOYSA-N 0 3 413.445 4.391 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)NC[C@@H]1CCCC[C@H]1C(F)(F)F ZINC000482218571 897698237 /nfs/dbraw/zinc/69/82/37/897698237.db2.gz UTMOVGBPAHFMSH-AZUAARDMSA-N 0 3 411.512 4.074 20 0 HIADHN COc1ccc([C@H](NC(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)C(F)(F)F)cc1 ZINC000482328084 897831140 /nfs/dbraw/zinc/83/11/40/897831140.db2.gz IRDONRZZUJADTK-ZTNFWEORSA-N 0 3 421.463 4.433 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)N[C@H](c3cccc(C(F)(F)F)c3)C(F)(F)F)[C@H]2C1 ZINC000482335207 897840205 /nfs/dbraw/zinc/84/02/05/897840205.db2.gz PMRKZUWNGXFCRE-BYCMXARLSA-N 0 3 409.374 4.044 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)c2csc(-c3ccccc3C)n2)c1 ZINC000482364686 897884148 /nfs/dbraw/zinc/88/41/48/897884148.db2.gz ZWMIGLCQVLQFKU-UHFFFAOYSA-N 0 3 409.555 4.331 20 0 HIADHN CC(=O)N[C@@H](C)C1CCN(Cc2cn(-c3ccccc3)nc2-c2ccc(C)o2)CC1 ZINC000482509776 898092772 /nfs/dbraw/zinc/09/27/72/898092772.db2.gz KWTQYDVMCLDSKB-SFHVURJKSA-N 0 3 406.530 4.177 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)c1nccnc1C(=O)Nc1ccc(Cl)cc1 ZINC000482593449 898193025 /nfs/dbraw/zinc/19/30/25/898193025.db2.gz OULSXSNAYIZRCJ-UHFFFAOYSA-N 0 3 423.904 4.005 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)Cc1csc(NC(=O)c2cccs2)n1 ZINC000482597947 898200209 /nfs/dbraw/zinc/20/02/09/898200209.db2.gz PLFZVZVXSKOJQV-UHFFFAOYSA-N 0 3 414.556 4.008 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)c1ccccc1 ZINC000482630379 898234095 /nfs/dbraw/zinc/23/40/95/898234095.db2.gz PUBMNOIFRGLNKK-NHTMILBNSA-N 0 3 419.569 4.469 20 0 HIADHN CC[C@H](C)C(=O)Nc1cccc(CNC(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)c1 ZINC000482638443 898241994 /nfs/dbraw/zinc/24/19/94/898241994.db2.gz XDDYIFQILKKEMF-SPEDKVCISA-N 0 3 410.562 4.162 20 0 HIADHN CN(CCOc1c(Br)cccc1Br)CCc1ccccn1 ZINC000482787991 898396240 /nfs/dbraw/zinc/39/62/40/898396240.db2.gz IKVILGFUMSQXDC-UHFFFAOYSA-N 0 3 414.141 4.160 20 0 HIADHN C[C@H](N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1)c1ccc(-n2cncn2)cc1 ZINC000482881718 898495870 /nfs/dbraw/zinc/49/58/70/898495870.db2.gz FCRCRXMUBXATNP-CYFREDJKSA-N 0 3 411.509 4.168 20 0 HIADHN Cc1nc2ccccc2n1C1CCN([C@@H](C)C(=O)N2CCc3sccc3C2)CC1 ZINC000482887684 898503017 /nfs/dbraw/zinc/50/30/17/898503017.db2.gz IXNYLGADRUWZIM-INIZCTEOSA-N 0 3 408.571 4.017 20 0 HIADHN C[C@@H](NCCC(=O)N(C)Cc1ccccc1Br)c1cc(F)cc(F)c1 ZINC000482888715 898505792 /nfs/dbraw/zinc/50/57/92/898505792.db2.gz KRUJORMVXGKMGD-CYBMUJFWSA-N 0 3 411.290 4.427 20 0 HIADHN O=C(NCc1ccccc1)c1ccc(NC(=O)N2CCN(C3CCCCC3)CC2)cc1 ZINC000482916639 898534728 /nfs/dbraw/zinc/53/47/28/898534728.db2.gz AXYUTSZEFIUFCO-UHFFFAOYSA-N 0 3 420.557 4.099 20 0 HIADHN O=C(Nc1ccccc1OC[C@H]1CCCCO1)N1CCN(C2CCCCC2)CC1 ZINC000482922112 898539746 /nfs/dbraw/zinc/53/97/46/898539746.db2.gz WDHISFRCRDQATI-HXUWFJFHSA-N 0 3 401.551 4.117 20 0 HIADHN Cc1cc(NC(=O)N2CCN(C3CCCCC3)CC2)ccc1NC(=O)c1ccco1 ZINC000482921416 898540261 /nfs/dbraw/zinc/54/02/61/898540261.db2.gz YOBSVBUDZGCHNY-UHFFFAOYSA-N 0 3 410.518 4.323 20 0 HIADHN C[C@H](NC[C@@H](O)Cc1ccc(C(F)(F)F)cc1)c1ccc(Br)cn1 ZINC000482946202 898571802 /nfs/dbraw/zinc/57/18/02/898571802.db2.gz IKYYQXJFHJRUCP-NHYWBVRUSA-N 0 3 403.242 4.117 20 0 HIADHN C[C@H](NCCC(=O)Nc1ccccc1)c1ccc(S(=O)(=O)C2CCCC2)cc1 ZINC000482957092 898586484 /nfs/dbraw/zinc/58/64/84/898586484.db2.gz HZVJHYHGBZACEK-KRWDZBQOSA-N 0 3 400.544 4.082 20 0 HIADHN C[C@H]1Cc2ccccc2[C@H]1NCc1ccccc1CN1C(=O)NC2(CCCCC2)C1=O ZINC000482968013 898600814 /nfs/dbraw/zinc/60/08/14/898600814.db2.gz ZGCLXXISYNDFRV-MBSDFSHPSA-N 0 3 417.553 4.464 20 0 HIADHN C[C@@H](NCc1ccccc1CN1C(=O)NC2(CCCCC2)C1=O)c1cccc(F)c1 ZINC000482973330 898607589 /nfs/dbraw/zinc/60/75/89/898607589.db2.gz SSLSLLVSIJRWHW-QGZVFWFLSA-N 0 3 409.505 4.431 20 0 HIADHN CO[C@]1(C)CCCN(CC(=O)N[C@@H](c2ccccc2)c2cccc(Cl)c2)CC1 ZINC000482996326 898640263 /nfs/dbraw/zinc/64/02/63/898640263.db2.gz FFCXPCUCXLDOQB-XZOQPEGZSA-N 0 3 400.950 4.437 20 0 HIADHN CO[C@@]1(C)CCCN(CC(=O)N[C@@H](c2ccccc2)c2cccc(Cl)c2)CC1 ZINC000482996324 898640764 /nfs/dbraw/zinc/64/07/64/898640764.db2.gz FFCXPCUCXLDOQB-GOTSBHOMSA-N 0 3 400.950 4.437 20 0 HIADHN C[C@H](NC(=O)Cc1c[nH]c2cc(Br)ccc12)[C@H](c1ccccc1)N(C)C ZINC000505574451 914280197 /nfs/dbraw/zinc/28/01/97/914280197.db2.gz JGINVYHCMPBMQC-LHSJRXKWSA-N 0 3 414.347 4.281 20 0 HIADHN COc1cc(NC(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)c(C)c(OC)c1 ZINC000483092760 898780637 /nfs/dbraw/zinc/78/06/37/898780637.db2.gz KUDOSYPWQORADE-NRFANRHFSA-N 0 3 415.534 4.224 20 0 HIADHN COc1ccc([C@H](C)N[C@@H](Cc2ccccc2)[C@@H](O)C(F)F)cc1Br ZINC000483125887 898811286 /nfs/dbraw/zinc/81/12/86/898811286.db2.gz JWKNFPPZKLAJGW-ULFGMLNVSA-N 0 3 414.290 4.346 20 0 HIADHN Cc1c([C@H](C)N[C@@H](Cc2ccccc2)[C@H](O)C(F)F)cnn1-c1ccc(F)cc1 ZINC000483131621 898814174 /nfs/dbraw/zinc/81/41/74/898814174.db2.gz BRDPRAZCZJGFKW-WVFSVQOHSA-N 0 3 403.448 4.208 20 0 HIADHN C[C@H](N[C@H](Cc1ccccc1)[C@H](O)C(F)F)c1ccc(F)c(Br)c1 ZINC000483133542 898814986 /nfs/dbraw/zinc/81/49/86/898814986.db2.gz ZYWOKVJXMOJCHL-JECHBYEQSA-N 0 3 402.254 4.476 20 0 HIADHN C[C@@H](NCC(C)(C)S(=O)(=O)c1ccc(Br)cc1)c1cccs1 ZINC000483151960 898826755 /nfs/dbraw/zinc/82/67/55/898826755.db2.gz AZJWBEYGWVVBAL-GFCCVEGCSA-N 0 3 402.379 4.414 20 0 HIADHN CC[C@@H]1CN(CCC(=O)Nc2ccccc2Oc2ccccc2)C[C@]2(CCOC2)O1 ZINC000483163113 898833317 /nfs/dbraw/zinc/83/33/17/898833317.db2.gz XUFILEGHIPOFSQ-DVECYGJZSA-N 0 3 410.514 4.077 20 0 HIADHN COc1ccc(CNC(=O)C2CCN(Cc3ccc(OCC4CC4)cc3)CC2)cc1 ZINC000483277653 898914662 /nfs/dbraw/zinc/91/46/62/898914662.db2.gz LFRHWZFPXJSOIF-UHFFFAOYSA-N 0 3 408.542 4.012 20 0 HIADHN CC(C)N(C)c1ccc(CN2CCC[C@H](CNC(=O)Nc3cccc(F)c3)C2)cn1 ZINC000483287290 898923671 /nfs/dbraw/zinc/92/36/71/898923671.db2.gz USYNOMLSWYRQII-GOSISDBHSA-N 0 3 413.541 4.099 20 0 HIADHN Cc1ccc(NC(=O)N2CCN(C3CCCCC3)CC2)c(-c2nc(C3CC3)no2)c1 ZINC000483291564 898924785 /nfs/dbraw/zinc/92/47/85/898924785.db2.gz JPUUQVHAZOHWBG-UHFFFAOYSA-N 0 3 409.534 4.405 20 0 HIADHN C[C@@H](NC(=O)Cc1cccc(OCc2cccnc2)c1)[C@H](c1ccccc1)N(C)C ZINC000505590818 914297531 /nfs/dbraw/zinc/29/75/31/914297531.db2.gz KGSVJFXAMRIYPH-KBMIEXCESA-N 0 3 403.526 4.011 20 0 HIADHN O=C(Nc1ccc(F)cc1-c1nc(C2CC2)no1)N1CCN(C2CCCCC2)CC1 ZINC000483315830 898943834 /nfs/dbraw/zinc/94/38/34/898943834.db2.gz QENCXNISOZXIJS-UHFFFAOYSA-N 0 3 413.497 4.235 20 0 HIADHN C[C@H](Cc1ccc(O)cc1)N(C)C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000483333741 898963797 /nfs/dbraw/zinc/96/37/97/898963797.db2.gz GRHICIKRYROYSR-GOSISDBHSA-N 0 3 413.587 4.078 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)N1CCc2c(F)cc(F)cc2C1 ZINC000483335984 898965642 /nfs/dbraw/zinc/96/56/42/898965642.db2.gz IXVIPNGZVHTRBO-UHFFFAOYSA-N 0 3 417.525 4.146 20 0 HIADHN C[C@@H](NC(=O)C1(c2ccccc2Br)CC1)[C@H](c1ccccc1)N(C)C ZINC000505597205 914303162 /nfs/dbraw/zinc/30/31/62/914303162.db2.gz QTZOTKHHXCLTOX-DNVCBOLYSA-N 0 3 401.348 4.288 20 0 HIADHN CS[C@H]1CN(C(=O)c2oc3c(cccc3Br)c2C)C[C@H]1N1CCCC1 ZINC000483386388 899021621 /nfs/dbraw/zinc/02/16/21/899021621.db2.gz AQQFLSLBPJNURQ-CVEARBPZSA-N 0 3 423.376 4.156 20 0 HIADHN CS[C@H]1CN(C(=O)c2sc(-c3ccccc3C)nc2C)C[C@H]1N1CCCC1 ZINC000483409093 899039840 /nfs/dbraw/zinc/03/98/40/899039840.db2.gz OYHUFTBDJPTDSL-MSOLQXFVSA-N 0 3 401.601 4.079 20 0 HIADHN Cc1noc(C)c1COc1ccc(CC(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)cc1 ZINC000505603503 914309234 /nfs/dbraw/zinc/30/92/34/914309234.db2.gz ORUZFYPDXYHENI-AVRWGWEMSA-N 0 3 421.541 4.221 20 0 HIADHN C[C@H](NC(=O)c1c[nH]c2ccc(Br)cc12)[C@@H](c1ccccc1)N(C)C ZINC000505605901 914309625 /nfs/dbraw/zinc/30/96/25/914309625.db2.gz JATYTHPSMPJYBG-DJJJIMSYSA-N 0 3 400.320 4.352 20 0 HIADHN CCOc1cc(CN2CCSCC[C@H]2C)ccc1OCc1ccc(C(=O)OC)o1 ZINC000483425261 899056684 /nfs/dbraw/zinc/05/66/84/899056684.db2.gz HPGVHHOZBYNIKF-MRXNPFEDSA-N 0 3 419.543 4.371 20 0 HIADHN CCc1nc(C2CCN(Cc3ccc(Br)c4cccnc34)CC2)n[nH]1 ZINC000483438571 899072547 /nfs/dbraw/zinc/07/25/47/899072547.db2.gz JSAFZBZAWWNGGD-UHFFFAOYSA-N 0 3 400.324 4.057 20 0 HIADHN CCc1n[nH]c(C2CCN(Cc3ccc(Br)c4cccnc34)CC2)n1 ZINC000483438571 899072560 /nfs/dbraw/zinc/07/25/60/899072560.db2.gz JSAFZBZAWWNGGD-UHFFFAOYSA-N 0 3 400.324 4.057 20 0 HIADHN O=C1CCCN1[C@H]1CCN(Cc2cn(-c3ccccc3)nc2-c2cccc(Cl)c2)C1 ZINC000483444676 899080176 /nfs/dbraw/zinc/08/01/76/899080176.db2.gz WULYGEWETUQIMR-QFIPXVFZSA-N 0 3 420.944 4.389 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)Nc2cc(Br)ccn2)N(C)C)cc1 ZINC000483450972 899086991 /nfs/dbraw/zinc/08/69/91/899086991.db2.gz XPQKGQQRKKAHCQ-KRWDZBQOSA-N 0 3 421.339 4.056 20 0 HIADHN CCc1ccc([C@H](N[C@@H](COC)CC(C)C)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000483453345 899089919 /nfs/dbraw/zinc/08/99/19/899089919.db2.gz GYRBLBCWWKWFBG-GGAORHGYSA-N 0 3 403.588 4.393 20 0 HIADHN O=C(NCc1nc(C2CC2)cs1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000483628283 899281917 /nfs/dbraw/zinc/28/19/17/899281917.db2.gz YGNTWFIZKLCDLW-IBGZPJMESA-N 0 3 409.477 4.091 20 0 HIADHN Cc1ccccc1COc1ccc([C@H](C)NCc2cccc(OCC(N)=O)c2)cc1 ZINC000483630987 899284251 /nfs/dbraw/zinc/28/42/51/899284251.db2.gz AAGJBKLCIRELGB-IBGZPJMESA-N 0 3 404.510 4.289 20 0 HIADHN CC(C)[C@H](CC(=O)Nc1ccccc1CN1CCC[C@@H](C(N)=O)C1)c1ccccc1 ZINC000483638399 899293064 /nfs/dbraw/zinc/29/30/64/899293064.db2.gz VZWMKQNDNIMCHJ-YADHBBJMSA-N 0 3 407.558 4.152 20 0 HIADHN C[C@@H](NCCc1ccc(S(=O)(=O)N2CCCCC2)s1)c1ccc(F)cc1F ZINC000483649125 899307195 /nfs/dbraw/zinc/30/71/95/899307195.db2.gz WILHLYLJNQRKHZ-CQSZACIVSA-N 0 3 414.543 4.094 20 0 HIADHN Cc1ccc(-c2noc([C@@H](C)NC3CCN(CCC(F)(F)F)CC3)n2)cc1F ZINC000483653337 899310927 /nfs/dbraw/zinc/31/09/27/899310927.db2.gz AEOPYBSLWXWQEQ-CYBMUJFWSA-N 0 3 400.420 4.252 20 0 HIADHN CC[C@@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)c1cccc(Br)c1 ZINC000483707444 899363210 /nfs/dbraw/zinc/36/32/10/899363210.db2.gz BTMGUMUAFZGUPH-QUCCMNQESA-N 0 3 414.347 4.328 20 0 HIADHN CNC(=O)[C@H](Cc1c[nH]c2ccccc12)N[C@@H]1CCc2c1ccc(Cl)c2Cl ZINC000483710072 899365469 /nfs/dbraw/zinc/36/54/69/899365469.db2.gz HDPIECOBTRDYJG-MOPGFXCFSA-N 0 3 402.325 4.409 20 0 HIADHN CC[C@@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)c1ccc(Br)cc1 ZINC000483714136 899371116 /nfs/dbraw/zinc/37/11/16/899371116.db2.gz OOOISNMTNXQQFU-QUCCMNQESA-N 0 3 414.347 4.328 20 0 HIADHN Cc1nn(Cc2ccc(Cl)cc2)c2sc(C(=O)N(CCN(C)C)C3CC3)cc12 ZINC000505640945 914341253 /nfs/dbraw/zinc/34/12/53/914341253.db2.gz ZZLSPPUEKIECAZ-UHFFFAOYSA-N 0 3 416.978 4.274 20 0 HIADHN COCCOc1ccc([C@@H](C)N[C@H]2CCCN(c3ccccc3Cl)C2=O)cc1 ZINC000483716587 899374685 /nfs/dbraw/zinc/37/46/85/899374685.db2.gz VOYRUOWFHRMPAQ-UZLBHIALSA-N 0 3 402.922 4.211 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)Nc2cc3c(cc2Cl)OCCO3)C1 ZINC000483755509 899417464 /nfs/dbraw/zinc/41/74/64/899417464.db2.gz KDZVPHBSTIYVIQ-GOEBONIOSA-N 0 3 401.894 4.068 20 0 HIADHN COc1ccc(C(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)cc1Cl ZINC000483802087 899476796 /nfs/dbraw/zinc/47/67/96/899476796.db2.gz OKTHLGNWVWFUQJ-SFHVURJKSA-N 0 3 410.905 4.244 20 0 HIADHN Cc1ccc(NC(=O)CSc2nncn2-c2ccc(C(C)C)cc2)c(CN(C)C)c1 ZINC000505654306 914351252 /nfs/dbraw/zinc/35/12/52/914351252.db2.gz GPTYFKWUGNGGLZ-UHFFFAOYSA-N 0 3 423.586 4.492 20 0 HIADHN CN(C(=O)N[C@@H]1CCN(C2CC2)C1)[C@H](c1ccc(F)cc1)c1ccc(Cl)cc1 ZINC000483812677 899489813 /nfs/dbraw/zinc/48/98/13/899489813.db2.gz ZDYUWWLFGHBCTO-CTNGQTDRSA-N 0 3 401.913 4.447 20 0 HIADHN Cc1ccc(NC(=O)[C@H]2CCCN(C(=O)Nc3ccccc3F)C2)c(CN(C)C)c1 ZINC000505655895 914353480 /nfs/dbraw/zinc/35/34/80/914353480.db2.gz FBBHLCWOFTXRFU-KRWDZBQOSA-N 0 3 412.509 4.078 20 0 HIADHN CN(C)C[C@H](NC(=O)N[C@@H](c1cc(F)ccc1F)C(F)F)c1ccc(F)cc1 ZINC000483881536 899557108 /nfs/dbraw/zinc/55/71/08/899557108.db2.gz FHOSHNUHPJCDQT-IRXDYDNUSA-N 0 3 401.379 4.012 20 0 HIADHN Cc1ccc(CNC(=O)C2CCN(CCOc3ccc(Cl)c(F)c3)CC2)cc1 ZINC000483950119 899601674 /nfs/dbraw/zinc/60/16/74/899601674.db2.gz CKYBBXGILURWPW-UHFFFAOYSA-N 0 3 404.913 4.195 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)NC[C@@H]2CCCC[C@@H]2C(F)(F)F)CC1 ZINC000484049111 899682167 /nfs/dbraw/zinc/68/21/67/899682167.db2.gz SDMVTJAVTUTHEP-YJBOKZPZSA-N 0 3 401.473 4.254 20 0 HIADHN Cc1cc(-c2cc(C(=O)N3CCN(C4CCCCC4)CC3)c3c(C)noc3n2)c(C)o1 ZINC000484100388 899727948 /nfs/dbraw/zinc/72/79/48/899727948.db2.gz CLVRUYPAWZUHQH-UHFFFAOYSA-N 0 3 422.529 4.499 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)Nc1nnc(/C=C\c2ccco2)s1 ZINC000484126567 899748982 /nfs/dbraw/zinc/74/89/82/899748982.db2.gz FRABEFAEXNLNRS-LENZSSGSSA-N 0 3 409.515 4.260 20 0 HIADHN C[C@@H](NCCCOC[C@@H]1CCOC1)c1ccc(Br)cc1Br ZINC000484163736 899783705 /nfs/dbraw/zinc/78/37/05/899783705.db2.gz MBPHPYKGUXTCOG-OLZOCXBDSA-N 0 3 421.173 4.305 20 0 HIADHN Cc1c([C@@H](C)NC2CCN(c3ccc(C)cn3)CC2)nnn1-c1cccc(Cl)c1 ZINC000484178113 899796260 /nfs/dbraw/zinc/79/62/60/899796260.db2.gz QAWSMGZTPLFTRH-MRXNPFEDSA-N 0 3 410.953 4.252 20 0 HIADHN CCN1CCC[C@H](NC(=O)N2CCc3nc(-c4ccccc4Cl)sc3C2)C1 ZINC000484259355 899837963 /nfs/dbraw/zinc/83/79/63/899837963.db2.gz WLGRALQDJKCROL-AWEZNQCLSA-N 0 3 404.967 4.016 20 0 HIADHN CC[C@@H](N[C@H]1CCCc2nc(-c3ccc(Cl)cc3)sc21)C(=O)N1CCOCC1 ZINC000484314611 899873977 /nfs/dbraw/zinc/87/39/77/899873977.db2.gz XDLGWMVKACJYOL-SJORKVTESA-N 0 3 419.978 4.068 20 0 HIADHN COc1ccccc1-c1nc(C2CCN(Cc3cccc(NC(C)=O)c3)CC2)no1 ZINC000484322469 899878451 /nfs/dbraw/zinc/87/84/51/899878451.db2.gz GRLWCDSWWIGZAL-UHFFFAOYSA-N 0 3 406.486 4.083 20 0 HIADHN COc1cccc(OCCN2CCC(c3noc(-c4ccccc4OC)n3)CC2)c1 ZINC000484327737 899881915 /nfs/dbraw/zinc/88/19/15/899881915.db2.gz WCFATQABMXGQLH-UHFFFAOYSA-N 0 3 409.486 4.012 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2ccc(F)cc2OC(C)C)c1 ZINC000484348293 899898206 /nfs/dbraw/zinc/89/82/06/899898206.db2.gz WIFSNYYRATWENO-UHFFFAOYSA-N 0 3 403.498 4.217 20 0 HIADHN CSc1cccc(N(C(=O)c2ccc(N3CCCC3=O)cc2)C2CCN(C)CC2)c1 ZINC000484408375 899932203 /nfs/dbraw/zinc/93/22/03/899932203.db2.gz UROMLOGRVGNSAA-UHFFFAOYSA-N 0 3 423.582 4.276 20 0 HIADHN CSc1cccc(N(C(=O)c2ccc(F)c(NC(C)=O)c2)C2CCN(C)CC2)c1 ZINC000484409683 899932308 /nfs/dbraw/zinc/93/23/08/899932308.db2.gz REWRMGBUYYKNBY-UHFFFAOYSA-N 0 3 415.534 4.247 20 0 HIADHN Cc1cccc(NC(=O)C[C@H](C)NCC(=O)N2CCC(Cc3ccccc3)CC2)c1C ZINC000484480011 899971492 /nfs/dbraw/zinc/97/14/92/899971492.db2.gz JYWICIULQUJBLH-FQEVSTJZSA-N 0 3 421.585 4.091 20 0 HIADHN Cc1cccc(NC(=O)C[C@@H](C)NCC(=O)N2CCC(Cc3ccccc3)CC2)c1C ZINC000484480012 899971666 /nfs/dbraw/zinc/97/16/66/899971666.db2.gz JYWICIULQUJBLH-HXUWFJFHSA-N 0 3 421.585 4.091 20 0 HIADHN COC[C@@H](N[C@H]1CCN(c2cc(OC)cc(OC)c2)C1)c1cccc(C(F)(F)F)c1 ZINC000484485106 899976895 /nfs/dbraw/zinc/97/68/95/899976895.db2.gz IVVJTZHEHPSOTR-LAUBAEHRSA-N 0 3 424.463 4.279 20 0 HIADHN O[C@@H](CN[C@H](Cn1cnc2ccccc21)c1ccc(F)cc1)COCc1ccccc1 ZINC000484533012 900019741 /nfs/dbraw/zinc/01/97/41/900019741.db2.gz IPEJDHKWHCVTGI-LADGPHEKSA-N 0 3 419.500 4.084 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)NC2CCN(c3ccccc3)CC2)N(C)C)cc1 ZINC000484694997 900130810 /nfs/dbraw/zinc/13/08/10/900130810.db2.gz RCHVAGTVHLMHKE-XMMPIXPASA-N 0 3 424.589 4.045 20 0 HIADHN CCc1nc(C2CCN([C@@H](c3nc(-c4ccccc4)no3)c3ccccc3)CC2)n[nH]1 ZINC000484709249 900142800 /nfs/dbraw/zinc/14/28/00/900142800.db2.gz VNRBSWZDBZLJNC-OAQYLSRUSA-N 0 3 414.513 4.386 20 0 HIADHN CCc1n[nH]c(C2CCN([C@@H](c3nc(-c4ccccc4)no3)c3ccccc3)CC2)n1 ZINC000484709249 900142802 /nfs/dbraw/zinc/14/28/02/900142802.db2.gz VNRBSWZDBZLJNC-OAQYLSRUSA-N 0 3 414.513 4.386 20 0 HIADHN CCc1nnc(C2CCN([C@@H](c3nc(-c4ccccc4)no3)c3ccccc3)CC2)[nH]1 ZINC000484709249 900142805 /nfs/dbraw/zinc/14/28/05/900142805.db2.gz VNRBSWZDBZLJNC-OAQYLSRUSA-N 0 3 414.513 4.386 20 0 HIADHN CCc1nnc(C2CCN([C@H](C(=O)Nc3ccc(C)cc3)c3ccccc3)CC2)[nH]1 ZINC000484742869 900166800 /nfs/dbraw/zinc/16/68/00/900166800.db2.gz RZYWZBVXRKPNBM-QFIPXVFZSA-N 0 3 403.530 4.235 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2ccc(OC(C)C)c(OC)c2)c1 ZINC000484776727 900189260 /nfs/dbraw/zinc/18/92/60/900189260.db2.gz BAVZDSSUBUYQPZ-UHFFFAOYSA-N 0 3 415.534 4.087 20 0 HIADHN COc1ccc(NC(=O)CCN2CCC(C(=O)c3ccccc3)CC2)cc1Cl ZINC000484987005 900342498 /nfs/dbraw/zinc/34/24/98/900342498.db2.gz LPGNNURVKZPXNG-UHFFFAOYSA-N 0 3 400.906 4.272 20 0 HIADHN COc1cccc(-c2nc(CN[C@@]3(CO)C[C@H](C)CC(C)(C)C3)cs2)c1OC ZINC000485064300 900389110 /nfs/dbraw/zinc/38/91/10/900389110.db2.gz OJUZDPDGLNYFPK-QRQCRPRQSA-N 0 3 404.576 4.494 20 0 HIADHN Cc1cccc(C)c1NC(=O)CCCN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1 ZINC000485073179 900393349 /nfs/dbraw/zinc/39/33/49/900393349.db2.gz GZVGLQSVKKOMEN-FQEVSTJZSA-N 0 3 412.509 4.057 20 0 HIADHN CCC(=O)N[C@@H]1CCCN(CCCC(=O)Nc2c(CC)ccc(Cl)c2CC)C1 ZINC000485096418 900406394 /nfs/dbraw/zinc/40/63/94/900406394.db2.gz XNUZHNPRMYUSGL-QGZVFWFLSA-N 0 3 407.986 4.174 20 0 HIADHN CCCCn1ncc(NC(=O)NCC2(N3CCSCC3)CCCC2)c1C(C)C ZINC000485145863 900446032 /nfs/dbraw/zinc/44/60/32/900446032.db2.gz AZTVVHXQYGIWRR-UHFFFAOYSA-N 0 3 407.628 4.290 20 0 HIADHN CCc1c(NC(=O)N2CC[C@@H]3CCN(C)C[C@H]32)cnn1-c1cccc(C(F)(F)F)c1 ZINC000485319131 900599229 /nfs/dbraw/zinc/59/92/29/900599229.db2.gz GRCONVSMBNAGDY-IFXJQAMLSA-N 0 3 421.467 4.011 20 0 HIADHN CC(C)CC(=O)Nc1cccc(CNC(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)c1 ZINC000485342124 900632323 /nfs/dbraw/zinc/63/23/23/900632323.db2.gz CZFOZNHGKDSQFA-JPYJTQIMSA-N 0 3 410.562 4.162 20 0 HIADHN CC(C)CCOc1ccc(C(=O)Nc2ccc(C(=O)NCCN3CCCC3)cc2)cc1 ZINC000485503531 900792377 /nfs/dbraw/zinc/79/23/77/900792377.db2.gz KFHHCAAIIRLEEO-UHFFFAOYSA-N 0 3 423.557 4.189 20 0 HIADHN CN(C)Cc1cccc(NC(=O)N[C@@H]2CSc3ccc(Br)cc32)c1 ZINC000485534669 900813732 /nfs/dbraw/zinc/81/37/32/900813732.db2.gz ZWPFALUGDIMMFQ-MRXNPFEDSA-N 0 3 406.349 4.479 20 0 HIADHN COc1cc([C@@H](C)NC(=O)N2CCN(C3CCCCC3)CC2)ccc1OC(C)C ZINC000485567156 900837129 /nfs/dbraw/zinc/83/71/29/900837129.db2.gz HTRYSULRRDLLQU-GOSISDBHSA-N 0 3 403.567 4.203 20 0 HIADHN CCOC(=O)c1cc(NC(=O)NC[C@@H](N[C@@H](C)CC)c2ccco2)c(F)cc1C ZINC000485572284 900840454 /nfs/dbraw/zinc/84/04/54/900840454.db2.gz CJJVSGSGXVTJJJ-KBXCAEBGSA-N 0 3 405.470 4.155 20 0 HIADHN C[C@H](Oc1ccccc1Br)C(=O)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000485706217 900954937 /nfs/dbraw/zinc/95/49/37/900954937.db2.gz HACDYJPEAKFHAO-LPHOPBHVSA-N 0 3 417.347 4.170 20 0 HIADHN COCCO[C@H]1COCC[C@H]1NCc1ccc(-c2ccc(Cl)c(Cl)c2)o1 ZINC000485724185 900973685 /nfs/dbraw/zinc/97/36/85/900973685.db2.gz KSNBZBDFHMRYPJ-MJGOQNOKSA-N 0 3 400.302 4.164 20 0 HIADHN C[C@H](NC(=O)c1ccccc1CN(C)C)c1cccc(NC(=O)c2ccccc2)c1 ZINC000485814681 901062497 /nfs/dbraw/zinc/06/24/97/901062497.db2.gz ACUYBMHFGGPXPO-SFHVURJKSA-N 0 3 401.510 4.492 20 0 HIADHN COc1ccc(OC)c([C@H](C)NC(=O)[C@@H](C)N[C@@H](C)c2ccc3ncsc3c2)c1 ZINC000485830118 901076343 /nfs/dbraw/zinc/07/63/43/901076343.db2.gz FEVCJTRTSHSFEL-SOUVJXGZSA-N 0 3 413.543 4.230 20 0 HIADHN Cc1[nH]c2ccc(Cl)cc2c1C(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000485846612 901090317 /nfs/dbraw/zinc/09/03/17/901090317.db2.gz PNBSYLFJSZSXQK-HUUCEWRRSA-N 0 3 403.954 4.091 20 0 HIADHN COc1cc(NC(=O)CN2C[C@H](c3ccccc3)[C@H]3CCCC[C@@H]32)cc(OC)c1OC ZINC000485885199 901119085 /nfs/dbraw/zinc/11/90/85/901119085.db2.gz ZKPJELNYFTURQR-NJYVYQBISA-N 0 3 424.541 4.309 20 0 HIADHN C[C@@H]1C[C@@H](C(=O)N2CCC(N(C)Cc3cccc(C(F)(F)F)c3)CC2)CCC1=O ZINC000485943067 901162518 /nfs/dbraw/zinc/16/25/18/901162518.db2.gz GXZZOZIIALIGSP-WBVHZDCISA-N 0 3 410.480 4.134 20 0 HIADHN CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)c1nc2ccccc2nc1N1CCCCC1 ZINC000486002195 901216445 /nfs/dbraw/zinc/21/64/45/901216445.db2.gz GRCOUPZTQQGBJH-REWPJTCUSA-N 0 3 416.573 4.144 20 0 HIADHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)c1cc(F)c(F)c(F)c1 ZINC000486137138 901325179 /nfs/dbraw/zinc/32/51/79/901325179.db2.gz WBZKXJQKACTMPR-UHFFFAOYSA-N 0 3 415.253 4.070 20 0 HIADHN Cc1cc(NC(=O)[C@H](C)N2CCN(C3CCCCC3)CC2)ccc1Br ZINC000486248047 901430694 /nfs/dbraw/zinc/43/06/94/901430694.db2.gz CDXQDXKFSDTUBN-INIZCTEOSA-N 0 3 408.384 4.035 20 0 HIADHN Cc1cc(Br)cc(NC(=O)N2CCC(CN3C[C@@H](C)O[C@H](C)C3)CC2)c1 ZINC000486320746 901498198 /nfs/dbraw/zinc/49/81/98/901498198.db2.gz VLSCQFNVJHONOM-HZPDHXFCSA-N 0 3 424.383 4.111 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)N[C@@H]2CC(C)(C)Oc3cc(F)ccc32)CC1 ZINC000486473524 901634889 /nfs/dbraw/zinc/63/48/89/901634889.db2.gz VYMCJXHNLHNSLT-HXUWFJFHSA-N 0 3 415.509 4.327 20 0 HIADHN COc1cc(-c2noc(CN3CC[C@H](c4ccccc4)[C@@H]3C)n2)cc(OC)c1OC ZINC000486812245 901870299 /nfs/dbraw/zinc/87/02/99/901870299.db2.gz YMGPRPBWXXAICY-YJBOKZPZSA-N 0 3 409.486 4.140 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)Nc3cc(C(C)(C)C)nn3-c3cccc(Cl)c3)[C@H]2C1 ZINC000486895655 901939384 /nfs/dbraw/zinc/93/93/84/901939384.db2.gz OLNBKMLNXWEUOT-QAPCUYQASA-N 0 3 415.969 4.381 20 0 HIADHN CN(C)CCN(C(=O)Nc1cccc2cc(Br)cnc21)C1CCCC1 ZINC000486896831 901941152 /nfs/dbraw/zinc/94/11/52/901941152.db2.gz QYHSCRZHTKESQX-UHFFFAOYSA-N 0 3 405.340 4.335 20 0 HIADHN C[C@H](NC(=O)N(C)C1CCN(CCc2ccccn2)CC1)c1ccc2ncsc2c1 ZINC000487016893 902016359 /nfs/dbraw/zinc/01/63/59/902016359.db2.gz IRVIQCZRLVMKPB-KRWDZBQOSA-N 0 3 423.586 4.101 20 0 HIADHN CN(C)Cc1ccccc1C(=O)N1CCC(Oc2cccc(Br)c2)CC1 ZINC000487127518 902068668 /nfs/dbraw/zinc/06/86/68/902068668.db2.gz VGJZFQOOUVFWFG-UHFFFAOYSA-N 0 3 417.347 4.194 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)[C@H]2CCO[C@@H]2c2cnn(Cc3ccccc3)c2)c1 ZINC000487307631 902145491 /nfs/dbraw/zinc/14/54/91/902145491.db2.gz RCAATKDCTBZOMS-BJKOFHAPSA-N 0 3 418.541 4.018 20 0 HIADHN CC[C@H](C)c1nc([C@H](C)NC(=O)NC[C@H](c2cccc(Cl)c2)N2CCCC2)n[nH]1 ZINC000487349022 902156796 /nfs/dbraw/zinc/15/67/96/902156796.db2.gz AEQJFXNCIPEGNO-RLFYNMQTSA-N 0 3 418.973 4.169 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)N[C@H]1CCC[C@H](c2ccccc2)C1 ZINC000487417843 902201022 /nfs/dbraw/zinc/20/10/22/902201022.db2.gz WHVITRPPGKMLRV-URXFXBBRSA-N 0 3 421.585 4.169 20 0 HIADHN CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)N[C@@H]1CCC[C@H](c2ccccc2)C1 ZINC000487747085 902338838 /nfs/dbraw/zinc/33/88/38/902338838.db2.gz GLECXBYJXNIVSM-XGAJZPNHSA-N 0 3 406.574 4.442 20 0 HIADHN C[C@H]1CN(C2CCOCC2)CCN1C(=O)Nc1ccccc1SC1CCCC1 ZINC000487875919 902421052 /nfs/dbraw/zinc/42/10/52/902421052.db2.gz MWXFUNBNFOVMHI-KRWDZBQOSA-N 0 3 403.592 4.438 20 0 HIADHN C[C@@H]1CN(C2CCOCC2)CCN1C(=O)Nc1ccc(SC2CCCC2)cc1 ZINC000487933503 902463678 /nfs/dbraw/zinc/46/36/78/902463678.db2.gz UUCRYOLREMNASW-QGZVFWFLSA-N 0 3 403.592 4.438 20 0 HIADHN O=C(c1ccc(Cl)cc1)N1CCC(N2CCN(c3cccc(Cl)c3)CC2)CC1 ZINC000488051037 902563784 /nfs/dbraw/zinc/56/37/84/902563784.db2.gz KGINCXBRYBRLBK-UHFFFAOYSA-N 0 3 418.368 4.420 20 0 HIADHN CC(C)OC(=O)CCN1CCC(c2nc(-c3ccccc3Br)no2)CC1 ZINC000488205653 902687608 /nfs/dbraw/zinc/68/76/08/902687608.db2.gz YYOILVOWVCLIKC-UHFFFAOYSA-N 0 3 422.323 4.020 20 0 HIADHN C[C@@H]1CN(C2CCOCC2)CCN1C(=O)Nc1cc(F)ccc1Oc1ccccc1 ZINC000488284371 902746755 /nfs/dbraw/zinc/74/67/55/902746755.db2.gz YPDTUEBVMGXSDA-QGZVFWFLSA-N 0 3 413.493 4.335 20 0 HIADHN Cc1ccc(-c2ncc(CN3CCC[C@H](N(C)CC(=O)OC(C)(C)C)CC3)s2)o1 ZINC000488367126 902782762 /nfs/dbraw/zinc/78/27/62/902782762.db2.gz OEKVKRMCJPICNS-KRWDZBQOSA-N 0 3 419.591 4.340 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)c2cc(-c3ccccc3Cl)n[nH]2)CC1 ZINC000488662251 902926792 /nfs/dbraw/zinc/92/67/92/902926792.db2.gz UJYRXYVREGIOLN-UHFFFAOYSA-N 0 3 408.933 4.467 20 0 HIADHN C[C@H]1CN(C2CCOCC2)CCN1Cc1coc(-c2ccc(C(F)(F)F)cc2)n1 ZINC000488671329 902933036 /nfs/dbraw/zinc/93/30/36/902933036.db2.gz GHVLAEKWNQFMEM-HNNXBMFYSA-N 0 3 409.452 4.046 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)c2ccn(-c3cccc(Cl)c3)n2)CC1 ZINC000488676175 902938076 /nfs/dbraw/zinc/93/80/76/902938076.db2.gz JXPWBAOGMVPHER-UHFFFAOYSA-N 0 3 408.933 4.262 20 0 HIADHN COc1ccc(-c2nc(C(=O)Nc3cccc(CN4CCC(O)CC4)c3)cs2)cc1 ZINC000488704980 902954805 /nfs/dbraw/zinc/95/48/05/902954805.db2.gz UNFGIZNRYFCVAA-UHFFFAOYSA-N 0 3 423.538 4.028 20 0 HIADHN COc1cc2c(cc1OC)CN(C(=O)CN(C)[C@H](c1ccccc1C)C(C)C)CC2 ZINC000488802184 903006812 /nfs/dbraw/zinc/00/68/12/903006812.db2.gz GIAMIUGBWXWRDF-VWLOTQADSA-N 0 3 410.558 4.226 20 0 HIADHN CCN(C(=O)c1ccc(N2CCN(C(C)C)CC2)cc1)[C@@H](C)c1cccc(OC)c1 ZINC000488801998 903007385 /nfs/dbraw/zinc/00/73/85/903007385.db2.gz FPQWSTUUFDXHLH-FQEVSTJZSA-N 0 3 409.574 4.449 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N[C@H](C)c3ccccc3OC(F)F)cc2)CC1 ZINC000488839974 903034815 /nfs/dbraw/zinc/03/48/15/903034815.db2.gz PXCRALTYPRVYOQ-QGZVFWFLSA-N 0 3 417.500 4.309 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N[C@@H](C)c3ccccc3OC(F)F)cc2)CC1 ZINC000488839973 903035024 /nfs/dbraw/zinc/03/50/24/903035024.db2.gz PXCRALTYPRVYOQ-KRWDZBQOSA-N 0 3 417.500 4.309 20 0 HIADHN CC(=O)c1ccc(NC(=O)[C@H](C)N[C@@H](COc2ccccc2F)C(C)(C)C)cc1 ZINC000489033659 903139678 /nfs/dbraw/zinc/13/96/78/903139678.db2.gz IEJWBNSSPXRLSJ-BTYIYWSLSA-N 0 3 400.494 4.439 20 0 HIADHN C[C@@H](N[C@@H](COc1ccccc1F)C(C)(C)C)C(=O)N1CCc2sccc2C1 ZINC000489034370 903141532 /nfs/dbraw/zinc/14/15/32/903141532.db2.gz KEHFDXKFKSGHDO-QRWLVFNGSA-N 0 3 404.551 4.244 20 0 HIADHN COc1ccc(OCCCNCc2nc(-c3ccc(Br)cc3)c[nH]2)cc1 ZINC000489042889 903147888 /nfs/dbraw/zinc/14/78/88/903147888.db2.gz YWXLIIDJNQDGGQ-UHFFFAOYSA-N 0 3 416.319 4.407 20 0 HIADHN O=C(NC[C@H](OCc1ccccc1)c1ccc(Cl)cc1)N[C@H]1CCN(C2CC2)C1 ZINC000489049394 903154131 /nfs/dbraw/zinc/15/41/31/903154131.db2.gz VGEMZFLSEWKZAW-UNMCSNQZSA-N 0 3 413.949 4.134 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)NCCCCCc3ccc(F)cc3)CC2)C[C@H](C)O1 ZINC000489080349 903181529 /nfs/dbraw/zinc/18/15/29/903181529.db2.gz RHBLORFHDVEJAW-PMACEKPBSA-N 0 3 419.585 4.069 20 0 HIADHN O=C(NCc1ccc(OC(F)F)cc1)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000506017839 914697290 /nfs/dbraw/zinc/69/72/90/914697290.db2.gz VQVNMZRAHLLSJM-SFHVURJKSA-N 0 3 410.411 4.062 20 0 HIADHN CC(C)CC[C@H]1CCC[C@@H]1NC(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000489139361 903226459 /nfs/dbraw/zinc/22/64/59/903226459.db2.gz NDVFCSNMJFBLLL-XXBNENTESA-N 0 3 401.595 4.047 20 0 HIADHN COc1ccccc1C1(CNC(=O)N(Cc2ccccc2)C2CCN(C)CC2)CC1 ZINC000489146061 903229728 /nfs/dbraw/zinc/22/97/28/903229728.db2.gz BFWNVLPANBNWQN-UHFFFAOYSA-N 0 3 407.558 4.033 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)NCCSCc2ccccc2F)CC1 ZINC000489309361 903323171 /nfs/dbraw/zinc/32/31/71/903323171.db2.gz YIDUAKNQWYBTDB-UHFFFAOYSA-N 0 3 415.578 4.365 20 0 HIADHN CCC(CC)(CNC(=O)NCc1ccccc1CN1CCC(O)CC1)c1ccccc1 ZINC000489472696 903403688 /nfs/dbraw/zinc/40/36/88/903403688.db2.gz GOJFPBRNZMZIBB-UHFFFAOYSA-N 0 3 423.601 4.201 20 0 HIADHN CCO[C@@H](CCNC(=O)N(Cc1ccccc1)C1CCN(C)CC1)C1CCCC1 ZINC000489474750 903405624 /nfs/dbraw/zinc/40/56/24/903405624.db2.gz LAMPEPVLVWBCNT-QHCPKHFHSA-N 0 3 401.595 4.278 20 0 HIADHN C[C@H](CNC(=O)N(Cc1ccccc1)C1CCN(C)CC1)c1ccc(F)cc1F ZINC000489493118 903419897 /nfs/dbraw/zinc/41/98/97/903419897.db2.gz ZWYTZXFLLSZJHA-QGZVFWFLSA-N 0 3 401.501 4.374 20 0 HIADHN C[C@@H]([C@H](C)NC(=O)NCc1ccccc1CN1CCC(O)CC1)C1CCCCC1 ZINC000489492623 903420383 /nfs/dbraw/zinc/42/03/83/903420383.db2.gz QVBKJUPFWGBVLD-OALUTQOASA-N 0 3 401.595 4.047 20 0 HIADHN CO[C@H](CNC(=O)N(Cc1ccccc1)C1CCN(C)CC1)c1cccc(Cl)c1 ZINC000489498508 903425214 /nfs/dbraw/zinc/42/52/14/903425214.db2.gz QMGKJMGIKBFXLH-JOCHJYFZSA-N 0 3 415.965 4.334 20 0 HIADHN CC(C)(CNC(=O)N[C@H](c1ccccc1)c1cccnc1)N1CCc2ccccc2C1 ZINC000489538222 903448776 /nfs/dbraw/zinc/44/87/76/903448776.db2.gz OPEXOMLNLCQVBZ-XMMPIXPASA-N 0 3 414.553 4.307 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)N3CCC[C@@H](C[NH+]4CCCCCC4)C3)cc2)cc(=O)[n-]1 ZINC000489538864 903449076 /nfs/dbraw/zinc/44/90/76/903449076.db2.gz QDUWILLBBONCSW-IBGZPJMESA-N 0 3 423.561 4.278 20 0 HIADHN Cc1ccc(NC(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)cc1C(=O)N(C)C(C)C ZINC000489564012 903465882 /nfs/dbraw/zinc/46/58/82/903465882.db2.gz DVGZKZBTMBVPMZ-FCHUYYIVSA-N 0 3 408.546 4.042 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)NCCc2ccc(F)cc2Cl)CC1 ZINC000489562455 903466090 /nfs/dbraw/zinc/46/60/90/903466090.db2.gz CCCAVDZKXXLVRF-UHFFFAOYSA-N 0 3 403.929 4.328 20 0 HIADHN CN(C)C(=O)COc1cccc(CN[C@@H]2CCCOc3cc4c(cc32)CCCC4)c1 ZINC000489574866 903472859 /nfs/dbraw/zinc/47/28/59/903472859.db2.gz SPJCOPPUQWZQPJ-HSZRJFAPSA-N 0 3 408.542 4.036 20 0 HIADHN Cc1ccc(NC(=O)N2CCC(CN3C[C@@H](C)O[C@H](C)C3)CC2)cc1OC(C)C ZINC000489576617 903474871 /nfs/dbraw/zinc/47/48/71/903474871.db2.gz JFKGHZAENFBGHT-RTBURBONSA-N 0 3 403.567 4.135 20 0 HIADHN CCC[C@@H](CCc1ccccc1)NC(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000489592728 903483222 /nfs/dbraw/zinc/48/32/22/903483222.db2.gz CGUGPBLQAFECFM-DEOSSOPVSA-N 0 3 423.601 4.244 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2cccc(NC(=O)[C@H]3C[C@@H]3C)c2)N2CCCC2)cc1 ZINC000489600055 903490549 /nfs/dbraw/zinc/49/05/49/903490549.db2.gz UATPXRXRWQVZRD-TZYHBYERSA-N 0 3 405.542 4.156 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)c1cccn1C1CCCC1 ZINC000489651219 903515921 /nfs/dbraw/zinc/51/59/21/903515921.db2.gz JSQAOCLDZZBLCD-OAQYLSRUSA-N 0 3 403.530 4.499 20 0 HIADHN CCNC(=O)COc1ccc(CN(C)Cc2ccc3cc(OC)ccc3c2)cc1OC ZINC000506040736 914731788 /nfs/dbraw/zinc/73/17/88/914731788.db2.gz OGNPUBOIOGCZGO-UHFFFAOYSA-N 0 3 422.525 4.004 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)N1CCCCC[C@@H]1c1ccccc1 ZINC000489787144 903598646 /nfs/dbraw/zinc/59/86/46/903598646.db2.gz DLQNAZSYWOLUND-RUZDIDTESA-N 0 3 421.585 4.470 20 0 HIADHN CC[C@H](c1ccccc1)N(CC)C(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000489788688 903600054 /nfs/dbraw/zinc/60/00/54/903600054.db2.gz HUXIZMMUUNTBFH-XMMPIXPASA-N 0 3 409.574 4.326 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)N1CCC[C@H](c2ccccc2)CC1 ZINC000489814557 903610340 /nfs/dbraw/zinc/61/03/40/903610340.db2.gz WOSHPHMQWXRBPU-QFIPXVFZSA-N 0 3 421.585 4.123 20 0 HIADHN CN(c1ccccc1)C1CCN(C(=O)NC[C@H](c2ccccc2)N2CCCC2)CC1 ZINC000489985814 903713025 /nfs/dbraw/zinc/71/30/25/903713025.db2.gz AOVNAIBOQRYIFU-XMMPIXPASA-N 0 3 406.574 4.134 20 0 HIADHN Cc1ccc([C@H]2C[C@H](C)N(CC(=O)N3CCC(C(=O)Nc4ccccc4)CC3)C2)cc1 ZINC000490079192 903760801 /nfs/dbraw/zinc/76/08/01/903760801.db2.gz JUEFVEUGORFFEW-REWPJTCUSA-N 0 3 419.569 4.050 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](NCCc2cccnc2)c2ccc(Cl)cc2)c1 ZINC000490134897 903783667 /nfs/dbraw/zinc/78/36/67/903783667.db2.gz DASUUBQNADYJFM-NRFANRHFSA-N 0 3 400.931 4.060 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](NCCCOC2CCCC2)c2ccc(F)cc2)c1 ZINC000490164140 903805016 /nfs/dbraw/zinc/80/50/16/903805016.db2.gz KKBZDWNXSZQUDS-QFIPXVFZSA-N 0 3 405.535 4.258 20 0 HIADHN Cc1ccc([C@H](NCCN(C)C2CCCCC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000490172141 903809089 /nfs/dbraw/zinc/80/90/89/903809089.db2.gz LHCDUOWNSXSINM-DEOSSOPVSA-N 0 3 414.615 4.342 20 0 HIADHN CCc1ccc([C@H](NCCc2nccs2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000490171535 903809397 /nfs/dbraw/zinc/80/93/97/903809397.db2.gz FLHSLJDQRHOBCM-NRFANRHFSA-N 0 3 400.569 4.031 20 0 HIADHN Cc1ccc([C@@H](NCCN2CCC[C@H](C)C2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000490173092 903810447 /nfs/dbraw/zinc/81/04/47/903810447.db2.gz SKCZGEBJBPHZEY-CYFREDJKSA-N 0 3 414.615 4.118 20 0 HIADHN CN(C)C[C@H](NC(=O)NCc1ccc(Oc2ccccc2)nc1)c1ccc(F)cc1 ZINC000490185589 903814773 /nfs/dbraw/zinc/81/47/73/903814773.db2.gz YFJOATAOZWQEIK-NRFANRHFSA-N 0 3 408.477 4.115 20 0 HIADHN Cc1ccc([C@@H](NCCN2CCC(C)CC2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000490190238 903817377 /nfs/dbraw/zinc/81/73/77/903817377.db2.gz HIRYJYVGXWYEGG-DEOSSOPVSA-N 0 3 414.615 4.118 20 0 HIADHN CC(=O)N1CC[C@@H](NCc2ccc(OCc3ccccn3)cc2)c2ccccc2C1 ZINC000490191507 903818753 /nfs/dbraw/zinc/81/87/53/903818753.db2.gz TZZSPPDGOVADRF-RUZDIDTESA-N 0 3 401.510 4.244 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)N[C@H]1CCN(c2ccc(Cl)c(F)c2)C1 ZINC000490272110 903867746 /nfs/dbraw/zinc/86/77/46/903867746.db2.gz KQQUKVPTLDKBOI-AWEZNQCLSA-N 0 3 415.896 4.296 20 0 HIADHN CC[C@@H](C)NC(=O)c1ccc(NC(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)cc1 ZINC000490315527 903896602 /nfs/dbraw/zinc/89/66/02/903896602.db2.gz UVHVQAWAAUYXGO-AUSIDOKSSA-N 0 3 422.573 4.482 20 0 HIADHN CCNC(=O)Nc1ccc(C)c(NC(=O)NC[C@H](c2cccs2)N2CCCC2)c1 ZINC000490320957 903901534 /nfs/dbraw/zinc/90/15/34/903901534.db2.gz IATBTJWINSXRGN-GOSISDBHSA-N 0 3 415.563 4.157 20 0 HIADHN Cc1ccc2c(c1)[C@H](NC(=O)NC1CC(N3CCC(C(F)(F)F)CC3)C1)CCC2 ZINC000490345363 903939587 /nfs/dbraw/zinc/93/95/87/903939587.db2.gz CFJJJHLVJBCWKA-AFMYVXGZSA-N 0 3 409.496 4.477 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)Nc3ccc(OC(F)F)c(Cc4ccccc4)c3)[C@H]2C1 ZINC000490433715 904008183 /nfs/dbraw/zinc/00/81/83/904008183.db2.gz OHNNMSLEUCRIEW-PXNSSMCTSA-N 0 3 415.484 4.437 20 0 HIADHN Cc1cc([C@H](NCCCn2cc(Br)cn2)c2cccnc2)ccc1F ZINC000490439667 904011778 /nfs/dbraw/zinc/01/17/78/904011778.db2.gz YHSBHVIJRDKBEA-IBGZPJMESA-N 0 3 403.299 4.257 20 0 HIADHN CN(C)[C@@H](CNC(=O)Nc1cccc(-c2noc(C(F)(F)F)n2)c1)c1ccccc1 ZINC000490498220 904051588 /nfs/dbraw/zinc/05/15/88/904051588.db2.gz IQPCNDHEELQIHI-INIZCTEOSA-N 0 3 419.407 4.180 20 0 HIADHN CC[C@@H](CNC(=O)N(Cc1ccccc1)C1CCN(C)CC1)Oc1ccccc1C ZINC000490520206 904068816 /nfs/dbraw/zinc/06/88/16/904068816.db2.gz JCTVTCYGVAYXMP-QHCPKHFHSA-N 0 3 409.574 4.458 20 0 HIADHN Cn1nc(-c2ccc(Cl)s2)cc1NC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000490528537 904077826 /nfs/dbraw/zinc/07/78/26/904077826.db2.gz SDOIVCGJSBVCLP-LIRRHRJNSA-N 0 3 415.950 4.369 20 0 HIADHN Cc1n[nH]c(C)c1[C@H]1CCCCCN1C(=O)CCCN1CCN(c2ccccc2)CC1 ZINC000490634581 904148246 /nfs/dbraw/zinc/14/82/46/904148246.db2.gz DENDLHZSKQCPLX-HSZRJFAPSA-N 0 3 423.605 4.073 20 0 HIADHN O=C1C[C@@H]([C@@H]2CCCCN2Cc2csc(-c3ccc(Br)cc3)n2)CN1 ZINC000490674523 904167796 /nfs/dbraw/zinc/16/77/96/904167796.db2.gz NYRLWYJFBSEBRI-PBHICJAKSA-N 0 3 420.376 4.063 20 0 HIADHN CC(C)(C)[C@@H]1C[C@@H](NC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)CCO1 ZINC000490821168 904265951 /nfs/dbraw/zinc/26/59/51/904265951.db2.gz AUAYQSSZBPCSMP-BBTUJRGHSA-N 0 3 412.496 4.151 20 0 HIADHN COc1cccc([C@@H](CNC(=O)N2CCC[C@H]2c2nc3cc(C)ccc3[nH]2)N(C)C)c1 ZINC000490929851 904324126 /nfs/dbraw/zinc/32/41/26/904324126.db2.gz ZCFNYZFULKDPEX-FCHUYYIVSA-N 0 3 421.545 4.029 20 0 HIADHN COc1cccc([C@@H](CNC(=O)N2CCC[C@H]2c2nc3ccc(C)cc3[nH]2)N(C)C)c1 ZINC000490929851 904324133 /nfs/dbraw/zinc/32/41/33/904324133.db2.gz ZCFNYZFULKDPEX-FCHUYYIVSA-N 0 3 421.545 4.029 20 0 HIADHN O=C([C@H]1CN(Cc2ccccc2)CCC1(F)F)N1CCc2[nH]c3ccccc3c2C1 ZINC000506101140 914804305 /nfs/dbraw/zinc/80/43/05/914804305.db2.gz NFQFEGWHKJPPCX-HXUWFJFHSA-N 0 3 409.480 4.210 20 0 HIADHN CCN(CC)C[C@H](C)N[C@@H](c1cccc(S(C)(=O)=O)c1)c1ccc(C)cc1C ZINC000491035351 904387266 /nfs/dbraw/zinc/38/72/66/904387266.db2.gz JJNVVBUCEQUTDN-CVDCTZTESA-N 0 3 402.604 4.116 20 0 HIADHN COc1ccc([C@@H](NCC2CCN(C(C)=O)CC2)c2ccccc2Cl)cc1OC ZINC000491034512 904387443 /nfs/dbraw/zinc/38/74/43/904387443.db2.gz GZXHAJLCSZITAT-HSZRJFAPSA-N 0 3 416.949 4.295 20 0 HIADHN CCN(CC)C[C@@H](C)N[C@H](c1cccc(S(C)(=O)=O)c1)c1ccc(C)cc1C ZINC000491035350 904387932 /nfs/dbraw/zinc/38/79/32/904387932.db2.gz JJNVVBUCEQUTDN-AUSIDOKSSA-N 0 3 402.604 4.116 20 0 HIADHN CCCc1nc(C)c(CNC(=O)NC[C@H](c2ccc(CC(C)C)cc2)N(C)C)o1 ZINC000491079191 904416644 /nfs/dbraw/zinc/41/66/44/904416644.db2.gz JJQCJQAYFPKVCA-HXUWFJFHSA-N 0 3 400.567 4.236 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)N2CC(C)(C)[C@H]2c2cccnc2)N(C)C)cc1 ZINC000491082967 904418698 /nfs/dbraw/zinc/41/86/98/904418698.db2.gz XBVPJEGUFMXGHA-FGZHOGPDSA-N 0 3 410.562 4.264 20 0 HIADHN CC[C@H](C)C(=O)Nc1cccc(CNC(=O)NC[C@H](c2ccccc2)N2CCCC2)c1 ZINC000506120019 914810912 /nfs/dbraw/zinc/81/09/12/914810912.db2.gz PUKMJSDOBJXPCI-WMZHIEFXSA-N 0 3 422.573 4.308 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000491114641 904438828 /nfs/dbraw/zinc/43/88/28/904438828.db2.gz AAHSKDFHMSQSLI-XMMPIXPASA-N 0 3 416.569 4.155 20 0 HIADHN CC[C@H](C)C(=O)Nc1cccc(CNC(=O)NC[C@@H](c2ccccc2)N2CCCC2)c1 ZINC000506120016 914811366 /nfs/dbraw/zinc/81/13/66/914811366.db2.gz PUKMJSDOBJXPCI-CVDCTZTESA-N 0 3 422.573 4.308 20 0 HIADHN COc1ccccc1-c1ncc(CNC[C@H](C)c2nc(-c3ccccc3)no2)cn1 ZINC000491226713 904490496 /nfs/dbraw/zinc/49/04/96/904490496.db2.gz XVLLGIKJCSADRZ-INIZCTEOSA-N 0 3 401.470 4.096 20 0 HIADHN Cc1ccc(NC(=O)C2(CNCc3cnnn3Cc3ccccc3)CCCC2)cc1C ZINC000491238053 904495982 /nfs/dbraw/zinc/49/59/82/904495982.db2.gz UILQAFMURMTEKG-UHFFFAOYSA-N 0 3 417.557 4.232 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](NCCCOCC2CC2)c2ccc(Cl)cc2)c1 ZINC000491270086 904511337 /nfs/dbraw/zinc/51/13/37/904511337.db2.gz FVWSYEYJNJVUQQ-NRFANRHFSA-N 0 3 407.963 4.239 20 0 HIADHN CCN1CC[C@H](NCc2cnnn2Cc2ccccc2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000491271197 904513236 /nfs/dbraw/zinc/51/32/36/904513236.db2.gz LZEZVMGITMMQLQ-VXKWHMMOSA-N 0 3 413.928 4.044 20 0 HIADHN COc1ccccc1-c1ncc(CN[C@@H]2CCN(c3ccc(F)c(Cl)c3)C2)cn1 ZINC000491273058 904515048 /nfs/dbraw/zinc/51/50/48/904515048.db2.gz UCVGTQNIHOMOTF-MRXNPFEDSA-N 0 3 412.896 4.313 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](NCCc2cccc(F)c2)c2ccc(F)cc2)c1 ZINC000491296760 904522313 /nfs/dbraw/zinc/52/23/13/904522313.db2.gz SOFQXFGUTPZLQT-JOCHJYFZSA-N 0 3 401.478 4.290 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCc3ccc(C4CC4)cc3F)c(C)c2)CC1 ZINC000491309121 904528953 /nfs/dbraw/zinc/52/89/53/904528953.db2.gz JMWKWEMKYMYUBN-UHFFFAOYSA-N 0 3 410.537 4.475 20 0 HIADHN Cc1ccc([C@H](NCCN(C(C)C)C(C)C)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000491355021 904552288 /nfs/dbraw/zinc/55/22/88/904552288.db2.gz DQOZMXAXVWPWRD-QHCPKHFHSA-N 0 3 402.604 4.196 20 0 HIADHN Cc1ccc([C@@H](NCCN(C(C)C)C(C)C)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000491355020 904553226 /nfs/dbraw/zinc/55/32/26/904553226.db2.gz DQOZMXAXVWPWRD-HSZRJFAPSA-N 0 3 402.604 4.196 20 0 HIADHN COc1cc(CN2CCC[C@H](c3nnc4ccccn43)C2)ccc1OCC(F)(F)F ZINC000506146041 914823577 /nfs/dbraw/zinc/82/35/77/914823577.db2.gz AINOFGUNWXDNBV-INIZCTEOSA-N 0 3 420.435 4.059 20 0 HIADHN CC(=O)Nc1cccc(NC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)c1 ZINC000491436855 904597530 /nfs/dbraw/zinc/59/75/30/904597530.db2.gz XXKGUVGDFPTPEU-HXUWFJFHSA-N 0 3 405.420 4.038 20 0 HIADHN O=C(Nc1ccccc1O)C1CCN(Cc2c[nH]nc2-c2ccc(Cl)cc2)CC1 ZINC000506153048 914826824 /nfs/dbraw/zinc/82/68/24/914826824.db2.gz KZYWTTHVWQWDQF-UHFFFAOYSA-N 0 3 410.905 4.286 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)Nc2cc(F)c(OC(F)F)cc2F)CN1Cc1ccccc1 ZINC000491472755 904615061 /nfs/dbraw/zinc/61/50/61/904615061.db2.gz XQTYAWXDLGPEIW-TZMCWYRMSA-N 0 3 411.399 4.351 20 0 HIADHN COCC1(CNCc2c(Cl)cccc2OCc2cccc(OC)c2)CCOCC1 ZINC000491588137 904663233 /nfs/dbraw/zinc/66/32/33/904663233.db2.gz FOBLNQUOZNLOFX-UHFFFAOYSA-N 0 3 419.949 4.460 20 0 HIADHN CN(C)[C@H](CNC(=O)N1CCC[C@H](c2nc3ccc(F)cc3o2)C1)Cc1ccccc1 ZINC000506183672 914836868 /nfs/dbraw/zinc/83/68/68/914836868.db2.gz NCXPLTGJGWBUCN-ICSRJNTNSA-N 0 3 424.520 4.029 20 0 HIADHN Cc1nn(-c2ccc(Cl)c(Cl)c2)c(NC(=O)N2CC[C@H]3CCN(C)C[C@@H]32)c1C ZINC000492019232 904760311 /nfs/dbraw/zinc/76/03/11/904760311.db2.gz GYHGOSOMKHVXBW-KDOFPFPSSA-N 0 3 422.360 4.354 20 0 HIADHN Cc1cc(-c2nc3cc(F)ccc3n2C)ccc1NC(=O)N1CC[C@H]2CCN(C)C[C@H]21 ZINC000492067494 904785011 /nfs/dbraw/zinc/78/50/11/904785011.db2.gz MAJSSDXZPAPFIA-OPAMFIHVSA-N 0 3 421.520 4.246 20 0 HIADHN CC(C)c1nnc(CCNCc2cnn(Cc3ccc(C(F)(F)F)cc3)c2)s1 ZINC000492149254 904806647 /nfs/dbraw/zinc/80/66/47/904806647.db2.gz DPQVQFXDTICAPY-UHFFFAOYSA-N 0 3 409.481 4.257 20 0 HIADHN C[C@@H](NCc1cnn(-c2ccc(Br)cc2)c1)[C@@H]1OCCc2sccc21 ZINC000492192547 904811767 /nfs/dbraw/zinc/81/17/67/904811767.db2.gz HLRQKZOHNLXRBQ-YJYMSZOUSA-N 0 3 418.360 4.488 20 0 HIADHN C[C@@H](NCc1cc(Br)c2c(c1)OCCO2)[C@@H]1OCCc2sccc21 ZINC000492194050 904812865 /nfs/dbraw/zinc/81/28/65/904812865.db2.gz QCJLPHKPIWPKNV-DIFFPNOSSA-N 0 3 410.333 4.074 20 0 HIADHN CC1(C)Cc2c(cccc2Br)[C@H]1NCc1ccc(S(C)(=O)=O)cc1 ZINC000492211531 904816086 /nfs/dbraw/zinc/81/60/86/904816086.db2.gz SZLQJWWEEHZMIX-GOSISDBHSA-N 0 3 408.361 4.266 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)C(=O)Nc1nc(C(C)C)cs1)c1ccc(Cl)cc1 ZINC000506214326 914848268 /nfs/dbraw/zinc/84/82/68/914848268.db2.gz INCDHDASMXDCNR-KRWDZBQOSA-N 0 3 422.982 4.058 20 0 HIADHN COc1ccc([C@@H](N[C@@H](C)CN2CCOCC2)c2ccc(C(F)(F)F)cc2)cc1 ZINC000492517447 904863704 /nfs/dbraw/zinc/86/37/04/904863704.db2.gz XLYRYBLRQLXFLH-KKSFZXQISA-N 0 3 408.464 4.114 20 0 HIADHN CN(C)C[C@@H](NC(=O)Nc1nc(C2CCOCC2)cs1)c1ccc(Cl)cc1 ZINC000492533634 904865023 /nfs/dbraw/zinc/86/50/23/904865023.db2.gz BJJSYHYWXFNOMZ-MRXNPFEDSA-N 0 3 408.955 4.115 20 0 HIADHN CCCCCOc1ccc(C(=O)CCC(=O)N2CCC[C@@H]3CN(C)CC[C@H]32)cc1 ZINC000492788300 904904184 /nfs/dbraw/zinc/90/41/84/904904184.db2.gz HZPLFBQMCFQSKZ-IFMALSPDSA-N 0 3 400.563 4.161 20 0 HIADHN C[C@H](Cc1ccncc1)NC(=O)N(CCN(C)Cc1ccccc1)Cc1ccccc1 ZINC000492937919 904955875 /nfs/dbraw/zinc/95/58/75/904955875.db2.gz SMVOEMKBYIODSF-JOCHJYFZSA-N 0 3 416.569 4.356 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N(C)Cc3cccc4[nH]ccc43)c(C)c2)CC1 ZINC000492959730 904968378 /nfs/dbraw/zinc/96/83/78/904968378.db2.gz LCCCIWDPBUXYOT-UHFFFAOYSA-N 0 3 405.546 4.282 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)c2c(F)ccc(C)c2Br)N(C)C)cc1 ZINC000493048698 905002450 /nfs/dbraw/zinc/00/24/50/905002450.db2.gz HPSIDYDIMIISDC-QGZVFWFLSA-N 0 3 407.327 4.492 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](NCC2(CCO)CCCC2)c2ccc(Cl)cc2)c1 ZINC000493058355 905006218 /nfs/dbraw/zinc/00/62/18/905006218.db2.gz NKWLPMJZFSXIFE-OAQYLSRUSA-N 0 3 421.990 4.365 20 0 HIADHN O=C(Nc1ncc(Cc2ccccc2)s1)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000493100087 905015953 /nfs/dbraw/zinc/01/59/53/905015953.db2.gz ZOBNQRLCBCKGEV-UHFFFAOYSA-N 0 3 421.566 4.191 20 0 HIADHN CC(C)N1CCC(N[C@@H](c2ccc(Cl)cc2)c2cccc(S(C)(=O)=O)c2)CC1 ZINC000493130015 905026607 /nfs/dbraw/zinc/02/66/07/905026607.db2.gz MYIRYFUVGLTDRI-QFIPXVFZSA-N 0 3 421.006 4.295 20 0 HIADHN COc1ccc([C@H](NC[C@H](C)CN2CCOCC2)c2ccccc2Cl)cc1OC ZINC000493148994 905033130 /nfs/dbraw/zinc/03/31/30/905033130.db2.gz NCCLRBBSYKNPAU-SBUREZEXSA-N 0 3 418.965 4.005 20 0 HIADHN CC[C@@H]1CCCCN1CCN[C@@H](c1ccc(C)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000493178425 905041134 /nfs/dbraw/zinc/04/11/34/905041134.db2.gz SRZUJYIJKOWIFV-VWNXMTODSA-N 0 3 414.615 4.342 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)c1c(F)ccc(Br)c1F ZINC000493177462 905041560 /nfs/dbraw/zinc/04/15/60/905041560.db2.gz CIODFEUHVUISLZ-MRXNPFEDSA-N 0 3 409.274 4.294 20 0 HIADHN CCc1ccc([C@@H](NCCc2nc(C)oc2C)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000493233394 905059493 /nfs/dbraw/zinc/05/94/93/905059493.db2.gz ULSMLPRCKOWIMN-HSZRJFAPSA-N 0 3 412.555 4.179 20 0 HIADHN CC(C)(CCCO)CN[C@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000493247562 905068205 /nfs/dbraw/zinc/06/82/05/905068205.db2.gz LODLLBSZJMDOAK-HXUWFJFHSA-N 0 3 409.979 4.221 20 0 HIADHN COCC(=O)N1CCC(N[C@@H](c2cccc(SC)c2)c2ccc(F)c(F)c2)CC1 ZINC000493251778 905070626 /nfs/dbraw/zinc/07/06/26/905070626.db2.gz VKZHVSSOIIQHGU-QFIPXVFZSA-N 0 3 420.525 4.003 20 0 HIADHN COCC(=O)N1CCC(N[C@@H](c2ccccc2Cl)c2cc(C)ccc2C)CC1 ZINC000493276467 905072845 /nfs/dbraw/zinc/07/28/45/905072845.db2.gz JTIOZCMFZQXCSR-QHCPKHFHSA-N 0 3 400.950 4.273 20 0 HIADHN CCO[C@@H](CCN[C@@H](c1ccc(F)cc1)c1cccc(S(C)(=O)=O)c1)C(C)C ZINC000493308849 905084503 /nfs/dbraw/zinc/08/45/03/905084503.db2.gz ZXQYWZRSTADIQK-VXKWHMMOSA-N 0 3 407.551 4.359 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)c3ccc(CSc4nc5ccccc5[nH]4)cc3)[C@H]2C1 ZINC000493436475 905117503 /nfs/dbraw/zinc/11/75/03/905117503.db2.gz CRUTXCSZWOLKHT-UWJYYQICSA-N 0 3 406.555 4.021 20 0 HIADHN Cc1ccc(-c2cc(C(=O)N3CC[C@@H]4CCN(C)C[C@@H]43)c3cnn(C(C)C)c3n2)cc1 ZINC000493533789 905149442 /nfs/dbraw/zinc/14/94/42/905149442.db2.gz DCJDWLBAWTZGDW-CVDCTZTESA-N 0 3 417.557 4.154 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)c3ccc(Oc4cccc(Br)c4)cc3)[C@H]2C1 ZINC000493537677 905152074 /nfs/dbraw/zinc/15/20/74/905152074.db2.gz XYPIKMCMMKJYHX-YWZLYKJASA-N 0 3 415.331 4.408 20 0 HIADHN COc1cc(C(=O)N2CC[C@@H]3CCN(C)C[C@@H]32)ccc1OCc1ccccc1Cl ZINC000493556330 905161131 /nfs/dbraw/zinc/16/11/31/905161131.db2.gz PZQIHACJVIJISW-JXFKEZNVSA-N 0 3 414.933 4.094 20 0 HIADHN Cc1nc2ccc(Br)cc2c(N[C@H]2CCOC3(CCOCC3)C2)c1C ZINC000493606063 905172925 /nfs/dbraw/zinc/17/29/25/905172925.db2.gz ONIJTIOYDFZUJH-INIZCTEOSA-N 0 3 405.336 4.176 20 0 HIADHN COc1cc(Br)c(CNC2CCC(C(=O)OC(C)(C)C)CC2)cc1O ZINC000493687104 905193922 /nfs/dbraw/zinc/19/39/22/905193922.db2.gz LRECHSWLVKCRGP-UHFFFAOYSA-N 0 3 414.340 4.153 20 0 HIADHN CNS(=O)(=O)c1ccc([C@H](C)N[C@H]2CCc3cc(Br)cc(C)c32)cc1 ZINC000493843988 905231974 /nfs/dbraw/zinc/23/19/74/905231974.db2.gz MOGJASOIEMSLJR-UGSOOPFHSA-N 0 3 423.376 4.004 20 0 HIADHN C[C@H](N[C@H](Cc1ccccc1)C(=O)N1CCCC1)c1cc(Br)cs1 ZINC000493888271 905248644 /nfs/dbraw/zinc/24/86/44/905248644.db2.gz LKTLDZGDFPBPBG-WMLDXEAASA-N 0 3 407.377 4.395 20 0 HIADHN CN1C(=O)C[C@@H](NCc2cc(F)cc3cccnc32)[C@H]1c1ccc(Cl)c(F)c1 ZINC000493909553 905262562 /nfs/dbraw/zinc/26/25/62/905262562.db2.gz WBQKIFOTYKOFAE-WIYYLYMNSA-N 0 3 401.844 4.228 20 0 HIADHN COCCSc1ccc([C@H](C)NC(=O)N[C@H](CN(C)C)c2ccc(F)cc2)cc1 ZINC000493939519 905292008 /nfs/dbraw/zinc/29/20/08/905292008.db2.gz FJKSJCKDRAWMGX-HRAATJIYSA-N 0 3 419.566 4.227 20 0 HIADHN Cc1cc(Br)cc2c1[C@@H](NCc1ccc(CS(C)(=O)=O)cc1)CC2 ZINC000493943893 905295652 /nfs/dbraw/zinc/29/56/52/905295652.db2.gz GHTZQESNADJZCV-SFHVURJKSA-N 0 3 408.361 4.079 20 0 HIADHN Cc1cc(F)ccc1N1CCC[C@H](N[C@@H]2CCO[C@@H]2c2ccc(F)c(F)c2)C1=O ZINC000493951594 905302489 /nfs/dbraw/zinc/30/24/89/905302489.db2.gz CMYOQCCGEKEABY-SVFBPWRDSA-N 0 3 404.432 4.028 20 0 HIADHN CSc1nc(C(C)(C)C)nc(C)c1C(=O)N[C@H]1CCN(Cc2ccccc2)[C@H]1C ZINC000494017101 905354749 /nfs/dbraw/zinc/35/47/49/905354749.db2.gz LBPBRUYGLHMRBE-WMZOPIPTSA-N 0 3 412.603 4.197 20 0 HIADHN CCc1ccc([C@H](NCC(C)(C)C[C@H](C)O)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000494018787 905357165 /nfs/dbraw/zinc/35/71/65/905357165.db2.gz FIFOPQYDAFSQHH-JTSKRJEESA-N 0 3 403.588 4.129 20 0 HIADHN CC(C)[C@@H]1OCCC[C@H]1CN[C@H](c1ccc(F)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000494021426 905364408 /nfs/dbraw/zinc/36/44/08/905364408.db2.gz WLIKQYFZTRKKMD-PMOQBDJRSA-N 0 3 419.562 4.359 20 0 HIADHN COc1cc(-c2ccccc2)ccc1CNCc1ccccc1CN1CCOCC1 ZINC000512412383 921144051 /nfs/dbraw/zinc/14/40/51/921144051.db2.gz UOYRLBCZNPXYMP-UHFFFAOYSA-N 0 3 402.538 4.484 20 0 HIADHN COCCN(CCC(=O)Nc1ccccc1F)Cc1cc(Br)cs1 ZINC000494097972 905430582 /nfs/dbraw/zinc/43/05/82/905430582.db2.gz JZCPZBWRACPWTR-UHFFFAOYSA-N 0 3 415.328 4.127 20 0 HIADHN COCCOc1cccc(CN2CCC[C@H](CNC(=O)Nc3ccc(C)cc3)C2)c1 ZINC000512425513 921152633 /nfs/dbraw/zinc/15/26/33/921152633.db2.gz AVBMUVNLQUEQTB-OAQYLSRUSA-N 0 3 411.546 4.054 20 0 HIADHN O=C(NCc1ccnc(Oc2ccccc2F)c1)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000494181283 905516743 /nfs/dbraw/zinc/51/67/43/905516743.db2.gz ARAZBWJLDQCGOY-HXUWFJFHSA-N 0 3 420.488 4.087 20 0 HIADHN CC(C)c1ccc([C@H](NC(=O)N2CCN(C3CCOCC3)C[C@@H]2C)C(C)C)cc1 ZINC000494215734 905547089 /nfs/dbraw/zinc/54/70/89/905547089.db2.gz KCXILBDUSLIGPG-WMZHIEFXSA-N 0 3 401.595 4.402 20 0 HIADHN C[C@H](CC(=O)NCCCN1CCN(C)C[C@H]1c1ccccc1)c1c[nH]c2ccccc21 ZINC000494312988 905627898 /nfs/dbraw/zinc/62/78/98/905627898.db2.gz OALFDFRTKRQBGY-NLFFAJNJSA-N 0 3 418.585 4.157 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3cc(OC)c(C(C)C)c(OC)c3)cc2)CC1 ZINC000494327558 905638804 /nfs/dbraw/zinc/63/88/04/905638804.db2.gz ANCZAELFZNNZIQ-UHFFFAOYSA-N 0 3 411.546 4.221 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@H](C)NCc2ccc3nc(C)sc3c2)cc1 ZINC000494328352 905640551 /nfs/dbraw/zinc/64/05/51/905640551.db2.gz KIBPUOSMEVDSCW-HNNXBMFYSA-N 0 3 417.600 4.486 20 0 HIADHN CCCC(=O)NC[C@@H]1CCCN(Cc2cn(-c3ccccc3)nc2-c2ccncc2)C1 ZINC000512474796 921185147 /nfs/dbraw/zinc/18/51/47/921185147.db2.gz NMJNEEMITJGWPM-FQEVSTJZSA-N 0 3 417.557 4.063 20 0 HIADHN CCCC(=O)NC[C@H]1CCCN(Cc2c(C)nn(Cc3ccccc3Cl)c2C)C1 ZINC000512475242 921185228 /nfs/dbraw/zinc/18/52/28/921185228.db2.gz QWBPRDMJPFIBJC-LJQANCHMSA-N 0 3 416.997 4.330 20 0 HIADHN Cc1nn(C(C)(C)C)c(C)c1CN1CCC[C@@H](CNC(=O)Nc2cccc(F)c2)C1 ZINC000512478739 921188326 /nfs/dbraw/zinc/18/83/26/921188326.db2.gz DNZGXPLYKMNNCB-SFHVURJKSA-N 0 3 415.557 4.428 20 0 HIADHN COc1ccccc1CC(C)(C)C(=O)N1CCCN(CCCc2ccccc2)CC1 ZINC000494746650 905946145 /nfs/dbraw/zinc/94/61/45/905946145.db2.gz NWINVQTUHUGXNE-UHFFFAOYSA-N 0 3 408.586 4.431 20 0 HIADHN CSCC[C@@H](NCCc1cccc(OC(F)(F)F)c1)c1nnc2ccccn21 ZINC000494787889 905990282 /nfs/dbraw/zinc/99/02/82/905990282.db2.gz MYMLHWOMQFXEBF-MRXNPFEDSA-N 0 3 410.465 4.254 20 0 HIADHN Cc1ccc2c(c1)[C@H](NC(=O)N(C)C1CCN(CCc3ccccn3)CC1)CCC2 ZINC000494863158 906048144 /nfs/dbraw/zinc/04/81/44/906048144.db2.gz HENFZYIOGLZHMR-XMMPIXPASA-N 0 3 406.574 4.116 20 0 HIADHN CN1CCN(CC(=O)N2CCc3sccc3[C@H]2c2ccccc2)C2(CCCCC2)C1 ZINC000494893781 906068408 /nfs/dbraw/zinc/06/84/08/906068408.db2.gz PYBMGBYYZPASQJ-XMMPIXPASA-N 0 3 423.626 4.173 20 0 HIADHN Cc1ccc(Oc2ccccc2CNC(=O)N2CCN(C3CCOCC3)C[C@@H]2C)cc1 ZINC000494896225 906070412 /nfs/dbraw/zinc/07/04/12/906070412.db2.gz XEYZNVAZTQQLKE-FQEVSTJZSA-N 0 3 423.557 4.182 20 0 HIADHN Cc1ccc(Oc2ccccc2CNC(=O)N2CCN(C3CCOCC3)C[C@H]2C)cc1 ZINC000494896234 906071064 /nfs/dbraw/zinc/07/10/64/906071064.db2.gz XEYZNVAZTQQLKE-HXUWFJFHSA-N 0 3 423.557 4.182 20 0 HIADHN CCc1c(NC(=O)N(C)C[C@@H]2CCN(C)[C@H]2c2cccnc2)cnn1CCC(C)C ZINC000494908669 906082981 /nfs/dbraw/zinc/08/29/81/906082981.db2.gz LOUYORWTEHRXTQ-UGKGYDQZSA-N 0 3 412.582 4.043 20 0 HIADHN C[C@H](NC(=O)N1CCN(C2CCOCC2)C[C@H]1C)c1ccc(Oc2ccccc2)cc1 ZINC000494912124 906086720 /nfs/dbraw/zinc/08/67/20/906086720.db2.gz SYCGPUJHEOVLJA-UXHICEINSA-N 0 3 423.557 4.435 20 0 HIADHN FC(F)(F)Oc1cccc(CN2CCC(c3nc(-c4ccccn4)no3)CC2)c1 ZINC000512506654 921205228 /nfs/dbraw/zinc/20/52/28/921205228.db2.gz OLIUHFSBGIUTSR-UHFFFAOYSA-N 0 3 404.392 4.410 20 0 HIADHN C[C@H](NC(=O)N[C@@H](CN(C)C)c1ccc(Cl)cc1)[C@H]1OCCc2sccc21 ZINC000494959294 906130332 /nfs/dbraw/zinc/13/03/32/906130332.db2.gz MTUKXRRCZGNSIX-SOVGHPHASA-N 0 3 407.967 4.006 20 0 HIADHN CCc1ccc([C@H](NCC2([C@@H](O)C(C)C)CC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000494966966 906135934 /nfs/dbraw/zinc/13/59/34/906135934.db2.gz CUAQPIOZUSMMGY-GOTSBHOMSA-N 0 3 415.599 4.129 20 0 HIADHN CCn1nc(C)c(CN2CCC(C(=O)Nc3cccc(Br)c3)CC2)c1C ZINC000512517645 921210367 /nfs/dbraw/zinc/21/03/67/921210367.db2.gz ZBKGUZWPZXNZIC-UHFFFAOYSA-N 0 3 419.367 4.133 20 0 HIADHN Cc1ccc(-c2n[nH]cc2CN2CCC(c3nc(-c4ccccn4)no3)CC2)cc1 ZINC000512517161 921210656 /nfs/dbraw/zinc/21/06/56/921210656.db2.gz RGECRLUWPUEGJC-UHFFFAOYSA-N 0 3 400.486 4.210 20 0 HIADHN Brc1cccc(N2CC[C@H](N[C@H](c3nc[nH]n3)C3CCCCC3)C2)c1 ZINC000495001355 906162823 /nfs/dbraw/zinc/16/28/23/906162823.db2.gz WYIDEYDTIODUCC-WMZOPIPTSA-N 0 3 404.356 4.057 20 0 HIADHN CCN1CCN(Cc2ccc(CNC(=O)Nc3cccc4ccc(C)nc43)cc2)CC1 ZINC000512519109 921211659 /nfs/dbraw/zinc/21/16/59/921211659.db2.gz PEJXTKMOTYTOMQ-UHFFFAOYSA-N 0 3 417.557 4.002 20 0 HIADHN Fc1ccc([C@@H](C[C@H]2CCOC2)NCc2cc(F)ccc2N2CCOCC2)cc1 ZINC000495041733 906198468 /nfs/dbraw/zinc/19/84/68/906198468.db2.gz VDYGRFWNFGPPKQ-VGOFRKELSA-N 0 3 402.485 4.059 20 0 HIADHN Brc1ccccc1[C@H](N[C@H]1CCO[C@]2(CCOC2)C1)c1ccccc1 ZINC000495063010 906215398 /nfs/dbraw/zinc/21/53/98/906215398.db2.gz GKRMKSJSRYSSBT-IOMROCGXSA-N 0 3 402.332 4.466 20 0 HIADHN Cc1cnc(-c2cccc(NC(=O)c3ccc(CN4CCC(CO)CC4)cc3)c2)o1 ZINC000495162473 906279351 /nfs/dbraw/zinc/27/93/51/906279351.db2.gz ZJWVHHNCOBGQAZ-UHFFFAOYSA-N 0 3 405.498 4.107 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)c2cccc(F)c2Br)cc1 ZINC000495344884 906390625 /nfs/dbraw/zinc/39/06/25/906390625.db2.gz FIABCKZCOTWINU-GOSISDBHSA-N 0 3 421.310 4.164 20 0 HIADHN COc1ccc(CN2CCC(c3nc(-c4ccccc4)n[nH]3)CC2)cc1OC(F)F ZINC000512557136 921234758 /nfs/dbraw/zinc/23/47/58/921234758.db2.gz MHLFIKMQTAHKBT-UHFFFAOYSA-N 0 3 414.456 4.461 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)N[C@@H](C)c2nc(-c3ccccc3)cs2)cc1 ZINC000495425451 906442875 /nfs/dbraw/zinc/44/28/75/906442875.db2.gz BEEOEECUYDURME-OXJNMPFZSA-N 0 3 424.570 4.482 20 0 HIADHN CCCC[C@H](NCCc1nc(-c2ccc(Cl)cc2)no1)C(=O)Nc1cc(C)on1 ZINC000495470348 906470890 /nfs/dbraw/zinc/47/08/90/906470890.db2.gz NHLLCDPXBXYYPP-INIZCTEOSA-N 0 3 417.897 4.016 20 0 HIADHN CCCC[C@@H](NCCc1cc(Br)ccc1F)C(=O)Nc1cc(C)on1 ZINC000495560963 906502679 /nfs/dbraw/zinc/50/26/79/906502679.db2.gz GMKYCYPIGCHDOH-MRXNPFEDSA-N 0 3 412.303 4.214 20 0 HIADHN O=C(Nc1cccc(-c2ccccc2)c1)N[C@H]1CCN(Cc2ccccc2)C[C@H]1CO ZINC000495580152 906507960 /nfs/dbraw/zinc/50/79/60/906507960.db2.gz ZGBFILKNOZNADQ-ZCYQVOJMSA-N 0 3 415.537 4.358 20 0 HIADHN COc1cc(OC)cc(Oc2cccc(CNCc3ccc(-n4cncn4)cc3)c2)c1 ZINC000512570154 921243340 /nfs/dbraw/zinc/24/33/40/921243340.db2.gz SGTUTBIQJRUNGZ-UHFFFAOYSA-N 0 3 416.481 4.367 20 0 HIADHN O=C(Nc1ccc(O)cc1)C1CCN(Cc2ccccc2OCc2cccnc2)CC1 ZINC000512581770 921248654 /nfs/dbraw/zinc/24/86/54/921248654.db2.gz JMOBJOZEWFPISM-UHFFFAOYSA-N 0 3 417.509 4.217 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)[C@@H](C)Sc1ccc(OC)cc1 ZINC000496228469 906634153 /nfs/dbraw/zinc/63/41/53/906634153.db2.gz ZDIOCBNFZFYPGL-UYAOXDASSA-N 0 3 413.587 4.084 20 0 HIADHN COc1cccc(C[C@@H](C)NC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)c1 ZINC000496260307 906640157 /nfs/dbraw/zinc/64/01/57/906640157.db2.gz BVMYJPRJSRWBID-VGOFRKELSA-N 0 3 420.475 4.197 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)c1sccc1Br ZINC000496266213 906642885 /nfs/dbraw/zinc/64/28/85/906642885.db2.gz YCRWYVGQTJROJT-HNNXBMFYSA-N 0 3 408.365 4.032 20 0 HIADHN O=C(c1ccc(Br)cn1)N(CCN1CCCC1)Cc1ccc(Cl)cc1 ZINC000496814376 906760705 /nfs/dbraw/zinc/76/07/05/906760705.db2.gz AKHKYAIEBYZYCS-UHFFFAOYSA-N 0 3 422.754 4.236 20 0 HIADHN CCOc1cc(CNC(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)ccc1OC ZINC000512619749 921264536 /nfs/dbraw/zinc/26/45/36/921264536.db2.gz NAIMQEAAVHXVRG-NRFANRHFSA-N 0 3 411.546 4.039 20 0 HIADHN COc1ccc([C@H]2CCCN2C[C@H](O)COCc2ccccc2Cl)cc1OC ZINC000497095013 906803352 /nfs/dbraw/zinc/80/33/52/906803352.db2.gz FRLRRCWHIWWIAF-AZUAARDMSA-N 0 3 405.922 4.072 20 0 HIADHN CN(Cc1ccc(OC(F)(F)F)cc1)C[C@H](O)COCc1ccccc1Cl ZINC000497161137 906815282 /nfs/dbraw/zinc/81/52/82/906815282.db2.gz LOSACABHWZAIQU-INIZCTEOSA-N 0 3 403.828 4.248 20 0 HIADHN CC(C)[C@H](c1ccccc1)N(C)CC(=O)NC1CCN(C(=O)C2CCCCC2)CC1 ZINC000497358639 906850898 /nfs/dbraw/zinc/85/08/98/906850898.db2.gz UPXNIGLHYGXRKB-XMMPIXPASA-N 0 3 413.606 4.003 20 0 HIADHN CC(C)[C@@H](c1ccccc1)N(C)CC(=O)N1CCC[C@H]1c1ccc2c(c1)OCCO2 ZINC000497384240 906870187 /nfs/dbraw/zinc/87/01/87/906870187.db2.gz GRDWRBVJJIKIDN-OFVILXPXSA-N 0 3 408.542 4.450 20 0 HIADHN COc1ccc([C@@H](C)NC(=O)NC[C@@H]2CCCN2Cc2ccccc2)c(C)c1OC ZINC000497445281 906918981 /nfs/dbraw/zinc/91/89/81/906918981.db2.gz WNGOZJMKBAVKJY-QUCCMNQESA-N 0 3 411.546 4.037 20 0 HIADHN CN(CCCN1CCN(C)CC1)C(=O)N[C@@H](CC(C)(C)C)c1ccc(Cl)cc1 ZINC000497499006 906983811 /nfs/dbraw/zinc/98/38/11/906983811.db2.gz XRMPQZNBGYIXST-FQEVSTJZSA-N 0 3 409.018 4.096 20 0 HIADHN COc1ccccc1[C@H](NC(=O)N1CC[C@@H]2CCN(C)C[C@H]21)c1ccccc1Cl ZINC000497498665 906984743 /nfs/dbraw/zinc/98/47/43/906984743.db2.gz AEQLMKCPUSDJIE-SAWYMBPVSA-N 0 3 413.949 4.174 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)c1ccc(Oc2ccccc2)nc1 ZINC000512703634 921292438 /nfs/dbraw/zinc/29/24/38/921292438.db2.gz GSSGPZASVWHCAT-JOCHJYFZSA-N 0 3 416.525 4.396 20 0 HIADHN CCOc1ccc(CN2CCC(C(=O)NCc3ccc(C)cc3)CC2)cc1OCC ZINC000512705760 921292973 /nfs/dbraw/zinc/29/29/73/921292973.db2.gz PJCRYKNYLICIFF-UHFFFAOYSA-N 0 3 410.558 4.321 20 0 HIADHN CC(C)(C)[C@H](CN1CCc2ccccc2C1)NC(=O)N1CCC2(CCOCC2)CC1 ZINC000497617059 907094948 /nfs/dbraw/zinc/09/49/48/907094948.db2.gz NYAUSGFCUUMYBW-QFIPXVFZSA-N 0 3 413.606 4.062 20 0 HIADHN CC(C)(C)[C@@H](CN1CCc2ccccc2C1)NC(=O)N1CCCC[C@H]1c1cn[nH]c1 ZINC000497657385 907147443 /nfs/dbraw/zinc/14/74/43/907147443.db2.gz MPVAXXKCLGIMBL-FCHUYYIVSA-N 0 3 409.578 4.119 20 0 HIADHN CC(C)Cn1ncc(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2F)c1C1CC1 ZINC000497673153 907174335 /nfs/dbraw/zinc/17/43/35/907174335.db2.gz UNXLMWWYBRISJN-UHFFFAOYSA-N 0 3 419.520 4.290 20 0 HIADHN C[C@H]1[C@H](NC(=O)NCc2ccc(-c3ccncc3)cc2)CCN1Cc1ccccc1 ZINC000497707001 907212208 /nfs/dbraw/zinc/21/22/08/907212208.db2.gz XZTAKXQSNTYYOX-YADARESESA-N 0 3 400.526 4.211 20 0 HIADHN CN1CCCN(C(=O)CCc2cn(Cc3ccc(Cl)cc3)c3ccccc23)CC1 ZINC000497768145 907260343 /nfs/dbraw/zinc/26/03/43/907260343.db2.gz XRSPIGJCMVNXBI-UHFFFAOYSA-N 0 3 409.961 4.440 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)N(C)[C@@H](c2ccccc2)C(C)C)CC1 ZINC000497776808 907270183 /nfs/dbraw/zinc/27/01/83/907270183.db2.gz STRJICXAFCKUOK-RUZDIDTESA-N 0 3 422.617 4.363 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(Cl)cc2)CC1)[C@H]1CC[C@H](C(F)(F)F)C1 ZINC000512779865 921309961 /nfs/dbraw/zinc/30/99/61/921309961.db2.gz UVJRGDRZYMVNDC-GJZGRUSLSA-N 0 3 418.887 4.278 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(Cl)cc2)CC1)[C@H]1CC[C@@H](C(F)(F)F)C1 ZINC000512779867 921310215 /nfs/dbraw/zinc/31/02/15/921310215.db2.gz UVJRGDRZYMVNDC-LSDHHAIUSA-N 0 3 418.887 4.278 20 0 HIADHN C[C@H](NC(=O)N[C@@H](CN(C)C)c1ccc(Cl)cc1)c1nccn1-c1ccccc1 ZINC000512798182 921313182 /nfs/dbraw/zinc/31/31/82/921313182.db2.gz RTXYVZPOYACSOC-JXFKEZNVSA-N 0 3 411.937 4.189 20 0 HIADHN C[C@H](CCn1cccn1)N[C@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000497851959 907332148 /nfs/dbraw/zinc/33/21/48/907332148.db2.gz GXYDKXGNOBGHCL-IIBYNOLFSA-N 0 3 417.962 4.098 20 0 HIADHN CCS[C@@H]1CC[C@@H](N(C)C(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)C1 ZINC000512807940 921315673 /nfs/dbraw/zinc/31/56/73/921315673.db2.gz LWIJXGQEXWFCNS-HMXCVIKNSA-N 0 3 407.624 4.392 20 0 HIADHN CCOC1CC2(C1)CCN([C@@H]1CCCN(c3ccc(Br)c(C)c3)C1=O)C2 ZINC000512812314 921318046 /nfs/dbraw/zinc/31/80/46/921318046.db2.gz RZHRBVPWTKRQQQ-MOMVYJMYSA-N 0 3 421.379 4.144 20 0 HIADHN CC[C@H](C)[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)Nc1cccc(CN(C)C)c1 ZINC000497963463 907432911 /nfs/dbraw/zinc/43/29/11/907432911.db2.gz BKXJUQSPWKOLCR-MGPUTAFESA-N 0 3 401.938 4.185 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)[C@H](C)Sc3ccccc3)CC2)c1 ZINC000497967393 907434618 /nfs/dbraw/zinc/43/46/18/907434618.db2.gz CWPFLJHDUJTDSD-NRFANRHFSA-N 0 3 411.615 4.194 20 0 HIADHN COc1ccc([C@@H](CNC(=O)CCc2ccc(OC(F)F)cc2)N2CCCC2)cc1 ZINC000497984590 907462971 /nfs/dbraw/zinc/46/29/71/907462971.db2.gz PTOWRWGERHHBKQ-OAQYLSRUSA-N 0 3 418.484 4.183 20 0 HIADHN COc1ccc([C@H](CNC(=O)Cc2cc(Cl)ccc2Cl)N2CCCC2)cc1 ZINC000497987423 907466564 /nfs/dbraw/zinc/46/65/64/907466564.db2.gz XIUVCDVABLBDBW-FQEVSTJZSA-N 0 3 407.341 4.498 20 0 HIADHN CC(C)(c1ccccc1)c1ccc(OC[C@@H](O)CN2CC[C@@H](COC(F)F)C2)cc1 ZINC000512824984 921329902 /nfs/dbraw/zinc/32/99/02/921329902.db2.gz ZVGFAIYYJAAIOQ-NQIIRXRSSA-N 0 3 419.512 4.313 20 0 HIADHN COc1ccc([C@@H](CNC(=O)C[C@@H]2CCCc3cc(OC)ccc32)N2CCCC2)cc1 ZINC000497994548 907474430 /nfs/dbraw/zinc/47/44/30/907474430.db2.gz QQGAEFBHZAKOEE-SQJMNOBHSA-N 0 3 422.569 4.467 20 0 HIADHN COc1ccc([C@@H](CNC(=O)CCCOc2ccccc2Cl)N2CCCC2)cc1 ZINC000497999527 907482078 /nfs/dbraw/zinc/48/20/78/907482078.db2.gz ZJHHQCVNLVZRDI-OAQYLSRUSA-N 0 3 416.949 4.461 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)N2CCC[C@H](C(F)(F)F)C2)N(C)C)cc1 ZINC000512827454 921330994 /nfs/dbraw/zinc/33/09/94/921330994.db2.gz MRTGSNJOADQBPJ-WMZOPIPTSA-N 0 3 401.473 4.060 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)NCc2coc(-c3ccccc3)n2)N(C)C)cc1 ZINC000498033481 907537161 /nfs/dbraw/zinc/53/71/61/907537161.db2.gz VFSAGMHWQLINDP-JOCHJYFZSA-N 0 3 422.529 4.231 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)[C@@H]1C[C@H]1c1ccc(F)cc1F ZINC000498049547 907561259 /nfs/dbraw/zinc/56/12/59/907561259.db2.gz XMFROMOTWGZXQV-VQTJNVASSA-N 0 3 402.510 4.298 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F ZINC000498054858 907566114 /nfs/dbraw/zinc/56/61/14/907566114.db2.gz NHIORKGCPNQFDK-VQTJNVASSA-N 0 3 402.460 4.374 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)N2CC=C(c3ccc(O)cc3)CC2)N(C)C)cc1 ZINC000512831327 921335902 /nfs/dbraw/zinc/33/59/02/921335902.db2.gz FVYCQTUSMYHCRU-DEOSSOPVSA-N 0 3 423.557 4.281 20 0 HIADHN CC[C@H](OC1CCCC1)C(=O)N(CCN(C)C)Cc1ccc(Br)cc1 ZINC000498101620 907610737 /nfs/dbraw/zinc/61/07/37/907610737.db2.gz MIPDUHWXEXEJPC-IBGZPJMESA-N 0 3 411.384 4.077 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CCc2c(ncn2-c2ccccc2)C1)c1ccsc1 ZINC000498150434 907674941 /nfs/dbraw/zinc/67/49/41/907674941.db2.gz GCSKMIRMOGRHMG-QFIPXVFZSA-N 0 3 423.586 4.085 20 0 HIADHN C[C@H](CNC(=O)N[C@@H](c1cccc(F)c1)c1ccccn1)N(C)Cc1ccccc1 ZINC000498238328 907771426 /nfs/dbraw/zinc/77/14/26/907771426.db2.gz JZFREGSQOHKSFT-JPYJTQIMSA-N 0 3 406.505 4.130 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N[C@@H](c2cccc(F)c2)c2ccccn2)C1 ZINC000498238806 907772451 /nfs/dbraw/zinc/77/24/51/907772451.db2.gz KCKHWAOGOBXQSD-OUOWLKGYSA-N 0 3 418.516 4.445 20 0 HIADHN C[C@@H](CNC(=O)N[C@H](c1cccc(F)c1)c1ccccn1)N(C)Cc1ccccc1 ZINC000498238327 907772537 /nfs/dbraw/zinc/77/25/37/907772537.db2.gz JZFREGSQOHKSFT-FDDCHVKYSA-N 0 3 406.505 4.130 20 0 HIADHN C[C@@H](SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)NCCN1CCC(C)CC1 ZINC000498352197 907853034 /nfs/dbraw/zinc/85/30/34/907853034.db2.gz GCBQYPYXTKIZBS-MRXNPFEDSA-N 0 3 421.994 4.465 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)C3(c4ccc(C)c(OC)c4)CCC3)cc2)CC1 ZINC000498373380 907864245 /nfs/dbraw/zinc/86/42/45/907864245.db2.gz NQURMRIYPNGNQL-UHFFFAOYSA-N 0 3 421.585 4.202 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)COc1cccc(Br)c1)c1ccsc1 ZINC000498376460 907865964 /nfs/dbraw/zinc/86/59/64/907865964.db2.gz YSRGJNPPXIQKCP-KRWDZBQOSA-N 0 3 411.365 4.089 20 0 HIADHN COc1ccc([C@H](NC(=O)N2CCN3CCC2CC3)c2ccccc2Cl)c(C)c1 ZINC000498378469 907867894 /nfs/dbraw/zinc/86/78/94/907867894.db2.gz XRGWCYDMNPKJEU-QFIPXVFZSA-N 0 3 413.949 4.236 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)c2ccc(NC(=O)c3ccccc3)cc2)CC1 ZINC000498455824 907920607 /nfs/dbraw/zinc/92/06/07/907920607.db2.gz XXIOIBBKVROACJ-UHFFFAOYSA-N 0 3 417.509 4.269 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)NCc2ccccc2N2CCCCC2)CC1 ZINC000498458515 907922135 /nfs/dbraw/zinc/92/21/35/907922135.db2.gz VMYSJWZTKGMYSW-UHFFFAOYSA-N 0 3 410.562 4.076 20 0 HIADHN CCN1CCN([C@@H](C)CNC(=O)c2ccccc2-c2ccc(C(F)(F)F)cc2)CC1 ZINC000498527525 907995437 /nfs/dbraw/zinc/99/54/37/907995437.db2.gz QZAQEQFJCNBTHU-KRWDZBQOSA-N 0 3 419.491 4.128 20 0 HIADHN O=C(Nc1ccc(Oc2nncc3ccccc32)cc1)[C@@H]1CCCN1C1CCOCC1 ZINC000498575157 908032260 /nfs/dbraw/zinc/03/22/60/908032260.db2.gz GQIUGVQCIFDPPY-QFIPXVFZSA-N 0 3 418.497 4.004 20 0 HIADHN Cc1ccc2[nH]c3c(c2c1)C[C@@H](NC(=O)N(CCN(C)C)Cc1cccs1)CC3 ZINC000498710108 908137051 /nfs/dbraw/zinc/13/70/51/908137051.db2.gz NRBYUDPBTLTANG-KRWDZBQOSA-N 0 3 410.587 4.169 20 0 HIADHN CC[C@H](NC(=O)N[C@H](CN(C)C)c1ccc(F)cc1)c1nc(C(F)(F)F)cs1 ZINC000498713440 908138126 /nfs/dbraw/zinc/13/81/26/908138126.db2.gz IQYWTFWCXSRMAY-UONOGXRCSA-N 0 3 418.460 4.354 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)NC[C@H]1CCCO[C@@H]1c1ccc(C)cc1 ZINC000498722419 908148001 /nfs/dbraw/zinc/14/80/01/908148001.db2.gz XQXSIPDJPLQMOQ-DHIUTWEWSA-N 0 3 401.595 4.370 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)NC[C@H]1CCCO[C@@H]1c1ccc(C)cc1)c1ccco1 ZINC000498739483 908168517 /nfs/dbraw/zinc/16/85/17/908168517.db2.gz UPBJQCFBIAYSOW-BWKHYTDRSA-N 0 3 413.562 4.484 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)N2CCC(C(F)(F)F)CC2)N(C)C)cc1 ZINC000512901289 921393324 /nfs/dbraw/zinc/39/33/24/921393324.db2.gz IKGGOLKSJJVCHV-GOSISDBHSA-N 0 3 401.473 4.060 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)N2CC[C@H](CC(F)(F)F)C2)N(C)C)cc1 ZINC000512900934 921393472 /nfs/dbraw/zinc/39/34/72/921393472.db2.gz GARLAMPURDUEJE-CRAIPNDOSA-N 0 3 401.473 4.060 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)N2CCCC[C@@H]2c2cccn2C)N(C)C)cc1 ZINC000512902681 921394468 /nfs/dbraw/zinc/39/44/68/921394468.db2.gz QUMQSDGSBNUQKS-PKTZIBPZSA-N 0 3 412.578 4.352 20 0 HIADHN CCCO[C@H]1CCCN(C(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)CC1 ZINC000512903378 921396345 /nfs/dbraw/zinc/39/63/45/921396345.db2.gz YUDPHJJKJHZPKS-RBBKRZOGSA-N 0 3 405.583 4.067 20 0 HIADHN C[C@H](NC(=O)NCc1nccn1CCCc1ccccc1)[C@@H](c1ccccc1)N(C)C ZINC000498891173 908297188 /nfs/dbraw/zinc/29/71/88/908297188.db2.gz MHKAZJCOMAVTDB-RDPSFJRHSA-N 0 3 419.573 4.007 20 0 HIADHN C[C@H](NC(=O)[C@H](C)N1CCC[C@H](c2nc(C3CC3)n[nH]2)C1)c1ccc2c(c1)CCCC2 ZINC000498903823 908313659 /nfs/dbraw/zinc/31/36/59/908313659.db2.gz DCUBRDHHLPCUAT-HOIFWPIMSA-N 0 3 421.589 4.006 20 0 HIADHN C[C@H](NC(=O)[C@H](C)N1CCC[C@H](c2n[nH]c(C3CC3)n2)C1)c1ccc2c(c1)CCCC2 ZINC000498903823 908313665 /nfs/dbraw/zinc/31/36/65/908313665.db2.gz DCUBRDHHLPCUAT-HOIFWPIMSA-N 0 3 421.589 4.006 20 0 HIADHN CCN1C[C@H](C)N(Cc2csc(N(C(C)=O)c3cccc(Cl)c3)n2)C[C@@H]1C ZINC000498928608 908337785 /nfs/dbraw/zinc/33/77/85/908337785.db2.gz ZEKXLRXXKVLPOH-GJZGRUSLSA-N 0 3 406.983 4.396 20 0 HIADHN Clc1ccc(-c2nnc(CN3CCC[C@H](c4nc(C5CC5)n[nH]4)C3)o2)c(Cl)c1 ZINC000498930647 908339357 /nfs/dbraw/zinc/33/93/57/908339357.db2.gz VTVOMJBPWIOJSA-LBPRGKRZSA-N 0 3 419.316 4.419 20 0 HIADHN Clc1ccc(-c2nnc(CN3CCC[C@H](c4n[nH]c(C5CC5)n4)C3)o2)c(Cl)c1 ZINC000498930647 908339366 /nfs/dbraw/zinc/33/93/66/908339366.db2.gz VTVOMJBPWIOJSA-LBPRGKRZSA-N 0 3 419.316 4.419 20 0 HIADHN Cc1cccc([C@@H](NC(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)c2ccccn2)c1 ZINC000499026675 908402623 /nfs/dbraw/zinc/40/26/23/908402623.db2.gz KPJDFBDCXHIZLV-UKILVPOCSA-N 0 3 414.553 4.395 20 0 HIADHN COc1cccc(CN(C)C(=O)CN[C@@H](Cc2ccccc2)c2ccccc2)c1OC ZINC000499049193 908421702 /nfs/dbraw/zinc/42/17/02/908421702.db2.gz WZUYBCUXRLNEQG-QHCPKHFHSA-N 0 3 418.537 4.236 20 0 HIADHN Cc1cccnc1[C@H](NC(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F)C(C)C ZINC000512944576 921430035 /nfs/dbraw/zinc/43/00/35/921430035.db2.gz FHGWWBDGSNOKPT-WOJBJXKFSA-N 0 3 401.501 4.361 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)N[C@H](c1cccc(F)c1)c1ccccn1 ZINC000499310221 908684760 /nfs/dbraw/zinc/68/47/60/908684760.db2.gz VWRREEVZRBKCSJ-HSZRJFAPSA-N 0 3 424.495 4.223 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)NC(=O)N[C@H]2CCN(Cc3ccccc3)[C@H]2C)cc1 ZINC000499318173 908691840 /nfs/dbraw/zinc/69/18/40/908691840.db2.gz TUJKGVWNEUBKCV-JXQFQVJHSA-N 0 3 417.557 4.204 20 0 HIADHN CN(C)C[C@H](NC(=O)NCCc1csc(-c2ccccc2)n1)c1ccc(F)cc1 ZINC000499327013 908701626 /nfs/dbraw/zinc/70/16/26/908701626.db2.gz NRFMIRBUPCIAEI-FQEVSTJZSA-N 0 3 412.534 4.094 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)Cc1csc(-c2ccccc2)n1 ZINC000499364339 908731155 /nfs/dbraw/zinc/73/11/55/908731155.db2.gz QPXWYHQSCDXLJY-UHFFFAOYSA-N 0 3 415.509 4.221 20 0 HIADHN COc1ccc(Br)c(C(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)c1 ZINC000499397703 908760920 /nfs/dbraw/zinc/76/09/20/908760920.db2.gz ODMBAHFZYXFGIE-HXUWFJFHSA-N 0 3 417.347 4.333 20 0 HIADHN Cc1ccc(-c2nc(CNC3CCN(C(=O)c4cc(Cl)c[nH]4)CC3)cs2)cc1 ZINC000512971260 921445928 /nfs/dbraw/zinc/44/59/28/921445928.db2.gz BXVRAEMBLXERJM-UHFFFAOYSA-N 0 3 414.962 4.494 20 0 HIADHN CC[C@@H]1CCCCN1CCNC(=O)c1sc(COc2ccc(F)cc2)nc1C ZINC000499665999 908870403 /nfs/dbraw/zinc/87/04/03/908870403.db2.gz BGNVRDMYMFHEGU-QGZVFWFLSA-N 0 3 405.539 4.164 20 0 HIADHN Cc1nn(-c2ccccc2)c(Oc2ccc(F)cc2)c1CNC[C@@]1(O)CCSC1 ZINC000499676863 908873746 /nfs/dbraw/zinc/87/37/46/908873746.db2.gz FHFLJDZIQQYECY-QFIPXVFZSA-N 0 3 413.518 4.070 20 0 HIADHN CCc1c(C)nn(-c2cccc(C(=O)N3C[C@H](N(C)C)Cc4ccccc43)c2)c1C ZINC000499720317 908889332 /nfs/dbraw/zinc/88/93/32/908889332.db2.gz PMELHPHUXSERID-JOCHJYFZSA-N 0 3 402.542 4.185 20 0 HIADHN O=C(NCc1ccnc(OC2CCCC2)c1)N[C@H](CN1CCCC1)c1ccccc1 ZINC000499739463 908895270 /nfs/dbraw/zinc/89/52/70/908895270.db2.gz APBCCWPWMGPFBR-JOCHJYFZSA-N 0 3 408.546 4.039 20 0 HIADHN O=C(c1cc(Cl)c[nH]1)N1CCC(NCc2csc(-c3ccc(F)cc3)n2)CC1 ZINC000513001751 921468488 /nfs/dbraw/zinc/46/84/88/921468488.db2.gz MUYTUCDYCDEBOD-UHFFFAOYSA-N 0 3 418.925 4.325 20 0 HIADHN Cc1cc(C[C@H](C)NC(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)n(-c2ccccc2)n1 ZINC000499957688 909398367 /nfs/dbraw/zinc/39/83/67/909398367.db2.gz NFOLNICGFPEUIW-WXVUKLJWSA-N 0 3 419.573 4.102 20 0 HIADHN CC(C)c1ccc(OCCC(=O)N(C)C2CCN(CCc3ccccn3)CC2)cc1 ZINC000500026618 909483078 /nfs/dbraw/zinc/48/30/78/909483078.db2.gz QIYPEIGKZFUGPE-UHFFFAOYSA-N 0 3 409.574 4.139 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Cc2coc(-c3ccc(F)cc3)n2)N2CCCC2)cc1 ZINC000500030156 909485923 /nfs/dbraw/zinc/48/59/23/909485923.db2.gz CBPLCZGGEHEFHF-JOCHJYFZSA-N 0 3 407.489 4.285 20 0 HIADHN Cc1noc(C)c1[C@H](C)CNC(=O)NC[C@@H](c1ccc(CC(C)C)cc1)N(C)C ZINC000500101917 909581449 /nfs/dbraw/zinc/58/14/49/909581449.db2.gz JIXWTWWZKMKMJP-IERDGZPVSA-N 0 3 400.567 4.196 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N[C@H](Cn1ccnc1)c1ccc(C)cc1C)c1ccco1 ZINC000500113762 909595668 /nfs/dbraw/zinc/59/56/68/909595668.db2.gz PVFBQWYWYLMJRN-KSEOMHKRSA-N 0 3 423.561 4.263 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)N[C@H]2CCOC3(CCCCC3)C2)N(C)C)cc1 ZINC000500147999 909624522 /nfs/dbraw/zinc/62/45/22/909624522.db2.gz OJYXGTRDNWEGAT-RBBKRZOGSA-N 0 3 417.594 4.258 20 0 HIADHN CCn1cc(Br)cc1C(=O)N1CCCN(CCCc2ccccc2)CC1 ZINC000513069229 921524249 /nfs/dbraw/zinc/52/42/49/921524249.db2.gz KRMXUAJSBIWCRV-UHFFFAOYSA-N 0 3 418.379 4.051 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NCc2c(F)ccc(Br)c2F)CC1 ZINC000500369251 909818230 /nfs/dbraw/zinc/81/82/30/909818230.db2.gz GSXBLYLZIAVUFO-ZDUSSCGKSA-N 0 3 410.306 4.438 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)c2ccc(N3CCCC3)c(F)c2)cc1 ZINC000500408340 909841143 /nfs/dbraw/zinc/84/11/43/909841143.db2.gz MXNVWOAASJDPPB-QFIPXVFZSA-N 0 3 411.521 4.001 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)c2cnc(-c3ccccc3)nc2C)cc1 ZINC000500410377 909842449 /nfs/dbraw/zinc/84/24/49/909842449.db2.gz OPNJGIVEJJEMEY-HSZRJFAPSA-N 0 3 416.525 4.028 20 0 HIADHN CCC[C@H](NCCC(=O)N(C)Cc1ccccc1Br)c1ccccn1 ZINC000500615669 909966736 /nfs/dbraw/zinc/96/67/36/909966736.db2.gz IDROJEYSBDZHFI-SFHVURJKSA-N 0 3 404.352 4.324 20 0 HIADHN Cc1ccccc1[C@@H]([C@@H](C)NC(=O)C(=O)Nc1cc(C(F)F)ccc1Cl)N(C)C ZINC000500626208 909975972 /nfs/dbraw/zinc/97/59/72/909975972.db2.gz SAROIDBSFVJGNA-FZKQIMNGSA-N 0 3 423.891 4.332 20 0 HIADHN CCN1CCN(Cc2ccc(CNC(=O)N[C@@H](C)c3ccc(Cl)cc3)cc2)CC1 ZINC000500684510 910019576 /nfs/dbraw/zinc/01/95/76/910019576.db2.gz IJOBHEBXDUTFNY-SFHVURJKSA-N 0 3 414.981 4.038 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)NCc2csc3ccccc23)CC1 ZINC000500687422 910022542 /nfs/dbraw/zinc/02/25/42/910022542.db2.gz XXLCRKDGUIUHJH-UHFFFAOYSA-N 0 3 422.598 4.038 20 0 HIADHN C[S@](=O)Cc1ccc(CNCc2ccc(Br)c3cccnc23)cc1 ZINC000513096940 921545902 /nfs/dbraw/zinc/54/59/02/921545902.db2.gz XVTBXWXXGKMKAQ-DEOSSOPVSA-N 0 3 403.345 4.166 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)COc1cc(Cl)c(Cl)cc1Cl ZINC000500784775 910076842 /nfs/dbraw/zinc/07/68/42/910076842.db2.gz DKETZJSWOIBISW-UHFFFAOYSA-N 0 3 416.736 4.011 20 0 HIADHN COc1cc(C(C)=O)ccc1OCCCC(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000500835078 910113019 /nfs/dbraw/zinc/11/30/19/910113019.db2.gz CHZWCQOWOSFWCQ-AVRDEDQJSA-N 0 3 424.541 4.009 20 0 HIADHN COc1cc(C(C)=O)ccc1OCCCC(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000500835080 910113167 /nfs/dbraw/zinc/11/31/67/910113167.db2.gz CHZWCQOWOSFWCQ-PGRDOPGGSA-N 0 3 424.541 4.009 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)c2cc(C3CC3)nn2-c2ccccc2)C1 ZINC000500845670 910120317 /nfs/dbraw/zinc/12/03/17/910120317.db2.gz XDUJSLJZVWGZIA-NQIIRXRSSA-N 0 3 400.526 4.315 20 0 HIADHN CC1(C)CN(Cc2ccccc2)CC[C@H]1NC(=O)CCC(=O)c1ccc(F)cc1F ZINC000513104730 921552500 /nfs/dbraw/zinc/55/25/00/921552500.db2.gz MJIZLRYXNFXUEC-JOCHJYFZSA-N 0 3 414.496 4.345 20 0 HIADHN O=C(NC[C@@H]1CCCN(Cc2ccc(OCc3cccnc3)cc2)C1)c1ccccc1 ZINC000513105681 921552860 /nfs/dbraw/zinc/55/28/60/921552860.db2.gz AAXPARWMJDDYKQ-QFIPXVFZSA-N 0 3 415.537 4.303 20 0 HIADHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)CCCc1cccs1 ZINC000500960348 910208537 /nfs/dbraw/zinc/20/85/37/910208537.db2.gz QBOFDYIERGAPCF-UHFFFAOYSA-N 0 3 409.393 4.424 20 0 HIADHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)CSc1ccccc1 ZINC000500989783 910219887 /nfs/dbraw/zinc/21/98/87/910219887.db2.gz SDWXHFOMAWRGOG-UHFFFAOYSA-N 0 3 407.377 4.132 20 0 HIADHN COc1ccc([C@@H](CNC(=O)NCCc2ccc(F)cc2Cl)N2CCCC2)cc1 ZINC000501020458 910238612 /nfs/dbraw/zinc/23/86/12/910238612.db2.gz CGDQFKAFSBFFMI-OAQYLSRUSA-N 0 3 419.928 4.167 20 0 HIADHN Cc1cc2cc(CNCc3ccc(Br)cc3N3CCOCC3)ccc2[nH]1 ZINC000513116754 921563064 /nfs/dbraw/zinc/56/30/64/921563064.db2.gz KRWGMVWTUWOFQE-UHFFFAOYSA-N 0 3 414.347 4.365 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CN1CCC2(C[C@@H]2C(=O)N2CCCCC2)CC1 ZINC000501130463 910311316 /nfs/dbraw/zinc/31/13/16/910311316.db2.gz JCRATODSZCQOAN-XMMPIXPASA-N 0 3 420.601 4.163 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCc1ccc(Br)s1)c1ccsc1 ZINC000501172678 910341782 /nfs/dbraw/zinc/34/17/82/910341782.db2.gz ILLFTNFFDQVRGU-CQSZACIVSA-N 0 3 416.410 4.454 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CN1CCC(C(=O)Nc2ccc(F)cc2)CC1 ZINC000513128437 921571724 /nfs/dbraw/zinc/57/17/24/921571724.db2.gz QOJMDZRIGVJGHH-UHFFFAOYSA-N 0 3 406.505 4.479 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)C2(c3cccc(Br)c3)CC2)C1 ZINC000501228371 910388514 /nfs/dbraw/zinc/38/85/14/910388514.db2.gz PRFXPSYMHVQRBZ-OXJNMPFZSA-N 0 3 413.359 4.432 20 0 HIADHN Cc1cc(N(C)C)cc(C)c1NC(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000501253785 910414066 /nfs/dbraw/zinc/41/40/66/910414066.db2.gz NJJUKOSJPBYHSV-WOJBJXKFSA-N 0 3 416.610 4.113 20 0 HIADHN Cc1ccc2nc(-c3ccc(NC(=O)CN[C@@H](C)Cn4cccn4)cc3)sc2c1 ZINC000501262431 910422630 /nfs/dbraw/zinc/42/26/30/910422630.db2.gz LJDBJFSLCQVPQF-INIZCTEOSA-N 0 3 405.527 4.085 20 0 HIADHN O=C(NCc1ccc(F)cc1)C1CCN(CCOc2ccc(C(F)(F)F)cc2)CC1 ZINC000501321673 910469726 /nfs/dbraw/zinc/46/97/26/910469726.db2.gz GBGLYEKUEZBBHY-UHFFFAOYSA-N 0 3 424.438 4.252 20 0 HIADHN CC(=O)c1cccc(O[C@H](C)C(=O)NC[C@H](c2ccccc2)N2CCC(C)CC2)c1 ZINC000501341968 910479584 /nfs/dbraw/zinc/47/95/84/910479584.db2.gz FZBQKMKLCFCDSS-HYBUGGRVSA-N 0 3 408.542 4.246 20 0 HIADHN CC[C@@H](CNC(=O)N1CC=C(c2ccc(O)cc2)CC1)N1CCc2ccccc2C1 ZINC000501359168 910491654 /nfs/dbraw/zinc/49/16/54/910491654.db2.gz LVVZYEVBCRRZQH-QHCPKHFHSA-N 0 3 405.542 4.028 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3ccc(-c4ncco4)cc3)CC2)C[C@H](C)O1 ZINC000501397696 910525874 /nfs/dbraw/zinc/52/58/74/910525874.db2.gz KEYRGWXLTLXVOA-HDICACEKSA-N 0 3 412.534 4.085 20 0 HIADHN Cc1noc2nc(C(C)C)cc(C(=O)Nc3ccc(CCN4CCSCC4)cc3)c12 ZINC000501409986 910541990 /nfs/dbraw/zinc/54/19/90/910541990.db2.gz KZYMIRMQIOSSKB-UHFFFAOYSA-N 0 3 424.570 4.498 20 0 HIADHN Cc1ccn(-c2ccc(C(=O)Nc3ccc(CCN4CCSCC4)cc3)cc2)n1 ZINC000501416237 910547291 /nfs/dbraw/zinc/54/72/91/910547291.db2.gz IAWSPTXTHDCQGY-UHFFFAOYSA-N 0 3 406.555 4.024 20 0 HIADHN COC(=O)c1cc2cc(CN(C)[C@@H](CO)c3cccc(Br)c3)ccc2o1 ZINC000501415450 910547984 /nfs/dbraw/zinc/54/79/84/910547984.db2.gz DTXDSAHHXIGLMR-KRWDZBQOSA-N 0 3 418.287 4.147 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)N[C@@H]2CCCOc3cc(Cl)ccc32)cc1 ZINC000501555161 910658679 /nfs/dbraw/zinc/65/86/79/910658679.db2.gz NNOYDCFZFHESJH-UXHICEINSA-N 0 3 417.937 4.164 20 0 HIADHN CCCn1nccc1C1CCN(C[C@@H](O)COc2c(Cl)cccc2Cl)CC1 ZINC000501560228 910668115 /nfs/dbraw/zinc/66/81/15/910668115.db2.gz DQDCHJRBKPVLOV-MRXNPFEDSA-N 0 3 412.361 4.219 20 0 HIADHN O=C(CN[C@]1(Cc2ccc(C(F)(F)F)cc2)CCOC1)Nc1ccccc1Cl ZINC000513174664 921600656 /nfs/dbraw/zinc/60/06/56/921600656.db2.gz XIHPKEPFRFBDOC-IBGZPJMESA-N 0 3 412.839 4.289 20 0 HIADHN Cn1ccnc1SCc1cccc(C(=O)NC[C@H](c2ccccc2)N2CCCC2)c1 ZINC000501692255 910762638 /nfs/dbraw/zinc/76/26/38/910762638.db2.gz VHQHAPTXJJAAMS-JOCHJYFZSA-N 0 3 420.582 4.279 20 0 HIADHN CC[C@@H](CC(=O)N(C)C1CCN(CCc2ccccn2)CC1)c1ccc(OC)cc1 ZINC000501733510 910795830 /nfs/dbraw/zinc/79/58/30/910795830.db2.gz JHQJRNGEFQEEGD-FQEVSTJZSA-N 0 3 409.574 4.139 20 0 HIADHN CC(=O)Nc1c[nH]nc1[C@@H]1CCCN(Cc2cn(-c3ccccc3)nc2C(C)(C)C)C1 ZINC000501746422 910806354 /nfs/dbraw/zinc/80/63/54/910806354.db2.gz XYVLGSIKMBNBCX-GOSISDBHSA-N 0 3 420.561 4.231 20 0 HIADHN C[C@@H](NC(=O)NCCCN1CCc2ccccc2C1)c1ccc(OC(F)F)cc1 ZINC000501758732 910815857 /nfs/dbraw/zinc/81/58/57/910815857.db2.gz ZHRFNGGWDZNTMN-MRXNPFEDSA-N 0 3 403.473 4.097 20 0 HIADHN CC(=O)c1cccc(O[C@@H](C)C(=O)N[C@@H](CN2CCc3ccccc3C2)C(C)(C)C)c1 ZINC000501763546 910818840 /nfs/dbraw/zinc/81/88/40/910818840.db2.gz CDKKRZARCVCIMN-CYFREDJKSA-N 0 3 422.569 4.246 20 0 HIADHN CC(=O)Nc1c[nH]nc1[C@@H]1CCCN(C[C@@H](C)c2cccc(Br)c2)C1 ZINC000501768071 910823409 /nfs/dbraw/zinc/82/34/09/910823409.db2.gz HDDMZIOSMITUDI-CZUORRHYSA-N 0 3 405.340 4.114 20 0 HIADHN C[C@H]1CN(Cc2nc3c4ccccc4oc3c(=O)[nH]2)[C@@H](C)CN1Cc1ccccc1 ZINC000501784582 910839164 /nfs/dbraw/zinc/83/91/64/910839164.db2.gz HUJGTSJXBYZWSR-IRXDYDNUSA-N 0 3 402.498 4.176 20 0 HIADHN O=C(NCCc1ccc(Br)s1)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000501801787 910851964 /nfs/dbraw/zinc/85/19/64/910851964.db2.gz GLOFHMJXDLMCGN-KRWDZBQOSA-N 0 3 422.392 4.189 20 0 HIADHN Cc1cc(C)c(NC(=O)CN(C)C(=O)N[C@H](CN2CCCC2)c2ccccc2)c(C)c1 ZINC000501809504 910859433 /nfs/dbraw/zinc/85/94/33/910859433.db2.gz JRPCDQWRQBYWBB-JOCHJYFZSA-N 0 3 422.573 4.029 20 0 HIADHN CCOc1ccc([C@@H](C)NC(=O)N[C@H](CN2CCCC2)c2ccccc2)cc1OC ZINC000501852193 910884702 /nfs/dbraw/zinc/88/47/02/910884702.db2.gz UPVJQKHHJRQTKP-WIYYLYMNSA-N 0 3 411.546 4.291 20 0 HIADHN O=C(Cc1csc(-c2cccc(F)c2)n1)N1CCN(CC2CCCCC2)CC1 ZINC000501869779 910896242 /nfs/dbraw/zinc/89/62/42/910896242.db2.gz ZRYLIXICUBECEZ-UHFFFAOYSA-N 0 3 401.551 4.216 20 0 HIADHN C[C@@H](CC(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1)c1ccc(F)cc1F ZINC000501876380 910899243 /nfs/dbraw/zinc/89/92/43/910899243.db2.gz ZGTRMQMYWZWFNX-RCCFBDPRSA-N 0 3 408.533 4.196 20 0 HIADHN CCN(C(=O)CN[C@]1(Cc2ccc(C(F)(F)F)cc2)CCOC1)c1ccccc1 ZINC000513197739 921616085 /nfs/dbraw/zinc/61/60/85/921616085.db2.gz YEHHGMGCRUIQSW-NRFANRHFSA-N 0 3 406.448 4.050 20 0 HIADHN CCN(C(=O)c1cccc(N2CCCC2=O)c1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000501947358 910934566 /nfs/dbraw/zinc/93/45/66/910934566.db2.gz NYZZDESBUGYMPX-AUSIDOKSSA-N 0 3 405.542 4.111 20 0 HIADHN C[C@@H]1[C@H](NC(=O)N[C@H]2CCO[C@H](c3ccc(F)cc3)C2)CCN1Cc1ccccc1 ZINC000501949094 910936259 /nfs/dbraw/zinc/93/62/59/910936259.db2.gz NHZMAGHNNDVAGZ-WIQPIVSASA-N 0 3 411.521 4.008 20 0 HIADHN CCN(C(=O)c1ccc2c(c1)NC(=O)CS2)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000501953992 910940930 /nfs/dbraw/zinc/94/09/30/910940930.db2.gz CUKUVQCTWBOEJW-LPHOPBHVSA-N 0 3 409.555 4.028 20 0 HIADHN CCN(C(=O)c1cnc2c(cnn2C(C)C)c1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000501953167 910941861 /nfs/dbraw/zinc/94/18/61/910941861.db2.gz ZBNUFBRPOYMNEI-XMSQKQJNSA-N 0 3 405.546 4.310 20 0 HIADHN C[C@@H](NC[C@H]1CN(C(=O)c2ccccc2)[C@H]2CCN1C2)c1cc(Cl)ccc1Cl ZINC000502038249 910991688 /nfs/dbraw/zinc/99/16/88/910991688.db2.gz VKLMXLRFKMHTSX-MNEFBYGVSA-N 0 3 418.368 4.243 20 0 HIADHN C[C@H](NC[C@@H]1CN(C(=O)c2ccccc2)[C@H]2CCN1C2)c1cccc(Cl)c1Cl ZINC000502038357 910991808 /nfs/dbraw/zinc/99/18/08/910991808.db2.gz WWAVRKOCKXKQEI-RYQLBKOJSA-N 0 3 418.368 4.243 20 0 HIADHN C[C@@H](NC[C@@H]1CN(C(=O)c2ccccc2)[C@H]2CCN1C2)c1ccc(-c2ccccc2)o1 ZINC000502063700 911009282 /nfs/dbraw/zinc/00/92/82/911009282.db2.gz ZEWRSKMERVJNAL-WTIAFYNJSA-N 0 3 415.537 4.196 20 0 HIADHN Cc1ccc(C)c(NC(=O)CN[C@@]2(Cc3ccc(C(F)(F)F)cc3)CCOC2)c1 ZINC000513210149 921626577 /nfs/dbraw/zinc/62/65/77/921626577.db2.gz NOSNBFJIFIUHIS-OAQYLSRUSA-N 0 3 406.448 4.252 20 0 HIADHN Cc1cccc(C)c1NC(=O)CN[C@@]1(Cc2ccc(C(F)(F)F)cc2)CCOC1 ZINC000513211598 921628178 /nfs/dbraw/zinc/62/81/78/921628178.db2.gz YNYCCDQUGMULTR-OAQYLSRUSA-N 0 3 406.448 4.252 20 0 HIADHN C[C@@H](NCC(=O)N(Cc1ccc(C(F)(F)F)cc1)C1CC1)c1ccc2n[nH]cc2c1 ZINC000513221228 921635302 /nfs/dbraw/zinc/63/53/02/921635302.db2.gz AOYDIFWWFKZDES-CQSZACIVSA-N 0 3 416.447 4.424 20 0 HIADHN C[C@H](NCC(=O)N(Cc1ccc(C(F)(F)F)cc1)C1CC1)c1ccc2n[nH]cc2c1 ZINC000513221226 921635369 /nfs/dbraw/zinc/63/53/69/921635369.db2.gz AOYDIFWWFKZDES-AWEZNQCLSA-N 0 3 416.447 4.424 20 0 HIADHN C[C@@H](NC(=O)N(Cc1ccco1)C1CCN(C)CC1)c1cccc(OC(F)F)c1 ZINC000502217905 911161093 /nfs/dbraw/zinc/16/10/93/911161093.db2.gz WWJLOMVGBHAFLV-OAHLLOKOSA-N 0 3 407.461 4.248 20 0 HIADHN C[C@@H](NC(=O)NC[C@@H](c1ccccc1)N1CCCC1)c1cccc(OC(F)F)c1 ZINC000502225691 911173638 /nfs/dbraw/zinc/17/36/38/911173638.db2.gz KNMFRLJOXNPYBM-UZLBHIALSA-N 0 3 403.473 4.485 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)N[C@@H](C)c2cc(OC)c(OC)cc2C)N(C)C)cc1 ZINC000502270590 911217708 /nfs/dbraw/zinc/21/77/08/911217708.db2.gz RIDBWLNRRGKRGX-LAUBAEHRSA-N 0 3 413.562 4.238 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)c2cc(NC(=O)N(C)C)ccc2Cl)N(C)C)cc1 ZINC000502288826 911245223 /nfs/dbraw/zinc/24/52/23/911245223.db2.gz QYXAHBOXBPTIOG-HXUWFJFHSA-N 0 3 416.953 4.029 20 0 HIADHN O=C(NC[C@H]1CCCN1Cc1ccccc1)c1ccccc1OCc1cscn1 ZINC000513234626 921647178 /nfs/dbraw/zinc/64/71/78/921647178.db2.gz ZRIDYYLNNWQELT-HXUWFJFHSA-N 0 3 407.539 4.117 20 0 HIADHN C[C@H](CC(=O)Nc1ccc(F)cc1)N[C@H]1CCOc2c(Br)cccc21 ZINC000502322042 911298454 /nfs/dbraw/zinc/29/84/54/911298454.db2.gz PHSMQNVMLCVKBK-PXAZEXFGSA-N 0 3 407.283 4.419 20 0 HIADHN Cc1c(Cl)cccc1NC(=O)NCCCN1CCN(C)C[C@@H]1c1ccccc1 ZINC000502363764 911348152 /nfs/dbraw/zinc/34/81/52/911348152.db2.gz HCOAYNKNOXPIRG-OAQYLSRUSA-N 0 3 400.954 4.149 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)c1cc(F)cc(Br)c1 ZINC000502374243 911359919 /nfs/dbraw/zinc/35/99/19/911359919.db2.gz LXGWAVLYXXSFDJ-UHFFFAOYSA-N 0 3 407.327 4.225 20 0 HIADHN CC(C)(COc1ncccc1C(F)(F)F)NCc1cncc(Br)c1 ZINC000502383802 911370582 /nfs/dbraw/zinc/37/05/82/911370582.db2.gz CWKAPJKFDOLDAW-UHFFFAOYSA-N 0 3 404.230 4.205 20 0 HIADHN Cc1nn(C)c(C)c1C(=O)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000513250849 921657200 /nfs/dbraw/zinc/65/72/00/921657200.db2.gz MAWOARSWBVTLTB-UHFFFAOYSA-N 0 3 409.361 4.082 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CNC(=O)CN[C@H](c1ccc(F)cc1)C(C)C ZINC000502534228 911539629 /nfs/dbraw/zinc/53/96/29/911539629.db2.gz AKKVRHYAPFLFSI-DEOSSOPVSA-N 0 3 408.521 4.231 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cn(C)nc1C(C)C)c1ccc(C(F)(F)F)cc1 ZINC000502545554 911551397 /nfs/dbraw/zinc/55/13/97/911551397.db2.gz WJEBVDHTQYWMMY-GOSISDBHSA-N 0 3 410.484 4.375 20 0 HIADHN CCc1ccccc1NC(=O)CN(C)C(=O)[C@@H](C)N[C@@H](c1ccc(F)cc1)C(C)C ZINC000502552432 911560279 /nfs/dbraw/zinc/56/02/79/911560279.db2.gz PRANIAIRZQJJMV-UZUQRXQVSA-N 0 3 413.537 4.160 20 0 HIADHN COc1cc(C)c([C@@H](C)NC(=O)CN[C@H](c2ccc(F)cc2)C(C)C)cc1OC ZINC000502578454 911584666 /nfs/dbraw/zinc/58/46/66/911584666.db2.gz JONYGGFNPCFIGT-MWTRTKDXSA-N 0 3 402.510 4.315 20 0 HIADHN CC(C)S(=O)(=O)c1ccc(CN[C@@]2(Cc3ccc(Cl)cc3)CCOC2)cc1 ZINC000502600309 911606270 /nfs/dbraw/zinc/60/62/70/911606270.db2.gz MWNUJDKITYWQCN-OAQYLSRUSA-N 0 3 407.963 4.014 20 0 HIADHN CC1CCN([C@@H](CNC(=O)[C@H](c2ccccc2)n2cccn2)c2cccs2)CC1 ZINC000513286273 921684569 /nfs/dbraw/zinc/68/45/69/921684569.db2.gz DCKGEBQMPAFCMT-UNMCSNQZSA-N 0 3 408.571 4.123 20 0 HIADHN COc1ccc(NC(=O)[C@H](N[C@H](C)[C@@H]2CCCOC2)c2ccccc2)cc1Cl ZINC000502668490 911710944 /nfs/dbraw/zinc/71/09/44/911710944.db2.gz ZRLVNKKHZRAYQH-QLVMHMETSA-N 0 3 402.922 4.433 20 0 HIADHN O=C(NC[C@H]1CCCN1Cc1ccccc1)C1(c2ccc(Br)cc2)CC1 ZINC000513289386 921687777 /nfs/dbraw/zinc/68/77/77/921687777.db2.gz NSRSDGOHNOWXDN-HXUWFJFHSA-N 0 3 413.359 4.262 20 0 HIADHN CN(C)Cc1cccc(NC(=O)N2CCN(c3ccc(C(F)(F)F)cc3)CC2)c1 ZINC000502823099 911838069 /nfs/dbraw/zinc/83/80/69/911838069.db2.gz FBTJJIPTCRWATF-UHFFFAOYSA-N 0 3 406.452 4.121 20 0 HIADHN COc1ccc(C(=O)CCCC(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)cc1 ZINC000502866648 911872465 /nfs/dbraw/zinc/87/24/65/911872465.db2.gz DYHWKOMYKPHLBH-UHFFFAOYSA-N 0 3 423.557 4.217 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)N[C@H](c2ccccc2)c2ccncc2)N(C)C)cc1 ZINC000503024789 911995320 /nfs/dbraw/zinc/99/53/20/911995320.db2.gz OHJOFTFYPMPCPS-DNQXCXABSA-N 0 3 402.542 4.336 20 0 HIADHN CCOC(=O)c1c(C)c(C)sc1NC(=O)N(C)CCCN(C)Cc1ccco1 ZINC000513320100 921711322 /nfs/dbraw/zinc/71/13/22/921711322.db2.gz JQYSKENLNBYHGO-UHFFFAOYSA-N 0 3 407.536 4.120 20 0 HIADHN C[C@@H]1CCN(Cc2ccnc(-c3ccc(Br)cc3)n2)C[C@H]1n1ccnc1 ZINC000503076583 912048427 /nfs/dbraw/zinc/04/84/27/912048427.db2.gz YPGGPGDTNYBXPM-DNVCBOLYSA-N 0 3 412.335 4.186 20 0 HIADHN O[C@H](Cc1ccc(C(F)(F)F)cc1)CN1CCC[C@H]1c1nnc(-c2ccccc2)[nH]1 ZINC000503168076 912140341 /nfs/dbraw/zinc/14/03/41/912140341.db2.gz BLUXUXLBMSLOLD-MOPGFXCFSA-N 0 3 416.447 4.231 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)N(C)[C@H]3CCCC[C@H]3C)CC2)c1 ZINC000503217114 912199765 /nfs/dbraw/zinc/19/97/65/912199765.db2.gz NUJBYICKRZKFGF-GGAORHGYSA-N 0 3 400.611 4.117 20 0 HIADHN COc1cc(CN2CCC(OC)CC2)ccc1OCCOc1ccccc1Cl ZINC000506282251 914882089 /nfs/dbraw/zinc/88/20/89/914882089.db2.gz UZAVKBGVWAXNEE-UHFFFAOYSA-N 0 3 405.922 4.417 20 0 HIADHN CCN(CC)C(=O)c1ccc(NC(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)cc1 ZINC000506294338 914889765 /nfs/dbraw/zinc/88/97/65/914889765.db2.gz IVZLFEATRYMNFN-GCJKJVERSA-N 0 3 408.546 4.126 20 0 HIADHN COC(=O)c1cc2cc(NC(=O)N[C@H]3CCN([C@H](C)c4ccccc4)C3)ccc2o1 ZINC000506294892 914890026 /nfs/dbraw/zinc/89/00/26/914890026.db2.gz MYNSARXJYSSWGI-BEFAXECRSA-N 0 3 407.470 4.176 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)Nc2cccc(OC[C@@H]3CCCO3)c2)C1 ZINC000506295302 914890355 /nfs/dbraw/zinc/89/03/55/914890355.db2.gz PQNNMPCZDZPBKZ-AAIMPIBUSA-N 0 3 409.530 4.201 20 0 HIADHN CNC(=O)C1CCN(Cc2cn(-c3ccccc3)nc2-c2cc3ccccc3o2)CC1 ZINC000506311590 914899845 /nfs/dbraw/zinc/89/98/45/914899845.db2.gz XCQUAHKISJNZKK-UHFFFAOYSA-N 0 3 414.509 4.244 20 0 HIADHN Cc1cc(C)n(-c2ccccc2NC(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)n1 ZINC000506312960 914903040 /nfs/dbraw/zinc/90/30/40/914903040.db2.gz RTZDDBNPUTXYSU-TZIWHRDSSA-N 0 3 403.530 4.446 20 0 HIADHN CCOc1cc(CN(C)[C@@H](C)c2ccc(OC)cc2)ccc1O[C@H](C)C(=O)N(C)C ZINC000506326674 914934336 /nfs/dbraw/zinc/93/43/36/914934336.db2.gz QEHAEIRHBYSJEA-ZWKOTPCHSA-N 0 3 414.546 4.142 20 0 HIADHN Cc1cc(NC(=O)c2ccc3c(c2)CCCC3=O)cc(N2CCN(C(C)C)CC2)c1 ZINC000506337842 914954307 /nfs/dbraw/zinc/95/43/07/914954307.db2.gz DFGGYXOSZHRVLA-UHFFFAOYSA-N 0 3 405.542 4.297 20 0 HIADHN COc1ccc(OCc2nc(CN(C)[C@H]3CCN(Cc4ccccc4)C3)cs2)cc1 ZINC000506407480 915021151 /nfs/dbraw/zinc/02/11/51/915021151.db2.gz ZLWNAVCJXRQPQO-NRFANRHFSA-N 0 3 423.582 4.437 20 0 HIADHN CN(C)C(=O)CC1CCN(Cc2cn(Cc3ccccc3)nc2-c2ccccc2)CC1 ZINC000513373758 921748076 /nfs/dbraw/zinc/74/80/76/921748076.db2.gz SNMBWRBXZVYNSK-UHFFFAOYSA-N 0 3 416.569 4.289 20 0 HIADHN COc1ccc(Br)c(NC(=O)N(CCN(C)C)Cc2ccccc2)c1 ZINC000506527267 915167967 /nfs/dbraw/zinc/16/79/67/915167967.db2.gz AVWTYIYMWRVCCT-UHFFFAOYSA-N 0 3 406.324 4.053 20 0 HIADHN O=C(Nc1ccnc(Sc2ccccn2)c1)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000506531505 915174953 /nfs/dbraw/zinc/17/49/53/915174953.db2.gz GKQFGARJIIDZIC-LJQANCHMSA-N 0 3 405.527 4.024 20 0 HIADHN CCCN(C(=O)NCCc1c[nH]c2ncccc12)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000506540841 915184686 /nfs/dbraw/zinc/18/46/86/915184686.db2.gz KSSYRNWPHHQRQE-JOCHJYFZSA-N 0 3 419.573 4.192 20 0 HIADHN COc1c(Br)cc(Br)cc1CN(C[C@H]1CCOC1)C1CC1 ZINC000506581207 915230552 /nfs/dbraw/zinc/23/05/52/915230552.db2.gz XRXXVNMHPDHIEM-LLVKDONJSA-N 0 3 419.157 4.221 20 0 HIADHN CCCNC(=O)C1CCN(Cc2ccc(-c3cccc(Br)c3)o2)CC1 ZINC000506646187 915314565 /nfs/dbraw/zinc/31/45/65/915314565.db2.gz AZIBHYKFHZGQGT-UHFFFAOYSA-N 0 3 405.336 4.447 20 0 HIADHN Cn1cc(CN2CCC[C@H](c3nnc4n3CCCCC4)C2)c(-c2ccccc2Cl)n1 ZINC000506652271 915323299 /nfs/dbraw/zinc/32/32/99/915323299.db2.gz DVXAPDVENPVNNN-KRWDZBQOSA-N 0 3 424.980 4.438 20 0 HIADHN CC[C@H](N[C@@H]1CCCN(Cc2ccc(F)cc2F)C1=O)c1ccc(OC)c(OC)c1 ZINC000506661031 915334752 /nfs/dbraw/zinc/33/47/52/915334752.db2.gz FDYUQEYFHIJIIV-VQTJNVASSA-N 0 3 418.484 4.214 20 0 HIADHN CCCOc1ccc(CN2CCC(C(=O)NCc3ccccc3)CC2)cc1OCC ZINC000506711559 915389395 /nfs/dbraw/zinc/38/93/95/915389395.db2.gz RCDOWMYWMLQFSN-UHFFFAOYSA-N 0 3 410.558 4.403 20 0 HIADHN O=C(Nc1ccc2c(c1)OCO2)C1CCN(Cc2cccc(OC(F)(F)F)c2)CC1 ZINC000506744033 915432160 /nfs/dbraw/zinc/43/21/60/915432160.db2.gz PKWHVCXRNUWXLO-UHFFFAOYSA-N 0 3 422.403 4.165 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)cc1CN1CCC(c2nnc3ccccn32)CC1 ZINC000506745622 915436395 /nfs/dbraw/zinc/43/63/95/915436395.db2.gz YWYHWISZIDEBTM-UHFFFAOYSA-N 0 3 406.921 4.256 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N[C@H](c3ccc(C)cc3)c3ccccn3)cc2)CC1 ZINC000506892587 915687874 /nfs/dbraw/zinc/68/78/74/915687874.db2.gz HHJWSXZSERRNER-RUZDIDTESA-N 0 3 414.553 4.051 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CN1CCC(C(=O)NCc2ccc(F)cc2)CC1 ZINC000507019576 915826719 /nfs/dbraw/zinc/82/67/19/915826719.db2.gz DJUSCMWJNLYVLG-UHFFFAOYSA-N 0 3 420.532 4.157 20 0 HIADHN CCCCNC(=O)C1CCN(Cc2c(C)nn(Cc3ccccc3Cl)c2C)CC1 ZINC000507024063 915827739 /nfs/dbraw/zinc/82/77/39/915827739.db2.gz YYIKRXWVCVASGG-UHFFFAOYSA-N 0 3 416.997 4.330 20 0 HIADHN CC(C)(C)[C@@H](NCC(=O)NCCc1cnn(-c2ccccc2)c1)c1ccc(F)cc1 ZINC000507041781 915836568 /nfs/dbraw/zinc/83/65/68/915836568.db2.gz VRGCLUMULKQRSO-QHCPKHFHSA-N 0 3 408.521 4.047 20 0 HIADHN CCCn1nccc1C1CCN(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)CC1 ZINC000507055090 915844680 /nfs/dbraw/zinc/84/46/80/915844680.db2.gz FZKFZQMGBSMSGM-QHCPKHFHSA-N 0 3 409.578 4.019 20 0 HIADHN COc1ccc([C@H]2C[C@H](NC(=O)NC[C@H](c3cccs3)N3CCCC3)C2)cc1F ZINC000507073847 915853910 /nfs/dbraw/zinc/85/39/10/915853910.db2.gz OROJVXDQTUKSNK-ZHALLVOQSA-N 0 3 417.550 4.278 20 0 HIADHN CCCn1nccc1C1CCN(C(=O)NC[C@H](c2ccsc2)N(CC)CC)CC1 ZINC000507098523 915868635 /nfs/dbraw/zinc/86/86/35/915868635.db2.gz WYSXQLDYIUZMRE-OAQYLSRUSA-N 0 3 417.623 4.327 20 0 HIADHN O=C(c1cc(F)cc(Br)c1)N1CCCN(CCCc2ccccc2)CC1 ZINC000507136388 915884059 /nfs/dbraw/zinc/88/40/59/915884059.db2.gz RAFZKJRGVOONJP-UHFFFAOYSA-N 0 3 419.338 4.369 20 0 HIADHN Cc1cccc(-c2n[nH]cc2CN2CCC(C(=O)NCc3ccc(C)c(F)c3)CC2)c1 ZINC000507142427 915887165 /nfs/dbraw/zinc/88/71/65/915887165.db2.gz IYEWAXDKCKMKLB-UHFFFAOYSA-N 0 3 420.532 4.361 20 0 HIADHN Cc1ccc(-c2cc(C(=O)N3CCCN(CCCc4ccccc4)CC3)on2)cc1 ZINC000507158569 915896797 /nfs/dbraw/zinc/89/67/97/915896797.db2.gz RUQIIRYTJSUDDQ-UHFFFAOYSA-N 0 3 403.526 4.431 20 0 HIADHN CN(C)Cc1cccc(NC(=O)N2CCO[C@@H](c3ccccc3C(F)(F)F)C2)c1 ZINC000513439879 921807935 /nfs/dbraw/zinc/80/79/35/921807935.db2.gz XHBRTBXLWCZSGU-LJQANCHMSA-N 0 3 407.436 4.372 20 0 HIADHN Cc1ccc(NC(=O)[C@H](C)N[C@H](C)c2ccc3n[nH]cc3c2)c(Br)c1 ZINC000507221276 915974477 /nfs/dbraw/zinc/97/44/77/915974477.db2.gz HSHGDSAFGCMGDZ-OLZOCXBDSA-N 0 3 401.308 4.312 20 0 HIADHN C/C=C\c1ccc(OC[C@H](O)CN2CCC(Nc3ccc(F)cc3)CC2)c(OC)c1 ZINC000507220390 915974768 /nfs/dbraw/zinc/97/47/68/915974768.db2.gz WHTASVLFJNVGPC-LJBSOROUSA-N 0 3 414.521 4.184 20 0 HIADHN CN(CCC(=O)Nc1ccccc1Br)C[C@H]1OCCc2ccccc21 ZINC000507262710 916025847 /nfs/dbraw/zinc/02/58/47/916025847.db2.gz YFOSKKAZFXIQPK-LJQANCHMSA-N 0 3 403.320 4.024 20 0 HIADHN COc1ccc2cc(CN(C)C(=O)[C@H](C)N[C@@H](C)c3ccc4n[nH]cc4c3)ccc2c1 ZINC000507268317 916030687 /nfs/dbraw/zinc/03/06/87/916030687.db2.gz QGSFWDRTHFXOOI-IRXDYDNUSA-N 0 3 416.525 4.422 20 0 HIADHN O=C(N[C@@H](c1nccs1)c1ccccc1)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000507322031 916083447 /nfs/dbraw/zinc/08/34/47/916083447.db2.gz ZBPOLQFLXJUVOW-LEWJYISDSA-N 0 3 406.555 4.196 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N[C@@H](c2nccs2)c2ccccc2)C1 ZINC000507334668 916090825 /nfs/dbraw/zinc/09/08/25/916090825.db2.gz RGPVMCUYKSNHGF-DUXKGJEZSA-N 0 3 406.555 4.367 20 0 HIADHN CC(C)(c1ccccc1)c1ccc(OC[C@H](O)CN2CCC(c3cn[nH]c3)CC2)cc1 ZINC000507461895 916228443 /nfs/dbraw/zinc/22/84/43/916228443.db2.gz NGYMTCDDRLQPKV-XMMPIXPASA-N 0 3 419.569 4.355 20 0 HIADHN COc1ccc(OC)c([C@H](C)NC(=O)[C@H](C)N[C@H](C)c2ccc(SC)cc2)c1 ZINC000507486849 916255331 /nfs/dbraw/zinc/25/53/31/916255331.db2.gz PUMVZRQSQCKMJW-PMPSAXMXSA-N 0 3 402.560 4.342 20 0 HIADHN CN(Cc1ccccc1-c1ccnn1C)[C@H]1c2cc(Cl)cc(Cl)c2C[C@H]1O ZINC000507531045 916289203 /nfs/dbraw/zinc/28/92/03/916289203.db2.gz LUGKTILNEQQSQO-RTWAWAEBSA-N 0 3 402.325 4.484 20 0 HIADHN COCCSc1ccc([C@H](C)N[C@H](C)C(=O)N(C)Cc2ccccc2C)cc1 ZINC000507567039 916322954 /nfs/dbraw/zinc/32/29/54/916322954.db2.gz MLZRSALVUFZWSC-RBUKOAKNSA-N 0 3 400.588 4.431 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)COc2ccc(Cl)c3cccnc23)C1 ZINC000507599133 916352768 /nfs/dbraw/zinc/35/27/68/916352768.db2.gz WLLDKLICXADIEG-FUHWJXTLSA-N 0 3 409.917 4.219 20 0 HIADHN Cc1ccc(-n2nc(C(=O)N[C@@H]3CCN([C@H](C)c4ccccc4)C3)c3c2CCC3)cc1 ZINC000507604616 916360644 /nfs/dbraw/zinc/36/06/44/916360644.db2.gz LWJOBGYJCJXDOC-TZIWHRDSSA-N 0 3 414.553 4.235 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3sc(CC)nc3C)c(OCC)c2)CC1 ZINC000507606184 916362907 /nfs/dbraw/zinc/36/29/07/916362907.db2.gz MNQGCLFHXCOXSG-UHFFFAOYSA-N 0 3 416.591 4.197 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)C[C@H](C)c3cccnc3)c(OCC)c2)CC1 ZINC000507611289 916370995 /nfs/dbraw/zinc/37/09/95/916370995.db2.gz OUVCZZWBMWNXQF-IBGZPJMESA-N 0 3 410.562 4.145 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)c2ccccc2OCc2cscn2)C1 ZINC000507618841 916378097 /nfs/dbraw/zinc/37/80/97/916378097.db2.gz DKLQZXWLDTVSGI-PKOBYXMFSA-N 0 3 407.539 4.287 20 0 HIADHN CCOc1cc(NC(=O)[C@H]2CN(Cc3ccccc3)CCC2(F)F)ccc1OC ZINC000507674530 916442394 /nfs/dbraw/zinc/44/23/94/916442394.db2.gz UAVVUFYQTZOXIG-GOSISDBHSA-N 0 3 404.457 4.190 20 0 HIADHN CC[C@H](C)N(CC(=O)NCc1c(C)nn(Cc2ccccc2)c1C)Cc1ccccc1 ZINC000507680297 916450674 /nfs/dbraw/zinc/45/06/74/916450674.db2.gz YYHZRMWYROHIIG-FQEVSTJZSA-N 0 3 418.585 4.465 20 0 HIADHN C[C@H](OC[C@H](O)CN(Cc1ccccc1)C[C@@H]1CCCO1)c1ccc(Cl)cc1 ZINC000507702024 916485452 /nfs/dbraw/zinc/48/54/52/916485452.db2.gz LVRJPJJJVIEVTO-NMNUPHIUSA-N 0 3 403.950 4.460 20 0 HIADHN COc1ccc2nc(C3CC3)cc(C(=O)N3C[C@H](N(C)C)Cc4ccccc43)c2c1 ZINC000507703210 916488194 /nfs/dbraw/zinc/48/81/94/916488194.db2.gz BJHSYHLUJXLFHU-GOSISDBHSA-N 0 3 401.510 4.254 20 0 HIADHN CC[C@H]1CN(c2nnc(-c3cccc4cccnc43)n2C)CCN1Cc1ccccc1 ZINC000507777406 916563057 /nfs/dbraw/zinc/56/30/57/916563057.db2.gz HMDVTOIFWZJMOX-NRFANRHFSA-N 0 3 412.541 4.131 20 0 HIADHN Cc1ccc(NC(=O)C2CCN(Cc3ccccc3OCc3ccccn3)CC2)nc1 ZINC000507983920 916828453 /nfs/dbraw/zinc/82/84/53/916828453.db2.gz DQNBQZJPLIYPTN-UHFFFAOYSA-N 0 3 416.525 4.215 20 0 HIADHN Cc1cccc(NC(=O)[C@H]2CCCN(Cc3c[nH]nc3-c3cccc(Cl)c3)C2)n1 ZINC000508013939 916852065 /nfs/dbraw/zinc/85/20/65/916852065.db2.gz JNEITRBGYTUNSA-KRWDZBQOSA-N 0 3 409.921 4.284 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CN1CCC[C@H](C(=O)Nc2cccc(C)n2)C1 ZINC000508037799 916867493 /nfs/dbraw/zinc/86/74/93/916867493.db2.gz LHJXOYAZHWHECS-QFIPXVFZSA-N 0 3 417.557 4.102 20 0 HIADHN CSc1ccccc1[C@@H](C)NC(=O)N1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000508062643 916885893 /nfs/dbraw/zinc/88/58/93/916885893.db2.gz HCSKAZZEVIUJFC-GBESFXJTSA-N 0 3 419.635 4.390 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@H](C)[C@@H]1CCCOC1)c1ccc(C(F)(F)F)cc1 ZINC000508159152 916979814 /nfs/dbraw/zinc/97/98/14/916979814.db2.gz FAVVWQYERJUKTH-SZVBFZGTSA-N 0 3 415.500 4.203 20 0 HIADHN COCc1c(Br)cccc1NC(=O)NC[C@H](c1ccc(C)cc1)N(C)C ZINC000508183260 917004762 /nfs/dbraw/zinc/00/47/62/917004762.db2.gz OZZOSADAPDISTC-LJQANCHMSA-N 0 3 420.351 4.328 20 0 HIADHN COc1ccc(-n2ccc(C(=O)NC[C@H](c3ccccc3)N3CCC(C)CC3)n2)cc1 ZINC000508362047 917161998 /nfs/dbraw/zinc/16/19/98/917161998.db2.gz WLQMIKSDVICHHT-XMMPIXPASA-N 0 3 418.541 4.084 20 0 HIADHN CN(CCc1ccc(F)cc1)C(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000508600796 917370986 /nfs/dbraw/zinc/37/09/86/917370986.db2.gz ZGCNTUOYIUNFJF-NRFANRHFSA-N 0 3 408.439 4.281 20 0 HIADHN CCc1ccccc1NC(=O)CN1[C@H](C)C[C@H](C(=O)N[C@H](C)CC)[C@H]2CCCC[C@@H]21 ZINC000508657492 917423197 /nfs/dbraw/zinc/42/31/97/917423197.db2.gz SHHNAXFQAGOFGE-XKCAEOMCSA-N 0 3 413.606 4.371 20 0 HIADHN CC(=O)Nc1cccc(NC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)c1C ZINC000508805102 917560841 /nfs/dbraw/zinc/56/08/41/917560841.db2.gz XJKNTUHIVYWLNV-NRFANRHFSA-N 0 3 419.447 4.347 20 0 HIADHN C[C@H](NC(=O)c1oc2ccccc2c1CN(C)C)c1ccc(-n2cccn2)c(F)c1 ZINC000508826610 917579326 /nfs/dbraw/zinc/57/93/26/917579326.db2.gz HCODBYYELKQSSP-HNNXBMFYSA-N 0 3 406.461 4.310 20 0 HIADHN C[C@H](NC(=O)N1CCC(Oc2ccc(F)cc2F)CC1)[C@@H](c1ccccc1)N(C)C ZINC000508860113 917613501 /nfs/dbraw/zinc/61/35/01/917613501.db2.gz ZXEYEBXUEMWWKF-AOMKIAJQSA-N 0 3 417.500 4.209 20 0 HIADHN C[C@@H](NC(=O)Nc1ccccc1CN1C[C@@H](C)O[C@H](C)C1)[C@H](c1ccccc1)N(C)C ZINC000508877235 917630361 /nfs/dbraw/zinc/63/03/61/917630361.db2.gz XUFQSMGTNYVYBD-DBYOASNMSA-N 0 3 424.589 4.109 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)cc1OC ZINC000508880336 917634213 /nfs/dbraw/zinc/63/42/13/917634213.db2.gz LGBWAFSMPKLECE-NYDSKATKSA-N 0 3 411.546 4.242 20 0 HIADHN C[C@H](NC(=O)N(Cc1cccc(F)c1)C[C@H]1CCCO1)[C@H](c1ccccc1)N(C)C ZINC000508888644 917643650 /nfs/dbraw/zinc/64/36/50/917643650.db2.gz CNWHCJWJQBBRQL-CDNPAEQRSA-N 0 3 413.537 4.208 20 0 HIADHN C[C@@H](NC(=O)N(C)Cc1csc(Br)c1)[C@@H](c1ccccc1)N(C)C ZINC000508896562 917651435 /nfs/dbraw/zinc/65/14/35/917651435.db2.gz IEERTWUQQJFQOT-DYVFJYSZSA-N 0 3 410.381 4.343 20 0 HIADHN C[C@@H](NC(=O)NCc1ccncc1OCc1ccccc1)[C@H](c1ccccc1)N(C)C ZINC000508900189 917654517 /nfs/dbraw/zinc/65/45/17/917654517.db2.gz XEWATAUOJYEKIC-NTKDMRAZSA-N 0 3 418.541 4.151 20 0 HIADHN C[C@@H](NC(=O)Nc1ccc(C(=O)NC2CCCC2)cc1)[C@@H](c1ccccc1)N(C)C ZINC000508904629 917660017 /nfs/dbraw/zinc/66/00/17/917660017.db2.gz IICBMQRMUALZOV-VGSWGCGISA-N 0 3 408.546 4.172 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)c(OC)c1 ZINC000508905495 917661962 /nfs/dbraw/zinc/66/19/62/917661962.db2.gz LKAFTBCGHBCQDW-HYVJGQCMSA-N 0 3 411.546 4.242 20 0 HIADHN CCOc1ccc(CNC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)cc1 ZINC000509004099 917759852 /nfs/dbraw/zinc/75/98/52/917759852.db2.gz FAIHXUWEKBZVJO-OAQYLSRUSA-N 0 3 406.448 4.156 20 0 HIADHN CN(Cc1nc2cc(Br)ccc2o1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000509007733 917762326 /nfs/dbraw/zinc/76/23/26/917762326.db2.gz JNVWTZISZVUYFS-QGZVFWFLSA-N 0 3 400.320 4.297 20 0 HIADHN Cc1ccc(S(=O)(=O)N[C@H](CCN(C)[C@@H](C)c2ccccn2)c2ccccc2)cc1 ZINC000509020179 917775030 /nfs/dbraw/zinc/77/50/30/917775030.db2.gz CJJYWDLUMVMBCE-GBXCKJPGSA-N 0 3 423.582 4.493 20 0 HIADHN COc1ccc([C@H]2CCN(C(=O)[C@H]3CN(Cc4ccccc4)CCC3(F)F)C2)cc1 ZINC000509072109 917816749 /nfs/dbraw/zinc/81/67/49/917816749.db2.gz WUBCGWWRJNZDLH-RBBKRZOGSA-N 0 3 414.496 4.169 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1ccccc1Oc1cnn(C)c1)c1cccc(OC)c1 ZINC000509127517 917859522 /nfs/dbraw/zinc/85/95/22/917859522.db2.gz XZPKJFYVADBLIJ-JOCHJYFZSA-N 0 3 422.529 4.034 20 0 HIADHN Cc1cccc(CCCNC(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)n1 ZINC000509200210 917904623 /nfs/dbraw/zinc/90/46/23/917904623.db2.gz IKHUICDINFWJJG-UHFFFAOYSA-N 0 3 422.495 4.115 20 0 HIADHN Cc1noc([C@@H]2CCCN(Cc3cn(-c4ccccc4)nc3-c3ccncc3)C2)n1 ZINC000509365439 918029513 /nfs/dbraw/zinc/02/95/13/918029513.db2.gz JZNHDHZWTVHFSO-LJQANCHMSA-N 0 3 400.486 4.005 20 0 HIADHN COc1ccc(C(=O)CCN2CCC[C@@H](CNC(=O)Nc3ccc(C)cc3)C2)cc1 ZINC000509373908 918038903 /nfs/dbraw/zinc/03/89/03/918038903.db2.gz RPJKASHTOIJBOT-IBGZPJMESA-N 0 3 409.530 4.110 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(CN(C)CCOc3ccccc3OC)c2)cc1 ZINC000509418957 918079192 /nfs/dbraw/zinc/07/91/92/918079192.db2.gz LZIYVPZQKVPTQD-UHFFFAOYSA-N 0 3 420.509 4.467 20 0 HIADHN CC(C)(C)n1cc(CN[C@H]2CC(=O)N3CCCC[C@@H]23)c(-c2ccccc2Cl)n1 ZINC000509422225 918082895 /nfs/dbraw/zinc/08/28/95/918082895.db2.gz BIGHWSZPGZHHFC-OALUTQOASA-N 0 3 400.954 4.202 20 0 HIADHN CCCn1nc(C)c(CN2CCC(C(=O)Nc3cc(Cl)ccc3O)CC2)c1C ZINC000509518535 918168068 /nfs/dbraw/zinc/16/80/68/918168068.db2.gz GKWZDCXTGKDNIW-UHFFFAOYSA-N 0 3 404.942 4.120 20 0 HIADHN COCCOc1ccc([C@H](C)NCc2ccc(-c3cnn(C)c3)s2)cc1OC ZINC000509536338 918184873 /nfs/dbraw/zinc/18/48/73/918184873.db2.gz CCMWMGMVPSNKKP-HNNXBMFYSA-N 0 3 401.532 4.033 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)NC(C)(C)c1nc(C(F)(F)F)cs1)c1ccco1 ZINC000509579824 918228118 /nfs/dbraw/zinc/22/81/18/918228118.db2.gz XARBQFUNUFXMNX-NWDGAFQWSA-N 0 3 418.485 4.419 20 0 HIADHN CC(C)N(C)C(=O)C1CCN(Cc2cn(-c3ccccc3)nc2-c2ccncc2)CC1 ZINC000509580599 918229738 /nfs/dbraw/zinc/22/97/38/918229738.db2.gz SGFXDWVMCBBJDM-UHFFFAOYSA-N 0 3 417.557 4.013 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N(C)Cc1csc(Br)c1)c1ccco1 ZINC000509595658 918244324 /nfs/dbraw/zinc/24/43/24/918244324.db2.gz INHXPZQTBDXTJX-JSGCOSHPSA-N 0 3 414.369 4.374 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N1CC=C(c2c(F)cccc2F)CC1)c1ccco1 ZINC000509594831 918244476 /nfs/dbraw/zinc/24/44/76/918244476.db2.gz FXXWEZFYEOCXJP-HNAYVOBHSA-N 0 3 403.473 4.486 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N1CCO[C@@H](c2ccccc2Cl)C1)c1ccco1 ZINC000509597170 918247631 /nfs/dbraw/zinc/24/76/31/918247631.db2.gz YKAFIRPUCXJVQQ-ZAAXVRCTSA-N 0 3 405.926 4.145 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N1CCC(c2nc3ccccc3[nH]2)CC1)c1ccco1 ZINC000509597832 918248043 /nfs/dbraw/zinc/24/80/43/918248043.db2.gz ATYCMAGAZAUVKJ-JXFKEZNVSA-N 0 3 409.534 4.174 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)Nc1ccccc1N1CCCC1 ZINC000509605556 918255012 /nfs/dbraw/zinc/25/50/12/918255012.db2.gz ZREHREWIEGVXKL-UHFFFAOYSA-N 0 3 421.589 4.011 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)N(C)Cc1ccc(OC(F)(F)F)cc1)c1ccco1 ZINC000509612405 918259501 /nfs/dbraw/zinc/25/95/01/918259501.db2.gz YGMVPHQNQSVUFN-PBHICJAKSA-N 0 3 413.440 4.449 20 0 HIADHN CCN1CCC[C@@H](CN(C)c2ncnc3sc4c(c32)CCCC4)[C@@H]1c1cnn(C)c1 ZINC000509622223 918269958 /nfs/dbraw/zinc/26/99/58/918269958.db2.gz BLSGEANMVGUHLR-HRAATJIYSA-N 0 3 424.618 4.213 20 0 HIADHN Cc1ccc(-c2n[nH]cc2CN2CCC(NC(=O)Nc3ccc(F)cc3)CC2)cc1 ZINC000509695034 918326570 /nfs/dbraw/zinc/32/65/70/918326570.db2.gz DMUQQISTDBQIAN-UHFFFAOYSA-N 0 3 407.493 4.310 20 0 HIADHN COc1cc2c(cc1OC)[C@H](c1ccccc1)N(C(=O)[C@H](C)N1CCCCCC1)CC2 ZINC000509812510 918415524 /nfs/dbraw/zinc/41/55/24/918415524.db2.gz YLWSFDSFJOCMAS-DFBJGRDBSA-N 0 3 422.569 4.442 20 0 HIADHN O=C(Cc1ccccc1)N1CCC[C@H](NCc2ccc(-c3ccncc3)cc2F)C1 ZINC000509949934 918545564 /nfs/dbraw/zinc/54/55/64/918545564.db2.gz UMWVFCQWYIGOMH-QHCPKHFHSA-N 0 3 403.501 4.211 20 0 HIADHN CC(C)Oc1ccc(NC(=O)NCCCCN2CCN(Cc3ccccc3)CC2)cc1 ZINC000509963321 918554180 /nfs/dbraw/zinc/55/41/80/918554180.db2.gz KYWDIXVURXXHGW-UHFFFAOYSA-N 0 3 424.589 4.193 20 0 HIADHN CC(C)Oc1ccc(NC(=O)NCCCCN2CCN(c3ccccc3)CC2)cc1 ZINC000509964996 918555289 /nfs/dbraw/zinc/55/52/89/918555289.db2.gz YXEMIQPXVWVUKU-UHFFFAOYSA-N 0 3 410.562 4.198 20 0 HIADHN CN(CCCCCc1cc(-c2ccc(F)cc2)n[nH]1)Cc1cc(C(N)=O)cs1 ZINC000510200221 918749611 /nfs/dbraw/zinc/74/96/11/918749611.db2.gz OYIAHJAYDJRTJX-UHFFFAOYSA-N 0 3 400.523 4.221 20 0 HIADHN CN(Cc1nc2c3ccccc3oc2c(=O)[n-]1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000510220386 918765251 /nfs/dbraw/zinc/76/52/51/918765251.db2.gz BYFZBGHDYQXYHS-UHFFFAOYSA-N 0 3 402.498 4.178 20 0 HIADHN CC(C)[C@@H](CNC(=O)Nc1nnc(-c2ccco2)s1)N1CCc2ccccc2C1 ZINC000510250174 918786451 /nfs/dbraw/zinc/78/64/51/918786451.db2.gz AKPWBVNVUKMSQJ-QGZVFWFLSA-N 0 3 411.531 4.003 20 0 HIADHN COc1ccc(F)cc1NC(=O)N(CCN(C)C)Cc1ccc(C(F)(F)F)cc1 ZINC000510267288 918796389 /nfs/dbraw/zinc/79/63/89/918796389.db2.gz FMGVQTNSWFOCDM-UHFFFAOYSA-N 0 3 413.415 4.449 20 0 HIADHN COC[C@H](C)N(C)Cc1cn(Cc2ccccc2)nc1-c1ccc(OC)c(OC)c1 ZINC000510434426 918894888 /nfs/dbraw/zinc/89/48/88/918894888.db2.gz DHNGQVHKYGGCFV-SFHVURJKSA-N 0 3 409.530 4.082 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)Nc1cccc(Cl)c1-n1cccn1 ZINC000510475371 918929351 /nfs/dbraw/zinc/92/93/51/918929351.db2.gz GLWFQJLLILZBFQ-UHFFFAOYSA-N 0 3 419.982 4.009 20 0 HIADHN CC(C)(C)NC(=O)c1cccc(NC(=O)N[C@H](CN2CCCC2)c2ccccc2)c1 ZINC000510498412 918944980 /nfs/dbraw/zinc/94/49/80/918944980.db2.gz ZHYQMGDNNSSKER-OAQYLSRUSA-N 0 3 408.546 4.174 20 0 HIADHN CCN1CCN([C@@H]2CCN([C@H](C)c3ncc(-c4ccc(Cl)cc4Cl)o3)C2)CC1 ZINC000510496909 918945350 /nfs/dbraw/zinc/94/53/50/918945350.db2.gz RVYHRSLAQGEWDZ-NVXWUHKLSA-N 0 3 423.388 4.421 20 0 HIADHN CN(CCCc1cc(-c2ccc(F)cc2)n[nH]1)Cc1ccc(Br)cn1 ZINC000510504046 918952772 /nfs/dbraw/zinc/95/27/72/918952772.db2.gz WWRYYQZUXXTKDO-UHFFFAOYSA-N 0 3 403.299 4.438 20 0 HIADHN CCOc1cc(CN2CCC(N3CCO[C@@H](C)C3)CC2)ccc1OCc1ccccc1 ZINC000510506916 918954406 /nfs/dbraw/zinc/95/44/06/918954406.db2.gz BXGQKZCPPKPXMV-NRFANRHFSA-N 0 3 424.585 4.349 20 0 HIADHN Cc1n[nH]c(C)c1[C@@H]1CCCCCN1C(=O)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000510526750 918972885 /nfs/dbraw/zinc/97/28/85/918972885.db2.gz UMOGFHUVOWUWGC-VXKWHMMOSA-N 0 3 409.578 4.490 20 0 HIADHN O=C(Nc1ccc(C(=O)NC2CCCCC2)cc1)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000510534830 918980144 /nfs/dbraw/zinc/98/01/44/918980144.db2.gz RZSKUYZVZWTWQP-HSZRJFAPSA-N 0 3 420.557 4.145 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CC[C@H](n2ncc3ccccc32)C1)c1ccsc1 ZINC000510539923 918985621 /nfs/dbraw/zinc/98/56/21/918985621.db2.gz OECCBGMSGHWMEV-FPOVZHCZSA-N 0 3 411.575 4.137 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)N[C@@H](c1nccs1)c1ccccc1 ZINC000510557360 919000869 /nfs/dbraw/zinc/00/08/69/919000869.db2.gz DFYXCRARNVZROO-JOCHJYFZSA-N 0 3 422.598 4.439 20 0 HIADHN Cc1n[nH]c(C)c1[C@H]1CCCCCN1C(=O)NCC1(N2CCSCC2)CCCC1 ZINC000510561357 919003869 /nfs/dbraw/zinc/00/38/69/919003869.db2.gz NKDIIXJWVYVCAA-LJQANCHMSA-N 0 3 419.639 4.015 20 0 HIADHN CCOC1CC(CN2CCN(CC3CC(OCC)C3)[C@H](c3cccc(F)c3)C2)C1 ZINC000510630874 919072793 /nfs/dbraw/zinc/07/27/93/919072793.db2.gz DHHTYVHJLIEVBQ-YPYWWCMWSA-N 0 3 404.570 4.115 20 0 HIADHN CN(Cc1c[nH]nc1-c1cccs1)C[C@H](O)COc1ccccc1C(F)(F)F ZINC000510632907 919074754 /nfs/dbraw/zinc/07/47/54/919074754.db2.gz XLOMHEPGQUFWGY-AWEZNQCLSA-N 0 3 411.449 4.029 20 0 HIADHN C[C@@H]1CN(c2ccc(CN[C@@H]3CCc4ccc(Br)cc43)cn2)C[C@H](C)O1 ZINC000510668470 919109318 /nfs/dbraw/zinc/10/93/18/919109318.db2.gz JNIDFTGAPJCUNH-QEEYODRMSA-N 0 3 416.363 4.235 20 0 HIADHN CCN(CC)CCN(Cc1ccccc1)C(=O)C(=O)c1ccc(Br)cc1 ZINC000510724933 919169181 /nfs/dbraw/zinc/16/91/81/919169181.db2.gz BQCBHAFNFNMFNR-UHFFFAOYSA-N 0 3 417.347 4.002 20 0 HIADHN C[C@@H](NC(=O)c1ccc(COc2cccc(Br)c2)o1)C1=CCN(C)CC1 ZINC000510772526 919229713 /nfs/dbraw/zinc/22/97/13/919229713.db2.gz JVNRIRZZTPAAPB-CQSZACIVSA-N 0 3 419.319 4.001 20 0 HIADHN C[C@@H](NC(=O)c1nn(-c2ccc(Cl)cc2)c2c1CCCCC2)C1=CCN(C)CC1 ZINC000510788446 919254347 /nfs/dbraw/zinc/25/43/47/919254347.db2.gz RIITZJBTHRBMFD-MRXNPFEDSA-N 0 3 412.965 4.175 20 0 HIADHN COc1ccc(Br)cc1CNC(=O)c1oc2ccccc2c1CN(C)C ZINC000510791339 919259101 /nfs/dbraw/zinc/25/91/01/919259101.db2.gz FHEZEMKOLHETFO-UHFFFAOYSA-N 0 3 417.303 4.196 20 0 HIADHN C[C@@H]1CSc2ccc(Br)cc2[C@H]1NCc1ccc2c(c1)oc(=O)n2C ZINC000510798776 919269741 /nfs/dbraw/zinc/26/97/41/919269741.db2.gz TUJBGKYZYMUTGT-ZMZPIMSZSA-N 0 3 419.344 4.467 20 0 HIADHN CC(C)S(=O)(=O)Cc1ccc(NC(=O)c2oc3ccccc3c2CN(C)C)cc1 ZINC000510808054 919282903 /nfs/dbraw/zinc/28/29/03/919282903.db2.gz ALUAORSJATVLFN-UHFFFAOYSA-N 0 3 414.527 4.070 20 0 HIADHN C[C@@H](c1ccc(NC(=O)c2oc3ccccc3c2CN(C)C)cc1)N1CCOCC1 ZINC000510852921 919342023 /nfs/dbraw/zinc/34/20/23/919342023.db2.gz PCFYHLMGTQBTGF-KRWDZBQOSA-N 0 3 407.514 4.140 20 0 HIADHN CCOc1cc2c(cc1CNC(=O)c1oc3ccccc3c1CN(C)C)O[C@@H](C)C2 ZINC000510902533 919403497 /nfs/dbraw/zinc/40/34/97/919403497.db2.gz MWZLHMBBCFJMAS-HNNXBMFYSA-N 0 3 408.498 4.147 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](NCCCOC(F)F)c2ccc(Cl)cc2)c1 ZINC000510981353 919533854 /nfs/dbraw/zinc/53/38/54/919533854.db2.gz CRVXZQHKPIKSPT-KRWDZBQOSA-N 0 3 403.878 4.052 20 0 HIADHN C[C@@H](N[C@H]1CCCc2nn(C)cc21)c1cccc(OCc2cn3ccccc3n2)c1 ZINC000511009428 919571342 /nfs/dbraw/zinc/57/13/42/919571342.db2.gz FPSGYQJWHWCXSD-VGSWGCGISA-N 0 3 401.514 4.375 20 0 HIADHN CCOC(=O)c1oc2c(c1C)[C@H](N[C@H]1CCN(C(=O)Nc3ccccc3)C1)CCC2 ZINC000511028160 919601684 /nfs/dbraw/zinc/60/16/84/919601684.db2.gz FSQCPTJZJZMMPZ-ZWKOTPCHSA-N 0 3 411.502 4.038 20 0 HIADHN CCOC(=O)c1oc2c(c1C)[C@@H](N[C@@H]1CCN(C(=O)Nc3ccccc3)C1)CCC2 ZINC000511028157 919602136 /nfs/dbraw/zinc/60/21/36/919602136.db2.gz FSQCPTJZJZMMPZ-MSOLQXFVSA-N 0 3 411.502 4.038 20 0 HIADHN C[C@H](N[C@H]1CCCN(C(=O)Cc2ccccc2)C1)c1ccc(F)cc1OC(F)F ZINC000511052981 919647718 /nfs/dbraw/zinc/64/77/18/919647718.db2.gz DBILWMCVRAHTHB-YJBOKZPZSA-N 0 3 406.448 4.311 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)c1cc2c(cccc2Br)[nH]1 ZINC000511077540 919680557 /nfs/dbraw/zinc/68/05/57/919680557.db2.gz TWKFYQQASFCSOL-FQEVSTJZSA-N 0 3 412.331 4.497 20 0 HIADHN CN(CCCc1cc(-c2ccccc2)n[nH]1)C(=O)[C@H]1CCCN1Cc1ccccc1 ZINC000511087683 919691138 /nfs/dbraw/zinc/69/11/38/919691138.db2.gz ABTNQTFLWODVCR-XMMPIXPASA-N 0 3 402.542 4.132 20 0 HIADHN C[C@H](NC(=O)N(C)CCCCCc1cc(-c2ccccc2)no1)C1=CCN(C)CC1 ZINC000511214245 919823929 /nfs/dbraw/zinc/82/39/29/919823929.db2.gz DPBDMNVSJFVDGG-IBGZPJMESA-N 0 3 410.562 4.346 20 0 HIADHN Cc1cc(C)n(-c2ccc(C(F)(F)F)cc2NC(=O)N[C@@H](C)C2=CCN(C)CC2)n1 ZINC000511265200 919863204 /nfs/dbraw/zinc/86/32/04/919863204.db2.gz KNLFLXQOWZXBNQ-HNNXBMFYSA-N 0 3 421.467 4.280 20 0 HIADHN C[C@H](NC(=O)N1CCC(c2nc3cc(Cl)ccc3o2)CC1)C1=CCN(C)CC1 ZINC000511284890 919879914 /nfs/dbraw/zinc/87/99/14/919879914.db2.gz ICBPWFSVKXBVCV-AWEZNQCLSA-N 0 3 402.926 4.021 20 0 HIADHN C[C@@H](NC(=O)N1CCC(c2nc3cc(Cl)ccc3o2)CC1)C1=CCN(C)CC1 ZINC000511284891 919880165 /nfs/dbraw/zinc/88/01/65/919880165.db2.gz ICBPWFSVKXBVCV-CQSZACIVSA-N 0 3 402.926 4.021 20 0 HIADHN Cc1cc(C(=O)N2CCC(C)CC2)ccc1NC(=O)NC[C@@H](c1ccccc1)N(C)C ZINC000511284613 919880200 /nfs/dbraw/zinc/88/02/00/919880200.db2.gz ZDNLRGBHHVKSBX-QHCPKHFHSA-N 0 3 422.573 4.292 20 0 HIADHN COc1ccccc1[C@H](NC(=O)N[C@H](C)C1=CCN(C)CC1)c1ccccc1Cl ZINC000511309489 919902308 /nfs/dbraw/zinc/90/23/08/919902308.db2.gz RPIFJTLBZARWOQ-OPAMFIHVSA-N 0 3 413.949 4.388 20 0 HIADHN Cc1cccc(-c2nn(-c3ccc(F)cc3)cc2C(=O)N[C@H](C)C2=CCN(C)CC2)c1 ZINC000511325504 919916678 /nfs/dbraw/zinc/91/66/78/919916678.db2.gz MSJJXFSCTPARJS-GOSISDBHSA-N 0 3 418.516 4.367 20 0 HIADHN CC(C)c1c(NC(=O)[C@H]2CCCN(Cc3cccnc3)C2)cnn1-c1ccccc1 ZINC000562353810 945064761 /nfs/dbraw/zinc/06/47/61/945064761.db2.gz VRXGNQRBZNKKHI-FQEVSTJZSA-N 0 3 403.530 4.241 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N[C@H](C[C@H]1CCOC1)c1ccccc1 ZINC000511366044 919958723 /nfs/dbraw/zinc/95/87/23/919958723.db2.gz SMWPTIPZPNUSIB-HMXCVIKNSA-N 0 3 413.587 4.352 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)N[C@H](C[C@H]2CCOC2)c2ccccc2)c1 ZINC000511373078 919967649 /nfs/dbraw/zinc/96/76/49/919967649.db2.gz VOJAAKGHTKZEIB-ISKFKSNPSA-N 0 3 409.574 4.236 20 0 HIADHN C[C@@H](NC(=O)c1ccccc1-c1nc(-c2cccc(Cl)c2)no1)C1=CCN(C)CC1 ZINC000511377995 919978077 /nfs/dbraw/zinc/97/80/77/919978077.db2.gz JGKKLOVXRVOQSS-OAHLLOKOSA-N 0 3 422.916 4.437 20 0 HIADHN O[C@H](CN[C@H](Cc1ccc(Cl)cc1)c1ccccn1)COc1ccc(F)cc1 ZINC000511381223 919983830 /nfs/dbraw/zinc/98/38/30/919983830.db2.gz IHJDMLGHFOWRNC-DENIHFKCSA-N 0 3 400.881 4.187 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)N[C@H](C[C@H]1CCOC1)c1ccccc1 ZINC000511384810 919987346 /nfs/dbraw/zinc/98/73/46/919987346.db2.gz RPDSUZWCKPRBBI-NFBKMPQASA-N 0 3 413.537 4.067 20 0 HIADHN Cc1cc(NC(=O)c2ccccc2Cl)sc1C(=O)N[C@H](C)C1=CCN(C)CC1 ZINC000511386437 919990057 /nfs/dbraw/zinc/99/00/57/919990057.db2.gz ZFYMNJFPNPYSPU-CQSZACIVSA-N 0 3 417.962 4.342 20 0 HIADHN O=C(N[C@H](C[C@@H]1CCOC1)c1ccccc1)N1CCCN(Cc2ccccc2)CC1 ZINC000511390288 919997481 /nfs/dbraw/zinc/99/74/81/919997481.db2.gz HVEPNUHQIFUUPQ-LADGPHEKSA-N 0 3 407.558 4.072 20 0 HIADHN C[C@@H]1CCN(C(=O)N[C@H](C[C@H]2CCOC2)c2ccccc2)CCN1Cc1ccccc1 ZINC000511395188 920006278 /nfs/dbraw/zinc/00/62/78/920006278.db2.gz CFYIKUKHSZKJNB-GZGNHOFSSA-N 0 3 421.585 4.460 20 0 HIADHN CC[C@H](CC1CCCCC1)C(=O)NCc1ccc(C(=O)NCCN2CCCC2)cc1 ZINC000511422471 920036654 /nfs/dbraw/zinc/03/66/54/920036654.db2.gz JFRZOLJWEKLQST-JOCHJYFZSA-N 0 3 413.606 4.125 20 0 HIADHN COc1cc(OC)cc(N2CC[C@@H](NCc3ccc(Sc4ccccn4)o3)C2)c1 ZINC000511503425 920118794 /nfs/dbraw/zinc/11/87/94/920118794.db2.gz GMBHARYGCONLSO-MRXNPFEDSA-N 0 3 411.527 4.212 20 0 HIADHN CCOc1cc2c(cc1OCC)CN(C(=O)[C@@H]1CCCN1Cc1ccccc1)CC2 ZINC000511639433 920303613 /nfs/dbraw/zinc/30/36/13/920303613.db2.gz GFRFABCKCXRYHW-QFIPXVFZSA-N 0 3 408.542 4.033 20 0 HIADHN CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@H]3CN2Cc1csc(-c2ccc(Br)cc2)n1 ZINC000511642321 920307672 /nfs/dbraw/zinc/30/76/72/920307672.db2.gz XFWDPBWGVZTHNB-WIHIRCLASA-N 0 3 405.361 4.428 20 0 HIADHN C[C@@H]1CCCN(Cc2csc(NC(=O)[C@H]3CCCN(Cc4ccccc4)C3)n2)C1 ZINC000511646292 920311220 /nfs/dbraw/zinc/31/12/20/920311220.db2.gz JQXBBYZMXGUYDH-QUCCMNQESA-N 0 3 412.603 4.226 20 0 HIADHN c1[nH]nc(-c2ccc3c(c2)OCCO3)c1CN(Cc1ccccc1)C[C@@H]1CCCO1 ZINC000511666672 920332591 /nfs/dbraw/zinc/33/25/91/920332591.db2.gz MTVFOIDAKWBNNJ-NRFANRHFSA-N 0 3 405.498 4.029 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)c2ccc(OCc3ccccc3)nc2)C1 ZINC000511678278 920342168 /nfs/dbraw/zinc/34/21/68/920342168.db2.gz XROXSAWAOYFLLC-XXBNENTESA-N 0 3 401.510 4.226 20 0 HIADHN O=C(N[C@@H]1CN(Cc2ccccc2)C[C@H]1c1ccccc1)c1cc(-c2ccncc2)on1 ZINC000511742253 920418873 /nfs/dbraw/zinc/41/88/73/920418873.db2.gz LXWRQRIHQDDHAY-LADGPHEKSA-N 0 3 424.504 4.135 20 0 HIADHN O=C1NCCN1C1CCN(Cc2ccc(-c3ccc(C(F)(F)F)cc3)s2)CC1 ZINC000511753682 920432664 /nfs/dbraw/zinc/43/26/64/920432664.db2.gz GWMLYDUCROLIFN-UHFFFAOYSA-N 0 3 409.477 4.424 20 0 HIADHN Cc1ccccc1COc1c(C)cc(CN2CCC(N3CCNC3=O)CC2)cc1C ZINC000511776219 920464056 /nfs/dbraw/zinc/46/40/56/920464056.db2.gz UDXUPQWIJQWOCO-UHFFFAOYSA-N 0 3 407.558 4.180 20 0 HIADHN Cc1cc(N2CCCC2)ccc1NC(=O)CN1C[C@H](c2ccccc2)[C@@H]2COCC[C@@H]21 ZINC000511793228 920486645 /nfs/dbraw/zinc/48/66/45/920486645.db2.gz PSCGWWVKXVXDBP-CUYJMHBOSA-N 0 3 419.569 4.038 20 0 HIADHN Cc1cc(N2CCCC2)ccc1NC(=O)CN1C[C@H](c2ccccc2)[C@@H]2COCC[C@H]21 ZINC000511793246 920486700 /nfs/dbraw/zinc/48/67/00/920486700.db2.gz PSCGWWVKXVXDBP-GIFXNVAJSA-N 0 3 419.569 4.038 20 0 HIADHN CCCN(C(=O)c1cccc(C(=O)N(C)CC)c1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000511870521 920598911 /nfs/dbraw/zinc/59/89/11/920598911.db2.gz FKADPHUZIUSJSX-DEOSSOPVSA-N 0 3 421.585 4.295 20 0 HIADHN CC(C)Cc1ccc([C@@H](CNC(=O)N[C@@H](C)c2c(F)cncc2F)N(C)C)cc1 ZINC000511873542 920603113 /nfs/dbraw/zinc/60/31/13/920603113.db2.gz FZDVSPOBJUOAHA-MGPUTAFESA-N 0 3 404.505 4.221 20 0 HIADHN COc1cccc(OC)c1CNC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1 ZINC000511924210 920669616 /nfs/dbraw/zinc/66/96/16/920669616.db2.gz DEYQCTWMURHREI-UHFFFAOYSA-N 0 3 422.447 4.117 20 0 HIADHN Cc1cc([C@H](C)N[C@@H](C)Cn2ncc3ccccc3c2=O)sc1Br ZINC000511924532 920670839 /nfs/dbraw/zinc/67/08/39/920670839.db2.gz AALXEULQPQGGTH-STQMWFEESA-N 0 3 406.349 4.268 20 0 HIADHN COc1ccc(COCCNCc2cnn(-c3ccc(C(F)(F)F)cc3)c2)cc1 ZINC000511958366 920719131 /nfs/dbraw/zinc/71/91/31/920719131.db2.gz UIXQPYSDWGAXRX-UHFFFAOYSA-N 0 3 405.420 4.206 20 0 HIADHN COc1ccc(C2(CNCc3ncc(CN(C)C)s3)CCCCC2)cc1OC ZINC000511988303 920757385 /nfs/dbraw/zinc/75/73/85/920757385.db2.gz HMEUURQDUHKJEB-UHFFFAOYSA-N 0 3 403.592 4.214 20 0 HIADHN O=C(CCN1CCN(c2ccccc2)CC1)N[C@@H](CC(F)(F)F)c1ccc(F)cc1 ZINC000511996795 920766297 /nfs/dbraw/zinc/76/62/97/920766297.db2.gz LLJVTSLKNPRXMM-FQEVSTJZSA-N 0 3 423.454 4.148 20 0 HIADHN CCc1cccc2c(CCNCc3ncc(I)s3)c[nH]c21 ZINC000512007564 920778427 /nfs/dbraw/zinc/77/84/27/920778427.db2.gz NOOBPUWGZCUZEQ-UHFFFAOYSA-N 0 3 411.312 4.124 20 0 HIADHN FC(F)(F)[C@H]1CCC[C@H](CNCc2ncc(I)s2)C1 ZINC000512015926 920787925 /nfs/dbraw/zinc/78/79/25/920787925.db2.gz QNTGZAISYDSKSK-IUCAKERBSA-N 0 3 404.239 4.206 20 0 HIADHN COc1cc(F)c([C@H](C)NC(=O)NC[C@H](c2ccccc2)N2CCCC2)cc1OC ZINC000512024506 920800317 /nfs/dbraw/zinc/80/03/17/920800317.db2.gz FGUDEZMVYDACKI-OXJNMPFZSA-N 0 3 415.509 4.040 20 0 HIADHN COc1cc(OC)cc(N2CC[C@H](CNCc3cscc3Br)C2)c1 ZINC000512032760 920805245 /nfs/dbraw/zinc/80/52/45/920805245.db2.gz WLBMSLOZSRERBY-CYBMUJFWSA-N 0 3 411.365 4.144 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N[C@H](C)c1cc(OC)c(OC)cc1F)c1ccsc1 ZINC000512040999 920812392 /nfs/dbraw/zinc/81/23/92/920812392.db2.gz KHLKRYBAXYDFDN-KDOFPFPSSA-N 0 3 423.554 4.348 20 0 HIADHN Cc1cc([C@@H](C)NCCNC(=O)c2c(F)cccc2F)sc1Br ZINC000512055721 920825565 /nfs/dbraw/zinc/82/55/65/920825565.db2.gz ZJKMJFKLFAJMBU-SNVBAGLBSA-N 0 3 403.292 4.178 20 0 HIADHN CCN1CCCC[C@@H]1C(=O)N1CCC[C@H](Cc2nc(C3CCCCCC3)no2)C1 ZINC000512055952 920826061 /nfs/dbraw/zinc/82/60/61/920826061.db2.gz HAQTXMWUTHJXGP-UYAOXDASSA-N 0 3 402.583 4.163 20 0 HIADHN C[C@@H]1CN(C[C@@H]2CCCN2CC2=Cc3cc(Cl)cc(Cl)c3OC2)C[C@@H](C)O1 ZINC000512072346 920838902 /nfs/dbraw/zinc/83/89/02/920838902.db2.gz NKFVKUPSQVOSDJ-CLCXKQKWSA-N 0 3 411.373 4.343 20 0 HIADHN Cc1cc([C@H](C)NCCCS(=O)(=O)Cc2ccccc2)sc1Br ZINC000512083617 920847883 /nfs/dbraw/zinc/84/78/83/920847883.db2.gz RLVFAHZGPXGZFF-AWEZNQCLSA-N 0 3 416.406 4.475 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)NCc2ccsc2Br)C1 ZINC000512112522 920868178 /nfs/dbraw/zinc/86/81/78/920868178.db2.gz OBPZMJROINVTKR-CZUORRHYSA-N 0 3 408.365 4.145 20 0 HIADHN CNS(=O)(=O)c1ccc([C@@H](C)N[C@@H](C)c2cc(C)c(Br)s2)cc1 ZINC000512112606 920868435 /nfs/dbraw/zinc/86/84/35/920868435.db2.gz FFBBHLJYANGJLW-NEPJUHHUSA-N 0 3 417.394 4.139 20 0 HIADHN C[C@@H](NC(=O)c1ccc(Oc2ccc(Br)cc2)nc1)C1=CCN(C)CC1 ZINC000512126889 920876312 /nfs/dbraw/zinc/87/63/12/920876312.db2.gz HYCNLBJSVGKJKM-CQSZACIVSA-N 0 3 416.319 4.017 20 0 HIADHN Cc1nn(-c2ccc(Cl)c(Cl)c2)c(C)c1CC(=O)N[C@H](C)C1=CCN(C)CC1 ZINC000512126759 920876472 /nfs/dbraw/zinc/87/64/72/920876472.db2.gz GEDLDEUDIMYZRP-CYBMUJFWSA-N 0 3 421.372 4.105 20 0 HIADHN Cc1ccc(-n2cc(C(=O)N[C@@H](C)C3=CCN(C)CC3)c(-c3ccccc3)n2)cc1 ZINC000512134886 920882373 /nfs/dbraw/zinc/88/23/73/920882373.db2.gz ZOHLBTXUWZKFJI-IBGZPJMESA-N 0 3 400.526 4.228 20 0 HIADHN C[C@H](NC(=O)c1ccc(Oc2cccc(Br)c2)nc1)C1=CCN(C)CC1 ZINC000512142320 920886536 /nfs/dbraw/zinc/88/65/36/920886536.db2.gz JFDCETYQEUDCEK-AWEZNQCLSA-N 0 3 416.319 4.017 20 0 HIADHN C[C@@H]1Cc2cc(-c3ccc(CNCc4ccc5c(c4)oc(=O)n5C)cc3)ccc2O1 ZINC000512194901 920939280 /nfs/dbraw/zinc/93/92/80/920939280.db2.gz LNPXAWSUHHCXAQ-MRXNPFEDSA-N 0 3 400.478 4.412 20 0 HIADHN COCc1ccccc1/C=C(\C)CNCC(=O)Nc1cccc(Br)c1 ZINC000512215777 920965601 /nfs/dbraw/zinc/96/56/01/920965601.db2.gz XGYZNRFBIZCBPG-XNTDXEJSSA-N 0 3 403.320 4.227 20 0 HIADHN CC(C)(CN[C@@H](C(=O)NCc1ccc2c(c1)OCO2)c1ccccc1)c1cccs1 ZINC000512246337 921004890 /nfs/dbraw/zinc/00/48/90/921004890.db2.gz YWUBIGNVWTVEHV-JOCHJYFZSA-N 0 3 422.550 4.402 20 0 HIADHN CCC[C@@]1(NCC(=O)N2N=C(c3ccc(Cl)cc3)C[C@H]2c2ccco2)CCOC1 ZINC000512256741 921015896 /nfs/dbraw/zinc/01/58/96/921015896.db2.gz ASUPRAGBWZGAHU-SIKLNZKXSA-N 0 3 415.921 4.160 20 0 HIADHN CCCN(Cc1nc(-c2ccccc2)no1)C1CCN(c2cc(C)nc(C)n2)CC1 ZINC000512282461 921037272 /nfs/dbraw/zinc/03/72/72/921037272.db2.gz VHTXXYWYLHFIMI-UHFFFAOYSA-N 0 3 406.534 4.024 20 0 HIADHN CCCOc1cc(CN2CCC(C(=O)NCCc3cccs3)CC2)ccc1OC ZINC000512350274 921096678 /nfs/dbraw/zinc/09/66/78/921096678.db2.gz KWHBAJLNHGIQLK-UHFFFAOYSA-N 0 3 416.587 4.116 20 0 HIADHN O[C@H](CN[C@@H]1CCSc2ccc(Br)cc21)COc1ccc(F)cc1 ZINC000513472479 921831821 /nfs/dbraw/zinc/83/18/21/921831821.db2.gz FXPVWPXRFRRFNG-RHSMWYFYSA-N 0 3 412.324 4.155 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)c1cnc(-c2ccccc2)s1 ZINC000513500561 921850027 /nfs/dbraw/zinc/85/00/27/921850027.db2.gz NEGRSGRDSKTOFE-UHFFFAOYSA-N 0 3 401.482 4.292 20 0 HIADHN Cn1ccnc1SCc1cccc(C(=O)NC[C@@H]2CCCN2Cc2ccccc2)c1 ZINC000513568987 921901712 /nfs/dbraw/zinc/90/17/12/921901712.db2.gz WYVJEXZWIWTHOL-QFIPXVFZSA-N 0 3 420.582 4.107 20 0 HIADHN CC(C)(C)n1ncc(C(=O)NC[C@@H]2CCCN2Cc2ccccc2)c1C(F)(F)F ZINC000513586991 921918385 /nfs/dbraw/zinc/91/83/85/921918385.db2.gz SZLZYAXBBMTYAG-INIZCTEOSA-N 0 3 408.468 4.051 20 0 HIADHN CCN(Cc1ccccc1)C(=O)CN[C@@H](Cc1ccncc1)c1ccc(OC)cc1 ZINC000513660057 921982878 /nfs/dbraw/zinc/98/28/78/921982878.db2.gz FLSYVNKTKUYWCU-DEOSSOPVSA-N 0 3 403.526 4.012 20 0 HIADHN COc1ccc([C@H](C)N[C@@H](C)c2ccccc2-n2ccnn2)cc1Br ZINC000513673701 921995819 /nfs/dbraw/zinc/99/58/19/921995819.db2.gz WEGSLFZSBKPKGI-KBPBESRZSA-N 0 3 401.308 4.450 20 0 HIADHN COc1ccc([C@@H](Cc2ccncc2)N[C@@H]2CC(=O)N(c3c(F)cccc3F)C2)cc1 ZINC000513685008 922005830 /nfs/dbraw/zinc/00/58/30/922005830.db2.gz WCNDPUQVPPSQSF-XMSQKQJNSA-N 0 3 423.463 4.047 20 0 HIADHN CCOc1ccccc1NC(=O)[C@H](C)N[C@H]1CCC[C@H]1Oc1cc(F)cc(F)c1 ZINC000513725541 922044883 /nfs/dbraw/zinc/04/48/83/922044883.db2.gz PHMLUIIRXWHZKZ-ONTRVFCTSA-N 0 3 404.457 4.280 20 0 HIADHN COc1cccc([C@H](CNC(=O)Cc2cccc3ccc(OC)cc32)N2CCCC2)c1 ZINC000513805426 922130287 /nfs/dbraw/zinc/13/02/87/922130287.db2.gz QITNXWFXOWNJBP-VWLOTQADSA-N 0 3 418.537 4.353 20 0 HIADHN COc1cc(Cl)c(C(=O)NC[C@H]2CCCCN2Cc2ccccc2)cc1OC ZINC000513854085 922178811 /nfs/dbraw/zinc/17/88/11/922178811.db2.gz JBGXYPBRQVRSDB-QGZVFWFLSA-N 0 3 402.922 4.142 20 0 HIADHN C[C@@H](N[C@H]1CCc2c1cccc2Br)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000513861824 922188682 /nfs/dbraw/zinc/18/86/82/922188682.db2.gz NSMUUTHBNLVLPZ-YJYMSZOUSA-N 0 3 423.376 4.038 20 0 HIADHN CC(C)c1ccc(CN2CCN(C[C@H]3CCN(C(=O)c4ccccc4)C3)CC2)cc1 ZINC000513965791 922284714 /nfs/dbraw/zinc/28/47/14/922284714.db2.gz FWYRGPUFWLOEMR-HSZRJFAPSA-N 0 3 405.586 4.090 20 0 HIADHN CCc1ccc([C@H](CNC(=O)Nc2cc3c(cc2SC)OCCO3)N(C)C)cc1 ZINC000513973575 922292655 /nfs/dbraw/zinc/29/26/55/922292655.db2.gz ZCYCCMXYGCQSGY-SFHVURJKSA-N 0 3 415.559 4.167 20 0 HIADHN CC(C)[C@H](NC(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1)c1nc2ccccc2[nH]1 ZINC000514068684 922391459 /nfs/dbraw/zinc/39/14/59/922391459.db2.gz NWOQYQGQSYTPKH-JUXOCIIHSA-N 0 3 405.546 4.395 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)N1CCC(c2ncccc2Cl)CC1 ZINC000562369467 945066345 /nfs/dbraw/zinc/06/63/45/945066345.db2.gz VPFHSYDXIYCLHP-UHFFFAOYSA-N 0 3 402.926 4.217 20 0 HIADHN CCOc1cccc([C@@H](C)NC(=O)NC[C@@H](c2cccc(OC)c2)N2CCCC2)c1 ZINC000514154320 922492036 /nfs/dbraw/zinc/49/20/36/922492036.db2.gz SBKUSWHTVMUONF-JPYJTQIMSA-N 0 3 411.546 4.291 20 0 HIADHN O=C(N[C@H]1CCN(Cc2ccccc2)C1)N[C@H]1CCCc2cc(OC(F)F)ccc21 ZINC000514159035 922496422 /nfs/dbraw/zinc/49/64/22/922496422.db2.gz ZAPUIERKEDLAIL-RXVVDRJESA-N 0 3 415.484 4.239 20 0 HIADHN C[C@@H](Cc1cccc(O)c1)NC(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1 ZINC000514182283 922522469 /nfs/dbraw/zinc/52/24/69/922522469.db2.gz JYHKFYWHUQQWFM-PXNSSMCTSA-N 0 3 401.576 4.157 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)NCC1(c2ccc(F)cc2)CCC1 ZINC000514193596 922533464 /nfs/dbraw/zinc/53/34/64/922533464.db2.gz RIMWFJWCMAYHNR-LJQANCHMSA-N 0 3 401.551 4.445 20 0 HIADHN COc1ccc(C(C)(C)CNC(=O)NC[C@@H](c2cccs2)N2CCCC2)cc1 ZINC000514197278 922535510 /nfs/dbraw/zinc/53/55/10/922535510.db2.gz LKDKSZZEDIIZGH-IBGZPJMESA-N 0 3 401.576 4.171 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)N1CC[C@H](C(F)(F)F)C2(CCC2)C1 ZINC000514201725 922539753 /nfs/dbraw/zinc/53/97/53/922539753.db2.gz LLOIKJSXKRAUCP-FQEVSTJZSA-N 0 3 423.523 4.170 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1)c1ccc(OC(F)F)cc1 ZINC000514214207 922549985 /nfs/dbraw/zinc/54/99/85/922549985.db2.gz LRFHIZNYHUFSKR-TXPKVOOTSA-N 0 3 403.473 4.484 20 0 HIADHN C[C@@H](NC(=O)NC[C@H](c1ccccc1)N(C)C)c1ccc(OCc2cccnc2)cc1 ZINC000514447038 922628795 /nfs/dbraw/zinc/62/87/95/922628795.db2.gz VUUIFLUOMIWPKX-NTKDMRAZSA-N 0 3 418.541 4.324 20 0 HIADHN CN(C)[C@@H](CNC(=O)NC[C@H](c1ccccc1Cl)N1CCCC1)c1ccsc1 ZINC000514458363 922635360 /nfs/dbraw/zinc/63/53/60/922635360.db2.gz NQUNHZPMYNVVAS-VQTJNVASSA-N 0 3 421.010 4.141 20 0 HIADHN O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCC(c2c[nH]c3ccccc32)CC1 ZINC000514564616 922702308 /nfs/dbraw/zinc/70/23/08/922702308.db2.gz MEBJIJFOPBYMDL-OAQYLSRUSA-N 0 3 402.542 4.331 20 0 HIADHN CSc1ccc([C@@H](CNC[C@H](O)C(F)(F)F)N2CCc3sccc3C2)cc1 ZINC000514700722 922764980 /nfs/dbraw/zinc/76/49/80/922764980.db2.gz LFAKDCPCHFEXAE-AEFFLSMTSA-N 0 3 416.534 4.082 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)c1ccc(C(=O)N(C)c2ccccc2)cc1)c1ccco1 ZINC000514750606 922782055 /nfs/dbraw/zinc/78/20/55/922782055.db2.gz XXWUPLTVHPNVEP-XMSQKQJNSA-N 0 3 419.525 4.415 20 0 HIADHN C[C@H]1[C@H](NC(=O)Cc2csc(-c3cccc(F)c3)n2)CCN1Cc1ccccc1 ZINC000514810512 922809305 /nfs/dbraw/zinc/80/93/05/922809305.db2.gz QAITUDTYHGKXJJ-HRAATJIYSA-N 0 3 409.530 4.271 20 0 HIADHN CC(C)[C@@H]1CN(c2nnc(-c3c[nH]c4ccccc34)n2Cc2cccs2)CCN1C ZINC000514827574 922817543 /nfs/dbraw/zinc/81/75/43/922817543.db2.gz SNLNFOXKHKOXOY-NRFANRHFSA-N 0 3 420.586 4.313 20 0 HIADHN O=C(CCC(F)(F)F)N1CCC[C@@H](NCc2ccc(-c3ccncc3)cc2F)C1 ZINC000514945961 922849242 /nfs/dbraw/zinc/84/92/42/922849242.db2.gz JOCBUCOPWZDKCI-GOSISDBHSA-N 0 3 409.427 4.311 20 0 HIADHN CCOc1ccccc1NC(=O)[C@H](C)N[C@@H]1CCN(C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000514976641 922862695 /nfs/dbraw/zinc/86/26/95/922862695.db2.gz WJDZEBWUXSOODW-ZKYUUJBMSA-N 0 3 419.928 4.240 20 0 HIADHN CCOc1c(OC)cc(CN2CCC[C@@H](c3nc(-c4ccccc4)n[nH]3)C2)cc1OC ZINC000515009294 922875457 /nfs/dbraw/zinc/87/54/57/922875457.db2.gz VPGIQCXHURWWEW-LJQANCHMSA-N 0 3 422.529 4.267 20 0 HIADHN CN1CCN(CCCCNc2ncnc3cc(-c4ccc(Cl)cc4)sc32)CC1 ZINC000515083395 922897258 /nfs/dbraw/zinc/89/72/58/922897258.db2.gz NTXQOVYVFPQFGY-UHFFFAOYSA-N 0 3 415.994 4.451 20 0 HIADHN O=C(CCc1ncc(-c2ccccc2F)o1)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000515196320 922984173 /nfs/dbraw/zinc/98/41/73/922984173.db2.gz OBLAYKUQVXBSBS-LJQANCHMSA-N 0 3 407.489 4.194 20 0 HIADHN O=C(Nc1ccc(Br)cc1Cl)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000515229607 923005692 /nfs/dbraw/zinc/00/56/92/923005692.db2.gz OPRRETCJYFBODD-OAHLLOKOSA-N 0 3 408.727 4.499 20 0 HIADHN COCCN(Cc1cccs1)C(=O)NC[C@H](c1cccs1)N1CCC(C)CC1 ZINC000515290640 923036746 /nfs/dbraw/zinc/03/67/46/923036746.db2.gz BIDBKOYJEWMUJC-LJQANCHMSA-N 0 3 421.632 4.441 20 0 HIADHN COc1cccc([C@@H](CNC(=O)Nc2ccccc2N2CCCC2)N2CCCC2)c1 ZINC000515384419 923073640 /nfs/dbraw/zinc/07/36/40/923073640.db2.gz DGSDFLGBQMXLFW-HSZRJFAPSA-N 0 3 408.546 4.254 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)N(C)Cc1ccc(OCC(F)(F)F)cc1 ZINC000515400380 923081292 /nfs/dbraw/zinc/08/12/92/923081292.db2.gz KQAKAFAIYNHURO-QGZVFWFLSA-N 0 3 423.479 4.290 20 0 HIADHN CN(Cc1cc(Br)cs1)C[C@@H](O)COCc1ccccc1Cl ZINC000515410944 923088334 /nfs/dbraw/zinc/08/83/34/923088334.db2.gz PTTJAAALEQASJR-CQSZACIVSA-N 0 3 404.757 4.174 20 0 HIADHN Cc1ccc(-c2csc3ncnc(N4CCC(CN5CCOCC5)CC4)c23)cc1 ZINC000515481017 923127625 /nfs/dbraw/zinc/12/76/25/923127625.db2.gz VERYRHNNHMWDJY-UHFFFAOYSA-N 0 3 408.571 4.215 20 0 HIADHN CCc1ccc([C@H](C)NC(=O)[C@H](C)N[C@H](C)c2ccc(NC(=O)NC3CC3)cc2)cc1 ZINC000515517120 923147252 /nfs/dbraw/zinc/14/72/52/923147252.db2.gz FHNHYAARYHTGCE-SQNIBIBYSA-N 0 3 422.573 4.449 20 0 HIADHN Cc1sc(-c2ccco2)nc1C(=O)NCCCCN1CCN(c2ccccc2)CC1 ZINC000515598249 923206372 /nfs/dbraw/zinc/20/63/72/923206372.db2.gz KOWGDMKHFZCPBV-UHFFFAOYSA-N 0 3 424.570 4.044 20 0 HIADHN CCOC(=O)c1c2c(sc1NC(=O)[C@H](C)OCC(C)C)C(C)(C)NC(C)(C)C2 ZINC000515599601 923208124 /nfs/dbraw/zinc/20/81/24/923208124.db2.gz GNMCABSPPYXBAR-ZDUSSCGKSA-N 0 3 410.580 4.084 20 0 HIADHN Cc1ccc(-c2nnc(N3CCCN(Cc4ccc(C(F)(F)F)cc4)CC3)n2C)o1 ZINC000515712399 923293186 /nfs/dbraw/zinc/29/31/86/923293186.db2.gz VHMJYDVWSYRGOW-UHFFFAOYSA-N 0 3 419.451 4.115 20 0 HIADHN Cc1cc(NC(=O)N2CC(C)(C)[C@@H]2C2CC2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000515716020 923297822 /nfs/dbraw/zinc/29/78/22/923297822.db2.gz BEDZOVGDKXSLFO-UNMCSNQZSA-N 0 3 407.562 4.291 20 0 HIADHN O=S(=O)(NCc1ccccc1CN1CCCC1)c1ccc(-c2ccccc2)cc1 ZINC000515725143 923306509 /nfs/dbraw/zinc/30/65/09/923306509.db2.gz FTHNYOGIQQZIMS-UHFFFAOYSA-N 0 3 406.551 4.428 20 0 HIADHN CC(C)(C)CCN1CCN(C(=O)Nc2ccc(OC(F)F)cc2OC(F)F)CC1 ZINC000515773298 923341290 /nfs/dbraw/zinc/34/12/90/923341290.db2.gz DWUXWYQMYISTRL-UHFFFAOYSA-N 0 3 421.435 4.475 20 0 HIADHN CC1CCN([C@H](CNC(=O)c2ccc(Cn3ccnc3)cc2)c2ccccc2)CC1 ZINC000515987491 923482582 /nfs/dbraw/zinc/48/25/82/923482582.db2.gz ICFCSYGIYAZGGB-XMMPIXPASA-N 0 3 402.542 4.134 20 0 HIADHN CN(C)Cc1cccc(NC(=O)C(=O)N2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)c1 ZINC000516024225 923507019 /nfs/dbraw/zinc/50/70/19/923507019.db2.gz KVTVPFUVKUWKBP-LJQANCHMSA-N 0 3 420.340 4.357 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cnn(-c2ccc(F)cc2F)c1C)c1ccsc1 ZINC000516179718 923589722 /nfs/dbraw/zinc/58/97/22/923589722.db2.gz SQSKBUIEJBSNOI-HXUWFJFHSA-N 0 3 418.513 4.333 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)N2CCC(COc3ccccc3)CC2)C1 ZINC000516223611 923612739 /nfs/dbraw/zinc/61/27/39/923612739.db2.gz ROHPVAOOUZRBPD-REWPJTCUSA-N 0 3 407.558 4.323 20 0 HIADHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)NCc1cccc(Cl)c1 ZINC000516232203 923618878 /nfs/dbraw/zinc/61/88/78/923618878.db2.gz MMPWAKSVEIIEIJ-UHFFFAOYSA-N 0 3 424.770 4.376 20 0 HIADHN O=C(N[C@@H]1CCN(C2CC2)C1)c1cn(Cc2ccccc2)nc1-c1ccc(Cl)cc1 ZINC000516336049 923673287 /nfs/dbraw/zinc/67/32/87/923673287.db2.gz DBCSTAJRGGYEPA-HXUWFJFHSA-N 0 3 420.944 4.218 20 0 HIADHN CCCCOc1ccc(NC(=O)NCc2ccc(CN3CCN(C)CC3)cc2)c(C)c1 ZINC000516469384 923747868 /nfs/dbraw/zinc/74/78/68/923747868.db2.gz SACJMDYTKNYKSJ-UHFFFAOYSA-N 0 3 424.589 4.243 20 0 HIADHN FC(F)(F)Cn1ccnc1CNCCc1c[nH]c2cccc(Br)c12 ZINC000516516669 923773359 /nfs/dbraw/zinc/77/33/59/923773359.db2.gz YEAJJNDVTHZMSB-UHFFFAOYSA-N 0 3 401.230 4.022 20 0 HIADHN Cc1nccn1CCCN(C)Cc1cc(Br)cc(C)c1OC(F)F ZINC000516559269 923796087 /nfs/dbraw/zinc/79/60/87/923796087.db2.gz NNJSRQIHVYUJPN-UHFFFAOYSA-N 0 3 402.283 4.386 20 0 HIADHN Cc1ccc(CNC(=O)N(CCN(C)C)Cc2ccc(Br)cc2)s1 ZINC000516662648 923833698 /nfs/dbraw/zinc/83/36/98/923833698.db2.gz JISPZIFZCLEGAT-UHFFFAOYSA-N 0 3 410.381 4.092 20 0 HIADHN Cn1cc(NC(=O)[C@H]2CN(Cc3ccccc3)CCC2(F)F)c(-c2ccccc2)n1 ZINC000516931172 923939849 /nfs/dbraw/zinc/93/98/49/923939849.db2.gz OXLJIXMGSQOYGC-LJQANCHMSA-N 0 3 410.468 4.183 20 0 HIADHN C[C@H]1CCCN(CCNC(=O)c2ccccc2SCc2cn3ccccc3n2)C1 ZINC000517085164 923988878 /nfs/dbraw/zinc/98/88/78/923988878.db2.gz QOOGQYICMLXSPI-SFHVURJKSA-N 0 3 408.571 4.088 20 0 HIADHN COC1CCN(C(C)(C)CNC(=O)c2csc(-c3ccc(Cl)s3)n2)CC1 ZINC000517405597 924161218 /nfs/dbraw/zinc/16/12/18/924161218.db2.gz SCSHRYLCARDPPG-UHFFFAOYSA-N 0 3 413.996 4.144 20 0 HIADHN COc1cc(CNC[C@@H](c2c(F)cccc2Cl)N2CCCC2)cc2c1OCO2 ZINC000517538114 924252524 /nfs/dbraw/zinc/25/25/24/924252524.db2.gz KCXCLGGHJCSTIJ-KRWDZBQOSA-N 0 3 406.885 4.143 20 0 HIADHN COc1ccc2ccccc2c1CNC(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000517539111 924253880 /nfs/dbraw/zinc/25/38/80/924253880.db2.gz FNFLOHGOANVQTB-RXVVDRJESA-N 0 3 403.526 4.483 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N[C@@H](c2ccc3c(c2)OCCO3)C2CC2)C1 ZINC000517543444 924255830 /nfs/dbraw/zinc/25/58/30/924255830.db2.gz RTJWECSLHRJQIF-QATBIIFWSA-N 0 3 421.541 4.044 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@H](C)NCc2cnc(-c3ccccc3)nc2)CC1 ZINC000517547118 924258436 /nfs/dbraw/zinc/25/84/36/924258436.db2.gz HJLJKCAUGDNHMV-IBGZPJMESA-N 0 3 419.548 4.275 20 0 HIADHN CCc1ccc([C@H](CNC(=O)Nc2ccc(NC(C)=O)cc2Cl)N(C)C)cc1 ZINC000517573354 926686739 /nfs/dbraw/zinc/68/67/39/926686739.db2.gz ZMVWEWDJAPYNGO-FQEVSTJZSA-N 0 3 402.926 4.285 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)NCC(C)(C)N2CCc3ccccc3C2)c(Cl)c1 ZINC000517572280 926687887 /nfs/dbraw/zinc/68/78/87/926687887.db2.gz HOYDVNVOMGLVTH-UHFFFAOYSA-N 0 3 414.937 4.257 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)c1[nH]c2ccc(F)cc2c1Cl ZINC000517601697 926710423 /nfs/dbraw/zinc/71/04/23/926710423.db2.gz WBKQAQAHUVQVRA-QGZVFWFLSA-N 0 3 414.912 4.482 20 0 HIADHN CC(=O)CCc1ccc(OCc2cccc(C(=O)N(C)[C@H]3CCN(C4CC4)C3)c2)cc1 ZINC000517647212 926755156 /nfs/dbraw/zinc/75/51/56/926755156.db2.gz ACGHRDFIAHXVQL-DEOSSOPVSA-N 0 3 420.553 4.096 20 0 HIADHN CCN1CCCC[C@@H]1CNC(=O)c1cnn(-c2cccc(C(F)(F)F)c2)c1C1CC1 ZINC000517675507 926780472 /nfs/dbraw/zinc/78/04/72/926780472.db2.gz RJIATXHAHUKSEB-GOSISDBHSA-N 0 3 420.479 4.373 20 0 HIADHN O=C([C@@H](Sc1ccc(F)c(F)c1)c1ccccc1)N1CC[C@@H](N2CCCC2)C1 ZINC000517990326 926934111 /nfs/dbraw/zinc/93/41/11/926934111.db2.gz AKEHQIBAELNDAN-UTKZUKDTSA-N 0 3 402.510 4.495 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)NCc1ccc(Br)cc1 ZINC000518040201 926977994 /nfs/dbraw/zinc/97/79/94/926977994.db2.gz AQBJGCXZNURSEC-UHFFFAOYSA-N 0 3 424.770 4.376 20 0 HIADHN Cc1cc(NC(=O)c2cccc(F)c2)sc1C(=O)NC[C@H](C)N1CCC[C@@H](C)C1 ZINC000518054138 926990698 /nfs/dbraw/zinc/99/06/98/926990698.db2.gz OKLFSHODRFKQCL-ZBFHGGJFSA-N 0 3 417.550 4.298 20 0 HIADHN CC1CCC(OC2CCN(C(=O)NCC3(N4CCSCC4)CCCC3)CC2)CC1 ZINC000518164851 927057957 /nfs/dbraw/zinc/05/79/57/927057957.db2.gz GGIRRTSUAXQDRG-UHFFFAOYSA-N 0 3 423.667 4.117 20 0 HIADHN CN(C[C@@H]1CCCN(Cc2ccc(-c3ccc(Cl)cc3)s2)C1)S(C)(=O)=O ZINC000518258834 927117279 /nfs/dbraw/zinc/11/72/79/927117279.db2.gz YLILPFGZZHGXHI-HNNXBMFYSA-N 0 3 413.008 4.172 20 0 HIADHN COc1cccc(CNC[C@H](c2cccc(Cl)c2)N2CCOCC2)c1OC(C)C ZINC000518275839 927132939 /nfs/dbraw/zinc/13/29/39/927132939.db2.gz SWUUGMXYYWLPLL-OAQYLSRUSA-N 0 3 418.965 4.299 20 0 HIADHN CC1CCN([C@H](CNC(=O)Nc2cccnc2N2CCCC2)c2ccccc2)CC1 ZINC000518338582 927202807 /nfs/dbraw/zinc/20/28/07/927202807.db2.gz OBDUEVIMRRXVOZ-JOCHJYFZSA-N 0 3 407.562 4.277 20 0 HIADHN Cc1ccc(-c2noc([C@@H](C)NC[C@@H]3CN(Cc4ccccc4)CCCO3)n2)cc1F ZINC000518348990 927213319 /nfs/dbraw/zinc/21/33/19/927213319.db2.gz KCXWJXRVSMSCLE-WIYYLYMNSA-N 0 3 424.520 4.126 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)N1CCCCC[C@H]1c1ccncc1 ZINC000518357256 927217727 /nfs/dbraw/zinc/21/77/27/927217727.db2.gz LJZFHYFNBJGIIR-DEOSSOPVSA-N 0 3 406.574 4.128 20 0 HIADHN CN(Cc1cccc(Br)c1)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000518357033 927218091 /nfs/dbraw/zinc/21/80/91/927218091.db2.gz SVLPKOWGGLLECQ-FQEVSTJZSA-N 0 3 416.363 4.255 20 0 HIADHN CN(Cc1cccc2ccccc21)C(=O)CCCN1CCN(c2ccccc2)CC1 ZINC000518358576 927219754 /nfs/dbraw/zinc/21/97/54/927219754.db2.gz XFBKJPHPNKHDEK-UHFFFAOYSA-N 0 3 401.554 4.401 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)N(C)CCOc2ccccc2Cl)C1 ZINC000518406995 927247299 /nfs/dbraw/zinc/24/72/99/927247299.db2.gz UFHXOLCPBSSYLF-PKOBYXMFSA-N 0 3 401.938 4.196 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N(Cc2cccs2)C[C@H]2CCCO2)C1 ZINC000518410362 927250859 /nfs/dbraw/zinc/25/08/59/927250859.db2.gz OARMBNWXJQZMFL-HLAWJBBLSA-N 0 3 413.587 4.274 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)NCc2ccc(OC(F)(F)F)cc2)C1 ZINC000518409643 927251009 /nfs/dbraw/zinc/25/10/09/927251009.db2.gz LGSVUCCWMFKLCK-CRAIPNDOSA-N 0 3 407.436 4.220 20 0 HIADHN CC(C)Oc1ccc([C@H](C)NC(=O)N(CCN(C)C)Cc2ccccc2F)cc1 ZINC000518409990 927251091 /nfs/dbraw/zinc/25/10/91/927251091.db2.gz ZJHXWVPGDIKZBN-SFHVURJKSA-N 0 3 401.526 4.447 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3cccc4cnccc43)c(OCC)c2)CC1 ZINC000518433992 927267109 /nfs/dbraw/zinc/26/71/09/927267109.db2.gz ZNVFAJWTLBEJTB-UHFFFAOYSA-N 0 3 418.541 4.418 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)NC[C@@H](C)N(C)Cc2ccccc2)cc1OC ZINC000518441393 927273532 /nfs/dbraw/zinc/27/35/32/927273532.db2.gz IWUYJMJADIFFMX-NQIIRXRSSA-N 0 3 411.546 4.071 20 0 HIADHN C[C@H](NC(=O)NC[C@@H](c1ccccc1)N(C)C)c1ccc(OCC(F)(F)F)cc1 ZINC000518629248 927389181 /nfs/dbraw/zinc/38/91/81/927389181.db2.gz RPKPQGUIODIMDP-KXBFYZLASA-N 0 3 409.452 4.291 20 0 HIADHN COc1cc(Br)c(CN[C@H]2CCN([C@@H](C)c3ccccc3)C2)cc1OC ZINC000518774659 927487001 /nfs/dbraw/zinc/48/70/01/927487001.db2.gz ZFQITGPBUXPGDZ-YJBOKZPZSA-N 0 3 419.363 4.391 20 0 HIADHN Clc1ccccc1-c1cc(-c2nc(-c3ccc(CN4CCOCC4)cc3)no2)[nH]n1 ZINC000518875213 927584745 /nfs/dbraw/zinc/58/47/45/927584745.db2.gz NFXASQLEXQBQHC-UHFFFAOYSA-N 0 3 421.888 4.279 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1ccc(NC(C)=O)cc1)c1ccc(C(F)(F)F)cc1 ZINC000518892109 927601865 /nfs/dbraw/zinc/60/18/65/927601865.db2.gz GPCIIAJBSVVVMN-HXUWFJFHSA-N 0 3 421.463 4.477 20 0 HIADHN CC(C)(CNC(=O)c1ccc(OCC(F)(F)F)cc1)N1CCc2ccccc2C1 ZINC000518960570 927659962 /nfs/dbraw/zinc/65/99/62/927659962.db2.gz CIEHKMLCKMAXJP-UHFFFAOYSA-N 0 3 406.448 4.194 20 0 HIADHN COc1cccc(COC[C@H](O)CN2CCC[C@@H]2Cc2c(F)cccc2Cl)c1 ZINC000519000273 927682973 /nfs/dbraw/zinc/68/29/73/927682973.db2.gz CFPABCCJRGNBMJ-QZTJIDSGSA-N 0 3 407.913 4.072 20 0 HIADHN COC(=O)c1cc(CN[C@H](C)c2ccc(NC(=O)c3ccc(F)cc3)cc2)cn1C ZINC000519037247 927713121 /nfs/dbraw/zinc/71/31/21/927713121.db2.gz WPKHZJFOJKAAHJ-OAHLLOKOSA-N 0 3 409.461 4.054 20 0 HIADHN CC(C)(CNC(=O)N(Cc1ccccc1)C[C@H]1CCCO1)N1CCc2ccccc2C1 ZINC000519044217 927718995 /nfs/dbraw/zinc/71/89/95/927718995.db2.gz MPWWUGYWKKHIKN-XMMPIXPASA-N 0 3 421.585 4.214 20 0 HIADHN COc1ccc([C@@H](Cc2ccc(F)cc2)N[C@@H](C)C(=O)NCCc2ccccc2)cc1 ZINC000519064329 927742067 /nfs/dbraw/zinc/74/20/67/927742067.db2.gz WCSMVBIRHIQBAI-UQBPGWFLSA-N 0 3 420.528 4.455 20 0 HIADHN O=C(Nc1ccc(OCc2ccncc2)cc1)N1CCCN(Cc2ccccc2)CC1 ZINC000519196772 927821556 /nfs/dbraw/zinc/82/15/56/927821556.db2.gz SSHMTBVJFHYJJZ-UHFFFAOYSA-N 0 3 416.525 4.400 20 0 HIADHN COCc1cccc2sc(NC(=O)NC[C@@H](c3ccccc3)N3CCCC3)nc21 ZINC000519195570 927821765 /nfs/dbraw/zinc/82/17/65/927821765.db2.gz IYPLLKIPBVOTDR-SFHVURJKSA-N 0 3 410.543 4.401 20 0 HIADHN COCc1cccc2sc(NC(=O)N3CCN(CC4CCCCC4)CC3)nc21 ZINC000519199293 927823510 /nfs/dbraw/zinc/82/35/10/927823510.db2.gz WNEWEANOFXFCKJ-UHFFFAOYSA-N 0 3 402.564 4.173 20 0 HIADHN Cc1ccc(CN(C)C[C@@H](O)COc2ccc(Cl)cc2Br)s1 ZINC000519284188 927863021 /nfs/dbraw/zinc/86/30/21/927863021.db2.gz HGDDMWPYBZEEDL-CYBMUJFWSA-N 0 3 404.757 4.344 20 0 HIADHN Cc1nn(Cc2ccc(C)cc2)c(C)c1CCC(=O)NCCN(C)Cc1ccccc1 ZINC000519299399 927870089 /nfs/dbraw/zinc/87/00/89/927870089.db2.gz NBLRZWBTRLBOIT-UHFFFAOYSA-N 0 3 418.585 4.037 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)NCc2ccc(COCC(F)(F)F)cc2)N(C)C)cc1 ZINC000519343608 927890931 /nfs/dbraw/zinc/89/09/31/927890931.db2.gz CRIHZIHZYARNGU-HXUWFJFHSA-N 0 3 423.479 4.176 20 0 HIADHN CCOc1cc2c(cc1[C@@H]1C[C@H]1NC(=O)c1cccc(CN3CCCC3)c1)O[C@H](C)C2 ZINC000519365316 927897820 /nfs/dbraw/zinc/89/78/20/927897820.db2.gz WOOIHFVVICEOKG-FRGLQRNOSA-N 0 3 420.553 4.290 20 0 HIADHN Cc1ccc(NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)cc1C(=O)NC(C)C ZINC000519487853 927984030 /nfs/dbraw/zinc/98/40/30/927984030.db2.gz GPJZLTRZVZBNAR-LJQANCHMSA-N 0 3 411.521 4.123 20 0 HIADHN COc1ccc(CN[C@@H](Cc2ccccc2)C(=O)NCc2ccccc2)c(C)c1OC ZINC000519559127 928015580 /nfs/dbraw/zinc/01/55/80/928015580.db2.gz PSQPPOHCQQFYCW-QHCPKHFHSA-N 0 3 418.537 4.030 20 0 HIADHN COc1cccc([C@@H](CNC(=O)Nc2cc(-c3nnco3)ccc2C)N2CCCC2)c1 ZINC000519567688 928018457 /nfs/dbraw/zinc/01/84/57/928018457.db2.gz LIEZJTCGESABJT-OAQYLSRUSA-N 0 3 421.501 4.012 20 0 HIADHN CN(C(=O)CN1CCCC2(CCOCC2)C1)[C@H](c1ccccc1)c1ccc(F)cc1 ZINC000519617784 928029455 /nfs/dbraw/zinc/02/94/55/928029455.db2.gz WCXLTRRVVZSQJP-XMMPIXPASA-N 0 3 410.533 4.266 20 0 HIADHN Cc1cc(C(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)c(C)n1Cc1ccncc1 ZINC000519629830 928032157 /nfs/dbraw/zinc/03/21/57/928032157.db2.gz PUDJKQANOUGUCX-QFIPXVFZSA-N 0 3 410.949 4.234 20 0 HIADHN CCCN(C(=O)NCc1ccc2cnn(C)c2c1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000519852784 928097746 /nfs/dbraw/zinc/09/77/46/928097746.db2.gz SYAMRAUBUJSMJD-HSZRJFAPSA-N 0 3 419.573 4.160 20 0 HIADHN CCCN(C(=O)NCc1ccc2cnn(C)c2c1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000519852790 928097860 /nfs/dbraw/zinc/09/78/60/928097860.db2.gz SYAMRAUBUJSMJD-QHCPKHFHSA-N 0 3 419.573 4.160 20 0 HIADHN CN(C)C(=O)C1(CNCc2cc(C(F)(F)F)ccc2Br)CCCC1 ZINC000519857630 928100446 /nfs/dbraw/zinc/10/04/46/928100446.db2.gz KBNMRFAYXWNCHU-UHFFFAOYSA-N 0 3 407.274 4.206 20 0 HIADHN CCCN(C(=O)NCc1ccc(CN2CCN(C)CC2)cc1)[C@@H]1CCc2ccccc21 ZINC000519897227 928133419 /nfs/dbraw/zinc/13/34/19/928133419.db2.gz WNSGUBLNKZEOPR-RUZDIDTESA-N 0 3 420.601 4.043 20 0 HIADHN CN(C)CCN(C(=O)c1ccc(-c2ccc3c(c2)OCCO3)s1)c1ccccc1 ZINC000519901265 928136692 /nfs/dbraw/zinc/13/66/92/928136692.db2.gz FWZOOSBSCFNMHU-UHFFFAOYSA-N 0 3 408.523 4.395 20 0 HIADHN CC[C@@H](c1ccccc1)N(CC)CC(=O)N1CCC(C(=O)Nc2ccccc2)CC1 ZINC000519909392 928144123 /nfs/dbraw/zinc/14/41/23/928144123.db2.gz VNVFGMZLBQPDEF-QHCPKHFHSA-N 0 3 407.558 4.337 20 0 HIADHN Cc1c(C(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)cnn1-c1ccc(C)cc1 ZINC000519936683 928172366 /nfs/dbraw/zinc/17/23/66/928172366.db2.gz OIBIDFHNZSJUQH-XMMPIXPASA-N 0 3 402.542 4.364 20 0 HIADHN Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)NC[C@H](c1ccccc1)N(C)C ZINC000519957819 928187097 /nfs/dbraw/zinc/18/70/97/928187097.db2.gz BOENOBAPLBLJBU-JOCHJYFZSA-N 0 3 408.546 4.092 20 0 HIADHN COc1ccc(COC[C@H](O)CN2CCC[C@H]2Cc2c(F)cccc2Cl)cc1 ZINC000519968419 928196575 /nfs/dbraw/zinc/19/65/75/928196575.db2.gz DIQUZODESCLWPY-ZWKOTPCHSA-N 0 3 407.913 4.072 20 0 HIADHN CC[C@@H](C)NC(=O)c1ccc(NC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)c(C)c1 ZINC000519988325 928216145 /nfs/dbraw/zinc/21/61/45/928216145.db2.gz NJMPHHWUOJIJJR-KNQAVFIVSA-N 0 3 422.573 4.309 20 0 HIADHN CN(C)[C@H](CNC(=O)N(Cc1cccc(Br)c1)C1CC1)c1ccccc1 ZINC000520055405 928280465 /nfs/dbraw/zinc/28/04/65/928280465.db2.gz OPPMNSRLQQFUNT-HXUWFJFHSA-N 0 3 416.363 4.426 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)NCc1coc(-c2cccs2)n1 ZINC000520058240 928282459 /nfs/dbraw/zinc/28/24/59/928282459.db2.gz WLDWVKNUOVZUDG-UHFFFAOYSA-N 0 3 412.559 4.109 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)N[C@H]1CCOc2c(Cl)cccc21 ZINC000520058137 928282728 /nfs/dbraw/zinc/28/27/28/928282728.db2.gz QFWORWNBGROJBD-NRFANRHFSA-N 0 3 415.965 4.370 20 0 HIADHN C[C@@H](CNC(=O)c1cccnc1SCc1ccc(F)cc1)N1CCC(C)CC1 ZINC000520065514 928289103 /nfs/dbraw/zinc/28/91/03/928289103.db2.gz HCIYBJNOEMFPIH-KRWDZBQOSA-N 0 3 401.551 4.363 20 0 HIADHN C[C@H](NC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1)c1cccc(N2CCCC2=O)c1 ZINC000520109662 928317118 /nfs/dbraw/zinc/31/71/18/928317118.db2.gz XHJMHXQQNGTODM-RXVVDRJESA-N 0 3 423.532 4.042 20 0 HIADHN Cc1ccccc1C1(CNC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)CCOCC1 ZINC000520109568 928317387 /nfs/dbraw/zinc/31/73/87/928317387.db2.gz KUQJEJUIDYKUHV-JOCHJYFZSA-N 0 3 424.560 4.211 20 0 HIADHN CCN(C(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1)[C@@H](C)Cc1ccc(OC)cc1 ZINC000520196965 928382258 /nfs/dbraw/zinc/38/22/58/928382258.db2.gz LVTGOSOOKWHCMD-SXWKCWPCSA-N 0 3 409.574 4.493 20 0 HIADHN Cc1cccc(C[C@@H](NCc2csc(CNC(=O)c3ccccc3)n2)C2CC2)c1 ZINC000520236316 928405103 /nfs/dbraw/zinc/40/51/03/928405103.db2.gz TYLWKZJDOUJZHG-JOCHJYFZSA-N 0 3 405.567 4.492 20 0 HIADHN C[C@@H](NC[C@H]1CC[C@@H](c2nc(C3CC3)no2)O1)c1cc(Br)ccc1F ZINC000520262403 928426965 /nfs/dbraw/zinc/42/69/65/928426965.db2.gz AEYAQHNBVOEZEG-ZXIHIIQKSA-N 0 3 410.287 4.420 20 0 HIADHN COc1ccccc1NC(=O)[C@@H](C)N(C)CCCc1cc(-c2cccc(F)c2)n[nH]1 ZINC000520288064 928450211 /nfs/dbraw/zinc/45/02/11/928450211.db2.gz WZLIKZJNTIKORN-MRXNPFEDSA-N 0 3 410.493 4.116 20 0 HIADHN C[C@@H](Oc1ccc2c(c1)CCC2)C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000520302165 928465020 /nfs/dbraw/zinc/46/50/20/928465020.db2.gz CNYBDCWESXWVGB-GOSISDBHSA-N 0 3 410.583 4.173 20 0 HIADHN C[C@@H](CNC(=O)C1CCN(c2nc3ccccc3s2)CC1)N(C)Cc1ccccc1 ZINC000520328080 928493282 /nfs/dbraw/zinc/49/32/82/928493282.db2.gz JSWGRWQUEQEQBB-SFHVURJKSA-N 0 3 422.598 4.149 20 0 HIADHN COc1cccc(CN(CCC(=O)N[C@@H]2CCCc3ccccc32)C[C@H]2CCCO2)c1 ZINC000520392078 928544961 /nfs/dbraw/zinc/54/49/61/928544961.db2.gz JDSYTZKSWAVVDJ-ILBGXUMGSA-N 0 3 422.569 4.260 20 0 HIADHN C[C@H](N[C@@H]1CCN(C(C)(C)C)[C@@H]1c1ccc(Cl)c(F)c1)C(=O)Nc1nccs1 ZINC000520433247 928562181 /nfs/dbraw/zinc/56/21/81/928562181.db2.gz NCLUHGTVGZBXDV-JCURWCKSSA-N 0 3 424.973 4.466 20 0 HIADHN CCCOCc1ccccc1CNC(=O)NCC(C)(C)N1CCc2ccccc2C1 ZINC000520540197 928628092 /nfs/dbraw/zinc/62/80/92/928628092.db2.gz TZQNYJZCHSTFRI-UHFFFAOYSA-N 0 3 409.574 4.249 20 0 HIADHN CC[C@@H](C)NC(=O)c1ccc(NC(=O)NC[C@H](c2ccccc2)N2CCCC2)c(C)c1 ZINC000520597844 928662499 /nfs/dbraw/zinc/66/24/99/928662499.db2.gz HQGIOBUGUAIJDI-AUSIDOKSSA-N 0 3 422.573 4.482 20 0 HIADHN CCN(CC(=O)N1N=C(c2cccs2)C[C@@H]1c1ccco1)[C@H]1CCOC(C)(C)C1 ZINC000520664803 928708979 /nfs/dbraw/zinc/70/89/79/928708979.db2.gz AFTZVASAOVWSEZ-FUHWJXTLSA-N 0 3 415.559 4.298 20 0 HIADHN COC(=O)c1c(C)c(C)sc1NC(=O)N(CCN(C)C)Cc1cccc(Cl)c1 ZINC000520854260 928845520 /nfs/dbraw/zinc/84/55/20/928845520.db2.gz JLOLFFOKQGCXIR-UHFFFAOYSA-N 0 3 423.966 4.401 20 0 HIADHN CCOC(=O)c1cnn(C2CCN(Cc3cccc(OC(F)(F)F)c3)CC2)c1C ZINC000520893229 928862941 /nfs/dbraw/zinc/86/29/41/928862941.db2.gz POWMOGSELOPDAK-UHFFFAOYSA-N 0 3 411.424 4.104 20 0 HIADHN COc1ccc(CN(C(=O)NCCCN2CCc3ccccc3C2)[C@H](C)C2CC2)cc1 ZINC000520909298 928869294 /nfs/dbraw/zinc/86/92/94/928869294.db2.gz NJVDFGKPJZOCTH-HXUWFJFHSA-N 0 3 421.585 4.454 20 0 HIADHN COCCCN(C(=O)c1cc(C)c(-c2ccc(F)cc2)s1)C1CCN(C)CC1 ZINC000520909683 928869368 /nfs/dbraw/zinc/86/93/68/928869368.db2.gz JHVHYNPGEADMPI-UHFFFAOYSA-N 0 3 404.551 4.436 20 0 HIADHN c1cc2c(s1)CCN([C@H](CNCc1cccc3c1OCCO3)c1ccccc1)C2 ZINC000520949833 928885786 /nfs/dbraw/zinc/88/57/86/928885786.db2.gz SLIIJJMJIBNUGK-OAQYLSRUSA-N 0 3 406.551 4.409 20 0 HIADHN O=C(Nc1cccc(Oc2cnccn2)c1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000520952590 928887664 /nfs/dbraw/zinc/88/76/64/928887664.db2.gz XHUALSSRTURNBE-GOSISDBHSA-N 0 3 406.461 4.259 20 0 HIADHN COc1cc(CN[C@H]2CCc3c2cccc3C)cc(I)c1OC ZINC000520959396 928890571 /nfs/dbraw/zinc/89/05/71/928890571.db2.gz GVLCDLBCSAVLDC-KRWDZBQOSA-N 0 3 423.294 4.394 20 0 HIADHN CC[C@H](C)[C@H](NCc1ccc2[nH]cnc2c1)C(=O)Nc1cccc(N2CCCC2)c1 ZINC000520964028 928892141 /nfs/dbraw/zinc/89/21/41/928892141.db2.gz ABDPAJLEMRUMDO-SBUREZEXSA-N 0 3 405.546 4.306 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)NC[C@@H]3CCC[N@@H+]3CC3CCCCC3)cc2)cc(=O)[n-]1 ZINC000520971669 928897223 /nfs/dbraw/zinc/89/72/23/928897223.db2.gz SQKJPZSSNLZVKA-NRFANRHFSA-N 0 3 423.561 4.324 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)NC[C@@H]3CCC[N@H+]3CC3CCCCC3)cc2)cc(=O)[n-]1 ZINC000520971669 928897225 /nfs/dbraw/zinc/89/72/25/928897225.db2.gz SQKJPZSSNLZVKA-NRFANRHFSA-N 0 3 423.561 4.324 20 0 HIADHN CC(C)Oc1ccc([C@@H](C)NC(=O)N(C)C2CCN(CCc3ccccn3)CC2)cc1 ZINC000521006037 928921687 /nfs/dbraw/zinc/92/16/87/928921687.db2.gz FXXKGHIFDNQXPA-HXUWFJFHSA-N 0 3 424.589 4.278 20 0 HIADHN COC(=O)c1cccc(NC(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)c1 ZINC000521074450 928975172 /nfs/dbraw/zinc/97/51/72/928975172.db2.gz VHPRDQOAMWVSFQ-UHFFFAOYSA-N 0 3 423.435 4.088 20 0 HIADHN Cc1ccccc1-c1cc(C(=O)N(C)[C@H]2CCN(C3CC3)C2)c2cnn(C(C)C)c2n1 ZINC000521082367 928981049 /nfs/dbraw/zinc/98/10/49/928981049.db2.gz ZNZNVRWJKCBVRR-IBGZPJMESA-N 0 3 417.557 4.296 20 0 HIADHN COCCOc1ccc(C(=O)N(CCN2CCCC2)Cc2ccc(Cl)cc2)cc1 ZINC000521137328 929018013 /nfs/dbraw/zinc/01/80/13/929018013.db2.gz MXJBYTSCYDKQOR-UHFFFAOYSA-N 0 3 416.949 4.103 20 0 HIADHN COc1cc(OC)c(CCNCc2cc(Cl)cc(Cl)c2OC)c(OC)c1 ZINC000521338356 929153556 /nfs/dbraw/zinc/15/35/56/929153556.db2.gz DMIDEBZTRVITIG-UHFFFAOYSA-N 0 3 400.302 4.360 20 0 HIADHN CCN1CCCC[C@@H]1CNC(=O)c1oc2ccccc2c1CSc1ncccn1 ZINC000521357605 929177625 /nfs/dbraw/zinc/17/76/25/929177625.db2.gz WSXIWZRZLHKPCC-MRXNPFEDSA-N 0 3 410.543 4.119 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2ccccc2CN2C[C@H](C)O[C@@H](C)C2)N(C)C)cc1 ZINC000521463269 929232809 /nfs/dbraw/zinc/23/28/09/929232809.db2.gz IKOYODMOWQTFKZ-SKPFHBQLSA-N 0 3 424.589 4.029 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N[C@H](C)CCc3ccc(OC)cc3)c(C)c2)CC1 ZINC000521466500 929234417 /nfs/dbraw/zinc/23/44/17/929234417.db2.gz ZIQRVOSSBOYKSW-HXUWFJFHSA-N 0 3 424.589 4.288 20 0 HIADHN OC1(Cc2ccc(OC(F)(F)F)cc2)CCN(Cc2ccc3c(c2)CCO3)CC1 ZINC000521514414 929267742 /nfs/dbraw/zinc/26/77/42/929267742.db2.gz XOVRUQTYZYOBRX-UHFFFAOYSA-N 0 3 407.432 4.090 20 0 HIADHN Cn1c2ccccc2cc(CN(CCc2ccccn2)Cc2ccc(F)cc2)c1=O ZINC000521529651 929277396 /nfs/dbraw/zinc/27/73/96/929277396.db2.gz OBGVFVDCNDLEPY-UHFFFAOYSA-N 0 3 401.485 4.318 20 0 HIADHN O=C(NC[C@@H]1CCCCO1)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000521602456 929323185 /nfs/dbraw/zinc/32/31/85/929323185.db2.gz DOFJRLDCUXVMSK-KRWDZBQOSA-N 0 3 414.377 4.170 20 0 HIADHN O=C(Cc1sc(-c2ccccc2)nc1-c1cccs1)N[C@H]1CCN(C2CC2)C1 ZINC000521677716 929361124 /nfs/dbraw/zinc/36/11/24/929361124.db2.gz LNUKUZHHXMSBPR-INIZCTEOSA-N 0 3 409.580 4.434 20 0 HIADHN COC1CCN(C(C)(C)CNC(=O)c2csc(-c3ccc(Cl)cc3)n2)CC1 ZINC000521683189 929364548 /nfs/dbraw/zinc/36/45/48/929364548.db2.gz OQHOTXYULMPJKW-UHFFFAOYSA-N 0 3 407.967 4.083 20 0 HIADHN CCc1ccc(C(=O)Nc2sccc2C(=O)N2CC[C@H](N3CCCCC3)C2)cc1 ZINC000521688744 929368469 /nfs/dbraw/zinc/36/84/69/929368469.db2.gz HWBFEZIWOJRRFE-IBGZPJMESA-N 0 3 411.571 4.263 20 0 HIADHN C[C@@H](c1cccs1)N(Cc1ccccc1)C(=O)NCCCCN1CCN(C)CC1 ZINC000521783002 929442624 /nfs/dbraw/zinc/44/26/24/929442624.db2.gz GBLVIWPSLNUOJH-FQEVSTJZSA-N 0 3 414.619 4.049 20 0 HIADHN COc1ccc(OC)c([C@H](C)NC(=O)[C@H](C)N[C@H](C)c2ccc(OC(C)C)cc2)c1 ZINC000521862073 929512600 /nfs/dbraw/zinc/51/26/00/929512600.db2.gz KFCLWTYIKQPYOQ-SQNIBIBYSA-N 0 3 414.546 4.408 20 0 HIADHN Cc1cc(C(C)(C)N[C@@H]2CCCN(CC(F)(F)F)C2=O)ccc1Br ZINC000522007606 929617453 /nfs/dbraw/zinc/61/74/53/929617453.db2.gz FROCQMKOKNJBIE-CQSZACIVSA-N 0 3 407.274 4.136 20 0 HIADHN CC(C)[C@@H](NC(=O)N(CCCc1ccccc1)CCN(C)C)c1nc2ccccc2[nH]1 ZINC000524528030 929666388 /nfs/dbraw/zinc/66/63/88/929666388.db2.gz QSMICGDTHQPSEN-HSZRJFAPSA-N 0 3 421.589 4.466 20 0 HIADHN COc1cc2c(cc1OC)CN(C(=O)CN(CC1CCC1)[C@H](C)c1ccccc1)CC2 ZINC000524620578 929728271 /nfs/dbraw/zinc/72/82/71/929728271.db2.gz FBTFXXXMEMQMAY-LJQANCHMSA-N 0 3 422.569 4.452 20 0 HIADHN Cc1c(C(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)cnn1-c1ccc(C)cc1 ZINC000524707659 929806316 /nfs/dbraw/zinc/80/63/16/929806316.db2.gz LTFJEMZTBDRRFW-HXUWFJFHSA-N 0 3 402.542 4.226 20 0 HIADHN C/C=C/c1ccc(OCC(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)c(OC)c1 ZINC000524866115 929864652 /nfs/dbraw/zinc/86/46/52/929864652.db2.gz YINMSFDSCRJRBO-ZTJJKMQJSA-N 0 3 408.542 4.230 20 0 HIADHN COc1ccc(CC[C@H](C)NC(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)cc1 ZINC000524882172 929871102 /nfs/dbraw/zinc/87/11/02/929871102.db2.gz IWAQSBDNNVSHMA-LEWJYISDSA-N 0 3 409.574 4.322 20 0 HIADHN C[C@H](c1ccccc1)N(CC(=O)NC[C@@H]1CCN(c2ccccc2)C1)CC1CCC1 ZINC000524893744 929876434 /nfs/dbraw/zinc/87/64/34/929876434.db2.gz LFFVDHYMBDFMKL-GGAORHGYSA-N 0 3 405.586 4.492 20 0 HIADHN C[C@H](c1ccccc1)N(CC(=O)NC[C@H]1CCN(c2ccccc2)C1)CC1CCC1 ZINC000524893743 929876496 /nfs/dbraw/zinc/87/64/96/929876496.db2.gz LFFVDHYMBDFMKL-FYYLOGMGSA-N 0 3 405.586 4.492 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)c(Cl)c1 ZINC000524896053 929877443 /nfs/dbraw/zinc/87/74/43/929877443.db2.gz FAAYOQHQCDRZFV-INIZCTEOSA-N 0 3 414.937 4.427 20 0 HIADHN Cc1ccc(NC(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1OCC1CCOCC1 ZINC000524991125 929957689 /nfs/dbraw/zinc/95/76/89/929957689.db2.gz ZCQFRIFTSIAHAT-QHCPKHFHSA-N 0 3 423.557 4.196 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)N2CCC(Nc3cccc(C)c3)CC2)N(C)C)cc1 ZINC000524992677 929958958 /nfs/dbraw/zinc/95/89/58/929958958.db2.gz PNZHCBHJVDEIFW-XMMPIXPASA-N 0 3 408.590 4.446 20 0 HIADHN CN(C)c1nc2sc(C(=O)NC[C@H]3CCCN(C)[C@H]3c3cccs3)cc2s1 ZINC000525057810 930008519 /nfs/dbraw/zinc/00/85/19/930008519.db2.gz TZLIVOPRNQMTSH-MLGOLLRUSA-N 0 3 420.629 4.298 20 0 HIADHN CN1CCN(c2ccncc2NC(=O)C[C@H](Cc2ccccc2)c2ccccc2)CC1 ZINC000525144407 930062435 /nfs/dbraw/zinc/06/24/35/930062435.db2.gz PBIUCQIXENSJRP-QHCPKHFHSA-N 0 3 414.553 4.189 20 0 HIADHN Cc1cc(NC(=O)c2ccccc2Cl)sc1C(=O)NCCN1CC[C@H](C)C1 ZINC000525292673 930135965 /nfs/dbraw/zinc/13/59/65/930135965.db2.gz NKAQWNGEUABXBL-ZDUSSCGKSA-N 0 3 405.951 4.034 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N[C@H]3C[C@H]3c3c(F)cccc3Cl)cc2)CC1 ZINC000525338203 930176234 /nfs/dbraw/zinc/17/62/34/930176234.db2.gz ATGNKIHWVILTJN-NQIIRXRSSA-N 0 3 415.940 4.295 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N[C@H]3C[C@@H]3c3c(F)cccc3Cl)cc2)CC1 ZINC000525338204 930176328 /nfs/dbraw/zinc/17/63/28/930176328.db2.gz ATGNKIHWVILTJN-RXVVDRJESA-N 0 3 415.940 4.295 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)NC[C@H]1CCCO[C@H]1C(C)(C)C ZINC000525394449 930215835 /nfs/dbraw/zinc/21/58/35/930215835.db2.gz QYPQOAATDXHJOB-CEMLEFRQSA-N 0 3 401.595 4.134 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)N[C@H]1C[C@H]1c1c(F)cccc1Cl ZINC000525394454 930215980 /nfs/dbraw/zinc/21/59/80/930215980.db2.gz REEWMUMHJWNPNZ-XLIONFOSSA-N 0 3 401.913 4.083 20 0 HIADHN Cc1nn(Cc2ccc(Cl)cc2)c(C)c1CNCCOc1ccc2c(c1)OCO2 ZINC000525402277 930220818 /nfs/dbraw/zinc/22/08/18/930220818.db2.gz GTFWVHPVPZUGES-UHFFFAOYSA-N 0 3 413.905 4.099 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)NCCCCOc1ccc(F)cc1 ZINC000525419523 930230754 /nfs/dbraw/zinc/23/07/54/930230754.db2.gz LDFJFFNEHGINKJ-FQEVSTJZSA-N 0 3 413.537 4.291 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1ccc(C(=O)NC(C)(C)C)cc1 ZINC000525440178 930240974 /nfs/dbraw/zinc/24/09/74/930240974.db2.gz YLOVIJLGOKHJAH-IBGZPJMESA-N 0 3 422.573 4.343 20 0 HIADHN CCN(Cc1ccccc1NC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C)C(C)=O ZINC000525444569 930243572 /nfs/dbraw/zinc/24/35/72/930243572.db2.gz HJOMRUBYKKXJEW-HXUWFJFHSA-N 0 3 422.573 4.183 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)[C@H]1C[C@@H]1c1ccccc1OC(F)(F)F ZINC000525471533 930261447 /nfs/dbraw/zinc/26/14/47/930261447.db2.gz SLDFRBDHTSBZDD-CVEARBPZSA-N 0 3 408.420 4.398 20 0 HIADHN Cc1ccc(-c2cc(C(=O)N(C)[C@H]3CCCN(C)C3)c3cnn(C(C)C)c3n2)s1 ZINC000525525325 930301636 /nfs/dbraw/zinc/30/16/36/930301636.db2.gz GBMKCXGRNNYKLK-INIZCTEOSA-N 0 3 411.575 4.215 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)CCc2cc(Cl)cs2)cc1)[C@@H]1CCCN(C)C1 ZINC000525579372 930341818 /nfs/dbraw/zinc/34/18/18/930341818.db2.gz QCQXUYTZQZSDDK-GOSISDBHSA-N 0 3 419.978 4.139 20 0 HIADHN Cc1cccc2cc(C(=O)Nc3ccc(C(=O)N(C)[C@H]4CCCN(C)C4)cc3)oc21 ZINC000525579175 930341938 /nfs/dbraw/zinc/34/19/38/930341938.db2.gz DYNWGVIWPNGVLD-FQEVSTJZSA-N 0 3 405.498 4.160 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2cc3sccc3s2)cc1)[C@@H]1CCCN(C)C1 ZINC000525580163 930342793 /nfs/dbraw/zinc/34/27/93/930342793.db2.gz DDSAUQNTQLGWGO-MRXNPFEDSA-N 0 3 413.568 4.381 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2ccc3ccccc3c2)cc1)[C@H]1CCCN(C)C1 ZINC000525581508 930344161 /nfs/dbraw/zinc/34/41/61/930344161.db2.gz CMJQNDMJRUHJJF-QHCPKHFHSA-N 0 3 401.510 4.258 20 0 HIADHN COc1ccc(Br)cc1C(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000525583321 930345297 /nfs/dbraw/zinc/34/52/97/930345297.db2.gz SQBKLYYGJUFDIN-YOEHRIQHSA-N 0 3 403.320 4.023 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N3c4ccccc4N(C)CC[C@H]3C)cc2)CC1 ZINC000525596087 930353973 /nfs/dbraw/zinc/35/39/73/930353973.db2.gz OVVUXBAKHNHJTQ-HXUWFJFHSA-N 0 3 406.574 4.092 20 0 HIADHN C[C@H](c1cccc(C(F)(F)F)c1)N(CCN1C(=O)NC2(CCCC2)C1=O)C1CC1 ZINC000525633202 930374735 /nfs/dbraw/zinc/37/47/35/930374735.db2.gz RZUJXWPPXSRBAE-CQSZACIVSA-N 0 3 409.452 4.095 20 0 HIADHN C[C@H]1CCN(C(=O)c2cc(Cl)c3c(c2)OCCCO3)CCN1Cc1ccccc1 ZINC000525737471 930420850 /nfs/dbraw/zinc/42/08/50/930420850.db2.gz NBABHYHMSDNYJW-KRWDZBQOSA-N 0 3 414.933 4.238 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(OC(F)F)cc1)c1ccc(OCC(=O)NC2CC2)cc1 ZINC000525760703 930434335 /nfs/dbraw/zinc/43/43/35/930434335.db2.gz BJBHCGOLVSFUAO-CABCVRRESA-N 0 3 404.457 4.357 20 0 HIADHN CCCN(CC(F)(F)F)C(=O)[C@@H]1CCCN(Cc2ccc(SC)c(OC)c2)C1 ZINC000525779196 930441928 /nfs/dbraw/zinc/44/19/28/930441928.db2.gz HNCDWWNWPZTXPJ-MRXNPFEDSA-N 0 3 418.525 4.430 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)CN2CC[C@@H](c3ccccc3)[C@@H](C)C2)c(OC)c1 ZINC000525787150 930444646 /nfs/dbraw/zinc/44/46/46/930444646.db2.gz RFHROJROZAKWQA-KWOQKUFVSA-N 0 3 422.569 4.493 20 0 HIADHN Cc1cnn([C@@H]2CCCc3ccccc32)c1NC(=O)CC1(N2CCOCC2)CCCC1 ZINC000525824088 930458302 /nfs/dbraw/zinc/45/83/02/930458302.db2.gz FKFRKXQZPMUDGX-JOCHJYFZSA-N 0 3 422.573 4.091 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3ccn(Cc4ccccc4)n3)c(C)c2)CC1 ZINC000526061188 930516980 /nfs/dbraw/zinc/51/69/80/930516980.db2.gz VURMSKYERHYUPC-UHFFFAOYSA-N 0 3 418.545 4.026 20 0 HIADHN COc1cc(CN[C@H](CCn2cncn2)c2ccc(C)cc2)ccc1OC(F)F ZINC000526107270 930536161 /nfs/dbraw/zinc/53/61/61/930536161.db2.gz GTYOXPRNYMMOOH-GOSISDBHSA-N 0 3 402.445 4.118 20 0 HIADHN COc1ccc(CN(CCc2ccccn2)Cc2ccc(-n3cncn3)c(F)c2)cc1 ZINC000526994159 930562971 /nfs/dbraw/zinc/56/29/71/930562971.db2.gz QQYHHBNTGYBWLW-UHFFFAOYSA-N 0 3 417.488 4.055 20 0 HIADHN C[C@H](CC(=O)Nc1cccc(Br)c1)N[C@H]1CCOc2ccc(F)cc21 ZINC000527100436 930590275 /nfs/dbraw/zinc/59/02/75/930590275.db2.gz LPQCTBOBEBYWQB-PXAZEXFGSA-N 0 3 407.283 4.419 20 0 HIADHN C[C@H](CC(=O)Nc1cccc(Br)c1)N[C@@H]1CCOc2ccc(F)cc21 ZINC000527100438 930590391 /nfs/dbraw/zinc/59/03/91/930590391.db2.gz LPQCTBOBEBYWQB-SJKOYZFVSA-N 0 3 407.283 4.419 20 0 HIADHN CC[NH+](CC)CCOc1ccc(CNC(=O)c2cc([O-])c3ccccc3c2)cc1OC ZINC000527157911 930604404 /nfs/dbraw/zinc/60/44/04/930604404.db2.gz DBNZERSNRQXEMG-UHFFFAOYSA-N 0 3 422.525 4.205 20 0 HIADHN Fc1cccnc1N1CC[C@H](N[C@@H](c2ccc(Br)cc2F)C2CC2)C1 ZINC000527282918 930626268 /nfs/dbraw/zinc/62/62/68/930626268.db2.gz PWUMIYGTRBNXRY-KBXCAEBGSA-N 0 3 408.290 4.442 20 0 HIADHN Cc1cc(N2CCC[C@@H](N[C@H](c3cccnc3)C3CC3)C2=O)ccc1Br ZINC000527326328 930634609 /nfs/dbraw/zinc/63/46/09/930634609.db2.gz YOYACJKIEVNLGX-UXHICEINSA-N 0 3 414.347 4.389 20 0 HIADHN C[C@H](NCc1ccc2c(c1)sc(=O)n2C)c1ccc(NC(=O)c2ccncc2)cc1 ZINC000527528797 930674506 /nfs/dbraw/zinc/67/45/06/930674506.db2.gz IGSPHXVDVBTESY-HNNXBMFYSA-N 0 3 418.522 4.098 20 0 HIADHN Cc1ccc(NC(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)c(OC[C@H]2CCCO2)c1 ZINC000530357006 930692214 /nfs/dbraw/zinc/69/22/14/930692214.db2.gz AQQUGBRVOSPPOT-LSWJPFSZSA-N 0 3 409.530 4.120 20 0 HIADHN Cc1cc(NC(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)ccc1NC(=O)c1ccco1 ZINC000530409815 930704722 /nfs/dbraw/zinc/70/47/22/930704722.db2.gz OQSALKOHNMJQIR-RBBKRZOGSA-N 0 3 418.497 4.407 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2cc(C3CC3)nn2-c2ccccc2)[C@@H]1c1ccccc1 ZINC000530461938 930716604 /nfs/dbraw/zinc/71/66/04/930716604.db2.gz CAKVYJMLCJEERU-REWPJTCUSA-N 0 3 401.514 4.317 20 0 HIADHN CCC(=O)Nc1ccc(Cl)c(NC(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)c1 ZINC000530462806 930719433 /nfs/dbraw/zinc/71/94/33/930719433.db2.gz XSZZVJHJPHPIND-XLIONFOSSA-N 0 3 400.910 4.255 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2ccc(C(=O)NC3CCCCC3)cc2)[C@@H]1c1ccccc1 ZINC000530515310 930734632 /nfs/dbraw/zinc/73/46/32/930734632.db2.gz VZWJLEHPDWVRFR-GOTSBHOMSA-N 0 3 420.557 4.316 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(F)cc2)CC1)C1CC(c2cccc(F)c2)C1 ZINC000530774495 930820583 /nfs/dbraw/zinc/82/05/83/930820583.db2.gz ADSZJIQZVXNSCW-UHFFFAOYSA-N 0 3 414.496 4.118 20 0 HIADHN CC(C)OCc1ccccc1CNC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000530826620 930832843 /nfs/dbraw/zinc/83/28/43/930832843.db2.gz ZRKLWRBCNYOOJY-DEOSSOPVSA-N 0 3 409.574 4.418 20 0 HIADHN COc1ccc(-c2noc([C@@]3(C(F)(F)F)CCN(Cc4ccccc4)C3)n2)cc1 ZINC000530879304 930847430 /nfs/dbraw/zinc/84/74/30/930847430.db2.gz SXRROYGDZKNIJO-HXUWFJFHSA-N 0 3 403.404 4.451 20 0 HIADHN CN(C(=O)c1cc(Cl)c2c(c1)OCCCO2)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000531063105 930902525 /nfs/dbraw/zinc/90/25/25/930902525.db2.gz AUOYTYZRUMHBDK-IBGZPJMESA-N 0 3 414.933 4.238 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N[C@@H](c2cccs2)c2ccc(F)cc2)CC1 ZINC000531106477 930922157 /nfs/dbraw/zinc/92/21/57/930922157.db2.gz ZIUZFTBACUYMMI-OAQYLSRUSA-N 0 3 419.566 4.165 20 0 HIADHN CS(=O)(=O)c1ccc(OCCCN[C@H](c2ccccc2)c2ccc(F)cc2)cc1 ZINC000531142067 930941544 /nfs/dbraw/zinc/94/15/44/930941544.db2.gz JORZYFVCQJTCDS-HSZRJFAPSA-N 0 3 413.514 4.377 20 0 HIADHN CS(=O)(=O)c1ccc(OCCCN[C@H](c2cccs2)c2ccc(F)cc2)cc1 ZINC000531141943 930942189 /nfs/dbraw/zinc/94/21/89/930942189.db2.gz ZAPSUHOSRCWSJI-NRFANRHFSA-N 0 3 419.543 4.439 20 0 HIADHN CC[C@H](C)NC(=O)c1cccc(CNCc2ccc(OC)c3oc(C(=O)OC)cc32)c1 ZINC000531142541 930943218 /nfs/dbraw/zinc/94/32/18/930943218.db2.gz ODWWWOSTXKESBB-HNNXBMFYSA-N 0 3 424.497 4.046 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)c2cc(-c3ccccc3)c(C)[nH]c2=O)N(C)C)cc1 ZINC000531176285 930953681 /nfs/dbraw/zinc/95/36/81/930953681.db2.gz DZQPLQXPXVOCAO-HSZRJFAPSA-N 0 3 403.526 4.358 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)Nc1ccccc1Br)[C@H]1Oc2ccccc2[C@@H]1C ZINC000531212516 930967730 /nfs/dbraw/zinc/96/77/30/930967730.db2.gz CIWUTXCSWQGULA-LJPSSGMGSA-N 0 3 403.320 4.319 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccnc2)C1)N1CCc2cc(Cl)cc(Cl)c2C1 ZINC000531225123 930973718 /nfs/dbraw/zinc/97/37/18/930973718.db2.gz NRFATSARGVYWRO-QGZVFWFLSA-N 0 3 404.341 4.185 20 0 HIADHN Cc1ccc(C(=O)N2CCC[C@H](c3nc(-c4ccc(CN(C)C)cc4)no3)C2)cc1 ZINC000531348577 931026712 /nfs/dbraw/zinc/02/67/12/931026712.db2.gz PTTPYFHNMBWYLS-NRFANRHFSA-N 0 3 404.514 4.126 20 0 HIADHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1[nH]c2ccc(Br)cc2c1Cl ZINC000531435040 931056680 /nfs/dbraw/zinc/05/66/80/931056680.db2.gz ZQVBNJDATGHASV-OLZOCXBDSA-N 0 3 410.743 4.283 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)Nc1cc(Cl)cc2cccnc21 ZINC000531457915 931065271 /nfs/dbraw/zinc/06/52/71/931065271.db2.gz YTHUBPNDSKRRKE-UHFFFAOYSA-N 0 3 424.932 4.167 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)Nc1cc(F)ccc1OCC(F)(F)F ZINC000531460380 931065740 /nfs/dbraw/zinc/06/57/40/931065740.db2.gz WLBSPZMXLCVKIP-UHFFFAOYSA-N 0 3 413.415 4.363 20 0 HIADHN CC(C)CCn1cccc1C[NH2+]Cc1nnc(-c2ccc(Br)cc2)[n-]1 ZINC000531496063 931078601 /nfs/dbraw/zinc/07/86/01/931078601.db2.gz SXDYUMWKKLMITO-UHFFFAOYSA-N 0 3 402.340 4.372 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccnc2)C1)N(CCc1ccc(F)cc1)C1CCCC1 ZINC000531540967 931097883 /nfs/dbraw/zinc/09/78/83/931097883.db2.gz KOPOSBNEDPLFTL-JOCHJYFZSA-N 0 3 409.549 4.447 20 0 HIADHN C[C@H]1C[C@H](NC(=O)c2ccccc2OCc2ccncc2)CN1Cc1ccccc1 ZINC000531569392 931105345 /nfs/dbraw/zinc/10/53/45/931105345.db2.gz WDFAVJAGRNBUKY-UGKGYDQZSA-N 0 3 401.510 4.053 20 0 HIADHN COc1cccc(C=C2CCN(C(=O)[C@@H]3CCCN(Cc4cccnc4)C3)CC2)c1 ZINC000531616338 931128375 /nfs/dbraw/zinc/12/83/75/931128375.db2.gz MGXFCXDLEOMMKX-HSZRJFAPSA-N 0 3 405.542 4.008 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@H](C)N[C@@H]2CCCc3cc(OC)ccc32)cc1 ZINC000531676682 931147761 /nfs/dbraw/zinc/14/77/61/931147761.db2.gz IPGISOBNJHGNFW-GAJHUEQPSA-N 0 3 416.587 4.454 20 0 HIADHN COc1ccccc1-c1ccc([C@@H](C)NCc2ccc(N3CCN(C)CC3)nc2)cc1 ZINC000531687511 931153305 /nfs/dbraw/zinc/15/33/05/931153305.db2.gz DDJKDYKYRGKUSF-HXUWFJFHSA-N 0 3 416.569 4.360 20 0 HIADHN COc1cc([C@H](C)NCc2ccc(CS(=O)(=O)NC(C)C)cc2)ccc1SC ZINC000531695605 931158000 /nfs/dbraw/zinc/15/80/00/931158000.db2.gz CDKJWMDLRGYLFH-INIZCTEOSA-N 0 3 422.616 4.096 20 0 HIADHN C[C@@H](NCCNS(=O)(=O)c1cccc(Cl)c1)c1ccc(-c2ccncc2)cc1 ZINC000531696504 931159983 /nfs/dbraw/zinc/15/99/83/931159983.db2.gz GLDZDLGSRKKFQI-MRXNPFEDSA-N 0 3 415.946 4.031 20 0 HIADHN COc1ccc([C@@H](C)NCc2ccccc2N2CCOCC2)cc1Br ZINC000531697555 931161061 /nfs/dbraw/zinc/16/10/61/931161061.db2.gz KUYSPUCHYILWHO-OAHLLOKOSA-N 0 3 405.336 4.145 20 0 HIADHN C[C@H](NCc1cc(Cl)c2c(c1)OCCO2)c1ccc(OCc2nccn2C)cc1 ZINC000531701325 931163929 /nfs/dbraw/zinc/16/39/29/931163929.db2.gz ZRWNYOUAJUSKAO-HNNXBMFYSA-N 0 3 413.905 4.275 20 0 HIADHN CC[C@@H](NCc1ccccc1CS(=O)(=O)NC(C)C)c1ccc(Cl)s1 ZINC000531703047 931164880 /nfs/dbraw/zinc/16/48/80/931164880.db2.gz DUEBOEUAFDFLDR-MRXNPFEDSA-N 0 3 400.997 4.470 20 0 HIADHN COc1cccc(C[C@@H](NCc2cccc(CS(C)(=O)=O)c2)c2ccccc2)c1 ZINC000531709464 931168782 /nfs/dbraw/zinc/16/87/82/931168782.db2.gz OCVAIZUDNMCSQW-XMMPIXPASA-N 0 3 409.551 4.313 20 0 HIADHN C[C@@H](NC(=O)N1CCN(C2CCCCC2)CC1)c1ccc(OCc2cccnc2)cc1 ZINC000531740876 931179253 /nfs/dbraw/zinc/17/92/53/931179253.db2.gz IAKGDWUTAGOFBS-HXUWFJFHSA-N 0 3 422.573 4.382 20 0 HIADHN CN(CC1(CO)COC1)[C@H](c1ccc(Cl)cc1)c1ccc(Br)cc1 ZINC000531802256 931204775 /nfs/dbraw/zinc/20/47/75/931204775.db2.gz DGDDCXLJEZLCFZ-SFHVURJKSA-N 0 3 410.739 4.133 20 0 HIADHN CC[C@H](C)[C@H](NC(=O)N1CC[C@H](N2CCN(C(C)C)CC2)C1)c1ccc(Cl)cc1 ZINC000531839689 931216105 /nfs/dbraw/zinc/21/61/05/931216105.db2.gz MKOARJVCPSKZHX-NYVOZVTQSA-N 0 3 421.029 4.237 20 0 HIADHN CCCN1CCN(c2ccccc2CNCc2nnc(-c3ccccc3)s2)CC1 ZINC000531848176 931218927 /nfs/dbraw/zinc/21/89/27/931218927.db2.gz MFMJOMSJZCKBDJ-UHFFFAOYSA-N 0 3 407.587 4.027 20 0 HIADHN COc1cccc(OC)c1Oc1ccc(CNCc2cccc(-n3cccn3)c2)cn1 ZINC000531856179 931222690 /nfs/dbraw/zinc/22/26/90/931222690.db2.gz DRHLMWJFBBOIOG-UHFFFAOYSA-N 0 3 416.481 4.367 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)c(C)c1CN[C@H]1CCN(C(=O)C2CCCCC2)C1 ZINC000531863973 931226652 /nfs/dbraw/zinc/22/66/52/931226652.db2.gz RAOVNNBXDIZUFR-FQEVSTJZSA-N 0 3 414.981 4.413 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N2CCC(Nc3ccc(F)cc3)CC2)C1 ZINC000531935585 931252955 /nfs/dbraw/zinc/25/29/55/931252955.db2.gz XUZXANJOTLVPOK-WZONZLPQSA-N 0 3 410.537 4.247 20 0 HIADHN C[C@H](NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)nc1)c1ccc(Br)cc1 ZINC000531936280 931253195 /nfs/dbraw/zinc/25/31/95/931253195.db2.gz JGJPUCYFTNBOHQ-OAGGEKHMSA-N 0 3 404.352 4.309 20 0 HIADHN Fc1ccccc1-c1nc2c(s1)[C@H](NCc1ccc(N3CCOCC3)nc1)CCC2 ZINC000531944686 931256863 /nfs/dbraw/zinc/25/68/63/931256863.db2.gz UTMAPPROAKMERN-LJQANCHMSA-N 0 3 424.545 4.348 20 0 HIADHN C[C@H]1C[C@H](NCc2ccc(N3CCOCC3)nc2)c2cccc(Br)c21 ZINC000531945274 931257438 /nfs/dbraw/zinc/25/74/38/931257438.db2.gz UFDOVOWSTVYIMW-KSSFIOAISA-N 0 3 402.336 4.019 20 0 HIADHN CC(C)NS(=O)(=O)Cc1ccccc1CN[C@@H]1c2cccc(F)c2CC[C@H]1C ZINC000531958221 931264981 /nfs/dbraw/zinc/26/49/81/931264981.db2.gz TZEUQFLQCSVYEK-ZHRRBRCNSA-N 0 3 404.551 4.067 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)cc1 ZINC000531963833 931267303 /nfs/dbraw/zinc/26/73/03/931267303.db2.gz BDLBWHFBFFBUPR-NTKDMRAZSA-N 0 3 402.542 4.065 20 0 HIADHN CN1CCN(c2ccc(CN[C@@H]3CCCc4c(Cl)sc(Cl)c43)cn2)CC1 ZINC000531989254 931278418 /nfs/dbraw/zinc/27/84/18/931278418.db2.gz KZFCPSBJBUTMGU-OAHLLOKOSA-N 0 3 411.402 4.369 20 0 HIADHN Cc1cccc(Oc2ccc(NC(=O)N3CC[C@H](N4CCN(C(C)C)CC4)C3)cc2)c1 ZINC000532094883 931309356 /nfs/dbraw/zinc/30/93/56/931309356.db2.gz LRHMNLGKNBXPDM-QFIPXVFZSA-N 0 3 422.573 4.420 20 0 HIADHN CC(C)N1CCN([C@@H]2CCN(C(=O)c3ccc(SCc4ccccc4)cc3)C2)CC1 ZINC000532093646 931309858 /nfs/dbraw/zinc/30/98/58/931309858.db2.gz TYQQWOUXYYYMDM-HSZRJFAPSA-N 0 3 423.626 4.219 20 0 HIADHN Clc1cc(CN[C@H]2CCSc3ccccc32)ccc1OCCN1CCOCC1 ZINC000532094365 931309949 /nfs/dbraw/zinc/30/99/49/931309949.db2.gz NBQUPMPLWJEXJP-FQEVSTJZSA-N 0 3 418.990 4.378 20 0 HIADHN Cc1cccc(Oc2ccc(NC(=O)N3CC[C@@H](N4CCN(C(C)C)CC4)C3)cc2)c1 ZINC000532094881 931310089 /nfs/dbraw/zinc/31/00/89/931310089.db2.gz LRHMNLGKNBXPDM-JOCHJYFZSA-N 0 3 422.573 4.420 20 0 HIADHN Cc1ccc(Oc2ccccc2NC(=O)N2CC[C@H](N3CCN(C(C)C)CC3)C2)cc1 ZINC000532096524 931311025 /nfs/dbraw/zinc/31/10/25/931311025.db2.gz FNGRUIBYHQYVRY-NRFANRHFSA-N 0 3 422.573 4.420 20 0 HIADHN O=C(CN1CCC[C@H]1Cc1ccccc1)NCc1cccc(COCc2ccco2)c1 ZINC000532159585 931333087 /nfs/dbraw/zinc/33/30/87/931333087.db2.gz LZEZBFPPRNBDHX-DEOSSOPVSA-N 0 3 418.537 4.320 20 0 HIADHN CCOc1cc(Br)ccc1NC(=O)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000532181645 931338393 /nfs/dbraw/zinc/33/83/93/931338393.db2.gz FBTNPYHGKSCNLF-INIZCTEOSA-N 0 3 418.335 4.094 20 0 HIADHN C[C@H](NCc1ccc(N2CCOCC2)nc1)c1ccc(OCc2ccccc2)cc1 ZINC000532200136 931346926 /nfs/dbraw/zinc/34/69/26/931346926.db2.gz AFXMPIUMVGFOKF-FQEVSTJZSA-N 0 3 403.526 4.348 20 0 HIADHN CCc1nc2c(s1)[C@@H](N[C@H](C)c1ccc(S(=O)(=O)N(CC)CC)cc1)CCC2 ZINC000532203037 931348095 /nfs/dbraw/zinc/34/80/95/931348095.db2.gz CJERPEDPSVAVMN-QAPCUYQASA-N 0 3 421.632 4.464 20 0 HIADHN C[C@H](NCc1ccc2c(c1)nnn2C)c1cccc(NC(=O)Cc2ccccc2F)c1 ZINC000532211916 931354208 /nfs/dbraw/zinc/35/42/08/931354208.db2.gz AMQXATWRCCOGDC-INIZCTEOSA-N 0 3 417.488 4.139 20 0 HIADHN CC[C@@H](N[C@@H](C)c1ccc(-n2ccnc2)cc1)c1ccccc1OCC(=O)N(C)C ZINC000532212150 931354759 /nfs/dbraw/zinc/35/47/59/931354759.db2.gz WHPYQXUMVDPYKC-PGRDOPGGSA-N 0 3 406.530 4.141 20 0 HIADHN CC(C)NS(=O)(=O)Cc1ccccc1CN[C@H](C)c1ccc2c(c1)CCCC2 ZINC000532213857 931354916 /nfs/dbraw/zinc/35/49/16/931354916.db2.gz IUTMUUSLTUPWGM-GOSISDBHSA-N 0 3 400.588 4.244 20 0 HIADHN Cc1ccc(Cl)cc1NC(=O)C[C@H](C)NCc1ccnc(OC2CCOCC2)c1 ZINC000532228674 931362548 /nfs/dbraw/zinc/36/25/48/931362548.db2.gz KHFQKOMQKUEZAN-INIZCTEOSA-N 0 3 417.937 4.108 20 0 HIADHN COc1cc(-c2noc(CN3CC[C@H](C)[C@@H]4CCCC[C@@H]43)n2)cc(OC)c1OC ZINC000532266929 931376396 /nfs/dbraw/zinc/37/63/96/931376396.db2.gz QAPYPVRWQDUGPK-XIRDDKMYSA-N 0 3 401.507 4.163 20 0 HIADHN Cc1cc2ccccc2nc1N1CCC(C(=O)NCCN(C)Cc2ccccc2)CC1 ZINC000532269282 931377765 /nfs/dbraw/zinc/37/77/65/931377765.db2.gz UMRRYQNJMYAXCW-UHFFFAOYSA-N 0 3 416.569 4.008 20 0 HIADHN CC(C)N1CCN([C@H]2CCN(C(=O)C[C@@H](Cc3ccccc3)c3ccccc3)C2)CC1 ZINC000532347677 931403404 /nfs/dbraw/zinc/40/34/04/931403404.db2.gz CCTVMQNIPQIPFF-FTJBHMTQSA-N 0 3 419.613 4.030 20 0 HIADHN C[C@@H](CC[S@@](C)=O)NCc1cc(Br)ccc1OCc1ccccc1 ZINC000532374737 931414945 /nfs/dbraw/zinc/41/49/45/931414945.db2.gz WCPFUNCJIGIKDQ-IZHWHUGBSA-N 0 3 410.377 4.275 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)N1CCC[C@H](CC(=O)OC(C)(C)C)C1 ZINC000532385794 931418752 /nfs/dbraw/zinc/41/87/52/931418752.db2.gz FCNOFHDLZYYFCA-MRXNPFEDSA-N 0 3 400.519 4.078 20 0 HIADHN COc1ccc([C@H](CN[C@@H](C)c2ccccc2Cl)N2CCOCC2)cc1OC ZINC000532441781 931435621 /nfs/dbraw/zinc/43/56/21/931435621.db2.gz QJUBRJHJRVXAQS-JXFKEZNVSA-N 0 3 404.938 4.081 20 0 HIADHN COc1ccc([C@H](C)N[C@H](C)c2ccc(S(=O)(=O)N3CCCCC3)cc2)cc1F ZINC000532454559 931442578 /nfs/dbraw/zinc/44/25/78/931442578.db2.gz TWTNQCSKZLOAKZ-SJORKVTESA-N 0 3 420.550 4.421 20 0 HIADHN CC[C@@H](NCc1ccc(CS(=O)(=O)NC(C)C)cc1)c1ccc(Cl)s1 ZINC000532465900 931447921 /nfs/dbraw/zinc/44/79/21/931447921.db2.gz QIXNWYIRJGAGTM-MRXNPFEDSA-N 0 3 400.997 4.470 20 0 HIADHN CC[C@@H](N[C@@H](C)c1ccc(S(=O)(=O)NC)cc1)c1ccc(Br)cc1 ZINC000532467995 931448659 /nfs/dbraw/zinc/44/86/59/931448659.db2.gz JRIGQEUYHHJVOU-SCLBCKFNSA-N 0 3 411.365 4.159 20 0 HIADHN CCN(CC)C(=O)Nc1ccc([C@H](C)NCc2ccccc2N2CCOCC2)cc1 ZINC000532468405 931449372 /nfs/dbraw/zinc/44/93/72/931449372.db2.gz ZHLXBELVKGGHKB-IBGZPJMESA-N 0 3 410.562 4.248 20 0 HIADHN Cc1cc(C)n(-c2ccc(CNCc3ccc4c(c3)nnn4C)c(C(F)(F)F)c2)n1 ZINC000532479867 931454921 /nfs/dbraw/zinc/45/49/21/931454921.db2.gz WWIDJABWLDATQP-UHFFFAOYSA-N 0 3 414.435 4.079 20 0 HIADHN COc1ccc(S(=O)(=O)[N-]c2cccc(C[NH2+][C@H]3CCc4ccccc43)c2)cc1 ZINC000532501207 931465189 /nfs/dbraw/zinc/46/51/89/931465189.db2.gz FMSWLSYCKZYTPV-QHCPKHFHSA-N 0 3 408.523 4.273 20 0 HIADHN Cc1cc(NC(=O)c2cc3ccccc3n2C)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000532513628 931469432 /nfs/dbraw/zinc/46/94/32/931469432.db2.gz KBBWCWRHKLVRTR-OAQYLSRUSA-N 0 3 413.525 4.383 20 0 HIADHN Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)NCc1cccc(OCC(N)=O)c1 ZINC000532524519 931474841 /nfs/dbraw/zinc/47/48/41/931474841.db2.gz BXPFKOVXBGGMEL-CYBMUJFWSA-N 0 3 415.946 4.487 20 0 HIADHN O[C@H](COc1cccc(C(F)(F)F)c1)CN1CC=C(c2c[nH]c3ncccc23)CC1 ZINC000532641947 931564289 /nfs/dbraw/zinc/56/42/89/931564289.db2.gz OQXRMXVKFSFWQP-KRWDZBQOSA-N 0 3 417.431 4.111 20 0 HIADHN C[C@@H](NC[C@H](CO)Cc1ccco1)c1ccc(Br)cc1Br ZINC000532647948 931567391 /nfs/dbraw/zinc/56/73/91/931567391.db2.gz BSWVJRHRCICVIG-VXGBXAGGSA-N 0 3 417.141 4.306 20 0 HIADHN COc1ccccc1NC(=O)c1ccc(NC(=O)CCN(C)Cc2ccc(C)o2)cc1 ZINC000532761848 931625055 /nfs/dbraw/zinc/62/50/55/931625055.db2.gz CQFWXXATTFRBCP-UHFFFAOYSA-N 0 3 421.497 4.310 20 0 HIADHN C[C@H](c1ccccc1Br)N(C)C(=O)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000532790001 931632272 /nfs/dbraw/zinc/63/22/72/931632272.db2.gz REHRIBWDXVXHHS-AEFFLSMTSA-N 0 3 416.363 4.276 20 0 HIADHN COc1ccc(CNC[C@H](CO)Cc2ccc(C(F)(F)F)cc2)c(Cl)c1OC ZINC000532866752 931672904 /nfs/dbraw/zinc/67/29/04/931672904.db2.gz VLFFBFXFHQZROR-CQSZACIVSA-N 0 3 417.855 4.317 20 0 HIADHN COc1cc(Br)c(CN[C@H]2CCOC3(CCSCC3)C2)c(OC)c1 ZINC000532905352 931687460 /nfs/dbraw/zinc/68/74/60/931687460.db2.gz ISHMCWVZGHONAL-ZDUSSCGKSA-N 0 3 416.381 4.001 20 0 HIADHN C[C@@H]1CN(C[C@H]2CCCN2Cc2cccc(C(=O)Nc3ccccc3)c2)C[C@@H](C)O1 ZINC000532929389 931700606 /nfs/dbraw/zinc/70/06/06/931700606.db2.gz LYNZKZOZZQKRDQ-YOSAUDMPSA-N 0 3 407.558 4.013 20 0 HIADHN COC(=O)c1cc(CN2CCC[C@H](c3nc(-c4ccc(Cl)cc4)no3)C2)c(C)o1 ZINC000533041963 931749534 /nfs/dbraw/zinc/74/95/34/931749534.db2.gz ADHZCDDORNEOSI-HNNXBMFYSA-N 0 3 415.877 4.458 20 0 HIADHN O=C(CNC1(c2ccccc2)CCOCC1)NCC1(c2ccccc2)CCCCC1 ZINC000533057419 931756809 /nfs/dbraw/zinc/75/68/09/931756809.db2.gz NPLOPFITCVOGCQ-UHFFFAOYSA-N 0 3 406.570 4.300 20 0 HIADHN CN(C(=O)CNC1(c2ccc(Cl)cc2)CCOCC1)[C@H]1CCCc2ccccc21 ZINC000533062820 931759543 /nfs/dbraw/zinc/75/95/43/931759543.db2.gz YYTYOECMVOWOSD-QFIPXVFZSA-N 0 3 412.961 4.471 20 0 HIADHN C[C@@H](NCc1nc(-c2cc(Cl)ccc2Cl)cs1)[C@@H](C)N1CCOCC1 ZINC000533149635 931787500 /nfs/dbraw/zinc/78/75/00/931787500.db2.gz FQEWIUOAHQARGJ-CHWSQXEVSA-N 0 3 400.375 4.316 20 0 HIADHN O[C@]1(CNCc2ccc(OCc3ccccc3)cc2OCc2ccccc2)CCOC1 ZINC000533178883 931802509 /nfs/dbraw/zinc/80/25/09/931802509.db2.gz KRXJXFLGNLFAKD-SANMLTNESA-N 0 3 419.521 4.086 20 0 HIADHN COc1cc(CNCc2ccc3c(c2)COC3)cc(Br)c1OC(F)F ZINC000533200686 931807687 /nfs/dbraw/zinc/80/76/87/931807687.db2.gz XNSCQQVHLLJHDF-UHFFFAOYSA-N 0 3 414.246 4.379 20 0 HIADHN O=C(CCOc1cccc(Cl)c1)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000533264224 931823180 /nfs/dbraw/zinc/82/31/80/931823180.db2.gz CPODJJCQXWTEIO-HXUWFJFHSA-N 0 3 424.932 4.391 20 0 HIADHN O=c1cc(CN2CCC(c3c[nH]c4cc(F)ccc43)CC2)nc2ccc(Cl)cn12 ZINC000533286602 931828238 /nfs/dbraw/zinc/82/82/38/931828238.db2.gz KUDBIAGCFJXKFW-UHFFFAOYSA-N 0 3 410.880 4.348 20 0 HIADHN CC(C)(O)CN(CC(=O)Nc1ccccc1Sc1ccccc1)C1CCOCC1 ZINC000533345023 931843841 /nfs/dbraw/zinc/84/38/41/931843841.db2.gz OZEDHPMBYLWXCA-UHFFFAOYSA-N 0 3 414.571 4.028 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)CN[C@H](c2ccccc2)C2CCC2)c(OC)c1 ZINC000533368340 931850320 /nfs/dbraw/zinc/85/03/20/931850320.db2.gz JFAMPJMIFFUFKU-WIOPSUGQSA-N 0 3 408.542 4.498 20 0 HIADHN Fc1ccc(-c2noc([C@H]3CCCN(Cc4cnn(-c5ccccc5)c4)C3)n2)cc1 ZINC000533370033 931850714 /nfs/dbraw/zinc/85/07/14/931850714.db2.gz WGMPEMJEPHZQSD-IBGZPJMESA-N 0 3 403.461 4.441 20 0 HIADHN Cc1cccc(C2(NCC(=O)N3CCC(C(=O)Nc4ccccc4)CC3)CCCC2)c1 ZINC000533373954 931852130 /nfs/dbraw/zinc/85/21/30/931852130.db2.gz MHTGBEYODGQKMR-UHFFFAOYSA-N 0 3 419.569 4.231 20 0 HIADHN O=C(Nc1ccc(Cl)c(Cl)c1)C1CCN(C[C@@H](O)COc2ccccc2)CC1 ZINC000533396377 931857437 /nfs/dbraw/zinc/85/74/37/931857437.db2.gz VENIEFKQAWGJIG-QGZVFWFLSA-N 0 3 423.340 4.084 20 0 HIADHN Cc1ccc(COc2c(C)cc(CN(C)Cc3cc(=O)n4nccc4[nH]3)cc2C)cc1 ZINC000533436380 931868705 /nfs/dbraw/zinc/86/87/05/931868705.db2.gz PEFQQTQUKHPVEA-UHFFFAOYSA-N 0 3 416.525 4.159 20 0 HIADHN CCc1ccc([C@@H](NCC(=O)NCc2ccc(C(=O)N3CCCC3)cc2)C(C)C)cc1 ZINC000533471517 931877752 /nfs/dbraw/zinc/87/77/52/931877752.db2.gz PVLWPXWRNCNETF-VWLOTQADSA-N 0 3 421.585 4.088 20 0 HIADHN CCN(CC)CCN(Cc1cccs1)Cc1nc(=O)c2c3c(sc2[nH]1)CCC3 ZINC000533482391 931880570 /nfs/dbraw/zinc/88/05/70/931880570.db2.gz QBVMFSQITYCYRL-UHFFFAOYSA-N 0 3 416.616 4.291 20 0 HIADHN COc1cc(NC(=O)CCN2CCC[C@H]2c2cccc(C)n2)c(OC)cc1Cl ZINC000533484039 931881249 /nfs/dbraw/zinc/88/12/49/931881249.db2.gz MTAPAMSFWGVMSO-SFHVURJKSA-N 0 3 403.910 4.226 20 0 HIADHN COc1ccc(C)cc1CN1CCC(C(=O)Nc2ccc(Br)cn2)CC1 ZINC000533490108 931883185 /nfs/dbraw/zinc/88/31/85/931883185.db2.gz GMPWZIWXEKMLPY-UHFFFAOYSA-N 0 3 418.335 4.012 20 0 HIADHN COC(=O)c1cc(CN2CCC[C@H](c3nc(-c4ccc(Cl)cc4)no3)C2)oc1C ZINC000533503467 931886081 /nfs/dbraw/zinc/88/60/81/931886081.db2.gz MYJPBOVGMMJYKF-HNNXBMFYSA-N 0 3 415.877 4.458 20 0 HIADHN C[C@H]1Oc2ccc(C(=O)C3CCN(Cc4cccc5cccnc54)CC3)cc2NC1=O ZINC000533508545 931888867 /nfs/dbraw/zinc/88/88/67/931888867.db2.gz XRSSBKVAZMNAEI-MRXNPFEDSA-N 0 3 415.493 4.049 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CNC(=O)CN[C@@H](c1ccccc1)C1CCC1 ZINC000533513754 931890741 /nfs/dbraw/zinc/89/07/41/931890741.db2.gz QPHKILAEDMITGM-SANMLTNESA-N 0 3 416.569 4.295 20 0 HIADHN Cc1ccc(CN(C(=O)CN2CCC(c3c[nH]c4ncccc34)CC2)C2CC2)cc1 ZINC000533518297 931892307 /nfs/dbraw/zinc/89/23/07/931892307.db2.gz NNDLMEOAFBPTLT-UHFFFAOYSA-N 0 3 402.542 4.242 20 0 HIADHN CC(C)N(CC(=O)N(Cc1cccs1)c1ccc2c(c1)OCCO2)C1CCC1 ZINC000533533358 931895817 /nfs/dbraw/zinc/89/58/17/931895817.db2.gz MCBJLZQIINCDMU-UHFFFAOYSA-N 0 3 400.544 4.315 20 0 HIADHN Cc1c(C(=O)NC2CCN([C@H](C)c3ccncc3)CC2)cccc1-c1ccccn1 ZINC000533651041 931946330 /nfs/dbraw/zinc/94/63/30/931946330.db2.gz NMRTZQXSNRQNEY-LJQANCHMSA-N 0 3 400.526 4.407 20 0 HIADHN C[C@H](NC(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1)[C@@H]1COc2ccccc21 ZINC000533657596 931951689 /nfs/dbraw/zinc/95/16/89/931951689.db2.gz ANJLWJICCBKWSL-XWFZLUIHSA-N 0 3 418.459 4.122 20 0 HIADHN CC[C@H](NCc1cc(OC)cc2c1O[C@@H](C)C2)[C@@H](c1ccc(C)cc1)n1cncn1 ZINC000533742867 932003616 /nfs/dbraw/zinc/00/36/16/932003616.db2.gz LFPMRVMQQZNQOB-PDIWNELESA-N 0 3 406.530 4.076 20 0 HIADHN CC1CCN(S(=O)(=O)Cc2ccccc2CNCc2ccc3ncccc3c2)CC1 ZINC000533756716 932013185 /nfs/dbraw/zinc/01/31/85/932013185.db2.gz OAMIFGVNYLJPMO-UHFFFAOYSA-N 0 3 423.582 4.086 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccc(O)cc1)C(=O)c1cc(-c2ccccc2)no1 ZINC000533833777 932051617 /nfs/dbraw/zinc/05/16/17/932051617.db2.gz ZWHQQTCYBRVMOX-HXUWFJFHSA-N 0 3 405.498 4.174 20 0 HIADHN CN(C(=O)c1ccc(C(=O)N2CCN(C3CCCCC3)CC2)cc1)c1ccccc1 ZINC000533848738 932059321 /nfs/dbraw/zinc/05/93/21/932059321.db2.gz JOOAQGZLBQKRDX-UHFFFAOYSA-N 0 3 405.542 4.054 20 0 HIADHN Cc1n[nH]c(C)c1[C@@H](C)CC(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1 ZINC000533873887 932074641 /nfs/dbraw/zinc/07/46/41/932074641.db2.gz HUVXJBNXIVHSPD-AWEZNQCLSA-N 0 3 410.484 4.129 20 0 HIADHN COc1cc(C(=O)N(CCN(C)C)Cc2cccc(C)c2)sc1Br ZINC000533901598 932090315 /nfs/dbraw/zinc/09/03/15/932090315.db2.gz JOVAWHRIKNJUHR-UHFFFAOYSA-N 0 3 411.365 4.032 20 0 HIADHN Cc1ccc(-c2nc(C(=O)N(Cc3ccccc3)C3CCN(C)CC3)cs2)n1C ZINC000533927351 932104284 /nfs/dbraw/zinc/10/42/84/932104284.db2.gz BFORJNUGFVCJHG-UHFFFAOYSA-N 0 3 408.571 4.194 20 0 HIADHN CN(Cc1ccccc1Br)C(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000533947323 932119991 /nfs/dbraw/zinc/11/99/91/932119991.db2.gz UEKMGNDGCKEEOH-RBUKOAKNSA-N 0 3 402.336 4.036 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)c2ccc(Oc3ccc(C(N)=O)cc3)cc2)c1 ZINC000533967965 932144699 /nfs/dbraw/zinc/14/46/99/932144699.db2.gz AEHLQGJTDCZVRG-UHFFFAOYSA-N 0 3 403.482 4.200 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)c2ccc(-c3noc(C(F)(F)F)n3)cc2)c1 ZINC000533971766 932148871 /nfs/dbraw/zinc/14/88/71/932148871.db2.gz DIGJJTOQNGHOBR-UHFFFAOYSA-N 0 3 404.392 4.378 20 0 HIADHN C[C@H](C(=O)NCc1ccccc1-c1cnn(C)c1)N1CCC(Cc2ccccc2)CC1 ZINC000534007521 932189772 /nfs/dbraw/zinc/18/97/72/932189772.db2.gz DPVBPCCPNIRXFI-HXUWFJFHSA-N 0 3 416.569 4.047 20 0 HIADHN CC(C)N1CCN([C@@H]2CCN(C(=O)Nc3ccc4c(c3)C(C)(C)CC4(C)C)C2)CC1 ZINC000534013180 932194073 /nfs/dbraw/zinc/19/40/73/932194073.db2.gz BCQOUZNNTBPYRS-HXUWFJFHSA-N 0 3 412.622 4.278 20 0 HIADHN Cc1ccc(OCc2cccc(C(=O)N[C@@H]3CCN(C)[C@H]3c3ccccc3)c2)cn1 ZINC000534016539 932198355 /nfs/dbraw/zinc/19/83/55/932198355.db2.gz FUIKRXRRJLWLAX-RPWUZVMVSA-N 0 3 401.510 4.144 20 0 HIADHN CN1CC[C@H](NC(=O)c2cccc(-n3ccc(C(F)(F)F)n3)c2)[C@@H]1c1ccccc1 ZINC000534019277 932200978 /nfs/dbraw/zinc/20/09/78/932200978.db2.gz OQTSAIVVRHQABZ-ICSRJNTNSA-N 0 3 414.431 4.066 20 0 HIADHN CN1CC[C@H](NC(=O)c2cccc(-n3ccc(C(F)(F)F)n3)c2)[C@H]1c1ccccc1 ZINC000534019276 932201606 /nfs/dbraw/zinc/20/16/06/932201606.db2.gz OQTSAIVVRHQABZ-AZUAARDMSA-N 0 3 414.431 4.066 20 0 HIADHN Cc1cc(CN2CCC(OC[C@H]3CCOC3)CC2)nc(-c2ccc(Cl)cc2)n1 ZINC000534129741 932294547 /nfs/dbraw/zinc/29/45/47/932294547.db2.gz QMSMSJAYXDVPJR-KRWDZBQOSA-N 0 3 401.938 4.123 20 0 HIADHN CN(C)Cc1ccc(CNCc2cc(Cl)ccc2OC[C@@H]2CCCO2)cc1F ZINC000534233223 932353260 /nfs/dbraw/zinc/35/32/60/932353260.db2.gz CEVVAXQJTWETBB-FQEVSTJZSA-N 0 3 406.929 4.388 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)[C@H]2CC(=O)N(C)[C@@H]2c2ccc(Cl)c(F)c2)c1 ZINC000534285268 932375343 /nfs/dbraw/zinc/37/53/43/932375343.db2.gz ILVQJZXHBANBBZ-LAUBAEHRSA-N 0 3 417.912 4.007 20 0 HIADHN CC1(C)CCC[C@H](CN2CCN(CC(=O)Nc3ccccc3C(F)(F)F)CC2)C1 ZINC000534333199 932384526 /nfs/dbraw/zinc/38/45/26/932384526.db2.gz BMYXMQPSSJLJSG-KRWDZBQOSA-N 0 3 411.512 4.478 20 0 HIADHN O=C(CN[C@@H](C[C@H]1CCOC1)c1ccccc1)Nc1ccc(Br)cc1 ZINC000534351747 932389351 /nfs/dbraw/zinc/38/93/51/932389351.db2.gz DXZOAQYPHBZMJJ-BEFAXECRSA-N 0 3 403.320 4.145 20 0 HIADHN Cc1ccc(C(=O)Nc2cccc(CN3CCC(CO)CC3)c2)c(Br)c1 ZINC000534362618 932396269 /nfs/dbraw/zinc/39/62/69/932396269.db2.gz HIHRJLAGRRVIDV-UHFFFAOYSA-N 0 3 417.347 4.214 20 0 HIADHN Cc1c(C(=O)N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)cccc1-c1ccccn1 ZINC000534365402 932397242 /nfs/dbraw/zinc/39/72/42/932397242.db2.gz GPOUHOOCCKJVSD-KDURUIRLSA-N 0 3 407.558 4.018 20 0 HIADHN COc1cc(NC(=O)C(Cc2c(C)cc(C)cc2C)C(F)(F)F)ccc1NC(N)=O ZINC000534409775 932430025 /nfs/dbraw/zinc/43/00/25/932430025.db2.gz DCMQWGAHWPIYIE-MRXNPFEDSA-N 0 3 423.435 4.471 20 0 HIADHN CC(C)C1CCC(N2CCN(C(=O)N[C@@H](C)c3ccc([S@](C)=O)cc3)CC2)CC1 ZINC000534442513 932456747 /nfs/dbraw/zinc/45/67/47/932456747.db2.gz OJBQNZRTYAWREM-ZDDJMYFLSA-N 0 3 419.635 4.027 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@@H](C)NCc2cnc([C@H]3CCCO3)s2)CC1 ZINC000534465473 932482985 /nfs/dbraw/zinc/48/29/85/932482985.db2.gz OQVFHOWNBVWWNH-IIBYNOLFSA-N 0 3 418.582 4.126 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)CN(Cc1ccccc1)c1ccccc1 ZINC000534508305 932538583 /nfs/dbraw/zinc/53/85/83/932538583.db2.gz CFFVUDKWTZVMGV-UHFFFAOYSA-N 0 3 403.526 4.402 20 0 HIADHN O=C(Nc1cccc2c1CN(c1ccccn1)C2)N1CCN(C2CCCCC2)CC1 ZINC000534599359 932585714 /nfs/dbraw/zinc/58/57/14/932585714.db2.gz AVMZCKCQLJEMNE-UHFFFAOYSA-N 0 3 405.546 4.084 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)CCc1cc(Br)ccc1F ZINC000534633351 932610789 /nfs/dbraw/zinc/61/07/89/932610789.db2.gz TWYZACHCXPSDIY-UHFFFAOYSA-N 0 3 409.299 4.230 20 0 HIADHN CN1CC[C@H](NC(=O)NCCc2csc(-c3ccccc3)n2)[C@@H]1c1ccccc1 ZINC000534718240 932685553 /nfs/dbraw/zinc/68/55/53/932685553.db2.gz YHBRSGSDXUQCCF-SFTDATJTSA-N 0 3 406.555 4.097 20 0 HIADHN CN1CC[C@@H](NC(=O)CCCc2ccc(Br)s2)[C@H]1c1ccccc1 ZINC000534752478 932728309 /nfs/dbraw/zinc/72/83/09/932728309.db2.gz BJDBHDBQBBCDCP-VQIMIIECSA-N 0 3 407.377 4.395 20 0 HIADHN CN1CC[C@@H](NC(=O)c2cccc(NC(=O)c3cccs3)c2)[C@@H]1c1ccccc1 ZINC000534754056 932729735 /nfs/dbraw/zinc/72/97/35/932729735.db2.gz JZUXBFCKWQSPGN-CTNGQTDRSA-N 0 3 405.523 4.176 20 0 HIADHN CN1CC[C@H](NC(=O)[C@@H]2C[C@H]2c2ccccc2OC(F)(F)F)[C@H]1c1ccccc1 ZINC000534754856 932731461 /nfs/dbraw/zinc/73/14/61/932731461.db2.gz MPMGOWSWERVIKO-HLNWXESRSA-N 0 3 404.432 4.250 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)N1CC[C@H](Oc2cccc(Cl)c2)C1 ZINC000534777437 932757997 /nfs/dbraw/zinc/75/79/97/932757997.db2.gz TUKSLXXYKPSPRV-SFHVURJKSA-N 0 3 403.910 4.095 20 0 HIADHN CC(C)Cn1ncc(NC(=O)NC[C@@H]2CCCN2Cc2ccccc2)c1C(F)F ZINC000534822632 932793988 /nfs/dbraw/zinc/79/39/88/932793988.db2.gz JPKODNCQCVYXOF-KRWDZBQOSA-N 0 3 405.493 4.263 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3ccc(C(F)(F)F)nc3)c(C)c2)CC1 ZINC000534909763 932834221 /nfs/dbraw/zinc/83/42/21/932834221.db2.gz ZFKKRLAPRCRTGP-UHFFFAOYSA-N 0 3 407.440 4.195 20 0 HIADHN CN(C)[C@@H](CNC(=O)Nc1cccc(C(=O)NCc2ccccc2)c1)c1ccccc1 ZINC000534959637 932860253 /nfs/dbraw/zinc/86/02/53/932860253.db2.gz DLOYPMKXRBDNEF-QHCPKHFHSA-N 0 3 416.525 4.041 20 0 HIADHN CCCCCOc1ccc(Br)cc1CN(C)C[C@H]1CCN(C(C)=O)C1 ZINC000535091728 932903556 /nfs/dbraw/zinc/90/35/56/932903556.db2.gz HFZFLFDSCJBWGM-QGZVFWFLSA-N 0 3 411.384 4.318 20 0 HIADHN COc1ccc(C(=O)N(CCN2CCCC2)c2ccccc2)cc1-c1ccccn1 ZINC000535096178 932911356 /nfs/dbraw/zinc/91/13/56/932911356.db2.gz PUWJJPZOCRNIHV-UHFFFAOYSA-N 0 3 401.510 4.500 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N(C)[C@H]1CCSC1)c1ccc(C(F)(F)F)cc1 ZINC000535219200 933023457 /nfs/dbraw/zinc/02/34/57/933023457.db2.gz IIZDSYGGYKGEKZ-IRXDYDNUSA-N 0 3 403.514 4.235 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)c3cccc(C)c3Br)cc2)CC1 ZINC000535243739 933034751 /nfs/dbraw/zinc/03/47/51/933034751.db2.gz WTJXGVRHSCFEMQ-UHFFFAOYSA-N 0 3 416.363 4.147 20 0 HIADHN Cc1ccc(C[C@H](NC(=O)NC[C@H](Cc2ccccc2)N(C)C)c2ccccn2)cc1 ZINC000535263392 933041336 /nfs/dbraw/zinc/04/13/36/933041336.db2.gz YTOVBHIGCVFFBN-ZCYQVOJMSA-N 0 3 416.569 4.146 20 0 HIADHN Cc1cc(C(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)ccc1Br ZINC000535287605 933051300 /nfs/dbraw/zinc/05/13/00/933051300.db2.gz JKDJBBHGPYJBFZ-IAGOWNOFSA-N 0 3 423.395 4.109 20 0 HIADHN CN1CC[C@@H](NC(=O)NCc2csc(CCc3ccccc3)n2)[C@@H]1c1ccccc1 ZINC000535429988 933130631 /nfs/dbraw/zinc/13/06/31/933130631.db2.gz IFIVSCXVEQZJOQ-GGAORHGYSA-N 0 3 420.582 4.173 20 0 HIADHN CN1CC[C@@H](NC(=O)N(Cc2ccccc2)CC2CCOCC2)[C@H]1c1ccccc1 ZINC000535433620 933133739 /nfs/dbraw/zinc/13/37/39/933133739.db2.gz UWYRBDIVVVOBMG-DNQXCXABSA-N 0 3 407.558 4.070 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2cccc3c2CN(c2nccs2)C3)N(C)C)cc1 ZINC000535477425 933169961 /nfs/dbraw/zinc/16/99/61/933169961.db2.gz VJUYBPWEVWQUQL-OAQYLSRUSA-N 0 3 421.570 4.396 20 0 HIADHN Cc1cc(C(=O)NCc2ccccc2CN(C)C)ccc1NC(=O)c1cccs1 ZINC000535479358 933171223 /nfs/dbraw/zinc/17/12/23/933171223.db2.gz KDYMQNFMFSSHLW-UHFFFAOYSA-N 0 3 407.539 4.300 20 0 HIADHN CCOc1ccc(F)c(NC(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)c1F ZINC000535493969 933181937 /nfs/dbraw/zinc/18/19/37/933181937.db2.gz CUPQGBBDANPCSN-MRXNPFEDSA-N 0 3 403.473 4.492 20 0 HIADHN Cc1c(Cl)cc(F)c(NC(=O)N2CCC(CN3C[C@H](C)O[C@@H](C)C3)CC2)c1F ZINC000535621992 933272233 /nfs/dbraw/zinc/27/22/33/933272233.db2.gz NIVQSQRDMIQCQU-STQMWFEESA-N 0 3 415.912 4.280 20 0 HIADHN Clc1ccc(-n2cc(CN[C@H]3CCOC4(CCSCC4)C3)nn2)c(Cl)c1 ZINC000535941984 933508726 /nfs/dbraw/zinc/50/87/26/933508726.db2.gz DLQGGNWRGUMEJA-AWEZNQCLSA-N 0 3 413.374 4.109 20 0 HIADHN Cc1nc2ccccc2n1C[C@H]1CCCN1CC(=O)N(Cc1ccccc1)C1CC1 ZINC000535962019 933527529 /nfs/dbraw/zinc/52/75/29/933527529.db2.gz CTMOZLQJRGJWFI-JOCHJYFZSA-N 0 3 402.542 4.000 20 0 HIADHN Cc1nc2ccccc2n1C[C@@H]1CCCN1CC(=O)N[C@H]1CCCc2ccccc21 ZINC000535965814 933528237 /nfs/dbraw/zinc/52/82/37/933528237.db2.gz NDHHKRVCPFDQHW-UNMCSNQZSA-N 0 3 402.542 4.003 20 0 HIADHN CC(=O)N(c1nc(CN2CCN(CCC(C)(C)C)CC2)cs1)c1ccccc1 ZINC000535979018 933543593 /nfs/dbraw/zinc/54/35/93/933543593.db2.gz SZWLBFDDGWMGEV-UHFFFAOYSA-N 0 3 400.592 4.382 20 0 HIADHN Cc1nc(CN2CCC(CN[C@H](C)c3ncc(Br)s3)CC2)oc1C ZINC000535989546 933552185 /nfs/dbraw/zinc/55/21/85/933552185.db2.gz VOAZUHITBKJNDF-GFCCVEGCSA-N 0 3 413.385 4.073 20 0 HIADHN CC1CCC(N2CCN(C(=O)c3ccc(C(=O)N(C)c4ccccc4)cc3)CC2)CC1 ZINC000536003175 933561917 /nfs/dbraw/zinc/56/19/17/933561917.db2.gz OMHOYZBBXUCVMF-UHFFFAOYSA-N 0 3 419.569 4.300 20 0 HIADHN Cc1ccccc1[C@@H](NCC(=O)Nc1ccccc1I)C1CC1 ZINC000537288405 933698234 /nfs/dbraw/zinc/69/82/34/933698234.db2.gz YBQGSBDNGXOJBV-IBGZPJMESA-N 0 3 420.294 4.279 20 0 HIADHN CCO[C@@H]1C[C@H](N[C@H](c2ccc(C)cc2)c2cccc(S(C)(=O)=O)c2)C1(C)C ZINC000537289935 933699888 /nfs/dbraw/zinc/69/98/88/933699888.db2.gz ZGRZREAQLJPZKO-BHDDXSALSA-N 0 3 401.572 4.281 20 0 HIADHN C[C@@H](COc1ccc2cc(Br)ccc2c1)NCc1ccnc(N(C)C)n1 ZINC000537306564 933708067 /nfs/dbraw/zinc/70/80/67/933708067.db2.gz KEGVVUYUSJXYIA-AWEZNQCLSA-N 0 3 415.335 4.015 20 0 HIADHN CNS(=O)(=O)c1ccc([C@@H](C)NC2(c3cccc(Br)c3)CCC2)cc1 ZINC000537422794 933770413 /nfs/dbraw/zinc/77/04/13/933770413.db2.gz QYYKEKVJYXFZLT-CQSZACIVSA-N 0 3 423.376 4.087 20 0 HIADHN Cc1cc(C(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)nn1-c1cccc(Cl)c1 ZINC000537461880 933785415 /nfs/dbraw/zinc/78/54/15/933785415.db2.gz MQKDPQZWFROCEB-NRFANRHFSA-N 0 3 408.933 4.181 20 0 HIADHN Fc1ccc(CNc2ccc3nc(CCN4CCOCC4)[nH]c3c2)cc1C(F)(F)F ZINC000537505804 933796990 /nfs/dbraw/zinc/79/69/90/933796990.db2.gz JTAWAXPSAIGIMM-UHFFFAOYSA-N 0 3 422.426 4.208 20 0 HIADHN CCNC(=O)[C@H](C)N[C@H]1CCCc2nc(-c3ccccc3Br)sc21 ZINC000537519877 933798864 /nfs/dbraw/zinc/79/88/64/933798864.db2.gz KFXGZZVRBOJKBU-FZMZJTMJSA-N 0 3 408.365 4.064 20 0 HIADHN Clc1cccc([C@H](CNCc2conc2Cc2ccccc2)N2CCOCC2)c1 ZINC000562768591 945118880 /nfs/dbraw/zinc/11/88/80/945118880.db2.gz YGMVZVAEORYQHK-QHCPKHFHSA-N 0 3 411.933 4.082 20 0 HIADHN CN(CCCN(C)C(=O)[C@@H]1C[C@@H]1c1cc(Cl)cc(Cl)c1)Cc1ccncc1 ZINC000562857292 945128380 /nfs/dbraw/zinc/12/83/80/945128380.db2.gz OCAXNQGJIFXARP-WOJBJXKFSA-N 0 3 406.357 4.472 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)N[C@H]1CCCOc2cc(F)ccc21 ZINC000537564803 938326491 /nfs/dbraw/zinc/32/64/91/938326491.db2.gz JKWHAWALYBKRHM-ROUUACIJSA-N 0 3 403.523 4.237 20 0 HIADHN CC[C@@H](C)n1nc(C(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)cc1C ZINC000537588257 938329607 /nfs/dbraw/zinc/32/96/07/938329607.db2.gz CFTZKFJXGOXLCD-OAHLLOKOSA-N 0 3 410.484 4.385 20 0 HIADHN COc1cccc(CN(Cc2cc3c(cc2OC)C[C@@H](C)O3)C2CCC(O)CC2)c1 ZINC000537614405 938333264 /nfs/dbraw/zinc/33/32/64/938333264.db2.gz QCOBJUNUFVUTAA-PPNDLDFTSA-N 0 3 411.542 4.333 20 0 HIADHN OCCOC1CCN(Cc2cn(-c3ccccc3)nc2-c2cc3ccccc3o2)CC1 ZINC000537622525 938337525 /nfs/dbraw/zinc/33/75/25/938337525.db2.gz AGLFYSMAEUAMAE-UHFFFAOYSA-N 0 3 417.509 4.259 20 0 HIADHN COC(=O)[C@@H]1CC12CCN(Cc1cn(-c3ccccc3)nc1-c1cccs1)CC2 ZINC000537625048 938337958 /nfs/dbraw/zinc/33/79/58/938337958.db2.gz HGXKDPJKXYHAQC-IBGZPJMESA-N 0 3 407.539 4.376 20 0 HIADHN Cc1nn(Cc2ccc(C)cc2)c(C)c1CN1CCC[C@H](CNC(=O)C(C)(C)C)C1 ZINC000537630566 938340966 /nfs/dbraw/zinc/34/09/66/938340966.db2.gz AYKADCHXKUKJRS-JOCHJYFZSA-N 0 3 410.606 4.231 20 0 HIADHN CC[C@@](C)(COc1ncccc1Cl)NCC(=O)N(C)c1nc2ccccc2s1 ZINC000537682487 938352993 /nfs/dbraw/zinc/35/29/93/938352993.db2.gz VGTOSPBKCIRCFP-FQEVSTJZSA-N 0 3 418.950 4.145 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@H](C)Oc2ccc(SC)cc2)cc1 ZINC000537728223 938364010 /nfs/dbraw/zinc/36/40/10/938364010.db2.gz JCIDLGVEKQUQHT-HTAPYJJXSA-N 0 3 414.571 4.138 20 0 HIADHN c1cnn(Cc2ccc(CNCc3cn(-c4ccccc4)nc3-c3cccnc3)cc2)c1 ZINC000537755063 938369989 /nfs/dbraw/zinc/36/99/89/938369989.db2.gz FPBJABLIHMBLPI-UHFFFAOYSA-N 0 3 420.520 4.469 20 0 HIADHN CN(C)C(=O)COc1cccc(CN[C@H]2CCCc3ccc(Br)cc32)c1 ZINC000537763348 938372028 /nfs/dbraw/zinc/37/20/28/938372028.db2.gz JVKSNEWINZWFFR-FQEVSTJZSA-N 0 3 417.347 4.083 20 0 HIADHN Cc1ccc(NC(=O)C[C@H](C)N[C@@H]2CC(=O)N(c3c(F)cccc3F)C2)c(Cl)c1 ZINC000537767596 938372942 /nfs/dbraw/zinc/37/29/42/938372942.db2.gz KHAJHSRFJRNGMX-UONOGXRCSA-N 0 3 421.875 4.039 20 0 HIADHN COCCn1ccc2ccc(NC(=O)N[C@@H]3CCCN(Cc4ccccc4)C3)cc21 ZINC000537802660 938380048 /nfs/dbraw/zinc/38/00/48/938380048.db2.gz PEZTUKHDKOQXNU-JOCHJYFZSA-N 0 3 406.530 4.074 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N2CCC(Cc3cccnc3)CC2)N2CCCC2)cc1 ZINC000537817808 938383637 /nfs/dbraw/zinc/38/36/37/938383637.db2.gz LJIKILISPMKGHK-XMMPIXPASA-N 0 3 406.574 4.191 20 0 HIADHN Cc1cc([C@H](C)NCc2ccccc2CS(=O)(=O)N2CCCC2)cc(C)c1F ZINC000537938198 938423607 /nfs/dbraw/zinc/42/36/07/938423607.db2.gz PKYNMIILUOYYKJ-SFHVURJKSA-N 0 3 404.551 4.219 20 0 HIADHN COC(=O)c1ccc(CN[C@H](C)CC(=O)Nc2ccccc2C(F)(F)F)cc1OC ZINC000537939305 938424609 /nfs/dbraw/zinc/42/46/09/938424609.db2.gz KWCQUUFDBVVPIB-CYBMUJFWSA-N 0 3 424.419 4.008 20 0 HIADHN COc1cc(NC(C)=O)ccc1[C@@H](C)N[C@@H]1CCN(c2ccc(Cl)c(F)c2)C1 ZINC000537941645 938425077 /nfs/dbraw/zinc/42/50/77/938425077.db2.gz YPSUATVKKJDWDB-CZUORRHYSA-N 0 3 405.901 4.376 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)N[C@@H](CO)c2ccc(Br)cc2)cc1 ZINC000537941552 938425095 /nfs/dbraw/zinc/42/50/95/938425095.db2.gz VCLSPADKFDDTCK-XOBRGWDASA-N 0 3 400.320 4.327 20 0 HIADHN C[C@H](N[C@@H](C)[C@@H](OC1CCOCC1)c1ccccc1)c1ccc(S(C)(=O)=O)cc1 ZINC000537949209 938428650 /nfs/dbraw/zinc/42/86/50/938428650.db2.gz WSKAZRARSGOLKM-IUKKYPGJSA-N 0 3 417.571 4.066 20 0 HIADHN COc1cc(C)cc(CN[C@@H](C)c2ccc(S(=O)(=O)N3CCCCC3)cc2)c1 ZINC000537947730 938428830 /nfs/dbraw/zinc/42/88/30/938428830.db2.gz HWPIJJALDYGZHG-SFHVURJKSA-N 0 3 402.560 4.029 20 0 HIADHN CC(C)CC[C@@H](NC[C@H](O)CS(=O)(=O)c1cccs1)c1ccc(Cl)cc1 ZINC000537953943 938431947 /nfs/dbraw/zinc/43/19/47/938431947.db2.gz NUGINISTCNLCJH-ZWKOTPCHSA-N 0 3 416.008 4.303 20 0 HIADHN Cc1ccccc1NC(=O)C[C@H](C)N[C@H](c1ccc(Cl)cc1)[C@@H]1CN(C)CCO1 ZINC000537963371 938436348 /nfs/dbraw/zinc/43/63/48/938436348.db2.gz JMTKJMFQHHBPET-JWNTYJGQSA-N 0 3 415.965 4.027 20 0 HIADHN Cc1c([C@H](C)NCc2cccc(CN3CCCC3=O)c2)cnn1-c1ccc(F)cc1 ZINC000537968183 938439008 /nfs/dbraw/zinc/43/90/08/938439008.db2.gz UAPVIFMLVMLTKH-KRWDZBQOSA-N 0 3 406.505 4.293 20 0 HIADHN CCCCOc1ccc([C@@H](C)NCc2cccc(NS(C)(=O)=O)c2)cc1OC ZINC000537972838 938441967 /nfs/dbraw/zinc/44/19/67/938441967.db2.gz DWDAHBXUZDHEKL-MRXNPFEDSA-N 0 3 406.548 4.096 20 0 HIADHN C[C@@H](N[C@H]1CCN(c2cnn(C)c2)C1=O)c1ccc(-c2ccccc2Cl)s1 ZINC000537972103 938442020 /nfs/dbraw/zinc/44/20/20/938442020.db2.gz VZHYGJYVACUJCN-DYVFJYSZSA-N 0 3 400.935 4.258 20 0 HIADHN C[C@H](N[C@H]1CCN(c2cnn(C)c2)C1=O)c1ccc(-c2ccccc2Cl)s1 ZINC000537972104 938442041 /nfs/dbraw/zinc/44/20/41/938442041.db2.gz VZHYGJYVACUJCN-GUYCJALGSA-N 0 3 400.935 4.258 20 0 HIADHN C[C@H](N[C@H]1CCc2ccc(F)cc21)c1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000537975704 938444180 /nfs/dbraw/zinc/44/41/80/938444180.db2.gz ZFQPJKFHTKAHMN-AOMKIAJQSA-N 0 3 402.535 4.338 20 0 HIADHN CCc1cc(N2CCC[C@H](N[C@H](C)c3cc(Cl)c(OC)cc3OC)C2)ncn1 ZINC000537979936 938446594 /nfs/dbraw/zinc/44/65/94/938446594.db2.gz BROAIWLDUJIBNS-ZBFHGGJFSA-N 0 3 404.942 4.029 20 0 HIADHN CC[C@@H](N[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O)c1ccc(OC(F)F)cc1 ZINC000537982030 938447383 /nfs/dbraw/zinc/44/73/83/938447383.db2.gz HQBPYTCGLHHLST-WOJBJXKFSA-N 0 3 404.457 4.138 20 0 HIADHN COC(=O)COc1cccc(CN[C@@H]2CCCc3ccc(Br)cc32)c1 ZINC000537983941 938447911 /nfs/dbraw/zinc/44/79/11/938447911.db2.gz DRYGCWFDRYVBKJ-LJQANCHMSA-N 0 3 404.304 4.168 20 0 HIADHN Cc1ccc(-c2nc3c(s2)[C@@H](N[C@H]2CCCN(c4ccn(C)n4)C2=O)CCC3)cc1 ZINC000537983719 938448237 /nfs/dbraw/zinc/44/82/37/938448237.db2.gz WCWXAINSSWXPIO-HKUYNNGSSA-N 0 3 421.570 4.015 20 0 HIADHN CN1CCN(CCCNC(=O)c2ccccc2COC(C)(C)C)[C@@H](c2ccccc2)C1 ZINC000538010296 938460942 /nfs/dbraw/zinc/46/09/42/938460942.db2.gz ZKOOBFUBSHUGRB-XMMPIXPASA-N 0 3 423.601 4.110 20 0 HIADHN CCOc1ccc([C@@H](C)[NH2+]Cc2nnc(-c3ccc(Br)cc3)[n-]2)cc1 ZINC000538017516 938463219 /nfs/dbraw/zinc/46/32/19/938463219.db2.gz FFBFJGHAIZQMSR-CYBMUJFWSA-N 0 3 401.308 4.484 20 0 HIADHN CCNC(=O)COc1cccc(CN[C@@H]2CCCOc3cc4c(cc32)CCCC4)c1 ZINC000538019671 938464762 /nfs/dbraw/zinc/46/47/62/938464762.db2.gz FMALFHQWYJLSJO-HSZRJFAPSA-N 0 3 408.542 4.084 20 0 HIADHN CO[C@H](c1ccc(Br)cc1)[C@H](C)NCc1cc(-c2cccnc2)n[nH]1 ZINC000538022238 938466863 /nfs/dbraw/zinc/46/68/63/938466863.db2.gz GERWQJRXTXILQZ-DJJJIMSYSA-N 0 3 401.308 4.100 20 0 HIADHN Clc1ccc(N2CC[C@H](NCc3cn4ccc(Br)cc4n3)C2)cc1 ZINC000563316843 945177345 /nfs/dbraw/zinc/17/73/45/945177345.db2.gz XHBVMAJGQUWDEA-HNNXBMFYSA-N 0 3 405.727 4.119 20 0 HIADHN CCOc1ccc([C@H](N[C@@H](C)c2cccc(S(N)(=O)=O)c2)C(C)C)cc1OCC ZINC000538061504 938491229 /nfs/dbraw/zinc/49/12/29/938491229.db2.gz UHNFCTBKKCQSIF-KSFYIVLOSA-N 0 3 420.575 4.179 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)N[C@@H]1CCO[C@@H]1c1ccc(Cl)c(F)c1 ZINC000538081729 938497678 /nfs/dbraw/zinc/49/76/78/938497678.db2.gz GUXVQYHEAKTWQZ-YLJYHZDGSA-N 0 3 421.900 4.201 20 0 HIADHN COCCN(CCN(C)C)C(=O)N[C@H](c1ccc(Cl)c(C(F)(F)F)c1)C1CC1 ZINC000538108031 938504199 /nfs/dbraw/zinc/50/41/99/938504199.db2.gz QHMWIHVXLIHRIC-KRWDZBQOSA-N 0 3 421.891 4.030 20 0 HIADHN CC[C@@H](N[C@H](C)C(=O)N(C)Cc1ccc(OC)c(OC)c1)c1cccc(Cl)c1 ZINC000538125109 938511430 /nfs/dbraw/zinc/51/14/30/938511430.db2.gz LZYXTQNUZLHKIK-DNVCBOLYSA-N 0 3 404.938 4.445 20 0 HIADHN CC[C@H](N[C@H](C)C(=O)N(C)Cc1ccc(OC)c(OC)c1)c1cccc(Cl)c1 ZINC000538125107 938511630 /nfs/dbraw/zinc/51/16/30/938511630.db2.gz LZYXTQNUZLHKIK-BEFAXECRSA-N 0 3 404.938 4.445 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@@H](C)N[C@@H](CCOC)c2ccccc2)cc1 ZINC000538144419 938519712 /nfs/dbraw/zinc/51/97/12/938519712.db2.gz PUUCLCCDGPLXKT-GCJKJVERSA-N 0 3 404.576 4.146 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@@H](C)N[C@H](CCOC)c2ccccc2)cc1 ZINC000538144427 938520055 /nfs/dbraw/zinc/52/00/55/938520055.db2.gz PUUCLCCDGPLXKT-XMSQKQJNSA-N 0 3 404.576 4.146 20 0 HIADHN CC[C@H](NCC(=O)Nc1ccccc1I)c1ccc(C)cc1 ZINC000538156424 938526638 /nfs/dbraw/zinc/52/66/38/938526638.db2.gz YNRNHZNWUPGRAW-INIZCTEOSA-N 0 3 408.283 4.279 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)Nc1ccc(OC(F)(F)F)cc1)c1ccccc1-n1cccn1 ZINC000538160470 938529457 /nfs/dbraw/zinc/52/94/57/938529457.db2.gz ZRDHYEZKYSQSIS-CABCVRRESA-N 0 3 418.419 4.449 20 0 HIADHN COc1ccc(C[C@H](NCC(=O)N[C@@H](C)c2ccccc2)c2ccccc2)cc1OC ZINC000538159512 938529706 /nfs/dbraw/zinc/52/97/06/938529706.db2.gz IFYBSYDYNYXLSP-CVDCTZTESA-N 0 3 418.537 4.455 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)Nc1ccc2c(c1)OCCO2)c1ccc(OCC(F)(F)F)cc1 ZINC000538163688 938531163 /nfs/dbraw/zinc/53/11/63/938531163.db2.gz QLRSRGLYFFSOPY-KGLIPLIRSA-N 0 3 424.419 4.077 20 0 HIADHN Cc1cccc([C@H](C)NCC(=O)Nc2cc(C(F)(F)F)ccc2-n2cncn2)c1C ZINC000538186455 938543042 /nfs/dbraw/zinc/54/30/42/938543042.db2.gz ODHDOTNFDCGASQ-HNNXBMFYSA-N 0 3 417.435 4.192 20 0 HIADHN Cc1ccc(NC(=O)CN[C@H](C)c2cccc(-n3cccn3)c2)c(Br)c1 ZINC000538189217 938544749 /nfs/dbraw/zinc/54/47/49/938544749.db2.gz XTUOQCIWTHLQDE-OAHLLOKOSA-N 0 3 413.319 4.233 20 0 HIADHN CC(C)(C)c1ccc(S(=O)(=O)CCN[C@@H](c2ccccc2)[C@@H]2CCOC2)cc1 ZINC000538191255 938546310 /nfs/dbraw/zinc/54/63/10/938546310.db2.gz ROPMUDHOJJFACO-KNQAVFIVSA-N 0 3 401.572 4.125 20 0 HIADHN O=C(N[C@H]1CCO[C@@H]1c1ccc(Cl)cc1)N1CCCN(Cc2ccccc2)CC1 ZINC000538191521 938547265 /nfs/dbraw/zinc/54/72/65/938547265.db2.gz PELBIKZKCHOTPW-FCHUYYIVSA-N 0 3 413.949 4.088 20 0 HIADHN COc1cc(F)c([C@@H](C)NC[C@H](O)Cc2ccccc2C(F)(F)F)cc1OC ZINC000538198467 938550889 /nfs/dbraw/zinc/55/08/89/938550889.db2.gz SIDUUFVYGVJPIV-TZMCWYRMSA-N 0 3 401.400 4.116 20 0 HIADHN COc1cc(C(C)=O)ccc1OC[C@@H](O)CN[C@H](c1ccc(F)cc1F)C(C)(C)C ZINC000538224197 938564405 /nfs/dbraw/zinc/56/44/05/938564405.db2.gz PSUKGGDGJRLAEQ-HTAPYJJXSA-N 0 3 421.484 4.293 20 0 HIADHN O=C(CN[C@@H](C[C@@H]1CCOC1)c1ccccc1)NCC1(c2ccccc2)CCCC1 ZINC000538225879 938565221 /nfs/dbraw/zinc/56/52/21/938565221.db2.gz JMLAHBMRZMQACN-URXFXBBRSA-N 0 3 406.570 4.372 20 0 HIADHN CN(Cc1ccc(OC(F)F)cc1)C(=O)CN[C@@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000538233428 938567616 /nfs/dbraw/zinc/56/76/16/938567616.db2.gz MAHIHKSJEAWFKA-RXVVDRJESA-N 0 3 418.484 4.004 20 0 HIADHN COc1ccc(CNC(=O)[C@@H](C)N[C@@H](C)c2ccc(-c3ccncc3)cc2)cc1OC ZINC000538235835 938568704 /nfs/dbraw/zinc/56/87/04/938568704.db2.gz PYGZZVIOZDXXHB-ZWKOTPCHSA-N 0 3 419.525 4.121 20 0 HIADHN COc1ccc([C@H](NC(=O)CN[C@@H](C)c2ccc(-n3cccn3)cc2)C(C)C)cc1 ZINC000538236440 938569133 /nfs/dbraw/zinc/56/91/33/938569133.db2.gz MSSRVLMBAIHCCP-MHECFPHRSA-N 0 3 406.530 4.045 20 0 HIADHN CS(=O)(=O)c1cccc(OCCN[C@@H](Cc2ccccc2)c2ccccc2F)c1 ZINC000538257065 938576240 /nfs/dbraw/zinc/57/62/40/938576240.db2.gz IRLVQVUPEWYTJA-QHCPKHFHSA-N 0 3 413.514 4.182 20 0 HIADHN CC[C@@H]1Oc2cc([C@H](C)NCc3ccc4oc(C(=O)OC)cc4c3)ccc2NC1=O ZINC000538258468 938576763 /nfs/dbraw/zinc/57/67/63/938576763.db2.gz YXIDGQWYMIAWJB-UGSOOPFHSA-N 0 3 408.454 4.180 20 0 HIADHN O=S(=O)(CCN[C@@H](c1cccs1)C1CC1)c1ccc(Br)cc1 ZINC000538269291 938579913 /nfs/dbraw/zinc/57/99/13/938579913.db2.gz YKKFAVGWPVGIAB-MRXNPFEDSA-N 0 3 400.363 4.025 20 0 HIADHN CC(=O)Nc1cccc(NC(=O)CN[C@@H](COc2c(C)cccc2C)C(C)(C)C)c1 ZINC000538321173 938591610 /nfs/dbraw/zinc/59/16/10/938591610.db2.gz ZJZXNDIDOYFFNB-NRFANRHFSA-N 0 3 411.546 4.284 20 0 HIADHN CCN(CC)C(=O)c1cccc(NC(=O)CN[C@@H](c2ccc(F)c(C)c2)C2CC2)c1 ZINC000538321348 938591630 /nfs/dbraw/zinc/59/16/30/938591630.db2.gz BKTXXJDTRAOLEG-HSZRJFAPSA-N 0 3 411.521 4.296 20 0 HIADHN COc1ccc(OC)c([C@@H](C)NC(=O)CN[C@@H](c2ccc(F)c(C)c2)C2CC2)c1 ZINC000538324534 938593164 /nfs/dbraw/zinc/59/31/64/938593164.db2.gz VXDYDQSDCBUQKL-IQMFZBJNSA-N 0 3 400.494 4.069 20 0 HIADHN CC[C@H](NCc1cccc(OCC(=O)N(C)C)c1)c1cc(F)cc(Br)c1 ZINC000538398148 938611232 /nfs/dbraw/zinc/61/12/32/938611232.db2.gz KVTDUYMSOWOAEO-IBGZPJMESA-N 0 3 423.326 4.296 20 0 HIADHN O=C(Nc1cccc(CNCc2cccc(-n3cncn3)c2)c1)c1ccc(Cl)cc1 ZINC000538401003 938611644 /nfs/dbraw/zinc/61/16/44/938611644.db2.gz LNGMAVAVYBYKSQ-UHFFFAOYSA-N 0 3 417.900 4.463 20 0 HIADHN CC[C@H](N[C@@H](C)[C@H](OC)c1ccccc1F)c1ccccc1OCC(=O)N(C)C ZINC000538406422 938612906 /nfs/dbraw/zinc/61/29/06/938612906.db2.gz DNVNCJUGRTUDPJ-GRWTVWFQSA-N 0 3 402.510 4.110 20 0 HIADHN Brc1ccc(-c2c[nH]c(CN[C@@H]3[C@@H]4CCO[C@H]4C34CCCC4)n2)cc1 ZINC000538422887 938616732 /nfs/dbraw/zinc/61/67/32/938616732.db2.gz SCCPYBROZVWTQB-KFKAGJAMSA-N 0 3 402.336 4.277 20 0 HIADHN CCN1CCN(Cc2ccc(N[C@@H](c3ccc4[nH]c(=O)oc4c3)C(C)C)cc2)CC1 ZINC000538535944 938643749 /nfs/dbraw/zinc/64/37/49/938643749.db2.gz QIYHAYIGAAKBIR-HSZRJFAPSA-N 0 3 408.546 4.480 20 0 HIADHN Cc1cc(C(=O)N2CCCN(CCCc3ccccc3)CC2)nn1-c1ccc(F)cc1 ZINC000538577234 938653778 /nfs/dbraw/zinc/65/37/78/938653778.db2.gz OQKXIXFDJIKPAK-UHFFFAOYSA-N 0 3 420.532 4.101 20 0 HIADHN COCCC[C@H](C)C(=O)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000538654451 938674755 /nfs/dbraw/zinc/67/47/55/938674755.db2.gz ISKCRLNJGVJQSR-INIZCTEOSA-N 0 3 401.378 4.481 20 0 HIADHN CN(C(=O)NC1CC(C)(C)CC(C)(C)C1)C1CCN(CCc2ccccn2)CC1 ZINC000538661306 938676725 /nfs/dbraw/zinc/67/67/25/938676725.db2.gz FLLAWRYVSFAXSM-UHFFFAOYSA-N 0 3 400.611 4.335 20 0 HIADHN C[C@H](c1cn(-c2ccccc2)nn1)N1CCC[C@H](c2nc(C3CCCCC3)n[nH]2)C1 ZINC000538664623 938678738 /nfs/dbraw/zinc/67/87/38/938678738.db2.gz SIFVJVRCSCFQBW-MJGOQNOKSA-N 0 3 405.550 4.374 20 0 HIADHN C[C@H](c1cn(-c2ccccc2)nn1)N1CCC[C@H](c2n[nH]c(C3CCCCC3)n2)C1 ZINC000538664623 938678740 /nfs/dbraw/zinc/67/87/40/938678740.db2.gz SIFVJVRCSCFQBW-MJGOQNOKSA-N 0 3 405.550 4.374 20 0 HIADHN C[C@@H](c1cn(-c2ccccc2)nn1)N1CCC[C@H](c2nc(C3CCCCC3)n[nH]2)C1 ZINC000538664619 938679208 /nfs/dbraw/zinc/67/92/08/938679208.db2.gz SIFVJVRCSCFQBW-HKUYNNGSSA-N 0 3 405.550 4.374 20 0 HIADHN C[C@@H](c1cn(-c2ccccc2)nn1)N1CCC[C@H](c2n[nH]c(C3CCCCC3)n2)C1 ZINC000538664619 938679210 /nfs/dbraw/zinc/67/92/10/938679210.db2.gz SIFVJVRCSCFQBW-HKUYNNGSSA-N 0 3 405.550 4.374 20 0 HIADHN CN(Cc1cnc(N2CCCC2)nc1)CC1(c2ccc(Br)cc2)CC1 ZINC000538718333 938689628 /nfs/dbraw/zinc/68/96/28/938689628.db2.gz KWGIUMSMJOBGQN-UHFFFAOYSA-N 0 3 401.352 4.003 20 0 HIADHN CNC(=O)CC1CCN(Cc2ccc(OCc3c(F)cccc3Cl)cc2)CC1 ZINC000538718259 938689666 /nfs/dbraw/zinc/68/96/66/938689666.db2.gz GSIXZNVDLNUMBQ-UHFFFAOYSA-N 0 3 404.913 4.406 20 0 HIADHN COC(=O)CCn1nc(C)c(CN2CCC(Sc3ccc(Cl)cc3)CC2)c1C ZINC000538723324 938691793 /nfs/dbraw/zinc/69/17/93/938691793.db2.gz WPGQJJDZDLZSMW-UHFFFAOYSA-N 0 3 421.994 4.473 20 0 HIADHN COc1cc(CN2CCC[C@]3(CNC(=O)C3)C2)ccc1OCc1ccc(Cl)cc1 ZINC000538738422 938697460 /nfs/dbraw/zinc/69/74/60/938697460.db2.gz UUMYXDABMMFIHS-QHCPKHFHSA-N 0 3 414.933 4.030 20 0 HIADHN OCCCN(Cc1ccc(-n2cncn2)c(F)c1)C(c1ccccc1)c1ccccc1 ZINC000538739484 938697478 /nfs/dbraw/zinc/69/74/78/938697478.db2.gz NIOKGWJXXZLLQO-UHFFFAOYSA-N 0 3 416.500 4.380 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(CN(CCO)[C@@H]3CCc4ccccc43)c2)cc1 ZINC000538739598 938697845 /nfs/dbraw/zinc/69/78/45/938697845.db2.gz DTWRDRJYVKWYLF-RUZDIDTESA-N 0 3 416.521 4.429 20 0 HIADHN COc1cc(CN(CCO)[C@@H]2CCc3ccccc32)ccc1OCc1ccncc1 ZINC000538740057 938698169 /nfs/dbraw/zinc/69/81/69/938698169.db2.gz FYHWNFQNVDDQCK-HSZRJFAPSA-N 0 3 404.510 4.151 20 0 HIADHN C[C@@H]1Oc2ccc(C(=O)C3CCN(Cc4ccnc5ccccc45)CC3)cc2NC1=O ZINC000538739713 938698203 /nfs/dbraw/zinc/69/82/03/938698203.db2.gz SGXUEAOGJWYAAM-INIZCTEOSA-N 0 3 415.493 4.049 20 0 HIADHN C[C@@H](NCc1ccc(S(=O)(=O)N2CCC[C@H](C)C2)cc1)c1ccccc1N(C)C ZINC000538759977 938703801 /nfs/dbraw/zinc/70/38/01/938703801.db2.gz IRPZORTUCCWCGV-RBUKOAKNSA-N 0 3 415.603 4.024 20 0 HIADHN c1csc(-c2nn(Cc3ccccc3)cc2CN2CCC[C@@H](Cn3ccnn3)C2)c1 ZINC000538795815 938714075 /nfs/dbraw/zinc/71/40/75/938714075.db2.gz YBSVAWOVABLVBX-HXUWFJFHSA-N 0 3 418.570 4.164 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)c2cc(C)n(-c3nccs3)c2C)cc1 ZINC000538830398 938721342 /nfs/dbraw/zinc/72/13/42/938721342.db2.gz LJLXIWKSBWCRQX-OAQYLSRUSA-N 0 3 424.570 4.126 20 0 HIADHN COCCn1ccc2ccc(NC(=O)N[C@@H]3CCN([C@H](C)c4ccccc4)C3)cc21 ZINC000538906474 938735509 /nfs/dbraw/zinc/73/55/09/938735509.db2.gz ODRAIJNBRBMNER-XMSQKQJNSA-N 0 3 406.530 4.245 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)c2ccc(-c3noc(C(F)F)n3)cc2)N(C)C)cc1 ZINC000538966390 938753532 /nfs/dbraw/zinc/75/35/32/938753532.db2.gz GRDSTDWAANYYAG-GOSISDBHSA-N 0 3 414.456 4.269 20 0 HIADHN C[C@H](NCCCNC(=O)c1ccc(Br)cc1)c1nc2c(s1)CCCC2 ZINC000538983566 938759376 /nfs/dbraw/zinc/75/93/76/938759376.db2.gz DCCYDVGYXXVYRX-ZDUSSCGKSA-N 0 3 422.392 4.255 20 0 HIADHN Cc1cc(NC(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)nn1-c1ccccc1 ZINC000539017072 938769911 /nfs/dbraw/zinc/76/99/11/938769911.db2.gz XVUHQJQWXKSFJD-FQEVSTJZSA-N 0 3 403.530 4.309 20 0 HIADHN CCOc1ccc([C@@H](C)N[C@@H](C)c2ccc(S(=O)(=O)N(C)C)cc2)cc1OCC ZINC000539021192 938771521 /nfs/dbraw/zinc/77/15/21/938771521.db2.gz VVUOZTNGCUKYMW-DLBZAZTESA-N 0 3 420.575 4.146 20 0 HIADHN CCCCOc1ccc([C@@H](C)N[C@H](C)Cn2ncc3ccccc3c2=O)cc1OC ZINC000539041705 938778645 /nfs/dbraw/zinc/77/86/45/938778645.db2.gz OHZXPCHSYSYKKC-QZTJIDSGSA-N 0 3 409.530 4.323 20 0 HIADHN CCc1ccc([C@@H](CO)N[C@@H](C)CC(=O)Nc2ccc(Br)cc2)cc1 ZINC000539041898 938779002 /nfs/dbraw/zinc/77/90/02/938779002.db2.gz UKWMEYSUNNHKCT-IFXJQAMLSA-N 0 3 405.336 4.052 20 0 HIADHN CC(C)NC(=O)Nc1ccc([C@@H](C)N[C@H]2CCN(CCCc3ccccc3)C2=O)cc1 ZINC000539045643 938780883 /nfs/dbraw/zinc/78/08/83/938780883.db2.gz DLBSQIJGACOVMJ-XXBNENTESA-N 0 3 422.573 4.101 20 0 HIADHN C[C@@H](NC[C@H](CO)Cc1ccc(OC(F)(F)F)cc1)c1nc2c(s1)CCCC2 ZINC000539059639 938787187 /nfs/dbraw/zinc/78/71/87/938787187.db2.gz CWJPYPURLZKYQY-UKRRQHHQSA-N 0 3 414.493 4.422 20 0 HIADHN C[C@H](NCc1cccc(Cn2cnc3ccccc32)c1)c1ccc(S(C)(=O)=O)cc1 ZINC000539060696 938788144 /nfs/dbraw/zinc/78/81/44/938788144.db2.gz ILNKPYWVMXEERV-SFHVURJKSA-N 0 3 419.550 4.339 20 0 HIADHN Fc1ccc2c(c1)CC[C@H]2NCc1ccc(Br)cc1N1CCOCC1 ZINC000539067044 938791250 /nfs/dbraw/zinc/79/12/50/938791250.db2.gz RRSQAEFJUGQKCS-LJQANCHMSA-N 0 3 405.311 4.202 20 0 HIADHN COc1ccc(C[C@H](NC[C@@H](O)[C@H]2CCOC2)c2cc(Cl)ccc2Cl)cc1 ZINC000539073581 938794825 /nfs/dbraw/zinc/79/48/25/938794825.db2.gz OEIICTBKZRGBQA-ONGXBYRLSA-N 0 3 410.341 4.273 20 0 HIADHN C[C@@H](NCc1cccc(NS(C)(=O)=O)c1)c1ccc(SCC(F)F)cc1 ZINC000539075809 938795529 /nfs/dbraw/zinc/79/55/29/938795529.db2.gz LPUWFOTXUVRCQN-CYBMUJFWSA-N 0 3 400.516 4.266 20 0 HIADHN COCCSc1ccc([C@@H](C)N[C@@H](C)c2ccc(S(=O)(=O)N(C)C)cc2)cc1 ZINC000539076573 938796150 /nfs/dbraw/zinc/79/61/50/938796150.db2.gz GXPWEPDMCIBHCU-SJORKVTESA-N 0 3 422.616 4.087 20 0 HIADHN CCc1cc(N2CCC[C@@H](N[C@@H](COC)c3cccc(C(F)(F)F)c3)C2)ncn1 ZINC000539079009 938796812 /nfs/dbraw/zinc/79/68/12/938796812.db2.gz QHEXXKQWMNMBLP-MOPGFXCFSA-N 0 3 408.468 4.004 20 0 HIADHN COc1ccc([C@@H](C)NCCC(=O)Nc2cc(Br)ccc2C)c(OC)c1 ZINC000539077800 938796986 /nfs/dbraw/zinc/79/69/86/938796986.db2.gz BGUUWEFEZNNEEX-CQSZACIVSA-N 0 3 421.335 4.454 20 0 HIADHN C[C@@H](NC[C@H](c1cccc(Cl)c1)N1CCOCC1)c1nc2c(s1)CCCC2 ZINC000539081336 938797985 /nfs/dbraw/zinc/79/79/85/938797985.db2.gz ZSBZJHTUOWFMAT-DNVCBOLYSA-N 0 3 405.995 4.399 20 0 HIADHN Cc1ccccc1COc1ccc([C@H](C)N[C@@H]2CCCN(c3ccn(C)n3)C2=O)cc1 ZINC000539089070 938800369 /nfs/dbraw/zinc/80/03/69/938800369.db2.gz JELRVGOWIGPZDT-WMZHIEFXSA-N 0 3 418.541 4.154 20 0 HIADHN CC(C)C[C@@H](N[C@H](C)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1cccs1 ZINC000539091256 938801057 /nfs/dbraw/zinc/80/10/57/938801057.db2.gz HQCVKLWNOMXEMA-YLJYHZDGSA-N 0 3 422.616 4.207 20 0 HIADHN COc1cc(CN[C@H](C)c2sc(C(C)(C)C)nc2C)ccc1OCC(=O)N(C)C ZINC000539093924 938801994 /nfs/dbraw/zinc/80/19/94/938801994.db2.gz UXEWEKIQEVVJDQ-CQSZACIVSA-N 0 3 419.591 4.075 20 0 HIADHN CN(Cc1ccccc1)CC(C)(C)NCc1nnc(-c2ccc(Br)o2)o1 ZINC000539115539 938805014 /nfs/dbraw/zinc/80/50/14/938805014.db2.gz PRWWQNXARFPFTE-UHFFFAOYSA-N 0 3 419.323 4.092 20 0 HIADHN C[C@H](NCc1nc(-c2ccc(F)cc2)n[nH]1)c1ccc(I)cc1 ZINC000539119418 938805426 /nfs/dbraw/zinc/80/54/26/938805426.db2.gz BYMSDXGUEPJZLX-NSHDSACASA-N 0 3 422.245 4.066 20 0 HIADHN C[C@H]([NH2+]Cc1nnc(-c2ccc(F)cc2)[n-]1)c1ccc(I)cc1 ZINC000539119418 938805427 /nfs/dbraw/zinc/80/54/27/938805427.db2.gz BYMSDXGUEPJZLX-NSHDSACASA-N 0 3 422.245 4.066 20 0 HIADHN C[C@@H]1Cc2ccc(F)cc2[C@@H]1[NH2+]Cc1nnc(-c2ccc(Br)cc2)[n-]1 ZINC000539121105 938805850 /nfs/dbraw/zinc/80/58/50/938805850.db2.gz AINSGIGKXZPQOV-ADLMAVQZSA-N 0 3 401.283 4.396 20 0 HIADHN COc1ccc(CCNCc2ccc(OC)c(OC)c2Cl)c(Cl)c1OC ZINC000563503481 945206366 /nfs/dbraw/zinc/20/63/66/945206366.db2.gz YASGPTDZJMYDDP-UHFFFAOYSA-N 0 3 400.302 4.360 20 0 HIADHN C[C@@H](NCc1ccc(Sc2ccc(F)cc2)cc1)c1ccc(S(N)(=O)=O)cc1 ZINC000539198344 938818299 /nfs/dbraw/zinc/81/82/99/938818299.db2.gz IICLTOFKZRRLGU-OAHLLOKOSA-N 0 3 416.543 4.475 20 0 HIADHN CC(C)[C@H](N[C@@H](C)c1cccc(S(N)(=O)=O)c1)c1ccc(C(F)(F)F)cc1 ZINC000539217396 938820175 /nfs/dbraw/zinc/82/01/75/938820175.db2.gz NUMCHEVJNGVFBL-UGSOOPFHSA-N 0 3 400.466 4.401 20 0 HIADHN COc1ccccc1OCCN[C@@H](CN1CCCC1=O)c1cccc(C(F)(F)F)c1 ZINC000539221691 938820749 /nfs/dbraw/zinc/82/07/49/938820749.db2.gz AEQISPPGXMRZEC-SFHVURJKSA-N 0 3 422.447 4.046 20 0 HIADHN CC[C@H](NCC(=O)N(CC)Cc1ccc(OC)c(OC)c1)c1cccc(Cl)c1 ZINC000539229368 938822484 /nfs/dbraw/zinc/82/24/84/938822484.db2.gz HBRPSTOBQBVGKM-IBGZPJMESA-N 0 3 404.938 4.447 20 0 HIADHN O=C(CNC1(c2ccc3c(c2)OCCO3)CCCC1)Nc1ccc(F)cc1Cl ZINC000539242988 938824496 /nfs/dbraw/zinc/82/44/96/938824496.db2.gz DDIUJKPENYYCPI-UHFFFAOYSA-N 0 3 404.869 4.248 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(Br)cc1)C(=O)N[C@@H]1CCOc2ccccc21 ZINC000539246537 938825239 /nfs/dbraw/zinc/82/52/39/938825239.db2.gz MYTXNSTWHUBTOF-HBUWYVDXSA-N 0 3 403.320 4.128 20 0 HIADHN COc1cc([C@@H](C)N[C@@H]2CCCN(CC(F)(F)F)C2=O)ccc1OC1CCCC1 ZINC000539253921 938827229 /nfs/dbraw/zinc/82/72/29/938827229.db2.gz JCSPZHBOXMJILE-RHSMWYFYSA-N 0 3 414.468 4.221 20 0 HIADHN Cc1ccccc1[C@H](NCC(=O)N1CCC(C(=O)Nc2ccccc2)CC1)C(C)C ZINC000539261502 938829238 /nfs/dbraw/zinc/82/92/38/938829238.db2.gz QQQXHTWHBJLIAF-XMMPIXPASA-N 0 3 407.558 4.159 20 0 HIADHN COc1ccc([C@H](Cc2ccc(F)cc2)NCC(=O)N2CCc3sccc3C2)cc1 ZINC000539273866 938831514 /nfs/dbraw/zinc/83/15/14/938831514.db2.gz JJOYRUNLDGGNBF-QFIPXVFZSA-N 0 3 424.541 4.354 20 0 HIADHN CC[C@H](N[C@H](C)C(=O)N1CCC[C@@H]1c1cccs1)c1ccc2c(c1)OCCO2 ZINC000539276848 938831864 /nfs/dbraw/zinc/83/18/64/938831864.db2.gz QTOZIXWIVMVIBV-BPQIPLTHSA-N 0 3 400.544 4.312 20 0 HIADHN CCOc1ccc([C@H]2CCCN2C(=O)CN[C@H](CC)c2ccc3c(c2)OCCO3)cc1 ZINC000539279845 938832431 /nfs/dbraw/zinc/83/24/31/938832431.db2.gz LZMDVACRSQFENG-FGZHOGPDSA-N 0 3 424.541 4.261 20 0 HIADHN C[C@@H](N[C@H](C)c1cccc(-n2cccn2)c1)C(=O)Nc1ccc(OC(F)F)cc1 ZINC000539289796 938834376 /nfs/dbraw/zinc/83/43/76/938834376.db2.gz QKEJLFQNMHTKEO-HUUCEWRRSA-N 0 3 400.429 4.152 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)Nc1ccc(OC(F)F)cc1)c1cccc(-n2cccn2)c1 ZINC000539289792 938834460 /nfs/dbraw/zinc/83/44/60/938834460.db2.gz QKEJLFQNMHTKEO-CABCVRRESA-N 0 3 400.429 4.152 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)N[C@H]1CCO[C@H]1c1ccc(Cl)cc1 ZINC000539292547 938835026 /nfs/dbraw/zinc/83/50/26/938835026.db2.gz FHZDBZJECGKUOX-SFTDATJTSA-N 0 3 419.928 4.083 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CNC(=O)CNC1(c2ccccc2)CCCC1 ZINC000539297288 938835937 /nfs/dbraw/zinc/83/59/37/938835937.db2.gz KERCMUHTGZEYBS-UHFFFAOYSA-N 0 3 416.569 4.224 20 0 HIADHN O=C(CN[C@H](c1ccccc1)[C@@H]1CCOC1)N[C@@H](c1cccs1)c1ccc(F)cc1 ZINC000539297579 938835960 /nfs/dbraw/zinc/83/59/60/938835960.db2.gz HGKAKKNBWISVKQ-CTUHWIOQSA-N 0 3 424.541 4.460 20 0 HIADHN CC(C)C[C@H](NCC(=O)Nc1ccccc1SCC(N)=O)c1ccc(Cl)cc1 ZINC000539296922 938835995 /nfs/dbraw/zinc/83/59/95/938835995.db2.gz GITOXRFQQWOURK-SFHVURJKSA-N 0 3 419.978 4.233 20 0 HIADHN CC(C)COc1ccc(C(C)(C)NCC(=O)NC[C@@H]2CCN(c3ccccc3)C2)cc1 ZINC000539317116 938839987 /nfs/dbraw/zinc/83/99/87/938839987.db2.gz MONRCTLXXJLGGG-NRFANRHFSA-N 0 3 423.601 4.189 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(-n2cccn2)cc1)C(=O)N(C)Cc1nc2ccccc2s1 ZINC000539336344 938844151 /nfs/dbraw/zinc/84/41/51/938844151.db2.gz IGEQCDLPRAQBJD-DLBZAZTESA-N 0 3 419.554 4.180 20 0 HIADHN CCOc1ccc([C@H]2CCCN2C(=O)CN[C@H](C)c2ccc(-n3cccn3)cc2)cc1 ZINC000539337723 938844366 /nfs/dbraw/zinc/84/43/66/938844366.db2.gz USNMFBHNMZWMDX-NTKDMRAZSA-N 0 3 418.541 4.285 20 0 HIADHN CCOc1ccc([C@@H]2CCCN2C(=O)CN[C@H](C)c2ccc(-n3cccn3)cc2)cc1 ZINC000539337719 938844374 /nfs/dbraw/zinc/84/43/74/938844374.db2.gz USNMFBHNMZWMDX-DVECYGJZSA-N 0 3 418.541 4.285 20 0 HIADHN COc1cc(OC)c(OC)cc1CNC(=O)CN[C@@H](c1cccc(C)c1)C(C)(C)C ZINC000539338648 938844709 /nfs/dbraw/zinc/84/47/09/938844709.db2.gz YRNATDIJMOEFEB-QHCPKHFHSA-N 0 3 414.546 4.014 20 0 HIADHN CNC(=O)C(C)(C)CN[C@H](Cc1ccccc1F)c1ccccc1Br ZINC000539369674 938850289 /nfs/dbraw/zinc/85/02/89/938850289.db2.gz YJZVICFYYRTCBR-GOSISDBHSA-N 0 3 407.327 4.234 20 0 HIADHN COc1ccc([C@@H](Cc2ccncc2)NCc2cc(F)ccc2N2CCOCC2)cc1 ZINC000563523871 945210570 /nfs/dbraw/zinc/21/05/70/945210570.db2.gz XIZPEHBKJGWLIK-XMMPIXPASA-N 0 3 421.516 4.140 20 0 HIADHN COC(=O)[C@H]1CCCC[C@@]1(C)NCc1ccnc(-c2ccc(Br)cc2)n1 ZINC000539479091 938866380 /nfs/dbraw/zinc/86/63/80/938866380.db2.gz FBUOSMLWVIOCCQ-YLJYHZDGSA-N 0 3 418.335 4.118 20 0 HIADHN Cc1ccc(NC(=O)[C@H](C)N[C@H](c2ccc3c(c2)OCCO3)C2CC2)c(Cl)c1 ZINC000539492367 938867808 /nfs/dbraw/zinc/86/78/08/938867808.db2.gz RLUZCMAHLGLZLL-QKKBWIMNSA-N 0 3 400.906 4.488 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CNC(=O)CN[C@H](c1ccccc1C)C1CC1 ZINC000539492225 938867817 /nfs/dbraw/zinc/86/78/17/938867817.db2.gz LQAJWZPPHNZVKD-SANMLTNESA-N 0 3 416.569 4.214 20 0 HIADHN C[C@@H](N[C@H](c1ccc2c(c1)OCCO2)C1CC1)C(=O)Nc1ccccc1OC(F)F ZINC000539493031 938868285 /nfs/dbraw/zinc/86/82/85/938868285.db2.gz GPHDWGNQYSCZMT-XCLFUZPHSA-N 0 3 418.440 4.127 20 0 HIADHN C[C@H](NC[C@H](O)COc1ccc2c(c1)CCC(=O)N2)c1cc2cc(Cl)ccc2o1 ZINC000539498930 938869137 /nfs/dbraw/zinc/86/91/37/938869137.db2.gz WUIMUURLNLRPGP-GUYCJALGSA-N 0 3 414.889 4.061 20 0 HIADHN C[C@@H](NC[C@H](O)COc1ccc2c(c1)CCC(=O)N2)c1cc2cc(Cl)ccc2o1 ZINC000539498929 938869158 /nfs/dbraw/zinc/86/91/58/938869158.db2.gz WUIMUURLNLRPGP-DYVFJYSZSA-N 0 3 414.889 4.061 20 0 HIADHN CCc1nn(C)c(CC)c1CNC1(c2cccc(Br)c2)CCOCC1 ZINC000539499640 938869253 /nfs/dbraw/zinc/86/92/53/938869253.db2.gz ZHKVNWZRILUJDU-UHFFFAOYSA-N 0 3 406.368 4.103 20 0 HIADHN CC(C)N1CCN([C@@H]2CCN(C(=O)N[C@H]3C[C@H]4CCC(C)(C)c5cccc3c54)C2)CC1 ZINC000539566726 938880921 /nfs/dbraw/zinc/88/09/21/938880921.db2.gz SOIGJKBHNFRCPX-VIZSFHNOSA-N 0 3 424.633 4.096 20 0 HIADHN NC(=O)c1csc(CNCCOc2c(Cl)cc(Br)cc2Cl)c1 ZINC000539588783 938884176 /nfs/dbraw/zinc/88/41/76/938884176.db2.gz HJMSTDRQHCCZDF-UHFFFAOYSA-N 0 3 424.147 4.085 20 0 HIADHN Cc1ccc([C@H](N[C@H]2CCO[C@H](C(C)C)C2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000539611934 938887828 /nfs/dbraw/zinc/88/78/28/938887828.db2.gz MNYLKMSESCGYSM-PMVMPFDFSA-N 0 3 401.572 4.281 20 0 HIADHN CCN1CCN(Cc2ccc(N[C@@H](C)c3ccc(-n4cncn4)cc3Cl)cc2)CC1 ZINC000539636571 938891746 /nfs/dbraw/zinc/89/17/46/938891746.db2.gz FUVSULMMIUWZAJ-SFHVURJKSA-N 0 3 424.980 4.231 20 0 HIADHN CCN1CCN(Cc2ccc(N[C@H](C)c3cnn(Cc4ccccc4)c3)cc2)CC1 ZINC000539636007 938891775 /nfs/dbraw/zinc/89/17/75/938891775.db2.gz PVZFCSUTVLVEPF-OAQYLSRUSA-N 0 3 403.574 4.242 20 0 HIADHN C[C@@H](NC1(c2cccc(Br)c2)CC1)c1ccc(NS(C)(=O)=O)cc1 ZINC000539652848 938894488 /nfs/dbraw/zinc/89/44/88/938894488.db2.gz FHODQICABQDYKX-CYBMUJFWSA-N 0 3 409.349 4.161 20 0 HIADHN CC[C@@H](C)Oc1cc(C(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)ccn1 ZINC000539665614 938897099 /nfs/dbraw/zinc/89/70/99/938897099.db2.gz DOERZKSSJKDMLM-NQIIRXRSSA-N 0 3 419.529 4.155 20 0 HIADHN O=C(CN1CCC[C@H]1C1CCOCC1)Nc1cc(C2CCCC2)nn1-c1ccccc1 ZINC000539727269 938914572 /nfs/dbraw/zinc/91/45/72/938914572.db2.gz RVPJKPFRLYTSCX-QHCPKHFHSA-N 0 3 422.573 4.359 20 0 HIADHN NC(=O)[C@@H](N[C@@H]1CC=C(c2ccc(F)cc2)CC1)c1ccc(Br)cc1 ZINC000539754171 938922049 /nfs/dbraw/zinc/92/20/49/938922049.db2.gz JNWFXGKYVJQYFU-MOPGFXCFSA-N 0 3 403.295 4.340 20 0 HIADHN CC[C@@H](C)[C@H](NCc1cccc2nccn21)C(=O)Nc1cccc(N2CCCC2)c1 ZINC000539853395 938958307 /nfs/dbraw/zinc/95/83/07/938958307.db2.gz BQUBZUAHUJQLQU-JPYJTQIMSA-N 0 3 405.546 4.078 20 0 HIADHN COc1cc2c(c(OC)c1OC)CCN(Cc1cnc(-c3ccsc3)s1)CC2 ZINC000539861402 938959765 /nfs/dbraw/zinc/95/97/65/938959765.db2.gz PBYRAZSNCJTPAY-UHFFFAOYSA-N 0 3 416.568 4.498 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(C)c1CN1CCC(OC[C@@H]2CCCCO2)CC1 ZINC000539863103 938960813 /nfs/dbraw/zinc/96/08/13/938960813.db2.gz HQWLPNGLVZVFFY-QFIPXVFZSA-N 0 3 401.526 4.178 20 0 HIADHN CC(C)[C@H](Oc1cccc(Cl)c1)C(=O)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000539877603 938964045 /nfs/dbraw/zinc/96/40/45/938964045.db2.gz RIJSIKJHDYVIIK-QFIPXVFZSA-N 0 3 416.949 4.339 20 0 HIADHN CC[C@@H]1CN(Cc2ccc(OCCOc3ccccc3Cl)c(OC)c2)C[C@@H]1O ZINC000539897650 938971184 /nfs/dbraw/zinc/97/11/84/938971184.db2.gz UVASEBNFLSTWGQ-MJGOQNOKSA-N 0 3 405.922 4.009 20 0 HIADHN COc1cc(C)c(C[NH+]2CCC(C(=O)Nc3cc(Cl)ccc3[O-])CC2)cc1OC ZINC000539897371 938971314 /nfs/dbraw/zinc/97/13/14/938971314.db2.gz LEVNDDOUBPBRHF-UHFFFAOYSA-N 0 3 418.921 4.222 20 0 HIADHN Cc1ccc(S(=O)(=O)N2CCC(NCc3cc(Cl)sc3Cl)CC2)cc1 ZINC000539967895 938982417 /nfs/dbraw/zinc/98/24/17/938982417.db2.gz JXAWMOWJEJQSMO-UHFFFAOYSA-N 0 3 419.399 4.306 20 0 HIADHN COc1cccc(COc2cccc(Cl)c2CN[C@@H]2CCO[C@]3(CCOC3)C2)c1 ZINC000539976871 939028331 /nfs/dbraw/zinc/02/83/31/939028331.db2.gz FNVOOKDIWCANKE-WZONZLPQSA-N 0 3 417.933 4.355 20 0 HIADHN O=C(Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1)C1CCSCC1 ZINC000540030203 939044304 /nfs/dbraw/zinc/04/43/04/939044304.db2.gz JVQAKAJTAMFUEX-UHFFFAOYSA-N 0 3 409.599 4.133 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)Nc1ccc2[nH]c(C(F)F)nc2c1 ZINC000540081304 939062261 /nfs/dbraw/zinc/06/22/61/939062261.db2.gz CUZXMXWKWMKNHK-UHFFFAOYSA-N 0 3 405.424 4.235 20 0 HIADHN C[C@H](CN[C@@H](C)c1ccc(-c2ccc(Br)cc2)s1)S(C)(=O)=O ZINC000540141191 939088934 /nfs/dbraw/zinc/08/89/34/939088934.db2.gz YWOKKFMHCSWEBR-NEPJUHHUSA-N 0 3 402.379 4.261 20 0 HIADHN C[C@H](N[C@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000540144189 939089881 /nfs/dbraw/zinc/08/98/81/939089881.db2.gz LHTCAMJPAYFNQX-JSGCOSHPSA-N 0 3 415.896 4.165 20 0 HIADHN COC(=O)c1ccc(CN[C@@H]2CCCc3ccc(Br)cc32)cc1OC ZINC000540145646 939090776 /nfs/dbraw/zinc/09/07/76/939090776.db2.gz VNUDYSGBRUOSCL-GOSISDBHSA-N 0 3 404.304 4.412 20 0 HIADHN Cc1ccc(S(=O)(=O)NCCN[C@H](C)c2ccc(SCC(F)F)cc2)s1 ZINC000540152822 939093310 /nfs/dbraw/zinc/09/33/10/939093310.db2.gz RSSAVTFGFLQDAL-CYBMUJFWSA-N 0 3 420.572 4.043 20 0 HIADHN C[C@H](COc1ccc2cc(Br)ccc2c1)N[C@@H](CO)CC(F)(F)F ZINC000540154824 939093886 /nfs/dbraw/zinc/09/38/86/939093886.db2.gz ZJLKEDWLJXHISE-IAQYHMDHSA-N 0 3 406.242 4.273 20 0 HIADHN Cc1c([C@@H](C)N[C@H]2CCOC3(CCC3)C2)nnn1-c1cccc(Br)c1 ZINC000540158531 939094631 /nfs/dbraw/zinc/09/46/31/939094631.db2.gz ZDJYVGXALMKEMU-CJNGLKHVSA-N 0 3 405.340 4.091 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(OCCN[C@@H](C)c3cnn(C(C)C)c3)c2)cc1 ZINC000540170143 939101670 /nfs/dbraw/zinc/10/16/70/939101670.db2.gz WDYMYCSKYFTNNL-SFHVURJKSA-N 0 3 422.529 4.455 20 0 HIADHN Cc1nc(-c2ccccc2)sc1[C@H](C)NCc1cccc(NS(C)(=O)=O)c1 ZINC000540175680 939104699 /nfs/dbraw/zinc/10/46/99/939104699.db2.gz KKSRIAROKRURQU-AWEZNQCLSA-N 0 3 401.557 4.341 20 0 HIADHN C[C@@H](NCCNC(=O)CC1CCCCC1)c1ccc(S(=O)(=O)C2CCCC2)cc1 ZINC000540180495 939107841 /nfs/dbraw/zinc/10/78/41/939107841.db2.gz CBHAATOQOQGCDD-GOSISDBHSA-N 0 3 420.619 4.140 20 0 HIADHN CC(=O)Nc1cccc([C@@H](C)NCCOc2ncc(C(F)(F)F)cc2Cl)c1 ZINC000540183307 939109876 /nfs/dbraw/zinc/10/98/76/939109876.db2.gz GXYYEPBQXZYSFX-LLVKDONJSA-N 0 3 401.816 4.442 20 0 HIADHN C[C@H]1C[C@@H](NCCC(=O)N2CCN(c3ccc(F)cc3)CC2)c2ccsc2S1 ZINC000540190370 939114000 /nfs/dbraw/zinc/11/40/00/939114000.db2.gz IMANCTOEWQJHFP-HNAYVOBHSA-N 0 3 419.591 4.141 20 0 HIADHN Cc1c([C@H](C)NCc2ccc(NS(C)(=O)=O)cc2)cnn1-c1cccc(Cl)c1 ZINC000540189623 939114681 /nfs/dbraw/zinc/11/46/81/939114681.db2.gz VPQIEBIKNAXBND-AWEZNQCLSA-N 0 3 418.950 4.056 20 0 HIADHN Cc1cc2c(cc1C)[C@@H](N[C@@H](C)c1ccc(S(=O)(=O)N(C)C)cc1)CCCO2 ZINC000540191466 939115892 /nfs/dbraw/zinc/11/58/92/939115892.db2.gz PKAREXMEQVTPME-UWJYYQICSA-N 0 3 402.560 4.118 20 0 HIADHN Cc1cc(C)c([C@H](C)NCc2ccccc2OCC(=O)NC[C@H]2CCCO2)cc1C ZINC000540191633 939116060 /nfs/dbraw/zinc/11/60/60/939116060.db2.gz SRCRPQMFWGIFBF-RBBKRZOGSA-N 0 3 410.558 4.137 20 0 HIADHN CCN1CC[C@H](NCc2cc(OC)c(OC)cc2OC)[C@H]1c1ccc(Cl)c(F)c1 ZINC000540203536 939125531 /nfs/dbraw/zinc/12/55/31/939125531.db2.gz JAIKSUDODIVCHR-PGRDOPGGSA-N 0 3 422.928 4.430 20 0 HIADHN CS(=O)(=O)CC1(CN[C@H](CCSc2ccccc2)c2ccc(F)cc2)CC1 ZINC000540223256 939139056 /nfs/dbraw/zinc/13/90/56/939139056.db2.gz ZSPLWMDXQUNITE-HXUWFJFHSA-N 0 3 407.576 4.464 20 0 HIADHN COc1ccc(CN[C@H](C)[C@H](OC)c2ccc(Br)cc2)c(OC)c1OC ZINC000540223522 939139807 /nfs/dbraw/zinc/13/98/07/939139807.db2.gz LNBIOHXCSNQDNP-ACJLOTCBSA-N 0 3 424.335 4.341 20 0 HIADHN CO[C@@H](c1ccc(Br)cc1)[C@@H](C)NC(=O)c1cccc(CN(C)C)c1 ZINC000540256483 939174023 /nfs/dbraw/zinc/17/40/23/939174023.db2.gz LQTZKAGANRGHHQ-AUUYWEPGSA-N 0 3 405.336 4.017 20 0 HIADHN C[C@@H]1CCCN(S(=O)(=O)c2ccc(CN[C@H]3CCCNc4ccccc43)cc2)C1 ZINC000563647930 945232638 /nfs/dbraw/zinc/23/26/38/945232638.db2.gz CBZPJZSYRBTPJB-JPYJTQIMSA-N 0 3 413.587 4.144 20 0 HIADHN O=C(N[C@H](c1ccc(Cl)c(C(F)(F)F)c1)C1CC1)N1CC[C@@H](N2CC=CC2)C1 ZINC000540309095 939189103 /nfs/dbraw/zinc/18/91/03/939189103.db2.gz QSVOAUQSYOVZFB-QAPCUYQASA-N 0 3 413.871 4.466 20 0 HIADHN CC[C@@H](NCC(=O)NCC1(c2ccccc2)CCOCC1)c1cccc(Cl)c1 ZINC000540332349 939197800 /nfs/dbraw/zinc/19/78/00/939197800.db2.gz LVNOMYOAIPVUEI-OAQYLSRUSA-N 0 3 400.950 4.245 20 0 HIADHN CCC[C@H](NCC(=O)N1c2ccccc2NC(=O)C[C@H]1C(F)(F)F)c1ccccc1 ZINC000540341829 939200050 /nfs/dbraw/zinc/20/00/50/939200050.db2.gz YFPOSKWCUHVMRA-LPHOPBHVSA-N 0 3 419.447 4.424 20 0 HIADHN COc1ccc(C)cc1NC(=O)[C@H](NCCCc1c(C)nn(C)c1C)c1ccccc1 ZINC000540341253 939200092 /nfs/dbraw/zinc/20/00/92/939200092.db2.gz ZGUQLWZINDKXNO-XMMPIXPASA-N 0 3 420.557 4.256 20 0 HIADHN CC(C)[C@@H](NCC(=O)N(C)[C@H](C)c1ccc(F)c(F)c1)c1ccc2c(c1)OCCO2 ZINC000540341723 939200317 /nfs/dbraw/zinc/20/03/17/939200317.db2.gz RWKSACNVLHCZDZ-IQMFZBJNSA-N 0 3 418.484 4.242 20 0 HIADHN CCOc1ccc([C@@H]2CCCN2C(=O)CN[C@@H](C)c2ccccc2-n2cccn2)cc1 ZINC000540359291 939208086 /nfs/dbraw/zinc/20/80/86/939208086.db2.gz HSPMEFFPJOWGII-CVDCTZTESA-N 0 3 418.541 4.285 20 0 HIADHN CC(C)(C)C[C@H](NCC(=O)NCc1ccccc1CN1CCCC1=O)c1ccccc1 ZINC000540381338 939220107 /nfs/dbraw/zinc/22/01/07/939220107.db2.gz UAUURULCXMROCA-QHCPKHFHSA-N 0 3 421.585 4.192 20 0 HIADHN C[C@H](NCC(=O)N1CCC(Cc2ccccc2)CC1)c1cccc(-n2cccn2)c1 ZINC000540386158 939223271 /nfs/dbraw/zinc/22/32/71/939223271.db2.gz NPPXZOIXVCFDOW-FQEVSTJZSA-N 0 3 402.542 4.004 20 0 HIADHN Cc1cc(Br)ccc1NC(=O)CN[C@H](C)c1cccc(-n2cccn2)c1 ZINC000540390132 939227763 /nfs/dbraw/zinc/22/77/63/939227763.db2.gz VNURFPUEGUVBBO-OAHLLOKOSA-N 0 3 413.319 4.233 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)N[C@H]2CCO[C@@H]2c2ccc(Cl)cc2)CC1 ZINC000540391685 939229848 /nfs/dbraw/zinc/22/98/48/939229848.db2.gz IQHQXSKZKVRSBI-LEWJYISDSA-N 0 3 417.937 4.069 20 0 HIADHN O=C(CN[C@H](c1ccccc1)[C@H]1CCOC1)N[C@H](c1cccs1)c1ccccc1 ZINC000540395211 939232691 /nfs/dbraw/zinc/23/26/91/939232691.db2.gz QZNCCAGOYXXYRI-ZTCOLXNVSA-N 0 3 406.551 4.321 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(-c2cccnc2)cc1)C(=O)NC(=O)Nc1ccccc1F ZINC000540424741 939243488 /nfs/dbraw/zinc/24/34/88/939243488.db2.gz WSPAYYRTUWKEIJ-JKSUJKDBSA-N 0 3 406.461 4.275 20 0 HIADHN COc1cccc(OC)c1OC[C@@H](O)CN[C@@H](c1ccc(F)cc1F)C(C)(C)C ZINC000540425986 939245089 /nfs/dbraw/zinc/24/50/89/939245089.db2.gz PXWHBADSONOORZ-BTYIYWSLSA-N 0 3 409.473 4.099 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)N1CCN(c2ccccc2)CC1)c1ccc(-c2cccnc2)cc1 ZINC000540431031 939246167 /nfs/dbraw/zinc/24/61/67/939246167.db2.gz WSNSTVYRZXICTB-RTWAWAEBSA-N 0 3 414.553 4.137 20 0 HIADHN Cc1cccc(OCCNC(=O)[C@@H](C)N[C@H](C)c2ccc(-c3cccnc3)cc2)c1 ZINC000540433197 939247014 /nfs/dbraw/zinc/24/70/14/939247014.db2.gz PRZWFSLODKEGAS-WOJBJXKFSA-N 0 3 403.526 4.291 20 0 HIADHN COc1ccc([C@H](NC(=O)CN[C@@H](C[C@@H]2CCOC2)c2ccccc2)C2CC2)cc1 ZINC000540435011 939247948 /nfs/dbraw/zinc/24/79/48/939247948.db2.gz WWRJLPQBJVWVJI-VVMVZBAXSA-N 0 3 408.542 4.020 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(-c2ccncc2)cc1)C(=O)Nc1ccc2c(c1)OCCO2 ZINC000540437959 939249291 /nfs/dbraw/zinc/24/92/91/939249291.db2.gz QEJZQYYKMGHRHL-IRXDYDNUSA-N 0 3 403.482 4.198 20 0 HIADHN COc1cc2c(cc1OC)CN(C(=O)CN[C@H](c1cccc(C)c1)C(C)(C)C)CC2 ZINC000540437666 939249859 /nfs/dbraw/zinc/24/98/59/939249859.db2.gz GZQWOOJDQSQZKS-XMMPIXPASA-N 0 3 410.558 4.274 20 0 HIADHN COc1cc(OC)c(OC)cc1CNC(=O)CN[C@H](c1ccccc1C)C(C)(C)C ZINC000540460158 939261350 /nfs/dbraw/zinc/26/13/50/939261350.db2.gz CEDLDZVPYKBCIE-HSZRJFAPSA-N 0 3 414.546 4.014 20 0 HIADHN O=C(N[C@@H]1CCO[C@H]1c1ccc(Cl)cc1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000540462194 939261756 /nfs/dbraw/zinc/26/17/56/939261756.db2.gz OMTSMEUWXSAPDZ-QIJUGHKUSA-N 0 3 416.924 4.338 20 0 HIADHN O=C(CN[C@H](c1cccs1)C1CC1)Nc1cc(C(F)(F)F)ccc1-n1cncn1 ZINC000540468379 939264552 /nfs/dbraw/zinc/26/45/52/939264552.db2.gz NGCGPSLLROJLRU-SFHVURJKSA-N 0 3 421.448 4.027 20 0 HIADHN Cc1ccc([C@@H](NC(=O)CN[C@@H](c2ccc3c(c2)OCCO3)C2CC2)C2CC2)cc1 ZINC000540588775 939312404 /nfs/dbraw/zinc/31/24/04/939312404.db2.gz GDELYJFYZYENOH-JWQCQUIFSA-N 0 3 406.526 4.074 20 0 HIADHN CC(C)Cc1ccc([C@@H](NCC(=O)Nc2ccc(C(=O)N(C)C)cc2)C2CC2)cc1 ZINC000540589163 939312550 /nfs/dbraw/zinc/31/25/50/939312550.db2.gz PVUBFCBSYSPPDI-XMMPIXPASA-N 0 3 407.558 4.266 20 0 HIADHN Cc1cc(I)ccc1NC(=O)CN[C@@H](c1ccccc1)C1CC1 ZINC000540589934 939312776 /nfs/dbraw/zinc/31/27/76/939312776.db2.gz PQBSDHAOADRNHF-IBGZPJMESA-N 0 3 420.294 4.279 20 0 HIADHN CCc1ccccc1NC(=O)CN(C)C(=O)[C@@H](C)N[C@H](c1ccccc1C)C1CC1 ZINC000540591737 939312881 /nfs/dbraw/zinc/31/28/81/939312881.db2.gz YECYYXYELQBBBR-KOSHJBKYSA-N 0 3 407.558 4.084 20 0 HIADHN C[C@H](c1ccc(Cl)cc1)N(C)C(=O)CN[C@@H](c1ccc2c(c1)OCCO2)C1CC1 ZINC000540591207 939312889 /nfs/dbraw/zinc/31/28/89/939312889.db2.gz GFTNJOAFRJLCHO-IQMFZBJNSA-N 0 3 414.933 4.372 20 0 HIADHN COc1ccc([C@H](C)NCCc2cccc(C(=O)N(C)C)c2)c(Br)c1 ZINC000540594239 939314103 /nfs/dbraw/zinc/31/41/03/939314103.db2.gz PTPVOSWAPVYFHB-AWEZNQCLSA-N 0 3 405.336 4.053 20 0 HIADHN CC[C@H](NCc1ccc(N2CCOCC2)nc1)c1cc(F)cc(Br)c1 ZINC000540597118 939314970 /nfs/dbraw/zinc/31/49/70/939314970.db2.gz JFDJFVSJBNOFQC-SFHVURJKSA-N 0 3 408.315 4.061 20 0 HIADHN COc1cc(OC)cc(N2CC[C@@H](NCc3ccccc3OCc3cccnc3)C2)c1 ZINC000540693562 939341287 /nfs/dbraw/zinc/34/12/87/939341287.db2.gz JIIDVBKSFHOPGC-OAQYLSRUSA-N 0 3 419.525 4.046 20 0 HIADHN CC(C)N1CC[C@H](NCc2cnc(N3CCCC3)nc2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000540716593 939346910 /nfs/dbraw/zinc/34/69/10/939346910.db2.gz AGKLWGJXVXKQAU-LEWJYISDSA-N 0 3 417.960 4.183 20 0 HIADHN C[C@@H](NC1(c2ccccc2)CCC1)c1ccc(S(=O)(=O)NCc2ccco2)cc1 ZINC000540767404 939365111 /nfs/dbraw/zinc/36/51/11/939365111.db2.gz SJXYLWYPLIJXCA-GOSISDBHSA-N 0 3 410.539 4.488 20 0 HIADHN CC(C)(C)N1CCC(Nc2cccc(CS(=O)(=O)Cc3ccccc3)c2)CC1 ZINC000540826173 939385913 /nfs/dbraw/zinc/38/59/13/939385913.db2.gz PFBWHHPFHJKEMB-UHFFFAOYSA-N 0 3 400.588 4.476 20 0 HIADHN CN(C)Cc1cccc(NC(=O)N2CCC[C@H](c3nnc(C4CCCCC4)[nH]3)C2)c1 ZINC000540862562 939400525 /nfs/dbraw/zinc/40/05/25/939400525.db2.gz HBJCQSHMMROJKK-IBGZPJMESA-N 0 3 410.566 4.326 20 0 HIADHN C[C@@H](N[C@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O)c1ccc(-n2ccnn2)cc1 ZINC000540889787 939411021 /nfs/dbraw/zinc/41/10/21/939411021.db2.gz WQLZDFWEEUOZMM-YJYMSZOUSA-N 0 3 416.312 4.030 20 0 HIADHN CC[C@@H](C)n1nc(C(=O)N(CCN(C)C)Cc2ccc(Br)cc2)cc1C ZINC000540889355 939411267 /nfs/dbraw/zinc/41/12/67/939411267.db2.gz HCYSRZUYXFMEGG-OAHLLOKOSA-N 0 3 421.383 4.129 20 0 HIADHN COC[C@@H](NC1CCN(Cc2ccccc2Br)CC1)c1ccc(C)o1 ZINC000540983996 939424841 /nfs/dbraw/zinc/42/48/41/939424841.db2.gz QYGGGKFSTRZWAH-LJQANCHMSA-N 0 3 407.352 4.292 20 0 HIADHN CC(=O)Nc1ccc([C@H](C)N[C@@H]2CC(=O)N(C)[C@@H]2c2ccc(Cl)c(F)c2)cc1 ZINC000540987097 939425317 /nfs/dbraw/zinc/42/53/17/939425317.db2.gz SFZLWIBVZNYZQQ-VYAXVDJTSA-N 0 3 403.885 4.060 20 0 HIADHN OC[C@H](NC[C@@H](O)COc1c(Cl)cccc1Cl)c1ccc(C(F)(F)F)cc1 ZINC000541023981 939433584 /nfs/dbraw/zinc/43/35/84/939433584.db2.gz UEJHFRQTLDMAIM-CJNGLKHVSA-N 0 3 424.246 4.075 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)NCC(=O)N[C@@H](c2ccc(F)cc2)C(C)C)cc1 ZINC000541027519 939435194 /nfs/dbraw/zinc/43/51/94/939435194.db2.gz BCNMJSFLXXNQGO-BXKMTCNYSA-N 0 3 408.521 4.484 20 0 HIADHN CC(C)Cc1noc(-c2cc(Cl)ccc2NC(=O)N(CCN(C)C)C(C)C)n1 ZINC000541043838 939439503 /nfs/dbraw/zinc/43/95/03/939439503.db2.gz UZPMGUBCLYFITM-UHFFFAOYSA-N 0 3 407.946 4.392 20 0 HIADHN CCN1CC[C@@H](NCc2ccc(OC)c(OC)c2OC)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000541084522 939454363 /nfs/dbraw/zinc/45/43/63/939454363.db2.gz LNOXYMZIOIUSDG-XLIONFOSSA-N 0 3 424.463 4.055 20 0 HIADHN CC(=O)Nc1ccc(OC[C@H](O)CN2CCCCC[C@@H]2/C=C\c2cccs2)cc1 ZINC000541201030 939485339 /nfs/dbraw/zinc/48/53/39/939485339.db2.gz IJFHPMJZIPSEDR-LUUCIGQJSA-N 0 3 414.571 4.404 20 0 HIADHN CCOC(=O)C1CCN(C(=O)C[C@H](C)NC(C)(c2ccccc2)c2ccccc2)CC1 ZINC000541206483 939485589 /nfs/dbraw/zinc/48/55/89/939485589.db2.gz AEIYNLOVHCERJC-FQEVSTJZSA-N 0 3 422.569 4.120 20 0 HIADHN COc1ccc(NC(=O)C[C@H](C)N[C@@H]2CCCOc3ccc(F)cc32)c(OC)c1 ZINC000541213779 939485972 /nfs/dbraw/zinc/48/59/72/939485972.db2.gz ZIJVBICQZMRWAZ-KBXCAEBGSA-N 0 3 402.466 4.064 20 0 HIADHN COc1ccc(NC(=O)C[C@H](C)N[C@H]2CCCOc3ccc(F)cc32)c(OC)c1 ZINC000541213781 939485983 /nfs/dbraw/zinc/48/59/83/939485983.db2.gz ZIJVBICQZMRWAZ-KSSFIOAISA-N 0 3 402.466 4.064 20 0 HIADHN CSc1ccccc1C[C@@H](C)NCc1ccccc1S(=O)(=O)NC(C)(C)C ZINC000541254697 939487834 /nfs/dbraw/zinc/48/78/34/939487834.db2.gz GUYWYWRDUUPXNP-MRXNPFEDSA-N 0 3 406.617 4.206 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)C(C)(C)Cc1nc2ccccc2[nH]1 ZINC000541256901 939487999 /nfs/dbraw/zinc/48/79/99/939487999.db2.gz QZCKFBXUCKCGSG-LJQANCHMSA-N 0 3 404.558 4.255 20 0 HIADHN CN(C)C(=O)[C@@H](NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1ccccc1 ZINC000541281971 939489137 /nfs/dbraw/zinc/48/91/37/939489137.db2.gz RUNGPUQXIRSTQX-NRFANRHFSA-N 0 3 420.384 4.377 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)CCc1cc(F)ccc1Br ZINC000541302639 939490175 /nfs/dbraw/zinc/49/01/75/939490175.db2.gz OMUNELANBLIZKW-UHFFFAOYSA-N 0 3 413.356 4.173 20 0 HIADHN c1cn(-c2csc(CNCc3ccc(OCCOc4ccccc4)nc3)c2)cn1 ZINC000541389199 939503381 /nfs/dbraw/zinc/50/33/81/939503381.db2.gz FLICUNCQNTXUFB-UHFFFAOYSA-N 0 3 406.511 4.076 20 0 HIADHN O=C(CN[C@@H](Cc1ccccc1)c1cccs1)Nc1cccc(C(=O)NC2CC2)c1 ZINC000541593447 939562309 /nfs/dbraw/zinc/56/23/09/939562309.db2.gz JLZUQGMEFMTACM-NRFANRHFSA-N 0 3 419.550 4.152 20 0 HIADHN CC(C)C[C@@H](NCc1cc(=O)n2cc(Br)ccc2n1)c1cccs1 ZINC000541626297 939574443 /nfs/dbraw/zinc/57/44/43/939574443.db2.gz XRLLMOMCKRNAGA-OAHLLOKOSA-N 0 3 406.349 4.396 20 0 HIADHN CC[C@@H](NCC(=O)N(Cc1ccccc1)c1nc2c(s1)CCCC2)[C@H]1CCCO1 ZINC000541637393 939579548 /nfs/dbraw/zinc/57/95/48/939579548.db2.gz POJOBKIKFGQCFU-UYAOXDASSA-N 0 3 413.587 4.102 20 0 HIADHN Cc1cccc(Cc2cnc(NC(=O)CN[C@@H](C)[C@H]3COc4ccccc43)s2)c1 ZINC000541694669 939607017 /nfs/dbraw/zinc/60/70/17/939607017.db2.gz HQSWETRDLXCZCP-OXJNMPFZSA-N 0 3 407.539 4.135 20 0 HIADHN C[C@@H](NCC(=O)NCCC(c1ccccc1)c1ccccc1)[C@H]1COc2ccccc21 ZINC000541700547 939608838 /nfs/dbraw/zinc/60/88/38/939608838.db2.gz RJXZMCBNVCADDQ-CJFMBICVSA-N 0 3 414.549 4.479 20 0 HIADHN C[C@H]1N(CC(=O)Nc2cccc(CSc3ccccn3)c2)CCC12CCOCC2 ZINC000541717931 939613135 /nfs/dbraw/zinc/61/31/35/939613135.db2.gz JHRFBJHFGGLJOB-GOSISDBHSA-N 0 3 411.571 4.203 20 0 HIADHN CCc1ccc([C@H](NC(=O)CN2CCC3(CCOCC3)[C@H]2C)c2cccs2)cc1 ZINC000541718316 939613617 /nfs/dbraw/zinc/61/36/17/939613617.db2.gz OCIBLMDMQCQOLV-JPYJTQIMSA-N 0 3 412.599 4.407 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@@H]2NCc2ccc(F)c(CN(C)C)c2)cc1 ZINC000541732219 939616176 /nfs/dbraw/zinc/61/61/76/939616176.db2.gz HWMIEEMFCQTEJJ-XZOQPEGZSA-N 0 3 418.578 4.070 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@H]2CCCC[C@@H]2NCc2ccc(F)c(CN(C)C)c2)cc1 ZINC000541732214 939616204 /nfs/dbraw/zinc/61/62/04/939616204.db2.gz HWMIEEMFCQTEJJ-GOTSBHOMSA-N 0 3 418.578 4.070 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@H]2NCc2cccc(Cn3cccn3)c2)cc1 ZINC000541742154 939618471 /nfs/dbraw/zinc/61/84/71/939618471.db2.gz WDBCXAGIDCFEES-DNQXCXABSA-N 0 3 423.582 4.115 20 0 HIADHN Cc1nnc([C@@H]2CCCN(Cc3csc(-c4cccc(Br)c4)n3)C2)[nH]1 ZINC000541762264 939623536 /nfs/dbraw/zinc/62/35/36/939623536.db2.gz VLHZPVPDDGBMJG-CQSZACIVSA-N 0 3 418.364 4.379 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@@H]2NCc2ccccc2-c2cnn(C)c2)cc1 ZINC000541767149 939625477 /nfs/dbraw/zinc/62/54/77/939625477.db2.gz SIDLCBRIBUITLH-BJKOFHAPSA-N 0 3 423.582 4.270 20 0 HIADHN CCC(CC)[C@@H]1C[C@H](NC(=O)NC[C@@H](c2ccc(OC)cc2)N2CCCC2)CCO1 ZINC000541851033 939647126 /nfs/dbraw/zinc/64/71/26/939647126.db2.gz YQSAWIJWEPTQNB-PUHATCMVSA-N 0 3 417.594 4.115 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3cn(C)nc3-c3ccccc3)c(C)c2)CC1 ZINC000541861733 939647930 /nfs/dbraw/zinc/64/79/30/939647930.db2.gz VYHAFKIXGXNXMI-UHFFFAOYSA-N 0 3 418.545 4.181 20 0 HIADHN COc1ccc([C@@H](NC(=O)CN[C@H](C)c2ccc(-n3ccnc3C)cc2)C(C)C)cc1 ZINC000541956677 939662338 /nfs/dbraw/zinc/66/23/38/939662338.db2.gz VXHHNRYGKDNOAU-CJAUYULYSA-N 0 3 420.557 4.353 20 0 HIADHN CC(C)[C@@H]1C[C@@H](CC(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)CCO1 ZINC000541959433 939662437 /nfs/dbraw/zinc/66/24/37/939662437.db2.gz ZSAYLEZIGJGNCO-BDTNDASRSA-N 0 3 410.562 4.110 20 0 HIADHN CC[C@@H]1C[C@H](CC(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)CCO1 ZINC000541959443 939663241 /nfs/dbraw/zinc/66/32/41/939663241.db2.gz ZWFFWDGTXCVCGZ-YPAWHYETSA-N 0 3 410.562 4.172 20 0 HIADHN CC[C@@H]1C[C@H](CC(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)CCO1 ZINC000541959441 939663299 /nfs/dbraw/zinc/66/32/99/939663299.db2.gz ZWFFWDGTXCVCGZ-BHIFYINESA-N 0 3 410.562 4.172 20 0 HIADHN CCN1CC[C@H](NCc2cnc([C@H]3CCCO3)s2)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000542013189 939684961 /nfs/dbraw/zinc/68/49/61/939684961.db2.gz MZMGTUVATAOEAV-SCTDSRPQSA-N 0 3 411.493 4.337 20 0 HIADHN COc1ccc(Br)c(CNCCCc2nc(-c3ccc(F)cc3)no2)c1 ZINC000542312494 939796148 /nfs/dbraw/zinc/79/61/48/939796148.db2.gz ZBMBTLZBZDUJNO-UHFFFAOYSA-N 0 3 420.282 4.369 20 0 HIADHN CC(C)(C)[C@H]1CCN(CC(=O)N(Cc2nnc(-c3ccccc3Cl)o2)C2CC2)C1 ZINC000542321635 939799886 /nfs/dbraw/zinc/79/98/86/939799886.db2.gz CGPWSPFBGOAGHQ-HNNXBMFYSA-N 0 3 416.953 4.249 20 0 HIADHN Cc1ccc([C@H]2CCN(CC(=O)N3CCC[C@H]3c3ccc4c(c3)OCCCO4)C2)cc1 ZINC000542323108 939800272 /nfs/dbraw/zinc/80/02/72/939800272.db2.gz PINQMURUDZSCMU-GOTSBHOMSA-N 0 3 420.553 4.309 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)[C@@H]1CCn2c(cnc2C2CCCCC2)C1 ZINC000542335711 939802741 /nfs/dbraw/zinc/80/27/41/939802741.db2.gz CQXUVKGMWGQIFE-ISKFKSNPSA-N 0 3 420.601 4.447 20 0 HIADHN O=C(Nc1cc(Cl)ccc1[O-])C1CC[NH+](Cc2cc(-n3ccnc3)cs2)CC1 ZINC000542465702 939828054 /nfs/dbraw/zinc/82/80/54/939828054.db2.gz JYRVFONRUOIZQN-UHFFFAOYSA-N 0 3 416.934 4.144 20 0 HIADHN Cc1ccccc1[C@H](CN1CCOCC1)NCc1cccc(OCC(F)(F)F)c1 ZINC000542480235 939830631 /nfs/dbraw/zinc/83/06/31/939830631.db2.gz YTQWSJJRQCXIBM-NRFANRHFSA-N 0 3 408.464 4.099 20 0 HIADHN O=S(=O)(c1ccccc1)N1CCC(CN[C@H](c2ccco2)c2ccccc2)CC1 ZINC000542494101 939832649 /nfs/dbraw/zinc/83/26/49/939832649.db2.gz KOLLOIGQZKGLSX-QHCPKHFHSA-N 0 3 410.539 4.060 20 0 HIADHN COc1ccc([C@H]2CCCN2C(=O)CN[C@@H](c2cccs2)C2CC2)cc1OC ZINC000542510784 939834818 /nfs/dbraw/zinc/83/48/18/939834818.db2.gz NKEWHDRWDANONV-VGOFRKELSA-N 0 3 400.544 4.170 20 0 HIADHN Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)NC[C@@H](O)COc1ccc2ccccc2c1 ZINC000542531947 939838619 /nfs/dbraw/zinc/83/86/19/939838619.db2.gz MMRPIQMVSVEFKP-AUUYWEPGSA-N 0 3 421.463 4.306 20 0 HIADHN C[C@H](c1ccccc1)[C@H](C)NCc1csc(-c2ccc(S(C)(=O)=O)cc2)n1 ZINC000542542579 939841161 /nfs/dbraw/zinc/84/11/61/939841161.db2.gz AECIMHURBZVYHN-HOTGVXAUSA-N 0 3 400.569 4.495 20 0 HIADHN CC[C@@H](C)[C@@H](C)NCc1nc2c(Br)cc(Br)cc2c(=O)[nH]1 ZINC000542543871 939841467 /nfs/dbraw/zinc/84/14/67/939841467.db2.gz HWYQDNTURYAKHZ-RKDXNWHRSA-N 0 3 417.145 4.385 20 0 HIADHN Cc1cnc([C@@H](C)CNC(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)s1 ZINC000542554481 939842816 /nfs/dbraw/zinc/84/28/16/939842816.db2.gz JKGYAWPXBPSUOD-DOTOQJQBSA-N 0 3 406.621 4.389 20 0 HIADHN C[C@H](NCC(=O)Nc1ccc(Br)cc1Cl)[C@H]1COc2ccccc21 ZINC000542621077 939849439 /nfs/dbraw/zinc/84/94/39/939849439.db2.gz WNHFBQQUOVYTNJ-SMDDNHRTSA-N 0 3 409.711 4.195 20 0 HIADHN CCN(Cc1cccc(F)c1)C(=O)CN(C)[C@@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000542628149 939850264 /nfs/dbraw/zinc/85/02/64/939850264.db2.gz OMGKKESJXYFIQI-YADHBBJMSA-N 0 3 402.485 4.165 20 0 HIADHN Clc1cccc(N2CCN(CCCN[C@@H](c3ccccc3)c3cncnc3)CC2)c1 ZINC000542666985 939852806 /nfs/dbraw/zinc/85/28/06/939852806.db2.gz URMFPXQQUBEIID-DEOSSOPVSA-N 0 3 421.976 4.021 20 0 HIADHN C[C@H]1CCN(C(=O)Nc2csc(-c3ccccn3)n2)CCN1Cc1ccccc1 ZINC000542687170 939854181 /nfs/dbraw/zinc/85/41/81/939854181.db2.gz ZKKVUWQKADMHIB-KRWDZBQOSA-N 0 3 407.543 4.333 20 0 HIADHN CC(C)c1nn(-c2ccc(Br)cc2)cc1CN1CCC[C@@H]([C@@H](C)O)C1 ZINC000542820558 939861435 /nfs/dbraw/zinc/86/14/35/939861435.db2.gz RZVKMAYLRIBEOT-HZPDHXFCSA-N 0 3 406.368 4.351 20 0 HIADHN O=C1NCCCN1C1CCN(Cc2ccc(-c3cccc(C(F)(F)F)c3)o2)CC1 ZINC000542857135 939863566 /nfs/dbraw/zinc/86/35/66/939863566.db2.gz VTXQBGPRHNJSJU-UHFFFAOYSA-N 0 3 407.436 4.345 20 0 HIADHN COc1cccc2sc(NC(=O)CN[C@H](C)c3ccc(-n4ccnc4C)cc3)nc21 ZINC000542882566 939865178 /nfs/dbraw/zinc/86/51/78/939865178.db2.gz GAKMJXCUUUUFPP-CQSZACIVSA-N 0 3 421.526 4.088 20 0 HIADHN Cc1ccc([C@H](CNC(=O)NCc2cn(C)nc2-c2ccccc2)N2CCCC2)cc1 ZINC000542968226 939888077 /nfs/dbraw/zinc/88/80/77/939888077.db2.gz JUIPTEWIXZULPU-QHCPKHFHSA-N 0 3 417.557 4.032 20 0 HIADHN CCOc1cc(C)ccc1CN[C@H](C)CC(=O)Nc1ccc(NC(=O)C2CC2)cc1 ZINC000543077900 939928678 /nfs/dbraw/zinc/92/86/78/939928678.db2.gz UTYBKVKYLXJGKZ-QGZVFWFLSA-N 0 3 409.530 4.249 20 0 HIADHN Cc1cc(NC(=O)c2ccnc(C3CC3)c2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000543077895 939929088 /nfs/dbraw/zinc/92/90/88/939929088.db2.gz UQRMBSYWQQRYCB-OAQYLSRUSA-N 0 3 401.514 4.163 20 0 HIADHN Cc1ccc(C(=O)Nc2ccc(C(=O)N(C)[C@@H]3CCCN(C)C3)cc2)c(Cl)c1C ZINC000543078102 939929556 /nfs/dbraw/zinc/92/95/56/939929556.db2.gz SCFMHVMUYNONJB-LJQANCHMSA-N 0 3 413.949 4.375 20 0 HIADHN COC(=O)CN1CCC(N[C@H](c2cccc(SC)c2)c2ccc(F)c(F)c2)CC1 ZINC000543097123 939942989 /nfs/dbraw/zinc/94/29/89/939942989.db2.gz PECFXNJYOWRGFN-JOCHJYFZSA-N 0 3 420.525 4.003 20 0 HIADHN Cc1cc(NC(=O)c2cccnc2C2CC2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000543155511 939979044 /nfs/dbraw/zinc/97/90/44/939979044.db2.gz CIXWBKMUNFFXDL-HXUWFJFHSA-N 0 3 401.514 4.163 20 0 HIADHN C[C@H](CN(C)C(=O)NC[C@@H](c1ccccc1)N1CCC(C)CC1)c1nccs1 ZINC000543201516 939994030 /nfs/dbraw/zinc/99/40/30/939994030.db2.gz ZDJHPRJHEBUDGW-QUCCMNQESA-N 0 3 400.592 4.361 20 0 HIADHN C[C@@H]1[C@H](NC(=O)c2cccc(OCc3cccnc3)c2)CCN1Cc1ccccc1 ZINC000563760448 945288078 /nfs/dbraw/zinc/28/80/78/945288078.db2.gz RPKNAVUBCFRGPW-NTKDMRAZSA-N 0 3 401.510 4.053 20 0 HIADHN O=C(Cc1ccccc1)N1CCc2ccc(NC(=O)[C@H]3CCCN3C3CCCC3)cc21 ZINC000563758298 945288134 /nfs/dbraw/zinc/28/81/34/945288134.db2.gz CXCSPEUUVMQXBA-HSZRJFAPSA-N 0 3 417.553 4.164 20 0 HIADHN COc1cc(CN[C@@H](C)C[S@@](C)=O)ccc1OCc1ccc(Cl)cc1Cl ZINC000543226936 940001245 /nfs/dbraw/zinc/00/12/45/940001245.db2.gz QUSMFHGDLXINEO-WHDAMIPWSA-N 0 3 416.370 4.438 20 0 HIADHN C[C@H]1[C@@H](NC(=O)c2cccc(OCc3cccnc3)c2)CCN1Cc1ccccc1 ZINC000563760446 945288822 /nfs/dbraw/zinc/28/88/22/945288822.db2.gz RPKNAVUBCFRGPW-CYFREDJKSA-N 0 3 401.510 4.053 20 0 HIADHN Cc1n[nH]c(C)c1[C@H](C)C(=O)N(CCN(C)Cc1ccccc1)Cc1ccccc1 ZINC000543279766 940016727 /nfs/dbraw/zinc/01/67/27/940016727.db2.gz AKAWJOQEPQONQD-IBGZPJMESA-N 0 3 404.558 4.291 20 0 HIADHN Cc1ccc(CNC(=O)C2CCN(Cc3cn(C)nc3C3CCCCC3)CC2)cc1 ZINC000543396670 940050843 /nfs/dbraw/zinc/05/08/43/940050843.db2.gz VQPNHJCPKITAIF-UHFFFAOYSA-N 0 3 408.590 4.305 20 0 HIADHN CCc1ccc([C@@H](CN2CCOCC2)NCc2ccc(-c3cccnc3)cc2)cc1 ZINC000543402214 940052737 /nfs/dbraw/zinc/05/27/37/940052737.db2.gz GJSJHWZXLSIDDT-AREMUKBSSA-N 0 3 401.554 4.474 20 0 HIADHN CCN(CC)[C@@H](CN[C@@H](c1ccc(F)cc1)c1cnccn1)c1cccc(OC)c1 ZINC000543410241 940056560 /nfs/dbraw/zinc/05/65/60/940056560.db2.gz BPNZCXKRIGSXCQ-ZEQRLZLVSA-N 0 3 408.521 4.386 20 0 HIADHN Fc1ccc([C@@H](NCCCN2CCN(c3ccccc3)CC2)c2ccccc2)nc1 ZINC000543411541 940057291 /nfs/dbraw/zinc/05/72/91/940057291.db2.gz KAAGABIJSPZILL-VWLOTQADSA-N 0 3 404.533 4.112 20 0 HIADHN Cc1nn(Cc2ccccc2Cl)c(C)c1CN1CCC(OC[C@H]2CCOC2)CC1 ZINC000543414737 940057996 /nfs/dbraw/zinc/05/79/96/940057996.db2.gz LZBFBBCGNBJWSI-IBGZPJMESA-N 0 3 417.981 4.219 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)Nc1ccc(F)cc1-c1nc(C2CC2)no1 ZINC000563771601 945294661 /nfs/dbraw/zinc/29/46/61/945294661.db2.gz XFKVOQQZVZIZRZ-OAHLLOKOSA-N 0 3 423.492 4.395 20 0 HIADHN Cc1cc(NC(=O)[C@H](C)N[C@@H](C)[C@@H]2COc3ccccc32)ccc1Br ZINC000543552357 940106134 /nfs/dbraw/zinc/10/61/34/940106134.db2.gz UUNBEFHOAQQZQK-ZQIUZPCESA-N 0 3 403.320 4.239 20 0 HIADHN COc1ccc(C2(C(=O)N3CC[C@H](C)N(Cc4ccccc4)CC3)CCC2)cc1OC ZINC000543588003 940121346 /nfs/dbraw/zinc/12/13/46/940121346.db2.gz ODFPFJWGQXSVIK-FQEVSTJZSA-N 0 3 422.569 4.249 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@H]2NC[C@@H](c2ccsc2)N(C)C)cc1 ZINC000543607946 940129379 /nfs/dbraw/zinc/12/93/79/940129379.db2.gz LWYUARQXRPTWSS-QHAWAJNXSA-N 0 3 406.617 4.034 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCC[C@@H]1C(C)(C)O)c1ccc(C(F)(F)F)cc1 ZINC000543691667 940160974 /nfs/dbraw/zinc/16/09/74/940160974.db2.gz WVEWTTLQQJLYNV-QZTJIDSGSA-N 0 3 415.500 4.033 20 0 HIADHN Cc1ccc(CCN[C@H](c2ccc(Cl)cc2)c2cccc(S(C)(=O)=O)c2)cn1 ZINC000543702108 940164280 /nfs/dbraw/zinc/16/42/80/940164280.db2.gz KFXYFINGUSAYJT-JOCHJYFZSA-N 0 3 414.958 4.369 20 0 HIADHN Cc1ccc(CCN[C@@H](c2ccc(Cl)cc2)c2cccc(S(C)(=O)=O)c2)cn1 ZINC000543702109 940164993 /nfs/dbraw/zinc/16/49/93/940164993.db2.gz KFXYFINGUSAYJT-QFIPXVFZSA-N 0 3 414.958 4.369 20 0 HIADHN COc1ccc(-c2nsc(NC(=O)N[C@@H]3CCN([C@H](C)c4ccccc4)C3)n2)cc1 ZINC000563782575 945300228 /nfs/dbraw/zinc/30/02/28/945300228.db2.gz FMAWFJBUNGUTIS-CRAIPNDOSA-N 0 3 423.542 4.171 20 0 HIADHN Cc1c2cc(Cl)ccc2oc1C(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1CO ZINC000543707087 940166731 /nfs/dbraw/zinc/16/67/31/940166731.db2.gz JQJODWRRMHJGFO-XLIONFOSSA-N 0 3 412.917 4.007 20 0 HIADHN C[C@H](C(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1CO)c1ccc(Cl)c(Cl)c1 ZINC000543707358 940166757 /nfs/dbraw/zinc/16/67/57/940166757.db2.gz OLZDWTWBNGIYPK-KLHJMIIUSA-N 0 3 421.368 4.096 20 0 HIADHN COC(=O)c1ccc(-c2nc(CN3CCC[C@@H]3Cc3cccc(OC)c3)co2)cc1 ZINC000543859883 940213456 /nfs/dbraw/zinc/21/34/56/940213456.db2.gz GZBJCOFMWWTGPZ-OAQYLSRUSA-N 0 3 406.482 4.344 20 0 HIADHN C[C@H](NC[C@@H](O)COc1ccc(-c2ccccc2)cc1)c1ccc([S@](C)=O)cc1 ZINC000543898401 940232671 /nfs/dbraw/zinc/23/26/71/940232671.db2.gz ZPCOMGKLUHGZSB-XSKPMCJVSA-N 0 3 409.551 4.182 20 0 HIADHN Cc1oc(-c2cccc(C(F)(F)F)c2)nc1C(=O)N1CC[C@@H](N2CCCCC2)C1 ZINC000543938898 940256323 /nfs/dbraw/zinc/25/63/23/940256323.db2.gz NWYYVSUWQUWXQT-QGZVFWFLSA-N 0 3 407.436 4.369 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)c2ccc(NC(=O)C(C)C)cc2)N(C)C)cc1 ZINC000563836060 945309192 /nfs/dbraw/zinc/30/91/92/945309192.db2.gz MTNHFQRSGUSSIK-JOCHJYFZSA-N 0 3 411.546 4.101 20 0 HIADHN Cc1cc(F)ccc1-n1ccc(C(=O)NC[C@@H]2CCCN(Cc3cccs3)C2)n1 ZINC000543999362 940291005 /nfs/dbraw/zinc/29/10/05/940291005.db2.gz GRIAAUBYGHUZTR-KRWDZBQOSA-N 0 3 412.534 4.023 20 0 HIADHN Cc1cc(F)ccc1-n1ccc(C(=O)N2CCCN(CCCc3ccccc3)CC2)n1 ZINC000544003856 940293518 /nfs/dbraw/zinc/29/35/18/940293518.db2.gz HVMBKWFTOOGNTK-UHFFFAOYSA-N 0 3 420.532 4.101 20 0 HIADHN Cc1cc(Br)cn2c(CNCc3ccccc3-c3cnn(C)c3)cnc12 ZINC000544178928 940345402 /nfs/dbraw/zinc/34/54/02/940345402.db2.gz HWSXZHSGEOVXGK-UHFFFAOYSA-N 0 3 410.319 4.096 20 0 HIADHN Cc1cc(Br)cn2c(CNC[C@H](c3ccco3)N3CCCCC3)cnc12 ZINC000544186185 940347699 /nfs/dbraw/zinc/34/76/99/940347699.db2.gz QVJGZXKLJJDAFE-GOSISDBHSA-N 0 3 417.351 4.315 20 0 HIADHN O=C(NC[C@H]1CCCN1Cc1ccccc1)[C@@H]1CCn2c(cnc2C2CCCCC2)C1 ZINC000544224205 940359515 /nfs/dbraw/zinc/35/95/15/940359515.db2.gz ASMCKAPEVDXGQI-DHIUTWEWSA-N 0 3 420.601 4.274 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(CSc4ccc(Cl)cc4)n3)cn2)CC1 ZINC000544332843 940392548 /nfs/dbraw/zinc/39/25/48/940392548.db2.gz DCCPGIXBIJGCMA-UHFFFAOYSA-N 0 3 415.950 4.219 20 0 HIADHN Cc1cccc([C@H](CN[C@H](c2ccc(F)cc2)c2cccnc2)N2CCOCC2)c1 ZINC000544359247 940400356 /nfs/dbraw/zinc/40/03/56/940400356.db2.gz FUFNEFMALDQXQT-LOSJGSFVSA-N 0 3 405.517 4.282 20 0 HIADHN Fc1ccc([C@@H](NCC2(c3ccc4c(c3)OCO4)CCOCC2)c2ccccn2)cc1 ZINC000544366779 940403097 /nfs/dbraw/zinc/40/30/97/940403097.db2.gz VYXDGAFELZJRFF-XMMPIXPASA-N 0 3 420.484 4.377 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(C4(c5ccc(Cl)cc5)CC4)n3)cn2)CC1 ZINC000544368044 940403832 /nfs/dbraw/zinc/40/38/32/940403832.db2.gz QWWRWTPXMBHIEP-UHFFFAOYSA-N 0 3 409.921 4.007 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(Cc4ccc(Cl)c(Cl)c4)n3)cn2)CC1 ZINC000544373781 940404747 /nfs/dbraw/zinc/40/47/47/940404747.db2.gz YENUWBCWCMOQAH-UHFFFAOYSA-N 0 3 418.328 4.171 20 0 HIADHN CSc1ccc(Cl)c(-c2nc(-c3ccc(N4CCCN(C)CC4)nc3)no2)c1 ZINC000544372576 940404907 /nfs/dbraw/zinc/40/49/07/940404907.db2.gz CNVOPEIPAZBFCU-UHFFFAOYSA-N 0 3 415.950 4.316 20 0 HIADHN Cc1nc(-c2ccccc2F)sc1[C@H](C)N[C@@H]1CCCN(Cc2ccccn2)C1=O ZINC000544386029 940408253 /nfs/dbraw/zinc/40/82/53/940408253.db2.gz RKERHIPPCOQCND-MGPUTAFESA-N 0 3 424.545 4.494 20 0 HIADHN Cc1ccc(Cl)c(OC[C@H](O)CN2CCC(OCCc3ccccc3)CC2)c1 ZINC000544395598 940410874 /nfs/dbraw/zinc/41/08/74/940410874.db2.gz VQPVMFLVDSAUOU-HXUWFJFHSA-N 0 3 403.950 4.112 20 0 HIADHN COC(=O)c1ccc(CN[C@@H](c2ccc(F)c(F)c2)C(C)(C)N2CCCC2)cc1 ZINC000544407352 940415237 /nfs/dbraw/zinc/41/52/37/940415237.db2.gz HHFOMOZYMQDIMT-NRFANRHFSA-N 0 3 402.485 4.457 20 0 HIADHN Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)NC[C@H](O)COc1cc(C)ccc1Cl ZINC000544421212 940420371 /nfs/dbraw/zinc/42/03/71/940420371.db2.gz IWKWMGGQPUURAZ-WFASDCNBSA-N 0 3 419.875 4.115 20 0 HIADHN Cc1cnc([C@H](NCC2(CN[C@@H](c3ncc(C)s3)C3CC3)COC2)C2CC2)s1 ZINC000544423660 940422660 /nfs/dbraw/zinc/42/26/60/940422660.db2.gz FWTQIUOFINRYJS-QZTJIDSGSA-N 0 3 418.632 4.015 20 0 HIADHN CC(C)[C@H](NC[C@H](O)Cn1c2ccccc2c2ccccc21)c1nnc2ccccn21 ZINC000544435199 940429247 /nfs/dbraw/zinc/42/92/47/940429247.db2.gz LTIXYKWGOFFQOO-UUOWRZLLSA-N 0 3 413.525 4.185 20 0 HIADHN CC(C)(C)[C@@H]1CCN(Cc2ccnc(-c3ccc(Br)cc3)n2)C[C@@H]1O ZINC000544438947 940431137 /nfs/dbraw/zinc/43/11/37/940431137.db2.gz UADDFPFOVFGLGM-MSOLQXFVSA-N 0 3 404.352 4.135 20 0 HIADHN CC[C@@H](NC[C@@H](O)COc1ccc(Cl)cc1Br)c1c(C)noc1C ZINC000544458639 940439780 /nfs/dbraw/zinc/43/97/80/940439780.db2.gz QIHIWPCSCNTXHM-UKRRQHHQSA-N 0 3 417.731 4.188 20 0 HIADHN CC[C@H](NCC(=O)N1N=C(c2ccc(Cl)cc2)C[C@H]1c1ccco1)[C@H]1CCCO1 ZINC000544462436 940441768 /nfs/dbraw/zinc/44/17/68/940441768.db2.gz VMRGPMIOLYFXOE-YSIASYRMSA-N 0 3 415.921 4.158 20 0 HIADHN Cc1nn(-c2ccc(C)cc2)c(C)c1NC(=O)CN[C@H](C)[C@@H]1Oc2ccccc2[C@H]1C ZINC000544519777 940469985 /nfs/dbraw/zinc/46/99/85/940469985.db2.gz QUOMNGZTDAMHTN-BXZDMCNWSA-N 0 3 418.541 4.279 20 0 HIADHN C[C@H](NCC(=O)N(C)C(c1ccccc1)c1ccccc1)[C@@H]1COc2ccccc21 ZINC000544530613 940472788 /nfs/dbraw/zinc/47/27/88/940472788.db2.gz ZNDGRQZPYVRYDH-CVDCTZTESA-N 0 3 400.522 4.389 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@H]2CCCC[C@H]2NCc2ccccc2Cn2cccn2)cc1 ZINC000544580183 940483574 /nfs/dbraw/zinc/48/35/74/940483574.db2.gz LPXDYLGDEXSMAA-RPWUZVMVSA-N 0 3 423.582 4.115 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@H]2NCc2ccccc2Cn2cccn2)cc1 ZINC000544580182 940483790 /nfs/dbraw/zinc/48/37/90/940483790.db2.gz LPXDYLGDEXSMAA-DNQXCXABSA-N 0 3 423.582 4.115 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)N[C@H]2CCO[C@@H](c3ccc(F)cc3)C2)c1 ZINC000544651863 940498865 /nfs/dbraw/zinc/49/88/65/940498865.db2.gz KXNKBNVCTKVBBY-XZOQPEGZSA-N 0 3 413.537 4.128 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N(C)[C@H]2CCO[C@H](c3ccc(F)cc3)C2)N(C)C)cc1 ZINC000544662364 940499767 /nfs/dbraw/zinc/49/97/67/940499767.db2.gz OCTBCXZXLQLTNC-VABKMULXSA-N 0 3 413.537 4.299 20 0 HIADHN C[C@@H](CNC(=O)N(CCN(C)C)Cc1ccc(C(F)(F)F)cc1)c1nccs1 ZINC000544688047 940502492 /nfs/dbraw/zinc/50/24/92/940502492.db2.gz OPKUSQXXRVBGTM-AWEZNQCLSA-N 0 3 414.497 4.039 20 0 HIADHN O=C(NCc1nc2ccccc2n1C1CC1)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000544701732 940504734 /nfs/dbraw/zinc/50/47/34/940504734.db2.gz REBQQFXSURESTG-NRFANRHFSA-N 0 3 403.530 4.008 20 0 HIADHN CCO[C@@H]1C[C@H](NCc2cccc(NC(=O)c3ccccc3Cl)c2)[C@@]12CCCO2 ZINC000544709977 940505362 /nfs/dbraw/zinc/50/53/62/940505362.db2.gz NGSLDDOOSXFKAH-XJUOHMSHSA-N 0 3 414.933 4.409 20 0 HIADHN CCC(CC)(CN[C@H](c1ccc(C)cc1)c1cccc(S(C)(=O)=O)c1)C(=O)OC ZINC000544833549 940518342 /nfs/dbraw/zinc/51/83/42/940518342.db2.gz WJZWVPHFFCDBGK-OAQYLSRUSA-N 0 3 417.571 4.057 20 0 HIADHN CCN(C(=O)c1cc(C)n(Cc2ccccn2)c1C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000544865255 940520227 /nfs/dbraw/zinc/52/02/27/940520227.db2.gz FLVXQCSGCJLMBI-DEOSSOPVSA-N 0 3 416.569 4.285 20 0 HIADHN O=C(Nc1cccc(-c2noc([C@@H]3CCCN(Cc4cccnc4)C3)n2)c1)C1CCC1 ZINC000544947528 940527212 /nfs/dbraw/zinc/52/72/12/940527212.db2.gz UEGMFKYQJINTKH-HXUWFJFHSA-N 0 3 417.513 4.250 20 0 HIADHN FC(F)(F)Oc1ccc(-c2noc([C@@H]3CCCN(Cc4cccnc4)C3)n2)cc1 ZINC000545036243 940535618 /nfs/dbraw/zinc/53/56/18/940535618.db2.gz SJPCODSKDCGGNO-MRXNPFEDSA-N 0 3 404.392 4.410 20 0 HIADHN C[C@H](CNC(=O)c1ccccc1)c1noc([C@@H]2CCCN(Cc3cccc(F)c3)C2)n1 ZINC000545046314 940536671 /nfs/dbraw/zinc/53/66/71/940536671.db2.gz AFGKXNWWXOLDCY-YLJYHZDGSA-N 0 3 422.504 4.122 20 0 HIADHN Cc1cc(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)c(C)n1Cc1ccncc1 ZINC000545166850 940553356 /nfs/dbraw/zinc/55/33/56/940553356.db2.gz HVRJIPOKVUNBFU-DEOSSOPVSA-N 0 3 402.542 4.115 20 0 HIADHN COc1ccc2[nH]c3c(c2c1)C[C@@H](N[C@H](c1nc(-c2cccnc2)no1)C(C)C)CC3 ZINC000545191450 940555295 /nfs/dbraw/zinc/55/52/95/940555295.db2.gz LBOVQVJCTGISLJ-AOMKIAJQSA-N 0 3 417.513 4.466 20 0 HIADHN COc1ccc2[nH]c3c(c2c1)C[C@@H](N[C@H](c1nc(-c2ccncc2)no1)C(C)C)CC3 ZINC000545191332 940555317 /nfs/dbraw/zinc/55/53/17/940555317.db2.gz RBQLRAZEBQEWRE-AOMKIAJQSA-N 0 3 417.513 4.466 20 0 HIADHN O=C(NC1(c2ccc(Cl)c(Cl)c2)CC1)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000545298675 940560607 /nfs/dbraw/zinc/56/06/07/940560607.db2.gz UZXSEQOWTFWJEL-MRXNPFEDSA-N 0 3 404.341 4.406 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CCC[C@@H]3Cc3cccc(OC)c3)c2)CC1 ZINC000545331893 940562225 /nfs/dbraw/zinc/56/22/25/940562225.db2.gz ZYQOZCCNPVORSQ-HSZRJFAPSA-N 0 3 422.573 4.076 20 0 HIADHN CCc1nc2c(s1)[C@H](N(C)C(=O)N[C@@H]1CCN(Cc3ccccc3)[C@@H]1C)CCC2 ZINC000563963759 945332205 /nfs/dbraw/zinc/33/22/05/945332205.db2.gz IKBXQKFQMSOANB-YVWKXTFCSA-N 0 3 412.603 4.387 20 0 HIADHN CS[C@@H]1CN(C(=O)Nc2ccc(Sc3nc(C)cs3)cc2C)C[C@@H]1N(C)C ZINC000545421107 940569018 /nfs/dbraw/zinc/56/90/18/940569018.db2.gz QQQBIVKSTLTJNI-DLBZAZTESA-N 0 3 422.645 4.420 20 0 HIADHN CS[C@H]1CN(C(=O)Nc2ccc(Br)cc2C(C)C)C[C@@H]1N(C)C ZINC000545442850 940570103 /nfs/dbraw/zinc/57/01/03/940570103.db2.gz YYPUKHUTRGYJLS-HOTGVXAUSA-N 0 3 400.386 4.082 20 0 HIADHN C[C@H]1CCN(C(=O)NCc2nc3ccccc3n2C2CC2)CCN1Cc1ccccc1 ZINC000545449006 940570400 /nfs/dbraw/zinc/57/04/00/940570400.db2.gz IXNHYLSEXXAORX-IBGZPJMESA-N 0 3 417.557 4.177 20 0 HIADHN CSc1ccc([C@H](C)NC(=O)NC[C@@H]2CN(Cc3ccccc3)CCCO2)cc1 ZINC000545469011 940571081 /nfs/dbraw/zinc/57/10/81/940571081.db2.gz DDDYRQLABMEFTA-GHTZIAJQSA-N 0 3 413.587 4.060 20 0 HIADHN COc1ccc(Br)cc1-c1nc(CN[C@H](CCO)C(C)(C)C)cs1 ZINC000545516721 940572915 /nfs/dbraw/zinc/57/29/15/940572915.db2.gz FPJSYRLOJURRTB-MRXNPFEDSA-N 0 3 413.381 4.468 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(/C=C\c4cnc(C(C)(C)C)s4)n3)cn2)CC1 ZINC000545650685 940578840 /nfs/dbraw/zinc/57/88/40/940578840.db2.gz FSNXGPQKNJILFN-CLFYSBASSA-N 0 3 424.574 4.198 20 0 HIADHN Fc1ccc2c(Cc3noc(-c4ccc(CN5CCSCC5)cc4)n3)c[nH]c2c1 ZINC000545680638 940580381 /nfs/dbraw/zinc/58/03/81/940580381.db2.gz ZAIKXTWALCXFRO-UHFFFAOYSA-N 0 3 408.502 4.497 20 0 HIADHN CC(C)N1CCN(c2ccc(-c3nc(-c4cccc(C(F)(F)F)n4)no3)cc2)CC1 ZINC000545729024 940582707 /nfs/dbraw/zinc/58/27/07/940582707.db2.gz DHAAEGWFKTUHFE-UHFFFAOYSA-N 0 3 417.435 4.348 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)[C@H](C)c1c(C)nn(CC(F)(F)F)c1C)c1ccco1 ZINC000563986616 945336588 /nfs/dbraw/zinc/33/65/88/945336588.db2.gz AYYJEKXZECIHPY-ZENOOKHLSA-N 0 3 414.472 4.004 20 0 HIADHN Cc1cc(C(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)c(C)n1Cc1ccncc1 ZINC000545862697 940642343 /nfs/dbraw/zinc/64/23/43/940642343.db2.gz TWBWDYOWGSLMOY-AUSIDOKSSA-N 0 3 402.542 4.114 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)c1cn(C)nc1-c1ccc(Cl)s1)c1ccco1 ZINC000563987787 945337950 /nfs/dbraw/zinc/33/79/50/945337950.db2.gz MGXFPOTZOGGUHY-OCCSQVGLSA-N 0 3 406.939 4.254 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)CCc1cc(Br)ccc1F)c1ccco1 ZINC000563989529 945337979 /nfs/dbraw/zinc/33/79/79/945337979.db2.gz VZUUUUQYZUYRGN-SUMWQHHRSA-N 0 3 411.315 4.359 20 0 HIADHN C[C@H](NCCCS(=O)(=O)c1ccccc1)c1cccc(NC(=O)c2ccccc2)c1 ZINC000545922659 940658394 /nfs/dbraw/zinc/65/83/94/940658394.db2.gz YXMCCDMQPWMASX-IBGZPJMESA-N 0 3 422.550 4.454 20 0 HIADHN CCO[C@@H]1C[C@H](NCc2cnc(-c3ccc(Br)cc3)s2)[C@]12CCCO2 ZINC000546058989 940684930 /nfs/dbraw/zinc/68/49/30/940684930.db2.gz JVVDELHBHPWWNF-YQVWRLOYSA-N 0 3 423.376 4.389 20 0 HIADHN COc1ccc(C(=O)CCCCC(=O)N(Cc2ccco2)C2CCN(C)CC2)cc1 ZINC000546093646 940698811 /nfs/dbraw/zinc/69/88/11/940698811.db2.gz SLEDNYFFCMFJLP-UHFFFAOYSA-N 0 3 412.530 4.154 20 0 HIADHN COCC(=O)Nc1cccc(CN[C@@H](Cc2cccnc2)c2ccc(Cl)cc2)c1 ZINC000546163585 940718489 /nfs/dbraw/zinc/71/84/89/940718489.db2.gz MOSUKGFNHVIYAM-QFIPXVFZSA-N 0 3 409.917 4.394 20 0 HIADHN CCCc1c(NC(=O)NC[C@@H](C)N(C)Cc2ccccc2)cnn1-c1cc(C)ccn1 ZINC000546217327 940731954 /nfs/dbraw/zinc/73/19/54/940731954.db2.gz JWNIHIMYFXYZEL-LJQANCHMSA-N 0 3 420.561 4.170 20 0 HIADHN CCO[C@@H]1C[C@@H](NCc2c(C)nn(Cc3ccccc3Cl)c2C)[C@]12CCCO2 ZINC000546255727 940749995 /nfs/dbraw/zinc/74/99/95/940749995.db2.gz KPKBRSRHNWNZMM-YPAWHYETSA-N 0 3 403.954 4.018 20 0 HIADHN Fc1cccc(CN2CCC[C@@H](c3nc(-c4ccncc4N4CCCC4)no3)C2)c1 ZINC000546528612 940844881 /nfs/dbraw/zinc/84/48/81/940844881.db2.gz VDALNMBLHKSVJR-GOSISDBHSA-N 0 3 407.493 4.251 20 0 HIADHN CO[C@@H](C)c1nc(Cc2noc([C@H]3CCCN(Cc4cccc(F)c4)C3)n2)cs1 ZINC000546533462 940846050 /nfs/dbraw/zinc/84/60/50/940846050.db2.gz QPBWTQZPLBQLCF-HOCLYGCPSA-N 0 3 416.522 4.343 20 0 HIADHN Cc1cc(C(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)c(C)n1Cc1ccncc1 ZINC000546571415 940855782 /nfs/dbraw/zinc/85/57/82/940855782.db2.gz KOLYGFLVAMFMGN-RUZDIDTESA-N 0 3 416.569 4.424 20 0 HIADHN Cn1ccc([C@H](NC2CCN(CCC(F)(F)F)CC2)c2ccc(Cl)cc2)n1 ZINC000546573106 940855927 /nfs/dbraw/zinc/85/59/27/940855927.db2.gz WXIMHNWZPXWVTG-GOSISDBHSA-N 0 3 400.876 4.169 20 0 HIADHN C[C@@H](NCc1cc2cc(Br)ccc2[nH]1)c1ccc(S(C)(=O)=O)cc1 ZINC000546648936 940865003 /nfs/dbraw/zinc/86/50/03/940865003.db2.gz HIXZOQKOLLLEQT-GFCCVEGCSA-N 0 3 407.333 4.185 20 0 HIADHN COc1cc(CN2CCCC[C@@H]2c2ccccc2)ccc1OCC(=O)N1CCCC1 ZINC000546691457 940869529 /nfs/dbraw/zinc/86/95/29/940869529.db2.gz BOPVKLFQIRJZOP-JOCHJYFZSA-N 0 3 408.542 4.424 20 0 HIADHN CC(C)Cc1ccc([C@@H](CNC(=O)[C@H]2CCc3nc(C(C)C)[nH]c3C2)N(C)C)cc1 ZINC000564030239 945358070 /nfs/dbraw/zinc/35/80/70/945358070.db2.gz VJCNIHBGHNAWDJ-NZQKXSOJSA-N 0 3 410.606 4.256 20 0 HIADHN CCN(C(=O)c1cnn(-c2ccccc2F)c1C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000546914363 940911832 /nfs/dbraw/zinc/91/18/32/940911832.db2.gz BYNBRUFEOTZGFU-HXUWFJFHSA-N 0 3 406.505 4.056 20 0 HIADHN O=C1CCCN1c1cccc(-c2noc([C@@H]3CCCN(Cc4cccc(F)c4)C3)n2)c1 ZINC000546983754 940938522 /nfs/dbraw/zinc/93/85/22/940938522.db2.gz JEPULFDMJGYSBB-LJQANCHMSA-N 0 3 420.488 4.382 20 0 HIADHN CN1CC[C@@H](c2noc(-c3ccc(CN4CCSCC4)cc3)n2)c2ccccc21 ZINC000547051988 940975823 /nfs/dbraw/zinc/97/58/23/940975823.db2.gz BDXJVDWMLYMUBF-HXUWFJFHSA-N 0 3 406.555 4.257 20 0 HIADHN C[C@@H](CSc1ccccc1)c1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1 ZINC000547066154 940981415 /nfs/dbraw/zinc/98/14/15/940981415.db2.gz GUYQZBIQVJLCHR-KRWDZBQOSA-N 0 3 409.559 4.169 20 0 HIADHN CC(C)NC(=O)Nc1cccc(-c2noc([C@H]3CCCN(Cc4cccnc4)C3)n2)c1 ZINC000547116712 941002078 /nfs/dbraw/zinc/00/20/78/941002078.db2.gz QZGGOYFLOUYJAD-IBGZPJMESA-N 0 3 420.517 4.041 20 0 HIADHN CC[C@@H](C(=O)Nc1cccc(C(=O)N2CCc3sccc3C2)c1C)N(CC)CC ZINC000547303293 941055450 /nfs/dbraw/zinc/05/54/50/941055450.db2.gz PKMQWDPSGHHBJO-FQEVSTJZSA-N 0 3 413.587 4.314 20 0 HIADHN C[C@](O)(C1CCN(CCC(=O)Nc2ccccc2C(F)(F)F)CC1)C(F)(F)F ZINC000547345613 941057673 /nfs/dbraw/zinc/05/76/73/941057673.db2.gz KRPMXMDPIACVJV-INIZCTEOSA-N 0 3 412.374 4.059 20 0 HIADHN CN1CCN(C[C@@H](N[C@H]2CCCc3ncc(C(F)(F)F)cc32)c2ccccc2)CC1 ZINC000547654102 941070729 /nfs/dbraw/zinc/07/07/29/941070729.db2.gz STLDFQARWKOBPY-FCHUYYIVSA-N 0 3 418.507 4.056 20 0 HIADHN CSc1ccc([C@H](C)NCc2ccc(N3CCCS3(=O)=O)c(F)c2)cc1F ZINC000547831565 941077693 /nfs/dbraw/zinc/07/76/93/941077693.db2.gz ISCKBNGCJOEGKZ-ZDUSSCGKSA-N 0 3 412.527 4.077 20 0 HIADHN CCN(C[C@@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)c1cccc2c(C)ccnc21 ZINC000547965301 941081031 /nfs/dbraw/zinc/08/10/31/941081031.db2.gz GGHVEDDNGXYDMV-OAQYLSRUSA-N 0 3 423.582 4.076 20 0 HIADHN COCCOc1ccc(C(F)(F)F)cc1NC(=O)CN(C)[C@H]1CCCC[C@@H]1C ZINC000548403127 941099831 /nfs/dbraw/zinc/09/98/31/941099831.db2.gz PQLIFUNPSDEYHX-YOEHRIQHSA-N 0 3 402.457 4.180 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)Nc3cccc(NCC(F)(F)F)c3)cc2)CC1 ZINC000548406820 941100476 /nfs/dbraw/zinc/10/04/76/941100476.db2.gz WNBWLFAVOLQSEC-UHFFFAOYSA-N 0 3 420.479 4.444 20 0 HIADHN CC(C)c1noc(CCC(=O)N[C@H](c2ccc(F)c(F)c2)C(C)(C)N2CCCC2)n1 ZINC000548601484 941114153 /nfs/dbraw/zinc/11/41/53/941114153.db2.gz HSPPVIHBCWFMPT-HXUWFJFHSA-N 0 3 420.504 4.136 20 0 HIADHN O=C(N[C@H]1CCOc2ccc(F)cc21)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000548706888 941120609 /nfs/dbraw/zinc/12/06/09/941120609.db2.gz VSJXPYPTXUHEJP-RXVVDRJESA-N 0 3 422.422 4.220 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)c1ncsc1C(F)(F)F ZINC000548714407 941120999 /nfs/dbraw/zinc/12/09/99/941120999.db2.gz XVSHBEBBPZKSNM-UHFFFAOYSA-N 0 3 401.479 4.006 20 0 HIADHN O=C(N[C@H](c1ccccc1)C(F)(F)F)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000548723306 941121624 /nfs/dbraw/zinc/12/16/24/941121624.db2.gz PYQXHLNNJDNBDJ-UYSNPLJNSA-N 0 3 423.401 4.395 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)NCc1cc2ccccc2s1 ZINC000548936433 941130939 /nfs/dbraw/zinc/13/09/39/941130939.db2.gz RPHUIXCEXYUGEJ-UHFFFAOYSA-N 0 3 422.598 4.303 20 0 HIADHN CCOC(=O)C1CCC(N(CC)Cc2nc3sc4c(c3c(N)n2)CCCC4)CC1 ZINC000548939479 941131179 /nfs/dbraw/zinc/13/11/79/941131179.db2.gz MZBCCBYZWXCEKL-UHFFFAOYSA-N 0 3 416.591 4.096 20 0 HIADHN CN(C)C[C@@H](NC(=O)Nc1ccc(C(=O)NC(C)(C)C)cc1)c1ccc(Cl)cc1 ZINC000548963773 941134943 /nfs/dbraw/zinc/13/49/43/941134943.db2.gz QWUUAKLBGWGFKG-LJQANCHMSA-N 0 3 416.953 4.293 20 0 HIADHN Cc1nc(COc2ccc(CN[C@@H](CN(C)C)c3ccc(Cl)cc3)cc2)no1 ZINC000548991650 941139719 /nfs/dbraw/zinc/13/97/19/941139719.db2.gz LYFLGCZOWAXGRQ-FQEVSTJZSA-N 0 3 400.910 4.003 20 0 HIADHN c1ncn(-c2ccc(CN(Cc3ccc(OCc4ccncc4)cc3)C3CC3)cc2)n1 ZINC000549074211 941152767 /nfs/dbraw/zinc/15/27/67/941152767.db2.gz RPOLEOMUCRLILL-UHFFFAOYSA-N 0 3 411.509 4.406 20 0 HIADHN Cn1nccc1C1=C[C@H]2CC[C@@H](C1)N2CCC(=O)Nc1ccccc1C(F)(F)F ZINC000549086825 941155545 /nfs/dbraw/zinc/15/55/45/941155545.db2.gz XCKJBRWHQCGKSI-CVEARBPZSA-N 0 3 404.436 4.088 20 0 HIADHN COc1cc2c(cc1F)CC[C@@H]2NC(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000549100866 941158655 /nfs/dbraw/zinc/15/86/55/941158655.db2.gz LKIPNEFPDAMUKI-ROUUACIJSA-N 0 3 403.523 4.019 20 0 HIADHN CCN1CC[C@H](NCC(=O)N[C@H](C)c2cccs2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000549111872 941160773 /nfs/dbraw/zinc/16/07/73/941160773.db2.gz DNEZIYAZFHRCNF-ASUYLVSUSA-N 0 3 409.958 4.143 20 0 HIADHN CCN1CC[C@@H](NCC(=O)Nc2ccc(Cl)cc2)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000549113798 941161226 /nfs/dbraw/zinc/16/12/26/941161226.db2.gz OEUJSPLJCRYABC-XLIONFOSSA-N 0 3 411.855 4.121 20 0 HIADHN CCN1CC[C@H](NCC(=O)Nc2ccc(Cl)cc2)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000549113796 941161237 /nfs/dbraw/zinc/16/12/37/941161237.db2.gz OEUJSPLJCRYABC-PXNSSMCTSA-N 0 3 411.855 4.121 20 0 HIADHN CCOC(=O)C1CCC(N(CC)CC(=O)c2cc(C)n(-c3nccs3)c2C)CC1 ZINC000549181955 941169094 /nfs/dbraw/zinc/16/90/94/941169094.db2.gz ZLIUFYWYEVIJMY-UHFFFAOYSA-N 0 3 417.575 4.177 20 0 HIADHN Cc1nc(-c2ccc(C)c(NC(=O)N[C@H](CN(C)C)c3ccc(Cl)cc3)c2)n[nH]1 ZINC000549216190 941171576 /nfs/dbraw/zinc/17/15/76/941171576.db2.gz GFCPDULGZUZTDI-LJQANCHMSA-N 0 3 412.925 4.166 20 0 HIADHN CC(=O)Nc1ccc(S[C@H](C)C(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)cc1 ZINC000549229689 941172309 /nfs/dbraw/zinc/17/23/09/941172309.db2.gz DBEANUPKYQCPBU-VLIAUNLRSA-N 0 3 419.978 4.198 20 0 HIADHN CCN(CC)CCN(Cc1cccs1)S(=O)(=O)Cc1ccc(C(F)F)cc1 ZINC000549325631 941180117 /nfs/dbraw/zinc/18/01/17/941180117.db2.gz DXZBFHNXKRGOGM-UHFFFAOYSA-N 0 3 416.559 4.360 20 0 HIADHN Cn1cc(-c2ccc(CN3CCCC[C@@H]3CNC(=O)Nc3ccccc3)s2)cn1 ZINC000549401278 941186221 /nfs/dbraw/zinc/18/62/21/941186221.db2.gz WBRFURNLXYQJCK-LJQANCHMSA-N 0 3 409.559 4.325 20 0 HIADHN COc1ccc(OCCCN2CCC(Oc3c(OC)cccc3OC)CC2)cc1 ZINC000549470086 941193116 /nfs/dbraw/zinc/19/31/16/941193116.db2.gz UXUGPXKNOBGJQH-UHFFFAOYSA-N 0 3 401.503 4.025 20 0 HIADHN Cc1cc(NC(=O)[C@H](C)N[C@@H]2CCN(C(C)(C)C)[C@@H]2c2ccc(Cl)c(F)c2)on1 ZINC000549476044 941194447 /nfs/dbraw/zinc/19/44/47/941194447.db2.gz BWQKSSSDHBLJNE-BOFPYLFWSA-N 0 3 422.932 4.306 20 0 HIADHN CCN1CC[C@H](N[C@@H](C)C(=O)Nc2ccc(C)cc2F)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000549482089 941195165 /nfs/dbraw/zinc/19/51/65/941195165.db2.gz KXURWKZQUQYFSK-JBZDTAIVSA-N 0 3 423.454 4.304 20 0 HIADHN CN(C)C[C@H](NC(=O)N[C@@H]1CCO[C@H]1c1ccc(Cl)cc1)c1ccc(Cl)cc1 ZINC000549491000 941195780 /nfs/dbraw/zinc/19/57/80/941195780.db2.gz ZGMWJBKJNDSRBM-AABGKKOBSA-N 0 3 422.356 4.426 20 0 HIADHN COCCc1ccc(OC[C@@H](O)CN2CCCC[C@@H]2c2cc3ccccc3[nH]2)cc1 ZINC000549527825 941198082 /nfs/dbraw/zinc/19/80/82/941198082.db2.gz VXVSHTILOAWHOJ-SQJMNOBHSA-N 0 3 408.542 4.324 20 0 HIADHN COc1cc(CN2[C@@H]3CC[C@H]2C[C@@H](c2ccccc2)C3)cc(Cl)c1OCC(N)=O ZINC000549808102 941207873 /nfs/dbraw/zinc/20/78/73/941207873.db2.gz JTLZXDWIWXXHPA-REPLKXPHSA-N 0 3 414.933 4.123 20 0 HIADHN C[C@@H](NCc1ccc(OCc2nccn2C)cc1)c1ccc(-n2cccn2)c(F)c1 ZINC000549833680 941208898 /nfs/dbraw/zinc/20/88/98/941208898.db2.gz XDTKLTJWQZQNIQ-QGZVFWFLSA-N 0 3 405.477 4.175 20 0 HIADHN C[C@H](c1ccc(F)cc1)N1CCC[C@H](NCc2ccc(-c3cnn(C)c3)s2)C1=O ZINC000549907511 941235914 /nfs/dbraw/zinc/23/59/14/941235914.db2.gz LXFXLZPUTKMRBT-QRWLVFNGSA-N 0 3 412.534 4.130 20 0 HIADHN O=S(=O)(CCCNCc1cc(F)cc(C(F)(F)F)c1)c1ccc(Cl)cc1 ZINC000549935761 941243213 /nfs/dbraw/zinc/24/32/13/941243213.db2.gz CRZJQNKSBAMDPT-UHFFFAOYSA-N 0 3 409.832 4.452 20 0 HIADHN C[C@H](Cc1cccc(O)c1)NC(=O)N(CCN(C)C)Cc1ccc(C(F)(F)F)cc1 ZINC000550271812 941307553 /nfs/dbraw/zinc/30/75/53/941307553.db2.gz ZZAFQPJCXNMYPB-MRXNPFEDSA-N 0 3 423.479 4.115 20 0 HIADHN CC(C)[C@]1(CO)CCCN([C@H](C)C(=O)N[C@@H](C)c2ccc(Cl)cc2Cl)C1 ZINC000550433751 941326707 /nfs/dbraw/zinc/32/67/07/941326707.db2.gz UHACBEVSMMLGJY-BXTJHSDWSA-N 0 3 401.378 4.290 20 0 HIADHN CN(C(=O)NCc1cc2ccccc2s1)C1CCN(CCc2ccccn2)CC1 ZINC000550606914 941345487 /nfs/dbraw/zinc/34/54/87/941345487.db2.gz DIQYSCIZBLITOT-UHFFFAOYSA-N 0 3 408.571 4.145 20 0 HIADHN C/C=C/c1ccc(OC[C@@H](O)CNCc2cc(F)cc(Br)c2)c(OC)c1 ZINC000550624281 941347130 /nfs/dbraw/zinc/34/71/30/941347130.db2.gz NDRJBSUVXMCXLC-WHLIDYPQSA-N 0 3 424.310 4.159 20 0 HIADHN Cc1ccc([C@H](NC(=O)CN[C@H]2CCN(C)[C@H]2c2ccccc2)c2cccs2)cc1 ZINC000550705460 941356732 /nfs/dbraw/zinc/35/67/32/941356732.db2.gz UAFSXUUUAAZEAM-TUSQITKMSA-N 0 3 419.594 4.297 20 0 HIADHN Cc1cc(C)c(NC(=O)CN[C@@H]2CCN(C)[C@H]2c2ccc(F)c(F)c2)c(Cl)c1 ZINC000550714524 941357822 /nfs/dbraw/zinc/35/78/22/941357822.db2.gz XQFUQRLLSIOQQQ-NQIIRXRSSA-N 0 3 407.892 4.209 20 0 HIADHN C[C@H]1CN(c2ccccc2CNCc2ccc(OCc3ccccn3)cc2)CCO1 ZINC000550758806 941363590 /nfs/dbraw/zinc/36/35/90/941363590.db2.gz SXZOAONJWBDXHW-FQEVSTJZSA-N 0 3 403.526 4.176 20 0 HIADHN COc1cccc(C(=O)CCCC(=O)NC2C[C@H]3CC[C@@H](C2)N3Cc2ccccc2)c1 ZINC000550961239 941387042 /nfs/dbraw/zinc/38/70/42/941387042.db2.gz CQGJKMPJPBZYFB-NOTZXAQLSA-N 0 3 420.553 4.360 20 0 HIADHN O[C@@H](CNCc1cc(F)cc(Br)c1)COc1ccc2ccccc2c1 ZINC000551007944 941394332 /nfs/dbraw/zinc/39/43/32/941394332.db2.gz QXUKMNIXUSVNDB-IBGZPJMESA-N 0 3 404.279 4.271 20 0 HIADHN Cc1cc(N2CCCC[C@H]2C)ccc1NS(=O)(=O)c1ccc(CN(C)C)cc1 ZINC000551017650 941395920 /nfs/dbraw/zinc/39/59/20/941395920.db2.gz UZVMTJMCEXKFJQ-GOSISDBHSA-N 0 3 401.576 4.236 20 0 HIADHN COc1cccc(-c2nc(CN[C@@H]3CCN(C)[C@H]3c3ccccc3)cs2)c1OC ZINC000551069866 941404374 /nfs/dbraw/zinc/40/43/74/941404374.db2.gz WMZDYNIYGSBCDX-CTNGQTDRSA-N 0 3 409.555 4.362 20 0 HIADHN Cc1ccc(-c2n[nH]cc2CNc2ccc(C(=O)N(C)[C@@H]3CCCN(C)C3)cc2)cc1 ZINC000551091471 941407943 /nfs/dbraw/zinc/40/79/43/941407943.db2.gz LWIQHEIZGBXOQU-HSZRJFAPSA-N 0 3 417.557 4.163 20 0 HIADHN CCCN(C)[C@@H](CN[C@H](c1nc[nH]n1)c1ccc(F)cc1)c1ccc(Cl)cc1 ZINC000551197367 941426589 /nfs/dbraw/zinc/42/65/89/941426589.db2.gz NSXVRKZPDMWTNP-PMACEKPBSA-N 0 3 401.917 4.359 20 0 HIADHN Fc1ccc([C@@H](NCC2(c3cccc(Br)c3)CC2)c2c[nH]nn2)cc1 ZINC000551267190 941439819 /nfs/dbraw/zinc/43/98/19/941439819.db2.gz OAYKVPLKWQSUIS-GOSISDBHSA-N 0 3 401.283 4.117 20 0 HIADHN Fc1ccc([C@H](NCC2(c3cccc(Br)c3)CC2)c2c[nH]nn2)cc1 ZINC000551267191 941440039 /nfs/dbraw/zinc/44/00/39/941440039.db2.gz OAYKVPLKWQSUIS-SFHVURJKSA-N 0 3 401.283 4.117 20 0 HIADHN CN(C)Cc1ccc(S(=O)(=O)N(Cc2ccccn2)c2ccc(Cl)cc2)cc1 ZINC000551386101 941466178 /nfs/dbraw/zinc/46/61/78/941466178.db2.gz KIVKORQRIFNKSG-UHFFFAOYSA-N 0 3 415.946 4.192 20 0 HIADHN COc1ccc2ccccc2c1CN(C[C@H]1CCCS(=O)(=O)C1)C1CCCC1 ZINC000551385251 941466306 /nfs/dbraw/zinc/46/63/06/941466306.db2.gz JELDPBMJANNNCD-GOSISDBHSA-N 0 3 401.572 4.418 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)Nc1ccc(Oc2cccnc2)nc1 ZINC000551392812 941468108 /nfs/dbraw/zinc/46/81/08/941468108.db2.gz PSZAUMSUWZDMAQ-UHFFFAOYSA-N 0 3 419.529 4.297 20 0 HIADHN CN(C(=O)Nc1ccc(Oc2cccnc2)nc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000551393525 941468521 /nfs/dbraw/zinc/46/85/21/941468521.db2.gz SBHDGSWIPXNYNI-HXUWFJFHSA-N 0 3 403.486 4.007 20 0 HIADHN COC1(c2nc(-c3ccccn3)no2)CCN([C@@H]2CCc3ccc(Cl)cc32)CC1 ZINC000551417510 941474941 /nfs/dbraw/zinc/47/49/41/941474941.db2.gz CMLVFLVMFMIVCS-LJQANCHMSA-N 0 3 410.905 4.410 20 0 HIADHN COc1cc(CNc2ccc(C(=O)N(C)[C@@H]3CCCN(C)C3)cc2)ccc1SC ZINC000551450304 941482091 /nfs/dbraw/zinc/48/20/91/941482091.db2.gz BBTHVNDADQRGBE-HXUWFJFHSA-N 0 3 413.587 4.195 20 0 HIADHN COc1ncc([C@@H](C)NC[C@H](O)COc2cccc(Cl)c2Cl)cc1Cl ZINC000551529991 941496080 /nfs/dbraw/zinc/49/60/80/941496080.db2.gz LFWJWIUDBMAMQN-PWSUYJOCSA-N 0 3 405.709 4.141 20 0 HIADHN CC(C)Oc1ccc([C@H](C)NCc2ccc([C@]3(C)NC(=O)NC3=O)cc2)cc1Cl ZINC000551533274 941496538 /nfs/dbraw/zinc/49/65/38/941496538.db2.gz JUQZTEFOWNWNHB-FPTDNZKUSA-N 0 3 415.921 4.033 20 0 HIADHN COC(=O)c1ccc(COc2ccccc2CN2CCC(c3c[nH]nc3C)CC2)cc1 ZINC000551563373 941502097 /nfs/dbraw/zinc/50/20/97/941502097.db2.gz GGPOUTDAUWJSNI-UHFFFAOYSA-N 0 3 419.525 4.463 20 0 HIADHN CCOc1ccc(CN[C@@H](CCn2cncn2)c2ccc(OC)cc2)cc1Cl ZINC000551569540 941503833 /nfs/dbraw/zinc/50/38/33/941503833.db2.gz FOQJCIGIYMOEMJ-FQEVSTJZSA-N 0 3 400.910 4.260 20 0 HIADHN COc1ccc([C@@H](CNCc2c(F)cccc2OC(F)(F)F)N(C)C)cc1OC ZINC000551570758 941503887 /nfs/dbraw/zinc/50/38/87/941503887.db2.gz AMYCQVGCYGPTIM-MRXNPFEDSA-N 0 3 416.415 4.134 20 0 HIADHN Brc1cccc([C@@H](NCc2cnc3n2CCCC3)C2CCOCC2)c1 ZINC000551572852 941504748 /nfs/dbraw/zinc/50/47/48/941504748.db2.gz LIHGXYKCPJGQSG-FQEVSTJZSA-N 0 3 404.352 4.239 20 0 HIADHN C[C@@H](NCc1cccc(I)c1)c1ccc2c(c1)CCC(=O)N2 ZINC000551575760 941505280 /nfs/dbraw/zinc/50/52/80/941505280.db2.gz NQTONRZGXTYRCC-GFCCVEGCSA-N 0 3 406.267 4.027 20 0 HIADHN COc1ccc([C@H](CN(C)C)NCC2=Cc3cc(Br)ccc3OC2)cc1 ZINC000551581738 941506352 /nfs/dbraw/zinc/50/63/52/941506352.db2.gz QLIGWOXEUSSOMQ-FQEVSTJZSA-N 0 3 417.347 4.126 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)[C@@H]1CCCc2cccnc21 ZINC000551646386 941517875 /nfs/dbraw/zinc/51/78/75/941517875.db2.gz NKTJLRXAQHGUOF-FCHUYYIVSA-N 0 3 415.541 4.092 20 0 HIADHN COc1ccc([C@H](NCCn2cc(C)cn2)c2ccccc2)cc1Br ZINC000551699115 941528672 /nfs/dbraw/zinc/52/86/72/941528672.db2.gz LIAIOXQBTQKTDS-HXUWFJFHSA-N 0 3 400.320 4.342 20 0 HIADHN CCS(=O)(=O)c1ccc([C@@H](C)NCCOc2ccc(OC(F)(F)F)cc2)cc1 ZINC000551714053 941531238 /nfs/dbraw/zinc/53/12/38/941531238.db2.gz RDAZLJSEXPALAS-CQSZACIVSA-N 0 3 417.449 4.108 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)c2sc(-c3ccccc3C)nc2C)cc1 ZINC000551795500 941546105 /nfs/dbraw/zinc/54/61/05/941546105.db2.gz FCXSSIGTWSEYHO-FQEVSTJZSA-N 0 3 409.555 4.468 20 0 HIADHN C[C@H]1CN([C@H](CNCc2cnc(C(C)(C)C)nc2)c2c(F)cccc2Cl)CCO1 ZINC000551799248 941547699 /nfs/dbraw/zinc/54/76/99/941547699.db2.gz OZFLHWOOXIDFLQ-HNAYVOBHSA-N 0 3 420.960 4.118 20 0 HIADHN COc1ccc(C[C@@H](C)N[C@H](c2nc(-c3cccnc3)no2)C(C)C)c(C)c1OC ZINC000552045801 941573399 /nfs/dbraw/zinc/57/33/99/941573399.db2.gz PLPBLDMVKVJJBP-QRWLVFNGSA-N 0 3 410.518 4.375 20 0 HIADHN CC1(C)Cc2c(cccc2Br)[C@H]1NCc1ccc2c(c1)NC(=O)CO2 ZINC000552051779 941574501 /nfs/dbraw/zinc/57/45/01/941574501.db2.gz GINIISCAIIXTRH-LJQANCHMSA-N 0 3 401.304 4.193 20 0 HIADHN C[C@@H](CC(=O)Nc1cccc(C(F)(F)F)c1)N[C@@H](CC(=O)N(C)C)c1ccccc1 ZINC000552073629 941579430 /nfs/dbraw/zinc/57/94/30/941579430.db2.gz LJZQTADXXIJELX-KXBFYZLASA-N 0 3 421.463 4.232 20 0 HIADHN COc1cc(OC)cc(Oc2ccc(CN3CCC(O[C@@H]4CCOC4)CC3)cc2)c1 ZINC000552080103 941581182 /nfs/dbraw/zinc/58/11/82/941581182.db2.gz VZWVTPFJXMYSSU-OAQYLSRUSA-N 0 3 413.514 4.266 20 0 HIADHN CCc1nc(C(=O)Nc2cccc(N3CCN(CCc4ccccc4)CC3)c2)c(C)o1 ZINC000552139378 941592443 /nfs/dbraw/zinc/59/24/43/941592443.db2.gz DJMQZOMZQMTHQQ-UHFFFAOYSA-N 0 3 418.541 4.162 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@@H](O)C2)c1)c1cc(-c2ccccn2)ccc1Cl ZINC000552200055 941601150 /nfs/dbraw/zinc/60/11/50/941601150.db2.gz SISVZAPWLHFYRX-LJQANCHMSA-N 0 3 407.901 4.221 20 0 HIADHN CCCN(C)[C@H](CNC(=O)c1cc(NC(C)=O)ccc1C)c1ccc(Cl)cc1 ZINC000552243742 941612232 /nfs/dbraw/zinc/61/22/32/941612232.db2.gz JEZFNUKJABBLMP-OAQYLSRUSA-N 0 3 401.938 4.420 20 0 HIADHN COC(=O)c1csc([C@H](C)N[C@@H](C)CC(=O)Nc2cccc(N3CCCC3)c2)c1 ZINC000552247322 941613339 /nfs/dbraw/zinc/61/33/39/941613339.db2.gz KMGYPZAXJXTHQK-HOTGVXAUSA-N 0 3 415.559 4.203 20 0 HIADHN C[C@@H](N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1)c1ccccc1-n1ccnn1 ZINC000552249814 941614069 /nfs/dbraw/zinc/61/40/69/941614069.db2.gz LJJRCVSOKHWQSB-AUSIDOKSSA-N 0 3 411.509 4.168 20 0 HIADHN CC[C@@H](N[C@@H](C)c1ccc(S(=O)(=O)NC)cc1)c1ccc(OC(F)(F)F)cc1 ZINC000552250103 941614166 /nfs/dbraw/zinc/61/41/66/941614166.db2.gz VCPOFDPEEODDLP-SCLBCKFNSA-N 0 3 416.465 4.295 20 0 HIADHN COc1ccc([C@@H](C)N[C@@H]2CCCN(c3ccc(F)cc3C)C2=O)c(C)c1OC ZINC000552252618 941614565 /nfs/dbraw/zinc/61/45/65/941614565.db2.gz RQVWYZQDYRFCQA-VQIMIIECSA-N 0 3 400.494 4.306 20 0 HIADHN CCC[C@H](C)C(=O)NCCNCc1cccc(NC(=O)c2ccc(Cl)cc2)c1 ZINC000552292446 941624226 /nfs/dbraw/zinc/62/42/26/941624226.db2.gz QRKGNQGEKKWRDL-INIZCTEOSA-N 0 3 401.938 4.234 20 0 HIADHN Cc1ccc(NC(=O)C[C@H](C)N[C@@H](CC(=O)N(C)C)c2ccccc2)cc1Cl ZINC000552295625 941625162 /nfs/dbraw/zinc/62/51/62/941625162.db2.gz RNGDIXGXOZHEEC-JXFKEZNVSA-N 0 3 401.938 4.175 20 0 HIADHN Cc1ccc(NC(=O)C[C@H](C)N[C@H](CC(=O)N(C)C)c2ccccc2)cc1Cl ZINC000552295626 941625204 /nfs/dbraw/zinc/62/52/04/941625204.db2.gz RNGDIXGXOZHEEC-OXJNMPFZSA-N 0 3 401.938 4.175 20 0 HIADHN CN(C(=O)c1cccc(C(=O)Nc2ccccc2)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000552330536 941633576 /nfs/dbraw/zinc/63/35/76/941633576.db2.gz VSNVZNXMQJFZRQ-DEOSSOPVSA-N 0 3 413.521 4.285 20 0 HIADHN CC(C)(CO)[C@@H](NCc1ccc(Br)c2cccnc12)c1cccnc1 ZINC000552344745 941639490 /nfs/dbraw/zinc/63/94/90/941639490.db2.gz DQPTWTGSYYAYEM-IBGZPJMESA-N 0 3 400.320 4.242 20 0 HIADHN CC(C)C[C@H](Cc1cccc(Br)c1)C(=O)N1[C@@H]2CC[C@H]1CCN(C)C2 ZINC000552420554 941665722 /nfs/dbraw/zinc/66/57/22/941665722.db2.gz IXQDCJXXNDONAV-YZGWKJHDSA-N 0 3 407.396 4.349 20 0 HIADHN Cc1cccc(COc2cccc(C(=O)Nc3cccc(CN4CC[C@@H](O)C4)c3)c2)c1 ZINC000552517963 941693206 /nfs/dbraw/zinc/69/32/06/941693206.db2.gz QWJNTYYCCDJDED-XMMPIXPASA-N 0 3 416.521 4.393 20 0 HIADHN CC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(Oc3ccc(F)cc3)cc2)cc1 ZINC000552626119 941726775 /nfs/dbraw/zinc/72/67/75/941726775.db2.gz JNRLWEHZXQYOTF-NRFANRHFSA-N 0 3 409.457 4.350 20 0 HIADHN C[C@@H](CC(=O)c1ccccc1F)C(=O)N1CC[C@]2(CCN(Cc3ccccc3)C2)C1 ZINC000552678987 941735719 /nfs/dbraw/zinc/73/57/19/941735719.db2.gz LSUGHNZWNNGNRK-DFBJGRDBSA-N 0 3 408.517 4.159 20 0 HIADHN CCc1ccc(-c2nc(CC(=O)N[C@H](CN(C)C)c3ccc(OC)cc3)cs2)cc1 ZINC000552814201 941773730 /nfs/dbraw/zinc/77/37/30/941773730.db2.gz XKGQNRFIPMZZOX-JOCHJYFZSA-N 0 3 423.582 4.343 20 0 HIADHN CC[C@@H](C)Oc1cccc(NC(=O)N(C)C2CCN(CCc3ccccn3)CC2)c1 ZINC000552825867 941779315 /nfs/dbraw/zinc/77/93/15/941779315.db2.gz XNOQQBVYUNVVLO-LJQANCHMSA-N 0 3 410.562 4.430 20 0 HIADHN CC1CCN([C@@H](CNC(=O)Cc2cnccc2C(F)(F)F)c2cccs2)CC1 ZINC000552831585 941780137 /nfs/dbraw/zinc/78/01/37/941780137.db2.gz ZEGLGKMYNLLROF-KRWDZBQOSA-N 0 3 411.493 4.294 20 0 HIADHN O=C(CCc1cncs1)N(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000552849855 941788009 /nfs/dbraw/zinc/78/80/09/941788009.db2.gz BZNFINHIGZHACB-JOCHJYFZSA-N 0 3 420.582 4.164 20 0 HIADHN COc1ccc(C(=O)N(Cc2ccncc2)[C@@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000552849948 941788082 /nfs/dbraw/zinc/78/80/82/941788082.db2.gz GLVNDDGSXNQLNA-XMMPIXPASA-N 0 3 415.537 4.397 20 0 HIADHN CC(C)CCOc1ccc([C@H](C)NCc2ccc(S(=O)(=O)N(C)C)cc2)cc1 ZINC000552880185 941797241 /nfs/dbraw/zinc/79/72/41/941797241.db2.gz VHIREBPHBLBWNL-SFHVURJKSA-N 0 3 404.576 4.213 20 0 HIADHN O=C(Nc1nnc(SCc2ccccc2)s1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000552916622 941802496 /nfs/dbraw/zinc/80/24/96/941802496.db2.gz YIXLCDWUHAQVOD-SFHVURJKSA-N 0 3 410.568 4.291 20 0 HIADHN CN(C)Cc1cccc(C(=O)Nc2nnc(-c3cccc(OC(F)(F)F)c3)s2)c1 ZINC000552973045 941810503 /nfs/dbraw/zinc/81/05/03/941810503.db2.gz DRXHMLOAKXXUDH-UHFFFAOYSA-N 0 3 422.432 4.418 20 0 HIADHN Cc1cc(NC(=O)CN[C@H](C[C@H]2CCOC2)c2ccccc2)n(-c2ccccc2F)n1 ZINC000553063479 941826956 /nfs/dbraw/zinc/82/69/56/941826956.db2.gz XSILMEFAZKOKGY-WIYYLYMNSA-N 0 3 422.504 4.016 20 0 HIADHN O=C(CCC1CCOCC1)N(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000553197633 941847957 /nfs/dbraw/zinc/84/79/57/941847957.db2.gz VTEBNLYXKRRAMF-RUZDIDTESA-N 0 3 421.585 4.282 20 0 HIADHN Cc1c2ccccc2oc1[C@H](NCc1ccc(S(=O)(=O)N(C)C)cc1)C(C)C ZINC000553261626 941858211 /nfs/dbraw/zinc/85/82/11/941858211.db2.gz LIZFJRNROPNDCW-OAQYLSRUSA-N 0 3 400.544 4.478 20 0 HIADHN CCN(CC(=O)N(C)[C@H](C)c1ccc(F)c(F)c1)[C@H](C)Cc1ccc(OC)cc1 ZINC000553317484 941866347 /nfs/dbraw/zinc/86/63/47/941866347.db2.gz WCBUXJAKMGWNQM-IAGOWNOFSA-N 0 3 404.501 4.446 20 0 HIADHN Cc1cccc([C@@H](C)NCC(=O)Nc2nc(CN3CCC(C)CC3)cs2)c1C ZINC000553338083 941869277 /nfs/dbraw/zinc/86/92/77/941869277.db2.gz QICZTLJBGITALR-GOSISDBHSA-N 0 3 400.592 4.281 20 0 HIADHN CCOC1CC2(C1)CCN(C(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1)C2 ZINC000553363416 941872973 /nfs/dbraw/zinc/87/29/73/941872973.db2.gz ICCNUZVMWVDWEN-LVIWNVNYSA-N 0 3 405.608 4.122 20 0 HIADHN Cc1ccc(-n2ncc(C(=O)N3CCN(C4CCC4)C[C@@H](C)C3)c2C(F)(F)F)cc1 ZINC000553528584 941903930 /nfs/dbraw/zinc/90/39/30/941903930.db2.gz RWJZMBOBNLVBEN-MRXNPFEDSA-N 0 3 420.479 4.146 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)Cc2ccccc2OC(F)F)N(C)C)cc1 ZINC000553670815 941941247 /nfs/dbraw/zinc/94/12/47/941941247.db2.gz GLAXQTKAAPRPRA-LJQANCHMSA-N 0 3 406.473 4.037 20 0 HIADHN CC(C)Cc1ccc([C@H](CNC(=O)CCc2nc(C3CCCC3)no2)N(C)C)cc1 ZINC000553742266 941956644 /nfs/dbraw/zinc/95/66/44/941956644.db2.gz KYRHNCVFJMFBCQ-NRFANRHFSA-N 0 3 412.578 4.277 20 0 HIADHN CC(C)(NC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1)c1cc(C(F)(F)F)on1 ZINC000553755782 941960527 /nfs/dbraw/zinc/96/05/27/941960527.db2.gz TUXWNFXDRYAKHZ-CQSZACIVSA-N 0 3 413.415 4.096 20 0 HIADHN CCOc1ccc(-c2nc(CC)c(C(=O)N3CC[C@H](N4CCCC4)[C@@H]3C)s2)cc1 ZINC000553775499 941965578 /nfs/dbraw/zinc/96/55/78/941965578.db2.gz XCRLGBWCOAEBQN-JXFKEZNVSA-N 0 3 413.587 4.470 20 0 HIADHN Cc1cc(C(=O)N2CCN([C@@H]3C[C@@H]3C)C[C@@H](C)C2)nn1-c1ccc(Cl)c(Cl)c1 ZINC000553782637 941967968 /nfs/dbraw/zinc/96/79/68/941967968.db2.gz CRFKZRIZZBJEFL-LAPQFRIASA-N 0 3 421.372 4.290 20 0 HIADHN Cc1c2cc(Br)ccc2oc1C(=O)N1CCN(C2CCC2)C[C@H](C)C1 ZINC000553856414 941984009 /nfs/dbraw/zinc/98/40/09/941984009.db2.gz PGCKKQLPJPOQQU-ZDUSSCGKSA-N 0 3 405.336 4.450 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)NCc1c(C)nn(CC)c1C)c1ccc(Cl)cc1 ZINC000553872214 941988720 /nfs/dbraw/zinc/98/87/20/941988720.db2.gz USMLLGNTWCXDNY-FQEVSTJZSA-N 0 3 405.974 4.056 20 0 HIADHN Cc1cc(C)c(CN2CCC[C@@H](C(=O)N3CCCC3)C2)c(OCc2ccccc2)n1 ZINC000553884691 941990657 /nfs/dbraw/zinc/99/06/57/941990657.db2.gz MENSBMPBYJUBLT-JOCHJYFZSA-N 0 3 407.558 4.112 20 0 HIADHN C[C@H](C(=O)Nc1ccc(Br)cc1Br)N(C)CC1CCC1 ZINC000554074802 942030728 /nfs/dbraw/zinc/03/07/28/942030728.db2.gz GVYRAFJQUVCADT-SNVBAGLBSA-N 0 3 404.146 4.271 20 0 HIADHN CC(C)n1c2ccc(C(=O)N3CCN([C@H]4C[C@@H]4C)C[C@H](C)C3)cc2nc1C(F)(F)F ZINC000554113201 942039622 /nfs/dbraw/zinc/03/96/22/942039622.db2.gz KDCXOOOSMWKTOO-DOXZYTNZSA-N 0 3 422.495 4.438 20 0 HIADHN C[C@H](NC[C@H](CO)c1cccnc1)c1ccc(Br)cc1Br ZINC000554116827 942040907 /nfs/dbraw/zinc/04/09/07/942040907.db2.gz XEGHZFOHZAAJSZ-WCQYABFASA-N 0 3 414.141 4.033 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)Nc2cccc(-c3nccn3C)c2)N(C)C)cc1 ZINC000554181668 942059969 /nfs/dbraw/zinc/05/99/69/942059969.db2.gz BULXPBIDJLXCMI-QFIPXVFZSA-N 0 3 421.545 4.299 20 0 HIADHN COc1cc([C@H](C)N[C@@H](C)c2cccc(NS(C)(=O)=O)c2)ccc1OC(C)C ZINC000554209462 942067932 /nfs/dbraw/zinc/06/79/32/942067932.db2.gz HKQRMKOKOZCLHK-HOTGVXAUSA-N 0 3 406.548 4.266 20 0 HIADHN Ic1cccc(OCCCN2CCC[C@@H]2c2cccnc2)c1 ZINC000554243932 942076049 /nfs/dbraw/zinc/07/60/49/942076049.db2.gz OSFAECGZPZQXJL-GOSISDBHSA-N 0 3 408.283 4.292 20 0 HIADHN C[C@H](N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1)c1cccc(-n2ccnn2)c1 ZINC000554376578 942118805 /nfs/dbraw/zinc/11/88/05/942118805.db2.gz STIOCPBUCMLEOC-YADARESESA-N 0 3 411.509 4.168 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)Nc2ccc(N3CCCC3=O)cc2)N(C)C)cc1 ZINC000554385828 942121373 /nfs/dbraw/zinc/12/13/73/942121373.db2.gz LGHSWHAEFHJQIJ-JOCHJYFZSA-N 0 3 424.545 4.025 20 0 HIADHN OC[C@@H](CN[C@H](c1cccc(F)c1)c1cccc(Br)c1)c1cccnc1 ZINC000554404491 942129289 /nfs/dbraw/zinc/12/92/89/942129289.db2.gz ZZBSIXRSAOYQQW-NQIIRXRSSA-N 0 3 415.306 4.438 20 0 HIADHN Cc1cc(Oc2ncccn2)ccc1NC(=O)N[C@H](CN(C)C)c1ccc(F)cc1 ZINC000554415516 942133667 /nfs/dbraw/zinc/13/36/67/942133667.db2.gz PPNQWURLDFAREU-HXUWFJFHSA-N 0 3 409.465 4.141 20 0 HIADHN Cc1nc(-c2ccc(CNC(=O)N[C@H](CN(C)C)c3ccc(F)cc3)cc2)cs1 ZINC000554439777 942143474 /nfs/dbraw/zinc/14/34/74/942143474.db2.gz FWUWTGHKYUXXBL-HXUWFJFHSA-N 0 3 412.534 4.360 20 0 HIADHN CCOC(=O)Cn1ccc2cc(NC(=O)N[C@@H](C)[C@@H](c3ccccc3)N(C)C)ccc21 ZINC000554440685 942143490 /nfs/dbraw/zinc/14/34/90/942143490.db2.gz CEBDGBLIDVLQIQ-SBUREZEXSA-N 0 3 422.529 4.017 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)Nc2cnn(-c3ccccc3)c2)N(C)C)cc1 ZINC000554461514 942151580 /nfs/dbraw/zinc/15/15/80/942151580.db2.gz CJDCMTMDSPVCSI-JOCHJYFZSA-N 0 3 407.518 4.084 20 0 HIADHN O=c1[nH]c2ccccc2n1CCCN[C@@H]1CCOc2c(Br)cccc21 ZINC000554553628 942166577 /nfs/dbraw/zinc/16/65/77/942166577.db2.gz CXVAPRRKYCWILF-OAHLLOKOSA-N 0 3 402.292 4.008 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)c1nn(-c2ccccc2C)c2c1CCC2)c1ccco1 ZINC000554632018 942181155 /nfs/dbraw/zinc/18/11/55/942181155.db2.gz JNGNLOONEZHMDI-HKUYNNGSSA-N 0 3 406.530 4.122 20 0 HIADHN Cc1nc(-c2ccc(NC[C@@H](c3ccc(OC(C)C)cc3)[NH+](C)C)nc2)[n-]c(=O)c1C ZINC000554685842 942198601 /nfs/dbraw/zinc/19/86/01/942198601.db2.gz SKZVGMWWKRXNAG-NRFANRHFSA-N 0 3 421.545 4.363 20 0 HIADHN Cc1nc(-c2ccc(NC[C@H](c3ccc(OC(C)C)cc3)[NH+](C)C)nc2)[n-]c(=O)c1C ZINC000554685843 942198899 /nfs/dbraw/zinc/19/88/99/942198899.db2.gz SKZVGMWWKRXNAG-OAQYLSRUSA-N 0 3 421.545 4.363 20 0 HIADHN COC[C@@H](NC(=O)N[C@@H](CN1CCCC1)c1ccccc1)c1cccc(Cl)c1 ZINC000554696322 942202772 /nfs/dbraw/zinc/20/27/72/942202772.db2.gz XGPPWQUMLUFTTC-LEWJYISDSA-N 0 3 401.938 4.164 20 0 HIADHN CCn1cccc(CN[C@@H]2CCCc3c4cc(Br)ccc4[nH]c32)c1=O ZINC000554743169 942218592 /nfs/dbraw/zinc/21/85/92/942218592.db2.gz YGRFDLYKDLKYAM-GOSISDBHSA-N 0 3 400.320 4.279 20 0 HIADHN COc1cc(Cl)c(NC(=O)N2CCC(CN3C[C@@H](C)O[C@H](C)C3)CC2)cc1C ZINC000554763233 942227884 /nfs/dbraw/zinc/22/78/84/942227884.db2.gz OUIXDSJQGXEFOR-HZPDHXFCSA-N 0 3 409.958 4.010 20 0 HIADHN COCCN1CC[C@@H](NC(=O)Nc2ccc(Oc3ccccc3)cc2C(F)(F)F)C1 ZINC000554785223 942235974 /nfs/dbraw/zinc/23/59/74/942235974.db2.gz JHRMPYSZKZSVES-OAHLLOKOSA-N 0 3 423.435 4.340 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccnc2)C1)N1CC[C@](F)(c2cccc(Cl)c2)C1 ZINC000554811350 942255417 /nfs/dbraw/zinc/25/54/17/942255417.db2.gz BCQXNSXZRFUQRW-XMSQKQJNSA-N 0 3 401.913 4.044 20 0 HIADHN O=C(CC(F)(F)F)Nc1ccc(NC(=O)c2ccc(Nc3ccncc3)cc2)cc1 ZINC000554823100 942263263 /nfs/dbraw/zinc/26/32/63/942263263.db2.gz DYZGRINAOZHXFI-UHFFFAOYSA-N 0 3 414.387 4.390 20 0 HIADHN c1ccc(CN2C[C@@H](c3ccccc3)[C@H](NCc3nc(C4CCCC4)no3)C2)cc1 ZINC000554843023 942279605 /nfs/dbraw/zinc/27/96/05/942279605.db2.gz JBWNVUSXDWRENP-XZOQPEGZSA-N 0 3 402.542 4.485 20 0 HIADHN CSc1ccc(NC(=O)CN[C@H]2CCN(C)[C@@H]2c2ccc(Cl)c(F)c2)cc1 ZINC000554954272 942332078 /nfs/dbraw/zinc/33/20/78/942332078.db2.gz MLVUJESELJDHMC-AZUAARDMSA-N 0 3 407.942 4.175 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3ccc(-c4ccccn4)cc3)CC2)C[C@H](C)O1 ZINC000555013595 942356622 /nfs/dbraw/zinc/35/66/22/942356622.db2.gz UENNTSWOYPXXEK-KDURUIRLSA-N 0 3 408.546 4.102 20 0 HIADHN C[C@@H](Cc1cnc2ccccc2n1)C(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1 ZINC000555031757 942363492 /nfs/dbraw/zinc/36/34/92/942363492.db2.gz GREMDDIBEQCRRZ-AVRDEDQJSA-N 0 3 422.598 4.459 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)Nc1cccc(Br)c1Cl ZINC000555031819 942363796 /nfs/dbraw/zinc/36/37/96/942363796.db2.gz IKSNAOYPLVXWCL-UHFFFAOYSA-N 0 3 411.731 4.093 20 0 HIADHN Cc1ccc(-c2cncc(F)c2)cc1NC(=O)NC1CCN(CCOC(C)C)CC1 ZINC000555040287 942367377 /nfs/dbraw/zinc/36/73/77/942367377.db2.gz DSMSIJBFDFQCPD-UHFFFAOYSA-N 0 3 414.525 4.207 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)NCc1cc(-c2ccccc2)on1 ZINC000555065046 942374916 /nfs/dbraw/zinc/37/49/16/942374916.db2.gz CQBBDCLCPXGCKL-LJQANCHMSA-N 0 3 404.514 4.148 20 0 HIADHN CCCC(C)(C)N(CC(=O)N1CCC(C(=O)N(C)C(C)C)CC1)Cc1cccs1 ZINC000555075881 942378081 /nfs/dbraw/zinc/37/80/81/942378081.db2.gz CJECRKLQXWDOCC-UHFFFAOYSA-N 0 3 421.651 4.234 20 0 HIADHN CCN1CC[C@H](NCC(=O)Nc2ccc(C(C)=O)cc2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000555131657 942396623 /nfs/dbraw/zinc/39/66/23/942396623.db2.gz OSNLLCOBFSMTEH-UNMCSNQZSA-N 0 3 417.912 4.045 20 0 HIADHN COc1cccc([C@@H]2[C@H](N[C@H](C)C(=O)Nc3cccc(C)c3C)CCN2C2CC2)c1 ZINC000555133574 942397072 /nfs/dbraw/zinc/39/70/72/942397072.db2.gz UNSVVMBOORAIAS-DQMJNTIXSA-N 0 3 407.558 4.207 20 0 HIADHN CCN1CC[C@H](N[C@H](C)C(=O)Nc2cccc(C)c2)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000555132486 942397721 /nfs/dbraw/zinc/39/77/21/942397721.db2.gz IZVIKTAMMYPNPH-RFVSGWPVSA-N 0 3 405.464 4.164 20 0 HIADHN C[C@H](NC(=O)N[C@H](CN(C)C)c1ccc(Cl)cc1)c1nc(C(F)(F)F)cs1 ZINC000555206531 942431881 /nfs/dbraw/zinc/43/18/81/942431881.db2.gz ISSGMICMRKMOAX-GXFFZTMASA-N 0 3 420.888 4.478 20 0 HIADHN O=C(NCCCOC(F)F)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000555215764 942433637 /nfs/dbraw/zinc/43/36/37/942433637.db2.gz LZJICPTVWZJAMC-UHFFFAOYSA-N 0 3 424.319 4.230 20 0 HIADHN CN(C)C[C@@H](NC(=O)CCCc1nnc(-c2ccccc2)o1)c1ccc(Cl)cc1 ZINC000555231028 942438791 /nfs/dbraw/zinc/43/87/91/942438791.db2.gz SQRPWVYVHODKKU-LJQANCHMSA-N 0 3 412.921 4.132 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@H](N[C@@H](CC(C)C)C(=O)Nc2nccs2)c2ccccc21 ZINC000555236192 942440505 /nfs/dbraw/zinc/44/05/05/942440505.db2.gz RVJRIEWHOMORRP-QYZOEREBSA-N 0 3 415.559 4.268 20 0 HIADHN Cc1cccc(C)c1CS(=O)(=O)N(C)[C@@H]1CCN(Cc2ccccc2)[C@@H](C)C1 ZINC000555317089 942474093 /nfs/dbraw/zinc/47/40/93/942474093.db2.gz MXLQRSWPOFVWSR-RBBKRZOGSA-N 0 3 400.588 4.118 20 0 HIADHN COc1cccc(OC)c1OC1CCN(Cc2ccc(C)cc2-c2ccnn2C)CC1 ZINC000555335752 942481802 /nfs/dbraw/zinc/48/18/02/942481802.db2.gz ZXZXZCPDMOCHRL-UHFFFAOYSA-N 0 3 421.541 4.456 20 0 HIADHN COCCc1ccc(OC[C@H](O)CN2CC=C(c3cccc(Cl)c3)CC2)cc1 ZINC000555462366 942564871 /nfs/dbraw/zinc/56/48/71/942564871.db2.gz NUJKMXJTIVEZFB-JOCHJYFZSA-N 0 3 401.934 4.058 20 0 HIADHN C[C@H](c1ccc(F)cc1)N1CC[C@H](N[C@H]2CCN(C)[C@H]2c2ccc(Cl)cc2)C1=O ZINC000555527837 942628627 /nfs/dbraw/zinc/62/86/27/942628627.db2.gz TVFJJBOFUACHAD-VUVCYMEASA-N 0 3 415.940 4.176 20 0 HIADHN COc1ccccc1NC(=O)c1ccc(NC(=O)[C@H](C)N2CC[C@@H](CC3CC3)C2)cc1 ZINC000555704395 942705978 /nfs/dbraw/zinc/70/59/78/942705978.db2.gz BAEFPHIMDKNARK-HKUYNNGSSA-N 0 3 421.541 4.397 20 0 HIADHN Cc1cc(C(=O)NC2CCN(CCOC(C)C)CC2)cc(Cl)c1Br ZINC000555864208 942757124 /nfs/dbraw/zinc/75/71/24/942757124.db2.gz YXJYKNDJXUHJMV-UHFFFAOYSA-N 0 3 417.775 4.030 20 0 HIADHN Cc1nc(NC(=O)CCCN2CCN(c3ccccc3)CC2)sc1C(F)(F)F ZINC000555929341 942774157 /nfs/dbraw/zinc/77/41/57/942774157.db2.gz REGFRUNIKGWYHS-UHFFFAOYSA-N 0 3 412.481 4.011 20 0 HIADHN FC(F)(F)c1cccc(CN2CCC(N[C@@H](c3cccs3)c3nc[nH]n3)CC2)c1 ZINC000556059642 942798979 /nfs/dbraw/zinc/79/89/79/942798979.db2.gz URBJRGYJCYEQDI-SFHVURJKSA-N 0 3 421.492 4.229 20 0 HIADHN FC(F)(F)c1cccc(CN2CCC(N[C@H](c3cccs3)c3nc[nH]n3)CC2)c1 ZINC000556059641 942799232 /nfs/dbraw/zinc/79/92/32/942799232.db2.gz URBJRGYJCYEQDI-GOSISDBHSA-N 0 3 421.492 4.229 20 0 HIADHN CN1CC[C@H](CN[C@H](c2cccs2)c2nc[nH]n2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000556118947 942807350 /nfs/dbraw/zinc/80/73/50/942807350.db2.gz NRDMIHCFUCFRAJ-FSPWUOQZSA-N 0 3 405.930 4.031 20 0 HIADHN COc1cccc(C(=O)CCCC(=O)NC2CCN([C@@H](C)c3ccccc3)CC2)c1 ZINC000556203110 942818259 /nfs/dbraw/zinc/81/82/59/942818259.db2.gz ZZMMKUFRQHLWOJ-IBGZPJMESA-N 0 3 408.542 4.390 20 0 HIADHN COc1ccc2c(c1F)CC[C@@H]2N[C@@H]1CCCN([C@@H](C)c2ccccc2F)C1=O ZINC000556225711 942821336 /nfs/dbraw/zinc/82/13/36/942821336.db2.gz ZIVQFCXINMPALN-PNHOKKKMSA-N 0 3 400.469 4.303 20 0 HIADHN CN(C(=O)c1ccc(NCc2cccc(Br)c2)cc1)[C@@H]1CCCN(C)C1 ZINC000556336538 942844067 /nfs/dbraw/zinc/84/40/67/942844067.db2.gz NPMSNMYCXBHIFI-HXUWFJFHSA-N 0 3 416.363 4.227 20 0 HIADHN CN(C(=O)c1ccc(NCc2cnc(-c3ccco3)s2)cc1)[C@@H]1CCCN(C)C1 ZINC000556337014 942844296 /nfs/dbraw/zinc/84/42/96/942844296.db2.gz REOYBAKCADYICY-GOSISDBHSA-N 0 3 410.543 4.181 20 0 HIADHN COc1ccc(COC[C@@H](O)CNCc2cnc(-c3ccc(Cl)cc3)s2)cc1 ZINC000556385037 942854106 /nfs/dbraw/zinc/85/41/06/942854106.db2.gz DBTSSTFDGPCRBM-SFHVURJKSA-N 0 3 418.946 4.139 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)[C@H]1CCCc2cccnc21 ZINC000556398116 942856587 /nfs/dbraw/zinc/85/65/87/942856587.db2.gz UQLIVGYBIYMAII-IBGZPJMESA-N 0 3 405.464 4.111 20 0 HIADHN CNC(=O)c1cccc(CN[C@@H](c2cccc(C(F)(F)F)c2)C2CCOCC2)c1 ZINC000556515552 942889779 /nfs/dbraw/zinc/88/97/79/942889779.db2.gz QFWSIHGJBPGIOL-HXUWFJFHSA-N 0 3 406.448 4.323 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@@H](C)N[C@H](C)c2cnc(OC)c(Cl)c2)CC1 ZINC000556582649 942906234 /nfs/dbraw/zinc/90/62/34/942906234.db2.gz CDAVZKPUMBMOSM-HZPDHXFCSA-N 0 3 420.960 4.436 20 0 HIADHN CC(C)Oc1ccc([C@@H](C)NCc2ccc(C(=O)N3CCOCC3)cc2)cc1Cl ZINC000556584138 942906468 /nfs/dbraw/zinc/90/64/68/942906468.db2.gz QKZAKBFAJYLCTQ-QGZVFWFLSA-N 0 3 416.949 4.450 20 0 HIADHN C[C@@]1(C2CC2)NC(=O)N(c2cccc(CN[C@@H]3CCc4cc(Cl)ccc43)c2)C1=O ZINC000556609760 942914436 /nfs/dbraw/zinc/91/44/36/942914436.db2.gz ATLGBQCCFRZTIN-OFNKIYASSA-N 0 3 409.917 4.342 20 0 HIADHN OC[C@@H](CN[C@@H](c1ncc[nH]1)C1CCCCC1)Cc1cccc(Br)c1 ZINC000556879305 942949059 /nfs/dbraw/zinc/94/90/59/942949059.db2.gz RQTBTJORULYKKA-VQIMIIECSA-N 0 3 406.368 4.234 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)[C@H](C)Cc2cnc3ccccc3n2)N(C)C)cc1 ZINC000556989400 942988588 /nfs/dbraw/zinc/98/85/88/942988588.db2.gz CRBAYRKIYFIARZ-HOYKHHGWSA-N 0 3 420.557 4.015 20 0 HIADHN Cn1c(C(=O)Nc2cccc(CN3CC[C@@H](O)C3)c2)cc2cc(C(F)(F)F)ccc21 ZINC000557023120 942996471 /nfs/dbraw/zinc/99/64/71/942996471.db2.gz MWNYUTMZCATRBK-GOSISDBHSA-N 0 3 417.431 4.016 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@@H](O)C2)c1)C1c2ccccc2Oc2ccccc21 ZINC000557023504 942997315 /nfs/dbraw/zinc/99/73/15/942997315.db2.gz KFXQUWYHPNAIIA-LJQANCHMSA-N 0 3 400.478 4.130 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@@H](O)C2)c1)c1csc(-c2ccc(Cl)s2)n1 ZINC000557024161 942997342 /nfs/dbraw/zinc/99/73/42/942997342.db2.gz WSBXMGDZFFQOGA-CQSZACIVSA-N 0 3 419.959 4.344 20 0 HIADHN O[C@@H](CNCc1ccc(Oc2cccnc2)c(F)c1)COc1ccccc1Cl ZINC000557218158 943054442 /nfs/dbraw/zinc/05/44/42/943054442.db2.gz YBZBBQNHOULTRV-INIZCTEOSA-N 0 3 402.853 4.196 20 0 HIADHN COc1ccc2c(c1)OC[C@@H](N[C@@H](C)c1ccc(S(=O)(=O)C3CCCC3)cc1)C2 ZINC000557266445 943064092 /nfs/dbraw/zinc/06/40/92/943064092.db2.gz RCGNIGAHQGSPKC-LPHOPBHVSA-N 0 3 415.555 4.066 20 0 HIADHN O=C(Cc1ccc(O)cc1)N(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000557449347 943134586 /nfs/dbraw/zinc/13/45/86/943134586.db2.gz VMBZJEKMUPXRBE-XMMPIXPASA-N 0 3 415.537 4.023 20 0 HIADHN CCC(CC)[C@@H](NCC(=O)Nc1cc(C)nn1-c1nc(C)cc(C)n1)c1ccccc1 ZINC000557501528 943171588 /nfs/dbraw/zinc/17/15/88/943171588.db2.gz LRJJQTQJKFAATM-HSZRJFAPSA-N 0 3 420.561 4.293 20 0 HIADHN COC(=O)c1ccc(CNC(=O)[C@@H](C)N[C@H](c2ccc(Cl)cc2)C(C)C)cc1 ZINC000557655100 943249511 /nfs/dbraw/zinc/24/95/11/943249511.db2.gz XAXDWVMUYXLIRK-QRWLVFNGSA-N 0 3 402.922 4.118 20 0 HIADHN Cc1nc(N[C@@H](C)c2ccc3n[nH]cc3c2)cc(N[C@@H](C)c2ccc3n[nH]cc3c2)n1 ZINC000557763036 943283423 /nfs/dbraw/zinc/28/34/23/943283423.db2.gz PATOOIKYIVZTMA-KBPBESRZSA-N 0 3 412.501 4.884 20 0 HIADHN CCN(Cc1ccc(OC)cc1OC)C(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000557801115 943295559 /nfs/dbraw/zinc/29/55/59/943295559.db2.gz BCUFYSMCOSCAHW-FQEVSTJZSA-N 0 3 414.521 4.104 20 0 HIADHN COC(=O)[C@@H](C)Oc1ccc(CNC2(c3ccc(Cl)cc3)CCOCC2)cc1 ZINC000557800543 943295902 /nfs/dbraw/zinc/29/59/02/943295902.db2.gz RBSZSFOTSMXODP-MRXNPFEDSA-N 0 3 403.906 4.076 20 0 HIADHN Cc1nn(-c2ccccc2)c2sc(C(=O)N3CCN(C4CCC4)C[C@H](C)C3)cc12 ZINC000557837071 943308879 /nfs/dbraw/zinc/30/88/79/943308879.db2.gz MMIMHHCEWJHGOB-INIZCTEOSA-N 0 3 408.571 4.342 20 0 HIADHN CC(C)C[C@@H]1CN(CCCc2ccccc2)CCN1C(=O)c1cc(=O)[nH]c(C2CC2)c1 ZINC000557848333 943311605 /nfs/dbraw/zinc/31/16/05/943311605.db2.gz CKHLLSQJWBKEDF-HSZRJFAPSA-N 0 3 421.585 4.470 20 0 HIADHN C[C@@H]1[C@H](NC(=O)N2CCC(c3ncccc3Cl)CC2)CCN1Cc1ccccc1 ZINC000557879950 943318664 /nfs/dbraw/zinc/31/86/64/943318664.db2.gz CRGCHKOCBGUDDM-DYESRHJHSA-N 0 3 412.965 4.287 20 0 HIADHN Cc1nc2c(cnn2C(C)C)cc1C(=O)NC[C@@H](c1ccc(OC(C)C)cc1)N(C)C ZINC000557933412 943332570 /nfs/dbraw/zinc/33/25/70/943332570.db2.gz YXHFRWQUUUWHIZ-QFIPXVFZSA-N 0 3 423.561 4.141 20 0 HIADHN COC1(CNC(=O)[C@H]2CCCN(Cc3cccnc3)C2)CCC(c2ccccc2)CC1 ZINC000557961522 943340559 /nfs/dbraw/zinc/34/05/59/943340559.db2.gz RMZCDBPWNLQANW-QWJQGLKASA-N 0 3 421.585 4.153 20 0 HIADHN COc1cc(C(=O)N2CCN([C@@H]3C[C@H]3C)C[C@@H](C)C2)cc(Cl)c1OCC(C)C ZINC000558026431 943359864 /nfs/dbraw/zinc/35/98/64/943359864.db2.gz RCJGQEUFTDNMES-GPMSIDNRSA-N 0 3 408.970 4.186 20 0 HIADHN CSc1cccc(F)c1CNC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000558029988 943361426 /nfs/dbraw/zinc/36/14/26/943361426.db2.gz PPKXMCXLLJXBFT-UHFFFAOYSA-N 0 3 419.488 4.152 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)Nc1ccc(-c2noc(C(F)F)n2)cc1 ZINC000558190077 943423725 /nfs/dbraw/zinc/42/37/25/943423725.db2.gz QQJILPQFMFGCLI-CQSZACIVSA-N 0 3 415.444 4.316 20 0 HIADHN CC(C)n1cnnc1-c1ccccc1NC(=O)N[C@@H]1CCN(Cc2ccccc2)[C@@H]1C ZINC000558199449 943429026 /nfs/dbraw/zinc/42/90/26/943429026.db2.gz CXIXUSNDXJEXGE-WIYYLYMNSA-N 0 3 418.545 4.311 20 0 HIADHN COc1cc([C@H](C)NCC2(c3cc(Cl)ccc3OC)CCOCC2)c(F)cn1 ZINC000558221349 943440573 /nfs/dbraw/zinc/44/05/73/943440573.db2.gz GGFLEPVPSOVWNE-AWEZNQCLSA-N 0 3 408.901 4.290 20 0 HIADHN C[C@@H](NC(=O)Nc1cc2c(cc1Cl)OCCCO2)[C@H](c1ccccc1)N(C)C ZINC000558244031 943455156 /nfs/dbraw/zinc/45/51/56/943455156.db2.gz NNBNOQOZSMRPDB-JLTOFOAXSA-N 0 3 403.910 4.314 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)Nc1cc(NC(=O)C(C)C)ccc1C)c1ccco1 ZINC000558310892 943498634 /nfs/dbraw/zinc/49/86/34/943498634.db2.gz GSCZVWHTQZIJOW-APWZRJJASA-N 0 3 400.523 4.433 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)Nc1ccc(C(=O)N[C@@H](C)CC)cc1)c1ccco1 ZINC000558332716 943511229 /nfs/dbraw/zinc/51/12/29/943511229.db2.gz VCJQFOODMZCJBK-GJYPPUQNSA-N 0 3 400.523 4.059 20 0 HIADHN C[C@@H](NC(=O)Nc1ccccc1CC(=O)OC(C)(C)C)[C@H](c1ccccc1)N(C)C ZINC000558380113 943535936 /nfs/dbraw/zinc/53/59/36/943535936.db2.gz HOZZPIACKLJEHF-VGOFRKELSA-N 0 3 411.546 4.384 20 0 HIADHN C[C@@H](NC(=O)Nc1ccccc1CC(=O)OC(C)(C)C)[C@@H](c1ccccc1)N(C)C ZINC000558380116 943536372 /nfs/dbraw/zinc/53/63/72/943536372.db2.gz HOZZPIACKLJEHF-VGSWGCGISA-N 0 3 411.546 4.384 20 0 HIADHN COc1nc2ccccc2cc1CN1CCC[C@H](c2nc(C(F)(F)F)cn2C)C1 ZINC000558407521 943551767 /nfs/dbraw/zinc/55/17/67/943551767.db2.gz PBLGGZLBPMTPSW-HNNXBMFYSA-N 0 3 404.436 4.375 20 0 HIADHN C[C@H](N[C@@H]1CCN(C)[C@@H]1c1ccc(F)c(F)c1)C(=O)Nc1cc(Cl)ccc1F ZINC000558475917 943569288 /nfs/dbraw/zinc/56/92/88/943569288.db2.gz MRPHQJRHLVWELT-OWOPXTPDSA-N 0 3 411.855 4.119 20 0 HIADHN C[C@H](N[C@H]1c2ccccc2CC12CCOCC2)C(=O)N1c2ccccc2CC[C@H]1C ZINC000558483921 943571981 /nfs/dbraw/zinc/57/19/81/943571981.db2.gz MHSGLBAFNAWRBD-IMWIBFENSA-N 0 3 404.554 4.427 20 0 HIADHN COc1ccc([C@H](Cc2ccccc2)NCC(=O)N2CCC[C@H](C(F)(F)F)C2)cc1 ZINC000558487497 943572676 /nfs/dbraw/zinc/57/26/76/943572676.db2.gz BFYZIPLPYYEYMF-FPOVZHCZSA-N 0 3 420.475 4.370 20 0 HIADHN NS(=O)(=O)c1ccc2c(c1)[C@H](N[C@@H](Cc1ccccc1)c1cccs1)CCC2 ZINC000558498144 943576437 /nfs/dbraw/zinc/57/64/37/943576437.db2.gz PWIRLHHLYKOODW-RTWAWAEBSA-N 0 3 412.580 4.347 20 0 HIADHN NS(=O)(=O)c1ccc2c(c1)[C@@H](N[C@@H](Cc1ccccc1)c1cccs1)CCC2 ZINC000558498145 943576530 /nfs/dbraw/zinc/57/65/30/943576530.db2.gz PWIRLHHLYKOODW-SFTDATJTSA-N 0 3 412.580 4.347 20 0 HIADHN C[C@H]1CC[C@H](CCC(=O)N(Cc2ccccc2Br)C2CCN(C)CC2)O1 ZINC000558610455 943616883 /nfs/dbraw/zinc/61/68/83/943616883.db2.gz VFWDWYRIDRDYFG-QFBILLFUSA-N 0 3 423.395 4.220 20 0 HIADHN CCCN(C(=O)Cc1cc2ccccc2[nH]c1=O)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000558639254 943623260 /nfs/dbraw/zinc/62/32/60/943623260.db2.gz IPNNJYJKHTYJRY-HSZRJFAPSA-N 0 3 417.553 4.386 20 0 HIADHN O=C(CCN[C@@H]1CCCOc2ccc(F)cc21)Nc1ccc(Br)cc1 ZINC000558652452 943624435 /nfs/dbraw/zinc/62/44/35/943624435.db2.gz SNUQJUPZTZHZFK-QGZVFWFLSA-N 0 3 407.283 4.420 20 0 HIADHN COc1cc(Br)c(CN2CCCC[C@@H]2[C@H]2CCCC[C@@H]2O)cc1OC ZINC000558658311 943625147 /nfs/dbraw/zinc/62/51/47/943625147.db2.gz CFBKMXWLFIDFHV-NXHRZFHOSA-N 0 3 412.368 4.372 20 0 HIADHN COc1ccc(Br)cc1CNCc1ccc(C)cc1-c1cnn(C)c1 ZINC000558779531 943659419 /nfs/dbraw/zinc/65/94/19/943659419.db2.gz RMALQOZHDTXLNR-UHFFFAOYSA-N 0 3 400.320 4.456 20 0 HIADHN CO[C@H](C[N@H+](C)Cc1cccc([N-]S(=O)(=O)c2ccccc2)c1)c1ccccc1 ZINC000558833108 943684518 /nfs/dbraw/zinc/68/45/18/943684518.db2.gz XVSPHFQCBNQMJM-HSZRJFAPSA-N 0 3 410.539 4.307 20 0 HIADHN CO[C@H](C[N@@H+](C)Cc1cccc([N-]S(=O)(=O)c2ccccc2)c1)c1ccccc1 ZINC000558833108 943684523 /nfs/dbraw/zinc/68/45/23/943684523.db2.gz XVSPHFQCBNQMJM-HSZRJFAPSA-N 0 3 410.539 4.307 20 0 HIADHN CN(C)C[C@H](NC(=O)N[C@@H](c1ccccc1)[C@@H]1CCCO1)c1ccc(Cl)cc1 ZINC000558893692 943724775 /nfs/dbraw/zinc/72/47/75/943724775.db2.gz UBMIOIQBQKTFRW-ACRUOGEOSA-N 0 3 401.938 4.162 20 0 HIADHN CN(C)C[C@H](NC(=O)N[C@H](c1ccccc1)[C@H]1CCCO1)c1ccc(Cl)cc1 ZINC000558893695 943726039 /nfs/dbraw/zinc/72/60/39/943726039.db2.gz UBMIOIQBQKTFRW-PWRODBHTSA-N 0 3 401.938 4.162 20 0 HIADHN CC(C)N1CC[C@@H](N[C@@H](C)C(=O)Nc2cccc(F)c2)[C@H]1c1ccc(F)c(F)c1 ZINC000558896296 943728255 /nfs/dbraw/zinc/72/82/55/943728255.db2.gz KVSVYJMSCWHAND-LVXYXVKQSA-N 0 3 405.464 4.245 20 0 HIADHN CCN1CC[C@H](NCC(=O)Nc2cc(C(C)(C)C)no2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000558895631 943728988 /nfs/dbraw/zinc/72/89/88/943728988.db2.gz KIYCIANMSJFIEF-OXJNMPFZSA-N 0 3 422.932 4.128 20 0 HIADHN CCc1cccc(C)c1NC(=O)CN[C@@H]1CCN(C2CC2)[C@@H]1c1cccc(OC)c1 ZINC000558902614 943737305 /nfs/dbraw/zinc/73/73/05/943737305.db2.gz SAWDISOOEJYHJM-RCZVLFRGSA-N 0 3 407.558 4.072 20 0 HIADHN Brc1ccc2c(c1)CCCC[C@H]2NCc1ccc(N2CCOCC2)nc1 ZINC000558921261 943747639 /nfs/dbraw/zinc/74/76/39/943747639.db2.gz XATFOFMUMIFFHF-HXUWFJFHSA-N 0 3 416.363 4.238 20 0 HIADHN Cc1cc(Br)ccc1NC(=O)CCNCC1=Cc2ccccc2OC1 ZINC000558931903 943753699 /nfs/dbraw/zinc/75/36/99/943753699.db2.gz QJUCLROBGIONKQ-UHFFFAOYSA-N 0 3 401.304 4.152 20 0 HIADHN CC(C)CC(=O)Nc1ccc(C(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)cc1F ZINC000558972350 943778149 /nfs/dbraw/zinc/77/81/49/943778149.db2.gz KAYSPYBPOAQPCJ-FQEVSTJZSA-N 0 3 419.928 4.496 20 0 HIADHN CN(C)C[C@H](NC(=O)CN(Cc1cccnc1)c1ccccc1)c1ccc(Cl)cc1 ZINC000558974268 943779906 /nfs/dbraw/zinc/77/99/06/943779906.db2.gz WWBSUZYVKDQYAM-QHCPKHFHSA-N 0 3 422.960 4.161 20 0 HIADHN C[C@@H](C(=O)NCCCCN1CCN(c2cccc(C(F)(F)F)c2)CC1)C(C)(F)F ZINC000559021405 943807418 /nfs/dbraw/zinc/80/74/18/943807418.db2.gz AXKITZLOXBYJSB-HNNXBMFYSA-N 0 3 421.454 4.015 20 0 HIADHN Cc1nc2ccccc2n1C1CCN([C@H]2CCN([C@@H](C)c3ccc(F)cc3)C2=O)CC1 ZINC000559185840 943865214 /nfs/dbraw/zinc/86/52/14/943865214.db2.gz HBHZBGACNVIJEZ-XDHUDOTRSA-N 0 3 420.532 4.483 20 0 HIADHN O=C(NCCN1CCCC1)c1ccc(NCc2cccc(-c3ccncc3)c2)cc1 ZINC000559229944 943881149 /nfs/dbraw/zinc/88/11/49/943881149.db2.gz UVBBNSHZISYEKN-UHFFFAOYSA-N 0 3 400.526 4.186 20 0 HIADHN COC(=O)c1cc2c(o1)c(OC)ccc2CNCc1ccc(OC(F)F)c(F)c1 ZINC000559332838 943897883 /nfs/dbraw/zinc/89/78/83/943897883.db2.gz FOLFKPDDUGRAJL-UHFFFAOYSA-N 0 3 409.360 4.258 20 0 HIADHN CCO[C@@H]1C[C@@H](NCc2cn(-c3ccccc3)nc2-c2ccc(C)o2)[C@H]1n1cccn1 ZINC000559360747 943910605 /nfs/dbraw/zinc/91/06/05/943910605.db2.gz QUPXKPYBDHJVFG-KIFXHHALSA-N 0 3 417.513 4.146 20 0 HIADHN COC(=O)CCC[C@@H]1CCC[C@@H](N[C@H](c2nc(-c3cccnc3)no2)C(C)C)C1 ZINC000559752328 944043190 /nfs/dbraw/zinc/04/31/90/944043190.db2.gz RLQGFTCQOFVREO-HQRMLTQVSA-N 0 3 400.523 4.320 20 0 HIADHN NS(=O)(=O)c1ccc2c(c1)CCC[C@@H]2N[C@@H](COc1ccccc1)c1ccccc1 ZINC000559788375 944050824 /nfs/dbraw/zinc/05/08/24/944050824.db2.gz GIRJMTFZYFJRKM-ZEQRLZLVSA-N 0 3 422.550 4.121 20 0 HIADHN CN1CC[C@@H](NCc2cn3cc(Cl)cc(Cl)c3n2)[C@@H]1c1ccc(F)c(F)c1 ZINC000559793635 944052210 /nfs/dbraw/zinc/05/22/10/944052210.db2.gz OITHOEDMLNTDAQ-MSOLQXFVSA-N 0 3 411.283 4.454 20 0 HIADHN Brc1cccc2[nH]cc(CC[NH2+][C@@H](c3cccs3)c3nnc[n-]3)c21 ZINC000559853706 944068324 /nfs/dbraw/zinc/06/83/24/944068324.db2.gz BOZXQUVXTODXJC-INIZCTEOSA-N 0 3 402.321 4.032 20 0 HIADHN CCO[C@@H]1C[C@H](N[C@H](C)c2ccc(OC[C@H]3CCCCO3)c(F)c2)[C@H]1n1cccn1 ZINC000559924022 944086462 /nfs/dbraw/zinc/08/64/62/944086462.db2.gz DSWBPAQPAKTGBM-HQBDODNFSA-N 0 3 417.525 4.039 20 0 HIADHN CN(C(=O)c1ccc(NCc2ccc(Br)cc2)cc1)[C@H]1CCCN(C)C1 ZINC000559998641 944120615 /nfs/dbraw/zinc/12/06/15/944120615.db2.gz AFBNTUOGYKCSIU-FQEVSTJZSA-N 0 3 416.363 4.227 20 0 HIADHN CN(C(=O)c1ccc(NCc2ccc(Br)cc2)cc1)[C@@H]1CCCN(C)C1 ZINC000559998642 944120981 /nfs/dbraw/zinc/12/09/81/944120981.db2.gz AFBNTUOGYKCSIU-HXUWFJFHSA-N 0 3 416.363 4.227 20 0 HIADHN Cc1nc2ccc(CNc3ccc(C(=O)N(C)[C@@H]4CCCN(C)C4)cc3)cc2s1 ZINC000559999400 944122836 /nfs/dbraw/zinc/12/28/36/944122836.db2.gz UHBHMLZXUVPLQT-HXUWFJFHSA-N 0 3 408.571 4.383 20 0 HIADHN C[C@]1(C2CC2)NC(=O)N(c2cccc(CNCc3cc4ccccc4s3)c2)C1=O ZINC000560078674 944151123 /nfs/dbraw/zinc/15/11/23/944151123.db2.gz YHWQNTCHHCPTMB-HSZRJFAPSA-N 0 3 405.523 4.416 20 0 HIADHN Cc1sc([C@H](C)NC(=O)N2CCN3CCC2CC3)nc1-c1ccc(Cl)cc1 ZINC000560106774 944161963 /nfs/dbraw/zinc/16/19/63/944161963.db2.gz YVRZNIMEGFWTGI-ZDUSSCGKSA-N 0 3 404.967 4.323 20 0 HIADHN COC(=O)[C@H](Cc1ccccc1)[C@@H](C)N[C@@H](C)C(=O)Nc1c(C)cc(C)cc1Cl ZINC000560178978 944188165 /nfs/dbraw/zinc/18/81/65/944188165.db2.gz DFMPGHRESVUSIR-ZIFCJYIRSA-N 0 3 416.949 4.294 20 0 HIADHN CC(C)(C)CCNC(=O)CN[C@@H](c1cccc(C(F)(F)F)c1)C1CCOCC1 ZINC000560180940 944189786 /nfs/dbraw/zinc/18/97/86/944189786.db2.gz MLNBTVLIXNKFIB-LJQANCHMSA-N 0 3 400.485 4.315 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)Cc2csc(-c3cccc(C)c3)n2)cc1 ZINC000560245909 944206043 /nfs/dbraw/zinc/20/60/43/944206043.db2.gz LVXFUBYNVPREBS-OAQYLSRUSA-N 0 3 409.555 4.089 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)[C@@H](C)c2ccc3cc(OC)ccc3c2)cc1 ZINC000560248427 944206906 /nfs/dbraw/zinc/20/69/06/944206906.db2.gz LUIHBTVNMGMZEC-XDHUDOTRSA-N 0 3 406.526 4.380 20 0 HIADHN C[C@H](N[C@@H](c1cncc(Br)c1)C1CC1)c1cccc(N2CCOCC2)c1 ZINC000560269713 944214193 /nfs/dbraw/zinc/21/41/93/944214193.db2.gz XNSMAVXUWQTSEP-YCRPNKLZSA-N 0 3 416.363 4.483 20 0 HIADHN Cc1ccc([C@H](NCc2cccc(N3C(=O)N[C@](C)(C4CC4)C3=O)c2)C2CC2)cc1 ZINC000560270918 944215270 /nfs/dbraw/zinc/21/52/70/944215270.db2.gz UPHMSFGEDXMMAY-WIOPSUGQSA-N 0 3 403.526 4.461 20 0 HIADHN COCC(=O)Nc1cccc(CN[C@H](c2cccc(OC(F)(F)F)c2)C2CC2)c1 ZINC000560521820 944241645 /nfs/dbraw/zinc/24/16/45/944241645.db2.gz FOXUCHKXLSIGQK-FQEVSTJZSA-N 0 3 408.420 4.411 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc2c(c1)OCC(=O)N2)c1cccc(OCc2ccccn2)c1 ZINC000560522827 944241724 /nfs/dbraw/zinc/24/17/24/944241724.db2.gz KOSSXEMPELUGKO-IRXDYDNUSA-N 0 3 403.482 4.403 20 0 HIADHN COc1ccc(C[C@H](C)N[C@@H](CCO)c2ccccc2Br)c(C)c1OC ZINC000560548535 944250342 /nfs/dbraw/zinc/25/03/42/944250342.db2.gz HMUUNVPVAAYHTB-LIRRHRJNSA-N 0 3 422.363 4.419 20 0 HIADHN COc1ccccc1NC(=O)C[C@H](C)N[C@H](CCO)c1ccc(Cl)c(Cl)c1 ZINC000560585580 944264482 /nfs/dbraw/zinc/26/44/82/944264482.db2.gz UATMESOGWFDWQV-SUMWQHHRSA-N 0 3 411.329 4.432 20 0 HIADHN O=C([C@H]1CN(Cc2ccccc2)CCC1(F)F)N1CC=C(c2ccccc2F)C1 ZINC000560624814 944278840 /nfs/dbraw/zinc/27/88/40/944278840.db2.gz SBWFPEONVXABRK-HXUWFJFHSA-N 0 3 400.444 4.209 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)[C@H]1C[C@@H]1c1ccccc1C(F)(F)F ZINC000560676227 944290023 /nfs/dbraw/zinc/29/00/23/944290023.db2.gz POSLXQYCWYROPR-UHOSZYNNSA-N 0 3 404.432 4.014 20 0 HIADHN CC(C)(C)OC1CC(CCNC(=O)[C@H]2CN(Cc3ccccc3)CCC2(F)F)C1 ZINC000560674416 944290292 /nfs/dbraw/zinc/29/02/92/944290292.db2.gz DNLRSFGOEWCLAV-SOAGJPPSSA-N 0 3 408.533 4.244 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)[C@@H](C)Cc1c(C)nn(C)c1C)c1ccc(Cl)cc1 ZINC000560710859 944304455 /nfs/dbraw/zinc/30/44/55/944304455.db2.gz YKLFKKBCQDJFHQ-BTYIYWSLSA-N 0 3 404.986 4.068 20 0 HIADHN CCCN(C)[C@H](CNC(=O)c1cccc(C(=O)N(C)CC)c1)c1ccc(Cl)cc1 ZINC000560710317 944305081 /nfs/dbraw/zinc/30/50/81/944305081.db2.gz UQLBGSCUVUBWNG-OAQYLSRUSA-N 0 3 415.965 4.245 20 0 HIADHN CCOc1ccc(C(=O)CCC(=O)N2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)cc1 ZINC000560758602 944322619 /nfs/dbraw/zinc/32/26/19/944322619.db2.gz LYCPGZUVAWQXGZ-AREMUKBSSA-N 0 3 420.553 4.173 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)N1CC[C@@](F)(c2cc(F)cc(F)c2)C1 ZINC000560826612 944348903 /nfs/dbraw/zinc/34/89/03/944348903.db2.gz FYJDJQWWASONES-QFIPXVFZSA-N 0 3 402.416 4.484 20 0 HIADHN Cc1ccc(S(=O)(=O)N[C@H](CCN(C)[C@@H](C)c2cccnc2)c2ccccc2)cc1 ZINC000560854229 944358502 /nfs/dbraw/zinc/35/85/02/944358502.db2.gz FMGMRARAYMLCOW-GBXCKJPGSA-N 0 3 423.582 4.493 20 0 HIADHN Cn1cc(C(F)(F)F)nc1[C@@H]1CCCN(C(=O)c2cccc(CN3CCCC3)c2)C1 ZINC000560855458 944358931 /nfs/dbraw/zinc/35/89/31/944358931.db2.gz LCGYARPJXADDFL-GOSISDBHSA-N 0 3 420.479 4.055 20 0 HIADHN C[C@H](NCc1ccc(S(=O)(=O)N2CCCC2)cc1)c1cccc(-c2ccncc2)c1 ZINC000560881931 944365004 /nfs/dbraw/zinc/36/50/04/944365004.db2.gz BWRFBUWRMASDFO-IBGZPJMESA-N 0 3 421.566 4.384 20 0 HIADHN CSc1ccc([C@H](C)NCc2ccccc2CS(=O)(=O)N2CCCC2)cc1 ZINC000560907238 944367406 /nfs/dbraw/zinc/36/74/06/944367406.db2.gz CKURCJNCKPFLRT-KRWDZBQOSA-N 0 3 404.601 4.185 20 0 HIADHN CCCOc1ccc([C@@H](C)NCc2ccccc2CS(=O)(=O)N2CCCC2)cc1 ZINC000560910358 944368659 /nfs/dbraw/zinc/36/86/59/944368659.db2.gz RIVAQFAQCGTPMI-LJQANCHMSA-N 0 3 416.587 4.252 20 0 HIADHN CCCN(C)[C@H](CNC(=O)c1ccccc1Cn1cccn1)c1ccc(Cl)cc1 ZINC000560974994 944382288 /nfs/dbraw/zinc/38/22/88/944382288.db2.gz XWGMBWHVVBJMAV-JOCHJYFZSA-N 0 3 410.949 4.398 20 0 HIADHN O=C(Nc1ccc2c(Cl)cccc2n1)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000561039286 944411415 /nfs/dbraw/zinc/41/14/15/944411415.db2.gz JKBNGSJAUZXBDS-UHFFFAOYSA-N 0 3 409.917 4.345 20 0 HIADHN O=C(CC[C@H]1CCCO1)N(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000561075659 944430734 /nfs/dbraw/zinc/43/07/34/944430734.db2.gz UEVBANLXWWGQIS-BJKOFHAPSA-N 0 3 407.558 4.034 20 0 HIADHN Cc1ncccc1CC(=O)N(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000561076898 944432500 /nfs/dbraw/zinc/43/25/00/944432500.db2.gz ZXIGMJARVOQREV-RUZDIDTESA-N 0 3 414.553 4.021 20 0 HIADHN C[C@H](NC(=O)N(C)C1CCN(CCc2ccccn2)CC1)c1ccccc1Cl ZINC000561158803 944488553 /nfs/dbraw/zinc/48/85/53/944488553.db2.gz JLJWBEWCQZUIBL-KRWDZBQOSA-N 0 3 400.954 4.145 20 0 HIADHN C[C@@H]1CCCN(C(=O)CN(C)CCCCCc2cc(-c3cccc(F)c3)n[nH]2)C1 ZINC000561170663 944496004 /nfs/dbraw/zinc/49/60/04/944496004.db2.gz MTKIBSAHMQEFAW-GOSISDBHSA-N 0 3 400.542 4.119 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)Cc1csc(COc2ccc(C)cc2)n1 ZINC000561268707 944534387 /nfs/dbraw/zinc/53/43/87/944534387.db2.gz SXEGIDMNOAOHQC-UHFFFAOYSA-N 0 3 415.603 4.298 20 0 HIADHN CCS(=O)(=O)c1ccc([C@@H](C)N[C@@H](C)CC(=O)Nc2cccc(C)c2C)cc1 ZINC000561297693 944543084 /nfs/dbraw/zinc/54/30/84/944543084.db2.gz IFTRLYQFCJYAKL-FUHWJXTLSA-N 0 3 402.560 4.165 20 0 HIADHN O=C1c2ccccc2C(=O)N1CCCNCc1csc(-c2ccc(Cl)cc2)n1 ZINC000561313913 944547322 /nfs/dbraw/zinc/54/73/22/944547322.db2.gz GUVZXRZOCICVDI-UHFFFAOYSA-N 0 3 411.914 4.239 20 0 HIADHN CCOc1cc(CNCc2cn(-c3ccccc3)nc2-c2ccncc2)ccc1O ZINC000561324941 944552241 /nfs/dbraw/zinc/55/22/41/944552241.db2.gz FYIXZBUDEVAEDU-UHFFFAOYSA-N 0 3 400.482 4.328 20 0 HIADHN CC(C)N(C)c1cccc(NC(=O)NCCCN2CCN(C)C[C@@H]2c2ccccc2)c1 ZINC000561344810 944557791 /nfs/dbraw/zinc/55/77/91/944557791.db2.gz ZLGBDXHFTLRWLY-XMMPIXPASA-N 0 3 423.605 4.032 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)Cc1c(C)nn(-c2ccc(F)cc2)c1C)c1ccco1 ZINC000561370778 944564797 /nfs/dbraw/zinc/56/47/97/944564797.db2.gz ZGLDPBKEVUQRFX-VFNWGFHPSA-N 0 3 412.509 4.009 20 0 HIADHN O=C(Nc1ccc2nc(C(F)F)sc2c1)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000561389923 944574231 /nfs/dbraw/zinc/57/42/31/944574231.db2.gz GOHAYXRLBIDIRZ-AWEZNQCLSA-N 0 3 402.470 4.480 20 0 HIADHN C[C@@H](N[C@@H](c1ccc2c(c1)OCCO2)C1CC1)C(=O)Nc1cc(Cl)ccc1F ZINC000561402579 944581038 /nfs/dbraw/zinc/58/10/38/944581038.db2.gz RSYKWYRKPMGKOI-MPBGBICISA-N 0 3 404.869 4.318 20 0 HIADHN COC(=O)[C@@H](C)Oc1ccc(CNC2(c3cccc(Br)c3)CC2)cc1 ZINC000561522374 944652536 /nfs/dbraw/zinc/65/25/36/944652536.db2.gz GSFWYWDCNLTSAZ-CQSZACIVSA-N 0 3 404.304 4.168 20 0 HIADHN CCCN(CCN1CCCC1)C(=O)c1ccc2c(c1)nc(Cc1cccs1)n2C ZINC000561546882 944667380 /nfs/dbraw/zinc/66/73/80/944667380.db2.gz ZAODSPINMUCJRZ-UHFFFAOYSA-N 0 3 410.587 4.174 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)c1ccc(NC(=O)CC(C)C)c(F)c1)c1ccco1 ZINC000561610573 944705444 /nfs/dbraw/zinc/70/54/44/944705444.db2.gz NOCJZYGTJKHTHY-DNVCBOLYSA-N 0 3 403.498 4.263 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)c1ccc(NC(=O)CC(C)C)c(F)c1)c1ccco1 ZINC000561610572 944706107 /nfs/dbraw/zinc/70/61/07/944706107.db2.gz NOCJZYGTJKHTHY-BEFAXECRSA-N 0 3 403.498 4.263 20 0 HIADHN Cc1nc(C(F)(F)F)ccc1C(=O)NC[C@@H](c1ccc(OC(C)C)cc1)N(C)C ZINC000561675809 944741672 /nfs/dbraw/zinc/74/16/72/944741672.db2.gz DGVHRYBCJAWWQS-SFHVURJKSA-N 0 3 409.452 4.229 20 0 HIADHN CSc1ccc([C@@H](CNC(=O)c2cnc3c(F)ccc(F)c3c2)N(C)C)cc1 ZINC000561727401 944767186 /nfs/dbraw/zinc/76/71/86/944767186.db2.gz WCOLJXFOZGUPIR-LJQANCHMSA-N 0 3 401.482 4.268 20 0 HIADHN Cc1onc(-c2ccc(C(F)(F)F)cc2)c1C(=O)N1CCN([C@@H]2C[C@@H]2C)C[C@H](C)C1 ZINC000561762530 944785287 /nfs/dbraw/zinc/78/52/87/944785287.db2.gz URXNMRBYUDCRQS-SUNYJGFJSA-N 0 3 421.463 4.471 20 0 HIADHN CCC[C@H]1C[C@@H](C(=O)Nc2ccc(N3CCN(CCC)CC3)cc2OCC)CCO1 ZINC000561796551 944800136 /nfs/dbraw/zinc/80/01/36/944800136.db2.gz AHLGOSZQDXJYQZ-FPOVZHCZSA-N 0 3 417.594 4.151 20 0 HIADHN COc1ccc(-c2ocnc2C(=O)NC[C@@H]2CCCN(Cc3cccs3)C2)cc1 ZINC000561842482 944819276 /nfs/dbraw/zinc/81/92/76/944819276.db2.gz UUFLQDRXALNPLW-INIZCTEOSA-N 0 3 411.527 4.054 20 0 HIADHN CC(C)n1ncc2c1nc(C1CC1)cc2C(=O)N[C@H](C)CN(C)Cc1ccccc1 ZINC000561877928 944833475 /nfs/dbraw/zinc/83/34/75/944833475.db2.gz STSNDIPGWOTPDL-QGZVFWFLSA-N 0 3 405.546 4.140 20 0 HIADHN CN(C)[C@H](CNC(=O)NCc1cc(F)c(C(F)(F)F)cc1F)c1ccccc1 ZINC000562009877 944893372 /nfs/dbraw/zinc/89/33/72/944893372.db2.gz WSQSEKOHZBVUTG-QGZVFWFLSA-N 0 3 401.379 4.086 20 0 HIADHN C[C@H](N[C@@H]1CCN(C)[C@H]1c1ccc(Cl)cc1)C(=O)N1CCC[C@@H]1c1cccs1 ZINC000562049020 944910567 /nfs/dbraw/zinc/91/05/67/944910567.db2.gz NGFARXLYBWDZGF-ZRRCRCOKSA-N 0 3 418.006 4.489 20 0 HIADHN C[C@H](N[C@@H]1CCN(C)[C@@H]1c1ccc(Cl)cc1)C(=O)Nc1cc(Cl)ccc1F ZINC000562050512 944912130 /nfs/dbraw/zinc/91/21/30/944912130.db2.gz WGKHNDRMCODHPQ-OEPMTFCVSA-N 0 3 410.320 4.495 20 0 HIADHN Cc1c([C@H](C)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)nnn1-c1ccccc1 ZINC000562056605 944914868 /nfs/dbraw/zinc/91/48/68/944914868.db2.gz BLSXRYSZONUKBC-FDDCHVKYSA-N 0 3 407.562 4.316 20 0 HIADHN CCCN(C)[C@H](CNC(=O)Nc1cc(C(=O)NC)ccc1C)c1ccc(Cl)cc1 ZINC000562073419 944923040 /nfs/dbraw/zinc/92/30/40/944923040.db2.gz DVLANUVATQVKTA-HXUWFJFHSA-N 0 3 416.953 4.213 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)N[C@H]1CCC[C@H]1Oc1cc(F)cc(F)c1 ZINC000562086273 944929964 /nfs/dbraw/zinc/92/99/64/944929964.db2.gz AHZVBWTVJYMYRO-GHTZIAJQSA-N 0 3 419.472 4.157 20 0 HIADHN C[C@@H](N[C@H]1CCCN(c2ccn(C)n2)C1=O)c1ccc(-c2c(F)cccc2F)cc1 ZINC000562089245 944932231 /nfs/dbraw/zinc/93/22/31/944932231.db2.gz RWICRZPATKYKNF-QRWLVFNGSA-N 0 3 410.468 4.212 20 0 HIADHN C[C@H](N[C@@H]1CCCN(c2ccn(C)n2)C1=O)c1ccc(-c2c(F)cccc2F)cc1 ZINC000562089244 944932631 /nfs/dbraw/zinc/93/26/31/944932631.db2.gz RWICRZPATKYKNF-MGPUTAFESA-N 0 3 410.468 4.212 20 0 HIADHN OCc1cn(CCCN[C@@H](c2ccccc2Cl)c2cccc3ccccc32)nn1 ZINC000562090551 944933945 /nfs/dbraw/zinc/93/39/45/944933945.db2.gz JAAIYSPIOCPNHB-HSZRJFAPSA-N 0 3 406.917 4.346 20 0 HIADHN Cc1ccc(C(=O)N(C)C)cc1NC(=O)NC[C@@H](c1ccc(CC(C)C)cc1)N(C)C ZINC000562126755 944957403 /nfs/dbraw/zinc/95/74/03/944957403.db2.gz AJVBOYJJGIALTQ-QHCPKHFHSA-N 0 3 424.589 4.320 20 0 HIADHN Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C ZINC000562141850 944970775 /nfs/dbraw/zinc/97/07/75/944970775.db2.gz GVXCKXWZGIQVJK-AVRDEDQJSA-N 0 3 410.562 4.194 20 0 HIADHN CN(C)C[C@H](NC(=O)Nc1ccc(-n2cccn2)c(Cl)c1)c1ccc(F)cc1 ZINC000562148975 944978810 /nfs/dbraw/zinc/97/88/10/944978810.db2.gz ZPHQRYRYJJBOPO-SFHVURJKSA-N 0 3 401.873 4.089 20 0 HIADHN Cc1ccc(NC(=O)N[C@@H](CN(C)C)c2ccc(F)cc2)c(OC[C@@H]2CCCO2)c1 ZINC000562155413 944983645 /nfs/dbraw/zinc/98/36/45/944983645.db2.gz BFEBTNRLFQTFIH-FPOVZHCZSA-N 0 3 415.509 4.116 20 0 HIADHN Cc1sc(Br)c(C(=O)N(C)CCCN(C)Cc2ccncc2)c1C ZINC000564110040 945382576 /nfs/dbraw/zinc/38/25/76/945382576.db2.gz NDYSLOYQAACMSV-UHFFFAOYSA-N 0 3 410.381 4.117 20 0 HIADHN COc1ccc2c(c1F)CC[C@H]2NC[C@H](O)COc1cccc(Cl)c1Cl ZINC000564144477 945397918 /nfs/dbraw/zinc/39/79/18/945397918.db2.gz RZZTWGVYGNVZJY-XHDPSFHLSA-N 0 3 400.277 4.158 20 0 HIADHN C/C(=C/c1ccccc1OC(F)F)CN(C)[C@@H](C)c1ccc(S(N)(=O)=O)cc1 ZINC000564261437 945478712 /nfs/dbraw/zinc/47/87/12/945478712.db2.gz RPODXGSGUVEQNQ-ZSMUJPCHSA-N 0 3 410.486 4.032 20 0 HIADHN Cc1c2ccccc2oc1[C@@H](NC(=O)N1CCN(CC2CCOCC2)CC1)C(C)C ZINC000564287810 945499163 /nfs/dbraw/zinc/49/91/63/945499163.db2.gz PCGOALFLYCMASV-QFIPXVFZSA-N 0 3 413.562 4.192 20 0 HIADHN C[C@@H](c1cccc(N2CCCS2(=O)=O)c1)N(C)C/C=C/c1ccc(F)c(F)c1 ZINC000564302880 945505777 /nfs/dbraw/zinc/50/57/77/945505777.db2.gz VUVQKUIDKVXCNZ-NBUZRDOWSA-N 0 3 406.498 4.211 20 0 HIADHN Cn1cc(C(F)(F)F)nc1[C@@H]1CCCN(Cc2cnc(-c3ccccn3)s2)C1 ZINC000564304645 945507683 /nfs/dbraw/zinc/50/76/83/945507683.db2.gz YXPVNPWREIUOJD-CYBMUJFWSA-N 0 3 407.465 4.337 20 0 HIADHN C[C@@H]1OCC[C@@]1(O)CN(Cc1cnc(-c2ccsc2)s1)Cc1ccccc1 ZINC000564324845 945516208 /nfs/dbraw/zinc/51/62/08/945516208.db2.gz INGPXGGCCPZJIN-HRAATJIYSA-N 0 3 400.569 4.414 20 0 HIADHN COc1ccc(-c2nsc(NC(=O)N[C@H](CN3CCCC3)c3ccccc3)n2)cc1 ZINC000564367294 945533511 /nfs/dbraw/zinc/53/35/11/945533511.db2.gz FJLJTAYXOJKLNC-LJQANCHMSA-N 0 3 423.542 4.172 20 0 HIADHN O=c1[nH]c2ccccc2n1CCCN[C@@H](CO)c1ccc(Cl)cc1C(F)(F)F ZINC000564390232 945548989 /nfs/dbraw/zinc/54/89/89/945548989.db2.gz RJYPBDGCBMJNPI-INIZCTEOSA-N 0 3 413.827 4.127 20 0 HIADHN CN(Cc1ccc(Cl)s1)C(=O)CN[C@@H]1CCN(C)[C@@H]1c1ccc(Cl)cc1 ZINC000564395110 945552985 /nfs/dbraw/zinc/55/29/85/945552985.db2.gz JUZSZCZYXIECQJ-VQIMIIECSA-N 0 3 412.386 4.048 20 0 HIADHN C[C@@H](N[C@@H]1c2ccccc2CC12CCOCC2)C(=O)Nc1nc2ccccc2s1 ZINC000564410361 945562354 /nfs/dbraw/zinc/56/23/54/945562354.db2.gz VQXYQTZXCWANNL-FOIQADDNSA-N 0 3 407.539 4.307 20 0 HIADHN O=S(=O)(CCCNCc1cnc(-c2ccccc2)s1)c1ccc(Cl)cc1 ZINC000564589056 945689695 /nfs/dbraw/zinc/68/96/95/945689695.db2.gz ONZOHAFJNIXNEY-UHFFFAOYSA-N 0 3 406.960 4.417 20 0 HIADHN CN(C)[C@H](CNC(=O)N1CCC(c2noc3cc(F)ccc32)CC1)Cc1ccccc1 ZINC000564601154 945699132 /nfs/dbraw/zinc/69/91/32/945699132.db2.gz FLUKSVSUZCIPJR-FQEVSTJZSA-N 0 3 424.520 4.029 20 0 HIADHN COc1cccc(OC)c1OC[C@H](O)CN1CCCCC[C@H]1/C=C\c1cccs1 ZINC000564605845 945701675 /nfs/dbraw/zinc/70/16/75/945701675.db2.gz SQNNJLTWDQQJJA-FRRBRAEUSA-N 0 3 417.571 4.463 20 0 HIADHN CN(C)Cc1ccccc1NC(=O)CCNc1ncc(C(F)(F)F)cc1Cl ZINC000564623913 945715328 /nfs/dbraw/zinc/71/53/28/945715328.db2.gz XDFZRFAAFPEQAM-UHFFFAOYSA-N 0 3 400.832 4.256 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)[C@@H]1CCn2c(cnc2C2CCCCC2)C1)c1ccco1 ZINC000564678465 945725706 /nfs/dbraw/zinc/72/57/06/945725706.db2.gz BMEZKXZRNIZRGN-DSKINZAPSA-N 0 3 412.578 4.332 20 0 HIADHN C[C@H](NC[C@@H](CO)Cc1c(F)cccc1Cl)c1ccc(Br)cn1 ZINC000564766877 945754820 /nfs/dbraw/zinc/75/48/20/945754820.db2.gz RIWPGPUGZYNZKP-RYUDHWBXSA-N 0 3 401.707 4.138 20 0 HIADHN CN(C(=O)N[C@H](c1ccccc1)[C@@H]1CCOC1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000565093833 945772964 /nfs/dbraw/zinc/77/29/64/945772964.db2.gz RNWZTRFQFAPARH-TZRRMPRUSA-N 0 3 407.558 4.070 20 0 HIADHN CN(C)C[C@@H](NC(=O)COC(c1ccccc1)c1ccccc1)c1ccc(F)cc1 ZINC000565267411 945797935 /nfs/dbraw/zinc/79/79/35/945797935.db2.gz RSOOPLKBLGOOOL-HSZRJFAPSA-N 0 3 406.501 4.351 20 0 HIADHN C[C@H](c1ccc(F)cc1)N(C)C(=O)CN[C@@H]1CCN(C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000565331061 945812299 /nfs/dbraw/zinc/81/22/99/945812299.db2.gz DOPKQLBQCQMNGR-JEWAVWJGSA-N 0 3 421.919 4.173 20 0 HIADHN CCCC[C@H](N[C@@H]1CCCc2ccc(S(N)(=O)=O)cc21)c1ccc(OC)cc1 ZINC000565450166 945833826 /nfs/dbraw/zinc/83/38/26/945833826.db2.gz LAAMRBXQUBAKAR-FCHUYYIVSA-N 0 3 402.560 4.241 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)c1cc(NC(C)=O)cc(C(F)(F)F)c1)c1ccco1 ZINC000565500080 945840007 /nfs/dbraw/zinc/84/00/07/945840007.db2.gz GBQXNMYGTKZDLP-PXAZEXFGSA-N 0 3 411.424 4.116 20 0 HIADHN Cc1ccc(NC(=O)[C@H](C)N[C@H]2CCN(C)[C@@H]2c2ccc(Cl)c(F)c2)c(C)c1 ZINC000565743710 945878035 /nfs/dbraw/zinc/87/80/35/945878035.db2.gz NJUYWSMMUWUCCE-ONGXBYRLSA-N 0 3 403.929 4.458 20 0 HIADHN C[C@@H]1[C@H](NC(=O)Nc2ccccc2C(=O)N2CCCCC2)CCN1Cc1ccccc1 ZINC000565794448 945884347 /nfs/dbraw/zinc/88/43/47/945884347.db2.gz LHXUIZZKQKJXMU-DENIHFKCSA-N 0 3 420.557 4.097 20 0 HIADHN COc1cc2c(c(CN3CCC[C@H](c4nc(C(F)(F)F)cn4C)C3)c1)O[C@@H](C)C2 ZINC000565977554 945954869 /nfs/dbraw/zinc/95/48/69/945954869.db2.gz ZIGRGJDDFCOZRA-KBPBESRZSA-N 0 3 409.452 4.151 20 0 HIADHN Cc1ccc2[nH]c(CNCc3cccc(N4C(=O)NC5(CCCC5)C4=O)c3)cc2c1C ZINC000565976770 945956512 /nfs/dbraw/zinc/95/65/12/945956512.db2.gz CEEBNTURVAGZPE-UHFFFAOYSA-N 0 3 416.525 4.444 20 0 HIADHN CCCN1c2ccc(NC(=O)N[C@H](C)CN(C)Cc3ccccc3)cc2CCC1=O ZINC000566033413 945983435 /nfs/dbraw/zinc/98/34/35/945983435.db2.gz UGDYYLOZOGYKDQ-GOSISDBHSA-N 0 3 408.546 4.018 20 0 HIADHN C[C@H]1[C@@H](NC(=O)c2cccc(OCc3cscn3)c2)CCN1Cc1ccccc1 ZINC000566390390 946018699 /nfs/dbraw/zinc/01/86/99/946018699.db2.gz RNVOJIJJMMXDDG-JTSKRJEESA-N 0 3 407.539 4.115 20 0 HIADHN CCOc1cc(C[NH2+]CCc2ccc(-n3cccn3)cc2)cc(Br)c1[O-] ZINC000566581253 946046571 /nfs/dbraw/zinc/04/65/71/946046571.db2.gz IHUGPVSVCHDKLO-UHFFFAOYSA-N 0 3 416.319 4.071 20 0 HIADHN CSc1ccc([C@@H](CNC(=O)Cc2c(C)nn(-c3ccccc3)c2C)N(C)C)cc1 ZINC000566937276 946174264 /nfs/dbraw/zinc/17/42/64/946174264.db2.gz SQONPTXKXHIHNC-HSZRJFAPSA-N 0 3 422.598 4.173 20 0 HIADHN CS(=O)(=O)Nc1ccc(CNCc2ccc(Oc3ccc(F)cc3)cc2)cc1 ZINC000567031781 946222537 /nfs/dbraw/zinc/22/25/37/946222537.db2.gz ANLKWPFAHAQCAD-UHFFFAOYSA-N 0 3 400.475 4.279 20 0 HIADHN O=C(Cc1nc(-c2ccc(F)cc2)cs1)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000567083257 946237119 /nfs/dbraw/zinc/23/71/19/946237119.db2.gz DKUGGDGFKLBEHU-HXUWFJFHSA-N 0 3 409.530 4.273 20 0 HIADHN CCOC(=O)Cn1nc(C)c(CN2CCC([C@@H](F)c3ccccc3F)CC2)c1C ZINC000567200591 946269063 /nfs/dbraw/zinc/26/90/63/946269063.db2.gz NDBHXJOEFSBFPA-JOCHJYFZSA-N 0 3 405.489 4.125 20 0 HIADHN CCn1ncc2ccc(NC(=O)NC[C@H](c3ccc(OC(C)C)cc3)N(C)C)cc21 ZINC000567261579 946281605 /nfs/dbraw/zinc/28/16/05/946281605.db2.gz XEJQBCFAAPMAOM-JOCHJYFZSA-N 0 3 409.534 4.268 20 0 HIADHN Cc1nc(CCC(=O)N[C@@H]2CCN(Cc3ccccc3)[C@H]2C)oc1-c1ccccc1 ZINC000567304375 946302889 /nfs/dbraw/zinc/30/28/89/946302889.db2.gz YCEKEQRUWYRGNX-SIKLNZKXSA-N 0 3 403.526 4.362 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)c1cncc(C(F)(F)F)c1 ZINC000567306896 946305004 /nfs/dbraw/zinc/30/50/04/946305004.db2.gz PCJYEUZZJFKIQL-UHFFFAOYSA-N 0 3 419.369 4.323 20 0 HIADHN CC(C)C[C@H](NC(=O)N1CC[C@H](N2CCN(C(C)C)CC2)C1)c1ccc(Cl)cc1 ZINC000567438539 946341474 /nfs/dbraw/zinc/34/14/74/946341474.db2.gz FHSUWOPAPOYNOX-VXKWHMMOSA-N 0 3 421.029 4.237 20 0 HIADHN Cc1ccccc1[C@@H](CC(F)(F)F)NC(=O)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000567604520 946383615 /nfs/dbraw/zinc/38/36/15/946383615.db2.gz XUKFSQGTHPSUSG-UYAOXDASSA-N 0 3 405.464 4.412 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)c1cc(Cl)ccc1OC1CCCC1 ZINC000568006201 946439520 /nfs/dbraw/zinc/43/95/20/946439520.db2.gz YXEUXXJSAIUSFR-IBGZPJMESA-N 0 3 414.933 4.480 20 0 HIADHN CC[C@H](C)[C@H](NCC(=O)Nc1ccccc1SCC(N)=O)c1ccc(Cl)cc1 ZINC000568063782 946453718 /nfs/dbraw/zinc/45/37/18/946453718.db2.gz WOKLHNGCTMPUEY-QKKBWIMNSA-N 0 3 419.978 4.233 20 0 HIADHN O=C(CN[C@H]1c2ccccc2CC12CCOCC2)Nc1ccccc1Br ZINC000568143465 946480240 /nfs/dbraw/zinc/48/02/40/946480240.db2.gz TWVDQOVTVGYNFB-FQEVSTJZSA-N 0 3 415.331 4.071 20 0 HIADHN COc1ccc([C@@H](C)NCc2ccc(C)nc2-n2cc(Cl)cn2)c(C)c1OC ZINC000568375960 946527160 /nfs/dbraw/zinc/52/71/60/946527160.db2.gz TUTCDWRDNQKQFT-OAHLLOKOSA-N 0 3 400.910 4.406 20 0 HIADHN CN(C)C[C@@H](NC(=O)Nc1cccc(N2CCCCC2=O)c1)c1ccc(Cl)cc1 ZINC000568417205 946531670 /nfs/dbraw/zinc/53/16/70/946531670.db2.gz YCINYMQLMQXFCR-HXUWFJFHSA-N 0 3 414.937 4.281 20 0 HIADHN O=C(c1cncc(C(F)(F)F)c1)N(CCN1CCCC1)Cc1ccc(Cl)cc1 ZINC000568438658 946547263 /nfs/dbraw/zinc/54/72/63/946547263.db2.gz DBXCMRCYUMRWCF-UHFFFAOYSA-N 0 3 411.855 4.492 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)c1cc2sc(N3CCCC3)nc2s1)c1ccco1 ZINC000568551118 946589972 /nfs/dbraw/zinc/58/99/72/946589972.db2.gz PTCXEXWNVVDTMT-KGLIPLIRSA-N 0 3 418.588 4.410 20 0 HIADHN CCOc1ccc(C(C)=O)cc1CN[C@@H]1CCN(C2CC2)[C@@H]1c1cccc(OC)c1 ZINC000568657527 946640331 /nfs/dbraw/zinc/64/03/31/946640331.db2.gz WQOLETGSENBFKJ-ILBGXUMGSA-N 0 3 408.542 4.364 20 0 HIADHN CCOc1ccc(C(C)=O)cc1CN[C@H]1CCN(C2CC2)[C@H]1c1cccc(OC)c1 ZINC000568657530 946640442 /nfs/dbraw/zinc/64/04/42/946640442.db2.gz WQOLETGSENBFKJ-ZCYQVOJMSA-N 0 3 408.542 4.364 20 0 HIADHN COc1ccc(CN2CCC[C@@H](c3nnc(C4CC4)[nH]3)C2)cc1OCc1cccnc1 ZINC000568895853 946739236 /nfs/dbraw/zinc/73/92/36/946739236.db2.gz RWBNSAPSOYDYMK-HXUWFJFHSA-N 0 3 419.529 4.044 20 0 HIADHN CN(C)CCn1nccc1NC(=O)c1csc(-c2ccc(Cl)cc2Cl)n1 ZINC000568906316 946743158 /nfs/dbraw/zinc/74/31/58/946743158.db2.gz IYEXALPMJWGMPJ-UHFFFAOYSA-N 0 3 410.330 4.127 20 0 HIADHN Cc1ccsc1CNC(=O)CN[C@H]1CCN(C(C)C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000569005831 946793785 /nfs/dbraw/zinc/79/37/85/946793785.db2.gz BVIHEJUWEQITKP-RXVVDRJESA-N 0 3 423.985 4.279 20 0 HIADHN COc1ccc([C@@H](Cc2ccccc2)N[C@H](C)C(=O)Nc2ccnn2C(C)C)cc1 ZINC000569046732 946808285 /nfs/dbraw/zinc/80/82/85/946808285.db2.gz YCTSAJLKZFQNKN-XMSQKQJNSA-N 0 3 406.530 4.373 20 0 HIADHN CC1(C)[C@H](C(F)(F)F)CCN1C(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000569108984 946817253 /nfs/dbraw/zinc/81/72/53/946817253.db2.gz UOUNQGGXPJKDNH-HZPDHXFCSA-N 0 3 404.423 4.333 20 0 HIADHN Cc1cc(C)c(NC(=O)CN[C@H]2CCN(C)[C@H]2c2ccc(Cl)c(F)c2)c(C)c1 ZINC000569293298 946853271 /nfs/dbraw/zinc/85/32/71/946853271.db2.gz YOVQRECRDHUKHV-UGKGYDQZSA-N 0 3 403.929 4.378 20 0 HIADHN Cc1nc(CCN[C@@H](C)c2cccc(S(=O)(=O)NC3CCCCCC3)c2)c(C)o1 ZINC000569368424 946861353 /nfs/dbraw/zinc/86/13/53/946861353.db2.gz NRWXKQKVLIPYOZ-INIZCTEOSA-N 0 3 419.591 4.186 20 0 HIADHN CN1CCC(N(Cc2ccccc2Br)C(=O)Nc2ccc(F)cn2)CC1 ZINC000569532832 946888215 /nfs/dbraw/zinc/88/82/15/946888215.db2.gz RUIYUYOKHSSVLU-UHFFFAOYSA-N 0 3 421.314 4.112 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CC(=O)N[C@@H](CN(C)C)c1ccc(Cl)cc1 ZINC000569870859 947026882 /nfs/dbraw/zinc/02/68/82/947026882.db2.gz NZGHHMHXGLNULH-QFIPXVFZSA-N 0 3 410.949 4.104 20 0 HIADHN COc1cc(OC)cc(Oc2ccc(CN3CCC[C@H](c4ccnc(N)n4)C3)cc2)c1 ZINC000569888046 947035616 /nfs/dbraw/zinc/03/56/16/947035616.db2.gz BIUWMLSFJZXFGK-SFHVURJKSA-N 0 3 420.513 4.248 20 0 HIADHN CCC(CC)(CN[C@@H](c1nnc[nH]1)c1ccc(F)cc1)c1ccc(OC)c(OC)c1 ZINC000570053814 947079368 /nfs/dbraw/zinc/07/93/68/947079368.db2.gz FFDHDMMUGRBNMF-OAQYLSRUSA-N 0 3 412.509 4.398 20 0 HIADHN CN(C)C[C@H](NC(=O)c1ccc2nc(C(F)(F)F)cn2c1)c1ccc(Cl)cc1 ZINC000570061523 947080986 /nfs/dbraw/zinc/08/09/86/947080986.db2.gz VLOXVUCFOSFXCA-HNNXBMFYSA-N 0 3 410.827 4.039 20 0 HIADHN O=C1NC2(CCCC2)C(=O)N1c1cccc(CN[C@H](c2cccnc2)C2CCC2)c1 ZINC000570090115 947092397 /nfs/dbraw/zinc/09/23/97/947092397.db2.gz FEXXLRKBDGCUSF-NRFANRHFSA-N 0 3 404.514 4.082 20 0 HIADHN COc1cc(C(C)=O)ccc1OC[C@H](O)CN1CCC[C@@H](C)[C@@H]1c1ccc(C)cc1 ZINC000570319260 947198692 /nfs/dbraw/zinc/19/86/92/947198692.db2.gz OGMKJCGVWJFJKH-YBGOQADZSA-N 0 3 411.542 4.419 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Cc1c[nH]c2cc(Br)ccc12)c1ccco1 ZINC000570424358 947236102 /nfs/dbraw/zinc/23/61/02/947236102.db2.gz JRQIQLALUYCMBK-SCLBCKFNSA-N 0 3 418.335 4.312 20 0 HIADHN CCCN(C)[C@H](CNC(=O)N1CCC2(CCOCC2)[C@H]1C)c1ccc(Cl)cc1 ZINC000570433446 947244679 /nfs/dbraw/zinc/24/46/79/947244679.db2.gz OGVRGYFDNZFULG-YLJYHZDGSA-N 0 3 407.986 4.324 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)Nc1cccc(C(=O)N2CCCC2)c1C)c1ccco1 ZINC000570504575 947270301 /nfs/dbraw/zinc/27/03/01/947270301.db2.gz KNRIUDAQKGWSNS-OXQOHEQNSA-N 0 3 412.534 4.075 20 0 HIADHN Cc1c2cccc(Cl)c2sc1CN1CCC[C@@H](CNS(=O)(=O)C2CC2)C1 ZINC000570590339 947305840 /nfs/dbraw/zinc/30/58/40/947305840.db2.gz QBKDYDJOSOOHIR-AWEZNQCLSA-N 0 3 413.008 4.157 20 0 HIADHN COc1ccc(C)cc1NC(=O)[C@H](C)N[C@H]1CCN(C)[C@@H]1c1ccc(Cl)cc1 ZINC000570731937 947339545 /nfs/dbraw/zinc/33/95/45/947339545.db2.gz MMLLVAXBVIVRSQ-UQASEVPWSA-N 0 3 401.938 4.019 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)N[C@H](c2ccccc2)C(F)(F)F)c1 ZINC000570771906 947355064 /nfs/dbraw/zinc/35/50/64/947355064.db2.gz ATKNASKUQKRHNY-LJQANCHMSA-N 0 3 409.452 4.072 20 0 HIADHN CC(C)Cc1ccc([C@H](CNC(=O)c2cc(=O)[nH]c3cc(F)ccc32)N(C)C)cc1 ZINC000570879613 947380257 /nfs/dbraw/zinc/38/02/57/947380257.db2.gz GDEAPWVERNNOID-QFIPXVFZSA-N 0 3 409.505 4.311 20 0 HIADHN CCCCO[C@H](C)C(=O)N(Cc1ccccc1Br)C1CCN(C)CC1 ZINC000570985106 947413187 /nfs/dbraw/zinc/41/31/87/947413187.db2.gz UZRBIGSFYFDCRT-MRXNPFEDSA-N 0 3 411.384 4.077 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)c1cccnc1OCc1ccccc1F)c1ccco1 ZINC000571117201 947510935 /nfs/dbraw/zinc/51/09/35/947510935.db2.gz RHMMEVMSYLSPPE-UZLBHIALSA-N 0 3 411.477 4.252 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)Cc1cc(Cl)ccc1Br)c1ccco1 ZINC000571236890 947560176 /nfs/dbraw/zinc/56/01/76/947560176.db2.gz NDCTYCQOOZSPRX-WBMJQRKESA-N 0 3 413.743 4.484 20 0 HIADHN CSc1ccc([C@H](CNC(=O)c2cnn(C3CCCCC3)c2C)N(C)C)cc1 ZINC000571337535 947603585 /nfs/dbraw/zinc/60/35/85/947603585.db2.gz WBMUPUGNGMTJJZ-NRFANRHFSA-N 0 3 400.592 4.451 20 0 HIADHN C[C@@H]1CN(c2ccc(CN[C@@H]3CCc4c3cccc4Br)cn2)C[C@@H](C)O1 ZINC000571666434 947741248 /nfs/dbraw/zinc/74/12/48/947741248.db2.gz CRVZQDPUOGUTLT-STXHMFSFSA-N 0 3 416.363 4.235 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)c1nc2ccccc2cc1Br)c1ccco1 ZINC000571843105 947802707 /nfs/dbraw/zinc/80/27/07/947802707.db2.gz RKSJUNGENQBEBV-DYVFJYSZSA-N 0 3 416.319 4.450 20 0 HIADHN C[C@H](C1CC1)N(Cc1ccccc1)C(=O)CN[C@@H]1c2ccccc2CC12CCOCC2 ZINC000571930950 947814942 /nfs/dbraw/zinc/81/49/42/947814942.db2.gz QSUDDYGXUABUIS-FQRUVTKNSA-N 0 3 418.581 4.498 20 0 HIADHN Cc1cccnc1OC1CCN(C[C@@H](O)CO[C@H](C)c2ccc(Cl)cc2)CC1 ZINC000571930409 947815047 /nfs/dbraw/zinc/81/50/47/947815047.db2.gz PBJAHISIUIBGRR-YLJYHZDGSA-N 0 3 404.938 4.025 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@H](C)c1ccc2n[nH]cc2c1)c1cccc(OC)c1 ZINC000572025354 947830203 /nfs/dbraw/zinc/83/02/03/947830203.db2.gz BRELXEDVNGDVHI-OPAMFIHVSA-N 0 3 409.534 4.015 20 0 HIADHN CN(C)C[C@H](NC(=O)N[C@@H]1CCO[C@H](c2ccc(F)cc2)C1)c1ccc(Cl)cc1 ZINC000572224658 947866932 /nfs/dbraw/zinc/86/69/32/947866932.db2.gz DRRCMCBZPZSQJH-HKBOAZHASA-N 0 3 419.928 4.301 20 0 HIADHN Fc1ccc([C@@H](NCCc2ccc(OCc3ccccc3)cc2)c2nnc[nH]2)cc1 ZINC000572427951 947899945 /nfs/dbraw/zinc/89/99/45/947899945.db2.gz HENPIUUBOGIHSG-HSZRJFAPSA-N 0 3 402.473 4.445 20 0 HIADHN CC(C)Cc1ccc([C@@H](CNC(=O)CCc2nnc(C3CCCC3)o2)N(C)C)cc1 ZINC000572432801 947903417 /nfs/dbraw/zinc/90/34/17/947903417.db2.gz URYMPBSGDRZNEH-OAQYLSRUSA-N 0 3 412.578 4.277 20 0 HIADHN COC(=O)c1oc(CN2CCC[C@@H](c3nc(-c4ccc(Cl)cc4)no3)C2)cc1C ZINC000572534976 947936569 /nfs/dbraw/zinc/93/65/69/947936569.db2.gz AHZFSEMBVVBPDO-OAHLLOKOSA-N 0 3 415.877 4.458 20 0 HIADHN O=C(NC[C@H]1CCCN1Cc1ccccc1)Nc1cccc(OCc2cccnc2)c1 ZINC000572633652 947962074 /nfs/dbraw/zinc/96/20/74/947962074.db2.gz ZCXUQSOTTYARKE-HSZRJFAPSA-N 0 3 416.525 4.447 20 0 HIADHN C[C@H]1[C@@H](NC(=O)Nc2ccc(OCC3CCOCC3)cc2)CCN1Cc1ccccc1 ZINC000572758095 948003322 /nfs/dbraw/zinc/00/33/22/948003322.db2.gz JAAMHGSFMMBXRS-CYFREDJKSA-N 0 3 423.557 4.277 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)NCc2cc(Br)ccc2F)c1 ZINC000573005032 948056226 /nfs/dbraw/zinc/05/62/26/948056226.db2.gz ZZOASDFSAKLIQM-UHFFFAOYSA-N 0 3 422.342 4.170 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(CN[C@@H]3COc4ccc(F)cc4C3)c2)cc1 ZINC000573010506 948057503 /nfs/dbraw/zinc/05/75/03/948057503.db2.gz FEUCZVNBBUSOAH-NRFANRHFSA-N 0 3 406.457 4.180 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)NC[C@@H](NCc1ccccc1)c1ccco1 ZINC000573228767 948114276 /nfs/dbraw/zinc/11/42/76/948114276.db2.gz JASRZQHEGAIXDG-OAQYLSRUSA-N 0 3 417.509 4.348 20 0 HIADHN COC(=O)c1ccc(COc2ccc(CN3CC4(CCC4)[C@@H]3C3CC3)cc2OC)o1 ZINC000573412509 948200046 /nfs/dbraw/zinc/20/00/46/948200046.db2.gz JFRVGAOTVWPRES-QFIPXVFZSA-N 0 3 411.498 4.418 20 0 HIADHN Cc1cccc(NC(=O)N[C@H]2CCN(Cc3ccccc3)[C@H]2C)c1C(=O)N1CCCC1 ZINC000573474729 948212100 /nfs/dbraw/zinc/21/21/00/948212100.db2.gz FRBXJIPVYWEMAT-FPOVZHCZSA-N 0 3 420.557 4.016 20 0 HIADHN Cc1ccc(CN(C(=O)CN[C@@H]2c3ccccc3CC23CCOCC3)C2CC2)cc1 ZINC000573528900 948232540 /nfs/dbraw/zinc/23/25/40/948232540.db2.gz IZXBLFKCVKUDMZ-RUZDIDTESA-N 0 3 404.554 4.170 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)[C@@H]1C[C@H]1c1ccc(OC(F)(F)F)cc1 ZINC000573538055 948236046 /nfs/dbraw/zinc/23/60/46/948236046.db2.gz UCVMQQQKPZKRES-DLBZAZTESA-N 0 3 408.420 4.398 20 0 HIADHN CC(C)N1CC[C@H](NCC(=O)Nc2cc(C(C)(C)C)no2)[C@@H]1c1ccc(F)c(F)c1 ZINC000573573308 948239781 /nfs/dbraw/zinc/23/97/81/948239781.db2.gz WVNFADRNGXGEQZ-UWJYYQICSA-N 0 3 420.504 4.002 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@@H](NCc2ccc(C)cc2N2CCOCC2)c2ccccc21 ZINC000573581369 948241488 /nfs/dbraw/zinc/24/14/88/948241488.db2.gz AFANMQWPMCFWCU-DHIUTWEWSA-N 0 3 408.542 4.103 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)CCc1nc(-c2ccc(Cl)cc2)no1)c1ccco1 ZINC000573593874 948243969 /nfs/dbraw/zinc/24/39/69/948243969.db2.gz WDBAGXHWCWIHAS-WMLDXEAASA-N 0 3 416.909 4.161 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)CCc1nc(-c2ccc(Cl)cc2)no1)c1ccco1 ZINC000573593873 948244171 /nfs/dbraw/zinc/24/41/71/948244171.db2.gz WDBAGXHWCWIHAS-RHSMWYFYSA-N 0 3 416.909 4.161 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)c2cc(O)ccc2C(F)(F)F)N(C)C)cc1 ZINC000573714895 948280616 /nfs/dbraw/zinc/28/06/16/948280616.db2.gz DTSLYHSMBYAFFG-IBGZPJMESA-N 0 3 410.436 4.231 20 0 HIADHN CC(C)Cn1ncc(C(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)c1C1CC1 ZINC000573755122 948290188 /nfs/dbraw/zinc/29/01/88/948290188.db2.gz PDJOTXBCLDTHRK-JOCHJYFZSA-N 0 3 412.578 4.236 20 0 HIADHN CN1CCO[C@H]([C@H](NC[C@H]2CC[C@H](c3ccccc3)O2)c2ccc(Cl)cc2)C1 ZINC000573836751 948306904 /nfs/dbraw/zinc/30/69/04/948306904.db2.gz KCLBMQBYRHMEJH-BXXSPATCSA-N 0 3 400.950 4.222 20 0 HIADHN Cc1cc(C)c(CCNC(=O)CN(C)[C@@H]2CCO[C@H](c3ccc(F)cc3)C2)c(C)c1 ZINC000573845166 948308988 /nfs/dbraw/zinc/30/89/88/948308988.db2.gz ITCLNFICPCJRDQ-VWNXMTODSA-N 0 3 412.549 4.262 20 0 HIADHN C[C@H](Cc1cncc2ccccc21)C(=O)NCC(C)(C)N1CCc2ccccc2C1 ZINC000574062867 948355356 /nfs/dbraw/zinc/35/53/56/948355356.db2.gz DGWOCYSGBKSTCF-LJQANCHMSA-N 0 3 401.554 4.367 20 0 HIADHN Cc1cc(C)c(NC(=O)[C@H](C)N[C@@H]2CCN(C)[C@H]2c2ccc(F)c(F)c2)c(C)c1 ZINC000574122568 948371674 /nfs/dbraw/zinc/37/16/74/948371674.db2.gz YLHWIMNODGXUIV-AQKFKSFVSA-N 0 3 401.501 4.252 20 0 HIADHN CCN(CC(=O)Nc1ccc(Br)cc1Cl)[C@@H]1CCOC(C)(C)C1 ZINC000574203645 948387084 /nfs/dbraw/zinc/38/70/84/948387084.db2.gz YACSGNMCCNGZFG-CYBMUJFWSA-N 0 3 403.748 4.321 20 0 HIADHN CC(C)[C@@H](CNC(=O)[C@@H](C)Cc1cnc2ccccc2n1)N1CCc2ccccc2C1 ZINC000574295453 948404078 /nfs/dbraw/zinc/40/40/78/948404078.db2.gz OGKXLBFKDLWESI-UQBPGWFLSA-N 0 3 416.569 4.008 20 0 HIADHN NC(=O)C1CCN(Cc2cccc(NC(=O)c3ccc(C4=CCCC4)cc3)c2)CC1 ZINC000574557238 948472681 /nfs/dbraw/zinc/47/26/81/948472681.db2.gz LLSQXJQLFLCVCV-UHFFFAOYSA-N 0 3 403.526 4.204 20 0 HIADHN CN1CC[C@H](NC(=O)NC[C@H](Cc2ccccc2)C(F)(F)F)[C@H]1c1ccccc1 ZINC000574614038 948492913 /nfs/dbraw/zinc/49/29/13/948492913.db2.gz BULLGHIEZTWMAB-SLFFLAALSA-N 0 3 405.464 4.152 20 0 HIADHN CC(C)Cc1ccc([C@H](CNC(=O)Cc2ccc(NC(=O)C3CC3)cc2)N(C)C)cc1 ZINC000574711857 948508473 /nfs/dbraw/zinc/50/84/73/948508473.db2.gz CQMUKLPCUDZOIC-DEOSSOPVSA-N 0 3 421.585 4.195 20 0 HIADHN C[C@H]1[C@H](NC(=O)CCc2nc(-c3ccc(Cl)cc3)no2)CCN1Cc1ccccc1 ZINC000574716505 948510050 /nfs/dbraw/zinc/51/00/50/948510050.db2.gz BSACDGFESPLTQI-OXJNMPFZSA-N 0 3 424.932 4.102 20 0 HIADHN CC[C@H](C)C(=O)Nc1cccc(CNC[C@H](O)COc2cc(C)ccc2Cl)c1 ZINC000574726154 948514452 /nfs/dbraw/zinc/51/44/52/948514452.db2.gz USEHDMLMGOAXGL-LPHOPBHVSA-N 0 3 404.938 4.163 20 0 HIADHN CC(C)C(=O)c1ccc([C@H](C)C(=O)NC[C@H]2CN(Cc3ccccc3)CCCO2)cc1 ZINC000574858935 948545280 /nfs/dbraw/zinc/54/52/80/948545280.db2.gz KSXFTZXPESLSLU-RDPSFJRHSA-N 0 3 422.569 4.036 20 0 HIADHN CCN(C(=O)[C@H](C)N[C@H]1CCN(C2CC2)[C@@H]1c1cccc(OC)c1)c1ccccc1 ZINC000574859542 948545567 /nfs/dbraw/zinc/54/55/67/948545567.db2.gz JASBTOQJABQSHR-GKVQRAMASA-N 0 3 407.558 4.004 20 0 HIADHN C[C@@H]1CCCC[C@H]1N(C)C(=O)CNC1(c2cccc(C(F)(F)F)c2)CCOCC1 ZINC000575207072 948629939 /nfs/dbraw/zinc/62/99/39/948629939.db2.gz BHXCHQZSPLMMLX-VQIMIIECSA-N 0 3 412.496 4.338 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N[C@@H]2c3ccccc3CC23CCOCC3)N(C)C)cc1 ZINC000575794623 948718766 /nfs/dbraw/zinc/71/87/66/948718766.db2.gz CQQXUZAIMBTRID-BJKOFHAPSA-N 0 3 421.585 4.245 20 0 HIADHN CSc1cc(Br)ccc1CNCc1ccc(Cn2cncn2)cc1 ZINC000575907089 948774145 /nfs/dbraw/zinc/77/41/45/948774145.db2.gz XIAQVLQLNIPBPN-UHFFFAOYSA-N 0 3 403.349 4.101 20 0 HIADHN FC(F)(c1nc(Cl)cc(Cl)n1)N1CCC[C@H]2CN(Cc3ccccc3)C[C@H]21 ZINC001164623705 719058778 /nfs/dbraw/zinc/05/87/78/719058778.db2.gz KPAKRRMIUQECQE-LSDHHAIUSA-N 0 3 413.299 4.429 20 0 HIADHN FC(F)(c1nc(Cl)cc(Cl)n1)N1CCC[C@@H]2CN(Cc3ccccc3)C[C@@H]21 ZINC001164623702 719058984 /nfs/dbraw/zinc/05/89/84/719058984.db2.gz KPAKRRMIUQECQE-CABCVRRESA-N 0 3 413.299 4.429 20 0 HIADHN Cc1nc(C(F)(F)N2CCC[C@H]3CN(Cc4ccccc4)C[C@@H]32)nc(Cl)c1C ZINC001164621079 719085331 /nfs/dbraw/zinc/08/53/31/719085331.db2.gz GXFQOTUOQOODBS-ROUUACIJSA-N 0 3 406.908 4.393 20 0 HIADHN FC(F)(c1c2c(nnc1Cl)CCC2)N1CCC[C@H]2CN(Cc3ccccc3)C[C@@H]21 ZINC001164630102 719099107 /nfs/dbraw/zinc/09/91/07/719099107.db2.gz VGUQRFRBPPCVPK-LPHOPBHVSA-N 0 3 418.919 4.264 20 0 HIADHN FC1(F)CCN(c2ncccc2CN2CCCC2)C[C@]12CCN(c1ccccc1)C2 ZINC001164827702 720397070 /nfs/dbraw/zinc/39/70/70/720397070.db2.gz HEIJHGFUXHOMBI-HSZRJFAPSA-N 0 3 412.528 4.420 20 0 HIADHN Fc1ccc(-c2ccc(Cl)nn2)c(N2CC[C@H]3[C@@H]2CCN3Cc2cccnc2)c1 ZINC001164727882 720456641 /nfs/dbraw/zinc/45/66/41/720456641.db2.gz FEBQGABTSORZJK-PMACEKPBSA-N 0 3 409.896 4.184 20 0 HIADHN c1cc2c(nc(-c3ccccn3)nc2N2CC[C@@H]3[C@H]2CCN3Cc2cccnc2)s1 ZINC001164730597 720467633 /nfs/dbraw/zinc/46/76/33/720467633.db2.gz UOZXMRXHPBMXME-WOJBJXKFSA-N 0 3 414.538 4.002 20 0 HIADHN c1cc2c(nc(-c3ccccn3)nc2N2CC[C@H]3[C@H]2CCN3Cc2cccnc2)s1 ZINC001164730595 720468963 /nfs/dbraw/zinc/46/89/63/720468963.db2.gz UOZXMRXHPBMXME-VQTJNVASSA-N 0 3 414.538 4.002 20 0 HIADHN FC(F)c1nc2ccc(Cl)cc2c(N2CC[C@H]3[C@H]2CCN3Cc2cccnc2)n1 ZINC001164724341 720469645 /nfs/dbraw/zinc/46/96/45/720469645.db2.gz FCLZPQUNFIHBCA-ZWKOTPCHSA-N 0 3 415.875 4.469 20 0 HIADHN Cc1noc(C)c1CN1CCOC[C@]2(CCCN(c3nc(C)cc4ccccc43)C2)C1 ZINC001164787067 721358577 /nfs/dbraw/zinc/35/85/77/721358577.db2.gz YDVCYFUVHNAKKP-RUZDIDTESA-N 0 3 420.557 4.267 20 0 HIADHN CC(C)COc1cccc(N2CCC(F)(F)[C@]3(CCN(Cc4ccccn4)C3)C2)n1 ZINC001164907342 721718924 /nfs/dbraw/zinc/71/89/24/721718924.db2.gz QZJBWYCYFRBQOU-QFIPXVFZSA-N 0 3 416.516 4.249 20 0 HIADHN CC(C)COc1cccc(N2CCC(F)(F)[C@@]3(CCN(Cc4ccccn4)C3)C2)n1 ZINC001164907340 721719210 /nfs/dbraw/zinc/71/92/10/721719210.db2.gz QZJBWYCYFRBQOU-JOCHJYFZSA-N 0 3 416.516 4.249 20 0 HIADHN Clc1ccc2ccnc(N3CC[C@H]4CN(Cc5cccnc5)CCO[C@H]4C3)c2c1 ZINC001164981106 722110227 /nfs/dbraw/zinc/11/02/27/722110227.db2.gz SOIFAELBPRCCEG-UGKGYDQZSA-N 0 3 408.933 4.011 20 0 HIADHN Clc1cccc2ccc(N3CC[C@H]4CN(Cc5cccnc5)CCO[C@H]4C3)nc12 ZINC001164976496 722110843 /nfs/dbraw/zinc/11/08/43/722110843.db2.gz LSFXSNYCLFPYAN-FPOVZHCZSA-N 0 3 408.933 4.011 20 0 HIADHN Cc1ccc2c(C)cc(N3CC[C@@H]4CN(Cc5cccnc5)CCO[C@@H]4C3)nc2c1C ZINC001164982761 722144100 /nfs/dbraw/zinc/14/41/00/722144100.db2.gz SHXUQSRFTJICBL-ISKFKSNPSA-N 0 3 416.569 4.282 20 0 HIADHN COc1cc(OC)c2ncnc(N3CCC[C@@]4(CCN4Cc4cccc(F)c4)C3)c2c1 ZINC001164998534 722213225 /nfs/dbraw/zinc/21/32/25/722213225.db2.gz WTZDGUOHWWCSTL-XMMPIXPASA-N 0 3 422.504 4.031 20 0 HIADHN CCN1CCC[C@H](NC(=O)N[C@H](CC(F)(F)F)c2ccc(C(F)(F)F)cc2)C1 ZINC000436034751 861326679 /nfs/dbraw/zinc/32/66/79/861326679.db2.gz OWZKFVNUALLRFF-LSDHHAIUSA-N 0 3 411.390 4.482 20 0 HIADHN Cc1cccc2nc(C3CCN(C(=O)NCCN(C)Cc4ccccc4)CC3)oc21 ZINC000436036339 861328635 /nfs/dbraw/zinc/32/86/35/861328635.db2.gz SASUYZZSXUNFET-UHFFFAOYSA-N 0 3 406.530 4.157 20 0 HIADHN COC(=O)[C@H]1CC[C@H](C(=O)N(CCN(C)Cc2ccccc2)Cc2ccccc2)CC1 ZINC000436207263 861509201 /nfs/dbraw/zinc/50/92/01/861509201.db2.gz XCMZWBKMUNSMQD-RQNOJGIXSA-N 0 3 422.569 4.127 20 0 HIADHN CC(C)c1ccc([C@@H](NCC(=O)Nc2ccccc2SCC(N)=O)C(C)C)cc1 ZINC000007804536 845417607 /nfs/dbraw/zinc/41/76/07/845417607.db2.gz NKRQMVBMBJIRHU-QHCPKHFHSA-N 0 3 413.587 4.313 20 0 HIADHN Fc1ccc(Cn2cc(CNCCc3nc(-c4cccc(Cl)c4)no3)cn2)cc1 ZINC000436255654 861567430 /nfs/dbraw/zinc/56/74/30/861567430.db2.gz YKDGUQZXSRAPQL-UHFFFAOYSA-N 0 3 411.868 4.106 20 0 HIADHN CC(C)c1cc(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)c2cnn(C(C)C)c2n1 ZINC000008367090 845519702 /nfs/dbraw/zinc/51/97/02/845519702.db2.gz AJIWFMQKGJAHAO-IBGZPJMESA-N 0 3 405.546 4.140 20 0 HIADHN COc1ccc([C@H](CNC(=O)Cc2nc(C(C)C)c(C)s2)N2CCCC2)cc1 ZINC000436275939 861585661 /nfs/dbraw/zinc/58/56/61/861585661.db2.gz RAIKSTWPZTVQPE-IBGZPJMESA-N 0 3 401.576 4.079 20 0 HIADHN Cc1c([C@H](C)N[C@H]2CC[C@@H](C(=O)N3CCCCC3)C2)nnn1-c1ccc(Cl)cc1 ZINC000436280747 861587960 /nfs/dbraw/zinc/58/79/60/861587960.db2.gz COSNBSSULAKSHK-WDYCEAGBSA-N 0 3 415.969 4.061 20 0 HIADHN C[C@H](NCc1cnn(Cc2ccc(F)cc2)c1)[C@H](OC1CCOCC1)c1ccccc1 ZINC000436294896 861599778 /nfs/dbraw/zinc/59/97/78/861599778.db2.gz PIRPOOFYTYXOEK-DFBJGRDBSA-N 0 3 423.532 4.486 20 0 HIADHN Cc1nn(Cc2ccc(F)cc2)c(Cl)c1C(=O)NC[C@@H](c1ccccc1)N(C)C ZINC000014061965 845922240 /nfs/dbraw/zinc/92/22/40/845922240.db2.gz METPWLAGCWSSJM-IBGZPJMESA-N 0 3 414.912 4.065 20 0 HIADHN Cc1nn(Cc2ccccc2)c2sc(C(=O)NC[C@H](c3ccccc3)N(C)C)cc12 ZINC000014661232 845966746 /nfs/dbraw/zinc/96/67/46/845966746.db2.gz KCEFRWRCCOUUPO-OAQYLSRUSA-N 0 3 418.566 4.487 20 0 HIADHN CCN(CC(=O)Nc1ccc(N2CCN(CC)CC2)cc1)Cc1ccc(Cl)s1 ZINC000015481817 846053251 /nfs/dbraw/zinc/05/32/51/846053251.db2.gz SQEJAGZWOXANAX-UHFFFAOYSA-N 0 3 421.010 4.004 20 0 HIADHN O=C(CN[C@@H](Cc1ccccc1)c1ccccc1)Nc1ccccc1C(=O)NC1CC1 ZINC000019538941 846367269 /nfs/dbraw/zinc/36/72/69/846367269.db2.gz MXPHEICNRILADO-DEOSSOPVSA-N 0 3 413.521 4.091 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)N[C@@H]1C[C@H]1c1c(F)cccc1F ZINC000436354833 861679262 /nfs/dbraw/zinc/67/92/62/861679262.db2.gz RBWAUNYRHHSBEG-YLJYHZDGSA-N 0 3 417.525 4.234 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cnc2onc(C(C)C)c2c1)c1cccc(OC)c1 ZINC000022701000 846607388 /nfs/dbraw/zinc/60/73/88/846607388.db2.gz PALZKHJLDBMFHH-HXUWFJFHSA-N 0 3 410.518 4.168 20 0 HIADHN COc1ccc([C@H](CNC(=O)Cc2csc(-c3ccccc3)n2)N2CCCC2)cc1 ZINC000023485873 846706234 /nfs/dbraw/zinc/70/62/34/846706234.db2.gz GDSYNTSLVFUTRS-QFIPXVFZSA-N 0 3 421.566 4.315 20 0 HIADHN CCO[C@@H]1C[C@](CO)(NCc2cccc(NC(=O)c3ccccc3Cl)c2)C1(C)C ZINC000436377592 861720141 /nfs/dbraw/zinc/72/01/41/861720141.db2.gz IGDDAYRNOOXRKS-NFBKMPQASA-N 0 3 416.949 4.248 20 0 HIADHN CCc1c(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)cnn1-c1ccc(F)cc1 ZINC000024556148 846837555 /nfs/dbraw/zinc/83/75/55/846837555.db2.gz XXPYNKVHOPKCFU-QHCPKHFHSA-N 0 3 406.505 4.141 20 0 HIADHN CN(Cc1cn(-c2ccccc2)nc1-c1ccccc1)C[C@@H](O)COCc1ccco1 ZINC000024591278 846842624 /nfs/dbraw/zinc/84/26/24/846842624.db2.gz IAPKDKHBVVSMIQ-HSZRJFAPSA-N 0 3 417.509 4.142 20 0 HIADHN Cc1nc(Cc2ccc(F)cc2)sc1C(=O)NCCCN1CCc2ccccc2C1 ZINC000025015303 846905889 /nfs/dbraw/zinc/90/58/89/846905889.db2.gz UMFYGQPHPNLNLC-UHFFFAOYSA-N 0 3 423.557 4.360 20 0 HIADHN Cc1ccc(-c2nn(-c3ccc(F)cc3)cc2CNCCNC(=O)c2ccco2)cc1 ZINC000025053801 846912949 /nfs/dbraw/zinc/91/29/49/846912949.db2.gz NHGKKIUTNKZJEL-UHFFFAOYSA-N 0 3 418.472 4.099 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)COc3ccc(Cl)cc3Cl)c(C)c2)CC1 ZINC000025184905 846938021 /nfs/dbraw/zinc/93/80/21/846938021.db2.gz YEBDSCSEZSCULI-UHFFFAOYSA-N 0 3 422.356 4.461 20 0 HIADHN COc1cc(CN[C@@H](C)c2ccc(Cl)cc2)ccc1OCC(=O)N1CCCC1 ZINC000025360919 846966506 /nfs/dbraw/zinc/96/65/06/846966506.db2.gz LGDWISYUUOXUTP-INIZCTEOSA-N 0 3 402.922 4.201 20 0 HIADHN CC(C)[C@H](CNC(=O)c1ccccc1Br)N1CCc2ccccc2C1 ZINC000025535835 846994852 /nfs/dbraw/zinc/99/48/52/846994852.db2.gz YZDFTRREYQQYHO-FQEVSTJZSA-N 0 3 401.348 4.262 20 0 HIADHN CC(C)c1noc2ncc(C(=O)NC[C@@H](C(C)C)N3CCc4ccccc4C3)cc21 ZINC000025539726 846996053 /nfs/dbraw/zinc/99/60/53/846996053.db2.gz ONHGNWRHCQVKFB-NRFANRHFSA-N 0 3 406.530 4.159 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1ccc(F)cc1Br)c1cccc(OC)c1 ZINC000025860921 847046765 /nfs/dbraw/zinc/04/67/65/847046765.db2.gz AJPJVXOWAAYQNX-LJQANCHMSA-N 0 3 423.326 4.410 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1nc(-c2ccccc2)oc1C)c1cccc(OC)c1 ZINC000025858399 847046817 /nfs/dbraw/zinc/04/68/17/847046817.db2.gz ZCRMLFDUYOPZDW-NRFANRHFSA-N 0 3 407.514 4.472 20 0 HIADHN COc1ccc2ccc([O-])c(C[NH+]3CCC(NC(=O)c4ccc(F)cc4)CC3)c2c1 ZINC000026650095 847181138 /nfs/dbraw/zinc/18/11/38/847181138.db2.gz JYBZPMQKROHGEU-UHFFFAOYSA-N 0 3 408.473 4.088 20 0 HIADHN CCN(CCC(=O)Nc1ccc(N2CCCC2=O)cc1)Cc1ccc(Cl)s1 ZINC000026854481 847208353 /nfs/dbraw/zinc/20/83/53/847208353.db2.gz XLFASAMGGBPBFT-UHFFFAOYSA-N 0 3 405.951 4.379 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3ccc(Br)cc3)c(C)c2)CC1 ZINC000026908628 847221247 /nfs/dbraw/zinc/22/12/47/847221247.db2.gz DQJLGJSDSCIBGG-UHFFFAOYSA-N 0 3 402.336 4.152 20 0 HIADHN CCOc1cc(CN[C@@H](C)c2cc(C)sc2C)ccc1O[C@@H](C)C(=O)N(C)C ZINC000027218267 847268859 /nfs/dbraw/zinc/26/88/59/847268859.db2.gz WPWVPVITTCKKNH-HOTGVXAUSA-N 0 3 404.576 4.470 20 0 HIADHN COCCOc1ccc(CN[C@@H](C)c2ccc(Br)s2)cc1OC ZINC000436419346 861775058 /nfs/dbraw/zinc/77/50/58/861775058.db2.gz RGQBEALJIGFCHL-LBPRGKRZSA-N 0 3 400.338 4.395 20 0 HIADHN CN(Cc1ccc(OC(F)(F)F)cc1)C(=O)NCCCN1CCc2ccccc2C1 ZINC000028354168 847410459 /nfs/dbraw/zinc/41/04/59/847410459.db2.gz TYXHSFVBCPDDCN-UHFFFAOYSA-N 0 3 421.463 4.175 20 0 HIADHN C[C@@H](Oc1ccc(Br)cc1)C(=O)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000029177980 847520737 /nfs/dbraw/zinc/52/07/37/847520737.db2.gz HDASUWDYWRVBGD-UZLBHIALSA-N 0 3 417.347 4.170 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)c1cnn(Cc2ccccc2Cl)c1 ZINC000029179025 847521877 /nfs/dbraw/zinc/52/18/77/847521877.db2.gz RIWCPYWQWWPTKG-QFIPXVFZSA-N 0 3 408.933 4.152 20 0 HIADHN O=C(CCc1ncc(-c2ccccc2F)o1)N[C@H](CN1CCCC1)c1ccccc1 ZINC000029179224 847522104 /nfs/dbraw/zinc/52/21/04/847522104.db2.gz OYYBTJZHNHRKSV-OAQYLSRUSA-N 0 3 407.489 4.367 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)CCC(=O)c3ccc(C)c(C)c3)c(C)c2)CC1 ZINC000029376719 847555635 /nfs/dbraw/zinc/55/56/35/847555635.db2.gz YTKRLQXYZAHUQW-UHFFFAOYSA-N 0 3 407.558 4.355 20 0 HIADHN CN1CCN(CCCNC(=O)Cc2ccc(Cl)c(Cl)c2)[C@@H](c2ccccc2)C1 ZINC000030000175 847667742 /nfs/dbraw/zinc/66/77/42/847667742.db2.gz UPQLMPNQSYZHGX-OAQYLSRUSA-N 0 3 420.384 4.031 20 0 HIADHN Cc1ccccc1CN1CCCN(CC(=O)Nc2c(Cl)cccc2Cl)CC1 ZINC000030153700 847683963 /nfs/dbraw/zinc/68/39/63/847683963.db2.gz UXTMRQDNVFZZLM-UHFFFAOYSA-N 0 3 406.357 4.448 20 0 HIADHN COc1ccc(CNCc2ccc(N3CCCC3=O)cc2)cc1OCc1cccnc1 ZINC000030628554 847747217 /nfs/dbraw/zinc/74/72/17/847747217.db2.gz MBXDAGGMHQJSIE-UHFFFAOYSA-N 0 3 417.509 4.086 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2ccc3c(c2)CN(CC(F)F)C3)N(C)C)cc1 ZINC000436499581 861825806 /nfs/dbraw/zinc/82/58/06/861825806.db2.gz XPZTZEHKUUPKKO-HXUWFJFHSA-N 0 3 402.489 4.000 20 0 HIADHN CC1CCN([C@@H](CNC(=O)NCc2ccc(N(C)C)cc2)c2cccs2)CC1 ZINC000031726849 847938985 /nfs/dbraw/zinc/93/89/85/847938985.db2.gz YSVRRVSQDQMCKZ-FQEVSTJZSA-N 0 3 400.592 4.087 20 0 HIADHN Cc1ccccc1CN1CCCN(C(=O)c2c[nH]nc2-c2ccc(Cl)cc2)CC1 ZINC000031765632 847944344 /nfs/dbraw/zinc/94/43/44/847944344.db2.gz ALSPMAXPRXVWAF-UHFFFAOYSA-N 0 3 408.933 4.387 20 0 HIADHN CCOc1c(Cl)cc(C(=O)N2CCCN(Cc3ccccc3C)CC2)cc1OC ZINC000031766839 847946139 /nfs/dbraw/zinc/94/61/39/847946139.db2.gz YBRFQKKANCSVKX-UHFFFAOYSA-N 0 3 416.949 4.404 20 0 HIADHN CCN(CC)[C@H](CNC(=O)COCc1nc2ccccc2s1)c1ccsc1 ZINC000031986520 847975838 /nfs/dbraw/zinc/97/58/38/847975838.db2.gz RGNFBNJDOCBDJO-QGZVFWFLSA-N 0 3 403.573 4.074 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)C34CC5CC(CC(C5)C3)C4)CC2)c1 ZINC000032067699 847984941 /nfs/dbraw/zinc/98/49/41/847984941.db2.gz NRQILDVEFRMTLN-UHFFFAOYSA-N 0 3 409.618 4.230 20 0 HIADHN COc1ccc(-c2nc(C)c(C(=O)NC[C@@H](Cc3ccccc3)N(C)C)s2)cc1 ZINC000032245747 847994160 /nfs/dbraw/zinc/99/41/60/847994160.db2.gz DQPAHMNNQSFDSQ-LJQANCHMSA-N 0 3 409.555 4.030 20 0 HIADHN CCc1ccc([C@H](CNC(=O)c2c(C)nn(-c3ccc(F)cc3)c2C)N(C)C)cc1 ZINC000032733660 848069287 /nfs/dbraw/zinc/06/92/87/848069287.db2.gz HLSDWISXZSIPDA-QFIPXVFZSA-N 0 3 408.521 4.223 20 0 HIADHN COc1ccc([C@@H]2CCCN2C[C@@H](O)CO[C@@H]2CCCc3ccccc32)c(OC)c1 ZINC000032774412 848073478 /nfs/dbraw/zinc/07/34/78/848073478.db2.gz LQIXLGBQKGHEAG-VEXUSMLFSA-N 0 3 411.542 4.296 20 0 HIADHN O=C(c1cc(CCc2ccccc2)ccc1[O-])N1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000436599371 861864231 /nfs/dbraw/zinc/86/42/31/861864231.db2.gz AVGQPUIXBJVDFF-QPPBQGQZSA-N 0 3 404.554 4.266 20 0 HIADHN O=C(c1cc(CCc2ccccc2)ccc1[O-])N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000436599371 861864232 /nfs/dbraw/zinc/86/42/32/861864232.db2.gz AVGQPUIXBJVDFF-QPPBQGQZSA-N 0 3 404.554 4.266 20 0 HIADHN C[C@H](Oc1ccc(Br)cc1)C(=O)NC[C@H](c1ccccc1)N1CCCC1 ZINC000036883711 848171577 /nfs/dbraw/zinc/17/15/77/848171577.db2.gz OSRAZGJCVKQBAL-OXJNMPFZSA-N 0 3 417.347 4.170 20 0 HIADHN Cc1ccccc1CN1CCCN(C(=O)Cc2csc(-c3cccs3)n2)CC1 ZINC000041315435 848210943 /nfs/dbraw/zinc/21/09/43/848210943.db2.gz BPFUWJAIKJCBBC-UHFFFAOYSA-N 0 3 411.596 4.457 20 0 HIADHN Cc1ccc(-n2cnnc2SCC(=O)C(C#N)c2nc3ccccc3s2)cc1 ZINC000041500607 848222076 /nfs/dbraw/zinc/22/20/76/848222076.db2.gz HUPVHQPPRQRNNQ-OAHLLOKOSA-N 0 3 405.508 4.154 20 0 HIADHN N#CC(C(=O)C[C@H](NC(=O)c1ccccc1)c1ccccc1)c1nc2ccccc2[nH]1 ZINC000041497890 848222344 /nfs/dbraw/zinc/22/23/44/848222344.db2.gz LNJCLLIBTMJKMI-KNQAVFIVSA-N 0 3 408.461 4.301 20 0 HIADHN Cc1nc2c3ccccc3nn2c(C)c1CCC(=O)C(C#N)c1nc2ccccc2o1 ZINC000041542320 848228312 /nfs/dbraw/zinc/22/83/12/848228312.db2.gz TZAYJOHBLHCSOL-SFHVURJKSA-N 0 3 409.449 4.450 20 0 HIADHN CCOc1ccc(-c2noc(CCC(=O)C(C#N)c3nc4ccccc4o3)n2)cc1 ZINC000041540138 848229060 /nfs/dbraw/zinc/22/90/60/848229060.db2.gz CEXIJEGDUOOLBL-INIZCTEOSA-N 0 3 402.410 4.086 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)c3cc(SC)ccc3Cl)cc2)CC1 ZINC000041666632 848238025 /nfs/dbraw/zinc/23/80/25/848238025.db2.gz DFJJYULTEPRVSS-UHFFFAOYSA-N 0 3 403.979 4.452 20 0 HIADHN Cc1ccccc1CN1CCC(NC(=O)CCC(=O)c2ccc3c(c2)CCC3)CC1 ZINC000042127279 848290029 /nfs/dbraw/zinc/29/00/29/848290029.db2.gz ONFQKDCUVPVZMM-UHFFFAOYSA-N 0 3 404.554 4.227 20 0 HIADHN COc1ccc(CN[C@@H](C)c2ccc3c(c2)OCCO3)cc1OCc1cccnc1 ZINC000042186435 848298404 /nfs/dbraw/zinc/29/84/04/848298404.db2.gz QVMOPYPKYGAWAX-KRWDZBQOSA-N 0 3 406.482 4.291 20 0 HIADHN COc1cc(CN[C@H](C)c2ccc3c(c2)OCO3)ccc1OCc1c(C)noc1C ZINC000042203058 848300126 /nfs/dbraw/zinc/30/01/26/848300126.db2.gz IVOTUOOUUYVFAG-CQSZACIVSA-N 0 3 410.470 4.459 20 0 HIADHN COc1cc(CNCc2ccc(Cn3ccnc3)cc2)ccc1OCc1ccncc1 ZINC000042228100 848305921 /nfs/dbraw/zinc/30/59/21/848305921.db2.gz XLOCXEIJCXRFQX-UHFFFAOYSA-N 0 3 414.509 4.204 20 0 HIADHN O[C@@H](COc1c(Cl)cccc1Cl)CN1CCC([C@@H](O)c2ccccc2)CC1 ZINC000042635036 848334584 /nfs/dbraw/zinc/33/45/84/848334584.db2.gz XRFQUUGIZMLDRI-XLIONFOSSA-N 0 3 410.341 4.179 20 0 HIADHN CCCNC(=O)C1CC[NH+](Cc2c([O-])ccc3cc(Br)ccc32)CC1 ZINC000042674933 848343302 /nfs/dbraw/zinc/34/33/02/848343302.db2.gz QUDWHRCYWISZCG-UHFFFAOYSA-N 0 3 405.336 4.046 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N(C)CCCOc3ccccc3)c(C)c2)CC1 ZINC000043522069 848435017 /nfs/dbraw/zinc/43/50/17/848435017.db2.gz DAYXAEBOIPQJJU-UHFFFAOYSA-N 0 3 410.562 4.070 20 0 HIADHN CC(C)C(=O)Nc1ccc(NC(=O)NC[C@H](c2cccs2)N2CCCC2)cc1 ZINC000043675122 848449469 /nfs/dbraw/zinc/44/94/69/848449469.db2.gz RHOMGQZLVGHUND-GOSISDBHSA-N 0 3 400.548 4.301 20 0 HIADHN Cc1cc([C@@H](C)[NH2+]C2CCN(C(=O)c3ccccc3[O-])CC2)sc1Br ZINC000436720996 861907011 /nfs/dbraw/zinc/90/70/11/861907011.db2.gz KTZDNPPBHMCHSI-CYBMUJFWSA-N 0 3 423.376 4.480 20 0 HIADHN CCN(Cc1ccccc1NC(=O)NC[C@@H](c1ccsc1)N(CC)CC)C(C)=O ZINC000044383908 848554855 /nfs/dbraw/zinc/55/48/55/848554855.db2.gz IRLVVDFXKBVXQH-NRFANRHFSA-N 0 3 416.591 4.321 20 0 HIADHN O=C(COc1ccc(Oc2ccccn2)cc1)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000044670068 848590666 /nfs/dbraw/zinc/59/06/66/848590666.db2.gz QJIGDEVKILAXHT-QHCPKHFHSA-N 0 3 417.509 4.206 20 0 HIADHN Cc1noc(C)c1CSCC(=O)N[C@@H](CN1CCc2ccccc2C1)C(C)(C)C ZINC000044770294 848600115 /nfs/dbraw/zinc/60/01/15/848600115.db2.gz MFBHQZXFHPTRCJ-NRFANRHFSA-N 0 3 415.603 4.114 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1c(C)nn(C(C)(C)C)c1C)c1cccc(OC)c1 ZINC000045056292 848628876 /nfs/dbraw/zinc/62/88/76/848628876.db2.gz GZZAOCQCQWSOSO-HXUWFJFHSA-N 0 3 400.567 4.076 20 0 HIADHN COc1cccc(Oc2ccc(CNC(=O)Nc3cccc(CN(C)C)c3)cn2)c1 ZINC000045988522 848766620 /nfs/dbraw/zinc/76/66/20/848766620.db2.gz QOKOQRSSFCYELX-UHFFFAOYSA-N 0 3 406.486 4.266 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@H](C)c1ccc2c(c1)CCC(=O)N2)c1ccsc1 ZINC000046253837 848811931 /nfs/dbraw/zinc/81/19/31/848811931.db2.gz HWRPPERRXCODTL-FOIQADDNSA-N 0 3 414.575 4.076 20 0 HIADHN C[C@@H](c1nc2ccccc2s1)N(C)C(=O)NCCCN1CCc2ccccc2C1 ZINC000046428631 848846813 /nfs/dbraw/zinc/84/68/13/848846813.db2.gz MMJIKRWJDLCHSJ-KRWDZBQOSA-N 0 3 408.571 4.447 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N[C@H](C)c3cc(F)ccc3OC)c(C)c2)CC1 ZINC000046984954 848967398 /nfs/dbraw/zinc/96/73/98/848967398.db2.gz IYMQWQQUDGQPCE-QGZVFWFLSA-N 0 3 414.525 4.167 20 0 HIADHN N#CC(C(=O)CCNC(=O)C12CC3CC(CC(C3)C1)C2)c1ccc2ccccc2n1 ZINC000047375145 849034278 /nfs/dbraw/zinc/03/42/78/849034278.db2.gz UKGGOZQOXIOZSA-YZOPDKEQSA-N 0 3 401.510 4.134 20 0 HIADHN N#CC(C(=O)CCNC(=O)NC12CC3CC(CC(C3)C1)C2)c1ccc2ccccc2n1 ZINC000047376460 849034970 /nfs/dbraw/zinc/03/49/70/849034970.db2.gz CQDWYECWOQCBRT-JQZCCEMDSA-N 0 3 416.525 4.069 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)N[C@@H](c1ccccc1)c1ccccn1 ZINC000047950480 849144123 /nfs/dbraw/zinc/14/41/23/849144123.db2.gz ACFTXAOIFKLJJM-UNMCSNQZSA-N 0 3 406.555 4.369 20 0 HIADHN CC(C)CC(=O)Nc1ccc(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2)cc1 ZINC000048073591 849159567 /nfs/dbraw/zinc/15/95/67/849159567.db2.gz ZNWNJEPSXUISGA-UHFFFAOYSA-N 0 3 414.525 4.406 20 0 HIADHN Cc1ccc(C(=O)N(Cc2ccccc2Br)C2CC[NH+](C)CC2)c([O-])c1 ZINC000436793291 861986844 /nfs/dbraw/zinc/98/68/44/861986844.db2.gz KFENJQULCMRHLE-UHFFFAOYSA-N 0 3 417.347 4.200 20 0 HIADHN Cc1ccc(NC(=O)C(C)C)cc1NC(=O)NCCCN1CCc2ccccc2C1 ZINC000048255446 849198842 /nfs/dbraw/zinc/19/88/42/849198842.db2.gz LMKWVZJBUCFYPR-UHFFFAOYSA-N 0 3 408.546 4.159 20 0 HIADHN CCN1CCC[C@H]1CNC(=O)c1sc(NC(=O)c2ccccc2Cl)cc1C ZINC000048361266 849211954 /nfs/dbraw/zinc/21/19/54/849211954.db2.gz QFUAZJIZBFLEGK-AWEZNQCLSA-N 0 3 405.951 4.176 20 0 HIADHN C[C@@H](NCc1ccc(OC(F)(F)F)cc1)c1ccc(OCC(=O)NC2CC2)cc1 ZINC000048744891 849261528 /nfs/dbraw/zinc/26/15/28/849261528.db2.gz JACVPSTVZYKTIT-CQSZACIVSA-N 0 3 408.420 4.093 20 0 HIADHN COc1cccc(OC)c1Oc1ccc(CNCc2ccc(-n3ccnc3)cc2)cn1 ZINC000048749662 849264315 /nfs/dbraw/zinc/26/43/15/849264315.db2.gz BPQCXXVZEPZRIB-UHFFFAOYSA-N 0 3 416.481 4.367 20 0 HIADHN Cc1cc(CN[C@H](C)c2ccc(S(=O)(=O)N(C)C)cc2)cc(C)c1OC(F)F ZINC000048780414 849266855 /nfs/dbraw/zinc/26/68/55/849266855.db2.gz XXFLUZRIEFJVPR-OAHLLOKOSA-N 0 3 412.502 4.006 20 0 HIADHN Cc1nn(Cc2ccc(Cl)cc2Cl)c(Cl)c1CNCCc1cnn(C)c1 ZINC000048784590 849268219 /nfs/dbraw/zinc/26/82/19/849268219.db2.gz ZSOQFVYTHBIGKG-UHFFFAOYSA-N 0 3 412.752 4.266 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2CNCc2cc(Cl)c3c(c2)OCCO3)C[C@@H](C)O1 ZINC000048816705 849270236 /nfs/dbraw/zinc/27/02/36/849270236.db2.gz CFLUMCQGISLKMW-IAGOWNOFSA-N 0 3 416.949 4.010 20 0 HIADHN CCNC(=O)c1cccc(CNCc2cc(OC)c(OC)cc2-c2ccccc2)c1 ZINC000048816381 849270613 /nfs/dbraw/zinc/27/06/13/849270613.db2.gz ZOOUZWCGBNOXFS-UHFFFAOYSA-N 0 3 404.510 4.410 20 0 HIADHN CC(C)[C@H](NC(=O)OCc1ccccc1)C(=O)C(C#N)c1nc2ccccc2s1 ZINC000048822801 849271731 /nfs/dbraw/zinc/27/17/31/849271731.db2.gz NDLAZPOKSMGHRR-LPHOPBHVSA-N 0 3 407.495 4.424 20 0 HIADHN CCNC(=O)c1ccc(NC(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)cc1 ZINC000049790164 849329914 /nfs/dbraw/zinc/32/99/14/849329914.db2.gz NGFKPXJBQMMEFA-IBGZPJMESA-N 0 3 414.575 4.093 20 0 HIADHN Cc1cc([C@@H]2CCCN2C(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)on1 ZINC000049790441 849330367 /nfs/dbraw/zinc/33/03/67/849330367.db2.gz OYZBXCJUXIXDST-ROUUACIJSA-N 0 3 402.564 4.364 20 0 HIADHN CCCCN(C)C(=O)C1CCN(C[C@@H](O)COc2ccc(C(C)(C)C)cc2C)CC1 ZINC000052186503 849559552 /nfs/dbraw/zinc/55/95/52/849559552.db2.gz VSXGIOJDOBLLED-JOCHJYFZSA-N 0 3 418.622 4.003 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)[C@H](C)Sc1ccc(NC(C)=O)cc1)c1ccsc1 ZINC000052877959 849638864 /nfs/dbraw/zinc/63/88/64/849638864.db2.gz ZKDJWUGQVMSGHT-YWZLYKJASA-N 0 3 419.616 4.386 20 0 HIADHN Cc1sc2ncnc(SCCC(=O)Nc3ccccc3CN(C)C)c2c1C ZINC000053476437 849718151 /nfs/dbraw/zinc/71/81/51/849718151.db2.gz PJJZCANQURQQJF-UHFFFAOYSA-N 0 3 400.573 4.491 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)N1CCC(OCc2ccccc2)CC1 ZINC000053540924 849728676 /nfs/dbraw/zinc/72/86/76/849728676.db2.gz AFMFZPZXDFFUHU-DEOSSOPVSA-N 0 3 407.558 4.214 20 0 HIADHN CCN(Cc1ccc(N(C)C)cc1)C(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000053548392 849730930 /nfs/dbraw/zinc/73/09/30/849730930.db2.gz IRJFLZYLFLPTNO-HXUWFJFHSA-N 0 3 400.592 4.183 20 0 HIADHN CC(C)(C)[C@@H](NCC(=O)NC1CCN(C(=O)C2CCCCC2)CC1)c1ccccc1 ZINC000053616780 849737726 /nfs/dbraw/zinc/73/77/26/849737726.db2.gz ZPKJFIWIDBQBFE-QHCPKHFHSA-N 0 3 413.606 4.051 20 0 HIADHN CCNc1nnc(SCC(=O)C(C#N)c2nc(-c3ccccc3)cs2)s1 ZINC000054169241 849819538 /nfs/dbraw/zinc/81/95/38/849819538.db2.gz CICHANDJSAYSJB-GFCCVEGCSA-N 0 3 401.542 4.062 20 0 HIADHN CC(C)OCCCNC(=O)C1CCN(Cc2ccc(Cl)c3cccnc23)CC1 ZINC000054316961 849846781 /nfs/dbraw/zinc/84/67/81/849846781.db2.gz BEDVLPMGSGETIG-UHFFFAOYSA-N 0 3 403.954 4.032 20 0 HIADHN CC(C)OCCCNC(=O)C1CCN(Cc2c(Cl)ccc3cccnc32)CC1 ZINC000054316962 849846921 /nfs/dbraw/zinc/84/69/21/849846921.db2.gz BGODTHVYVUIUMU-UHFFFAOYSA-N 0 3 403.954 4.032 20 0 HIADHN Cc1cccc(C)c1NC(=O)CNC1(c2ccc(Br)cc2)CCOCC1 ZINC000054394267 849859395 /nfs/dbraw/zinc/85/93/95/849859395.db2.gz REKLIESGQKKNSJ-UHFFFAOYSA-N 0 3 417.347 4.300 20 0 HIADHN COc1ccc(OC(F)F)c(NC(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)c1 ZINC000054410551 849862480 /nfs/dbraw/zinc/86/24/80/849862480.db2.gz OMEWQTHDURRHNU-ZBFHGGJFSA-N 0 3 405.445 4.254 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)c1cccc(Cl)c1Cl ZINC000054573169 849890435 /nfs/dbraw/zinc/89/04/35/849890435.db2.gz IFSMXTUVEWWUQF-UHFFFAOYSA-N 0 3 406.357 4.326 20 0 HIADHN CCCC(=O)Nc1ccc(CNC(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)cc1 ZINC000054717972 849912065 /nfs/dbraw/zinc/91/20/65/849912065.db2.gz UCBFVEIGTYKHHG-PGRDOPGGSA-N 0 3 408.546 4.060 20 0 HIADHN C[C@H](NC(=O)NCCN(C)Cc1ccccc1)c1cccc(OCc2ccccn2)c1 ZINC000054761372 849918937 /nfs/dbraw/zinc/91/89/37/849918937.db2.gz FMOBTGKCOLSBJF-FQEVSTJZSA-N 0 3 418.541 4.153 20 0 HIADHN CCCNC(=O)CCNCc1cccc(NC(=O)c2ccc(Cl)cc2Cl)c1 ZINC000055175459 849982202 /nfs/dbraw/zinc/98/22/02/849982202.db2.gz YWHCSFSEAWQNLZ-UHFFFAOYSA-N 0 3 408.329 4.252 20 0 HIADHN CC(=O)c1ccc(NC(=O)N(CCN(C)C)Cc2ccc(Br)cc2)cc1 ZINC000056515957 850381634 /nfs/dbraw/zinc/38/16/34/850381634.db2.gz XRGGIZICEDKJES-UHFFFAOYSA-N 0 3 418.335 4.247 20 0 HIADHN CCN(CC)C(=O)c1ccccc1NC(=O)NC[C@H](c1ccsc1)N(CC)CC ZINC000056623657 850419012 /nfs/dbraw/zinc/41/90/12/850419012.db2.gz IGGUQCJWVNOMMR-HXUWFJFHSA-N 0 3 416.591 4.435 20 0 HIADHN CC(=O)Nc1ccc(Cl)c(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2)c1 ZINC000056691823 850440742 /nfs/dbraw/zinc/44/07/42/850440742.db2.gz JCQKIFYVMWTTKZ-UHFFFAOYSA-N 0 3 406.889 4.033 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)Nc2cc(NC(C)=O)ccc2Cl)N(C)C)cc1 ZINC000056693107 850442175 /nfs/dbraw/zinc/44/21/75/850442175.db2.gz FOZPYQGVAIYMSM-HXUWFJFHSA-N 0 3 402.926 4.285 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1ccc(-c2csnn2)cc1)c1ccsc1 ZINC000056787620 850482073 /nfs/dbraw/zinc/48/20/73/850482073.db2.gz QOHCWZJKKOBBNP-SFHVURJKSA-N 0 3 401.561 4.471 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)N[C@@H](c1ccccc1)c1ccccn1 ZINC000056797061 850485915 /nfs/dbraw/zinc/48/59/15/850485915.db2.gz SDXQJYJOMUKWHB-QHCPKHFHSA-N 0 3 406.505 4.084 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)C1(c2ccc(Cl)cc2)CCOCC1 ZINC000057192604 850576487 /nfs/dbraw/zinc/57/64/87/850576487.db2.gz UTRJKWLZRNIQKM-LJQANCHMSA-N 0 3 418.990 4.403 20 0 HIADHN CN(C)[C@H](CNC(=O)Nc1cccc(NC(=O)c2ccccc2)c1)c1ccccc1 ZINC000057779449 850712155 /nfs/dbraw/zinc/71/21/55/850712155.db2.gz NHFXKNNGAKGRNR-JOCHJYFZSA-N 0 3 402.498 4.363 20 0 HIADHN Cc1cc2oc(=O)cc(CN3CCC(C(=O)N4CCCCC4)CC3)c2cc1C(C)C ZINC000057886423 850737678 /nfs/dbraw/zinc/73/76/78/850737678.db2.gz PIYCCBOBFQVBQH-UHFFFAOYSA-N 0 3 410.558 4.449 20 0 HIADHN CCCCc1ccc(NC(=S)Nc2ccc3oc(=O)n(CCN(C)C)c3c2)cc1 ZINC000058467875 850832890 /nfs/dbraw/zinc/83/28/90/850832890.db2.gz FWLHGCLMPYBDJU-UHFFFAOYSA-N 0 3 412.559 4.308 20 0 HIADHN O=C(NCCCCN1CCN(Cc2ccccc2)CC1)c1[nH]c2ccccc2c1Cl ZINC000058471642 850833423 /nfs/dbraw/zinc/83/34/23/850833423.db2.gz ROOWXQKDJQIRBT-UHFFFAOYSA-N 0 3 424.976 4.149 20 0 HIADHN CC[C@H](c1ccccc1)[C@@H]1CCCN1CC(=O)Nc1cccc(N2CCCC2=O)c1 ZINC000058524061 850845213 /nfs/dbraw/zinc/84/52/13/850845213.db2.gz HQKWDVSMQFVPMX-PKTZIBPZSA-N 0 3 405.542 4.410 20 0 HIADHN CCOC(=O)C1CCN(C(=O)[C@@H](C)N2CCC(c3cccc4ccccc43)CC2)CC1 ZINC000058525095 850846414 /nfs/dbraw/zinc/84/64/14/850846414.db2.gz OSPGMLOAEDNBRT-LJQANCHMSA-N 0 3 422.569 4.209 20 0 HIADHN C[C@@H](Sc1nc2ccc(Cl)cc2[nH]1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000058593208 850864174 /nfs/dbraw/zinc/86/41/74/850864174.db2.gz AGWGIIJOKJLKCQ-PBHICJAKSA-N 0 3 414.962 4.088 20 0 HIADHN CN(C)CCn1c2cc(NC(=O)CSc3ccc4ccccc4c3)ccc2oc1=O ZINC000058739115 850908876 /nfs/dbraw/zinc/90/88/76/850908876.db2.gz XIHUHLWOUQYWAT-UHFFFAOYSA-N 0 3 421.522 4.040 20 0 HIADHN O=C(CCN1CCCC[C@H]1CNC(=O)Nc1ccccc1)Nc1ccccc1Cl ZINC000058754131 850912744 /nfs/dbraw/zinc/91/27/44/850912744.db2.gz ANLXFUUROSEWCO-SFHVURJKSA-N 0 3 414.937 4.345 20 0 HIADHN CCN(CC)C(=O)c1ccc(NC(=O)NC[C@H](c2cccs2)N2CCCC2)cc1 ZINC000058864105 850946846 /nfs/dbraw/zinc/94/68/46/850946846.db2.gz SPZMIQNQFCAQBA-LJQANCHMSA-N 0 3 414.575 4.189 20 0 HIADHN O=C(Nc1cccnc1)c1ccc(OC(=O)[C@@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000058874658 850949276 /nfs/dbraw/zinc/94/92/76/850949276.db2.gz PDWBWIGWTIKFOR-OAQYLSRUSA-N 0 3 415.493 4.152 20 0 HIADHN CCCCCOc1ccc(C(=O)CCC(=O)N2CCC[C@H](N3CCCC3)C2)cc1 ZINC000058920054 850958296 /nfs/dbraw/zinc/95/82/96/850958296.db2.gz YWGXPWRMNNHDFL-NRFANRHFSA-N 0 3 400.563 4.305 20 0 HIADHN CCCOc1c(Cl)cc(C(=O)N(CCN(C)C)Cc2ccc(F)cc2)cc1OC ZINC000059002087 850976262 /nfs/dbraw/zinc/97/62/62/850976262.db2.gz XYKHSURQQOJYTH-UHFFFAOYSA-N 0 3 422.928 4.481 20 0 HIADHN CCOC(=O)/C=C/c1ccc(NC(=O)NC[C@@H](c2ccccc2)N2CCCC2)cc1 ZINC000059039869 850982266 /nfs/dbraw/zinc/98/22/66/850982266.db2.gz QGWNHAACFPUFDC-GLBTYYSXSA-N 0 3 407.514 4.222 20 0 HIADHN CCCOC(=O)c1ccc(NC(=O)NC[C@H](c2cccs2)N2CCCC2)cc1 ZINC000059039240 850982276 /nfs/dbraw/zinc/98/22/76/850982276.db2.gz XQXKXMAYMVKNHS-GOSISDBHSA-N 0 3 401.532 4.274 20 0 HIADHN CCCN(CC(=O)Nc1cccc(C(=O)N(CC)CC)c1)[C@H]1CCc2ccccc2C1 ZINC000060039724 851034178 /nfs/dbraw/zinc/03/41/78/851034178.db2.gz KLYWZGOZJXWCKT-DEOSSOPVSA-N 0 3 421.585 4.377 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2cnn(-c3ccc(F)cc3)c2C(C)C)N(C)C)cc1 ZINC000060155794 851045502 /nfs/dbraw/zinc/04/55/02/851045502.db2.gz LYMMHCXBCWNWMK-QFIPXVFZSA-N 0 3 408.521 4.476 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)c1csc(-c2ccccc2)n1 ZINC000060168011 851048066 /nfs/dbraw/zinc/04/80/66/851048066.db2.gz AJURESQQMLIIHT-UHFFFAOYSA-N 0 3 401.482 4.292 20 0 HIADHN Cc1cc(NC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)ccc1N(C)C ZINC000060350679 851072954 /nfs/dbraw/zinc/07/29/54/851072954.db2.gz OFMFLTHLDLCQOS-NRFANRHFSA-N 0 3 405.464 4.454 20 0 HIADHN O=C(c1cccc(Br)c1)N1CCCN(CCCc2ccccc2)CC1 ZINC000060355415 851076003 /nfs/dbraw/zinc/07/60/03/851076003.db2.gz IAFQDBWGSZTMAN-UHFFFAOYSA-N 0 3 401.348 4.230 20 0 HIADHN C[C@@H]1C[C@H]1C(=O)Nc1cccc(C(=O)N2CCCN(CCCc3ccccc3)CC2)c1 ZINC000060355326 851076038 /nfs/dbraw/zinc/07/60/38/851076038.db2.gz VFGJVUHXNXKGLI-HYBUGGRVSA-N 0 3 419.569 4.062 20 0 HIADHN COc1ccc2cc(C(=O)N3CCCN(CCCc4ccccc4)CC3)c(C)nc2c1 ZINC000060355384 851076182 /nfs/dbraw/zinc/07/61/82/851076182.db2.gz NQCQUGIMTONEHL-UHFFFAOYSA-N 0 3 417.553 4.333 20 0 HIADHN CN(C)[C@H](CNC(=O)CCc1nc2ccccc2n1-c1ccccc1)c1ccccc1 ZINC000060392276 851086641 /nfs/dbraw/zinc/08/66/41/851086641.db2.gz YXRKEBAVSZHIOD-XMMPIXPASA-N 0 3 412.537 4.377 20 0 HIADHN O=C(NCCNCc1cn(-c2ccccc2)nc1-c1cccs1)c1ccccc1F ZINC000060527291 851134849 /nfs/dbraw/zinc/13/48/49/851134849.db2.gz VPOCQOXKXPVKFH-UHFFFAOYSA-N 0 3 420.513 4.260 20 0 HIADHN O=C(NCCNCc1cn(-c2ccccc2)nc1-c1ccccc1)c1ccccc1F ZINC000060527293 851135122 /nfs/dbraw/zinc/13/51/22/851135122.db2.gz PYJKJKODUZVGCZ-UHFFFAOYSA-N 0 3 414.484 4.198 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)CCC(=O)c3ccc(C)c(C)c3)cc2)CC1 ZINC000060551838 851144089 /nfs/dbraw/zinc/14/40/89/851144089.db2.gz CISQCBLMFXJVFF-UHFFFAOYSA-N 0 3 407.558 4.043 20 0 HIADHN Cc1nc(COc2cccc(C(=O)N3CCN(CC4CCCCC4)CC3)c2)cs1 ZINC000060579330 851154328 /nfs/dbraw/zinc/15/43/28/851154328.db2.gz LRFYHMXNOHOEQO-UHFFFAOYSA-N 0 3 413.587 4.369 20 0 HIADHN CC[C@@H](CNC(=O)N(C)CCCc1ccc(OC)cc1)N1CCc2ccccc2C1 ZINC000060610058 851165145 /nfs/dbraw/zinc/16/51/45/851165145.db2.gz SSZRHKUEDOWPGW-QHCPKHFHSA-N 0 3 409.574 4.106 20 0 HIADHN O[C@H](CNCc1ccccc1OCc1cccnc1)c1ccc(OC(F)(F)F)cc1 ZINC000060952966 851256374 /nfs/dbraw/zinc/25/63/74/851256374.db2.gz SRLSBFRPNVTLEN-HXUWFJFHSA-N 0 3 418.415 4.382 20 0 HIADHN O[C@H](CNCc1cnn(-c2ccc(Cl)cc2)c1)c1ccc(OC(F)(F)F)cc1 ZINC000060952990 851256914 /nfs/dbraw/zinc/25/69/14/851256914.db2.gz HAYGWITWPYNVPM-GOSISDBHSA-N 0 3 411.811 4.248 20 0 HIADHN Cc1nn(Cc2ccc(F)cc2)c(Cl)c1CNC[C@H](c1ccccc1)N(C)C ZINC000061012474 851272356 /nfs/dbraw/zinc/27/23/56/851272356.db2.gz NHIDFRUYYRUVTR-OAQYLSRUSA-N 0 3 400.929 4.425 20 0 HIADHN Cc1nn(Cc2ccc(C)cc2)c(Cl)c1CNCCCN1CCCCCC1=O ZINC000061014557 851273289 /nfs/dbraw/zinc/27/32/89/851273289.db2.gz AOAXIEKSBFWZHY-UHFFFAOYSA-N 0 3 402.970 4.084 20 0 HIADHN CC1CCN([C@H](CNC(=O)NC[C@@H]2COc3ccccc3C2)c2cccs2)CC1 ZINC000061191542 851313973 /nfs/dbraw/zinc/31/39/73/851313973.db2.gz PEDXQXISCZHCSD-UYAOXDASSA-N 0 3 413.587 4.072 20 0 HIADHN CCCC(=O)Nc1cccc(CNC(=O)NC[C@@H](c2ccc(CC)cc2)N(C)C)c1 ZINC000061223318 851321489 /nfs/dbraw/zinc/32/14/89/851321489.db2.gz CRUJKRCVCNTGFC-QFIPXVFZSA-N 0 3 410.562 4.090 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)c1ccc(Br)c(F)c1 ZINC000061287042 851338161 /nfs/dbraw/zinc/33/81/61/851338161.db2.gz AQIUFSCSLOAEOU-UHFFFAOYSA-N 0 3 423.351 4.432 20 0 HIADHN CCOc1ccc2cc(C(=O)Nc3ccc(CCN4CCSCC4)cc3)[nH]c2c1 ZINC000061572089 851408993 /nfs/dbraw/zinc/40/89/93/851408993.db2.gz WSZQIEIIISCLER-UHFFFAOYSA-N 0 3 409.555 4.410 20 0 HIADHN O=C(CCC(=O)c1ccc2c(c1)CCC2)Nc1ccc(CCN2CCSCC2)cc1 ZINC000061637092 851418701 /nfs/dbraw/zinc/41/87/01/851418701.db2.gz KPQPDWJSUWAEDU-UHFFFAOYSA-N 0 3 422.594 4.368 20 0 HIADHN CCN(Cc1ccc(OC)cc1)C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000061790709 851453834 /nfs/dbraw/zinc/45/38/34/851453834.db2.gz NUOLTLAORVFKFL-UHFFFAOYSA-N 0 3 413.587 4.341 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)C(=O)Nc1ccccc1SC(F)F)c1ccccc1 ZINC000061878914 851467351 /nfs/dbraw/zinc/46/73/51/851467351.db2.gz JTKZBKBBSKXVFN-KRWDZBQOSA-N 0 3 421.513 4.139 20 0 HIADHN C[C@H](CNC(=O)C(=O)Nc1ccccc1Sc1ccccc1)N1CCC[C@@H](C)C1 ZINC000062121027 851502800 /nfs/dbraw/zinc/50/28/00/851502800.db2.gz GZUHPKOSLIPNNN-QZTJIDSGSA-N 0 3 411.571 4.013 20 0 HIADHN COc1ccc2nc(NC(=O)N(CCN(C)C)Cc3cccc(F)c3)sc2c1 ZINC000062367947 851530601 /nfs/dbraw/zinc/53/06/01/851530601.db2.gz LFINFACJGJBMAW-UHFFFAOYSA-N 0 3 402.495 4.040 20 0 HIADHN COc1ccc2nc(NC(=O)N(CCN(C)C)Cc3ccc(F)cc3F)sc2c1 ZINC000062367951 851530799 /nfs/dbraw/zinc/53/07/99/851530799.db2.gz KVCIPVNHNWYYQL-UHFFFAOYSA-N 0 3 420.485 4.179 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000062374067 851531571 /nfs/dbraw/zinc/53/15/71/851531571.db2.gz IGNALJUMQKZJOY-UHFFFAOYSA-N 0 3 412.824 4.122 20 0 HIADHN CC(C)CC(=O)Nc1ccc(NC(=O)N(CCN(C)C)Cc2cccc(F)c2)cc1 ZINC000062384600 851538570 /nfs/dbraw/zinc/53/85/70/851538570.db2.gz KKJOHMKCTBHMHY-UHFFFAOYSA-N 0 3 414.525 4.406 20 0 HIADHN CCOC(=O)Nc1ccc(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2F)cc1 ZINC000062389974 851539826 /nfs/dbraw/zinc/53/98/26/851539826.db2.gz PMRALXQXQHFNNV-UHFFFAOYSA-N 0 3 420.460 4.129 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)Nc1ccc(N2CCCC2)c(F)c1 ZINC000062403179 851542435 /nfs/dbraw/zinc/54/24/35/851542435.db2.gz AKNYPCBHSBANGY-UHFFFAOYSA-N 0 3 402.489 4.161 20 0 HIADHN CCCNC(=O)c1ccc(NC(=O)N(CCN(C)C)Cc2cccc(Cl)c2)cc1 ZINC000062403794 851543042 /nfs/dbraw/zinc/54/30/42/851543042.db2.gz CUNABXKIZBYPNW-UHFFFAOYSA-N 0 3 416.953 4.076 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)Nc1cccc(COCC2CC2)c1 ZINC000062411771 851545989 /nfs/dbraw/zinc/54/59/89/851545989.db2.gz LMJYGRJOKMOZEU-UHFFFAOYSA-N 0 3 417.500 4.487 20 0 HIADHN CCCOc1ccc(CNC(=O)N(CCN(C)C)Cc2ccc(F)cc2F)cc1 ZINC000062484859 851562578 /nfs/dbraw/zinc/56/25/78/851562578.db2.gz YFZYYCJFHDPNBH-UHFFFAOYSA-N 0 3 405.489 4.027 20 0 HIADHN S=C(NC1CCN(Cc2ccccc2)CC1)N1CCc2[nH]c3ccccc3c2C1 ZINC000063146310 851621430 /nfs/dbraw/zinc/62/14/30/851621430.db2.gz OFTGDRSEBRCLNY-UHFFFAOYSA-N 0 3 404.583 4.065 20 0 HIADHN CN1CCC(NC(=S)N(Cc2cccs2)c2ccc(Br)cc2)CC1 ZINC000063149829 851623634 /nfs/dbraw/zinc/62/36/34/851623634.db2.gz FTPNALKGFBFDIG-UHFFFAOYSA-N 0 3 424.433 4.486 20 0 HIADHN CN1CCC(NC(=S)Nc2ccc(NC(=O)Nc3ccc(Cl)cc3)cc2)CC1 ZINC000063178171 851628709 /nfs/dbraw/zinc/62/87/09/851628709.db2.gz FSJYEROJNPAGMF-UHFFFAOYSA-N 0 3 417.966 4.365 20 0 HIADHN CCc1ccc(CNCc2cc(I)c(OC)c(OC)c2)s1 ZINC000063313257 851658560 /nfs/dbraw/zinc/65/85/60/851658560.db2.gz RGDPFPJZZKXVFQ-UHFFFAOYSA-N 0 3 417.312 4.222 20 0 HIADHN CCOc1cccc([C@H](C)NC(=O)Nc2ccc(N3CCN(CC)CC3)cc2C)c1 ZINC000063320859 851660075 /nfs/dbraw/zinc/66/00/75/851660075.db2.gz XWCLZDZWPJAONV-IBGZPJMESA-N 0 3 410.562 4.418 20 0 HIADHN CCOc1cccc([C@H](C)NC(=O)NC[C@@H](c2ccc(OC)cc2)N2CCCC2)c1 ZINC000063323829 851660927 /nfs/dbraw/zinc/66/09/27/851660927.db2.gz JGXFNOWMAXMAGF-MBSDFSHPSA-N 0 3 411.546 4.291 20 0 HIADHN CCOc1cccc([C@@H](C)NC(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)c1 ZINC000063404527 851681314 /nfs/dbraw/zinc/68/13/14/851681314.db2.gz NZWPIOXQFKXCCO-MRXNPFEDSA-N 0 3 405.489 4.198 20 0 HIADHN Cc1ccc(-c2nc(CC(=O)N(CCCc3ccccc3)CCN(C)C)cs2)o1 ZINC000063485827 851702482 /nfs/dbraw/zinc/70/24/82/851702482.db2.gz JQWFWPNMDFLNAM-UHFFFAOYSA-N 0 3 411.571 4.277 20 0 HIADHN CC(=O)Nc1ccc(CN[C@H]2CC(=O)N(c3ccc(Oc4ccccc4)cc3)C2)cc1 ZINC000063549552 851713134 /nfs/dbraw/zinc/71/31/34/851713134.db2.gz ZZVZWVPMEQIOEN-NRFANRHFSA-N 0 3 415.493 4.332 20 0 HIADHN COc1ccc2cc(CNCc3ccc(C(=O)N4C[C@@H](C)O[C@@H](C)C4)cc3)ccc2c1 ZINC000063561325 851714548 /nfs/dbraw/zinc/71/45/48/851714548.db2.gz KWXFFLVABOKESJ-KDURUIRLSA-N 0 3 418.537 4.388 20 0 HIADHN Cc1ccc(CCCCC(=O)Nc2cccc(CN3CCC(C(N)=O)CC3)c2)cc1 ZINC000063595314 851721150 /nfs/dbraw/zinc/72/11/50/851721150.db2.gz DCEFFVUZZDOWJT-UHFFFAOYSA-N 0 3 407.558 4.044 20 0 HIADHN COc1cccc(OC)c1OC[C@@H](O)CN1CC=C(c2cccc3ccccc32)CC1 ZINC000063762330 851757416 /nfs/dbraw/zinc/75/74/16/851757416.db2.gz VQQMRHKOYFGHIP-NRFANRHFSA-N 0 3 419.521 4.386 20 0 HIADHN CCN1CCC[C@H](CNC(=O)c2cccc3c(=O)c(C)c(-c4ccccc4)oc23)C1 ZINC000063852237 851778466 /nfs/dbraw/zinc/77/84/66/851778466.db2.gz OJFUFCXPWUWSGN-GOSISDBHSA-N 0 3 404.510 4.230 20 0 HIADHN COc1ccc(-c2cnc(CCC(=O)N3CCN(CC4CCCCC4)CC3)o2)cc1 ZINC000063947005 851801652 /nfs/dbraw/zinc/80/16/52/851801652.db2.gz SVUVNQOYBMWJPP-UHFFFAOYSA-N 0 3 411.546 4.007 20 0 HIADHN Cc1onc(-c2ccccc2)c1-c1nnc(CN2CCN(CC3CCCCC3)CC2)o1 ZINC000064129731 851832997 /nfs/dbraw/zinc/83/29/97/851832997.db2.gz WWPSNGXCBGPNRT-UHFFFAOYSA-N 0 3 421.545 4.398 20 0 HIADHN C[C@H](CC(=O)Nc1ccc(NC(=O)C2CC2)cc1)N[C@@H]1CCOc2c(F)cccc21 ZINC000437102943 862292128 /nfs/dbraw/zinc/29/21/28/862292128.db2.gz HUXOQXQMOMOSAK-JLTOFOAXSA-N 0 3 411.477 4.005 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)Nc1ccc2c(c1)OCCO2 ZINC000064412330 851891130 /nfs/dbraw/zinc/89/11/30/851891130.db2.gz CWNJGOPWDFIQLE-UHFFFAOYSA-N 0 3 423.435 4.072 20 0 HIADHN CC(C)CC(=O)Nc1cccc(CNC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000064415433 851892228 /nfs/dbraw/zinc/89/22/28/851892228.db2.gz HZWAVHUPMIPAEG-HSZRJFAPSA-N 0 3 422.573 4.135 20 0 HIADHN COc1ccc(Cl)c(NC(=O)NCCCCN2CCN(c3ccccc3)CC2)c1 ZINC000064548057 851927662 /nfs/dbraw/zinc/92/76/62/851927662.db2.gz PLWQDOOZKDVKGC-UHFFFAOYSA-N 0 3 416.953 4.073 20 0 HIADHN CCc1ccc([C@H](CNC(=O)C2(c3cccc(Cl)c3)CCOCC2)N(C)C)cc1 ZINC000064693334 851959106 /nfs/dbraw/zinc/95/91/06/851959106.db2.gz VXLPBILWZUYOTH-QFIPXVFZSA-N 0 3 414.977 4.370 20 0 HIADHN Cc1cccc(-n2ncc(C(=O)NCCN(C)Cc3ccccc3)c2C(F)(F)F)c1 ZINC000064804656 851987319 /nfs/dbraw/zinc/98/73/19/851987319.db2.gz ZBAHHPAJQASRQN-UHFFFAOYSA-N 0 3 416.447 4.061 20 0 HIADHN c1ccc(-c2ccc(CNCc3cccc(OCCN4CCOCC4)c3)cc2)cc1 ZINC000065014208 852039721 /nfs/dbraw/zinc/03/97/21/852039721.db2.gz RTZQHOUYOXNOCH-UHFFFAOYSA-N 0 3 402.538 4.354 20 0 HIADHN Cc1ccc(-c2noc(CCC(=O)N[C@H]3CCN([C@@H](C)c4ccccc4)C3)n2)cc1F ZINC000065141082 852076184 /nfs/dbraw/zinc/07/61/84/852076184.db2.gz ZTSPPUHIWKKWFR-PXNSSMCTSA-N 0 3 422.504 4.068 20 0 HIADHN CN(C(=O)[C@H]1CCN(Cc2ccc(N(C)c3ccccc3)nc2)C1)c1ccccc1 ZINC000437129329 862319157 /nfs/dbraw/zinc/31/91/57/862319157.db2.gz ZLQIXMMPLRQTOP-NRFANRHFSA-N 0 3 400.526 4.334 20 0 HIADHN Cc1ccc(C[C@@H]2CCCN(CCCOc3ccc(S(C)(=O)=O)cc3)C2)cc1 ZINC000065254031 852094463 /nfs/dbraw/zinc/09/44/63/852094463.db2.gz MYTOBGROXVIOJV-NRFANRHFSA-N 0 3 401.572 4.122 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)NCc1cccc(OC(F)F)c1 ZINC000065384895 852119236 /nfs/dbraw/zinc/11/92/36/852119236.db2.gz VFGDULMCGABHRH-UHFFFAOYSA-N 0 3 411.880 4.215 20 0 HIADHN O=C(Nc1ccccc1OC[C@H]1CCCCO1)N1CCN(CC2CCCCC2)CC1 ZINC000065416955 852125932 /nfs/dbraw/zinc/12/59/32/852125932.db2.gz RWTCIYAWBXGQPL-OAQYLSRUSA-N 0 3 415.578 4.364 20 0 HIADHN CCCC(=O)Nc1cccc(NC(=O)N2CCN(CC3CCCCC3)CC2)c1C ZINC000065417450 852126102 /nfs/dbraw/zinc/12/61/02/852126102.db2.gz BAMSRTQTJPJIOL-UHFFFAOYSA-N 0 3 400.567 4.463 20 0 HIADHN CN(CCNC(=O)Nc1cc(C(F)(F)F)ccc1-n1cccn1)Cc1ccccc1 ZINC000065439781 852133976 /nfs/dbraw/zinc/13/39/76/852133976.db2.gz LJBZNIZOTRDNCV-UHFFFAOYSA-N 0 3 417.435 4.145 20 0 HIADHN CN(CCNC(=O)Nc1ccc(OC(F)F)c2ncccc12)Cc1ccccc1 ZINC000065451205 852139738 /nfs/dbraw/zinc/13/97/38/852139738.db2.gz WLQIKLXQTVPDFZ-UHFFFAOYSA-N 0 3 400.429 4.090 20 0 HIADHN CCOc1ccc([C@@H](C)NC(=O)N2CCN(CC3CCCCC3)CC2)cc1OC ZINC000065457190 852141630 /nfs/dbraw/zinc/14/16/30/852141630.db2.gz HJEHHSQLUVUPQS-GOSISDBHSA-N 0 3 403.567 4.062 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N[C@H](C)c2ccc(NC(=O)C3CC3)cc2)N(C)C)cc1 ZINC000065468702 852145262 /nfs/dbraw/zinc/14/52/62/852145262.db2.gz DXWQRHURVYLLJM-VGSWGCGISA-N 0 3 408.546 4.007 20 0 HIADHN COc1cccc(CN2CCC(NC(=O)c3c4c(nc5ccccc53)CCC4)CC2)c1 ZINC000065506459 852160657 /nfs/dbraw/zinc/16/06/57/852160657.db2.gz VNLQCWWQEJBCTC-UHFFFAOYSA-N 0 3 415.537 4.127 20 0 HIADHN CCCOc1ccc(CNC(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)cc1OC ZINC000065522990 852168121 /nfs/dbraw/zinc/16/81/21/852168121.db2.gz XRNFJDAWBZSOFR-RXVVDRJESA-N 0 3 411.546 4.119 20 0 HIADHN C[C@H]1CCCC[C@@H]1N(C)C(=O)CNC1(c2cccc(Br)c2)CCOCC1 ZINC000065604501 852197243 /nfs/dbraw/zinc/19/72/43/852197243.db2.gz KTQMKQGJOLXRFB-LPHOPBHVSA-N 0 3 423.395 4.082 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCc1csc(C)n1)c1ccc(C(F)(F)F)cc1 ZINC000065697616 852223384 /nfs/dbraw/zinc/22/33/84/852223384.db2.gz OMCWZUVWYWQLTC-KRWDZBQOSA-N 0 3 414.497 4.353 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)C(=O)Nc1cccc(C)c1)c1ccc(C(F)(F)F)cc1 ZINC000065713524 852230771 /nfs/dbraw/zinc/23/07/71/852230771.db2.gz PRBAPDYVBCOTIP-IBGZPJMESA-N 0 3 421.463 4.152 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)Nc3ccc(Br)cc3F)cc2)CC1 ZINC000065727754 852236532 /nfs/dbraw/zinc/23/65/32/852236532.db2.gz YBHKXYBTVXVYCG-UHFFFAOYSA-N 0 3 420.326 4.371 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)NCCSCc3ccccc3F)cc2)CC1 ZINC000065742370 852240959 /nfs/dbraw/zinc/24/09/59/852240959.db2.gz ABDZYRXZLYAWOY-UHFFFAOYSA-N 0 3 415.578 4.019 20 0 HIADHN COc1cc(C(=O)N(CCN(C)C)C2CCCCC2)ccc1OCc1cscn1 ZINC000065746644 852243118 /nfs/dbraw/zinc/24/31/18/852243118.db2.gz MBEDKQBPHFNSDM-UHFFFAOYSA-N 0 3 417.575 4.067 20 0 HIADHN Cc1cc(NC(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)ccc1N1CCCC1 ZINC000065749730 852244435 /nfs/dbraw/zinc/24/44/35/852244435.db2.gz NNPMLUFGNYKHFB-UHFFFAOYSA-N 0 3 406.574 4.378 20 0 HIADHN O=C(CCNCc1ccc(-c2cccc(Cl)c2Cl)o1)NCc1cccnc1 ZINC000065935640 852323821 /nfs/dbraw/zinc/32/38/21/852323821.db2.gz VPBXVQORYWIEEL-UHFFFAOYSA-N 0 3 404.297 4.445 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)c1ccc(OC[C@H]2CCCO2)cc1 ZINC000065937119 852325143 /nfs/dbraw/zinc/32/51/43/852325143.db2.gz GCBXHTBIOIUABW-JOCHJYFZSA-N 0 3 416.949 4.102 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)c1csc(-c2ccccc2F)n1 ZINC000065938336 852326117 /nfs/dbraw/zinc/32/61/17/852326117.db2.gz JJRNAELWRNEREP-UHFFFAOYSA-N 0 3 419.472 4.431 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)CSc1nc2ccccc2s1 ZINC000065939100 852328457 /nfs/dbraw/zinc/32/84/57/852328457.db2.gz AIGJEASQPGWUCO-UHFFFAOYSA-N 0 3 403.548 4.118 20 0 HIADHN Cc1ccc(-c2nc(CC(=O)N(CCN(C)C)Cc3cccc(F)c3)cs2)cc1 ZINC000065940000 852329260 /nfs/dbraw/zinc/32/92/60/852329260.db2.gz QQEJCARJSWNLJE-UHFFFAOYSA-N 0 3 411.546 4.391 20 0 HIADHN CC(=O)Nc1cc(NC(=S)NC2CCN(Cc3ccccc3)CC2)ccc1Cl ZINC000066010958 852354220 /nfs/dbraw/zinc/35/42/20/852354220.db2.gz IDWFVSJNHZYXKE-UHFFFAOYSA-N 0 3 416.978 4.249 20 0 HIADHN COc1ccc(/C=C/C(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)cc1OC ZINC000069210912 852387730 /nfs/dbraw/zinc/38/77/30/852387730.db2.gz QWNSYSHRIWDLRM-XSBJJCPUSA-N 0 3 414.571 4.368 20 0 HIADHN COc1ccc(Br)c(C(=O)N[C@H](CN2CCCC2)c2ccccc2)c1 ZINC000071851429 852418817 /nfs/dbraw/zinc/41/88/17/852418817.db2.gz CMELVVPVQYNCTL-LJQANCHMSA-N 0 3 403.320 4.025 20 0 HIADHN CC1CCN([C@H](CNC(=O)Cc2csc(-c3ccccn3)n2)c2ccccc2)CC1 ZINC000072006548 852461996 /nfs/dbraw/zinc/46/19/96/852461996.db2.gz YXVRUAGYARAUQZ-JOCHJYFZSA-N 0 3 420.582 4.337 20 0 HIADHN COc1cccc(CN2CCC(NC(=O)C3(c4cccc(F)c4)CCCC3)CC2)c1 ZINC000072012212 852465279 /nfs/dbraw/zinc/46/52/79/852465279.db2.gz AJFBSQJUNHJOOB-UHFFFAOYSA-N 0 3 410.533 4.427 20 0 HIADHN CC[C@@H](C)c1ccc([C@@H](NCC(=O)NC2CCC3(CC2)OCCO3)C(C)C)cc1 ZINC000072016024 852466920 /nfs/dbraw/zinc/46/69/20/852466920.db2.gz MDWKAOVGMASROF-JPYJTQIMSA-N 0 3 402.579 4.289 20 0 HIADHN O=C(NCc1cccc(Br)c1)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000072048432 852485582 /nfs/dbraw/zinc/48/55/82/852485582.db2.gz YOVKCMHNGASXAR-IBGZPJMESA-N 0 3 402.336 4.085 20 0 HIADHN Cc1ccc(-c2nc(CCNC(=O)NC[C@H](c3cccs3)N3CCCC3)co2)cc1 ZINC000072083948 852500943 /nfs/dbraw/zinc/50/09/43/852500943.db2.gz HOWYZLQYFWYDQQ-HXUWFJFHSA-N 0 3 424.570 4.390 20 0 HIADHN CCOc1ccc(NC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)cc1OCC ZINC000096626851 852552587 /nfs/dbraw/zinc/55/25/87/852552587.db2.gz RWPYCYIQHDIEKD-SFHVURJKSA-N 0 3 400.494 4.474 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)[C@@H]1C[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000097261431 852594756 /nfs/dbraw/zinc/59/47/56/852594756.db2.gz UGLVFNSQTKJVJR-QZTJIDSGSA-N 0 3 412.521 4.287 20 0 HIADHN Cc1noc2nc(-c3ccc(F)cc3)cc(C(=O)NC[C@@H](c3ccccc3)N(C)C)c12 ZINC000105435585 852705576 /nfs/dbraw/zinc/70/55/76/852705576.db2.gz GSWFSBFMMZMMBK-NRFANRHFSA-N 0 3 418.472 4.370 20 0 HIADHN Cc1nn(C)c2nc(-c3cccs3)cc(C(=O)NC[C@@H](c3ccccc3)N(C)C)c12 ZINC000105597262 852716241 /nfs/dbraw/zinc/71/62/41/852716241.db2.gz PUJDXPJSTLHIHB-IBGZPJMESA-N 0 3 419.554 4.038 20 0 HIADHN O=C(CCc1nc2ccccc2n1-c1ccccc1)N1CCN(C2CCCC2)CC1 ZINC000106065695 852750000 /nfs/dbraw/zinc/75/00/00/852750000.db2.gz YWQLEORLYWZNPS-UHFFFAOYSA-N 0 3 402.542 4.045 20 0 HIADHN C[C@H]1CCCN(Cc2csc(NC(=O)N(CCN(C)C)Cc3cccs3)n2)C1 ZINC000437202775 862392841 /nfs/dbraw/zinc/39/28/41/862392841.db2.gz XRTICOPUIXFMMU-INIZCTEOSA-N 0 3 421.636 4.032 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1ccc(Cl)c(C(=O)OC)c1)c1ccsc1 ZINC000107705164 852788419 /nfs/dbraw/zinc/78/84/19/852788419.db2.gz AMCBURSFVHDGSZ-QGZVFWFLSA-N 0 3 409.939 4.393 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cc(C)n(-c2ccccc2)n1)c1cccc(OC)c1 ZINC000107786126 852796458 /nfs/dbraw/zinc/79/64/58/852796458.db2.gz ZEGRRRFDISRDIK-QHCPKHFHSA-N 0 3 406.530 4.002 20 0 HIADHN O=C(COc1ccc(Cl)c2cccnc12)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000107829142 852800923 /nfs/dbraw/zinc/80/09/23/852800923.db2.gz DYDBNGCWRYEVCZ-FQEVSTJZSA-N 0 3 409.917 4.220 20 0 HIADHN O=S(=O)(c1ccc(CN(Cc2ccccc2)C2CCCCC2)o1)N1CCCC1 ZINC000108236467 852831255 /nfs/dbraw/zinc/83/12/55/852831255.db2.gz HSOVELMOTBYTSP-UHFFFAOYSA-N 0 3 402.560 4.399 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)[C@H]1C[C@H]1c1ccccc1Cl ZINC000108470358 852854323 /nfs/dbraw/zinc/85/43/23/852854323.db2.gz ORURXKLFGCWFNJ-VXKWHMMOSA-N 0 3 411.977 4.162 20 0 HIADHN COc1ccc2oc(C)c(C(=O)NC3CCN(Cc4cccc(OC)c4)CC3)c2c1 ZINC000108536108 852857579 /nfs/dbraw/zinc/85/75/79/852857579.db2.gz DOUMLCWANZJEJM-UHFFFAOYSA-N 0 3 408.498 4.153 20 0 HIADHN CCn1c2ccccc2nc1SCC(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000108820958 852882255 /nfs/dbraw/zinc/88/22/55/852882255.db2.gz RZBHZAMETMAYGC-PKOBYXMFSA-N 0 3 408.571 4.100 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)Nc3ccccc3N3CCCCC3)cc2)CC1 ZINC000109188032 852933403 /nfs/dbraw/zinc/93/34/03/852933403.db2.gz IHOYUBOJAKTRMY-UHFFFAOYSA-N 0 3 406.574 4.460 20 0 HIADHN O=C(NCc1ccccc1OC(F)(F)F)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000109339142 852955220 /nfs/dbraw/zinc/95/52/20/852955220.db2.gz SYSOAFINVDJZSV-QGZVFWFLSA-N 0 3 410.411 4.253 20 0 HIADHN COc1ccc(C(=O)N(CCN2CCCC2)Cc2ccc(Cl)c(Cl)c2)cn1 ZINC000109371508 852960805 /nfs/dbraw/zinc/96/08/05/852960805.db2.gz LVZSZQIUDOQELP-UHFFFAOYSA-N 0 3 408.329 4.135 20 0 HIADHN O=C(CN(CCc1ccccc1)C1CCCC1)Nc1ccccc1N1CCCC1=O ZINC000109405290 852965296 /nfs/dbraw/zinc/96/52/96/852965296.db2.gz PSMAWARCWZIQIM-UHFFFAOYSA-N 0 3 405.542 4.239 20 0 HIADHN CN(CC(=O)N(Cc1cccs1)c1ccc2c(c1)OCCO2)CC1CCCC1 ZINC000109422939 852969434 /nfs/dbraw/zinc/96/94/34/852969434.db2.gz WGUYBDXWDFTGEQ-UHFFFAOYSA-N 0 3 400.544 4.175 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)NCc3ccccc3OC(F)(F)F)cc2)CC1 ZINC000109488670 852975899 /nfs/dbraw/zinc/97/58/99/852975899.db2.gz XKIITQNBQCJDHO-UHFFFAOYSA-N 0 3 421.463 4.046 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2cc(F)cc3nc(C)c(C)nc32)N2CCCC2)cc1 ZINC000109504634 852978244 /nfs/dbraw/zinc/97/82/44/852978244.db2.gz IKNQCWZGQMTGMX-QFIPXVFZSA-N 0 3 406.505 4.261 20 0 HIADHN CSc1nc(C)c(CCC(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)c(C)n1 ZINC000109503994 852978441 /nfs/dbraw/zinc/97/84/41/852978441.db2.gz JVPCKAKCROXRQR-NRFANRHFSA-N 0 3 412.603 4.010 20 0 HIADHN Cc1cc(Sc2ncccn2)ccc1NC(=O)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000110075853 853056983 /nfs/dbraw/zinc/05/69/83/853056983.db2.gz AMYDJVBAJMITAM-IBGZPJMESA-N 0 3 419.554 4.332 20 0 HIADHN O=C(NCCc1cc(F)cc(F)c1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000110107267 853060614 /nfs/dbraw/zinc/06/06/14/853060614.db2.gz KOJWWOPBGMCKFG-HXUWFJFHSA-N 0 3 412.402 4.078 20 0 HIADHN O=C(NCCc1c(F)cccc1F)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000110123439 853062893 /nfs/dbraw/zinc/06/28/93/853062893.db2.gz BHBVYIDCWDGAHU-HXUWFJFHSA-N 0 3 412.402 4.078 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)c2cc(Br)cnc2Cl)C1 ZINC000110230366 853077159 /nfs/dbraw/zinc/07/71/59/853077159.db2.gz QRGUBTJMOWDTRP-DOMZBBRYSA-N 0 3 408.727 4.063 20 0 HIADHN COc1ccc(OC)c([C@@H](O)CNCc2cc3ccccc3nc2N2CCCCC2)c1 ZINC000110252700 853080268 /nfs/dbraw/zinc/08/02/68/853080268.db2.gz JBQAAWWARNSZDE-QHCPKHFHSA-N 0 3 421.541 4.066 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)c3ccccc3Cc3ccccc3)CC2)C[C@@H](C)O1 ZINC000110411439 853096870 /nfs/dbraw/zinc/09/68/70/853096870.db2.gz XXRBONKQBLVMSJ-NHCUHLMSSA-N 0 3 406.570 4.239 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)CSc3ccc(C(C)(C)C)cc3)CC2)C[C@H](C)O1 ZINC000110416848 853097544 /nfs/dbraw/zinc/09/75/44/853097544.db2.gz LGSCAVFOAHZXFA-OALUTQOASA-N 0 3 418.647 4.424 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)c3ccccc3Nc3ccccc3)CC2)C[C@@H](C)O1 ZINC000110417727 853097612 /nfs/dbraw/zinc/09/76/12/853097612.db2.gz QRXSTPGWBYMORZ-WOJBJXKFSA-N 0 3 407.558 4.392 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)CCc3ccc(C(C)(C)C)cc3)CC2)C[C@@H](C)O1 ZINC000110451193 853101370 /nfs/dbraw/zinc/10/13/70/853101370.db2.gz XAEWCJKNDHIWFL-WOJBJXKFSA-N 0 3 400.607 4.265 20 0 HIADHN Cc1nc(-c2ccccc2)sc1C(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000110459281 853102056 /nfs/dbraw/zinc/10/20/56/853102056.db2.gz SWEWCERBLNRVEZ-CALCHBBNSA-N 0 3 413.587 4.080 20 0 HIADHN COc1c(Br)cc(Br)cc1CNCC1(O)CCCCC1 ZINC000110469274 853104522 /nfs/dbraw/zinc/10/45/22/853104522.db2.gz CIMPLCMJDBZRGT-UHFFFAOYSA-N 0 3 407.146 4.005 20 0 HIADHN CN(C)Cc1cccc(NC(=O)C(=O)Nc2cccc(OCc3cccc(F)c3)c2)c1 ZINC000437229010 862430470 /nfs/dbraw/zinc/43/04/70/862430470.db2.gz YWLWRSOCJKPYGF-UHFFFAOYSA-N 0 3 421.472 4.044 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(NCc3ccc(C[NH+]4CCC(C)CC4)cc3)nc2)n1 ZINC000111106322 853202823 /nfs/dbraw/zinc/20/28/23/853202823.db2.gz ATRSLWCHZHUNTF-UHFFFAOYSA-N 0 3 417.557 4.238 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(NCc3ccccc3C[N@@H+]3CCCC[C@H]3C)nc2)n1 ZINC000111227858 853229210 /nfs/dbraw/zinc/22/92/10/853229210.db2.gz CGOMFSSDEYIQRH-GOSISDBHSA-N 0 3 417.557 4.381 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(NCc3ccccc3C[N@H+]3CCCC[C@H]3C)nc2)n1 ZINC000111227858 853229217 /nfs/dbraw/zinc/22/92/17/853229217.db2.gz CGOMFSSDEYIQRH-GOSISDBHSA-N 0 3 417.557 4.381 20 0 HIADHN Cc1noc(CSc2ccc(C(=O)N[C@H]3CCN([C@@H](C)c4ccccc4)C3)cc2)n1 ZINC000115759680 853263803 /nfs/dbraw/zinc/26/38/03/853263803.db2.gz QPOYQUWVADLEAV-JXFKEZNVSA-N 0 3 422.554 4.236 20 0 HIADHN Cc1c(C(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)cnn1-c1cccc(C)c1 ZINC000116185014 853291368 /nfs/dbraw/zinc/29/13/68/853291368.db2.gz RDOCMUIYUXQUSI-DEOSSOPVSA-N 0 3 402.542 4.364 20 0 HIADHN CN(C)Cc1ccccc1CNC(=O)c1cccc(NC(=O)c2ccc(F)cc2)c1 ZINC000116955122 853339873 /nfs/dbraw/zinc/33/98/73/853339873.db2.gz JNMHBXUJQOGGKP-UHFFFAOYSA-N 0 3 405.473 4.070 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)cc1Cl ZINC000138281182 853382328 /nfs/dbraw/zinc/38/23/28/853382328.db2.gz XYRHSQZMDARYMS-INIZCTEOSA-N 0 3 403.885 4.288 20 0 HIADHN O=C(NC1CCN(Cc2ccc(OCc3ccncc3)cc2)CC1)c1ccccc1 ZINC000139197528 853405200 /nfs/dbraw/zinc/40/52/00/853405200.db2.gz KZAQQYVVGDOFSY-UHFFFAOYSA-N 0 3 401.510 4.055 20 0 HIADHN Cn1cc(CNCc2ccc(C(=O)N3CCCC3)cc2)c(-c2cc3ccccc3o2)n1 ZINC000139340604 853408582 /nfs/dbraw/zinc/40/85/82/853408582.db2.gz ICMFXGVWWUNLAK-UHFFFAOYSA-N 0 3 414.509 4.359 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2ccc(-c3csnn3)cc2)N2CCCC2)cc1 ZINC000139721833 853419973 /nfs/dbraw/zinc/41/99/73/853419973.db2.gz UHJSJHSESGOADF-OAQYLSRUSA-N 0 3 407.543 4.472 20 0 HIADHN C[C@@H](NC(=O)Nc1ccc(CCN2CCSCC2)cc1)c1nc2ccccc2[nH]1 ZINC000139903740 853425934 /nfs/dbraw/zinc/42/59/34/853425934.db2.gz KAUDGQALYQOAKF-MRXNPFEDSA-N 0 3 409.559 4.037 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cnn(C)c1C1CC1)c1ccc(C(F)(F)F)cc1 ZINC000141350407 853469211 /nfs/dbraw/zinc/46/92/11/853469211.db2.gz WNUAQPQAAJOUAP-GOSISDBHSA-N 0 3 408.468 4.129 20 0 HIADHN CCOc1cc(CN[C@H](C)c2ccc(N3CCOC3=O)cc2)ccc1OC(F)F ZINC000142748064 853498832 /nfs/dbraw/zinc/49/88/32/853498832.db2.gz ZPTAVBMBDPLNBA-CQSZACIVSA-N 0 3 406.429 4.494 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N[C@@H](c3ccccc3)c3ccccn3)cc2)CC1 ZINC000142986435 853504949 /nfs/dbraw/zinc/50/49/49/853504949.db2.gz IEISFMKAQGRBDF-VWLOTQADSA-N 0 3 414.553 4.131 20 0 HIADHN CC[C@@H](CNC(=O)Nc1cccc(-c2noc(C)n2)c1)N1CCc2ccccc2C1 ZINC000144574636 853537391 /nfs/dbraw/zinc/53/73/91/853537391.db2.gz MGANWHDQONDTPY-NRFANRHFSA-N 0 3 405.502 4.003 20 0 HIADHN CCOC(=O)c1ccc(NC(=S)NC[C@H]2CCCN(Cc3cccs3)C2)cc1 ZINC000145497712 853552119 /nfs/dbraw/zinc/55/21/19/853552119.db2.gz JAPGYJDWJGPWHI-MRXNPFEDSA-N 0 3 417.600 4.123 20 0 HIADHN CCc1nc(CN(C)C(=O)NC[C@@H](c2ccccc2)N2CCC(C)CC2)cs1 ZINC000147996535 853598025 /nfs/dbraw/zinc/59/80/25/853598025.db2.gz ZZUBRJMCSBEBDX-FQEVSTJZSA-N 0 3 400.592 4.320 20 0 HIADHN CCc1nc(CC(=O)C(C#N)C(=O)Nc2ccccc2Oc2ccccc2)cs1 ZINC000150133533 853638091 /nfs/dbraw/zinc/63/80/91/853638091.db2.gz QRIRHXVEEKNNOJ-KRWDZBQOSA-N 0 3 405.479 4.388 20 0 HIADHN Cc1cc(CNCc2cccc(NC(=O)[C@H]3CCCO3)c2)cc(C)c1OC(F)F ZINC000165425172 853651784 /nfs/dbraw/zinc/65/17/84/853651784.db2.gz WGRHQFOJSMASSX-LJQANCHMSA-N 0 3 404.457 4.312 20 0 HIADHN COc1ccc2[nH]cc(C3CCN(C(=O)NCCN(C)Cc4ccccc4)CC3)c2c1 ZINC000195635738 853729061 /nfs/dbraw/zinc/72/90/61/853729061.db2.gz NQVPFABBPDYJDT-UHFFFAOYSA-N 0 3 420.557 4.198 20 0 HIADHN Cc1ccccc1OC[C@H](O)CN[C@@H](C)c1cccc(NC(=O)c2ccccc2)c1 ZINC000195662318 853744061 /nfs/dbraw/zinc/74/40/61/853744061.db2.gz IAKSDTANHGWULX-WMZHIEFXSA-N 0 3 404.510 4.338 20 0 HIADHN C[C@H](N[C@@H](C)c1cccc(C(F)(F)F)c1)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000195702188 853768216 /nfs/dbraw/zinc/76/82/16/853768216.db2.gz WKPWRNUEFPQDEC-KBPBESRZSA-N 0 3 400.466 4.368 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(C(F)(F)F)cc1)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000195702199 853768656 /nfs/dbraw/zinc/76/86/56/853768656.db2.gz CDNQACFENYNPQB-UONOGXRCSA-N 0 3 400.466 4.368 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)/C=C\c3nc4ccccc4s3)cc2)CC1 ZINC000208803819 853808880 /nfs/dbraw/zinc/80/88/80/853808880.db2.gz LEDQMNXPZGOJKS-QXMHVHEDSA-N 0 3 406.555 4.086 20 0 HIADHN FC(F)(F)c1ccccc1OCCN1CCC[C@@H](c2nnc3n2CCCCC3)C1 ZINC000215886925 853839431 /nfs/dbraw/zinc/83/94/31/853839431.db2.gz QHJZYIWNILFCLO-MRXNPFEDSA-N 0 3 408.468 4.282 20 0 HIADHN O=C(N1CC[C@@H](Nc2ccccc2)C1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000229735471 853892266 /nfs/dbraw/zinc/89/22/66/853892266.db2.gz SYGGGIYSEMYCQR-IFMALSPDSA-N 0 3 417.475 4.154 20 0 HIADHN Brc1cccc(-c2nc(CNCCCOC[C@H]3CCOC3)cs2)c1 ZINC000236581525 853899900 /nfs/dbraw/zinc/89/99/00/853899900.db2.gz VATCTPDBTJMQGW-CQSZACIVSA-N 0 3 411.365 4.105 20 0 HIADHN CC(C)(CCS(C)(=O)=O)NCc1ccc(-c2cccc(Br)c2)o1 ZINC000236591466 853900327 /nfs/dbraw/zinc/90/03/27/853900327.db2.gz HHVDCTXOUISADM-UHFFFAOYSA-N 0 3 400.338 4.012 20 0 HIADHN CC(C)c1nn(-c2ccccc2)c(Cl)c1CNCCc1nnc2n1CCCCC2 ZINC000236632750 853904680 /nfs/dbraw/zinc/90/46/80/853904680.db2.gz GFDGYVKOIQRBAY-UHFFFAOYSA-N 0 3 412.969 4.299 20 0 HIADHN CC(C)(C)c1nn(-c2ccccc2)cc1CNCc1cccc(CN2CCOCC2)c1 ZINC000236655944 853908098 /nfs/dbraw/zinc/90/80/98/853908098.db2.gz ALNQXEGFVOVAES-UHFFFAOYSA-N 0 3 418.585 4.292 20 0 HIADHN CC(C)Oc1ccc(CN[C@@H](C)CC(=O)Nc2ccc(Br)cc2)cn1 ZINC000236720876 853914913 /nfs/dbraw/zinc/91/49/13/853914913.db2.gz QZVIDDZHBIGFJD-AWEZNQCLSA-N 0 3 406.324 4.138 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@H](C)NCc2cnn(-c3ccccc3)c2)CC1 ZINC000236853393 853928674 /nfs/dbraw/zinc/92/86/74/853928674.db2.gz XWGTYEVZSVHPSH-IBGZPJMESA-N 0 3 407.537 4.004 20 0 HIADHN CCOc1cc(CNCc2ccc(N3CCCC3=O)cc2)ccc1OCC(F)(F)F ZINC000236866278 853930359 /nfs/dbraw/zinc/93/03/59/853930359.db2.gz HLKWPWXWNSSMMC-UHFFFAOYSA-N 0 3 422.447 4.443 20 0 HIADHN CCNC(=O)COc1ccc(CN[C@@H](c2ccc(F)cc2)C(C)(C)C)cc1OC ZINC000236893419 853933046 /nfs/dbraw/zinc/93/30/46/853933046.db2.gz BDEGULUZJLWVIL-QFIPXVFZSA-N 0 3 402.510 4.226 20 0 HIADHN CCC[C@@H](NCc1ccc(O[C@@H](C)C#N)cc1)C(=O)Nc1cccc(N2CCCC2)c1 ZINC000236917152 853937052 /nfs/dbraw/zinc/93/70/52/853937052.db2.gz DWMOJMABAOAQLZ-YADARESESA-N 0 3 420.557 4.475 20 0 HIADHN CCOc1cccc(CNCc2cc(Br)ccc2OC(F)F)c1O ZINC000236943840 853940261 /nfs/dbraw/zinc/94/02/61/853940261.db2.gz PSOXTIPZWFSBIP-UHFFFAOYSA-N 0 3 402.235 4.445 20 0 HIADHN CCNC(=O)c1ccc(CNCc2cc(OC)c(OC)cc2-c2ccccc2)cc1 ZINC000236977723 853945318 /nfs/dbraw/zinc/94/53/18/853945318.db2.gz PSNSGYKQDWLGEI-UHFFFAOYSA-N 0 3 404.510 4.410 20 0 HIADHN CCS(=O)(=O)C[C@H](C)NCc1ccc(-c2cccc(Br)c2)s1 ZINC000237011595 853951453 /nfs/dbraw/zinc/95/14/53/853951453.db2.gz RIUVKNMCOCTTQU-LBPRGKRZSA-N 0 3 402.379 4.090 20 0 HIADHN CC(=O)N(c1nc(CNC[C@@H]2CCCN2C)cs1)c1ccc(C(F)(F)F)cc1 ZINC000237088804 853962902 /nfs/dbraw/zinc/96/29/02/853962902.db2.gz ATXWIFJBMCMPCF-KRWDZBQOSA-N 0 3 412.481 4.030 20 0 HIADHN CN(C)S(=O)(=O)c1ccc(CNCc2cccc(OCC3CCCCC3)c2)cc1 ZINC000237121493 853967917 /nfs/dbraw/zinc/96/79/17/853967917.db2.gz PCRUYVSHANCXNB-UHFFFAOYSA-N 0 3 416.587 4.186 20 0 HIADHN COCCOc1ccc(CNCc2cccc(NC(=O)c3ccc(F)cc3)c2)cc1 ZINC000237212252 853983454 /nfs/dbraw/zinc/98/34/54/853983454.db2.gz DMPFZAHRCLCKHV-UHFFFAOYSA-N 0 3 408.473 4.393 20 0 HIADHN COc1cc(Br)cc(C[NH2+]Cc2ccc(C(=O)OC(C)(C)C)cc2)c1[O-] ZINC000237214743 853984848 /nfs/dbraw/zinc/98/48/48/853984848.db2.gz RFMKBALMGJDCAJ-UHFFFAOYSA-N 0 3 422.319 4.408 20 0 HIADHN COc1cc(C[NH2+]C[C@@H](O)c2cccc(C(F)(F)F)c2)cc(Br)c1[O-] ZINC000237235400 853987694 /nfs/dbraw/zinc/98/76/94/853987694.db2.gz VKUNMBIPULOXGK-CQSZACIVSA-N 0 3 420.225 4.005 20 0 HIADHN COc1cc(Br)cc(C[NH2+]C2(c3ccc(F)cc3)CCOCC2)c1[O-] ZINC000237238028 853988411 /nfs/dbraw/zinc/98/84/11/853988411.db2.gz MPGFAOJJWGMEGI-UHFFFAOYSA-N 0 3 410.283 4.098 20 0 HIADHN COc1ccc(OC)c([C@H](C)N[C@H](C)CC(=O)Nc2cc(Cl)ccc2OC)c1 ZINC000237275466 853995292 /nfs/dbraw/zinc/99/52/92/853995292.db2.gz SHPBPPIUPYMUKL-KGLIPLIRSA-N 0 3 406.910 4.434 20 0 HIADHN COc1cc(CNC[C@](C)(O)c2ccccc2)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000237285187 853997262 /nfs/dbraw/zinc/99/72/62/853997262.db2.gz JBTXNFBTTRXGSH-DEOSSOPVSA-N 0 3 422.481 4.180 20 0 HIADHN COc1ccc(NC(=O)C[C@@H](C)N[C@H](c2nc3ccccc3[nH]2)C(C)C)c(OC)c1 ZINC000237290105 853998046 /nfs/dbraw/zinc/99/80/46/853998046.db2.gz LWCJPZLIHXKVDJ-QRQCRPRQSA-N 0 3 410.518 4.284 20 0 HIADHN COc1ccc(NC(=O)C[C@@H](C)N[C@H]2CCOc3c(Cl)cccc32)c(OC)c1 ZINC000237292932 853999059 /nfs/dbraw/zinc/99/90/59/853999059.db2.gz MCJAJJQWZCENKZ-DYVFJYSZSA-N 0 3 404.894 4.188 20 0 HIADHN COc1ccc(NC(=O)C[C@@H](C)N[C@@H](c2ccccc2)c2ccncc2)c(OC)c1 ZINC000237291241 853999242 /nfs/dbraw/zinc/99/92/42/853999242.db2.gz JJKADRVLRHCYCP-OSPHWJPCSA-N 0 3 405.498 4.195 20 0 HIADHN COc1cccc(CNCc2ccccc2CN2C[C@@H](C)O[C@@H](C)C2)c1OC(C)C ZINC000237388454 854020530 /nfs/dbraw/zinc/02/05/30/854020530.db2.gz UYBKALQPVJQDOL-BGYRXZFFSA-N 0 3 412.574 4.381 20 0 HIADHN COc1cc(CN[C@H](c2ccc3c(c2)OCCO3)C2CC2)cc(Br)c1O ZINC000237423439 854029571 /nfs/dbraw/zinc/02/95/71/854029571.db2.gz VOIMJEDROZZINV-IBGZPJMESA-N 0 3 420.303 4.175 20 0 HIADHN CS(=O)(=O)c1ccc(OCCNCc2ccc(-c3ccccc3Cl)o2)cc1 ZINC000237457696 854037287 /nfs/dbraw/zinc/03/72/87/854037287.db2.gz CQGXAJRVTYTARO-UHFFFAOYSA-N 0 3 405.903 4.172 20 0 HIADHN Cc1nn(-c2ccccc2)cc1CN[C@H](C)CC(=O)Nc1cccc(N2CCCC2)c1 ZINC000237580015 854058702 /nfs/dbraw/zinc/05/87/02/854058702.db2.gz RXZPCOJETKFEOH-LJQANCHMSA-N 0 3 417.557 4.288 20 0 HIADHN C[C@H](NCc1cccc(OCc2ccccc2)c1)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000237598581 854060571 /nfs/dbraw/zinc/06/05/71/854060571.db2.gz ULQWLOPXASETHQ-IBGZPJMESA-N 0 3 424.566 4.367 20 0 HIADHN C[C@H]1CN(CCCNCc2csc(-c3cccc(Br)c3)n2)C[C@H](C)O1 ZINC000237614902 854062550 /nfs/dbraw/zinc/06/25/50/854062550.db2.gz FKYSTQRZKVIFAJ-GJZGRUSLSA-N 0 3 424.408 4.162 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2CNCc2ccc(F)c(Br)c2)C[C@H](C)O1 ZINC000237622020 854063612 /nfs/dbraw/zinc/06/36/12/854063612.db2.gz MFWOKCQZTOGXCT-IYBDPMFKSA-N 0 3 421.354 4.487 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2CNCc2ccccc2Br)C[C@H](C)O1 ZINC000237623529 854063901 /nfs/dbraw/zinc/06/39/01/854063901.db2.gz MPBYHFFLVULCGK-CALCHBBNSA-N 0 3 403.364 4.348 20 0 HIADHN Cc1nn(C)c(C)c1CCNCc1c(C)nn(Cc2ccc(Cl)cc2)c1Cl ZINC000237698647 854078047 /nfs/dbraw/zinc/07/80/47/854078047.db2.gz AVSMTZPBLBLQJA-UHFFFAOYSA-N 0 3 406.361 4.229 20 0 HIADHN Cc1ccccc1-c1nn(-c2ccccc2)cc1CNCCNC(=O)c1cccs1 ZINC000237709735 854080922 /nfs/dbraw/zinc/08/09/22/854080922.db2.gz GJTLOZIQOJOXIC-UHFFFAOYSA-N 0 3 416.550 4.429 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)c(C)c1CNCCCS(=O)(=O)c1ccccc1 ZINC000237720652 854082730 /nfs/dbraw/zinc/08/27/30/854082730.db2.gz BXARMULQROEBJL-UHFFFAOYSA-N 0 3 417.962 4.096 20 0 HIADHN Cc1ccoc1C(=O)NCCCNCc1c(C)nn(-c2cccc(Cl)c2)c1Cl ZINC000237763494 854092084 /nfs/dbraw/zinc/09/20/84/854092084.db2.gz MFOXGSCJFQTKAP-UHFFFAOYSA-N 0 3 421.328 4.299 20 0 HIADHN Fc1ccc(F)c(CNC[C@H](c2ccc(C(F)(F)F)cc2)N2CCOCC2)c1 ZINC000237814113 854102316 /nfs/dbraw/zinc/10/23/16/854102316.db2.gz LAPOAQZHVILKPV-LJQANCHMSA-N 0 3 400.391 4.147 20 0 HIADHN Cc1nn(Cc2ccc(Cl)cc2)c(Cl)c1CNCCCOC[C@H]1CCCO1 ZINC000237892134 854115957 /nfs/dbraw/zinc/11/59/57/854115957.db2.gz MTYTWCJFLDUWMJ-GOSISDBHSA-N 0 3 412.361 4.222 20 0 HIADHN NC(=O)Nc1ccc(CNCc2cn(-c3ccccc3)nc2-c2cccs2)cc1 ZINC000237904573 854117934 /nfs/dbraw/zinc/11/79/34/854117934.db2.gz HSVTVRPPIFPKRU-UHFFFAOYSA-N 0 3 403.511 4.381 20 0 HIADHN O=S(=O)(c1ccc(CNCc2csc3ccccc23)cc1)N1CCCCC1 ZINC000238033676 854135917 /nfs/dbraw/zinc/13/59/17/854135917.db2.gz DKQXCNNPRPCLJP-UHFFFAOYSA-N 0 3 400.569 4.366 20 0 HIADHN O=C(NCCNCc1cn(-c2ccccc2)nc1-c1ccccc1)c1cccs1 ZINC000238128564 854145419 /nfs/dbraw/zinc/14/54/19/854145419.db2.gz JVAFVYRXTQGTMK-UHFFFAOYSA-N 0 3 402.523 4.120 20 0 HIADHN COc1cccc([C@@H](CNC(=O)Cc2coc3cc4c(cc23)CCC4)N2CCCC2)c1 ZINC000248265187 854188954 /nfs/dbraw/zinc/18/89/54/854188954.db2.gz YWHZREFYDKOPOP-XMMPIXPASA-N 0 3 418.537 4.426 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@H](c1ccc(F)cc1)[C@H]1CCCO1)c1ccsc1 ZINC000250046362 854192976 /nfs/dbraw/zinc/19/29/76/854192976.db2.gz VXHOKXOPYOHGDG-NJDAHSKKSA-N 0 3 419.566 4.490 20 0 HIADHN COc1ccc([C@@H](CNC(=O)Cc2coc3cc4c(cc23)CCC4)N2CCCC2)cc1 ZINC000255941410 854224901 /nfs/dbraw/zinc/22/49/01/854224901.db2.gz RBDVHOAMLKLDEI-XMMPIXPASA-N 0 3 418.537 4.426 20 0 HIADHN CC[C@H](C)c1ccccc1NC(=O)[C@H](C)NC[C@H](c1cccs1)N1CCOCC1 ZINC000255953260 854228949 /nfs/dbraw/zinc/22/89/49/854228949.db2.gz OBHBNKQQQLCPIM-BBTUJRGHSA-N 0 3 415.603 4.252 20 0 HIADHN COc1cc(CCC2CCN(Cc3cnc4c(c3)c(C)nn4C)CC2)cc(OC)c1 ZINC000261372591 854237494 /nfs/dbraw/zinc/23/74/94/854237494.db2.gz QZQRYHMGAWYWTO-UHFFFAOYSA-N 0 3 408.546 4.139 20 0 HIADHN COc1ccccc1[C@H](CNc1nc(C(F)(F)F)nc2nc[nH]c21)N1CCCCC1 ZINC000301072401 854287823 /nfs/dbraw/zinc/28/78/23/854287823.db2.gz HJBJHSQRLDMICT-AWEZNQCLSA-N 0 3 420.439 4.019 20 0 HIADHN O=C(NC1CC1)c1cc(NC[C@H](c2ccco2)N2CCCCC2)nc2ccccc21 ZINC000301080088 854289856 /nfs/dbraw/zinc/28/98/56/854289856.db2.gz SNTZLMDFVBFOPQ-OAQYLSRUSA-N 0 3 404.514 4.359 20 0 HIADHN COc1cccc([C@H](CNc2ccc3nnc(-c4ccccc4)n3n2)N2CCCC2)c1 ZINC000301152478 854313547 /nfs/dbraw/zinc/31/35/47/854313547.db2.gz LBYVYZJWSGTTIZ-NRFANRHFSA-N 0 3 414.513 4.049 20 0 HIADHN c1ccc(-c2nnc3ccc(Nc4cccc(CN5CCSCC5)c4)nn32)cc1 ZINC000301190238 854324819 /nfs/dbraw/zinc/32/48/19/854324819.db2.gz LKGRBBIRUORPNO-UHFFFAOYSA-N 0 3 402.527 4.084 20 0 HIADHN FC(F)(F)c1cc(NCC2CCN(Cc3ccccc3Cl)CC2)n2ncnc2n1 ZINC000301197803 854325664 /nfs/dbraw/zinc/32/56/64/854325664.db2.gz OSMABYVYBAAFNK-UHFFFAOYSA-N 0 3 424.858 4.121 20 0 HIADHN C[C@@H](CNc1ncccc1C(=O)N1CCc2ccccc21)N1CCc2ccccc2C1 ZINC000301336543 854363522 /nfs/dbraw/zinc/36/35/22/854363522.db2.gz DELHKBGKJAKMDM-IBGZPJMESA-N 0 3 412.537 4.143 20 0 HIADHN Cc1nc2ccc(Br)cc2c(N2CCC(C(=O)N3CCCC3)CC2)c1C ZINC000301371156 854373708 /nfs/dbraw/zinc/37/37/08/854373708.db2.gz STMGHJROWJBLQJ-UHFFFAOYSA-N 0 3 416.363 4.453 20 0 HIADHN COc1ccccc1OCCC(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1 ZINC000301383063 854377921 /nfs/dbraw/zinc/37/79/21/854377921.db2.gz AUOBENVYLKSYRU-SFHVURJKSA-N 0 3 402.560 4.115 20 0 HIADHN COc1ccccc1[C@@H](CNc1ncnc2nc(SC)sc21)N1CCCC1 ZINC000301501202 854408806 /nfs/dbraw/zinc/40/88/06/854408806.db2.gz DWELBMDJMGPROL-CQSZACIVSA-N 0 3 401.561 4.066 20 0 HIADHN C[C@@H]1CN(CCC2CCN(c3nc(C(F)F)nc4ccccc43)CC2)C[C@@H](C)O1 ZINC000301536077 854415158 /nfs/dbraw/zinc/41/51/58/854415158.db2.gz IXBYIGNXWVZFLK-HZPDHXFCSA-N 0 3 404.505 4.283 20 0 HIADHN CCC[C@H]1CN(c2ccc(-c3nc(C)c(C)c(=O)[n-]3)cn2)CC[N@@H+]1Cc1ccccc1 ZINC000301996896 854513025 /nfs/dbraw/zinc/51/30/25/854513025.db2.gz HVNCVBRVIZZOLA-QFIPXVFZSA-N 0 3 417.557 4.352 20 0 HIADHN CCC[C@H]1CN(c2ccc(-c3nc(C)c(C)c(=O)[n-]3)cn2)CC[N@H+]1Cc1ccccc1 ZINC000301996896 854513027 /nfs/dbraw/zinc/51/30/27/854513027.db2.gz HVNCVBRVIZZOLA-QFIPXVFZSA-N 0 3 417.557 4.352 20 0 HIADHN COc1cccc([C@H]2[C@@H](Nc3cc(C)nc(-c4cccnc4)n3)CCN2C2CC2)c1 ZINC000302016129 854516259 /nfs/dbraw/zinc/51/62/59/854516259.db2.gz CCBWFAPKFPIRBZ-GMAHTHKFSA-N 0 3 401.514 4.246 20 0 HIADHN COc1ccc([C@@H](CNc2ccnc3ccc(C)cc32)N2CCOCC2)cc1OC ZINC000302179721 854544199 /nfs/dbraw/zinc/54/41/99/854544199.db2.gz YUQNPOMPLVEACS-JOCHJYFZSA-N 0 3 407.514 4.046 20 0 HIADHN CC(=O)N[C@@H](C)C1CCN(c2c(C)c(C)nc3ccc(Br)cc32)CC1 ZINC000302370187 854564530 /nfs/dbraw/zinc/56/45/30/854564530.db2.gz GOYMOSVNLCQRAB-AWEZNQCLSA-N 0 3 404.352 4.355 20 0 HIADHN COCCCN1CCC(Nc2nn3cc(-c4ccc(Cl)cc4)nc3s2)CC1 ZINC000302498727 854577190 /nfs/dbraw/zinc/57/71/90/854577190.db2.gz KTPPRRFUXPAJDE-UHFFFAOYSA-N 0 3 405.955 4.024 20 0 HIADHN C[C@@H](CCN1CCN(C)CC1)Nc1ccnc2c(Cl)cc(Br)cc12 ZINC000302779313 854632566 /nfs/dbraw/zinc/63/25/66/854632566.db2.gz HQRJJRPUIMIMEW-ZDUSSCGKSA-N 0 3 411.775 4.089 20 0 HIADHN COc1ccc(SCCC(=O)NC[C@@H](c2ccc(OC)cc2)N2CCCC2)cc1 ZINC000302886891 854665696 /nfs/dbraw/zinc/66/56/96/854665696.db2.gz CTIDQAFVSBVKBU-QFIPXVFZSA-N 0 3 414.571 4.139 20 0 HIADHN Cc1occc1-c1nn(CN2CCN(CC(C)C)CC2)c(=S)n1-c1ccccc1 ZINC000302978048 854705827 /nfs/dbraw/zinc/70/58/27/854705827.db2.gz SLJUFRLQLOWMMW-UHFFFAOYSA-N 0 3 411.575 4.203 20 0 HIADHN Cc1ccc(-c2nc(C(=O)N(CCN(C)C)Cc3ccc(F)cc3F)cs2)o1 ZINC000303001886 854718280 /nfs/dbraw/zinc/71/82/80/854718280.db2.gz OLARHMNPOJZVSQ-UHFFFAOYSA-N 0 3 405.470 4.194 20 0 HIADHN CN(C)CCN(C[C@H]1CCCO1)C(=O)Nc1ccc(N(C)C2CCCCC2)c(F)c1 ZINC000303025965 854728914 /nfs/dbraw/zinc/72/89/14/854728914.db2.gz ODXJBJCBCLIQBG-HXUWFJFHSA-N 0 3 420.573 4.169 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)c1cc2ccc(Br)cc2[nH]1 ZINC000303048188 854738465 /nfs/dbraw/zinc/73/84/65/854738465.db2.gz IMSSWJZKOXJKIE-UHFFFAOYSA-N 0 3 400.320 4.134 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)c1cccc(Br)c1 ZINC000303056529 854741333 /nfs/dbraw/zinc/74/13/33/854741333.db2.gz SVXZCERYGKVTCT-UHFFFAOYSA-N 0 3 405.361 4.293 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)c1cc(-c2cccc(Cl)c2)no1 ZINC000303060872 854743772 /nfs/dbraw/zinc/74/37/72/854743772.db2.gz YEBVHPZKFXYUBW-UHFFFAOYSA-N 0 3 401.869 4.338 20 0 HIADHN O=C(Nc1ccnn1CCc1ccccc1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000303105716 854763473 /nfs/dbraw/zinc/76/34/73/854763473.db2.gz DUKDYSOUKCCEAI-NRFANRHFSA-N 0 3 406.505 4.116 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N3CCCCC[C@@H]3c3cccn3C)cc2)CC1 ZINC000303126950 854773685 /nfs/dbraw/zinc/77/36/85/854773685.db2.gz RASIVWLIMIPGOO-XMMPIXPASA-N 0 3 408.590 4.313 20 0 HIADHN CCCN(C(=O)c1ccc2c(c1)CCN2C(C)=O)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000303129675 854774526 /nfs/dbraw/zinc/77/45/26/854774526.db2.gz OYBAAOZLNKRAQT-XMMPIXPASA-N 0 3 419.569 4.112 20 0 HIADHN Cc1ccccc1COc1cccc(CC(=O)NCc2ccccc2CN(C)C)c1 ZINC000303241812 854831794 /nfs/dbraw/zinc/83/17/94/854831794.db2.gz BVSLDXCQLIGKHU-UHFFFAOYSA-N 0 3 402.538 4.495 20 0 HIADHN CN(C)Cc1cccc(NC(=O)CCC[S@](=O)c2ccc(Br)cc2)c1 ZINC000303440911 854940142 /nfs/dbraw/zinc/94/01/42/854940142.db2.gz FSQOOYYCSMLQAB-VWLOTQADSA-N 0 3 423.376 4.037 20 0 HIADHN C[C@H](CNC(=O)N(Cc1ccccc1)CC1CCOCC1)N(C)Cc1ccccc1 ZINC000303449135 854948715 /nfs/dbraw/zinc/94/87/15/854948715.db2.gz HVLWDICVCMCCIC-OAQYLSRUSA-N 0 3 409.574 4.145 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCCC1)c1ccc(SC(F)F)cc1 ZINC000303450593 854949266 /nfs/dbraw/zinc/94/92/66/854949266.db2.gz KJUYEPNVFRJURW-UHFFFAOYSA-N 0 3 400.560 4.483 20 0 HIADHN CCc1cccc2c(CCNC(=O)NC[C@H](c3cccs3)N3CCCC3)c[nH]c21 ZINC000303455733 854955338 /nfs/dbraw/zinc/95/53/38/854955338.db2.gz JVFQNPIADYAYJF-HXUWFJFHSA-N 0 3 410.587 4.471 20 0 HIADHN CCS[C@H]1CCCCN(C(=O)Nc2ccc(CCN3CCSCC3)cc2)C1 ZINC000303460854 854960780 /nfs/dbraw/zinc/96/07/80/854960780.db2.gz ODIUGBJWBIYIQG-FQEVSTJZSA-N 0 3 407.649 4.417 20 0 HIADHN COC(=O)Nc1cccc(C(=O)N(CCN2CCCC2)Cc2ccc(Cl)cc2)c1 ZINC000303478806 854973687 /nfs/dbraw/zinc/97/36/87/854973687.db2.gz JYRSFTXSNOZVMM-UHFFFAOYSA-N 0 3 415.921 4.257 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)Nc1cccc(CN2CCCCC2=O)c1 ZINC000303512255 855000449 /nfs/dbraw/zinc/00/04/49/855000449.db2.gz CMOYKMWHFCEQHL-UHFFFAOYSA-N 0 3 405.498 4.259 20 0 HIADHN C[C@H](CNC(=O)C1(c2ccccc2Cl)CCOCC1)N(C)Cc1ccccc1 ZINC000303541574 855026784 /nfs/dbraw/zinc/02/67/84/855026784.db2.gz YOXBKQCKNVIUID-GOSISDBHSA-N 0 3 400.950 4.025 20 0 HIADHN COc1cc(F)c([C@@H](C)NC(=O)c2oc3ccccc3c2CN(C)C)cc1OC ZINC000303546995 855032996 /nfs/dbraw/zinc/03/29/96/855032996.db2.gz LCPCWKJIDMMEHJ-CYBMUJFWSA-N 0 3 400.450 4.142 20 0 HIADHN CC(C)(C)c1ccc([C@H](O)CNC(=O)N[C@@H](CN2CCCC2)c2ccccc2)cc1 ZINC000303635685 855092232 /nfs/dbraw/zinc/09/22/32/855092232.db2.gz GSELMSZAIUOREN-XZOQPEGZSA-N 0 3 409.574 4.154 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N2CCC(C(F)(F)F)(C(F)(F)F)C2)N(C)C)cc1 ZINC000303640035 855097039 /nfs/dbraw/zinc/09/70/39/855097039.db2.gz AXAJNOBVNCTXHE-AWEZNQCLSA-N 0 3 411.390 4.124 20 0 HIADHN Cc1ccc(N2CCCC2)c(C(=O)NCC2(N3CCSCC3)CCCCC2)c1 ZINC000303700519 855139814 /nfs/dbraw/zinc/13/98/14/855139814.db2.gz XBWNFHJNFMKHTK-UHFFFAOYSA-N 0 3 401.620 4.077 20 0 HIADHN CN(C)CCN(C[C@H]1CCCO1)C(=O)Nc1cc(F)ccc1Oc1ccccc1 ZINC000303725036 855152327 /nfs/dbraw/zinc/15/23/27/855152327.db2.gz SOCZXZIJUUXBCM-LJQANCHMSA-N 0 3 401.482 4.193 20 0 HIADHN Cc1ccnc(-c2ccc(NC(=O)[C@H]3CCCN(Cc4cccc(F)c4)C3)cc2)n1 ZINC000303733754 855159048 /nfs/dbraw/zinc/15/90/48/855159048.db2.gz WAPIQCSJJSLTTM-FQEVSTJZSA-N 0 3 404.489 4.442 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)NCc1cccc(OCC(F)F)c1 ZINC000303787643 855198727 /nfs/dbraw/zinc/19/87/27/855198727.db2.gz DUYAHWRJERKBLD-SFHVURJKSA-N 0 3 417.500 4.137 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)Cc1coc(-c2ccc(F)cc2)n1 ZINC000303808536 855212672 /nfs/dbraw/zinc/21/26/72/855212672.db2.gz IAWOHFDHENRJBG-SFHVURJKSA-N 0 3 407.489 4.146 20 0 HIADHN CCCN(Cc1nc2cc(Cl)ccc2c(=O)[nH]1)C(=O)c1cccc(CN(C)C)c1 ZINC000303838268 855236122 /nfs/dbraw/zinc/23/61/22/855236122.db2.gz IMTJEVSJECUADE-UHFFFAOYSA-N 0 3 412.921 4.103 20 0 HIADHN O=C(Nc1ccc(N2CCSCC2)cc1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000303874546 855263611 /nfs/dbraw/zinc/26/36/11/855263611.db2.gz IPXMIEPRABUZAQ-IBGZPJMESA-N 0 3 413.562 4.230 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)NCc1ccnc(OC2CCCC2)c1 ZINC000303884613 855269846 /nfs/dbraw/zinc/26/98/46/855269846.db2.gz RJQPYNPIOGUNHF-FQEVSTJZSA-N 0 3 422.573 4.209 20 0 HIADHN COc1ccc(CN2CCCN(c3cc(Br)ccc3[N+](=O)[O-])CC2)cc1 ZINC000303924441 855294487 /nfs/dbraw/zinc/29/44/87/855294487.db2.gz PIVVEMUAKPEOJA-UHFFFAOYSA-N 0 3 420.307 4.078 20 0 HIADHN CN1CCN(CCCNC(=O)c2ccc(F)cc2-c2ccc(Cl)c(Cl)c2)CC1 ZINC000303957648 855320286 /nfs/dbraw/zinc/32/02/86/855320286.db2.gz VMANNMPEWZHWRR-UHFFFAOYSA-N 0 3 424.347 4.167 20 0 HIADHN COc1ccc(CNC2CCC(NC(=O)OC(C)(C)C)CC2)c(Br)c1 ZINC000310676301 855365964 /nfs/dbraw/zinc/36/59/64/855365964.db2.gz KCXIZUSECGMHOO-UHFFFAOYSA-N 0 3 413.356 4.383 20 0 HIADHN COc1ccc(Br)c(CN[C@@](C)(CNC(=O)OC(C)(C)C)C(C)C)c1 ZINC000310602196 855366067 /nfs/dbraw/zinc/36/60/67/855366067.db2.gz OLCCIDJPAJMZAS-IBGZPJMESA-N 0 3 415.372 4.487 20 0 HIADHN CC[C@@H](C)[C@H](CNCc1cc(Br)cc(Br)c1OC)OC ZINC000381106574 855430479 /nfs/dbraw/zinc/43/04/79/855430479.db2.gz BEKMEDAWUXGJHM-YGRLFVJLSA-N 0 3 409.162 4.371 20 0 HIADHN C[C@@H]1CCN(C(=O)c2ccc(Br)c(F)c2)CCN1Cc1ccccc1 ZINC000383040487 855435895 /nfs/dbraw/zinc/43/58/95/855435895.db2.gz AGSLKUMKYGSVQF-OAHLLOKOSA-N 0 3 405.311 4.325 20 0 HIADHN Cc1c(Br)cccc1C(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000388882541 855449167 /nfs/dbraw/zinc/44/91/67/855449167.db2.gz QXVJAUSRACXUNG-GOSISDBHSA-N 0 3 401.348 4.494 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)c1cc(Cl)ccc1Br ZINC000390738835 855456233 /nfs/dbraw/zinc/45/62/33/855456233.db2.gz AKRZUERPIRXXOZ-INIZCTEOSA-N 0 3 407.739 4.497 20 0 HIADHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(Br)cc1C(F)(F)F ZINC000394366386 855470007 /nfs/dbraw/zinc/47/00/07/855470007.db2.gz PUCVPMSSTKUABM-OLZOCXBDSA-N 0 3 405.258 4.167 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)c2cccc(Br)c2Cl)CN1Cc1ccccc1 ZINC000398139989 855476534 /nfs/dbraw/zinc/47/65/34/855476534.db2.gz NYGBQPYSKFTDGS-DZGCQCFKSA-N 0 3 407.739 4.495 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)c2ccc(Cl)cc2Br)CN1Cc1ccccc1 ZINC000398163078 855476646 /nfs/dbraw/zinc/47/66/46/855476646.db2.gz WLACXCIGRUHWDC-XJKSGUPXSA-N 0 3 407.739 4.495 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)Nc1ccc(F)cc1Cl ZINC000409701158 855609312 /nfs/dbraw/zinc/60/93/12/855609312.db2.gz ZTVAFDKBTWKZSI-UHFFFAOYSA-N 0 3 404.917 4.203 20 0 HIADHN CC[C@H](C)n1ncc2c1nc(C)cc2C(=O)N(CCCc1ccccc1)CCN(C)C ZINC000409704719 855611645 /nfs/dbraw/zinc/61/16/45/855611645.db2.gz LAZWZOQJKPPFBE-FQEVSTJZSA-N 0 3 421.589 4.347 20 0 HIADHN Cc1cc(NC(=O)CCCC2CCOCC2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000409833261 855678634 /nfs/dbraw/zinc/67/86/34/855678634.db2.gz AKWYWMKJRZXRNC-QFIPXVFZSA-N 0 3 410.562 4.174 20 0 HIADHN O=C(NCc1ccc2c(c1)OCO2)[C@@H](NC[C@@H]1CCCC(F)(F)C1)c1ccccc1 ZINC000409865428 855694895 /nfs/dbraw/zinc/69/48/95/855694895.db2.gz FANFONVPKFOTOD-UTKZUKDTSA-N 0 3 416.468 4.188 20 0 HIADHN CN1CC[C@@H](NC(=O)[C@@H]2CCO[C@H]2c2ccc(Cl)c(F)c2)[C@@H]1c1ccccc1 ZINC000409884527 855705953 /nfs/dbraw/zinc/70/59/53/855705953.db2.gz TXQLQDNZNPWWNO-DBOLQNLKSA-N 0 3 402.897 4.118 20 0 HIADHN O=C(N1CCN(CC2CCCCC2)CC1)C1(c2ccccc2Cl)CCOCC1 ZINC000409891524 855709250 /nfs/dbraw/zinc/70/92/50/855709250.db2.gz HPZIUKDGSVQBIU-UHFFFAOYSA-N 0 3 404.982 4.113 20 0 HIADHN CN(C)Cc1cccc(NC(=O)N[C@@H]2CCOc3c(Br)cccc32)c1 ZINC000410054348 855803457 /nfs/dbraw/zinc/80/34/57/855803457.db2.gz JMCFJZNAJVAWJK-QGZVFWFLSA-N 0 3 404.308 4.156 20 0 HIADHN CN1CCN(Cc2ccc(CNC(=O)N[C@H](c3ccccc3)C(C)(C)C)cc2)CC1 ZINC000410351657 855943826 /nfs/dbraw/zinc/94/38/26/855943826.db2.gz MIRPDLMDHHZOIQ-HSZRJFAPSA-N 0 3 408.590 4.021 20 0 HIADHN CC[C@@H](NC(=O)NCc1ccc(CN2CCN(C)CC2)cc1)c1cccc(Cl)c1 ZINC000410366350 855953925 /nfs/dbraw/zinc/95/39/25/855953925.db2.gz GWUSAMRJZCTXKN-JOCHJYFZSA-N 0 3 414.981 4.038 20 0 HIADHN CC[C@H](CSc1ccc(C)c(C)c1)NC(=O)N1CCN(C2CCOCC2)C[C@H]1C ZINC000425914010 855995817 /nfs/dbraw/zinc/99/58/17/855995817.db2.gz DRCYCOQBHDOIIG-WOJBJXKFSA-N 0 3 419.635 4.069 20 0 HIADHN CCC(CC)[C@H](CCNC(=O)Nc1ccc(N2CCN(CC)CC2)cc1C)OC ZINC000437400037 862747574 /nfs/dbraw/zinc/74/75/74/862747574.db2.gz GZSVAPMPCIRIFH-QFIPXVFZSA-N 0 3 404.599 4.100 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)N1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000426021579 856052045 /nfs/dbraw/zinc/05/20/45/856052045.db2.gz OGHRNNIHHWYBLR-HOTGVXAUSA-N 0 3 409.958 4.092 20 0 HIADHN CC[C@H](C)[C@H](NC(=O)N1CCN(C2CCOCC2)C[C@H]1C)c1ccc(Cl)cc1 ZINC000426025259 856055086 /nfs/dbraw/zinc/05/50/86/856055086.db2.gz YSIGQGRLKYPCFO-FVJLSDCUSA-N 0 3 407.986 4.322 20 0 HIADHN CCN(CCN[C@@H](C)c1ccccc1I)CCC(F)(F)F ZINC000426031787 856058944 /nfs/dbraw/zinc/05/89/44/856058944.db2.gz ULYBLDGGIMGSQN-LBPRGKRZSA-N 0 3 414.253 4.216 20 0 HIADHN Cc1ccc([C@H]2C[C@H](C)N(C(=O)NCc3ccccc3CN3CCC(O)CC3)C2)cc1 ZINC000426041627 856067180 /nfs/dbraw/zinc/06/71/80/856067180.db2.gz GNDRFGPVCGZRKN-RDPSFJRHSA-N 0 3 421.585 4.039 20 0 HIADHN COc1ccccc1[C@H](NC(=O)NCCCN1CCc2ccccc2C1)c1ccco1 ZINC000426045961 856070599 /nfs/dbraw/zinc/07/05/99/856070599.db2.gz DAZWNBPUFBIFQU-DEOSSOPVSA-N 0 3 419.525 4.125 20 0 HIADHN Nc1nc(C2CCCC2)ncc1-c1noc([C@@H]2CCCN(Cc3cccc(F)c3)C2)n1 ZINC000426190155 856166087 /nfs/dbraw/zinc/16/60/87/856166087.db2.gz DTQUJQCXHYPHAM-QGZVFWFLSA-N 0 3 422.508 4.285 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)NCc1ccnc(Oc2ccccc2F)c1 ZINC000426215816 856181814 /nfs/dbraw/zinc/18/18/14/856181814.db2.gz SAXFIFMCARRXNV-GOSISDBHSA-N 0 3 422.504 4.333 20 0 HIADHN C[C@H]1CN(C2CCOCC2)CCN1C(=O)N[C@H]1C[C@H]2CCC(C)(C)c3cccc1c32 ZINC000426217225 856182784 /nfs/dbraw/zinc/18/27/84/856182784.db2.gz XMMOQMIOJROZQB-SVMVAKDDSA-N 0 3 411.590 4.181 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)NC12CCC(C(F)(F)F)(CC1)CC2 ZINC000426246893 856200632 /nfs/dbraw/zinc/20/06/32/856200632.db2.gz WTWZJXNVMWDEOG-GYIPLFPLSA-N 0 3 409.496 4.461 20 0 HIADHN CC(C)[C@@H](NC(=O)N1CCN(C2CCOCC2)C[C@H]1C)c1ccc(Cl)cc1F ZINC000426251601 856202984 /nfs/dbraw/zinc/20/29/84/856202984.db2.gz MAGFPCMUTUBIHK-FOIQADDNSA-N 0 3 411.949 4.071 20 0 HIADHN C[C@H](CC(=O)Nc1ccc(C(=O)NCCN2CCCC2)cc1)c1c[nH]c2ccccc21 ZINC000426288216 856223158 /nfs/dbraw/zinc/22/31/58/856223158.db2.gz BAGUCBDRCNOYJY-GOSISDBHSA-N 0 3 418.541 4.126 20 0 HIADHN Cc1ccc2c(c1)[C@H](N[C@H](C)c1ccc(Br)c(S(N)(=O)=O)c1)CCC2 ZINC000426294102 856226696 /nfs/dbraw/zinc/22/66/96/856226696.db2.gz SKNMXQFWZYWVSJ-FZKQIMNGSA-N 0 3 423.376 4.133 20 0 HIADHN COc1ccccc1[C@@H](NC(=O)NC[C@@H](c1ccc(C)cc1)N(C)C)c1ccco1 ZINC000426314794 856239812 /nfs/dbraw/zinc/23/98/12/856239812.db2.gz YGKWLJUREDQLCH-NZQKXSOJSA-N 0 3 407.514 4.288 20 0 HIADHN CC(C)CN(CCN(C)C)C(=O)Nc1cccc(C[S@](=O)c2ccccc2)c1 ZINC000426542838 856340361 /nfs/dbraw/zinc/34/03/61/856340361.db2.gz FYSJGLXSLYLLHI-NDEPHWFRSA-N 0 3 401.576 4.046 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)N[C@H]1CCCC(F)(F)C1 ZINC000426585619 856360833 /nfs/dbraw/zinc/36/08/33/856360833.db2.gz GDFBBJSKVCGDHT-INIZCTEOSA-N 0 3 407.427 4.357 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)N[C@@H]1CCCC(F)(F)C1 ZINC000426585620 856361345 /nfs/dbraw/zinc/36/13/45/856361345.db2.gz GDFBBJSKVCGDHT-MRXNPFEDSA-N 0 3 407.427 4.357 20 0 HIADHN CCN(C(=O)Cc1noc([C@@H]2CN(C(C)(C)C)C[C@H]2C(F)(F)F)n1)c1ccccc1 ZINC000426601549 856368191 /nfs/dbraw/zinc/36/81/91/856368191.db2.gz WODGAGUJFAGASP-HZPDHXFCSA-N 0 3 424.467 4.041 20 0 HIADHN COCCOc1ccc(C(F)(F)F)cc1NC(=O)[C@H](C)N1C[C@@H]2CCCC[C@@H]2C1 ZINC000426769039 856468061 /nfs/dbraw/zinc/46/80/61/856468061.db2.gz FKTBRIYPGHCXSE-HRCADAONSA-N 0 3 414.468 4.180 20 0 HIADHN C[C@@H]1CN(CCC2CCN(Cc3nc4ccccc4n3C(F)F)CC2)C[C@@H](C)O1 ZINC000426782854 856475260 /nfs/dbraw/zinc/47/52/60/856475260.db2.gz HWPIYSIEGUZDHK-IAGOWNOFSA-N 0 3 406.521 4.143 20 0 HIADHN C[C@H](c1cccc(N2CCCS2(=O)=O)c1)N(C)Cc1cc(F)cc2cccnc21 ZINC000426807468 856489208 /nfs/dbraw/zinc/48/92/08/856489208.db2.gz HXCUYJGHCPFBOX-MRXNPFEDSA-N 0 3 413.518 4.107 20 0 HIADHN COc1ccccc1[C@@H](NC(=O)N1CCCN(Cc2ccccc2)CC1)c1ccco1 ZINC000426813208 856493467 /nfs/dbraw/zinc/49/34/67/856493467.db2.gz VEYVGDAMBQFMGQ-XMMPIXPASA-N 0 3 419.525 4.295 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)NCc1ccnc(Oc2ccccc2F)c1 ZINC000426850787 856511945 /nfs/dbraw/zinc/51/19/45/856511945.db2.gz KFGDBFOTTQNVEQ-UHFFFAOYSA-N 0 3 422.504 4.286 20 0 HIADHN C[C@H](NC(=O)N1CCCN(Cc2ccccc2)CC1)c1nc(C(F)(F)F)cs1 ZINC000426895462 856531211 /nfs/dbraw/zinc/53/12/11/856531211.db2.gz HYCLNQULYFWRTH-AWEZNQCLSA-N 0 3 412.481 4.140 20 0 HIADHN CN(C)Cc1cccc(C(=O)Nc2cccc(-c3cn(Cc4ccccc4)nn3)c2)c1 ZINC000426944279 856554522 /nfs/dbraw/zinc/55/45/22/856554522.db2.gz HHNLDNLGTOTOGH-UHFFFAOYSA-N 0 3 411.509 4.307 20 0 HIADHN CC[C@@H](C)Oc1ccc(C(=O)Nc2ccc(C(=O)N(C)[C@H]3CCCN(C)C3)cc2)cc1 ZINC000426947155 856557271 /nfs/dbraw/zinc/55/72/71/856557271.db2.gz BPFRNVLNWSRPGR-GCJKJVERSA-N 0 3 423.557 4.282 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000427171925 856689478 /nfs/dbraw/zinc/68/94/78/856689478.db2.gz OXIPTSALXBNABS-QZTJIDSGSA-N 0 3 404.963 4.348 20 0 HIADHN Cc1ccc(CCCCC(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)cc1 ZINC000427292482 856755526 /nfs/dbraw/zinc/75/55/26/856755526.db2.gz QSBXNZOFRDROQA-FGZHOGPDSA-N 0 3 400.607 4.446 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3cnc(-c4ccsc4)s3)CC2)C[C@@H](C)O1 ZINC000427291851 856755624 /nfs/dbraw/zinc/75/56/24/856755624.db2.gz KLFLIHNXRYAZLD-HZPDHXFCSA-N 0 3 419.616 4.223 20 0 HIADHN C[C@@H](CC(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1)Cc1cccc(F)c1 ZINC000427298502 856758521 /nfs/dbraw/zinc/75/85/21/856758521.db2.gz CXYPGVROQPTAGK-AQNXPRMDSA-N 0 3 404.570 4.132 20 0 HIADHN C[C@H](CCc1ccccc1F)C(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000427304005 856760722 /nfs/dbraw/zinc/76/07/22/856760722.db2.gz GGLXDIJMJJWPGY-AQNXPRMDSA-N 0 3 404.570 4.132 20 0 HIADHN Cc1cc(OC(F)F)c(C(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)s1 ZINC000427313872 856765557 /nfs/dbraw/zinc/76/55/57/856765557.db2.gz OIDQNWGDZBVTBW-KBPBESRZSA-N 0 3 416.534 4.009 20 0 HIADHN Cc1cc(C(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)c(C)n1-c1nccs1 ZINC000437472585 862834388 /nfs/dbraw/zinc/83/43/88/862834388.db2.gz MWJQBWIEJMYXRP-QGZVFWFLSA-N 0 3 408.571 4.287 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3cc4ccc(Cl)cc4[nH]3)CC2)C[C@H](C)O1 ZINC000427329597 856774769 /nfs/dbraw/zinc/77/47/69/856774769.db2.gz LBTWAMJTPIAGNR-IYBDPMFKSA-N 0 3 403.954 4.173 20 0 HIADHN Cc1nc(-c2ccccc2)ccc1C(=O)N1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000427330947 856775480 /nfs/dbraw/zinc/77/54/80/856775480.db2.gz OBNUPVOJFWSFQO-PMACEKPBSA-N 0 3 421.585 4.409 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3cc(F)c(Cl)cc3Cl)CC2)C[C@H](C)O1 ZINC000427333074 856776878 /nfs/dbraw/zinc/77/68/78/856776878.db2.gz XAWAEJMDNTZARS-OKILXGFUSA-N 0 3 417.352 4.484 20 0 HIADHN CCCN(CC)C(=O)c1ccc(C(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)cc1 ZINC000437482980 862840817 /nfs/dbraw/zinc/84/08/17/862840817.db2.gz FPUSGSOGJCOINT-NRFANRHFSA-N 0 3 421.585 4.295 20 0 HIADHN CCN1CCN(Cc2ccc(N[C@@H](C)c3ncc(Br)cc3F)cc2)CC1 ZINC000427527739 856850621 /nfs/dbraw/zinc/85/06/21/856850621.db2.gz LPHJWGCYTBKTFI-HNNXBMFYSA-N 0 3 421.358 4.294 20 0 HIADHN C[C@@H]1C[C@@H]1C(=O)Nc1cccc(C(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)c1 ZINC000437492415 862849890 /nfs/dbraw/zinc/84/98/90/862849890.db2.gz GAYHDVZOSNXHLZ-PWHSHALESA-N 0 3 405.542 4.018 20 0 HIADHN O=C1C[C@H](N[C@@H]2CCCc3ncc(C(F)(F)F)cc32)CN1[C@H]1C[C@@H]1c1ccccc1 ZINC000427711166 856919251 /nfs/dbraw/zinc/91/92/51/856919251.db2.gz RSFLJLJUBAOZJS-NLEAXPPASA-N 0 3 415.459 4.224 20 0 HIADHN CN(C)CCN(Cc1cccc(O)c1)C(=O)c1cc(Cl)cc(C(F)(F)F)c1 ZINC000427761670 856943350 /nfs/dbraw/zinc/94/33/50/856943350.db2.gz PSXBOAGITBDBIY-UHFFFAOYSA-N 0 3 400.828 4.268 20 0 HIADHN Fc1ccc(Br)cc1[C@@H](N[C@H]1CCn2ccnc2C1)c1ccccc1 ZINC000427875398 856990125 /nfs/dbraw/zinc/99/01/25/856990125.db2.gz SZKBVPLKGVEFMX-JXFKEZNVSA-N 0 3 400.295 4.479 20 0 HIADHN Fc1cc(Br)ccc1[C@@H](N[C@@H]1CCn2ccnc2C1)c1ccccc1 ZINC000427886087 856993500 /nfs/dbraw/zinc/99/35/00/856993500.db2.gz YIDWFDIEDMSTPC-UZLBHIALSA-N 0 3 400.295 4.479 20 0 HIADHN Cc1ccc([C@H](NC[C@@H]2CCC(C)(C)O2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000427979815 857030629 /nfs/dbraw/zinc/03/06/29/857030629.db2.gz QGPQTUMOTGZNAK-SIKLNZKXSA-N 0 3 401.572 4.344 20 0 HIADHN Cc1ccc(Br)cc1-c1nnc(N2CCC[C@H]3CN(C)CC[C@@H]32)s1 ZINC000428170497 857095420 /nfs/dbraw/zinc/09/54/20/857095420.db2.gz IWHNGELGCUSTPP-BBRMVZONSA-N 0 3 407.381 4.197 20 0 HIADHN Cc1nc([C@H]2CCCOC2)sc1C(=O)NC[C@@H]1CCCN(Cc2cccs2)C1 ZINC000428200846 857109391 /nfs/dbraw/zinc/10/93/91/857109391.db2.gz QIVOXSHFNOINOF-IRXDYDNUSA-N 0 3 419.616 4.049 20 0 HIADHN CC[C@@]1(CO)CCCN(Cc2c(C)nn(-c3ccc(Br)cc3)c2C)C1 ZINC000428453979 857207680 /nfs/dbraw/zinc/20/76/80/857207680.db2.gz QHSCFFAQNLRFFA-HXUWFJFHSA-N 0 3 406.368 4.236 20 0 HIADHN Cc1ccc(-c2nc(CNC[C@@H]3CN(Cc4ccccc4)CCCO3)cs2)cc1 ZINC000428534150 857247942 /nfs/dbraw/zinc/24/79/42/857247942.db2.gz FGGPHDJJFPKBQV-HSZRJFAPSA-N 0 3 407.583 4.499 20 0 HIADHN CCCOc1ccc(C(=O)Nc2cccc(CN3CC[C@@H](O)C3)c2)c(OCCC)c1 ZINC000428536491 857249073 /nfs/dbraw/zinc/24/90/73/857249073.db2.gz LTZFLBSFMMMDAV-HXUWFJFHSA-N 0 3 412.530 4.083 20 0 HIADHN CCCn1c(C)c(C(=O)Nc2cccc(CN3CC[C@@H](O)C3)c2)c2cc(OC)ccc21 ZINC000428549615 857257797 /nfs/dbraw/zinc/25/77/97/857257797.db2.gz QEQNWTVEUDIYDN-HXUWFJFHSA-N 0 3 421.541 4.187 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)[C@H](Oc1ccccc1)c1ccccc1 ZINC000428550284 857259684 /nfs/dbraw/zinc/25/96/84/857259684.db2.gz QRARRKOCCPFQMF-LADGPHEKSA-N 0 3 402.494 4.012 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)c1cccc(COc2cccc(F)c2)c1 ZINC000428550533 857259780 /nfs/dbraw/zinc/25/97/80/857259780.db2.gz VSOWVGVYYXFINS-QHCPKHFHSA-N 0 3 420.484 4.224 20 0 HIADHN Cc1ccc(-n2ncc(C(=O)Nc3cccc(CN4CC[C@H](O)C4)c3)c2C(C)C)cc1 ZINC000428553541 857262318 /nfs/dbraw/zinc/26/23/18/857262318.db2.gz PLXFSAVVDBXHRE-QFIPXVFZSA-N 0 3 418.541 4.123 20 0 HIADHN Cc1ccc(OCCCC(=O)Nc2cccc(CN3CC[C@H](O)C3)c2)c(Cl)c1 ZINC000428555847 857264883 /nfs/dbraw/zinc/26/48/83/857264883.db2.gz ZZRCODYBKMSUKT-IBGZPJMESA-N 0 3 402.922 4.013 20 0 HIADHN CC[C@@H](NC(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1)c1ccc(F)cc1F ZINC000428633647 857283797 /nfs/dbraw/zinc/28/37/97/857283797.db2.gz PXOZABSHSIOKBM-DENIHFKCSA-N 0 3 417.500 4.006 20 0 HIADHN O=C(NC[C@H]1CN(Cc2ccccc2)CCCO1)Nc1cc(Cl)ccc1Cl ZINC000428701895 857302478 /nfs/dbraw/zinc/30/24/78/857302478.db2.gz QUUGFDPCQIHSPJ-KRWDZBQOSA-N 0 3 408.329 4.406 20 0 HIADHN COC(=O)c1ccoc1CN(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000428773700 857330014 /nfs/dbraw/zinc/33/00/14/857330014.db2.gz RBANGWYFVGHUDZ-QFIPXVFZSA-N 0 3 419.525 4.128 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3ncc(C(C)(C)C)s3)CC2)C[C@@H](C)O1 ZINC000428846291 857370472 /nfs/dbraw/zinc/37/04/72/857370472.db2.gz BTURKAKDQMDNJZ-HZPDHXFCSA-N 0 3 408.612 4.184 20 0 HIADHN CC(C)N(CC(=O)NC1CCN(C(=O)C2CCCCC2)CC1)[C@H](C)c1ccccc1 ZINC000428863851 857377358 /nfs/dbraw/zinc/37/73/58/857377358.db2.gz ZJLNNIMCPQROEP-HXUWFJFHSA-N 0 3 413.606 4.146 20 0 HIADHN Fc1ccc2nc(CNC[C@@H](c3ccc(Cl)cc3)N3CCOCC3)sc2c1 ZINC000428864592 857377549 /nfs/dbraw/zinc/37/75/49/857377549.db2.gz UAXVAJGBHZJCTC-SFHVURJKSA-N 0 3 405.926 4.252 20 0 HIADHN CCCCCn1nc(C)cc1NC(=O)N1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000428891362 857393979 /nfs/dbraw/zinc/39/39/79/857393979.db2.gz XNXKDYNVFGDXQS-PMACEKPBSA-N 0 3 419.614 4.125 20 0 HIADHN CCCCCn1nc(C)cc1NC(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000428891366 857394343 /nfs/dbraw/zinc/39/43/43/857394343.db2.gz XNXKDYNVFGDXQS-WOJBJXKFSA-N 0 3 419.614 4.125 20 0 HIADHN CCc1ccccc1NC(=O)CN1CCN([C@@H]2CC[C@@](C)(c3ccccc3)C2)CC1 ZINC000437593687 862907424 /nfs/dbraw/zinc/90/74/24/862907424.db2.gz UQCJXDULJLZLIJ-ZEQKJWHPSA-N 0 3 405.586 4.316 20 0 HIADHN CO[C@@H](CN[C@@H](CO)c1ccc(Br)c(F)c1)c1ccc(Cl)cc1 ZINC000428992634 857446753 /nfs/dbraw/zinc/44/67/53/857446753.db2.gz KLRHICJKYBPNQO-IRXDYDNUSA-N 0 3 402.691 4.252 20 0 HIADHN CC(C)(C)Oc1ccc(NC(=O)NC[C@H]2CN(Cc3ccccc3)CCCO2)cc1 ZINC000429025064 857462879 /nfs/dbraw/zinc/46/28/79/857462879.db2.gz AYTODKTWEHAMRX-QFIPXVFZSA-N 0 3 411.546 4.277 20 0 HIADHN CC(C)N(Cc1ccccc1F)C(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000429035617 857467283 /nfs/dbraw/zinc/46/72/83/857467283.db2.gz NJZXFDMBMCEJEP-JOCHJYFZSA-N 0 3 413.537 4.037 20 0 HIADHN CC(C)[C@@H](c1ccccc1)N(C)C(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000429036691 857469073 /nfs/dbraw/zinc/46/90/73/857469073.db2.gz UEXBOWAMFFJYJO-ZEQRLZLVSA-N 0 3 409.574 4.316 20 0 HIADHN O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)N1CCCCC[C@H]1c1ccco1 ZINC000429049220 857477606 /nfs/dbraw/zinc/47/76/06/857477606.db2.gz BGJWPMHIUVGUQV-YADHBBJMSA-N 0 3 411.546 4.197 20 0 HIADHN CO[C@H](C)c1cccc(NC(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)c1 ZINC000429060443 857485480 /nfs/dbraw/zinc/48/54/80/857485480.db2.gz PBJLHFJWPNBMKH-CEXWTWQISA-N 0 3 403.567 4.137 20 0 HIADHN CC(C)Oc1ccc(NC(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)cc1 ZINC000429102075 857509932 /nfs/dbraw/zinc/50/99/32/857509932.db2.gz YNIFJRZUUUAKAX-OALUTQOASA-N 0 3 403.567 4.217 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)NC3CCC(C(F)(F)F)CC3)CC2)C[C@H](C)O1 ZINC000429192470 857547690 /nfs/dbraw/zinc/54/76/90/857547690.db2.gz HNOZTEAFRMFLSZ-CCZBSFLLSA-N 0 3 419.532 4.028 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)N[C@H](c3cccs3)C3CC3)CC2)C[C@H](C)O1 ZINC000429210402 857556659 /nfs/dbraw/zinc/55/66/59/857556659.db2.gz YCIPOYIQWRAZFK-FVJLSDCUSA-N 0 3 405.608 4.120 20 0 HIADHN C[C@H](N[C@H]1Cc2cccc(O)c2C1)C(=O)Nc1ccc(OCc2ccccc2)cc1 ZINC000429313489 857600154 /nfs/dbraw/zinc/60/01/54/857600154.db2.gz GOEGUXVQXWHDOK-UWJYYQICSA-N 0 3 402.494 4.055 20 0 HIADHN CCSc1cc(CNC(=O)Nc2ccc(CCN3CCSCC3)cc2)ccn1 ZINC000429350936 857615236 /nfs/dbraw/zinc/61/52/36/857615236.db2.gz DKYSKPXMOCOSLU-UHFFFAOYSA-N 0 3 416.616 4.107 20 0 HIADHN CN(C(=O)NC[C@H](c1ccccc1)C(C)(C)CO)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000437621051 862938107 /nfs/dbraw/zinc/93/81/07/862938107.db2.gz CLRYFJPCJFXKKE-BJKOFHAPSA-N 0 3 423.601 4.095 20 0 HIADHN CCO[C@H]1C[C@H](NC(=O)N(Cc2ccco2)C2CCN(C)CC2)C12CCCCC2 ZINC000429463416 857684264 /nfs/dbraw/zinc/68/42/64/857684264.db2.gz BPNNMYYKGUBGNI-SFTDATJTSA-N 0 3 403.567 4.013 20 0 HIADHN C[C@H]1CCN(C(=O)Nc2ccnn2Cc2ccc(F)cc2)CCN1Cc1ccccc1 ZINC000429589400 857772881 /nfs/dbraw/zinc/77/28/81/857772881.db2.gz IUBSJEWXSSGMAC-IBGZPJMESA-N 0 3 421.520 4.199 20 0 HIADHN Cc1noc(-c2ccccc2)c1NC(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000429602465 857785623 /nfs/dbraw/zinc/78/56/23/857785623.db2.gz PFDMCWJTLINJDO-OAQYLSRUSA-N 0 3 420.513 4.063 20 0 HIADHN Cc1ccc(-c2ncco2)cc1NC(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000429611931 857793005 /nfs/dbraw/zinc/79/30/05/857793005.db2.gz PPKOSNZEXDDAMT-OAQYLSRUSA-N 0 3 420.513 4.063 20 0 HIADHN COC(=O)c1ccc(COc2ccccc2CN2CCC[C@H](n3cccn3)C2)cc1 ZINC000437628362 862951091 /nfs/dbraw/zinc/95/10/91/862951091.db2.gz WCVDSPYWQNOMHQ-QFIPXVFZSA-N 0 3 405.498 4.086 20 0 HIADHN O=C(c1ccc(F)cc1)[C@H]1CCCN(C[C@@H]2CN(Cc3ccccc3)CCCO2)C1 ZINC000429683749 857833346 /nfs/dbraw/zinc/83/33/46/857833346.db2.gz RFYKEWCMFPYOJA-UPVQGACJSA-N 0 3 410.533 4.012 20 0 HIADHN C[C@@H](NC(=O)Nc1ccnn1Cc1c(Cl)cccc1Cl)C1=CCN(C)CC1 ZINC000429735299 857858536 /nfs/dbraw/zinc/85/85/36/857858536.db2.gz DLLUGXUQROLWCM-CYBMUJFWSA-N 0 3 408.333 4.010 20 0 HIADHN CC(C)N1CC[C@H](N[C@@H](C)C(=O)Nc2nccs2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000429791482 857886311 /nfs/dbraw/zinc/88/63/11/857886311.db2.gz VYBAAHQYDPOZNK-AFAVFJNCSA-N 0 3 410.946 4.076 20 0 HIADHN C[C@@H](C(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1)c1ccc2c(c1)OCO2 ZINC000429815197 857894967 /nfs/dbraw/zinc/89/49/67/857894967.db2.gz ZOTYQUFCBDEQDN-OAHLLOKOSA-N 0 3 422.447 4.128 20 0 HIADHN CN(C)C(=O)COc1ccccc1CN1CC[C@@H](Sc2cccc(Cl)c2)C1 ZINC000430192122 858075813 /nfs/dbraw/zinc/07/58/13/858075813.db2.gz ADQNJKDTXBCMBZ-LJQANCHMSA-N 0 3 404.963 4.174 20 0 HIADHN COc1ccc(Br)c(CN(C)C(=O)c2cccc(CN3CCCC3)c2)c1 ZINC000430201670 858080542 /nfs/dbraw/zinc/08/05/42/858080542.db2.gz DSPRTOJUMAMKRV-UHFFFAOYSA-N 0 3 417.347 4.326 20 0 HIADHN Cc1cc([C@H]2CCCN2CCc2nnnn2-c2ccccc2)ccc1Br ZINC000430229412 858089924 /nfs/dbraw/zinc/08/99/24/858089924.db2.gz VGHFXXLZJWFKJY-LJQANCHMSA-N 0 3 412.335 4.113 20 0 HIADHN C[C@@H]1CN(CCC(=O)Nc2ccc(Oc3ccccc3)cc2)C[C@]2(CCO[C@H](C)C2)O1 ZINC000430259864 858099267 /nfs/dbraw/zinc/09/92/67/858099267.db2.gz FXVLARLGOIONRO-UMEGOILYSA-N 0 3 424.541 4.466 20 0 HIADHN C[C@@H]1CN(CCC(=O)Nc2ccccc2Oc2ccccc2)C[C@@]2(CCO[C@H](C)C2)O1 ZINC000430270690 858103586 /nfs/dbraw/zinc/10/35/86/858103586.db2.gz SLRXNSNRFBKJHE-FHAGJXEFSA-N 0 3 424.541 4.466 20 0 HIADHN O=C(N[C@H](CC1CC1)c1cc(F)cc(Br)c1)N1CC[C@H](N2CC=CC2)C1 ZINC000430291302 858110773 /nfs/dbraw/zinc/11/07/73/858110773.db2.gz GEKVSELDMPESFM-RBUKOAKNSA-N 0 3 422.342 4.085 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)NC[C@@]1(Cc2ccc(F)cc2)CCC[C@H]1O ZINC000430481594 858190017 /nfs/dbraw/zinc/19/00/17/858190017.db2.gz GUNZKYUNFQNTIW-RDGATRHJSA-N 0 3 424.516 4.137 20 0 HIADHN Cc1nc(NC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)cc(C2CC2)n1 ZINC000430498519 858201689 /nfs/dbraw/zinc/20/16/89/858201689.db2.gz XAMSHIPWWMHXLR-FQEVSTJZSA-N 0 3 404.436 4.056 20 0 HIADHN CCC[C@H](N[C@@H](C)c1ccc(Br)c(S(N)(=O)=O)c1)c1ccccc1 ZINC000430695573 858272245 /nfs/dbraw/zinc/27/22/45/858272245.db2.gz OCLYMYDZNNVBFC-GUYCJALGSA-N 0 3 411.365 4.289 20 0 HIADHN C[C@@H](N[C@H]1CC(C)(C)c2ccccc21)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000430704710 858274431 /nfs/dbraw/zinc/27/44/31/858274431.db2.gz JJRZUKPHHCQVMR-PXAZEXFGSA-N 0 3 423.376 4.170 20 0 HIADHN Cc1ccccc1[C@H](N[C@@H](C)c1ccc(Br)c(S(N)(=O)=O)c1)C1CC1 ZINC000430725951 858279794 /nfs/dbraw/zinc/27/97/94/858279794.db2.gz YVSCTSABBGYMLL-ORAYPTAESA-N 0 3 423.376 4.207 20 0 HIADHN Cc1ccccc1[C@@H](N[C@@H](C)c1ccc(Br)c(S(N)(=O)=O)c1)C1CC1 ZINC000430725949 858279996 /nfs/dbraw/zinc/27/99/96/858279996.db2.gz YVSCTSABBGYMLL-DJJJIMSYSA-N 0 3 423.376 4.207 20 0 HIADHN C[C@@H]1Oc2ccc(C(=O)C3CCN(CCSCc4ccccc4)CC3)cc2NC1=O ZINC000430734119 858281002 /nfs/dbraw/zinc/28/10/02/858281002.db2.gz KYUQVBBFRUPJKC-KRWDZBQOSA-N 0 3 424.566 4.234 20 0 HIADHN CS(=O)(=O)c1ccc(CNCCSCc2ccccc2)cc1C(F)(F)F ZINC000430774135 858300606 /nfs/dbraw/zinc/30/06/06/858300606.db2.gz YTAPWNYJJQISJL-UHFFFAOYSA-N 0 3 403.491 4.132 20 0 HIADHN C[C@H]1CCN(C(=O)Nc2ccc(C(=O)NC(C)(C)C)cc2)CCN1Cc1ccccc1 ZINC000437675737 863017981 /nfs/dbraw/zinc/01/79/81/863017981.db2.gz HXLLTMGDBATEHV-IBGZPJMESA-N 0 3 422.573 4.343 20 0 HIADHN COCCCOc1cccc(NC(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000431119478 858454755 /nfs/dbraw/zinc/45/47/55/858454755.db2.gz JXFAQJNNUIQGSE-QFIPXVFZSA-N 0 3 411.546 4.230 20 0 HIADHN COCCCOc1cccc(NC(=O)NC[C@@H](c2cccs2)N2CCCC2)c1 ZINC000431134909 858463300 /nfs/dbraw/zinc/46/33/00/858463300.db2.gz ZAXLEKNOAYUGKE-IBGZPJMESA-N 0 3 403.548 4.122 20 0 HIADHN C[C@H]1CCN(C(=O)Nc2cccc(NC(=O)C3CC3)c2)CCN1Cc1ccccc1 ZINC000437686433 863026332 /nfs/dbraw/zinc/02/63/32/863026332.db2.gz HNARZILHWSACDU-SFHVURJKSA-N 0 3 406.530 4.163 20 0 HIADHN O=C1[C@@H]2C[C@@H](C3CCCCC3)CN2C(=O)N1C[C@H]1CCCN(Cc2cccs2)C1 ZINC000431170253 858484787 /nfs/dbraw/zinc/48/47/87/858484787.db2.gz PCPAXWFZSYNZHD-DSKINZAPSA-N 0 3 415.603 4.193 20 0 HIADHN Cc1cc(Cl)cc2c1OCCC[C@@H]2NCc1ccccc1CN1CCOCC1 ZINC000431352995 858575921 /nfs/dbraw/zinc/57/59/21/858575921.db2.gz UKYUXWJUTZTYHN-QFIPXVFZSA-N 0 3 400.950 4.484 20 0 HIADHN Cc1cnc(C(C)(C)NC(=O)Nc2ccc(CCN3CCSCC3)cc2)s1 ZINC000431409620 858601383 /nfs/dbraw/zinc/60/13/83/858601383.db2.gz HXVBQSLWQQWLNN-UHFFFAOYSA-N 0 3 404.605 4.100 20 0 HIADHN CN1CCN(CCCNC(=O)c2c(Cl)cc(F)cc2Cl)[C@@H](c2ccccc2)C1 ZINC000431484206 858638750 /nfs/dbraw/zinc/63/87/50/858638750.db2.gz CPIYIKGOTNFYMN-LJQANCHMSA-N 0 3 424.347 4.241 20 0 HIADHN C[C@H](CCSc1ccccc1)N1CCC(NS(=O)(=O)c2ccccc2)CC1 ZINC000431600017 858683516 /nfs/dbraw/zinc/68/35/16/858683516.db2.gz LPJHCKPWRHKBOH-GOSISDBHSA-N 0 3 404.601 4.000 20 0 HIADHN C[C@@H](NC(=O)NC[C@@H](c1ccccc1)N(C)C)c1noc(-c2ccc(Cl)cc2)n1 ZINC000431723018 858763824 /nfs/dbraw/zinc/76/38/24/858763824.db2.gz IQZRKWFTKODRAB-KDOFPFPSSA-N 0 3 413.909 4.053 20 0 HIADHN COc1ccccc1CSc1ccccc1NC(=O)N1CC[C@H](N2CC=CC2)C1 ZINC000431724721 858765420 /nfs/dbraw/zinc/76/54/20/858765420.db2.gz VXGPNOZIGYLIRM-IBGZPJMESA-N 0 3 409.555 4.466 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CC(C)(C)[C@H]1c1ccncc1)c1cccc(OC)c1 ZINC000431775108 858805831 /nfs/dbraw/zinc/80/58/31/858805831.db2.gz HQQMVNPCCMSQGW-FGZHOGPDSA-N 0 3 410.562 4.266 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)c1cccc(-c2noc(C(F)(F)F)n2)c1 ZINC000431842623 858836465 /nfs/dbraw/zinc/83/64/65/858836465.db2.gz GZWNKARKLMWUST-UHFFFAOYSA-N 0 3 424.448 4.021 20 0 HIADHN COc1ccc2c(c1)[C@@H](C(=O)Nc1ccnn1[C@@H]1CCN(Cc3ccccc3)C1)CC2 ZINC000431924851 858872792 /nfs/dbraw/zinc/87/27/92/858872792.db2.gz LRUWQNSUTVHLKD-IRLDBZIGSA-N 0 3 416.525 4.007 20 0 HIADHN COc1cnccc1N1CCN(C(=O)Nc2ccc3nc(C(C)C)sc3c2)CC1 ZINC000431976384 858898175 /nfs/dbraw/zinc/89/81/75/858898175.db2.gz CPDPURPBOMMYRD-UHFFFAOYSA-N 0 3 411.531 4.177 20 0 HIADHN COC(=O)[C@H](C)Oc1ccc(CN2CCC(F)(c3cccc(OC)c3)CC2)cc1 ZINC000467540770 881361824 /nfs/dbraw/zinc/36/18/24/881361824.db2.gz CWSMJAQZGUSKOI-KRWDZBQOSA-N 0 3 401.478 4.096 20 0 HIADHN COc1cnccc1N1CCN(C(=O)Nc2c(F)cccc2Oc2ccccc2)CC1 ZINC000432069479 858965644 /nfs/dbraw/zinc/96/56/44/858965644.db2.gz NNTPVYKHYJCUKX-UHFFFAOYSA-N 0 3 422.460 4.376 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCCc1cccc(C(F)(F)F)n1)c1ccsc1 ZINC000432106534 858994416 /nfs/dbraw/zinc/99/44/16/858994416.db2.gz JLUYJZUNASOXCQ-MRXNPFEDSA-N 0 3 414.497 4.087 20 0 HIADHN O=S(=O)(Cc1ccccc1)N1CCC(NCc2csc(Cl)c2Cl)CC1 ZINC000432252256 859068727 /nfs/dbraw/zinc/06/87/27/859068727.db2.gz FMTAXUOWZZRIAB-UHFFFAOYSA-N 0 3 419.399 4.139 20 0 HIADHN Cc1cc(NC(=O)NC[C@H]2CCC(F)(F)C2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000432273783 859079495 /nfs/dbraw/zinc/07/94/95/859079495.db2.gz DFNWAZFXUYDRPD-OALUTQOASA-N 0 3 417.504 4.195 20 0 HIADHN Cc1cc(NC(=O)N(C)Cc2cnccc2C)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000432278057 859082365 /nfs/dbraw/zinc/08/23/65/859082365.db2.gz WRIBFKOJOUPXIG-QFIPXVFZSA-N 0 3 418.545 4.006 20 0 HIADHN Brc1cccc(C2CCN(Cc3cnc(N4CCOCC4)s3)CC2)c1 ZINC000467559187 881381245 /nfs/dbraw/zinc/38/12/45/881381245.db2.gz ZEYUCBPCSCUTLG-UHFFFAOYSA-N 0 3 422.392 4.122 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N1CCO[C@H](c2cccc(Cl)c2)C1 ZINC000467561514 881384791 /nfs/dbraw/zinc/38/47/91/881384791.db2.gz CNMNZEGWZYXSTJ-MOPGFXCFSA-N 0 3 419.978 4.322 20 0 HIADHN Cc1cnc(C2CCN(C(=O)c3ccc(N4CCN(C(C)C)CC4)cc3)CC2)s1 ZINC000432435923 859163718 /nfs/dbraw/zinc/16/37/18/859163718.db2.gz JOQPLIZDVXMFHF-UHFFFAOYSA-N 0 3 412.603 4.002 20 0 HIADHN CN(CCCNC(=O)C1CCC1)Cc1cccc(NC(=O)c2ccc(Cl)cc2)c1 ZINC000432800772 859367589 /nfs/dbraw/zinc/36/75/89/859367589.db2.gz QJAFDIYLKSEXNH-UHFFFAOYSA-N 0 3 413.949 4.331 20 0 HIADHN COCCOc1ccc(CN2CCC(c3nc(-c4ccccc4OC)no3)CC2)cc1 ZINC000433021426 859482993 /nfs/dbraw/zinc/48/29/93/859482993.db2.gz GMTJLKROBIWYOQ-UHFFFAOYSA-N 0 3 423.513 4.150 20 0 HIADHN COc1cc(NC(=O)CCN2CCC(c3ncc(C)s3)CC2)c(OC)cc1Cl ZINC000433165330 859549286 /nfs/dbraw/zinc/54/92/86/859549286.db2.gz BSSITGIGFGARDM-UHFFFAOYSA-N 0 3 423.966 4.330 20 0 HIADHN CCn1cccc(CNCc2cn(Cc3ccccc3)nc2-c2cccs2)c1=O ZINC000433182523 859557815 /nfs/dbraw/zinc/55/78/15/859557815.db2.gz OGFIWUCEMYJMSK-UHFFFAOYSA-N 0 3 404.539 4.131 20 0 HIADHN COc1cc(CN(C)Cc2cnccc2C)cc(CN(C)Cc2cnccc2C)c1 ZINC000433203045 859564791 /nfs/dbraw/zinc/56/47/91/859564791.db2.gz VZSAALMYKNEIFG-UHFFFAOYSA-N 0 3 404.558 4.366 20 0 HIADHN Cc1ncc(CN[C@@H](Cc2ccccc2Br)c2ccc(F)cc2)c(=O)[nH]1 ZINC000467640339 881437329 /nfs/dbraw/zinc/43/73/29/881437329.db2.gz NACICPMYKQZSBV-IBGZPJMESA-N 0 3 416.294 4.466 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)C2(Cc3ccc(F)cc3)CCOCC2)N2CCCC2)cc1 ZINC000433248276 859590586 /nfs/dbraw/zinc/59/05/86/859590586.db2.gz PKEZNKLSHGKFEY-XMMPIXPASA-N 0 3 424.560 4.427 20 0 HIADHN Cc1cnc(C2CCN(C(=O)NC[C@H](c3cccs3)N3CCCC3)CC2)s1 ZINC000433286153 859618023 /nfs/dbraw/zinc/61/80/23/859618023.db2.gz UETBWXYNQHTGBN-QGZVFWFLSA-N 0 3 404.605 4.239 20 0 HIADHN CCNC(=O)N(C)c1cccc(NC(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)c1 ZINC000433477769 859720940 /nfs/dbraw/zinc/72/09/40/859720940.db2.gz NSYSMQXSTYUMLC-JOCHJYFZSA-N 0 3 423.561 4.119 20 0 HIADHN CC(=O)Nc1ccc(C(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)cc1F ZINC000433588184 859798033 /nfs/dbraw/zinc/79/80/33/859798033.db2.gz USBPFBVTAQEVNH-LJQANCHMSA-N 0 3 403.523 4.049 20 0 HIADHN COc1ccc([C@H](CNC(=O)Nc2ccc(Cl)c(OC)c2)N2CCCC2)cc1 ZINC000433641564 859821511 /nfs/dbraw/zinc/82/15/11/859821511.db2.gz ZOQQLBKMJDEWAD-IBGZPJMESA-N 0 3 403.910 4.316 20 0 HIADHN CN(C)CCN(C(=O)Nc1ccnc(Oc2ccc(F)cc2F)c1)C1CCCC1 ZINC000433744356 859870394 /nfs/dbraw/zinc/87/03/94/859870394.db2.gz JEJBTHUKUIRNRZ-UHFFFAOYSA-N 0 3 404.461 4.490 20 0 HIADHN Cn1cc(-c2cc(F)ccc2NC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)cn1 ZINC000433800236 859898536 /nfs/dbraw/zinc/89/85/36/859898536.db2.gz VGGDEJHLXLCMHO-HXUWFJFHSA-N 0 3 407.493 4.012 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)N[C@@H](c2cccc(Cl)c2)C2CCCC2)CC1 ZINC000433814960 859909175 /nfs/dbraw/zinc/90/91/75/859909175.db2.gz YPNUFWMFVLTVSI-XMSQKQJNSA-N 0 3 421.029 4.144 20 0 HIADHN CC(C)C(=O)Nc1ccc(Cl)c(C(=O)N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)c1 ZINC000467689632 881481168 /nfs/dbraw/zinc/48/11/68/881481168.db2.gz WLBJTVSZKYZERL-VQIMIIECSA-N 0 3 413.949 4.327 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)NC[C@H]1CCCN(c2ccccc2)C1 ZINC000433914856 859966891 /nfs/dbraw/zinc/96/68/91/859966891.db2.gz KQUXZXJWZLSIEU-QPPBQGQZSA-N 0 3 406.574 4.039 20 0 HIADHN C[C@H](NC(=O)NC[C@H]1CCCCN1C1CC1)c1cccc(NC(=O)c2ccccc2)c1 ZINC000433940177 859988369 /nfs/dbraw/zinc/98/83/69/859988369.db2.gz KDTYMPDCINCUFM-FDDCHVKYSA-N 0 3 420.557 4.316 20 0 HIADHN O=C(NC[C@@H]1CCCCN1C1CC1)N[C@@H](Cc1ccc(Cl)cc1)c1ccccn1 ZINC000433951731 859998113 /nfs/dbraw/zinc/99/81/13/859998113.db2.gz BPVNGRARWHPKLJ-UNMCSNQZSA-N 0 3 412.965 4.335 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)NC[C@H]1CCCN(c2ccccc2)C1 ZINC000433974578 860010554 /nfs/dbraw/zinc/01/05/54/860010554.db2.gz AUYDKMTXWICTDI-TZIWHRDSSA-N 0 3 412.603 4.101 20 0 HIADHN C[C@H]1C[C@H](NC(=O)c2ccc(NC(=O)c3ccccc3)cc2)CN1Cc1ccccc1 ZINC000467698545 881493450 /nfs/dbraw/zinc/49/34/50/881493450.db2.gz QNYXNVVBIQZOPC-CYFREDJKSA-N 0 3 413.521 4.332 20 0 HIADHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(SCc2cn3ccccc3n2)cc1 ZINC000434038831 860056798 /nfs/dbraw/zinc/05/67/98/860056798.db2.gz VYSKXAFCPWYHPV-RTWAWAEBSA-N 0 3 420.582 4.325 20 0 HIADHN C[C@H]1C[C@H](NC(=O)c2ccc(OCc3ccccn3)cc2)CN1Cc1ccccc1 ZINC000467700725 881496113 /nfs/dbraw/zinc/49/61/13/881496113.db2.gz NHXCZAITRLILJZ-CVDCTZTESA-N 0 3 401.510 4.053 20 0 HIADHN C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)c1cn(C(C)(C)C)nc1-c1ccccc1Cl ZINC000467713367 881511878 /nfs/dbraw/zinc/51/18/78/881511878.db2.gz MCORDZMZAIXYEE-KUHUBIRLSA-N 0 3 400.954 4.171 20 0 HIADHN Cc1c(C(=O)N2CCN(C)CC[C@H]2C)c2cc(Br)ccc2nc1C1CC1 ZINC000434268306 860242459 /nfs/dbraw/zinc/24/24/59/860242459.db2.gz ILJBJPAOFJYYIU-CYBMUJFWSA-N 0 3 416.363 4.349 20 0 HIADHN CCc1ccccc1OCC(=O)Nc1c(C)cnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000434313615 860274398 /nfs/dbraw/zinc/27/43/98/860274398.db2.gz AWFCHERZZGYSHP-JOCHJYFZSA-N 0 3 418.541 4.218 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)[C@H](C)Oc1ccccc1F ZINC000434320437 860280637 /nfs/dbraw/zinc/28/06/37/860280637.db2.gz CESNSGDVFLCECO-AZUAARDMSA-N 0 3 422.504 4.184 20 0 HIADHN CCOc1ccc(CC(=O)Nc2c(C)cnn2[C@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000434322156 860282349 /nfs/dbraw/zinc/28/23/49/860282349.db2.gz BHLJZJLFPHUMOE-QFIPXVFZSA-N 0 3 418.541 4.218 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)CSc1ccccc1 ZINC000434323011 860283377 /nfs/dbraw/zinc/28/33/77/860283377.db2.gz YNHZMWOHSMGJQC-FQEVSTJZSA-N 0 3 406.555 4.369 20 0 HIADHN Cc1cc(C)n([C@@H](C)CC(=O)Nc2c(C)cnn2[C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000434324445 860286391 /nfs/dbraw/zinc/28/63/91/860286391.db2.gz DEGHEODPCRIMEX-UNMCSNQZSA-N 0 3 420.561 4.042 20 0 HIADHN CCOc1c(F)cccc1C(=O)Nc1c(C)cnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000434326371 860287381 /nfs/dbraw/zinc/28/73/81/860287381.db2.gz MPUJBSBPMKWKNW-LJQANCHMSA-N 0 3 422.504 4.429 20 0 HIADHN O=C(NCc1nc(-c2cc3ccccc3o2)cs1)NC[C@@H]1CCCCN1C1CC1 ZINC000434333630 860295269 /nfs/dbraw/zinc/29/52/69/860295269.db2.gz MZSHIVDQZVRPNC-KRWDZBQOSA-N 0 3 410.543 4.372 20 0 HIADHN CCc1ccc(CC(=O)Nc2c(C)cnn2[C@@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000434337910 860299187 /nfs/dbraw/zinc/29/91/87/860299187.db2.gz ZGNCSKZMQWBFFX-HSZRJFAPSA-N 0 3 402.542 4.382 20 0 HIADHN CC(C)(C)CC(=O)Nc1ccc(Cl)c(C(=O)NC[C@H]2CCCCN2C2CC2)c1 ZINC000434437272 860351786 /nfs/dbraw/zinc/35/17/86/860351786.db2.gz CMDUOOZHCSTVFX-QGZVFWFLSA-N 0 3 405.970 4.461 20 0 HIADHN Cc1ccc(C2(CNC(=O)N(C)C[C@@H]3CCN(C)[C@H]3c3cccnc3)CCC2)cc1C ZINC000434453744 860357609 /nfs/dbraw/zinc/35/76/09/860357609.db2.gz LEURKHKCMUNZDM-UPVQGACJSA-N 0 3 420.601 4.455 20 0 HIADHN Cc1ccn(C2CCN([C@@H]3CCCN(Cc4cccc(C(F)(F)F)c4)C3=O)CC2)n1 ZINC000434506571 860379602 /nfs/dbraw/zinc/37/96/02/860379602.db2.gz DBOSAXPLHMHMHY-HXUWFJFHSA-N 0 3 420.479 4.038 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)NC1(c2c(Cl)cccc2Cl)CC1 ZINC000434612465 860429544 /nfs/dbraw/zinc/42/95/44/860429544.db2.gz SFVBNGUWULJNGU-UHFFFAOYSA-N 0 3 420.340 4.107 20 0 HIADHN CN(CCC(=O)Nc1ccc(C(N)=O)c(Cl)c1)Cc1cc(Cl)cc(Cl)c1 ZINC000434660532 860449029 /nfs/dbraw/zinc/44/90/29/860449029.db2.gz ZTOJOMWYOBLMSN-UHFFFAOYSA-N 0 3 414.720 4.206 20 0 HIADHN NC(=O)c1ccc(NC(=O)CCN2CCC[C@@H]2c2cccc(Cl)c2)cc1Cl ZINC000434659772 860449363 /nfs/dbraw/zinc/44/93/63/860449363.db2.gz UNBNTGBPSKFKOM-GOSISDBHSA-N 0 3 406.313 4.258 20 0 HIADHN O=C(c1ccc(F)cc1)C1CCN(C[C@@H](O)CO[C@H]2CCCc3ccccc32)CC1 ZINC000434661900 860450495 /nfs/dbraw/zinc/45/04/95/860450495.db2.gz GYEUCRDYEGPSEE-VWNXMTODSA-N 0 3 411.517 4.176 20 0 HIADHN O=C(c1ccc(F)cc1)C1CCN(C[C@H](O)Cc2ccc(C(F)(F)F)cc2)CC1 ZINC000434667121 860452827 /nfs/dbraw/zinc/45/28/27/860452827.db2.gz TYJUIOWGGDHNGO-HXUWFJFHSA-N 0 3 409.423 4.343 20 0 HIADHN C[C@H](NC(=O)CN1CCC(c2ncc3n2CCCC3)CC1)c1cccc2ccccc21 ZINC000434680588 860457169 /nfs/dbraw/zinc/45/71/69/860457169.db2.gz JVZCDFJKSKIVLF-IBGZPJMESA-N 0 3 416.569 4.429 20 0 HIADHN O=C([C@@H](c1ccccc1)N1CCC(c2ncc3n2CCCC3)CC1)N1CCCCC1 ZINC000434684700 860459488 /nfs/dbraw/zinc/45/94/88/860459488.db2.gz KBRDINSVXSIMFX-HSZRJFAPSA-N 0 3 406.574 4.153 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)c2csc(-c3ccc(Cl)s3)n2)C[C@H](C)O1 ZINC000434757038 860483113 /nfs/dbraw/zinc/48/31/13/860483113.db2.gz FCTDVCDIBPGMFZ-BETUJISGSA-N 0 3 413.996 4.144 20 0 HIADHN C[C@H](C(=O)Nc1ccccc1C(F)(F)F)N1CCC(c2ncc3n2CCCC3)CC1 ZINC000434759393 860484513 /nfs/dbraw/zinc/48/45/13/860484513.db2.gz VZYZKZACVDRKEU-OAHLLOKOSA-N 0 3 420.479 4.445 20 0 HIADHN Cc1cc(Br)cc(CNCCOCC(F)(F)C(F)F)c1OC(F)F ZINC000434789440 860494656 /nfs/dbraw/zinc/49/46/56/860494656.db2.gz MRBBSAPYKBOISS-UHFFFAOYSA-N 0 3 424.179 4.366 20 0 HIADHN CCN(C(=O)NC[C@H]1CCCN(c2ccccc2)C1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000434868550 860529417 /nfs/dbraw/zinc/52/94/17/860529417.db2.gz LWHWUSRXOOWDSA-NOZRDPDXSA-N 0 3 420.601 4.209 20 0 HIADHN COc1cc(NC(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)c(C)cc1C ZINC000434897178 860542224 /nfs/dbraw/zinc/54/22/24/860542224.db2.gz SDTUXVKTHIAGMS-KDURUIRLSA-N 0 3 403.567 4.055 20 0 HIADHN C[C@@H]1[C@H](c2ccccc2)CCN1CC(=O)N1CCC[C@@H]1c1ccc2c(c1)OCCCO2 ZINC000434898512 860543324 /nfs/dbraw/zinc/54/33/24/860543324.db2.gz VRDZNMJHULWCPI-UEVCKROQSA-N 0 3 420.553 4.389 20 0 HIADHN C[C@@H]1[C@@H](c2ccccc2)CCN1CC(=O)N1CCC[C@H]1c1ccc2c(c1)OCCCO2 ZINC000434898509 860543528 /nfs/dbraw/zinc/54/35/28/860543528.db2.gz VRDZNMJHULWCPI-OIBXWCBGSA-N 0 3 420.553 4.389 20 0 HIADHN C/C=C\c1ccc(OC[C@@H](O)CN2CCC(OCC3CCCC3)CC2)c(OC)c1 ZINC000434909721 860550702 /nfs/dbraw/zinc/55/07/02/860550702.db2.gz PMWHVHSFXQIXJL-WCMNTNLDSA-N 0 3 403.563 4.139 20 0 HIADHN CC(=O)Nc1ccc(OC[C@H](O)CN(Cc2cc(F)ccc2F)C2CCCC2)cc1 ZINC000434911654 860550756 /nfs/dbraw/zinc/55/07/56/860550756.db2.gz ZHKQSYWLQKDNKY-OAQYLSRUSA-N 0 3 418.484 4.108 20 0 HIADHN COc1ccc([C@@H]2CCCN2Cc2ccc(OCC(=O)N3CCCC3)c(OC)c2)cc1 ZINC000434984428 860585897 /nfs/dbraw/zinc/58/58/97/860585897.db2.gz AFFPYUSPCHRVHH-QFIPXVFZSA-N 0 3 424.541 4.042 20 0 HIADHN Cc1ccn(C2CCN(Cc3cn(-c4ccc(Br)cc4)nc3C)CC2)n1 ZINC000435041904 860612410 /nfs/dbraw/zinc/61/24/10/860612410.db2.gz RTDCLNQHQMDEBW-UHFFFAOYSA-N 0 3 414.351 4.285 20 0 HIADHN COc1cc(CN2CCC(c3ncc4n3CCCC4)CC2)c(SC)cc1OC ZINC000435055689 860618024 /nfs/dbraw/zinc/61/80/24/860618024.db2.gz CVOMLWJEUZRHMZ-UHFFFAOYSA-N 0 3 401.576 4.338 20 0 HIADHN Cc1nc(CN2CCC(CN[C@H](C)c3nc(C(F)(F)F)cs3)CC2)oc1C ZINC000467752833 881563385 /nfs/dbraw/zinc/56/33/85/881563385.db2.gz MKBJJGOHQKFXJV-GFCCVEGCSA-N 0 3 402.486 4.330 20 0 HIADHN C[C@H](SCC(=O)N[C@@H]1C[C@@H](C)N(Cc2ccccc2)C1)c1nc2ccccc2[nH]1 ZINC000467755111 881568864 /nfs/dbraw/zinc/56/88/64/881568864.db2.gz QVZIAKBPGGCJSY-ZIFCJYIRSA-N 0 3 408.571 4.136 20 0 HIADHN Cc1cc(NC(=O)CCc2cccc(F)c2F)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435272923 860711558 /nfs/dbraw/zinc/71/15/58/860711558.db2.gz UPTFQSHPQVZTCC-FQEVSTJZSA-N 0 3 424.495 4.488 20 0 HIADHN COCc1cccc(C(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000435275092 860712510 /nfs/dbraw/zinc/71/25/10/860712510.db2.gz OTDVBLCWBMUVRD-JOCHJYFZSA-N 0 3 404.514 4.037 20 0 HIADHN Cc1cc(NC(=O)COc2ccc(C)c(C)c2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435278477 860715496 /nfs/dbraw/zinc/71/54/96/860715496.db2.gz GHLMVYSWFKDPOV-QFIPXVFZSA-N 0 3 418.541 4.273 20 0 HIADHN CCCn1nc(C)c(C(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)c1C ZINC000435287342 860719924 /nfs/dbraw/zinc/71/99/24/860719924.db2.gz HBQPJLVOFJGCNM-OAQYLSRUSA-N 0 3 420.561 4.114 20 0 HIADHN Cc1cc(NC(=O)c2ccc3ccccc3n2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435290813 860721211 /nfs/dbraw/zinc/72/12/11/860721211.db2.gz RZVOCXRIYLVLOS-OAQYLSRUSA-N 0 3 411.509 4.439 20 0 HIADHN C[C@H]1C[C@H](NC(=O)c2[nH]c3ccccc3c2Br)CN1Cc1ccccc1 ZINC000467757669 881572758 /nfs/dbraw/zinc/57/27/58/881572758.db2.gz ITCOFDWAJZYFGL-HOCLYGCPSA-N 0 3 412.331 4.323 20 0 HIADHN COc1ccc(CCCC(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000435367796 860766222 /nfs/dbraw/zinc/76/62/22/860766222.db2.gz AMYORTNGHDQAKD-JOCHJYFZSA-N 0 3 418.541 4.300 20 0 HIADHN COc1cccc([C@H](C)C(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000435369004 860767159 /nfs/dbraw/zinc/76/71/59/860767159.db2.gz CMBMDJPHNRQXNB-RXVVDRJESA-N 0 3 404.514 4.081 20 0 HIADHN COc1cccc([C@H](C)C(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000435369000 860767329 /nfs/dbraw/zinc/76/73/29/860767329.db2.gz CMBMDJPHNRQXNB-GHTZIAJQSA-N 0 3 404.514 4.081 20 0 HIADHN O=C(Cc1c(F)cccc1Cl)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435370716 860767995 /nfs/dbraw/zinc/76/79/95/860767995.db2.gz QNCPUECKYABXHD-QGZVFWFLSA-N 0 3 412.896 4.304 20 0 HIADHN COc1cccc(SCC(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000435370523 860768167 /nfs/dbraw/zinc/76/81/67/860768167.db2.gz JBPABLBQQRDJHJ-LJQANCHMSA-N 0 3 422.554 4.070 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(OC(F)F)cc1 ZINC000435370464 860768294 /nfs/dbraw/zinc/76/82/94/860768294.db2.gz PMAZHNDYJWBPHK-GOSISDBHSA-N 0 3 412.440 4.184 20 0 HIADHN CC(C)(C)c1nc(C(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)cs1 ZINC000435375446 860774194 /nfs/dbraw/zinc/77/41/94/860774194.db2.gz VGFOHDLNHCQKRF-QGZVFWFLSA-N 0 3 409.559 4.336 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)c1c(F)c(F)cc(F)c1F ZINC000435380143 860775726 /nfs/dbraw/zinc/77/57/26/860775726.db2.gz MNLNCRVKOJGBBH-CQSZACIVSA-N 0 3 418.394 4.139 20 0 HIADHN CC(C)Oc1ccccc1CC(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435380386 860776824 /nfs/dbraw/zinc/77/68/24/860776824.db2.gz QVDBQBNAPOQWJI-JOCHJYFZSA-N 0 3 418.541 4.299 20 0 HIADHN CCC(=O)c1ccc(C(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000435381074 860777094 /nfs/dbraw/zinc/77/70/94/860777094.db2.gz VBZCLHWWXZSYFM-NRFANRHFSA-N 0 3 402.498 4.175 20 0 HIADHN Cc1cccc(OCCC(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000435382142 860778266 /nfs/dbraw/zinc/77/82/66/860778266.db2.gz XZGUKYBSAVCYKN-NRFANRHFSA-N 0 3 404.514 4.046 20 0 HIADHN Cc1cc(NC(=O)N[C@H](C)c2csc(C)n2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435514869 860832713 /nfs/dbraw/zinc/83/27/13/860832713.db2.gz DGNCDVHPIVEZOM-APWZRJJASA-N 0 3 424.574 4.286 20 0 HIADHN Cc1cc(NC(=O)N(C)[C@H](C)c2ccccn2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435515077 860832975 /nfs/dbraw/zinc/83/29/75/860832975.db2.gz FJORGLGIDORAFQ-TZIWHRDSSA-N 0 3 418.545 4.258 20 0 HIADHN O=C(NCc1csc(CCc2ccccc2)n1)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435530336 860845711 /nfs/dbraw/zinc/84/57/11/860845711.db2.gz WGAUASBFTWIEBY-OAQYLSRUSA-N 0 3 420.582 4.002 20 0 HIADHN Cc1cc(NC(=O)N2CCc3ccccc3C2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435529961 860845805 /nfs/dbraw/zinc/84/58/05/860845805.db2.gz SSLNMZPYRAEEHT-QHCPKHFHSA-N 0 3 415.541 4.229 20 0 HIADHN CC[C@@H](NC(=O)Nc1cc(C)nn1[C@H]1CCN(Cc2ccccc2)C1)c1ccncc1 ZINC000435536873 860850788 /nfs/dbraw/zinc/85/07/88/860850788.db2.gz MOZLZOLYZTXKMC-FCHUYYIVSA-N 0 3 418.545 4.306 20 0 HIADHN Cc1c(NC(=O)N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)cnn1-c1ccccc1F ZINC000435544007 860858765 /nfs/dbraw/zinc/85/87/65/860858765.db2.gz BTTARLKJOWBTOI-LPHOPBHVSA-N 0 3 407.493 4.104 20 0 HIADHN Cc1c(NC(=O)N(CCN(C)C)Cc2cccc(C)c2)cnn1-c1ccccc1F ZINC000435545392 860859758 /nfs/dbraw/zinc/85/97/58/860859758.db2.gz KBVYPSKUTGGPAV-UHFFFAOYSA-N 0 3 409.509 4.224 20 0 HIADHN Cc1c(NC(=O)NC[C@H](c2ccccc2)N2CCCC2)cnn1-c1ccccc1F ZINC000435552110 860868501 /nfs/dbraw/zinc/86/85/01/860868501.db2.gz YRMDCHGYKVQFTQ-JOCHJYFZSA-N 0 3 407.493 4.278 20 0 HIADHN O=C(Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)c1cc2c(cccc2F)[nH]1 ZINC000435647625 860932706 /nfs/dbraw/zinc/93/27/06/860932706.db2.gz SBFKIALJGIROJI-KRWDZBQOSA-N 0 3 403.461 4.203 20 0 HIADHN NC(=O)[C@H](Cc1ccc(C(F)(F)F)cc1)N[C@@H]1C[C@H]1c1c(F)cccc1Cl ZINC000435654302 860937920 /nfs/dbraw/zinc/93/79/20/860937920.db2.gz KGRMHMZACZQKBO-WQVCFCJDSA-N 0 3 400.803 4.040 20 0 HIADHN CCN(CC)[C@H](CNC(=O)C1(OCc2ccccc2)CCOCC1)c1ccsc1 ZINC000435809734 861075391 /nfs/dbraw/zinc/07/53/91/861075391.db2.gz QMILLDWGPODAKZ-OAQYLSRUSA-N 0 3 416.587 4.013 20 0 HIADHN C[C@H](NC(=O)NC[C@H](Cc1ccccc1)N(C)C)c1ccc(Br)s1 ZINC000435843827 861104658 /nfs/dbraw/zinc/10/46/58/861104658.db2.gz GZQISMABRQRERW-ZFWWWQNUSA-N 0 3 410.381 4.044 20 0 HIADHN Cc1ccc(NC(=O)C2CC2)cc1NC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC000437790963 863110813 /nfs/dbraw/zinc/11/08/13/863110813.db2.gz ZWIPSRCGAWDGLF-LJQANCHMSA-N 0 3 420.557 4.472 20 0 HIADHN Cc1noc(C)c1COc1cc2ccccc2cc1C(=O)N[C@H]1CN(C2CC2)C[C@H]1C ZINC000467802933 881628629 /nfs/dbraw/zinc/62/86/29/881628629.db2.gz LKQAOGGLNJWNKG-CMJOXMDJSA-N 0 3 419.525 4.236 20 0 HIADHN Cc1c(NC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cnn1-c1cc(C)ccc1C ZINC000437806139 863129093 /nfs/dbraw/zinc/12/90/93/863129093.db2.gz XEZKMFBTJGWLIG-OAQYLSRUSA-N 0 3 403.530 4.194 20 0 HIADHN CN(C(=O)c1ccc(Cl)cc1)c1ccc(NC(=O)N2CC[C@@H](N3CC=CC3)C2)cc1 ZINC000437837262 863191369 /nfs/dbraw/zinc/19/13/69/863191369.db2.gz RLCDJWMNMDTPTL-OAQYLSRUSA-N 0 3 424.932 4.095 20 0 HIADHN Cc1ccc(C(=O)NC2CC2)cc1NC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1 ZINC000437862241 863222024 /nfs/dbraw/zinc/22/20/24/863222024.db2.gz XABCHKCPTCVTLF-IBGZPJMESA-N 0 3 420.557 4.016 20 0 HIADHN CCc1ncsc1NC(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1 ZINC000437875098 863236289 /nfs/dbraw/zinc/23/62/89/863236289.db2.gz JYQMCBAGSPPSDE-UHFFFAOYSA-N 0 3 400.470 4.320 20 0 HIADHN C[C@@H](Oc1ccc(C(F)(F)F)cc1)C(=O)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000437892908 863261086 /nfs/dbraw/zinc/26/10/86/863261086.db2.gz ZGDYDVXSOPTFPA-OAHLLOKOSA-N 0 3 422.447 4.068 20 0 HIADHN CCN(CCOc1ccc(Br)cc1)C(=O)Nc1cccc(CN(C)C)c1 ZINC000437938574 863313829 /nfs/dbraw/zinc/31/38/29/863313829.db2.gz CXGQIWJWYGZNDR-UHFFFAOYSA-N 0 3 420.351 4.444 20 0 HIADHN CCO[C@@H]1C[C@@H](NC(=O)Nc2ccc(CCN3CCSCC3)cc2)C12CCCC2 ZINC000438078128 863472105 /nfs/dbraw/zinc/47/21/05/863472105.db2.gz HMWONJKYWUAXKL-NHCUHLMSSA-N 0 3 417.619 4.137 20 0 HIADHN Cc1ccc2cc(CNCc3ccc(S(=O)(=O)N4CCC[C@@H](C)C4)cc3)ccc2n1 ZINC000438098965 863506802 /nfs/dbraw/zinc/50/68/02/863506802.db2.gz XLUZADCBXISTKJ-GOSISDBHSA-N 0 3 423.582 4.254 20 0 HIADHN Cc1ccc(O[C@H](C)CNC(=O)Nc2ccc(CCN3CCSCC3)cc2)cc1 ZINC000438100479 863510094 /nfs/dbraw/zinc/51/00/94/863510094.db2.gz CTWPMZJTYBYIOE-LJQANCHMSA-N 0 3 413.587 4.175 20 0 HIADHN COc1cccc(F)c1[C@H](C)NC(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000438100249 863510346 /nfs/dbraw/zinc/51/03/46/863510346.db2.gz LJNTYZQONXSKGS-INIZCTEOSA-N 0 3 417.550 4.308 20 0 HIADHN CCOC(=O)Cn1nc(C)c(CNCc2cc(-c3ccc(OC)cc3)cs2)c1C ZINC000438180885 863604710 /nfs/dbraw/zinc/60/47/10/863604710.db2.gz UDGPBZXROCECMH-UHFFFAOYSA-N 0 3 413.543 4.090 20 0 HIADHN C[C@@H](Cc1ccccc1F)NCc1cccnc1Oc1cccc(S(C)(=O)=O)c1 ZINC000438199301 863628954 /nfs/dbraw/zinc/62/89/54/863628954.db2.gz LDSDVYWBLIOTNL-INIZCTEOSA-N 0 3 414.502 4.137 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)[C@@H]1C[C@H]1c1ccccc1OC(F)(F)F ZINC000438455561 863879746 /nfs/dbraw/zinc/87/97/46/863879746.db2.gz CMEWKZVDUZWSAZ-DLBZAZTESA-N 0 3 412.477 4.341 20 0 HIADHN CCc1ccc([C@H](CNC(=O)Nc2ccc(C(C)(C)C(=O)OC)cc2)N(C)C)cc1 ZINC000438455757 863879751 /nfs/dbraw/zinc/87/97/51/863879751.db2.gz BILOOJJGIAKWPF-NRFANRHFSA-N 0 3 411.546 4.124 20 0 HIADHN CCCc1noc2nc(C3CC3)cc(C(=O)N(CCN(C)C)Cc3cccs3)c12 ZINC000438459142 863882118 /nfs/dbraw/zinc/88/21/18/863882118.db2.gz LVHBUNDUCRFVIT-UHFFFAOYSA-N 0 3 412.559 4.318 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)[C@@H]1C[C@H]1c1cccc(Br)c1 ZINC000438462293 863885111 /nfs/dbraw/zinc/88/51/11/863885111.db2.gz SSYGYMBHWYEAOX-ZWKOTPCHSA-N 0 3 407.377 4.205 20 0 HIADHN COC(=O)C(C)(C)c1ccc(NC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)cc1 ZINC000438470740 863890904 /nfs/dbraw/zinc/89/09/04/863890904.db2.gz JUDYMJNPXOGYJY-LJQANCHMSA-N 0 3 423.557 4.266 20 0 HIADHN CC[C@@H]1CCN(CC(=O)NC[C@@H](c2c[nH]c3ccccc32)c2ccc(OC)cc2)C1 ZINC000438508676 863932247 /nfs/dbraw/zinc/93/22/47/863932247.db2.gz MVHPGKGTNKOOSY-XMSQKQJNSA-N 0 3 405.542 4.157 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Cc1csc2nc(-c3ccccc3)cn12 ZINC000438528894 863953611 /nfs/dbraw/zinc/95/36/11/863953611.db2.gz HQUYDCIJDNICDW-UHFFFAOYSA-N 0 3 424.595 4.257 20 0 HIADHN COc1ccccc1OCc1ccc(C(=O)N(CCN(C)C)Cc2cccs2)o1 ZINC000438538498 863964028 /nfs/dbraw/zinc/96/40/28/863964028.db2.gz FMTRRJJRFBRAOI-UHFFFAOYSA-N 0 3 414.527 4.133 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)NC[C@@H]1CCC[C@H](C(F)(F)F)C1 ZINC000438537881 863964137 /nfs/dbraw/zinc/96/41/37/863964137.db2.gz AGSUZNKVIAXRJR-MOPGFXCFSA-N 0 3 411.512 4.074 20 0 HIADHN Cc1sc2ncnc(SCC(=O)N(CCN(C)C)Cc3cccs3)c2c1C ZINC000438541743 863967265 /nfs/dbraw/zinc/96/72/65/863967265.db2.gz SBUCQUJUHBFLMS-UHFFFAOYSA-N 0 3 420.629 4.052 20 0 HIADHN CC(C)CCO[C@@H]1CCCC[C@H]1NC(=O)N(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1 ZINC000438596624 864023724 /nfs/dbraw/zinc/02/37/24/864023724.db2.gz FDONUJXHEGZZIE-AFXVXQJMSA-N 0 3 416.610 4.090 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)Nc1ccc(Br)c(F)c1 ZINC000438623029 864050354 /nfs/dbraw/zinc/05/03/54/864050354.db2.gz MJQPQRFIVVPLHV-UHFFFAOYSA-N 0 3 416.360 4.071 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Nc1cccc(C[S@](=O)C(C)(C)C)c1 ZINC000438644554 864082322 /nfs/dbraw/zinc/08/23/22/864082322.db2.gz AZEQQZLBINIGQB-NDEPHWFRSA-N 0 3 421.632 4.391 20 0 HIADHN CCN(C(=O)C(=O)Nc1ccc(SC)cc1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000438656492 864099777 /nfs/dbraw/zinc/09/97/77/864099777.db2.gz PTCSCLSVSIPATM-XLIONFOSSA-N 0 3 411.571 4.031 20 0 HIADHN CCN(C(=O)C(=O)Nc1ccccc1OC(C)C)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000438664792 864115554 /nfs/dbraw/zinc/11/55/54/864115554.db2.gz JWBFEOBTUQHREN-PZJWPPBQSA-N 0 3 423.557 4.096 20 0 HIADHN Cc1c(F)cccc1NC(=O)CCN1CCCC[C@H]1CNC(=O)Nc1ccccc1 ZINC000438698177 864167116 /nfs/dbraw/zinc/16/71/16/864167116.db2.gz ROIFZZJYIIQOQQ-IBGZPJMESA-N 0 3 412.509 4.139 20 0 HIADHN CCOC(=O)c1cc2cc(C(=O)N(Cc3ccccc3)C3CCN(C)CC3)ccc2[nH]1 ZINC000438712976 864193375 /nfs/dbraw/zinc/19/33/75/864193375.db2.gz IKNSUQHKEGFDNO-UHFFFAOYSA-N 0 3 419.525 4.081 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)C(=O)Nc1ccc(Oc2ccccc2)cc1 ZINC000438750167 864240245 /nfs/dbraw/zinc/24/02/45/864240245.db2.gz GJUSPUUKSOLPBM-UHFFFAOYSA-N 0 3 423.538 4.069 20 0 HIADHN COc1ccc2[nH]cc(C3=CCN(C[C@H](O)COc4ccccc4Cl)CC3)c2c1 ZINC000438759208 864252103 /nfs/dbraw/zinc/25/21/03/864252103.db2.gz XRPFRYVYAWMNIA-KRWDZBQOSA-N 0 3 412.917 4.359 20 0 HIADHN COc1cc(CN(C)C[C@@H](O)CO[C@H](c2ccccc2)c2ccccc2C)ccc1O ZINC000438793005 864285818 /nfs/dbraw/zinc/28/58/18/864285818.db2.gz JRMPYRRPCZHISB-ATIYNZHBSA-N 0 3 421.537 4.308 20 0 HIADHN O[C@H](COc1cc(F)cc(Br)c1)CN1CCC[C@@H]1c1ccsc1 ZINC000438845408 864340430 /nfs/dbraw/zinc/34/04/30/864340430.db2.gz BFPZZIOBSKLBPI-DOTOQJQBSA-N 0 3 400.313 4.227 20 0 HIADHN Cc1ccc(Br)cc1CNCc1c[nH]nc1-c1ccc2c(c1)OCCO2 ZINC000438907133 864386350 /nfs/dbraw/zinc/38/63/50/864386350.db2.gz KSKXVMUQDSKLPI-UHFFFAOYSA-N 0 3 414.303 4.209 20 0 HIADHN COC(=O)[C@@H](NC1CCN([C@H](C)c2ccncc2)CC1)c1ccc(Cl)cc1Cl ZINC000439064380 864515295 /nfs/dbraw/zinc/51/52/95/864515295.db2.gz OXMHOGBZTAMLKN-VLIAUNLRSA-N 0 3 422.356 4.418 20 0 HIADHN COc1cc(CN[C@@H](c2ccc(Br)s2)C2CC2)ccc1OCCO ZINC000439136522 864569452 /nfs/dbraw/zinc/56/94/52/864569452.db2.gz RDKNYFADLKWCSJ-GOSISDBHSA-N 0 3 412.349 4.131 20 0 HIADHN COc1cc(CN[C@H](c2ccc(Br)s2)C2CC2)ccc1OCCO ZINC000439136523 864569754 /nfs/dbraw/zinc/56/97/54/864569754.db2.gz RDKNYFADLKWCSJ-SFHVURJKSA-N 0 3 412.349 4.131 20 0 HIADHN CS(=O)(=O)Cc1ccc(CN[C@H](c2ccc(Br)s2)C2CC2)cc1 ZINC000439138246 864570931 /nfs/dbraw/zinc/57/09/31/864570931.db2.gz UQCOLUVWYMKUPM-KRWDZBQOSA-N 0 3 414.390 4.296 20 0 HIADHN CC[C@@H](NCc1cc(Br)ccc1C)c1ccccc1OCC(=O)N(C)C ZINC000439138992 864571116 /nfs/dbraw/zinc/57/11/16/864571116.db2.gz HCIRKXVNYAUXPH-LJQANCHMSA-N 0 3 419.363 4.465 20 0 HIADHN CCN(C[C@@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)c1ccc(Cl)cc1C ZINC000439222161 864639244 /nfs/dbraw/zinc/63/92/44/864639244.db2.gz JJQSEKGOJDMRAP-LJQANCHMSA-N 0 3 406.979 4.181 20 0 HIADHN Brc1ccc(-c2nccc(CN3CCC([C@H]4CCCO4)CC3)n2)cc1 ZINC000439290041 864711718 /nfs/dbraw/zinc/71/17/18/864711718.db2.gz SGPINEIBSOBSFN-LJQANCHMSA-N 0 3 402.336 4.297 20 0 HIADHN CCOC(=O)c1oc2ccc(Br)cc2c1CN(C)[C@H]1CC[C@H](O)CC1 ZINC000439294820 864719372 /nfs/dbraw/zinc/71/93/72/864719372.db2.gz LYTYUVYEPHECPM-HDJSIYSDSA-N 0 3 410.308 4.107 20 0 HIADHN C[C@@H](NC(=O)N(CCN(C)C)Cc1cccs1)c1nc(C2CCCCC2)no1 ZINC000439329089 864765536 /nfs/dbraw/zinc/76/55/36/864765536.db2.gz OYHZFVYPSFDTAT-OAHLLOKOSA-N 0 3 405.568 4.013 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)Nc3ccc(Cc4ccncc4)cc3)CC2)c1 ZINC000467944947 881814304 /nfs/dbraw/zinc/81/43/04/881814304.db2.gz CSQBHOZXTTXOKI-UHFFFAOYSA-N 0 3 414.553 4.132 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)NC[C@@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000439580785 864901845 /nfs/dbraw/zinc/90/18/45/864901845.db2.gz KBJFZLDOJOKPSV-GDBMZVCRSA-N 0 3 421.454 4.407 20 0 HIADHN CN(Cc1ccco1)Cc1ccccc1CN[C@H]1CCN(c2ccc(Cl)cc2)C1=O ZINC000439593791 864914943 /nfs/dbraw/zinc/91/49/43/864914943.db2.gz GWNXAVVDBGWXEL-QHCPKHFHSA-N 0 3 423.944 4.460 20 0 HIADHN Cc1ccccc1CN(C)C(=O)[C@@H](C)NCc1ccccc1CN(C)Cc1ccco1 ZINC000439594295 864916288 /nfs/dbraw/zinc/91/62/88/864916288.db2.gz KMUHXAZXHADXIA-OAQYLSRUSA-N 0 3 419.569 4.357 20 0 HIADHN CC(=O)c1cccc(NC(=O)[C@H](C)NCc2ccccc2CN(C)Cc2ccco2)c1 ZINC000439597796 864920445 /nfs/dbraw/zinc/92/04/45/864920445.db2.gz PGNXWZKVXMMSGP-SFHVURJKSA-N 0 3 419.525 4.231 20 0 HIADHN CC(C)N(CCN(C)C)C(=O)c1ccc(COc2ccc(Br)cc2)o1 ZINC000439621249 864944517 /nfs/dbraw/zinc/94/45/17/864944517.db2.gz BWIONHHAJUIXMB-UHFFFAOYSA-N 0 3 409.324 4.033 20 0 HIADHN COC(=O)c1ccc(C)c(NC(=O)[C@H](C)NCC(C)(C)c2c(F)cccc2Cl)c1 ZINC000439644367 864970559 /nfs/dbraw/zinc/97/05/59/864970559.db2.gz IVRVUPLPNNVXIY-AWEZNQCLSA-N 0 3 420.912 4.469 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)c2cc(-c3ccccc3Cl)n[nH]2)CC1 ZINC000439728822 865060550 /nfs/dbraw/zinc/06/05/50/865060550.db2.gz FJNJWUNLFVRZOA-OAHLLOKOSA-N 0 3 409.921 4.081 20 0 HIADHN O=C(CCN1CCN(c2ccccc2)CC1)Nc1ccccc1COc1ccccc1 ZINC000467981145 881832166 /nfs/dbraw/zinc/83/21/66/881832166.db2.gz DXSPDPRXVXHWOW-UHFFFAOYSA-N 0 3 415.537 4.416 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)CCc2ncc(-c3ccccc3)o2)CC1 ZINC000439743138 865075554 /nfs/dbraw/zinc/07/55/54/865075554.db2.gz IXJCCNHEYSEUAI-GOSISDBHSA-N 0 3 404.514 4.011 20 0 HIADHN COc1cc(C(=O)NC2CCN([C@@H](C)c3ccncc3)CC2)ccc1OCC(C)C ZINC000439748129 865079608 /nfs/dbraw/zinc/07/96/08/865079608.db2.gz TUICHPGNRBEABQ-SFHVURJKSA-N 0 3 411.546 4.080 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)C[C@H](c2ccccc2)C(F)(F)F)CC1 ZINC000439763320 865088410 /nfs/dbraw/zinc/08/84/10/865088410.db2.gz HSKZUBOFGDFWMO-OXQOHEQNSA-N 0 3 405.464 4.459 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)c2cccc(Oc3ccncc3)c2)CC1 ZINC000439762629 865089104 /nfs/dbraw/zinc/08/91/04/865089104.db2.gz FGGDGAKLJPPCQJ-SFHVURJKSA-N 0 3 402.498 4.224 20 0 HIADHN C[C@@H](CSc1ccc(F)cc1)C(=O)NC1CCN([C@@H](C)c2ccncc2)CC1 ZINC000439776997 865100671 /nfs/dbraw/zinc/10/06/71/865100671.db2.gz ZAZDUCAJEQFMHP-IRXDYDNUSA-N 0 3 401.551 4.291 20 0 HIADHN Cc1cc(CCCC(=O)Nc2ccccc2CN2CCC[C@H](C(N)=O)C2)c(C)s1 ZINC000439796246 865116183 /nfs/dbraw/zinc/11/61/83/865116183.db2.gz XSDDHBRMKYJGPC-FQEVSTJZSA-N 0 3 413.587 4.024 20 0 HIADHN Cc1ccc(-c2ccnn2C)cc1NC(=O)N[C@H]1C[C@@H](C)N(Cc2ccccc2)C1 ZINC000439951042 865243964 /nfs/dbraw/zinc/24/39/64/865243964.db2.gz PUZJJQURBWVOFA-NQIIRXRSSA-N 0 3 403.530 4.180 20 0 HIADHN CCc1ccc([C@H](CNC(=O)Nc2cc(-c3ccnn3C)ccc2C)N(C)C)cc1 ZINC000439979895 865278040 /nfs/dbraw/zinc/27/80/40/865278040.db2.gz NEMIBCYHXOSSHP-QHCPKHFHSA-N 0 3 405.546 4.382 20 0 HIADHN CCN1CCN(CCC(=O)N[C@@H](c2ccccc2)c2ccc(Cl)c(Cl)c2)CC1 ZINC000468019436 881856092 /nfs/dbraw/zinc/85/60/92/881856092.db2.gz ICKNIJSTMQFAEC-QFIPXVFZSA-N 0 3 420.384 4.227 20 0 HIADHN COCCc1nc2cc(NC(=O)[C@@H]3CCCN(Cc4cccc(F)c4)C3)ccc2o1 ZINC000439988916 865297634 /nfs/dbraw/zinc/29/76/34/865297634.db2.gz OYQQWEUNAGHGSG-QGZVFWFLSA-N 0 3 411.477 4.007 20 0 HIADHN C[C@H](N[C@@H]1CC(=O)N(Cc2ccccc2C(F)(F)F)C1)c1ccc2c(c1)COC2 ZINC000468027073 881860805 /nfs/dbraw/zinc/86/08/05/881860805.db2.gz BNGWHQQZQDJXSX-IFXJQAMLSA-N 0 3 404.432 4.187 20 0 HIADHN CN(C)CCN(C(=O)NCc1cccc(Cn2cnc3ccccc32)c1)C1CCCC1 ZINC000468030773 881863757 /nfs/dbraw/zinc/86/37/57/881863757.db2.gz RUCHHTSRUUMEPH-UHFFFAOYSA-N 0 3 419.573 4.100 20 0 HIADHN COc1ccc([C@@H](NC[C@@H](O)COCC(C)C)c2ccccc2)cc1Br ZINC000440186954 865413451 /nfs/dbraw/zinc/41/34/51/865413451.db2.gz BSXWKBHEBGFNKY-NQIIRXRSSA-N 0 3 422.363 4.170 20 0 HIADHN Cc1nc2c(s1)[C@@H](N[C@H]1CC(=O)N(Cc3ccccc3C(F)(F)F)C1)CCC2 ZINC000468049597 881875197 /nfs/dbraw/zinc/87/51/97/881875197.db2.gz OFSCFUIVNILJSI-YOEHRIQHSA-N 0 3 409.477 4.238 20 0 HIADHN CC(C)(CN[C@@H](c1c[nH]nn1)c1ccc(F)cc1)c1ccccc1Br ZINC000468069139 881886022 /nfs/dbraw/zinc/88/60/22/881886022.db2.gz OCSWVNUXPLJZJV-GOSISDBHSA-N 0 3 403.299 4.363 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)N[C@@H](CC(F)(F)F)c3ccccc3)CC2)c1 ZINC000468074113 881887972 /nfs/dbraw/zinc/88/79/72/881887972.db2.gz PHMVPPOKLDKUJS-NRFANRHFSA-N 0 3 419.491 4.317 20 0 HIADHN CCOC(=O)c1c2c(sc1[N-]C(=O)c1cc(C3CC3)no1)C(C)(C)[NH2+]C(C)(C)C2 ZINC000440422768 865721644 /nfs/dbraw/zinc/72/16/44/865721644.db2.gz GAOUXJOWFHLHEN-UHFFFAOYSA-N 0 3 417.531 4.202 20 0 HIADHN COCc1nc(C(=O)NC[C@@H](C)N(C)Cc2ccccc2)c(-c2ccccc2)s1 ZINC000440485379 865789963 /nfs/dbraw/zinc/78/99/63/865789963.db2.gz JLRUPGZHXBXLJD-QGZVFWFLSA-N 0 3 409.555 4.207 20 0 HIADHN CN(C)[C@@H](CNC(=O)N1CCC[C@H]1c1nc2ccc(Cl)cc2[nH]1)c1cccs1 ZINC000440499938 865797616 /nfs/dbraw/zinc/79/76/16/865797616.db2.gz ABBDJKABUXDZLW-IRXDYDNUSA-N 0 3 417.966 4.427 20 0 HIADHN CSc1ccccc1[C@H](C)NCC(=O)Nc1cccc(CN2CCSCC2)c1 ZINC000440626912 865846406 /nfs/dbraw/zinc/84/64/06/865846406.db2.gz OUOKFYZONIYTPJ-KRWDZBQOSA-N 0 3 415.628 4.247 20 0 HIADHN CN(C)Cc1cccc(NC(=O)C(=O)Nc2ccc(COCc3ccccc3)cc2)c1 ZINC000440762533 865895017 /nfs/dbraw/zinc/89/50/17/865895017.db2.gz PMRUXTYSDSETOA-UHFFFAOYSA-N 0 3 417.509 4.042 20 0 HIADHN CN1CCN(CC(=O)N2c3ccccc3CCc3ccccc32)C2(CCCCC2)C1 ZINC000440790996 865914097 /nfs/dbraw/zinc/91/40/97/865914097.db2.gz HKXBLQPCYHJHNH-UHFFFAOYSA-N 0 3 403.570 4.400 20 0 HIADHN Cc1ccc(-c2nnc(-c3ccc(C(=O)N[C@@H]4C[C@H](C)N(C5CC5)C4)cc3)o2)cc1 ZINC000440917070 866011939 /nfs/dbraw/zinc/01/19/39/866011939.db2.gz ZGIQZTOEVFOFFI-OXJNMPFZSA-N 0 3 402.498 4.067 20 0 HIADHN Cc1ccc(NC(=O)CSc2ccccc2C(=O)N[C@H]2C[C@H](C)N(C3CC3)C2)cc1 ZINC000440921927 866018094 /nfs/dbraw/zinc/01/80/94/866018094.db2.gz FHFKKOJTZFUOKD-HKUYNNGSSA-N 0 3 423.582 4.081 20 0 HIADHN C[C@H]1C[C@H](NC(=O)c2cccc(NC(=O)CCCc3cccs3)c2)CN1C1CC1 ZINC000440926409 866023312 /nfs/dbraw/zinc/02/33/12/866023312.db2.gz XFLYALFZMOTEPQ-LPHOPBHVSA-N 0 3 411.571 4.065 20 0 HIADHN Cc1c2cc(Cl)ccc2sc1CNC(=O)N1CCN(C2CCOCC2)C[C@H]1C ZINC000441048623 866116152 /nfs/dbraw/zinc/11/61/52/866116152.db2.gz JQHXQFDMRRMOMD-CQSZACIVSA-N 0 3 421.994 4.258 20 0 HIADHN Cc1ccnc(Oc2ccc(NC(=O)N[C@H]3CCCN(Cc4ccccc4)C3)cc2)n1 ZINC000441085124 866179420 /nfs/dbraw/zinc/17/94/20/866179420.db2.gz BALRKKAGOZOWOS-NRFANRHFSA-N 0 3 417.513 4.363 20 0 HIADHN Cc1ccnc(Oc2ccc(NC(=O)NC[C@@H](C)N(C)Cc3ccccc3)cc2)n1 ZINC000441087511 866181912 /nfs/dbraw/zinc/18/19/12/866181912.db2.gz HMIPQJXYIUJCJB-GOSISDBHSA-N 0 3 405.502 4.219 20 0 HIADHN CC(C)OC(=O)c1ccc(CN2CCC(NC(=O)Nc3ccc(F)cc3)CC2)cc1 ZINC000441168678 866251484 /nfs/dbraw/zinc/25/14/84/866251484.db2.gz QKOMXBDZJIUPAO-UHFFFAOYSA-N 0 3 413.493 4.177 20 0 HIADHN CC(C)c1ncc(CN(C)C(=O)NC[C@@H](c2ccccc2)N2CCC(C)CC2)cn1 ZINC000441234932 866311116 /nfs/dbraw/zinc/31/11/16/866311116.db2.gz OECQDIKHNHBSHX-QFIPXVFZSA-N 0 3 409.578 4.215 20 0 HIADHN CC[C@H](Cc1ccc(C)cc1)N(CC)CC(=O)N1CCc2cc(OC)c(OC)cc2C1 ZINC000441327953 866399529 /nfs/dbraw/zinc/39/95/29/866399529.db2.gz AFZGBGPASYZGTF-HSZRJFAPSA-N 0 3 424.585 4.240 20 0 HIADHN Cc1ccc([C@@H]2CCC[C@H]2N(C)CC(=O)Nc2cccc(N3CCCC3=O)c2)cc1 ZINC000441338362 866409122 /nfs/dbraw/zinc/40/91/22/866409122.db2.gz CYIZNQATANWZGW-XZOQPEGZSA-N 0 3 405.542 4.328 20 0 HIADHN COc1cc(CN(C)C(=O)N[C@@H]2C[C@H](C)N(C3CC3)C2)ccc1OCc1ccccc1 ZINC000441356997 866427073 /nfs/dbraw/zinc/42/70/73/866427073.db2.gz MWFRSVUNKPDOGN-GHTZIAJQSA-N 0 3 423.557 4.041 20 0 HIADHN Cc1ccc([C@@H]2CCC[C@@H]2N(C)CC(=O)NCC2(c3ccccc3)CCOCC2)cc1 ZINC000441378866 866448553 /nfs/dbraw/zinc/44/85/53/866448553.db2.gz NGCWBHNSSAMGAD-DQEYMECFSA-N 0 3 420.597 4.428 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)c2cc(F)c(F)cc2Br)CN1Cc1ccccc1 ZINC000441451201 866527756 /nfs/dbraw/zinc/52/77/56/866527756.db2.gz TWJXKNPRTVSMHF-GXTWGEPZSA-N 0 3 409.274 4.120 20 0 HIADHN COCCOc1ccc(C(F)(F)F)cc1NC(=O)CN1[C@H](C)C[C@@H]2CCCC[C@H]21 ZINC000441459030 866534386 /nfs/dbraw/zinc/53/43/86/866534386.db2.gz QYNQWYDYPUDMPY-RVKKMQEKSA-N 0 3 414.468 4.322 20 0 HIADHN COc1ccc(CN(C)C(=O)CN(C)[C@@H](Cc2ccc(F)cc2)C(C)C)cc1OC ZINC000441624850 866723062 /nfs/dbraw/zinc/72/30/62/866723062.db2.gz XHMJDQZKNROOCO-NRFANRHFSA-N 0 3 416.537 4.000 20 0 HIADHN CCCN(C(=O)NCc1nnc(C(C)C)s1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000468147273 882007299 /nfs/dbraw/zinc/00/72/99/882007299.db2.gz SXCMKBBFOBJUCT-IBGZPJMESA-N 0 3 415.607 4.248 20 0 HIADHN COc1ccc(Br)cc1-c1nc(CN2CC[C@@H]([C@H]3CCOC3)C2)cs1 ZINC000441658708 866775162 /nfs/dbraw/zinc/77/51/62/866775162.db2.gz WOZDIWMIZMMIJF-KGLIPLIRSA-N 0 3 423.376 4.440 20 0 HIADHN Cc1nn(C(C)(C)C)cc1[C@@H](C)NC(=O)N(CCN(C)C)Cc1ccc(F)c(F)c1 ZINC000468157841 882022980 /nfs/dbraw/zinc/02/29/80/882022980.db2.gz JXDVBTYOCLPZOI-OAHLLOKOSA-N 0 3 421.536 4.059 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)c2cc(F)c(F)cc2Br)N(C)C)cc1 ZINC000441836297 866895307 /nfs/dbraw/zinc/89/53/07/866895307.db2.gz DYUWCIXXVCYAHE-GOSISDBHSA-N 0 3 411.290 4.322 20 0 HIADHN Cc1oc2ccccc2c1CCNC(=O)N(C)C1CCN(CCc2ccccn2)CC1 ZINC000468164317 882037611 /nfs/dbraw/zinc/03/76/11/882037611.db2.gz LQTWTIJJJKHPEI-UHFFFAOYSA-N 0 3 420.557 4.027 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3nc(C4CCC4)cs3)CC2)C[C@H](C)O1 ZINC000442078993 867109834 /nfs/dbraw/zinc/10/98/34/867109834.db2.gz MAEMKSXCCCVZFO-IYBDPMFKSA-N 0 3 406.596 4.154 20 0 HIADHN C[C@@H]1CCN(C)CCN1C(=O)N[C@@H]1CCCc2sc(-c3ccc(F)cc3)nc21 ZINC000468172042 882050633 /nfs/dbraw/zinc/05/06/33/882050633.db2.gz ZQXVWLFGRATLRN-RHSMWYFYSA-N 0 3 402.539 4.062 20 0 HIADHN CC[C@@H](C)[C@H](NC(=O)C(=O)Nc1cccc(CN(C)C)c1)c1ccc(Cl)cc1 ZINC000442144320 867165992 /nfs/dbraw/zinc/16/59/92/867165992.db2.gz HWJOKBREBHZPTB-QRWLVFNGSA-N 0 3 401.938 4.244 20 0 HIADHN CC(C)c1ncc(CN(C)C(=O)N[C@H](CN2CCc3ccccc3C2)C(C)(C)C)cn1 ZINC000442143579 867166021 /nfs/dbraw/zinc/16/60/21/867166021.db2.gz XDHHTRTWSPKENP-JOCHJYFZSA-N 0 3 423.605 4.214 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)C(=O)Nc3cccc4ccsc43)c2)CC1 ZINC000442158298 867179424 /nfs/dbraw/zinc/17/94/24/867179424.db2.gz FDNXUTHKIUXZHF-UHFFFAOYSA-N 0 3 422.554 4.009 20 0 HIADHN Cc1ccc([C@H](Cn2ccnc2)NC(=O)N(CCN(C)C)Cc2ccccc2)c(C)c1 ZINC000442233503 867268476 /nfs/dbraw/zinc/26/84/76/867268476.db2.gz DXRWYAFYDOQGAY-DEOSSOPVSA-N 0 3 419.573 4.015 20 0 HIADHN CCCc1ccc(-c2ccc(NC(=O)C(=O)N[C@@H](C)C3=CCN(C)CC3)cc2)cc1 ZINC000442341587 867335941 /nfs/dbraw/zinc/33/59/41/867335941.db2.gz LCVMAJNOVQFDHV-SFHVURJKSA-N 0 3 405.542 4.011 20 0 HIADHN CSc1ccccc1[C@H](C)NC(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000442592682 867549401 /nfs/dbraw/zinc/54/94/01/867549401.db2.gz HCSKAZZEVIUJFC-OTWHNJEPSA-N 0 3 419.635 4.390 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1ccncc1Oc1ccccc1 ZINC000442696578 867630914 /nfs/dbraw/zinc/63/09/14/867630914.db2.gz RCSGOTTVGCBBOS-UHFFFAOYSA-N 0 3 417.509 4.331 20 0 HIADHN C[S@](=O)C1(CN[C@@H](Cc2ccccc2F)c2ccccc2Br)CC1 ZINC000442826697 867690380 /nfs/dbraw/zinc/69/03/80/867690380.db2.gz XQQRDIDGQIRYAY-UUOWRZLLSA-N 0 3 410.352 4.373 20 0 HIADHN CCOc1cc(CN2CC[C@H](OC)C[C@H]2C)ccc1OCC(=O)Nc1ccccc1 ZINC000443063307 867806685 /nfs/dbraw/zinc/80/66/85/867806685.db2.gz AFDJILFTEXPZLX-NQIIRXRSSA-N 0 3 412.530 4.102 20 0 HIADHN CCOc1cc(CN2CC[C@H](OC)C[C@@H]2C)ccc1OCC(=O)Nc1ccccc1 ZINC000443063308 867807021 /nfs/dbraw/zinc/80/70/21/867807021.db2.gz AFDJILFTEXPZLX-RXVVDRJESA-N 0 3 412.530 4.102 20 0 HIADHN CCOc1cc(CN2CC[C@H](OC)C[C@@H]2C)ccc1OCC(=O)N(C(C)C)C(C)C ZINC000443077128 867813392 /nfs/dbraw/zinc/81/33/92/867813392.db2.gz ZIEDAKVYPMIJBT-FPOVZHCZSA-N 0 3 420.594 4.109 20 0 HIADHN C[C@@H](CC(=O)Nc1ccc(Br)cc1)N[C@H]1CCOc2c(F)cccc21 ZINC000443202004 867872803 /nfs/dbraw/zinc/87/28/03/867872803.db2.gz WHOAYEOAASMZGF-SJCJKPOMSA-N 0 3 407.283 4.419 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(F)cc2)CC1)[C@H]1CCSc2ccccc21 ZINC000443342817 867914832 /nfs/dbraw/zinc/91/48/32/867914832.db2.gz IBFQELHTTDXDRQ-NRFANRHFSA-N 0 3 414.546 4.065 20 0 HIADHN Cc1ccc2c(CCC(=O)NC3CCN(CCOc4ccc(F)cc4)CC3)c[nH]c2c1 ZINC000443344629 867916759 /nfs/dbraw/zinc/91/67/59/867916759.db2.gz IPUWLUCPQUYUIQ-UHFFFAOYSA-N 0 3 423.532 4.208 20 0 HIADHN O=C(C/C=C/c1ccccc1F)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000443355501 867922096 /nfs/dbraw/zinc/92/20/96/867922096.db2.gz WEUGXESITGVHHZ-HWKANZROSA-N 0 3 400.469 4.028 20 0 HIADHN CCCC(=O)NC[C@@H]1CCCN(Cc2cc(C)nc(-c3ccc(Cl)cc3)n2)C1 ZINC000443624099 868195799 /nfs/dbraw/zinc/19/57/99/868195799.db2.gz KQVLGIVJNZJZQD-KRWDZBQOSA-N 0 3 400.954 4.234 20 0 HIADHN C[C@H](Cc1ccc(Cl)cc1Cl)C(=O)NCCCCN1C[C@@H](C)O[C@H](C)C1 ZINC000443673513 868280198 /nfs/dbraw/zinc/28/01/98/868280198.db2.gz JOFNKUIMBJUFMM-BZUAXINKSA-N 0 3 401.378 4.178 20 0 HIADHN Cc1ccccc1COc1cccc(CC(=O)NCCCCN2C[C@@H](C)O[C@@H](C)C2)c1 ZINC000443675711 868282693 /nfs/dbraw/zinc/28/26/93/868282693.db2.gz QQVGFXWEKVWYGI-SZPZYZBQSA-N 0 3 424.585 4.122 20 0 HIADHN Cc1ccccc1[C@@H]([C@H](C)NC(=O)C(=O)Nc1ccccc1SC(C)C)N(C)C ZINC000443834727 868366256 /nfs/dbraw/zinc/36/62/56/868366256.db2.gz NOBCRFRUUCUAMK-LAUBAEHRSA-N 0 3 413.587 4.242 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N3CCC[C@@H]3CC(=O)c3ccccc3)cc2)CC1 ZINC000443840169 868371601 /nfs/dbraw/zinc/37/16/01/868371601.db2.gz MFOBFUOXQHZOLM-XMMPIXPASA-N 0 3 419.569 4.095 20 0 HIADHN Cc1ccccc1[C@H]([C@@H](C)NC(=O)C(=O)Nc1ccccc1OC1CCCC1)N(C)C ZINC000443846608 868377169 /nfs/dbraw/zinc/37/71/69/868377169.db2.gz ZXJJXCFVKYSKDS-JPYJTQIMSA-N 0 3 423.557 4.063 20 0 HIADHN CN1CCN(c2ccc(CNCc3ccc(Oc4cccc(F)c4)cc3)cn2)CC1 ZINC000443970693 868500856 /nfs/dbraw/zinc/50/08/56/868500856.db2.gz RUNBSRPIJNCBHG-UHFFFAOYSA-N 0 3 406.505 4.055 20 0 HIADHN FC(F)(F)c1ncc(CN[C@H]2CCN(c3ccccc3Br)C2)s1 ZINC000443983683 868509024 /nfs/dbraw/zinc/50/90/24/868509024.db2.gz FUFFDCZDQXDWAP-JTQLQIEISA-N 0 3 406.271 4.293 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@@H](C)NCc2cnc(C(F)(F)F)s2)CC1 ZINC000443988867 868512287 /nfs/dbraw/zinc/51/22/87/868512287.db2.gz PIVSZMSTLHXLIF-CYBMUJFWSA-N 0 3 416.488 4.294 20 0 HIADHN COc1ccc(CNCc2ccccc2-c2cnn(C)c2)c(OCc2cccnc2)c1 ZINC000443990462 868513909 /nfs/dbraw/zinc/51/39/09/868513909.db2.gz RKILWRHMNKKCAF-UHFFFAOYSA-N 0 3 414.509 4.360 20 0 HIADHN C[C@H](C(=O)Nc1cccc(C(=O)Nc2ccc(Cl)cn2)c1)N1[C@H](C)CC[C@H]1C ZINC000444002581 868521871 /nfs/dbraw/zinc/52/18/71/868521871.db2.gz JZRZFBBVNWZDTA-RBSFLKMASA-N 0 3 400.910 4.187 20 0 HIADHN C[C@@H](C(=O)Nc1cccc(C(=O)Nc2ccc(Cl)cn2)c1)N1[C@H](C)CC[C@@H]1C ZINC000444002582 868522400 /nfs/dbraw/zinc/52/24/00/868522400.db2.gz JZRZFBBVNWZDTA-ZNMIVQPWSA-N 0 3 400.910 4.187 20 0 HIADHN CCOc1ccc([C@@H]2CCCN2C(=O)CN2CC[C@@H](COCc3ccccc3)C2)cc1 ZINC000444186762 868657312 /nfs/dbraw/zinc/65/73/12/868657312.db2.gz RJWOFMXLUPQNCL-RDGATRHJSA-N 0 3 422.569 4.288 20 0 HIADHN CCCN(CC(=O)Nc1ccc2c(c1)OC1(CCCC1)O2)[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC000444227295 868676356 /nfs/dbraw/zinc/67/63/56/868676356.db2.gz UOILLGSKSSIOKF-WTOYTKOKSA-N 0 3 414.546 4.192 20 0 HIADHN CCCN(CC(=O)N(CC)c1nc2ccccc2s1)[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000444231923 868680096 /nfs/dbraw/zinc/68/00/96/868680096.db2.gz LACQKQPJNRBXCV-CDHQVMDDSA-N 0 3 401.576 4.175 20 0 HIADHN CN(CCC(=O)Nc1ccccc1C(=O)c1ccccc1)[C@@H](CCO)c1ccccc1 ZINC000444239271 868688790 /nfs/dbraw/zinc/68/87/90/868688790.db2.gz KFXYNFRLNKBHOR-DEOSSOPVSA-N 0 3 416.521 4.302 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)NC(=O)NC[C@@H](c2cccs2)N2CCCC2)cc1 ZINC000444337987 868764019 /nfs/dbraw/zinc/76/40/19/868764019.db2.gz MYVNNTCTDGJELY-UWJYYQICSA-N 0 3 423.586 4.440 20 0 HIADHN O=C(CSc1cccc(C(F)(F)F)c1)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000444456227 868834974 /nfs/dbraw/zinc/83/49/74/868834974.db2.gz WJNORLYPWSNYDB-UHFFFAOYSA-N 0 3 424.488 4.393 20 0 HIADHN Cc1cc(O[C@@H](C)C(=O)Nc2cccc(CN3CCC(O)CC3)c2)ccc1Cl ZINC000444459916 868836794 /nfs/dbraw/zinc/83/67/94/868836794.db2.gz HUBIAPZBDVKUSM-INIZCTEOSA-N 0 3 402.922 4.011 20 0 HIADHN Cc1ccc(-c2cc(C(=O)Nc3cccc(CN4CCC(CO)CC4)c3)on2)cc1 ZINC000444556094 868880054 /nfs/dbraw/zinc/88/00/54/868880054.db2.gz YQEJESJHBHAZBO-UHFFFAOYSA-N 0 3 405.498 4.107 20 0 HIADHN O[C@H](COc1ccc(Cl)cc1Br)CN1CC[C@H](CC(F)(F)F)C1 ZINC000444689431 868959959 /nfs/dbraw/zinc/95/99/59/868959959.db2.gz FVBIKBZJBMVYGV-PWSUYJOCSA-N 0 3 416.665 4.117 20 0 HIADHN Cc1c([C@H](C)NC(=O)N2CCN(Cc3ccccc3)C3(CCCCC3)C2)cnn1C ZINC000444703010 868965149 /nfs/dbraw/zinc/96/51/49/868965149.db2.gz JDCHAHFULONRBY-IBGZPJMESA-N 0 3 409.578 4.020 20 0 HIADHN CN(CCC(=O)Nc1ccc(Br)cc1F)Cc1cc(F)cc(F)c1 ZINC000444706059 868966916 /nfs/dbraw/zinc/96/69/16/868966916.db2.gz BSDLGZGAHXZZEQ-UHFFFAOYSA-N 0 3 401.226 4.327 20 0 HIADHN CC(C)Oc1ccc(NC(=O)N2CCC(CN3C[C@@H](C)O[C@H](C)C3)CC2)c(Cl)c1 ZINC000445024036 869173613 /nfs/dbraw/zinc/17/36/13/869173613.db2.gz NDJIJMZEZBDBGU-IAGOWNOFSA-N 0 3 423.985 4.480 20 0 HIADHN Cc1ccc(NC(=O)Cc2noc([C@@H]3CCCN(Cc4cccc(F)c4)C3)n2)c(C)c1 ZINC000445356532 869423184 /nfs/dbraw/zinc/42/31/84/869423184.db2.gz KNRWJYMRMZSWQM-LJQANCHMSA-N 0 3 422.504 4.386 20 0 HIADHN C[C@H](NC(=O)N[C@@H](CN1CCCC1)c1ccccc1)c1cccc(N2CCCC2)c1 ZINC000445503063 869568369 /nfs/dbraw/zinc/56/83/69/869568369.db2.gz JGZBIAALBILMCR-RDPSFJRHSA-N 0 3 406.574 4.484 20 0 HIADHN FC(F)(F)[C@@]1(c2nc(-c3cnc4ccccn34)no2)CCN(Cc2ccccc2)C1 ZINC000445572118 869631819 /nfs/dbraw/zinc/63/18/19/869631819.db2.gz QDWPULIZMJCEMB-FQEVSTJZSA-N 0 3 413.403 4.090 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)c1c[nH]nc1-c1cccc(Cl)c1 ZINC000445756730 869803401 /nfs/dbraw/zinc/80/34/01/869803401.db2.gz CSLIFQMOCDXYAX-QGZVFWFLSA-N 0 3 400.935 4.359 20 0 HIADHN O=C(CCC(=O)c1ccc(F)c(F)c1)NCc1ccccc1CN1CCCCC1 ZINC000445771288 869814754 /nfs/dbraw/zinc/81/47/54/869814754.db2.gz GAYALSMDCLHOCC-UHFFFAOYSA-N 0 3 400.469 4.230 20 0 HIADHN NC(=O)[C@@H]1CCCC[C@@H]1NCC(=O)Nc1ccccc1Sc1ccc(Cl)cc1 ZINC000445788034 869824808 /nfs/dbraw/zinc/82/48/08/869824808.db2.gz WSUOKXNIRQYMKV-SJORKVTESA-N 0 3 417.962 4.063 20 0 HIADHN CCN(Cc1ccccc1)C(=O)Cc1noc(C2CCN(Cc3ccccc3)CC2)n1 ZINC000445802317 869830691 /nfs/dbraw/zinc/83/06/91/869830691.db2.gz MARMCCREDJNBDM-UHFFFAOYSA-N 0 3 418.541 4.040 20 0 HIADHN Cc1ccc(S(=O)(=O)N[C@@H](CN[C@@H](c2cccnc2)C2CC2)c2ccccc2)cc1 ZINC000445806412 869833059 /nfs/dbraw/zinc/83/30/59/869833059.db2.gz VOUMIUHHKLZQET-BJKOFHAPSA-N 0 3 421.566 4.151 20 0 HIADHN O=C(CCCc1ccc(F)c(F)c1)NCCCCN1CCN(c2ccccc2)CC1 ZINC000445848856 869857122 /nfs/dbraw/zinc/85/71/22/869857122.db2.gz YOAWNBHDEMUDRP-UHFFFAOYSA-N 0 3 415.528 4.006 20 0 HIADHN COc1cc(-c2noc(CN[C@H]3CCC[C@H]3c3ccccc3)n2)cc(OC)c1OC ZINC000445993716 869955974 /nfs/dbraw/zinc/95/59/74/869955974.db2.gz TYFNEMDZXLOECX-ROUUACIJSA-N 0 3 409.486 4.188 20 0 HIADHN O=C(CCC(=O)c1ccc(F)c(F)c1)NC1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1 ZINC000446062966 870022135 /nfs/dbraw/zinc/02/21/35/870022135.db2.gz SFNTUZLAUVYIPO-IHWFROFDSA-N 0 3 412.480 4.240 20 0 HIADHN O=C(CCC(=O)c1ccc(F)c(F)c1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000446123439 870068951 /nfs/dbraw/zinc/06/89/51/870068951.db2.gz WQBSQAWFUHCZKO-UHFFFAOYSA-N 0 3 418.509 4.158 20 0 HIADHN CC(C)CC1(C(=O)N2CCC[C@@H](CN3CCN(c4ccccn4)CC3)C2)CCCC1 ZINC000446145022 870087243 /nfs/dbraw/zinc/08/72/43/870087243.db2.gz KOTHECPIBILIIU-QFIPXVFZSA-N 0 3 412.622 4.049 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)CCCc2cc(Cl)sc2Cl)C[C@H](C)O1 ZINC000446386619 870292490 /nfs/dbraw/zinc/29/24/90/870292490.db2.gz PQSPEDOOXZPQEJ-OKILXGFUSA-N 0 3 407.407 4.383 20 0 HIADHN CC1CCN([C@H](CNC(=O)Nc2c[nH]nc2-c2nccs2)c2cccs2)CC1 ZINC000446395546 870299330 /nfs/dbraw/zinc/29/93/30/870299330.db2.gz XIGBTTSSIHAELS-OAHLLOKOSA-N 0 3 416.576 4.189 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)cc1CNC(=O)c1oc2ccccc2c1CN(C)C ZINC000468461110 882401727 /nfs/dbraw/zinc/40/17/27/882401727.db2.gz QHFUSGJRAVMDGU-UHFFFAOYSA-N 0 3 406.461 4.058 20 0 HIADHN COc1ccccc1-c1csc([C@H]2CCCN(C(=O)[C@@H](C(C)C)N(C)C)C2)n1 ZINC000446489375 870402813 /nfs/dbraw/zinc/40/28/13/870402813.db2.gz YEERTFGCTBENHX-OXJNMPFZSA-N 0 3 401.576 4.111 20 0 HIADHN COc1ccc(CN[C@@H](CCn2cncn2)c2ccc(C)cc2)cc1OC(F)F ZINC000446745306 870652269 /nfs/dbraw/zinc/65/22/69/870652269.db2.gz RFZWWSNTDDSSNN-SFHVURJKSA-N 0 3 402.445 4.118 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N[C@@H](c2ccccc2F)C2CCCC2)CC1 ZINC000446776331 870690790 /nfs/dbraw/zinc/69/07/90/870690790.db2.gz MQRKMHOIUHKQPD-JOCHJYFZSA-N 0 3 405.558 4.246 20 0 HIADHN CN(C[C@@H](O)COC1CCOCC1)[C@H](c1ccc(F)cc1)c1ccc(Cl)cc1 ZINC000446777375 870693227 /nfs/dbraw/zinc/69/32/27/870693227.db2.gz OMLNYHRLWVQHSO-IRLDBZIGSA-N 0 3 407.913 4.057 20 0 HIADHN CC(C)n1ccc(C[C@@H](C)NCc2ccc(Cl)cc2I)n1 ZINC000446835320 870753001 /nfs/dbraw/zinc/75/30/01/870753001.db2.gz NONAGWZMDWRZJB-GFCCVEGCSA-N 0 3 417.722 4.443 20 0 HIADHN COc1ccc([C@@H](CCn2cncn2)NCc2ccc(Br)c(F)c2)cc1 ZINC000446841899 870760099 /nfs/dbraw/zinc/76/00/99/870760099.db2.gz BQWAWDMFAFXRQX-LJQANCHMSA-N 0 3 419.298 4.110 20 0 HIADHN Cc1ccc([C@H](CCn2cncn2)NCc2ccc(C)cc2OC[C@H]2CCCO2)cc1 ZINC000446935593 870845570 /nfs/dbraw/zinc/84/55/70/870845570.db2.gz GIANGWYXOOQNKB-RPWUZVMVSA-N 0 3 420.557 4.374 20 0 HIADHN COC(=O)[C@@](C)(CN[C@@H](C)C(=O)Nc1c(C)cccc1C(C)C)c1ccc(F)cc1 ZINC000447024401 870900355 /nfs/dbraw/zinc/90/03/55/870900355.db2.gz WUXVRCJMHZHEIN-XDHUDOTRSA-N 0 3 414.521 4.305 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N[C@H](c1ccccc1F)C1CCCC1 ZINC000447041165 870917689 /nfs/dbraw/zinc/91/76/89/870917689.db2.gz VIYCSSSCOXOYGW-QFIPXVFZSA-N 0 3 411.521 4.182 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1cc(F)c(OC)cc1OC)c1cccc(OC)c1 ZINC000447062166 870941803 /nfs/dbraw/zinc/94/18/03/870941803.db2.gz XOPRNXBFYDYYFT-IBGZPJMESA-N 0 3 419.497 4.056 20 0 HIADHN COC(=O)c1cc(CN2CCC[C@@H](c3nc(-c4ccccc4OC)cs3)C2)c[nH]1 ZINC000447061896 870942047 /nfs/dbraw/zinc/94/20/47/870942047.db2.gz YZXSENLYXRRVTC-MRXNPFEDSA-N 0 3 411.527 4.313 20 0 HIADHN Cc1nc(-c2ccc(C)c(NC(=O)N(Cc3ccccc3)C3CCN(C)CC3)c2)n[nH]1 ZINC000447080810 870968019 /nfs/dbraw/zinc/96/80/19/870968019.db2.gz ZOVSVTGVDNYLKG-UHFFFAOYSA-N 0 3 418.545 4.217 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3cnn(-c4ccccc4F)c3)c(C)c2)CC1 ZINC000447190188 871082240 /nfs/dbraw/zinc/08/22/40/871082240.db2.gz BZRLLHRKYKRERB-UHFFFAOYSA-N 0 3 422.508 4.106 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)NCc1cccc(COc2ccccc2)c1 ZINC000447321267 871212682 /nfs/dbraw/zinc/21/26/82/871212682.db2.gz MSQYIIHETJCBCF-UHFFFAOYSA-N 0 3 407.514 4.132 20 0 HIADHN COc1ccc(COC[C@@H](O)CN[C@@H](C)c2ccc(Cl)cc2Cl)cc1OC ZINC000447327728 871217197 /nfs/dbraw/zinc/21/71/97/871217197.db2.gz WGUWXIREWHMCNK-BBRMVZONSA-N 0 3 414.329 4.239 20 0 HIADHN COc1ccc(COC[C@H](O)CN[C@H](C)c2ccc(Cl)cc2Cl)cc1OC ZINC000447327730 871221025 /nfs/dbraw/zinc/22/10/25/871221025.db2.gz WGUWXIREWHMCNK-CZUORRHYSA-N 0 3 414.329 4.239 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)NCCOc1ccccc1-c1ccccc1 ZINC000447334605 871226549 /nfs/dbraw/zinc/22/65/49/871226549.db2.gz RBAFUNFSTZCSHP-UHFFFAOYSA-N 0 3 407.514 4.099 20 0 HIADHN CCOc1ccccc1NC(=O)CCN1CCN(c2cccc3cnccc32)C[C@@H]1C ZINC000447386707 871296207 /nfs/dbraw/zinc/29/62/07/871296207.db2.gz RNJYQWYCTRKVKS-IBGZPJMESA-N 0 3 418.541 4.173 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)NCc1ccc(-c2ccc3c(c2)CCO3)cc1 ZINC000447386996 871296449 /nfs/dbraw/zinc/29/64/49/871296449.db2.gz SELWXYKZHVUYQO-UHFFFAOYSA-N 0 3 419.525 4.155 20 0 HIADHN O[C@@H](CN[C@@H](c1ccc(Br)cc1C(F)(F)F)C1CC1)C(F)(F)F ZINC000447528367 871392972 /nfs/dbraw/zinc/39/29/72/871392972.db2.gz IYVITORKUOBNOW-NWDGAFQWSA-N 0 3 406.164 4.432 20 0 HIADHN CC(C)[C@@H]1C[C@H](NCc2ccccc2OCC(=O)NC[C@H]2CCCO2)c2ccccc21 ZINC000447539869 871404900 /nfs/dbraw/zinc/40/49/00/871404900.db2.gz HWNGCJZQUAFGLW-QDSKXPNFSA-N 0 3 422.569 4.335 20 0 HIADHN CC(C)[C@@H]1C[C@H](NCc2cccc(NC(=O)CCN3CCOCC3)c2)c2ccccc21 ZINC000447546636 871416482 /nfs/dbraw/zinc/41/64/82/871416482.db2.gz XNBGZPADEXKCGK-DQEYMECFSA-N 0 3 421.585 4.322 20 0 HIADHN CC(=O)c1cc(C(=O)Nc2c(C)cnn2[C@@H]2CCN(Cc3ccccc3)C2)ccc1C ZINC000447581413 871485116 /nfs/dbraw/zinc/48/51/16/871485116.db2.gz SWDALNRAURXIDL-JOCHJYFZSA-N 0 3 416.525 4.402 20 0 HIADHN O=C(c1ccc(F)cc1)C1CCN(C(=O)C2CCN(Cc3ccccc3)CC2)CC1 ZINC000447707857 871649243 /nfs/dbraw/zinc/64/92/43/871649243.db2.gz DKOKJWGWFAUZIN-UHFFFAOYSA-N 0 3 408.517 4.159 20 0 HIADHN CN(C)[C@H]1CCOc2c(NC(=O)[C@H]3CCCCN3Cc3ccc(F)cc3)cccc21 ZINC000447721152 871663712 /nfs/dbraw/zinc/66/37/12/871663712.db2.gz FFZUWDUXJVVUAY-FCHUYYIVSA-N 0 3 411.521 4.204 20 0 HIADHN O=C(NC[C@@H]1CCCN(c2ccccc2)C1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000447735227 871685953 /nfs/dbraw/zinc/68/59/53/871685953.db2.gz CGYBEVJWVHCRMI-VXKWHMMOSA-N 0 3 409.549 4.071 20 0 HIADHN O=C(N1CCOc2c(F)cccc2C1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000447866468 871792036 /nfs/dbraw/zinc/79/20/36/871792036.db2.gz RHQJLRZNKWCLJX-OAQYLSRUSA-N 0 3 422.422 4.001 20 0 HIADHN CCOc1cc(CN[C@@H](CO)[C@H]2CCCO2)ccc1OCc1c(F)cccc1Cl ZINC000447982001 871833810 /nfs/dbraw/zinc/83/38/10/871833810.db2.gz HUUQBMPIZXOBDC-VQTJNVASSA-N 0 3 423.912 4.086 20 0 HIADHN Cc1ccc([C@@H](NC[C@H]2N(C)CCCC2(C)C)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000448020350 871863755 /nfs/dbraw/zinc/86/37/55/871863755.db2.gz BOMQEDNNUSTZAP-DHIUTWEWSA-N 0 3 414.615 4.198 20 0 HIADHN CO[C@H]1CCOc2c(NC(=O)N[C@H](CN(C)Cc3ccccc3)C(C)C)cccc21 ZINC000448052634 871883184 /nfs/dbraw/zinc/88/31/84/871883184.db2.gz DJPJWTDEQLAWQI-YADHBBJMSA-N 0 3 411.546 4.435 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NC[C@@H]1CCSC1)c1ccc(C(F)(F)F)cc1 ZINC000448169158 872044605 /nfs/dbraw/zinc/04/46/05/872044605.db2.gz JSYUKMPNTJPQNR-WMLDXEAASA-N 0 3 403.514 4.141 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1ccc(Br)c(Cl)c1 ZINC000448329426 872268039 /nfs/dbraw/zinc/26/80/39/872268039.db2.gz JLHJVSSUOOVBNT-UHFFFAOYSA-N 0 3 400.704 4.291 20 0 HIADHN CCN(C(=O)Nc1cnn(-c2ccccc2F)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000460123485 872598192 /nfs/dbraw/zinc/59/81/92/872598192.db2.gz DRPWDXMNTFYJDS-HXUWFJFHSA-N 0 3 407.493 4.140 20 0 HIADHN CCN(C(=O)Nc1cccc(C(=O)NC(C)(C)C)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000460132993 872619500 /nfs/dbraw/zinc/61/95/00/872619500.db2.gz IAUNSILKYONLPH-QFIPXVFZSA-N 0 3 422.573 4.343 20 0 HIADHN CCn1c(COCc2ccccc2)nnc1N1C[C@H](C)N(Cc2ccccc2)C[C@@H]1C ZINC000460181956 872743482 /nfs/dbraw/zinc/74/34/82/872743482.db2.gz YIKTWHWHDYRPOQ-SFTDATJTSA-N 0 3 419.573 4.114 20 0 HIADHN CCn1c(COCc2ccccc2)nnc1N1C[C@H](C)N(Cc2ccccc2)C[C@H]1C ZINC000460181953 872744378 /nfs/dbraw/zinc/74/43/78/872744378.db2.gz YIKTWHWHDYRPOQ-LEWJYISDSA-N 0 3 419.573 4.114 20 0 HIADHN Cc1ccc2[nH]cc(CCC(=O)NCCCCN3CCN(c4ccccc4)CC3)c2c1 ZINC000468575828 882646921 /nfs/dbraw/zinc/64/69/21/882646921.db2.gz NRBZJMPHNIFDSI-UHFFFAOYSA-N 0 3 418.585 4.128 20 0 HIADHN C[C@H](CC1CC1)NC(=O)N(Cc1ccccc1Br)C1CCN(C)CC1 ZINC000460240151 872828427 /nfs/dbraw/zinc/82/84/27/872828427.db2.gz RPPKNMYQZDHDNP-OAHLLOKOSA-N 0 3 408.384 4.244 20 0 HIADHN CCCN(CCN1CCN(CC)CC1)C(=O)N[C@H](CC(C)C)c1ccccc1C ZINC000460245388 872833278 /nfs/dbraw/zinc/83/32/78/872833278.db2.gz LYWYXNJQVHWYCA-HSZRJFAPSA-N 0 3 402.627 4.141 20 0 HIADHN COc1ccccc1[C@@H](NC(=O)N[C@H](C)CN(C)Cc1ccccc1)c1ccco1 ZINC000460376674 873015658 /nfs/dbraw/zinc/01/56/58/873015658.db2.gz KRVZEBLGEWSEIC-WZONZLPQSA-N 0 3 407.514 4.197 20 0 HIADHN CN(C)[C@H](CNC(=O)CN1CCCC[C@@H]1c1cc2ccccc2[nH]1)c1ccccc1 ZINC000460388253 873033064 /nfs/dbraw/zinc/03/30/64/873033064.db2.gz PSZOLBJROMUGGE-DNQXCXABSA-N 0 3 404.558 4.114 20 0 HIADHN CCC[C@H]1C[C@@H]1NC(=O)N(Cc1ccccc1Br)C1CCN(C)CC1 ZINC000460396324 873045534 /nfs/dbraw/zinc/04/55/34/873045534.db2.gz ZYWSUPGQRNFPFS-KXBFYZLASA-N 0 3 408.384 4.244 20 0 HIADHN CC(C)[C@H](C)CNC(=O)N(Cc1ccccc1Br)C1CCN(C)CC1 ZINC000460534434 873231829 /nfs/dbraw/zinc/23/18/29/873231829.db2.gz ROZBYZYIBVJHQC-MRXNPFEDSA-N 0 3 410.400 4.347 20 0 HIADHN CC(C)Cn1c([C@@H]2OCC[C@@H]2C)nnc1N1C[C@@H](C)N(Cc2ccccc2)C[C@@H]1C ZINC000460614605 873358001 /nfs/dbraw/zinc/35/80/01/873358001.db2.gz WMCOUHSGJDXIAZ-CUXKYVRBSA-N 0 3 411.594 4.131 20 0 HIADHN C[C@@H]1CC[C@@H](CNC(=O)N(Cc2ccccc2Br)C2CCN(C)CC2)C1 ZINC000460743911 873571903 /nfs/dbraw/zinc/57/19/03/873571903.db2.gz XVBFILOHIIHJTN-IAGOWNOFSA-N 0 3 422.411 4.491 20 0 HIADHN Cc1cc(C)c(Br)c(C(=O)NC2CCN(Cc3ccccc3)CC2)c1 ZINC000460756125 873595906 /nfs/dbraw/zinc/59/59/06/873595906.db2.gz HPBIWKLSFYFYRZ-UHFFFAOYSA-N 0 3 401.348 4.460 20 0 HIADHN CN1CCC(N(Cc2ccccc2Br)C(=O)NCC2(C3CC3)CC2)CC1 ZINC000460946041 873844958 /nfs/dbraw/zinc/84/49/58/873844958.db2.gz ASULNRPIVVXCAS-UHFFFAOYSA-N 0 3 420.395 4.245 20 0 HIADHN COCCCOc1cccc(C(=O)NC[C@H](c2ccccc2)N2CCC(C)CC2)c1 ZINC000460962031 873858608 /nfs/dbraw/zinc/85/86/08/873858608.db2.gz IJAMKSYWPDHNIY-XMMPIXPASA-N 0 3 410.558 4.305 20 0 HIADHN O=C(NCc1ccccc1)[C@H](NC[C@@H]1CCN(c2ccccc2F)C1)c1ccccc1 ZINC000461077189 873978572 /nfs/dbraw/zinc/97/85/72/873978572.db2.gz SPFMBRJTIQSOSN-SQJMNOBHSA-N 0 3 417.528 4.299 20 0 HIADHN Cc1ccccc1[C@H](NCc1ccc(N2CCCS2(=O)=O)cc1)c1ccccc1 ZINC000461083885 873995547 /nfs/dbraw/zinc/99/55/47/873995547.db2.gz KYGDAHGWBJFGCZ-XMMPIXPASA-N 0 3 406.551 4.414 20 0 HIADHN O=S1(=O)CCCN1c1ccc(CN[C@@H]2CCSc3ccc(Cl)cc32)cc1 ZINC000461091310 874004885 /nfs/dbraw/zinc/00/48/85/874004885.db2.gz CMRXBAVXXNSEGG-GOSISDBHSA-N 0 3 408.976 4.207 20 0 HIADHN Cc1ccccc1[C@@H]1CN(C(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)[C@H](C)CO1 ZINC000461251396 874254326 /nfs/dbraw/zinc/25/43/26/874254326.db2.gz CXDWFKHYYLXVOL-ZYKOEDHHSA-N 0 3 410.533 4.335 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)NC1CCC2(CCCCC2)CC1 ZINC000468694141 882817465 /nfs/dbraw/zinc/81/74/65/882817465.db2.gz NSNDPAWQTMCMTC-UHFFFAOYSA-N 0 3 413.606 4.336 20 0 HIADHN O=S1(=O)CCCN1c1ccc(CNCc2cccc(Oc3ccccc3)c2)cc1 ZINC000461405601 874416309 /nfs/dbraw/zinc/41/63/09/874416309.db2.gz GPTCAVOXCLLCID-UHFFFAOYSA-N 0 3 408.523 4.309 20 0 HIADHN CCN(C(=O)NC[C@@H](c1ccc(OC(C)C)cc1)N(C)C)[C@@H]1CCOC(C)(C)C1 ZINC000461414476 874430757 /nfs/dbraw/zinc/43/07/57/874430757.db2.gz BFHNXPCAXBDFCM-CTNGQTDRSA-N 0 3 405.583 4.066 20 0 HIADHN CCCCCOc1ccc(CNCc2ccc(N3CCCS3(=O)=O)cc2)cc1 ZINC000461423997 874453698 /nfs/dbraw/zinc/45/36/98/874453698.db2.gz VZKFOYADRYXLEX-UHFFFAOYSA-N 0 3 402.560 4.085 20 0 HIADHN CCOc1ccc(C(=O)CCC(=O)N2C[C@@H]3CCN(Cc4ccccc4)C[C@H]3C2)cc1 ZINC000461426921 874461979 /nfs/dbraw/zinc/46/19/79/874461979.db2.gz FKWBECBBEODLHG-GOTSBHOMSA-N 0 3 420.553 4.029 20 0 HIADHN O=S1(=O)CCCN1c1ccc(CNCc2ccc(Cl)c(C(F)(F)F)c2)cc1 ZINC000461434846 874486024 /nfs/dbraw/zinc/48/60/24/874486024.db2.gz ZMZPAAUENQJEQW-UHFFFAOYSA-N 0 3 418.868 4.189 20 0 HIADHN C[C@H](CC(=O)c1ccccc1F)C(=O)N1C[C@@H]2CCN(Cc3ccccc3)C[C@@H]2C1 ZINC000461438565 874491290 /nfs/dbraw/zinc/49/12/90/874491290.db2.gz MFVDGNJOIFISBH-HLAWJBBLSA-N 0 3 408.517 4.015 20 0 HIADHN Cc1cn(-c2c(F)cccc2F)nc1C(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000468745874 882839513 /nfs/dbraw/zinc/83/95/13/882839513.db2.gz WGRXZTJBYYCEBH-WMZOPIPTSA-N 0 3 410.468 4.024 20 0 HIADHN COc1cc(Br)ccc1[C@H](C)NC(=O)N(CCN(C)C)C1CCCC1 ZINC000468778762 882855695 /nfs/dbraw/zinc/85/56/95/882855695.db2.gz AYSITAFXRUEITI-AWEZNQCLSA-N 0 3 412.372 4.035 20 0 HIADHN C[C@H]1CN(CCCCNC(=O)C(C)(C)Cc2ccc(C(F)(F)F)cc2)C[C@H](C)O1 ZINC000468805996 882869034 /nfs/dbraw/zinc/86/90/34/882869034.db2.gz CRWMVGYUPLTOKQ-IRXDYDNUSA-N 0 3 414.512 4.280 20 0 HIADHN C[C@H](C(=O)NCCCN1CCc2ccccc2C1)c1cccc(Br)c1 ZINC000461888336 875038238 /nfs/dbraw/zinc/03/82/38/875038238.db2.gz GXPBAGNAKDNRFL-INIZCTEOSA-N 0 3 401.348 4.117 20 0 HIADHN COC(=O)[C@](C)(CN[C@@H](C)C(=O)Nc1cc(Cl)ccc1Cl)c1ccccc1 ZINC000468861344 882895009 /nfs/dbraw/zinc/89/50/09/882895009.db2.gz GDEZFOLURYKMIH-RNODOKPDSA-N 0 3 409.313 4.041 20 0 HIADHN Cc1nc(C(F)(F)F)sc1C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000462030145 875145561 /nfs/dbraw/zinc/14/55/61/875145561.db2.gz IBEMMDDJQYNECN-UHFFFAOYSA-N 0 3 415.506 4.314 20 0 HIADHN Cc1ccccc1-c1cc(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2)n(C)n1 ZINC000462071057 875182383 /nfs/dbraw/zinc/18/23/83/875182383.db2.gz JEULDRVLMJAZDV-UHFFFAOYSA-N 0 3 409.509 4.130 20 0 HIADHN Cc1ccccc1-c1cc(NC(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)n(C)n1 ZINC000462088528 875197987 /nfs/dbraw/zinc/19/79/87/875197987.db2.gz NFQSMEPUBFQHQT-AZUAARDMSA-N 0 3 403.530 4.353 20 0 HIADHN Cc1nc2ccc(Br)cc2c(N2CCC[C@H](C(=O)NCC3CC3)C2)c1C ZINC000462098525 875207031 /nfs/dbraw/zinc/20/70/31/875207031.db2.gz USUPWGBJKVPPKU-INIZCTEOSA-N 0 3 416.363 4.357 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)NCc1ccc2sccc2c1 ZINC000462168091 875264891 /nfs/dbraw/zinc/26/48/91/875264891.db2.gz XJAGUTQIJGKYDC-UHFFFAOYSA-N 0 3 403.498 4.453 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1cc(NC(=O)C(C)(C)C)ccc1F ZINC000462174585 875272855 /nfs/dbraw/zinc/27/28/55/875272855.db2.gz GUKRYEIVZUIASH-HRAATJIYSA-N 0 3 411.521 4.061 20 0 HIADHN CC(C)C(=O)Nc1ccc(Cl)c(C(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)c1 ZINC000462181396 875280440 /nfs/dbraw/zinc/28/04/40/875280440.db2.gz KQQJPYAAVSDZRJ-IERDGZPVSA-N 0 3 413.949 4.185 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Cc1coc(-c2ccc(Cl)cc2)n1 ZINC000462183245 875284374 /nfs/dbraw/zinc/28/43/74/875284374.db2.gz BPEZPOUBVQBLTQ-IIBYNOLFSA-N 0 3 409.917 4.174 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1cccc(NC(=O)c2cccs2)c1 ZINC000462187430 875291297 /nfs/dbraw/zinc/29/12/97/875291297.db2.gz IHPNUXKBEDYDPA-UTKZUKDTSA-N 0 3 419.550 4.251 20 0 HIADHN Cc1ccc(-c2nc(CC(=O)N[C@@H]3CN(Cc4ccccc4)C[C@@H]3C)cs2)cc1 ZINC000462189610 875294778 /nfs/dbraw/zinc/29/47/78/875294778.db2.gz OHNLXSIUYNRFNK-PGRDOPGGSA-N 0 3 405.567 4.298 20 0 HIADHN COCCOCc1ccc(C(=O)N[C@@H](CN2CCc3ccccc3C2)C(C)(C)C)cc1 ZINC000462215626 875323065 /nfs/dbraw/zinc/32/30/65/875323065.db2.gz RERHLUFTSZKPBC-DEOSSOPVSA-N 0 3 424.585 4.052 20 0 HIADHN O=C(CCN1CCC(c2noc(C3CC3)n2)CC1)Nc1cccc(C(F)(F)F)c1 ZINC000462233090 875344986 /nfs/dbraw/zinc/34/49/86/875344986.db2.gz JKDNMKABCPALLM-UHFFFAOYSA-N 0 3 408.424 4.174 20 0 HIADHN CC(C)(CNC(=O)N[C@H]1CCO[C@@H](c2ccccc2)C1)N1CCc2ccccc2C1 ZINC000462299971 875421307 /nfs/dbraw/zinc/42/13/07/875421307.db2.gz UZAWGGPOAPSELU-XZOQPEGZSA-N 0 3 407.558 4.043 20 0 HIADHN Cc1nc(-c2ccc(CNC(=O)N[C@@H]3CN(Cc4ccccc4)C[C@@H]3C)o2)cs1 ZINC000462308205 875428787 /nfs/dbraw/zinc/42/87/87/875428787.db2.gz IXUYDSHQYOZOQZ-HNAYVOBHSA-N 0 3 410.543 4.031 20 0 HIADHN c1ccc(C(OCCN2CCN(CCCc3ccncc3)CC2)c2ccccc2)cc1 ZINC000462326056 875444777 /nfs/dbraw/zinc/44/47/77/875444777.db2.gz JYMBDRLXDQPCJI-UHFFFAOYSA-N 0 3 415.581 4.438 20 0 HIADHN Cc1cccc2c1ncc(C)c2N(C)CC(=O)N1c2ccccc2NC(=O)C[C@H]1C ZINC000462442843 875549275 /nfs/dbraw/zinc/54/92/75/875549275.db2.gz BTFXMYFKYVCGCE-QGZVFWFLSA-N 0 3 402.498 4.052 20 0 HIADHN CN(C)C[C@H](NC(=O)NC[C@H]1CC[C@@H](c2ccccc2)O1)c1ccc(Cl)cc1 ZINC000462480039 875588727 /nfs/dbraw/zinc/58/87/27/875588727.db2.gz OTVXACKVDUTVDQ-HKBOAZHASA-N 0 3 401.938 4.162 20 0 HIADHN Cc1ccccc1-c1cccc(CNCc2cccc(N3CCCS3(=O)=O)c2)c1 ZINC000462554702 875679697 /nfs/dbraw/zinc/67/96/97/875679697.db2.gz RIMQWFOEVMBISF-UHFFFAOYSA-N 0 3 406.551 4.492 20 0 HIADHN Cc1ccnc(-c2cccc(NC(=O)N[C@@H]3CN(Cc4ccccc4)C[C@@H]3C)c2)n1 ZINC000462557356 875683109 /nfs/dbraw/zinc/68/31/09/875683109.db2.gz LOQCBLWYOMVRSW-HTAPYJJXSA-N 0 3 401.514 4.094 20 0 HIADHN O=C1[C@@H](NCc2ccc(OC(F)F)cc2)CCCN1c1ccc(OC(F)F)cc1 ZINC000462730039 875806122 /nfs/dbraw/zinc/80/61/22/875806122.db2.gz FJJOMUYEIWXJJT-KRWDZBQOSA-N 0 3 412.383 4.175 20 0 HIADHN COc1ccccc1/C=C/CN[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1=O ZINC000462739770 875811189 /nfs/dbraw/zinc/81/11/89/875811189.db2.gz WWWWDAQPUQJCMD-ZLHKHBAESA-N 0 3 402.441 4.095 20 0 HIADHN CC(C)Oc1cccc(CN[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2=O)c1 ZINC000462743277 875812620 /nfs/dbraw/zinc/81/26/20/875812620.db2.gz WTOUVEWIYBDSSE-FQEVSTJZSA-N 0 3 404.457 4.360 20 0 HIADHN CCCNC(=O)[C@H]1CCCN(c2c(C)c(C)nc3ccc(Br)cc32)C1 ZINC000462807965 875854385 /nfs/dbraw/zinc/85/43/85/875854385.db2.gz UEXOVOJQDMAVCW-HNNXBMFYSA-N 0 3 404.352 4.357 20 0 HIADHN C[C@H](NC[C@@H]1C[C@@H](O)CN1Cc1ccccc1)c1csc(-c2ccccc2F)n1 ZINC000462822329 875860658 /nfs/dbraw/zinc/86/06/58/875860658.db2.gz OMQOARLTTOJHLU-YTQUADARSA-N 0 3 411.546 4.235 20 0 HIADHN Cc1nc2ccc(Br)cc2c(N2CCC[C@H](C(=O)N3CCCC3)C2)c1C ZINC000462834164 875868548 /nfs/dbraw/zinc/86/85/48/875868548.db2.gz OXDMVDKOSQXRKB-INIZCTEOSA-N 0 3 416.363 4.453 20 0 HIADHN CC[C@H](NCc1cnc(N2CCOCC2)c(F)c1)c1ccc(Br)cc1 ZINC000462846992 875881989 /nfs/dbraw/zinc/88/19/89/875881989.db2.gz DMJNPWSEVNYPNW-SFHVURJKSA-N 0 3 408.315 4.061 20 0 HIADHN COc1ccc([C@H](CCC(C)C)NCc2cnc(N3CCOCC3)c(F)c2)cc1 ZINC000462846244 875882121 /nfs/dbraw/zinc/88/21/21/875882121.db2.gz RSXYIOMWKUKWKQ-QFIPXVFZSA-N 0 3 401.526 4.333 20 0 HIADHN C[C@H](NC[C@@H](O)CN1CCc2ccccc2C1)c1csc(-c2ccccc2F)n1 ZINC000462885111 875911493 /nfs/dbraw/zinc/91/14/93/875911493.db2.gz UDJSVPPZJLXFBZ-QFBILLFUSA-N 0 3 411.546 4.019 20 0 HIADHN Cc1nc([C@@H](C)NCCCN2CCN(c3cccc(C(F)(F)F)c3)CC2)cs1 ZINC000462884348 875912218 /nfs/dbraw/zinc/91/22/18/875912218.db2.gz PIOOTVFSCBHQCO-OAHLLOKOSA-N 0 3 412.525 4.333 20 0 HIADHN CC[C@H](CO)N1CCN(c2nc(C3CC3)nc3scc(-c4ccccc4)c32)CC1 ZINC000462937892 875961967 /nfs/dbraw/zinc/96/19/67/875961967.db2.gz HNHGTGMXXCMIHV-GOSISDBHSA-N 0 3 408.571 4.129 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N[C@@H](c1nccs1)c1ccccc1 ZINC000463013033 876029884 /nfs/dbraw/zinc/02/98/84/876029884.db2.gz RIKQXEIOPOEPTR-JRGCBEDISA-N 0 3 406.555 4.052 20 0 HIADHN Cc1cccc([C@H](NC(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)c2ccccn2)c1 ZINC000463023739 876041347 /nfs/dbraw/zinc/04/13/47/876041347.db2.gz YYQZINWKZCBSIH-OPXMRZJTSA-N 0 3 414.553 4.299 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)[C@@H]3SCCc4ccccc43)CC2)c1 ZINC000463098928 876132507 /nfs/dbraw/zinc/13/25/07/876132507.db2.gz NWXGREUOMZOPSA-XMMPIXPASA-N 0 3 423.626 4.044 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)c3cccc(Br)c3C)cc2)CC1 ZINC000463105073 876141709 /nfs/dbraw/zinc/14/17/09/876141709.db2.gz DNXUPRXENATRKC-UHFFFAOYSA-N 0 3 416.363 4.147 20 0 HIADHN C[C@@H](CN1CCCCC1)NC(=O)c1ccc(-c2noc(-c3ccc(F)cc3)n2)cc1 ZINC000463117743 876160375 /nfs/dbraw/zinc/16/03/75/876160375.db2.gz XOPWFMIHKBIZIZ-INIZCTEOSA-N 0 3 408.477 4.147 20 0 HIADHN COc1cccc([C@H](CNC(=O)N[C@H]2CCO[C@H](c3ccccc3)C2)N2CCCC2)c1 ZINC000463155973 876209917 /nfs/dbraw/zinc/20/99/17/876209917.db2.gz QEWREIXCWWMIBA-XWGVYQGASA-N 0 3 423.557 4.052 20 0 HIADHN COc1ccc(-c2ncc(C(=O)N(CCN(C)C)Cc3ccccc3F)s2)cc1 ZINC000463159220 876212602 /nfs/dbraw/zinc/21/26/02/876212602.db2.gz YIEBKACHKCZLCM-UHFFFAOYSA-N 0 3 413.518 4.162 20 0 HIADHN COc1cccc(NC2CCN(C(=O)c3oc4ccccc4c3CN(C)C)CC2)c1 ZINC000468940994 883006996 /nfs/dbraw/zinc/00/69/96/883006996.db2.gz MJTFGNDKUGMEMK-UHFFFAOYSA-N 0 3 407.514 4.220 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)cc1C(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000463167147 876222508 /nfs/dbraw/zinc/22/25/08/876222508.db2.gz VMODPQBLCCNESL-PXNSSMCTSA-N 0 3 408.933 4.399 20 0 HIADHN C[C@@H]1CC[C@H](O)[C@H]([C@H]2CCCCN2Cc2csc(-c3ccc(C(N)=O)cc3)n2)C1 ZINC000463196062 876257426 /nfs/dbraw/zinc/25/74/26/876257426.db2.gz ARUIQJMLZSAONC-QAJUQPOASA-N 0 3 413.587 4.061 20 0 HIADHN C[C@@H]1CC[C@H](O)[C@@H]([C@@H]2CCCCN2CC(=O)N(Cc2ccco2)c2ccccc2)C1 ZINC000463203539 876264208 /nfs/dbraw/zinc/26/42/08/876264208.db2.gz KTRRSLZPFCTMIX-JFTIXFDTSA-N 0 3 410.558 4.464 20 0 HIADHN COCc1nc(CNC2CCN(c3nc(C)cs3)CC2)c(-c2ccccc2)s1 ZINC000463245358 876301349 /nfs/dbraw/zinc/30/13/49/876301349.db2.gz KVHUWOJFRMMMJZ-UHFFFAOYSA-N 0 3 414.600 4.480 20 0 HIADHN Cc1n[nH]c(C)c1[C@@H]1CCCCCN1C(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C ZINC000463270326 876327932 /nfs/dbraw/zinc/32/79/32/876327932.db2.gz GFCVCVRDVIVVRV-HSQYWUDLSA-N 0 3 409.578 4.174 20 0 HIADHN C[C@H]1CCCN(CCNC(=O)c2ccc(-c3noc(-c4ccc(F)cc4)n3)cc2)C1 ZINC000463386367 876441910 /nfs/dbraw/zinc/44/19/10/876441910.db2.gz WYCLFRWYNIVQPL-INIZCTEOSA-N 0 3 408.477 4.004 20 0 HIADHN CN1CCN(Cc2ccc(CNC(=O)C3CCC(c4ccccc4)CC3)cc2)CC1 ZINC000463394385 876448365 /nfs/dbraw/zinc/44/83/65/876448365.db2.gz SAFWLWDCQSGDHX-UHFFFAOYSA-N 0 3 405.586 4.024 20 0 HIADHN CC(C)N1CCCN(C(=O)c2ccc(-c3noc(-c4ccc(F)cc4)n3)cc2)CC1 ZINC000463472503 876532547 /nfs/dbraw/zinc/53/25/47/876532547.db2.gz CLTHRFWPXOHVHB-UHFFFAOYSA-N 0 3 408.477 4.099 20 0 HIADHN COc1ccc([C@H](CNC(=O)[C@H]2C[C@@H]2c2cc(F)c(F)c(F)c2)N2CCCC2)cc1 ZINC000463500326 876560809 /nfs/dbraw/zinc/56/08/09/876560809.db2.gz OKWNMQWSKMENDL-LQWHRVPQSA-N 0 3 418.459 4.169 20 0 HIADHN O=C(NC[C@H]1CCCCN1Cc1ccccc1)c1cccc(-c2noc(C3CC3)n2)c1 ZINC000463509967 876572275 /nfs/dbraw/zinc/57/22/75/876572275.db2.gz UYFVYDSHZOCXSZ-JOCHJYFZSA-N 0 3 416.525 4.399 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)[C@H]1C[C@H]1c1cc(F)c(F)c(F)c1 ZINC000463526976 876599334 /nfs/dbraw/zinc/59/93/34/876599334.db2.gz IJHKGLDOAURMBF-HOTGVXAUSA-N 0 3 412.402 4.076 20 0 HIADHN CC(C)c1nn(C)c2sc(C(=O)N(CCN(C)C)Cc3cccc(F)c3)cc12 ZINC000463527987 876601665 /nfs/dbraw/zinc/60/16/65/876601665.db2.gz RRHARSJDNBZYEP-UHFFFAOYSA-N 0 3 402.539 4.101 20 0 HIADHN Cc1nn(C)c(Sc2ccccc2)c1C(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000463594252 876704435 /nfs/dbraw/zinc/70/44/35/876704435.db2.gz UGTGZSLXHSAEQP-AZUAARDMSA-N 0 3 420.582 4.445 20 0 HIADHN COc1cccc([C@H](C)N2CCN(C(=O)c3oc4ccccc4c3CN(C)C)CC2)c1 ZINC000468992123 883059273 /nfs/dbraw/zinc/05/92/73/883059273.db2.gz OYWAGYFKHJJFPC-SFHVURJKSA-N 0 3 421.541 4.022 20 0 HIADHN COc1ccc(Cn2nc(C)c(CNCc3ccccc3-n3ccc(C)n3)c2C)cc1 ZINC000463739561 876860914 /nfs/dbraw/zinc/86/09/14/876860914.db2.gz OGJVUPBCBVNDAA-UHFFFAOYSA-N 0 3 415.541 4.341 20 0 HIADHN COc1ccc(Cn2nc(C)c(CNC[C@@H](c3ccco3)N3CCCCC3)c2C)cc1 ZINC000463753865 876877590 /nfs/dbraw/zinc/87/75/90/876877590.db2.gz YGXAPSVUKNRNRK-DEOSSOPVSA-N 0 3 422.573 4.467 20 0 HIADHN Cc1nn(C)c(Sc2ccccc2)c1C(=O)NC[C@@H](C)N(C)Cc1ccccc1 ZINC000463762543 876885301 /nfs/dbraw/zinc/88/53/01/876885301.db2.gz HOIIQFIMEFDDPD-QGZVFWFLSA-N 0 3 408.571 4.130 20 0 HIADHN C[C@H]1CC[C@H](CC(=O)NC2CCN(CCOc3ccc(Br)cc3)CC2)C1 ZINC000469009263 883076531 /nfs/dbraw/zinc/07/65/31/883076531.db2.gz RNFCLHVMNHBHAZ-IRXDYDNUSA-N 0 3 423.395 4.235 20 0 HIADHN COc1c(Br)c(C)sc1C(=O)NC[C@H](C)N(C)Cc1ccccc1 ZINC000463843557 876966100 /nfs/dbraw/zinc/96/61/00/876966100.db2.gz FKGGPXMJSHOFFN-LBPRGKRZSA-N 0 3 411.365 4.078 20 0 HIADHN Cn1ccc(N2CCC[C@@H](N[C@@H](CCCc3ccccc3)c3ccccc3)C2=O)n1 ZINC000463885988 877007698 /nfs/dbraw/zinc/00/76/98/877007698.db2.gz CNBOTZXCFWOIOI-XZOQPEGZSA-N 0 3 402.542 4.269 20 0 HIADHN Cn1cc(N2CCC[C@@H](N[C@H](CCCc3ccccc3)c3ccccc3)C2=O)cn1 ZINC000463900038 877022694 /nfs/dbraw/zinc/02/26/94/877022694.db2.gz ZAEFIWVHKDNYKR-DNQXCXABSA-N 0 3 402.542 4.269 20 0 HIADHN COc1ccc([C@@H](CNC(=O)NCCc2c[nH]c3c2cccc3C)N2CCCC2)cc1 ZINC000463953572 877075299 /nfs/dbraw/zinc/07/52/99/877075299.db2.gz GQWIYIAZJOKCIU-HSZRJFAPSA-N 0 3 420.557 4.164 20 0 HIADHN COc1ccc([C@@H](CNC(=O)N[C@@H](c2ncc(C)s2)C2CC2)N2CCCC2)cc1 ZINC000463969833 877096395 /nfs/dbraw/zinc/09/63/95/877096395.db2.gz KDFWZCJADUJHDX-WOJBJXKFSA-N 0 3 414.575 4.048 20 0 HIADHN O=C(Cc1cccc(Cl)c1F)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000464190109 877360938 /nfs/dbraw/zinc/36/09/38/877360938.db2.gz ZHAILLJAFLSWES-GOSISDBHSA-N 0 3 412.896 4.304 20 0 HIADHN C[C@@H](NC(=O)N[C@H]1CCCc2sc(-c3ccc(F)cc3)nc21)C1=CCN(C)CC1 ZINC000464308134 877498209 /nfs/dbraw/zinc/49/82/09/877498209.db2.gz OQHUHCCPOJTXCC-KDOFPFPSSA-N 0 3 414.550 4.276 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)NCc2cccc(-c3cccnc3)c2)C1 ZINC000464351343 877544224 /nfs/dbraw/zinc/54/42/24/877544224.db2.gz GSPMLYLQKNFIGF-CYFREDJKSA-N 0 3 400.526 4.383 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)N[C@H]1C[C@H](c2ccc(Br)cc2)C1 ZINC000464460987 877683376 /nfs/dbraw/zinc/68/33/76/877683376.db2.gz LVDYBKFNPWIARU-SAABIXHNSA-N 0 3 420.351 4.062 20 0 HIADHN CO[C@H](CNC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1)c1cccc(Cl)c1 ZINC000464592209 877818499 /nfs/dbraw/zinc/81/84/99/877818499.db2.gz HWQXFUBEFYIALC-WIYYLYMNSA-N 0 3 404.913 4.195 20 0 HIADHN C[C@@H](NC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1)c1nc(C2CCCCC2)no1 ZINC000464721765 877951120 /nfs/dbraw/zinc/95/11/20/877951120.db2.gz YFJIYOIVGWCDPL-VQIMIIECSA-N 0 3 414.525 4.346 20 0 HIADHN CCS[C@@H]1CC[C@@H](N(C)CC(=O)N(C)Cc2cc(Br)cs2)C1 ZINC000464767910 878010227 /nfs/dbraw/zinc/01/02/27/878010227.db2.gz DWTPOPMBVTWTEX-ZIAGYGMSSA-N 0 3 405.427 4.075 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@H](C)N2CC[C@@H](CSc3ccccc3)C2)cc1F ZINC000464773399 878016954 /nfs/dbraw/zinc/01/69/54/878016954.db2.gz NJJJBKGJQYYXDK-PKOBYXMFSA-N 0 3 416.562 4.295 20 0 HIADHN COc1cc2c(cc1OC)CN(C(=O)CN1CCCC[C@H]1c1cccc(C)c1C)CC2 ZINC000464782032 878028534 /nfs/dbraw/zinc/02/85/34/878028534.db2.gz VBFUDZUVFGUKQY-QHCPKHFHSA-N 0 3 422.569 4.433 20 0 HIADHN CCN(CC(=O)Nc1ccc(C(F)(F)F)cc1)CC1CCN(c2ccccn2)CC1 ZINC000464804629 878047361 /nfs/dbraw/zinc/04/73/61/878047361.db2.gz HOYIAMWSZMLUHE-UHFFFAOYSA-N 0 3 420.479 4.277 20 0 HIADHN CCOc1ccc(-c2noc(CN(CC)CC3CCN(c4ccccn4)CC3)n2)cc1 ZINC000464806521 878053083 /nfs/dbraw/zinc/05/30/83/878053083.db2.gz DGWQLPNDHAMEQY-UHFFFAOYSA-N 0 3 421.545 4.269 20 0 HIADHN C[C@@H](C(=O)Nc1ccccc1OC(F)F)N1CC[C@H](C)N(Cc2ccccc2)CC1 ZINC000464838815 878103138 /nfs/dbraw/zinc/10/31/38/878103138.db2.gz OKBPDIDSNAMBLA-ROUUACIJSA-N 0 3 417.500 4.211 20 0 HIADHN COC(=O)c1cc(CN2CCC[C@@H](c3nc(-c4cccc(F)c4)no3)C2)c(C)s1 ZINC000464863874 878145622 /nfs/dbraw/zinc/14/56/22/878145622.db2.gz BFAOKWQCSZDSRC-OAHLLOKOSA-N 0 3 415.490 4.412 20 0 HIADHN CCOc1c(Cl)cc(C(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)cc1OC ZINC000464888382 878187422 /nfs/dbraw/zinc/18/74/22/878187422.db2.gz DTVMJKYWYXYVKO-QGZVFWFLSA-N 0 3 416.949 4.484 20 0 HIADHN C[C@@H]1CCN(C(=O)CCc2ccc(OC(F)F)cc2)CCN1Cc1ccccc1 ZINC000464896028 878201854 /nfs/dbraw/zinc/20/18/54/878201854.db2.gz RFLHXASSDCNFAF-GOSISDBHSA-N 0 3 402.485 4.344 20 0 HIADHN CC[C@H](C)n1ncc2c1nc(C)cc2C(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1 ZINC000464897015 878203718 /nfs/dbraw/zinc/20/37/18/878203718.db2.gz VJBPRZXTTJKLTH-PMACEKPBSA-N 0 3 419.573 4.447 20 0 HIADHN COc1ccc(NC(=O)CN(CCc2cccc(F)c2)C2CCCC2)c(OC)c1 ZINC000464902049 878212666 /nfs/dbraw/zinc/21/26/66/878212666.db2.gz YWKFOKOEUQZZRN-UHFFFAOYSA-N 0 3 400.494 4.269 20 0 HIADHN C[C@H]1CCN(C(=O)Cc2ccccc2Br)CCN1Cc1ccccc1 ZINC000464912778 878230442 /nfs/dbraw/zinc/23/04/42/878230442.db2.gz XLEDYUSJQCTUJG-KRWDZBQOSA-N 0 3 401.348 4.115 20 0 HIADHN O[C@@H](COc1c(Cl)cccc1Cl)CN1CCC[C@H](c2ncc3n2CCCC3)C1 ZINC000503367788 912343852 /nfs/dbraw/zinc/34/38/52/912343852.db2.gz BEHHDKIUDDVYGE-DOTOQJQBSA-N 0 3 424.372 4.146 20 0 HIADHN O[C@H](COc1c(Cl)cccc1Cl)CN1CCC[C@H](c2ncc3n2CCCC3)C1 ZINC000503367792 912344227 /nfs/dbraw/zinc/34/42/27/912344227.db2.gz BEHHDKIUDDVYGE-RDJZCZTQSA-N 0 3 424.372 4.146 20 0 HIADHN COC(=O)c1ccsc1N1CC[C@H](N[C@@H](Cc2ccccc2)c2ccccc2)C1=O ZINC000465081350 878443245 /nfs/dbraw/zinc/44/32/45/878443245.db2.gz VGQFUEAODOQOTL-SFTDATJTSA-N 0 3 420.534 4.214 20 0 HIADHN Cc1ccc([C@H](NC(=O)N[C@H]2CCN(Cc3ccccc3)[C@@H]2C)c2ccccn2)cc1 ZINC000503373127 912352862 /nfs/dbraw/zinc/35/28/62/912352862.db2.gz RQSSSVQVEJXTHJ-PBXXJUDPSA-N 0 3 414.553 4.442 20 0 HIADHN CC(C)c1noc(-c2ccc(NC(=O)NC[C@H](Cc3ccccc3)N(C)C)cc2)n1 ZINC000503375280 912358029 /nfs/dbraw/zinc/35/80/29/912358029.db2.gz RJPLNULHONTSDZ-FQEVSTJZSA-N 0 3 407.518 4.154 20 0 HIADHN O[C@@H](COc1cc(Cl)ccc1Cl)CN1CCC[C@@H](c2ncc3n2CCCC3)C1 ZINC000503402618 912381988 /nfs/dbraw/zinc/38/19/88/912381988.db2.gz BOLFEUFWIBPKMJ-CRAIPNDOSA-N 0 3 424.372 4.146 20 0 HIADHN CO[C@]1(C)C[C@H](N[C@@H](C)C(=O)Nc2ccc(NC(=O)c3cccs3)cc2)C1(C)C ZINC000465414709 878847854 /nfs/dbraw/zinc/84/78/54/878847854.db2.gz UNCRQXLKVQGEPN-VELBRHGASA-N 0 3 415.559 4.121 20 0 HIADHN C[C@@H](CNC(=O)NC[C@H](c1cccs1)N1CCCC1)Oc1ccccc1Cl ZINC000465424661 878854642 /nfs/dbraw/zinc/85/46/42/878854642.db2.gz PJUKRRFKGJWTKR-DOTOQJQBSA-N 0 3 407.967 4.305 20 0 HIADHN O=C(NCc1c(F)cccc1OC(F)F)NC[C@H](c1ccccc1)N1CCCC1 ZINC000465432587 878864784 /nfs/dbraw/zinc/86/47/84/878864784.db2.gz XORBAUWNGYMHKA-GOSISDBHSA-N 0 3 407.436 4.063 20 0 HIADHN C[C@H](NC(=O)NC[C@H](c1cccs1)N1CCC(C)CC1)c1nc(C(C)(C)C)no1 ZINC000465433954 878866500 /nfs/dbraw/zinc/86/65/00/878866500.db2.gz OVNFAYUZYJCSTM-JKSUJKDBSA-N 0 3 419.595 4.262 20 0 HIADHN CC1CCN([C@@H](CNC(=O)NCc2cccc(N3CC=CC3)c2)c2cccs2)CC1 ZINC000465433781 878866706 /nfs/dbraw/zinc/86/67/06/878866706.db2.gz OKFFAOIYWZLUHG-QFIPXVFZSA-N 0 3 424.614 4.397 20 0 HIADHN C[C@H](NC(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1)c1nc(C(C)(C)C)no1 ZINC000465433952 878866896 /nfs/dbraw/zinc/86/68/96/878866896.db2.gz OVNFAYUZYJCSTM-HOTGVXAUSA-N 0 3 419.595 4.262 20 0 HIADHN COc1ccc(C2CCN(C(=O)NC[C@H](c3ccccc3)N3CCCC3)CC2)cc1 ZINC000465445654 878875667 /nfs/dbraw/zinc/87/56/67/878875667.db2.gz XVYMJLIAKJPPER-XMMPIXPASA-N 0 3 407.558 4.421 20 0 HIADHN O=C([C@H]1CCCN(Cc2cccc(F)c2)C1)N1CC(c2nc3ccccc3s2)C1 ZINC000465509914 878949706 /nfs/dbraw/zinc/94/97/06/878949706.db2.gz XOXJZFPVZFVIAY-KRWDZBQOSA-N 0 3 409.530 4.273 20 0 HIADHN CC[C@H](CNC(=O)N(Cc1ccc(O)cc1)CC1CC1)N1CCc2ccccc2C1 ZINC000465544630 879006044 /nfs/dbraw/zinc/00/60/44/879006044.db2.gz MZDXRBBJHOLTMK-HSZRJFAPSA-N 0 3 407.558 4.151 20 0 HIADHN Cc1ccccc1[C@@H]1CN(C(=O)N[C@H](CN2CCCC2)c2ccccc2)[C@H](C)CO1 ZINC000465594435 879079575 /nfs/dbraw/zinc/07/95/75/879079575.db2.gz HFWJLQNZHVXYSI-HUVFLSCGSA-N 0 3 407.558 4.304 20 0 HIADHN CC(C)(C)OC(=O)c1ccc(CNC(=O)N[C@H](CN2CCCC2)c2ccccc2)cc1 ZINC000465594467 879079753 /nfs/dbraw/zinc/07/97/53/879079753.db2.gz HKHLQRAZXDATCL-JOCHJYFZSA-N 0 3 423.557 4.278 20 0 HIADHN CC(C)CC[C@@H](NC(=O)NC[C@@H](C)CN1CCN(C)CC1)c1ccc(Cl)cc1 ZINC000465664144 879196652 /nfs/dbraw/zinc/19/66/52/879196652.db2.gz PTCKYSDTCVOMFV-WIYYLYMNSA-N 0 3 409.018 4.000 20 0 HIADHN CCc1nc(C)c([C@H](C)N(C)C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)s1 ZINC000465695924 879253177 /nfs/dbraw/zinc/25/31/77/879253177.db2.gz SKMGGJOGAVSIEC-PKOBYXMFSA-N 0 3 400.592 4.381 20 0 HIADHN CC[C@@H](NC(=O)NCCN(C)Cc1ccccc1)c1nc(C(F)(F)F)cs1 ZINC000465742089 879327946 /nfs/dbraw/zinc/32/79/46/879327946.db2.gz BOIISXSUNIXOKW-CQSZACIVSA-N 0 3 400.470 4.044 20 0 HIADHN COc1ccccc1C1(CNC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)CC1 ZINC000465780680 879384413 /nfs/dbraw/zinc/38/44/13/879384413.db2.gz LKBFILUOMFCXNE-FQEVSTJZSA-N 0 3 407.558 4.033 20 0 HIADHN O=C(NC[C@@H]1CCO[C@H]1c1ccccc1)NC[C@H]1CCCCN1Cc1ccccc1 ZINC000465795130 879404497 /nfs/dbraw/zinc/40/44/97/879404497.db2.gz YYNXTVHCMOSBNS-VXNXHJTFSA-N 0 3 407.558 4.118 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)N[C@H](C)c2ccccc2Oc2ccccc2)CC1 ZINC000465799305 879410038 /nfs/dbraw/zinc/41/00/38/879410038.db2.gz IIZMBLOZZVXDTQ-LEWJYISDSA-N 0 3 424.589 4.113 20 0 HIADHN Cc1ccc([C@H](CNC(=O)NC(C)(C)c2nc(C(F)(F)F)cs2)N(C)C)cc1 ZINC000465822134 879450621 /nfs/dbraw/zinc/45/06/21/879450621.db2.gz UWKODCWBVAZRFS-AWEZNQCLSA-N 0 3 414.497 4.308 20 0 HIADHN CC(C)[C@H](NC(=O)N(CCN(C)C)C[C@H]1CCCO1)c1cccc(C(F)(F)F)c1 ZINC000465830186 879462800 /nfs/dbraw/zinc/46/28/00/879462800.db2.gz HRTKUVKNRDRMDD-MOPGFXCFSA-N 0 3 415.500 4.155 20 0 HIADHN Cc1ccc(Oc2ccccc2CNC(=O)N(CCN(C)C)C[C@@H]2CCCO2)cc1 ZINC000465864656 879513442 /nfs/dbraw/zinc/51/34/42/879513442.db2.gz SNMGDSCJMYRVNA-QFIPXVFZSA-N 0 3 411.546 4.040 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccc(O)cc1)C(=O)c1cc(-c2cccs2)on1 ZINC000503445528 912466222 /nfs/dbraw/zinc/46/62/22/912466222.db2.gz FBUIBHXQXCZMOW-QGZVFWFLSA-N 0 3 411.527 4.235 20 0 HIADHN CC(C)[C@@H](CNC(=O)N1CC[C@@H](N2CC=CC2)C1)Cc1ccc(Cl)cc1Cl ZINC000465925124 879587834 /nfs/dbraw/zinc/58/78/34/879587834.db2.gz NZJAYNXUTJDSNV-IEBWSBKVSA-N 0 3 410.389 4.464 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)N[C@H](CC(C)(C)C)c2ccc(Cl)cc2)CC1 ZINC000465964624 879632927 /nfs/dbraw/zinc/63/29/27/879632927.db2.gz GMKBLAZGUQWWJI-GHTZIAJQSA-N 0 3 423.045 4.390 20 0 HIADHN O=C(N[C@H]1CCN(C2CC2)C1)N1CCC(COc2cc(Cl)cc(Cl)c2)CC1 ZINC000466020984 879707205 /nfs/dbraw/zinc/70/72/05/879707205.db2.gz JVSOBYZGXWHESC-KRWDZBQOSA-N 0 3 412.361 4.031 20 0 HIADHN COc1cccc([C@@H](NC(=O)N(C)[C@H]2CCN(C3CC3)C2)c2ccccc2Cl)c1 ZINC000466031468 879718534 /nfs/dbraw/zinc/71/85/34/879718534.db2.gz GBKMORBAXAXEIO-PGRDOPGGSA-N 0 3 413.949 4.316 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NC[C@H]3CCO[C@@H]3c3ccccc3)c(C)c2)CC1 ZINC000466065792 879764138 /nfs/dbraw/zinc/76/41/38/879764138.db2.gz TZZCZZBZKCIFKU-ZJSXRUAMSA-N 0 3 422.573 4.036 20 0 HIADHN CCCN(C(=O)NCc1nccn1CC(C)C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000466095499 879813778 /nfs/dbraw/zinc/81/37/78/879813778.db2.gz FJCGMKGMQIQAMI-JOCHJYFZSA-N 0 3 411.594 4.125 20 0 HIADHN CN(C(=O)NCc1ccc(Oc2ccccc2F)c(F)c1)[C@H]1CCN(C2CC2)C1 ZINC000466121116 879835200 /nfs/dbraw/zinc/83/52/00/879835200.db2.gz USUYGDDXFBEMGP-KRWDZBQOSA-N 0 3 401.457 4.135 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N[C@H](C)c3c(F)cccc3OC)c(C)c2)CC1 ZINC000466122353 879836158 /nfs/dbraw/zinc/83/61/58/879836158.db2.gz QRIPHVDTABTJLB-QGZVFWFLSA-N 0 3 414.525 4.167 20 0 HIADHN CCCN(C(=O)N[C@@H]1[C@@H]2CCCO[C@@H]2C1(C)C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000466133259 879845760 /nfs/dbraw/zinc/84/57/60/879845760.db2.gz FCYBYCKZAJUNMS-ACESQOTJSA-N 0 3 413.606 4.276 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)N(Cc2ccccc2Cl)C2CCCC2)CC1 ZINC000466136746 879847982 /nfs/dbraw/zinc/84/79/82/879847982.db2.gz RENFCMAJWLPTJB-IBGZPJMESA-N 0 3 421.029 4.068 20 0 HIADHN COC(C)(C)CNC(=O)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000466182215 879879012 /nfs/dbraw/zinc/87/90/12/879879012.db2.gz VQDPHZMYHMBHHE-UHFFFAOYSA-N 0 3 402.366 4.026 20 0 HIADHN C[C@H](NC(=O)N[C@H]1C[C@@H](C)N(Cc2ccccc2)C1)c1ccc(NC(=O)C2CC2)cc1 ZINC000466214329 879906686 /nfs/dbraw/zinc/90/66/86/879906686.db2.gz BGBGOJMNRYMOLQ-STSQHVNTSA-N 0 3 420.557 4.058 20 0 HIADHN C[C@H]1CCN(C)CCN1C(=O)N[C@H](c1ccccc1Cl)c1cc(F)ccc1F ZINC000466236993 879944441 /nfs/dbraw/zinc/94/44/41/879944441.db2.gz ANMKQWDXRCGJEN-VBKZILBWSA-N 0 3 407.892 4.443 20 0 HIADHN COc1ccc(-c2cncc(C(=O)N[C@@H]3CCN([C@@H](C)c4ccccc4)C3)c2)cc1 ZINC000466303861 880052742 /nfs/dbraw/zinc/05/27/42/880052742.db2.gz ZKNXUALARXZCEB-FDDCHVKYSA-N 0 3 401.510 4.323 20 0 HIADHN C[C@H](CNC(=O)N(CCN(C)C)Cc1ccc(F)c(F)c1)Sc1ccccc1 ZINC000466308711 880060595 /nfs/dbraw/zinc/06/05/95/880060595.db2.gz OQXYVZGKMLJUAQ-MRXNPFEDSA-N 0 3 407.530 4.219 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NC[C@H](C)Sc3ccccc3)c(C)c2)CC1 ZINC000466327445 880081244 /nfs/dbraw/zinc/08/12/44/880081244.db2.gz YHIMVJKXEJIOJD-IBGZPJMESA-N 0 3 412.603 4.439 20 0 HIADHN CO[C@H](CNC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1)c1cccc(Cl)c1 ZINC000466349797 880107828 /nfs/dbraw/zinc/10/78/28/880107828.db2.gz KNDQPARHIQZQSS-XMSQKQJNSA-N 0 3 415.965 4.334 20 0 HIADHN CO[C@@H](CNC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1)c1cccc(Cl)c1 ZINC000466349795 880108048 /nfs/dbraw/zinc/10/80/48/880108048.db2.gz KNDQPARHIQZQSS-GCJKJVERSA-N 0 3 415.965 4.334 20 0 HIADHN CC(C)(COc1ncc(Cl)cc1Cl)NCc1cncc(Br)c1 ZINC000466360751 880118444 /nfs/dbraw/zinc/11/84/44/880118444.db2.gz JEQZFMGEYNYLRL-UHFFFAOYSA-N 0 3 405.123 4.493 20 0 HIADHN Cc1ccccc1[C@H]1C[C@H](NC(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)C1 ZINC000466381513 880141212 /nfs/dbraw/zinc/14/12/12/880141212.db2.gz SPIBSOSCWONVER-VXDBUDOBSA-N 0 3 413.606 4.162 20 0 HIADHN COc1ccc([C@H](NC(=O)N2CCN(C)CC[C@H]2C)c2ccccc2Cl)c(C)c1 ZINC000466385239 880145040 /nfs/dbraw/zinc/14/50/40/880145040.db2.gz BWUYWFBFFVCRGI-VGSWGCGISA-N 0 3 415.965 4.482 20 0 HIADHN Brc1ccc(-c2c[nH]c(CNC3CCN(c4nccs4)CC3)n2)cc1 ZINC000466415227 880186016 /nfs/dbraw/zinc/18/60/16/880186016.db2.gz DUBSKVSXICWHTJ-UHFFFAOYSA-N 0 3 418.364 4.054 20 0 HIADHN C[C@H](NC(=O)N[C@H]1C[C@H](C)N(Cc2ccccc2)C1)c1nc(C(C)(C)C)cs1 ZINC000466505716 880280810 /nfs/dbraw/zinc/28/08/10/880280810.db2.gz QGZBHFIDFQFTQM-BQFCYCMXSA-N 0 3 400.592 4.464 20 0 HIADHN COc1ccc(OC(F)F)c(NC(=O)N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)c1 ZINC000466513198 880287886 /nfs/dbraw/zinc/28/78/86/880287886.db2.gz HNVJAZFXBFLWOL-ZBFHGGJFSA-N 0 3 405.445 4.081 20 0 HIADHN Cc1ccc(NC(=O)C(C)C)cc1NC(=O)N[C@@H]1C[C@H](C)N(Cc2ccccc2)C1 ZINC000466517927 880293600 /nfs/dbraw/zinc/29/36/00/880293600.db2.gz LCVIZTDOBJDESV-GHTZIAJQSA-N 0 3 408.546 4.374 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)N2CCC(OCCc3ccccc3)CC2)CN1Cc1ccccc1 ZINC000466517889 880293642 /nfs/dbraw/zinc/29/36/42/880293642.db2.gz WZCVEQZNPWGVQL-XUZZJYLKSA-N 0 3 421.585 4.083 20 0 HIADHN Cc1ccc(NC(=O)C(C)C)cc1NC(=O)N[C@H]1C[C@H](C)N(Cc2ccccc2)C1 ZINC000466518129 880293931 /nfs/dbraw/zinc/29/39/31/880293931.db2.gz LCVIZTDOBJDESV-RXVVDRJESA-N 0 3 408.546 4.374 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)N2CCC(OCc3ccccc3)CC2)CN1Cc1ccccc1 ZINC000466522172 880298653 /nfs/dbraw/zinc/29/86/53/880298653.db2.gz ZVWNLHYGGMEUMU-NZQKXSOJSA-N 0 3 407.558 4.040 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)Nc2ccc(NC(=O)c3ccco3)cc2)CN1Cc1ccccc1 ZINC000466538875 880313874 /nfs/dbraw/zinc/31/38/74/880313874.db2.gz JMLFOFQAERAPNK-DYESRHJHSA-N 0 3 418.497 4.316 20 0 HIADHN COCc1ccc([C@@H]2CCCN2C(=O)NCC(C)(C)N2CCc3ccccc3C2)o1 ZINC000466563263 880337193 /nfs/dbraw/zinc/33/71/93/880337193.db2.gz CTTFNUGYMSOYPV-NRFANRHFSA-N 0 3 411.546 4.109 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CCC[C@H]1c1ccc(COC)o1)c1ccsc1 ZINC000466574294 880350254 /nfs/dbraw/zinc/35/02/54/880350254.db2.gz PCSVKLMSRYHJNY-OALUTQOASA-N 0 3 405.564 4.417 20 0 HIADHN CCc1c(NC(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)cnn1-c1ccccc1 ZINC000466698639 880489746 /nfs/dbraw/zinc/48/97/46/880489746.db2.gz ZFBXJGTXKGOLKT-OAQYLSRUSA-N 0 3 403.530 4.173 20 0 HIADHN COC(=O)c1ccc(C(C)C)c(NC(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000466714278 880504944 /nfs/dbraw/zinc/50/49/44/880504944.db2.gz WFFCXJNTMZQRSI-FQEVSTJZSA-N 0 3 409.530 4.335 20 0 HIADHN CCc1c(NC(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)cnn1-c1ccccc1 ZINC000466716360 880505794 /nfs/dbraw/zinc/50/57/94/880505794.db2.gz HAYBYJWETSKRQQ-QUCCMNQESA-N 0 3 403.530 4.392 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)N1C[C@@H]2CCC[C@@]2(C(=O)OC(C)(C)C)C1 ZINC000466752728 880533702 /nfs/dbraw/zinc/53/37/02/880533702.db2.gz HBZZATKTDLDVPJ-UPCLLVRISA-N 0 3 412.530 4.078 20 0 HIADHN C[C@H]1CN(C2CC2)C[C@H]1NC(=O)N(C)CCCCCc1cc(-c2ccccc2)no1 ZINC000466776780 880556362 /nfs/dbraw/zinc/55/63/62/880556362.db2.gz MGMSNPWLZMMRFK-FDDCHVKYSA-N 0 3 410.562 4.179 20 0 HIADHN Cc1c(-c2cc(CN3CCN(Cc4ccccc4)C4(CCCCC4)C3)on2)cnn1C ZINC000466810964 880587506 /nfs/dbraw/zinc/58/75/06/880587506.db2.gz DBHWDNVDWHEZPB-UHFFFAOYSA-N 0 3 419.573 4.404 20 0 HIADHN COc1cc(CNCCN2CCc3ccccc3C2=O)ccc1OCc1cccs1 ZINC000466911873 880679641 /nfs/dbraw/zinc/67/96/41/880679641.db2.gz ZYSQWDKFYSLOMW-UHFFFAOYSA-N 0 3 422.550 4.124 20 0 HIADHN Cc1ccc([C@H]2OCCC[C@H]2CNC(=O)N2CCCN(Cc3ccccc3)CC2)cc1 ZINC000466955012 880738606 /nfs/dbraw/zinc/73/86/06/880738606.db2.gz PKHONRDYJLRUCM-LOSJGSFVSA-N 0 3 421.585 4.380 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1NC(=O)N[C@H]1C[C@@H](C)N(Cc2ccccc2)C1 ZINC000466976487 880781630 /nfs/dbraw/zinc/78/16/30/880781630.db2.gz JSJNEHJULVVSOD-UTKZUKDTSA-N 0 3 403.530 4.274 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)C(C)(C)c1ccc(OC)c(OC)c1)c1ccsc1 ZINC000466984081 880793982 /nfs/dbraw/zinc/79/39/82/880793982.db2.gz LROSOCCHXJVWSX-SFHVURJKSA-N 0 3 404.576 4.242 20 0 HIADHN C[C@H](NC(=O)N[C@H]1CCN(Cc2ccccc2)[C@@H]1C)c1nc(C(F)(F)F)cs1 ZINC000503546113 912609685 /nfs/dbraw/zinc/60/96/85/912609685.db2.gz FEFRZAUNXCKDAO-GUTXKFCHSA-N 0 3 412.481 4.185 20 0 HIADHN COCc1ccc([C@@H]2CCCN2CCC(=O)Nc2ccc(Br)cc2)o1 ZINC000467032979 880831039 /nfs/dbraw/zinc/83/10/39/880831039.db2.gz JHAKHUMIZWOPAP-KRWDZBQOSA-N 0 3 407.308 4.354 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)CCc2ncc(-c3ccccc3F)o2)CN1Cc1ccccc1 ZINC000467035729 880833729 /nfs/dbraw/zinc/83/37/29/880833729.db2.gz RUJVNALKJPHSCQ-IEBWSBKVSA-N 0 3 407.489 4.193 20 0 HIADHN C[C@H](SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)N[C@H]1CN(C2CC2)C[C@H]1C ZINC000467049222 880841549 /nfs/dbraw/zinc/84/15/49/880841549.db2.gz XEOJZZKCBUPSLN-GLJUWKHASA-N 0 3 419.978 4.216 20 0 HIADHN Cc1noc(C)c1COc1cccc(C(=O)N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)c1 ZINC000467054423 880844013 /nfs/dbraw/zinc/84/40/13/880844013.db2.gz STBGLAMFYWYWDD-JTSKRJEESA-N 0 3 419.525 4.263 20 0 HIADHN O=C([C@@H]1CCCc2n[nH]cc21)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000467104040 880864049 /nfs/dbraw/zinc/86/40/49/880864049.db2.gz XIHNYFUMFRDCPQ-MRXNPFEDSA-N 0 3 421.372 4.261 20 0 HIADHN CC[C@H]1Oc2cc([C@@H](C)NC(=O)c3oc4ccccc4c3CN(C)C)ccc2NC1=O ZINC000467125037 880879263 /nfs/dbraw/zinc/87/92/63/880879263.db2.gz GQBLONRNTLDLEV-AUUYWEPGSA-N 0 3 421.497 4.095 20 0 HIADHN Cc1ccc(S(=O)(=O)c2ccc(CN3CC[C@H]4CC[C@@H](C3)N4C(C)C)cc2)cc1 ZINC000467203963 880934395 /nfs/dbraw/zinc/93/43/95/880934395.db2.gz CBXYCHUKFPRRFB-YADHBBJMSA-N 0 3 412.599 4.275 20 0 HIADHN C[C@H](NC(=O)NCc1nc(-c2ccccc2F)cs1)[C@@H](c1ccccc1)N(C)C ZINC000503558620 912630716 /nfs/dbraw/zinc/63/07/16/912630716.db2.gz VLKZQPOASRASEN-BTYIYWSLSA-N 0 3 412.534 4.440 20 0 HIADHN CC(C)C[C@@H](N[C@H](C)Cc1cccc(C(F)(F)F)c1)c1nc(-c2nc[nH]n2)no1 ZINC000467334752 881083753 /nfs/dbraw/zinc/08/37/53/881083753.db2.gz OQQSSKXJLNIURY-IUODEOHRSA-N 0 3 408.428 4.182 20 0 HIADHN COc1cc2c(cc1F)CC[C@@H]2N[C@@H](C)c1cc(F)ccc1N1CCN(C)CC1 ZINC000467341312 881092611 /nfs/dbraw/zinc/09/26/11/881092611.db2.gz DLCNQOCWRSGXAZ-BTYIYWSLSA-N 0 3 401.501 4.063 20 0 HIADHN CC(=O)Nc1ccc([C@H](C)NCc2ccc(I)c(C)c2)cc1 ZINC000467379803 881158078 /nfs/dbraw/zinc/15/80/78/881158078.db2.gz BTSRKUZNLPDJOE-ZDUSSCGKSA-N 0 3 408.283 4.409 20 0 HIADHN Cc1cc(C(F)(F)F)ccc1CN[C@H](C)c1cccc(N2CCCS2(=O)=O)c1 ZINC000467408312 881195059 /nfs/dbraw/zinc/19/50/59/881195059.db2.gz ZNBNJLYDRRVUMF-OAHLLOKOSA-N 0 3 412.477 4.405 20 0 HIADHN COc1ccc2c(c1)[C@@H](N[C@@H](C)c1ccc(OCC(=O)NC3CC3)cc1)CCS2 ZINC000467425324 881215315 /nfs/dbraw/zinc/21/53/15/881215315.db2.gz YTPQCGXHZNGOAY-BTYIYWSLSA-N 0 3 412.555 4.240 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1cccc2c1CCC2 ZINC000467463867 881274226 /nfs/dbraw/zinc/27/42/26/881274226.db2.gz JGGBFCZKDOJBJJ-NRFANRHFSA-N 0 3 400.526 4.380 20 0 HIADHN CC(C)n1cnnc1-c1ccccc1NC(=O)N[C@H]1C[C@H](C)N(Cc2ccccc2)C1 ZINC000467466959 881280459 /nfs/dbraw/zinc/28/04/59/881280459.db2.gz TYMHGLICOVEGHB-ICSRJNTNSA-N 0 3 418.545 4.311 20 0 HIADHN CC(C)n1cnnc1-c1ccccc1NC(=O)N[C@H]1C[C@@H](C)N(Cc2ccccc2)C1 ZINC000467466960 881280966 /nfs/dbraw/zinc/28/09/66/881280966.db2.gz TYMHGLICOVEGHB-QUCCMNQESA-N 0 3 418.545 4.311 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)Nc2ccc(OCC3CCOCC3)cc2)CN1Cc1ccccc1 ZINC000467476125 881293935 /nfs/dbraw/zinc/29/39/35/881293935.db2.gz NKPQOBCPBQARLC-WMZHIEFXSA-N 0 3 423.557 4.277 20 0 HIADHN C[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000467494798 881312865 /nfs/dbraw/zinc/31/28/65/881312865.db2.gz QXWNMDSNXLMTBC-LJQANCHMSA-N 0 3 424.585 4.025 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)CCc1cccc(OC(C)(C)C)n1 ZINC000467518078 881333323 /nfs/dbraw/zinc/33/33/23/881333323.db2.gz ZYSFVNCYZASHQO-FQEVSTJZSA-N 0 3 409.574 4.315 20 0 HIADHN COC(=O)[C@@](C)(CN[C@@H](C)C(=O)Nc1ccc(Cl)cc1Cl)c1ccccc1 ZINC000469066315 883143935 /nfs/dbraw/zinc/14/39/35/883143935.db2.gz SUBDVDJGPGIJFP-RBZFPXEDSA-N 0 3 409.313 4.041 20 0 HIADHN COC1CCN(C(C)(C)CNC(=O)C2(c3c(Cl)cccc3Cl)CCC2)CC1 ZINC000469171531 883270955 /nfs/dbraw/zinc/27/09/55/883270955.db2.gz UMDFYWBTAXTXBX-UHFFFAOYSA-N 0 3 413.389 4.421 20 0 HIADHN CO[C@H](CCN[C@@H](c1ccc(C)cc1)c1cccc(S(C)(=O)=O)c1)C(F)(F)F ZINC000469314139 883415323 /nfs/dbraw/zinc/41/53/23/883415323.db2.gz FDDICKBXUQYYCO-MOPGFXCFSA-N 0 3 415.477 4.045 20 0 HIADHN CCSCc1ccccc1C(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000469320080 883425889 /nfs/dbraw/zinc/42/58/89/883425889.db2.gz ZUKSIKHATJUQRC-KDURUIRLSA-N 0 3 404.620 4.291 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)NCc1coc(-c2cccs2)n1 ZINC000469437335 883627102 /nfs/dbraw/zinc/62/71/02/883627102.db2.gz XFSUQWPTBKAFHE-LJQANCHMSA-N 0 3 412.559 4.359 20 0 HIADHN CCNC(=O)c1ccc(NC(=O)N[C@@H](CN(C)Cc2ccccc2)C(C)C)c(C)c1 ZINC000469472958 883702141 /nfs/dbraw/zinc/70/21/41/883702141.db2.gz SLUUSGSBXSFCMW-QFIPXVFZSA-N 0 3 410.562 4.023 20 0 HIADHN CN(C)[C@H](CNc1ncccc1C(=O)N1CCCCC1)c1cccc(C(F)(F)F)c1 ZINC000469548066 883809472 /nfs/dbraw/zinc/80/94/72/883809472.db2.gz WFNPLMPTPSWECN-LJQANCHMSA-N 0 3 420.479 4.441 20 0 HIADHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(-n2ncc3ccccc32)cc1Cl ZINC000469554490 883811897 /nfs/dbraw/zinc/81/18/97/883811897.db2.gz PHCLINACIDQMMD-MJGOQNOKSA-N 0 3 408.933 4.378 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)c2cccc(Br)c2F)CC1 ZINC000469554824 883811908 /nfs/dbraw/zinc/81/19/08/883811908.db2.gz SZEGZKPWIUNTDN-UHFFFAOYSA-N 0 3 405.311 4.325 20 0 HIADHN CCN(C(=O)c1nn(-c2c(F)cccc2F)cc1C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000469564756 883816681 /nfs/dbraw/zinc/81/66/81/883816681.db2.gz DIUAGMKHTDKSSI-LJQANCHMSA-N 0 3 424.495 4.196 20 0 HIADHN CCO[C@H](C)c1nc(CN(C)C(=O)c2oc3ccccc3c2CN(C)C)cs1 ZINC000469569621 883818266 /nfs/dbraw/zinc/81/82/66/883818266.db2.gz XXCBRTQCNDROMA-CQSZACIVSA-N 0 3 401.532 4.321 20 0 HIADHN Cc1cccc(NC(=O)N2CCC(CN3C[C@H](C)O[C@@H](C)C3)CC2)c1Br ZINC000469598185 883829597 /nfs/dbraw/zinc/82/95/97/883829597.db2.gz DOPSXJIHPXAUJH-HOTGVXAUSA-N 0 3 424.383 4.111 20 0 HIADHN CCN1c2ccc(NC(=O)N[C@H](CN(C)Cc3ccccc3)C(C)C)cc2CCC1=O ZINC000469652340 883849674 /nfs/dbraw/zinc/84/96/74/883849674.db2.gz GSPZCPRWXCFVQX-JOCHJYFZSA-N 0 3 422.573 4.264 20 0 HIADHN O=C(NCCN1CCCCCC1)C(=O)Nc1ccc(F)cc1-c1ccc(Cl)cc1 ZINC000503658446 912762695 /nfs/dbraw/zinc/76/26/95/912762695.db2.gz KNIUPKPSXFBQPE-UHFFFAOYSA-N 0 3 417.912 4.077 20 0 HIADHN COc1ccc2c(c1)[C@H](N(Cc1ccccc1)C(=O)CN1[C@@H](C)CC[C@@H]1C)CCO2 ZINC000469699524 883878034 /nfs/dbraw/zinc/87/80/34/883878034.db2.gz IETYLDRKRPZQJY-SFYKDHMMSA-N 0 3 408.542 4.420 20 0 HIADHN COc1ccc([C@@H](NCCOCC(F)F)c2ccccc2)cc1Br ZINC000469713401 883883161 /nfs/dbraw/zinc/88/31/61/883883161.db2.gz OGVHDKVBLIQAAV-SFHVURJKSA-N 0 3 400.263 4.418 20 0 HIADHN FC(F)C(F)(F)COCCN1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1 ZINC000469715859 883883752 /nfs/dbraw/zinc/88/37/52/883883752.db2.gz BQMRZEVMYCJOJV-CYBMUJFWSA-N 0 3 421.822 4.486 20 0 HIADHN Cc1ccc(NC(=O)NC[C@H]2CCCN(CCOCC(F)(F)C(F)(F)F)C2)cc1 ZINC000469722148 883886121 /nfs/dbraw/zinc/88/61/21/883886121.db2.gz WCYFFAFFTDYTIC-OAHLLOKOSA-N 0 3 423.426 4.043 20 0 HIADHN CN1CCCN(C(=O)N[C@@H](c2cccc(F)c2)c2cccc(Br)c2)CC1 ZINC000469831344 884010972 /nfs/dbraw/zinc/01/09/72/884010972.db2.gz QMBGZXPHAVNICN-LJQANCHMSA-N 0 3 420.326 4.025 20 0 HIADHN O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)C(c1ccccc1)c1ccccc1 ZINC000469842845 884024565 /nfs/dbraw/zinc/02/45/65/884024565.db2.gz JLNBGGADJQENSZ-RUZDIDTESA-N 0 3 414.549 4.226 20 0 HIADHN O=C(NC[C@H]1CN(Cc2ccccc2)CCCO1)c1ccc(-c2ccccc2F)o1 ZINC000469843756 884026051 /nfs/dbraw/zinc/02/60/51/884026051.db2.gz TVVRPSSLINIBDG-IBGZPJMESA-N 0 3 408.473 4.107 20 0 HIADHN O=C(CCc1cccc(C(F)(F)F)c1)NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000469845673 884027797 /nfs/dbraw/zinc/02/77/97/884027797.db2.gz XZSQEGZTTNTDEG-OAQYLSRUSA-N 0 3 420.475 4.045 20 0 HIADHN O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)[C@H]1C[C@H]1c1ccc2ccccc2c1 ZINC000469862475 884049921 /nfs/dbraw/zinc/04/99/21/884049921.db2.gz MTAORYBFNGSDCH-ZNZIZOMTSA-N 0 3 414.549 4.351 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N[C@@H](c2nc3ccccc3[nH]2)C(C)C)N(C)C)cc1 ZINC000503682236 912789177 /nfs/dbraw/zinc/78/91/77/912789177.db2.gz RIGMCUXZMXBDEW-FCHUYYIVSA-N 0 3 407.562 4.425 20 0 HIADHN CN(Cc1ccccc1)Cc1cccc(C(=O)N(C)Cc2cn3c(n2)CCCC3)c1 ZINC000469995080 884210585 /nfs/dbraw/zinc/21/05/85/884210585.db2.gz VVDBOVVNJPSCIQ-UHFFFAOYSA-N 0 3 402.542 4.124 20 0 HIADHN C[C@H](NC(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1)c1ccccc1-n1cccn1 ZINC000470034347 884268143 /nfs/dbraw/zinc/26/81/43/884268143.db2.gz PBGYOZFDAHCZLI-ZJOUEHCJSA-N 0 3 403.530 4.068 20 0 HIADHN CC[C@H](CNC(=O)N1C[C@@H](c2ccsc2)O[C@@H](C)C1)N1CCc2ccccc2C1 ZINC000470038127 884276892 /nfs/dbraw/zinc/27/68/92/884276892.db2.gz ILGHEMDKUHUHLA-WTOYTKOKSA-N 0 3 413.587 4.056 20 0 HIADHN CC[C@H](CNC(=O)N1C[C@H](C)O[C@@H](c2ccsc2)C1)N1CCc2ccccc2C1 ZINC000470038126 884277769 /nfs/dbraw/zinc/27/77/69/884277769.db2.gz ILGHEMDKUHUHLA-MTNREXPMSA-N 0 3 413.587 4.056 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1C[C@@H](C)O[C@H](c2ccsc2)C1)c1ccsc1 ZINC000470042789 884283727 /nfs/dbraw/zinc/28/37/27/884283727.db2.gz OBJBKGUFZORXTK-LZQZEXGQSA-N 0 3 407.605 4.364 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@H]2NC(=O)N(CCN(C)C)Cc2cccc(F)c2)cc1 ZINC000470048711 884293095 /nfs/dbraw/zinc/29/30/95/884293095.db2.gz CZPKUDZXHBGBGM-PKTZIBPZSA-N 0 3 413.537 4.128 20 0 HIADHN Cc1cccc2[nH]cc(CCNC(=O)N(CCCc3ccccc3)CCN(C)C)c21 ZINC000503772154 912820253 /nfs/dbraw/zinc/82/02/53/912820253.db2.gz SNWWWSQOMBBJPJ-UHFFFAOYSA-N 0 3 406.574 4.225 20 0 HIADHN C[C@H](CO)N1CCCN(Cc2nc(-c3cc(Cl)ccc3Cl)cs2)CC1 ZINC000470137390 884401959 /nfs/dbraw/zinc/40/19/59/884401959.db2.gz KAQJJFZTWDQQOQ-CYBMUJFWSA-N 0 3 400.375 4.005 20 0 HIADHN CC(C)N(Cc1nnc(-c2ccccc2Cl)o1)C(=O)[C@@H](C)N1CCCCCC1 ZINC000503784269 912823130 /nfs/dbraw/zinc/82/31/30/912823130.db2.gz YXHBUZGLDORXDB-MRXNPFEDSA-N 0 3 404.942 4.392 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)c1ccc(-c2ccccc2)[nH]c1=O ZINC000470162784 884437279 /nfs/dbraw/zinc/43/72/79/884437279.db2.gz LCIGBZBBMULSLG-HSZRJFAPSA-N 0 3 403.526 4.341 20 0 HIADHN C[C@@H](NC(=O)NC[C@H](c1ccccc1)N1CCCC1)c1ccccc1-n1cccn1 ZINC000470183655 884473355 /nfs/dbraw/zinc/47/33/55/884473355.db2.gz RWLPQLKXVXTECO-AUSIDOKSSA-N 0 3 403.530 4.070 20 0 HIADHN CC(C)c1nn(-c2ccccc2)cc1CN[C@@H](C)Cn1cc(Br)cn1 ZINC000470250260 884584449 /nfs/dbraw/zinc/58/44/49/884584449.db2.gz IXQPGXCTJDBANK-HNNXBMFYSA-N 0 3 402.340 4.133 20 0 HIADHN CC(C)c1nn(-c2ccccc2)cc1CN[C@H](C)Cn1cc(Br)cn1 ZINC000470250261 884585405 /nfs/dbraw/zinc/58/54/05/884585405.db2.gz IXQPGXCTJDBANK-OAHLLOKOSA-N 0 3 402.340 4.133 20 0 HIADHN O=C(CN[C@@H](c1cccc(C(F)(F)F)c1)C1CC1)N[C@H]1CCOc2ccccc21 ZINC000503886520 912850760 /nfs/dbraw/zinc/85/07/60/912850760.db2.gz NSZFXKZKTXKATQ-GHTZIAJQSA-N 0 3 404.432 4.386 20 0 HIADHN COc1cc(F)c(C(=O)NC[C@@H](c2ccccc2)N2CCC(C)CC2)cc1OC ZINC000470342788 884732486 /nfs/dbraw/zinc/73/24/86/884732486.db2.gz DHQLWFGESJQPDJ-FQEVSTJZSA-N 0 3 400.494 4.046 20 0 HIADHN Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)N1CCCN([C@@H](C)CO)CC1 ZINC000470349023 884739615 /nfs/dbraw/zinc/73/96/15/884739615.db2.gz CWKDGRZHGDSRQT-PMACEKPBSA-N 0 3 411.546 4.055 20 0 HIADHN Cc1c([C@@H](C)N[C@H]2CCCC23CCOCC3)nnn1-c1cccc(Br)c1 ZINC000503911533 912861452 /nfs/dbraw/zinc/86/14/52/912861452.db2.gz PHEQZXNJIFQNCZ-KDOFPFPSSA-N 0 3 419.367 4.338 20 0 HIADHN O=C(CN[C@H](Cc1ccc(F)cc1)c1ccccc1)N[C@@H]1CCOc2ccccc21 ZINC000503920165 912865315 /nfs/dbraw/zinc/86/53/15/912865315.db2.gz KXEQGGJIIJXFLN-DHIUTWEWSA-N 0 3 404.485 4.339 20 0 HIADHN C[C@@H](CO)N1CCCN(C(=O)Nc2ccc([C@H](C)Sc3ccccc3)cc2)CC1 ZINC000470408998 884813030 /nfs/dbraw/zinc/81/30/30/884813030.db2.gz PEJRDNMSZYNVMX-OALUTQOASA-N 0 3 413.587 4.460 20 0 HIADHN COC[C@H](C)Oc1ccc(Cl)cc1NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000470519380 884910122 /nfs/dbraw/zinc/91/01/22/884910122.db2.gz LTFXLJAMEAZYHG-QFBILLFUSA-N 0 3 417.937 4.150 20 0 HIADHN C[C@@H](NC(=O)c1oc2ccccc2c1CN(C)C)c1nc(-c2cccc(F)c2)no1 ZINC000470546260 884955937 /nfs/dbraw/zinc/95/59/37/884955937.db2.gz KAULZHOMMBYEOK-CYBMUJFWSA-N 0 3 408.433 4.175 20 0 HIADHN CCN(CCO)CCNC(=O)c1oc2ccccc2c1CSC1CCCCC1 ZINC000470586807 885002172 /nfs/dbraw/zinc/00/21/72/885002172.db2.gz BGXVKOMJXYJKEY-UHFFFAOYSA-N 0 3 404.576 4.043 20 0 HIADHN C[C@H](CO)N1CCCN(C(=O)Nc2ccccc2Oc2ccccc2Cl)CC1 ZINC000470604498 885033010 /nfs/dbraw/zinc/03/30/10/885033010.db2.gz DAAUXSCUAFPQML-MRXNPFEDSA-N 0 3 403.910 4.053 20 0 HIADHN CN(C(=O)c1cnn(-c2cccc(Cl)c2)c1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470661390 885086641 /nfs/dbraw/zinc/08/66/41/885086641.db2.gz XISAFBHGEBTWLA-QFIPXVFZSA-N 0 3 408.933 4.262 20 0 HIADHN Cc1oc(-c2ccsc2)nc1CC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470662670 885088781 /nfs/dbraw/zinc/08/87/81/885088781.db2.gz SDXRESYTQOLTKD-HXUWFJFHSA-N 0 3 409.555 4.377 20 0 HIADHN CN(C(=O)CCCc1nnc(-c2ccccc2)o1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470671953 885101414 /nfs/dbraw/zinc/10/14/14/885101414.db2.gz UDZGPUBDABTJAO-QFIPXVFZSA-N 0 3 418.541 4.182 20 0 HIADHN CC(=O)c1cccc(OCCCC(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000470673773 885102583 /nfs/dbraw/zinc/10/25/83/885102583.db2.gz QRCQZLYKUYYKFA-HSZRJFAPSA-N 0 3 408.542 4.171 20 0 HIADHN COc1ccc([C@@H](NC(=O)NC[C@H](c2cccc(OC)c2)N2CCCC2)C2CC2)cc1 ZINC000503992962 912903271 /nfs/dbraw/zinc/90/32/71/912903271.db2.gz MQULMQXZQGZVRS-RPWUZVMVSA-N 0 3 423.557 4.291 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N(C)Cc2nc(C(F)(F)F)cs2)C1 ZINC000470722475 885169241 /nfs/dbraw/zinc/16/92/41/885169241.db2.gz JUCRVHHSQAILSD-HIFRSBDPSA-N 0 3 412.481 4.139 20 0 HIADHN C[C@@H]1CN(C(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)C[C@H](c2ccsc2)O1 ZINC000470735991 885191791 /nfs/dbraw/zinc/19/17/91/885191791.db2.gz IAQSHWZCSAEWHR-HGHGUNKESA-N 0 3 402.535 4.088 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N(C)Cc1nc(C(F)(F)F)cs1)c1ccsc1 ZINC000470739592 885200779 /nfs/dbraw/zinc/20/07/79/885200779.db2.gz CHUYOARGEBPMNW-ZDUSSCGKSA-N 0 3 420.526 4.448 20 0 HIADHN CN(Cc1nc(C(F)(F)F)cs1)C(=O)N[C@H](CN1CCCC1)c1ccccc1 ZINC000470756051 885222019 /nfs/dbraw/zinc/22/20/19/885222019.db2.gz PFGXCCDLRZMAEZ-OAHLLOKOSA-N 0 3 412.481 4.140 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CCC(n2cc(Cl)cn2)CC1)c1ccsc1 ZINC000504010489 912916726 /nfs/dbraw/zinc/91/67/26/912916726.db2.gz NUOHXZHKUVRCKM-SFHVURJKSA-N 0 3 409.987 4.028 20 0 HIADHN Cc1nc2cc(F)cc(C(=O)N(C)[C@H]3CCCN(Cc4ccccc4)C3)c2nc1C ZINC000470816321 885305506 /nfs/dbraw/zinc/30/55/06/885305506.db2.gz HILSUFRGIOWYDU-FQEVSTJZSA-N 0 3 406.505 4.122 20 0 HIADHN O=C(Cc1cn(-c2ccccc2)nc1-c1ccc(Cl)cc1)N1CCN2CCC1CC2 ZINC000470843996 885338343 /nfs/dbraw/zinc/33/83/43/885338343.db2.gz FZDSEYDKDKFZLB-UHFFFAOYSA-N 0 3 420.944 4.042 20 0 HIADHN COc1cccc(C2(NC[C@@H](O)Cc3ccc4ccccc4c3)CCOCC2)c1F ZINC000470873771 885362086 /nfs/dbraw/zinc/36/20/86/885362086.db2.gz LYBIGLOVWNNRID-NRFANRHFSA-N 0 3 409.501 4.186 20 0 HIADHN Cc1nc2cc(C(=O)N(CCN(C)C)Cc3ccc(C(F)(F)F)cc3)ccc2o1 ZINC000470932680 885436428 /nfs/dbraw/zinc/43/64/28/885436428.db2.gz PASXVWHDBNVNRW-UHFFFAOYSA-N 0 3 405.420 4.359 20 0 HIADHN CCc1ccc(Cl)c(CC)c1NC(=O)CCCN1CCO[C@]2(CCO[C@@H]2C)C1 ZINC000470934227 885438637 /nfs/dbraw/zinc/43/86/37/885438637.db2.gz AFSDTUJHKYSETG-OPAMFIHVSA-N 0 3 408.970 4.063 20 0 HIADHN O=C(CSCC(=O)N1CC[C@]2(C1)CCCN(Cc1ccccc1)C2)c1ccccc1 ZINC000470964358 885463566 /nfs/dbraw/zinc/46/35/66/885463566.db2.gz XGGIJNLQQVAMHF-RUZDIDTESA-N 0 3 422.594 4.117 20 0 HIADHN CC(C)(C)OC(=O)CCC(C)(C)NC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000471097494 885628494 /nfs/dbraw/zinc/62/84/94/885628494.db2.gz DZNRYQRZHDUTNC-SFHVURJKSA-N 0 3 406.542 4.054 20 0 HIADHN Cc1ccc(NC(=O)[C@H]2CCCN(Cc3ccccc3Oc3cccnc3)C2)nc1 ZINC000471147993 885695518 /nfs/dbraw/zinc/69/55/18/885695518.db2.gz JLOWZUORERPLEJ-FQEVSTJZSA-N 0 3 402.498 4.428 20 0 HIADHN CN(CCCCOc1ccccc1C(F)(F)F)[C@@H]1CCCC[C@@H]1S(C)(=O)=O ZINC000471241248 885818517 /nfs/dbraw/zinc/81/85/17/885818517.db2.gz DTBALQVFPNAQOG-AEFFLSMTSA-N 0 3 407.498 4.152 20 0 HIADHN C[C@@H]1[C@@H](C(F)(F)F)CCN1C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000471246769 885822906 /nfs/dbraw/zinc/82/29/06/885822906.db2.gz WPMBTZBRVYSQGV-PBHICJAKSA-N 0 3 401.498 4.083 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)c1cc(C)sc1Br ZINC000471262448 885841155 /nfs/dbraw/zinc/84/11/55/885841155.db2.gz MLONASGJGREDIQ-MRXNPFEDSA-N 0 3 422.392 4.341 20 0 HIADHN Cc1c(NC(=O)N(C)C)cccc1NC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC000471358977 885982802 /nfs/dbraw/zinc/98/28/02/885982802.db2.gz XXVVVTFCWUWRLB-GOSISDBHSA-N 0 3 423.561 4.217 20 0 HIADHN O=C(CCN1CCc2ccccc2C1)Nc1cc(Cl)ccc1OC[C@@H]1CCCO1 ZINC000471384115 886032661 /nfs/dbraw/zinc/03/26/61/886032661.db2.gz GYPCDLUEKGPFMG-FQEVSTJZSA-N 0 3 414.933 4.285 20 0 HIADHN COc1ccc(N(Cc2ccco2)C(=O)CCN2CCc3ccccc3C2)cc1F ZINC000471386378 886033872 /nfs/dbraw/zinc/03/38/72/886033872.db2.gz ZCHGGBOFZSQMOW-UHFFFAOYSA-N 0 3 408.473 4.409 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N[C@H]1CCSc2ccccc21 ZINC000471495772 886196556 /nfs/dbraw/zinc/19/65/56/886196556.db2.gz LCOKXMPPWRPENR-DQPZFDDXSA-N 0 3 413.509 4.328 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)NCC1CCN(c2ccccc2)CC1 ZINC000471507415 886209054 /nfs/dbraw/zinc/20/90/54/886209054.db2.gz MSRJCVRQUYXQSU-OAQYLSRUSA-N 0 3 412.603 4.101 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N(C)CC1CCOCC1)c1ccc(C(F)(F)F)cc1 ZINC000504108657 913018207 /nfs/dbraw/zinc/01/82/07/913018207.db2.gz GXQLVPPUMHZSLU-LJQANCHMSA-N 0 3 415.500 4.156 20 0 HIADHN COc1ccc(C)cc1[C@@H](C)NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000471526114 886229525 /nfs/dbraw/zinc/22/95/25/886229525.db2.gz CFYMJBHVCHOFDT-ODIFPOPNSA-N 0 3 413.484 4.169 20 0 HIADHN CC(=O)Nc1cc(C(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)cc(C(F)(F)F)c1 ZINC000471528750 886232442 /nfs/dbraw/zinc/23/24/42/886232442.db2.gz GILQRNALZDWGNU-ORAYPTAESA-N 0 3 407.436 4.085 20 0 HIADHN C[C@H](NC(=O)CCc1nc(-c2ccc(Cl)cc2)no1)[C@@H](c1ccccc1)N(C)C ZINC000471535160 886239207 /nfs/dbraw/zinc/23/92/07/886239207.db2.gz DUQXNXORIFWUTK-BTYIYWSLSA-N 0 3 412.921 4.130 20 0 HIADHN C[C@H](NC(=O)CCc1nnc(-c2ccc(Cl)cc2)o1)[C@H](c1ccccc1)N(C)C ZINC000471541245 886247178 /nfs/dbraw/zinc/24/71/78/886247178.db2.gz KVRMTNRCIDKKGH-YCRPNKLZSA-N 0 3 412.921 4.130 20 0 HIADHN Cc1nc(COc2cccc(C(=O)N[C@@H](C)[C@H](c3ccccc3)N(C)C)c2)cs1 ZINC000471556058 886264868 /nfs/dbraw/zinc/26/48/68/886264868.db2.gz PCOPSMQLEVQCBT-KSFYIVLOSA-N 0 3 409.555 4.452 20 0 HIADHN COc1ccccc1[C@H](CN[C@H](C)c1ccc(S(C)(=O)=O)c(F)c1)OC(C)C ZINC000471582676 886295247 /nfs/dbraw/zinc/29/52/47/886295247.db2.gz PWBXRTSZMBZREU-QRWLVFNGSA-N 0 3 409.523 4.055 20 0 HIADHN COc1ccc([C@H](C)NC[C@H](OC(C)C)c2ccccc2OC)cc1NC(C)=O ZINC000471608878 886324963 /nfs/dbraw/zinc/32/49/63/886324963.db2.gz GOKWTNMFFPRHOF-HJPURHCSSA-N 0 3 400.519 4.479 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)[C@H](OC3CCCC3)c3ccccc3)c2)CC1 ZINC000471644119 886361531 /nfs/dbraw/zinc/36/15/31/886361531.db2.gz AFFHQXIGJSOMMD-XMMPIXPASA-N 0 3 407.558 4.468 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CCC[C@@](C)(O)CC1)c1ccc(C(F)(F)F)cc1 ZINC000471721585 886433126 /nfs/dbraw/zinc/43/31/26/886433126.db2.gz WBKWOFINEYRPRT-AZUAARDMSA-N 0 3 415.500 4.035 20 0 HIADHN COCCC[C@H](Cc1ccccc1)NC(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000471727777 886443363 /nfs/dbraw/zinc/44/33/63/886443363.db2.gz PSZGPMQTLAASJS-ZTCOLXNVSA-N 0 3 409.574 4.159 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)c1ncoc1-c1ccc(F)cc1 ZINC000471768852 886500445 /nfs/dbraw/zinc/50/04/45/886500445.db2.gz LNDRPPHWCYQHGK-UHFFFAOYSA-N 0 3 411.502 4.324 20 0 HIADHN C[C@H](SCC(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1)c1nc2ccccc2[nH]1 ZINC000471800483 886537453 /nfs/dbraw/zinc/53/74/53/886537453.db2.gz RPCREMGFRFLFED-JENIJYKNSA-N 0 3 408.571 4.309 20 0 HIADHN O=C(NCCc1cc2ccccc2o1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000471883635 886664290 /nfs/dbraw/zinc/66/42/90/886664290.db2.gz FMKHJKDFDXUQEF-UHFFFAOYSA-N 0 3 409.452 4.080 20 0 HIADHN Cc1cn([C@H](C)c2ccccc2)nc1NC(=O)NC[C@H](Cc1ccccc1)N(C)C ZINC000471915582 886703427 /nfs/dbraw/zinc/70/34/27/886703427.db2.gz RMWQVHFRFBCJDL-KNQAVFIVSA-N 0 3 405.546 4.095 20 0 HIADHN COc1cc(F)c(NC(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)cc1OC ZINC000504190077 913072663 /nfs/dbraw/zinc/07/26/63/913072663.db2.gz QGIGQYRNQFODRM-QGZVFWFLSA-N 0 3 421.538 4.499 20 0 HIADHN COc1cc(F)c(NC(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)cc1OC ZINC000504190075 913073606 /nfs/dbraw/zinc/07/36/06/913073606.db2.gz QGIGQYRNQFODRM-KRWDZBQOSA-N 0 3 421.538 4.499 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2ccc(OC(F)F)c3cccnc23)[C@H]1c1ccccc1 ZINC000471952299 886760657 /nfs/dbraw/zinc/76/06/57/886760657.db2.gz MRPOJGSDNWBBKE-FXAWDEMLSA-N 0 3 412.440 4.403 20 0 HIADHN C[C@H](Oc1ccc2ccccc2c1)C(=O)N(C)C1CCN(CCc2ccccn2)CC1 ZINC000471964927 886794632 /nfs/dbraw/zinc/79/46/32/886794632.db2.gz KLWKRQKAXLYFST-FQEVSTJZSA-N 0 3 417.553 4.168 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2cc(F)cc(F)c2Br)[C@H]1c1ccccc1 ZINC000471967931 886798027 /nfs/dbraw/zinc/79/80/27/886798027.db2.gz SZLZIGZTGKYGNR-WMLDXEAASA-N 0 3 410.262 4.294 20 0 HIADHN Cc1nc(-c2ccccc2)oc1C(=O)Nc1cccc(N2CCN(C(C)C)CC2)c1 ZINC000504200151 913082326 /nfs/dbraw/zinc/08/23/26/913082326.db2.gz XVEVCXJDIQQKAQ-UHFFFAOYSA-N 0 3 404.514 4.433 20 0 HIADHN Cc1ccc(NC(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)c(-c2nc(C3CC3)no2)c1 ZINC000471990469 886816741 /nfs/dbraw/zinc/81/67/41/886816741.db2.gz FIBQKWUGBXGUNE-NHCUHLMSSA-N 0 3 417.513 4.489 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2-c2nc(C3CC3)no2)[C@@H]1c1ccccc1 ZINC000471992157 886818482 /nfs/dbraw/zinc/81/84/82/886818482.db2.gz MVEAFLTZIPSTQM-UXHICEINSA-N 0 3 421.476 4.320 20 0 HIADHN Cc1cc(NC(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)ccc1OC1CCOCC1 ZINC000471994636 886819608 /nfs/dbraw/zinc/81/96/08/886819608.db2.gz CLUNKUOGZKMLDN-GGAORHGYSA-N 0 3 409.530 4.120 20 0 HIADHN CSc1cnn(-c2ccccc2)c1NC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000471996279 886821716 /nfs/dbraw/zinc/82/17/16/886821716.db2.gz VXTOCPHPJZMXSK-UYAOXDASSA-N 0 3 407.543 4.161 20 0 HIADHN CCN(C(=O)c1ccc2nc(C(F)(F)F)cn2c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000472024977 886847081 /nfs/dbraw/zinc/84/70/81/886847081.db2.gz KVVLSHXOBXLZEJ-GOSISDBHSA-N 0 3 416.447 4.090 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)c3cc(F)ccc3-c3ccoc3)CC2)C[C@H](C)O1 ZINC000472027664 886849743 /nfs/dbraw/zinc/84/97/43/886849743.db2.gz AKXYKDGZGQSUCK-IRXDYDNUSA-N 0 3 400.494 4.047 20 0 HIADHN CCS[C@H]1CCCC[C@H]1NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472045454 886860966 /nfs/dbraw/zinc/86/09/66/886860966.db2.gz SVPDYGBBMHZBCT-BACDZXNISA-N 0 3 407.546 4.155 20 0 HIADHN CCN(CC)[C@H](CNC(=O)[C@@H]1C[C@@H]1c1cc(OC)ccc1OC)c1ccsc1 ZINC000472120183 886906731 /nfs/dbraw/zinc/90/67/31/886906731.db2.gz NKZCVQDSYGBACO-MISYRCLQSA-N 0 3 402.560 4.068 20 0 HIADHN COc1ccc(F)c(C(=O)NC[C@H](c2ccccc2)N2CCC(C)CC2)c1OC ZINC000472137970 886931968 /nfs/dbraw/zinc/93/19/68/886931968.db2.gz HQCXLTUTXMSNQZ-LJQANCHMSA-N 0 3 400.494 4.046 20 0 HIADHN COc1ccsc1[C@@H](C)NCCC(=O)N(C)Cc1ccccc1Br ZINC000472147489 886944690 /nfs/dbraw/zinc/94/46/90/886944690.db2.gz MGXRSGDLFAHDQC-CYBMUJFWSA-N 0 3 411.365 4.219 20 0 HIADHN CC(C)[C@H](CC(F)(F)F)NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472174038 886972925 /nfs/dbraw/zinc/97/29/25/886972925.db2.gz JCQAVJIWKVNVFI-RUXDESIVSA-N 0 3 403.411 4.068 20 0 HIADHN O=C(NCc1ccc(C(F)F)cc1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472196463 886998734 /nfs/dbraw/zinc/99/87/34/886998734.db2.gz RUBGHSSOPZAKOQ-UHFFFAOYSA-N 0 3 405.411 4.229 20 0 HIADHN COc1ccc(OC)c([C@@H]2C[C@H]2C(=O)N[C@@H](CN(C)Cc2ccccc2)C(C)C)c1 ZINC000472253492 887063118 /nfs/dbraw/zinc/06/31/18/887063118.db2.gz DEJROKXTZAIAKG-WWNPGLIZSA-N 0 3 410.558 4.080 20 0 HIADHN O=C(CCN1CCCC[C@@H]1CNC(=O)c1ccccc1)Nc1ccc(Cl)cc1F ZINC000472277920 887093896 /nfs/dbraw/zinc/09/38/96/887093896.db2.gz OKXMHVFYKIMILN-GOSISDBHSA-N 0 3 417.912 4.092 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2cccc(OCc3cscn3)c2)[C@H]1c1ccccc1 ZINC000472304256 887128145 /nfs/dbraw/zinc/12/81/45/887128145.db2.gz HCXXQAOGVQFRDL-NHCUHLMSSA-N 0 3 408.527 4.289 20 0 HIADHN Cc1cc(C(=O)Nc2ccc(C(=O)N(C)[C@@H]3CCCN(C)C3)cc2)c(C(F)(F)F)o1 ZINC000472307076 887134044 /nfs/dbraw/zinc/13/40/44/887134044.db2.gz VKAZBWYPWHOCAX-MRXNPFEDSA-N 0 3 423.435 4.025 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2OCC(F)(F)F)[C@@H]1c1ccccc1 ZINC000472342085 887176218 /nfs/dbraw/zinc/17/62/18/887176218.db2.gz YBBUSHKUGANBHG-AEFFLSMTSA-N 0 3 411.399 4.334 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2cccc(C[S@](=O)C(C)(C)C)c2)[C@H]1c1ccccc1 ZINC000472345409 887180680 /nfs/dbraw/zinc/18/06/80/887180680.db2.gz XDYWQJXCXODNAD-FONBTEPMSA-N 0 3 413.587 4.301 20 0 HIADHN Cc1cc(F)ccc1CN(C)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472444092 887295809 /nfs/dbraw/zinc/29/58/09/887295809.db2.gz NSTLGJSJUVNUHX-UHFFFAOYSA-N 0 3 401.448 4.081 20 0 HIADHN CN(Cc1ccc(F)c(Cl)c1)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472452563 887305848 /nfs/dbraw/zinc/30/58/48/887305848.db2.gz CRCAJDBAANBNFM-UHFFFAOYSA-N 0 3 421.866 4.426 20 0 HIADHN C[C@@H]1[C@@H](c2ccccc2)CCN1C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472462627 887321488 /nfs/dbraw/zinc/32/14/88/887321488.db2.gz HRCXHYXWBLKVRR-FFZSDIPESA-N 0 3 409.496 4.379 20 0 HIADHN C[C@H]1c2ccsc2CCN1C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472470223 887331221 /nfs/dbraw/zinc/33/12/21/887331221.db2.gz ZVEWSSYHBHRKPD-GRTSSRMGSA-N 0 3 401.498 4.182 20 0 HIADHN Cc1ccc([C@H](NC(=O)N(CCN(C)C)Cc2ccccc2)c2ccccn2)cc1 ZINC000472484365 887349699 /nfs/dbraw/zinc/34/96/99/887349699.db2.gz CWIYPNUBMYJGMF-DEOSSOPVSA-N 0 3 402.542 4.253 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1ncoc1-c1ccc(F)cc1)c1cccc(OC)c1 ZINC000472526483 887396820 /nfs/dbraw/zinc/39/68/20/887396820.db2.gz ZNIMRQHCEOVPOO-FQEVSTJZSA-N 0 3 411.477 4.302 20 0 HIADHN O=C(Nc1ccc2ccc(Cl)cc2n1)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000504289758 913144156 /nfs/dbraw/zinc/14/41/56/913144156.db2.gz OJGOOKPAXARHFI-UHFFFAOYSA-N 0 3 409.917 4.345 20 0 HIADHN CC[C@@H](C)NC(=O)c1ccc(NC(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000472700563 887553146 /nfs/dbraw/zinc/55/31/46/887553146.db2.gz DJKYCZJCUWOUEO-AUSIDOKSSA-N 0 3 422.573 4.343 20 0 HIADHN COc1ccc(OC(F)F)c(NC(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000472702406 887555141 /nfs/dbraw/zinc/55/51/41/887555141.db2.gz XDAGLALORUOWOU-QGZVFWFLSA-N 0 3 419.472 4.425 20 0 HIADHN CN(C(=O)Nc1nnc(-c2ccsc2)s1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000472718447 887566043 /nfs/dbraw/zinc/56/60/43/887566043.db2.gz YQRBSOHRPYQMGB-KRWDZBQOSA-N 0 3 413.572 4.395 20 0 HIADHN CCN(CC)C(=O)c1cccc(NC(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000472767473 887613390 /nfs/dbraw/zinc/61/33/90/887613390.db2.gz HRKLWNHHAVDIRF-HSZRJFAPSA-N 0 3 422.573 4.297 20 0 HIADHN CCN(CC)C(=O)c1ccc(NC(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000472774689 887619996 /nfs/dbraw/zinc/61/99/96/887619996.db2.gz UANMNIUDNCHZDX-HSZRJFAPSA-N 0 3 422.573 4.297 20 0 HIADHN Cc1ccc(NC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)c(-c2nc(C3CC3)no2)c1 ZINC000472834034 887683264 /nfs/dbraw/zinc/68/32/64/887683264.db2.gz DXQAUYOYIBTXEK-LJQANCHMSA-N 0 3 417.513 4.318 20 0 HIADHN COc1cc(NC(=O)N(CCN(C)C)Cc2ccccc2)ccc1Br ZINC000472859103 887713875 /nfs/dbraw/zinc/71/38/75/887713875.db2.gz ZYRUBSJZWSXIBB-UHFFFAOYSA-N 0 3 406.324 4.053 20 0 HIADHN C[C@H](CCN1CCN(C)CC1)NC(=O)N[C@@H](CC1CCCCC1)c1ccccc1 ZINC000472904834 887750278 /nfs/dbraw/zinc/75/02/78/887750278.db2.gz MFYOEUKYVDSALS-OFNKIYASSA-N 0 3 400.611 4.023 20 0 HIADHN C[C@H](NC(=O)N(CCN(C)C)Cc1ccc(Br)cc1)c1ccccc1 ZINC000504337827 913176388 /nfs/dbraw/zinc/17/63/88/913176388.db2.gz HHMPPLIYFQZBAF-INIZCTEOSA-N 0 3 404.352 4.284 20 0 HIADHN COc1cccc(C=C2CCN(C[C@@H](O)Cn3cnc4cc(C)c(C)cc43)CC2)c1 ZINC000472940488 887788987 /nfs/dbraw/zinc/78/89/87/887788987.db2.gz NBFINXQXBRYQME-JOCHJYFZSA-N 0 3 405.542 4.202 20 0 HIADHN CN(C(=O)Nc1cnn(Cc2ccccc2)c1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000473073439 887891783 /nfs/dbraw/zinc/89/17/83/887891783.db2.gz UAHGKVGAMNKQJG-HSZRJFAPSA-N 0 3 403.530 4.060 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCc1oc2ccccc2c1OC)c1ccsc1 ZINC000473463398 888186989 /nfs/dbraw/zinc/18/69/89/888186989.db2.gz SFYVXTVHMXXYFH-KRWDZBQOSA-N 0 3 401.532 4.385 20 0 HIADHN CN1CCN(CCC(C)(C)NC(=O)Nc2ccc(-c3nc4ccccc4o3)cc2)CC1 ZINC000473501575 888227165 /nfs/dbraw/zinc/22/71/65/888227165.db2.gz FHQKMNJTLDFJPS-UHFFFAOYSA-N 0 3 421.545 4.032 20 0 HIADHN CC(C)[C@H]1CC[C@@H](C)C[C@@H]1OCC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473513511 888243425 /nfs/dbraw/zinc/24/34/25/888243425.db2.gz NYQIIADATVUGKL-ODGZRVONSA-N 0 3 418.544 4.385 20 0 HIADHN Cc1nc2cc(F)ccc2cc1C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473518293 888250654 /nfs/dbraw/zinc/25/06/54/888250654.db2.gz DQTPEFUGIYHDJS-UHFFFAOYSA-N 0 3 409.427 4.217 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1cccc(OC(F)(F)F)c1 ZINC000473517950 888250679 /nfs/dbraw/zinc/25/06/79/888250679.db2.gz CBOAAURTPJAROP-UHFFFAOYSA-N 0 3 410.358 4.120 20 0 HIADHN C[C@H](CSc1ccccc1)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473518313 888250825 /nfs/dbraw/zinc/25/08/25/888250825.db2.gz CYLWLTSVCRCBPB-ODIFPOPNSA-N 0 3 400.510 4.336 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)[C@@H]1C[C@]12CCCc1ccccc12 ZINC000473520117 888253456 /nfs/dbraw/zinc/25/34/56/888253456.db2.gz IHTGQLLVOHPPEZ-IQDQWBFVSA-N 0 3 406.492 4.202 20 0 HIADHN Cc1ccc(SCC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)c(C)c1 ZINC000473520597 888255361 /nfs/dbraw/zinc/25/53/61/888255361.db2.gz IOAJTCWKVQQTTK-UHFFFAOYSA-N 0 3 400.510 4.317 20 0 HIADHN O=C(CSc1ccccc1Cl)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473521633 888256225 /nfs/dbraw/zinc/25/62/25/888256225.db2.gz FMBWGOMUKKHVAF-UHFFFAOYSA-N 0 3 406.901 4.354 20 0 HIADHN CCSCc1ccc(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cc1 ZINC000473523561 888258007 /nfs/dbraw/zinc/25/80/07/888258007.db2.gz WAPORHUICJMUJZ-UHFFFAOYSA-N 0 3 400.510 4.475 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1sccc1Br ZINC000473523368 888258876 /nfs/dbraw/zinc/25/88/76/888258876.db2.gz VOIOHGMROAUJAW-UHFFFAOYSA-N 0 3 411.287 4.046 20 0 HIADHN O=C(COc1ccccc1C(F)(F)F)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473523129 888258937 /nfs/dbraw/zinc/25/89/37/888258937.db2.gz GKSYNZVQZHXCEA-UHFFFAOYSA-N 0 3 424.385 4.006 20 0 HIADHN CSc1ccc(O[C@H](C)C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cc1 ZINC000473525545 888261520 /nfs/dbraw/zinc/26/15/20/888261520.db2.gz QGWMOWCCQPWREN-IUDNXUCKSA-N 0 3 416.509 4.097 20 0 HIADHN Cc1cc(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)c2c(n1)onc2C(C)C ZINC000473526060 888264032 /nfs/dbraw/zinc/26/40/32/888264032.db2.gz JXAXJWZKQBTIDF-UHFFFAOYSA-N 0 3 424.467 4.190 20 0 HIADHN C[C@H](Oc1cccc(Cl)c1)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473528632 888264716 /nfs/dbraw/zinc/26/47/16/888264716.db2.gz UEMLSHPBVCUWLL-JQRITLKVSA-N 0 3 404.860 4.029 20 0 HIADHN Cn1c2ccccc2c(Cl)c1C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473528774 888267543 /nfs/dbraw/zinc/26/75/43/888267543.db2.gz VCTRUYUGMOOTFQ-UHFFFAOYSA-N 0 3 413.871 4.367 20 0 HIADHN Cc1c(NC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)cccc1NC(=O)N(C)C ZINC000473530884 888268374 /nfs/dbraw/zinc/26/83/74/888268374.db2.gz MYWWGVUCCKPSGN-SFHVURJKSA-N 0 3 412.509 4.078 20 0 HIADHN C[C@H](Oc1ccc(Cl)cc1)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473533374 888269886 /nfs/dbraw/zinc/26/98/86/888269886.db2.gz WUNQNDKWJXFOSH-JQRITLKVSA-N 0 3 404.860 4.029 20 0 HIADHN CC[C@H](O[C@H]1CCC[C@H](C)C1)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473534058 888271170 /nfs/dbraw/zinc/27/11/70/888271170.db2.gz UMBKGSAOFSPFGP-AUTIYMEDSA-N 0 3 404.517 4.282 20 0 HIADHN C[C@@H](CSc1ccc(F)cc1)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473534778 888273197 /nfs/dbraw/zinc/27/31/97/888273197.db2.gz WBGSOXPQMVSYCA-IGEOTXOUSA-N 0 3 418.500 4.475 20 0 HIADHN C[C@@H](Oc1ccc(C(F)(F)F)cc1)C(=O)N(Cc1ccco1)C1CCN(C)CC1 ZINC000473620807 888360666 /nfs/dbraw/zinc/36/06/66/888360666.db2.gz UJCQJCLTZVZGBD-OAHLLOKOSA-N 0 3 410.436 4.189 20 0 HIADHN Cc1nc(CNC(=O)NCCN(C)Cc2ccccc2)oc1-c1ccc(Cl)cc1 ZINC000473668547 888425474 /nfs/dbraw/zinc/42/54/74/888425474.db2.gz UVILNLAHDYRCKG-UHFFFAOYSA-N 0 3 412.921 4.235 20 0 HIADHN COc1c(CNC(=O)N(Cc2ccccc2)C2CCN(C)CC2)oc2ccccc21 ZINC000473718145 888495680 /nfs/dbraw/zinc/49/56/80/888495680.db2.gz YJWRRELAJQZARE-UHFFFAOYSA-N 0 3 407.514 4.247 20 0 HIADHN CCCCn1cc(C(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)c(C)n1 ZINC000473756989 888548346 /nfs/dbraw/zinc/54/83/46/888548346.db2.gz DCKWWIKUKAELSN-UHFFFAOYSA-N 0 3 410.484 4.214 20 0 HIADHN CCCCn1cc(C(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)c(C)n1 ZINC000473762817 888558745 /nfs/dbraw/zinc/55/87/45/888558745.db2.gz KEZPRCDQMLFHHP-UHFFFAOYSA-N 0 3 410.484 4.214 20 0 HIADHN CC(C)n1nc2c(c1NC(=O)N(CCN(C)C)Cc1cccc(Cl)c1)CCC2 ZINC000473804230 888626374 /nfs/dbraw/zinc/62/63/74/888626374.db2.gz HVQKPVZTKNUMNX-UHFFFAOYSA-N 0 3 403.958 4.202 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N(C)CCCOc3ccccc3C)c2)CC1 ZINC000473816520 888643857 /nfs/dbraw/zinc/64/38/57/888643857.db2.gz HRCDDBDCAQIRMH-UHFFFAOYSA-N 0 3 410.562 4.070 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CCC[C@@H]3Cc3cccc(F)c3)c2)CC1 ZINC000473820393 888650023 /nfs/dbraw/zinc/65/00/23/888650023.db2.gz PLTXUWRNDSVQMU-HSZRJFAPSA-N 0 3 410.537 4.207 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CCC[C@@](C)(c4ccccc4)C3)c2)CC1 ZINC000473822010 888653513 /nfs/dbraw/zinc/65/35/13/888653513.db2.gz ZLVUVMJIPIDYCT-RUZDIDTESA-N 0 3 406.574 4.414 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CCCC[C@@H]3Cc3ccccc3)c2)CC1 ZINC000473824783 888656513 /nfs/dbraw/zinc/65/65/13/888656513.db2.gz OWVCJIRSEWSESU-XMMPIXPASA-N 0 3 406.574 4.458 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N(C)[C@H]3CCCc4nc(C)sc43)c2)CC1 ZINC000473828294 888661383 /nfs/dbraw/zinc/66/13/83/888661383.db2.gz JTNQSQWQUYACQO-FQEVSTJZSA-N 0 3 413.591 4.135 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CC[C@@H](c4ccccc4)[C@H](C)C3)c2)CC1 ZINC000473832771 888668303 /nfs/dbraw/zinc/66/83/03/888668303.db2.gz AFDVTMGMLXDLOC-HYBUGGRVSA-N 0 3 406.574 4.486 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N(C)C[C@H](C)Cc3ccc(OC)cc3)c2)CC1 ZINC000473833785 888670120 /nfs/dbraw/zinc/67/01/20/888670120.db2.gz DCKGHCFSMKXRBJ-HXUWFJFHSA-N 0 3 424.589 4.180 20 0 HIADHN Cc1nc(CC(C)C)c(NC(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)s1 ZINC000473848231 888695807 /nfs/dbraw/zinc/69/58/07/888695807.db2.gz QKRMTNBVCDKOKX-CALCHBBNSA-N 0 3 422.639 4.393 20 0 HIADHN COc1ccc(C(=O)Nc2cc(CN(C)C)ccc2C)c(OCCOC(C)C)c1 ZINC000473852387 888703859 /nfs/dbraw/zinc/70/38/59/888703859.db2.gz FDHLDJMYUXDJGO-UHFFFAOYSA-N 0 3 400.519 4.121 20 0 HIADHN Cc1cc(Br)c(F)cc1NC(=O)N(CCN(C)C)Cc1ccccc1 ZINC000473855547 888707135 /nfs/dbraw/zinc/70/71/35/888707135.db2.gz RZSKCZDGYZXKKR-UHFFFAOYSA-N 0 3 408.315 4.492 20 0 HIADHN C[C@H](NC(=O)N1CC[C@H](CN(C)Cc2cccnc2)C1)c1cc2cccc(F)c2o1 ZINC000473873908 888736138 /nfs/dbraw/zinc/73/61/38/888736138.db2.gz HTJOWDMTVLGVLQ-FUHWJXTLSA-N 0 3 410.493 4.191 20 0 HIADHN CCOc1cccc2[nH]cc(CC(=O)N3CC[C@H](C)N(Cc4ccccc4)CC3)c21 ZINC000473887686 888758177 /nfs/dbraw/zinc/75/81/77/888758177.db2.gz PTEYVTKIQHGZPM-IBGZPJMESA-N 0 3 405.542 4.232 20 0 HIADHN CCCOc1ccc(CNC(=O)N(C)C2CCN(CCc3ccccn3)CC2)c(C)c1 ZINC000473964233 888834227 /nfs/dbraw/zinc/83/42/27/888834227.db2.gz AXPKBOKTGRULSJ-UHFFFAOYSA-N 0 3 424.589 4.027 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N[C@@H](C)c2ccc(Br)cn2)N(C)C)cc1 ZINC000473967479 888835127 /nfs/dbraw/zinc/83/51/27/888835127.db2.gz GIIYGTOJQIVOLK-LIRRHRJNSA-N 0 3 419.367 4.070 20 0 HIADHN O=C(Nc1ccc(OC2CCCC2)cc1)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1CO ZINC000473975288 888840719 /nfs/dbraw/zinc/84/07/19/888840719.db2.gz NSKIMMAXIKQNCL-YKSBVNFPSA-N 0 3 423.557 4.013 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc(CN[C@@H]2CC(C)(C)c3cc(OC)ccc32)cc1 ZINC000474033811 888880669 /nfs/dbraw/zinc/88/06/69/888880669.db2.gz MABICJUVNZFTTL-JOCHJYFZSA-N 0 3 416.587 4.238 20 0 HIADHN FC(F)(F)c1cc(Br)ccc1CN1CCC(CN2CCOCC2)CC1 ZINC000474148815 888976727 /nfs/dbraw/zinc/97/67/27/888976727.db2.gz FAVRGDMGUWPOOO-UHFFFAOYSA-N 0 3 421.301 4.012 20 0 HIADHN C[C@H](NC(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1)c1ccc(Br)cn1 ZINC000474180835 889020926 /nfs/dbraw/zinc/02/09/26/889020926.db2.gz FWLKVUACIOQRAC-MPGHIAIKSA-N 0 3 417.351 4.040 20 0 HIADHN CCOC(=O)c1nc(-c2ccccc2)oc1CN(C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000474241932 889089217 /nfs/dbraw/zinc/08/92/17/889089217.db2.gz YBHUKVPSFOZVMX-OAQYLSRUSA-N 0 3 419.525 4.225 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)[C@H](C)Oc2ccc(C(F)(F)F)cc2)CC1 ZINC000474245819 889094455 /nfs/dbraw/zinc/09/44/55/889094455.db2.gz DENLWHHDQFGCCL-CVEARBPZSA-N 0 3 421.463 4.210 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)C2(c3ccc(C(F)(F)F)cc3)CC2)CC1 ZINC000474249721 889100047 /nfs/dbraw/zinc/10/00/47/889100047.db2.gz MWHMXNOUKBEILM-MRXNPFEDSA-N 0 3 417.475 4.474 20 0 HIADHN CCO[C@@H](C)c1noc(CN2CCN(C[C@H](CC(C)C)c3ccccc3)CC2)n1 ZINC000474267681 889129683 /nfs/dbraw/zinc/12/96/83/889129683.db2.gz NODZCXGLXSUVJC-FPOVZHCZSA-N 0 3 400.567 4.115 20 0 HIADHN Clc1ccc(CN2CCC(c3nc(-c4ccccc4)n[nH]3)CC2)c(-n2cncn2)c1 ZINC000474277689 889142565 /nfs/dbraw/zinc/14/25/65/889142565.db2.gz UBSUJPQBGGHLAG-UHFFFAOYSA-N 0 3 419.920 4.085 20 0 HIADHN COc1cnccc1N1CCN(C(=O)N[C@H](C)c2ccc(SC(C)C)cc2)CC1 ZINC000474329001 889200067 /nfs/dbraw/zinc/20/00/67/889200067.db2.gz HUAAHJSISIDSOV-QGZVFWFLSA-N 0 3 414.575 4.184 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)NCCc1cccc(-c2ccccc2)c1 ZINC000474332003 889204874 /nfs/dbraw/zinc/20/48/74/889204874.db2.gz XSCJWBPRCPHDKN-UHFFFAOYSA-N 0 3 402.542 4.065 20 0 HIADHN CCc1ccc(-c2noc([C@@H](C)NC(=O)N(CCN(C)C)Cc3ccccc3)n2)cc1 ZINC000474475404 889337129 /nfs/dbraw/zinc/33/71/29/889337129.db2.gz YGLRYTQOUHJVCM-GOSISDBHSA-N 0 3 421.545 4.133 20 0 HIADHN C[C@H](CCc1ccc(I)cc1)N[C@H](C)c1nnc2ccccn21 ZINC000474484059 889345175 /nfs/dbraw/zinc/34/51/75/889345175.db2.gz DXCZJUZBOAVTFQ-ZIAGYGMSSA-N 0 3 420.298 4.006 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)N[C@@H](c1cccc(Cl)c1)c1ccccn1 ZINC000474515705 889382527 /nfs/dbraw/zinc/38/25/27/889382527.db2.gz PGOGGUVLDYIQHP-NRFANRHFSA-N 0 3 412.921 4.191 20 0 HIADHN Cc1ccccc1-n1nccc1CNCc1ccccc1CN1C[C@H](C)O[C@@H](C)C1 ZINC000474610881 889475609 /nfs/dbraw/zinc/47/56/09/889475609.db2.gz DOIGNAAHUOKSEA-SFTDATJTSA-N 0 3 404.558 4.080 20 0 HIADHN Cc1cc(N2CCSCC2)ccc1NC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000474616702 889480580 /nfs/dbraw/zinc/48/05/80/889480580.db2.gz NWVZUUDKRVGSBL-QFIPXVFZSA-N 0 3 424.614 4.286 20 0 HIADHN Cc1ccnc(-c2ccc(NC(=O)N(C)[C@@H]3CCN(Cc4ccccc4)C3)cc2)n1 ZINC000474619921 889483742 /nfs/dbraw/zinc/48/37/42/889483742.db2.gz YZOTWQMFZLISJO-JOCHJYFZSA-N 0 3 401.514 4.190 20 0 HIADHN Cc1ccnc(-c2ccc(NC(=O)N(C)[C@H]3CCN(Cc4ccccc4)C3)cc2)n1 ZINC000474619924 889483992 /nfs/dbraw/zinc/48/39/92/889483992.db2.gz YZOTWQMFZLISJO-QFIPXVFZSA-N 0 3 401.514 4.190 20 0 HIADHN COc1ccc(Br)cc1NC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000474723909 889580134 /nfs/dbraw/zinc/58/01/34/889580134.db2.gz HPEMBUUDSVJNDE-QGZVFWFLSA-N 0 3 418.335 4.196 20 0 HIADHN Cc1ccc(NC(=O)C(C)C)cc1NC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000474732170 889588608 /nfs/dbraw/zinc/58/86/08/889588608.db2.gz BUHVUEGSDWSCSD-OAQYLSRUSA-N 0 3 408.546 4.328 20 0 HIADHN Cc1ccc(NC(=O)C2CC2)cc1NC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000474740817 889595745 /nfs/dbraw/zinc/59/57/45/889595745.db2.gz USDJRHFZIXLDIM-NRFANRHFSA-N 0 3 406.530 4.082 20 0 HIADHN CC(=O)Nc1ccc(Cl)c(NC(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000474740619 889596403 /nfs/dbraw/zinc/59/64/03/889596403.db2.gz YYTPBCYILSNWQW-SFHVURJKSA-N 0 3 400.910 4.037 20 0 HIADHN COC(=O)C[C@@H]1CC[C@H](N[C@@H](c2cccc(OC)c2)c2cc(F)ccc2OC)[C@@H]1C ZINC000474808506 889662049 /nfs/dbraw/zinc/66/20/49/889662049.db2.gz JZAHOOCTVKQOGW-GSZISWOESA-N 0 3 415.505 4.500 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)[C@H](C)Oc2ccccc2Cc2ccccc2)CC1 ZINC000474876770 889730334 /nfs/dbraw/zinc/73/03/34/889730334.db2.gz FPDGJMFMFVPVAQ-NRFANRHFSA-N 0 3 424.585 4.050 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)c2ccc(Oc3ccc(F)c(F)c3)cc2)CC1 ZINC000474884288 889740575 /nfs/dbraw/zinc/74/05/75/889740575.db2.gz ZZVBVRIRDHYJJJ-UHFFFAOYSA-N 0 3 418.484 4.376 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)c2ccccc2OCc2ccc(F)cc2)CC1 ZINC000474890511 889747372 /nfs/dbraw/zinc/74/73/72/889747372.db2.gz ALFIUCCYOZMBMX-UHFFFAOYSA-N 0 3 414.521 4.024 20 0 HIADHN Cc1csc([C@H](C)CNCc2c(F)ccc(I)c2F)n1 ZINC000474924688 889784125 /nfs/dbraw/zinc/78/41/25/889784125.db2.gz IPOGWRTVALYHSC-MRVPVSSYSA-N 0 3 408.255 4.228 20 0 HIADHN CCN(C(=O)Nc1ccc2c(c1)CCCC(=O)N2)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475005308 889857458 /nfs/dbraw/zinc/85/74/58/889857458.db2.gz XIXLNWAQPXXVHQ-NRFANRHFSA-N 0 3 406.530 4.090 20 0 HIADHN CCN(C(=O)N[C@H](c1ccc(OC)cc1)C1CC1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475006886 889859157 /nfs/dbraw/zinc/85/91/57/889859157.db2.gz AOTRUTDZZMCOPC-VWNXMTODSA-N 0 3 407.558 4.452 20 0 HIADHN CCN(C(=O)N[C@H](c1ccc(OC)cc1)C1CC1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475006885 889859360 /nfs/dbraw/zinc/85/93/60/889859360.db2.gz AOTRUTDZZMCOPC-UPVQGACJSA-N 0 3 407.558 4.452 20 0 HIADHN CCN(CC)C(=O)c1cccc(NC(=O)N(CC)[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000475008569 889862396 /nfs/dbraw/zinc/86/23/96/889862396.db2.gz UYRLYFWJWGOYEY-HSZRJFAPSA-N 0 3 422.573 4.297 20 0 HIADHN C[C@@H](CCN1CCCN(C(=O)c2cccc(Cl)c2)CC1)OCc1ccccc1 ZINC000475053309 889899539 /nfs/dbraw/zinc/89/95/39/889899539.db2.gz IHFNFAIZMNFAMY-IBGZPJMESA-N 0 3 400.950 4.483 20 0 HIADHN CN(Cc1ccc(-c2ccccc2Cl)o1)C[C@@H]1C[C@H](F)CN1Cc1ncccn1 ZINC000475082428 889928073 /nfs/dbraw/zinc/92/80/73/889928073.db2.gz ISCSZWBKXPEZAR-IRXDYDNUSA-N 0 3 414.912 4.434 20 0 HIADHN CCN1CCN(c2cccc(NCc3ccc(OCC(F)(F)F)c(OC)c3)c2)CC1 ZINC000475096034 889942767 /nfs/dbraw/zinc/94/27/67/889942767.db2.gz VAXBTRMCVSSBSL-UHFFFAOYSA-N 0 3 423.479 4.390 20 0 HIADHN Cc1ccc(-c2nc(CCNC(=O)N(C)[C@H]3CCN(Cc4ccccc4)C3)co2)cc1 ZINC000475102026 889948760 /nfs/dbraw/zinc/94/87/60/889948760.db2.gz FZDSJKHRXNGFBY-QHCPKHFHSA-N 0 3 418.541 4.108 20 0 HIADHN CN(C(=O)NCc1ccc(-c2ccncc2)cc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475104450 889952149 /nfs/dbraw/zinc/95/21/49/889952149.db2.gz SQHMTXMGYQQJLS-DEOSSOPVSA-N 0 3 400.526 4.165 20 0 HIADHN CN(C(=O)N[C@H](c1nccs1)c1ccccc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475105227 889954599 /nfs/dbraw/zinc/95/45/99/889954599.db2.gz BJVGBPLXDXZGJG-RTWAWAEBSA-N 0 3 406.555 4.148 20 0 HIADHN CN(C(=O)NCc1cccc(COC(C)(C)C)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475110723 889960606 /nfs/dbraw/zinc/96/06/06/889960606.db2.gz ACBMIKGRAXGKDV-HSZRJFAPSA-N 0 3 409.574 4.418 20 0 HIADHN C[C@H](NC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1)c1nc(C(C)(C)C)cs1 ZINC000475121951 889979399 /nfs/dbraw/zinc/97/93/99/889979399.db2.gz UOSSPHSJUWIGNI-WMZOPIPTSA-N 0 3 400.592 4.418 20 0 HIADHN CCOc1ccc([C@@H](C)NC(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)cc1OC ZINC000475129119 889992475 /nfs/dbraw/zinc/99/24/75/889992475.db2.gz LJGGFQXNJHEDAZ-WIYYLYMNSA-N 0 3 411.546 4.071 20 0 HIADHN CC(C)[C@H](CCO)NCC(=O)Nc1nc(-c2ccc(Cl)cc2Cl)cs1 ZINC000475150053 890016804 /nfs/dbraw/zinc/01/68/04/890016804.db2.gz QYKYRKQDMDCLQR-AWEZNQCLSA-N 0 3 402.347 4.052 20 0 HIADHN CCN(C(=O)N[C@@H](C)c1noc(-c2ccccc2)n1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475161336 890024618 /nfs/dbraw/zinc/02/46/18/890024618.db2.gz HWFKIQNJCGZCKP-RXVVDRJESA-N 0 3 419.529 4.104 20 0 HIADHN CCN(C(=O)NCc1cccc(OC(C)(C)C)n1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475160149 890025250 /nfs/dbraw/zinc/02/52/50/890025250.db2.gz BCDHQRVERFZJIJ-OAQYLSRUSA-N 0 3 410.562 4.065 20 0 HIADHN CCN(C(=O)NCc1nc(C(C)C)c(C)s1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475162843 890026350 /nfs/dbraw/zinc/02/63/50/890026350.db2.gz LEQGFLWIDNBPFD-LJQANCHMSA-N 0 3 400.592 4.381 20 0 HIADHN CCN(C(=O)N[C@@H](C)c1ccccc1-n1cccn1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475162752 890026445 /nfs/dbraw/zinc/02/64/45/890026445.db2.gz DZENGFHVBCANLS-UNMCSNQZSA-N 0 3 417.557 4.239 20 0 HIADHN CCN(C(=O)N[C@H](C[C@H]1CCOC1)c1ccccc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475166003 890030374 /nfs/dbraw/zinc/03/03/74/890030374.db2.gz UPQHCIMZHUBWTK-PZUNEJSGSA-N 0 3 421.585 4.460 20 0 HIADHN CCN(C(=O)N[C@@H]1CCO[C@H](c2ccccc2)C1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475164756 890031237 /nfs/dbraw/zinc/03/12/37/890031237.db2.gz PNXCFVZUKBRVIN-SGNDLWITSA-N 0 3 407.558 4.213 20 0 HIADHN COC(=O)C[C@@H]1CC[C@H](N[C@@H](C)c2nc(-c3ccc(Br)cc3)no2)[C@H]1C ZINC000475192806 890061886 /nfs/dbraw/zinc/06/18/86/890061886.db2.gz BZZJUOSNDTWFFX-DUPGQFARSA-N 0 3 422.323 4.128 20 0 HIADHN CC(C)[C@](C)(NCc1cnc(-c2cnn(C)c2)nc1)c1ccc(Br)cc1 ZINC000475216569 890085136 /nfs/dbraw/zinc/08/51/36/890085136.db2.gz OUWVLJWZATYOFF-FQEVSTJZSA-N 0 3 414.351 4.301 20 0 HIADHN COc1cc(C[NH2+]CC2CCN(c3ccccc3)CC2)cc(Br)c1[O-] ZINC000475286068 890184940 /nfs/dbraw/zinc/18/49/40/890184940.db2.gz OQOIOEPJYBUKSE-UHFFFAOYSA-N 0 3 405.336 4.170 20 0 HIADHN CN(C(=O)CCc1ncc(-c2ccccc2F)o1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475300507 890208087 /nfs/dbraw/zinc/20/80/87/890208087.db2.gz AQQSIZSQKZJGFP-IBGZPJMESA-N 0 3 407.489 4.146 20 0 HIADHN COc1cc(C(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)ccc1OC1CCCC1 ZINC000475306863 890218096 /nfs/dbraw/zinc/21/80/96/890218096.db2.gz VPPJEBCMZCACKB-NRFANRHFSA-N 0 3 408.542 4.363 20 0 HIADHN COc1ccc(-c2cnc(CCC(=O)N(C)[C@@H]3CCN(Cc4ccccc4)C3)o2)cc1 ZINC000475307646 890218963 /nfs/dbraw/zinc/21/89/63/890218963.db2.gz FIPUTRJBIIIVGJ-OAQYLSRUSA-N 0 3 419.525 4.016 20 0 HIADHN CN(C(=O)c1cnn(-c2ccccc2)c1C1CC1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475312131 890226839 /nfs/dbraw/zinc/22/68/39/890226839.db2.gz AUSWXQZEWVYUKE-QFIPXVFZSA-N 0 3 400.526 4.096 20 0 HIADHN C[C@H](SCC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1)c1nc2ccccc2[nH]1 ZINC000475313124 890227760 /nfs/dbraw/zinc/22/77/60/890227760.db2.gz OUKDKCCRZZXCJT-PKOBYXMFSA-N 0 3 408.571 4.090 20 0 HIADHN CO[C@H]1CCC[C@@H](CC(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)C1 ZINC000475316690 890230878 /nfs/dbraw/zinc/23/08/78/890230878.db2.gz XVNABAKLVDBLOZ-APWZRJJASA-N 0 3 400.485 4.191 20 0 HIADHN CN(C(=O)CCc1cc(Br)cs1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475318777 890235751 /nfs/dbraw/zinc/23/57/51/890235751.db2.gz RCTCMXUFVMXTJK-KRWDZBQOSA-N 0 3 407.377 4.176 20 0 HIADHN COCCC[C@@H](Cc1ccccc1)[NH2+]Cc1ccc(OC)c([O-])c1Br ZINC000475331211 890250682 /nfs/dbraw/zinc/25/06/82/890250682.db2.gz KPAKEEWCBHGDEH-KRWDZBQOSA-N 0 3 408.336 4.291 20 0 HIADHN CS(=O)(=O)C1(CNCc2ccc(-c3ccc(Br)cc3)s2)CCC1 ZINC000475440969 890359489 /nfs/dbraw/zinc/35/94/89/890359489.db2.gz OLDOTCKEHTZFDN-UHFFFAOYSA-N 0 3 414.390 4.235 20 0 HIADHN OCCN(Cc1cnc(-c2ccc(Br)cc2)s1)[C@@H]1CCCSC1 ZINC000475501027 890412332 /nfs/dbraw/zinc/41/23/32/890412332.db2.gz HUAFGOBMAKSFFF-OAHLLOKOSA-N 0 3 413.406 4.263 20 0 HIADHN Cc1nc(CC(C)C)oc1C(=O)N(CCN(C)C)Cc1ccc(C(F)(F)F)cc1 ZINC000475506251 890422010 /nfs/dbraw/zinc/42/20/10/890422010.db2.gz XWVJWFRZBWTVNM-UHFFFAOYSA-N 0 3 411.468 4.404 20 0 HIADHN COC(=O)c1cc2c(o1)c(OC)ccc2CN1CCC(O)(Cc2cccc(C)c2)CC1 ZINC000475512274 890430731 /nfs/dbraw/zinc/43/07/31/890430731.db2.gz YGBXEOYPMAYHQV-UHFFFAOYSA-N 0 3 423.509 4.106 20 0 HIADHN CN(C(=O)c1[nH]c2ccccc2c1Br)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475543803 890469191 /nfs/dbraw/zinc/46/91/91/890469191.db2.gz RJLPNRCBCKXEMH-INIZCTEOSA-N 0 3 412.331 4.277 20 0 HIADHN COc1c(Cl)cc(NC(=O)NC2CCN(CCOC(C)C)CC2)cc1Cl ZINC000475607326 890535013 /nfs/dbraw/zinc/53/50/13/890535013.db2.gz MCSPHNVPDRBZCI-UHFFFAOYSA-N 0 3 404.338 4.013 20 0 HIADHN Cc1nc(CN(C)[C@H]2CCCN(Cc3cnc(-c4ccsc4)s3)CC2)no1 ZINC000475629393 890568938 /nfs/dbraw/zinc/56/89/38/890568938.db2.gz YFVPUCSPAQYIMY-INIZCTEOSA-N 0 3 403.577 4.050 20 0 HIADHN C[C@H](CC(=O)N1CCCCCC1)N[C@@H](CO)c1ccc(Cl)cc1C(F)(F)F ZINC000475638030 890579029 /nfs/dbraw/zinc/57/90/29/890579029.db2.gz NOZOXKONGVKFAJ-DYVFJYSZSA-N 0 3 406.876 4.163 20 0 HIADHN COc1ccc([C@H](CNC(=O)Nc2cc(-n3cccn3)ccc2C)N2CCCC2)cc1 ZINC000475639595 890580641 /nfs/dbraw/zinc/58/06/41/890580641.db2.gz BYRLYDWWXSIWDM-QHCPKHFHSA-N 0 3 419.529 4.148 20 0 HIADHN CC(C)(CNC(=O)NCc1cc(Br)cs1)N1CCc2ccccc2C1 ZINC000504733224 913471131 /nfs/dbraw/zinc/47/11/31/913471131.db2.gz VZEWMXSWDDVESF-UHFFFAOYSA-N 0 3 422.392 4.147 20 0 HIADHN C[C@H](NCCC(=O)Nc1ccc(N2CCCC2=O)cc1)c1cc2cccc(F)c2o1 ZINC000475690977 890632334 /nfs/dbraw/zinc/63/23/34/890632334.db2.gz CCUSQRYJZXUPQM-HNNXBMFYSA-N 0 3 409.461 4.378 20 0 HIADHN COc1ccc(CN(C(=O)NCC(C)(C)N2CCc3ccccc3C2)C2CC2)cc1 ZINC000504737331 913475625 /nfs/dbraw/zinc/47/56/25/913475625.db2.gz KZSWNAMQFPAZOS-UHFFFAOYSA-N 0 3 407.558 4.206 20 0 HIADHN O=C(c1ccccc1)c1cc(F)c(F)cc1C(=O)N1CCCC[C@H](N2CCCC2)C1 ZINC000475778691 890721356 /nfs/dbraw/zinc/72/13/56/890721356.db2.gz XIXYJXMYRPKQKW-SFHVURJKSA-N 0 3 412.480 4.286 20 0 HIADHN CN(Cc1ccccc1NC(=O)C(=O)c1cnn(-c2ccccc2)c1)C1CCCCC1 ZINC000504747487 913487665 /nfs/dbraw/zinc/48/76/65/913487665.db2.gz FMJKONCBWYVOCH-UHFFFAOYSA-N 0 3 416.525 4.458 20 0 HIADHN O=C(N[C@@H](c1ccccc1)C1CCCC1)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1CO ZINC000475894152 890826568 /nfs/dbraw/zinc/82/65/68/890826568.db2.gz ZTRZZGKOBYJQOM-SDHSZQHLSA-N 0 3 421.585 4.100 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1oc(CC2CC2)nc1C ZINC000475909647 890838304 /nfs/dbraw/zinc/83/83/04/890838304.db2.gz FFOLTZGGWGFORR-HXUWFJFHSA-N 0 3 419.529 4.140 20 0 HIADHN C[C@H](NC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1CO)c1cccc2ccccc21 ZINC000475970948 890888800 /nfs/dbraw/zinc/88/88/00/890888800.db2.gz YSUJSIPFKJXXSF-SWHJIRTISA-N 0 3 417.553 4.083 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N[C@@H](C)Cc2ccc(Cl)cc2Cl)CC1 ZINC000476036111 890967040 /nfs/dbraw/zinc/96/70/40/890967040.db2.gz VZFSFOKMHBYYPJ-HNNXBMFYSA-N 0 3 416.393 4.113 20 0 HIADHN COc1cccc([C@H]2CCCN2C(=O)NCC(C)(C)N2CCc3ccccc3C2)c1 ZINC000504779353 913508468 /nfs/dbraw/zinc/50/84/68/913508468.db2.gz PKTOFEYNWJSYFM-HSZRJFAPSA-N 0 3 407.558 4.379 20 0 HIADHN CC(C)c1nc2c([nH]1)CC[C@@H](C(=O)NCc1ccccc1CN(C)Cc1ccco1)C2 ZINC000476176642 891106894 /nfs/dbraw/zinc/10/68/94/891106894.db2.gz VAACYYDLZXITRJ-GOSISDBHSA-N 0 3 420.557 4.179 20 0 HIADHN O=C(CN1CC[C@@H](c2ccccc2)C1)N1CCC[C@@H]1c1ccc2c(c1)OCCCO2 ZINC000476241930 891165400 /nfs/dbraw/zinc/16/54/00/891165400.db2.gz MWHABZCWYOICMG-FGZHOGPDSA-N 0 3 406.526 4.001 20 0 HIADHN CC(C)(C(=O)NCc1ccccc1CN1CCC(O)CC1)c1ccc(Cl)cc1F ZINC000476267535 891189456 /nfs/dbraw/zinc/18/94/56/891189456.db2.gz VELHWEKCIFNEPD-UHFFFAOYSA-N 0 3 418.940 4.030 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)c2cn(C)nc2-c2ccc(Cl)s2)CN1Cc1ccccc1 ZINC000476305013 891216870 /nfs/dbraw/zinc/21/68/70/891216870.db2.gz XDQYMPQJTJBRTR-ZBFHGGJFSA-N 0 3 414.962 4.195 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)COC1CCC(C)CC1 ZINC000476406552 891322707 /nfs/dbraw/zinc/32/27/07/891322707.db2.gz DDSUZHQNTHEDKC-QUENFVSXSA-N 0 3 410.562 4.172 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N(C)[C@@H](C)[C@H](C)c2ccc(Cl)cc2)CC1 ZINC000476437677 891348990 /nfs/dbraw/zinc/34/89/90/891348990.db2.gz RVMBKBSHVYHCEV-ROUUACIJSA-N 0 3 410.002 4.363 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N(C)[C@H](C)c2cccc(C(F)(F)F)c2)CC1 ZINC000476439530 891351002 /nfs/dbraw/zinc/35/10/02/891351002.db2.gz YDUPHGXAUFTNCX-MRXNPFEDSA-N 0 3 415.500 4.297 20 0 HIADHN CCc1ccc([C@@H]2C[C@@H](C)CCN2C(=O)NC2CCN(CCOC(C)C)CC2)o1 ZINC000476451732 891365145 /nfs/dbraw/zinc/36/51/45/891365145.db2.gz LAHSKVPUYHFSNW-RXVVDRJESA-N 0 3 405.583 4.214 20 0 HIADHN CCc1onc(-c2ccccc2)c1C(=O)Nc1ccc(OC2CCN(C)CC2)nc1 ZINC000476474250 891383744 /nfs/dbraw/zinc/38/37/44/891383744.db2.gz XNULAUYYZNLKIL-UHFFFAOYSA-N 0 3 406.486 4.024 20 0 HIADHN CCN1CCN(CCC(=O)Nc2ccc(-c3ccc(Cl)cc3Cl)nc2)CC1 ZINC000476490655 891400040 /nfs/dbraw/zinc/40/00/40/891400040.db2.gz QFOSYMKKIQCVCU-UHFFFAOYSA-N 0 3 407.345 4.022 20 0 HIADHN CCCSc1nsc(NC(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)n1 ZINC000476502760 891417213 /nfs/dbraw/zinc/41/72/13/891417213.db2.gz HHCATWGEOUCASP-OAHLLOKOSA-N 0 3 405.593 4.169 20 0 HIADHN CCN(C[C@H]1CCN(CC(=O)N(C)[C@@H](C)c2ccc(Cl)cc2)C1)CC(F)(F)F ZINC000476579999 891506055 /nfs/dbraw/zinc/50/60/55/891506055.db2.gz WIAJSYNADVMCET-JKSUJKDBSA-N 0 3 419.919 4.066 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)N(C)[C@@H]2CCCc3nc(C)sc32)N(C)C)cc1 ZINC000476622650 891556321 /nfs/dbraw/zinc/55/63/21/891556321.db2.gz FKBXATYMVBRYJI-WOJBJXKFSA-N 0 3 400.592 4.336 20 0 HIADHN CCCN1CCC(N(C)C(=O)c2cn(C3CC3)c3cc(Cl)c(F)cc3c2=O)CC1 ZINC000476724051 891690181 /nfs/dbraw/zinc/69/01/81/891690181.db2.gz XBKSFSACKANELC-UHFFFAOYSA-N 0 3 419.928 4.075 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CCC[C@@]2(C1)OCc1ccccc12)c1ccsc1 ZINC000476864612 891829617 /nfs/dbraw/zinc/82/96/17/891829617.db2.gz UCQVQDRZMJDIPO-GMAHTHKFSA-N 0 3 413.587 4.362 20 0 HIADHN CCCN(C(=O)c1cn(CC(F)(F)F)nc1C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000477081815 892016432 /nfs/dbraw/zinc/01/64/32/892016432.db2.gz GWXXVIBURIOTPF-IBGZPJMESA-N 0 3 422.495 4.271 20 0 HIADHN C/C=C/c1ccc(OC[C@@H](O)CN2CCC(OCc3ccccc3)CC2)c(OC)c1 ZINC000477157178 892078668 /nfs/dbraw/zinc/07/86/68/892078668.db2.gz BWMOMMVEOKQNRA-RJOTYRNVSA-N 0 3 411.542 4.149 20 0 HIADHN C[C@H](NC(=O)N[C@H](Cc1cccc(Br)c1)CC1CC1)C1=CCN(C)CC1 ZINC000477179608 892098802 /nfs/dbraw/zinc/09/88/02/892098802.db2.gz GTEFHLZIRQRBSZ-YWZLYKJASA-N 0 3 420.395 4.110 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)Nc1ccccc1-c1nncn1C(C)C)c1ccco1 ZINC000477184788 892105644 /nfs/dbraw/zinc/10/56/44/892105644.db2.gz CYPBMUDWDHNUIN-VQIMIIECSA-N 0 3 410.522 4.370 20 0 HIADHN Cc1cccc2c1[C@H](C)C[C@H]2NCc1ccccc1OCC(=O)NC[C@@H]1CCCO1 ZINC000504900227 913631986 /nfs/dbraw/zinc/63/19/86/913631986.db2.gz UFZWKUMKCKKYIK-KAGYGMCKSA-N 0 3 408.542 4.007 20 0 HIADHN O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)N1CCC(c2nc3ccccc3[nH]2)CC1 ZINC000504900608 913632318 /nfs/dbraw/zinc/63/23/18/913632318.db2.gz AIXSDXCSVRCLOI-OAQYLSRUSA-N 0 3 417.557 4.117 20 0 HIADHN Cc1cc(Br)ccc1CNC(=O)N(CCN(C)C)Cc1ccccc1 ZINC000477341476 892310971 /nfs/dbraw/zinc/31/09/71/892310971.db2.gz NZEINGDXGHKBPL-UHFFFAOYSA-N 0 3 404.352 4.031 20 0 HIADHN O=C(CCCc1nc(-c2ccc(F)cc2)no1)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000477436573 892388783 /nfs/dbraw/zinc/38/87/83/892388783.db2.gz MLGCGFLKTFLUJF-NRFANRHFSA-N 0 3 422.504 4.152 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)CCN1CCC[C@H]1c1ccc2c(c1)OCO2 ZINC000477464680 892435012 /nfs/dbraw/zinc/43/50/12/892435012.db2.gz NLOPTKXWLWIEDZ-KRWDZBQOSA-N 0 3 402.878 4.243 20 0 HIADHN CC(C)(C)[C@H](CN1CCc2ccccc2C1)NC(=O)c1ccncc1Br ZINC000477466399 892440428 /nfs/dbraw/zinc/44/04/28/892440428.db2.gz GQECGBYRFQMCOP-IBGZPJMESA-N 0 3 416.363 4.047 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cc(C)ccc3Br)c(C)c2)CC1 ZINC000477491512 892490352 /nfs/dbraw/zinc/49/03/52/892490352.db2.gz FOTUXUFRARNNBA-UHFFFAOYSA-N 0 3 416.363 4.460 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1ccc(OCC(F)(F)F)c(Cl)c1 ZINC000504950500 913688522 /nfs/dbraw/zinc/68/85/22/913688522.db2.gz SQNXBKKLTHUFEC-UHFFFAOYSA-N 0 3 419.831 4.470 20 0 HIADHN CC(C)(C)CCNC(=O)CNC1(c2ccc(OCc3ccccc3)cc2)CCOCC1 ZINC000477657454 892790672 /nfs/dbraw/zinc/79/06/72/892790672.db2.gz FLJVANTYFMWHMT-UHFFFAOYSA-N 0 3 424.585 4.413 20 0 HIADHN Cc1nc(-c2ccccc2)oc1C(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000477690248 892811872 /nfs/dbraw/zinc/81/18/72/892811872.db2.gz DGRCNEHXYZFOMP-UHFFFAOYSA-N 0 3 405.498 4.107 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1cc(Oc2ccccc2)ccn1 ZINC000477696557 892814616 /nfs/dbraw/zinc/81/46/16/892814616.db2.gz ODLUOUSOCOQHAN-UHFFFAOYSA-N 0 3 417.509 4.331 20 0 HIADHN Cc1cc(C(=O)Nc2cccc(CN3CCC(CO)CC3)c2)c2c(n1)onc2C(C)C ZINC000477700412 892815922 /nfs/dbraw/zinc/81/59/22/892815922.db2.gz JYOOGYFYFLGFRI-UHFFFAOYSA-N 0 3 422.529 4.111 20 0 HIADHN Cc1ccc(Br)c(C(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)c1 ZINC000477732863 892831934 /nfs/dbraw/zinc/83/19/34/892831934.db2.gz ZCDSVBANBXTDFP-IRXDYDNUSA-N 0 3 423.395 4.109 20 0 HIADHN CC(C)(C)[C@H](CN1CCc2ccccc2C1)NC(=O)Nc1nnc(C(F)F)s1 ZINC000477764860 892852657 /nfs/dbraw/zinc/85/26/57/892852657.db2.gz IAQOBRXFPNKGLH-AWEZNQCLSA-N 0 3 409.506 4.070 20 0 HIADHN CC(C)(C)[C@@H](CN1CCc2ccccc2C1)NC(=O)Nc1cnn(CC(F)(F)F)c1 ZINC000477775155 892859828 /nfs/dbraw/zinc/85/98/28/892859828.db2.gz GQCHNGQQINSPJK-GOSISDBHSA-N 0 3 423.483 4.040 20 0 HIADHN CC(C)(C)[C@@H](CN1CCc2ccccc2C1)NC(=O)Nc1ccc2c(c1)NC(=O)CC2 ZINC000477778454 892861932 /nfs/dbraw/zinc/86/19/32/892861932.db2.gz HCBXNOMSOIBUFY-JOCHJYFZSA-N 0 3 420.557 4.166 20 0 HIADHN C[S@@](=O)c1ccc(NC(=O)N[C@@H](CN2CCc3ccccc3C2)C(C)(C)C)cc1 ZINC000477779487 892863040 /nfs/dbraw/zinc/86/30/40/892863040.db2.gz NZSVAVVIURPBAP-KCWXNJEJSA-N 0 3 413.587 4.019 20 0 HIADHN O=C(NCc1ncoc1-c1ccccc1)NC[C@H]1CCCCN1Cc1ccccc1 ZINC000477836650 892897517 /nfs/dbraw/zinc/89/75/17/892897517.db2.gz XAJJBVWOLMGVHD-OAQYLSRUSA-N 0 3 404.514 4.196 20 0 HIADHN Cc1ccc([C@@H](NC[C@@](C)(O)C2CCCCC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000477844248 892901809 /nfs/dbraw/zinc/90/18/09/892901809.db2.gz CJLPTCJEWMMLGR-DNQXCXABSA-N 0 3 415.599 4.409 20 0 HIADHN C[C@H](NC(=O)N[C@H](CN(C)C)c1ccc(F)cc1)c1nc2ccccc2n1C(F)F ZINC000477849541 892911290 /nfs/dbraw/zinc/91/12/90/892911290.db2.gz TXFVDZGOGBMCSW-SUMWQHHRSA-N 0 3 419.451 4.234 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)NCCc2cccc3cccnc32)N(C)C)cc1 ZINC000477904186 892977005 /nfs/dbraw/zinc/97/70/05/892977005.db2.gz DLQYOUPMONRVSV-QHCPKHFHSA-N 0 3 420.557 4.167 20 0 HIADHN CC(C)c1ccc(NC(=O)C[C@H](C)N[C@H]2CCN(Cc3ccc(F)cc3)C2=O)cc1 ZINC000477920091 893006616 /nfs/dbraw/zinc/00/66/16/893006616.db2.gz UJDFNUPYLHZEJP-JTSKRJEESA-N 0 3 411.521 4.057 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)N[C@@H]1CCC[C@H]1c1ccccc1 ZINC000478021620 893141679 /nfs/dbraw/zinc/14/16/79/893141679.db2.gz OTOXHZKWWHJWIA-RBBKRZOGSA-N 0 3 401.501 4.374 20 0 HIADHN CCCN(C(=O)c1cnn(Cc2ccccc2)c1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000505011361 913754778 /nfs/dbraw/zinc/75/47/78/913754778.db2.gz UMZBTCUYHPCTHX-VWLOTQADSA-N 0 3 416.569 4.448 20 0 HIADHN CCCN(C(=O)c1cnn(Cc2ccccc2)c1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000505011360 913755330 /nfs/dbraw/zinc/75/53/30/913755330.db2.gz UMZBTCUYHPCTHX-RUZDIDTESA-N 0 3 416.569 4.448 20 0 HIADHN CCOc1c(Cl)cccc1CC(=O)NC[C@@H](c1ccc(OC)cc1)N1CCCC1 ZINC000478233990 893395777 /nfs/dbraw/zinc/39/57/77/893395777.db2.gz UFLGNIYETIIARA-NRFANRHFSA-N 0 3 416.949 4.243 20 0 HIADHN C[C@H](CC(=O)Nc1ccccc1)N[C@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O ZINC000478273732 893473279 /nfs/dbraw/zinc/47/32/79/893473279.db2.gz KSXAISKAZHJVSD-ACJLOTCBSA-N 0 3 406.313 4.106 20 0 HIADHN COc1cc(CN[C@@H](CC2CCC2)c2ccccc2)cc(Cl)c1OCC(N)=O ZINC000478299040 893516871 /nfs/dbraw/zinc/51/68/71/893516871.db2.gz NATSWOSBTPSSTI-IBGZPJMESA-N 0 3 402.922 4.234 20 0 HIADHN CN1C[C@@H](NC(=O)Cc2csc(-c3ccccc3Cl)n2)[C@@H](c2ccccc2)C1 ZINC000478370952 893633896 /nfs/dbraw/zinc/63/38/96/893633896.db2.gz MZHQSIRGROGKDS-UYAOXDASSA-N 0 3 411.958 4.220 20 0 HIADHN C[C@H](NC(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1)c1c(F)cccc1Cl ZINC000478378722 893646874 /nfs/dbraw/zinc/64/68/74/893646874.db2.gz HTFXQFUENMTUIN-XHSDSOJGSA-N 0 3 411.949 4.071 20 0 HIADHN O=C(N[C@H]1CCN(Cc2ccccc2)C1)N(CCC(F)(F)F)Cc1ccccc1 ZINC000478450021 893768054 /nfs/dbraw/zinc/76/80/54/893768054.db2.gz AOZBNOWWQBAUKT-FQEVSTJZSA-N 0 3 405.464 4.425 20 0 HIADHN CN(C)[C@H](CNC(=O)N(C)Cc1ccc(F)cc1Br)c1ccccc1 ZINC000478452142 893770319 /nfs/dbraw/zinc/77/03/19/893770319.db2.gz YQFQGGKJGJPLFU-GOSISDBHSA-N 0 3 408.315 4.033 20 0 HIADHN COc1cnccc1N1CCN(C(=O)CCCc2cc(Cl)sc2Cl)CC1 ZINC000478477718 893802698 /nfs/dbraw/zinc/80/26/98/893802698.db2.gz CNCMBYHKFMXJHM-UHFFFAOYSA-N 0 3 414.358 4.130 20 0 HIADHN CC1CCN(CCNC(=O)c2cn(Cc3ccccc3)nc2-c2ccccc2)CC1 ZINC000478561778 893849199 /nfs/dbraw/zinc/84/91/99/893849199.db2.gz NNGZLRIYZLXPMU-UHFFFAOYSA-N 0 3 402.542 4.060 20 0 HIADHN COc1ccc(-c2nc(C)c(C(=O)NC[C@@H](C)N3CCCC[C@H]3C)s2)cc1OC ZINC000478567014 893852189 /nfs/dbraw/zinc/85/21/89/893852189.db2.gz RFDUPIZONNIHMQ-HUUCEWRRSA-N 0 3 417.575 4.128 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)N[C@H](C)Cc2ccc(C(F)(F)F)cc2)o1 ZINC000478661527 893905980 /nfs/dbraw/zinc/90/59/80/893905980.db2.gz PEGJCCSQFYMFHT-OAHLLOKOSA-N 0 3 411.468 4.311 20 0 HIADHN COc1ccc([C@H](C)N(C)C(=O)[C@H]2CN(Cc3ccccc3)CCC2(F)F)cc1 ZINC000505120454 913827725 /nfs/dbraw/zinc/82/77/25/913827725.db2.gz OUKGINHMXOJJRG-LAUBAEHRSA-N 0 3 402.485 4.372 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2ccc(C)cc2Br)c1 ZINC000478775156 894050999 /nfs/dbraw/zinc/05/09/99/894050999.db2.gz UEEULPOZYYVXAI-UHFFFAOYSA-N 0 3 420.351 4.362 20 0 HIADHN C[C@H](NC(=O)NCc1cccc(OCC(F)(F)F)c1)[C@@H](c1ccccc1)N(C)C ZINC000478803898 894078651 /nfs/dbraw/zinc/07/86/51/894078651.db2.gz WJMDYZZYQZZBQV-KXBFYZLASA-N 0 3 409.452 4.118 20 0 HIADHN Cc1cc(O[C@H](C)C(=O)NCc2ccccc2CN2CCC(O)CC2)ccc1C(C)C ZINC000478860816 894140635 /nfs/dbraw/zinc/14/06/35/894140635.db2.gz FRZUAFGXXKFFAW-HXUWFJFHSA-N 0 3 424.585 4.159 20 0 HIADHN C[C@@H](Oc1cccc(C(C)(C)C)c1)C(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000478868586 894147897 /nfs/dbraw/zinc/14/78/97/894147897.db2.gz OXQRGKZMKINMRB-LJQANCHMSA-N 0 3 424.585 4.025 20 0 HIADHN CN(C)Cc1cccc(NC(=O)[C@@H]2CC(=O)N(C)[C@H]2c2ccc(Cl)c(Cl)c2)c1 ZINC000478904040 894184641 /nfs/dbraw/zinc/18/46/41/894184641.db2.gz SNFSWGZZANYGDL-UZLBHIALSA-N 0 3 420.340 4.213 20 0 HIADHN COc1ccccc1C[C@H]1CCCN1C(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000478920018 894200742 /nfs/dbraw/zinc/20/07/42/894200742.db2.gz CCIACOQRBHUOPQ-FYYLOGMGSA-N 0 3 410.533 4.280 20 0 HIADHN COCCSc1ccc([C@@H](C)N[C@@H](C)c2cc(S(N)(=O)=O)c(C)cc2C)cc1 ZINC000479060491 894319892 /nfs/dbraw/zinc/31/98/92/894319892.db2.gz AHPYSAJNMCLCRG-SJORKVTESA-N 0 3 422.616 4.101 20 0 HIADHN CCC[C@H](N[C@@H]1CCc2cc(OC)c(OC)cc21)C(=O)N1CCc2sccc2C1 ZINC000479065584 894329366 /nfs/dbraw/zinc/32/93/66/894329366.db2.gz UWXIWPSRVILZQD-MOPGFXCFSA-N 0 3 414.571 4.096 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)Nc1cccc2c1CN(c1ccccn1)C2 ZINC000479099133 894363585 /nfs/dbraw/zinc/36/35/85/894363585.db2.gz BWVGSVHEZLQVKF-UHFFFAOYSA-N 0 3 407.562 4.332 20 0 HIADHN O=C(NCc1csc(Br)c1)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000505181058 913866115 /nfs/dbraw/zinc/86/61/15/913866115.db2.gz XQYLVCKTMABCRC-INIZCTEOSA-N 0 3 408.365 4.147 20 0 HIADHN CC[C@@H](C)n1nc(C(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)cc1C ZINC000479184332 894452972 /nfs/dbraw/zinc/45/29/72/894452972.db2.gz IHDHCFDDPBIHJV-XLIONFOSSA-N 0 3 406.534 4.058 20 0 HIADHN C[C@H](NCCc1ccc(Cl)cc1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479330501 894624020 /nfs/dbraw/zinc/62/40/20/894624020.db2.gz YONPTUZRGQXQFT-JTQLQIEISA-N 0 3 407.750 4.188 20 0 HIADHN Cc1cc(C)c(S(N)(=O)=O)cc1[C@H](C)N[C@H](C)c1ccc(C(F)(F)F)cc1 ZINC000479332234 894625628 /nfs/dbraw/zinc/62/56/28/894625628.db2.gz SLOBOJMAZGVAFV-KGLIPLIRSA-N 0 3 400.466 4.381 20 0 HIADHN Cc1ccc(CCN[C@H](C)c2cc(S(N)(=O)=O)c(Cl)cc2Cl)c(C)c1 ZINC000479334326 894628065 /nfs/dbraw/zinc/62/80/65/894628065.db2.gz IHXQIXCCGCRYDK-CYBMUJFWSA-N 0 3 401.359 4.151 20 0 HIADHN COc1cc2c(cc1OC)[C@@H](NCc1cccc(NC(=O)c3ccncc3)c1)CC2 ZINC000479337688 894631865 /nfs/dbraw/zinc/63/18/65/894631865.db2.gz SJEQGEDNFKXUHN-NRFANRHFSA-N 0 3 403.482 4.128 20 0 HIADHN CCCOC[C@@H](Cc1cccc(Br)c1)NCc1cnc(N(C)C)s1 ZINC000479401353 894704713 /nfs/dbraw/zinc/70/47/13/894704713.db2.gz GDCIAGCMJADLIQ-MRXNPFEDSA-N 0 3 412.397 4.099 20 0 HIADHN C[C@@H](NCCC1CC(OC(C)(C)C)C1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479427882 894741291 /nfs/dbraw/zinc/74/12/91/894741291.db2.gz FRDARGSFZKLEOM-PNESKVBLSA-N 0 3 423.406 4.275 20 0 HIADHN C[C@H](NC1CCC2(CCOCC2)CC1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479428307 894741538 /nfs/dbraw/zinc/74/15/38/894741538.db2.gz ZJKZAYAFOAYOPJ-LBPRGKRZSA-N 0 3 421.390 4.031 20 0 HIADHN C[C@H](CCCC(F)(F)F)N[C@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479459511 894781575 /nfs/dbraw/zinc/78/15/75/894781575.db2.gz WQEWVJOYLBMMMX-RKDXNWHRSA-N 0 3 407.285 4.413 20 0 HIADHN COc1ccc(-c2ccncc2)cc1CNCCOc1ccc(C(F)(F)F)cn1 ZINC000479461971 894783842 /nfs/dbraw/zinc/78/38/42/894783842.db2.gz BGGDTGFQTUKEPE-UHFFFAOYSA-N 0 3 403.404 4.340 20 0 HIADHN Cc1cccc(CCN[C@H](c2ccc(Cl)cc2)c2cccc(S(C)(=O)=O)c2)n1 ZINC000479468395 894792233 /nfs/dbraw/zinc/79/22/33/894792233.db2.gz RZJOXQUWSJWOSY-JOCHJYFZSA-N 0 3 414.958 4.369 20 0 HIADHN CC(=O)N1CCC[C@H](CN[C@@H](c2ccccc2)c2ccccc2Br)C1 ZINC000479474484 894798546 /nfs/dbraw/zinc/79/85/46/894798546.db2.gz DFYKXHRKPBQIRA-UTKZUKDTSA-N 0 3 401.348 4.387 20 0 HIADHN C[C@H](N[C@@H](Cc1ccc(C(F)(F)F)cc1)C(N)=O)c1ccc(OC(F)(F)F)cc1 ZINC000479545010 894846408 /nfs/dbraw/zinc/84/64/08/894846408.db2.gz OCBRMAQYDVMVIC-ZBEGNZNMSA-N 0 3 420.353 4.351 20 0 HIADHN CCc1nc2c(s1)[C@@H](N(C)C(=O)NC[C@@H]1CCCN1Cc1ccccc1)CCC2 ZINC000479547170 894847730 /nfs/dbraw/zinc/84/77/30/894847730.db2.gz XWALPSCPQKXOSF-ICSRJNTNSA-N 0 3 412.603 4.389 20 0 HIADHN Cc1cc2[nH]c(CNCc3ccc(C(=O)N4C[C@@H](C)O[C@H](C)C4)cc3)cc2c(C)c1 ZINC000479560536 894857928 /nfs/dbraw/zinc/85/79/28/894857928.db2.gz AZWMWSKUWJOFSH-RTBURBONSA-N 0 3 405.542 4.324 20 0 HIADHN Cc1ccccc1[C@H](OC[C@H](O)CN(C)[C@H](CO)c1ccccc1)c1ccccc1 ZINC000479667625 894944943 /nfs/dbraw/zinc/94/49/43/894944943.db2.gz ROPCTOZSMDGGDZ-LGPLSSKUSA-N 0 3 405.538 4.127 20 0 HIADHN Cc1ccc([C@H](OC[C@@H](O)CN(C)[C@@H](CO)c2ccccc2)c2ccccc2)cc1 ZINC000479669659 894947560 /nfs/dbraw/zinc/94/75/60/894947560.db2.gz ZECIANGCQAQFGV-KKUQBAQOSA-N 0 3 405.538 4.127 20 0 HIADHN CC(C)[C@@](C)(NC(=O)N[C@@H](C)C1=CCN(C)CC1)c1ccc(Br)cc1 ZINC000479746879 895046105 /nfs/dbraw/zinc/04/61/05/895046105.db2.gz BVGXUJRFPPGGTB-MGPUTAFESA-N 0 3 408.384 4.270 20 0 HIADHN COC[C@H](NC[C@H](c1cccs1)N1CCOCC1)c1cccc(C(F)(F)F)c1 ZINC000479856244 895191850 /nfs/dbraw/zinc/19/18/50/895191850.db2.gz WDCKUCNZNUXBNJ-ZWKOTPCHSA-N 0 3 414.493 4.118 20 0 HIADHN Cc1nn(C)c(C)c1C[C@H](C)C(=O)N1CCN(Cc2ccccc2)C2(CCCCC2)C1 ZINC000479856451 895192016 /nfs/dbraw/zinc/19/20/16/895192016.db2.gz YDAZAJHZKMHZED-FQEVSTJZSA-N 0 3 422.617 4.263 20 0 HIADHN COc1cc(OC)c(OC)cc1CN[C@@H]1CCN(c2ccccc2C(F)(F)F)C1 ZINC000479869470 895210388 /nfs/dbraw/zinc/21/03/88/895210388.db2.gz YSPVZBRHUWXYRP-OAHLLOKOSA-N 0 3 410.436 4.100 20 0 HIADHN C[C@H](NC[C@H](c1cccs1)N1CCC(C)CC1)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000479872836 895214581 /nfs/dbraw/zinc/21/45/81/895214581.db2.gz KYVDBVIPUIBLMA-QFBILLFUSA-N 0 3 424.607 4.415 20 0 HIADHN CC(C)COC[C@H](NC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1)c1ccco1 ZINC000505292646 913950128 /nfs/dbraw/zinc/95/01/28/913950128.db2.gz XSGLLHSVSBHLAS-FPOVZHCZSA-N 0 3 402.510 4.161 20 0 HIADHN C[C@H](C(=O)NCc1ccccc1CN1CCC(O)CC1)c1ccc(Cl)c(Cl)c1 ZINC000479988380 895342584 /nfs/dbraw/zinc/34/25/84/895342584.db2.gz OVVDETBHEPNJPX-HNNXBMFYSA-N 0 3 421.368 4.370 20 0 HIADHN COc1cc(OC)c([C@@H](C)NC[C@H](c2ccc(F)cc2)N2CCOCC2)cc1Cl ZINC000480068945 895418217 /nfs/dbraw/zinc/41/82/17/895418217.db2.gz KSXHTRRSOGKIPN-FOIQADDNSA-N 0 3 422.928 4.220 20 0 HIADHN COc1cc(OC)c([C@@H](C)NC[C@@H](c2ccc(F)cc2)N2CCOCC2)cc1Cl ZINC000480068947 895418290 /nfs/dbraw/zinc/41/82/90/895418290.db2.gz KSXHTRRSOGKIPN-QRWLVFNGSA-N 0 3 422.928 4.220 20 0 HIADHN C[C@H](NCc1ccc(OC(F)F)cc1)c1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000480079777 895436331 /nfs/dbraw/zinc/43/63/31/895436331.db2.gz DPIOJRWLOPQREK-INIZCTEOSA-N 0 3 424.513 4.313 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)Nc1cc2c(cc1Cl)OCCO2 ZINC000480101938 895468652 /nfs/dbraw/zinc/46/86/52/895468652.db2.gz XRDLGTGULXZBQA-UHFFFAOYSA-N 0 3 424.328 4.360 20 0 HIADHN CC[C@H](c1ccccc1)[C@@H]1CCCN1CC(=O)Nc1cc(OC)c(OC)c(OC)c1 ZINC000480103138 895471098 /nfs/dbraw/zinc/47/10/98/895471098.db2.gz LOOPJUVRZNETLH-UXHICEINSA-N 0 3 412.530 4.309 20 0 HIADHN Cc1nn(-c2ccccc2)c2nc(-c3cccs3)cc(C(=O)N(C)CCN(C)C)c12 ZINC000480109855 895480305 /nfs/dbraw/zinc/48/03/05/895480305.db2.gz OZOFMPYOPFRDHI-UHFFFAOYSA-N 0 3 419.554 4.091 20 0 HIADHN Cc1cc(C)c(CCN[C@@H]2CCS(=O)(=O)c3ccc(Br)cc32)c(C)c1 ZINC000480160923 895547250 /nfs/dbraw/zinc/54/72/50/895547250.db2.gz DNRNDFSFEQAKKU-LJQANCHMSA-N 0 3 422.388 4.425 20 0 HIADHN CCC(CC)[C@@H](CCN[C@H]1CCS(=O)(=O)c2ccc(Br)cc21)OC ZINC000480167562 895558322 /nfs/dbraw/zinc/55/83/22/895558322.db2.gz DHRGECLWEWXRAY-DLBZAZTESA-N 0 3 418.397 4.099 20 0 HIADHN Cc1cc(C)cc(CCN[C@@H]2CCS(=O)(=O)c3ccc(Br)cc32)c1 ZINC000480173033 895565485 /nfs/dbraw/zinc/56/54/85/895565485.db2.gz XRFOWVFKKIQTBZ-GOSISDBHSA-N 0 3 408.361 4.117 20 0 HIADHN Cc1ccccc1C[C@@H](C)N[C@H]1CCS(=O)(=O)c2ccc(Br)cc21 ZINC000480190089 895587894 /nfs/dbraw/zinc/58/78/94/895587894.db2.gz CYHMTVDBIBBPLG-KDOFPFPSSA-N 0 3 408.361 4.197 20 0 HIADHN CCS[C@@H]1CCCC[C@@H]1N[C@H]1CCS(=O)(=O)c2ccc(Br)cc21 ZINC000480198222 895594905 /nfs/dbraw/zinc/59/49/05/895594905.db2.gz ONOHNRBPDUZDQC-HRCADAONSA-N 0 3 418.422 4.322 20 0 HIADHN CNS(=O)(=O)c1ccc([C@H](C)N[C@H](C)c2ccc(-c3csc(C)n3)cc2)cc1 ZINC000480235231 895640288 /nfs/dbraw/zinc/64/02/88/895640288.db2.gz YEFYRVOULOEFMK-CABCVRRESA-N 0 3 415.584 4.438 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1cc(C(C)(C)C)nn1-c1ccccn1)c1ccco1 ZINC000480237336 895645470 /nfs/dbraw/zinc/64/54/70/895645470.db2.gz PTUUIJWBXQVKGI-DLBZAZTESA-N 0 3 424.549 4.409 20 0 HIADHN O=S1(=O)CC[C@H](NCC2(c3ccc(F)cc3)CC2)c2cc(Br)ccc21 ZINC000480246425 895655922 /nfs/dbraw/zinc/65/59/22/895655922.db2.gz KOBNHOBSEMZFBM-KRWDZBQOSA-N 0 3 424.335 4.128 20 0 HIADHN C[C@H](NCc1ccc(Cn2cccn2)cc1)c1ccc(S(=O)(=O)C2CCCC2)cc1 ZINC000480256075 895666117 /nfs/dbraw/zinc/66/61/17/895666117.db2.gz ONDXYVJGNLBGHZ-IBGZPJMESA-N 0 3 423.582 4.499 20 0 HIADHN CCOCc1ccccc1CN[C@@H](C)c1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000480257159 895666155 /nfs/dbraw/zinc/66/61/55/895666155.db2.gz ZAXFPFAXQGHSGA-IBGZPJMESA-N 0 3 416.587 4.249 20 0 HIADHN Cc1cc(CN[C@H](C)c2ccc(S(=O)(=O)NCc3ccco3)cc2)ccc1F ZINC000480256970 895666849 /nfs/dbraw/zinc/66/68/49/895666849.db2.gz FBDCUGQUMJFRJI-MRXNPFEDSA-N 0 3 402.491 4.056 20 0 HIADHN COCCC[C@@H](NCc1cccc(C(=O)N(C)C)c1)c1ccc(Br)cc1 ZINC000480278415 895684807 /nfs/dbraw/zinc/68/48/07/895684807.db2.gz MWQLOJJNKJHOSP-HXUWFJFHSA-N 0 3 419.363 4.408 20 0 HIADHN CC(C)N(C)c1ccc(CN[C@@H](C)c2ccc(NC(=O)c3ccncc3)cc2)cn1 ZINC000480363720 895771126 /nfs/dbraw/zinc/77/11/26/895771126.db2.gz LAKGYZAESNNANR-SFHVURJKSA-N 0 3 403.530 4.424 20 0 HIADHN COc1cc([C@@H](C)N[C@H](CN2CCOCC2)c2ccc(C)cc2)ccc1OC(F)F ZINC000480453668 895840867 /nfs/dbraw/zinc/84/08/67/895840867.db2.gz FDFCKZJUGUESEB-YLJYHZDGSA-N 0 3 420.500 4.329 20 0 HIADHN COC(=O)c1csc(-c2cccc(CNCc3cnc4ccc(Cl)cn34)c2)n1 ZINC000480473630 895854352 /nfs/dbraw/zinc/85/43/52/895854352.db2.gz XUYJCSJRFFIXMT-UHFFFAOYSA-N 0 3 412.902 4.188 20 0 HIADHN CCOc1cc2c(cc1OCC)CN(CC1CCN(C(=O)C(C)(C)C)CC1)CC2 ZINC000480531775 895894679 /nfs/dbraw/zinc/89/46/79/895894679.db2.gz YHLSZYQNFCLXAR-UHFFFAOYSA-N 0 3 402.579 4.127 20 0 HIADHN CC(C)c1noc(-c2ccnc(NC3CC(N4CCC(C(F)(F)F)CC4)C3)c2)n1 ZINC000480547630 895909400 /nfs/dbraw/zinc/90/94/00/895909400.db2.gz ABTROZWDFMRUEZ-UHFFFAOYSA-N 0 3 409.456 4.472 20 0 HIADHN C[C@@H](NCc1ccc(C(=O)N2CCN(C)CC2)cc1)c1ccc(Cl)c(Cl)c1 ZINC000480613791 895980569 /nfs/dbraw/zinc/98/05/69/895980569.db2.gz MSQZBJIMYAMDFL-OAHLLOKOSA-N 0 3 406.357 4.232 20 0 HIADHN COc1cc([C@H](C)N[C@@H](C)c2ccc(NC(=O)NC3CC3)cc2)cc(OC)c1OC ZINC000480616853 895984206 /nfs/dbraw/zinc/98/42/06/895984206.db2.gz WJBQWVPEYJSQLN-GJZGRUSLSA-N 0 3 413.518 4.408 20 0 HIADHN COc1cc([C@@H](C)N[C@@H](C)c2ccc(NC(=O)NC3CC3)cc2)cc(OC)c1OC ZINC000480616855 895984810 /nfs/dbraw/zinc/98/48/10/895984810.db2.gz WJBQWVPEYJSQLN-LSDHHAIUSA-N 0 3 413.518 4.408 20 0 HIADHN CC[C@H](NCc1ccc(N2CCO[C@@H](C)C2)nc1)c1cccc(Br)c1 ZINC000480619716 895987473 /nfs/dbraw/zinc/98/74/73/895987473.db2.gz XTORBYNMBRVTHI-KXBFYZLASA-N 0 3 404.352 4.310 20 0 HIADHN Cc1nc(-c2ccc(F)c(F)c2)sc1C(=O)N1CCC[C@H]1CN1CCCCC1 ZINC000480624871 895992619 /nfs/dbraw/zinc/99/26/19/895992619.db2.gz IVWHTQOIYSVVBM-INIZCTEOSA-N 0 3 405.514 4.487 20 0 HIADHN CN(C)C[C@H](NC(=O)Nc1ccc2nc(-c3ccccn3)oc2c1)c1ccc(F)cc1 ZINC000480639847 896008476 /nfs/dbraw/zinc/00/84/76/896008476.db2.gz AJWYEWVYNQBIOD-FQEVSTJZSA-N 0 3 419.460 4.453 20 0 HIADHN Cc1cc(NC(=O)N(C)CCCN(C)Cc2ccco2)cnc1N1CCCC[C@@H]1C ZINC000480656151 896023794 /nfs/dbraw/zinc/02/37/94/896023794.db2.gz WBIOXOQOMMLZFW-IBGZPJMESA-N 0 3 413.566 4.348 20 0 HIADHN CC(C)Cc1ccc(CCC(=O)NCc2ccccc2CN2CCC(O)CC2)cc1 ZINC000505363534 914027678 /nfs/dbraw/zinc/02/76/78/914027678.db2.gz CSHXSGITTBYLRW-UHFFFAOYSA-N 0 3 408.586 4.091 20 0 HIADHN CCCNC(=O)[C@H]1CCCN(Cc2cc(-c3c(OC)ccc4ccccc43)no2)C1 ZINC000480678262 896041484 /nfs/dbraw/zinc/04/14/84/896041484.db2.gz JWQLOYILPDMSFX-SFHVURJKSA-N 0 3 407.514 4.242 20 0 HIADHN C[C@H](NCc1ccc(N2CCCS2(=O)=O)c(F)c1)c1cccc(C(F)(F)F)c1 ZINC000480690541 896052653 /nfs/dbraw/zinc/05/26/53/896052653.db2.gz ANPZVHYEDKKGSP-ZDUSSCGKSA-N 0 3 416.440 4.235 20 0 HIADHN C[C@@H](NCc1cccc(N2CCOCC2)n1)[C@H](C)Oc1ccc(Cl)cc1Cl ZINC000480695012 896058037 /nfs/dbraw/zinc/05/80/37/896058037.db2.gz COJANORULODTMA-CABCVRRESA-N 0 3 410.345 4.171 20 0 HIADHN Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)NCc1ccnc(N2CCN(C)CC2)c1 ZINC000480709817 896072185 /nfs/dbraw/zinc/07/21/85/896072185.db2.gz NQLHRWQWWDRMDR-GOSISDBHSA-N 0 3 421.614 4.425 20 0 HIADHN CCN1CCN(Cc2ccc(CNC(=O)C(C)(C)c3ccc(Cl)cc3)cc2)CC1 ZINC000480741721 896103413 /nfs/dbraw/zinc/10/34/13/896103413.db2.gz NXHOTCVVUXKRTR-UHFFFAOYSA-N 0 3 413.993 4.072 20 0 HIADHN CCNC(=O)COc1ccc(CN[C@H](C)c2sc(C(C)(C)C)nc2C)cc1OC ZINC000480743357 896105346 /nfs/dbraw/zinc/10/53/46/896105346.db2.gz ZOWOCINEINZIRW-CQSZACIVSA-N 0 3 419.591 4.123 20 0 HIADHN CCCNC(=O)CN1CCC(N[C@H](C)c2ccc(Cl)c(Cl)c2Cl)CC1 ZINC000480765519 896128698 /nfs/dbraw/zinc/12/86/98/896128698.db2.gz AGUIGYIWVJFYMT-GFCCVEGCSA-N 0 3 406.785 4.288 20 0 HIADHN CCS(=O)(=O)Nc1ccc([C@H](C)NCc2ccnc(OC3CCCC3)c2)cc1 ZINC000480768826 896131124 /nfs/dbraw/zinc/13/11/24/896131124.db2.gz OAIOUHNIYQEPDI-INIZCTEOSA-N 0 3 403.548 4.015 20 0 HIADHN COCCOc1ccc(CN[C@H](C)c2ccc(I)cc2)cc1 ZINC000480773416 896138826 /nfs/dbraw/zinc/13/88/26/896138826.db2.gz YXMMJPCESRZASF-CQSZACIVSA-N 0 3 411.283 4.167 20 0 HIADHN COC(=O)c1ccccc1CCN1CCC([C@H]2C(=O)Nc3cc(Cl)ccc32)CC1 ZINC000480784311 896150744 /nfs/dbraw/zinc/15/07/44/896150744.db2.gz BRLSSEQQQSANQM-OAQYLSRUSA-N 0 3 412.917 4.117 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N2CCC[C@@H]2c2ccc3c(c2)OCO3)N2CCCC2)cc1 ZINC000480797266 896164561 /nfs/dbraw/zinc/16/45/61/896164561.db2.gz ZVQQTNOPKIYJSL-YADHBBJMSA-N 0 3 421.541 4.407 20 0 HIADHN COc1cc(CN[C@H]2C[C@H](C)c3c2cccc3Br)ccc1OCCO ZINC000480887193 896243737 /nfs/dbraw/zinc/24/37/37/896243737.db2.gz DGGJLEJFUOLXNT-GUYCJALGSA-N 0 3 406.320 4.167 20 0 HIADHN C[C@@H](NCc1cccc(NC(=O)c2ccncc2)c1)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000480894670 896252261 /nfs/dbraw/zinc/25/22/61/896252261.db2.gz GINMTLHRUASNLA-MRXNPFEDSA-N 0 3 414.509 4.414 20 0 HIADHN C[C@@H](NCc1cccc(NC(=O)C2CCCC2)c1)c1ccc(NS(C)(=O)=O)cc1 ZINC000480908808 896264453 /nfs/dbraw/zinc/26/44/53/896264453.db2.gz MGNVMOIDVUNJRL-MRXNPFEDSA-N 0 3 415.559 4.038 20 0 HIADHN COc1cccc([C@H](C)N[C@H](C)c2ccc(S(=O)(=O)N3CCCCC3)cc2)c1 ZINC000480909017 896266686 /nfs/dbraw/zinc/26/66/86/896266686.db2.gz GVHIGWIXGLAGIN-MSOLQXFVSA-N 0 3 402.560 4.282 20 0 HIADHN C[C@@H]1CC[C@@H](NCc2cccc(NC(=O)CCN3CCOCC3)c2)c2ccccc21 ZINC000480912374 896270168 /nfs/dbraw/zinc/27/01/68/896270168.db2.gz MWPGFEBZXYXSPU-NTKDMRAZSA-N 0 3 407.558 4.076 20 0 HIADHN COc1cccc([C@@H](C)N[C@@H](C)c2ccc(S(=O)(=O)NCc3ccco3)cc2)c1 ZINC000480917098 896275774 /nfs/dbraw/zinc/27/57/74/896275774.db2.gz XOOFGSUGZZLFNB-DLBZAZTESA-N 0 3 414.527 4.179 20 0 HIADHN C[C@H](NC(C)(C)CNS(=O)(=O)c1ccc(CC(F)(F)F)cc1)c1ccccc1 ZINC000481055763 896378101 /nfs/dbraw/zinc/37/81/01/896378101.db2.gz TWTJLGKUJUDMDX-HNNXBMFYSA-N 0 3 414.493 4.199 20 0 HIADHN CC[C@@H](c1cccc(OC)c1)N(C)C(=O)NCC1(N2CCSCC2)CCCC1 ZINC000481084703 896404534 /nfs/dbraw/zinc/40/45/34/896404534.db2.gz ZLEUYDUOLWGHHK-FQEVSTJZSA-N 0 3 405.608 4.149 20 0 HIADHN COc1ccc([C@@H](C)NC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)c(C)c1OC ZINC000481124753 896452478 /nfs/dbraw/zinc/45/24/78/896452478.db2.gz ZGTKCSXHRRJOBZ-UYAOXDASSA-N 0 3 411.546 4.037 20 0 HIADHN C[C@@H](Cc1ccc(F)c(Br)c1)NC(=O)Nc1cccc(CN(C)C)c1 ZINC000481153642 896485348 /nfs/dbraw/zinc/48/53/48/896485348.db2.gz JOQWIFPDNMDLAS-ZDUSSCGKSA-N 0 3 408.315 4.403 20 0 HIADHN Cc1c([C@@H](C)NCC2(c3ccc(F)cc3)CCOCC2)nnn1-c1ccc(C)cc1 ZINC000481165865 896499140 /nfs/dbraw/zinc/49/91/40/896499140.db2.gz AUNGCKKZDLGEOP-GOSISDBHSA-N 0 3 408.521 4.422 20 0 HIADHN CNS(=O)(=O)c1ccc([C@H](C)N[C@H]2C[C@@H](C)c3c2cccc3Br)cc1 ZINC000481176991 896511332 /nfs/dbraw/zinc/51/13/32/896511332.db2.gz PIYZYWLFBHSQQK-VBHSOAQHSA-N 0 3 423.376 4.256 20 0 HIADHN CNS(=O)(=O)c1ccc([C@@H](C)N[C@H](C)c2csc(-c3csc(C)n3)c2)cc1 ZINC000481180358 896516757 /nfs/dbraw/zinc/51/67/57/896516757.db2.gz XHYTWFUOIWRVHI-CHWSQXEVSA-N 0 3 421.613 4.500 20 0 HIADHN COc1cc([C@@H](C)N[C@H]2CCc3ccc(OC(F)(F)F)cc32)ccc1OCCO ZINC000481180471 896517587 /nfs/dbraw/zinc/51/75/87/896517587.db2.gz MFNNQJUZAMZAQX-ACJLOTCBSA-N 0 3 411.420 4.303 20 0 HIADHN CNS(=O)(=O)c1ccc([C@@H](C)N[C@@H](C)c2csc(-c3csc(C)n3)c2)cc1 ZINC000481180359 896518339 /nfs/dbraw/zinc/51/83/39/896518339.db2.gz XHYTWFUOIWRVHI-OLZOCXBDSA-N 0 3 421.613 4.500 20 0 HIADHN CC[C@H](N[C@@H](C)c1ccc(S(=O)(=O)NC)cc1)c1cccc(Br)c1 ZINC000481181324 896521069 /nfs/dbraw/zinc/52/10/69/896521069.db2.gz ZBXVTZZSJUPSKD-UGSOOPFHSA-N 0 3 411.365 4.159 20 0 HIADHN Fc1cc(Br)cc2c1CC[C@H]2NCc1ccccc1N1CCOCC1 ZINC000481190714 896542063 /nfs/dbraw/zinc/54/20/63/896542063.db2.gz LRIXAFCDEUJRDN-LJQANCHMSA-N 0 3 405.311 4.202 20 0 HIADHN COc1cc([C@H](C)N[C@@H](C)c2ccc(F)c(Br)c2)ccc1OCCO ZINC000481195914 896549042 /nfs/dbraw/zinc/54/90/42/896549042.db2.gz YJRBSZCXSPJCGU-STQMWFEESA-N 0 3 412.299 4.380 20 0 HIADHN C[C@H](NCc1ccccc1OCCN1CCOCC1)c1cccc(-c2ccncc2)c1 ZINC000481199939 896552594 /nfs/dbraw/zinc/55/25/94/896552594.db2.gz GLRIWQKYQIMQMT-NRFANRHFSA-N 0 3 417.553 4.310 20 0 HIADHN Cc1ccc(OCCCC(=O)N(C)C2CCN(CCc3ccccn3)CC2)c(C)c1 ZINC000481227872 896579723 /nfs/dbraw/zinc/57/97/23/896579723.db2.gz BONWSXSYCCFTNX-UHFFFAOYSA-N 0 3 409.574 4.023 20 0 HIADHN C[C@H]1CCCN(S(=O)(=O)c2ccc(CN[C@@H]3CCCc4sccc43)cc2)C1 ZINC000481302010 896647418 /nfs/dbraw/zinc/64/74/18/896647418.db2.gz BQXXDJXBXZAFEQ-OXJNMPFZSA-N 0 3 404.601 4.336 20 0 HIADHN CCOc1ccccc1Oc1ccc(CN[C@@H](C)c2ccc(-n3cnnn3)cc2)cn1 ZINC000481308774 896654578 /nfs/dbraw/zinc/65/45/78/896654578.db2.gz BOQWXEOWVHOHAA-KRWDZBQOSA-N 0 3 416.485 4.099 20 0 HIADHN Cc1c([C@@H](C)NC2CCN(Cc3ccc(F)c(F)c3)CC2)nnn1-c1ccccc1 ZINC000481308747 896655139 /nfs/dbraw/zinc/65/51/39/896655139.db2.gz QFTIYOJSQNBZFZ-MRXNPFEDSA-N 0 3 411.500 4.169 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N[C@@H](c1ccc(OC)cc1)C(F)(F)F)c1ccco1 ZINC000481316807 896666718 /nfs/dbraw/zinc/66/67/18/896666718.db2.gz LBTVZOWFJGMOOM-OWQGQXMQSA-N 0 3 413.440 4.320 20 0 HIADHN C[C@H](NC1CCN(Cc2ccncc2)CC1)c1ccccc1I ZINC000481318510 896670522 /nfs/dbraw/zinc/67/05/22/896670522.db2.gz VTUFNXPYPHLEOM-HNNXBMFYSA-N 0 3 421.326 4.001 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)N[C@@H](C3CCCC3)C(F)(F)F)CC2)C[C@H](C)O1 ZINC000481388712 896791056 /nfs/dbraw/zinc/79/10/56/896791056.db2.gz SIKCUYSAOCWGSL-FCEWJHQRSA-N 0 3 419.532 4.028 20 0 HIADHN C[C@H]1C[C@@H](NCc2cccc(OCCN3CCOCC3)c2)c2ccsc2S1 ZINC000481404185 896810519 /nfs/dbraw/zinc/81/05/19/896810519.db2.gz MQVYSDYGKOKRHK-OXJNMPFZSA-N 0 3 404.601 4.174 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)Nc1cnn(-c2ccc(Cl)cc2)c1)c1ccco1 ZINC000481431099 896832172 /nfs/dbraw/zinc/83/21/72/896832172.db2.gz ZWMHJGZUOGDZFQ-KDOFPFPSSA-N 0 3 401.898 4.370 20 0 HIADHN COc1cc(Br)cc(C)c1NC(=O)N1CCN(C2CCCCC2)CC1 ZINC000481473874 896861628 /nfs/dbraw/zinc/86/16/28/896861628.db2.gz GTXLWMQBMSREPR-UHFFFAOYSA-N 0 3 410.356 4.248 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1nnc(-c2ccc(OC)cc2)s1)c1ccco1 ZINC000481486667 896868171 /nfs/dbraw/zinc/86/81/71/896868171.db2.gz RJNFYCVLPCRBHU-BBRMVZONSA-N 0 3 415.519 4.058 20 0 HIADHN CC(C)C[C@H](C)n1nccc1NC(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000481489526 896870118 /nfs/dbraw/zinc/87/01/18/896870118.db2.gz HTYNDKJGDCRNPE-XUVXKRRUSA-N 0 3 419.614 4.233 20 0 HIADHN Cc1c([C@H](C)NCc2cccc(CN3CCO[C@@H](C)C3)c2)cnn1-c1ccc(F)cc1 ZINC000481534702 896895599 /nfs/dbraw/zinc/89/55/99/896895599.db2.gz OJJPUSLKZGWGIZ-OALUTQOASA-N 0 3 422.548 4.391 20 0 HIADHN CCOc1ccc(C2(CN[C@@H](C)c3nnn(-c4ccccc4)c3C)CCOCC2)cc1 ZINC000481545222 896906585 /nfs/dbraw/zinc/90/65/85/896906585.db2.gz NOOLELLZMGBJJJ-IBGZPJMESA-N 0 3 420.557 4.373 20 0 HIADHN COc1cc(OC)c([C@@H](C)NCc2cccc(CN3CCO[C@@H](C)C3)c2)cc1Cl ZINC000481560372 896932278 /nfs/dbraw/zinc/93/22/78/896932278.db2.gz UZJYNOXGYKKWGN-DLBZAZTESA-N 0 3 418.965 4.429 20 0 HIADHN CC[C@H](NCc1cccc(C(=O)NC[C@@H]2CCCO2)c1)c1ccc(OC(F)F)cc1 ZINC000481562046 896937740 /nfs/dbraw/zinc/93/77/40/896937740.db2.gz KZWZJWSKELNUIG-SFTDATJTSA-N 0 3 418.484 4.438 20 0 HIADHN COc1cc([C@H](C)NCc2cccc(CN3CCO[C@@H](C)C3)c2)ccc1OC(F)F ZINC000481585339 896964477 /nfs/dbraw/zinc/96/44/77/896964477.db2.gz VAZQRMXFEDIFLZ-IRXDYDNUSA-N 0 3 420.500 4.368 20 0 HIADHN COc1cccc(F)c1NC(=O)N(CCN(C)C)Cc1ccc(C(F)(F)F)cc1 ZINC000481629490 897014586 /nfs/dbraw/zinc/01/45/86/897014586.db2.gz IRKVDOSQVDBUHH-UHFFFAOYSA-N 0 3 413.415 4.449 20 0 HIADHN Cc1cc(NC(=O)Cc2ccccc2OC(F)F)cc(N2CCN(C(C)C)CC2)c1 ZINC000481643024 897027977 /nfs/dbraw/zinc/02/79/77/897027977.db2.gz QGGSAIXFEZYEDM-UHFFFAOYSA-N 0 3 417.500 4.308 20 0 HIADHN COc1cccc2[nH]cc(CC(=O)Nc3cc(C)cc(N4CCN(C(C)C)CC4)c3)c21 ZINC000481646564 897031852 /nfs/dbraw/zinc/03/18/52/897031852.db2.gz QPCZGGIFGIDTKM-UHFFFAOYSA-N 0 3 420.557 4.197 20 0 HIADHN Cc1cc(NC(=O)C[C@H]2CCO[C@@H](C(C)C)C2)cc(N2CCN(C(C)C)CC2)c1 ZINC000481663123 897047040 /nfs/dbraw/zinc/04/70/40/897047040.db2.gz NUCJVTFIFJFEOO-NZQKXSOJSA-N 0 3 401.595 4.305 20 0 HIADHN CC1(C)CC[C@@H](NCc2cccc(OCC(N)=O)c2)c2cc(Br)ccc21 ZINC000481666475 897049661 /nfs/dbraw/zinc/04/96/61/897049661.db2.gz FMWSCLIJTQXSBP-LJQANCHMSA-N 0 3 417.347 4.216 20 0 HIADHN Cc1cc(NC(=O)c2ccc(Br)o2)cc(N2CCN(C(C)C)CC2)c1 ZINC000481671775 897055815 /nfs/dbraw/zinc/05/58/15/897055815.db2.gz QLSPLPMVNMERQN-UHFFFAOYSA-N 0 3 406.324 4.133 20 0 HIADHN Cc1cc(NC(=O)c2cnc([C@H]3CCCO3)s2)cc(N2CCN(C(C)C)CC2)c1 ZINC000481673009 897056806 /nfs/dbraw/zinc/05/68/06/897056806.db2.gz SNCQCMYZOOHZDH-LJQANCHMSA-N 0 3 414.575 4.086 20 0 HIADHN Cc1cc(NC(=O)c2cnc([C@@H]3CCCO3)s2)cc(N2CCN(C(C)C)CC2)c1 ZINC000481673008 897057493 /nfs/dbraw/zinc/05/74/93/897057493.db2.gz SNCQCMYZOOHZDH-IBGZPJMESA-N 0 3 414.575 4.086 20 0 HIADHN CCC(CC)[C@H]1C[C@@H](NC(=O)Nc2ccc(N3CCN(CC)CC3)cc2C)CCO1 ZINC000481672992 897057531 /nfs/dbraw/zinc/05/75/31/897057531.db2.gz PPZKHXIZGCQJPF-NZQKXSOJSA-N 0 3 416.610 4.242 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)Nc1ccc2c(c1)CCC(=O)N2CC1CC1 ZINC000481714223 897106299 /nfs/dbraw/zinc/10/62/99/897106299.db2.gz NJLMWWZNSIXEQG-UHFFFAOYSA-N 0 3 412.578 4.106 20 0 HIADHN CC(C)C[C@@H]1OCCC[C@@H]1NCC(=O)N1N=C(c2cccs2)C[C@H]1c1ccco1 ZINC000481721250 897116198 /nfs/dbraw/zinc/11/61/98/897116198.db2.gz HKPGOHWICMOAJC-QRFRQXIXSA-N 0 3 415.559 4.202 20 0 HIADHN Cc1cc(Br)cc(C)c1CN[C@@H](C)c1cccc(NS(C)(=O)=O)c1 ZINC000481727588 897122101 /nfs/dbraw/zinc/12/21/01/897122101.db2.gz QWRBFIOFOILHIY-AWEZNQCLSA-N 0 3 411.365 4.288 20 0 HIADHN CC[C@@H](CN(CC)[C@@H](C)C(=O)NCC(=O)Nc1c(C)cccc1C)c1ccccc1 ZINC000481734892 897129423 /nfs/dbraw/zinc/12/94/23/897129423.db2.gz LUISRQTXCQABHD-SFTDATJTSA-N 0 3 409.574 4.262 20 0 HIADHN Cc1nc(-c2ccc(C)cc2)c(CC(=O)N[C@@H]2CN(C)C[C@@H]2c2ccccc2)s1 ZINC000481739307 897133592 /nfs/dbraw/zinc/13/35/92/897133592.db2.gz HQUUEJOPLLWGLU-NHCUHLMSSA-N 0 3 405.567 4.183 20 0 HIADHN C[C@H](NC(=O)Nc1ccc2c(c1)CCC(=O)N2CC1CC1)[C@H](c1ccccc1)N(C)C ZINC000481755814 897146331 /nfs/dbraw/zinc/14/63/31/897146331.db2.gz PQGFPLPYSCFLNJ-BXKMTCNYSA-N 0 3 420.557 4.189 20 0 HIADHN OC[C@@H](CNCc1c(Cl)cccc1OCc1ccccc1Cl)[C@H]1CCOC1 ZINC000481815886 897190014 /nfs/dbraw/zinc/19/00/14/897190014.db2.gz PWDIZMFUWSRMIS-DOTOQJQBSA-N 0 3 410.341 4.307 20 0 HIADHN Brc1ccccc1CCCN1CCC(c2nnc3n2CCCC3)CC1 ZINC000481825557 897197045 /nfs/dbraw/zinc/19/70/45/897197045.db2.gz RNUNOXDULTUMAB-UHFFFAOYSA-N 0 3 403.368 4.189 20 0 HIADHN COC(=O)c1ccccc1-c1ccc(CN2CCC(C(=O)N3CCC[C@@H](C)C3)CC2)o1 ZINC000481913694 897295551 /nfs/dbraw/zinc/29/55/51/897295551.db2.gz HBDHNYXNENKJIB-GOSISDBHSA-N 0 3 424.541 4.204 20 0 HIADHN CC(C)C[C@@H](N[C@H](C)Cc1ccccc1C(F)(F)F)c1nc(-c2nc[nH]n2)no1 ZINC000481982366 897376253 /nfs/dbraw/zinc/37/62/53/897376253.db2.gz FPAIEDHFHOYQQC-IUODEOHRSA-N 0 3 408.428 4.182 20 0 HIADHN CC[C@H](NCc1c(C)c2ccccc2n1C)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000482003030 897399246 /nfs/dbraw/zinc/39/92/46/897399246.db2.gz RJKGIIRGRZQKTC-SFHVURJKSA-N 0 3 419.978 4.289 20 0 HIADHN CC(=O)c1cccc(O[C@H](C)C(=O)Nc2cc(C)cc(N3CCN(C(C)C)CC3)c2)c1 ZINC000482026043 897432570 /nfs/dbraw/zinc/43/25/70/897432570.db2.gz MFRWSJQXXYHPCX-HXUWFJFHSA-N 0 3 423.557 4.134 20 0 HIADHN Cn1c2ccccc2nc1[C@@H](NC1CCN(Cc2cccnc2)CC1)c1ccccc1 ZINC000482037125 897453162 /nfs/dbraw/zinc/45/31/62/897453162.db2.gz WMXHWXGGROHPKL-VWLOTQADSA-N 0 3 411.553 4.312 20 0 HIADHN CCC[C@@H](N[C@H](C)c1ccc2c(c1)OCO2)C(=O)Nc1cccc(N2CCCC2)c1 ZINC000482047954 897471081 /nfs/dbraw/zinc/47/10/81/897471081.db2.gz WEGXYZQUIHTZHY-DYESRHJHSA-N 0 3 409.530 4.474 20 0 HIADHN COc1ccc([C@H](C)N[C@@H](C)CC(=O)Nc2cccc(N3CCCC3)c2)c(OC)c1 ZINC000482100170 897546851 /nfs/dbraw/zinc/54/68/51/897546851.db2.gz NSMDKBWFNJHSSZ-ROUUACIJSA-N 0 3 411.546 4.372 20 0 HIADHN CCO[C@@H]1C[C@@H](NCC(=O)Nc2cc3c(cc2Cl)OCCCO3)C1(CC)CC ZINC000482144724 897605813 /nfs/dbraw/zinc/60/58/13/897605813.db2.gz BKURJUYEQHRLCP-RTBURBONSA-N 0 3 410.942 4.013 20 0 HIADHN CCC[C@@H](N[C@H]1CCCc2nc(CC)sc21)C(=O)N1CCc2sccc2C1 ZINC000482239546 897721605 /nfs/dbraw/zinc/72/16/05/897721605.db2.gz BGGWNUGUPBJMOQ-DOTOQJQBSA-N 0 3 403.617 4.488 20 0 HIADHN Cc1nc2n(n1)C[C@@H](N[C@@H](C)c1cnn(-c3ccc(Cl)cc3Cl)c1C)CC2 ZINC000482244653 897726202 /nfs/dbraw/zinc/72/62/02/897726202.db2.gz QDEWLQXWFFOPQU-NHYWBVRUSA-N 0 3 405.333 4.053 20 0 HIADHN COC(=O)c1ccc(Cl)c(CNCc2ccccc2CN2C[C@@H](C)O[C@@H](C)C2)c1 ZINC000482247859 897729633 /nfs/dbraw/zinc/72/96/33/897729633.db2.gz VQBZWFKCFVZMLV-CALCHBBNSA-N 0 3 416.949 4.026 20 0 HIADHN Cc1nn(CC(=O)OC(C)C)c(C)c1CN(CC(C)C)[C@H]1CCCc2cccnc21 ZINC000482284427 897778543 /nfs/dbraw/zinc/77/85/43/897778543.db2.gz BDIVECNFJLXDRK-QFIPXVFZSA-N 0 3 412.578 4.382 20 0 HIADHN CN(C)CCN(C[C@H]1CCCO1)C(=O)N[C@@H](c1cccc2ccccc21)C(F)(F)F ZINC000482401973 897941693 /nfs/dbraw/zinc/94/16/93/897941693.db2.gz GMNMPMFTORZVTN-XLIONFOSSA-N 0 3 423.479 4.195 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)Nc1cccc2c1CN(CC(F)(F)F)C2)c1ccco1 ZINC000482422284 897973433 /nfs/dbraw/zinc/97/34/33/897973433.db2.gz NCEOIKKCXCNGQG-KDOFPFPSSA-N 0 3 424.467 4.408 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)Nc1cccc2c1CN(CC(F)(F)F)C2)c1ccco1 ZINC000482422286 897974274 /nfs/dbraw/zinc/97/42/74/897974274.db2.gz NCEOIKKCXCNGQG-RDTXWAMCSA-N 0 3 424.467 4.408 20 0 HIADHN CN(C)CCN(C(=O)N[C@H](c1ccc(OC(F)F)cc1)C(F)(F)F)C1CCCC1 ZINC000482452555 898019554 /nfs/dbraw/zinc/01/95/54/898019554.db2.gz VRRLUKATMNASDK-MRXNPFEDSA-N 0 3 423.426 4.407 20 0 HIADHN CC1(C)CN(Cc2ccc(-n3ccc(C(F)(F)F)n3)cc2)C[C@]2(CCCOC2)O1 ZINC000482455684 898025221 /nfs/dbraw/zinc/02/52/21/898025221.db2.gz QNBGNYOHIHBSDZ-FQEVSTJZSA-N 0 3 409.452 4.051 20 0 HIADHN CCc1cccc(CC(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000505522398 914214447 /nfs/dbraw/zinc/21/44/47/914214447.db2.gz CNSYRJUKRIQFJJ-QHCPKHFHSA-N 0 3 402.542 4.382 20 0 HIADHN Cc1cc(C)n(-c2ccc(C(=O)N[C@H]3CCN([C@@H](C)c4ccccc4)C3)cc2F)n1 ZINC000482476481 898054539 /nfs/dbraw/zinc/05/45/39/898054539.db2.gz INFMTTNPCDTMFB-RXVVDRJESA-N 0 3 406.505 4.194 20 0 HIADHN Cc1c(C(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)cnn1-c1ccccc1Cl ZINC000482486519 898067316 /nfs/dbraw/zinc/06/73/16/898067316.db2.gz VXUPJZGFQOKSAX-LPHOPBHVSA-N 0 3 408.933 4.399 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)Nc2ccc3nnc(C(C)C)n3c2)N(C)C)cc1 ZINC000482509277 898093073 /nfs/dbraw/zinc/09/30/73/898093073.db2.gz NHRRRLZQFXGSCL-FQEVSTJZSA-N 0 3 424.549 4.064 20 0 HIADHN CC(=O)N[C@H](C)C1CCN(Cc2cccc(NC(=O)c3ccc(Cl)cc3)c2)CC1 ZINC000482524966 898112949 /nfs/dbraw/zinc/11/29/49/898112949.db2.gz QIYCBVRZAYCCIX-MRXNPFEDSA-N 0 3 413.949 4.329 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)[C@H](NC(=O)c1ccccc1)c1ccccc1 ZINC000482591103 898191180 /nfs/dbraw/zinc/19/11/80/898191180.db2.gz ZDMQEQLFCAMJRB-HSZRJFAPSA-N 0 3 401.510 4.166 20 0 HIADHN CC(C)CN(C(=O)N[C@@H]1CCN(Cc2ccccc2)C1)[C@@H]1CCCc2cccnc21 ZINC000482641939 898244861 /nfs/dbraw/zinc/24/48/61/898244861.db2.gz MKXBRLJBCHUWLI-DHIUTWEWSA-N 0 3 406.574 4.401 20 0 HIADHN CC(C)c1nn(-c2ccc(Br)cc2)cc1CN[C@H](C)CC[S@@](C)=O ZINC000482753199 898358397 /nfs/dbraw/zinc/35/83/97/898358397.db2.gz OMDOSLRHMKQLTI-JBEBIEQOSA-N 0 3 412.397 4.005 20 0 HIADHN CCN1CCN(CCC(=O)N(C)[C@H](c2ccc(F)cc2)c2ccc(Cl)cc2)CC1 ZINC000482770543 898379233 /nfs/dbraw/zinc/37/92/33/898379233.db2.gz VKZBSEAWPPXRHA-QHCPKHFHSA-N 0 3 417.956 4.055 20 0 HIADHN CC[C@H](C)[C@@H](N[C@@H](C)c1cn(C)nc1C)C(=O)N1CCC(Cc2ccccc2)CC1 ZINC000482827342 898434822 /nfs/dbraw/zinc/43/48/22/898434822.db2.gz SRCCJSPNZCVYRS-AXHZCLLHSA-N 0 3 410.606 4.275 20 0 HIADHN O=C(c1cnc(-c2ccc3c(c2)OCO3)s1)N1C[C@@H]2CCCN2Cc2ccccc21 ZINC000482840738 898450560 /nfs/dbraw/zinc/45/05/60/898450560.db2.gz MKYIICMUEOAOJC-KRWDZBQOSA-N 0 3 419.506 4.164 20 0 HIADHN Cc1cc(OCC(=O)Nc2cccc(CN3CCC(CO)CC3)c2)cc(C)c1Cl ZINC000482841403 898450618 /nfs/dbraw/zinc/45/06/18/898450618.db2.gz ZRPCYELDPLNHPR-UHFFFAOYSA-N 0 3 416.949 4.179 20 0 HIADHN CCCN(C(=O)NCC1(N2CCSCC2)CCCC1)[C@H]1CCCc2cccnc21 ZINC000482858481 898470362 /nfs/dbraw/zinc/47/03/62/898470362.db2.gz PPKHMNXKYDIPLC-FQEVSTJZSA-N 0 3 416.635 4.242 20 0 HIADHN Cc1nc2ccccc2n1C1CCN(CC(=O)N(Cc2ccc(C)cc2)C2CC2)CC1 ZINC000482891678 898510157 /nfs/dbraw/zinc/51/01/57/898510157.db2.gz OPFFATXIWRBJCZ-UHFFFAOYSA-N 0 3 416.569 4.481 20 0 HIADHN COc1ccccc1Oc1ccc(CN[C@H](C)c2ccc(-n3cnnn3)cc2)cc1 ZINC000482896158 898514460 /nfs/dbraw/zinc/51/44/60/898514460.db2.gz ZDWYRHMVIIDNKU-QGZVFWFLSA-N 0 3 401.470 4.314 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCCC1)c1cnn(-c2ccccc2)c1C1CC1 ZINC000482937448 898558294 /nfs/dbraw/zinc/55/82/94/898558294.db2.gz WYDJKXGHIOSIDZ-UHFFFAOYSA-N 0 3 424.614 4.231 20 0 HIADHN C[C@@H](NCCOc1cc(F)cc(Br)c1)c1ccc(Br)cn1 ZINC000482959548 898589806 /nfs/dbraw/zinc/58/98/06/898589806.db2.gz JVPJZZNSVHUPDI-SNVBAGLBSA-N 0 3 418.104 4.475 20 0 HIADHN C[C@@H]1CCCCN1C(=O)c1ccc(NC(=O)N2CCN(C3CCCCC3)CC2)cc1 ZINC000482981549 898619455 /nfs/dbraw/zinc/61/94/55/898619455.db2.gz LCVMNDANYUXKKQ-LJQANCHMSA-N 0 3 412.578 4.183 20 0 HIADHN C[C@@H](NC(=O)Cc1c[nH]c2cccc(Br)c12)[C@@H](c1ccccc1)N(C)C ZINC000505582948 914289003 /nfs/dbraw/zinc/28/90/03/914289003.db2.gz XIUDWMCMOHQPBE-SZNDQCEHSA-N 0 3 414.347 4.281 20 0 HIADHN Cc1cccc(N2CCC(N[C@H](C)c3ccccc3I)CC2)n1 ZINC000483201741 898855995 /nfs/dbraw/zinc/85/59/95/898855995.db2.gz OSACHRLOOZLPBJ-OAHLLOKOSA-N 0 3 421.326 4.314 20 0 HIADHN CCCOc1ccc(C(C)(C)NCC(=O)NCC2(c3ccccc3)CCOCC2)cc1 ZINC000483273455 898911497 /nfs/dbraw/zinc/91/14/97/898911497.db2.gz YVMSOGGQEJVOPH-UHFFFAOYSA-N 0 3 424.585 4.165 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)NCc1cc(F)cc(Br)c1)c1ccco1 ZINC000483282668 898918326 /nfs/dbraw/zinc/91/83/26/898918326.db2.gz KEQFWTSBPXQQOG-LRDDRELGSA-N 0 3 412.303 4.110 20 0 HIADHN CCCN(C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C)[C@@H]1CCCc2cccnc21 ZINC000483313446 898940734 /nfs/dbraw/zinc/94/07/34/898940734.db2.gz WWLOIWWHXJPSLA-UEVCKROQSA-N 0 3 406.574 4.401 20 0 HIADHN CS[C@H]1CN(C(=O)c2cc3cc(Br)cc(C)c3o2)C[C@H]1N1CCCC1 ZINC000483379624 899015904 /nfs/dbraw/zinc/01/59/04/899015904.db2.gz GERCDNHSDVDGLB-WBVHZDCISA-N 0 3 423.376 4.156 20 0 HIADHN C[C@@H](NC(=O)c1cc2sc(N3CCCC3)nc2s1)[C@H](c1ccccc1)N(C)C ZINC000505601948 914305945 /nfs/dbraw/zinc/30/59/45/914305945.db2.gz IYBZHMZWCMNNOM-RDTXWAMCSA-N 0 3 414.600 4.379 20 0 HIADHN CS[C@@H]1CN(C(=O)c2oc3c(cccc3Br)c2C)C[C@@H]1N1CCCC1 ZINC000483386391 899021476 /nfs/dbraw/zinc/02/14/76/899021476.db2.gz AQQFLSLBPJNURQ-JKSUJKDBSA-N 0 3 423.376 4.156 20 0 HIADHN CS[C@@H]1CN(C(=O)c2csc(-c3ccc(C)cc3C)n2)C[C@@H]1N1CCCC1 ZINC000483392531 899027421 /nfs/dbraw/zinc/02/74/21/899027421.db2.gz IAVXJVHZEKQCRL-RBUKOAKNSA-N 0 3 401.601 4.079 20 0 HIADHN CS[C@@H]1CN(C(=O)c2cc3cc(C)cc(Br)c3o2)C[C@H]1N1CCCC1 ZINC000483400072 899031449 /nfs/dbraw/zinc/03/14/49/899031449.db2.gz CNMXWAFWMLGSLF-NVXWUHKLSA-N 0 3 423.376 4.156 20 0 HIADHN C[C@H](NC(=O)c1c[nH]c2ccc(Br)cc12)[C@H](c1ccccc1)N(C)C ZINC000505605902 914310186 /nfs/dbraw/zinc/31/01/86/914310186.db2.gz JATYTHPSMPJYBG-ORAYPTAESA-N 0 3 400.320 4.352 20 0 HIADHN Cc1cccc(-c2nn(-c3ccc(F)cc3)cc2CN2CC[C@@H](N3CCCC3=O)C2)c1 ZINC000483431737 899063848 /nfs/dbraw/zinc/06/38/48/899063848.db2.gz DHVNWEREKLEXQP-HSZRJFAPSA-N 0 3 418.516 4.184 20 0 HIADHN C[C@@H](NC(=O)c1c[nH]c2ccc(Br)cc12)[C@H](c1ccccc1)N(C)C ZINC000505605900 914310594 /nfs/dbraw/zinc/31/05/94/914310594.db2.gz JATYTHPSMPJYBG-BFUOFWGJSA-N 0 3 400.320 4.352 20 0 HIADHN CCS[C@@H]1CCC[C@@H](NC(=O)Nc2ccc(N3CCN(CC)CC3)cc2C)C1 ZINC000483435965 899068881 /nfs/dbraw/zinc/06/88/81/899068881.db2.gz BWUCYWYPQCMCAD-UYAOXDASSA-N 0 3 404.624 4.323 20 0 HIADHN C[C@@H](NC(=O)CCc1nnc(-c2cc3ccccc3o2)o1)[C@H](c1ccccc1)N(C)C ZINC000505608304 914312700 /nfs/dbraw/zinc/31/27/00/914312700.db2.gz MWLLVOAUIUIXOZ-WAIKUNEKSA-N 0 3 418.497 4.223 20 0 HIADHN Cc1ccc(NC(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)cc1C(=O)N(C)C(C)C ZINC000483450691 899087450 /nfs/dbraw/zinc/08/74/50/899087450.db2.gz WYHNPPGOPKZKLE-XMSQKQJNSA-N 0 3 410.562 4.288 20 0 HIADHN CC[C@H](N[C@@H](C)c1ccc(S(=O)(=O)N2CCCCC2)cc1)c1c(C)nn(C)c1C ZINC000483454089 899090845 /nfs/dbraw/zinc/09/08/45/899090845.db2.gz KUHSVIIACAWYOF-KKSFZXQISA-N 0 3 418.607 4.013 20 0 HIADHN C[C@@H](NC(=O)CSCc1cc(-c2cccs2)on1)[C@@H](c1ccccc1)N(C)C ZINC000505611888 914316283 /nfs/dbraw/zinc/31/62/83/914316283.db2.gz OYKMOUQTFDKEML-VFNWGFHPSA-N 0 3 415.584 4.444 20 0 HIADHN Cc1ccc(OCc2nc(CC(=O)N[C@@H](C)[C@H](c3ccccc3)N(C)C)cs2)cc1 ZINC000505613636 914317541 /nfs/dbraw/zinc/31/75/41/914317541.db2.gz ZTBDHVPOWIYDMY-MHECFPHRSA-N 0 3 423.582 4.381 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1ccc(N(C)C)cc1F ZINC000505625592 914325702 /nfs/dbraw/zinc/32/57/02/914325702.db2.gz LQCIBEWAFDUXDX-HXUWFJFHSA-N 0 3 421.520 4.096 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)Nc3ccc(OC4CCC4)c(F)c3)CC2)C[C@H](C)O1 ZINC000483513423 899175568 /nfs/dbraw/zinc/17/55/68/899175568.db2.gz OHCGWPKHEWJVJW-IRXDYDNUSA-N 0 3 419.541 4.110 20 0 HIADHN COc1ccccc1-c1noc([C@H](C)N[C@@H]2C[C@@H](C)CN(Cc3ccccc3)C2)n1 ZINC000483645573 899302138 /nfs/dbraw/zinc/30/21/38/899302138.db2.gz ASQRQWCWNSJGMG-WSTZPKSXSA-N 0 3 406.530 4.306 20 0 HIADHN CCc1ccc(-c2noc([C@@H](C)NCc3ccccc3N3CCN(CC)CC3)n2)cc1 ZINC000483646348 899303708 /nfs/dbraw/zinc/30/37/08/899303708.db2.gz CTSHUQPMMVZYHD-LJQANCHMSA-N 0 3 419.573 4.292 20 0 HIADHN C[C@@H](NCCc1ccc(S(=O)(=O)N2CCCCC2)s1)c1cc(F)ccc1F ZINC000483648561 899305197 /nfs/dbraw/zinc/30/51/97/899305197.db2.gz OEGJSYWDFUIULW-CQSZACIVSA-N 0 3 414.543 4.094 20 0 HIADHN C[C@@H](NC(=O)Cc1ccc(NC(=O)CC(C)(C)C)cc1)[C@@H](c1ccccc1)N(C)C ZINC000505634838 914334443 /nfs/dbraw/zinc/33/44/43/914334443.db2.gz RGECJWNBWNAJEA-KOSHJBKYSA-N 0 3 409.574 4.411 20 0 HIADHN COc1ccccc1-c1noc([C@@H](C)NC2CCC(C(=O)OC(C)(C)C)CC2)n1 ZINC000483651896 899309551 /nfs/dbraw/zinc/30/95/51/899309551.db2.gz HNEJMGVZMYRUKR-QQFBHYJXSA-N 0 3 401.507 4.296 20 0 HIADHN COCCC1(CNC(=O)N(CCN(C)C)Cc2ccc(F)cc2F)CCCCC1 ZINC000483677664 899336849 /nfs/dbraw/zinc/33/68/49/899336849.db2.gz FOLATQRSISPAIH-UHFFFAOYSA-N 0 3 411.537 4.025 20 0 HIADHN CNC(=O)[C@H](Cc1c[nH]c2ccccc12)N[C@H](C)c1ccc(OC(F)(F)F)cc1 ZINC000483716043 899374599 /nfs/dbraw/zinc/37/45/99/899374599.db2.gz RUZRXGOAMBMFDD-YJYMSZOUSA-N 0 3 405.420 4.074 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2ccc(C)c(OCC(F)F)c2)c1 ZINC000483724678 899383741 /nfs/dbraw/zinc/38/37/41/899383741.db2.gz LQDLRQXMURUKNU-UHFFFAOYSA-N 0 3 421.488 4.243 20 0 HIADHN CNC(=O)[C@H](Cc1c[nH]c2ccccc12)N[C@@H](C)c1ccc(F)c(Br)c1 ZINC000483729084 899388856 /nfs/dbraw/zinc/38/88/56/899388856.db2.gz PWNJRGIUUDAKQX-BUXKBTBVSA-N 0 3 418.310 4.077 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)c2cc(C)nc(-c3ccc(Cl)cc3)n2)o1 ZINC000505646875 914347134 /nfs/dbraw/zinc/34/71/34/914347134.db2.gz KADACQNVZHOOMP-UHFFFAOYSA-N 0 3 412.921 4.211 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2ccc(-c3nccc(C)n3)cc2)c1 ZINC000483993741 899633944 /nfs/dbraw/zinc/63/39/44/899633944.db2.gz KJVKBJPYNBTUOR-UHFFFAOYSA-N 0 3 419.529 4.056 20 0 HIADHN CC[C@H](CNC(=O)Nc1ccc(C(=O)N[C@@H](C)CC)cc1)N1CCc2ccccc2C1 ZINC000505668377 914366128 /nfs/dbraw/zinc/36/61/28/914366128.db2.gz ZFCOKIUMYJXOIY-FDDCHVKYSA-N 0 3 422.573 4.173 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)NC[C@@H]1CCCC[C@@H]1C(F)(F)F ZINC000484051421 899683430 /nfs/dbraw/zinc/68/34/30/899683430.db2.gz VLKBTWXWWTZTNS-WMZOPIPTSA-N 0 3 403.464 4.268 20 0 HIADHN O=C(c1ccc(OCc2cn3ccccc3n2)cc1)N1CCN(C2CCCCC2)CC1 ZINC000484120241 899742259 /nfs/dbraw/zinc/74/22/59/899742259.db2.gz WAIBSFIRLVBWLW-UHFFFAOYSA-N 0 3 418.541 4.004 20 0 HIADHN Cc1c([C@H](C)NC2CCN(c3ccc(C)cn3)CC2)nnn1-c1ccc(Cl)cc1 ZINC000484133159 899754380 /nfs/dbraw/zinc/75/43/80/899754380.db2.gz JKIJSCLRRJTDTH-INIZCTEOSA-N 0 3 410.953 4.252 20 0 HIADHN C[C@@H](N[C@H](CCCO)c1ccccc1)c1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000484135434 899756636 /nfs/dbraw/zinc/75/66/36/899756636.db2.gz QJCDEINTPIXZRO-AUSIDOKSSA-N 0 3 416.587 4.026 20 0 HIADHN Cc1noc([C@H]2CCCCN2C(=O)NC[C@@H](c2ccccc2)N2CCC(C)CC2)n1 ZINC000484165371 899784887 /nfs/dbraw/zinc/78/48/87/899784887.db2.gz SMPMVTZTWHGFCW-RTWAWAEBSA-N 0 3 411.550 4.088 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N[C@@H](c1ccc(Cl)cc1)C(C)C ZINC000484192156 899805976 /nfs/dbraw/zinc/80/59/76/899805976.db2.gz QRRMVZHMZWXEMO-HXUWFJFHSA-N 0 3 401.938 4.162 20 0 HIADHN Cc1ccc(Oc2ccccc2)c(NC(=O)N2CC[C@@H](N3CCN(C)CC3)[C@@H](C)C2)c1 ZINC000484225289 899821536 /nfs/dbraw/zinc/82/15/36/899821536.db2.gz XGLRKXNECGQXMD-NZQKXSOJSA-N 0 3 422.573 4.277 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)NCc1cccc(Oc2ccccc2)c1 ZINC000484227116 899823111 /nfs/dbraw/zinc/82/31/11/899823111.db2.gz UFKMLYXWPKPCLP-UHFFFAOYSA-N 0 3 417.509 4.104 20 0 HIADHN Cc1cc(N2CCC(N[C@@H](C)c3ccc(F)cc3Br)CC2)nc(C)n1 ZINC000484280580 899849600 /nfs/dbraw/zinc/84/96/00/899849600.db2.gz YLCPKBDYCXIQKH-ZDUSSCGKSA-N 0 3 407.331 4.315 20 0 HIADHN CSc1cccc(N(C(=O)c2cccc(Cn3ccnc3)c2)C2CCN(C)CC2)c1 ZINC000484285401 899851787 /nfs/dbraw/zinc/85/17/87/899851787.db2.gz QZGYRZKNDODIQO-UHFFFAOYSA-N 0 3 420.582 4.394 20 0 HIADHN CC[S@](=O)[C@@H]1CCC[C@H](N[C@H](C)c2ccccc2I)C1 ZINC000484290525 899855388 /nfs/dbraw/zinc/85/53/88/899855388.db2.gz FAZONYQRZAMTCS-JWHHTLNTSA-N 0 3 405.345 4.022 20 0 HIADHN Cc1ccc(CN[C@H]2CCc3cc(Br)ccc32)c(N2CCOCC2)c1 ZINC000484300364 899862473 /nfs/dbraw/zinc/86/24/73/899862473.db2.gz JBIWHWVSJHTJQL-FQEVSTJZSA-N 0 3 401.348 4.371 20 0 HIADHN COc1ccc(OCCN2CCC(c3noc(-c4ccccc4OC)n3)CC2)cc1 ZINC000484322558 899878240 /nfs/dbraw/zinc/87/82/40/899878240.db2.gz HVGYRFUDLSDTFE-UHFFFAOYSA-N 0 3 409.486 4.012 20 0 HIADHN COc1ccc(C(=O)N(c2cccc(SC)c2)C2CCN(C)CC2)cc1OC ZINC000484406074 899929078 /nfs/dbraw/zinc/92/90/78/899929078.db2.gz PAWUVNNRLMICMV-UHFFFAOYSA-N 0 3 400.544 4.167 20 0 HIADHN CSc1cccc(N(C(=O)CSC[C@H]2CCCCO2)C2CCN(C)CC2)c1 ZINC000484408917 899931598 /nfs/dbraw/zinc/93/15/98/899931598.db2.gz VJYINMRAESEAOI-LJQANCHMSA-N 0 3 408.633 4.138 20 0 HIADHN CC[C@@H](C)n1ncc(NC(=O)N(CCN(C)C)Cc2cccc(OC)c2)c1C1CC1 ZINC000484471259 899965254 /nfs/dbraw/zinc/96/52/54/899965254.db2.gz HRTHEMLNDXBNTG-QGZVFWFLSA-N 0 3 413.566 4.336 20 0 HIADHN O[C@@H](CN[C@H]1CCCc2nc(-c3ccccc3Br)sc21)C(F)F ZINC000484473921 899967846 /nfs/dbraw/zinc/96/78/46/899967846.db2.gz JIBIBCLCYPTKJE-AAEUAGOBSA-N 0 3 403.292 4.166 20 0 HIADHN COc1ccc(OC)c([C@H](C)NCCC(=O)Nc2cc(C)c(Cl)cc2OC)c1 ZINC000484485954 899977992 /nfs/dbraw/zinc/97/79/92/899977992.db2.gz QGFWZCLSKHIJDY-AWEZNQCLSA-N 0 3 406.910 4.354 20 0 HIADHN O=C(C1CCCCC1)N1CC[C@H](N[C@H]2CCCOc3c(Br)cccc32)C1 ZINC000484507101 899997627 /nfs/dbraw/zinc/99/76/27/899997627.db2.gz YMTPURFIURYRCY-LPHOPBHVSA-N 0 3 421.379 4.434 20 0 HIADHN C[C@@H](NCCCO[C@@H]1CCOC1)c1ccc(Br)cc1Br ZINC000484615427 900072306 /nfs/dbraw/zinc/07/23/06/900072306.db2.gz HUEZIQFPTHMHMU-DGCLKSJQSA-N 0 3 407.146 4.058 20 0 HIADHN CCCOc1ccc(O[C@H]2CCCC[C@@H]2NCc2cc(-c3cnn(C)c3)no2)cc1 ZINC000484623877 900076111 /nfs/dbraw/zinc/07/61/11/900076111.db2.gz VFPCSSCPPQEBJM-GMAHTHKFSA-N 0 3 410.518 4.344 20 0 HIADHN O=C(CN1CCN(CCC23CC4CC(CC(C4)C2)C3)CC1)Nc1c(F)cccc1F ZINC000484630395 900080695 /nfs/dbraw/zinc/08/06/95/900080695.db2.gz OODHYDKRHWBHKN-UHFFFAOYSA-N 0 3 417.544 4.127 20 0 HIADHN Brc1ccccc1-n1nnnc1CN[C@@H]1CCCC[C@H]1c1ccccc1 ZINC000484633621 900083425 /nfs/dbraw/zinc/08/34/25/900083425.db2.gz AHQQMYPXXSMWBR-FUHWJXTLSA-N 0 3 412.335 4.241 20 0 HIADHN C[C@@H](N[C@@H](C)c1cccc(N2CCCC2)c1)c1cccc(N2CCCS2(=O)=O)c1 ZINC000484644056 900090269 /nfs/dbraw/zinc/09/02/69/900090269.db2.gz TUGKBDNRBFDIOJ-RBUKOAKNSA-N 0 3 413.587 4.239 20 0 HIADHN C[C@@H](NC(=O)NCCN(C)Cc1ccccc1)c1ccc(Oc2cccnc2)cc1 ZINC000484671522 900113404 /nfs/dbraw/zinc/11/34/04/900113404.db2.gz SQWIYJWESGVNEM-LJQANCHMSA-N 0 3 404.514 4.366 20 0 HIADHN CCc1nc(C2CCN(CC(=O)N3CCC[C@H]3c3ccc(C(C)(C)C)cc3)CC2)n[nH]1 ZINC000484738153 900162724 /nfs/dbraw/zinc/16/27/24/900162724.db2.gz MNEPJJPQHDLZHM-NRFANRHFSA-N 0 3 423.605 4.208 20 0 HIADHN CCc1n[nH]c(C2CCN(CC(=O)N3CCC[C@H]3c3ccc(C(C)(C)C)cc3)CC2)n1 ZINC000484738153 900162728 /nfs/dbraw/zinc/16/27/28/900162728.db2.gz MNEPJJPQHDLZHM-NRFANRHFSA-N 0 3 423.605 4.208 20 0 HIADHN CCc1nnc(C2CCN(CC(=O)N3CCC[C@H]3c3ccc(C(C)(C)C)cc3)CC2)[nH]1 ZINC000484738153 900162736 /nfs/dbraw/zinc/16/27/36/900162736.db2.gz MNEPJJPQHDLZHM-NRFANRHFSA-N 0 3 423.605 4.208 20 0 HIADHN CCOc1ccc(NC(=O)N(CCN(C)C)Cc2cccc(OC)c2)c2ncccc12 ZINC000484786915 900194672 /nfs/dbraw/zinc/19/46/72/900194672.db2.gz OTXSZACLWAQLHO-UHFFFAOYSA-N 0 3 422.529 4.238 20 0 HIADHN C[C@H](NC(=O)NCc1ccc(OCc2ccccn2)cc1)[C@@H](c1ccccc1)N(C)C ZINC000484794422 900200466 /nfs/dbraw/zinc/20/04/66/900200466.db2.gz DJBXNOSESIVDRY-CYFREDJKSA-N 0 3 418.541 4.151 20 0 HIADHN COc1ccc(NC(=O)CCN(Cc2cccs2)C[C@H]2CCCO2)cc1Cl ZINC000484995350 900348543 /nfs/dbraw/zinc/34/85/43/900348543.db2.gz MDAZZGPDWCCGHN-MRXNPFEDSA-N 0 3 408.951 4.420 20 0 HIADHN Cc1ccccc1CN1CCN(CCC(=O)Nc2ccccc2C(F)(F)F)CC1 ZINC000485002936 900354535 /nfs/dbraw/zinc/35/45/35/900354535.db2.gz PDOGHZADMXJKDY-UHFFFAOYSA-N 0 3 405.464 4.160 20 0 HIADHN CN(C(=O)CCCN1CCN(c2ccccc2)CC1)[C@H]1CCCC[C@H]1C(F)(F)F ZINC000485070625 900391930 /nfs/dbraw/zinc/39/19/30/900391930.db2.gz MKKKTTOFXCFIQA-UXHICEINSA-N 0 3 411.512 4.168 20 0 HIADHN CCCCn1ncc(NC(=O)N2CCC(CN3C[C@@H](C)O[C@H](C)C3)CC2)c1C(C)C ZINC000485163494 900462940 /nfs/dbraw/zinc/46/29/40/900462940.db2.gz XYRGHUQIVFHOIO-RTBURBONSA-N 0 3 419.614 4.160 20 0 HIADHN CC(C)c1c(NC(=O)N[C@H](C)C2=CCN(C)CC2)cnn1-c1ccc(Cl)cc1 ZINC000485200132 900492673 /nfs/dbraw/zinc/49/26/73/900492673.db2.gz HMRWFBNWBKRGPJ-OAHLLOKOSA-N 0 3 401.942 4.421 20 0 HIADHN O=C(N[C@H](c1ccc(F)cc1)C(F)(F)F)N1CCCN(Cc2ccccc2)CC1 ZINC000485241753 900526914 /nfs/dbraw/zinc/52/69/14/900526914.db2.gz KFOCYPIXXNCEMG-LJQANCHMSA-N 0 3 409.427 4.347 20 0 HIADHN Cc1[nH]nc(-c2ccccc2)c1NC(=O)c1ccc(N2CCN(C(C)C)CC2)cc1 ZINC000485255295 900540842 /nfs/dbraw/zinc/54/08/42/900540842.db2.gz AGBMDXIGZKXZBW-UHFFFAOYSA-N 0 3 403.530 4.168 20 0 HIADHN C[C@@H]1[C@H](NC(=O)NC[C@H]2CCCO[C@@H]2c2ccccc2)CCN1Cc1ccccc1 ZINC000485267308 900548821 /nfs/dbraw/zinc/54/88/21/900548821.db2.gz BHMOBEVZLLNAOK-OTUUDDROSA-N 0 3 407.558 4.117 20 0 HIADHN CN(C)[C@H](CNC(=O)Nc1ccc(Oc2ccccc2C(N)=O)cc1)c1ccccc1 ZINC000485369484 900667812 /nfs/dbraw/zinc/66/78/12/900667812.db2.gz GXCHIBSAOKMDNQ-OAQYLSRUSA-N 0 3 418.497 4.002 20 0 HIADHN CN(C)Cc1ccccc1C(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1 ZINC000485421430 900720043 /nfs/dbraw/zinc/72/00/43/900720043.db2.gz KRQBGQPJHOGJOX-UHFFFAOYSA-N 0 3 413.565 4.296 20 0 HIADHN Cc1c2cccc(C)c2oc1C(=O)Nc1ccc(C(=O)NCCN2CCCC2)cc1 ZINC000485519420 900803828 /nfs/dbraw/zinc/80/38/28/900803828.db2.gz MVGULJHTKHZBIE-UHFFFAOYSA-N 0 3 405.498 4.128 20 0 HIADHN C[C@H]1CN(C(=O)c2ccc(-c3ccc(Cl)cc3)s2)CC[C@H]1N1CCN(C)CC1 ZINC000485678326 900930157 /nfs/dbraw/zinc/93/01/57/900930157.db2.gz OQSNHIYKYCNVHR-QFBILLFUSA-N 0 3 418.006 4.167 20 0 HIADHN Cc1ccc(-c2ccc(C(=O)N3CC[C@@H](N4CCN(C)CC4)[C@@H](C)C3)c(F)c2)cc1C ZINC000485783497 901037737 /nfs/dbraw/zinc/03/77/37/901037737.db2.gz HBWHHRRJWZUQPL-NBGIEHNGSA-N 0 3 423.576 4.208 20 0 HIADHN CCCN(Cc1nc2ccc(Br)cc2n1C)[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000485819383 901068346 /nfs/dbraw/zinc/06/83/46/901068346.db2.gz XKMSURCPGAREPV-NIKGAXFTSA-N 0 3 406.368 4.361 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@@H](C)N[C@@H](C)c2ccc3ncsc3c2)cc1OC ZINC000485838620 901084356 /nfs/dbraw/zinc/08/43/56/901084356.db2.gz BICQRLTYUXXXOU-LSDHHAIUSA-N 0 3 413.543 4.011 20 0 HIADHN CCN(C(=O)c1cnnc(-c2ccccc2)c1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000485882330 901117896 /nfs/dbraw/zinc/11/78/96/901117896.db2.gz JBDVANASAKCAIG-XXBNENTESA-N 0 3 400.526 4.441 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Nc1ccnc(OCc2ccccc2)c1 ZINC000505871166 914518919 /nfs/dbraw/zinc/51/89/19/914518919.db2.gz HZTCOMBYLAERIL-UHFFFAOYSA-N 0 3 410.543 4.318 20 0 HIADHN COc1cc([C@@H](C)NC[C@H](c2ccccc2)C(F)(F)F)ccc1S(C)(=O)=O ZINC000486062861 901258254 /nfs/dbraw/zinc/25/82/54/901258254.db2.gz RUZFVWZTFQQFLM-CZUORRHYSA-N 0 3 401.450 4.095 20 0 HIADHN Cc1ccc(F)c(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)c1Br ZINC000486117083 901303126 /nfs/dbraw/zinc/30/31/26/901303126.db2.gz FAWHBRRHHLWNMD-RHSMWYFYSA-N 0 3 405.311 4.147 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)c2ccc(-c3noc(C(F)F)n3)cc2)C1 ZINC000486222968 901405235 /nfs/dbraw/zinc/40/52/35/901405235.db2.gz ZLVIDSPAMFIEAA-KDOFPFPSSA-N 0 3 412.440 4.240 20 0 HIADHN Clc1ccc(-n2cc(CN3C[C@H]4CCC[C@@]4(c4nc(CC5CC5)no4)C3)cn2)cc1 ZINC000486435391 901593446 /nfs/dbraw/zinc/59/34/46/901593446.db2.gz QYUQBXQJVBQHQW-WZONZLPQSA-N 0 3 423.948 4.415 20 0 HIADHN COC(=O)c1ccccc1CN1C[C@H]2CCC[C@@]2(c2nc(-c3ccccc3)no2)C1 ZINC000486468807 901629934 /nfs/dbraw/zinc/62/99/34/901629934.db2.gz MZXSSPYCNGTFPS-NTKDMRAZSA-N 0 3 403.482 4.077 20 0 HIADHN C[C@@H]1CN(C2CCOCC2)CCN1c1nnc(-c2cc(Cl)cc(Cl)c2)s1 ZINC000486498852 901650626 /nfs/dbraw/zinc/65/06/26/901650626.db2.gz XDUHCAJEMIONKL-GFCCVEGCSA-N 0 3 413.374 4.201 20 0 HIADHN C[C@H](Cc1cncc2ccccc21)C(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000486720529 901812952 /nfs/dbraw/zinc/81/29/52/901812952.db2.gz DLBARJLTTXNYFV-LJQANCHMSA-N 0 3 417.553 4.256 20 0 HIADHN COC(=O)c1ccc(CN2C[C@H]3CCC[C@@]3(c3nc(-c4ccccc4)no3)C2)cc1F ZINC000486836098 901886821 /nfs/dbraw/zinc/88/68/21/901886821.db2.gz USJCTAOLBMVOAM-HOYKHHGWSA-N 0 3 421.472 4.216 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cccc(COC2CCOCC2)c1)c1ccsc1 ZINC000486843468 901891191 /nfs/dbraw/zinc/89/11/91/901891191.db2.gz RJZQIDUOHBZNSW-QFIPXVFZSA-N 0 3 416.587 4.257 20 0 HIADHN CC[C@@H]1CCCCN1C(=O)[C@H](C)N1C[C@H]2CCC[C@@]2(c2nc(-c3ccccc3)no2)C1 ZINC000486851674 901896726 /nfs/dbraw/zinc/89/67/26/901896726.db2.gz BDVZVZLGAHEUJD-FXWJEBAPSA-N 0 3 422.573 4.270 20 0 HIADHN Cc1ccc(Cc2cnc(NC(=O)N3CC[C@@H]4CCN(C)C[C@@H]43)s2)cc1Cl ZINC000486905224 901951945 /nfs/dbraw/zinc/95/19/45/901951945.db2.gz DSLHROJXFCKAKP-YJBOKZPZSA-N 0 3 404.967 4.254 20 0 HIADHN CC(C)(O)CN1CCc2c(cccc2NC(=O)c2cc3cc(Cl)sc3[nH]2)C1 ZINC000487004179 902010320 /nfs/dbraw/zinc/01/03/20/902010320.db2.gz VIRSDNNAJHWYJT-UHFFFAOYSA-N 0 3 403.935 4.264 20 0 HIADHN CC(C)([C@@H](NC(=O)CCc1ccc(O)cc1)c1ccc(F)c(F)c1)N1CCCC1 ZINC000487083191 902050546 /nfs/dbraw/zinc/05/05/46/902050546.db2.gz JTMMFFJNFPRSIL-QFIPXVFZSA-N 0 3 402.485 4.335 20 0 HIADHN CC(C)(C)CCN1CCN(C(=O)Nc2c(F)cc(F)cc2Br)CC1 ZINC000487207596 902102249 /nfs/dbraw/zinc/10/22/49/902102249.db2.gz ZSQGUZSGMLWUDY-UHFFFAOYSA-N 0 3 404.299 4.313 20 0 HIADHN CN(C(=O)Nc1c(F)cc(F)cc1Br)[C@H]1CCN(Cc2ccccc2)C1 ZINC000487245046 902115760 /nfs/dbraw/zinc/11/57/60/902115760.db2.gz YNGKHRSHBRXLAW-HNNXBMFYSA-N 0 3 424.289 4.466 20 0 HIADHN CCN1CCC[C@@H](CN(C)C(=O)C2(c3ccccc3C)CCCC2)[C@@H]1c1cnn(C)c1 ZINC000487261902 902124319 /nfs/dbraw/zinc/12/43/19/902124319.db2.gz JZMYNQFCUIKIDT-XUZZJYLKSA-N 0 3 422.617 4.472 20 0 HIADHN Fc1ccc(-c2nnc3n2C[C@@H](NCc2cc(Br)ccc2F)CC3)cc1 ZINC000505946538 914599032 /nfs/dbraw/zinc/59/90/32/914599032.db2.gz JZNWXOWMTUUKBJ-INIZCTEOSA-N 0 3 419.273 4.090 20 0 HIADHN C[C@@H](c1cccc(N2CCCS2(=O)=O)c1)N(C)Cc1ccc(C(F)(F)F)cc1 ZINC000487425732 902204195 /nfs/dbraw/zinc/20/41/95/902204195.db2.gz GHKKRTHRHMQOSQ-HNNXBMFYSA-N 0 3 412.477 4.438 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)CCc2nc(-c3ccc(F)c(C)c3)no2)c1 ZINC000487513728 902230521 /nfs/dbraw/zinc/23/05/21/902230521.db2.gz YKYUMNAGHJXGAI-UHFFFAOYSA-N 0 3 424.520 4.016 20 0 HIADHN Cc1noc(CSc2ccc(C(=O)N(CCN(C)C)Cc3cccc(C)c3)cc2)n1 ZINC000487620178 902254197 /nfs/dbraw/zinc/25/41/97/902254197.db2.gz DJRSHKWQYSDEDW-UHFFFAOYSA-N 0 3 424.570 4.183 20 0 HIADHN CC(C)CCn1ncc(NC(=O)NC2CCN(CCOC(C)C)CC2)c1C(C)C ZINC000487626114 902258006 /nfs/dbraw/zinc/25/80/06/902258006.db2.gz ZNZXTECOXCRYCZ-UHFFFAOYSA-N 0 3 407.603 4.064 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000505959233 914615353 /nfs/dbraw/zinc/61/53/53/914615353.db2.gz FHYRNTUYIPVEJX-PGRDOPGGSA-N 0 3 408.546 4.001 20 0 HIADHN CCCc1ccc([C@H](NC(=O)N2CC[C@H](N3CCN(C)CC3)[C@@H](C)C2)C(C)C)cc1 ZINC000487869041 902415031 /nfs/dbraw/zinc/41/50/31/902415031.db2.gz FIOPNRBZJCTNSU-NKKJXINNSA-N 0 3 414.638 4.004 20 0 HIADHN CC[C@@H]1C[C@@H](C(=O)NC[C@@H](c2ccc(C(F)(F)F)cc2)N(CC)CC)CCO1 ZINC000505969045 914631076 /nfs/dbraw/zinc/63/10/76/914631076.db2.gz AGOOGSMTDGQWLJ-UHOSZYNNSA-N 0 3 400.485 4.410 20 0 HIADHN FC(F)Cn1ncnc1CNC1(Cc2ccc(Br)cc2)CCCCC1 ZINC000488133263 902629745 /nfs/dbraw/zinc/62/97/45/902629745.db2.gz XAHDRLTZFGVXND-UHFFFAOYSA-N 0 3 413.310 4.341 20 0 HIADHN CC(C)c1nc2ccc(NC(=O)N3CCN(C4CCOCC4)C[C@H]3C)cc2s1 ZINC000488375184 902788602 /nfs/dbraw/zinc/78/86/02/902788602.db2.gz ASYXWZDBRUTEJP-OAHLLOKOSA-N 0 3 402.564 4.137 20 0 HIADHN C[C@@H]1CN(C2CCOCC2)CCN1C(=O)Nc1ccccc1Oc1cccc(F)c1 ZINC000488393968 902803603 /nfs/dbraw/zinc/80/36/03/902803603.db2.gz HNMZBCAVCZAJAM-QGZVFWFLSA-N 0 3 413.493 4.335 20 0 HIADHN COc1ccc(S(=O)(=O)[N-]c2cccc(C[NH2+][C@@H]3CS[C@H](C(C)C)C3)c2)cc1 ZINC000488418277 902817956 /nfs/dbraw/zinc/81/79/56/902817956.db2.gz NFMQKFPHRHCGHF-RXVVDRJESA-N 0 3 420.600 4.116 20 0 HIADHN O=C(Nc1ccc(C(=O)NCCN2CCCC2)cc1)c1occc1-c1ccccc1 ZINC000488439795 902827723 /nfs/dbraw/zinc/82/77/23/902827723.db2.gz KNRQVVFXWZACDJ-UHFFFAOYSA-N 0 3 403.482 4.025 20 0 HIADHN CC(C)(CNCc1csc(-c2ccc3c(c2)OCO3)n1)c1ccc2c(c1)OCCO2 ZINC000488481692 902847587 /nfs/dbraw/zinc/84/75/87/902847587.db2.gz LWGQUFLXMMARLB-UHFFFAOYSA-N 0 3 424.522 4.377 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)Nc1ccc(F)cc1OC1CCOCC1 ZINC000488652376 902919562 /nfs/dbraw/zinc/91/95/62/902919562.db2.gz BPRMZZYNZROUPR-QGZVFWFLSA-N 0 3 415.509 4.026 20 0 HIADHN O=C(Nc1ccc(F)cc1OC1CCOCC1)N1CCN(CC2CCCCC2)CC1 ZINC000488653680 902922293 /nfs/dbraw/zinc/92/22/93/902922293.db2.gz HKSBEVVBZRQAFH-UHFFFAOYSA-N 0 3 419.541 4.113 20 0 HIADHN Cc1cc(Br)ccc1C(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000488673833 902935590 /nfs/dbraw/zinc/93/55/90/902935590.db2.gz GZZJEEFHQJXMRP-UHFFFAOYSA-N 0 3 401.348 4.494 20 0 HIADHN CC(C)c1cccc(C(C)C)c1NC(=O)CN1CCN(C2CCOCC2)C[C@@H]1C ZINC000488699220 902950238 /nfs/dbraw/zinc/95/02/38/902950238.db2.gz GQPBISLHFVXABJ-IBGZPJMESA-N 0 3 401.595 4.057 20 0 HIADHN CCC(C)(C)OCc1ccccc1NC(=O)N1CCN(C2CCOCC2)C[C@@H]1C ZINC000488802870 903009124 /nfs/dbraw/zinc/00/91/24/903009124.db2.gz RPXXFDYUIUCDLG-SFHVURJKSA-N 0 3 403.567 4.109 20 0 HIADHN CC(C)n1ncc(C(=O)N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)c1-c1ccccc1 ZINC000488829268 903028958 /nfs/dbraw/zinc/02/89/58/903028958.db2.gz CUWNAXWFEGHLDQ-BGYRXZFFSA-N 0 3 424.589 4.092 20 0 HIADHN CC[C@@H](C)[C@](C)(O)CNCc1cc(Br)cc(Br)c1OC ZINC000489062563 903166125 /nfs/dbraw/zinc/16/61/25/903166125.db2.gz GNQGOFIOLCYAAL-MEBBXXQBSA-N 0 3 409.162 4.107 20 0 HIADHN Cc1cc(NC(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)n(-c2cc(C)ccn2)n1 ZINC000489093109 903192319 /nfs/dbraw/zinc/19/23/19/903192319.db2.gz URONIFLQGSZAMM-HXUWFJFHSA-N 0 3 418.545 4.012 20 0 HIADHN Cc1ccc(NC(=O)N2CCN(CCC(C)(C)C)CC2)cc1C(=O)N(C)C(C)C ZINC000489113701 903208041 /nfs/dbraw/zinc/20/80/41/903208041.db2.gz QXOCRWLRHVZHEG-UHFFFAOYSA-N 0 3 402.583 4.061 20 0 HIADHN Cc1cc(NC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)n(-c2cc(C)ccn2)n1 ZINC000489122743 903213004 /nfs/dbraw/zinc/21/30/04/903213004.db2.gz LEYMUVQFRQOXFB-HXUWFJFHSA-N 0 3 418.545 4.012 20 0 HIADHN Cc1ccc(NC(=O)N[C@@H](CN2CCCC2)c2ccccc2)cc1C(=O)N(C)C(C)C ZINC000489126566 903217047 /nfs/dbraw/zinc/21/70/47/903217047.db2.gz DJDQNPMJVMJMOZ-QHCPKHFHSA-N 0 3 422.573 4.434 20 0 HIADHN C[C@H](N[C@H](COc1ccccc1F)C(C)(C)C)C(=O)Nc1ccc2c(c1)OCCO2 ZINC000489142829 903228955 /nfs/dbraw/zinc/22/89/55/903228955.db2.gz WLZDDMLUGDPQRT-YCRPNKLZSA-N 0 3 416.493 4.007 20 0 HIADHN CCN(CC1CCN(c2ccccn2)CC1)[C@@H](C)C(=O)Nc1nc2ccccc2s1 ZINC000489292298 903313344 /nfs/dbraw/zinc/31/33/44/903313344.db2.gz MWJDJIWPAWMQAZ-KRWDZBQOSA-N 0 3 423.586 4.257 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N2CCC(N(C)c3ccccc3)CC2)C1 ZINC000489292205 903313884 /nfs/dbraw/zinc/31/38/84/903313884.db2.gz MDBMAEKHRSJEHH-IFMALSPDSA-N 0 3 406.574 4.132 20 0 HIADHN COc1cnccc1N1CCN(C(=O)Nc2ccc(N3CCCCCC3)cc2C)CC1 ZINC000489332523 903335602 /nfs/dbraw/zinc/33/56/02/903335602.db2.gz NNXYKEGHDNQMIS-UHFFFAOYSA-N 0 3 423.561 4.133 20 0 HIADHN Clc1cccc(-c2nc(CN3CCC(CCCN4CCOCC4)CC3)co2)c1 ZINC000506028095 914709394 /nfs/dbraw/zinc/70/93/94/914709394.db2.gz QDOREMXHNNNAPO-UHFFFAOYSA-N 0 3 403.954 4.319 20 0 HIADHN CC[C@@H](C)c1ccccc1NC(=O)[C@@H](C)N1CCC(CCCN2CCOCC2)CC1 ZINC000506032017 914715440 /nfs/dbraw/zinc/71/54/40/914715440.db2.gz OISBKLWLUQOZCC-NHCUHLMSSA-N 0 3 415.622 4.352 20 0 HIADHN Cc1ccc(NC(=O)N2CCN(C3CCC(C)CC3)CC2)cc1C(=O)N(C)C(C)C ZINC000489544027 903454526 /nfs/dbraw/zinc/45/45/26/903454526.db2.gz DEUKQIYUFRQTBE-UHFFFAOYSA-N 0 3 414.594 4.204 20 0 HIADHN Cc1ccc(NC(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)cc1C(=O)N(C)C(C)C ZINC000489604315 903494073 /nfs/dbraw/zinc/49/40/73/903494073.db2.gz XNOJWPWUXJDJMH-JOCHJYFZSA-N 0 3 422.573 4.214 20 0 HIADHN COc1ccccc1[C@@]1(C)C[C@@H]1NC(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000489634633 903510285 /nfs/dbraw/zinc/51/02/85/903510285.db2.gz UKRASTSYWJYQDS-UKILVPOCSA-N 0 3 407.558 4.031 20 0 HIADHN Cc1ccc(C[C@H](C)C(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000489658122 903523340 /nfs/dbraw/zinc/52/33/40/903523340.db2.gz ZIWMZODQEMLKAG-REWPJTCUSA-N 0 3 402.542 4.456 20 0 HIADHN Cc1cccc(Cl)c1CC(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000489705932 903549494 /nfs/dbraw/zinc/54/94/94/903549494.db2.gz MZMWAWBMKASZKS-IBGZPJMESA-N 0 3 408.933 4.473 20 0 HIADHN CCCN(C(=O)NC[C@H]1CCCn2cc(C)nc21)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000506038926 914727887 /nfs/dbraw/zinc/72/78/87/914727887.db2.gz RQGIAEJABTZNEZ-PKTZIBPZSA-N 0 3 423.605 4.155 20 0 HIADHN CCCN(C(=O)NC[C@@H]1CCCn2cc(C)nc21)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000506038927 914729235 /nfs/dbraw/zinc/72/92/35/914729235.db2.gz RQGIAEJABTZNEZ-XZOQPEGZSA-N 0 3 423.605 4.155 20 0 HIADHN COc1ccc(-c2noc([C@@H](C)NCC3(N4CCSCC4)CCCCC3)n2)cc1 ZINC000489753781 903579430 /nfs/dbraw/zinc/57/94/30/903579430.db2.gz NSVPTMGGNXLJOK-QGZVFWFLSA-N 0 3 416.591 4.148 20 0 HIADHN Cc1ccc(COc2ccc(CN(C)[C@@H](C)c3ccc(S(N)(=O)=O)cc3)cc2)cc1 ZINC000506040228 914731904 /nfs/dbraw/zinc/73/19/04/914731904.db2.gz KTKISENWMGZGEI-IBGZPJMESA-N 0 3 424.566 4.414 20 0 HIADHN CC(C)CCN(C(=O)NCc1ccccc1CN1CCC(O)CC1)C1CCCC1 ZINC000489792549 903603914 /nfs/dbraw/zinc/60/39/14/903603914.db2.gz APGNNNWBDWNZND-UHFFFAOYSA-N 0 3 401.595 4.144 20 0 HIADHN C[C@H](C1CC1)N(Cc1ccccc1)C(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000489806417 903605823 /nfs/dbraw/zinc/60/58/23/903605823.db2.gz IKXODAKPSMGZKD-HXUWFJFHSA-N 0 3 421.585 4.154 20 0 HIADHN CC(C)CN(CCc1ccccc1)C(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000489811546 903608178 /nfs/dbraw/zinc/60/81/78/903608178.db2.gz QFCQFIKWMKSCEL-UHFFFAOYSA-N 0 3 423.601 4.054 20 0 HIADHN CN(c1ccccc1)C1CCN(C(=O)N[C@@H](CN2CCCC2)c2ccccc2)CC1 ZINC000489915709 903671993 /nfs/dbraw/zinc/67/19/93/903671993.db2.gz GKAQWDKGZNIUHJ-DEOSSOPVSA-N 0 3 406.574 4.134 20 0 HIADHN C[C@@H](NC(=O)N[C@H]1c2cc(Br)ccc2CC1(C)C)C1=CCN(C)CC1 ZINC000489998944 903717714 /nfs/dbraw/zinc/71/77/14/903717714.db2.gz QSDWPWHPQVSEQP-ACJLOTCBSA-N 0 3 406.368 4.022 20 0 HIADHN Cc1ccc([C@@H]2C[C@H](C)N(CC(=O)N3CCC(C(=O)Nc4ccccc4)CC3)C2)cc1 ZINC000490079190 903761051 /nfs/dbraw/zinc/76/10/51/903761051.db2.gz JUEFVEUGORFFEW-NZQKXSOJSA-N 0 3 419.569 4.050 20 0 HIADHN Cc1ccc(C)c([C@@H](NCc2ccc([C@@]3(C)NC(=O)NC3=O)cc2)c2ccccc2)c1 ZINC000490137475 903785629 /nfs/dbraw/zinc/78/56/29/903785629.db2.gz RGMSDWKFQOWEGY-JYFHCDHNSA-N 0 3 413.521 4.237 20 0 HIADHN Cc1ccc(C)c([C@@H](NCc2cccnc2N2CCN(C)CC2)c2ccccc2)c1 ZINC000490171862 903809411 /nfs/dbraw/zinc/80/94/11/903809411.db2.gz JEQHSOZKORWARQ-VWLOTQADSA-N 0 3 400.570 4.329 20 0 HIADHN CCc1ccc([C@@H](NCCN2CCC(C)CC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000490191324 903818776 /nfs/dbraw/zinc/81/87/76/903818776.db2.gz RNWJMZACKXNJOJ-XMMPIXPASA-N 0 3 414.615 4.063 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)N[C@@H]2CCCOc3ccccc32)N(C)C)cc1 ZINC000490195546 903821132 /nfs/dbraw/zinc/82/11/32/903821132.db2.gz BMKJAYJHPADOLK-YADHBBJMSA-N 0 3 411.546 4.290 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N[C@H](c2ccccc2)c2cccnc2)C1 ZINC000490249564 903854246 /nfs/dbraw/zinc/85/42/46/903854246.db2.gz PXELHNOABFLXHX-CTUHWIOQSA-N 0 3 400.526 4.306 20 0 HIADHN CN(Cc1cn(-c2ccccc2)nc1-c1cccs1)C[C@@H](O)COCc1ccco1 ZINC000490290033 903879035 /nfs/dbraw/zinc/87/90/35/903879035.db2.gz RWTPLPCXIZODKN-HXUWFJFHSA-N 0 3 423.538 4.203 20 0 HIADHN CCNC(=O)Nc1ccc(C)c(NC(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000490329806 903917111 /nfs/dbraw/zinc/91/71/11/903917111.db2.gz FJJLTQLMMOZASR-OAQYLSRUSA-N 0 3 423.561 4.265 20 0 HIADHN CCNC(=O)Nc1ccc(C)c(NC(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)c1 ZINC000490338835 903928429 /nfs/dbraw/zinc/92/84/29/903928429.db2.gz YGZUHCASPJOZAZ-QFIPXVFZSA-N 0 3 423.561 4.403 20 0 HIADHN CCNC(=O)Nc1ccc(C)c(NC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)c1 ZINC000490351356 903944407 /nfs/dbraw/zinc/94/44/07/903944407.db2.gz BOOFVINRKCKYBW-LJQANCHMSA-N 0 3 423.561 4.265 20 0 HIADHN C[C@@H]1C[C@@H](CN2CCC[C@@H]2c2nc(Cc3ccc(Br)cc3)no2)CCO1 ZINC000490355356 903949646 /nfs/dbraw/zinc/94/96/46/903949646.db2.gz PTNRUVIVCSDCIA-UWWQBHOKSA-N 0 3 420.351 4.375 20 0 HIADHN CN(C)[C@@H](CNC(=O)N1CCCC[C@H]1c1nc(-c2ccccc2)no1)c1ccccc1 ZINC000490360158 903952611 /nfs/dbraw/zinc/95/26/11/903952611.db2.gz BVZLUJWKKHRAGS-SFTDATJTSA-N 0 3 419.529 4.276 20 0 HIADHN Brc1ccc(CN2CCC[C@H](c3nnc(C4CC4)[nH]3)C2)c2ncccc12 ZINC000490405073 903988873 /nfs/dbraw/zinc/98/88/73/903988873.db2.gz VEOWIEFSIVUUKI-HNNXBMFYSA-N 0 3 412.335 4.372 20 0 HIADHN Cc1ccc2c(c1)[C@@H](N[C@@H](C)c1ccc(Br)c(S(N)(=O)=O)c1)CCC2 ZINC000490436689 904009816 /nfs/dbraw/zinc/00/98/16/904009816.db2.gz SKNMXQFWZYWVSJ-UGSOOPFHSA-N 0 3 423.376 4.133 20 0 HIADHN O=C(NC1CCN(Cc2ccccc2)CC1)c1c(F)ccc(Br)c1F ZINC000490449302 904016294 /nfs/dbraw/zinc/01/62/94/904016294.db2.gz ZOZHBTKRRHMWBJ-UHFFFAOYSA-N 0 3 409.274 4.122 20 0 HIADHN Cn1nc(-c2ccc(Cl)s2)cc1NC(=O)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000490497118 904049286 /nfs/dbraw/zinc/04/92/86/904049286.db2.gz ZIDXIZRFCLBZQR-HNNXBMFYSA-N 0 3 415.950 4.198 20 0 HIADHN Cn1nc(-c2ccc(Cl)s2)cc1NC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000490528535 904076743 /nfs/dbraw/zinc/07/67/43/904076743.db2.gz SDOIVCGJSBVCLP-IFXJQAMLSA-N 0 3 415.950 4.369 20 0 HIADHN Cc1n[nH]c(C)c1[C@@H]1CCCCCN1C(=O)CCCN1CCN(c2ccccc2)CC1 ZINC000490634582 904148064 /nfs/dbraw/zinc/14/80/64/904148064.db2.gz DENDLHZSKQCPLX-QHCPKHFHSA-N 0 3 423.605 4.073 20 0 HIADHN O=C1C[C@H]([C@H]2CCCCN2Cc2csc(-c3cccc(Br)c3)n2)CN1 ZINC000490668644 904164862 /nfs/dbraw/zinc/16/48/62/904164862.db2.gz CKYPCJDQKMSZSB-WMLDXEAASA-N 0 3 420.376 4.063 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2cnn(Cc3ccccc3)c2)N2CCCC2)cc1 ZINC000490684638 904171342 /nfs/dbraw/zinc/17/13/42/904171342.db2.gz PEVOFDVQSZOBGW-HSZRJFAPSA-N 0 3 403.530 4.198 20 0 HIADHN COc1ccccc1-c1ncc(CNCCC(=O)Nc2cccc(Cl)c2C)cn1 ZINC000490772365 904224286 /nfs/dbraw/zinc/22/42/86/904224286.db2.gz QJVMNGDBENKDIY-UHFFFAOYSA-N 0 3 410.905 4.232 20 0 HIADHN COc1ccccc1-c1ncc(CNCCc2nc(-c3ccc(Cl)cc3)no2)cn1 ZINC000490886996 904303914 /nfs/dbraw/zinc/30/39/14/904303914.db2.gz POEVFPUMKJEIEV-UHFFFAOYSA-N 0 3 421.888 4.188 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCC(COC)CC1)c1ccc(C(F)(F)F)cc1 ZINC000490952982 904332734 /nfs/dbraw/zinc/33/27/34/904332734.db2.gz TZMAVSNETHXVJU-LJQANCHMSA-N 0 3 415.500 4.156 20 0 HIADHN CC(C)N(Cc1ccc([S@@](C)=O)cc1)C[C@H](O)COc1cccc2ccccc21 ZINC000506099413 914803243 /nfs/dbraw/zinc/80/32/43/914803243.db2.gz QDQZWTPPUKVOEG-KCWXNJEJSA-N 0 3 411.567 4.228 20 0 HIADHN Cc1ccc([C@@H](NC[C@@H](O)C2CCCCC2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000491003907 904364946 /nfs/dbraw/zinc/36/49/46/904364946.db2.gz GPFLOMIUUOCYKD-RPWUZVMVSA-N 0 3 415.599 4.327 20 0 HIADHN CCN(CCN[C@@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1)C(C)C ZINC000491012037 904367305 /nfs/dbraw/zinc/36/73/05/904367305.db2.gz WWUBUSUEPRYMSV-NRFANRHFSA-N 0 3 408.995 4.153 20 0 HIADHN COC(=O)CCn1nc(C)c(CN2CCC(c3nc4ccccc4s3)CC2)c1C ZINC000506113262 914808680 /nfs/dbraw/zinc/80/86/80/914808680.db2.gz MICSTSXYTZKUBR-UHFFFAOYSA-N 0 3 412.559 4.052 20 0 HIADHN CCc1ccc([C@H](N[C@H](C)C[C@@H]2CCCO2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000491024523 904375077 /nfs/dbraw/zinc/37/50/77/904375077.db2.gz SUCJSVQSKMOCKE-FHZYATBESA-N 0 3 401.572 4.289 20 0 HIADHN CCOc1ccc([C@H](N[C@H](C)CN2CCN(C)CC2)c2ccccc2Cl)cc1 ZINC000491024569 904375472 /nfs/dbraw/zinc/37/54/72/904375472.db2.gz UEFHSIQMLYSHPN-JPYJTQIMSA-N 0 3 401.982 4.054 20 0 HIADHN CCN(CC)C[C@@H](C)N[C@@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000491038958 904390503 /nfs/dbraw/zinc/39/05/03/904390503.db2.gz QKSDSBCJCKVRMR-IERDGZPVSA-N 0 3 408.995 4.153 20 0 HIADHN CC[C@@H](C)N(C)CCN[C@H](c1cccc(S(C)(=O)=O)c1)c1ccc(C)cc1C ZINC000491050402 904395171 /nfs/dbraw/zinc/39/51/71/904395171.db2.gz HPJUCVGRTOTHFS-AUSIDOKSSA-N 0 3 402.604 4.116 20 0 HIADHN CCc1nc(CCN[C@@H](c2ccc(C)cc2)c2cccc(S(C)(=O)=O)c2)cs1 ZINC000491058820 904402250 /nfs/dbraw/zinc/40/22/50/904402250.db2.gz YRWVEUAHQLTJGF-QFIPXVFZSA-N 0 3 414.596 4.339 20 0 HIADHN COc1c(C)cc(CN(C)C(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)cc1C ZINC000506127862 914815035 /nfs/dbraw/zinc/81/50/35/914815035.db2.gz VNPXILBMCYXBLY-UHFFFAOYSA-N 0 3 409.574 4.115 20 0 HIADHN CCNC(=O)COc1ccc(CN(C)Cc2c3ccccc3oc2CC)cc1OC ZINC000506123546 914812579 /nfs/dbraw/zinc/81/25/79/914812579.db2.gz BDLBNSKUUXXKGE-UHFFFAOYSA-N 0 3 410.514 4.151 20 0 HIADHN C[C@@H]1CN(C[C@H]2CCCN2Cc2ccc(Br)c3cccnc23)C[C@H](C)O1 ZINC000491194937 904477609 /nfs/dbraw/zinc/47/76/09/904477609.db2.gz RDPWBSZLFJYSTO-SOLBZPMBSA-N 0 3 418.379 4.071 20 0 HIADHN FC(F)(F)c1ccc2nnc([C@@H]3CCCN(CC4=Cc5ccccc5OC4)C3)n2c1 ZINC000506128560 914815469 /nfs/dbraw/zinc/81/54/69/914815469.db2.gz HYRVCCAMOGRKPI-QGZVFWFLSA-N 0 3 414.431 4.404 20 0 HIADHN CC1CCN(CCCN[C@H](c2ccc(F)cc2)c2cccc(S(C)(=O)=O)c2)CC1 ZINC000491259049 904506795 /nfs/dbraw/zinc/50/67/95/904506795.db2.gz HPQWVHSZTRVXPE-HSZRJFAPSA-N 0 3 418.578 4.030 20 0 HIADHN Cc1ccc([C@H](NCCCOCC2CC2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000491269519 904511439 /nfs/dbraw/zinc/51/14/39/904511439.db2.gz BSGSQMHQMLWSHL-HSZRJFAPSA-N 0 3 401.572 4.203 20 0 HIADHN CC(=O)N1CC[C@H](NCc2c(C)nn(Cc3ccccc3)c2C)c2ccccc2C1 ZINC000491270672 904511497 /nfs/dbraw/zinc/51/14/97/904511497.db2.gz IZWBSEYRFGQHDL-VWLOTQADSA-N 0 3 402.542 4.131 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](NCCCOCC2CC2)c2ccc(Cl)cc2)c1 ZINC000491270087 904511637 /nfs/dbraw/zinc/51/16/37/904511637.db2.gz FVWSYEYJNJVUQQ-OAQYLSRUSA-N 0 3 407.963 4.239 20 0 HIADHN COc1ccc([C@H](CNC(=O)CN2CC[C@H](C3CC3)C2)c2c[nH]c3ccccc32)cc1 ZINC000491277047 904515545 /nfs/dbraw/zinc/51/55/45/904515545.db2.gz HGEKVPNPVQBOQS-REWPJTCUSA-N 0 3 417.553 4.157 20 0 HIADHN COc1cccc([C@H](CN[C@H](c2cnn(C)c2)c2cccc(F)c2)N2CCCC2)c1 ZINC000491309889 904528893 /nfs/dbraw/zinc/52/88/93/904528893.db2.gz ZPGQOPMZJCGLSD-ZEQRLZLVSA-N 0 3 408.521 4.084 20 0 HIADHN COCCN1CCC(NC(=O)Nc2ccc(F)cc2-c2ccc(Cl)cc2)CC1 ZINC000491323154 904536439 /nfs/dbraw/zinc/53/64/39/904536439.db2.gz MJLVUYKUYWKFBD-UHFFFAOYSA-N 0 3 405.901 4.378 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)[C@H]2CN(Cc3ccccc3)CCC2(F)F)cc1Cl ZINC000506140365 914820568 /nfs/dbraw/zinc/82/05/68/914820568.db2.gz AWOSQSVELVDWLS-QGZVFWFLSA-N 0 3 421.875 4.394 20 0 HIADHN O=C(NCc1ccccc1OC(F)F)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000506141447 914821473 /nfs/dbraw/zinc/82/14/73/914821473.db2.gz WSJXLDWFNTXINY-KRWDZBQOSA-N 0 3 410.411 4.062 20 0 HIADHN CC(=O)N1CCC(N[C@@H](c2ccc(Br)cc2)c2ccccc2F)CC1 ZINC000491355697 904553584 /nfs/dbraw/zinc/55/35/84/904553584.db2.gz IGMFJXQZCIOCEM-FQEVSTJZSA-N 0 3 405.311 4.278 20 0 HIADHN CC(C)(CN[C@H](c1ccc(F)cc1)c1cccc(S(C)(=O)=O)c1)N1CCCCC1 ZINC000491365324 904560201 /nfs/dbraw/zinc/56/02/01/904560201.db2.gz DGFDWEBAKOBPHO-JOCHJYFZSA-N 0 3 418.578 4.173 20 0 HIADHN Clc1ccc(-c2nc(CCNCc3cnnn3Cc3ccccc3)cs2)cc1 ZINC000491363636 904560447 /nfs/dbraw/zinc/56/04/47/904560447.db2.gz WOSSMPVYTLAHLV-UHFFFAOYSA-N 0 3 409.946 4.436 20 0 HIADHN COc1ccc([C@H](CN[C@@H](c2cnn(C)c2)c2cccc(F)c2)N2CCCCC2)cc1 ZINC000491370363 904562132 /nfs/dbraw/zinc/56/21/32/904562132.db2.gz ZSVPBJOARPUCBN-LOSJGSFVSA-N 0 3 422.548 4.474 20 0 HIADHN Cc1ccc([C@H](NCC(C)(C)N2CCCCC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000491370157 904562255 /nfs/dbraw/zinc/56/22/55/904562255.db2.gz YNPAJDMSUOITTI-QHCPKHFHSA-N 0 3 414.615 4.342 20 0 HIADHN C[C@H](c1cccc(N2CCCS2(=O)=O)c1)N(C)Cc1cccc(OC(F)F)c1 ZINC000491390534 904574433 /nfs/dbraw/zinc/57/44/33/904574433.db2.gz VZKAZEIPTRWXRE-OAHLLOKOSA-N 0 3 410.486 4.021 20 0 HIADHN COc1ccccc1CCN[C@@H](c1ccc(F)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000491410875 904583128 /nfs/dbraw/zinc/58/31/28/904583128.db2.gz SHXUIMMFDOFCMX-QHCPKHFHSA-N 0 3 413.514 4.160 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)N2CCCC[C@@H]2c2ccc(C(C)C)cc2)CC1 ZINC000491425104 904590349 /nfs/dbraw/zinc/59/03/49/904590349.db2.gz VWEVRVUONWJGFD-XUZZJYLKSA-N 0 3 414.638 4.320 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)cc1CN1CCC(C(=O)Nc2ccccc2O)CC1 ZINC000506153733 914826897 /nfs/dbraw/zinc/82/68/97/914826897.db2.gz RTKBVQZEVPJQQP-UHFFFAOYSA-N 0 3 424.932 4.390 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)Nc2ccc(-n3cccn3)c(Cl)c2)c1 ZINC000491501745 904625443 /nfs/dbraw/zinc/62/54/43/904625443.db2.gz ATNPDAJSARUTEP-UHFFFAOYSA-N 0 3 411.937 4.430 20 0 HIADHN COc1ccccc1C(C)(C)NC(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000491502828 904627941 /nfs/dbraw/zinc/62/79/41/904627941.db2.gz UIJQEBBNEIFWJE-UHFFFAOYSA-N 0 3 413.587 4.343 20 0 HIADHN c1csc(-c2noc(CCCN3CCN(C[C@H]4C[C@H]4c4ccccc4)CC3)n2)c1 ZINC000506158648 914828631 /nfs/dbraw/zinc/82/86/31/914828631.db2.gz AXDRAFWFTRQOBM-UXHICEINSA-N 0 3 408.571 4.152 20 0 HIADHN C[C@H](NC(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1)c1cccc(O)c1 ZINC000491829299 904702353 /nfs/dbraw/zinc/70/23/53/904702353.db2.gz BGVBOYCINQXIEZ-HNNXBMFYSA-N 0 3 409.452 4.245 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)Nc3ccc(Oc4ccc(C(F)(F)F)cc4)nc3)[C@@H]2C1 ZINC000492081391 904793264 /nfs/dbraw/zinc/79/32/64/904793264.db2.gz OQMVLIQSFGGTKG-RDTXWAMCSA-N 0 3 420.435 4.451 20 0 HIADHN O=S(=O)(Cc1ccccc1CN[C@@H]1CCc2cc(Cl)ccc21)N1CCCC1 ZINC000506202694 914843692 /nfs/dbraw/zinc/84/36/92/914843692.db2.gz ILRPDBNKXHOGFY-OAQYLSRUSA-N 0 3 404.963 4.043 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)Nc3ccc(Oc4cccc(C(F)(F)F)n4)cc3)[C@H]2C1 ZINC000492236524 904820701 /nfs/dbraw/zinc/82/07/01/904820701.db2.gz IBUKSLTUWZGLKD-YOEHRIQHSA-N 0 3 420.435 4.451 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)Nc3ccc(Oc4cccc(C(F)(F)F)n4)cc3)[C@@H]2C1 ZINC000492236522 904820952 /nfs/dbraw/zinc/82/09/52/904820952.db2.gz IBUKSLTUWZGLKD-RHSMWYFYSA-N 0 3 420.435 4.451 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)C[C@@H](C)c1c(C)n[nH]c1C ZINC000492594392 904874732 /nfs/dbraw/zinc/87/47/32/904874732.db2.gz ZEZDBTQSKKHNMY-IIBYNOLFSA-N 0 3 420.561 4.111 20 0 HIADHN Cc1nc(-c2ccccc2)sc1CNC(=O)N[C@@H](CN(C)C)c1ccc(F)cc1 ZINC000492599919 904874863 /nfs/dbraw/zinc/87/48/63/904874863.db2.gz FJZFESGABZPEFX-IBGZPJMESA-N 0 3 412.534 4.360 20 0 HIADHN COc1cc(OC)cc(N2CC[C@@H](CN[C@@H](c3ccccc3)c3ccccn3)C2)c1 ZINC000493011251 904989201 /nfs/dbraw/zinc/98/92/01/904989201.db2.gz UGVUBCNWULNIES-DFBJGRDBSA-N 0 3 403.526 4.304 20 0 HIADHN Cc1ccc([C@H](NC[C@@](C)(O)CCC(C)C)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000493037842 905000057 /nfs/dbraw/zinc/00/00/57/905000057.db2.gz RZGTVDKGUGLSLC-GOTSBHOMSA-N 0 3 403.588 4.265 20 0 HIADHN Cc1nc(CCN[C@H](c2ccc(F)cc2)c2cccc(S(C)(=O)=O)c2)sc1C ZINC000493053599 905004860 /nfs/dbraw/zinc/00/48/60/905004860.db2.gz GUKMDEWIQMPCOR-OAQYLSRUSA-N 0 3 418.559 4.224 20 0 HIADHN CCc1ccc([C@@H](NC[C@@H](OC)C(C)(C)C)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000493059712 905006434 /nfs/dbraw/zinc/00/64/34/905006434.db2.gz PBBLFTSOJGKLTD-FGZHOGPDSA-N 0 3 403.588 4.393 20 0 HIADHN Cc1ccc([C@@H](NCC2(O)CCCCCC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000493062505 905006480 /nfs/dbraw/zinc/00/64/80/905006480.db2.gz SYSAGXHROGDXLC-JOCHJYFZSA-N 0 3 401.572 4.163 20 0 HIADHN Cc1ccc(Br)cc1NC(=O)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000493071021 905008750 /nfs/dbraw/zinc/00/87/50/905008750.db2.gz KCXBGIDNOZCADU-UHFFFAOYSA-N 0 3 417.347 4.214 20 0 HIADHN CCc1ccc([C@H](NCC2(O)CCCCCC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000493076864 905009611 /nfs/dbraw/zinc/00/96/11/905009611.db2.gz FIEDXUHMGWFPJF-QHCPKHFHSA-N 0 3 415.599 4.417 20 0 HIADHN CO[C@]1(C)C[C@H](N[C@@H](c2ccc(C)cc2)c2cccc(S(C)(=O)=O)c2)C1(C)C ZINC000493106532 905019744 /nfs/dbraw/zinc/01/97/44/905019744.db2.gz UYTIMCNOWXHBJX-QNWVGRARSA-N 0 3 401.572 4.281 20 0 HIADHN NC(=O)CCN(Cc1ccccc1)Cc1cccc(NC(=O)c2ccccc2Cl)c1 ZINC000506261232 914869712 /nfs/dbraw/zinc/86/97/12/914869712.db2.gz FDVQHFMQMBIOSN-UHFFFAOYSA-N 0 3 421.928 4.470 20 0 HIADHN CCOc1ccc([C@H](NC2CCN(C(=O)COC)CC2)c2ccccc2Cl)cc1 ZINC000493250891 905066999 /nfs/dbraw/zinc/06/69/99/905066999.db2.gz SRQXEKQGKZCEIN-QHCPKHFHSA-N 0 3 416.949 4.055 20 0 HIADHN CC(C)C[C@H](CCO)CN[C@@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000493251686 905069679 /nfs/dbraw/zinc/06/96/79/905069679.db2.gz VENHOQSFZVCXAH-JTSKRJEESA-N 0 3 424.006 4.467 20 0 HIADHN Cc1ccc([C@H](NC[C@H](CCO)c2ccccc2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000493275959 905072893 /nfs/dbraw/zinc/07/28/93/905072893.db2.gz DPENNUSBMUFQHE-ZCYQVOJMSA-N 0 3 423.578 4.244 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](NCCC2CCOCC2)c2ccc(Cl)cc2)c1 ZINC000493278458 905076152 /nfs/dbraw/zinc/07/61/52/905076152.db2.gz UTVFGBRGBHAJNO-OAQYLSRUSA-N 0 3 407.963 4.239 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N[C@H](C)CCCC(F)(F)F)c(C)c2)CC1 ZINC000493332942 905089015 /nfs/dbraw/zinc/08/90/15/905089015.db2.gz DKMPZBXKBHKDGW-MRXNPFEDSA-N 0 3 400.489 4.380 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)c3cccc(Oc4ccc(Cl)c(Cl)c4)n3)[C@@H]2C1 ZINC000493345451 905091630 /nfs/dbraw/zinc/09/16/30/905091630.db2.gz XVGYSYXDVCYMAB-FZKQIMNGSA-N 0 3 406.313 4.347 20 0 HIADHN CC(C)Oc1cc(F)ccc1NC(=O)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000493370405 905095547 /nfs/dbraw/zinc/09/55/47/905095547.db2.gz ROKFPVCAMHXZMX-UHFFFAOYSA-N 0 3 400.494 4.070 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)c3ccc(CSc4nc5ccccc5[nH]4)cc3)[C@@H]2C1 ZINC000493436473 905118493 /nfs/dbraw/zinc/11/84/93/905118493.db2.gz CRUTXCSZWOLKHT-LAUBAEHRSA-N 0 3 406.555 4.021 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)c3ccc(Oc4cccc(Br)c4)cc3)[C@@H]2C1 ZINC000493537675 905153040 /nfs/dbraw/zinc/15/30/40/905153040.db2.gz XYPIKMCMMKJYHX-MGPUTAFESA-N 0 3 415.331 4.408 20 0 HIADHN COc1ccc(OCCN2CCC[C@@H](c3nnc4ccc(C(F)(F)F)cn43)C2)cc1 ZINC000493602033 905170573 /nfs/dbraw/zinc/17/05/73/905170573.db2.gz FUDXQAJKUKEOSM-OAHLLOKOSA-N 0 3 420.435 4.015 20 0 HIADHN Cc1nc2ccc(Br)cc2c(N[C@@H]2CCOC3(CCOCC3)C2)c1C ZINC000493606064 905172824 /nfs/dbraw/zinc/17/28/24/905172824.db2.gz ONIJTIOYDFZUJH-MRXNPFEDSA-N 0 3 405.336 4.176 20 0 HIADHN CC(C)Cc1noc(-c2cc(Cl)ccc2NC(=O)N2CC[C@H]3CCN(C)C[C@H]32)n1 ZINC000493835888 905228962 /nfs/dbraw/zinc/22/89/62/905228962.db2.gz NUALEXCUJOZNRE-RDTXWAMCSA-N 0 3 417.941 4.146 20 0 HIADHN Fc1cccc(OCCN2CCC[C@@H](c3nnc4ccc(C(F)(F)F)cn43)C2)c1 ZINC000493873950 905237488 /nfs/dbraw/zinc/23/74/88/905237488.db2.gz NNBIEIMVWNVMOS-CQSZACIVSA-N 0 3 408.399 4.146 20 0 HIADHN Cc1cc(F)ccc1N1CCC[C@H](N[C@@H]2CCO[C@H]2c2ccc(F)c(F)c2)C1=O ZINC000493951589 905302896 /nfs/dbraw/zinc/30/28/96/905302896.db2.gz CMYOQCCGEKEABY-DYXWJJEUSA-N 0 3 404.432 4.028 20 0 HIADHN Cc1cc(C[C@H](C)N[C@@H](c2ccc(Cl)cc2)c2cccc(S(C)(=O)=O)c2)[nH]n1 ZINC000493989320 905331857 /nfs/dbraw/zinc/33/18/57/905331857.db2.gz KPNFMJLNDCLWNN-QKKBWIMNSA-N 0 3 417.962 4.085 20 0 HIADHN Cc1cc(C[C@H](C)N[C@@H](c2ccc(Cl)cc2)c2cccc(S(C)(=O)=O)c2)n[nH]1 ZINC000493989320 905331867 /nfs/dbraw/zinc/33/18/67/905331867.db2.gz KPNFMJLNDCLWNN-QKKBWIMNSA-N 0 3 417.962 4.085 20 0 HIADHN CC(C)c1noc(-c2ccccc2C(=O)N[C@H]2CCN(Cc3ccccc3)[C@H]2C)n1 ZINC000493997615 905339191 /nfs/dbraw/zinc/33/91/91/905339191.db2.gz ATVQAOMRCCFPJZ-UWJYYQICSA-N 0 3 404.514 4.253 20 0 HIADHN COCCC(=O)N1CCC(N[C@H](c2ccc(OC)cc2)c2ccccc2Cl)CC1 ZINC000493997360 905339427 /nfs/dbraw/zinc/33/94/27/905339427.db2.gz VLZYKXFHLRUDTM-HSZRJFAPSA-N 0 3 416.949 4.055 20 0 HIADHN C[C@@H]1[C@H](NC(=O)c2[nH]c3ccccc3c2Br)CCN1Cc1ccccc1 ZINC000494006865 905348938 /nfs/dbraw/zinc/34/89/38/905348938.db2.gz MEZQWPKZQRIAKF-RHSMWYFYSA-N 0 3 412.331 4.323 20 0 HIADHN CCc1ccc([C@@H](NCC(C)(C)C[C@@H](C)O)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000494018788 905357431 /nfs/dbraw/zinc/35/74/31/905357431.db2.gz FIFOPQYDAFSQHH-VGOFRKELSA-N 0 3 403.588 4.129 20 0 HIADHN CC(C)C(=O)NC[C@H]1CCCN(Cc2cn(Cc3ccccc3)nc2C(C)(C)C)C1 ZINC000512405122 921139674 /nfs/dbraw/zinc/13/96/74/921139674.db2.gz XXZNWTBFCICDPN-OAQYLSRUSA-N 0 3 410.606 4.213 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)c2cc(NC(=O)C(C)(C)C)ccc2F)CCN1Cc1ccccc1 ZINC000494046241 905385672 /nfs/dbraw/zinc/38/56/72/905385672.db2.gz FFHJPOBRBQYVTG-IERDGZPVSA-N 0 3 411.521 4.203 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](NCCC[C@@H]2CCCC[C@H]2O)c2ccc(F)cc2)c1 ZINC000494046363 905385930 /nfs/dbraw/zinc/38/59/30/905385930.db2.gz DBCVRCCRDKEHRX-JJEOQYAHSA-N 0 3 419.562 4.240 20 0 HIADHN CC(C)n1ncc2c1nc(C1CC1)cc2C(=O)N[C@@H]1CCN(Cc2ccccc2)[C@@H]1C ZINC000494070613 905408427 /nfs/dbraw/zinc/40/84/27/905408427.db2.gz XYTNCPQJFNPJCI-VGOFRKELSA-N 0 3 417.557 4.282 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)c2ccnc(SCC(F)(F)F)c2)CC1 ZINC000494075740 905413527 /nfs/dbraw/zinc/41/35/27/905413527.db2.gz RWRGJPOYGXHIRV-UHFFFAOYSA-N 0 3 413.465 4.066 20 0 HIADHN Cc1ccc(-c2nc(CC(=O)N[C@H]3CCN(Cc4ccccc4)[C@@H]3C)cs2)cc1 ZINC000494078064 905415090 /nfs/dbraw/zinc/41/50/90/905415090.db2.gz JIUXMBXENWHNSR-GCJKJVERSA-N 0 3 405.567 4.440 20 0 HIADHN Cc1ccc(-c2nc(CC(=O)N[C@H]3CCN(Cc4ccccc4)[C@H]3C)cs2)cc1 ZINC000494078059 905415325 /nfs/dbraw/zinc/41/53/25/905415325.db2.gz JIUXMBXENWHNSR-AVRDEDQJSA-N 0 3 405.567 4.440 20 0 HIADHN Cc1ccc(C(F)(F)F)cc1NC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1CO ZINC000494109500 905456059 /nfs/dbraw/zinc/45/60/59/905456059.db2.gz UMKGBMIHFKFDRP-MJGOQNOKSA-N 0 3 421.463 4.018 20 0 HIADHN CCCn1ccc2ccc(NC(=O)N[C@@H]3CCN(Cc4ccccc4)C[C@H]3CO)cc21 ZINC000494152231 905489689 /nfs/dbraw/zinc/48/96/89/905489689.db2.gz IITWDGXHDRIJLU-JTHBVZDNSA-N 0 3 420.557 4.056 20 0 HIADHN Cc1nc2ccc(C[NH2+]Cc3nnc(-c4ccc(Br)cc4)[n-]3)cc2s1 ZINC000494197628 905531726 /nfs/dbraw/zinc/53/17/26/905531726.db2.gz HEWVRBQSCMCEKP-UHFFFAOYSA-N 0 3 414.332 4.442 20 0 HIADHN O=C(Nc1ccccc1OC1CCCC1)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1CO ZINC000494203448 905535945 /nfs/dbraw/zinc/53/59/45/905535945.db2.gz CQKAYYFIWFFOSK-RBBKRZOGSA-N 0 3 423.557 4.013 20 0 HIADHN CC(=O)c1c(C)cc(C)c(CN[C@@H]2CC(=O)N(C)[C@H]2c2ccc(F)c(F)c2)c1C ZINC000494208925 905539556 /nfs/dbraw/zinc/53/95/56/905539556.db2.gz OIBPRTFHLYHHRA-OFNKIYASSA-N 0 3 400.469 4.154 20 0 HIADHN C[C@@H](O)C[C@@H]1CCCCCN1CC(=O)Nc1cccc(CSc2ccccn2)c1 ZINC000512434171 921158098 /nfs/dbraw/zinc/15/80/98/921158098.db2.gz UZLDAVXYYUWODA-NQIIRXRSSA-N 0 3 413.587 4.328 20 0 HIADHN CCCC(=O)NC[C@@H]1CCCN(Cc2cccc(NC(=O)c3ccc(OC)cc3)c2)C1 ZINC000512434642 921158166 /nfs/dbraw/zinc/15/81/66/921158166.db2.gz ZNOOVBCUPVONNW-FQEVSTJZSA-N 0 3 423.557 4.076 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cnn(-c2ccncc2)c1C(F)F)c1ccsc1 ZINC000494290655 905612319 /nfs/dbraw/zinc/61/23/19/905612319.db2.gz NVSAVNHLXNUKNW-KRWDZBQOSA-N 0 3 419.501 4.079 20 0 HIADHN Cc1nc2ccc(CNCc3ccc(C(=O)N4C[C@@H](C)O[C@H](C)C4)cc3)cc2s1 ZINC000494314617 905629797 /nfs/dbraw/zinc/62/97/97/905629797.db2.gz PZOWUCLOIMQYHF-HZPDHXFCSA-N 0 3 409.555 4.144 20 0 HIADHN CN1CCN(CCCNC(=O)[C@@H]2C[C@H]2c2ccc(Cl)s2)[C@H](c2ccccc2)C1 ZINC000494321309 905634734 /nfs/dbraw/zinc/63/47/34/905634734.db2.gz YYQCOGVSOKHMLJ-QRVBRYPASA-N 0 3 418.006 4.000 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N[C@@H](C)c2nc(C(F)(F)F)cs2)C1 ZINC000494429903 905716399 /nfs/dbraw/zinc/71/63/99/905716399.db2.gz LKFUZORELJSBEB-GUTXKFCHSA-N 0 3 412.481 4.358 20 0 HIADHN C[C@H](N[C@H]1CCO[C@H]1c1ccc(Cl)cc1)C(=O)N1CCSc2ccccc21 ZINC000494476180 905757061 /nfs/dbraw/zinc/75/70/61/905757061.db2.gz UYLSMIKOYBBLJB-VHFSOBRXSA-N 0 3 402.947 4.287 20 0 HIADHN Cc1cccc2sc(N(Cc3ccccc3)C(=O)CN[C@@H]3CCO[C@@H]3C3CC3)nc21 ZINC000494475805 905757579 /nfs/dbraw/zinc/75/75/79/905757579.db2.gz MXBIFEHHNKTKSQ-AUSIDOKSSA-N 0 3 421.566 4.295 20 0 HIADHN Cc1cccc(S(=O)(=O)CCCN[C@H]2CCO[C@H]2c2ccc(Cl)c(F)c2)c1 ZINC000494477737 905759110 /nfs/dbraw/zinc/75/91/10/905759110.db2.gz ROBGSORAWDCIJZ-PMACEKPBSA-N 0 3 411.926 4.071 20 0 HIADHN Cc1ccc2nc(-c3ccc(NC(=O)CN[C@@H]4CCO[C@H]4C4CC4)cc3)sc2c1 ZINC000494486416 905770682 /nfs/dbraw/zinc/77/06/82/905770682.db2.gz UKOSKKQXLKDANA-KNQAVFIVSA-N 0 3 407.539 4.367 20 0 HIADHN C[C@H](N[C@@H]1CCO[C@H]1c1ccc(Cl)cc1)C(=O)Nc1ccc(OC(F)F)cc1 ZINC000494493895 905781077 /nfs/dbraw/zinc/78/10/77/905781077.db2.gz JVHPYLBCSPOLAA-RZAIGCCYSA-N 0 3 410.848 4.388 20 0 HIADHN C[C@H](N[C@@H]1CCO[C@@H]1c1ccc(Cl)cc1)C(=O)Nc1ccc(OC(F)F)cc1 ZINC000494493893 905781963 /nfs/dbraw/zinc/78/19/63/905781963.db2.gz JVHPYLBCSPOLAA-JBBXEZCESA-N 0 3 410.848 4.388 20 0 HIADHN CCOc1ccc(CN2CCC[C@H](CNC(=O)Nc3cccc(F)c3)C2)cc1OC ZINC000512462641 921176853 /nfs/dbraw/zinc/17/68/53/921176853.db2.gz LOOWGULTEFSLLR-GOSISDBHSA-N 0 3 415.509 4.267 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N(C)Cc1cccc2[nH]ccc21)c1cccc(OC)c1 ZINC000494561973 905837027 /nfs/dbraw/zinc/83/70/27/905837027.db2.gz KHWIOMGGBRFJFF-QHCPKHFHSA-N 0 3 408.546 4.401 20 0 HIADHN CCCC(=O)NC[C@@H]1CCCN(Cc2ccc(OCc3cccs3)c(OC)c2)C1 ZINC000512475235 921185203 /nfs/dbraw/zinc/18/52/03/921185203.db2.gz QTRAUQDTOQTDEQ-IBGZPJMESA-N 0 3 416.587 4.464 20 0 HIADHN C[C@@H]1CN(C2CCOCC2)CCN1C(=O)N[C@@H](CC(C)(C)C)c1ccc(F)cc1 ZINC000494660216 905888115 /nfs/dbraw/zinc/88/81/15/905888115.db2.gz FEMUWKRZWOBJOW-UTKZUKDTSA-N 0 3 405.558 4.198 20 0 HIADHN C[C@H](NC(=O)N1CCN(C2CCOCC2)C[C@@H]1C)C(c1ccccc1)c1ccccc1 ZINC000494683363 905898525 /nfs/dbraw/zinc/89/85/25/905898525.db2.gz VTROLJWJVPSIDO-SFTDATJTSA-N 0 3 421.585 4.102 20 0 HIADHN CCOCCC1(CN[C@@H](c2cccc(S(C)(=O)=O)c2)c2ccc(F)c(F)c2)CC1 ZINC000494744368 905942831 /nfs/dbraw/zinc/94/28/31/905942831.db2.gz DFYZJRQUPBINHK-NRFANRHFSA-N 0 3 423.525 4.254 20 0 HIADHN CN(C)CCN(Cc1cccc(O)c1)C(=O)c1ccc(COc2ccccc2)cc1 ZINC000494771228 905969112 /nfs/dbraw/zinc/96/91/12/905969112.db2.gz SKDNYOVETTYCEP-UHFFFAOYSA-N 0 3 404.510 4.175 20 0 HIADHN C[C@@H]1CCN(C)CCN1C(=O)NC[C@H](OCc1ccccc1)c1ccc(Cl)cc1 ZINC000494782592 905982492 /nfs/dbraw/zinc/98/24/92/905982492.db2.gz CEWNWESIADUZIQ-GCJKJVERSA-N 0 3 415.965 4.334 20 0 HIADHN CSC[C@@H](O)CN[C@H](COc1cccc(F)c1)c1cccc(C(F)(F)F)c1 ZINC000494793551 905995052 /nfs/dbraw/zinc/99/50/52/905995052.db2.gz VHLIHYOEJDTEIC-FUHWJXTLSA-N 0 3 403.441 4.278 20 0 HIADHN Cc1csc2nc(CN(Cc3cccc(Br)c3)C(C)C)cc(=O)n12 ZINC000512502447 921203300 /nfs/dbraw/zinc/20/33/00/921203300.db2.gz AIFQJHVEJQCKSB-UHFFFAOYSA-N 0 3 406.349 4.238 20 0 HIADHN CC1(C)C[C@H](N[C@H](c2ccc(Cl)cc2)c2cccc(S(C)(=O)=O)c2)CCO1 ZINC000494945585 906117952 /nfs/dbraw/zinc/11/79/52/906117952.db2.gz AVPJBLBTRMPKSW-UYAOXDASSA-N 0 3 407.963 4.380 20 0 HIADHN CC1(C)C[C@@H](N[C@@H](c2cccc(S(C)(=O)=O)c2)c2ccc(F)c(F)c2)CCO1 ZINC000494949282 906121679 /nfs/dbraw/zinc/12/16/79/906121679.db2.gz KFBSRRQWHOGNHN-JXFKEZNVSA-N 0 3 409.498 4.005 20 0 HIADHN C[C@H](NC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1)[C@@H]1OCCc2sccc21 ZINC000494972058 906139785 /nfs/dbraw/zinc/13/97/85/906139785.db2.gz FZMMFMJDPHOOPX-KPLVRAHFSA-N 0 3 413.587 4.056 20 0 HIADHN CNC(=O)CCOC1CCN(Cc2cnc(-c3ccc(C(C)C)cc3)s2)CC1 ZINC000494973618 906141251 /nfs/dbraw/zinc/14/12/51/906141251.db2.gz BQSOKBRNXLVBRZ-UHFFFAOYSA-N 0 3 401.576 4.051 20 0 HIADHN CCC(CC)(CO)CN[C@H](c1cccc(S(C)(=O)=O)c1)c1ccc(C)cc1C ZINC000494986310 906149927 /nfs/dbraw/zinc/14/99/27/906149927.db2.gz CLGJCVBZXWINDL-JOCHJYFZSA-N 0 3 403.588 4.185 20 0 HIADHN C[C@@H](CNC(=O)NCc1ccnc(Oc2ccccc2F)c1)N(C)Cc1ccccc1 ZINC000495007879 906168000 /nfs/dbraw/zinc/16/80/00/906168000.db2.gz PXNQBHQPIMNJKA-SFHVURJKSA-N 0 3 422.504 4.333 20 0 HIADHN NC(=O)COc1cccc(CN[C@H](Cc2ccccc2Cl)c2cccs2)c1 ZINC000495045961 906201690 /nfs/dbraw/zinc/20/16/90/906201690.db2.gz NEJICDUREVDGKZ-LJQANCHMSA-N 0 3 400.931 4.339 20 0 HIADHN COc1cc(Cl)c(C)cc1NC(=O)CCN[C@H](c1nnc[nH]1)C1CCCCC1 ZINC000495045791 906202127 /nfs/dbraw/zinc/20/21/27/906202127.db2.gz FGUOYSQIDSUMTO-IBGZPJMESA-N 0 3 405.930 4.015 20 0 HIADHN CC(C)C(=O)NCCCN[C@@H](c1ccccc1)c1ccc(Br)cc1F ZINC000495052632 906206714 /nfs/dbraw/zinc/20/67/14/906206714.db2.gz WAPIZQFYBIALNZ-IBGZPJMESA-N 0 3 407.327 4.430 20 0 HIADHN Clc1ccccc1[C@H](N[C@H]1CCO[C@]2(CCOC2)C1)c1ccc2c(c1)OCCO2 ZINC000495061001 906213829 /nfs/dbraw/zinc/21/38/29/906213829.db2.gz BWKHKEHQLIENKQ-JJEOQYAHSA-N 0 3 415.917 4.128 20 0 HIADHN FC(F)(F)Oc1cccc(N2CC[C@H](N[C@@H](c3nc[nH]n3)C3CCCCC3)C2)c1 ZINC000495062163 906214837 /nfs/dbraw/zinc/21/48/37/906214837.db2.gz AIOGBBXOTGCIMR-MAUKXSAKSA-N 0 3 409.456 4.193 20 0 HIADHN Fc1ccc([C@H](C[C@@H]2CCOC2)NCc2ccnc(OC3CCOCC3)c2)cc1 ZINC000495079307 906225234 /nfs/dbraw/zinc/22/52/34/906225234.db2.gz NLTRKSNHQHKYCA-AVRDEDQJSA-N 0 3 400.494 4.036 20 0 HIADHN O=C(CN[C@@H](C[C@H]1CCOC1)c1ccc(F)cc1)N1CCC(Cc2ccccc2)CC1 ZINC000495081082 906227871 /nfs/dbraw/zinc/22/78/71/906227871.db2.gz SNEJNJHUPNSHRM-RDGATRHJSA-N 0 3 424.560 4.364 20 0 HIADHN CCC[C@H](C)NC(=O)[C@@H]1CCCN(Cc2c(C)nn(-c3ccc(F)cc3)c2C)C1 ZINC000512542203 921224667 /nfs/dbraw/zinc/22/46/67/921224667.db2.gz MBFULJGPSUTYSZ-QFBILLFUSA-N 0 3 400.542 4.145 20 0 HIADHN CCC[C@@H](C)NC(=O)[C@@H]1CCCN(Cc2c(C)nn(-c3ccc(F)cc3)c2C)C1 ZINC000512542204 921224691 /nfs/dbraw/zinc/22/46/91/921224691.db2.gz MBFULJGPSUTYSZ-VQIMIIECSA-N 0 3 400.542 4.145 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1cc(C(F)(F)F)c[nH]c1=O)c1ccsc1 ZINC000512545057 921226616 /nfs/dbraw/zinc/22/66/16/921226616.db2.gz RBXLLVFAXGIZDU-CQSZACIVSA-N 0 3 402.442 4.072 20 0 HIADHN COc1cc(OC)cc(Oc2cccc(CNCc3cnc4c(c3)c(C)nn4C)c2)c1 ZINC000512552141 921230919 /nfs/dbraw/zinc/23/09/19/921230919.db2.gz JQVWPGSEOMLWMX-UHFFFAOYSA-N 0 3 418.497 4.376 20 0 HIADHN c1ccc(-c2n[nH]c(C3CCN(Cc4ccc(Oc5cnccn5)cc4)CC3)n2)cc1 ZINC000512557078 921234137 /nfs/dbraw/zinc/23/41/37/921234137.db2.gz KZTMEHWHJPUDPF-UHFFFAOYSA-N 0 3 412.497 4.434 20 0 HIADHN COc1ccc(NC(=O)C[C@@H](C)N[C@H]2CCCOc3c(F)cccc32)c(OC)c1 ZINC000495425468 906443346 /nfs/dbraw/zinc/44/33/46/906443346.db2.gz BJAMGLRGDYWFCV-KDOFPFPSSA-N 0 3 402.466 4.064 20 0 HIADHN COc1cc(NC(C)=O)ccc1[C@H](C)NCCNc1cccc(Br)c1 ZINC000495428149 906446765 /nfs/dbraw/zinc/44/67/65/906446765.db2.gz VXKHNCJMSPWANJ-ZDUSSCGKSA-N 0 3 406.324 4.179 20 0 HIADHN CCCC[C@@H](N[C@@H]1CCN(c2cc(Cl)ccc2OC)C1)C(=O)Nc1cc(C)on1 ZINC000495725082 906535485 /nfs/dbraw/zinc/53/54/85/906535485.db2.gz PNGKRMFHYRHXKJ-IAGOWNOFSA-N 0 3 420.941 4.011 20 0 HIADHN COc1cccc(C[C@H](C)NC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)c1 ZINC000496260299 906640140 /nfs/dbraw/zinc/64/01/40/906640140.db2.gz BVMYJPRJSRWBID-HTAPYJJXSA-N 0 3 420.475 4.197 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)CSc1ccccc1Cl ZINC000496259489 906640325 /nfs/dbraw/zinc/64/03/25/906640325.db2.gz ALCOFUSWAIBGBX-GOSISDBHSA-N 0 3 403.979 4.340 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)c1cnn(-c2cccc(C)c2)c1C ZINC000496263424 906643053 /nfs/dbraw/zinc/64/30/53/906643053.db2.gz OEYPRAPBEHFMIS-HSZRJFAPSA-N 0 3 417.557 4.011 20 0 HIADHN CC(C)[C@H](C)NC(=O)C1CCN(CC2=Cc3cc(Br)ccc3OC2)CC1 ZINC000512599483 921255236 /nfs/dbraw/zinc/25/52/36/921255236.db2.gz DLIPHNIOBYAVQE-HNNXBMFYSA-N 0 3 421.379 4.098 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(C)c1CN1CCC(C(=O)N[C@H](C)C(C)C)CC1 ZINC000512604835 921257413 /nfs/dbraw/zinc/25/74/13/921257413.db2.gz QZKCJLKILQEJAR-MRXNPFEDSA-N 0 3 400.542 4.001 20 0 HIADHN Cc1cc(C)n(Cc2cccc(C(=O)NC[C@H](c3cccs3)N3CCCC3)c2)n1 ZINC000496534214 906706096 /nfs/dbraw/zinc/70/60/96/906706096.db2.gz MMZJQMPGPKFSHR-OAQYLSRUSA-N 0 3 408.571 4.177 20 0 HIADHN CCN(C)C(=O)c1cccc(NC(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)c1 ZINC000496726298 906745104 /nfs/dbraw/zinc/74/51/04/906745104.db2.gz WXPKJJFXSQHVKS-JOCHJYFZSA-N 0 3 408.546 4.046 20 0 HIADHN CN(C(=O)Nc1cnn(C)c1-c1ccccc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000496802712 906758474 /nfs/dbraw/zinc/75/84/74/906758474.db2.gz BNZQANSHCMSPRC-OAQYLSRUSA-N 0 3 403.530 4.215 20 0 HIADHN COc1ccc(CN2CCC(C(=O)Nc3ccc(O)cc3)CC2)cc1OCC(C)C ZINC000512622210 921265734 /nfs/dbraw/zinc/26/57/34/921265734.db2.gz KTYQPYXCEWAPEQ-UHFFFAOYSA-N 0 3 412.530 4.286 20 0 HIADHN Cc1nc(COc2ccc(CN3CCC(C(=O)N[C@H](C)C(C)C)CC3)cc2)cs1 ZINC000512627144 921266638 /nfs/dbraw/zinc/26/66/38/921266638.db2.gz AMBYFXUVVVDCDB-QGZVFWFLSA-N 0 3 415.603 4.403 20 0 HIADHN Cc1csc(C2(NC(=O)[C@H]3CCCN(Cc4cccc(F)c4)C3)CCCC2)n1 ZINC000497048330 906796340 /nfs/dbraw/zinc/79/63/40/906796340.db2.gz NOWQFCHWLJBRNL-SFHVURJKSA-N 0 3 401.551 4.388 20 0 HIADHN Cc1cc(NC(=O)C(C)(C)C)sc1C(=O)N(Cc1ccco1)C1CCN(C)CC1 ZINC000497355795 906849317 /nfs/dbraw/zinc/84/93/17/906849317.db2.gz DYXGRKCENBKYGT-UHFFFAOYSA-N 0 3 417.575 4.371 20 0 HIADHN Cc1ccc(C(=O)N(Cc2ccco2)C2CCN(C)CC2)cc1NC(=O)c1ccco1 ZINC000497356219 906849374 /nfs/dbraw/zinc/84/93/74/906849374.db2.gz SBORSNILMXPPHH-UHFFFAOYSA-N 0 3 421.497 4.170 20 0 HIADHN Cc1sc(CNC(=O)N2CC[C@@H]3CCN(C)C[C@@H]32)nc1-c1ccc(Cl)cc1 ZINC000497377457 906865851 /nfs/dbraw/zinc/86/58/51/906865851.db2.gz WDVKJVMCUBOWJR-YOEHRIQHSA-N 0 3 404.967 4.008 20 0 HIADHN COc1cc(CN2CCC(C(=O)N[C@H](C)C(C)C)CC2)ccc1OCC(F)(F)F ZINC000512647055 921273454 /nfs/dbraw/zinc/27/34/54/921273454.db2.gz AIJWJWSQCMYGDW-OAHLLOKOSA-N 0 3 416.484 4.009 20 0 HIADHN C/C=C/c1ccc(NC(=O)N2CCC[C@H](CN3CCN(c4ccccn4)CC3)C2)cc1 ZINC000497383828 906870494 /nfs/dbraw/zinc/87/04/94/906870494.db2.gz GFUQFXWGGHQXKS-AOQYBADCSA-N 0 3 419.573 4.181 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)N[C@@H](c3ccc(Br)cc3)C3CCC3)[C@@H]2C1 ZINC000497385973 906871832 /nfs/dbraw/zinc/87/18/32/906871832.db2.gz ILZBFPIYZLHKKZ-NIKGAXFTSA-N 0 3 406.368 4.026 20 0 HIADHN COc1cccc([C@H](CNC(=O)NCC(C)(C)c2cccs2)N2CCCC2)c1 ZINC000512654840 921276574 /nfs/dbraw/zinc/27/65/74/921276574.db2.gz PEEZEQWLCAUXES-IBGZPJMESA-N 0 3 401.576 4.171 20 0 HIADHN CCC(=O)c1ccc(OCCCCC(=O)N[C@@H]2CN(C)C[C@H]2c2ccccc2)cc1 ZINC000497435350 906908714 /nfs/dbraw/zinc/90/87/14/906908714.db2.gz OJWAMVGYNXISMS-XZOQPEGZSA-N 0 3 408.542 4.042 20 0 HIADHN CN(C(=O)c1ccc(Cl)c2ncccc12)C1CCN(CCc2ccccn2)CC1 ZINC000512662307 921279541 /nfs/dbraw/zinc/27/95/41/921279541.db2.gz ZRFRCDJTAVVMCC-UHFFFAOYSA-N 0 3 408.933 4.062 20 0 HIADHN C[C@@H]1CN(C(=O)c2cc3sc4ccccc4c3s2)CC[C@H]1N1CCN(C)CC1 ZINC000497479216 906961495 /nfs/dbraw/zinc/96/14/95/906961495.db2.gz YUKZUXMMASIUPI-NVXWUHKLSA-N 0 3 413.612 4.214 20 0 HIADHN Cc1ccc(C(=O)NC2CCN(Cc3ccc(OCc4ccncc4)cc3)CC2)s1 ZINC000512672329 921282947 /nfs/dbraw/zinc/28/29/47/921282947.db2.gz HLPZMTCXVKFOPE-UHFFFAOYSA-N 0 3 421.566 4.425 20 0 HIADHN COc1cccc([C@H](NC(=O)N2CC[C@@H]3CCN(C)C[C@@H]32)c2ccccc2Cl)c1 ZINC000497503594 906991816 /nfs/dbraw/zinc/99/18/16/906991816.db2.gz LGDOEDHLHHBJNV-SSKFGXFMSA-N 0 3 413.949 4.174 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)NCc3ccc(OC(C)(C)C)cc3C(F)(F)F)[C@H]2C1 ZINC000497509624 906999997 /nfs/dbraw/zinc/99/99/97/906999997.db2.gz VDAQKJMBXFBYNR-KDOFPFPSSA-N 0 3 413.484 4.118 20 0 HIADHN NC(=O)CC[C@H]1CCCN(Cc2cn(Cc3ccccc3)nc2-c2cccs2)C1 ZINC000512690818 921288966 /nfs/dbraw/zinc/28/89/66/921288966.db2.gz PKLSATNVMGFFKQ-LJQANCHMSA-N 0 3 408.571 4.137 20 0 HIADHN O=C(Nc1ccccc1)C1CCN(C[C@H](O)COc2ccc(Cl)cc2Cl)CC1 ZINC000497586178 907067149 /nfs/dbraw/zinc/06/71/49/907067149.db2.gz XYZGDQHBEDKRFR-SFHVURJKSA-N 0 3 423.340 4.084 20 0 HIADHN COc1cc(C)c(CN(C)C[C@@H](O)COc2cc(Cl)ccc2Cl)cc1OC ZINC000497587011 907068267 /nfs/dbraw/zinc/06/82/67/907068267.db2.gz FOTITAWLUXXQGD-MRXNPFEDSA-N 0 3 414.329 4.191 20 0 HIADHN Cc1ccc(C(=O)NC2CCN(CCC(=O)Nc3ccc(Cl)cc3F)CC2)s1 ZINC000497616788 907094202 /nfs/dbraw/zinc/09/42/02/907094202.db2.gz LCTZXVIPWFBJQA-UHFFFAOYSA-N 0 3 423.941 4.072 20 0 HIADHN C[C@H](NC(=O)N1CC[C@H]2CCN(C)C[C@H]21)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000497628606 907107731 /nfs/dbraw/zinc/10/77/31/907107731.db2.gz PXZHHBMBWSZKAD-XTQVGHSUSA-N 0 3 411.521 4.201 20 0 HIADHN Brc1ccccc1-c1ccc(CN2CCN(C3CCOCC3)CC2)s1 ZINC000512713901 921294821 /nfs/dbraw/zinc/29/48/21/921294821.db2.gz IXVZCYQKDHCTKP-UHFFFAOYSA-N 0 3 421.404 4.474 20 0 HIADHN COc1cc(C)c(CN(C)C[C@@H](O)CO[C@H](C)c2ccc(Cl)cc2)cc1OC ZINC000497706079 907209931 /nfs/dbraw/zinc/20/99/31/907209931.db2.gz LDBXIMQLIALILC-OXQOHEQNSA-N 0 3 407.938 4.236 20 0 HIADHN CC(C)(C)c1ccc(C(=O)NCCC(=O)N[C@H](CN2CCCC2)c2ccccc2)cc1 ZINC000497723214 907223622 /nfs/dbraw/zinc/22/36/22/907223622.db2.gz REGFSLCDBVVRFC-HSZRJFAPSA-N 0 3 421.585 4.057 20 0 HIADHN C[C@H](NC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1)c1nccn1-c1ccccc1 ZINC000512780318 921310110 /nfs/dbraw/zinc/31/01/10/921310110.db2.gz YRXVCSBTNMFAAX-REWPJTCUSA-N 0 3 417.557 4.239 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)c2ccccc2SCc2nc(C)no2)N(C)C)cc1 ZINC000497804490 907290427 /nfs/dbraw/zinc/29/04/27/907290427.db2.gz FJTKQRQRBGMWEL-HXUWFJFHSA-N 0 3 424.570 4.265 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)N[C@@H](CC1CCC1)c1ccccc1 ZINC000497835762 907316048 /nfs/dbraw/zinc/31/60/48/907316048.db2.gz KOOXWEILUZFDNX-VWLOTQADSA-N 0 3 421.585 4.374 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)N2CCC(OC3CCCC3)CC2)N(C)C)cc1 ZINC000512808784 921315805 /nfs/dbraw/zinc/31/58/05/921315805.db2.gz RHBQBLPIJPOAPZ-QHCPKHFHSA-N 0 3 417.594 4.210 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCCc1nc2c(s1)CCCC2)c1ccsc1 ZINC000497936500 907402986 /nfs/dbraw/zinc/40/29/86/907402986.db2.gz FNZLWQQPSMPEMS-QGZVFWFLSA-N 0 3 406.621 4.008 20 0 HIADHN CCN(C(=O)c1ccc(NC(=O)C2CC2)cc1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000497950910 907420730 /nfs/dbraw/zinc/42/07/30/907420730.db2.gz JMHTXWRISUQLGY-WZONZLPQSA-N 0 3 405.542 4.333 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)Nc3nc(-c4cccs4)ns3)cc2)CC1 ZINC000497976582 907450112 /nfs/dbraw/zinc/45/01/12/907450112.db2.gz SCZZGPBOKYGAAQ-UHFFFAOYSA-N 0 3 413.572 4.049 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)N2C[C@H](C)C[C@H]2c2cccnc2)N(C)C)cc1 ZINC000512822411 921326985 /nfs/dbraw/zinc/32/69/85/921326985.db2.gz VLQWQMPLGNHEFU-LEOXJPRUSA-N 0 3 410.562 4.264 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)N2CCC[C@@H](C(F)(F)F)[C@H]2C)N(C)C)cc1 ZINC000512825272 921329162 /nfs/dbraw/zinc/32/91/62/921329162.db2.gz DBSJGGNQTANIFP-LZQZEXGQSA-N 0 3 415.500 4.449 20 0 HIADHN CCN(C(=O)c1ccc(OCC(F)(F)F)nc1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000498019394 907515155 /nfs/dbraw/zinc/51/51/55/907515155.db2.gz QTABJHXREYCUQF-QFBILLFUSA-N 0 3 421.463 4.320 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)N2CCc3[nH]c4ccccc4c3C2)N(C)C)cc1 ZINC000512828032 921333401 /nfs/dbraw/zinc/33/34/01/921333401.db2.gz OSONMHPDIXUJBU-XMMPIXPASA-N 0 3 420.557 4.326 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)[C@H]1C[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000498060819 907571503 /nfs/dbraw/zinc/57/15/03/907571503.db2.gz FDQYAHOIIRCAQX-RTWAWAEBSA-N 0 3 402.460 4.374 20 0 HIADHN CN(C)Cc1cccc(C(=O)N[C@H](Cc2ccc(O)cc2)c2nc3ccccc3[nH]2)c1 ZINC000498102640 907610156 /nfs/dbraw/zinc/61/01/56/907610156.db2.gz FHVOFUXYEYIMMV-HSZRJFAPSA-N 0 3 414.509 4.044 20 0 HIADHN Cc1cnc([C@H](NC(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)C2CC2)s1 ZINC000498105592 907616209 /nfs/dbraw/zinc/61/62/09/907616209.db2.gz CEGKDPZUOVDXJI-VQTJNVASSA-N 0 3 416.591 4.292 20 0 HIADHN O=C(c1cnn2ccccc12)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000498128000 907644828 /nfs/dbraw/zinc/64/48/28/907644828.db2.gz RKWJLWRAWDSOLM-UHFFFAOYSA-N 0 3 417.340 4.379 20 0 HIADHN CCCCCOc1ccc([C@H](C)NC(=O)N2CC[C@H]3CCN(C)C[C@H]32)cc1OC ZINC000498155824 907681436 /nfs/dbraw/zinc/68/14/36/907681436.db2.gz FANOGXPPDGUONN-NLWGTHIKSA-N 0 3 403.567 4.061 20 0 HIADHN CCCCCOc1ccc([C@H](C)NC(=O)N2CC[C@@H]3CCN(C)C[C@H]32)cc1OC ZINC000498155823 907681946 /nfs/dbraw/zinc/68/19/46/907681946.db2.gz FANOGXPPDGUONN-CMKODMSKSA-N 0 3 403.567 4.061 20 0 HIADHN O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)[C@H]1C[C@@H]1c1ccc(Br)cc1 ZINC000498161881 907689506 /nfs/dbraw/zinc/68/95/06/907689506.db2.gz HKDQYWNYDCEQEF-NJYVYQBISA-N 0 3 413.359 4.333 20 0 HIADHN O=C(N[C@H](c1cccc(F)c1)c1ccccn1)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000498239724 907774491 /nfs/dbraw/zinc/77/44/91/907774491.db2.gz ONDAZEFIZIXKRT-ISKFKSNPSA-N 0 3 418.516 4.274 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@@H](C)NCc2nc3c(s2)C[C@@H](C)CC3)CC1 ZINC000498350424 907852146 /nfs/dbraw/zinc/85/21/46/907852146.db2.gz XHISDJVWXAJZOU-DLBZAZTESA-N 0 3 416.610 4.400 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)CCCCc3ccc(OC)cc3)cc2)CC1 ZINC000498349507 907852468 /nfs/dbraw/zinc/85/24/68/907852468.db2.gz DEOIFNFRRKGHIP-UHFFFAOYSA-N 0 3 409.574 4.184 20 0 HIADHN CCC(CC)[C@@H]1C[C@@H](NC(=O)N(CCN(C)C)Cc2ccc(F)cc2F)CCO1 ZINC000498391368 907876101 /nfs/dbraw/zinc/87/61/01/907876101.db2.gz XJSHDLRQGAKDJD-FPOVZHCZSA-N 0 3 411.537 4.022 20 0 HIADHN C[C@@H](NCc1ccc(-c2cccc(Br)c2)s1)C1(S(C)(=O)=O)CC1 ZINC000512875104 921372348 /nfs/dbraw/zinc/37/23/48/921372348.db2.gz YWGSUCNYGXWSGT-GFCCVEGCSA-N 0 3 414.390 4.233 20 0 HIADHN COc1ccccc1[C@@H]1CC[C@@H](C)CN1C(=O)NC1CCN(CCOC(C)C)CC1 ZINC000498595727 908045601 /nfs/dbraw/zinc/04/56/01/908045601.db2.gz YHXAGWFGICNPRC-KNQAVFIVSA-N 0 3 417.594 4.067 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N[C@@H](c3cccc(C)c3)c3ccccn3)cc2)CC1 ZINC000498619537 908066863 /nfs/dbraw/zinc/06/68/63/908066863.db2.gz XTNMQFDQSLCJII-VWLOTQADSA-N 0 3 414.553 4.051 20 0 HIADHN COc1ccc([C@@H](NC(=O)N(C)CCN(C)C)c2ccc(C(F)(F)F)cc2)cc1 ZINC000498676802 908107329 /nfs/dbraw/zinc/10/73/29/908107329.db2.gz SNHTXBNYLDQQQQ-IBGZPJMESA-N 0 3 409.452 4.006 20 0 HIADHN COCC(=O)N1CCC(N[C@H](c2sccc2C)c2ccc(Cl)cc2F)CC1 ZINC000498781124 908197171 /nfs/dbraw/zinc/19/71/71/908197171.db2.gz AZOJNMICUNKTNR-IBGZPJMESA-N 0 3 410.942 4.165 20 0 HIADHN CS(=O)(=O)C1CCC(N[C@H](c2ccco2)c2ccc(Br)cc2)CC1 ZINC000498782455 908199603 /nfs/dbraw/zinc/19/96/03/908199603.db2.gz FPCFWAJBBJMHSS-HTWSVDAQSA-N 0 3 412.349 4.077 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)Nc2ccc(C(=O)N3CCCC3)cc2C)N(C)C)cc1 ZINC000498823959 908231882 /nfs/dbraw/zinc/23/18/82/908231882.db2.gz CUFCMDWAXRSKFR-HSZRJFAPSA-N 0 3 422.573 4.218 20 0 HIADHN Cc1cc(C)c(NC(=O)N2CCC[C@H](CN3CCN(c4ccccn4)CC3)C2)c(C)c1 ZINC000498834810 908243068 /nfs/dbraw/zinc/24/30/68/908243068.db2.gz DLNGSVNJHYFNOC-JOCHJYFZSA-N 0 3 421.589 4.073 20 0 HIADHN CC(C)c1cccc(NC(=O)N2CCC[C@H](CN3CCN(c4ccccn4)CC3)C2)c1 ZINC000498859233 908262861 /nfs/dbraw/zinc/26/28/61/908262861.db2.gz WIAVNCHVLYRYMB-OAQYLSRUSA-N 0 3 421.589 4.271 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)N2CCCC[C@@H]2c2cccn2C)N(C)C)cc1 ZINC000512902679 921395213 /nfs/dbraw/zinc/39/52/13/921395213.db2.gz QUMQSDGSBNUQKS-DHIUTWEWSA-N 0 3 412.578 4.352 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(C)c1C(=O)NC[C@@H]1CCCCN1Cc1ccccc1 ZINC000498898171 908303262 /nfs/dbraw/zinc/30/32/62/908303262.db2.gz YFKGZYRYMSOYSD-QHCPKHFHSA-N 0 3 420.532 4.413 20 0 HIADHN C[C@@H](NC(=O)CN1CCC[C@H](c2n[nH]c(C3CC3)n2)C1)c1ccc(Cl)cc1Cl ZINC000498915518 908326542 /nfs/dbraw/zinc/32/65/42/908326542.db2.gz FFYIROFXIWXXPE-OCCSQVGLSA-N 0 3 422.360 4.046 20 0 HIADHN CC(=O)N1CCN(CCC(=O)Nc2c(Cl)cccc2Cl)CC12CCCCC2 ZINC000498919776 908330027 /nfs/dbraw/zinc/33/00/27/908330027.db2.gz UVOOCRXMENODPO-UHFFFAOYSA-N 0 3 412.361 4.189 20 0 HIADHN CCN(C(=O)CN1CCC[C@@H](c2nc(C3CC3)n[nH]2)C1)c1cccc2ccccc21 ZINC000498921626 908332008 /nfs/dbraw/zinc/33/20/08/908332008.db2.gz GSQKICZIUKVNOJ-LJQANCHMSA-N 0 3 403.530 4.068 20 0 HIADHN CCN(C(=O)CN1CCC[C@@H](c2n[nH]c(C3CC3)n2)C1)c1cccc2ccccc21 ZINC000498921626 908332025 /nfs/dbraw/zinc/33/20/25/908332025.db2.gz GSQKICZIUKVNOJ-LJQANCHMSA-N 0 3 403.530 4.068 20 0 HIADHN CN(C)C(=O)[C@@H]1CCC[C@H](N[C@@H](c2ccco2)c2ccc(Br)cc2)C1 ZINC000498938769 908345845 /nfs/dbraw/zinc/34/58/45/908345845.db2.gz DVSKYKFYKCPJJP-HHXXYDBFSA-N 0 3 405.336 4.368 20 0 HIADHN Cc1cccc([C@@H](NC(=O)NCC2(N3CCSCC3)CCCC2)c2ccccn2)c1 ZINC000499001023 908378635 /nfs/dbraw/zinc/37/86/35/908378635.db2.gz BUDRPVAGDMWONW-JOCHJYFZSA-N 0 3 424.614 4.140 20 0 HIADHN Cc1[nH]c2ccccc2c1C1CCN(Cc2ccc(S(=O)(=O)N(C)C)cc2)CC1 ZINC000499055681 908425225 /nfs/dbraw/zinc/42/52/25/908425225.db2.gz NTGQAYLPYKZHMC-UHFFFAOYSA-N 0 3 411.571 4.106 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(-n2cncn2)cc1)C(=O)Nc1cccc(Cl)c1Cl ZINC000499073464 908438943 /nfs/dbraw/zinc/43/89/43/908438943.db2.gz RKLAIOGFIOFBKS-QWHCGFSZSA-N 0 3 404.301 4.252 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)N2CCC(Cc3cccnc3)CC2)N(C)C)cc1 ZINC000512918892 921413276 /nfs/dbraw/zinc/41/32/76/921413276.db2.gz VBNAMLBPOGPSFH-XMMPIXPASA-N 0 3 424.589 4.136 20 0 HIADHN CC[C@H](NC(=O)N[C@@H]1C[C@H](C)N(Cc2ccccc2)C1)c1ccc(OC)c(OC)c1 ZINC000499186537 908541464 /nfs/dbraw/zinc/54/14/64/908541464.db2.gz HNBPCFFXBBOQHU-WMQCIHAUSA-N 0 3 411.546 4.117 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)N(C)Cc2ccc(F)c(F)c2)N(C)C)cc1 ZINC000512923842 921418620 /nfs/dbraw/zinc/41/86/20/921418620.db2.gz ZTTOTNCGZIRRFL-NRFANRHFSA-N 0 3 405.489 4.196 20 0 HIADHN CC1CCC(N2CCN(C(=O)N[C@H](c3cccc(F)c3)c3ccccn3)CC2)CC1 ZINC000499305505 908678882 /nfs/dbraw/zinc/67/88/82/908678882.db2.gz HDONBTOYRYXGJV-PSGUAHCZSA-N 0 3 410.537 4.216 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N[C@H](C)c1ccc(-n2ccnc2C)cc1)c1ccco1 ZINC000499326366 908701129 /nfs/dbraw/zinc/70/11/29/908701129.db2.gz FEZUECWNBRDAEO-FVJLSDCUSA-N 0 3 409.534 4.263 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCCC1)c1cccc([C@H]2CCCOC2)c1 ZINC000499371270 908739978 /nfs/dbraw/zinc/73/99/78/908739978.db2.gz WJDGKGKCPTZHDN-NRFANRHFSA-N 0 3 402.604 4.062 20 0 HIADHN Cc1c(C(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)cnn1CC(C)C ZINC000499381832 908746739 /nfs/dbraw/zinc/74/67/39/908746739.db2.gz OCBHYZZBCMLPOT-UHFFFAOYSA-N 0 3 410.484 4.070 20 0 HIADHN CCOc1cn(-c2ccccc2)nc1C(=O)N(C)C1CCN(Cc2ccccc2)CC1 ZINC000499482140 908813390 /nfs/dbraw/zinc/81/33/90/908813390.db2.gz WQRNRDNDGXTZQY-UHFFFAOYSA-N 0 3 418.541 4.008 20 0 HIADHN Cc1nn2c(CNCCOc3cccc(Br)c3)c(C(C)C)nc2s1 ZINC000499679889 908874935 /nfs/dbraw/zinc/87/49/35/908874935.db2.gz MMYVFGHUNULWRF-UHFFFAOYSA-N 0 3 409.353 4.154 20 0 HIADHN C[C@H]1CCCCN1CCNC(=O)c1oc2ccccc2c1CSc1ncccn1 ZINC000499710603 908884583 /nfs/dbraw/zinc/88/45/83/908884583.db2.gz JMMIXKGLYPWBSP-INIZCTEOSA-N 0 3 410.543 4.119 20 0 HIADHN CC[C@H]1CCCCN1CCNC(=O)c1sc(NC(=O)c2cccc(F)c2)cc1C ZINC000499722884 908890408 /nfs/dbraw/zinc/89/04/08/908890408.db2.gz NBXYIINMFWEJNG-SFHVURJKSA-N 0 3 417.550 4.442 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)N[C@@H](C)c1nc(-c2ccc(F)c(C)c2)no1 ZINC000499741241 908895897 /nfs/dbraw/zinc/89/58/97/908895897.db2.gz LUTRPNLDCIALFL-KRWDZBQOSA-N 0 3 417.529 4.153 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)c1csc(CCc2ccccc2)n1 ZINC000499940219 909046681 /nfs/dbraw/zinc/04/66/81/909046681.db2.gz TWZNUSYIUVEEKF-UHFFFAOYSA-N 0 3 411.546 4.271 20 0 HIADHN Cc1cc(Br)cc(C)c1N1CCC[C@@H](NC/C=C\c2ccncc2)C1=O ZINC000513034782 921493071 /nfs/dbraw/zinc/49/30/71/921493071.db2.gz CXZJHTPLLPZLJP-SIEMBAAWSA-N 0 3 414.347 4.259 20 0 HIADHN CCN(C(=O)c1nnn(-c2cccc(C)c2)c1C)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000499997330 909449675 /nfs/dbraw/zinc/44/96/75/909449675.db2.gz FHQGWYVNEXJLFI-XXBNENTESA-N 0 3 417.557 4.182 20 0 HIADHN CCN(C(=O)c1ccn(-c2ccccc2F)n1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000500004180 909454441 /nfs/dbraw/zinc/45/44/41/909454441.db2.gz KKTNWSYIPCUUOQ-AZUAARDMSA-N 0 3 406.505 4.309 20 0 HIADHN CCN(C(=O)c1nnn(-c2ccc(C)cc2)c1C)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000500011121 909465154 /nfs/dbraw/zinc/46/51/54/909465154.db2.gz YEUQYXKYIXVRNH-XXBNENTESA-N 0 3 417.557 4.182 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)C2(Cc3cccc(F)c3)CCCCC2)CC1 ZINC000500069496 909538569 /nfs/dbraw/zinc/53/85/69/909538569.db2.gz XUTDSRLVVNKQJJ-UHFFFAOYSA-N 0 3 404.570 4.324 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1nn(-c2ccc(F)cc2)cc1C)c1ccsc1 ZINC000513049201 921507813 /nfs/dbraw/zinc/50/78/13/921507813.db2.gz PXIJOQLOGFINSF-IBGZPJMESA-N 0 3 400.523 4.194 20 0 HIADHN CC[NH+](CC)Cc1cccc(CNC(=O)Nc2ccc(-c3cc(=O)[n-]c(C)n3)cc2)c1 ZINC000500123141 909607341 /nfs/dbraw/zinc/60/73/41/909607341.db2.gz JWSLADCFZVFCRE-UHFFFAOYSA-N 0 3 419.529 4.321 20 0 HIADHN CN(C)C[C@H](NC(=O)N[C@H]1CC(C)(C)Oc2cc(F)ccc21)c1ccc(F)cc1 ZINC000500142445 909623096 /nfs/dbraw/zinc/62/30/96/909623096.db2.gz ORGWSQSRPIXBKF-OALUTQOASA-N 0 3 403.473 4.169 20 0 HIADHN COc1ccccc1[C@H](NC(=O)N[C@@H](CN(C)C)c1ccc(F)cc1)c1ccco1 ZINC000500164134 909647357 /nfs/dbraw/zinc/64/73/57/909647357.db2.gz PQXXDQUHZWLQFN-UGKGYDQZSA-N 0 3 411.477 4.119 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)C[C@@H](C)Cc3ccccc3OC)cc2)CC1 ZINC000500196670 909688870 /nfs/dbraw/zinc/68/88/70/909688870.db2.gz FKBWPGAIJPZCML-FQEVSTJZSA-N 0 3 409.574 4.040 20 0 HIADHN COc1ccc([C@H]2CCCN2C(=O)CN2CCC[C@@H](Cc3ccccc3)C2)c(OC)c1 ZINC000500220558 909712881 /nfs/dbraw/zinc/71/28/81/909712881.db2.gz SDRLQQXFNJWBRK-XUZZJYLKSA-N 0 3 422.569 4.322 20 0 HIADHN CCN(C(=O)C(=O)Nc1cccc(F)c1Cl)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000500225586 909717537 /nfs/dbraw/zinc/71/75/37/909717537.db2.gz CNQCNADWMNHWNC-RDJZCZTQSA-N 0 3 417.912 4.102 20 0 HIADHN Cc1nc(CCNCc2cc(Br)ccc2OCc2ccccn2)c(C)o1 ZINC000500243083 909731218 /nfs/dbraw/zinc/73/12/18/909731218.db2.gz TZYCIKQPYNZLPR-UHFFFAOYSA-N 0 3 416.319 4.360 20 0 HIADHN C/C=C/c1ccc(NC(=O)C(=O)Nc2cc(C)cc(N3CCN(C(C)C)CC3)c2)cc1 ZINC000500369888 909818721 /nfs/dbraw/zinc/81/87/21/909818721.db2.gz XENUBYVXXOKHKC-AATRIKPKSA-N 0 3 420.557 4.136 20 0 HIADHN O=C(NC[C@H]1CCCN(Cc2ccccc2OCC(F)(F)F)C1)c1ccccc1 ZINC000513072023 921526489 /nfs/dbraw/zinc/52/64/89/921526489.db2.gz ZNOXIKAYNQYZNG-QGZVFWFLSA-N 0 3 406.448 4.270 20 0 HIADHN CN(C)Cc1nc2scc(-c3ccccc3)c2c(N2CCN(C3CCC3)CC2)n1 ZINC000500425656 909849813 /nfs/dbraw/zinc/84/98/13/909849813.db2.gz OGDGIUIXYJWEJP-UHFFFAOYSA-N 0 3 407.587 4.094 20 0 HIADHN Cc1ccccc1NC(=O)C[C@@H](C)NCc1cccc(C(=O)NCc2ccco2)c1 ZINC000513076564 921529413 /nfs/dbraw/zinc/52/94/13/921529413.db2.gz RIVDZVITWQWJGX-GOSISDBHSA-N 0 3 405.498 4.025 20 0 HIADHN C[C@@H]1[C@H](NC(=O)N[C@H](C[C@@H]2CCOC2)c2ccccc2)CCN1Cc1ccccc1 ZINC000500589513 909950571 /nfs/dbraw/zinc/95/05/71/909950571.db2.gz IBHDTDIQVZQOJX-NZRJUOQRSA-N 0 3 407.558 4.117 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N[C@H](C)c1cnn(Cc2ccccc2)c1)c1ccco1 ZINC000500601237 909957732 /nfs/dbraw/zinc/95/77/32/909957732.db2.gz KTTMSJHDOVEDBQ-WAOWUJCRSA-N 0 3 409.534 4.014 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)N2CCC[C@@H]2c2ccc(C)cc2)CC1 ZINC000500622736 909973204 /nfs/dbraw/zinc/97/32/04/909973204.db2.gz WTMSIFMHWHLTHR-RUZDIDTESA-N 0 3 420.601 4.179 20 0 HIADHN CCN1CCN(Cc2ccc(CNC(=O)N(C)Cc3ccc(C(C)C)cc3)cc2)CC1 ZINC000500657654 910000034 /nfs/dbraw/zinc/00/00/34/910000034.db2.gz XXMGUMRFEFBGBC-UHFFFAOYSA-N 0 3 422.617 4.289 20 0 HIADHN C[C@H](Oc1ccc(-c2ccccc2)cc1)C(=O)N(CCN(C)C)Cc1ccccn1 ZINC000500747657 910059200 /nfs/dbraw/zinc/05/92/00/910059200.db2.gz MJNKFYJTKUZYGX-FQEVSTJZSA-N 0 3 403.526 4.106 20 0 HIADHN O=C(CCCOc1ccccc1F)Nc1ccc(CCN2CCSCC2)cc1 ZINC000500817655 910100059 /nfs/dbraw/zinc/10/00/59/910100059.db2.gz LSYXMPYZVIONPV-UHFFFAOYSA-N 0 3 402.535 4.215 20 0 HIADHN Cc1cc2cc(CNCc3cn(C)nc3-c3ccc4c(c3)OCCCO4)ccc2[nH]1 ZINC000513100190 921548835 /nfs/dbraw/zinc/54/88/35/921548835.db2.gz HVVOIMIKFWPHAZ-UHFFFAOYSA-N 0 3 402.498 4.328 20 0 HIADHN CCc1nc(C(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)nn1-c1ccccc1Cl ZINC000500880325 910154264 /nfs/dbraw/zinc/15/42/64/910154264.db2.gz KNQHLDYZRSJLQM-FUHWJXTLSA-N 0 3 423.948 4.048 20 0 HIADHN CN(C)[C@@H](CNC(=O)NC[C@H](c1cccc(Cl)c1)N1CCCC1)c1ccccc1 ZINC000501023032 910240815 /nfs/dbraw/zinc/24/08/15/910240815.db2.gz LTSFZAAVJNLJDQ-FCHUYYIVSA-N 0 3 414.981 4.079 20 0 HIADHN CN(C)[C@@H](CNC(=O)NC[C@@H](c1cccc(Cl)c1)N1CCCC1)c1ccsc1 ZINC000501027526 910245093 /nfs/dbraw/zinc/24/50/93/910245093.db2.gz ZVSXYUOTPCZQSP-PMACEKPBSA-N 0 3 421.010 4.141 20 0 HIADHN Cc1cc(C)c(CNCc2ccc(S(=O)(=O)N3CCC[C@H](C)C3)cc2)c(C)c1 ZINC000513114378 921560778 /nfs/dbraw/zinc/56/07/78/921560778.db2.gz AYXYATWVVGUAPT-KRWDZBQOSA-N 0 3 400.588 4.322 20 0 HIADHN CC(C)c1ccccc1NC(=O)CNC(C)(C)COc1ncccc1Br ZINC000501083972 910283740 /nfs/dbraw/zinc/28/37/40/910283740.db2.gz WOUUMSIZGZEONX-UHFFFAOYSA-N 0 3 420.351 4.353 20 0 HIADHN C[C@@H]1[C@H](NC(=O)N[C@H](c2cccc(F)c2)c2ccccn2)CCN1Cc1ccccc1 ZINC000501111210 910299382 /nfs/dbraw/zinc/29/93/82/910299382.db2.gz AEDFQHUNZLIRQH-IHLLOCCUSA-N 0 3 418.516 4.272 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1cc(C(=O)OC)c(F)cc1F)c1ccsc1 ZINC000501113452 910300754 /nfs/dbraw/zinc/30/07/54/910300754.db2.gz TVQRKGMKMTWVSP-KRWDZBQOSA-N 0 3 411.474 4.018 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(C)c1CN1CCC2(C[C@@H]2C(=O)N2CCCCC2)CC1 ZINC000501133232 910314173 /nfs/dbraw/zinc/31/41/73/910314173.db2.gz OBHMCLBPNHQULU-HSZRJFAPSA-N 0 3 424.564 4.243 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)Nc1cccc(NC(=O)c2ccoc2)c1 ZINC000501181979 910349699 /nfs/dbraw/zinc/34/96/99/910349699.db2.gz PQPIRISXFANUFM-UHFFFAOYSA-N 0 3 418.497 4.102 20 0 HIADHN COc1cc(CN2CCC(C(=O)Nc3ccc(F)cc3)CC2)ccc1OC(C)C ZINC000513124067 921568950 /nfs/dbraw/zinc/56/89/50/921568950.db2.gz YXOZCDHKKQZADL-UHFFFAOYSA-N 0 3 400.494 4.472 20 0 HIADHN Cc1c(C(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)cnn1-c1ccc(Cl)cc1 ZINC000501228043 910388211 /nfs/dbraw/zinc/38/82/11/910388211.db2.gz OAYHANSAPRATNG-OXJNMPFZSA-N 0 3 408.933 4.399 20 0 HIADHN CN(C)Cc1cccc(NC(=O)C(=O)NCC2(c3ccc(C(C)(C)C)cc3)CCC2)c1 ZINC000501283569 910444804 /nfs/dbraw/zinc/44/48/04/910444804.db2.gz GNHOHCCUMALIKQ-UHFFFAOYSA-N 0 3 421.585 4.222 20 0 HIADHN CCCN(CCN1CCCCC1)Cc1nc(=O)c2c(-c3ccco3)csc2[nH]1 ZINC000513134178 921577245 /nfs/dbraw/zinc/57/72/45/921577245.db2.gz UOUJWUYTCCCSHR-UHFFFAOYSA-N 0 3 400.548 4.355 20 0 HIADHN Cc1oc(-c2ccco2)nc1CC(=O)NC[C@@H](c1ccccc1)N1CCC(C)CC1 ZINC000501343486 910480064 /nfs/dbraw/zinc/48/00/64/910480064.db2.gz LYEXJTBOKOLPBW-NRFANRHFSA-N 0 3 407.514 4.375 20 0 HIADHN C[C@@H](C(=O)Nc1cccc(CN2CCC(O)CC2)c1)c1ccc(Br)cc1 ZINC000501495343 910607466 /nfs/dbraw/zinc/60/74/66/910607466.db2.gz GMPZPSLYXDGYMW-OAHLLOKOSA-N 0 3 417.347 4.148 20 0 HIADHN CN(C)[C@H](CNC(=O)N1CCN(Cc2cccc3ccccc32)CC1)c1ccsc1 ZINC000501519836 910629687 /nfs/dbraw/zinc/62/96/87/910629687.db2.gz VFBXWNWMABYELE-HSZRJFAPSA-N 0 3 422.598 4.031 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1cnn(CC(C)C)c1C ZINC000501520920 910631511 /nfs/dbraw/zinc/63/15/11/910631511.db2.gz URQCDYZVAPPPKS-OAQYLSRUSA-N 0 3 420.561 4.052 20 0 HIADHN COC(=O)CCC[C@@H]1CCC[C@H](N[C@H](C)c2nc(-c3cccc(OC)c3)no2)C1 ZINC000513163503 921594645 /nfs/dbraw/zinc/59/46/45/921594645.db2.gz AYDFAFNDEAOKCK-RYRKJORJSA-N 0 3 401.507 4.298 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)Cc2ccc(OCc3ccccn3)cc2)C1 ZINC000501677489 910750638 /nfs/dbraw/zinc/75/06/38/910750638.db2.gz GYYUJYGFNGXGRR-NZQKXSOJSA-N 0 3 415.537 4.155 20 0 HIADHN COc1ccc(-c2ccccc2)cc1CN1CCC[C@H](c2n[nH]cc2NC(C)=O)C1 ZINC000501701954 910770450 /nfs/dbraw/zinc/77/04/50/910770450.db2.gz BXBZAZURNBOFEA-FQEVSTJZSA-N 0 3 404.514 4.423 20 0 HIADHN Cc1ccccc1CN1CCC(NS(=O)(=O)Cc2ccc3ccccc3c2)CC1 ZINC000501705907 910773800 /nfs/dbraw/zinc/77/38/00/910773800.db2.gz YBONFSXGJBMTFN-UHFFFAOYSA-N 0 3 408.567 4.232 20 0 HIADHN C[C@@H](NCC(=O)N1Cc2ccccc2[C@@H](c2ccccc2)C1)c1ccc2n[nH]cc2c1 ZINC000513184810 921607620 /nfs/dbraw/zinc/60/76/20/921607620.db2.gz VHHGOHHOPWEJKK-HOYKHHGWSA-N 0 3 410.521 4.388 20 0 HIADHN CC1(C)CCC(CC(=O)N2CCC[C@@H](CN3CCN(c4ccccn4)CC3)C2)CC1 ZINC000501772425 910826846 /nfs/dbraw/zinc/82/68/46/910826846.db2.gz BHDDDPIGEJMJGG-QFIPXVFZSA-N 0 3 412.622 4.049 20 0 HIADHN CCN(CC)C(=O)c1ccc(NC(=O)N[C@H](CN2CCCC2)c2ccccc2)cc1 ZINC000501801750 910852262 /nfs/dbraw/zinc/85/22/62/910852262.db2.gz GGQODDSVCOWRMF-JOCHJYFZSA-N 0 3 408.546 4.127 20 0 HIADHN CCN(CC)C(=O)c1cccc(NC(=O)N[C@@H](CN2CCCC2)c2ccccc2)c1 ZINC000501802757 910853202 /nfs/dbraw/zinc/85/32/02/910853202.db2.gz IIWMYFAGEWDVIJ-QFIPXVFZSA-N 0 3 408.546 4.127 20 0 HIADHN O=C(Nc1ccc(OC[C@@H]2CCCO2)cc1)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000501804290 910855425 /nfs/dbraw/zinc/85/54/25/910855425.db2.gz JSSHIZYSERFVCC-GOTSBHOMSA-N 0 3 409.530 4.203 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)N[C@@H](c1ccccc1)c1ccccn1 ZINC000501807802 910858278 /nfs/dbraw/zinc/85/82/78/910858278.db2.gz VMGGZBCUCCEHNJ-ZEQRLZLVSA-N 0 3 400.526 4.307 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)c3ccc(CCC(F)(F)F)cc3)CC2)C[C@@H](C)O1 ZINC000501852868 910886404 /nfs/dbraw/zinc/88/64/04/910886404.db2.gz SCYOQBDZDKSTII-IAGOWNOFSA-N 0 3 412.496 4.143 20 0 HIADHN CCN(C(=O)c1nc(C)n(-c2ccc(F)cc2)n1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000501948594 910934851 /nfs/dbraw/zinc/93/48/51/910934851.db2.gz PZQXUBJJYUANEI-HTAPYJJXSA-N 0 3 421.520 4.012 20 0 HIADHN CCN(C(=O)c1cnc2c(cnn2C(C)C)c1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000501953165 910941759 /nfs/dbraw/zinc/94/17/59/910941759.db2.gz ZBNUFBRPOYMNEI-GCJKJVERSA-N 0 3 405.546 4.310 20 0 HIADHN CCN(C(=O)c1cnc2c(cnn2C(C)C)c1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000501953164 910942118 /nfs/dbraw/zinc/94/21/18/910942118.db2.gz ZBNUFBRPOYMNEI-AVRDEDQJSA-N 0 3 405.546 4.310 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)c1cc2ccccc2[nH]c1=O ZINC000501978497 910960203 /nfs/dbraw/zinc/96/02/03/910960203.db2.gz LBADZBULTRXQEX-UHFFFAOYSA-N 0 3 417.431 4.163 20 0 HIADHN C[C@H](Cc1cncc2ccccc21)C(=O)NC1CCN([C@@H](C)c2ccncc2)CC1 ZINC000502008525 910975829 /nfs/dbraw/zinc/97/58/29/910975829.db2.gz IMVBJKAOVFVBCP-MOPGFXCFSA-N 0 3 402.542 4.150 20 0 HIADHN C[C@@H](NC[C@H]1CN(C(=O)c2ccccc2)[C@H]2CCN1C2)c1cccc(Cl)c1Cl ZINC000502038356 910992767 /nfs/dbraw/zinc/99/27/67/910992767.db2.gz WWAVRKOCKXKQEI-NJAFHUGGSA-N 0 3 418.368 4.243 20 0 HIADHN C[C@@H](NC[C@H]1CN(C(=O)c2ccccc2)[C@H]2CCN1C2)c1ccc(-c2ccccc2)o1 ZINC000502063698 911009810 /nfs/dbraw/zinc/00/98/10/911009810.db2.gz ZEWRSKMERVJNAL-OIBXWCBGSA-N 0 3 415.537 4.196 20 0 HIADHN Cc1cc([C@H](C)NC(=O)NCCCN2CCN(C)C[C@@H]2c2ccccc2)c(C)s1 ZINC000502191044 911128060 /nfs/dbraw/zinc/12/80/60/911128060.db2.gz YXCVALJTVPZTQB-PGRDOPGGSA-N 0 3 414.619 4.104 20 0 HIADHN C[C@@H](NC(=O)NC[C@H](c1ccccc1)N1CCCC1)c1cccc(OC(F)F)c1 ZINC000502225690 911172821 /nfs/dbraw/zinc/17/28/21/911172821.db2.gz KNMFRLJOXNPYBM-OXQOHEQNSA-N 0 3 403.473 4.485 20 0 HIADHN CC(C)(COc1ncccc1C(F)(F)F)NCC(=O)Nc1cc(Cl)ccc1F ZINC000502224524 911173284 /nfs/dbraw/zinc/17/32/84/911173284.db2.gz UGUNPQBICNUUIS-UHFFFAOYSA-N 0 3 419.806 4.279 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)C1(c2cccc(Br)c2)CC1 ZINC000513231785 921643467 /nfs/dbraw/zinc/64/34/67/921643467.db2.gz FQAUJKGQOXUMSE-FQEVSTJZSA-N 0 3 413.359 4.262 20 0 HIADHN COc1ccccc1NC(=O)C[C@@H](C)N[C@@H]1CCOc2c(Br)cccc21 ZINC000502301247 911262321 /nfs/dbraw/zinc/26/23/21/911262321.db2.gz ODSZNQVVMCWDNH-CZUORRHYSA-N 0 3 419.319 4.288 20 0 HIADHN C[C@H](NC(=O)NCCCN1CCN(C)C[C@@H]1c1ccccc1)c1ccc(Cl)cc1 ZINC000502397513 911382518 /nfs/dbraw/zinc/38/25/18/911382518.db2.gz AXDBGXWNTXTRNT-PGRDOPGGSA-N 0 3 414.981 4.079 20 0 HIADHN CCOc1c(Cl)cc(C(=O)NC[C@H]2CCCN2Cc2ccccc2)cc1OC ZINC000513248935 921657182 /nfs/dbraw/zinc/65/71/82/921657182.db2.gz KJMVWKOSOPTQRF-GOSISDBHSA-N 0 3 402.922 4.142 20 0 HIADHN CCOc1ccccc1NC(=O)[C@@H](NC1CCN(C(=O)C(C)C)CC1)c1ccccc1 ZINC000502416868 911396762 /nfs/dbraw/zinc/39/67/62/911396762.db2.gz QZSIAPAMHGWMDQ-QHCPKHFHSA-N 0 3 423.557 4.002 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)[C@@H]1C[C@@H]1c1cccc(Br)c1 ZINC000513258239 921663093 /nfs/dbraw/zinc/66/30/93/921663093.db2.gz YDTPWENZYBOPRF-PWRODBHTSA-N 0 3 413.359 4.333 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)C1(c2ccccc2Cl)CCOCC1 ZINC000513263820 921668203 /nfs/dbraw/zinc/66/82/03/921668203.db2.gz SKXATRPIYPLLKT-FQEVSTJZSA-N 0 3 412.961 4.169 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cccc2c1OCCO2)c1ccc(C(F)(F)F)cc1 ZINC000502533326 911537549 /nfs/dbraw/zinc/53/75/49/911537549.db2.gz BQKBIBIQOHATGG-GOSISDBHSA-N 0 3 422.447 4.290 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)c1csc(-c2ccc(F)c(F)c2)n1 ZINC000502569708 911576461 /nfs/dbraw/zinc/57/64/61/911576461.db2.gz MISDCTOPJHNQSJ-UHFFFAOYSA-N 0 3 401.482 4.292 20 0 HIADHN C/C=C\c1ccc(OCC(=O)NCC(C)(C)N2CCc3ccccc3C2)c(OC)c1 ZINC000502571594 911579097 /nfs/dbraw/zinc/57/90/97/911579097.db2.gz QJMKIEMSRWVYAA-YVMONPNESA-N 0 3 408.542 4.060 20 0 HIADHN CC[C@@H](NC(=O)NC[C@@H](Cc1ccccc1)N(C)C)c1ccccc1OC(F)F ZINC000502648200 911688612 /nfs/dbraw/zinc/68/86/12/911688612.db2.gz JCWMHPYQNBJXBX-IEBWSBKVSA-N 0 3 405.489 4.211 20 0 HIADHN CCN1CCC[C@@H](CN(C)C(=O)c2ccc3ccc(OC)cc3c2)[C@@H]1c1cnn(C)c1 ZINC000502731091 911758196 /nfs/dbraw/zinc/75/81/96/911758196.db2.gz QVDFSDCIMQOUIN-GBXCKJPGSA-N 0 3 420.557 4.127 20 0 HIADHN C[C@@H]1CCN(C)CCN1C(=O)N[C@@H](c1ccccc1)c1ccc(Br)cc1 ZINC000502811068 911827845 /nfs/dbraw/zinc/82/78/45/911827845.db2.gz HQPZOECWPUSANX-UZLBHIALSA-N 0 3 416.363 4.274 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)C[C@@H](C)C(=O)c3cccc(F)c3)c2)CC1 ZINC000502854661 911863240 /nfs/dbraw/zinc/86/32/40/911863240.db2.gz FHKJQDHAOOZSAU-GOSISDBHSA-N 0 3 411.521 4.204 20 0 HIADHN COCc1c2ccccc2oc1C(=O)Nc1cccc(N2CCN(C(C)C)CC2)c1 ZINC000502856306 911864527 /nfs/dbraw/zinc/86/45/27/911864527.db2.gz MWTJBXINSIDKGA-UHFFFAOYSA-N 0 3 407.514 4.362 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)Cc3ccc(C(F)(F)F)cc3)c2)CC1 ZINC000502870743 911876031 /nfs/dbraw/zinc/87/60/31/911876031.db2.gz UFNHTHOKFHSGDG-UHFFFAOYSA-N 0 3 405.464 4.417 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)[C@@H](C)Oc3ccccc3Cl)c2)CC1 ZINC000502879724 911880907 /nfs/dbraw/zinc/88/09/07/911880907.db2.gz IOQYLQFWBLRBDE-QGZVFWFLSA-N 0 3 401.938 4.276 20 0 HIADHN C/C=C\c1ccc(OCC(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)c(OC)c1 ZINC000502881387 911881346 /nfs/dbraw/zinc/88/13/46/911881346.db2.gz QWXVEHWOIBVGRL-ALCCZGGFSA-N 0 3 423.557 4.276 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)Cc3ccccc3C(F)(F)F)c2)CC1 ZINC000502892628 911887009 /nfs/dbraw/zinc/88/70/09/911887009.db2.gz LGCUHHVGCSHMAK-UHFFFAOYSA-N 0 3 405.464 4.417 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)C(C)(C)c2csc(-c3cccs3)n2)CC1 ZINC000502985936 911963460 /nfs/dbraw/zinc/96/34/60/911963460.db2.gz WHUNDUKHJGBKLF-UHFFFAOYSA-N 0 3 421.632 4.155 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)N[C@@H]2CCCc3c(O)cccc32)N(C)C)cc1 ZINC000503136450 912097277 /nfs/dbraw/zinc/09/72/77/912097277.db2.gz GSGJDAGGAUKKQK-YADHBBJMSA-N 0 3 411.546 4.159 20 0 HIADHN Cc1cnc([C@H](NC(=O)[C@@H]2CN(Cc3ccccc3)CCC2(F)F)C2CC2)s1 ZINC000513333802 921720729 /nfs/dbraw/zinc/72/07/29/921720729.db2.gz QFGDOVDMGKKWPQ-ZWKOTPCHSA-N 0 3 405.514 4.176 20 0 HIADHN COc1cccc([C@H](CNC(=O)NCCc2ccc(F)cc2Cl)N2CCCC2)c1 ZINC000503157728 912124415 /nfs/dbraw/zinc/12/44/15/912124415.db2.gz PXNMPJMIMTVKJM-NRFANRHFSA-N 0 3 419.928 4.167 20 0 HIADHN Cc1cc(C(=O)NC(C)C)ccc1NC(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000503158023 912125107 /nfs/dbraw/zinc/12/51/07/912125107.db2.gz ALFJDVQFGBPNSX-IBGZPJMESA-N 0 3 414.575 4.153 20 0 HIADHN CCN(C(=O)CSc1nccn1C(C)(C)C)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000503158726 912125226 /nfs/dbraw/zinc/12/52/26/912125226.db2.gz VFIMFDZNYIFJGE-UYAOXDASSA-N 0 3 414.619 4.414 20 0 HIADHN COc1ccc([C@@H](CNC(=O)Nc2ccc(OCC3CC3)cc2)N2CCCC2)cc1 ZINC000503159107 912127916 /nfs/dbraw/zinc/12/79/16/912127916.db2.gz WBWFSZUJXJTILT-HSZRJFAPSA-N 0 3 409.530 4.443 20 0 HIADHN O[C@@H](COc1ccc(Cl)cc1Br)CN1CCC[C@@H]1c1ccncc1 ZINC000503168869 912141451 /nfs/dbraw/zinc/14/14/51/912141451.db2.gz ZFKJSTXLHHGIGZ-NVXWUHKLSA-N 0 3 411.727 4.074 20 0 HIADHN CCCC(=O)Nc1ccc(CNC(=O)NC[C@H](c2ccc(CC)cc2)N(C)C)cc1 ZINC000503195229 912173499 /nfs/dbraw/zinc/17/34/99/912173499.db2.gz OIGGYHBXMDDUJU-JOCHJYFZSA-N 0 3 410.562 4.090 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)N3CCC[C@H]3c3ccccc3)CC2)c1 ZINC000503209395 912191733 /nfs/dbraw/zinc/19/17/33/912191733.db2.gz WLGCCPKUGIWXKC-VWLOTQADSA-N 0 3 420.601 4.444 20 0 HIADHN CCN(CCc1ccccc1)C(=O)NCCCCN1CCN(c2cccc(C)c2)CC1 ZINC000503215448 912197285 /nfs/dbraw/zinc/19/72/85/912197285.db2.gz GTYIENBSXGSXOX-UHFFFAOYSA-N 0 3 422.617 4.171 20 0 HIADHN Cc1cccc(C(=O)N2CCCC2)c1NC(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000506294891 914889876 /nfs/dbraw/zinc/88/98/76/914889876.db2.gz LZMAJYHXFPOLCD-FPOVZHCZSA-N 0 3 420.557 4.188 20 0 HIADHN Cc1cc(C)n(-c2cccc(NC(=O)N[C@@H]3CCN([C@H](C)c4ccccc4)C3)c2)n1 ZINC000506296603 914891515 /nfs/dbraw/zinc/89/15/15/914891515.db2.gz BCONPMPWZCPMSI-DENIHFKCSA-N 0 3 403.530 4.446 20 0 HIADHN CCC(C)(C)c1ccc(CNC(=O)NCc2ccccc2CN2CCC(O)CC2)cc1 ZINC000506307248 914897410 /nfs/dbraw/zinc/89/74/10/914897410.db2.gz QTSRJRKGNWSXDN-UHFFFAOYSA-N 0 3 423.601 4.330 20 0 HIADHN CCN(Cc1cccc(NC(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)c1)C(C)=O ZINC000506309124 914899069 /nfs/dbraw/zinc/89/90/69/914899069.db2.gz LKHJTXMHHURHRH-WZONZLPQSA-N 0 3 408.546 4.012 20 0 HIADHN Cc1ccc(-c2nnco2)cc1NC(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000506337554 914953952 /nfs/dbraw/zinc/95/39/52/914953952.db2.gz BNWMWFVBZNYGNJ-SFHVURJKSA-N 0 3 412.440 4.141 20 0 HIADHN COc1ccc(Br)c(NC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000506534935 915180318 /nfs/dbraw/zinc/18/03/18/915180318.db2.gz XXSMUFSFJQHNJO-MRXNPFEDSA-N 0 3 418.335 4.244 20 0 HIADHN Cc1n[nH]c(C)c1[C@@H]1CCCN1C(=O)NC[C@@H](c1ccc(CC(C)C)cc1)N(C)C ZINC000513385266 921757751 /nfs/dbraw/zinc/75/77/51/921757751.db2.gz VKMZYJMMJWLQHO-VXKWHMMOSA-N 0 3 411.594 4.374 20 0 HIADHN Cc1cc(CN2CCCN(Cc3cscn3)CC2)cc(C)c1OCc1ccccn1 ZINC000513391496 921763699 /nfs/dbraw/zinc/76/36/99/921763699.db2.gz CRWQHEXZGHKWPA-UHFFFAOYSA-N 0 3 422.598 4.442 20 0 HIADHN COc1cc(CN2CCC[C@H](c3nnc4n3CCCCC4)C2)c(SC)cc1OC ZINC000506633709 915302711 /nfs/dbraw/zinc/30/27/11/915302711.db2.gz PVVLQKOTELXAHM-INIZCTEOSA-N 0 3 416.591 4.123 20 0 HIADHN CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)C[C@H](c1cccs1)n1cccc1 ZINC000506644322 915313415 /nfs/dbraw/zinc/31/34/15/915313415.db2.gz VPLOBADHCDIRKX-MZKRTTBSSA-N 0 3 408.571 4.076 20 0 HIADHN CC[C@@H](N[C@@H](C)C(=O)Nc1ccc(OC(F)F)cc1)c1ccc(OC)c(OC)c1 ZINC000506661784 915337460 /nfs/dbraw/zinc/33/74/60/915337460.db2.gz JLYRJDBJJOKTBQ-SUMWQHHRSA-N 0 3 408.445 4.373 20 0 HIADHN COC(=O)C1(c2ccccc2)CCN(Cc2c[nH]nc2-c2ccc(Cl)cc2)CC1 ZINC000506663223 915338439 /nfs/dbraw/zinc/33/84/39/915338439.db2.gz QMBFXEJBFVMUIQ-UHFFFAOYSA-N 0 3 409.917 4.437 20 0 HIADHN CC[C@H](N[C@H](C)C(=O)N[C@H](C)c1ccccc1OC)c1ccc(OC)c(OC)c1 ZINC000506663518 915339536 /nfs/dbraw/zinc/33/95/36/915339536.db2.gz SAKOLXXYXXRMQU-MDZRGWNJSA-N 0 3 400.519 4.019 20 0 HIADHN CN(C)C(=O)CC1CCN(Cc2ccc(-c3cccc(Br)c3)o2)CC1 ZINC000513394279 921764886 /nfs/dbraw/zinc/76/48/86/921764886.db2.gz GVZYRRTVEWGSKK-UHFFFAOYSA-N 0 3 405.336 4.399 20 0 HIADHN CCCNC(=O)C1CCN(Cc2ccc(OCc3ccccc3)c(OCC)c2)CC1 ZINC000506675901 915351389 /nfs/dbraw/zinc/35/13/89/915351389.db2.gz RFGLJLBVCLPYKN-UHFFFAOYSA-N 0 3 410.558 4.403 20 0 HIADHN Cc1noc([C@H]2CCCCN2C(=O)NC[C@H](c2ccc(CC(C)C)cc2)N(C)C)n1 ZINC000513396168 921765556 /nfs/dbraw/zinc/76/55/56/921765556.db2.gz PHZIZFNELUKTAF-NHCUHLMSSA-N 0 3 413.566 4.116 20 0 HIADHN c1ncn(-c2ccc(CN3CCN(C4c5ccccc5-c5ccccc54)CC3)cc2)n1 ZINC000506688161 915366175 /nfs/dbraw/zinc/36/61/75/915366175.db2.gz HLTODKIPVURERC-UHFFFAOYSA-N 0 3 407.521 4.155 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(C)c1CN1CCC(c2nnc3ccccn32)CC1 ZINC000506722533 915404261 /nfs/dbraw/zinc/40/42/61/915404261.db2.gz WUISJYYREXGOTM-UHFFFAOYSA-N 0 3 404.493 4.051 20 0 HIADHN C[C@@H](CNC(=O)N1CCC[C@H](c2nc3ccc(F)cc3o2)C1)N(C)Cc1ccccc1 ZINC000506730417 915415815 /nfs/dbraw/zinc/41/58/15/915415815.db2.gz HIXFOHPNNFKNAQ-HKUYNNGSSA-N 0 3 424.520 4.376 20 0 HIADHN COC(=O)c1c(C2CC2)csc1NC(=O)N(CCN(C)C)Cc1ccccc1 ZINC000506853484 915637718 /nfs/dbraw/zinc/63/77/18/915637718.db2.gz AWJDMBHZBDCWEP-UHFFFAOYSA-N 0 3 401.532 4.008 20 0 HIADHN O=C(Nc1ccc(F)cc1OCC(F)(F)F)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000506872436 915662518 /nfs/dbraw/zinc/66/25/18/915662518.db2.gz GEXWJBFBEXVTSX-INIZCTEOSA-N 0 3 411.399 4.163 20 0 HIADHN CCc1cccc2c1OCC[C@H]2NC(=O)c1ccc(N2CCN(C(C)C)CC2)cc1 ZINC000506981362 915789213 /nfs/dbraw/zinc/78/92/13/915789213.db2.gz IQVZXWICYIDZPT-HSZRJFAPSA-N 0 3 407.558 4.033 20 0 HIADHN O=C(NCc1ccc(F)cc1)C1CCN(Cc2cccc(OC(F)(F)F)c2)CC1 ZINC000507014440 915822314 /nfs/dbraw/zinc/82/23/14/915822314.db2.gz WALZSBGQFDVJER-UHFFFAOYSA-N 0 3 410.411 4.253 20 0 HIADHN CC(C)(C)[C@@H](NCC(=O)Nc1cc(Cl)ccc1-n1cncn1)c1ccc(F)cc1 ZINC000507040592 915836707 /nfs/dbraw/zinc/83/67/07/915836707.db2.gz TXNBLYIUWUSSGA-FQEVSTJZSA-N 0 3 415.900 4.375 20 0 HIADHN COc1ccc(-c2nc(C)c([C@H](C)NC(=O)N(C)[C@H]3CCN(C4CC4)C3)s2)cc1 ZINC000507059531 915846615 /nfs/dbraw/zinc/84/66/15/915846615.db2.gz KQYADMZZKNVEDA-YJBOKZPZSA-N 0 3 414.575 4.066 20 0 HIADHN O=C(c1ccc(F)cc1Br)N1CCCN(CCCc2ccccc2)CC1 ZINC000507104534 915871764 /nfs/dbraw/zinc/87/17/64/915871764.db2.gz RUYWWQXMPGFZIG-UHFFFAOYSA-N 0 3 419.338 4.369 20 0 HIADHN O=C(c1ccc(N2CCCCCC2)nc1)N1CCCN(CCCc2ccccc2)CC1 ZINC000507160354 915897910 /nfs/dbraw/zinc/89/79/10/915897910.db2.gz FFYPXQZDZSAUDR-UHFFFAOYSA-N 0 3 420.601 4.243 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)CN2CC[C@@H](c3ccccc3C)C2)c(OC)c1 ZINC000507177364 915922068 /nfs/dbraw/zinc/92/20/68/915922068.db2.gz HAVLJEGWUTZXHF-XXBNENTESA-N 0 3 408.542 4.165 20 0 HIADHN CCc1nnc(NC(=O)[C@H](C)[C@H](C)N[C@H](C)c2ccccc2Br)s1 ZINC000507206809 915955894 /nfs/dbraw/zinc/95/58/94/915955894.db2.gz ANPYSEQQVIRRRK-GRYCIOLGSA-N 0 3 411.369 4.177 20 0 HIADHN COc1cc(CN(Cc2ccco2)C2CCCC2)ccc1OCC(=O)N1CCCC1 ZINC000507216987 915967179 /nfs/dbraw/zinc/96/71/79/915967179.db2.gz ZRZOVSYUBKVAOS-UHFFFAOYSA-N 0 3 412.530 4.234 20 0 HIADHN Cc1ccc(NC(=O)[C@H](C)N[C@@H](C)c2ccc3n[nH]cc3c2)c(Br)c1 ZINC000507221278 915974059 /nfs/dbraw/zinc/97/40/59/915974059.db2.gz HSHGDSAFGCMGDZ-STQMWFEESA-N 0 3 401.308 4.312 20 0 HIADHN Cc1ccc(NC(=O)[C@@H](C)N[C@@H](C)c2ccc3n[nH]cc3c2)c(Br)c1 ZINC000507221277 915975423 /nfs/dbraw/zinc/97/54/23/915975423.db2.gz HSHGDSAFGCMGDZ-QWHCGFSZSA-N 0 3 401.308 4.312 20 0 HIADHN C[C@@H](N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1=O)c1ccc2n[nH]cc2c1 ZINC000507233222 915989627 /nfs/dbraw/zinc/98/96/27/915989627.db2.gz QCPCJAPUBZPPSL-BFUOFWGJSA-N 0 3 400.429 4.011 20 0 HIADHN Cc1cc(NC(=O)[C@H](C)N[C@@H](C)c2ccc3n[nH]cc3c2)ccc1Br ZINC000507243684 916003316 /nfs/dbraw/zinc/00/33/16/916003316.db2.gz NOZJDGXQRVKXEF-STQMWFEESA-N 0 3 401.308 4.312 20 0 HIADHN CN(CCC(=O)Nc1ccccc1Br)C[C@@H]1OCCc2ccccc21 ZINC000507262709 916025925 /nfs/dbraw/zinc/02/59/25/916025925.db2.gz YFOSKKAZFXIQPK-IBGZPJMESA-N 0 3 403.320 4.024 20 0 HIADHN CCOC(=O)c1c(C(C)C)csc1NC(=O)N(CCN(C)C)Cc1ccco1 ZINC000507281726 916048632 /nfs/dbraw/zinc/04/86/32/916048632.db2.gz UKUQKTHATHXNSH-UHFFFAOYSA-N 0 3 407.536 4.237 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N2CCO[C@H](c3ccccc3Cl)C2)C1 ZINC000507343421 916098250 /nfs/dbraw/zinc/09/82/50/916098250.db2.gz XBLHBWFCFIPJAA-LZNRXBQRSA-N 0 3 413.949 4.258 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N2CCO[C@@H](c3ccccc3Cl)C2)C1 ZINC000507343423 916098552 /nfs/dbraw/zinc/09/85/52/916098552.db2.gz XBLHBWFCFIPJAA-ZWCUEREDSA-N 0 3 413.949 4.258 20 0 HIADHN NC(=O)CN(CCC(=O)Nc1ccccc1-c1ccccc1)CCC1CCCCC1 ZINC000507400913 916167789 /nfs/dbraw/zinc/16/77/89/916167789.db2.gz DQEQRZRVOWSMBQ-UHFFFAOYSA-N 0 3 407.558 4.440 20 0 HIADHN CN(CCNC(=O)c1ccc(NC(=O)Nc2ccccc2)cc1)Cc1ccccc1 ZINC000507452621 916222506 /nfs/dbraw/zinc/22/25/06/916222506.db2.gz WPKWBWDARXWELL-UHFFFAOYSA-N 0 3 402.498 4.192 20 0 HIADHN COCCSc1ccc([C@H](C)N[C@@H](C)C(=O)NCc2ccc(Cl)cc2)cc1 ZINC000507465910 916234283 /nfs/dbraw/zinc/23/42/83/916234283.db2.gz RDSPKUWRHNXKJU-HOTGVXAUSA-N 0 3 406.979 4.434 20 0 HIADHN COCCSc1ccc([C@H](C)N[C@@H](C)C(=O)N[C@@H](C)c2ccc(F)cc2)cc1 ZINC000507468363 916237931 /nfs/dbraw/zinc/23/79/31/916237931.db2.gz ZRKCYPKCXWTREU-ULQDDVLXSA-N 0 3 404.551 4.481 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3ccnc(C4CC4)c3)c(OCC)c2)CC1 ZINC000507599202 916354230 /nfs/dbraw/zinc/35/42/30/916354230.db2.gz DTOIPZHJQFOFAG-UHFFFAOYSA-N 0 3 408.546 4.142 20 0 HIADHN FC(F)(F)c1ccn(-c2ccc(CN3CCC(Oc4ccccn4)CC3)cc2)n1 ZINC000507664405 916426312 /nfs/dbraw/zinc/42/63/12/916426312.db2.gz GQNHKDNJXRKXJA-UHFFFAOYSA-N 0 3 402.420 4.330 20 0 HIADHN CCOc1c(Cl)cc(CN2CCC(CCCN3CCOCC3)CC2)cc1OC ZINC000507694886 916469504 /nfs/dbraw/zinc/46/95/04/916469504.db2.gz OEWWYWALHLZWSX-UHFFFAOYSA-N 0 3 410.986 4.072 20 0 HIADHN C[C@H](c1ccccc1)N(CC(=O)Nc1cccc(CN2CCSCC2)c1)C1CC1 ZINC000507698032 916479128 /nfs/dbraw/zinc/47/91/28/916479128.db2.gz MWLUQNREOKEGGT-LJQANCHMSA-N 0 3 409.599 4.400 20 0 HIADHN Cc1cc(C(=O)N(C)C2CCN(Cc3ccccc3)CC2)nn1-c1ccc(F)cc1F ZINC000507705635 916491486 /nfs/dbraw/zinc/49/14/86/916491486.db2.gz HAYHUTAGHCUSSA-UHFFFAOYSA-N 0 3 424.495 4.196 20 0 HIADHN CC(C)(C(=O)NC[C@@H]1CCCCN1C1CC1)c1csc(-c2c(F)cccc2F)n1 ZINC000507766275 916550228 /nfs/dbraw/zinc/55/02/28/916550228.db2.gz JVNXLIWTBLLBKV-HNNXBMFYSA-N 0 3 419.541 4.499 20 0 HIADHN CSc1ccccc1[C@@H](C)NC(=O)N(C)C1CCN(CCc2ccccn2)CC1 ZINC000507793613 916577474 /nfs/dbraw/zinc/57/74/74/916577474.db2.gz WVESIYLLLRWJFQ-GOSISDBHSA-N 0 3 412.603 4.213 20 0 HIADHN CCOc1ccccc1NC(=O)[C@@H](NCCc1c[nH]c2ncccc12)c1ccccc1 ZINC000507856333 916682580 /nfs/dbraw/zinc/68/25/80/916682580.db2.gz NFLUQQLDZUFQED-QHCPKHFHSA-N 0 3 414.509 4.474 20 0 HIADHN COc1ccc(CNCc2ccccc2-c2ccc(Cn3cncn3)cc2)cc1F ZINC000507856043 916683350 /nfs/dbraw/zinc/68/33/50/916683350.db2.gz RQWAJYAOLOKMRN-UHFFFAOYSA-N 0 3 402.473 4.431 20 0 HIADHN Fc1ccc(-c2nnc3n2C[C@@H](NCc2cc(Cl)ccc2OC(F)F)CC3)cc1 ZINC000507887150 916731744 /nfs/dbraw/zinc/73/17/44/916731744.db2.gz NXKXEPMWCLAZNZ-INIZCTEOSA-N 0 3 422.838 4.444 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(C)c1CN1CCC(C(=O)Nc2ccc(C)cn2)CC1 ZINC000507984351 916828293 /nfs/dbraw/zinc/82/82/93/916828293.db2.gz FHHUYMSDRHEWRH-UHFFFAOYSA-N 0 3 421.520 4.182 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CN1CCC(C(=O)Nc2ccc(C)cn2)CC1 ZINC000507986622 916829837 /nfs/dbraw/zinc/82/98/37/916829837.db2.gz PYPFWTPKMKJRLQ-UHFFFAOYSA-N 0 3 403.530 4.043 20 0 HIADHN COC(=O)c1cccc(-c2noc([C@H]3CN(Cc4ccccc4)CCC3(F)F)n2)c1 ZINC000508023609 916858874 /nfs/dbraw/zinc/85/88/74/916858874.db2.gz YMAFUQOCEJFZFX-GOSISDBHSA-N 0 3 413.424 4.148 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1ccc(Br)cc1F ZINC000508058327 916883470 /nfs/dbraw/zinc/88/34/70/916883470.db2.gz MYEWNJAYZXKFJE-UHFFFAOYSA-N 0 3 421.310 4.045 20 0 HIADHN CCCN(C(=O)N[C@@H]1CCCC12CCOCC2)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000508065933 916889206 /nfs/dbraw/zinc/88/92/06/916889206.db2.gz XWQFXTDXGHVFPI-DHIUTWEWSA-N 0 3 413.606 4.422 20 0 HIADHN CN(C)C(=O)Nc1ccc(Cl)c(C(=O)NCCN2CCC3(CCCCC3)CC2)c1 ZINC000508314556 917120882 /nfs/dbraw/zinc/12/08/82/917120882.db2.gz GNQXZLOIVYKJIX-UHFFFAOYSA-N 0 3 420.985 4.210 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)c1cccc(C(=O)Nc2ccccc2)c1 ZINC000508559645 917335221 /nfs/dbraw/zinc/33/52/21/917335221.db2.gz GGJYLOGVMQAXKO-UHFFFAOYSA-N 0 3 419.500 4.282 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)NCCCc1c[nH]c2ccc(F)cc12 ZINC000508630652 917396440 /nfs/dbraw/zinc/39/64/40/917396440.db2.gz SCWSMZOITIOHNX-UHFFFAOYSA-N 0 3 414.500 4.152 20 0 HIADHN CN(Cc1ccc(F)cc1F)C(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000508799197 917556046 /nfs/dbraw/zinc/55/60/46/917556046.db2.gz BLQKLLXYUOVSKS-HXUWFJFHSA-N 0 3 412.402 4.378 20 0 HIADHN O=C(Nc1ccc(-n2ccnc2)cc1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000508807153 917562391 /nfs/dbraw/zinc/56/23/91/917562391.db2.gz BTVONZSLMFVSTD-OAQYLSRUSA-N 0 3 414.431 4.265 20 0 HIADHN C[C@H](NC(=O)NC(C)(C)c1nc(C(F)(F)F)cs1)[C@H](c1ccccc1)N(C)C ZINC000508856676 917609388 /nfs/dbraw/zinc/60/93/88/917609388.db2.gz VZFPTFOIAGPVSX-SWLSCSKDSA-N 0 3 414.497 4.388 20 0 HIADHN C[C@H](NC(=O)N1CCC(c2c[nH]c3ncccc23)CC1)[C@@H](c1ccccc1)N(C)C ZINC000508869541 917623781 /nfs/dbraw/zinc/62/37/81/917623781.db2.gz YFYASYXAAJHVPJ-JTSKRJEESA-N 0 3 405.546 4.143 20 0 HIADHN Cc1nc2ccccc2n1C1CCN(C(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)CC1 ZINC000508891793 917645553 /nfs/dbraw/zinc/64/55/53/917645553.db2.gz CDPIYCHXRVBDHU-MHECFPHRSA-N 0 3 419.573 4.383 20 0 HIADHN C[C@@H](NC(=O)Nc1ccccc1N1C[C@@H](C)O[C@H](C)C1)[C@H](c1ccccc1)N(C)C ZINC000508895257 917650808 /nfs/dbraw/zinc/65/08/08/917650808.db2.gz LFKYKZVBHFWNHZ-FZONSQQESA-N 0 3 410.562 4.113 20 0 HIADHN CCOc1cc(NC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)ccc1OC ZINC000508978478 917732442 /nfs/dbraw/zinc/73/24/42/917732442.db2.gz IWSTUNAGHMYIPD-NRFANRHFSA-N 0 3 422.447 4.487 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)N1CCCC[C@@H]1c1cc[nH]n1)c1ccc(Cl)cc1 ZINC000509050882 917801653 /nfs/dbraw/zinc/80/16/53/917801653.db2.gz NHNYFPFOSDCPGX-UXHICEINSA-N 0 3 403.958 4.383 20 0 HIADHN CCn1ncc2ccc(NC(=O)[C@@]3(C(F)(F)F)CCN(Cc4ccccc4)C3)cc21 ZINC000509126871 917859385 /nfs/dbraw/zinc/85/93/85/917859385.db2.gz WHIMWKJLJXRONB-OAQYLSRUSA-N 0 3 416.447 4.449 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)c1cc(N(C)C)nc2ccccc21 ZINC000509200460 917904167 /nfs/dbraw/zinc/90/41/67/917904167.db2.gz MTOOYGGNLNYDDK-LJQANCHMSA-N 0 3 402.542 4.037 20 0 HIADHN COc1ccc(C(=O)CCN2CCC[C@H](c3nc(-c4ccc(F)cc4)no3)C2)cc1 ZINC000509347875 918012624 /nfs/dbraw/zinc/01/26/24/918012624.db2.gz GKXPJFMCVRXNRM-SFHVURJKSA-N 0 3 409.461 4.337 20 0 HIADHN COc1cc(C)c(CN(C)C[C@H](O)COc2c(Cl)cccc2Cl)cc1OC ZINC000509359186 918024844 /nfs/dbraw/zinc/02/48/44/918024844.db2.gz QOHDHKZRSKTZAE-HNNXBMFYSA-N 0 3 414.329 4.191 20 0 HIADHN Cn1cnnc1C1CCN(Cc2cn(-c3ccccc3Cl)nc2C(C)(C)C)CC1 ZINC000509368841 918034578 /nfs/dbraw/zinc/03/45/78/918034578.db2.gz AOFWDAMIVMKFEG-UHFFFAOYSA-N 0 3 412.969 4.331 20 0 HIADHN Cc1cccc(CN(CCc2c(C)nc3sccn3c2=O)Cc2ccccn2)c1 ZINC000509375560 918041271 /nfs/dbraw/zinc/04/12/71/918041271.db2.gz YQLQEMVSENSPAO-UHFFFAOYSA-N 0 3 404.539 4.013 20 0 HIADHN CCN1CCN(CCNC(=O)c2ccc(Oc3cccc(Cl)c3Cl)cc2)CC1 ZINC000509497587 918142605 /nfs/dbraw/zinc/14/26/05/918142605.db2.gz GRDIMWQJVQKSDM-UHFFFAOYSA-N 0 3 422.356 4.153 20 0 HIADHN C[C@H]1CCCN(C(=O)C2CCN(Cc3ccccc3OCc3ccccn3)CC2)C1 ZINC000509518277 918166995 /nfs/dbraw/zinc/16/69/95/918166995.db2.gz FQPPKPXMQAZFBL-FQEVSTJZSA-N 0 3 407.558 4.131 20 0 HIADHN Cc1ccc(NC(=O)[C@@H](C)N[C@@H]2CCc3ccccc3OC2)c(Br)c1 ZINC000509530191 918177258 /nfs/dbraw/zinc/17/72/58/918177258.db2.gz XUCQHBDMYHAOEK-GDBMZVCRSA-N 0 3 403.320 4.068 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N1CCC[C@H]1c1cc(OC)ccc1OC)c1ccco1 ZINC000509566038 918215713 /nfs/dbraw/zinc/21/57/13/918215713.db2.gz CIBPUNKHQGFAPP-VDGAXYAQSA-N 0 3 415.534 4.273 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N1CCC[C@@H]1c1cc(OC)ccc1OC)c1ccco1 ZINC000509566037 918216148 /nfs/dbraw/zinc/21/61/48/918216148.db2.gz CIBPUNKHQGFAPP-PWIZWCRZSA-N 0 3 415.534 4.273 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N1CCC[C@@H]1c1ccc2c(c1)OCCO2)c1ccco1 ZINC000509571319 918221163 /nfs/dbraw/zinc/22/11/63/918221163.db2.gz RYSJCJBWEFKBDE-YTQUADARSA-N 0 3 413.518 4.027 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N[C@H](C)c1ccc(OC)c(OC)c1C)c1ccco1 ZINC000509572284 918221300 /nfs/dbraw/zinc/22/13/00/918221300.db2.gz VBXUMOOBRJLHDY-YXJHDRRASA-N 0 3 403.523 4.095 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N1CCCCC[C@H]1c1c(C)n[nH]c1C)c1ccco1 ZINC000509575326 918224689 /nfs/dbraw/zinc/22/46/89/918224689.db2.gz VPJQGERYRHSEMS-IPELMVKDSA-N 0 3 401.555 4.376 20 0 HIADHN COc1ccccc1NC(=O)C1CCN(Cc2c(C)nn(-c3ccccc3)c2C)CC1 ZINC000509574830 918225220 /nfs/dbraw/zinc/22/52/20/918225220.db2.gz XSNDKDZXMWLUAZ-UHFFFAOYSA-N 0 3 418.541 4.348 20 0 HIADHN CCOc1cc(CN(CC)[C@H](C)c2cccc(O)c2)ccc1O[C@@H](C)C(=O)N(C)C ZINC000509579832 918228564 /nfs/dbraw/zinc/22/85/64/918228564.db2.gz NSEZVSDRJIPDDB-MSOLQXFVSA-N 0 3 414.546 4.230 20 0 HIADHN COc1ccc(C[C@H](NCc2ccc3c(c2)NC(=O)CO3)c2ccc(OC)cc2)cc1 ZINC000509584228 918233531 /nfs/dbraw/zinc/23/35/31/918233531.db2.gz MVIPIYDTPDZTCH-QFIPXVFZSA-N 0 3 418.493 4.108 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N(C)Cc1ccccc1Br)c1ccco1 ZINC000509584445 918233823 /nfs/dbraw/zinc/23/38/23/918233823.db2.gz CKVGWDDNYGKOFP-WMLDXEAASA-N 0 3 408.340 4.313 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N(C)Cc1ccc(SC)c(OC)c1)c1ccco1 ZINC000509593227 918243116 /nfs/dbraw/zinc/24/31/16/918243116.db2.gz CRGOERUUMJYHJQ-RDJZCZTQSA-N 0 3 405.564 4.281 20 0 HIADHN CC[C@@H](NC(=O)N[C@H](CN(C)C)c1ccc(Cl)cc1)c1ccc(OC)c(OC)c1 ZINC000509594939 918244179 /nfs/dbraw/zinc/24/41/79/918244179.db2.gz GBIPQLTZHLBJCE-RTBURBONSA-N 0 3 419.953 4.410 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)N(C)Cc1csc(Br)c1)c1ccco1 ZINC000509595659 918244776 /nfs/dbraw/zinc/24/47/76/918244776.db2.gz INHXPZQTBDXTJX-OCCSQVGLSA-N 0 3 414.369 4.374 20 0 HIADHN CC[C@@H](NC(=O)N[C@@H](CN(C)C)c1ccc(Cl)cc1)c1ccc(OC)c(OC)c1 ZINC000509594932 918244865 /nfs/dbraw/zinc/24/48/65/918244865.db2.gz GBIPQLTZHLBJCE-MOPGFXCFSA-N 0 3 419.953 4.410 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N1CCO[C@@H](c2ccc(F)cc2Cl)C1)c1ccco1 ZINC000509613653 918261437 /nfs/dbraw/zinc/26/14/37/918261437.db2.gz NUIFNMFSIYVMBH-ADLFWFRXSA-N 0 3 423.916 4.284 20 0 HIADHN CSc1ccc(NC(=O)NCCCCN2CCN(Cc3ccccc3)CC2)cc1 ZINC000509709768 918337698 /nfs/dbraw/zinc/33/76/98/918337698.db2.gz CLBKKZWUQHNUJP-UHFFFAOYSA-N 0 3 412.603 4.128 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CNC(=O)c1oc2ccccc2c1CN(C)C ZINC000509811608 918415373 /nfs/dbraw/zinc/41/53/73/918415373.db2.gz VQBXEWFCJMEDMD-UHFFFAOYSA-N 0 3 402.498 4.227 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)NC[C@@H](c3ccccc3)[NH+]3CCCC3)cc2)cc(=O)[n-]1 ZINC000509880582 918482040 /nfs/dbraw/zinc/48/20/40/918482040.db2.gz MRPNMWRVIKHQJA-QFIPXVFZSA-N 0 3 417.513 4.116 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)NC[C@H](c3cccs3)N3CCCC3)cc2)cc(=O)[nH]1 ZINC000509885514 918487474 /nfs/dbraw/zinc/48/74/74/918487474.db2.gz YSOHAHAFEAMICV-LJQANCHMSA-N 0 3 423.542 4.178 20 0 HIADHN O=C(Nc1ccccc1)N1CC[C@@H](NCc2ccccc2OCc2cccnc2)C1 ZINC000509963179 918554122 /nfs/dbraw/zinc/55/41/22/918554122.db2.gz HYETWVFCOLGRGT-JOCHJYFZSA-N 0 3 402.498 4.057 20 0 HIADHN CCN1CCN(c2ccccc2CNc2ccc(NC(=O)CC(F)(F)F)cc2)CC1 ZINC000509963653 918554247 /nfs/dbraw/zinc/55/42/47/918554247.db2.gz NHVFIQLTMRFFKO-UHFFFAOYSA-N 0 3 420.479 4.332 20 0 HIADHN Cc1cn(-c2ccc(F)cc2)nc1C(=O)NC[C@H]1CCCN(C)[C@@H]1c1cccs1 ZINC000509977038 918566232 /nfs/dbraw/zinc/56/62/32/918566232.db2.gz KGIOJUBSWWKPCU-IERDGZPVSA-N 0 3 412.534 4.194 20 0 HIADHN CCOC(=O)C(C)(C)C1CCN(Cc2cccc(C(=O)N3CCCCC3)c2)CC1 ZINC000510073981 918642532 /nfs/dbraw/zinc/64/25/32/918642532.db2.gz PQYDJWYOUFAODJ-UHFFFAOYSA-N 0 3 400.563 4.114 20 0 HIADHN CC1CCN([C@H](CNC(=O)Nc2nnc(-c3ccco3)s2)c2cccs2)CC1 ZINC000510238047 918777485 /nfs/dbraw/zinc/77/74/85/918777485.db2.gz FXYFEOWYGVTRFV-CQSZACIVSA-N 0 3 417.560 4.454 20 0 HIADHN CC1CCN([C@@H](CNC(=O)Nc2nnc(-c3ccco3)s2)c2cccs2)CC1 ZINC000510238044 918777586 /nfs/dbraw/zinc/77/75/86/918777586.db2.gz FXYFEOWYGVTRFV-AWEZNQCLSA-N 0 3 417.560 4.454 20 0 HIADHN CC(C)[C@H](CNC(=O)Nc1nnc(-c2ccco2)s1)N1CCc2ccccc2C1 ZINC000510250173 918786317 /nfs/dbraw/zinc/78/63/17/918786317.db2.gz AKPWBVNVUKMSQJ-KRWDZBQOSA-N 0 3 411.531 4.003 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N3CCC(c4c[nH]c5ccccc54)CC3)cc2)CC1 ZINC000510331933 918836538 /nfs/dbraw/zinc/83/65/38/918836538.db2.gz HELQCHLZLCDVGY-UHFFFAOYSA-N 0 3 416.569 4.330 20 0 HIADHN COc1cc(C(=O)N(Cc2ccco2)C2CCN(C)CC2)cc(OC)c1C(C)C ZINC000510342206 918841751 /nfs/dbraw/zinc/84/17/51/918841751.db2.gz MNKKSHXVDPATOK-UHFFFAOYSA-N 0 3 400.519 4.157 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3ccccc3N3CCCCCC3)cc2)CC1 ZINC000510348986 918845711 /nfs/dbraw/zinc/84/57/11/918845711.db2.gz RGQZFPHURLPTKW-UHFFFAOYSA-N 0 3 406.574 4.461 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N[C@@H](C)c3ccc(Br)cc3)cc2)CC1 ZINC000510399546 918873701 /nfs/dbraw/zinc/87/37/01/918873701.db2.gz ROUOBLOOXQNHPP-INIZCTEOSA-N 0 3 416.363 4.082 20 0 HIADHN O[C@@H](COc1cc(Cl)ccc1Cl)CN1CC[C@H](n2ncc3ccccc32)C1 ZINC000510403958 918877167 /nfs/dbraw/zinc/87/71/67/918877167.db2.gz XXBVFEMTUJPLMA-DLBZAZTESA-N 0 3 406.313 4.030 20 0 HIADHN C[C@H](NC(=O)NC[C@H](c1c[nH]c2ccccc21)c1ccccc1)C1=CCN(C)CC1 ZINC000510499162 918947788 /nfs/dbraw/zinc/94/77/88/918947788.db2.gz FIZSMRFKEXVGNK-AVRDEDQJSA-N 0 3 402.542 4.249 20 0 HIADHN C[C@@H]1CN(C2CCN(Cc3ccc(-c4ccc(Br)cc4)o3)CC2)CCO1 ZINC000510509598 918956507 /nfs/dbraw/zinc/95/65/07/918956507.db2.gz WIHGUHXJQCFYTB-MRXNPFEDSA-N 0 3 419.363 4.394 20 0 HIADHN C[C@H](NC(=O)N[C@@H](c1ccc(Br)cc1)C1CCC1)C1=CCN(C)CC1 ZINC000510518755 918964631 /nfs/dbraw/zinc/96/46/31/918964631.db2.gz BIUHDRHOJQDDNW-IFXJQAMLSA-N 0 3 406.368 4.240 20 0 HIADHN C[C@@H]1CN(C2CCN(Cc3ccc(Oc4ccccc4F)c(F)c3)CC2)CCO1 ZINC000510556793 919001390 /nfs/dbraw/zinc/00/13/90/919001390.db2.gz AKNXPJUTHLGXPH-QGZVFWFLSA-N 0 3 402.485 4.442 20 0 HIADHN CCc1ccc(Cl)c(CC)c1NC(=O)CCCN1CCO[C@@]2(CCCOC2)C1 ZINC000510579218 919020893 /nfs/dbraw/zinc/02/08/93/919020893.db2.gz NDHURQHIOKUIGD-QFIPXVFZSA-N 0 3 408.970 4.065 20 0 HIADHN Cc1ccc2nc(CN3CCC[C@@H](c4nc5ccccc5n4C(C)C)C3)cc(=O)n2c1 ZINC000510661228 919101378 /nfs/dbraw/zinc/10/13/78/919101378.db2.gz UXTHREYWBMHYAE-LJQANCHMSA-N 0 3 415.541 4.313 20 0 HIADHN C[C@@H]1CN(c2ccc(CN[C@@H]3CCc4ccc(Br)cc43)cn2)C[C@@H](C)O1 ZINC000510668471 919109639 /nfs/dbraw/zinc/10/96/39/919109639.db2.gz JNIDFTGAPJCUNH-STXHMFSFSA-N 0 3 416.363 4.235 20 0 HIADHN CCCC(=O)Nc1cccc(NC(=O)NC[C@@H](c2ccc(OC)cc2)N2CCCC2)c1 ZINC000510673406 919113639 /nfs/dbraw/zinc/11/36/39/919113639.db2.gz BKIGPSFVCNNXJP-QFIPXVFZSA-N 0 3 424.545 4.392 20 0 HIADHN Cc1cc(OCCC[C@H](C)[NH2+][C@@H](c2nc(-c3nc[n-]n3)no2)C(C)C)ccc1Cl ZINC000510677228 919117480 /nfs/dbraw/zinc/11/74/80/919117480.db2.gz AGADUUDQEMDOMI-WMLDXEAASA-N 0 3 418.929 4.351 20 0 HIADHN COc1cccc([C@H](CNC(=O)Nc2ccc(OC(F)F)c(F)c2)N2CCCC2)c1 ZINC000510683530 919123779 /nfs/dbraw/zinc/12/37/79/919123779.db2.gz GRSCQZGFPSUEOX-SFHVURJKSA-N 0 3 423.435 4.394 20 0 HIADHN Cc1cccc([C@@H](NCc2ccnc(N3CCN(C)CC3)c2)c2cccc(F)c2)c1 ZINC000510704645 919143711 /nfs/dbraw/zinc/14/37/11/919143711.db2.gz OIXCCYRUOSVHCH-RUZDIDTESA-N 0 3 404.533 4.160 20 0 HIADHN COc1ccc(-c2nc3c(s2)[C@@H](NCc2cnn(CC(F)F)c2)CCC3)cc1 ZINC000510714044 919155052 /nfs/dbraw/zinc/15/50/52/919155052.db2.gz DUCOEPXAROWOAU-INIZCTEOSA-N 0 3 404.486 4.448 20 0 HIADHN Cc1ccc(OCc2cccc(C(=O)N(CCN(C)C)Cc3ccccc3F)c2)cn1 ZINC000510716824 919159341 /nfs/dbraw/zinc/15/93/41/919159341.db2.gz JXDJIAZYXAZGQW-UHFFFAOYSA-N 0 3 421.516 4.312 20 0 HIADHN C[C@H](NC(=O)c1csc(-c2ccc(Br)s2)n1)C1=CCN(C)CC1 ZINC000510742469 919190679 /nfs/dbraw/zinc/19/06/79/919190679.db2.gz CLEWEDKPLNVQKD-JTQLQIEISA-N 0 3 412.378 4.014 20 0 HIADHN O=C([C@@H](Cc1ccccc1)N[C@@H]1CCc2ccc(Br)cc21)N1CCCC1 ZINC000510745603 919194925 /nfs/dbraw/zinc/19/49/25/919194925.db2.gz CRFAIXJHENEQFM-NHCUHLMSSA-N 0 3 413.359 4.260 20 0 HIADHN CC[C@@H](C)n1ncc2c1nc(C)cc2C(=O)NCC(C)(C)N1CCc2ccccc2C1 ZINC000510785555 919250238 /nfs/dbraw/zinc/25/02/38/919250238.db2.gz VDGNRUYKVHYFGJ-GOSISDBHSA-N 0 3 419.573 4.277 20 0 HIADHN C[C@H](NC(=O)[C@@H](Oc1ccc(F)c(Cl)c1)c1ccccc1)C1=CCN(C)CC1 ZINC000510801303 919271957 /nfs/dbraw/zinc/27/19/57/919271957.db2.gz VKWNTTIWGIDVFN-BTYIYWSLSA-N 0 3 402.897 4.366 20 0 HIADHN COC(=O)c1c(C)c(C)sc1NC(=O)CN[C@@H](c1ccc(OC)cc1)C(C)C ZINC000510807686 919282326 /nfs/dbraw/zinc/28/23/26/919282326.db2.gz BOSXGIKHIQMFMI-LJQANCHMSA-N 0 3 404.532 4.086 20 0 HIADHN COc1ccc(C[C@@H](C)C(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)cc1OC ZINC000510885898 919383773 /nfs/dbraw/zinc/38/37/73/919383773.db2.gz YKUKXUPTVGYTIY-KNQAVFIVSA-N 0 3 410.558 4.005 20 0 HIADHN CCOc1cccc2cc([C@H](C)N[C@H]3CCN(C(=O)COc4ccccc4)C3)oc21 ZINC000511013416 919580276 /nfs/dbraw/zinc/58/02/76/919580276.db2.gz JEMANEXWGVJMQQ-HKUYNNGSSA-N 0 3 408.498 4.162 20 0 HIADHN CC(C)[C@H](NCC(=O)N1CCC[C@H]1c1ccc2c(c1)OCCCO2)c1ccccc1 ZINC000511047085 919638232 /nfs/dbraw/zinc/63/82/32/919638232.db2.gz TXDJFCJPXSNJHV-OFVILXPXSA-N 0 3 408.542 4.498 20 0 HIADHN CC1(c2nc3ccccc3s2)CCN(C[C@@H](O)COc2ccccc2F)CC1 ZINC000511106307 919712860 /nfs/dbraw/zinc/71/28/60/919712860.db2.gz GTMMJJZULUFGGU-MRXNPFEDSA-N 0 3 400.519 4.229 20 0 HIADHN O=C(Nc1cc(F)c(Br)cc1F)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000511126023 919740006 /nfs/dbraw/zinc/74/00/06/919740006.db2.gz NZNBTSPGYJCQNK-CYBMUJFWSA-N 0 3 410.262 4.123 20 0 HIADHN Cc1cc(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2)ccc1Br ZINC000511171440 919793849 /nfs/dbraw/zinc/79/38/49/919793849.db2.gz RLOCLEZOBPXMKP-UHFFFAOYSA-N 0 3 408.315 4.492 20 0 HIADHN C[C@H](NC(=O)N1CCC(c2nc3cc(Cl)ccc3s2)CC1)C1=CCN(C)CC1 ZINC000511216426 919826949 /nfs/dbraw/zinc/82/69/49/919826949.db2.gz LIXXZRKTOMOKAV-AWEZNQCLSA-N 0 3 418.994 4.489 20 0 HIADHN CCOc1ccc(NC(=O)c2ccc(NC(=O)N[C@@H](C)C3=CCN(C)CC3)cc2)cc1 ZINC000511232438 919836076 /nfs/dbraw/zinc/83/60/76/919836076.db2.gz WMKXROBIIPAPPD-KRWDZBQOSA-N 0 3 422.529 4.110 20 0 HIADHN C[C@H](NC(=O)NCC1(c2ccc(Br)cc2)CCCC1)C1=CCN(C)CC1 ZINC000511250741 919851617 /nfs/dbraw/zinc/85/16/17/919851617.db2.gz RGCSVSUZAWOXSJ-INIZCTEOSA-N 0 3 420.395 4.211 20 0 HIADHN CC[C@@H](C)n1ncc2c1nc(C)cc2C(=O)NC[C@H](CC)N1CCc2ccccc2C1 ZINC000511269012 919867522 /nfs/dbraw/zinc/86/75/22/919867522.db2.gz UAWFXPOTKTYGNE-NQIIRXRSSA-N 0 3 419.573 4.277 20 0 HIADHN Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)NC(=O)N[C@H](C)C1=CCN(C)CC1 ZINC000511271288 919869126 /nfs/dbraw/zinc/86/91/26/919869126.db2.gz VKSVDTIGVHYWGL-HIFRSBDPSA-N 0 3 402.539 4.268 20 0 HIADHN C[C@@H](NC(=O)N1CCC[C@H](Oc2ccc(Cl)c(Cl)c2)C1)C1=CCN(C)CC1 ZINC000511273856 919870499 /nfs/dbraw/zinc/87/04/99/919870499.db2.gz PBHDMAYULIZCJF-PBHICJAKSA-N 0 3 412.361 4.197 20 0 HIADHN Cc1ccccc1-c1nn(-c2ccccc2)cc1C(=O)N[C@@H](C)C1=CCN(C)CC1 ZINC000511356425 919950514 /nfs/dbraw/zinc/95/05/14/919950514.db2.gz CLMRNLSJMYZFKE-IBGZPJMESA-N 0 3 400.526 4.228 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N[C@@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000511366045 919959841 /nfs/dbraw/zinc/95/98/41/919959841.db2.gz SMWPTIPZPNUSIB-SESVDKBCSA-N 0 3 413.587 4.352 20 0 HIADHN C[C@H](NC(=O)c1ccc(SCc2cn3ccccc3n2)cc1)C1=CCN(C)CC1 ZINC000511370925 919963805 /nfs/dbraw/zinc/96/38/05/919963805.db2.gz VYEZWBNZDXJDPF-KRWDZBQOSA-N 0 3 406.555 4.007 20 0 HIADHN O=C(N[C@@H](C[C@@H]1CCOC1)c1ccccc1)N1CCCN(Cc2ccccc2)CC1 ZINC000511390289 919996898 /nfs/dbraw/zinc/99/68/98/919996898.db2.gz HVEPNUHQIFUUPQ-UPVQGACJSA-N 0 3 407.558 4.072 20 0 HIADHN CN(Cc1ccccc1)Cc1cccc(C(=O)NCc2ccc(Cn3ccnc3)cc2)c1 ZINC000511423044 920038642 /nfs/dbraw/zinc/03/86/42/920038642.db2.gz VCVSFLZSQIMYPA-UHFFFAOYSA-N 0 3 424.548 4.493 20 0 HIADHN CCOc1cccc(NC(=O)NCCCCN2CCN(c3cccc(C)c3)CC2)c1 ZINC000511510806 920129429 /nfs/dbraw/zinc/12/94/29/920129429.db2.gz FUCMTDRDXRDFKL-UHFFFAOYSA-N 0 3 410.562 4.118 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)N[C@@H](CC(F)(F)F)c2ccc(F)cc2)o1 ZINC000511544093 920170298 /nfs/dbraw/zinc/17/02/98/920170298.db2.gz WTRMPHIIPYOARE-SFHVURJKSA-N 0 3 415.431 4.494 20 0 HIADHN O=C(Nc1cccc(C(=O)N2CCCCC2)c1)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000511610692 920261598 /nfs/dbraw/zinc/26/15/98/920261598.db2.gz GIFDUAYKTASQJU-HSZRJFAPSA-N 0 3 420.557 4.099 20 0 HIADHN Cc1cc(CN(CCCO)Cc2ccc(Cl)c(Cl)c2)ccc1-n1cncn1 ZINC000511625582 920283784 /nfs/dbraw/zinc/28/37/84/920283784.db2.gz JRUTWYVQZUJGQV-UHFFFAOYSA-N 0 3 405.329 4.267 20 0 HIADHN COc1ccc(C(=O)C2CCN(C(=O)[C@H]3CCCN(Cc4ccccc4)C3)CC2)cc1 ZINC000511631687 920291854 /nfs/dbraw/zinc/29/18/54/920291854.db2.gz VSRUWAOBMIUAAI-QHCPKHFHSA-N 0 3 420.553 4.029 20 0 HIADHN COc1cc(CN2CCC(CNC(C)=O)CC2)ccc1OCc1ccc(Cl)cc1 ZINC000511656516 920324864 /nfs/dbraw/zinc/32/48/64/920324864.db2.gz MYVHIRRZMZGEBP-UHFFFAOYSA-N 0 3 416.949 4.276 20 0 HIADHN CN(C)Cc1ccc(C(=O)Nc2cc(-c3ccc(Br)s3)[nH]n2)cc1 ZINC000511664643 920330539 /nfs/dbraw/zinc/33/05/39/920330539.db2.gz MFVLGSWQBWDUPJ-UHFFFAOYSA-N 0 3 405.321 4.215 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)c2cc3c(cccc3Br)[nH]2)C1 ZINC000511677282 920340880 /nfs/dbraw/zinc/34/08/80/920340880.db2.gz JEMAVJKLPQTEID-GOEBONIOSA-N 0 3 412.331 4.496 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)c2cc3c(cccc3Br)[nH]2)C1 ZINC000511677283 920342453 /nfs/dbraw/zinc/34/24/53/920342453.db2.gz JEMAVJKLPQTEID-HOCLYGCPSA-N 0 3 412.331 4.496 20 0 HIADHN O=C(N[C@@H]1CN(Cc2ccccc2)C[C@H]1c1ccccc1)c1cc(-c2cccnc2)on1 ZINC000511732183 920399479 /nfs/dbraw/zinc/39/94/79/920399479.db2.gz XTDDDDXHHJSFQN-LADGPHEKSA-N 0 3 424.504 4.135 20 0 HIADHN O=C(COc1ccc(Cl)c2cccnc12)NC[C@H](c1cccs1)N1CCCC1 ZINC000511753314 920430369 /nfs/dbraw/zinc/43/03/69/920430369.db2.gz LGMUDTOTYXESEQ-QGZVFWFLSA-N 0 3 415.946 4.282 20 0 HIADHN Cc1cc(C(=O)CN2C[C@H](c3ccccc3)[C@@H]3COCC[C@@H]32)c(C)n1CC(F)(F)F ZINC000511754324 920431718 /nfs/dbraw/zinc/43/17/18/920431718.db2.gz JBTLWIQMKVIRCD-HKBOAZHASA-N 0 3 420.475 4.354 20 0 HIADHN Cc1cc(C(=O)CN2C[C@H](c3ccccc3)[C@H]3COCC[C@@H]32)c(C)n1Cc1ccco1 ZINC000511754850 920434203 /nfs/dbraw/zinc/43/42/03/920434203.db2.gz JRLMJKQZYLRIKQ-SDHSZQHLSA-N 0 3 418.537 4.433 20 0 HIADHN Brc1cc(CN2C[C@H](c3ccccc3)[C@@H]3COCC[C@@H]32)cc2c1OCO2 ZINC000511765224 920448828 /nfs/dbraw/zinc/44/88/28/920448828.db2.gz NYPIRMDNBJNEIL-AOIWGVFYSA-N 0 3 416.315 4.182 20 0 HIADHN Brc1cc(CN2C[C@H](c3ccccc3)[C@@H]3COCC[C@H]32)cc2c1OCO2 ZINC000511765227 920449248 /nfs/dbraw/zinc/44/92/48/920449248.db2.gz NYPIRMDNBJNEIL-ZIFCJYIRSA-N 0 3 416.315 4.182 20 0 HIADHN O=C(CCc1ccccc1Br)NC[C@H](c1cccs1)N1CCCC1 ZINC000511767099 920453106 /nfs/dbraw/zinc/45/31/06/920453106.db2.gz JNGGCPMMMJYDMB-QGZVFWFLSA-N 0 3 407.377 4.397 20 0 HIADHN C[C@H](c1ccc2ccccc2c1)N(Cc1cnc(N2CCN(C)CC2)nc1)C1CC1 ZINC000511775017 920462599 /nfs/dbraw/zinc/46/25/99/920462599.db2.gz FPOKEVAARURTRD-LJQANCHMSA-N 0 3 401.558 4.107 20 0 HIADHN Brc1ccc2[nH]c(CN3C[C@H](c4ccccc4)[C@@H]4COCC[C@H]43)nc2c1 ZINC000511775953 920465239 /nfs/dbraw/zinc/46/52/39/920465239.db2.gz JCCGHGDZQWQKEM-FUHIMQAGSA-N 0 3 412.331 4.330 20 0 HIADHN O=C(N[C@@H]1CN(Cc2ccccc2)C[C@H]1c1ccccc1)c1cc(-c2ccccn2)no1 ZINC000511786705 920479430 /nfs/dbraw/zinc/47/94/30/920479430.db2.gz UEVHKKJQFWOUDG-XUZZJYLKSA-N 0 3 424.504 4.135 20 0 HIADHN Nc1nc(CN2C[C@H](c3ccccc3)[C@@H]3COCC[C@H]32)nc2sc3c(c21)CCCC3 ZINC000511786287 920479500 /nfs/dbraw/zinc/47/95/00/920479500.db2.gz MHZCTWLTFCJAEF-CEXWTWQISA-N 0 3 420.582 4.157 20 0 HIADHN COCc1ccccc1/C=C(/C)CN[C@@H]1CC(=O)N(C)[C@H]1c1ccc(F)c(F)c1 ZINC000511800097 920494591 /nfs/dbraw/zinc/49/45/91/920494591.db2.gz TZULGGUDGMZGRZ-GOSYHEGASA-N 0 3 400.469 4.076 20 0 HIADHN CCOC(=O)c1c(C)oc2nc(CN3C[C@H](c4ccccc4)[C@@H]4CCC[C@H]43)nc(N)c21 ZINC000511821783 920519168 /nfs/dbraw/zinc/51/91/68/920519168.db2.gz FTLUPCJGTAVHBA-RCCFBDPRSA-N 0 3 420.513 4.058 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)CCc1ccc2ccccc2n1)c1cccc(OC)c1 ZINC000511834617 920542619 /nfs/dbraw/zinc/54/26/19/920542619.db2.gz LDGZYJPCRGYBLO-DEOSSOPVSA-N 0 3 405.542 4.375 20 0 HIADHN CC(C)Cc1ccc([C@H](CNC(=O)N[C@H](C)c2c(F)cncc2F)N(C)C)cc1 ZINC000511873544 920601741 /nfs/dbraw/zinc/60/17/41/920601741.db2.gz FZDVSPOBJUOAHA-QRWLVFNGSA-N 0 3 404.505 4.221 20 0 HIADHN CCCOc1ccc(O[C@H]2CCCC[C@H]2NCc2ncc(CN(C)C)s2)cc1 ZINC000512032274 920804262 /nfs/dbraw/zinc/80/42/62/920804262.db2.gz TYWUYWBTEJGBKZ-RTWAWAEBSA-N 0 3 403.592 4.473 20 0 HIADHN COc1cc2c(cc1OC)CCN(Cc1c(C)nn(Cc3ccccc3)c1C)CC2 ZINC000512055759 920825843 /nfs/dbraw/zinc/82/58/43/920825843.db2.gz ZTUGYEDRYPHCJP-UHFFFAOYSA-N 0 3 405.542 4.166 20 0 HIADHN CO[C@@H]1C[C@@H](c2ccccc2)CC[C@H]1NC(=O)N(CCN(C)C)Cc1ccc(C)o1 ZINC000512065300 920832415 /nfs/dbraw/zinc/83/24/15/920832415.db2.gz XFLSVLQHJJUBSI-MDNUFGMLSA-N 0 3 413.562 4.013 20 0 HIADHN OC[C@@H](CNCc1cscc1Br)Cc1ccccc1C(F)(F)F ZINC000512066156 920833888 /nfs/dbraw/zinc/83/38/88/920833888.db2.gz CRSFADMGSLTORP-LLVKDONJSA-N 0 3 408.283 4.470 20 0 HIADHN C[C@@H]1CN(C[C@@H]2CCCN2CC2=Cc3cc(Cl)cc(Cl)c3OC2)C[C@H](C)O1 ZINC000512072348 920838869 /nfs/dbraw/zinc/83/88/69/920838869.db2.gz NKFVKUPSQVOSDJ-KHYOSLBOSA-N 0 3 411.373 4.343 20 0 HIADHN CO[C@@H]1C[C@H](c2ccccc2)CC[C@H]1NC(=O)N(CCN(C)C)Cc1cccs1 ZINC000512098826 920859347 /nfs/dbraw/zinc/85/93/47/920859347.db2.gz SHJQSFAGZWLRAO-CEMLEFRQSA-N 0 3 415.603 4.173 20 0 HIADHN Cc1cc([C@H](C)NCc2ccc(NS(C)(=O)=O)cc2)sc1Br ZINC000512101274 920861558 /nfs/dbraw/zinc/86/15/58/920861558.db2.gz SMXYGDWAEJZTJF-NSHDSACASA-N 0 3 403.367 4.041 20 0 HIADHN COc1ccc([C@H](CNC(=O)NCC(C)(C)c2cccs2)N2CCCC2)cc1 ZINC000512118170 920871780 /nfs/dbraw/zinc/87/17/80/920871780.db2.gz GXVOKHMRVLOFGE-IBGZPJMESA-N 0 3 401.576 4.171 20 0 HIADHN Cc1noc(C)c1COc1cc2ccccc2cc1C(=O)N[C@@H](C)C1=CCN(C)CC1 ZINC000512121184 920872938 /nfs/dbraw/zinc/87/29/38/920872938.db2.gz DPOPMZVICWECBP-INIZCTEOSA-N 0 3 419.525 4.404 20 0 HIADHN CC(C)C[C@@H](Cc1cccc(Br)c1)C(=O)N[C@@H](C)C1=CCN(C)CC1 ZINC000512129100 920877937 /nfs/dbraw/zinc/87/79/37/920877937.db2.gz SYGUHOKKUVUSOC-LPHOPBHVSA-N 0 3 407.396 4.421 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N3CCC(Nc4ccc(F)cc4)CC3)cc2)CC1 ZINC000512133272 920879970 /nfs/dbraw/zinc/87/99/70/920879970.db2.gz ULHDFCGGNISYAX-UHFFFAOYSA-N 0 3 424.564 4.073 20 0 HIADHN C[C@H]1CC[C@H](c2ccccc2)N(CC(=O)N2CCC(C(=O)Nc3ccccc3)CC2)C1 ZINC000512154529 920895002 /nfs/dbraw/zinc/89/50/02/920895002.db2.gz YVHLZKIWNMWBAK-GBXCKJPGSA-N 0 3 419.569 4.337 20 0 HIADHN CN(CCc1nc(-c2ccccc2)no1)CCc1nc(-c2ccc(Cl)cc2)no1 ZINC000512181731 920922637 /nfs/dbraw/zinc/92/26/37/920922637.db2.gz PZZDZQUYVLBLQL-UHFFFAOYSA-N 0 3 409.877 4.157 20 0 HIADHN CN(C)Cc1ccc(C(=O)Nc2ccc(C(=O)NCc3ccc(F)cc3)cc2)cc1 ZINC000512185825 920928247 /nfs/dbraw/zinc/92/82/47/920928247.db2.gz QJSQVKIILZUATN-UHFFFAOYSA-N 0 3 405.473 4.070 20 0 HIADHN CC[C@@H](NC(=O)NCc1ccc(CN2CCN(C)CC2)cc1)c1ccc(Cl)s1 ZINC000512196032 920941290 /nfs/dbraw/zinc/94/12/90/920941290.db2.gz LNDPIEQZLHFQHK-GOSISDBHSA-N 0 3 421.010 4.099 20 0 HIADHN C[C@H](NC(=O)CN(C)[C@H]1CCc2ccccc2C1)c1ccc(Br)cc1 ZINC000512317903 921068147 /nfs/dbraw/zinc/06/81/47/921068147.db2.gz HBUWIJMPBWWXMH-YWZLYKJASA-N 0 3 401.348 4.116 20 0 HIADHN Fc1ccc(-c2nnc3n2C[C@H](NCc2ccc(Sc4ccccn4)o2)CC3)cc1 ZINC000512343784 921088928 /nfs/dbraw/zinc/08/89/28/921088928.db2.gz RVBHBKXBVGXJEC-QGZVFWFLSA-N 0 3 421.501 4.328 20 0 HIADHN O=C(NC1CCN(Cc2c[nH]nc2-c2ccc(Cl)cc2)CC1)C1CCCCC1 ZINC000512349903 921095774 /nfs/dbraw/zinc/09/57/74/921095774.db2.gz CNJGRULOLXCCMZ-UHFFFAOYSA-N 0 3 400.954 4.391 20 0 HIADHN Cc1cccc(-c2n[nH]cc2CN2CCC(C(=O)NCCc3cccs3)CC2)c1 ZINC000512354826 921100265 /nfs/dbraw/zinc/10/02/65/921100265.db2.gz LGWARQXTNNOQAG-UHFFFAOYSA-N 0 3 408.571 4.018 20 0 HIADHN CCOc1cc(CN2CC[C@@H](c3cccc(F)c3)C2)ccc1O[C@@H](C)C(=O)N(C)C ZINC000513460261 921824918 /nfs/dbraw/zinc/82/49/18/921824918.db2.gz DGDVAPCQNARUSQ-FXAWDEMLSA-N 0 3 414.521 4.069 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)NCc1ccc(NC(=O)c2ccco2)cc1)c1ccco1 ZINC000513502708 921852847 /nfs/dbraw/zinc/85/28/47/921852847.db2.gz DKFXDZHKOPNLIH-APWZRJJASA-N 0 3 424.501 4.054 20 0 HIADHN Cn1c2ccc(CN3CCC(c4ccc(Br)cc4)CC3)cc2oc1=O ZINC000513512785 921859132 /nfs/dbraw/zinc/85/91/32/921859132.db2.gz BMAVMSJSEXKZDD-UHFFFAOYSA-N 0 3 401.304 4.274 20 0 HIADHN CC(C)OCc1ccc(NC(=O)NCCCN2CCN(C)C[C@@H]2c2ccccc2)cc1 ZINC000513558323 921893015 /nfs/dbraw/zinc/89/30/15/921893015.db2.gz MLECJFAQORVJOC-XMMPIXPASA-N 0 3 424.589 4.112 20 0 HIADHN Clc1ccc(OCc2cccnc2)c(CNCCOc2ccc3c(c2)OCO3)c1 ZINC000513582058 921913935 /nfs/dbraw/zinc/91/39/35/921913935.db2.gz GWUXTXADFCSOLR-UHFFFAOYSA-N 0 3 412.873 4.211 20 0 HIADHN COc1ccc([C@@H](Cc2ccncc2)NCc2cc(OC)c(OC)c(OC)c2)cc1 ZINC000513666247 921989746 /nfs/dbraw/zinc/98/97/46/921989746.db2.gz KIADKLFSKDLWSC-OAQYLSRUSA-N 0 3 408.498 4.190 20 0 HIADHN CC[C@@H](NCc1cccc(NS(C)(=O)=O)c1)c1ccc(OC(F)(F)F)cc1 ZINC000513703525 922024812 /nfs/dbraw/zinc/02/48/12/922024812.db2.gz WWBDPLYFPKIUQF-QGZVFWFLSA-N 0 3 402.438 4.198 20 0 HIADHN CCOc1ccccc1NC(=O)[C@@H](C)N[C@H]1CCC[C@H]1Oc1cc(F)cc(F)c1 ZINC000513725543 922044248 /nfs/dbraw/zinc/04/42/48/922044248.db2.gz PHMLUIIRXWHZKZ-XWRIVVANSA-N 0 3 404.457 4.280 20 0 HIADHN COc1cc(Cl)c(C(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)cc1OC ZINC000513822703 922148090 /nfs/dbraw/zinc/14/80/90/922148090.db2.gz HQOZZLKTEHXQIR-LJQANCHMSA-N 0 3 402.922 4.233 20 0 HIADHN Cc1noc(C)c1[C@@H](C)CC(=O)N(CCN(C)C)Cc1ccc(Br)cc1 ZINC000513857409 922183976 /nfs/dbraw/zinc/18/39/76/922183976.db2.gz LHWRSXHIBPLHDI-AWEZNQCLSA-N 0 3 422.367 4.138 20 0 HIADHN Cc1ccc(CN[C@H]2CCc3c2cccc3Br)c(N2CCOCC2)c1 ZINC000513859655 922186107 /nfs/dbraw/zinc/18/61/07/922186107.db2.gz OECHEAUFXHIHAI-FQEVSTJZSA-N 0 3 401.348 4.371 20 0 HIADHN COc1c(Cl)cc(NC(=O)NCC2(N3CCSCC3)CCCC2)cc1Cl ZINC000513878867 922208900 /nfs/dbraw/zinc/20/89/00/922208900.db2.gz UYMHLEKPJCJPRG-UHFFFAOYSA-N 0 3 418.390 4.485 20 0 HIADHN Cc1ccccc1C1(CNC(=O)NC[C@H](c2ccccc2)N2CCCC2)CCOCC1 ZINC000513891520 922219346 /nfs/dbraw/zinc/21/93/46/922219346.db2.gz IFSUOFCINIYBRP-XMMPIXPASA-N 0 3 421.585 4.180 20 0 HIADHN O=C(NCCCCN1CCN(Cc2ccccc2)CC1)Nc1cccc(C(F)F)c1 ZINC000513908954 922230954 /nfs/dbraw/zinc/23/09/54/922230954.db2.gz GZMBHWBAXNXVRY-UHFFFAOYSA-N 0 3 416.516 4.344 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)NC[C@@H]1CCCO[C@@H]1c1ccccc1 ZINC000513911259 922233556 /nfs/dbraw/zinc/23/35/56/922233556.db2.gz MUBIGPKRWNWZLF-RBZQAINGSA-N 0 3 407.558 4.291 20 0 HIADHN O=S(=O)(NC1CCN(C(c2ccccc2)c2ccccc2)CC1)c1cccs1 ZINC000513967077 922285860 /nfs/dbraw/zinc/28/58/60/922285860.db2.gz DIRQSIQACOGUAT-UHFFFAOYSA-N 0 3 412.580 4.280 20 0 HIADHN COc1ccc(CCCC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)c(OC)c1 ZINC000514007272 922332374 /nfs/dbraw/zinc/33/23/74/922332374.db2.gz DOTZEDBMWUIVNF-HXUWFJFHSA-N 0 3 410.558 4.150 20 0 HIADHN CCC[C@H](Cc1ccccc1)N(CCC)Cc1cnn([C@]2(C)CCS(=O)(=O)C2)c1 ZINC000514087029 922410593 /nfs/dbraw/zinc/41/05/93/922410593.db2.gz FLQSUMWXYDHBHR-DHIUTWEWSA-N 0 3 417.619 4.040 20 0 HIADHN CCC[C@@H](Cc1ccccc1)N(CCC)Cc1cnn([C@]2(C)CCS(=O)(=O)C2)c1 ZINC000514087034 922410942 /nfs/dbraw/zinc/41/09/42/922410942.db2.gz FLQSUMWXYDHBHR-XZOQPEGZSA-N 0 3 417.619 4.040 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N[C@@H](C)c2ccc(NC(=O)C3CC3)cc2)N(C)C)cc1 ZINC000514101358 922428492 /nfs/dbraw/zinc/42/84/92/922428492.db2.gz DXWQRHURVYLLJM-HTAPYJJXSA-N 0 3 408.546 4.007 20 0 HIADHN COc1ccc([C@@H](C)N[C@@H](C)c2ccc(OCC(=O)NC3CC3)cc2)c(C)c1OC ZINC000514105977 922435700 /nfs/dbraw/zinc/43/57/00/922435700.db2.gz VGDRMNOTQQBRBK-DLBZAZTESA-N 0 3 412.530 4.081 20 0 HIADHN CCCC(=O)Nc1ccc(CNC(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)cc1 ZINC000514116157 922448073 /nfs/dbraw/zinc/44/80/73/922448073.db2.gz YELWBLPRHUTCRL-HSZRJFAPSA-N 0 3 422.573 4.370 20 0 HIADHN CC[C@@H](NC(=O)N[C@H]1CCN(Cc2ccccc2)C1)c1nc(-c2ccccc2)c[nH]1 ZINC000514148632 922484025 /nfs/dbraw/zinc/48/40/25/922484025.db2.gz GQEYEHOJDDXEFJ-LEWJYISDSA-N 0 3 403.530 4.102 20 0 HIADHN COc1cccc([C@H](CNC(=O)N[C@H]2CCCOc3ccccc32)N2CCCC2)c1 ZINC000514173095 922511364 /nfs/dbraw/zinc/51/13/64/922511364.db2.gz UHCDSHJHSPYOBP-VXKWHMMOSA-N 0 3 409.530 4.045 20 0 HIADHN CN(C)[C@H](CNC(=O)N[C@@H]1CCCc2cc(OC(F)F)ccc21)Cc1ccccc1 ZINC000514176711 922515038 /nfs/dbraw/zinc/51/50/38/922515038.db2.gz UTBICHGLNMZLSJ-GHTZIAJQSA-N 0 3 417.500 4.138 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1cccc(C(N)=O)c1)c1ccc(C(F)(F)F)cc1 ZINC000514189430 922529339 /nfs/dbraw/zinc/52/93/39/922529339.db2.gz HSMULKLQZNKQRZ-SFHVURJKSA-N 0 3 422.451 4.009 20 0 HIADHN O=C(CCNCc1ccc(-c2cccc(C(F)(F)F)c2)o1)NCc1cccnc1 ZINC000514226628 922562989 /nfs/dbraw/zinc/56/29/89/922562989.db2.gz KPPKXUBWGLIVPD-UHFFFAOYSA-N 0 3 403.404 4.157 20 0 HIADHN CC(C)[C@H](NC(=O)NC[C@H](c1ccccc1)N1CCCC1)c1ccc2c(c1)OCCO2 ZINC000514442596 922628978 /nfs/dbraw/zinc/62/89/78/922628978.db2.gz CZWAFSXGABMDMR-QPPBQGQZSA-N 0 3 423.557 4.291 20 0 HIADHN C[C@H](c1ccc(F)cc1)N1CCC[C@H](NCc2ccc(OCC(F)F)cc2)C1=O ZINC000514680756 922751202 /nfs/dbraw/zinc/75/12/02/922751202.db2.gz KSZWAHCGDFOIPN-QRWLVFNGSA-N 0 3 406.448 4.311 20 0 HIADHN Cc1cc(C(C)(C)NCC(=O)N2CCc3sccc3C2)ccc1Br ZINC000514760910 922788766 /nfs/dbraw/zinc/78/87/66/922788766.db2.gz ZNXUAGLGVPCTBF-UHFFFAOYSA-N 0 3 407.377 4.229 20 0 HIADHN COc1ccc([C@H](Cc2ccccc2)NCc2ccc3c(c2)CCS3(=O)=O)cc1 ZINC000514761199 922790569 /nfs/dbraw/zinc/79/05/69/922790569.db2.gz IFLPBJNMTUKAAY-QHCPKHFHSA-N 0 3 407.535 4.099 20 0 HIADHN C[C@H]1[C@@H](NC(=O)Cc2csc(-c3cccc(F)c3)n2)CCN1Cc1ccccc1 ZINC000514810518 922809327 /nfs/dbraw/zinc/80/93/27/922809327.db2.gz QAITUDTYHGKXJJ-KKSFZXQISA-N 0 3 409.530 4.271 20 0 HIADHN C[C@@H](Cn1cc(Br)cn1)N[C@@H](C)c1ccc(Br)cc1F ZINC000514821288 922815384 /nfs/dbraw/zinc/81/53/84/922815384.db2.gz XJMKHWNIGYROCI-UWVGGRQHSA-N 0 3 405.109 4.287 20 0 HIADHN CN(Cc1ccc(OC(F)F)cc1)C[C@@H](O)COc1cc(Cl)ccc1Cl ZINC000514855703 922825119 /nfs/dbraw/zinc/82/51/19/922825119.db2.gz GVJUMEHAVTURBO-CQSZACIVSA-N 0 3 406.256 4.467 20 0 HIADHN COc1ccc(C[C@@](C)(O)CN[C@@H](C)c2sccc2Br)cc1OC ZINC000514892750 922835412 /nfs/dbraw/zinc/83/54/12/922835412.db2.gz AVEIZRAUYIQQIE-KPZWWZAWSA-N 0 3 414.365 4.172 20 0 HIADHN CC(C)[C@@H]([NH2+]CC(Cc1ccccc1)Cc1ccccc1)c1nc(-c2nc[n-]n2)no1 ZINC000514976970 922864343 /nfs/dbraw/zinc/86/43/43/922864343.db2.gz HNGSRMHQJOJCDW-OAQYLSRUSA-N 0 3 416.529 4.243 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)CCc1nc(-c2ccc(Cl)cc2)no1 ZINC000515030342 922886089 /nfs/dbraw/zinc/88/60/89/922886089.db2.gz DNOQQSQDMIBAFQ-UHFFFAOYSA-N 0 3 414.893 4.032 20 0 HIADHN O=C(CCOc1cccc(Br)c1)NC[C@@H](c1cccs1)N1CCCC1 ZINC000515081635 922896988 /nfs/dbraw/zinc/89/69/88/922896988.db2.gz LJSNBJKSWSBDNC-KRWDZBQOSA-N 0 3 423.376 4.233 20 0 HIADHN COc1ccc(NC(=O)NC[C@H](c2ccccc2)N(C)C)cc1OCC(F)(F)F ZINC000515118829 922930929 /nfs/dbraw/zinc/93/09/29/922930929.db2.gz GEADMBINNXDKON-MRXNPFEDSA-N 0 3 411.424 4.061 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Cc1ccc(-n2nc(C)cc2C)cc1)c1ccsc1 ZINC000515133743 922943625 /nfs/dbraw/zinc/94/36/25/922943625.db2.gz RKSOPFXLQNZODH-QFIPXVFZSA-N 0 3 410.587 4.292 20 0 HIADHN COC(=O)c1cc2cc(NC(=O)NC[C@@H](c3ccccc3)N3CCCC3)ccc2o1 ZINC000515136900 922946143 /nfs/dbraw/zinc/94/61/43/922946143.db2.gz UWSRYYHLUDSECQ-IBGZPJMESA-N 0 3 407.470 4.178 20 0 HIADHN Cc1cc(I)ccc1NC(=O)NC[C@@H](c1ccccc1)N(C)C ZINC000515227032 923003265 /nfs/dbraw/zinc/00/32/65/923003265.db2.gz SGZVJVLJQBQXLP-KRWDZBQOSA-N 0 3 423.298 4.024 20 0 HIADHN CCn1c2ccccc2c2cc(NC(=O)C(=O)NC[C@@H](C)N3CCCC[C@H]3C)ccc21 ZINC000515278514 923030585 /nfs/dbraw/zinc/03/05/85/923030585.db2.gz LBOBMDFXYZBNDO-QZTJIDSGSA-N 0 3 420.557 4.132 20 0 HIADHN Cc1noc(-c2ccc(C)c(NC(=O)NC[C@@H](c3ccccc3)N3CCCC3)c2)n1 ZINC000515467433 923119963 /nfs/dbraw/zinc/11/99/63/923119963.db2.gz KYLUNDWJYMVQBI-NRFANRHFSA-N 0 3 405.502 4.312 20 0 HIADHN Cc1onc(-c2ccccc2)c1-c1nnc(CN2CCN(CCC(C)(C)C)CC2)o1 ZINC000515509080 923142823 /nfs/dbraw/zinc/14/28/23/923142823.db2.gz SHYMWSVIXYMSSO-UHFFFAOYSA-N 0 3 409.534 4.254 20 0 HIADHN COCCCN(C(=O)[C@H](C)Oc1ccc(Cl)c2ccccc12)C1CCN(C)CC1 ZINC000515567297 923185017 /nfs/dbraw/zinc/18/50/17/923185017.db2.gz VWVJFRKZULWYSL-KRWDZBQOSA-N 0 3 418.965 4.220 20 0 HIADHN Cc1cnc(C2CCN(C(=O)[C@H]3CN(Cc4ccccc4)CCC3(F)F)CC2)s1 ZINC000515683652 923268209 /nfs/dbraw/zinc/26/82/09/923268209.db2.gz QOZFKDFMDLOLJG-LJQANCHMSA-N 0 3 419.541 4.315 20 0 HIADHN O=C(NCc1cc(F)ccc1Br)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000515778462 923345058 /nfs/dbraw/zinc/34/50/58/923345058.db2.gz NPTNLYZNWYVTHQ-IBGZPJMESA-N 0 3 420.326 4.225 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)N(C)Cc2ccccc2N2CCCC2)N(C)C)cc1 ZINC000515841353 923387471 /nfs/dbraw/zinc/38/74/71/923387471.db2.gz RFZUFVGBYAGPKQ-XMMPIXPASA-N 0 3 408.590 4.294 20 0 HIADHN COc1cc([C@@H](C)NC(=O)NCCN2CCCCC2)ccc1OCc1ccccc1 ZINC000515910865 923428238 /nfs/dbraw/zinc/42/82/38/923428238.db2.gz ITNLNENBVAONAK-LJQANCHMSA-N 0 3 411.546 4.120 20 0 HIADHN CN(C)Cc1cccc(NC(=O)C(=O)N[C@@H](CCc2ccccc2)c2ccccc2)c1 ZINC000516046971 923519778 /nfs/dbraw/zinc/51/97/78/923519778.db2.gz WOCOWJVFBGWPKV-DEOSSOPVSA-N 0 3 415.537 4.177 20 0 HIADHN CC1CCN([C@H](CNC(=O)N2CCO[C@H](c3ccccc3)C2)c2ccccc2)CC1 ZINC000516149214 923576295 /nfs/dbraw/zinc/57/62/95/923576295.db2.gz LJZAPHZXULTIRB-RPWUZVMVSA-N 0 3 407.558 4.243 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2ccc(Oc3cccnc3)cc2)c1 ZINC000516171780 923587946 /nfs/dbraw/zinc/58/79/46/923587946.db2.gz YYKPZMUEPOLVBJ-UHFFFAOYSA-N 0 3 420.513 4.478 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)c2cc(Cl)c3c(c2)OCCCO3)C1 ZINC000516204882 923597954 /nfs/dbraw/zinc/59/79/54/923597954.db2.gz JYQRCZKYDQLDSH-QAPCUYQASA-N 0 3 400.906 4.067 20 0 HIADHN O=C(Nc1ccc(Cl)cc1OCC(F)F)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000516231208 923619293 /nfs/dbraw/zinc/61/92/93/923619293.db2.gz OUEJOOIEUQRHBC-OAHLLOKOSA-N 0 3 409.864 4.230 20 0 HIADHN Cc1cc(NC(=O)N[C@@H]2CCN(Cc3ccccc3)[C@@H]2C)ccc1OC1CCOCC1 ZINC000516341442 923677016 /nfs/dbraw/zinc/67/70/16/923677016.db2.gz XYJZBISNCPQJCU-AUSIDOKSSA-N 0 3 423.557 4.337 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3ccc(-c4ccccn4)cc3)CC2)C[C@H](C)O1 ZINC000516354233 923684481 /nfs/dbraw/zinc/68/44/81/923684481.db2.gz IXIBNNHWUVBARB-BGYRXZFFSA-N 0 3 422.573 4.492 20 0 HIADHN CC(=O)Nc1ccc(S[C@@H](C)C(=O)N[C@H](CN2CCCC2)c2ccccc2)cc1 ZINC000516391967 923706793 /nfs/dbraw/zinc/70/67/93/923706793.db2.gz XYOFHADGCUITDP-HTAPYJJXSA-N 0 3 411.571 4.079 20 0 HIADHN O=C(NCc1cc(F)cc(Br)c1)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000516556401 923793901 /nfs/dbraw/zinc/79/39/01/923793901.db2.gz CXKAZWGNEXVUIZ-LJQANCHMSA-N 0 3 420.326 4.052 20 0 HIADHN CC[C@H](CNC(=O)NC[C@H]1CCCO[C@H]1c1ccccc1)N1CCc2ccccc2C1 ZINC000516716825 923861151 /nfs/dbraw/zinc/86/11/51/923861151.db2.gz IXHJQIQBLQRUDO-GPXOXTDOSA-N 0 3 421.585 4.290 20 0 HIADHN CN(C)[C@@H](CNC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1)c1ccccc1Cl ZINC000516767640 923881773 /nfs/dbraw/zinc/88/17/73/923881773.db2.gz XZSNSNPNKCFFLR-AVRDEDQJSA-N 0 3 417.956 4.110 20 0 HIADHN COc1ccc(Cn2nc(C)c(CNCc3ccccc3Cn3ccnc3)c2C)cc1 ZINC000516893787 923929768 /nfs/dbraw/zinc/92/97/68/923929768.db2.gz CFGZTHUMWSFAKO-UHFFFAOYSA-N 0 3 415.541 4.091 20 0 HIADHN CC(C)(C(=O)NC[C@@H]1CCCCN1C1CC1)c1csc(-c2cc(F)ccc2F)n1 ZINC000517062298 923983216 /nfs/dbraw/zinc/98/32/16/923983216.db2.gz ONVSGFBWDXMCMT-INIZCTEOSA-N 0 3 419.541 4.499 20 0 HIADHN Cc1sc2nc(CNC3(Cc4ccc(F)cc4)CCOCC3)[nH]c(=O)c2c1C ZINC000517095453 923994006 /nfs/dbraw/zinc/99/40/06/923994006.db2.gz NBMXNMKUVYWRFI-UHFFFAOYSA-N 0 3 401.507 4.034 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)N1CCn2cccc2[C@@H]1c1ccccc1 ZINC000517111890 924004058 /nfs/dbraw/zinc/00/40/58/924004058.db2.gz WFOWCCRTMPZMNI-RPBOFIJWSA-N 0 3 414.553 4.440 20 0 HIADHN CC[C@@H]1CN(c2nnc(C(C)C)n2C[C@@H]2CCCCO2)CCN1Cc1ccccc1 ZINC000517248893 924060190 /nfs/dbraw/zinc/06/01/90/924060190.db2.gz GWUWTDUKOOQVAZ-YADHBBJMSA-N 0 3 411.594 4.071 20 0 HIADHN Cc1cc(NC(=O)NCC(C)(C)N2CCc3ccccc3C2)ccc1C(=O)NC(C)C ZINC000517502844 924232558 /nfs/dbraw/zinc/23/25/58/924232558.db2.gz ASQPOFCHEXXLGV-UHFFFAOYSA-N 0 3 422.573 4.092 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NC1CCN(c2ccccc2)CC1)c1cccc(OC)c1 ZINC000517540546 924253288 /nfs/dbraw/zinc/25/32/88/924253288.db2.gz DBHFPJFAMJHLQA-XMMPIXPASA-N 0 3 424.589 4.046 20 0 HIADHN CCN(Cc1ccc(OC)c(OC)c1)C(=O)N[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000517541798 924255750 /nfs/dbraw/zinc/25/57/50/924255750.db2.gz XNHHAGOIGONCLS-NQIIRXRSSA-N 0 3 411.546 4.071 20 0 HIADHN CCN1CCCN(C(=O)c2cn(-c3ccccc3)nc2-c2ccc(C)cc2C)CC1 ZINC000517642446 926748555 /nfs/dbraw/zinc/74/85/55/926748555.db2.gz AGATXSXFQCWTRB-UHFFFAOYSA-N 0 3 402.542 4.324 20 0 HIADHN Cc1c(C(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)cnn1-c1ccc(F)cc1F ZINC000517649584 926758066 /nfs/dbraw/zinc/75/80/66/926758066.db2.gz IYIQRIGQEAJYGW-BEFAXECRSA-N 0 3 410.468 4.024 20 0 HIADHN Fc1ccc(-n2cc(CN[C@H]3CCN(c4ccccc4Br)C3)cn2)cc1 ZINC000517709850 926807910 /nfs/dbraw/zinc/80/79/10/926807910.db2.gz VTURMBRHHONFOZ-KRWDZBQOSA-N 0 3 415.310 4.142 20 0 HIADHN C[C@H](CN1CCC[C@H](C)C1)NC(=O)C(=O)Nc1ccccc1Sc1ccccc1 ZINC000517816301 926849952 /nfs/dbraw/zinc/84/99/52/926849952.db2.gz WNZNMQPUVLCNKN-ZWKOTPCHSA-N 0 3 411.571 4.013 20 0 HIADHN CC(C)CN(CCN(C)C)C(=O)c1ccc(Cl)c(NC(=O)c2cccs2)c1 ZINC000517874022 926871417 /nfs/dbraw/zinc/87/14/17/926871417.db2.gz KXGVCHWROZVMRO-UHFFFAOYSA-N 0 3 407.967 4.314 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccc(F)c2)C1)N1CCC[C@H]1c1ccc2c(c1)OCCO2 ZINC000517889125 926876644 /nfs/dbraw/zinc/87/66/44/926876644.db2.gz SGNKWKUASBYIHQ-IRLDBZIGSA-N 0 3 424.516 4.173 20 0 HIADHN COCc1cccc2sc(NC(=O)N[C@H](CN3CCCC3)c3ccccc3)nc21 ZINC000517905512 926884503 /nfs/dbraw/zinc/88/45/03/926884503.db2.gz HFGUDMKXSGULMO-GOSISDBHSA-N 0 3 410.543 4.401 20 0 HIADHN Cc1ccc([C@H]2CCCN2C(=O)NCc2ccc(CN3CCN(C)CC3)cc2)cc1C ZINC000517970782 926915619 /nfs/dbraw/zinc/91/56/19/926915619.db2.gz JWXBATPAMHNTGM-RUZDIDTESA-N 0 3 420.601 4.098 20 0 HIADHN O=C(CCCc1nc(-c2cccs2)no1)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000518125773 927034307 /nfs/dbraw/zinc/03/43/07/927034307.db2.gz JGOFZZAACOSXPR-SFHVURJKSA-N 0 3 410.543 4.074 20 0 HIADHN CC(C)N1CC[C@@H](NCc2cc(F)cc3c2OCOC3)[C@@H]1c1ccc(F)c(F)c1 ZINC000518221986 927087135 /nfs/dbraw/zinc/08/71/35/927087135.db2.gz LAXMCTFBYQEBSD-RTWAWAEBSA-N 0 3 406.448 4.284 20 0 HIADHN Cc1cnc(-c2cccc(NC(=O)c3ccc(N4CCN(C(C)C)CC4)cc3)c2)o1 ZINC000518244811 927104599 /nfs/dbraw/zinc/10/45/99/927104599.db2.gz FQNHEPMNEAKNJO-UHFFFAOYSA-N 0 3 404.514 4.433 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)c1cc(-c2cccc(F)c2)no1 ZINC000518298950 927158758 /nfs/dbraw/zinc/15/87/58/927158758.db2.gz WTFKCVGADCQYBW-FQEVSTJZSA-N 0 3 408.477 4.002 20 0 HIADHN CCN(C(=O)c1nc(SC)ncc1Cl)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000518339964 927204581 /nfs/dbraw/zinc/20/45/81/927204581.db2.gz MKLQUTSWGBWXBW-GDBMZVCRSA-N 0 3 404.967 4.150 20 0 HIADHN C[C@H](CNC(=O)Cc1csc2nc(-c3ccccc3)cn12)N(C)Cc1ccccc1 ZINC000518378399 927229787 /nfs/dbraw/zinc/22/97/87/927229787.db2.gz ZDGKPMSVICRYQB-GOSISDBHSA-N 0 3 418.566 4.242 20 0 HIADHN CCN1CCCN(C(=O)Cc2cn(-c3ccccc3)nc2-c2ccc(Cl)cc2)CC1 ZINC000518415836 927255025 /nfs/dbraw/zinc/25/50/25/927255025.db2.gz GJBALIHKUNGOAD-UHFFFAOYSA-N 0 3 422.960 4.289 20 0 HIADHN Cc1ccc(-c2nn(-c3ccc(F)cc3)cc2C(=O)N(C)[C@@H]2CCN(C3CC3)C2)cc1 ZINC000518428711 927264550 /nfs/dbraw/zinc/26/45/50/927264550.db2.gz VWRXVTWHPLIRTO-JOCHJYFZSA-N 0 3 418.516 4.296 20 0 HIADHN Cc1ccc(-n2ncc(C(=O)N3CC[C@H](N4CCCCC4)C3)c2C2CC2)cc1Cl ZINC000518616023 927380595 /nfs/dbraw/zinc/38/05/95/927380595.db2.gz GWMSEZWLBJFCBO-IBGZPJMESA-N 0 3 412.965 4.412 20 0 HIADHN COc1cc(Br)c(CN[C@@H]2CCN([C@@H](C)c3ccccc3)C2)cc1OC ZINC000518774657 927486757 /nfs/dbraw/zinc/48/67/57/927486757.db2.gz ZFQITGPBUXPGDZ-MAUKXSAKSA-N 0 3 419.363 4.391 20 0 HIADHN OCCOc1ccc(CNCc2cn(-c3ccccc3)nc2-c2ccc(F)cc2)cc1 ZINC000518774582 927486770 /nfs/dbraw/zinc/48/67/70/927486770.db2.gz SHIAWWLYYDIUCV-UHFFFAOYSA-N 0 3 417.484 4.339 20 0 HIADHN COC(=O)c1cc(C)nc(NC[C@@H]2CCCN(C)[C@H]2c2ccc(C(F)(F)F)cc2)n1 ZINC000518809212 927505957 /nfs/dbraw/zinc/50/59/57/927505957.db2.gz JKQDEECJCQFOCK-YJBOKZPZSA-N 0 3 422.451 4.085 20 0 HIADHN CC1CCN([C@@H](CNC(=O)NCCCNc2ccccc2)c2cccs2)CC1 ZINC000518811429 927508494 /nfs/dbraw/zinc/50/84/94/927508494.db2.gz UDQKPWUYVHKDEQ-FQEVSTJZSA-N 0 3 400.592 4.323 20 0 HIADHN CCCCOc1ccccc1NC(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000518838989 927540955 /nfs/dbraw/zinc/54/09/55/927540955.db2.gz ZVVNYDZLSDLJCF-RTBURBONSA-N 0 3 403.567 4.219 20 0 HIADHN COCCN1CCC[C@H]1CNC(=O)Nc1ccc(Sc2nc(C)cs2)cc1C ZINC000518912879 927621888 /nfs/dbraw/zinc/62/18/88/927621888.db2.gz HUTQOEJIPYNSBH-INIZCTEOSA-N 0 3 420.604 4.143 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)c1ccc2[nH]c(C(F)F)nc2c1 ZINC000518925889 927633104 /nfs/dbraw/zinc/63/31/04/927633104.db2.gz MKNQDABOSCEYNU-UHFFFAOYSA-N 0 3 406.864 4.358 20 0 HIADHN COc1ccc(-c2nsc(NC(=O)NC[C@H](c3ccccc3)N3CCCC3)n2)cc1 ZINC000519035162 927710807 /nfs/dbraw/zinc/71/08/07/927710807.db2.gz MXEKFJUJNRVEDG-LJQANCHMSA-N 0 3 423.542 4.172 20 0 HIADHN Cc1ccc(Oc2ccc(NC(=O)C(=O)NC[C@H](C)N3CCCC[C@@H]3C)cc2)cc1 ZINC000519048747 927724867 /nfs/dbraw/zinc/72/48/67/927724867.db2.gz ALHFBKWRHINJHK-OALUTQOASA-N 0 3 409.530 4.105 20 0 HIADHN Cc1ccc(Oc2ccc(NC(=O)C(=O)NC[C@@H](C)N3CCCC[C@H]3C)cc2)cc1 ZINC000519048748 927725843 /nfs/dbraw/zinc/72/58/43/927725843.db2.gz ALHFBKWRHINJHK-RTBURBONSA-N 0 3 409.530 4.105 20 0 HIADHN C[C@@H](NC(=O)CN1CCN(CCC(C)(C)C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000519068544 927746277 /nfs/dbraw/zinc/74/62/77/927746277.db2.gz GISNFZJAJZVYER-OAHLLOKOSA-N 0 3 400.394 4.224 20 0 HIADHN CC(C)n1ncc2c1nc(C1CC1)cc2C(=O)N(CCN(C)C)CC1CCCCC1 ZINC000519108461 927775709 /nfs/dbraw/zinc/77/57/09/927775709.db2.gz ITJXSBDZLQEEIY-UHFFFAOYSA-N 0 3 411.594 4.474 20 0 HIADHN CCN(CC)C(=O)c1ccc(C(=O)NC[C@@H](c2ccccc2)N2CCC(C)CC2)cc1 ZINC000519107700 927775962 /nfs/dbraw/zinc/77/59/62/927775962.db2.gz DURHTTSUJZPKPP-DEOSSOPVSA-N 0 3 421.585 4.372 20 0 HIADHN CN(C)CCN(CC1CCCCC1)C(=O)c1cnc(Cc2ccc(F)cc2)s1 ZINC000519107927 927776370 /nfs/dbraw/zinc/77/63/70/927776370.db2.gz NNYADVQHKHMRRT-UHFFFAOYSA-N 0 3 403.567 4.457 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)Cc2coc(-c3ccc(Cl)cc3)n2)C1 ZINC000519107819 927777259 /nfs/dbraw/zinc/77/72/59/927777259.db2.gz IKDQXFBAEBTTLL-OXJNMPFZSA-N 0 3 409.917 4.489 20 0 HIADHN CC(C)[C@@H](C(=O)Nc1ccc(CC(=O)Nc2ccccc2F)cc1)N1CCCCC1 ZINC000519142475 927802789 /nfs/dbraw/zinc/80/27/89/927802789.db2.gz REWJNVHPSULTCA-QHCPKHFHSA-N 0 3 411.521 4.456 20 0 HIADHN CC(C)N(C)C(=O)c1ccc(Cl)c(NC(=O)NC[C@@H](c2ccccc2)N(C)C)c1 ZINC000519192719 927819871 /nfs/dbraw/zinc/81/98/71/927819871.db2.gz NCVQQZUAJHFDDA-FQEVSTJZSA-N 0 3 416.953 4.245 20 0 HIADHN CCOc1cc2c(cc1NC(=O)NC[C@@H](c1ccccc1)N1CCCC1)O[C@H](C)C2 ZINC000519241404 927843632 /nfs/dbraw/zinc/84/36/32/927843632.db2.gz HLYJCTAGHDWAME-UTKZUKDTSA-N 0 3 409.530 4.367 20 0 HIADHN C[C@H](NC(=O)N1CCN(CC2CCCCC2)CC1)c1nc2ccccc2n1C(F)F ZINC000519260282 927852158 /nfs/dbraw/zinc/85/21/58/927852158.db2.gz ZHCDUBIVZNAOFE-INIZCTEOSA-N 0 3 419.520 4.400 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N(C)Cc2ccccc2Br)N(C)C)cc1 ZINC000519295011 927867350 /nfs/dbraw/zinc/86/73/50/927867350.db2.gz AMEFNLMBAVDLGG-LJQANCHMSA-N 0 3 404.352 4.202 20 0 HIADHN CCOc1cccc2cc([C@@H](C)N[C@H]3CCCc4cc(S(N)(=O)=O)ccc43)oc21 ZINC000519306073 927873409 /nfs/dbraw/zinc/87/34/09/927873409.db2.gz YFJAPNHASZERFJ-KUHUBIRLSA-N 0 3 414.527 4.207 20 0 HIADHN COc1ccc([C@H](CNC(=O)NCCc2ccccc2Cl)N2CCCC2)cc1 ZINC000519342955 927890016 /nfs/dbraw/zinc/89/00/16/927890016.db2.gz QJDCKALBWIBGRQ-NRFANRHFSA-N 0 3 401.938 4.027 20 0 HIADHN CC[C@H](NC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1)c1ccc2c(c1)OCCO2 ZINC000519440118 927948618 /nfs/dbraw/zinc/94/86/18/927948618.db2.gz JKEIPABPRKHTKS-CTNGQTDRSA-N 0 3 412.505 4.076 20 0 HIADHN COc1cc(CN(Cc2ccccc2)[C@@H](C)CN2CCOCC2)ccc1OC(F)F ZINC000519442649 927951420 /nfs/dbraw/zinc/95/14/20/927951420.db2.gz SVMXJHJLAKMUNB-SFHVURJKSA-N 0 3 420.500 4.020 20 0 HIADHN Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)N[C@H]1CCN(Cc2ccccc2)[C@@H]1C ZINC000519468521 927969515 /nfs/dbraw/zinc/96/95/15/927969515.db2.gz NZEMIJFDSUGNNG-XXBNENTESA-N 0 3 422.573 4.165 20 0 HIADHN COCc1ccccc1CNC(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1 ZINC000519507289 928000254 /nfs/dbraw/zinc/00/02/54/928000254.db2.gz XSFBBRVUUZJMIM-UHFFFAOYSA-N 0 3 423.479 4.125 20 0 HIADHN COc1ccc(CN2CC[C@@H](NC/C(C)=C\c3ccccc3OC(F)F)C2=O)cc1 ZINC000519673916 928046342 /nfs/dbraw/zinc/04/63/42/928046342.db2.gz QUSZVBBAIIXWQT-QTXHJTIISA-N 0 3 416.468 4.091 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)Nc1nc(-c2ccc(OC)cc2)ns1)c1ccco1 ZINC000519717450 928055337 /nfs/dbraw/zinc/05/53/37/928055337.db2.gz AURGPGYBFQLVBB-CJNGLKHVSA-N 0 3 415.519 4.058 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1nc(-c2ccc(OC)cc2)ns1)c1ccco1 ZINC000519717449 928055461 /nfs/dbraw/zinc/05/54/61/928055461.db2.gz AURGPGYBFQLVBB-BBRMVZONSA-N 0 3 415.519 4.058 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)N1CC[C@@H](n2cc(Cl)cn2)C1)c1ccc(Cl)cc1 ZINC000519758265 928068218 /nfs/dbraw/zinc/06/82/18/928068218.db2.gz YYGCHEDSIBFDFA-MOPGFXCFSA-N 0 3 424.376 4.229 20 0 HIADHN C[C@H](Oc1ccc(Cl)cc1)c1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1 ZINC000519853871 928097935 /nfs/dbraw/zinc/09/79/35/928097935.db2.gz XCLKIBVFOZGKIR-HNNXBMFYSA-N 0 3 413.909 4.067 20 0 HIADHN CC(C)CN(CC(=O)N1CCC(C(=O)Nc2ccccc2)CC1)Cc1ccccc1 ZINC000519904415 928139456 /nfs/dbraw/zinc/13/94/56/928139456.db2.gz JRZHPDWHHCBHDX-UHFFFAOYSA-N 0 3 407.558 4.022 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)Nc1cccc(OC[C@H]2CCCO2)c1 ZINC000519971950 928198619 /nfs/dbraw/zinc/19/86/19/928198619.db2.gz ITLIJLFLDRPNIK-DHIUTWEWSA-N 0 3 409.530 4.203 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)Nc1cccc(OC[C@@H]2CCCO2)c1 ZINC000519971951 928199245 /nfs/dbraw/zinc/19/92/45/928199245.db2.gz ITLIJLFLDRPNIK-GOTSBHOMSA-N 0 3 409.530 4.203 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)NCc1ccc(Br)cc1Cl ZINC000520047048 928271689 /nfs/dbraw/zinc/27/16/89/928271689.db2.gz BSOGAQQBVAKPQL-UHFFFAOYSA-N 0 3 424.770 4.376 20 0 HIADHN CCOc1ccc(NC(=O)NC[C@@H](c2ccc(OC)cc2)N2CCCC2)cc1OC ZINC000520050601 928276092 /nfs/dbraw/zinc/27/60/92/928276092.db2.gz RDXITMJKHHUBKB-FQEVSTJZSA-N 0 3 413.518 4.061 20 0 HIADHN CCC(C)(C)NC(=O)c1ccc(NC(=O)NC[C@H](c2ccc(C)cc2)N(C)C)cc1 ZINC000520053660 928279388 /nfs/dbraw/zinc/27/93/88/928279388.db2.gz ROAKGSGNIKPENA-OAQYLSRUSA-N 0 3 410.562 4.338 20 0 HIADHN O=C(Nc1ccccc1C(=O)N1CCCCC1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000520094002 928306722 /nfs/dbraw/zinc/30/67/22/928306722.db2.gz WBEKEJBVHGRBQM-HXUWFJFHSA-N 0 3 423.532 4.303 20 0 HIADHN CN1CCN([C@@H](CNCc2csc(-c3ccsc3)n2)c2cccs2)CC1 ZINC000520190165 928376446 /nfs/dbraw/zinc/37/64/46/928376446.db2.gz KXCHIYXVNZVVSZ-KRWDZBQOSA-N 0 3 404.630 4.011 20 0 HIADHN c1ccc(-c2ccc(NCCNCc3ccccc3OCc3cccnc3)nn2)cc1 ZINC000520220114 928396581 /nfs/dbraw/zinc/39/65/81/928396581.db2.gz XSJAPXUHVSPTPD-UHFFFAOYSA-N 0 3 411.509 4.319 20 0 HIADHN C[C@@H]1C[C@H]1c1ccc(CN(C(=O)CCCN2CCN(c3ccccc3)CC2)C2CC2)o1 ZINC000520306033 928466259 /nfs/dbraw/zinc/46/62/59/928466259.db2.gz LOAQTLFGJUAFMF-HYBUGGRVSA-N 0 3 421.585 4.496 20 0 HIADHN Cc1cccc(-c2nn(-c3ccc(F)cc3)cc2C(=O)N(C)[C@@H]2CCN(C3CC3)C2)c1 ZINC000520318672 928480534 /nfs/dbraw/zinc/48/05/34/928480534.db2.gz AVIOGDKPXYHPDV-JOCHJYFZSA-N 0 3 418.516 4.296 20 0 HIADHN C[C@@H](C(=O)NCCc1cccc2cccnc21)N1CCC(Cc2ccccc2)CC1 ZINC000520332540 928496246 /nfs/dbraw/zinc/49/62/46/928496246.db2.gz JYLXJHQOEPPJSP-FQEVSTJZSA-N 0 3 401.554 4.237 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)c1cncc(-c2ccc(N(C)C)cc2)c1)c1ccco1 ZINC000520448625 928570653 /nfs/dbraw/zinc/57/06/53/928570653.db2.gz MOXXEKOJEYNLDJ-JTSKRJEESA-N 0 3 406.530 4.267 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)C(=O)Nc1ccc(C)cc1)c1ccc(C(F)(F)F)cc1 ZINC000520484612 928594213 /nfs/dbraw/zinc/59/42/13/928594213.db2.gz WYWDBGQQUXERIU-IBGZPJMESA-N 0 3 421.463 4.152 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCc3nc(C(C)(C)C)cs3)c(C)c2)CC1 ZINC000520590737 928657986 /nfs/dbraw/zinc/65/79/86/928657986.db2.gz XAASGQRLFJYESH-UHFFFAOYSA-N 0 3 415.607 4.213 20 0 HIADHN COc1ccc2c(c1F)CC[C@@H]2N[C@@H]1CCCN([C@@H](C)c2ccc(F)cc2)C1=O ZINC000520601743 928667177 /nfs/dbraw/zinc/66/71/77/928667177.db2.gz NWCSSBUIZDQIRW-PNHOKKKMSA-N 0 3 400.469 4.303 20 0 HIADHN O=C(CN1CCCCC[C@@H]1c1ccccc1)Nc1ccc(CN2CCOCC2)cc1 ZINC000520788632 928819320 /nfs/dbraw/zinc/81/93/20/928819320.db2.gz OAGFHLXVQXTBAH-XMMPIXPASA-N 0 3 407.558 4.075 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)c1nn(-c2ccc(C)cc2)c2c1CCCC2 ZINC000520802082 928825084 /nfs/dbraw/zinc/82/50/84/928825084.db2.gz TVZAQAHAPZHAEV-UHFFFAOYSA-N 0 3 418.541 4.382 20 0 HIADHN COc1ccc([C@H]2CCCN2C(=O)NC[C@@H](c2ccc(C)cc2)N(C)C)cc1OC ZINC000520936470 928882454 /nfs/dbraw/zinc/88/24/54/928882454.db2.gz BKEUWLCPVCZYLN-RTWAWAEBSA-N 0 3 411.546 4.162 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)Cc1csc(Cc2ccccc2)n1 ZINC000521001784 928918736 /nfs/dbraw/zinc/91/87/36/928918736.db2.gz NFNYWALYDKOPRE-UHFFFAOYSA-N 0 3 411.546 4.006 20 0 HIADHN C[C@H](NCC1(Sc2ccccc2)CCCC1)C(=O)N1CC(=O)Nc2ccccc21 ZINC000521012349 928929344 /nfs/dbraw/zinc/92/93/44/928929344.db2.gz DRKPFULPOYVLGV-KRWDZBQOSA-N 0 3 409.555 4.055 20 0 HIADHN Cc1cc(N2CCCC2)ccc1NC(=O)N(CCN(C)C)Cc1ccc(F)cc1F ZINC000521062248 928969443 /nfs/dbraw/zinc/96/94/43/928969443.db2.gz AYGWKUGFSPPQGR-UHFFFAOYSA-N 0 3 416.516 4.469 20 0 HIADHN C[C@@H](NC(=O)N(CCN(C)C)Cc1cccc(F)c1)c1ccccc1OC(F)F ZINC000521068583 928970247 /nfs/dbraw/zinc/97/02/47/928970247.db2.gz AGPTWJALZDPCSV-OAHLLOKOSA-N 0 3 409.452 4.262 20 0 HIADHN CCN1CCCN(C(=O)c2cc(-c3ccc(C)cc3)nc3c2cnn3C(C)C)CC1 ZINC000521070245 928972319 /nfs/dbraw/zinc/97/23/19/928972319.db2.gz ISCQQAZPXQZLHB-UHFFFAOYSA-N 0 3 405.546 4.155 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)Nc1nc2c(s1)CCCCC2 ZINC000521071951 928973558 /nfs/dbraw/zinc/97/35/58/928973558.db2.gz GRMBSSXYIDYLKC-UHFFFAOYSA-N 0 3 408.518 4.286 20 0 HIADHN Cc1nc2c(s1)[C@H](N(C)C(=O)c1ccc(N3CCN(C(C)C)CC3)cc1)CCC2 ZINC000521111830 929002246 /nfs/dbraw/zinc/00/22/46/929002246.db2.gz OBYIARKNPYVQQX-OAQYLSRUSA-N 0 3 412.603 4.132 20 0 HIADHN C[C@H](CNC(=O)NCc1cccnc1Oc1cccc(F)c1)N(C)Cc1ccccc1 ZINC000521161893 929033795 /nfs/dbraw/zinc/03/37/95/929033795.db2.gz COGHNKDDHOXYOI-GOSISDBHSA-N 0 3 422.504 4.333 20 0 HIADHN C[C@@H](Cc1ccc(C(F)(F)F)cc1)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000521167576 929040889 /nfs/dbraw/zinc/04/08/89/929040889.db2.gz VOPXUSBXNKHYOT-OXJNMPFZSA-N 0 3 405.464 4.210 20 0 HIADHN Cn1cc(C(=O)NC[C@@H](c2cccs2)N2CCCC2)c(-c2ccccc2Cl)n1 ZINC000521263306 929089015 /nfs/dbraw/zinc/08/90/15/929089015.db2.gz DAPBKPFZIQBHML-SFHVURJKSA-N 0 3 414.962 4.369 20 0 HIADHN O=C(NC[C@@H]1CCN(C2CC2)C1)c1ccccc1C(=O)c1ccc(Cl)c(Cl)c1 ZINC000521294385 929107999 /nfs/dbraw/zinc/10/79/99/929107999.db2.gz ZHNOBTRDWVUMPF-AWEZNQCLSA-N 0 3 417.336 4.439 20 0 HIADHN CCc1ccc([C@H](CNC(=O)Nc2ccc(C)c(C(=O)NC(C)C)c2)N(C)C)cc1 ZINC000521305396 929113410 /nfs/dbraw/zinc/11/34/10/929113410.db2.gz QSZVPWJFGODYDG-QFIPXVFZSA-N 0 3 410.562 4.120 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)c1c(Cl)c2ccccc2n1C ZINC000521350539 929171259 /nfs/dbraw/zinc/17/12/59/929171259.db2.gz YZETVUMYASNKLF-GOSISDBHSA-N 0 3 410.949 4.353 20 0 HIADHN COc1ccc([C@H](C)NC(=O)N(CCCc2ccccc2)CCN(C)C)cc1F ZINC000521437840 929220102 /nfs/dbraw/zinc/22/01/02/929220102.db2.gz XKRDWSYJUPFOID-SFHVURJKSA-N 0 3 401.526 4.101 20 0 HIADHN O=C(NC[C@@H]1CCCCN1Cc1ccccc1)Nc1cccc(C(=O)N2CCCC2)c1 ZINC000521464779 929232576 /nfs/dbraw/zinc/23/25/76/929232576.db2.gz WGLZGGTWJBIYJC-QHCPKHFHSA-N 0 3 420.557 4.099 20 0 HIADHN CCN1CCCN(C(=O)Nc2ccc(C(=O)N(C)C3CCCCC3)c(Cl)c2)CC1 ZINC000521532512 929278619 /nfs/dbraw/zinc/27/86/19/929278619.db2.gz NIKYNBKYTUAXLQ-UHFFFAOYSA-N 0 3 420.985 4.304 20 0 HIADHN O=C(Nc1ccc(Br)cc1[O-])[C@H]1CCC[N@H+](Cc2cccc(F)c2)C1 ZINC000521533570 929279405 /nfs/dbraw/zinc/27/94/05/929279405.db2.gz JEWVBWFJRXSQQF-AWEZNQCLSA-N 0 3 407.283 4.145 20 0 HIADHN O=C(Nc1ccc(Br)cc1[O-])[C@H]1CCC[N@@H+](Cc2cccc(F)c2)C1 ZINC000521533570 929279416 /nfs/dbraw/zinc/27/94/16/929279416.db2.gz JEWVBWFJRXSQQF-AWEZNQCLSA-N 0 3 407.283 4.145 20 0 HIADHN COc1ccc2oc(C(=O)N(CCN(C)C)Cc3ccc(F)c(F)c3)c(C)c2c1 ZINC000521574162 929304984 /nfs/dbraw/zinc/30/49/84/929304984.db2.gz UYEPEGJPSANPMT-UHFFFAOYSA-N 0 3 402.441 4.232 20 0 HIADHN O=C(NCCc1ccccn1)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000521671418 929358361 /nfs/dbraw/zinc/35/83/61/929358361.db2.gz KPUVXYGUSXPDPE-UHFFFAOYSA-N 0 3 421.372 4.239 20 0 HIADHN Brc1cc(CNC[C@@H](c2ccco2)N2CCCCC2)cc2c1OCCO2 ZINC000521678578 929362282 /nfs/dbraw/zinc/36/22/82/929362282.db2.gz REEHBHPYHUGIEH-KRWDZBQOSA-N 0 3 421.335 4.130 20 0 HIADHN CCN(C(=O)N[C@H]1CCCN(Cc2ccccc2)C1)[C@@H](C)Cc1ccc(OC)cc1 ZINC000521811301 929469797 /nfs/dbraw/zinc/46/97/97/929469797.db2.gz BPPACVDCIKFQIK-REWPJTCUSA-N 0 3 409.574 4.322 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2)c(Cl)c1 ZINC000521855221 929505052 /nfs/dbraw/zinc/50/50/52/929505052.db2.gz FBXUGVZXWRUZBZ-UHFFFAOYSA-N 0 3 406.889 4.033 20 0 HIADHN C[C@@H](C(=O)N[C@H]1CCCC[C@H]1C)N(C)CCCc1cc(-c2cccc(F)c2)n[nH]1 ZINC000521902748 929546933 /nfs/dbraw/zinc/54/69/33/929546933.db2.gz NBPQDJUOYBLGJR-WWMYMODYSA-N 0 3 400.542 4.164 20 0 HIADHN COc1cc(NC(=O)NC[C@H]2CCCN2Cc2ccccc2)c(OC)cc1Cl ZINC000524480935 929630853 /nfs/dbraw/zinc/63/08/53/929630853.db2.gz AMDBUVMUPWOEAD-MRXNPFEDSA-N 0 3 403.910 4.143 20 0 HIADHN CCN(C(=O)N[C@H]1CCN(C2CC2)C1)[C@H]1CCSc2ccc(Br)cc21 ZINC000524493567 929642340 /nfs/dbraw/zinc/64/23/40/929642340.db2.gz ZICOVQYZFSSCMN-YOEHRIQHSA-N 0 3 424.408 4.254 20 0 HIADHN CCc1c(C(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)cnn1Cc1ccccc1 ZINC000524866599 929864514 /nfs/dbraw/zinc/86/45/14/929864514.db2.gz DYTDLZYRDLJDNA-NRFANRHFSA-N 0 3 416.569 4.230 20 0 HIADHN COc1ccc(C(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)cc1OC(F)F ZINC000524865704 929864554 /nfs/dbraw/zinc/86/45/54/929864554.db2.gz CHGZHSAQPZIDLZ-MRXNPFEDSA-N 0 3 404.457 4.033 20 0 HIADHN C/C=C\c1ccc(OCC(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)c(OC)c1 ZINC000524866112 929864572 /nfs/dbraw/zinc/86/45/72/929864572.db2.gz YINMSFDSCRJRBO-BUSNORKWSA-N 0 3 408.542 4.230 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)c1cnn(-c2ccc(Cl)cc2)c1 ZINC000524865855 929864757 /nfs/dbraw/zinc/86/47/57/929864757.db2.gz LLHVJQSCHWBTMF-SFHVURJKSA-N 0 3 408.933 4.262 20 0 HIADHN CC(C)c1nc(CCNC(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)cs1 ZINC000524883319 929871169 /nfs/dbraw/zinc/87/11/69/929871169.db2.gz IYCFCJHPJDTLKG-SFHVURJKSA-N 0 3 400.592 4.115 20 0 HIADHN Cc1cnn(-c2ccc(NC(=O)N3CCCN(Cc4ccccc4)C[C@@H]3C)cc2F)c1 ZINC000524906587 929883554 /nfs/dbraw/zinc/88/35/54/929883554.db2.gz XCQYRCFVGCEWPK-IBGZPJMESA-N 0 3 421.520 4.448 20 0 HIADHN Cc1cc(NC(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)n(Cc2ccccc2)n1 ZINC000524928025 929894633 /nfs/dbraw/zinc/89/46/33/929894633.db2.gz FQUFDYPCXHLZGN-NRFANRHFSA-N 0 3 417.557 4.368 20 0 HIADHN CCOc1c(Cl)cc(CN[C@@H](C)[C@H]2CN(Cc3ccccc3)CCO2)cc1OC ZINC000524947541 929909891 /nfs/dbraw/zinc/90/98/91/929909891.db2.gz USFAGVXIYQHFRW-HTAPYJJXSA-N 0 3 418.965 4.126 20 0 HIADHN COc1cc(CNC(=O)c2cccc(CN(C)C)c2)ccc1OCc1ccccc1 ZINC000524978158 929943159 /nfs/dbraw/zinc/94/31/59/929943159.db2.gz CWZIXWIKLAQOAC-UHFFFAOYSA-N 0 3 404.510 4.266 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)Cc1ccc(NC(=O)CC(C)(C)C)cc1 ZINC000525018488 929978440 /nfs/dbraw/zinc/97/84/40/929978440.db2.gz NGKXCVOYOHNGMB-UHFFFAOYSA-N 0 3 409.574 4.194 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)C[C@@H]2CCCc3ccccc32)cc1)[C@H]1CCCN(C)C1 ZINC000525065779 930013615 /nfs/dbraw/zinc/01/36/15/930013615.db2.gz TUYUDZWJHDHPLZ-GMAHTHKFSA-N 0 3 419.569 4.302 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2c[nH]cc2-c2ccccc2)cc1)[C@H]1CCCN(C)C1 ZINC000525098727 930033546 /nfs/dbraw/zinc/03/35/46/930033546.db2.gz GSQBBEDHRKETQO-NRFANRHFSA-N 0 3 416.525 4.100 20 0 HIADHN Cc1ccc(C(=O)N(CCN(C)C)Cc2ccccc2)cc1NC(=O)NC(C)(C)C ZINC000525371098 930202290 /nfs/dbraw/zinc/20/22/90/930202290.db2.gz IFPKHWQTIURTKZ-UHFFFAOYSA-N 0 3 410.562 4.119 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)[C@@H](c1c(F)cccc1Cl)N(C)C)c1ccsc1 ZINC000525383933 930210522 /nfs/dbraw/zinc/21/05/22/930210522.db2.gz HLFAMSBMCUBHMB-PKOBYXMFSA-N 0 3 411.974 4.343 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)NCc1ccccc1OCC1CC1 ZINC000525399121 930218533 /nfs/dbraw/zinc/21/85/33/930218533.db2.gz ADUDHVTXFRZFDE-FQEVSTJZSA-N 0 3 407.558 4.281 20 0 HIADHN COC(=O)c1cc2cc(NC(=O)N3CCCN(Cc4ccccc4)C[C@@H]3C)ccc2o1 ZINC000525418891 930229897 /nfs/dbraw/zinc/22/98/97/930229897.db2.gz MFJAGNDMWTXIJL-KRWDZBQOSA-N 0 3 421.497 4.348 20 0 HIADHN OCCCN(CCc1nc(-c2ccccc2)no1)Cc1ccc(Cl)c(Cl)c1 ZINC000525423395 930233050 /nfs/dbraw/zinc/23/30/50/930233050.db2.gz UMVWWCVPJRXLJF-UHFFFAOYSA-N 0 3 406.313 4.471 20 0 HIADHN CN(C)C[C@H]1CN(C(=O)N[C@@H](c2ccc(Cl)cc2)c2ccccc2Cl)CCO1 ZINC000525444803 930243410 /nfs/dbraw/zinc/24/34/10/930243410.db2.gz PHNFOLUVMDAILL-PXNSSMCTSA-N 0 3 422.356 4.055 20 0 HIADHN CCc1ccc(Cl)c(CC)c1NC(=O)NC[C@@]1(O)CCN(Cc2ccccc2)C1 ZINC000525510087 930293149 /nfs/dbraw/zinc/29/31/49/930293149.db2.gz XHXGLPVQULDJDE-QHCPKHFHSA-N 0 3 415.965 4.223 20 0 HIADHN CN(C)Cc1ccccc1CNC(=O)c1cccc(-c2noc(CC(C)(C)C)n2)c1 ZINC000525575428 930339781 /nfs/dbraw/zinc/33/97/81/930339781.db2.gz CDIIMFQHONAMJY-UHFFFAOYSA-N 0 3 406.530 4.317 20 0 HIADHN Cc1cc(C)cc(C2(C(=O)Nc3ccc(C(=O)N(C)[C@H]4CCCN(C)C4)cc3)CC2)c1 ZINC000525581510 930344474 /nfs/dbraw/zinc/34/44/74/930344474.db2.gz CQVFPIYYAYTHHH-QHCPKHFHSA-N 0 3 419.569 4.140 20 0 HIADHN O=C(CCc1nnc(-c2ccc(Cl)cc2)o1)N1CCCN(Cc2ccccc2)CC1 ZINC000525618762 930365586 /nfs/dbraw/zinc/36/55/86/930365586.db2.gz FKQXZXPAEICMGZ-UHFFFAOYSA-N 0 3 424.932 4.057 20 0 HIADHN CN(C(=O)c1ccccc1Sc1ccc(Br)cn1)[C@H]1CCCN(C)C1 ZINC000525618888 930365775 /nfs/dbraw/zinc/36/57/75/930365775.db2.gz JWDKNUORCGBZAN-HNNXBMFYSA-N 0 3 420.376 4.162 20 0 HIADHN COC(=O)c1cc2cc(CN(C)Cc3ccc(OC)c(OC(F)F)c3)ccc2o1 ZINC000525633139 930374816 /nfs/dbraw/zinc/37/48/16/930374816.db2.gz MUKKPJILDBPOIM-UHFFFAOYSA-N 0 3 405.397 4.461 20 0 HIADHN C[C@@H]1C[C@H](c2ccccc2)[C@@H](C)N1C(=O)CCCN1CCN(c2ccccc2)CC1 ZINC000525645402 930380782 /nfs/dbraw/zinc/38/07/82/930380782.db2.gz LIUJZBNVMJWANI-RQTOMXEWSA-N 0 3 405.586 4.382 20 0 HIADHN C[C@H]1CCN(C(=O)c2cnn(-c3ccccc3Cl)c2)CCN1Cc1ccccc1 ZINC000525737567 930421011 /nfs/dbraw/zinc/42/10/11/930421011.db2.gz OZHKRHRWMUQYCX-SFHVURJKSA-N 0 3 408.933 4.262 20 0 HIADHN Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)NC[C@H](c1cccs1)N1CCOCC1 ZINC000525757085 930432083 /nfs/dbraw/zinc/43/20/83/930432083.db2.gz BJLYORWEGMTWEZ-UYAOXDASSA-N 0 3 415.603 4.170 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3ccc(C)c(OCC(F)F)c3)cc2)CC1 ZINC000525756539 930432388 /nfs/dbraw/zinc/43/23/88/930432388.db2.gz XILBJUUDLFIQTH-UHFFFAOYSA-N 0 3 403.473 4.033 20 0 HIADHN COc1ccc([C@@H](CCn2cncn2)NCc2ccc(OC3CCCCC3)nc2)cc1 ZINC000526110271 930536957 /nfs/dbraw/zinc/53/69/57/930536957.db2.gz OZVOLQXQWIHDKN-HSZRJFAPSA-N 0 3 421.545 4.314 20 0 HIADHN O=C(NCc1cc2c(s1)CCCC2)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000526908393 930548439 /nfs/dbraw/zinc/54/84/39/930548439.db2.gz LYTFESKBXFJKJU-UHFFFAOYSA-N 0 3 415.525 4.231 20 0 HIADHN C[C@@H]([NH2+]C1(CNC(=O)c2cc([O-])c3ccccc3c2)CCOCC1)c1ccccc1 ZINC000526893866 930548726 /nfs/dbraw/zinc/54/87/26/930548726.db2.gz JKVGUKUXWMCPJO-GOSISDBHSA-N 0 3 404.510 4.175 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2cc(F)ccc2OCC(F)(F)F)[C@@H]1c1ccccc1 ZINC000527067000 930579048 /nfs/dbraw/zinc/57/90/48/930579048.db2.gz HHEICPHIWAZHGX-QAPCUYQASA-N 0 3 411.399 4.334 20 0 HIADHN Cn1c2ccc(CNCc3ccc(-n4cnc5ccccc54)cc3)cc2sc1=O ZINC000527228439 930616208 /nfs/dbraw/zinc/61/62/08/930616208.db2.gz JZZIGIHNTXDLPO-UHFFFAOYSA-N 0 3 400.507 4.229 20 0 HIADHN COC(=O)c1cc2c(o1)c(OC)ccc2CNCc1ccnc(N2CCCCCC2)c1 ZINC000527357808 930645212 /nfs/dbraw/zinc/64/52/12/930645212.db2.gz ADVNXRWWMGQOKR-UHFFFAOYSA-N 0 3 423.513 4.293 20 0 HIADHN O=C(Nc1cccc(CN2CCC[C@@H](OCCO)C2)c1)c1ccc(Cl)cc1Cl ZINC000527362779 930647734 /nfs/dbraw/zinc/64/77/34/930647734.db2.gz JTAUWUJZMPVFDX-GOSISDBHSA-N 0 3 423.340 4.219 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)Nc3ccc(C(F)(F)F)c(Br)c3)[C@@H]2C1 ZINC000530343705 930688091 /nfs/dbraw/zinc/68/80/91/930688091.db2.gz RXWTXACAJCMHAH-IINYFYTJSA-N 0 3 406.246 4.026 20 0 HIADHN CN(C)c1ccc(NC(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)c(C(F)(F)F)c1 ZINC000530357472 930694613 /nfs/dbraw/zinc/69/46/13/930694613.db2.gz ZMJWRSNAJVMRQS-OALUTQOASA-N 0 3 406.452 4.338 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2cc(C3CC3)nn2-c2ccccc2)[C@H]1c1ccccc1 ZINC000530461933 930717758 /nfs/dbraw/zinc/71/77/58/930717758.db2.gz CAKVYJMLCJEERU-NZQKXSOJSA-N 0 3 401.514 4.317 20 0 HIADHN CCCNC(=O)c1ccc(NC(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)cc1Cl ZINC000530515313 930735096 /nfs/dbraw/zinc/73/50/96/930735096.db2.gz WCGKBJCSUHYIML-PMACEKPBSA-N 0 3 414.937 4.047 20 0 HIADHN CCOc1ccc([C@H](NC(=O)CC2(N3CCOCC3)CCCC2)c2ccccc2)cc1 ZINC000530572152 930754163 /nfs/dbraw/zinc/75/41/63/930754163.db2.gz KYWUOKUERVAJAI-RUZDIDTESA-N 0 3 422.569 4.326 20 0 HIADHN CC(C)(CNC(=O)c1ccc(NC(=O)Nc2ccccc2)s1)N1CCCCC1 ZINC000530622835 930775423 /nfs/dbraw/zinc/77/54/23/930775423.db2.gz ZMZDUVNVSKDZMK-UHFFFAOYSA-N 0 3 400.548 4.386 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1cnc(-c2ccccc2)nc1 ZINC000530625464 930776807 /nfs/dbraw/zinc/77/68/07/930776807.db2.gz BAEOPJADSYPOKL-IBGZPJMESA-N 0 3 401.514 4.272 20 0 HIADHN CN(C)Cc1ccc(-c2noc(/C=C/c3ccc(I)o3)n2)cc1 ZINC000530632791 930779937 /nfs/dbraw/zinc/77/99/37/930779937.db2.gz LRHAHFTZMXXXKO-CSKARUKUSA-N 0 3 421.238 4.166 20 0 HIADHN COc1cc(C[NH2+]CCc2nc(-c3ccncc3)cs2)cc(Br)c1[O-] ZINC000530633474 930780293 /nfs/dbraw/zinc/78/02/93/930780293.db2.gz DOKLSEIDIJSRJX-UHFFFAOYSA-N 0 3 420.332 4.014 20 0 HIADHN CC(C)N(Cc1ccc(Br)cc1)C(=O)CC1(N2CCOCC2)CCCC1 ZINC000530805315 930828063 /nfs/dbraw/zinc/82/80/63/930828063.db2.gz CYIOSDNCFCPISK-UHFFFAOYSA-N 0 3 423.395 4.221 20 0 HIADHN COc1ccc(-c2ccc(CNC(=O)[C@H]3CCCN(Cc4cccnc4)C3)s2)cc1 ZINC000530843943 930838773 /nfs/dbraw/zinc/83/87/73/930838773.db2.gz YTRGCDZYJVJTKR-FQEVSTJZSA-N 0 3 421.566 4.347 20 0 HIADHN CN(C)Cc1ccc(-c2noc([C@@H]3CCCN(c4ncnc5sccc54)C3)n2)cc1 ZINC000530872682 930844851 /nfs/dbraw/zinc/84/48/51/930844851.db2.gz OGXLBWJURXLONB-QGZVFWFLSA-N 0 3 420.542 4.187 20 0 HIADHN CN(C)Cc1ccc(-c2noc(-c3cccc(CSc4nccn4C)c3)n2)cc1 ZINC000530872901 930845083 /nfs/dbraw/zinc/84/50/83/930845083.db2.gz SXJOWNYRPATMBG-UHFFFAOYSA-N 0 3 405.527 4.491 20 0 HIADHN CCC[C@@H](N[C@@H](C)CC(=O)Nc1ccccc1)C(=O)Nc1cccc(N2CCCC2)c1 ZINC000530907397 930856327 /nfs/dbraw/zinc/85/63/27/930856327.db2.gz JYIVOIYWEYATOV-WMZHIEFXSA-N 0 3 422.573 4.401 20 0 HIADHN CC[C@@H](C(=O)Nc1ccc(CN2C(=O)Cc3ccc(Cl)cc32)cc1)N(CC)CC ZINC000531048095 930897207 /nfs/dbraw/zinc/89/72/07/930897207.db2.gz SDECVGJQWBMJDS-FQEVSTJZSA-N 0 3 413.949 4.488 20 0 HIADHN Cc1ccc([C@H](CNC(=O)CN[C@@H](c2ccccc2)C(F)(F)F)N2CCCC2)cc1 ZINC000531049059 930897318 /nfs/dbraw/zinc/89/73/18/930897318.db2.gz LRJAPWZWTUVHAU-UNMCSNQZSA-N 0 3 419.491 4.141 20 0 HIADHN O=C(c1cccc(CN2CCCC2)c1)N1CCN(CC(F)(F)F)c2ccccc21 ZINC000531073114 930907973 /nfs/dbraw/zinc/90/79/73/930907973.db2.gz IZIWAYPCCYUQPS-UHFFFAOYSA-N 0 3 403.448 4.312 20 0 HIADHN COc1cc(C[NH2+][C@@H]2CCCO[C@H]2c2ccc(C)cc2)cc(Br)c1[O-] ZINC000531094315 930917763 /nfs/dbraw/zinc/91/77/63/930917763.db2.gz AMCYNHHECWCONV-XLIONFOSSA-N 0 3 406.320 4.482 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)Nc1cnc(-c2ccccc2)nc1 ZINC000531102889 930921093 /nfs/dbraw/zinc/92/10/93/930921093.db2.gz QBYSGVWFCLWHPW-UHFFFAOYSA-N 0 3 411.456 4.018 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)NCC1(c2ccccc2)CCCCC1 ZINC000531138464 930939255 /nfs/dbraw/zinc/93/92/55/930939255.db2.gz JACQQDHVSABFLG-UHFFFAOYSA-N 0 3 407.558 4.013 20 0 HIADHN C[C@@H](c1ccc2ccccc2c1)N(C(=O)NCCCCN1CCN(C)CC1)C1CC1 ZINC000531260689 930985555 /nfs/dbraw/zinc/98/55/55/930985555.db2.gz VYJQGHNCXOXQJE-FQEVSTJZSA-N 0 3 408.590 4.102 20 0 HIADHN Cc1sc([C@@H](C)NC(=O)N[C@@H]2CCN(C3CC3)C2)nc1-c1ccc(Cl)cc1 ZINC000531263618 930987955 /nfs/dbraw/zinc/98/79/55/930987955.db2.gz YHXLSVOVSHFYNE-MLGOLLRUSA-N 0 3 404.967 4.369 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)CCc1nnc(-c2ccc(Cl)cc2)o1 ZINC000531288312 931003108 /nfs/dbraw/zinc/00/31/08/931003108.db2.gz AEKALQKVGHYNQI-UHFFFAOYSA-N 0 3 414.893 4.032 20 0 HIADHN CC[C@@H](C(=O)Nc1ccc(OC)c(NC(=O)c2cccc(F)c2)c1)N(CC)CC ZINC000531289430 931003198 /nfs/dbraw/zinc/00/31/98/931003198.db2.gz CWWMBRLTVBELGX-IBGZPJMESA-N 0 3 401.482 4.146 20 0 HIADHN Cc1nnc(-c2cccc(C(=O)N[C@@H](CN3CCc4ccccc4C3)C(C)(C)C)c2)o1 ZINC000531290554 931003891 /nfs/dbraw/zinc/00/38/91/931003891.db2.gz VBSYOOMHLTVXHG-QFIPXVFZSA-N 0 3 418.541 4.248 20 0 HIADHN CCNC(=O)COc1ccc(CN[C@@H](c2cccc(F)c2)C(C)(C)C)cc1OC ZINC000531402561 931045041 /nfs/dbraw/zinc/04/50/41/931045041.db2.gz NCXHFWMXXPEQHR-QFIPXVFZSA-N 0 3 402.510 4.226 20 0 HIADHN C[C@H](O)C[C@@H](CNCc1nc(-c2cccc(Br)c2)c[nH]1)c1ccccc1 ZINC000531582091 931108848 /nfs/dbraw/zinc/10/88/48/931108848.db2.gz WIMZRZGLSPIIBP-YJBOKZPZSA-N 0 3 414.347 4.484 20 0 HIADHN Cc1cccc2c1CC[C@@H]2NCc1ccc(OCCN2CCOCC2)c(Cl)c1 ZINC000531582074 931109230 /nfs/dbraw/zinc/10/92/30/931109230.db2.gz ULRARHKUXUPXGX-QFIPXVFZSA-N 0 3 400.950 4.137 20 0 HIADHN CC(C)(NCc1ccc(OCCN2CCOCC2)c(Cl)c1)c1cccc(F)c1 ZINC000531582007 931109341 /nfs/dbraw/zinc/10/93/41/931109341.db2.gz KVVXAMQBKYXNLQ-UHFFFAOYSA-N 0 3 406.929 4.215 20 0 HIADHN CN1CCN(c2ccc(C(F)(F)F)cc2CNCc2cnc(C3CC3)s2)CC1 ZINC000531628922 931132754 /nfs/dbraw/zinc/13/27/54/931132754.db2.gz VWHIDXORXZELMA-UHFFFAOYSA-N 0 3 410.509 4.081 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@H](C)N[C@H]2CCCc3cc(OC)ccc32)cc1 ZINC000531676684 931147994 /nfs/dbraw/zinc/14/79/94/931147994.db2.gz IPGISOBNJHGNFW-SBUREZEXSA-N 0 3 416.587 4.454 20 0 HIADHN O=C(Nc1ccc2[nH]c([C@@H]3CCCO3)nc2c1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000531681214 931149564 /nfs/dbraw/zinc/14/95/64/931149564.db2.gz YKMGDDUKGOZVPW-JTSKRJEESA-N 0 3 422.504 4.404 20 0 HIADHN C[C@@H](NC1CCN(CC(=O)Nc2ccccc2)CC1)c1sccc1Br ZINC000531687864 931153096 /nfs/dbraw/zinc/15/30/96/931153096.db2.gz YSAGSCIBSJDRFX-CQSZACIVSA-N 0 3 422.392 4.264 20 0 HIADHN COc1cc(CN[C@@H](C)c2ccc([S@@](C)=O)cc2)ccc1OCC(F)(F)F ZINC000531690869 931155036 /nfs/dbraw/zinc/15/50/36/931155036.db2.gz BIPGALCVLVBIIX-JGTBNHKDSA-N 0 3 401.450 4.225 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(S(C)(=O)=O)cc1)c1ccc(OCC(F)(F)F)cc1 ZINC000531695053 931158715 /nfs/dbraw/zinc/15/87/15/931158715.db2.gz VJRXIMOCDOMSEI-KBPBESRZSA-N 0 3 401.450 4.443 20 0 HIADHN CCC[C@@H](N[C@H](C)c1ccc2c(c1)CCC(=O)N2)C(=O)N1CCc2sccc2C1 ZINC000531710014 931169079 /nfs/dbraw/zinc/16/90/79/931169079.db2.gz IBFSNTOBNRUQBA-FOIQADDNSA-N 0 3 411.571 4.037 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1C(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000531800872 931203659 /nfs/dbraw/zinc/20/36/59/931203659.db2.gz MKHCVCSIOBGUEI-DEOSSOPVSA-N 0 3 416.569 4.285 20 0 HIADHN Clc1cccc2c1CC[C@@H]2NCc1ccc(OCCN2CCOCC2)c(Cl)c1 ZINC000531835699 931214122 /nfs/dbraw/zinc/21/41/22/931214122.db2.gz XFZHRTSVKHTXMG-NRFANRHFSA-N 0 3 421.368 4.482 20 0 HIADHN Cc1nc([C@H](C)N2CC[C@@H](N3CCN(C(C)C)CC3)C2)oc1-c1ccc(Cl)cc1 ZINC000531912599 931244436 /nfs/dbraw/zinc/24/44/36/931244436.db2.gz KSRHYWAFFZAOLE-GHTZIAJQSA-N 0 3 416.997 4.465 20 0 HIADHN COCC(=O)Nc1cccc(CN[C@H](Cc2ccc(F)cc2)c2ccc(OC)cc2)c1 ZINC000531941970 931254774 /nfs/dbraw/zinc/25/47/74/931254774.db2.gz BICIDCMMGQGNIX-XMMPIXPASA-N 0 3 422.500 4.493 20 0 HIADHN C[C@H](NCc1ccc(N2CCN(C)CC2)nc1)c1ccccc1OCc1ccccc1 ZINC000531941788 931255009 /nfs/dbraw/zinc/25/50/09/931255009.db2.gz XWYFLNGIYMBTOC-NRFANRHFSA-N 0 3 416.569 4.263 20 0 HIADHN Fc1cccc(C[C@@H](NCc2ccc(N3CCOCC3)nc2)c2cccc(F)c2)c1 ZINC000531944592 931256694 /nfs/dbraw/zinc/25/66/94/931256694.db2.gz HNDFYNVYQSOTFT-HSZRJFAPSA-N 0 3 409.480 4.270 20 0 HIADHN COc1ccc([C@@H](C)NCc2ccc(S(=O)(=O)N(C)C(C)C)cc2)cc1Cl ZINC000531951777 931260927 /nfs/dbraw/zinc/26/09/27/931260927.db2.gz YPCBPTLFWFCONV-OAHLLOKOSA-N 0 3 410.967 4.228 20 0 HIADHN COc1cccc(C(=O)NCCN[C@@H]2CCSc3ccc(Br)cc32)c1 ZINC000531951941 931261453 /nfs/dbraw/zinc/26/14/53/931261453.db2.gz MQYCCNXEOWBDMA-QGZVFWFLSA-N 0 3 421.360 4.014 20 0 HIADHN COc1cccc(C(=O)NCCN[C@@H](C)c2sc(Cc3ccccc3)nc2C)c1 ZINC000531952482 931261545 /nfs/dbraw/zinc/26/15/45/931261545.db2.gz JNPQAVCPRIRAFV-INIZCTEOSA-N 0 3 409.555 4.132 20 0 HIADHN C[C@@H](NC[C@H](c1cccc(F)c1)N1CCOCC1)c1sccc1Br ZINC000531952719 931261768 /nfs/dbraw/zinc/26/17/68/931261768.db2.gz POSIFPUCEAFIIM-CXAGYDPISA-N 0 3 413.356 4.374 20 0 HIADHN CNS(=O)(=O)c1ccc([C@@H](C)N[C@@H](C)c2sc(-c3ccccc3)nc2C)cc1 ZINC000531952599 931262057 /nfs/dbraw/zinc/26/20/57/931262057.db2.gz WNYWYMBPDSYYII-CABCVRRESA-N 0 3 415.584 4.438 20 0 HIADHN CC[C@@H](NCc1ccc(C(=O)N2CCOCC2)cc1)c1cccc(Br)c1 ZINC000531954473 931262588 /nfs/dbraw/zinc/26/25/88/931262588.db2.gz QTTMVUFZYCALKR-HXUWFJFHSA-N 0 3 417.347 4.162 20 0 HIADHN CCS(=O)(=O)Nc1ccc([C@H](C)N[C@@H](c2ccc(F)cc2)[C@H]2CCCO2)cc1 ZINC000531962134 931266393 /nfs/dbraw/zinc/26/63/93/931266393.db2.gz NIZQATWCWBCDKG-RVHYNSKXSA-N 0 3 406.523 4.158 20 0 HIADHN CC[C@H](N[C@@H](C)c1cccc(S(=O)(=O)NC)c1)c1ccc(Br)cc1 ZINC000531965532 931268608 /nfs/dbraw/zinc/26/86/08/931268608.db2.gz HYZRVUZOCTYNAC-UGSOOPFHSA-N 0 3 411.365 4.159 20 0 HIADHN C[C@@H](NCc1cccc(OCC(N)=O)c1)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000531982898 931274845 /nfs/dbraw/zinc/27/48/45/931274845.db2.gz BKORVLYEVLQGJC-QGZVFWFLSA-N 0 3 408.473 4.120 20 0 HIADHN C[C@@H](NCc1ccc(N2CCN(C)CC2)nc1)c1ccc(Oc2ccccc2)cc1 ZINC000531989389 931278644 /nfs/dbraw/zinc/27/86/44/931278644.db2.gz USEAZALVJGXPOP-HXUWFJFHSA-N 0 3 402.542 4.477 20 0 HIADHN O=C(c1ccc(CN[C@@H]2CCCOc3cc4c(cc32)CCCC4)cc1)N1CCOCC1 ZINC000532016432 931285431 /nfs/dbraw/zinc/28/54/31/931285431.db2.gz SLAQIYYDWPRVKN-XMMPIXPASA-N 0 3 420.553 4.041 20 0 HIADHN O=C(c1ccc(CN[C@H]2CCCOc3cc4c(cc32)CCCC4)cc1)N1CCOCC1 ZINC000532016431 931285712 /nfs/dbraw/zinc/28/57/12/931285712.db2.gz SLAQIYYDWPRVKN-DEOSSOPVSA-N 0 3 420.553 4.041 20 0 HIADHN Cn1cc(Nc2cccc(C(=O)Nc3ccc(CCN4CCSCC4)cc3)c2)cn1 ZINC000532026843 931290009 /nfs/dbraw/zinc/29/00/09/931290009.db2.gz GSZCLWXFOAWSTN-UHFFFAOYSA-N 0 3 421.570 4.007 20 0 HIADHN CCC[C@H](NCc1cccc(-n2cccn2)c1)C(=O)Nc1cccc(N2CCCC2)c1 ZINC000532122553 931321951 /nfs/dbraw/zinc/32/19/51/931321951.db2.gz SXORASRSANBBKU-DEOSSOPVSA-N 0 3 417.557 4.370 20 0 HIADHN C[C@@H]1C[C@@H](c2ccccc2)CN1CC(=O)NCc1cccc(COCc2ccco2)c1 ZINC000532159885 931333280 /nfs/dbraw/zinc/33/32/80/931333280.db2.gz NZAWKACBWQYSGG-HYBUGGRVSA-N 0 3 418.537 4.491 20 0 HIADHN C[C@H](CC(=O)N1CCCCCC1)NCc1cccc(NC(=O)c2cccc(F)c2)c1 ZINC000532194869 931343999 /nfs/dbraw/zinc/34/39/99/931343999.db2.gz LQNGZRABRMFWQW-GOSISDBHSA-N 0 3 411.521 4.349 20 0 HIADHN C[C@H](NCc1ccc(OCC(F)(F)F)nc1)c1ccc(NC(=O)NC2CC2)cc1 ZINC000532194028 931344026 /nfs/dbraw/zinc/34/40/26/931344026.db2.gz LXMKOFMRPZJFIX-ZDUSSCGKSA-N 0 3 408.424 4.157 20 0 HIADHN C[C@@H](NCc1ccc(OCC(F)(F)F)nc1)c1ccc(NC(=O)NC2CC2)cc1 ZINC000532194027 931344482 /nfs/dbraw/zinc/34/44/82/931344482.db2.gz LXMKOFMRPZJFIX-CYBMUJFWSA-N 0 3 408.424 4.157 20 0 HIADHN COc1cccc(COc2cccc(Cl)c2CN[C@H]2CCC[C@H](C(N)=O)C2)c1 ZINC000532210320 931353207 /nfs/dbraw/zinc/35/32/07/931353207.db2.gz VADFEPRBZVYIOS-IRXDYDNUSA-N 0 3 402.922 4.061 20 0 HIADHN Cc1cccc(COc2ccc([C@H](C)NCc3cccc(OCC(N)=O)c3)cc2)c1 ZINC000532238087 931366504 /nfs/dbraw/zinc/36/65/04/931366504.db2.gz OGVVPFBULCHLIU-IBGZPJMESA-N 0 3 404.510 4.289 20 0 HIADHN C[C@@H](O)C[C@H](CNCc1nc(-c2ccc(Br)cc2)c[nH]1)c1ccccc1 ZINC000532346426 931403267 /nfs/dbraw/zinc/40/32/67/931403267.db2.gz JQRCISPAMOIAIV-CRAIPNDOSA-N 0 3 414.347 4.484 20 0 HIADHN CC(C)N1CCN([C@@H]2CCN(C(=O)C[C@@H](Cc3ccccc3)c3ccccc3)C2)CC1 ZINC000532347676 931403684 /nfs/dbraw/zinc/40/36/84/931403684.db2.gz CCTVMQNIPQIPFF-CLJLJLNGSA-N 0 3 419.613 4.030 20 0 HIADHN COc1cccc(-c2nn(C(C)(C)C)cc2CNCCn2c(=O)[nH]c3ccccc32)c1 ZINC000532358567 931407652 /nfs/dbraw/zinc/40/76/52/931407652.db2.gz OWPSXQDWSDFBPT-UHFFFAOYSA-N 0 3 419.529 4.159 20 0 HIADHN COc1ccccc1OCCN[C@@H](C)c1ccc(S(=O)(=O)C2CCCC2)cc1 ZINC000532461044 931444864 /nfs/dbraw/zinc/44/48/64/931444864.db2.gz RDHFIUFGLRPESE-KRWDZBQOSA-N 0 3 403.544 4.141 20 0 HIADHN CC[C@H](NCc1ccc(CS(=O)(=O)NC(C)C)cc1)c1ccc(Cl)s1 ZINC000532465899 931447912 /nfs/dbraw/zinc/44/79/12/931447912.db2.gz QIXNWYIRJGAGTM-INIZCTEOSA-N 0 3 400.997 4.470 20 0 HIADHN COc1cc(CN(C)CCC(=O)N[C@H](c2cccs2)c2ccccc2)cc(OC)c1 ZINC000532490717 931458792 /nfs/dbraw/zinc/45/87/92/931458792.db2.gz QTPDFMYAYPZDEV-DEOSSOPVSA-N 0 3 424.566 4.493 20 0 HIADHN Cc1ccc([C@H](C)N(C)Cc2cc(=O)n3cc(Br)ccc3n2)c(C)c1 ZINC000532493806 931459967 /nfs/dbraw/zinc/45/99/67/931459967.db2.gz XLFBJUONFIHKFD-HNNXBMFYSA-N 0 3 400.320 4.267 20 0 HIADHN Cc1ccc2ncc(CNC3(c4ccc(Br)cc4)CCOCC3)n2c1 ZINC000532495868 931461467 /nfs/dbraw/zinc/46/14/67/931461467.db2.gz SZSWGCWLYYGSQX-UHFFFAOYSA-N 0 3 400.320 4.201 20 0 HIADHN C[C@H](N[C@H](CN1CCN(C)CC1)c1ccccc1)c1ccc(F)c(Br)c1 ZINC000532497599 931462889 /nfs/dbraw/zinc/46/28/89/931462889.db2.gz AMQWCFNYKLLXAB-HRAATJIYSA-N 0 3 420.370 4.228 20 0 HIADHN C[C@@H](N[C@@H](CN1CCN(C)CC1)c1ccccc1)c1ccc(Br)s1 ZINC000532498124 931463233 /nfs/dbraw/zinc/46/32/33/931463233.db2.gz BJZYTTPAAHXXKT-WBVHZDCISA-N 0 3 408.409 4.150 20 0 HIADHN Cc1ccc2cccc(C(=O)Nc3ccnn3[C@H]3CCN(Cc4ccccc4)C3)c2n1 ZINC000532521177 931473358 /nfs/dbraw/zinc/47/33/58/931473358.db2.gz YQAQMKGYRFRNNV-NRFANRHFSA-N 0 3 411.509 4.439 20 0 HIADHN COc1cc(OC)cc(N2CC[C@H](N[C@H](C)c3sccc3Br)C2)c1 ZINC000532549724 931518969 /nfs/dbraw/zinc/51/89/69/931518969.db2.gz QNIJCJMSOKATNJ-OLZOCXBDSA-N 0 3 411.365 4.457 20 0 HIADHN C[C@H](C(=O)N(c1nccs1)C1CCCCC1)N1CCN(C2CCC(C)CC2)CC1 ZINC000532572758 931535409 /nfs/dbraw/zinc/53/54/09/931535409.db2.gz VWNIJFRDDCXBHZ-IOJLRTSASA-N 0 3 418.651 4.394 20 0 HIADHN Cc1c(NC(=O)[C@@H]2CCCN(Cc3cccnc3)C2)cnn1-c1cc(C)ccc1C ZINC000532614172 931554465 /nfs/dbraw/zinc/55/44/65/931554465.db2.gz BEMDLUVNPDRQMY-OAQYLSRUSA-N 0 3 403.530 4.043 20 0 HIADHN O=C(CCc1ccccc1)N1CCC(NCc2ccc(F)cc2Br)CC1 ZINC000532618933 931556177 /nfs/dbraw/zinc/55/61/77/931556177.db2.gz SQPLRPIVOJRZSU-UHFFFAOYSA-N 0 3 419.338 4.302 20 0 HIADHN O=c1cc(CN2CCC[C@@H](c3nc4ccccc4s3)C2)nc2ccc(Cl)cn12 ZINC000532626950 931559061 /nfs/dbraw/zinc/55/90/61/931559061.db2.gz XJKHHPXMXPSXTD-CQSZACIVSA-N 0 3 410.930 4.337 20 0 HIADHN CN(C)C(=O)[C@H](c1ccccc1)N1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1 ZINC000532685727 931584153 /nfs/dbraw/zinc/58/41/53/931584153.db2.gz KECYEFMGRQPZOA-QUCCMNQESA-N 0 3 424.932 4.399 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@H](C)N[C@@H](c2ccc(F)cc2)C2CCC2)cc1OC ZINC000532687622 931585087 /nfs/dbraw/zinc/58/50/87/931585087.db2.gz GTOINTXSZVFTET-QMHKHESXSA-N 0 3 414.521 4.321 20 0 HIADHN O=C(CN[C@@H](c1ccc(F)cc1)C1CCC1)N1CCC[C@@H]1c1ccc2c(c1)OCCO2 ZINC000532687633 931585362 /nfs/dbraw/zinc/58/53/62/931585362.db2.gz GVOPAZBYIOVOMG-PXDATVDWSA-N 0 3 424.516 4.391 20 0 HIADHN O[C@@H](COc1c(Cl)cccc1Cl)CN1CCC(c2nc3ccccc3[nH]2)CC1 ZINC000532718938 931607480 /nfs/dbraw/zinc/60/74/80/931607480.db2.gz JVWWZPNXQBGRTM-OAHLLOKOSA-N 0 3 420.340 4.489 20 0 HIADHN CCCN1CCN(c2ccccc2CNc2ccc(-c3nnc(CC)o3)cc2)CC1 ZINC000532743999 931620187 /nfs/dbraw/zinc/62/01/87/931620187.db2.gz ALGIFMRABYKWRC-UHFFFAOYSA-N 0 3 405.546 4.443 20 0 HIADHN C[C@H](Cc1cc(Br)ccc1F)NCc1ccc(Br)cn1 ZINC000532859128 931668483 /nfs/dbraw/zinc/66/84/83/931668483.db2.gz ZNTOLXHGGPCCQC-SNVBAGLBSA-N 0 3 402.105 4.467 20 0 HIADHN Brc1ccc(CNCc2cccc3cccnc32)c(N2CCOCC2)c1 ZINC000532886483 931678488 /nfs/dbraw/zinc/67/84/88/931678488.db2.gz BTCALZNBMIFEIX-UHFFFAOYSA-N 0 3 412.331 4.124 20 0 HIADHN O=c1[nH]c(CCN2CCN(C(c3ccccc3)c3ccccc3)CC2)nc2ccccc21 ZINC000532899084 931684690 /nfs/dbraw/zinc/68/46/90/931684690.db2.gz JOFPJRNBEYVUOS-UHFFFAOYSA-N 0 3 424.548 4.285 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)Cc1ccc(C)c(C)c1 ZINC000532911322 931690357 /nfs/dbraw/zinc/69/03/57/931690357.db2.gz OPGUKLILUCRDFZ-QHCPKHFHSA-N 0 3 402.542 4.437 20 0 HIADHN CCOC(=O)c1oc2ccc(Br)cc2c1CN(C[C@H]1CCOC1)C1CC1 ZINC000532921843 931695281 /nfs/dbraw/zinc/69/52/81/931695281.db2.gz QVTRPXPVUSWYGX-CYBMUJFWSA-N 0 3 422.319 4.373 20 0 HIADHN O=C(CN(Cc1ccccc1)CC1CCOCC1)Nc1ccc(OC(F)(F)F)cc1 ZINC000532965354 931716159 /nfs/dbraw/zinc/71/61/59/931716159.db2.gz QQIIFDWOBLXVAO-UHFFFAOYSA-N 0 3 422.447 4.453 20 0 HIADHN CC[C@H](C)[C@H](C)N(CC(=O)Nc1ccccc1I)C1CC1 ZINC000532966324 931717748 /nfs/dbraw/zinc/71/77/48/931717748.db2.gz FKBFCQHETOCAOP-STQMWFEESA-N 0 3 400.304 4.129 20 0 HIADHN CSc1ccccc1NC(=O)CCN1CCC[C@H](C(=O)c2ccc(F)cc2)C1 ZINC000532970269 931720251 /nfs/dbraw/zinc/72/02/51/931720251.db2.gz FTSSDZIWONSJIC-KRWDZBQOSA-N 0 3 400.519 4.471 20 0 HIADHN Cc1sc2[nH]c(CN(C)[C@@H]3CCN(C4CC4)C3)nc(=O)c2c1-c1ccc(C)cc1 ZINC000532981958 931725654 /nfs/dbraw/zinc/72/56/54/931725654.db2.gz PTLMOMTUFJFKHW-GOSISDBHSA-N 0 3 408.571 4.349 20 0 HIADHN c1ccc(-c2cccc(CNc3ccc4nc(CCN5CCOCC5)[nH]c4c3)c2)nc1 ZINC000533039215 931748383 /nfs/dbraw/zinc/74/83/83/931748383.db2.gz POILIWSXLJUSMK-UHFFFAOYSA-N 0 3 413.525 4.112 20 0 HIADHN COc1ccc(OC)c([C@@H]2CCCN2C(=O)CN[C@@H](c2ccccc2)C2CCC2)c1 ZINC000533046365 931751219 /nfs/dbraw/zinc/75/12/19/931751219.db2.gz RIABDCOMWWYCLH-DHLKQENFSA-N 0 3 408.542 4.498 20 0 HIADHN Cc1cccc(C2(NCc3cc(=O)n4cc(Br)ccc4n3)CCCC2)c1 ZINC000533051388 931755224 /nfs/dbraw/zinc/75/52/24/931755224.db2.gz KECJAWFDBWXVAI-UHFFFAOYSA-N 0 3 412.331 4.325 20 0 HIADHN Cc1cccc(NC2CCN(C[C@@H](O)COc3cccc(C(F)(F)F)c3)CC2)c1 ZINC000533072867 931763616 /nfs/dbraw/zinc/76/36/16/931763616.db2.gz VVEGQKSDRVUZND-HXUWFJFHSA-N 0 3 408.464 4.330 20 0 HIADHN CC(C)N(C)S(=O)(=O)c1ccc(CNCc2cccc(-c3cccnc3)c2)cc1 ZINC000533191784 931805394 /nfs/dbraw/zinc/80/53/94/931805394.db2.gz RRLSUEHNLCOMPO-UHFFFAOYSA-N 0 3 409.555 4.067 20 0 HIADHN O=C(CC1CCN(Cc2c(-c3ccccc3)nc3ccccn32)CC1)N1CCCC1 ZINC000533242208 931817420 /nfs/dbraw/zinc/81/74/20/931817420.db2.gz BODRDFFOJALGBH-UHFFFAOYSA-N 0 3 402.542 4.226 20 0 HIADHN CCNC(=O)c1cccc(NC(=O)CN(CCc2ccccc2F)C2CCCC2)c1 ZINC000533256039 931820800 /nfs/dbraw/zinc/82/08/00/931820800.db2.gz TZJHOBQTTZNFHK-UHFFFAOYSA-N 0 3 411.521 4.001 20 0 HIADHN CCCN(CC(=O)Nc1cc(C2CC2)nn1-c1ccccc1)[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000533294039 931831770 /nfs/dbraw/zinc/83/17/70/931831770.db2.gz GDTNSFXAJUFKDS-CTUHWIOQSA-N 0 3 422.573 4.214 20 0 HIADHN COc1cc(OC)c(OC)cc1CN[C@H](C)[C@@H](OC1CCOCC1)c1ccccc1 ZINC000533329422 931839929 /nfs/dbraw/zinc/83/99/29/931839929.db2.gz GYJLVDNSHSTXEP-MZNJEOGPSA-N 0 3 415.530 4.127 20 0 HIADHN COC(=O)c1ccc(CNC2(c3cccc(Br)c3)CCOCC2)cc1F ZINC000533348924 931845242 /nfs/dbraw/zinc/84/52/42/931845242.db2.gz GRWSRKFZIBAVPJ-UHFFFAOYSA-N 0 3 422.294 4.170 20 0 HIADHN COc1ccc([C@H]2CCCN2C(=O)CN[C@H](c2ccccc2)C2CCC2)c(OC)c1 ZINC000533368338 931850206 /nfs/dbraw/zinc/85/02/06/931850206.db2.gz JFAMPJMIFFUFKU-RCZVLFRGSA-N 0 3 408.542 4.498 20 0 HIADHN NC(=O)c1ccc(NC(=O)CCN2CCCC[C@H]2c2ccccc2C(F)(F)F)cc1 ZINC000533369258 931850694 /nfs/dbraw/zinc/85/06/94/931850694.db2.gz HPNAROWCEPWMFM-IBGZPJMESA-N 0 3 419.447 4.360 20 0 HIADHN O=C(Nc1ccccc1Br)C1CCN(CCOc2ccc(F)cc2)CC1 ZINC000533372973 931852030 /nfs/dbraw/zinc/85/20/30/931852030.db2.gz SMBIEXZFTNZIKE-UHFFFAOYSA-N 0 3 421.310 4.318 20 0 HIADHN C[C@@H](c1ccc(F)c(F)c1)N(C)C(=O)CNC1(c2ccc(Cl)cc2)CCOCC1 ZINC000533385444 931854467 /nfs/dbraw/zinc/85/44/67/931854467.db2.gz MLMSSFLVTMPAOK-HNNXBMFYSA-N 0 3 422.903 4.433 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@@H](C)NCc2cnc(CC(C)C)s2)CC1 ZINC000533446549 931871708 /nfs/dbraw/zinc/87/17/08/931871708.db2.gz OLJANMJPIIKWCO-QGZVFWFLSA-N 0 3 404.599 4.473 20 0 HIADHN CC1CCC(N(C)C(=O)CNC2(c3cccc(Br)c3)CCOCC2)CC1 ZINC000533485943 931881663 /nfs/dbraw/zinc/88/16/63/931881663.db2.gz YFYZGSOFCGWUOJ-UHFFFAOYSA-N 0 3 423.395 4.082 20 0 HIADHN CC(C)[C@H](CNC(=O)CNC1(c2ccc(Cl)cc2)CCOCC1)c1ccccc1 ZINC000533522490 931893219 /nfs/dbraw/zinc/89/32/19/931893219.db2.gz XHORUNDDQIQRDV-QFIPXVFZSA-N 0 3 414.977 4.491 20 0 HIADHN CCN(CC(=O)Nc1cccc(C)c1C)C1CCN(c2cc(C)nc(C(C)C)n2)CC1 ZINC000533533023 931896248 /nfs/dbraw/zinc/89/62/48/931896248.db2.gz GBAKCPOUECTEIJ-UHFFFAOYSA-N 0 3 423.605 4.455 20 0 HIADHN O=C1c2ccccc2C(=O)N1[C@@H]1CCCC[C@H](NCc2csc(-c3ccco3)n2)C1 ZINC000533547940 931898365 /nfs/dbraw/zinc/89/83/65/931898365.db2.gz HGOHUCBIOSSNQK-DOTOQJQBSA-N 0 3 421.522 4.490 20 0 HIADHN CC(C)N1CCN([C@H]2CCN([C@@H](C)c3ncc(-c4ccc(Cl)cc4)o3)C2)CC1 ZINC000533559062 931899973 /nfs/dbraw/zinc/89/99/73/931899973.db2.gz PFZHVLLQFPWKKK-PXNSSMCTSA-N 0 3 402.970 4.156 20 0 HIADHN CSc1ccc(OCC[NH+]2CCC(C(=O)Nc3cc(Cl)ccc3[O-])CC2)cc1 ZINC000533595847 931911699 /nfs/dbraw/zinc/91/16/99/931911699.db2.gz AUALPYFKWRARJW-UHFFFAOYSA-N 0 3 420.962 4.497 20 0 HIADHN CC(C)(C)c1ccc(CNCc2ccccc2CS(=O)(=O)N2CCCC2)cc1 ZINC000533636523 931938145 /nfs/dbraw/zinc/93/81/45/931938145.db2.gz DFQXYYCSOVFRAR-UHFFFAOYSA-N 0 3 400.588 4.200 20 0 HIADHN COc1ccc(C(=O)N(CCN(C)C)Cc2ccc(F)cc2)cc1-c1ccccn1 ZINC000533647020 931943331 /nfs/dbraw/zinc/94/33/31/931943331.db2.gz HTTLNDWCSOKQKE-UHFFFAOYSA-N 0 3 407.489 4.100 20 0 HIADHN CC[C@@H](CNC(=O)c1ccc(OC)c(-c2ccccn2)c1)N1CCc2ccccc2C1 ZINC000533653351 931948659 /nfs/dbraw/zinc/94/86/59/931948659.db2.gz YYIXBGPTNAYQOD-QFIPXVFZSA-N 0 3 415.537 4.324 20 0 HIADHN Cc1cc(C)c(CC(C(=O)Nc2ccc3oc(=O)n(C)c3c2)C(F)(F)F)c(C)c1 ZINC000533678809 931965693 /nfs/dbraw/zinc/96/56/93/931965693.db2.gz XHAHIFLCKGONRS-INIZCTEOSA-N 0 3 406.404 4.416 20 0 HIADHN Cc1cc(C)c(CC(C(=O)Nc2ccc3oc(=O)n(C)c3c2)C(F)(F)F)c(C)c1 ZINC000533678810 931965727 /nfs/dbraw/zinc/96/57/27/931965727.db2.gz XHAHIFLCKGONRS-MRXNPFEDSA-N 0 3 406.404 4.416 20 0 HIADHN Cc1cc(C)c(CC(C(=O)Nc2cccc(S(C)(=O)=O)c2)C(F)(F)F)c(C)c1 ZINC000533702994 931978725 /nfs/dbraw/zinc/97/87/25/931978725.db2.gz ZAWYUNHRUYCSJF-GOSISDBHSA-N 0 3 413.461 4.375 20 0 HIADHN FC(F)(F)Oc1cccc(N2CC[C@H](NCc3cnc([C@H]4CCCO4)s3)C2)c1 ZINC000533742786 932003652 /nfs/dbraw/zinc/00/36/52/932003652.db2.gz GVAIMBUNICHBCJ-SUMWQHHRSA-N 0 3 413.465 4.262 20 0 HIADHN CSc1cccc(N(C(=O)c2csc([C@@H]3CCCO3)n2)C2CCN(C)CC2)c1 ZINC000533762958 932016876 /nfs/dbraw/zinc/01/68/76/932016876.db2.gz RBHMZUXYCPCJMA-IBGZPJMESA-N 0 3 417.600 4.458 20 0 HIADHN Cc1cc(C)c(CC(C(=O)Nc2ccnc(C(=O)N(C)C)c2)C(F)(F)F)c(C)c1 ZINC000533763901 932018256 /nfs/dbraw/zinc/01/82/56/932018256.db2.gz PDDHSKRZIYQITD-KRWDZBQOSA-N 0 3 407.436 4.068 20 0 HIADHN CC(=O)c1ccc2c(c1)CCN(CCCc1nc(-c3ccc(C)c(F)c3)no1)CC2 ZINC000533766923 932021719 /nfs/dbraw/zinc/02/17/19/932021719.db2.gz LIYTZUHXQMZBSJ-UHFFFAOYSA-N 0 3 407.489 4.420 20 0 HIADHN Cc1cc(C(=O)N(Cc2ccccc2)C2CCN(C)CC2)ccc1Br ZINC000533844879 932057220 /nfs/dbraw/zinc/05/72/20/932057220.db2.gz MCMKUHIAJJHHBM-UHFFFAOYSA-N 0 3 401.348 4.494 20 0 HIADHN CN(Cc1cccc(OC(F)(F)F)c1)C(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000533944386 932117478 /nfs/dbraw/zinc/11/74/78/932117478.db2.gz KBZKWGAJJZPQSD-RBUKOAKNSA-N 0 3 407.436 4.172 20 0 HIADHN CN(Cc1ccccc1Br)C(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000533947320 932120348 /nfs/dbraw/zinc/12/03/48/932120348.db2.gz UEKMGNDGCKEEOH-OALUTQOASA-N 0 3 402.336 4.036 20 0 HIADHN CN1CC[C@H](NC(=O)N2CCC[C@H](c3nc4ccc(F)cc4o3)C2)[C@@H]1c1ccccc1 ZINC000533949292 932123816 /nfs/dbraw/zinc/12/38/16/932123816.db2.gz OFOSIICHYDDYGV-XJABCFGWSA-N 0 3 422.504 4.301 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)c2c(F)cccc2I)c1 ZINC000533967014 932142136 /nfs/dbraw/zinc/14/21/36/932142136.db2.gz FRYHMRZXMCZPFT-UHFFFAOYSA-N 0 3 412.246 4.053 20 0 HIADHN COc1ccc(-c2nc(C(=O)Nc3cc(C)cc(CN(C)C)c3)cs2)cc1OC ZINC000533968718 932144344 /nfs/dbraw/zinc/14/43/44/932144344.db2.gz KYDLHNLKSKENDS-UHFFFAOYSA-N 0 3 411.527 4.450 20 0 HIADHN CN1CC[C@H](NC(=O)C2CCN(c3nc4ccccc4s3)CC2)[C@H]1c1ccccc1 ZINC000534017961 932200260 /nfs/dbraw/zinc/20/02/60/932200260.db2.gz LTLQCZOTIPSSQI-RBBKRZOGSA-N 0 3 420.582 4.074 20 0 HIADHN CN1CC[C@@H](NC(=O)CCCc2nc(-c3ccc(Cl)cc3)no2)[C@H]1c1ccccc1 ZINC000534018138 932200307 /nfs/dbraw/zinc/20/03/07/932200307.db2.gz AZHGJKHNISDHMU-DENIHFKCSA-N 0 3 424.932 4.274 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3cc4c(cc3Cl)OCO4)c(C)c2)CC1 ZINC000534027067 932207733 /nfs/dbraw/zinc/20/77/33/932207733.db2.gz ATIYORXFRXTPHI-UHFFFAOYSA-N 0 3 416.909 4.163 20 0 HIADHN CC(C)Cn1ncc(NC(=O)N[C@@H](CN2CCCC2)c2ccccc2)c1C(F)F ZINC000534087166 932266344 /nfs/dbraw/zinc/26/63/44/932266344.db2.gz ACPRMSIJUOHLJS-SFHVURJKSA-N 0 3 405.493 4.435 20 0 HIADHN COc1cc(CNCc2ccc(CN(C)C)c(F)c2)ccc1OCc1ccncc1 ZINC000534240048 932358935 /nfs/dbraw/zinc/35/89/35/932358935.db2.gz HLTNNFPGMQTOJT-UHFFFAOYSA-N 0 3 409.505 4.160 20 0 HIADHN COc1cc(CNCc2ccc(CN(C)C)c(F)c2)ccc1OCC(F)(F)F ZINC000534241484 932359946 /nfs/dbraw/zinc/35/99/46/932359946.db2.gz IWMQXRWGQQVQLK-UHFFFAOYSA-N 0 3 400.416 4.127 20 0 HIADHN CN(CCCCCc1cc(-c2ccccc2)n[nH]1)Cc1cnc(N2CCCC2)nc1 ZINC000534344863 932387905 /nfs/dbraw/zinc/38/79/05/932387905.db2.gz VKOVLGFVHORGNS-UHFFFAOYSA-N 0 3 404.562 4.312 20 0 HIADHN Cc1cc(C)c(CC(C(=O)Nc2ccccc2OCCC(N)=O)C(F)(F)F)c(C)c1 ZINC000534389954 932413967 /nfs/dbraw/zinc/41/39/67/932413967.db2.gz QCUSGKAJQPJWMO-QGZVFWFLSA-N 0 3 422.447 4.226 20 0 HIADHN COCCn1nc(C)c(NC(=O)C(Cc2c(C)cc(C)cc2C)C(F)(F)F)c1C ZINC000534414555 932434081 /nfs/dbraw/zinc/43/40/81/932434081.db2.gz BRPMQSUNDAERLG-SFHVURJKSA-N 0 3 411.468 4.431 20 0 HIADHN C[C@H](Cc1ccc(Cl)cc1)C(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000534415670 932435253 /nfs/dbraw/zinc/43/52/53/932435253.db2.gz LEBDKFMDXJVTBJ-QGZVFWFLSA-N 0 3 400.950 4.362 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N2CCC[C@@H]2Cn2cnc3ccccc32)C1 ZINC000534449883 932464469 /nfs/dbraw/zinc/46/44/69/932464469.db2.gz SSJMGSRFTIPGAU-CEMLEFRQSA-N 0 3 417.557 4.046 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N2CCC[C@@H]2Cn2cnc3ccccc32)C1 ZINC000534449882 932465208 /nfs/dbraw/zinc/46/52/08/932465208.db2.gz SSJMGSRFTIPGAU-BAGYTPMASA-N 0 3 417.557 4.046 20 0 HIADHN Cc1cccc(N2CCN(CCCN[C@H](C)c3ncc(Br)s3)CC2)c1 ZINC000534494131 932529438 /nfs/dbraw/zinc/52/94/38/932529438.db2.gz AAUPNQCCEKYZCH-MRXNPFEDSA-N 0 3 423.424 4.077 20 0 HIADHN CC[C@H](NC(=O)NC[C@@H](c1cccc(OC)c1)N(CC)CC)c1c(C)noc1C ZINC000534518427 932542311 /nfs/dbraw/zinc/54/23/11/932542311.db2.gz TUJQIHUBAZPRMZ-PMACEKPBSA-N 0 3 402.539 4.133 20 0 HIADHN CSc1cccc(N(C(=O)c2ccc(C(=O)NC3CC3)cc2)C2CCN(C)CC2)c1 ZINC000534594082 932581424 /nfs/dbraw/zinc/58/14/24/932581424.db2.gz QSBVTIWIRJTGGB-UHFFFAOYSA-N 0 3 423.582 4.042 20 0 HIADHN CC(C)Cn1ncc(C(=O)Nc2ccc(CCN3CCSCC3)cc2)c1C(F)F ZINC000534623501 932604486 /nfs/dbraw/zinc/60/44/86/932604486.db2.gz XJMKSAAHKHLDCG-UHFFFAOYSA-N 0 3 422.545 4.320 20 0 HIADHN CN(C(=O)CCn1ccc2cc(Cl)ccc21)C1CCN(CCc2ccccn2)CC1 ZINC000534697938 932670464 /nfs/dbraw/zinc/67/04/64/932670464.db2.gz WMSQNWPHHSTRHW-UHFFFAOYSA-N 0 3 424.976 4.245 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)c2cccc(C)c2I)c1 ZINC000534699750 932671985 /nfs/dbraw/zinc/67/19/85/932671985.db2.gz DQACNOYPOBAWNW-UHFFFAOYSA-N 0 3 408.283 4.222 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)[C@@H]2C[C@H]3CCCC[C@H]3N2C(=O)c2ccccc2)c1 ZINC000534699919 932672118 /nfs/dbraw/zinc/67/21/18/932672118.db2.gz HCKVIKDLRZXGSC-JRFVFWCSSA-N 0 3 419.569 4.469 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)CSc2nncn2-c2ccc(C(C)C)cc2)c1 ZINC000534704073 932675182 /nfs/dbraw/zinc/67/51/82/932675182.db2.gz FNUGWXXVZSVUBS-UHFFFAOYSA-N 0 3 423.586 4.492 20 0 HIADHN CC(C)(CNC(=O)N1CCc2c3ccccc3[nH]c2C1)N1CCc2ccccc2C1 ZINC000534719057 932686918 /nfs/dbraw/zinc/68/69/18/932686918.db2.gz CWQUUQATPLQMMG-UHFFFAOYSA-N 0 3 402.542 4.073 20 0 HIADHN CN1CC[C@H](NC(=O)[C@@H]2C[C@H]2c2ccccc2OC(F)(F)F)[C@@H]1c1ccccc1 ZINC000534754854 932732946 /nfs/dbraw/zinc/73/29/46/932732946.db2.gz MPMGOWSWERVIKO-DMUMMCEESA-N 0 3 404.432 4.250 20 0 HIADHN Cc1c(C(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)cnn1-c1ccc(C)cc1 ZINC000535061978 932895789 /nfs/dbraw/zinc/89/57/89/932895789.db2.gz SXUVDJOGUCRMPT-UHFFFAOYSA-N 0 3 417.557 4.272 20 0 HIADHN O=C(CN1CC[C@@H](C2CCOCC2)C1)N[C@H](c1ccccc1)c1ccc(Cl)cc1 ZINC000535117690 932934296 /nfs/dbraw/zinc/93/42/96/932934296.db2.gz VIWIXDVTKANXQX-ZJSXRUAMSA-N 0 3 412.961 4.294 20 0 HIADHN CCOc1cc(CN[C@H](C)c2ccc(-n3ccnn3)cc2)ccc1OCC(F)(F)F ZINC000535186920 933002223 /nfs/dbraw/zinc/00/22/23/933002223.db2.gz VDQVATJWHTWMFW-OAHLLOKOSA-N 0 3 420.435 4.458 20 0 HIADHN Cc1cc(CNCc2ccccc2CS(=O)(=O)N2CCC(C)CC2)c(C)s1 ZINC000535200896 933010452 /nfs/dbraw/zinc/01/04/52/933010452.db2.gz KZGKBPXZWVVMTH-UHFFFAOYSA-N 0 3 406.617 4.216 20 0 HIADHN Cc1ccc(C)c(CNCc2ccccc2CS(=O)(=O)N2CCC(C)CC2)c1 ZINC000535203045 933011613 /nfs/dbraw/zinc/01/16/13/933011613.db2.gz ZJIHBSLQXNDOIR-UHFFFAOYSA-N 0 3 400.588 4.155 20 0 HIADHN CN(C)[C@H](CNC(=O)c1cccc(-c2noc(CC(C)(C)C)n2)c1)Cc1ccccc1 ZINC000535261634 933041724 /nfs/dbraw/zinc/04/17/24/933041724.db2.gz NHUSFEYNAFPNME-NRFANRHFSA-N 0 3 420.557 4.228 20 0 HIADHN CC[C@H](NC(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1)c1c(C)noc1C ZINC000535278730 933046342 /nfs/dbraw/zinc/04/63/42/933046342.db2.gz XPNYXKRAHLVSRY-FXAWDEMLSA-N 0 3 409.452 4.313 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)[C@H](C)Oc2ccc(F)cc2Br)c1 ZINC000535419034 933126997 /nfs/dbraw/zinc/12/69/97/933126997.db2.gz KLOGFULTAGAFEO-ZDUSSCGKSA-N 0 3 409.299 4.364 20 0 HIADHN CN1CC[C@H](NC(=O)CCCOc2ccccc2Br)[C@H]1c1ccccc1 ZINC000535466974 933156512 /nfs/dbraw/zinc/15/65/12/933156512.db2.gz AOVGPRIEPBIEKK-GHTZIAJQSA-N 0 3 417.347 4.170 20 0 HIADHN Cc1ccc(C(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)cc1NC(=O)c1ccco1 ZINC000535469135 933159613 /nfs/dbraw/zinc/15/96/13/933159613.db2.gz MLFNMBXULKCITB-DENIHFKCSA-N 0 3 403.482 4.016 20 0 HIADHN CC(C)c1ccc(-c2noc(CCC(=O)N[C@@H]3CCN(C)[C@H]3c3ccccc3)n2)cc1 ZINC000535470013 933160662 /nfs/dbraw/zinc/16/06/62/933160662.db2.gz RTWODNRJUZVRFX-QPPBQGQZSA-N 0 3 418.541 4.354 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2cccc3c2CN(c2nccs2)C3)N(C)C)cc1 ZINC000535477421 933169733 /nfs/dbraw/zinc/16/97/33/933169733.db2.gz VJUYBPWEVWQUQL-NRFANRHFSA-N 0 3 421.570 4.396 20 0 HIADHN OC[C@H](Cc1c[nH]c2ccccc12)N[C@@H]1CCc2c1c(Br)ccc2F ZINC000535508002 933202316 /nfs/dbraw/zinc/20/23/16/933202316.db2.gz KGBWPVHUMIFSDT-ORAYPTAESA-N 0 3 403.295 4.250 20 0 HIADHN COc1ccc(-c2nn(Cc3ccccc3)cc2CNC[C@](C)(O)C(F)(F)F)cc1 ZINC000535543311 933234358 /nfs/dbraw/zinc/23/43/58/933234358.db2.gz OJPXVNNXZUHQQX-NRFANRHFSA-N 0 3 419.447 4.010 20 0 HIADHN COc1ccc(C[C@@H](C)CN(C)C(=O)NC[C@H](c2cccs2)N2CCCC2)cc1 ZINC000535625908 933273495 /nfs/dbraw/zinc/27/34/95/933273495.db2.gz JYOSJCCPWHXYOE-WIYYLYMNSA-N 0 3 415.603 4.414 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)Nc3ccc4c(c3)nc(C3CC3)n4C)cc2)CC1 ZINC000535661455 933305676 /nfs/dbraw/zinc/30/56/76/933305676.db2.gz KDJRHLHMSYWNBW-UHFFFAOYSA-N 0 3 417.557 4.233 20 0 HIADHN NC(=O)c1ccc(CN(Cc2ccc(-n3ccc(C(F)(F)F)n3)cc2)C2CC2)cc1 ZINC000535789673 933389172 /nfs/dbraw/zinc/38/91/72/933389172.db2.gz ZZJQUVILYOOJHX-UHFFFAOYSA-N 0 3 414.431 4.155 20 0 HIADHN O=C(COc1ccccc1CN1CCC(OCC2CCCCC2)CC1)NCC1CC1 ZINC000535819177 933414152 /nfs/dbraw/zinc/41/41/52/933414152.db2.gz KLVUJYDXUFFMOD-UHFFFAOYSA-N 0 3 414.590 4.153 20 0 HIADHN CCN1CCN(c2ccccc2NCc2ccccc2OCc2cccnc2)CC1 ZINC000535846055 933427111 /nfs/dbraw/zinc/42/71/11/933427111.db2.gz VBQFBQSVWGVNPI-UHFFFAOYSA-N 0 3 402.542 4.415 20 0 HIADHN COc1ccc(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)cc1-c1ccccn1 ZINC000535861787 933445136 /nfs/dbraw/zinc/44/51/36/933445136.db2.gz QCRWAVACLFNCOQ-QHCPKHFHSA-N 0 3 401.510 4.324 20 0 HIADHN CC(C)(C)[C@@H](CN1CCc2ccccc2C1)NC(=O)c1csc([C@@H]2CCCO2)n1 ZINC000535879469 933460745 /nfs/dbraw/zinc/46/07/45/933460745.db2.gz GPUJGKKCVJHMDS-VQTJNVASSA-N 0 3 413.587 4.197 20 0 HIADHN CC(C)(C)[C@@H](CN1CCc2ccccc2C1)NC(=O)c1csc([C@H]2CCCO2)n1 ZINC000535879471 933461021 /nfs/dbraw/zinc/46/10/21/933461021.db2.gz GPUJGKKCVJHMDS-WOJBJXKFSA-N 0 3 413.587 4.197 20 0 HIADHN CNC(=O)COc1ccc(NC(=O)C(Cc2c(C)cc(C)cc2C)C(F)(F)F)cc1 ZINC000535909425 933485428 /nfs/dbraw/zinc/48/54/28/933485428.db2.gz HEXPVPHWYBITKX-LJQANCHMSA-N 0 3 422.447 4.096 20 0 HIADHN Cc1nc(C(C)C)sc1[C@H](C)N(C)C(=O)NC1CCN(CCOC(C)C)CC1 ZINC000535930271 933499282 /nfs/dbraw/zinc/49/92/82/933499282.db2.gz MYHPEXMZWLVJOJ-KRWDZBQOSA-N 0 3 410.628 4.167 20 0 HIADHN CSc1ccc(CNCc2ccccc2CS(=O)(=O)N2CCC(C)CC2)cc1 ZINC000535958022 933523744 /nfs/dbraw/zinc/52/37/44/933523744.db2.gz CYHGMWQBCNIAGS-UHFFFAOYSA-N 0 3 418.628 4.260 20 0 HIADHN CCC(CC)n1ncc(C(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)c1C ZINC000536009134 933565816 /nfs/dbraw/zinc/56/58/16/933565816.db2.gz AZSJUOHYDFBXEI-OAQYLSRUSA-N 0 3 420.561 4.448 20 0 HIADHN CCOc1cccc2cc([C@@H](C)NC(=O)NC[C@@H](Cc3ccccc3)N(C)C)oc21 ZINC000536013081 933571734 /nfs/dbraw/zinc/57/17/34/933571734.db2.gz HSNNNWRERGQDHS-YLJYHZDGSA-N 0 3 409.530 4.365 20 0 HIADHN C[C@H](CNC(=O)c1ccc(C(=O)N(C)c2ccccc2)cc1)N(C)Cc1ccccc1 ZINC000536051584 933596989 /nfs/dbraw/zinc/59/69/89/933596989.db2.gz HAEXUEJCOBSWST-HXUWFJFHSA-N 0 3 415.537 4.214 20 0 HIADHN O=C1c2ccccc2C(=O)N1[C@@H]1CCCC[C@@H](NCc2nc(C(F)(F)F)cs2)C1 ZINC000537311823 933711063 /nfs/dbraw/zinc/71/10/63/933711063.db2.gz VOEYLBBADHWDGJ-CHWSQXEVSA-N 0 3 423.460 4.249 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)c1coc(-c2ccccc2Cl)n1 ZINC000537332417 933719772 /nfs/dbraw/zinc/71/97/72/933719772.db2.gz VWMZUOKXQWODER-UHFFFAOYSA-N 0 3 419.859 4.477 20 0 HIADHN Cc1cc(C(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)nn1C1CCCCC1 ZINC000537355982 933733645 /nfs/dbraw/zinc/73/36/45/933733645.db2.gz CQXHFKBHTXHMHP-WOJBJXKFSA-N 0 3 416.610 4.048 20 0 HIADHN CCN1CCN(Cc2ccc(N[C@@H](C)c3ncc(Br)s3)cc2)CC1 ZINC000537396832 933757183 /nfs/dbraw/zinc/75/71/83/933757183.db2.gz MCMQJBFWNVWFAB-AWEZNQCLSA-N 0 3 409.397 4.216 20 0 HIADHN CCN1CCN(c2ccc(N[C@@H](C)c3cc(OC)c(OC)cc3F)c(C)c2)CC1 ZINC000537406170 933761892 /nfs/dbraw/zinc/76/18/92/933761892.db2.gz CBHPZZLCUWJZFP-KRWDZBQOSA-N 0 3 401.526 4.466 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@@H](NCc2cccc(C(=O)N[C@@H](C)CC)c2)c2ccccc21 ZINC000562758477 945117284 /nfs/dbraw/zinc/11/72/84/945117284.db2.gz SEBCGKGTSCSZBG-JJEOQYAHSA-N 0 3 408.542 4.486 20 0 HIADHN CSc1ccc([C@@H](CNC(=O)CCCc2nnc(-c3ccccc3)o2)N(C)C)cc1 ZINC000562889906 945140692 /nfs/dbraw/zinc/14/06/92/945140692.db2.gz MXBPWXWDDUXLBX-HXUWFJFHSA-N 0 3 424.570 4.200 20 0 HIADHN CCOc1cc(CN2CC[C@@](CO)(Cc3ccc(F)cc3)C2)ccc1OC(F)F ZINC000562905568 945147214 /nfs/dbraw/zinc/14/72/14/945147214.db2.gz SEQNAQZMZVPMIC-JOCHJYFZSA-N 0 3 409.448 4.253 20 0 HIADHN Cc1cc(NC(=O)N2CCCN(C(C)C)CC2)nn1-c1ccc(Cl)cc1Cl ZINC000537529209 938316662 /nfs/dbraw/zinc/31/66/62/938316662.db2.gz WINBSSOAYGKAPS-UHFFFAOYSA-N 0 3 410.349 4.436 20 0 HIADHN CSc1cccc(N(C(=O)c2cc(OCC(F)F)ccn2)C2CCN(C)CC2)c1 ZINC000537562698 938325510 /nfs/dbraw/zinc/32/55/10/938325510.db2.gz WINQQBIOYSBIKT-UHFFFAOYSA-N 0 3 421.513 4.188 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N[C@H]1CCCOc2cc(F)ccc21 ZINC000537564804 938326554 /nfs/dbraw/zinc/32/65/54/938326554.db2.gz JKWHAWALYBKRHM-ZWKOTPCHSA-N 0 3 403.523 4.237 20 0 HIADHN CC(C)N1CCN([C@H]2CCN(Cc3cc(Cl)ccc3OC3CCCC3)C2)CC1 ZINC000537660022 938348419 /nfs/dbraw/zinc/34/84/19/938348419.db2.gz ZYCBMWVXXPYCGG-NRFANRHFSA-N 0 3 406.014 4.262 20 0 HIADHN CCc1ccc(NC(=O)N2CCC[C@H](CN3CCN(c4ccccn4)CC3)C2)cc1C ZINC000537671010 938350554 /nfs/dbraw/zinc/35/05/54/938350554.db2.gz LSYYJXWNOCJSPP-OAQYLSRUSA-N 0 3 421.589 4.019 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NC1CCC(C(=O)OC(C)(C)C)CC1)c1ccsc1 ZINC000537673141 938350953 /nfs/dbraw/zinc/35/09/53/938350953.db2.gz CPLBEAZWUKQVBO-NKELODKYSA-N 0 3 423.623 4.331 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)c2ccc(-c3ccccc3)[nH]c2=O)cc1 ZINC000537728500 938364166 /nfs/dbraw/zinc/36/41/66/938364166.db2.gz PPDTWTSVISKMTP-HSZRJFAPSA-N 0 3 417.509 4.030 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)[C@H]2C[C@@H]2c2c(F)cccc2F)cc1 ZINC000537731501 938365221 /nfs/dbraw/zinc/36/52/21/938365221.db2.gz UQTYWHKUDXZTCL-WFXMLNOXSA-N 0 3 400.469 4.030 20 0 HIADHN C[C@@H](N[C@@H]1CCN(c2cnn(C)c2)C1=O)c1ccc(-c2ccc(Cl)cc2)s1 ZINC000537774084 938374057 /nfs/dbraw/zinc/37/40/57/938374057.db2.gz LNTBCAFYMZRURK-CXAGYDPISA-N 0 3 400.935 4.258 20 0 HIADHN c1c(CNc2cccc(N3CCN(CCc4ccccc4)CC3)c2)nc2ccccn12 ZINC000537777960 938374612 /nfs/dbraw/zinc/37/46/12/938374612.db2.gz ZFRXYUGSROEURZ-UHFFFAOYSA-N 0 3 411.553 4.311 20 0 HIADHN COCCn1ccc2ccc(NC(=O)NC[C@H](c3cccs3)N3CCCC3)cc21 ZINC000537799553 938378906 /nfs/dbraw/zinc/37/89/06/938378906.db2.gz ACJSEZMRCYMEAS-HXUWFJFHSA-N 0 3 412.559 4.308 20 0 HIADHN COCCn1ccc2ccc(NC(=O)N[C@H](CN3CCCC3)c3ccccc3)cc21 ZINC000537801567 938379672 /nfs/dbraw/zinc/37/96/72/938379672.db2.gz KGPGPMADJMVEOF-JOCHJYFZSA-N 0 3 406.530 4.246 20 0 HIADHN CC(C)n1ccc(C(=O)Nc2cccc(N3CCN(CCc4ccccc4)CC3)c2)n1 ZINC000537831762 938386022 /nfs/dbraw/zinc/38/60/22/938386022.db2.gz RHAKDMPUMVEOHZ-UHFFFAOYSA-N 0 3 417.557 4.081 20 0 HIADHN O=C([C@H]1CC12CCN(Cc1cccc(OCC(F)(F)F)c1)CC2)N1CCCCC1 ZINC000537846039 938389158 /nfs/dbraw/zinc/38/91/58/938389158.db2.gz HDVVVMBHDRXBOV-LJQANCHMSA-N 0 3 410.480 4.242 20 0 HIADHN COCc1cnc(CNc2cccc(N3CCN(CCc4ccccc4)CC3)c2)s1 ZINC000537870164 938395319 /nfs/dbraw/zinc/39/53/19/938395319.db2.gz RFEGGGVINBDLTH-UHFFFAOYSA-N 0 3 422.598 4.266 20 0 HIADHN CC[C@@H](NCc1ccc(S(=O)(=O)N2CCCCC2)cc1)c1ccc(OC)cc1 ZINC000537918740 938413210 /nfs/dbraw/zinc/41/32/10/938413210.db2.gz IORCILTVWCTPLZ-JOCHJYFZSA-N 0 3 402.560 4.111 20 0 HIADHN COc1cc([C@H](C)N[C@@H](C)[C@H](OC)c2ccc(Cl)cc2)ccc1S(C)(=O)=O ZINC000537969647 938439889 /nfs/dbraw/zinc/43/98/89/938439889.db2.gz JDFYKEFYSWPVRS-YRVVQQKDSA-N 0 3 411.951 4.179 20 0 HIADHN CCN(Cc1ccccc1)C(=O)CN[C@@H](C)CC(=O)Nc1ccccc1C(F)(F)F ZINC000537972478 938441735 /nfs/dbraw/zinc/44/17/35/938441735.db2.gz MEDBIOXRMSPPKF-INIZCTEOSA-N 0 3 421.463 4.061 20 0 HIADHN COc1ccc(OC)c(NC(=O)C[C@@H](C)N[C@@H]2CCCOc3ccc(F)cc32)c1 ZINC000537989827 938451513 /nfs/dbraw/zinc/45/15/13/938451513.db2.gz HCKKQFCXHWBWOH-RDTXWAMCSA-N 0 3 402.466 4.064 20 0 HIADHN C[C@@H](NCc1ccc(C(=O)N2C[C@@H](C)O[C@@H](C)C2)cc1)c1ccc(OC(F)F)cc1 ZINC000537990009 938451528 /nfs/dbraw/zinc/45/15/28/938451528.db2.gz FOAIGCRLYMCSSB-IXDOHACOSA-N 0 3 418.484 4.388 20 0 HIADHN C[C@H](NCc1ccc(C(=O)N2C[C@@H](C)O[C@@H](C)C2)cc1)c1ccc(OC(F)F)cc1 ZINC000537989996 938451841 /nfs/dbraw/zinc/45/18/41/938451841.db2.gz FOAIGCRLYMCSSB-BBWFWOEESA-N 0 3 418.484 4.388 20 0 HIADHN COc1ccc([C@@H](C)NCc2ccc(S(=O)(=O)N3CCCCC3)cc2)cc1Cl ZINC000537992624 938453955 /nfs/dbraw/zinc/45/39/55/938453955.db2.gz ZCAZDIZXPCJKLM-MRXNPFEDSA-N 0 3 422.978 4.374 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)c1ccc(-c2noc(C(F)F)n2)cc1 ZINC000538002522 938458060 /nfs/dbraw/zinc/45/80/60/938458060.db2.gz OGAKKJWDLQGGGS-SFHVURJKSA-N 0 3 412.440 4.241 20 0 HIADHN CCN1CC[C@@H](NC(=O)Nc2cccc(CN(C)C)c2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000538003516 938458920 /nfs/dbraw/zinc/45/89/20/938458920.db2.gz ZQEZEQLQKROWJZ-RTWAWAEBSA-N 0 3 418.944 4.498 20 0 HIADHN CCN1CC[C@H](NC(=O)Nc2cccc(CN(C)C)c2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000538003511 938458941 /nfs/dbraw/zinc/45/89/41/938458941.db2.gz ZQEZEQLQKROWJZ-LEWJYISDSA-N 0 3 418.944 4.498 20 0 HIADHN COc1ccc([C@@H](C)NCc2n[nH]c(-c3ccc(Br)cc3)n2)cc1F ZINC000538017264 938463499 /nfs/dbraw/zinc/46/34/99/938463499.db2.gz BIHSJCTYXDONOS-LLVKDONJSA-N 0 3 405.271 4.233 20 0 HIADHN COc1ccc([C@@H](C)NCc2nc(-c3ccc(Br)cc3)n[nH]2)cc1F ZINC000538017264 938463502 /nfs/dbraw/zinc/46/35/02/938463502.db2.gz BIHSJCTYXDONOS-LLVKDONJSA-N 0 3 405.271 4.233 20 0 HIADHN COc1ccc(CN(C(=O)NC[C@H]2CCCCN2C2CC2)[C@H](C)C2CC2)c(OC)c1 ZINC000563320632 945178230 /nfs/dbraw/zinc/17/82/30/945178230.db2.gz QNSJWJBCIRUHLX-DYESRHJHSA-N 0 3 415.578 4.031 20 0 HIADHN CN1CC[C@H](NC(=O)N[C@@H]2CCO[C@H]2c2ccc(Cl)c(F)c2)[C@@H]1c1ccccc1 ZINC000538043134 938479166 /nfs/dbraw/zinc/47/91/66/938479166.db2.gz BGOZXQGVQMEOCQ-WOZUAGRISA-N 0 3 417.912 4.054 20 0 HIADHN Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)N[C@H](C)c1ccc(S(N)(=O)=O)cc1 ZINC000538101025 938502210 /nfs/dbraw/zinc/50/22/10/938502210.db2.gz ZRZMWXCCGREQEE-CABCVRRESA-N 0 3 415.584 4.486 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)N[C@@H]1CCO[C@@H]1c1ccc(Cl)c(F)c1 ZINC000538116090 938506330 /nfs/dbraw/zinc/50/63/30/938506330.db2.gz IEUYTJKNRYDLMQ-NHCUHLMSSA-N 0 3 419.928 4.083 20 0 HIADHN CC(C)[C@H](NCc1ccc(Br)cc1N1CCOCC1)c1cccnc1 ZINC000538117759 938506897 /nfs/dbraw/zinc/50/68/97/938506897.db2.gz UYTAHGUYTKXPQG-FQEVSTJZSA-N 0 3 404.352 4.168 20 0 HIADHN CC[C@H](NCC(=O)N1CCC[C@@H]1c1ccc(OC)c(OC)c1)c1ccc(OC)cc1 ZINC000538141368 938518252 /nfs/dbraw/zinc/51/82/52/938518252.db2.gz NGYLUNFYCZGCTQ-LEWJYISDSA-N 0 3 412.530 4.117 20 0 HIADHN COc1cc2c(cc1F)CC[C@@H]2N[C@H]1CCCN([C@@H](C)c2ccccc2F)C1=O ZINC000563325412 945182087 /nfs/dbraw/zinc/18/20/87/945182087.db2.gz HUIPFOQMEWPRPT-WVFSVQOHSA-N 0 3 400.469 4.303 20 0 HIADHN CC[C@H](NCC(=O)N1c2ccccc2NC(=O)C[C@H]1C(F)(F)F)c1ccc(C)cc1 ZINC000538155051 938526030 /nfs/dbraw/zinc/52/60/30/938526030.db2.gz IVJAYXXNKWGLSZ-LPHOPBHVSA-N 0 3 419.447 4.342 20 0 HIADHN Cc1ccccc1-n1nccc1NC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C ZINC000538158315 938528255 /nfs/dbraw/zinc/52/82/55/938528255.db2.gz SYKVLNGWBZMNLU-HXUWFJFHSA-N 0 3 403.530 4.309 20 0 HIADHN CCC[C@H](NCC(=O)Nc1ccc(C(=O)N(C)C)cc1)c1cccc(C(F)(F)F)c1 ZINC000538161249 938530249 /nfs/dbraw/zinc/53/02/49/938530249.db2.gz LWQSCCHAKVUCGS-IBGZPJMESA-N 0 3 421.463 4.477 20 0 HIADHN COc1ccc([C@@H](Cc2ccccc2C)NCC(=O)N2CCC[C@@H](C)C2)cc1OC ZINC000538174900 938535986 /nfs/dbraw/zinc/53/59/86/938535986.db2.gz HRHUCNVKAIXUTG-XMSQKQJNSA-N 0 3 410.558 4.144 20 0 HIADHN COc1ccc([C@H](Cc2ccccc2C)NCC(=O)N2CCC(C)CC2)cc1OC ZINC000538175893 938536589 /nfs/dbraw/zinc/53/65/89/938536589.db2.gz UZSYIYXTOSJANO-QFIPXVFZSA-N 0 3 410.558 4.144 20 0 HIADHN Cc1cccc([C@H](C)NCC(=O)Nc2ccccc2I)c1C ZINC000538187089 938542868 /nfs/dbraw/zinc/54/28/68/938542868.db2.gz DKNTUFSESHWPBC-AWEZNQCLSA-N 0 3 408.283 4.197 20 0 HIADHN C[C@@H](N[C@H](C)c1cccc(-n2cccn2)c1)C(=O)N(C)Cc1c(F)cccc1Cl ZINC000538187393 938543520 /nfs/dbraw/zinc/54/35/20/938543520.db2.gz HBYRMTBQXZYGNC-HZPDHXFCSA-N 0 3 414.912 4.363 20 0 HIADHN CCOc1ccc([C@@H]2CCCN2C(=O)CN[C@@H](c2ccccc2)[C@H]2CCOC2)cc1 ZINC000538189560 938545581 /nfs/dbraw/zinc/54/55/81/938545581.db2.gz GFJJFVHDVYLPGD-RSEQLOHWSA-N 0 3 408.542 4.116 20 0 HIADHN COc1ccc(CN(C)C(=O)CN[C@H](c2ccc(Cl)cc2)C2CCC2)cc1OC ZINC000538206562 938554485 /nfs/dbraw/zinc/55/44/85/938554485.db2.gz QYNZIYPLZGLSQS-QHCPKHFHSA-N 0 3 416.949 4.447 20 0 HIADHN Clc1ccc2c(c1)OCCC[C@H]2NCc1cccc(OCCN2CCOCC2)c1 ZINC000538206205 938554669 /nfs/dbraw/zinc/55/46/69/938554669.db2.gz HYLVYIYDMCVKAH-JOCHJYFZSA-N 0 3 416.949 4.055 20 0 HIADHN C[C@H](NC[C@H](O)COc1cc(Cl)ccc1Cl)c1cccc(N2CCCC2=O)c1 ZINC000538208481 938555838 /nfs/dbraw/zinc/55/58/38/938555838.db2.gz QAZBIPMEYVSONN-KSSFIOAISA-N 0 3 423.340 4.211 20 0 HIADHN CSc1cccc(NC(=O)NCCCCN2CCN(c3ccccc3)CC2)c1C ZINC000538212618 938558063 /nfs/dbraw/zinc/55/80/63/938558063.db2.gz QHGSBBGRQFXBIB-UHFFFAOYSA-N 0 3 412.603 4.441 20 0 HIADHN COc1cc(Cl)c(C)cc1NC(=O)CN[C@H](C[C@H]1CCOC1)c1ccccc1 ZINC000538225786 938565094 /nfs/dbraw/zinc/56/50/94/938565094.db2.gz WLMQNZOMDIFXLY-VQIMIIECSA-N 0 3 402.922 4.353 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(-n2cccn2)cc1)C(=O)Nc1ccc(OC(F)(F)F)cc1 ZINC000538236159 938569412 /nfs/dbraw/zinc/56/94/12/938569412.db2.gz YJXPHJCUGMUCFJ-LSDHHAIUSA-N 0 3 418.419 4.449 20 0 HIADHN CC[C@H]1Oc2cc([C@@H](C)NCc3ccc4oc(C(=O)OC)cc4c3)ccc2NC1=O ZINC000538258466 938576703 /nfs/dbraw/zinc/57/67/03/938576703.db2.gz YXIDGQWYMIAWJB-FZKQIMNGSA-N 0 3 408.454 4.180 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)N[C@H](C)C(=O)Nc2ccccc2OC(F)F)cc1 ZINC000538262287 938577809 /nfs/dbraw/zinc/57/78/09/938577809.db2.gz QXKRFOIGXNNREP-HUUCEWRRSA-N 0 3 414.456 4.460 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)NCC(=O)Nc2nc3ccc(F)cc3s2)cc1 ZINC000538268037 938579390 /nfs/dbraw/zinc/57/93/90/938579390.db2.gz ACSVNLKAAGDAIQ-ZDUSSCGKSA-N 0 3 409.490 4.219 20 0 HIADHN CN(C)CCn1c2cc(NC(=O)CCCc3ccc4ccccc4c3)ccc2oc1=O ZINC000538295434 938585597 /nfs/dbraw/zinc/58/55/97/938585597.db2.gz MBAOBROJQYAVKT-UHFFFAOYSA-N 0 3 417.509 4.271 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@@H](C)N[C@@H](c2ccc(F)c(C)c2)C2CC2)cc1OC ZINC000538323121 938592523 /nfs/dbraw/zinc/59/25/23/938592523.db2.gz JWHZKQSBSMUERC-WAIKUNEKSA-N 0 3 414.521 4.239 20 0 HIADHN COc1ccc(OC)c([C@H](C)NC(=O)CN[C@H](c2ccc(F)c(C)c2)C2CC2)c1 ZINC000538324536 938592963 /nfs/dbraw/zinc/59/29/63/938592963.db2.gz VXDYDQSDCBUQKL-WNSKOXEYSA-N 0 3 400.494 4.069 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)Nc2cc(SC)ccc2C)CC1 ZINC000538325183 938593141 /nfs/dbraw/zinc/59/31/41/938593141.db2.gz QGLSRHMAJQWNQK-UHFFFAOYSA-N 0 3 412.603 4.176 20 0 HIADHN COc1ccc(C[C@@H](NCc2c(C)nc3sc(C)nn23)c2ccccc2)cc1OC ZINC000538393293 938610031 /nfs/dbraw/zinc/61/00/31/938610031.db2.gz TUZDUKAHTRWECP-LJQANCHMSA-N 0 3 422.554 4.498 20 0 HIADHN COc1ccc([C@H](C)N[C@@H](CO)Cc2c[nH]c3ccccc23)c(Br)c1 ZINC000538395504 938610610 /nfs/dbraw/zinc/61/06/10/938610610.db2.gz FIQHBDKQGQZIDK-DZGCQCFKSA-N 0 3 403.320 4.193 20 0 HIADHN COc1ccc([C@@H](C)N[C@@H](CO)Cc2c[nH]c3ccccc23)c(Br)c1 ZINC000538395506 938610787 /nfs/dbraw/zinc/61/07/87/938610787.db2.gz FIQHBDKQGQZIDK-UKRRQHHQSA-N 0 3 403.320 4.193 20 0 HIADHN Cc1nn(C(C)(C)C)c(C)c1CN[C@H](C)CC(=O)Nc1cccc(N2CCCC2)c1 ZINC000538395692 938610799 /nfs/dbraw/zinc/61/07/99/938610799.db2.gz LAKJMDWYEIULGJ-QGZVFWFLSA-N 0 3 411.594 4.362 20 0 HIADHN COc1cc2c(c(CN[C@H](C)[C@@H](OC3CCOCC3)c3ccccc3)c1)O[C@H](C)C2 ZINC000538422154 938616956 /nfs/dbraw/zinc/61/69/56/938616956.db2.gz JLMILOAYJOEQSD-QZTZHPFYSA-N 0 3 411.542 4.434 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N[C@H]1C[C@@H]2CCC(C)(C)c3cccc1c32 ZINC000538483788 938632091 /nfs/dbraw/zinc/63/20/91/938632091.db2.gz COGLODPAINKRRV-AVRDEDQJSA-N 0 3 419.569 4.411 20 0 HIADHN CCN1CCN(c2ccc(N[C@@H](C)c3ccc(NC(C)=O)cc3OC)c(C)c2)CC1 ZINC000538508767 938638092 /nfs/dbraw/zinc/63/80/92/938638092.db2.gz CIDNZQDUWZVMCQ-SFHVURJKSA-N 0 3 410.562 4.277 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CCc2cc(OC)c(F)cc2C1)c1ccsc1 ZINC000538517113 938639666 /nfs/dbraw/zinc/63/96/66/938639666.db2.gz IKVDXBAHKZKORK-IBGZPJMESA-N 0 3 405.539 4.047 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N(C)Cc1cc(F)c(F)c(F)c1)c1cccc(OC)c1 ZINC000538516863 938639712 /nfs/dbraw/zinc/63/97/12/938639712.db2.gz UIPZQYDPEJKVRE-FQEVSTJZSA-N 0 3 423.479 4.337 20 0 HIADHN CC(=O)c1ccc(C(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)c(F)c1 ZINC000538544494 938645727 /nfs/dbraw/zinc/64/57/27/938645727.db2.gz NRDMRSVPTKYZFW-HXUWFJFHSA-N 0 3 420.488 4.233 20 0 HIADHN C[C@@H](CC(=O)NC1CCN(CCc2ccccc2)CC1)C(=O)c1ccc(Cl)cc1 ZINC000538587818 938656070 /nfs/dbraw/zinc/65/60/70/938656070.db2.gz HPUKJKYXSFPHCO-SFHVURJKSA-N 0 3 412.961 4.372 20 0 HIADHN Cc1ccc(NC(=O)CN[C@@H]2CCN(C(C)C)[C@@H]2c2ccc(F)c(F)c2)c(C)c1 ZINC000563472880 945194395 /nfs/dbraw/zinc/19/43/95/945194395.db2.gz UEFVJMOWLHLGBB-FYYLOGMGSA-N 0 3 401.501 4.334 20 0 HIADHN COc1ccc([C@H](C)Nc2ccc3c(c2)C(=O)N(C)CC3)cc1CN1CCCCC1 ZINC000538640496 938670228 /nfs/dbraw/zinc/67/02/28/938670228.db2.gz OLDACTKURDBNPB-SFHVURJKSA-N 0 3 407.558 4.482 20 0 HIADHN Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)C(=O)N(CCN1CCCC1)c1ccccc1 ZINC000538670857 938681152 /nfs/dbraw/zinc/68/11/52/938681152.db2.gz NYVRUSZNDBMGND-MRXNPFEDSA-N 0 3 422.495 4.295 20 0 HIADHN Cc1nn(-c2ccc(Br)cc2)cc1CN1CCC(c2c[nH]cn2)CC1 ZINC000538726166 938693621 /nfs/dbraw/zinc/69/36/21/938693621.db2.gz AKZGKIAUGIBBPG-UHFFFAOYSA-N 0 3 400.324 4.046 20 0 HIADHN Cc1ccc(-c2n[nH]cc2CN2CCC(n3cc(Br)cn3)CC2)cc1 ZINC000538730849 938695061 /nfs/dbraw/zinc/69/50/61/938695061.db2.gz VSGCIUNDRGWKRW-UHFFFAOYSA-N 0 3 400.324 4.181 20 0 HIADHN CCN(CC(F)(F)F)C(=O)[C@H]1CCCN(Cc2c(F)cccc2N2CCCC2)C1 ZINC000538750887 938701251 /nfs/dbraw/zinc/70/12/51/938701251.db2.gz FFQMXMDYWOIPNX-INIZCTEOSA-N 0 3 415.475 4.049 20 0 HIADHN CCN(CC(F)(F)F)C(=O)[C@@H]1CCCN(Cc2cnc(C3CCCC3)s2)C1 ZINC000538752349 938702515 /nfs/dbraw/zinc/70/25/15/938702515.db2.gz BOSSTNLBMQZLTJ-OAHLLOKOSA-N 0 3 403.514 4.424 20 0 HIADHN CN(C)CCN(Cc1cccc(O)c1)C(=O)c1cc2ccc(C(F)(F)F)cc2[nH]1 ZINC000538764351 938704656 /nfs/dbraw/zinc/70/46/56/938704656.db2.gz BFJIHMIMORFIDK-UHFFFAOYSA-N 0 3 405.420 4.096 20 0 HIADHN COc1cc(OC)c(OC)cc1CN1CCC[C@H](c2nc3ccc(F)cc3o2)C1 ZINC000538796795 938714611 /nfs/dbraw/zinc/71/46/11/938714611.db2.gz VDEFMBYTGNAZKE-AWEZNQCLSA-N 0 3 400.450 4.372 20 0 HIADHN COc1ccc(CN(C(=O)N[C@H]2C[C@@H](C)N(C3CC3)C2)C2CCCCC2)cc1OC ZINC000538811767 938718933 /nfs/dbraw/zinc/71/89/33/938718933.db2.gz FMHJFSFTGOVXKQ-MJGOQNOKSA-N 0 3 415.578 4.173 20 0 HIADHN COc1ccc(CN(C(=O)N[C@@H]2C[C@H](C)N(C3CC3)C2)C2CCCCC2)cc1OC ZINC000538811768 938719081 /nfs/dbraw/zinc/71/90/81/938719081.db2.gz FMHJFSFTGOVXKQ-PKOBYXMFSA-N 0 3 415.578 4.173 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)Cc2cccc(C(F)(F)F)c2)cc1 ZINC000538830949 938721746 /nfs/dbraw/zinc/72/17/46/938721746.db2.gz ZAQUOFHUJOPCDR-FQEVSTJZSA-N 0 3 406.448 4.210 20 0 HIADHN COCCn1ccc2ccc(NC(=O)N[C@@H]3C[C@H](C)N(Cc4ccccc4)C3)cc21 ZINC000538903149 938734515 /nfs/dbraw/zinc/73/45/15/938734515.db2.gz SYYPTWJCNRHLHI-PGRDOPGGSA-N 0 3 406.530 4.072 20 0 HIADHN O=C(CCN1CC[C@H](Oc2ccc(C(F)(F)F)cn2)C1)Nc1ccccc1Cl ZINC000538955801 938748456 /nfs/dbraw/zinc/74/84/56/938748456.db2.gz NFIZAHAEFBVPHH-AWEZNQCLSA-N 0 3 413.827 4.236 20 0 HIADHN O=C(CCN1CC[C@@H](Oc2ccc(C(F)(F)F)cn2)C1)Nc1ccccc1Cl ZINC000538955802 938748532 /nfs/dbraw/zinc/74/85/32/938748532.db2.gz NFIZAHAEFBVPHH-CQSZACIVSA-N 0 3 413.827 4.236 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)c1ccnc(OC2CCCCC2)c1 ZINC000539034558 938775493 /nfs/dbraw/zinc/77/54/93/938775493.db2.gz GVUVDSRSPBBVNW-UHFFFAOYSA-N 0 3 409.530 4.002 20 0 HIADHN CC(C)c1ccc([C@H](C)NCc2ccc(S(=O)(=O)NC[C@H]3CCCO3)cc2)cc1 ZINC000539041335 938778643 /nfs/dbraw/zinc/77/86/43/938778643.db2.gz MAFJJDGZCIBRNQ-PGRDOPGGSA-N 0 3 416.587 4.118 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(S(=O)(=O)C2CCCC2)cc1)c1ccc(-n2ccnn2)cc1 ZINC000539043750 938780625 /nfs/dbraw/zinc/78/06/25/938780625.db2.gz QIXWOCZQQXSQOH-MSOLQXFVSA-N 0 3 424.570 4.395 20 0 HIADHN CC(=O)N1CC[C@H](N[C@@H](C)c2ccc(I)cc2)c2ccccc21 ZINC000539050835 938783045 /nfs/dbraw/zinc/78/30/45/938783045.db2.gz QRCOWKVGWHTBKH-UGSOOPFHSA-N 0 3 420.294 4.440 20 0 HIADHN Cc1c([C@H](C)NCCCc2ccccn2)nnn1-c1cccc(Br)c1 ZINC000539062976 938788463 /nfs/dbraw/zinc/78/84/63/938788463.db2.gz MTSWWVITTMPFHU-AWEZNQCLSA-N 0 3 400.324 4.017 20 0 HIADHN Cc1c([C@@H](C)NCCCc2ccccn2)nnn1-c1cccc(Br)c1 ZINC000539062977 938788652 /nfs/dbraw/zinc/78/86/52/938788652.db2.gz MTSWWVITTMPFHU-CQSZACIVSA-N 0 3 400.324 4.017 20 0 HIADHN Ic1ccc2c(c1)[C@H](NCc1ccc3c(c1)COC3)CCCO2 ZINC000539067600 938791246 /nfs/dbraw/zinc/79/12/46/938791246.db2.gz XPEZDPLEZLHRCO-GOSISDBHSA-N 0 3 421.278 4.325 20 0 HIADHN C[C@H](N[C@@H](C)[C@@H](c1ccccc1)N1CCOCC1)c1nc(-c2ccncc2)cs1 ZINC000539070183 938793154 /nfs/dbraw/zinc/79/31/54/938793154.db2.gz IFDFTHQOJOACPE-SPEDKVCISA-N 0 3 408.571 4.318 20 0 HIADHN COc1ccc([C@H](CN[C@H](C)c2ccc(F)cc2OC(F)F)N(C)C)cc1OC ZINC000539074435 938794624 /nfs/dbraw/zinc/79/46/24/938794624.db2.gz OWDLKRNWWLYCOU-DYVFJYSZSA-N 0 3 412.452 4.398 20 0 HIADHN CC(C)(C)CC(=O)N1CCC(N[C@H](C(=O)Nc2ccccc2)c2ccccc2)CC1 ZINC000539074790 938794709 /nfs/dbraw/zinc/79/47/09/938794709.db2.gz DCXDFNBILQYVDW-QHCPKHFHSA-N 0 3 407.558 4.383 20 0 HIADHN COc1ccc(C[C@H](NC[C@@H](O)[C@@H]2CCOC2)c2cc(Cl)ccc2Cl)cc1 ZINC000539073578 938794905 /nfs/dbraw/zinc/79/49/05/938794905.db2.gz OEIICTBKZRGBQA-GQWLDOHISA-N 0 3 410.341 4.273 20 0 HIADHN Cc1c([C@@H](C)NCCNC(=O)c2c(F)cccc2F)cnn1-c1cccc(Cl)c1 ZINC000539079429 938797631 /nfs/dbraw/zinc/79/76/31/938797631.db2.gz TTZULEYZRNVLQV-CYBMUJFWSA-N 0 3 418.875 4.193 20 0 HIADHN COC(=O)COc1cccc(CN[C@H]2CCc3c2cc(Cl)cc3Br)c1 ZINC000539084277 938798745 /nfs/dbraw/zinc/79/87/45/938798745.db2.gz NLHDQHZBNMLKBS-SFHVURJKSA-N 0 3 424.722 4.431 20 0 HIADHN CCc1nc2c(s1)[C@H](NCc1ccc(C(=O)N3C[C@H](C)O[C@@H](C)C3)cc1)CCC2 ZINC000539091681 938801454 /nfs/dbraw/zinc/80/14/54/938801454.db2.gz JNAYLXLIJVKXAL-TXPKVOOTSA-N 0 3 413.587 4.122 20 0 HIADHN C[C@H](CC(=O)Nc1cccc(C(F)(F)F)c1)NCc1nc(-c2ccc(F)cc2)n[nH]1 ZINC000539120559 938805641 /nfs/dbraw/zinc/80/56/41/938805641.db2.gz BEWFPUBYAUOXRU-GFCCVEGCSA-N 0 3 421.398 4.137 20 0 HIADHN CS(=O)(=O)Cc1ccccc1CN[C@@H]1CCCc2ccc(Br)cc21 ZINC000539121454 938806060 /nfs/dbraw/zinc/80/60/60/938806060.db2.gz UPZSZKFFEUGPHY-LJQANCHMSA-N 0 3 408.361 4.161 20 0 HIADHN COc1cc(CN[C@@H](c2ccc(Cl)c(Cl)c2)C2CC2)ccc1OCC(N)=O ZINC000539217719 938820224 /nfs/dbraw/zinc/82/02/24/938820224.db2.gz ZZHNGGUWAFZUEM-HXUWFJFHSA-N 0 3 409.313 4.107 20 0 HIADHN OC1(Cc2ccc(F)cc2F)C[C@H]2CC[C@@H](C1)N2Cc1cnn(-c2ccccc2)c1 ZINC000539219785 938820550 /nfs/dbraw/zinc/82/05/50/938820550.db2.gz QYLPDMVCTFEXIF-RIKCKFAHSA-N 0 3 409.480 4.251 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(OCc2cccnc2)cc1)C(=O)N1CCc2sccc2C1 ZINC000539226381 938821744 /nfs/dbraw/zinc/82/17/44/938821744.db2.gz NGFGRVCUKNSWOM-ROUUACIJSA-N 0 3 421.566 4.346 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@H](C)N[C@H](C)c2cccc(OC(C)C)c2)cc1OC ZINC000539226125 938821845 /nfs/dbraw/zinc/82/18/45/938821845.db2.gz LFTUCWDVGSWSQQ-MSOLQXFVSA-N 0 3 414.546 4.189 20 0 HIADHN COc1ccc(C[C@@H](NCc2cccc(C(=O)N(C)C)c2)c2ccccc2)cc1OC ZINC000539253797 938827134 /nfs/dbraw/zinc/82/71/34/938827134.db2.gz ZINKYUHOAVCRCI-HSZRJFAPSA-N 0 3 418.537 4.479 20 0 HIADHN CC[C@@H](NCCOC1CCCCCC1)c1ccccc1OCC(=O)N1CCCC1 ZINC000539254936 938827500 /nfs/dbraw/zinc/82/75/00/938827500.db2.gz DHTIHOYOZIFSGQ-JOCHJYFZSA-N 0 3 402.579 4.468 20 0 HIADHN COc1ccc(C[C@H](NCC(=O)N(C)c2ccccc2)c2ccccc2)cc1OC ZINC000539259284 938828512 /nfs/dbraw/zinc/82/85/12/938828512.db2.gz ONYWRJDWKUWPMR-QFIPXVFZSA-N 0 3 404.510 4.240 20 0 HIADHN C[C@@H](NCC(=O)Nc1ccc(OC(F)F)c(Cl)c1)c1cccc(-n2cccn2)c1 ZINC000539286822 938833816 /nfs/dbraw/zinc/83/38/16/938833816.db2.gz OLAJUBKMOHJVAZ-CYBMUJFWSA-N 0 3 420.847 4.416 20 0 HIADHN C[C@H](N[C@@H](C)c1cccc(-n2cccn2)c1)C(=O)Nc1ccc(OC(F)F)cc1 ZINC000539289794 938834546 /nfs/dbraw/zinc/83/45/46/938834546.db2.gz QKEJLFQNMHTKEO-GJZGRUSLSA-N 0 3 400.429 4.152 20 0 HIADHN O=C(CN[C@H](c1ccccc1)[C@H]1CCOC1)N[C@@H](c1cccs1)c1ccc(F)cc1 ZINC000539297589 938835916 /nfs/dbraw/zinc/83/59/16/938835916.db2.gz HGKAKKNBWISVKQ-WUMKDDEVSA-N 0 3 424.541 4.460 20 0 HIADHN CC(C)(C)[C@H](NCC(=O)NCC(=O)c1cccs1)c1cccc(C(F)(F)F)c1 ZINC000539302015 938837074 /nfs/dbraw/zinc/83/70/74/938837074.db2.gz WUPZNHNQXQNOBX-GOSISDBHSA-N 0 3 412.477 4.443 20 0 HIADHN C[C@H](NCC(=O)N(Cc1nnc(-c2ccccc2Cl)o1)C1CC1)c1ccccc1 ZINC000539305737 938837714 /nfs/dbraw/zinc/83/77/14/938837714.db2.gz OAXGIUZHIILBEC-HNNXBMFYSA-N 0 3 410.905 4.232 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3c(F)cc(Cl)cc3F)CC2)C[C@H](C)O1 ZINC000539320480 938840834 /nfs/dbraw/zinc/84/08/34/938840834.db2.gz LHCAZUBACJRFGL-OKILXGFUSA-N 0 3 415.912 4.361 20 0 HIADHN COCCOc1cccc(CNC(=O)CNC2(c3cccc(Cl)c3)CCCC2)c1 ZINC000539324843 938841313 /nfs/dbraw/zinc/84/13/13/938841313.db2.gz JXUNYEVSDFRABD-UHFFFAOYSA-N 0 3 416.949 4.041 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(-n2ccnn2)cc1)C(=O)Nc1ccc(Cl)cc1Cl ZINC000539328952 938842525 /nfs/dbraw/zinc/84/25/25/938842525.db2.gz UDCMJLKIYVSPJJ-STQMWFEESA-N 0 3 404.301 4.252 20 0 HIADHN Cc1cccc([C@H](NCC(=O)NCc2ccc(C(=O)N3CCCC3)cc2)C(C)(C)C)c1 ZINC000539335579 938843833 /nfs/dbraw/zinc/84/38/33/938843833.db2.gz HJINXTLSOHSRGZ-DEOSSOPVSA-N 0 3 421.585 4.224 20 0 HIADHN C[C@H](NCC(=O)N(C)CCOc1ccccc1F)c1ccc(-c2ccncc2)cc1 ZINC000539337563 938844425 /nfs/dbraw/zinc/84/44/25/938844425.db2.gz CIGJGDBIYUTJRX-SFHVURJKSA-N 0 3 407.489 4.076 20 0 HIADHN Cc1cc(Br)ccc1NC(=O)CN[C@H](C)c1ccc(-n2cccn2)cc1 ZINC000539338525 938844686 /nfs/dbraw/zinc/84/46/86/938844686.db2.gz DDKONCKLLKZFNB-OAHLLOKOSA-N 0 3 413.319 4.233 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)N[C@@H](C)C(=O)Nc2nc3ccccc3s2)cc1 ZINC000539363604 938849167 /nfs/dbraw/zinc/84/91/67/938849167.db2.gz PYIPCZICRSAIQU-CABCVRRESA-N 0 3 405.527 4.468 20 0 HIADHN Cn1cc(CN2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)c(C(C)(C)C)n1 ZINC000539381753 938852048 /nfs/dbraw/zinc/85/20/48/938852048.db2.gz QPVSYSFJDTYCBH-UHFFFAOYSA-N 0 3 406.933 4.361 20 0 HIADHN CC(C)c1nn(-c2ccc(Br)cc2)cc1CN[C@H](C)Cn1ccnc1 ZINC000539446589 938861936 /nfs/dbraw/zinc/86/19/36/938861936.db2.gz IKSRWHLMQHCSLS-OAHLLOKOSA-N 0 3 402.340 4.133 20 0 HIADHN COc1cc(CN[C@H](c2cccc(F)c2)C(C)(C)C)cc(Cl)c1OCC(N)=O ZINC000539489359 938867633 /nfs/dbraw/zinc/86/76/33/938867633.db2.gz XVPDSCYEIGFVBU-HXUWFJFHSA-N 0 3 408.901 4.229 20 0 HIADHN Cc1ccc(NC(=O)[C@@H](C)N[C@@H](c2ccc3c(c2)OCCO3)C2CC2)c(Cl)c1 ZINC000539492368 938868004 /nfs/dbraw/zinc/86/80/04/938868004.db2.gz RLUZCMAHLGLZLL-SPLOXXLWSA-N 0 3 400.906 4.488 20 0 HIADHN CCOc1cccc2cc([C@@H](C)N[C@H](CN3CCN(C)CC3)c3ccccc3)oc21 ZINC000539497796 938868880 /nfs/dbraw/zinc/86/88/80/938868880.db2.gz YETUQIJTBBWBEP-DENIHFKCSA-N 0 3 407.558 4.471 20 0 HIADHN CCCC[C@@H](NCc1ccc2c(c1)ncn2C)C(=O)Nc1cccc(N2CCCC2)c1 ZINC000539498433 938868920 /nfs/dbraw/zinc/86/89/20/938868920.db2.gz GBUJSFRECPAILI-JOCHJYFZSA-N 0 3 419.573 4.461 20 0 HIADHN COc1cccc2cc([C@H](C)NCc3ccc(CS(=O)(=O)NC(C)C)cc3)oc21 ZINC000539499188 938869110 /nfs/dbraw/zinc/86/91/10/938869110.db2.gz CHPNURMAFVKYRF-INIZCTEOSA-N 0 3 416.543 4.120 20 0 HIADHN CCOC(=O)COc1ccc(CNC2(c3ccc(Cl)cc3)CCOCC2)cc1 ZINC000539499633 938869264 /nfs/dbraw/zinc/86/92/64/938869264.db2.gz YRLVUYYVGNZSDM-UHFFFAOYSA-N 0 3 403.906 4.077 20 0 HIADHN NC(=O)c1csc(CNCc2ccccc2-c2ccc(Cn3cccn3)cc2)c1 ZINC000539500296 938869517 /nfs/dbraw/zinc/86/95/17/938869517.db2.gz YPBHTVAXFZPGGA-UHFFFAOYSA-N 0 3 402.523 4.049 20 0 HIADHN CCOC(=O)COc1ccc(CN[C@H]2CCc3c2cccc3Br)cc1 ZINC000539504018 938869909 /nfs/dbraw/zinc/86/99/09/938869909.db2.gz ODWSJPKVKADYDV-IBGZPJMESA-N 0 3 404.304 4.168 20 0 HIADHN COc1ccc([C@H](C)NCCCNC(=O)c2cccc(F)c2)c(Br)c1 ZINC000539507678 938870394 /nfs/dbraw/zinc/87/03/94/938870394.db2.gz XXBGCFGTTZFSEF-ZDUSSCGKSA-N 0 3 409.299 4.068 20 0 HIADHN CC[C@H](N[C@@H](C)Cn1ncc2ccccc2c1=O)c1cc(F)cc(Br)c1 ZINC000539507085 938870531 /nfs/dbraw/zinc/87/05/31/938870531.db2.gz CCPWATYMHLHNON-DJJJIMSYSA-N 0 3 418.310 4.428 20 0 HIADHN CO[C@@H](c1ccc(Br)cc1)[C@H](C)NCc1c(C)nc2sc(C)nn12 ZINC000539545548 938877393 /nfs/dbraw/zinc/87/73/93/938877393.db2.gz VDVSCNRNZQIFJR-MEDUHNTESA-N 0 3 409.353 4.036 20 0 HIADHN CCN(CC)CCN(C(=O)[C@H]1CCC(=O)C[C@H]1C)c1cccc(Br)c1 ZINC000539546858 938877663 /nfs/dbraw/zinc/87/76/63/938877663.db2.gz XKOCWKLDHCXXND-BEFAXECRSA-N 0 3 409.368 4.129 20 0 HIADHN CC(C)c1cccc(-c2ccc(C(=O)N3CC[C@H](N4CCN(C)CC4)[C@H](C)C3)o2)c1 ZINC000539590332 938884475 /nfs/dbraw/zinc/88/44/75/938884475.db2.gz CELGBGMEKQHVRN-KNQAVFIVSA-N 0 3 409.574 4.168 20 0 HIADHN Cc1cc(C(=O)Nc2cccc(CN3CCC(CO)CC3)c2)nn1C1CCCCC1 ZINC000539627507 938889925 /nfs/dbraw/zinc/88/99/25/938889925.db2.gz UGLDCZOWDSKNJO-UHFFFAOYSA-N 0 3 410.562 4.153 20 0 HIADHN COc1ccc(OC)c(NC(=O)C[C@@H](C)NC2(c3ccc(F)cc3F)CCC2)c1 ZINC000539646485 938893254 /nfs/dbraw/zinc/89/32/54/938893254.db2.gz RUPMWPUIGGOZGP-CQSZACIVSA-N 0 3 404.457 4.368 20 0 HIADHN C[C@H](NC1(c2cccc(Br)c2)CC1)c1ccc(NS(C)(=O)=O)cc1 ZINC000539652849 938894432 /nfs/dbraw/zinc/89/44/32/938894432.db2.gz FHODQICABQDYKX-ZDUSSCGKSA-N 0 3 409.349 4.161 20 0 HIADHN Cc1cccn2cc(COc3ccc(CNc4cc(CN(C)C)ccn4)cc3)nc12 ZINC000539710567 938908625 /nfs/dbraw/zinc/90/86/25/938908625.db2.gz TYRLLOUJYADGPS-UHFFFAOYSA-N 0 3 401.514 4.290 20 0 HIADHN C[C@@H](c1nc(-c2cccnc2)no1)N1CCC[C@@H](c2nc(C3CCCCC3)n[nH]2)C1 ZINC000539764270 938928811 /nfs/dbraw/zinc/92/88/11/938928811.db2.gz BMEMLFDMYHPQPN-MAUKXSAKSA-N 0 3 407.522 4.238 20 0 HIADHN C[C@@H](c1nc(-c2cccnc2)no1)N1CCC[C@@H](c2n[nH]c(C3CCCCC3)n2)C1 ZINC000539764270 938928817 /nfs/dbraw/zinc/92/88/17/938928817.db2.gz BMEMLFDMYHPQPN-MAUKXSAKSA-N 0 3 407.522 4.238 20 0 HIADHN Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)C(=O)N(CCN(C)C)Cc1cccc(C)c1 ZINC000539790611 938935429 /nfs/dbraw/zinc/93/54/29/938935429.db2.gz PCGUJVNMPLEUNQ-MRXNPFEDSA-N 0 3 424.511 4.065 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](NCCCCn2ccnc2)c2ccc(Cl)cc2)c1 ZINC000539809394 938939650 /nfs/dbraw/zinc/93/96/50/938939650.db2.gz NDIURIWHWJBHHM-OAQYLSRUSA-N 0 3 417.962 4.099 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](NCC(C2CC2)C2CC2)c2ccc(F)cc2F)c1 ZINC000539812744 938940250 /nfs/dbraw/zinc/94/02/50/938940250.db2.gz IMCQOKIKMPHHRU-QFIPXVFZSA-N 0 3 405.510 4.484 20 0 HIADHN COC(=O)[C@H]1CC12CCN(Cc1cn(C(C)(C)C)nc1-c1cccc(OC)c1)CC2 ZINC000539827631 938947904 /nfs/dbraw/zinc/94/79/04/938947904.db2.gz NVHLKSYIJDWTGJ-HXUWFJFHSA-N 0 3 411.546 4.089 20 0 HIADHN COc1ccc(CN2CCC[C@@H](CNC(=O)C(C)(C)C)C2)cc1OCCC(C)C ZINC000539832630 938951738 /nfs/dbraw/zinc/95/17/38/938951738.db2.gz RJHQZNFENPRVGQ-FQEVSTJZSA-N 0 3 404.595 4.494 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(C)c1CN1CCC(OC[C@H]2CCCCO2)CC1 ZINC000539863101 938960354 /nfs/dbraw/zinc/96/03/54/938960354.db2.gz HQWLPNGLVZVFFY-JOCHJYFZSA-N 0 3 401.526 4.178 20 0 HIADHN CC(C)(C)OC(=O)C1CCC(NCc2cn(-c3ccc(F)cc3Cl)nn2)CC1 ZINC000539881150 938964999 /nfs/dbraw/zinc/96/49/99/938964999.db2.gz QOCGFRHWBMXMBP-UHFFFAOYSA-N 0 3 408.905 4.050 20 0 HIADHN CCCN1CCN(c2ccccc2CN(C)Cc2nc([C@H](C)SCC)no2)CC1 ZINC000539899311 938971922 /nfs/dbraw/zinc/97/19/22/938971922.db2.gz DLUCAUXVWSVIGQ-SFHVURJKSA-N 0 3 417.623 4.048 20 0 HIADHN COCCc1nc(C)c([C@H](C)NC[C@@H](O)COc2cccc(Cl)c2Cl)s1 ZINC000539968385 938982348 /nfs/dbraw/zinc/98/23/48/938982348.db2.gz SPKTZRSTJIRAPP-WCQYABFASA-N 0 3 419.374 4.038 20 0 HIADHN COCCC[C@@H](NCc1cccnc1-n1cccn1)c1ccc(Br)cc1 ZINC000539969533 938982424 /nfs/dbraw/zinc/98/24/24/938982424.db2.gz NPQLOMYWGIXANW-LJQANCHMSA-N 0 3 415.335 4.287 20 0 HIADHN CCn1c2cc(Br)ccc2nc1NC(=O)c1cccc(CN(C)C)c1 ZINC000540014037 939039257 /nfs/dbraw/zinc/03/92/57/939039257.db2.gz VQOWAGPLZLTIJF-UHFFFAOYSA-N 0 3 401.308 4.133 20 0 HIADHN Brc1cc(CN[C@@H](c2ccccc2)[C@@H]2CCOC2)cc2c1OCCCO2 ZINC000540067906 939057513 /nfs/dbraw/zinc/05/75/13/939057513.db2.gz DNGMEVNZJSZDCM-XLIONFOSSA-N 0 3 418.331 4.478 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)Nc2ccc3[nH]c(C(F)F)nc3c2)c1 ZINC000540082608 939063651 /nfs/dbraw/zinc/06/36/51/939063651.db2.gz BREBYSLVFLMRKL-UHFFFAOYSA-N 0 3 401.461 4.405 20 0 HIADHN C[C@H](NCc1ccc(S(=O)(=O)N2CCCC2)cc1)c1ccc(-c2ccncc2)cc1 ZINC000540119360 939079887 /nfs/dbraw/zinc/07/98/87/939079887.db2.gz UIHKCJDIHKXNQV-IBGZPJMESA-N 0 3 421.566 4.384 20 0 HIADHN Cc1c([C@H](C)N[C@H]2CCO[C@@H](C(C)C)C2)nnn1-c1cccc(Br)c1 ZINC000540137379 939086489 /nfs/dbraw/zinc/08/64/89/939086489.db2.gz BRUYMESWROAOCH-QANKJYHBSA-N 0 3 407.356 4.192 20 0 HIADHN COc1ccc([C@@H](NC2CCN(Cc3ccncc3)CC2)c2ccccc2OC)cc1 ZINC000540146499 939090845 /nfs/dbraw/zinc/09/08/45/939090845.db2.gz GJJVYTIRHLWYSV-AREMUKBSSA-N 0 3 417.553 4.442 20 0 HIADHN Cc1nn(C)cc1[C@@H](C)NCCOc1ccc(Br)cc1C(F)(F)F ZINC000540165588 939098622 /nfs/dbraw/zinc/09/86/22/939098622.db2.gz TWOIDCKOLVSLIV-SNVBAGLBSA-N 0 3 406.246 4.239 20 0 HIADHN Cc1nc(-c2cccnc2)sc1[C@@H](C)NCc1cccc(CN2CCCC2=O)c1 ZINC000540167030 939099911 /nfs/dbraw/zinc/09/99/11/939099911.db2.gz XZMTZCJNMAAFGD-MRXNPFEDSA-N 0 3 406.555 4.487 20 0 HIADHN COc1ccc([C@H](C)N[C@@H](C)c2ccc(-n3cncn3)cc2)cc1Br ZINC000540191216 939116262 /nfs/dbraw/zinc/11/62/62/939116262.db2.gz MYGJZCIZICMCQB-KBPBESRZSA-N 0 3 401.308 4.450 20 0 HIADHN CCN1CC[C@H](NCc2cc(OC)c(OC)cc2OC)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000540203534 939125271 /nfs/dbraw/zinc/12/52/71/939125271.db2.gz JAIKSUDODIVCHR-AVRDEDQJSA-N 0 3 422.928 4.430 20 0 HIADHN COc1ccccc1[C@@H](NCc1ccc(C(=O)N2CCN(C)CC2)cc1)C1CCCC1 ZINC000540264032 939177513 /nfs/dbraw/zinc/17/75/13/939177513.db2.gz AIAIPVKKSJQGOY-VWLOTQADSA-N 0 3 421.585 4.104 20 0 HIADHN C[C@H]1CCCN(S(=O)(=O)c2ccc(CN[C@H]3CCCNc4ccccc43)cc2)C1 ZINC000563647932 945233074 /nfs/dbraw/zinc/23/30/74/945233074.db2.gz CBZPJZSYRBTPJB-MBSDFSHPSA-N 0 3 413.587 4.144 20 0 HIADHN Cc1n[nH]c(C)c1[C@@H]1CCCN1C(=O)NC[C@H](c1cccs1)N1CCC(C)CC1 ZINC000540293280 939185038 /nfs/dbraw/zinc/18/50/38/939185038.db2.gz TXEMAIVWDIEEJD-RBUKOAKNSA-N 0 3 415.607 4.408 20 0 HIADHN Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)N[C@H](C)c1ccc(S(N)(=O)=O)cc1 ZINC000540300004 939186972 /nfs/dbraw/zinc/18/69/72/939186972.db2.gz GIXHOZJLTMTWMB-OLZOCXBDSA-N 0 3 419.547 4.317 20 0 HIADHN CC(C)[C@H](NCC(=O)N1CCC(Cc2ccccc2)CC1)c1ccc2[nH]c(=O)oc2c1 ZINC000540314747 939191076 /nfs/dbraw/zinc/19/10/76/939191076.db2.gz WRCHSKOIUOGFMK-DEOSSOPVSA-N 0 3 421.541 4.301 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc(CN[C@H](c2ccc(F)c(C)c2)C2CC2)cc1 ZINC000540315429 939191235 /nfs/dbraw/zinc/19/12/35/939191235.db2.gz GEXNNBOQIFNRFA-QFIPXVFZSA-N 0 3 404.551 4.406 20 0 HIADHN CC[C@H](CS(=O)(=O)c1ccccc1)N[C@H]1CCc2c1cccc2Br ZINC000540314801 939191311 /nfs/dbraw/zinc/19/13/11/939191311.db2.gz YTLGCTHZDHYULN-KUHUBIRLSA-N 0 3 408.361 4.279 20 0 HIADHN CN(CCN[C@H](c1cccc(C(F)(F)F)c1)C1CC1)S(=O)(=O)c1cccs1 ZINC000540317086 939191917 /nfs/dbraw/zinc/19/19/17/939191917.db2.gz ZLAIAEVBYUZVCA-KRWDZBQOSA-N 0 3 418.506 4.128 20 0 HIADHN Cc1ccsc1[C@H](Cc1ccccc1)N[C@H](C)c1cccc(S(N)(=O)=O)c1 ZINC000540320481 939193805 /nfs/dbraw/zinc/19/38/05/939193805.db2.gz LLKRUHOWNNLMLE-UZLBHIALSA-N 0 3 400.569 4.339 20 0 HIADHN CC[C@@H](NCC(=O)N1CCC(C(=O)N2CCCCCC2)CC1)c1cccc(Cl)c1 ZINC000540328698 939196375 /nfs/dbraw/zinc/19/63/75/939196375.db2.gz POYFBHRNVHVZFD-OAQYLSRUSA-N 0 3 419.997 4.022 20 0 HIADHN CC[C@H](N[C@H](C)C(=O)N[C@H](C)c1cc(OC)ccc1OC)c1ccc(OC)cc1 ZINC000540343372 939200616 /nfs/dbraw/zinc/20/06/16/939200616.db2.gz SGJGVPQBIPGDCP-ZOCZFRKYSA-N 0 3 400.519 4.019 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)N1CCc2ccccc2C1)c1cccc(OCc2ccccn2)c1 ZINC000540353637 939204916 /nfs/dbraw/zinc/20/49/16/939204916.db2.gz ZECWUDOAPCDIJT-UXHICEINSA-N 0 3 415.537 4.285 20 0 HIADHN CC(C)(C)C[C@@H](NCC(=O)NCc1ccccc1CN1CCCC1=O)c1ccccc1 ZINC000540381337 939220645 /nfs/dbraw/zinc/22/06/45/939220645.db2.gz UAUURULCXMROCA-HSZRJFAPSA-N 0 3 421.585 4.192 20 0 HIADHN CC[C@H](C)[C@H](NCC(=O)Nc1ccc(C(=O)N(C)C)cc1)c1ccc(Cl)cc1 ZINC000540387293 939223116 /nfs/dbraw/zinc/22/31/16/939223116.db2.gz VQABBSOWEUVAEC-BTYIYWSLSA-N 0 3 401.938 4.357 20 0 HIADHN C[C@@H](NCC(=O)NCc1ccccc1OC1CCCC1)c1cccc(-n2cccn2)c1 ZINC000540385747 939223128 /nfs/dbraw/zinc/22/31/28/939223128.db2.gz GXWFYNLMGSMTAT-LJQANCHMSA-N 0 3 418.541 4.161 20 0 HIADHN O=C(CN[C@H](c1ccccc1)[C@H]1CCOC1)NCC1(c2ccc(F)cc2)CCCC1 ZINC000540389659 939226796 /nfs/dbraw/zinc/22/67/96/939226796.db2.gz GQYNZTHHXNUGMZ-GBXCKJPGSA-N 0 3 410.533 4.121 20 0 HIADHN Cc1cc(C)cc([C@H](C)NCC(=O)N2c3ccccc3NC(=O)C[C@H]2C(F)(F)F)c1 ZINC000540410427 939238678 /nfs/dbraw/zinc/23/86/78/939238678.db2.gz XZMXJFFGWUPFGI-KXBFYZLASA-N 0 3 419.447 4.260 20 0 HIADHN CC[C@@H](C)[C@@H](NCC(=O)N1CCC(C(=O)N(C)C(C)C)CC1)c1ccc(Cl)cc1 ZINC000540411029 939239108 /nfs/dbraw/zinc/23/91/08/939239108.db2.gz JIYBGEMLWBSCCD-VGOFRKELSA-N 0 3 422.013 4.122 20 0 HIADHN COc1cccc(OC)c1OC[C@@H](O)CN[C@H](c1ccc(F)cc1F)C(C)(C)C ZINC000540425989 939244736 /nfs/dbraw/zinc/24/47/36/939244736.db2.gz PXWHBADSONOORZ-YCRPNKLZSA-N 0 3 409.473 4.099 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)Nc1ccc(Cl)c(Cl)c1)c1ccc(-n2ccnn2)cc1 ZINC000540431856 939246126 /nfs/dbraw/zinc/24/61/26/939246126.db2.gz GWIRGWBXGLSQLW-OLZOCXBDSA-N 0 3 404.301 4.252 20 0 HIADHN O=C(CN[C@@H](C[C@@H]1CCOC1)c1ccccc1)N(Cc1ccccc1)CC(F)(F)F ZINC000540434787 939247232 /nfs/dbraw/zinc/24/72/32/939247232.db2.gz ULPSVNUQPHKWAL-FPOVZHCZSA-N 0 3 420.475 4.335 20 0 HIADHN O=C(CN[C@@H](C[C@H]1CCOC1)c1ccccc1)NCCc1cccc(Cl)c1Cl ZINC000540433901 939247260 /nfs/dbraw/zinc/24/72/60/939247260.db2.gz AXNSHOABSHEKJR-UZLBHIALSA-N 0 3 421.368 4.410 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(-n2cccn2)cc1)C(=O)Nc1ccc(Br)cc1 ZINC000540434956 939247635 /nfs/dbraw/zinc/24/76/35/939247635.db2.gz KPVXWOKVBPTDDU-HUUCEWRRSA-N 0 3 413.319 4.313 20 0 HIADHN CN(Cc1c(F)cccc1Cl)C(=O)CN[C@@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000540433874 939247682 /nfs/dbraw/zinc/24/76/82/939247682.db2.gz AAIRSLQGDKPWBN-KKSFZXQISA-N 0 3 404.913 4.195 20 0 HIADHN Cc1cccc([C@H](NCC(=O)NCc2ccccc2CN2CCCC2=O)C(C)(C)C)c1 ZINC000540437251 939248737 /nfs/dbraw/zinc/24/87/37/939248737.db2.gz ZBHDMOUHKWRYCV-VWLOTQADSA-N 0 3 421.585 4.111 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(-c2ccncc2)cc1)C(=O)N[C@@H]1CCOc2ccccc21 ZINC000540440707 939251052 /nfs/dbraw/zinc/25/10/52/939251052.db2.gz ZOMJLBNDOPLHGA-IUKKYPGJSA-N 0 3 401.510 4.428 20 0 HIADHN CC[C@@H]1Oc2cc([C@@H](C)NCc3ccc(-n4nc(C)cc4C)cc3)ccc2NC1=O ZINC000540457923 939259468 /nfs/dbraw/zinc/25/94/68/939259468.db2.gz KCEWTVBKDJYQKP-VGSWGCGISA-N 0 3 404.514 4.449 20 0 HIADHN CC[C@H](N[C@H](C)c1ccc(OC(F)(F)F)cc1)c1cccc(S(N)(=O)=O)c1 ZINC000540464237 939262726 /nfs/dbraw/zinc/26/27/26/939262726.db2.gz ONVGBVIXNJHEEK-PXAZEXFGSA-N 0 3 402.438 4.035 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)N[C@H](C)C(=O)NCCc2c[nH]c3ccccc23)cc1 ZINC000540468455 939264877 /nfs/dbraw/zinc/26/48/77/939264877.db2.gz PCBCTSXERPPGAT-ZWKOTPCHSA-N 0 3 415.541 4.060 20 0 HIADHN C[C@@H](CCO)C1(CNC(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)CCC1 ZINC000540492943 939273166 /nfs/dbraw/zinc/27/31/66/939273166.db2.gz QZHPWTHVEIJEGZ-OALUTQOASA-N 0 3 407.624 4.009 20 0 HIADHN CC[C@@H](NCc1nc2cc(S(=O)(=O)CC)ccc2o1)C(C)(C)c1ccccc1 ZINC000540521034 939285837 /nfs/dbraw/zinc/28/58/37/939285837.db2.gz KLHNZROTYLENIQ-HXUWFJFHSA-N 0 3 400.544 4.467 20 0 HIADHN O=c1ccccn1Cc1ccc(CNCc2c[nH]nc2-c2cccc(Cl)c2)cc1 ZINC000540583877 939310910 /nfs/dbraw/zinc/31/09/10/939310910.db2.gz LGQXHKSMBUBPBR-UHFFFAOYSA-N 0 3 404.901 4.230 20 0 HIADHN Cc1ccccc1[C@H](NCC(=O)N1CCC[C@@H]1c1ccc2c(c1)OCCO2)C1CC1 ZINC000540588854 939312311 /nfs/dbraw/zinc/31/23/11/939312311.db2.gz JOKBTRQCKQQYET-PXDATVDWSA-N 0 3 406.526 4.171 20 0 HIADHN CCc1ccccc1NC(=O)CN(C)C(=O)[C@@H](C)N[C@@H](c1ccccc1C)C1CC1 ZINC000540591736 939313161 /nfs/dbraw/zinc/31/31/61/939313161.db2.gz YECYYXYELQBBBR-HOYKHHGWSA-N 0 3 407.558 4.084 20 0 HIADHN COc1nc2ccccc2cc1CN[C@@H](C)CC(=O)Nc1cccc(N2CCCC2)c1 ZINC000540593245 939313696 /nfs/dbraw/zinc/31/36/96/939313696.db2.gz DTHJTWMVIIQYSL-SFHVURJKSA-N 0 3 418.541 4.351 20 0 HIADHN Cc1c([C@@H](C)NCC2([C@H](C)CCO)CCC2)nnn1-c1cccc(Br)c1 ZINC000540607777 939318034 /nfs/dbraw/zinc/31/80/34/939318034.db2.gz MMEGLOXMCSGEDJ-HUUCEWRRSA-N 0 3 421.383 4.178 20 0 HIADHN CC(C)N1CC[C@H](NCc2cnc(N3CCCC3)nc2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000540716596 939346785 /nfs/dbraw/zinc/34/67/85/939346785.db2.gz AGKLWGJXVXKQAU-SFTDATJTSA-N 0 3 417.960 4.183 20 0 HIADHN CNS(=O)(=O)c1ccc([C@H](C)NC2(c3ccc(Br)cc3)CCC2)cc1 ZINC000540723790 939349860 /nfs/dbraw/zinc/34/98/60/939349860.db2.gz LNWSSOOAIBCHNB-AWEZNQCLSA-N 0 3 423.376 4.087 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)c2cc(C)ccc2SC2CCCC2)CC1 ZINC000540725993 939350023 /nfs/dbraw/zinc/35/00/23/939350023.db2.gz KMBFNPJSSKAWCP-IBGZPJMESA-N 0 3 403.636 4.033 20 0 HIADHN Cc1cc(C(=O)NC[C@H]2CCCN(Cc3cccs3)C2)nn1-c1ccc(F)cc1 ZINC000540784980 939371320 /nfs/dbraw/zinc/37/13/20/939371320.db2.gz RJUJKSPPTSDBOK-QGZVFWFLSA-N 0 3 412.534 4.023 20 0 HIADHN COc1ccc(C2(C(=O)N[C@@H]3CCN(C)[C@@H]3c3ccccc3)CCCC2)cc1OC ZINC000540805473 939378363 /nfs/dbraw/zinc/37/83/63/939378363.db2.gz RCMASRWDPPPEKQ-NFBKMPQASA-N 0 3 408.542 4.077 20 0 HIADHN CCOc1cc(CN[C@@H]2C=C[C@H](CO)C2)ccc1OCc1c(F)cccc1Cl ZINC000540807093 939378655 /nfs/dbraw/zinc/37/86/55/939378655.db2.gz PPSORWXIBVAZMB-DLBZAZTESA-N 0 3 405.897 4.483 20 0 HIADHN Cc1nc([C@@H]2CCCN([C@@H](C)c3nnc(-c4ccc(Cl)c(Cl)c4)o3)C2)n[nH]1 ZINC000540862517 939400486 /nfs/dbraw/zinc/40/04/86/939400486.db2.gz QXBJSAZHLPVBJO-GXFFZTMASA-N 0 3 407.305 4.411 20 0 HIADHN Cc1n[nH]c([C@@H]2CCCN([C@@H](C)c3nnc(-c4ccc(Cl)c(Cl)c4)o3)C2)n1 ZINC000540862517 939400489 /nfs/dbraw/zinc/40/04/89/939400489.db2.gz QXBJSAZHLPVBJO-GXFFZTMASA-N 0 3 407.305 4.411 20 0 HIADHN Cc1nnc([C@@H]2CCCN([C@@H](C)c3nnc(-c4ccc(Cl)c(Cl)c4)o3)C2)[nH]1 ZINC000540862517 939400491 /nfs/dbraw/zinc/40/04/91/939400491.db2.gz QXBJSAZHLPVBJO-GXFFZTMASA-N 0 3 407.305 4.411 20 0 HIADHN C[C@H](C(=O)N1CCc2ccccc2C1)N1CCC[C@H](c2nc(C3CCCCC3)n[nH]2)C1 ZINC000540866489 939403734 /nfs/dbraw/zinc/40/37/34/939403734.db2.gz VHQOERYZLVJPTQ-GCJKJVERSA-N 0 3 421.589 4.005 20 0 HIADHN Cc1nc(-c2ccc(F)c(F)c2)sc1C(=O)NCc1ccccc1CN(C)C ZINC000540871225 939405272 /nfs/dbraw/zinc/40/52/72/939405272.db2.gz BCKVZSUCPXFLBA-UHFFFAOYSA-N 0 3 401.482 4.388 20 0 HIADHN Cc1ccc([C@H](NCCc2ccc3c(c2)OCO3)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000540915677 939416891 /nfs/dbraw/zinc/41/68/91/939416891.db2.gz PEPTYEIDGQBBEV-DEOSSOPVSA-N 0 3 423.534 4.049 20 0 HIADHN Cc1nn(-c2ccccc2)cc1NC(=O)N(CCN(C)C)Cc1ccc(F)cc1F ZINC000540980552 939424462 /nfs/dbraw/zinc/42/44/62/939424462.db2.gz ORSOBNNOFFKRJF-UHFFFAOYSA-N 0 3 413.472 4.055 20 0 HIADHN COc1cc(CN[C@H](C)c2ccc(NC(C)=O)cc2)cc(Br)c1OC ZINC000540988100 939425828 /nfs/dbraw/zinc/42/58/28/939425828.db2.gz GERPINQTNBCDAJ-GFCCVEGCSA-N 0 3 407.308 4.276 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)NCC(=O)NCc2ccccc2COC(C)C)cc1 ZINC000541029405 939435795 /nfs/dbraw/zinc/43/57/95/939435795.db2.gz ZOKSQKJROUQQQB-LJQANCHMSA-N 0 3 420.557 4.073 20 0 HIADHN CCN(Cc1ccc(S(=O)(=O)C(C)C)cc1)CC1CCN(c2ccccn2)CC1 ZINC000541055765 939443715 /nfs/dbraw/zinc/44/37/15/939443715.db2.gz BTFVBSUGXVKYTQ-UHFFFAOYSA-N 0 3 415.603 4.002 20 0 HIADHN O=C(CCN1CCC[C@H](n2ccc(C(F)(F)F)n2)C1)Nc1ccc(Cl)cc1F ZINC000541086436 939455197 /nfs/dbraw/zinc/45/51/97/939455197.db2.gz PABUWQURJPHDJU-ZDUSSCGKSA-N 0 3 418.822 4.360 20 0 HIADHN CCN(C[C@H]1CCN(Cc2ccccc2)C1)c1nn2cc(-c3cccnc3)nc2s1 ZINC000541113259 939464318 /nfs/dbraw/zinc/46/43/18/939464318.db2.gz XEIUZHWWWCHZMX-IBGZPJMESA-N 0 3 418.570 4.201 20 0 HIADHN CN(C)[C@@H](CNC(=O)N1CCO[C@H](c2ccc(C(F)(F)F)cc2)C1)c1ccccc1 ZINC000541153100 939478101 /nfs/dbraw/zinc/47/81/01/939478101.db2.gz CJABMQVRWSMDBI-PMACEKPBSA-N 0 3 421.463 4.091 20 0 HIADHN O[C@H](CN[C@@H](Cc1ccc(Cl)cc1)c1ccccn1)COCc1ccccc1F ZINC000541194782 939485083 /nfs/dbraw/zinc/48/50/83/939485083.db2.gz VMPNDQHNKFJOKN-OFNKIYASSA-N 0 3 414.908 4.325 20 0 HIADHN O[C@@H](CN[C@@H](Cc1ccc(Cl)cc1)c1ccccn1)COCc1ccccc1F ZINC000541194784 939485134 /nfs/dbraw/zinc/48/51/34/939485134.db2.gz VMPNDQHNKFJOKN-REWPJTCUSA-N 0 3 414.908 4.325 20 0 HIADHN CC[C@@H](N[C@@H](CC)c1ccc(Br)cc1)c1cccc(S(N)(=O)=O)c1 ZINC000541204627 939485463 /nfs/dbraw/zinc/48/54/63/939485463.db2.gz AKVGWDZWXQFJPR-ZWKOTPCHSA-N 0 3 411.365 4.289 20 0 HIADHN CC[C@H](N[C@H]1CCCN(Cc2nccn2C)C1=O)c1ccc(Oc2ccccc2)cc1 ZINC000541228901 939486625 /nfs/dbraw/zinc/48/66/25/939486625.db2.gz JFWAIVAANWJUKJ-GOTSBHOMSA-N 0 3 418.541 4.444 20 0 HIADHN CCOc1ccc(C(C)(C)C(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1OCC ZINC000541231415 939486766 /nfs/dbraw/zinc/48/67/66/939486766.db2.gz WDOVXNBAAYCQJX-NRFANRHFSA-N 0 3 410.558 4.152 20 0 HIADHN CC(C)Cn1cc(CNCc2ccccc2-c2ccc(Cn3cncn3)cc2)cn1 ZINC000541255004 939487877 /nfs/dbraw/zinc/48/78/77/939487877.db2.gz LEHRUBFTVZKSBD-UHFFFAOYSA-N 0 3 400.530 4.136 20 0 HIADHN CS(=O)(=O)Cc1ccccc1CN[C@@H]1CCCc2c(Br)cccc21 ZINC000541257790 939488057 /nfs/dbraw/zinc/48/80/57/939488057.db2.gz KSCKCXGAWMJVTG-LJQANCHMSA-N 0 3 408.361 4.161 20 0 HIADHN NC(=O)[C@H](Cc1ccc(C(F)(F)F)cc1)N[C@@H]1C[C@@H]1c1ccccc1C(F)(F)F ZINC000541307688 939490368 /nfs/dbraw/zinc/49/03/68/939490368.db2.gz PKGAMXSOQSPRMV-OIISXLGYSA-N 0 3 416.365 4.266 20 0 HIADHN NC(=O)[C@H](Cc1ccc(C(F)(F)F)cc1)N[C@H]1C[C@H]1c1ccccc1C(F)(F)F ZINC000541307692 939490391 /nfs/dbraw/zinc/49/03/91/939490391.db2.gz PKGAMXSOQSPRMV-XIRDDKMYSA-N 0 3 416.365 4.266 20 0 HIADHN CC(=O)NC1CCC(N(C)CC(=O)N2CCC[C@@H]2c2ccc(C(C)(C)C)cc2)CC1 ZINC000541319115 939490685 /nfs/dbraw/zinc/49/06/85/939490685.db2.gz JNSCABLFMIKRTA-XPPIMPSXSA-N 0 3 413.606 4.027 20 0 HIADHN Cc1ccc([C@H]2CCN(C(=O)NCCCCN3CCN(c4ccccc4)CC3)C2)cc1 ZINC000541338804 939492383 /nfs/dbraw/zinc/49/23/83/939492383.db2.gz XGCOKWKXYWWSRZ-DEOSSOPVSA-N 0 3 420.601 4.096 20 0 HIADHN COc1cccc([C@@H]2[C@@H](c3ccccc3)CCN2C(=O)N[C@H]2CCN(C3CC3)C2)c1 ZINC000541342965 939493040 /nfs/dbraw/zinc/49/30/40/939493040.db2.gz HEGFTYHAFLKNOC-TUACAJSNSA-N 0 3 405.542 4.172 20 0 HIADHN COc1ccc(Oc2ccc(CN3CCC(C(=O)NCC(F)(F)F)CC3)cc2)cc1 ZINC000541533720 939546030 /nfs/dbraw/zinc/54/60/30/939546030.db2.gz AMALUQGBQVTLEN-UHFFFAOYSA-N 0 3 422.447 4.378 20 0 HIADHN Fc1ccc([C@H](NCC2(N3CCSCC3)CCCCC2)c2cnccn2)cc1 ZINC000541542862 939548706 /nfs/dbraw/zinc/54/87/06/939548706.db2.gz BCCCFKMUYZJKHD-NRFANRHFSA-N 0 3 400.567 4.046 20 0 HIADHN NC(=O)C1CCN(C[C@@H](NCc2cccc(Cl)c2)c2ccc(Cl)cc2)CC1 ZINC000541547789 939550890 /nfs/dbraw/zinc/55/08/90/939550890.db2.gz VQYCRHRYPDWLCG-HXUWFJFHSA-N 0 3 406.357 4.022 20 0 HIADHN CCOc1cc(CN[C@@H](CN2CCOCC2)c2ccccc2C)ccc1OC(F)F ZINC000541548314 939551709 /nfs/dbraw/zinc/55/17/09/939551709.db2.gz BIOHFZZJYPZSNQ-FQEVSTJZSA-N 0 3 420.500 4.158 20 0 HIADHN CC(C)c1ccc(CN[C@H](CN2CCC(C(N)=O)CC2)c2ccc(Cl)cc2)cc1 ZINC000541550466 939552654 /nfs/dbraw/zinc/55/26/54/939552654.db2.gz ZLKWYDQCXDTJBG-HSZRJFAPSA-N 0 3 413.993 4.492 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)c2ccc(Sc3ccc(Cl)cc3)o2)CC1 ZINC000541575140 939558971 /nfs/dbraw/zinc/55/89/71/939558971.db2.gz UJFSUZSZGFXDLM-MRXNPFEDSA-N 0 3 421.994 4.088 20 0 HIADHN Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)NC[C@H](O)COc1c(C)ccc(C)c1C ZINC000541600639 939564353 /nfs/dbraw/zinc/56/43/53/939564353.db2.gz OWLLGDKWRGIFCJ-YJBOKZPZSA-N 0 3 413.484 4.078 20 0 HIADHN COc1cc(-c2noc(CN[C@@H](C)[C@@H](C)C3CCCCC3)n2)cc(OC)c1OC ZINC000541600312 939564955 /nfs/dbraw/zinc/56/49/55/939564955.db2.gz CTHXUHDLLADASD-CABCVRRESA-N 0 3 403.523 4.457 20 0 HIADHN CC(C)NS(=O)(=O)Cc1ccccc1CN[C@@H](C)c1ccc(OC(C)C)cc1 ZINC000563702414 945258038 /nfs/dbraw/zinc/25/80/38/945258038.db2.gz JTKBCYWLDBVYRR-SFHVURJKSA-N 0 3 404.576 4.152 20 0 HIADHN COC[C@@H](NCC(=O)N(Cc1ccccc1)c1nc2c(ccc(C)c2C)s1)C1CC1 ZINC000541617508 939572218 /nfs/dbraw/zinc/57/22/18/939572218.db2.gz OMMSBBHXWUHLCZ-HXUWFJFHSA-N 0 3 423.582 4.461 20 0 HIADHN CC(C)C[C@H](NCC(=O)NCC1(c2ccccc2)CCOCC1)c1cccs1 ZINC000541625771 939574424 /nfs/dbraw/zinc/57/44/24/939574424.db2.gz KMNDKGPIJZHGSA-FQEVSTJZSA-N 0 3 400.588 4.290 20 0 HIADHN C[C@@H](NCC(=O)Nc1nnc(-c2ccco2)o1)[C@H](C)c1ccccc1C(F)(F)F ZINC000541637252 939579669 /nfs/dbraw/zinc/57/96/69/939579669.db2.gz QTXBIZUGPWOYKZ-NWDGAFQWSA-N 0 3 408.380 4.069 20 0 HIADHN Cc1cccc(Cc2cnc(NC(=O)CN[C@H](C)[C@@H]3COc4ccccc43)s2)c1 ZINC000541694671 939606801 /nfs/dbraw/zinc/60/68/01/939606801.db2.gz HQSWETRDLXCZCP-UZLBHIALSA-N 0 3 407.539 4.135 20 0 HIADHN Cc1cccc(Cc2cnc(NC(=O)CN[C@@H](C)[C@@H]3COc4ccccc43)s2)c1 ZINC000541694668 939606824 /nfs/dbraw/zinc/60/68/24/939606824.db2.gz HQSWETRDLXCZCP-JXFKEZNVSA-N 0 3 407.539 4.135 20 0 HIADHN CCCCSc1ccc(Cl)cc1C(=O)N1CC[C@H](N2CCN(C)CC2)[C@H](C)C1 ZINC000541720491 939614138 /nfs/dbraw/zinc/61/41/38/939614138.db2.gz LSDUMGVLSPONJS-XLIONFOSSA-N 0 3 424.054 4.330 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(N[C@@H](c2ccn(C)n2)c2ccc(Cl)cc2)CC1 ZINC000541779542 939628520 /nfs/dbraw/zinc/62/85/20/939628520.db2.gz WOQRQGYYJNCEHC-GAJHUEQPSA-N 0 3 409.965 4.373 20 0 HIADHN COc1ccccc1[C@H](C)NC(=O)[C@H](C)N[C@H](C)c1ccc(-n2ccnc2C)cc1 ZINC000541955962 939661900 /nfs/dbraw/zinc/66/19/00/939661900.db2.gz YYMIDHOUOAWRJP-SQNIBIBYSA-N 0 3 406.530 4.106 20 0 HIADHN CC(C)[C@@H]1C[C@@H](CC(=O)NC2CCN(CCOc3ccc(Cl)cc3)CC2)CCO1 ZINC000541961945 939663259 /nfs/dbraw/zinc/66/32/59/939663259.db2.gz QODHWBKHWIPAKO-AVRDEDQJSA-N 0 3 422.997 4.141 20 0 HIADHN CCN1CC[C@H](NCc2cnc([C@@H]3CCCO3)s2)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000542013181 939684601 /nfs/dbraw/zinc/68/46/01/939684601.db2.gz MZMGTUVATAOEAV-JENIJYKNSA-N 0 3 411.493 4.337 20 0 HIADHN C[C@H](c1ccc(Cl)cc1)N(C)C(=O)CN1CCC(CCCn2ccnc2)CC1 ZINC000542132378 939724144 /nfs/dbraw/zinc/72/41/44/939724144.db2.gz ZAWOZGXYNBBECW-GOSISDBHSA-N 0 3 402.970 4.248 20 0 HIADHN CNS(=O)(=O)c1ccc([C@@H](C)N[C@H]2CCCc3c(Br)cccc32)cc1 ZINC000542152793 939733691 /nfs/dbraw/zinc/73/36/91/939733691.db2.gz RDRJAUVOLQQQIT-YJYMSZOUSA-N 0 3 423.376 4.085 20 0 HIADHN Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)N[C@@H]1CCCN(Cc2nccn2C)C1=O ZINC000542158309 939736081 /nfs/dbraw/zinc/73/60/81/939736081.db2.gz VSKYEMXZPRZLJH-QFBILLFUSA-N 0 3 423.586 4.002 20 0 HIADHN CCCc1c(NC(=O)[C@H]2CCCN(Cc3cccnc3)C2)cnn1-c1ccccc1 ZINC000542173614 939744016 /nfs/dbraw/zinc/74/40/16/939744016.db2.gz DIPPSGSIURNTRP-FQEVSTJZSA-N 0 3 403.530 4.071 20 0 HIADHN COc1ccc(-c2n[nH]cc2CN2CCC[C@@H](n3ccc(C(F)(F)F)n3)C2)cc1 ZINC000542174624 939744419 /nfs/dbraw/zinc/74/44/19/939744419.db2.gz GELRZPRZYQTRSA-MRXNPFEDSA-N 0 3 405.424 4.138 20 0 HIADHN CCOC(=O)c1sc2cccc(F)c2c1CN(C)C1CCC(NC(C)=O)CC1 ZINC000542245938 939771700 /nfs/dbraw/zinc/77/17/00/939771700.db2.gz VYXOKXOCRAYVKY-UHFFFAOYSA-N 0 3 406.523 4.096 20 0 HIADHN C[C@]1(NCC(=O)Nc2cc(C(F)(F)F)cc(C(F)(F)F)c2)CCO[C@H]1C1CC1 ZINC000542309035 939794407 /nfs/dbraw/zinc/79/44/07/939794407.db2.gz DNXLOMTWLJQVLW-HOTGVXAUSA-N 0 3 410.358 4.210 20 0 HIADHN COc1c(Br)cc(Br)cc1CN[C@]1(C)CCO[C@@H]1C1CC1 ZINC000542312887 939796492 /nfs/dbraw/zinc/79/64/92/939796492.db2.gz JNSKPHBBCYSRMA-HZPDHXFCSA-N 0 3 419.157 4.267 20 0 HIADHN Cc1cn(C2CCCCC2)nc1NC(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000542370315 939808912 /nfs/dbraw/zinc/80/89/12/939808912.db2.gz PWHYTPXRRIEFRR-RTBURBONSA-N 0 3 417.598 4.050 20 0 HIADHN CCN1CCN(CCC(=O)N[C@@H](c2ccccc2)c2cc(Cl)ccc2Cl)CC1 ZINC000542456426 939825918 /nfs/dbraw/zinc/82/59/18/939825918.db2.gz SKNZOAQUISLLMB-QFIPXVFZSA-N 0 3 420.384 4.227 20 0 HIADHN CO[C@@H](C)c1nc(CN2CCCN(Cc3cc(C)c4ncccc4c3)CC2)cs1 ZINC000542464727 939827490 /nfs/dbraw/zinc/82/74/90/939827490.db2.gz GDPUTXMMMPUIDI-SFHVURJKSA-N 0 3 410.587 4.415 20 0 HIADHN CCOc1ccc([C@@H](CC)N[C@@H]2CCCN(Cc3ccccn3)C2=O)cc1OCC ZINC000542498327 939833045 /nfs/dbraw/zinc/83/30/45/939833045.db2.gz JIUBGLDEUZGASA-NHCUHLMSSA-N 0 3 411.546 4.111 20 0 HIADHN C[C@@H](NCc1csc(-c2ccc(S(C)(=O)=O)cc2)n1)[C@@H](C)c1ccccc1 ZINC000542542582 939841245 /nfs/dbraw/zinc/84/12/45/939841245.db2.gz AECIMHURBZVYHN-HZPDHXFCSA-N 0 3 400.569 4.495 20 0 HIADHN CC(C)C[C@@H](NCC(=O)NC1CCN(C(=O)C2CCCCC2)CC1)c1cccs1 ZINC000542556967 939843378 /nfs/dbraw/zinc/84/33/78/939843378.db2.gz VBLCPDRRTICNLI-HXUWFJFHSA-N 0 3 419.635 4.112 20 0 HIADHN CC[C@H](NCC(=O)N1N=C(c2cccs2)C[C@@H]1c1cccs1)[C@H]1CCCO1 ZINC000542566824 939844550 /nfs/dbraw/zinc/84/45/50/939844550.db2.gz NJEJQMLKHQRHPD-USXIJHARSA-N 0 3 403.573 4.035 20 0 HIADHN Cc1csc([C@@H](C)CNC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)n1 ZINC000542582287 939846053 /nfs/dbraw/zinc/84/60/53/939846053.db2.gz SFUVAHXECAFPNM-LIRRHRJNSA-N 0 3 411.493 4.126 20 0 HIADHN Cc1nccc(NCc2cccc(C(=O)N(CCN3CCCC3)c3ccccc3)c2)n1 ZINC000542596172 939847305 /nfs/dbraw/zinc/84/73/05/939847305.db2.gz MQYXAOMPRHBXRY-UHFFFAOYSA-N 0 3 415.541 4.140 20 0 HIADHN C[C@@H](NCC(=O)Nc1ccc(OCc2ccccc2)cc1)[C@H]1COc2ccccc21 ZINC000542624666 939849927 /nfs/dbraw/zinc/84/99/27/939849927.db2.gz AAXFODDFLNOHGU-WZONZLPQSA-N 0 3 402.494 4.358 20 0 HIADHN CCN1CCN([C@@H](C)CNC(=O)c2cc(Cl)ccc2SC2CCCC2)CC1 ZINC000542659287 939852200 /nfs/dbraw/zinc/85/22/00/939852200.db2.gz NDGMPGKVTXLNTM-INIZCTEOSA-N 0 3 410.027 4.131 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@H]2CCCC[C@@H]2NCc2ccccc2-n2ccnc2)cc1 ZINC000542664431 939852613 /nfs/dbraw/zinc/85/26/13/939852613.db2.gz KQIQDZMZIZLKOU-GMAHTHKFSA-N 0 3 409.555 4.055 20 0 HIADHN Clc1cccc2c1CCC[C@H]2NCc1cccc(OCCN2CCOCC2)c1 ZINC000542667662 939852744 /nfs/dbraw/zinc/85/27/44/939852744.db2.gz UUAQZFYGLRWYEX-HSZRJFAPSA-N 0 3 400.950 4.218 20 0 HIADHN C[C@H]1C[C@@H](c2cccnc2)N(C(=O)Nc2ccc(CCN3CCSCC3)cc2)C1 ZINC000542669487 939852844 /nfs/dbraw/zinc/85/28/44/939852844.db2.gz JIMBOAKBAQCQEW-AVRDEDQJSA-N 0 3 410.587 4.288 20 0 HIADHN Brc1ccc(N2CC[C@H](CN[C@H](c3ccccc3)c3cncnc3)C2)cc1 ZINC000542668279 939852934 /nfs/dbraw/zinc/85/29/34/939852934.db2.gz HSFVQLWOPOZLQG-VGOFRKELSA-N 0 3 423.358 4.445 20 0 HIADHN CCOCc1ccc(CN[C@@H]2CCCC[C@@H]2S(=O)(=O)c2ccc(C)cc2)cc1 ZINC000542669560 939853059 /nfs/dbraw/zinc/85/30/59/939853059.db2.gz MGTQPBHHAKYLIU-PKTZIBPZSA-N 0 3 401.572 4.406 20 0 HIADHN CS(=O)(=O)c1cccc(Cl)c1CNCc1ccccc1CN1CCCCCC1 ZINC000542721238 939856593 /nfs/dbraw/zinc/85/65/93/939856593.db2.gz AMBGLWJLDKTSIB-UHFFFAOYSA-N 0 3 421.006 4.409 20 0 HIADHN CC(C)OC(=O)C1(C(=O)OC(C)C)CC(N[C@@H](C)c2ccc(-c3ccncc3)cc2)C1 ZINC000543089302 939937102 /nfs/dbraw/zinc/93/71/02/939937102.db2.gz YFQAOWYUPSNEEV-SFHVURJKSA-N 0 3 424.541 4.451 20 0 HIADHN COC(=O)CN1CCC(N[C@H](C)c2nc(-c3ccc(Cl)cc3)c(C)s2)CC1 ZINC000543097497 939942716 /nfs/dbraw/zinc/94/27/16/939942716.db2.gz LYNRESFWNYMQSO-CYBMUJFWSA-N 0 3 407.967 4.060 20 0 HIADHN CCCc1c(NC(=O)c2ccc(N3CCN(CC)CC3)cc2)cnn1-c1ccccc1 ZINC000543101706 939945514 /nfs/dbraw/zinc/94/55/14/939945514.db2.gz XBNSMLUIOHGHSM-UHFFFAOYSA-N 0 3 417.557 4.219 20 0 HIADHN COc1cccc([C@@H]2C[C@@H](C)CN2CC(=O)N2CCc3[nH]c4ccccc4c3C2)c1 ZINC000543181049 939987539 /nfs/dbraw/zinc/98/75/39/939987539.db2.gz IIDSSKUSTGHLNJ-OSPHWJPCSA-N 0 3 403.526 4.144 20 0 HIADHN CN(C)c1cccc([C@@H]2CCCN2[C@@H](Cc2ccc(C(F)(F)F)cc2)C(N)=O)c1 ZINC000543202697 939994556 /nfs/dbraw/zinc/99/45/56/939994556.db2.gz KQWUGSBFUKYQTJ-PMACEKPBSA-N 0 3 405.464 4.005 20 0 HIADHN Cc1ccccc1[C@H](OC[C@@H](O)CN(C)CCc1ccccc1O)c1ccccc1 ZINC000543254502 940009424 /nfs/dbraw/zinc/00/94/24/940009424.db2.gz ZHOHEFMTLMIJHR-JYFHCDHNSA-N 0 3 405.538 4.342 20 0 HIADHN Cc1cc(NC(=O)N(CCN(C)C)Cc2cccc(Cl)c2)nn1[C@H](C)C1CC1 ZINC000543319388 940028121 /nfs/dbraw/zinc/02/81/21/940028121.db2.gz KEFOQCRHDZPEBU-MRXNPFEDSA-N 0 3 403.958 4.412 20 0 HIADHN COc1ccc(C2(CNC(=O)N(Cc3ccccc3)C3CCN(C)CC3)CCC2)cc1 ZINC000543376610 940046499 /nfs/dbraw/zinc/04/64/99/940046499.db2.gz PETJMMMBHZNVIK-UHFFFAOYSA-N 0 3 421.585 4.423 20 0 HIADHN Cc1ccc(S(=O)(=O)NC[C@@H]2CCCN(Cc3cc(C)c4ncccc4c3)C2)cc1 ZINC000543396664 940050795 /nfs/dbraw/zinc/05/07/95/940050795.db2.gz LPDIIXSVMRGTOI-FQEVSTJZSA-N 0 3 423.582 4.042 20 0 HIADHN O=C(N[C@H]1CCCN(Cc2cc(-n3ccnc3)cs2)C1)c1ccc2ccccc2c1 ZINC000543396666 940051299 /nfs/dbraw/zinc/05/12/99/940051299.db2.gz VPPRKAVRAYLJBL-NRFANRHFSA-N 0 3 416.550 4.481 20 0 HIADHN CCN(CC)[C@@H](CN[C@H](c1ccc(F)cc1)c1cnccn1)c1cccc(OC)c1 ZINC000543410238 940056795 /nfs/dbraw/zinc/05/67/95/940056795.db2.gz BPNZCXKRIGSXCQ-BJKOFHAPSA-N 0 3 408.521 4.386 20 0 HIADHN COc1cc(CN[C@H]2CCC(=O)Nc3ccccc32)cc(Br)c1OC ZINC000543425215 940060918 /nfs/dbraw/zinc/06/09/18/940060918.db2.gz WSCIUOISRMDHML-HNNXBMFYSA-N 0 3 405.292 4.030 20 0 HIADHN Cc1c([C@@H](C)NC[C@H](O)COc2ccccc2Cl)cnn1-c1ccc(F)cc1 ZINC000543470259 940074837 /nfs/dbraw/zinc/07/48/37/940074837.db2.gz OXXLLZVKWDVXFT-KDOFPFPSSA-N 0 3 403.885 4.064 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Cc1ccc2c(c1)COC2)c1ccc(C(F)(F)F)cc1 ZINC000543537139 940097703 /nfs/dbraw/zinc/09/77/03/940097703.db2.gz NIEBZIRNIKRWNB-NRFANRHFSA-N 0 3 420.475 4.477 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cccc(CNc2ccnc(C)n2)c1)c1ccsc1 ZINC000543537201 940097770 /nfs/dbraw/zinc/09/77/70/940097770.db2.gz IMPXYTPFCNYTCQ-OAQYLSRUSA-N 0 3 423.586 4.272 20 0 HIADHN Cc1sc(CCN[C@@H](C)CS(=O)(=O)c2ccc(C)cc2)nc1-c1ccccc1 ZINC000543601353 940127018 /nfs/dbraw/zinc/12/70/18/940127018.db2.gz FIHFUWLDLYJTFV-KRWDZBQOSA-N 0 3 414.596 4.421 20 0 HIADHN CCOc1cc(CNCc2ccc(Cl)c(C)c2)ccc1O[C@@H](C)C(=O)N(C)C ZINC000543645103 940148416 /nfs/dbraw/zinc/14/84/16/940148416.db2.gz XOYGDWQMYSHYEM-INIZCTEOSA-N 0 3 404.938 4.192 20 0 HIADHN C[C@H]1CCCCN1Cc1ccccc1CNCc1c(Cl)cccc1S(C)(=O)=O ZINC000543650092 940150124 /nfs/dbraw/zinc/15/01/24/940150124.db2.gz AXIGSSYVVCKUCR-KRWDZBQOSA-N 0 3 421.006 4.408 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)c2ccc3[nH]c(C(F)F)nc3c2)cc1 ZINC000543715050 940168791 /nfs/dbraw/zinc/16/87/91/940168791.db2.gz WWLPUGYQSMDISV-IBGZPJMESA-N 0 3 414.456 4.076 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)NCC(=O)Nc2ccc(N3CCCC3)cc2C)cc1 ZINC000543811981 940194559 /nfs/dbraw/zinc/19/45/59/940194559.db2.gz OQBMNBCYSOBTRJ-LJQANCHMSA-N 0 3 417.557 4.379 20 0 HIADHN CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H](c2ccc(Cl)cc2F)C(C)C)cc1 ZINC000543846947 940207468 /nfs/dbraw/zinc/20/74/68/940207468.db2.gz YLFVFMQISPGETB-DYESRHJHSA-N 0 3 408.901 4.164 20 0 HIADHN O[C@@H](COc1cccc2ccccc21)CN1CCC[C@H](n2ccc(C(F)(F)F)n2)C1 ZINC000543873037 940219513 /nfs/dbraw/zinc/21/95/13/940219513.db2.gz LHPCRNCRZWXKKX-ZWKOTPCHSA-N 0 3 419.447 4.132 20 0 HIADHN COc1cccc2c1CCN(CCC(=O)N[C@@H](c1cccs1)c1ccccc1)C2 ZINC000543875946 940221147 /nfs/dbraw/zinc/22/11/47/940221147.db2.gz LTMMRWWPIVWKII-XMMPIXPASA-N 0 3 406.551 4.411 20 0 HIADHN Cn1nccc1[C@H]1CCCCN1C(=O)N[C@@H](CN1CCc2ccccc2C1)C(C)(C)C ZINC000543877253 940221617 /nfs/dbraw/zinc/22/16/17/940221617.db2.gz SLXOTRRVFAGZAS-PKTZIBPZSA-N 0 3 423.605 4.130 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCC(Oc2cc(C)ccn2)CC1)c1ccsc1 ZINC000543913356 940241260 /nfs/dbraw/zinc/24/12/60/940241260.db2.gz MRMQMFVLPJFXIM-HXUWFJFHSA-N 0 3 416.591 4.087 20 0 HIADHN O=C(NC1CC1)[C@H](NCCc1c[nH]c2ccc(Br)cc12)c1ccccc1 ZINC000544069526 940316774 /nfs/dbraw/zinc/31/67/74/940316774.db2.gz ALBOOMLZWDYWNX-HXUWFJFHSA-N 0 3 412.331 4.082 20 0 HIADHN C[C@@H](N[C@H](Cc1ccc(C(F)(F)F)cc1)C(N)=O)c1ccc(OC(F)F)cc1 ZINC000544095789 940325293 /nfs/dbraw/zinc/32/52/93/940325293.db2.gz BVMDMBUPKMTDHD-BDJLRTHQSA-N 0 3 402.363 4.054 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)[C@H]2CCn3c(cnc3C3CCCCC3)C2)CN1Cc1ccccc1 ZINC000544287538 940380343 /nfs/dbraw/zinc/38/03/43/940380343.db2.gz WKIIQAFJBMUQGV-WTIAFYNJSA-N 0 3 420.601 4.272 20 0 HIADHN Cc1ccc2nc(C)c(-c3nc(-c4ccc(N5CCCN(C)CC5)nc4)no3)cc2c1 ZINC000544350797 940397726 /nfs/dbraw/zinc/39/77/26/940397726.db2.gz PMLVYECLNHGOHP-UHFFFAOYSA-N 0 3 414.513 4.106 20 0 HIADHN CC(C)([C@@H](NC(=O)[C@H]1COc2ccccc21)c1ccc(F)c(F)c1)N1CCCC1 ZINC000544358578 940400661 /nfs/dbraw/zinc/40/06/61/940400661.db2.gz QWVPXSZUCRTYOA-UWJYYQICSA-N 0 3 400.469 4.173 20 0 HIADHN Fc1ccc([C@H](CN[C@@H](c2ccc(F)cc2)c2cccnc2)N2CCOCC2)cc1 ZINC000544363215 940401961 /nfs/dbraw/zinc/40/19/61/940401961.db2.gz UHULCCFIXUJGQR-ZEQRLZLVSA-N 0 3 409.480 4.112 20 0 HIADHN COc1ccc(C(=O)C[C@H](C)C(=O)N[C@H]2CCN(Cc3ccccc3)[C@@H](C)C2)cc1 ZINC000544378496 940406603 /nfs/dbraw/zinc/40/66/03/940406603.db2.gz ZRHKTHCZHORHGW-IPJJNNNSSA-N 0 3 408.542 4.073 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(-c4ccc(Oc5ccccc5)o4)n3)cn2)CC1 ZINC000544390751 940409809 /nfs/dbraw/zinc/40/98/09/940409809.db2.gz DPTNFYUUCWRQMR-UHFFFAOYSA-N 0 3 417.469 4.326 20 0 HIADHN CCNC(=O)c1cccc(NC(=O)CN[C@H](Cc2ccccc2)c2cccs2)c1 ZINC000544412597 940416825 /nfs/dbraw/zinc/41/68/25/940416825.db2.gz SMWVTWLSTGEEKK-HXUWFJFHSA-N 0 3 407.539 4.010 20 0 HIADHN COc1ccc(CNC(=O)CN[C@H](Cc2ccccc2)c2sccc2C)cc1OC ZINC000544415079 940417330 /nfs/dbraw/zinc/41/73/30/940417330.db2.gz NPAWGFKGBQWKNB-HXUWFJFHSA-N 0 3 424.566 4.264 20 0 HIADHN Cc1cnc([C@@H](NCC2(CN[C@H](c3ncc(C)s3)C3CC3)COC2)C2CC2)s1 ZINC000544423662 940422177 /nfs/dbraw/zinc/42/21/77/940422177.db2.gz FWTQIUOFINRYJS-ROUUACIJSA-N 0 3 418.632 4.015 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1C[C@H](C)C[C@H]1c1cccnc1)c1cccc(OC)c1 ZINC000544437592 940430509 /nfs/dbraw/zinc/43/05/09/940430509.db2.gz KCFYLDLLWMZLTO-YFXJRYMSSA-N 0 3 410.562 4.266 20 0 HIADHN CC(C)[C@@H](NC(=O)CNC(C)(C)c1cccs1)c1ccc2c(c1)OCCCO2 ZINC000544471265 940445875 /nfs/dbraw/zinc/44/58/75/940445875.db2.gz NEIYVFOICGMZPU-OAQYLSRUSA-N 0 3 402.560 4.248 20 0 HIADHN Cc1sc([C@@H](C)NCCCN2C(=O)NC(C)(C)C2=O)nc1-c1ccc(Cl)cc1 ZINC000544471433 940446143 /nfs/dbraw/zinc/44/61/43/940446143.db2.gz QTQVZCKCTNLYQF-GFCCVEGCSA-N 0 3 420.966 4.143 20 0 HIADHN COc1ccc(C2(C(=O)NC[C@@H](c3ccc(C)cc3)N3CCCC3)CCC2)cc1OC ZINC000544523310 940471266 /nfs/dbraw/zinc/47/12/66/940471266.db2.gz WUKHWKCDSCXCGL-QFIPXVFZSA-N 0 3 422.569 4.387 20 0 HIADHN C[C@H](NCC(=O)N[C@@H](c1cccs1)c1ccc(F)cc1)[C@H]1COc2ccccc21 ZINC000544527777 940471968 /nfs/dbraw/zinc/47/19/68/940471968.db2.gz CTRHUBAUPIDARP-FCORRRHLSA-N 0 3 410.514 4.247 20 0 HIADHN C[C@H](NCC(=O)N(C)C(c1ccccc1)c1ccccc1)[C@H]1COc2ccccc21 ZINC000544530615 940472984 /nfs/dbraw/zinc/47/29/84/940472984.db2.gz ZNDGRQZPYVRYDH-WMZHIEFXSA-N 0 3 400.522 4.389 20 0 HIADHN Cc1nn(C(C)(C)C)c(C)c1CNCCC(=O)Nc1ccc(Br)cc1C ZINC000544600384 940487988 /nfs/dbraw/zinc/48/79/88/940487988.db2.gz QKKGDCKYBJMIAF-UHFFFAOYSA-N 0 3 421.383 4.444 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N(C)[C@@H]2CCO[C@@H](c3ccc(F)cc3)C2)N(C)C)cc1 ZINC000544662662 940500003 /nfs/dbraw/zinc/50/00/03/940500003.db2.gz OCTBCXZXLQLTNC-XPWALMASSA-N 0 3 413.537 4.299 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3nc(C)oc3-c3ccccc3)c(C)c2)CC1 ZINC000544679056 940501652 /nfs/dbraw/zinc/50/16/52/940501652.db2.gz SSVVCYYRNHKEQE-UHFFFAOYSA-N 0 3 404.514 4.353 20 0 HIADHN CN(C)CCN(Cc1cccc(O)c1)C(=O)c1cccc2nc(-c3cccs3)[nH]c21 ZINC000544785877 940513864 /nfs/dbraw/zinc/51/38/64/940513864.db2.gz VXCURLGKQJNDQL-UHFFFAOYSA-N 0 3 420.538 4.201 20 0 HIADHN CS[C@H]1CN(C(=O)Nc2ccc(OC(C)C)cc2C(F)(F)F)C[C@H]1N(C)C ZINC000544790972 940514286 /nfs/dbraw/zinc/51/42/86/940514286.db2.gz OYOOSNBKHVPXEA-CVEARBPZSA-N 0 3 405.486 4.002 20 0 HIADHN CO[C@H](c1ccccc1Cl)[C@H](C)N[C@H](C)c1cccc(S(=O)(=O)N(C)C)c1 ZINC000544828131 940517958 /nfs/dbraw/zinc/51/79/58/940517958.db2.gz OIZFYMGXPYAJCA-SIFCLUCFSA-N 0 3 410.967 4.017 20 0 HIADHN CCN(C(=O)c1cnc(Oc2ccccc2)cn1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000544848123 940518953 /nfs/dbraw/zinc/51/89/53/940518953.db2.gz FYLJNOZEFFNLOL-FQEVSTJZSA-N 0 3 402.498 4.006 20 0 HIADHN CCN(C(=O)c1cnn(CC(C)C)c1C(F)F)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000544850875 940519150 /nfs/dbraw/zinc/51/91/50/940519150.db2.gz PKAPTJBCHBEABZ-GOSISDBHSA-N 0 3 404.505 4.213 20 0 HIADHN O=C(CCN1CCC(=Cc2ccccc2F)CC1)Nc1ccc(N2CCCC2=O)cc1 ZINC000544893860 940522605 /nfs/dbraw/zinc/52/26/05/940522605.db2.gz NJXVPEUHVNAUTB-UHFFFAOYSA-N 0 3 421.516 4.461 20 0 HIADHN CCO[C@@H]1C[C@H](NCc2cc(Cl)ccc2OCc2cccnc2)[C@]12CCCO2 ZINC000545351725 940564081 /nfs/dbraw/zinc/56/40/81/940564081.db2.gz QSWNAYMVEMUKNZ-BHDDXSALSA-N 0 3 402.922 4.130 20 0 HIADHN CS[C@H]1CN(C(=O)Nc2ccc(Sc3nc(C)cs3)cc2C)C[C@H]1N(C)C ZINC000545421110 940569128 /nfs/dbraw/zinc/56/91/28/940569128.db2.gz QQQBIVKSTLTJNI-SJORKVTESA-N 0 3 422.645 4.420 20 0 HIADHN CCN1c2ccc(NC(=O)NC[C@@H]3CCCCN3Cc3ccccc3)cc2CCC1=O ZINC000545430459 940569465 /nfs/dbraw/zinc/56/94/65/940569465.db2.gz JSIDAMFONMTLOO-QFIPXVFZSA-N 0 3 420.557 4.162 20 0 HIADHN CS(=O)(=O)Nc1ccc(CN[C@H](Cc2cccnc2)c2ccc(Cl)cc2)cc1 ZINC000545458581 940570793 /nfs/dbraw/zinc/57/07/93/940570793.db2.gz ZIAYDCCTNKYCBW-OAQYLSRUSA-N 0 3 415.946 4.180 20 0 HIADHN CC(C)(C)[C@H](CCO)NCC(=O)N1N=C(c2cc3ccccc3o2)C[C@H]1c1ccco1 ZINC000545517308 940572913 /nfs/dbraw/zinc/57/29/13/940572913.db2.gz KVTFDZLCIYQQAM-AVRDEDQJSA-N 0 3 423.513 4.090 20 0 HIADHN FC(F)(F)[C@@]1(c2nc(-c3ccc4c(c3)OCO4)no2)CCN(Cc2ccccc2)C1 ZINC000545581861 940575783 /nfs/dbraw/zinc/57/57/83/940575783.db2.gz VKSITWVCMSFYOR-FQEVSTJZSA-N 0 3 417.387 4.171 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(CCC(C)(C)c4ccccc4)n3)cn2)CC1 ZINC000545656225 940579143 /nfs/dbraw/zinc/57/91/43/940579143.db2.gz IQVPVWWNARATED-UHFFFAOYSA-N 0 3 405.546 4.184 20 0 HIADHN C[C@H](CCCc1ccccc1)c1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1 ZINC000545656080 940579147 /nfs/dbraw/zinc/57/91/47/940579147.db2.gz GLVGZSJJECTZBU-LJQANCHMSA-N 0 3 405.546 4.400 20 0 HIADHN CN(C)c1cc(-c2noc([C@@H]3CCCN(Cc4cccnc4)C3)n2)c2ccccc2n1 ZINC000545743841 940583353 /nfs/dbraw/zinc/58/33/53/940583353.db2.gz WEGAIQXKEXITRH-GOSISDBHSA-N 0 3 414.513 4.125 20 0 HIADHN FC(F)(F)c1cccc(-c2noc(-c3ccc(CN4CCSCC4)cc3)n2)n1 ZINC000545746414 940583532 /nfs/dbraw/zinc/58/35/32/940583532.db2.gz HVHOADWUYLAVPS-UHFFFAOYSA-N 0 3 406.433 4.366 20 0 HIADHN FC(F)(F)[C@@]1(c2nc(-c3ccc4nc[nH]c4c3)no2)CCN(Cc2ccccc2)C1 ZINC000545754119 940583920 /nfs/dbraw/zinc/58/39/20/940583920.db2.gz QICUXQUTYYRFMU-FQEVSTJZSA-N 0 3 413.403 4.319 20 0 HIADHN CC(C)[C@H](NCc1ccccc1OCCN1CCOCC1)c1ccc(F)c(F)c1 ZINC000563970013 945333373 /nfs/dbraw/zinc/33/33/73/945333373.db2.gz CTZRABKVLHSSHW-QHCPKHFHSA-N 0 3 404.501 4.163 20 0 HIADHN COc1ccc(C[C@H](C)N[C@H](c2nc(-c3ccncc3)no2)C(C)C)c(C)c1OC ZINC000563984445 945335708 /nfs/dbraw/zinc/33/57/08/945335708.db2.gz MIVVKMMIIMSSPO-YWZLYKJASA-N 0 3 410.518 4.375 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)c1ccc(NC(=O)c2cccs2)cc1)c1ccco1 ZINC000563989559 945337872 /nfs/dbraw/zinc/33/78/72/945337872.db2.gz WMRMCXHRIZNLJI-YJBOKZPZSA-N 0 3 411.527 4.453 20 0 HIADHN Cc1cn(-c2ccccc2)nc1C(=O)NC[C@H](c1ccc(OC(C)C)cc1)N(C)C ZINC000563991259 945339117 /nfs/dbraw/zinc/33/91/17/945339117.db2.gz IZHGMEOFGHTHOA-JOCHJYFZSA-N 0 3 406.530 4.001 20 0 HIADHN CCc1nccn1C[C@@H]1CCCN1C(=O)c1cccc2[nH]c(-c3cccs3)nc21 ZINC000546144794 940712672 /nfs/dbraw/zinc/71/26/72/940712672.db2.gz CMXUXUSFGZMYBU-HNNXBMFYSA-N 0 3 405.527 4.355 20 0 HIADHN CN(C(=O)NCc1nc2ccccc2n1C1CC1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000546155653 940716373 /nfs/dbraw/zinc/71/63/73/940716373.db2.gz OEBQBWYHDHOZRD-NRFANRHFSA-N 0 3 417.557 4.177 20 0 HIADHN COc1ccc(C[NH2+]C2CCC(C(=O)OC(C)(C)C)CC2)c(Br)c1[O-] ZINC000546175521 940722008 /nfs/dbraw/zinc/72/20/08/940722008.db2.gz GEMJGLAEKYAHDP-UHFFFAOYSA-N 0 3 414.340 4.153 20 0 HIADHN COc1ccc(CNC2CCC(C(=O)OC(C)(C)C)CC2)c(Br)c1O ZINC000546175521 940722013 /nfs/dbraw/zinc/72/20/13/940722013.db2.gz GEMJGLAEKYAHDP-UHFFFAOYSA-N 0 3 414.340 4.153 20 0 HIADHN CCN(C(=O)c1ccc(CNC(=O)C(C)(C)C)cc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000546185011 940724406 /nfs/dbraw/zinc/72/44/06/940724406.db2.gz SWEDITRAKIXCQE-QHCPKHFHSA-N 0 3 421.585 4.086 20 0 HIADHN CCCN(C(=O)NCCC[C@@H]1CCCCO1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000546203690 940728759 /nfs/dbraw/zinc/72/87/59/940728759.db2.gz NLYBYHDISIEBKI-GOTSBHOMSA-N 0 3 401.595 4.422 20 0 HIADHN COCCn1cc2c(n1)[C@@H](N[C@@H](C)Cc1ccc(Br)cc1F)CCC2 ZINC000546227231 940735514 /nfs/dbraw/zinc/73/55/14/940735514.db2.gz FOJZWTOXWUIJCL-UGSOOPFHSA-N 0 3 410.331 4.029 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(Cc4ccc(C(C)(C)C)cc4)n3)cn2)CC1 ZINC000546358699 940801183 /nfs/dbraw/zinc/80/11/83/940801183.db2.gz CPHBEDNKOZNJEJ-UHFFFAOYSA-N 0 3 405.546 4.162 20 0 HIADHN Cc1noc(C)c1CO[C@H]1CCN(CCCc2nc(-c3ccc(C)c(F)c3)no2)C1 ZINC000546588250 940858690 /nfs/dbraw/zinc/85/86/90/940858690.db2.gz MARABIDGBICAFA-SFHVURJKSA-N 0 3 414.481 4.013 20 0 HIADHN C[C@H](NCc1cc2cc(Br)ccc2[nH]1)c1ccc(S(C)(=O)=O)cc1 ZINC000546648937 940864878 /nfs/dbraw/zinc/86/48/78/940864878.db2.gz HIXZOQKOLLLEQT-LBPRGKRZSA-N 0 3 407.333 4.185 20 0 HIADHN CC[C@H](N[C@H](C)CCN1C(=O)c2ccccc2C1=O)c1nc(C(F)(F)F)cs1 ZINC000546660793 940866371 /nfs/dbraw/zinc/86/63/71/940866371.db2.gz KEXIYZHBXNPNQY-RISCZKNCSA-N 0 3 411.449 4.277 20 0 HIADHN Cc1ccc(Sc2ccc(Cl)cc2)c(C(=O)NCCCN2CCN(C)CC2)c1 ZINC000546786672 940882845 /nfs/dbraw/zinc/88/28/45/940882845.db2.gz MZLQJKWVGCBRIY-UHFFFAOYSA-N 0 3 418.006 4.167 20 0 HIADHN CCCc1c(NC(=O)N2CCN(C3CCC(C)CC3)CC2)cnn1-c1cc(C)ccn1 ZINC000546928580 940916599 /nfs/dbraw/zinc/91/65/99/940916599.db2.gz IVYNSWPSUNZBDW-UHFFFAOYSA-N 0 3 424.593 4.256 20 0 HIADHN CCO[C@H]1COCC[C@@H]1NCc1cn(-c2ccc(Br)cc2)nc1C(C)C ZINC000546963409 940929451 /nfs/dbraw/zinc/92/94/51/940929451.db2.gz IKVJGQBBLCDHRD-OALUTQOASA-N 0 3 422.367 4.042 20 0 HIADHN CCN(C(=O)c1cc(C)n(-c2nccs2)c1C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000546977039 940933987 /nfs/dbraw/zinc/93/39/87/940933987.db2.gz NALWROGKXNJHAP-HXUWFJFHSA-N 0 3 408.571 4.287 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(/C=C\c4nc5ccccc5s4)n3)cn2)CC1 ZINC000547062030 940979064 /nfs/dbraw/zinc/97/90/64/940979064.db2.gz HULQZOKRAOWIKL-KTKRTIGZSA-N 0 3 418.526 4.054 20 0 HIADHN C/C(=C\c1cccc(Cl)c1)c1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1 ZINC000547073724 940984861 /nfs/dbraw/zinc/98/48/61/940984861.db2.gz UWQMSGCDGHOWSE-DTQAZKPQSA-N 0 3 409.921 4.487 20 0 HIADHN Cc1cc(-c2noc(-c3ccc(CN4C[C@H](C)O[C@@H](C)C4)cc3)n2)cc2nc[nH]c21 ZINC000547150972 941012172 /nfs/dbraw/zinc/01/21/72/941012172.db2.gz LJTXNJZHYYVCMW-HOTGVXAUSA-N 0 3 403.486 4.198 20 0 HIADHN C[C@H](c1noc([C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)n1)c1ccncc1 ZINC000547220885 941035918 /nfs/dbraw/zinc/03/59/18/941035918.db2.gz GJBIKYDHKOGPFD-YWZLYKJASA-N 0 3 402.420 4.322 20 0 HIADHN Fc1ccc(-c2nc3c(s2)CCC[C@@H]3NC2CCN(c3cnccn3)CC2)cc1 ZINC000547356728 941058069 /nfs/dbraw/zinc/05/80/69/941058069.db2.gz SCTNFFWLQOLGRM-SFHVURJKSA-N 0 3 409.534 4.375 20 0 HIADHN COc1ccccc1NC(=O)CN1CCN(CC2CCC(c3ccccc3)CC2)CC1 ZINC000547743907 941074311 /nfs/dbraw/zinc/07/43/11/941074311.db2.gz LOXCGZHUMVRDRR-UHFFFAOYSA-N 0 3 421.585 4.225 20 0 HIADHN CCN(C[C@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)c1cccc2c(C)ccnc21 ZINC000547965298 941080981 /nfs/dbraw/zinc/08/09/81/941080981.db2.gz GGHVEDDNGXYDMV-NRFANRHFSA-N 0 3 423.582 4.076 20 0 HIADHN CC(C)CN(C(=O)[C@H]1CCCN(Cc2cccnc2)C1)[C@H]1CCCc2cccnc21 ZINC000548147910 941088743 /nfs/dbraw/zinc/08/87/43/941088743.db2.gz LHPUPFQQGBSQLU-GOTSBHOMSA-N 0 3 406.574 4.251 20 0 HIADHN Cc1ccnc2c1cccc2S(=O)(=O)NC1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1 ZINC000548299148 941094450 /nfs/dbraw/zinc/09/44/50/941094450.db2.gz KFHLJUQRXXTRHC-SEJPIABJSA-N 0 3 421.566 4.017 20 0 HIADHN CCN(C(=O)NCc1ccc(NC(=O)C(C)C)cc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000548442966 941104489 /nfs/dbraw/zinc/10/44/89/941104489.db2.gz SPGSNMMKDDASPE-QHCPKHFHSA-N 0 3 422.573 4.087 20 0 HIADHN COc1ccc(OC)c(-c2nn(-c3ccccc3)cc2CN2CCC3(CCO3)CC2)c1 ZINC000548807144 941124696 /nfs/dbraw/zinc/12/46/96/941124696.db2.gz WHJATGQOOBSJDJ-UHFFFAOYSA-N 0 3 419.525 4.311 20 0 HIADHN CCOc1cc(CN2CCC3(CCO3)CC2)ccc1OCCOc1ccc(F)cc1 ZINC000548806983 941124777 /nfs/dbraw/zinc/12/47/77/941124777.db2.gz DNGSSSAGYZLWGZ-UHFFFAOYSA-N 0 3 415.505 4.437 20 0 HIADHN c1ccc(Cc2noc(CN[C@@H]3CN(Cc4ccccc4)C[C@H]3c3ccccc3)n2)cc1 ZINC000548932293 941130629 /nfs/dbraw/zinc/13/06/29/941130629.db2.gz YWWRXKRILVZCHB-LOSJGSFVSA-N 0 3 424.548 4.418 20 0 HIADHN O=C(CN[C@@H](c1cccc(C(F)(F)F)c1)C1CC1)Nc1ccc2c(c1)OCCO2 ZINC000549080165 941153724 /nfs/dbraw/zinc/15/37/24/941153724.db2.gz PKNAEBMAKQGCTL-HXUWFJFHSA-N 0 3 406.404 4.156 20 0 HIADHN CCc1ccccc1NC(=O)CN[C@@H]1CCN(C(C)C)[C@@H]1c1ccc(F)c(F)c1 ZINC000549114029 941161153 /nfs/dbraw/zinc/16/11/53/941161153.db2.gz PLMPYGPDWUGPPZ-FYYLOGMGSA-N 0 3 401.501 4.279 20 0 HIADHN Cc1ccc(NC(=O)CN[C@H]2CCN(C(C)C)[C@@H]2c2ccc(F)c(F)c2)c(F)c1 ZINC000549114131 941161214 /nfs/dbraw/zinc/16/12/14/941161214.db2.gz ULCCMXQRUKCTFV-RBBKRZOGSA-N 0 3 405.464 4.164 20 0 HIADHN CCc1ccccc1NC(=O)CN[C@H]1CCN(C(C)C)[C@H]1c1ccc(F)c(F)c1 ZINC000549114031 941161230 /nfs/dbraw/zinc/16/12/30/941161230.db2.gz PLMPYGPDWUGPPZ-GMAHTHKFSA-N 0 3 401.501 4.279 20 0 HIADHN CCN1CC[C@@H](NCC(=O)N(C(C)C)C2CCCC2)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000549115289 941161468 /nfs/dbraw/zinc/16/14/68/941161468.db2.gz BFIMMRJUGZVUGG-KNQAVFIVSA-N 0 3 411.512 4.008 20 0 HIADHN CC[C@@H](C)C(=O)Nc1cccc(CNC[C@@H](O)COc2ccc3ccccc3c2)c1 ZINC000549159487 941167104 /nfs/dbraw/zinc/16/71/04/941167104.db2.gz VDWQSEYFUUQPOX-WZONZLPQSA-N 0 3 406.526 4.354 20 0 HIADHN CC[C@H](C)C(=O)Nc1cccc(CNC[C@@H](O)CO[C@H]2CCCc3ccccc32)c1 ZINC000549159587 941167145 /nfs/dbraw/zinc/16/71/45/941167145.db2.gz YWDLRMONGRRXQU-ANJVHQHFSA-N 0 3 410.558 4.216 20 0 HIADHN CC[C@@H](C)NC(=O)c1ccc(NC(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)cc1 ZINC000549231490 941172664 /nfs/dbraw/zinc/17/26/64/941172664.db2.gz OQYYLPLXGZWGOP-FOIQADDNSA-N 0 3 416.953 4.293 20 0 HIADHN CN(C)C[C@@H](NC(=O)c1cc(NC(=O)N(C)C)ccc1Cl)c1ccc(Cl)cc1 ZINC000549233331 941172866 /nfs/dbraw/zinc/17/28/66/941172866.db2.gz UBDHXVBLYJMFBE-GOSISDBHSA-N 0 3 423.344 4.120 20 0 HIADHN CCc1ccccc1[C@@H]1C[C@H]1C(=O)Nc1ccc(C(=O)N(C)[C@H]2CCCN(C)C2)cc1 ZINC000549295432 941177723 /nfs/dbraw/zinc/17/77/23/941177723.db2.gz RWBPJBYGXNNHRB-OEMFJLHTSA-N 0 3 419.569 4.157 20 0 HIADHN CCN1CC[C@@H](NCC(=O)Nc2cc(C)ccc2C)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000549476161 941194389 /nfs/dbraw/zinc/19/43/89/941194389.db2.gz JLZKLLWHSLRJMH-XMSQKQJNSA-N 0 3 405.464 4.084 20 0 HIADHN CCN1CC[C@H](N[C@@H](C)C(=O)Nc2ccc(C)cc2C)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000549476057 941194459 /nfs/dbraw/zinc/19/44/59/941194459.db2.gz HPJMTZVLHARJHI-GJULWVSJSA-N 0 3 419.491 4.473 20 0 HIADHN C[C@H](c1ccc(F)cc1)N1CC[C@H](N[C@@H]2CCO[C@H]2c2ccc(Cl)cc2)C1=O ZINC000549609842 941201236 /nfs/dbraw/zinc/20/12/36/941201236.db2.gz BZQYOMFSEMHPKU-PLBGURBNSA-N 0 3 402.897 4.261 20 0 HIADHN Cc1sc2nc([C@H](C)N[C@H](C)C3CCN(CC(F)(F)F)CC3)nc(N)c2c1C ZINC000549633612 941202191 /nfs/dbraw/zinc/20/21/91/941202191.db2.gz NPQYDAPXUPAKAT-NEPJUHHUSA-N 0 3 415.529 4.204 20 0 HIADHN Cc1ccc(C(=O)Nc2ccc(OC[C@@H](O)CN3CCc4ccccc4C3)cc2)cc1 ZINC000549688706 941204606 /nfs/dbraw/zinc/20/46/06/941204606.db2.gz VCKGRUALAYTYJK-DEOSSOPVSA-N 0 3 416.521 4.045 20 0 HIADHN Cc1ccc(C(=O)Nc2ccc(OC[C@H](O)CN3CCc4ccccc4C3)cc2)cc1 ZINC000549688710 941204633 /nfs/dbraw/zinc/20/46/33/941204633.db2.gz VCKGRUALAYTYJK-XMMPIXPASA-N 0 3 416.521 4.045 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)N[C@H]2CCN([C@H](C)c3ccc(F)cc3)C2=O)cc1 ZINC000549927533 941240283 /nfs/dbraw/zinc/24/02/83/941240283.db2.gz AHEKOHRITJRZLD-MFEFFIJZSA-N 0 3 406.505 4.333 20 0 HIADHN COc1cc(CN[C@H]2CCC[C@H]2F)ccc1OCC(=O)Nc1ccccc1Cl ZINC000549936264 941243102 /nfs/dbraw/zinc/24/31/02/941243102.db2.gz KFQMQNADGPYOGN-AEFFLSMTSA-N 0 3 406.885 4.346 20 0 HIADHN CCO[C@@H]1C[C@@H](NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H]1n1cccn1 ZINC000549942563 941243975 /nfs/dbraw/zinc/24/39/75/941243975.db2.gz XAZHJDRXSCGABE-BZUAXINKSA-N 0 3 407.358 4.429 20 0 HIADHN CC[C@H]1CN(c2nnc(C3CCC3)n2C[C@@H]2CCCCO2)CCN1Cc1ccccc1 ZINC000550055920 941275453 /nfs/dbraw/zinc/27/54/53/941275453.db2.gz DWRSQRLOYJIBFZ-GOTSBHOMSA-N 0 3 423.605 4.216 20 0 HIADHN C[C@@H]1CCN(C(=O)c2cc(N(C)C)c3ccccc3n2)CCN1Cc1ccccc1 ZINC000550159317 941291301 /nfs/dbraw/zinc/29/13/01/941291301.db2.gz JFZGBFPXERZOPG-LJQANCHMSA-N 0 3 402.542 4.037 20 0 HIADHN C[C@H](c1ccc(F)cc1)N1CCC[C@@H](NCc2ccc(Oc3cnccn3)cc2)C1=O ZINC000550292750 941310105 /nfs/dbraw/zinc/31/01/05/941310105.db2.gz CBUKGHXVVDRHJT-VGOFRKELSA-N 0 3 420.488 4.250 20 0 HIADHN CC[C@@H](NCc1cc(Br)c2c(c1)OCCO2)c1ccc(C(=O)OC)cc1 ZINC000550629363 941347745 /nfs/dbraw/zinc/34/77/45/941347745.db2.gz QVKZSQJXGIBRJY-QGZVFWFLSA-N 0 3 420.303 4.248 20 0 HIADHN NS(=O)(=O)c1ccc2c(c1)CCC[C@@H]2NCc1ccccc1Oc1ccccc1 ZINC000550643910 941349090 /nfs/dbraw/zinc/34/90/90/941349090.db2.gz GUOMAJVYCJLTJA-QFIPXVFZSA-N 0 3 408.523 4.294 20 0 HIADHN Cc1ccc([C@H](NC(=O)CN[C@@H]2CCN(C)[C@@H]2c2ccccc2)c2cccs2)cc1 ZINC000550705459 941356836 /nfs/dbraw/zinc/35/68/36/941356836.db2.gz UAFSXUUUAAZEAM-IEZKXTBUSA-N 0 3 419.594 4.297 20 0 HIADHN COc1cc2c(cc1OC)[C@H](N[C@H]1CCCN([C@H](C)c3ccc(F)cc3)C1=O)CC2 ZINC000550894400 941380594 /nfs/dbraw/zinc/38/05/94/941380594.db2.gz FAAZPSGGJLRUBF-LPTQZCDUSA-N 0 3 412.505 4.172 20 0 HIADHN CCO[C@@H]1C[C@H](N[C@@H]2CCSc3ccc(Br)cc32)[C@@H]1n1cccn1 ZINC000550947138 941384069 /nfs/dbraw/zinc/38/40/69/941384069.db2.gz XECLUZODOLGARR-HPFXQQBRSA-N 0 3 408.365 4.191 20 0 HIADHN CN1CC[C@H](NCC(=O)Nc2ccc(Br)cc2Cl)[C@H]1c1ccccc1 ZINC000551098012 941409377 /nfs/dbraw/zinc/40/93/77/941409377.db2.gz UYBNMNARSSSTFX-PKOBYXMFSA-N 0 3 422.754 4.076 20 0 HIADHN C[C@H](N[C@@H]1CCCc2cc(S(N)(=O)=O)ccc21)c1ccc(Oc2cccnc2)cc1 ZINC000551198317 941426493 /nfs/dbraw/zinc/42/64/93/941426493.db2.gz MGIHMNXLIPOBOS-QMHKHESXSA-N 0 3 423.538 4.250 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](NC[C@@H](CO)C2CCCCC2)c2ccc(F)cc2)c1 ZINC000551272928 941440772 /nfs/dbraw/zinc/44/07/72/941440772.db2.gz RLVVSFPXPNJPTC-NZQKXSOJSA-N 0 3 419.562 4.097 20 0 HIADHN COc1ccc([C@H](C)N[C@@H]2CCCN([C@@H](C)c3ccc(F)cc3)C2=O)cc1OC ZINC000551275060 941441421 /nfs/dbraw/zinc/44/14/21/941441421.db2.gz YNXJDUBPRZPCKC-TWOQFEAHSA-N 0 3 400.494 4.246 20 0 HIADHN Fc1ccc([C@H](N[C@H]2C[C@H](c3ccc(F)c(Br)c3)C2)c2c[nH]nn2)cc1 ZINC000551305497 941447642 /nfs/dbraw/zinc/44/76/42/941447642.db2.gz YGRCFNJCUCTSQT-RFUYNDQBSA-N 0 3 419.273 4.471 20 0 HIADHN C[C@@H](Cn1cc(Br)ccc1=O)NCc1cc(Cl)ccc1OC(F)F ZINC000551315402 941449752 /nfs/dbraw/zinc/44/97/52/941449752.db2.gz WTZVFUDELFUGIJ-JTQLQIEISA-N 0 3 421.669 4.044 20 0 HIADHN CN(C)Cc1ccc(S(=O)(=O)Nc2cc(F)c(Br)cc2Cl)cc1 ZINC000551387996 941466840 /nfs/dbraw/zinc/46/68/40/941466840.db2.gz OFXYDJCXSBEJRQ-UHFFFAOYSA-N 0 3 421.719 4.104 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)Cc1cscc1Br ZINC000551388563 941467612 /nfs/dbraw/zinc/46/76/12/941467612.db2.gz PFXFQPOYNPCZCK-HNNXBMFYSA-N 0 3 407.377 4.176 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)Cc1cscc1Br ZINC000551388564 941467631 /nfs/dbraw/zinc/46/76/31/941467631.db2.gz PFXFQPOYNPCZCK-OAHLLOKOSA-N 0 3 407.377 4.176 20 0 HIADHN CN1CCN(CCC(=O)Nc2c(Cl)cccc2Cl)C[C@H]1Cc1ccccc1 ZINC000551411594 941472206 /nfs/dbraw/zinc/47/22/06/941472206.db2.gz KLWVOFFUDUWRES-QGZVFWFLSA-N 0 3 406.357 4.181 20 0 HIADHN COC(=O)[C@H](Cc1ccccc1)[C@H](C)N[C@H](C)C(=O)Nc1c(C)cccc1C(C)C ZINC000551420396 941475372 /nfs/dbraw/zinc/47/53/72/941475372.db2.gz ZDVUCKTZOPYDFC-NNMXDRDESA-N 0 3 410.558 4.455 20 0 HIADHN CC(C)(C)N1C[C@@H](C(=O)N2CCC[C@H]2CC(=O)c2cccs2)[C@H](C(F)(F)F)C1 ZINC000551468930 941486095 /nfs/dbraw/zinc/48/60/95/941486095.db2.gz YFLOSEGOZXOUIZ-RRFJBIMHSA-N 0 3 416.509 4.221 20 0 HIADHN CCCCOc1ccc([C@@H](C)NCc2ccc(N3CCCS3(=O)=O)c(F)c2)cc1 ZINC000551515828 941493213 /nfs/dbraw/zinc/49/32/13/941493213.db2.gz GTLLMZHOQNCEQZ-QGZVFWFLSA-N 0 3 420.550 4.395 20 0 HIADHN CC(C)Oc1ccc([C@H](C)NCc2ccnc(N3CCN(C)CC3)c2)cc1Cl ZINC000551534384 941497054 /nfs/dbraw/zinc/49/70/54/941497054.db2.gz NODCGWPIHJOTGQ-KRWDZBQOSA-N 0 3 402.970 4.125 20 0 HIADHN C[C@@H](NCc1cccc(I)c1)c1cccc(N2CCCC2=O)c1 ZINC000551538270 941497791 /nfs/dbraw/zinc/49/77/91/941497791.db2.gz TZVGJNRMGGECMW-CQSZACIVSA-N 0 3 420.294 4.269 20 0 HIADHN COCC[C@@H](N[C@H](C)c1ccc(-n2cnnn2)cc1)c1ccc(Cl)c(Cl)c1 ZINC000551572300 941504381 /nfs/dbraw/zinc/50/43/81/941504381.db2.gz YNPUOQUJOFPAAP-BFUOFWGJSA-N 0 3 406.317 4.398 20 0 HIADHN COc1ccc2c(c1)CCC[C@@H]2NCc1cccc(N2C(=O)N[C@@](C)(C3CC3)C2=O)c1 ZINC000551572508 941504786 /nfs/dbraw/zinc/50/47/86/941504786.db2.gz ZPTUOFNXNGHGTA-DHLKQENFSA-N 0 3 419.525 4.087 20 0 HIADHN COc1ccc([C@H](NCc2cccc(N3C(=O)N[C@](C)(C4CC4)C3=O)c2)C2CC2)cc1 ZINC000551572772 941504916 /nfs/dbraw/zinc/50/49/16/941504916.db2.gz KDMDKLUJOVDJTQ-RCZVLFRGSA-N 0 3 419.525 4.161 20 0 HIADHN Cc1nn(C)c(C)c1[C@H]1OCC[C@@H]1NCc1cnc(-c2ccc(Cl)cc2)s1 ZINC000551591377 941508304 /nfs/dbraw/zinc/50/83/04/941508304.db2.gz ZODRPDXORPNSIE-HKUYNNGSSA-N 0 3 402.951 4.434 20 0 HIADHN COC(=O)c1ccccc1-c1ccc(CN[C@H](CN(C)C)c2ccc(OC)cc2)o1 ZINC000551600090 941509773 /nfs/dbraw/zinc/50/97/73/941509773.db2.gz HQDSEXBLDAJRQV-JOCHJYFZSA-N 0 3 408.498 4.134 20 0 HIADHN C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000551641372 941517092 /nfs/dbraw/zinc/51/70/92/941517092.db2.gz YBFKUUWSPOZXSZ-BZNIZROVSA-N 0 3 423.401 4.348 20 0 HIADHN COc1ccc(-c2nc(CC(=O)Nc3ccccc3CN(C)C)cs2)cc1OC ZINC000551665329 941521561 /nfs/dbraw/zinc/52/15/61/941521561.db2.gz NUOPQBVYPNMJPN-UHFFFAOYSA-N 0 3 411.527 4.070 20 0 HIADHN Cc1ccc(C)c(OC[C@H](O)CN[C@@H](c2cncc(Br)c2)C2CC2)c1C ZINC000551718560 941532778 /nfs/dbraw/zinc/53/27/78/941532778.db2.gz IDJIKMBPPQAVPH-WOJBJXKFSA-N 0 3 419.363 4.250 20 0 HIADHN COC(=O)[C@@H](C)Oc1ccc(CN[C@H](c2cncc(Br)c2)C2CC2)cc1 ZINC000551811841 941550279 /nfs/dbraw/zinc/55/02/79/941550279.db2.gz HYVMANMLGRDJCN-YJYMSZOUSA-N 0 3 419.319 4.025 20 0 HIADHN CS(=O)(=O)c1cc(CNCCSCc2ccccc2)cc(C(F)(F)F)c1 ZINC000551823500 941553528 /nfs/dbraw/zinc/55/35/28/941553528.db2.gz HLKHBLAFLVTQPI-UHFFFAOYSA-N 0 3 403.491 4.132 20 0 HIADHN Cc1cc(C(=O)Nc2ccccc2CN(C)C)c2cnn(Cc3cccs3)c2n1 ZINC000551873462 941559683 /nfs/dbraw/zinc/55/96/83/941559683.db2.gz IRGDWQDYTPLIKE-UHFFFAOYSA-N 0 3 405.527 4.163 20 0 HIADHN CN(C)Cc1cccc(C(=O)Nc2nc(-c3ccc(Br)cn3)cs2)c1 ZINC000551990659 941565535 /nfs/dbraw/zinc/56/55/35/941565535.db2.gz CFDBYBFRVATRMT-UHFFFAOYSA-N 0 3 417.332 4.282 20 0 HIADHN Cc1cc([C@H](C)N[C@H](CN2CCN(C)CC2)c2ccccc2)sc1Br ZINC000552013695 941568368 /nfs/dbraw/zinc/56/83/68/941568368.db2.gz QFTCDFCVUDDOOK-FUHWJXTLSA-N 0 3 422.436 4.458 20 0 HIADHN COCc1c2ccccc2oc1C(=O)N1CCN(c2ccnc3ccccc32)CC1 ZINC000552009026 941568590 /nfs/dbraw/zinc/56/85/90/941568590.db2.gz PMUNXLZUIUZKRQ-UHFFFAOYSA-N 0 3 401.466 4.090 20 0 HIADHN O[C@H](CN[C@@H]1CCCOc2ccc(F)cc21)COc1cc(Cl)ccc1Cl ZINC000552029155 941570482 /nfs/dbraw/zinc/57/04/82/941570482.db2.gz LDOQXNXQKPCTJE-RHSMWYFYSA-N 0 3 400.277 4.376 20 0 HIADHN OCC1([C@@H](NCc2cc(Br)c3c(c2)OCCO3)c2ccccc2)CCC1 ZINC000552085260 941581782 /nfs/dbraw/zinc/58/17/82/941581782.db2.gz WWFUJOMZCZCMIO-FQEVSTJZSA-N 0 3 418.331 4.214 20 0 HIADHN CNC(=O)COc1cccc(CN[C@H](C)c2cccc(OCc3ccccc3)c2)c1 ZINC000552086428 941581957 /nfs/dbraw/zinc/58/19/57/941581957.db2.gz GVWLCFMEVHTXRE-LJQANCHMSA-N 0 3 404.510 4.241 20 0 HIADHN CC[C@@H](N[C@@H](C)c1cccc(N2CCCS2(=O)=O)c1)c1ccc(OC)c(OC)c1 ZINC000552090435 941583083 /nfs/dbraw/zinc/58/30/83/941583083.db2.gz KCTRDZWQFPHCFB-OXJNMPFZSA-N 0 3 418.559 4.046 20 0 HIADHN C[C@H](NC[C@H](N1CCOCC1)C(F)(F)F)c1ccc(SCC(F)(F)F)cc1 ZINC000552100791 941585139 /nfs/dbraw/zinc/58/51/39/941585139.db2.gz VTBAZNUDYDUODO-WFASDCNBSA-N 0 3 416.431 4.255 20 0 HIADHN CCOc1ccc(-c2nc(C(=O)N(C)CCCN(C)Cc3ccncc3)cs2)cc1 ZINC000552112809 941587527 /nfs/dbraw/zinc/58/75/27/941587527.db2.gz VVAWSPVBCCBWSZ-UHFFFAOYSA-N 0 3 424.570 4.198 20 0 HIADHN C[C@H]1CCc2[nH]c3ccc(C(=O)N(C)CCCN(C)Cc4ccncc4)cc3c2C1 ZINC000552112798 941587596 /nfs/dbraw/zinc/58/75/96/941587596.db2.gz VCWWCEJNBOAISQ-SFHVURJKSA-N 0 3 404.558 4.282 20 0 HIADHN O=C(CCc1nc2ccccc2s1)N1CCN(c2ccnc3ccccc32)CC1 ZINC000552148405 941593672 /nfs/dbraw/zinc/59/36/72/941593672.db2.gz FPEXKFHCMJKNLX-UHFFFAOYSA-N 0 3 402.523 4.126 20 0 HIADHN C[C@H](CC(=O)Nc1cccc(CN2CC[C@H](O)C2)c1)c1ccc(C(F)(F)F)cc1 ZINC000552198772 941600193 /nfs/dbraw/zinc/60/01/93/941600193.db2.gz FJZBJKJUSYIIRD-QRWLVFNGSA-N 0 3 406.448 4.404 20 0 HIADHN O=C(CCCOc1ccc(Cl)cc1Cl)Nc1cccc(CN2CC[C@H](O)C2)c1 ZINC000552199643 941600233 /nfs/dbraw/zinc/60/02/33/941600233.db2.gz CAIMXZDWHXPBMW-SFHVURJKSA-N 0 3 423.340 4.358 20 0 HIADHN O=C(Nc1ccc(Nc2ncccn2)cc1)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000552212848 941604965 /nfs/dbraw/zinc/60/49/65/941604965.db2.gz UPWZUSZKARZFKQ-FQEVSTJZSA-N 0 3 423.467 4.316 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)Cc1ccc(OC)c(OC)c1)c1ccc(Cl)cc1 ZINC000552243476 941612398 /nfs/dbraw/zinc/61/23/98/941612398.db2.gz CNVLDCYIAWLKNH-IBGZPJMESA-N 0 3 404.938 4.099 20 0 HIADHN COC(=O)c1csc([C@@H](C)N[C@H](C)CC(=O)Nc2cccc(N3CCCC3)c2)c1 ZINC000552247323 941613413 /nfs/dbraw/zinc/61/34/13/941613413.db2.gz KMGYPZAXJXTHQK-HZPDHXFCSA-N 0 3 415.559 4.203 20 0 HIADHN CCCc1nc(C)c(CNC2CCC(NC(=O)COc3ccc(Cl)cc3)CC2)o1 ZINC000552257698 941615957 /nfs/dbraw/zinc/61/59/57/941615957.db2.gz RZCWJCFWKPDLIS-UHFFFAOYSA-N 0 3 419.953 4.185 20 0 HIADHN CC[C@H](NCC(=O)N[C@H]1CCOc2ccccc21)c1ccc(OC(F)(F)F)cc1 ZINC000552260467 941616405 /nfs/dbraw/zinc/61/64/05/941616405.db2.gz COSBYUNENHFKPZ-ROUUACIJSA-N 0 3 408.420 4.266 20 0 HIADHN O=C1NCCCN1C1CCN(Cc2ccc(Oc3cc(F)cc(F)c3)cc2)CC1 ZINC000552277827 941620859 /nfs/dbraw/zinc/62/08/59/941620859.db2.gz KZGQHLSVSREIHZ-UHFFFAOYSA-N 0 3 401.457 4.137 20 0 HIADHN CCOc1cc(C[NH2+]C2CCN(c3ccccc3)CC2)cc(Br)c1[O-] ZINC000552285304 941622721 /nfs/dbraw/zinc/62/27/21/941622721.db2.gz IAYOVZGPHUFCQV-UHFFFAOYSA-N 0 3 405.336 4.312 20 0 HIADHN C[S@@](=O)Cc1ccc(CN[C@H]2CCCOc3cc(Br)ccc32)cc1 ZINC000552317808 941630405 /nfs/dbraw/zinc/63/04/05/941630405.db2.gz IHDAVDMXCWQGEY-MHECFPHRSA-N 0 3 408.361 4.331 20 0 HIADHN O=C(N[C@@H]1CCOC2(CCCCC2)C1)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000552388649 941653227 /nfs/dbraw/zinc/65/32/27/941653227.db2.gz MPOMNLLFTOXDQB-WOJBJXKFSA-N 0 3 406.517 4.142 20 0 HIADHN COCc1ccc([C@@H]2CCCN2C(=O)[C@H]2CN(Cc3ccccc3)CCC2(F)F)o1 ZINC000552449065 941675186 /nfs/dbraw/zinc/67/51/86/941675186.db2.gz OMPCBDJLMZJURA-UXHICEINSA-N 0 3 418.484 4.247 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)[C@H]1C[C@H]1c1ccc(Cl)cc1Cl ZINC000552516149 941691954 /nfs/dbraw/zinc/69/19/54/941691954.db2.gz JSLTWHUILPMYKT-WDSOQIARSA-N 0 3 405.325 4.302 20 0 HIADHN Cc1cc(OCCCC(=O)Nc2cccc(CN3CC[C@H](O)C3)c2)ccc1Cl ZINC000552516212 941692211 /nfs/dbraw/zinc/69/22/11/941692211.db2.gz LSPYYPZBZFKDAA-IBGZPJMESA-N 0 3 402.922 4.013 20 0 HIADHN C[C@@H](Cc1cccc(C(F)(F)F)c1)C(=O)Nc1cccc(CN2CC[C@H](O)C2)c1 ZINC000552516473 941693750 /nfs/dbraw/zinc/69/37/50/941693750.db2.gz UKPTXJCUJLIGHF-YWZLYKJASA-N 0 3 406.448 4.089 20 0 HIADHN C/C=C/c1ccc(OC[C@H](O)CNCc2ccc(Br)s2)c(OC)c1 ZINC000553199872 941848312 /nfs/dbraw/zinc/84/83/12/941848312.db2.gz VRMGUTBYVMRJSL-RDFMZFSFSA-N 0 3 412.349 4.082 20 0 HIADHN O=C(NC[C@@H](NCc1ccccc1)c1ccco1)c1ccc(Nc2ccncc2)cc1 ZINC000553214512 941850527 /nfs/dbraw/zinc/85/05/27/941850527.db2.gz CXAQIRPQBFFJIH-HSZRJFAPSA-N 0 3 412.493 4.101 20 0 HIADHN Cc1noc(C)c1CCC(=O)N1CCN(CCCc2ccccc2)C[C@@H]1CC(C)C ZINC000553546797 941906046 /nfs/dbraw/zinc/90/60/46/941906046.db2.gz NNOVLBFIJZJJLS-QHCPKHFHSA-N 0 3 411.590 4.416 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)c2cnc(-c3ccncc3)s2)N(C)C)cc1 ZINC000553670517 941941309 /nfs/dbraw/zinc/94/13/09/941941309.db2.gz ANNBPCLAZDPVMJ-LJQANCHMSA-N 0 3 410.543 4.025 20 0 HIADHN CN1CC[C@@H](NC(=O)NCc2cc(F)c(C(F)(F)F)cc2F)[C@H]1c1ccccc1 ZINC000553703893 941947450 /nfs/dbraw/zinc/94/74/50/941947450.db2.gz NCSCBGYXFMVPBH-QZTJIDSGSA-N 0 3 413.390 4.228 20 0 HIADHN CCCN(C)[C@H](CNC(=O)N1CCC[C@H]([C@H]2CCOC2)C1)c1ccc(Cl)cc1 ZINC000553894792 941992808 /nfs/dbraw/zinc/99/28/08/941992808.db2.gz LHTLHBQGYIFAQV-IRFCIJBXSA-N 0 3 407.986 4.181 20 0 HIADHN CC(C)c1nn(-c2ccc(Br)cc2)cc1CN[C@H](C)CO[C@H]1CCOC1 ZINC000553898978 941994119 /nfs/dbraw/zinc/99/41/19/941994119.db2.gz RDDJCQQSQJVYRW-BEFAXECRSA-N 0 3 422.367 4.042 20 0 HIADHN c1ccc(CN2CCCO[C@@H](CN3CCCC[C@@H]3c3nnc(C4CCC4)o3)C2)cc1 ZINC000553923704 941999721 /nfs/dbraw/zinc/99/97/21/941999721.db2.gz AXZZFBSBQDKOEA-FGZHOGPDSA-N 0 3 410.562 4.155 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)[C@@H]2C[C@H]2c2cc(F)ccc2F)N(C)C)cc1 ZINC000554015496 942019928 /nfs/dbraw/zinc/01/99/28/942019928.db2.gz XQCUWJPCNYSPBQ-DWLFOUALSA-N 0 3 402.485 4.275 20 0 HIADHN C[C@H]1CCc2c(sc3nc(CCN(C)C[C@H]4OCCc5ccccc54)nc(N)c32)C1 ZINC000554030538 942022070 /nfs/dbraw/zinc/02/20/70/942022070.db2.gz ICXGOYFZVOPCRE-HNAYVOBHSA-N 0 3 422.598 4.187 20 0 HIADHN O=C(CCN1CCC[C@H](c2nnc3ccc(C(F)(F)F)cn32)C1)c1ccccc1 ZINC000554063059 942028018 /nfs/dbraw/zinc/02/80/18/942028018.db2.gz ZIHXPJMYRVSPKB-INIZCTEOSA-N 0 3 402.420 4.201 20 0 HIADHN CCOc1cc2c(cc1NC(=O)NC[C@H](N[C@H](C)CC)c1ccco1)O[C@@H](C)C2 ZINC000554068050 942029011 /nfs/dbraw/zinc/02/90/11/942029011.db2.gz SFMGQVUUXJQJSO-VKJFTORMSA-N 0 3 401.507 4.253 20 0 HIADHN COc1cc(Br)ccc1[C@H](C)N[C@@H](C)c1cccc(-n2ccnn2)c1 ZINC000554094209 942034906 /nfs/dbraw/zinc/03/49/06/942034906.db2.gz BEWNVJNVKOZYGT-KBPBESRZSA-N 0 3 401.308 4.450 20 0 HIADHN C[C@@H]1Oc2cc(F)ccc2[C@@H]1NC(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000554183506 942060684 /nfs/dbraw/zinc/06/06/84/942060684.db2.gz YBZBLUYUSMHUFD-YCRPNKLZSA-N 0 3 415.534 4.061 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1ccccc1OC[C@@H]1CCCCO1)c1ccco1 ZINC000554192918 942063236 /nfs/dbraw/zinc/06/32/36/942063236.db2.gz NLHFGNQAMSUCSY-CMKODMSKSA-N 0 3 415.534 4.478 20 0 HIADHN CN(C)[C@@H](CNC(=O)N[C@H](CCO)c1ccc(Cl)c(Cl)c1)c1ccccc1 ZINC000554216605 942070169 /nfs/dbraw/zinc/07/01/69/942070169.db2.gz LBSHMBCIBXDWIF-MOPGFXCFSA-N 0 3 410.345 4.019 20 0 HIADHN CC(C)Cc1ccc([C@H](CNC(=O)Nc2ccc3c(c2)NC(=O)CC3)N(C)C)cc1 ZINC000554232257 942073488 /nfs/dbraw/zinc/07/34/88/942073488.db2.gz CBMUVGIUQRQHNY-QFIPXVFZSA-N 0 3 408.546 4.194 20 0 HIADHN CSC[C@H]1CCCN(C(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)C1 ZINC000554278500 942088284 /nfs/dbraw/zinc/08/82/84/942088284.db2.gz IXMWSOVLIDPYLF-HKUYNNGSSA-N 0 3 400.510 4.043 20 0 HIADHN O=C(CCC(=O)c1ccc(F)cc1F)NC1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1 ZINC000554322594 942103679 /nfs/dbraw/zinc/10/36/79/942103679.db2.gz JYUVFJGMUUONNM-IHWFROFDSA-N 0 3 412.480 4.240 20 0 HIADHN CC[C@H](N[C@H]1CCN(Cc2ccc(OC)cc2OC)C1=O)c1ccc(Cl)cc1 ZINC000554366151 942115520 /nfs/dbraw/zinc/11/55/20/942115520.db2.gz HFPCEZNCMZFDFY-PMACEKPBSA-N 0 3 402.922 4.199 20 0 HIADHN C[C@@H](NC(=O)Nc1cccc(C(=O)N2CCCCC2)c1)[C@@H](c1ccccc1)N(C)C ZINC000554418785 942134796 /nfs/dbraw/zinc/13/47/96/942134796.db2.gz FZWPQXITOWBLOU-GCJKJVERSA-N 0 3 408.546 4.126 20 0 HIADHN CC(C)C[C@H]([NH2+]C[C@H](C)c1ccc(C(F)(F)F)cc1)c1nc(-c2nc[n-]n2)no1 ZINC000554862748 942295479 /nfs/dbraw/zinc/29/54/79/942295479.db2.gz QNQFTDVGKVTPDM-WFASDCNBSA-N 0 3 408.428 4.354 20 0 HIADHN CC(C)C[C@H](NC[C@H](C)c1ccc(C(F)(F)F)cc1)c1nc(-c2nc[nH]n2)no1 ZINC000554862748 942295488 /nfs/dbraw/zinc/29/54/88/942295488.db2.gz QNQFTDVGKVTPDM-WFASDCNBSA-N 0 3 408.428 4.354 20 0 HIADHN C/C(=C/c1ccccc1C(F)(F)F)CN1CCC(C(=O)Nc2nncs2)CC1 ZINC000554880524 942305735 /nfs/dbraw/zinc/30/57/35/942305735.db2.gz IWARNDKHEFSZOH-RAXLEYEMSA-N 0 3 410.465 4.311 20 0 HIADHN Cc1c(Cl)cccc1NC(=O)CN[C@@H]1CCN(C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000554954643 942331842 /nfs/dbraw/zinc/33/18/42/942331842.db2.gz PZTAOKIBWIXIGV-UYAOXDASSA-N 0 3 410.320 4.414 20 0 HIADHN O=C(CCN1CC[C@@H](n2cc(Cl)cn2)C1)N[C@H](c1cccs1)c1ccccc1 ZINC000554959111 942334019 /nfs/dbraw/zinc/33/40/19/942334019.db2.gz BIVZDISUYQRZAO-NQIIRXRSSA-N 0 3 414.962 4.141 20 0 HIADHN Cc1ccc([C@H](OC[C@H](O)CN2CC3(CCC3)[C@@H]2[C@H]2CCCO2)c2ccccc2)cc1 ZINC000554959852 942334149 /nfs/dbraw/zinc/33/41/49/942334149.db2.gz JJVVKNHYTVYOAS-POTDNYQPSA-N 0 3 421.581 4.495 20 0 HIADHN C[C@@H](NC[C@@H](Cc1ccccc1)C(F)(F)F)c1cccc(NS(C)(=O)=O)c1 ZINC000555002974 942351277 /nfs/dbraw/zinc/35/12/77/942351277.db2.gz LNDGUPGNPNHOFN-RHSMWYFYSA-N 0 3 400.466 4.130 20 0 HIADHN CC(C)C(=O)c1ccc([C@@H](C)C(=O)NC2CCN([C@H](C)c3ccncc3)CC2)cc1 ZINC000555010147 942354666 /nfs/dbraw/zinc/35/46/66/942354666.db2.gz CQNLHJCQDKPZIF-RTBURBONSA-N 0 3 407.558 4.366 20 0 HIADHN CCN1CC[C@H](NC(=O)c2cccc3nc(C)[nH]c32)[C@H]1c1ccc(Cl)c(F)c1 ZINC000555011879 942356029 /nfs/dbraw/zinc/35/60/29/942356029.db2.gz UZWLPZRJICMVKD-AZUAARDMSA-N 0 3 400.885 4.229 20 0 HIADHN CCn1nccc1CCN1CCc2c(cccc2NC(=O)Nc2ccccc2F)C1 ZINC000555014532 942357296 /nfs/dbraw/zinc/35/72/96/942357296.db2.gz FLUKCPAXZMLFHD-UHFFFAOYSA-N 0 3 407.493 4.287 20 0 HIADHN COc1ccc([C@H](CNc2ncc(C)c(-c3ccccc3F)n2)N(C)C)cc1OC ZINC000555121929 942390961 /nfs/dbraw/zinc/39/09/61/942390961.db2.gz RGYXJHIDQXJPRT-IBGZPJMESA-N 0 3 410.493 4.323 20 0 HIADHN CCN1CC[C@H](NCC(=O)N(CC(F)(F)F)C(C)C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000555133077 942397555 /nfs/dbraw/zinc/39/75/55/942397555.db2.gz YZAKXQFKFDMHIV-WMZOPIPTSA-N 0 3 423.882 4.003 20 0 HIADHN CCN1CC[C@H](N[C@@H](C)C(=O)Nc2cccc(C)c2)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000555132485 942397567 /nfs/dbraw/zinc/39/75/67/942397567.db2.gz IZVIKTAMMYPNPH-ONTRVFCTSA-N 0 3 405.464 4.164 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@@H](N[C@H](CN2CCCC2=O)c2ccccc2)c2ccccc21 ZINC000555170239 942414498 /nfs/dbraw/zinc/41/44/98/942414498.db2.gz SOTORMKPMJRZIA-DNVJHFABSA-N 0 3 406.526 4.122 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@H](C)[C@H]1NS(=O)(=O)Cc1ccc(C(F)F)cc1 ZINC000555320818 942475231 /nfs/dbraw/zinc/47/52/31/942475231.db2.gz WHHIPDWHZLMVDN-LFUKPOHLSA-N 0 3 422.541 4.200 20 0 HIADHN CCC[C@@H]1CN(c2nnc(C3CCC3)n2C[C@@H]2CCCO2)CCN1Cc1ccccc1 ZINC000555394872 942512337 /nfs/dbraw/zinc/51/23/37/942512337.db2.gz LXHCVNBSKOJFJI-PKTZIBPZSA-N 0 3 423.605 4.216 20 0 HIADHN CSc1ccc([C@@H](CNCc2cc3c(cc2OC(F)F)OCO3)N(C)C)cc1 ZINC000555644320 942686061 /nfs/dbraw/zinc/68/60/61/942686061.db2.gz CPKYXUPYKDCTCN-MRXNPFEDSA-N 0 3 410.486 4.131 20 0 HIADHN CCS(=O)(=O)c1ccc([C@@H](C)NCCOc2ccc(C(F)(F)F)cc2)cc1 ZINC000555710413 942708215 /nfs/dbraw/zinc/70/82/15/942708215.db2.gz HVQFVVHUDPDTCU-CQSZACIVSA-N 0 3 401.450 4.229 20 0 HIADHN Cc1cccn2c(=O)cc(CN3CCC(c4ccc(OC(F)(F)F)cc4)CC3)nc12 ZINC000555729276 942715365 /nfs/dbraw/zinc/71/53/65/942715365.db2.gz QECUVCGDOIVQRS-UHFFFAOYSA-N 0 3 417.431 4.281 20 0 HIADHN CC[C@H](CNC(=O)N1CCC(OC2CCCCC2)CC1)N1CCc2ccccc2C1 ZINC000555738387 942717502 /nfs/dbraw/zinc/71/75/02/942717502.db2.gz IDWWYESAPYLBSV-JOCHJYFZSA-N 0 3 413.606 4.347 20 0 HIADHN COc1cnccc1[C@H](C)NC[C@@H](O)CO[C@H](c1ccccc1)c1ccccc1C ZINC000556018123 942786586 /nfs/dbraw/zinc/78/65/86/942786586.db2.gz GSQWMCLPIWCQPW-PIBDYAPNSA-N 0 3 406.526 4.216 20 0 HIADHN CN1CC[C@H](CN[C@H](c2nc[nH]n2)c2ccc(F)cc2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000556118775 942807672 /nfs/dbraw/zinc/80/76/72/942807672.db2.gz LAIMHLIIQPAMQA-UIAACRFSSA-N 0 3 417.891 4.108 20 0 HIADHN Fc1ccc([C@H]2C[C@H](N[C@@H](c3cccs3)c3nnc[nH]3)C2)cc1Br ZINC000556177945 942814691 /nfs/dbraw/zinc/81/46/91/942814691.db2.gz AMNKKZVOMTXTBO-MKBNYLNASA-N 0 3 407.312 4.393 20 0 HIADHN FC(F)(F)c1ccn(-c2ccc(CNCc3ccnc(N4CCCC4)c3)cc2)n1 ZINC000556191902 942816979 /nfs/dbraw/zinc/81/69/79/942816979.db2.gz XGKKLVYYGFKHSZ-UHFFFAOYSA-N 0 3 401.436 4.176 20 0 HIADHN C[C@@H](NCCCS(=O)(=O)c1ccc(Cl)cc1)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000556260898 942828062 /nfs/dbraw/zinc/82/80/62/942828062.db2.gz MIPIJWCBSUXEMP-CQSZACIVSA-N 0 3 420.962 4.084 20 0 HIADHN Ic1cccc(CN[C@@H](c2ccc3c(c2)OCCO3)C2CC2)c1 ZINC000556387421 942854932 /nfs/dbraw/zinc/85/49/32/942854932.db2.gz MADWKHKEUSJZDJ-LJQANCHMSA-N 0 3 421.278 4.303 20 0 HIADHN Cc1ccc2cc(CNCc3cccc(N4C(=O)N[C@@](C)(C5CC5)C4=O)c3)ccc2n1 ZINC000556412407 942860175 /nfs/dbraw/zinc/86/01/75/942860175.db2.gz DBMBTCZBEGDJOO-VWLOTQADSA-N 0 3 414.509 4.058 20 0 HIADHN Cc1ccn(-c2ccccc2CNCc2cccc(I)c2)n1 ZINC000556416647 942860897 /nfs/dbraw/zinc/86/08/97/942860897.db2.gz PCYOQPGRJUFJIS-UHFFFAOYSA-N 0 3 403.267 4.075 20 0 HIADHN CN(C(=O)CN[C@@H](c1cccc(C(F)(F)F)c1)C1CCOCC1)c1ccccc1 ZINC000556512923 942888843 /nfs/dbraw/zinc/88/88/43/942888843.db2.gz NZNDNBGNACOPLA-OAQYLSRUSA-N 0 3 406.448 4.426 20 0 HIADHN O=C(c1ccc(F)cc1)C1CCN(C[C@@H]2CN(Cc3ccccc3)CCCO2)CC1 ZINC000556531498 942893051 /nfs/dbraw/zinc/89/30/51/942893051.db2.gz ZZYLPVLOLLCFDK-XMMPIXPASA-N 0 3 410.533 4.012 20 0 HIADHN C[C@H](NCc1cccc(N2C(=O)N[C@](C)(C3CC3)C2=O)c1)c1ccc2c(c1)CCC2 ZINC000556607258 942912890 /nfs/dbraw/zinc/91/28/90/942912890.db2.gz BUMINLNBZFPQBI-IVCQMTBJSA-N 0 3 403.526 4.251 20 0 HIADHN FC(F)CN1CCSc2ccc(NC3CCN(Cc4ccncc4)CC3)cc21 ZINC000556606034 942913176 /nfs/dbraw/zinc/91/31/76/942913176.db2.gz QAPPKMPTWVCYSC-UHFFFAOYSA-N 0 3 404.530 4.335 20 0 HIADHN Ic1cccc(CN2CCC(c3ncc4n3CCCC4)CC2)c1 ZINC000556628079 942920470 /nfs/dbraw/zinc/92/04/70/942920470.db2.gz ZBFLZCHRDSPMJW-UHFFFAOYSA-N 0 3 421.326 4.204 20 0 HIADHN C[C@H]1CCc2c(sc3nc(CCC(=O)Nc4ccccc4CN(C)C)[nH]c(=O)c32)C1 ZINC000556665135 942928424 /nfs/dbraw/zinc/92/84/24/942928424.db2.gz FTKFYNCOXQBWKI-AWEZNQCLSA-N 0 3 424.570 4.155 20 0 HIADHN CCc1c(C(=O)N(C)C[C@H]2CCN(Cc3ccc(C)s3)C2)[nH]c(C)c1C(C)=O ZINC000556829780 942937618 /nfs/dbraw/zinc/93/76/18/942937618.db2.gz VADMYPVKSNWFEE-QGZVFWFLSA-N 0 3 401.576 4.052 20 0 HIADHN CCc1c(C(=O)N(C)C[C@@H]2CCN(Cc3ccc(C)s3)C2)[nH]c(C)c1C(C)=O ZINC000556829779 942937792 /nfs/dbraw/zinc/93/77/92/942937792.db2.gz VADMYPVKSNWFEE-KRWDZBQOSA-N 0 3 401.576 4.052 20 0 HIADHN CC(C)c1ccc([C@H](NC[C@@H](O)CN2C[C@@H](C)O[C@@H](C)C2)c2cccs2)cc1 ZINC000556853785 942940597 /nfs/dbraw/zinc/94/05/97/942940597.db2.gz NXPUWPIVVHOGSL-JHBZICRXSA-N 0 3 402.604 4.021 20 0 HIADHN O[C@H](CN[C@@H]1CCOc2c(Cl)cccc21)COc1ccc(Cl)cc1Cl ZINC000556859918 942942431 /nfs/dbraw/zinc/94/24/31/942942431.db2.gz QVOFZTVKFPCLDE-MLGOLLRUSA-N 0 3 402.705 4.500 20 0 HIADHN COc1ccc(C)cc1NC(=O)[C@H](C)N[C@H]1CCC[C@H]1Oc1cc(F)cc(F)c1 ZINC000556881551 942948878 /nfs/dbraw/zinc/94/88/78/942948878.db2.gz WKXIPTNBWWZOPM-DHUIEDIVSA-N 0 3 404.457 4.199 20 0 HIADHN CCOc1cc(CN2CC[C@H](c3ccccc3F)C2)ccc1O[C@H](C)C(=O)N(C)C ZINC000556883742 942949641 /nfs/dbraw/zinc/94/96/41/942949641.db2.gz XEPSFRHENOMXLN-MJGOQNOKSA-N 0 3 414.521 4.069 20 0 HIADHN Cc1cc(I)cc(NC2CCN(CCC(F)(F)F)CC2)c1 ZINC000556921284 942966172 /nfs/dbraw/zinc/96/61/72/942966172.db2.gz MZBQULNFEOZKDO-UHFFFAOYSA-N 0 3 412.237 4.428 20 0 HIADHN O=C(NCC1CCN(Cc2ccccc2Cl)CC1)c1cccc(Cn2ccnc2)c1 ZINC000557042863 943003179 /nfs/dbraw/zinc/00/31/79/943003179.db2.gz ZWAAXXIEKQSCPZ-UHFFFAOYSA-N 0 3 422.960 4.227 20 0 HIADHN CCCN(C)[C@H](CNC(=O)c1cc2c(C)nn(C)c2nc1C)c1ccc(Cl)cc1 ZINC000557062350 943009333 /nfs/dbraw/zinc/00/93/33/943009333.db2.gz NGJIDXQQRLHYQI-HXUWFJFHSA-N 0 3 413.953 4.051 20 0 HIADHN Cc1c(CNC[C@@H](O)COc2ccc(Br)cc2)oc2ccc(F)cc12 ZINC000557218331 943054302 /nfs/dbraw/zinc/05/43/02/943054302.db2.gz CTWBGIMJHCVHAG-OAHLLOKOSA-N 0 3 408.267 4.172 20 0 HIADHN COC[C@H](NC[C@@H]1CCN(c2cc(OC)cc(OC)c2)C1)c1cccc(Cl)c1F ZINC000557451450 943135633 /nfs/dbraw/zinc/13/56/33/943135633.db2.gz JEAJCAAAMXMLKG-BTYIYWSLSA-N 0 3 422.928 4.300 20 0 HIADHN CCCCO[C@@H]1C[C@@H](NCC(=O)Nc2c(F)cc(F)cc2Br)C1(C)C ZINC000557520485 943187606 /nfs/dbraw/zinc/18/76/06/943187606.db2.gz HVQMGTGIZSVROQ-HUUCEWRRSA-N 0 3 419.310 4.239 20 0 HIADHN Nc1nccc([C@H]2CCCN(Cc3ccc(-c4cccc(Br)c4)o3)C2)n1 ZINC000557522341 943189742 /nfs/dbraw/zinc/18/97/42/943189742.db2.gz KIEVSSVMLJQWQT-HNNXBMFYSA-N 0 3 413.319 4.461 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)[C@@H]1CCn2c(cnc2C2CCCCC2)C1 ZINC000557630524 943239296 /nfs/dbraw/zinc/23/92/96/943239296.db2.gz RQARHNZKCOYAQB-OAQYLSRUSA-N 0 3 400.611 4.218 20 0 HIADHN O=C(C1CC(c2cccc(F)c2)C1)N1CCC[C@@H](c2n[nH]cc2CN2CCCC2)C1 ZINC000557646932 943247289 /nfs/dbraw/zinc/24/72/89/943247289.db2.gz MPALAZRIFQCNTP-XEVCZEQESA-N 0 3 410.537 4.044 20 0 HIADHN CC(C)CN(C)c1ccc(C(=O)N2CCC[C@@H](c3n[nH]cc3CN3CCCC3)C2)cc1 ZINC000557648217 943248387 /nfs/dbraw/zinc/24/83/87/943248387.db2.gz YVZOVTVIWCUKQR-OAQYLSRUSA-N 0 3 423.605 4.118 20 0 HIADHN C[C@@H]1C[C@H](N(C)S(=O)(=O)c2ccc(C(F)F)cc2)CCN1Cc1ccccc1 ZINC000557824743 943305142 /nfs/dbraw/zinc/30/51/42/943305142.db2.gz LBVDYYXPRMEDOQ-VQIMIIECSA-N 0 3 408.514 4.298 20 0 HIADHN COCCCCN(Cc1ccccc1)C(=O)N[C@H]1CCN(Cc2ccccc2)[C@@H]1C ZINC000557885527 943320752 /nfs/dbraw/zinc/32/07/52/943320752.db2.gz UFSOLRNIKDKKGM-QPPBQGQZSA-N 0 3 409.574 4.288 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)[C@H](C)Oc1cccc(Br)c1)c1ccco1 ZINC000557911280 943326987 /nfs/dbraw/zinc/32/69/87/943326987.db2.gz DNPIBHQGDWEIPE-GRDNDAEWSA-N 0 3 409.324 4.055 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)c1cccc(C(=O)N(C)CC(C)(C)C)c1)c1ccco1 ZINC000557916817 943328147 /nfs/dbraw/zinc/32/81/47/943328147.db2.gz SDFYPMJZBLXLIC-PXNSSMCTSA-N 0 3 413.562 4.257 20 0 HIADHN CC(C)Cc1ccc([C@H](CNC(=O)c2cccc(NC(=O)N(C)C)c2)N(C)C)cc1 ZINC000557989213 943348262 /nfs/dbraw/zinc/34/82/62/943348262.db2.gz VELYVNJKISXHJQ-QFIPXVFZSA-N 0 3 410.562 4.011 20 0 HIADHN C[C@@H]1C[C@H]1N1CCN(C(=O)c2cc(C(F)(F)F)ccc2Br)C[C@@H](C)C1 ZINC000558026736 943359927 /nfs/dbraw/zinc/35/99/27/943359927.db2.gz YEWFUTZATWNHHX-HWWQOWPSSA-N 0 3 419.285 4.270 20 0 HIADHN C[C@@H]1C[C@@H]1N1CCN(C(=O)C2(Cc3ccc(OC(F)(F)F)cc3)CC2)C[C@@H](C)C1 ZINC000558027727 943360617 /nfs/dbraw/zinc/36/06/17/943360617.db2.gz SUYJRCBCTJUGNG-FCEWJHQRSA-N 0 3 410.480 4.097 20 0 HIADHN O=C(NCc1c(F)cccc1N1CCCC1)NC[C@H](c1ccccc1)N1CCCC1 ZINC000558105973 943380443 /nfs/dbraw/zinc/38/04/43/943380443.db2.gz UAKXFZIDOCEZMV-HSZRJFAPSA-N 0 3 410.537 4.062 20 0 HIADHN COc1ccc(-c2ocnc2C(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000558147523 943396631 /nfs/dbraw/zinc/39/66/31/943396631.db2.gz QGPAXNXUVCDEOI-FQEVSTJZSA-N 0 3 405.498 4.087 20 0 HIADHN CCN(C(=O)Nc1cc2[nH]ccc2c(C(=O)OC)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000558202506 943429627 /nfs/dbraw/zinc/42/96/27/943429627.db2.gz HQHVZHITRAZCPS-IBGZPJMESA-N 0 3 420.513 4.083 20 0 HIADHN COC[C@@H](NC1CCN(C(=O)c2cc(Cl)c[nH]2)CC1)c1cccc(Cl)c1F ZINC000558257874 943463174 /nfs/dbraw/zinc/46/31/74/943463174.db2.gz ZAUWFDMLIBHBCD-QGZVFWFLSA-N 0 3 414.308 4.043 20 0 HIADHN C[C@@H](NC(=O)Nc1ccc(-c2noc(C(F)F)n2)cc1)[C@H](c1ccccc1)N(C)C ZINC000558352059 943521035 /nfs/dbraw/zinc/52/10/35/943521035.db2.gz LDCFBVGASCRNNZ-CXAGYDPISA-N 0 3 415.444 4.487 20 0 HIADHN CCOC(=O)c1nnc(-c2cccc(C[NH2+]Cc3cc4c(ccc(C)c4C)[nH]3)c2)[n-]1 ZINC000558420975 943554859 /nfs/dbraw/zinc/55/48/59/943554859.db2.gz XOBPTBZMPGTHNL-UHFFFAOYSA-N 0 3 403.486 4.036 20 0 HIADHN CCOC(=O)c1nc(-c2cccc(C[NH2+]Cc3cc4c(ccc(C)c4C)[nH]3)c2)n[n-]1 ZINC000558420975 943554865 /nfs/dbraw/zinc/55/48/65/943554865.db2.gz XOBPTBZMPGTHNL-UHFFFAOYSA-N 0 3 403.486 4.036 20 0 HIADHN Cn1cc(-c2ccc(CN3CC[C@H](Oc4ccc(C(F)(F)F)cn4)C3)s2)cn1 ZINC000558422976 943556107 /nfs/dbraw/zinc/55/61/07/943556107.db2.gz ZCLTZORKKGYWBV-HNNXBMFYSA-N 0 3 408.449 4.216 20 0 HIADHN Cc1ccc(-c2cc(C(=O)N3[C@@H]4CC[C@H]3CCN(C)C4)c3cnn(C(C)C)c3n2)cc1 ZINC000558426856 943557097 /nfs/dbraw/zinc/55/70/97/943557097.db2.gz CRSZNSMQTRYEPT-VQTJNVASSA-N 0 3 417.557 4.296 20 0 HIADHN C[C@H](N[C@@H]1CCN(C)[C@H]1c1ccc(Cl)cc1)C(=O)Nc1ccc(F)cc1Cl ZINC000558467066 943567585 /nfs/dbraw/zinc/56/75/85/943567585.db2.gz NCJFQNFGLMNZSP-RQUSPXKASA-N 0 3 410.320 4.495 20 0 HIADHN C[C@H](N[C@H]1c2ccccc2CC12CCOCC2)C(=O)N1c2ccccc2CC[C@@H]1C ZINC000558483922 943571826 /nfs/dbraw/zinc/57/18/26/943571826.db2.gz MHSGLBAFNAWRBD-JXQFQVJHSA-N 0 3 404.554 4.427 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(F)cc2)CC1)[C@@H]1C[C@@H]1c1ccccc1Cl ZINC000558503899 943578487 /nfs/dbraw/zinc/57/84/87/943578487.db2.gz HAYGUPXPUSRKRH-NHCUHLMSSA-N 0 3 416.924 4.242 20 0 HIADHN COc1ccc2c(c1)CCC[C@@H]2NCc1cccc(N2C(=O)NC3(CCCC3)C2=O)c1 ZINC000558506946 943579438 /nfs/dbraw/zinc/57/94/38/943579438.db2.gz AJAUFBQJNINMEE-QFIPXVFZSA-N 0 3 419.525 4.231 20 0 HIADHN COCCCN(C(=O)[C@@H](C)Cc1ccc(Cl)cc1Cl)C1CCN(C)CC1 ZINC000558613194 943617487 /nfs/dbraw/zinc/61/74/87/943617487.db2.gz RUSCRVYVDQOOOJ-HNNXBMFYSA-N 0 3 401.378 4.131 20 0 HIADHN COCCCN(C(=O)[C@H](C)Cc1ccc(Cl)cc1Cl)C1CCN(C)CC1 ZINC000558613195 943617605 /nfs/dbraw/zinc/61/76/05/943617605.db2.gz RUSCRVYVDQOOOJ-OAHLLOKOSA-N 0 3 401.378 4.131 20 0 HIADHN O[C@@H](CNC[C@H](c1ccc(Cl)cc1)N1CCc2sccc2C1)C(F)(F)F ZINC000558628627 943621646 /nfs/dbraw/zinc/62/16/46/943621646.db2.gz NMRYLTPQMFEESW-WBVHZDCISA-N 0 3 404.885 4.014 20 0 HIADHN Cc1ccc(Cc2ccccn2)cc1NC(=O)CCN1CCN(c2ccccc2)CC1 ZINC000558737506 943636091 /nfs/dbraw/zinc/63/60/91/943636091.db2.gz DAIZLGSHHBZNBS-UHFFFAOYSA-N 0 3 414.553 4.132 20 0 HIADHN CC[C@H](N[C@@H](C)c1ccc(Br)cn1)[C@@H]1CN(Cc2ccccc2)CCO1 ZINC000558741180 943636720 /nfs/dbraw/zinc/63/67/20/943636720.db2.gz VWECNBUSAAHTBL-LRQRDZAKSA-N 0 3 418.379 4.174 20 0 HIADHN CCN(CC)C(=O)c1ccc(NC(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)cc1 ZINC000558755769 943647376 /nfs/dbraw/zinc/64/73/76/943647376.db2.gz RXIQLJYXZZDLIQ-HXUWFJFHSA-N 0 3 416.953 4.246 20 0 HIADHN CCc1nc2cc(CNCc3c(C)n(C)n(-c4ccccc4)c3=O)ccc2n1C1CC1 ZINC000558780085 943660196 /nfs/dbraw/zinc/66/01/96/943660196.db2.gz UPQPGHWONJGJLG-UHFFFAOYSA-N 0 3 415.541 4.021 20 0 HIADHN CCn1c([C@H]2OCC[C@H]2c2ccccc2)nnc1N1CCN(CCC(C)(C)C)CC1 ZINC000558827699 943682518 /nfs/dbraw/zinc/68/25/18/943682518.db2.gz JBPOTXNBPPMTII-SFTDATJTSA-N 0 3 411.594 4.101 20 0 HIADHN CC(C)c1noc(Cc2ccc(NC(=O)NC[C@H](Cc3ccccc3)N(C)C)cc2)n1 ZINC000558848269 943697856 /nfs/dbraw/zinc/69/78/56/943697856.db2.gz XDXDJYUUQNNTJO-NRFANRHFSA-N 0 3 421.545 4.078 20 0 HIADHN COc1ccc(CNC(=O)CN[C@@H](c2cccc(C(F)(F)F)c2)C2CC2)cc1OC ZINC000558864681 943706829 /nfs/dbraw/zinc/70/68/29/943706829.db2.gz ZSFFOYJZECMYRC-OAQYLSRUSA-N 0 3 422.447 4.080 20 0 HIADHN CN(C)C[C@@H](NC(=O)NCc1csc(Br)c1)c1ccc(Cl)cc1 ZINC000558865326 943707226 /nfs/dbraw/zinc/70/72/26/943707226.db2.gz ICGZVLYIIWEJIQ-CQSZACIVSA-N 0 3 416.772 4.266 20 0 HIADHN COc1ccc(CN(Cc2ccc(-n3cncn3)cc2)C2CC2)cc1Br ZINC000558887607 943721026 /nfs/dbraw/zinc/72/10/26/943721026.db2.gz YAWLHDPPBPOMSE-UHFFFAOYSA-N 0 3 413.319 4.203 20 0 HIADHN COc1cccc([C@@H]2[C@@H](NCC(=O)N[C@H](c3ccccc3)C(C)C)CCN2C2CC2)c1 ZINC000558902663 943737299 /nfs/dbraw/zinc/73/72/99/943737299.db2.gz TXCBECYTSJEHSA-AYRHNUGRSA-N 0 3 421.585 4.076 20 0 HIADHN CN(C)C[C@H](NC(=O)c1ccc(OCc2ccccn2)cc1)c1ccc(Cl)cc1 ZINC000558973409 943777676 /nfs/dbraw/zinc/77/76/76/943777676.db2.gz ROTSEMYFRGYAMU-QFIPXVFZSA-N 0 3 409.917 4.347 20 0 HIADHN C[C@@H](N[C@@H](CN1CCN(C)CC1)c1ccccc1)c1cc(Br)cs1 ZINC000559087065 943832240 /nfs/dbraw/zinc/83/22/40/943832240.db2.gz OAOGSVBDAPQNIB-QAPCUYQASA-N 0 3 408.409 4.150 20 0 HIADHN C[C@H](Oc1ccccc1NC(=O)[C@H]1CCCN(Cc2cccnc2)C1)C(F)(F)F ZINC000559099079 943838280 /nfs/dbraw/zinc/83/82/80/943838280.db2.gz BZTLTRWPRLADLM-RDJZCZTQSA-N 0 3 407.436 4.262 20 0 HIADHN O=S(=O)(CCCNCc1cccc(OCC(F)(F)F)c1)c1ccc(Cl)cc1 ZINC000559359835 943910654 /nfs/dbraw/zinc/91/06/54/943910654.db2.gz XLASDSKFSKYKPA-UHFFFAOYSA-N 0 3 421.868 4.235 20 0 HIADHN CCO[C@@H]1C[C@H](NCc2cccc(NC(=O)c3ccc(Cl)cc3)c2)[C@H]1n1cccn1 ZINC000559365047 943912336 /nfs/dbraw/zinc/91/23/36/943912336.db2.gz OOQROHHOXKWGAC-BHDDXSALSA-N 0 3 424.932 4.297 20 0 HIADHN COC(=O)c1c(CN2CCC[C@H](CO)CC2)nc2ccccc2c1-c1ccccc1 ZINC000559458329 943962672 /nfs/dbraw/zinc/96/26/72/943962672.db2.gz BPRLFGSYUQKTLZ-SFHVURJKSA-N 0 3 404.510 4.283 20 0 HIADHN COc1cccc(Br)c1OC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000559636619 944021818 /nfs/dbraw/zinc/02/18/18/944021818.db2.gz NYDIENHMOPXPAY-QGZVFWFLSA-N 0 3 406.320 4.128 20 0 HIADHN Cc1cccc(-c2cccc(CN[C@H]3CCCc4cc(S(N)(=O)=O)ccc43)c2)c1 ZINC000559752774 944044447 /nfs/dbraw/zinc/04/44/47/944044447.db2.gz UMLFCHDKCTZOHH-DEOSSOPVSA-N 0 3 406.551 4.477 20 0 HIADHN CC(C)(CN[C@@H](c1nnc[nH]1)c1ccc(F)cc1)c1cccc(Br)c1 ZINC000559754294 944044869 /nfs/dbraw/zinc/04/48/69/944044869.db2.gz YQFJYXAGEKNLDG-QGZVFWFLSA-N 0 3 403.299 4.363 20 0 HIADHN Cc1ccc(NC(=O)[C@H](C)N[C@H]2CCN(C)[C@H]2c2ccccc2)c(Br)c1 ZINC000559793092 944052262 /nfs/dbraw/zinc/05/22/62/944052262.db2.gz IPFZAOBNNULMPO-YSSFQJQWSA-N 0 3 416.363 4.120 20 0 HIADHN CN1CC[C@H](NCc2cn3cc(Cl)cc(Cl)c3n2)[C@@H]1c1ccc(F)c(F)c1 ZINC000559793637 944052641 /nfs/dbraw/zinc/05/26/41/944052641.db2.gz OITHOEDMLNTDAQ-ROUUACIJSA-N 0 3 411.283 4.454 20 0 HIADHN CCOC1(CN[C@@H](c2ccc(C)cc2)c2cccc(S(C)(=O)=O)c2)CCCC1 ZINC000559891415 944077689 /nfs/dbraw/zinc/07/76/89/944077689.db2.gz XWGYXWOIWDJKDQ-QFIPXVFZSA-N 0 3 401.572 4.427 20 0 HIADHN CC[C@H](Cn1cncn1)N[C@@H](c1cccc(F)c1)c1cccc(Br)c1 ZINC000559913405 944083858 /nfs/dbraw/zinc/08/38/58/944083858.db2.gz KMYOUEPRLATKHU-RTBURBONSA-N 0 3 403.299 4.338 20 0 HIADHN COc1cc(C)c([C@@H](C)NCCCS(=O)(=O)c2ccc(Cl)cc2)cc1OC ZINC000559917990 944084626 /nfs/dbraw/zinc/08/46/26/944084626.db2.gz CWQHQSIWAPWLBF-OAHLLOKOSA-N 0 3 411.951 4.180 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)Nc1ccc(Oc2cccnc2)nc1 ZINC000559965649 944102835 /nfs/dbraw/zinc/10/28/35/944102835.db2.gz KWVMSCUXPGGXQS-FQEVSTJZSA-N 0 3 403.486 4.055 20 0 HIADHN CCN(C(=O)CNC1(c2cccc(C(F)(F)F)c2)CCOCC1)C1CCCCC1 ZINC000559989153 944114115 /nfs/dbraw/zinc/11/41/15/944114115.db2.gz GAPSLKAWYKDILW-UHFFFAOYSA-N 0 3 412.496 4.482 20 0 HIADHN O=S(=O)(CCCNCc1cnc(-c2ccc(Cl)cc2)s1)c1ccccc1 ZINC000560051365 944141877 /nfs/dbraw/zinc/14/18/77/944141877.db2.gz ZZDBIDXLCAUABF-UHFFFAOYSA-N 0 3 406.960 4.417 20 0 HIADHN Cc1ccc2nc(CNC3CCN(Cc4cccc(C(F)(F)F)c4)CC3)cn2c1 ZINC000560070135 944148498 /nfs/dbraw/zinc/14/84/98/944148498.db2.gz KHNHGXXLQZPOSP-UHFFFAOYSA-N 0 3 402.464 4.416 20 0 HIADHN C[C@H](CCN1CCN(C)CC1)NC(=O)N[C@@H]1CCCCC[C@H]1c1ccc(Cl)cc1 ZINC000560105295 944160423 /nfs/dbraw/zinc/16/04/23/944160423.db2.gz CATGQZFPJSQFIA-BVYCBKJFSA-N 0 3 421.029 4.082 20 0 HIADHN O=C(CCCc1cc(F)ccc1F)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000560144181 944177232 /nfs/dbraw/zinc/17/72/32/944177232.db2.gz HZDDBRBNVUBSQE-UHFFFAOYSA-N 0 3 402.485 4.131 20 0 HIADHN CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C[C@H](O)COCc1ccco1 ZINC000560175952 944187232 /nfs/dbraw/zinc/18/72/32/944187232.db2.gz WWKIZIYZCQCUAT-HNNXBMFYSA-N 0 3 411.342 4.327 20 0 HIADHN CC(C)Oc1ccc([C@@H](C)NCc2ccc(S(=O)(=O)N(C)C)cc2)cc1Cl ZINC000560243598 944205902 /nfs/dbraw/zinc/20/59/02/944205902.db2.gz MXULKUDZQCDURJ-OAHLLOKOSA-N 0 3 410.967 4.228 20 0 HIADHN Cc1ccc([C@@H](NCc2cccc(N3C(=O)N[C@@](C)(C4CC4)C3=O)c2)C2CC2)cc1 ZINC000560270917 944214907 /nfs/dbraw/zinc/21/49/07/944214907.db2.gz UPHMSFGEDXMMAY-RDGATRHJSA-N 0 3 403.526 4.461 20 0 HIADHN Cc1oc(-c2ccccc2)nc1CC(=O)N1CCN(c2ccnc3ccccc32)CC1 ZINC000560490344 944237463 /nfs/dbraw/zinc/23/74/63/944237463.db2.gz RBYWGTPGZRCSPO-UHFFFAOYSA-N 0 3 412.493 4.090 20 0 HIADHN O=C(c1cccc(OCc2cccnc2)c1)N1CCN(c2ccnc3ccccc32)CC1 ZINC000560489976 944238066 /nfs/dbraw/zinc/23/80/66/944238066.db2.gz SQHWDNGKYDWJAN-UHFFFAOYSA-N 0 3 424.504 4.171 20 0 HIADHN C/C=C/c1ccc(OC[C@H](O)CN[C@H]2CCOc3c(Cl)cccc32)c(OC)c1 ZINC000560515481 944240055 /nfs/dbraw/zinc/24/00/55/944240055.db2.gz USUMLOYBJFHHDL-HSLQUGRPSA-N 0 3 403.906 4.235 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@@H](C)N[C@H](C)c2cc(C(=O)OC)cs2)CC1 ZINC000560528250 944242376 /nfs/dbraw/zinc/24/23/76/944242376.db2.gz OJGCDKGMPGDZPA-HZPDHXFCSA-N 0 3 419.566 4.228 20 0 HIADHN COC(=O)c1ccc(C)c(NC(=O)[C@H](C)N[C@@H]2CC[C@@H](c3ccccc3)C[C@H]2OC)c1 ZINC000560539025 944247633 /nfs/dbraw/zinc/24/76/33/944247633.db2.gz ZSORIYOMFPQMKC-ICGULJKJSA-N 0 3 424.541 4.050 20 0 HIADHN CN(CCCN(C)Cc1nc(-c2cccc(C(F)(F)F)c2)no1)Cc1ccco1 ZINC000560539182 944248149 /nfs/dbraw/zinc/24/81/49/944248149.db2.gz ASWUKMYTRVXRQY-UHFFFAOYSA-N 0 3 408.424 4.302 20 0 HIADHN CN(Cc1nc2c(s1)CCCC2)C(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000560553401 944252470 /nfs/dbraw/zinc/25/24/70/944252470.db2.gz CJMNJBJUMIDHHH-QGZVFWFLSA-N 0 3 419.541 4.138 20 0 HIADHN CCC[C@H](C)C(=O)NCCNCc1cnc(-c2ccc(Br)cc2)s1 ZINC000560556249 944253345 /nfs/dbraw/zinc/25/33/45/944253345.db2.gz HTKBWFIALHVWTF-ZDUSSCGKSA-N 0 3 410.381 4.215 20 0 HIADHN CNS(=O)(=O)c1cccc([C@H](C)NC[C@H](OCC2CC2)c2ccc(Cl)cc2)c1 ZINC000560570528 944258038 /nfs/dbraw/zinc/25/80/38/944258038.db2.gz RIKFMWWPVHZAGA-BTYIYWSLSA-N 0 3 422.978 4.067 20 0 HIADHN C[C@@H](N[C@H](CCO)c1ccc(Cl)c(Cl)c1)c1ccc(NS(C)(=O)=O)cc1 ZINC000560584274 944262861 /nfs/dbraw/zinc/26/28/61/944262861.db2.gz ABHSVFUTUOIFNB-KZULUSFZSA-N 0 3 417.358 4.139 20 0 HIADHN CN(CCCN(C)C(=O)[C@@H]1C[C@H]1c1cccc(Cl)c1Cl)Cc1ccncc1 ZINC000560596356 944267911 /nfs/dbraw/zinc/26/79/11/944267911.db2.gz YKMQDJJZBFIFSQ-ZWKOTPCHSA-N 0 3 406.357 4.472 20 0 HIADHN CN(CCCN(C)C(=O)[C@H]1C[C@H]1c1cccc(Cl)c1Cl)Cc1ccncc1 ZINC000560596355 944268285 /nfs/dbraw/zinc/26/82/85/944268285.db2.gz YKMQDJJZBFIFSQ-ROUUACIJSA-N 0 3 406.357 4.472 20 0 HIADHN Cc1nn(-c2ccccn2)c(C)c1CNCCC(=O)Nc1cc(Cl)cc(Cl)c1 ZINC000560612147 944274694 /nfs/dbraw/zinc/27/46/94/944274694.db2.gz SCEZVNLZZVNGCX-UHFFFAOYSA-N 0 3 418.328 4.309 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F ZINC000560676229 944289848 /nfs/dbraw/zinc/28/98/48/944289848.db2.gz POSLXQYCWYROPR-YTQUADARSA-N 0 3 404.432 4.014 20 0 HIADHN Cc1ccc2nc(C3CC3)cc(C(=O)Nc3cccc(CN4CC[C@@H](O)C4)c3)c2c1 ZINC000560677853 944291584 /nfs/dbraw/zinc/29/15/84/944291584.db2.gz MVCDNVFQFFRVOS-HXUWFJFHSA-N 0 3 401.510 4.240 20 0 HIADHN CCN1CCCN(C(=O)Nc2cc(Cl)c(OCC(F)(F)F)c(Cl)c2)CC1 ZINC000560975046 944382065 /nfs/dbraw/zinc/38/20/65/944382065.db2.gz LXATZORTACELBW-UHFFFAOYSA-N 0 3 414.255 4.494 20 0 HIADHN Cc1ccc(-c2noc(CCCN3CCC(C(=O)OC(C)(C)C)CC3)n2)cc1F ZINC000561274806 944536691 /nfs/dbraw/zinc/53/66/91/944536691.db2.gz BZBBUNPHVHZLMK-UHFFFAOYSA-N 0 3 403.498 4.170 20 0 HIADHN O=C(c1ccc(SC2CC2)cc1)N1CCC[C@H](c2n[nH]cc2CN2CCCC2)C1 ZINC000561305596 944544819 /nfs/dbraw/zinc/54/48/19/944544819.db2.gz ZCFURNQHHYOOSX-SFHVURJKSA-N 0 3 410.587 4.280 20 0 HIADHN COc1ccc(CNCc2cccc(-c3nc(CC(F)(F)F)no3)c2)cc1OC ZINC000561405765 944582674 /nfs/dbraw/zinc/58/26/74/944582674.db2.gz LCDJTUOMTNLFDH-UHFFFAOYSA-N 0 3 407.392 4.148 20 0 HIADHN Clc1ccc2nc(CNC3CCN(Cc4coc(-c5ccccc5)n4)CC3)cn2c1 ZINC000561446617 944606888 /nfs/dbraw/zinc/60/68/88/944606888.db2.gz YDTTWJMECHGZJV-UHFFFAOYSA-N 0 3 421.932 4.397 20 0 HIADHN CCOc1c(Br)cc(CN[C@@H]2CCCc3[nH]c(=O)ccc32)cc1OC ZINC000561453075 944610315 /nfs/dbraw/zinc/61/03/15/944610315.db2.gz CQLAASYZLJHWND-OAHLLOKOSA-N 0 3 407.308 4.124 20 0 HIADHN CN(CCCN(C)C(=O)[C@H]1CCn2c(cnc2C2CCCCC2)C1)Cc1ccco1 ZINC000561457202 944611322 /nfs/dbraw/zinc/61/13/22/944611322.db2.gz CGHDJPHLIAOWSD-FQEVSTJZSA-N 0 3 412.578 4.067 20 0 HIADHN CCN(C[C@@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)c1ccc(C(F)F)cc1 ZINC000561519887 944651228 /nfs/dbraw/zinc/65/12/28/944651228.db2.gz YCTJTHGOMZIHIO-GOSISDBHSA-N 0 3 408.514 4.157 20 0 HIADHN C[C@H]1CN(C(=O)c2cc(Cl)cc(Br)c2F)CCN(C2CCC2)C1 ZINC000561534846 944661436 /nfs/dbraw/zinc/66/14/36/944661436.db2.gz SFRKVTGPKXRJAI-LLVKDONJSA-N 0 3 403.723 4.188 20 0 HIADHN CC(=O)Nc1ccc(Cl)c(NC(=O)N[C@H]2CCN(Cc3ccccc3)[C@@H]2C)c1 ZINC000561591112 944694720 /nfs/dbraw/zinc/69/47/20/944694720.db2.gz QOLCPJHDZMBYFS-KUHUBIRLSA-N 0 3 400.910 4.083 20 0 HIADHN CCC(CC)n1nc(C(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)cc1C ZINC000561616051 944709608 /nfs/dbraw/zinc/70/96/08/944709608.db2.gz XROSQYNIVRAYMG-QFIPXVFZSA-N 0 3 400.567 4.373 20 0 HIADHN CC(=O)c1oc2cc(C)ccc2c1CC(=O)NC[C@H]1CCN(Cc2ccccc2)C1 ZINC000561635671 944720961 /nfs/dbraw/zinc/72/09/61/944720961.db2.gz DMZZZPNCRNIIKU-HXUWFJFHSA-N 0 3 404.510 4.125 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)C(C)(C)Cc2nc3ccccc3[nH]2)N(C)C)cc1 ZINC000561647853 944726148 /nfs/dbraw/zinc/72/61/48/944726148.db2.gz OAIZRCKQIOQQME-JOCHJYFZSA-N 0 3 422.573 4.338 20 0 HIADHN CC(=O)Nc1ccc(Cl)c(C(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)c1 ZINC000561651768 944728626 /nfs/dbraw/zinc/72/86/26/944728626.db2.gz SXFQJBOILHPXCA-OAQYLSRUSA-N 0 3 417.937 4.118 20 0 HIADHN Cc1oc(-c2ccco2)nc1CC(=O)NC[C@H](c1ccc(CC(C)C)cc1)N(C)C ZINC000561718160 944761908 /nfs/dbraw/zinc/76/19/08/944761908.db2.gz WJVOEGNLYNPJDA-OAQYLSRUSA-N 0 3 409.530 4.403 20 0 HIADHN C[C@H]1C[C@@H]1N1CCN(C(=O)c2cc(Br)cc(C(F)(F)F)c2)C[C@@H](C)C1 ZINC000561764161 944784574 /nfs/dbraw/zinc/78/45/74/944784574.db2.gz GMVCEIJXDWURCW-MKBNYLNASA-N 0 3 419.285 4.270 20 0 HIADHN C[C@@H]1C[C@H]1N1CCN(C(=O)c2cc(Br)cc(C(F)(F)F)c2)C[C@@H](C)C1 ZINC000561764160 944785371 /nfs/dbraw/zinc/78/53/71/944785371.db2.gz GMVCEIJXDWURCW-HWWQOWPSSA-N 0 3 419.285 4.270 20 0 HIADHN C[C@H]1C[C@H]1N1CCN(C(=O)c2cccnc2SCc2ccc(F)cc2)C[C@@H](C)C1 ZINC000561764417 944786326 /nfs/dbraw/zinc/78/63/26/944786326.db2.gz JYONWIDUBSJYNV-XGHQBKJUSA-N 0 3 413.562 4.315 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)N[C@H]2CCN(Cc3ccccc3)[C@@H]2C)c(Cl)c1 ZINC000561800395 944802296 /nfs/dbraw/zinc/80/22/96/944802296.db2.gz TYGZASOALMUKAW-KUHUBIRLSA-N 0 3 400.910 4.083 20 0 HIADHN CCCN(C)[C@H](CNC(=O)N1CCC(c2nc(C)no2)CC1)c1ccc(Cl)cc1 ZINC000561875104 944832392 /nfs/dbraw/zinc/83/23/92/944832392.db2.gz BFTWUAHTTPPSMR-LJQANCHMSA-N 0 3 419.957 4.004 20 0 HIADHN COc1ccc(CCN[C@@H](C(=O)Nc2ccc(F)cc2)c2ccccc2)c(OC)c1 ZINC000561885303 944836599 /nfs/dbraw/zinc/83/65/99/944836599.db2.gz UEJSXOGCLNHARV-HSZRJFAPSA-N 0 3 408.473 4.355 20 0 HIADHN CCS(=O)(=O)c1ccc(CN[C@H](c2ccc(Br)cc2)C2CC2)cc1 ZINC000561905637 944849267 /nfs/dbraw/zinc/84/92/67/944849267.db2.gz FHSKQFAOIHWBAP-IBGZPJMESA-N 0 3 408.361 4.484 20 0 HIADHN Cc1cnn(-c2ccc(NC(=O)N3CCCN(Cc4ccccc4)CC3)cc2F)c1 ZINC000561927736 944860854 /nfs/dbraw/zinc/86/08/54/944860854.db2.gz FHVCRNOQJSJTBD-UHFFFAOYSA-N 0 3 407.493 4.060 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1ccc(C(=O)N(CC)CC)cc1)c1ccco1 ZINC000562013423 944894034 /nfs/dbraw/zinc/89/40/34/944894034.db2.gz OZSUSKCIOCGARL-QFBILLFUSA-N 0 3 400.523 4.013 20 0 HIADHN C[C@H](N[C@@H]1CCN(C)[C@H]1c1ccc(Cl)cc1)C(=O)N1CCC[C@H]1c1cccs1 ZINC000562049018 944910531 /nfs/dbraw/zinc/91/05/31/944910531.db2.gz NGFARXLYBWDZGF-FCBIJRMHSA-N 0 3 418.006 4.489 20 0 HIADHN COc1ccc(CN2CC[C@H](N[C@@H](C)c3cccc4ccccc43)C2=O)c(OC)c1 ZINC000562047570 944911262 /nfs/dbraw/zinc/91/12/62/944911262.db2.gz LFPROPZAGMTDSL-SBUREZEXSA-N 0 3 404.510 4.309 20 0 HIADHN Cc1cc(F)ccc1-c1nc(C(C)(C)C(=O)NCCN2CCC(C)CC2)cs1 ZINC000562070684 944920439 /nfs/dbraw/zinc/92/04/39/944920439.db2.gz RVOMBNSMBMOUEM-UHFFFAOYSA-N 0 3 403.567 4.383 20 0 HIADHN COc1ccc([C@H](Cc2ccccc2)NCC(=O)Nc2cc(OC)ccc2OC)cc1 ZINC000562073543 944923625 /nfs/dbraw/zinc/92/36/25/944923625.db2.gz JSMWLNIIBCYAJJ-QFIPXVFZSA-N 0 3 420.509 4.225 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)Nc1ccc(C(=O)N2CCCCCC2)cc1 ZINC000562132832 944962697 /nfs/dbraw/zinc/96/26/97/944962697.db2.gz VVNDJGMPRKUNAH-UHFFFAOYSA-N 0 3 414.594 4.433 20 0 HIADHN Cc1cc(N2CCSCC2)ccc1NC(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C ZINC000562141882 944970470 /nfs/dbraw/zinc/97/04/70/944970470.db2.gz HGHKCVJIRPFRTH-PGRDOPGGSA-N 0 3 412.603 4.361 20 0 HIADHN Cc1nnc([C@@H]2CCCN(Cc3csc(-c4ccc(Br)cc4)n3)C2)[nH]1 ZINC000562158737 944986419 /nfs/dbraw/zinc/98/64/19/944986419.db2.gz DBTAJDUFEGFSPY-CQSZACIVSA-N 0 3 418.364 4.379 20 0 HIADHN COC(C)(C)c1nc(C)c(C(=O)N[C@H](CN(C)Cc2ccccc2)C(C)C)s1 ZINC000562170477 944999058 /nfs/dbraw/zinc/99/90/58/944999058.db2.gz FWNPCZZRWFRDLI-GOSISDBHSA-N 0 3 403.592 4.219 20 0 HIADHN COc1ccc(NC(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)cc1Br ZINC000562171844 945000532 /nfs/dbraw/zinc/00/05/32/945000532.db2.gz UCZQBKLXPICSDI-ACJLOTCBSA-N 0 3 406.324 4.271 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)Nc1nc2c(cccc2COC)s1)c1ccco1 ZINC000562171058 945001007 /nfs/dbraw/zinc/00/10/07/945001007.db2.gz HGGBSGASBYDEKH-UKRRQHHQSA-N 0 3 402.520 4.287 20 0 HIADHN CN1CCC(N(Cc2ccccc2Br)C(=O)NCc2cccs2)CC1 ZINC000562226941 945030924 /nfs/dbraw/zinc/03/09/24/945030924.db2.gz JZCHZKDHAZRFPC-UHFFFAOYSA-N 0 3 422.392 4.317 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)NCc2ncc(-c3ccccc3)o2)N(C)C)cc1 ZINC000562263657 945049400 /nfs/dbraw/zinc/04/94/00/945049400.db2.gz HWYYYARMIFJHJJ-OAQYLSRUSA-N 0 3 422.529 4.231 20 0 HIADHN CSc1ccc([C@H](CNC(=O)c2cccc(Br)c2F)N(C)C)cc1 ZINC000564095840 945376701 /nfs/dbraw/zinc/37/67/01/945376701.db2.gz ZOQUQZUJSUXPSQ-INIZCTEOSA-N 0 3 411.340 4.343 20 0 HIADHN C/C(=C\c1ccccc1OC(F)F)CN(C)[C@H](C)c1ccc(S(N)(=O)=O)cc1 ZINC000564261434 945478534 /nfs/dbraw/zinc/47/85/34/945478534.db2.gz RPODXGSGUVEQNQ-OKFGHLOFSA-N 0 3 410.486 4.032 20 0 HIADHN COc1cc(Br)c(CN2C[C@H](c3ccccc3)[C@@H]3COCC[C@H]32)cc1O ZINC000564307137 945509121 /nfs/dbraw/zinc/50/91/21/945509121.db2.gz BEXSCLHUIXGFTJ-ZIFCJYIRSA-N 0 3 418.331 4.168 20 0 HIADHN Cc1cc(OC[C@@H](O)CNCc2cccc(C(=O)N(C)C)c2)c(C(C)C)cc1Cl ZINC000564361847 945527767 /nfs/dbraw/zinc/52/77/67/945527767.db2.gz YBFMOWLTQQKFNL-IBGZPJMESA-N 0 3 418.965 4.003 20 0 HIADHN CN1CC[C@H](NCC(=O)N(Cc2ccccc2)C2CC2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000564395057 945552669 /nfs/dbraw/zinc/55/26/69/945552669.db2.gz HJUZCBYORJAWQK-JTHBVZDNSA-N 0 3 415.940 4.005 20 0 HIADHN CN1CC[C@@H](NCC(=O)N(Cc2ccccc2)C2CC2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000564395055 945552914 /nfs/dbraw/zinc/55/29/14/945552914.db2.gz HJUZCBYORJAWQK-GGAORHGYSA-N 0 3 415.940 4.005 20 0 HIADHN O=C(NCc1nc2cc(F)ccc2o1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000564396855 945555241 /nfs/dbraw/zinc/55/52/41/945555241.db2.gz XTDJAXLSCGDWRI-HXUWFJFHSA-N 0 3 421.394 4.038 20 0 HIADHN COc1ccc([C@H](Cc2ccccc2)NCC(=O)N2CCc3ccccc3C2)cc1 ZINC000564414483 945566249 /nfs/dbraw/zinc/56/62/49/945566249.db2.gz KWCUMZGILFHXMK-VWLOTQADSA-N 0 3 400.522 4.154 20 0 HIADHN c1ccc(-c2ncc(CN3C[C@H]4CCC[C@@]4(c4nc(CC5CC5)no4)C3)cn2)cc1 ZINC000564888567 945764101 /nfs/dbraw/zinc/76/41/01/945764101.db2.gz FDIGSUQGTFVFNP-HYBUGGRVSA-N 0 3 401.514 4.033 20 0 HIADHN COCCOc1ccc(NC(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)c(C)c1 ZINC000565259754 945793833 /nfs/dbraw/zinc/79/38/33/945793833.db2.gz KWIGPSFUBDYLLY-HXUWFJFHSA-N 0 3 405.926 4.098 20 0 HIADHN C[C@H](c1ccc(F)cc1)N(C)C(=O)CN[C@H]1CCN(C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000565331063 945812782 /nfs/dbraw/zinc/81/27/82/945812782.db2.gz DOPKQLBQCQMNGR-VQUVXCFPSA-N 0 3 421.919 4.173 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)CCCc2ccc(O)c(F)c2)N(C)C)cc1 ZINC000565444881 945831109 /nfs/dbraw/zinc/83/11/09/945831109.db2.gz REWGFTLCNSVXCZ-OAQYLSRUSA-N 0 3 402.510 4.060 20 0 HIADHN C[C@H]1[C@H](NC(=O)Nc2ccc(F)cc2-c2cnn(C)c2)CCN1Cc1ccccc1 ZINC000565563566 945848994 /nfs/dbraw/zinc/84/89/94/945848994.db2.gz PWDMDWJAKKKDMF-HRAATJIYSA-N 0 3 407.493 4.011 20 0 HIADHN CN(C(=O)CCCN1CCN(c2ccccc2)CC1)[C@H]1CC[C@@H](C(F)(F)F)CC1 ZINC000565591518 945853290 /nfs/dbraw/zinc/85/32/90/945853290.db2.gz NDQUKTBTTYKFML-KDURUIRLSA-N 0 3 411.512 4.168 20 0 HIADHN CN(C)Cc1ccc(C(=O)Nc2ccc3c(c2)N(C(=O)Cc2ccccc2)CC3)cc1 ZINC000565856266 945895529 /nfs/dbraw/zinc/89/55/29/945895529.db2.gz PKOIYLDJCSYTOX-UHFFFAOYSA-N 0 3 413.521 4.132 20 0 HIADHN CCc1ccc(C[C@@H](Cc2ccc(Cl)cc2)NCc2nnc3ccccn32)nc1 ZINC000565974555 945952808 /nfs/dbraw/zinc/95/28/08/945952808.db2.gz VBOXMIVVYLGQJH-OAQYLSRUSA-N 0 3 405.933 4.284 20 0 HIADHN Cc1nc(-c2cccc(NC(=O)CN[C@@H]3CCN(C)[C@@H]3c3ccccc3)c2)cs1 ZINC000566038297 945989773 /nfs/dbraw/zinc/98/97/73/945989773.db2.gz NIYFPQOCUHPHAY-NFBKMPQASA-N 0 3 406.555 4.092 20 0 HIADHN CCOC(=O)[C@H]1CC[C@H](NCc2ccc(C(=O)N(CC)CC)cc2)c2ccccc21 ZINC000566392765 946019795 /nfs/dbraw/zinc/01/97/95/946019795.db2.gz ROJIVAUPEWWXNU-GOTSBHOMSA-N 0 3 408.542 4.440 20 0 HIADHN CCSc1cccc(F)c1NC(=O)N1CCC(CN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000566532093 946034859 /nfs/dbraw/zinc/03/48/59/946034859.db2.gz LDACCISOOGLNPN-HOTGVXAUSA-N 0 3 409.571 4.291 20 0 HIADHN CC[C@](C)(COc1ncccc1Cl)NCC(=O)N(C)[C@@H](C)c1ccccc1OC ZINC000566669763 946069608 /nfs/dbraw/zinc/06/96/08/946069608.db2.gz MGTUVXZULMOQHY-KSFYIVLOSA-N 0 3 419.953 4.100 20 0 HIADHN CC(=O)N1C[C@@H]2CCC[C@H](NCc3csc(COc4ccc(Cl)cc4)n3)[C@H]2C1 ZINC000566877794 946144646 /nfs/dbraw/zinc/14/46/46/946144646.db2.gz BGHIBDPZMWQUDR-YSSFQJQWSA-N 0 3 419.978 4.112 20 0 HIADHN CSc1ccc([C@@H](CNC(=O)c2cnc(Oc3ccccc3)cn2)N(C)C)cc1 ZINC000566937330 946176841 /nfs/dbraw/zinc/17/68/41/946176841.db2.gz VRSNEFBUDUJVII-HXUWFJFHSA-N 0 3 408.527 4.024 20 0 HIADHN FC(F)(F)c1cnc(NCCN[C@@H](c2nc[nH]n2)C2CCCCC2)c(Cl)c1 ZINC000566966770 946198145 /nfs/dbraw/zinc/19/81/45/946198145.db2.gz GTNRNSWXQYSEQS-CQSZACIVSA-N 0 3 402.852 4.195 20 0 HIADHN FC(F)(F)c1cnc(NCC[NH2+][C@@H](c2nnc[n-]2)C2CCCCC2)c(Cl)c1 ZINC000566966770 946198151 /nfs/dbraw/zinc/19/81/51/946198151.db2.gz GTNRNSWXQYSEQS-CQSZACIVSA-N 0 3 402.852 4.195 20 0 HIADHN OC1(Cc2ccc(OC(F)(F)F)cc2)CCN(Cc2ccc3c[nH]nc3c2)CC1 ZINC000567085036 946236337 /nfs/dbraw/zinc/23/63/37/946236337.db2.gz LRHQKUMDXIQWIM-UHFFFAOYSA-N 0 3 405.420 4.031 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3Cc4ccccc4OC(C)(C)C3)c2)CC1 ZINC000567197548 946268268 /nfs/dbraw/zinc/26/82/68/946268268.db2.gz AAKHVMLKAQPKNI-UHFFFAOYSA-N 0 3 408.546 4.034 20 0 HIADHN C[C@@]1(C2CC2)NC(=O)N(c2cccc(CN[C@@H]3CCc4c3cccc4Cl)c2)C1=O ZINC000567256677 946280614 /nfs/dbraw/zinc/28/06/14/946280614.db2.gz VOCOAOJDQFTJEK-OFNKIYASSA-N 0 3 409.917 4.342 20 0 HIADHN Clc1ccccc1-c1nnc(CN2CCN(c3ccnc4ccccc43)CC2)o1 ZINC000567279510 946288159 /nfs/dbraw/zinc/28/81/59/946288159.db2.gz NWWGCOGZMJDZLT-UHFFFAOYSA-N 0 3 405.889 4.260 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)[C@@H](C)c3ccc(C(=O)C(C)C)cc3)c2)CC1 ZINC000567293919 946297589 /nfs/dbraw/zinc/29/75/89/946297589.db2.gz YIZXNIWFTMUMBN-IBGZPJMESA-N 0 3 407.558 4.409 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)Nc1ccnc(Sc2ccccn2)c1)c1ccco1 ZINC000567301045 946301877 /nfs/dbraw/zinc/30/18/77/946301877.db2.gz KHAOLCKKBZHFPA-WBVHZDCISA-N 0 3 411.531 4.472 20 0 HIADHN Cc1nc(CCC(=O)N[C@H]2CCN(Cc3ccccc3)[C@@H]2C)oc1-c1ccccc1 ZINC000567304374 946303402 /nfs/dbraw/zinc/30/34/02/946303402.db2.gz YCEKEQRUWYRGNX-KNQAVFIVSA-N 0 3 403.526 4.362 20 0 HIADHN COC[C@@]1(CNCc2cc(Br)c(Cl)s2)OCCc2ccccc21 ZINC000567403875 946326142 /nfs/dbraw/zinc/32/61/42/946326142.db2.gz UWAIBPSRIWPXEH-QGZVFWFLSA-N 0 3 416.768 4.368 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1cc(F)c(F)cc1N1CCCCC1 ZINC000568011405 946441354 /nfs/dbraw/zinc/44/13/54/946441354.db2.gz NJLROJFOXHYEIR-UHFFFAOYSA-N 0 3 406.477 4.144 20 0 HIADHN CN(C)C[C@H](CNC(=O)CCC(=O)c1ccc(F)c(F)c1)c1ccc(Cl)cc1 ZINC000568435003 946543801 /nfs/dbraw/zinc/54/38/01/946543801.db2.gz ZUEKFDCHNRMXTG-INIZCTEOSA-N 0 3 408.876 4.043 20 0 HIADHN C[C@@H](C(=O)NCCC1=CCCCC1)N(C)CCCc1cc(-c2cccc(F)c2)n[nH]1 ZINC000568545261 946586042 /nfs/dbraw/zinc/58/60/42/946586042.db2.gz FZCUCPYSPQIBDS-SFHVURJKSA-N 0 3 412.553 4.475 20 0 HIADHN Cc1cc(C(=O)Nc2ccccc2CN(C)C)cc(C)c1OCC(=O)N1CCCCC1 ZINC000568702997 946667865 /nfs/dbraw/zinc/66/78/65/946667865.db2.gz XLHRJFMIHXKHLW-UHFFFAOYSA-N 0 3 423.557 4.009 20 0 HIADHN COC(C)(C)c1nc(C)c(C(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)s1 ZINC000568820494 946718798 /nfs/dbraw/zinc/71/87/98/946718798.db2.gz VHPRZWMUICVNBR-SFHVURJKSA-N 0 3 419.591 4.153 20 0 HIADHN CCN(CC(=O)N1N=C(c2ccco2)C[C@@H]1c1cccs1)[C@@H]1CCOC(C)(C)C1 ZINC000568919524 946758330 /nfs/dbraw/zinc/75/83/30/946758330.db2.gz BBWWSENUZORRHD-SJLPKXTDSA-N 0 3 415.559 4.298 20 0 HIADHN COc1ccc(Cl)cc1CNCCC(=O)Nc1cc(OC)c(Cl)cc1OC ZINC000569190267 946836551 /nfs/dbraw/zinc/83/65/51/946836551.db2.gz WGBVZCDBNFXHPC-UHFFFAOYSA-N 0 3 413.301 4.138 20 0 HIADHN COC(C)(C)c1nc(C)c(C(=O)NC[C@@H](c2ccc(SC)cc2)N(C)C)s1 ZINC000569285697 946849505 /nfs/dbraw/zinc/84/95/05/946849505.db2.gz XLEVFDFSJZFATK-INIZCTEOSA-N 0 3 407.605 4.088 20 0 HIADHN Cc1cc(C)c(S(N)(=O)=O)cc1[C@@H](C)NC[C@H](Cc1ccccc1)C(F)(F)F ZINC000569892991 947039461 /nfs/dbraw/zinc/03/94/61/947039461.db2.gz WNCDQBPZALNCLT-WBVHZDCISA-N 0 3 414.493 4.023 20 0 HIADHN CN(C)c1noc([C@H]2CCCN(Cc3c(OC(F)F)ccc4ccccc43)C2)n1 ZINC000569913685 947043237 /nfs/dbraw/zinc/04/32/37/947043237.db2.gz BRDCUDGCWIUZAU-HNNXBMFYSA-N 0 3 402.445 4.270 20 0 HIADHN C[C@H](NCc1ccccc1CN1CCN(c2ccccc2)CC1)c1ccncc1F ZINC000569992555 947063313 /nfs/dbraw/zinc/06/33/13/947063313.db2.gz XKSCHAINYCAQGP-FQEVSTJZSA-N 0 3 404.533 4.394 20 0 HIADHN C[C@H](NC(=O)N1CCC(OCC2CCCCC2)CC1)[C@@H](c1ccccc1)N(C)C ZINC000569998888 947066200 /nfs/dbraw/zinc/06/62/00/947066200.db2.gz KBYMHVWPBOBMQT-CVDCTZTESA-N 0 3 401.595 4.449 20 0 HIADHN C[C@H]1[C@@H](NC(=O)N(C)Cc2ccccc2N2CCCC2)CCN1Cc1ccccc1 ZINC000570238488 947160364 /nfs/dbraw/zinc/16/03/64/947160364.db2.gz ZPPHVTNQMMMRQE-REWPJTCUSA-N 0 3 406.574 4.091 20 0 HIADHN Clc1cccc(N2CCOCC2)c1CNC[C@@H](c1cccs1)N1CCCC1 ZINC000570284116 947179937 /nfs/dbraw/zinc/17/99/37/947179937.db2.gz BQPWBMCXEQFTCH-FQEVSTJZSA-N 0 3 405.995 4.165 20 0 HIADHN CN(C)[C@H](CNC(=O)N1CCC(c2noc3cc(F)ccc32)CC1)c1ccccc1 ZINC000570444175 947251298 /nfs/dbraw/zinc/25/12/98/947251298.db2.gz ILGBCZILFFQJMY-HXUWFJFHSA-N 0 3 410.493 4.159 20 0 HIADHN CC[C@@H](NCc1cnc(N2CCOCC2)c(F)c1)c1ccc(OC(F)(F)F)cc1 ZINC000570553203 947293318 /nfs/dbraw/zinc/29/33/18/947293318.db2.gz BYELCOBBQUKPEQ-GOSISDBHSA-N 0 3 413.415 4.197 20 0 HIADHN Cc1cc(F)ccc1-c1nc(C(C)(C)C(=O)N[C@H]2C[C@@H](C)N(C3CC3)C2)cs1 ZINC000570558451 947298414 /nfs/dbraw/zinc/29/84/14/947298414.db2.gz OWOOTIMNEVOBKR-ZBFHGGJFSA-N 0 3 401.551 4.277 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](NC2CCC3(CCCO3)CC2)c2ccc(F)cc2)c1 ZINC000570617032 947316549 /nfs/dbraw/zinc/31/65/49/947316549.db2.gz RCZQHOMJLQMRDA-GTMAMOSYSA-N 0 3 417.546 4.400 20 0 HIADHN CSc1ccc([C@H](CNC(=O)C2(c3ccc(F)cc3)CCOCC2)N(C)C)cc1 ZINC000570719195 947333595 /nfs/dbraw/zinc/33/35/95/947333595.db2.gz OBBWRARLVRKOKK-NRFANRHFSA-N 0 3 416.562 4.015 20 0 HIADHN COc1ccc(C)cc1NC(=O)[C@H](C)N[C@@H]1CCN(C)[C@@H]1c1ccc(Cl)cc1 ZINC000570731935 947339398 /nfs/dbraw/zinc/33/93/98/947339398.db2.gz MMLLVAXBVIVRSQ-RRMPHLOHSA-N 0 3 401.938 4.019 20 0 HIADHN O=C(CN[C@H]1c2ccccc2CC12CCOCC2)Nc1ccnn1CC1CCCCC1 ZINC000570859360 947372507 /nfs/dbraw/zinc/37/25/07/947372507.db2.gz ZSTMWKBPXUZFAZ-DEOSSOPVSA-N 0 3 422.573 4.086 20 0 HIADHN COc1ncc([C@@H](C)NCc2ccc(CN3C[C@@H](C)O[C@@H](C)C3)cc2)cc1Cl ZINC000570913671 947391464 /nfs/dbraw/zinc/39/14/64/947391464.db2.gz OATQVNLAJMQYKV-IXDOHACOSA-N 0 3 403.954 4.204 20 0 HIADHN COc1ncc([C@H](C)NCc2ccc(CN3C[C@H](C)O[C@@H](C)C3)cc2)cc1Cl ZINC000570913672 947391728 /nfs/dbraw/zinc/39/17/28/947391728.db2.gz OATQVNLAJMQYKV-ULQDDVLXSA-N 0 3 403.954 4.204 20 0 HIADHN c1cc(-c2noc(CN[C@@H]3CN(Cc4ccccc4)C[C@H]3c3ccccc3)n2)co1 ZINC000571028266 947447777 /nfs/dbraw/zinc/44/77/77/947447777.db2.gz TUIJGLWFIVHINJ-FCHUYYIVSA-N 0 3 400.482 4.087 20 0 HIADHN CSc1ccc([C@H](CNC(=O)c2sc([C@H]3CCCOC3)nc2C)N(C)C)cc1 ZINC000571120407 947512913 /nfs/dbraw/zinc/51/29/13/947512913.db2.gz LQVXLYJXFRNHOJ-WMZOPIPTSA-N 0 3 419.616 4.100 20 0 HIADHN O[C@@H](CO[C@H]1CCCc2ccccc21)CN1CCC(Oc2cncc(Cl)c2)CC1 ZINC000571242391 947564066 /nfs/dbraw/zinc/56/40/66/947564066.db2.gz AGFIWQGFCQVEMF-XXBNENTESA-N 0 3 416.949 4.033 20 0 HIADHN CCc1c(C(=O)NC[C@H](c2ccc(SC)cc2)N(C)C)cnn1Cc1ccccc1 ZINC000571835450 947798738 /nfs/dbraw/zinc/79/87/38/947798738.db2.gz WQIBTNYOXOTWRW-HSZRJFAPSA-N 0 3 422.598 4.248 20 0 HIADHN Cc1cccnc1OC1CCN(C[C@H](O)CO[C@@H](C)c2ccc(Cl)cc2)CC1 ZINC000571930407 947814951 /nfs/dbraw/zinc/81/49/51/947814951.db2.gz PBJAHISIUIBGRR-PXNSSMCTSA-N 0 3 404.938 4.025 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3nc4ccccc4cc3Cl)CC2)C[C@H](C)O1 ZINC000571933668 947816145 /nfs/dbraw/zinc/81/61/45/947816145.db2.gz YXUWKICTENESDT-CALCHBBNSA-N 0 3 415.965 4.240 20 0 HIADHN CSc1ccc([C@@H](CNC(=O)c2cc(-c3ccc4c(c3)CCO4)no2)N(C)C)cc1 ZINC000571954740 947821371 /nfs/dbraw/zinc/82/13/71/947821371.db2.gz NRWBPRIGHALZLB-HXUWFJFHSA-N 0 3 423.538 4.031 20 0 HIADHN CN(CCCN(C)C(=O)c1csc(-c2ccc(F)c(F)c2)n1)Cc1ccncc1 ZINC000572047644 947832533 /nfs/dbraw/zinc/83/25/33/947832533.db2.gz QKBDCVVIHPISGY-UHFFFAOYSA-N 0 3 416.497 4.077 20 0 HIADHN O=C(CN[C@@H]1c2ccccc2CC12CCOCC2)Nc1ccc(Br)cc1 ZINC000572080984 947842119 /nfs/dbraw/zinc/84/21/19/947842119.db2.gz DJBAYMNDAYPJMH-HXUWFJFHSA-N 0 3 415.331 4.071 20 0 HIADHN O=C(c1cc(F)c2ccccc2c1)N1CCC[C@@H](c2n[nH]cc2CN2CCCC2)C1 ZINC000572309758 947880538 /nfs/dbraw/zinc/88/05/38/947880538.db2.gz AFWYERJDWUBPHU-GOSISDBHSA-N 0 3 406.505 4.318 20 0 HIADHN COc1ccc(-c2nc(CN[C@@H]3CCN(C)[C@@H]3c3ccccc3)cs2)cc1OC ZINC000572446100 947908960 /nfs/dbraw/zinc/90/89/60/947908960.db2.gz FCMADSJFMCSPCT-DENIHFKCSA-N 0 3 409.555 4.362 20 0 HIADHN COc1ccc(-c2nc(CN[C@@H]3CCN(C)[C@H]3c3ccccc3)cs2)cc1OC ZINC000572446101 947909574 /nfs/dbraw/zinc/90/95/74/947909574.db2.gz FCMADSJFMCSPCT-KNQAVFIVSA-N 0 3 409.555 4.362 20 0 HIADHN C[C@@H](NC[C@H](CO)Cc1cc(F)c(F)c(F)c1)c1sccc1Br ZINC000572451689 947911693 /nfs/dbraw/zinc/91/16/93/947911693.db2.gz SVEPSYYMAXJPLE-MWLCHTKSSA-N 0 3 408.283 4.430 20 0 HIADHN C[C@@H](NC(=O)c1nccnc1-c1nc2ccccc2s1)[C@H](c1ccccc1)N(C)C ZINC000572631121 947961967 /nfs/dbraw/zinc/96/19/67/947961967.db2.gz LXLUFWQTEKCIEX-QVKFZJNVSA-N 0 3 417.538 4.175 20 0 HIADHN Cc1cc(=O)[nH]c2cc(C(=O)N[C@H](CN3CCc4ccccc4C3)C(C)(C)C)ccc12 ZINC000572637381 947963198 /nfs/dbraw/zinc/96/31/98/947963198.db2.gz DUXVEISJRJUZDS-HSZRJFAPSA-N 0 3 417.553 4.452 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)C2(c3cccc(Cl)c3)CC(=O)C2)CCN1Cc1ccccc1 ZINC000572654786 947969274 /nfs/dbraw/zinc/96/92/74/947969274.db2.gz MZLIESHARDQDIT-UTKZUKDTSA-N 0 3 410.945 4.110 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)c1cnnn1-c1c(Cl)cccc1Cl)c1ccco1 ZINC000572750748 948000519 /nfs/dbraw/zinc/00/05/19/948000519.db2.gz JZZWVWUJGUAZNV-SWLSCSKDSA-N 0 3 422.316 4.026 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)Nc2ccc(OCC3CCOCC3)cc2)CCN1Cc1ccccc1 ZINC000572758096 948003080 /nfs/dbraw/zinc/00/30/80/948003080.db2.gz JAAMHGSFMMBXRS-DVECYGJZSA-N 0 3 423.557 4.277 20 0 HIADHN O=S(=O)(Cc1ccc2ccccc2c1)NC1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1 ZINC000572765105 948004144 /nfs/dbraw/zinc/00/41/44/948004144.db2.gz DFKRTAUGSSOPGD-QILAJZQNSA-N 0 3 420.578 4.455 20 0 HIADHN COc1ccc2cc([C@H](C)C(=O)Nc3cccc(CN4CC[C@@H](O)C4)c3)ccc2c1 ZINC000573273572 948134700 /nfs/dbraw/zinc/13/47/00/948134700.db2.gz NOLCJTUZBRQWCL-GAJHUEQPSA-N 0 3 404.510 4.157 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@H]2NC[C@@H](c2ccco2)N2CCCC2)cc1 ZINC000573289166 948146277 /nfs/dbraw/zinc/14/62/77/948146277.db2.gz SDQWDTLOOMKNHZ-FUPPJEDESA-N 0 3 416.587 4.100 20 0 HIADHN COc1ccc([C@H](Cc2ccncc2)NCc2cc(C)nc(N3CCCC3)c2)cc1 ZINC000573491809 948217542 /nfs/dbraw/zinc/21/75/42/948217542.db2.gz IGIRVNZOBYZGEE-DEOSSOPVSA-N 0 3 402.542 4.467 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)c1cccc(OCc2csc(C)n2)c1 ZINC000573574114 948239876 /nfs/dbraw/zinc/23/98/76/948239876.db2.gz MCDXLNANQJMJRY-UHFFFAOYSA-N 0 3 401.576 4.369 20 0 HIADHN Cc1cc(Br)c(C(=O)NCCCCN2C[C@@H](C)O[C@@H](C)C2)cc1Cl ZINC000573705679 948277308 /nfs/dbraw/zinc/27/73/08/948277308.db2.gz GQBCSEQMDHQKKM-OKILXGFUSA-N 0 3 417.775 4.030 20 0 HIADHN C[C@H](C(=O)N[C@@H]1CCN(Cc2ccccc2)[C@@H]1C)c1ccc(Br)s1 ZINC000573716038 948279837 /nfs/dbraw/zinc/27/98/37/948279837.db2.gz UQCWWVQCAAVVLM-SQWLQELKSA-N 0 3 407.377 4.393 20 0 HIADHN Cc1nc(COc2cccc(C(=O)N[C@H]3CCN(Cc4ccccc4)[C@@H]3C)c2)cs1 ZINC000573716074 948280188 /nfs/dbraw/zinc/28/01/88/948280188.db2.gz VDEULHUWXQEFOY-HXOBKFHXSA-N 0 3 421.566 4.423 20 0 HIADHN CNC(=O)COc1cccc(CN[C@H](C)c2sc(-c3ccc(C)cc3)nc2C)c1 ZINC000574107098 948366438 /nfs/dbraw/zinc/36/64/38/948366438.db2.gz SMGSGXSLXRKZBD-MRXNPFEDSA-N 0 3 409.555 4.403 20 0 HIADHN CC[C@@H](C)C(=O)Nc1cccc(CNC[C@@H](O)COc2cc(C)ccc2Cl)c1 ZINC000574726158 948513803 /nfs/dbraw/zinc/51/38/03/948513803.db2.gz USEHDMLMGOAXGL-VQIMIIECSA-N 0 3 404.938 4.163 20 0 HIADHN Cc1ccc(C(=O)N[C@@H](CN(C)C)c2ccc(F)cc2)cc1NC(=O)c1ccco1 ZINC000574784236 948524569 /nfs/dbraw/zinc/52/45/69/948524569.db2.gz AQHSPXQVQIEXTF-FQEVSTJZSA-N 0 3 409.461 4.012 20 0 HIADHN COc1ccc([C@@H](CO)N(C)CCCC(=O)c2ccc(Br)cc2)cc1 ZINC000574866641 948547914 /nfs/dbraw/zinc/54/79/14/948547914.db2.gz WHWBJSWWXJWKKQ-LJQANCHMSA-N 0 3 406.320 4.086 20 0 HIADHN COCCCN(C(=O)c1cc2cc(Br)cc(C)c2o1)C1CCN(C)CC1 ZINC000574890708 948549054 /nfs/dbraw/zinc/54/90/54/948549054.db2.gz OTQIVZQMFYQHOU-UHFFFAOYSA-N 0 3 423.351 4.077 20 0 HIADHN CCCN(C)[C@H](CNC(=O)c1ccc(-n2cncn2)c(C)c1)c1ccc(Cl)cc1 ZINC000575080050 948586053 /nfs/dbraw/zinc/58/60/53/948586053.db2.gz ZRGRLFRAGFHBSA-OAQYLSRUSA-N 0 3 411.937 4.042 20 0 HIADHN COc1ccc(CN2CC[C@@](CO)(Cc3ccc(F)cc3)C2)cc1OCC(C)C ZINC000575787306 948708685 /nfs/dbraw/zinc/70/86/85/948708685.db2.gz CGYYAVPRMBIFPS-XMMPIXPASA-N 0 3 401.522 4.296 20 0 HIADHN C[C@@H](NCc1ccc(C[S@@](C)=O)cc1)c1ccc(I)cc1 ZINC000575855704 948744043 /nfs/dbraw/zinc/74/40/43/948744043.db2.gz RKAAULWRWWFPDI-LRTDBIEQSA-N 0 3 413.324 4.021 20 0 HIADHN Cc1cc(C(=O)N(Cc2ccncc2)[C@H]2CCCN(Cc3ccccc3)C2)ccc1O ZINC000575891120 948753875 /nfs/dbraw/zinc/75/38/75/948753875.db2.gz MGSAYPYBQCWUDP-DEOSSOPVSA-N 0 3 415.537 4.403 20 0 HIADHN Clc1cccc2nc(Cl)nc(N3CC[C@H]4[C@H]3CCN4Cc3cccnc3)c12 ZINC001164722123 720381704 /nfs/dbraw/zinc/38/17/04/720381704.db2.gz CCGQCVJPESUEEE-DLBZAZTESA-N 0 3 400.313 4.185 20 0 HIADHN Clc1ccc2c(Cl)nnc(N3CC[C@@H]4[C@@H]3CCN4Cc3cccnc3)c2c1 ZINC001164726348 720464400 /nfs/dbraw/zinc/46/44/00/720464400.db2.gz BPVLVKLINWXSQZ-MSOLQXFVSA-N 0 3 400.313 4.185 20 0 HIADHN Cn1cc(CN2CC[C@H]3CN(c4cc(Cl)nc5cc(Cl)ccc54)C[C@H]3C2)cn1 ZINC001164771733 721107761 /nfs/dbraw/zinc/10/77/61/721107761.db2.gz STTYADUCBXDGFU-JKSUJKDBSA-N 0 3 416.356 4.233 20 0 HIADHN Fc1cccc(O[C@@H]2C[C@H]3CN(c4ccc(-c5ccccc5Cl)nn4)CCN3C2)c1 ZINC001164903407 721544358 /nfs/dbraw/zinc/54/43/58/721544358.db2.gz CJXAGEBSSTYDCV-PKOBYXMFSA-N 0 3 424.907 4.278 20 0 HIADHN Cc1ccc(C)c(-c2ccc(N3CCN4C[C@H](Oc5cccc(F)c5)C[C@@H]4C3)nn2)c1 ZINC001164905320 721556905 /nfs/dbraw/zinc/55/69/05/721556905.db2.gz GSIKRIFFYXMXIN-IFMALSPDSA-N 0 3 418.516 4.241 20 0 HIADHN Cc1cc2c(ncnc2N2CCC(F)(F)[C@@]3(CCN(Cc4ccccn4)C3)C2)s1 ZINC001164903805 721583274 /nfs/dbraw/zinc/58/32/74/721583274.db2.gz NXVIEGWKKDCTLG-HXUWFJFHSA-N 0 3 415.513 4.132 20 0 HIADHN COc1ccc2c(ccnc2N2CCC(F)(F)[C@]3(CCN(Cc4ccccn4)C3)C2)c1 ZINC001164906196 721694321 /nfs/dbraw/zinc/69/43/21/721694321.db2.gz LZPCCLUGTGILHH-QHCPKHFHSA-N 0 3 424.495 4.376 20 0 HIADHN FC1(F)CCN(c2nccc3ccsc32)C[C@]12CCN(Cc1ccccn1)C2 ZINC001164904760 721696755 /nfs/dbraw/zinc/69/67/55/721696755.db2.gz GEARVOBTFXISOL-HXUWFJFHSA-N 0 3 400.498 4.429 20 0 HIADHN Cc1cc(Cl)c(C)c(N2CCC(F)(F)[C@]3(CCN(Cc4ccccn4)C3)C2)n1 ZINC001164906788 721710123 /nfs/dbraw/zinc/71/01/23/721710123.db2.gz OHYITUHYRXDBGO-FQEVSTJZSA-N 0 3 406.908 4.485 20 0 HIADHN FC1(F)CCN(c2cc3ccsc3cn2)C[C@@]12CCN(Cc1ccccn1)C2 ZINC001164906573 721712304 /nfs/dbraw/zinc/71/23/04/721712304.db2.gz MZHNPCTWNSBQLX-FQEVSTJZSA-N 0 3 400.498 4.429 20 0 HIADHN FC1(F)CCN(c2nnc(Cl)c3ccoc32)C[C@@]12CCN(Cc1ccccn1)C2 ZINC001164904382 721714094 /nfs/dbraw/zinc/71/40/94/721714094.db2.gz DCEXXQHXOUCFBS-IBGZPJMESA-N 0 3 419.863 4.009 20 0 HIADHN Clc1ccc2c(ccnc2N2CCC3(CC2)COCCN(Cc2ccncc2)C3)c1 ZINC001164964744 722054850 /nfs/dbraw/zinc/05/48/50/722054850.db2.gz XNUBJIVLZRJXJH-UHFFFAOYSA-N 0 3 422.960 4.402 20 0 HIADHN Cc1cccc2cc(Cl)nc(N3CC[C@H]4CN(Cc5cccnc5)CCO[C@@H]4C3)c12 ZINC001164971257 722153132 /nfs/dbraw/zinc/15/31/32/722153132.db2.gz BLWYYFLYNWYNLK-LEWJYISDSA-N 0 3 422.960 4.319 20 0 HIADHN COc1cc2c(cc1F)ncnc2N1CCC[C@]2(CCN2Cc2cccc(F)c2)C1 ZINC001164994068 722203922 /nfs/dbraw/zinc/20/39/22/722203922.db2.gz FGEUBXHGYXIHPI-QHCPKHFHSA-N 0 3 410.468 4.162 20 0 HIADHN COC(=O)c1cc2ccccc2c(N2CCC[C@@]3(CCN3Cc3cccc(F)c3)C2)n1 ZINC001164994029 722209002 /nfs/dbraw/zinc/20/90/02/722209002.db2.gz DGELIQRTIMVRCZ-RUZDIDTESA-N 0 3 419.500 4.405 20 0 HIADHN COC(=O)c1cccc2nc(N3CCC[C@@]4(CCN4Cc4cccc(F)c4)C3)ccc21 ZINC001164995083 722210445 /nfs/dbraw/zinc/21/04/45/722210445.db2.gz GFQGYVOPHKXSGD-RUZDIDTESA-N 0 3 419.500 4.405 20 0 HIADHN Fc1ccccc1OCc1noc([C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)n1 ZINC000436008913 861298788 /nfs/dbraw/zinc/29/87/88/861298788.db2.gz BMFDNXWIIHZWRF-FQEVSTJZSA-N 0 3 421.394 4.494 20 0 HIADHN Cc1csc(CCC(=O)N[C@H](c2ccc(F)c(F)c2)C(C)(C)N2CCCC2)n1 ZINC000436037988 861330427 /nfs/dbraw/zinc/33/04/27/861330427.db2.gz KGOASXVMRPDCLF-HXUWFJFHSA-N 0 3 407.530 4.394 20 0 HIADHN Fc1ccc(Cn2cc(CNCCc3nc(-c4ccc(Cl)cc4)no3)cn2)cc1 ZINC000436229732 861533455 /nfs/dbraw/zinc/53/34/55/861533455.db2.gz UGDQEROBZHICSI-UHFFFAOYSA-N 0 3 411.868 4.106 20 0 HIADHN COCCC1(CNCc2nnc3c(Cl)cc(C(F)(F)F)cn23)CCCCC1 ZINC000436238238 861545311 /nfs/dbraw/zinc/54/53/11/861545311.db2.gz FQHXCFYPNOPPIH-UHFFFAOYSA-N 0 3 404.864 4.478 20 0 HIADHN O=C(Cc1csc(-c2ccc(Cl)cc2)n1)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000008367034 845520354 /nfs/dbraw/zinc/52/03/54/845520354.db2.gz AOMYEWKFCYKBDP-LJQANCHMSA-N 0 3 411.958 4.397 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)CCc3ncc(-c4ccccc4)o3)cc2)CC1 ZINC000010193044 845629998 /nfs/dbraw/zinc/62/99/98/845629998.db2.gz YBYSXUKCPIVART-UHFFFAOYSA-N 0 3 404.514 4.055 20 0 HIADHN CCCOc1ccc(C(=O)CCC(=O)Nc2ccc(N3CCN(CC)CC3)cc2)cc1 ZINC000011872687 845838823 /nfs/dbraw/zinc/83/88/23/845838823.db2.gz GLWAVZBZQCCBRQ-UHFFFAOYSA-N 0 3 423.557 4.219 20 0 HIADHN CCOC(=O)c1sc2nc(C)nc(NC[C@H](c3ccco3)N3CCCC3)c2c1C ZINC000015171868 846015242 /nfs/dbraw/zinc/01/52/42/846015242.db2.gz AXIUNPZLNBZYPA-OAHLLOKOSA-N 0 3 414.531 4.327 20 0 HIADHN CC1CCN([C@H](CNC(=O)c2cccc(N3CCCC3=O)c2)c2cccs2)CC1 ZINC000018186155 846307319 /nfs/dbraw/zinc/30/73/19/846307319.db2.gz HBKCGCXGBNQSLR-HXUWFJFHSA-N 0 3 411.571 4.078 20 0 HIADHN CCOc1ccc([C@H](NCC(=O)N2CCc3sccc3C2)C(C)C)cc1OCC ZINC000022102620 846532083 /nfs/dbraw/zinc/53/20/83/846532083.db2.gz QGALIQHTLQJPGT-HSZRJFAPSA-N 0 3 416.587 4.417 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)COc1ccc(F)cc1Cl)c1cccc(OC)c1 ZINC000022700602 846606031 /nfs/dbraw/zinc/60/60/31/846606031.db2.gz YLJMMQUGSMYQRB-IBGZPJMESA-N 0 3 408.901 4.066 20 0 HIADHN Cc1nn(Cc2ccc(F)cc2)c(Cl)c1CN[C@@H]1CCN(Cc2ccccc2)C1 ZINC000023480182 846706808 /nfs/dbraw/zinc/70/68/08/846706808.db2.gz DETDJKASDRRIQV-OAQYLSRUSA-N 0 3 412.940 4.396 20 0 HIADHN CC[C@H](NCC(=O)Nc1cc(Cl)ccc1-n1cncn1)c1ccc(Cl)cc1 ZINC000024254189 846806477 /nfs/dbraw/zinc/80/64/77/846806477.db2.gz HOKOHCITKOWLBJ-INIZCTEOSA-N 0 3 404.301 4.254 20 0 HIADHN CN(C)Cc1ccccc1NC(=O)c1nc(-c2cccs2)n(-c2ccccc2)n1 ZINC000024809238 846871617 /nfs/dbraw/zinc/87/16/17/846871617.db2.gz KBCAOHJMBLTUAM-UHFFFAOYSA-N 0 3 403.511 4.310 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cccc(Br)c3)c(C)c2)CC1 ZINC000025185024 846937804 /nfs/dbraw/zinc/93/78/04/846937804.db2.gz ULFKTIOHEIKCSZ-UHFFFAOYSA-N 0 3 402.336 4.152 20 0 HIADHN Cc1nc(-c2c[nH]c(C(=O)NC[C@H](C(C)C)N3CCc4ccccc4C3)c2)cs1 ZINC000025538564 846995772 /nfs/dbraw/zinc/99/57/72/846995772.db2.gz OWLDMZHEACNCSR-JOCHJYFZSA-N 0 3 408.571 4.259 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(CNC[C@@H](c3ccco3)N3CCCC3)c2)cc1 ZINC000026307990 847122767 /nfs/dbraw/zinc/12/27/67/847122767.db2.gz VIIHLTJCQHLNEH-QHCPKHFHSA-N 0 3 419.525 4.467 20 0 HIADHN COc1cc2c(cc1OC)[C@H](c1cccs1)N(C[C@H](O)Cc1ccccc1)CC2 ZINC000026353522 847132071 /nfs/dbraw/zinc/13/20/71/847132071.db2.gz JRUCEUSQJRONEO-NTKDMRAZSA-N 0 3 409.551 4.316 20 0 HIADHN COc1ccc(OC)c([C@H](C)NC[C@H](O)COc2c(Cl)cccc2Cl)c1 ZINC000026714809 847188802 /nfs/dbraw/zinc/18/88/02/847188802.db2.gz MYEMXWSYKQWLHQ-STQMWFEESA-N 0 3 400.302 4.101 20 0 HIADHN COc1ccc(OC)c([C@@H](C)NC[C@H](O)COc2ccc(Cl)cc2Cl)c1 ZINC000026715113 847189712 /nfs/dbraw/zinc/18/97/12/847189712.db2.gz LKRSTEDFWBORRU-OCCSQVGLSA-N 0 3 400.302 4.101 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)c3ccccc3C(F)(F)F)CC2)c1 ZINC000026960348 847226385 /nfs/dbraw/zinc/22/63/85/847226385.db2.gz BLBBLEOWSHVEFI-UHFFFAOYSA-N 0 3 419.491 4.346 20 0 HIADHN COc1ccc(CN(C)C[C@H](O)COc2c(C)ccc(C)c2C)cc1OC(F)F ZINC000027210101 847267565 /nfs/dbraw/zinc/26/75/65/847267565.db2.gz ZPJJDCQILRQADM-SFHVURJKSA-N 0 3 409.473 4.094 20 0 HIADHN COc1cc(CNC[C@H]2COc3ccccc3O2)cc(OC)c1OCc1ccccc1 ZINC000027397921 847297461 /nfs/dbraw/zinc/29/74/61/847297461.db2.gz QKZXZVWAPHFIPI-FQEVSTJZSA-N 0 3 421.493 4.212 20 0 HIADHN Cc1onc(-c2c(F)cccc2Cl)c1C(=O)NC[C@H](c1ccccc1)N(C)C ZINC000027456221 847306297 /nfs/dbraw/zinc/30/62/97/847306297.db2.gz HCMNNYFEWFKLNC-QGZVFWFLSA-N 0 3 401.869 4.475 20 0 HIADHN Cc1onc(-c2c(F)cccc2Cl)c1C(=O)NC[C@H](Cc1ccccc1)N(C)C ZINC000027589275 847324583 /nfs/dbraw/zinc/32/45/83/847324583.db2.gz XPKHDOCLRLAKJW-INIZCTEOSA-N 0 3 415.896 4.345 20 0 HIADHN C[C@@H](NC(=O)NCCCN1CCc2ccccc2C1)c1ccc(Br)cc1 ZINC000028353062 847410572 /nfs/dbraw/zinc/41/05/72/847410572.db2.gz LEXBOQAINBLLBS-MRXNPFEDSA-N 0 3 416.363 4.258 20 0 HIADHN CC[C@@H](CNC(=O)N[C@H](c1ccccc1)c1ccccn1)N1CCc2ccccc2C1 ZINC000028392909 847414685 /nfs/dbraw/zinc/41/46/85/847414685.db2.gz KSXHLMOGIWPJOZ-UKILVPOCSA-N 0 3 414.553 4.307 20 0 HIADHN Cc1ccccc1CN1CCN(CCC(=O)Nc2c(Cl)cccc2Cl)CC1 ZINC000028882279 847471902 /nfs/dbraw/zinc/47/19/02/847471902.db2.gz ZZXCTDPVRQQJFI-UHFFFAOYSA-N 0 3 406.357 4.448 20 0 HIADHN CC(=O)Nc1cccc([C@@H](C)NC[C@H](O)COc2ccc(-c3ccccc3)cc2)c1 ZINC000028917879 847477559 /nfs/dbraw/zinc/47/75/59/847477559.db2.gz URGWWAWVOWUCJT-KOSHJBKYSA-N 0 3 404.510 4.403 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)c1ccc(C2SCCS2)cc1 ZINC000029367484 847552663 /nfs/dbraw/zinc/55/26/63/847552663.db2.gz FCCZYRZEDJVPJB-UHFFFAOYSA-N 0 3 408.658 4.257 20 0 HIADHN O=C(NCc1cccc(NC(=O)C2CCC2)c1)N[C@H](CN1CCCC1)c1ccccc1 ZINC000029735312 847610841 /nfs/dbraw/zinc/61/08/41/847610841.db2.gz XVWXVLDQOCAJGI-HSZRJFAPSA-N 0 3 420.557 4.062 20 0 HIADHN C[C@@H](C1CC1)N(CC(=O)N1CCC(C(=O)Nc2ccccc2)CC1)Cc1ccccc1 ZINC000029843911 847632546 /nfs/dbraw/zinc/63/25/46/847632546.db2.gz MALJRBRXOUVXCK-FQEVSTJZSA-N 0 3 419.569 4.164 20 0 HIADHN COc1ccc2ccc([O-])c(C[N@@H+]3CCCN(C(=O)c4cccc(C)c4)CC3)c2c1 ZINC000029889885 847641925 /nfs/dbraw/zinc/64/19/25/847641925.db2.gz MDRDFMQWPRQWAA-UHFFFAOYSA-N 0 3 404.510 4.211 20 0 HIADHN COc1ccc2ccc([O-])c(C[N@H+]3CCCN(C(=O)c4cccc(C)c4)CC3)c2c1 ZINC000029889885 847641931 /nfs/dbraw/zinc/64/19/31/847641931.db2.gz MDRDFMQWPRQWAA-UHFFFAOYSA-N 0 3 404.510 4.211 20 0 HIADHN Cc1cc(Br)c(NC(=O)CN(C)[C@H](C)C(C)C)c(Br)c1 ZINC000030148668 847682493 /nfs/dbraw/zinc/68/24/93/847682493.db2.gz GHELPKNRPHTPTA-LLVKDONJSA-N 0 3 406.162 4.435 20 0 HIADHN CCCOc1c(Cl)cc(CNCCNC(=O)c2ccc(C)c(F)c2)cc1OC ZINC000030670357 847756282 /nfs/dbraw/zinc/75/62/82/847756282.db2.gz SCTSOBQLZWYYTL-UHFFFAOYSA-N 0 3 408.901 4.105 20 0 HIADHN Cc1ccc(C(=O)NCCNCc2c(OC(F)F)ccc3ccccc32)cc1F ZINC000030670261 847756353 /nfs/dbraw/zinc/75/63/53/847756353.db2.gz NOSFVRSJJZJMFZ-UHFFFAOYSA-N 0 3 402.416 4.408 20 0 HIADHN c1c(CNCc2ccc(N3CCCC3)nc2)c(-c2cccnc2)nn1-c1ccccc1 ZINC000030900245 847794028 /nfs/dbraw/zinc/79/40/28/847794028.db2.gz DUFQZQOKEFIKSF-UHFFFAOYSA-N 0 3 410.525 4.219 20 0 HIADHN Fc1cccc(COc2ccc(CNCc3ccccc3Cn3cncn3)cc2)c1 ZINC000030900933 847794515 /nfs/dbraw/zinc/79/45/15/847794515.db2.gz OUVOKJNKPMFNLP-UHFFFAOYSA-N 0 3 402.473 4.334 20 0 HIADHN c1cn(-c2ncccc2CNCc2cn(Cc3ccccc3)nc2-c2ccccc2)cn1 ZINC000030902557 847795423 /nfs/dbraw/zinc/79/54/23/847795423.db2.gz NYYRJNHKTYTTLD-UHFFFAOYSA-N 0 3 420.520 4.469 20 0 HIADHN COc1cc(Br)c(CN[C@H]2CCCN(Cc3ccccc3)C2)cc1OC ZINC000030908969 847796975 /nfs/dbraw/zinc/79/69/75/847796975.db2.gz YWQCWCZSUAYNPG-SFHVURJKSA-N 0 3 419.363 4.221 20 0 HIADHN CC(C)(CNC(=O)N[C@H]1CCSc2c(F)cccc21)N1CCc2ccccc2C1 ZINC000031106556 847825402 /nfs/dbraw/zinc/82/54/02/847825402.db2.gz JDEGIFRNKYVATH-FQEVSTJZSA-N 0 3 413.562 4.499 20 0 HIADHN CN(C)Cc1ccccc1NC(=O)c1ccc(OCc2cn3ccccc3n2)cc1 ZINC000031232196 847847995 /nfs/dbraw/zinc/84/79/95/847847995.db2.gz NOZVAVWTMWTLSD-UHFFFAOYSA-N 0 3 400.482 4.227 20 0 HIADHN CC(C)n1ncc2c1nc(C1CC1)cc2C(=O)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000031565793 847909058 /nfs/dbraw/zinc/90/90/58/847909058.db2.gz IEHCZBBQBJOONX-FQEVSTJZSA-N 0 3 417.557 4.284 20 0 HIADHN CC(C)(C)OC(=O)Nc1ccc(C(=O)NCC2(N3CCSCC3)CCCC2)cc1 ZINC000031959442 847971667 /nfs/dbraw/zinc/97/16/67/847971667.db2.gz WYGGRJLYGCBOKX-UHFFFAOYSA-N 0 3 419.591 4.125 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cccc(NC(=O)NC(C)C)c1)c1ccsc1 ZINC000031983001 847974928 /nfs/dbraw/zinc/97/49/28/847974928.db2.gz BHYQISQDFSLHSV-LJQANCHMSA-N 0 3 402.564 4.091 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cc(Cl)c2c(c1)OCCCO2)c1ccsc1 ZINC000031986509 847975898 /nfs/dbraw/zinc/97/58/98/847975898.db2.gz MVKPJJZVRQKBMY-KRWDZBQOSA-N 0 3 408.951 4.376 20 0 HIADHN CN(C)[C@H](CNC(=O)CCc1ncc(-c2ccccc2Cl)o1)Cc1ccccc1 ZINC000032245843 847994575 /nfs/dbraw/zinc/99/45/75/847994575.db2.gz PXCHKWYLMWKFAL-SFHVURJKSA-N 0 3 411.933 4.217 20 0 HIADHN CC(C)c1ccc(C(=O)NC[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)c([O-])c1 ZINC000436565460 861854349 /nfs/dbraw/zinc/85/43/49/861854349.db2.gz MSWMPWJFPJUSNR-JOCHJYFZSA-N 0 3 422.569 4.174 20 0 HIADHN CC(C)c1ccc(C(=O)NC[C@@H]2C[N@@H+](Cc3ccccc3)CC23CCOCC3)c([O-])c1 ZINC000436565460 861854350 /nfs/dbraw/zinc/85/43/50/861854350.db2.gz MSWMPWJFPJUSNR-JOCHJYFZSA-N 0 3 422.569 4.174 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)c1cc2ccc(Br)cc2[nH]1 ZINC000032401465 848020031 /nfs/dbraw/zinc/02/00/31/848020031.db2.gz ZLVPEBHWVJBADL-UHFFFAOYSA-N 0 3 412.331 4.109 20 0 HIADHN CC[C@H](CNC(=O)c1cc(C)n(Cc2ccco2)c1C)N1CCc2ccccc2C1 ZINC000032446576 848028649 /nfs/dbraw/zinc/02/86/49/848028649.db2.gz RYYXJRRKEQBFAR-JOCHJYFZSA-N 0 3 405.542 4.313 20 0 HIADHN CC[C@H](CNC(=O)Cc1csc(-c2ccc(C)o2)n1)N1CCc2ccccc2C1 ZINC000032447692 848029899 /nfs/dbraw/zinc/02/98/99/848029899.db2.gz IQOGTTXQYZDIKH-HXUWFJFHSA-N 0 3 409.555 4.207 20 0 HIADHN O=C(CCCc1nnc(-c2ccccc2)o1)NC[C@@H](c1cccs1)N1CCCC1 ZINC000032485351 848037535 /nfs/dbraw/zinc/03/75/35/848037535.db2.gz GTSAZPQOCYJTEX-SFHVURJKSA-N 0 3 410.543 4.074 20 0 HIADHN CCc1ccc([C@H](CNC(=O)c2cc(OC)ccc2Br)N(C)C)cc1 ZINC000032732976 848069160 /nfs/dbraw/zinc/06/91/60/848069160.db2.gz HNMDYYDCTYXWNC-IBGZPJMESA-N 0 3 405.336 4.053 20 0 HIADHN CCc1ccc([C@H](CNC(=O)CCc2ncc(-c3ccccc3F)o2)N(C)C)cc1 ZINC000032734219 848069918 /nfs/dbraw/zinc/06/99/18/848069918.db2.gz XRNBFSMIGSSVIZ-NRFANRHFSA-N 0 3 409.505 4.395 20 0 HIADHN COc1ccc(Br)c(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)c1 ZINC000036659897 848153099 /nfs/dbraw/zinc/15/30/99/848153099.db2.gz MUBMXDVCOCSYPV-IBGZPJMESA-N 0 3 403.320 4.025 20 0 HIADHN C[C@H](NC(=O)OC(C)(C)C)C(=O)C(C#N)c1nc2cc(C(F)(F)F)ccc2s1 ZINC000041548467 848229969 /nfs/dbraw/zinc/22/99/69/848229969.db2.gz GPLMJYVMCOJYSG-GXSJLCMTSA-N 0 3 413.421 4.405 20 0 HIADHN COc1ccc(C2=NN(C(=O)CN([C@@H](C)C3CC3)C3CC3)[C@H](c3ccco3)C2)cc1 ZINC000042123201 848289209 /nfs/dbraw/zinc/28/92/09/848289209.db2.gz FMMUKNIZPOCJEL-AOMKIAJQSA-N 0 3 407.514 4.229 20 0 HIADHN COc1cc(CN[C@H](C)c2ccc(SC)cc2)ccc1OCC(=O)N1CCCC1 ZINC000042202599 848300641 /nfs/dbraw/zinc/30/06/41/848300641.db2.gz FAJZDKOECFQJCS-QGZVFWFLSA-N 0 3 414.571 4.269 20 0 HIADHN O[C@@H](c1ccccc1)C1CCN(C[C@H](O)COc2cc(Cl)ccc2Cl)CC1 ZINC000042657703 848340222 /nfs/dbraw/zinc/34/02/22/848340222.db2.gz ILDADSSZZDBLRT-RXVVDRJESA-N 0 3 410.341 4.179 20 0 HIADHN Cc1cc(F)ccc1-c1ccc(C[NH2+]C2CCN(C(=O)c3ccccc3[O-])CC2)o1 ZINC000436711543 861899624 /nfs/dbraw/zinc/89/96/24/861899624.db2.gz JHLBMRWDICADEG-UHFFFAOYSA-N 0 3 408.473 4.494 20 0 HIADHN COc1ccc(-c2ccccc2)cc1C[NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1 ZINC000436712334 861899888 /nfs/dbraw/zinc/89/98/88/861899888.db2.gz NNFGWPLLBPFATN-UHFFFAOYSA-N 0 3 416.521 4.462 20 0 HIADHN CCOc1ccc([C@@H](C)NC(=O)Nc2ccc(N3CCN(CC)CC3)cc2C)cc1 ZINC000043522614 848435691 /nfs/dbraw/zinc/43/56/91/848435691.db2.gz RCNPMJCBTNHWIH-LJQANCHMSA-N 0 3 410.562 4.418 20 0 HIADHN Cc1ccccc1CN1CCCN(C(=O)Nc2ccc(NC(=O)C(C)C)cc2)CC1 ZINC000043674369 848447751 /nfs/dbraw/zinc/44/77/51/848447751.db2.gz NNDCGHVWCUVBRS-UHFFFAOYSA-N 0 3 408.546 4.329 20 0 HIADHN CC1CCN([C@H](CNC(=O)Nc2cccc(C(=O)N(C)C)c2)c2cccs2)CC1 ZINC000043992673 848497847 /nfs/dbraw/zinc/49/78/47/848497847.db2.gz HOONNNBPZKONDM-LJQANCHMSA-N 0 3 414.575 4.045 20 0 HIADHN Cc1ccccc1CN1CCCN(C(=O)Nc2cccc(NC(=O)C(C)C)c2)CC1 ZINC000044083582 848513077 /nfs/dbraw/zinc/51/30/77/848513077.db2.gz LBLJULMDNVZWAD-UHFFFAOYSA-N 0 3 408.546 4.329 20 0 HIADHN COc1ccc(Br)cc1CN(C)C(=O)Nc1cccc(CN(C)C)c1 ZINC000044292394 848540283 /nfs/dbraw/zinc/54/02/83/848540283.db2.gz LHNRTOYMQCTVDX-UHFFFAOYSA-N 0 3 406.324 4.183 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)c1cccc(OCc2cccnc2)c1 ZINC000044315090 848544447 /nfs/dbraw/zinc/54/44/47/848544447.db2.gz BDCGEPRZPQBGSU-OAQYLSRUSA-N 0 3 407.539 4.289 20 0 HIADHN CCN(Cc1cccc(NC(=O)NC[C@@H](c2ccsc2)N(CC)CC)c1)C(C)=O ZINC000044379137 848553427 /nfs/dbraw/zinc/55/34/27/848553427.db2.gz XURNPAMWHNQZOS-NRFANRHFSA-N 0 3 416.591 4.321 20 0 HIADHN O=C(COc1ccc(Oc2ccccn2)cc1)NC[C@H](c1ccccc1)N1CCCC1 ZINC000044670067 848590918 /nfs/dbraw/zinc/59/09/18/848590918.db2.gz QJIGDEVKILAXHT-HSZRJFAPSA-N 0 3 417.509 4.206 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)[C@@H](C)Oc3ccccc3Cl)c(C)c2)CC1 ZINC000045195937 848646176 /nfs/dbraw/zinc/64/61/76/848646176.db2.gz LUJTUMIAFXHZKG-QGZVFWFLSA-N 0 3 401.938 4.196 20 0 HIADHN COc1ccc(Oc2cc(CNC(=O)Nc3cccc(CN(C)C)c3)ccn2)cc1 ZINC000046000879 848770054 /nfs/dbraw/zinc/77/00/54/848770054.db2.gz LUNMLBUAPJETBK-UHFFFAOYSA-N 0 3 406.486 4.266 20 0 HIADHN CCc1cc(=O)[n-]c(-c2cccc(NC(=O)c3ccc(C[NH+](CC)CC)cc3)c2)n1 ZINC000046066101 848779808 /nfs/dbraw/zinc/77/98/08/848779808.db2.gz VZVOCBUHEZEZMN-UHFFFAOYSA-N 0 3 404.514 4.093 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N(C)Cc1ccc(Br)o1)c1ccsc1 ZINC000046253775 848812201 /nfs/dbraw/zinc/81/22/01/848812201.db2.gz WMJPKEAQUWKADT-OAHLLOKOSA-N 0 3 414.369 4.328 20 0 HIADHN CN(C)Cc1cccc(NC(=O)[C@@H]2CCCN(c3ncccc3C(F)(F)F)C2)c1 ZINC000046784999 848934538 /nfs/dbraw/zinc/93/45/38/848934538.db2.gz ZLBNZCWHSNHVDV-MRXNPFEDSA-N 0 3 406.452 4.017 20 0 HIADHN C[C@H]1CCCN(CCNC(=O)c2cnn(-c3ccc(Cl)cc3)c2C(F)(F)F)C1 ZINC000046861767 848949105 /nfs/dbraw/zinc/94/91/05/848949105.db2.gz BNFNPJQBIDAGOO-ZDUSSCGKSA-N 0 3 414.859 4.006 20 0 HIADHN C[C@H]1CCCN(CCNC(=O)c2ccc(Cl)c(NC(=O)c3cccs3)c2)C1 ZINC000047145633 848993056 /nfs/dbraw/zinc/99/30/56/848993056.db2.gz BXQZJMRPBVANEQ-AWEZNQCLSA-N 0 3 405.951 4.116 20 0 HIADHN Cc1nn(Cc2ccccc2Cl)c(Cl)c1C(=O)NCCN1CCCC[C@H]1C ZINC000047145165 848993247 /nfs/dbraw/zinc/99/32/47/848993247.db2.gz WEYVMFRETZEHSV-CQSZACIVSA-N 0 3 409.361 4.151 20 0 HIADHN O=C(NCCCCN1CCN(c2cccc(C(F)(F)F)c2)CC1)[C@@H]1CC=CCC1 ZINC000047460969 849051952 /nfs/dbraw/zinc/05/19/52/849051952.db2.gz UVGHNNPRXBSTGI-GOSISDBHSA-N 0 3 409.496 4.080 20 0 HIADHN CCCC(=O)Nc1cccc(NC(=O)NCC(C)(C)N2CCc3ccccc3C2)c1 ZINC000047716250 849098067 /nfs/dbraw/zinc/09/80/67/849098067.db2.gz HIPIQDZYYABUSU-UHFFFAOYSA-N 0 3 408.546 4.384 20 0 HIADHN COc1cc(CN[C@@H](C)c2ccc(NC(=O)NC(C)C)cc2)cc(OC)c1OC ZINC000047723568 849099118 /nfs/dbraw/zinc/09/91/18/849099118.db2.gz QPWVTQJAAKBGEG-HNNXBMFYSA-N 0 3 401.507 4.093 20 0 HIADHN CC(C)CNC(=O)c1ccc(NC(=O)NC[C@H](c2cccs2)N2CCCC2)cc1 ZINC000047729793 849100054 /nfs/dbraw/zinc/10/00/54/849100054.db2.gz RRHUKUBEHKBFJR-LJQANCHMSA-N 0 3 414.575 4.093 20 0 HIADHN CCOC(=O)Nc1ccc(NC(=O)N2CCCN(Cc3ccccc3C)CC2)cc1 ZINC000047945583 849142075 /nfs/dbraw/zinc/14/20/75/849142075.db2.gz GERUMDPGARHYJB-UHFFFAOYSA-N 0 3 410.518 4.303 20 0 HIADHN CCCC(=O)Nc1ccc(CNC(=O)NC[C@@H](c2ccccc2)N2CCCC2)cc1 ZINC000047949261 849142712 /nfs/dbraw/zinc/14/27/12/849142712.db2.gz YBQTZFMKNSARFE-QFIPXVFZSA-N 0 3 408.546 4.062 20 0 HIADHN O=C(NCc1ccc(Br)s1)NC[C@H](c1cccs1)N1CCCC1 ZINC000047956531 849144074 /nfs/dbraw/zinc/14/40/74/849144074.db2.gz ULHOXOBLWBTXSJ-CYBMUJFWSA-N 0 3 414.394 4.208 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)Nc1ccc(OCC(F)(F)F)cc1 ZINC000048061249 849156146 /nfs/dbraw/zinc/15/61/46/849156146.db2.gz PIGVGRABDIISFE-UHFFFAOYSA-N 0 3 413.415 4.363 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1sccc1Br)c1cccc(OC)c1 ZINC000048095223 849163282 /nfs/dbraw/zinc/16/32/82/849163282.db2.gz YWQDGVXPZKTGGQ-MRXNPFEDSA-N 0 3 411.365 4.332 20 0 HIADHN CCC(=O)Nc1ccc(NC(=O)NC[C@H](c2ccc(OC)cc2)N2CCCC2)cc1 ZINC000048394370 849216512 /nfs/dbraw/zinc/21/65/12/849216512.db2.gz FXCZSNBNYQMTNI-OAQYLSRUSA-N 0 3 410.518 4.002 20 0 HIADHN Cc1nn(Cc2ccc(C)cc2)c(Cl)c1CNC1CCN(C(=O)C(C)(C)C)CC1 ZINC000048713390 849258330 /nfs/dbraw/zinc/25/83/30/849258330.db2.gz UFXQPVWBUQPZRV-UHFFFAOYSA-N 0 3 416.997 4.328 20 0 HIADHN CC[C@@H](NCc1ccc(Br)cc1)c1ccccc1OCC(=O)N(C)C ZINC000048750574 849264488 /nfs/dbraw/zinc/26/44/88/849264488.db2.gz NFBCFIGJEZOXSO-GOSISDBHSA-N 0 3 405.336 4.157 20 0 HIADHN O=C(COc1ccccc1CNCCOc1cccc2ccccc21)N1CCCC1 ZINC000048778240 849266049 /nfs/dbraw/zinc/26/60/49/849266049.db2.gz JROGHERJFIIIRD-UHFFFAOYSA-N 0 3 404.510 4.010 20 0 HIADHN COc1ccc(CNCc2ccc(-n3ccnc3C)nc2)cc1OCc1ccccc1 ZINC000048782324 849267072 /nfs/dbraw/zinc/26/70/72/849267072.db2.gz YQEVDYXIJFMNGK-UHFFFAOYSA-N 0 3 414.509 4.453 20 0 HIADHN COc1cc(CNCc2cccc(Br)c2)cc(Br)c1O ZINC000048817508 849271584 /nfs/dbraw/zinc/27/15/84/849271584.db2.gz QTIUJKZSTNOBJH-UHFFFAOYSA-N 0 3 401.098 4.216 20 0 HIADHN N#CC(C(=O)[C@@H]1CCCN(C(=O)c2ccc(F)cc2)C1)c1ccc2ccccc2n1 ZINC000048855298 849274673 /nfs/dbraw/zinc/27/46/73/849274673.db2.gz FTSZWTOUBNBPKT-QUCCMNQESA-N 0 3 401.441 4.103 20 0 HIADHN CC(C)c1ccc(SCC(=O)C(C#N)c2nc(N)nc(Nc3ccccc3)n2)cc1 ZINC000049395327 849309067 /nfs/dbraw/zinc/30/90/67/849309067.db2.gz CTYMHCOENCIDJT-SFHVURJKSA-N 0 3 418.526 4.289 20 0 HIADHN CC[C@@H]([NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1)c1cc(Cl)ccc1OC ZINC000436826163 862007364 /nfs/dbraw/zinc/00/73/64/862007364.db2.gz GJCZTLBVZPWLPO-LJQANCHMSA-N 0 3 402.922 4.400 20 0 HIADHN C[C@@H]([NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1)c1ccc(Br)cc1 ZINC000436826010 862007611 /nfs/dbraw/zinc/00/76/11/862007611.db2.gz GFSFRVDXUGNECJ-CQSZACIVSA-N 0 3 403.320 4.110 20 0 HIADHN C[C@@H]([NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1)c1ccc(Br)c(F)c1 ZINC000436829040 862010434 /nfs/dbraw/zinc/01/04/34/862010434.db2.gz OEEXUNIHLZFYRL-CYBMUJFWSA-N 0 3 421.310 4.249 20 0 HIADHN O=C(c1ccccc1[O-])N1CCC([NH2+][C@@H]2CCCOc3ccc(Cl)cc32)CC1 ZINC000436833714 862013787 /nfs/dbraw/zinc/01/37/87/862013787.db2.gz YSUZQLMJEARUIV-LJQANCHMSA-N 0 3 400.906 4.154 20 0 HIADHN CC(=O)N[C@@H](C(=O)C(C#N)c1nc2cc(C(F)(F)F)ccc2s1)C1CCCC1 ZINC000051677671 849503331 /nfs/dbraw/zinc/50/33/31/849503331.db2.gz RUQPRASQFCYLDH-CZUORRHYSA-N 0 3 409.433 4.186 20 0 HIADHN Cc1cc([C@@H]([NH2+]C2CCN(C(=O)c3ccccc3[O-])CC2)c2cccnc2)ccc1F ZINC000436853744 862033014 /nfs/dbraw/zinc/03/30/14/862033014.db2.gz DEUPGQMCCVMIGG-XMMPIXPASA-N 0 3 419.500 4.219 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)C1(c2cccc(Cl)c2)CCOCC1 ZINC000052960169 849649998 /nfs/dbraw/zinc/64/99/98/849649998.db2.gz SJQWFAUUABIRNO-LJQANCHMSA-N 0 3 418.990 4.403 20 0 HIADHN Cc1ccc(-n2ncc(C(=O)NCCN(C)Cc3ccccc3)c2C(F)(F)F)cc1 ZINC000053349539 849698110 /nfs/dbraw/zinc/69/81/10/849698110.db2.gz ULSQVQKMXLWAOE-UHFFFAOYSA-N 0 3 416.447 4.061 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)N1CCN(c2cccc(Cl)c2)CC1 ZINC000053547813 849729678 /nfs/dbraw/zinc/72/96/78/849729678.db2.gz UQBOFDVGUMJIDX-IBGZPJMESA-N 0 3 418.994 4.070 20 0 HIADHN COc1cccc([C@H](CNC(=O)N[C@@H](C)c2ccc(OC)c(F)c2)N2CCCC2)c1 ZINC000053553108 849731279 /nfs/dbraw/zinc/73/12/79/849731279.db2.gz XQPNYFCAHNDDFO-KKSFZXQISA-N 0 3 415.509 4.040 20 0 HIADHN COc1cc2c(cc1OC)CN(C(=O)CN[C@@H](c1ccc(F)cc1)C(C)(C)C)CC2 ZINC000053644207 849741242 /nfs/dbraw/zinc/74/12/42/849741242.db2.gz XSCDVORWACNNGZ-QHCPKHFHSA-N 0 3 414.521 4.105 20 0 HIADHN Cc1nc(-c2ccc(CNC(=O)NC[C@H](c3ccccc3)N3CCCC3)o2)cs1 ZINC000054043569 849804344 /nfs/dbraw/zinc/80/43/44/849804344.db2.gz VFVGXRRZCBQCJO-HXUWFJFHSA-N 0 3 410.543 4.348 20 0 HIADHN CCNc1nnc(SCC(=O)C(C#N)c2nc(-c3ccccc3)cs2)s1 ZINC000054169244 849819354 /nfs/dbraw/zinc/81/93/54/849819354.db2.gz CICHANDJSAYSJB-LBPRGKRZSA-N 0 3 401.542 4.062 20 0 HIADHN Cc1nn(-c2ccccc2)c(Cl)c1C(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000054227122 849829099 /nfs/dbraw/zinc/82/90/99/849829099.db2.gz IHAJFQBDNCDUOC-PKOBYXMFSA-N 0 3 408.933 4.399 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)c2ccc(OCc3ccncc3)cc2)C1 ZINC000054223711 849829257 /nfs/dbraw/zinc/82/92/57/849829257.db2.gz ZLXAGYVHDVWAPT-CVDCTZTESA-N 0 3 401.510 4.226 20 0 HIADHN Cc1cccc(C(=O)NCCN(C)Cc2ccccc2)c1NC(=O)c1ccccc1F ZINC000054281655 849838886 /nfs/dbraw/zinc/83/88/86/849838886.db2.gz SZKCJYZKKLXKEG-UHFFFAOYSA-N 0 3 419.500 4.248 20 0 HIADHN FC(F)(F)Oc1ccc(CNCc2cc3c(c(Br)c2)OCO3)cc1 ZINC000054278084 849838918 /nfs/dbraw/zinc/83/89/18/849838918.db2.gz WRQIULMBXQGMAL-UHFFFAOYSA-N 0 3 404.182 4.366 20 0 HIADHN CCOC(=O)N(C)c1ccc(NC(=O)NC[C@H](c2ccc(CC)cc2)N(C)C)cc1 ZINC000054529025 849884211 /nfs/dbraw/zinc/88/42/11/849884211.db2.gz FUOXVSNWBKUDBC-OAQYLSRUSA-N 0 3 412.534 4.266 20 0 HIADHN S=c1n(CN2CCN(CC3CC3)CC2)nc(-c2cccs2)n1-c1ccccc1 ZINC000054551149 849887230 /nfs/dbraw/zinc/88/72/30/849887230.db2.gz UMZGPINIQFZWJD-UHFFFAOYSA-N 0 3 411.600 4.117 20 0 HIADHN Cc1ccc([C@@H](C)NC(=O)NCCCCN2CCN(c3ccccc3)CC2)s1 ZINC000054734029 849915106 /nfs/dbraw/zinc/91/51/06/849915106.db2.gz UVRPFYQDJBQFIW-LJQANCHMSA-N 0 3 400.592 4.019 20 0 HIADHN COc1cc(CNCCNC(=O)c2cccc(C)c2)ccc1OCc1cccs1 ZINC000055176493 849981783 /nfs/dbraw/zinc/98/17/83/849981783.db2.gz HZMKXPRENPGSNN-UHFFFAOYSA-N 0 3 410.539 4.164 20 0 HIADHN COc1cc(CNCc2cccc(Cn3cccn3)c2)ccc1OCc1ccncc1 ZINC000055171977 849982185 /nfs/dbraw/zinc/98/21/85/849982185.db2.gz NGKFIZMWQCSNFO-UHFFFAOYSA-N 0 3 414.509 4.204 20 0 HIADHN CC(C)(C)CCN1CCN(C(=O)CCc2ncc(-c3ccc(F)cc3F)o2)CC1 ZINC000056043390 850235152 /nfs/dbraw/zinc/23/51/52/850235152.db2.gz YDTZNMTUQSBYOU-UHFFFAOYSA-N 0 3 405.489 4.133 20 0 HIADHN CCN1CCN(c2ccc(N[C@H](C)C(=O)Nc3ccccc3Cl)c(C)c2)CC1 ZINC000056170289 850269927 /nfs/dbraw/zinc/26/99/27/850269927.db2.gz AJTURFKRGGBJJO-QGZVFWFLSA-N 0 3 400.954 4.229 20 0 HIADHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)Nc1ccc(F)cc1F ZINC000056515954 850381899 /nfs/dbraw/zinc/38/18/99/850381899.db2.gz XOALKRJVAQLIBI-UHFFFAOYSA-N 0 3 412.278 4.323 20 0 HIADHN CCN(CC)C(=O)c1ccccc1NC(=O)NC[C@H](c1ccccc1)N1CCCC1 ZINC000056532779 850385174 /nfs/dbraw/zinc/38/51/74/850385174.db2.gz XNUDOABTXPNWLB-JOCHJYFZSA-N 0 3 408.546 4.127 20 0 HIADHN CCN(CC)C(=O)c1ccccc1NC(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000056554618 850391766 /nfs/dbraw/zinc/39/17/66/850391766.db2.gz OOEADQPVVZPITP-IBGZPJMESA-N 0 3 414.575 4.189 20 0 HIADHN CN(C(=O)c1ccc(Cl)cc1)c1ccc(NC(=O)NCCN2CCCCC2)cc1 ZINC000056578730 850400927 /nfs/dbraw/zinc/40/09/27/850400927.db2.gz SIEMWNCTWDWOJA-UHFFFAOYSA-N 0 3 414.937 4.224 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N(Cc1ccco1)C[C@@H]1CCCO1)c1ccsc1 ZINC000056623734 850418907 /nfs/dbraw/zinc/41/89/07/850418907.db2.gz KWVSLRFFEXBEFZ-PMACEKPBSA-N 0 3 405.564 4.115 20 0 HIADHN CCCNC(=O)c1ccc(NC(=O)NC[C@@H](c2ccsc2)N(CC)CC)cc1 ZINC000056641706 850429342 /nfs/dbraw/zinc/42/93/42/850429342.db2.gz KIFNPHYRRYYFQR-IBGZPJMESA-N 0 3 402.564 4.093 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)N[C@H]1CCSc2ccc(F)cc21 ZINC000056815356 850491474 /nfs/dbraw/zinc/49/14/74/850491474.db2.gz OVBOMCQNWACZKZ-IBGZPJMESA-N 0 3 405.514 4.275 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)c1c[nH]cc1-c1ccccc1 ZINC000057113937 850548594 /nfs/dbraw/zinc/54/85/94/850548594.db2.gz KCEQNUIMBHMYAC-UHFFFAOYSA-N 0 3 402.542 4.014 20 0 HIADHN O=C(CCc1ccc(Cl)s1)NCCCCN1CCN(c2ccccc2)CC1 ZINC000057114159 850550399 /nfs/dbraw/zinc/55/03/99/850550399.db2.gz ATNGJKYAJIYJOZ-UHFFFAOYSA-N 0 3 405.995 4.053 20 0 HIADHN CCN1CCC[C@H]1CNC(=O)[C@@H](C)SCc1ncc(-c2ccc(Cl)cc2)o1 ZINC000057382159 850621744 /nfs/dbraw/zinc/62/17/44/850621744.db2.gz DKZRMFOKIRCDSE-PBHICJAKSA-N 0 3 407.967 4.217 20 0 HIADHN Cc1ccc(NC(=O)C(C)C)cc1NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000057541576 850663548 /nfs/dbraw/zinc/66/35/48/850663548.db2.gz GRSSVDZZGWYQLG-NRFANRHFSA-N 0 3 408.546 4.376 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1cccc(-n2cccn2)c1)c1cccc(OC)c1 ZINC000057863139 850735138 /nfs/dbraw/zinc/73/51/38/850735138.db2.gz FMZJMJLYCMOHQN-JOCHJYFZSA-N 0 3 407.518 4.086 20 0 HIADHN CC(=O)c1cccc(OCCCC(=O)NCC(C)(C)N2CCc3ccccc3C2)c1 ZINC000058676854 850886290 /nfs/dbraw/zinc/88/62/90/850886290.db2.gz RAUCVTCKHPMPOC-UHFFFAOYSA-N 0 3 408.542 4.001 20 0 HIADHN CCOc1c(Cl)cc(C(=O)N(CCN(C)C)Cc2ccccc2F)cc1OC ZINC000058990983 850974590 /nfs/dbraw/zinc/97/45/90/850974590.db2.gz HNVYYLAUEKECPX-UHFFFAOYSA-N 0 3 408.901 4.090 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)c1cc(-c2ccccc2Cl)n[nH]1 ZINC000059001144 850976772 /nfs/dbraw/zinc/97/67/72/850976772.db2.gz FXYHYLPODUCGSZ-UHFFFAOYSA-N 0 3 400.885 4.073 20 0 HIADHN O=S(=O)(NC1CCN(C2c3ccccc3-c3ccccc32)CC1)c1ccc(F)cc1 ZINC000059403256 851004466 /nfs/dbraw/zinc/00/44/66/851004466.db2.gz RGDVECAAWIIAGK-UHFFFAOYSA-N 0 3 422.525 4.338 20 0 HIADHN CCN(CC)C(=O)c1ccc(NC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)cc1 ZINC000060061323 851035809 /nfs/dbraw/zinc/03/58/09/851035809.db2.gz GTIQWZKNDLVGEO-FQEVSTJZSA-N 0 3 411.521 4.158 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2cccc(NC(=O)c3ccc(F)cc3)c2)N(C)C)cc1 ZINC000060155694 851045436 /nfs/dbraw/zinc/04/54/36/851045436.db2.gz MZWGZUZWVRDNED-HSZRJFAPSA-N 0 3 419.500 4.419 20 0 HIADHN Cc1ccccc1-n1ncc(C(=O)NC[C@H](C)N2CCC(C)CC2)c1C(F)(F)F ZINC000060156351 851046536 /nfs/dbraw/zinc/04/65/36/851046536.db2.gz KNUBHHCCKPLFLP-INIZCTEOSA-N 0 3 408.468 4.050 20 0 HIADHN COc1ccc(C)cc1-n1ccc(C(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)n1 ZINC000060238615 851054619 /nfs/dbraw/zinc/05/46/19/851054619.db2.gz LVBHJZDCIPRUIX-HSZRJFAPSA-N 0 3 418.541 4.065 20 0 HIADHN COc1ccc(Br)cc1CN(C)C(=O)c1cccc(CN2CCCC2)c1 ZINC000060562838 851148021 /nfs/dbraw/zinc/14/80/21/851148021.db2.gz MKCCWPFCKVFNQP-UHFFFAOYSA-N 0 3 417.347 4.326 20 0 HIADHN O=C(CN1CCN(CC2CCCCC2)CC1)N(Cc1ccccc1)c1ccccc1 ZINC000060569192 851150639 /nfs/dbraw/zinc/15/06/39/851150639.db2.gz CBRLCKAUSIJGLG-UHFFFAOYSA-N 0 3 405.586 4.418 20 0 HIADHN Cc1ccc2c(c1)[C@@H]1CN(C)CC[C@H]1N2C(=O)c1ccc(OC[C@H]2CCCO2)cc1 ZINC000060847990 851229382 /nfs/dbraw/zinc/22/93/82/851229382.db2.gz BVLNIXLXMKDAFQ-JCTONOIOSA-N 0 3 406.526 4.001 20 0 HIADHN FC(F)Oc1cccc(CNCc2ccc(N3CCOCC3)cc2C(F)(F)F)c1 ZINC000060948340 851255066 /nfs/dbraw/zinc/25/50/66/851255066.db2.gz DWUVIINIOIQTKW-UHFFFAOYSA-N 0 3 416.390 4.433 20 0 HIADHN CN(C)[C@@H](CNC(=O)NCc1cccnc1Oc1cccc(F)c1)c1ccccc1 ZINC000060954523 851257343 /nfs/dbraw/zinc/25/73/43/851257343.db2.gz FCHYIGSAMUPYLW-NRFANRHFSA-N 0 3 408.477 4.115 20 0 HIADHN COc1cc([C@@H](C)NC(=O)NC[C@@H](c2ccccc2)N(C)C)ccc1OCC(C)C ZINC000060954827 851258075 /nfs/dbraw/zinc/25/80/75/851258075.db2.gz OFYNCSMQJJVXCS-NQIIRXRSSA-N 0 3 413.562 4.393 20 0 HIADHN CCOc1cc(CNCc2csc3ccccc23)ccc1O[C@H](C)C(=O)N(C)C ZINC000061048434 851282749 /nfs/dbraw/zinc/28/27/49/851282749.db2.gz HVJZRBKMNCPUCX-MRXNPFEDSA-N 0 3 412.555 4.445 20 0 HIADHN CCCOCc1ccccc1CNC(=O)c1ccc(N2CCN(C(C)C)CC2)cc1 ZINC000061163823 851308895 /nfs/dbraw/zinc/30/88/95/851308895.db2.gz QOSYBBSYQZFOFN-UHFFFAOYSA-N 0 3 409.574 4.074 20 0 HIADHN CC(C)Oc1ccc(CNC(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)cn1 ZINC000061191389 851313465 /nfs/dbraw/zinc/31/34/65/851313465.db2.gz UMSAMXIEESHNTI-IBGZPJMESA-N 0 3 416.591 4.203 20 0 HIADHN CCCOc1ccc(CNC(=O)NC[C@H](c2ccccc2)N2CCCC2)cc1OC ZINC000061229872 851322661 /nfs/dbraw/zinc/32/26/61/851322661.db2.gz WVKNNGUXFPCVNN-OAQYLSRUSA-N 0 3 411.546 4.120 20 0 HIADHN O=C(Cc1coc(-c2ccccc2)n1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000061288459 851339768 /nfs/dbraw/zinc/33/97/68/851339768.db2.gz VYUWOFCLHGIURL-UHFFFAOYSA-N 0 3 407.539 4.114 20 0 HIADHN CCCOc1ccc(OCC(=O)Nc2ccc(CCN3CCSCC3)cc2)cc1 ZINC000061289279 851340038 /nfs/dbraw/zinc/34/00/38/851340038.db2.gz AFEATBBCFPBABJ-UHFFFAOYSA-N 0 3 414.571 4.084 20 0 HIADHN Cc1ccnn1-c1ccc(C(=O)Nc2ccc(CCN3CCSCC3)cc2)cc1 ZINC000061288782 851340197 /nfs/dbraw/zinc/34/01/97/851340197.db2.gz FVCQYJMJLYKBHM-UHFFFAOYSA-N 0 3 406.555 4.024 20 0 HIADHN COc1cccc(C(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)c1OC(F)F ZINC000061502982 851391201 /nfs/dbraw/zinc/39/12/01/851391201.db2.gz PLYHLTLPIUFBDX-GOSISDBHSA-N 0 3 404.457 4.172 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)c1c[nH]c(=S)n1-c1ccccc1 ZINC000061572654 851409047 /nfs/dbraw/zinc/40/90/47/851409047.db2.gz NJKFSYINBVMYHY-UHFFFAOYSA-N 0 3 424.595 4.378 20 0 HIADHN Cc1nn(Cc2ccc(Cl)cc2)c(Cl)c1CNCCCOC[C@@H]1CCCO1 ZINC000061743592 851436519 /nfs/dbraw/zinc/43/65/19/851436519.db2.gz MTYTWCJFLDUWMJ-SFHVURJKSA-N 0 3 412.361 4.222 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2ccc(-c3csnn3)cc2)N2CCCC2)cc1 ZINC000061776820 851447523 /nfs/dbraw/zinc/44/75/23/851447523.db2.gz UHJSJHSESGOADF-NRFANRHFSA-N 0 3 407.543 4.472 20 0 HIADHN CC(=O)Nc1cc(NC(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)c(F)cc1F ZINC000061786207 851451036 /nfs/dbraw/zinc/45/10/36/851451036.db2.gz LMLNEKVUZCMPFC-NRFANRHFSA-N 0 3 416.472 4.190 20 0 HIADHN O=C(NCc1ccccc1OC(F)F)Nc1ccc(CCN2CCSCC2)cc1 ZINC000061792618 851454227 /nfs/dbraw/zinc/45/42/27/851454227.db2.gz QQZDORHGMOYQKJ-UHFFFAOYSA-N 0 3 421.513 4.201 20 0 HIADHN CCN(Cc1cccc(F)c1)C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000061793190 851455391 /nfs/dbraw/zinc/45/53/91/851455391.db2.gz DLJDEYHJRABSCA-UHFFFAOYSA-N 0 3 401.551 4.471 20 0 HIADHN CCOc1ccc([C@H](C)NC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)cc1OC ZINC000062042730 851493117 /nfs/dbraw/zinc/49/31/17/851493117.db2.gz IIRFZWFFVZCYJQ-GHTZIAJQSA-N 0 3 411.546 4.119 20 0 HIADHN Cc1ccc(Oc2ccccc2NC(=O)C(=O)NC[C@@H](C)N2CCCC[C@@H]2C)cc1 ZINC000062120436 851502718 /nfs/dbraw/zinc/50/27/18/851502718.db2.gz MHLQMXVDLFUCRB-RBUKOAKNSA-N 0 3 409.530 4.105 20 0 HIADHN CCOc1cc(CN[C@H]2CCc3c2cccc3Cl)ccc1O[C@H](C)C(=O)N(C)C ZINC000062258186 851518609 /nfs/dbraw/zinc/51/86/09/851518609.db2.gz SNDIVTSSMFQBFI-QRWLVFNGSA-N 0 3 416.949 4.371 20 0 HIADHN Cc1ccc(NC(=O)N(CCN(C)C)Cc2cccc(F)c2)c(Br)c1 ZINC000062373865 851532194 /nfs/dbraw/zinc/53/21/94/851532194.db2.gz JGLVPUXMACRVSQ-UHFFFAOYSA-N 0 3 408.315 4.492 20 0 HIADHN CCOc1ccc(OCC)c(NC(=O)N(CCN(C)C)Cc2cccc(F)c2)c1 ZINC000062377761 851533676 /nfs/dbraw/zinc/53/36/76/851533676.db2.gz FQHGOHASSBJSHE-UHFFFAOYSA-N 0 3 403.498 4.219 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)Nc1ccc(OC(F)F)c(F)c1 ZINC000062400695 851541950 /nfs/dbraw/zinc/54/19/50/851541950.db2.gz BDFYYATZLVVXSQ-UHFFFAOYSA-N 0 3 417.378 4.301 20 0 HIADHN CC(C)[C@H](NC(=O)N(CCN(C)C)Cc1cccc(F)c1)c1nc2ccccc2[nH]1 ZINC000062474292 851558518 /nfs/dbraw/zinc/55/85/18/851558518.db2.gz HGHAKJKCOIFLKN-NRFANRHFSA-N 0 3 411.525 4.173 20 0 HIADHN CC(C)COc1ccccc1CNC(=O)N(CCN(C)C)Cc1cccc(F)c1 ZINC000062499278 851566079 /nfs/dbraw/zinc/56/60/79/851566079.db2.gz OPCZSUVMIHNVMX-UHFFFAOYSA-N 0 3 401.526 4.134 20 0 HIADHN Cc1ccc([C@H](CNC(=O)NCc2cccc(NC(=O)C3CCCC3)c2)N(C)C)cc1 ZINC000062653839 851585121 /nfs/dbraw/zinc/58/51/21/851585121.db2.gz PLIIZDZLRUYESB-QHCPKHFHSA-N 0 3 422.573 4.226 20 0 HIADHN COc1ccc(CN(C(=S)NC2CCN(Cc3ccccc3)CC2)C2CC2)cc1 ZINC000063145137 851621693 /nfs/dbraw/zinc/62/16/93/851621693.db2.gz MYVYBMFSJSLCQN-UHFFFAOYSA-N 0 3 409.599 4.199 20 0 HIADHN CNC(=O)C1CCC(N[C@H](C(=O)Nc2ccc(C)c(Cl)c2)c2ccccc2)CC1 ZINC000063311748 851656693 /nfs/dbraw/zinc/65/66/93/851656693.db2.gz MUXRQXMNDJAFNN-NGICGMGXSA-N 0 3 413.949 4.223 20 0 HIADHN COc1cc(CN[C@@H]2CCCc3ccccc32)cc(I)c1OC ZINC000063312800 851657838 /nfs/dbraw/zinc/65/78/38/851657838.db2.gz UFKVKRPIXYCFOC-QGZVFWFLSA-N 0 3 423.294 4.476 20 0 HIADHN Cc1cccn2cc(COc3ccc(CNCc4ccc5c(c4)OCCO5)cc3)nc12 ZINC000063312883 851657908 /nfs/dbraw/zinc/65/79/08/851657908.db2.gz KYWGYZAZMGOLFD-UHFFFAOYSA-N 0 3 415.493 4.283 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)c2cc3ccc(Br)cc3[nH]2)o1 ZINC000063497869 851703596 /nfs/dbraw/zinc/70/35/96/851703596.db2.gz QZEFJDJHGMJZCF-UHFFFAOYSA-N 0 3 404.308 4.036 20 0 HIADHN C[C@H]1CN(Cc2cccc(CNCc3ccccc3OCc3cccnc3)c2)CCO1 ZINC000063524262 851707585 /nfs/dbraw/zinc/70/75/85/851707585.db2.gz LFLSPIIOBRSGIG-NRFANRHFSA-N 0 3 417.553 4.171 20 0 HIADHN CC(C)CCOc1ccc(CNCc2ccc(S(=O)(=O)N(C)C(C)C)cc2)cc1 ZINC000063546323 851711774 /nfs/dbraw/zinc/71/17/74/851711774.db2.gz LCFRIVKUUCRFCB-UHFFFAOYSA-N 0 3 418.603 4.430 20 0 HIADHN C[C@@H]1CN(C(=O)c2ccc(CNCc3cccc(C(F)(F)F)c3)cc2)C[C@@H](C)O1 ZINC000063561644 851714594 /nfs/dbraw/zinc/71/45/94/851714594.db2.gz PZDNODFQCDQHBC-HZPDHXFCSA-N 0 3 406.448 4.245 20 0 HIADHN CC(C)N(Cc1ccc(C#N)cc1)C(=S)NC1CCN(Cc2ccccc2)CC1 ZINC000063564189 851714619 /nfs/dbraw/zinc/71/46/19/851714619.db2.gz MSYGLKWIMSIEQC-UHFFFAOYSA-N 0 3 406.599 4.308 20 0 HIADHN CCOC(=O)c1c(C)c(C)sc1NC(=O)C[C@@H](C)N[C@@H](C)c1ccncc1OC ZINC000437082899 862277041 /nfs/dbraw/zinc/27/70/41/862277041.db2.gz MSKNXGBRBPZUEV-OCCSQVGLSA-N 0 3 419.547 4.013 20 0 HIADHN CCCCN(CCC(=O)Nc1ccc(N2CCOCC2)cc1)Cc1ccccc1F ZINC000063755169 851756237 /nfs/dbraw/zinc/75/62/37/851756237.db2.gz ISVPEXIHANLBNZ-UHFFFAOYSA-N 0 3 413.537 4.293 20 0 HIADHN O=C(NNC(=O)c1cccc(CN2CCCC2)c1)c1ccc(-c2ccc(F)cc2)s1 ZINC000063914903 851792256 /nfs/dbraw/zinc/79/22/56/851792256.db2.gz KGIYOGWBAVXCRW-UHFFFAOYSA-N 0 3 423.513 4.225 20 0 HIADHN CCCC(=O)Nc1cccc(CNC(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)c1 ZINC000064237462 851855152 /nfs/dbraw/zinc/85/51/52/851855152.db2.gz OUCKROHMBADZLP-QHCPKHFHSA-N 0 3 422.573 4.370 20 0 HIADHN Cc1ccc([C@H](CNC(=O)NCc2ccc(N3CCCCC3)nc2)N2CCCC2)cc1 ZINC000064237279 851855352 /nfs/dbraw/zinc/85/53/52/851855352.db2.gz PZRIXYUQINUATI-QHCPKHFHSA-N 0 3 421.589 4.017 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N[C@@H](C)c2ccc3c(c2)CCC(=O)N3)N2CCCC2)cc1 ZINC000064237344 851855390 /nfs/dbraw/zinc/85/53/90/851855390.db2.gz YEEUWDCRTIIEGA-MBSDFSHPSA-N 0 3 420.557 4.077 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)Nc1ccc2c(c1)OCO2 ZINC000064412332 851891331 /nfs/dbraw/zinc/89/13/31/851891331.db2.gz LRCPWZBTUQUKMW-UHFFFAOYSA-N 0 3 409.408 4.030 20 0 HIADHN COCc1ccccc1NC(=O)N(CCN(C)C)Cc1ccc(C(F)(F)F)cc1 ZINC000064529989 851920953 /nfs/dbraw/zinc/92/09/53/851920953.db2.gz WNSYGLOPJFNMMZ-UHFFFAOYSA-N 0 3 409.452 4.448 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)Nc1nnc(C(F)F)s1 ZINC000064533171 851923560 /nfs/dbraw/zinc/92/35/60/851923560.db2.gz FEPIFUQSPGBHDI-UHFFFAOYSA-N 0 3 423.411 4.090 20 0 HIADHN c1ccc(-c2cccc(CNCc3cccc(OCCN4CCOCC4)c3)c2)cc1 ZINC000065013989 852040420 /nfs/dbraw/zinc/04/04/20/852040420.db2.gz OTOODPWEZDZEBY-UHFFFAOYSA-N 0 3 402.538 4.354 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2ccccc2C(=O)N2CCCCC2)N(C)C)cc1 ZINC000065358474 852112063 /nfs/dbraw/zinc/11/20/63/852112063.db2.gz QPZVVPAAWZDMBG-QFIPXVFZSA-N 0 3 408.546 4.046 20 0 HIADHN CC(C)(CNC(=O)NCCCCOCc1ccccc1)N1CCc2ccccc2C1 ZINC000065386290 852118773 /nfs/dbraw/zinc/11/87/73/852118773.db2.gz YIBIUKFLDOCDPB-UHFFFAOYSA-N 0 3 409.574 4.120 20 0 HIADHN CCN(Cc1cccc(NC(=O)NC[C@H]2CCCCN2Cc2ccccc2)c1)C(C)=O ZINC000065408347 852122603 /nfs/dbraw/zinc/12/26/03/852122603.db2.gz FVCWELMHBILFNL-XMMPIXPASA-N 0 3 422.573 4.231 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2ccccc2CN2C[C@@H](C)O[C@@H](C)C2)N(C)C)cc1 ZINC000065412309 852123857 /nfs/dbraw/zinc/12/38/57/852123857.db2.gz IKOYODMOWQTFKZ-JXALWOEJSA-N 0 3 424.589 4.029 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2ccccc2OC[C@H]2CCCCO2)N(C)C)cc1 ZINC000065416958 852126015 /nfs/dbraw/zinc/12/60/15/852126015.db2.gz XTEHVIYCQKXRTN-IFMALSPDSA-N 0 3 411.546 4.367 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCCCCN(C)c3ccccc3)c(C)c2)CC1 ZINC000065438615 852132624 /nfs/dbraw/zinc/13/26/24/852132624.db2.gz ZLNYJOSHSNIBBE-UHFFFAOYSA-N 0 3 423.605 4.175 20 0 HIADHN COc1ccc([C@H](CNC(=O)Nc2cccc(N3CCCC3)c2)N2CCCC2)cc1 ZINC000065475734 852149088 /nfs/dbraw/zinc/14/90/88/852149088.db2.gz NJDHDPPXQJYEHJ-QHCPKHFHSA-N 0 3 408.546 4.254 20 0 HIADHN O=C(N[C@H]1CCCN(Cc2ccccc2)C1)N(Cc1ccccc1)C[C@@H]1CCCO1 ZINC000065478192 852150088 /nfs/dbraw/zinc/15/00/88/852150088.db2.gz KSTLCBXRCGXATL-ZEQRLZLVSA-N 0 3 407.558 4.042 20 0 HIADHN Cc1cc([C@H](C)NC(=O)NCCCCN2CCN(c3cccc(C)c3)CC2)c(C)o1 ZINC000065498861 852158723 /nfs/dbraw/zinc/15/87/23/852158723.db2.gz MCHIHTKBYKUQCN-FQEVSTJZSA-N 0 3 412.578 4.167 20 0 HIADHN Cc1cc(C)c(NC(=O)CN(C)C(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)c(C)c1 ZINC000065522117 852167271 /nfs/dbraw/zinc/16/72/71/852167271.db2.gz HLEQPEAVKJYJOG-UNMCSNQZSA-N 0 3 422.573 4.027 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)NCc2cc(F)ccc2Br)C1 ZINC000065521370 852167298 /nfs/dbraw/zinc/16/72/98/852167298.db2.gz AFKBBGIFDYYFTD-KSSFIOAISA-N 0 3 420.326 4.223 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)NCc2cc(Br)ccc2F)C1 ZINC000065523572 852168073 /nfs/dbraw/zinc/16/80/73/852168073.db2.gz PJPFZZXSVPPHRZ-KSSFIOAISA-N 0 3 420.326 4.223 20 0 HIADHN CN(CCNC(=O)N(Cc1cccc(Br)c1)C1CC1)Cc1ccccc1 ZINC000065542741 852171843 /nfs/dbraw/zinc/17/18/43/852171843.db2.gz GMPGHPVQGQEMMN-UHFFFAOYSA-N 0 3 416.363 4.255 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=S)Nc3cc(C)ccc3F)CC2)c1 ZINC000065702240 852224162 /nfs/dbraw/zinc/22/41/62/852224162.db2.gz FENGOBRFNHBCFR-UHFFFAOYSA-N 0 3 414.594 4.331 20 0 HIADHN CCOC(=O)c1ccc(NC(=S)N(CCN(C)C)Cc2cccc(Cl)c2)cc1 ZINC000065704363 852225258 /nfs/dbraw/zinc/22/52/58/852225258.db2.gz MLXABOXZHJNVFE-UHFFFAOYSA-N 0 3 419.978 4.277 20 0 HIADHN COc1ccccc1NC(=S)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1 ZINC000065704460 852226390 /nfs/dbraw/zinc/22/63/90/852226390.db2.gz PYRHMSCUSUAVDR-UHFFFAOYSA-N 0 3 411.493 4.475 20 0 HIADHN CN(C)CCN(C(=O)CCc1ncc(-c2ccc(F)cc2F)o1)C1CCCCC1 ZINC000065745919 852242648 /nfs/dbraw/zinc/24/26/48/852242648.db2.gz IOPZFLPIQFTPLU-UHFFFAOYSA-N 0 3 405.489 4.275 20 0 HIADHN O=S(=O)(/C=C/c1ccc(Cl)cc1)NC[C@H]1CCCN(Cc2ccccc2)C1 ZINC000065885942 852302251 /nfs/dbraw/zinc/30/22/51/852302251.db2.gz QZCPNBOLVPFGAN-CMQXMCPJSA-N 0 3 404.963 4.142 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)c1csc(-c2cccs2)n1 ZINC000065937858 852326618 /nfs/dbraw/zinc/32/66/18/852326618.db2.gz ZRKZZIBPCWYJCH-UHFFFAOYSA-N 0 3 407.511 4.354 20 0 HIADHN Cc1ccc(C(=O)N(CCN(C)C)Cc2cccc(F)c2)cc1NC(=O)c1ccco1 ZINC000065939082 852327801 /nfs/dbraw/zinc/32/78/01/852327801.db2.gz IJWRFNBJMBQSAP-UHFFFAOYSA-N 0 3 423.488 4.183 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)CCc1nc2ccccc2s1 ZINC000065938788 852328058 /nfs/dbraw/zinc/32/80/58/852328058.db2.gz FBOXMBXOLMOVSM-UHFFFAOYSA-N 0 3 403.498 4.098 20 0 HIADHN CCOc1ccc(CC(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)cc1 ZINC000065939063 852328577 /nfs/dbraw/zinc/32/85/77/852328577.db2.gz BVBUYBGYCXLVMA-UHFFFAOYSA-N 0 3 408.464 4.237 20 0 HIADHN C[C@H]1CCCN(C(=O)C2CCN(Cc3ccc(OCc4ccccn4)cc3)CC2)C1 ZINC000065950465 852330352 /nfs/dbraw/zinc/33/03/52/852330352.db2.gz TZXLHQLMYMVRDU-FQEVSTJZSA-N 0 3 407.558 4.131 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)Nc1ccc(OC(F)F)c2ncccc12 ZINC000072008127 852463283 /nfs/dbraw/zinc/46/32/83/852463283.db2.gz KHNJBZBYQYMHFJ-UHFFFAOYSA-N 0 3 414.456 4.432 20 0 HIADHN C[C@H](SCC(=O)N[C@H](CN1CCCC1)c1ccccc1)c1nc2ccccc2[nH]1 ZINC000097121360 852584183 /nfs/dbraw/zinc/58/41/83/852584183.db2.gz VXVAKVJDZPVIDD-LAUBAEHRSA-N 0 3 408.571 4.310 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cc(C)n(-c2cc(C)on2)c1C)c1ccsc1 ZINC000097327272 852601739 /nfs/dbraw/zinc/60/17/39/852601739.db2.gz DLOYGQBFHHYFFC-IBGZPJMESA-N 0 3 400.548 4.265 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cc(C)n(Cc2ccccn2)c1C)c1ccsc1 ZINC000097327275 852602534 /nfs/dbraw/zinc/60/25/34/852602534.db2.gz KJSCNBAMTRPABA-JOCHJYFZSA-N 0 3 410.587 4.423 20 0 HIADHN Cc1cc(C)n(-c2ccc(Cl)c(C(=O)NC[C@@H](c3ccccc3)N3CCCC3)n2)n1 ZINC000098076460 852655343 /nfs/dbraw/zinc/65/53/43/852655343.db2.gz PDXMZDNMAXFEEB-FQEVSTJZSA-N 0 3 423.948 4.104 20 0 HIADHN Cc1ccc(-n2ncc(C(=O)NC[C@H](c3ccccc3)N(C)C)c2C(F)(F)F)cc1 ZINC000105596886 852716214 /nfs/dbraw/zinc/71/62/14/852716214.db2.gz LMYDUXRHAOCSLO-LJQANCHMSA-N 0 3 416.447 4.232 20 0 HIADHN O=C(c1cc(-c2cccs2)[nH]n1)N1CCCN(Cc2ccc(Cl)cc2)CC1 ZINC000107716136 852790065 /nfs/dbraw/zinc/79/00/65/852790065.db2.gz WZSGBIRRGCDNCM-UHFFFAOYSA-N 0 3 400.935 4.140 20 0 HIADHN COc1ccccc1[C@@H](CNC(=O)[C@@H]1CCCN1Cc1ccccc1)N1CCCCC1 ZINC000108934209 852895658 /nfs/dbraw/zinc/89/56/58/852895658.db2.gz DXTZVTYDYJYJJM-BJKOFHAPSA-N 0 3 421.585 4.003 20 0 HIADHN C[C@@H](NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(OCC(F)(F)F)cc1 ZINC000109040134 852913596 /nfs/dbraw/zinc/91/35/96/852913596.db2.gz NYJQBOMKCUATBI-VQIMIIECSA-N 0 3 421.463 4.262 20 0 HIADHN CC(C)Oc1cccc([C@H](C)NC(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)c1 ZINC000109188532 852932984 /nfs/dbraw/zinc/93/29/84/852932984.db2.gz DNQBMWOPRLQICG-FQEVSTJZSA-N 0 3 409.574 4.495 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2ccc(CNC(=O)c3cccs3)cc2)N(C)C)cc1 ZINC000109289347 852947314 /nfs/dbraw/zinc/94/73/14/852947314.db2.gz WGFUHMGBPVPOED-NRFANRHFSA-N 0 3 421.566 4.019 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)c1[nH]c2ccccc2c1Br ZINC000109343801 852955243 /nfs/dbraw/zinc/95/52/43/852955243.db2.gz DCGZENRQRSSGRO-UHFFFAOYSA-N 0 3 418.310 4.274 20 0 HIADHN O=C(NCc1ccc(N2CCCCCC2)nc1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000109347391 852956686 /nfs/dbraw/zinc/95/66/86/852956686.db2.gz OCEKPMIMHSGJTC-QFIPXVFZSA-N 0 3 424.564 4.130 20 0 HIADHN CC(=O)c1cccc(O[C@H](C)C(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)c1 ZINC000109366392 852959740 /nfs/dbraw/zinc/95/97/40/852959740.db2.gz ZOBAFQZYOHLFFV-NQIIRXRSSA-N 0 3 414.571 4.307 20 0 HIADHN Cc1cc(C)n(Cc2cccc(C(=O)NC[C@H](c3ccccc3)N3CCCC3)c2)n1 ZINC000109383553 852963238 /nfs/dbraw/zinc/96/32/38/852963238.db2.gz WLEMLHFVRMRMJC-XMMPIXPASA-N 0 3 402.542 4.115 20 0 HIADHN C[C@@H]1C[C@@H]1C(=O)Nc1cccc(C(=O)Nc2ccc(CCN3CCSCC3)cc2)c1 ZINC000109484511 852975908 /nfs/dbraw/zinc/97/59/08/852975908.db2.gz WGWVETSMGNJVMU-VGSWGCGISA-N 0 3 423.582 4.125 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N(C)CCOc3cccc(Cl)c3)cc2)CC1 ZINC000109489180 852976173 /nfs/dbraw/zinc/97/61/73/852976173.db2.gz QGHQSEQWUAIWEY-UHFFFAOYSA-N 0 3 415.965 4.021 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2ccc(F)cc2Br)N2CCCC2)cc1 ZINC000109505552 852978189 /nfs/dbraw/zinc/97/81/89/852978189.db2.gz YHIPBGIWSHMGNG-LJQANCHMSA-N 0 3 405.311 4.464 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2ccc(NC(=O)[C@@H]3C[C@@H]3C)cc2)N2CCCC2)cc1 ZINC000109505368 852978195 /nfs/dbraw/zinc/97/81/95/852978195.db2.gz JZZPKQPRRIKOHS-NMNUPHIUSA-N 0 3 405.542 4.156 20 0 HIADHN CCc1nc(C(=O)N2CCCN(C(C)(C)C)CC2)nn1-c1c(Cl)cccc1Cl ZINC000109770559 853011366 /nfs/dbraw/zinc/01/13/66/853011366.db2.gz SFUZMNVTAFLJCQ-UHFFFAOYSA-N 0 3 424.376 4.083 20 0 HIADHN CN(C(=O)c1csc(-c2ccccc2F)n1)C1CCN(CCc2ccccn2)CC1 ZINC000109809063 853016961 /nfs/dbraw/zinc/01/69/61/853016961.db2.gz KGQMOVLAAMIXNC-UHFFFAOYSA-N 0 3 424.545 4.123 20 0 HIADHN Cc1ccc(-c2nc(C)c(C(=O)N(C)C3CCN(CCc4ccccn4)CC3)s2)o1 ZINC000109809669 853017380 /nfs/dbraw/zinc/01/73/80/853017380.db2.gz JDMNXMZWCUQDSC-UHFFFAOYSA-N 0 3 424.570 4.194 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)Nc3ccc(N(C)C)c(Cl)c3)cc2)CC1 ZINC000109902811 853032684 /nfs/dbraw/zinc/03/26/84/853032684.db2.gz DNPZMYIBVFQBRS-UHFFFAOYSA-N 0 3 400.954 4.189 20 0 HIADHN NC(=O)[C@@H]1CCCN(Cc2ccccc2NC(=O)c2ccc(-c3ccc(F)cc3)o2)C1 ZINC000109939776 853037594 /nfs/dbraw/zinc/03/75/94/853037594.db2.gz QPAWKFOXRVPKBW-GOSISDBHSA-N 0 3 421.472 4.035 20 0 HIADHN COc1ccc(OC)c([C@H](O)CNCc2cc3ccccc3nc2N2CCCCC2)c1 ZINC000110252696 853080463 /nfs/dbraw/zinc/08/04/63/853080463.db2.gz JBQAAWWARNSZDE-HSZRJFAPSA-N 0 3 421.541 4.066 20 0 HIADHN C[C@@H](Sc1ccccc1Cl)C(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000110413471 853096848 /nfs/dbraw/zinc/09/68/48/853096848.db2.gz WUTQPLYRQPSLPO-IXDOHACOSA-N 0 3 411.011 4.168 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)CSc3ccc(C(C)(C)C)cc3)CC2)C[C@@H](C)O1 ZINC000110416850 853097807 /nfs/dbraw/zinc/09/78/07/853097807.db2.gz LGSCAVFOAHZXFA-RTBURBONSA-N 0 3 418.647 4.424 20 0 HIADHN CC(C)Cn1cc(C(=O)N2CCC(CN3C[C@H](C)O[C@@H](C)C3)CC2)c2ccccc21 ZINC000110417426 853097888 /nfs/dbraw/zinc/09/78/88/853097888.db2.gz SBVSAUZTFQZKCL-PMACEKPBSA-N 0 3 411.590 4.259 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)c3cccc4c5c([nH]c43)CCCC5)CC2)C[C@H](C)O1 ZINC000110451204 853101320 /nfs/dbraw/zinc/10/13/20/853101320.db2.gz BJLDAPFDSWCRKZ-ROUUACIJSA-N 0 3 409.574 4.008 20 0 HIADHN Cc1nn(-c2cccc(Cl)c2)c2sc(C(=O)N3CC[C@@H](N4CCCC4)C3)cc12 ZINC000110516455 853112042 /nfs/dbraw/zinc/11/20/42/853112042.db2.gz XQMKDEFPBPVKHT-QGZVFWFLSA-N 0 3 414.962 4.359 20 0 HIADHN CCOCCCn1c2ccccc2nc1NC(=O)c1cccc(CN2CCCC2)c1 ZINC000110800314 853154124 /nfs/dbraw/zinc/15/41/24/853154124.db2.gz KTTSXWPTBSMDGW-UHFFFAOYSA-N 0 3 406.530 4.311 20 0 HIADHN Cc1noc(C2CCN(CCC(=O)Nc3ccccc3Oc3ccccc3)CC2)n1 ZINC000110985516 853179560 /nfs/dbraw/zinc/17/95/60/853179560.db2.gz BSXOYGIBMTVUKK-UHFFFAOYSA-N 0 3 406.486 4.379 20 0 HIADHN O=C(NCCCOc1cccc2cccnc21)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000111021359 853189246 /nfs/dbraw/zinc/18/92/46/853189246.db2.gz WLAMXOVFSFIMJU-OAQYLSRUSA-N 0 3 421.516 4.171 20 0 HIADHN Cc1nc(CN2CCC(C(=O)Nc3ccccc3-c3nnc(C(C)C)[nH]3)CC2)cs1 ZINC000111042095 853192008 /nfs/dbraw/zinc/19/20/08/853192008.db2.gz CQRGTZRGOYOIFY-UHFFFAOYSA-N 0 3 424.574 4.211 20 0 HIADHN CN(Cc1nc2ccccc2s1)Cn1ccc(=O)c2cccc(Br)c21 ZINC000111118485 853204263 /nfs/dbraw/zinc/20/42/63/853204263.db2.gz ZVCXSBVKKLPXFY-UHFFFAOYSA-N 0 3 414.328 4.463 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1[nH]nc(C(C)C)c1Br)c1ccsc1 ZINC000111144850 853209420 /nfs/dbraw/zinc/20/94/20/853209420.db2.gz RJVPSIZNCCZVRF-ZDUSSCGKSA-N 0 3 413.385 4.170 20 0 HIADHN COc1ccc(C)cc1NC(=O)[C@@H](C)N(C)CCCc1cc(-c2ccc(F)cc2)n[nH]1 ZINC000111178134 853217901 /nfs/dbraw/zinc/21/79/01/853217901.db2.gz RTBKNPLDMSQDLA-QGZVFWFLSA-N 0 3 424.520 4.424 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cc(C)ccc1-n1ccnc1)c1cccc(OC)c1 ZINC000112628196 853235095 /nfs/dbraw/zinc/23/50/95/853235095.db2.gz YUUHETTYVQPVSP-HSZRJFAPSA-N 0 3 406.530 4.002 20 0 HIADHN O=C1O[C@@H](CN(CCc2ccccn2)Cc2ccc(F)cc2)CN1c1ccccc1 ZINC000112665117 853237939 /nfs/dbraw/zinc/23/79/39/853237939.db2.gz JRITUUNHYVQCCN-QHCPKHFHSA-N 0 3 405.473 4.291 20 0 HIADHN O=C([C@H]1CCCN(Cc2cccnc2)C1)N1CCC(c2nc3ccccc3s2)CC1 ZINC000115839393 853268642 /nfs/dbraw/zinc/26/86/42/853268642.db2.gz RBMRFSADAKFZAB-FQEVSTJZSA-N 0 3 420.582 4.310 20 0 HIADHN CCCN(C(=O)c1ccc2c(c1)NC(=O)CS2)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000116526047 853312695 /nfs/dbraw/zinc/31/26/95/853312695.db2.gz JUTUXMFTKNLINO-HXUWFJFHSA-N 0 3 423.582 4.248 20 0 HIADHN O=C(NC1CCN(Cc2ccc(OCc3ccccn3)cc2)CC1)c1ccc(F)cc1 ZINC000139228224 853406570 /nfs/dbraw/zinc/40/65/70/853406570.db2.gz FLFBVKWNZIYBMA-UHFFFAOYSA-N 0 3 419.500 4.194 20 0 HIADHN CCOc1c(Cl)cc(CNC(=O)c2cccc(CN3CCCC3)c2)cc1OC ZINC000139332815 853408628 /nfs/dbraw/zinc/40/86/28/853408628.db2.gz CPQAUQJLRGUKTQ-UHFFFAOYSA-N 0 3 402.922 4.273 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCc1nc(C)cs1)c1ccc(C(F)(F)F)cc1 ZINC000139691079 853419522 /nfs/dbraw/zinc/41/95/22/853419522.db2.gz HWVNYYGOYDGKLT-MRXNPFEDSA-N 0 3 414.497 4.353 20 0 HIADHN Fc1ccc(COc2ccc(CN3CCC(c4nnc5n4CCC5)CC3)cc2)cc1 ZINC000139924983 853427140 /nfs/dbraw/zinc/42/71/40/853427140.db2.gz OCISXYOAHQLHGC-UHFFFAOYSA-N 0 3 406.505 4.322 20 0 HIADHN CC(C)c1cc(C(=O)NC[C@@H]2CCCN(Cc3cccs3)C2)nn1C(C)(C)C ZINC000139987142 853429659 /nfs/dbraw/zinc/42/96/59/853429659.db2.gz BHEKXIQHAFNREW-KRWDZBQOSA-N 0 3 402.608 4.465 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)Nc1cccc2ccccc21)c1ccc(N2CCOCC2)cc1 ZINC000140206444 853437838 /nfs/dbraw/zinc/43/78/38/853437838.db2.gz ZBZLUVGZMJMSKA-MOPGFXCFSA-N 0 3 403.526 4.354 20 0 HIADHN COc1ccc(CNCc2ccc(Cn3ccccc3=O)cc2)cc1OCC(C)C ZINC000140420303 853443963 /nfs/dbraw/zinc/44/39/63/853443963.db2.gz ADALBZDDQBESBF-UHFFFAOYSA-N 0 3 406.526 4.230 20 0 HIADHN Cc1nn(CC(C)C)c(C)c1CCC(=O)NC[C@@H](c1ccc(C)cc1)N1CCCC1 ZINC000143200662 853509769 /nfs/dbraw/zinc/50/97/69/853509769.db2.gz QKKHQJGPTFQPDN-DEOSSOPVSA-N 0 3 410.606 4.350 20 0 HIADHN S=C(N[C@H](c1ccccc1)c1ccccn1)NC1CCN(Cc2ccccc2)CC1 ZINC000145489859 853552422 /nfs/dbraw/zinc/55/24/22/853552422.db2.gz SHXNCZGHELNYOL-XMMPIXPASA-N 0 3 416.594 4.300 20 0 HIADHN COc1cccc([C@H](CNC(=O)NCc2ccccc2OC(C)C)N2CCCC2)c1 ZINC000195555477 853681806 /nfs/dbraw/zinc/68/18/06/853681806.db2.gz ZNDYQCKDTLHNMX-QFIPXVFZSA-N 0 3 411.546 4.119 20 0 HIADHN CC[C@@H](C)NC(=O)c1ccc(NC(=O)N[C@@H](CN2CCCC2)c2ccccc2)cc1 ZINC000195612954 853713922 /nfs/dbraw/zinc/71/39/22/853713922.db2.gz KFTZNROETGSZMY-GCJKJVERSA-N 0 3 408.546 4.174 20 0 HIADHN Cc1nc(COc2ccc(F)cc2)sc1C(=O)N[C@@H](C)CN1C[C@H](C)C[C@H](C)C1 ZINC000195625540 853722938 /nfs/dbraw/zinc/72/29/38/853722938.db2.gz CYMJHEAAKCXRTN-XHSDSOJGSA-N 0 3 419.566 4.266 20 0 HIADHN O=C(NC[C@@H]1CCCO[C@H]1c1ccccc1)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000195660494 853742043 /nfs/dbraw/zinc/74/20/43/853742043.db2.gz MVSXEFGARZTYNS-HJOGWXRNSA-N 0 3 407.558 4.291 20 0 HIADHN COc1ccc([C@H](NCC(=O)NCc2ccc(F)cc2C(F)(F)F)C2CC2)cc1 ZINC000195668017 853747265 /nfs/dbraw/zinc/74/72/65/853747265.db2.gz IOQYCYDKDHNVAW-HXUWFJFHSA-N 0 3 410.411 4.210 20 0 HIADHN COc1ccc([C@@H](NCC(=O)Nc2cc(C3CC3)nn2-c2ccccc2)C2CC2)cc1 ZINC000195673905 853750604 /nfs/dbraw/zinc/75/06/04/853750604.db2.gz YYZFAMVWNDPNMS-VWLOTQADSA-N 0 3 416.525 4.438 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3ccc(NC(=O)C4CC4)cc3)c(C)c2)CC1 ZINC000195700863 853766225 /nfs/dbraw/zinc/76/62/25/853766225.db2.gz DCFKRWHWOAPGSU-UHFFFAOYSA-N 0 3 421.545 4.129 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3cc(NC(C)=O)ccc3C)c(C)c2)CC1 ZINC000195700996 853767678 /nfs/dbraw/zinc/76/76/78/853767678.db2.gz HGMRUXOWXHHFIO-UHFFFAOYSA-N 0 3 409.534 4.048 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(S(=O)(=O)N(C)C)cc1)c1ccc(C(F)(F)F)cc1 ZINC000195702194 853768635 /nfs/dbraw/zinc/76/86/35/853768635.db2.gz CDNQACFENYNPQB-KGLIPLIRSA-N 0 3 400.466 4.368 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)c1cc(Br)cs1 ZINC000195744358 853791060 /nfs/dbraw/zinc/79/10/60/853791060.db2.gz PDCGKIGTPKLGET-UHFFFAOYSA-N 0 3 411.390 4.354 20 0 HIADHN CCN1CCN(CCCNC(=O)/C=C\c2ccc(-c3ccccc3Cl)s2)CC1 ZINC000213665662 853826079 /nfs/dbraw/zinc/82/60/79/853826079.db2.gz GKIHFOFXUGWLSP-LUAWRHEFSA-N 0 3 418.006 4.226 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)[C@@H]2C[C@H]2c2ccc(Br)cc2)CC1 ZINC000216497199 853854080 /nfs/dbraw/zinc/85/40/80/853854080.db2.gz RNJGOSRPWVNDFG-VQTJNVASSA-N 0 3 417.347 4.269 20 0 HIADHN c1ccc(COc2cccc(CN[C@@H](CN3CCOCC3)c3ccccc3)c2)cc1 ZINC000216503636 853854557 /nfs/dbraw/zinc/85/45/57/853854557.db2.gz WWMVHEDGGKAFST-SANMLTNESA-N 0 3 402.538 4.429 20 0 HIADHN C[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000228971620 853890880 /nfs/dbraw/zinc/89/08/80/853890880.db2.gz AAJVVEUABAIFGX-ZCNNSNEGSA-N 0 3 416.606 4.099 20 0 HIADHN Brc1ccc(OCc2ccccn2)c(CNCCc2cscn2)c1 ZINC000236733627 853917307 /nfs/dbraw/zinc/91/73/07/853917307.db2.gz BZIQLJSEOUZWRN-UHFFFAOYSA-N 0 3 404.333 4.212 20 0 HIADHN CC(C)(C)[S@](=O)CCNCc1ccc(OC(F)(F)[C@@H](F)C(F)(F)F)cc1 ZINC000236739276 853918731 /nfs/dbraw/zinc/91/87/31/853918731.db2.gz CWQDDWCEJRNAGZ-WHDAMIPWSA-N 0 3 405.404 4.195 20 0 HIADHN Cc1nn(-c2ccc(F)cc2F)c(C)c1CNC[C@H](O)c1ccc(OC(C)C)cc1 ZINC000236811135 853925742 /nfs/dbraw/zinc/92/57/42/853925742.db2.gz RUWUSMPSSWHAKB-QHCPKHFHSA-N 0 3 415.484 4.378 20 0 HIADHN CC(C)(N)C(=O)Nc1ncc(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)s1 ZINC000236818155 853926645 /nfs/dbraw/zinc/92/66/45/853926645.db2.gz UIOHETIKJUUJGE-UHFFFAOYSA-N 0 3 411.371 4.447 20 0 HIADHN CN(C)C(=O)COc1cccc(CNCC2=Cc3cc(Cl)cc(Cl)c3OC2)c1 ZINC000236961830 853943244 /nfs/dbraw/zinc/94/32/44/853943244.db2.gz QLLLLKZLJSLJHK-UHFFFAOYSA-N 0 3 421.324 4.026 20 0 HIADHN CC[C@@H](C(=O)N1CCC(NCc2csc(-c3ccccn3)n2)CC1)c1ccccc1 ZINC000236965289 853943417 /nfs/dbraw/zinc/94/34/17/853943417.db2.gz DZNRVQWZCYICIF-OAQYLSRUSA-N 0 3 420.582 4.480 20 0 HIADHN CCOc1ccc(Oc2cc(CNCc3ccc(-n4cncn4)c(C)c3)ccn2)cc1 ZINC000236978670 853946623 /nfs/dbraw/zinc/94/66/23/853946623.db2.gz BMHJJSNOXDJISI-UHFFFAOYSA-N 0 3 415.497 4.452 20 0 HIADHN CNC(=O)c1cccc(CCNCc2c(Cl)n(-c3ccccc3)nc2C(C)C)c1 ZINC000237048041 853956853 /nfs/dbraw/zinc/95/68/53/853956853.db2.gz AMKDRFYKENVHTE-UHFFFAOYSA-N 0 3 410.949 4.341 20 0 HIADHN COC(=O)c1cc(CNCc2cn(-c3ccccc3)nc2-c2ccc(F)cc2)c[nH]1 ZINC000237126512 853968864 /nfs/dbraw/zinc/96/88/64/853968864.db2.gz ICXANYOQHPFQET-UHFFFAOYSA-N 0 3 404.445 4.083 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)C[C@H](C)NCc1cc2c(cc1OC)C[C@H](C)O2 ZINC000237146507 853972560 /nfs/dbraw/zinc/97/25/60/853972560.db2.gz ILYONWNHYRUHAC-KBPBESRZSA-N 0 3 418.921 4.188 20 0 HIADHN COCCOc1ccc(CNCc2ccc(-n3ccc(C(F)(F)F)n3)cc2)cc1 ZINC000237211816 853983015 /nfs/dbraw/zinc/98/30/15/853983015.db2.gz SJTISCINCZCWIK-UHFFFAOYSA-N 0 3 405.420 4.206 20 0 HIADHN COc1cc(CNCc2cn(C)nc2-c2ccncc2)ccc1OCc1ccccc1 ZINC000237227477 853986330 /nfs/dbraw/zinc/98/63/30/853986330.db2.gz JUSDQKRLZLLSAA-UHFFFAOYSA-N 0 3 414.509 4.360 20 0 HIADHN COc1cc(CNCc2cccnc2-n2cccn2)ccc1OCc1ccc(F)cc1 ZINC000237225947 853986553 /nfs/dbraw/zinc/98/65/53/853986553.db2.gz HVYHHAVMRWVUJC-UHFFFAOYSA-N 0 3 418.472 4.284 20 0 HIADHN COc1cc(Br)cc(C[NH2+]C[C@@H](c2ccco2)N2CCCCC2)c1[O-] ZINC000237244674 853989975 /nfs/dbraw/zinc/98/99/75/853989975.db2.gz DJDBQBPKBGFWFQ-INIZCTEOSA-N 0 3 409.324 4.073 20 0 HIADHN COc1cc(Br)cc(C[NH2+]CCc2coc(-c3ccc(F)cc3)n2)c1[O-] ZINC000237242434 853990006 /nfs/dbraw/zinc/99/00/06/853990006.db2.gz XKRRAWZSQJYMAK-UHFFFAOYSA-N 0 3 421.266 4.290 20 0 HIADHN COc1cc(CNCc2ccc(N3CCCCC3=O)cc2)ccc1OCC(F)(F)F ZINC000237250519 853990747 /nfs/dbraw/zinc/99/07/47/853990747.db2.gz PZQLVVAZINEFAF-UHFFFAOYSA-N 0 3 422.447 4.443 20 0 HIADHN COCc1nc2n(n1)C[C@@H](NCc1ccc(-c3ccc(Cl)c(Cl)c3)o1)CC2 ZINC000237289613 853998587 /nfs/dbraw/zinc/99/85/87/853998587.db2.gz FDNILEJANQLBRY-ZDUSSCGKSA-N 0 3 407.301 4.096 20 0 HIADHN COc1cc(CNCc2ccnc(-n3cccn3)c2)ccc1OCc1ccc(F)cc1 ZINC000237290069 853998624 /nfs/dbraw/zinc/99/86/24/853998624.db2.gz DKRUUEQBYPLGMN-UHFFFAOYSA-N 0 3 418.472 4.284 20 0 HIADHN COc1ccc(OCc2ccccn2)c(CNCCc2csc(N3CCCC3)n2)c1 ZINC000237291425 853999626 /nfs/dbraw/zinc/99/96/26/853999626.db2.gz VLHAHXFZKTWIFK-UHFFFAOYSA-N 0 3 424.570 4.058 20 0 HIADHN COc1cccc(CNCc2ccccc2CN2C[C@@H](C)O[C@H](C)C2)c1OC(F)F ZINC000237388252 854020500 /nfs/dbraw/zinc/02/05/00/854020500.db2.gz QDQZEQSWMCUKPM-IAGOWNOFSA-N 0 3 420.500 4.196 20 0 HIADHN COc1cc(CNCCc2nc(-c3cccc(Cl)c3)no2)c(SC)cc1OC ZINC000237417345 854027510 /nfs/dbraw/zinc/02/75/10/854027510.db2.gz ZXZIWKOWRIKWDX-UHFFFAOYSA-N 0 3 419.934 4.461 20 0 HIADHN COc1cc(CN[C@H]2CCSc3ccccc32)ccc1OCC(=O)N1CCCC1 ZINC000237420630 854028784 /nfs/dbraw/zinc/02/87/84/854028784.db2.gz FAUXSMJGOZUZHK-IBGZPJMESA-N 0 3 412.555 4.023 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(CNC[C@](C)(O)c3cc(C)oc3C)c2)cc1 ZINC000237466810 854038033 /nfs/dbraw/zinc/03/80/33/854038033.db2.gz SCOXLZMJGTYLKQ-DEOSSOPVSA-N 0 3 408.498 4.155 20 0 HIADHN COc1cc(OC)cc([C@@H](O)CNCc2cc3ccccc3nc2N2CCCCC2)c1 ZINC000237464375 854038250 /nfs/dbraw/zinc/03/82/50/854038250.db2.gz MBHOCSNGXDPHKK-DEOSSOPVSA-N 0 3 421.541 4.066 20 0 HIADHN C[C@@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@H]1CNCc1cnc(-c2ccccn2)s1 ZINC000237474890 854041225 /nfs/dbraw/zinc/04/12/25/854041225.db2.gz HJPHASOOLAUEAG-YOEHRIQHSA-N 0 3 418.563 4.055 20 0 HIADHN C[C@H](NCc1ccc(F)c(Br)c1)c1ccc(OCC(=O)NC2CC2)cc1 ZINC000237601979 854060605 /nfs/dbraw/zinc/06/06/05/854060605.db2.gz QRGFDTVIUCTZGY-ZDUSSCGKSA-N 0 3 421.310 4.096 20 0 HIADHN Cc1ccc(C(=O)Nc2cccc(CN[C@@H]3CCN(C(=O)OC(C)(C)C)C3)c2)cc1 ZINC000237650981 854067754 /nfs/dbraw/zinc/06/77/54/854067754.db2.gz HTWPLLUHWHHXSV-OAQYLSRUSA-N 0 3 409.530 4.346 20 0 HIADHN Cc1nn(-c2ccc(Br)cc2)c(C)c1CNC[C@@H](O)c1ccc(C)cc1 ZINC000237650617 854067767 /nfs/dbraw/zinc/06/77/67/854067767.db2.gz KYILJXJLRVTKTG-OAQYLSRUSA-N 0 3 414.347 4.383 20 0 HIADHN Cc1nn(-c2ccc(Br)cc2)c(C)c1CNC[C@H](O)c1ccccc1F ZINC000237701106 854078810 /nfs/dbraw/zinc/07/88/10/854078810.db2.gz JUNCTVNXAQQBCK-FQEVSTJZSA-N 0 3 418.310 4.214 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)c(C)c1CNCc1ccc(CN2CCOCC2)cc1 ZINC000237724628 854083787 /nfs/dbraw/zinc/08/37/87/854083787.db2.gz PFLCHJVAAMVJQB-UHFFFAOYSA-N 0 3 424.976 4.265 20 0 HIADHN Cn1ncc2c1CCC[C@H]2NCc1ccc(OC(F)(F)[C@@H](F)C(F)(F)F)cc1 ZINC000237734354 854085695 /nfs/dbraw/zinc/08/56/95/854085695.db2.gz WXEUCUPBFWXINC-ZBFHGGJFSA-N 0 3 407.358 4.459 20 0 HIADHN Cc1nc2ccccc2n1CCCNCc1csc(-c2ccc3c(c2)OCO3)n1 ZINC000237765575 854091632 /nfs/dbraw/zinc/09/16/32/854091632.db2.gz ZTSNXACUWWRNAE-UHFFFAOYSA-N 0 3 406.511 4.377 20 0 HIADHN O=C(NCCNCC1=Cc2cc(Cl)cc(Cl)c2OC1)c1c(F)cccc1F ZINC000237764349 854091844 /nfs/dbraw/zinc/09/18/44/854091844.db2.gz RMIRWMGGPHLKBJ-UHFFFAOYSA-N 0 3 413.251 4.067 20 0 HIADHN Cc1nn(-c2ccccc2)cc1CNCc1ccccc1CN1C[C@H](C)O[C@@H](C)C1 ZINC000237778732 854095883 /nfs/dbraw/zinc/09/58/83/854095883.db2.gz ATRDFPMDHNVDMW-PMACEKPBSA-N 0 3 404.558 4.080 20 0 HIADHN NC(=O)c1ccc(CNCc2cn(Cc3ccccc3)nc2-c2cccs2)cc1 ZINC000237778505 854096358 /nfs/dbraw/zinc/09/63/58/854096358.db2.gz DWWQWPQLNUZZPP-UHFFFAOYSA-N 0 3 402.523 4.049 20 0 HIADHN Cc1nn(C)c(N2CCOCC2)c1CN[C@@H](CCc1ccccc1)c1ccccc1 ZINC000237827973 854104394 /nfs/dbraw/zinc/10/43/94/854104394.db2.gz DYZAILAEXDVGBP-DEOSSOPVSA-N 0 3 404.558 4.029 20 0 HIADHN Cn1c(CCNCc2cc(Cl)ccc2OC[C@H]2CCCO2)nc2c1cccc2F ZINC000237852492 854107572 /nfs/dbraw/zinc/10/75/72/854107572.db2.gz PYDHSTHFVLVTPP-QGZVFWFLSA-N 0 3 417.912 4.256 20 0 HIADHN O=C(NCCNCc1cc2ccccc2nc1N1CCCCC1)c1ccccc1Cl ZINC000237856368 854108521 /nfs/dbraw/zinc/10/85/21/854108521.db2.gz BXKHSOIJINNNLI-UHFFFAOYSA-N 0 3 422.960 4.398 20 0 HIADHN Cc1cccn2cc(COc3ccc(CN[C@](C)(CO)c4ccccc4)cc3)nc12 ZINC000237857857 854109471 /nfs/dbraw/zinc/10/94/71/854109471.db2.gz UUUUSFBMADFWCS-RUZDIDTESA-N 0 3 401.510 4.219 20 0 HIADHN Fc1cc(CN[C@@H]2CCc3c2cccc3Br)ccc1N1CCOCC1 ZINC000237863005 854110595 /nfs/dbraw/zinc/11/05/95/854110595.db2.gz XGSRATAPXUNQAE-LJQANCHMSA-N 0 3 405.311 4.202 20 0 HIADHN O=C(Nc1cccc(CNCc2ccnc(-n3ccnc3)c2)c1)c1ccccc1Cl ZINC000237864293 854110664 /nfs/dbraw/zinc/11/06/64/854110664.db2.gz HXVSQXUTPDXVRL-UHFFFAOYSA-N 0 3 417.900 4.463 20 0 HIADHN O=C(CC1CCCC1)NCCNCc1cccc(NC(=O)c2ccc(Cl)cc2)c1 ZINC000237871403 854111524 /nfs/dbraw/zinc/11/15/24/854111524.db2.gz MQEOMZZLQFCWOF-UHFFFAOYSA-N 0 3 413.949 4.378 20 0 HIADHN Cc1cc([C@](C)(O)CNCc2c(C)nn(Cc3ccccc3Cl)c2C)c(C)o1 ZINC000237879179 854113860 /nfs/dbraw/zinc/11/38/60/854113860.db2.gz IXKINHUHRCFXFF-JOCHJYFZSA-N 0 3 401.938 4.409 20 0 HIADHN Cc1cccn2cc(COc3ccc(CNCc4ccc(-n5cncn5)cc4)cc3)nc12 ZINC000237894194 854115717 /nfs/dbraw/zinc/11/57/17/854115717.db2.gz IERKLWBNBYOHQF-UHFFFAOYSA-N 0 3 424.508 4.092 20 0 HIADHN O[C@@H](CNCc1cnc(-c2ccccc2)s1)COc1cccc(C(F)(F)F)c1 ZINC000238074657 854140698 /nfs/dbraw/zinc/14/06/98/854140698.db2.gz KBPMRSNBVUMUSX-INIZCTEOSA-N 0 3 408.445 4.358 20 0 HIADHN O=C(CCc1ncc(-c2ccccc2F)o1)N1CCCN(Cc2ccccc2)CC1 ZINC000247803483 854162150 /nfs/dbraw/zinc/16/21/50/854162150.db2.gz XISFMYFTYVGKDH-UHFFFAOYSA-N 0 3 407.489 4.148 20 0 HIADHN Cc1noc(C)c1COc1cccc(C(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)c1 ZINC000250996174 854196462 /nfs/dbraw/zinc/19/64/62/854196462.db2.gz UZKOLJDIACWKKO-XMSQKQJNSA-N 0 3 419.525 4.436 20 0 HIADHN C[C@H](OC[C@H](O)CN1CCC[C@H]1c1ccc2c(c1)OCCO2)c1ccc(Cl)cc1 ZINC000253619512 854209705 /nfs/dbraw/zinc/20/97/05/854209705.db2.gz DBMRNOUGBYIQNM-DQLDELGASA-N 0 3 417.933 4.387 20 0 HIADHN O=C(CCc1cccc(Br)c1)NC[C@@H](c1cccs1)N1CCCC1 ZINC000255952813 854229198 /nfs/dbraw/zinc/22/91/98/854229198.db2.gz YNXWODMXDHOPDM-KRWDZBQOSA-N 0 3 407.377 4.397 20 0 HIADHN CN1CCN(C[C@@H](Nc2nc(-c3ccncc3)nc3ccccc32)c2ccccc2)CC1 ZINC000301148362 854312047 /nfs/dbraw/zinc/31/20/47/854312047.db2.gz IAIBEQAWKONWOB-XMMPIXPASA-N 0 3 424.552 4.092 20 0 HIADHN CCCNC(=O)C1CCN(c2c(C)c(C)nc3ccc(Br)cc32)CC1 ZINC000301349934 854367633 /nfs/dbraw/zinc/36/76/33/854367633.db2.gz IMRVGEASMANSQG-UHFFFAOYSA-N 0 3 404.352 4.357 20 0 HIADHN CN(C)[C@H](CNc1ncccc1C(=O)N1CCc2ccccc21)c1cccc(F)c1 ZINC000301355433 854369276 /nfs/dbraw/zinc/36/92/76/854369276.db2.gz LXALDYNQLJNZIN-JOCHJYFZSA-N 0 3 404.489 4.138 20 0 HIADHN CC(C)(C)OC(=O)N[C@@H](CNCc1cncc(Br)c1)c1ccccc1 ZINC000301818680 854470370 /nfs/dbraw/zinc/47/03/70/854470370.db2.gz WLRJZIGZMZTZAD-KRWDZBQOSA-N 0 3 406.324 4.200 20 0 HIADHN C[C@H](NCC(=O)N(Cc1cccs1)c1ccc2c(c1)OCCO2)c1ccccc1 ZINC000301905433 854489932 /nfs/dbraw/zinc/48/99/32/854489932.db2.gz IGEJSUZOYJCEDX-KRWDZBQOSA-N 0 3 408.523 4.403 20 0 HIADHN C[C@H]1C[C@@H](NCc2ccc(F)cc2Br)CCN1C(=O)OC(C)(C)C ZINC000302152140 854538134 /nfs/dbraw/zinc/53/81/34/854538134.db2.gz AWRBVLNDKZTGLV-WFASDCNBSA-N 0 3 401.320 4.466 20 0 HIADHN Cc1nn(Cc2ccc(F)cc2)c(Cl)c1CNCCc1ccc2c(c1)OCCO2 ZINC000302607786 854591044 /nfs/dbraw/zinc/59/10/44/854591044.db2.gz GMOAFKHCLURUEW-UHFFFAOYSA-N 0 3 415.896 4.136 20 0 HIADHN CCN1CCN([C@H](C)CNc2ccnc3c(Cl)cc(Br)cc23)CC1 ZINC000302753604 854621568 /nfs/dbraw/zinc/62/15/68/854621568.db2.gz VHLDCQYBJPGZKW-CYBMUJFWSA-N 0 3 411.775 4.089 20 0 HIADHN C[C@@H](N[C@H](Cc1ccccc1)c1ccccc1)C(=O)Nc1ccc2c(c1)OCCO2 ZINC000302804744 854639204 /nfs/dbraw/zinc/63/92/04/854639204.db2.gz KDRLDMPPSVUKTH-XMSQKQJNSA-N 0 3 402.494 4.358 20 0 HIADHN C[N@@H+]1CC[C@@H](Nc2nc(C(F)(F)F)nc3[n-]cnc32)[C@H]1c1ccc(Cl)c(F)c1 ZINC000302836773 854650784 /nfs/dbraw/zinc/65/07/84/854650784.db2.gz WVUWPTVBSXRLQG-DGCLKSJQSA-N 0 3 414.794 4.022 20 0 HIADHN C[N@H+]1CC[C@@H](Nc2nc(C(F)(F)F)nc3[n-]cnc32)[C@H]1c1ccc(Cl)c(F)c1 ZINC000302836773 854650791 /nfs/dbraw/zinc/65/07/91/854650791.db2.gz WVUWPTVBSXRLQG-DGCLKSJQSA-N 0 3 414.794 4.022 20 0 HIADHN CN1CC[C@@H](Nc2nc(C(F)(F)F)nc3[nH]cnc32)[C@H]1c1ccc(Cl)c(F)c1 ZINC000302836773 854650795 /nfs/dbraw/zinc/65/07/95/854650795.db2.gz WVUWPTVBSXRLQG-DGCLKSJQSA-N 0 3 414.794 4.022 20 0 HIADHN COc1cccc([C@H](CNC(=O)CCSc2ccccc2F)N2CCCC2)c1 ZINC000302849457 854655520 /nfs/dbraw/zinc/65/55/20/854655520.db2.gz IUDNUGMXFLRPSE-FQEVSTJZSA-N 0 3 402.535 4.270 20 0 HIADHN C[C@H](NCC(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1)c1cccc2ccccc21 ZINC000302918630 854679437 /nfs/dbraw/zinc/67/94/37/854679437.db2.gz CMHFUCCRPPVZLP-AWEZNQCLSA-N 0 3 418.465 4.125 20 0 HIADHN CN(C)[C@@H](CNC(=O)c1cc2c(cc(Br)cc2F)[nH]1)c1ccccc1 ZINC000302927151 854684074 /nfs/dbraw/zinc/68/40/74/854684074.db2.gz DMJUZWNJFNSWLM-SFHVURJKSA-N 0 3 404.283 4.102 20 0 HIADHN O=C(NCc1cccc(Br)c1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000302963982 854699693 /nfs/dbraw/zinc/69/96/93/854699693.db2.gz GQMNIZCHWXWTAT-KRWDZBQOSA-N 0 3 405.311 4.117 20 0 HIADHN COc1ccccc1C[C@@H]1CCCN1C(=O)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000303003373 854717996 /nfs/dbraw/zinc/71/79/96/854717996.db2.gz OSTKKVIAIOETCF-GOTSBHOMSA-N 0 3 407.558 4.249 20 0 HIADHN COc1ccccc1C[C@@H]1CCCN1C(=O)N[C@H](CN1CCCC1)c1ccccc1 ZINC000303003375 854718336 /nfs/dbraw/zinc/71/83/36/854718336.db2.gz OSTKKVIAIOETCF-XZOQPEGZSA-N 0 3 407.558 4.249 20 0 HIADHN COCCN(C(=O)[C@H]1CCCN(Cc2ccccc2)C1)c1nc2ccccc2s1 ZINC000303006219 854720228 /nfs/dbraw/zinc/72/02/28/854720228.db2.gz IKKWCKCNWRHUSS-IBGZPJMESA-N 0 3 409.555 4.188 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2cccc(OC[C@@H]3CCCO3)c2)N2CCCC2)cc1 ZINC000303035065 854733003 /nfs/dbraw/zinc/73/30/03/854733003.db2.gz OVBBQDOMQTWSTB-ZEQRLZLVSA-N 0 3 408.542 4.120 20 0 HIADHN COCCN1CCC(NC(=O)c2ccc(COc3ccc(C(C)(C)C)cc3)cc2)CC1 ZINC000303068054 854746385 /nfs/dbraw/zinc/74/63/85/854746385.db2.gz WGTSOIRDSITIJV-UHFFFAOYSA-N 0 3 424.585 4.404 20 0 HIADHN COc1c(F)cc(NC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)cc1F ZINC000303084547 854753271 /nfs/dbraw/zinc/75/32/71/854753271.db2.gz ATTLPZXZMLPAJB-LJQANCHMSA-N 0 3 414.374 4.367 20 0 HIADHN CC(C)(C)NC(=O)c1ccccc1NC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000303087365 854755441 /nfs/dbraw/zinc/75/54/41/854755441.db2.gz YDOUTXJUXMKUSO-GOSISDBHSA-N 0 3 411.521 4.205 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2ccccc2NC(=O)c2ccsc2)N(C)C)cc1 ZINC000303090642 854756150 /nfs/dbraw/zinc/75/61/50/854756150.db2.gz ZJTSRQXSEBCBKR-NRFANRHFSA-N 0 3 407.539 4.342 20 0 HIADHN COc1ccc2cc(NC(=O)c3ccc(N4CCN(C(C)C)CC4)cc3)ccc2n1 ZINC000303190641 854809904 /nfs/dbraw/zinc/80/99/04/854809904.db2.gz MOAIOXUNSJSZLA-UHFFFAOYSA-N 0 3 404.514 4.026 20 0 HIADHN CCN(CC)[C@@H](C(=O)NC[C@H](c1cccc(OC)c1)N1CCCC1)c1ccccc1 ZINC000303306580 854863398 /nfs/dbraw/zinc/86/33/98/854863398.db2.gz ZVNQNCDUNPJWOL-DNQXCXABSA-N 0 3 409.574 4.031 20 0 HIADHN O=C(NC[C@H](O)c1ccc2ccccc2c1)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000303345763 854884682 /nfs/dbraw/zinc/88/46/82/854884682.db2.gz DVJWVGSLNINTAA-ZEQRLZLVSA-N 0 3 403.526 4.010 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)CCc2cc(Br)cs2)N(C)C)cc1 ZINC000303360633 854891705 /nfs/dbraw/zinc/89/17/05/854891705.db2.gz ZORKVVALTBKRFE-GOSISDBHSA-N 0 3 409.393 4.425 20 0 HIADHN CCOc1ccc(CNC(=O)Nc2ccc(CCN3CCSCC3)cc2)cc1F ZINC000303379497 854900120 /nfs/dbraw/zinc/90/01/20/854900120.db2.gz XBBZRYRSOHRCIW-UHFFFAOYSA-N 0 3 417.550 4.137 20 0 HIADHN CCc1cccc2c(CC(=O)Nc3ccc(N4CCN(CC)CC4)cc3C)c[nH]c21 ZINC000303419390 854921972 /nfs/dbraw/zinc/92/19/72/854921972.db2.gz UGRMFOVQKYYOBV-UHFFFAOYSA-N 0 3 404.558 4.362 20 0 HIADHN O=C(NC[C@H](O)c1ccc2ccccc2c1)NC[C@H](c1ccccc1)N1CCCC1 ZINC000303431931 854933001 /nfs/dbraw/zinc/93/30/01/854933001.db2.gz XANCLOLBKNKWMA-RPWUZVMVSA-N 0 3 403.526 4.010 20 0 HIADHN Cc1c(C(=O)NC[C@H](c2ccccc2)N2CCCC2)cnn1-c1ccccc1Cl ZINC000303450517 854949482 /nfs/dbraw/zinc/94/94/82/854949482.db2.gz KHSXOMBQDQFNSI-JOCHJYFZSA-N 0 3 408.933 4.401 20 0 HIADHN COc1cc(CN(C)C[C@H](O)COc2ccccc2C(F)(F)F)ccc1SC ZINC000303636164 855092356 /nfs/dbraw/zinc/09/23/56/855092356.db2.gz GUBBBEGLVVTOIQ-HNNXBMFYSA-N 0 3 415.477 4.308 20 0 HIADHN Cc1cc(OCc2ccccc2)ccc1NC(=O)N(CCN(C)C)C[C@@H]1CCCO1 ZINC000303734121 855159169 /nfs/dbraw/zinc/15/91/69/855159169.db2.gz WFVWIOZPIGCLIP-QFIPXVFZSA-N 0 3 411.546 4.149 20 0 HIADHN COc1ccc(C(=O)CCC(=O)N(C)[C@H]2CCN(Cc3ccccc3)[C@H](C)C2)cc1 ZINC000303737415 855162273 /nfs/dbraw/zinc/16/22/73/855162273.db2.gz HCXLCFLXNIHMQE-KNQAVFIVSA-N 0 3 408.542 4.170 20 0 HIADHN CO[C@@H](c1ccc(Cl)cc1)[C@@H](C)NC(=O)N1CCCN(Cc2ccccc2)CC1 ZINC000303745990 855168214 /nfs/dbraw/zinc/16/82/14/855168214.db2.gz FZWAFIXNTOKVNS-XMSQKQJNSA-N 0 3 415.965 4.334 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)[C@H]3C[C@H]3c3c(F)cccc3Cl)cc2)CC1 ZINC000303797838 855203499 /nfs/dbraw/zinc/20/34/99/855203499.db2.gz GHDMWMUOAPQEHO-MOPGFXCFSA-N 0 3 415.940 4.359 20 0 HIADHN Cc1oc(-c2ccccc2)nc1CC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C ZINC000303845546 855241932 /nfs/dbraw/zinc/24/19/32/855241932.db2.gz NQEHDXJADWSJIF-IBGZPJMESA-N 0 3 403.526 4.316 20 0 HIADHN CCC[C@H](C(=O)Nc1ccc(C(=O)N(C)[C@H]2CCCN(C)C2)cc1)c1ccccc1 ZINC000303848326 855244734 /nfs/dbraw/zinc/24/47/34/855244734.db2.gz FDRXXESXRFSGPC-GOTSBHOMSA-N 0 3 407.558 4.375 20 0 HIADHN CCC[C@@H](C(=O)Nc1ccc(C(=O)N(C)[C@H]2CCCN(C)C2)cc1)c1ccccc1 ZINC000303848334 855245019 /nfs/dbraw/zinc/24/50/19/855245019.db2.gz FDRXXESXRFSGPC-XZOQPEGZSA-N 0 3 407.558 4.375 20 0 HIADHN Cc1ccc(Cl)cc1S(=O)(=O)N(C)[C@@H]1CCN(Cc2ccccc2)[C@H](C)C1 ZINC000303848721 855245342 /nfs/dbraw/zinc/24/53/42/855245342.db2.gz UQXXKYMMYIWGJI-YLJYHZDGSA-N 0 3 406.979 4.322 20 0 HIADHN CCc1ccc([C@@H]2COCCN2C(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)o1 ZINC000303880256 855266654 /nfs/dbraw/zinc/26/66/54/855266654.db2.gz QYIHWWCAENXXMJ-YADHBBJMSA-N 0 3 411.546 4.070 20 0 HIADHN CN(C(=O)c1cn(-c2ccccc2)nc1-c1ccc(Cl)cc1)[C@H]1CCCN(C)C1 ZINC000303895976 855274381 /nfs/dbraw/zinc/27/43/81/855274381.db2.gz KTAAUXWKGJFPEL-FQEVSTJZSA-N 0 3 408.933 4.359 20 0 HIADHN CC(C)CNC(=O)c1ccc(NC(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)cc1 ZINC000303934874 855301689 /nfs/dbraw/zinc/30/16/89/855301689.db2.gz WFGOEMKNTUJFFL-FQEVSTJZSA-N 0 3 422.573 4.201 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N3CC[C@@H](c4ccccc4)[C@@H](C)C3)cc2)CC1 ZINC000303967074 855327799 /nfs/dbraw/zinc/32/77/99/855327799.db2.gz DEXFGBLXNZFPTB-SQJMNOBHSA-N 0 3 405.586 4.483 20 0 HIADHN CCCOc1ccc(Br)cc1CNC[C@@H](C)NC(=O)OC(C)(C)C ZINC000310056126 855365363 /nfs/dbraw/zinc/36/53/63/855365363.db2.gz JPYXOIHMJSXITF-CYBMUJFWSA-N 0 3 401.345 4.241 20 0 HIADHN COc1ccc(CN[C@@H]2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)c(Br)c1 ZINC000310950883 855369088 /nfs/dbraw/zinc/36/90/88/855369088.db2.gz RCBFMAPMZNOMCF-DZGCQCFKSA-N 0 3 413.356 4.335 20 0 HIADHN COc1ccc(CN[C@H]2CCN(C(=O)OC(C)(C)C)[C@H](C)C2)c(Br)c1 ZINC000310950887 855369321 /nfs/dbraw/zinc/36/93/21/855369321.db2.gz RCBFMAPMZNOMCF-HIFRSBDPSA-N 0 3 413.356 4.335 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCN(C(=O)c2ccc(Br)c(F)c2)C1 ZINC000323775871 855396629 /nfs/dbraw/zinc/39/66/29/855396629.db2.gz BOEVHWVVVCECKU-HNNXBMFYSA-N 0 3 405.311 4.182 20 0 HIADHN COc1cc(Br)ccc1C(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1 ZINC000383022522 855434896 /nfs/dbraw/zinc/43/48/96/855434896.db2.gz SABPXRXNZNGZRN-INIZCTEOSA-N 0 3 417.347 4.194 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)c2cc(Cl)ccc2Br)CCN1Cc1ccccc1 ZINC000383542406 855438562 /nfs/dbraw/zinc/43/85/62/855438562.db2.gz URLDEZQFNWFRKR-ACJLOTCBSA-N 0 3 407.739 4.495 20 0 HIADHN C[C@H](C[C@@H]1COCCN1C(=O)OC(C)(C)C)NCc1ccsc1Br ZINC000388551053 855447705 /nfs/dbraw/zinc/44/77/05/855447705.db2.gz PAKDLDUZOAANDF-TZMCWYRMSA-N 0 3 419.385 4.015 20 0 HIADHN CN(C(=O)c1cc(F)ccc1Br)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000388806155 855449220 /nfs/dbraw/zinc/44/92/20/855449220.db2.gz KCOUSZSDGYHUOB-QGZVFWFLSA-N 0 3 405.311 4.325 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1cccc(Br)c1Cl ZINC000389851800 855452575 /nfs/dbraw/zinc/45/25/75/855452575.db2.gz WBFWFTMOHBJIQY-GUYCJALGSA-N 0 3 407.739 4.353 20 0 HIADHN COc1cc(Br)c(CNC[C@@H](C)COCc2ccccc2)cc1OC ZINC000389918349 855452720 /nfs/dbraw/zinc/45/27/20/855452720.db2.gz OKUDRFJOENCEQI-OAHLLOKOSA-N 0 3 408.336 4.409 20 0 HIADHN O=C(NC[C@H]1CCCN1Cc1ccccc1)c1c(F)cc(Br)cc1F ZINC000390803693 855457195 /nfs/dbraw/zinc/45/71/95/855457195.db2.gz UYYRYXWSXBLPAH-OAHLLOKOSA-N 0 3 409.274 4.122 20 0 HIADHN C[C@@H]1C[C@@H](NCc2cccc(F)c2Br)CCN1C(=O)OC(C)(C)C ZINC000394620405 855470976 /nfs/dbraw/zinc/47/09/76/855470976.db2.gz XIMHTQQEQLHKSV-OCCSQVGLSA-N 0 3 401.320 4.466 20 0 HIADHN CSc1nccn1-c1ccc(C(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)cc1 ZINC000409569714 855545117 /nfs/dbraw/zinc/54/51/17/855545117.db2.gz IUXYKRFFQZDFGW-YLJYHZDGSA-N 0 3 406.555 4.160 20 0 HIADHN C[C@H](NC(=O)Nc1cccc(CN(C)C)c1)[C@@H](OC1CCOCC1)c1ccccc1 ZINC000437383168 862694944 /nfs/dbraw/zinc/69/49/44/862694944.db2.gz GLSCKNCXPVRDMG-FDDCHVKYSA-N 0 3 411.546 4.195 20 0 HIADHN C[C@@H](C(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1)c1ccc(C(F)(F)F)cc1 ZINC000409646729 855581338 /nfs/dbraw/zinc/58/13/38/855581338.db2.gz FLFALLGRYRJBMV-BRWVUGGUSA-N 0 3 412.496 4.157 20 0 HIADHN CN1CCN(Cc2ccc(CNC(=O)Nc3ccc(Cl)cc3Cl)cc2)CC1 ZINC000409684413 855600835 /nfs/dbraw/zinc/60/08/35/855600835.db2.gz FSXUYMPAZSOHGG-UHFFFAOYSA-N 0 3 407.345 4.063 20 0 HIADHN O=C(NCCCCN1CCN(Cc2ccccc2)CC1)Nc1ccc(F)cc1Cl ZINC000409694368 855605044 /nfs/dbraw/zinc/60/50/44/855605044.db2.gz BUNBIGSAYQUFTC-UHFFFAOYSA-N 0 3 418.944 4.199 20 0 HIADHN Cc1ccc(C[C@@H](NC(=O)N2CCN(C3CCCCC3)CC2)c2ccccn2)cc1 ZINC000409740657 855629626 /nfs/dbraw/zinc/62/96/26/855629626.db2.gz NFUURNDWNVOOCN-XMMPIXPASA-N 0 3 406.574 4.334 20 0 HIADHN C[C@H]1C[C@H](NC(=O)[C@@H]2CCO[C@H]2c2ccc(Cl)c(F)c2)CN1Cc1ccccc1 ZINC000409814199 855668035 /nfs/dbraw/zinc/66/80/35/855668035.db2.gz SQQNNMROVPBLJD-XCRNZQRYSA-N 0 3 416.924 4.336 20 0 HIADHN CC[C@@H](NCC(=O)N[C@H]1CCOc2ccccc21)c1ccc(Br)cc1 ZINC000409862329 855693236 /nfs/dbraw/zinc/69/32/36/855693236.db2.gz ZJVXHKUZFHVKJO-MSOLQXFVSA-N 0 3 403.320 4.130 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N(C)Cc3ccc(F)cc3Cl)cc2)CC1 ZINC000409966518 855750192 /nfs/dbraw/zinc/75/01/92/855750192.db2.gz VRRBABXVYDUYJO-UHFFFAOYSA-N 0 3 403.929 4.282 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)[C@H]1CCCC(F)(F)C1 ZINC000410092865 855815349 /nfs/dbraw/zinc/81/53/49/855815349.db2.gz CZVQBVAFWKMOIK-RBUKOAKNSA-N 0 3 402.489 4.403 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)NCC3CCC(F)(F)CC3)CC2)c1 ZINC000410094052 855816282 /nfs/dbraw/zinc/81/62/82/855816282.db2.gz HBEVTRBCTPZBFN-UHFFFAOYSA-N 0 3 422.564 4.022 20 0 HIADHN C[C@H](NCc1ccc(S(=O)(=O)N2CCCC2)cc1)c1cccc(Br)c1 ZINC000410226199 855870074 /nfs/dbraw/zinc/87/00/74/855870074.db2.gz XWDPJBIVJCAGSR-HNNXBMFYSA-N 0 3 423.376 4.084 20 0 HIADHN CN1CCN(Cc2ccc(CNC(=O)N[C@@H](c3ccccc3)C(C)(C)C)cc2)CC1 ZINC000410351658 855943736 /nfs/dbraw/zinc/94/37/36/855943736.db2.gz MIRPDLMDHHZOIQ-QHCPKHFHSA-N 0 3 408.590 4.021 20 0 HIADHN CS(=O)(=O)Cc1cccc(CN[C@@H](Cc2cccnc2)c2cccc(Cl)c2)c1 ZINC000425932379 856006520 /nfs/dbraw/zinc/00/65/20/856006520.db2.gz PWFOFAWBVJPUTO-QFIPXVFZSA-N 0 3 414.958 4.353 20 0 HIADHN COCC1(CN[C@@H](c2ccc3c(c2)OCCO3)c2ccccc2Cl)CCOCC1 ZINC000425952027 856014901 /nfs/dbraw/zinc/01/49/01/856014901.db2.gz RNILSIHWPMCHFM-QFIPXVFZSA-N 0 3 417.933 4.233 20 0 HIADHN CN1CC[C@@H](NC(=O)NCc2nc(-c3ccccc3F)cs2)[C@H]1c1ccccc1 ZINC000425985544 856031880 /nfs/dbraw/zinc/03/18/80/856031880.db2.gz RINOLBAECMUTRC-WIYYLYMNSA-N 0 3 410.518 4.194 20 0 HIADHN C[C@H](NC(=O)N[C@H]1C[C@@H](C)N(Cc2ccccc2)C1)c1nc(C(F)(F)F)cs1 ZINC000426053202 856075197 /nfs/dbraw/zinc/07/51/97/856075197.db2.gz AWUJJYCHEVGUEQ-IPYPFGDCSA-N 0 3 412.481 4.185 20 0 HIADHN Cc1cccc2[nH]c(CCC(=O)NC[C@H](c3cccs3)N3CCC(C)CC3)nc21 ZINC000426053323 856075309 /nfs/dbraw/zinc/07/53/09/856075309.db2.gz BSIIRTUGRKAZJB-LJQANCHMSA-N 0 3 410.587 4.455 20 0 HIADHN COc1ccc(NC(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)c2cccnc12 ZINC000426105631 856111608 /nfs/dbraw/zinc/11/16/08/856111608.db2.gz VZRMPLBKVIZROB-UHFFFAOYSA-N 0 3 414.456 4.117 20 0 HIADHN O=C(Nc1cccc(-c2cccs2)c1)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1CO ZINC000426109020 856112613 /nfs/dbraw/zinc/11/26/13/856112613.db2.gz AXNHOGQNFKSMEM-IRLDBZIGSA-N 0 3 421.566 4.420 20 0 HIADHN C[C@@H]1CN(C2CCOCC2)CCN1C(=O)N[C@H]1C[C@H]2CCC(C)(C)c3cccc1c32 ZINC000426217214 856182877 /nfs/dbraw/zinc/18/28/77/856182877.db2.gz XMMOQMIOJROZQB-HMFYCAOWSA-N 0 3 411.590 4.181 20 0 HIADHN CN(C)[C@@H](CNC(=O)N1CCC[C@@H](c2nc3c(s2)CCCC3)C1)c1ccccc1 ZINC000426232922 856191454 /nfs/dbraw/zinc/19/14/54/856191454.db2.gz PFFGNTGTJFJCTN-QUCCMNQESA-N 0 3 412.603 4.214 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)NC12CCC(C(F)(F)F)(CC1)CC2 ZINC000426246896 856200011 /nfs/dbraw/zinc/20/00/11/856200011.db2.gz WTWZJXNVMWDEOG-SPNPKDGLSA-N 0 3 409.496 4.461 20 0 HIADHN CCc1ccc(Cl)c(CC)c1NC(=O)CCCN1CCC(O)(C(F)F)CC1 ZINC000426262238 856208275 /nfs/dbraw/zinc/20/82/75/856208275.db2.gz DFPKXPTWNDGIGP-UHFFFAOYSA-N 0 3 402.913 4.276 20 0 HIADHN CN(C)[C@@H]1Cc2ccccc2N(C(=O)c2cc3ccccc3n2CC(F)(F)F)C1 ZINC000426325024 856246901 /nfs/dbraw/zinc/24/69/01/856246901.db2.gz TVQMTVLMHWSGTF-QGZVFWFLSA-N 0 3 401.432 4.337 20 0 HIADHN CN(CCN(Cc1ccccc1)C(=O)N[C@@H]1CCOC2(CCC2)C1)Cc1ccccc1 ZINC000426622736 856378814 /nfs/dbraw/zinc/37/88/14/856378814.db2.gz JFBDLHAPZAAMGI-XMMPIXPASA-N 0 3 421.585 4.432 20 0 HIADHN O=C(CC1(N2CCOCC2)CCCC1)N[C@H]1C[C@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000437420304 862793155 /nfs/dbraw/zinc/79/31/55/862793155.db2.gz RHSAENIYDIMZHZ-UAPYVXQJSA-N 0 3 410.480 4.103 20 0 HIADHN CN1CCC(N(Cc2ccccc2Br)C(=O)c2cc[nH]c2C2CC2)CC1 ZINC000426800180 856485488 /nfs/dbraw/zinc/48/54/88/856485488.db2.gz NKZPRQWCAARJTE-UHFFFAOYSA-N 0 3 416.363 4.391 20 0 HIADHN Cc1cc(CN(C)[C@H](C)c2cccc(N3CCCS3(=O)=O)c2)c2ccccc2n1 ZINC000426800144 856485846 /nfs/dbraw/zinc/48/58/46/856485846.db2.gz MYECAFDSMCZOTH-GOSISDBHSA-N 0 3 409.555 4.276 20 0 HIADHN Cc1ccc(-c2c[nH]cc2C(=O)Nc2ccc(C(=O)NCCN3CCCC3)cc2)s1 ZINC000426814101 856493574 /nfs/dbraw/zinc/49/35/74/856493574.db2.gz CJLFIHUZHBELCK-UHFFFAOYSA-N 0 3 422.554 4.130 20 0 HIADHN C[C@H](NC(=O)N(CCN(C)C)Cc1ccc(F)cc1)c1nc(C(F)(F)F)cs1 ZINC000426902125 856534638 /nfs/dbraw/zinc/53/46/38/856534638.db2.gz BDXYFFCQZXDQKO-LBPRGKRZSA-N 0 3 418.460 4.135 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)NCc2nc(-c3ccccc3F)cs2)o1 ZINC000426904210 856535662 /nfs/dbraw/zinc/53/56/62/856535662.db2.gz XNYRHJNBYBPRNL-UHFFFAOYSA-N 0 3 416.522 4.124 20 0 HIADHN Cn1cc(-c2c[nH]cc2C(=O)N2CCN(Cc3ccccc3)C3(CCCCC3)C2)cn1 ZINC000427222089 856721528 /nfs/dbraw/zinc/72/15/28/856721528.db2.gz FXGDOXWJPWUMGZ-UHFFFAOYSA-N 0 3 417.557 4.076 20 0 HIADHN O=C(N[C@H]1CCOC2(CCCCC2)C1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000427266809 856744414 /nfs/dbraw/zinc/74/44/14/856744414.db2.gz VGHUXUHDHRLMGB-SIKLNZKXSA-N 0 3 424.507 4.439 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)Cc3ccc(Cl)c(Cl)c3)CC2)C[C@H](C)O1 ZINC000427285949 856751378 /nfs/dbraw/zinc/75/13/78/856751378.db2.gz BAYWFWQWZWCOHA-HOTGVXAUSA-N 0 3 413.389 4.274 20 0 HIADHN Cc1ccc(C)c(C(=O)CCC(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)c1 ZINC000427292068 856754884 /nfs/dbraw/zinc/75/48/84/856754884.db2.gz MOVVLGKIVFHRJU-OYRHEFFESA-N 0 3 414.590 4.004 20 0 HIADHN CC(C)c1cc(C(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)nn1C(C)(C)C ZINC000427291886 856755262 /nfs/dbraw/zinc/75/52/62/856755262.db2.gz KYKZZMLUNPBLTM-KDURUIRLSA-N 0 3 418.626 4.113 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3c4c(nc5ccccc53)CCC4)CC2)C[C@@H](C)O1 ZINC000427298557 856758187 /nfs/dbraw/zinc/75/81/87/856758187.db2.gz DGXGFBWWCMSRNF-RTBURBONSA-N 0 3 421.585 4.075 20 0 HIADHN Cc1cc(Br)ccc1C(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000427297756 856758321 /nfs/dbraw/zinc/75/83/21/856758321.db2.gz WPNSMJQWZGFFEV-CALCHBBNSA-N 0 3 423.395 4.109 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)c3ccc(F)c(C(F)(F)F)c3)CC2)C[C@H](C)O1 ZINC000427301480 856759814 /nfs/dbraw/zinc/75/98/14/856759814.db2.gz XUTXLTMKGFRZCQ-GJZGRUSLSA-N 0 3 416.459 4.196 20 0 HIADHN Cc1c(C(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)sc2nccc(C)c12 ZINC000427304273 856761150 /nfs/dbraw/zinc/76/11/50/856761150.db2.gz ISZQPDZDQYMJEN-IRXDYDNUSA-N 0 3 415.603 4.265 20 0 HIADHN C[C@H]1CCN(C(=O)c2cn(C)nc2-c2ccccc2Cl)CCN1Cc1ccccc1 ZINC000437471185 862833410 /nfs/dbraw/zinc/83/34/10/862833410.db2.gz JDGVTFZTNPPTFG-SFHVURJKSA-N 0 3 422.960 4.477 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3cc(-c4ccccc4)ns3)CC2)C[C@H](C)O1 ZINC000427319791 856767948 /nfs/dbraw/zinc/76/79/48/856767948.db2.gz JOGAJUAAOIRIDZ-HDICACEKSA-N 0 3 413.587 4.162 20 0 HIADHN Cc1cc(C(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)c(C)n1-c1nccs1 ZINC000437472579 862834076 /nfs/dbraw/zinc/83/40/76/862834076.db2.gz MWJQBWIEJMYXRP-KRWDZBQOSA-N 0 3 408.571 4.287 20 0 HIADHN C[C@H]1C[C@H]1c1ccc([C@H]2C[C@H]2C(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)o1 ZINC000427319998 856768846 /nfs/dbraw/zinc/76/88/46/856768846.db2.gz JCZRMBNVMRZCAV-DJNRTHQISA-N 0 3 414.590 4.244 20 0 HIADHN COc1ccc(CCCCC(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)cc1 ZINC000427323258 856771851 /nfs/dbraw/zinc/77/18/51/856771851.db2.gz WXJDHLYREIGTMI-SFTDATJTSA-N 0 3 416.606 4.146 20 0 HIADHN CC(C)[C@H](Cc1ccccc1)C(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000427342096 856782279 /nfs/dbraw/zinc/78/22/79/856782279.db2.gz LBHWCFPJGQAEJL-IMSXRSKXSA-N 0 3 400.607 4.239 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)c1cnc(Cc2ccccc2)s1 ZINC000427378282 856800950 /nfs/dbraw/zinc/80/09/50/856800950.db2.gz WDHVHROPCYNVDS-UHFFFAOYSA-N 0 3 415.509 4.216 20 0 HIADHN CCN1CCC[C@@H](CN(C)C(=O)c2c[nH]cc2-c2ccccc2F)[C@@H]1c1cnn(C)c1 ZINC000427491285 856840406 /nfs/dbraw/zinc/84/04/06/856840406.db2.gz UPGFFIOOHLTNJJ-GAJHUEQPSA-N 0 3 423.536 4.100 20 0 HIADHN Cc1ccc([C@H]2C[C@@H](C)CCN2C(=O)CCCN2CCN(c3ccccc3)CC2)o1 ZINC000437484037 862842220 /nfs/dbraw/zinc/84/22/20/862842220.db2.gz NPIIPFVZARMFSK-NZQKXSOJSA-N 0 3 409.574 4.490 20 0 HIADHN CCC(CC)C(=O)N1CCC(N[C@H](C)c2ncc(Br)cc2F)CC1 ZINC000427603113 856885313 /nfs/dbraw/zinc/88/53/13/856885313.db2.gz STTBDDAHYVRIGI-GFCCVEGCSA-N 0 3 400.336 4.061 20 0 HIADHN CCC(CC)C(=O)N1CCC(N[C@@H](C)c2ncc(Br)cc2F)CC1 ZINC000427603114 856885324 /nfs/dbraw/zinc/88/53/24/856885324.db2.gz STTBDDAHYVRIGI-LBPRGKRZSA-N 0 3 400.336 4.061 20 0 HIADHN O=C(Nc1c2c(cc3c1CCC3)CCC2)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000427648076 856896991 /nfs/dbraw/zinc/89/69/91/856896991.db2.gz YCFFATKJCYMBQN-UHFFFAOYSA-N 0 3 404.554 4.121 20 0 HIADHN COc1cccc(N2CC[C@@H](CN[C@H](C)c3ncc(Br)cc3F)C2)c1 ZINC000427694060 856911714 /nfs/dbraw/zinc/91/17/14/856911714.db2.gz IHIOMGNHQLDLCN-KGLIPLIRSA-N 0 3 408.315 4.169 20 0 HIADHN O=C(CCc1ccccc1)N1CC[C@@H](N[C@@H]2CCCc3ncc(C(F)(F)F)cc32)C1 ZINC000427698465 856913667 /nfs/dbraw/zinc/91/36/67/856913667.db2.gz TVUSUGABDANGOU-WIYYLYMNSA-N 0 3 417.475 4.301 20 0 HIADHN O=C1C[C@H](N[C@@H]2CCCc3ncc(C(F)(F)F)cc32)CN1[C@H]1C[C@H]1c1ccccc1 ZINC000427711167 856919344 /nfs/dbraw/zinc/91/93/44/856919344.db2.gz RSFLJLJUBAOZJS-PZBISTMVSA-N 0 3 415.459 4.224 20 0 HIADHN C[C@H](CS(=O)(=O)N(C)[C@@H]1CCN(Cc2ccccc2)[C@@H](C)C1)c1ccccc1 ZINC000427847606 856980295 /nfs/dbraw/zinc/98/02/95/856980295.db2.gz AMPSPOLDHMHRSC-ZRCGQRJVSA-N 0 3 400.588 4.105 20 0 HIADHN C[C@H](N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1=O)[C@H]1OCCc2sccc21 ZINC000427866869 856986937 /nfs/dbraw/zinc/98/69/37/856986937.db2.gz SUQNNQZSVJFOBG-BOFPYLFWSA-N 0 3 422.497 4.137 20 0 HIADHN CCOC(=O)C1CCN(C(=O)C[C@H](C)N[C@H](C)c2cc(Cl)ccc2Cl)CC1 ZINC000427871319 856989256 /nfs/dbraw/zinc/98/92/56/856989256.db2.gz AHOVPKQFIJLGCT-UONOGXRCSA-N 0 3 415.361 4.224 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1sc([C@@H]2CCCOC2)nc1C)c1ccsc1 ZINC000428179700 857099286 /nfs/dbraw/zinc/09/92/86/857099286.db2.gz YUWAWKFXZQQQPB-WBVHZDCISA-N 0 3 407.605 4.220 20 0 HIADHN O=C(CCN1CCS[C@H]2CCCC[C@@H]21)Nc1ccc(Br)cc1F ZINC000437541436 862875200 /nfs/dbraw/zinc/87/52/00/862875200.db2.gz XATCOCATOWGGGO-HOTGVXAUSA-N 0 3 401.345 4.277 20 0 HIADHN Cc1nc(-c2cccs2)ccc1C(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000428445525 857206087 /nfs/dbraw/zinc/20/60/87/857206087.db2.gz ZGJPLNPFKUFVKS-HXUWFJFHSA-N 0 3 421.566 4.139 20 0 HIADHN C[C@H](c1cccc(N2CCCS2(=O)=O)c1)N(C)Cc1ccc(OCC(F)F)cc1 ZINC000428473064 857214445 /nfs/dbraw/zinc/21/44/45/857214445.db2.gz DAWJNEWTVNANSL-MRXNPFEDSA-N 0 3 424.513 4.063 20 0 HIADHN COc1ccc2nc(CNC[C@@H](CO)Cc3cccc(Br)c3)sc2c1 ZINC000428532134 857245295 /nfs/dbraw/zinc/24/52/95/857245295.db2.gz GTAYWYZSSPTZMF-AWEZNQCLSA-N 0 3 421.360 4.008 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@@H](O)C2)c1)c1ccc2nc(-c3ccccc3)oc2c1 ZINC000428532551 857245746 /nfs/dbraw/zinc/24/57/46/857245746.db2.gz BXKGGWLWBHNDQD-OAQYLSRUSA-N 0 3 413.477 4.314 20 0 HIADHN CCOc1cccc2[nH]cc(CC(=O)Nc3ccc(N4CCN(CC)CC4)cc3C)c21 ZINC000437567296 862889994 /nfs/dbraw/zinc/88/99/94/862889994.db2.gz IEYMUUOPWMDHSE-UHFFFAOYSA-N 0 3 420.557 4.198 20 0 HIADHN CCCCOc1ccc(C(=O)Nc2cccc(CN3CC[C@@H](O)C3)c2)cc1OCC ZINC000428547528 857257635 /nfs/dbraw/zinc/25/76/35/857257635.db2.gz PGOYBASTUFANPJ-OAQYLSRUSA-N 0 3 412.530 4.083 20 0 HIADHN CCCn1c2ccccc2nc1CNC[C@@H](CO)Cc1ccccc1Br ZINC000428550007 857259477 /nfs/dbraw/zinc/25/94/77/857259477.db2.gz QTFOLKOTGOWROO-INIZCTEOSA-N 0 3 416.363 4.150 20 0 HIADHN COCCS(=O)(=O)c1ccc(CNCc2cc(-c3ccccc3)cs2)cc1 ZINC000428551262 857260526 /nfs/dbraw/zinc/26/05/26/857260526.db2.gz KFTUFDVJMVILKR-UHFFFAOYSA-N 0 3 401.553 4.125 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)c1cccc(-c2c(F)cccc2F)c1 ZINC000428555111 857263934 /nfs/dbraw/zinc/26/39/34/857263934.db2.gz WWIZEOGMNPKQKH-FQEVSTJZSA-N 0 3 408.448 4.451 20 0 HIADHN CSc1cccc(N(C(=O)c2ccnc(N3CC[C@H](C)C3)c2)C2CCN(C)CC2)c1 ZINC000437568899 862890837 /nfs/dbraw/zinc/89/08/37/862890837.db2.gz PDSIKOBCLCVSFT-SFHVURJKSA-N 0 3 424.614 4.391 20 0 HIADHN COc1ccc(CNC[C@H]2CSCCN2Cc2ccccc2)c(Cl)c1OC ZINC000428557065 857264923 /nfs/dbraw/zinc/26/49/23/857264923.db2.gz HUTPOZISYICALS-SFHVURJKSA-N 0 3 406.979 4.064 20 0 HIADHN COc1ccc(CNC[C@@H]2CSCCN2Cc2ccccc2)c(Cl)c1OC ZINC000428557064 857265429 /nfs/dbraw/zinc/26/54/29/857265429.db2.gz HUTPOZISYICALS-GOSISDBHSA-N 0 3 406.979 4.064 20 0 HIADHN COc1ccc(CNC[C@]2(Cc3ccc(F)cc3)CCC[C@H]2O)c(Cl)c1OC ZINC000428574218 857269898 /nfs/dbraw/zinc/26/98/98/857269898.db2.gz QZGBWOOOXCYERE-DENIHFKCSA-N 0 3 407.913 4.360 20 0 HIADHN COc1cc(CNC2CC(F)(F)C2)ccc1OCC(=O)Nc1ccccc1Cl ZINC000428636606 857284600 /nfs/dbraw/zinc/28/46/00/857284600.db2.gz AXSNTAIYLNYIFZ-UHFFFAOYSA-N 0 3 410.848 4.253 20 0 HIADHN OC[C@@H](CC(F)F)NCc1ccc(OCc2ccccc2)c(Br)c1 ZINC000428649475 857288888 /nfs/dbraw/zinc/28/88/88/857288888.db2.gz MQHIWRSGONSMDZ-OAHLLOKOSA-N 0 3 400.263 4.134 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)N1CCC(c2ncccc2Cl)CC1 ZINC000428686390 857297682 /nfs/dbraw/zinc/29/76/82/857297682.db2.gz ZXVOMMHFKXXPMP-OAQYLSRUSA-N 0 3 412.965 4.461 20 0 HIADHN O=S1(=O)CCC2(CCN(CC/C=C\c3ccc(Br)cc3)CC2)CC1 ZINC000428700180 857301432 /nfs/dbraw/zinc/30/14/32/857301432.db2.gz KTKLNOMLQVDGJT-IWQZZHSRSA-N 0 3 412.393 4.143 20 0 HIADHN CCN1CCCN(C(=O)NCCCCSc2ccccc2Br)CC1 ZINC000428702290 857302468 /nfs/dbraw/zinc/30/24/68/857302468.db2.gz VAYZTXKKQQQAAG-UHFFFAOYSA-N 0 3 414.413 4.059 20 0 HIADHN CN(Cc1c[nH]nc1-c1ccsc1)C[C@@H](O)COc1ccc(C(F)(F)F)cc1 ZINC000437580946 862897043 /nfs/dbraw/zinc/89/70/43/862897043.db2.gz RHKYIPYNRUODJM-MRXNPFEDSA-N 0 3 411.449 4.029 20 0 HIADHN CCC(C)(C)OCc1cccc(NC(=O)N2CCN(CC3CCOCC3)CC2)c1C ZINC000428783374 857336531 /nfs/dbraw/zinc/33/65/31/857336531.db2.gz RHZMFIRDDZCJEN-UHFFFAOYSA-N 0 3 417.594 4.276 20 0 HIADHN CCCc1nc(CN(Cc2ccncc2)[C@H]2CCCN(Cc3ccccc3)C2)no1 ZINC000428788751 857339910 /nfs/dbraw/zinc/33/99/10/857339910.db2.gz MXDMXINRTWSUCJ-QFIPXVFZSA-N 0 3 405.546 4.084 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)NCC(C)(C)c3ccccc3F)CC2)C[C@H](C)O1 ZINC000428834803 857365122 /nfs/dbraw/zinc/36/51/22/857365122.db2.gz VWZBTQJRICWWAN-KDURUIRLSA-N 0 3 419.585 4.024 20 0 HIADHN OC[C@@H](CNCc1nc2ccc(F)cc2s1)Cc1cccc(OC(F)(F)F)c1 ZINC000428869815 857380116 /nfs/dbraw/zinc/38/01/16/857380116.db2.gz FCIQZKXBORLUFC-CYBMUJFWSA-N 0 3 414.424 4.275 20 0 HIADHN COCc1csc(NC(=O)N(CCN(C)Cc2ccccc2)Cc2ccccc2)n1 ZINC000428877158 857383523 /nfs/dbraw/zinc/38/35/23/857383523.db2.gz SPSLMJZDBPSFER-UHFFFAOYSA-N 0 3 424.570 4.456 20 0 HIADHN OC[C@@H](NCCOc1ccc(F)cc1Cl)c1ccc(Br)c(F)c1 ZINC000428994543 857448116 /nfs/dbraw/zinc/44/81/16/857448116.db2.gz NEAWDTFCVXOHOV-OAHLLOKOSA-N 0 3 406.654 4.083 20 0 HIADHN C[C@H](c1cccc(Cl)c1)N(C)C(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000429008772 857454638 /nfs/dbraw/zinc/45/46/38/857454638.db2.gz MVCDEECCULTZOW-XMSQKQJNSA-N 0 3 415.965 4.334 20 0 HIADHN CCN(C(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1)[C@H](C)c1ccc(F)cc1 ZINC000429039845 857470578 /nfs/dbraw/zinc/47/05/78/857470578.db2.gz GCKPOEBJMRBULO-XXBNENTESA-N 0 3 413.537 4.209 20 0 HIADHN CCCOc1ccc(NC(=O)NC[C@@H]2CN(Cc3ccccc3)CCCO2)c(C)c1 ZINC000429044137 857472950 /nfs/dbraw/zinc/47/29/50/857472950.db2.gz QFXPTJUNSYJTSU-JOCHJYFZSA-N 0 3 411.546 4.196 20 0 HIADHN CC[C@H]1c2ccsc2CCN1C(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000429053338 857480458 /nfs/dbraw/zinc/48/04/58/857480458.db2.gz MROMPOAOCAQEQS-CTNGQTDRSA-N 0 3 413.587 4.058 20 0 HIADHN CC1CCN([C@@H](CNC(=O)NCc2ccn(C3CCCC3)n2)c2cccs2)CC1 ZINC000429069493 857491995 /nfs/dbraw/zinc/49/19/95/857491995.db2.gz JKPUCHHPDLFTKV-FQEVSTJZSA-N 0 3 415.607 4.332 20 0 HIADHN COc1ccc(C2=NN(C(=O)CN(C3CCC3)C3CCC3)[C@H](c3ccco3)C2)cc1 ZINC000429170865 857539654 /nfs/dbraw/zinc/53/96/54/857539654.db2.gz MAGJUTDSGMXNCS-QFIPXVFZSA-N 0 3 407.514 4.373 20 0 HIADHN CC(C)[C@@H](NC(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1)c1ccccc1 ZINC000429172965 857540218 /nfs/dbraw/zinc/54/02/18/857540218.db2.gz SWNSRVFUMRIMGR-TXTKFYIRSA-N 0 3 401.595 4.305 20 0 HIADHN COc1ccc(NC(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)cc1Cl ZINC000429209329 857556624 /nfs/dbraw/zinc/55/66/24/857556624.db2.gz OPANIFXZULGMGL-HZPDHXFCSA-N 0 3 409.958 4.092 20 0 HIADHN CC(=O)Nc1cccc(CN[C@H](Cc2ccc(F)cc2)[C@H]2COc3ccccc3O2)c1 ZINC000429244418 857570406 /nfs/dbraw/zinc/57/04/06/857570406.db2.gz GFLYPWYKAGWHDB-RCZVLFRGSA-N 0 3 420.484 4.325 20 0 HIADHN CC(=O)Nc1cccc(CN[C@H](Cc2ccc(F)cc2)[C@@H]2COc3ccccc3O2)c1 ZINC000429244419 857571574 /nfs/dbraw/zinc/57/15/74/857571574.db2.gz GFLYPWYKAGWHDB-RDGATRHJSA-N 0 3 420.484 4.325 20 0 HIADHN CC(=O)Nc1cccc(CN[C@@H](Cc2ccc(F)cc2)[C@H]2COc3ccccc3O2)c1 ZINC000429244420 857571840 /nfs/dbraw/zinc/57/18/40/857571840.db2.gz GFLYPWYKAGWHDB-WIOPSUGQSA-N 0 3 420.484 4.325 20 0 HIADHN C[C@H](N[C@@H]1Cc2cccc(O)c2C1)C(=O)Nc1ccc(OCc2ccccc2)cc1 ZINC000429313485 857599915 /nfs/dbraw/zinc/59/99/15/857599915.db2.gz GOEGUXVQXWHDOK-LAUBAEHRSA-N 0 3 402.494 4.055 20 0 HIADHN Cc1nn(C)c(C)c1NC(=O)[C@@H](C)N[C@@H]1c2cccc(Br)c2CC1(C)C ZINC000429407326 857649661 /nfs/dbraw/zinc/64/96/61/857649661.db2.gz LHBKEWPDORQVRC-KZULUSFZSA-N 0 3 419.367 4.040 20 0 HIADHN CC(C)n1nccc1NC(=O)[C@@H](C)N[C@H]1c2cccc(Br)c2CC1(C)C ZINC000429412304 857651992 /nfs/dbraw/zinc/65/19/92/857651992.db2.gz ZREYCKMJVIIAPC-ACJLOTCBSA-N 0 3 419.367 4.467 20 0 HIADHN CC[C@@H](NC(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1)c1ccc(F)cc1F ZINC000429486146 857690988 /nfs/dbraw/zinc/69/09/88/857690988.db2.gz DTNNTZKEMGFERU-HYFFOGBASA-N 0 3 423.548 4.337 20 0 HIADHN Cc1ncsc1CN(C)C(=O)N[C@@H](CN1CCc2ccccc2C1)C(C)(C)C ZINC000429491924 857694904 /nfs/dbraw/zinc/69/49/04/857694904.db2.gz LVFRWIKUESFMTO-FQEVSTJZSA-N 0 3 400.592 4.066 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)NCC(C)(C)c3cccc(F)c3)CC2)C[C@@H](C)O1 ZINC000429497051 857698380 /nfs/dbraw/zinc/69/83/80/857698380.db2.gz XBLWCWNOCGYUSG-RTBURBONSA-N 0 3 419.585 4.024 20 0 HIADHN Cc1cccnc1[C@H](NC(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1)C(C)C ZINC000429499422 857699429 /nfs/dbraw/zinc/69/94/29/857699429.db2.gz UDVXJTGNLROJNA-RZUBCFFCSA-N 0 3 416.610 4.008 20 0 HIADHN Cc1noc(C[C@@H](NCCOc2ccccc2Br)c2ccccc2)n1 ZINC000429534934 857727700 /nfs/dbraw/zinc/72/77/00/857727700.db2.gz AILAFJFUERFMOO-QGZVFWFLSA-N 0 3 402.292 4.093 20 0 HIADHN Cc1noc(C[C@H](NCC[S@@](=O)c2cc(Cl)ccc2Cl)c2ccccc2)n1 ZINC000429547457 857738482 /nfs/dbraw/zinc/73/84/82/857738482.db2.gz JMKUXYQANLUJDD-CBZJRKILSA-N 0 3 424.353 4.366 20 0 HIADHN C[C@@H]1CCN(C(=O)Nc2cc3c(cc2Cl)OCCO3)CCN1Cc1ccccc1 ZINC000437627011 862948166 /nfs/dbraw/zinc/94/81/66/862948166.db2.gz GYKBKBDCQYDUAN-MRXNPFEDSA-N 0 3 415.921 4.240 20 0 HIADHN CCCc1c(NC(=O)N(CCN(C)C)Cc2ccco2)cnn1-c1ccc(F)cc1 ZINC000429606570 857788919 /nfs/dbraw/zinc/78/89/19/857788919.db2.gz BWBLJCOFRNMBFR-UHFFFAOYSA-N 0 3 413.497 4.153 20 0 HIADHN C[C@H](C1CC1)n1cc(NC(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)cn1 ZINC000429637583 857812566 /nfs/dbraw/zinc/81/25/66/857812566.db2.gz SHTDOGZYBUSDMO-OAHLLOKOSA-N 0 3 423.483 4.469 20 0 HIADHN Cc1cnc(-c2cccc(NC(=O)NC[C@H]3CN(Cc4ccccc4)CCCO3)c2)o1 ZINC000429737317 857859611 /nfs/dbraw/zinc/85/96/11/857859611.db2.gz LBQNDTAOKDPUGP-QFIPXVFZSA-N 0 3 420.513 4.063 20 0 HIADHN CC(C)Oc1ccc(F)cc1NC(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000429742642 857864068 /nfs/dbraw/zinc/86/40/68/857864068.db2.gz KURMFXUCSLSMGH-HXUWFJFHSA-N 0 3 415.509 4.026 20 0 HIADHN COC(=O)c1c(CN[C@H]2CCC[C@H]2CCO)nc2ccccc2c1-c1ccccc1 ZINC000429775467 857880635 /nfs/dbraw/zinc/88/06/35/857880635.db2.gz PHWUSQDMASQAOB-PXNSSMCTSA-N 0 3 404.510 4.329 20 0 HIADHN O=C(NC1CC1)[C@@H](N[C@H]1C[C@H](c2ccc(F)c(Br)c2)C1)c1ccccc1 ZINC000429806205 857890820 /nfs/dbraw/zinc/89/08/20/857890820.db2.gz HDSWPZLHDASANK-KNBMTAEXSA-N 0 3 417.322 4.444 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)[C@@H](C)[C@H]3OCCc4sccc43)c(C)c2)CC1 ZINC000429845853 857908603 /nfs/dbraw/zinc/90/86/03/857908603.db2.gz KWOKVRDLRUTGNW-HTAPYJJXSA-N 0 3 413.587 4.087 20 0 HIADHN CC(C)n1c(=O)c2ccccc2nc1SC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000430090287 858027400 /nfs/dbraw/zinc/02/74/00/858027400.db2.gz QJRPVRMOGAOJMG-HXUWFJFHSA-N 0 3 423.582 4.361 20 0 HIADHN Cc1ccc(-c2c[nH]cc2C(=O)NC[C@@H]2CN(Cc3ccccc3)CCCO2)s1 ZINC000430105459 858034497 /nfs/dbraw/zinc/03/44/97/858034497.db2.gz LMLXZTBQIWSZHL-LJQANCHMSA-N 0 3 409.555 4.073 20 0 HIADHN CCOc1cc(CN2CC[C@H](O)C[C@@H]2C)ccc1OCCOc1ccc(F)cc1 ZINC000430142134 858051062 /nfs/dbraw/zinc/05/10/62/858051062.db2.gz ZVRHONLNWGFOQQ-PXNSSMCTSA-N 0 3 403.494 4.027 20 0 HIADHN CCOC(=O)Cn1nc(C)c(CN2CC[C@@H](Sc3cccc(Cl)c3)C2)c1C ZINC000430194562 858076400 /nfs/dbraw/zinc/07/64/00/858076400.db2.gz JVZMSTVVZBHSDN-GOSISDBHSA-N 0 3 407.967 4.083 20 0 HIADHN O=S1(=O)CCC2(CCN(CC(c3ccc(F)cc3)c3ccc(F)cc3)CC2)CC1 ZINC000430216675 858085705 /nfs/dbraw/zinc/08/57/05/858085705.db2.gz FTEZHYUKMHPAPR-UHFFFAOYSA-N 0 3 419.537 4.388 20 0 HIADHN CN(C(=O)N[C@H](CC1CC1)c1cc(F)cc(Br)c1)[C@@H]1CCN(C2CC2)C1 ZINC000430295539 858111779 /nfs/dbraw/zinc/11/17/79/858111779.db2.gz CYGILVIMKDYZCI-RTBURBONSA-N 0 3 424.358 4.308 20 0 HIADHN Cc1cc(NC(=O)c2cc3sccc3[nH]2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000430298567 858113601 /nfs/dbraw/zinc/11/36/01/858113601.db2.gz KDGFZUCYVNWFAZ-KRWDZBQOSA-N 0 3 405.527 4.434 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccc(F)c2)C1)N1CCC(c2ncccc2Cl)CC1 ZINC000430505556 858204195 /nfs/dbraw/zinc/20/41/95/858204195.db2.gz QXJZQBLCCPQKPW-LJQANCHMSA-N 0 3 415.940 4.492 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)CCC(=O)c2ccc3c(c2)CCC3)CCN1Cc1ccccc1 ZINC000430741506 858283336 /nfs/dbraw/zinc/28/33/36/858283336.db2.gz SYFOPTCMZISKGJ-CYFREDJKSA-N 0 3 404.554 4.308 20 0 HIADHN FC(F)(F)CCN1CCC(Nc2ccc(Cl)c(CN3CCOCC3)c2)CC1 ZINC000430744036 858284716 /nfs/dbraw/zinc/28/47/16/858284716.db2.gz TVLVLVFDQPUWJG-UHFFFAOYSA-N 0 3 405.892 4.001 20 0 HIADHN COc1ccc([C@H](CNC(=O)N[C@@H](c2ccccc2)C(F)F)N2CCCC2)cc1 ZINC000430953109 858381526 /nfs/dbraw/zinc/38/15/26/858381526.db2.gz GBFGSRDSJZZXCX-PMACEKPBSA-N 0 3 403.473 4.138 20 0 HIADHN CN(Cc1cccnc1)C[C@@H]1CCN(C(=O)N[C@H]2CC[C@H](c3ccccc3F)C2)C1 ZINC000431056772 858423988 /nfs/dbraw/zinc/42/39/88/858423988.db2.gz LQXWYEGWVXNIHW-ACRUOGEOSA-N 0 3 410.537 4.020 20 0 HIADHN CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)N[C@@H]1CC[C@@H](c2ccccc2F)C1 ZINC000431060557 858426645 /nfs/dbraw/zinc/42/66/45/858426645.db2.gz SQIPQKJLTTYLKQ-JWRIFHQMSA-N 0 3 410.537 4.191 20 0 HIADHN Cc1ccc([C@@H](CN2C(=O)[C@H](Cc3ccccc3)N(C3CC3)C2=O)N2CCCC2)cc1 ZINC000431061227 858427836 /nfs/dbraw/zinc/42/78/36/858427836.db2.gz JEKLDLBATXLDIM-BJKOFHAPSA-N 0 3 417.553 4.170 20 0 HIADHN CCc1noc(-c2ccc(C)c(NC(=O)NC[C@@H](c3ccc(C)cc3)N(C)C)c2)n1 ZINC000431111526 858451222 /nfs/dbraw/zinc/45/12/22/858451222.db2.gz XRYGDJRQWKWAGG-FQEVSTJZSA-N 0 3 407.518 4.340 20 0 HIADHN O=C1CN(Cc2ccc(Cl)cc2)C(=O)N1C[C@@H]1CCCN(Cc2cccs2)C1 ZINC000431163880 858479972 /nfs/dbraw/zinc/47/99/72/858479972.db2.gz ZRNLNAKWTYOOGY-QGZVFWFLSA-N 0 3 417.962 4.078 20 0 HIADHN O=S(=O)(Cc1cc(Cl)ccc1F)NC1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1 ZINC000431287463 858548168 /nfs/dbraw/zinc/54/81/68/858548168.db2.gz MCDWYMYMZZCQFY-IHWFROFDSA-N 0 3 422.953 4.094 20 0 HIADHN Cc1cc(Cl)cc2c1OCCC[C@H]2NCc1cccc(CN2CCOCC2)c1 ZINC000431325058 858566212 /nfs/dbraw/zinc/56/62/12/858566212.db2.gz YZWRMGBSZKDKBE-JOCHJYFZSA-N 0 3 400.950 4.484 20 0 HIADHN COc1cnccc1N1CCN(C(=O)Nc2ccccc2Cc2ccccc2)CC1 ZINC000431430108 858611040 /nfs/dbraw/zinc/61/10/40/858611040.db2.gz LKXAHYJPLVZGIR-UHFFFAOYSA-N 0 3 402.498 4.035 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)Cc2cccc(OCC(F)(F)F)c2)C1 ZINC000431468012 858631434 /nfs/dbraw/zinc/63/14/34/858631434.db2.gz BGUKPVJKIWGFKZ-VQIMIIECSA-N 0 3 406.448 4.122 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)C1(Cc2ccc(F)cc2)CCOCC1 ZINC000431683053 858737226 /nfs/dbraw/zinc/73/72/26/858737226.db2.gz WXRXJDXJLNMEOJ-FQEVSTJZSA-N 0 3 416.562 4.180 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N[C@@H](c3ccccc3)C(F)F)c(C)c2)CC1 ZINC000431702503 858751137 /nfs/dbraw/zinc/75/11/37/858751137.db2.gz NELBTXMWSMZJCK-FQEVSTJZSA-N 0 3 402.489 4.265 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3CC(C)(C)[C@H]3c3ccncc3)c(C)c2)CC1 ZINC000431707590 858753359 /nfs/dbraw/zinc/75/33/59/858753359.db2.gz YLSSGHHNSIHVAS-JOCHJYFZSA-N 0 3 407.562 4.147 20 0 HIADHN COc1cc2c(c(OC)c1OC)CCN(Cc1c(C)cc(C)c(C(C)=O)c1C)CC2 ZINC000432024998 858935135 /nfs/dbraw/zinc/93/51/35/858935135.db2.gz NDAKVNZBURHXQL-UHFFFAOYSA-N 0 3 411.542 4.441 20 0 HIADHN CN(C(=O)N[C@@H]1CC(C)(C)c2ccccc21)C1CCN(CCc2ccccn2)CC1 ZINC000432148643 859015846 /nfs/dbraw/zinc/01/58/46/859015846.db2.gz NPVYUYMHBMZFBA-HSZRJFAPSA-N 0 3 406.574 4.153 20 0 HIADHN CC(C)C1CCC(CNC(=O)N(C)C2CCN(CCc3ccccn3)CC2)CC1 ZINC000432165015 859025683 /nfs/dbraw/zinc/02/56/83/859025683.db2.gz GDMIZCFOKMVNNJ-UHFFFAOYSA-N 0 3 400.611 4.192 20 0 HIADHN COc1cnccc1N1CCN(C(=O)Nc2ccc(OC3CCCCC3)cc2)CC1 ZINC000432172261 859029664 /nfs/dbraw/zinc/02/96/64/859029664.db2.gz LSPBWQVHTCSDMR-UHFFFAOYSA-N 0 3 410.518 4.156 20 0 HIADHN O=C(NC[C@H]1CN(Cc2ccccc2)CCCO1)N1CC2(CCC2)[C@H]1c1ccccc1 ZINC000432347371 859113932 /nfs/dbraw/zinc/11/39/32/859113932.db2.gz OWDFLOLLQSEXCJ-BJKOFHAPSA-N 0 3 419.569 4.214 20 0 HIADHN COCc1ccc([C@H]2CCCN2C(=O)NC[C@H](c2cccs2)N2CCCC2)o1 ZINC000467564930 881387108 /nfs/dbraw/zinc/38/71/08/881387108.db2.gz SWQSCPICMUEGKT-QZTJIDSGSA-N 0 3 403.548 4.171 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)C2(Cc3ccc(F)cc3)CCOCC2)C1 ZINC000432420152 859156875 /nfs/dbraw/zinc/15/68/75/859156875.db2.gz JEEOWQIMZHXYQJ-XXBNENTESA-N 0 3 410.533 4.117 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)N[C@H]1C[C@H](c2ccc(F)cc2)C1 ZINC000432769744 859350355 /nfs/dbraw/zinc/35/03/55/859350355.db2.gz UAYHOQBKYSJMRO-XYWHTSSQSA-N 0 3 413.562 4.485 20 0 HIADHN Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)N(C)C[C@H](O)COCC(F)(F)F ZINC000432818207 859373210 /nfs/dbraw/zinc/37/32/10/859373210.db2.gz JMILCWKUYYLIIT-HOCLYGCPSA-N 0 3 402.482 4.360 20 0 HIADHN CN(C)Cc1ccc(S(=O)(=O)N(Cc2cccs2)c2ccc(F)cc2)cc1 ZINC000432849643 859387998 /nfs/dbraw/zinc/38/79/98/859387998.db2.gz AVNHUYXJCOHEHI-UHFFFAOYSA-N 0 3 404.532 4.344 20 0 HIADHN Cc1nc(-c2ccc([C@@H](C)NS(=O)(=O)c3ccc(CN(C)C)cc3)cc2)cs1 ZINC000432864178 859395028 /nfs/dbraw/zinc/39/50/28/859395028.db2.gz DCBSASCLKSATFB-OAHLLOKOSA-N 0 3 415.584 4.220 20 0 HIADHN Cc1nc(-c2ccccc2)sc1[C@@H](C)NS(=O)(=O)c1ccc(CN(C)C)cc1 ZINC000432877070 859402339 /nfs/dbraw/zinc/40/23/39/859402339.db2.gz CUSXWASUFAKHEL-MRXNPFEDSA-N 0 3 415.584 4.220 20 0 HIADHN C[C@@H](NS(=O)(=O)c1ccc(CN(C)C)cc1)c1cc(F)c(Cl)cc1Cl ZINC000432937593 859439035 /nfs/dbraw/zinc/43/90/35/859439035.db2.gz IHSUEVPCLHSVGL-LLVKDONJSA-N 0 3 405.322 4.234 20 0 HIADHN COCCOc1cccc(CN2CCC(c3nc(-c4ccccc4OC)no3)CC2)c1 ZINC000433020065 859482247 /nfs/dbraw/zinc/48/22/47/859482247.db2.gz BCRJPNAUXNKLQF-UHFFFAOYSA-N 0 3 423.513 4.150 20 0 HIADHN COc1ccccc1-c1noc(C2CCN(Cc3cc4ccccc4[nH]c3=O)CC2)n1 ZINC000433023098 859484370 /nfs/dbraw/zinc/48/43/70/859484370.db2.gz NLHMERTXMJIAAN-UHFFFAOYSA-N 0 3 416.481 4.379 20 0 HIADHN Cc1cnc(C2CCN(C(=O)N[C@H](CN(C)Cc3ccccc3)C(C)C)CC2)s1 ZINC000433039791 859494099 /nfs/dbraw/zinc/49/40/99/859494099.db2.gz PNGNATSNBKHXPH-OAQYLSRUSA-N 0 3 414.619 4.497 20 0 HIADHN Fc1cccc([C@H]2CN(CCC3CCOCC3)CCN2CCC2CCOCC2)c1 ZINC000433206177 859566205 /nfs/dbraw/zinc/56/62/05/859566205.db2.gz HKGHHRRLAMBYFC-XMMPIXPASA-N 0 3 404.570 4.118 20 0 HIADHN C[C@@H](C(=O)Nc1cccc(Oc2ncc(Br)cn2)c1)N1[C@H](C)CC[C@@H]1C ZINC000433271458 859606962 /nfs/dbraw/zinc/60/69/62/859606962.db2.gz TZPXGVKTHDQLPQ-MJBXVCDLSA-N 0 3 419.323 4.231 20 0 HIADHN OCC1([C@H](NCc2ccc(I)cc2)c2ccccc2)CCC1 ZINC000433301971 859625230 /nfs/dbraw/zinc/62/52/30/859625230.db2.gz WPEHGGAPOYGSBD-GOSISDBHSA-N 0 3 407.295 4.285 20 0 HIADHN Cc1ccc(C(=O)NCC(F)(F)F)cc1NC(=O)[C@@H]1CCCCN1C1CCCC1 ZINC000433306472 859629524 /nfs/dbraw/zinc/62/95/24/859629524.db2.gz SDXMKFXUAKPGTB-SFHVURJKSA-N 0 3 411.468 4.023 20 0 HIADHN CN(C)Cc1ccccc1C(=O)Nc1cccc(C[S@@](=O)Cc2ccccc2)c1 ZINC000433354586 859658816 /nfs/dbraw/zinc/65/88/16/859658816.db2.gz NVZOCIUQYNTCMX-LJAQVGFWSA-N 0 3 406.551 4.449 20 0 HIADHN O=C(Nc1c2c(ccc1Cl)OCC2)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000433487513 859728318 /nfs/dbraw/zinc/72/83/18/859728318.db2.gz QIDYBSMFIXMUAC-UHFFFAOYSA-N 0 3 417.859 4.202 20 0 HIADHN Cc1cc(NC(=O)N2CC3(CCC3)C[C@H]2C)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000433496361 859734139 /nfs/dbraw/zinc/73/41/39/859734139.db2.gz FAGICGPEMHIPFW-TZIWHRDSSA-N 0 3 407.562 4.435 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CC[C@@H](CC(F)(F)F)C1)c1cccc(OC)c1 ZINC000433566534 859782580 /nfs/dbraw/zinc/78/25/80/859782580.db2.gz UFYPMLPYFOKXSM-YJBOKZPZSA-N 0 3 401.473 4.062 20 0 HIADHN Cc1cc(SC2CCCCC2)ccc1NC(=O)C(=O)N1CC[C@H]2CC[C@@H](C1)N2C ZINC000467674587 881465661 /nfs/dbraw/zinc/46/56/61/881465661.db2.gz BQPNTOBSMQVNFU-MSOLQXFVSA-N 0 3 415.603 4.053 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)Nc3ccc(-c4csc(C(F)(F)F)n4)cc3)[C@@H]2C1 ZINC000433794678 859896026 /nfs/dbraw/zinc/89/60/26/859896026.db2.gz ZIELZGXHMNSFPD-CZUORRHYSA-N 0 3 410.465 4.387 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)c2cccc(CSc3nccn3C)c2)CN1Cc1ccccc1 ZINC000467684611 881478161 /nfs/dbraw/zinc/47/81/61/881478161.db2.gz CXOMCOQUWKZDKJ-PGRDOPGGSA-N 0 3 420.582 4.105 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)c1ccc(-c2nc(C3CC3)no2)cc1 ZINC000433857754 859939037 /nfs/dbraw/zinc/93/90/37/859939037.db2.gz FSMFLKVZULPUKU-NRFANRHFSA-N 0 3 402.498 4.181 20 0 HIADHN CN(C)Cc1ccc(S(=O)(=O)N[C@H](Cc2ccccc2)c2cccs2)cc1 ZINC000433863390 859941030 /nfs/dbraw/zinc/94/10/30/859941030.db2.gz FQDYZRCWYBTOKN-HXUWFJFHSA-N 0 3 400.569 4.072 20 0 HIADHN Cc1c(NC(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)noc1-c1ccccc1F ZINC000433894495 859954205 /nfs/dbraw/zinc/95/42/05/859954205.db2.gz RTTMUYPQGHAPOB-QGZVFWFLSA-N 0 3 422.504 4.917 20 0 HIADHN Cc1c(NC(=O)NC[C@H](c2ccccc2)N2CCCC2)noc1-c1ccccc1F ZINC000433908587 859963406 /nfs/dbraw/zinc/96/34/06/859963406.db2.gz OSHSDPXXTBRYNL-HXUWFJFHSA-N 0 3 408.477 4.748 20 0 HIADHN Cc1nc(-c2ccc(CCNC(=O)NC[C@H]3CCCCN3C3CC3)s2)cs1 ZINC000433939958 859988327 /nfs/dbraw/zinc/98/83/27/859988327.db2.gz IYMIXGVGIFOFLS-MRXNPFEDSA-N 0 3 404.605 4.039 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)c2ccc(NC(=O)c3ccccc3)cc2)CN1Cc1ccccc1 ZINC000467698546 881493876 /nfs/dbraw/zinc/49/38/76/881493876.db2.gz QNYXNVVBIQZOPC-DVECYGJZSA-N 0 3 413.521 4.332 20 0 HIADHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc(Cl)c(OCCC(C)C)c(OC)c1 ZINC000434045663 860061475 /nfs/dbraw/zinc/06/14/75/860061475.db2.gz HIRLZTCLFLMQMR-MSOLQXFVSA-N 0 3 408.970 4.472 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)Nc1cccc(-c2noc(C3CC3)n2)c1 ZINC000434084822 860092234 /nfs/dbraw/zinc/09/22/34/860092234.db2.gz YXCAAUSTUYZAER-UHFFFAOYSA-N 0 3 417.513 4.184 20 0 HIADHN C[C@H]1CN(C2CC2)C[C@H]1NC(=O)c1ccccc1-c1ncc(-c2ccccc2F)o1 ZINC000467718821 881516706 /nfs/dbraw/zinc/51/67/06/881516706.db2.gz UAPIDONJHPVGDR-YCRPNKLZSA-N 0 3 405.473 4.360 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1ccnc2ccccc21 ZINC000434312427 860273580 /nfs/dbraw/zinc/27/35/80/860273580.db2.gz LZRZHVQHPZVSSY-HXUWFJFHSA-N 0 3 411.509 4.439 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1ccc(C2CC2)cn1 ZINC000434316223 860277616 /nfs/dbraw/zinc/27/76/16/860277616.db2.gz LYRUPEXHMWJART-OAQYLSRUSA-N 0 3 401.514 4.163 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1cc(F)c(F)c(F)c1 ZINC000434319174 860279776 /nfs/dbraw/zinc/27/97/76/860279776.db2.gz RWDMTDJCJLFEGW-KRWDZBQOSA-N 0 3 414.431 4.308 20 0 HIADHN CCCCS[C@@H](C)C(=O)Nc1c(C)cnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000434322095 860281927 /nfs/dbraw/zinc/28/19/27/860281927.db2.gz TXWNYNUWNXEMOI-AZUAARDMSA-N 0 3 400.592 4.499 20 0 HIADHN CCn1nc(C(C)C)cc1C(=O)Nc1c(C)cnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000434322007 860282290 /nfs/dbraw/zinc/28/22/90/860282290.db2.gz ATHNQVMQJLUSGS-FQEVSTJZSA-N 0 3 420.561 4.231 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)[C@H](C)Oc1ccc(F)cc1 ZINC000434323432 860284520 /nfs/dbraw/zinc/28/45/20/860284520.db2.gz JBZSWNKGVZCOKV-GHTZIAJQSA-N 0 3 422.504 4.184 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)[C@H](C)Oc1cccc(F)c1 ZINC000434323308 860284771 /nfs/dbraw/zinc/28/47/71/860284771.db2.gz HWUSNOVHYQVFHY-RXVVDRJESA-N 0 3 422.504 4.184 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)[C@@H](C)Oc1ccccc1 ZINC000434329661 860292065 /nfs/dbraw/zinc/29/20/65/860292065.db2.gz BSROYKZCKVMPLK-TZIWHRDSSA-N 0 3 404.514 4.045 20 0 HIADHN COc1ccc(C(=O)Nc2c(C)cnn2[C@H]2CCN(Cc3ccccc3)C2)c(F)c1 ZINC000434331617 860294446 /nfs/dbraw/zinc/29/44/46/860294446.db2.gz CWMOHFKCRGTJDL-SFHVURJKSA-N 0 3 408.477 4.039 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)[C@@H](C)Oc1ccc(C)cc1 ZINC000434334872 860296542 /nfs/dbraw/zinc/29/65/42/860296542.db2.gz SNTWZJJXLWPLGF-IRLDBZIGSA-N 0 3 418.541 4.353 20 0 HIADHN O=C(NC[C@@H]1CCCCN1C1CC1)N1CCC[C@@H]1c1nc2cc(Cl)ccc2[nH]1 ZINC000434349224 860305601 /nfs/dbraw/zinc/30/56/01/860305601.db2.gz GTRNGFKCAAEEEH-QFBILLFUSA-N 0 3 401.942 4.080 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)[C@@H](C)Sc1ccccn1 ZINC000434412077 860338252 /nfs/dbraw/zinc/33/82/52/860338252.db2.gz OONHHLMIFSOYSR-QUCCMNQESA-N 0 3 421.570 4.153 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1nccc2ccccc21 ZINC000434412600 860338686 /nfs/dbraw/zinc/33/86/86/860338686.db2.gz PHNQJZUXKCBWJW-NRFANRHFSA-N 0 3 411.509 4.439 20 0 HIADHN O=C(CCc1nc2ccccc2n1-c1ccccc1)NC[C@@H]1CCCCN1C1CC1 ZINC000434426628 860345551 /nfs/dbraw/zinc/34/55/51/860345551.db2.gz WMDJYRXLSOXYBQ-NRFANRHFSA-N 0 3 402.542 4.091 20 0 HIADHN Cc1nc2cc(C(=O)NC[C@@H]3CCCCN3C3CC3)ccc2n1Cc1ccsc1 ZINC000434443469 860355053 /nfs/dbraw/zinc/35/50/53/860355053.db2.gz ZCXIPWYZZNLHSK-FQEVSTJZSA-N 0 3 408.571 4.201 20 0 HIADHN Cc1ccc(Cl)c(NC(=O)NC[C@@H]2CN(Cc3ccccc3)CCCO2)c1C ZINC000434489998 860370986 /nfs/dbraw/zinc/37/09/86/860370986.db2.gz WBNKIGOSYDKXTB-LJQANCHMSA-N 0 3 401.938 4.369 20 0 HIADHN CC(C)C[C@H](NC(=O)CN1CCC(c2ncc3n2CCCC3)CC1)c1ccccc1 ZINC000434690691 860463200 /nfs/dbraw/zinc/46/32/00/860463200.db2.gz JIDJATOXRVYDSR-QHCPKHFHSA-N 0 3 408.590 4.302 20 0 HIADHN COc1cc(-c2nnc(CN3CC[C@@H](c4ccccc4)[C@@H]3C)o2)cc(OC)c1OC ZINC000434893719 860540215 /nfs/dbraw/zinc/54/02/15/860540215.db2.gz CSGBHOWCVDROEZ-MAUKXSAKSA-N 0 3 409.486 4.140 20 0 HIADHN C[C@H]1[C@H](c2ccccc2)CCN1CC(=O)Nc1cccc(CN2CCSCC2)c1 ZINC000434897598 860542507 /nfs/dbraw/zinc/54/25/07/860542507.db2.gz XAFHRNJJXBRJNR-WMZHIEFXSA-N 0 3 409.599 4.052 20 0 HIADHN COc1cc(Br)c(CNC[C@@H]2CCCN(c3ccccc3)C2)cc1O ZINC000435036637 860609381 /nfs/dbraw/zinc/60/93/81/860609381.db2.gz TWNHFFRLIBRWRF-HNNXBMFYSA-N 0 3 405.336 4.170 20 0 HIADHN Cc1cc(NC(=O)NCCc2cccs2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435099094 860641398 /nfs/dbraw/zinc/64/13/98/860641398.db2.gz QNLKIOQFGLSAMP-IBGZPJMESA-N 0 3 409.559 4.064 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)C2(c3ccccc3Cl)CCOCC2)CN1Cc1ccccc1 ZINC000467754870 881567796 /nfs/dbraw/zinc/56/77/96/881567796.db2.gz XJDSVGIWZONBFG-QUCCMNQESA-N 0 3 412.961 4.167 20 0 HIADHN C[C@H]1C[C@H](NC(=O)C2(c3ccccc3Cl)CCOCC2)CN1Cc1ccccc1 ZINC000467754869 881567894 /nfs/dbraw/zinc/56/78/94/881567894.db2.gz XJDSVGIWZONBFG-ICSRJNTNSA-N 0 3 412.961 4.167 20 0 HIADHN CCc1cc(C)cc(CC)c1NC(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000435180243 860681909 /nfs/dbraw/zinc/68/19/09/860681909.db2.gz CYCGZICUEJTHCU-RTBURBONSA-N 0 3 401.595 4.473 20 0 HIADHN CCc1ccccc1OCC(=O)Nc1cc(C)nn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435271221 860710675 /nfs/dbraw/zinc/71/06/75/860710675.db2.gz WWRAHYVRVMUNTC-JOCHJYFZSA-N 0 3 418.541 4.218 20 0 HIADHN Cc1cc(NC(=O)[C@H](C)COc2ccccc2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435277042 860713357 /nfs/dbraw/zinc/71/33/57/860713357.db2.gz IKPKWIZSQZYPAR-DENIHFKCSA-N 0 3 418.541 4.292 20 0 HIADHN CO[C@](C)(C(=O)Nc1cc(C)nn1[C@@H]1CCN(Cc2ccccc2)C1)c1ccccc1 ZINC000435277368 860714533 /nfs/dbraw/zinc/71/45/33/860714533.db2.gz BPLSAOJSKQPYBR-RDGATRHJSA-N 0 3 418.541 4.139 20 0 HIADHN Cc1cc(NC(=O)c2ccnc(OC(C)C)c2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435279951 860715158 /nfs/dbraw/zinc/71/51/58/860715158.db2.gz QUBDWWXOLLKUJD-NRFANRHFSA-N 0 3 419.529 4.073 20 0 HIADHN Cc1cc(NC(=O)COc2ccccc2Cl)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435279912 860715473 /nfs/dbraw/zinc/71/54/73/860715473.db2.gz LSAXWYKLHWWNIU-IBGZPJMESA-N 0 3 424.932 4.309 20 0 HIADHN CSc1cc(C(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)ccn1 ZINC000435284117 860718207 /nfs/dbraw/zinc/71/82/07/860718207.db2.gz DVBFHDYCFJBUAM-IBGZPJMESA-N 0 3 407.543 4.008 20 0 HIADHN COCc1ccc(C(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000435285005 860718868 /nfs/dbraw/zinc/71/88/68/860718868.db2.gz MSSNQVBXPKKSSA-QFIPXVFZSA-N 0 3 404.514 4.037 20 0 HIADHN Cc1cc(NC(=O)[C@@H](C)Oc2cccc(F)c2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435292788 860723189 /nfs/dbraw/zinc/72/31/89/860723189.db2.gz ZXBYQINKFWWBSA-WIYYLYMNSA-N 0 3 422.504 4.184 20 0 HIADHN Cc1cc(NC(=O)[C@H](C)Oc2cccc(C)c2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435303610 860728337 /nfs/dbraw/zinc/72/83/37/860728337.db2.gz ZNSWFQZAESEBCL-UNMCSNQZSA-N 0 3 418.541 4.353 20 0 HIADHN Cc1nc(CCNC(=O)N(CCN(C)Cc2ccccc2)Cc2ccccc2)cs1 ZINC000467760289 881576424 /nfs/dbraw/zinc/57/64/24/881576424.db2.gz XQMWRVVVIWYTTM-UHFFFAOYSA-N 0 3 422.598 4.338 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)C1(Cc2ccccc2)CC1 ZINC000435370108 860767068 /nfs/dbraw/zinc/76/70/68/860767068.db2.gz NTHGEHUYPILMBP-JOCHJYFZSA-N 0 3 400.526 4.292 20 0 HIADHN Cc1cccc(OCCC(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)c1C ZINC000435371054 860768242 /nfs/dbraw/zinc/76/82/42/860768242.db2.gz RYZXLGDDPNBQPD-JOCHJYFZSA-N 0 3 418.541 4.355 20 0 HIADHN C[C@H](Cc1ccccc1F)C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435370920 860768262 /nfs/dbraw/zinc/76/82/62/860768262.db2.gz ROXQMZIGRJEVIS-WIYYLYMNSA-N 0 3 406.505 4.287 20 0 HIADHN O=C(Cc1ccc(F)cc1Cl)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435371044 860768552 /nfs/dbraw/zinc/76/85/52/860768552.db2.gz RUIRZFKRZOLJOX-IBGZPJMESA-N 0 3 412.896 4.304 20 0 HIADHN Cc1c(Cl)cccc1OCC(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435371634 860769534 /nfs/dbraw/zinc/76/95/34/860769534.db2.gz VXNMNYGHDBNFAC-IBGZPJMESA-N 0 3 424.932 4.309 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)[C@H]1SCCc2sccc21 ZINC000435373253 860771293 /nfs/dbraw/zinc/77/12/93/860771293.db2.gz UPELUHQKIGSCLX-UTKZUKDTSA-N 0 3 424.595 4.361 20 0 HIADHN C[C@H](Sc1ccccc1)C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435374092 860771622 /nfs/dbraw/zinc/77/16/22/860771622.db2.gz WGQDNRVYRNYFSS-AZUAARDMSA-N 0 3 406.555 4.449 20 0 HIADHN O=C(Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)[C@H]1SCCc2sccc21 ZINC000435373255 860771892 /nfs/dbraw/zinc/77/18/92/860771892.db2.gz UPELUHQKIGSCLX-UWJYYQICSA-N 0 3 424.595 4.361 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)[C@@H]1SCCc2sccc21 ZINC000435373248 860772123 /nfs/dbraw/zinc/77/21/23/860772123.db2.gz UPELUHQKIGSCLX-DYESRHJHSA-N 0 3 424.595 4.361 20 0 HIADHN O=C(CCCOc1cccc(F)c1)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435374985 860772543 /nfs/dbraw/zinc/77/25/43/860772543.db2.gz KOFDDFKLRQKAFX-OAQYLSRUSA-N 0 3 422.504 4.267 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)[C@@H]1C[C@@H]1c1ccc(F)cc1F ZINC000435375806 860773973 /nfs/dbraw/zinc/77/39/73/860773973.db2.gz WTGGGYBXPSMIFN-HMXCVIKNSA-N 0 3 422.479 4.351 20 0 HIADHN Cc1cc(NC(=O)N[C@H](C)c2ccc(C)o2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435511428 860830179 /nfs/dbraw/zinc/83/01/79/860830179.db2.gz NMNDPYLMQZBGHM-UYAOXDASSA-N 0 3 407.518 4.423 20 0 HIADHN Cc1cc(NC(=O)N[C@H](C)c2csc(C)n2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435514872 860833210 /nfs/dbraw/zinc/83/32/10/860833210.db2.gz DGNCDVHPIVEZOM-VQIMIIECSA-N 0 3 424.574 4.286 20 0 HIADHN Cc1cc([C@H](C)NC(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)ccc1F ZINC000435517918 860835025 /nfs/dbraw/zinc/83/50/25/860835025.db2.gz RUITYYNTIOBZRJ-QRVBRYPASA-N 0 3 405.558 4.116 20 0 HIADHN COc1cccc(NC(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000435519996 860837754 /nfs/dbraw/zinc/83/77/54/860837754.db2.gz AJMXIEFSNYGFTN-HXUWFJFHSA-N 0 3 405.502 4.291 20 0 HIADHN COc1ccc(NC(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000435525845 860842287 /nfs/dbraw/zinc/84/22/87/860842287.db2.gz LNKQIYRLENROSF-FQEVSTJZSA-N 0 3 405.502 4.291 20 0 HIADHN Cc1cc(NC(=O)NC(C)(C)c2nccs2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435526207 860842330 /nfs/dbraw/zinc/84/23/30/860842330.db2.gz HCTCKNOPLDNMKZ-GOSISDBHSA-N 0 3 424.574 4.152 20 0 HIADHN Cc1cc(NC(=O)NCc2ccc(C)s2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435529285 860844520 /nfs/dbraw/zinc/84/45/20/860844520.db2.gz FNFZMDDTTDKCGF-LJQANCHMSA-N 0 3 409.559 4.330 20 0 HIADHN Cc1cc(NC(=O)Nc2cnn(C(C)(C)C)c2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435533199 860848444 /nfs/dbraw/zinc/84/84/44/860848444.db2.gz UTQBDQHVOWTKOY-FQEVSTJZSA-N 0 3 421.549 4.234 20 0 HIADHN CN(C)[C@H](CNC(=O)NCc1csc(CCc2ccccc2)n1)c1ccccc1 ZINC000435532926 860848751 /nfs/dbraw/zinc/84/87/51/860848751.db2.gz SNFQSIDQGZZNGA-OAQYLSRUSA-N 0 3 408.571 4.030 20 0 HIADHN Cc1c(NC(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)cnn1-c1ccccc1 ZINC000435549678 860865697 /nfs/dbraw/zinc/86/56/97/860865697.db2.gz WASYZFPTZXVPBD-UHFFFAOYSA-N 0 3 413.472 4.055 20 0 HIADHN Cc1cccc(CN(Cc2cccc(C)n2)C(=O)NC[C@H](c2ccccc2)N(C)C)n1 ZINC000435577061 860893453 /nfs/dbraw/zinc/89/34/53/860893453.db2.gz IJZUJLMPLNQHFX-XMMPIXPASA-N 0 3 417.557 4.108 20 0 HIADHN C[S@](=O)C1(CNCc2cc(Br)ccc2OCc2ccccc2)CCC1 ZINC000435748272 861028748 /nfs/dbraw/zinc/02/87/48/861028748.db2.gz NOEYSOSNWZDMEW-VWLOTQADSA-N 0 3 422.388 4.419 20 0 HIADHN COc1cc(CN(C)[C@H](C)c2ccc(-n3cncn3)cc2)ccc1OCC(F)(F)F ZINC000435773141 861047821 /nfs/dbraw/zinc/04/78/21/861047821.db2.gz SPSGTRUMBFDJRX-OAHLLOKOSA-N 0 3 420.435 4.410 20 0 HIADHN Cc1cccc2nc(C3CCN(C(=O)NC[C@H](c4ccccc4)N(C)C)CC3)oc21 ZINC000435862397 861123021 /nfs/dbraw/zinc/12/30/21/861123021.db2.gz YXRPRTNXRKBZNH-OAQYLSRUSA-N 0 3 406.530 4.328 20 0 HIADHN Cc1ccc([C@H](NCCCc2ccccc2Br)[C@@H](C)S(C)(=O)=O)cc1 ZINC000435895200 861151544 /nfs/dbraw/zinc/15/15/44/861151544.db2.gz XMUCYQKLXLCZHE-OXQOHEQNSA-N 0 3 424.404 4.454 20 0 HIADHN COCCOc1cc(C)ccc1NC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1 ZINC000437807617 863131742 /nfs/dbraw/zinc/13/17/42/863131742.db2.gz WNFIDANQCXCZJN-FQEVSTJZSA-N 0 3 411.546 4.149 20 0 HIADHN O=C(Nc1ccc(NC(=O)N2CC[C@@H](N3CC=CC3)C2)cc1)c1ccc(Cl)cc1 ZINC000437828004 863174683 /nfs/dbraw/zinc/17/46/83/863174683.db2.gz JOYINVBMHBVYHV-HXUWFJFHSA-N 0 3 410.905 4.070 20 0 HIADHN O=C(N[C@@H]1C[C@H]1c1cccc(Cl)c1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000437870625 863231303 /nfs/dbraw/zinc/23/13/03/863231303.db2.gz SGSXRAYFMZRSPY-ZGUYJTEBSA-N 0 3 415.887 4.300 20 0 HIADHN Cc1ccc(S(=O)(=O)N[C@H](CCN(C)Cc2cccc(C)n2)c2ccccc2)cc1 ZINC000437902504 863277180 /nfs/dbraw/zinc/27/71/80/863277180.db2.gz ZXCVXPYKAOLWPC-XMMPIXPASA-N 0 3 423.582 4.240 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N[C@H](CC(F)(F)F)C(C)C)c(C)c2)CC1 ZINC000437922059 863297835 /nfs/dbraw/zinc/29/78/35/863297835.db2.gz WXUMUKYEOZLSKW-GOSISDBHSA-N 0 3 400.489 4.235 20 0 HIADHN C[C@H]1CCN(C(=O)Nc2cccc(C(=O)N3CCCC3)c2)CCN1Cc1ccccc1 ZINC000437922843 863299812 /nfs/dbraw/zinc/29/98/12/863299812.db2.gz OUPKLWZXIGUCTF-FQEVSTJZSA-N 0 3 420.557 4.051 20 0 HIADHN COc1ccc2cc(NC(=O)N3CC[C@@H](C)N(Cc4ccccc4)CC3)ccc2n1 ZINC000437966179 863336096 /nfs/dbraw/zinc/33/60/96/863336096.db2.gz VRXWKIMMESHABJ-GOSISDBHSA-N 0 3 404.514 4.372 20 0 HIADHN O=C1c2ccccc2C(=O)N1C1CCC(NCc2nc3ccccc3n2C2CC2)CC1 ZINC000437990161 863353171 /nfs/dbraw/zinc/35/31/71/863353171.db2.gz UZZBWPMSTGDQHR-UHFFFAOYSA-N 0 3 414.509 4.068 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)N[C@H]1C[C@@H]1c1ccccc1OC(F)F ZINC000438053587 863420653 /nfs/dbraw/zinc/42/06/53/863420653.db2.gz VOVZJLILOWWTMH-HSALFYBXSA-N 0 3 415.484 4.280 20 0 HIADHN COc1cccc([C@H](CNC(=O)N[C@H]2C[C@H](c3ccccc3F)C2)N2CCCC2)c1 ZINC000438198305 863627382 /nfs/dbraw/zinc/62/73/82/863627382.db2.gz JFYOGEGOPPRQDD-YDHSSHFGSA-N 0 3 411.521 4.217 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Nc1cc(F)ccc1OCC(F)(F)F ZINC000438334003 863809325 /nfs/dbraw/zinc/80/93/25/863809325.db2.gz XLRJRIYIIGSYNN-UHFFFAOYSA-N 0 3 419.444 4.424 20 0 HIADHN C[C@H]1CN(Cc2csc(-c3ccc(C(F)(F)F)cc3)n2)CCN1CC(C)(C)O ZINC000438340893 863811890 /nfs/dbraw/zinc/81/18/90/863811890.db2.gz MEWOXDOVWAJAER-AWEZNQCLSA-N 0 3 413.509 4.106 20 0 HIADHN CCOc1ccc([C@@H]2C[C@H]2NC(=O)N(Cc2ccccc2)C2CCN(C)CC2)cc1 ZINC000438339940 863811934 /nfs/dbraw/zinc/81/19/34/863811934.db2.gz VAMCVBMYGKJNNR-BJKOFHAPSA-N 0 3 407.558 4.247 20 0 HIADHN CCN(CC)C(=O)c1cccc(NC(=O)N(Cc2ccccc2)C2CCN(C)CC2)c1 ZINC000438371220 863832141 /nfs/dbraw/zinc/83/21/41/863832141.db2.gz LNISSIBHSAEZNA-UHFFFAOYSA-N 0 3 422.573 4.297 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)N[C@H]1C[C@@H]1c1ccccc1OC(F)F ZINC000438400454 863848210 /nfs/dbraw/zinc/84/82/10/863848210.db2.gz XGMALVLZDRZLQN-MOPGFXCFSA-N 0 3 421.463 4.056 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)[C@@H]1C[C@@H]1c1cccc(Br)c1 ZINC000438462291 863885590 /nfs/dbraw/zinc/88/55/90/863885590.db2.gz SSYGYMBHWYEAOX-QZTJIDSGSA-N 0 3 407.377 4.205 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)CSCc1coc(-c2ccccc2)n1 ZINC000438464455 863886419 /nfs/dbraw/zinc/88/64/19/863886419.db2.gz WWUJFZZLBFIIPC-UHFFFAOYSA-N 0 3 415.584 4.227 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)CSCc1cc(-c2cccs2)on1 ZINC000438470819 863890868 /nfs/dbraw/zinc/89/08/68/863890868.db2.gz QXPCJPRWJPLCJA-UHFFFAOYSA-N 0 3 421.613 4.288 20 0 HIADHN COc1ccccc1NC(=O)c1ccc(NC(=O)[C@H](C)N2CC[C@@H](C(C)C)C2)cc1 ZINC000438487773 863904209 /nfs/dbraw/zinc/90/42/09/863904209.db2.gz UISHRCADNCWTIZ-PKOBYXMFSA-N 0 3 409.530 4.252 20 0 HIADHN CCC1(CC)CCN(CC(=O)N(Cc2nnc(-c3ccccc3Cl)o2)C2CC2)C1 ZINC000438504764 863927211 /nfs/dbraw/zinc/92/72/11/863927211.db2.gz XQMGEACJCUATFT-UHFFFAOYSA-N 0 3 416.953 4.393 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)NC[C@@H]3CCC[C@@H](C(F)(F)F)C3)cc2)CC1 ZINC000438531958 863956923 /nfs/dbraw/zinc/95/69/23/863956923.db2.gz JISDREWJRFUDTK-IEBWSBKVSA-N 0 3 411.512 4.316 20 0 HIADHN COCCO[C@@H]1CCN(Cc2cn(Cc3ccccc3)nc2-c2ccc(C)cc2)C1 ZINC000438548445 863977612 /nfs/dbraw/zinc/97/76/12/863977612.db2.gz APCGLVUXSDIQNN-XMMPIXPASA-N 0 3 405.542 4.144 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)c2ccc(F)c(Br)c2)CC1 ZINC000438556308 863988280 /nfs/dbraw/zinc/98/82/80/863988280.db2.gz GYJHFZZNKYJAEW-UHFFFAOYSA-N 0 3 405.311 4.325 20 0 HIADHN COCCn1cc(C(=O)N(Cc2ccccc2)C2CCN(C)CC2)c2ccccc21 ZINC000438560312 863993511 /nfs/dbraw/zinc/99/35/11/863993511.db2.gz WJCQXBXOPQXNSU-UHFFFAOYSA-N 0 3 405.542 4.024 20 0 HIADHN Cc1c(C(=O)N(Cc2ccccc2)C2CCN(C)CC2)cnn1-c1cccc(C)c1 ZINC000438562683 863994894 /nfs/dbraw/zinc/99/48/94/863994894.db2.gz QPZBGAIWTKFJFN-UHFFFAOYSA-N 0 3 402.542 4.226 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)CCc2ccc(OC(F)F)cc2)CC1 ZINC000438563361 863996452 /nfs/dbraw/zinc/99/64/52/863996452.db2.gz UYPYBZUXTJXLRJ-UHFFFAOYSA-N 0 3 402.485 4.344 20 0 HIADHN COc1cc2nc(C)sc2cc1NC(=O)N(CCN(C)C)Cc1cccs1 ZINC000438582407 864013257 /nfs/dbraw/zinc/01/32/57/864013257.db2.gz ITQRMGHZYMYHGZ-UHFFFAOYSA-N 0 3 404.561 4.271 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Nc1cccc(NC(=O)c2ccoc2)c1 ZINC000438592165 864020637 /nfs/dbraw/zinc/02/06/37/864020637.db2.gz ZKDYKRQYRZEFAC-UHFFFAOYSA-N 0 3 412.515 4.189 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)Nc2ccc(F)c(Br)c2)c1 ZINC000438597859 864025538 /nfs/dbraw/zinc/02/55/38/864025538.db2.gz MTZCSSMPQPNVEZ-UHFFFAOYSA-N 0 3 408.315 4.492 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)Nc1ccc(Br)c(F)c1 ZINC000438626742 864055072 /nfs/dbraw/zinc/05/50/72/864055072.db2.gz SLAVOLXQWOKNIR-UHFFFAOYSA-N 0 3 412.278 4.323 20 0 HIADHN CCCOc1ccc(NC(=O)C(=O)N(CC)[C@H]2CCN([C@H](C)c3ccccc3)C2)cc1 ZINC000438658104 864104776 /nfs/dbraw/zinc/10/47/76/864104776.db2.gz YVLBLYDEPORHBZ-KNQAVFIVSA-N 0 3 423.557 4.098 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Nc1ccc(OCc2ccncc2)cc1 ZINC000438661428 864110956 /nfs/dbraw/zinc/11/09/56/864110956.db2.gz OGIOVYKWLYXMBP-UHFFFAOYSA-N 0 3 410.543 4.318 20 0 HIADHN CCN(C(=O)C(=O)Nc1cccc(Cl)c1F)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000438663307 864113635 /nfs/dbraw/zinc/11/36/35/864113635.db2.gz CZCFVFZYADMYEE-RDJZCZTQSA-N 0 3 417.912 4.102 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3cccc(Oc4ccccn4)c3)CC2)C[C@@H](C)O1 ZINC000438666624 864120657 /nfs/dbraw/zinc/12/06/57/864120657.db2.gz VDMIFRKSYRPGPP-RTBURBONSA-N 0 3 424.545 4.227 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)Nc3cccc(Oc4ccccn4)c3)CC2)C[C@H](C)O1 ZINC000438666623 864120770 /nfs/dbraw/zinc/12/07/70/864120770.db2.gz VDMIFRKSYRPGPP-OALUTQOASA-N 0 3 424.545 4.227 20 0 HIADHN CCOc1ccc(NC(=O)C(=O)N(CC)[C@H]2CCN([C@H](C)c3ccccc3)C2)c(C)c1 ZINC000438666750 864121217 /nfs/dbraw/zinc/12/12/17/864121217.db2.gz RVCIWUIXFGPIJK-CTNGQTDRSA-N 0 3 423.557 4.016 20 0 HIADHN CN(C)Cc1cccc(NC(=O)C(=O)Nc2cccc(COC3CCCCC3)c2)c1 ZINC000438751409 864242084 /nfs/dbraw/zinc/24/20/84/864242084.db2.gz ZGSFOQFGPJYZBO-UHFFFAOYSA-N 0 3 409.530 4.175 20 0 HIADHN Cc1cccc(OC[C@@H](O)CN2CCC(c3nc4cc(Cl)ccc4o3)CC2)c1 ZINC000438755236 864248188 /nfs/dbraw/zinc/24/81/88/864248188.db2.gz MJLVMKANHRLVAJ-SFHVURJKSA-N 0 3 400.906 4.409 20 0 HIADHN CCN1CCC[C@@H]1CNC(=O)C(=O)Nc1ccc([C@@H](C)Sc2ccccc2)cc1 ZINC000438808573 864298633 /nfs/dbraw/zinc/29/86/33/864298633.db2.gz BSIVYKKYKMDOLR-YLJYHZDGSA-N 0 3 411.571 4.079 20 0 HIADHN C[C@@H](CCN1C(=O)c2ccccc2C1=O)NCc1nc(-c2ccccc2F)cs1 ZINC000438846672 864342674 /nfs/dbraw/zinc/34/26/74/864342674.db2.gz ASTOEXKXHISNKC-AWEZNQCLSA-N 0 3 409.486 4.114 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)Nc1ccccc1CC(F)(F)F ZINC000438874014 864364850 /nfs/dbraw/zinc/36/48/50/864364850.db2.gz BOTLPENMVCWDNX-UHFFFAOYSA-N 0 3 421.463 4.070 20 0 HIADHN Cc1cnn(-c2ccc(NC(=O)N(Cc3ccccc3)C3CCN(C)CC3)cc2F)c1 ZINC000438885804 864371123 /nfs/dbraw/zinc/37/11/23/864371123.db2.gz VNXJRIFFXKEPSD-UHFFFAOYSA-N 0 3 421.520 4.448 20 0 HIADHN COc1cc(NC(C)=O)ccc1[C@H](C)NCCC(=O)Nc1cccc(Cl)c1C ZINC000439005279 864458431 /nfs/dbraw/zinc/45/84/31/864458431.db2.gz VOPDIXMGIYQUGD-AWEZNQCLSA-N 0 3 403.910 4.295 20 0 HIADHN O[C@@H]1CCCC[C@H]1[C@H]1CCCCN1Cc1nnc(-c2ccccc2Br)o1 ZINC000439013957 864465096 /nfs/dbraw/zinc/46/50/96/864465096.db2.gz FIZXHBJLHJLDFV-CGTJXYLNSA-N 0 3 420.351 4.405 20 0 HIADHN CCCN(C(=O)c1cccc(C(=O)NC2CC2)c1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000439120643 864557215 /nfs/dbraw/zinc/55/72/15/864557215.db2.gz VQVUFTNFKLWPAC-XMMPIXPASA-N 0 3 419.569 4.096 20 0 HIADHN Cc1ccccc1NC(=O)CCN1CCCN(C(=O)Nc2cccc(Cl)c2)CC1 ZINC000439133452 864567132 /nfs/dbraw/zinc/56/71/32/864567132.db2.gz SHARWTIIRSEEPH-UHFFFAOYSA-N 0 3 414.937 4.217 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)NCCc1nc2cc(Cl)ccc2s1 ZINC000439206729 864631489 /nfs/dbraw/zinc/63/14/89/864631489.db2.gz ADALWWJSQYGVDS-UHFFFAOYSA-N 0 3 423.007 4.327 20 0 HIADHN CCN(C[C@@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)c1cccc2cc(C)cnc21 ZINC000439219823 864637725 /nfs/dbraw/zinc/63/77/25/864637725.db2.gz BRFJVBDUBWAOCP-OAQYLSRUSA-N 0 3 423.582 4.076 20 0 HIADHN CCN(C[C@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)Cc1ccccc1Cl ZINC000439227461 864645713 /nfs/dbraw/zinc/64/57/13/864645713.db2.gz DBGHKSVUMPNYIH-IBGZPJMESA-N 0 3 406.979 4.014 20 0 HIADHN COc1ccc2cc(CN(C)C(=O)[C@@H](C)N3CCC([C@@H]4CCCO4)CC3)ccc2c1 ZINC000439302729 864729192 /nfs/dbraw/zinc/72/91/92/864729192.db2.gz VOSOJSOQMBZSCJ-KOSHJBKYSA-N 0 3 410.558 4.086 20 0 HIADHN COc1ccc2cc(CN(C)C(=O)[C@H](C)N3CCC([C@@H]4CCCO4)CC3)ccc2c1 ZINC000439302736 864729676 /nfs/dbraw/zinc/72/96/76/864729676.db2.gz VOSOJSOQMBZSCJ-UUOWRZLLSA-N 0 3 410.558 4.086 20 0 HIADHN C[C@H]1C[C@@H](c2ccccc2)CCN1CC(=O)N1CCC(OCc2ccccc2)CC1 ZINC000439315531 864749473 /nfs/dbraw/zinc/74/94/73/864749473.db2.gz JINCBQWGOPTWKY-URXFXBBRSA-N 0 3 406.570 4.462 20 0 HIADHN CO[C@@H](c1ccc(Cl)cc1)[C@@H](C)NC(=O)N(CCN(C)C)Cc1cccs1 ZINC000439355164 864796542 /nfs/dbraw/zinc/79/65/42/864796542.db2.gz ITUAWMLYGISYGU-DNVCBOLYSA-N 0 3 409.983 4.251 20 0 HIADHN COc1ccc(NC(=O)c2ccc(NC(=O)c3cccc(CN(C)C)c3)cc2)cc1 ZINC000467934827 881807510 /nfs/dbraw/zinc/80/75/10/881807510.db2.gz FEOXRPYTFBTBGR-UHFFFAOYSA-N 0 3 403.482 4.261 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)Nc2cc(F)ccc2Br)c1 ZINC000467936802 881808909 /nfs/dbraw/zinc/80/89/09/881808909.db2.gz DNUGTKHDXQUOCQ-UHFFFAOYSA-N 0 3 408.315 4.492 20 0 HIADHN Cc1ccc([C@H]2OCCC[C@H]2NC(=O)N(CCN(C)C)Cc2cccs2)cc1 ZINC000439501350 864855722 /nfs/dbraw/zinc/85/57/22/864855722.db2.gz DDBMSEUXJIXGDI-NHCUHLMSSA-N 0 3 401.576 4.050 20 0 HIADHN COc1cccc(NC(=O)[C@@H](NC2CCC(c3nc(C)no3)CC2)c2ccccc2)c1 ZINC000439514878 864859361 /nfs/dbraw/zinc/85/93/61/864859361.db2.gz BTEDGGHAKPGIPE-AJTFCVKESA-N 0 3 420.513 4.382 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(Cl)cc2)CC1)[C@@H]1C[C@]12CCc1ccccc12 ZINC000439536508 864869132 /nfs/dbraw/zinc/86/91/32/864869132.db2.gz VQNKXVDRZYTRSV-ZCYQVOJMSA-N 0 3 424.972 4.204 20 0 HIADHN C[C@@H](NCc1ccccc1CN(C)Cc1ccco1)C(=O)Nc1c(F)cccc1F ZINC000439597277 864920357 /nfs/dbraw/zinc/92/03/57/864920357.db2.gz NRKBGHHMIJULRY-MRXNPFEDSA-N 0 3 413.468 4.307 20 0 HIADHN Cc1ccc(NC(=O)[C@H](C)NCc2ccccc2CN(C)Cc2ccco2)c(F)c1 ZINC000439597761 864920512 /nfs/dbraw/zinc/92/05/12/864920512.db2.gz OVDNODSVBRJFBW-SFHVURJKSA-N 0 3 409.505 4.476 20 0 HIADHN Cc1ccc(NC(=O)[C@@H](C)NCc2ccccc2CN(C)Cc2ccco2)c(F)c1 ZINC000439597760 864921206 /nfs/dbraw/zinc/92/12/06/864921206.db2.gz OVDNODSVBRJFBW-GOSISDBHSA-N 0 3 409.505 4.476 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)NC[C@@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000439633706 864958717 /nfs/dbraw/zinc/95/87/17/864958717.db2.gz MEBHGYNZPHHKJK-IAGOWNOFSA-N 0 3 403.464 4.268 20 0 HIADHN CC[C@@](C)(O)CN(Cc1ccccc1)C(=O)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000439700175 865036570 /nfs/dbraw/zinc/03/65/70/865036570.db2.gz RAUGOHNJHCCVGI-UKILVPOCSA-N 0 3 409.574 4.196 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)CSCc2cccc(Cl)c2)CC1 ZINC000439734404 865067211 /nfs/dbraw/zinc/06/72/11/865067211.db2.gz QCEUCEAKPLDAJV-INIZCTEOSA-N 0 3 403.979 4.310 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)c2cc(C3CC3)nn2-c2ccccc2)CC1 ZINC000439736965 865069354 /nfs/dbraw/zinc/06/93/54/865069354.db2.gz GAXYVGUTZOVFLZ-GOSISDBHSA-N 0 3 415.541 4.100 20 0 HIADHN CC(C)n1cc(Br)cc1C(=O)NC1CCN([C@H](C)c2ccncc2)CC1 ZINC000439736658 865069419 /nfs/dbraw/zinc/06/94/19/865069419.db2.gz WGBUUVUYUYRNJC-OAHLLOKOSA-N 0 3 419.367 4.182 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)C(C)(C)Oc2ccc(Cl)cc2)CC1 ZINC000439766460 865092589 /nfs/dbraw/zinc/09/25/89/865092589.db2.gz NBZKBYWPRIYZMY-MRXNPFEDSA-N 0 3 401.938 4.234 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)[C@H]2C[C@H]2c2ccccc2OC(F)F)CC1 ZINC000439770284 865095553 /nfs/dbraw/zinc/09/55/53/865095553.db2.gz QEMAQHVPPYOKLW-XPGWFJOJSA-N 0 3 415.484 4.128 20 0 HIADHN COc1ccc([C@H](C)N[C@H]2CC(=O)N(Cc3ccccc3C(F)(F)F)C2)cc1OC ZINC000468031733 881863612 /nfs/dbraw/zinc/86/36/12/881863612.db2.gz XLDOHJYZJNWVSR-YOEHRIQHSA-N 0 3 422.447 4.174 20 0 HIADHN Cc1ccc(C(=O)N(C)C)cc1NC(=O)N1CCN(C2CCC(C(C)C)CC2)CC1 ZINC000440242452 865478601 /nfs/dbraw/zinc/47/86/01/865478601.db2.gz OVFABVBNAQMIKP-UHFFFAOYSA-N 0 3 414.594 4.061 20 0 HIADHN CC(C)n1cnnc1-c1ccccc1NC(=O)N(CCN(C)C)Cc1cccs1 ZINC000440287355 865539501 /nfs/dbraw/zinc/53/95/01/865539501.db2.gz UVELHLJEMBSYIY-UHFFFAOYSA-N 0 3 412.563 4.183 20 0 HIADHN CC(C)C1CCC(N2CCN(CC(=O)N(C)Cc3ccc(Cl)s3)CC2)CC1 ZINC000440314070 865583682 /nfs/dbraw/zinc/58/36/82/865583682.db2.gz JVQPAFBSXIMJRT-UHFFFAOYSA-N 0 3 412.043 4.192 20 0 HIADHN O=C(NC[C@@]1(O)CCN(Cc2ccccc2)C1)c1ccccc1Sc1ccccc1 ZINC000440521645 865803758 /nfs/dbraw/zinc/80/37/58/865803758.db2.gz XUEIGKGSHYOADB-VWLOTQADSA-N 0 3 418.562 4.205 20 0 HIADHN C[C@@H](NC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1)c1ccc(-n2cccn2)cc1 ZINC000440596650 865830107 /nfs/dbraw/zinc/83/01/07/865830107.db2.gz ABXRBANDDNVAMY-NQIIRXRSSA-N 0 3 406.505 4.101 20 0 HIADHN CCCN(C(=O)c1cc2cnn(CC)c2nc1C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000440717529 865873274 /nfs/dbraw/zinc/87/32/74/865873274.db2.gz LFQIWXHWJJCLHW-JOCHJYFZSA-N 0 3 419.573 4.276 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)NCc2cccc(COCC(F)(F)F)c2)N(C)C)cc1 ZINC000440788400 865911374 /nfs/dbraw/zinc/91/13/74/865911374.db2.gz ZPWPYESGJSEISV-HXUWFJFHSA-N 0 3 423.479 4.176 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)c2ccc(Oc3ccc(C(F)(F)F)cn3)cc2)CN1C1CC1 ZINC000440919022 866014957 /nfs/dbraw/zinc/01/49/57/866014957.db2.gz PFCFPTOIKMBZBB-XJKSGUPXSA-N 0 3 405.420 4.248 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)c2cccc(NC(=O)CCCc3cccs3)c2)CN1C1CC1 ZINC000440926414 866022776 /nfs/dbraw/zinc/02/27/76/866022776.db2.gz XFLYALFZMOTEPQ-VQIMIIECSA-N 0 3 411.571 4.065 20 0 HIADHN Cc1nn(C)c(C)c1NC(=O)CN1CCc2ccccc2[C@H](c2ccccc2)[C@@H]1C ZINC000441055060 866131204 /nfs/dbraw/zinc/13/12/04/866131204.db2.gz AKKCOKYEDWKXKN-UUOWRZLLSA-N 0 3 402.542 4.054 20 0 HIADHN COc1cc(-c2noc(CN3C[C@@H](c4ccccc4)C(C)(C)C3)n2)cc(OC)c1OC ZINC000441079902 866174186 /nfs/dbraw/zinc/17/41/86/866174186.db2.gz NWAGQFYFAIENIH-SFHVURJKSA-N 0 3 423.513 4.388 20 0 HIADHN COc1cc(-c2noc(CN3C[C@H](c4ccccc4)C(C)(C)C3)n2)cc(OC)c1OC ZINC000441079901 866174516 /nfs/dbraw/zinc/17/45/16/866174516.db2.gz NWAGQFYFAIENIH-GOSISDBHSA-N 0 3 423.513 4.388 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3ccc(Oc4ccccc4)nc3)cc2)CC1 ZINC000468120611 881952959 /nfs/dbraw/zinc/95/29/59/881952959.db2.gz NVRUAPQIUCPWFS-UHFFFAOYSA-N 0 3 402.498 4.268 20 0 HIADHN COc1cc(-c2nnc(CN3CCC[C@@H]3CCc3ccccc3)o2)cc(OC)c1OC ZINC000441200684 866272164 /nfs/dbraw/zinc/27/21/64/866272164.db2.gz JLEAYGGQQXNWIH-LJQANCHMSA-N 0 3 423.513 4.360 20 0 HIADHN O=C(CN1CCC[C@@H]([C@@H]2CCOC2)C1)NCCC(c1ccccc1)c1ccccc1 ZINC000441216819 866289836 /nfs/dbraw/zinc/28/98/36/866289836.db2.gz KTYACRVYCRJZFB-DNQXCXABSA-N 0 3 406.570 4.073 20 0 HIADHN CCOc1ccc(-c2nc(CN3CCC[C@H]([C@H]4CCOC4)C3)cs2)cc1OC ZINC000441219204 866295909 /nfs/dbraw/zinc/29/59/09/866295909.db2.gz WGKZWLBLOUVEEK-ROUUACIJSA-N 0 3 402.560 4.466 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)N(C)[C@H]2CCSc3ccc(Br)cc32)CN1C1CC1 ZINC000441303696 866375535 /nfs/dbraw/zinc/37/55/35/866375535.db2.gz QBTJNKUCGFBKOS-MRRJBJDNSA-N 0 3 424.408 4.253 20 0 HIADHN CCN(CC(F)(F)F)C(=O)[C@H]1CCCN(Cc2cc(-c3ccc(F)cc3)no2)C1 ZINC000441348619 866419861 /nfs/dbraw/zinc/41/98/61/866419861.db2.gz RDXUBHXBGHGTAI-HNNXBMFYSA-N 0 3 413.415 4.104 20 0 HIADHN OC[C@]1(NCc2ccc(OC(F)F)c(Br)c2)CCCc2ccccc21 ZINC000441354470 866425159 /nfs/dbraw/zinc/42/51/59/866425159.db2.gz OCCVMSODSHSMRJ-LJQANCHMSA-N 0 3 412.274 4.364 20 0 HIADHN Cc1ccc([C@H]2CCC[C@H]2N(C)CC(=O)Nc2ccccc2N2CCCC2=O)cc1 ZINC000441355583 866425475 /nfs/dbraw/zinc/42/54/75/866425475.db2.gz KNONLBQUXVYERK-IFMALSPDSA-N 0 3 405.542 4.328 20 0 HIADHN C[S@](=O)C1(CNCc2cccc(NC(=O)c3ccc(Cl)cc3Cl)c2)CC1 ZINC000441369755 866437617 /nfs/dbraw/zinc/43/76/17/866437617.db2.gz VWJQXZOGIGTWHN-SANMLTNESA-N 0 3 411.354 4.246 20 0 HIADHN C[C@H](C(=O)N[C@@H](C)c1ccc(Cl)cc1)N1CC[C@H](COCc2ccccc2)C1 ZINC000441371327 866439453 /nfs/dbraw/zinc/43/94/53/866439453.db2.gz TUDRNLNBGSUYLN-NSHGMRRFSA-N 0 3 400.950 4.444 20 0 HIADHN COc1cccc(CN(C)C(=O)CN(C)[C@@H]2CCC[C@@H]2c2ccc(C)cc2)c1OC ZINC000441376932 866446879 /nfs/dbraw/zinc/44/68/79/866446879.db2.gz LFOAFIYCNYOWKU-FGZHOGPDSA-N 0 3 410.558 4.239 20 0 HIADHN Cc1ccc([C@@H]2CCC[C@H]2N(C)CC(=O)NCC2(c3ccccc3)CCOCC2)cc1 ZINC000441378868 866448202 /nfs/dbraw/zinc/44/82/02/866448202.db2.gz NGCWBHNSSAMGAD-LOSJGSFVSA-N 0 3 420.597 4.428 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)N(C)CCCCCc2cc(-c3ccccc3)no2)CN1C1CC1 ZINC000441394340 866466620 /nfs/dbraw/zinc/46/66/20/866466620.db2.gz OJMYVRPRBQAWQX-UYAOXDASSA-N 0 3 410.562 4.321 20 0 HIADHN COc1cc(CNC(=O)CN2CCC[C@H]3CCC[C@H]32)ccc1OCc1ccccc1 ZINC000441441130 866516741 /nfs/dbraw/zinc/51/67/41/866516741.db2.gz BNSPKQZLNWWISN-FGZHOGPDSA-N 0 3 408.542 4.155 20 0 HIADHN COc1cc(CNC(=O)CN2CCC[C@H]3CCC[C@@H]32)ccc1OCc1ccccc1 ZINC000441441132 866516983 /nfs/dbraw/zinc/51/69/83/866516983.db2.gz BNSPKQZLNWWISN-YADHBBJMSA-N 0 3 408.542 4.155 20 0 HIADHN Cc1c(C(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)cnn1CCC(C)C ZINC000441455053 866530285 /nfs/dbraw/zinc/53/02/85/866530285.db2.gz VCINYNAWEMUVTK-NRFANRHFSA-N 0 3 420.561 4.133 20 0 HIADHN CCCn1ccc2ccc(NC(=O)C(=O)NC[C@@H](c3ccccc3)N(CC)CC)cc21 ZINC000441593918 866685188 /nfs/dbraw/zinc/68/51/88/866685188.db2.gz CRZQADFLWVPWKH-QHCPKHFHSA-N 0 3 420.557 4.189 20 0 HIADHN CCN(CC)[C@H](CNC(=O)C(=O)Nc1ccc(OC(C)(C)C)cc1)c1ccccc1 ZINC000441597134 866688212 /nfs/dbraw/zinc/68/82/12/866688212.db2.gz JLVFGVNWLPHSJP-OAQYLSRUSA-N 0 3 411.546 4.002 20 0 HIADHN COc1ccc(NC(=O)[C@H](c2ccccc2)N2CC[C@H]([C@H]3CCOC3)C2)cc1Cl ZINC000441643203 866752388 /nfs/dbraw/zinc/75/23/88/866752388.db2.gz BGFSMAWKVGASHV-SPEDKVCISA-N 0 3 414.933 4.387 20 0 HIADHN CC(C)Sc1c(Cl)cccc1NC(=O)C(=O)NC[C@@H](C)N1CCC(C)CC1 ZINC000441792369 866862749 /nfs/dbraw/zinc/86/27/49/866862749.db2.gz FGABPQXAJMNUTC-OAHLLOKOSA-N 0 3 411.999 4.016 20 0 HIADHN Cc1nn(C(C)(C)C)cc1[C@@H](C)NC(=O)N(CCN(C)C)Cc1cccc(Cl)c1 ZINC000468161499 882029532 /nfs/dbraw/zinc/02/95/32/882029532.db2.gz WGFQEVXOTLYOGA-MRXNPFEDSA-N 0 3 420.001 4.434 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3cc(Cl)cc(F)c3F)CC2)C[C@H](C)O1 ZINC000442206758 867229158 /nfs/dbraw/zinc/22/91/58/867229158.db2.gz HOYKUJLSONBVGJ-OKILXGFUSA-N 0 3 415.912 4.361 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)Nc3cc(Cl)cc(F)c3F)CC2)C[C@H](C)O1 ZINC000442206755 867229186 /nfs/dbraw/zinc/22/91/86/867229186.db2.gz HOYKUJLSONBVGJ-KBPBESRZSA-N 0 3 415.912 4.361 20 0 HIADHN O=C(NC[C@H]1CN(Cc2ccccc2)CCCO1)Nc1cc(Cl)cc(F)c1F ZINC000442210388 867232125 /nfs/dbraw/zinc/23/21/25/867232125.db2.gz ROEBXLASAYEEEE-INIZCTEOSA-N 0 3 409.864 4.031 20 0 HIADHN O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)Nc1cc(Cl)cc(F)c1F ZINC000442210390 867232530 /nfs/dbraw/zinc/23/25/30/867232530.db2.gz ROEBXLASAYEEEE-MRXNPFEDSA-N 0 3 409.864 4.031 20 0 HIADHN C[C@@H](NC(=O)C(=O)Nc1ccc([C@@H](C)Sc2ccccc2)cc1)C1=CCN(C)CC1 ZINC000442332671 867331327 /nfs/dbraw/zinc/33/13/27/867331327.db2.gz BEHPTNGWDZTVEG-QZTJIDSGSA-N 0 3 423.582 4.245 20 0 HIADHN Cc1ccc(OCc2ccccc2)c(NC(=O)N2CCN(C3CCOCC3)C[C@H]2C)c1 ZINC000442432750 867403018 /nfs/dbraw/zinc/40/30/18/867403018.db2.gz DVRLWCSQLYRMIF-HXUWFJFHSA-N 0 3 423.557 4.291 20 0 HIADHN C[C@@H](N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1)c1ccc(-n2cncn2)cc1 ZINC000443104607 867820723 /nfs/dbraw/zinc/82/07/23/867820723.db2.gz FCRCRXMUBXATNP-NTKDMRAZSA-N 0 3 411.509 4.168 20 0 HIADHN C[C@@H](CS(=O)(=O)c1ccccc1)NCC1(c2cc(F)cc(C(F)(F)F)c2)CC1 ZINC000443109217 867822877 /nfs/dbraw/zinc/82/28/77/867822877.db2.gz YDFHEYCNIWERFV-AWEZNQCLSA-N 0 3 415.452 4.328 20 0 HIADHN CN(C)Cc1cccc(NC(=O)N[C@H](Cc2ccccc2)C(=O)Nc2ccccc2)c1 ZINC000443134800 867835082 /nfs/dbraw/zinc/83/50/82/867835082.db2.gz BLPQEPNABIXRAG-HSZRJFAPSA-N 0 3 416.525 4.120 20 0 HIADHN C[C@@H](NC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1)c1ccc(Br)s1 ZINC000443166805 867854096 /nfs/dbraw/zinc/85/40/96/867854096.db2.gz JLQHRPJADBDAFC-SUYBPPKGSA-N 0 3 408.365 4.316 20 0 HIADHN C[C@@H](C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1)c1ccc(Cl)s1 ZINC000443350714 867921008 /nfs/dbraw/zinc/92/10/08/867921008.db2.gz KKTMNNGCRACMIQ-CQSZACIVSA-N 0 3 410.942 4.304 20 0 HIADHN COc1ccc([C@@H](CNc2nnc(-c3ccccc3Cl)s2)N(C)C)cc1OC ZINC000443434628 868019342 /nfs/dbraw/zinc/01/93/42/868019342.db2.gz HZPSKFXZVHUODW-MRXNPFEDSA-N 0 3 418.950 4.591 20 0 HIADHN COc1ccc(C(=O)C2CCN(C[C@H](O)Cc3ccccc3C(F)(F)F)CC2)cc1 ZINC000443467595 868055325 /nfs/dbraw/zinc/05/53/25/868055325.db2.gz SZMUYQIAXKVCSG-LJQANCHMSA-N 0 3 421.459 4.212 20 0 HIADHN CN(C(=O)Nc1cc(F)cc(F)c1Br)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000443531162 868088387 /nfs/dbraw/zinc/08/83/87/868088387.db2.gz KBQFIKHCSZBWNC-OAHLLOKOSA-N 0 3 424.289 4.466 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)Nc1cc(F)cc(F)c1Br ZINC000443532630 868090567 /nfs/dbraw/zinc/09/05/67/868090567.db2.gz NZTFYDMBRGQVSW-UHFFFAOYSA-N 0 3 412.278 4.323 20 0 HIADHN CCN(Cc1c[nH]c2ccccc12)C(=O)NCC1(N2CCSCC2)CCCC1 ZINC000443592908 868146430 /nfs/dbraw/zinc/14/64/30/868146430.db2.gz OSHGFNOHFSZALU-UHFFFAOYSA-N 0 3 400.592 4.061 20 0 HIADHN C[C@@H]1CCN(CC(=O)N(Cc2nnc(-c3ccccc3Cl)o2)C2CC2)C[C@@H](C)C1 ZINC000443654994 868254147 /nfs/dbraw/zinc/25/41/47/868254147.db2.gz NMPJSIDFYCASKQ-CVEARBPZSA-N 0 3 416.953 4.249 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)CSc2cc(Cl)ccc2Cl)C[C@H](C)O1 ZINC000443656674 868256622 /nfs/dbraw/zinc/25/66/22/868256622.db2.gz RFPYPDWQBBVXSJ-OKILXGFUSA-N 0 3 405.391 4.091 20 0 HIADHN Cc1ccccc1[C@H]([C@@H](C)NC(=O)C(=O)Nc1ccccc1SC(C)C)N(C)C ZINC000443834730 868366032 /nfs/dbraw/zinc/36/60/32/868366032.db2.gz NOBCRFRUUCUAMK-UTKZUKDTSA-N 0 3 413.587 4.242 20 0 HIADHN Cc1ccc(C(F)(F)F)cc1NC(=O)C(=O)N[C@H](C)[C@@H](c1ccccc1C)N(C)C ZINC000443848165 868379130 /nfs/dbraw/zinc/37/91/30/868379130.db2.gz ZXQCTRDNSMBSOJ-BEFAXECRSA-N 0 3 421.463 4.068 20 0 HIADHN CCOc1c(F)cccc1C(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1 ZINC000443879229 868411671 /nfs/dbraw/zinc/41/16/71/868411671.db2.gz GAQTUNJITUDYCY-UHFFFAOYSA-N 0 3 412.427 4.447 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N[C@H]3CCSc4ccc(Cl)cc43)cc2)CC1 ZINC000468266572 882186637 /nfs/dbraw/zinc/18/66/37/882186637.db2.gz PTFNYCMHFMNSEP-FQEVSTJZSA-N 0 3 415.990 4.449 20 0 HIADHN CCOc1c(F)cccc1C(=O)N(CCN(C)C)Cc1ccc(C(F)(F)F)cc1 ZINC000443883663 868420135 /nfs/dbraw/zinc/42/01/35/868420135.db2.gz MPZDVRKBBREJIO-UHFFFAOYSA-N 0 3 412.427 4.447 20 0 HIADHN CCOc1ccc(CNC2(c3ccc(OC)c(F)c3)CCOCC2)cc1OCC ZINC000444014786 868538106 /nfs/dbraw/zinc/53/81/06/868538106.db2.gz RFSLMEGGKCLUEP-UHFFFAOYSA-N 0 3 403.494 4.427 20 0 HIADHN C[C@H]1CCN(C)CCN1C(=O)N[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 ZINC000444021213 868547073 /nfs/dbraw/zinc/54/70/73/868547073.db2.gz LMMPFEKBYVITST-WFASDCNBSA-N 0 3 411.390 4.435 20 0 HIADHN CN(C)Cc1cccc(NC(=O)Nc2ccc3c(c2)CCC(=O)N3CC(F)(F)F)c1 ZINC000444045667 868584535 /nfs/dbraw/zinc/58/45/35/868584535.db2.gz OHHIGBFKVORSNO-UHFFFAOYSA-N 0 3 420.435 4.234 20 0 HIADHN CN(CCC(=O)Nc1cc(F)cc(F)c1)[C@H]1c2cc(Cl)cc(Cl)c2C[C@H]1O ZINC000444046982 868585001 /nfs/dbraw/zinc/58/50/01/868585001.db2.gz ZXGRAUKLNQOLJD-MJGOQNOKSA-N 0 3 415.267 4.190 20 0 HIADHN Cc1ccc(C[NH+](C)C)cc1[N-]S(=O)(=O)c1ccc(OCc2ccccc2)cc1 ZINC000444221805 868675011 /nfs/dbraw/zinc/67/50/11/868675011.db2.gz ZMVWUWKZGZWDKZ-UHFFFAOYSA-N 0 3 410.539 4.436 20 0 HIADHN CC[C@@H](Cc1ccc(C)cc1)N(CC)Cc1nc2cc(C(=O)OC)ccc2c(=O)[nH]1 ZINC000444233506 868681482 /nfs/dbraw/zinc/68/14/82/868681482.db2.gz BTGHPFCUAHUTCK-IBGZPJMESA-N 0 3 407.514 4.274 20 0 HIADHN COc1cc2nc(CN(C)[C@H]3CCC[C@H]3c3ccc(C)cc3)[nH]c(=O)c2cc1OC ZINC000444239914 868689361 /nfs/dbraw/zinc/68/93/61/868689361.db2.gz MTFJQSUUJLYUDW-PXNSSMCTSA-N 0 3 407.514 4.429 20 0 HIADHN COc1ccc(CN(C)C[C@H](O)CO[C@H](c2ccccc2)c2ccc(C)cc2)cc1O ZINC000444401478 868812549 /nfs/dbraw/zinc/81/25/49/868812549.db2.gz GQJJVQXCJYXQCG-JYFHCDHNSA-N 0 3 421.537 4.308 20 0 HIADHN O=C(CCOc1ccc(Cl)cc1Cl)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000444454010 868834051 /nfs/dbraw/zinc/83/40/51/868834051.db2.gz LPSBGBGYLMMDDK-UHFFFAOYSA-N 0 3 423.340 4.358 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)c1cc(-c2cccc(Cl)c2)no1 ZINC000444455120 868835154 /nfs/dbraw/zinc/83/51/54/868835154.db2.gz RRYAAIWPBYDFJM-UHFFFAOYSA-N 0 3 411.889 4.204 20 0 HIADHN CNC(=O)c1ccc(NC(=O)N2CCN(Cc3ccccc3)C3(CCCCC3)C2)cc1 ZINC000444496121 868857395 /nfs/dbraw/zinc/85/73/95/868857395.db2.gz IGKVKGLKKOHJDR-UHFFFAOYSA-N 0 3 420.557 4.099 20 0 HIADHN O=C(CCSc1ccc(F)cc1)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000444544111 868875690 /nfs/dbraw/zinc/87/56/90/868875690.db2.gz KIXDREATHVWJTQ-UHFFFAOYSA-N 0 3 402.535 4.151 20 0 HIADHN Cc1cc(C(=O)Nc2cccc(CN3CCC(CO)CC3)c2)c(C)n1-c1nccs1 ZINC000444545253 868876633 /nfs/dbraw/zinc/87/66/33/868876633.db2.gz KKDORIKEEVHLDL-UHFFFAOYSA-N 0 3 424.570 4.007 20 0 HIADHN C[C@H](Oc1ccc(F)cc1Cl)C(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000444549357 868878857 /nfs/dbraw/zinc/87/88/57/868878857.db2.gz LCFFENHPWOJWRU-HNNXBMFYSA-N 0 3 420.912 4.089 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)NC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000444585226 868891617 /nfs/dbraw/zinc/89/16/17/868891617.db2.gz YBCZIVAYIBLDLS-XXBNENTESA-N 0 3 417.557 4.206 20 0 HIADHN C[C@@H](O)CC(C)(C)CNC(=O)N1CCN(Cc2ccccc2)C2(CCCCC2)C1 ZINC000444703427 868964984 /nfs/dbraw/zinc/96/49/84/868964984.db2.gz KQPXNKCXHGEXJV-HXUWFJFHSA-N 0 3 401.595 4.014 20 0 HIADHN O=C(CCN1CCC[C@@H]([C@H](O)C(F)(F)F)C1)Nc1ccc(Oc2ccccc2)cc1 ZINC000444724740 868976868 /nfs/dbraw/zinc/97/68/68/868976868.db2.gz LCSPPWPBKVFHOV-IERDGZPVSA-N 0 3 422.447 4.443 20 0 HIADHN C[C@H](NC(=O)Cc1noc([C@H]2CCCN(Cc3cccc(F)c3)C2)n1)c1ccccc1 ZINC000445289883 869341886 /nfs/dbraw/zinc/34/18/86/869341886.db2.gz AKAYFAVDSKNLSX-PXNSSMCTSA-N 0 3 422.504 4.008 20 0 HIADHN Cc1cccc(NC(=O)Cc2noc([C@H]3CCCN(Cc4cccc(F)c4)C3)n2)c1 ZINC000445314901 869370082 /nfs/dbraw/zinc/37/00/82/869370082.db2.gz HHEPTVPTPQGATR-SFHVURJKSA-N 0 3 408.477 4.078 20 0 HIADHN COc1ccc([C@H](CNC(=O)NCc2cccc(CSC)c2)N2CCCC2)cc1 ZINC000445557155 869612525 /nfs/dbraw/zinc/61/25/25/869612525.db2.gz KRPRBGAUFRXXEX-QFIPXVFZSA-N 0 3 413.587 4.195 20 0 HIADHN COc1ccc([C@H](CNC(=O)CCc2cn(C)c3ccccc23)N2CCCC2)cc1 ZINC000445644579 869715401 /nfs/dbraw/zinc/71/54/01/869715401.db2.gz HRAXISSLDXSQOV-DEOSSOPVSA-N 0 3 405.542 4.073 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)c1c[nH]nc1-c1cccc(Cl)c1 ZINC000445756729 869803343 /nfs/dbraw/zinc/80/33/43/869803343.db2.gz CSLIFQMOCDXYAX-KRWDZBQOSA-N 0 3 400.935 4.359 20 0 HIADHN CC(C)(COc1ccc(C(F)(F)F)cn1)NCc1cncn1Cc1ccccc1 ZINC000445805297 869832150 /nfs/dbraw/zinc/83/21/50/869832150.db2.gz IZZGWLBEVPHDGH-UHFFFAOYSA-N 0 3 404.436 4.292 20 0 HIADHN CC(C)[C@@H](CC(F)(F)F)NCC(=O)N[C@H](C)c1ccc(OC(F)(F)F)cc1 ZINC000445898403 869877323 /nfs/dbraw/zinc/87/73/23/869877323.db2.gz RBLJDMIZYOGOCH-BXUZGUMPSA-N 0 3 400.363 4.329 20 0 HIADHN O=C(Cc1cccc(C(F)F)c1)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000468412822 882355756 /nfs/dbraw/zinc/35/57/56/882355756.db2.gz WQCRPCDUDUPVQN-HXUWFJFHSA-N 0 3 410.468 4.449 20 0 HIADHN Cn1c(CN[C@@H]2CCC[C@H]2c2ccc(C(F)(F)F)cc2)nc2ccccc2c1=O ZINC000445982331 869946665 /nfs/dbraw/zinc/94/66/65/869946665.db2.gz MTHZJRPKZOJJTK-FUHWJXTLSA-N 0 3 401.432 4.378 20 0 HIADHN CCOC(=O)c1sc2nc(CN[C@H]3CCC[C@@H]3c3ccccc3)nc(N)c2c1C ZINC000445987530 869951059 /nfs/dbraw/zinc/95/10/59/869951059.db2.gz GHIGMDXLWRFRPH-CVEARBPZSA-N 0 3 410.543 4.185 20 0 HIADHN CC(=O)c1ccc(C(=O)N2CCC(N(C)Cc3cccc(C(F)(F)F)c3)CC2)o1 ZINC000446031136 869996227 /nfs/dbraw/zinc/99/62/27/869996227.db2.gz ZAEWSRAUAOWNPZ-UHFFFAOYSA-N 0 3 408.420 4.238 20 0 HIADHN CC1CCN([C@@H](CNC(=O)Nc2cn(C)nc2C(F)(F)F)c2cccs2)CC1 ZINC000446260783 870201041 /nfs/dbraw/zinc/20/10/41/870201041.db2.gz RGUATUKAFGBLRR-AWEZNQCLSA-N 0 3 415.485 4.095 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)N[C@H](c1ccc(F)c(Cl)c1)C(F)(F)F ZINC000446354528 870265650 /nfs/dbraw/zinc/26/56/50/870265650.db2.gz GGIWDATXSIGCFP-MRXNPFEDSA-N 0 3 421.822 4.449 20 0 HIADHN CN1CCCC(C)(C)[C@@H]1CNC(=O)c1oc2ccccc2c1CSc1ncccn1 ZINC000468458398 882398005 /nfs/dbraw/zinc/39/80/05/882398005.db2.gz LPGPWUUHZFNNIC-IBGZPJMESA-N 0 3 424.570 4.365 20 0 HIADHN COc1cccc([C@H](CNC(=O)NCc2cccc(CSC)c2)N2CCCC2)c1 ZINC000446567162 870480537 /nfs/dbraw/zinc/48/05/37/870480537.db2.gz WIUOQWMOBRBGSZ-QFIPXVFZSA-N 0 3 413.587 4.195 20 0 HIADHN CN1CCCC(C)(C)[C@@H]1CNC(=O)c1cc(Br)sc1Br ZINC000468472128 882427838 /nfs/dbraw/zinc/42/78/38/882427838.db2.gz IQWSKVVXQSNQRH-JTQLQIEISA-N 0 3 424.202 4.123 20 0 HIADHN Cc1ccc([C@@H](CCn2cncn2)NCc2ccccc2OCC(F)(F)F)cc1 ZINC000446741369 870647290 /nfs/dbraw/zinc/64/72/90/870647290.db2.gz MKQGOVVHUGQXPH-LJQANCHMSA-N 0 3 404.436 4.449 20 0 HIADHN COc1ccc2c(c1)[C@H](N[C@@H](C)c1ccc(OCCO)c(OC)c1)CCCS2 ZINC000446742743 870649850 /nfs/dbraw/zinc/64/98/50/870649850.db2.gz BVJPNPQOGDJIMV-HNAYVOBHSA-N 0 3 403.544 4.353 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)cc1CN[C@H](CCn1cncn1)c1ccc(C)cc1 ZINC000446753019 870664238 /nfs/dbraw/zinc/66/42/38/870664238.db2.gz JMOXGEQURQVKHY-HSZRJFAPSA-N 0 3 404.493 4.141 20 0 HIADHN C[C@@H](NCc1ccccc1OCC(=O)NC[C@H]1CCCO1)c1cc2ccccc2s1 ZINC000446757272 870668210 /nfs/dbraw/zinc/66/82/10/870668210.db2.gz SPBHGEJHFRLSLV-YLJYHZDGSA-N 0 3 424.566 4.426 20 0 HIADHN CC[C@@H](C)NC(=O)c1cccc(CN[C@H](CCn2cncn2)c2ccc(C)cc2)c1 ZINC000446757427 870671224 /nfs/dbraw/zinc/67/12/24/870671224.db2.gz UEAYJQCRVSMQRV-AUSIDOKSSA-N 0 3 405.546 4.036 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N[C@H](c2ccccc2F)C2CCCC2)CC1 ZINC000446776332 870691175 /nfs/dbraw/zinc/69/11/75/870691175.db2.gz MQRKMHOIUHKQPD-QFIPXVFZSA-N 0 3 405.558 4.246 20 0 HIADHN CN(C[C@H](O)COC1CCOCC1)[C@H](c1ccc(F)cc1)c1ccc(Cl)cc1 ZINC000446777377 870692573 /nfs/dbraw/zinc/69/25/73/870692573.db2.gz OMLNYHRLWVQHSO-UNMCSNQZSA-N 0 3 407.913 4.057 20 0 HIADHN CC(C)N1CCc2nc(CN3CCC[C@@H](c4nc(C(F)(F)F)c[nH]4)C3)sc2C1 ZINC000446830650 870745877 /nfs/dbraw/zinc/74/58/77/870745877.db2.gz VJMWDCKAQRBZIW-CYBMUJFWSA-N 0 3 413.513 4.031 20 0 HIADHN COc1ccc([C@@H](CCn2cncn2)NCc2ccccc2N2CCCCC2)cc1 ZINC000446889371 870808401 /nfs/dbraw/zinc/80/84/01/870808401.db2.gz WFJXMWWEHSAEPV-HSZRJFAPSA-N 0 3 405.546 4.198 20 0 HIADHN O[C@H]([C@H]1CCCN(Cc2ccc(-n3ccc(C(F)(F)F)n3)cc2)C1)C(F)(F)F ZINC000446976220 870874010 /nfs/dbraw/zinc/87/40/10/870874010.db2.gz VUKIZPVBDPMFHS-XJKSGUPXSA-N 0 3 407.358 4.026 20 0 HIADHN CN(Cc1cc(C(C)(C)C)n[nH]1)C(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000447073640 870953470 /nfs/dbraw/zinc/95/34/70/870953470.db2.gz XNZJWEVQYMSUBN-NRFANRHFSA-N 0 3 422.495 4.120 20 0 HIADHN CN1CCC2(CCN(Cc3cn(-c4ccccc4Cl)nc3C(C)(C)C)CC2)C1=O ZINC000447074729 870957012 /nfs/dbraw/zinc/95/70/12/870957012.db2.gz CGPGDBGVYIENRS-UHFFFAOYSA-N 0 3 414.981 4.268 20 0 HIADHN CCc1ccc([C@H](CNC(=O)Nc2cc(-c3n[nH]c(C)n3)ccc2C)N(C)C)cc1 ZINC000447082091 870969609 /nfs/dbraw/zinc/96/96/09/870969609.db2.gz LXDMORYXHYXYRT-NRFANRHFSA-N 0 3 406.534 4.075 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)Nc2cnn(-c3ccccc3F)c2)CC1 ZINC000447168399 871060778 /nfs/dbraw/zinc/06/07/78/871060778.db2.gz RYVOTKFNYFRUHA-UHFFFAOYSA-N 0 3 407.493 4.140 20 0 HIADHN Cc1noc(C)c1CSc1ccccc1C(=O)NC[C@H]1N(C)CCCC1(C)C ZINC000468494264 882479435 /nfs/dbraw/zinc/47/94/35/882479435.db2.gz ASMYWTMXCYGZJA-HXUWFJFHSA-N 0 3 401.576 4.434 20 0 HIADHN C[C@@H]1CN(c2cccc3cnccc32)CCN1CCC(=O)Nc1ccccc1Cl ZINC000447384421 871290574 /nfs/dbraw/zinc/29/05/74/871290574.db2.gz MJACSRQBRDAXLL-QGZVFWFLSA-N 0 3 408.933 4.428 20 0 HIADHN C[C@H](C(=O)Nc1ccc(-c2c[nH]cn2)cc1)N1CC[C@H](C)N(Cc2ccccc2)CC1 ZINC000468501615 882496939 /nfs/dbraw/zinc/49/69/39/882496939.db2.gz QZJJUTBVGADCAB-VQTJNVASSA-N 0 3 417.557 4.000 20 0 HIADHN COc1ccccc1-c1csc([C@@H]2CCCN(C[C@H](O)CC(F)(F)F)C2)n1 ZINC000447402632 871312262 /nfs/dbraw/zinc/31/22/62/871312262.db2.gz LBFLQXJPKBIXPA-ZIAGYGMSSA-N 0 3 400.466 4.311 20 0 HIADHN C[C@H]1CN(c2cccc3cnccc32)CCN1CCCc1nc(-c2cccs2)no1 ZINC000447400947 871312394 /nfs/dbraw/zinc/31/23/94/871312394.db2.gz TZBMHRKJFANNQX-KRWDZBQOSA-N 0 3 419.554 4.490 20 0 HIADHN COc1ccccc1-c1csc([C@H]2CCCN([C@@H]3CCCN(C(C)C)C3=O)C2)n1 ZINC000447401396 871312792 /nfs/dbraw/zinc/31/27/92/871312792.db2.gz YCFJJJFJWISIIM-FXAWDEMLSA-N 0 3 413.587 4.398 20 0 HIADHN Cc1ccc(C[C@H](NC(=O)N(CCN(C)C)Cc2ccco2)c2ccccn2)cc1 ZINC000447415259 871321669 /nfs/dbraw/zinc/32/16/69/871321669.db2.gz ZMSYTMQEWWENHC-QHCPKHFHSA-N 0 3 406.530 4.040 20 0 HIADHN CC(C)NS(=O)(=O)Cc1ccccc1CN[C@@H]1C[C@H](C(C)C)c2ccccc21 ZINC000447538174 871405311 /nfs/dbraw/zinc/40/53/11/871405311.db2.gz AXCHIDBKPDBXAK-DHIUTWEWSA-N 0 3 400.588 4.489 20 0 HIADHN CC(C)[C@H]1C[C@H](NCc2cccc(NC(=O)CCN3CCOCC3)c2)c2ccccc21 ZINC000447546639 871415815 /nfs/dbraw/zinc/41/58/15/871415815.db2.gz XNBGZPADEXKCGK-RPBOFIJWSA-N 0 3 421.585 4.322 20 0 HIADHN CC(=O)c1cc(C(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)ccc1C ZINC000447548352 871421047 /nfs/dbraw/zinc/42/10/47/871421047.db2.gz AKMGLJYTHPGWBJ-QFIPXVFZSA-N 0 3 416.525 4.402 20 0 HIADHN CCOC1CC(CN[C@@H]2CCCc3c(Cl)sc(Cl)c32)(N2CCOCC2)C1 ZINC000447581665 871487270 /nfs/dbraw/zinc/48/72/70/871487270.db2.gz UMSRUYMJCUJBBL-SHBDPFAUSA-N 0 3 419.418 4.292 20 0 HIADHN Cc1ccc([C@@H](NC[C@H]2CCCCN2C2CC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000447593380 871501369 /nfs/dbraw/zinc/50/13/69/871501369.db2.gz RNODBTUEKDXSMK-ISKFKSNPSA-N 0 3 412.599 4.094 20 0 HIADHN OC[C@H](CN[C@@H](c1ccc(F)cc1)c1cccnc1)Cc1cc(F)c(F)c(F)c1 ZINC000447607256 871516502 /nfs/dbraw/zinc/51/65/02/871516502.db2.gz QWRQDHRKJQEDRD-NYHFZMIOSA-N 0 3 404.407 4.168 20 0 HIADHN C[C@@H]1OCC[C@]12CN(CCC(=O)Nc1ccccc1Oc1ccccc1)C[C@@H](C)O2 ZINC000447844213 871768278 /nfs/dbraw/zinc/76/82/78/871768278.db2.gz LAKQSDXEDUBXJL-IMWIBFENSA-N 0 3 410.514 4.076 20 0 HIADHN CC(C)n1nc(-c2ccco2)cc1NC(=O)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000447860265 871779940 /nfs/dbraw/zinc/77/99/40/871779940.db2.gz FGQWIAPTQCXQOF-UHFFFAOYSA-N 0 3 422.529 4.181 20 0 HIADHN Cc1nn(C)c(CNC[C@@H](c2ccccc2)N2CCC(C)CC2)c1Br ZINC000447940454 871818553 /nfs/dbraw/zinc/81/85/53/871818553.db2.gz OJDXEWRUTNRQLR-SFHVURJKSA-N 0 3 405.384 4.054 20 0 HIADHN CCc1nc2ccccc2n1C1CCN(C(=O)NC[C@@H]2N(C)CCCC2(C)C)CC1 ZINC000448028118 871867533 /nfs/dbraw/zinc/86/75/33/871867533.db2.gz BQTLRZCFIJICQX-NRFANRHFSA-N 0 3 411.594 4.066 20 0 HIADHN CO[C@@H]1CCOc2c(NC(=O)N3CCCN(Cc4ccccc4)C[C@H]3C)cccc21 ZINC000448040988 871873769 /nfs/dbraw/zinc/87/37/69/871873769.db2.gz ZEZLIOMTEACODO-XMSQKQJNSA-N 0 3 409.530 4.285 20 0 HIADHN CO[C@@H]1CCOc2c(NC(=O)N(Cc3ccccc3)C3CCN(C)CC3)cccc21 ZINC000448046067 871877185 /nfs/dbraw/zinc/87/71/85/871877185.db2.gz WLFKEUBTQSHCBZ-JOCHJYFZSA-N 0 3 409.530 4.285 20 0 HIADHN CC(C)(C)[C@H](CN1CCc2ccccc2C1)NC(=O)Nc1cccc(N2CCC2=O)c1 ZINC000448051328 871881333 /nfs/dbraw/zinc/88/13/33/871881333.db2.gz ZJAKHFGPXACLPX-QFIPXVFZSA-N 0 3 420.557 4.018 20 0 HIADHN CO[C@@H]1CCOc2c(NC(=O)N(C)[C@@H]3CCCN(Cc4ccccc4)C3)cccc21 ZINC000448051936 871882221 /nfs/dbraw/zinc/88/22/21/871882221.db2.gz UMEBDWRMPZCHAP-DENIHFKCSA-N 0 3 409.530 4.285 20 0 HIADHN CC[C@H](NC(=O)N(Cc1ccccc1Br)C1CCN(C)CC1)C(C)C ZINC000460115470 872583696 /nfs/dbraw/zinc/58/36/96/872583696.db2.gz NDMXWMBZYFBPNE-IBGZPJMESA-N 0 3 410.400 4.490 20 0 HIADHN CCCN(CCN1CCN(CC)CC1)C(=O)N[C@H](C)c1ccc(C(C)(C)C)cc1 ZINC000460119076 872589607 /nfs/dbraw/zinc/58/96/07/872589607.db2.gz XDBXGJCSOCLOGF-HXUWFJFHSA-N 0 3 402.627 4.104 20 0 HIADHN CCN(C(=O)Nc1cccc(OC[C@H]2CCCO2)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000460127232 872605749 /nfs/dbraw/zinc/60/57/49/872605749.db2.gz CHYQLWCWRYLGIZ-ISKFKSNPSA-N 0 3 423.557 4.373 20 0 HIADHN CCN(C(=O)Nc1cc(NC(=O)C2CC2)ccc1C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000460132902 872618082 /nfs/dbraw/zinc/61/80/82/872618082.db2.gz HIXPEHNUNMIWMJ-QFIPXVFZSA-N 0 3 420.557 4.472 20 0 HIADHN CCN(C(=O)Nc1ccccc1OCCCOC)[C@H]1CCN(Cc2ccccc2)C1 ZINC000460132951 872620020 /nfs/dbraw/zinc/62/00/20/872620020.db2.gz HSUGXKSNTZOFQH-NRFANRHFSA-N 0 3 411.546 4.230 20 0 HIADHN O=C(N[C@H]1CCCN(Cc2ccccc2)C1)N1CCCC[C@@H]1c1nnc(C2CCC2)o1 ZINC000460141765 872643335 /nfs/dbraw/zinc/64/33/35/872643335.db2.gz XEURINGYSINQKG-LEWJYISDSA-N 0 3 423.561 4.238 20 0 HIADHN CCC(CC)CNC(=O)N(Cc1ccccc1Br)C1CCN(C)CC1 ZINC000460328022 872928078 /nfs/dbraw/zinc/92/80/78/872928078.db2.gz NXPUXBUNPNYMHW-UHFFFAOYSA-N 0 3 410.400 4.491 20 0 HIADHN CN1CCC(N(Cc2ccccc2Br)C(=O)N[C@@H]2CC=CCC2)CC1 ZINC000460327941 872929506 /nfs/dbraw/zinc/92/95/06/872929506.db2.gz NNRXWXJBXXDPBQ-QGZVFWFLSA-N 0 3 406.368 4.164 20 0 HIADHN CCCN(CCN1CCN(CC)CC1)C(=O)N[C@H](c1ccc(F)cc1F)C(C)(C)C ZINC000460357856 872982757 /nfs/dbraw/zinc/98/27/57/872982757.db2.gz ABRKTFOPMBXFQJ-OAQYLSRUSA-N 0 3 424.580 4.111 20 0 HIADHN Cc1cc(C(=O)NC[C@H](c2ccccc2)N2CCCC2)nn1-c1c(F)cccc1F ZINC000468589955 882674138 /nfs/dbraw/zinc/67/41/38/882674138.db2.gz XKGVEVVRMCVLRZ-OAQYLSRUSA-N 0 3 410.468 4.026 20 0 HIADHN COc1ccc(CNCc2ccc(C)nc2-n2cc(Cl)cn2)cc1Br ZINC000468591086 882677411 /nfs/dbraw/zinc/67/74/11/882677411.db2.gz NZNLYPMMSVRBDG-UHFFFAOYSA-N 0 3 421.726 4.290 20 0 HIADHN Cc1ccc(CNCc2ccc(OCC(F)(F)F)cc2)c(-n2cc(Cl)cn2)n1 ZINC000468594731 882685570 /nfs/dbraw/zinc/68/55/70/882685570.db2.gz AQIVVSSHLKGEBJ-UHFFFAOYSA-N 0 3 410.827 4.460 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)NC[C@@H](C)Oc3cccc(Cl)c3)cc2)CC1 ZINC000460452565 873129285 /nfs/dbraw/zinc/12/92/85/873129285.db2.gz QYGUJRXYYLRRTP-GOSISDBHSA-N 0 3 415.965 4.068 20 0 HIADHN CC(C)Cn1c([C@@H]2OCC[C@@H]2C)nnc1N1C[C@H](C)N(Cc2ccccc2)C[C@H]1C ZINC000460614607 873357078 /nfs/dbraw/zinc/35/70/78/873357078.db2.gz WMCOUHSGJDXIAZ-ITTUMRLJSA-N 0 3 411.594 4.131 20 0 HIADHN CC(C)Cn1c([C@@H]2OCC[C@@H]2C)nnc1N1C[C@H](C)N(Cc2ccccc2)C[C@@H]1C ZINC000460614604 873357401 /nfs/dbraw/zinc/35/74/01/873357401.db2.gz WMCOUHSGJDXIAZ-BPBCIEFSSA-N 0 3 411.594 4.131 20 0 HIADHN C[C@@H]1CCCCN1CCNC(=O)c1ccc(Oc2cccc(Cl)c2Cl)nn1 ZINC000460727121 873534796 /nfs/dbraw/zinc/53/47/96/873534796.db2.gz NVIRFGYJDYSFRN-CYBMUJFWSA-N 0 3 409.317 4.180 20 0 HIADHN CCc1ccc([C@H](CNC(=O)c2ccc(OCc3ccccn3)cc2)N(C)C)cc1 ZINC000460788306 873648506 /nfs/dbraw/zinc/64/85/06/873648506.db2.gz GXYSJKXZFMAUDQ-DEOSSOPVSA-N 0 3 403.526 4.256 20 0 HIADHN CCc1ccc([C@H](CNC(=O)c2c[nH]cc2-c2ccc3c(c2)OCCO3)N(C)C)cc1 ZINC000460794425 873662524 /nfs/dbraw/zinc/66/25/24/873662524.db2.gz XCPQJUQISXGSMW-QFIPXVFZSA-N 0 3 419.525 4.048 20 0 HIADHN CCOCCCn1c(C2CCC2)nnc1N1C[C@H](C)N(Cc2ccccc2)C[C@@H]1C ZINC000460795268 873664276 /nfs/dbraw/zinc/66/42/76/873664276.db2.gz PJWFMDWVRWCLMZ-PMACEKPBSA-N 0 3 411.594 4.071 20 0 HIADHN CN(C)[C@@H](CNC(=O)C1(c2cccc(C(F)(F)F)c2)CCC1)Cc1ccccc1 ZINC000460802478 873674420 /nfs/dbraw/zinc/67/44/20/873674420.db2.gz BRUNWJJZRCHFGV-HXUWFJFHSA-N 0 3 404.476 4.416 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N1CCCC[C@@H]1c1nnc(C2CCC2)o1 ZINC000460901196 873809929 /nfs/dbraw/zinc/80/99/29/873809929.db2.gz WXUJJILJTGSCHX-JRGCBEDISA-N 0 3 423.561 4.094 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1c2ccccc2CC12CCOCC2)[C@H](c1ccccc1)N(C)C ZINC000461226309 874227815 /nfs/dbraw/zinc/22/78/15/874227815.db2.gz MIAHDOXYZFVORH-CDNPAEQRSA-N 0 3 407.558 4.071 20 0 HIADHN Cc1ccccc1[C@@H]1CN(C(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)[C@@H](C)CO1 ZINC000461251395 874254647 /nfs/dbraw/zinc/25/46/47/874254647.db2.gz CXDWFKHYYLXVOL-PTLVVNQVSA-N 0 3 410.533 4.335 20 0 HIADHN C[C@H](CC(=O)c1ccccc1F)C(=O)N1C[C@H]2CN(Cc3ccccc3)CC[C@@H]2C1 ZINC000461438566 874491009 /nfs/dbraw/zinc/49/10/09/874491009.db2.gz MFVDGNJOIFISBH-HMXCVIKNSA-N 0 3 408.517 4.015 20 0 HIADHN C[C@@H](NC(=O)NCC1(c2cc(C(F)(F)F)ccc2Cl)CC1)C1=CCN(C)CC1 ZINC000468742090 882838213 /nfs/dbraw/zinc/83/82/13/882838213.db2.gz FLOPYJAWJUQFTR-CYBMUJFWSA-N 0 3 415.887 4.340 20 0 HIADHN O=C1[C@@H](NCc2cccc(Br)c2)CCCN1Cc1ccc(F)cc1F ZINC000468758989 882845884 /nfs/dbraw/zinc/84/58/84/882845884.db2.gz AHAOVGOELBDJSP-SFHVURJKSA-N 0 3 409.274 4.008 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3ccnc(N4CCC[C@H](C)C4)c3)c(C)c2)CC1 ZINC000461798749 874911946 /nfs/dbraw/zinc/91/19/46/874911946.db2.gz WSVGILVVQDOPHX-IBGZPJMESA-N 0 3 421.589 4.021 20 0 HIADHN CC[C@@H](c1nnc(N(C)[C@H]2CCN(C3CC3)C2)n1C[C@@H]1CCCCO1)c1ccccc1 ZINC000461817700 874938857 /nfs/dbraw/zinc/93/88/57/874938857.db2.gz AWDZBHKOKPYQCX-RJGXRXQPSA-N 0 3 423.605 4.062 20 0 HIADHN Cc1ccc(F)c(C(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)c1Br ZINC000468840369 882884643 /nfs/dbraw/zinc/88/46/43/882884643.db2.gz DHBUSMYYLNKFBG-GOEBONIOSA-N 0 3 405.311 4.462 20 0 HIADHN C[C@H](CCCOc1ccccc1C(N)=O)NCc1cc(F)ccc1Br ZINC000468845285 882887141 /nfs/dbraw/zinc/88/71/41/882887141.db2.gz DSIJGXBZGJJSKL-CYBMUJFWSA-N 0 3 409.299 4.024 20 0 HIADHN O=C(N[C@@H]1CCCc2cn(C3CCCC3)nc21)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000461945577 875078283 /nfs/dbraw/zinc/07/82/83/875078283.db2.gz DQPRIXLUKVATTB-JTHBVZDNSA-N 0 3 421.589 4.339 20 0 HIADHN O=C(N[C@H]1CCCN(Cc2ccccc2)C1)N[C@H]1CCCc2cn(C3CCCC3)nc21 ZINC000461945575 875078413 /nfs/dbraw/zinc/07/84/13/875078413.db2.gz DQPRIXLUKVATTB-GMAHTHKFSA-N 0 3 421.589 4.339 20 0 HIADHN C[C@@H](CN(C)Cc1ccccc1)NC(=O)N[C@H]1CCCc2cn(C3CCCC3)nc21 ZINC000461959879 875087238 /nfs/dbraw/zinc/08/72/38/875087238.db2.gz RVRTZLUELURXCZ-AVRDEDQJSA-N 0 3 409.578 4.195 20 0 HIADHN O=C(CCc1nnc(-c2ccc(Cl)cc2)o1)N1CCN(CC2CCCCC2)CC1 ZINC000461969785 875093260 /nfs/dbraw/zinc/09/32/60/875093260.db2.gz KKSUOKUFBMKUNT-UHFFFAOYSA-N 0 3 416.953 4.047 20 0 HIADHN COC(=O)[C@](C)(CN[C@H](C)C(=O)Nc1cc(Cl)ccc1Cl)c1ccccc1 ZINC000468861411 882894926 /nfs/dbraw/zinc/89/49/26/882894926.db2.gz GDEZFOLURYKMIH-ZUOKHONESA-N 0 3 409.313 4.041 20 0 HIADHN O=C1[C@@H](NCc2cc(Cl)cc3cccnc32)CCCN1Cc1ccc(F)cc1F ZINC000468862758 882895934 /nfs/dbraw/zinc/89/59/34/882895934.db2.gz FLLJSTOABDOGEB-FQEVSTJZSA-N 0 3 415.871 4.447 20 0 HIADHN COc1cccc(CN[C@@H](C)Cn2cc(Br)cn2)c1OC1CCCC1 ZINC000468871275 882899958 /nfs/dbraw/zinc/89/99/58/882899958.db2.gz GCCXUYFBFBHSNG-AWEZNQCLSA-N 0 3 408.340 4.154 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)N[C@@H]1CCc2sc(Cl)cc21 ZINC000462045603 875158195 /nfs/dbraw/zinc/15/81/95/875158195.db2.gz FKNDTMKNYAKEIW-MRXNPFEDSA-N 0 3 413.921 4.440 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)[C@H]1C[C@@H]1c1ccccc1OC(F)F ZINC000462156380 875253318 /nfs/dbraw/zinc/25/33/18/875253318.db2.gz CPLCKQKQHUPHKT-XCLNPWKQSA-N 0 3 400.469 4.028 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1cccc(C(=O)N(C)CC(C)(C)C)c1 ZINC000462161477 875257516 /nfs/dbraw/zinc/25/75/16/875257516.db2.gz DSFVALFRSUMSTO-WMZHIEFXSA-N 0 3 421.585 4.055 20 0 HIADHN C[C@@H](NC(=O)N1CC[C@@H](CN(C)Cc2cccnc2)C1)c1ccc(C(F)(F)F)cc1 ZINC000462164240 875260578 /nfs/dbraw/zinc/26/05/78/875260578.db2.gz ZIBLNABAVMMRBM-AEFFLSMTSA-N 0 3 420.479 4.325 20 0 HIADHN CCOC(=O)c1csc(CCN[C@H]2CCc3c2c(Br)ccc3F)n1 ZINC000468876858 882912245 /nfs/dbraw/zinc/91/22/45/882912245.db2.gz ILAVTZDHNODQCC-ZDUSSCGKSA-N 0 3 413.312 4.041 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1ccc(NC(=O)c2cccs2)cc1 ZINC000462195102 875301708 /nfs/dbraw/zinc/30/17/08/875301708.db2.gz KCDGKPNPJQCCQP-LAUBAEHRSA-N 0 3 419.550 4.251 20 0 HIADHN C[C@@H](CC(=O)N(CCN(C)C)Cc1ccco1)c1ccc(F)c(Br)c1 ZINC000462212472 875320949 /nfs/dbraw/zinc/32/09/49/875320949.db2.gz JMMRNSFOYZLEAW-AWEZNQCLSA-N 0 3 411.315 4.265 20 0 HIADHN CN(C)C[C@H](NC(=O)NC[C@@H](Cc1ccccc1)C(F)(F)F)c1ccc(F)cc1 ZINC000462236956 875349232 /nfs/dbraw/zinc/34/92/32/875349232.db2.gz RTCHZZVBJBDNOL-MJGOQNOKSA-N 0 3 411.443 4.149 20 0 HIADHN Cc1ccc(NC(=O)C(C)C)cc1NC(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C ZINC000462239441 875353894 /nfs/dbraw/zinc/35/38/94/875353894.db2.gz FYRRFVQUEAPSED-PGRDOPGGSA-N 0 3 408.546 4.232 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)NC[C@H](Cc2ccccc2)C(F)(F)F)cc1 ZINC000462240342 875355173 /nfs/dbraw/zinc/35/51/73/875355173.db2.gz VECBIHQFTWBAHQ-ICSRJNTNSA-N 0 3 423.479 4.018 20 0 HIADHN COCCOc1ccc(NC(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)cc1Cl ZINC000462248267 875366440 /nfs/dbraw/zinc/36/64/40/875366440.db2.gz SPFACGOWQOYSJP-UZLBHIALSA-N 0 3 417.937 4.007 20 0 HIADHN Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C ZINC000462264654 875390975 /nfs/dbraw/zinc/39/09/75/875390975.db2.gz ZGGMIFCIOGHACH-WMZHIEFXSA-N 0 3 422.573 4.023 20 0 HIADHN CC(C)Cn1cc(NC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)c(C(F)F)n1 ZINC000462281226 875407959 /nfs/dbraw/zinc/40/79/59/875407959.db2.gz YTZCQMWTAXKBGL-DOTOQJQBSA-N 0 3 405.493 4.119 20 0 HIADHN Cc1nc(-c2ccc(CNC(=O)N[C@@H]3CN(Cc4ccccc4)C[C@H]3C)o2)cs1 ZINC000462308204 875429101 /nfs/dbraw/zinc/42/91/01/875429101.db2.gz IXUYDSHQYOZOQZ-DNVCBOLYSA-N 0 3 410.543 4.031 20 0 HIADHN COC(=O)Cc1csc(NC(=O)CN[C@H](CC2CCCCC2)c2ccccc2)n1 ZINC000462334796 875450710 /nfs/dbraw/zinc/45/07/10/875450710.db2.gz VPYSDHQISYHPLJ-LJQANCHMSA-N 0 3 415.559 4.098 20 0 HIADHN O=C(N[C@@H]1CCOc2c(F)ccc(F)c21)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000462402527 875509582 /nfs/dbraw/zinc/50/95/82/875509582.db2.gz ODIGQHKIYMKHDB-MAUKXSAKSA-N 0 3 422.422 4.062 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)[C@@H](C)c3cccc(Br)c3)c2)CC1 ZINC000462487198 875595657 /nfs/dbraw/zinc/59/56/57/875595657.db2.gz DBCGMZNEQXHWFX-INIZCTEOSA-N 0 3 416.363 4.333 20 0 HIADHN COc1cccc(Oc2ccc(CN[C@@H](C)Cn3cc(Br)cn3)cn2)c1 ZINC000468899624 882950677 /nfs/dbraw/zinc/95/06/77/882950677.db2.gz IFBZPZJHAGQQCH-AWEZNQCLSA-N 0 3 417.307 4.020 20 0 HIADHN Fc1ccc(-n2cc(CNCCOc3ncc(C(F)(F)F)cc3Cl)cn2)cc1 ZINC000462731587 875806304 /nfs/dbraw/zinc/80/63/04/875806304.db2.gz OXZPRIMRYLSBPX-UHFFFAOYSA-N 0 3 414.790 4.247 20 0 HIADHN OC[C@@H](CNCc1ccccc1Br)Cc1cccc(OC(F)(F)F)c1 ZINC000462739630 875811622 /nfs/dbraw/zinc/81/16/22/875811622.db2.gz ORRQGHAEVNBJPQ-CQSZACIVSA-N 0 3 418.253 4.289 20 0 HIADHN O=C1c2ccccc2C(=O)N1CCCCNCc1ccc(Br)cc1Cl ZINC000462748604 875816832 /nfs/dbraw/zinc/81/68/32/875816832.db2.gz DNCZMKYBEUMBJM-UHFFFAOYSA-N 0 3 421.722 4.269 20 0 HIADHN Cc1nn(C(C)C)cc1CNC[C@H](c1c(F)cccc1Cl)N1CCO[C@@H](C)C1 ZINC000462787921 875840146 /nfs/dbraw/zinc/84/01/46/875840146.db2.gz MJPNYTISODEIAK-MGPUTAFESA-N 0 3 408.949 4.117 20 0 HIADHN COc1ccc(F)cc1CN[C@H]1CCN(c2ncc(C(F)(F)F)cc2Cl)C1 ZINC000462787386 875840463 /nfs/dbraw/zinc/84/04/63/875840463.db2.gz BBOMDPNBTIMRCP-AWEZNQCLSA-N 0 3 403.807 4.270 20 0 HIADHN COc1ccc(C[C@H](NCc2cn(C)nc2C(F)F)c2ccccc2)cc1OC ZINC000462797148 875845991 /nfs/dbraw/zinc/84/59/91/875845991.db2.gz CANLVFVGBVVGIO-SFHVURJKSA-N 0 3 401.457 4.449 20 0 HIADHN COCCC[C@H](NCc1c2c(nn1C)CCCC2)c1ccc(Br)cc1 ZINC000462813948 875856032 /nfs/dbraw/zinc/85/60/32/875856032.db2.gz BRYUWTIPGGFUAC-SFHVURJKSA-N 0 3 406.368 4.319 20 0 HIADHN CCOc1cc(CN(C)C[C@@H](C)O)cc(Br)c1OCc1ccccc1 ZINC000462833358 875868376 /nfs/dbraw/zinc/86/83/76/875868376.db2.gz KVSBZROFYQPDST-OAHLLOKOSA-N 0 3 408.336 4.239 20 0 HIADHN CCOc1cc(CN(C(C)C)[C@@H]2CCOC2)cc(Br)c1OC(F)F ZINC000462874010 875903974 /nfs/dbraw/zinc/90/39/74/875903974.db2.gz ZYFOLSQFQMYNSS-CYBMUJFWSA-N 0 3 408.283 4.449 20 0 HIADHN CC(C)C[C@@H](C)C(=O)NC1CCN(CCOc2ccc(Br)cc2)CC1 ZINC000462997378 876011445 /nfs/dbraw/zinc/01/14/45/876011445.db2.gz YUKJKDFHMHPKSM-MRXNPFEDSA-N 0 3 411.384 4.091 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)c3sc(C4CCCC4)nc3C)cc2)CC1 ZINC000463107765 876147121 /nfs/dbraw/zinc/14/71/21/876147121.db2.gz NGRATDVGWFBDJV-UHFFFAOYSA-N 0 3 412.603 4.499 20 0 HIADHN CC(C)n1cc(Br)cc1C(=O)N(CCN(C)C)Cc1ccccc1F ZINC000463147573 876201782 /nfs/dbraw/zinc/20/17/82/876201782.db2.gz DWANFGBCJXNGDM-UHFFFAOYSA-N 0 3 410.331 4.175 20 0 HIADHN C[C@H](C(=O)N(CCN(C)C)Cc1ccccc1F)c1ccc(Br)s1 ZINC000463153760 876206993 /nfs/dbraw/zinc/20/69/93/876206993.db2.gz SXPRLJRURLCPIE-ZDUSSCGKSA-N 0 3 413.356 4.344 20 0 HIADHN COc1ccc(CN2CCCC[C@@H]2[C@@H]2CCCC[C@@H]2O)c(Br)c1OC ZINC000463197107 876256181 /nfs/dbraw/zinc/25/61/81/876256181.db2.gz OKGQJGFZMLIXSJ-BBWFWOEESA-N 0 3 412.368 4.372 20 0 HIADHN Cc1ccc(-c2nc(CCNC(=O)N[C@@H]3CN(Cc4ccccc4)C[C@@H]3C)co2)cc1 ZINC000463204731 876266705 /nfs/dbraw/zinc/26/67/05/876266705.db2.gz OEYCZXXOOONGEC-WMZHIEFXSA-N 0 3 418.541 4.012 20 0 HIADHN Cc1nc(NC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)nc2c1CCCC2 ZINC000463244878 876301787 /nfs/dbraw/zinc/30/17/87/876301787.db2.gz WRTUIUFXVQGYSC-OAQYLSRUSA-N 0 3 418.463 4.057 20 0 HIADHN C[C@H]1CCCc2ccccc2[C@@H]1NC(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000463261723 876319687 /nfs/dbraw/zinc/31/96/87/876319687.db2.gz IRASLBWTUIWYPX-UQBPGWFLSA-N 0 3 421.585 4.156 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@@H]1CCOc2c(F)ccc(F)c21)c1ccsc1 ZINC000463320011 876377424 /nfs/dbraw/zinc/37/74/24/876377424.db2.gz MPOUTUSMPDQERK-IAGOWNOFSA-N 0 3 409.502 4.232 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NC[C@H]1CCN(c2ccccc2F)C1)c1ccsc1 ZINC000463344773 876398355 /nfs/dbraw/zinc/39/83/55/876398355.db2.gz MIIMQSPJUPSAFF-UTKZUKDTSA-N 0 3 418.582 4.096 20 0 HIADHN C[C@@H]1CCCN(CCNC(=O)c2ccc(-c3noc(-c4ccc(F)cc4)n3)cc2)C1 ZINC000463386368 876442044 /nfs/dbraw/zinc/44/20/44/876442044.db2.gz WYCLFRWYNIVQPL-MRXNPFEDSA-N 0 3 408.477 4.004 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N[C@H](C)c3oc4ccc(OC)cc4c3C)cc2)CC1 ZINC000468966538 883033999 /nfs/dbraw/zinc/03/39/99/883033999.db2.gz KQXXLNVAMMUSEK-GOSISDBHSA-N 0 3 421.541 4.383 20 0 HIADHN CCc1ccc([C@H](CNC(=O)c2cccc(-c3noc(C4CC4)n3)c2)N(C)C)cc1 ZINC000463436661 876492670 /nfs/dbraw/zinc/49/26/70/876492670.db2.gz YVCMLTQRNZUYSW-NRFANRHFSA-N 0 3 404.514 4.209 20 0 HIADHN OC[C@]1(Cc2ccccc2)CCCN(C[C@H](O)COc2cc(Cl)ccc2Cl)C1 ZINC000463453896 876513803 /nfs/dbraw/zinc/51/38/03/876513803.db2.gz WDLOTOXYJHQNPI-UGKGYDQZSA-N 0 3 424.368 4.050 20 0 HIADHN Cc1nc(-c2cccc(C(=O)N3CCC(CN4C[C@@H](C)O[C@@H](C)C4)CC3)c2)cs1 ZINC000463560117 876647172 /nfs/dbraw/zinc/64/71/72/876647172.db2.gz PNJQCGWTHODATO-CALCHBBNSA-N 0 3 413.587 4.080 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)c1cccc(-c2noc(C3CC3)n2)c1 ZINC000463740713 876860745 /nfs/dbraw/zinc/86/07/45/876860745.db2.gz FCMGFNWZWFBCEI-NRFANRHFSA-N 0 3 402.498 4.008 20 0 HIADHN CC(C)(C)C(=O)Nc1ccc(F)c(C(=O)NC[C@H]2CCCN2Cc2ccccc2)c1 ZINC000463740727 876861092 /nfs/dbraw/zinc/86/10/92/876861092.db2.gz FGGJCIBIRUOQNI-LJQANCHMSA-N 0 3 411.521 4.205 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)N3C[C@H](C)C[C@H]3c3ccccc3F)CC2)c1 ZINC000469000442 883068255 /nfs/dbraw/zinc/06/82/55/883068255.db2.gz QTUKVEBSLNUVQL-YKSBVNFPSA-N 0 3 409.549 4.256 20 0 HIADHN COc1ccc([C@H](N[C@H]2CCCN(Cc3ccc(F)cc3F)C2=O)C2CC2)cc1 ZINC000469011309 883080012 /nfs/dbraw/zinc/08/00/12/883080012.db2.gz ONLONMSVXSQKKV-FCHUYYIVSA-N 0 3 400.469 4.205 20 0 HIADHN Cn1cc(N2CCC[C@H](N[C@H](Cc3ccc(Cl)cc3)c3ccccc3)C2=O)cn1 ZINC000463885296 877006519 /nfs/dbraw/zinc/00/65/19/877006519.db2.gz AIPULCAOEVULOL-FCHUYYIVSA-N 0 3 408.933 4.143 20 0 HIADHN O=C(NCCN1CCCCC1)NCc1ccc(Oc2ccccc2C(F)(F)F)nc1 ZINC000463954884 877076970 /nfs/dbraw/zinc/07/69/70/877076970.db2.gz NKJSXSWTRFCORM-UHFFFAOYSA-N 0 3 422.451 4.178 20 0 HIADHN CC(C)c1cccc(C(C)C)c1NC(=O)C(=O)Nc1cccc(CN2CC[C@H](O)C2)c1 ZINC000463977834 877107109 /nfs/dbraw/zinc/10/71/09/877107109.db2.gz QEQWPWLXINCODK-FQEVSTJZSA-N 0 3 423.557 4.077 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)Nc2ccc(NC(=O)c3cccc(Cl)c3)c(F)c2)CCCN1C ZINC000463987665 877121212 /nfs/dbraw/zinc/12/12/12/877121212.db2.gz OVUFKEZCUZXDJW-ACJLOTCBSA-N 0 3 418.900 4.336 20 0 HIADHN Cc1nn(C(C)(C)C)cc1[C@@H](C)NC(=O)NC[C@@H](c1ccc(C)cc1)N1CCCC1 ZINC000464126212 877280992 /nfs/dbraw/zinc/28/09/92/877280992.db2.gz OLUGWTMBBUPRJH-GCJKJVERSA-N 0 3 411.594 4.452 20 0 HIADHN O=C(NCc1cccc(-c2cccnc2)c1)NC[C@@H]1CCCN1Cc1ccccc1 ZINC000464146511 877314654 /nfs/dbraw/zinc/31/46/54/877314654.db2.gz PFELHLVLAPEGPQ-DEOSSOPVSA-N 0 3 400.526 4.212 20 0 HIADHN Cc1nn(C)c(Sc2ccccc2)c1C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C ZINC000464168154 877335299 /nfs/dbraw/zinc/33/52/99/877335299.db2.gz NIBBEIRVCGZVDG-LAUBAEHRSA-N 0 3 420.582 4.130 20 0 HIADHN CSCc1cccnc1C(=O)Nc1cc(C)nn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000464206486 877377565 /nfs/dbraw/zinc/37/75/65/877377565.db2.gz PQFIUQHJSLTXKM-FQEVSTJZSA-N 0 3 421.570 4.149 20 0 HIADHN O=c1ccccn1C[C@H](NCCOc1cccc(Br)c1)c1ccccc1 ZINC000503255002 912235171 /nfs/dbraw/zinc/23/51/71/912235171.db2.gz GTDXRAGMQOGBDY-FQEVSTJZSA-N 0 3 413.315 4.021 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)NCc3cccc(-c4cccnc4)c3)cc2)CC1 ZINC000464321748 877511475 /nfs/dbraw/zinc/51/14/75/877511475.db2.gz QTOHZNXEEOAWHY-UHFFFAOYSA-N 0 3 414.553 4.209 20 0 HIADHN CC[C@@H]1CCCC[C@H]1OCC(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000464405696 877609050 /nfs/dbraw/zinc/60/90/50/877609050.db2.gz NGJTUKCEXOOFBD-YPAWHYETSA-N 0 3 410.562 4.254 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3sccc3CC)c(OCC)c2)CC1 ZINC000464502452 877726229 /nfs/dbraw/zinc/72/62/29/877726229.db2.gz ZIEYUDKJIQXDLR-UHFFFAOYSA-N 0 3 401.576 4.494 20 0 HIADHN O=C(N1CCC(C(F)(F)F)CC1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000464510652 877734325 /nfs/dbraw/zinc/73/43/25/877734325.db2.gz UJLXEDVBQPRJSQ-KRWDZBQOSA-N 0 3 408.386 4.242 20 0 HIADHN CC(C)CN(C(=O)[C@@H]1C[C@@]12CCc1cc(Br)ccc12)C1CCN(C)CC1 ZINC000464572669 877792817 /nfs/dbraw/zinc/79/28/17/877792817.db2.gz HOXZKWWYRZJZNT-RBBKRZOGSA-N 0 3 419.407 4.232 20 0 HIADHN CC(C)CN(C(=O)c1ccc(Br)cc1OC(C)C)C1CCN(C)CC1 ZINC000464579309 877802893 /nfs/dbraw/zinc/80/28/93/877802893.db2.gz SYGBYMGUVCXOIS-UHFFFAOYSA-N 0 3 411.384 4.429 20 0 HIADHN CCCN(CCc1cccs1)CC(=O)N1CCC[C@H]1c1cc(OC)ccc1OC ZINC000464593552 877819706 /nfs/dbraw/zinc/81/97/06/877819706.db2.gz CXCLZRJSUCENLL-NRFANRHFSA-N 0 3 416.587 4.384 20 0 HIADHN Cc1nn(C(C)(C)C)cc1[C@H](C)NC[C@@H](O)COc1c(Cl)cccc1Cl ZINC000464600980 877829051 /nfs/dbraw/zinc/82/90/51/877829051.db2.gz GMZCWFSSFIHWHS-GXTWGEPZSA-N 0 3 400.350 4.344 20 0 HIADHN Cc1nn(C(C)(C)C)cc1[C@H](C)NC[C@H](O)COc1cc(Cl)ccc1Cl ZINC000464632558 877850474 /nfs/dbraw/zinc/85/04/74/877850474.db2.gz XWFMSVNOLCWGNE-WFASDCNBSA-N 0 3 400.350 4.344 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N3C[C@H](C)Oc4ccc(Cl)cc43)cc2)CC1 ZINC000464672688 877891635 /nfs/dbraw/zinc/89/16/35/877891635.db2.gz WEIOEKJLXLNYTI-KRWDZBQOSA-N 0 3 413.949 4.298 20 0 HIADHN COc1ccc(CN(C)C(=O)CN(C)[C@@H](Cc2ccc(F)cc2)C(C)C)cc1F ZINC000464786202 878034712 /nfs/dbraw/zinc/03/47/12/878034712.db2.gz WLUPNGOZVPCMMO-NRFANRHFSA-N 0 3 404.501 4.131 20 0 HIADHN C[C@H](C(=O)N1CCC[C@@H]1c1cccs1)N1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC000464839506 878105528 /nfs/dbraw/zinc/10/55/28/878105528.db2.gz PWILBTDEGAWYKK-KCZVDYSFSA-N 0 3 411.615 4.397 20 0 HIADHN CCc1ccc([C@@H]2C[C@@H](C)CCN2C[C@H](O)COc2c(OC)cccc2OC)o1 ZINC000464846645 878119680 /nfs/dbraw/zinc/11/96/80/878119680.db2.gz SENMVCFEIAZPEK-LNLFQRSKSA-N 0 3 403.519 4.072 20 0 HIADHN CC[C@H]1c2ccsc2CCN1C(=O)CN1CC[C@H](C)N(Cc2ccccc2)CC1 ZINC000464849838 878125830 /nfs/dbraw/zinc/12/58/30/878125830.db2.gz ZERSHLBDXROLMI-UGKGYDQZSA-N 0 3 411.615 4.180 20 0 HIADHN COC(=O)[C@H](C)[C@@H](NCC[S@](=O)c1cc(Cl)ccc1Cl)c1ccccc1 ZINC000464876580 878166873 /nfs/dbraw/zinc/16/68/73/878166873.db2.gz OASAMTKCZHIDQN-RVEGZYOQSA-N 0 3 414.354 4.241 20 0 HIADHN Cc1cc(C)n(-c2ccc(C(=O)N3CC[C@@H](C)N(Cc4ccccc4)CC3)cc2F)n1 ZINC000464893594 878195720 /nfs/dbraw/zinc/19/57/20/878195720.db2.gz LTMGLLXEYCAIGL-LJQANCHMSA-N 0 3 420.532 4.365 20 0 HIADHN Cc1nc2c(cnn2C(C)C)cc1C(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC000464893973 878196742 /nfs/dbraw/zinc/19/67/42/878196742.db2.gz MXMRGFFQKATHBR-GOSISDBHSA-N 0 3 405.546 4.057 20 0 HIADHN C[C@H]1CCN(C(=O)c2cnn(Cc3ccccc3Cl)c2)CCN1Cc1ccccc1 ZINC000464898655 878206019 /nfs/dbraw/zinc/20/60/19/878206019.db2.gz YTCMIAKNWYZHEP-IBGZPJMESA-N 0 3 422.960 4.321 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)CCc3c[nH]c4cc(C)ccc34)c(C)c2)CC1 ZINC000465028468 878393285 /nfs/dbraw/zinc/39/32/85/878393285.db2.gz IAIZPUQWJFAKHQ-UHFFFAOYSA-N 0 3 404.558 4.498 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)Nc2ccccc2CCC(F)(F)F)CC1 ZINC000465243482 878665229 /nfs/dbraw/zinc/66/52/29/878665229.db2.gz UFXHLJPDNARZKF-UHFFFAOYSA-N 0 3 401.473 4.192 20 0 HIADHN CC1CCN([C@@H](CNC(=O)N2CCOC[C@@H]2c2ccccc2)c2cccs2)CC1 ZINC000465423939 878852612 /nfs/dbraw/zinc/85/26/12/878852612.db2.gz SFOBGSUYVNIOQU-LEWJYISDSA-N 0 3 413.587 4.304 20 0 HIADHN CC1CCN([C@H](CNC(=O)N2CCOC[C@H]2c2ccccc2)c2cccs2)CC1 ZINC000465423943 878852643 /nfs/dbraw/zinc/85/26/43/878852643.db2.gz SFOBGSUYVNIOQU-RTWAWAEBSA-N 0 3 413.587 4.304 20 0 HIADHN C[C@@H]1CCN(C(=O)N[C@@H](c2ccccc2)c2ccccn2)CCN1Cc1ccccc1 ZINC000465429839 878861181 /nfs/dbraw/zinc/86/11/81/878861181.db2.gz GWXKWGRFGQZNTR-BWKNWUBXSA-N 0 3 414.553 4.477 20 0 HIADHN O=C(NCc1cc(Cl)ccc1OC(F)F)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000465433373 878865166 /nfs/dbraw/zinc/86/51/66/878865166.db2.gz MZVCUUIAQQHRTE-QGZVFWFLSA-N 0 3 409.864 4.015 20 0 HIADHN C[C@H](CCc1cccn1C)NC(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1 ZINC000465433757 878866766 /nfs/dbraw/zinc/86/67/66/878866766.db2.gz OFIXXLIXJAGEQH-QUCCMNQESA-N 0 3 402.608 4.180 20 0 HIADHN CCO[C@H](C)c1nc(CN(C)C(=O)NC[C@H](c2ccccc2)N2CCCC2)cs1 ZINC000465436607 878869210 /nfs/dbraw/zinc/86/92/10/878869210.db2.gz AVJORTVURWGPNP-YLJYHZDGSA-N 0 3 416.591 4.219 20 0 HIADHN Cc1ccc2nc(CN3CCC(c4ccc(Br)cc4)CC3)cc(=O)n2c1 ZINC000503414363 912397147 /nfs/dbraw/zinc/39/71/47/912397147.db2.gz XMIRAZGHGQXLFO-UHFFFAOYSA-N 0 3 412.331 4.145 20 0 HIADHN COc1cccc([C@H](CNC(=O)NCCc2c[nH]c3c2cccc3C)N2CCCC2)c1 ZINC000465476195 878914651 /nfs/dbraw/zinc/91/46/51/878914651.db2.gz OYYZLNYDVGYPQI-QHCPKHFHSA-N 0 3 420.557 4.164 20 0 HIADHN C[C@@H]1CCN(C(=O)NCc2ccc(OC3CCCC3)nc2)CCN1Cc1ccccc1 ZINC000465516375 878962687 /nfs/dbraw/zinc/96/26/87/878962687.db2.gz MBMQYNOFVHGMQR-HXUWFJFHSA-N 0 3 422.573 4.209 20 0 HIADHN COc1ccc(C2CCN(C(=O)N[C@@H](CN3CCCC3)c3ccccc3)CC2)cc1 ZINC000465531493 878987748 /nfs/dbraw/zinc/98/77/48/878987748.db2.gz RSYHCPUTOSLYJT-DEOSSOPVSA-N 0 3 407.558 4.421 20 0 HIADHN CC[C@H](CNC(=O)N1CC[C@H](COCc2ccccc2)C1)N1CCc2ccccc2C1 ZINC000465537022 878996449 /nfs/dbraw/zinc/99/64/49/878996449.db2.gz GEGBEDICCGTBDA-WIOPSUGQSA-N 0 3 421.585 4.072 20 0 HIADHN Cc1ccc([C@@H]2C[C@H](C)CCN2C(=O)NCc2ccc(CN3CCN(C)CC3)cc2)o1 ZINC000465558173 879026691 /nfs/dbraw/zinc/02/66/91/879026691.db2.gz NAOKWVPDPQVIBS-XXBNENTESA-N 0 3 424.589 4.018 20 0 HIADHN CC(C)(C)OC(=O)c1ccc(CNC(=O)N[C@@H](CN2CCCC2)c2ccccc2)cc1 ZINC000465594468 879079934 /nfs/dbraw/zinc/07/99/34/879079934.db2.gz HKHLQRAZXDATCL-QFIPXVFZSA-N 0 3 423.557 4.278 20 0 HIADHN C[C@H](NC(=O)N[C@H](CN1CCCC1)c1ccccc1)c1cccc(-n2cccn2)c1 ZINC000465598991 879087359 /nfs/dbraw/zinc/08/73/59/879087359.db2.gz MTBXJHIMGUVJIC-WMZHIEFXSA-N 0 3 403.530 4.070 20 0 HIADHN CCO[C@@H](C)c1nc(CN(C)C(=O)N[C@@H](CN2CCCC2)c2ccccc2)cs1 ZINC000465598906 879087657 /nfs/dbraw/zinc/08/76/57/879087657.db2.gz MGASHIQVZAQGOV-PXNSSMCTSA-N 0 3 416.591 4.219 20 0 HIADHN CO[C@@H](CNC(=O)N[C@@H](CN1CCCC1)c1ccccc1)c1ccc(Cl)cc1 ZINC000465613354 879111840 /nfs/dbraw/zinc/11/18/40/879111840.db2.gz ZRZHBWUKHKMCRT-SFTDATJTSA-N 0 3 401.938 4.164 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)N[C@H](c2ccc(C(C)C)cc2)C(C)C)CC1 ZINC000465638361 879154502 /nfs/dbraw/zinc/15/45/02/879154502.db2.gz VCJMTPCIAGTNRT-OFNKIYASSA-N 0 3 402.627 4.080 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)c2csc(-c3ccc(F)c(F)c3)n2)o1 ZINC000503425984 912423289 /nfs/dbraw/zinc/42/32/89/912423289.db2.gz GEOSOPQTQSDIIB-UHFFFAOYSA-N 0 3 405.470 4.194 20 0 HIADHN CCc1nc(C)c([C@@H](C)N(C)C(=O)NCC2(N3CCSCC3)CCCC2)s1 ZINC000465652041 879175653 /nfs/dbraw/zinc/17/56/53/879175653.db2.gz HQZPASZLWZDTNM-MRXNPFEDSA-N 0 3 410.653 4.078 20 0 HIADHN C[C@H]1CCN(C(=O)NCc2csc(Br)c2)CCN1Cc1ccccc1 ZINC000465661867 879191488 /nfs/dbraw/zinc/19/14/88/879191488.db2.gz JKYMARCAFJOWDL-HNNXBMFYSA-N 0 3 422.392 4.317 20 0 HIADHN CC[C@H](Cc1ccccc1)N(C)C(=O)NCCCCN1CCN(c2ccccc2)CC1 ZINC000465666394 879200458 /nfs/dbraw/zinc/20/04/58/879200458.db2.gz QMMYQNZMSUIBRZ-XMMPIXPASA-N 0 3 422.617 4.252 20 0 HIADHN CCN(Cc1cccc(-c2ccncc2)c1)C(=O)NCCN(C)Cc1ccccc1 ZINC000465741406 879326237 /nfs/dbraw/zinc/32/62/37/879326237.db2.gz ALVWPSLVIHWLIJ-UHFFFAOYSA-N 0 3 402.542 4.412 20 0 HIADHN Clc1cc(CCN2CCC[C@H](c3ncc4n3CCCC4)C2)cc2c1OCCCO2 ZINC000503436750 912444854 /nfs/dbraw/zinc/44/48/54/912444854.db2.gz OSKDOZIKXSTGSP-SFHVURJKSA-N 0 3 415.965 4.456 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N[C@@H](C)c2cccc(-n3cccn3)c2)C1 ZINC000465758402 879351703 /nfs/dbraw/zinc/35/17/03/879351703.db2.gz PAAQACGYAIQITL-JQVVWYNYSA-N 0 3 403.530 4.068 20 0 HIADHN C[C@@H]1CCN(C(=O)N[C@@H](c2ccccc2)[C@@H]2CCCO2)CCN1Cc1ccccc1 ZINC000465839955 879477438 /nfs/dbraw/zinc/47/74/38/879477438.db2.gz JMQYNIJZTDWAPW-QDSKXPNFSA-N 0 3 407.558 4.213 20 0 HIADHN Cc1ccc(COc2ccc(C[C@@H](C)NC(=O)N3CC[C@@H](N4CC=CC4)C3)cc2)cc1 ZINC000465851395 879493449 /nfs/dbraw/zinc/49/34/49/879493449.db2.gz UPYABSATKHYZMZ-ZJSXRUAMSA-N 0 3 419.569 4.161 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccc(O)cc1)C(=O)c1oc2ccccc2c1COC ZINC000503449509 912470596 /nfs/dbraw/zinc/47/05/96/912470596.db2.gz FAZBNQQWYFHIHI-LJQANCHMSA-N 0 3 422.525 4.412 20 0 HIADHN CCc1nc(C)c([C@H](C)N(C)C(=O)NC[C@H]2CCCN2Cc2ccccc2)s1 ZINC000465943061 879611627 /nfs/dbraw/zinc/61/16/27/879611627.db2.gz ZDDDBRXPYDDGCY-PKOBYXMFSA-N 0 3 400.592 4.381 20 0 HIADHN Cc1ccsc1[C@@H](Cc1ccccc1)NC(=O)N(CCN(C)C)C[C@H]1CCCO1 ZINC000465955254 879622327 /nfs/dbraw/zinc/62/23/27/879622327.db2.gz VXEMEEYFHJGLSB-NHCUHLMSSA-N 0 3 415.603 4.093 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)N[C@H](CC(C)(C)C)c2ccc(Cl)cc2)CC1 ZINC000465964627 879633149 /nfs/dbraw/zinc/63/31/49/879633149.db2.gz GMKBLAZGUQWWJI-WIYYLYMNSA-N 0 3 423.045 4.390 20 0 HIADHN CCCN(C(=O)NCCCCn1ccnc1C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000466011846 879691867 /nfs/dbraw/zinc/69/18/67/879691867.db2.gz QXZYIAXUPQDONG-QHCPKHFHSA-N 0 3 411.594 4.058 20 0 HIADHN COc1ccc([C@@H](NC(=O)N[C@H]2CCN(C3CC3)C2)c2ccccc2Cl)c(C)c1 ZINC000466017431 879700793 /nfs/dbraw/zinc/70/07/93/879700793.db2.gz NGEDCQVPNWLYBV-KSFYIVLOSA-N 0 3 413.949 4.282 20 0 HIADHN COc1ccc([C@@H](C)CCNC(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)cc1 ZINC000466030046 879716097 /nfs/dbraw/zinc/71/60/97/879716097.db2.gz AQRVZXIZVUPFNP-LEWJYISDSA-N 0 3 409.574 4.495 20 0 HIADHN COc1ccccc1[C@]1(C)C[C@@H]1NC(=O)N(CCN(C)C)Cc1cccc(Cl)c1 ZINC000466047655 879736006 /nfs/dbraw/zinc/73/60/06/879736006.db2.gz GXAZRXJJEAIJMV-GMAHTHKFSA-N 0 3 415.965 4.152 20 0 HIADHN COc1ccccc1[C@]1(C)C[C@@H]1NC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C ZINC000466046374 879736874 /nfs/dbraw/zinc/73/68/74/879736874.db2.gz FTPFOJSTOOSEAB-QXWFJRNPSA-N 0 3 407.558 4.031 20 0 HIADHN COc1ccccc1[C@H](NC(=O)N1CCN(C)CC[C@H]1C)c1ccccc1Cl ZINC000466079033 879795288 /nfs/dbraw/zinc/79/52/88/879795288.db2.gz OHHJVRDLEGFQDX-IIBYNOLFSA-N 0 3 401.938 4.174 20 0 HIADHN COc1ccccc1[C@@H](NC(=O)N1CC[C@@H](N2CC=CC2)C1)c1ccccc1Cl ZINC000466079088 879795720 /nfs/dbraw/zinc/79/57/20/879795720.db2.gz OSYRAZKKZXTNDY-VGSWGCGISA-N 0 3 411.933 4.094 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)N[C@H]1CCc2c1cccc2O ZINC000466098225 879816460 /nfs/dbraw/zinc/81/64/60/879816460.db2.gz GOKCCJUAYGHTRI-IBGZPJMESA-N 0 3 421.463 4.172 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccc(O)cc1)C(=O)c1nc(-c2ccccc2)oc1C ZINC000503466201 912499369 /nfs/dbraw/zinc/49/93/69/912499369.db2.gz FOTLBSJJEHMEDS-NRFANRHFSA-N 0 3 419.525 4.482 20 0 HIADHN CCC(CC)c1cc(CNC(=O)Nc2ccc(N3CCN(CC)CC3)cc2C)on1 ZINC000466117085 879830472 /nfs/dbraw/zinc/83/04/72/879830472.db2.gz PQBHDVXKXWLYJA-UHFFFAOYSA-N 0 3 413.566 4.350 20 0 HIADHN CCC(CC)c1cc(CNC(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)on1 ZINC000466122106 879835518 /nfs/dbraw/zinc/83/55/18/879835518.db2.gz ZZDLWPWEEUYKBY-UHFFFAOYSA-N 0 3 408.493 4.130 20 0 HIADHN C[C@@H](CCc1cccn1C)NC(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1 ZINC000466124707 879839027 /nfs/dbraw/zinc/83/90/27/879839027.db2.gz RGHZWIAVMZYZDG-KRWDZBQOSA-N 0 3 424.511 4.138 20 0 HIADHN COc1cccc(F)c1[C@@H](C)NC(=O)N(CCCc1ccccc1)CCN(C)C ZINC000466125850 879839754 /nfs/dbraw/zinc/83/97/54/879839754.db2.gz VMSIWFRMUDOASY-GOSISDBHSA-N 0 3 401.526 4.101 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1C[C@H](C)N(Cc2ccccc2)C1)c1ccc(NC(=O)C2CC2)cc1 ZINC000466214328 879905356 /nfs/dbraw/zinc/90/53/56/879905356.db2.gz BGBGOJMNRYMOLQ-IUKKYPGJSA-N 0 3 420.557 4.058 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1C[C@@H](C)N(Cc2ccccc2)C1)c1ccc(NC(=O)C2CC2)cc1 ZINC000466214327 879906839 /nfs/dbraw/zinc/90/68/39/879906839.db2.gz BGBGOJMNRYMOLQ-IEGUWTFLSA-N 0 3 420.557 4.058 20 0 HIADHN CCCN(C(=O)NCc1ncc(CC)s1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000466331333 880084847 /nfs/dbraw/zinc/08/48/47/880084847.db2.gz QBYOFPISRVIWQQ-LJQANCHMSA-N 0 3 400.592 4.292 20 0 HIADHN CO[C@H](CNC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C)c1cccc(Cl)c1 ZINC000466343847 880101518 /nfs/dbraw/zinc/10/15/18/880101518.db2.gz PSKNVVLDALMJIF-XMSQKQJNSA-N 0 3 415.965 4.334 20 0 HIADHN COc1ccc([C@@H](NC(=O)N2CCCN(C)CC2)c2ccccc2Cl)c(C)c1 ZINC000466368395 880126980 /nfs/dbraw/zinc/12/69/80/880126980.db2.gz JQYCCEXVJBSDMA-OAQYLSRUSA-N 0 3 401.938 4.094 20 0 HIADHN FC(F)(F)C1CCC(CNc2ccc3nc(CCN4CCOCC4)[nH]c3c2)CC1 ZINC000466379335 880140300 /nfs/dbraw/zinc/14/03/00/880140300.db2.gz XUIQABLOMBCIMX-UHFFFAOYSA-N 0 3 410.484 4.218 20 0 HIADHN CCN1CCC[C@@H](CN(C)C(=O)NCC[C@@H](C)c2ccccc2)[C@@H]1c1cnn(C)c1 ZINC000466383212 880142808 /nfs/dbraw/zinc/14/28/08/880142808.db2.gz KWWWDBOKVDQGAS-UNWVZKJWSA-N 0 3 411.594 4.028 20 0 HIADHN CN(C(=O)c1cc(COc2ccccc2F)on1)C1CCN(Cc2ccccc2)CC1 ZINC000466420492 880193023 /nfs/dbraw/zinc/19/30/23/880193023.db2.gz BNAZSCVJRLMTHV-UHFFFAOYSA-N 0 3 423.488 4.129 20 0 HIADHN COc1ccc([C@H](CNC(=O)Nc2ccc(OC)c(Cl)c2)N2CCCC2)cc1 ZINC000503492785 912540972 /nfs/dbraw/zinc/54/09/72/912540972.db2.gz JFVQKMYOQURXQG-IBGZPJMESA-N 0 3 403.910 4.316 20 0 HIADHN Cc1oc2ccccc2c1C(=O)Nc1ccc(C(=O)N(C)[C@H]2CCCN(C)C2)cc1 ZINC000466434903 880209582 /nfs/dbraw/zinc/20/95/82/880209582.db2.gz NQNFPAOWJSUACP-IBGZPJMESA-N 0 3 405.498 4.160 20 0 HIADHN C[C@@H](NC(=O)N(CCN(C)C)CC1CCCCC1)c1nc(-c2cccc(F)c2)no1 ZINC000466465313 880247232 /nfs/dbraw/zinc/24/72/32/880247232.db2.gz PVIQABPVWZQQDY-MRXNPFEDSA-N 0 3 417.529 4.090 20 0 HIADHN CCc1ccc([C@H](NC(=O)CN(C)CCC2CCOCC2)c2cccs2)cc1 ZINC000466471606 880253931 /nfs/dbraw/zinc/25/39/31/880253931.db2.gz UIGWGPCQYHBCLD-QHCPKHFHSA-N 0 3 400.588 4.265 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)N[C@H](c2ccccc2)c2cccnc2)N(C)C)cc1 ZINC000503500411 912548254 /nfs/dbraw/zinc/54/82/54/912548254.db2.gz YCGRLMABWGWNBH-DNQXCXABSA-N 0 3 402.542 4.336 20 0 HIADHN CN(CCC1CCOCC1)CC(=O)NC[C@@H](c1c[nH]c2ccccc21)c1ccccc1 ZINC000466495734 880272399 /nfs/dbraw/zinc/27/23/99/880272399.db2.gz NHCVYFJSLSAXPG-HSZRJFAPSA-N 0 3 419.569 4.165 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)N[C@@H](c1ccccc1)c1cccnc1 ZINC000503503107 912551207 /nfs/dbraw/zinc/55/12/07/912551207.db2.gz MMGFWNRYVRDXBO-UNMCSNQZSA-N 0 3 406.555 4.369 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)Nc2cccc(OC[C@H]3CCCO3)c2)CN1Cc1ccccc1 ZINC000466515627 880289915 /nfs/dbraw/zinc/28/99/15/880289915.db2.gz BZZNXLRUSXYUNC-RZFNWQHOSA-N 0 3 409.530 4.029 20 0 HIADHN CC(=O)Nc1ccc(Cl)c(NC(=O)N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)c1 ZINC000466516008 880291427 /nfs/dbraw/zinc/29/14/27/880291427.db2.gz DRHZQHNGWBSGAK-RDTXWAMCSA-N 0 3 400.910 4.083 20 0 HIADHN Cc1ccc(NC(=O)C(C)C)cc1NC(=O)N[C@H]1C[C@@H](C)N(Cc2ccccc2)C1 ZINC000466518128 880293339 /nfs/dbraw/zinc/29/33/39/880293339.db2.gz LCVIZTDOBJDESV-NQIIRXRSSA-N 0 3 408.546 4.374 20 0 HIADHN C[C@H]1C[C@H](NC(=O)N2CCC(OCc3ccccc3)CC2)CN1Cc1ccccc1 ZINC000466522176 880298438 /nfs/dbraw/zinc/29/84/38/880298438.db2.gz ZVWNLHYGGMEUMU-REWPJTCUSA-N 0 3 407.558 4.040 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)Nc2cccc(C(=O)N3CCCCC3)c2)CN1Cc1ccccc1 ZINC000466523213 880300179 /nfs/dbraw/zinc/30/01/79/880300179.db2.gz VAMYGKVVZWFXOD-AUSIDOKSSA-N 0 3 420.557 4.097 20 0 HIADHN CCOCCOCc1cccc(NC(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)c1 ZINC000466531530 880307158 /nfs/dbraw/zinc/30/71/58/880307158.db2.gz YVVDFEGTUKUNJS-WMZHIEFXSA-N 0 3 411.546 4.024 20 0 HIADHN C[C@H](NC(=O)N[C@H]1C[C@H](C)N(Cc2ccccc2)C1)c1nc(C2CCCCC2)no1 ZINC000466533827 880308428 /nfs/dbraw/zinc/30/84/28/880308428.db2.gz KDQLTYUIDCBMOC-ZWOKBUDYSA-N 0 3 411.550 4.141 20 0 HIADHN CC(C)(C)Oc1ccc(CNC(=O)N2CC[C@@H](N3CC=CC3)C2)c(C(F)(F)F)c1 ZINC000466589097 880360439 /nfs/dbraw/zinc/36/04/39/880360439.db2.gz VYBBNFLQDANKCY-MRXNPFEDSA-N 0 3 411.468 4.038 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)c2cc(COc3ccccc3F)on2)CC1 ZINC000466646954 880422163 /nfs/dbraw/zinc/42/21/63/880422163.db2.gz FJWUXWQZZUYXDD-UHFFFAOYSA-N 0 3 423.488 4.129 20 0 HIADHN C[C@@H](NC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C)c1cccc(-n2cccn2)c1 ZINC000466663291 880445176 /nfs/dbraw/zinc/44/51/76/880445176.db2.gz DHRYHHCJNOYXPB-LEWJYISDSA-N 0 3 417.557 4.239 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)N[C@@H](C)c2cccc(-n3cccn3)c2)c1 ZINC000466697095 880488416 /nfs/dbraw/zinc/48/84/16/880488416.db2.gz PUDLPUSQAFUWDQ-FQEVSTJZSA-N 0 3 405.546 4.015 20 0 HIADHN COC(=O)C1(c2ccccc2)CCN(CCOc2ccc(OC(F)(F)F)cc2)CC1 ZINC000466728939 880514176 /nfs/dbraw/zinc/51/41/76/880514176.db2.gz RBYSTHWQXXFOPE-UHFFFAOYSA-N 0 3 423.431 4.171 20 0 HIADHN CSc1ccc(F)cc1CNC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C ZINC000466799576 880577438 /nfs/dbraw/zinc/57/74/38/880577438.db2.gz FGJXJQAQGLXZMB-KRWDZBQOSA-N 0 3 401.551 4.354 20 0 HIADHN COCCc1ccccc1NC(=O)N[C@@H](CN1CCc2ccccc2C1)C(C)(C)C ZINC000466954949 880737686 /nfs/dbraw/zinc/73/76/86/880737686.db2.gz OWVBSBQLMDDYRB-QHCPKHFHSA-N 0 3 409.574 4.470 20 0 HIADHN C[C@@H](NC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C)c1ccc(-n2cccn2)cc1 ZINC000466956921 880740255 /nfs/dbraw/zinc/74/02/55/880740255.db2.gz COLBVTROMPEALX-LEWJYISDSA-N 0 3 417.557 4.239 20 0 HIADHN O=C(NCCN1CCCCC1)N[C@@H]1CCCc2sc(-c3ccc(F)cc3)nc21 ZINC000466981995 880786843 /nfs/dbraw/zinc/78/68/43/880786843.db2.gz YNYNLXMDQGLAFN-QGZVFWFLSA-N 0 3 402.539 4.112 20 0 HIADHN COc1ccc(C)cc1NC(=O)[C@H](NC[C@@]1(C)CCO[C@@H]1C1CC1)c1ccccc1 ZINC000467001886 880811623 /nfs/dbraw/zinc/81/16/23/880811623.db2.gz NIJSWCXWGVPVMK-VDKIKQQVSA-N 0 3 408.542 4.478 20 0 HIADHN C[C@@H](NC(=O)N[C@@H](C)c1nc(C(F)(F)F)cs1)[C@H](c1ccccc1)N(C)C ZINC000503546107 912609335 /nfs/dbraw/zinc/60/93/35/912609335.db2.gz FAQTZLSEVBQOQS-TYNCELHUSA-N 0 3 400.470 4.214 20 0 HIADHN C[C@H](NC(=O)N1CCN(CC2CCCCC2)CC1)c1nc(C2CCCCC2)no1 ZINC000467029793 880829678 /nfs/dbraw/zinc/82/96/78/880829678.db2.gz XBKHDMUVPBBILD-KRWDZBQOSA-N 0 3 403.571 4.086 20 0 HIADHN Cc1ccc(-c2cnc(CCC(=O)N[C@H]3C[C@@H](C)N(Cc4ccccc4)C3)o2)cc1 ZINC000467033929 880831899 /nfs/dbraw/zinc/83/18/99/880831899.db2.gz CYCDUZNTBGVQFB-KNQAVFIVSA-N 0 3 403.526 4.362 20 0 HIADHN Cc1nc(COc2cccc(C(=O)N[C@@H]3C[C@H](C)N(Cc4ccccc4)C3)c2)cs1 ZINC000467034535 880832609 /nfs/dbraw/zinc/83/26/09/880832609.db2.gz PJIUYYOBNALTKS-LAUBAEHRSA-N 0 3 421.566 4.423 20 0 HIADHN Cc1noc(CSc2ccccc2C(=O)N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)n1 ZINC000467046189 880840602 /nfs/dbraw/zinc/84/06/02/880840602.db2.gz NHPCQELJWSPCEO-LPHOPBHVSA-N 0 3 422.554 4.063 20 0 HIADHN C[C@H](SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)N[C@@H]1CN(C2CC2)C[C@@H]1C ZINC000467049224 880841290 /nfs/dbraw/zinc/84/12/90/880841290.db2.gz XEOJZZKCBUPSLN-SUNYJGFJSA-N 0 3 419.978 4.216 20 0 HIADHN C[C@H]1C[C@H](NC(=O)c2cccc(OCc3cscn3)c2)CN1Cc1ccccc1 ZINC000467052669 880843412 /nfs/dbraw/zinc/84/34/12/880843412.db2.gz AUXCEEPFELUATP-PXNSSMCTSA-N 0 3 407.539 4.115 20 0 HIADHN C[C@@H](NC(=O)N1CCC[C@@H]1c1cc(F)cc(Br)c1)C1=CCN(C)CC1 ZINC000467214951 880944395 /nfs/dbraw/zinc/94/43/95/880944395.db2.gz DWOUNSYVMMSVQM-FZKQIMNGSA-N 0 3 410.331 4.085 20 0 HIADHN CC[C@@H](Cc1cccc(Br)c1)C(=O)N(CCN(C)C)Cc1ccccn1 ZINC000467262909 881001791 /nfs/dbraw/zinc/00/17/91/881001791.db2.gz KYAJZKCOCCXWKL-SFHVURJKSA-N 0 3 418.379 4.003 20 0 HIADHN COCC[C@@H]1CCCCN(CC(=O)N[C@@H](c2cccs2)c2ccc(F)cc2)C1 ZINC000467272705 881013942 /nfs/dbraw/zinc/01/39/42/881013942.db2.gz HAOIZWBURXZBFP-HTAPYJJXSA-N 0 3 404.551 4.231 20 0 HIADHN COCC[C@@H]1CCCCN(CC(=O)N[C@@H](c2cccs2)c2ccc(C)cc2)C1 ZINC000467278454 881023456 /nfs/dbraw/zinc/02/34/56/881023456.db2.gz KSEWNLXNZHEDRD-WMZHIEFXSA-N 0 3 400.588 4.401 20 0 HIADHN CN(CCCc1ccncc1)Cc1cccc(Br)c1OCC(C)(C)O ZINC000467281920 881028653 /nfs/dbraw/zinc/02/86/53/881028653.db2.gz YIFWWWWJMZPEMP-UHFFFAOYSA-N 0 3 407.352 4.058 20 0 HIADHN Brc1cccc(CN(Cc2cnc3ccccn23)C2CCOCC2)c1 ZINC000467301308 881048918 /nfs/dbraw/zinc/04/89/18/881048918.db2.gz LQLUQJNFOLZADN-UHFFFAOYSA-N 0 3 400.320 4.278 20 0 HIADHN COC(=O)c1cc(CN(Cc2cccc(Br)c2)C2CCOCC2)oc1C ZINC000467301890 881051180 /nfs/dbraw/zinc/05/11/80/881051180.db2.gz SOLWCWUXGHCBCW-UHFFFAOYSA-N 0 3 422.319 4.318 20 0 HIADHN O=S(=O)(CCO)c1ccc(CN[C@H](c2ccc(Cl)cc2)C2CCCC2)cc1 ZINC000467357199 881120965 /nfs/dbraw/zinc/12/09/65/881120965.db2.gz HKHIAKLBWTVQLQ-NRFANRHFSA-N 0 3 407.963 4.127 20 0 HIADHN CN(Cc1ccccc1Br)C(=O)CCN[C@@H](c1cncc(F)c1)C1CC1 ZINC000467379599 881157880 /nfs/dbraw/zinc/15/78/80/881157880.db2.gz ANTLCIPJAPPXIB-HXUWFJFHSA-N 0 3 420.326 4.073 20 0 HIADHN CSc1cnn(-c2ccccc2)c1NC(=O)N(CCN(C)C)Cc1ccccc1 ZINC000467395099 881178259 /nfs/dbraw/zinc/17/82/59/881178259.db2.gz RLAOHKYMMUAQTC-UHFFFAOYSA-N 0 3 409.559 4.190 20 0 HIADHN COc1ccc2c(c1)[C@@H](NCCNC(=O)c1ccc(Br)cc1)CCS2 ZINC000467401334 881186044 /nfs/dbraw/zinc/18/60/44/881186044.db2.gz OOSHXOPDZRNNNI-KRWDZBQOSA-N 0 3 421.360 4.014 20 0 HIADHN CC(C)(C)OC(=O)Cc1ccccc1NC(=O)NCCCN1CCc2ccccc2C1 ZINC000467403947 881190296 /nfs/dbraw/zinc/19/02/96/881190296.db2.gz XQHTTZDAIQXYFA-UHFFFAOYSA-N 0 3 423.557 4.141 20 0 HIADHN C[C@@H](CCN[C@@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl)c1ccccc1 ZINC000467406039 881192183 /nfs/dbraw/zinc/19/21/83/881192183.db2.gz OQQXCHJQXVNETQ-STQMWFEESA-N 0 3 401.359 4.485 20 0 HIADHN CC[C@@H](NCc1cc(Cl)ccc1N1CCOCC1)c1ccc2c(c1)OCCO2 ZINC000467407266 881192216 /nfs/dbraw/zinc/19/22/16/881192216.db2.gz SJRKCSHTYGRWKL-LJQANCHMSA-N 0 3 402.922 4.189 20 0 HIADHN Clc1ccc(N2CCOCC2)c(CN[C@H](C[C@H]2CCOC2)c2ccccc2)c1 ZINC000467410749 881197115 /nfs/dbraw/zinc/19/71/15/881197115.db2.gz KFBGQRCJRBZYCC-XMSQKQJNSA-N 0 3 400.950 4.434 20 0 HIADHN CC(C)(C)OC(=O)Cc1ccccc1NC(=O)NC[C@H]1CCCN1Cc1ccccc1 ZINC000467427811 881218030 /nfs/dbraw/zinc/21/80/30/881218030.db2.gz ICWYRMCUMJEZBG-OAQYLSRUSA-N 0 3 423.557 4.357 20 0 HIADHN CC(C)(C)OC(=O)Cc1ccccc1NC(=O)NC[C@@H]1CCCN1Cc1ccccc1 ZINC000467427810 881218985 /nfs/dbraw/zinc/21/89/85/881218985.db2.gz ICWYRMCUMJEZBG-NRFANRHFSA-N 0 3 423.557 4.357 20 0 HIADHN Cc1cc(Cl)ccc1S(=O)(=O)[N-]c1ccc(OCC[NH+](C)C)c(Cl)c1 ZINC000467438583 881237192 /nfs/dbraw/zinc/23/71/92/881237192.db2.gz HIFPDBJILVTQFV-UHFFFAOYSA-N 0 3 403.331 4.043 20 0 HIADHN Cc1ccnc(Oc2ccc(NC(=O)N[C@H]3C[C@@H](C)N(Cc4ccccc4)C3)cc2)n1 ZINC000467478963 881301190 /nfs/dbraw/zinc/30/11/90/881301190.db2.gz VXTZCWYZHOMNIB-NQIIRXRSSA-N 0 3 417.513 4.362 20 0 HIADHN O=C(CSc1ccc2ccccc2c1)NCc1ccccc1CN1CCC(O)CC1 ZINC000467497306 881315545 /nfs/dbraw/zinc/31/55/45/881315545.db2.gz VZZMSAQVACJWOK-UHFFFAOYSA-N 0 3 420.578 4.205 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)c1ccc(S(=O)(=O)c2ccccc2)s1 ZINC000467519013 881334403 /nfs/dbraw/zinc/33/44/03/881334403.db2.gz HFFXRFIFRFIJFC-UHFFFAOYSA-N 0 3 414.552 4.203 20 0 HIADHN COc1ccccc1[C@@H](C)NC(=O)[C@H](C)N(C)CCCc1cc(-c2ccccc2)n[nH]1 ZINC000503594277 912680229 /nfs/dbraw/zinc/68/02/29/912680229.db2.gz LTKWBSQQNJTAHZ-MOPGFXCFSA-N 0 3 420.557 4.216 20 0 HIADHN Cc1nc2c(s1)CCC[C@@H]2C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000469103736 883194464 /nfs/dbraw/zinc/19/44/64/883194464.db2.gz WUUIZCIXJWOHBD-SFHVURJKSA-N 0 3 401.601 4.101 20 0 HIADHN Cc1c([C@@H](C)NCCC(=O)N(C)Cc2ccccc2Br)cnn1C(C)C ZINC000469114602 883208288 /nfs/dbraw/zinc/20/82/88/883208288.db2.gz OYQDSTRDVNJSEL-OAHLLOKOSA-N 0 3 421.383 4.234 20 0 HIADHN CCOC(=O)c1csc(CCN[C@@H](c2ccc(F)cc2)c2ccc(OC)cc2)n1 ZINC000469124770 883220072 /nfs/dbraw/zinc/22/00/72/883220072.db2.gz HARIGQKFUSHQNT-NRFANRHFSA-N 0 3 414.502 4.389 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3CC[C@H](C(F)(F)F)C3(C)C)c(C)c2)CC1 ZINC000469153468 883249745 /nfs/dbraw/zinc/24/97/45/883249745.db2.gz UDMUZJFQFLCXAZ-SFHVURJKSA-N 0 3 412.500 4.332 20 0 HIADHN C[C@H](N[C@@H]1CCCN(Cc2ccc(F)cc2F)C1=O)c1cccc(N2CCCC2)c1 ZINC000469164054 883261736 /nfs/dbraw/zinc/26/17/36/883261736.db2.gz ZXCIWEUYGGBHRR-GAJHUEQPSA-N 0 3 413.512 4.407 20 0 HIADHN CC[C@@H]1C[C@@H](CN[C@@H](c2cccc(S(C)(=O)=O)c2)c2ccc(F)c(F)c2)CCO1 ZINC000503602015 912693442 /nfs/dbraw/zinc/69/34/42/912693442.db2.gz JRJIOERMAPRUEB-REDKUUPNSA-N 0 3 423.525 4.253 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCC(OC(C)(C)C)CC1)c1cccc(OC)c1 ZINC000469245255 883343263 /nfs/dbraw/zinc/34/32/63/883343263.db2.gz JJRFDSQXEJNOHJ-OAQYLSRUSA-N 0 3 405.583 4.067 20 0 HIADHN COc1cccc([C@H](C)CCCC(=O)N2CCC(CN3C[C@@H](C)O[C@H](C)C3)CC2)c1 ZINC000469318126 883419803 /nfs/dbraw/zinc/41/98/03/883419803.db2.gz XBWFSHWSBRGLIF-NJDAHSKKSA-N 0 3 416.606 4.317 20 0 HIADHN CC1CCN([C@H](CNC(=O)c2ccc(O[C@@H]3CCOC3)cc2)c2ccccc2)CC1 ZINC000469335543 883447067 /nfs/dbraw/zinc/44/70/67/883447067.db2.gz KNKDCPBMTSGRRQ-DNQXCXABSA-N 0 3 408.542 4.057 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)c1c(F)ccc(Br)c1F ZINC000469424730 883604434 /nfs/dbraw/zinc/60/44/34/883604434.db2.gz RKTDANRIQKPERE-AWEZNQCLSA-N 0 3 409.274 4.122 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)NCc1ncoc1-c1ccccc1 ZINC000469430316 883612906 /nfs/dbraw/zinc/61/29/06/883612906.db2.gz PFKOCPNXJRTJIQ-QFIPXVFZSA-N 0 3 406.530 4.297 20 0 HIADHN CC(C)NC(=O)Cc1ccc(NC(=O)N[C@H](CN(C)Cc2ccccc2)C(C)C)cc1 ZINC000469467907 883689764 /nfs/dbraw/zinc/68/97/64/883689764.db2.gz CEGWWCRBPLNCHS-HSZRJFAPSA-N 0 3 424.589 4.032 20 0 HIADHN COc1cccc(COC[C@@H](O)CN2CCC(=Cc3ccc(F)c(F)c3)CC2)c1 ZINC000469470657 883696287 /nfs/dbraw/zinc/69/62/87/883696287.db2.gz NENDCQGKUTYWAW-FQEVSTJZSA-N 0 3 403.469 4.030 20 0 HIADHN CCc1c(NC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)cnn1-c1ccccc1 ZINC000469493222 883733637 /nfs/dbraw/zinc/73/36/37/883733637.db2.gz COJQLJZOVYSJNS-IBGZPJMESA-N 0 3 406.505 4.425 20 0 HIADHN COc1cc(Cl)c(C(=O)N[C@H](CN(C)Cc2ccccc2)C(C)C)cc1OC ZINC000469505303 883754366 /nfs/dbraw/zinc/75/43/66/883754366.db2.gz RCQDMBCRAXQNQM-LJQANCHMSA-N 0 3 404.938 4.244 20 0 HIADHN COc1ccc(CNC[C@H](c2cccc(C(F)(F)F)c2)N(C)C)c(OC)c1OC ZINC000469564482 883815858 /nfs/dbraw/zinc/81/58/58/883815858.db2.gz ZECBYYXNJYNHMM-QGZVFWFLSA-N 0 3 412.452 4.124 20 0 HIADHN Cc1[nH]cnc1CC(=O)N[C@H](c1ccccc1)c1ccc(Br)cc1F ZINC000469563176 883816043 /nfs/dbraw/zinc/81/60/43/883816043.db2.gz DEMLEQZRRFHLCS-LJQANCHMSA-N 0 3 402.267 4.068 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)N3C[C@H](C)C[C@@H]3c3cccc(F)c3)CC2)c1 ZINC000469568285 883817461 /nfs/dbraw/zinc/81/74/61/883817461.db2.gz FGJUQYSDAKTJJL-HYBUGGRVSA-N 0 3 409.549 4.256 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N(C[C@@H]3CCCO3)C3CCC(C)CC3)cc2)CC1 ZINC000469627019 883839737 /nfs/dbraw/zinc/83/97/37/883839737.db2.gz GQADMMHZPSWFAF-BOYUCYPVSA-N 0 3 413.606 4.028 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N3C[C@H](c4cc(C)ccc4C)OC[C@H]3C)cc2)CC1 ZINC000469636514 883843753 /nfs/dbraw/zinc/84/37/53/883843753.db2.gz ZTIFMDBPLFSAAK-PXDATVDWSA-N 0 3 421.585 4.048 20 0 HIADHN COC(=O)c1ccccc1-c1ccccc1C(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000469687816 883871249 /nfs/dbraw/zinc/87/12/49/883871249.db2.gz OMBGGKNLNAZEPM-RPWUZVMVSA-N 0 3 414.505 4.315 20 0 HIADHN CC1CCN(c2cccc(NC(=O)CCN3CCN(c4ccccc4)CC3)c2)CC1 ZINC000469700935 883878690 /nfs/dbraw/zinc/87/86/90/883878690.db2.gz XURYSIDUABWBOL-UHFFFAOYSA-N 0 3 406.574 4.074 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)c1cccc(NC(=O)c2ccco2)c1 ZINC000469746316 883902895 /nfs/dbraw/zinc/90/28/95/883902895.db2.gz WJTVPFDMCDMEOW-QFIPXVFZSA-N 0 3 419.525 4.418 20 0 HIADHN COc1cc(Br)ccc1[C@@H](C)NC[C@@H](O)COc1cccc2[nH]ccc21 ZINC000469751336 883911748 /nfs/dbraw/zinc/91/17/48/883911748.db2.gz INOWYSSTXQOBQN-UKRRQHHQSA-N 0 3 419.319 4.030 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)NCCc1ccc(F)cc1Cl ZINC000503662965 912767845 /nfs/dbraw/zinc/76/78/45/912767845.db2.gz LJZHSKUYKGFGEO-UHFFFAOYSA-N 0 3 413.871 4.073 20 0 HIADHN C[C@H]1C[C@@H](N(C)C(=O)CCC(=O)c2ccc(Cl)cn2)CCN1Cc1ccccc1 ZINC000469808646 883982212 /nfs/dbraw/zinc/98/22/12/883982212.db2.gz KIOBLXGTKVMPKA-PXNSSMCTSA-N 0 3 413.949 4.209 20 0 HIADHN CC(C)(C)OCc1ccccc1C(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000469840089 884020493 /nfs/dbraw/zinc/02/04/93/884020493.db2.gz GBWNJLBERRJMEN-QFIPXVFZSA-N 0 3 410.558 4.023 20 0 HIADHN O=C(NC[C@H]1CN(Cc2ccccc2)CCCO1)C1(c2ccc(F)cc2)CCCC1 ZINC000469841852 884025094 /nfs/dbraw/zinc/02/50/94/884025094.db2.gz MBOAUAXPWIVHCK-QHCPKHFHSA-N 0 3 410.533 4.045 20 0 HIADHN Cc1nc2c(s1)CCC[C@H]2C(=O)Nc1cc(C)cc(N2CCN(C(C)C)CC2)c1 ZINC000469849584 884032772 /nfs/dbraw/zinc/03/27/72/884032772.db2.gz BDLRRAXQXVJSOL-HXUWFJFHSA-N 0 3 412.603 4.349 20 0 HIADHN COc1ccc2sc(C(=O)NC[C@H]3CN(Cc4ccccc4)CCCO3)c(C)c2c1 ZINC000469854449 884039998 /nfs/dbraw/zinc/03/99/98/884039998.db2.gz MISPTNRARCDORI-FQEVSTJZSA-N 0 3 424.566 4.239 20 0 HIADHN C[C@@H](C(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1)c1ccc2ccccc2c1 ZINC000469862085 884049424 /nfs/dbraw/zinc/04/94/24/884049424.db2.gz LKIIEYCCLDZFTJ-NLFFAJNJSA-N 0 3 402.538 4.351 20 0 HIADHN O=C(CC1CCC(C(F)(F)F)CC1)NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000469863433 884051522 /nfs/dbraw/zinc/05/15/22/884051522.db2.gz GXXNAFUIMGPXQO-LYBXBRPPSA-N 0 3 412.496 4.153 20 0 HIADHN CC1CCN([C@H](CNC(=O)N2CC[C@H](C)[C@@H](n3ccnc3)C2)c2cccs2)CC1 ZINC000469863828 884053906 /nfs/dbraw/zinc/05/39/06/884053906.db2.gz SYJYWSBUGMXJME-ZCNNSNEGSA-N 0 3 415.607 4.010 20 0 HIADHN Cc1c(NC(=O)[C@@H](C)N2CCCC3(CCCCC3)CC2)c(=O)n(-c2ccccc2)n1C ZINC000469866405 884055214 /nfs/dbraw/zinc/05/52/14/884055214.db2.gz QBMNDKFXQQJAEQ-HXUWFJFHSA-N 0 3 424.589 4.248 20 0 HIADHN CC(C)C[C@@H](C)n1nccc1NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000469900200 884091135 /nfs/dbraw/zinc/09/11/35/884091135.db2.gz MYERUVWFBFUXEE-ODIFPOPNSA-N 0 3 415.504 4.417 20 0 HIADHN Cc1c(NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cnn1CCC(C)C ZINC000469905200 884094829 /nfs/dbraw/zinc/09/48/29/884094829.db2.gz HGCIGEPBDZGHQH-UHFFFAOYSA-N 0 3 415.504 4.164 20 0 HIADHN O=C(Nc1cc(C(F)(F)F)ccn1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000469910321 884100391 /nfs/dbraw/zinc/10/03/91/884100391.db2.gz WBBGJUWTZRVLFI-UHFFFAOYSA-N 0 3 410.362 4.027 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)N[C@H](c2nc3ccccc3[nH]2)C(C)C)N(C)C)cc1 ZINC000503682239 912789523 /nfs/dbraw/zinc/78/95/23/912789523.db2.gz RIGMCUXZMXBDEW-YADHBBJMSA-N 0 3 407.562 4.425 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCCCSc3ccccc3)c(C)c2)CC1 ZINC000503686868 912793001 /nfs/dbraw/zinc/79/30/01/912793001.db2.gz XLRBDYHYJDAMBZ-UHFFFAOYSA-N 0 3 412.603 4.441 20 0 HIADHN CN(C)CCN(C(=O)CCc1nnc(-c2ccc(Cl)cc2)o1)C1CCCCC1 ZINC000469957441 884162086 /nfs/dbraw/zinc/16/20/86/884162086.db2.gz NQTIFOKKASQUEG-UHFFFAOYSA-N 0 3 404.942 4.046 20 0 HIADHN CCN(CC)CC(=O)N[C@@H](C)c1sc(-c2ccccc2Br)nc1C ZINC000503696041 912800999 /nfs/dbraw/zinc/80/09/99/912800999.db2.gz CTGWTHQIWLKBAZ-LBPRGKRZSA-N 0 3 410.381 4.400 20 0 HIADHN C[C@@H](NC(=O)N[C@@H](CN1CCCC1)c1ccccc1)c1ccccc1-n1cccn1 ZINC000470063204 884315835 /nfs/dbraw/zinc/31/58/35/884315835.db2.gz VWAWRWHUXOMLLT-KNQAVFIVSA-N 0 3 403.530 4.070 20 0 HIADHN C[C@H](NC(=O)Nc1ccc(OC(F)(F)F)c(Br)c1)C1=CCN(C)CC1 ZINC000470112359 884372420 /nfs/dbraw/zinc/37/24/20/884372420.db2.gz NBDMOLRCRFWAEZ-JTQLQIEISA-N 0 3 422.245 4.120 20 0 HIADHN Cc1nc2c(cnn2C(C)C)cc1C(=O)N[C@H](CN(C)Cc1ccccc1)C(C)C ZINC000470161073 884436060 /nfs/dbraw/zinc/43/60/60/884436060.db2.gz LPHNUXODKZUOQY-JOCHJYFZSA-N 0 3 407.562 4.207 20 0 HIADHN O=C(NC[C@H]1CCCCN1C1CC1)c1cc(Br)sc1Br ZINC000470162630 884438068 /nfs/dbraw/zinc/43/80/68/884438068.db2.gz DZMLFRXOLLZDJH-SNVBAGLBSA-N 0 3 422.186 4.020 20 0 HIADHN Cc1onc(-c2ccc(C(F)(F)F)cc2)c1C(=O)NC[C@H]1CCCCN1C1CC1 ZINC000470181178 884469303 /nfs/dbraw/zinc/46/93/03/884469303.db2.gz ZJTXFXZHIFNBSU-QGZVFWFLSA-N 0 3 407.436 4.416 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N[C@H](C)c3ccc(-c4ccncc4)cc3)cc2)CC1 ZINC000470196155 884504327 /nfs/dbraw/zinc/50/43/27/884504327.db2.gz SJRVMYHXUICJKW-HXUWFJFHSA-N 0 3 414.553 4.382 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2ccccc2O[C@@H]2CCOC2)N2CCCC2)cc1 ZINC000470261851 884607516 /nfs/dbraw/zinc/60/75/16/884607516.db2.gz WMVMVUKEVZOIBR-IRLDBZIGSA-N 0 3 409.530 4.121 20 0 HIADHN C[C@H](CO)N1CCCN(C(=O)Nc2ccc(Oc3cccc(Cl)c3)cc2)CC1 ZINC000470343966 884734594 /nfs/dbraw/zinc/73/45/94/884734594.db2.gz JHROVGXYSKBNPY-MRXNPFEDSA-N 0 3 403.910 4.053 20 0 HIADHN C[C@H]1CCC[C@H]1CC(=O)NC1CCN(CCOc2ccc(Br)cc2)CC1 ZINC000470360158 884751809 /nfs/dbraw/zinc/75/18/09/884751809.db2.gz YFGXRYVTBSJDJB-IRXDYDNUSA-N 0 3 423.395 4.235 20 0 HIADHN C[C@H](CO)N1CCCN(C(=O)Nc2cccc(CSCc3ccccc3)c2)CC1 ZINC000470368343 884763239 /nfs/dbraw/zinc/76/32/39/884763239.db2.gz YTAKUNLLIXIELZ-LJQANCHMSA-N 0 3 413.587 4.040 20 0 HIADHN C[C@@H]1CN(C[C@H]2CCCN2Cc2cc(Br)cc3cccnc32)C[C@@H](C)O1 ZINC000470369686 884764258 /nfs/dbraw/zinc/76/42/58/884764258.db2.gz PLOCEYMQYKDOGH-JXXFODFXSA-N 0 3 418.379 4.071 20 0 HIADHN COc1ccc(NC(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)c(C)n1 ZINC000470397612 884803134 /nfs/dbraw/zinc/80/31/34/884803134.db2.gz LIEULDOFZVRVRN-UHFFFAOYSA-N 0 3 410.440 4.013 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(Oc2ccc(Br)cc2)cc1)C(=O)NCCF ZINC000503920824 912865151 /nfs/dbraw/zinc/86/51/51/912865151.db2.gz PLPDCNGQXVZODW-UONOGXRCSA-N 0 3 409.299 4.366 20 0 HIADHN O[C@H](COCc1cccs1)CN1CC[C@H](Oc2ccc(Cl)c(Cl)c2)C1 ZINC000470568157 884984875 /nfs/dbraw/zinc/98/48/75/884984875.db2.gz FAMPIYUYJXEHGL-ZFWWWQNUSA-N 0 3 402.343 4.086 20 0 HIADHN COc1ccc(C(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)cc1OC(F)F ZINC000470654020 885074638 /nfs/dbraw/zinc/07/46/38/885074638.db2.gz NEHXNKPYFIHNRV-GOSISDBHSA-N 0 3 404.457 4.033 20 0 HIADHN Cc1ccc(C)n1-c1nc(CC(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)cs1 ZINC000470653970 885075025 /nfs/dbraw/zinc/07/50/25/885075025.db2.gz MGMOMCLGNXEWJC-JOCHJYFZSA-N 0 3 422.598 4.216 20 0 HIADHN Cc1cc(C)n(-c2ccc(C(=O)N(C)[C@H]3CCCN(Cc4ccccc4)C3)cc2)n1 ZINC000470664070 885090221 /nfs/dbraw/zinc/09/02/21/885090221.db2.gz ULKIZIPVEHPXIY-DEOSSOPVSA-N 0 3 402.542 4.226 20 0 HIADHN CN(C(=O)c1ccnc(OCc2ccccc2)c1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470667900 885096538 /nfs/dbraw/zinc/09/65/38/885096538.db2.gz MDNACAZYEFRDCC-XMMPIXPASA-N 0 3 415.537 4.397 20 0 HIADHN CN(C(=O)Cc1ccc(OC(F)(F)F)cc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470676123 885106055 /nfs/dbraw/zinc/10/60/55/885106055.db2.gz YALYAWDUJQXTSL-IBGZPJMESA-N 0 3 406.448 4.251 20 0 HIADHN CN(C(=O)Cc1csc(Cc2ccccc2)n1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470675724 885106930 /nfs/dbraw/zinc/10/69/30/885106930.db2.gz UBJLIMMGIOAWDF-QHCPKHFHSA-N 0 3 419.594 4.399 20 0 HIADHN CC1CCN(c2ccc(C(=O)N(C)[C@H]3CCCN(Cc4ccccc4)C3)cn2)CC1 ZINC000470678942 885110588 /nfs/dbraw/zinc/11/05/88/885110588.db2.gz RVYMOPQIXUTHTQ-QHCPKHFHSA-N 0 3 406.574 4.055 20 0 HIADHN CN(C(=O)NCc1csc(Br)c1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470727925 885179128 /nfs/dbraw/zinc/17/91/28/885179128.db2.gz XCUVHZZHHMIJKF-QGZVFWFLSA-N 0 3 422.392 4.317 20 0 HIADHN COc1ccccc1C1(CNC(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)CC1 ZINC000470733108 885187410 /nfs/dbraw/zinc/18/74/10/885187410.db2.gz PQTNZQVNSPJCLI-OAQYLSRUSA-N 0 3 407.558 4.033 20 0 HIADHN CO[C@@H](CNC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1)c1cccc(Cl)c1 ZINC000470885920 885379590 /nfs/dbraw/zinc/37/95/90/885379590.db2.gz JEGYKSCXMIJNOU-YADHBBJMSA-N 0 3 415.965 4.334 20 0 HIADHN CN(C(=O)NCc1coc(-c2ccccc2)n1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470888188 885384084 /nfs/dbraw/zinc/38/40/84/885384084.db2.gz KCLFNFCKBMHNJJ-JOCHJYFZSA-N 0 3 404.514 4.148 20 0 HIADHN C[C@@H]1CN(C(=O)NC[C@H](c2cccs2)N2CCCC2)C[C@@H](c2ccsc2)O1 ZINC000470897082 885396117 /nfs/dbraw/zinc/39/61/17/885396117.db2.gz KCJFGQHGVMHJSP-NXHRZFHOSA-N 0 3 405.589 4.118 20 0 HIADHN O=C(NCCN1CCCC1)c1ccc(NC(=O)c2cc(F)ccc2-c2ccoc2)cc1 ZINC000470950615 885449428 /nfs/dbraw/zinc/44/94/28/885449428.db2.gz YOJYINDOFWRZRY-UHFFFAOYSA-N 0 3 421.472 4.164 20 0 HIADHN CN1CCN(CC(=O)N[C@@H](c2ccc(F)cc2)C2CCCC2)C2(CCCCC2)C1 ZINC000471036650 885545162 /nfs/dbraw/zinc/54/51/62/885545162.db2.gz CXEYBYKMPJSNOB-HSZRJFAPSA-N 0 3 401.570 4.124 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1cccc2oc(C)nc21 ZINC000471046528 885558527 /nfs/dbraw/zinc/55/85/27/885558527.db2.gz GWUSAAZBKNMBEF-IBGZPJMESA-N 0 3 415.497 4.340 20 0 HIADHN Cn1cc(Nc2cccc(NC(=O)[C@H]3CCCN(Cc4cccc(F)c4)C3)c2)cn1 ZINC000471114110 885650074 /nfs/dbraw/zinc/65/00/74/885650074.db2.gz RBHMEYZFNLYFNE-SFHVURJKSA-N 0 3 407.493 4.154 20 0 HIADHN O=C(Nc1ccc(OC(F)F)cc1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000471118905 885654804 /nfs/dbraw/zinc/65/48/04/885654804.db2.gz LZSNEKOFRJVYAM-UHFFFAOYSA-N 0 3 407.383 4.215 20 0 HIADHN C[C@@H](NC(=O)C1(c2ccccc2Cl)CCOCC1)[C@H](c1ccccc1)N(C)C ZINC000471127469 885665011 /nfs/dbraw/zinc/66/50/11/885665011.db2.gz NOTBTQXJYKAWRN-DYESRHJHSA-N 0 3 400.950 4.196 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3ccc(OC)c(F)c3)c(OCC)c2)CC1 ZINC000471161162 885715757 /nfs/dbraw/zinc/71/57/57/885715757.db2.gz OBGDBKXOEHMTSI-UHFFFAOYSA-N 0 3 415.509 4.017 20 0 HIADHN CSc1nc(C(C)(C)C)nc(C)c1C(=O)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000471173083 885732426 /nfs/dbraw/zinc/73/24/26/885732426.db2.gz OUHWAUOBPPFJMH-SFHVURJKSA-N 0 3 412.603 4.371 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)c3cc(C)sc3Br)cc2)CC1 ZINC000471214944 885788063 /nfs/dbraw/zinc/78/80/63/885788063.db2.gz GDXXLAIBBGCPTL-UHFFFAOYSA-N 0 3 422.392 4.209 20 0 HIADHN CN(CCCCOc1cccc(C(F)(F)F)c1)[C@@H]1CCCC[C@@H]1S(C)(=O)=O ZINC000471241284 885818714 /nfs/dbraw/zinc/81/87/14/885818714.db2.gz FHWLBRNVKHUURX-MSOLQXFVSA-N 0 3 407.498 4.152 20 0 HIADHN CC(=O)Nc1cc(C(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)cc(C(F)(F)F)c1 ZINC000471333791 885934747 /nfs/dbraw/zinc/93/47/47/885934747.db2.gz ZLVJCEVHQAMRPY-AUUYWEPGSA-N 0 3 419.447 4.229 20 0 HIADHN CC[C@H](CNC(=O)Nc1cccc(NC(=O)N(C)C)c1C)N1CCc2ccccc2C1 ZINC000471354269 885972735 /nfs/dbraw/zinc/97/27/35/885972735.db2.gz HIVUSBCOCZTOIV-HXUWFJFHSA-N 0 3 423.561 4.047 20 0 HIADHN CN(C)CCN(C(=O)Nc1cccc(CCC(=O)OC(C)(C)C)c1)C1CCCC1 ZINC000471359474 885983119 /nfs/dbraw/zinc/98/31/19/885983119.db2.gz XJZHKCRCJLSPKR-UHFFFAOYSA-N 0 3 403.567 4.299 20 0 HIADHN Cc1c(NC(=O)N(C)C)cccc1NC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000471364501 885994801 /nfs/dbraw/zinc/99/48/01/885994801.db2.gz ZMUZIDPTYLTVGK-FQEVSTJZSA-N 0 3 423.561 4.217 20 0 HIADHN COc1cccc([C@H](CNC(=O)N[C@@H]2CCSc3ccccc32)N2CCCC2)c1 ZINC000504087517 912995486 /nfs/dbraw/zinc/99/54/86/912995486.db2.gz NZAPDHKGJLXDSE-RTWAWAEBSA-N 0 3 411.571 4.368 20 0 HIADHN Cc1c(NC(=O)NC[C@@H](c2ccccc2)N2CCCC2)cccc1NC(=O)N(C)C ZINC000471373263 886013853 /nfs/dbraw/zinc/01/38/53/886013853.db2.gz LSUJHBQMYJPPFH-NRFANRHFSA-N 0 3 409.534 4.047 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2cccc(NC(=O)N(C)C)c2C)N2CCCC2)cc1 ZINC000471377489 886021818 /nfs/dbraw/zinc/02/18/18/886021818.db2.gz WNHAENKBMXCCBQ-QFIPXVFZSA-N 0 3 423.561 4.356 20 0 HIADHN O=C(c1csc(Cc2cccc(F)c2)n1)N1C[C@@H]2CCCN2Cc2ccccc21 ZINC000504089492 913000908 /nfs/dbraw/zinc/00/09/08/913000908.db2.gz GZZDRVLRARTUJP-IBGZPJMESA-N 0 3 407.514 4.498 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)Nc2cc(-c3ccccc3)ccc2Cl)CC1 ZINC000471398451 886047027 /nfs/dbraw/zinc/04/70/27/886047027.db2.gz NHUKPWNLGKTKIW-GOSISDBHSA-N 0 3 414.981 4.402 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)c1cncc(-c2ccc(N(C)C)cc2)c1 ZINC000471454424 886129917 /nfs/dbraw/zinc/12/99/17/886129917.db2.gz DAEHCLUZCSVGDP-UHFFFAOYSA-N 0 3 402.542 4.019 20 0 HIADHN COc1cc(NC(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)cc(-n2cccn2)c1 ZINC000471474243 886168886 /nfs/dbraw/zinc/16/88/86/886168886.db2.gz ARISBMMNPGKRQY-IBGZPJMESA-N 0 3 419.529 4.009 20 0 HIADHN C[C@@H](NC(=O)c1ccc(NC(=O)c2cccs2)cc1)[C@H](c1ccccc1)N(C)C ZINC000471548388 886256617 /nfs/dbraw/zinc/25/66/17/886256617.db2.gz RIFAHZCOZXGPSF-IIBYNOLFSA-N 0 3 407.539 4.422 20 0 HIADHN COc1ccccc1[C@H](CNC(=O)c1oc2ccccc2c1CN(C)C)OC(C)C ZINC000471551853 886259594 /nfs/dbraw/zinc/25/95/94/886259594.db2.gz OYFUZELIZIEPSR-QFIPXVFZSA-N 0 3 410.514 4.399 20 0 HIADHN C[C@H](NC(=O)c1cccc(NC(=O)c2cccs2)c1)[C@H](c1ccccc1)N(C)C ZINC000471555436 886264361 /nfs/dbraw/zinc/26/43/61/886264361.db2.gz NGQBJBMROHJMNI-HRAATJIYSA-N 0 3 407.539 4.422 20 0 HIADHN C[C@@H](NC(=O)c1cccc(NC(=O)c2cccs2)c1)[C@@H](c1ccccc1)N(C)C ZINC000471555437 886264964 /nfs/dbraw/zinc/26/49/64/886264964.db2.gz NGQBJBMROHJMNI-IERDGZPVSA-N 0 3 407.539 4.422 20 0 HIADHN Cc1cccc(C(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)c1I ZINC000471558953 886268566 /nfs/dbraw/zinc/26/85/66/886268566.db2.gz HUYKPSUVPAPABG-KSSFIOAISA-N 0 3 422.310 4.021 20 0 HIADHN C[C@H](Cc1ccc(Br)c(F)c1)[NH2+]Cc1nnc(COc2ccccc2)[n-]1 ZINC000471599757 886313004 /nfs/dbraw/zinc/31/30/04/886313004.db2.gz VWPIUAMHWPACIU-CYBMUJFWSA-N 0 3 419.298 4.006 20 0 HIADHN C[C@@H](NC(=O)N[C@H]1C[C@@H]1c1ccccc1OC(F)F)[C@H](c1ccccc1)N(C)C ZINC000504126488 913030388 /nfs/dbraw/zinc/03/03/88/913030388.db2.gz WOJWAEURQHVEBJ-XUMLPFHTSA-N 0 3 403.473 4.135 20 0 HIADHN CC(C)c1ccc(NC(=O)C[C@H](C)NCc2n[nH]c(COc3ccccc3)n2)cc1 ZINC000471603899 886319302 /nfs/dbraw/zinc/31/93/02/886319302.db2.gz VRFOQVLCGQOWMT-KRWDZBQOSA-N 0 3 407.518 4.014 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)[C@@H]3C[C@@H]3c3ccccc3OC(F)F)c2)CC1 ZINC000471621589 886339010 /nfs/dbraw/zinc/33/90/10/886339010.db2.gz NQDNKXUHJRFOOP-WOJBJXKFSA-N 0 3 415.484 4.172 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)CS[C@@H](C)c3nc4ccccc4[nH]3)c2)CC1 ZINC000471635712 886352974 /nfs/dbraw/zinc/35/29/74/886352974.db2.gz PAHREJXJJFMQOQ-KRWDZBQOSA-N 0 3 423.586 4.138 20 0 HIADHN C[C@@H](NC(=O)N[C@@H]1C[C@H]1c1ccc(OC(F)F)cc1)[C@H](c1ccccc1)N(C)C ZINC000504146187 913044168 /nfs/dbraw/zinc/04/41/68/913044168.db2.gz UDCBMLRUNFOKDJ-ZVEHZALQSA-N 0 3 403.473 4.135 20 0 HIADHN Cc1nn(C)cc1CN(Cc1cccc(Br)c1)CC1(O)CCCCC1 ZINC000471804562 886541657 /nfs/dbraw/zinc/54/16/57/886541657.db2.gz MSNYPYQVKBXBPC-UHFFFAOYSA-N 0 3 406.368 4.188 20 0 HIADHN CSCc1cc(C(=O)NCCCCN2CCN(c3ccccc3)CC2)ccc1F ZINC000471823290 886569783 /nfs/dbraw/zinc/56/97/83/886569783.db2.gz PZWJTJCTSOHLMA-UHFFFAOYSA-N 0 3 415.578 4.021 20 0 HIADHN Cc1ccc([C@@H](NC(=O)NC[C@@H](C)N(C)Cc2ccccc2)c2ccccn2)cc1 ZINC000471852331 886621448 /nfs/dbraw/zinc/62/14/48/886621448.db2.gz VIOFKVIJDBCCPN-HYBUGGRVSA-N 0 3 402.542 4.299 20 0 HIADHN Cc1cn([C@H](C)c2ccccc2)nc1NC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000471855267 886624928 /nfs/dbraw/zinc/62/49/28/886624928.db2.gz FUSFASSYKQAILF-STZQEDGTSA-N 0 3 403.530 4.368 20 0 HIADHN COc1ccc(NC(=O)[C@H](C)N[C@H]2C[C@@H](OCc3ccccc3)C2(C)C)cc1OC ZINC000471860027 886633785 /nfs/dbraw/zinc/63/37/85/886633785.db2.gz WZEVEXZNVVQNQF-WQTXXOFMSA-N 0 3 412.530 4.004 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)c1cc2c(C(F)F)nn(C)c2s1 ZINC000471889951 886672036 /nfs/dbraw/zinc/67/20/36/886672036.db2.gz WASCGTCROIAMTK-UHFFFAOYSA-N 0 3 420.529 4.209 20 0 HIADHN Cc1cn([C@H](C)c2ccccc2)nc1NC(=O)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000471914370 886701930 /nfs/dbraw/zinc/70/19/30/886701930.db2.gz HLPIZOBRDZMGPI-KNQAVFIVSA-N 0 3 403.530 4.197 20 0 HIADHN Cc1cc(-c2nc(C3CC3)no2)ccc1NC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000471925377 886716025 /nfs/dbraw/zinc/71/60/25/886716025.db2.gz RVOZBZVTKQDVGB-RTWAWAEBSA-N 0 3 417.513 4.489 20 0 HIADHN CSc1nc(C(C)(C)C)nc(C)c1C(=O)N[C@@H]1C[C@@H](C)N(Cc2ccccc2)C1 ZINC000471968385 886800367 /nfs/dbraw/zinc/80/03/67/886800367.db2.gz OMQWOKZZOQACHK-CRAIPNDOSA-N 0 3 412.603 4.197 20 0 HIADHN Cc1c(NC(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)cnn1-c1cc(C)ccc1C ZINC000471980770 886810107 /nfs/dbraw/zinc/81/01/07/886810107.db2.gz SIQJTAPOZOXQAY-OFNKIYASSA-N 0 3 403.530 4.364 20 0 HIADHN Cc1ccnc(Oc2ccc(NC(=O)N[C@@H]3CCN(C)[C@@H]3c3ccccc3)cc2)n1 ZINC000471986624 886814057 /nfs/dbraw/zinc/81/40/57/886814057.db2.gz YJYGLBDGZXWHCZ-NHCUHLMSSA-N 0 3 403.486 4.144 20 0 HIADHN CCCCO[C@H]1C[C@H](NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)C1(C)C ZINC000471991338 886817713 /nfs/dbraw/zinc/81/77/13/886817713.db2.gz HYSLIDCSKVYYED-FOIPXRHGSA-N 0 3 419.532 4.075 20 0 HIADHN CC(C)n1cnnc1-c1ccccc1NC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000472020534 886844078 /nfs/dbraw/zinc/84/40/78/886844078.db2.gz TYAYZUAFNZIXFT-RTWAWAEBSA-N 0 3 404.518 4.093 20 0 HIADHN COc1ccc(CNCCc2cn(C)c3cc(F)ccc23)c(Br)c1O ZINC000472043656 886859987 /nfs/dbraw/zinc/85/99/87/886859987.db2.gz JPCRJEYUROTPRF-UHFFFAOYSA-N 0 3 407.283 4.126 20 0 HIADHN COc1cc(C[NH2+]CCc2cn(C)c3cc(F)ccc23)cc(Br)c1[O-] ZINC000472057778 886868251 /nfs/dbraw/zinc/86/82/51/886868251.db2.gz LQQKAOVQVMBJQK-UHFFFAOYSA-N 0 3 407.283 4.126 20 0 HIADHN COc1cc(F)c(NC(=O)NC[C@@H](c2ccccc2)N2CCC(C)CC2)cc1OC ZINC000504212771 913089388 /nfs/dbraw/zinc/08/93/88/913089388.db2.gz OOIJUVKEJQEUFO-FQEVSTJZSA-N 0 3 415.509 4.438 20 0 HIADHN Cc1cc(C(=O)N[C@@H](C)CCN2CCN(C)CC2)sc1-c1cccc(Cl)c1 ZINC000472119942 886906664 /nfs/dbraw/zinc/90/66/64/886906664.db2.gz KQSAOOBCEDRRKU-INIZCTEOSA-N 0 3 405.995 4.133 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N[C@@H]1CCCc2sccc21 ZINC000472170395 886969686 /nfs/dbraw/zinc/96/96/86/886969686.db2.gz IVIYTHJCQDDPNN-ZBCRRDGASA-N 0 3 401.498 4.230 20 0 HIADHN CSCc1cccc(CNC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)c1 ZINC000472174194 886972813 /nfs/dbraw/zinc/97/28/13/886972813.db2.gz JPXLKFHNUWIOCF-UHFFFAOYSA-N 0 3 415.525 4.154 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)NCC(C)(C)c1ccc(Cl)c(Cl)c1 ZINC000504243803 913112819 /nfs/dbraw/zinc/11/28/19/913112819.db2.gz AXXLBVJTNSGHCZ-UHFFFAOYSA-N 0 3 423.388 4.439 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2cccc(NC(=O)c3ccoc3)c2)[C@H]1c1ccccc1 ZINC000472334405 887171438 /nfs/dbraw/zinc/17/14/38/887171438.db2.gz IILLSCOJBBIMCV-NHCUHLMSSA-N 0 3 404.470 4.099 20 0 HIADHN CCN(C(=O)NCC1CCN(c2ccccc2)CC1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000472393615 887239137 /nfs/dbraw/zinc/23/91/37/887239137.db2.gz GRMKDMODZUNFIN-RUZDIDTESA-N 0 3 420.601 4.209 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)NCC1(c2ccccc2)CCCCCC1 ZINC000504276274 913131084 /nfs/dbraw/zinc/13/10/84/913131084.db2.gz BDEPPRDLQSJDAR-UHFFFAOYSA-N 0 3 408.590 4.447 20 0 HIADHN C[C@@]1(c2ccccc2)CCN(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)C1 ZINC000472447934 887300220 /nfs/dbraw/zinc/30/02/20/887300220.db2.gz GAVUSSGIZYXTPW-GZNCHQMQSA-N 0 3 409.496 4.165 20 0 HIADHN Cc1cc(CN(C)C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)ccc1F ZINC000472448647 887300282 /nfs/dbraw/zinc/30/02/82/887300282.db2.gz OJZVWTSPTBYCFC-UHFFFAOYSA-N 0 3 401.448 4.081 20 0 HIADHN C[C@H](c1ccc(F)cc1)N(C)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472449455 887302227 /nfs/dbraw/zinc/30/22/27/887302227.db2.gz QWGPDZMKDORXPL-NLNFPOJYSA-N 0 3 401.448 4.333 20 0 HIADHN CCN(Cc1cccc(F)c1)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472466440 887326108 /nfs/dbraw/zinc/32/61/08/887326108.db2.gz YTWITFOVACIKSI-UHFFFAOYSA-N 0 3 401.448 4.163 20 0 HIADHN Cc1ccc([C@@H](NC(=O)N2CCCN(Cc3ccccc3)CC2)c2ccccn2)cc1 ZINC000472483937 887349541 /nfs/dbraw/zinc/34/95/41/887349541.db2.gz GVCWZKUWIOPRDF-RUZDIDTESA-N 0 3 414.553 4.397 20 0 HIADHN Cc1ccc(-c2noc([C@@H](C)NC(=O)c3oc4ccccc4c3CN(C)C)n2)cc1F ZINC000472550965 887433275 /nfs/dbraw/zinc/43/32/75/887433275.db2.gz XWUBEYUBWAVBFX-CQSZACIVSA-N 0 3 422.460 4.483 20 0 HIADHN CCN1CCN(c2cccc(NCc3cc(OC)c(OC)cc3SC)c2)CC1 ZINC000472615937 887483861 /nfs/dbraw/zinc/48/38/61/887483861.db2.gz ZRSHYUQTPBLAGU-UHFFFAOYSA-N 0 3 401.576 4.180 20 0 HIADHN Cc1cc(NC(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)ccc1C(=O)NC(C)C ZINC000472740898 887585774 /nfs/dbraw/zinc/58/57/74/887585774.db2.gz YXLBZPQNZZJHLO-QFIPXVFZSA-N 0 3 422.573 4.262 20 0 HIADHN Cc1ccc(-c2nnco2)cc1NC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000472739903 887585831 /nfs/dbraw/zinc/58/58/31/887585831.db2.gz PMNLZZBBFFASNU-HXUWFJFHSA-N 0 3 405.502 4.173 20 0 HIADHN COC[C@@H](NC(=O)NC[C@H](c1cccs1)N1CCC(C)CC1)c1ccc(C)o1 ZINC000472819252 887663430 /nfs/dbraw/zinc/66/34/30/887663430.db2.gz ZRIXRVXYHOKNHS-QZTJIDSGSA-N 0 3 405.564 4.109 20 0 HIADHN Cc1ccc(NC(=O)NC[C@H](Cc2ccccc2)N(C)C)c(-c2nc(C3CC3)no2)c1 ZINC000472869749 887723953 /nfs/dbraw/zinc/72/39/53/887723953.db2.gz BIORWJRLGGUVCD-IBGZPJMESA-N 0 3 419.529 4.217 20 0 HIADHN COc1cc(NC(=O)N(CCN(C)C)Cc2cccc(F)c2)ccc1Br ZINC000472878927 887731442 /nfs/dbraw/zinc/73/14/42/887731442.db2.gz USGNZRQCMSPIMQ-UHFFFAOYSA-N 0 3 424.314 4.193 20 0 HIADHN Cc1ccc(C(F)(F)F)cc1NC(=O)N1CCC(CN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000473070316 887890329 /nfs/dbraw/zinc/89/03/29/887890329.db2.gz DDBRYYDLLWOAPZ-HOTGVXAUSA-N 0 3 413.484 4.367 20 0 HIADHN COc1ccc(CNC(=O)C2CCN(Cc3cc4c(ccc(C)c4C)[nH]3)CC2)cc1 ZINC000473133038 887924492 /nfs/dbraw/zinc/92/44/92/887924492.db2.gz PIJYYGTYMBVSEN-UHFFFAOYSA-N 0 3 405.542 4.322 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)C1(c2ccccc2Br)CC1 ZINC000473387598 888101526 /nfs/dbraw/zinc/10/15/26/888101526.db2.gz ISQVDPAJZJHLPK-UHFFFAOYSA-N 0 3 413.359 4.045 20 0 HIADHN Cc1ccc(C(=O)CCC(=O)N2CC[C@@]3(C2)CCCN(Cc2ccccc2)C3)cc1 ZINC000473495762 888218243 /nfs/dbraw/zinc/21/82/43/888218243.db2.gz CPYSUOBTTPAFCR-SANMLTNESA-N 0 3 404.554 4.473 20 0 HIADHN O=C(Cc1cccc(OC(F)(F)F)c1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473515500 888246825 /nfs/dbraw/zinc/24/68/25/888246825.db2.gz YMBGSAAIZNZXGV-UHFFFAOYSA-N 0 3 424.385 4.049 20 0 HIADHN O=C(Cc1ccc(Cl)c(Cl)c1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473515631 888246846 /nfs/dbraw/zinc/24/68/46/888246846.db2.gz ZACPGCTXLASJTP-UHFFFAOYSA-N 0 3 409.279 4.457 20 0 HIADHN O=C(CCOc1ccccc1Cl)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473517058 888248611 /nfs/dbraw/zinc/24/86/11/888248611.db2.gz GMTFMWYVPKVFJL-UHFFFAOYSA-N 0 3 404.860 4.030 20 0 HIADHN Cc1ccc(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cc1Br ZINC000473517928 888249626 /nfs/dbraw/zinc/24/96/26/888249626.db2.gz CGFWWYQQDLOCGE-UHFFFAOYSA-N 0 3 419.285 4.293 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N[C@@H](CCCCOC)c3ccccc3)cc2)CC1 ZINC000473518023 888250007 /nfs/dbraw/zinc/25/00/07/888250007.db2.gz KRGBHIURNDZAQX-DEOSSOPVSA-N 0 3 409.574 4.116 20 0 HIADHN CCOc1ccc(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cc1OCC ZINC000473517844 888250436 /nfs/dbraw/zinc/25/04/36/888250436.db2.gz BTWZJQGCMPGSMZ-UHFFFAOYSA-N 0 3 414.468 4.019 20 0 HIADHN Cc1cccc(OCCCCC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)c1 ZINC000473520672 888255092 /nfs/dbraw/zinc/25/50/92/888255092.db2.gz NTVRLWABIXKZIV-UHFFFAOYSA-N 0 3 412.496 4.466 20 0 HIADHN CC[C@@H](Sc1ccccc1)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473522695 888258090 /nfs/dbraw/zinc/25/80/90/888258090.db2.gz LNXJXWHHDMFBQY-LEOMRAHMSA-N 0 3 400.510 4.479 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)[C@@H]1C[C@H]1c1cc(F)c(F)c(F)c1 ZINC000473523954 888259893 /nfs/dbraw/zinc/25/98/93/888259893.db2.gz HNNROOZKKJORCF-PFSRBDOWSA-N 0 3 420.397 4.129 20 0 HIADHN O=C(Cc1ccc(OC(F)(F)F)cc1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473525344 888261415 /nfs/dbraw/zinc/26/14/15/888261415.db2.gz PQWBKWJLLAYNCG-UHFFFAOYSA-N 0 3 424.385 4.049 20 0 HIADHN CCn1ncc(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)c1-c1ccccc1 ZINC000473528659 888265673 /nfs/dbraw/zinc/26/56/73/888265673.db2.gz UHASOZBTZSVABI-UHFFFAOYSA-N 0 3 420.479 4.105 20 0 HIADHN Cc1c(NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)cccc1NC(=O)N(C)C ZINC000473530881 888268778 /nfs/dbraw/zinc/26/87/78/888268778.db2.gz MYWWGVUCCKPSGN-GOSISDBHSA-N 0 3 412.509 4.078 20 0 HIADHN C[C@H](CC(=O)c1ccc(Cl)cc1)C(=O)N1C[C@H]2CN(Cc3ccccc3)C[C@H]2C1 ZINC000473565052 888305351 /nfs/dbraw/zinc/30/53/51/888305351.db2.gz ZNMHXKGQULCRAL-UIFIKXQLSA-N 0 3 410.945 4.139 20 0 HIADHN Cc1cc(C)cc(Oc2ccc(NC(=O)N[C@@H](C)CCN3CCN(C)CC3)cc2)c1 ZINC000473662228 888415885 /nfs/dbraw/zinc/41/58/85/888415885.db2.gz IPJDTLQOFQCAPH-FQEVSTJZSA-N 0 3 410.562 4.243 20 0 HIADHN Cc1ccccc1COc1cccc(NC(=O)NC(C)(C)CCN2CCN(C)CC2)c1 ZINC000473678158 888443863 /nfs/dbraw/zinc/44/38/63/888443863.db2.gz FPXQUAZPKJPUEL-UHFFFAOYSA-N 0 3 424.589 4.112 20 0 HIADHN CCSc1nnc(NC(=O)N(CC)[C@H]2CCN([C@@H](C)c3ccccc3)C2)s1 ZINC000473683171 888452779 /nfs/dbraw/zinc/45/27/79/888452779.db2.gz QEWZIWXXTWIWQR-HOCLYGCPSA-N 0 3 405.593 4.339 20 0 HIADHN CCC(C)(C)OCc1cccc(NC(=O)NC(C)(C)CCN2CCN(C)CC2)c1C ZINC000473699919 888475055 /nfs/dbraw/zinc/47/50/55/888475055.db2.gz PONWIIJDGCSAIK-UHFFFAOYSA-N 0 3 418.626 4.238 20 0 HIADHN CC(C)CC[C@@H]1CCCCN1C(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000473751782 888538953 /nfs/dbraw/zinc/53/89/53/888538953.db2.gz SITGAMVSRNAWOA-QFIPXVFZSA-N 0 3 401.595 4.144 20 0 HIADHN CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)NCCCCc1ccc(Cl)s1 ZINC000504450527 913259651 /nfs/dbraw/zinc/25/96/51/913259651.db2.gz LDYQOHZDRVQPAG-PXNSSMCTSA-N 0 3 421.010 4.454 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N(CCCCOC)Cc3ccccc3)c2)CC1 ZINC000473805029 888627345 /nfs/dbraw/zinc/62/73/45/888627345.db2.gz HBMPVWXPZSRYAW-UHFFFAOYSA-N 0 3 424.589 4.289 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@H](c3ccccc3)c3ccncc3)c2)CC1 ZINC000473808499 888632548 /nfs/dbraw/zinc/63/25/48/888632548.db2.gz OZWGJBSGQCDBBU-XMMPIXPASA-N 0 3 415.541 4.135 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)NCc1ccsc1Br)c1ccco1 ZINC000504459547 913265087 /nfs/dbraw/zinc/26/50/87/913265087.db2.gz ZZRRFPJYRZAVLP-DGCLKSJQSA-N 0 3 400.342 4.032 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@H]3CCSc4ccc(F)cc43)c2)CC1 ZINC000473823863 888656993 /nfs/dbraw/zinc/65/69/93/888656993.db2.gz XUPIGMPEBYOWHD-FQEVSTJZSA-N 0 3 414.550 4.326 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@@H](c3ccco3)c3ccccc3)c2)CC1 ZINC000473826787 888659863 /nfs/dbraw/zinc/65/98/63/888659863.db2.gz ZCCOTKJEIZVSEU-HSZRJFAPSA-N 0 3 404.514 4.333 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CC[C@H](c4ccccc4)[C@H](C)C3)c2)CC1 ZINC000473832773 888668640 /nfs/dbraw/zinc/66/86/40/888668640.db2.gz AFDVTMGMLXDLOC-YKSBVNFPSA-N 0 3 406.574 4.486 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N(C)[C@@H](C)c3sc(C)nc3C)c2)CC1 ZINC000473833296 888668771 /nfs/dbraw/zinc/66/87/71/888668771.db2.gz BYKCIYKVTBXGEM-INIZCTEOSA-N 0 3 401.580 4.127 20 0 HIADHN Cc1cc(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)nn1-c1ccc(F)cc1F ZINC000504480226 913274760 /nfs/dbraw/zinc/27/47/60/913274760.db2.gz MVIRURWIFSKNTN-QFIPXVFZSA-N 0 3 410.468 4.026 20 0 HIADHN CN(C)[C@@H](CNC(=O)N[C@H](c1cccc(Cl)c1)c1ccccn1)c1ccccc1 ZINC000473875288 888736740 /nfs/dbraw/zinc/73/67/40/888736740.db2.gz KZWDLWOPBULLFX-FCHUYYIVSA-N 0 3 408.933 4.427 20 0 HIADHN C[C@H](NC(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1)c1cc2ccccc2s1 ZINC000504480543 913274850 /nfs/dbraw/zinc/27/48/50/913274850.db2.gz OVYZLSMXIQZDBR-KURKYZTESA-N 0 3 415.603 4.493 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCSC[C@@H]1c1nccs1)c1ccsc1 ZINC000473890289 888760366 /nfs/dbraw/zinc/76/03/66/888760366.db2.gz CFRCZWOBDWNHFZ-HZPDHXFCSA-N 0 3 410.634 4.087 20 0 HIADHN Cn1cnc2cc(CN[C@H]3CCCN(c4ccc(Cl)cc4Cl)C3=O)ccc21 ZINC000474008354 888865937 /nfs/dbraw/zinc/86/59/37/888865937.db2.gz IPSIWMAUKBXYCN-INIZCTEOSA-N 0 3 403.313 4.165 20 0 HIADHN COC(=O)c1cc(CN[C@H](Cc2ccccn2)c2ccc(Br)cc2)c[nH]1 ZINC000474011509 888867996 /nfs/dbraw/zinc/86/79/96/888867996.db2.gz PEPICIJEVKEIKF-GOSISDBHSA-N 0 3 414.303 4.032 20 0 HIADHN COc1c2ccccc2oc1CNC1CCC(N2C(=O)c3ccccc3C2=O)CC1 ZINC000474014615 888869540 /nfs/dbraw/zinc/86/95/40/888869540.db2.gz ZCMWDIPNEOWUOK-UHFFFAOYSA-N 0 3 404.466 4.138 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)N1CCSC[C@@H]1c1nccs1 ZINC000474020211 888872693 /nfs/dbraw/zinc/87/26/93/888872693.db2.gz XFAPBQOUAMRURJ-RTBURBONSA-N 0 3 418.632 4.099 20 0 HIADHN COc1ccc2c(c1)C(C)(C)C[C@@H]2NCc1ccc(C(=O)N2C[C@H](C)O[C@@H](C)C2)cc1 ZINC000474026968 888877096 /nfs/dbraw/zinc/87/70/96/888877096.db2.gz BCTCRGCZURVBES-XFAGBWLFSA-N 0 3 422.569 4.457 20 0 HIADHN COc1ccc(Cc2nc(C)c([C@@H](C)NCCOC(F)(F)F)s2)cc1OC ZINC000474028427 888878535 /nfs/dbraw/zinc/87/85/35/888878535.db2.gz DFIPLOKZAODOHS-LLVKDONJSA-N 0 3 404.454 4.247 20 0 HIADHN CC[C@@H](C)[C@@H](NC(=O)NC(C)(C)CCN1CCN(C)CC1)c1ccc(Cl)cc1 ZINC000474041367 888884702 /nfs/dbraw/zinc/88/47/02/888884702.db2.gz YTAYILMLCLKHKL-YLJYHZDGSA-N 0 3 409.018 4.143 20 0 HIADHN C[C@@H](CC(=O)N(C)c1ccccc1)N[C@@H]1CCN(c2ccc(Cl)cc2Cl)C1=O ZINC000474108063 888929617 /nfs/dbraw/zinc/92/96/17/888929617.db2.gz UPRLHMBYJHZSQD-KBXCAEBGSA-N 0 3 420.340 4.130 20 0 HIADHN CCc1cccc(F)c1CN1CCC(C(=O)Nc2ccc(Br)cn2)CC1 ZINC000474154297 888985138 /nfs/dbraw/zinc/98/51/38/888985138.db2.gz QJPBELLRFQOTQK-UHFFFAOYSA-N 0 3 420.326 4.396 20 0 HIADHN CCOc1cccc2[nH]cc(CC(=O)N(CC)[C@H]3CCN(Cc4ccccc4)C3)c21 ZINC000474168789 889007716 /nfs/dbraw/zinc/00/77/16/889007716.db2.gz JBCXIKIPFMNIJV-NRFANRHFSA-N 0 3 405.542 4.232 20 0 HIADHN C[C@H](NC(=O)c1ccc2c(c1)[nH]c(=O)n2C1CCCC1)[C@@H](c1ccccc1)N(C)C ZINC000474178126 889016630 /nfs/dbraw/zinc/01/66/30/889016630.db2.gz QIOUVTZDKCRIBR-AOMKIAJQSA-N 0 3 406.530 4.278 20 0 HIADHN Cc1cccn2c(=O)cc(CN3CCC(c4ccccc4C(F)(F)F)CC3)nc12 ZINC000474237171 889082084 /nfs/dbraw/zinc/08/20/84/889082084.db2.gz GNBIKNFVVJGKAN-UHFFFAOYSA-N 0 3 401.432 4.401 20 0 HIADHN Cc1ccc(CC(=O)NC2CCN([C@@H](C)c3ccncc3)CC2)cc1Br ZINC000474245190 889094394 /nfs/dbraw/zinc/09/43/94/889094394.db2.gz BHNLLUORNBITAA-INIZCTEOSA-N 0 3 416.363 4.037 20 0 HIADHN COc1ccc(C(=O)CCCCCC(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)cc1 ZINC000474259723 889117272 /nfs/dbraw/zinc/11/72/72/889117272.db2.gz QUHRKZLSSANERO-WIOPSUGQSA-N 0 3 408.542 4.390 20 0 HIADHN COc1ccc(C(=O)CCCCCC(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)cc1 ZINC000474259717 889118128 /nfs/dbraw/zinc/11/81/28/889118128.db2.gz QUHRKZLSSANERO-DHLKQENFSA-N 0 3 408.542 4.390 20 0 HIADHN C[C@H]1CCN(Cc2cnc(-c3cnn(C)c3)nc2)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000474270927 889132506 /nfs/dbraw/zinc/13/25/06/889132506.db2.gz PSMGDYZFNXNARM-LIRRHRJNSA-N 0 3 401.436 4.479 20 0 HIADHN Cn1c2ccc(CN(CCc3ccccn3)Cc3ccc(F)cc3)cc2sc1=O ZINC000474277718 889143763 /nfs/dbraw/zinc/14/37/63/889143763.db2.gz UFRZNRVIGAENGA-UHFFFAOYSA-N 0 3 407.514 4.379 20 0 HIADHN CC[C@@H]1CCCCN1CCNC(=O)c1ccc(NC(=O)Nc2ccccc2)s1 ZINC000474301926 889168716 /nfs/dbraw/zinc/16/87/16/889168716.db2.gz KGOUVCQDCNUGHQ-QGZVFWFLSA-N 0 3 400.548 4.386 20 0 HIADHN CCc1onc(-c2ccccc2Cl)c1C(=O)NC[C@@H](Cc1ccccc1)N(C)C ZINC000474369415 889248059 /nfs/dbraw/zinc/24/80/59/889248059.db2.gz AUYPZXFOVZVQSQ-QGZVFWFLSA-N 0 3 411.933 4.460 20 0 HIADHN Cc1cccc2c1OCC[C@H]2NC(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000474486155 889346721 /nfs/dbraw/zinc/34/67/21/889346721.db2.gz RSEQCWHQENAQIB-OAQYLSRUSA-N 0 3 411.571 4.232 20 0 HIADHN C[C@H](CNC(=O)c1ccc(NC(=O)Nc2ccccc2)s1)N1CCC[C@@H](C)C1 ZINC000474514404 889379029 /nfs/dbraw/zinc/37/90/29/889379029.db2.gz PZUGZIUMXGZHCO-HZPDHXFCSA-N 0 3 400.548 4.242 20 0 HIADHN Cc1ccc(NC(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)c(Br)c1 ZINC000474548155 889424127 /nfs/dbraw/zinc/42/41/27/889424127.db2.gz PIXPSZSFANXDIJ-KRWDZBQOSA-N 0 3 402.336 4.496 20 0 HIADHN CCc1noc(-c2ccc(C)c(NC(=O)N(C)[C@@H]3CCN(Cc4ccccc4)C3)c2)n1 ZINC000474611913 889476769 /nfs/dbraw/zinc/47/67/69/889476769.db2.gz FEFKBESYIPFMJU-HXUWFJFHSA-N 0 3 419.529 4.346 20 0 HIADHN C[C@@H]1CN(c2ccccc2NC(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)C[C@H](C)O1 ZINC000474730987 889587228 /nfs/dbraw/zinc/58/72/28/889587228.db2.gz ZVRXFMZUMMVMQW-VWPQPMDRSA-N 0 3 422.573 4.038 20 0 HIADHN COc1cc(OC)cc(N2CC[C@H](CNCc3c(F)cccc3Br)C2)c1 ZINC000474806442 889658486 /nfs/dbraw/zinc/65/84/86/889658486.db2.gz DNIHHVRPXRLIIU-CQSZACIVSA-N 0 3 423.326 4.222 20 0 HIADHN COc1ccc([C@H](NCCCc2ccc(C)nc2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000474811162 889664546 /nfs/dbraw/zinc/66/45/46/889664546.db2.gz NHHFLOCJWWBCJX-DEOSSOPVSA-N 0 3 424.566 4.114 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)CCCCc2nc3ccccc3s2)CC1 ZINC000474872114 889726465 /nfs/dbraw/zinc/72/64/65/889726465.db2.gz ILPISEBNNRIFNB-UHFFFAOYSA-N 0 3 403.592 4.015 20 0 HIADHN C[C@H](N[C@H](c1nc(-c2nc[nH]n2)no1)C(C)(C)C)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000474885826 889742813 /nfs/dbraw/zinc/74/28/13/889742813.db2.gz WXKCUDLYNMFTRD-KZWBYHQPSA-N 0 3 406.943 4.439 20 0 HIADHN C[C@H]([NH2+][C@H](c1nc(-c2nc[n-]n2)no1)C(C)(C)C)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000474885826 889742822 /nfs/dbraw/zinc/74/28/22/889742822.db2.gz WXKCUDLYNMFTRD-KZWBYHQPSA-N 0 3 406.943 4.439 20 0 HIADHN CCN(C(=O)Nc1ccc(C(=O)NC(C)(C)C)cc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000474997418 889849210 /nfs/dbraw/zinc/84/92/10/889849210.db2.gz FAAIVLOLLUYZEX-QFIPXVFZSA-N 0 3 422.573 4.343 20 0 HIADHN CCN(C(=O)Nc1ccc(-c2csnn2)cc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475001004 889851664 /nfs/dbraw/zinc/85/16/64/889851664.db2.gz MNUGGFNSBBYMLO-HXUWFJFHSA-N 0 3 407.543 4.333 20 0 HIADHN CCN(C(=O)Nc1cc2c(cc1Cl)OCCO2)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475001404 889852977 /nfs/dbraw/zinc/85/29/77/889852977.db2.gz LWYCDPRFLGNBBY-QGZVFWFLSA-N 0 3 415.921 4.240 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)C/C=C/c2ccc(F)cc2)cc1)[C@@H]1CCCN(C)C1 ZINC000475008235 889860395 /nfs/dbraw/zinc/86/03/95/889860395.db2.gz KQSJMBARSTUODJ-WTCGPSRQSA-N 0 3 409.505 4.034 20 0 HIADHN CCN(Cc1cccc(NC(=O)N(CC)[C@H]2CCN(Cc3ccccc3)C2)c1)C(C)=O ZINC000475010910 889863875 /nfs/dbraw/zinc/86/38/75/889863875.db2.gz WFKYHSDFLMDOTR-DEOSSOPVSA-N 0 3 422.573 4.183 20 0 HIADHN Cc1cc(CN2C[C@@H](F)C[C@H]2CN(C)Cc2c[nH]nc2-c2ccc(Cl)cc2)on1 ZINC000475080707 889925861 /nfs/dbraw/zinc/92/58/61/889925861.db2.gz FMVLYZZIUCHXMA-OALUTQOASA-N 0 3 417.916 4.071 20 0 HIADHN CN(Cc1c[nH]nc1-c1cccc(Cl)c1)C[C@@H]1C[C@H](F)CN1Cc1nccs1 ZINC000475087632 889934929 /nfs/dbraw/zinc/93/49/29/889934929.db2.gz JIFVYPKMMXHDMQ-ROUUACIJSA-N 0 3 419.957 4.231 20 0 HIADHN COc1ccc(CN(C)C[C@@H]2C[C@H](F)CN2Cc2nccs2)cc1OCC(C)C ZINC000475098545 889945909 /nfs/dbraw/zinc/94/59/09/889945909.db2.gz CCOSAKMEOVBUDV-OALUTQOASA-N 0 3 421.582 4.231 20 0 HIADHN CN(C(=O)NCc1csc(-c2ccccc2)n1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475114897 889968188 /nfs/dbraw/zinc/96/81/88/889968188.db2.gz YVCWEAKEPYLHLE-OAQYLSRUSA-N 0 3 406.555 4.226 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@H](C)C1CCOCC1)c1ccc(C(F)(F)F)cc1 ZINC000475133794 889998923 /nfs/dbraw/zinc/99/89/23/889998923.db2.gz BELAKRRLIQFSKS-DNVCBOLYSA-N 0 3 415.500 4.203 20 0 HIADHN CCN(C(=O)NCc1sccc1Br)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475158989 890023555 /nfs/dbraw/zinc/02/35/55/890023555.db2.gz WVDBEACECSGWOL-INIZCTEOSA-N 0 3 422.392 4.317 20 0 HIADHN CCN(C(=O)N[C@H](C)c1cccc(-n2cccn2)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475172766 890040433 /nfs/dbraw/zinc/04/04/33/890040433.db2.gz IOOJNGKGLFYCRK-YKSBVNFPSA-N 0 3 417.557 4.239 20 0 HIADHN CCN(C(=O)NCc1ccc(Br)s1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475175578 890043450 /nfs/dbraw/zinc/04/34/50/890043450.db2.gz MCAMQEXBNKZWID-MRXNPFEDSA-N 0 3 422.392 4.317 20 0 HIADHN CCN(C(=O)N[C@H](C)c1ccc(-n2cccn2)cc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475176673 890046052 /nfs/dbraw/zinc/04/60/52/890046052.db2.gz OIAZHGBBADAZOV-YKSBVNFPSA-N 0 3 417.557 4.239 20 0 HIADHN CCN(C(=O)NCCc1ccc2ccccc2n1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475177654 890047075 /nfs/dbraw/zinc/04/70/75/890047075.db2.gz OTDPTFSYOFTGEX-HSZRJFAPSA-N 0 3 402.542 4.083 20 0 HIADHN CCN(C(=O)NCc1ccc(OC(C)(C)C)nc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475178602 890048263 /nfs/dbraw/zinc/04/82/63/890048263.db2.gz RKMHCFWQJXQYMH-OAQYLSRUSA-N 0 3 410.562 4.065 20 0 HIADHN CCN(C(=O)Nc1cn(-c2ccccc2)nc1C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475208570 890077372 /nfs/dbraw/zinc/07/73/72/890077372.db2.gz YMTZMXWISMYWGL-QFIPXVFZSA-N 0 3 403.530 4.309 20 0 HIADHN CN(CCCNC(=O)C1CCC1)Cc1ccc(Br)cc1C(F)(F)F ZINC000475213015 890082177 /nfs/dbraw/zinc/08/21/77/890082177.db2.gz FCFGEDXMVVYOMB-UHFFFAOYSA-N 0 3 407.274 4.206 20 0 HIADHN O=C(N1CCc2cccc(F)c2C1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000504674091 913413536 /nfs/dbraw/zinc/41/35/36/913413536.db2.gz VJMZCXHHNCSLHI-OAQYLSRUSA-N 0 3 406.423 4.165 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)c2cn(C)nc2-c2ccc(Cl)s2)C1 ZINC000475242147 890120828 /nfs/dbraw/zinc/12/08/28/890120828.db2.gz AOJNKTSVQCMPQW-ZBFHGGJFSA-N 0 3 414.962 4.367 20 0 HIADHN Cc1ccc(C)c([C@H]2CCCN2C(=O)NCc2ccccc2CN2CCC(O)CC2)c1 ZINC000475283093 890180113 /nfs/dbraw/zinc/18/01/13/890180113.db2.gz SZMJLVLFDSGQIM-RUZDIDTESA-N 0 3 421.585 4.307 20 0 HIADHN Cc1ccc(C)c([C@@H]2CCCN2C(=O)NCc2ccccc2CN2CCC(O)CC2)c1 ZINC000475283094 890180286 /nfs/dbraw/zinc/18/02/86/890180286.db2.gz SZMJLVLFDSGQIM-VWLOTQADSA-N 0 3 421.585 4.307 20 0 HIADHN COc1ccc(C[NH2+]CC2CCN(c3ccccc3)CC2)c(Br)c1[O-] ZINC000475285419 890185379 /nfs/dbraw/zinc/18/53/79/890185379.db2.gz GXOPQBFZMZOUKF-UHFFFAOYSA-N 0 3 405.336 4.170 20 0 HIADHN Cc1ccc(-n2nc(C(=O)N(C)[C@H]3CCN(Cc4ccccc4)C3)c3c2CCC3)cc1 ZINC000475307874 890218232 /nfs/dbraw/zinc/21/82/32/890218232.db2.gz IHJSXAGPDKEPLP-QFIPXVFZSA-N 0 3 414.553 4.016 20 0 HIADHN C[C@@H](C(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(Br)s1 ZINC000475309040 890220171 /nfs/dbraw/zinc/22/01/71/890220171.db2.gz UGILRAXTEMOPOJ-GDBMZVCRSA-N 0 3 407.377 4.347 20 0 HIADHN CO[C@@H]1CCC[C@H](CC(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)C1 ZINC000475312599 890228121 /nfs/dbraw/zinc/22/81/21/890228121.db2.gz BYHGABPYQCKCCU-PKOBYXMFSA-N 0 3 400.485 4.191 20 0 HIADHN CN(C(=O)C1(c2ccccc2Cl)CCOCC1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475319979 890238220 /nfs/dbraw/zinc/23/82/20/890238220.db2.gz UKAXMGVKBMRAKG-FQEVSTJZSA-N 0 3 412.961 4.121 20 0 HIADHN Cc1c(C(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)cnn1-c1ccc(Cl)cc1 ZINC000475322076 890242774 /nfs/dbraw/zinc/24/27/74/890242774.db2.gz ZHBJOXLZUUFVFB-NRFANRHFSA-N 0 3 408.933 4.181 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)c1cc2sc(N3CCCC3)nc2s1 ZINC000475325575 890243635 /nfs/dbraw/zinc/24/36/35/890243635.db2.gz MYTDYODUHJMMGM-UHFFFAOYSA-N 0 3 414.600 4.162 20 0 HIADHN CCN(C(=O)c1ccn(Cc2ccccc2)n1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000475325688 890246834 /nfs/dbraw/zinc/24/68/34/890246834.db2.gz WWWKLBFLCYACJF-NZQKXSOJSA-N 0 3 402.542 4.229 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)N[C@H]3C[C@H](c4ccc(Cl)cc4)C3)CC2)C[C@@H](C)O1 ZINC000475407242 890335360 /nfs/dbraw/zinc/33/53/60/890335360.db2.gz FGZUDGBQUQYOCE-ZFNVSSEQSA-N 0 3 419.997 4.117 20 0 HIADHN COc1ccc([C@H](CNC(=O)N[C@H](C)c2cc(F)ccc2OC)N2CCCC2)cc1 ZINC000504708416 913441046 /nfs/dbraw/zinc/44/10/46/913441046.db2.gz QUBQWPQCCAMXAD-IERDGZPVSA-N 0 3 415.509 4.040 20 0 HIADHN COc1cccc([C@@H](CNC(=O)N[C@@H](C)c2cc(F)ccc2OC)N2CCCC2)c1 ZINC000504716640 913451861 /nfs/dbraw/zinc/45/18/61/913451861.db2.gz NSDOYNQUTFWYBD-HRAATJIYSA-N 0 3 415.509 4.040 20 0 HIADHN Cc1nn(-c2ccncc2)cc1CN[C@@H](CO)c1ccc(Cl)cc1C(F)(F)F ZINC000475632975 890573764 /nfs/dbraw/zinc/57/37/64/890573764.db2.gz HFQBACZDKYAYGZ-SFHVURJKSA-N 0 3 410.827 4.071 20 0 HIADHN CCc1nnc(-c2ccc(NC(=O)N3CC[C@@H](C)N(Cc4ccccc4)CC3)cc2)o1 ZINC000475683751 890625437 /nfs/dbraw/zinc/62/54/37/890625437.db2.gz GWPCKLUMWQOEIP-GOSISDBHSA-N 0 3 419.529 4.427 20 0 HIADHN CC(C)(CNC(=O)Nc1cccc(OC[C@H]2CCCO2)c1)N1CCc2ccccc2C1 ZINC000504736456 913473024 /nfs/dbraw/zinc/47/30/24/913473024.db2.gz CPWFVFIGKDJZRV-HSZRJFAPSA-N 0 3 423.557 4.203 20 0 HIADHN COc1ccc2cc(CN(C)C(=O)[C@@H](C)N3CCC[C@@]4(CCCOC4)C3)ccc2c1 ZINC000475739903 890682790 /nfs/dbraw/zinc/68/27/90/890682790.db2.gz YFSUYCHYYFUYSL-KBMIEXCESA-N 0 3 410.558 4.088 20 0 HIADHN C[C@H](c1ccc([S@](C)=O)cc1)N(C)CCc1nc(-c2ccc(Cl)cc2)no1 ZINC000475746132 890689097 /nfs/dbraw/zinc/68/90/97/890689097.db2.gz IHCFAZHMNIRYOA-ASHKIFAZSA-N 0 3 403.935 4.363 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1cn(C)nc1-c1ccc(Cl)s1 ZINC000475837210 890769927 /nfs/dbraw/zinc/76/99/27/890769927.db2.gz OQDQLVJGZLBDAE-PBHICJAKSA-N 0 3 414.962 4.052 20 0 HIADHN CC1CCN([C@@H](CNC(=O)Nc2ccc([S@@](C)=O)c(F)c2)c2cccs2)CC1 ZINC000475855377 890789721 /nfs/dbraw/zinc/78/97/21/890789721.db2.gz YKKOBFFASRMLCL-YMGMXPECSA-N 0 3 423.579 4.219 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N(C)Cc2nc3c(s2)CCCC3)N2CCCC2)cc1 ZINC000475911716 890839852 /nfs/dbraw/zinc/83/98/52/890839852.db2.gz VERMUCHWOUQPNO-FQEVSTJZSA-N 0 3 412.603 4.309 20 0 HIADHN COc1ccc(-c2csc(CNC(=O)N(CCN(C)C)Cc3ccccn3)c2)cc1 ZINC000475940083 890863992 /nfs/dbraw/zinc/86/39/92/890863992.db2.gz PZJVSXOJMBIKCR-UHFFFAOYSA-N 0 3 424.570 4.092 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N[C@H](Cc2ccccc2)c2ccccc2)CC1 ZINC000475985037 890901222 /nfs/dbraw/zinc/90/12/22/890901222.db2.gz ALDADQLQUUEOAH-XMMPIXPASA-N 0 3 409.574 4.159 20 0 HIADHN CC(C)(CNC(=O)Nc1ccc(OC[C@H]2CCCO2)cc1)N1CCc2ccccc2C1 ZINC000504771297 913504493 /nfs/dbraw/zinc/50/44/93/913504493.db2.gz UOJBEDMBVPXQGN-HSZRJFAPSA-N 0 3 423.557 4.203 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N[C@@H](C)c2ccc(SC(C)C)cc2)CC1 ZINC000476030273 890961786 /nfs/dbraw/zinc/96/17/86/890961786.db2.gz HUWVSAQYLANALN-SFHVURJKSA-N 0 3 407.624 4.437 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N[C@H](c2ccccc2)c2ccc(F)cc2)CC1 ZINC000476051780 890982375 /nfs/dbraw/zinc/98/23/75/890982375.db2.gz RXJGHEHUCNIVKO-HSZRJFAPSA-N 0 3 413.537 4.104 20 0 HIADHN COc1ccc([C@H]2CCCN2C(=O)NCC(C)(C)N2CCc3ccccc3C2)cc1 ZINC000504787746 913514162 /nfs/dbraw/zinc/51/41/62/913514162.db2.gz VGWLBUDBGIALAU-HSZRJFAPSA-N 0 3 407.558 4.379 20 0 HIADHN CN(C(=O)N[C@H](c1ccc(F)cc1)c1ccccc1Cl)[C@H]1CCN(C2CC2)C1 ZINC000476127495 891050028 /nfs/dbraw/zinc/05/00/28/891050028.db2.gz AYECRBUDUDJAPE-GHTZIAJQSA-N 0 3 401.913 4.447 20 0 HIADHN CN(C(=O)N[C@@H](c1ccc(F)cc1)c1ccccc1Cl)[C@@H]1CCN(C2CC2)C1 ZINC000476127538 891050476 /nfs/dbraw/zinc/05/04/76/891050476.db2.gz AYECRBUDUDJAPE-NQIIRXRSSA-N 0 3 401.913 4.447 20 0 HIADHN Cc1c(F)ccc(Cl)c1C(=O)Nc1ccc(C(=O)N(C)[C@@H]2CCCN(C)C2)cc1 ZINC000476146113 891069763 /nfs/dbraw/zinc/06/97/63/891069763.db2.gz JHNLYOQDHOXGPJ-QGZVFWFLSA-N 0 3 417.912 4.206 20 0 HIADHN COc1cc([C@@H](C)NC(=O)N(C)[C@H]2CCN(C3CC3)C2)ccc1OCc1ccccc1 ZINC000476162784 891089695 /nfs/dbraw/zinc/08/96/95/891089695.db2.gz OSPLPFIETLGOML-GCJKJVERSA-N 0 3 423.557 4.213 20 0 HIADHN CCNc1ccc(Cl)cc1C(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000476245111 891168631 /nfs/dbraw/zinc/16/86/31/891168631.db2.gz FCAAOHJHMOGTDE-IAGOWNOFSA-N 0 3 407.986 4.123 20 0 HIADHN Cc1nc(CC(C)C)oc1C(=O)NC1CCN(CCOc2ccc(Cl)cc2)CC1 ZINC000476396185 891311641 /nfs/dbraw/zinc/31/16/41/891311641.db2.gz LCQRGJVAMZEBDF-UHFFFAOYSA-N 0 3 419.953 4.108 20 0 HIADHN CO[C@@H]1CCC[C@H](CC(=O)Nc2c(C)cnn2[C@@H]2CCN(Cc3ccccc3)C2)C1 ZINC000476414460 891326789 /nfs/dbraw/zinc/32/67/89/891326789.db2.gz WWYOLEHNSZUCHA-BHDDXSALSA-N 0 3 410.562 4.172 20 0 HIADHN CO[C@@H]1CCC[C@@H](CC(=O)Nc2c(C)cnn2[C@H]2CCN(Cc3ccccc3)C2)C1 ZINC000476414461 891327834 /nfs/dbraw/zinc/32/78/34/891327834.db2.gz WWYOLEHNSZUCHA-BHIFYINESA-N 0 3 410.562 4.172 20 0 HIADHN CC[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)NC1CCN(CCOC(C)C)CC1 ZINC000476437375 891348822 /nfs/dbraw/zinc/34/88/22/891348822.db2.gz OXKOEQAHMLOKJU-PKTZIBPZSA-N 0 3 401.595 4.244 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N(C)[C@@H](C)[C@@H](C)c2ccc(Cl)cc2)CC1 ZINC000476437675 891349968 /nfs/dbraw/zinc/34/99/68/891349968.db2.gz RVMBKBSHVYHCEV-MSOLQXFVSA-N 0 3 410.002 4.363 20 0 HIADHN CC[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)NC1CCN(CCOC(C)C)CC1 ZINC000476437377 891350109 /nfs/dbraw/zinc/35/01/09/891350109.db2.gz OXKOEQAHMLOKJU-XZOQPEGZSA-N 0 3 401.595 4.244 20 0 HIADHN O=C(c1ccc(OC(F)F)cn1)N(CCN1CCCC1)Cc1ccc(Cl)cc1 ZINC000476491318 891401585 /nfs/dbraw/zinc/40/15/85/891401585.db2.gz MAKFRAVFIBVLJS-UHFFFAOYSA-N 0 3 409.864 4.075 20 0 HIADHN CCCc1ccc([C@@H](NC(=O)NC[C@H]2CCCN2CCOC)c2cccs2)cc1 ZINC000476495710 891407694 /nfs/dbraw/zinc/40/76/94/891407694.db2.gz YWTPXCOSWWNGLW-IFMALSPDSA-N 0 3 415.603 4.200 20 0 HIADHN CCCSc1nsc(NC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)n1 ZINC000476514142 891426834 /nfs/dbraw/zinc/42/68/34/891426834.db2.gz WRLHPOARGWWNFM-HNNXBMFYSA-N 0 3 405.593 4.169 20 0 HIADHN CN(C)[C@@H](CNC(=O)N1CCC(c2c[nH]c3cc(F)ccc32)CC1)c1ccccc1 ZINC000476600647 891534847 /nfs/dbraw/zinc/53/48/47/891534847.db2.gz SLHFWKSWLAWHRE-QHCPKHFHSA-N 0 3 408.521 4.499 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCC[C@@H](C(F)(F)F)[C@H]1C)c1cccc(OC)c1 ZINC000476713277 891674610 /nfs/dbraw/zinc/67/46/10/891674610.db2.gz GRSRLVYIXHRMHY-ATZDWAIDSA-N 0 3 415.500 4.451 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCC[C@@H](C(F)(F)F)[C@@H]1C)c1cccc(OC)c1 ZINC000476713281 891675540 /nfs/dbraw/zinc/67/55/40/891675540.db2.gz GRSRLVYIXHRMHY-KFKAGJAMSA-N 0 3 415.500 4.451 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CCC[C@]2(C1)OCc1ccccc12)c1ccsc1 ZINC000476864613 891829332 /nfs/dbraw/zinc/82/93/32/891829332.db2.gz UCQVQDRZMJDIPO-JTHBVZDNSA-N 0 3 413.587 4.362 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N2CCC[C@]3(C2)OCc2ccccc23)C1 ZINC000476892657 891851320 /nfs/dbraw/zinc/85/13/20/891851320.db2.gz ZSMRGXHDRCPNFQ-RZTXVSJASA-N 0 3 405.542 4.053 20 0 HIADHN O=C(Nc1cc2c(cc1Cl)OCCCO2)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000504882294 913612088 /nfs/dbraw/zinc/61/20/88/913612088.db2.gz NHRBQUZFWYHAHM-KRWDZBQOSA-N 0 3 415.921 4.287 20 0 HIADHN O=C(NCCc1ccc(Br)s1)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000504882531 913613267 /nfs/dbraw/zinc/61/32/67/913613267.db2.gz OFMNHLRLSBUFGS-INIZCTEOSA-N 0 3 422.392 4.017 20 0 HIADHN O=C(CN1CCC[C@]2(CCCOC2)C1)N1Cc2ccccc2[C@H](c2ccccc2)C1 ZINC000477049637 891978624 /nfs/dbraw/zinc/97/86/24/891978624.db2.gz OUUALPNTMNGWEX-AHWVRZQESA-N 0 3 404.554 4.053 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)c3cccc(Cl)c3F)CC2)c1 ZINC000477321981 892286346 /nfs/dbraw/zinc/28/63/46/892286346.db2.gz RALCHINZPUYBSE-UHFFFAOYSA-N 0 3 403.929 4.120 20 0 HIADHN CN(C(=O)Cc1nc(-c2ccc(F)cc2)cs1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000477349605 892316460 /nfs/dbraw/zinc/31/64/60/892316460.db2.gz GYDDXGTWWZJOKI-HXUWFJFHSA-N 0 3 409.530 4.225 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N[C@@H](C)C2(c3ccccc3)CCCC2)CC1 ZINC000477436139 892385954 /nfs/dbraw/zinc/38/59/54/892385954.db2.gz OJURNXQPPBPACF-FQEVSTJZSA-N 0 3 401.595 4.076 20 0 HIADHN CN(Cc1ccc(OC(F)F)cc1)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000504922417 913657986 /nfs/dbraw/zinc/65/79/86/913657986.db2.gz ATKWAFXXVXYSAU-LJQANCHMSA-N 0 3 403.473 4.094 20 0 HIADHN O[C@@H](COc1ccc(Cl)cc1Cl)CN1CCC[C@@H]1c1ccc2c(c1)OCO2 ZINC000477462765 892429195 /nfs/dbraw/zinc/42/91/95/892429195.db2.gz GCPZFHOAIOKRBE-NVXWUHKLSA-N 0 3 410.297 4.299 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@H](C)N[C@@H](C)c2ccc(F)c(OC)c2)cc1 ZINC000504926830 913665061 /nfs/dbraw/zinc/66/50/61/913665061.db2.gz KRYNWKAQMOEQCU-HOTGVXAUSA-N 0 3 408.539 4.277 20 0 HIADHN COc1ccc([C@H](NS(=O)(=O)c2ccc(CN(C)C)cc2)c2ccc(C)cc2)cc1 ZINC000477537525 892571519 /nfs/dbraw/zinc/57/15/19/892571519.db2.gz MPPZXTPJNWHAAR-XMMPIXPASA-N 0 3 424.566 4.133 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)Nc1cccn(Cc2ccc(C)cc2)c1=O)c1ccco1 ZINC000477584390 892651668 /nfs/dbraw/zinc/65/16/68/892651668.db2.gz CQKPGZFMLGHXRV-NQIIRXRSSA-N 0 3 422.529 4.049 20 0 HIADHN COc1ccc(CNC2(c3ccc(OCc4ccccc4)cc3)CCOCC2)cn1 ZINC000477636078 892757614 /nfs/dbraw/zinc/75/76/14/892757614.db2.gz MAABUSFPYYUPSF-UHFFFAOYSA-N 0 3 404.510 4.465 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)Nc1ccccc1OCC(F)(F)F ZINC000504960073 913697693 /nfs/dbraw/zinc/69/76/93/913697693.db2.gz UBBXGDRTRAERTR-UHFFFAOYSA-N 0 3 417.497 4.111 20 0 HIADHN CC[C@@H](CNC(=O)N1CCC[C@@H]1c1ccc2c(c1)OCO2)N1CCc2ccccc2C1 ZINC000477725810 892827724 /nfs/dbraw/zinc/82/77/24/892827724.db2.gz XPMGLQHDQRWEHX-FCHUYYIVSA-N 0 3 421.541 4.099 20 0 HIADHN CCN(C[C@@H]1CCN([C@H](C)C(=O)N[C@@H](C)c2ccc(Cl)cc2)C1)CC(F)(F)F ZINC000477760718 892849921 /nfs/dbraw/zinc/84/99/21/892849921.db2.gz QAJDYSIEXZOKNW-XHSDSOJGSA-N 0 3 419.919 4.112 20 0 HIADHN C[S@](=O)c1ccc(NC(=O)N[C@@H](CN2CCc3ccccc3C2)C(C)(C)C)cc1 ZINC000477779488 892862543 /nfs/dbraw/zinc/86/25/43/892862543.db2.gz NZSVAVVIURPBAP-LGGPFLRQSA-N 0 3 413.587 4.019 20 0 HIADHN C[C@@H](NC(=O)c1oc2ccccc2c1CN(C)C)c1ccc(Br)cn1 ZINC000477792128 892870193 /nfs/dbraw/zinc/87/01/93/892870193.db2.gz AAJAOWGSVAELJR-GFCCVEGCSA-N 0 3 402.292 4.143 20 0 HIADHN COc1ccc([C@@H](NC(=O)NCC2(N3CCSCC3)CCCC2)C(C)C)cc1 ZINC000504969345 913707678 /nfs/dbraw/zinc/70/76/78/913707678.db2.gz AZWGCWRJLUXAEG-FQEVSTJZSA-N 0 3 405.608 4.053 20 0 HIADHN C[C@H](NC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1)c1ccc(Br)cn1 ZINC000477806335 892878194 /nfs/dbraw/zinc/87/81/94/892878194.db2.gz LUAYOOZTWGZIBJ-GOEBONIOSA-N 0 3 420.326 4.073 20 0 HIADHN Cc1ccc(NC(=O)NCC2(N3CCSCC3)CCCC2)c(Br)c1 ZINC000504971929 913711399 /nfs/dbraw/zinc/71/13/99/913711399.db2.gz YZKZJSSTZFRYRW-UHFFFAOYSA-N 0 3 412.397 4.241 20 0 HIADHN C[C@@H](NC(=O)NCc1ccc(COCC(F)(F)F)cc1)[C@H](c1ccccc1)N(C)C ZINC000477853921 892913914 /nfs/dbraw/zinc/91/39/14/892913914.db2.gz YNFIZEQZKDWEBZ-OXQOHEQNSA-N 0 3 423.479 4.256 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)N[C@@H]1CCCc2[nH]c(=O)ccc21)c1ccc(Cl)cc1 ZINC000477881138 892945447 /nfs/dbraw/zinc/94/54/47/892945447.db2.gz QNNVHORSOBINQT-UXHICEINSA-N 0 3 416.953 4.200 20 0 HIADHN CCN(CC)C(=O)Nc1ccc([C@H](C)N[C@H]2CCN(Cc3ccc(C)cc3)C2=O)cc1 ZINC000477918228 893002583 /nfs/dbraw/zinc/00/25/83/893002583.db2.gz OYDLGMXVGISLDJ-CVDCTZTESA-N 0 3 422.573 4.320 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(OC(F)(F)F)cc1)c1cccc(NS(C)(=O)=O)c1 ZINC000477945907 893034978 /nfs/dbraw/zinc/03/49/78/893034978.db2.gz JNIJKSXFQPJBLR-QWHCGFSZSA-N 0 3 402.438 4.369 20 0 HIADHN C[C@H](N[C@@H](C)c1cccc(NS(C)(=O)=O)c1)c1ccc(OC(F)(F)F)cc1 ZINC000477945909 893035404 /nfs/dbraw/zinc/03/54/04/893035404.db2.gz JNIJKSXFQPJBLR-STQMWFEESA-N 0 3 402.438 4.369 20 0 HIADHN CN(C(=O)N[C@@H]1CCC[C@@H]1c1ccccc1)C1CCN(CCc2ccccn2)CC1 ZINC000477947079 893036858 /nfs/dbraw/zinc/03/68/58/893036858.db2.gz ZFBHWYTWJNWSAA-DNQXCXABSA-N 0 3 406.574 4.066 20 0 HIADHN Cc1nnc(-c2ccc(C(=O)N(CCN3CCCC3)Cc3ccc(Cl)cc3)cc2)o1 ZINC000477958462 893048979 /nfs/dbraw/zinc/04/89/79/893048979.db2.gz GGUAHGLZXAOKST-UHFFFAOYSA-N 0 3 424.932 4.437 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)Nc1ccn(-c2ncccc2C(F)(F)F)n1 ZINC000477971525 893064927 /nfs/dbraw/zinc/06/49/27/893064927.db2.gz VPOGZXYPFZKSQC-UHFFFAOYSA-N 0 3 424.471 4.016 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1cc(OC)cc(OC)c1C)c1cccc(OC)c1 ZINC000504988054 913732505 /nfs/dbraw/zinc/73/25/05/913732505.db2.gz HDIJHPWPRUKUEW-OAQYLSRUSA-N 0 3 415.534 4.225 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)Nc1ccn(-c2ccccc2Cl)n1)c1ccco1 ZINC000478020634 893139476 /nfs/dbraw/zinc/13/94/76/893139476.db2.gz OFSNUPKBQWFVRI-GDBMZVCRSA-N 0 3 401.898 4.370 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1NC(=O)CCN1CCOC2(C1)CCCCCC2 ZINC000478037086 893167585 /nfs/dbraw/zinc/16/75/85/893167585.db2.gz XVEPCMGMVSNZQT-UHFFFAOYSA-N 0 3 410.562 4.243 20 0 HIADHN CCCN(C(=O)[C@H]1CC(=O)Nc2cc(F)ccc21)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000504994391 913738798 /nfs/dbraw/zinc/73/87/98/913738798.db2.gz OLGHYAJQUCOGNX-IRLDBZIGSA-N 0 3 423.532 4.155 20 0 HIADHN CN(C)C[C@@H](NC(=O)Nc1ccn(-c2ccccc2Cl)n1)c1ccc(F)cc1 ZINC000478046592 893191937 /nfs/dbraw/zinc/19/19/37/893191937.db2.gz LOJGFTVSNCOVQI-QGZVFWFLSA-N 0 3 401.873 4.089 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3cccc(-n4cccc4)c3)CC2)C[C@@H](C)O1 ZINC000478081487 893243196 /nfs/dbraw/zinc/24/31/96/893243196.db2.gz VHILGIFTLLPKFR-WOJBJXKFSA-N 0 3 410.562 4.221 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)Nc3cccc(-n4cccc4)c3)CC2)C[C@H](C)O1 ZINC000478081485 893244593 /nfs/dbraw/zinc/24/45/93/893244593.db2.gz VHILGIFTLLPKFR-PMACEKPBSA-N 0 3 410.562 4.221 20 0 HIADHN CCCN(C(=O)c1ccc(F)c(NC(C)=O)c1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000505011627 913755677 /nfs/dbraw/zinc/75/56/77/913755677.db2.gz YAURIGULHZHJBZ-OAQYLSRUSA-N 0 3 411.521 4.301 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)N[C@@H]1C[C@H]1c1ccc(OC(F)F)cc1 ZINC000478208061 893368706 /nfs/dbraw/zinc/36/87/06/893368706.db2.gz PUSIYIMZDGMVLV-FUHWJXTLSA-N 0 3 400.425 4.382 20 0 HIADHN C[C@H](C(=O)Nc1cccc2c1CCN(CC(C)(C)O)C2)c1cn(C)c2ccccc12 ZINC000478245197 893413223 /nfs/dbraw/zinc/41/32/23/893413223.db2.gz ANJKGSVJXKLMHR-KRWDZBQOSA-N 0 3 405.542 4.050 20 0 HIADHN CC(C)(CNC(=O)c1ccccc1NCc1cccnc1)N1CCc2ccccc2C1 ZINC000478269663 893462746 /nfs/dbraw/zinc/46/27/46/893462746.db2.gz LEXOMUCAAMOOMC-UHFFFAOYSA-N 0 3 414.553 4.260 20 0 HIADHN COc1cc(CN[C@H](CC2CCC2)c2ccccc2)cc(Cl)c1OCC(N)=O ZINC000478299041 893515997 /nfs/dbraw/zinc/51/59/97/893515997.db2.gz NATSWOSBTPSSTI-LJQANCHMSA-N 0 3 402.922 4.234 20 0 HIADHN CC[C@H](C)n1ncc(C(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)c1C ZINC000478333461 893568552 /nfs/dbraw/zinc/56/85/52/893568552.db2.gz DWRBGSFSLMEOMF-GHTZIAJQSA-N 0 3 420.561 4.367 20 0 HIADHN CC(C)c1ccc(-c2noc(CCC(=O)N[C@H]3CN(C)C[C@H]3c3ccccc3)n2)cc1 ZINC000478396123 893679887 /nfs/dbraw/zinc/67/98/87/893679887.db2.gz COGJPKCESILFIR-VXKWHMMOSA-N 0 3 418.541 4.007 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)NCc2ccc3cc(OC)ccc3c2)c1 ZINC000478398469 893682439 /nfs/dbraw/zinc/68/24/39/893682439.db2.gz NWXMGDDINCCUBE-UHFFFAOYSA-N 0 3 421.541 4.130 20 0 HIADHN C[C@H](NCc1ccc(N2CCCS2(=O)=O)c(F)c1)c1ccc(C(F)(F)F)cc1 ZINC000478416143 893706380 /nfs/dbraw/zinc/70/63/80/893706380.db2.gz OCOYVBMOSFAKLW-ZDUSSCGKSA-N 0 3 416.440 4.235 20 0 HIADHN COc1cnccc1N1CCN(C(=O)c2ccc(CSc3ccccc3)cc2)CC1 ZINC000478445897 893758735 /nfs/dbraw/zinc/75/87/35/893758735.db2.gz INHVMYAVYACRSO-UHFFFAOYSA-N 0 3 419.550 4.345 20 0 HIADHN COc1ccc([C@@H](NC(=O)N(CCN(C)C)Cc2cccc(OC)c2)C(C)C)cc1 ZINC000478496404 893813133 /nfs/dbraw/zinc/81/31/33/893813133.db2.gz XJLDWYFSNWDNPQ-QHCPKHFHSA-N 0 3 413.562 4.174 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CC2(CCOCC2)c2ccccc21)c1ccsc1 ZINC000478754516 894029957 /nfs/dbraw/zinc/02/99/57/894029957.db2.gz HBTGBPPUAHUFCC-OAQYLSRUSA-N 0 3 413.587 4.409 20 0 HIADHN Cc1cc(Br)cc(Cl)c1C(=O)NCCCCN1C[C@H](C)O[C@@H](C)C1 ZINC000478873737 894151046 /nfs/dbraw/zinc/15/10/46/894151046.db2.gz MKXUKRGLBYRPCE-KBPBESRZSA-N 0 3 417.775 4.030 20 0 HIADHN Cc1cc(C(=O)Nc2cccc(CN3CCC(O)CC3)c2)nn1-c1ccc(Cl)cc1 ZINC000478901491 894182724 /nfs/dbraw/zinc/18/27/24/894182724.db2.gz MSVYPLJBKCSGIJ-UHFFFAOYSA-N 0 3 424.932 4.043 20 0 HIADHN O=C([C@H]1CCCN(Cc2cccc(F)c2)C1)N1CCO[C@@H](c2ccccc2Cl)C1 ZINC000505155407 913846808 /nfs/dbraw/zinc/84/68/08/913846808.db2.gz UBKYPEVGPDFDOF-PGRDOPGGSA-N 0 3 416.924 4.291 20 0 HIADHN CN(C)C[C@@H](NC(=O)Nc1cccc2c1CN(c1ccccn1)C2)c1ccc(F)cc1 ZINC000479030876 894294479 /nfs/dbraw/zinc/29/44/79/894294479.db2.gz YULUDHFQJPYKBV-JOCHJYFZSA-N 0 3 419.504 4.165 20 0 HIADHN CN(C)C(=O)Nc1ccc(CNCC2=Cc3cc(Br)ccc3OC2)cc1 ZINC000479042550 894304174 /nfs/dbraw/zinc/30/41/74/894304174.db2.gz KLRGLBVIJXJIIL-UHFFFAOYSA-N 0 3 416.319 4.108 20 0 HIADHN C[C@H](NCCOc1cccc(Br)c1)c1ccc(Br)cn1 ZINC000479058849 894317469 /nfs/dbraw/zinc/31/74/69/894317469.db2.gz KGIDQNHDZXLSKK-NSHDSACASA-N 0 3 400.114 4.336 20 0 HIADHN CC(C)c1ccccc1OCCNC(=O)N(CCN(C)C)Cc1ccc(F)cc1 ZINC000479196313 894462525 /nfs/dbraw/zinc/46/25/25/894462525.db2.gz WUFXZTJPXLPBID-UHFFFAOYSA-N 0 3 401.526 4.101 20 0 HIADHN CC[C@H](NC(=O)N(CCN(C)C)Cc1cccc(OC)c1)c1ccc(F)cc1F ZINC000479315618 894602951 /nfs/dbraw/zinc/60/29/51/894602951.db2.gz JHBBOIOZSJAGED-NRFANRHFSA-N 0 3 405.489 4.198 20 0 HIADHN Cc1cc(C)c(S(N)(=O)=O)cc1[C@H](C)N[C@@H](C)c1ccc(C(F)(F)F)cc1 ZINC000479332232 894626090 /nfs/dbraw/zinc/62/60/90/894626090.db2.gz SLOBOJMAZGVAFV-KBPBESRZSA-N 0 3 400.466 4.381 20 0 HIADHN Cc1cc(C)c(S(N)(=O)=O)cc1[C@@H](C)NCc1ccc(COc2ccccc2)cc1 ZINC000479385880 894688152 /nfs/dbraw/zinc/68/81/52/894688152.db2.gz GSIUKZMCNSSLPO-LJQANCHMSA-N 0 3 424.566 4.381 20 0 HIADHN COc1cc2c(cc1OC)[C@H](NCc1cc(Br)c(OC)c(OC)c1)CC2 ZINC000479413727 894723593 /nfs/dbraw/zinc/72/35/93/894723593.db2.gz WEKLDAMACIWOMK-MRXNPFEDSA-N 0 3 422.319 4.261 20 0 HIADHN CCS(=O)(=O)c1c(Cl)cccc1CNC1CCC(C(=O)OC(C)(C)C)CC1 ZINC000479442734 894759163 /nfs/dbraw/zinc/75/91/63/894759163.db2.gz XYGLZTKGUWXSRZ-UHFFFAOYSA-N 0 3 415.983 4.124 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCc1ccc(F)cn1)c1ccc(C(F)(F)F)cc1 ZINC000479460396 894782187 /nfs/dbraw/zinc/78/21/87/894782187.db2.gz YTYXYGZGPGLPHX-GOSISDBHSA-N 0 3 412.431 4.122 20 0 HIADHN Cc1c([C@H](C)NC2CC(N3CCC(C(F)(F)F)CC3)C2)nnn1-c1ccccc1 ZINC000479495262 894814296 /nfs/dbraw/zinc/81/42/96/894814296.db2.gz GBKUEYCLZMZWJI-STJZUHDESA-N 0 3 407.484 4.032 20 0 HIADHN C[C@@H]1CN(Cc2ccccn2)CC[C@@H]1Nc1ccc(NC(=O)c2ccccc2)cn1 ZINC000479535590 894840312 /nfs/dbraw/zinc/84/03/12/894840312.db2.gz AGKXSRQUSNFTKF-GCJKJVERSA-N 0 3 401.514 4.051 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCc3c(Cl)cccc3OC)c(C)c2)CC1 ZINC000479551701 894850719 /nfs/dbraw/zinc/85/07/19/894850719.db2.gz GMLGDCOGBPMJLX-UHFFFAOYSA-N 0 3 416.953 4.121 20 0 HIADHN COc1c(Br)cccc1CNc1ccc(N2CCN(C)CC2)cc1C ZINC000479571039 894864617 /nfs/dbraw/zinc/86/46/17/894864617.db2.gz QQUSQBVVHWLKGS-UHFFFAOYSA-N 0 3 404.352 4.130 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)NCc1csc(-c2ccco2)n1 ZINC000479605519 894882313 /nfs/dbraw/zinc/88/23/13/894882313.db2.gz WKRHYXIBODWOGM-UHFFFAOYSA-N 0 3 412.559 4.109 20 0 HIADHN O=C1NC2(CCCC2)C(=O)N1CCNCc1ccc(-c2cccc(Cl)c2Cl)o1 ZINC000479608049 894882472 /nfs/dbraw/zinc/88/24/72/894882472.db2.gz DANCNAKRQYVPDO-UHFFFAOYSA-N 0 3 422.312 4.208 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N(CCC(F)(F)F)Cc2ccccc2)CC1 ZINC000479681791 894965808 /nfs/dbraw/zinc/96/58/08/894965808.db2.gz BLYHKWDXCUOHHB-UHFFFAOYSA-N 0 3 415.500 4.040 20 0 HIADHN Cc1onc(-c2cccc(Cl)c2)c1C(=O)NCCCN1CCc2ccccc2C1 ZINC000479688803 894975210 /nfs/dbraw/zinc/97/52/10/894975210.db2.gz QAIJRDMRELUPDU-UHFFFAOYSA-N 0 3 409.917 4.482 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)N1C[C@H](c2ccccc2)[C@H]2COCC[C@H]21 ZINC000479742908 895043459 /nfs/dbraw/zinc/04/34/59/895043459.db2.gz FKCMFSQQCOOTBN-ZGFBMJKBSA-N 0 3 419.569 4.038 20 0 HIADHN C[C@@H]1CCN(C(=O)NCc2ncoc2-c2ccccc2)CCN1Cc1ccccc1 ZINC000479751481 895051570 /nfs/dbraw/zinc/05/15/70/895051570.db2.gz RHAPSLIGEQDPQZ-LJQANCHMSA-N 0 3 404.514 4.148 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)NCCc1ccc(-n2nc(C)cc2C)cc1)c1ccco1 ZINC000479758364 895058373 /nfs/dbraw/zinc/05/83/73/895058373.db2.gz LBLURZKCBOBRGO-VGOFRKELSA-N 0 3 423.561 4.053 20 0 HIADHN COc1cc(OC)c([C@@H](C)NC[C@H](c2cccs2)N2CCOCC2)cc1Cl ZINC000479849174 895182581 /nfs/dbraw/zinc/18/25/81/895182581.db2.gz HJMHCBQDLVAGBB-RHSMWYFYSA-N 0 3 410.967 4.143 20 0 HIADHN COC[C@@H](NC[C@@H](c1cccs1)N1CCOCC1)c1cccc(C(F)(F)F)c1 ZINC000479856241 895190772 /nfs/dbraw/zinc/19/07/72/895190772.db2.gz WDCKUCNZNUXBNJ-MSOLQXFVSA-N 0 3 414.493 4.118 20 0 HIADHN COc1ccc([C@@H](CN[C@H](C)c2ccc(F)cc2Cl)N2CCOCC2)cc1OC ZINC000479890601 895236237 /nfs/dbraw/zinc/23/62/37/895236237.db2.gz VRODHPJFTLYUDI-FOIQADDNSA-N 0 3 422.928 4.220 20 0 HIADHN CCCCCOc1ccc(C(=O)NCc2ccccc2CN2CCC(O)CC2)cc1 ZINC000479958047 895311821 /nfs/dbraw/zinc/31/18/21/895311821.db2.gz CCCWZBQJRKKALG-UHFFFAOYSA-N 0 3 410.558 4.142 20 0 HIADHN Cc1csc(C(=O)Nc2ccc(C(=O)N(C)[C@H]3CCCN(C)C3)cc2)c1Cl ZINC000480025720 895373989 /nfs/dbraw/zinc/37/39/89/895373989.db2.gz YCLPJLXAINQRQM-INIZCTEOSA-N 0 3 405.951 4.128 20 0 HIADHN Cc1c(C(F)(F)F)nn(C)c1NC(=O)N[C@@H](CN(C)Cc1ccccc1)C(C)C ZINC000480050789 895398686 /nfs/dbraw/zinc/39/86/86/895398686.db2.gz ZEZXJPYMPQMRIH-INIZCTEOSA-N 0 3 411.472 4.025 20 0 HIADHN COc1ccc([C@@H](CN[C@H](C)c2nnn(-c3ccccc3)c2C)N2CCCC2)cc1 ZINC000480079861 895436205 /nfs/dbraw/zinc/43/62/05/895436205.db2.gz DTJDHKPWMGSTGH-WZONZLPQSA-N 0 3 405.546 4.072 20 0 HIADHN C[C@@H](NC[C@H](c1ccc(F)cc1)N1CCOCC1)c1ccc(F)cc1OC(F)F ZINC000480082185 895438113 /nfs/dbraw/zinc/43/81/13/895438113.db2.gz PQHHAEUBAMNLNV-AUUYWEPGSA-N 0 3 412.427 4.290 20 0 HIADHN CC(C)c1c(C(=O)N2CC[C@@H](N3CCCCC3)C2)cnn1-c1ccccc1Cl ZINC000480083214 895443035 /nfs/dbraw/zinc/44/30/35/895443035.db2.gz PQTMGRMXKRXBHS-QGZVFWFLSA-N 0 3 400.954 4.350 20 0 HIADHN Cc1ccc(CC[C@H](C)N[C@H]2CCS(=O)(=O)c3ccc(Br)cc32)o1 ZINC000480186386 895580584 /nfs/dbraw/zinc/58/05/84/895580584.db2.gz XTIWRKJSWPRMIS-SJCJKPOMSA-N 0 3 412.349 4.180 20 0 HIADHN CCS[C@@H]1CCCC[C@H]1N[C@@H]1CCS(=O)(=O)c2ccc(Br)cc21 ZINC000480198220 895595926 /nfs/dbraw/zinc/59/59/26/895595926.db2.gz ONOHNRBPDUZDQC-BZUAXINKSA-N 0 3 418.422 4.322 20 0 HIADHN COc1ccc(OC)c([C@@H](C)NC[C@@H](c2ccccc2Cl)N2CCOCC2)c1 ZINC000480262495 895670488 /nfs/dbraw/zinc/67/04/88/895670488.db2.gz KNLZUJPVWUMMCV-IERDGZPVSA-N 0 3 404.938 4.081 20 0 HIADHN CCOC(=O)c1csc(CCNCc2cc(Br)c(Cl)s2)n1 ZINC000480261543 895670499 /nfs/dbraw/zinc/67/04/99/895670499.db2.gz JNMBPTKRDLHSSK-UHFFFAOYSA-N 0 3 409.758 4.130 20 0 HIADHN CCn1cc([C@H]2OCCC[C@@H]2NCc2cc(Br)c(Cl)s2)cn1 ZINC000480269438 895677072 /nfs/dbraw/zinc/67/70/72/895677072.db2.gz WIWFRSDLQSQUAF-UONOGXRCSA-N 0 3 404.761 4.390 20 0 HIADHN COc1cc(F)c([C@@H](C)NC[C@@H](c2ccccc2Cl)N2CCOCC2)cc1OC ZINC000480272218 895681083 /nfs/dbraw/zinc/68/10/83/895681083.db2.gz BGCAFFMPXRVHPY-QRWLVFNGSA-N 0 3 422.928 4.220 20 0 HIADHN Clc1sc(CNC[C@H]2CC[C@@H](c3nc(C4CC4)no3)O2)cc1Br ZINC000480287469 895692479 /nfs/dbraw/zinc/69/24/79/895692479.db2.gz JXRIBCAPXNJLSE-SKDRFNHKSA-N 0 3 418.744 4.434 20 0 HIADHN CC[C@@H](C(=O)N1CCC(NCc2ccc(Br)o2)CC1)c1ccccc1 ZINC000480331448 895734356 /nfs/dbraw/zinc/73/43/56/895734356.db2.gz GUMWKJLFHLSDAQ-GOSISDBHSA-N 0 3 405.336 4.317 20 0 HIADHN CCN(Cc1ccc(OC)cc1OC)C(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000480374264 895780137 /nfs/dbraw/zinc/78/01/37/895780137.db2.gz HBFBUFWQODUGKR-IBGZPJMESA-N 0 3 417.575 4.134 20 0 HIADHN CC[C@@H](C)[C@@H](NCc1ccc(N(C)CC)nc1)C(=O)Nc1cccc(N2CCCC2)c1 ZINC000480386174 895791729 /nfs/dbraw/zinc/79/17/29/895791729.db2.gz KYFAMXIDVAKEHQ-NTKDMRAZSA-N 0 3 423.605 4.281 20 0 HIADHN c1cn(-c2ccccc2)c(CNC2CCN(Cc3coc(-c4ccccc4)n3)CC2)n1 ZINC000480388414 895794864 /nfs/dbraw/zinc/79/48/64/895794864.db2.gz IDHSAWQSZOVCKS-UHFFFAOYSA-N 0 3 413.525 4.282 20 0 HIADHN COc1cc([C@@H](C)N[C@H](CN2CCOCC2)c2ccc(C)cc2)ccc1SC ZINC000480413318 895812459 /nfs/dbraw/zinc/81/24/59/895812459.db2.gz FTLIEUYQFWIPSK-WIYYLYMNSA-N 0 3 400.588 4.450 20 0 HIADHN COc1ccc(OCCN[C@H](C)c2ccc(S(=O)(=O)C3CCCC3)cc2)cc1 ZINC000480436166 895827468 /nfs/dbraw/zinc/82/74/68/895827468.db2.gz HYZNMWBEEZJWBQ-QGZVFWFLSA-N 0 3 403.544 4.141 20 0 HIADHN COC(=O)c1csc(-c2cccc(CNCc3cc4ccccc4[nH]c3=O)c2)n1 ZINC000480449409 895838139 /nfs/dbraw/zinc/83/81/39/895838139.db2.gz YOPONVZQWGMGRC-UHFFFAOYSA-N 0 3 405.479 4.140 20 0 HIADHN Fc1cc(Br)cc2c1CC[C@@H]2N[C@@H](CN1CCOCC1)c1ccccc1 ZINC000480451767 895840003 /nfs/dbraw/zinc/84/00/03/895840003.db2.gz YHMNRXJHAWZJLL-SFTDATJTSA-N 0 3 419.338 4.239 20 0 HIADHN COC(=O)c1csc(-c2cccc(CNCc3cn(C)nc3-c3ccccc3)c2)n1 ZINC000480459554 895844815 /nfs/dbraw/zinc/84/48/15/895844815.db2.gz HWPJKUZBNNPJMN-UHFFFAOYSA-N 0 3 418.522 4.287 20 0 HIADHN C[C@@H](N[C@@H](CN1CCOCC1)c1ccccc1)c1ccc(OCC(F)(F)F)cc1 ZINC000480465538 895848150 /nfs/dbraw/zinc/84/81/50/895848150.db2.gz FXGRFDBVIKFQEK-UTKZUKDTSA-N 0 3 408.464 4.352 20 0 HIADHN C[C@H](N[C@@H](CN1CCOCC1)c1ccccc1)c1ccc(OCC(F)(F)F)cc1 ZINC000480465540 895848547 /nfs/dbraw/zinc/84/85/47/895848547.db2.gz FXGRFDBVIKFQEK-UWJYYQICSA-N 0 3 408.464 4.352 20 0 HIADHN COC(=O)c1csc(-c2cccc(CNCc3c[nH]nc3-c3ccc(C)o3)c2)n1 ZINC000480480423 895859009 /nfs/dbraw/zinc/85/90/09/895859009.db2.gz WSSVADBLVCMAHD-UHFFFAOYSA-N 0 3 408.483 4.178 20 0 HIADHN CCOc1cc(CNCc2cccc(-c3nc(C(=O)OC)cs3)c2)ccc1OC ZINC000480483861 895860258 /nfs/dbraw/zinc/86/02/58/895860258.db2.gz YJAYNCWVNNFCCX-UHFFFAOYSA-N 0 3 412.511 4.294 20 0 HIADHN C[C@@H](NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)nc1)c1ccc(OCC(F)(F)F)cc1 ZINC000480600277 895962214 /nfs/dbraw/zinc/96/22/14/895962214.db2.gz GVGHCJGJOIHLMD-BRWVUGGUSA-N 0 3 423.479 4.487 20 0 HIADHN C[C@H](NCc1ccc(N2C[C@@H](C)O[C@@H](C)C2)nc1)c1ccc(OCC(F)(F)F)cc1 ZINC000480600276 895962611 /nfs/dbraw/zinc/96/26/11/895962611.db2.gz GVGHCJGJOIHLMD-BBWFWOEESA-N 0 3 423.479 4.487 20 0 HIADHN COc1cc([C@@H](C)NCc2ccc(N3C[C@@H](C)O[C@@H](C)C3)nc2)ccc1SC ZINC000480599726 895962670 /nfs/dbraw/zinc/96/26/70/895962670.db2.gz COLJXDXDDJPBGS-IXDOHACOSA-N 0 3 401.576 4.277 20 0 HIADHN CCOc1ccc([C@@H](C)NCc2ccc(N3C[C@@H](C)O[C@@H](C)C3)nc2)cc1OCC ZINC000480622726 895991100 /nfs/dbraw/zinc/99/11/00/895991100.db2.gz WCVUSYDEXYDYFH-CEXWTWQISA-N 0 3 413.562 4.343 20 0 HIADHN C[C@H](NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)nc1)c1cccc(OC(F)(F)F)c1 ZINC000480623896 895992656 /nfs/dbraw/zinc/99/26/56/895992656.db2.gz XRWPTRVUBZAUPX-OAGGEKHMSA-N 0 3 409.452 4.445 20 0 HIADHN COc1cccc(C[C@H](NCc2ccc(N3CCO[C@@H](C)C3)nc2)c2ccccc2)c1 ZINC000480630766 895998750 /nfs/dbraw/zinc/99/87/50/895998750.db2.gz LHMKEXSTKFDMJP-CPJSRVTESA-N 0 3 417.553 4.389 20 0 HIADHN CC(C)Sc1ccc([C@H](C)NCc2ccc(C(=O)N3CCN(C)CC3)cc2)cc1 ZINC000480630813 895999017 /nfs/dbraw/zinc/99/90/17/895999017.db2.gz LSVCCFRXUKDWHX-IBGZPJMESA-N 0 3 411.615 4.426 20 0 HIADHN COc1cccc(C[C@@H](NCc2ccc(N3CCO[C@@H](C)C3)nc2)c2ccccc2)c1 ZINC000480630767 895999325 /nfs/dbraw/zinc/99/93/25/895999325.db2.gz LHMKEXSTKFDMJP-NBGIEHNGSA-N 0 3 417.553 4.389 20 0 HIADHN COc1ccc(CCNC(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)cc1F ZINC000480641627 896011066 /nfs/dbraw/zinc/01/10/66/896011066.db2.gz BRRNEUPERONHFX-IBGZPJMESA-N 0 3 419.566 4.211 20 0 HIADHN Cc1nc(-c2cccnc2)sc1[C@@H](C)NCc1ccc(N2C[C@@H](C)O[C@@H](C)C2)nc1 ZINC000480643733 896012489 /nfs/dbraw/zinc/01/24/89/896012489.db2.gz OWVUXWASNJIPBE-IXDOHACOSA-N 0 3 423.586 4.373 20 0 HIADHN Cc1cc(NC(=O)N(C)CCCN(C)Cc2ccco2)cnc1N1CCCC[C@H]1C ZINC000480656152 896024069 /nfs/dbraw/zinc/02/40/69/896024069.db2.gz WBIOXOQOMMLZFW-LJQANCHMSA-N 0 3 413.566 4.348 20 0 HIADHN C[C@H](c1ccccc1)N1CCC(NS(=O)(=O)Cc2ccc(Cl)c(F)c2)CC1 ZINC000480660112 896028275 /nfs/dbraw/zinc/02/82/75/896028275.db2.gz OGBHQMJAOXQFQQ-OAHLLOKOSA-N 0 3 410.942 4.124 20 0 HIADHN Brc1ccc(N2CC[C@@H](CNCc3nccn3-c3ccccc3)C2)cc1 ZINC000480670152 896034253 /nfs/dbraw/zinc/03/42/53/896034253.db2.gz YEYREFQYFFAYND-KRWDZBQOSA-N 0 3 411.347 4.251 20 0 HIADHN CCC[C@@H](NCc1ccc(N2CCCS2(=O)=O)c(F)c1)c1ccc(OC)cc1 ZINC000480677664 896040631 /nfs/dbraw/zinc/04/06/31/896040631.db2.gz RAFJJFFGLBNIHJ-HXUWFJFHSA-N 0 3 406.523 4.005 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)N1CCC[C@H]1c1ccc2c(c1)OCO2 ZINC000480690140 896053007 /nfs/dbraw/zinc/05/30/07/896053007.db2.gz ZXGJMAYBGCUFHN-SFTDATJTSA-N 0 3 407.514 4.099 20 0 HIADHN CCN1CCN(c2c(C)c(C)nc3ccc(Br)cc32)C[C@H]1c1ncc[nH]1 ZINC000480692543 896054384 /nfs/dbraw/zinc/05/43/84/896054384.db2.gz IODLASLGTHSRGZ-SFHVURJKSA-N 0 3 414.351 4.220 20 0 HIADHN Cc1ccccc1NC(=O)C[C@H](C)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1=O ZINC000480694792 896058684 /nfs/dbraw/zinc/05/86/84/896058684.db2.gz PWHCZRSMJSZEJW-YJBOKZPZSA-N 0 3 419.447 4.126 20 0 HIADHN O=S1(=O)CCCN1c1ccc(CN[C@H](c2ccc(Cl)cc2)C2CC2)cc1F ZINC000480705481 896067509 /nfs/dbraw/zinc/06/75/09/896067509.db2.gz DLBUXWRUVNWKSM-FQEVSTJZSA-N 0 3 408.926 4.260 20 0 HIADHN Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)NCc1ccnc(N2CCN(C)CC2)c1 ZINC000480709819 896072336 /nfs/dbraw/zinc/07/23/36/896072336.db2.gz NQLHRWQWWDRMDR-SFHVURJKSA-N 0 3 421.614 4.425 20 0 HIADHN C[C@H](NCc1ccnc(N2CCN(C)CC2)c1)c1ccc(OCc2ccccc2)cc1 ZINC000480717767 896077912 /nfs/dbraw/zinc/07/79/12/896077912.db2.gz MYYSIKOMBPBABG-NRFANRHFSA-N 0 3 416.569 4.263 20 0 HIADHN CC[C@@H](C)n1nc(NC(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)cc1C ZINC000480751365 896113717 /nfs/dbraw/zinc/11/37/17/896113717.db2.gz UHOKSZKOVASDSE-OXQOHEQNSA-N 0 3 401.555 4.374 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(-n2cnnn2)cc1)c1cccc(NC(=O)c2ccccc2)c1 ZINC000480753322 896115390 /nfs/dbraw/zinc/11/53/90/896115390.db2.gz IKDPASHLVJGIKF-ZWKOTPCHSA-N 0 3 412.497 4.326 20 0 HIADHN C[C@@H](N[C@H](C)c1cccc(NC(=O)c2ccccc2)c1)c1ccc(-n2cnnn2)cc1 ZINC000480753318 896115900 /nfs/dbraw/zinc/11/59/00/896115900.db2.gz IKDPASHLVJGIKF-QZTJIDSGSA-N 0 3 412.497 4.326 20 0 HIADHN C[C@H](N[C@@H](c1cc(F)cc(Br)c1)C1CC1)c1ccc(-n2cnnn2)cc1 ZINC000480758380 896120403 /nfs/dbraw/zinc/12/04/03/896120403.db2.gz NMRQMZIORGWIEL-HXPMCKFVSA-N 0 3 416.298 4.366 20 0 HIADHN C[C@H](NCc1cccc(Cn2ccnc2)c1)c1ccc(S(=O)(=O)C2CCCC2)cc1 ZINC000480787993 896154067 /nfs/dbraw/zinc/15/40/67/896154067.db2.gz QLWFDOOIZHHBFR-IBGZPJMESA-N 0 3 423.582 4.499 20 0 HIADHN COCCOc1ccc([C@@H](C)NCc2cccc(NC(=O)c3ccccn3)c2)cc1 ZINC000480887953 896244228 /nfs/dbraw/zinc/24/42/28/896244228.db2.gz GLWGPGACICJQAG-GOSISDBHSA-N 0 3 405.498 4.210 20 0 HIADHN CC(C)NC(=O)Nc1ccc(CN[C@H](C)c2ccc(NC(=O)NC3CC3)cc2)cc1 ZINC000480915736 896274258 /nfs/dbraw/zinc/27/42/58/896274258.db2.gz TYFMSFBRGIOYJM-MRXNPFEDSA-N 0 3 409.534 4.351 20 0 HIADHN C[C@@H](NCc1cccc(NC(=O)CCN2CCOCC2)c1)c1ccc2c(c1)CCCC2 ZINC000480921216 896278193 /nfs/dbraw/zinc/27/81/93/896278193.db2.gz PFRIVUSDHNPWDJ-HXUWFJFHSA-N 0 3 421.585 4.077 20 0 HIADHN COC(=O)c1cc(NC(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)cc(Cl)c1F ZINC000480971393 896309685 /nfs/dbraw/zinc/30/96/85/896309685.db2.gz NNPULICFYOHAKT-SGTLLEGYSA-N 0 3 407.873 4.079 20 0 HIADHN COc1ccc([C@@H](Cc2ccccc2C)N[C@@H]2CCCN(C(C)C)C2=O)cc1OC ZINC000481064555 896385452 /nfs/dbraw/zinc/38/54/52/896385452.db2.gz VJBVFEPFCDODBU-FGZHOGPDSA-N 0 3 410.558 4.285 20 0 HIADHN CCCCN1Cc2cccc(N[C@@H]3CCN(c4cc(OC)cc(OC)c4)C3=O)c2C1 ZINC000481080585 896400962 /nfs/dbraw/zinc/40/09/62/896400962.db2.gz YBALDVPOFOLXEV-HSZRJFAPSA-N 0 3 409.530 4.037 20 0 HIADHN CC[C@H](c1ccccc1OC)N(C)C(=O)NCC1(N2CCSCC2)CCCC1 ZINC000481100665 896423776 /nfs/dbraw/zinc/42/37/76/896423776.db2.gz FHLRDHTZHXPTPW-LJQANCHMSA-N 0 3 405.608 4.149 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)NCc1cc(Br)cs1)c1ccco1 ZINC000481123316 896449786 /nfs/dbraw/zinc/44/97/86/896449786.db2.gz XFQFVEGEQVRMAA-FZMZJTMJSA-N 0 3 400.342 4.032 20 0 HIADHN Cc1nn(C)c(=O)c(-c2nc(CN[C@@H]3CCCC[C@@H]3Cc3ccccc3)cs2)c1C ZINC000481183531 896528360 /nfs/dbraw/zinc/52/83/60/896528360.db2.gz QXWYDHGZZIDDLS-TZIWHRDSSA-N 0 3 422.598 4.412 20 0 HIADHN COc1cc([C@H](C)N[C@@H]2CCc3c2cc(Br)cc3F)ccc1OCCO ZINC000481185874 896532608 /nfs/dbraw/zinc/53/26/08/896532608.db2.gz VEAANCVWVGRXLH-KPZWWZAWSA-N 0 3 424.310 4.306 20 0 HIADHN COC(=O)CCSCc1cccc(NC(=O)c2cccc(CN3CCCC3)c2)c1 ZINC000505412419 914075908 /nfs/dbraw/zinc/07/59/08/914075908.db2.gz ASBOVQXZXFEFOC-UHFFFAOYSA-N 0 3 412.555 4.331 20 0 HIADHN C[C@H](NC[C@H](c1cccc(F)c1)N1CCOCC1)c1ccc(F)cc1OC(F)F ZINC000481231814 896583796 /nfs/dbraw/zinc/58/37/96/896583796.db2.gz IJYPKJXRAFWZAX-IFXJQAMLSA-N 0 3 412.427 4.290 20 0 HIADHN Cc1ccsc1[C@@H](Cc1ccccc1)NCc1cccnc1N1CCN(C)CC1 ZINC000481239605 896590499 /nfs/dbraw/zinc/59/04/99/896590499.db2.gz GJYJVWZWSGETMD-JOCHJYFZSA-N 0 3 406.599 4.277 20 0 HIADHN Cc1nc(-c2ccccc2)ncc1C(=O)N1CCCN(CCCc2ccccc2)CC1 ZINC000481290781 896636715 /nfs/dbraw/zinc/63/67/15/896636715.db2.gz WQVZYDIEUCYZTR-UHFFFAOYSA-N 0 3 414.553 4.233 20 0 HIADHN CC[C@H](NCc1ccc(S(=O)(=O)N2CCC[C@@H](C)C2)cc1)c1ccc(OC)cc1 ZINC000481301040 896645468 /nfs/dbraw/zinc/64/54/68/896645468.db2.gz XFBIWULRZXJKPI-JPYJTQIMSA-N 0 3 416.587 4.357 20 0 HIADHN C[C@@H]1CCCN(S(=O)(=O)c2ccc(CN[C@@H]3CCCc4sccc43)cc2)C1 ZINC000481302011 896647146 /nfs/dbraw/zinc/64/71/46/896647146.db2.gz BQXXDJXBXZAFEQ-OXQOHEQNSA-N 0 3 404.601 4.336 20 0 HIADHN Cc1nc(Cc2ccccc2)sc1[C@H](C)NCc1cccc(OCC(=O)N(C)C)c1 ZINC000481308154 896654671 /nfs/dbraw/zinc/65/46/71/896654671.db2.gz AUWNLHVODHLBNU-KRWDZBQOSA-N 0 3 423.582 4.360 20 0 HIADHN C[C@H](NCc1ccnc(N2CCCCC2)c1)c1ccc(OCc2nccn2C)cc1 ZINC000481313240 896661714 /nfs/dbraw/zinc/66/17/14/896661714.db2.gz KCNXYORFQRWUQX-IBGZPJMESA-N 0 3 405.546 4.235 20 0 HIADHN CCCOCc1ccccc1CN[C@H](C)c1cccc(N2CCCS2(=O)=O)c1 ZINC000481319966 896672646 /nfs/dbraw/zinc/67/26/46/896672646.db2.gz URWQZHZLVIASOT-GOSISDBHSA-N 0 3 402.560 4.004 20 0 HIADHN C[C@H](NCc1cccc(OCC(=O)N(C)C)c1)c1ccc(SCC(F)F)cc1 ZINC000481319238 896673045 /nfs/dbraw/zinc/67/30/45/896673045.db2.gz TWWVAHYBHCMENW-HNNXBMFYSA-N 0 3 408.514 4.362 20 0 HIADHN C[C@@H](NC1CCN(Cc2ccccn2)CC1)c1ccccc1I ZINC000481335573 896697538 /nfs/dbraw/zinc/69/75/38/896697538.db2.gz YSSAOJSGNFUBRV-OAHLLOKOSA-N 0 3 421.326 4.001 20 0 HIADHN CN(C)C[C@@H](NC(=O)Nc1ccc(OC(F)F)c2cccnc12)c1ccc(F)cc1 ZINC000481342016 896709554 /nfs/dbraw/zinc/70/95/54/896709554.db2.gz GYVAAZLOVCXMSP-QGZVFWFLSA-N 0 3 418.419 4.400 20 0 HIADHN C[C@@H](NCc1cccc(OCCN2CCOCC2)c1)c1ccc(OC(F)(F)F)cc1 ZINC000481423501 896825299 /nfs/dbraw/zinc/82/52/99/896825299.db2.gz VKNOQHTXGGTVTD-QGZVFWFLSA-N 0 3 424.463 4.147 20 0 HIADHN COc1cccc([C@@H](CNC(=O)Nc2ccnn2[C@H](C)CC(C)C)N2CCCC2)c1 ZINC000481479972 896865291 /nfs/dbraw/zinc/86/52/91/896865291.db2.gz KWBRIJRJXMXHBY-WIYYLYMNSA-N 0 3 413.566 4.457 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)Nc1nnc(-c2ccc(OC)cc2)s1)c1ccco1 ZINC000481486669 896867927 /nfs/dbraw/zinc/86/79/27/896867927.db2.gz RJNFYCVLPCRBHU-CZUORRHYSA-N 0 3 415.519 4.058 20 0 HIADHN Cc1c([C@H](C)NCc2cccc(CN3CCO[C@H](C)C3)c2)cnn1-c1ccc(F)cc1 ZINC000481534701 896895710 /nfs/dbraw/zinc/89/57/10/896895710.db2.gz OJJPUSLKZGWGIZ-MOPGFXCFSA-N 0 3 422.548 4.391 20 0 HIADHN COc1ccc2c(c1)[C@H](NC[C@@H](O)COc1cccc(Cl)c1Cl)CCCO2 ZINC000481538963 896897846 /nfs/dbraw/zinc/89/78/46/896897846.db2.gz XLKPLIYUBGFZQV-CXAGYDPISA-N 0 3 412.313 4.245 20 0 HIADHN C[C@H](NC[C@@H](O)COc1cccc(Cl)c1Cl)c1cnn(Cc2ccccc2)c1 ZINC000481546049 896907570 /nfs/dbraw/zinc/90/75/70/896907570.db2.gz KSEKAZAVBOEUGF-MAUKXSAKSA-N 0 3 420.340 4.329 20 0 HIADHN COC[C@@H](NCc1cccc(CN2CCO[C@@H](C)C2)c1)c1cccc(C(F)(F)F)c1 ZINC000481550284 896916892 /nfs/dbraw/zinc/91/68/92/896916892.db2.gz CFEYEFKOLXUEQL-HTAPYJJXSA-N 0 3 422.491 4.403 20 0 HIADHN CC[C@@H](NC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2)c1ccc(Cl)cc1Cl ZINC000481556710 896928610 /nfs/dbraw/zinc/92/86/10/896928610.db2.gz JKHZSQVPEBNINC-DNVCBOLYSA-N 0 3 423.340 4.359 20 0 HIADHN COc1ccc(C2(CN[C@@H](C)c3nnn(-c4ccc(C)cc4)c3C)CCOCC2)cc1 ZINC000481560755 896934700 /nfs/dbraw/zinc/93/47/00/896934700.db2.gz WIMKFRQQVPCGHD-IBGZPJMESA-N 0 3 420.557 4.292 20 0 HIADHN O=C(Nc1cccc(CN[C@@H]2CCc3ccc(OC(F)(F)F)cc32)c1)[C@@H]1CCCO1 ZINC000481561604 896938219 /nfs/dbraw/zinc/93/82/19/896938219.db2.gz KOVPDWWCOUBFSZ-UXHICEINSA-N 0 3 420.431 4.480 20 0 HIADHN O=C(Nc1cccc(CN[C@@H]2CCc3cc(Br)ccc32)c1)[C@@H]1CCCO1 ZINC000481569932 896948972 /nfs/dbraw/zinc/94/89/72/896948972.db2.gz KMCGVMAFLUNGEU-UXHICEINSA-N 0 3 415.331 4.344 20 0 HIADHN COc1ccccc1NC(=O)c1ccc(NC(=O)[C@@H](C)N2CCCC[C@@H](C)C2)cc1 ZINC000481579788 896959129 /nfs/dbraw/zinc/95/91/29/896959129.db2.gz IPPIUMXVNXNOBA-QZTJIDSGSA-N 0 3 409.530 4.397 20 0 HIADHN Cc1cc(NC(=O)c2cc3ccccc3[nH]c2=O)cc(N2CCN(C(C)C)CC2)c1 ZINC000481632080 897015887 /nfs/dbraw/zinc/01/58/87/897015887.db2.gz MRTLZZTXWKWDGN-UHFFFAOYSA-N 0 3 404.514 4.032 20 0 HIADHN Cc1oc2ccc(NC(=O)N[C@@H]3CCN(Cc4ccccc4)C[C@H]3CO)cc2c1C ZINC000481641958 897026130 /nfs/dbraw/zinc/02/61/30/897026130.db2.gz NQIFJCXFKITHDT-SIKLNZKXSA-N 0 3 407.514 4.054 20 0 HIADHN Cc1cc(NC(=O)c2cccc(NC(=O)C3CC3)c2)cc(N2CCN(C(C)C)CC2)c1 ZINC000481650066 897034337 /nfs/dbraw/zinc/03/43/37/897034337.db2.gz LFNVMXVTMQGHRP-UHFFFAOYSA-N 0 3 420.557 4.126 20 0 HIADHN CC[C@H](N[C@H](c1ccccc1)[C@H]1CCOC1)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000481659772 897043067 /nfs/dbraw/zinc/04/30/67/897043067.db2.gz JULHVBCZVKYQLL-HFSMHLIXSA-N 0 3 422.978 4.067 20 0 HIADHN Cc1cc(NC(=O)c2cccc([C@@H]3CCOC3)c2)cc(N2CCN(C(C)C)CC2)c1 ZINC000481669841 897053820 /nfs/dbraw/zinc/05/38/20/897053820.db2.gz NNRAXHDWBGQWRR-JOCHJYFZSA-N 0 3 407.558 4.282 20 0 HIADHN COc1ccc2c(CC(=O)Nc3cc(C)cc(N4CCN(C(C)C)CC4)c3)coc2c1 ZINC000481678007 897060520 /nfs/dbraw/zinc/06/05/20/897060520.db2.gz OQGCIHHNONODOK-UHFFFAOYSA-N 0 3 421.541 4.461 20 0 HIADHN CC(=O)N1CCC[C@@H](CN[C@H](C(=O)Nc2ccc(C)c(Cl)c2)c2ccccc2)C1 ZINC000481682355 897065512 /nfs/dbraw/zinc/06/55/12/897065512.db2.gz BCRIXSZOSRXJMX-AVRDEDQJSA-N 0 3 413.949 4.176 20 0 HIADHN CC[C@H](CN(CC)[C@@H](C)C(=O)Nc1cc(NC(C)=O)ccc1OC)c1ccccc1 ZINC000481696773 897084293 /nfs/dbraw/zinc/08/42/93/897084293.db2.gz VIYIWKDOAGMMPL-PKOBYXMFSA-N 0 3 411.546 4.496 20 0 HIADHN CC[C@@H](CN(CC)[C@@H](C)C(=O)Nc1cc(NC(C)=O)ccc1OC)c1ccccc1 ZINC000481696768 897084659 /nfs/dbraw/zinc/08/46/59/897084659.db2.gz VIYIWKDOAGMMPL-HKUYNNGSSA-N 0 3 411.546 4.496 20 0 HIADHN C[C@H](Cc1ccccc1C(F)(F)F)NCc1nnc2ccc(C(F)(F)F)cn21 ZINC000481916153 897298551 /nfs/dbraw/zinc/29/85/51/897298551.db2.gz WXXHDJPMWSHBGJ-LLVKDONJSA-N 0 3 402.342 4.488 20 0 HIADHN CN(C)C[C@H](NC(=O)Nc1cccc(-n2cc(C(F)(F)F)cn2)c1)c1ccccc1 ZINC000481942167 897329217 /nfs/dbraw/zinc/32/92/17/897329217.db2.gz GMHPMSDQFGBGKS-IBGZPJMESA-N 0 3 417.435 4.316 20 0 HIADHN Cc1ccc(I)cc1NC(=O)NC[C@@H](c1ccccc1)N(C)C ZINC000481962307 897351542 /nfs/dbraw/zinc/35/15/42/897351542.db2.gz WTYRSWRWZCFUCV-KRWDZBQOSA-N 0 3 423.298 4.024 20 0 HIADHN COc1ccc(-c2ccncc2)cc1CN1CCC(NC(=O)NC2CCCCC2)CC1 ZINC000482007293 897405123 /nfs/dbraw/zinc/40/51/23/897405123.db2.gz KNUMAJFALLOKMZ-UHFFFAOYSA-N 0 3 422.573 4.354 20 0 HIADHN CCCn1ncc(C(=O)Nc2cc(C)cc(N3CCN(C(C)C)CC3)c2)c1C1CC1 ZINC000482017681 897420337 /nfs/dbraw/zinc/42/03/37/897420337.db2.gz RFEHOQTXEOJKNT-UHFFFAOYSA-N 0 3 409.578 4.262 20 0 HIADHN COc1ccc(CCN[C@@H](C)c2nnn(-c3ccc(F)cc3)c2C)cc1OC(F)F ZINC000482042562 897461688 /nfs/dbraw/zinc/46/16/88/897461688.db2.gz NXLJYTZDUBCDTH-ZDUSSCGKSA-N 0 3 420.435 4.218 20 0 HIADHN CN(C)[C@H](CNC(=O)Nc1ccc(OC(F)F)c2cccnc12)c1ccccc1 ZINC000482091331 897534621 /nfs/dbraw/zinc/53/46/21/897534621.db2.gz VBLCYGUXPUMWAR-QGZVFWFLSA-N 0 3 400.429 4.261 20 0 HIADHN C[C@H](NCc1cccc(COC(C)(C)C)c1)c1cccc(N2CCCS2(=O)=O)c1 ZINC000482092518 897535682 /nfs/dbraw/zinc/53/56/82/897535682.db2.gz YZWHFDMOJZENGQ-SFHVURJKSA-N 0 3 416.587 4.392 20 0 HIADHN O=C([C@@H](Cc1ccccc1)N[C@@H]1CCc2cc(Br)ccc21)N1CCCC1 ZINC000482121703 897575676 /nfs/dbraw/zinc/57/56/76/897575676.db2.gz OAEFYJVXVUCBSU-NHCUHLMSSA-N 0 3 413.359 4.260 20 0 HIADHN CCO[C@H]1C[C@@H](NCC(=O)Nc2cc3c(cc2Cl)OCCCO3)C1(CC)CC ZINC000482144714 897605120 /nfs/dbraw/zinc/60/51/20/897605120.db2.gz BKURJUYEQHRLCP-MOPGFXCFSA-N 0 3 410.942 4.013 20 0 HIADHN Cc1ccc(-c2nnc([C@@H](C)NCC3(N4CCSCC4)CCCCC3)o2)cc1 ZINC000482172915 897640172 /nfs/dbraw/zinc/64/01/72/897640172.db2.gz ZSVPRYFXSNPOKV-GOSISDBHSA-N 0 3 400.592 4.447 20 0 HIADHN Cc1cc(C(=O)NC2CCN(CCOc3ccc(Cl)cc3)CC2)c(F)cc1F ZINC000482310719 897809744 /nfs/dbraw/zinc/80/97/44/897809744.db2.gz KWBXZKRITKNGJK-UHFFFAOYSA-N 0 3 408.876 4.200 20 0 HIADHN COc1ccc([C@H](NC(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)C(F)(F)F)cc1 ZINC000482328082 897830794 /nfs/dbraw/zinc/83/07/94/897830794.db2.gz IRDONRZZUJADTK-CVAIRZPRSA-N 0 3 421.463 4.433 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)N[C@@H](c3cccc(C(F)(F)F)c3)C(F)(F)F)[C@@H]2C1 ZINC000482335208 897840102 /nfs/dbraw/zinc/84/01/02/897840102.db2.gz PMRKZUWNGXFCRE-DFBGVHRSSA-N 0 3 409.374 4.044 20 0 HIADHN Cc1cc(C)n(-c2ccc(C(=O)N[C@H](CN3CCCC3)c3ccccc3)cc2F)n1 ZINC000482358828 897875151 /nfs/dbraw/zinc/87/51/51/897875151.db2.gz DXPUJPZJNPZBAP-JOCHJYFZSA-N 0 3 406.505 4.195 20 0 HIADHN COC[C@@H](C)Oc1ccc(Cl)cc1NC(=O)N[C@@H](CN(C)C)c1ccc(F)cc1 ZINC000482393865 897926895 /nfs/dbraw/zinc/92/68/95/897926895.db2.gz PKYXSLMRQLVMFF-KUHUBIRLSA-N 0 3 423.916 4.317 20 0 HIADHN O=C(N[C@@H](c1c(F)cccc1F)C(F)(F)F)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000482421844 897974138 /nfs/dbraw/zinc/97/41/38/897974138.db2.gz CLIGHADNDRIKIJ-KDOFPFPSSA-N 0 3 413.390 4.142 20 0 HIADHN CC(C)CN(CCN(C)C)C(=O)N[C@@H](c1ccccc1OC(F)F)C(F)(F)F ZINC000482428920 897983640 /nfs/dbraw/zinc/98/36/40/897983640.db2.gz WAYIONJXFAOTEW-HNNXBMFYSA-N 0 3 411.415 4.121 20 0 HIADHN CC(C)CCC[C@@H](NCc1cccnc1N1CCC(C(N)=O)CC1)c1ccccc1 ZINC000482455745 898024849 /nfs/dbraw/zinc/02/48/49/898024849.db2.gz QVUJRDCLJODQDA-HSZRJFAPSA-N 0 3 408.590 4.441 20 0 HIADHN CCO[C@@H]1C[C@@H](NCc2ccccc2OCc2ccccn2)[C@H]1Oc1ccccc1 ZINC000482494819 898073777 /nfs/dbraw/zinc/07/37/77/898073777.db2.gz GJPTVPYMWJUZJZ-QLBJFCOMSA-N 0 3 404.510 4.375 20 0 HIADHN CCO[C@@H]1C[C@H](NCc2ccccc2OCc2ccncc2)[C@@H]1Oc1ccccc1 ZINC000482496261 898075418 /nfs/dbraw/zinc/07/54/18/898075418.db2.gz SOYQXNDPHCGIQR-CAOCKLPOSA-N 0 3 404.510 4.375 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(-n2cccn2)cc1)c1cc(F)ccc1N1CCN(C)CC1 ZINC000482542728 898131974 /nfs/dbraw/zinc/13/19/74/898131974.db2.gz YQQFFRUBAAGWQU-RBUKOAKNSA-N 0 3 407.537 4.175 20 0 HIADHN CC[C@H](N[C@@H](C)c1cc(F)ccc1N1CCN(C)CC1)c1ccc2c(c1)OCCO2 ZINC000482565131 898157736 /nfs/dbraw/zinc/15/77/36/898157736.db2.gz MPMXLKGMYSRVLJ-UWJYYQICSA-N 0 3 413.537 4.151 20 0 HIADHN CCOc1ccc(-c2noc(CCC(=O)Nc3cc(CN(C)C)ccc3C)n2)cc1 ZINC000482578241 898175235 /nfs/dbraw/zinc/17/52/35/898175235.db2.gz GIMHCVCEAYPWPU-UHFFFAOYSA-N 0 3 408.502 4.077 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)[C@@H]1CC(=O)N(c2cc(Cl)cc(Cl)c2)C1 ZINC000482598010 898200470 /nfs/dbraw/zinc/20/04/70/898200470.db2.gz QECZPACABPVACD-OAHLLOKOSA-N 0 3 420.340 4.355 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1cc(CC2CC2)nn1-c1ccccc1 ZINC000482603318 898204024 /nfs/dbraw/zinc/20/40/24/898204024.db2.gz BIGDDRLIWHIJIF-UHFFFAOYSA-N 0 3 407.518 4.014 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)N1CCC[C@@]2(C1)OCc1ccccc12 ZINC000482632369 898236122 /nfs/dbraw/zinc/23/61/22/898236122.db2.gz QGIIZNGKIYOGDA-ZCYQVOJMSA-N 0 3 405.542 4.055 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)c1nnn(-c2ccc(F)cc2)c1C(F)(F)F ZINC000482634025 898237372 /nfs/dbraw/zinc/23/73/72/898237372.db2.gz SWVAIRDMMZCUQS-UHFFFAOYSA-N 0 3 421.398 4.048 20 0 HIADHN CCc1c(NC(=O)c2ccc(CN3CCC(CO)CC3)cc2)cnn1C(CC)CC ZINC000482715344 898315463 /nfs/dbraw/zinc/31/54/63/898315463.db2.gz GOYPTAMLJCUKQF-UHFFFAOYSA-N 0 3 412.578 4.263 20 0 HIADHN O=C(N[C@@H](c1nccs1)c1ccccc1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000505546014 914245420 /nfs/dbraw/zinc/24/54/20/914245420.db2.gz ATCLAFAISRWZHS-PZJWPPBQSA-N 0 3 409.530 4.400 20 0 HIADHN CCCN(C(=O)NCCCN1CCc2ccccc2C1)[C@@H]1CCCc2cccnc21 ZINC000482769504 898376964 /nfs/dbraw/zinc/37/69/64/898376964.db2.gz RHVRSGBJYZEWLI-HSZRJFAPSA-N 0 3 406.574 4.329 20 0 HIADHN CCCOc1cn(-c2ccccc2)nc1C(=O)N1C[C@H]2CCCN2Cc2ccccc21 ZINC000482835238 898443920 /nfs/dbraw/zinc/44/39/20/898443920.db2.gz AXHJVCDRVLAKQO-OAQYLSRUSA-N 0 3 416.525 4.286 20 0 HIADHN O=C(c1cnc(-c2ccc3c(c2)OCO3)s1)N1C[C@H]2CCCN2Cc2ccccc21 ZINC000482840739 898450885 /nfs/dbraw/zinc/45/08/85/898450885.db2.gz MKYIICMUEOAOJC-QGZVFWFLSA-N 0 3 419.506 4.164 20 0 HIADHN CN(C)Cc1cccc(NC(=O)CSc2nnc(-c3cccs3)n2C2CC2)c1 ZINC000482869073 898481507 /nfs/dbraw/zinc/48/15/07/898481507.db2.gz OBIROFHADVGQSA-UHFFFAOYSA-N 0 3 413.572 4.134 20 0 HIADHN C[C@@H](N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1)c1ccc(-n2cncn2)cc1 ZINC000482881719 898495510 /nfs/dbraw/zinc/49/55/10/898495510.db2.gz FCRCRXMUBXATNP-DVECYGJZSA-N 0 3 411.509 4.168 20 0 HIADHN CN1CCN(C)[C@@H](CN[C@H](Cc2cccc(F)c2)c2ccc(Cl)c(Cl)c2)C1 ZINC000482886453 898500819 /nfs/dbraw/zinc/50/08/19/898500819.db2.gz NXVLKKSJVABYOR-GHTZIAJQSA-N 0 3 410.364 4.252 20 0 HIADHN C[C@H](NCc1cccc(COC2CCOCC2)c1)c1cccc(N2CCCC2=O)c1 ZINC000482887769 898504615 /nfs/dbraw/zinc/50/46/15/898504615.db2.gz JDUDFKVDECXKMG-IBGZPJMESA-N 0 3 408.542 4.360 20 0 HIADHN Cc1cccc(CC2(O)CCN(C[C@@H](O)COc3ccc(Cl)cc3Cl)CC2)c1 ZINC000482933728 898557236 /nfs/dbraw/zinc/55/72/36/898557236.db2.gz XRYSYFVDGLZQBC-LJQANCHMSA-N 0 3 424.368 4.111 20 0 HIADHN CO[C@]1(C)CCCN(CC(=O)NC[C@@H](c2c[nH]c3ccccc32)c2ccccc2)CC1 ZINC000483038488 898705416 /nfs/dbraw/zinc/70/54/16/898705416.db2.gz UQSWUXNDKTZCFE-ATIYNZHBSA-N 0 3 419.569 4.307 20 0 HIADHN CCOC(=O)c1c2c(sc1NC(=O)[C@H]1CCC(F)(F)C1)C(C)(C)NC(C)(C)C2 ZINC000483055178 898727464 /nfs/dbraw/zinc/72/74/64/898727464.db2.gz XZQYNJSWFSKLMM-NSHDSACASA-N 0 3 414.518 4.458 20 0 HIADHN C[C@H](NC(=O)[C@@H]1CCn2c(cnc2C2CCCCC2)C1)[C@@H](c1ccccc1)N(C)C ZINC000505580461 914286643 /nfs/dbraw/zinc/28/66/43/914286643.db2.gz GQTGZYXWGQUTPO-ZEYPLWLESA-N 0 3 408.590 4.301 20 0 HIADHN Cc1cc(C)n(-c2ccc(C(=O)NC[C@H](c3ccccc3)N3CCCC3)cc2F)n1 ZINC000483160970 898832693 /nfs/dbraw/zinc/83/26/93/898832693.db2.gz BAIUYQZOHWZTLS-HSZRJFAPSA-N 0 3 406.505 4.195 20 0 HIADHN OC[C@H](NC[C@@H](O)C1CCCCC1)c1ccc(Br)cc1C(F)(F)F ZINC000483247457 898889978 /nfs/dbraw/zinc/88/99/78/898889978.db2.gz XFQYGEBFLJMLHZ-JKSUJKDBSA-N 0 3 410.274 4.032 20 0 HIADHN C[C@@H](NC(=O)Cc1ccc(OCc2ccccn2)cc1)[C@H](c1ccccc1)N(C)C ZINC000505588911 914294825 /nfs/dbraw/zinc/29/48/25/914294825.db2.gz WGKXELRDASBBST-KBMIEXCESA-N 0 3 403.526 4.011 20 0 HIADHN COCCN(C)c1ccc(CN(Cc2cccc(-c3cccnc3)c2)C2CC2)cn1 ZINC000483289136 898924865 /nfs/dbraw/zinc/92/48/65/898924865.db2.gz CFCOWPGDPFICOF-UHFFFAOYSA-N 0 3 402.542 4.391 20 0 HIADHN C[C@@H](NC(=O)c1cc(OC(F)F)cc(OC(F)F)c1)[C@@H](c1ccccc1)N(C)C ZINC000505592934 914300170 /nfs/dbraw/zinc/30/01/70/914300170.db2.gz WBTFRUBNHUGZSE-PXAZEXFGSA-N 0 3 414.399 4.311 20 0 HIADHN CC(C)N(C)C(=O)c1ccc(Cl)c(NC(=O)N2CCN(C3CCCCC3)CC2)c1 ZINC000483341335 898971356 /nfs/dbraw/zinc/97/13/56/898971356.db2.gz URDZOGZKZKSPNB-UHFFFAOYSA-N 0 3 420.985 4.303 20 0 HIADHN CS[C@@H]1CN(C(=O)c2oc3c(cccc3Br)c2C)C[C@H]1N1CCCC1 ZINC000483386390 899021145 /nfs/dbraw/zinc/02/11/45/899021145.db2.gz AQQFLSLBPJNURQ-HZPDHXFCSA-N 0 3 423.376 4.156 20 0 HIADHN CS[C@H]1CN(C(=O)c2sc(-c3ccc(Cl)cc3)nc2C)C[C@@H]1N1CCCC1 ZINC000483390976 899025486 /nfs/dbraw/zinc/02/54/86/899025486.db2.gz FCYLDJVJJPGOGR-IRXDYDNUSA-N 0 3 422.019 4.424 20 0 HIADHN CS[C@@H]1CN(C(=O)c2sc(-c3ccc(Cl)cc3)nc2C)C[C@@H]1N1CCCC1 ZINC000483390974 899026495 /nfs/dbraw/zinc/02/64/95/899026495.db2.gz FCYLDJVJJPGOGR-DLBZAZTESA-N 0 3 422.019 4.424 20 0 HIADHN CS[C@@H]1CN(C(=O)[C@@H](C)c2cccc(C(=O)c3ccccc3)c2)C[C@H]1N1CCCC1 ZINC000483398333 899032320 /nfs/dbraw/zinc/03/23/20/899032320.db2.gz XQHREEINDAUHLX-CDNPAEQRSA-N 0 3 422.594 4.059 20 0 HIADHN Cc1noc(C)c1COc1ccc(CC(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)cc1 ZINC000505604337 914308691 /nfs/dbraw/zinc/30/86/91/914308691.db2.gz ORUZFYPDXYHENI-CJAUYULYSA-N 0 3 421.541 4.221 20 0 HIADHN CO[C@@H](c1ccccc1Cl)[C@@H](C)NC(=O)N(Cc1ccco1)C1CCN(C)CC1 ZINC000483418504 899048727 /nfs/dbraw/zinc/04/87/27/899048727.db2.gz NZBMTEJURBCJRF-IIBYNOLFSA-N 0 3 419.953 4.315 20 0 HIADHN Cc1ccc(-c2nn(-c3ccc(F)cc3)cc2CN2CC[C@H](N3CCCC3=O)C2)cc1 ZINC000483434497 899065981 /nfs/dbraw/zinc/06/59/81/899065981.db2.gz APKQEEAKVKSLSL-QHCPKHFHSA-N 0 3 418.516 4.184 20 0 HIADHN Cc1ccc(-c2nn(-c3ccc(F)cc3)cc2CN2CC[C@@H](N3CCCC3=O)C2)cc1 ZINC000483434495 899067114 /nfs/dbraw/zinc/06/71/14/899067114.db2.gz APKQEEAKVKSLSL-HSZRJFAPSA-N 0 3 418.516 4.184 20 0 HIADHN O=C1CCCN1[C@H]1CCN(Cc2ccc(-c3cccc(Br)c3)s2)C1 ZINC000483435821 899068189 /nfs/dbraw/zinc/06/81/89/899068189.db2.gz RQRKMSDMWBBQRU-INIZCTEOSA-N 0 3 405.361 4.374 20 0 HIADHN C[C@H](NC(=O)CCc1nnc(-c2cc3ccccc3o2)o1)[C@H](c1ccccc1)N(C)C ZINC000505608301 914311537 /nfs/dbraw/zinc/31/15/37/914311537.db2.gz MWLLVOAUIUIXOZ-QMHKHESXSA-N 0 3 418.497 4.223 20 0 HIADHN Cc1ccc(-c2nn(Cc3ccccc3)cc2CN2CC[C@H](N3CCCC3=O)C2)cc1 ZINC000483440566 899075011 /nfs/dbraw/zinc/07/50/11/899075011.db2.gz OJOMQWSNVOATJP-DEOSSOPVSA-N 0 3 414.553 4.104 20 0 HIADHN Cc1ccc([C@@H](NC(=O)CN2CCN(C3CCCCC3)CC2)c2cccs2)cc1 ZINC000483487660 899139576 /nfs/dbraw/zinc/13/95/76/899139576.db2.gz RNYAFEGUYDNGMN-XMMPIXPASA-N 0 3 411.615 4.212 20 0 HIADHN CN(C(=O)CN1CCN(C2CCCCC2)CC1)[C@H](c1ccccc1)c1ccc(F)cc1 ZINC000483489687 899141940 /nfs/dbraw/zinc/14/19/40/899141940.db2.gz KFAAXWLXEDQORO-AREMUKBSSA-N 0 3 423.576 4.324 20 0 HIADHN Cc1ccc(NC(=O)[C@@H](C)N2CCN(C3CCCCC3)CC2)c(Br)c1 ZINC000483504424 899165510 /nfs/dbraw/zinc/16/55/10/899165510.db2.gz XGNOZMPGKAGKOP-MRXNPFEDSA-N 0 3 408.384 4.035 20 0 HIADHN CN(C)C[C@@H](NC(=O)Nc1cc(F)cc(Br)c1F)c1ccc(F)cc1 ZINC000483548313 899209212 /nfs/dbraw/zinc/20/92/12/899209212.db2.gz KMJCQCQROAYJEP-OAHLLOKOSA-N 0 3 416.241 4.291 20 0 HIADHN C[C@H]1CCN(C(=O)Nc2ccc(OCC(F)F)cc2)CCN1Cc1ccccc1 ZINC000483586437 899237183 /nfs/dbraw/zinc/23/71/83/899237183.db2.gz AHGDTMLCBYQNAN-KRWDZBQOSA-N 0 3 403.473 4.459 20 0 HIADHN Cc1nc(SCC(=O)Nc2ccc(C)cc2CN(C)C)[nH]c1Cc1ccccc1 ZINC000505638292 914339157 /nfs/dbraw/zinc/33/91/57/914339157.db2.gz SKCBTMZPGZJZEX-UHFFFAOYSA-N 0 3 408.571 4.410 20 0 HIADHN Cc1[nH]c(SCC(=O)Nc2ccc(C)cc2CN(C)C)nc1Cc1ccccc1 ZINC000505638292 914339177 /nfs/dbraw/zinc/33/91/77/914339177.db2.gz SKCBTMZPGZJZEX-UHFFFAOYSA-N 0 3 408.571 4.410 20 0 HIADHN CO[C@@H]1CCCC[C@H]1NCC(=O)N(Cc1ccccc1)c1nc2c(s1)CCCC2 ZINC000483709622 899366148 /nfs/dbraw/zinc/36/61/48/899366148.db2.gz LDJGAXSMVHEHEW-UYAOXDASSA-N 0 3 413.587 4.102 20 0 HIADHN CCCCCn1nc(C(=O)Nc2ccc(C)cc2CN(C)C)c2ccccc2c1=O ZINC000505640289 914340886 /nfs/dbraw/zinc/34/08/86/914340886.db2.gz WLXLSQSPLNJMAH-UHFFFAOYSA-N 0 3 406.530 4.209 20 0 HIADHN CO[C@@H]1CCCC[C@@H]1NCC(=O)N1N=C(c2cc3ccccc3o2)C[C@H]1c1ccco1 ZINC000483723540 899382877 /nfs/dbraw/zinc/38/28/77/899382877.db2.gz KTEHKBDQHFCWAA-HFSMHLIXSA-N 0 3 421.497 4.251 20 0 HIADHN COc1ccccc1[C@H](C)NCc1cc(C(F)(F)F)ccc1N1CCN(C)CC1 ZINC000483730882 899391879 /nfs/dbraw/zinc/39/18/79/899391879.db2.gz OUGHIAMSZUBXPO-INIZCTEOSA-N 0 3 407.480 4.317 20 0 HIADHN CC(C)N(CCN(C)C)C(=O)N[C@@H](c1cc(F)cc(Br)c1)C1CC1 ZINC000483794991 899466690 /nfs/dbraw/zinc/46/66/90/899466690.db2.gz RXKJYFGHZBHOAH-QGZVFWFLSA-N 0 3 400.336 4.021 20 0 HIADHN C[C@H](NC(=O)Nc1cc(-c2ccc(F)cc2F)nn1C)[C@@H](c1ccccc1)N(C)C ZINC000483800147 899473133 /nfs/dbraw/zinc/47/31/33/899473133.db2.gz FYLUMIOIDVVBPX-QKKBWIMNSA-N 0 3 413.472 4.178 20 0 HIADHN CC[C@@H]1Oc2cc([C@@H](C)N[C@H](C)c3cc(OC)c(OC)c(OC)c3)ccc2NC1=O ZINC000483850038 899530865 /nfs/dbraw/zinc/53/08/65/899530865.db2.gz OEMACUCIKCUYEW-LBTNJELSSA-N 0 3 414.502 4.234 20 0 HIADHN CC[C@@H]1Oc2cc([C@H](C)N[C@H](C)c3cc(OC)c(OC)c(OC)c3)ccc2NC1=O ZINC000483850037 899531102 /nfs/dbraw/zinc/53/11/02/899531102.db2.gz OEMACUCIKCUYEW-IYOUNJFTSA-N 0 3 414.502 4.234 20 0 HIADHN Cc1c(C(=O)Nc2ccc(C)cc2CN(C)C)sc2nc3n(c(=O)c12)CCCCC3 ZINC000505658799 914356934 /nfs/dbraw/zinc/35/69/34/914356934.db2.gz KEOXFFPUVUNDKK-UHFFFAOYSA-N 0 3 424.570 4.115 20 0 HIADHN CC[C@@H]1Oc2cc([C@H](C)N[C@H](C)c3cccc(N4CCCC4=O)c3)ccc2NC1=O ZINC000483868226 899548740 /nfs/dbraw/zinc/54/87/40/899548740.db2.gz GPTRULJKPZXURD-XFQAVAEZSA-N 0 3 407.514 4.335 20 0 HIADHN CCCN(C)[C@H](CNC(=O)Nc1ccc2c(c1)CC(=O)N2C)c1ccc(Cl)cc1 ZINC000483875256 899553012 /nfs/dbraw/zinc/55/30/12/899553012.db2.gz DRGDTXTXLWZAAI-HXUWFJFHSA-N 0 3 414.937 4.064 20 0 HIADHN CN(C)CCN(C(=O)c1ccc(COc2ccccc2Br)cc1)C1CC1 ZINC000505662363 914359561 /nfs/dbraw/zinc/35/95/61/914359561.db2.gz WPKOTNRXOIUUBN-UHFFFAOYSA-N 0 3 417.347 4.194 20 0 HIADHN CC[C@@H](CNC(=O)N(Cc1ccco1)C1CCN(C)CC1)Oc1ccccc1Cl ZINC000483994971 899635345 /nfs/dbraw/zinc/63/53/45/899635345.db2.gz RQNFVOCODJYFET-SFHVURJKSA-N 0 3 419.953 4.396 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)NC[C@@H]1CCCC[C@H]1C(F)(F)F ZINC000484048933 899680354 /nfs/dbraw/zinc/68/03/54/899680354.db2.gz VZVMJLUVDRJEMN-JKSUJKDBSA-N 0 3 421.454 4.407 20 0 HIADHN C[C@@H](NCCC(=O)Nc1cccnc1)c1cccc(NC(=O)Cc2ccccc2F)c1 ZINC000484073200 899706047 /nfs/dbraw/zinc/70/60/47/899706047.db2.gz PGZWOWZZJWJYIC-QGZVFWFLSA-N 0 3 420.488 4.081 20 0 HIADHN CN(C)[C@H](CNC(=O)NC(C)(C)c1ccc(Br)cc1)c1ccccc1 ZINC000505677969 914370819 /nfs/dbraw/zinc/37/08/19/914370819.db2.gz NWUVZGMDJSTRDZ-GOSISDBHSA-N 0 3 404.352 4.286 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)Nc1nnc(/C=C\c2ccco2)s1 ZINC000484093503 899723672 /nfs/dbraw/zinc/72/36/72/899723672.db2.gz CVMKARVYIMHDQK-HJWRWDBZSA-N 0 3 415.494 4.036 20 0 HIADHN Cc1cc(NC(=O)c2oc(C(C)C)nc2C)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000484160628 899780474 /nfs/dbraw/zinc/78/04/74/899780474.db2.gz PMPCTYQUFLYOQS-IBGZPJMESA-N 0 3 407.518 4.311 20 0 HIADHN COC1CCC(CN[C@H](C)c2nnn(-c3cccc(Br)c3)c2C)CC1 ZINC000484286258 899853207 /nfs/dbraw/zinc/85/32/07/899853207.db2.gz XLTNXXNYWZMJCO-MJJDPTRDSA-N 0 3 407.356 4.194 20 0 HIADHN CSc1cccc(N(C(=O)C[C@H](C)n2nc(C)cc2C)C2CCN(C)CC2)c1 ZINC000484407233 899930371 /nfs/dbraw/zinc/93/03/71/899930371.db2.gz RRZIOSZZOBGFAH-SFHVURJKSA-N 0 3 400.592 4.300 20 0 HIADHN CSc1cccc(N(C(=O)c2cn(-c3ccc(C)cc3)nn2)C2CCN(C)CC2)c1 ZINC000484406964 899930719 /nfs/dbraw/zinc/93/07/19/899930719.db2.gz MTYSSLYIKBAPTA-UHFFFAOYSA-N 0 3 421.570 4.039 20 0 HIADHN COc1ccc2c(c1)[C@@H](NCCC(=O)Nc1cc(Cl)ccc1OC)CCCO2 ZINC000484483031 899975787 /nfs/dbraw/zinc/97/57/87/899975787.db2.gz LDJUTMIHKVDFGK-KRWDZBQOSA-N 0 3 404.894 4.189 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)CCN[C@@H](C)c1cccc(N2CCCC2=O)c1 ZINC000484487469 899979981 /nfs/dbraw/zinc/97/99/81/899979981.db2.gz DCFVBDKVTLVXJF-HNNXBMFYSA-N 0 3 415.921 4.155 20 0 HIADHN COc1cc(OC)cc(N2CC[C@@H](N[C@@H](C)c3cc(Cl)c(OC)cc3OC)C2)c1 ZINC000484489974 899981250 /nfs/dbraw/zinc/98/12/50/899981250.db2.gz KALBRWQWZLCYEM-LSDHHAIUSA-N 0 3 420.937 4.304 20 0 HIADHN COc1cc(OC)cc(N2CC[C@@H](N[C@H](C)c3cc(Cl)c(OC)cc3OC)C2)c1 ZINC000484489972 899981681 /nfs/dbraw/zinc/98/16/81/899981681.db2.gz KALBRWQWZLCYEM-HUUCEWRRSA-N 0 3 420.937 4.304 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(OCC2CC2)c(F)c1)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000484508452 899999380 /nfs/dbraw/zinc/99/93/80/899999380.db2.gz PIOIQJWCLNLVCP-CVEARBPZSA-N 0 3 420.550 4.277 20 0 HIADHN COCCOc1ccc([C@H](C)NCc2ccccc2-n2nc(C)cc2C)cc1OC ZINC000484519501 900007784 /nfs/dbraw/zinc/00/77/84/900007784.db2.gz KDUPACIOSPJTAQ-IBGZPJMESA-N 0 3 409.530 4.374 20 0 HIADHN CC(C)([C@@H](NC[C@@H](O)COc1ccccc1F)c1ccc(F)c(F)c1)N1CCCC1 ZINC000484527221 900014195 /nfs/dbraw/zinc/01/41/95/900014195.db2.gz ATXPHKJHITXFCK-VGSWGCGISA-N 0 3 422.491 4.049 20 0 HIADHN CC(C)([C@@H](NCC[S@@](=O)c1ccccc1)c1ccc(F)c(F)c1)N1CCCC1 ZINC000484528847 900015928 /nfs/dbraw/zinc/01/59/28/900015928.db2.gz CQUQVJLDHLDWDY-RBTNQOKQSA-N 0 3 406.542 4.278 20 0 HIADHN O=[S@](CCN[C@@H](Cn1cnc2ccccc21)c1ccc(F)cc1)c1ccccc1 ZINC000484557523 900033804 /nfs/dbraw/zinc/03/38/04/900033804.db2.gz VHKRFMWGFDJZPH-PZGXJGMVSA-N 0 3 407.514 4.314 20 0 HIADHN CCc1nnc(C2CCN([C@@H](C(=O)Nc3ccc(C)cc3)c3ccccc3)CC2)[nH]1 ZINC000484742868 900167022 /nfs/dbraw/zinc/16/70/22/900167022.db2.gz RZYWZBVXRKPNBM-JOCHJYFZSA-N 0 3 403.530 4.235 20 0 HIADHN CCOc1cc(CNC(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)ccc1OC(F)F ZINC000484764340 900178729 /nfs/dbraw/zinc/17/87/29/900178729.db2.gz PSCDGOSAOVIILC-YWZLYKJASA-N 0 3 421.488 4.177 20 0 HIADHN O=S(=O)([N-]C1CC[NH+](C2CCCC2)CC1)c1ccc(Cl)cc1C(F)(F)F ZINC000484778403 900189230 /nfs/dbraw/zinc/18/92/30/900189230.db2.gz UFTZXBLZZOODKP-UHFFFAOYSA-N 0 3 410.889 4.044 20 0 HIADHN CCOc1c(Cl)cc(CNC(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)cc1OC ZINC000484840126 900240373 /nfs/dbraw/zinc/24/03/73/900240373.db2.gz WDDBIOYZWQJOGR-FOIQADDNSA-N 0 3 419.953 4.238 20 0 HIADHN Cc1ccc(C(C)(C)C(=O)NCCCCN2CCN(c3cccc(C)c3)CC2)cc1 ZINC000484845138 900242425 /nfs/dbraw/zinc/24/24/25/900242425.db2.gz HMEXHKXIKNWDSA-UHFFFAOYSA-N 0 3 407.602 4.300 20 0 HIADHN COc1ccccc1[C@@H](C)CC(=O)NCCCCN1CCN(c2cccc(C)c2)CC1 ZINC000484844531 900243104 /nfs/dbraw/zinc/24/31/04/900243104.db2.gz GAKGPLZXWRWHAZ-QFIPXVFZSA-N 0 3 423.601 4.216 20 0 HIADHN CCOc1ccccc1NC(=O)CCN1CCC(C(=O)c2ccc(OC)cc2)CC1 ZINC000484983301 900339026 /nfs/dbraw/zinc/33/90/26/900339026.db2.gz AFQLSRHMWBKLPC-UHFFFAOYSA-N 0 3 410.514 4.017 20 0 HIADHN CCOc1ccccc1NC(=O)CCN(C)[C@@H]1c2cc(Cl)cc(Cl)c2C[C@@H]1O ZINC000484988970 900343672 /nfs/dbraw/zinc/34/36/72/900343672.db2.gz UADGIRRPIZNJID-GHTZIAJQSA-N 0 3 423.340 4.311 20 0 HIADHN CN(C)[C@H](CNC(=O)NCc1ccc(COc2ccccc2)cc1)c1ccccc1 ZINC000505772059 914439457 /nfs/dbraw/zinc/43/94/57/914439457.db2.gz JVMBPBDMYIMEMD-XMMPIXPASA-N 0 3 403.526 4.368 20 0 HIADHN CC[C@H](C)NC(=O)[C@@H]1C[C@H](C)N(Cc2csc(N(C)C3CC3)n2)[C@@H]2CCCC[C@@H]12 ZINC000485091337 900403238 /nfs/dbraw/zinc/40/32/38/900403238.db2.gz FYPMJIJERHKCFS-WPCMGHOJSA-N 0 3 418.651 4.426 20 0 HIADHN CC(C)c1c(NC(=O)N[C@H](C)C2=CCN(C)CC2)cnn1-c1ccccc1Cl ZINC000485150375 900450549 /nfs/dbraw/zinc/45/05/49/900450549.db2.gz STTZTTIALUWTKD-OAHLLOKOSA-N 0 3 401.942 4.421 20 0 HIADHN CCc1c(NC(=O)N2CCC(CN3C[C@H](C)O[C@@H](C)C3)CC2)cnn1C(CC)CC ZINC000485210122 900500271 /nfs/dbraw/zinc/50/02/71/900500271.db2.gz RDEUYMKWQMOBGC-ROUUACIJSA-N 0 3 419.614 4.160 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3cccc(Oc4ccncc4)c3)CC2)C[C@@H](C)O1 ZINC000485317049 900596260 /nfs/dbraw/zinc/59/62/60/900596260.db2.gz JFWZTUMSYHCEQL-RTBURBONSA-N 0 3 424.545 4.227 20 0 HIADHN O=C(Cc1cc(Cl)ccc1Cl)Nc1ccc(C(=O)NCCN2CCCC2)cc1 ZINC000485476305 900769195 /nfs/dbraw/zinc/76/91/95/900769195.db2.gz BDYCTWFXQZAAPX-UHFFFAOYSA-N 0 3 420.340 4.000 20 0 HIADHN CCSCc1ccc(C(=O)Nc2ccc(C(=O)NCCN3CCCC3)cc2)cc1 ZINC000485483205 900774896 /nfs/dbraw/zinc/77/48/96/900774896.db2.gz UUSFCBBDMGJHMW-UHFFFAOYSA-N 0 3 411.571 4.018 20 0 HIADHN O=C(NCCN1CCCC1)c1ccc(NC(=O)c2cccc(Cl)c2Cl)cc1 ZINC000485506380 900794852 /nfs/dbraw/zinc/79/48/52/900794852.db2.gz RUJKQMWEEPFQIK-UHFFFAOYSA-N 0 3 406.313 4.071 20 0 HIADHN O=C(Nc1ccc(C(=O)NCCN2CCCC2)cc1)c1cc2cc(Cl)ccc2o1 ZINC000485513012 900798726 /nfs/dbraw/zinc/79/87/26/900798726.db2.gz BDBGAZRTGJQWQO-UHFFFAOYSA-N 0 3 411.889 4.164 20 0 HIADHN COc1cc([C@H](C)NC(=O)N2CCN(C3CCCCC3)CC2)ccc1OC(C)C ZINC000485567157 900836733 /nfs/dbraw/zinc/83/67/33/900836733.db2.gz HTRYSULRRDLLQU-SFHVURJKSA-N 0 3 403.567 4.203 20 0 HIADHN C[C@@H]1CN(C2CCOCC2)CCN1C(=O)NCCC(c1ccccc1)c1ccccc1 ZINC000485586966 900851232 /nfs/dbraw/zinc/85/12/32/900851232.db2.gz FUURNCHXDYHCKV-OAQYLSRUSA-N 0 3 421.585 4.103 20 0 HIADHN CCOc1cc(CN(C)[C@H](c2ccccc2)C(C)C)nc2nc(C(F)(F)F)nn21 ZINC000485666405 900916993 /nfs/dbraw/zinc/91/69/93/900916993.db2.gz HPUGLXVKQUYOFH-KRWDZBQOSA-N 0 3 407.440 4.371 20 0 HIADHN C[C@@H](NC(=O)CCCN1CCN(c2ccccc2)CC1)c1ccc2ncsc2c1 ZINC000485669737 900920197 /nfs/dbraw/zinc/92/01/97/900920197.db2.gz KZLIZHMKETXTIC-GOSISDBHSA-N 0 3 408.571 4.076 20 0 HIADHN O=C(COc1ccccc1CNC[C@H](c1ccccc1)C(F)(F)F)N1CCCC1 ZINC000485726833 900978479 /nfs/dbraw/zinc/97/84/79/900978479.db2.gz TUYKXBOFNVGXHT-LJQANCHMSA-N 0 3 406.448 4.124 20 0 HIADHN CC(C)(C)[C@@H](CN1CCc2ccccc2C1)NC(=O)NCc1nc(C2CC2)cs1 ZINC000485776341 901033084 /nfs/dbraw/zinc/03/30/84/901033084.db2.gz VTVVTUPMQXIDPV-HXUWFJFHSA-N 0 3 412.603 4.293 20 0 HIADHN COC(=O)c1ccc2c(c1)nc(CN1C[C@H](c3ccccc3)[C@H]3CCCC[C@@H]31)[nH]c2=O ZINC000485880169 901116648 /nfs/dbraw/zinc/11/66/48/901116648.db2.gz IRHKPUJVNKTOGN-UZKOGDIHSA-N 0 3 417.509 4.280 20 0 HIADHN CCN(C(=O)C(=O)Nc1ccc(Cl)c(F)c1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000485883414 901118147 /nfs/dbraw/zinc/11/81/47/901118147.db2.gz NISCNGSLFPUPBX-QAPCUYQASA-N 0 3 417.912 4.102 20 0 HIADHN C[C@H]1CC(=O)CC[C@H]1C(=O)N1CCC(N(C)Cc2cccc(C(F)(F)F)c2)CC1 ZINC000485945811 901165691 /nfs/dbraw/zinc/16/56/91/901165691.db2.gz QPKUDXTXVYRRBK-MGPUTAFESA-N 0 3 410.480 4.134 20 0 HIADHN Cc1ccc(F)c(C(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)c1Br ZINC000486117082 901303448 /nfs/dbraw/zinc/30/34/48/901303448.db2.gz FAWHBRRHHLWNMD-PBHICJAKSA-N 0 3 405.311 4.147 20 0 HIADHN CN(C(=O)c1ccc(Oc2cccc(Br)c2)cc1)[C@@H]1CN2CCC1CC2 ZINC000486167162 901354476 /nfs/dbraw/zinc/35/44/76/901354476.db2.gz AJGVZKRACLSSPT-HXUWFJFHSA-N 0 3 415.331 4.408 20 0 HIADHN CN(C(=O)N1CCC(Cc2ccccc2)CC1)C1CCN(CCc2ccccn2)CC1 ZINC000486308443 901487118 /nfs/dbraw/zinc/48/71/18/901487118.db2.gz KEZFAAMMUUVGAH-UHFFFAOYSA-N 0 3 420.601 4.095 20 0 HIADHN COc1ccc(CNC(=O)N(CCN(C)C)Cc2cccc(Cl)c2)cc1Cl ZINC000486315525 901493599 /nfs/dbraw/zinc/49/35/99/901493599.db2.gz FVOXLUOVSFEWTI-UHFFFAOYSA-N 0 3 410.345 4.275 20 0 HIADHN Cn1nc2ccccc2c1C(=O)N[C@@H](c1ccc(F)c(F)c1)C(C)(C)N1CCCC1 ZINC000486554849 901701074 /nfs/dbraw/zinc/70/10/74/901701074.db2.gz GBUSSZFQGLFXSA-NRFANRHFSA-N 0 3 412.484 4.197 20 0 HIADHN C[C@H](CC(=O)Nc1cccc2c1CCN(CC(C)(C)O)C2)c1c[nH]c2ccccc21 ZINC000486608004 901743274 /nfs/dbraw/zinc/74/32/74/901743274.db2.gz YACXBYAULQLKGL-QGZVFWFLSA-N 0 3 405.542 4.429 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1c(F)cccc1Br)c1cccc(OC)c1 ZINC000486627541 901761810 /nfs/dbraw/zinc/76/18/10/901761810.db2.gz KGZVYMBTLZQADM-SFHVURJKSA-N 0 3 423.326 4.410 20 0 HIADHN COc1cc(-c2noc(CN3CC[C@@H](Cc4ccccc4)[C@H]3C)n2)cc(OC)c1OC ZINC000486787358 901853464 /nfs/dbraw/zinc/85/34/64/901853464.db2.gz JZMNGLLJNXRNAN-AEFFLSMTSA-N 0 3 423.513 4.216 20 0 HIADHN COc1cc(-c2noc(CN3CC[C@@H](Cc4ccccc4)[C@@H]3C)n2)cc(OC)c1OC ZINC000486787363 901853595 /nfs/dbraw/zinc/85/35/95/901853595.db2.gz JZMNGLLJNXRNAN-WMZOPIPTSA-N 0 3 423.513 4.216 20 0 HIADHN CCCCC[C@@H]1CCCN1CC(=O)N(C)CC(=O)Nc1ccccc1C(F)(F)F ZINC000486793368 901857970 /nfs/dbraw/zinc/85/79/70/901857970.db2.gz INLUOMWKQAYQLW-MRXNPFEDSA-N 0 3 413.484 4.147 20 0 HIADHN COC(=O)c1ccc(F)c(CN2C[C@H]3CCC[C@@]3(c3nc(-c4ccccc4)no3)C2)c1 ZINC000486820684 901874269 /nfs/dbraw/zinc/87/42/69/901874269.db2.gz KZIRVALLODLUHX-NTKDMRAZSA-N 0 3 421.472 4.216 20 0 HIADHN O=C(N[C@H](c1ccccc1)c1ccncc1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000486828764 901879771 /nfs/dbraw/zinc/87/97/71/901879771.db2.gz RCQYZQIUAYTUOO-ISKFKSNPSA-N 0 3 403.501 4.339 20 0 HIADHN COc1ccc(Cl)c(CN2C[C@H]3CCC[C@@]3(c3nc(-c4cccnc4)no3)C2)c1 ZINC000486840549 901889215 /nfs/dbraw/zinc/88/92/15/901889215.db2.gz CNSUOQGVDYWODW-VGOFRKELSA-N 0 3 410.905 4.347 20 0 HIADHN CC(C)N(C(=O)[C@H](C)N1C[C@H]2CCC[C@@]2(c2nc(-c3ccccc3)no2)C1)C(C)C ZINC000486844487 901891680 /nfs/dbraw/zinc/89/16/80/901891680.db2.gz KQPIMWHPDWRZIM-MFSJNOQSSA-N 0 3 410.562 4.124 20 0 HIADHN C[C@H](NC(=O)N(CCN(C)C)Cc1ccc(F)c(F)c1)c1ccc2ncsc2c1 ZINC000486878623 901923591 /nfs/dbraw/zinc/92/35/91/901923591.db2.gz IQVUAYKDLQJGTC-AWEZNQCLSA-N 0 3 418.513 4.409 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)c2nc3ccccc3cc2Cl)cc1 ZINC000486894591 901937306 /nfs/dbraw/zinc/93/73/06/901937306.db2.gz ARWKQEYKQQTXIY-NRFANRHFSA-N 0 3 409.917 4.464 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)CCc2ccc3ccccc3n2)cc1 ZINC000486903853 901948380 /nfs/dbraw/zinc/94/83/80/901948380.db2.gz NPXJUVFTPVOHCT-DEOSSOPVSA-N 0 3 403.526 4.129 20 0 HIADHN O=C(NC[C@H]1CCCN1Cc1ccccc1)Nc1nnc(/C=C\c2ccco2)s1 ZINC000486943688 901981019 /nfs/dbraw/zinc/98/10/19/901981019.db2.gz NGGYKCMUVWFXOT-QXPKXGMISA-N 0 3 409.515 4.088 20 0 HIADHN CN(C)Cc1ccccc1C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000487000885 902008372 /nfs/dbraw/zinc/00/83/72/902008372.db2.gz PMSPKLQCJREKMT-UHFFFAOYSA-N 0 3 420.384 4.449 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)[C@H]3CCCCCC(=O)C3)c(OCC)c2)CC1 ZINC000487350011 902156782 /nfs/dbraw/zinc/15/67/82/902156782.db2.gz CIXPAMLVEHCQKO-IBGZPJMESA-N 0 3 415.578 4.095 20 0 HIADHN Cc1nc(-c2ccc(C)cc2NC(=O)CN2CCC[C@H]2CCc2ccccc2)n[nH]1 ZINC000487418320 902200287 /nfs/dbraw/zinc/20/02/87/902200287.db2.gz XLLNCSDUNXQKMR-FQEVSTJZSA-N 0 3 403.530 4.124 20 0 HIADHN COc1cc(-c2noc(CN3CCC[C@@H]3Cc3ccccc3C)n2)cc(OC)c1OC ZINC000487437779 902210978 /nfs/dbraw/zinc/21/09/78/902210978.db2.gz ZSNZHMLYIHDXKN-LJQANCHMSA-N 0 3 423.513 4.278 20 0 HIADHN CN(CC(=O)Nc1ccc(Cl)c(Cl)c1)C1CCN(CCC(F)(F)F)CC1 ZINC000487819477 902385907 /nfs/dbraw/zinc/38/59/07/902385907.db2.gz IXKRXGBWEXUZPB-UHFFFAOYSA-N 0 3 412.283 4.281 20 0 HIADHN COc1ccc(CNC(=O)[C@@H](C)N[C@H](C)c2ccc(F)c3ccccc32)cc1OC ZINC000487861416 902411817 /nfs/dbraw/zinc/41/18/17/902411817.db2.gz WWHCHPPKOXBJQR-HZPDHXFCSA-N 0 3 410.489 4.352 20 0 HIADHN CC(=O)N(c1nc(CN2CCN(C)[C@@H](C(C)C)C2)cs1)c1ccc(C)c(C)c1 ZINC000487944742 902473652 /nfs/dbraw/zinc/47/36/52/902473652.db2.gz HUOGWINRTSDGOI-OAQYLSRUSA-N 0 3 400.592 4.217 20 0 HIADHN C[C@H]1CCN(C(=O)c2cccc(COC3CCOCC3)c2)CCN1Cc1ccccc1 ZINC000487952422 902479878 /nfs/dbraw/zinc/47/98/78/902479878.db2.gz CXSMDRVSQUIEQZ-NRFANRHFSA-N 0 3 422.569 4.119 20 0 HIADHN O=C(c1ccccc1Cl)N1CCC(N2CCN(c3cccc(Cl)c3)CC2)CC1 ZINC000488040350 902557775 /nfs/dbraw/zinc/55/77/75/902557775.db2.gz DTQOAHBRUFMKFB-UHFFFAOYSA-N 0 3 418.368 4.420 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Cc1n[nH]c2ccccc21)c1ccc(C(F)(F)F)cc1 ZINC000488045309 902562141 /nfs/dbraw/zinc/56/21/41/902562141.db2.gz JCBCJKNYONSMSZ-HXUWFJFHSA-N 0 3 418.463 4.324 20 0 HIADHN C[C@H]1CN(C2CCOCC2)CCN1C(=O)Nc1ccc(C(F)(F)F)cc1Cl ZINC000488247013 902721096 /nfs/dbraw/zinc/72/10/96/902721096.db2.gz AEZRTBGYYLKJGN-LBPRGKRZSA-N 0 3 405.848 4.076 20 0 HIADHN CCN1CCC[C@@H](CN(C)C(=O)N[C@H](C)c2cccc(Cl)c2)[C@@H]1c1cnn(C)c1 ZINC000488260070 902731647 /nfs/dbraw/zinc/73/16/47/902731647.db2.gz BVUDGCRBQDOROP-PLMTUMEDSA-N 0 3 417.985 4.249 20 0 HIADHN C[C@H]1CN(C2CCOCC2)CCN1C(=O)Nc1ccc(OCC2CCCCC2)cc1 ZINC000488381845 902791295 /nfs/dbraw/zinc/79/12/95/902791295.db2.gz UBFRWKRONOIJLD-IBGZPJMESA-N 0 3 415.578 4.363 20 0 HIADHN C[C@@H]1CN(C2CCOCC2)CCN1C(=O)Nc1ccc(Oc2cccc(F)c2)cc1 ZINC000488395097 902805106 /nfs/dbraw/zinc/80/51/06/902805106.db2.gz IPLZMZNICJZFOS-QGZVFWFLSA-N 0 3 413.493 4.335 20 0 HIADHN CC(C)(C)[C@@H]1C[C@H](NCc2cccnc2Oc2cccc(S(C)(=O)=O)c2)CS1 ZINC000488405842 902811621 /nfs/dbraw/zinc/81/16/21/902811621.db2.gz BRAODDCBPMBFLM-LPHOPBHVSA-N 0 3 420.600 4.287 20 0 HIADHN C[C@@H](NC(=O)N[C@@H](CC1CC1)c1cc(F)cc(Br)c1)C1=CCN(C)CC1 ZINC000488508988 902861874 /nfs/dbraw/zinc/86/18/74/902861874.db2.gz CCUHXGKZMYYUHR-YJYMSZOUSA-N 0 3 424.358 4.379 20 0 HIADHN CC[C@H](C)N(CC(=O)Nc1ccccc1C(F)(F)F)C[C@@H](O)Cc1ccccc1 ZINC000488616470 902903067 /nfs/dbraw/zinc/90/30/67/902903067.db2.gz HXPUVYDGUYAAOB-WMZOPIPTSA-N 0 3 408.464 4.348 20 0 HIADHN CCOc1c(Cl)cc(NC(=O)N2CCN(C3CCOCC3)C[C@@H]2C)cc1Cl ZINC000488649752 902918123 /nfs/dbraw/zinc/91/81/23/902918123.db2.gz XFMTUIJTFBVZGN-ZDUSSCGKSA-N 0 3 416.349 4.109 20 0 HIADHN C[C@@H]1CN(C2CCOCC2)CCN1Cc1csc(Cc2ccc(Cl)cc2)n1 ZINC000488713423 902962168 /nfs/dbraw/zinc/96/21/68/902962168.db2.gz LCOPEZXYQCPVIU-MRXNPFEDSA-N 0 3 405.995 4.072 20 0 HIADHN Cc1ccccc1[C@@H](C(C)C)N(C)CC(=O)NCC1(c2ccccc2)CCOCC1 ZINC000488720447 902964176 /nfs/dbraw/zinc/96/41/76/902964176.db2.gz BRRKYKNLJWDSIW-RUZDIDTESA-N 0 3 408.586 4.489 20 0 HIADHN O=C(c1c[nH]c(C2CC2)n1)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000488721842 902966069 /nfs/dbraw/zinc/96/60/69/902966069.db2.gz DMSJVRLIUCZBKG-UHFFFAOYSA-N 0 3 407.345 4.332 20 0 HIADHN Cc1ccccc1[C@@H](C(C)C)N(C)CC(=O)NCc1ccc(C(=O)N2CCCC2)cc1 ZINC000488768113 902986033 /nfs/dbraw/zinc/98/60/33/902986033.db2.gz PSGWPVSCDHRPTQ-RUZDIDTESA-N 0 3 421.585 4.176 20 0 HIADHN COc1cc2c(cc1OC)CN(C(=O)CN(C)[C@@H](c1ccccc1C)C(C)C)CC2 ZINC000488802181 903007704 /nfs/dbraw/zinc/00/77/04/903007704.db2.gz GIAMIUGBWXWRDF-RUZDIDTESA-N 0 3 410.558 4.226 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N(C)[C@@H](C)c3cc(F)ccc3F)cc2)CC1 ZINC000488924891 903079938 /nfs/dbraw/zinc/07/99/38/903079938.db2.gz QUIMEMKTLNDAJT-KRWDZBQOSA-N 0 3 401.501 4.328 20 0 HIADHN COc1ccc([C@H](C)NC(=O)[C@@H]2CN(Cc3ccccc3)CCC2(F)F)cc1F ZINC000506011094 914685720 /nfs/dbraw/zinc/68/57/20/914685720.db2.gz XHVRCOPAAWMNST-YJBOKZPZSA-N 0 3 406.448 4.169 20 0 HIADHN O=C(NCc1ccc(OC(F)F)cc1)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000506017838 914695793 /nfs/dbraw/zinc/69/57/93/914695793.db2.gz VQVNMZRAHLLSJM-GOSISDBHSA-N 0 3 410.411 4.062 20 0 HIADHN CC(C)CC[C@@H]1CCC[C@H]1NC(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000489139360 903225938 /nfs/dbraw/zinc/22/59/38/903225938.db2.gz NDVFCSNMJFBLLL-WMZHIEFXSA-N 0 3 401.595 4.047 20 0 HIADHN C[C@H](C(=O)NC1CCN(CCOc2ccc(Cl)cc2)CC1)c1c(F)cccc1F ZINC000489196413 903257510 /nfs/dbraw/zinc/25/75/10/903257510.db2.gz NAEQHFQRXRCFNS-HNNXBMFYSA-N 0 3 422.903 4.381 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)NC[C@H]2CCCO[C@@H]2c2ccccc2)CC1 ZINC000489368584 903347927 /nfs/dbraw/zinc/34/79/27/903347927.db2.gz NAGQCNIBBQHRNS-ILBGXUMGSA-N 0 3 421.585 4.460 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCCc3c[nH]c4cccc(C)c34)c(C)c2)CC1 ZINC000489423892 903377856 /nfs/dbraw/zinc/37/78/56/903377856.db2.gz QKVLNUKTMUAAFC-UHFFFAOYSA-N 0 3 419.573 4.291 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@H](C)NCc2ccc(OC)c(Cl)c2)cc1 ZINC000489453680 903392149 /nfs/dbraw/zinc/39/21/49/903392149.db2.gz AYOAGFTVCLVXBV-HNNXBMFYSA-N 0 3 410.967 4.230 20 0 HIADHN COc1cccc(NC(=O)[C@H](N[C@H]2CCO[C@]3(CCSC3)C2)c2ccccc2)c1 ZINC000489524750 903437987 /nfs/dbraw/zinc/43/79/87/903437987.db2.gz BAHANHKQAPAEOC-XKCSPQBFSA-N 0 3 412.555 4.019 20 0 HIADHN Cc1ccc(NC(=O)N(CCN(C)C)Cc2ccccc2)cc1C(=O)N(C)C(C)C ZINC000489523960 903438241 /nfs/dbraw/zinc/43/82/41/903438241.db2.gz SWBKOSVEEVOCQU-UHFFFAOYSA-N 0 3 410.562 4.071 20 0 HIADHN Cc1nn(C)cc1[C@@H](C)NC(=O)N(CCN(C)Cc1ccccc1)Cc1ccccc1 ZINC000489538883 903448946 /nfs/dbraw/zinc/44/89/46/903448946.db2.gz CXUCFKDMOIYLMM-HXUWFJFHSA-N 0 3 419.573 4.133 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCC(C)(C)c3ccc(F)cc3)c(C)c2)CC1 ZINC000489548233 903457448 /nfs/dbraw/zinc/45/74/48/903457448.db2.gz KLGVEPZCXOXCAZ-UHFFFAOYSA-N 0 3 412.553 4.375 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)N[C@@H]2CCCN(c3cccc(F)c3)C2)CC1 ZINC000489577223 903476570 /nfs/dbraw/zinc/47/65/70/903476570.db2.gz LAXXXHPLLTZGKN-JOCHJYFZSA-N 0 3 424.564 4.101 20 0 HIADHN CC[C@H](NC(=O)NCc1ccccc1CN1CCC(O)CC1)c1ccc(Cl)s1 ZINC000489614372 903497644 /nfs/dbraw/zinc/49/76/44/903497644.db2.gz BHNCAZNHUOSNEK-SFHVURJKSA-N 0 3 421.994 4.309 20 0 HIADHN COc1cc([C@H](C)N[C@@H](C)c2ccc(Br)c(F)c2)ccc1OCCO ZINC000489631831 903508380 /nfs/dbraw/zinc/50/83/80/903508380.db2.gz ORAGBNHIIJQDRP-STQMWFEESA-N 0 3 412.299 4.380 20 0 HIADHN CC[C@H](C)N(Cc1ccccc1)C(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000489782700 903595785 /nfs/dbraw/zinc/59/57/85/903595785.db2.gz JZSOLAVSSCIYNJ-FQEVSTJZSA-N 0 3 409.574 4.154 20 0 HIADHN CCCOc1ccc(NC(=O)NCc2ccccc2CN2CCC(O)CC2)c(C)c1 ZINC000489816556 903611989 /nfs/dbraw/zinc/61/19/89/903611989.db2.gz YEWOMDWKAPOVPD-UHFFFAOYSA-N 0 3 411.546 4.062 20 0 HIADHN CCN(CCCNC(=O)N(Cc1ccccc1)C1CCN(C)CC1)c1ccccc1 ZINC000489877258 903647405 /nfs/dbraw/zinc/64/74/05/903647405.db2.gz WWDTWTYTMRDGKC-UHFFFAOYSA-N 0 3 408.590 4.209 20 0 HIADHN COc1ccc(-c2noc([C@H](C)N3CC[C@@H](C)N(Cc4ccccc4)CC3)n2)cc1 ZINC000489884860 903651144 /nfs/dbraw/zinc/65/11/44/903651144.db2.gz KJQKRVMVKLKSCB-MOPGFXCFSA-N 0 3 406.530 4.403 20 0 HIADHN CSCC[C@H](N[C@H]1CCCc2nc(-c3ccccc3F)sc21)C(=O)N(C)C ZINC000489886549 903652885 /nfs/dbraw/zinc/65/28/85/903652885.db2.gz SFPPBSMQINEHPQ-RDJZCZTQSA-N 0 3 407.580 4.126 20 0 HIADHN CSCC[C@H](N[C@H](C)c1ccc(OCc2cccc(C)c2)cc1)C(=O)N(C)C ZINC000489960712 903697832 /nfs/dbraw/zinc/69/78/32/903697832.db2.gz XUSBTBWXDZVEJW-GCJKJVERSA-N 0 3 400.588 4.435 20 0 HIADHN COc1cc(CN[C@@H]2CCN(C(C)=O)Cc3ccccc32)ccc1OCC(F)(F)F ZINC000490129844 903781897 /nfs/dbraw/zinc/78/18/97/903781897.db2.gz HPOCNLIXKMHFHY-LJQANCHMSA-N 0 3 422.447 4.219 20 0 HIADHN CCN1CCN(c2ccc(CNC(c3ccc(F)cc3)c3ccc(F)cc3)cn2)CC1 ZINC000490157014 903798360 /nfs/dbraw/zinc/79/83/60/903798360.db2.gz KTPPNFTXLQKNRM-UHFFFAOYSA-N 0 3 422.523 4.381 20 0 HIADHN Fc1ccc(-c2nc(CN3CCC(CCCN4CCOCC4)CC3)cs2)cc1 ZINC000506052515 914750579 /nfs/dbraw/zinc/75/05/79/914750579.db2.gz UQYPZDYUQGRHAX-UHFFFAOYSA-N 0 3 403.567 4.274 20 0 HIADHN CCc1ccc([C@@H](NCCN2CCC[C@H](C)C2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000490173490 903810468 /nfs/dbraw/zinc/81/04/68/903810468.db2.gz VUBAJTQQGRCTGV-YADARESESA-N 0 3 414.615 4.063 20 0 HIADHN C[C@@H](CN[C@H](c1ccc(F)cc1)c1cccc(S(C)(=O)=O)c1)N1CCC[C@@H](C)C1 ZINC000490184766 903814698 /nfs/dbraw/zinc/81/46/98/903814698.db2.gz OEUPEBUKSFPWJR-IEGUWTFLSA-N 0 3 418.578 4.029 20 0 HIADHN COc1ccc(NC(=O)NC[C@@H](C)N(C)Cc2ccccc2)cc1Br ZINC000490299199 903886278 /nfs/dbraw/zinc/88/62/78/903886278.db2.gz KVCORKRNWLKDSH-CQSZACIVSA-N 0 3 406.324 4.100 20 0 HIADHN Cc1sc2ncnc(SCCC(=O)NCc3ccccc3CN(C)C)c2c1C ZINC000506056353 914758859 /nfs/dbraw/zinc/75/88/59/914758859.db2.gz SYHMGFOGPWIESO-UHFFFAOYSA-N 0 3 414.600 4.168 20 0 HIADHN CC1CCN([C@@H](CNC(=O)N[C@@H]2CCOC3(CCCC3)C2)c2cccs2)CC1 ZINC000490316456 903896868 /nfs/dbraw/zinc/89/68/68/903896868.db2.gz OZYLIZJDRWCVIL-MOPGFXCFSA-N 0 3 405.608 4.312 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N(CC(F)F)c3ccc(F)cc3)cc2)CC1 ZINC000490320768 903902037 /nfs/dbraw/zinc/90/20/37/903902037.db2.gz HHIRAZCREKVKDX-UHFFFAOYSA-N 0 3 405.464 4.268 20 0 HIADHN CC(C)Oc1ccc2ccccc2c1CN(C)[C@H](C)c1ccc(S(N)(=O)=O)cc1 ZINC000506056868 914760746 /nfs/dbraw/zinc/76/07/46/914760746.db2.gz ZTEAUAKSBYNWPO-QGZVFWFLSA-N 0 3 412.555 4.467 20 0 HIADHN COc1cc(C)ccc1Oc1ccc(F)cc1NC(=O)N1CC[C@@H]2CCN(C)C[C@@H]21 ZINC000490339313 903929798 /nfs/dbraw/zinc/92/97/98/903929798.db2.gz IEGHCBKSWCGUDN-LPHOPBHVSA-N 0 3 413.493 4.493 20 0 HIADHN COCCOc1ccc(NC(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)cc1F ZINC000490342048 903934033 /nfs/dbraw/zinc/93/40/33/903934033.db2.gz SHOMYEUDWZHKLV-OAQYLSRUSA-N 0 3 415.509 4.118 20 0 HIADHN C[C@@H]1C[C@H](CN2CCC[C@@H]2c2nc(Cc3ccc(Br)cc3)no2)CCO1 ZINC000490355355 903949409 /nfs/dbraw/zinc/94/94/09/903949409.db2.gz PTNRUVIVCSDCIA-QGPMSJSTSA-N 0 3 420.351 4.375 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccc(F)c2)C1)N1CCC(Cc2ccccc2CO)CC1 ZINC000490376038 903968065 /nfs/dbraw/zinc/96/80/65/903968065.db2.gz GDCXDVVCPCLQHM-HSZRJFAPSA-N 0 3 424.560 4.011 20 0 HIADHN CC(C)Cc1ccc([C@@H](CNC(=O)C2(c3ccccc3)CCOCC2)N(C)C)cc1 ZINC000490484031 904036479 /nfs/dbraw/zinc/03/64/79/904036479.db2.gz MZBPJDGEZYTNTH-XMMPIXPASA-N 0 3 408.586 4.352 20 0 HIADHN Cc1nnc(-c2ccccc2C(=O)NC[C@H](c2ccc(CC(C)C)cc2)N(C)C)o1 ZINC000490492043 904045338 /nfs/dbraw/zinc/04/53/38/904045338.db2.gz NQXSRGYDSXJDGW-JOCHJYFZSA-N 0 3 406.530 4.276 20 0 HIADHN Cc1nnc(-c2ccccc2C(=O)NC[C@@H](c2ccc(CC(C)C)cc2)N(C)C)o1 ZINC000490492046 904045526 /nfs/dbraw/zinc/04/55/26/904045526.db2.gz NQXSRGYDSXJDGW-QFIPXVFZSA-N 0 3 406.530 4.276 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2cc(F)cc(Br)c2F)[C@@H]1c1ccccc1 ZINC000490515218 904064658 /nfs/dbraw/zinc/06/46/58/904064658.db2.gz VHONSVHJBBYCLC-PBHICJAKSA-N 0 3 410.262 4.294 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)Nc1cc(F)cc(Br)c1F ZINC000490536236 904083160 /nfs/dbraw/zinc/08/31/60/904083160.db2.gz SRUUFQILPSXHAB-UHFFFAOYSA-N 0 3 412.278 4.323 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)Nc3ccc(Br)cc3C(F)(F)F)[C@@H]2C1 ZINC000490547387 904093111 /nfs/dbraw/zinc/09/31/11/904093111.db2.gz RHLSCLUZKPTYOO-IINYFYTJSA-N 0 3 406.246 4.026 20 0 HIADHN CN(C)[C@H](CNC(=O)Nc1cc(F)cc(Br)c1F)Cc1ccccc1 ZINC000490565604 904103574 /nfs/dbraw/zinc/10/35/74/904103574.db2.gz FJZZJTUPFBHENL-AWEZNQCLSA-N 0 3 412.278 4.022 20 0 HIADHN CCN1CCN(c2ccc(NCc3cnc(-c4ccccc4OC)nc3)c(C)c2)CC1 ZINC000490606435 904131888 /nfs/dbraw/zinc/13/18/88/904131888.db2.gz XDQQWFYNMOIWGJ-UHFFFAOYSA-N 0 3 417.557 4.215 20 0 HIADHN O=C1C[C@@H]([C@H]2CCCCN2Cc2csc(-c3ccc(Br)cc3)n2)CN1 ZINC000490674524 904167733 /nfs/dbraw/zinc/16/77/33/904167733.db2.gz NYRLWYJFBSEBRI-RHSMWYFYSA-N 0 3 420.376 4.063 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)Nc1ccc2nccnc2c1Br ZINC000490755735 904211054 /nfs/dbraw/zinc/21/10/54/904211054.db2.gz DZASZJTTXSHDCP-UHFFFAOYSA-N 0 3 420.355 4.122 20 0 HIADHN Cc1ccc(-c2nc(CCNC(=O)N[C@@H](C)[C@@H](c3ccccc3)N(C)C)co2)cc1 ZINC000490762105 904215224 /nfs/dbraw/zinc/21/52/24/904215224.db2.gz WYLMKFRANONNLA-AVRDEDQJSA-N 0 3 406.530 4.183 20 0 HIADHN CN(C)C[C@@H](NC(=O)N[C@@H](c1c[nH]c2ccccc21)C(F)(F)F)c1ccccc1 ZINC000490787528 904234157 /nfs/dbraw/zinc/23/41/57/904234157.db2.gz AHKUWWDVYVDAOP-MOPGFXCFSA-N 0 3 404.436 4.373 20 0 HIADHN CCOc1c(Br)cc(Cl)cc1NC(=O)N1CC[C@H]2CCN(C)C[C@H]21 ZINC000490808872 904254897 /nfs/dbraw/zinc/25/48/97/904254897.db2.gz VSZIXIRVUNVPKA-IAQYHMDHSA-N 0 3 416.747 4.059 20 0 HIADHN CC[C@@H](C)C(=O)Nc1cccc(CNC(=O)N2CCCN(Cc3ccccc3)CC2)c1 ZINC000506109032 914807372 /nfs/dbraw/zinc/80/73/72/914807372.db2.gz XHXKTHJLJHDGLF-HXUWFJFHSA-N 0 3 422.573 4.089 20 0 HIADHN C[C@@H](NC(=O)Nc1ccc(CCN2CCSCC2)cc1)c1c(F)cccc1F ZINC000490979154 904347849 /nfs/dbraw/zinc/34/78/49/904347849.db2.gz CYYIZIDRIWUSPE-OAHLLOKOSA-N 0 3 405.514 4.439 20 0 HIADHN COCCN1CCC[C@@H]1CN[C@H](c1ccc(OC)c(OC)c1)c1ccccc1Cl ZINC000491027464 904379358 /nfs/dbraw/zinc/37/93/58/904379358.db2.gz BABDXGJCLLDYAD-WZONZLPQSA-N 0 3 418.965 4.147 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)NCc2cccc(NC(=O)[C@H](C)CC)c2)N(C)C)cc1 ZINC000506103865 914804923 /nfs/dbraw/zinc/80/49/23/914804923.db2.gz CYYOLKVMOSQKJU-WZONZLPQSA-N 0 3 424.589 4.336 20 0 HIADHN CC(C)Oc1ccc([C@H](CN2C(=O)[C@@H]3CC[C@@H](c4ccccc4)N3C2=O)N(C)C)cc1 ZINC000491206830 904482181 /nfs/dbraw/zinc/48/21/81/904482181.db2.gz VLZLAEPNWJKLPN-VABKMULXSA-N 0 3 421.541 4.244 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](NC2CCN(C3CC3)CC2)c2ccc(Cl)cc2)c1 ZINC000491260923 904508515 /nfs/dbraw/zinc/50/85/15/904508515.db2.gz RHSVOYLPUKHBEB-QFIPXVFZSA-N 0 3 418.990 4.049 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)Nc3ncc(Cc4ccc(C(F)(F)F)cc4)s3)[C@@H]2C1 ZINC000491304908 904525366 /nfs/dbraw/zinc/52/53/66/904525366.db2.gz LAESKIMAKNNYNL-RHSMWYFYSA-N 0 3 424.492 4.311 20 0 HIADHN Cc1nc(COc2ccc(CN(C)Cc3ccccc3N3CCOCC3)cc2)cs1 ZINC000506140908 914820746 /nfs/dbraw/zinc/82/07/46/914820746.db2.gz LLCVBCWFJPVZBR-UHFFFAOYSA-N 0 3 423.582 4.499 20 0 HIADHN O=C1CCCN1CCCN[C@H](c1ccc(Br)cc1)c1ccccc1F ZINC000491356632 904553251 /nfs/dbraw/zinc/55/32/51/904553251.db2.gz PKRQYAMBZOYKJH-HXUWFJFHSA-N 0 3 405.311 4.280 20 0 HIADHN CC(C)N(CCN[C@@H](c1cccc(S(C)(=O)=O)c1)c1ccc(F)c(F)c1)C(C)C ZINC000491357336 904554614 /nfs/dbraw/zinc/55/46/14/904554614.db2.gz YFYMYYHBWGZKJU-QFIPXVFZSA-N 0 3 424.557 4.166 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](NCCc2ccccc2F)c2ccc(F)cc2)c1 ZINC000491357492 904554933 /nfs/dbraw/zinc/55/49/33/904554933.db2.gz ZXPMHNGSGLWZCV-JOCHJYFZSA-N 0 3 401.478 4.290 20 0 HIADHN O=C1CCCN1CCCN[C@H](c1ccccc1)c1ccc(Br)cc1F ZINC000491356982 904555077 /nfs/dbraw/zinc/55/50/77/904555077.db2.gz UIMGNHZMHBAIEG-HXUWFJFHSA-N 0 3 405.311 4.280 20 0 HIADHN COc1ccc(CCN[C@H](c2ccc(F)cc2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000491377925 904567706 /nfs/dbraw/zinc/56/77/06/904567706.db2.gz ABBKHYJSSJLOKG-HSZRJFAPSA-N 0 3 413.514 4.160 20 0 HIADHN Cc1ccc([C@@H](NC[C@H]2Cc3ccccc3O2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000491392927 904573823 /nfs/dbraw/zinc/57/38/23/904573823.db2.gz BIFXEUBNLRFLOG-ZJSXRUAMSA-N 0 3 407.535 4.081 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)Nc2c(C)cccc2C(=O)N2CCCC2)c1 ZINC000491862442 904714081 /nfs/dbraw/zinc/71/40/81/904714081.db2.gz GOKCOQKHCHIZDY-UHFFFAOYSA-N 0 3 422.573 4.135 20 0 HIADHN Cc1cc(Br)cc2c1[C@H](NCc1ccccc1N1CCOCC1)CC2 ZINC000491913345 904728251 /nfs/dbraw/zinc/72/82/51/904728251.db2.gz MSTALWAWXHQWPR-LJQANCHMSA-N 0 3 401.348 4.371 20 0 HIADHN Cc1ccc(-c2nc3cc(F)ccc3n2C)cc1NC(=O)N1CC[C@H]2CCN(C)C[C@H]21 ZINC000492001337 904757349 /nfs/dbraw/zinc/75/73/49/904757349.db2.gz RCBUQBLQEKFPQH-OPAMFIHVSA-N 0 3 421.520 4.246 20 0 HIADHN CC1(C)Cc2c(cccc2Br)[C@H]1NCc1cnc(N2CCOCC2)s1 ZINC000492205274 904814083 /nfs/dbraw/zinc/81/40/83/904814083.db2.gz AMAXTPQVIGVQOY-QGZVFWFLSA-N 0 3 422.392 4.155 20 0 HIADHN COc1ccc(OCc2ccccn2)c(CN[C@H]2CCN(c3ccccc3F)C2)c1 ZINC000492209843 904815362 /nfs/dbraw/zinc/81/53/62/904815362.db2.gz NAZUEOLPDAOPBQ-IBGZPJMESA-N 0 3 407.489 4.177 20 0 HIADHN Cc1cc(Br)cn2c(CN[C@H](C)[C@H]3OCCc4sccc43)cnc12 ZINC000492226892 904818698 /nfs/dbraw/zinc/81/86/98/904818698.db2.gz PUIISZPTVDOEEK-SJKOYZFVSA-N 0 3 406.349 4.259 20 0 HIADHN O[C@@H](CO[C@H]1CCCc2ccccc21)CN1CCC2(CC1)OCCc1ccsc12 ZINC000492379659 904841865 /nfs/dbraw/zinc/84/18/65/904841865.db2.gz YLZUFRWFZDKUOB-IRLDBZIGSA-N 0 3 413.583 4.067 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)N[C@H](c2ccccc2)c2cccnc2)CCN1Cc1ccccc1 ZINC000492489953 904858512 /nfs/dbraw/zinc/85/85/12/904858512.db2.gz NOUDKBRSVRTMFX-VEXUSMLFSA-N 0 3 400.526 4.133 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)c1ccnc(SCC(F)(F)F)c1 ZINC000492557969 904868423 /nfs/dbraw/zinc/86/84/23/904868423.db2.gz KZEQGEJWVLTNRW-QGZVFWFLSA-N 0 3 409.477 4.303 20 0 HIADHN CCC[C@@H]1CN(CCSc2ccnc3cc(Cl)ccc32)CCN1CCOC ZINC000492834405 904919912 /nfs/dbraw/zinc/91/99/12/904919912.db2.gz RXHASMMAMBCQMQ-GOSISDBHSA-N 0 3 408.011 4.413 20 0 HIADHN CCOc1ccc([C@@H](NC[C@@H]2CCCS(=O)(=O)C2)c2cccc(Cl)c2)cc1 ZINC000506248917 914862526 /nfs/dbraw/zinc/86/25/26/914862526.db2.gz ZEKNNWIAUXWBMY-HRAATJIYSA-N 0 3 407.963 4.243 20 0 HIADHN COc1cccc([C@H](CNc2ccc(C(=O)Nc3ccc(C)cc3)cn2)N(C)C)c1 ZINC000492898199 904946270 /nfs/dbraw/zinc/94/62/70/904946270.db2.gz ZXDDTLCWSRCUEQ-QFIPXVFZSA-N 0 3 404.514 4.366 20 0 HIADHN OCC[C@]1(CN[C@@H](c2ccc(Cl)cc2)c2ccc(OC(F)F)cc2)CCOC1 ZINC000493008808 904986261 /nfs/dbraw/zinc/98/62/61/904986261.db2.gz LMTULLQQMGYEJX-PZJWPPBQSA-N 0 3 411.876 4.410 20 0 HIADHN Cc1ccc([C@@H](NC[C@](C)(O)CCC(C)C)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000493037836 904999620 /nfs/dbraw/zinc/99/96/20/904999620.db2.gz RZGTVDKGUGLSLC-DHIUTWEWSA-N 0 3 403.588 4.265 20 0 HIADHN CCc1ccc([C@@H](NC[C@H](OC)C(C)(C)C)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000493059711 905006949 /nfs/dbraw/zinc/00/69/49/905006949.db2.gz PBBLFTSOJGKLTD-FCHUYYIVSA-N 0 3 403.588 4.393 20 0 HIADHN COc1ccc(SC)c(OC)c1C(=O)NC[C@@]1(C)CCCN1Cc1ccccc1 ZINC000493084997 905016397 /nfs/dbraw/zinc/01/63/97/905016397.db2.gz ZSRRTESFJSYWRM-HSZRJFAPSA-N 0 3 414.571 4.210 20 0 HIADHN CO[C@]1(C)C[C@@H](N[C@@H](c2ccc(C)cc2)c2cccc(S(C)(=O)=O)c2)C1(C)C ZINC000493106530 905021199 /nfs/dbraw/zinc/02/11/99/905021199.db2.gz UYTIMCNOWXHBJX-FUPPJEDESA-N 0 3 401.572 4.281 20 0 HIADHN O=C(NCCc1cccc2[nH]ccc21)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000506251229 914864380 /nfs/dbraw/zinc/86/43/80/914864380.db2.gz WBBSYWCTEAMIII-JOCHJYFZSA-N 0 3 415.459 4.281 20 0 HIADHN CCc1ccc([C@H](NCCc2nc(C)oc2C)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000493233400 905058673 /nfs/dbraw/zinc/05/86/73/905058673.db2.gz ULSMLPRCKOWIMN-QHCPKHFHSA-N 0 3 412.555 4.179 20 0 HIADHN Fc1ccccc1[C@H](NCCCO[C@@H]1CCOC1)c1ccc(Br)cc1 ZINC000493250898 905067489 /nfs/dbraw/zinc/06/74/89/905067489.db2.gz SSJJYZGNWQBEDD-YLJYHZDGSA-N 0 3 408.311 4.463 20 0 HIADHN Fc1ccc(Br)cc1[C@H](NCCCO[C@H]1CCOC1)c1ccccc1 ZINC000493249573 905067980 /nfs/dbraw/zinc/06/79/80/905067980.db2.gz QJCLXDCUDUMARB-FXAWDEMLSA-N 0 3 408.311 4.463 20 0 HIADHN COCC(=O)N1CCC(N[C@H](c2cccc(SC)c2)c2ccc(F)c(F)c2)CC1 ZINC000493251777 905068756 /nfs/dbraw/zinc/06/87/56/905068756.db2.gz VKZHVSSOIIQHGU-JOCHJYFZSA-N 0 3 420.525 4.003 20 0 HIADHN Cc1ccc([C@@H](NC[C@H](CCO)CC(C)C)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000493254135 905070722 /nfs/dbraw/zinc/07/07/22/905070722.db2.gz ZZRGYMYQDVOGOJ-AUSIDOKSSA-N 0 3 403.588 4.122 20 0 HIADHN CCOc1cc(CN(C)[C@@H](C)c2ccc(F)cc2)ccc1O[C@@H](C)C(=O)N(C)C ZINC000506259351 914868882 /nfs/dbraw/zinc/86/88/82/914868882.db2.gz OJCDRQGTQWGDQZ-IRXDYDNUSA-N 0 3 402.510 4.273 20 0 HIADHN C[C@]1(CO)CCC[C@@H]1NCC(=O)Nc1nc(-c2ccc(Cl)cc2Cl)cs1 ZINC000493388898 905102045 /nfs/dbraw/zinc/10/20/45/905102045.db2.gz SJRAJPCMRYROQN-MAUKXSAKSA-N 0 3 414.358 4.196 20 0 HIADHN C[C@@]1(CO)CCC[C@H]1NCC(=O)Nc1nc(-c2ccc(Cl)cc2Cl)cs1 ZINC000493388899 905103055 /nfs/dbraw/zinc/10/30/55/905103055.db2.gz SJRAJPCMRYROQN-QAPCUYQASA-N 0 3 414.358 4.196 20 0 HIADHN Cc1ccc(-c2cc(C(=O)N3CC[C@@H]4CCN(C)C[C@H]43)c3cnn(C(C)C)c3n2)s1 ZINC000493412189 905111723 /nfs/dbraw/zinc/11/17/23/905111723.db2.gz VDWBPCHWRBNXCX-OXJNMPFZSA-N 0 3 423.586 4.215 20 0 HIADHN O=C(CN[C@@H](Cc1ccccc1)c1ccccc1)NCCc1cccc2cccnc21 ZINC000493540880 905155418 /nfs/dbraw/zinc/15/54/18/905155418.db2.gz CHWLOIYQHPHWLY-VWLOTQADSA-N 0 3 409.533 4.467 20 0 HIADHN Fc1ccccc1OCCN1CCC[C@H](c2nnc3ccc(C(F)(F)F)cn32)C1 ZINC000493607919 905172099 /nfs/dbraw/zinc/17/20/99/905172099.db2.gz YTGGRFYTKZGISQ-AWEZNQCLSA-N 0 3 408.399 4.146 20 0 HIADHN COc1cc([C@@H](C)N[C@H](C)c2cc(Br)cs2)ccc1OCCO ZINC000493810596 905224466 /nfs/dbraw/zinc/22/44/66/905224466.db2.gz AWUVCYSLXBJCCQ-VXGBXAGGSA-N 0 3 400.338 4.302 20 0 HIADHN C[C@H](NCCCS(=O)(=O)Cc1ccccc1)c1cc(Br)cs1 ZINC000493841799 905232192 /nfs/dbraw/zinc/23/21/92/905232192.db2.gz GIRNHLZSRRIPEL-ZDUSSCGKSA-N 0 3 402.379 4.166 20 0 HIADHN O=C(Nc1cccc(-c2cc[nH]n2)c1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000493878291 905239116 /nfs/dbraw/zinc/23/91/16/905239116.db2.gz JKPWGHFPRMYVEY-NRFANRHFSA-N 0 3 414.431 4.470 20 0 HIADHN C[C@@H](N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)c1cc(Br)cs1 ZINC000493888269 905247835 /nfs/dbraw/zinc/24/78/35/905247835.db2.gz LKTLDZGDFPBPBG-PBHICJAKSA-N 0 3 407.377 4.395 20 0 HIADHN O=C1[C@H](N[C@H]2CCO[C@H]2c2ccc(F)c(F)c2)CCCN1c1ccccc1Cl ZINC000493910112 905262654 /nfs/dbraw/zinc/26/26/54/905262654.db2.gz YTEFCHBDQYPJAU-NSHGMRRFSA-N 0 3 406.860 4.233 20 0 HIADHN Cc1nc(COc2cccc(C(=O)N[C@H]3CCN(Cc4ccccc4)C3)c2)cs1 ZINC000493946583 905296498 /nfs/dbraw/zinc/29/64/98/905296498.db2.gz FVPZNMMCACVFOD-FQEVSTJZSA-N 0 3 407.539 4.035 20 0 HIADHN CCN1CCN(c2ccc(N[C@@H](C(=O)N3CCCCC3)c3ccccc3)c(C)c2)CC1 ZINC000493984348 905327739 /nfs/dbraw/zinc/32/77/39/905327739.db2.gz RSKXFQSPIULLRS-RUZDIDTESA-N 0 3 420.601 4.303 20 0 HIADHN O=[S@](CCN[C@H]1CCO[C@@H]1c1ccc(F)c(F)c1)c1cc(Cl)ccc1Cl ZINC000493983365 905328210 /nfs/dbraw/zinc/32/82/10/905328210.db2.gz DIOAXRQCCBGCFL-ZTBAGHRESA-N 0 3 420.308 4.499 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)c2ccccc2-c2nc(C(C)(C)C)no2)CCN1Cc1ccccc1 ZINC000493997776 905339038 /nfs/dbraw/zinc/33/90/38/905339038.db2.gz BIAAUNHIWSOPRL-UTKZUKDTSA-N 0 3 418.541 4.427 20 0 HIADHN COc1cccc([C@@H](NC2CCC(S(C)(=O)=O)CC2)c2ccccc2Cl)c1 ZINC000493997482 905339084 /nfs/dbraw/zinc/33/90/84/905339084.db2.gz WLYWFULNBNTLSI-QYGXFBIXSA-N 0 3 407.963 4.383 20 0 HIADHN Cc1ccc(C(=O)N[C@@H]2CCN(Cc3ccccc3)[C@H]2C)cc1NC(=O)NC(C)(C)C ZINC000494025587 905365008 /nfs/dbraw/zinc/36/50/08/905365008.db2.gz CRRBHSVBSRXSCQ-GHTZIAJQSA-N 0 3 422.573 4.308 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](NCCc2cccc(F)c2F)c2ccccc2)c1 ZINC000494026927 905367008 /nfs/dbraw/zinc/36/70/08/905367008.db2.gz FLOHYRSQEZLZSN-QFIPXVFZSA-N 0 3 401.478 4.290 20 0 HIADHN NC(=O)C1CCC(N[C@@H](c2ccc(Br)cc2)c2ccccc2F)CC1 ZINC000494040412 905382971 /nfs/dbraw/zinc/38/29/71/905382971.db2.gz SOBCDMUPUYLVJW-KJXMEXGPSA-N 0 3 405.311 4.311 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](NCCC[C@H]2CCCC[C@H]2O)c2ccc(F)cc2)c1 ZINC000494046365 905387085 /nfs/dbraw/zinc/38/70/85/905387085.db2.gz DBCVRCCRDKEHRX-NLSFWIRASA-N 0 3 419.562 4.240 20 0 HIADHN COCCN(CCC(=O)N(C)c1ccccc1)Cc1cc(Br)cs1 ZINC000494105457 905442829 /nfs/dbraw/zinc/44/28/29/905442829.db2.gz INFQSLCIXZDRMC-UHFFFAOYSA-N 0 3 411.365 4.012 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N[C@@H](C)c2nc(C(F)(F)F)cs2)N(C)C)cc1 ZINC000494175638 905511088 /nfs/dbraw/zinc/51/10/88/905511088.db2.gz JMABFJHSVMAQSI-WFASDCNBSA-N 0 3 414.497 4.387 20 0 HIADHN O=C(NCc1nc(-c2ccccc2F)cs1)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000494181417 905517561 /nfs/dbraw/zinc/51/75/61/905517561.db2.gz BMBBAMZLUCNCQA-KRWDZBQOSA-N 0 3 410.518 4.023 20 0 HIADHN Cc1ccc(-c2n[nH]cc2CN2CCC[C@H](CNC(=O)Nc3ccc(C)cc3)C2)o1 ZINC000512428050 921154419 /nfs/dbraw/zinc/15/44/19/921154419.db2.gz OWEGIMKFVDYGEZ-GOSISDBHSA-N 0 3 407.518 4.320 20 0 HIADHN COC[C@H](NC(=O)NC[C@H](c1cccs1)N1CCCC1)c1ccc(Cl)cc1 ZINC000494219120 905548505 /nfs/dbraw/zinc/54/85/05/905548505.db2.gz HMKAFCHIZNRXLV-ZWKOTPCHSA-N 0 3 407.967 4.225 20 0 HIADHN COC[C@@H](NC(=O)NC[C@@H](c1cccs1)N1CCCC1)c1ccc(Cl)cc1 ZINC000494219117 905548786 /nfs/dbraw/zinc/54/87/86/905548786.db2.gz HMKAFCHIZNRXLV-MSOLQXFVSA-N 0 3 407.967 4.225 20 0 HIADHN C[C@H](N[C@]1(C)CCO[C@@H]1C)C(=O)N1N=C(c2ccc(Cl)cc2)C[C@H]1c1ccco1 ZINC000494266631 905590020 /nfs/dbraw/zinc/59/00/20/905590020.db2.gz ZPADVPSDYAQWFL-LTRXETERSA-N 0 3 415.921 4.156 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)C[C@@H](C)c3c[nH]c4ccccc43)cc2)CC1 ZINC000494273818 905598146 /nfs/dbraw/zinc/59/81/46/905598146.db2.gz LAIXJXOHOVDHGG-LJQANCHMSA-N 0 3 404.558 4.438 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cnn(-c2ccncc2)c1C(F)F)c1ccsc1 ZINC000494290656 905611893 /nfs/dbraw/zinc/61/18/93/905611893.db2.gz NVSAVNHLXNUKNW-QGZVFWFLSA-N 0 3 419.501 4.079 20 0 HIADHN O=S(=O)(CCCNCc1ccc(Br)c(Cl)c1)c1ccccc1 ZINC000494311291 905628002 /nfs/dbraw/zinc/62/80/02/905628002.db2.gz MHVARFAJQGXLFP-UHFFFAOYSA-N 0 3 402.741 4.056 20 0 HIADHN CN1CCN(CCCNC(=O)[C@@H]2C[C@H]2c2ccc(Cl)s2)[C@@H](c2ccccc2)C1 ZINC000494321305 905633895 /nfs/dbraw/zinc/63/38/95/905633895.db2.gz YYQCOGVSOKHMLJ-GUDVDZBRSA-N 0 3 418.006 4.000 20 0 HIADHN CCCC(=O)NC[C@H]1CCCN(Cc2ccc(OCc3ccccc3)c(OC)c2)C1 ZINC000512439616 921163184 /nfs/dbraw/zinc/16/31/84/921163184.db2.gz UQJBAGPVYOUVQM-JOCHJYFZSA-N 0 3 410.558 4.403 20 0 HIADHN C[C@@H]1CN(c2ccc(Cl)c(F)c2)CCN1C(=O)Nc1cccc(CN(C)C)c1 ZINC000494379602 905675935 /nfs/dbraw/zinc/67/59/35/905675935.db2.gz XKJVZIKTZOBJDN-OAHLLOKOSA-N 0 3 404.917 4.283 20 0 HIADHN CCc1ccc([C@H](NCCCc2ccccn2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000494421465 905707467 /nfs/dbraw/zinc/70/74/67/905707467.db2.gz KIZXGBRLHSOKHS-DEOSSOPVSA-N 0 3 408.567 4.359 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1)c1nc(C(F)(F)F)cs1 ZINC000494429909 905716414 /nfs/dbraw/zinc/71/64/14/905716414.db2.gz LKFUZORELJSBEB-KCQAQPDRSA-N 0 3 412.481 4.358 20 0 HIADHN C[C@H](N[C@H]1CCO[C@@H]1c1ccc(Cl)cc1)C(=O)NC12CC3CC(CC(C3)C1)C2 ZINC000494465891 905747976 /nfs/dbraw/zinc/74/79/76/905747976.db2.gz OMPSBVRDDLYUSR-CUUCSKPQSA-N 0 3 402.966 4.233 20 0 HIADHN CC(C)CN1Cc2cccc(NC(=O)c3ccc(CN4CCSCC4)cc3)c2C1 ZINC000494479956 905760870 /nfs/dbraw/zinc/76/08/70/905760870.db2.gz PMARBTBNILGYLO-UHFFFAOYSA-N 0 3 409.599 4.459 20 0 HIADHN COC[C@H](N[C@@H](C)CC(=O)Nc1ccc(OC)cc1OC)c1ccc(Cl)cc1 ZINC000494510861 905802218 /nfs/dbraw/zinc/80/22/18/905802218.db2.gz PFAJOJAUWDBFNU-LIRRHRJNSA-N 0 3 406.910 4.052 20 0 HIADHN CC(C)n1ncc2cc(CN3CCC[C@H](CNC(=O)Nc4cccc(F)c4)C3)cnc21 ZINC000512478181 921187578 /nfs/dbraw/zinc/18/75/78/921187578.db2.gz BKSOCMRMHMQAMM-QGZVFWFLSA-N 0 3 424.524 4.185 20 0 HIADHN CC(C)c1ccc(/C=C\CC(=O)NCc2ccccc2CN2CCC(O)CC2)cc1 ZINC000494632345 905874514 /nfs/dbraw/zinc/87/45/14/905874514.db2.gz RPGWMJFLRJTWLP-WAYWQWQTSA-N 0 3 406.570 4.486 20 0 HIADHN Cc1cc(-c2cc(C(=O)NCCN3CCC(C)CC3)c3cnn(C(C)C)c3n2)c(C)o1 ZINC000512478230 921187652 /nfs/dbraw/zinc/18/76/52/921187652.db2.gz BPRFVBHBKRVFOB-UHFFFAOYSA-N 0 3 423.561 4.351 20 0 HIADHN COC[C@H](c1ccc(Cl)cc1)N(C)C(=O)NCCCN1CCc2ccccc2C1 ZINC000494660724 905887531 /nfs/dbraw/zinc/88/75/31/905887531.db2.gz HBVFLGSIJQDWPS-JOCHJYFZSA-N 0 3 415.965 4.117 20 0 HIADHN C[C@H]1CN(C2CCOCC2)CCN1C(=O)N[C@@H](CC(C)(C)C)c1ccc(F)cc1 ZINC000494665845 905890472 /nfs/dbraw/zinc/89/04/72/905890472.db2.gz FEMUWKRZWOBJOW-UWJYYQICSA-N 0 3 405.558 4.198 20 0 HIADHN COC[C@H](NC(=O)N[C@@H](CN1CCCC1)c1ccccc1)c1ccc(Cl)cc1 ZINC000494719179 905923259 /nfs/dbraw/zinc/92/32/59/905923259.db2.gz KQXYOEWVJMGWEA-SFTDATJTSA-N 0 3 401.938 4.164 20 0 HIADHN O=C(NC[C@@H](OCc1ccccc1)c1ccc(Cl)cc1)N1CCN2CCC1CC2 ZINC000494775753 905973295 /nfs/dbraw/zinc/97/32/95/905973295.db2.gz UNBWOWQYEITMHP-JOCHJYFZSA-N 0 3 413.949 4.088 20 0 HIADHN CC1CCN([C@@H](CNC(=O)c2ccc3c(c2)C(C)(C)C(=O)N3)c2cccs2)CC1 ZINC000494784901 905985965 /nfs/dbraw/zinc/98/59/65/905985965.db2.gz MSSBOAKMTKQDJE-IBGZPJMESA-N 0 3 411.571 4.181 20 0 HIADHN CN(Cc1ccc(Br)c(F)c1)C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000494839480 906029473 /nfs/dbraw/zinc/02/94/73/906029473.db2.gz XSTFMLGBWMMAML-RTBURBONSA-N 0 3 420.326 4.175 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)Nc3cc(Cl)c(F)c(Cl)c3)CC2)C[C@H](C)O1 ZINC000494890614 906067419 /nfs/dbraw/zinc/06/74/19/906067419.db2.gz GZDJATPIEJQOII-STQMWFEESA-N 0 3 418.340 4.486 20 0 HIADHN Cc1cccc(-c2cccc(CNC(=O)N3CCN(C4CCOCC4)C[C@@H]3C)c2)c1 ZINC000494898396 906072716 /nfs/dbraw/zinc/07/27/16/906072716.db2.gz REEPUNYPGDOMSW-FQEVSTJZSA-N 0 3 407.558 4.057 20 0 HIADHN CC1(C)C[C@@H](N[C@@H](c2ccc(Cl)cc2)c2cccc(S(C)(=O)=O)c2)CCO1 ZINC000494945583 906116190 /nfs/dbraw/zinc/11/61/90/906116190.db2.gz AVPJBLBTRMPKSW-ICSRJNTNSA-N 0 3 407.963 4.380 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)C(C)(C)CCCc3ccccc3)CC2)C[C@H](C)O1 ZINC000494955314 906127695 /nfs/dbraw/zinc/12/76/95/906127695.db2.gz SKNWOXJPFGHTLB-SFTDATJTSA-N 0 3 400.607 4.383 20 0 HIADHN CCCC(=O)NC[C@H]1CCCN(Cc2c[nH]nc2-c2ccc(C(F)(F)F)cc2)C1 ZINC000494961293 906132040 /nfs/dbraw/zinc/13/20/40/906132040.db2.gz UITXGNJLLCWBGP-OAHLLOKOSA-N 0 3 408.468 4.224 20 0 HIADHN CC(C)(C)C(=O)NC[C@H]1CCCN(Cc2c[nH]nc2-c2ccc(C(F)(F)F)cc2)C1 ZINC000494962267 906132137 /nfs/dbraw/zinc/13/21/37/906132137.db2.gz UUYHVWFUIGQPFX-OAHLLOKOSA-N 0 3 422.495 4.470 20 0 HIADHN C[C@H](NC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1)[C@H]1OCCc2sccc21 ZINC000494972060 906139741 /nfs/dbraw/zinc/13/97/41/906139741.db2.gz FZMMFMJDPHOOPX-LQBOVUBWSA-N 0 3 413.587 4.056 20 0 HIADHN Cc1ccc(Br)cc1NC(=O)CCN[C@@H](c1nnc[nH]1)C1CCCCC1 ZINC000495058142 906210675 /nfs/dbraw/zinc/21/06/75/906210675.db2.gz IEGRKBDBHQKDCK-GOSISDBHSA-N 0 3 420.355 4.115 20 0 HIADHN O=C(Nc1ccc(Br)cn1)C1CCN(Cc2scnc2C2CC2)CC1 ZINC000495141857 906268210 /nfs/dbraw/zinc/26/82/10/906268210.db2.gz RCBPJVFSVQYONP-UHFFFAOYSA-N 0 3 421.364 4.029 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N[C@@H](C)c2nc(C(F)(F)F)cs2)N(C)C)cc1 ZINC000495178458 906289221 /nfs/dbraw/zinc/28/92/21/906289221.db2.gz QMRHXKHOLOKIBX-GXTWGEPZSA-N 0 3 400.470 4.133 20 0 HIADHN Cc1cccc(-c2cncc(C(=O)N3CCC(CN4C[C@H](C)O[C@@H](C)C4)CC3)c2)c1 ZINC000495199324 906303231 /nfs/dbraw/zinc/30/32/31/906303231.db2.gz BYUNTBWRJJIRDZ-PMACEKPBSA-N 0 3 407.558 4.018 20 0 HIADHN CCC[C@H](C)NC(=O)[C@H]1CCCN(Cc2c(C)nn(-c3ccc(F)cc3)c2C)C1 ZINC000512542202 921225051 /nfs/dbraw/zinc/22/50/51/921225051.db2.gz MBFULJGPSUTYSZ-LPHOPBHVSA-N 0 3 400.542 4.145 20 0 HIADHN CN(C(=O)Nc1ccc(CCN2CCSCC2)cc1)[C@H]1CCc2ccccc2C1 ZINC000512549640 921229969 /nfs/dbraw/zinc/22/99/69/921229969.db2.gz URXAOUQHBHWPPG-QHCPKHFHSA-N 0 3 409.599 4.299 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)[C@H](C)[C@@H]3OCCc4sccc43)c2)CC1 ZINC000495365610 906407488 /nfs/dbraw/zinc/40/74/88/906407488.db2.gz JGUPRNIKJBWGQH-VGSWGCGISA-N 0 3 413.587 4.167 20 0 HIADHN O=C(CCCC(=O)N1CCC[C@H]1CN1CCCCC1)c1ccc(Br)cc1 ZINC000495402403 906428679 /nfs/dbraw/zinc/42/86/79/906428679.db2.gz QMDLZTFYZFZAKL-IBGZPJMESA-N 0 3 421.379 4.279 20 0 HIADHN C[C@H](COc1ccc2cc(Br)ccc2c1)NCc1ccnc2ccnn21 ZINC000495416353 906437910 /nfs/dbraw/zinc/43/79/10/906437910.db2.gz ZECNYGVRIAEXJG-CQSZACIVSA-N 0 3 411.303 4.202 20 0 HIADHN C[C@H](NC(=O)N[C@H]1CCN(Cc2ccccc2)[C@H]1C)c1nc(C(C)(C)C)cs1 ZINC000495449171 906455789 /nfs/dbraw/zinc/45/57/89/906455789.db2.gz ATLICNNYVWLQCJ-BQFCYCMXSA-N 0 3 400.592 4.464 20 0 HIADHN C[C@@H](NCc1cccc(NC(=O)Cn2cccn2)c1)c1ccc(C(F)(F)F)cc1 ZINC000495529930 906497379 /nfs/dbraw/zinc/49/73/79/906497379.db2.gz LQEYBTKIDQEEMG-OAHLLOKOSA-N 0 3 402.420 4.391 20 0 HIADHN C[C@H](NCc1cccc(NC(=O)Cn2cccn2)c1)c1ccc(OC(F)(F)F)cc1 ZINC000495530734 906499214 /nfs/dbraw/zinc/49/92/14/906499214.db2.gz OILDJLSIUMGNRC-HNNXBMFYSA-N 0 3 418.419 4.271 20 0 HIADHN Fc1ccc(-c2n[nH]cc2CN2CCC(c3nc(-c4ccccc4)n[nH]3)CC2)cc1 ZINC000512567546 921241538 /nfs/dbraw/zinc/24/15/38/921241538.db2.gz BOFRTGXGTHCUDZ-UHFFFAOYSA-N 0 3 402.477 4.381 20 0 HIADHN COc1ccc(CCC(=O)N2CCCN(Cc3c(C)oc4ccccc43)CC2)cc1 ZINC000512583600 921248563 /nfs/dbraw/zinc/24/85/63/921248563.db2.gz TWUZAEPRMJWNEF-UHFFFAOYSA-N 0 3 406.526 4.417 20 0 HIADHN CCc1nc([C@H](C)NC(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)cs1 ZINC000496165506 906618527 /nfs/dbraw/zinc/61/85/27/906618527.db2.gz HAFZICNFATULRD-HNAYVOBHSA-N 0 3 404.580 4.156 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)CSCc1ccc(Cl)cc1 ZINC000496247459 906638620 /nfs/dbraw/zinc/63/86/20/906638620.db2.gz WMHJDHFKCFYENK-NRFANRHFSA-N 0 3 418.006 4.481 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)c1cc(C(C)C)n(C(C)(C)C)n1 ZINC000496261531 906640556 /nfs/dbraw/zinc/64/05/56/906640556.db2.gz INLIMTJIALDVFE-HXUWFJFHSA-N 0 3 411.594 4.283 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)c1cc(C2CC2)n(C(C)(C)C)n1 ZINC000496272774 906645053 /nfs/dbraw/zinc/64/50/53/906645053.db2.gz PTVUITWWPAPWQQ-HXUWFJFHSA-N 0 3 409.578 4.037 20 0 HIADHN O=C(Nc1ccc(O)cc1)C1CCN(Cc2c[nH]nc2-c2cccc(Cl)c2)CC1 ZINC000512630443 921268046 /nfs/dbraw/zinc/26/80/46/921268046.db2.gz XRKVDIIYCJJORL-UHFFFAOYSA-N 0 3 410.905 4.286 20 0 HIADHN CO[C@H](c1ccccc1Cl)[C@H](C)NCc1ccccc1OCC(=O)N1CCCC1 ZINC000497154220 906813650 /nfs/dbraw/zinc/81/36/50/906813650.db2.gz ZVWMITAIHZJTJI-SBUREZEXSA-N 0 3 416.949 4.207 20 0 HIADHN COc1ccc(CC[C@H]2CCCCN2Cc2ccc([S@](C)=O)cc2)cc1OC ZINC000512644040 921271906 /nfs/dbraw/zinc/27/19/06/921271906.db2.gz IHVOWBIUIJABEJ-NGOKVRLYSA-N 0 3 401.572 4.429 20 0 HIADHN CN(C)[C@H](CNC(=O)CCSc1ccc(Br)cc1)c1ccccc1 ZINC000497375102 906862547 /nfs/dbraw/zinc/86/25/47/906862547.db2.gz UUILYQQKPPRLGW-GOSISDBHSA-N 0 3 407.377 4.350 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)Cc2sc(C)nc2-c2ccc(C)cc2)o1 ZINC000497378558 906867585 /nfs/dbraw/zinc/86/75/85/906867585.db2.gz LKSDETRHGHDKBH-UHFFFAOYSA-N 0 3 411.571 4.461 20 0 HIADHN CO[C@@H]1CCC[C@@H](C(=O)Nc2cccc(N3CCN(CCc4ccccc4)CC3)c2)C1 ZINC000497398551 906879194 /nfs/dbraw/zinc/87/91/94/906879194.db2.gz FQHKIIGKHKHSIG-RCZVLFRGSA-N 0 3 421.585 4.195 20 0 HIADHN O=C(Nc1cc(C(F)F)ccc1Cl)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1CO ZINC000497448112 906923039 /nfs/dbraw/zinc/92/30/39/906923039.db2.gz XVMDGDFGNQXMHY-SJLPKXTDSA-N 0 3 423.891 4.282 20 0 HIADHN COc1cccc([C@H](NC(=O)N2CC[C@@H]3CCN(C)C[C@H]32)c2ccccc2Cl)c1 ZINC000497503595 906990688 /nfs/dbraw/zinc/99/06/88/906990688.db2.gz LGDOEDHLHHBJNV-USCONSEESA-N 0 3 413.949 4.174 20 0 HIADHN COc1cc(F)c([C@@H](C)NC(=O)NC[C@@H](c2cccs2)N2CCCC2)cc1OC ZINC000512678120 921284655 /nfs/dbraw/zinc/28/46/55/921284655.db2.gz OQNMHGHUIAEZCU-PBHICJAKSA-N 0 3 421.538 4.102 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)NCc3csc(-c4ccc(C(F)(F)F)cc4)n3)[C@H]2C1 ZINC000497511074 907000980 /nfs/dbraw/zinc/00/09/80/907000980.db2.gz WKLYUOFUIIEYIY-GUYCJALGSA-N 0 3 424.492 4.065 20 0 HIADHN Cc1ccc(CNC(=O)C2CCN(Cc3c[nH]nc3-c3cccc(C)c3)CC2)cc1 ZINC000512683514 921286460 /nfs/dbraw/zinc/28/64/60/921286460.db2.gz TUPNNEXCENZHRD-UHFFFAOYSA-N 0 3 402.542 4.222 20 0 HIADHN COc1ccc([C@H](CNC(=O)[C@H]2C[C@@H]2c2ccc(F)cc2F)N2CCCC2)cc1 ZINC000497556106 907044688 /nfs/dbraw/zinc/04/46/88/907044688.db2.gz HUVNJSZHQCUXKU-URVUXULASA-N 0 3 400.469 4.030 20 0 HIADHN CC(C)[C@H](c1ccccc1)N(C)C(=O)NCCCN1CCN(C)C[C@@H]1c1ccccc1 ZINC000497604668 907083771 /nfs/dbraw/zinc/08/37/71/907083771.db2.gz SUXTVSNKFAITSJ-JWQCQUIFSA-N 0 3 422.617 4.404 20 0 HIADHN Cc1ccccc1OC[C@H](O)CN1CCC(c2nc3cc(Cl)ccc3o2)CC1 ZINC000497617496 907096292 /nfs/dbraw/zinc/09/62/92/907096292.db2.gz FPBOYFZCKGZFBZ-GOSISDBHSA-N 0 3 400.906 4.409 20 0 HIADHN C[C@H](NC(=O)N1CC[C@@H]2CCN(C)C[C@H]21)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000497628601 907108062 /nfs/dbraw/zinc/10/80/62/907108062.db2.gz PXZHHBMBWSZKAD-KPDCDPCYSA-N 0 3 411.521 4.201 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)c1cnc(-c2ccccc2)s1 ZINC000512715272 921294839 /nfs/dbraw/zinc/29/48/39/921294839.db2.gz CVPRUJSARXSGHD-UHFFFAOYSA-N 0 3 420.582 4.142 20 0 HIADHN CC(C)(C)c1cnc(CNC(=O)N[C@H](CN2CCc3ccccc3C2)C(C)(C)C)o1 ZINC000497659560 907151708 /nfs/dbraw/zinc/15/17/08/907151708.db2.gz JSCQNVZUEBIRBM-LJQANCHMSA-N 0 3 412.578 4.244 20 0 HIADHN CS[C@@H]1CN(C(=O)Nc2ccc(Sc3nc(C)cs3)cc2)C[C@H]1N(C)C ZINC000497674660 907177413 /nfs/dbraw/zinc/17/74/13/907177413.db2.gz AYAVZYNDBAAMNH-HZPDHXFCSA-N 0 3 408.618 4.112 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)NCc2ccc(-c3ccncc3)cc2)CCN1Cc1ccccc1 ZINC000497706997 907213296 /nfs/dbraw/zinc/21/32/96/907213296.db2.gz XZTAKXQSNTYYOX-DVECYGJZSA-N 0 3 400.526 4.211 20 0 HIADHN C[C@@H]1CC=CC[C@H]1C(=O)NC1CCN(CCOc2ccc(Br)cc2)CC1 ZINC000512788714 921311521 /nfs/dbraw/zinc/31/15/21/921311521.db2.gz RKEGTWVTEKUQIA-OXQOHEQNSA-N 0 3 421.379 4.011 20 0 HIADHN CCc1ccc([C@H](CNC(=O)CSc2ccc(C(F)(F)F)cn2)N(C)C)cc1 ZINC000497799112 907285172 /nfs/dbraw/zinc/28/51/72/907285172.db2.gz RBWKIWHOVABGMH-KRWDZBQOSA-N 0 3 411.493 4.174 20 0 HIADHN C[C@@H](CC(=O)OC(C)(C)C)N[C@H](CN1CCCC1=O)c1cccc(C(F)(F)F)c1 ZINC000497830963 907313334 /nfs/dbraw/zinc/31/33/34/907313334.db2.gz FSVCDIOGPDHBNX-WMLDXEAASA-N 0 3 414.468 4.079 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)N[C@H](CC1CCC1)c1ccccc1 ZINC000497835761 907316406 /nfs/dbraw/zinc/31/64/06/907316406.db2.gz KOOXWEILUZFDNX-RUZDIDTESA-N 0 3 421.585 4.374 20 0 HIADHN CCc1ccc([C@@H](N[C@H](C)CCn2cccn2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000497850956 907331094 /nfs/dbraw/zinc/33/10/94/907331094.db2.gz DKPXFALHIBRVGA-WZONZLPQSA-N 0 3 411.571 4.007 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)C(C)(C)c3ccccc3F)CC2)c1 ZINC000497930842 907396459 /nfs/dbraw/zinc/39/64/59/907396459.db2.gz UYVQVXGSKCHONY-UHFFFAOYSA-N 0 3 411.565 4.130 20 0 HIADHN CCOC(=O)c1c(C)[nH]c(C(=O)N(CC)[C@@H]2CCN([C@@H](C)c3ccccc3)C2)c1C ZINC000497956290 907427411 /nfs/dbraw/zinc/42/74/11/907427411.db2.gz ATHGBRQFTZSIPJ-AZUAARDMSA-N 0 3 411.546 4.106 20 0 HIADHN CC(C)C[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)Nc1cccc(CN(C)C)c1 ZINC000497970332 907439567 /nfs/dbraw/zinc/43/95/67/907439567.db2.gz ZWASKQSIVSHQSC-HXUWFJFHSA-N 0 3 401.938 4.185 20 0 HIADHN C[C@H]1CCN(C(=O)NCCc2csc(C(C)(C)C)n2)CCN1Cc1ccccc1 ZINC000497969723 907440704 /nfs/dbraw/zinc/44/07/04/907440704.db2.gz TWAPVZWLDJTROA-SFHVURJKSA-N 0 3 414.619 4.289 20 0 HIADHN Cc1ccc(C2CCN(C(=O)NC[C@H](c3ccc(OC(C)C)cc3)N(C)C)CC2)cn1 ZINC000512822274 921326910 /nfs/dbraw/zinc/32/69/10/921326910.db2.gz UNZAZWOWPHDXRI-XMMPIXPASA-N 0 3 424.589 4.369 20 0 HIADHN CC(C)(c1ccccc1)c1ccc(OC[C@H](O)CN2CC[C@H](COC(F)F)C2)cc1 ZINC000512824983 921330022 /nfs/dbraw/zinc/33/00/22/921330022.db2.gz ZVGFAIYYJAAIOQ-GHTZIAJQSA-N 0 3 419.512 4.313 20 0 HIADHN CCOC1CC2(C1)CCN(CC(=O)N1CCCCC[C@@H]1c1ccc(OC)cc1)C2 ZINC000512827239 921331966 /nfs/dbraw/zinc/33/19/66/921331966.db2.gz JABBMDUVJHOQAL-XERBYJISSA-N 0 3 400.563 4.030 20 0 HIADHN CCC(CC)[C@@H]1C[C@H](NC(=O)NC[C@H](c2cccc(OC)c2)N2CCCC2)CCO1 ZINC000498116899 907628554 /nfs/dbraw/zinc/62/85/54/907628554.db2.gz HBUTYNDPLCHXEG-MZYLBHOOSA-N 0 3 417.594 4.115 20 0 HIADHN CCCCCOc1ccc([C@H](C)NC(=O)N2CC[C@@H]3CCN(C)C[C@@H]32)cc1OC ZINC000498155821 907681075 /nfs/dbraw/zinc/68/10/75/907681075.db2.gz FANOGXPPDGUONN-BJLQDIEVSA-N 0 3 403.567 4.061 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)NCCc2csc(C(C)(C)C)n2)C1 ZINC000498240851 907775958 /nfs/dbraw/zinc/77/59/58/907775958.db2.gz WQIJLWFKFYUTJA-SJLPKXTDSA-N 0 3 400.592 4.118 20 0 HIADHN CCOc1ccc([C@@H](C)NC(=O)CCCNCc2nc3c(s2)C[C@@H](C)CC3)cc1 ZINC000498349553 907851875 /nfs/dbraw/zinc/85/18/75/907851875.db2.gz FIECEEQLGOEKQE-DLBZAZTESA-N 0 3 415.603 4.414 20 0 HIADHN C[C@@H]1CCc2nc(CNC3CCN(c4ccc(C(F)(F)F)cn4)CC3)sc2C1 ZINC000498360302 907857138 /nfs/dbraw/zinc/85/71/38/907857138.db2.gz ZVLZQHYTODHUIU-CYBMUJFWSA-N 0 3 410.509 4.440 20 0 HIADHN CCOc1cccc2c1OCC(C(=O)NC[C@@H](c1ccsc1)N(CC)CC)=C2 ZINC000498370011 907861846 /nfs/dbraw/zinc/86/18/46/907861846.db2.gz ZTZRUTFNYWFFFO-IBGZPJMESA-N 0 3 400.544 4.122 20 0 HIADHN COCC[C@@H](NC(=O)N(CCN(C)C)Cc1cccc(Cl)c1)c1ccc(C)o1 ZINC000498388531 907874146 /nfs/dbraw/zinc/87/41/46/907874146.db2.gz WHXQKICGBGLBHW-LJQANCHMSA-N 0 3 407.942 4.092 20 0 HIADHN COCC[C@H](NC(=O)N(CCN(C)C)Cc1cccc(Cl)c1)c1ccc(C)o1 ZINC000498388528 907874179 /nfs/dbraw/zinc/87/41/79/907874179.db2.gz WHXQKICGBGLBHW-IBGZPJMESA-N 0 3 407.942 4.092 20 0 HIADHN CCC(CC)[C@H]1C[C@@H](NC(=O)N(CCN(C)C)Cc2cccc(Cl)c2)CCO1 ZINC000498392397 907877040 /nfs/dbraw/zinc/87/70/40/907877040.db2.gz QJZYDIMTYSUKFF-LEWJYISDSA-N 0 3 410.002 4.397 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)N[C@H]2COc3c2ccc(Cl)c3Cl)cc1 ZINC000498412503 907889049 /nfs/dbraw/zinc/88/90/49/907889049.db2.gz AWWKSTICAWNNBI-IRXDYDNUSA-N 0 3 424.328 4.038 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)c2cc3sc4ccccc4c3s2)CC1 ZINC000498424921 907896369 /nfs/dbraw/zinc/89/63/69/907896369.db2.gz JKGRZLFWGMTOIU-HNNXBMFYSA-N 0 3 401.601 4.119 20 0 HIADHN Cc1cc(-c2cc(C(=O)N(CCN(C)C)C3CCCC3)c3c(C)noc3n2)c(C)o1 ZINC000498458204 907922442 /nfs/dbraw/zinc/92/24/42/907922442.db2.gz SNOVRGAMWUVYJU-UHFFFAOYSA-N 0 3 410.518 4.354 20 0 HIADHN C[C@H](c1ccc(F)c(Cl)c1)N1CCC[C@@H](CN2CCN(c3ccccn3)CC2)C1 ZINC000498559973 908019787 /nfs/dbraw/zinc/01/97/87/908019787.db2.gz LIXXFPGDLXPGGZ-MOPGFXCFSA-N 0 3 416.972 4.469 20 0 HIADHN C[C@@H]1CC[C@@H](C)N1CC(=O)NCc1cn(Cc2ccccc2)nc1-c1ccccc1 ZINC000498606917 908055115 /nfs/dbraw/zinc/05/51/15/908055115.db2.gz OYTLWJSWYFEFQS-WOJBJXKFSA-N 0 3 402.542 4.087 20 0 HIADHN CCCc1noc2nc(C3CC3)cc(C(=O)N(CCN(C)C)Cc3ccccc3F)c12 ZINC000498710888 908136908 /nfs/dbraw/zinc/13/69/08/908136908.db2.gz NKIGQEXHOPQWTM-UHFFFAOYSA-N 0 3 424.520 4.396 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)NC[C@@H]1CCCO[C@H]1c1ccc(C)cc1 ZINC000498722420 908147376 /nfs/dbraw/zinc/14/73/76/908147376.db2.gz XQXSIPDJPLQMOQ-GOTSBHOMSA-N 0 3 401.595 4.370 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@@H]2CNC(=O)N[C@H](CN(C)C)c2ccc(F)cc2)cc1 ZINC000498724081 908149618 /nfs/dbraw/zinc/14/96/18/908149618.db2.gz ZJXHHSIPEIUWDU-MZYLBHOOSA-N 0 3 413.537 4.204 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@@H]2CNC(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)cc1 ZINC000498726868 908153785 /nfs/dbraw/zinc/15/37/85/908153785.db2.gz GLZURFPKVDAIDE-CDIGIKMISA-N 0 3 409.574 4.453 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N[C@@H](C)c1nc(C2CCCCC2)no1)c1ccco1 ZINC000498733497 908162839 /nfs/dbraw/zinc/16/28/39/908162839.db2.gz YDQFNTQWBCZACZ-YQQAZPJKSA-N 0 3 403.527 4.200 20 0 HIADHN O=C(CC(F)(F)F)N1CCC(N[C@H](c2cc3ccccc3o2)c2cccnc2)CC1 ZINC000498774165 908194372 /nfs/dbraw/zinc/19/43/72/908194372.db2.gz OLMIQMORBVMEFQ-NRFANRHFSA-N 0 3 417.431 4.450 20 0 HIADHN O=C(c1cccc(CN2CCCC2)c1)N1CCO[C@@H](c2ccc(OC(F)F)cc2)C1 ZINC000498841658 908247106 /nfs/dbraw/zinc/24/71/06/908247106.db2.gz NUBVYDOROOSSTC-OAQYLSRUSA-N 0 3 416.468 4.098 20 0 HIADHN CC(C)c1ccccc1NC(=O)N1CCC[C@@H](CN2CCN(c3ccccn3)CC2)C1 ZINC000498844868 908249472 /nfs/dbraw/zinc/24/94/72/908249472.db2.gz RLJAQKCKZGNJGL-NRFANRHFSA-N 0 3 421.589 4.271 20 0 HIADHN CCCO[C@@H]1CCCN(C(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)CC1 ZINC000512903376 921396747 /nfs/dbraw/zinc/39/67/47/921396747.db2.gz YUDPHJJKJHZPKS-IFMALSPDSA-N 0 3 405.583 4.067 20 0 HIADHN CCOC(=O)c1c(C)c2ccccc2nc1CN1CCC[C@@H](c2nc(C3CC3)n[nH]2)C1 ZINC000498919354 908328183 /nfs/dbraw/zinc/32/81/83/908328183.db2.gz RXSOWGWTCZHCSK-QGZVFWFLSA-N 0 3 419.529 4.095 20 0 HIADHN CC(C)c1ccc(CN(C(=O)CN2CCC[C@H](c3nc(C4CC4)n[nH]3)C2)C2CC2)cc1 ZINC000498928164 908335642 /nfs/dbraw/zinc/33/56/42/908335642.db2.gz WYFVXAXEVIAMAK-NRFANRHFSA-N 0 3 421.589 4.176 20 0 HIADHN CC(C)c1ccc(CN(C(=O)CN2CCC[C@H](c3n[nH]c(C4CC4)n3)C2)C2CC2)cc1 ZINC000498928164 908335656 /nfs/dbraw/zinc/33/56/56/908335656.db2.gz WYFVXAXEVIAMAK-NRFANRHFSA-N 0 3 421.589 4.176 20 0 HIADHN C[C@H](C(=O)N[C@@H](C)c1ccc2ccccc2c1)N1CCC[C@@H](c2nc(C3CC3)n[nH]2)C1 ZINC000498939953 908345912 /nfs/dbraw/zinc/34/59/12/908345912.db2.gz OVLWSWBYOMWBOB-GSHUGGBRSA-N 0 3 417.557 4.281 20 0 HIADHN C[C@H](C(=O)N[C@@H](C)c1ccc2ccccc2c1)N1CCC[C@@H](c2n[nH]c(C3CC3)n2)C1 ZINC000498939953 908345928 /nfs/dbraw/zinc/34/59/28/908345928.db2.gz OVLWSWBYOMWBOB-GSHUGGBRSA-N 0 3 417.557 4.281 20 0 HIADHN C[C@H](C(=O)N[C@@H](C)c1ccc2ccccc2c1)N1CCC[C@H](c2nc(C3CC3)n[nH]2)C1 ZINC000498939955 908347471 /nfs/dbraw/zinc/34/74/71/908347471.db2.gz OVLWSWBYOMWBOB-JKSBSHDWSA-N 0 3 417.557 4.281 20 0 HIADHN C[C@H](C(=O)N[C@@H](C)c1ccc2ccccc2c1)N1CCC[C@H](c2n[nH]c(C3CC3)n2)C1 ZINC000498939955 908347476 /nfs/dbraw/zinc/34/74/76/908347476.db2.gz OVLWSWBYOMWBOB-JKSBSHDWSA-N 0 3 417.557 4.281 20 0 HIADHN C[C@H](NC(=O)[C@H](C)N1CCC[C@@H](c2nc(C3CC3)n[nH]2)C1)c1ccc2ccccc2c1 ZINC000498939956 908348165 /nfs/dbraw/zinc/34/81/65/908348165.db2.gz OVLWSWBYOMWBOB-PNLZDCPESA-N 0 3 417.557 4.281 20 0 HIADHN C[C@H](NC(=O)[C@H](C)N1CCC[C@@H](c2n[nH]c(C3CC3)n2)C1)c1ccc2ccccc2c1 ZINC000498939956 908348182 /nfs/dbraw/zinc/34/81/82/908348182.db2.gz OVLWSWBYOMWBOB-PNLZDCPESA-N 0 3 417.557 4.281 20 0 HIADHN CCN1C[C@@H](C)N(CC(=O)Nc2nc(-c3cc(C)c(C)cc3C)cs2)C[C@H]1C ZINC000498944129 908349769 /nfs/dbraw/zinc/34/97/69/908349769.db2.gz ZMQACYRMPKIZIM-QZTJIDSGSA-N 0 3 400.592 4.088 20 0 HIADHN CC[C@H](C)Sc1ccc(NC(=O)C(=O)NCC(C)(C)N2CCCCC2)c(C)c1 ZINC000498962022 908358486 /nfs/dbraw/zinc/35/84/86/908358486.db2.gz JPJFDNXEMNUFCK-KRWDZBQOSA-N 0 3 405.608 4.205 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)NC2(c3ccc(F)cc3F)CCCCC2)CC1 ZINC000499014599 908390303 /nfs/dbraw/zinc/39/03/03/908390303.db2.gz QHCWGZTYCNOUIK-UHFFFAOYSA-N 0 3 423.548 4.313 20 0 HIADHN COc1ccc([C@H](CO)N(C)CCOc2ccc(Cl)cc2Br)cc1 ZINC000499049782 908421630 /nfs/dbraw/zinc/42/16/30/908421630.db2.gz SKCRFLVAEKGVDR-KRWDZBQOSA-N 0 3 414.727 4.155 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(-n2cncn2)cc1)C(=O)Nc1cccc(Cl)c1Cl ZINC000499073466 908438784 /nfs/dbraw/zinc/43/87/84/908438784.db2.gz RKLAIOGFIOFBKS-STQMWFEESA-N 0 3 404.301 4.252 20 0 HIADHN COc1ccc([C@@H](C)N(C)C(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)cc1 ZINC000512918555 921412339 /nfs/dbraw/zinc/41/23/39/921412339.db2.gz QQXRHYJWGNCWIS-WZONZLPQSA-N 0 3 413.562 4.488 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)CCc2nc(-c3ccc(Cl)cc3)no2)N(C)C)cc1 ZINC000499140783 908497037 /nfs/dbraw/zinc/49/70/37/908497037.db2.gz GGVDFPQLKGHEPJ-LJQANCHMSA-N 0 3 412.921 4.050 20 0 HIADHN Cc1ccc([C@H](CNC(=O)[C@@H](C)Oc2ccc(F)cc2Br)N(C)C)cc1 ZINC000499169054 908521250 /nfs/dbraw/zinc/52/12/50/908521250.db2.gz RNALEEABWGQNCO-KDOFPFPSSA-N 0 3 423.326 4.083 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)[C@H](C)Oc2ccc(F)cc2Br)N(C)C)cc1 ZINC000499169053 908521293 /nfs/dbraw/zinc/52/12/93/908521293.db2.gz RNALEEABWGQNCO-KBXCAEBGSA-N 0 3 423.326 4.083 20 0 HIADHN CCOc1cccc(CNC(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)c1OC(F)F ZINC000499210829 908565925 /nfs/dbraw/zinc/56/59/25/908565925.db2.gz LLECZORQLQXJJO-HNAYVOBHSA-N 0 3 421.488 4.177 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)N2CCc3nc(-c4ccccc4Cl)sc3C2)CN1C1CC1 ZINC000499304445 908675968 /nfs/dbraw/zinc/67/59/68/908675968.db2.gz RLQCBOBQAYTKGQ-KGLIPLIRSA-N 0 3 416.978 4.156 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)N[C@@H](c1cccc(F)c1)c1ccccn1 ZINC000499308024 908683671 /nfs/dbraw/zinc/68/36/71/908683671.db2.gz JAGXZNUXLZSCJP-NRFANRHFSA-N 0 3 412.534 4.145 20 0 HIADHN C[C@H](NC(=O)NCCc1csc(-c2ccccc2)n1)[C@@H](c1ccccc1)N(C)C ZINC000499333219 908707985 /nfs/dbraw/zinc/70/79/85/908707985.db2.gz CRPNIFBQYMNUER-UWJYYQICSA-N 0 3 408.571 4.343 20 0 HIADHN CC(C)Cc1ccc([C@H](CNC(=O)NCc2nnc(C(C)(C)C)s2)N(C)C)cc1 ZINC000499357391 908724920 /nfs/dbraw/zinc/72/49/20/908724920.db2.gz IGCLCKDWUGVUIB-SFHVURJKSA-N 0 3 417.623 4.136 20 0 HIADHN Cc1cc(C)n([C@@H](C)CC(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)n1 ZINC000499358292 908727519 /nfs/dbraw/zinc/72/75/19/908727519.db2.gz QLNFHCXLMUNKKP-KRWDZBQOSA-N 0 3 410.484 4.060 20 0 HIADHN C[C@H](OCc1ccccc1)C(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1 ZINC000499360417 908729004 /nfs/dbraw/zinc/72/90/04/908729004.db2.gz MDHWLDWFBDCVDP-KRWDZBQOSA-N 0 3 408.464 4.201 20 0 HIADHN Cc1nn(C)c(C)c1CC(=O)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000499364849 908731300 /nfs/dbraw/zinc/73/13/00/908731300.db2.gz RTVXUSWDDRSJGO-UHFFFAOYSA-N 0 3 423.388 4.011 20 0 HIADHN COc1cc(C(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)ccc1OC(F)F ZINC000499418083 908783504 /nfs/dbraw/zinc/78/35/04/908783504.db2.gz CEUGBPQDZZFFHR-SFHVURJKSA-N 0 3 404.457 4.172 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(C)c1C(=O)N(C)C1CCN(Cc2ccccc2)CC1 ZINC000499629727 908861237 /nfs/dbraw/zinc/86/12/37/908861237.db2.gz DZAFBVMHPSDMPE-UHFFFAOYSA-N 0 3 420.532 4.365 20 0 HIADHN C[C@H]1C[C@@H](NCc2nnc3c(Cl)cc(C(F)(F)F)cn23)CN1Cc1ccccc1 ZINC000499661583 908868359 /nfs/dbraw/zinc/86/83/59/908868359.db2.gz DAKUIVWVAAJCAW-XJKSGUPXSA-N 0 3 423.870 4.154 20 0 HIADHN Cc1nn(-c2ccccc2)c(Oc2ccc(F)cc2)c1CNCCc1cnn(C)c1 ZINC000499664772 908869960 /nfs/dbraw/zinc/86/99/60/908869960.db2.gz QIRAGTZGSJYMRD-UHFFFAOYSA-N 0 3 405.477 4.178 20 0 HIADHN CSC[C@H](CCO)NCc1c(C)nn(-c2ccccc2)c1Oc1cccc(F)c1 ZINC000499707827 908883618 /nfs/dbraw/zinc/88/36/18/908883618.db2.gz SZRWPXDAKSEGLN-SFHVURJKSA-N 0 3 415.534 4.316 20 0 HIADHN Cc1cc(=O)n2nc(CN(C)[C@@H](c3ccc(Cl)cc3)C3CCCC3)sc2n1 ZINC000499902092 909024420 /nfs/dbraw/zinc/02/44/20/909024420.db2.gz DNCADIAPOJYELD-LJQANCHMSA-N 0 3 402.951 4.476 20 0 HIADHN C[C@@H]1CCC[C@@H](OCCCCCC(=O)N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)C1 ZINC000499930473 909038628 /nfs/dbraw/zinc/03/86/28/909038628.db2.gz MQLUMMSJZATFCH-PIATZUFCSA-N 0 3 422.654 4.490 20 0 HIADHN COc1cccc(OC(F)(F)F)c1CNC1CCN(C(=O)CC(C)(C)C)CC1 ZINC000512996397 921463590 /nfs/dbraw/zinc/46/35/90/921463590.db2.gz LSVRHWBQRLOMSW-UHFFFAOYSA-N 0 3 402.457 4.111 20 0 HIADHN CCN(C(=O)c1cccc(NC(=O)NC2CC2)c1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000499998939 909451368 /nfs/dbraw/zinc/45/13/68/909451368.db2.gz HRNNKILQBOGLGG-WZONZLPQSA-N 0 3 420.557 4.268 20 0 HIADHN CN(C(=O)CCSc1ccccc1Cl)C1CCN(CCc2ccccn2)CC1 ZINC000500036796 909495315 /nfs/dbraw/zinc/49/53/15/909495315.db2.gz ITWRFJBBPJKFDL-UHFFFAOYSA-N 0 3 418.006 4.383 20 0 HIADHN COc1cc(Br)cc(NC(=O)N(CCN(C)C)Cc2cccc(F)c2)c1 ZINC000500040979 909500181 /nfs/dbraw/zinc/50/01/81/909500181.db2.gz SCOLNELRCFUSRH-UHFFFAOYSA-N 0 3 424.314 4.193 20 0 HIADHN C[C@@H]1C[C@@H]1c1ccc([C@H]2C[C@H]2C(=O)NCCCCN2CCN(c3ccccc3)CC2)o1 ZINC000500068480 909538272 /nfs/dbraw/zinc/53/82/72/909538272.db2.gz WQWMUSSHZHCFHB-YPIGPJMWSA-N 0 3 421.585 4.225 20 0 HIADHN CN(C)CCN(C(=O)c1nc(C2CC2)n(-c2ccccc2Cl)n1)c1ccccc1 ZINC000500091296 909570916 /nfs/dbraw/zinc/57/09/16/909570916.db2.gz SLVRQAAMMRNQQN-UHFFFAOYSA-N 0 3 409.921 4.007 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)[C@@H]3C[C@@H]3c3ccc([C@@H]4C[C@@H]4C)o3)cc2)CC1 ZINC000500203639 909694108 /nfs/dbraw/zinc/69/41/08/909694108.db2.gz JBQDFDRTQWNMDX-KVJIRVJXSA-N 0 3 407.558 4.283 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)CN2CCC[C@@H](Cc3ccccc3)C2)c(OC)c1 ZINC000500220557 909713437 /nfs/dbraw/zinc/71/34/37/909713437.db2.gz SDRLQQXFNJWBRK-URXFXBBRSA-N 0 3 422.569 4.322 20 0 HIADHN CCN(C(=O)C(=O)Nc1cccc(F)c1Cl)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000500225585 909717287 /nfs/dbraw/zinc/71/72/87/909717287.db2.gz CNQCNADWMNHWNC-NVXWUHKLSA-N 0 3 417.912 4.102 20 0 HIADHN COc1c(Br)cc(Br)cc1CNCCc1nc(C)oc1C ZINC000500241528 909730638 /nfs/dbraw/zinc/73/06/38/909730638.db2.gz IYTNYFRBWKTKRC-UHFFFAOYSA-N 0 3 418.129 4.157 20 0 HIADHN Cc1nc(-c2ccccn2)sc1C(=O)NC[C@@H]1CCCN(Cc2cccs2)C1 ZINC000500279425 909757960 /nfs/dbraw/zinc/75/79/60/909757960.db2.gz JQVFSTLQBQSEBY-INIZCTEOSA-N 0 3 412.584 4.217 20 0 HIADHN Cc1nc(-c2ccccn2)sc1C(=O)NC[C@H]1CCCN(Cc2cccs2)C1 ZINC000500279426 909758222 /nfs/dbraw/zinc/75/82/22/909758222.db2.gz JQVFSTLQBQSEBY-MRXNPFEDSA-N 0 3 412.584 4.217 20 0 HIADHN CCc1cc(OC)ccc1CNCc1ccc(Br)cc1N1CCOCC1 ZINC000500368147 909817474 /nfs/dbraw/zinc/81/74/74/909817474.db2.gz LGSZIXWENUNDBF-UHFFFAOYSA-N 0 3 419.363 4.147 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)c2cc(C)ccc2Br)cc1 ZINC000500405576 909837890 /nfs/dbraw/zinc/83/78/90/909837890.db2.gz CNHKSCLYPQKDSN-HXUWFJFHSA-N 0 3 417.347 4.333 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)CCCc2ccc(F)c(F)c2)cc1 ZINC000500410075 909842603 /nfs/dbraw/zinc/84/26/03/909842603.db2.gz OJVUDCYNVKCBAZ-QFIPXVFZSA-N 0 3 402.485 4.249 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)c2cccc(Oc3ccncc3)c2)cc1 ZINC000500412403 909843651 /nfs/dbraw/zinc/84/36/51/909843651.db2.gz YSMQJWDXQLWFDN-XMMPIXPASA-N 0 3 417.509 4.449 20 0 HIADHN CC[C@H](NCc1cccc2cccnc21)c1ccccc1OCC(=O)N1CCCC1 ZINC000513075715 921528646 /nfs/dbraw/zinc/52/86/46/921528646.db2.gz OHIPPHGVNSXKAO-QFIPXVFZSA-N 0 3 403.526 4.477 20 0 HIADHN COc1ccc(CNCCOc2cccc(Br)c2)c(Cl)c1OC ZINC000500460029 909871715 /nfs/dbraw/zinc/87/17/15/909871715.db2.gz GERZKRKXEQQJDH-UHFFFAOYSA-N 0 3 400.700 4.288 20 0 HIADHN CCN1CCN(Cc2ccc(CNC(=O)NCc3csc4ccccc34)cc2)CC1 ZINC000500653797 909995129 /nfs/dbraw/zinc/99/51/29/909995129.db2.gz PGXZHWWIPSGWPI-UHFFFAOYSA-N 0 3 422.598 4.038 20 0 HIADHN CCc1nnc(NC(=O)[C@H](C)[C@H](C)NCc2cc(Cl)cc(Cl)c2OC)s1 ZINC000513089855 921540245 /nfs/dbraw/zinc/54/02/45/921540245.db2.gz PTEOMOFPVDBZER-ZJUUUORDSA-N 0 3 417.362 4.169 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)CCc2cc(Br)cs2)c1 ZINC000500686173 910021770 /nfs/dbraw/zinc/02/17/70/910021770.db2.gz KJJYYTXMZYRATB-UHFFFAOYSA-N 0 3 409.393 4.342 20 0 HIADHN C[C@@H](Oc1ccc(-c2ccccc2)cc1)C(=O)N(CCN(C)C)Cc1ccccn1 ZINC000500747658 910058172 /nfs/dbraw/zinc/05/81/72/910058172.db2.gz MJNKFYJTKUZYGX-HXUWFJFHSA-N 0 3 403.526 4.106 20 0 HIADHN COc1cc([C@H](C)NCc2ccc(-n3cncn3)cc2)ccc1OCc1ccncc1 ZINC000513104706 921552826 /nfs/dbraw/zinc/55/28/26/921552826.db2.gz MBKJSHBNZBCVGM-SFHVURJKSA-N 0 3 415.497 4.101 20 0 HIADHN Fc1ccc(-c2noc([C@@H]3CCCN(Cc4cnn(CC(F)(F)F)c4)C3)n2)cc1 ZINC000513106624 921554441 /nfs/dbraw/zinc/55/44/41/921554441.db2.gz OVVVCNROLTXDHQ-OAHLLOKOSA-N 0 3 409.387 4.014 20 0 HIADHN CN(C)Cc1cccc(NC(=O)NC[C@@H](c2c(F)cccc2Cl)N2CCCC2)c1 ZINC000501033723 910249299 /nfs/dbraw/zinc/24/92/99/910249299.db2.gz VDQVEDNVJDGDGT-FQEVSTJZSA-N 0 3 418.944 4.499 20 0 HIADHN O=C(NCc1ccnc(N2CCCCCC2)c1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000501058579 910269596 /nfs/dbraw/zinc/26/95/96/910269596.db2.gz IUFHTIUUAWEIOQ-JOCHJYFZSA-N 0 3 424.564 4.130 20 0 HIADHN C[C@H](NC(=O)N[C@H](c1cccc(F)c1)c1ccccn1)[C@H](c1ccccc1)N(C)C ZINC000501093651 910292088 /nfs/dbraw/zinc/29/20/88/910292088.db2.gz ZBHBURAWOYJCLD-JJEOQYAHSA-N 0 3 406.505 4.301 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCCCn1c(C)nc2ccccc21)c1ccsc1 ZINC000501134522 910315510 /nfs/dbraw/zinc/31/55/10/910315510.db2.gz ZXDJYLDXWLCBBM-NRFANRHFSA-N 0 3 413.591 4.179 20 0 HIADHN CCCN(C(=O)c1cnn(C2CCOCC2)c1C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000501135874 910317797 /nfs/dbraw/zinc/31/77/97/910317797.db2.gz QXELKIMGWHEHIE-HSZRJFAPSA-N 0 3 424.589 4.060 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)Nc2cccc(NC(=O)c3ccoc3)c2)C1 ZINC000501148261 910322726 /nfs/dbraw/zinc/32/27/26/910322726.db2.gz LSCJMZFSUCFLTK-HTAPYJJXSA-N 0 3 418.497 4.489 20 0 HIADHN Cc1ccc(NC(=O)CS[C@@H](C)C(=O)N(CCN(C)C)CC2CCCCC2)cc1 ZINC000501249640 910408330 /nfs/dbraw/zinc/40/83/30/910408330.db2.gz UDVVUFCSDUDBJN-IBGZPJMESA-N 0 3 419.635 4.026 20 0 HIADHN COc1ccc([C@@H](CNC(=O)Nc2ccc(-c3ncco3)cc2)N2CCCC2)cc1 ZINC000501397667 910526733 /nfs/dbraw/zinc/52/67/33/910526733.db2.gz SWGKBLKWGYNSRJ-OAQYLSRUSA-N 0 3 406.486 4.309 20 0 HIADHN CC[C@H](CNC(=O)NCc1csc(Br)c1)N1CCc2ccccc2C1 ZINC000501402352 910534388 /nfs/dbraw/zinc/53/43/88/910534388.db2.gz ALALZFQVUCCRRU-QGZVFWFLSA-N 0 3 422.392 4.147 20 0 HIADHN C[C@H](Oc1ccc(Cl)cc1Cl)C(=O)N(Cc1ccco1)C1CCN(C)CC1 ZINC000501446807 910575186 /nfs/dbraw/zinc/57/51/86/910575186.db2.gz HDXRRQBBTNZUDQ-AWEZNQCLSA-N 0 3 411.329 4.477 20 0 HIADHN CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)NC[C@H]1CCCC[C@H]1C(F)(F)F ZINC000513156414 921589852 /nfs/dbraw/zinc/58/98/52/921589852.db2.gz VBMGYGVYAWTDJD-LULLPPNCSA-N 0 3 412.500 4.085 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1cccc([C@H]2CCCOC2)c1 ZINC000501495517 910608158 /nfs/dbraw/zinc/60/81/58/910608158.db2.gz ICTWAFZORVOBNU-QHCPKHFHSA-N 0 3 408.542 4.037 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N[C@@H]1CCO[C@H]1c1ccc(Cl)cc1)c1ccco1 ZINC000501562398 910669551 /nfs/dbraw/zinc/66/95/51/910669551.db2.gz ASTSNZAUIXIDQO-IVGZAAIESA-N 0 3 405.926 4.192 20 0 HIADHN C[C@H](NCC1(c2cccc(Cl)c2)CCCC1)C(=O)N1CC(=O)Nc2ccccc21 ZINC000513168902 921597805 /nfs/dbraw/zinc/59/78/05/921597805.db2.gz XULFIDKEXRWGDS-INIZCTEOSA-N 0 3 411.933 4.115 20 0 HIADHN Cc1ccc(NC(=O)CN[C@@]2(Cc3ccc(C(F)(F)F)cc3)CCOC2)c(F)c1 ZINC000513173456 921600599 /nfs/dbraw/zinc/60/05/99/921600599.db2.gz KEIHMGFCUPOHPW-HXUWFJFHSA-N 0 3 410.411 4.083 20 0 HIADHN CCc1ccc([C@H](CNC(=O)NCc2ccc(-c3csc(C)n3)o2)N(C)C)cc1 ZINC000501709875 910776926 /nfs/dbraw/zinc/77/69/26/910776926.db2.gz NHPNOGPGYKGHNG-FQEVSTJZSA-N 0 3 412.559 4.376 20 0 HIADHN Fc1cc(CN[C@]2(Cc3ccc(C(F)(F)F)cc3)CCOC2)c2c(c1)COCO2 ZINC000513179229 921604631 /nfs/dbraw/zinc/60/46/31/921604631.db2.gz VXNHEZAIBGDYQD-FQEVSTJZSA-N 0 3 411.395 4.202 20 0 HIADHN CC(=O)Nc1c[nH]nc1[C@@H]1CCCN(Cc2cccc(OCc3ccc(F)cc3)c2)C1 ZINC000501726572 910790682 /nfs/dbraw/zinc/79/06/82/910790682.db2.gz VUDWRAPTFCOXCC-HXUWFJFHSA-N 0 3 422.504 4.466 20 0 HIADHN CCCn1nc(C)c(CN2CCC[C@@H](c3n[nH]cc3NC(=O)c3ccccc3)C2)c1C ZINC000501767942 910823619 /nfs/dbraw/zinc/82/36/19/910823619.db2.gz SXNVVWBFIZEFTM-HXUWFJFHSA-N 0 3 420.561 4.265 20 0 HIADHN CC(C)(C)c1n[nH]cc1CN1CCC[C@@H](c2n[nH]cc2NC(=O)c2ccccc2)C1 ZINC000501770599 910825486 /nfs/dbraw/zinc/82/54/86/910825486.db2.gz NWZRDTKINPCACB-QGZVFWFLSA-N 0 3 406.534 4.062 20 0 HIADHN O=C(N[C@H](c1ccccc1)c1ccccn1)N[C@H](CN1CCCC1)c1ccccc1 ZINC000501807800 910857956 /nfs/dbraw/zinc/85/79/56/910857956.db2.gz VMGGZBCUCCEHNJ-DNQXCXABSA-N 0 3 400.526 4.307 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)N1CCc2[nH]c3ccc(F)cc3c2C1 ZINC000501809862 910861463 /nfs/dbraw/zinc/86/14/63/910861463.db2.gz MGFMAEBSTBZTGA-HSZRJFAPSA-N 0 3 406.505 4.212 20 0 HIADHN CCN(CC)C(=O)Cc1ccc(NC(=O)N[C@@H](CN2CCCC2)c2ccccc2)cc1 ZINC000501852744 910885869 /nfs/dbraw/zinc/88/58/69/910885869.db2.gz XGEYSPFBWBZYHM-QHCPKHFHSA-N 0 3 422.573 4.056 20 0 HIADHN CC[C@H](CC(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1)c1ccc(OC)cc1 ZINC000501872154 910897671 /nfs/dbraw/zinc/89/76/71/910897671.db2.gz ISMACWGWXIVLHF-KCZVDYSFSA-N 0 3 416.606 4.317 20 0 HIADHN CCN(C(=O)c1cc2c(c(Cl)c1)OCO2)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000501953069 910940011 /nfs/dbraw/zinc/94/00/11/910940011.db2.gz BNRQIBMRQJHYGF-MAUKXSAKSA-N 0 3 400.906 4.366 20 0 HIADHN CCN(C(=O)c1ccc(CN2CCCC2=O)cc1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000501959141 910945244 /nfs/dbraw/zinc/94/52/44/910945244.db2.gz FYCKEUULHOOMQV-HYBUGGRVSA-N 0 3 419.569 4.107 20 0 HIADHN C[C@@H](Cc1cncc2ccccc21)C(=O)NC1CCN([C@@H](C)c2ccncc2)CC1 ZINC000502008527 910975385 /nfs/dbraw/zinc/97/53/85/910975385.db2.gz IMVBJKAOVFVBCP-OALUTQOASA-N 0 3 402.542 4.150 20 0 HIADHN C[C@H](NC[C@@H]1CN(C(=O)c2ccccc2)[C@H]2CCN1C2)c1ccc(Cl)cc1Cl ZINC000502035705 910991614 /nfs/dbraw/zinc/99/16/14/910991614.db2.gz LKPNBXFFMIBTFS-ZYSHUDEJSA-N 0 3 418.368 4.243 20 0 HIADHN C[C@H](NC[C@H]1CN(C(=O)c2ccccc2)[C@H]2CCN1C2)c1cc(Cl)ccc1Cl ZINC000502038250 910991846 /nfs/dbraw/zinc/99/18/46/910991846.db2.gz VKLMXLRFKMHTSX-SNRMKQJTSA-N 0 3 418.368 4.243 20 0 HIADHN O=C(COc1ccsc1)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1 ZINC000502050767 911003058 /nfs/dbraw/zinc/00/30/58/911003058.db2.gz PHYXPBFAQABMMK-UHFFFAOYSA-N 0 3 421.566 4.130 20 0 HIADHN Cc1ccc(NC(=O)[C@@H](NC2CCN(c3nccs3)CC2)c2ccccc2)cc1 ZINC000502058642 911007803 /nfs/dbraw/zinc/00/78/03/911007803.db2.gz QPPQJYIWRMFBEJ-NRFANRHFSA-N 0 3 406.555 4.390 20 0 HIADHN O=C(Cc1coc(-c2ccc(Cl)cc2)n1)NC[C@H]1CCCN1Cc1ccccc1 ZINC000513220262 921635042 /nfs/dbraw/zinc/63/50/42/921635042.db2.gz XCTHJKDBWHKKHR-OAQYLSRUSA-N 0 3 409.917 4.318 20 0 HIADHN CSc1ccc(NC(=O)CNC(C)(C)COc2ccc(C(F)(F)F)cn2)cc1 ZINC000502236927 911189333 /nfs/dbraw/zinc/18/93/33/911189333.db2.gz AGCNRIKXXJSKAK-UHFFFAOYSA-N 0 3 413.465 4.208 20 0 HIADHN COc1cc(C)c([C@H](C)NC(=O)NC[C@@H](c2ccccc2)N2CCCC2)cc1OC ZINC000502308720 911277156 /nfs/dbraw/zinc/27/71/56/911277156.db2.gz ITYYXUNXYVQTCL-RXVVDRJESA-N 0 3 411.546 4.210 20 0 HIADHN CC(=O)Nc1c[nH]nc1[C@H]1CCCN(CCOc2ccc(Oc3ccccc3)cc2)C1 ZINC000502313018 911282157 /nfs/dbraw/zinc/28/21/57/911282157.db2.gz ASBKSWWIRGQMSX-IBGZPJMESA-N 0 3 420.513 4.419 20 0 HIADHN CN1CCN(CCCNC(=O)N2CCC[C@@H]2c2ccc(F)cc2)[C@H](c2ccccc2)C1 ZINC000502353130 911334491 /nfs/dbraw/zinc/33/44/91/911334491.db2.gz JRUNURYKAMXTTK-RPWUZVMVSA-N 0 3 424.564 4.051 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)c1cnn(-c2ccc(Cl)cc2)c1 ZINC000502383961 911370691 /nfs/dbraw/zinc/37/06/91/911370691.db2.gz XXTLXRCIGRNSLE-UHFFFAOYSA-N 0 3 410.949 4.162 20 0 HIADHN O=C(CN[C@@H]1CCCC[C@H]1OC(F)F)N1N=C(c2ccco2)C[C@H]1c1cccs1 ZINC000502483081 911479225 /nfs/dbraw/zinc/47/92/25/911479225.db2.gz TWEXTRIPIIGAES-UKPHBRMFSA-N 0 3 423.485 4.159 20 0 HIADHN COc1ccc(NC(C)=O)cc1NC(=O)[C@@H](C)N[C@H](c1ccc(F)cc1)C(C)C ZINC000502489177 911489451 /nfs/dbraw/zinc/48/94/51/911489451.db2.gz ZLJQITCCHYYZLL-SZNDQCEHSA-N 0 3 401.482 4.107 20 0 HIADHN COc1ccc(NC(=O)C[C@@H](C)N[C@@H](C)c2ccccc2OC(F)F)c(OC)c1 ZINC000502501283 911505793 /nfs/dbraw/zinc/50/57/93/911505793.db2.gz LOLQITDYYDQWNU-KGLIPLIRSA-N 0 3 408.445 4.373 20 0 HIADHN CC(C)(C)CC(C)(C)c1ccc(OC[C@@H](O)CN2CCN(C3CCC3)CC2)cc1 ZINC000502572338 911578197 /nfs/dbraw/zinc/57/81/97/911578197.db2.gz TXSUFFOWLPABBD-QFIPXVFZSA-N 0 3 402.623 4.310 20 0 HIADHN O=c1[n-]c(C[NH2+][C@]2(Cc3ccc(Cl)cc3)CCOC2)nc2c3ccccc3oc21 ZINC000502601887 911607833 /nfs/dbraw/zinc/60/78/33/911607833.db2.gz RIRYGVSXOIYBHH-QFIPXVFZSA-N 0 3 409.873 4.226 20 0 HIADHN CCN1CC[C@H]2OCCN(C(=O)c3cc(Cl)ccc3SC3CCCC3)[C@H]2C1 ZINC000502622701 911650549 /nfs/dbraw/zinc/65/05/49/911650549.db2.gz NYUVTILKHZBFJT-RBUKOAKNSA-N 0 3 408.995 4.310 20 0 HIADHN CCc1nc(C(C)C)ccc1C(=O)N(C)C[C@@H]1CCCN(CC)[C@H]1c1cnn(C)c1 ZINC000502731759 911757697 /nfs/dbraw/zinc/75/76/97/911757697.db2.gz UWOAXLYAXMGEAV-FDDCHVKYSA-N 0 3 411.594 4.046 20 0 HIADHN CN(C)CCN(C(=O)c1ccc(-c2ccc3c(c2)OCCO3)s1)C1CCCC1 ZINC000502807586 911825020 /nfs/dbraw/zinc/82/50/20/911825020.db2.gz WFXDMQQFNVFBGZ-UHFFFAOYSA-N 0 3 400.544 4.133 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)NC3CCC([NH+]4CCC(C)CC4)CC3)cc2)cc(=O)[n-]1 ZINC000502808409 911826700 /nfs/dbraw/zinc/82/67/00/911826700.db2.gz PBSBPEJTNUOTFK-UHFFFAOYSA-N 0 3 423.561 4.322 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CCC[C@H](COC)C1)c1ccc(C(F)(F)F)cc1 ZINC000502844455 911854338 /nfs/dbraw/zinc/85/43/38/911854338.db2.gz ACQAOZGDIXCQJH-LPHOPBHVSA-N 0 3 415.500 4.156 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)COc3ccc(F)cc3Cl)c2)CC1 ZINC000502859864 911868051 /nfs/dbraw/zinc/86/80/51/911868051.db2.gz WRALYDQBNQPIKI-UHFFFAOYSA-N 0 3 405.901 4.027 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)CCc3ncc(-c4ccccc4)o3)c2)CC1 ZINC000502882339 911882740 /nfs/dbraw/zinc/88/27/40/911882740.db2.gz XDYJSLDWULUFSS-UHFFFAOYSA-N 0 3 418.541 4.443 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)NCC(C)(C)c1ccc(F)cc1 ZINC000502980669 911959408 /nfs/dbraw/zinc/95/94/08/911959408.db2.gz NKIKUHARKDCPGR-UHFFFAOYSA-N 0 3 407.480 4.155 20 0 HIADHN Cc1nccn1CCCN(C)[C@H](C)C(=O)Nc1ccc(OCc2ccccc2)cc1 ZINC000503060865 912025274 /nfs/dbraw/zinc/02/52/74/912025274.db2.gz CCKPGVHQNXSJHJ-LJQANCHMSA-N 0 3 406.530 4.120 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)NCc3csc(-c4ccccc4)n3)cc2)CC1 ZINC000503160913 912130271 /nfs/dbraw/zinc/13/02/71/912130271.db2.gz QHCFWHBKXGZVPK-UHFFFAOYSA-N 0 3 420.582 4.271 20 0 HIADHN O[C@H](CO[C@H]1CCCc2ccccc21)CN1CCC[C@@H]1c1n[nH]c(-c2ccccc2)n1 ZINC000503161383 912130617 /nfs/dbraw/zinc/13/06/17/912130617.db2.gz UHYLLQPBJDSLGN-WWNPGLIZSA-N 0 3 418.541 4.064 20 0 HIADHN O[C@H](CO[C@H]1CCCc2ccccc21)C[N@@H+]1CCC[C@@H]1c1nnc(-c2ccccc2)[n-]1 ZINC000503161383 912130636 /nfs/dbraw/zinc/13/06/36/912130636.db2.gz UHYLLQPBJDSLGN-WWNPGLIZSA-N 0 3 418.541 4.064 20 0 HIADHN O[C@H](CO[C@H]1CCCc2ccccc21)C[N@H+]1CCC[C@@H]1c1nnc(-c2ccccc2)[n-]1 ZINC000503161383 912130647 /nfs/dbraw/zinc/13/06/47/912130647.db2.gz UHYLLQPBJDSLGN-WWNPGLIZSA-N 0 3 418.541 4.064 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)Nc3cccc4cccnc43)CC2)c1 ZINC000503204550 912184254 /nfs/dbraw/zinc/18/42/54/912184254.db2.gz KRELCOFXHZDQRY-UHFFFAOYSA-N 0 3 417.557 4.267 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)Nc2cccc(C(=O)NC(C)(C)C)c2)C1 ZINC000506293656 914889132 /nfs/dbraw/zinc/88/91/32/914889132.db2.gz DSEDQVKRORPUID-DYESRHJHSA-N 0 3 408.546 4.172 20 0 HIADHN Cc1cccc(C(=O)N2CCCC2)c1NC(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000506294895 914890013 /nfs/dbraw/zinc/89/00/13/914890013.db2.gz LZMAJYHXFPOLCD-TZIWHRDSSA-N 0 3 420.557 4.188 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)Nc2ccccc2N2C[C@@H](C)O[C@H](C)C2)C1 ZINC000506295441 914890368 /nfs/dbraw/zinc/89/03/68/914890368.db2.gz QQNNTPJZPIGZTI-NXLVEIQXSA-N 0 3 422.573 4.257 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)Nc2ccc(C(=O)NC3CCCC3)cc2)C1 ZINC000506295753 914890893 /nfs/dbraw/zinc/89/08/93/914890893.db2.gz TYZGIIAMYCLYHW-MBSDFSHPSA-N 0 3 420.557 4.316 20 0 HIADHN CCN(Cc1cccc(NC(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)c1)C(C)=O ZINC000506308725 914898267 /nfs/dbraw/zinc/89/82/67/914898267.db2.gz LKHJTXMHHURHRH-JPYJTQIMSA-N 0 3 408.546 4.012 20 0 HIADHN Cc1cc(NC(=O)C2CCN(C[C@H](C)c3cccc(Br)c3)CC2)no1 ZINC000506309198 914898824 /nfs/dbraw/zinc/89/88/24/914898824.db2.gz JYLLVKSWQFEYET-ZDUSSCGKSA-N 0 3 406.324 4.200 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)Nc2ccc(OC[C@@H]3CCCO3)cc2)C1 ZINC000506312246 914900963 /nfs/dbraw/zinc/90/09/63/914900963.db2.gz JEJWVQONZLZTAO-AAIMPIBUSA-N 0 3 409.530 4.201 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)Nc2ccc(OC[C@H]3CCCO3)cc2)C1 ZINC000506312247 914904585 /nfs/dbraw/zinc/90/45/85/914904585.db2.gz JEJWVQONZLZTAO-RZFNWQHOSA-N 0 3 409.530 4.201 20 0 HIADHN Cc1cc(NC(=O)C2CCN(Cc3ccc(Oc4cccnc4)c(C)c3)CC2)no1 ZINC000506327533 914933132 /nfs/dbraw/zinc/93/31/32/914933132.db2.gz UWMSSGRBNMOYPY-UHFFFAOYSA-N 0 3 406.486 4.329 20 0 HIADHN Cc1cc(NC(=O)c2ccc3c(c2)NC(=O)C3(C)C)cc(N2CCN(C(C)C)CC2)c1 ZINC000506342285 914958913 /nfs/dbraw/zinc/95/89/13/914958913.db2.gz SMDPZKMJJORELE-UHFFFAOYSA-N 0 3 420.557 4.007 20 0 HIADHN COc1ccc(OC)c(-c2nn(-c3ccccc3)cc2CN2CCN(C(C)C)CC2)c1 ZINC000506353970 914974262 /nfs/dbraw/zinc/97/42/62/914974262.db2.gz BDQFXPGYWPSJSS-UHFFFAOYSA-N 0 3 420.557 4.083 20 0 HIADHN C[C@@H]1C[C@H](C)CN(C(=O)c2ccccc2NC(=O)NCCN(C)Cc2ccccc2)C1 ZINC000506367726 914992375 /nfs/dbraw/zinc/99/23/75/914992375.db2.gz FSKOCBTVOSHMDA-BGYRXZFFSA-N 0 3 422.573 4.058 20 0 HIADHN COc1ccccc1OCCN1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1 ZINC000506451109 915050492 /nfs/dbraw/zinc/05/04/92/915050492.db2.gz ASMUIUXXUKVDHL-UHFFFAOYSA-N 0 3 406.885 4.217 20 0 HIADHN O=C(N[C@@H](C(=O)Nc1ccccc1)c1ccccc1)c1cccc(CN2CCCC2)c1 ZINC000513368401 921742330 /nfs/dbraw/zinc/74/23/30/921742330.db2.gz VUDXHOAZYWXDLY-XMMPIXPASA-N 0 3 413.521 4.392 20 0 HIADHN CC[C@@H](C)[C@H](C)C(=O)NC1CCN(CCOc2ccc(Br)cc2)CC1 ZINC000506470641 915068921 /nfs/dbraw/zinc/06/89/21/915068921.db2.gz MTVHTUJIFCCROX-CVEARBPZSA-N 0 3 411.384 4.091 20 0 HIADHN CCC(=O)Nc1ccc(C)c(NC(=O)[C@H]2CN(Cc3ccccc3)CCC2(F)F)c1 ZINC000506477000 915080284 /nfs/dbraw/zinc/08/02/84/915080284.db2.gz LRSDLUUYZWZGAJ-LJQANCHMSA-N 0 3 415.484 4.439 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)Nc1ccnc(Sc2ccccn2)c1 ZINC000506535220 915179762 /nfs/dbraw/zinc/17/97/62/915179762.db2.gz RWFAAHZDXSFZQA-UHFFFAOYSA-N 0 3 407.543 4.224 20 0 HIADHN CCN1CCN([C@@H]2CCN([C@H](C)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)C2)CC1 ZINC000506568223 915216376 /nfs/dbraw/zinc/21/63/76/915216376.db2.gz WRFZLMNEXLSYCP-RDTXWAMCSA-N 0 3 423.445 4.497 20 0 HIADHN CN(C)[C@H](CNC(=O)Nc1ccc(C(=O)Nc2ccccc2)cc1)Cc1ccccc1 ZINC000506640709 915311534 /nfs/dbraw/zinc/31/15/34/915311534.db2.gz BAYMQXDGVRQWDJ-QHCPKHFHSA-N 0 3 416.525 4.233 20 0 HIADHN COC(=O)C(C)(C)CCN[C@H](C)C(=O)Nc1ccccc1Sc1ccccc1 ZINC000506659797 915335704 /nfs/dbraw/zinc/33/57/04/915335704.db2.gz GEGYDLPYIVLHTI-MRXNPFEDSA-N 0 3 400.544 4.344 20 0 HIADHN C[C@@H](Cn1ccc2ccccc21)C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000513392613 921764248 /nfs/dbraw/zinc/76/42/48/921764248.db2.gz UQTRUEMLZBECSH-IBGZPJMESA-N 0 3 423.532 4.076 20 0 HIADHN COc1cccc([C@H]2CCCN2Cc2ccc(OCC(=O)N3CCCC3)c(OC)c2)c1 ZINC000506690668 915369861 /nfs/dbraw/zinc/36/98/61/915369861.db2.gz RRCMVEJECZUETP-JOCHJYFZSA-N 0 3 424.541 4.042 20 0 HIADHN Cc1nn(-c2ccc(F)cc2F)c(C)c1CN1CCC(c2nnc3ccccn32)CC1 ZINC000506717203 915395128 /nfs/dbraw/zinc/39/51/28/915395128.db2.gz BFRSBZJWPOPIAU-UHFFFAOYSA-N 0 3 422.483 4.190 20 0 HIADHN C[C@@H](CNC(=O)N1CCC[C@@H](c2nc3ccc(F)cc3o2)C1)N(C)Cc1ccccc1 ZINC000506730420 915415380 /nfs/dbraw/zinc/41/53/80/915415380.db2.gz HIXFOHPNNFKNAQ-PKOBYXMFSA-N 0 3 424.520 4.376 20 0 HIADHN COc1ccc([C@@H](CNC(=O)c2c[nH]cc2-c2cccc(OC)c2)N2CCCC2)cc1 ZINC000513403030 921771119 /nfs/dbraw/zinc/77/11/19/921771119.db2.gz PQUFHGYYUDYGQE-XMMPIXPASA-N 0 3 419.525 4.266 20 0 HIADHN C[C@@H](CNC(=O)Nc1ccnc(Sc2ccccn2)c1)N(C)Cc1ccccc1 ZINC000506754735 915451354 /nfs/dbraw/zinc/45/13/54/915451354.db2.gz AUHRCOCKUKISKX-KRWDZBQOSA-N 0 3 407.543 4.270 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)NCCCO[C@@H]2CCCc3ccccc32)o1 ZINC000506795631 915528747 /nfs/dbraw/zinc/52/87/47/915528747.db2.gz LNVLEASPJQWHQJ-HSZRJFAPSA-N 0 3 413.562 4.146 20 0 HIADHN CC(C)n1nc(-c2ccccc2)cc1NC(=O)NC[C@H](Cc1ccccc1)N(C)C ZINC000506901858 915701684 /nfs/dbraw/zinc/70/16/84/915701684.db2.gz ZEAYDRUBJQIKPO-NRFANRHFSA-N 0 3 405.546 4.425 20 0 HIADHN O=C(CN1CCC[C@H]1c1cccs1)Nc1cccc(CN2CCSCC2)c1 ZINC000506916846 915716860 /nfs/dbraw/zinc/71/68/60/915716860.db2.gz KZXGSGKFOBWPGJ-IBGZPJMESA-N 0 3 401.601 4.073 20 0 HIADHN CCc1cccc2c1OCC[C@@H]2NC(=O)c1ccc(N2CCN(C(C)C)CC2)cc1 ZINC000506981363 915789769 /nfs/dbraw/zinc/78/97/69/915789769.db2.gz IQVZXWICYIDZPT-QHCPKHFHSA-N 0 3 407.558 4.033 20 0 HIADHN CCCCNC(=O)C1CCN(Cc2ccc(OCc3csc(C)n3)cc2)CC1 ZINC000507012674 915820946 /nfs/dbraw/zinc/82/09/46/915820946.db2.gz LXOZJGPNCHTWNU-UHFFFAOYSA-N 0 3 401.576 4.159 20 0 HIADHN Cc1cc(-c2cc(C(=O)NCCN3CCCCC3)c3cnn(C(C)C)c3n2)c(C)o1 ZINC000507047088 915839308 /nfs/dbraw/zinc/83/93/08/915839308.db2.gz CFLLTGGJJUYJKP-UHFFFAOYSA-N 0 3 409.534 4.105 20 0 HIADHN Cc1nc(-c2c[nH]c(C(=O)N3CCCN(CCCc4ccccc4)CC3)c2)cs1 ZINC000507097727 915868412 /nfs/dbraw/zinc/86/84/12/915868412.db2.gz RAGNPHCDYGMQBV-UHFFFAOYSA-N 0 3 408.571 4.227 20 0 HIADHN COc1ccc2nc(C(=O)N3CCCN(CCCc4ccccc4)CC3)ccc2c1 ZINC000507158292 915896702 /nfs/dbraw/zinc/89/67/02/915896702.db2.gz RDMZVEVPBCAKFY-UHFFFAOYSA-N 0 3 403.526 4.024 20 0 HIADHN COc1ccc(C2(C(=O)N3CCCN(CCCc4ccccc4)CC3)CCC2)cc1 ZINC000507160481 915898385 /nfs/dbraw/zinc/89/83/85/915898385.db2.gz GDTXOTCRIABZJU-UHFFFAOYSA-N 0 3 406.570 4.284 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)N(C)Cc1ccc(Br)cc1)c1ccc2n[nH]cc2c1 ZINC000507227383 915982130 /nfs/dbraw/zinc/98/21/30/915982130.db2.gz HVXSWJVBBOQXPL-KGLIPLIRSA-N 0 3 415.335 4.023 20 0 HIADHN CN(CCC(=O)Nc1ccc(Br)cc1)C[C@@H]1OCCc2ccccc21 ZINC000507259150 916019916 /nfs/dbraw/zinc/01/99/16/916019916.db2.gz PZNQCSJELTVEJD-IBGZPJMESA-N 0 3 403.320 4.024 20 0 HIADHN O=C1NCCCC[C@H]1N[C@@H]1CCCc2nc(-c3ccc(Br)cc3)sc21 ZINC000507410660 916181981 /nfs/dbraw/zinc/18/19/81/916181981.db2.gz YZHTXYLENLQKRW-GDBMZVCRSA-N 0 3 420.376 4.208 20 0 HIADHN COc1ccc(NC(=O)[C@H](NCCc2ccc(NC(C)=O)cc2)c2ccccc2)cc1 ZINC000507468638 916238256 /nfs/dbraw/zinc/23/82/56/916238256.db2.gz OHNNWMJDKGLUJA-XMMPIXPASA-N 0 3 417.509 4.166 20 0 HIADHN CCCN(CC(=O)Nc1cccc(CC)c1)C1CCN(C(=O)c2ccccc2)CC1 ZINC000507584447 916339148 /nfs/dbraw/zinc/33/91/48/916339148.db2.gz BKDJIDXWCBKTCK-UHFFFAOYSA-N 0 3 407.558 4.204 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3cnc(C(C)C)s3)c(OCC)c2)CC1 ZINC000507594077 916347699 /nfs/dbraw/zinc/34/76/99/916347699.db2.gz WDWPHAJPYRDYTG-UHFFFAOYSA-N 0 3 416.591 4.450 20 0 HIADHN CCCN(CC(=O)Nc1cc(C)ccc1C)C1CCN(C(=O)c2ccccc2)CC1 ZINC000507597981 916353196 /nfs/dbraw/zinc/35/31/96/916353196.db2.gz OGKJWAOKSBDNCN-UHFFFAOYSA-N 0 3 407.558 4.259 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(C)c1CC(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000507603018 916358828 /nfs/dbraw/zinc/35/88/28/916358828.db2.gz QUEWCEGWARHZHG-XMSQKQJNSA-N 0 3 420.532 4.122 20 0 HIADHN Cc1ccc([C@H](NCC[C@@H]2CCCCO2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000507610435 916367879 /nfs/dbraw/zinc/36/78/79/916367879.db2.gz JZVOWNSEAQUYFZ-NZQKXSOJSA-N 0 3 401.572 4.345 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)c2cc3cc(Br)ccc3[nH]2)C1 ZINC000507614823 916371606 /nfs/dbraw/zinc/37/16/06/916371606.db2.gz WSLQOOCLEOKAAL-RDTXWAMCSA-N 0 3 412.331 4.496 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)Cc3ccc(C(C)=O)cc3)c(OCC)c2)CC1 ZINC000507622212 916380846 /nfs/dbraw/zinc/38/08/46/916380846.db2.gz QXIFWHDJPNIYAM-UHFFFAOYSA-N 0 3 423.557 4.001 20 0 HIADHN C[C@H](C(=O)N[C@@H](C)c1ccc(F)cc1)N(C)CCCc1cc(-c2ccccc2)n[nH]1 ZINC000507669104 916435868 /nfs/dbraw/zinc/43/58/68/916435868.db2.gz NISSTLMLURIJIY-ZWKOTPCHSA-N 0 3 408.521 4.346 20 0 HIADHN C[C@@H](c1ccccc1)N(CC(=O)Nc1cccc(CN2CCSCC2)c1)C1CC1 ZINC000507698031 916478509 /nfs/dbraw/zinc/47/85/09/916478509.db2.gz MWLUQNREOKEGGT-IBGZPJMESA-N 0 3 409.599 4.400 20 0 HIADHN Cc1noc(C2CCN(C[C@H](O)CO[C@@H](c3ccccc3)c3ccc(C)cc3)CC2)n1 ZINC000507717473 916510380 /nfs/dbraw/zinc/51/03/80/916510380.db2.gz JSDLYONZCXPCCX-ZEQRLZLVSA-N 0 3 421.541 4.033 20 0 HIADHN CCN(CC)[C@H](CN[C@H](c1nccn1C)c1cccc(F)c1)c1cccc(OC)c1 ZINC000507808888 916598069 /nfs/dbraw/zinc/59/80/69/916598069.db2.gz XAHJYONSVQOTPD-PKTZIBPZSA-N 0 3 410.537 4.330 20 0 HIADHN O=C(c1cn(CCOc2ccccc2Cl)c2ccccc12)N1CCN2CCC1CC2 ZINC000507880952 916723177 /nfs/dbraw/zinc/72/31/77/916723177.db2.gz FCBZUPRNCJRAMU-UHFFFAOYSA-N 0 3 423.944 4.294 20 0 HIADHN CCCCOc1ccc(CN2CCC(C(=O)Nc3ccc(C)cn3)CC2)cc1OC ZINC000507997551 916838547 /nfs/dbraw/zinc/83/85/47/916838547.db2.gz IAKDMLIDLOWCOL-UHFFFAOYSA-N 0 3 411.546 4.428 20 0 HIADHN Cc1ccc(NC(=O)[C@@H]2CCCN(Cc3ccc(-c4ccncc4)cc3F)C2)nc1 ZINC000507998724 916839460 /nfs/dbraw/zinc/83/94/60/916839460.db2.gz MMZPZVFLOREGBV-OAQYLSRUSA-N 0 3 404.489 4.442 20 0 HIADHN Cc1ccc(NC(=O)[C@H]2CCCN(Cc3ccc(-c4ccncc4)cc3F)C2)nc1 ZINC000507998719 916839994 /nfs/dbraw/zinc/83/99/94/916839994.db2.gz MMZPZVFLOREGBV-NRFANRHFSA-N 0 3 404.489 4.442 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CN1CCC(C(=O)Nc2ccc(C)cn2)CC1 ZINC000508044210 916872338 /nfs/dbraw/zinc/87/23/38/916872338.db2.gz XKLXPFJTWZRLGX-UHFFFAOYSA-N 0 3 417.557 4.102 20 0 HIADHN COc1ccc2nc(C3CC3)cc(C(=O)N(Cc3ccco3)C3CCN(C)CC3)c2c1 ZINC000508152255 916973285 /nfs/dbraw/zinc/97/32/85/916973285.db2.gz UCVONIDWXDHCPO-UHFFFAOYSA-N 0 3 419.525 4.450 20 0 HIADHN CC[C@H](CNC(=O)N[C@H](c1nccs1)c1ccccc1)N1CCc2ccccc2C1 ZINC000508189854 917012857 /nfs/dbraw/zinc/01/28/57/917012857.db2.gz HTKYLQTZYBCEGO-YADHBBJMSA-N 0 3 420.582 4.369 20 0 HIADHN CCCc1ccc(-c2nc(NC(=O)CCN3CCN(CC)CC3)sc2C)cc1 ZINC000508203869 917023644 /nfs/dbraw/zinc/02/36/44/917023644.db2.gz JFLJNKRYVSUCGY-UHFFFAOYSA-N 0 3 400.592 4.037 20 0 HIADHN Cc1ccc(OCCCNC(=O)Nc2ccc(CCN3CCSCC3)cc2)cc1 ZINC000508251215 917069943 /nfs/dbraw/zinc/06/99/43/917069943.db2.gz NBHRBKKHJNYZDA-UHFFFAOYSA-N 0 3 413.587 4.177 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)C[C@@H](c2cccs2)n2cccc2)c1 ZINC000508465397 917250006 /nfs/dbraw/zinc/25/00/06/917250006.db2.gz BWUIDCWKMIZASO-NRFANRHFSA-N 0 3 411.571 4.128 20 0 HIADHN COc1ccc2c(c1)CN(C(=O)[C@]1(C(F)(F)F)CCN(Cc3ccccc3)C1)CC2 ZINC000508602655 917373861 /nfs/dbraw/zinc/37/38/61/917373861.db2.gz FGCUIZSALBCRHJ-QFIPXVFZSA-N 0 3 418.459 4.035 20 0 HIADHN Cn1ccnc1C[C@@H]1CCCN(Cc2cc(Cl)ccc2OC[C@H]2CCCO2)C1 ZINC000508638977 917403801 /nfs/dbraw/zinc/40/38/01/917403801.db2.gz PRHKQWSAKDMESI-FXAWDEMLSA-N 0 3 403.954 4.086 20 0 HIADHN CC[C@H](C)NC(=O)[C@@H]1C[C@H](C)N(CC(=O)Nc2cc(C)ccc2C)[C@@H]2CCCC[C@@H]12 ZINC000508651439 917417892 /nfs/dbraw/zinc/41/78/92/917417892.db2.gz AIPRYORVGIQEPS-YKZCJQPKSA-N 0 3 413.606 4.426 20 0 HIADHN CC[C@H](C)NC(=O)[C@@H]1C[C@H](C)N(CC(=O)Nc2c(C)cccc2C)[C@H]2CCCC[C@@H]12 ZINC000508673162 917438231 /nfs/dbraw/zinc/43/82/31/917438231.db2.gz XJXCPXMZZYHWJC-KGWSWXIGSA-N 0 3 413.606 4.426 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2CN2CCC(CC(N)=O)CC2)c(C)c1 ZINC000508682838 917445522 /nfs/dbraw/zinc/44/55/22/917445522.db2.gz XLLVRSMWXSKKKM-UHFFFAOYSA-N 0 3 402.542 4.244 20 0 HIADHN Cc1c([C@H](C)NCc2ccccc2Cn2cncn2)cnn1-c1cccc(Cl)c1 ZINC000508728155 917489582 /nfs/dbraw/zinc/48/95/82/917489582.db2.gz CCWQKCHTLHMDHF-INIZCTEOSA-N 0 3 406.921 4.325 20 0 HIADHN C[C@H](NCc1ccccc1Cn1cncn1)c1ccc(OC[C@@H]2CCCCO2)c(F)c1 ZINC000508731250 917491945 /nfs/dbraw/zinc/49/19/45/917491945.db2.gz VUAATYDQNJWRTB-AVRDEDQJSA-N 0 3 424.520 4.264 20 0 HIADHN Fc1cc(Br)ccc1[C@H](NCc1ccccc1Cn1cncn1)C1CC1 ZINC000508737907 917496315 /nfs/dbraw/zinc/49/63/15/917496315.db2.gz CRISYHGWMACRSH-HXUWFJFHSA-N 0 3 415.310 4.469 20 0 HIADHN CN(Cc1ccc(F)cc1F)C(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000508799196 917555718 /nfs/dbraw/zinc/55/57/18/917555718.db2.gz BLQKLLXYUOVSKS-FQEVSTJZSA-N 0 3 412.402 4.378 20 0 HIADHN CN(Cc1ccc(F)c(F)c1)C(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000508803062 917559109 /nfs/dbraw/zinc/55/91/09/917559109.db2.gz MWRHMIMQLLNNRC-HXUWFJFHSA-N 0 3 412.402 4.378 20 0 HIADHN C[C@@H](NC(=O)N1CC=C(c2c[nH]c3ncccc23)CC1)[C@H](c1ccccc1)N(C)C ZINC000508890516 917646248 /nfs/dbraw/zinc/64/62/48/917646248.db2.gz ACTDKTQNQPDJOF-VGOFRKELSA-N 0 3 403.530 4.053 20 0 HIADHN C[C@H](NC(=O)N[C@H](CO)c1c(Cl)cccc1Cl)[C@H](c1ccccc1)N(C)C ZINC000508898872 917654837 /nfs/dbraw/zinc/65/48/37/917654837.db2.gz RXBPXHBKHJGOTQ-BOFPYLFWSA-N 0 3 410.345 4.017 20 0 HIADHN C[C@H](NC(=O)Nc1ccccc1I)[C@H](c1ccccc1)N(C)C ZINC000508898207 917654967 /nfs/dbraw/zinc/65/49/67/917654967.db2.gz KZOIUAJOAFIKGM-SUMWQHHRSA-N 0 3 423.298 4.104 20 0 HIADHN C[C@H](NC(=O)NCc1ccncc1OCc1ccccc1)[C@@H](c1ccccc1)N(C)C ZINC000508900186 917655323 /nfs/dbraw/zinc/65/53/23/917655323.db2.gz XEWATAUOJYEKIC-CYFREDJKSA-N 0 3 418.541 4.151 20 0 HIADHN COc1cc(NC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)cc(OC)c1 ZINC000508914629 917671926 /nfs/dbraw/zinc/67/19/26/917671926.db2.gz DNEBJBRLFOOBTE-HXUWFJFHSA-N 0 3 408.420 4.097 20 0 HIADHN O=C(N1CCc2cc(F)c(F)cc21)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000508924167 917682663 /nfs/dbraw/zinc/68/26/63/917682663.db2.gz DDLSDALXPJNTNW-HXUWFJFHSA-N 0 3 410.386 4.309 20 0 HIADHN O=C(NCc1ccc(Cl)s1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000508941569 917698386 /nfs/dbraw/zinc/69/83/86/917698386.db2.gz IPDDENJZBYUPKM-QGZVFWFLSA-N 0 3 402.869 4.472 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3nn(-c4ccc(F)cc4)cc3C)c(C)c2)CC1 ZINC000509026128 917780192 /nfs/dbraw/zinc/78/01/92/917780192.db2.gz FWISECSWPBJSDY-UHFFFAOYSA-N 0 3 421.520 4.022 20 0 HIADHN CCCN(C)[C@H](CNC(=O)NCc1noc2c1CCCC2)c1ccc(Cl)cc1 ZINC000509040442 917793326 /nfs/dbraw/zinc/79/33/26/917793326.db2.gz RYRJNTVKWIWORO-LJQANCHMSA-N 0 3 404.942 4.089 20 0 HIADHN O=C(N[C@@H]1CCCOc2ccccc21)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000509063224 917811619 /nfs/dbraw/zinc/81/16/19/917811619.db2.gz LRNOTCFGVWYJEY-VQTJNVASSA-N 0 3 400.469 4.174 20 0 HIADHN CC1(c2cccc(Br)c2)CCN(Cc2cc(=O)n3ccccc3n2)CC1 ZINC000509079880 917824059 /nfs/dbraw/zinc/82/40/59/917824059.db2.gz PRUGVOUOWJINMX-UHFFFAOYSA-N 0 3 412.331 4.011 20 0 HIADHN COC(=O)C[C@](C)(NCC/C=C\c1ccc(Br)cc1)c1ccccn1 ZINC000509127798 917859913 /nfs/dbraw/zinc/85/99/13/917859913.db2.gz QLGPYTZUYZEWNP-CTKIROQKSA-N 0 3 403.320 4.316 20 0 HIADHN COc1ccccc1SC[C@H](C)CNC(=O)NC[C@H](c1ccccc1)N(C)C ZINC000509360373 918026193 /nfs/dbraw/zinc/02/61/93/918026193.db2.gz VZWCHUVDPSNGTI-IEBWSBKVSA-N 0 3 401.576 4.026 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)N[C@H](c1nccs1)c1ccccc1 ZINC000509365003 918029470 /nfs/dbraw/zinc/02/94/70/918029470.db2.gz ILWLKNAFZFCZJN-SFTDATJTSA-N 0 3 406.555 4.369 20 0 HIADHN COc1cc(CN2CCC[C@H](c3nc(C)no3)C2)ccc1OCc1ccc(F)cc1 ZINC000509367317 918031630 /nfs/dbraw/zinc/03/16/30/918031630.db2.gz RVJLDHHSLCPWHO-IBGZPJMESA-N 0 3 411.477 4.484 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N[C@@H](c1nccs1)c1ccccc1 ZINC000509366696 918031722 /nfs/dbraw/zinc/03/17/22/918031722.db2.gz PQASZAYHEJFPCG-IEBWSBKVSA-N 0 3 412.584 4.430 20 0 HIADHN Cc1cc(CN2CCC(C(=O)Nc3ccc(Br)cn3)CC2)ccc1F ZINC000509383423 918050683 /nfs/dbraw/zinc/05/06/83/918050683.db2.gz DKZYZVRVFKPCNJ-UHFFFAOYSA-N 0 3 406.299 4.142 20 0 HIADHN CC(C)[C@H](NCc1cnn([C@]2(C)CCS(=O)(=O)C2)c1)c1ccc(C(C)(C)C)cc1 ZINC000509404275 918069318 /nfs/dbraw/zinc/06/93/18/918069318.db2.gz PUAHBCDVGSDSDA-JTHBVZDNSA-N 0 3 417.619 4.201 20 0 HIADHN Cn1cnnc1C1CCN(Cc2cccc(NC(=O)c3ccccc3Cl)c2)CC1 ZINC000509420112 918081417 /nfs/dbraw/zinc/08/14/17/918081417.db2.gz NGODYCCARHIXJS-UHFFFAOYSA-N 0 3 409.921 4.100 20 0 HIADHN CC(C)(C)n1cc(CN[C@@H]2CC(=O)N3CCCC[C@H]23)c(-c2ccccc2Cl)n1 ZINC000509422227 918083025 /nfs/dbraw/zinc/08/30/25/918083025.db2.gz BIGHWSZPGZHHFC-RTBURBONSA-N 0 3 400.954 4.202 20 0 HIADHN FC(F)(F)c1cccc(-c2ccc(CNCCc3nnnn3-c3ccccc3)o2)c1 ZINC000509441755 918095752 /nfs/dbraw/zinc/09/57/52/918095752.db2.gz ZCOINHHOPSFUIE-UHFFFAOYSA-N 0 3 413.403 4.273 20 0 HIADHN Cn1cc(-c2ccc(CN[C@@H]3CC(=O)N(c4cccc(C(F)(F)F)c4)C3)s2)cn1 ZINC000509474497 918120895 /nfs/dbraw/zinc/12/08/95/918120895.db2.gz ZQBNKZPNYJMGMT-OAHLLOKOSA-N 0 3 420.460 4.063 20 0 HIADHN CCCCOc1cc(CN2CCC(C(=O)N3CCC[C@H](C)C3)CC2)ccc1OC ZINC000509521615 918170818 /nfs/dbraw/zinc/17/08/18/918170818.db2.gz SPNGNNJVBAIJJE-IBGZPJMESA-N 0 3 402.579 4.345 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)N(C)Cc1ccc(Br)s1)c1ccco1 ZINC000509559251 918208568 /nfs/dbraw/zinc/20/85/68/918208568.db2.gz SZLQSFSNFLKLIH-OCCSQVGLSA-N 0 3 414.369 4.374 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N1CCC(c2c[nH]c3ncccc23)CC1)c1ccco1 ZINC000509568445 918217538 /nfs/dbraw/zinc/21/75/38/918217538.db2.gz LJYKROVZRDRMBY-OXJNMPFZSA-N 0 3 409.534 4.174 20 0 HIADHN CC[C@@H](NC(=O)N(CCN(C)C)Cc1ccc(F)cc1)c1ccc(OC)c(OC)c1 ZINC000509569558 918220315 /nfs/dbraw/zinc/22/03/15/918220315.db2.gz OHXCULRYDQABKL-HXUWFJFHSA-N 0 3 417.525 4.067 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N1CCCCC[C@H]1c1c(C)n[nH]c1C)c1ccco1 ZINC000509575328 918224377 /nfs/dbraw/zinc/22/43/77/918224377.db2.gz VPJQGERYRHSEMS-SNRMKQJTSA-N 0 3 401.555 4.376 20 0 HIADHN COc1ccc(C[C@H](NCc2ccc3c(c2)oc(=O)n3C)c2ccc(OC)cc2)cc1 ZINC000509584141 918233011 /nfs/dbraw/zinc/23/30/11/918233011.db2.gz MJAWENPFMLLSHK-QFIPXVFZSA-N 0 3 418.493 4.222 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N(Cc1ccccc1)CC1CCOCC1)c1ccco1 ZINC000509595133 918243844 /nfs/dbraw/zinc/24/38/44/918243844.db2.gz GLQWMQPZMXMTOF-UGKGYDQZSA-N 0 3 413.562 4.347 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N1CCC[C@H](OCc2ccccc2F)C1)c1ccco1 ZINC000509596160 918245561 /nfs/dbraw/zinc/24/55/61/918245561.db2.gz NPJONCVZNPSMPR-HFSMHLIXSA-N 0 3 417.525 4.239 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)N1CCC(OCCc2ccccc2)CC1)c1ccco1 ZINC000509595672 918246036 /nfs/dbraw/zinc/24/60/36/918246036.db2.gz ISIBRLWACDEUOO-KNQAVFIVSA-N 0 3 413.562 4.142 20 0 HIADHN CC(C)(NCCCN1CCN(c2ccccc2)CC1)c1nc(C(F)(F)F)cs1 ZINC000509599288 918249831 /nfs/dbraw/zinc/24/98/31/918249831.db2.gz BFHPORHZMKDOOH-UHFFFAOYSA-N 0 3 412.525 4.199 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N1CC[C@](F)(c2cc(F)cc(F)c2)C1)c1ccco1 ZINC000509601661 918252011 /nfs/dbraw/zinc/25/20/11/918252011.db2.gz LLVXLRYHOYDVOE-DHUIEDIVSA-N 0 3 409.452 4.267 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N1CC=C(c2c[nH]c3ncccc23)CC1)c1ccco1 ZINC000509611101 918258771 /nfs/dbraw/zinc/25/87/71/918258771.db2.gz MWDVLRHBNZYAAJ-OXJNMPFZSA-N 0 3 407.518 4.084 20 0 HIADHN CC[C@H](NC(=O)N[C@H]1CCN(Cc2ccccc2)[C@H]1C)c1ccc(OC)c(OC)c1 ZINC000509612374 918259308 /nfs/dbraw/zinc/25/93/08/918259308.db2.gz XVNTXBWDHJWPEI-YYWHXJBOSA-N 0 3 411.546 4.117 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)N(C)Cc1ccc(OC(F)(F)F)cc1)c1ccco1 ZINC000509612406 918261628 /nfs/dbraw/zinc/26/16/28/918261628.db2.gz YGMVPHQNQSVUFN-RHSMWYFYSA-N 0 3 413.440 4.449 20 0 HIADHN CCCN(Cc1nnc(-c2ccccc2Cl)o1)C(=O)[C@H](C)N1CCCCCC1 ZINC000509690064 918321172 /nfs/dbraw/zinc/32/11/72/918321172.db2.gz BVWQJPZDVYPJTQ-INIZCTEOSA-N 0 3 404.942 4.393 20 0 HIADHN Cc1cccc(-c2n[nH]cc2CN2CCC(NC(=O)Nc3ccc(F)cc3)CC2)c1 ZINC000509706039 918334259 /nfs/dbraw/zinc/33/42/59/918334259.db2.gz ZHRZOAYAAYEQGD-UHFFFAOYSA-N 0 3 407.493 4.310 20 0 HIADHN CCC(C)(C)c1ccc(C(=O)Nc2ccccc2CN2CCC[C@@H](C(N)=O)C2)cc1 ZINC000509707385 918335819 /nfs/dbraw/zinc/33/58/19/918335819.db2.gz GXNUONDVDVUGTF-HXUWFJFHSA-N 0 3 407.558 4.324 20 0 HIADHN O=C(CN1CCC(NCc2ccc(Sc3ccccn3)o2)CC1)Nc1ccccc1 ZINC000509818962 918420784 /nfs/dbraw/zinc/42/07/84/918420784.db2.gz JNFPNLSONTZGMA-UHFFFAOYSA-N 0 3 422.554 4.019 20 0 HIADHN O=C(c1ccccc1F)N1CCC(NCc2ccc(Sc3ccccn3)o2)CC1 ZINC000509879074 918480724 /nfs/dbraw/zinc/48/07/24/918480724.db2.gz PRSPWXZFLILCNM-UHFFFAOYSA-N 0 3 411.502 4.359 20 0 HIADHN O=C(COc1ccccc1)N1CC[C@H](NCc2ccc(Cl)c(C(F)(F)F)c2)C1 ZINC000509963568 918554145 /nfs/dbraw/zinc/55/41/45/918554145.db2.gz KTMNECSEDWZEKR-HNNXBMFYSA-N 0 3 412.839 4.128 20 0 HIADHN CC(C)c1nn(-c2ccccc2)cc1CN[C@@H]1CCN(C(=O)Nc2ccccc2)C1 ZINC000510022440 918598574 /nfs/dbraw/zinc/59/85/74/918598574.db2.gz DKNJBPULNDSHDR-OAQYLSRUSA-N 0 3 403.530 4.392 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Cc1ccc(Br)s1)c1ccsc1 ZINC000510039608 918610578 /nfs/dbraw/zinc/61/05/78/918610578.db2.gz GHJXBWZSVZWTLU-AWEZNQCLSA-N 0 3 401.395 4.314 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCc3cc(-c4ccccc4)on3)c(C)c2)CC1 ZINC000510072616 918640355 /nfs/dbraw/zinc/64/03/55/918640355.db2.gz QAFJAYOPDXLUFP-UHFFFAOYSA-N 0 3 419.529 4.114 20 0 HIADHN Cc1nc(-c2ccc(C)cc2NC(=O)CN2CCC[C@@](C)(c3ccccc3)CC2)n[nH]1 ZINC000510161932 918714384 /nfs/dbraw/zinc/71/43/84/918714384.db2.gz XLABHBLWNUDXOP-RUZDIDTESA-N 0 3 417.557 4.471 20 0 HIADHN CSc1cccc(S(=O)(=O)N(C)[C@@H]2CCN(Cc3ccccc3)[C@@H](C)C2)c1 ZINC000510180607 918730883 /nfs/dbraw/zinc/73/08/83/918730883.db2.gz KDXFEMQLEQEUOR-PKOBYXMFSA-N 0 3 404.601 4.082 20 0 HIADHN COc1cc(CN(C)C[C@H](O)COc2ccc(C(F)(F)F)cc2)ccc1SC ZINC000510194832 918744550 /nfs/dbraw/zinc/74/45/50/918744550.db2.gz WFHVPQPVZPFHIB-INIZCTEOSA-N 0 3 415.477 4.308 20 0 HIADHN FC(F)(F)c1ccc(-n2cc(CNC[C@@H](c3ccco3)N3CCCC3)cn2)cc1 ZINC000510212385 918759229 /nfs/dbraw/zinc/75/92/29/918759229.db2.gz XSNMDYVJIPBPSD-IBGZPJMESA-N 0 3 404.436 4.411 20 0 HIADHN CC[C@@H](NCC(=O)N1CCc2sccc2[C@@H]1CC)c1ccc(OC)c(OC)c1 ZINC000510236616 918776378 /nfs/dbraw/zinc/77/63/78/918776378.db2.gz FHULXZWRMXMBFR-MSOLQXFVSA-N 0 3 402.560 4.342 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N(C)C[C@H]1OCCc2ccccc21)c1ccsc1 ZINC000510254999 918789069 /nfs/dbraw/zinc/78/90/69/918789069.db2.gz IKJWLWAXCJLECI-NHCUHLMSSA-N 0 3 401.576 4.086 20 0 HIADHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(Br)c(OC(F)(F)F)c1 ZINC000510258262 918790944 /nfs/dbraw/zinc/79/09/44/918790944.db2.gz OVJIKEGDPNDYKF-OLZOCXBDSA-N 0 3 421.257 4.047 20 0 HIADHN CN(C)[C@H](CNC(=O)N[C@H](CC(F)(F)F)c1ccc(F)cc1)Cc1ccccc1 ZINC000510350024 918846958 /nfs/dbraw/zinc/84/69/58/918846958.db2.gz FQBNGDMPWVUQQT-RBUKOAKNSA-N 0 3 411.443 4.291 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)NCCNc1ncc(Cl)cc1Cl ZINC000510370751 918857473 /nfs/dbraw/zinc/85/74/73/918857473.db2.gz AJUQXUPIAUZUNF-UHFFFAOYSA-N 0 3 407.301 4.038 20 0 HIADHN C[C@H](C(=O)N[C@@H](Cn1cnc2ccccc21)c1ccc(F)cc1)N1CCCCCC1 ZINC000510390430 918869031 /nfs/dbraw/zinc/86/90/31/918869031.db2.gz XYBRSKNXDWCYEB-GCJKJVERSA-N 0 3 408.521 4.297 20 0 HIADHN C[C@H](C(=O)N[C@H](Cn1cnc2ccccc21)c1ccc(F)cc1)N1CCCCCC1 ZINC000510390432 918869179 /nfs/dbraw/zinc/86/91/79/918869179.db2.gz XYBRSKNXDWCYEB-XMSQKQJNSA-N 0 3 408.521 4.297 20 0 HIADHN O[C@H](COc1cc(Cl)ccc1Cl)CN1CC[C@@H](n2ncc3ccccc32)C1 ZINC000510403961 918877361 /nfs/dbraw/zinc/87/73/61/918877361.db2.gz XXBVFEMTUJPLMA-SJORKVTESA-N 0 3 406.313 4.030 20 0 HIADHN CN(CCCc1cc(-c2ccc(F)cc2)n(C)n1)Cc1ccc(Br)cn1 ZINC000510437624 918896298 /nfs/dbraw/zinc/89/62/98/918896298.db2.gz ZPZGFRUSPGSXHJ-UHFFFAOYSA-N 0 3 417.326 4.448 20 0 HIADHN CC(C)(C)NC(=O)c1cccc(NC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000510459733 918916125 /nfs/dbraw/zinc/91/61/25/918916125.db2.gz JPIYFPQHDJJBSQ-NRFANRHFSA-N 0 3 408.546 4.001 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)NCc1ccc(OCc2ccccn2)cc1 ZINC000510487866 918937582 /nfs/dbraw/zinc/93/75/82/918937582.db2.gz FORPLVLSLAUOBY-UHFFFAOYSA-N 0 3 415.493 4.398 20 0 HIADHN CC(C)(C)c1nn(-c2ccccc2)cc1CN1CCC(CC(=O)N2CCCC2)CC1 ZINC000510489187 918938846 /nfs/dbraw/zinc/93/88/46/918938846.db2.gz HEZUDHKRKVJKQE-UHFFFAOYSA-N 0 3 408.590 4.394 20 0 HIADHN C[C@H](C(=O)NCC1(c2ccc(Cl)cc2Cl)CCOCC1)N1CCCCCC1 ZINC000510492605 918940211 /nfs/dbraw/zinc/94/02/11/918940211.db2.gz RCGJHFJZGLKFDK-MRXNPFEDSA-N 0 3 413.389 4.422 20 0 HIADHN COc1cc([C@@H](C)NC(=O)N[C@H](C)C2=CCN(C)CC2)ccc1OC1CCCC1 ZINC000510499698 918947106 /nfs/dbraw/zinc/94/71/06/918947106.db2.gz ITNXCGKBJCIHRK-IAGOWNOFSA-N 0 3 401.551 4.027 20 0 HIADHN C[C@@H](NC(=O)NC[C@@H](c1c[nH]c2ccccc21)c1ccccc1)C1=CCN(C)CC1 ZINC000510499167 918947542 /nfs/dbraw/zinc/94/75/42/918947542.db2.gz FIZSMRFKEXVGNK-XMSQKQJNSA-N 0 3 402.542 4.249 20 0 HIADHN COc1ccc([C@H](Cc2ccc(F)cc2)NC(=O)N[C@H](C)C2=CCN(C)CC2)cc1 ZINC000510526000 918971048 /nfs/dbraw/zinc/97/10/48/918971048.db2.gz OJWCQSUMVRTKRC-HXOBKFHXSA-N 0 3 411.521 4.068 20 0 HIADHN COc1cc([C@H](C)NC(=O)N[C@@H](C)C2=CCN(C)CC2)ccc1OCCC(C)C ZINC000510528531 918974018 /nfs/dbraw/zinc/97/40/18/918974018.db2.gz XJTNKGUJHZDEQS-ROUUACIJSA-N 0 3 403.567 4.131 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)NCc2ccc(OCC(F)(F)F)cc2)C1 ZINC000510532657 918978826 /nfs/dbraw/zinc/97/88/26/918978826.db2.gz WBVTYMSKFCSWAK-VQIMIIECSA-N 0 3 421.463 4.262 20 0 HIADHN CCCOc1ccccc1Oc1ncccc1CNC(=O)N[C@@H](C)C1=CCN(C)CC1 ZINC000510541186 918984862 /nfs/dbraw/zinc/98/48/62/918984862.db2.gz RBZZNNZKAIKKSU-SFHVURJKSA-N 0 3 424.545 4.112 20 0 HIADHN Cc1ccccc1C1(CNC(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)CCOCC1 ZINC000510549590 918993907 /nfs/dbraw/zinc/99/39/07/918993907.db2.gz MRSYGRFNDASPCI-GGAORHGYSA-N 0 3 421.585 4.178 20 0 HIADHN C[C@@H]1CN(C2CCN(Cc3ccc(-c4cccc(Br)c4)o3)CC2)CCO1 ZINC000510561166 919003577 /nfs/dbraw/zinc/00/35/77/919003577.db2.gz UTNLTIBGTXQELJ-MRXNPFEDSA-N 0 3 419.363 4.394 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)Nc1ccc(OC[C@@H]2CCCO2)cc1 ZINC000510563823 919005667 /nfs/dbraw/zinc/00/56/67/919005667.db2.gz CPHBWOBLRMGKSU-VQTJNVASSA-N 0 3 415.559 4.265 20 0 HIADHN C[C@H](NCC(=O)NC(=O)Nc1ccc2c(c1)OCCCO2)c1cccc2ccccc21 ZINC000510634160 919074431 /nfs/dbraw/zinc/07/44/31/919074431.db2.gz OPKXXLFVAPSBNP-INIZCTEOSA-N 0 3 419.481 4.000 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)NCCc1coc(-c2ccc(F)cc2)n1 ZINC000510668266 919109439 /nfs/dbraw/zinc/10/94/39/919109439.db2.gz PIZWZZIQETVURC-UHFFFAOYSA-N 0 3 407.445 4.261 20 0 HIADHN CC(C)CNC(=O)c1ccc(NC(=O)NCC(C)(C)N2CCc3ccccc3C2)cc1 ZINC000510683355 919120900 /nfs/dbraw/zinc/12/09/00/919120900.db2.gz OECMCTKWXWPUKW-UHFFFAOYSA-N 0 3 422.573 4.031 20 0 HIADHN C[C@@H](N[C@H]1CCc2ccc(Br)cc21)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000510693374 919129739 /nfs/dbraw/zinc/12/97/39/919129739.db2.gz ANWWCWPQYUGWME-YJYMSZOUSA-N 0 3 423.376 4.038 20 0 HIADHN CCN(CC)C(=O)c1ccc(NC(=O)CN[C@@H](c2ccc(OC)cc2)C(C)C)cc1 ZINC000510706784 919145744 /nfs/dbraw/zinc/14/57/44/919145744.db2.gz ZAQUVNLZSLUNRF-HSZRJFAPSA-N 0 3 411.546 4.103 20 0 HIADHN CN(C)[C@@H](CNC(=O)c1cccc(CN(C)Cc2ccccc2)c1)c1ccsc1 ZINC000510736339 919182834 /nfs/dbraw/zinc/18/28/34/919182834.db2.gz PRVQWAXEZBECCV-QHCPKHFHSA-N 0 3 407.583 4.413 20 0 HIADHN C[C@H](NC(=O)c1ccc(COc2cccc(Br)c2)o1)C1=CCN(C)CC1 ZINC000510772525 919230295 /nfs/dbraw/zinc/23/02/95/919230295.db2.gz JVNRIRZZTPAAPB-AWEZNQCLSA-N 0 3 419.319 4.001 20 0 HIADHN C[C@@H](NC(=O)[C@H](C)SCc1ncc(-c2ccc(Cl)cc2)o1)C1=CCN(C)CC1 ZINC000510774155 919232260 /nfs/dbraw/zinc/23/22/60/919232260.db2.gz ZYNWCXNVGKLJEG-CABCVRRESA-N 0 3 419.978 4.383 20 0 HIADHN Cc1ccc([C@@H](NCCCN2CCN(c3ccccc3)CC2)c2ccccn2)cc1 ZINC000510781968 919243267 /nfs/dbraw/zinc/24/32/67/919243267.db2.gz WAZFWFJJKDAYDH-AREMUKBSSA-N 0 3 400.570 4.281 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)NCCOc1ccc(Br)cc1 ZINC000510795777 919265657 /nfs/dbraw/zinc/26/56/57/919265657.db2.gz GELRTEHYQSWVKG-UHFFFAOYSA-N 0 3 417.303 4.066 20 0 HIADHN COC(=O)c1ccc(CN2CCC[C@H](c3nc(-c4ccccc4OC)cs3)C2)nc1 ZINC000510808481 919285583 /nfs/dbraw/zinc/28/55/83/919285583.db2.gz DTUHLPCIFSPSFA-KRWDZBQOSA-N 0 3 423.538 4.380 20 0 HIADHN CN(Cc1ccccc1)Cc1cccc(C(=O)NC2CCN(c3ccccn3)CC2)c1 ZINC000510845975 919331584 /nfs/dbraw/zinc/33/15/84/919331584.db2.gz XZDLAOYTESEEAT-UHFFFAOYSA-N 0 3 414.553 4.112 20 0 HIADHN Cc1c(C(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)cnn1C1CCCCC1 ZINC000510854482 919343817 /nfs/dbraw/zinc/34/38/17/919343817.db2.gz YUQHXMRRQDVMQI-OALUTQOASA-N 0 3 416.610 4.048 20 0 HIADHN COc1ccc(CNC(=O)c2oc3ccccc3c2CN(C)C)cc1Br ZINC000510863847 919354468 /nfs/dbraw/zinc/35/44/68/919354468.db2.gz BJPZWLPAKTWJBP-UHFFFAOYSA-N 0 3 417.303 4.196 20 0 HIADHN Cc1ccc(OCc2cccc(C(=O)N3C[C@@H](N(C)C)Cc4ccccc43)c2)cn1 ZINC000510876869 919371023 /nfs/dbraw/zinc/37/10/23/919371023.db2.gz DJTPAQXTFGIIIR-QFIPXVFZSA-N 0 3 401.510 4.102 20 0 HIADHN COc1cccc(CCCN(CCn2ccnc2)Cc2ccc(Br)o2)c1 ZINC000510935942 919458762 /nfs/dbraw/zinc/45/87/62/919458762.db2.gz NWDRAZNXHFSVRZ-UHFFFAOYSA-N 0 3 418.335 4.382 20 0 HIADHN Cc1nc(C(C)(C)C)sc1[C@H](C)N[C@@H]1CCN(C(=O)COc2ccccc2)C1 ZINC000510958837 919497137 /nfs/dbraw/zinc/49/71/37/919497137.db2.gz DOSXQJNOJCWUGE-DOTOQJQBSA-N 0 3 401.576 4.080 20 0 HIADHN CC[C@H](N[C@H]1CCc2cc(F)c(OC)cc21)c1ccccc1OCC(=O)N(C)C ZINC000510976809 919525094 /nfs/dbraw/zinc/52/50/94/919525094.db2.gz HGRGXHAUDBKZIO-PMACEKPBSA-N 0 3 400.494 4.030 20 0 HIADHN COc1cc(C(=O)N(CCN(C)C)Cc2ccccc2F)cc(OC)c1C(C)C ZINC000511006599 919565933 /nfs/dbraw/zinc/56/59/33/919565933.db2.gz CYTYUHMJLHUTQD-UHFFFAOYSA-N 0 3 402.510 4.170 20 0 HIADHN COc1ccc([C@@H](N[C@H]2CCN(C(=O)COc3ccccc3)C2)c2ccccc2)cc1 ZINC000511051160 919644858 /nfs/dbraw/zinc/64/48/58/919644858.db2.gz USVFMVWHDGMSEH-NVQXNPDNSA-N 0 3 416.521 4.054 20 0 HIADHN COc1ccc([C@@H](N[C@@H]2CCN(C(=O)COc3ccccc3)C2)c2ccccc2)cc1 ZINC000511051159 919645877 /nfs/dbraw/zinc/64/58/77/919645877.db2.gz USVFMVWHDGMSEH-GJZUVCINSA-N 0 3 416.521 4.054 20 0 HIADHN Cc1cc(C(=O)N(Cc2ccco2)C2CCN(C)CC2)c(C)cc1Br ZINC000511064186 919663311 /nfs/dbraw/zinc/66/33/11/919663311.db2.gz JZRLKYXOKXQLJG-UHFFFAOYSA-N 0 3 405.336 4.396 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)c1ccc(OCc2ccccc2)nc1 ZINC000511074671 919675096 /nfs/dbraw/zinc/67/50/96/919675096.db2.gz FAUSXYGCNGSUFE-HSZRJFAPSA-N 0 3 401.510 4.228 20 0 HIADHN CN(C(=O)c1csc(-c2ncccc2F)n1)C1CCN(Cc2ccccc2)CC1 ZINC000511095257 919699565 /nfs/dbraw/zinc/69/95/65/919699565.db2.gz VGDKVAMIIBBASU-UHFFFAOYSA-N 0 3 410.518 4.081 20 0 HIADHN Cc1cc(C(=O)Nc2cccc(CN3CCC(O)CC3)c2)c(C)cc1Br ZINC000511108199 919717884 /nfs/dbraw/zinc/71/78/84/919717884.db2.gz MDRLISAPOSLMSV-UHFFFAOYSA-N 0 3 417.347 4.275 20 0 HIADHN Cc1cc(Br)cc2cc(C(=O)NCCCCN3C[C@@H](C)O[C@H](C)C3)oc21 ZINC000511125928 919738245 /nfs/dbraw/zinc/73/82/45/919738245.db2.gz NZHVMZSRSWSBGV-HUUCEWRRSA-N 0 3 423.351 4.123 20 0 HIADHN CN(C(=O)Nc1cc(F)c(Br)cc1F)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000511133222 919750064 /nfs/dbraw/zinc/75/00/64/919750064.db2.gz XFFSLDOTQLDBMU-CQSZACIVSA-N 0 3 424.289 4.466 20 0 HIADHN Cc1cccc2nc(CN(Cc3ccccc3C(F)(F)F)CC3CC3)cc(=O)n12 ZINC000511135407 919752247 /nfs/dbraw/zinc/75/22/47/919752247.db2.gz FXFQEKNNNPKIEY-UHFFFAOYSA-N 0 3 401.432 4.434 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N[C@@H](C)c3c(F)cccc3F)c(C)c2)CC1 ZINC000511193651 919811638 /nfs/dbraw/zinc/81/16/38/919811638.db2.gz VGYFIILLWUQAPI-INIZCTEOSA-N 0 3 402.489 4.298 20 0 HIADHN Clc1ccc(C2=CCN(CCc3nnnn3-c3ccccc3)CC2)cc1Cl ZINC000511211103 919822629 /nfs/dbraw/zinc/82/26/29/919822629.db2.gz HMGJJUUVTKCMRH-UHFFFAOYSA-N 0 3 400.313 4.301 20 0 HIADHN Cc1ccc(NC(=O)Nc2ccccc2)cc1NC(=O)N[C@@H](C)C1=CCN(C)CC1 ZINC000511215206 919825555 /nfs/dbraw/zinc/82/55/55/919825555.db2.gz HEDDBUBYEQGCOC-KRWDZBQOSA-N 0 3 407.518 4.411 20 0 HIADHN C[C@H](NC(=O)NCc1csc(-c2ccc(C(F)(F)F)cc2)n1)C1=CCN(C)CC1 ZINC000511252040 919854171 /nfs/dbraw/zinc/85/41/71/919854171.db2.gz KIGBAFMGMPESMM-ZDUSSCGKSA-N 0 3 424.492 4.279 20 0 HIADHN C[C@H](NC(=O)Nc1ccc(Cl)c(C(=O)NC2CCCCC2)c1)C1=CCN(C)CC1 ZINC000511254360 919856834 /nfs/dbraw/zinc/85/68/34/919856834.db2.gz QSBQTRQVHMOGQL-HNNXBMFYSA-N 0 3 418.969 4.174 20 0 HIADHN Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)NC(=O)N[C@H](C)C1=CCN(C)CC1 ZINC000511271289 919868873 /nfs/dbraw/zinc/86/88/73/919868873.db2.gz VKSVDTIGVHYWGL-UKRRQHHQSA-N 0 3 402.539 4.268 20 0 HIADHN O=C(NCc1ccc(OC(F)F)c(F)c1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000511285734 919882313 /nfs/dbraw/zinc/88/23/13/919882313.db2.gz GWOWHGYIYTZXCU-INIZCTEOSA-N 0 3 410.411 4.095 20 0 HIADHN C[C@H](NC(=O)NCc1ccc(-c2ccc3c(c2)CCCO3)cc1)C1=CCN(C)CC1 ZINC000511290266 919886851 /nfs/dbraw/zinc/88/68/51/919886851.db2.gz SPKMBYJEFGCDIG-SFHVURJKSA-N 0 3 405.542 4.128 20 0 HIADHN COCCN(C(=O)N[C@H](C)C1=CCN(C)CC1)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000511295335 919891383 /nfs/dbraw/zinc/89/13/83/919891383.db2.gz UYEDVQBVMKXYBR-CVEARBPZSA-N 0 3 413.484 4.075 20 0 HIADHN CCc1cc(C(=O)N(CCN(C)C)Cc2cccc(OC)c2)c2c(n1)onc2C(C)C ZINC000511333066 919924916 /nfs/dbraw/zinc/92/49/16/919924916.db2.gz KVNCJMWZCASFMZ-UHFFFAOYSA-N 0 3 424.545 4.121 20 0 HIADHN Cc1ccc([C@H](CN[C@H](c2ccc(Cl)cc2)[C@H]2CN(C)CCO2)N2CCCC2)o1 ZINC000511367140 919958364 /nfs/dbraw/zinc/95/83/64/919958364.db2.gz MSITVWDCVXBQGM-MDNUFGMLSA-N 0 3 417.981 4.040 20 0 HIADHN O[C@@H](CN[C@H](Cc1ccc(Cl)cc1)c1ccccn1)COc1ccc(F)cc1 ZINC000511381225 919983224 /nfs/dbraw/zinc/98/32/24/919983224.db2.gz IHJDMLGHFOWRNC-SIKLNZKXSA-N 0 3 400.881 4.187 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)N[C@@H](C[C@H]1CCOC1)c1ccccc1 ZINC000511384812 919987515 /nfs/dbraw/zinc/98/75/15/919987515.db2.gz RPDSUZWCKPRBBI-OFNKIYASSA-N 0 3 413.537 4.067 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)N[C@@H](C[C@@H]2CCOC2)c2ccccc2)CC1 ZINC000511397855 920010361 /nfs/dbraw/zinc/01/03/61/920010361.db2.gz LIWHKKQIWMWKAN-CVDCTZTESA-N 0 3 411.546 4.053 20 0 HIADHN Cc1n[nH]c(C)c1[C@@H]1CCCCCN1C(=O)N[C@@H]1C[C@@H](C)N(Cc2ccccc2)C1 ZINC000511415548 920028734 /nfs/dbraw/zinc/02/87/34/920028734.db2.gz BGMRUCGMZIABAN-YHYVQYDKSA-N 0 3 409.578 4.316 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N2CC[C@@H](n3ncc4ccccc43)C2)N2CCCC2)cc1 ZINC000511417850 920031277 /nfs/dbraw/zinc/03/12/77/920031277.db2.gz JUXCNUAFYIRBGY-ISKFKSNPSA-N 0 3 417.557 4.138 20 0 HIADHN CC[C@@H](NC(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F)c1nc2ccccc2[nH]1 ZINC000511493615 920104230 /nfs/dbraw/zinc/10/42/30/920104230.db2.gz MHSPBPFHWLBZQR-ZWKOTPCHSA-N 0 3 412.484 4.288 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)N[C@H](CC(F)(F)F)c1ccc(F)cc1 ZINC000511548595 920178728 /nfs/dbraw/zinc/17/87/28/920178728.db2.gz ZDUDQRYQMGMXIK-QGZVFWFLSA-N 0 3 401.404 4.186 20 0 HIADHN COc1ccc(C[C@H](C)C(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)cc1OC ZINC000511551529 920184637 /nfs/dbraw/zinc/18/46/37/920184637.db2.gz LNPPFTKQQIVRTR-PMACEKPBSA-N 0 3 410.558 4.005 20 0 HIADHN CN(C)Cc1cccc(NC(=O)C(=O)N2CCC[C@@H]2c2ccc(C(C)(C)C)cc2)c1 ZINC000511561270 920201648 /nfs/dbraw/zinc/20/16/48/920201648.db2.gz QPUHQRLXNRVPIF-JOCHJYFZSA-N 0 3 407.558 4.348 20 0 HIADHN COc1cccc(CN(C)C(=O)CN[C@@H](c2cccc(OC(F)(F)F)c2)C2CC2)c1 ZINC000511593350 920240163 /nfs/dbraw/zinc/24/01/63/920240163.db2.gz LPPQPXSIZDFWRB-OAQYLSRUSA-N 0 3 422.447 4.293 20 0 HIADHN O=C(CN[C@@H](c1cccc(OC(F)(F)F)c1)C1CC1)N1CCc2sccc2C1 ZINC000511625748 920285271 /nfs/dbraw/zinc/28/52/71/920285271.db2.gz SHJHJEWNNOZUCM-LJQANCHMSA-N 0 3 410.461 4.272 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)Nc1cccc(C(=O)N2CCCCC2)c1 ZINC000511631026 920293340 /nfs/dbraw/zinc/29/33/40/920293340.db2.gz VKFJRTOASVQBTO-HSZRJFAPSA-N 0 3 420.557 4.271 20 0 HIADHN COC(=O)c1ccc(C)c(NC(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)c1 ZINC000511635598 920298533 /nfs/dbraw/zinc/29/85/33/920298533.db2.gz HJTOWSIUWHCNSN-LJQANCHMSA-N 0 3 415.559 4.438 20 0 HIADHN OC[C@H]1CN(CCSc2ccnc3cc(Cl)ccc32)CC[C@@H]1C(F)(F)F ZINC000511667440 920334143 /nfs/dbraw/zinc/33/41/43/920334143.db2.gz ONCKULKYSCISTF-DOMZBBRYSA-N 0 3 404.885 4.473 20 0 HIADHN Cc1cc(C(=O)CN2C[C@H](c3ccccc3)[C@@H]3COCC[C@H]32)c(C)n1CC(F)(F)F ZINC000511754335 920432996 /nfs/dbraw/zinc/43/29/96/920432996.db2.gz JBTLWIQMKVIRCD-QHAWAJNXSA-N 0 3 420.475 4.354 20 0 HIADHN Cc1cc(C(=O)CN2C[C@H](c3ccccc3)[C@H]3COCC[C@H]32)c(C)n1Cc1ccco1 ZINC000511754851 920434676 /nfs/dbraw/zinc/43/46/76/920434676.db2.gz JRLMJKQZYLRIKQ-UBFVSLLYSA-N 0 3 418.537 4.433 20 0 HIADHN O=C(CN1C[C@H](c2ccccc2)[C@H]2COCC[C@H]21)Nc1cccc(C(F)(F)F)c1 ZINC000511759064 920441773 /nfs/dbraw/zinc/44/17/73/920441773.db2.gz SSFYYKKIXAJRAZ-VAMGGRTRSA-N 0 3 404.432 4.148 20 0 HIADHN O=c1[nH]c(CN2C[C@H](c3ccccc3)[C@@H]3COCC[C@@H]32)nc2c3ccccc3oc21 ZINC000511797608 920491522 /nfs/dbraw/zinc/49/15/22/920491522.db2.gz PAHYZARLGRDTIP-QYZOEREBSA-N 0 3 401.466 4.086 20 0 HIADHN O=C(CN1C[C@H](c2ccccc2)[C@@H]2CCC[C@H]21)Nc1ccccc1N1CCCC1=O ZINC000511830018 920530537 /nfs/dbraw/zinc/53/05/37/920530537.db2.gz NRQIZNXPXTYPBI-TUNNFDKTSA-N 0 3 403.526 4.020 20 0 HIADHN CC(C)[C@@H](NC(=O)N[C@@H](C)CCN1CCN(C)CC1)c1ccc(C(C)(C)C)cc1 ZINC000511899274 920636595 /nfs/dbraw/zinc/63/65/95/920636595.db2.gz RHDJRHDTINKTKO-SIKLNZKXSA-N 0 3 402.627 4.006 20 0 HIADHN CCCN(CC)C(=O)c1ccc(C(=O)N[C@H](CN2CCCC2)c2ccccc2)cc1 ZINC000512044577 920814912 /nfs/dbraw/zinc/81/49/12/920814912.db2.gz GJBCPLONPNGQJF-HSZRJFAPSA-N 0 3 407.558 4.126 20 0 HIADHN CN(C)Cc1ccc(CNCc2cnn(-c3ccc(C(F)(F)F)cc3)c2)cc1F ZINC000512066976 920833711 /nfs/dbraw/zinc/83/37/11/920833711.db2.gz IPVZKWKPLJIWJM-UHFFFAOYSA-N 0 3 406.427 4.382 20 0 HIADHN COc1cccc(OC)c1CNC[C@H]1CCN(c2ccc(Br)cc2)C1 ZINC000512083267 920847770 /nfs/dbraw/zinc/84/77/70/920847770.db2.gz IOOHQDVAZHVNHT-OAHLLOKOSA-N 0 3 405.336 4.082 20 0 HIADHN Ic1cnc(CNC[C@@H]2CCCO[C@@H]2c2ccccc2)s1 ZINC000512082908 920847979 /nfs/dbraw/zinc/84/79/79/920847979.db2.gz MIBQBLPJFTUZEC-XJKSGUPXSA-N 0 3 414.312 4.005 20 0 HIADHN COc1cccc(OC)c1CNC1CCN(Cc2cccc(C(F)(F)F)c2)CC1 ZINC000512102348 920861348 /nfs/dbraw/zinc/86/13/48/920861348.db2.gz ZIQQKRQCBSLDRU-UHFFFAOYSA-N 0 3 408.464 4.477 20 0 HIADHN COc1ccc(C(=O)c2ccccc2C(=O)N2CCCN(C3CCCC3)CC2)cc1 ZINC000512101782 920861364 /nfs/dbraw/zinc/86/13/64/920861364.db2.gz FJKOLYNOUASOOH-UHFFFAOYSA-N 0 3 406.526 4.017 20 0 HIADHN OCC[C@H](NC[C@H](O)COc1ccc(Cl)cc1)c1ccc(Cl)c(Cl)c1 ZINC000512153027 920893544 /nfs/dbraw/zinc/89/35/44/920893544.db2.gz QHXKUOWYXLDKOS-KSSFIOAISA-N 0 3 404.721 4.100 20 0 HIADHN C[C@@H]1CC[C@@H](c2ccccc2)N(CC(=O)N2CCC(C(=O)Nc3ccccc3)CC2)C1 ZINC000512154532 920894382 /nfs/dbraw/zinc/89/43/82/920894382.db2.gz YVHLZKIWNMWBAK-YKSBVNFPSA-N 0 3 419.569 4.337 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N[C@@H](C[C@H]3CCOC3)c3ccccc3)cc2)CC1 ZINC000512206676 920953531 /nfs/dbraw/zinc/95/35/31/920953531.db2.gz HZDUUDVYBRQUEJ-BWKNWUBXSA-N 0 3 421.585 4.115 20 0 HIADHN O=C(CN1CCC[C@@]2(CC=CCC2)C1)N1CCC[C@H]1c1ccc2c(c1)OCCCO2 ZINC000512208770 920954530 /nfs/dbraw/zinc/95/45/30/920954530.db2.gz HLJVUPJIECKFSC-OFVILXPXSA-N 0 3 410.558 4.334 20 0 HIADHN Cc1cccc2nc(CN3CCC[C@@H](c4nc5ccccc5n4C(C)C)C3)cc(=O)n12 ZINC000512282536 921036673 /nfs/dbraw/zinc/03/66/73/921036673.db2.gz VTRNQKWSPLWUAE-LJQANCHMSA-N 0 3 415.541 4.313 20 0 HIADHN CCn1ccnc1[C@H]1OCC[C@@H]1NCc1ccc(Oc2cc(OC)cc(OC)c2)cc1 ZINC000512340882 921085409 /nfs/dbraw/zinc/08/54/09/921085409.db2.gz AEZRYIQBMQOJRJ-GOTSBHOMSA-N 0 3 423.513 4.332 20 0 HIADHN Cc1ccc(-c2nn(Cc3ccccc3)cc2CN2CCC(n3cncn3)CC2)cc1 ZINC000512369554 921110199 /nfs/dbraw/zinc/11/01/99/921110199.db2.gz CWMGRSRBOVRTNR-UHFFFAOYSA-N 0 3 412.541 4.335 20 0 HIADHN O=C(NC[C@@H]1CCO[C@H]1c1ccccc1)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000513449111 921815113 /nfs/dbraw/zinc/81/51/13/921815113.db2.gz XQMOBTSZZZUIQD-BDTNDASRSA-N 0 3 414.496 4.038 20 0 HIADHN CCN(Cc1cccs1)C[C@@H](O)COc1ccc(Cl)cc1Br ZINC000513453698 921819460 /nfs/dbraw/zinc/81/94/60/921819460.db2.gz AATIZENBQRTNNK-CYBMUJFWSA-N 0 3 404.757 4.426 20 0 HIADHN CN1CCN(c2ncc(CNC3(c4ccc(C(C)(C)C)cc4)CCCC3)cn2)CC1 ZINC000513506548 921855149 /nfs/dbraw/zinc/85/51/49/921855149.db2.gz RBXPSIUSVMUBIO-UHFFFAOYSA-N 0 3 407.606 4.085 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2ccccc2Oc2cnn(C)c2)N2CCCC2)cc1 ZINC000513557006 921893393 /nfs/dbraw/zinc/89/33/93/921893393.db2.gz QURLWRDIHPCWHS-JOCHJYFZSA-N 0 3 404.514 4.088 20 0 HIADHN FC(F)Cn1cc(CN[C@H](c2cccc(C(F)(F)F)c2)C2CCOCC2)cn1 ZINC000513632448 921957971 /nfs/dbraw/zinc/95/79/71/921957971.db2.gz CQJXQJBNQKQEHP-SFHVURJKSA-N 0 3 403.395 4.425 20 0 HIADHN COc1ccc([C@H](Cc2ccncc2)NCc2ccccc2CN2CCCC2=O)cc1 ZINC000513653823 921975955 /nfs/dbraw/zinc/97/59/55/921975955.db2.gz FWJKWKWOMXHTBF-VWLOTQADSA-N 0 3 415.537 4.286 20 0 HIADHN c1cc(-c2nc3ccccc3s2)oc1CN1CCC[C@H](c2nnc3n2CCC3)C1 ZINC000513660718 921983234 /nfs/dbraw/zinc/98/32/34/921983234.db2.gz KGNORZGYPDVOMN-HNNXBMFYSA-N 0 3 405.527 4.474 20 0 HIADHN FC(F)(F)Oc1cccc([C@@H](NCc2ccc(N3CCOCC3)nc2)C2CC2)c1 ZINC000513696880 922016632 /nfs/dbraw/zinc/01/66/32/922016632.db2.gz FSQSVRSDWBDDFY-FQEVSTJZSA-N 0 3 407.436 4.058 20 0 HIADHN FC(F)(F)Oc1cccc([C@H](NCc2ccc(N3CCOCC3)nc2)C2CC2)c1 ZINC000513696881 922017438 /nfs/dbraw/zinc/01/74/38/922017438.db2.gz FSQSVRSDWBDDFY-HXUWFJFHSA-N 0 3 407.436 4.058 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3ccn(Cc4ccccc4)c3)c(C)c2)CC1 ZINC000513719409 922039112 /nfs/dbraw/zinc/03/91/12/922039112.db2.gz BYUJXMAVLZKLIV-UHFFFAOYSA-N 0 3 402.542 4.239 20 0 HIADHN CCN(Cc1ccc(C(=O)N(C)C)cc1)Cc1ccc(OCC(F)(F)F)c(OC)c1 ZINC000513725887 922046864 /nfs/dbraw/zinc/04/68/64/922046864.db2.gz UPAJDKVBTPCQKM-UHFFFAOYSA-N 0 3 424.463 4.360 20 0 HIADHN COc1ccc(CCC(=O)N2CCCN(CCCOc3cc(C)ccc3C)CC2)cc1 ZINC000513821661 922145471 /nfs/dbraw/zinc/14/54/71/922145471.db2.gz NAHQFHREMIXKOR-UHFFFAOYSA-N 0 3 424.585 4.248 20 0 HIADHN CS(=O)(=O)c1ccc(OCCN[C@@H]2CC3(CCCCC3)Oc3ccccc32)cc1 ZINC000513829474 922156083 /nfs/dbraw/zinc/15/60/83/922156083.db2.gz CXWYWQLDKJZMCX-OAQYLSRUSA-N 0 3 415.555 4.285 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3nc(-c4ccccc4)cs3)CC2)C[C@H](C)O1 ZINC000513831449 922158212 /nfs/dbraw/zinc/15/82/12/922158212.db2.gz RMUBMHRNOQEIMX-HDICACEKSA-N 0 3 413.587 4.162 20 0 HIADHN COc1cc(Cl)c(C(=O)NC[C@@H]2CCCCN2Cc2ccccc2)cc1OC ZINC000513854084 922178317 /nfs/dbraw/zinc/17/83/17/922178317.db2.gz JBGXYPBRQVRSDB-KRWDZBQOSA-N 0 3 402.922 4.142 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Cc2c[nH]c3cccc(Br)c23)N(C)C)cc1 ZINC000513854804 922180703 /nfs/dbraw/zinc/18/07/03/922180703.db2.gz VOLYRPXLLYNQIG-IBGZPJMESA-N 0 3 414.347 4.200 20 0 HIADHN C[C@H]1CCCN(S(=O)(=O)c2ccc(CN[C@@H]3CCc4c3cccc4F)cc2)C1 ZINC000513858468 922186507 /nfs/dbraw/zinc/18/65/07/922186507.db2.gz ABURMMGIHYCLMI-KSFYIVLOSA-N 0 3 402.535 4.023 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)NC[C@@H]1CCCO[C@@H]1c1ccccc1 ZINC000513911258 922234431 /nfs/dbraw/zinc/23/44/31/922234431.db2.gz MUBIGPKRWNWZLF-KMDXXIMOSA-N 0 3 407.558 4.291 20 0 HIADHN O=C(N1CCOc2cccc(F)c2C1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000513916187 922239530 /nfs/dbraw/zinc/23/95/30/922239530.db2.gz DKVVLUSMOUNQLY-OAQYLSRUSA-N 0 3 422.422 4.001 20 0 HIADHN CN(C)Cc1ccsc1C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1c1ccccc1 ZINC000513936382 922256742 /nfs/dbraw/zinc/25/67/42/922256742.db2.gz SRTMPSVSPXMCHC-XZOQPEGZSA-N 0 3 419.594 4.208 20 0 HIADHN CCOC(=O)C1CCC(N(CC)C(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)CC1 ZINC000514037559 922358474 /nfs/dbraw/zinc/35/84/74/922358474.db2.gz GZTLQRPJGPTJNG-FUHYEJFZSA-N 0 3 418.553 4.008 20 0 HIADHN COCCOc1ccc(CN2CCC([C@H]3C(=O)Nc4cc(Cl)ccc43)CC2)cc1 ZINC000514086024 922410694 /nfs/dbraw/zinc/41/06/94/922410694.db2.gz YJZUNDDZONNFSU-JOCHJYFZSA-N 0 3 414.933 4.313 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N[C@H](C)c2ccc(NC(=O)C3CC3)cc2)N(C)C)cc1 ZINC000514101360 922428562 /nfs/dbraw/zinc/42/85/62/922428562.db2.gz DXWQRHURVYLLJM-VGOFRKELSA-N 0 3 408.546 4.007 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N[C@@H](C)c2ccc(NC(=O)C3CC3)cc2)C1 ZINC000514141072 922476059 /nfs/dbraw/zinc/47/60/59/922476059.db2.gz AVRMUYOCUOUYCV-YZZKKUAISA-N 0 3 420.557 4.231 20 0 HIADHN CN(C)[C@@H](CNC(=O)N(C)CCCc1cc(-c2ccccc2)no1)Cc1ccccc1 ZINC000514163191 922503057 /nfs/dbraw/zinc/50/30/57/922503057.db2.gz UWXUVAAWKZDAIG-JOCHJYFZSA-N 0 3 420.557 4.089 20 0 HIADHN CCCCN(CC(=O)N1CCC(C(=O)N2CCCC2)CC1)[C@H](CC)c1ccccc1 ZINC000514175016 922513357 /nfs/dbraw/zinc/51/33/57/922513357.db2.gz UARZMGLWJMFDDV-HSZRJFAPSA-N 0 3 413.606 4.101 20 0 HIADHN CC[C@H]1C[C@@H](CC(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)CCO1 ZINC000514190145 922530612 /nfs/dbraw/zinc/53/06/12/922530612.db2.gz PTOKLHAVQWAITC-HKUYNNGSSA-N 0 3 400.485 4.191 20 0 HIADHN Cc1ccc(-c2ccc(C(=O)N3CCC(CN4C[C@@H](C)O[C@H](C)C4)CC3)s2)o1 ZINC000514219787 922555447 /nfs/dbraw/zinc/55/54/47/922555447.db2.gz VNXBJXJYHRBINC-IAGOWNOFSA-N 0 3 402.560 4.278 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)N1CCC(Nc2ccc(F)cc2)CC1 ZINC000514223802 922558064 /nfs/dbraw/zinc/55/80/64/922558064.db2.gz ZVAKBNJOSSBTPC-HSZRJFAPSA-N 0 3 410.537 4.249 20 0 HIADHN CN(C)[C@H](CNC(=O)Nc1ncc(Cc2ccc(F)c(F)c2)s1)c1ccccc1 ZINC000514560395 922698574 /nfs/dbraw/zinc/69/85/74/922698574.db2.gz LWSGUZSXQPEMQZ-LJQANCHMSA-N 0 3 416.497 4.437 20 0 HIADHN C[C@H](N[C@H]1c2ccccc2CC12CCOCC2)C(=O)Nc1ccc(-c2c[nH]cn2)cc1 ZINC000514694652 922761657 /nfs/dbraw/zinc/76/16/57/922761657.db2.gz GQRLGTADPPOHEW-SBUREZEXSA-N 0 3 416.525 4.088 20 0 HIADHN COc1cc(CN2CCC[C@H](CCNC(C)=O)C2)ccc1OCc1cccs1 ZINC000514891256 922834545 /nfs/dbraw/zinc/83/45/45/922834545.db2.gz RAYUAMYTUMIOLQ-GOSISDBHSA-N 0 3 402.560 4.074 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)c1ccc(C)c(NC(=O)NC(C)(C)C)c1)c1ccco1 ZINC000514962437 922855081 /nfs/dbraw/zinc/85/50/81/922855081.db2.gz HJAPBVFYXAONKX-QFBILLFUSA-N 0 3 414.550 4.367 20 0 HIADHN CCOc1ccc(-c2noc(CN3CCN(c4ccnc5ccccc54)CC3)n2)cc1 ZINC000515018841 922879738 /nfs/dbraw/zinc/87/97/38/922879738.db2.gz LCDGSBBNVKGIGR-UHFFFAOYSA-N 0 3 415.497 4.006 20 0 HIADHN COc1cc(Cl)c(C)cc1NC(=O)CN[C@H]1c2ccccc2CC12CCOCC2 ZINC000515017963 922880360 /nfs/dbraw/zinc/88/03/60/922880360.db2.gz CFDJTDWOGILJPM-QFIPXVFZSA-N 0 3 414.933 4.279 20 0 HIADHN C[C@@H]1C[C@H]1N1CCN(C(=O)c2cc(F)c(Br)cc2Cl)C[C@@H](C)C1 ZINC000515079668 922896486 /nfs/dbraw/zinc/89/64/86/922896486.db2.gz ACZKWBSGRCWEDU-LYOVBCGYSA-N 0 3 403.723 4.044 20 0 HIADHN Cc1cccc(C)c1NC(=O)CNC(=O)[C@@H](C)N[C@H](C)c1ccc(F)c2ccccc21 ZINC000515090126 922901926 /nfs/dbraw/zinc/90/19/26/922901926.db2.gz RXMPPCMMMMJIOD-QZTJIDSGSA-N 0 3 421.516 4.390 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N(C)[C@H](C)c3ccc(OC)cc3)c(C)c2)CC1 ZINC000515112591 922926449 /nfs/dbraw/zinc/92/64/49/922926449.db2.gz KTZLBZJFHWKXFQ-LJQANCHMSA-N 0 3 410.562 4.370 20 0 HIADHN CC1CCN([C@@H](CNC(=O)Nc2ccc3c(c2)CCC(=O)N3)c2cccs2)CC1 ZINC000515122133 922936782 /nfs/dbraw/zinc/93/67/82/922936782.db2.gz YQUWATDEFHSCFL-IBGZPJMESA-N 0 3 412.559 4.228 20 0 HIADHN C[C@H](NC(=O)NC[C@H](c1ccccc1)N(C)C)c1nc2ccccc2n1C(F)F ZINC000515296147 923040153 /nfs/dbraw/zinc/04/01/53/923040153.db2.gz XJBZNLUYENXXJJ-KBXCAEBGSA-N 0 3 401.461 4.095 20 0 HIADHN CCOC(=O)c1nnc(-c2cccc(C[NH2+]C3CCC(c4ccc(O)cc4)CC3)c2)[n-]1 ZINC000515332342 923056384 /nfs/dbraw/zinc/05/63/84/923056384.db2.gz AXASFPKNSCBTGO-UHFFFAOYSA-N 0 3 420.513 4.170 20 0 HIADHN CCOC(=O)c1nc(-c2cccc(C[NH2+]C3CCC(c4ccc(O)cc4)CC3)c2)n[n-]1 ZINC000515332342 923056396 /nfs/dbraw/zinc/05/63/96/923056396.db2.gz AXASFPKNSCBTGO-UHFFFAOYSA-N 0 3 420.513 4.170 20 0 HIADHN CCOc1ccc(-c2nc(CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)cs2)cc1 ZINC000515360159 923066318 /nfs/dbraw/zinc/06/63/18/923066318.db2.gz FWHYSRGUVKLUSI-FQEVSTJZSA-N 0 3 421.566 4.142 20 0 HIADHN CCc1ccc([C@H](CNC(=O)Nc2cc3c(cc2Cl)OCCCO3)N(C)C)cc1 ZINC000515387371 923074523 /nfs/dbraw/zinc/07/45/23/923074523.db2.gz APTTUALSSFTWHG-IBGZPJMESA-N 0 3 417.937 4.488 20 0 HIADHN CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)cc1)C1CC1 ZINC000515395800 923080272 /nfs/dbraw/zinc/08/02/72/923080272.db2.gz BHRNZUOFCKMDKV-LJQANCHMSA-N 0 3 409.505 4.192 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cnn2c1nccc2-c1ccccc1)c1ccsc1 ZINC000515503875 923139198 /nfs/dbraw/zinc/13/91/98/923139198.db2.gz VEZKGZBZSOLFFV-NRFANRHFSA-N 0 3 419.554 4.271 20 0 HIADHN CC[C@@H](C)NC(=O)c1cccc(CNCCC(=O)Nc2cccc(C(F)(F)F)c2)c1 ZINC000515506661 923140717 /nfs/dbraw/zinc/14/07/17/923140717.db2.gz QEAVMLVENHQEFC-OAHLLOKOSA-N 0 3 421.463 4.352 20 0 HIADHN CC[C@H](C)NC(=O)c1cccc(CNCCC(=O)Nc2cccc(C(F)(F)F)c2)c1 ZINC000515506660 923141784 /nfs/dbraw/zinc/14/17/84/923141784.db2.gz QEAVMLVENHQEFC-HNNXBMFYSA-N 0 3 421.463 4.352 20 0 HIADHN CCc1c(C(=O)NC[C@@H](c2cccc(OC)c2)N(CC)CC)cnn1C(C)(C)C ZINC000515528407 923157858 /nfs/dbraw/zinc/15/78/58/923157858.db2.gz FQYGOQMTVSJGHS-NRFANRHFSA-N 0 3 400.567 4.022 20 0 HIADHN COc1ccccc1CN(CCC(=O)Nc1cccc(Cl)c1)C[C@@H]1CCCO1 ZINC000515545882 923168208 /nfs/dbraw/zinc/16/82/08/923168208.db2.gz AWNHALXIZZWCFL-FQEVSTJZSA-N 0 3 402.922 4.358 20 0 HIADHN O=C(CN1CCCC2(CCOCC2)C1)N1Cc2ccccc2[C@@H](c2ccccc2)C1 ZINC000515566091 923183270 /nfs/dbraw/zinc/18/32/70/923183270.db2.gz YZKFQHWKRQVTJH-XMMPIXPASA-N 0 3 404.554 4.053 20 0 HIADHN CCOC(=O)c1c2c(sc1NC(=O)[C@@H](C)OCC(C)C)C(C)(C)NC(C)(C)C2 ZINC000515599599 923209196 /nfs/dbraw/zinc/20/91/96/923209196.db2.gz GNMCABSPPYXBAR-CYBMUJFWSA-N 0 3 410.580 4.084 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)c3c(Cl)c4ccccc4n3C)cc2)CC1 ZINC000515815042 923369765 /nfs/dbraw/zinc/36/97/65/923369765.db2.gz HORAAJXEHDHQBG-UHFFFAOYSA-N 0 3 410.949 4.222 20 0 HIADHN COc1ccc([C@H](CNC(=O)NCc2cc3c(s2)CCCC3)N2CCCC2)cc1 ZINC000515843354 923387442 /nfs/dbraw/zinc/38/74/42/923387442.db2.gz CJSSWTDEPJEHPV-NRFANRHFSA-N 0 3 413.587 4.272 20 0 HIADHN COc1ccc([C@@H](CNC(=O)NCc2cc3c(s2)CCCC3)N2CCCC2)cc1 ZINC000515843355 923388018 /nfs/dbraw/zinc/38/80/18/923388018.db2.gz CJSSWTDEPJEHPV-OAQYLSRUSA-N 0 3 413.587 4.272 20 0 HIADHN CN1CCN(CCCCNC(=O)c2ccccc2-c2ccc(C(F)(F)F)cc2)CC1 ZINC000516097536 923541778 /nfs/dbraw/zinc/54/17/78/923541778.db2.gz GYHCASJARQZDMQ-UHFFFAOYSA-N 0 3 419.491 4.130 20 0 HIADHN O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N(CCc1ccccc1)Cc1cccnc1 ZINC000516159447 923580873 /nfs/dbraw/zinc/58/08/73/923580873.db2.gz XYOFPZLWVNSQKM-RUZDIDTESA-N 0 3 414.553 4.110 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N2CCC[C@H]2c2ccc3c(c2)OCCO3)C1 ZINC000516165663 923583924 /nfs/dbraw/zinc/58/39/24/923583924.db2.gz UVZDFEGSDVBJHT-QIJUGHKUSA-N 0 3 421.541 4.140 20 0 HIADHN COc1ccc([C@H]2CCCCCN2C(=O)[C@@H]2CCCN(Cc3cccnc3)C2)cc1 ZINC000516331370 923670485 /nfs/dbraw/zinc/67/04/85/923670485.db2.gz VYLSCUDYYLLWNQ-ISKFKSNPSA-N 0 3 407.558 4.446 20 0 HIADHN Cc1cc(NC(=O)N[C@H]2CCN(Cc3ccccc3)[C@H]2C)ccc1OC1CCOCC1 ZINC000516341443 923677237 /nfs/dbraw/zinc/67/72/37/923677237.db2.gz XYJZBISNCPQJCU-CVDCTZTESA-N 0 3 423.557 4.337 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)CCCc3ccccc3Cl)CC2)C[C@H](C)O1 ZINC000516607795 923814156 /nfs/dbraw/zinc/81/41/56/923814156.db2.gz BHLBKRQILGMHFI-KDURUIRLSA-N 0 3 406.998 4.401 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@H](Nc2ccc(CN3CCN(CC)CC3)cc2)c2ccccc21 ZINC000516789234 923887100 /nfs/dbraw/zinc/88/71/00/923887100.db2.gz UJSKXOJFXFQVNV-RPBOFIJWSA-N 0 3 421.585 4.418 20 0 HIADHN C[C@H](NCC(=O)NC[C@@H]1CCN(c2ccccc2)C1)c1ccc(F)c2ccccc21 ZINC000517053294 923975872 /nfs/dbraw/zinc/97/58/72/923975872.db2.gz AKFPNIJJDQYNBB-OALUTQOASA-N 0 3 405.517 4.272 20 0 HIADHN C[C@@H]1CCCCN1CCNC(=O)c1ccccc1CSc1nc2ccccc2[nH]1 ZINC000517086491 923989701 /nfs/dbraw/zinc/98/97/01/923989701.db2.gz BYNWZJQBGCLORR-QGZVFWFLSA-N 0 3 408.571 4.459 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)NCc2ccsc2Br)c1 ZINC000517223523 924056831 /nfs/dbraw/zinc/05/68/31/924056831.db2.gz NODFVNDMWIOSTN-UHFFFAOYSA-N 0 3 410.381 4.092 20 0 HIADHN COc1cccc([C@@H]2C[C@H]2C(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)c1 ZINC000517335814 924109912 /nfs/dbraw/zinc/10/99/12/924109912.db2.gz SCXYOERJIRLFFX-LEWJYISDSA-N 0 3 420.475 4.408 20 0 HIADHN COc1ccc(OC(C)C)c(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2)c1 ZINC000517377462 924143653 /nfs/dbraw/zinc/14/36/53/924143653.db2.gz LUCBZZAJDVVIDN-UHFFFAOYSA-N 0 3 403.498 4.217 20 0 HIADHN Cc1nn(-c2ccccn2)c(C)c1CN1CCC[C@H](c2nc(C(F)(F)F)cn2C)C1 ZINC000517436409 924185191 /nfs/dbraw/zinc/18/51/91/924185191.db2.gz RVJLPXIGSKLHET-INIZCTEOSA-N 0 3 418.467 4.016 20 0 HIADHN CCN(C(=O)NC[C@H](c1ccccc1)N1CCCC1)[C@H](C)Cc1ccc(OC)cc1 ZINC000517532021 924249577 /nfs/dbraw/zinc/24/95/77/924249577.db2.gz IPFWTIRYNHAPMK-HYBUGGRVSA-N 0 3 409.574 4.495 20 0 HIADHN C[C@H]1CN([C@H](CNCc2cc(F)c(F)c(F)c2)c2c(F)cccc2Cl)CCO1 ZINC000517537389 924252163 /nfs/dbraw/zinc/25/21/63/924252163.db2.gz QZKMWQRCSVNQEW-KPZWWZAWSA-N 0 3 416.846 4.448 20 0 HIADHN COc1ccc(Cl)cc1CN(C)C(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000517544483 924257521 /nfs/dbraw/zinc/25/75/21/924257521.db2.gz CTJLPUOGKWQTLS-OXQOHEQNSA-N 0 3 401.938 4.326 20 0 HIADHN O=C(c1ccc(CNCc2ccc(Cl)c(C(F)(F)F)c2)cc1)N1CCOCC1 ZINC000517550950 924261479 /nfs/dbraw/zinc/26/14/79/924261479.db2.gz WIDSMPZKYZUNTG-UHFFFAOYSA-N 0 3 412.839 4.121 20 0 HIADHN COCCN(CCN(C)C)C(=O)N[C@@H](c1ccccc1)c1ccc2ccccc2c1 ZINC000517600285 926710109 /nfs/dbraw/zinc/71/01/09/926710109.db2.gz PHYYURZVNKQELK-DEOSSOPVSA-N 0 3 405.542 4.149 20 0 HIADHN COc1cc(Cl)c(C)cc1NC(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000517600350 926710192 /nfs/dbraw/zinc/71/01/92/926710192.db2.gz RSAVQSGKCKRFNJ-HZPDHXFCSA-N 0 3 409.958 4.010 20 0 HIADHN C[C@H](C(=O)NCC1CCCCC1)N(C)CCCc1cc(-c2cccc(F)c2)n[nH]1 ZINC000517618169 926727450 /nfs/dbraw/zinc/72/74/50/926727450.db2.gz WHUUDTURPJUKPO-QGZVFWFLSA-N 0 3 400.542 4.165 20 0 HIADHN C[C@@H](CNC(=O)NCc1ccc(Oc2cccc(F)c2)nc1)N(C)Cc1ccccc1 ZINC000517704837 926804261 /nfs/dbraw/zinc/80/42/61/926804261.db2.gz BTBJNFRYIQTNEM-SFHVURJKSA-N 0 3 422.504 4.333 20 0 HIADHN COCCCCN(Cc1ccccc1)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000517792833 926839072 /nfs/dbraw/zinc/83/90/72/926839072.db2.gz HETPRRZNILVSQS-DEOSSOPVSA-N 0 3 409.574 4.289 20 0 HIADHN CCOc1ccc(OC)cc1NC(=O)N1CCCN(CCCc2ccccc2)CC1 ZINC000517903837 926883228 /nfs/dbraw/zinc/88/32/28/926883228.db2.gz YPUPNZSRXXYBKR-UHFFFAOYSA-N 0 3 411.546 4.266 20 0 HIADHN CC[C@H](C)[C@@H](C)N(CC(=O)N(C)CC(=O)Nc1ccccc1C(F)(F)F)C1CC1 ZINC000517908943 926886321 /nfs/dbraw/zinc/88/63/21/926886321.db2.gz RTVWDUXPEBMUQJ-LSDHHAIUSA-N 0 3 413.484 4.001 20 0 HIADHN COc1ccc([C@H](CNC(=O)CCOc2cccc(Cl)c2)N2CCCC2)cc1 ZINC000517996578 926938978 /nfs/dbraw/zinc/93/89/78/926938978.db2.gz SKIWKPIQZVWQBZ-NRFANRHFSA-N 0 3 402.922 4.071 20 0 HIADHN COc1ccc(-c2nc(C)c(C(=O)NCCN3[C@H](C)CCC[C@H]3C)s2)cc1OC ZINC000518070975 927007084 /nfs/dbraw/zinc/00/70/84/927007084.db2.gz ZUOJAPKSNYZBJK-HUUCEWRRSA-N 0 3 417.575 4.128 20 0 HIADHN CCOc1ccc(NC(=O)NCC2(N3CCOC(C)(C)C3)CCCCC2)c(C)c1 ZINC000518226642 927090387 /nfs/dbraw/zinc/09/03/87/927090387.db2.gz FUQOCGRCTIZEFB-UHFFFAOYSA-N 0 3 403.567 4.329 20 0 HIADHN CN(C)Cc1ccc(C(=O)Nc2nc(-c3ccc4c(c3)CCC(=O)N4)cs2)cc1 ZINC000518227561 927092006 /nfs/dbraw/zinc/09/20/06/927092006.db2.gz GUHXGUCCSGRDEN-UHFFFAOYSA-N 0 3 406.511 4.009 20 0 HIADHN CN(C)c1ccc(CNCc2ccc(OC(F)(F)[C@H](F)C(F)(F)F)cc2)cn1 ZINC000518267950 927127125 /nfs/dbraw/zinc/12/71/25/927127125.db2.gz AVJNRJDPVOOBPS-MRXNPFEDSA-N 0 3 407.358 4.309 20 0 HIADHN C[C@@H](Cn1cncn1)NCc1cccc(NC(=O)c2ccc(Cl)cc2Cl)c1 ZINC000518276537 927133021 /nfs/dbraw/zinc/13/30/21/927133021.db2.gz ADBGVFBIOOXMIR-ZDUSSCGKSA-N 0 3 404.301 4.016 20 0 HIADHN FC(F)(F)CN1CC[C@@H](NCc2ccc(-c3cccc(Br)c3)o2)C1 ZINC000518279837 927138005 /nfs/dbraw/zinc/13/80/05/927138005.db2.gz ARSIQCLKCRESJS-CQSZACIVSA-N 0 3 403.242 4.435 20 0 HIADHN Cc1ccc(COc2ccc(CN[C@@H](Cc3ccccc3)C(=O)N(C)C)cc2)cc1 ZINC000518284368 927141040 /nfs/dbraw/zinc/14/10/40/927141040.db2.gz JLELPVPDDKADCU-VWLOTQADSA-N 0 3 402.538 4.363 20 0 HIADHN CC(C)COc1cccc(NC(=O)N2CCC(CN3C[C@@H](C)O[C@H](C)C3)CC2)c1 ZINC000518316070 927178206 /nfs/dbraw/zinc/17/82/06/927178206.db2.gz PBMSZCWVOVEZHT-RTBURBONSA-N 0 3 403.567 4.075 20 0 HIADHN Cc1cc(OC(C)C)ccc1NC(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000518315935 927178596 /nfs/dbraw/zinc/17/85/96/927178596.db2.gz KQCQAISVJLLVAH-RTBURBONSA-N 0 3 403.567 4.135 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3cccc(Cl)c3Cl)CC2)C[C@@H](C)O1 ZINC000518316871 927180150 /nfs/dbraw/zinc/18/01/50/927180150.db2.gz ZJBUVVFJDLYYNF-ZIAGYGMSSA-N 0 3 400.350 4.347 20 0 HIADHN CN(CCCCCc1cc(-c2ccccc2)n[nH]1)CC(=O)N1CCc2ccccc2C1 ZINC000518334573 927198800 /nfs/dbraw/zinc/19/88/00/927198800.db2.gz ZWAOFXVIMLDIRV-UHFFFAOYSA-N 0 3 416.569 4.306 20 0 HIADHN Cc1ccc(-c2noc([C@H](C)NC[C@H]3CN(Cc4ccccc4)CCCO3)n2)cc1F ZINC000518348989 927211737 /nfs/dbraw/zinc/21/17/37/927211737.db2.gz KCXWJXRVSMSCLE-RXVVDRJESA-N 0 3 424.520 4.126 20 0 HIADHN CCOc1ccc([C@H]2CCCN2C(=O)CCCN2CCN(c3ccccc3)CC2)cc1 ZINC000518356894 927217886 /nfs/dbraw/zinc/21/78/86/927217886.db2.gz DDCGRJIARNZLSI-RUZDIDTESA-N 0 3 421.585 4.351 20 0 HIADHN COc1ccc([C@H]2CCCN2C(=O)NC[C@H](C)N(C)Cc2ccccc2)cc1OC ZINC000518441391 927272987 /nfs/dbraw/zinc/27/29/87/927272987.db2.gz IWUYJMJADIFFMX-GHTZIAJQSA-N 0 3 411.546 4.071 20 0 HIADHN CC[C@@H](Oc1ccccc1C(C)C)C(=O)NCc1ccc(CN2CCN(C)CC2)cc1 ZINC000518508808 927316136 /nfs/dbraw/zinc/31/61/36/927316136.db2.gz DLLWNXYSIMPHQY-XMMPIXPASA-N 0 3 423.601 4.031 20 0 HIADHN Cc1ccc(C(=O)NCCNCc2cn(-c3ccccc3)nc2-c2ccccc2)cc1 ZINC000518512279 927318137 /nfs/dbraw/zinc/31/81/37/927318137.db2.gz QAVFJGXACVHULI-UHFFFAOYSA-N 0 3 410.521 4.367 20 0 HIADHN Cc1nn(Cc2ccc(C)cc2)c(C)c1CCC(=O)N1CCN(CCC(C)(C)C)CC1 ZINC000518545889 927337887 /nfs/dbraw/zinc/33/78/87/927337887.db2.gz KDHOQSZJELNURZ-UHFFFAOYSA-N 0 3 424.633 4.370 20 0 HIADHN CCN(CC)[C@H](CNC(=O)C(=O)Nc1ccc2c3c(cccc31)CC2)c1ccccc1 ZINC000518579817 927359710 /nfs/dbraw/zinc/35/97/10/927359710.db2.gz XOKMTKOEERAFNJ-HSZRJFAPSA-N 0 3 415.537 4.076 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)c3cnc(-c4ccccc4F)s3)cc2)CC1 ZINC000518615341 927381615 /nfs/dbraw/zinc/38/16/15/927381615.db2.gz NDAYQYMGWUDHEJ-UHFFFAOYSA-N 0 3 424.545 4.339 20 0 HIADHN COc1ccccc1[C@@H](NC(=O)N(CCN(C)C)Cc1ccc(C)o1)c1ccccc1 ZINC000518703627 927445979 /nfs/dbraw/zinc/44/59/79/927445979.db2.gz VDNHKPHQIBGTSD-DEOSSOPVSA-N 0 3 421.541 4.459 20 0 HIADHN CCn1c(CN[C@H](C)c2cc(F)ccc2N2CCN(CC)CC2)nc2ccccc21 ZINC000518775976 927487968 /nfs/dbraw/zinc/48/79/68/927487968.db2.gz OLAWWOHMOOTTPX-GOSISDBHSA-N 0 3 409.553 4.188 20 0 HIADHN O=C1C[C@@H](NCc2ccc(OCc3ccncc3)cc2)CN1c1ccccc1Cl ZINC000518791950 927494416 /nfs/dbraw/zinc/49/44/16/927494416.db2.gz MSSQPVCJXVVYMZ-LJQANCHMSA-N 0 3 407.901 4.209 20 0 HIADHN Cc1ccncc1CCCN1CC(C(=O)N2CC(C)(C)c3ccc(NC4CC4)cc32)C1 ZINC000518797919 927499019 /nfs/dbraw/zinc/49/90/19/927499019.db2.gz ZCPAJTDKWCJECV-UHFFFAOYSA-N 0 3 418.585 4.153 20 0 HIADHN C[C@@H](CCc1ccco1)NC(=O)N(CCN(C)C)Cc1ccc(C(F)(F)F)cc1 ZINC000518868316 927578764 /nfs/dbraw/zinc/57/87/64/927578764.db2.gz FYQOKGJEXYGDHR-INIZCTEOSA-N 0 3 411.468 4.393 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cccc(NC(C)=O)c1)c1ccc(C(F)(F)F)cc1 ZINC000518887815 927598261 /nfs/dbraw/zinc/59/82/61/927598261.db2.gz DHCIJVCXXXOZOF-HXUWFJFHSA-N 0 3 421.463 4.477 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)NCCCSc1ccc(F)cc1 ZINC000518902999 927614071 /nfs/dbraw/zinc/61/40/71/927614071.db2.gz PXVYXXWPUUNITF-UHFFFAOYSA-N 0 3 415.578 4.027 20 0 HIADHN CC(C)Oc1ccc([C@H](C)NC(=O)CCCN2CCN(c3ccccc3)CC2)cc1 ZINC000518907051 927616735 /nfs/dbraw/zinc/61/67/35/927616735.db2.gz JTTOOFXEIMSBFO-NRFANRHFSA-N 0 3 409.574 4.253 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCc3ccccc3COC(C)C)c(C)c2)CC1 ZINC000519005739 927685926 /nfs/dbraw/zinc/68/59/26/927685926.db2.gz ZFFMSYDKDVEWSL-UHFFFAOYSA-N 0 3 424.589 4.384 20 0 HIADHN COc1ccccc1CN(C(=O)NCC(C)(C)N1CCc2ccccc2C1)C1CC1 ZINC000519044769 927721908 /nfs/dbraw/zinc/72/19/08/927721908.db2.gz QJLRBDGKGZEFQN-UHFFFAOYSA-N 0 3 407.558 4.206 20 0 HIADHN CC[C@@H](C)NC(=O)c1ccc(NC(=O)N2CCN(CCC(C)(C)C)CC2)c(C)c1 ZINC000519053885 927732137 /nfs/dbraw/zinc/73/21/37/927732137.db2.gz XUBCVMXMVLPZLX-GOSISDBHSA-N 0 3 402.583 4.109 20 0 HIADHN CN(C)CCN(C[C@H]1CCCO1)C(=O)c1ccc(COc2ccc3ccccc3c2)o1 ZINC000519148609 927805177 /nfs/dbraw/zinc/80/51/77/927805177.db2.gz PLHYGYVKIXWTJB-JOCHJYFZSA-N 0 3 422.525 4.195 20 0 HIADHN Cc1cc(OC(C)C)ccc1NC(=O)N1CCN(CCN(C)Cc2ccccc2)CC1 ZINC000519185056 927816089 /nfs/dbraw/zinc/81/60/89/927816089.db2.gz XNCGTLHHHDECHP-UHFFFAOYSA-N 0 3 424.589 4.064 20 0 HIADHN COCc1cccc2sc(NC(=O)NC[C@H](c3ccccc3)N3CCCC3)nc21 ZINC000519195569 927821722 /nfs/dbraw/zinc/82/17/22/927821722.db2.gz IYPLLKIPBVOTDR-GOSISDBHSA-N 0 3 410.543 4.401 20 0 HIADHN COCCN1CCC(NC(=O)Nc2ccc(OCc3cccc(C)c3)cc2C)CC1 ZINC000519262852 927853834 /nfs/dbraw/zinc/85/38/34/927853834.db2.gz YKUSGFPCGMNBIZ-UHFFFAOYSA-N 0 3 411.546 4.115 20 0 HIADHN Cc1nc(CCC(=O)N(CCN(C)C)Cc2cccc(F)c2)oc1-c1ccccc1 ZINC000519296043 927868666 /nfs/dbraw/zinc/86/86/66/927868666.db2.gz UGRVFUKXMLBXFD-UHFFFAOYSA-N 0 3 409.505 4.312 20 0 HIADHN O=C(NCCc1cccc2cccnc21)NC[C@H]1CCCCN1Cc1ccccc1 ZINC000519307391 927873895 /nfs/dbraw/zinc/87/38/95/927873895.db2.gz JJUWMGZUDYZJSN-HSZRJFAPSA-N 0 3 402.542 4.131 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N2CCC(c3nc4ccccc4[nH]3)CC2)N(C)C)cc1 ZINC000519344982 927890614 /nfs/dbraw/zinc/89/06/14/927890614.db2.gz MDGXEARGRXHORB-JOCHJYFZSA-N 0 3 405.546 4.063 20 0 HIADHN C[C@@H]1C[C@H]1C(=O)Nc1cccc(C(=O)N(CCN(C)C)Cc2cccc(Cl)c2)c1 ZINC000519418200 927935122 /nfs/dbraw/zinc/93/51/22/927935122.db2.gz JLRJKFYOWAOAEB-IIBYNOLFSA-N 0 3 413.949 4.139 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)c1[nH]c2ccccc2c1Br ZINC000519418724 927935244 /nfs/dbraw/zinc/93/52/44/927935244.db2.gz PFYWTAPLGPVQFL-UHFFFAOYSA-N 0 3 400.320 4.134 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCCc1ccc2ccccc2n1)c1cccc(OC)c1 ZINC000519466859 927969183 /nfs/dbraw/zinc/96/91/83/927969183.db2.gz QDSYSUQMQFCGPB-DEOSSOPVSA-N 0 3 420.557 4.168 20 0 HIADHN CCCCN1CCCC[C@@H]1CNC(=O)N1CCC(C(=O)c2cc(F)ccc2F)CC1 ZINC000519480460 927978316 /nfs/dbraw/zinc/97/83/16/927978316.db2.gz AUWFDSXAWDTUBG-LJQANCHMSA-N 0 3 421.532 4.224 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2ccc(C)c(C(=O)NC(C)C)c2)N2CCCC2)cc1 ZINC000519498269 927992080 /nfs/dbraw/zinc/99/20/80/927992080.db2.gz AADAOAZWDQXLCS-QHCPKHFHSA-N 0 3 422.573 4.400 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)N[C@@H]1CCSc2ccc(F)cc21 ZINC000519502343 927995674 /nfs/dbraw/zinc/99/56/74/927995674.db2.gz OAOZEFUIPGGILH-LJQANCHMSA-N 0 3 423.504 4.414 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCCc3ccc4ccccc4n3)c(C)c2)CC1 ZINC000519503838 927996750 /nfs/dbraw/zinc/99/67/50/927996750.db2.gz LTGPLPUSLJBLQK-UHFFFAOYSA-N 0 3 417.557 4.049 20 0 HIADHN C[C@H](Cc1ccc(O)cc1)NC(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1 ZINC000519506456 927997962 /nfs/dbraw/zinc/99/79/62/927997962.db2.gz NBYCOJFEWVKUSA-MRXNPFEDSA-N 0 3 423.479 4.115 20 0 HIADHN Cc1cc(C(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)c(C)n1Cc1ccncc1 ZINC000519629822 928032949 /nfs/dbraw/zinc/03/29/49/928032949.db2.gz PUDJKQANOUGUCX-JOCHJYFZSA-N 0 3 410.949 4.234 20 0 HIADHN CN(C)C(=O)COc1cccc(CN[C@H](c2cccc(OC(F)(F)F)c2)C2CC2)c1 ZINC000519634193 928033421 /nfs/dbraw/zinc/03/34/21/928033421.db2.gz JGJTURORQXAGHX-NRFANRHFSA-N 0 3 422.447 4.293 20 0 HIADHN C[C@H](NC(=O)C(C)(C)c1csc(-c2cc(F)ccc2F)n1)C1=CCN(C)CC1 ZINC000519760785 928067319 /nfs/dbraw/zinc/06/73/19/928067319.db2.gz COPHXRKXSXDASD-ZDUSSCGKSA-N 0 3 405.514 4.133 20 0 HIADHN C[C@@H]1C[C@@H]1N1CCN(C(=O)c2ccccc2SCc2cscn2)C[C@@H](C)C1 ZINC000519765346 928069160 /nfs/dbraw/zinc/06/91/60/928069160.db2.gz HTIAJEVLMKQJBB-FCEWJHQRSA-N 0 3 401.601 4.238 20 0 HIADHN CCC(=O)Nc1ccc(Cl)c(NC(=O)NCCCN2CCc3ccccc3C2)c1 ZINC000519766638 928069793 /nfs/dbraw/zinc/06/97/93/928069793.db2.gz GTTUVPRVUOIHNF-UHFFFAOYSA-N 0 3 414.937 4.258 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N(CCOC)[C@@H](C)c3ccccc3)c(C)c2)CC1 ZINC000519908506 928141159 /nfs/dbraw/zinc/14/11/59/928141159.db2.gz AVECDWQWYFDNGY-NRFANRHFSA-N 0 3 424.589 4.378 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N2CCO[C@H](c3ccc(F)cc3)C2)N2CCCC2)cc1 ZINC000519936006 928169118 /nfs/dbraw/zinc/16/91/18/928169118.db2.gz ZUECQXUIZQQVHQ-GOTSBHOMSA-N 0 3 411.521 4.054 20 0 HIADHN CCN(Cc1ccc2c(c1)OCO2)C(=O)NC[C@H](c1ccc(C)cc1)N1CCCC1 ZINC000519935871 928169662 /nfs/dbraw/zinc/16/96/62/928169662.db2.gz HJWFWTHGPFIJEO-OAQYLSRUSA-N 0 3 409.530 4.092 20 0 HIADHN COc1ccc(COC[C@H](O)CN2CCC[C@@H]2Cc2c(F)cccc2Cl)cc1 ZINC000519968417 928197208 /nfs/dbraw/zinc/19/72/08/928197208.db2.gz DIQUZODESCLWPY-QZTJIDSGSA-N 0 3 407.913 4.072 20 0 HIADHN COCCOc1c(Cl)cccc1NC(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000520050760 928275318 /nfs/dbraw/zinc/27/53/18/928275318.db2.gz ANFBERYPTAOSTM-WMZOPIPTSA-N 0 3 417.937 4.322 20 0 HIADHN COCCOc1ccc(NC(=O)NC[C@H](c2ccc(C)cc2)N(C)C)cc1Cl ZINC000520054077 928279045 /nfs/dbraw/zinc/27/90/45/928279045.db2.gz RECIKDPILLTFKW-LJQANCHMSA-N 0 3 405.926 4.098 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N[C@H](c2ccc3c(c2)OCCO3)C(C)C)N(C)C)cc1 ZINC000520067743 928291462 /nfs/dbraw/zinc/29/14/62/928291462.db2.gz FNWVBVKCZKNTMU-REWPJTCUSA-N 0 3 411.546 4.065 20 0 HIADHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)c1cc2cc(F)ccc2[nH]1 ZINC000520105569 928314131 /nfs/dbraw/zinc/31/41/31/928314131.db2.gz CBGVYTBVZWXPBY-UHFFFAOYSA-N 0 3 418.310 4.274 20 0 HIADHN CCOc1cc2c(cc1NC(=O)N(CCN(C)C)Cc1cccc(F)c1)O[C@@H](C)C2 ZINC000520131221 928328747 /nfs/dbraw/zinc/32/87/47/928328747.db2.gz YXZYAOHCSYZNKX-INIZCTEOSA-N 0 3 415.509 4.144 20 0 HIADHN CC(C)CN(Cc1ccccc1)C(=O)NCCCCN1CCN(c2ccccc2)CC1 ZINC000520160397 928352424 /nfs/dbraw/zinc/35/24/24/928352424.db2.gz PZENCPMSPWZSSH-UHFFFAOYSA-N 0 3 422.617 4.457 20 0 HIADHN CC(=O)Nc1ccc(OC[C@@H](O)CN(C)[C@@H](C)c2ccc(Cl)c(Cl)c2)cc1 ZINC000520173258 928363021 /nfs/dbraw/zinc/36/30/21/928363021.db2.gz ZZZNLKUOQGURRD-GUYCJALGSA-N 0 3 411.329 4.385 20 0 HIADHN CC[C@H](c1ccccc1)N(CC)CC(=O)NCc1ccc(C(=O)N2CCCC2)cc1 ZINC000520174562 928364464 /nfs/dbraw/zinc/36/44/64/928364464.db2.gz PCHIQHXCNQNWTJ-HSZRJFAPSA-N 0 3 407.558 4.012 20 0 HIADHN C[C@@H](CC(=O)Nc1cccc(N2CCCC2)c1)NCc1cnn(Cc2ccccc2)c1 ZINC000520218594 928395103 /nfs/dbraw/zinc/39/51/03/928395103.db2.gz LXZKWDSAVMCJPF-FQEVSTJZSA-N 0 3 417.557 4.039 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N(Cc2ccco2)C[C@H]2CCCO2)N2CCCC2)cc1 ZINC000520285845 928447991 /nfs/dbraw/zinc/44/79/91/928447991.db2.gz WAICKNHHBJWHNT-PKTZIBPZSA-N 0 3 411.546 4.116 20 0 HIADHN Cc1ccc([C@H](CNC(=O)NCc2cc(Br)cs2)N2CCCC2)cc1 ZINC000520298778 928462119 /nfs/dbraw/zinc/46/21/19/928462119.db2.gz FFADTNNIDOGLDM-SFHVURJKSA-N 0 3 422.392 4.455 20 0 HIADHN C[C@H]1C[C@H]1c1ccc(CN(C(=O)CCCN2CCN(c3ccccc3)CC2)C2CC2)o1 ZINC000520306032 928466940 /nfs/dbraw/zinc/46/69/40/928466940.db2.gz LOAQTLFGJUAFMF-GBXCKJPGSA-N 0 3 421.585 4.496 20 0 HIADHN CCn1c2ccccc2nc1[C@@H](C)NC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000520309787 928472440 /nfs/dbraw/zinc/47/24/40/928472440.db2.gz QALHAARRCRLNPU-IEBWSBKVSA-N 0 3 408.521 4.285 20 0 HIADHN CN(C(=O)c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1)[C@H]1CCN(C2CC2)C1 ZINC000520318020 928479224 /nfs/dbraw/zinc/47/92/24/928479224.db2.gz YSIILHALXHURIN-KRWDZBQOSA-N 0 3 405.420 4.201 20 0 HIADHN C[C@H](CNC(=O)C1CCN(c2nc3ccccc3s2)CC1)N(C)Cc1ccccc1 ZINC000520328079 928493373 /nfs/dbraw/zinc/49/33/73/928493373.db2.gz JSWGRWQUEQEQBB-GOSISDBHSA-N 0 3 422.598 4.149 20 0 HIADHN COc1cc(C)c([C@@H](C)NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)cc1OC ZINC000520348533 928510961 /nfs/dbraw/zinc/51/09/61/928510961.db2.gz ZLRIUPWPMNRBGN-IEBWSBKVSA-N 0 3 414.521 4.241 20 0 HIADHN COCc1ccccc1CNC(=O)N(CCN(C)C)Cc1ccc(C(F)(F)F)cc1 ZINC000520416200 928554917 /nfs/dbraw/zinc/55/49/17/928554917.db2.gz NQSMQGVXTYHEEF-UHFFFAOYSA-N 0 3 423.479 4.125 20 0 HIADHN COc1ccc(CN(C(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)C2CC2)cc1 ZINC000520446957 928570356 /nfs/dbraw/zinc/57/03/56/928570356.db2.gz SSQGDBGUDLFKPA-UHFFFAOYSA-N 0 3 407.558 4.030 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)c1cncc(-c2ccc(N(C)C)cc2)c1)c1ccco1 ZINC000520448627 928570492 /nfs/dbraw/zinc/57/04/92/928570492.db2.gz MOXXEKOJEYNLDJ-VGSWGCGISA-N 0 3 406.530 4.267 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)NCCCO[C@@H](C)c3ccccc3)cc2)CC1 ZINC000520463326 928581351 /nfs/dbraw/zinc/58/13/51/928581351.db2.gz HWGYRUCWHWCBBK-NRFANRHFSA-N 0 3 409.574 4.115 20 0 HIADHN CCN1CCCC[C@H]1C(=O)NCc1ccccc1-c1ccc(Cn2ccnc2)cc1 ZINC000520567085 928644754 /nfs/dbraw/zinc/64/47/54/928644754.db2.gz JXCVYXWEMQIGQZ-DEOSSOPVSA-N 0 3 402.542 4.089 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N3CCC[C@@H](Cc4ccccc4)C3)cc2)CC1 ZINC000520688328 928736792 /nfs/dbraw/zinc/73/67/92/928736792.db2.gz HSBCSNBTQNXQLH-QHCPKHFHSA-N 0 3 405.586 4.312 20 0 HIADHN O=C(CN1CCCCC[C@H]1c1ccccc1)N1CCC(C(=O)Nc2ccccc2)CC1 ZINC000520788623 928819803 /nfs/dbraw/zinc/81/98/03/928819803.db2.gz NHUIRRSPEUJZON-DEOSSOPVSA-N 0 3 419.569 4.481 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N(C)Cc2cc(Br)cs2)N(C)C)cc1 ZINC000520889680 928860564 /nfs/dbraw/zinc/86/05/64/928860564.db2.gz QOXPPMSWAKYZCP-QGZVFWFLSA-N 0 3 410.381 4.263 20 0 HIADHN Cc1cc(NC(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)ccc1C(=O)NC(C)C ZINC000520903771 928867961 /nfs/dbraw/zinc/86/79/61/928867961.db2.gz XFBXLYMUVKQYGC-GHTZIAJQSA-N 0 3 408.546 4.090 20 0 HIADHN CCCCc1oc2ccccc2c1CNCc1ccc([C@]2(C)NC(=O)NC2=O)cc1 ZINC000520963541 928891914 /nfs/dbraw/zinc/89/19/14/928891914.db2.gz QJVZREIHRUMUHF-DEOSSOPVSA-N 0 3 405.498 4.120 20 0 HIADHN CCCOc1ccc(Cl)cc1NC(=O)N1CCC(CN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000521007501 928924414 /nfs/dbraw/zinc/92/44/14/928924414.db2.gz LATVQHPGCBHSEH-IRXDYDNUSA-N 0 3 423.985 4.482 20 0 HIADHN CCc1ccc(-c2nc(CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)cs2)cc1 ZINC000521106317 928998372 /nfs/dbraw/zinc/99/83/72/928998372.db2.gz JWZSJCJSOQHPNG-NRFANRHFSA-N 0 3 405.567 4.306 20 0 HIADHN CCN1CCCN(C(=O)c2ccc(NC(=O)c3cc(Cl)cc(Cl)c3)cc2)CC1 ZINC000521135563 929017377 /nfs/dbraw/zinc/01/73/77/929017377.db2.gz GLGQFNDJENTTQJ-UHFFFAOYSA-N 0 3 420.340 4.414 20 0 HIADHN CN(C)CCN(C(=O)CCCc1nc(-c2ccc(Cl)cc2)no1)c1ccccc1 ZINC000521182196 929048450 /nfs/dbraw/zinc/04/84/50/929048450.db2.gz HGQOFPKBKGPSOU-UHFFFAOYSA-N 0 3 412.921 4.308 20 0 HIADHN C[C@H](NC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1)c1nc(-c2ccncc2)cs1 ZINC000521357941 929177717 /nfs/dbraw/zinc/17/77/17/929177717.db2.gz DRWDLXIJKICGAV-LPHOPBHVSA-N 0 3 424.545 4.434 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)N(Cc1ccco1)Cc1ccco1 ZINC000521358198 929180014 /nfs/dbraw/zinc/18/00/14/929180014.db2.gz VAJUCACBGJLPHH-UHFFFAOYSA-N 0 3 407.514 4.004 20 0 HIADHN CN(C)[C@@H](CNC(=O)NCc1ccc(Oc2cccc(F)c2)nc1)c1ccccc1 ZINC000521453337 929228423 /nfs/dbraw/zinc/22/84/23/929228423.db2.gz SAAWULRBVSRGMH-NRFANRHFSA-N 0 3 408.477 4.115 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Cc3ccccc3C(F)(F)F)c(C)c2)CC1 ZINC000521451931 929229040 /nfs/dbraw/zinc/22/90/40/929229040.db2.gz LNELJKXZBAKQJW-UHFFFAOYSA-N 0 3 405.464 4.337 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2ccccc2CN2C[C@@H](C)O[C@@H](C)C2)N(C)C)cc1 ZINC000521463268 929232432 /nfs/dbraw/zinc/23/24/32/929232432.db2.gz IKOYODMOWQTFKZ-ROKPMTFOSA-N 0 3 424.589 4.029 20 0 HIADHN O=C(CN[C@H](c1cccc(C(F)(F)F)c1)C1CCOCC1)NCc1ccc(F)cc1 ZINC000521474142 929238584 /nfs/dbraw/zinc/23/85/84/929238584.db2.gz OIOJHOWWPJFLGL-NRFANRHFSA-N 0 3 424.438 4.218 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)N1CCn2cccc2[C@@H]1c1ccccc1 ZINC000521524191 929274954 /nfs/dbraw/zinc/27/49/54/929274954.db2.gz JODNYCKYLSBHCM-NOZRDPDXSA-N 0 3 414.553 4.440 20 0 HIADHN COc1ccc(Cl)cc1NCCC(=O)N[C@H](CN1CCCC1)c1ccccc1 ZINC000521532962 929278188 /nfs/dbraw/zinc/27/81/88/929278188.db2.gz GXPGPICJKCCCBA-HXUWFJFHSA-N 0 3 401.938 4.104 20 0 HIADHN CCN(C(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1)c1ccc(OC)c(OC)c1 ZINC000521531657 929278438 /nfs/dbraw/zinc/27/84/38/929278438.db2.gz CSAMFIBUTJOIIZ-SFHVURJKSA-N 0 3 400.494 4.108 20 0 HIADHN CC(C)n1ncc2c1nc(C1CC1)cc2C(=O)N(CCN(C)C)Cc1cccc(F)c1 ZINC000521570022 929303038 /nfs/dbraw/zinc/30/30/38/929303038.db2.gz XGGYJMCCEZEZIA-UHFFFAOYSA-N 0 3 423.536 4.233 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)c1cc2cc(Br)ccc2[nH]1 ZINC000521584303 929311957 /nfs/dbraw/zinc/31/19/57/929311957.db2.gz LCGJWTHFVOIFOW-UHFFFAOYSA-N 0 3 418.310 4.274 20 0 HIADHN CN(C)CCN(C[C@H]1CCCO1)C(=O)c1ccc(-c2ccc(OC(F)F)cc2)s1 ZINC000521618123 929330393 /nfs/dbraw/zinc/33/03/93/929330393.db2.gz MWSDXTVWCCPGBJ-QGZVFWFLSA-N 0 3 424.513 4.199 20 0 HIADHN CC(C)CN(CCc1ccccc1)CC(=O)NCC1(c2ccccc2)CCOCC1 ZINC000521813716 929471569 /nfs/dbraw/zinc/47/15/69/929471569.db2.gz RRQBBFJGSDUEII-UHFFFAOYSA-N 0 3 408.586 4.052 20 0 HIADHN Cc1cccc(OC(F)F)c1NC(=O)N(C)C1CCN(CCc2ccccn2)CC1 ZINC000521877240 929525807 /nfs/dbraw/zinc/52/58/07/929525807.db2.gz HIURMHILQYJLCQ-UHFFFAOYSA-N 0 3 418.488 4.162 20 0 HIADHN O=C(NC[C@H]1CN(Cc2ccccc2)CCCO1)N1CC[C@@H]1c1ccc(Cl)cc1 ZINC000521926374 929567685 /nfs/dbraw/zinc/56/76/85/929567685.db2.gz LBVYMSCSZVTUTI-FCHUYYIVSA-N 0 3 413.949 4.088 20 0 HIADHN CN(C)CCN(C(=O)c1nc(C2CC2)n(-c2ccccc2Cl)n1)C1CCCCC1 ZINC000522029632 929623806 /nfs/dbraw/zinc/62/38/06/929623806.db2.gz YGUSMEQVKKRSES-UHFFFAOYSA-N 0 3 415.969 4.135 20 0 HIADHN O=C(Nc1cccc(-c2ccc3c(c2)OCCO3)n1)c1cccc(CN2CCCC2)c1 ZINC000524562004 929689369 /nfs/dbraw/zinc/68/93/69/929689369.db2.gz GDNPRDATYKJMIL-UHFFFAOYSA-N 0 3 415.493 4.368 20 0 HIADHN CCOc1ccc(S(=O)(=O)N(C)[C@@H]2CCN(Cc3ccccc3)[C@@H](C)C2)c(C)c1 ZINC000524587704 929700701 /nfs/dbraw/zinc/70/07/01/929700701.db2.gz XZXLDGLPLLGLHA-PZJWPPBQSA-N 0 3 416.587 4.067 20 0 HIADHN Cc1cccc(-c2ccc(CNC(=O)N(CCN(C)C)Cc3ccccn3)cc2)c1 ZINC000524590965 929702082 /nfs/dbraw/zinc/70/20/82/929702082.db2.gz YEULVWWFAZIUGC-UHFFFAOYSA-N 0 3 402.542 4.330 20 0 HIADHN Cc1ccccc1[C@H]1C[C@@H](C)N(CC(=O)N2CCC(C(=O)Nc3ccccc3)CC2)C1 ZINC000524593659 929703755 /nfs/dbraw/zinc/70/37/55/929703755.db2.gz LENUGOBKEUVFSG-IRLDBZIGSA-N 0 3 419.569 4.050 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)NCc1csc(Br)c1 ZINC000524627397 929736120 /nfs/dbraw/zinc/73/61/20/929736120.db2.gz YFKWCGFHFJTGTF-OAHLLOKOSA-N 0 3 422.392 4.317 20 0 HIADHN CCCN(C(=O)NC[C@H](c1ccc(C)cc1)N1CCCC1)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000524628317 929737811 /nfs/dbraw/zinc/73/78/11/929737811.db2.gz RRXFNUBGWFKDEK-WBADGQHESA-N 0 3 413.606 4.367 20 0 HIADHN CC(C)CC(=O)Nc1ccc(C(=O)NC[C@H]2CCCN2Cc2ccccc2)cc1F ZINC000524664094 929779341 /nfs/dbraw/zinc/77/93/41/929779341.db2.gz NOYZNAVSWVOTKY-HXUWFJFHSA-N 0 3 411.521 4.205 20 0 HIADHN CC(C)CC(=O)Nc1ccc(C(=O)NC[C@@H]2CCCN2Cc2ccccc2)cc1F ZINC000524664093 929779605 /nfs/dbraw/zinc/77/96/05/929779605.db2.gz NOYZNAVSWVOTKY-FQEVSTJZSA-N 0 3 411.521 4.205 20 0 HIADHN C[C@H]1CCN(CCNC(=O)c2cccnc2Sc2ccc(Br)cc2)C1 ZINC000524719791 929809250 /nfs/dbraw/zinc/80/92/50/929809250.db2.gz LBVJERQQGUVYPK-AWEZNQCLSA-N 0 3 420.376 4.067 20 0 HIADHN Cc1ccc(C)c(SCC(=O)NC2CCN(CCOc3ccc(F)cc3)CC2)c1 ZINC000524837372 929853137 /nfs/dbraw/zinc/85/31/37/929853137.db2.gz LWOZQMAXNLMSKF-UHFFFAOYSA-N 0 3 416.562 4.194 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)CCc1ccc(OC(F)F)cc1 ZINC000524864280 929864017 /nfs/dbraw/zinc/86/40/17/929864017.db2.gz JSMHODXKNKYRBK-SFHVURJKSA-N 0 3 402.485 4.344 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)CCCOc1ccc(F)cc1F ZINC000524866563 929864564 /nfs/dbraw/zinc/86/45/64/929864564.db2.gz DDLDCJUWUPOYQI-GOSISDBHSA-N 0 3 402.485 4.247 20 0 HIADHN CCCN(Cc1nnc(-c2ccc(Br)o2)o1)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000524893040 929876783 /nfs/dbraw/zinc/87/67/83/929876783.db2.gz XJRBPEGWEGDKFM-LYRGGWFBSA-N 0 3 410.312 4.118 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)c(Cl)c1 ZINC000524896054 929877509 /nfs/dbraw/zinc/87/75/09/929877509.db2.gz FAAYOQHQCDRZFV-MRXNPFEDSA-N 0 3 414.937 4.427 20 0 HIADHN CCC(=O)Nc1ccc(C)c(NC(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)c1 ZINC000524897089 929878227 /nfs/dbraw/zinc/87/82/27/929878227.db2.gz JQPDAWOBGAYFSA-LJQANCHMSA-N 0 3 408.546 4.472 20 0 HIADHN CCCN(Cc1ccc(OC)c(OC)c1Br)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000524908106 929884021 /nfs/dbraw/zinc/88/40/21/929884021.db2.gz NHPDEAQZCHJPKN-GDIGMMSISA-N 0 3 412.368 4.492 20 0 HIADHN CCCNC(=O)c1cccc(C(=O)N(CC)[C@H]2CCN([C@@H](C)c3ccccc3)C2)c1 ZINC000524939925 929900486 /nfs/dbraw/zinc/90/04/86/929900486.db2.gz CQMCJZFMTYGNKV-CVDCTZTESA-N 0 3 407.558 4.124 20 0 HIADHN COc1ccc(NC(=O)[C@H](N[C@@H]2[C@H]3CCO[C@H]3C2(C)C)c2ccccc2)cc1Cl ZINC000524944427 929907316 /nfs/dbraw/zinc/90/73/16/929907316.db2.gz FIBXPCZPRPPOLS-QYRPDUKASA-N 0 3 414.933 4.432 20 0 HIADHN CN(C)Cc1cccc(C(=O)N2CCC[C@@H]2C(=O)Nc2cc(Cl)cc(Cl)c2)c1 ZINC000524975324 929939540 /nfs/dbraw/zinc/93/95/40/929939540.db2.gz NECYLQBDXQMRKI-LJQANCHMSA-N 0 3 420.340 4.298 20 0 HIADHN CN(C)Cc1cccc(C(=O)Nc2ccc(Oc3ccc(S(C)(=O)=O)cc3)cc2)c1 ZINC000524977371 929943224 /nfs/dbraw/zinc/94/32/24/929943224.db2.gz JMKNCBRYPTYSFV-UHFFFAOYSA-N 0 3 424.522 4.196 20 0 HIADHN CN(C(=O)c1ccc(COc2ccccc2Br)cc1)[C@H]1CCCN(C)C1 ZINC000525010556 929972253 /nfs/dbraw/zinc/97/22/53/929972253.db2.gz XMEDWQBQCZYBEI-SFHVURJKSA-N 0 3 417.347 4.194 20 0 HIADHN C[C@H](CNC(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1)Cc1cccs1 ZINC000525016457 929977061 /nfs/dbraw/zinc/97/70/61/929977061.db2.gz MHZSLHUXCPVHIZ-JXFKEZNVSA-N 0 3 410.505 4.498 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2cccc3ccccc32)cc1)[C@H]1CCCN(C)C1 ZINC000525066575 930013284 /nfs/dbraw/zinc/01/32/84/930013284.db2.gz TZPVJEJJYDTWRF-NRFANRHFSA-N 0 3 401.510 4.258 20 0 HIADHN CC[C@](C)(NC(=O)c1ccc(N2CCN(C(C)C)CC2)cc1)c1nc(C)cs1 ZINC000525065990 930013291 /nfs/dbraw/zinc/01/32/91/930013291.db2.gz AAIAFQHXFZOIOC-QFIPXVFZSA-N 0 3 400.592 4.037 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2ccc(C(F)(F)F)cc2)cc1)[C@H]1CCCN(C)C1 ZINC000525065969 930013532 /nfs/dbraw/zinc/01/35/32/930013532.db2.gz FKMUIYFVEXHEJX-IBGZPJMESA-N 0 3 419.447 4.124 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)c2ccc(C(=O)NCC(C)(C)C)cc2)N(C)C)cc1 ZINC000525071530 930017776 /nfs/dbraw/zinc/01/77/76/930017776.db2.gz WZFRNVCZZNMMBP-JOCHJYFZSA-N 0 3 409.574 4.058 20 0 HIADHN C[C@H](C(=O)Nc1cccc(N2CCCC2=O)c1)N1CC[C@H](c2ccccc2)[C@H](C)C1 ZINC000525122406 930049000 /nfs/dbraw/zinc/04/90/00/930049000.db2.gz FPUQAGIZWBDXMW-PWHSHALESA-N 0 3 405.542 4.266 20 0 HIADHN COc1ccc2c(c1)[C@H](N(CCC(=O)NC1CCCC1)Cc1ccccc1)CCO2 ZINC000525124719 930050142 /nfs/dbraw/zinc/05/01/42/930050142.db2.gz GJAXTFRUASBSJZ-HSZRJFAPSA-N 0 3 408.542 4.470 20 0 HIADHN CCCN(CCN(C)C)C(=O)c1cc2c(C)nn(-c3ccc(Cl)cc3)c2s1 ZINC000525162938 930072760 /nfs/dbraw/zinc/07/27/60/930072760.db2.gz FJTJLHDNGNGXND-UHFFFAOYSA-N 0 3 404.967 4.463 20 0 HIADHN Cc1cccn2c(CNC3(c4cccc(Br)c4)CCOCC3)cnc12 ZINC000525182716 930078858 /nfs/dbraw/zinc/07/88/58/930078858.db2.gz SVPZVCPEXAEUST-UHFFFAOYSA-N 0 3 400.320 4.201 20 0 HIADHN C[C@H](CC(=O)c1cccc(Br)c1)C(=O)NCC(C)(C)N1CCC[C@@H](C)C1 ZINC000525241151 930101565 /nfs/dbraw/zinc/10/15/65/930101565.db2.gz SJKFOMKIPVBOAC-HZPDHXFCSA-N 0 3 423.395 4.285 20 0 HIADHN CSc1ccc(O[C@@H](C)C(=O)N(CCN(C)C)Cc2ccc(F)cc2F)cc1 ZINC000525350428 930189496 /nfs/dbraw/zinc/18/94/96/930189496.db2.gz OVPXORGHTXGFAC-HNNXBMFYSA-N 0 3 408.514 4.044 20 0 HIADHN Cc1ccc(S[C@@H](C)C(=O)NC2CCN(CCOc3ccc(F)cc3)CC2)cc1 ZINC000525351858 930190241 /nfs/dbraw/zinc/19/02/41/930190241.db2.gz NMXDHDNWWCJAJF-SFHVURJKSA-N 0 3 416.562 4.274 20 0 HIADHN COc1ccc(SCCC(=O)N[C@@H](CN2CCCC2)c2ccccc2)cc1OC ZINC000525370099 930201377 /nfs/dbraw/zinc/20/13/77/930201377.db2.gz BUOTVGMKMQOFPL-FQEVSTJZSA-N 0 3 414.571 4.139 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)c1cc(C2CC2)nn1-c1ccccc1 ZINC000525381553 930208200 /nfs/dbraw/zinc/20/82/00/930208200.db2.gz UXZNKRYLMNZDJZ-HXUWFJFHSA-N 0 3 414.553 4.486 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)Cc1ccccc1Br ZINC000525384603 930211359 /nfs/dbraw/zinc/21/13/59/930211359.db2.gz GZNBWEGVXXJSFL-KRWDZBQOSA-N 0 3 401.348 4.115 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCc1nc(C(F)(F)F)cs1)c1ccsc1 ZINC000525395245 930217160 /nfs/dbraw/zinc/21/71/60/930217160.db2.gz XBNAPOITNMLSMR-GFCCVEGCSA-N 0 3 406.499 4.106 20 0 HIADHN CC(C)(CNC(=O)C(=O)Nc1cccc(CSC2CCCC2)c1)N1CCCCC1 ZINC000525435286 930238221 /nfs/dbraw/zinc/23/82/21/930238221.db2.gz VQPYBWOHDCCHKX-UHFFFAOYSA-N 0 3 417.619 4.182 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1cccc(N2CCCCC2=O)c1 ZINC000525445319 930244157 /nfs/dbraw/zinc/24/41/57/930244157.db2.gz JJGPBCUKXAPJOG-HXUWFJFHSA-N 0 3 420.557 4.332 20 0 HIADHN CCC(CC)[C@H](NC(=O)NC[C@@]1(O)CCN(Cc2ccccc2)C1)c1cccs1 ZINC000525497381 930284326 /nfs/dbraw/zinc/28/43/26/930284326.db2.gz PIMDKOJAEAKQQE-GMAHTHKFSA-N 0 3 415.603 4.162 20 0 HIADHN Cc1ccc(-c2nc3cc(F)ccc3n2C)cc1NC(=O)NCCN1CCCCC1 ZINC000525507641 930291429 /nfs/dbraw/zinc/29/14/29/930291429.db2.gz PYQLTIWRZTVTJE-UHFFFAOYSA-N 0 3 409.509 4.295 20 0 HIADHN Cc1cccc(-c2nn(-c3ccc(F)cc3)cc2C(=O)N(C)[C@H]2CCCN(C)C2)c1 ZINC000525522985 930300806 /nfs/dbraw/zinc/30/08/06/930300806.db2.gz KFGDZBFRMRHSGX-NRFANRHFSA-N 0 3 406.505 4.153 20 0 HIADHN Cc1ccccc1-c1cc(C(=O)N(C)[C@@H]2CCCN(C)C2)c2cnn(C(C)C)c2n1 ZINC000525525632 930302632 /nfs/dbraw/zinc/30/26/32/930302632.db2.gz VIHFUNLYXCLPIK-GOSISDBHSA-N 0 3 405.546 4.154 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)[C@H]1C[C@H]1c1cccc(F)c1F ZINC000525542259 930315571 /nfs/dbraw/zinc/31/55/71/930315571.db2.gz HOHFPZFRDYVEPT-OALUTQOASA-N 0 3 402.510 4.298 20 0 HIADHN CN(C(=O)c1ccc(Oc2cccc(Cl)c2Cl)nc1)[C@@H]1CCN(C2CC2)C1 ZINC000525567247 930334119 /nfs/dbraw/zinc/33/41/19/930334119.db2.gz CQAAZETVZGNPCU-OAHLLOKOSA-N 0 3 406.313 4.489 20 0 HIADHN CN1CCC[C@H](CNC(=O)c2csc(Nc3ccccn3)n2)[C@@H]1c1cccs1 ZINC000525573554 930338320 /nfs/dbraw/zinc/33/83/20/930338320.db2.gz QFELUKXSKNNQEH-RDTXWAMCSA-N 0 3 413.572 4.156 20 0 HIADHN C[C@H](NC(=O)[C@H](C)N1CC[C@H](c2ccccc2)[C@H](C)C1)c1ccc2c(c1)OCCO2 ZINC000525635833 930375493 /nfs/dbraw/zinc/37/54/93/930375493.db2.gz SHMHOYBEMBAOAG-GHDARCQNSA-N 0 3 408.542 4.149 20 0 HIADHN CC(C)(C)OC(=O)Cc1cccc(NC(=O)NCCCN2CCc3ccccc3C2)c1 ZINC000525741494 930423364 /nfs/dbraw/zinc/42/33/64/930423364.db2.gz KXLRYJRIMMADOL-UHFFFAOYSA-N 0 3 423.557 4.141 20 0 HIADHN C[C@H]1CCN(C(=O)NCCc2ccc(OC(F)F)cc2)CCN1Cc1ccccc1 ZINC000525754224 930430384 /nfs/dbraw/zinc/43/03/84/930430384.db2.gz XXRNASASHVYVNP-SFHVURJKSA-N 0 3 417.500 4.137 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(OCC(=O)NC2CC2)cc1)c1ccc(OC(F)F)cc1 ZINC000525760706 930434186 /nfs/dbraw/zinc/43/41/86/930434186.db2.gz BJBHCGOLVSFUAO-LSDHHAIUSA-N 0 3 404.457 4.357 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(S(C)(=O)=O)cc1)c1ccc(OCc2cccnc2)cc1 ZINC000525953220 930493590 /nfs/dbraw/zinc/49/35/90/930493590.db2.gz WLBWEEXNKLILCL-ROUUACIJSA-N 0 3 410.539 4.476 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(OCc2cccnc2)cc1)c1ccc(S(C)(=O)=O)cc1 ZINC000525953221 930494102 /nfs/dbraw/zinc/49/41/02/930494102.db2.gz WLBWEEXNKLILCL-ZWKOTPCHSA-N 0 3 410.539 4.476 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)c1c[nH]c(=O)c2ccccc12 ZINC000526048298 930514731 /nfs/dbraw/zinc/51/47/31/930514731.db2.gz HYDNPKIUCLWXDO-UHFFFAOYSA-N 0 3 417.431 4.163 20 0 HIADHN COc1cc(CN(C)CCc2ccccn2)cc(Br)c1OC(F)F ZINC000526116678 930537997 /nfs/dbraw/zinc/53/79/97/930537997.db2.gz ZIPOTKUXHMBVMJ-UHFFFAOYSA-N 0 3 401.251 4.129 20 0 HIADHN COc1cc(Cl)ccc1NC(=O)COc1ccc(CN2[C@H](C)C[C@H]2C)cc1OC ZINC000526989374 930562932 /nfs/dbraw/zinc/56/29/32/930562932.db2.gz RKQHLSWPMPCQHS-HUUCEWRRSA-N 0 3 418.921 4.357 20 0 HIADHN COc1cc(Cl)ccc1NC(=O)COc1ccc(CN2[C@H](C)C[C@@H]2C)cc1OC ZINC000526989372 930563163 /nfs/dbraw/zinc/56/31/63/930563163.db2.gz RKQHLSWPMPCQHS-GASCZTMLSA-N 0 3 418.921 4.357 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)C(=O)Nc1cccc(-c2cccs2)c1 ZINC000527098395 930588929 /nfs/dbraw/zinc/58/89/29/930588929.db2.gz GGIOFAJIBUVFNE-UHFFFAOYSA-N 0 3 409.511 4.063 20 0 HIADHN C[C@@H](CC(=O)Nc1cccc(Br)c1)N[C@H]1CCOc2ccc(F)cc21 ZINC000527100437 930589591 /nfs/dbraw/zinc/58/95/91/930589591.db2.gz LPQCTBOBEBYWQB-SJCJKPOMSA-N 0 3 407.283 4.419 20 0 HIADHN COCC(=O)Nc1cccc(CN[C@@H](c2ccc(Br)s2)C2CC2)c1 ZINC000527123312 930597422 /nfs/dbraw/zinc/59/74/22/930597422.db2.gz PVDGHTKGWLFXIE-GOSISDBHSA-N 0 3 409.349 4.336 20 0 HIADHN Cc1c(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cnn1-c1ccc(C)cc1 ZINC000527194501 930609528 /nfs/dbraw/zinc/60/95/28/930609528.db2.gz FPZWUIYPLKQEAS-UHFFFAOYSA-N 0 3 420.479 4.024 20 0 HIADHN Cc1ccccc1[C@H]([C@H](C)NC(=O)C(=O)Nc1cccc(Cl)c1Cl)N(C)C ZINC000527206859 930612715 /nfs/dbraw/zinc/61/27/15/930612715.db2.gz FQLBUUUZAUYCKD-UGSOOPFHSA-N 0 3 408.329 4.048 20 0 HIADHN COc1cc(Br)cc(C)c1NC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000530409444 930703649 /nfs/dbraw/zinc/70/36/49/930703649.db2.gz CZYMVVLOQBXPPX-LPHOPBHVSA-N 0 3 418.335 4.333 20 0 HIADHN Cc1cc(C)n(-c2ccc(NC(=O)N[C@@H]3CCN(C)[C@H]3c3ccccc3)cc2F)n1 ZINC000530409927 930704852 /nfs/dbraw/zinc/70/48/52/930704852.db2.gz ZVYVVFSXRVUJOM-IRLDBZIGSA-N 0 3 407.493 4.195 20 0 HIADHN COC(=O)c1ccc(NC(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)c(F)c1 ZINC000530568708 930752829 /nfs/dbraw/zinc/75/28/29/930752829.db2.gz XOUOVBCRTDLTKF-GOSISDBHSA-N 0 3 419.522 4.269 20 0 HIADHN Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)CC1(N2CCOCC2)CCCC1 ZINC000530572860 930755141 /nfs/dbraw/zinc/75/51/41/930755141.db2.gz FBBLOCFIISMNQS-UHFFFAOYSA-N 0 3 421.541 4.221 20 0 HIADHN O=C(CC1(N2CCOCC2)CCCC1)N[C@@H](COCc1ccccc1)c1ccccc1 ZINC000530582527 930758517 /nfs/dbraw/zinc/75/85/17/930758517.db2.gz KWEDYDNREYZWRA-DEOSSOPVSA-N 0 3 422.569 4.096 20 0 HIADHN CN(C(=O)NCc1ncc(-c2ccccc2)o1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000530587048 930760556 /nfs/dbraw/zinc/76/05/56/930760556.db2.gz JKTMUMIICJMBKR-NRFANRHFSA-N 0 3 404.514 4.148 20 0 HIADHN Cc1[nH]c(=O)c(C(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)cc1-c1ccccc1 ZINC000530684511 930797516 /nfs/dbraw/zinc/79/75/16/930797516.db2.gz BJTZNISTIDUUGX-GHTZIAJQSA-N 0 3 401.510 4.328 20 0 HIADHN Brc1ccc(-c2nnc(C[NH2+]Cc3cccc(Br)c3)[n-]2)cc1 ZINC000530779966 930821824 /nfs/dbraw/zinc/82/18/24/930821824.db2.gz FZYPDEVWRODEFA-UHFFFAOYSA-N 0 3 422.124 4.287 20 0 HIADHN COc1ccccc1Oc1ccc(CNC(=O)CC2(N3CCOCC3)CCCC2)cc1 ZINC000530818857 930831133 /nfs/dbraw/zinc/83/11/33/930831133.db2.gz ABNYAVWBHKFHNN-UHFFFAOYSA-N 0 3 424.541 4.139 20 0 HIADHN CN(C)Cc1ccc(-c2noc([C@H]3CCCN(c4ncnc5sccc54)C3)n2)cc1 ZINC000530872681 930844745 /nfs/dbraw/zinc/84/47/45/930844745.db2.gz OGXLBWJURXLONB-KRWDZBQOSA-N 0 3 420.542 4.187 20 0 HIADHN CCN(CC)[C@@H](C(=O)N1CCC(c2cnc[nH]2)CC1)c1cccc(C(F)(F)F)c1 ZINC000530958203 930868430 /nfs/dbraw/zinc/86/84/30/930868430.db2.gz GGXHVWQSBIPIBV-LJQANCHMSA-N 0 3 408.468 4.218 20 0 HIADHN CC(C)C1CCC(N2CCN(C(=O)N[C@H](c3nccn3C)c3ccccc3)CC2)CC1 ZINC000530996897 930880135 /nfs/dbraw/zinc/88/01/35/930880135.db2.gz NTJAWMXPMUYOIJ-SDVLMSEASA-N 0 3 423.605 4.052 20 0 HIADHN CC(C)c1c(C(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)cnn1-c1ccccn1 ZINC000531066964 930904907 /nfs/dbraw/zinc/90/49/07/930904907.db2.gz TWABINIUWGMXMI-NRFANRHFSA-N 0 3 417.557 4.127 20 0 HIADHN COC(=O)c1cc2c(o1)c(OC)ccc2CNCc1ccc(OC(F)F)c(OC)c1 ZINC000531141942 930941418 /nfs/dbraw/zinc/94/14/18/930941418.db2.gz YXKHKNHRDGCJSZ-UHFFFAOYSA-N 0 3 421.396 4.128 20 0 HIADHN CS(=O)(=O)c1ccc(CNCCOc2c(Cl)cc(Cl)cc2Cl)cc1 ZINC000531191500 930960029 /nfs/dbraw/zinc/96/00/29/930960029.db2.gz KTUYHQDOAJTWRU-UHFFFAOYSA-N 0 3 408.734 4.219 20 0 HIADHN O=C([C@H]1CCCN(Cc2cccnc2)C1)N1CCC[C@@H]1c1nc2cc(Cl)ccc2[nH]1 ZINC000531243707 930979654 /nfs/dbraw/zinc/97/96/54/930979654.db2.gz NGVQQYARMYJRKW-LAUBAEHRSA-N 0 3 423.948 4.187 20 0 HIADHN C[C@@H](NC(=O)CC1(N2CCOCC2)CCCC1)c1cc(F)c(Cl)cc1Cl ZINC000531282576 930999824 /nfs/dbraw/zinc/99/98/24/930999824.db2.gz VDJZJHFIOGDBRH-CYBMUJFWSA-N 0 3 403.325 4.345 20 0 HIADHN Cc1nnc(-c2cccc(C(=O)NC[C@H](c3ccccc3)N3CCC(C)CC3)c2)o1 ZINC000531284968 931000800 /nfs/dbraw/zinc/00/08/00/931000800.db2.gz ZZHFDCLFSMZIRB-JOCHJYFZSA-N 0 3 404.514 4.248 20 0 HIADHN CC[C@H](C(=O)Nc1ccc(OC)c(NC(=O)c2cccc(F)c2)c1)N(CC)CC ZINC000531289431 931002900 /nfs/dbraw/zinc/00/29/00/931002900.db2.gz CWWMBRLTVBELGX-LJQANCHMSA-N 0 3 401.482 4.146 20 0 HIADHN CN(C(=O)Nc1ccn(Cc2ccccc2)n1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000531314511 931013488 /nfs/dbraw/zinc/01/34/88/931013488.db2.gz YYQAUNKQCMUHFB-QFIPXVFZSA-N 0 3 403.530 4.060 20 0 HIADHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)c1cccc2[nH]ccc21 ZINC000531339257 931022926 /nfs/dbraw/zinc/02/29/26/931022926.db2.gz ZOXDEUVPHNMFPQ-UHFFFAOYSA-N 0 3 400.320 4.134 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2CNCC2(CS(C)(=O)=O)CC2)c(C)c1 ZINC000531445244 931059462 /nfs/dbraw/zinc/05/94/62/931059462.db2.gz IMQPLTWJCDVGCS-UHFFFAOYSA-N 0 3 423.582 4.071 20 0 HIADHN C[C@H](CCS(C)(=O)=O)NCc1cn(-c2ccccc2)nc1-c1cc2ccccc2o1 ZINC000531630854 931133712 /nfs/dbraw/zinc/13/37/12/931133712.db2.gz YDFDCCZVQRQPAJ-QGZVFWFLSA-N 0 3 423.538 4.198 20 0 HIADHN C[C@@H]1CN(C(=O)c2ccc(CNCc3cc(Cl)cc4cccnc43)cc2)C[C@H](C)O1 ZINC000531658641 931142271 /nfs/dbraw/zinc/14/22/71/931142271.db2.gz HANNUJXRMGTZLY-CALCHBBNSA-N 0 3 423.944 4.427 20 0 HIADHN Fc1ccc(OCc2noc([C@@]3(C(F)(F)F)CCN(Cc4ccccc4)C3)n2)cc1 ZINC000531687795 931153255 /nfs/dbraw/zinc/15/32/55/931153255.db2.gz NCTVSYSWPPADQH-HXUWFJFHSA-N 0 3 421.394 4.494 20 0 HIADHN Cc1c2ccccc2oc1[C@@H](C)NCc1ccc(CS(=O)(=O)NC(C)C)cc1 ZINC000531694781 931157271 /nfs/dbraw/zinc/15/72/71/931157271.db2.gz HVHXWFQMYNPGMV-QGZVFWFLSA-N 0 3 400.544 4.420 20 0 HIADHN Cc1nc(-c2ccc(CN[C@@H](C)c3cccc(NS(C)(=O)=O)c3)cc2)cs1 ZINC000531698222 931161047 /nfs/dbraw/zinc/16/10/47/931161047.db2.gz PCABUQMMUIWNMM-AWEZNQCLSA-N 0 3 401.557 4.341 20 0 HIADHN CCC[C@H](NCc1ccccc1CS(=O)(=O)NC(C)C)c1ccc(OC)cc1 ZINC000531703321 931165235 /nfs/dbraw/zinc/16/52/35/931165235.db2.gz UACREBRTTFZGOU-QFIPXVFZSA-N 0 3 404.576 4.154 20 0 HIADHN COc1ccc(NC(=O)C[C@H](C)N[C@H](c2ccc(F)cc2)[C@@H]2CCCO2)c(OC)c1 ZINC000531706789 931167339 /nfs/dbraw/zinc/16/73/39/931167339.db2.gz HXGOLXJTQDSJFO-RWAHWCJQSA-N 0 3 416.493 4.070 20 0 HIADHN CCC[C@H](N[C@@H](C)c1ccc2c(c1)CCC(=O)N2)C(=O)N1CCc2sccc2C1 ZINC000531710020 931169337 /nfs/dbraw/zinc/16/93/37/931169337.db2.gz IBFSNTOBNRUQBA-YWZLYKJASA-N 0 3 411.571 4.037 20 0 HIADHN CC(=O)N1CCC(N[C@@H](C)c2nc(-c3ccc(Br)cc3)cs2)CC1 ZINC000531733483 931177165 /nfs/dbraw/zinc/17/71/65/931177165.db2.gz YITSZZWOKJJAJJ-LBPRGKRZSA-N 0 3 408.365 4.234 20 0 HIADHN Clc1cccc2c1CC[C@H]2NCc1ccc(OCCN2CCOCC2)c(Cl)c1 ZINC000531835700 931213977 /nfs/dbraw/zinc/21/39/77/931213977.db2.gz XFZHRTSVKHTXMG-OAQYLSRUSA-N 0 3 421.368 4.482 20 0 HIADHN OCC[C@@]1(CNCc2c(Cl)cccc2OCc2ccccc2Cl)CCOC1 ZINC000531883814 931234147 /nfs/dbraw/zinc/23/41/47/931234147.db2.gz IPNYUPCRAIDNGM-NRFANRHFSA-N 0 3 410.341 4.451 20 0 HIADHN CCCCOc1ccc(CN[C@@H](C)c2cccc(NS(C)(=O)=O)c2)cc1OC ZINC000531936356 931253285 /nfs/dbraw/zinc/25/32/85/931253285.db2.gz QPCRAQFYPGZNRI-INIZCTEOSA-N 0 3 406.548 4.096 20 0 HIADHN COc1ccc(NC(=O)C[C@@H](C)NCc2ccc(F)cc2C(F)(F)F)c(OC)c1 ZINC000531937475 931254045 /nfs/dbraw/zinc/25/40/45/931254045.db2.gz BXPZZAYIRZAEBB-GFCCVEGCSA-N 0 3 414.399 4.369 20 0 HIADHN C[C@@H](CC(=O)Nc1ccccc1C(F)(F)F)NCc1cccc(N2CCCC2=O)c1 ZINC000531937828 931254142 /nfs/dbraw/zinc/25/41/42/931254142.db2.gz MGFAXJQOWOLAPG-HNNXBMFYSA-N 0 3 419.447 4.339 20 0 HIADHN COCC(=O)Nc1cccc(CN[C@@H](Cc2ccc(F)cc2)c2ccc(OC)cc2)c1 ZINC000531941969 931254833 /nfs/dbraw/zinc/25/48/33/931254833.db2.gz BICIDCMMGQGNIX-DEOSSOPVSA-N 0 3 422.500 4.493 20 0 HIADHN CC(C)C[C@@H](N[C@@H](C)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccccc1 ZINC000531947484 931259491 /nfs/dbraw/zinc/25/94/91/931259491.db2.gz OXPNCHXMNMXRMT-WMZHIEFXSA-N 0 3 416.587 4.146 20 0 HIADHN CC[C@H](N[C@H](C)c1cccc(S(=O)(=O)NC)c1)c1ccc(Br)cc1 ZINC000531965529 931268377 /nfs/dbraw/zinc/26/83/77/931268377.db2.gz HYZRVUZOCTYNAC-ACJLOTCBSA-N 0 3 411.365 4.159 20 0 HIADHN Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)NCc1ccc(N2CCN(C)CC2)nc1 ZINC000531989122 931277390 /nfs/dbraw/zinc/27/73/90/931277390.db2.gz DLLRWBUJYVXIHT-SFHVURJKSA-N 0 3 421.614 4.425 20 0 HIADHN COc1ccc(OC)c(NC(=O)C[C@@H](C)NCc2ccc(C)cc2OC(C)C)c1 ZINC000531992557 931279443 /nfs/dbraw/zinc/27/94/43/931279443.db2.gz NRAHZJRZDIMCKI-QGZVFWFLSA-N 0 3 400.519 4.306 20 0 HIADHN COc1cccc(CN[C@H]2CCN(c3ncc(C(F)(F)F)cc3Cl)C2)c1OC ZINC000532067033 931301988 /nfs/dbraw/zinc/30/19/88/931301988.db2.gz JHRHCLLLPQLMCZ-AWEZNQCLSA-N 0 3 415.843 4.140 20 0 HIADHN CC(C)N1CCN([C@H]2CCN(C(=O)[C@H](Sc3ccccc3)c3ccccc3)C2)CC1 ZINC000532088891 931307270 /nfs/dbraw/zinc/30/72/70/931307270.db2.gz HVIZMBFUVQKNSO-LADGPHEKSA-N 0 3 423.626 4.147 20 0 HIADHN CC(C)N1CCN([C@H]2CCN(C(=O)Nc3ccccc3Oc3ccccc3)C2)CC1 ZINC000532094713 931309704 /nfs/dbraw/zinc/30/97/04/931309704.db2.gz GUHFCDGNODFFMA-FQEVSTJZSA-N 0 3 408.546 4.111 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccnc2)C1)N1CCCC[C@H]1c1nc2ccccc2o1 ZINC000532153915 931329800 /nfs/dbraw/zinc/32/98/00/931329800.db2.gz WZLZGQZGMMNMGS-CTNGQTDRSA-N 0 3 404.514 4.189 20 0 HIADHN O=c1ccccn1Cc1ccc(CNCc2ccc(Br)c(F)c2)cc1 ZINC000532168399 931335132 /nfs/dbraw/zinc/33/51/32/931335132.db2.gz NCLNLONKDFDPSS-UHFFFAOYSA-N 0 3 401.279 4.088 20 0 HIADHN C[C@H](N[C@@H](C)c1cccc(N2CCCS2(=O)=O)c1)c1ccc(OC(F)F)cc1 ZINC000532197681 931345364 /nfs/dbraw/zinc/34/53/64/931345364.db2.gz XFTNNIPPIBZGAE-GJZGRUSLSA-N 0 3 410.486 4.240 20 0 HIADHN Fc1ccc(-c2nc3c(s2)[C@H](NCc2ccc(N4CCOCC4)nc2)CCC3)cc1 ZINC000532200316 931347561 /nfs/dbraw/zinc/34/75/61/931347561.db2.gz FURWUALBGNMVLW-LJQANCHMSA-N 0 3 424.545 4.348 20 0 HIADHN C[C@H](CCNCc1cc(Br)ccc1OCc1ccccc1)[S@@](C)=O ZINC000532207901 931350950 /nfs/dbraw/zinc/35/09/50/931350950.db2.gz PQXLYRXOGVBRSL-OYLFLEFRSA-N 0 3 410.377 4.275 20 0 HIADHN CC(C)COc1ccc([C@H](C)NCc2ccc(CS(=O)(=O)NC(C)C)cc2)cc1 ZINC000532207532 931351078 /nfs/dbraw/zinc/35/10/78/931351078.db2.gz WEGLFTNITMPGPN-IBGZPJMESA-N 0 3 418.603 4.400 20 0 HIADHN CC[C@H](N[C@@H](CC)c1ccccc1OCC(=O)N(C)C)c1ccc2c(c1)OCCO2 ZINC000532211781 931353979 /nfs/dbraw/zinc/35/39/79/931353979.db2.gz IMMDSVBETBYTMR-PMACEKPBSA-N 0 3 412.530 4.117 20 0 HIADHN Cc1c([C@H](C)N[C@H](C)c2ccc(NS(C)(=O)=O)cc2)cnn1-c1ccc(F)cc1 ZINC000532217992 931358014 /nfs/dbraw/zinc/35/80/14/931358014.db2.gz KPTWKKSSUZVFTF-CABCVRRESA-N 0 3 416.522 4.103 20 0 HIADHN CC[C@H](NC1CCN(C(=O)c2ccccc2Cl)CC1)c1nnc2n1CCCCC2 ZINC000532218436 931358288 /nfs/dbraw/zinc/35/82/88/931358288.db2.gz ZLUTWTUHEHYLID-IBGZPJMESA-N 0 3 415.969 4.003 20 0 HIADHN O=C1NC2(CCCCC2)C(=O)N1Cc1ccccc1CN[C@@H]1CCc2ccccc21 ZINC000532228683 931362510 /nfs/dbraw/zinc/36/25/10/931362510.db2.gz FUSIHKPMOPPELQ-JOCHJYFZSA-N 0 3 403.526 4.218 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(S(C)(=O)=O)cc1)c1ccc(NC(=O)c2ccncc2)cc1 ZINC000532229189 931363572 /nfs/dbraw/zinc/36/35/72/931363572.db2.gz XRDHXCFOYRPUIF-IRXDYDNUSA-N 0 3 423.538 4.149 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(NC(=O)c2ccncc2)cc1)c1ccc(S(C)(=O)=O)cc1 ZINC000532229177 931363749 /nfs/dbraw/zinc/36/37/49/931363749.db2.gz XRDHXCFOYRPUIF-DLBZAZTESA-N 0 3 423.538 4.149 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)N1CCc2cccc(Br)c2C1 ZINC000532305834 931392573 /nfs/dbraw/zinc/39/25/73/931392573.db2.gz CLVCBTLUPIQBBX-UHFFFAOYSA-N 0 3 413.315 4.455 20 0 HIADHN CN(C)CCN(C(=O)Nc1nnc(SCc2ccc(F)cc2)s1)C1CCCC1 ZINC000532327101 931397918 /nfs/dbraw/zinc/39/79/18/931397918.db2.gz FYCMRLPKPCPSTI-UHFFFAOYSA-N 0 3 423.583 4.308 20 0 HIADHN Cc1ccc(CNC(=O)c2cccc(CNCc3cccc(-n4cccn4)c3)c2)cc1 ZINC000532367314 931411539 /nfs/dbraw/zinc/41/15/39/931411539.db2.gz UBJFICGCKPESHK-UHFFFAOYSA-N 0 3 410.521 4.401 20 0 HIADHN CC[C@@H](N[C@H](C)c1ccc(NC(=O)C2CC2)cc1)c1ccccc1OCC(=O)N(C)C ZINC000532455182 931442675 /nfs/dbraw/zinc/44/26/75/931442675.db2.gz AUYTWERKPFVXDG-VGOFRKELSA-N 0 3 423.557 4.304 20 0 HIADHN C[C@H](NCCS(=O)(=O)c1ccccc1)[C@H](C)Oc1ccc(Cl)cc1Cl ZINC000532465011 931446837 /nfs/dbraw/zinc/44/68/37/931446837.db2.gz CXQPPJPNJHBRLK-KBPBESRZSA-N 0 3 402.343 4.213 20 0 HIADHN COc1cc([C@H](C)NCc2ccc(NC(=O)c3ccco3)cc2)cc(OC)c1OC ZINC000532471583 931450343 /nfs/dbraw/zinc/45/03/43/931450343.db2.gz JHZXREYNPSLQRK-HNNXBMFYSA-N 0 3 410.470 4.409 20 0 HIADHN Cc1cc(Br)c(NC(=O)CN(C)C2CCCC2)c(Br)c1 ZINC000532477441 931453696 /nfs/dbraw/zinc/45/36/96/931453696.db2.gz MBWAJSHOXSHTOB-UHFFFAOYSA-N 0 3 404.146 4.333 20 0 HIADHN CC[C@@H](N[C@@H](CN1CCN(C)CC1)c1ccccc1)c1ccccc1OC(F)F ZINC000532481120 931455718 /nfs/dbraw/zinc/45/57/18/931455718.db2.gz OXLKUMSYHOTUKE-RTWAWAEBSA-N 0 3 403.517 4.317 20 0 HIADHN C[C@H](N[C@@H](C)c1cc(F)ccc1N1CCN(C)CC1)c1ccc2c(c1)OCCCO2 ZINC000532483201 931456434 /nfs/dbraw/zinc/45/64/34/931456434.db2.gz WGCNAPBBOBOUGX-ROUUACIJSA-N 0 3 413.537 4.151 20 0 HIADHN CC(=O)NCC1CCN(Cc2c(-c3ccc(Cl)cc3)nc3sccn23)CC1 ZINC000532489040 931458155 /nfs/dbraw/zinc/45/81/55/931458155.db2.gz GTLBLWPHSKVIFT-UHFFFAOYSA-N 0 3 402.951 4.064 20 0 HIADHN C[C@H](N(C)CC(=O)N(Cc1nnc(-c2ccccc2Cl)o1)C1CC1)C(C)(C)C ZINC000532489120 931458243 /nfs/dbraw/zinc/45/82/43/931458243.db2.gz MGTDPWJMNYEMEW-AWEZNQCLSA-N 0 3 404.942 4.247 20 0 HIADHN C[C@@H](N[C@H](Cc1ccccc1)C(=O)N1CCCC1)c1ccc(Br)cc1 ZINC000532494870 931461072 /nfs/dbraw/zinc/46/10/72/931461072.db2.gz TXHVBYVFVWETQQ-OXQOHEQNSA-N 0 3 401.348 4.333 20 0 HIADHN C[C@@H](N[C@@H](CN1CCN(C)CC1)c1ccccc1)c1ccc(F)cc1OC(F)F ZINC000532497430 931461746 /nfs/dbraw/zinc/46/17/46/931461746.db2.gz XEHPVDUJZLNLKY-UZLBHIALSA-N 0 3 407.480 4.066 20 0 HIADHN C[C@@H](N[C@@H](CN1CCN(C)CC1)c1ccccc1)c1ccccc1OC(F)(F)F ZINC000532497772 931463317 /nfs/dbraw/zinc/46/33/17/931463317.db2.gz OHXUJWUQSJOONX-XLIONFOSSA-N 0 3 407.480 4.225 20 0 HIADHN COc1ccccc1C[C@H](C)N[C@@H](c1ccccc1)c1cccc(S(C)(=O)=O)c1 ZINC000532537625 931515450 /nfs/dbraw/zinc/51/54/50/931515450.db2.gz LBJSHVPVTRBEOO-UUOWRZLLSA-N 0 3 409.551 4.409 20 0 HIADHN Cc1ccc(CN[C@H](C)Cn2cc(Br)cn2)c(OCC(F)(F)F)c1 ZINC000532544620 931517352 /nfs/dbraw/zinc/51/73/52/931517352.db2.gz FDXLXSHVKRRDJQ-GFCCVEGCSA-N 0 3 406.246 4.073 20 0 HIADHN CCN(CC(=O)N1CCc2[nH]c3ccccc3c2C1)[C@H](C)Cc1ccc(OC)cc1 ZINC000532554328 931520582 /nfs/dbraw/zinc/52/05/82/931520582.db2.gz GQYKLFZQIWUCJJ-GOSISDBHSA-N 0 3 405.542 4.014 20 0 HIADHN O=C(CCN1CCC[C@H]1[C@@H](O)C(F)(F)F)Nc1ccccc1Oc1ccccc1 ZINC000532553282 931520706 /nfs/dbraw/zinc/52/07/06/931520706.db2.gz WIAKHIOSWJPHHQ-FXAWDEMLSA-N 0 3 408.420 4.195 20 0 HIADHN O[C@@H](CNCc1cnc(C2CCCC2)s1)COc1ccccc1Br ZINC000532627216 931560422 /nfs/dbraw/zinc/56/04/22/931560422.db2.gz FOLUUWAAXQYUET-AWEZNQCLSA-N 0 3 411.365 4.093 20 0 HIADHN O=C(CN[C@H](c1ccc(F)cc1)C1CCC1)N1CCC[C@@H]1c1ccc2c(c1)OCCO2 ZINC000532687626 931584929 /nfs/dbraw/zinc/58/49/29/931584929.db2.gz GVOPAZBYIOVOMG-BWKNWUBXSA-N 0 3 424.516 4.391 20 0 HIADHN COc1ccc([C@H](NCCOC[C@@H]2CCCO2)c2ccccc2)cc1Br ZINC000532697656 931592426 /nfs/dbraw/zinc/59/24/26/931592426.db2.gz LIWMOTFQERPJSI-GHTZIAJQSA-N 0 3 420.347 4.332 20 0 HIADHN C[C@@H]1CC[C@@H](C)N1[C@H]1CCCN(CCS(=O)(=O)c2cc(Cl)ccc2Cl)C1 ZINC000532700256 931593891 /nfs/dbraw/zinc/59/38/91/931593891.db2.gz NKZLUYAOJVJAFH-INMHGKMJSA-N 0 3 419.418 4.104 20 0 HIADHN CCCN(Cc1nccn1Cc1ccccc1)C1CCN(c2cc(C)nc(C)n2)CC1 ZINC000532710296 931601972 /nfs/dbraw/zinc/60/19/72/931601972.db2.gz CXJBEWQBVJEUJJ-UHFFFAOYSA-N 0 3 418.589 4.219 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)NCC(=O)Nc2ccc(Br)cc2)cc1 ZINC000532881704 931677374 /nfs/dbraw/zinc/67/73/74/931677374.db2.gz SYBSIJCJXQBDDW-CQSZACIVSA-N 0 3 413.319 4.233 20 0 HIADHN C[C@@H]1CN(C[C@@H]2CCCN2Cc2cccc(C(=O)Nc3ccccc3)c2)C[C@H](C)O1 ZINC000532929388 931700183 /nfs/dbraw/zinc/70/01/83/931700183.db2.gz LYNZKZOZZQKRDQ-ROKPMTFOSA-N 0 3 407.558 4.013 20 0 HIADHN CC[C@H](C)[C@@H](C)N(CC(=O)Nc1ccccc1I)C1CC1 ZINC000532966323 931717472 /nfs/dbraw/zinc/71/74/72/931717472.db2.gz FKBFCQHETOCAOP-QWHCGFSZSA-N 0 3 400.304 4.129 20 0 HIADHN CC(C)Cc1ncc(CNCCC(=O)N(C)Cc2ccccc2Br)s1 ZINC000532986888 931727056 /nfs/dbraw/zinc/72/70/56/931727056.db2.gz IYRYYJAWTBNKDR-UHFFFAOYSA-N 0 3 424.408 4.242 20 0 HIADHN Cc1ccc(OCc2nc(CNc3ccc(CN4CCN(C)CC4)cc3)cs2)cc1 ZINC000533212227 931810964 /nfs/dbraw/zinc/81/09/64/931810964.db2.gz KXHDEKRQGGVSAW-UHFFFAOYSA-N 0 3 422.598 4.390 20 0 HIADHN c1sc(-c2ccc3c(c2)OCO3)nc1CN[C@H]1CCOC2(CCSCC2)C1 ZINC000533226716 931814578 /nfs/dbraw/zinc/81/45/78/931814578.db2.gz NKQMLXJWZWTLIB-HNNXBMFYSA-N 0 3 404.557 4.073 20 0 HIADHN CCN(CC(=O)N[C@@H](c1nccs1)c1ccccc1)[C@H](C)Cc1ccc(OC)cc1 ZINC000533282442 931827631 /nfs/dbraw/zinc/82/76/31/931827631.db2.gz UMUWLYDTZGBYPN-WZONZLPQSA-N 0 3 423.582 4.310 20 0 HIADHN COc1ccc([C@@H](CNC(=O)CN(C)CC2CCC2)c2c[nH]c3ccccc32)cc1 ZINC000533302604 931833755 /nfs/dbraw/zinc/83/37/55/931833755.db2.gz MGNUAFCWHFSGFJ-JOCHJYFZSA-N 0 3 405.542 4.157 20 0 HIADHN O=C(CCN1CCC([C@@H](O)C(F)(F)F)CC1)Nc1ccccc1Oc1ccccc1 ZINC000533347350 931844761 /nfs/dbraw/zinc/84/47/61/931844761.db2.gz IISMJVUZQAHLSV-OAQYLSRUSA-N 0 3 422.447 4.443 20 0 HIADHN COC(=O)c1cc2cc(CN3CCC(C(=O)Nc4ccc(F)cc4)CC3)ccc2o1 ZINC000533365090 931849116 /nfs/dbraw/zinc/84/91/16/931849116.db2.gz WYRWSJKOTRBVOX-UHFFFAOYSA-N 0 3 410.445 4.209 20 0 HIADHN COc1ccc(NC(C)=O)cc1NC(=O)[C@@H](C)N[C@@H](c1ccc(F)cc1)C1CCC1 ZINC000533368216 931850351 /nfs/dbraw/zinc/85/03/51/931850351.db2.gz WBSBCIHOTJXRGW-JLCFBVMHSA-N 0 3 413.493 4.251 20 0 HIADHN COc1ccc([C@@H](NCCC(=O)NC(C)C)c2ccccc2)cc1Br ZINC000533374443 931851986 /nfs/dbraw/zinc/85/19/86/931851986.db2.gz GBDNVBNACJEGDG-FQEVSTJZSA-N 0 3 405.336 4.051 20 0 HIADHN O=C(CNC1(c2ccccc2)CCOCC1)Nc1ccc(OCc2ccccc2)cc1 ZINC000533380040 931853537 /nfs/dbraw/zinc/85/35/37/931853537.db2.gz BBLRUYDPONXTIE-UHFFFAOYSA-N 0 3 416.521 4.500 20 0 HIADHN Cc1cc(C)c(NC(=O)CNC(=O)CN(CCc2ccccc2)C2CCCC2)c(C)c1 ZINC000533424300 931863454 /nfs/dbraw/zinc/86/34/54/931863454.db2.gz QWDCJCCUMOXDFS-UHFFFAOYSA-N 0 3 421.585 4.154 20 0 HIADHN Cc1ccccc1[C@@H]1C[C@@H](C)N(CC(=O)N2CCC(OCc3ccccc3)CC2)C1 ZINC000533435111 931868021 /nfs/dbraw/zinc/86/80/21/931868021.db2.gz RTYANIYGXPLMHZ-FYYLOGMGSA-N 0 3 406.570 4.381 20 0 HIADHN COc1cc(OC)c(OC)cc1CNC(C)(C)COc1ccc(C(F)(F)F)cn1 ZINC000533466790 931876489 /nfs/dbraw/zinc/87/64/89/931876489.db2.gz HAQUNXSEZNZWBS-UHFFFAOYSA-N 0 3 414.424 4.073 20 0 HIADHN CCc1ccc([C@H](NCC(=O)NCc2ccc(C(=O)N3CCCC3)cc2)C(C)C)cc1 ZINC000533471516 931877614 /nfs/dbraw/zinc/87/76/14/931877614.db2.gz PVLWPXWRNCNETF-RUZDIDTESA-N 0 3 421.585 4.088 20 0 HIADHN O=C(CN1CCC(c2ccc(O)cc2)CC1)Nc1ccc2nc(C(F)(F)F)[nH]c2c1 ZINC000533480389 931879875 /nfs/dbraw/zinc/87/98/75/931879875.db2.gz VETAAGYGBBGKFE-UHFFFAOYSA-N 0 3 418.419 4.105 20 0 HIADHN COC(=O)c1ccc2c(c1)nc(CN(CCc1ccc(F)cc1)C1CCCC1)[nH]c2=O ZINC000533482809 931880327 /nfs/dbraw/zinc/88/03/27/931880327.db2.gz REVVMZCWDWNYEW-UHFFFAOYSA-N 0 3 423.488 4.248 20 0 HIADHN O=C(CN[C@@H](c1ccc(F)cc1)C1CCC1)N1CCC(C(=O)Nc2ccccc2)CC1 ZINC000533505250 931887340 /nfs/dbraw/zinc/88/73/40/931887340.db2.gz GONZSRKSGWTEGF-XMMPIXPASA-N 0 3 423.532 4.134 20 0 HIADHN O=C(Nc1cccc(F)c1)C1CCN(C[C@H](O)COc2ccc3ccccc3c2)CC1 ZINC000533507745 931888541 /nfs/dbraw/zinc/88/85/41/931888541.db2.gz GIKMOLJTOWHACW-QHCPKHFHSA-N 0 3 422.500 4.069 20 0 HIADHN C[C@@H]1Oc2ccc(C(=O)C3CCN(Cc4cccc5cccnc54)CC3)cc2NC1=O ZINC000533508544 931888704 /nfs/dbraw/zinc/88/87/04/931888704.db2.gz XRSSBKVAZMNAEI-INIZCTEOSA-N 0 3 415.493 4.049 20 0 HIADHN Cc1cc(F)ccc1N1CCC[C@H](N2CCC(c3c[nH]c4ncccc34)CC2)C1=O ZINC000533518343 931892443 /nfs/dbraw/zinc/89/24/43/931892443.db2.gz DHENZVITELCIAV-QFIPXVFZSA-N 0 3 406.505 4.385 20 0 HIADHN Cc1ccc(C2=NN(C(=O)CN(C(C)C)C3CCOCC3)[C@H](c3ccco3)C2)cc1 ZINC000533533249 931896274 /nfs/dbraw/zinc/89/62/74/931896274.db2.gz UIHDZFUEILAPMW-QFIPXVFZSA-N 0 3 409.530 4.155 20 0 HIADHN COc1cc(N[C@@H]2CCCN(Cc3cnc4c(cnn4C(C)C)c3)C2)cc(OC)c1 ZINC000533536851 931896607 /nfs/dbraw/zinc/89/66/07/931896607.db2.gz BWWTUAWGPQOHHC-LJQANCHMSA-N 0 3 409.534 4.106 20 0 HIADHN COc1cc(N[C@H]2CCCN(Cc3cnc4c(cnn4C(C)C)c3)C2)cc(OC)c1 ZINC000533536850 931896768 /nfs/dbraw/zinc/89/67/68/931896768.db2.gz BWWTUAWGPQOHHC-IBGZPJMESA-N 0 3 409.534 4.106 20 0 HIADHN COc1cccc(-c2nc(C(=O)N(CCN3CCCC3)c3ccccc3)c(C)[nH]2)c1 ZINC000533706967 931980695 /nfs/dbraw/zinc/98/06/95/931980695.db2.gz FDBFNBYFGUSOFK-UHFFFAOYSA-N 0 3 404.514 4.136 20 0 HIADHN COc1cccc(-c2nc(C)c(C(=O)N(CCN3CCCC3)c3ccccc3)[nH]2)c1 ZINC000533706967 931980704 /nfs/dbraw/zinc/98/07/04/931980704.db2.gz FDBFNBYFGUSOFK-UHFFFAOYSA-N 0 3 404.514 4.136 20 0 HIADHN C[C@@H](C(=O)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1)C1CCOCC1 ZINC000533715421 931986458 /nfs/dbraw/zinc/98/64/58/931986458.db2.gz BRLUQVOWPJNJSZ-MRXNPFEDSA-N 0 3 413.389 4.481 20 0 HIADHN CC[C@H](NCc1cc2c(cc1OC)C[C@H](C)O2)[C@@H](c1ccc(C)cc1)n1cncn1 ZINC000533741787 932003464 /nfs/dbraw/zinc/00/34/64/932003464.db2.gz KNSMCSSXOKGJFW-CODAWKSHSA-N 0 3 406.530 4.076 20 0 HIADHN CC[C@H](NCc1cc2c(cc1OC)C[C@@H](C)O2)[C@H](c1ccc(C)cc1)n1cncn1 ZINC000533741794 932003481 /nfs/dbraw/zinc/00/34/81/932003481.db2.gz KNSMCSSXOKGJFW-GQOCTPOGSA-N 0 3 406.530 4.076 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccc(O)cc1)C(=O)CCC(=O)c1ccc(F)cc1 ZINC000533832029 932050386 /nfs/dbraw/zinc/05/03/86/932050386.db2.gz PNHYOTTYTYSDNT-NRFANRHFSA-N 0 3 412.505 4.007 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)c2cccc(I)c2C)c1 ZINC000533967102 932143397 /nfs/dbraw/zinc/14/33/97/932143397.db2.gz HLBNSTZBCXKQRN-UHFFFAOYSA-N 0 3 408.283 4.222 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)c1 ZINC000533971836 932149298 /nfs/dbraw/zinc/14/92/98/932149298.db2.gz JIRNLRSEWKOMPN-XMMPIXPASA-N 0 3 415.537 4.036 20 0 HIADHN COc1ccccc1COc1cccc(NC(=O)[C@@H]2CCCN2C2CCOCC2)c1C ZINC000534011338 932192962 /nfs/dbraw/zinc/19/29/62/932192962.db2.gz PBEAVHSNBALRNT-QFIPXVFZSA-N 0 3 424.541 4.165 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)N[C@H]1CCN(C)[C@@H]1c1ccc(Cl)cc1 ZINC000534125763 932291546 /nfs/dbraw/zinc/29/15/46/932291546.db2.gz XCDUTMBOAMYVDT-PZJWPPBQSA-N 0 3 411.933 4.323 20 0 HIADHN Cc1ccc(-n2nc(C(C)(C)C)cc2NC(=O)N2CC[C@H](N3CC=CC3)C2)c(C)c1 ZINC000534161150 932309073 /nfs/dbraw/zinc/30/90/73/932309073.db2.gz BXLLJQJJGSRLLS-IBGZPJMESA-N 0 3 407.562 4.265 20 0 HIADHN O=C(CC1CCC(c2ccccc2)CC1)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1CO ZINC000534183250 932319889 /nfs/dbraw/zinc/31/98/89/932319889.db2.gz BUUIDIWZHFIXTA-GDNSUPOLSA-N 0 3 420.597 4.350 20 0 HIADHN COc1ccc(C[C@H](C)CN(C)C(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)cc1 ZINC000534205590 932330613 /nfs/dbraw/zinc/33/06/13/932330613.db2.gz KUPGMVZIEXKEGE-NRFANRHFSA-N 0 3 423.601 4.176 20 0 HIADHN COc1ccc(C)cc1NC(=O)[C@H](c1ccccc1)N1CC[C@H](C2CCOCC2)C1 ZINC000534381741 932408725 /nfs/dbraw/zinc/40/87/25/932408725.db2.gz CWDJUYLVAKQJAS-URXFXBBRSA-N 0 3 408.542 4.432 20 0 HIADHN Cc1ccc(NC(=O)c2cn(-c3ccc(Br)cc3)cn2)c(CN(C)C)c1 ZINC000534395252 932419897 /nfs/dbraw/zinc/41/98/97/932419897.db2.gz CNBAZUJSUYTMPI-UHFFFAOYSA-N 0 3 413.319 4.257 20 0 HIADHN CC(C)[C@@H](C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1)c1ccc(F)cc1 ZINC000534397418 932423159 /nfs/dbraw/zinc/42/31/59/932423159.db2.gz WWBATFVSUOXWKA-HSZRJFAPSA-N 0 3 416.512 4.364 20 0 HIADHN C[C@@H](Cc1ccc(Cl)cc1)C(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000534415787 932435204 /nfs/dbraw/zinc/43/52/04/932435204.db2.gz TXVHIUOOKMSAAZ-GBESFXJTSA-N 0 3 406.998 4.257 20 0 HIADHN O=C([C@H]1CCCN(Cc2cccc(F)c2)C1)N1CCC[C@H]1Cn1cnc2ccccc21 ZINC000534458593 932475067 /nfs/dbraw/zinc/47/50/67/932475067.db2.gz AQOCWRSRQMBOND-UNMCSNQZSA-N 0 3 420.532 4.079 20 0 HIADHN CN(C)[C@H](CNC(=O)c1ccn(-c2ccc(Cl)c(Cl)c2)n1)Cc1ccccc1 ZINC000534524035 932544713 /nfs/dbraw/zinc/54/47/13/932544713.db2.gz DQEVFVBNDVBHHR-KRWDZBQOSA-N 0 3 417.340 4.082 20 0 HIADHN Cc1ccc2c(c1)[nH]cc2C1=CCN(C(=O)NC[C@H](Cc2ccccc2)N(C)C)CC1 ZINC000534522561 932545048 /nfs/dbraw/zinc/54/50/48/932545048.db2.gz POYHQNCXUFMIEN-QFIPXVFZSA-N 0 3 416.569 4.448 20 0 HIADHN Cc1[nH]c2ccccc2c1C1=CCN(C(=O)NC[C@@H](Cc2ccccc2)N(C)C)CC1 ZINC000534524950 932545589 /nfs/dbraw/zinc/54/55/89/932545589.db2.gz PNGOLENLVFGHLX-JOCHJYFZSA-N 0 3 416.569 4.448 20 0 HIADHN O=C(N1CC=C(C(F)(F)F)CC1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000534538944 932552234 /nfs/dbraw/zinc/55/22/34/932552234.db2.gz CWLPPSGWTZFJMN-QGZVFWFLSA-N 0 3 406.370 4.162 20 0 HIADHN Cc1ccc(CNC(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)c(OCC(F)(F)F)c1 ZINC000534642495 932614925 /nfs/dbraw/zinc/61/49/25/932614925.db2.gz KRDWCVLYSUGBPR-ICSRJNTNSA-N 0 3 421.463 4.181 20 0 HIADHN CCOc1ccc([C@H](C)NC(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)cc1OCC ZINC000534658297 932628047 /nfs/dbraw/zinc/62/80/47/932628047.db2.gz BVEAPMLENPLLMF-NYDSKATKSA-N 0 3 411.546 4.290 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)[C@@H]2C[C@@H]3CCCC[C@H]3N2C(=O)c2ccccc2)c1 ZINC000534699922 932671863 /nfs/dbraw/zinc/67/18/63/932671863.db2.gz HCKVIKDLRZXGSC-QTJGBDASSA-N 0 3 419.569 4.469 20 0 HIADHN Cc1cc([C@H](NC(=O)N(C)C2CCN(CCc3ccccn3)CC2)C2CC2)ccc1F ZINC000534702499 932674201 /nfs/dbraw/zinc/67/42/01/932674201.db2.gz QJEPKFMMPOIZSW-XMMPIXPASA-N 0 3 424.564 4.329 20 0 HIADHN Cc1noc(C)c1COc1ccc(CC(=O)Nc2cc(C)cc(CN(C)C)c2)cc1 ZINC000534709100 932679697 /nfs/dbraw/zinc/67/96/97/932679697.db2.gz KJAULVMEAJUJLJ-UHFFFAOYSA-N 0 3 407.514 4.422 20 0 HIADHN CN1CC[C@H](NC(=O)CCCc2ccc(Br)s2)[C@H]1c1ccccc1 ZINC000534752477 932728552 /nfs/dbraw/zinc/72/85/52/932728552.db2.gz BJDBHDBQBBCDCP-QFBILLFUSA-N 0 3 407.377 4.395 20 0 HIADHN CN(C)[C@H](CNC(=O)Nc1cccc2c1CN(c1nccs1)C2)c1ccccc1 ZINC000534760994 932741300 /nfs/dbraw/zinc/74/13/00/932741300.db2.gz IQFNOUCWHQSXKV-HXUWFJFHSA-N 0 3 407.543 4.088 20 0 HIADHN Cc1cc(NC(=O)c2scnc2C2CC2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000534765622 932748055 /nfs/dbraw/zinc/74/80/55/932748055.db2.gz FVIACYCDNVZYFZ-GOSISDBHSA-N 0 3 407.543 4.225 20 0 HIADHN O=C(c1ccoc1)N1CCC(N[C@H]2CCc3c2c(Br)ccc3F)CC1 ZINC000534794270 932774866 /nfs/dbraw/zinc/77/48/66/932774866.db2.gz PXKOWKJLTLLORC-KRWDZBQOSA-N 0 3 407.283 4.063 20 0 HIADHN O=C1NCCN1[C@@H]1CCCN(Cc2ccc(-c3ccc(C(F)(F)F)cc3)s2)C1 ZINC000535083258 932900369 /nfs/dbraw/zinc/90/03/69/932900369.db2.gz VZCFYTJKXNBVDG-MRXNPFEDSA-N 0 3 409.477 4.424 20 0 HIADHN O=C(CN1CC[C@H](C2CCOCC2)C1)N[C@H](c1ccccc1)c1ccc(Cl)cc1 ZINC000535117687 932933704 /nfs/dbraw/zinc/93/37/04/932933704.db2.gz VIWIXDVTKANXQX-XUZZJYLKSA-N 0 3 412.961 4.294 20 0 HIADHN O=C(NCc1cccc(NC(=O)c2ccccc2)c1)c1cccc(CN2CCCC2)c1 ZINC000535120790 932938500 /nfs/dbraw/zinc/93/85/00/932938500.db2.gz KIOJITKQCVCKMR-UHFFFAOYSA-N 0 3 413.521 4.465 20 0 HIADHN CC(C)(COc1ncccc1C(F)(F)F)NCc1cnc([C@@H]2CCCO2)s1 ZINC000535183863 933000303 /nfs/dbraw/zinc/00/03/03/933000303.db2.gz AMROHXYIOMMCTH-AWEZNQCLSA-N 0 3 401.454 4.356 20 0 HIADHN CCSc1ccc([C@@H](C)NCc2ccccc2CS(=O)(=O)NC(C)C)cc1 ZINC000535235390 933032898 /nfs/dbraw/zinc/03/28/98/933032898.db2.gz YFPCEJAEJHVFOP-QGZVFWFLSA-N 0 3 406.617 4.477 20 0 HIADHN FC(F)(F)c1cnc(OCCCNCc2ccc(Br)cn2)c(Cl)c1 ZINC000535246222 933035633 /nfs/dbraw/zinc/03/56/33/933035633.db2.gz JBUVVXFMHCNMDL-UHFFFAOYSA-N 0 3 424.648 4.470 20 0 HIADHN CN(Cc1ccccc1OC(F)(F)F)C(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000535395083 933113277 /nfs/dbraw/zinc/11/32/77/933113277.db2.gz DKAOAODLNFSXGR-PKOBYXMFSA-N 0 3 407.436 4.172 20 0 HIADHN Cc1ccc(-c2nc(C(=O)N(C)C3CCN(Cc4ccccc4)CC3)cs2)n1C ZINC000535397409 933114873 /nfs/dbraw/zinc/11/48/73/933114873.db2.gz UBVAVVXFEGFBLG-UHFFFAOYSA-N 0 3 408.571 4.194 20 0 HIADHN CC[C@H](NC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1)c1nc(C(F)(F)F)cs1 ZINC000535397933 933115614 /nfs/dbraw/zinc/11/56/14/933115614.db2.gz SHYOQUGXWOBHQQ-LZWOXQAQSA-N 0 3 412.481 4.358 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)c2ccc(F)cc2I)c1 ZINC000535421693 933127662 /nfs/dbraw/zinc/12/76/62/933127662.db2.gz HRAYVUIRBDQJHF-UHFFFAOYSA-N 0 3 412.246 4.053 20 0 HIADHN CSc1cccc(N(C(=O)c2cnc([C@@H]3CCCO3)s2)C2CCN(C)CC2)c1 ZINC000535541024 933233363 /nfs/dbraw/zinc/23/33/63/933233363.db2.gz AYGQLDREUOVASB-SFHVURJKSA-N 0 3 417.600 4.458 20 0 HIADHN COc1ccc(OCc2ccccn2)c(CNCc2ccc(CN(C)C)c(F)c2)c1 ZINC000535680316 933330648 /nfs/dbraw/zinc/33/06/48/933330648.db2.gz JQQHBFWQOLNBNO-UHFFFAOYSA-N 0 3 409.505 4.160 20 0 HIADHN CC(C)[C@H](Oc1cccc(Cl)c1)C(=O)NC1CCN([C@@H](C)c2ccncc2)CC1 ZINC000535836747 933423689 /nfs/dbraw/zinc/42/36/89/933423689.db2.gz SVFIUXKPNFYNFG-JTSKRJEESA-N 0 3 415.965 4.480 20 0 HIADHN CN(C)Cc1cccc(NC(=O)N[C@H]2CCN(C)[C@@H]2c2ccc(Cl)c(F)c2)c1 ZINC000535839376 933424314 /nfs/dbraw/zinc/42/43/14/933424314.db2.gz YGJDJIKXEYFKEB-VQTJNVASSA-N 0 3 404.917 4.108 20 0 HIADHN Cc1cnc(CCN(C)C[C@H](O)CO[C@@H](c2ccccc2)c2ccc(C)cc2)s1 ZINC000535869136 933450802 /nfs/dbraw/zinc/45/08/02/933450802.db2.gz DIQQZBAVUHXAHJ-UPVQGACJSA-N 0 3 410.583 4.401 20 0 HIADHN CNC(=O)c1ccc(OC)c(NC(=O)C(Cc2c(C)cc(C)cc2C)C(F)(F)F)c1 ZINC000535895700 933474700 /nfs/dbraw/zinc/47/47/00/933474700.db2.gz ZQWWLSFEDPURCF-KRWDZBQOSA-N 0 3 422.447 4.340 20 0 HIADHN COc1cccc(-c2nc(C)c(C(=O)N(C)[C@H]3CCCN(Cc4ccccc4)C3)[nH]2)c1 ZINC000535913606 933487678 /nfs/dbraw/zinc/48/76/78/933487678.db2.gz KKVKQMRKTXRONP-NRFANRHFSA-N 0 3 418.541 4.130 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)N1CCC[C@H]1Cn1cnc2ccccc21 ZINC000535936579 933504212 /nfs/dbraw/zinc/50/42/12/933504212.db2.gz NTSWWKMYJUFHRR-JTHBVZDNSA-N 0 3 417.557 4.047 20 0 HIADHN O[C@H](CNCc1ccc(F)c(C(F)(F)F)c1)COc1ccccc1Br ZINC000535941849 933508994 /nfs/dbraw/zinc/50/89/94/933508994.db2.gz FEQWNEFPZABITA-GFCCVEGCSA-N 0 3 422.216 4.137 20 0 HIADHN COc1cc(Cl)c(C)cc1NC(=O)CCNCc1c(C)nn(C(C)(C)C)c1C ZINC000535945957 933512018 /nfs/dbraw/zinc/51/20/18/933512018.db2.gz XLSCSMGVKCYSAZ-UHFFFAOYSA-N 0 3 406.958 4.344 20 0 HIADHN Cc1noc(C2CCC(NCc3cn(-c4ccc(Cl)cc4Cl)nn3)CC2)n1 ZINC000535945098 933512108 /nfs/dbraw/zinc/51/21/08/933512108.db2.gz YIFQIFOUCGCDHI-UHFFFAOYSA-N 0 3 407.305 4.082 20 0 HIADHN Cc1cc(C)c(CC(C(=O)Nc2ccc3c(c2)CCN3C(N)=O)C(F)(F)F)c(C)c1 ZINC000535960771 933526332 /nfs/dbraw/zinc/52/63/32/933526332.db2.gz WSWKLOQVTCTOIT-GOSISDBHSA-N 0 3 419.447 4.413 20 0 HIADHN CN(C)[C@H](CNC(=O)Nc1cccc(C[S@@](=O)C(C)(C)C)c1)Cc1ccccc1 ZINC000536016964 933573009 /nfs/dbraw/zinc/57/30/09/933573009.db2.gz GNRPYKHUIKNWDA-KCWXNJEJSA-N 0 3 415.603 4.028 20 0 HIADHN CC[C@@](C)(COc1ncccc1Cl)NCC(=O)Nc1ccc(OC(F)F)cc1 ZINC000536030044 933579814 /nfs/dbraw/zinc/57/98/14/933579814.db2.gz WMZCBRVVXIUBPP-IBGZPJMESA-N 0 3 413.852 4.112 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccc(O)cc1)C(=O)c1ccc(Br)s1 ZINC000536035942 933583789 /nfs/dbraw/zinc/58/37/89/933583789.db2.gz OIDSKEDFGNBLDV-HNNXBMFYSA-N 0 3 423.376 4.343 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)c2ccc(OC(C)C)c(OC)c2)cc1 ZINC000536095775 933646066 /nfs/dbraw/zinc/64/60/66/933646066.db2.gz OVFULNZNHWNLSK-OAQYLSRUSA-N 0 3 412.530 4.058 20 0 HIADHN C[C@H](NCCNC(=O)c1ccccc1F)c1cc2cc(Br)ccc2o1 ZINC000537306036 933706971 /nfs/dbraw/zinc/70/69/71/933706971.db2.gz BQWJVVDVKAQOQP-LBPRGKRZSA-N 0 3 405.267 4.415 20 0 HIADHN O=C1c2ccccc2C(=O)N1[C@H]1CCCC[C@@H](NCc2nc(C(F)(F)F)cs2)C1 ZINC000537311829 933711080 /nfs/dbraw/zinc/71/10/80/933711080.db2.gz VOEYLBBADHWDGJ-OLZOCXBDSA-N 0 3 423.460 4.249 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)c1coc(-c2ccccc2Cl)n1 ZINC000537337552 933722087 /nfs/dbraw/zinc/72/20/87/933722087.db2.gz FORHFJNIYNTRQQ-UHFFFAOYSA-N 0 3 401.869 4.338 20 0 HIADHN CN1CC[C@H](NCc2nc(-c3ccc(Br)cc3)c[nH]2)[C@@H]1c1ccccc1 ZINC000537360745 933736679 /nfs/dbraw/zinc/73/66/79/933736679.db2.gz GWTRUVALKWPYHS-RXVVDRJESA-N 0 3 411.347 4.374 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cc(C)n(-c4ccc(F)cc4)n3)c(C)c2)CC1 ZINC000537389820 933751630 /nfs/dbraw/zinc/75/16/30/933751630.db2.gz UNAAQTWNQDIGRB-UHFFFAOYSA-N 0 3 421.520 4.022 20 0 HIADHN COCCC[C@H](NCc1ccc2c(c1)OCCO2)c1ccc(Br)cc1 ZINC000537407406 933761996 /nfs/dbraw/zinc/76/19/96/933761996.db2.gz OVHXQTMXGZLXTK-SFHVURJKSA-N 0 3 406.320 4.478 20 0 HIADHN CNS(=O)(=O)c1ccc([C@H](C)NC2(c3cccc(Br)c3)CCC2)cc1 ZINC000537422793 933770603 /nfs/dbraw/zinc/77/06/03/933770603.db2.gz QYYKEKVJYXFZLT-AWEZNQCLSA-N 0 3 423.376 4.087 20 0 HIADHN NC(=O)[C@@H](CNCc1cc(Cl)ccc1OC(F)F)Cc1ccccc1Cl ZINC000537434485 933773968 /nfs/dbraw/zinc/77/39/68/933773968.db2.gz OKDUKYSCHWLNIW-CYBMUJFWSA-N 0 3 403.256 4.029 20 0 HIADHN O=C1[C@@H](NCc2cccc3cc[nH]c32)CCCN1Cc1cccc(C(F)(F)F)c1 ZINC000537435369 933774036 /nfs/dbraw/zinc/77/40/36/933774036.db2.gz VJYBWOWWMHOPHX-IBGZPJMESA-N 0 3 401.432 4.468 20 0 HIADHN Cc1cc(-c2noc([C@]3(C(F)(F)F)CCN(Cc4ccccc4)C3)n2)ccc1O ZINC000562480818 945086638 /nfs/dbraw/zinc/08/66/38/945086638.db2.gz ODGCVUSTDGNZQM-FQEVSTJZSA-N 0 3 403.404 4.457 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@H](NCc2cccc(C(=O)N[C@H](C)CC)c2)c2ccccc21 ZINC000562758479 945117415 /nfs/dbraw/zinc/11/74/15/945117415.db2.gz SEBCGKGTSCSZBG-ZQMYSKGWSA-N 0 3 408.542 4.486 20 0 HIADHN COc1cc(CN2CCCC[C@@H]2CCc2ccccc2)cc(Cl)c1OCC(N)=O ZINC000537627955 938339215 /nfs/dbraw/zinc/33/92/15/938339215.db2.gz UXVJUAVUQLGDBR-LJQANCHMSA-N 0 3 416.949 4.200 20 0 HIADHN CC(C)(C)OC(=O)[C@@H]1CCN(Cc2cn(-c3ccccc3)nc2-c2cccnc2)C1 ZINC000537650459 938347234 /nfs/dbraw/zinc/34/72/34/938347234.db2.gz GDYAHMSFLUZQMW-LJQANCHMSA-N 0 3 404.514 4.098 20 0 HIADHN COCc1cccc(OCC2(CN(C)[C@@H](C)c3ccc([S@](C)=O)cc3)CC2)c1 ZINC000537677752 938351791 /nfs/dbraw/zinc/35/17/91/938351791.db2.gz NFHBPDQONPUVRH-JMQGSBJISA-N 0 3 401.572 4.422 20 0 HIADHN CN1CCN(c2cccc(Cl)c2CNCc2cccc(OCC(F)F)c2)CC1 ZINC000537749756 938369222 /nfs/dbraw/zinc/36/92/22/938369222.db2.gz PBJGBROBKPIXDB-UHFFFAOYSA-N 0 3 409.908 4.026 20 0 HIADHN COCCc1nc(C)c([C@H](C)N[C@@H](C)c2ccc(NC(=O)NC3CC3)cc2)s1 ZINC000537765369 938372535 /nfs/dbraw/zinc/37/25/35/938372535.db2.gz OIAAIQCDMWAAGN-KBPBESRZSA-N 0 3 402.564 4.336 20 0 HIADHN O=C([C@H]1CC12CCN(CCOc1ccccc1C(F)(F)F)CC2)N1CCCCC1 ZINC000537804172 938380472 /nfs/dbraw/zinc/38/04/72/938380472.db2.gz VMKYOIUGBZKWGW-GOSISDBHSA-N 0 3 410.480 4.199 20 0 HIADHN O=C(CC[C@@H]1CCCCO1)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1 ZINC000537832180 938386048 /nfs/dbraw/zinc/38/60/48/938386048.db2.gz VOMLQOYFAVMMOQ-VWLOTQADSA-N 0 3 421.585 4.339 20 0 HIADHN CC(C)n1cnnc1[C@@H]1CCCN(CCC(=O)Nc2c(Cl)cccc2Cl)C1 ZINC000537865707 938394423 /nfs/dbraw/zinc/39/44/23/938394423.db2.gz ZAQZSZDKDHUBJB-CQSZACIVSA-N 0 3 410.349 4.374 20 0 HIADHN Cc1c([C@@H](C)NCc2ccc(NS(C)(=O)=O)cc2)cnn1-c1cc(C)ccc1C ZINC000537918792 938413252 /nfs/dbraw/zinc/41/32/52/938413252.db2.gz MIQOMVLXVQTNJZ-QGZVFWFLSA-N 0 3 412.559 4.020 20 0 HIADHN COc1cc(C)cc(CN[C@H](C)c2ccc(S(=O)(=O)N3CCCCC3)cc2)c1 ZINC000537947729 938428719 /nfs/dbraw/zinc/42/87/19/938428719.db2.gz HWPIJJALDYGZHG-GOSISDBHSA-N 0 3 402.560 4.029 20 0 HIADHN Cc1c([C@H](C)NCCC[C@@H]2CCCC[C@@H]2O)nnn1-c1cccc(Br)c1 ZINC000537957923 938433535 /nfs/dbraw/zinc/43/35/35/938433535.db2.gz YYWWSTXTLILCHW-QOKNQOGYSA-N 0 3 421.383 4.320 20 0 HIADHN COc1ccc([C@H](OC)[C@H](C)N[C@H](C)c2ccc(-n3cncn3)cc2Cl)cc1 ZINC000537964589 938437311 /nfs/dbraw/zinc/43/73/11/938437311.db2.gz WLBVWQOCKPSMMC-LRAJWGHMSA-N 0 3 400.910 4.356 20 0 HIADHN Cc1c([C@@H](C)NCc2cccc(CN3CCCC3=O)c2)cnn1-c1ccc(F)cc1 ZINC000537968184 938438975 /nfs/dbraw/zinc/43/89/75/938438975.db2.gz UAPVIFMLVMLTKH-QGZVFWFLSA-N 0 3 406.505 4.293 20 0 HIADHN COc1cccc(C[C@@H](NCc2cccc(NS(C)(=O)=O)c2)c2ccccc2)c1 ZINC000537973672 938443238 /nfs/dbraw/zinc/44/32/38/938443238.db2.gz VMJJXKDRPYNLNG-HSZRJFAPSA-N 0 3 410.539 4.140 20 0 HIADHN C[C@H](N[C@@H]1CCc2ccc(F)cc21)c1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000537975705 938443812 /nfs/dbraw/zinc/44/38/12/938443812.db2.gz ZFQPJKFHTKAHMN-KSFYIVLOSA-N 0 3 402.535 4.338 20 0 HIADHN CC[C@H](N[C@H]1CCN(Cc2ccc(OC)cc2)C1=O)c1ccc(OC(F)F)cc1 ZINC000537982027 938447453 /nfs/dbraw/zinc/44/74/53/938447453.db2.gz HQBPYTCGLHHLST-PMACEKPBSA-N 0 3 404.457 4.138 20 0 HIADHN Cc1ccc(-c2nc3c(s2)[C@@H](N[C@@H]2CCCN(c4ccn(C)n4)C2=O)CCC3)cc1 ZINC000537983722 938448361 /nfs/dbraw/zinc/44/83/61/938448361.db2.gz WCWXAINSSWXPIO-PKOBYXMFSA-N 0 3 421.570 4.015 20 0 HIADHN CS(=O)(=O)Nc1ccc(CN[C@H](Cc2cccc(F)c2)c2cccc(F)c2)cc1 ZINC000537985630 938448961 /nfs/dbraw/zinc/44/89/61/938448961.db2.gz CVCRDWOCUJTZIR-JOCHJYFZSA-N 0 3 416.493 4.410 20 0 HIADHN C[C@@H](Cc1ccccc1)n1cccc1C(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000538020536 938466021 /nfs/dbraw/zinc/46/60/21/938466021.db2.gz GWNMBFQFGZMXEL-FDFHNCONSA-N 0 3 423.601 4.253 20 0 HIADHN CO[C@@H](c1ccc(Br)cc1)[C@H](C)NCc1cc(-c2cccnc2)n[nH]1 ZINC000538022239 938466554 /nfs/dbraw/zinc/46/65/54/938466554.db2.gz GERWQJRXTXILQZ-ORAYPTAESA-N 0 3 401.308 4.100 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)N[C@@H]1CCO[C@H]1c1ccc(Cl)c(F)c1 ZINC000538081728 938497820 /nfs/dbraw/zinc/49/78/20/938497820.db2.gz GUXVQYHEAKTWQZ-XLIONFOSSA-N 0 3 421.900 4.201 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)N[C@H]1CCO[C@H]1c1ccc(Cl)c(F)c1 ZINC000538081726 938497915 /nfs/dbraw/zinc/49/79/15/938497915.db2.gz GUXVQYHEAKTWQZ-PXNSSMCTSA-N 0 3 421.900 4.201 20 0 HIADHN COc1ccc([C@H](NCc2ccc(S(=O)(=O)N3CCCCC3)cc2)C(C)C)cc1 ZINC000538114799 938505781 /nfs/dbraw/zinc/50/57/81/938505781.db2.gz GTFNKGTWGWUXFP-HSZRJFAPSA-N 0 3 416.587 4.357 20 0 HIADHN C[C@H](NCc1ccc(-c2ccc3c(c2)C[C@@H](C)O3)cc1)c1ccc(S(N)(=O)=O)cc1 ZINC000538116044 938505872 /nfs/dbraw/zinc/50/58/72/938505872.db2.gz HTBGVFNLQRIMSA-SJORKVTESA-N 0 3 422.550 4.175 20 0 HIADHN CC(C)[C@@H](NCc1ccc(Br)cc1N1CCOCC1)c1cccnc1 ZINC000538117760 938506627 /nfs/dbraw/zinc/50/66/27/938506627.db2.gz UYTAHGUYTKXPQG-HXUWFJFHSA-N 0 3 404.352 4.168 20 0 HIADHN C[C@H](NCc1cc(F)cc(Br)c1)c1ccc(OCC(=O)NC2CC2)cc1 ZINC000538123458 938510107 /nfs/dbraw/zinc/51/01/07/938510107.db2.gz PXFVPFLGRVUSGA-ZDUSSCGKSA-N 0 3 421.310 4.096 20 0 HIADHN Cc1ccc(OC[C@@H](O)CN[C@@H](C)c2cccc(NC(=O)c3ccccc3)c2)cc1 ZINC000538128962 938514110 /nfs/dbraw/zinc/51/41/10/938514110.db2.gz VZSDQGYHWNGGIN-CVDCTZTESA-N 0 3 404.510 4.338 20 0 HIADHN CC[C@H](NCC(=O)N1CCC[C@H]1c1ccc(OC)c(OC)c1)c1ccc(OC)cc1 ZINC000538141374 938517807 /nfs/dbraw/zinc/51/78/07/938517807.db2.gz NGYLUNFYCZGCTQ-SFTDATJTSA-N 0 3 412.530 4.117 20 0 HIADHN CC[C@@H](NCC(=O)N1CCC[C@H]1c1ccc(OC)c(OC)c1)c1ccc(OC)cc1 ZINC000538141371 938518149 /nfs/dbraw/zinc/51/81/49/938518149.db2.gz NGYLUNFYCZGCTQ-RTWAWAEBSA-N 0 3 412.530 4.117 20 0 HIADHN COc1ccccc1[C@H](C)NC(=O)[C@@H](C)N[C@H](C)c1ccc(Br)cc1 ZINC000538143017 938518723 /nfs/dbraw/zinc/51/87/23/938518723.db2.gz DECZLVFSEXKFGA-QLFBSQMISA-N 0 3 405.336 4.374 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@H](C)N[C@H](CCOC)c2ccccc2)cc1 ZINC000538144423 938519718 /nfs/dbraw/zinc/51/97/18/938519718.db2.gz PUUCLCCDGPLXKT-PGRDOPGGSA-N 0 3 404.576 4.146 20 0 HIADHN CC(C)OC(=O)c1ccc(NC(=O)[C@H](C)N[C@H](C)c2ccccc2-n2cccn2)cc1 ZINC000538159827 938529363 /nfs/dbraw/zinc/52/93/63/938529363.db2.gz IQPUAHOXMFNUHK-MSOLQXFVSA-N 0 3 420.513 4.115 20 0 HIADHN CC(C)OC(=O)c1ccc(NC(=O)[C@@H](C)N[C@@H](C)c2ccccc2-n2cccn2)cc1 ZINC000538159833 938529476 /nfs/dbraw/zinc/52/94/76/938529476.db2.gz IQPUAHOXMFNUHK-ZWKOTPCHSA-N 0 3 420.513 4.115 20 0 HIADHN C[C@H](NCC(=O)NCCc1cccc(Cl)c1Cl)c1ccccc1-n1cccn1 ZINC000538160476 938529894 /nfs/dbraw/zinc/52/98/94/938529894.db2.gz ABKIBKRMVNMEFB-HNNXBMFYSA-N 0 3 417.340 4.189 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(OCC(F)(F)F)cc1)C(=O)Nc1ccc2c(c1)OCCO2 ZINC000538163689 938530840 /nfs/dbraw/zinc/53/08/40/938530840.db2.gz QLRSRGLYFFSOPY-UONOGXRCSA-N 0 3 424.419 4.077 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(OCC(F)(F)F)cc1)C(=O)Nc1ccc2c(c1)OCCO2 ZINC000538163683 938530854 /nfs/dbraw/zinc/53/08/54/938530854.db2.gz QLRSRGLYFFSOPY-KBPBESRZSA-N 0 3 424.419 4.077 20 0 HIADHN CC(C)(C)c1ccc(S(=O)(=O)CCN[C@H](c2ccccc2)[C@@H]2CCOC2)cc1 ZINC000538191249 938546780 /nfs/dbraw/zinc/54/67/80/938546780.db2.gz ROPMUDHOJJFACO-DENIHFKCSA-N 0 3 401.572 4.125 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)N[C@@H]1CCCC[C@H]1C)c1ccc(NC(=O)c2ccncc2)cc1 ZINC000538191683 938547197 /nfs/dbraw/zinc/54/71/97/938547197.db2.gz WNUMVLLZVSSRKC-QSNWEANLSA-N 0 3 408.546 4.068 20 0 HIADHN CC[C@@H]1CCCCN1C(=O)[C@@H](C)N[C@@H](C)c1ccc(NC(=O)c2ccncc2)cc1 ZINC000538197813 938550399 /nfs/dbraw/zinc/55/03/99/938550399.db2.gz LLOQTHGWPUNMNC-NJNPRVFISA-N 0 3 408.546 4.164 20 0 HIADHN CCN1CCN(Cc2ccc(CNC(=O)Nc3cccc(SC)c3C)cc2)CC1 ZINC000538211100 938557918 /nfs/dbraw/zinc/55/79/18/938557918.db2.gz PNWTXGWKISTWJC-UHFFFAOYSA-N 0 3 412.603 4.176 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)Nc2c(F)cc(Cl)cc2F)CC1 ZINC000538216947 938560664 /nfs/dbraw/zinc/56/06/64/938560664.db2.gz XBURZIAFPQZSNV-UHFFFAOYSA-N 0 3 422.907 4.077 20 0 HIADHN O=C(CN[C@@H](C[C@H]1CCOC1)c1ccccc1)Nc1ccccc1Br ZINC000538232529 938567087 /nfs/dbraw/zinc/56/70/87/938567087.db2.gz DFEQGFJRPLTHRW-BEFAXECRSA-N 0 3 403.320 4.145 20 0 HIADHN CS(=O)(=O)c1ccc(NC(=O)CN[C@H](c2cccc(Cl)c2)C2CCCC2)cc1 ZINC000538232655 938567100 /nfs/dbraw/zinc/56/71/00/938567100.db2.gz GOJFKMUOSXRVOZ-NRFANRHFSA-N 0 3 420.962 4.203 20 0 HIADHN CC(C)(C)[C@H](NCC(=O)NCC1(c2ccccc2)CCOCC1)c1cccc(F)c1 ZINC000538232286 938567266 /nfs/dbraw/zinc/56/72/66/938567266.db2.gz YCXBIGLAEHUQDU-HSZRJFAPSA-N 0 3 412.549 4.367 20 0 HIADHN O=C(CN[C@@H](C[C@@H]1CCOC1)c1ccccc1)NCc1ccccc1OC1CCCC1 ZINC000538233330 938567453 /nfs/dbraw/zinc/56/74/53/938567453.db2.gz QJVBDCNNYAZUKX-RDPSFJRHSA-N 0 3 422.569 4.382 20 0 HIADHN Cc1cccc(N2CCN(C(=O)CN[C@@H](C)c3ccc(-c4ccncc4)cc3)CC2)c1 ZINC000538237561 938569847 /nfs/dbraw/zinc/56/98/47/938569847.db2.gz WBGIOUOSNHQBLO-NRFANRHFSA-N 0 3 414.553 4.056 20 0 HIADHN CCC[C@@H]1CN(c2ccc(-c3nc(CC)cc(=O)[n-]3)cn2)CC[N@@H+]1Cc1ccccc1 ZINC000538291141 938584312 /nfs/dbraw/zinc/58/43/12/938584312.db2.gz RAMMXQFKKUJIHV-JOCHJYFZSA-N 0 3 417.557 4.298 20 0 HIADHN CCC[C@@H]1CN(c2ccc(-c3nc(CC)cc(=O)[n-]3)cn2)CC[N@H+]1Cc1ccccc1 ZINC000538291141 938584315 /nfs/dbraw/zinc/58/43/15/938584315.db2.gz RAMMXQFKKUJIHV-JOCHJYFZSA-N 0 3 417.557 4.298 20 0 HIADHN CN(C)CCN(C(=O)c1cc(OC(F)F)cc(OC(F)F)c1)C1CCCCC1 ZINC000538302994 938587816 /nfs/dbraw/zinc/58/78/16/938587816.db2.gz TWGOLAXGOOFLFM-UHFFFAOYSA-N 0 3 406.420 4.226 20 0 HIADHN CCN1CCN(Cc2ccc(CNC(=O)Nc3cc(SC)ccc3C)cc2)CC1 ZINC000538323503 938592619 /nfs/dbraw/zinc/59/26/19/938592619.db2.gz PZXDQTKZJWHQPP-UHFFFAOYSA-N 0 3 412.603 4.176 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2ccc(-c3noc(C(F)F)n3)cc2)N(C)C)cc1 ZINC000538346439 938599548 /nfs/dbraw/zinc/59/95/48/938599548.db2.gz QWCQQTWQTURTCJ-QGZVFWFLSA-N 0 3 400.429 4.015 20 0 HIADHN COc1ccc([C@H]2CCCN2C(=O)CN[C@H](c2ccccc2C)C2CC2)cc1OC ZINC000538392725 938609396 /nfs/dbraw/zinc/60/93/96/938609396.db2.gz KGMLXIFFLSZQCC-BWKNWUBXSA-N 0 3 408.542 4.417 20 0 HIADHN C[C@H](N[C@@H]1CCO[C@@H]1c1ccc(F)c(F)c1)c1ccc(-n2cncn2)cc1Cl ZINC000538406220 938612894 /nfs/dbraw/zinc/61/28/94/938612894.db2.gz TWVPRJMVLFRTJL-NXXCRTJYSA-N 0 3 404.848 4.380 20 0 HIADHN COc1cc(OC)c(CNC[C@@H]2CCN(C)[C@H]2c2ccc(Cl)c(F)c2)c(OC)c1 ZINC000538463707 938628084 /nfs/dbraw/zinc/62/80/84/938628084.db2.gz FHBMBULTCGJDPP-NYHFZMIOSA-N 0 3 422.928 4.288 20 0 HIADHN CC(C)C[C@@H]1C[C@@H](NC(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)CCO1 ZINC000538518121 938639867 /nfs/dbraw/zinc/63/98/67/938639867.db2.gz LDJYJGWRZVUCIZ-XUVXKRRUSA-N 0 3 407.624 4.414 20 0 HIADHN Cc1nc2c(s1)[C@@H](N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1)CCC2 ZINC000538554269 938647670 /nfs/dbraw/zinc/64/76/70/938647670.db2.gz QXLVMNIIINBMGL-VXKWHMMOSA-N 0 3 405.567 4.346 20 0 HIADHN Cc1cc(C(=O)CN2CCC[C@@H]2C2CCOCC2)c(C)n1CCc1cccs1 ZINC000538628851 938666847 /nfs/dbraw/zinc/66/68/47/938666847.db2.gz WFENOOJPFYELSW-JOCHJYFZSA-N 0 3 400.588 4.483 20 0 HIADHN C[C@@H](c1ccccc1)N(C)C(=O)CN1CCC[C@H](c2nc(C3CCCCC3)n[nH]2)C1 ZINC000538664905 938679148 /nfs/dbraw/zinc/67/91/48/938679148.db2.gz CGSYUXZMBCHGFS-RXVVDRJESA-N 0 3 409.578 4.251 20 0 HIADHN C[C@@H](c1ccccc1)N(C)C(=O)CN1CCC[C@H](c2n[nH]c(C3CCCCC3)n2)C1 ZINC000538664905 938679153 /nfs/dbraw/zinc/67/91/53/938679153.db2.gz CGSYUXZMBCHGFS-RXVVDRJESA-N 0 3 409.578 4.251 20 0 HIADHN COC(=O)[C@@H]1CC12CCN(Cc1cn(Cc3ccccc3)nc1-c1ccccc1)CC2 ZINC000538725849 938692565 /nfs/dbraw/zinc/69/25/65/938692565.db2.gz BKFVGIQYPMOLSO-QHCPKHFHSA-N 0 3 415.537 4.374 20 0 HIADHN CC1CCC(OC2CCN(Cc3c[nH]nc3-c3ccc4c(c3)OCCO4)CC2)CC1 ZINC000538732616 938696076 /nfs/dbraw/zinc/69/60/76/938696076.db2.gz CKZDEYHYPYQIPU-UHFFFAOYSA-N 0 3 411.546 4.408 20 0 HIADHN CCN(CC(F)(F)F)C(=O)[C@H]1CCCN(Cc2cnc(-c3cccs3)s2)C1 ZINC000538752055 938701861 /nfs/dbraw/zinc/70/18/61/938701861.db2.gz FSGCDMZYSZWYPV-ZDUSSCGKSA-N 0 3 417.522 4.494 20 0 HIADHN C[C@@H](NCc1ccc(S(=O)(=O)N2CCC[C@@H](C)C2)cc1)c1ccccc1N(C)C ZINC000538759978 938703495 /nfs/dbraw/zinc/70/34/95/938703495.db2.gz IRPZORTUCCWCGV-RTBURBONSA-N 0 3 415.603 4.024 20 0 HIADHN Cc1nn(Cc2ccc(C)cc2)c(C)c1CN1CCC(OC[C@@H]2CCCCO2)CC1 ZINC000538764043 938705204 /nfs/dbraw/zinc/70/52/04/938705204.db2.gz JTDZUCCLFWGBPY-DEOSSOPVSA-N 0 3 411.590 4.407 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)NC2CCC(C(=O)OC(C)(C)C)CC2)C1 ZINC000538781400 938709078 /nfs/dbraw/zinc/70/90/78/938709078.db2.gz ZPVLJIJWZMGINJ-RLHVNXBHSA-N 0 3 415.578 4.022 20 0 HIADHN CCCN(C(=O)c1cccs1)C1CCN(Cc2ccc(OCCOC)cc2)CC1 ZINC000538796329 938714362 /nfs/dbraw/zinc/71/43/62/938714362.db2.gz ANHTUSBNEANXCB-UHFFFAOYSA-N 0 3 416.587 4.290 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)CSc2ccc(F)c(F)c2)cc1 ZINC000538830735 938721695 /nfs/dbraw/zinc/72/16/95/938721695.db2.gz NSQPTBDJOVCHQT-FQEVSTJZSA-N 0 3 406.498 4.019 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)Cc2nc(-c3ccccc3)oc2C)cc1 ZINC000538831407 938722067 /nfs/dbraw/zinc/72/20/67/938722067.db2.gz YXYXLHCVXVEEQP-HSZRJFAPSA-N 0 3 419.525 4.154 20 0 HIADHN CCC[C@@H](N[C@H](C)c1sc(CCOC)nc1C)C(=O)N1CCc2sccc2C1 ZINC000538869007 938728480 /nfs/dbraw/zinc/72/84/80/938728480.db2.gz UVMIBHPCZYWIQO-RHSMWYFYSA-N 0 3 421.632 4.106 20 0 HIADHN CNS(=O)(=O)c1cccc([C@H](C)N[C@@H]2CCCc3ccc(Br)cc32)c1 ZINC000538868639 938728500 /nfs/dbraw/zinc/72/85/00/938728500.db2.gz BXPJYWXMDAJLBG-ORAYPTAESA-N 0 3 423.376 4.085 20 0 HIADHN Cc1nc(C)c(C(=O)Nc2cccc(N3CCN(CCc4ccccc4)CC3)c2)s1 ZINC000538924829 938738639 /nfs/dbraw/zinc/73/86/39/938738639.db2.gz WFIBDSKKLVMLLY-UHFFFAOYSA-N 0 3 420.582 4.377 20 0 HIADHN FC(F)(F)c1ccc(O[C@@H]2CCN(CCCc3nc(-c4cccs4)no3)C2)nc1 ZINC000538958815 938750543 /nfs/dbraw/zinc/75/05/43/938750543.db2.gz XXACOWXYHIFROP-CQSZACIVSA-N 0 3 424.448 4.298 20 0 HIADHN Cc1cc2ncc([C@@H](C)NCCNc3ncc(C(F)(F)F)cc3Cl)c(C)n2n1 ZINC000538985985 938760019 /nfs/dbraw/zinc/76/00/19/938760019.db2.gz YUMQZBOGZZWLMP-LLVKDONJSA-N 0 3 412.847 4.176 20 0 HIADHN COCCOc1ccc([C@H](C)N[C@H]2CC(=O)N(C)[C@@H]2c2ccc(Cl)c(F)c2)cc1 ZINC000539042321 938778650 /nfs/dbraw/zinc/77/86/50/938778650.db2.gz FFLMZUXBIYYZHQ-PRPYNDMISA-N 0 3 420.912 4.127 20 0 HIADHN CCC[C@@H](NC[C@H](O)CS(=O)(=O)c1cccs1)c1cccc(C(F)(F)F)c1 ZINC000539049068 938782853 /nfs/dbraw/zinc/78/28/53/938782853.db2.gz ACTLIEVKVUYORE-JKSUJKDBSA-N 0 3 421.506 4.033 20 0 HIADHN COc1ccc([C@H](C)[NH2+]Cc2nnc(-c3ccc(Br)cc3)[n-]2)cc1OC ZINC000539054204 938785165 /nfs/dbraw/zinc/78/51/65/938785165.db2.gz DUMZCYAWYHADDU-LBPRGKRZSA-N 0 3 417.307 4.102 20 0 HIADHN C[C@H](NCCOc1ccc(C(F)(F)F)cn1)c1ccc(-n2cncn2)cc1Cl ZINC000539061092 938787577 /nfs/dbraw/zinc/78/75/77/938787577.db2.gz YKYXALZAYUMKJH-LBPRGKRZSA-N 0 3 411.815 4.064 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)N[C@H](CO)c2cccc(Br)c2)cc1 ZINC000539066542 938790601 /nfs/dbraw/zinc/79/06/01/938790601.db2.gz OPHANUWVAKCYNI-JLTOFOAXSA-N 0 3 400.320 4.327 20 0 HIADHN COc1ccc([C@H](CN[C@@H](C)c2ccc(F)cc2OC(F)F)N(C)C)cc1OC ZINC000539074437 938794848 /nfs/dbraw/zinc/79/48/48/938794848.db2.gz OWDLKRNWWLYCOU-GUYCJALGSA-N 0 3 412.452 4.398 20 0 HIADHN COc1ccc([C@@H](CN[C@@H](C)c2ccc(F)cc2OC(F)F)N(C)C)cc1OC ZINC000539074439 938794938 /nfs/dbraw/zinc/79/49/38/938794938.db2.gz OWDLKRNWWLYCOU-SUMWQHHRSA-N 0 3 412.452 4.398 20 0 HIADHN C[C@@H](CC(=O)Nc1cccc(C(F)(F)F)c1)NCc1nc(-c2ccc(F)cc2)n[nH]1 ZINC000539120560 938805776 /nfs/dbraw/zinc/80/57/76/938805776.db2.gz BEWFPUBYAUOXRU-LBPRGKRZSA-N 0 3 421.398 4.137 20 0 HIADHN COCC[C@H]([NH2+]Cc1nnc(-c2ccc(Br)cc2)[n-]1)c1ccc(F)cc1 ZINC000539119815 938805843 /nfs/dbraw/zinc/80/58/43/938805843.db2.gz FZOLATRJLQKZSQ-KRWDZBQOSA-N 0 3 419.298 4.241 20 0 HIADHN COc1ccc([C@@H](NCc2ccc(S(=O)(=O)N3CCCCC3)cc2)C2CC2)cc1 ZINC000539218718 938820515 /nfs/dbraw/zinc/82/05/15/938820515.db2.gz YYKDNHJIIFQTQW-QHCPKHFHSA-N 0 3 414.571 4.111 20 0 HIADHN COc1ccc([C@@H](NCC(=O)N[C@@H](c2nccs2)c2ccccc2)C(C)C)cc1 ZINC000539242330 938824049 /nfs/dbraw/zinc/82/40/49/938824049.db2.gz GSJJOBOHACHUNO-FCHUYYIVSA-N 0 3 409.555 4.344 20 0 HIADHN CC(C)c1ccc([C@@H](NCC(=O)NCc2cccc(C(=O)NC3CC3)c2)C(C)C)cc1 ZINC000539241955 938824177 /nfs/dbraw/zinc/82/41/77/938824177.db2.gz OMBRIPAKWZEXPR-VWLOTQADSA-N 0 3 421.585 4.305 20 0 HIADHN CC[C@H](NCC(=O)Nc1ccc(NC(C)=O)cc1C(F)(F)F)c1ccc(OC)cc1 ZINC000539242785 938824595 /nfs/dbraw/zinc/82/45/95/938824595.db2.gz BHNOTOACQUSICL-SFHVURJKSA-N 0 3 423.435 4.352 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)N[C@@H]1CCO[C@@H]1c1ccc(Cl)cc1 ZINC000539250506 938825778 /nfs/dbraw/zinc/82/57/78/938825778.db2.gz AOHKTYWXNOWTLY-YPAWHYETSA-N 0 3 413.949 4.306 20 0 HIADHN C[C@H](NCC(=O)NCc1ccccc1OC1CCCC1)c1ccccc1-n1cccn1 ZINC000539259853 938828810 /nfs/dbraw/zinc/82/88/10/938828810.db2.gz AAHNPDKAOXVKJF-IBGZPJMESA-N 0 3 418.541 4.161 20 0 HIADHN C[C@@H](NCC(=O)NCc1ccccc1OC1CCCC1)c1ccccc1-n1cccn1 ZINC000539259854 938828852 /nfs/dbraw/zinc/82/88/52/938828852.db2.gz AAHNPDKAOXVKJF-LJQANCHMSA-N 0 3 418.541 4.161 20 0 HIADHN Cc1ccc(-c2csc(NC(=O)CN[C@H](c3ccccc3)[C@@H]3CCOC3)n2)cc1 ZINC000539298343 938836173 /nfs/dbraw/zinc/83/61/73/938836173.db2.gz PATIVFILENJFRC-DENIHFKCSA-N 0 3 407.539 4.424 20 0 HIADHN O[C@H](CN[C@@H](COc1ccccc1)c1ccccc1)COc1cccc2[nH]ccc21 ZINC000539320385 938840757 /nfs/dbraw/zinc/84/07/57/938840757.db2.gz RUKYEZOWVQRDPO-YKSBVNFPSA-N 0 3 402.494 4.318 20 0 HIADHN CC(C)(C)[C@@H](NCCC(=O)Nc1ccc(C(N)=O)c(Cl)c1)c1ccc(F)cc1F ZINC000539324763 938841296 /nfs/dbraw/zinc/84/12/96/938841296.db2.gz FKZIZAXIWONOKP-IBGZPJMESA-N 0 3 423.891 4.423 20 0 HIADHN O=C(CN[C@H](C[C@H]1CCOC1)c1ccccc1)Nc1ccc2c(c1)OC1(CCCC1)O2 ZINC000539325261 938841572 /nfs/dbraw/zinc/84/15/72/938841572.db2.gz GLTOUYMPYHCOGN-WIYYLYMNSA-N 0 3 422.525 4.424 20 0 HIADHN CC(=O)Nc1ccc(OC[C@H](O)CN[C@H](c2ccccc2F)C2CCCC2)cc1 ZINC000539325824 938841964 /nfs/dbraw/zinc/84/19/64/938841964.db2.gz PISBDRHZHOMXGD-XXBNENTESA-N 0 3 400.494 4.045 20 0 HIADHN CC(C)[C@@H](NCC(=O)Nc1ccc(C(=O)N(C)C)cc1)c1ccc(C(F)(F)F)cc1 ZINC000539326297 938842090 /nfs/dbraw/zinc/84/20/90/938842090.db2.gz SOXTXWPWCXJWOU-HXUWFJFHSA-N 0 3 421.463 4.333 20 0 HIADHN O=C(CN[C@H](C[C@@H]1CCOC1)c1ccccc1)Nc1ccc(Br)cc1F ZINC000539334710 938843629 /nfs/dbraw/zinc/84/36/29/938843629.db2.gz GQHDGCNNSLMAPP-IFXJQAMLSA-N 0 3 421.310 4.284 20 0 HIADHN NC(=O)CSc1ccccc1NC(=O)CN[C@@H](CC1CCCC1)c1ccccc1 ZINC000539335572 938843883 /nfs/dbraw/zinc/84/38/83/938843883.db2.gz HGWSNTJMOGASPG-FQEVSTJZSA-N 0 3 411.571 4.114 20 0 HIADHN CC[C@@H](NCCOC(c1ccccc1)c1ccccc1)c1cccc(S(N)(=O)=O)c1 ZINC000539368176 938849841 /nfs/dbraw/zinc/84/98/41/938849841.db2.gz GOCOXWHWYDKAPQ-HSZRJFAPSA-N 0 3 424.566 4.181 20 0 HIADHN Cc1cc(NC(=O)c2cc(=O)[nH]c(C(C)C)c2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000539370080 938850232 /nfs/dbraw/zinc/85/02/32/938850232.db2.gz DAVVVQATMHEWSQ-FQEVSTJZSA-N 0 3 419.529 4.115 20 0 HIADHN Cc1cc([C@H](NCC(=O)N2CCC[C@H]2c2ccc3c(c2)OCCO3)C2CC2)ccc1F ZINC000539422759 938858162 /nfs/dbraw/zinc/85/81/62/938858162.db2.gz FJTGNMHHFIUKRY-SQJMNOBHSA-N 0 3 424.516 4.310 20 0 HIADHN Cc1cc([C@H](N[C@H](C)C(=O)Nc2ccc(N3CCCC3=O)cc2)C2CC2)ccc1F ZINC000539425017 938858693 /nfs/dbraw/zinc/85/86/93/938858693.db2.gz QXZISKBCXJJENB-WAIKUNEKSA-N 0 3 409.505 4.329 20 0 HIADHN Cc1ccccc1[C@@H](NCC(=O)Nc1cc2c(cc1Cl)OCCCO2)C1CC1 ZINC000539490263 938867704 /nfs/dbraw/zinc/86/77/04/938867704.db2.gz BKRXUNAFWFSEPQ-QFIPXVFZSA-N 0 3 400.906 4.489 20 0 HIADHN Cc1cc(NC(=O)CN[C@H](COc2ccccc2F)C(C)(C)C)n(C(C)(C)C)n1 ZINC000539492570 938868220 /nfs/dbraw/zinc/86/82/20/938868220.db2.gz CHKZJGVCOJCYPI-GOSISDBHSA-N 0 3 404.530 4.107 20 0 HIADHN COc1ccc([C@H](NCC(=O)N(C)Cc2cc(Br)cs2)C2CC2)cc1 ZINC000539493126 938868228 /nfs/dbraw/zinc/86/82/28/938868228.db2.gz MYLCUMKHNGWQMY-LJQANCHMSA-N 0 3 423.376 4.219 20 0 HIADHN CCOc1cccc2cc([C@H](C)N[C@@H](CN3CCN(C)CC3)c3ccccc3)oc21 ZINC000539497799 938868908 /nfs/dbraw/zinc/86/89/08/938868908.db2.gz YETUQIJTBBWBEP-UGKGYDQZSA-N 0 3 407.558 4.471 20 0 HIADHN CCc1c2ccccc2oc1[C@H](C)NCc1ccc(C(=O)N2CCN(C)CC2)cc1 ZINC000539498747 938869250 /nfs/dbraw/zinc/86/92/50/938869250.db2.gz WLEUYXQFLXRWNH-SFHVURJKSA-N 0 3 405.542 4.234 20 0 HIADHN COc1ccc([C@H](C)NCCCN(C(=O)C2CCC2)C2CC2)c(Br)c1 ZINC000539509368 938870840 /nfs/dbraw/zinc/87/08/40/938870840.db2.gz YTTKKQMWCXZFEO-AWEZNQCLSA-N 0 3 409.368 4.290 20 0 HIADHN COc1cc(Cl)c(C)cc1NC(=O)CCNCc1cn(-c2ccccc2)nc1C ZINC000539530496 938874067 /nfs/dbraw/zinc/87/40/67/938874067.db2.gz CFFOPGRRRHWHJJ-UHFFFAOYSA-N 0 3 412.921 4.270 20 0 HIADHN CCOC(=O)c1c2c(sc1NC(=O)[C@@H]1CCC(=O)C[C@H]1C)C(C)(C)NC(C)(C)C2 ZINC000539550227 938878652 /nfs/dbraw/zinc/87/86/52/938878652.db2.gz CJCITCFANRTUSF-TZMCWYRMSA-N 0 3 420.575 4.028 20 0 HIADHN CCN1CCN(Cc2ccc(N[C@@H](C)c3cc(OC)c(OC)cc3F)cc2)CC1 ZINC000539639392 938892223 /nfs/dbraw/zinc/89/22/23/938892223.db2.gz XNAWMWOSHHEDIM-KRWDZBQOSA-N 0 3 401.526 4.154 20 0 HIADHN CCN1CCN(Cc2ccc(N[C@H](C)c3cc(OC)c(OC)cc3F)cc2)CC1 ZINC000539639393 938892295 /nfs/dbraw/zinc/89/22/95/938892295.db2.gz XNAWMWOSHHEDIM-QGZVFWFLSA-N 0 3 401.526 4.154 20 0 HIADHN COc1ccc(NC(=O)C[C@H](C)NC2(c3ccc(F)cc3F)CCC2)c(OC)c1 ZINC000539649628 938893867 /nfs/dbraw/zinc/89/38/67/938893867.db2.gz WHXQVTYWLPOGGU-AWEZNQCLSA-N 0 3 404.457 4.368 20 0 HIADHN COc1ccc([C@@H](C)Nc2ccc3c(c2)n(C)c(=O)n3C)cc1CN1CCCCC1 ZINC000539655298 938894755 /nfs/dbraw/zinc/89/47/55/938894755.db2.gz PAFSUBWVZSOTPS-QGZVFWFLSA-N 0 3 408.546 4.045 20 0 HIADHN CC(=O)c1ccc(C(=O)Nc2c(C)cnn2[C@H]2CCN(Cc3ccccc3)C2)c(F)c1 ZINC000539667021 938897327 /nfs/dbraw/zinc/89/73/27/938897327.db2.gz QEZGIVJVSDGQRL-FQEVSTJZSA-N 0 3 420.488 4.233 20 0 HIADHN Cc1cc(C(=O)Nc2cccc(CN3CCC(O)CC3)c2)nn1-c1cc(C)cc(C)c1 ZINC000539675497 938898825 /nfs/dbraw/zinc/89/88/25/938898825.db2.gz YVHCWDPEZDQYAT-UHFFFAOYSA-N 0 3 418.541 4.007 20 0 HIADHN CN(C)[C@@H](CNC(=O)Nc1ccc2nc(-c3ccccn3)oc2c1)Cc1ccccc1 ZINC000539725883 938914149 /nfs/dbraw/zinc/91/41/49/938914149.db2.gz QZGVNQJCYFNEKX-LJQANCHMSA-N 0 3 415.497 4.184 20 0 HIADHN CNC(=O)CC1CCN(Cc2cn(-c3ccccc3)nc2-c2ccc(F)cc2)CC1 ZINC000539817414 938941028 /nfs/dbraw/zinc/94/10/28/938941028.db2.gz YETPKTOYPDOIPP-UHFFFAOYSA-N 0 3 406.505 4.027 20 0 HIADHN Brc1ccc(-c2ccc(CN3CCN(C4CCOCC4)CC3)o2)cc1 ZINC000539817069 938941327 /nfs/dbraw/zinc/94/13/27/938941327.db2.gz BBLJEBZQOIWODX-UHFFFAOYSA-N 0 3 405.336 4.006 20 0 HIADHN COCCCOC1CCN(Cc2ccc(OCc3cn4cccc(C)c4n3)cc2)CC1 ZINC000539817934 938941811 /nfs/dbraw/zinc/94/18/11/938941811.db2.gz XCPBLDZYDUICLY-UHFFFAOYSA-N 0 3 423.557 4.239 20 0 HIADHN COCCOC[C@@H]1CCN(Cc2cn(C(C)(C)C)nc2-c2ccccc2Cl)C1 ZINC000539820503 938944605 /nfs/dbraw/zinc/94/46/05/938944605.db2.gz OGNOAYCVBVQODZ-QGZVFWFLSA-N 0 3 405.970 4.443 20 0 HIADHN COc1cc(N[C@@H]2CCCN(Cc3c[nH]nc3-c3ccc(F)cc3)C2)cc(OC)c1 ZINC000539849779 938956979 /nfs/dbraw/zinc/95/69/79/938956979.db2.gz LYWVENOPCIFQNY-LJQANCHMSA-N 0 3 410.493 4.310 20 0 HIADHN CCCN(CC(F)(F)F)C(=O)[C@@H]1CCCN(Cc2ccc(OCC)c(OC)c2)C1 ZINC000539851070 938957630 /nfs/dbraw/zinc/95/76/30/938957630.db2.gz UDKATRBGIVVFHH-QGZVFWFLSA-N 0 3 416.484 4.107 20 0 HIADHN CC(C)(C)OC(=O)C1CCC(NC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)CC1 ZINC000539908944 938975912 /nfs/dbraw/zinc/97/59/12/938975912.db2.gz YCYZZCSJSHKZFD-SCCNAQOGSA-N 0 3 418.553 4.054 20 0 HIADHN CCOc1ccc(C(=O)N[C@H](CN2CCCC2)c2ccc(OC)cc2)cc1OCC ZINC000539932621 938978984 /nfs/dbraw/zinc/97/89/84/938978984.db2.gz VHEAIVITIOQWAK-OAQYLSRUSA-N 0 3 412.530 4.060 20 0 HIADHN O=C(CCc1nccs1)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1 ZINC000540023565 939041822 /nfs/dbraw/zinc/04/18/22/939041822.db2.gz LICZGRXUBJSKCW-UHFFFAOYSA-N 0 3 420.582 4.079 20 0 HIADHN C[C@H](CC(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1)Cc1ccc(Cl)cc1 ZINC000540054476 939051879 /nfs/dbraw/zinc/05/18/79/939051879.db2.gz RVJLSWGAXNQLGO-IPMKNSEASA-N 0 3 406.998 4.257 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2ccc3nc(C(F)F)[nH]c3c2)N2CCCC2)o1 ZINC000540079987 939061360 /nfs/dbraw/zinc/06/13/60/939061360.db2.gz MOEPHLMGEHNHNY-INIZCTEOSA-N 0 3 403.433 4.361 20 0 HIADHN CCc1nc2ccccc2n1C1CCN(C(=O)[C@@H]2CCCN2Cc2ccccc2)CC1 ZINC000540120551 939080417 /nfs/dbraw/zinc/08/04/17/939080417.db2.gz TVDHSVODISLQJG-DEOSSOPVSA-N 0 3 416.569 4.427 20 0 HIADHN CCOc1ccc([C@H](C)N[C@H](C)c2cccc(NS(C)(=O)=O)c2)cc1OCC ZINC000540121525 939080525 /nfs/dbraw/zinc/08/05/25/939080525.db2.gz ZKNPGDKTEULSBR-CVEARBPZSA-N 0 3 406.548 4.267 20 0 HIADHN CCOc1ccc([C@@H](C)N[C@H](C)c2cccc(NS(C)(=O)=O)c2)cc1OCC ZINC000540121527 939080917 /nfs/dbraw/zinc/08/09/17/939080917.db2.gz ZKNPGDKTEULSBR-HZPDHXFCSA-N 0 3 406.548 4.267 20 0 HIADHN CCOc1cc(Cl)ccc1CN[C@H](C)CC(=O)Nc1ccc(OC)cc1OC ZINC000540142826 939089537 /nfs/dbraw/zinc/08/95/37/939089537.db2.gz HNWHVEZHRFHYKA-CQSZACIVSA-N 0 3 406.910 4.263 20 0 HIADHN CCN(CC)C(=O)Nc1ccc([C@@H](C)N[C@H]2CCN(Cc3ccccc3)C2=O)cc1 ZINC000540145910 939090695 /nfs/dbraw/zinc/09/06/95/939090695.db2.gz ZJBYUHFZMZTRLK-GCJKJVERSA-N 0 3 408.546 4.012 20 0 HIADHN C[C@H](CN[C@@H](C)c1ccc(-c2ccccc2Br)s1)S(C)(=O)=O ZINC000540145797 939090800 /nfs/dbraw/zinc/09/08/00/939090800.db2.gz XSDZYXLDQUZLRS-NEPJUHHUSA-N 0 3 402.379 4.261 20 0 HIADHN CCC[C@H](NC[C@H](O)CS(=O)(=O)c1cccs1)c1ccc(Cl)c(Cl)c1 ZINC000540149573 939092007 /nfs/dbraw/zinc/09/20/07/939092007.db2.gz VZHABCNYUMAPDW-BBRMVZONSA-N 0 3 422.399 4.321 20 0 HIADHN Cc1cccc([C@@H](C)NCc2ccccc2CS(=O)(=O)N2CCC(C)CC2)c1 ZINC000540150320 939093059 /nfs/dbraw/zinc/09/30/59/939093059.db2.gz IMRBMBOZCOYZGU-HXUWFJFHSA-N 0 3 400.588 4.408 20 0 HIADHN C[C@@H](COc1ccc2cc(Br)ccc2c1)N[C@H](CO)CC(F)(F)F ZINC000540154825 939094352 /nfs/dbraw/zinc/09/43/52/939094352.db2.gz ZJLKEDWLJXHISE-NHYWBVRUSA-N 0 3 406.242 4.273 20 0 HIADHN Cc1ccc(NC(=O)C[C@H](C)N[C@H]2CC(=O)N(C)[C@@H]2c2ccc(Cl)cc2)c(C)c1 ZINC000540162242 939097199 /nfs/dbraw/zinc/09/71/99/939097199.db2.gz GUPNUVKYGZOXJJ-ITSWEJNFSA-N 0 3 413.949 4.236 20 0 HIADHN C[C@H](NCCOc1ccc(Cl)cn1)c1ccc(S(=O)(=O)C2CCCC2)cc1 ZINC000540164667 939098323 /nfs/dbraw/zinc/09/83/23/939098323.db2.gz KVNWIBUAVBACDN-HNNXBMFYSA-N 0 3 408.951 4.181 20 0 HIADHN O=C(NCCN[C@H]1CCCOc2cc(Br)ccc21)c1ccccc1Cl ZINC000540174670 939104676 /nfs/dbraw/zinc/10/46/76/939104676.db2.gz OBBNTTRJIUIIMO-KRWDZBQOSA-N 0 3 423.738 4.336 20 0 HIADHN C[C@@H]1C[C@H](NCc2cccc(NS(C)(=O)=O)c2)c2cccc(Br)c21 ZINC000540176391 939105695 /nfs/dbraw/zinc/10/56/95/939105695.db2.gz PCQMKPBTIVAUGJ-PXAZEXFGSA-N 0 3 409.349 4.159 20 0 HIADHN Cc1c([C@@H](C)NC2CCN(C(=O)NC3CCCCC3)CC2)nnn1-c1ccc(C)cc1 ZINC000540182300 939108577 /nfs/dbraw/zinc/10/85/77/939108577.db2.gz UAZMUBPTDTVALA-GOSISDBHSA-N 0 3 424.593 4.041 20 0 HIADHN CC[C@H](NCc1cccc(C(=O)NCc2ccco2)c1)c1ccc2c(c1)OCCO2 ZINC000540187691 939111890 /nfs/dbraw/zinc/11/18/90/939111890.db2.gz BMMLUCNFMYRZEK-NRFANRHFSA-N 0 3 406.482 4.222 20 0 HIADHN C[C@@H](NCc1ccc(S(=O)(=O)N2CCCCC2)cc1)c1cc2c(s1)CCC2 ZINC000540193004 939118610 /nfs/dbraw/zinc/11/86/10/939118610.db2.gz YLUXQDQJCUCTRM-MRXNPFEDSA-N 0 3 404.601 4.262 20 0 HIADHN COc1ccc(C(=O)NCCN[C@H](C)c2csc(-c3csc(C)n3)c2)cc1 ZINC000540195409 939119676 /nfs/dbraw/zinc/11/96/76/939119676.db2.gz RYTIHLVHDSWQEX-CYBMUJFWSA-N 0 3 401.557 4.269 20 0 HIADHN Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)N[C@@H](C)c1ccc(S(N)(=O)=O)cc1 ZINC000540300005 939187285 /nfs/dbraw/zinc/18/72/85/939187285.db2.gz GIXHOZJLTMTWMB-QWHCGFSZSA-N 0 3 419.547 4.317 20 0 HIADHN CC(C)[C@@H](NCc1cccc(NC(=O)[C@H]2CCCO2)c1)c1ccc2[nH]c(=O)oc2c1 ZINC000540302904 939187752 /nfs/dbraw/zinc/18/77/52/939187752.db2.gz VPOYEOTYWNHRMF-TZIWHRDSSA-N 0 3 409.486 4.138 20 0 HIADHN COc1ccc(C[C@H](NCC(=O)NCc2ccc(F)cc2)c2ccccc2)cc1OC ZINC000540352304 939203605 /nfs/dbraw/zinc/20/36/05/939203605.db2.gz PYSIIXGSYIJEQI-QFIPXVFZSA-N 0 3 422.500 4.033 20 0 HIADHN COc1ccc(NC(=O)CN[C@@H](Cc2ccc(OC)c(OC)c2)c2ccccc2)cc1 ZINC000540359906 939209672 /nfs/dbraw/zinc/20/96/72/939209672.db2.gz MCZHRYSRABDPKP-QFIPXVFZSA-N 0 3 420.509 4.225 20 0 HIADHN C[C@H](NCC(=O)NC(=O)NCC(F)(F)F)c1ccccc1-c1ccc(Cl)cc1 ZINC000540386814 939223224 /nfs/dbraw/zinc/22/32/24/939223224.db2.gz VLXFMDMHXYDOCC-LBPRGKRZSA-N 0 3 413.827 4.046 20 0 HIADHN O=C(CN[C@H](c1ccccc1)[C@@H]1CCOC1)N[C@H](c1cccs1)c1ccccc1 ZINC000540395209 939232540 /nfs/dbraw/zinc/23/25/40/939232540.db2.gz QZNCCAGOYXXYRI-HUVFLSCGSA-N 0 3 406.551 4.321 20 0 HIADHN COc1ccc(OC)c([C@@H]2CCCN2C(=O)CNC2(c3ccccc3)CCCC2)c1 ZINC000540394625 939232637 /nfs/dbraw/zinc/23/26/37/939232637.db2.gz ZVSXRXJZJVVVKA-QFIPXVFZSA-N 0 3 408.542 4.426 20 0 HIADHN CCCC[C@@H](NCC(=O)Nc1ccccc1N1CCCC1=O)c1ccc(OC)cc1 ZINC000540401300 939235542 /nfs/dbraw/zinc/23/55/42/939235542.db2.gz UXIAXVPIDVXGAF-HXUWFJFHSA-N 0 3 409.530 4.282 20 0 HIADHN Cc1cc(C)cc([C@H](C)NCC(=O)N2c3ccccc3NC(=O)C[C@@H]2C(F)(F)F)c1 ZINC000540410426 939238803 /nfs/dbraw/zinc/23/88/03/939238803.db2.gz XZMXJFFGWUPFGI-HNAYVOBHSA-N 0 3 419.447 4.260 20 0 HIADHN O=C(CN[C@@H](C[C@H]1CCOC1)c1ccccc1)Nc1ccnn1CC1CCCCC1 ZINC000540432644 939246833 /nfs/dbraw/zinc/24/68/33/939246833.db2.gz JWNBUECZVCSVFC-IRLDBZIGSA-N 0 3 410.562 4.159 20 0 HIADHN CCN(C(=O)CN[C@@H](C[C@H]1CCOC1)c1ccccc1)c1nc2ccccc2s1 ZINC000540434781 939247480 /nfs/dbraw/zinc/24/74/80/939247480.db2.gz UHUQGXRDNHLKDW-XLIONFOSSA-N 0 3 409.555 4.407 20 0 HIADHN C[C@H](NCC(=O)N[C@H](c1cccs1)c1ccccc1)c1ccc(-n2cccn2)cc1 ZINC000540435301 939247918 /nfs/dbraw/zinc/24/79/18/939247918.db2.gz NWTJIXYMKVQONE-UUOWRZLLSA-N 0 3 416.550 4.490 20 0 HIADHN COc1cc(C(C)=O)ccc1OC[C@H](O)CN[C@@H](C)c1ccccc1C(F)(F)F ZINC000540443034 939251990 /nfs/dbraw/zinc/25/19/90/939251990.db2.gz GPWYFIAQUMSKNV-XJKSGUPXSA-N 0 3 411.420 4.007 20 0 HIADHN CC(C)[C@@H](NC(=O)CN[C@H](c1cccs1)C1CC1)c1ccc2c(c1)OCCCO2 ZINC000540466553 939264205 /nfs/dbraw/zinc/26/42/05/939264205.db2.gz KIPNHRHCELFMLF-PKTZIBPZSA-N 0 3 414.571 4.464 20 0 HIADHN C[C@@H](CCO)C1(CNC(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)CCC1 ZINC000540492944 939273259 /nfs/dbraw/zinc/27/32/59/939273259.db2.gz QZHPWTHVEIJEGZ-RBUKOAKNSA-N 0 3 407.624 4.009 20 0 HIADHN C[C@H](CCO)C1(CNC(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)CCC1 ZINC000540492945 939273396 /nfs/dbraw/zinc/27/33/96/939273396.db2.gz QZHPWTHVEIJEGZ-RTBURBONSA-N 0 3 407.624 4.009 20 0 HIADHN CC[C@H](NCc1cccc(CS(C)(=O)=O)c1)c1cc(F)cc(Br)c1 ZINC000540593472 939313889 /nfs/dbraw/zinc/31/38/89/939313889.db2.gz GTYGVINSBSHBAG-SFHVURJKSA-N 0 3 414.340 4.374 20 0 HIADHN COc1ccc([C@H](C)NC2CCN(C(=O)c3ccccc3)CC2)c(Br)c1 ZINC000540593706 939314382 /nfs/dbraw/zinc/31/43/82/939314382.db2.gz JQWSINVNSMXLEJ-HNNXBMFYSA-N 0 3 417.347 4.413 20 0 HIADHN Brc1cccc(C2(NCc3ccc(N4CCCC4)nc3)CCOCC2)c1 ZINC000540598240 939315967 /nfs/dbraw/zinc/31/59/67/939315967.db2.gz CGLUSDUPTJBYHT-UHFFFAOYSA-N 0 3 416.363 4.240 20 0 HIADHN CC(C)(COc1ncccc1Br)NCc1cnn(Cc2ccccc2)c1 ZINC000540626352 939323302 /nfs/dbraw/zinc/32/33/02/939323302.db2.gz GQLJGHKOGHZQMA-UHFFFAOYSA-N 0 3 415.335 4.036 20 0 HIADHN CC(C)N1CC[C@@H](NCc2cnc(N3CCCC3)nc2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000540716595 939346719 /nfs/dbraw/zinc/34/67/19/939346719.db2.gz AGKLWGJXVXKQAU-RTWAWAEBSA-N 0 3 417.960 4.183 20 0 HIADHN CNS(=O)(=O)c1ccc([C@H](C)NC2(c3cccc(C(F)(F)F)c3)CCC2)cc1 ZINC000540753856 939360033 /nfs/dbraw/zinc/36/00/33/939360033.db2.gz UGURAKPRTUEZDH-AWEZNQCLSA-N 0 3 412.477 4.344 20 0 HIADHN C[C@@H](N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1)c1ccc(-n2ccnc2)cc1 ZINC000540754654 939360560 /nfs/dbraw/zinc/36/05/60/939360560.db2.gz WGXMZTVVTAAMFM-RLWLMLJZSA-N 0 3 424.548 4.451 20 0 HIADHN COc1ccc(NC(=O)C[C@H](C)N[C@H]2CCCOc3cc(F)ccc32)c(OC)c1 ZINC000540778592 939368907 /nfs/dbraw/zinc/36/89/07/939368907.db2.gz LRXKHIJNKIIBIK-KSSFIOAISA-N 0 3 402.466 4.064 20 0 HIADHN COc1ccc(NC(=O)C[C@@H](C)N[C@@H]2CCCOc3cc(F)ccc32)c(OC)c1 ZINC000540778593 939369074 /nfs/dbraw/zinc/36/90/74/939369074.db2.gz LRXKHIJNKIIBIK-RDTXWAMCSA-N 0 3 402.466 4.064 20 0 HIADHN CC(C)CS(=O)(=O)N1CCC(N[C@H](C)c2cc(F)c(Cl)cc2Cl)CC1 ZINC000540779668 939369593 /nfs/dbraw/zinc/36/95/93/939369593.db2.gz WTKKSATVRWMGPY-GFCCVEGCSA-N 0 3 411.370 4.233 20 0 HIADHN COc1ccc(C2(C(=O)N[C@H]3CCN(C)[C@@H]3c3ccccc3)CCCC2)cc1OC ZINC000540805476 939378678 /nfs/dbraw/zinc/37/86/78/939378678.db2.gz RCMASRWDPPPEKQ-NZQKXSOJSA-N 0 3 408.542 4.077 20 0 HIADHN COC(=O)c1ccc(CN2CCC[C@@H](c3nnc(C4CCCCC4)[nH]3)C2)cc1F ZINC000540862298 939399738 /nfs/dbraw/zinc/39/97/38/939399738.db2.gz DZCVFOYWKODLAA-QGZVFWFLSA-N 0 3 400.498 4.158 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)N[C@@H]1CCCOc2cc(F)ccc21 ZINC000540861631 939399771 /nfs/dbraw/zinc/39/97/71/939399771.db2.gz LJGIBDULBBWZRK-HXUWFJFHSA-N 0 3 421.463 4.091 20 0 HIADHN C[C@@H](C(=O)N1CCc2ccccc2C1)N1CCC[C@H](c2nc(C3CCCCC3)n[nH]2)C1 ZINC000540866488 939403344 /nfs/dbraw/zinc/40/33/44/939403344.db2.gz VHQOERYZLVJPTQ-AVRDEDQJSA-N 0 3 421.589 4.005 20 0 HIADHN O[C@@H](COc1ccc2ccccc2c1)CN1CCC2(CC1)OCCc1ccsc12 ZINC000540911986 939416227 /nfs/dbraw/zinc/41/62/27/939416227.db2.gz TYNATZVDVGANDS-OAQYLSRUSA-N 0 3 409.551 4.205 20 0 HIADHN OC[C@H](NC[C@H](O)COc1c(Cl)cccc1Cl)c1ccc(C(F)(F)F)cc1 ZINC000541023980 939433296 /nfs/dbraw/zinc/43/32/96/939433296.db2.gz UEJHFRQTLDMAIM-BBRMVZONSA-N 0 3 424.246 4.075 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)NCC(=O)N(Cc2ccc(C)cc2)C2CC2)cc1 ZINC000541027109 939434263 /nfs/dbraw/zinc/43/42/63/939434263.db2.gz MTKMQYAHRMMMSC-IBGZPJMESA-N 0 3 402.542 4.331 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)NCC(=O)NCCSc2ccc(C)cc2)cc1 ZINC000541027225 939434944 /nfs/dbraw/zinc/43/49/44/939434944.db2.gz PILANDISQBAQOE-SFHVURJKSA-N 0 3 408.571 4.048 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)NCC(=O)NCc2ccccc2COC(C)C)cc1 ZINC000541029399 939435678 /nfs/dbraw/zinc/43/56/78/939435678.db2.gz ZOKSQKJROUQQQB-IBGZPJMESA-N 0 3 420.557 4.073 20 0 HIADHN CCN1CC[C@H](NCc2ccc(Br)cn2)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000541065676 939447369 /nfs/dbraw/zinc/44/73/69/939447369.db2.gz VSJYHEPIDZHVPL-WMZOPIPTSA-N 0 3 414.269 4.187 20 0 HIADHN CCN1CC[C@@H](NCc2ccc(OC)c(OC)c2OC)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000541084527 939454300 /nfs/dbraw/zinc/45/43/00/939454300.db2.gz LNOXYMZIOIUSDG-YLJYHZDGSA-N 0 3 424.463 4.055 20 0 HIADHN CCN1CC[C@H](NCc2ccc(OC)c(OC)c2OC)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000541084519 939454408 /nfs/dbraw/zinc/45/44/08/939454408.db2.gz LNOXYMZIOIUSDG-PXNSSMCTSA-N 0 3 424.463 4.055 20 0 HIADHN COc1cccc(F)c1[C@@H](C)NCC1(CN[C@@H](C)c2c(F)cccc2OC)COC1 ZINC000541123701 939469199 /nfs/dbraw/zinc/46/91/99/939469199.db2.gz ZXHCWMHVYLJNRH-IYBDPMFKSA-N 0 3 420.500 4.000 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)CCc1ccc(Br)cc1OC ZINC000541149203 939476190 /nfs/dbraw/zinc/47/61/90/939476190.db2.gz GSMPVOAWTRHWMS-UHFFFAOYSA-N 0 3 421.335 4.099 20 0 HIADHN C[C@@H](CCc1n[nH]c2ccccc21)N[C@@H](CCO)c1ccccc1Br ZINC000541153021 939478162 /nfs/dbraw/zinc/47/81/62/939478162.db2.gz DEUAVJKARMCAOK-KSSFIOAISA-N 0 3 402.336 4.360 20 0 HIADHN COc1ccc([C@H](NCCCc2ccsc2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000541168598 939483991 /nfs/dbraw/zinc/48/39/91/939483991.db2.gz RBLXIKVZFCJTMF-QFIPXVFZSA-N 0 3 415.580 4.472 20 0 HIADHN O[C@@H](CN[C@H](Cc1ccc(Cl)cc1)c1ccccn1)COCc1ccccc1F ZINC000541194780 939485164 /nfs/dbraw/zinc/48/51/64/939485164.db2.gz VMPNDQHNKFJOKN-NZQKXSOJSA-N 0 3 414.908 4.325 20 0 HIADHN COc1cccc(CN(C)C(=O)CN[C@@H](c2ccc(Cl)cc2)C2CC2)c1OC ZINC000541204808 939485521 /nfs/dbraw/zinc/48/55/21/939485521.db2.gz WQIBFPARMDCTSS-OAQYLSRUSA-N 0 3 402.922 4.057 20 0 HIADHN COc1cccc(C[C@H](C)N[C@@H](c2ccc(C)cc2)c2cccc(S(C)(=O)=O)c2)n1 ZINC000541207574 939485673 /nfs/dbraw/zinc/48/56/73/939485673.db2.gz YROBEBBCYUOAHZ-UUOWRZLLSA-N 0 3 424.566 4.112 20 0 HIADHN COc1cccc(C[C@@H](C)N[C@H](c2ccc(C)cc2)c2cccc(S(C)(=O)=O)c2)n1 ZINC000541207566 939485721 /nfs/dbraw/zinc/48/57/21/939485721.db2.gz YROBEBBCYUOAHZ-HOYKHHGWSA-N 0 3 424.566 4.112 20 0 HIADHN COc1ccc(CN[C@H](C)CC(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)cn1 ZINC000541209516 939485735 /nfs/dbraw/zinc/48/57/35/939485735.db2.gz MVPLMGKNROOTTM-LLVKDONJSA-N 0 3 401.816 4.269 20 0 HIADHN COC(=O)c1cccc(NC(=O)C[C@@H](C)N[C@@H]2CCSc3c(F)cccc32)c1 ZINC000541210501 939485791 /nfs/dbraw/zinc/48/57/91/939485791.db2.gz PVCWQNFLYXFAHE-FZKQIMNGSA-N 0 3 402.491 4.156 20 0 HIADHN O[C@@H](COc1ccccc1C(F)(F)F)CN1CCC(OCC2CCCC2)CC1 ZINC000541351059 939494999 /nfs/dbraw/zinc/49/49/99/939494999.db2.gz HVJMAXTXAQNJOB-QGZVFWFLSA-N 0 3 401.469 4.116 20 0 HIADHN CCN(C(=O)c1cnn(CCC(F)(F)F)c1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000541393700 939504673 /nfs/dbraw/zinc/50/46/73/939504673.db2.gz MCIPXIHWJWOFQT-APWZRJJASA-N 0 3 408.468 4.133 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1cc(C)n([C@@H](C)C2CC2)n1)c1cccc(OC)c1 ZINC000541462326 939524994 /nfs/dbraw/zinc/52/49/94/939524994.db2.gz HMQFAXBRONVFDP-UWJYYQICSA-N 0 3 413.566 4.376 20 0 HIADHN COc1cc(OC)cc(N2CCCN(Cc3cn(C)nc3C3CCCCC3)CC2)c1 ZINC000541538671 939547388 /nfs/dbraw/zinc/54/73/88/939547388.db2.gz UMDOJKTXQYLPIU-UHFFFAOYSA-N 0 3 412.578 4.197 20 0 HIADHN Cc1ccccc1[C@H](CN1CCOCC1)NCc1ccc(OCC(F)(F)F)cc1 ZINC000541549966 939552620 /nfs/dbraw/zinc/55/26/20/939552620.db2.gz MSGHSGDRUUGBAM-NRFANRHFSA-N 0 3 408.464 4.099 20 0 HIADHN Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)NC[C@@H](O)COc1c(C)ccc(C)c1C ZINC000541600636 939564882 /nfs/dbraw/zinc/56/48/82/939564882.db2.gz OWLLGDKWRGIFCJ-CRAIPNDOSA-N 0 3 413.484 4.078 20 0 HIADHN Cc1cc(Br)ccc1NC(=O)CCNCc1cnc([C@H]2CCCO2)s1 ZINC000541763345 939624240 /nfs/dbraw/zinc/62/42/40/939624240.db2.gz LRVOOCPEOVREHA-MRXNPFEDSA-N 0 3 424.364 4.184 20 0 HIADHN COc1cc(CN2CCCSCC2)ccc1OCC(=O)Nc1ccccc1Cl ZINC000541764483 939624308 /nfs/dbraw/zinc/62/43/08/939624308.db2.gz IVPXRNTXBLMYPB-UHFFFAOYSA-N 0 3 420.962 4.305 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@H]2NCc2ccccc2-n2cccn2)cc1 ZINC000541768372 939625747 /nfs/dbraw/zinc/62/57/47/939625747.db2.gz UEXMYQKCUCWFEP-FYYLOGMGSA-N 0 3 409.555 4.055 20 0 HIADHN C[C@@H]1C[C@@H](N[C@@H](c2cccc(S(C)(=O)=O)c2)c2ccc(F)c(F)c2)C[C@H](C)O1 ZINC000541847742 939646722 /nfs/dbraw/zinc/64/67/22/939646722.db2.gz FJDHFMDPWLDBKW-NFYPIIHDSA-N 0 3 409.498 4.003 20 0 HIADHN Cc1ccc(-n2nc(-c3ccco3)cc2NC(=O)N[C@H](C)C2=CCN(C)CC2)cc1 ZINC000541906647 939651012 /nfs/dbraw/zinc/65/10/12/939651012.db2.gz SLLLOJIDAWXAGT-QGZVFWFLSA-N 0 3 405.502 4.213 20 0 HIADHN Cc1cc(NC(=O)N[C@H](C)C2=CCN(C)CC2)nn1-c1ccc(Cl)cc1Cl ZINC000541907402 939651042 /nfs/dbraw/zinc/65/10/42/939651042.db2.gz MWNQMVJTUNPHAD-CYBMUJFWSA-N 0 3 408.333 4.259 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@@H](C)N[C@H](C)c2ccc(NC(C)=O)cc2)cc1 ZINC000541912947 939651810 /nfs/dbraw/zinc/65/18/10/939651810.db2.gz RIMBQPOEOZLHIA-IAGOWNOFSA-N 0 3 417.575 4.087 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](N[C@H](CCO)c2ccccc2Br)C1 ZINC000541916794 939653243 /nfs/dbraw/zinc/65/32/43/939653243.db2.gz OMWYGPAUEZXAHM-PLMTUMEDSA-N 0 3 403.364 4.298 20 0 HIADHN CCN1CC[C@@H](NCc2cnn(Cc3ccccc3)c2)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000541993903 939672622 /nfs/dbraw/zinc/67/26/22/939672622.db2.gz GECVVDCVZHPOEB-FYYLOGMGSA-N 0 3 414.475 4.274 20 0 HIADHN O[C@H](COc1ccc2ccccc2c1)CN1CCC[C@H](n2ccc(C(F)(F)F)n2)C1 ZINC000542055071 939700579 /nfs/dbraw/zinc/70/05/79/939700579.db2.gz LTJZQRBERZJRBU-OALUTQOASA-N 0 3 419.447 4.132 20 0 HIADHN COCCNS(=O)(=O)c1cccc(CN[C@H](c2ccccc2)C2CCCCC2)c1 ZINC000542089017 939706617 /nfs/dbraw/zinc/70/66/17/939706617.db2.gz WHLUADUDDOSWJY-HSZRJFAPSA-N 0 3 416.587 4.023 20 0 HIADHN Cc1cc([C@@H](NC2CC(C(=O)OC(C)C)(C(=O)OC(C)C)C2)C2CC2)ccc1F ZINC000542146105 939730454 /nfs/dbraw/zinc/73/04/54/939730454.db2.gz WJRAIIZISWELHH-FQEVSTJZSA-N 0 3 405.510 4.227 20 0 HIADHN CNS(=O)(=O)c1ccc([C@H](C)N[C@H]2CCCc3c(Br)cccc32)cc1 ZINC000542152791 939733185 /nfs/dbraw/zinc/73/31/85/939733185.db2.gz RDRJAUVOLQQQIT-DJJJIMSYSA-N 0 3 423.376 4.085 20 0 HIADHN COC(=O)COc1ccc(CNC2(c3cccc(Br)c3)CCC2)cc1 ZINC000542177253 939745682 /nfs/dbraw/zinc/74/56/82/939745682.db2.gz QLCSNEIGCUWEHF-UHFFFAOYSA-N 0 3 404.304 4.170 20 0 HIADHN Fc1cccc(CCN2CCC[C@H](c3nnc4ccc(C(F)(F)F)cn43)C2)c1F ZINC000542281170 939783461 /nfs/dbraw/zinc/78/34/61/939783461.db2.gz YOGYEQFQXCVJHF-AWEZNQCLSA-N 0 3 410.390 4.448 20 0 HIADHN Cc1nn(-c2ccncc2)cc1CNCc1cn(-c2ccccc2)nc1-c1ccncc1 ZINC000542320017 939799700 /nfs/dbraw/zinc/79/97/00/939799700.db2.gz OBEBWMQCRFIXPX-UHFFFAOYSA-N 0 3 421.508 4.113 20 0 HIADHN CC(C)(C)[C@@H]1CCN(CC(=O)N(Cc2nnc(-c3ccccc3Cl)o2)C2CC2)C1 ZINC000542321636 939800037 /nfs/dbraw/zinc/80/00/37/939800037.db2.gz CGPWSPFBGOAGHQ-OAHLLOKOSA-N 0 3 416.953 4.249 20 0 HIADHN CCOc1cc(CN2CCC(OC[C@H]3CCOC3)CC2)ccc1OCC(F)(F)F ZINC000542485070 939831555 /nfs/dbraw/zinc/83/15/55/939831555.db2.gz HTHSQGGFEQNWCY-KRWDZBQOSA-N 0 3 417.468 4.044 20 0 HIADHN Cc1ccccc1[C@@H](CN1CCOCC1)Nc1cccc(CN2CCSCC2)c1 ZINC000542497937 939832795 /nfs/dbraw/zinc/83/27/95/939832795.db2.gz DCRJGSFJTRQZEY-XMMPIXPASA-N 0 3 411.615 4.029 20 0 HIADHN COc1ccc([C@H]2CCCN2C(=O)CN[C@H](c2cccs2)C2CC2)cc1OC ZINC000542510787 939834787 /nfs/dbraw/zinc/83/47/87/939834787.db2.gz NKEWHDRWDANONV-VGSWGCGISA-N 0 3 400.544 4.170 20 0 HIADHN COc1ccc([C@@H]2CCCN2C[C@H](O)COc2cc(C)ccc2Cl)cc1OC ZINC000542520023 939836699 /nfs/dbraw/zinc/83/66/99/939836699.db2.gz GDZPERBMWYFKIC-HKUYNNGSSA-N 0 3 405.922 4.242 20 0 HIADHN CCNC(=O)c1cccc(NC(=O)CN[C@@H](Cc2ccccc2)c2sccc2C)c1 ZINC000542522995 939836914 /nfs/dbraw/zinc/83/69/14/939836914.db2.gz POYCDBGQMGCWIB-NRFANRHFSA-N 0 3 421.566 4.318 20 0 HIADHN O=C(CN[C@@H](Cc1ccccc1)c1cccs1)Nc1ccc(Br)cn1 ZINC000542521381 939836919 /nfs/dbraw/zinc/83/69/19/939836919.db2.gz LSUNMDHMRZUCRR-INIZCTEOSA-N 0 3 416.344 4.418 20 0 HIADHN COCc1ccc(CNC(=O)CN[C@@H](Cc2ccccc2)c2sccc2C)cc1 ZINC000542521315 939836929 /nfs/dbraw/zinc/83/69/29/939836929.db2.gz CVVPPRUPPJXGIB-QFIPXVFZSA-N 0 3 408.567 4.393 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)N[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000542537860 939839995 /nfs/dbraw/zinc/83/99/95/939839995.db2.gz HQORVNFYMHRQTM-DNVJHFABSA-N 0 3 411.521 4.182 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)N[C@@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000542547135 939841777 /nfs/dbraw/zinc/84/17/77/939841777.db2.gz WYFXNACKNIIGNL-VJBWXMMDSA-N 0 3 411.521 4.010 20 0 HIADHN COC[C@H](NCC(=O)Nc1nc(-c2ccc(Cl)c(Cl)c2)cs1)C1CC1 ZINC000542548972 939842081 /nfs/dbraw/zinc/84/20/81/939842081.db2.gz WGQUCSRFBDPRSB-AWEZNQCLSA-N 0 3 400.331 4.070 20 0 HIADHN C[C@H](NCC(=O)NCc1ccc(COc2ccccc2)cc1)[C@@H]1COc2ccccc21 ZINC000542626297 939850094 /nfs/dbraw/zinc/85/00/94/939850094.db2.gz ICAACSVOPBLRBZ-CYFREDJKSA-N 0 3 416.521 4.036 20 0 HIADHN C[C@H]1N(CC(=O)NCCC(c2ccccc2)c2ccccc2)CCC12CCOCC2 ZINC000542650168 939851620 /nfs/dbraw/zinc/85/16/20/939851620.db2.gz SXQCBFCBOYSMBO-OAQYLSRUSA-N 0 3 406.570 4.216 20 0 HIADHN C[C@@H](NCc1cccnc1N1CCC(C(N)=O)CC1)c1ccc(-c2ccccc2)s1 ZINC000542677257 939853424 /nfs/dbraw/zinc/85/34/24/939853424.db2.gz GSIDSZYIKCKKIU-QGZVFWFLSA-N 0 3 420.582 4.363 20 0 HIADHN Cc1csc([C@H](C)CN[C@@H](c2ccc(F)cc2)c2cccc(S(C)(=O)=O)c2)n1 ZINC000542682229 939853871 /nfs/dbraw/zinc/85/38/71/939853871.db2.gz SBTPXRYBLRSBFN-VLIAUNLRSA-N 0 3 418.559 4.477 20 0 HIADHN CCOC(=O)c1nn(-c2ccccc2)cc1CN[C@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000542689885 939854513 /nfs/dbraw/zinc/85/45/13/939854513.db2.gz YUMSVCAHAOXNLW-UNMCSNQZSA-N 0 3 423.488 4.198 20 0 HIADHN CCN1CCN(Cc2ccc(N[C@H](c3ccn(C)n3)c3ccc(Cl)cc3)cc2)CC1 ZINC000542707285 939855726 /nfs/dbraw/zinc/85/57/26/939855726.db2.gz IRNBCAUNYMVKQR-DEOSSOPVSA-N 0 3 423.992 4.413 20 0 HIADHN CC1(c2ccccc2)CC(NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)C1 ZINC000542723268 939856897 /nfs/dbraw/zinc/85/68/97/939856897.db2.gz NRJCSBNOTYBVJB-UHFFFAOYSA-N 0 3 409.496 4.211 20 0 HIADHN CN(C(=O)[C@@H]1CCO[C@H]1c1ccc(Cl)c(F)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000542731728 939857613 /nfs/dbraw/zinc/85/76/13/939857613.db2.gz MHLBLPJBNFYSRG-JQVVWYNYSA-N 0 3 416.924 4.290 20 0 HIADHN CCc1ccc([C@@H](NCCc2ccc(C)nc2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000542774180 939860244 /nfs/dbraw/zinc/86/02/44/939860244.db2.gz FKFDUDKPXLYMMA-XMMPIXPASA-N 0 3 408.567 4.278 20 0 HIADHN COc1cc(Br)ccc1CN(C)C1CCN(C(=O)c2ccccc2)CC1 ZINC000542855745 939863511 /nfs/dbraw/zinc/86/35/11/939863511.db2.gz BZCQZVTVKQCBOX-UHFFFAOYSA-N 0 3 417.347 4.194 20 0 HIADHN CC[C@H]1c2ccsc2CCN1C(=O)CN[C@H](C)c1ccc(-n2ccnc2C)cc1 ZINC000542886140 939865328 /nfs/dbraw/zinc/86/53/28/939865328.db2.gz SYNYKTPPXCMSBE-IERDGZPVSA-N 0 3 408.571 4.429 20 0 HIADHN C[C@H](NCc1cccc(C(=O)NCc2ccco2)c1)c1cccc(-n2ccnc2)c1 ZINC000542941327 939882621 /nfs/dbraw/zinc/88/26/21/939882621.db2.gz BIAKTFHWFPHZCC-SFHVURJKSA-N 0 3 400.482 4.246 20 0 HIADHN CCN1CC[C@@H](NCc2cnc(-c3ccccc3)nc2)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000542942929 939882889 /nfs/dbraw/zinc/88/28/89/939882889.db2.gz XRBCGABBURRNTG-IFMALSPDSA-N 0 3 412.459 4.486 20 0 HIADHN CC(C)COc1ncc(C(=O)N(Cc2ccco2)C2CCN(C)CC2)cc1Cl ZINC000543040242 939902069 /nfs/dbraw/zinc/90/20/69/939902069.db2.gz FAHWBLTVUQJRJS-UHFFFAOYSA-N 0 3 405.926 4.099 20 0 HIADHN COC(=O)c1cccc(NC(=O)C[C@H](C)N[C@@H]2CCSc3ccc(F)cc32)c1 ZINC000543068142 939921478 /nfs/dbraw/zinc/92/14/78/939921478.db2.gz UEWBGAXZVVWBFF-SCLBCKFNSA-N 0 3 402.491 4.156 20 0 HIADHN CC(C)OCCCCN[C@H](c1cccc(S(C)(=O)=O)c1)c1ccc(F)c(F)c1 ZINC000543086380 939934442 /nfs/dbraw/zinc/93/44/42/939934442.db2.gz CBQVXXVSDCRJCH-OAQYLSRUSA-N 0 3 411.514 4.253 20 0 HIADHN CCOc1ccc(C(C)(C)C(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)cc1OCC ZINC000543095294 939940839 /nfs/dbraw/zinc/94/08/39/939940839.db2.gz LRGUTRNRLURFHC-NZQKXSOJSA-N 0 3 410.558 4.323 20 0 HIADHN CN(C)c1cccc([C@@H]2CCCN2[C@H](Cc2ccc(C(F)(F)F)cc2)C(N)=O)c1 ZINC000543202699 939994488 /nfs/dbraw/zinc/99/44/88/939994488.db2.gz KQWUGSBFUKYQTJ-VQTJNVASSA-N 0 3 405.464 4.005 20 0 HIADHN O=S1(=O)CCCC[C@@H]1CNCc1ccc(-c2cccc(Br)c2)s1 ZINC000543237695 940004083 /nfs/dbraw/zinc/00/40/83/940004083.db2.gz DRTXOZDSAKFRAY-MRXNPFEDSA-N 0 3 414.390 4.235 20 0 HIADHN CC(C)Oc1c(F)cc(NC(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)cc1F ZINC000543321194 940029208 /nfs/dbraw/zinc/02/92/08/940029208.db2.gz JKTIHXGLTLWULO-SFHVURJKSA-N 0 3 403.473 4.490 20 0 HIADHN COc1cc(OC)cc(N2CC[C@H](CN[C@@H](c3ccc(F)cc3)c3cccnc3)C2)c1 ZINC000543404553 940053312 /nfs/dbraw/zinc/05/33/12/940053312.db2.gz IKRLJUSNRYDICA-CJAUYULYSA-N 0 3 421.516 4.443 20 0 HIADHN C[C@@H](C[S@@](C)=O)NCc1cn(Cc2ccccc2)nc1-c1cc2ccccc2o1 ZINC000543410488 940056614 /nfs/dbraw/zinc/05/66/14/940056614.db2.gz SFRHGYRJSVUQOX-SFNQZPIRSA-N 0 3 407.539 4.201 20 0 HIADHN COc1cc(CN2CCC(OC[C@@H]3CCOC3)CC2)ccc1OCc1ccccc1 ZINC000543415294 940058040 /nfs/dbraw/zinc/05/80/40/940058040.db2.gz OPVAGFPPBZSYMH-JOCHJYFZSA-N 0 3 411.542 4.292 20 0 HIADHN CC[C@H](N[C@@H]1CCCN(Cc2ccccn2)C1=O)c1cc(F)cc(Br)c1 ZINC000543426816 940060859 /nfs/dbraw/zinc/06/08/59/940060859.db2.gz KQQNEQIJWPPNFC-RBUKOAKNSA-N 0 3 420.326 4.215 20 0 HIADHN O=S1(=O)CCCC[C@H]1CN[C@@H]1CCCc2nc(-c3ccc(Cl)cc3)sc21 ZINC000543428675 940061882 /nfs/dbraw/zinc/06/18/82/940061882.db2.gz DAIGMMMKLQQCHG-JKSUJKDBSA-N 0 3 410.992 4.398 20 0 HIADHN COC(=O)c1ccc(C)c(NC(=O)CN[C@H](Cc2ccccc2)c2cccs2)c1 ZINC000543454007 940067835 /nfs/dbraw/zinc/06/78/35/940067835.db2.gz GLQSBVUTFBSNRK-HXUWFJFHSA-N 0 3 408.523 4.355 20 0 HIADHN CCCCSc1ccc(Cl)cc1C(=O)N1CC[C@H](N2CCN(C(C)C)CC2)C1 ZINC000543580469 940117926 /nfs/dbraw/zinc/11/79/26/940117926.db2.gz BWBWISDVVWIZAN-IBGZPJMESA-N 0 3 424.054 4.473 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)Nc1csc(-c2ccccn2)n1 ZINC000543613802 940131363 /nfs/dbraw/zinc/13/13/63/940131363.db2.gz NUIHRZWJSBLEFZ-UHFFFAOYSA-N 0 3 417.485 4.079 20 0 HIADHN C[C@@H]1CN(CCOC2CCN(Cc3ccccc3OC3CCCC3)CC2)C[C@H](C)O1 ZINC000563778241 945298378 /nfs/dbraw/zinc/29/83/78/945298378.db2.gz RTMVYMLUCBVPNM-OYRHEFFESA-N 0 3 416.606 4.098 20 0 HIADHN COc1ccc(C2(C(=O)NC[C@@H](c3cccs3)N3CCCC3)CCC2)cc1OC ZINC000543637470 940144920 /nfs/dbraw/zinc/14/49/20/940144920.db2.gz NNUYSUQSVLUEBL-SFHVURJKSA-N 0 3 414.571 4.140 20 0 HIADHN CS[C@@H]1CN(C(=O)c2ccc(-c3nc4ccccc4s3)o2)C[C@H]1N1CCCC1 ZINC000543700135 940163589 /nfs/dbraw/zinc/16/35/89/940163589.db2.gz YYAGLRPZQNZGBQ-DNVCBOLYSA-N 0 3 413.568 4.208 20 0 HIADHN O=C(NCc1cccc(Cn2ccnc2)c1)c1cccc2nc(-c3cccs3)[nH]c21 ZINC000543700292 940164341 /nfs/dbraw/zinc/16/43/41/940164341.db2.gz AOLMVPCBGINJMT-UHFFFAOYSA-N 0 3 413.506 4.466 20 0 HIADHN C[C@H](C(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1CO)c1ccc(Cl)c(Cl)c1 ZINC000543707359 940167125 /nfs/dbraw/zinc/16/71/25/940167125.db2.gz OLZDWTWBNGIYPK-RRMPHLOHSA-N 0 3 421.368 4.096 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)c2ccc3[nH]c(C(F)F)nc3c2)cc1 ZINC000543715054 940168942 /nfs/dbraw/zinc/16/89/42/940168942.db2.gz WWLPUGYQSMDISV-LJQANCHMSA-N 0 3 414.456 4.076 20 0 HIADHN CC[C@H](N[C@H](C)c1ccc(NC(C)=O)cc1)c1ccccc1OCC(=O)N1CCCC1 ZINC000543773900 940181714 /nfs/dbraw/zinc/18/17/14/940181714.db2.gz IDLLDSKSLMWWJD-JPYJTQIMSA-N 0 3 423.557 4.448 20 0 HIADHN CCN1CC[C@@H](NCc2cccc3c2OCCCO3)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000543870518 940218272 /nfs/dbraw/zinc/21/82/72/940218272.db2.gz BQNRTZCGOYPDMJ-WIYYLYMNSA-N 0 3 406.448 4.190 20 0 HIADHN Cc1c2cccc(Br)c2oc1C(=O)NCCCCN1C[C@@H](C)O[C@H](C)C1 ZINC000543880095 940222672 /nfs/dbraw/zinc/22/26/72/940222672.db2.gz IOHBIVJRNOCHRV-ZIAGYGMSSA-N 0 3 423.351 4.123 20 0 HIADHN CCOC(=O)c1c2c(sc1NC(=O)c1csnc1C)C(C)(C)NC(C)(C)C2 ZINC000543974543 940280616 /nfs/dbraw/zinc/28/06/16/940280616.db2.gz LOMADRFHXBRUQO-UHFFFAOYSA-N 0 3 407.561 4.101 20 0 HIADHN C[C@H](NC(=O)[C@H](C)N1CCC(CCCn2ccnc2)CC1)c1ccc(Cl)cc1 ZINC000543988690 940285260 /nfs/dbraw/zinc/28/52/60/940285260.db2.gz WTSFDLXSCLOQEH-ROUUACIJSA-N 0 3 402.970 4.295 20 0 HIADHN O=C(CN[C@H](c1ccc(Cl)cc1)C1CC1)N1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000543989712 940286417 /nfs/dbraw/zinc/28/64/17/940286417.db2.gz XAXOXWMTGNRIKO-IRLDBZIGSA-N 0 3 402.897 4.120 20 0 HIADHN COC(=O)c1cccc(NC(=O)C[C@@H](C)N[C@H](CC(F)(F)F)c2ccccc2)c1 ZINC000543996570 940289526 /nfs/dbraw/zinc/28/95/26/940289526.db2.gz JMGICOLJDDSCPC-RDTXWAMCSA-N 0 3 408.420 4.474 20 0 HIADHN Cn1cc(CN2CCC(C(=O)NCCc3cccs3)CC2)c(C2CCCCC2)n1 ZINC000563839167 945310288 /nfs/dbraw/zinc/31/02/88/945310288.db2.gz CTWVAXMVPZALIQ-UHFFFAOYSA-N 0 3 414.619 4.100 20 0 HIADHN O[C@H](COc1ccccc1C(F)(F)F)CN1CCC(Nc2ccc(F)cc2)CC1 ZINC000544071642 940317304 /nfs/dbraw/zinc/31/73/04/940317304.db2.gz SNSVSFQDIXWXEP-SFHVURJKSA-N 0 3 412.427 4.161 20 0 HIADHN C[C@@]1(NCC(=O)Nc2cc(C3CCCC3)nn2-c2ccccc2)CCO[C@@H]1C1CC1 ZINC000544175571 940344137 /nfs/dbraw/zinc/34/41/37/940344137.db2.gz NAPZNMYWDHIYRY-DNQXCXABSA-N 0 3 408.546 4.016 20 0 HIADHN Cc1cccc([C@@H]2CCN(CC(=O)N3CCC[C@@H]3c3ccc4c(c3)OCCCO4)C2)c1 ZINC000544183411 940346816 /nfs/dbraw/zinc/34/68/16/940346816.db2.gz GOZLCDSYCYFSJR-DHIUTWEWSA-N 0 3 420.553 4.309 20 0 HIADHN COc1cccc([C@@H]2C[C@@H](C)CN2C(=O)CCCN2CCN(c3ccccc3)CC2)c1 ZINC000544319151 940389151 /nfs/dbraw/zinc/38/91/51/940389151.db2.gz PROFOMUNOWGTAG-BWKNWUBXSA-N 0 3 421.585 4.207 20 0 HIADHN Fc1ccc([C@@H](NCC2(CN3CCOCC3)CCCCC2)c2cccnc2)c(F)c1 ZINC000544355820 940398979 /nfs/dbraw/zinc/39/89/79/940398979.db2.gz PFNRWXZCNUUQHI-QHCPKHFHSA-N 0 3 415.528 4.322 20 0 HIADHN Cn1cc(N2CCC[C@H](N[C@H](c3ccc(F)cc3)c3cnc4ccccc4c3)C2)cn1 ZINC000544359263 940400500 /nfs/dbraw/zinc/40/05/00/940400500.db2.gz HMHMGIQQKZRFOW-WIOPSUGQSA-N 0 3 415.516 4.455 20 0 HIADHN Fc1ccc([C@@H](NCC2(c3ccc4c(c3)OCO4)CCOCC2)c2ccccc2)nc1 ZINC000544367626 940403049 /nfs/dbraw/zinc/40/30/49/940403049.db2.gz FJIGLFPDYJYOGG-DEOSSOPVSA-N 0 3 420.484 4.377 20 0 HIADHN COc1ccc(CN2CCC(OC[C@H]3CCOC3)CC2)cc1OCc1ccccc1 ZINC000544372281 940404520 /nfs/dbraw/zinc/40/45/20/940404520.db2.gz YBEQNPHXYCHZKZ-QFIPXVFZSA-N 0 3 411.542 4.292 20 0 HIADHN Cc1cc([C@H](NCCCN2C(=O)COc3ccccc32)c2cccnc2)ccc1F ZINC000544382369 940407280 /nfs/dbraw/zinc/40/72/80/940407280.db2.gz QOFNLPZAPDWZDZ-DEOSSOPVSA-N 0 3 405.473 4.024 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(-c4ccc5ccc(Cl)cc5n4)n3)cn2)CC1 ZINC000544388166 940408851 /nfs/dbraw/zinc/40/88/51/940408851.db2.gz LYTCBGSLCZIKIG-UHFFFAOYSA-N 0 3 420.904 4.142 20 0 HIADHN COc1ccc(OC)c([C@@H]2CCCN2C(=O)CN[C@H](c2cccs2)C2CC2)c1 ZINC000544399365 940412524 /nfs/dbraw/zinc/41/25/24/940412524.db2.gz BRCZNISJZYJUOB-AVRDEDQJSA-N 0 3 400.544 4.170 20 0 HIADHN O[C@@H](CCc1ccccc1)CN1CCN(CCc2ccc(Cl)c(Cl)c2)CC1 ZINC000544400658 940412616 /nfs/dbraw/zinc/41/26/16/940412616.db2.gz KXASWWWZYJLMCC-FQEVSTJZSA-N 0 3 407.385 4.147 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(C(C)(C)c4cccc(Cl)c4)n3)cn2)CC1 ZINC000544406372 940414511 /nfs/dbraw/zinc/41/45/11/940414511.db2.gz OQJMKEUMGMTSOY-UHFFFAOYSA-N 0 3 411.937 4.253 20 0 HIADHN O=C(CN[C@H](Cc1ccccc1)c1cccs1)N1CCO[C@H](c2ccc(F)cc2)C1 ZINC000544415154 940417434 /nfs/dbraw/zinc/41/74/34/940417434.db2.gz HRMXFHMAOJDTQY-YADHBBJMSA-N 0 3 424.541 4.361 20 0 HIADHN CC[C@H](NCC(=O)N1N=C(c2ccc(Cl)cc2)C[C@H]1c1ccco1)[C@@H]1CCCO1 ZINC000544462434 940441511 /nfs/dbraw/zinc/44/15/11/940441511.db2.gz VMRGPMIOLYFXOE-IHPCNDPISA-N 0 3 415.921 4.158 20 0 HIADHN CCOc1ccc([C@@H]2CCCN2C(=O)CN[C@H](C)[C@H]2Oc3ccccc3[C@H]2C)cc1 ZINC000544517903 940469185 /nfs/dbraw/zinc/46/91/85/940469185.db2.gz IKRSHMLIEMVNGG-VQMLKYHISA-N 0 3 408.542 4.292 20 0 HIADHN C[C@@H](C(=O)Nc1ccc(OCc2ccccc2)cc1)N1CCC2(CCOCC2)[C@H]1C ZINC000544546649 940476289 /nfs/dbraw/zinc/47/62/89/940476289.db2.gz BUTTZILXYGIQII-VQTJNVASSA-N 0 3 408.542 4.484 20 0 HIADHN CCc1ccc([C@H](CNC(=O)NCc2nc3ccccc3n2C2CC2)N(C)C)cc1 ZINC000544779130 940513297 /nfs/dbraw/zinc/51/32/97/940513297.db2.gz YTGOHFBTHJHYHK-QFIPXVFZSA-N 0 3 405.546 4.036 20 0 HIADHN Cc1ccc(C(=O)CCCCC(=O)Nc2cccc(CN3CCC(O)CC3)c2)cc1 ZINC000544810089 940516427 /nfs/dbraw/zinc/51/64/27/940516427.db2.gz RAMTWJUYJXIGSK-UHFFFAOYSA-N 0 3 408.542 4.334 20 0 HIADHN Cc1cccc(C)c1[C@@H](C)NCC(=O)N1CCC[C@H]1c1ccc2c(c1)OCCCO2 ZINC000544895017 940522638 /nfs/dbraw/zinc/52/26/38/940522638.db2.gz BORXEPZTFWQTKV-CTNGQTDRSA-N 0 3 408.542 4.479 20 0 HIADHN Cn1cnc2cc(CN3CCC(Oc4cccc(Br)c4)CC3)ccc21 ZINC000544942813 940526793 /nfs/dbraw/zinc/52/67/93/940526793.db2.gz GWXFTYLVHROGTL-UHFFFAOYSA-N 0 3 400.320 4.379 20 0 HIADHN COc1ccc(OC)c(-c2nn(-c3ccccc3)cc2CN2CCC(C)(CO)CC2)c1 ZINC000545163635 940552845 /nfs/dbraw/zinc/55/28/45/940552845.db2.gz OROCNHGJDPRKOJ-UHFFFAOYSA-N 0 3 421.541 4.151 20 0 HIADHN Cc1ccc(-c2nc(NC(=O)[C@]3(O)CCN(Cc4ccccc4)C3)sc2C)s1 ZINC000545266866 940559354 /nfs/dbraw/zinc/55/93/54/940559354.db2.gz MEHSADVIPUYSBB-NRFANRHFSA-N 0 3 413.568 4.064 20 0 HIADHN CS[C@@H]1CN(C(=O)Nc2ccc(OCc3cccc(F)c3)cc2C)C[C@@H]1N(C)C ZINC000545423858 940569193 /nfs/dbraw/zinc/56/91/93/940569193.db2.gz RWIJWKWQHSRWAA-LEWJYISDSA-N 0 3 417.550 4.222 20 0 HIADHN CCN1C(=O)CCc2cc(NC(=O)NC[C@H](c3cccs3)N3CCCC3)ccc21 ZINC000545435309 940569904 /nfs/dbraw/zinc/56/99/04/940569904.db2.gz PLGRZUINSPAHBG-LJQANCHMSA-N 0 3 412.559 4.006 20 0 HIADHN CSc1ccc([C@H](C)NC(=O)NC[C@H]2CN(Cc3ccccc3)CCCO2)cc1 ZINC000545469012 940571107 /nfs/dbraw/zinc/57/11/07/940571107.db2.gz DDDYRQLABMEFTA-RXVVDRJESA-N 0 3 413.587 4.060 20 0 HIADHN COc1ccc(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2F)cc1OC(C)C ZINC000545515771 940572755 /nfs/dbraw/zinc/57/27/55/940572755.db2.gz MLYMFYIYBCMSPG-UHFFFAOYSA-N 0 3 421.488 4.356 20 0 HIADHN O=C(Nc1ccccc1-c1noc(-c2ccc(CN3CCSCC3)cc2)n1)C1CC1 ZINC000545580960 940575736 /nfs/dbraw/zinc/57/57/36/940575736.db2.gz NSSHSACTEKDALY-UHFFFAOYSA-N 0 3 420.538 4.301 20 0 HIADHN CN(Cc1ccccc1)Cc1cccc(-c2nc(Cc3ccc(C(N)=O)cc3)no2)c1 ZINC000545629410 940578070 /nfs/dbraw/zinc/57/80/70/940578070.db2.gz ZFZLEHKCXUKKIN-UHFFFAOYSA-N 0 3 412.493 4.058 20 0 HIADHN C[C@H](c1ccc(Cl)s1)c1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1 ZINC000545650280 940578833 /nfs/dbraw/zinc/57/88/33/940578833.db2.gz ZDDRRWHDKPNSRS-CYBMUJFWSA-N 0 3 403.939 4.140 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(Cc4csc5ccccc45)n3)cn2)CC1 ZINC000545650879 940578907 /nfs/dbraw/zinc/57/89/07/940578907.db2.gz MLSPEPHLGQOFAR-UHFFFAOYSA-N 0 3 405.527 4.079 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(-c4cccc(Cl)c4Cl)n3)cn2)CC1 ZINC000545655308 940579047 /nfs/dbraw/zinc/57/90/47/940579047.db2.gz ZNJCMIMRNPIPLR-UHFFFAOYSA-N 0 3 404.301 4.247 20 0 HIADHN CC(=O)NC1CCC(N[C@@H](c2ccc3c(c2)OCCO3)c2ccccc2Cl)CC1 ZINC000545916965 940657739 /nfs/dbraw/zinc/65/77/39/940657739.db2.gz KWPSPIHGQBGLME-KXXGJQBSSA-N 0 3 414.933 4.238 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)c2cscc2Br)N(C)C)cc1 ZINC000563991134 945339063 /nfs/dbraw/zinc/33/90/63/945339063.db2.gz AOWBFWXJNRLECJ-KRWDZBQOSA-N 0 3 411.365 4.331 20 0 HIADHN Cc1cc(NC(=O)c2oc(C3CC3)nc2C)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000546050087 940682591 /nfs/dbraw/zinc/68/25/91/940682591.db2.gz RJJJZIMUUNACKC-IBGZPJMESA-N 0 3 405.502 4.065 20 0 HIADHN CCN(C(=O)c1cnn(-c2ccc(F)cc2F)c1C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000546183605 940723015 /nfs/dbraw/zinc/72/30/15/940723015.db2.gz RXHGIBKFCDGPHP-FQEVSTJZSA-N 0 3 424.495 4.196 20 0 HIADHN CCN(C(=O)c1cc(C)nc2onc(C(C)C)c21)[C@H]1CCN(Cc2ccccc2)C1 ZINC000546183064 940723149 /nfs/dbraw/zinc/72/31/49/940723149.db2.gz QNUMZFPBPXOCFM-IBGZPJMESA-N 0 3 406.530 4.391 20 0 HIADHN CCN(C(=O)c1cnc(-c2ccccc2)nc1C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000546185394 940724103 /nfs/dbraw/zinc/72/41/03/940724103.db2.gz HMGWEQAJBADUBK-JOCHJYFZSA-N 0 3 400.526 4.189 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(-c4cncc(-c5ccccc5)c4)n3)cn2)CC1 ZINC000546356799 940800887 /nfs/dbraw/zinc/80/08/87/940800887.db2.gz SWBZNKCJKDRAKR-UHFFFAOYSA-N 0 3 412.497 4.003 20 0 HIADHN CN(Cc1ccccc1)Cc1cccc(-c2nc(-c3cccnc3-n3cncn3)no2)c1 ZINC000546360226 940801573 /nfs/dbraw/zinc/80/15/73/940801573.db2.gz BPIBJGXSOQUATE-UHFFFAOYSA-N 0 3 423.480 4.011 20 0 HIADHN CN(Cc1ccccc1)Cc1cccc(-c2nc(-c3ccc(CC(N)=O)cc3)no2)c1 ZINC000546483654 940832420 /nfs/dbraw/zinc/83/24/20/940832420.db2.gz QGXPTJAGOPHRMK-UHFFFAOYSA-N 0 3 412.493 4.063 20 0 HIADHN Fc1cccc(CN2CCC[C@H](c3nc(-c4ccc(OCC(F)F)nc4)no3)C2)c1 ZINC000546553352 940851027 /nfs/dbraw/zinc/85/10/27/940851027.db2.gz TXIHPSAGZFLUHS-INIZCTEOSA-N 0 3 418.419 4.294 20 0 HIADHN Cn1ccc([C@@H](NC2CCN(CCC(F)(F)F)CC2)c2ccc(Cl)cc2)n1 ZINC000546573108 940855871 /nfs/dbraw/zinc/85/58/71/940855871.db2.gz WXIMHNWZPXWVTG-SFHVURJKSA-N 0 3 400.876 4.169 20 0 HIADHN Cc1cc(C(=O)NC[C@@H](c2cccs2)N2CCCC2)c(C)n1Cc1ccncc1 ZINC000546582219 940857454 /nfs/dbraw/zinc/85/74/54/940857454.db2.gz WPMNOIHRQUOOMO-NRFANRHFSA-N 0 3 408.571 4.177 20 0 HIADHN Cc1ccc([C@H](Cc2ccccc2Br)NC[C@H](C)S(C)(=O)=O)cc1 ZINC000546626688 940862210 /nfs/dbraw/zinc/86/22/10/940862210.db2.gz HUGYDLHDELNMJD-KXBFYZLASA-N 0 3 410.377 4.064 20 0 HIADHN CN(C)[C@@H](CNc1cnn(C(C)(C)C)c(=O)c1Cl)c1cccc(C(F)(F)F)c1 ZINC000546682026 940868864 /nfs/dbraw/zinc/86/88/64/940868864.db2.gz CKTMLZPMKICSMS-HNNXBMFYSA-N 0 3 416.875 4.385 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCc1nc2ccccc2n1C1CC1)c1ccsc1 ZINC000546761893 940878524 /nfs/dbraw/zinc/87/85/24/940878524.db2.gz VDUMOLZGWCXQGP-FQEVSTJZSA-N 0 3 411.575 4.315 20 0 HIADHN CCN1C(=O)CCc2cc(NC(=O)N3CC[C@H](C)N(Cc4ccccc4)CC3)ccc21 ZINC000546844682 940893587 /nfs/dbraw/zinc/89/35/87/940893587.db2.gz KUUYCIUQTPDDMD-IBGZPJMESA-N 0 3 420.557 4.114 20 0 HIADHN CCN1CCc2nc3ccccc3c(C(=O)Nc3cc(CN(C)C)ccc3C)c2C1 ZINC000546854107 940895475 /nfs/dbraw/zinc/89/54/75/940895475.db2.gz NATVQCRYPBDEDI-UHFFFAOYSA-N 0 3 402.542 4.235 20 0 HIADHN CS(=O)(=O)Nc1cccc(CN[C@@H](Cc2cccnc2)c2ccc(Cl)cc2)c1 ZINC000546874446 940899581 /nfs/dbraw/zinc/89/95/81/940899581.db2.gz PSOSVJWWOKQVEI-NRFANRHFSA-N 0 3 415.946 4.180 20 0 HIADHN c1cn(Cc2cccc(-c3noc(-c4ccc(CN5CCSCC5)cc4)n3)c2)cn1 ZINC000546991300 940945290 /nfs/dbraw/zinc/94/52/90/940945290.db2.gz AYHCEMCETLJAEF-UHFFFAOYSA-N 0 3 417.538 4.197 20 0 HIADHN c1cnc(Oc2ccc(-c3noc([C@@H]4CCCN(Cc5cccnc5)C4)n3)cc2)nc1 ZINC000547038286 940969804 /nfs/dbraw/zinc/96/98/04/940969804.db2.gz HHVYQTKFODVZRB-LJQANCHMSA-N 0 3 414.469 4.094 20 0 HIADHN CCN(C(=O)Nc1cc(-c2nc(C)no2)ccc1C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000547464864 941064137 /nfs/dbraw/zinc/06/41/37/941064137.db2.gz RJJGDBGYIXDCLP-NRFANRHFSA-N 0 3 419.529 4.482 20 0 HIADHN C[C@@H](c1ccc(N2CCCS2(=O)=O)cc1)N(C)Cc1cccc2c1OC(C)(C)C2 ZINC000547928481 941079680 /nfs/dbraw/zinc/07/96/80/941079680.db2.gz HPQMAXSGQNQYIM-KRWDZBQOSA-N 0 3 414.571 4.133 20 0 HIADHN Cc1cc(C)c(NC(=O)[C@@H]2CCCN(Cc3cccnc3)C2)cc1Br ZINC000547957287 941080766 /nfs/dbraw/zinc/08/07/66/941080766.db2.gz NNKXGUNMWFKLCR-QGZVFWFLSA-N 0 3 402.336 4.312 20 0 HIADHN O=C(c1ccc2nc(C(F)(F)F)cn2c1)N(CCN1CCCC1)c1ccccc1 ZINC000548108615 941087226 /nfs/dbraw/zinc/08/72/26/941087226.db2.gz HVNYVBHVYRPKPG-UHFFFAOYSA-N 0 3 402.420 4.096 20 0 HIADHN C[C@H](CN[C@@H]1CCS(=O)(=O)c2ccc(Br)cc21)C1CCCCC1 ZINC000548155971 941089672 /nfs/dbraw/zinc/08/96/72/941089672.db2.gz YWJDHFJEPMQQGS-CXAGYDPISA-N 0 3 400.382 4.474 20 0 HIADHN COc1cccc(OC)c1OC[C@H](O)CNC(c1cccc(C)c1)c1cccc(C)c1 ZINC000548770298 941123224 /nfs/dbraw/zinc/12/32/24/941123224.db2.gz NXLBOZHZYMIXJQ-JOCHJYFZSA-N 0 3 421.537 4.440 20 0 HIADHN Brc1ccc(OCc2ccccn2)c(CN2CCC3(CCO3)CC2)c1 ZINC000548807112 941124684 /nfs/dbraw/zinc/12/46/84/941124684.db2.gz MMWYATQBEKMYBD-UHFFFAOYSA-N 0 3 403.320 4.178 20 0 HIADHN CCN(C(=O)Nc1cn(Cc2ccccc2)nn1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000548983312 941138667 /nfs/dbraw/zinc/13/86/67/941138667.db2.gz ADGZAZLIXYJOFD-KNQAVFIVSA-N 0 3 418.545 4.016 20 0 HIADHN Cc1ccc(Cc2ccccn2)cc1NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000549056511 941149650 /nfs/dbraw/zinc/14/96/50/941149650.db2.gz YGFVMSUIVDDVFR-HSZRJFAPSA-N 0 3 400.526 4.377 20 0 HIADHN CCn1c([C@H]2OCC[C@H]2c2ccccc2)nnc1N1CCN(C2CCC(C)CC2)CC1 ZINC000549093238 941156394 /nfs/dbraw/zinc/15/63/94/941156394.db2.gz AAQRUDXATHCZBP-VZKWCCSDSA-N 0 3 423.605 4.244 20 0 HIADHN COc1cccc([C@@H]2[C@H](N[C@H](C)C(=O)Nc3ccccc3Cl)CCN2C2CC2)c1 ZINC000549112872 941161036 /nfs/dbraw/zinc/16/10/36/941161036.db2.gz MELJHUNWBBDVIB-UJUVCNOISA-N 0 3 413.949 4.243 20 0 HIADHN CCN1CC[C@@H](NCc2cc(F)cc3c2OCOC3)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000549114516 941161453 /nfs/dbraw/zinc/16/14/53/941161453.db2.gz ZECDZKHHADGEGO-UYAOXDASSA-N 0 3 410.411 4.035 20 0 HIADHN CCN1CC[C@@H](NCc2cc(F)cc3c2OCOC3)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000549114515 941161489 /nfs/dbraw/zinc/16/14/89/941161489.db2.gz ZECDZKHHADGEGO-QUCCMNQESA-N 0 3 410.411 4.035 20 0 HIADHN CCOC(=O)[C@H]1CC[C@H](NCc2cc(OC)c(OCC)c(OC)c2)c2ccccc21 ZINC000549118369 941161838 /nfs/dbraw/zinc/16/18/38/941161838.db2.gz GHXYCTPAJOHFMD-PMACEKPBSA-N 0 3 413.514 4.374 20 0 HIADHN CCOC(=O)c1nc(CN[C@@H]2CN(Cc3ccccc3)C[C@H]2c2ccccc2)cs1 ZINC000549166626 941167786 /nfs/dbraw/zinc/16/77/86/941167786.db2.gz RZTJBHNJWLFBIW-FCHUYYIVSA-N 0 3 421.566 4.078 20 0 HIADHN CCOC(=O)C1CCN(C(=O)CN[C@H](c2ccc(C(C)(C)C)cc2)C(C)C)CC1 ZINC000549178468 941168839 /nfs/dbraw/zinc/16/88/39/941168839.db2.gz UTNVPJSGCZNVTH-QFIPXVFZSA-N 0 3 402.579 4.073 20 0 HIADHN Cc1cc(NC(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)ccc1C(=O)NC(C)C ZINC000549230732 941172589 /nfs/dbraw/zinc/17/25/89/941172589.db2.gz BDBDCVPLKIXQJT-HXUWFJFHSA-N 0 3 416.953 4.211 20 0 HIADHN COc1cc(C(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)sc1Br ZINC000549242458 941173445 /nfs/dbraw/zinc/17/34/45/941173445.db2.gz YIERYQURSVDSJK-LBPRGKRZSA-N 0 3 417.756 4.205 20 0 HIADHN CN(C)C[C@@H](NC(=O)Nc1ccc(-c2csnn2)cc1)c1ccc(Cl)cc1 ZINC000549243595 941173674 /nfs/dbraw/zinc/17/36/74/941173674.db2.gz AQRAYBUBTGXONO-QGZVFWFLSA-N 0 3 401.923 4.283 20 0 HIADHN CC(C)c1noc(Cc2ccc(NC(=O)NC[C@@H](c3ccccc3)N(C)C)cc2)n1 ZINC000549381317 941184436 /nfs/dbraw/zinc/18/44/36/941184436.db2.gz DXGWXOBWQSNLCW-FQEVSTJZSA-N 0 3 407.518 4.208 20 0 HIADHN COc1cccc([C@@H]2[C@@H](NCC(=O)N(c3ccccc3)C(C)C)CCN2C2CC2)c1 ZINC000549473354 941193724 /nfs/dbraw/zinc/19/37/24/941193724.db2.gz SUHCKTNSUDEQFR-UKILVPOCSA-N 0 3 407.558 4.004 20 0 HIADHN CC[C@@H](C)c1nnc(N2CCN(Cc3ccccc3)C(C)(C)C2)n1C[C@@H]1CCCO1 ZINC000549473604 941193912 /nfs/dbraw/zinc/19/39/12/941193912.db2.gz NYINAISAAULZNF-CTNGQTDRSA-N 0 3 411.594 4.071 20 0 HIADHN CCN1CC[C@H](NCC(=O)Nc2ccc(C)cc2C)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000549477108 941194617 /nfs/dbraw/zinc/19/46/17/941194617.db2.gz QUDRAZLZBUCPHT-SIKLNZKXSA-N 0 3 405.464 4.084 20 0 HIADHN COc1ccc(NC(=O)[C@H](C)N[C@H]2CCN(C(C)C)[C@H]2c2ccc(F)c(F)c2)cc1 ZINC000549476919 941194675 /nfs/dbraw/zinc/19/46/75/941194675.db2.gz OPTDLALRZTWKSU-RXYZOABWSA-N 0 3 417.500 4.114 20 0 HIADHN CCN1CC[C@H](NCc2cc(F)cc3c2OCOC3)[C@H]1c1ccc(Cl)c(F)c1 ZINC000549478597 941194912 /nfs/dbraw/zinc/19/49/12/941194912.db2.gz XGKNIAUBPUGTMU-VQTJNVASSA-N 0 3 408.876 4.410 20 0 HIADHN CN(C)C[C@H](NC(=O)N[C@H]1CCO[C@H]1c1ccc(Cl)cc1)c1ccc(Cl)cc1 ZINC000549491003 941195806 /nfs/dbraw/zinc/19/58/06/941195806.db2.gz ZGMWJBKJNDSRBM-UFYCRDLUSA-N 0 3 422.356 4.426 20 0 HIADHN CN(C)C[C@H](NC(=O)N[C@@H]1CCO[C@@H]1c1ccc(Cl)cc1)c1ccc(Cl)cc1 ZINC000549491001 941195830 /nfs/dbraw/zinc/19/58/30/941195830.db2.gz ZGMWJBKJNDSRBM-HSALFYBXSA-N 0 3 422.356 4.426 20 0 HIADHN CN(C)C[C@H](NC(=O)NC1CCC(C(=O)OC(C)(C)C)CC1)c1ccc(Cl)cc1 ZINC000549490545 941195887 /nfs/dbraw/zinc/19/58/87/941195887.db2.gz SPBDUQDZVCMEFZ-KVZIAJEVSA-N 0 3 423.985 4.142 20 0 HIADHN CN(C)C[C@@H](NC(=O)NCc1nc2ccccc2n1C1CC1)c1ccc(Cl)cc1 ZINC000549496998 941196578 /nfs/dbraw/zinc/19/65/78/941196578.db2.gz QTVTWPDQLLEQEW-LJQANCHMSA-N 0 3 411.937 4.127 20 0 HIADHN COc1ccccc1-c1nnc(N2CCN(C3CCCC3)CC2)n1Cc1ccccc1 ZINC000549539463 941198680 /nfs/dbraw/zinc/19/86/80/941198680.db2.gz WRVAEXJNVFFRGP-UHFFFAOYSA-N 0 3 417.557 4.067 20 0 HIADHN CCN(C(=O)N[C@H]1CCc2cc(F)c(OC)cc21)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000549625613 941201854 /nfs/dbraw/zinc/20/18/54/941201854.db2.gz QHWYLBQIRPLUBT-KNQAVFIVSA-N 0 3 411.521 4.128 20 0 HIADHN CCOC(=O)[C@H]1CC[C@H](NCc2ccc(S(C)(=O)=O)c(Cl)c2)c2ccccc21 ZINC000549624374 941201885 /nfs/dbraw/zinc/20/18/85/941201885.db2.gz JAJDOTIXFDPZLD-HKUYNNGSSA-N 0 3 421.946 4.015 20 0 HIADHN C[C@@H](NCc1c(F)ccc(Br)c1F)C1CCN(CC(F)(F)F)CC1 ZINC000549687071 941204531 /nfs/dbraw/zinc/20/45/31/941204531.db2.gz MSEDMWRCWYQXMC-SNVBAGLBSA-N 0 3 415.244 4.480 20 0 HIADHN Clc1cccc(N2CCOCC2)c1CNCCc1nc(-c2ccncc2)cs1 ZINC000549760870 941206725 /nfs/dbraw/zinc/20/67/25/941206725.db2.gz HJFUIJNNURFQDE-UHFFFAOYSA-N 0 3 414.962 4.027 20 0 HIADHN CCc1oc(CN2CCC[C@H](c3nc(-c4ccc(F)cc4)no3)C2)cc1C(=O)OC ZINC000549802602 941207781 /nfs/dbraw/zinc/20/77/81/941207781.db2.gz UQYUYLBYLMYTJO-HNNXBMFYSA-N 0 3 413.449 4.197 20 0 HIADHN COCCc1ccc(OC[C@@H](O)CN2CC=C(c3c[nH]c4cc(F)ccc43)CC2)cc1 ZINC000549899881 941233318 /nfs/dbraw/zinc/23/33/18/941233318.db2.gz WXVAFDRNVGOSNB-NRFANRHFSA-N 0 3 424.516 4.025 20 0 HIADHN CSc1ccc([C@H](CNCc2c(Cl)cccc2N2CCOCC2)N(C)C)cc1 ZINC000549937565 941243052 /nfs/dbraw/zinc/24/30/52/941243052.db2.gz UMDRLESRXRPMNI-QFIPXVFZSA-N 0 3 420.022 4.291 20 0 HIADHN COc1cccc(OC)c1OC[C@@H](O)CN1CCc2ccccc2[C@H]1c1ccccc1 ZINC000549961024 941250677 /nfs/dbraw/zinc/25/06/77/941250677.db2.gz SAELONCMRSEHPN-SQJMNOBHSA-N 0 3 419.521 4.091 20 0 HIADHN O=C(NCCN1CCCC1)c1ccc(NCc2ccc(OC(F)(F)F)cc2)cc1 ZINC000550064854 941277774 /nfs/dbraw/zinc/27/77/74/941277774.db2.gz RMJMYOZBNNATIZ-UHFFFAOYSA-N 0 3 407.436 4.023 20 0 HIADHN C[C@@H](Cc1ccc(Cl)cc1)C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000550121835 941287228 /nfs/dbraw/zinc/28/72/28/941287228.db2.gz DZXGZDQOPMQXNG-KRWDZBQOSA-N 0 3 418.940 4.317 20 0 HIADHN CC(C)[C@]1(CO)CCCN([C@@H](C)C(=O)N[C@@H](C)c2ccc(Cl)cc2Cl)C1 ZINC000550433749 941326907 /nfs/dbraw/zinc/32/69/07/941326907.db2.gz UHACBEVSMMLGJY-AUSJPIAWSA-N 0 3 401.378 4.290 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)c3cc(Cl)c(F)cc3Cl)CC2)C[C@@H](C)O1 ZINC000550471344 941330385 /nfs/dbraw/zinc/33/03/85/941330385.db2.gz IWKRQIRXCJNNRM-CHWSQXEVSA-N 0 3 403.325 4.094 20 0 HIADHN O=S1(=O)CC[C@H](NC[C@@H](c2ccccc2)C2CC2)c2cc(Br)ccc21 ZINC000550848383 941374155 /nfs/dbraw/zinc/37/41/55/941374155.db2.gz UMDBMKWLDUICBK-OALUTQOASA-N 0 3 420.372 4.451 20 0 HIADHN COC1(CCN[C@H](c2cccc(S(C)(=O)=O)c2)c2ccc(F)c(F)c2)CCC1 ZINC000550858544 941374814 /nfs/dbraw/zinc/37/48/14/941374814.db2.gz ALYDMUYNHWIUTR-HXUWFJFHSA-N 0 3 409.498 4.007 20 0 HIADHN COc1ccc([C@H](C)N[C@H]2CCCN([C@H](C)c3ccccc3F)C2=O)cc1OC ZINC000550860570 941375338 /nfs/dbraw/zinc/37/53/38/941375338.db2.gz MCYISOQYKXQWTH-YRNRMSPPSA-N 0 3 400.494 4.246 20 0 HIADHN COc1cc(OC)cc(Oc2ccc(CNCc3cnc4c(c3)c(C)nn4C)cc2)c1 ZINC000550859067 941375482 /nfs/dbraw/zinc/37/54/82/941375482.db2.gz PTDLNYLOHHXWKV-UHFFFAOYSA-N 0 3 418.497 4.376 20 0 HIADHN CN(C)Cc1ccc(S(=O)(=O)N[C@@H](c2cccc3ccccc32)C(F)(F)F)cc1 ZINC000551018656 941395949 /nfs/dbraw/zinc/39/59/49/941395949.db2.gz MXUYYWJYCCZKCX-FQEVSTJZSA-N 0 3 422.472 4.483 20 0 HIADHN Cc1c(Cl)cccc1NC(=O)[C@H](C)N[C@H]1CCN(C)[C@H]1c1ccc(F)c(F)c1 ZINC000551093631 941408778 /nfs/dbraw/zinc/40/87/78/941408778.db2.gz PMKKZFMEXGXXHD-MRFFXTKBSA-N 0 3 407.892 4.289 20 0 HIADHN CCCN(C)[C@H](CN[C@@H](c1nc[nH]n1)c1ccc(F)cc1)c1ccc(Cl)cc1 ZINC000551197370 941426569 /nfs/dbraw/zinc/42/65/69/941426569.db2.gz NSXVRKZPDMWTNP-WOJBJXKFSA-N 0 3 401.917 4.359 20 0 HIADHN CC(=O)c1cc(C(=O)N(C[C@H]2CCN(Cc3ccccc3)C2)CC(F)(F)F)cs1 ZINC000551276211 941442082 /nfs/dbraw/zinc/44/20/82/941442082.db2.gz GFTMXMMXTZJXLQ-KRWDZBQOSA-N 0 3 424.488 4.477 20 0 HIADHN Cc1nc(C(C)C)ccc1C(=O)NC1CCN(CCOc2ccc(Cl)cc2)CC1 ZINC000551300512 941446259 /nfs/dbraw/zinc/44/62/59/941446259.db2.gz RMLNEJDLUAFJDI-UHFFFAOYSA-N 0 3 415.965 4.440 20 0 HIADHN COc1ccc(C[C@H](C)CN(C)CC(=O)Nc2cc(Cl)c(OC)cc2OC)cc1 ZINC000551305896 941447617 /nfs/dbraw/zinc/44/76/17/941447617.db2.gz VLPBLXKLVJHOHF-HNNXBMFYSA-N 0 3 420.937 4.115 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(-c4cc(F)c5ccccc5c4)n3)cn2)CC1 ZINC000551354286 941459668 /nfs/dbraw/zinc/45/96/68/941459668.db2.gz UPSJXDWPBNWYLN-UHFFFAOYSA-N 0 3 403.461 4.233 20 0 HIADHN Clc1cccc([C@H]2CN(C[C@@H]3CN(Cc4ccccc4)CCCO3)CCO2)c1 ZINC000551394910 941468894 /nfs/dbraw/zinc/46/88/94/941468894.db2.gz IHOOGVZQGRUASE-XZOQPEGZSA-N 0 3 400.950 4.004 20 0 HIADHN CC(C)Cc1ncc(CNc2ccc(C(=O)N(C)[C@H]3CCCN(C)C3)cc2)s1 ZINC000551446530 941480933 /nfs/dbraw/zinc/48/09/33/941480933.db2.gz RGNZTQBRZHDDIY-IBGZPJMESA-N 0 3 400.592 4.120 20 0 HIADHN Fc1cccc(C2(NCc3cccc(I)c3)CCOCC2)c1 ZINC000551537693 941497722 /nfs/dbraw/zinc/49/77/22/941497722.db2.gz LBLGBUSXULGKTK-UHFFFAOYSA-N 0 3 411.258 4.226 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)c2sc(Cc3ccccc3)nc2C)cc1 ZINC000551537172 941497803 /nfs/dbraw/zinc/49/78/03/941497803.db2.gz NSMPBCMMTPLLJX-FQEVSTJZSA-N 0 3 409.555 4.084 20 0 HIADHN COCC[C@@H](N[C@@H](C)c1ccc(-n2cnnn2)cc1)c1ccc(Cl)c(Cl)c1 ZINC000551572307 941504333 /nfs/dbraw/zinc/50/43/33/941504333.db2.gz YNPUOQUJOFPAAP-ORAYPTAESA-N 0 3 406.317 4.398 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NCc2ccc(-n3ccc(C(F)(F)F)n3)cc2)cc1 ZINC000551580381 941506420 /nfs/dbraw/zinc/50/64/20/941506420.db2.gz GJBMPEYMDKXEFF-HXUWFJFHSA-N 0 3 418.463 4.292 20 0 HIADHN O=C(N[C@@H](CCCO)c1ccccc1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000551680697 941525670 /nfs/dbraw/zinc/52/56/70/941525670.db2.gz UITFETXFACKNMJ-RBBKRZOGSA-N 0 3 420.475 4.071 20 0 HIADHN Cc1ccc(C)c(OC[C@@H](O)CN[C@@H](c2cncc(Br)c2)C2CC2)c1C ZINC000551718559 941532566 /nfs/dbraw/zinc/53/25/66/941532566.db2.gz IDJIKMBPPQAVPH-VQTJNVASSA-N 0 3 419.363 4.250 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@@H](N[C@H](C)c2ccc(S(=O)(=O)CC)cc2)c2ccccc21 ZINC000551812757 941550303 /nfs/dbraw/zinc/55/03/03/941550303.db2.gz NHKLBNUAQKLSAI-NPFVIJTESA-N 0 3 415.555 4.313 20 0 HIADHN C[C@H](N[C@H](CO)C[C@@H](O)C(C)(C)C)c1ccc(Br)cc1C(F)(F)F ZINC000551816285 941551661 /nfs/dbraw/zinc/55/16/61/941551661.db2.gz IOLPETMVGRVIII-ITDIGPHOSA-N 0 3 412.290 4.277 20 0 HIADHN CO[C@@H]1C[C@H](c2ccccc2)CC[C@@H]1NCC(=O)Nc1ccc(N2CCCC2)cc1C ZINC000552058700 941576755 /nfs/dbraw/zinc/57/67/55/941576755.db2.gz WSLYJBQKHKQELZ-IEZKXTBUSA-N 0 3 421.585 4.475 20 0 HIADHN FC(F)(F)[C@H](CN[C@@H]1CCCc2nc(-c3ccccc3)sc21)N1CCOCC1 ZINC000552097198 941584019 /nfs/dbraw/zinc/58/40/19/941584019.db2.gz WFXPDFWJBJEIPQ-WBVHZDCISA-N 0 3 411.493 4.040 20 0 HIADHN COc1ccccc1-c1ccc([C@@H](C)NC[C@@H](N2CCOCC2)C(F)(F)F)cc1 ZINC000552097218 941584670 /nfs/dbraw/zinc/58/46/70/941584670.db2.gz WTNFIEUSKZYFRK-IIBYNOLFSA-N 0 3 408.464 4.276 20 0 HIADHN C[C@H](Cc1ccc(Br)cc1)C(=O)N(C)CCCN(C)Cc1ccncc1 ZINC000552112874 941587506 /nfs/dbraw/zinc/58/75/06/941587506.db2.gz YILCDVMZZRKVRL-QGZVFWFLSA-N 0 3 418.379 4.003 20 0 HIADHN CN(CCCN(C)C(=O)c1cc(Br)ccc1Cl)Cc1ccncc1 ZINC000552112554 941587515 /nfs/dbraw/zinc/58/75/15/941587515.db2.gz IXCFCMQARPCIAD-UHFFFAOYSA-N 0 3 410.743 4.092 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@@H](O)C2)c1)c1csc(-c2ccc(Cl)cc2)n1 ZINC000552200478 941601263 /nfs/dbraw/zinc/60/12/63/941601263.db2.gz FUCKKNQBBCUADB-GOSISDBHSA-N 0 3 413.930 4.282 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)c1cc(NC(C)=O)ccc1F)c1ccc(Cl)cc1 ZINC000552243512 941612443 /nfs/dbraw/zinc/61/24/43/941612443.db2.gz FHJMWFJJCDTSJM-FQEVSTJZSA-N 0 3 405.901 4.250 20 0 HIADHN COc1cc(CN[C@H](C)c2ccc(OC)c(OC)c2C)cc(Br)c1O ZINC000552247763 941613467 /nfs/dbraw/zinc/61/34/67/941613467.db2.gz ZIDRBXNQXBDYSR-GFCCVEGCSA-N 0 3 410.308 4.340 20 0 HIADHN CCC[C@@H](C)C(=O)NCCNCc1cccc(NC(=O)c2ccc(Cl)cc2)c1 ZINC000552292447 941624342 /nfs/dbraw/zinc/62/43/42/941624342.db2.gz QRKGNQGEKKWRDL-MRXNPFEDSA-N 0 3 401.938 4.234 20 0 HIADHN COc1ccc(NC(=O)C[C@@H](C)N[C@H](CCO)c2ccc(Cl)c(Cl)c2)cc1 ZINC000552342612 941638997 /nfs/dbraw/zinc/63/89/97/941638997.db2.gz PTWRPPDAUUYKQT-BFUOFWGJSA-N 0 3 411.329 4.432 20 0 HIADHN C[C@H](C(=O)NC[C@@H]1CCO[C@H]1c1ccc(F)cc1)N1CCC(Cc2ccccc2)CC1 ZINC000552485410 941685243 /nfs/dbraw/zinc/68/52/43/941685243.db2.gz XLPIZYHLDOWSJP-VPHKFGTKSA-N 0 3 424.560 4.363 20 0 HIADHN C[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)Nc1cccc(CN2CC[C@@H](O)C2)c1 ZINC000552516075 941692310 /nfs/dbraw/zinc/69/23/10/941692310.db2.gz IMMMGXYIVYHMDE-FOIQADDNSA-N 0 3 406.448 4.089 20 0 HIADHN C[C@H](CC(=O)c1ccccc1F)C(=O)N1CC[C@]2(CCN(Cc3ccccc3)C2)C1 ZINC000552678986 941735952 /nfs/dbraw/zinc/73/59/52/941735952.db2.gz LSUGHNZWNNGNRK-CLOONOSVSA-N 0 3 408.517 4.159 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)c2ccc(COc3ccc(F)cc3)o2)cc1 ZINC000552817491 941775944 /nfs/dbraw/zinc/77/59/44/941775944.db2.gz QEADGRKSYIAPBG-OAQYLSRUSA-N 0 3 412.461 4.039 20 0 HIADHN C[C@@H](C(=O)N(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1)c1ccccn1 ZINC000552827764 941780372 /nfs/dbraw/zinc/78/03/72/941780372.db2.gz YIZHFJCDSAEVBL-ZJSXRUAMSA-N 0 3 414.553 4.274 20 0 HIADHN C[C@H](C(=O)N(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1)c1ccccn1 ZINC000552827763 941780549 /nfs/dbraw/zinc/78/05/49/941780549.db2.gz YIZHFJCDSAEVBL-XUZZJYLKSA-N 0 3 414.553 4.274 20 0 HIADHN CC[C@@H]1C[C@@H](C(=O)N(Cc2ccncc2)[C@@H]2CCCN(Cc3ccccc3)C2)CCO1 ZINC000552850307 941787768 /nfs/dbraw/zinc/78/77/68/941787768.db2.gz XOZJOICLZXZVIG-ISJGIBHGSA-N 0 3 421.585 4.280 20 0 HIADHN CCCN(C)[C@H](CNC(=O)c1coc(C2CCOCC2)n1)c1ccc(Cl)cc1 ZINC000553016690 941816886 /nfs/dbraw/zinc/81/68/86/941816886.db2.gz DKVMJWTXPVDKTL-LJQANCHMSA-N 0 3 405.926 4.035 20 0 HIADHN CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H]2CCSc3ccc(Cl)cc32)cc1 ZINC000553020999 941818560 /nfs/dbraw/zinc/81/85/60/941818560.db2.gz ONSOPYBUPVXUMH-WIYYLYMNSA-N 0 3 419.974 4.428 20 0 HIADHN CC(=O)CCc1ccc(OC[C@@H](O)CN[C@H]2CCSc3ccc(Cl)cc32)cc1 ZINC000553020998 941818671 /nfs/dbraw/zinc/81/86/71/941818671.db2.gz ONSOPYBUPVXUMH-RXVVDRJESA-N 0 3 419.974 4.428 20 0 HIADHN CN(CCC(=O)N[C@@H](c1cccs1)c1ccccc1)C[C@@H]1COc2ccccc2O1 ZINC000553063291 941826951 /nfs/dbraw/zinc/82/69/51/941826951.db2.gz JYTLBXMVDLTNHF-NTKDMRAZSA-N 0 3 422.550 4.116 20 0 HIADHN CO[C@@H]1CCCC[C@@H]1C(=O)N(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000553196240 941847488 /nfs/dbraw/zinc/84/74/88/941847488.db2.gz GWMAEPOTRHNFKA-DSNGMDLFSA-N 0 3 421.585 4.280 20 0 HIADHN O=C(C1CCSCC1)N(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000553196428 941847495 /nfs/dbraw/zinc/84/74/95/941847495.db2.gz NKISVRVNTHLRAL-HSZRJFAPSA-N 0 3 409.599 4.218 20 0 HIADHN O=C(CCc1ccco1)N(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000553196265 941847520 /nfs/dbraw/zinc/84/75/20/941847520.db2.gz HSXOHVCJKFSOAW-HSZRJFAPSA-N 0 3 403.526 4.301 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)NCc1cc(F)c(F)cc1Br ZINC000553247832 941856368 /nfs/dbraw/zinc/85/63/68/941856368.db2.gz SAUGIDZXCDPOMK-UHFFFAOYSA-N 0 3 423.257 4.465 20 0 HIADHN CC1CCN(C[C@@H]2CCCN(c3ccc(S(C)(=O)=O)cc3C(F)(F)F)C2)CC1 ZINC000553328918 941868404 /nfs/dbraw/zinc/86/84/04/941868404.db2.gz NEQWZIQGNXRCTO-INIZCTEOSA-N 0 3 418.525 4.057 20 0 HIADHN C[C@H]1CN(C(=O)c2cccc(CN(C)C)c2)C[C@H](c2cccc(C(F)(F)F)c2)O1 ZINC000553382882 941877271 /nfs/dbraw/zinc/87/72/71/941877271.db2.gz XHCCLORRQQRBKP-MGPUTAFESA-N 0 3 406.448 4.369 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)CCSc3cccc(Cl)c3)CC2)C[C@@H](C)O1 ZINC000553409522 941880677 /nfs/dbraw/zinc/88/06/77/941880677.db2.gz CAOOINHXFQWDMB-IAGOWNOFSA-N 0 3 411.011 4.170 20 0 HIADHN O=C(NCc1cc(F)c(F)cc1Br)c1cccc(CN2CCCC2)c1 ZINC000553587769 941914886 /nfs/dbraw/zinc/91/48/86/941914886.db2.gz YJLUEKFCEFMYBX-UHFFFAOYSA-N 0 3 409.274 4.253 20 0 HIADHN CCN1CC[C@@H](N(C)C(=O)Nc2ccc(Cl)cc2C(=O)c2ccc[nH]2)C[C@H]1C ZINC000553614943 941921835 /nfs/dbraw/zinc/92/18/35/941921835.db2.gz BPTODVCSZPHMGM-GDBMZVCRSA-N 0 3 402.926 4.236 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)CCCc2nc3ccccc3[nH]2)N(C)C)cc1 ZINC000553672866 941941757 /nfs/dbraw/zinc/94/17/57/941941757.db2.gz WMDJDFLEZAUGDS-JOCHJYFZSA-N 0 3 408.546 4.092 20 0 HIADHN CC(C)Oc1cc(Br)cc(C(=O)N2CCN([C@@H]3C[C@@H]3C)C[C@H](C)C2)c1 ZINC000553781630 941967070 /nfs/dbraw/zinc/96/70/70/941967070.db2.gz CZDCBJPAGHUQJR-YZVOILCLSA-N 0 3 409.368 4.039 20 0 HIADHN C[C@@H]1CCN(C(=O)NC[C@@H]2CCO[C@H]2c2ccccc2)CCN1Cc1ccccc1 ZINC000553825735 941978559 /nfs/dbraw/zinc/97/85/59/941978559.db2.gz OLNHDEUYOZDCMT-QDSKXPNFSA-N 0 3 407.558 4.070 20 0 HIADHN CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NCc1ccc(Cl)c(C(F)(F)F)c1 ZINC000553847323 941982789 /nfs/dbraw/zinc/98/27/89/941982789.db2.gz XPQZZAFWEILWJI-SFHVURJKSA-N 0 3 409.839 4.287 20 0 HIADHN C[C@@H]1CN(C(=O)c2cc(-c3ccccc3C(F)(F)F)on2)CCN(C2CCC2)C1 ZINC000553862678 941986287 /nfs/dbraw/zinc/98/62/87/941986287.db2.gz FJIMLIMEAUBMEY-AWEZNQCLSA-N 0 3 407.436 4.307 20 0 HIADHN CCCN(C)[C@H](CNC(=O)N[C@H](CO)c1sccc1C)c1ccc(Cl)cc1 ZINC000553894579 941993062 /nfs/dbraw/zinc/99/30/62/941993062.db2.gz PGUWBXQYHWYPHG-QZTJIDSGSA-N 0 3 409.983 4.126 20 0 HIADHN COC(=O)c1ccc(-c2nc(CN(C[C@H](C)c3ccccc3)[C@@H](C)CO)co2)cc1 ZINC000553936275 942002299 /nfs/dbraw/zinc/00/22/99/942002299.db2.gz SAGCDJQNUGWTQR-ROUUACIJSA-N 0 3 408.498 4.115 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)[C@@H]2C[C@@H]2c2c(F)cccc2F)N(C)C)cc1 ZINC000554011490 942018586 /nfs/dbraw/zinc/01/85/86/942018586.db2.gz DQNCNYGMNKFLLY-UEXGIBASSA-N 0 3 402.485 4.275 20 0 HIADHN CC1CCN([C@@H](CN2C(=O)[C@@H]3c4ccccc4CCN3C2=O)c2cccs2)CC1 ZINC000554034948 942022928 /nfs/dbraw/zinc/02/29/28/942022928.db2.gz PZLVWIBGASOFBU-FPOVZHCZSA-N 0 3 409.555 4.083 20 0 HIADHN C[C@H](N[C@H]1CCN(c2ccc(Cl)cc2Cl)C1=O)c1cccc(-n2ccnn2)c1 ZINC000554090280 942034444 /nfs/dbraw/zinc/03/44/44/942034444.db2.gz PLMQHZBLMWFMIC-UGSOOPFHSA-N 0 3 416.312 4.030 20 0 HIADHN O=C(CCC(F)(F)F)N1CCC[C@@H](N[C@@H]2CCCOc3cc(Cl)ccc32)C1 ZINC000554094622 942035153 /nfs/dbraw/zinc/03/51/53/942035153.db2.gz HTELFUUIGTWWQJ-GDBMZVCRSA-N 0 3 404.860 4.477 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1cccc(C(=O)N(CC)CC)c1)c1ccco1 ZINC000554112011 942038743 /nfs/dbraw/zinc/03/87/43/942038743.db2.gz FTWIIDNYNGYRPI-QFBILLFUSA-N 0 3 400.523 4.013 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1ccc(C(=O)NC2CCCC2)cc1)c1ccco1 ZINC000554147315 942050102 /nfs/dbraw/zinc/05/01/02/942050102.db2.gz VXQAZJRGMNXPBG-JXFKEZNVSA-N 0 3 412.534 4.203 20 0 HIADHN COc1ccc(CN2CC[C@H](N[C@@H]3CCCc4ccc(Cl)cc43)C2=O)c(OC)c1 ZINC000554355775 942111820 /nfs/dbraw/zinc/11/18/20/942111820.db2.gz ZSXJCDBMNCLFAO-RTWAWAEBSA-N 0 3 414.933 4.125 20 0 HIADHN CCCN(C)[C@H](CNC(=O)Nc1cccc(C(=O)NCC)c1)c1ccc(Cl)cc1 ZINC000554363202 942114495 /nfs/dbraw/zinc/11/44/95/942114495.db2.gz AWYQSGBVTAFWTE-HXUWFJFHSA-N 0 3 416.953 4.294 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)Nc1ccccc1C(=O)N1CCCCC1 ZINC000554384728 942121734 /nfs/dbraw/zinc/12/17/34/942121734.db2.gz KKMYJARDUMKMMC-UHFFFAOYSA-N 0 3 400.567 4.043 20 0 HIADHN OC[C@H](CN[C@@H](c1cccc(F)c1)c1cccc(Br)c1)c1cccnc1 ZINC000554404490 942128502 /nfs/dbraw/zinc/12/85/02/942128502.db2.gz ZZBSIXRSAOYQQW-GHTZIAJQSA-N 0 3 415.306 4.438 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)Nc2ccc(Cn3cccn3)cc2)N(C)C)cc1 ZINC000554413132 942132309 /nfs/dbraw/zinc/13/23/09/942132309.db2.gz OVOJDCSKABHGGL-QHCPKHFHSA-N 0 3 421.545 4.143 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1cc2c(cc1SC)OCCO2)c1ccco1 ZINC000554421968 942136351 /nfs/dbraw/zinc/13/63/51/942136351.db2.gz FNIRERWBEBTOKB-ZFWWWQNUSA-N 0 3 405.520 4.024 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](N[C@@H]2CCC23CCOCC3)c2ccc(F)c(F)c2)c1 ZINC000554558915 942167289 /nfs/dbraw/zinc/16/72/89/942167289.db2.gz NEFLKVRBJOQEPC-RTWAWAEBSA-N 0 3 421.509 4.007 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)c1ccc2c(c1)[nH]c(=O)n2C1CCCC1)c1ccco1 ZINC000554633956 942180616 /nfs/dbraw/zinc/18/06/16/942180616.db2.gz HYIBRCXAFGGVTM-KXBFYZLASA-N 0 3 410.518 4.309 20 0 HIADHN COC[C@H](NC(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1)c1cccc(Cl)c1 ZINC000554692644 942201228 /nfs/dbraw/zinc/20/12/28/942201228.db2.gz ZLCDWHWXMGGXDH-DQLDELGASA-N 0 3 401.938 4.162 20 0 HIADHN O[C@H](CNCc1ccc(-c2ccccc2)o1)COc1cccc(Br)c1 ZINC000554831644 942270416 /nfs/dbraw/zinc/27/04/16/942270416.db2.gz XASQWFSDWROSAI-QGZVFWFLSA-N 0 3 402.288 4.239 20 0 HIADHN CN(C[C@@H]1CCCN(Cc2ccc(-c3ccccc3Cl)s2)C1)S(C)(=O)=O ZINC000554873135 942302548 /nfs/dbraw/zinc/30/25/48/942302548.db2.gz RXSHOPXJKZQFSE-HNNXBMFYSA-N 0 3 413.008 4.172 20 0 HIADHN CC(C)CN(CCN(C)C)C(=O)Nc1cnn(-c2ccc(F)cc2)c1C(F)(F)F ZINC000555011429 942355416 /nfs/dbraw/zinc/35/54/16/942355416.db2.gz ZOVVITWPPMMPBW-UHFFFAOYSA-N 0 3 415.435 4.082 20 0 HIADHN CC(C)N1CC[C@@H](N[C@@H](C)C(=O)N(C)Cc2ccccc2)[C@@H]1c1ccc(F)c(F)c1 ZINC000555125672 942392572 /nfs/dbraw/zinc/39/25/72/942392572.db2.gz LKKBZOPHZPZGDA-IMRHEYAYSA-N 0 3 415.528 4.125 20 0 HIADHN C[C@H](NCC1=Cc2cc(Br)ccc2OC1)c1ccc2c(c1)CCC(=O)N2 ZINC000555196059 942426466 /nfs/dbraw/zinc/42/64/66/942426466.db2.gz RHHZKDGCGGXKBG-ZDUSSCGKSA-N 0 3 413.315 4.460 20 0 HIADHN CN(C)C[C@H](NC(=O)CCCc1nnc(-c2ccccc2)o1)c1ccc(Cl)cc1 ZINC000555231026 942438703 /nfs/dbraw/zinc/43/87/03/942438703.db2.gz SQRPWVYVHODKKU-IBGZPJMESA-N 0 3 412.921 4.132 20 0 HIADHN Cc1nc(-c2ccc(CN[C@H](C)c3ccc(NS(C)(=O)=O)cc3)cc2)cs1 ZINC000555406649 942518164 /nfs/dbraw/zinc/51/81/64/942518164.db2.gz JLNIDIKQKFBUBF-CQSZACIVSA-N 0 3 401.557 4.341 20 0 HIADHN O=C(NCCN1CCCC1)c1ccc(NCc2cnc(-c3ccsc3)s2)cc1 ZINC000555506654 942611135 /nfs/dbraw/zinc/61/11/35/942611135.db2.gz QRFZOGUTAGTIDN-UHFFFAOYSA-N 0 3 412.584 4.309 20 0 HIADHN CCOc1c(Cl)cccc1CNc1ccc(C(=O)NCCN2CCCC2)cc1 ZINC000555507527 942611287 /nfs/dbraw/zinc/61/12/87/942611287.db2.gz NGGVSLBQLGXQCN-UHFFFAOYSA-N 0 3 401.938 4.176 20 0 HIADHN CCOc1cc(CNCc2cc3ccccc3s2)ccc1O[C@H](C)C(=O)N(C)C ZINC000555592053 942658588 /nfs/dbraw/zinc/65/85/88/942658588.db2.gz JTEJLOZZOUGSDU-MRXNPFEDSA-N 0 3 412.555 4.445 20 0 HIADHN COc1cc(CC[NH2+]Cc2cc(Br)c([O-])c(OC)c2)ccc1Cl ZINC000555636112 942681473 /nfs/dbraw/zinc/68/14/73/942681473.db2.gz WKMJOIINSGVACE-UHFFFAOYSA-N 0 3 400.700 4.158 20 0 HIADHN COC1CCN(C(C)(C)CNC(=O)c2cnc(OC3CCCCC3)c(Cl)c2)CC1 ZINC000555952017 942777885 /nfs/dbraw/zinc/77/78/85/942777885.db2.gz KVJAODJUDQUBNA-UHFFFAOYSA-N 0 3 423.985 4.066 20 0 HIADHN COCCCn1nccc1CN[C@@H](c1cccc(C(F)(F)F)c1)C1CCOCC1 ZINC000556429404 942864669 /nfs/dbraw/zinc/86/46/69/942864669.db2.gz DVBGSPKVLGPHAY-HXUWFJFHSA-N 0 3 411.468 4.196 20 0 HIADHN CNC(=O)c1cccc(CN[C@H](c2cccc(C(F)(F)F)c2)C2CCOCC2)c1 ZINC000556515550 942889692 /nfs/dbraw/zinc/88/96/92/942889692.db2.gz QFWSIHGJBPGIOL-FQEVSTJZSA-N 0 3 406.448 4.323 20 0 HIADHN CC(C)Oc1ccc([C@@H](C)N[C@@H]2CCCN(Cc3ccccn3)C2=O)cc1Cl ZINC000556572891 942902540 /nfs/dbraw/zinc/90/25/40/942902540.db2.gz ITCLTFGKGRUBBM-OXQOHEQNSA-N 0 3 401.938 4.364 20 0 HIADHN CCCCOc1ccc([C@@H](C)NCc2ccc(C(=O)N3CCN(C)CC3)cc2)cc1 ZINC000556589144 942908294 /nfs/dbraw/zinc/90/82/94/942908294.db2.gz KBQSDODGJOFNNW-HXUWFJFHSA-N 0 3 409.574 4.104 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(CN3CCC(c4c[nH]nc4C)CC3)c2)cc1 ZINC000556608254 942912867 /nfs/dbraw/zinc/91/28/67/942912867.db2.gz KDXFXDGFLFEDJD-UHFFFAOYSA-N 0 3 404.514 4.359 20 0 HIADHN COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NCc1nc2cc(C(F)(F)F)ccc2n1C ZINC000556610185 942915152 /nfs/dbraw/zinc/91/51/52/942915152.db2.gz VAYSRCGDAUJEAY-RHSMWYFYSA-N 0 3 419.447 4.102 20 0 HIADHN COc1ccc(C[C@H]2CCCN(Cc3c(C)nn(C)c3OCC(F)(F)F)C2)cc1 ZINC000556883694 942949875 /nfs/dbraw/zinc/94/98/75/942949875.db2.gz UJTSMIJULWIPQT-QGZVFWFLSA-N 0 3 411.468 4.133 20 0 HIADHN Cc1nc(-c2ccccc2F)sc1[C@@H](C)NC[C@H](N1CCOCC1)C(F)(F)F ZINC000556924834 942968416 /nfs/dbraw/zinc/96/84/16/942968416.db2.gz WPJYCXIHFOESIZ-WBMJQRKESA-N 0 3 417.472 4.171 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)[C@H]1CC[C@H](C(F)(F)F)C1 ZINC000556937413 942973754 /nfs/dbraw/zinc/97/37/54/942973754.db2.gz NHVPHKNLEYCLRS-OKZBNKHCSA-N 0 3 406.452 4.247 20 0 HIADHN O=C([C@H]1CN(Cc2ccccc2)CCC1(F)F)N1CC[C@@H](COc2ccccc2)C1 ZINC000556967254 942982387 /nfs/dbraw/zinc/98/23/87/942982387.db2.gz YZHTWXNZNFFESH-IFMALSPDSA-N 0 3 414.496 4.071 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)[C@@H](C)Cc2cnc3ccccc3n2)N(C)C)cc1 ZINC000556989405 942988749 /nfs/dbraw/zinc/98/87/49/942988749.db2.gz CRBAYRKIYFIARZ-UUOWRZLLSA-N 0 3 420.557 4.015 20 0 HIADHN CN1CCN(CCC(C)(C)NC(=O)c2ccc(-c3cccc4cccnc43)cc2)CC1 ZINC000556991725 942989625 /nfs/dbraw/zinc/98/96/25/942989625.db2.gz SLHZFPLUZCVWHB-UHFFFAOYSA-N 0 3 416.569 4.048 20 0 HIADHN C[C@@H](CC(=O)Nc1cccc(CN2CC[C@@H](O)C2)c1)c1cccc(C(F)(F)F)c1 ZINC000557021679 942996560 /nfs/dbraw/zinc/99/65/60/942996560.db2.gz AFQRBYLXPLQHJF-MGPUTAFESA-N 0 3 406.448 4.404 20 0 HIADHN CO[C@H]1CCCC[C@H]1C(=O)N(Cc1ccccc1Br)C1CCN(C)CC1 ZINC000557160036 943034996 /nfs/dbraw/zinc/03/49/96/943034996.db2.gz HQGBEUILSFTRPD-QUCCMNQESA-N 0 3 423.395 4.077 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)c2ccc(C)c(Oc3ccncc3)c2)cc1 ZINC000557206877 943051556 /nfs/dbraw/zinc/05/15/56/943051556.db2.gz MGJSZGLNNZAOJD-QFIPXVFZSA-N 0 3 405.498 4.224 20 0 HIADHN Cc1nn(-c2ccccc2)cc1CCCN[C@@H](C)c1nnn(-c2ccccc2)c1C ZINC000557246771 943060454 /nfs/dbraw/zinc/06/04/54/943060454.db2.gz JHUPENFCIATHJL-IBGZPJMESA-N 0 3 400.530 4.353 20 0 HIADHN COc1cccc(C(=O)CCCC(=O)N2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)c1 ZINC000557394997 943099672 /nfs/dbraw/zinc/09/96/72/943099672.db2.gz IPPUTZAKLQCBRY-AREMUKBSSA-N 0 3 420.553 4.173 20 0 HIADHN Cc1ccc(C)c(OC[C@H](O)CNCc2ccc(Oc3cccnc3)c(F)c2)c1C ZINC000557480412 943156083 /nfs/dbraw/zinc/15/60/83/943156083.db2.gz IBYSGDDZESDTSN-HXUWFJFHSA-N 0 3 410.489 4.468 20 0 HIADHN COc1ccccc1NC(=O)CN[C@H](Cc1ccc(OC)c(OC)c1)c1ccccc1 ZINC000557502059 943171314 /nfs/dbraw/zinc/17/13/14/943171314.db2.gz RDWIRHDRFLAMQA-OAQYLSRUSA-N 0 3 420.509 4.225 20 0 HIADHN Cc1nc(COc2ccc(Cl)cc2)sc1C(=O)N1C[C@H](N2CCCC2)C[C@H]1C ZINC000557599702 943226250 /nfs/dbraw/zinc/22/62/50/943226250.db2.gz HZZCRTHLRZVZRN-RHSMWYFYSA-N 0 3 419.978 4.383 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)c1ccc(C(=O)N(C)c2ccccc2)cc1 ZINC000557629841 943238840 /nfs/dbraw/zinc/23/88/40/943238840.db2.gz KLWYEEKYMLWROB-UHFFFAOYSA-N 0 3 407.558 4.301 20 0 HIADHN Cc1cc([C@@H](NCC(=O)N2CCC(C(=O)Nc3ccccc3)CC2)C2CC2)ccc1F ZINC000557710190 943265045 /nfs/dbraw/zinc/26/50/45/943265045.db2.gz ROXYWDRMFORBRB-DEOSSOPVSA-N 0 3 423.532 4.052 20 0 HIADHN C[C@@H]1C[C@@H](N(C)S(=O)(=O)c2ccc(C(F)F)cc2)CCN1Cc1ccccc1 ZINC000557824740 943304949 /nfs/dbraw/zinc/30/49/49/943304949.db2.gz LBVDYYXPRMEDOQ-APWZRJJASA-N 0 3 408.514 4.298 20 0 HIADHN C/C=C/c1ccc(OC[C@@H](O)CNCc2csc(Br)c2)c(OC)c1 ZINC000557888741 943321227 /nfs/dbraw/zinc/32/12/27/943321227.db2.gz HTDBNJRLSXGTSS-BWPKMQGJSA-N 0 3 412.349 4.082 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)c2cnc(-c3ccccn3)s2)N(C)C)cc1 ZINC000557936978 943333712 /nfs/dbraw/zinc/33/37/12/943333712.db2.gz TTWHVEFPVCBSIX-IBGZPJMESA-N 0 3 410.543 4.025 20 0 HIADHN C[C@@H]1C[C@@H]1N1CCN(C(=O)c2cc(Cl)cc(F)c2Br)C[C@@H](C)C1 ZINC000558027622 943360980 /nfs/dbraw/zinc/36/09/80/943360980.db2.gz QZHNGBNQHYNTFD-RWSFTLGLSA-N 0 3 403.723 4.044 20 0 HIADHN COc1cc([C@@H](C)NCC2(c3cc(Cl)ccc3OC)CCOCC2)c(F)cn1 ZINC000558221350 943440486 /nfs/dbraw/zinc/44/04/86/943440486.db2.gz GGFLEPVPSOVWNE-CQSZACIVSA-N 0 3 408.901 4.290 20 0 HIADHN CN(C)C[C@H](NC(=O)Nc1cc(F)ccc1OCC(F)(F)F)c1ccc(F)cc1 ZINC000558288824 943485429 /nfs/dbraw/zinc/48/54/29/943485429.db2.gz FGZXEWFYNGLBCW-INIZCTEOSA-N 0 3 417.378 4.330 20 0 HIADHN CCC(C)(C)NC(=O)c1ccc(NC(=O)N[C@@H](CN(C)C)c2ccc(F)cc2)cc1 ZINC000558297924 943490842 /nfs/dbraw/zinc/49/08/42/943490842.db2.gz YAKANBJKZYYHEY-FQEVSTJZSA-N 0 3 414.525 4.169 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)Nc2ccccc2-n2cccn2)N(C)C)cc1 ZINC000558306293 943495227 /nfs/dbraw/zinc/49/52/27/943495227.db2.gz PNQHWYMTDSSYHF-QFIPXVFZSA-N 0 3 407.518 4.084 20 0 HIADHN CN(Cc1ccc(OCC(F)(F)F)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000558361454 943525758 /nfs/dbraw/zinc/52/57/58/943525758.db2.gz KANNLCOUGHXOHE-IBGZPJMESA-N 0 3 421.463 4.044 20 0 HIADHN FC(F)Oc1cc(-c2noc([C@H]3CN(Cc4ccccc4)CCC3(F)F)n2)ccn1 ZINC000558388506 943541952 /nfs/dbraw/zinc/54/19/52/943541952.db2.gz MXIAFGZRXJBWLL-OAHLLOKOSA-N 0 3 422.382 4.358 20 0 HIADHN CCOC(=O)c1nnc(-c2cccc(C[NH2+]Cc3cccc(-c4ccncc4)c3)c2)[n-]1 ZINC000558420840 943554956 /nfs/dbraw/zinc/55/49/56/943554956.db2.gz WSZGEQXLUDUDNI-UHFFFAOYSA-N 0 3 413.481 4.000 20 0 HIADHN CCOC(=O)c1nc(-c2cccc(C[NH2+]Cc3cccc(-c4ccncc4)c3)c2)n[n-]1 ZINC000558420840 943554958 /nfs/dbraw/zinc/55/49/58/943554958.db2.gz WSZGEQXLUDUDNI-UHFFFAOYSA-N 0 3 413.481 4.000 20 0 HIADHN C[C@H](N[C@H]1CCN(C)[C@@H]1c1ccc(Cl)cc1)C(=O)Nc1cccc2ncccc21 ZINC000558467563 943567560 /nfs/dbraw/zinc/56/75/60/943567560.db2.gz SGZKOYHQXYJKSR-UZQPLGKSSA-N 0 3 408.933 4.250 20 0 HIADHN C[C@H](N[C@H]1CCN(C)[C@H]1c1ccc(F)c(F)c1)C(=O)Nc1cc(Cl)ccc1F ZINC000558475911 943569059 /nfs/dbraw/zinc/56/90/59/943569059.db2.gz MRPHQJRHLVWELT-AHYKXKOGSA-N 0 3 411.855 4.119 20 0 HIADHN Brc1ccccc1-n1cc(CN[C@H]2CCOC3(CCCCC3)C2)nn1 ZINC000558486387 943573025 /nfs/dbraw/zinc/57/30/25/943573025.db2.gz WNNIOLCEUMEIPQ-HNNXBMFYSA-N 0 3 405.340 4.001 20 0 HIADHN CN(C)c1noc([C@H]2CCCN([C@@H]3CCCc4ccc(Br)cc43)C2)n1 ZINC000558728897 943633674 /nfs/dbraw/zinc/63/36/74/943633674.db2.gz BAPNAWCWHVBEOS-WMLDXEAASA-N 0 3 405.340 4.155 20 0 HIADHN c1coc(-c2noc(CN[C@@H]3CN(Cc4ccccc4)C[C@H]3c3ccccc3)n2)c1 ZINC000558737954 943635923 /nfs/dbraw/zinc/63/59/23/943635923.db2.gz PIKPYISGAZXWEI-LEWJYISDSA-N 0 3 400.482 4.087 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)N1CC[C@@](F)(c2ccccc2F)C1 ZINC000558884302 943718108 /nfs/dbraw/zinc/71/81/08/943718108.db2.gz AXBMIFFNDNSHQX-RXVVDRJESA-N 0 3 405.514 4.304 20 0 HIADHN Cn1nccc1C1=C[C@H]2CC[C@@H](C1)N2CCC(=O)Nc1c(Cl)cccc1Cl ZINC000558897523 943732703 /nfs/dbraw/zinc/73/27/03/943732703.db2.gz VYDXHOVAXHEPMQ-CABCVRRESA-N 0 3 405.329 4.376 20 0 HIADHN CCc1cccc(C)c1NC(=O)CN[C@H]1CCN(C2CC2)[C@H]1c1cccc(OC)c1 ZINC000558902613 943737262 /nfs/dbraw/zinc/73/72/62/943737262.db2.gz SAWDISOOEJYHJM-DHLKQENFSA-N 0 3 407.558 4.072 20 0 HIADHN CC(C)CC(=O)Nc1ccc(C(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)cc1F ZINC000558972353 943777813 /nfs/dbraw/zinc/77/78/13/943777813.db2.gz KAYSPYBPOAQPCJ-HXUWFJFHSA-N 0 3 419.928 4.496 20 0 HIADHN CCOC(=O)[C@H]1CC[C@H](Nc2ccccc2N2CCN(CC)CC2)c2ccccc21 ZINC000558975739 943778723 /nfs/dbraw/zinc/77/87/23/943778723.db2.gz ARHNXESFQKKPFB-VXKWHMMOSA-N 0 3 407.558 4.422 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@H](Nc2ccccc2N2CCN(CC)CC2)c2ccccc21 ZINC000558975740 943779185 /nfs/dbraw/zinc/77/91/85/943779185.db2.gz ARHNXESFQKKPFB-YADHBBJMSA-N 0 3 407.558 4.422 20 0 HIADHN CN(C)Cc1ccccc1NC(=O)C1CCN(c2noc3ccc(Cl)cc32)CC1 ZINC000559020537 943806471 /nfs/dbraw/zinc/80/64/71/943806471.db2.gz DRTRCZNOMGIUSJ-UHFFFAOYSA-N 0 3 412.921 4.398 20 0 HIADHN CCc1oc(CNC[C@@H]2CCN(c3ccc(Br)cc3)C2)cc1C(=O)OC ZINC000559067786 943822215 /nfs/dbraw/zinc/82/22/15/943822215.db2.gz OFLQDDFNVCJUNO-AWEZNQCLSA-N 0 3 421.335 4.007 20 0 HIADHN Fc1ccc2c(c1)CCN2C1CCN(Cc2ccc(Oc3cnccn3)cc2)CC1 ZINC000559073973 943825197 /nfs/dbraw/zinc/82/51/97/943825197.db2.gz PNLPGSQKGTXXKR-UHFFFAOYSA-N 0 3 404.489 4.435 20 0 HIADHN Clc1ccc(-c2n[nH]cc2CN(Cc2ccc(-n3cncn3)cc2)C2CC2)cc1 ZINC000559098260 943838135 /nfs/dbraw/zinc/83/81/35/943838135.db2.gz UAXSRIHDJPPWEY-UHFFFAOYSA-N 0 3 404.905 4.475 20 0 HIADHN CCO[C@@H]1C[C@@H](NCc2cccc(NC(=O)c3ccc(Cl)cc3)c2)[C@@H]1n1cccn1 ZINC000559365049 943912236 /nfs/dbraw/zinc/91/22/36/943912236.db2.gz OOQROHHOXKWGAC-VSKRKVRLSA-N 0 3 424.932 4.297 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)NCc1cccc(N(C)C)c1 ZINC000559394893 943931176 /nfs/dbraw/zinc/93/11/76/943931176.db2.gz KQTNXBCVFXHJAM-UHFFFAOYSA-N 0 3 422.495 4.045 20 0 HIADHN O[C@@H](CNCc1ccccc1OCC(F)(F)F)COc1ccc2ccccc2c1 ZINC000559735755 944040354 /nfs/dbraw/zinc/04/03/54/944040354.db2.gz FDDWWZTULOSUJG-IBGZPJMESA-N 0 3 405.416 4.310 20 0 HIADHN O=S(=O)(CCCN[C@H]1CCc2sc(Br)cc21)Cc1ccccc1 ZINC000559740875 944042238 /nfs/dbraw/zinc/04/22/38/944042238.db2.gz HBIJTRYWSLGJHK-HNNXBMFYSA-N 0 3 414.390 4.093 20 0 HIADHN COC(=O)C1CCN(CCCNC(=O)c2csc(-c3ccc(Cl)cc3)c2)CC1 ZINC000559756374 944044920 /nfs/dbraw/zinc/04/49/20/944044920.db2.gz VTJVONQVFQVFMR-UHFFFAOYSA-N 0 3 420.962 4.073 20 0 HIADHN CN1CC[C@@H](NCc2cn3cc(Cl)cc(Cl)c3n2)[C@H]1c1ccc(F)c(F)c1 ZINC000559793636 944052424 /nfs/dbraw/zinc/05/24/24/944052424.db2.gz OITHOEDMLNTDAQ-QZTJIDSGSA-N 0 3 411.283 4.454 20 0 HIADHN O=C(N[C@H]1CCN(Cc2ccccc2)C1)NC1(c2cccc(C(F)(F)F)c2)CC1 ZINC000559828728 944061926 /nfs/dbraw/zinc/06/19/26/944061926.db2.gz HTSMFYICKSLNFB-IBGZPJMESA-N 0 3 403.448 4.268 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)NC1(c2cccc(C(F)(F)F)c2)CC1 ZINC000559827693 944062199 /nfs/dbraw/zinc/06/21/99/944062199.db2.gz ZFWHEZRZPKVIIQ-UHFFFAOYSA-N 0 3 417.475 4.442 20 0 HIADHN C[C@@]1(CN[C@H]2CCS(=O)(=O)c3ccc(Br)cc32)C[C@H]1c1ccccc1 ZINC000559880168 944073060 /nfs/dbraw/zinc/07/30/60/944073060.db2.gz DXOIPUQWQXNRHZ-BJLQDIEVSA-N 0 3 420.372 4.451 20 0 HIADHN C[C@@H](NCCCS(=O)(=O)c1ccc(Cl)cc1)c1ccccc1OC(F)F ZINC000559918092 944084547 /nfs/dbraw/zinc/08/45/47/944084547.db2.gz RQCRVJAOYOLEBA-CYBMUJFWSA-N 0 3 403.878 4.456 20 0 HIADHN C[C@H](NCCCS(=O)(=O)c1ccc(Cl)cc1)c1cccc(OC(F)F)c1 ZINC000559919444 944084676 /nfs/dbraw/zinc/08/46/76/944084676.db2.gz NSLHRSSINDRMDI-ZDUSSCGKSA-N 0 3 403.878 4.456 20 0 HIADHN CN1CCN(CCCCNC(=O)N[C@H]2CCCCC[C@H]2c2ccc(Cl)cc2)CC1 ZINC000560092705 944156701 /nfs/dbraw/zinc/15/67/01/944156701.db2.gz YZLYRDQRASKOIG-VXKWHMMOSA-N 0 3 421.029 4.083 20 0 HIADHN CN1CCN(CCCCNC(=O)N[C@@H]2CCCCC[C@@H]2c2ccc(Cl)cc2)CC1 ZINC000560092702 944156774 /nfs/dbraw/zinc/15/67/74/944156774.db2.gz YZLYRDQRASKOIG-FGZHOGPDSA-N 0 3 421.029 4.083 20 0 HIADHN Cc1csc2nc(CN(Cc3cccs3)C3Cc4ccccc4C3)cc(=O)n12 ZINC000560182567 944189615 /nfs/dbraw/zinc/18/96/15/944189615.db2.gz HCJWYCIHDXTERN-UHFFFAOYSA-N 0 3 407.564 4.296 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)c2cnc(-c3ccc(F)c(F)c3)s2)cc1 ZINC000560248162 944206734 /nfs/dbraw/zinc/20/67/34/944206734.db2.gz CDTGRZXUYWCPGJ-SFHVURJKSA-N 0 3 417.481 4.130 20 0 HIADHN COc1ccc([C@H](CN(C)C)N[C@@H]2CCc3c2cc(Br)cc3F)cc1 ZINC000560261525 944210175 /nfs/dbraw/zinc/21/01/75/944210175.db2.gz ZJNSMXWPZGFDSP-UXHICEINSA-N 0 3 407.327 4.477 20 0 HIADHN Cc1c([C@H](C)N[C@H](CO)C[C@H](O)C(C)(C)C)cnn1-c1ccc(Cl)cc1Cl ZINC000560267440 944213408 /nfs/dbraw/zinc/21/34/08/944213408.db2.gz CRHGXOSCHHLKQC-ODYMNIRHSA-N 0 3 414.377 4.296 20 0 HIADHN CCOc1cc2c(cc1CNC[C@H](O)CO[C@@H](C)c1ccc(Cl)cc1)O[C@H](C)C2 ZINC000560315319 944225072 /nfs/dbraw/zinc/22/50/72/944225072.db2.gz WHBUZMLTGWAHBG-XFQAVAEZSA-N 0 3 419.949 4.290 20 0 HIADHN O=C(c1cnc(Cc2ccccc2)s1)N1CCN(c2ccnc3ccccc32)CC1 ZINC000560489435 944238007 /nfs/dbraw/zinc/23/80/07/944238007.db2.gz VBLVOVXCMQRBAB-UHFFFAOYSA-N 0 3 414.534 4.245 20 0 HIADHN COc1cc(CN2CCC(CO)(c3ccccc3)CC2)ccc1OCc1ccncc1 ZINC000560557007 944253723 /nfs/dbraw/zinc/25/37/23/944253723.db2.gz TXPZEJICMXRVOK-UHFFFAOYSA-N 0 3 418.537 4.195 20 0 HIADHN CNS(=O)(=O)c1cccc([C@H](C)NC[C@@H](OCC2CC2)c2ccc(Cl)cc2)c1 ZINC000560570533 944258233 /nfs/dbraw/zinc/25/82/33/944258233.db2.gz RIKFMWWPVHZAGA-YCRPNKLZSA-N 0 3 422.978 4.067 20 0 HIADHN CN(CCCN(C)C(=O)[C@H]1C[C@@H]1c1ccc(Cl)cc1Cl)Cc1ccncc1 ZINC000560594258 944266642 /nfs/dbraw/zinc/26/66/42/944266642.db2.gz FZBJHFJYZHZRMV-MOPGFXCFSA-N 0 3 406.357 4.472 20 0 HIADHN CN(CCCN(C)C(=O)c1cc(C2CC2)nc2ccc(F)cc21)Cc1ccncc1 ZINC000560596606 944268122 /nfs/dbraw/zinc/26/81/22/944268122.db2.gz OQAUWXDSVDSXEJ-UHFFFAOYSA-N 0 3 406.505 4.240 20 0 HIADHN O=C([C@@H]1CN(Cc2ccccc2)CCC1(F)F)N1CCc2c3ccccc3[nH]c2C1 ZINC000560611867 944274609 /nfs/dbraw/zinc/27/46/09/944274609.db2.gz MPGSOKCOJSRDDU-FQEVSTJZSA-N 0 3 409.480 4.210 20 0 HIADHN O=C([C@@H]1CN(Cc2ccccc2)CCC1(F)F)N1CC=C(c2ccccc2F)C1 ZINC000560624813 944278960 /nfs/dbraw/zinc/27/89/60/944278960.db2.gz SBWFPEONVXABRK-FQEVSTJZSA-N 0 3 400.444 4.209 20 0 HIADHN O=C(N[C@@H]1CCO[C@@H](c2ccccc2)C1)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000560632493 944281114 /nfs/dbraw/zinc/28/11/14/944281114.db2.gz NRFBQDHNSUCZMX-BHIFYINESA-N 0 3 414.496 4.180 20 0 HIADHN C[C@@H]1CCc2[nH]c3ccc(C(=O)Nc4cccc(CN5CC[C@@H](O)C5)c4)cc3c2C1 ZINC000560675349 944290057 /nfs/dbraw/zinc/29/00/57/944290057.db2.gz IDJZFXPYOQJQFN-OXQOHEQNSA-N 0 3 403.526 4.112 20 0 HIADHN CCOc1cc(CN(C)CCC(=O)N2CCc3ccccc32)ccc1OC(F)F ZINC000560978350 944384312 /nfs/dbraw/zinc/38/43/12/944384312.db2.gz DJRKMGHPLNXTOP-UHFFFAOYSA-N 0 3 404.457 4.098 20 0 HIADHN O=C(NC[C@@H](NCc1ccccc1)c1ccco1)c1cccc(CN2CCCC2)c1 ZINC000561088481 944441910 /nfs/dbraw/zinc/44/19/10/944441910.db2.gz WIRSMWKARYDKIR-HSZRJFAPSA-N 0 3 403.526 4.136 20 0 HIADHN COc1ccccc1[C@@H]1CC[C@@H](C)CN1C(=O)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000561092375 944445128 /nfs/dbraw/zinc/44/51/28/944445128.db2.gz XWCNYYGBLUUQKF-LSWJPFSZSA-N 0 3 407.558 4.302 20 0 HIADHN COC(=O)c1sc2[nH]c(CN[C@@H](c3ccccc3C)C(C)(C)C)nc(=O)c2c1C ZINC000561161289 944490369 /nfs/dbraw/zinc/49/03/69/944490369.db2.gz SIXZAVODBUWKGD-SFHVURJKSA-N 0 3 413.543 4.265 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)c1csc(-c2ccc(OC)c(OC)c2)n1 ZINC000561269053 944534544 /nfs/dbraw/zinc/53/45/44/944534544.db2.gz KINYSDWQESATJU-UHFFFAOYSA-N 0 3 417.575 4.165 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)CCc1nnc(-c2ccc(Cl)cc2)o1 ZINC000561268559 944534660 /nfs/dbraw/zinc/53/46/60/944534660.db2.gz AUXCZMBTYXAAFP-UHFFFAOYSA-N 0 3 404.942 4.047 20 0 HIADHN Cc1n[nH]cc1C1CCN(C(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)CC1 ZINC000561288929 944540965 /nfs/dbraw/zinc/54/09/65/944540965.db2.gz MJKANUKBKRHEOE-HXUWFJFHSA-N 0 3 415.607 4.142 20 0 HIADHN CCS(=O)(=O)c1ccc([C@@H](C)N[C@H](C)CC(=O)Nc2cccc(C)c2C)cc1 ZINC000561297694 944543109 /nfs/dbraw/zinc/54/31/09/944543109.db2.gz IFTRLYQFCJYAKL-SJLPKXTDSA-N 0 3 402.560 4.165 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2ccccc2N2C[C@@H](C)O[C@H](C)C2)N(C)C)cc1 ZINC000561355764 944561581 /nfs/dbraw/zinc/56/15/81/944561581.db2.gz KLTABFPQMQARRK-PWHSHALESA-N 0 3 410.562 4.033 20 0 HIADHN CC[C@@H](C)N[C@@H](CNc1cc(C(F)(F)F)nc(-c2cccnc2)n1)c1ccco1 ZINC000561357289 944561721 /nfs/dbraw/zinc/56/17/21/944561721.db2.gz ZANZPWIWIFQXAV-HIFRSBDPSA-N 0 3 405.424 4.692 20 0 HIADHN CN(C)C[C@H](NC(=O)[C@@H]1C[C@H]1c1cccc(Br)c1)c1ccc(F)cc1 ZINC000561369552 944563414 /nfs/dbraw/zinc/56/34/14/944563414.db2.gz GYNIWMMHVDZABD-OTWHNJEPSA-N 0 3 405.311 4.111 20 0 HIADHN CSc1ccc([C@@H](CNC(=O)c2csc(-c3ncccc3F)n2)N(C)C)cc1 ZINC000561378433 944568305 /nfs/dbraw/zinc/56/83/05/944568305.db2.gz VWDFEONTMFPIOZ-QGZVFWFLSA-N 0 3 416.547 4.099 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N(C)Cc1nc(-c2cccs2)no1)c1ccsc1 ZINC000561463205 944617758 /nfs/dbraw/zinc/61/77/58/944617758.db2.gz RUHKWPOIQBRKLR-OAHLLOKOSA-N 0 3 419.576 4.084 20 0 HIADHN CN(C)C[C@H](NC(=O)c1cccc(-n2ccc(C(F)(F)F)n2)c1)c1ccc(F)cc1 ZINC000561621239 944712594 /nfs/dbraw/zinc/71/25/94/944712594.db2.gz MWMICGQENIYMKZ-SFHVURJKSA-N 0 3 420.410 4.063 20 0 HIADHN CSc1ccc([C@H](CNC(=O)c2c(C)nn(Cc3ccccc3)c2C)N(C)C)cc1 ZINC000561726022 944765701 /nfs/dbraw/zinc/76/57/01/944765701.db2.gz BBNQUOCKESHTQG-QFIPXVFZSA-N 0 3 422.598 4.303 20 0 HIADHN C[C@@H]1C[C@H]1N1CCN(C(=O)C(C)(C)c2csc(-c3ccccc3F)n2)C[C@@H](C)C1 ZINC000561761021 944783449 /nfs/dbraw/zinc/78/34/49/944783449.db2.gz KEUXCWMFVAVXEB-FRQCXROJSA-N 0 3 415.578 4.416 20 0 HIADHN Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)N[C@H]1CCN(Cc2ccccc2)[C@H]1C ZINC000561798791 944801367 /nfs/dbraw/zinc/80/13/67/944801367.db2.gz HGGCIDZAJQRIKB-CVDCTZTESA-N 0 3 420.557 4.016 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)N[C@H]2CCN(Cc3ccccc3)[C@@H]2C)c(C)c1 ZINC000561802980 944803439 /nfs/dbraw/zinc/80/34/39/944803439.db2.gz CJFPVBXGGUALHH-YYDVJCTNSA-N 0 3 422.573 4.308 20 0 HIADHN Cc1ccc(SC2CCCC2)c(C(=O)NC[C@]2(O)CCN(Cc3ccccc3)C2)c1 ZINC000561810493 944806078 /nfs/dbraw/zinc/80/60/78/944806078.db2.gz JZUYGIWSQIEHKM-RUZDIDTESA-N 0 3 424.610 4.397 20 0 HIADHN CCCN(C)[C@H](CNC(=O)N[C@H](C)c1c(F)cncc1F)c1ccc(Cl)cc1 ZINC000561878669 944834383 /nfs/dbraw/zinc/83/43/83/944834383.db2.gz VMDLIAYHNFJADN-FZKQIMNGSA-N 0 3 410.896 4.457 20 0 HIADHN C[C@@H](NC(=O)Cc1noc(C2CCN(C3CC3)CC2)n1)c1ccc(Cl)cc1Cl ZINC000561922528 944858708 /nfs/dbraw/zinc/85/87/08/944858708.db2.gz LVFYZJODOLTKIH-GFCCVEGCSA-N 0 3 423.344 4.138 20 0 HIADHN COc1cc(CN2CCCN(c3ccccc3)CC2)cc(OC)c1OCC(F)F ZINC000561947112 944870899 /nfs/dbraw/zinc/87/08/99/944870899.db2.gz PXBSQYMJVGLEIE-UHFFFAOYSA-N 0 3 406.473 4.060 20 0 HIADHN C[C@H](N[C@@H]1CCN(C)[C@H]1c1ccc(Cl)cc1)C(=O)Nc1cc(Cl)ccc1F ZINC000562050514 944912506 /nfs/dbraw/zinc/91/25/06/944912506.db2.gz WGKHNDRMCODHPQ-WILYLXEWSA-N 0 3 410.320 4.495 20 0 HIADHN Cc1nc(C(C)C)sc1[C@@H](C)N[C@@H]1CCCN(S(=O)(=O)c2cccs2)C1 ZINC000562057551 944915129 /nfs/dbraw/zinc/91/51/29/944915129.db2.gz JYVGNNHJXVBFLL-UKRRQHHQSA-N 0 3 413.634 4.140 20 0 HIADHN CNC(=O)Cc1nc(CN[C@H](Cc2ccccc2C(F)(F)F)C(C)(C)C)cs1 ZINC000562069778 944920501 /nfs/dbraw/zinc/92/05/01/944920501.db2.gz CYGYPCVHVDCWPN-MRXNPFEDSA-N 0 3 413.509 4.197 20 0 HIADHN O=C1[C@H](N[C@H]2c3ccccc3CC23CCOCC3)CCN1c1ccc(Cl)c(F)c1 ZINC000562071097 944921639 /nfs/dbraw/zinc/92/16/39/944921639.db2.gz UHPJSCLJYIOVPO-RTWAWAEBSA-N 0 3 414.908 4.268 20 0 HIADHN CN(C)C[C@@H](NC(=O)Nc1ccc(N(C)C)cc1C(F)(F)F)c1ccc(F)cc1 ZINC000562088211 944931147 /nfs/dbraw/zinc/93/11/47/944931147.db2.gz ZVQPPOXFJWAPML-GOSISDBHSA-N 0 3 412.431 4.335 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)Nc1ccccc1CN1CCSCC1)c1ccco1 ZINC000562123727 944955520 /nfs/dbraw/zinc/95/55/20/944955520.db2.gz FHAUSVDUEINUEW-YLJYHZDGSA-N 0 3 416.591 4.079 20 0 HIADHN CCCNC(=O)c1ccc(NC(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)cc1Cl ZINC000562140005 944967829 /nfs/dbraw/zinc/96/78/29/944967829.db2.gz OJBFBUMNOLKYFT-FOIQADDNSA-N 0 3 416.953 4.293 20 0 HIADHN C[C@@H](NC(=O)NC[C@@H](Cc1ccccc1)N(C)C)c1ccc(Oc2cccnc2)cc1 ZINC000562174379 945002879 /nfs/dbraw/zinc/00/28/79/945002879.db2.gz BVNSBLGHDIWLBN-DENIHFKCSA-N 0 3 418.541 4.407 20 0 HIADHN O=C(CN1CCCC2(CCOCC2)C1)NCCC(c1ccccc1)c1ccccc1 ZINC000562243471 945039170 /nfs/dbraw/zinc/03/91/70/945039170.db2.gz LQVFDDQDLPIJOP-UHFFFAOYSA-N 0 3 406.570 4.217 20 0 HIADHN CN(C)Cc1ccccc1NC(=O)CCC(=O)Nc1nnc(C2CCCCC2)s1 ZINC000562338441 945061700 /nfs/dbraw/zinc/06/17/00/945061700.db2.gz NWCLRSGWELSJLJ-UHFFFAOYSA-N 0 3 415.563 4.005 20 0 HIADHN Cc1cccc2cc(C(=O)Nc3cccc(CN4CCC(C(N)=O)CC4)c3)sc21 ZINC000564079218 945373244 /nfs/dbraw/zinc/37/32/44/945373244.db2.gz SZMYZUGARTVAEL-UHFFFAOYSA-N 0 3 407.539 4.159 20 0 HIADHN COc1cccc(Oc2ccc(CN[C@@H](C)c3cccc(-n4ccnn4)c3)cn2)c1 ZINC000564093113 945376078 /nfs/dbraw/zinc/37/60/78/945376078.db2.gz MMMVSQZYJXKULL-KRWDZBQOSA-N 0 3 401.470 4.314 20 0 HIADHN COc1ccc2ccccc2c1-c1cc(CN[C@H](CC(N)=O)C2CCCCC2)on1 ZINC000564130067 945394022 /nfs/dbraw/zinc/39/40/22/945394022.db2.gz WDNCOFGXVUZRKG-HXUWFJFHSA-N 0 3 407.514 4.417 20 0 HIADHN Cc1cccc2c1[C@@H](C)C[C@H]2Cc1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1 ZINC000564372167 945538492 /nfs/dbraw/zinc/53/84/92/945538492.db2.gz UBSZWLKPWCGZLM-ICSRJNTNSA-N 0 3 417.557 4.415 20 0 HIADHN Cc1cccc2c1[C@H](C)C[C@@H]2Cc1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1 ZINC000564372173 945538591 /nfs/dbraw/zinc/53/85/91/945538591.db2.gz UBSZWLKPWCGZLM-UYAOXDASSA-N 0 3 417.557 4.415 20 0 HIADHN Cc1cc(-c2ncco2)ccc1NC(=O)c1ccc(N2CCN(C(C)C)CC2)cc1 ZINC000564377977 945541873 /nfs/dbraw/zinc/54/18/73/945541873.db2.gz INTZNNIHJKJMQC-UHFFFAOYSA-N 0 3 404.514 4.433 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)NCc1c(Cl)cccc1-n1ccnc1 ZINC000564399809 945554690 /nfs/dbraw/zinc/55/46/90/945554690.db2.gz VHIBDXHWNLQIQK-UHFFFAOYSA-N 0 3 408.889 4.264 20 0 HIADHN COc1ccc(CN(C)C(=O)CN[C@H](Cc2ccccc2)c2ccc(OC)cc2)cc1 ZINC000564415462 945567657 /nfs/dbraw/zinc/56/76/57/945567657.db2.gz RRXXUKXZAHXHLO-RUZDIDTESA-N 0 3 418.537 4.236 20 0 HIADHN CCOc1cc(CN(Cc2ccc(-n3cncn3)cc2)C2CC2)ccc1OC(F)F ZINC000564474010 945605852 /nfs/dbraw/zinc/60/58/52/945605852.db2.gz OTLDCVDRCZKNKL-UHFFFAOYSA-N 0 3 414.456 4.432 20 0 HIADHN Cc1nc2ccccc2n1CCCNC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C ZINC000564479320 945612307 /nfs/dbraw/zinc/61/23/07/945612307.db2.gz ONFMSYADLQEQFM-HXUWFJFHSA-N 0 3 419.573 4.041 20 0 HIADHN C/C(=C\c1cccc(C(F)(F)F)c1)CNCC(=O)N[C@@H]1CCOc2ccccc21 ZINC000564604888 945702231 /nfs/dbraw/zinc/70/22/31/945702231.db2.gz CODONNJQEIYJGW-FERCGXDMSA-N 0 3 404.432 4.338 20 0 HIADHN COc1cc(CNC[C@@H](O)COc2cccc3[nH]ccc32)ccc1OC1CCCC1 ZINC000564747825 945746331 /nfs/dbraw/zinc/74/63/31/945746331.db2.gz BQUNVYTXNOWUNI-GOSISDBHSA-N 0 3 410.514 4.027 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)C[C@@H](NC(C)=O)c1ccccc1)c1ccc(Cl)cc1 ZINC000565131738 945782266 /nfs/dbraw/zinc/78/22/66/945782266.db2.gz GQEVWKMPSCGICX-YADHBBJMSA-N 0 3 415.965 4.107 20 0 HIADHN CC[C@@H](NC(=O)NC[C@H](c1cccs1)N1CCCC1)c1ccc(OC)c(OC)c1 ZINC000565321695 945809221 /nfs/dbraw/zinc/80/92/21/945809221.db2.gz HIXHIADNQFCHDH-QZTJIDSGSA-N 0 3 417.575 4.353 20 0 HIADHN CN(C)C[C@H](NC(=O)[C@@H]1C[C@@H]1c1ccccc1OC(F)(F)F)c1ccc(F)cc1 ZINC000565441240 945830506 /nfs/dbraw/zinc/83/05/06/945830506.db2.gz FPQLWFZCLFDYGO-KURKYZTESA-N 0 3 410.411 4.247 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)c1cc(NC(C)=O)cc(C(F)(F)F)c1)c1ccco1 ZINC000565500122 945840112 /nfs/dbraw/zinc/84/01/12/945840112.db2.gz GBQXNMYGTKZDLP-SJKOYZFVSA-N 0 3 411.424 4.116 20 0 HIADHN C[C@H]1[C@@H](NC(=O)Nc2ccc(F)cc2-c2cnn(C)c2)CCN1Cc1ccccc1 ZINC000565563572 945848937 /nfs/dbraw/zinc/84/89/37/945848937.db2.gz PWDMDWJAKKKDMF-KKSFZXQISA-N 0 3 407.493 4.011 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3ccc4c(c3)CCCCC4=O)c(C)c2)CC1 ZINC000566319836 946000801 /nfs/dbraw/zinc/00/08/01/946000801.db2.gz JYLAVRSPWMTACQ-UHFFFAOYSA-N 0 3 405.542 4.298 20 0 HIADHN COc1cc(-c2nc(-c3ccc(CN(C)C)cc3)no2)cc(Br)c1OC ZINC000566322999 946001219 /nfs/dbraw/zinc/00/12/19/946001219.db2.gz DKWKYXQRLLHULX-UHFFFAOYSA-N 0 3 418.291 4.245 20 0 HIADHN CN(CCCN(C)Cc1ccco1)CC(=O)Nc1cc(C(F)(F)F)ccc1Cl ZINC000566336481 946003852 /nfs/dbraw/zinc/00/38/52/946003852.db2.gz CYUOWMMZJFGBCW-UHFFFAOYSA-N 0 3 417.859 4.344 20 0 HIADHN C[C@@H]1[C@H](NC(=O)c2cccc(OCc3cscn3)c2)CCN1Cc1ccccc1 ZINC000566390391 946018179 /nfs/dbraw/zinc/01/81/79/946018179.db2.gz RNVOJIJJMMXDDG-VGOFRKELSA-N 0 3 407.539 4.115 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)Nc1c(F)cc(Br)cc1F ZINC000566521044 946027750 /nfs/dbraw/zinc/02/77/50/946027750.db2.gz LJISMBUEKZQASH-UHFFFAOYSA-N 0 3 404.299 4.457 20 0 HIADHN CN(C)CCn1nccc1NC(=O)c1ccc(-c2ccc(OC(F)(F)F)cc2)s1 ZINC000566522393 946027978 /nfs/dbraw/zinc/02/79/78/946027978.db2.gz NHRWNWGLMNJWHG-UHFFFAOYSA-N 0 3 424.448 4.324 20 0 HIADHN COCCOc1ccc(NC(=O)N[C@H]2CCN(Cc3ccccc3)[C@H]2C)cc1Cl ZINC000566522483 946029628 /nfs/dbraw/zinc/02/96/28/946029628.db2.gz PNJFEVCVJPKVKY-JXFKEZNVSA-N 0 3 417.937 4.150 20 0 HIADHN CC(=O)c1oc2cc(C)ccc2c1CC(=O)N1C[C@@H]2CCCN2Cc2ccccc21 ZINC000566700897 946075322 /nfs/dbraw/zinc/07/53/22/946075322.db2.gz QUDJFRVPVOVWIQ-IBGZPJMESA-N 0 3 402.494 4.498 20 0 HIADHN CN(C)C[C@H](NC(=O)Nc1nc(CN2CCCCC2)cs1)c1ccc(Cl)cc1 ZINC000566750464 946086339 /nfs/dbraw/zinc/08/63/39/946086339.db2.gz RHTHLVYYLGOXEY-SFHVURJKSA-N 0 3 421.998 4.207 20 0 HIADHN C[C@@H](C(=O)N(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1)c1cccnc1 ZINC000566847873 946132137 /nfs/dbraw/zinc/13/21/37/946132137.db2.gz YWBNURWRRKHLKH-BWKNWUBXSA-N 0 3 414.553 4.274 20 0 HIADHN CCc1cccc(C)c1NC(=O)CN[C@H]1CCN(C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000566885170 946155170 /nfs/dbraw/zinc/15/51/70/946155170.db2.gz ZLUDXHAVZXKLDZ-UGKGYDQZSA-N 0 3 403.929 4.323 20 0 HIADHN COc1ccc([C@H](Cc2ccccc2)N[C@H]2CCCN(CC(F)(F)F)C2=O)cc1 ZINC000567003180 946212072 /nfs/dbraw/zinc/21/20/72/946212072.db2.gz VTXDZEKKXATBNP-PMACEKPBSA-N 0 3 406.448 4.122 20 0 HIADHN O=C([C@H]1CN(Cc2ccccc2)CCC1(F)F)N1CC(Cc2ccc(F)c(F)c2)C1 ZINC000567130939 946246743 /nfs/dbraw/zinc/24/67/43/946246743.db2.gz HHRYSDHFNATDLK-LJQANCHMSA-N 0 3 420.450 4.123 20 0 HIADHN CSc1ccc([C@@H](CNC(=O)Cc2ccc(-n3nc(C)cc3C)cc2)N(C)C)cc1 ZINC000567140636 946250830 /nfs/dbraw/zinc/25/08/30/946250830.db2.gz BAPRHTCCDWCEIR-HSZRJFAPSA-N 0 3 422.598 4.173 20 0 HIADHN C[C@@H](NCC(=O)Nc1ccccc1C(=O)c1ccccc1)[C@H]1COc2ccccc21 ZINC000567147550 946252497 /nfs/dbraw/zinc/25/24/97/946252497.db2.gz QVILZGODXBWQPL-DYESRHJHSA-N 0 3 400.478 4.010 20 0 HIADHN CCSc1ccc(Cl)cc1NC(=O)N1CC[C@H](N2CCN(C(C)C)CC2)C1 ZINC000567160246 946259864 /nfs/dbraw/zinc/25/98/64/946259864.db2.gz HCULZBFHLZLMFH-KRWDZBQOSA-N 0 3 411.015 4.084 20 0 HIADHN CN(CCn1cc(Br)cn1)Cc1ccc(Br)c2cccnc12 ZINC000567196898 946265825 /nfs/dbraw/zinc/26/58/25/946265825.db2.gz AXKUEPFLBISFSI-UHFFFAOYSA-N 0 3 424.140 4.088 20 0 HIADHN C[C@@]1(C2CC2)NC(=O)N(c2cccc(CN[C@H]3CCc4c3cccc4Cl)c2)C1=O ZINC000567256678 946280054 /nfs/dbraw/zinc/28/00/54/946280054.db2.gz VOCOAOJDQFTJEK-REWPJTCUSA-N 0 3 409.917 4.342 20 0 HIADHN CN1CC[C@H](NC(=O)NC2(c3cccc(C(F)(F)F)c3)CC2)[C@@H]1c1ccccc1 ZINC000567296614 946298908 /nfs/dbraw/zinc/29/89/08/946298908.db2.gz VYHZINPWWNCHFX-OALUTQOASA-N 0 3 403.448 4.439 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)c1cc(Br)cnc1OCC1CC1 ZINC000567298857 946300915 /nfs/dbraw/zinc/30/09/15/946300915.db2.gz UMLZDNWAOGHJMI-UHFFFAOYSA-N 0 3 418.335 4.255 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)c1nn(-c2ccccc2Cl)cc1C)c1ccco1 ZINC000567420789 946332569 /nfs/dbraw/zinc/33/25/69/946332569.db2.gz ZRJHQUSBGGSNQV-RDJZCZTQSA-N 0 3 400.910 4.286 20 0 HIADHN COc1ccc2oc([C@H](C)N[C@H]3CCCc4cc(S(N)(=O)=O)ccc43)c(C)c2c1 ZINC000567574031 946379447 /nfs/dbraw/zinc/37/94/47/946379447.db2.gz YNABQOXXDJKHBF-XOBRGWDASA-N 0 3 414.527 4.125 20 0 HIADHN COCC[C@H](NC[C@H](O)COc1ccccc1F)c1ccc(Cl)c(Cl)c1 ZINC000567904259 946422470 /nfs/dbraw/zinc/42/24/70/946422470.db2.gz VNBCTMMDFJYUMS-KSSFIOAISA-N 0 3 402.293 4.240 20 0 HIADHN COc1ccc(C[C@](C)(O)CN[C@@H](c2cccnc2)c2ccc(F)c(C)c2)cc1OC ZINC000568334168 946514091 /nfs/dbraw/zinc/51/40/91/946514091.db2.gz RTSKKMNASMUSRG-RPBOFIJWSA-N 0 3 424.516 4.219 20 0 HIADHN CC(C)Oc1ccc(Cl)cc1NC(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000568518231 946574969 /nfs/dbraw/zinc/57/49/69/946574969.db2.gz VHRZQAKRWIPGDM-CALCHBBNSA-N 0 3 423.985 4.480 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)c1ccccc1OCc1csc(C)n1)c1ccco1 ZINC000568642148 946631305 /nfs/dbraw/zinc/63/13/05/946631305.db2.gz XZKJBUXNFGTTTE-HNAYVOBHSA-N 0 3 413.543 4.483 20 0 HIADHN CC(C)[C@H]1OCCC[C@H]1CNCc1c(Br)cncc1Br ZINC000568692182 946659484 /nfs/dbraw/zinc/65/94/84/946659484.db2.gz XNAHIPJUTIITBZ-XHDPSFHLSA-N 0 3 406.162 4.147 20 0 HIADHN CN1CC[C@H](NCC(=O)Nc2cccc(Cl)c2Cl)[C@@H]1c1ccc(F)c(F)c1 ZINC000568698313 946666496 /nfs/dbraw/zinc/66/64/96/946666496.db2.gz KJZPHYSYXILIEU-LPHOPBHVSA-N 0 3 414.283 4.245 20 0 HIADHN O=C(CCN1CCC(=Cc2cccc(F)c2)CC1)Nc1ccc(N2CCCC2=O)cc1 ZINC000568742546 946677109 /nfs/dbraw/zinc/67/71/09/946677109.db2.gz SYJFXCQACADSQC-UHFFFAOYSA-N 0 3 421.516 4.461 20 0 HIADHN C[C@H](N[C@@H]1CCN(C)[C@@H]1c1ccc(Cl)c(F)c1)C(=O)N[C@@H](C)c1ccc(F)cc1 ZINC000568871313 946728143 /nfs/dbraw/zinc/72/81/43/946728143.db2.gz QSEMBKKTFKZDHC-BMHXQBNDSA-N 0 3 421.919 4.219 20 0 HIADHN CC(C)Oc1ccc([C@H](C)NCc2cccc(OCC(=O)N(C)C)c2)cc1Cl ZINC000568995899 946793300 /nfs/dbraw/zinc/79/33/00/946793300.db2.gz DEIFSMBVPGQARM-INIZCTEOSA-N 0 3 404.938 4.445 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)c1cccc(OCc2csc(C)n2)c1)c1ccco1 ZINC000569025669 946802131 /nfs/dbraw/zinc/80/21/31/946802131.db2.gz WHGPHVCAAKLYPB-YWZLYKJASA-N 0 3 413.543 4.483 20 0 HIADHN Cc1cc(=O)[nH]c2cc(C(=O)NC[C@@H](c3ccc(CC(C)C)cc3)N(C)C)ccc12 ZINC000569033228 946803531 /nfs/dbraw/zinc/80/35/31/946803531.db2.gz IGMSQASZZYRWKU-QHCPKHFHSA-N 0 3 405.542 4.480 20 0 HIADHN COc1ccc(SC)c(OC)c1C(=O)NC[C@H](c1ccc(SC)cc1)N(C)C ZINC000569046299 946808175 /nfs/dbraw/zinc/80/81/75/946808175.db2.gz XIKVCLMZUANQAZ-MRXNPFEDSA-N 0 3 420.600 4.180 20 0 HIADHN O[C@@H](CN[C@@H]1CCOc2c(Cl)cccc21)COc1ccccc1C(F)(F)F ZINC000569166055 946829792 /nfs/dbraw/zinc/82/97/92/946829792.db2.gz AOMJFXYZBYAORA-BLLLJJGKSA-N 0 3 401.812 4.212 20 0 HIADHN COc1ccc(CNC[C@]2(C)OCCc3sccc32)c(OCc2cccnc2)c1 ZINC000569293859 946853497 /nfs/dbraw/zinc/85/34/97/946853497.db2.gz YBZOSXNRECGBKR-QHCPKHFHSA-N 0 3 410.539 4.308 20 0 HIADHN O=C(CCC(F)(F)F)N1CCC[C@@H](NCc2cc(Br)ccc2F)C1 ZINC000569644739 946917342 /nfs/dbraw/zinc/91/73/42/946917342.db2.gz KMMJZZYULWCVPM-CYBMUJFWSA-N 0 3 411.237 4.011 20 0 HIADHN C[C@H]1CN(C(=O)c2ccc(Br)c(Cl)c2F)CCN(C2CCC2)C1 ZINC000569721800 946957063 /nfs/dbraw/zinc/95/70/63/946957063.db2.gz JENFCCJQYQOIRS-LLVKDONJSA-N 0 3 403.723 4.188 20 0 HIADHN C[C@@H]1C[C@@H]1N1CCN(C(=O)c2ccc(-c3noc(CC(C)(C)C)n3)cc2)C[C@@H](C)C1 ZINC000569797337 947008946 /nfs/dbraw/zinc/00/89/46/947008946.db2.gz KNKKYJYOMFMKHD-QKLQHJQFSA-N 0 3 410.562 4.128 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)N(C)Cc2ccc(OC(F)F)cc2)CCN1Cc1ccccc1 ZINC000569999349 947066449 /nfs/dbraw/zinc/06/64/49/947066449.db2.gz NYYGCNSGAXFGLP-UZLBHIALSA-N 0 3 403.473 4.092 20 0 HIADHN C[C@@H](NC(=O)N1CCC(OCC2CCCCC2)CC1)[C@@H](c1ccccc1)N(C)C ZINC000569998890 947066541 /nfs/dbraw/zinc/06/65/41/947066541.db2.gz KBYMHVWPBOBMQT-XXBNENTESA-N 0 3 401.595 4.449 20 0 HIADHN CCOCCCn1c(-c2cccc3ccccc32)nnc1N1CCN(CC2CC2)CC1 ZINC000570026904 947076114 /nfs/dbraw/zinc/07/61/14/947076114.db2.gz HGKXNHXDGUCVMJ-UHFFFAOYSA-N 0 3 419.573 4.057 20 0 HIADHN CSc1ccc([C@H](CNC(=O)C(C)(C)Cc2nc3ccccc3[nH]2)N(C)C)cc1 ZINC000570073380 947084701 /nfs/dbraw/zinc/08/47/01/947084701.db2.gz DTLVMXSJHLVUHZ-FQEVSTJZSA-N 0 3 410.587 4.273 20 0 HIADHN CC(C)Cc1ccc([C@H](CNC(=O)N[C@H](C)c2ccc3c(c2)CC(=O)N3)N(C)C)cc1 ZINC000570304619 947186219 /nfs/dbraw/zinc/18/62/19/947186219.db2.gz GTWYTSMGPODPSD-HXOBKFHXSA-N 0 3 422.573 4.043 20 0 HIADHN COc1ccc([C@H](Cc2ccccc2)NCC(=O)N(C)Cc2ccccc2OC)cc1 ZINC000570323954 947203890 /nfs/dbraw/zinc/20/38/90/947203890.db2.gz SGBSGRIMSDBSLA-DEOSSOPVSA-N 0 3 418.537 4.236 20 0 HIADHN Cc1cccc(C)c1[C@@H](C)NCC(=O)N1c2ccccc2NC(=O)C[C@@H]1C(F)(F)F ZINC000570441363 947250128 /nfs/dbraw/zinc/25/01/28/947250128.db2.gz NKZJYIKFBBQXTM-CRAIPNDOSA-N 0 3 419.447 4.260 20 0 HIADHN O=C(Nc1ccc(C(=O)N2CCCN(CC3CCC3)CC2)s1)Nc1ccccc1 ZINC000570466630 947254279 /nfs/dbraw/zinc/25/42/79/947254279.db2.gz BNDJIZQJWSBQAP-UHFFFAOYSA-N 0 3 412.559 4.340 20 0 HIADHN Clc1ccc(CN[C@@H](c2cncc(Br)c2)C2CC2)c(-n2cncn2)c1 ZINC000570468963 947256616 /nfs/dbraw/zinc/25/66/16/947256616.db2.gz PBSKTRNUWAVZGC-GOSISDBHSA-N 0 3 418.726 4.319 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1cccc(C(=O)N2CCCC2)c1C)c1ccco1 ZINC000570504573 947270972 /nfs/dbraw/zinc/27/09/72/947270972.db2.gz KNRIUDAQKGWSNS-JXFKEZNVSA-N 0 3 412.534 4.075 20 0 HIADHN COc1ccc(CN(C)CCCN(C)Cc2ccco2)c(Br)c1OC ZINC000570636379 947320212 /nfs/dbraw/zinc/32/02/12/947320212.db2.gz MSHHVQVSGOUUJG-UHFFFAOYSA-N 0 3 411.340 4.013 20 0 HIADHN CNC(=O)COc1cccc(CN[C@H](C)c2sc(Cc3ccccc3)nc2C)c1 ZINC000570648503 947321267 /nfs/dbraw/zinc/32/12/67/947321267.db2.gz NYTYWAVLFLZLBZ-MRXNPFEDSA-N 0 3 409.555 4.018 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@H](NCc2cc(Cl)c3c(c2)OCCO3)c2ccccc21 ZINC000570855912 947371165 /nfs/dbraw/zinc/37/11/65/947371165.db2.gz SRAVNQYAYNPDCA-MJGOQNOKSA-N 0 3 401.890 4.383 20 0 HIADHN CN1CCC(N(Cc2ccccc2Br)C(=O)c2cc(Cl)c[nH]2)CC1 ZINC000571013655 947440320 /nfs/dbraw/zinc/44/03/20/947440320.db2.gz ZBZRGASHMZMDAL-UHFFFAOYSA-N 0 3 410.743 4.167 20 0 HIADHN CCN(Cc1ccccc1)C(=O)CNC1(c2cccc(C(F)(F)F)c2)CCOCC1 ZINC000571015197 947441137 /nfs/dbraw/zinc/44/11/37/947441137.db2.gz UCIGDHZTAKFJCI-UHFFFAOYSA-N 0 3 420.475 4.349 20 0 HIADHN C[C@@H](c1ccc(F)c(F)c1)N(C)C(=O)CN[C@@H]1c2ccccc2CC12CCOCC2 ZINC000571210507 947546919 /nfs/dbraw/zinc/54/69/19/947546919.db2.gz GMAIOBJBVSVYCW-QMHKHESXSA-N 0 3 414.496 4.168 20 0 HIADHN CCN(Cc1c(C)nn(CCC(=O)OC)c1C)Cc1cccc(-c2ccncc2)c1 ZINC000571329207 947598599 /nfs/dbraw/zinc/59/85/99/947598599.db2.gz XSFNKETZNCRKAC-UHFFFAOYSA-N 0 3 406.530 4.147 20 0 HIADHN CCOc1c(CNCCc2cc(Cl)c3c(c2)OCCO3)c(C)nn1CC(C)C ZINC000571349413 947611724 /nfs/dbraw/zinc/61/17/24/947611724.db2.gz OBTOQMNDASHNIG-UHFFFAOYSA-N 0 3 407.942 4.003 20 0 HIADHN CCN1CC[C@@H](NCC(=O)Nc2ccc(SC)cc2)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000571584469 947713624 /nfs/dbraw/zinc/71/36/24/947713624.db2.gz XBLNODVMUQKTBO-WIYYLYMNSA-N 0 3 423.504 4.189 20 0 HIADHN Cc1cn(-c2ccc(F)cc2)nc1C(=O)NC[C@@H](c1ccc(OC(C)C)cc1)N(C)C ZINC000571710198 947757587 /nfs/dbraw/zinc/75/75/87/947757587.db2.gz KKLZAOGKDMPBJS-QFIPXVFZSA-N 0 3 424.520 4.140 20 0 HIADHN Cc1ccc(CCCN2CC(C(=O)N3CC(C)(C)c4ccc(NC5CC5)cc43)C2)cn1 ZINC000572180688 947857373 /nfs/dbraw/zinc/85/73/73/947857373.db2.gz JEPULQSOHFLPPL-UHFFFAOYSA-N 0 3 418.585 4.153 20 0 HIADHN Cc1ccc(-c2ccc(Cl)cc2NC(=O)NCCCCN2CCN(C)CC2)o1 ZINC000572196490 947860574 /nfs/dbraw/zinc/86/05/74/947860574.db2.gz DLRMXCPSQHNSMW-UHFFFAOYSA-N 0 3 404.942 4.058 20 0 HIADHN CN1CC[C@H](N[C@@H]2CCN(c3ccccc3Cl)C2=O)[C@@H]1c1ccc(Cl)cc1 ZINC000572289708 947877286 /nfs/dbraw/zinc/87/72/86/947877286.db2.gz NAKPIYIKHXAESJ-NSHGMRRFSA-N 0 3 404.341 4.134 20 0 HIADHN COCCOc1ccc(CN[C@@H](c2cncc(Br)c2)C2CC2)cc1OC ZINC000572385377 947891564 /nfs/dbraw/zinc/89/15/64/947891564.db2.gz IUYRBOAVRHVESQ-HXUWFJFHSA-N 0 3 421.335 4.119 20 0 HIADHN Cc1ccc(Cl)cc1NC(=O)C[C@@H](C)N[C@H](CC(=O)N(C)C)c1ccccc1 ZINC000572387591 947892280 /nfs/dbraw/zinc/89/22/80/947892280.db2.gz IIAVJXYXRZSSFN-OXQOHEQNSA-N 0 3 401.938 4.175 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)CCc1cc(F)ccc1Br)c1ccco1 ZINC000572394094 947893975 /nfs/dbraw/zinc/89/39/75/947893975.db2.gz MHDAXVCNGMHTEH-DYVFJYSZSA-N 0 3 411.315 4.359 20 0 HIADHN COc1ccc2c(c1F)CC[C@H]2N[C@H](C)c1cc(F)ccc1N1CCN(C)CC1 ZINC000572439752 947906089 /nfs/dbraw/zinc/90/60/89/947906089.db2.gz FPNCDTAMDALSAH-FOIQADDNSA-N 0 3 401.501 4.063 20 0 HIADHN O=C(Cc1cccc(Cl)c1Cl)Nc1ccc(C(=O)NCCN2CCCC2)cc1 ZINC000572450941 947911479 /nfs/dbraw/zinc/91/14/79/947911479.db2.gz HOLDEKPQIDSEME-UHFFFAOYSA-N 0 3 420.340 4.000 20 0 HIADHN CCC(=O)Nc1ccc(Cl)c(NC(=O)N[C@H](C)CN(C)Cc2ccccc2)c1 ZINC000572520533 947926111 /nfs/dbraw/zinc/92/61/11/947926111.db2.gz IXQRPUQVBYPYGS-OAHLLOKOSA-N 0 3 402.926 4.331 20 0 HIADHN CN1CCC(N(Cc2ccccc2Br)C(=O)c2cc(C3CC3)on2)CC1 ZINC000572776548 948007391 /nfs/dbraw/zinc/00/73/91/948007391.db2.gz NYIMTPBDOFZMRN-UHFFFAOYSA-N 0 3 418.335 4.051 20 0 HIADHN COc1ccc([C@@H](Cc2ccccc2)NCC(=O)Nc2ccc(OC)c(OC)c2)cc1 ZINC000572804525 948015529 /nfs/dbraw/zinc/01/55/29/948015529.db2.gz IOEIVNGDPLXYHD-JOCHJYFZSA-N 0 3 420.509 4.225 20 0 HIADHN O=C(CN[C@H]1c2ccccc2CC12CCOCC2)N(Cc1ccco1)c1ccccc1 ZINC000572891534 948031313 /nfs/dbraw/zinc/03/13/13/948031313.db2.gz GAYZQVLKGTUSHR-VWLOTQADSA-N 0 3 416.521 4.497 20 0 HIADHN Cc1nc(NC(=O)[C@H](C)N[C@H]2CCN(C(C)C)[C@@H]2c2ccc(F)c(F)c2)sc1C ZINC000573011441 948057173 /nfs/dbraw/zinc/05/71/73/948057173.db2.gz YKULKCQGFCNELJ-FASAQXTFSA-N 0 3 422.545 4.179 20 0 HIADHN CSc1ccc([C@H](CNC(=O)c2cccc(Oc3cnccn3)c2)N(C)C)cc1 ZINC000573040042 948067426 /nfs/dbraw/zinc/06/74/26/948067426.db2.gz NIFDFOAQEJTLLN-FQEVSTJZSA-N 0 3 408.527 4.024 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)c1cccc(NC(C)=O)c1C)c1ccc(Cl)cc1 ZINC000573229572 948113528 /nfs/dbraw/zinc/11/35/28/948113528.db2.gz IRZPVOLUJOKSSE-NRFANRHFSA-N 0 3 401.938 4.420 20 0 HIADHN OC[C@]1(CNCc2cc(Cl)ccc2OC[C@H]2CCCO2)C[C@@H]1c1ccccc1 ZINC000573254786 948124952 /nfs/dbraw/zinc/12/49/52/948124952.db2.gz XQTXDBNMQZHEAK-MQSCRBSSSA-N 0 3 401.934 4.154 20 0 HIADHN COc1ccc(C[C@@H]2CCCN(CC(=O)N3CCc4[nH]c5ccccc5c4C3)C2)cc1 ZINC000573296109 948152122 /nfs/dbraw/zinc/15/21/22/948152122.db2.gz UKHGLFDLNICXGO-FQEVSTJZSA-N 0 3 417.553 4.016 20 0 HIADHN CCOc1cc(C[NH2+]CC2(c3ccccc3)CCOCC2)cc(Br)c1[O-] ZINC000573354424 948164274 /nfs/dbraw/zinc/16/42/74/948164274.db2.gz VKTJYXYCRVLGAN-UHFFFAOYSA-N 0 3 420.347 4.391 20 0 HIADHN CCNC(=O)C[C@H]1CCCCN1Cc1cc(-c2c(OC)ccc3ccccc32)no1 ZINC000573391445 948179751 /nfs/dbraw/zinc/17/97/51/948179751.db2.gz HSBMUZMUYCRNTK-GOSISDBHSA-N 0 3 407.514 4.384 20 0 HIADHN C[C@@H](N[C@@H]1c2ccccc2CC12CCOCC2)C(=O)Nc1cccc2ncccc21 ZINC000573490949 948217465 /nfs/dbraw/zinc/21/74/65/948217465.db2.gz UXVUDZJHRYCVIS-UZUQRXQVSA-N 0 3 401.510 4.246 20 0 HIADHN CC(C)N1CC[C@H](NCC(=O)Nc2cc(C(C)(C)C)no2)[C@H]1c1ccc(F)c(F)c1 ZINC000573573305 948239580 /nfs/dbraw/zinc/23/95/80/948239580.db2.gz WVNFADRNGXGEQZ-LAUBAEHRSA-N 0 3 420.504 4.002 20 0 HIADHN Cc1nc(COc2cccc(C(=O)N[C@@H]3CCN(Cc4ccccc4)[C@@H]3C)c2)cs1 ZINC000573716077 948279908 /nfs/dbraw/zinc/27/99/08/948279908.db2.gz VDEULHUWXQEFOY-UZUQRXQVSA-N 0 3 421.566 4.423 20 0 HIADHN CN(C)C[C@H](NC(=O)CSCc1cc(-c2cccs2)on1)c1ccc(F)cc1 ZINC000574190299 948382882 /nfs/dbraw/zinc/38/28/82/948382882.db2.gz UGHFSGKYVTTWJD-KRWDZBQOSA-N 0 3 419.547 4.195 20 0 HIADHN CN(C)C[C@@H](NC(=O)c1cccc(NC(=O)c2ccco2)c1)c1ccc(Cl)cc1 ZINC000574535379 948465327 /nfs/dbraw/zinc/46/53/27/948465327.db2.gz UOGMNTLYOXPGET-LJQANCHMSA-N 0 3 411.889 4.218 20 0 HIADHN Cc1nc(C(C)C)ccc1CN(C)[C@@H](C)c1ccc(N2CCCS2(=O)=O)cc1 ZINC000574664146 948498888 /nfs/dbraw/zinc/49/88/88/948498888.db2.gz DPJMLFPIJGLGHB-SFHVURJKSA-N 0 3 401.576 4.246 20 0 HIADHN Cc1nc2ccccn2c(=O)c1CCN1CCC[C@H]1c1ccc(Br)cc1 ZINC000574797499 948530355 /nfs/dbraw/zinc/53/03/55/948530355.db2.gz CVWWSTNOFVVWMS-IBGZPJMESA-N 0 3 412.331 4.145 20 0 HIADHN Cc1cccc(C)c1NC(=O)CNC(=O)NC[C@H](c1ccc(CC(C)C)cc1)N(C)C ZINC000574832852 948538604 /nfs/dbraw/zinc/53/86/04/948538604.db2.gz LRFVUPAZFNQFQC-JOCHJYFZSA-N 0 3 424.589 4.043 20 0 HIADHN Cc1c(NC(=O)N[C@H]2CCN(Cc3ccccc3)[C@@H]2C)cccc1C(=O)N1CCCC1 ZINC000574839165 948540639 /nfs/dbraw/zinc/54/06/39/948540639.db2.gz HFIITEYNNWVTGW-XXBNENTESA-N 0 3 420.557 4.016 20 0 HIADHN COc1cc(CN2CC[C@@H](C(F)(F)F)[C@H](CO)C2)c(-c2ccccc2)cc1OC ZINC000574844528 948542052 /nfs/dbraw/zinc/54/20/52/948542052.db2.gz LWANTBDRRBGNRU-PKOBYXMFSA-N 0 3 409.448 4.364 20 0 HIADHN Cc1csc(NC(=O)N(Cc2ccccc2Br)C2CCN(C)CC2)n1 ZINC000574945059 948561997 /nfs/dbraw/zinc/56/19/97/948561997.db2.gz QBLXEVPMWZBSAV-UHFFFAOYSA-N 0 3 423.380 4.342 20 0 HIADHN COc1cc(CNCc2ccccc2-c2cnn(C)c2)cc(OC)c1OCC(F)F ZINC000575020512 948574508 /nfs/dbraw/zinc/57/45/08/948574508.db2.gz SUSTXOJPPUMTCW-UHFFFAOYSA-N 0 3 417.456 4.038 20 0 HIADHN COCCOc1ccc(CN2CCC(c3noc4cc(F)ccc43)CC2)cc1OC ZINC000575101504 948594205 /nfs/dbraw/zinc/59/42/05/948594205.db2.gz OWLKYMRNTXQZEE-UHFFFAOYSA-N 0 3 414.477 4.380 20 0 HIADHN CC[C@H](C)c1nc([C@@H](C)NC(=O)NC[C@@H](c2ccccc2Cl)N2CCCC2)n[nH]1 ZINC000575235289 948639534 /nfs/dbraw/zinc/63/95/34/948639534.db2.gz CAEYVXQMAKZRCO-DAYGRLMNSA-N 0 3 418.973 4.169 20 0 HIADHN CCc1noc(-c2ccc(C)c(NC(=O)N[C@H](C)CN(C)Cc3ccccc3)c2)n1 ZINC000575516710 948673700 /nfs/dbraw/zinc/67/37/00/948673700.db2.gz XYKFZMRLGLOUFI-QGZVFWFLSA-N 0 3 407.518 4.249 20 0 HIADHN CSc1ccc([C@@H](CNC(=O)c2cc(C)nc3c2cnn3C(C)C)N(C)C)cc1 ZINC000575831631 948727708 /nfs/dbraw/zinc/72/77/08/948727708.db2.gz VCHPAGPSVGFJQD-HXUWFJFHSA-N 0 3 411.575 4.075 20 0 HIADHN CCOC(=O)c1ccn(-c2cccc(CNCc3ccc(OC(F)F)c(F)c3)c2)n1 ZINC000575956249 948801043 /nfs/dbraw/zinc/80/10/43/948801043.db2.gz QBDWQRVYWPQPBR-UHFFFAOYSA-N 0 3 419.403 4.079 20 0 HIADHN O[C@@H](CN[C@H]1CCSc2c(F)cccc21)COc1ccccc1C(F)(F)F ZINC000576068897 948818928 /nfs/dbraw/zinc/81/89/28/948818928.db2.gz XHVDYFMWFDCYGP-LRDDRELGSA-N 0 3 401.425 4.411 20 0 HIADHN Cc1nc(C(F)(F)N2CCC[C@@H]3CN(Cc4ccccc4)C[C@H]32)nc(Cl)c1C ZINC001164621078 719086031 /nfs/dbraw/zinc/08/60/31/719086031.db2.gz GXFQOTUOQOODBS-QZTJIDSGSA-N 0 3 406.908 4.393 20 0 HIADHN Clc1cc2c(Cl)ccnc2c(N2CC[C@H]3[C@H]2CCN3Cc2cccnc2)n1 ZINC001164727137 720378904 /nfs/dbraw/zinc/37/89/04/720378904.db2.gz QMUUMLYTZZGYEO-DLBZAZTESA-N 0 3 400.313 4.185 20 0 HIADHN FC(F)c1nc2ccc(Cl)cc2c(N2CC[C@@H]3[C@@H]2CCN3Cc2cccnc2)n1 ZINC001164724338 720469857 /nfs/dbraw/zinc/46/98/57/720469857.db2.gz FCLZPQUNFIHBCA-MSOLQXFVSA-N 0 3 415.875 4.469 20 0 HIADHN Cc1cc(-c2cccc(F)c2)nnc1N1CCN2C[C@H](Oc3cccc(F)c3)C[C@H]2C1 ZINC001164911679 721564654 /nfs/dbraw/zinc/56/46/54/721564654.db2.gz ZKOOGEFEHYKWIK-RBBKRZOGSA-N 0 3 422.479 4.072 20 0 HIADHN CC(C)(C)Oc1cccc(N2CCC(F)(F)[C@@]3(CCN(Cc4ccccn4)C3)C2)n1 ZINC001164904291 721711364 /nfs/dbraw/zinc/71/13/64/721711364.db2.gz BLILPVHUFCSJBI-JOCHJYFZSA-N 0 3 416.516 4.392 20 0 HIADHN Clc1cccc2ccc(N3CCC4(CC3)COCCN(Cc3ccncc3)C4)nc12 ZINC001164964514 722054828 /nfs/dbraw/zinc/05/48/28/722054828.db2.gz VIMMCPFFZHDARG-UHFFFAOYSA-N 0 3 422.960 4.402 20 0 HIADHN Clc1ccc2nc(N3CC[C@H]4CN(Cc5cccnc5)CCO[C@@H]4C3)ccc2c1 ZINC001164986161 722103657 /nfs/dbraw/zinc/10/36/57/722103657.db2.gz YFGUMDFEFGFQCA-SIKLNZKXSA-N 0 3 408.933 4.011 20 0 HIADHN Cc1ccc2nc(Cl)cc(N3CC[C@H]4CN(Cc5cccnc5)CCO[C@@H]4C3)c2c1 ZINC001164979816 722109569 /nfs/dbraw/zinc/10/95/69/722109569.db2.gz QFNOEGNXMHMGTB-WMZHIEFXSA-N 0 3 422.960 4.319 20 0 HIADHN Clc1ccc2ccc(N3CC[C@@H]4CN(Cc5cccnc5)CCO[C@@H]4C3)nc2c1 ZINC001164976707 722129229 /nfs/dbraw/zinc/12/92/29/722129229.db2.gz MHVGSHAYOPMPOU-DENIHFKCSA-N 0 3 408.933 4.011 20 0 HIADHN Cc1ccc2cc(Cl)nc(N3CC[C@H]4CN(Cc5cccnc5)CCO[C@H]4C3)c2c1 ZINC001164973203 722130918 /nfs/dbraw/zinc/13/09/18/722130918.db2.gz BMGUUYCXCVCSOB-UNMCSNQZSA-N 0 3 422.960 4.319 20 0 HIADHN COC(=O)c1ccc2nc(N3CCC[C@]4(CCN4Cc4cccc(F)c4)C3)ccc2c1 ZINC001164993915 722198263 /nfs/dbraw/zinc/19/82/63/722198263.db2.gz JDVJKHYXGAUPJB-VWLOTQADSA-N 0 3 419.500 4.405 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)C2(OCc3ccccc3)CCOCC2)N2CCCC2)cc1 ZINC000435947534 861213359 /nfs/dbraw/zinc/21/33/59/861213359.db2.gz BJOIPEKIVDCRPH-XMMPIXPASA-N 0 3 422.569 4.014 20 0 HIADHN CC(C)[C@@H]1CC[C@H](NCc2nnc3n2CCOC3)[C@H](Cc2ccc(Cl)cc2)C1 ZINC000436100215 861383922 /nfs/dbraw/zinc/38/39/22/861383922.db2.gz MMHLGZNBQOMWCB-GGPKGHCWSA-N 0 3 402.970 4.235 20 0 HIADHN CC[C@@H](C)c1ccc(S(=O)(=O)Nc2ccc(N3CCN(CC)CC3)cc2)cc1 ZINC000007109453 845254670 /nfs/dbraw/zinc/25/46/70/845254670.db2.gz GGEDDNYTBFRBQP-GOSISDBHSA-N 0 3 401.576 4.143 20 0 HIADHN O=C1c2ccccc2C(=O)N1C1CCC(NCc2coc(-c3cccs3)n2)CC1 ZINC000436249249 861557962 /nfs/dbraw/zinc/55/79/62/861557962.db2.gz RZOWNUPPYMCSFE-UHFFFAOYSA-N 0 3 407.495 4.100 20 0 HIADHN O=C(Cc1csc(-c2ccccc2Cl)n1)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000008367063 845519904 /nfs/dbraw/zinc/51/99/04/845519904.db2.gz XPDFEMATCRZZCM-KRWDZBQOSA-N 0 3 411.958 4.397 20 0 HIADHN COc1ccc([C@@H](CNC(=O)Cc2nc(C(C)C)c(C)s2)N2CCCC2)cc1 ZINC000436275940 861586126 /nfs/dbraw/zinc/58/61/26/861586126.db2.gz RAIKSTWPZTVQPE-LJQANCHMSA-N 0 3 401.576 4.079 20 0 HIADHN Cc1nn(Cc2ccc(F)cc2)c(Cl)c1C(=O)NCc1ccccc1CN(C)C ZINC000010085769 845618916 /nfs/dbraw/zinc/61/89/16/845618916.db2.gz XOUWJTQGKCWRRO-UHFFFAOYSA-N 0 3 414.912 4.024 20 0 HIADHN Cc1c([C@@H](C)NCC2([S@@](C)=O)CCC2)cnn1-c1ccc(Cl)cc1Cl ZINC000436311599 861616169 /nfs/dbraw/zinc/61/61/69/861616169.db2.gz UDSKMAGUGCTDLJ-XELLLNAOSA-N 0 3 400.375 4.439 20 0 HIADHN O=C(N[C@H]1CCN(Cc2ccccc2)C1)c1cc(-c2ccncc2)nc2ccccc21 ZINC000014043241 845919698 /nfs/dbraw/zinc/91/96/98/845919698.db2.gz PIHIOIZIWCCCAL-NRFANRHFSA-N 0 3 408.505 4.301 20 0 HIADHN CC1CCN([C@H](CNC(=S)Nc2ccc([N+](=O)[O-])cc2)c2cccs2)CC1 ZINC000016241519 846141407 /nfs/dbraw/zinc/14/14/07/846141407.db2.gz UFWRKJUONMFCMB-QGZVFWFLSA-N 0 3 404.561 4.416 20 0 HIADHN COc1cccc([C@H](CNC(=S)Nc2ccc(OC(F)F)cc2)N2CCCC2)c1 ZINC000016244979 846141834 /nfs/dbraw/zinc/14/18/34/846141834.db2.gz KXYMWXYAWDXRGE-IBGZPJMESA-N 0 3 421.513 4.420 20 0 HIADHN CCOc1cc(CNCc2ccc(C)c(F)c2)ccc1OCC(=O)N1CCCCC1 ZINC000022745308 846613383 /nfs/dbraw/zinc/61/33/83/846613383.db2.gz AKWOBBYXOLIKIU-UHFFFAOYSA-N 0 3 414.521 4.214 20 0 HIADHN CCOc1cc(CNCc2ccc(C(F)(F)F)cc2)ccc1O[C@@H](C)C(=O)N(C)C ZINC000022744396 846613513 /nfs/dbraw/zinc/61/35/13/846613513.db2.gz WLFTVJKCHILSHD-HNNXBMFYSA-N 0 3 424.463 4.249 20 0 HIADHN C[C@H](N[C@@H](CCCc1ccccc1)c1ccccc1)C(=O)Nc1ccc(C(N)=O)cc1 ZINC000022819091 846624867 /nfs/dbraw/zinc/62/48/67/846624867.db2.gz VDFAMVLXSQFLMW-CYFREDJKSA-N 0 3 415.537 4.466 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)c1cccc(OCc2cscn2)c1 ZINC000023741307 846744671 /nfs/dbraw/zinc/74/46/71/846744671.db2.gz GUQIWGCXDYRTPH-QFIPXVFZSA-N 0 3 407.539 4.289 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(C)c1C(=O)NC[C@H](c1ccccc1)N1CCCC1 ZINC000023739580 846744804 /nfs/dbraw/zinc/74/48/04/846744804.db2.gz JNQMLGDFBGTGFS-JOCHJYFZSA-N 0 3 406.505 4.195 20 0 HIADHN COc1cc(NC(=O)CCN(C)[C@H](C)c2sc(C)nc2C)c(OC)cc1Cl ZINC000436379521 861722310 /nfs/dbraw/zinc/72/23/10/861722310.db2.gz QTFAKBYRBICSAL-GFCCVEGCSA-N 0 3 411.955 4.452 20 0 HIADHN COc1ccc(CN(C)C[C@@H](O)Cn2c3ccccc3c3ccccc32)cc1OC ZINC000024946877 846894836 /nfs/dbraw/zinc/89/48/36/846894836.db2.gz SUEBJTOZKCEVSE-LJQANCHMSA-N 0 3 404.510 4.305 20 0 HIADHN CN(C)[C@@H](CNC(=O)c1cc(-c2ccccn2)nc2ccccc21)Cc1ccccc1 ZINC000025079889 846920284 /nfs/dbraw/zinc/92/02/84/846920284.db2.gz DZUNIRIIAHRTMA-HXUWFJFHSA-N 0 3 410.521 4.200 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)[C@H](C)Oc3cccc(Cl)c3)c(C)c2)CC1 ZINC000025187379 846939102 /nfs/dbraw/zinc/93/91/02/846939102.db2.gz MPFDHSBZYHOAPR-KRWDZBQOSA-N 0 3 401.938 4.196 20 0 HIADHN CC(C)(CNC(=O)CCc1ccc(OC(F)F)cc1)N1CCc2ccccc2C1 ZINC000025464940 846981812 /nfs/dbraw/zinc/98/18/12/846981812.db2.gz GNOMEMCSGDRBKZ-UHFFFAOYSA-N 0 3 402.485 4.174 20 0 HIADHN Cc1ccc(NC(=O)[C@H](NC2CCN(C(=O)c3ccoc3)CC2)c2ccccc2)cc1 ZINC000025480460 846985512 /nfs/dbraw/zinc/98/55/12/846985512.db2.gz HQABBRDKEKFHFE-HSZRJFAPSA-N 0 3 417.509 4.162 20 0 HIADHN CC(C)[C@H](CNC(=O)c1ccc(OC[C@@H]2CCCO2)cc1)N1CCc2ccccc2C1 ZINC000025534523 846995140 /nfs/dbraw/zinc/99/51/40/846995140.db2.gz OXRTVUAXYFYNJV-DQEYMECFSA-N 0 3 422.569 4.057 20 0 HIADHN CC(C)[C@H](CNC(=O)c1ccccc1OC[C@@H]1CCCO1)N1CCc2ccccc2C1 ZINC000025540846 846995688 /nfs/dbraw/zinc/99/56/88/846995688.db2.gz NRXSSWJJXHKFEY-UPVQGACJSA-N 0 3 422.569 4.057 20 0 HIADHN CC(C)[C@@H](CNC(=O)c1ccccc1OC[C@@H]1CCCO1)N1CCc2ccccc2C1 ZINC000025540841 846995916 /nfs/dbraw/zinc/99/59/16/846995916.db2.gz NRXSSWJJXHKFEY-LADGPHEKSA-N 0 3 422.569 4.057 20 0 HIADHN CC(C)c1noc2ncc(C(=O)NC[C@H](C(C)C)N3CCc4ccccc4C3)cc21 ZINC000025539720 846996527 /nfs/dbraw/zinc/99/65/27/846996527.db2.gz ONHGNWRHCQVKFB-OAQYLSRUSA-N 0 3 406.530 4.159 20 0 HIADHN CCCCc1ccc([C@H](NCC(=O)Nc2oc(C)c3c2c(=O)[nH]nc3C)C(C)C)cc1 ZINC000025817309 847041592 /nfs/dbraw/zinc/04/15/92/847041592.db2.gz CRVYFOZVAPNDCI-JOCHJYFZSA-N 0 3 424.545 4.401 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1oc2ccccc2c1COC)c1cccc(OC)c1 ZINC000025857552 847046670 /nfs/dbraw/zinc/04/66/70/847046670.db2.gz REQDTXMIBLESHL-NRFANRHFSA-N 0 3 410.514 4.401 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1c[nH]nc1-c1ccc(F)cc1)c1cccc(OC)c1 ZINC000025862829 847048213 /nfs/dbraw/zinc/04/82/13/847048213.db2.gz WUMHSWUFODRGJY-NRFANRHFSA-N 0 3 410.493 4.037 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cc(C)nc2c1cnn2C(C)C)c1cccc(OC)c1 ZINC000025862505 847048621 /nfs/dbraw/zinc/04/86/21/847048621.db2.gz GCZJWXOGUKKHQS-QFIPXVFZSA-N 0 3 423.561 4.142 20 0 HIADHN CC(C)[C@H](NCc1cc2c(c(Br)c1)OCO2)c1ccc2c(c1)OCCO2 ZINC000026312723 847122750 /nfs/dbraw/zinc/12/27/50/847122750.db2.gz XCCBKVVMPMRTET-IBGZPJMESA-N 0 3 420.303 4.436 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)COc3ccccc3C(C)C)CC2)c1 ZINC000026955023 847226427 /nfs/dbraw/zinc/22/64/27/847226427.db2.gz XLBOXLHJEMUGKM-UHFFFAOYSA-N 0 3 423.601 4.216 20 0 HIADHN Cc1[nH]c2ccccc2c1CC(=O)NCCCCN1CCN(c2cccc(C)c2)CC1 ZINC000026963457 847227305 /nfs/dbraw/zinc/22/73/05/847227305.db2.gz PPKOCFMRMXJHAT-UHFFFAOYSA-N 0 3 418.585 4.046 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)c3ccc(C(F)(F)F)cc3)CC2)c1 ZINC000026964629 847227688 /nfs/dbraw/zinc/22/76/88/847227688.db2.gz RRGHOXVETLNVQK-UHFFFAOYSA-N 0 3 419.491 4.346 20 0 HIADHN COc1cc(C(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)cc(OC)c1C ZINC000027573178 847321329 /nfs/dbraw/zinc/32/13/29/847321329.db2.gz USQMFSNBFJUBRS-SFHVURJKSA-N 0 3 402.560 4.277 20 0 HIADHN COc1ccc(O[C@@H](C)C(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)cc1 ZINC000027575379 847321888 /nfs/dbraw/zinc/32/18/88/847321888.db2.gz QHIAQQLAMWVGFY-FXAWDEMLSA-N 0 3 402.560 4.113 20 0 HIADHN C[C@H](NCc1cc(=O)oc2cc3c(cc12)CCC3)c1ccc(NC(=O)C2CC2)cc1 ZINC000028347852 847409486 /nfs/dbraw/zinc/40/94/86/847409486.db2.gz ILESWJAGLYCYAU-HNNXBMFYSA-N 0 3 402.494 4.481 20 0 HIADHN COCC(=O)Nc1cccc(CNCc2ccc(OCc3ccc(C)cc3)cc2)c1 ZINC000028960806 847484823 /nfs/dbraw/zinc/48/48/23/847484823.db2.gz LVFSUGYPWZNCBM-UHFFFAOYSA-N 0 3 404.510 4.449 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cc(C)n(-c4ccccn4)c3C)c(C)c2)CC1 ZINC000029045931 847497589 /nfs/dbraw/zinc/49/75/89/847497589.db2.gz KWQLQAGXKMQIRG-UHFFFAOYSA-N 0 3 417.557 4.192 20 0 HIADHN COc1ccccc1CCNC(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1 ZINC000029655203 847598100 /nfs/dbraw/zinc/59/81/00/847598100.db2.gz GFXUKVRVRRLZOA-IBGZPJMESA-N 0 3 401.576 4.072 20 0 HIADHN COc1ccc([C@H](CNC(=O)CN(C)[C@@H](C)c2cccs2)N2CCCCC2)cc1 ZINC000029703366 847603506 /nfs/dbraw/zinc/60/35/06/847603506.db2.gz BUJDNBVQYXFRBT-RXVVDRJESA-N 0 3 415.603 4.093 20 0 HIADHN O=C(NCc1ccc(OCC(F)(F)F)cc1)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000029727203 847609590 /nfs/dbraw/zinc/60/95/90/847609590.db2.gz MUWRSUKGWXVVBX-FQEVSTJZSA-N 0 3 421.463 4.264 20 0 HIADHN Cc1noc(C)c1COc1ccccc1C(=O)NCCCN1CCc2ccccc2C1 ZINC000029841853 847630768 /nfs/dbraw/zinc/63/07/68/847630768.db2.gz YFDODJWZWPULGM-UHFFFAOYSA-N 0 3 419.525 4.049 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)c1ccccc1COc1ccccc1 ZINC000029841888 847630808 /nfs/dbraw/zinc/63/08/08/847630808.db2.gz PYHZCBZYUMPANT-UHFFFAOYSA-N 0 3 400.522 4.444 20 0 HIADHN COc1ccccc1NC(=O)C1CCN(Cc2ccc(OC(F)(F)F)cc2)CC1 ZINC000029911338 847648183 /nfs/dbraw/zinc/64/81/83/847648183.db2.gz PWVHSHHLZXBNHR-UHFFFAOYSA-N 0 3 408.420 4.445 20 0 HIADHN CN1CCN(CCCNC(=O)c2ccc(SC(F)F)cc2)[C@@H](c2ccccc2)C1 ZINC000030000754 847667337 /nfs/dbraw/zinc/66/73/37/847667337.db2.gz OUXPXJYIQWDCHA-HXUWFJFHSA-N 0 3 419.541 4.110 20 0 HIADHN CNC(=O)c1ccc(CNCc2cn(-c3ccccc3)nc2-c2ccc(C)o2)cc1 ZINC000030671964 847756162 /nfs/dbraw/zinc/75/61/62/847756162.db2.gz FTRTZTNKRUKMDE-UHFFFAOYSA-N 0 3 400.482 4.090 20 0 HIADHN CCn1c2ccccc2c2cc(CNCc3ccnc(N4CCOCC4)c3)ccc21 ZINC000030900393 847793933 /nfs/dbraw/zinc/79/39/33/847793933.db2.gz MCJKVXMIYHWPAM-UHFFFAOYSA-N 0 3 400.526 4.336 20 0 HIADHN Clc1ccccc1COc1cccc(CNCc2ccnc(N3CCOCC3)c2)c1 ZINC000030900459 847794334 /nfs/dbraw/zinc/79/43/34/847794334.db2.gz YIKYNZIJXJPKJE-UHFFFAOYSA-N 0 3 423.944 4.440 20 0 HIADHN COc1cc(CNCc2cccnc2-n2ccnc2)ccc1OCc1ccccc1 ZINC000030902403 847796115 /nfs/dbraw/zinc/79/61/15/847796115.db2.gz KHVAULJVJZIZHB-UHFFFAOYSA-N 0 3 400.482 4.145 20 0 HIADHN c1cn(-c2ncccc2CNCc2cn(-c3ccccc3)nc2-c2ccccc2)cn1 ZINC000030902503 847796299 /nfs/dbraw/zinc/79/62/99/847796299.db2.gz HIBDDCGKIMDDTI-UHFFFAOYSA-N 0 3 406.493 4.410 20 0 HIADHN COc1cc(CNC[C@@H](c2c(F)cccc2Cl)N2CCCC2)cc2c1OCCO2 ZINC000030910938 847797480 /nfs/dbraw/zinc/79/74/80/847797480.db2.gz UDIZSLUSXFXUHY-SFHVURJKSA-N 0 3 420.912 4.186 20 0 HIADHN O=C(NCCc1ccc(C(F)(F)F)cc1)NC[C@H](c1cccs1)N1CCCC1 ZINC000030989151 847805596 /nfs/dbraw/zinc/80/55/96/847805596.db2.gz IBINCHDTLOWGFT-QGZVFWFLSA-N 0 3 411.493 4.446 20 0 HIADHN O=C(NCc1ccc(OC(F)(F)F)cc1)N[C@H](CN1CCCC1)c1ccccc1 ZINC000031040282 847813425 /nfs/dbraw/zinc/81/34/25/847813425.db2.gz AOVGSNHFNTYFIN-LJQANCHMSA-N 0 3 407.436 4.222 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)c1cc2c(cccc2OC(F)F)[nH]1 ZINC000031210872 847844646 /nfs/dbraw/zinc/84/46/46/847844646.db2.gz VDLUDPIFIQXAKT-MRXNPFEDSA-N 0 3 405.470 4.398 20 0 HIADHN CN(C)Cc1ccccc1NC(=O)C1CCN(C(=O)c2cccc3ccccc32)CC1 ZINC000031232246 847847772 /nfs/dbraw/zinc/84/77/72/847847772.db2.gz IPWDHZVAGLTQFO-UHFFFAOYSA-N 0 3 415.537 4.392 20 0 HIADHN C[C@H](C1CC1)N(CC(=O)N(Cc1cccs1)c1ccc2c(c1)OCCO2)C1CC1 ZINC000031654903 847924479 /nfs/dbraw/zinc/92/44/79/847924479.db2.gz LIXYVDFFAQBLPV-MRXNPFEDSA-N 0 3 412.555 4.315 20 0 HIADHN CCN(CC)[C@H](CNC(=O)COc1ccc(Br)cc1)c1ccsc1 ZINC000031987433 847975768 /nfs/dbraw/zinc/97/57/68/847975768.db2.gz VEHGKHLVKFZCRX-QGZVFWFLSA-N 0 3 411.365 4.089 20 0 HIADHN Cc1ccc(C(=O)NC[C@@H](c2cccs2)N2CCCC2)cc1NC(=O)c1ccco1 ZINC000032238947 847993276 /nfs/dbraw/zinc/99/32/76/847993276.db2.gz TYIXCGSHAOZJNP-IBGZPJMESA-N 0 3 423.538 4.469 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)c2ccc(SCc3nc(C)no3)cc2)N(C)C)cc1 ZINC000032246320 847994807 /nfs/dbraw/zinc/99/48/07/847994807.db2.gz RVDJVILRBZYCPC-OAQYLSRUSA-N 0 3 424.570 4.265 20 0 HIADHN O=C(Cc1csc(-c2cccc(F)c2)n1)NCCCN1CCc2ccccc2C1 ZINC000032400342 848018963 /nfs/dbraw/zinc/01/89/63/848018963.db2.gz ZHHMBMCFZNPQJE-UHFFFAOYSA-N 0 3 409.530 4.056 20 0 HIADHN CC(C)(C)OC(=O)Nc1ccc(C(=O)NCCCN2CCc3ccccc3C2)cc1 ZINC000032400025 848019020 /nfs/dbraw/zinc/01/90/20/848019020.db2.gz XKBHUCLNLNHYRF-UHFFFAOYSA-N 0 3 409.530 4.212 20 0 HIADHN O=C(Nc1ccccc1C(=O)NCCCN1CCc2ccccc2C1)c1ccccc1 ZINC000032400244 848019319 /nfs/dbraw/zinc/01/93/19/848019319.db2.gz RDQJYTWTQBJHMB-UHFFFAOYSA-N 0 3 413.521 4.117 20 0 HIADHN CC[C@@H](CNC(=O)Cc1csc(-c2cccs2)n1)N1CCc2ccccc2C1 ZINC000032446925 848028873 /nfs/dbraw/zinc/02/88/73/848028873.db2.gz IAOJGRPSVGUPLE-IBGZPJMESA-N 0 3 411.596 4.367 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)CCCc2nc(-c3cccs3)no2)N(C)C)cc1 ZINC000032484016 848037952 /nfs/dbraw/zinc/03/79/52/848037952.db2.gz PEZCBMSUTSCXIZ-GOSISDBHSA-N 0 3 412.559 4.102 20 0 HIADHN Cc1cc(C(=O)NC[C@@H](Cc2ccccc2)N(C)C)cc(C)c1OCc1cccnc1 ZINC000032483563 848038056 /nfs/dbraw/zinc/03/80/56/848038056.db2.gz HRTNRXWXNZWBAY-XMMPIXPASA-N 0 3 417.553 4.180 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)CCc2ncc(-c3ccccc3F)o2)N(C)C)cc1 ZINC000032734217 848069581 /nfs/dbraw/zinc/06/95/81/848069581.db2.gz XRNBFSMIGSSVIZ-OAQYLSRUSA-N 0 3 409.505 4.395 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)Cc2c(C)nn(-c3ccccc3)c2C)N(C)C)cc1 ZINC000032733549 848069597 /nfs/dbraw/zinc/06/95/97/848069597.db2.gz RAEOAQLHKGKMFP-XMMPIXPASA-N 0 3 404.558 4.013 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)Cc2csc(-c3cccc(F)c3)n2)N(C)C)cc1 ZINC000032733803 848069928 /nfs/dbraw/zinc/06/99/28/848069928.db2.gz OOKLBFIWLHRMKZ-OAQYLSRUSA-N 0 3 411.546 4.473 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)c2cc(Cc3ccccc3)ccc2O)CC1 ZINC000436601926 861865038 /nfs/dbraw/zinc/86/50/38/861865038.db2.gz IPCUWQLAEOSDQV-LJQANCHMSA-N 0 3 415.537 4.333 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)CCSc3ccc(F)cc3)c(C)c2)CC1 ZINC000036781803 848162399 /nfs/dbraw/zinc/16/23/99/848162399.db2.gz LDDGVZRKZFGNIB-UHFFFAOYSA-N 0 3 401.551 4.397 20 0 HIADHN O=C(Cn1c2ccccc2nc1C(F)(F)F)NC[C@H](c1ccccc1)N1CCCC1 ZINC000036883685 848171574 /nfs/dbraw/zinc/17/15/74/848171574.db2.gz FFABEOMSKXMQKG-LJQANCHMSA-N 0 3 416.447 4.008 20 0 HIADHN CC(C)CN(CC(=O)N(Cc1cccs1)c1ccc2c(c1)OCCO2)C1CC1 ZINC000037170697 848172672 /nfs/dbraw/zinc/17/26/72/848172672.db2.gz QYBHHUIPBRQDSH-UHFFFAOYSA-N 0 3 400.544 4.173 20 0 HIADHN N#CC(C(=O)C1CCN(c2ncc(C(F)(F)F)cc2Cl)CC1)c1ccccn1 ZINC000041493737 848221720 /nfs/dbraw/zinc/22/17/20/848221720.db2.gz GFNCHNAQVXNRJW-AWEZNQCLSA-N 0 3 408.811 4.242 20 0 HIADHN CCOC(=O)N[C@H](C(=O)C(C#N)c1nc2cc(C(F)(F)F)ccc2s1)C(C)C ZINC000041548360 848229630 /nfs/dbraw/zinc/22/96/30/848229630.db2.gz MITNYMVFOZUFOO-RISCZKNCSA-N 0 3 413.421 4.262 20 0 HIADHN O=C(Nc1ccccc1C(=O)NC1CCN(Cc2ccccc2)CC1)c1ccsc1 ZINC000042010813 848273907 /nfs/dbraw/zinc/27/39/07/848273907.db2.gz UZLWHZNJCWDUGV-UHFFFAOYSA-N 0 3 419.550 4.395 20 0 HIADHN CC(C)c1nn(-c2ccccc2)c(Cl)c1CNC1CCN(C(=O)C2CC2)CC1 ZINC000042209271 848301178 /nfs/dbraw/zinc/30/11/78/848301178.db2.gz XWFNHGJOCMHVQU-UHFFFAOYSA-N 0 3 400.954 4.140 20 0 HIADHN Cc1nn(-c2cccc(Cl)c2)c(Cl)c1CNC1CCN(C(=O)C(C)C)CC1 ZINC000042225787 848304370 /nfs/dbraw/zinc/30/43/70/848304370.db2.gz ZJXZLFVUDUPUIY-UHFFFAOYSA-N 0 3 409.361 4.224 20 0 HIADHN Cc1ccc(C)n1-c1nc(CC(=O)NC[C@@H](c2ccccc2)N2CCCC2)cs1 ZINC000042378871 848322773 /nfs/dbraw/zinc/32/27/73/848322773.db2.gz KGTNVEAFQYJESJ-NRFANRHFSA-N 0 3 408.571 4.046 20 0 HIADHN Cc1ccc(C)n1-c1nc(CC(=O)NC[C@@H](c2cccs2)N2CCCC2)cs1 ZINC000042378921 848323023 /nfs/dbraw/zinc/32/30/23/848323023.db2.gz YTXAUXXWKMKAPW-SFHVURJKSA-N 0 3 414.600 4.108 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)N(Cc1cccs1)C[C@H]1CCCO1 ZINC000042813364 848356275 /nfs/dbraw/zinc/35/62/75/848356275.db2.gz FBJFVSQTLXIZHY-IRLDBZIGSA-N 0 3 413.587 4.276 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)N1CC=C(c2c[nH]c3ncccc23)CC1 ZINC000042813196 848356732 /nfs/dbraw/zinc/35/67/32/848356732.db2.gz KPVNBBOJNGUEQA-QHCPKHFHSA-N 0 3 415.541 4.199 20 0 HIADHN CC(C)[C@H](NC(=O)NC[C@H](c1cccs1)N1CCCC1)c1nc2ccccc2[nH]1 ZINC000043107353 848385515 /nfs/dbraw/zinc/38/55/15/848385515.db2.gz GVRALBWLNQYFSI-QUCCMNQESA-N 0 3 411.575 4.458 20 0 HIADHN COc1ccccc1-c1ccc(C[NH2+]C2CCN(C(=O)c3ccccc3[O-])CC2)cc1 ZINC000436710938 861899644 /nfs/dbraw/zinc/89/96/44/861899644.db2.gz BGRNMGPJMOYISL-UHFFFAOYSA-N 0 3 416.521 4.462 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1cccc(N2CCCC2=O)c1)c1ccsc1 ZINC000043847210 848476969 /nfs/dbraw/zinc/47/69/69/848476969.db2.gz GHIOOWXNZSDZTO-IBGZPJMESA-N 0 3 400.548 4.080 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1ccc(C(=O)NC(C)(C)C)cc1)c1ccsc1 ZINC000044017135 848501500 /nfs/dbraw/zinc/50/15/00/848501500.db2.gz KWYQGVOXYCOLKL-LJQANCHMSA-N 0 3 416.591 4.481 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1ccc(C(=O)NC(C)(C)C)cc1)c1ccsc1 ZINC000044017134 848501767 /nfs/dbraw/zinc/50/17/67/848501767.db2.gz KWYQGVOXYCOLKL-IBGZPJMESA-N 0 3 416.591 4.481 20 0 HIADHN Cc1ccc(C(=O)N2c3ccccc3CC[C@@H]2CN(C)C)cc1NC(=O)c1ccco1 ZINC000436724742 861910042 /nfs/dbraw/zinc/91/00/42/861910042.db2.gz QIKFMFVKMDXAGB-HXUWFJFHSA-N 0 3 417.509 4.364 20 0 HIADHN COc1ccc(-c2nc(C(=O)N3c4ccccc4CC[C@H]3CN(C)C)cs2)cc1 ZINC000436725385 861910296 /nfs/dbraw/zinc/91/02/96/861910296.db2.gz QPDSIMNWHXFPTG-SFHVURJKSA-N 0 3 407.539 4.342 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=S)N[C@H](C)c3ccccc3)CC2)c1 ZINC000044075679 848510337 /nfs/dbraw/zinc/51/03/37/848510337.db2.gz GHJJOVAXRMNDAU-OAQYLSRUSA-N 0 3 410.631 4.123 20 0 HIADHN CC[C@@H](CNC(=O)Nc1cccc(NC(=O)C(C)C)c1)N1CCc2ccccc2C1 ZINC000044083455 848512773 /nfs/dbraw/zinc/51/27/73/848512773.db2.gz NALLJUWEYOKVKU-QFIPXVFZSA-N 0 3 408.546 4.240 20 0 HIADHN CC(C)c1ccc(NC(=S)Nc2cccc(CN3CCC(C(N)=O)CC3)c2)cc1 ZINC000044226368 848534665 /nfs/dbraw/zinc/53/46/65/848534665.db2.gz LWRNJUCJRZLMKD-UHFFFAOYSA-N 0 3 410.587 4.316 20 0 HIADHN CN(C)Cc1cccc(NC(=O)N(C)CC(=O)Nc2c(Cl)cccc2Cl)c1 ZINC000044293315 848540663 /nfs/dbraw/zinc/54/06/63/848540663.db2.gz GHZMODXWGKEXKU-UHFFFAOYSA-N 0 3 409.317 4.157 20 0 HIADHN Cc1cc2nc(N3CCN(Cc4cccc5cccnc54)CC3)c3ccccc3n2n1 ZINC000045725696 848719077 /nfs/dbraw/zinc/71/90/77/848719077.db2.gz QIMUYYUUKCEZRA-UHFFFAOYSA-N 0 3 408.509 4.061 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1ccc(N2CCC(C)=N2)cc1)c1cccc(OC)c1 ZINC000045878075 848745538 /nfs/dbraw/zinc/74/55/38/848745538.db2.gz JXUGJFVFNMKQCL-QHCPKHFHSA-N 0 3 408.546 4.094 20 0 HIADHN Cc1cc(C(=O)NCC(C)(C)N2CCc3ccccc3C2)c(C)n1CC(F)(F)F ZINC000046360187 848832879 /nfs/dbraw/zinc/83/28/79/848832879.db2.gz JCKWLAOWATWOIX-UHFFFAOYSA-N 0 3 407.480 4.234 20 0 HIADHN C[C@@H](NC(=O)N1CCCN(Cc2ccccc2)CC1)c1ccc(OC(F)F)cc1 ZINC000046613125 848886772 /nfs/dbraw/zinc/88/67/72/848886772.db2.gz OTLXGAPHDJIEQR-QGZVFWFLSA-N 0 3 403.473 4.267 20 0 HIADHN Cc1noc(CSc2ccccc2C(=O)NC[C@@H](c2ccccc2)N2CCCC2)n1 ZINC000046729425 848920734 /nfs/dbraw/zinc/92/07/34/848920734.db2.gz VHAGRIVOONWPCM-FQEVSTJZSA-N 0 3 422.554 4.237 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)N(C)[C@H](C)c3ccccc3)CC2)c1 ZINC000046867866 848950521 /nfs/dbraw/zinc/95/05/21/848950521.db2.gz AWZVCQXPWTUYDP-JOCHJYFZSA-N 0 3 408.590 4.300 20 0 HIADHN CCN(CC)[C@H](CNC(=O)CSCc1cn2cc(C)ccc2n1)c1ccsc1 ZINC000046940540 848963035 /nfs/dbraw/zinc/96/30/35/848963035.db2.gz ADIHPBPHPRGAAA-LJQANCHMSA-N 0 3 416.616 4.137 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)N(Cc1ccco1)Cc1cccs1 ZINC000047009067 848971870 /nfs/dbraw/zinc/97/18/70/848971870.db2.gz NYDOAWVFKGKGPS-UHFFFAOYSA-N 0 3 419.616 4.415 20 0 HIADHN Cc1ccc(-n2cnnc2SCC(=O)C(C#N)c2nc3ccccc3s2)cc1C ZINC000047365366 849033354 /nfs/dbraw/zinc/03/33/54/849033354.db2.gz DESHQSPWRYZEMN-MRXNPFEDSA-N 0 3 419.535 4.462 20 0 HIADHN Cc1ccc(CNC(=O)C2CCN(Cc3cc(F)cc4cccnc43)CC2)cc1F ZINC000047893801 849133378 /nfs/dbraw/zinc/13/33/78/849133378.db2.gz QCUHCJOMNJLCEG-UHFFFAOYSA-N 0 3 409.480 4.350 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N[C@H](c2ccccc2)c2ccccn2)N(C)C)cc1 ZINC000047937421 849141114 /nfs/dbraw/zinc/14/11/14/849141114.db2.gz QNAPBNRLTZTHIT-BJKOFHAPSA-N 0 3 402.542 4.336 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)N[C@H](c1ccccc1)c1ccccn1 ZINC000047948760 849142567 /nfs/dbraw/zinc/14/25/67/849142567.db2.gz VAVBOOHPTBZITI-BJKOFHAPSA-N 0 3 400.526 4.307 20 0 HIADHN COc1ccc(OC(F)F)c(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2)c1 ZINC000048078899 849160524 /nfs/dbraw/zinc/16/05/24/849160524.db2.gz SVVBQRRCPPCTEC-UHFFFAOYSA-N 0 3 411.424 4.031 20 0 HIADHN CC1CCN([C@@H](CNC(=O)CCSCc2ccccn2)c2cccs2)CC1 ZINC000048299531 849205396 /nfs/dbraw/zinc/20/53/96/849205396.db2.gz CQXKJPHTZZCVMK-IBGZPJMESA-N 0 3 403.617 4.356 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@H](C)NCc2ccc(OC(C)C)cc2)cc1 ZINC000048683623 849254974 /nfs/dbraw/zinc/25/49/74/849254974.db2.gz GBICLYDXTLIZBW-SFHVURJKSA-N 0 3 404.576 4.355 20 0 HIADHN CN(C)Cc1cccc(NC(=O)C(=O)NCCC(c2ccccc2)c2ccccc2)c1 ZINC000048682624 849255096 /nfs/dbraw/zinc/25/50/96/849255096.db2.gz RAGPUHSSYKGNPQ-UHFFFAOYSA-N 0 3 415.537 4.025 20 0 HIADHN COc1cc([C@H](C)NCc2ccc(NC(C)=O)cc2)ccc1OCc1ccncc1 ZINC000048746814 849263064 /nfs/dbraw/zinc/26/30/64/849263064.db2.gz YQBOPHAGNLOYOF-KRWDZBQOSA-N 0 3 405.498 4.478 20 0 HIADHN CN(C)[C@H](CNC(=O)N1CCC[C@@H]1c1nc2ccccc2s1)Cc1ccccc1 ZINC000049794796 849330085 /nfs/dbraw/zinc/33/00/85/849330085.db2.gz ASGLYQRPHPXNKT-AZUAARDMSA-N 0 3 408.571 4.316 20 0 HIADHN C[C@@H]([NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1)c1nc(-c2ccccc2)cs1 ZINC000436829855 862009488 /nfs/dbraw/zinc/00/94/88/862009488.db2.gz PQWWVMFPBQCASB-MRXNPFEDSA-N 0 3 407.539 4.471 20 0 HIADHN C[C@H]([NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1)c1ccc(OCC(F)(F)F)cc1 ZINC000436829316 862010756 /nfs/dbraw/zinc/01/07/56/862010756.db2.gz ORYVBNWHVCLYKO-HNNXBMFYSA-N 0 3 422.447 4.289 20 0 HIADHN C[C@@H]([NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1)[C@@H](C)c1nc2ccccc2s1 ZINC000436833777 862014185 /nfs/dbraw/zinc/01/41/85/862014185.db2.gz ZADBQSAKOXBXFG-HZPDHXFCSA-N 0 3 409.555 4.388 20 0 HIADHN Cc1ccc(C(=O)NC2CCN(Cc3ccc(OCC(F)(F)F)cc3)CC2)s1 ZINC000051098191 849432207 /nfs/dbraw/zinc/43/22/07/849432207.db2.gz AJZJSSHVFJWVPL-UHFFFAOYSA-N 0 3 412.477 4.392 20 0 HIADHN COc1cc(CNC(C)(C)c2ccccc2)cc(I)c1OC ZINC000051188489 849440821 /nfs/dbraw/zinc/44/08/21/849440821.db2.gz RDMSHOHADBEXOX-UHFFFAOYSA-N 0 3 411.283 4.333 20 0 HIADHN COC(=O)Nc1ccc(CNC(=O)CN[C@H](c2ccc(Cl)cc2)C(C)C)cc1 ZINC000052428150 849580146 /nfs/dbraw/zinc/58/01/46/849580146.db2.gz YTTYPLURCNFSQM-FQEVSTJZSA-N 0 3 403.910 4.121 20 0 HIADHN COc1ccc(C(=O)C2CCN(CCC(=O)Nc3ccc(Cl)cc3)CC2)cc1 ZINC000052433809 849581620 /nfs/dbraw/zinc/58/16/20/849581620.db2.gz NNPDJHPOXRBCEB-UHFFFAOYSA-N 0 3 400.906 4.272 20 0 HIADHN CC(C)(CNC(=O)c1cccc(NC(=O)c2ccco2)c1)N1CCc2ccccc2C1 ZINC000052530109 849592496 /nfs/dbraw/zinc/59/24/96/849592496.db2.gz MAIWMJXWVAHIRL-UHFFFAOYSA-N 0 3 417.509 4.099 20 0 HIADHN CC[C@@H](CNC(=O)c1cccc(NC(=O)c2ccco2)c1)N1CCc2ccccc2C1 ZINC000052591746 849600433 /nfs/dbraw/zinc/60/04/33/849600433.db2.gz JQNVTDNEVPHGFE-QFIPXVFZSA-N 0 3 417.509 4.099 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)C1(c2cccc(Cl)c2)CCOCC1 ZINC000052960144 849650417 /nfs/dbraw/zinc/65/04/17/849650417.db2.gz MTVTYTNQEZQZJN-JOCHJYFZSA-N 0 3 412.961 4.342 20 0 HIADHN Cc1cc(NC(=O)c2ccco2)sc1C(=O)N(CC(C)C)C1CCN(C)CC1 ZINC000053231166 849682493 /nfs/dbraw/zinc/68/24/93/849682493.db2.gz QAFYRMUNRLMDCS-UHFFFAOYSA-N 0 3 403.548 4.094 20 0 HIADHN Cc1onc(-c2c(F)cccc2Cl)c1C(=O)NCCN(C)Cc1ccccc1 ZINC000053349774 849697618 /nfs/dbraw/zinc/69/76/18/849697618.db2.gz ZIWUPZAGSXRGEP-UHFFFAOYSA-N 0 3 401.869 4.304 20 0 HIADHN Cc1cccc(N2CCN(C(=O)NC[C@H](c3cccs3)N3CCCC3)CC2)c1C ZINC000053547804 849729756 /nfs/dbraw/zinc/72/97/56/849729756.db2.gz YJAULKXQBJZAEM-OAQYLSRUSA-N 0 3 412.603 4.034 20 0 HIADHN COc1cc2c(cc1OC)CN(C(=O)CN[C@H](c1ccc(F)cc1)C(C)(C)C)CC2 ZINC000053644206 849741523 /nfs/dbraw/zinc/74/15/23/849741523.db2.gz XSCDVORWACNNGZ-HSZRJFAPSA-N 0 3 414.521 4.105 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)c2cccc(NC(=O)c3ccco3)c2)C1 ZINC000054228089 849829954 /nfs/dbraw/zinc/82/99/54/849829954.db2.gz ONUCRRNVWHZPLO-UWJYYQICSA-N 0 3 403.482 4.097 20 0 HIADHN CCCNC(=O)c1ccc(NC(=O)N(CCN(C)C)Cc2ccccc2)cc1Cl ZINC000054475840 849874382 /nfs/dbraw/zinc/87/43/82/849874382.db2.gz AWIRIIOCGDLEDW-UHFFFAOYSA-N 0 3 416.953 4.076 20 0 HIADHN CCOC(=O)N(C)c1ccc(NC(=O)NC[C@@H](c2ccccc2)N2CCCC2)cc1 ZINC000054529036 849884236 /nfs/dbraw/zinc/88/42/36/849884236.db2.gz WKFIHLXSNLUASL-NRFANRHFSA-N 0 3 410.518 4.238 20 0 HIADHN O=C(Nc1ccccc1)NC1CCN(Cc2cccc(OCC(F)(F)F)c2)CC1 ZINC000055052258 849964022 /nfs/dbraw/zinc/96/40/22/849964022.db2.gz DYMCBLMQEBAUNW-UHFFFAOYSA-N 0 3 407.436 4.414 20 0 HIADHN CN(C)Cc1ccccc1CNC(=O)c1ccccc1N(C)C(=O)c1cccs1 ZINC000055143663 849975419 /nfs/dbraw/zinc/97/54/19/849975419.db2.gz YIIDUHVLENVYPH-UHFFFAOYSA-N 0 3 407.539 4.016 20 0 HIADHN C[C@H](N[C@H](CCc1ccccc1)c1ccccc1)C(=O)Nc1ccc(C(N)=O)cc1 ZINC000055153000 849978041 /nfs/dbraw/zinc/97/80/41/849978041.db2.gz GYTSNKYZESSZPT-FDDCHVKYSA-N 0 3 401.510 4.076 20 0 HIADHN O[C@@H](CNCc1cc(Br)ccc1OCc1ccccn1)c1ccccc1 ZINC000055371653 850008386 /nfs/dbraw/zinc/00/83/86/850008386.db2.gz MOJXODILMQUNBF-FQEVSTJZSA-N 0 3 413.315 4.246 20 0 HIADHN CCOc1ccc(NC(=O)[C@H](C)N[C@H](C)c2ccc(NC(=O)NC3CC3)cc2)cc1 ZINC000056159754 850262560 /nfs/dbraw/zinc/26/25/60/850262560.db2.gz IQQJRYMCUZRKFB-CVEARBPZSA-N 0 3 410.518 4.047 20 0 HIADHN CCN1CCN(c2ccc(N[C@H](C)C(=O)Nc3ccc(F)cc3Cl)c(C)c2)CC1 ZINC000056170185 850267998 /nfs/dbraw/zinc/26/79/98/850267998.db2.gz SUBYFCSFEQWGCC-MRXNPFEDSA-N 0 3 418.944 4.369 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N(C)Cc1ccn(-c2ccccc2)n1)c1ccsc1 ZINC000056399630 850348238 /nfs/dbraw/zinc/34/82/38/850348238.db2.gz OBMDWVZWKQNGSH-NRFANRHFSA-N 0 3 411.575 4.158 20 0 HIADHN CC(=O)Nc1ccc(Cl)c(NC(=O)NC[C@@H](c2cccs2)N2CCCC2)c1 ZINC000056693114 850442265 /nfs/dbraw/zinc/44/22/65/850442265.db2.gz ZLFRGJQVDJXRSM-KRWDZBQOSA-N 0 3 406.939 4.319 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCCc1cccc2cccnc21)c1cccc(OC)c1 ZINC000057562345 850668631 /nfs/dbraw/zinc/66/86/31/850668631.db2.gz GOTMJICZDBLSEO-QHCPKHFHSA-N 0 3 420.557 4.168 20 0 HIADHN CN(C)[C@@H](CNC(=O)N(C)CCCc1cc(-c2cccc(F)c2)n[nH]1)c1ccccc1 ZINC000057791376 850716840 /nfs/dbraw/zinc/71/68/40/850716840.db2.gz DOLFQMUDPWPZLW-QHCPKHFHSA-N 0 3 423.536 4.093 20 0 HIADHN CN(C)[C@@H](CNC(=O)N(CCc1ccccc1)Cc1cccnc1)c1ccccc1 ZINC000057791400 850716949 /nfs/dbraw/zinc/71/69/49/850716949.db2.gz KCFOIYWRXPZPAI-DEOSSOPVSA-N 0 3 402.542 4.139 20 0 HIADHN COc1ccc(NC(=O)NC[C@@H](Cc2ccccc2)N(C)C)cc1OC1CCCC1 ZINC000058091899 850764442 /nfs/dbraw/zinc/76/44/42/850764442.db2.gz ZBRZUGGYRWQPON-HXUWFJFHSA-N 0 3 411.546 4.311 20 0 HIADHN CCOc1ccccc1OCC(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1 ZINC000058118636 850769394 /nfs/dbraw/zinc/76/93/94/850769394.db2.gz GSMDYLITEOOATL-SFHVURJKSA-N 0 3 402.560 4.115 20 0 HIADHN CN(C)CCN(C(=O)c1ccc(-n2ccc(C(F)(F)F)n2)cc1)c1ccccc1 ZINC000058296832 850795114 /nfs/dbraw/zinc/79/51/14/850795114.db2.gz JTVJWUAQNSCLJG-UHFFFAOYSA-N 0 3 402.420 4.100 20 0 HIADHN COc1ccccc1-c1nc(C(=O)NC2CCN(Cc3ccccc3)CC2)cs1 ZINC000058660690 850881311 /nfs/dbraw/zinc/88/13/11/850881311.db2.gz DWLFIRJNGPBGMB-UHFFFAOYSA-N 0 3 407.539 4.213 20 0 HIADHN CC(C)CN(CCN(C)C)C(=O)c1ccc(COc2ccc(Br)cc2)o1 ZINC000058883275 850951217 /nfs/dbraw/zinc/95/12/17/850951217.db2.gz XSXPQIYITGYCTB-UHFFFAOYSA-N 0 3 423.351 4.281 20 0 HIADHN CC(C)Oc1cc(Br)ccc1C(=O)NC[C@@H](c1ccccc1)N(C)C ZINC000060030048 851032044 /nfs/dbraw/zinc/03/20/44/851032044.db2.gz QHMVJNBJVAPEDD-SFHVURJKSA-N 0 3 405.336 4.269 20 0 HIADHN CCOc1ccc(C(=O)CCC(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000060159696 851047023 /nfs/dbraw/zinc/04/70/23/851047023.db2.gz GAFRNTZLJSKNIP-NRFANRHFSA-N 0 3 408.542 4.077 20 0 HIADHN Cc1cc(Cl)ccc1OCC(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000060221269 851053449 /nfs/dbraw/zinc/05/34/49/851053449.db2.gz NWQWDAMTJKFRII-UHFFFAOYSA-N 0 3 404.963 4.257 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)[C@@H]1C[C@@H]1c1ccc(Br)cc1 ZINC000060300070 851060644 /nfs/dbraw/zinc/06/06/44/851060644.db2.gz LTWPIEPJZLGMPF-NHCUHLMSSA-N 0 3 413.359 4.117 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)c2cccc(NC(=O)OC(C)(C)C)c2)o1 ZINC000060407430 851089687 /nfs/dbraw/zinc/08/96/87/851089687.db2.gz WDKJGWMULZSIQQ-UHFFFAOYSA-N 0 3 401.507 4.139 20 0 HIADHN CN(C)Cc1ccccc1CNC(=O)CCSc1ccccc1Br ZINC000060489792 851117282 /nfs/dbraw/zinc/11/72/82/851117282.db2.gz CZTXIXFOHHTWQK-UHFFFAOYSA-N 0 3 407.377 4.309 20 0 HIADHN CCOC(=O)N1CCC(NCc2c(Cl)n(-c3ccccc3)nc2C(C)C)CC1 ZINC000060523605 851133709 /nfs/dbraw/zinc/13/37/09/851133709.db2.gz SJHDAVDOCFAICS-UHFFFAOYSA-N 0 3 404.942 4.360 20 0 HIADHN O=C(c1cccc(CN2CCCC2)c1)N1CCN(c2cccc(C(F)(F)F)c2)CC1 ZINC000060580140 851154667 /nfs/dbraw/zinc/15/46/67/851154667.db2.gz YQUIMKCLUHACJP-UHFFFAOYSA-N 0 3 417.475 4.264 20 0 HIADHN CCCc1c(C(=O)NC[C@H](c2ccccc2)N2CCCC2)cnn1Cc1ccccc1 ZINC000060602900 851163805 /nfs/dbraw/zinc/16/38/05/851163805.db2.gz RLFBQRHLDMZRSK-RUZDIDTESA-N 0 3 416.569 4.451 20 0 HIADHN COc1cc(C(=O)NCCN2CCCCC2)ccc1OCc1ccccc1Cl ZINC000060665148 851182589 /nfs/dbraw/zinc/18/25/89/851182589.db2.gz IJYOMKDDCLQXMM-UHFFFAOYSA-N 0 3 402.922 4.143 20 0 HIADHN CCN1CCN(Cc2ccc(CNC(=O)c3cc(SC)ccc3Cl)cc2)CC1 ZINC000060758452 851206325 /nfs/dbraw/zinc/20/63/25/851206325.db2.gz MXZNABBAUQSUQQ-UHFFFAOYSA-N 0 3 418.006 4.129 20 0 HIADHN Cc1nn(Cc2ccccc2Cl)c(Cl)c1CNCCCN1CCCCCC1=O ZINC000061014521 851273746 /nfs/dbraw/zinc/27/37/46/851273746.db2.gz LXBMVYIZCVTUPJ-UHFFFAOYSA-N 0 3 423.388 4.429 20 0 HIADHN Cc1cc(C)n(Cc2ccc(C(=O)NCC(C)(C)N3CCc4ccccc4C3)cc2)n1 ZINC000061140449 851302824 /nfs/dbraw/zinc/30/28/24/851302824.db2.gz MHRQIEPZCWZNGS-UHFFFAOYSA-N 0 3 416.569 4.115 20 0 HIADHN COc1ccc(NC(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)c2cccnc12 ZINC000061192671 851313261 /nfs/dbraw/zinc/31/32/61/851313261.db2.gz NXTHJOBNCGSIEH-UHFFFAOYSA-N 0 3 404.514 4.026 20 0 HIADHN O=C(NCc1cccnc1OC1CCCC1)NC[C@H](c1cccs1)N1CCCC1 ZINC000061231486 851324462 /nfs/dbraw/zinc/32/44/62/851324462.db2.gz JWBFNRDGMYNSCX-LJQANCHMSA-N 0 3 414.575 4.101 20 0 HIADHN Cc1ccc([C@H](CNC(=O)[C@H](c2ccccc2)N2CCSCC2)N2CCCC2)cc1 ZINC000061502430 851389761 /nfs/dbraw/zinc/38/97/61/851389761.db2.gz RGRKXCLJSMIGQY-ZEQRLZLVSA-N 0 3 423.626 4.038 20 0 HIADHN O=C(CCCc1nc2ccccc2[nH]1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000061572185 851408818 /nfs/dbraw/zinc/40/88/18/851408818.db2.gz AEWMDGZWNDPZAK-UHFFFAOYSA-N 0 3 408.571 4.116 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)N1CCc2[nH]c3ccccc3c2C1 ZINC000061792861 851453778 /nfs/dbraw/zinc/45/37/78/851453778.db2.gz DTNPLFLDOJJZCP-UHFFFAOYSA-N 0 3 420.582 4.349 20 0 HIADHN O=C(NCc1ccccc1N1CCCC1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000061790876 851454019 /nfs/dbraw/zinc/45/40/19/851454019.db2.gz ZSSWNRJEDZNHPB-UHFFFAOYSA-N 0 3 424.614 4.200 20 0 HIADHN O=C(NCCc1c[nH]c2ccccc12)Nc1ccc(CCN2CCSCC2)cc1 ZINC000061792652 851454032 /nfs/dbraw/zinc/45/40/32/851454032.db2.gz XJERVFTUCQNVTJ-UHFFFAOYSA-N 0 3 408.571 4.123 20 0 HIADHN CCOc1ccccc1CN(C)C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000061790701 851454310 /nfs/dbraw/zinc/45/43/10/851454310.db2.gz DFFQVBHBSWASOG-UHFFFAOYSA-N 0 3 413.587 4.341 20 0 HIADHN C[C@@H](NC(=O)NCC1(N2CCSCC2)CCCC1)c1ccc(OC(F)F)cc1 ZINC000061966739 851482239 /nfs/dbraw/zinc/48/22/39/851482239.db2.gz XDMCNJPXQITBFX-OAHLLOKOSA-N 0 3 413.534 4.010 20 0 HIADHN CCCC(=O)Nc1cccc(CNC(=O)NCC(C)(C)N2CCc3ccccc3C2)c1 ZINC000061982183 851487058 /nfs/dbraw/zinc/48/70/58/851487058.db2.gz WITKXPNHBSVPSX-UHFFFAOYSA-N 0 3 422.573 4.061 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000062374070 851531733 /nfs/dbraw/zinc/53/17/33/851531733.db2.gz YSBWVIJGLLOKAN-UHFFFAOYSA-N 0 3 412.824 4.122 20 0 HIADHN COC(=O)c1ccc(NC(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)cc1 ZINC000062390299 851539398 /nfs/dbraw/zinc/53/93/98/851539398.db2.gz MBLALYODMUWVLV-UHFFFAOYSA-N 0 3 423.435 4.088 20 0 HIADHN COC(=O)Nc1ccc(NC(=O)N(CCN(C)C)Cc2cccc(Cl)c2)cc1 ZINC000062399888 851541793 /nfs/dbraw/zinc/54/17/93/851541793.db2.gz JCQLHTACLXKXHM-UHFFFAOYSA-N 0 3 404.898 4.114 20 0 HIADHN CC(=O)Nc1c(C)ccc(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2F)c1C ZINC000062404470 851543066 /nfs/dbraw/zinc/54/30/66/851543066.db2.gz BASCVCVMASIQCL-UHFFFAOYSA-N 0 3 418.488 4.136 20 0 HIADHN COc1cc(Br)cc(C)c1NC(=O)NC[C@@H](c1ccc(C)cc1)N(C)C ZINC000062428090 851550830 /nfs/dbraw/zinc/55/08/30/851550830.db2.gz XWZHWUZNRKSSNU-KRWDZBQOSA-N 0 3 420.351 4.499 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)N[C@@H](c1ccco1)c1ccccc1 ZINC000062476266 851560541 /nfs/dbraw/zinc/56/05/41/851560541.db2.gz VSQHDUBEGDPCSD-JOCHJYFZSA-N 0 3 413.468 4.421 20 0 HIADHN CCOCc1ccc(CNC(=O)N(CCN(C)C)Cc2cccc(Cl)c2)cc1 ZINC000062485534 851562942 /nfs/dbraw/zinc/56/29/42/851562942.db2.gz UFVPVFGQZVXVGG-UHFFFAOYSA-N 0 3 403.954 4.150 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)N[C@H]1CCSc2ccccc21 ZINC000062486914 851563046 /nfs/dbraw/zinc/56/30/46/851563046.db2.gz IZDLFFFMUMJEJX-IBGZPJMESA-N 0 3 405.514 4.275 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)N[C@H]1CCSc2c(F)cccc21 ZINC000062486960 851564263 /nfs/dbraw/zinc/56/42/63/851564263.db2.gz PWYPRPFRNDSIBE-IBGZPJMESA-N 0 3 405.514 4.275 20 0 HIADHN Fc1ccc(OCCCCNC(=S)NC2CCN(Cc3ccccc3)CC2)cc1 ZINC000063145703 851621811 /nfs/dbraw/zinc/62/18/11/851621811.db2.gz UFHDAARNBWXVCA-UHFFFAOYSA-N 0 3 415.578 4.113 20 0 HIADHN COc1ccccc1CN(C(=S)NC1CCN(Cc2ccccc2)CC1)C1CC1 ZINC000063149888 851623578 /nfs/dbraw/zinc/62/35/78/851623578.db2.gz IGDKNRLVBFQWEO-UHFFFAOYSA-N 0 3 409.599 4.199 20 0 HIADHN CC(=O)CCc1ccc(OCC(=O)NC[C@H](c2ccccc2)N2CCC(C)CC2)cc1 ZINC000063244021 851639271 /nfs/dbraw/zinc/63/92/71/851639271.db2.gz HSVIODWTCVVTBX-RUZDIDTESA-N 0 3 422.569 4.176 20 0 HIADHN CC(C)NS(=O)(=O)Cc1ccc(CNCc2cc(Cl)cc(Cl)c2)cc1 ZINC000063549760 851713251 /nfs/dbraw/zinc/71/32/51/851713251.db2.gz NREDBMAKYBHBRU-UHFFFAOYSA-N 0 3 401.359 4.111 20 0 HIADHN CC1CCN(C(=O)CN(C)CCCCCc2cc(-c3cccc(F)c3)no2)CC1 ZINC000063764049 851757450 /nfs/dbraw/zinc/75/74/50/851757450.db2.gz JGQDREHGYHXMSV-UHFFFAOYSA-N 0 3 401.526 4.384 20 0 HIADHN C[C@H]1CCCCN1CCNC(=O)c1ccccc1SCc1cn2ccccc2n1 ZINC000063812912 851770781 /nfs/dbraw/zinc/77/07/81/851770781.db2.gz QQZNVLAHJVCQLH-SFHVURJKSA-N 0 3 408.571 4.231 20 0 HIADHN CC(C)c1ccc(-n2cnnc2SCC(=O)N(CCN(C)C)c2ccccc2)cc1 ZINC000063853411 851778188 /nfs/dbraw/zinc/77/81/88/851778188.db2.gz XJKGJHMAAMKVNN-UHFFFAOYSA-N 0 3 423.586 4.078 20 0 HIADHN Cc1ccc(C(=O)NCC(F)(F)F)cc1NC(=O)c1cccc(CN2CCCC2)c1 ZINC000064026312 851816777 /nfs/dbraw/zinc/81/67/77/851816777.db2.gz DOQCVCDETHBVFZ-UHFFFAOYSA-N 0 3 419.447 4.135 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2NC(=O)c2cccc(CN3CCCC3)c2)C[C@H](C)O1 ZINC000064026427 851816908 /nfs/dbraw/zinc/81/69/08/851816908.db2.gz KZMUGNFGRYQJPV-BGYRXZFFSA-N 0 3 407.558 4.144 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(NS(C)(=O)=O)cc1)c1ccc(Br)s1 ZINC000437098197 862287893 /nfs/dbraw/zinc/28/78/93/862287893.db2.gz OCIXPTFCUCZFKC-QWRGUYRKSA-N 0 3 403.367 4.294 20 0 HIADHN Cc1ccc([C@@H](CNc2cnn(-c3ccc(F)cc3F)c(=O)c2Cl)N(C)C)cc1 ZINC000064114131 851829287 /nfs/dbraw/zinc/82/92/87/851829287.db2.gz INXGDOMARKTSCX-LJQANCHMSA-N 0 3 418.875 4.187 20 0 HIADHN O=C(CN1CCN(CC2CCCCC2)CC1)Nc1ccccc1Cc1ccccc1 ZINC000064129874 851833786 /nfs/dbraw/zinc/83/37/86/851833786.db2.gz IYHGQCMJFKUSJF-UHFFFAOYSA-N 0 3 405.586 4.414 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N2CC=C(c3ccc(O)cc3)CC2)N2CCCC2)cc1 ZINC000064237676 851855244 /nfs/dbraw/zinc/85/52/44/851855244.db2.gz XAVCJCMBBPOJAF-XMMPIXPASA-N 0 3 405.542 4.336 20 0 HIADHN CC(=O)Nc1cccc([C@@H](C)NC(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)c1 ZINC000064237324 851855539 /nfs/dbraw/zinc/85/55/39/851855539.db2.gz BFYDLKDIGWXRGF-JPYJTQIMSA-N 0 3 408.546 4.151 20 0 HIADHN O=C(Nc1ccc(F)c([N+](=O)[O-])c1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000064317043 851869687 /nfs/dbraw/zinc/86/96/87/851869687.db2.gz JVIAFWMQBXCYJX-GOSISDBHSA-N 0 3 411.355 4.127 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)C(=O)Nc1cc(Cl)ccc1SC)c1ccccc1 ZINC000064575784 851933862 /nfs/dbraw/zinc/93/38/62/851933862.db2.gz FOTPRVQIYCKODN-SFHVURJKSA-N 0 3 419.978 4.200 20 0 HIADHN Cc1nc(CN(C)[C@@H]2CCCN(Cc3ccc(N(C)c4ccccc4)nc3)CC2)no1 ZINC000437117198 862303822 /nfs/dbraw/zinc/30/38/22/862303822.db2.gz NILMJUUQJLZCRP-OAQYLSRUSA-N 0 3 420.561 4.027 20 0 HIADHN Cc1sc2ncnc(SCCC(=O)NC[C@@H](c3ccccc3)N(C)C)c2c1C ZINC000064733735 851970599 /nfs/dbraw/zinc/97/05/99/851970599.db2.gz RPKBWOXCTDXLHW-KRWDZBQOSA-N 0 3 414.600 4.209 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1c(C)nsc1NC)c1ccc(C(F)(F)F)cc1 ZINC000065121824 852071522 /nfs/dbraw/zinc/07/15/22/852071522.db2.gz ZLKVXAXKIACXGF-HNNXBMFYSA-N 0 3 414.497 4.325 20 0 HIADHN Cc1cc(-c2noc(CCC(=O)N[C@H]3CCN([C@@H](C)c4ccccc4)C3)n2)ccc1F ZINC000065141057 852075970 /nfs/dbraw/zinc/07/59/70/852075970.db2.gz PYGLKGWEXONGLX-PXNSSMCTSA-N 0 3 422.504 4.068 20 0 HIADHN CCOC(=O)c1c(-c2ccco2)csc1NC(=O)CN(C)C(C1CC1)C1CC1 ZINC000065243449 852092250 /nfs/dbraw/zinc/09/22/50/852092250.db2.gz QSTQZSRWQAUPKY-UHFFFAOYSA-N 0 3 402.516 4.244 20 0 HIADHN CCC[C@H](C)NC(=O)[C@H]1CCCN(Cc2cccc(C(=O)Nc3ccccc3)c2)C1 ZINC000065252059 852092815 /nfs/dbraw/zinc/09/28/15/852092815.db2.gz YJDWDRXVTLGUEI-UGKGYDQZSA-N 0 3 407.558 4.456 20 0 HIADHN O=C(CN1CCN(CC2CCCCC2)CC1)N(Cc1ccco1)Cc1ccccc1 ZINC000065302160 852101173 /nfs/dbraw/zinc/10/11/73/852101173.db2.gz PFIWSHSNGGFTEM-UHFFFAOYSA-N 0 3 409.574 4.006 20 0 HIADHN COCCOc1ccc(NC(=O)N2CCN(CC3CCCCC3)CC2)cc1Cl ZINC000065415887 852124420 /nfs/dbraw/zinc/12/44/20/852124420.db2.gz JGHUXPPINYJYTL-UHFFFAOYSA-N 0 3 409.958 4.095 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1cccc(C(N)=O)c1)c1ccc(C(F)(F)F)cc1 ZINC000065451537 852139554 /nfs/dbraw/zinc/13/95/54/852139554.db2.gz HSMULKLQZNKQRZ-GOSISDBHSA-N 0 3 422.451 4.009 20 0 HIADHN COc1ccc(Br)cc1NC(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000065451320 852139677 /nfs/dbraw/zinc/13/96/77/852139677.db2.gz GPEBVWYYFAFIDJ-YOEHRIQHSA-N 0 3 418.335 4.415 20 0 HIADHN CCOc1ccc([C@@H](C)NC(=O)NC[C@@H](c2ccc(C)cc2)N(C)C)cc1OCC ZINC000065469239 852144818 /nfs/dbraw/zinc/14/48/18/852144818.db2.gz ZCWZMHKKGOWRHN-NQIIRXRSSA-N 0 3 413.562 4.456 20 0 HIADHN CCOc1c(Cl)cc(CNC(=O)NC[C@@H](c2ccc(C)cc2)N(C)C)cc1OC ZINC000065468359 852145057 /nfs/dbraw/zinc/14/50/57/852145057.db2.gz FTEXKZGKMSWHDA-IBGZPJMESA-N 0 3 419.953 4.158 20 0 HIADHN CCCOc1ccc([C@@H](C)NC(=O)NC[C@@H](c2ccc(C)cc2)N(C)C)cc1OC ZINC000065469396 852145091 /nfs/dbraw/zinc/14/50/91/852145091.db2.gz LUHYAVYJPISKIA-NQIIRXRSSA-N 0 3 413.562 4.456 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)NCCc1ccccc1C(F)(F)F ZINC000065513564 852163338 /nfs/dbraw/zinc/16/33/38/852163338.db2.gz JVJVMHNBWYAJIC-UHFFFAOYSA-N 0 3 411.443 4.160 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)NCc2cc(F)cc(Br)c2)C1 ZINC000065521316 852166380 /nfs/dbraw/zinc/16/63/80/852166380.db2.gz LWOYMHXKGUFDKP-KUHUBIRLSA-N 0 3 420.326 4.223 20 0 HIADHN Cc1ccccc1-n1nc(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)c2c1CCC2 ZINC000065534600 852170477 /nfs/dbraw/zinc/17/04/77/852170477.db2.gz RVFYRDVZXKZCFM-DEOSSOPVSA-N 0 3 414.553 4.236 20 0 HIADHN C[C@H](CNC(=O)C(=O)Nc1ccc(Sc2ccccc2Cl)cc1)N1CCCC1 ZINC000065706766 852226790 /nfs/dbraw/zinc/22/67/90/852226790.db2.gz QHWLYUKIOQLRMH-OAHLLOKOSA-N 0 3 417.962 4.030 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1cc(C)nn1C(C)(C)C)c1cccc(OC)c1 ZINC000065786700 852256250 /nfs/dbraw/zinc/25/62/50/852256250.db2.gz AAIKIMJDFKXLOY-IBGZPJMESA-N 0 3 401.555 4.160 20 0 HIADHN Cc1ccccc1CN1CCCN(C(=O)Nc2nc(-c3ccccc3)ns2)CC1 ZINC000065790071 852257730 /nfs/dbraw/zinc/25/77/30/852257730.db2.gz IQLUODYWBLJUAO-UHFFFAOYSA-N 0 3 407.543 4.253 20 0 HIADHN COc1cc(Br)cc(C)c1NC(=O)NCCN(C)Cc1ccccc1 ZINC000065820086 852268412 /nfs/dbraw/zinc/26/84/12/852268412.db2.gz CEYRNQLGXNODSA-UHFFFAOYSA-N 0 3 406.324 4.020 20 0 HIADHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)Nc1cccnc1Cl ZINC000065821159 852268727 /nfs/dbraw/zinc/26/87/27/852268727.db2.gz RDWMFSNQKCCSBI-UHFFFAOYSA-N 0 3 411.731 4.093 20 0 HIADHN CC(=O)Nc1cc(NC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)ccc1Cl ZINC000065897469 852307382 /nfs/dbraw/zinc/30/73/82/852307382.db2.gz NJCNQTJJLLSTOC-INIZCTEOSA-N 0 3 403.885 4.288 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)c1ccc(Br)s1 ZINC000065937138 852325118 /nfs/dbraw/zinc/32/51/18/852325118.db2.gz DKBQVCMVRRZNIQ-UHFFFAOYSA-N 0 3 401.757 4.368 20 0 HIADHN Cc1ccc(-c2nc(CC(=O)N(CCN(C)C)Cc3ccc(F)cc3F)cs2)o1 ZINC000065937700 852326018 /nfs/dbraw/zinc/32/60/18/852326018.db2.gz MGMBJVQUNAYTPN-UHFFFAOYSA-N 0 3 419.497 4.123 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)CCCc1nc2ccccc2s1 ZINC000065937309 852326566 /nfs/dbraw/zinc/32/65/66/852326566.db2.gz KOTTYEZLOAEWPF-UHFFFAOYSA-N 0 3 417.525 4.488 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)c1cccc(OCc2cccnc2)c1 ZINC000065939462 852328201 /nfs/dbraw/zinc/32/82/01/852328201.db2.gz UKAOSQXEVHDIQP-UHFFFAOYSA-N 0 3 407.489 4.004 20 0 HIADHN CCCc1noc2nc(C3CC3)cc(C(=O)N(CCN(C)C)Cc3cccc(F)c3)c12 ZINC000065939537 852328350 /nfs/dbraw/zinc/32/83/50/852328350.db2.gz PPJGGHGKEOXVAY-UHFFFAOYSA-N 0 3 424.520 4.396 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)c1cc(-c2cccc(Cl)c2)on1 ZINC000065939802 852329556 /nfs/dbraw/zinc/32/95/56/852329556.db2.gz JAWILXLNDICJCT-UHFFFAOYSA-N 0 3 401.869 4.338 20 0 HIADHN COc1cccc(CCC(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)c1OC ZINC000069549922 852397843 /nfs/dbraw/zinc/39/78/43/852397843.db2.gz IMSHHVFKMTXHTI-LJQANCHMSA-N 0 3 416.587 4.287 20 0 HIADHN CCN(CC)CCN(Cc1cccs1)S(=O)(=O)c1ccc(C)c2ncccc12 ZINC000071849092 852417425 /nfs/dbraw/zinc/41/74/25/852417425.db2.gz SIQPORLVHZFHQF-UHFFFAOYSA-N 0 3 417.600 4.137 20 0 HIADHN O=C(NCc1cc(Br)cs1)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000071919672 852431290 /nfs/dbraw/zinc/43/12/90/852431290.db2.gz WVJMMTQIFKXMNW-KRWDZBQOSA-N 0 3 408.365 4.147 20 0 HIADHN Cc1nn(Cc2ccccc2)c(Cl)c1CNC[C@H](c1ccc(F)cc1)N(C)C ZINC000071947188 852441680 /nfs/dbraw/zinc/44/16/80/852441680.db2.gz GJNRLGDWCWSGCJ-OAQYLSRUSA-N 0 3 400.929 4.425 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 ZINC000071966795 852450399 /nfs/dbraw/zinc/45/03/99/852450399.db2.gz GRPHWBGNZDYOJB-UHFFFAOYSA-N 0 3 406.357 4.326 20 0 HIADHN O=C(CN1CCN(CC2CCCCC2)CC1)N[C@@H](Cc1ccccc1)c1ccccc1 ZINC000072015184 852466570 /nfs/dbraw/zinc/46/65/70/852466570.db2.gz SSSRVQGAHIZTNC-SANMLTNESA-N 0 3 419.613 4.285 20 0 HIADHN CC[C@H](C)c1ccc([C@H](NCC(=O)NC2CCC3(CC2)OCCO3)C(C)C)cc1 ZINC000072016023 852467143 /nfs/dbraw/zinc/46/71/43/852467143.db2.gz MDWKAOVGMASROF-FDDCHVKYSA-N 0 3 402.579 4.289 20 0 HIADHN CC(C)COC(=O)Nc1cccc(NC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000072033362 852475754 /nfs/dbraw/zinc/47/57/54/852475754.db2.gz XYFFOWUUJUTCRD-OAQYLSRUSA-N 0 3 410.518 4.287 20 0 HIADHN O=C(NCc1cccc(OCC(F)F)c1)NC[C@@H](c1cccs1)N1CCCC1 ZINC000072083939 852501368 /nfs/dbraw/zinc/50/13/68/852501368.db2.gz AZVROTHPWDZOFU-KRWDZBQOSA-N 0 3 409.502 4.028 20 0 HIADHN CC(=O)Nc1cc(Cl)ccc1NC(=O)c1ccc(N2CCN(C(C)C)CC2)cc1 ZINC000078557120 852519624 /nfs/dbraw/zinc/51/96/24/852519624.db2.gz PECUXEWLKNTHEG-UHFFFAOYSA-N 0 3 414.937 4.081 20 0 HIADHN CC[C@H]1CCCCN1CCNC(=O)c1sc(-c2ccc(OC)c(OC)c2)nc1C ZINC000079095755 852539825 /nfs/dbraw/zinc/53/98/25/852539825.db2.gz HADPEUJACNFPRL-KRWDZBQOSA-N 0 3 417.575 4.130 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cc(C)n(Cc2ccccn2)c1C)c1ccsc1 ZINC000097327274 852601416 /nfs/dbraw/zinc/60/14/16/852601416.db2.gz KJSCNBAMTRPABA-QFIPXVFZSA-N 0 3 410.587 4.423 20 0 HIADHN Cc1ccc(-c2nn(Cc3ccccc3)cc2C(=O)NC2CCN(C)CC2)cc1C ZINC000098081713 852656300 /nfs/dbraw/zinc/65/63/00/852656300.db2.gz PPORRAGIAJNLBK-UHFFFAOYSA-N 0 3 402.542 4.039 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)C1(c2cccc(Br)c2)CC1 ZINC000105766648 852727547 /nfs/dbraw/zinc/72/75/47/852727547.db2.gz KYPCQSLNVCFRLY-FQEVSTJZSA-N 0 3 413.359 4.434 20 0 HIADHN CCc1ccc([C@H](CNC(=O)CCc2nc(-c3ccc(C)c(F)c3)no2)N(C)C)cc1 ZINC000108455853 852853831 /nfs/dbraw/zinc/85/38/31/852853831.db2.gz VBVWWACHHSZQRD-NRFANRHFSA-N 0 3 424.520 4.098 20 0 HIADHN C[C@@H](NC(=O)N[C@H]1CCN(Cc2ccccc2)C1)c1ccc(OCC(F)(F)F)cc1 ZINC000109040137 852913488 /nfs/dbraw/zinc/91/34/88/852913488.db2.gz NYJQBOMKCUATBI-APWZRJJASA-N 0 3 421.463 4.262 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(OCC(F)(F)F)cc1 ZINC000109040133 852913538 /nfs/dbraw/zinc/91/35/38/852913538.db2.gz NYJQBOMKCUATBI-QFBILLFUSA-N 0 3 421.463 4.262 20 0 HIADHN Cc1noc(CSc2ccccc2C(=O)NC[C@H](c2ccc(C)cc2)N(C)C)n1 ZINC000109290082 852947510 /nfs/dbraw/zinc/94/75/10/852947510.db2.gz KGNNBBPDINFTDE-LJQANCHMSA-N 0 3 410.543 4.011 20 0 HIADHN C[C@H]1C[C@@H]1C(=O)Nc1cccc(C(=O)Nc2ccc(CCN3CCSCC3)cc2)c1 ZINC000109484513 852976140 /nfs/dbraw/zinc/97/61/40/852976140.db2.gz WGWVETSMGNJVMU-JTSKRJEESA-N 0 3 423.582 4.125 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)[C@H]1C[C@H]1c1ccc(Br)cc1 ZINC000109769903 853011811 /nfs/dbraw/zinc/01/18/11/853011811.db2.gz XCEQWJSQABVZDB-PMACEKPBSA-N 0 3 419.338 4.282 20 0 HIADHN NC(=O)[C@@H]1CCCN(Cc2ccccc2NC(=O)c2cc3cc(Cl)ccc3o2)C1 ZINC000109891379 853030262 /nfs/dbraw/zinc/03/02/62/853030262.db2.gz TWEMPRASIGIPHG-OAHLLOKOSA-N 0 3 411.889 4.036 20 0 HIADHN COC(=O)Nc1ccc(NC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)cc1 ZINC000110126104 853063713 /nfs/dbraw/zinc/06/37/13/853063713.db2.gz POYHOSDZHZPXIS-FQEVSTJZSA-N 0 3 421.419 4.258 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)c3ccccc3N(C)c3ccccc3)CC2)C[C@H](C)O1 ZINC000110406474 853095993 /nfs/dbraw/zinc/09/59/93/853095993.db2.gz YTSBZVDUQPFIPH-SFTDATJTSA-N 0 3 421.585 4.416 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)c3ccc4[nH]c5c(c4c3)CCCC5)CC2)C[C@@H](C)O1 ZINC000110458794 853102349 /nfs/dbraw/zinc/10/23/49/853102349.db2.gz VDYTTWIROBKMFR-QZTJIDSGSA-N 0 3 409.574 4.008 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)c3cccc(Oc4ccccc4)c3)CC2)C[C@H](C)O1 ZINC000110454275 853102530 /nfs/dbraw/zinc/10/25/30/853102530.db2.gz XNYMPPFYMCNZIR-BGYRXZFFSA-N 0 3 408.542 4.440 20 0 HIADHN C[C@@H]1CN(c2ccc(CNCC3=Cc4cc(Cl)cc(Cl)c4OC3)cn2)CCO1 ZINC000110468612 853104495 /nfs/dbraw/zinc/10/44/95/853104495.db2.gz HZRBJSBRIVLEPI-CQSZACIVSA-N 0 3 420.340 4.179 20 0 HIADHN CCN(CCC(=O)Nc1cc(OC)c(OC)c(OC)c1)Cc1ccc(Cl)s1 ZINC000110478175 853105706 /nfs/dbraw/zinc/10/57/06/853105706.db2.gz UOOJPERFUIERRQ-UHFFFAOYSA-N 0 3 412.939 4.278 20 0 HIADHN Cc1ccc(NC(=O)N2CCC(CN3C[C@@H](C)O[C@H](C)C3)CC2)c(Br)c1 ZINC000110720846 853143552 /nfs/dbraw/zinc/14/35/52/853143552.db2.gz RKRJTIMJTDIBTR-HZPDHXFCSA-N 0 3 424.383 4.111 20 0 HIADHN Cc1cc(Br)ccc1NC(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000110718385 853144010 /nfs/dbraw/zinc/14/40/10/853144010.db2.gz WCMYPSOGJQRJAD-IYBDPMFKSA-N 0 3 424.383 4.111 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3ccc(Cl)cc3Cl)CC2)C[C@@H](C)O1 ZINC000110727245 853145301 /nfs/dbraw/zinc/14/53/01/853145301.db2.gz BJYVJGJSFWAFJL-ZIAGYGMSSA-N 0 3 400.350 4.347 20 0 HIADHN CCCN(CCC(=O)Nc1cc(Cl)ccc1OC)[C@H](C)C(=O)Nc1ccccc1 ZINC000110989162 853180955 /nfs/dbraw/zinc/18/09/55/853180955.db2.gz IRDNGQIALPYBID-MRXNPFEDSA-N 0 3 417.937 4.416 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)NC[C@H](c2cccs2)N2CCCC2)c(Cl)c1 ZINC000111217341 853225838 /nfs/dbraw/zinc/22/58/38/853225838.db2.gz JVSBCECHTWRNHJ-QGZVFWFLSA-N 0 3 406.939 4.319 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccnc2)C1)N1CCC(c2nc3ccccc3s2)CC1 ZINC000115839390 853267427 /nfs/dbraw/zinc/26/74/27/853267427.db2.gz RBMRFSADAKFZAB-HXUWFJFHSA-N 0 3 420.582 4.310 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)c1cc2ccccc2oc1=O ZINC000115926310 853273820 /nfs/dbraw/zinc/27/38/20/853273820.db2.gz ZXLCNLVXGYZAFY-UHFFFAOYSA-N 0 3 418.415 4.016 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)[C@H]2C[C@H]2c2ccc(Br)cc2)o1 ZINC000116378166 853301302 /nfs/dbraw/zinc/30/13/02/853301302.db2.gz BZMZSIXWJMGFPR-OALUTQOASA-N 0 3 405.336 4.044 20 0 HIADHN CCCN(C(=O)Cc1cn2cccc(C)c2n1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000116681398 853325827 /nfs/dbraw/zinc/32/58/27/853325827.db2.gz YXEIADAWYXFIAA-HSZRJFAPSA-N 0 3 404.558 4.088 20 0 HIADHN COCc1c2ccccc2oc1C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000138702999 853394121 /nfs/dbraw/zinc/39/41/21/853394121.db2.gz AEGBJTLSXGBHFF-UHFFFAOYSA-N 0 3 410.539 4.423 20 0 HIADHN C[C@H]1CN(Cc2ccccc2NC(=O)c2cccc(CN3CCCC3)c2)C[C@H](C)O1 ZINC000139284978 853407524 /nfs/dbraw/zinc/40/75/24/853407524.db2.gz KZMUGNFGRYQJPV-PMACEKPBSA-N 0 3 407.558 4.144 20 0 HIADHN CCNC(=O)c1ccc(NC(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)c(C)c1 ZINC000139602927 853414799 /nfs/dbraw/zinc/41/47/99/853414799.db2.gz UMMANEQPBIWCIA-JOCHJYFZSA-N 0 3 408.546 4.012 20 0 HIADHN Cc1ccc(NC(=O)[C@@H](C)N[C@H](C)c2ccc(N3CCOCC3)cc2)c(Cl)c1 ZINC000140190518 853437311 /nfs/dbraw/zinc/43/73/11/853437311.db2.gz MDUZFUWAXYIVRS-IAGOWNOFSA-N 0 3 401.938 4.163 20 0 HIADHN Cc1c(Cl)cccc1NC(=O)[C@H](C)N[C@@H](C)c1ccc(N2CCOCC2)cc1 ZINC000140200747 853437687 /nfs/dbraw/zinc/43/76/87/853437687.db2.gz FKFUOUFRTNBLDH-IRXDYDNUSA-N 0 3 401.938 4.163 20 0 HIADHN C[C@@H](NCc1ccccc1-c1ccc(Cn2cncn2)cc1)C(=O)Nc1ccccc1 ZINC000140233128 853438508 /nfs/dbraw/zinc/43/85/08/853438508.db2.gz MLCKBJFILOVRBI-LJQANCHMSA-N 0 3 411.509 4.110 20 0 HIADHN Cc1sc2nc([C@H](C)NCC3(c4ccc(F)cc4)CCOCC3)[nH]c(=O)c2c1C ZINC000140279223 853440958 /nfs/dbraw/zinc/44/09/58/853440958.db2.gz DHFVVIPLIZCLQD-AWEZNQCLSA-N 0 3 415.534 4.140 20 0 HIADHN COc1ccc(CNCc2ccccc2-n2ccnc2)cc1OCc1cccnc1 ZINC000140463129 853445313 /nfs/dbraw/zinc/44/53/13/853445313.db2.gz LQAUXCZIWAUBJV-UHFFFAOYSA-N 0 3 400.482 4.145 20 0 HIADHN C[C@H](CNC(=O)[C@H](C)SCc1ncc(-c2ccc(Cl)cc2)o1)N1CCCC1 ZINC000140586934 853448923 /nfs/dbraw/zinc/44/89/23/853448923.db2.gz VSAFBAVPJCQXRO-CABCVRRESA-N 0 3 407.967 4.217 20 0 HIADHN O[C@H](Cn1c2ccccc2c2ccccc21)CN1CCN(CCc2cccs2)CC1 ZINC000141386210 853470105 /nfs/dbraw/zinc/47/01/05/853470105.db2.gz OIFDPPPJEGDQFE-FQEVSTJZSA-N 0 3 419.594 4.077 20 0 HIADHN C[C@H](NCc1ccc(OCc2ccccn2)cc1)c1cccc(N2CCOC2=O)c1 ZINC000142694042 853497980 /nfs/dbraw/zinc/49/79/80/853497980.db2.gz BAJRNZIODDXADQ-SFHVURJKSA-N 0 3 403.482 4.468 20 0 HIADHN COc1cc(NC(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)c(OC)cc1Cl ZINC000142978654 853505161 /nfs/dbraw/zinc/50/51/61/853505161.db2.gz WTNYRLCIEDQKRZ-UHFFFAOYSA-N 0 3 417.937 4.140 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)C2(c3ccc(F)cc3)CCOCC2)N2CCCC2)cc1 ZINC000143022712 853506616 /nfs/dbraw/zinc/50/66/16/853506616.db2.gz FJNQHBAUIIITCQ-HSZRJFAPSA-N 0 3 410.533 4.136 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CNC[C@@H](O)c1ccc(OC(F)(F)F)cc1 ZINC000143076677 853507200 /nfs/dbraw/zinc/50/72/00/853507200.db2.gz WBGKHRFKRWCISU-HXUWFJFHSA-N 0 3 405.420 4.211 20 0 HIADHN Cc1cccc(NC(=O)C(C#N)C(=O)Cc2csc(Cc3ccc(F)cc3)n2)c1 ZINC000143114780 853508342 /nfs/dbraw/zinc/50/83/42/853508342.db2.gz NZLTXCQOJGOJOR-LJQANCHMSA-N 0 3 407.470 4.072 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2cccc(NC(=O)NC(C)C)c2)N2CCCC2)cc1 ZINC000143104080 853508650 /nfs/dbraw/zinc/50/86/50/853508650.db2.gz XNLXVIWCLVBAMA-QFIPXVFZSA-N 0 3 408.546 4.092 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)COCc2nc3ccccc3s2)N2CCCC2)cc1 ZINC000143218291 853510472 /nfs/dbraw/zinc/51/04/72/853510472.db2.gz VDOFDSVSEXOBKG-HXUWFJFHSA-N 0 3 409.555 4.075 20 0 HIADHN COCCN1CCC(NC(=O)Nc2ccc(Oc3ccccc3Cl)cc2)CC1 ZINC000143767872 853522441 /nfs/dbraw/zinc/52/24/41/853522441.db2.gz CWNXDNZWUNVREE-UHFFFAOYSA-N 0 3 403.910 4.365 20 0 HIADHN CCc1nc(CN(C)C(=O)NC[C@H](c2ccccc2)N2CCC(C)CC2)cs1 ZINC000147996771 853598513 /nfs/dbraw/zinc/59/85/13/853598513.db2.gz ZZUBRJMCSBEBDX-HXUWFJFHSA-N 0 3 400.592 4.320 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)Nc3cccc(Oc4cnccn4)c3)cc2)CC1 ZINC000149190897 853620155 /nfs/dbraw/zinc/62/01/55/853620155.db2.gz LWZYUFJZYAHCCV-UHFFFAOYSA-N 0 3 417.513 4.052 20 0 HIADHN C[C@@H]1CCCC[C@@H]1N(C)C(=O)CNC1(c2ccc(Br)cc2)CCOCC1 ZINC000195600965 853706817 /nfs/dbraw/zinc/70/68/17/853706817.db2.gz RFMRSQGUYJSDLU-APWZRJJASA-N 0 3 423.395 4.082 20 0 HIADHN Cc1nc(COc2ccc(F)cc2)sc1C(=O)NCC(C)(C)N1CCC[C@H](C)C1 ZINC000195612083 853714037 /nfs/dbraw/zinc/71/40/37/853714037.db2.gz ONFGAKNJAUYUHD-HNNXBMFYSA-N 0 3 419.566 4.410 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cc(C)nc2onc(C(C)C)c21)c1cccc(OC)c1 ZINC000195691204 853760955 /nfs/dbraw/zinc/76/09/55/853760955.db2.gz LTCZZMDYTYHGIA-HXUWFJFHSA-N 0 3 424.545 4.476 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(S(=O)(=O)N(C)C)cc1)c1ccc(Br)cc1 ZINC000195702202 853768404 /nfs/dbraw/zinc/76/84/04/853768404.db2.gz ONJDNQOHBCNBLD-KBPBESRZSA-N 0 3 411.365 4.111 20 0 HIADHN O=C(NCc1ccc(OC(F)(F)F)cc1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000195722584 853778522 /nfs/dbraw/zinc/77/85/22/853778522.db2.gz IYPFOWFDSRNXRD-QGZVFWFLSA-N 0 3 410.411 4.253 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)c1ccc(N(C)c2ccccc2)nc1 ZINC000195724778 853779445 /nfs/dbraw/zinc/77/94/45/853779445.db2.gz WYKRHVAVTZRTKE-UHFFFAOYSA-N 0 3 424.495 4.332 20 0 HIADHN Cc1noc2nc(C(C)C)cc(C(=O)N(CCN(C)C)Cc3ccc(F)cc3F)c12 ZINC000195724787 853779523 /nfs/dbraw/zinc/77/95/23/853779523.db2.gz LATWIISDGJHCMN-UHFFFAOYSA-N 0 3 416.472 4.137 20 0 HIADHN CCOC(=O)/C=C\c1ccc(NC(=O)NC[C@H](c2cccs2)N2CCCC2)cc1 ZINC000207948659 853805569 /nfs/dbraw/zinc/80/55/69/853805569.db2.gz KZMQEBUSJKDOKK-UZRURVBFSA-N 0 3 413.543 4.283 20 0 HIADHN FC(F)(F)c1ccccc1OCCN1CCC[C@H](c2nnc3n2CCCCC3)C1 ZINC000215886973 853839467 /nfs/dbraw/zinc/83/94/67/853839467.db2.gz QHJZYIWNILFCLO-INIZCTEOSA-N 0 3 408.468 4.282 20 0 HIADHN CC[C@H](C)c1ccccc1NC(=O)[C@H](C)NC[C@@H](c1cccs1)N1CCOCC1 ZINC000216380703 853851201 /nfs/dbraw/zinc/85/12/01/853851201.db2.gz OBHBNKQQQLCPIM-WFXMLNOXSA-N 0 3 415.603 4.252 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)[C@H]2C[C@@H]2c2ccc(Br)cc2)CC1 ZINC000216497153 853854529 /nfs/dbraw/zinc/85/45/29/853854529.db2.gz RNJGOSRPWVNDFG-UXHICEINSA-N 0 3 417.347 4.269 20 0 HIADHN COc1c(Br)cc(CNC[C@@H](O)c2ccsc2)cc1Br ZINC000219105039 853866905 /nfs/dbraw/zinc/86/69/05/853866905.db2.gz FPSJBGUMLXHRGW-CYBMUJFWSA-N 0 3 421.154 4.105 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(NC(=O)C2CC2)cc1)C(=O)NC12CC3CC(CC(C3)C1)C2 ZINC000220349025 853875145 /nfs/dbraw/zinc/87/51/45/853875145.db2.gz ZZZDBEJCYNIYRC-RWJFQPFISA-N 0 3 409.574 4.159 20 0 HIADHN COc1cc(C[NH2+]CCc2ccc(Br)s2)cc(Br)c1[O-] ZINC000221139816 853875169 /nfs/dbraw/zinc/87/51/69/853875169.db2.gz INIPKABBVKCADB-UHFFFAOYSA-N 0 3 421.154 4.320 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)CSc2ccc(C(F)(F)F)cn2)C1 ZINC000227469844 853885862 /nfs/dbraw/zinc/88/58/62/853885862.db2.gz AXRGUKJMFORCHX-RHSMWYFYSA-N 0 3 409.477 4.144 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)c2cc(Br)cnc2Cl)C1 ZINC000228716878 853889406 /nfs/dbraw/zinc/88/94/06/853889406.db2.gz QRGUBTJMOWDTRP-SWLSCSKDSA-N 0 3 408.727 4.063 20 0 HIADHN Brc1cccc(-c2nc(CNCCCOC[C@H]3CCCO3)cs2)c1 ZINC000236581504 853899886 /nfs/dbraw/zinc/89/98/86/853899886.db2.gz DEYYGQMCUVOWLT-QGZVFWFLSA-N 0 3 411.365 4.248 20 0 HIADHN Cc1ccoc1C(=O)NCCCNCc1c(Cl)n(-c2ccccc2)nc1C(C)C ZINC000236630773 853905267 /nfs/dbraw/zinc/90/52/67/853905267.db2.gz QRLXOLXFTXSPAX-UHFFFAOYSA-N 0 3 414.937 4.460 20 0 HIADHN O=C(NCCNCc1cnc(-c2ccccc2)s1)c1ccc(Br)cc1 ZINC000236670490 853909455 /nfs/dbraw/zinc/90/94/55/853909455.db2.gz DUXAZFZUORAXBR-UHFFFAOYSA-N 0 3 416.344 4.092 20 0 HIADHN CC(C)COc1ccc(CNCc2ccc(C(=O)N3C[C@@H](C)O[C@H](C)C3)cc2)cc1 ZINC000236716930 853915609 /nfs/dbraw/zinc/91/56/09/853915609.db2.gz CMCCBXPNJDSGCK-WOJBJXKFSA-N 0 3 410.558 4.261 20 0 HIADHN CC(C)(C)OC(=O)N1CCc2cccc(CNCc3ccc(-n4ccnc4)cc3)c21 ZINC000236776135 853921319 /nfs/dbraw/zinc/92/13/19/853921319.db2.gz DTNUDEKNSQWUQH-UHFFFAOYSA-N 0 3 404.514 4.460 20 0 HIADHN CCNC(=O)COc1ccc(CN[C@H](c2ccc(Cl)cc2)[C@@H]2C[C@@H]2C)cc1OC ZINC000236909794 853936156 /nfs/dbraw/zinc/93/61/56/853936156.db2.gz QWSATINNZHVMFP-FCORRRHLSA-N 0 3 416.949 4.350 20 0 HIADHN CCOc1cc(CNC[C@@H](O)c2c(F)cccc2F)ccc1OCC(F)(F)F ZINC000236941055 853940392 /nfs/dbraw/zinc/94/03/92/853940392.db2.gz LBFAYKYIFLZVRZ-OAHLLOKOSA-N 0 3 405.363 4.128 20 0 HIADHN CC[C@@H]1Oc2cc([C@@H](C)NCc3ccc(OC(F)F)c(OC)c3)ccc2NC1=O ZINC000236975004 853945365 /nfs/dbraw/zinc/94/53/65/853945365.db2.gz NUVOHMXIFYWGHR-WBMJQRKESA-N 0 3 406.429 4.257 20 0 HIADHN CCOc1cccc(CNCc2ccnc(N3CCN(c4ccc(F)cc4)CC3)c2)c1 ZINC000236992206 853948493 /nfs/dbraw/zinc/94/84/93/853948493.db2.gz FAWNJNPTEPQXON-UHFFFAOYSA-N 0 3 420.532 4.236 20 0 HIADHN CCN(CC)c1ccc(CNCc2cn(-c3ccccc3)nc2-c2ccncc2)cn1 ZINC000237005952 853950352 /nfs/dbraw/zinc/95/03/52/853950352.db2.gz ATLPBJDJBSJWQH-UHFFFAOYSA-N 0 3 412.541 4.465 20 0 HIADHN Cc1nn(-c2cc(C)ccc2C)c(Cl)c1CNCCc1cccc(C(=O)N(C)C)c1 ZINC000237073894 853959933 /nfs/dbraw/zinc/95/99/33/853959933.db2.gz SEKPEWWIBOGSKC-UHFFFAOYSA-N 0 3 424.976 4.485 20 0 HIADHN CN(C(=O)c1ccncc1)c1ccc(CNCc2ccc(Br)cc2)cc1 ZINC000237093899 853963104 /nfs/dbraw/zinc/96/31/04/853963104.db2.gz DTCXHIIMWZRETJ-UHFFFAOYSA-N 0 3 410.315 4.411 20 0 HIADHN CN1CCN(c2cc(CNCc3ccc(Oc4cc(F)cc(F)c4)cc3)ccn2)CC1 ZINC000237105434 853965005 /nfs/dbraw/zinc/96/50/05/853965005.db2.gz GIFQNGZLWIKTLD-UHFFFAOYSA-N 0 3 424.495 4.194 20 0 HIADHN COc1cc(CNCCNC(=O)C(C)(C)C)ccc1OCc1ccc(Cl)cc1 ZINC000237143325 853971733 /nfs/dbraw/zinc/97/17/33/853971733.db2.gz OEOAJDLYNIKHMT-UHFFFAOYSA-N 0 3 404.938 4.180 20 0 HIADHN CN(C)[C@@H](CNCc1nc(-c2ccc(Br)cc2)c[nH]1)c1cccs1 ZINC000237178922 853976183 /nfs/dbraw/zinc/97/61/83/853976183.db2.gz XEMSQNSAQCQUIV-INIZCTEOSA-N 0 3 405.365 4.293 20 0 HIADHN COc1cc(Br)cc(CNCC#Cc2ccc(C(F)(F)F)cc2)c1O ZINC000237202375 853981325 /nfs/dbraw/zinc/98/13/25/853981325.db2.gz QJQCMLCKEQMVOY-UHFFFAOYSA-N 0 3 414.221 4.323 20 0 HIADHN COc1cc(CNCc2ccc(N(C)C(=O)c3ccncc3)cc2)ccc1SC ZINC000237247523 853990089 /nfs/dbraw/zinc/99/00/89/853990089.db2.gz PRPWXTOCUIVHQP-UHFFFAOYSA-N 0 3 407.539 4.379 20 0 HIADHN COc1ccc(OC)c(NC(=O)C[C@@H](C)NCc2ccccc2OC(F)(F)F)c1 ZINC000237247800 853990907 /nfs/dbraw/zinc/99/09/07/853990907.db2.gz MKAJMSFBOIGAGR-CYBMUJFWSA-N 0 3 412.408 4.109 20 0 HIADHN COc1cc(CNC[C@H](O)c2c(Cl)cccc2Cl)cc(Br)c1O ZINC000237269196 853993977 /nfs/dbraw/zinc/99/39/77/853993977.db2.gz KJVOKJMZEDAETN-ZDUSSCGKSA-N 0 3 421.118 4.293 20 0 HIADHN COc1cc(CNCc2ccc(-n3ccnc3C)nc2)ccc1OCc1ccccc1 ZINC000237269093 853994427 /nfs/dbraw/zinc/99/44/27/853994427.db2.gz UCVPMLBOKOPMIH-UHFFFAOYSA-N 0 3 414.509 4.453 20 0 HIADHN COc1cc(CNCc2ccc3c(c2)OCCCO3)ccc1OCc1c(C)noc1C ZINC000237271857 853995526 /nfs/dbraw/zinc/99/55/26/853995526.db2.gz PVMMXYKNRVPWPC-UHFFFAOYSA-N 0 3 424.497 4.330 20 0 HIADHN COc1ccc(OC)c([C@@H](O)CNCc2ccc(-c3nc4ccccc4s3)o2)c1 ZINC000237285736 853998081 /nfs/dbraw/zinc/99/80/81/853998081.db2.gz MZBATECIAHLWRV-SFHVURJKSA-N 0 3 410.495 4.397 20 0 HIADHN COCc1nc2n(n1)C[C@@H](NCc1ccc(-c3cccc(Cl)c3Cl)o1)CC2 ZINC000237289789 853998352 /nfs/dbraw/zinc/99/83/52/853998352.db2.gz HOFVWUDREMVITI-LBPRGKRZSA-N 0 3 407.301 4.096 20 0 HIADHN COc1ccc(OCc2nc(CN[C@H]3C[C@@H](C)N(Cc4ccccc4)C3)cs2)cc1 ZINC000237310514 854003690 /nfs/dbraw/zinc/00/36/90/854003690.db2.gz LNOZRXQRQLNLIQ-QUCCMNQESA-N 0 3 423.582 4.483 20 0 HIADHN COc1cc(CN[C@@H](C)c2ccc(-n3cncn3)cc2)ccc1OCC(F)(F)F ZINC000237322066 854006667 /nfs/dbraw/zinc/00/66/67/854006667.db2.gz JAJHSPWVZYABFU-AWEZNQCLSA-N 0 3 406.408 4.068 20 0 HIADHN CSC[C@@](C)(O)CNCc1c(C)nn(Cc2ccc(Cl)cc2Cl)c1Cl ZINC000237362350 854014856 /nfs/dbraw/zinc/01/48/56/854014856.db2.gz RBYLZHFTIATLET-KRWDZBQOSA-N 0 3 422.809 4.404 20 0 HIADHN COc1ccc(-c2ccc(CNC[C@](C)(O)c3cc(C)oc3C)o2)c([N+](=O)[O-])c1 ZINC000237430653 854031595 /nfs/dbraw/zinc/03/15/95/854031595.db2.gz SURZHBTYQGCPSP-NRFANRHFSA-N 0 3 400.431 4.071 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(CNC[C@@H](O)c3ccccc3Cl)c2)cc1 ZINC000237465558 854038278 /nfs/dbraw/zinc/03/82/78/854038278.db2.gz YDPZTGUPKROWEG-JOCHJYFZSA-N 0 3 410.901 4.424 20 0 HIADHN COc1ccc(CNCc2ccc(N3CCOCC3)cc2C(F)(F)F)cc1Cl ZINC000237472360 854040250 /nfs/dbraw/zinc/04/02/50/854040250.db2.gz OFFZFDJESKPCAE-UHFFFAOYSA-N 0 3 414.855 4.494 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(OCCNCc3ccc(F)c(F)c3)c2)cc1 ZINC000237475846 854041192 /nfs/dbraw/zinc/04/11/92/854041192.db2.gz IVQOFGXNOJFTEK-UHFFFAOYSA-N 0 3 412.436 4.394 20 0 HIADHN C[C@@H](NCc1ccc(F)c(Br)c1)c1ccc(OCC(=O)NC2CC2)cc1 ZINC000237494273 854045499 /nfs/dbraw/zinc/04/54/99/854045499.db2.gz QRGFDTVIUCTZGY-CYBMUJFWSA-N 0 3 421.310 4.096 20 0 HIADHN COc1ccc(C[C@@H](C)NCc2csc(-c3ccc4c(c3)OCO4)n2)cc1OC ZINC000237554358 854053282 /nfs/dbraw/zinc/05/32/82/854053282.db2.gz AUENKKGDDIENAG-CQSZACIVSA-N 0 3 412.511 4.277 20 0 HIADHN Cc1cc(CN[C@@H](C)c2ccc(OCC(=O)NC3CC3)cc2)ccc1Br ZINC000237581776 854058318 /nfs/dbraw/zinc/05/83/18/854058318.db2.gz IEFBDRXRRIJCMF-HNNXBMFYSA-N 0 3 417.347 4.266 20 0 HIADHN C[C@H](C#N)Oc1ccc(CN[C@@H](Cc2ccccc2)C(=O)N(C)c2ccccc2)cc1 ZINC000237603773 854060680 /nfs/dbraw/zinc/06/06/80/854060680.db2.gz NHKWVWWPROIBCI-NLFFAJNJSA-N 0 3 413.521 4.341 20 0 HIADHN Cc1nn(Cc2ccc(F)cc2)c(Cl)c1CNC[C@H](CCO)c1ccccc1 ZINC000237613464 854062480 /nfs/dbraw/zinc/06/24/80/854062480.db2.gz CLFATRJGANHXTF-IBGZPJMESA-N 0 3 401.913 4.288 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CNC[C@H](O)c1cccc(C(F)(F)F)c1 ZINC000237634479 854065766 /nfs/dbraw/zinc/06/57/66/854065766.db2.gz VKFDJUWZVKVILC-NRFANRHFSA-N 0 3 403.448 4.390 20 0 HIADHN C[C@H]1CN([C@@H](CNCc2c[nH]nc2C(C)(C)C)c2c(F)cccc2Cl)CCO1 ZINC000237647191 854067794 /nfs/dbraw/zinc/06/77/94/854067794.db2.gz NRVJDIBAVSUJQZ-KSSFIOAISA-N 0 3 408.949 4.051 20 0 HIADHN Cc1ccc(-c2n[nH]cc2C[NH2+][C@@H]2CCCN(Cc3cc(Cl)ccc3[O-])C2)o1 ZINC000237681791 854074320 /nfs/dbraw/zinc/07/43/20/854074320.db2.gz GPJQSKRKKUPCHY-GOSISDBHSA-N 0 3 400.910 4.091 20 0 HIADHN O=c1ccccn1Cc1ccc(CNCc2cccc(OCC(F)(F)F)c2)cc1 ZINC000237698796 854078037 /nfs/dbraw/zinc/07/80/37/854078037.db2.gz WHEJNZZQLDACMX-UHFFFAOYSA-N 0 3 402.416 4.128 20 0 HIADHN C[C@](O)(CNCc1cc(Cl)ccc1OC[C@@H]1CCCO1)c1ccc(F)cc1F ZINC000237734724 854085908 /nfs/dbraw/zinc/08/59/08/854085908.db2.gz NJYSNMGGILQKOO-UWJYYQICSA-N 0 3 411.876 4.173 20 0 HIADHN Fc1cccc(CNC[C@@H](c2ccc(C(F)(F)F)cc2)N2CCOCC2)c1F ZINC000237754400 854088687 /nfs/dbraw/zinc/08/86/87/854088687.db2.gz BLPQEISKMSNZFR-SFHVURJKSA-N 0 3 400.391 4.147 20 0 HIADHN FC(F)(F)c1ccn(-c2ccc(CNCc3ccc(OCC4CC4)nc3)cc2)n1 ZINC000237756684 854089616 /nfs/dbraw/zinc/08/96/16/854089616.db2.gz DRUGAQUEKXMHML-UHFFFAOYSA-N 0 3 402.420 4.365 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(C)c1CNC[C@@H](O)c1cccc(C(F)(F)F)c1 ZINC000237757495 854090010 /nfs/dbraw/zinc/09/00/10/854090010.db2.gz ATNXEUSLEKRZBB-HXUWFJFHSA-N 0 3 407.411 4.470 20 0 HIADHN Cc1cc(CNCc2cccc(NC(=O)c3cccc(F)c3)c2)ccc1-n1cncn1 ZINC000237757087 854090261 /nfs/dbraw/zinc/09/02/61/854090261.db2.gz WDJMMKMYOPVYSG-UHFFFAOYSA-N 0 3 415.472 4.257 20 0 HIADHN Cn1cc(CNCc2ccc(NC(=O)c3ccc(F)cc3)cc2)c(-c2cccnc2)n1 ZINC000237776794 854094954 /nfs/dbraw/zinc/09/49/54/854094954.db2.gz ZBKXSEPNGFEFJY-UHFFFAOYSA-N 0 3 415.472 4.163 20 0 HIADHN Cc1nn(-c2cccc(C(F)(F)F)c2)c(Cl)c1CNCCCC(=O)NC1CC1 ZINC000237807692 854101289 /nfs/dbraw/zinc/10/12/89/854101289.db2.gz VLEXHGRKLURBDM-UHFFFAOYSA-N 0 3 414.859 4.001 20 0 HIADHN Cc1cccn2cc(COc3ccc(CNC[C@H](O)c4c(F)cccc4F)cc3)nc12 ZINC000237855213 854108266 /nfs/dbraw/zinc/10/82/66/854108266.db2.gz BXDXBCLJIFFZEK-QFIPXVFZSA-N 0 3 423.463 4.323 20 0 HIADHN NC(=O)Nc1ccc(CNCc2ccc(OC(F)(F)[C@@H](F)C(F)(F)F)cc2)cc1 ZINC000237901157 854116944 /nfs/dbraw/zinc/11/69/44/854116944.db2.gz SLTJKGSHHKGRCR-HNNXBMFYSA-N 0 3 421.341 4.339 20 0 HIADHN S=C(NCc1ccccc1Br)NC1CCN(Cc2ccccc2)CC1 ZINC000243121814 854155367 /nfs/dbraw/zinc/15/53/67/854155367.db2.gz JIAOLEZGNLXCQQ-UHFFFAOYSA-N 0 3 418.404 4.078 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)[C@@H]1C[C@H]1c1cccc(Br)c1 ZINC000247442627 854157593 /nfs/dbraw/zinc/15/75/93/854157593.db2.gz XQZZJWLHOMUNLG-LEWJYISDSA-N 0 3 413.359 4.117 20 0 HIADHN C[C@@H]1Cc2ccccc2N1Cc1occc1C(=O)NC[C@H](Cc1ccccc1)N(C)C ZINC000248122063 854179844 /nfs/dbraw/zinc/17/98/44/854179844.db2.gz NLFWIAYXSZETAO-KNQAVFIVSA-N 0 3 417.553 4.134 20 0 HIADHN CCCCNC(=O)[C@@H]1CC[C@H](C)N(CC(=O)N[C@H](C)c2cccc3ccccc32)C1 ZINC000249902886 854192638 /nfs/dbraw/zinc/19/26/38/854192638.db2.gz XDPBRCHUJHXAAP-QKNQBKEWSA-N 0 3 409.574 4.034 20 0 HIADHN CCOC(=O)c1ccccc1N(CC)C(=O)c1ccc(N2CCN(C(C)C)CC2)cc1 ZINC000261430630 854259755 /nfs/dbraw/zinc/25/97/55/854259755.db2.gz RCZVDPVHSBUORJ-UHFFFAOYSA-N 0 3 423.557 4.060 20 0 HIADHN Cc1ccc([C@@H](CNc2ccc3nnc(-c4ccccc4F)n3n2)N2CCCC2)o1 ZINC000301162763 854316382 /nfs/dbraw/zinc/31/63/82/854316382.db2.gz UMGJANBOASXJHG-GOSISDBHSA-N 0 3 406.465 4.081 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(NCc3ccc(C[NH+]4CCCCC4)cc3)nc2)n1 ZINC000301163412 854316853 /nfs/dbraw/zinc/31/68/53/854316853.db2.gz HBBWRPZYMBTUQS-UHFFFAOYSA-N 0 3 403.530 4.405 20 0 HIADHN Cc1ccc([C@@H](CNc2ccc(C(=O)N3CCc4ccccc43)cn2)N2CCCC2)o1 ZINC000301233376 854335058 /nfs/dbraw/zinc/33/50/58/854335058.db2.gz KIMYQNURGXZFAG-JOCHJYFZSA-N 0 3 416.525 4.435 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(NC3CC[NH+]([C@H](C)c4ccccc4)CC3)nc2)n1 ZINC000301317975 854357277 /nfs/dbraw/zinc/35/72/77/854357277.db2.gz PDDMULSYEHDGET-QGZVFWFLSA-N 0 3 403.530 4.444 20 0 HIADHN Cc1nc(-c2ccc(NC[C@@H](C(C)C)[N@@H+]3CCc4ccccc4C3)nc2)[n-]c(=O)c1C ZINC000301330727 854361817 /nfs/dbraw/zinc/36/18/17/854361817.db2.gz BFZSAPINOXPLQF-QFIPXVFZSA-N 0 3 417.557 4.356 20 0 HIADHN Cc1nc(-c2ccc(NC[C@@H](C(C)C)[N@H+]3CCc4ccccc4C3)nc2)[n-]c(=O)c1C ZINC000301330727 854361824 /nfs/dbraw/zinc/36/18/24/854361824.db2.gz BFZSAPINOXPLQF-QFIPXVFZSA-N 0 3 417.557 4.356 20 0 HIADHN COc1ccc([C@H](CNc2ccc(-c3nc(C)c(C)c(=O)[n-]3)cn2)[NH+]2CCCC2)cc1 ZINC000301348067 854367379 /nfs/dbraw/zinc/36/73/79/854367379.db2.gz ISXMYFDIWACSMM-NRFANRHFSA-N 0 3 419.529 4.119 20 0 HIADHN Cc1ccccc1C[NH+]1CCC(Nc2ccc(-c3nc(C)c(C)c(=O)[n-]3)cn2)CC1 ZINC000301389072 854379704 /nfs/dbraw/zinc/37/97/04/854379704.db2.gz ZAZUGRCRLYAVMH-UHFFFAOYSA-N 0 3 403.530 4.246 20 0 HIADHN CCO[C@H]1C[C@@H](O)C12CCN(c1c(C)c(C)nc3ccc(Br)cc31)CC2 ZINC000301395275 854381829 /nfs/dbraw/zinc/38/18/29/854381829.db2.gz LHPCAMGMEBDKRC-MOPGFXCFSA-N 0 3 419.363 4.370 20 0 HIADHN Cc1nc(-c2ccc(NC[C@H]3CCC[N@H+](Cc4cccs4)C3)nc2)[n-]c(=O)c1C ZINC000301404206 854384652 /nfs/dbraw/zinc/38/46/52/854384652.db2.gz KQJAHOWIGHBEHD-QGZVFWFLSA-N 0 3 409.559 4.247 20 0 HIADHN Cc1nc(-c2ccc(NC[C@H]3CCC[N@@H+](Cc4cccs4)C3)nc2)[n-]c(=O)c1C ZINC000301404206 854384657 /nfs/dbraw/zinc/38/46/57/854384657.db2.gz KQJAHOWIGHBEHD-QGZVFWFLSA-N 0 3 409.559 4.247 20 0 HIADHN CC(C)(C)n1ncc2c1ncnc2N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1 ZINC000301890598 854486139 /nfs/dbraw/zinc/48/61/39/854486139.db2.gz NWULCNIQFYUJDY-MRXNPFEDSA-N 0 3 418.467 4.287 20 0 HIADHN C[C@@H](NCC(=O)N(Cc1cccs1)c1ccc2c(c1)OCCO2)c1ccccc1 ZINC000301905434 854489820 /nfs/dbraw/zinc/48/98/20/854489820.db2.gz IGEJSUZOYJCEDX-QGZVFWFLSA-N 0 3 408.523 4.403 20 0 HIADHN CCN1CCN([C@H](C)CNc2ccc3cc(Br)cc(Cl)c3n2)CC1 ZINC000302033706 854519606 /nfs/dbraw/zinc/51/96/06/854519606.db2.gz TTWXUFYCRICPOW-CYBMUJFWSA-N 0 3 411.775 4.089 20 0 HIADHN COc1ccc(Br)c(CN[C@H]2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)c1 ZINC000302062875 854524256 /nfs/dbraw/zinc/52/42/56/854524256.db2.gz XDGIIPONRRYPPH-ZFWWWQNUSA-N 0 3 413.356 4.335 20 0 HIADHN CN1CCC[C@H](CNc2nn3cc(-c4cccnc4)nc3s2)[C@@H]1c1cccs1 ZINC000302153405 854538255 /nfs/dbraw/zinc/53/82/55/854538255.db2.gz IEFVDJZHXAUMDT-CRAIPNDOSA-N 0 3 410.572 4.409 20 0 HIADHN C[C@@H]1C[C@H](N(C)c2nn3cc(-c4cccnc4)nc3s2)CCN1Cc1ccccc1 ZINC000302152461 854538273 /nfs/dbraw/zinc/53/82/73/854538273.db2.gz HYNCJQJCXAVAQE-YLJYHZDGSA-N 0 3 418.570 4.342 20 0 HIADHN COc1ccc(CN[C@@H]2CCCN(C(=O)OC(C)(C)C)[C@@H]2C)c(Br)c1 ZINC000302605228 854591121 /nfs/dbraw/zinc/59/11/21/854591121.db2.gz LYWFPIGBBXJWBR-CXAGYDPISA-N 0 3 413.356 4.335 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(Cl)c1CNCCc1ccc2c(c1)OCCO2 ZINC000302606600 854591498 /nfs/dbraw/zinc/59/14/98/854591498.db2.gz DEQOKUINNPPBBJ-UHFFFAOYSA-N 0 3 401.869 4.077 20 0 HIADHN C[N@@H+]1CC[C@H](Nc2nc(C(F)(F)F)nc3[n-]cnc32)[C@H]1c1ccc(Cl)c(F)c1 ZINC000302836774 854650435 /nfs/dbraw/zinc/65/04/35/854650435.db2.gz WVUWPTVBSXRLQG-WCQYABFASA-N 0 3 414.794 4.022 20 0 HIADHN C[N@H+]1CC[C@H](Nc2nc(C(F)(F)F)nc3[n-]cnc32)[C@H]1c1ccc(Cl)c(F)c1 ZINC000302836774 854650443 /nfs/dbraw/zinc/65/04/43/854650443.db2.gz WVUWPTVBSXRLQG-WCQYABFASA-N 0 3 414.794 4.022 20 0 HIADHN CN1CC[C@H](Nc2nc(C(F)(F)F)nc3[nH]cnc32)[C@H]1c1ccc(Cl)c(F)c1 ZINC000302836774 854650451 /nfs/dbraw/zinc/65/04/51/854650451.db2.gz WVUWPTVBSXRLQG-WCQYABFASA-N 0 3 414.794 4.022 20 0 HIADHN CC[C@@H](NCC(=O)Nc1ccccc1C(=O)NC1CCCC1)c1ccc(OC)cc1 ZINC000302856357 854658699 /nfs/dbraw/zinc/65/86/99/854658699.db2.gz MOBPOPUJJMONJJ-OAQYLSRUSA-N 0 3 409.530 4.047 20 0 HIADHN C[C@H](NCC(=O)N1CCC(C(=O)Nc2ccccc2)CC1)c1cccc2ccccc21 ZINC000302918559 854679617 /nfs/dbraw/zinc/67/96/17/854679617.db2.gz BXHFRRJRLRKGOM-IBGZPJMESA-N 0 3 415.537 4.368 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)Nc3ccc(OCC(F)(F)F)cc3)cc2)CC1 ZINC000302967328 854700192 /nfs/dbraw/zinc/70/01/92/854700192.db2.gz HRJARWVHULBCAK-UHFFFAOYSA-N 0 3 421.463 4.410 20 0 HIADHN CC1CCN([C@@H](CNC(=O)[C@@H]2CCCN2C(=O)CC(C)(C)C)c2cccs2)CC1 ZINC000303006905 854719948 /nfs/dbraw/zinc/71/99/48/854719948.db2.gz IOYPWKVSGYBEIH-OALUTQOASA-N 0 3 419.635 4.065 20 0 HIADHN COCCN(C(=O)[C@@H]1CCCN(Cc2ccccc2)C1)c1nc2ccccc2s1 ZINC000303006223 854719993 /nfs/dbraw/zinc/71/99/93/854719993.db2.gz IKKWCKCNWRHUSS-LJQANCHMSA-N 0 3 409.555 4.188 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N3CC=C(c4ccc(F)cc4)CC3)cc2)CC1 ZINC000303018920 854725811 /nfs/dbraw/zinc/72/58/11/854725811.db2.gz SZRLUMZSRFTTOD-UHFFFAOYSA-N 0 3 407.533 4.286 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2cccc(OC[C@@H]3CCCO3)c2)N2CCCC2)cc1 ZINC000303035056 854733222 /nfs/dbraw/zinc/73/32/22/854733222.db2.gz OVBBQDOMQTWSTB-BJKOFHAPSA-N 0 3 408.542 4.120 20 0 HIADHN O[C@H](CSc1ncnc2sc3c(c21)CCCC3)CN1CCc2ccccc2C1 ZINC000303065176 854745372 /nfs/dbraw/zinc/74/53/72/854745372.db2.gz YNTYZFSGKVELNV-KRWDZBQOSA-N 0 3 411.596 4.081 20 0 HIADHN CC1CCN([C@@H](CNC(=O)[C@H]2CCCN2C(=O)CC(C)(C)C)c2ccccc2)CC1 ZINC000303066393 854746401 /nfs/dbraw/zinc/74/64/01/854746401.db2.gz VYYSPVUKVMLVCB-YADHBBJMSA-N 0 3 413.606 4.003 20 0 HIADHN CCn1cc(CC(=O)NC[C@@H](c2ccc(OC)cc2)N2CCCC2)c2ccccc21 ZINC000303067674 854746747 /nfs/dbraw/zinc/74/67/47/854746747.db2.gz WFOUTYQXJDCPBZ-DEOSSOPVSA-N 0 3 405.542 4.166 20 0 HIADHN CN(C)CCN(C[C@@H]1CCCO1)C(=O)/C=C/c1ccc(-c2ccc(F)cc2)s1 ZINC000303164582 854795577 /nfs/dbraw/zinc/79/55/77/854795577.db2.gz AKERRUSVEIKLRH-RDELFYGPSA-N 0 3 402.535 4.137 20 0 HIADHN COc1ccc(OC)c(CNC[C@@H](c2c(F)cccc2Cl)N2CCO[C@H](C)C2)c1 ZINC000303225176 854824877 /nfs/dbraw/zinc/82/48/77/854824877.db2.gz WKGDOZJGBBFXCT-QRWLVFNGSA-N 0 3 422.928 4.048 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)C[C@H](C)Cc3ccccc3OC)c(C)c2)CC1 ZINC000303311619 854865842 /nfs/dbraw/zinc/86/58/42/854865842.db2.gz PAIJCCAXWOICPO-LJQANCHMSA-N 0 3 409.574 4.353 20 0 HIADHN CC(C)CCN(CCC(C)C)S(=O)(=O)N(C)C[C@H]1CCN(Cc2ccccc2)C1 ZINC000437341837 862615998 /nfs/dbraw/zinc/61/59/98/862615998.db2.gz XOBWXWSQSUCYJE-HSZRJFAPSA-N 0 3 423.667 4.079 20 0 HIADHN CN(C)[C@@H](CNC(=O)c1ccn(-c2ccc(Cl)c(Cl)c2)n1)c1ccccc1 ZINC000303354594 854888502 /nfs/dbraw/zinc/88/85/02/854888502.db2.gz ZDKAPRCYCOZWIS-IBGZPJMESA-N 0 3 403.313 4.212 20 0 HIADHN CCc1ccc([C@H](CNC(=O)CCc2cc(Br)cs2)N(C)C)cc1 ZINC000303360635 854892040 /nfs/dbraw/zinc/89/20/40/854892040.db2.gz ZORKVVALTBKRFE-SFHVURJKSA-N 0 3 409.393 4.425 20 0 HIADHN CCN1CCN(C(=O)CC2CCN([C@@H](C)c3ccc(Cl)c(Cl)c3)CC2)CC1 ZINC000303400169 854909267 /nfs/dbraw/zinc/90/92/67/854909267.db2.gz ZVPLGYOPTQVKED-INIZCTEOSA-N 0 3 412.405 4.321 20 0 HIADHN C[C@@H](CNC(=O)Cc1csc(Cc2ccc(F)cc2)n1)N(C)Cc1ccccc1 ZINC000303421191 854924304 /nfs/dbraw/zinc/92/43/04/854924304.db2.gz CRISUOHMEIFFIG-KRWDZBQOSA-N 0 3 411.546 4.052 20 0 HIADHN Cc1cc(Cl)ccc1S(=O)(=O)NC1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1 ZINC000303429786 854930841 /nfs/dbraw/zinc/93/08/41/854930841.db2.gz BRCVGNDRNBMEAV-IHWFROFDSA-N 0 3 404.963 4.122 20 0 HIADHN Cc1c(C(=O)NC2CCN(Cc3ccccc3)CC2)cnn1-c1ccccc1Cl ZINC000303438611 854938291 /nfs/dbraw/zinc/93/82/91/854938291.db2.gz GWJUOWWJQOJCQF-UHFFFAOYSA-N 0 3 408.933 4.229 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)[C@@H]1C[C@@H]1c1cccc(C(F)(F)F)c1 ZINC000303450930 854949464 /nfs/dbraw/zinc/94/94/64/854949464.db2.gz JMTIKUNWARTAPG-QZTJIDSGSA-N 0 3 412.521 4.287 20 0 HIADHN C[C@H](NC(=O)CN(Cc1ccccc1)CC1CCOCC1)c1ccc(Cl)cc1 ZINC000303460506 854959899 /nfs/dbraw/zinc/95/98/99/854959899.db2.gz LITPKYZLTDDTSB-SFHVURJKSA-N 0 3 400.950 4.446 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Cc1coc(-c2ccc(F)cc2)n1)c1ccsc1 ZINC000303497816 854986987 /nfs/dbraw/zinc/98/69/87/854986987.db2.gz BFACXZNUABPXLU-LJQANCHMSA-N 0 3 401.507 4.284 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)NCCc1ccc(Br)s1 ZINC000303502503 854990985 /nfs/dbraw/zinc/99/09/85/854990985.db2.gz AUHJTDAOFSUSGX-UHFFFAOYSA-N 0 3 407.333 4.291 20 0 HIADHN CCn1c2ccccc2nc1[C@H]1CCCN1C(=O)NC[C@H](C)N(C)Cc1ccccc1 ZINC000303523104 855010032 /nfs/dbraw/zinc/01/00/32/855010032.db2.gz ZOCRJCRTRLQUKC-WMZHIEFXSA-N 0 3 419.573 4.423 20 0 HIADHN CCn1c2ccccc2nc1[C@H]1CCCN1C(=O)NC[C@@H](C)N(C)Cc1ccccc1 ZINC000303523100 855010269 /nfs/dbraw/zinc/01/02/69/855010269.db2.gz ZOCRJCRTRLQUKC-AUSIDOKSSA-N 0 3 419.573 4.423 20 0 HIADHN CC(=O)Nc1cc(NC(=O)Nc2ccc(CCN3CCSCC3)cc2)ccc1C ZINC000303565786 855043882 /nfs/dbraw/zinc/04/38/82/855043882.db2.gz IQDDISIGPFGMJV-UHFFFAOYSA-N 0 3 412.559 4.189 20 0 HIADHN Cc1nnc(SCC(=O)Nc2ccc(C)cc2CN(C)C)n1-c1cc(C)ccc1C ZINC000303580847 855054542 /nfs/dbraw/zinc/05/45/42/855054542.db2.gz KJJMZZGLLRIXQB-UHFFFAOYSA-N 0 3 423.586 4.293 20 0 HIADHN COC(=O)CSCc1cccc(NC(=O)c2oc3ccccc3c2CN(C)C)c1 ZINC000303592416 855065279 /nfs/dbraw/zinc/06/52/79/855065279.db2.gz VKOFZUMBGNIIQC-UHFFFAOYSA-N 0 3 412.511 4.153 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)N1CCC[C@]2(CC=CCC2)C1 ZINC000303605340 855073358 /nfs/dbraw/zinc/07/33/58/855073358.db2.gz VRLYYPMKZBNNLF-RUZDIDTESA-N 0 3 410.606 4.121 20 0 HIADHN C[C@@H](C(=O)Nc1ccc(OC(F)(F)F)cc1)N1CCN(C2CCC(C)CC2)CC1 ZINC000303616161 855079646 /nfs/dbraw/zinc/07/96/46/855079646.db2.gz CKHCQHJYZMEOMC-PQUAAJSLSA-N 0 3 413.484 4.109 20 0 HIADHN O=C(NCC1CCN(Cc2ccccc2Cl)CC1)c1cccc(-n2ccnc2)c1 ZINC000303641890 855097950 /nfs/dbraw/zinc/09/79/50/855097950.db2.gz BKKQTTSJDPYVAX-UHFFFAOYSA-N 0 3 408.933 4.168 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(Cl)cc2)CC1)c1cc(F)c(F)c(F)c1 ZINC000303673810 855123759 /nfs/dbraw/zinc/12/37/59/855123759.db2.gz FABSGNILXCKSFB-UHFFFAOYSA-N 0 3 412.839 4.031 20 0 HIADHN COc1ccc(C(=O)CCC(=O)N(C)[C@H]2CCN(Cc3ccccc3)[C@@H](C)C2)cc1 ZINC000303737421 855161918 /nfs/dbraw/zinc/16/19/18/855161918.db2.gz HCXLCFLXNIHMQE-UGKGYDQZSA-N 0 3 408.542 4.170 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)Cc1ccc(F)c(Br)c1 ZINC000303768686 855186552 /nfs/dbraw/zinc/18/65/52/855186552.db2.gz BIOOVCQVCWVDOL-MRXNPFEDSA-N 0 3 419.338 4.254 20 0 HIADHN Cc1cc(NC(=O)N2CCCN(Cc3ccccc3)CC2)ccc1OC1CCOCC1 ZINC000303790766 855200351 /nfs/dbraw/zinc/20/03/51/855200351.db2.gz JVBXWUKJDKNQQT-UHFFFAOYSA-N 0 3 423.557 4.293 20 0 HIADHN Cc1cc(Cl)ccc1S(=O)(=O)N(C)[C@H]1CCN(Cc2ccccc2)[C@@H](C)C1 ZINC000303803727 855208760 /nfs/dbraw/zinc/20/87/60/855208760.db2.gz MCEKWMVROVOLOL-PXNSSMCTSA-N 0 3 406.979 4.322 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1ccc(C(=O)N2CCCC2)cc1 ZINC000303822098 855223480 /nfs/dbraw/zinc/22/34/80/855223480.db2.gz FSGMAOWGGNGJLQ-FQEVSTJZSA-N 0 3 420.557 4.051 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)NCc1nc(-c2cccc(Cl)c2)no1 ZINC000303849234 855245753 /nfs/dbraw/zinc/24/57/53/855245753.db2.gz JSOKMGVBXDDJSW-UHFFFAOYSA-N 0 3 410.861 4.128 20 0 HIADHN CC(C)COC[C@@H](NC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C)c1ccco1 ZINC000303858921 855253963 /nfs/dbraw/zinc/25/39/63/855253963.db2.gz PGPVPCYBOFFNJM-IFMALSPDSA-N 0 3 413.562 4.299 20 0 HIADHN CC(C)C(=O)Nc1ccc(Cl)c(C(=O)NC2CCN(Cc3ccccc3)CC2)c1 ZINC000303892386 855273783 /nfs/dbraw/zinc/27/37/83/855273783.db2.gz OZDJVRSTLZMRKR-UHFFFAOYSA-N 0 3 413.949 4.329 20 0 HIADHN CN(C(=O)[C@@H]1C[C@H]1c1c(F)cccc1Cl)C1CCN(CCc2ccccn2)CC1 ZINC000303902364 855278651 /nfs/dbraw/zinc/27/86/51/855278651.db2.gz STVKWKIKUDVJGI-RTBURBONSA-N 0 3 415.940 4.143 20 0 HIADHN Cc1ccc(NC(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)cc1C(=O)NC(C)C ZINC000303923259 855293959 /nfs/dbraw/zinc/29/39/59/855293959.db2.gz ULHAEEOCMPTYIC-FQEVSTJZSA-N 0 3 422.573 4.262 20 0 HIADHN Cc1cc(Br)ccc1C(=O)N1CCCN(Cc2ccccc2)C[C@H]1C ZINC000303934750 855301708 /nfs/dbraw/zinc/30/17/08/855301708.db2.gz XQUPAJPNZSYIRS-QGZVFWFLSA-N 0 3 401.348 4.494 20 0 HIADHN C[C@@H]1C[C@@H]1C(=O)Nc1cccc(C(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)c1 ZINC000303950389 855312977 /nfs/dbraw/zinc/31/29/77/855312977.db2.gz ZUIPORLBZPFUDS-PWHSHALESA-N 0 3 405.542 4.018 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1ncoc1-c1ccc(C)cc1)c1cccc(OC)c1 ZINC000303955393 855318679 /nfs/dbraw/zinc/31/86/79/855318679.db2.gz XAMBDEZSQLPCGR-NRFANRHFSA-N 0 3 407.514 4.472 20 0 HIADHN CN(C(=O)c1cc(F)ccc1Br)C1CCN(Cc2ccccc2)CC1 ZINC000311092835 855368550 /nfs/dbraw/zinc/36/85/50/855368550.db2.gz IMXUXHCJXDLLHF-UHFFFAOYSA-N 0 3 405.311 4.325 20 0 HIADHN COCC1(CNCc2ccc(Cl)cc2F)CCN(C(=O)OC(C)(C)C)CC1 ZINC000312286835 855372306 /nfs/dbraw/zinc/37/23/06/855372306.db2.gz TUSIMHLKBPPOIA-UHFFFAOYSA-N 0 3 400.922 4.232 20 0 HIADHN Cc1cc(C(=O)N2CCN(Cc3ccccc3)C[C@@H](C)C2)ccc1Br ZINC000323797475 855396560 /nfs/dbraw/zinc/39/65/60/855396560.db2.gz KCVMMHVMMSBJPI-MRXNPFEDSA-N 0 3 401.348 4.352 20 0 HIADHN C[C@@H](Cc1ccc(Br)cc1)N[C@H]1CCS(=O)(=O)c2ccc(F)cc21 ZINC000325113477 855401788 /nfs/dbraw/zinc/40/17/88/855401788.db2.gz JBPQGYNJRQNNIC-SJCJKPOMSA-N 0 3 412.324 4.028 20 0 HIADHN O=C(NC[C@H]1CCCCN1Cc1ccccc1)c1cc(Cl)ncc1Br ZINC000379695936 855427010 /nfs/dbraw/zinc/42/70/10/855427010.db2.gz WATUDKNYWJUOEX-OAHLLOKOSA-N 0 3 422.754 4.282 20 0 HIADHN COc1cc(Br)ccc1C(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC000383022523 855434734 /nfs/dbraw/zinc/43/47/34/855434734.db2.gz SABPXRXNZNGZRN-MRXNPFEDSA-N 0 3 417.347 4.194 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)c1ccc(F)c(Br)c1 ZINC000383044360 855435457 /nfs/dbraw/zinc/43/54/57/855435457.db2.gz FFILUKKSCQOFKY-HNNXBMFYSA-N 0 3 405.311 4.325 20 0 HIADHN Cc1c(Br)cccc1C(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C ZINC000383044032 855435653 /nfs/dbraw/zinc/43/56/53/855435653.db2.gz DRDZUPCVBGXUHJ-INIZCTEOSA-N 0 3 401.348 4.494 20 0 HIADHN CC(C)(C)OC(=O)N(CCCNCc1ccc(Br)o1)Cc1cccnc1 ZINC000387845135 855445561 /nfs/dbraw/zinc/44/55/61/855445561.db2.gz YXUOGSJWBPDJIH-UHFFFAOYSA-N 0 3 424.339 4.354 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)c1cc(Br)cnc1Cl ZINC000398045403 855475291 /nfs/dbraw/zinc/47/52/91/855475291.db2.gz SROCMIXEYNVPIX-KRWDZBQOSA-N 0 3 424.770 4.384 20 0 HIADHN C[C@]1(NC(=O)c2ccc(Cl)c(Br)c2)CCN(Cc2ccccc2)C1 ZINC000406032639 855482642 /nfs/dbraw/zinc/48/26/42/855482642.db2.gz NYGHLPHAGDAITP-IBGZPJMESA-N 0 3 407.739 4.497 20 0 HIADHN CCN1C(=O)c2cc(Cl)ccc2NC12CCN(CCc1ccc(F)cc1)CC2 ZINC000409592169 855556326 /nfs/dbraw/zinc/55/63/26/855556326.db2.gz PPLBVOHMUFAIED-UHFFFAOYSA-N 0 3 401.913 4.402 20 0 HIADHN CC(C)(Cc1nc2ccccc2[nH]1)C(=O)N1CCCN(CCCc2ccccc2)CC1 ZINC000409635653 855575292 /nfs/dbraw/zinc/57/52/92/855575292.db2.gz DHYBROHLHXDDCW-UHFFFAOYSA-N 0 3 418.585 4.299 20 0 HIADHN CN(CCN(Cc1ccccc1)C(=O)c1cnc2cnccc2c1)Cc1ccccc1 ZINC000409843060 855682625 /nfs/dbraw/zinc/68/26/25/855682625.db2.gz GGFVAPWRTWPHLB-UHFFFAOYSA-N 0 3 410.521 4.404 20 0 HIADHN CN1CC[C@H](NC(=O)[C@@H]2CCO[C@H]2c2ccc(Cl)c(F)c2)[C@H]1c1ccccc1 ZINC000409884531 855705653 /nfs/dbraw/zinc/70/56/53/855705653.db2.gz TXQLQDNZNPWWNO-RCOXNQKVSA-N 0 3 402.897 4.118 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cnn(-c4cccc(Cl)c4)c3)c(C)c2)CC1 ZINC000409953048 855742891 /nfs/dbraw/zinc/74/28/91/855742891.db2.gz RKQVGCDBUQIZHU-UHFFFAOYSA-N 0 3 423.948 4.228 20 0 HIADHN CCCc1noc2nc(CC)cc(C(=O)N(C)[C@@H]3CCN(Cc4ccccc4)C3)c12 ZINC000410005635 855775345 /nfs/dbraw/zinc/77/53/45/855775345.db2.gz SSDVGYRNYDEXOL-LJQANCHMSA-N 0 3 406.530 4.084 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NC(C)(C)COCc3ccccc3)c(C)c2)CC1 ZINC000410026913 855785438 /nfs/dbraw/zinc/78/54/38/855785438.db2.gz NMJVWACREXZZMO-UHFFFAOYSA-N 0 3 424.589 4.254 20 0 HIADHN CC(C)(C)[C@@H](CN1CCc2ccccc2C1)NC(=O)c1cccc(NC(=O)C2CC2)c1 ZINC000410050527 855800396 /nfs/dbraw/zinc/80/03/96/855800396.db2.gz CWPZHJPPOQOLQZ-HSZRJFAPSA-N 0 3 419.569 4.238 20 0 HIADHN Fc1cccc(CN2CCC[C@@H](c3nc(-c4ccnc(OC(F)F)c4)no3)C2)c1 ZINC000410165873 855846668 /nfs/dbraw/zinc/84/66/68/855846668.db2.gz KAHDBRDHASWUGR-OAHLLOKOSA-N 0 3 404.392 4.252 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)NCc1ccc(F)cc1C(F)(F)F ZINC000410197045 855858495 /nfs/dbraw/zinc/85/84/95/855858495.db2.gz BYWYKICYGCIUBO-UHFFFAOYSA-N 0 3 409.427 4.092 20 0 HIADHN O=C(NCc1ccc(F)cc1C(F)(F)F)N[C@H](CN1CCCC1)c1ccccc1 ZINC000410200583 855860155 /nfs/dbraw/zinc/86/01/55/855860155.db2.gz UNUPLMYWURLSIG-LJQANCHMSA-N 0 3 409.427 4.481 20 0 HIADHN CN1CCN(Cc2ccc(CNC(=O)Nc3cccc(OC4CCCC4)c3)cc2)CC1 ZINC000410371348 855957309 /nfs/dbraw/zinc/95/73/09/855957309.db2.gz ZTUOCPDGVSMKJH-UHFFFAOYSA-N 0 3 422.573 4.077 20 0 HIADHN O=C(CC1(N2CCOCC2)CCCC1)Nc1ccc(OCC(F)(F)F)c(Cl)c1 ZINC000410402815 855976704 /nfs/dbraw/zinc/97/67/04/855976704.db2.gz UMOLPKYSVBOXCI-UHFFFAOYSA-N 0 3 420.859 4.255 20 0 HIADHN C[C@H]1CN(C2CCOCC2)CCN1C(=O)N[C@H](c1cccc(Cl)c1)C1CCCC1 ZINC000425928290 856004414 /nfs/dbraw/zinc/00/44/14/856004414.db2.gz XTKMAKIJGJFOMM-JTSKRJEESA-N 0 3 419.997 4.466 20 0 HIADHN CN1CC[C@H](NC(=O)NCc2nc(-c3ccccc3F)cs2)[C@@H]1c1ccccc1 ZINC000425985543 856031996 /nfs/dbraw/zinc/03/19/96/856031996.db2.gz RINOLBAECMUTRC-RXVVDRJESA-N 0 3 410.518 4.194 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)N(Cc1ccc(F)cc1)C1CCOCC1 ZINC000426130672 856127492 /nfs/dbraw/zinc/12/74/92/856127492.db2.gz LBUATSYXNHQOQX-LJQANCHMSA-N 0 3 413.537 4.037 20 0 HIADHN C[C@H](C(=O)NCCCCN1CCN(Cc2ccccc2)CC1)c1ccc(Cl)s1 ZINC000426146955 856138929 /nfs/dbraw/zinc/13/89/29/856138929.db2.gz BCFZTJOQTLDBNR-SFHVURJKSA-N 0 3 420.022 4.219 20 0 HIADHN O=C(NCC(F)(F)F)[C@@H]1CCN(CCSc2cc(Cl)ccc2Cl)C1 ZINC000426157025 856144694 /nfs/dbraw/zinc/14/46/94/856144694.db2.gz OYXZRORRBNQKJR-SNVBAGLBSA-N 0 3 401.281 4.086 20 0 HIADHN C[C@@H]1CN(C2CCOCC2)CCN1C(=O)N[C@H]1CCc2ccc(-c3ccccc3)cc21 ZINC000426188041 856164675 /nfs/dbraw/zinc/16/46/75/856164675.db2.gz SUDCADRGXWUQFS-CLOONOSVSA-N 0 3 419.569 4.236 20 0 HIADHN CC(C)c1nn(C)cc1-c1noc([C@@H]2CN(Cc3ccccc3)CCC2(F)F)n1 ZINC000426190502 856166204 /nfs/dbraw/zinc/16/62/04/856166204.db2.gz GBWZOXAOGYQOMG-KRWDZBQOSA-N 0 3 401.461 4.218 20 0 HIADHN Cn1cc(C(=O)N(CCN2CCCC2)Cc2ccc(Cl)cc2)c(C(C)(C)C)n1 ZINC000426283763 856220410 /nfs/dbraw/zinc/22/04/10/856220410.db2.gz ZPUZXZWEWPBWJG-UHFFFAOYSA-N 0 3 402.970 4.109 20 0 HIADHN CC(C)c1nnc(CCN[C@@H](C)c2ccc(S(=O)(=O)C3CCCC3)cc2)s1 ZINC000426287902 856222754 /nfs/dbraw/zinc/22/27/54/856222754.db2.gz HHKSTXUFTWIGIX-HNNXBMFYSA-N 0 3 407.605 4.271 20 0 HIADHN Cc1cscc1CNC(=O)N(CCN(C)C)Cc1ccc(Br)cc1 ZINC000426378376 856265890 /nfs/dbraw/zinc/26/58/90/856265890.db2.gz GFDQNBCPFXOVSF-UHFFFAOYSA-N 0 3 410.381 4.092 20 0 HIADHN CCOc1cc(CN2CCS[C@@H](C)CC2)ccc1OCc1ccc(C(=O)OC)o1 ZINC000426391811 856271989 /nfs/dbraw/zinc/27/19/89/856271989.db2.gz SQXNEXRZADGIMM-INIZCTEOSA-N 0 3 419.543 4.371 20 0 HIADHN CO[C@H](C)c1nc(Cc2noc([C@@H]3CN(C(C)(C)C)C[C@H]3C(F)(F)F)n2)cs1 ZINC000426451615 856297093 /nfs/dbraw/zinc/29/70/93/856297093.db2.gz SKHZFDNJSDUCJD-RAIGVLPGSA-N 0 3 418.485 4.201 20 0 HIADHN COc1ccccc1[C@H](NC(=O)NC[C@@H]1CCCN1Cc1ccccc1)c1ccco1 ZINC000426466549 856306363 /nfs/dbraw/zinc/30/63/63/856306363.db2.gz CPEHXKOTKFUMMB-RDPSFJRHSA-N 0 3 419.525 4.341 20 0 HIADHN C[C@H](CCCOc1ccccc1C(N)=O)N[C@@H](C)c1nc(C(F)(F)F)cs1 ZINC000426528664 856335248 /nfs/dbraw/zinc/33/52/48/856335248.db2.gz GIZOGHJFXPBDHG-NEPJUHHUSA-N 0 3 401.454 4.159 20 0 HIADHN CCc1nc2ccccc2n1Cc1noc([C@@H]2CN(C(C)(C)C)C[C@H]2C(F)(F)F)n1 ZINC000426527394 856335491 /nfs/dbraw/zinc/33/54/91/856335491.db2.gz VZXVESXRFOAOHT-ZIAGYGMSSA-N 0 3 421.467 4.406 20 0 HIADHN C[C@H](C(=O)N(Cc1ccccc1Br)C1CCN(C)CC1)c1ccccn1 ZINC000426784525 856476630 /nfs/dbraw/zinc/47/66/30/856476630.db2.gz MXZYKGLNONINTM-INIZCTEOSA-N 0 3 416.363 4.071 20 0 HIADHN Cc1cc(Oc2ccc(NC(=O)CCCN3CCN(c4ccccc4)CC3)cc2)n[nH]1 ZINC000426793133 856481392 /nfs/dbraw/zinc/48/13/92/856481392.db2.gz MFNZNJHPDBJETD-UHFFFAOYSA-N 0 3 419.529 4.051 20 0 HIADHN CO[C@H](C)c1noc(CN2CCCN(CCCSc3ccccc3Cl)CC2)n1 ZINC000426809955 856491476 /nfs/dbraw/zinc/49/14/76/856491476.db2.gz GZNZCQAKLCUUPL-MRXNPFEDSA-N 0 3 424.998 4.121 20 0 HIADHN CN(C)C(=O)c1ccc(NC(=O)CN(Cc2ccccc2)[C@@H]2CCCC2(C)C)cc1 ZINC000426832322 856504601 /nfs/dbraw/zinc/50/46/01/856504601.db2.gz ITJHSXWVBKAVEL-JOCHJYFZSA-N 0 3 407.558 4.408 20 0 HIADHN Cc1ccc(C(=O)NCCCCN2C[C@@H](C)O[C@H](C)C2)c(Sc2ccccc2)n1 ZINC000426878974 856524044 /nfs/dbraw/zinc/52/40/44/856524044.db2.gz NKEZMGZHLLBGKF-RTBURBONSA-N 0 3 413.587 4.160 20 0 HIADHN C[C@H](NC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1)c1nc(C(F)(F)F)cs1 ZINC000426901926 856534609 /nfs/dbraw/zinc/53/46/09/856534609.db2.gz YTDOLOPRFGLEAA-DZGCQCFKSA-N 0 3 412.481 4.139 20 0 HIADHN C[C@H](C(=O)Nc1ccc(C(=O)N(C)[C@@H]2CCCN(C)C2)cc1)c1ccc(Cl)s1 ZINC000426947408 856557212 /nfs/dbraw/zinc/55/72/12/856557212.db2.gz DYIVKKROXCDRMW-WMLDXEAASA-N 0 3 419.978 4.310 20 0 HIADHN CC(=O)c1ccc(OCCCC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)cc1 ZINC000437460990 862824457 /nfs/dbraw/zinc/82/44/57/862824457.db2.gz IRFLQXJLKIUVJA-FQEVSTJZSA-N 0 3 408.542 4.171 20 0 HIADHN Cc1ccc(-c2nc(C(=O)N3CCC(CCN4C[C@@H](C)O[C@H](C)C4)CC3)cs2)o1 ZINC000427287401 856752703 /nfs/dbraw/zinc/75/27/03/856752703.db2.gz KJMOSYJSOXDSFT-IAGOWNOFSA-N 0 3 417.575 4.063 20 0 HIADHN CCSCc1ccc(C(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)cc1 ZINC000427288298 856753518 /nfs/dbraw/zinc/75/35/18/856753518.db2.gz OVTIVJIZQSHZBQ-RTBURBONSA-N 0 3 404.620 4.291 20 0 HIADHN Cc1ccc(C)c(C(=O)CCC(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)c1 ZINC000427292067 856755609 /nfs/dbraw/zinc/75/56/09/856755609.db2.gz MOVVLGKIVFHRJU-NHCUHLMSSA-N 0 3 414.590 4.004 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)c3c4c(nc5ccccc53)CCC4)CC2)C[C@H](C)O1 ZINC000427298556 856758547 /nfs/dbraw/zinc/75/85/47/856758547.db2.gz DGXGFBWWCMSRNF-OALUTQOASA-N 0 3 421.585 4.075 20 0 HIADHN C[C@@H](SCc1ccccc1)C(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000427306145 856761998 /nfs/dbraw/zinc/76/19/98/856761998.db2.gz ZRCWIQCDPCBIKW-VAMGGRTRSA-N 0 3 404.620 4.046 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)c3[nH]c4ccc(F)cc4c3Cl)CC2)C[C@H](C)O1 ZINC000427311920 856764604 /nfs/dbraw/zinc/76/46/04/856764604.db2.gz GAZJZSWQAVNFTM-GJZGRUSLSA-N 0 3 421.944 4.312 20 0 HIADHN C[C@H]1C[C@H]1c1ccc([C@H]2C[C@H]2C(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)o1 ZINC000427320000 856767744 /nfs/dbraw/zinc/76/77/44/856767744.db2.gz JCZRMBNVMRZCAV-NDDOAYCYSA-N 0 3 414.590 4.244 20 0 HIADHN COc1ccccc1C[C@H](C)CC(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000427330997 856774861 /nfs/dbraw/zinc/77/48/61/856774861.db2.gz OMGBASKGSWFCGL-PCCBWWKXSA-N 0 3 416.606 4.002 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)c3cc4ccc(Cl)cc4[nH]3)CC2)C[C@H](C)O1 ZINC000427329595 856775223 /nfs/dbraw/zinc/77/52/23/856775223.db2.gz LBTWAMJTPIAGNR-HOTGVXAUSA-N 0 3 403.954 4.173 20 0 HIADHN C[C@@H]1CCN(C(=O)c2ccc(OCc3ccncc3)cc2)CCN1Cc1ccccc1 ZINC000437475119 862835249 /nfs/dbraw/zinc/83/52/49/862835249.db2.gz AYHIZMQAEJXBIH-OAQYLSRUSA-N 0 3 415.537 4.397 20 0 HIADHN O=C(N1CCc2ccc(F)c(F)c2C1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000427355332 856789681 /nfs/dbraw/zinc/78/96/81/856789681.db2.gz SCLYSBPIJQPGLJ-OAQYLSRUSA-N 0 3 424.413 4.304 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3cnc(-c4ccccc4)s3)CC2)C[C@@H](C)O1 ZINC000427360892 856794589 /nfs/dbraw/zinc/79/45/89/856794589.db2.gz CAEXVWKLPBDKPH-QZTJIDSGSA-N 0 3 413.587 4.162 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3cc(C4CC4)nc4ccccc43)CC2)C[C@H](C)O1 ZINC000427363695 856796058 /nfs/dbraw/zinc/79/60/58/856796058.db2.gz YGEUTSADTXAHOC-KDURUIRLSA-N 0 3 421.585 4.464 20 0 HIADHN CC(C)CC(=O)N[C@@H](C(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1)c1ccccc1 ZINC000437477071 862837590 /nfs/dbraw/zinc/83/75/90/862837590.db2.gz RYMDZZHMBUKJCG-PXDATVDWSA-N 0 3 421.585 4.013 20 0 HIADHN CCN(CC)CCN(CCC(F)(F)F)C(=O)c1[nH]c2c(c1C)C(=O)CC(C)(C)C2 ZINC000427447398 856824138 /nfs/dbraw/zinc/82/41/38/856824138.db2.gz WRDUXDLFKJDZDY-UHFFFAOYSA-N 0 3 415.500 4.215 20 0 HIADHN O=C(C[C@H]1C=CCCC1)NC1CCN(CCOc2ccc(Br)cc2)CC1 ZINC000427448057 856824191 /nfs/dbraw/zinc/82/41/91/856824191.db2.gz DPXYTEXPLGKOIM-KRWDZBQOSA-N 0 3 421.379 4.155 20 0 HIADHN CCn1ncc(C(=O)Nc2ccc(CCN3CCSCC3)cc2)c1-c1ccccc1 ZINC000427452741 856825988 /nfs/dbraw/zinc/82/59/88/856825988.db2.gz LFAUCGIMRQJTNN-UHFFFAOYSA-N 0 3 420.582 4.414 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)CCCc1cc(Cl)sc1Cl ZINC000427599016 856883213 /nfs/dbraw/zinc/88/32/13/856883213.db2.gz LAMDROUMKVJCQA-UHFFFAOYSA-N 0 3 400.375 4.363 20 0 HIADHN Cc1cc2c(cc1C)[C@H](N[C@@H](C)c1ccc(S(=O)(=O)N(C)C)cc1)CCS2 ZINC000427602906 856885187 /nfs/dbraw/zinc/88/51/87/856885187.db2.gz SCNHEWIKDUNOHO-OXJNMPFZSA-N 0 3 404.601 4.441 20 0 HIADHN CSc1nccn1-c1ccc(C(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)cc1 ZINC000437488918 862846635 /nfs/dbraw/zinc/84/66/35/862846635.db2.gz XRQPQJYOLXVPDV-LJQANCHMSA-N 0 3 420.582 4.331 20 0 HIADHN O[C@H](C(F)F)[C@H](Cc1ccccc1)N[C@@H]1CCCc2ncc(C(F)(F)F)cc21 ZINC000427687336 856908649 /nfs/dbraw/zinc/90/86/49/856908649.db2.gz VJTSYQGBWOJNID-SQNIBIBYSA-N 0 3 400.391 4.305 20 0 HIADHN C[C@H]1CCN(C(=O)c2ccc(OCc3ccccc3)nc2)CCN1Cc1ccccc1 ZINC000437492418 862849941 /nfs/dbraw/zinc/84/99/41/862849941.db2.gz GBLHNYHZYOSLIM-NRFANRHFSA-N 0 3 415.537 4.397 20 0 HIADHN C[C@H](NCC(C)(C)c1ccc2c(c1)OCCO2)c1ncc(Br)cc1F ZINC000427704515 856916022 /nfs/dbraw/zinc/91/60/22/856916022.db2.gz DMVDZHZEHMUXSN-LBPRGKRZSA-N 0 3 409.299 4.383 20 0 HIADHN CC(=O)N1CCN(c2ccccc2CN[C@H]2CCSc3cc(C)c(C)cc32)CC1 ZINC000427708395 856918362 /nfs/dbraw/zinc/91/83/62/856918362.db2.gz YRNMIZRXMCGOOR-QFIPXVFZSA-N 0 3 409.599 4.299 20 0 HIADHN Cc1ccc(C(=O)N2CCC(N[C@@H](C)c3ncc(Br)cc3F)CC2)cc1 ZINC000427720135 856922145 /nfs/dbraw/zinc/92/21/45/856922145.db2.gz SGNBXULXHUPWRG-AWEZNQCLSA-N 0 3 420.326 4.247 20 0 HIADHN NC(=O)[C@@H](Cc1ccccc1)NC[C@@H](OCc1ccccc1)c1ccc(Cl)cc1 ZINC000427816341 856967394 /nfs/dbraw/zinc/96/73/94/856967394.db2.gz ICVXCKAAARSERE-DHIUTWEWSA-N 0 3 408.929 4.284 20 0 HIADHN COCC1(CN[C@@H](C(=O)Nc2ccc(C)c(Cl)c2)c2ccccc2)CCOCC1 ZINC000427836708 856975468 /nfs/dbraw/zinc/97/54/68/856975468.db2.gz YOECARNUZCTLHJ-OAQYLSRUSA-N 0 3 416.949 4.361 20 0 HIADHN CCOC(=O)C1CCN(C(=O)C[C@H](C)N[C@@H](C)c2cc(Cl)ccc2Cl)CC1 ZINC000427867047 856987352 /nfs/dbraw/zinc/98/73/52/856987352.db2.gz AHOVPKQFIJLGCT-KBPBESRZSA-N 0 3 415.361 4.224 20 0 HIADHN CC1CCN(CCSc2nnc(COc3ccccc3)n2Cc2ccco2)CC1 ZINC000428037079 857051662 /nfs/dbraw/zinc/05/16/62/857051662.db2.gz SMVLKOMHPYNVCA-UHFFFAOYSA-N 0 3 412.559 4.322 20 0 HIADHN CCN1CCN(CCC(=O)Nc2cccc(Oc3cccc(C(F)(F)F)c3)c2)CC1 ZINC000428040793 857052431 /nfs/dbraw/zinc/05/24/31/857052431.db2.gz XVIREZBEAKBGNY-UHFFFAOYSA-N 0 3 421.463 4.464 20 0 HIADHN CCCNC(=O)C1(NCc2ccc(OCc3csc(C)n3)cc2)CCCCC1 ZINC000428096144 857070829 /nfs/dbraw/zinc/07/08/29/857070829.db2.gz XFTXASACBMUWHV-UHFFFAOYSA-N 0 3 401.576 4.349 20 0 HIADHN CCCCNC(=O)[C@@H]1CCCN(Cc2cnn(Cc3ccc(C(F)(F)F)cc3)c2)C1 ZINC000428241042 857122938 /nfs/dbraw/zinc/12/29/38/857122938.db2.gz QPQYJZGRGXESMP-LJQANCHMSA-N 0 3 422.495 4.079 20 0 HIADHN C[C@@H]1CCN(Cc2cnn(Cc3ccc(C(F)(F)F)cc3)c2)C[C@@H]1n1ccnc1 ZINC000428265517 857133001 /nfs/dbraw/zinc/13/30/01/857133001.db2.gz OXIJXBGDDQBFRQ-UZLBHIALSA-N 0 3 403.452 4.230 20 0 HIADHN CSc1nc(C2CC2)nc(C)c1C(=O)NC[C@@]1(C)CCCN1Cc1ccccc1 ZINC000428337025 857159775 /nfs/dbraw/zinc/15/97/75/857159775.db2.gz KDUIGXFGZZAEPY-HSZRJFAPSA-N 0 3 410.587 4.169 20 0 HIADHN CCCOc1cccc(CN(C)[C@@H](C)c2cccc(N3CCCS3(=O)=O)c2)c1 ZINC000428474814 857214413 /nfs/dbraw/zinc/21/44/13/857214413.db2.gz LZGNXRDTQHIRSC-SFHVURJKSA-N 0 3 402.560 4.208 20 0 HIADHN CCOc1cc(CN2CCC(Cn3cncn3)CC2)ccc1OCc1ccccc1 ZINC000428477078 857216772 /nfs/dbraw/zinc/21/67/72/857216772.db2.gz SWCMPSNHOZIADA-UHFFFAOYSA-N 0 3 406.530 4.168 20 0 HIADHN COc1ccc2oc(CN(C)[C@@H](C)c3cccc(N4CCCS4(=O)=O)c3)cc2c1 ZINC000428486337 857222096 /nfs/dbraw/zinc/22/20/96/857222096.db2.gz XCBJGOXWDLNPAA-INIZCTEOSA-N 0 3 414.527 4.174 20 0 HIADHN CC(C)COc1ccc(C(C)(C)C(=O)Nc2cccc(CN3CC[C@@H](O)C3)c2)cc1 ZINC000428546219 857256751 /nfs/dbraw/zinc/25/67/51/857256751.db2.gz WYTDECBUFLKAEI-JOCHJYFZSA-N 0 3 410.558 4.204 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)C(Cc1ccccc1)Cc1ccccc1 ZINC000428550736 857260646 /nfs/dbraw/zinc/26/06/46/857260646.db2.gz SBUXFTLIFGZFPA-SANMLTNESA-N 0 3 414.549 4.293 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)c1ccccc1CCc1ccccc1 ZINC000428551820 857262680 /nfs/dbraw/zinc/26/26/80/857262680.db2.gz UPRVDHRLHKPLRO-DEOSSOPVSA-N 0 3 400.522 4.291 20 0 HIADHN CC(C)(Cc1ccc(C(F)(F)F)cc1)C(=O)Nc1cccc(CN2CC[C@@H](O)C2)c1 ZINC000428554824 857263629 /nfs/dbraw/zinc/26/36/29/857263629.db2.gz UQVPMINUMTVYGX-HXUWFJFHSA-N 0 3 420.475 4.479 20 0 HIADHN CCCn1ccnc1CCCN(C)C(=O)NC[C@H](c1ccc(C)cc1)N1CCCC1 ZINC000428559971 857266168 /nfs/dbraw/zinc/26/61/68/857266168.db2.gz QWJOZGBMZWZRHM-JOCHJYFZSA-N 0 3 411.594 4.013 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N(C)[C@H](C)Cc3ccccc3OC)c(C)c2)CC1 ZINC000437573005 862893165 /nfs/dbraw/zinc/89/31/65/862893165.db2.gz XZDNJBPWQCGAQA-HXUWFJFHSA-N 0 3 424.589 4.240 20 0 HIADHN CC[C@H](c1ccc(Br)cc1)N1CCC([C@@H]2OCC[C@H]2C(=O)OC)CC1 ZINC000428727797 857311740 /nfs/dbraw/zinc/31/17/40/857311740.db2.gz ZFLXEQGBTOVAKZ-QRVBRYPASA-N 0 3 410.352 4.190 20 0 HIADHN COc1ccnc(CN(Cc2ccncc2)[C@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000428792816 857342980 /nfs/dbraw/zinc/34/29/80/857342980.db2.gz IJFPSJZAYREMMK-DEOSSOPVSA-N 0 3 402.542 4.152 20 0 HIADHN c1ccc(CN2CCC[C@@H](N(Cc3noc(C4CC4)n3)Cc3ccncc3)C2)cc1 ZINC000428802816 857350051 /nfs/dbraw/zinc/35/00/51/857350051.db2.gz KANGZPKXIWXDRL-JOCHJYFZSA-N 0 3 403.530 4.009 20 0 HIADHN CCCCc1nc(CN(Cc2ccncc2)[C@H]2CCCN(Cc3ccccc3)C2)no1 ZINC000428810359 857355331 /nfs/dbraw/zinc/35/53/31/857355331.db2.gz YBUVXLIWEMESQM-QHCPKHFHSA-N 0 3 419.573 4.474 20 0 HIADHN CCOc1cccc([C@H](C)NC(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)c1 ZINC000428834579 857365401 /nfs/dbraw/zinc/36/54/01/857365401.db2.gz NKEUKCIEJWJCKA-AQNXPRMDSA-N 0 3 417.594 4.067 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)NCC(C)(C)c3ccccc3F)CC2)C[C@H](C)O1 ZINC000428834806 857365471 /nfs/dbraw/zinc/36/54/71/857365471.db2.gz VWZBTQJRICWWAN-OALUTQOASA-N 0 3 419.585 4.024 20 0 HIADHN O=C(NCCNCc1ccc(C(F)(F)F)s1)c1cccc(Br)c1 ZINC000428861158 857375985 /nfs/dbraw/zinc/37/59/85/857375985.db2.gz JEQLYIZEFNTGIU-UHFFFAOYSA-N 0 3 407.255 4.049 20 0 HIADHN Fc1ccc2nc(CNC[C@H](c3cccc(Cl)c3)N3CCOCC3)sc2c1 ZINC000428889323 857393485 /nfs/dbraw/zinc/39/34/85/857393485.db2.gz QZSXDQQADIEUND-GOSISDBHSA-N 0 3 405.926 4.252 20 0 HIADHN CN(C)CCN(C)C(=O)Nc1cc(C(F)(F)F)ccc1SCC(F)(F)F ZINC000428892054 857395851 /nfs/dbraw/zinc/39/58/51/857395851.db2.gz KHNOUPNYASFFQT-UHFFFAOYSA-N 0 3 403.392 4.385 20 0 HIADHN CCSc1cc(Cl)ccc1C(=O)N(C)C[C@@]1(O)CCN(Cc2ccccc2)C1 ZINC000428955016 857433893 /nfs/dbraw/zinc/43/38/93/857433893.db2.gz SXMDDIXNLDJCGO-QFIPXVFZSA-N 0 3 418.990 4.161 20 0 HIADHN Cc1c2cc(F)ccc2sc1C(=O)N(C)C[C@@]1(O)CCN(Cc2ccccc2)C1 ZINC000428969153 857439922 /nfs/dbraw/zinc/43/99/22/857439922.db2.gz VBGUBDRZCSWVCB-QHCPKHFHSA-N 0 3 412.530 4.058 20 0 HIADHN CCc1noc(CC)c1CNC(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1 ZINC000428970024 857440415 /nfs/dbraw/zinc/44/04/15/857440415.db2.gz AABPWPXYLGXAJU-SFHVURJKSA-N 0 3 404.580 4.133 20 0 HIADHN CCN(C(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1)[C@H](C)Cc1ccsc1 ZINC000429040680 857470640 /nfs/dbraw/zinc/47/06/40/857470640.db2.gz IWKDDRSPZWBYBM-KNQAVFIVSA-N 0 3 415.603 4.002 20 0 HIADHN C[C@@H]1CCN(C(=O)NC[C@@H]2CN(Cc3ccccc3)CCCO2)[C@@H](c2ccco2)C1 ZINC000429044709 857472988 /nfs/dbraw/zinc/47/29/88/857472988.db2.gz RPIISRKATDDJBP-CEMLEFRQSA-N 0 3 411.546 4.053 20 0 HIADHN Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1NC(=O)N(C)CCN(C)C ZINC000429046581 857474641 /nfs/dbraw/zinc/47/46/41/857474641.db2.gz NVMGGIOWBFOBON-UHFFFAOYSA-N 0 3 422.451 4.291 20 0 HIADHN CCOc1ccc(NC(=O)NC[C@@H]2CN(Cc3ccccc3)CCCO2)cc1Cl ZINC000429046001 857474764 /nfs/dbraw/zinc/47/47/64/857474764.db2.gz UEZZRMAUCBAUQR-LJQANCHMSA-N 0 3 417.937 4.151 20 0 HIADHN CN(C)[C@@H](CNC(=O)N(C)[C@H](c1ccc(Cl)cc1)c1cnccn1)c1ccccc1 ZINC000429191378 857546474 /nfs/dbraw/zinc/54/64/74/857546474.db2.gz GOMWVMUYAPDNNY-FCHUYYIVSA-N 0 3 423.948 4.164 20 0 HIADHN CN(C)[C@H](CNC(=O)Nc1cccc(NC(=O)C2CCCCC2)c1)Cc1ccccc1 ZINC000429206048 857553928 /nfs/dbraw/zinc/55/39/28/857553928.db2.gz MZDRTKFJPWAQFG-QHCPKHFHSA-N 0 3 422.573 4.500 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)N[C@H](c3cccs3)C3CC3)CC2)C[C@@H](C)O1 ZINC000429210404 857556242 /nfs/dbraw/zinc/55/62/42/857556242.db2.gz YCIPOYIQWRAZFK-LZJOCLMNSA-N 0 3 405.608 4.120 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3ccccc3OC(F)F)CC2)C[C@@H](C)O1 ZINC000429210945 857556404 /nfs/dbraw/zinc/55/64/04/857556404.db2.gz VKTCJVVPQFZBLI-HZPDHXFCSA-N 0 3 411.493 4.031 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)Nc1cnccc1-c1ccccc1 ZINC000429227066 857564506 /nfs/dbraw/zinc/56/45/06/857564506.db2.gz CPOHNKHIUZBEMJ-UHFFFAOYSA-N 0 3 400.526 4.290 20 0 HIADHN CCCn1ccnc1CCCN(C)CC(=O)Nc1ccc(Cl)cc1C(F)(F)F ZINC000429238389 857569114 /nfs/dbraw/zinc/56/91/14/857569114.db2.gz NJHBDCNGTAIBEY-UHFFFAOYSA-N 0 3 416.875 4.468 20 0 HIADHN FC(F)(F)c1cc(Br)ccc1N1CCN(CC[C@H]2CCOC2)CC1 ZINC000437615550 862931368 /nfs/dbraw/zinc/93/13/68/862931368.db2.gz PPVLIKDKFIBNAU-ZDUSSCGKSA-N 0 3 407.274 4.017 20 0 HIADHN CC(=O)N1CCC(N(CCCOc2cc(C)ccc2C)Cc2cncs2)CC1 ZINC000429282184 857590700 /nfs/dbraw/zinc/59/07/00/857590700.db2.gz ZLSYYLSBUYFGKS-UHFFFAOYSA-N 0 3 401.576 4.042 20 0 HIADHN CSC[C@H]1CCCN(CC(=O)N(Cc2ccc(C(F)(F)F)cc2)C2CC2)C1 ZINC000429290737 857593739 /nfs/dbraw/zinc/59/37/39/857593739.db2.gz ZNGZPXOLDIPAIA-INIZCTEOSA-N 0 3 400.510 4.271 20 0 HIADHN Cc1nn(C)c(C)c1NC(=O)[C@@H](C)N[C@H]1c2cc(Br)ccc2CC1(C)C ZINC000429296942 857595077 /nfs/dbraw/zinc/59/50/77/857595077.db2.gz TVWHAKPWALLDNM-XIKOKIGWSA-N 0 3 419.367 4.040 20 0 HIADHN Cc1cc(C)c(-c2csc(NC(=O)CN[C@H]3Cc4cccc(O)c4C3)n2)c(C)c1 ZINC000429321234 857602369 /nfs/dbraw/zinc/60/23/69/857602369.db2.gz XHHODAVCTCHCTK-KRWDZBQOSA-N 0 3 407.539 4.136 20 0 HIADHN COC(=O)[C@H]1CCN(Cc2ncc(-c3ccccc3Br)o2)[C@H]1C(C)C ZINC000429391083 857638152 /nfs/dbraw/zinc/63/81/52/857638152.db2.gz BMODUERMKTYNBK-KSSFIOAISA-N 0 3 407.308 4.124 20 0 HIADHN Cn1ccc([C@H](NC[C@H]2CN(Cc3ccccc3)CCCO2)c2ccc(Cl)cc2)n1 ZINC000429413608 857653290 /nfs/dbraw/zinc/65/32/90/857653290.db2.gz VNLQVMLFXVZEKK-LADGPHEKSA-N 0 3 424.976 4.044 20 0 HIADHN C[C@H](NC[C@H](CO)Cc1ccccc1Br)c1nc2c(s1)CCCC2 ZINC000429415957 857654330 /nfs/dbraw/zinc/65/43/30/857654330.db2.gz JLVWTFPGXKXSSL-UONOGXRCSA-N 0 3 409.393 4.286 20 0 HIADHN O=C(c1cccc(CN[C@H](Cc2ccccc2F)c2ccccc2)c1)N1CCOCC1 ZINC000429421136 857657799 /nfs/dbraw/zinc/65/77/99/857657799.db2.gz DLZQNRRFRGJJSR-RUZDIDTESA-N 0 3 418.512 4.372 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)N(Cc2ccccc2)[C@@H]2CCCC2(C)C)CC1 ZINC000429426389 857661054 /nfs/dbraw/zinc/66/10/54/857661054.db2.gz FTXPBWSSCSUMKD-JTHBVZDNSA-N 0 3 414.638 4.051 20 0 HIADHN Cc1noc(C[C@H](N[C@H](C)c2ccc(NC(=O)NC3CC3)cc2)c2ccccc2)n1 ZINC000429474817 857687750 /nfs/dbraw/zinc/68/77/50/857687750.db2.gz RXALJQARXXZZOS-VFNWGFHPSA-N 0 3 405.502 4.297 20 0 HIADHN CC[C@H](NC(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1)c1ccc(F)cc1F ZINC000429486152 857690878 /nfs/dbraw/zinc/69/08/78/857690878.db2.gz DTNNTZKEMGFERU-YVHKJVDXSA-N 0 3 423.548 4.337 20 0 HIADHN CC(C)(C)[C@H](CN1CCc2ccccc2C1)NC(=O)N(Cc1cccnc1)C1CC1 ZINC000429496456 857697228 /nfs/dbraw/zinc/69/72/28/857697228.db2.gz VWVBXWYEJDYBJE-QHCPKHFHSA-N 0 3 406.574 4.229 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)NCC(C)(C)c3cccc(F)c3)CC2)C[C@H](C)O1 ZINC000429497047 857697874 /nfs/dbraw/zinc/69/78/74/857697874.db2.gz XBLWCWNOCGYUSG-KDURUIRLSA-N 0 3 419.585 4.024 20 0 HIADHN CCOc1cccc2[nH]cc(CC(=O)NC[C@@H](c3cccc(OC)c3)N3CCCC3)c21 ZINC000437622918 862942074 /nfs/dbraw/zinc/94/20/74/862942074.db2.gz FNJGVSGSOZXLKY-QFIPXVFZSA-N 0 3 421.541 4.071 20 0 HIADHN CCN(C(=O)Nc1cccc(N2CCN(CC)CC2)c1)[C@@H](C)Cc1ccsc1 ZINC000429564483 857752506 /nfs/dbraw/zinc/75/25/06/857752506.db2.gz FNDNEAMSMBSKFW-SFHVURJKSA-N 0 3 400.592 4.375 20 0 HIADHN CN(C(=O)Nc1ccnn1Cc1ccc(F)cc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000429573017 857758002 /nfs/dbraw/zinc/75/80/02/857758002.db2.gz XFGRSVVXCAUTFK-JOCHJYFZSA-N 0 3 421.520 4.199 20 0 HIADHN O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)Nc1ccc(-c2ccc[nH]2)cc1 ZINC000429622847 857802710 /nfs/dbraw/zinc/80/27/10/857802710.db2.gz GMGKJHDWFCDFJD-JOCHJYFZSA-N 0 3 404.514 4.094 20 0 HIADHN CCn1c2ccccc2nc1[C@@H]1CCCN1C[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000429677993 857831301 /nfs/dbraw/zinc/83/13/01/857831301.db2.gz MHUPCYWUXAJRRH-DHLKQENFSA-N 0 3 418.585 4.484 20 0 HIADHN Clc1ccc([C@H]2CN(C[C@@H]3CN(Cc4ccccc4)CCCO3)CCO2)cc1 ZINC000429720095 857850086 /nfs/dbraw/zinc/85/00/86/857850086.db2.gz DNYNVOKBFINTFW-XZOQPEGZSA-N 0 3 400.950 4.004 20 0 HIADHN Clc1ccc([C@H]2CN(C[C@H]3CN(Cc4ccccc4)CCCO3)CCO2)cc1 ZINC000429720092 857850144 /nfs/dbraw/zinc/85/01/44/857850144.db2.gz DNYNVOKBFINTFW-DHIUTWEWSA-N 0 3 400.950 4.004 20 0 HIADHN CC(C)Oc1ccc(F)cc1NC(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000429742641 857863988 /nfs/dbraw/zinc/86/39/88/857863988.db2.gz KURMFXUCSLSMGH-FQEVSTJZSA-N 0 3 415.509 4.026 20 0 HIADHN C[C@@H](C(=O)N(CCN(C)C)Cc1cccc(Cl)c1)[C@@H]1OCCc2sccc21 ZINC000429804523 857890705 /nfs/dbraw/zinc/89/07/05/857890705.db2.gz CZJSGNKRWLLUQW-QRWLVFNGSA-N 0 3 406.979 4.242 20 0 HIADHN CC1CCN(CCNC(=O)C(C)(C)c2csc(-c3c(F)cccc3F)n2)CC1 ZINC000429841964 857907443 /nfs/dbraw/zinc/90/74/43/857907443.db2.gz YLJIRDPWNUBPSN-UHFFFAOYSA-N 0 3 407.530 4.214 20 0 HIADHN COc1ccccc1-c1ncc(CN2CCC[C@H](c3ncc4n3CCCC4)C2)cn1 ZINC000430055610 858014081 /nfs/dbraw/zinc/01/40/81/858014081.db2.gz DOYJCFCAEDOOAJ-IBGZPJMESA-N 0 3 403.530 4.065 20 0 HIADHN COc1ccccc1-c1ncc(CN2CCC3(CC2)OCCc2ccsc23)cn1 ZINC000430060898 858016685 /nfs/dbraw/zinc/01/66/85/858016685.db2.gz ODZYVORGRSCTKQ-UHFFFAOYSA-N 0 3 407.539 4.278 20 0 HIADHN CCc1ccccc1NC(=O)C[C@H](C)N[C@H](CO)c1ccc(Br)c(F)c1 ZINC000430147571 858053215 /nfs/dbraw/zinc/05/32/15/858053215.db2.gz LQIDVGCCDASMEH-ORAYPTAESA-N 0 3 423.326 4.191 20 0 HIADHN COc1ccc(CC[C@H]2CCCCN2Cc2cnnn2Cc2ccccc2)cc1OC ZINC000430232146 858090866 /nfs/dbraw/zinc/09/08/66/858090866.db2.gz FHAGPOMVSUIUKD-JOCHJYFZSA-N 0 3 420.557 4.331 20 0 HIADHN COCc1cccc(OCC2(CN3C[C@H](C)O[C@]4(CCO[C@@H](C)C4)C3)CCC2)c1 ZINC000430257704 858098493 /nfs/dbraw/zinc/09/84/93/858098493.db2.gz MERHLKYOHHQYJF-SKPFHBQLSA-N 0 3 403.563 4.041 20 0 HIADHN CN(C(=O)[C@H]1CCN(Cc2ccc(Br)c3cccnc23)C1)c1ccccc1 ZINC000430290632 858110735 /nfs/dbraw/zinc/11/07/35/858110735.db2.gz CSSXMQJSKYVTDQ-KRWDZBQOSA-N 0 3 424.342 4.482 20 0 HIADHN CN(C(=O)[C@H]1CCN(Cc2ccc(OCc3ccccc3F)nc2)C1)c1ccccc1 ZINC000430294673 858111419 /nfs/dbraw/zinc/11/14/19/858111419.db2.gz BIUXJRNLEYWGDI-FQEVSTJZSA-N 0 3 419.500 4.285 20 0 HIADHN CCN1CCCN(C(=O)N[C@H](CC2CC2)c2cc(F)cc(Br)c2)CC1 ZINC000430302556 858114537 /nfs/dbraw/zinc/11/45/37/858114537.db2.gz LDWBFFJXVDSBIZ-GOSISDBHSA-N 0 3 412.347 4.167 20 0 HIADHN O=C(CCN(CCc1ccccn1)Cc1cccnc1)Nc1ccc(Cl)cc1F ZINC000430345253 858129267 /nfs/dbraw/zinc/12/92/67/858129267.db2.gz QPLFDTSYXZMVQB-UHFFFAOYSA-N 0 3 412.896 4.343 20 0 HIADHN C[C@H](N[C@H]1c2ccccc2CC[C@@H]1C)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000430694106 858271484 /nfs/dbraw/zinc/27/14/84/858271484.db2.gz IYWIXECIIYCMSX-WTOJCKNJSA-N 0 3 423.376 4.071 20 0 HIADHN C[C@@H](NCc1cccc2ccccc21)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000430709204 858275298 /nfs/dbraw/zinc/27/52/98/858275298.db2.gz WQTSWVBFGLHKCA-CYBMUJFWSA-N 0 3 419.344 4.101 20 0 HIADHN Cc1cccc([C@H](C)N[C@H](C)c2ccc(Br)c(S(N)(=O)=O)c2)c1C ZINC000430719956 858278013 /nfs/dbraw/zinc/27/80/13/858278013.db2.gz LIVLBEYBFMUSQC-KGLIPLIRSA-N 0 3 411.365 4.125 20 0 HIADHN C[C@H]1[C@@H](c2ccccc2)[C@H]1C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000430828480 858320147 /nfs/dbraw/zinc/32/01/47/858320147.db2.gz TXNYMBFBNJOTQD-ZKZIVCHGSA-N 0 3 400.526 4.318 20 0 HIADHN CC[C@@H](c1ccccc1)N1CC(=O)N(C[C@H](c2ccc(OC)cc2)N2CCCC2)C1=O ZINC000430980824 858390015 /nfs/dbraw/zinc/39/00/15/858390015.db2.gz UOSRAFIIFKXNLZ-XZOQPEGZSA-N 0 3 421.541 4.248 20 0 HIADHN CN1C(=O)N([C@@H]2CCN(Cc3ccccc3)C2)C(=O)[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000430981117 858391056 /nfs/dbraw/zinc/39/10/56/858391056.db2.gz WCODOKHNUSGTLD-VQIMIIECSA-N 0 3 418.324 4.203 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](N2C(=O)N[C@H](Cc3cccc4ccccc43)C2=O)C1 ZINC000431042451 858415033 /nfs/dbraw/zinc/41/50/33/858415033.db2.gz HSMYFEWCEGRKQR-IHLLOCCUSA-N 0 3 413.521 4.138 20 0 HIADHN Cc1c(C(=O)N[C@@H]2CCN(Cc3ccccc3)[C@@H](C)C2)[nH]c2c1C(=O)CC(C)(C)C2 ZINC000431053395 858421619 /nfs/dbraw/zinc/42/16/19/858421619.db2.gz NEFAWQZZRZWMRQ-QFBILLFUSA-N 0 3 407.558 4.261 20 0 HIADHN CN(C[C@@H](O)COCC(F)(F)F)[C@H](c1ccc(F)cc1)c1ccc(Cl)cc1 ZINC000431125955 858457855 /nfs/dbraw/zinc/45/78/55/858457855.db2.gz DRSNCQVBKBXFJB-MSOLQXFVSA-N 0 3 405.819 4.440 20 0 HIADHN C[C@@H]1CCN(C(=O)Nc2ccc(NC(=O)C3CC3)cc2)CCN1Cc1ccccc1 ZINC000437684275 863025227 /nfs/dbraw/zinc/02/52/27/863025227.db2.gz FLGPXDFRJRVFFH-GOSISDBHSA-N 0 3 406.530 4.163 20 0 HIADHN Cc1ccc([C@H](OC[C@@H](O)CN2CC[C@@H](Oc3ccncc3)C2)c2ccccc2)cc1 ZINC000431129370 858459440 /nfs/dbraw/zinc/45/94/40/858459440.db2.gz PYFLXZOABLCDIG-SKBVVQJISA-N 0 3 418.537 4.010 20 0 HIADHN COc1cnccc1N1CCN(C(=O)Nc2ccc3c(c2)Cc2ccccc2-3)CC1 ZINC000431440857 858617008 /nfs/dbraw/zinc/61/70/08/858617008.db2.gz MUSDQUBVNFXKBU-UHFFFAOYSA-N 0 3 400.482 4.016 20 0 HIADHN C[C@H]1CCc2c(F)cccc2[C@H]1NC(=O)N(C)C1CCN(CCc2ccccn2)CC1 ZINC000431740377 858778698 /nfs/dbraw/zinc/77/86/98/858778698.db2.gz GWSIWNSBYJJOCL-UUOWRZLLSA-N 0 3 424.564 4.193 20 0 HIADHN CN(C)c1cccc(CN(C)C(=O)Nc2ccc(CCN3CCSCC3)cc2)c1 ZINC000431874473 858850540 /nfs/dbraw/zinc/85/05/40/858850540.db2.gz DFVVRISPIWYZEW-UHFFFAOYSA-N 0 3 412.603 4.008 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NC(C)(C)c1ncc(C)s1)c1cccc(OC)c1 ZINC000431876402 858851384 /nfs/dbraw/zinc/85/13/84/858851384.db2.gz VORVGBXDLUYKSS-GOSISDBHSA-N 0 3 404.580 4.078 20 0 HIADHN COc1ccc(NC(=O)[C@@H]2CCCCN2C2CCCC2)cc1OCc1cccnc1 ZINC000431901892 858862605 /nfs/dbraw/zinc/86/26/05/858862605.db2.gz MWFCTKRSEZJKTF-NRFANRHFSA-N 0 3 409.530 4.405 20 0 HIADHN COc1cnccc1N1CCN(C(=O)Nc2ccc3c(ccn3CC(C)C)c2)CC1 ZINC000432033882 858942210 /nfs/dbraw/zinc/94/22/10/858942210.db2.gz QGCNDDGQVRHGRK-UHFFFAOYSA-N 0 3 407.518 4.055 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(N(CC[NH+](CC)CC)Cc3cccs3)nc2)n1 ZINC000432048645 858950041 /nfs/dbraw/zinc/95/00/41/858950041.db2.gz RMMAGGUSCDDSLD-UHFFFAOYSA-N 0 3 411.575 4.217 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)C1(Cc2cccc(F)c2)CCOCC1 ZINC000432064314 858962342 /nfs/dbraw/zinc/96/23/42/858962342.db2.gz UWRMCRWQVDLFLK-HSZRJFAPSA-N 0 3 410.533 4.118 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N2CCCC[C@@H]2c2ccc(F)cc2F)CC1 ZINC000432449610 859169740 /nfs/dbraw/zinc/16/97/40/859169740.db2.gz SICBSYJCSLKJFS-OAQYLSRUSA-N 0 3 409.521 4.091 20 0 HIADHN O=C(NCC[C@@H](c1ccccc1)C(F)(F)F)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000432470917 859180418 /nfs/dbraw/zinc/18/04/18/859180418.db2.gz VVHXHGZNGFBGQT-UXHICEINSA-N 0 3 405.464 4.296 20 0 HIADHN O=C(Nc1ccc(Cc2nc3ccccc3s2)cc1)[C@H]1CCCN1C1CCOCC1 ZINC000432593978 859245568 /nfs/dbraw/zinc/24/55/68/859245568.db2.gz RHVNFRJKVSTXDR-OAQYLSRUSA-N 0 3 421.566 4.469 20 0 HIADHN FC(F)(F)c1ccc(CN2CCC[C@@H](CN3CCN(c4ccccn4)CC3)C2)s1 ZINC000432737595 859327619 /nfs/dbraw/zinc/32/76/19/859327619.db2.gz LRLWUDHJWBRVEH-KRWDZBQOSA-N 0 3 424.536 4.196 20 0 HIADHN CN(CCCNC(=O)C1CCC1)Cc1cc(Br)cc(C(F)(F)F)c1 ZINC000432796481 859365154 /nfs/dbraw/zinc/36/51/54/859365154.db2.gz AOOVSLYCLGTDEC-UHFFFAOYSA-N 0 3 407.274 4.206 20 0 HIADHN Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)N(C)C[C@@H](O)COCC(F)(F)F ZINC000432818205 859373246 /nfs/dbraw/zinc/37/32/46/859373246.db2.gz JMILCWKUYYLIIT-GDBMZVCRSA-N 0 3 402.482 4.360 20 0 HIADHN CN(C)[C@H]1CCOc2c(Nc3cc(C(F)(F)F)nc(-c4cccnc4)n3)cccc21 ZINC000432945628 859441615 /nfs/dbraw/zinc/44/16/15/859441615.db2.gz TYLHXJSOHDDVPI-INIZCTEOSA-N 0 3 415.419 4.686 20 0 HIADHN CCc1nc(-c2ccc(C(=O)N(CC)[C@H]3CCN([C@@H](C)c4ccccc4)C3)cc2)n[nH]1 ZINC000433018342 859481107 /nfs/dbraw/zinc/48/11/07/859481107.db2.gz DMYQGSJRUVFHII-AVRDEDQJSA-N 0 3 417.557 4.332 20 0 HIADHN C[C@@H](SCCN(C)Cc1ccccc1)C(=O)Nc1ccc(N2CCCC2=O)cc1 ZINC000433033389 859490468 /nfs/dbraw/zinc/49/04/68/859490468.db2.gz PLVUUDJMTYBKPT-GOSISDBHSA-N 0 3 411.571 4.006 20 0 HIADHN COc1cc(OC)c(NC(=O)CSCCN(C)Cc2ccccc2)cc1Cl ZINC000433032777 859491068 /nfs/dbraw/zinc/49/10/68/859491068.db2.gz NHOVYEBXTRHKQK-UHFFFAOYSA-N 0 3 408.951 4.161 20 0 HIADHN C[C@@H]1CCN(C(=O)NCCC2CC(OC(C)(C)C)C2)CCN1Cc1ccccc1 ZINC000433041308 859495866 /nfs/dbraw/zinc/49/58/66/859495866.db2.gz CBBYKFYLFSHOEC-JSRJAPPDSA-N 0 3 401.595 4.276 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)c2cncc(-c3ccc(Cl)cc3)c2)C[C@H](C)O1 ZINC000467629982 881428882 /nfs/dbraw/zinc/42/88/82/881428882.db2.gz OHZNIUOONKRTJZ-CALCHBBNSA-N 0 3 401.938 4.021 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N(C)Cc3ccc(F)c(Cl)c3)c2)CC1 ZINC000433100498 859521856 /nfs/dbraw/zinc/52/18/56/859521856.db2.gz BOHOBKOWUAPKJO-UHFFFAOYSA-N 0 3 404.917 4.285 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)Cc1c[nH]c2cccc(Cl)c12 ZINC000433101231 859521890 /nfs/dbraw/zinc/52/18/90/859521890.db2.gz DFSKNWPCYOXXOK-UHFFFAOYSA-N 0 3 405.876 4.232 20 0 HIADHN COc1ccccc1-c1noc(C2CCN(CCCC(=O)OC(C)(C)C)CC2)n1 ZINC000433128956 859532323 /nfs/dbraw/zinc/53/23/23/859532323.db2.gz CCOSAVWULNNPBR-UHFFFAOYSA-N 0 3 401.507 4.047 20 0 HIADHN Cc1cnc(C2CCN(C[C@@H](O)COc3cccc(C(F)(F)F)c3)CC2)s1 ZINC000433161370 859547252 /nfs/dbraw/zinc/54/72/52/859547252.db2.gz QYBBJTBTLOMYQR-MRXNPFEDSA-N 0 3 400.466 4.090 20 0 HIADHN COc1cc(C[NH2+]C[C@@H]2CCCN(c3ccccc3)C2)cc(Br)c1[O-] ZINC000433200073 859564953 /nfs/dbraw/zinc/56/49/53/859564953.db2.gz OCKDEVMLOHTQPB-HNNXBMFYSA-N 0 3 405.336 4.170 20 0 HIADHN C[C@H](NCc1cccc(-n2cncn2)c1)c1ccc(OC[C@@H]2CCCCO2)c(F)c1 ZINC000433385922 859668785 /nfs/dbraw/zinc/66/87/85/859668785.db2.gz GWGPAWMQRZPQIM-UWJYYQICSA-N 0 3 410.493 4.205 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)NCCC1CC(OC(C)(C)C)C1 ZINC000433473942 859719766 /nfs/dbraw/zinc/71/97/66/859719766.db2.gz ZKUHNYJAFLUSFE-UHFFFAOYSA-N 0 3 411.537 4.022 20 0 HIADHN Cc1cc(CCC(=O)N(Cc2ccco2)C2CCN(C)CC2)ccc1Br ZINC000433519898 859751085 /nfs/dbraw/zinc/75/10/85/859751085.db2.gz XHJKYTWHCNCMLJ-UHFFFAOYSA-N 0 3 419.363 4.406 20 0 HIADHN O=C(NCc1cccc(COCc2ccccc2)c1)NC[C@H]1CCCCN1C1CC1 ZINC000433552476 859771598 /nfs/dbraw/zinc/77/15/98/859771598.db2.gz DPUJGBPGDHXCJF-XMMPIXPASA-N 0 3 407.558 4.220 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)N[C@@H](c1cc(F)ccc1F)C(F)F ZINC000433617762 859812308 /nfs/dbraw/zinc/81/23/08/859812308.db2.gz OOZVVADGEHJXOR-OALUTQOASA-N 0 3 409.427 4.407 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N[C@H](c2cc(F)ccc2F)C(F)F)C1 ZINC000433628209 859816623 /nfs/dbraw/zinc/81/66/23/859816623.db2.gz JIDRDSWPVKHZQU-VVFCZOMOSA-N 0 3 409.427 4.406 20 0 HIADHN CN(C(=O)N[C@H](c1cc(F)ccc1F)C(F)F)[C@H]1CCN(Cc2ccccc2)C1 ZINC000433657118 859826655 /nfs/dbraw/zinc/82/66/55/859826655.db2.gz UDAZOKUNNDDDHM-QFBILLFUSA-N 0 3 409.427 4.187 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)c2ccc(C(C)(C)C(F)(F)F)cc2)C[C@H](C)O1 ZINC000433708487 859846997 /nfs/dbraw/zinc/84/69/97/859846997.db2.gz ISCUVCAKIKWYNO-IYBDPMFKSA-N 0 3 400.485 4.146 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)Cc2cc(Br)ccc2F)C1 ZINC000433718489 859851669 /nfs/dbraw/zinc/85/16/69/859851669.db2.gz NCVLAKHLMZXZKL-KSSFIOAISA-N 0 3 405.311 4.082 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(Cl)cc2)CC1)[C@@H]1CCCc2sccc21 ZINC000433762640 859882434 /nfs/dbraw/zinc/88/24/34/859882434.db2.gz QZMYXUDAOZIPPR-HXUWFJFHSA-N 0 3 418.990 4.481 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1ccc(F)cc1-c1cnn(C)c1 ZINC000433788411 859893344 /nfs/dbraw/zinc/89/33/44/859893344.db2.gz FRIFJPJVLIARPC-GOSISDBHSA-N 0 3 421.520 4.355 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)Nc3ccc(-c4csc(C(F)(F)F)n4)cc3)[C@H]2C1 ZINC000433794676 859895983 /nfs/dbraw/zinc/89/59/83/859895983.db2.gz ZIELZGXHMNSFPD-CJNGLKHVSA-N 0 3 410.465 4.387 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1noc2c1C[C@@H](C)CC2 ZINC000433865196 859942111 /nfs/dbraw/zinc/94/21/11/859942111.db2.gz OPKIHYJNSTZOOA-QFBILLFUSA-N 0 3 419.529 4.004 20 0 HIADHN C[C@H]1C[C@H](NC(=O)c2ccccc2NCc2cccnc2)CN1Cc1ccccc1 ZINC000467688693 881481287 /nfs/dbraw/zinc/48/12/87/881481287.db2.gz MUFNQCPVOGWFKI-UGKGYDQZSA-N 0 3 400.526 4.087 20 0 HIADHN CC(C)n1nc(-c2ccco2)cc1NC(=O)NCC1(N2CCSCC2)CCCC1 ZINC000433909026 859963281 /nfs/dbraw/zinc/96/32/81/859963281.db2.gz QTCOJJTZXPGKRG-UHFFFAOYSA-N 0 3 417.579 4.207 20 0 HIADHN Cc1c(NC(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)noc1-c1ccccc1F ZINC000433921964 859973813 /nfs/dbraw/zinc/97/38/13/859973813.db2.gz KNKMHTXVAWOXBR-FUHWJXTLSA-N 0 3 408.477 4.746 20 0 HIADHN C[C@H](NC(=O)NC[C@@H]1CCCCN1C1CC1)c1cccc(NC(=O)c2ccccc2)c1 ZINC000433940182 859988277 /nfs/dbraw/zinc/98/82/77/859988277.db2.gz KDTYMPDCINCUFM-MBSDFSHPSA-N 0 3 420.557 4.316 20 0 HIADHN O=C(NC[C@H]1CCCCN1C1CC1)N[C@H](Cc1ccc(Cl)cc1)c1ccccn1 ZINC000433951728 859998041 /nfs/dbraw/zinc/99/80/41/859998041.db2.gz BPVNGRARWHPKLJ-IFMALSPDSA-N 0 3 412.965 4.335 20 0 HIADHN O=C(NC[C@H]1CCCCN1C1CC1)N1CCC[C@@H](c2nc(C(F)(F)F)cs2)C1 ZINC000433955526 860001042 /nfs/dbraw/zinc/00/10/42/860001042.db2.gz ONQKQZDLIUHYKP-UKRRQHHQSA-N 0 3 416.513 4.068 20 0 HIADHN CC(C)CC(=O)Nc1ccc(C(=O)N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)cc1F ZINC000467694410 881488784 /nfs/dbraw/zinc/48/87/84/881488784.db2.gz AABQUPMOOBBDQW-PXNSSMCTSA-N 0 3 411.521 4.203 20 0 HIADHN C[C@H]1C[C@H](NC(=O)COc2ccc(Oc3ccccn3)cc2)CN1Cc1ccccc1 ZINC000467698883 881494300 /nfs/dbraw/zinc/49/43/00/881494300.db2.gz CGVXYEGPOVVNFR-FPOVZHCZSA-N 0 3 417.509 4.032 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)Nc1cccc(-c2noc(C3CC3)n2)c1 ZINC000434056083 860068095 /nfs/dbraw/zinc/06/80/95/860068095.db2.gz COIUFQCEXCXKGO-UHFFFAOYSA-N 0 3 423.492 4.349 20 0 HIADHN CCn1nccc1C1CCN(C(=O)NC[C@@H](c2ccccc2)N2CCC(C)CC2)CC1 ZINC000434268265 860242393 /nfs/dbraw/zinc/24/23/93/860242393.db2.gz HZAPSUXPZOYAAL-DEOSSOPVSA-N 0 3 423.605 4.265 20 0 HIADHN CCn1nc(C(C)C)cc1C(=O)Nc1c(C)cnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000434322008 860282145 /nfs/dbraw/zinc/28/21/45/860282145.db2.gz ATHNQVMQJLUSGS-HXUWFJFHSA-N 0 3 420.561 4.231 20 0 HIADHN COc1ccc(C(=O)Nc2c(C)cnn2[C@@H]2CCN(Cc3ccccc3)C2)cc1F ZINC000434329608 860291120 /nfs/dbraw/zinc/29/11/20/860291120.db2.gz AWCQUQQGVATOLD-LJQANCHMSA-N 0 3 408.477 4.039 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)Cn1ccc2ccccc21 ZINC000434334744 860296052 /nfs/dbraw/zinc/29/60/52/860296052.db2.gz RXKQGZURNXPQSY-JOCHJYFZSA-N 0 3 413.525 4.232 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)Cn1ccc2ccccc21 ZINC000434334745 860296444 /nfs/dbraw/zinc/29/64/44/860296444.db2.gz RXKQGZURNXPQSY-QFIPXVFZSA-N 0 3 413.525 4.232 20 0 HIADHN COc1cccc(CCC(=O)Nc2c(C)cnn2[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000434413548 860339805 /nfs/dbraw/zinc/33/98/05/860339805.db2.gz UOWJKRRPHPGANM-JOCHJYFZSA-N 0 3 418.541 4.218 20 0 HIADHN Cc1cccc(-c2nnc(-c3ccc(C(=O)NC[C@H]4CCCCN4C4CC4)cc3)o2)c1 ZINC000434425351 860343956 /nfs/dbraw/zinc/34/39/56/860343956.db2.gz OEZPZJOQMCKBLJ-JOCHJYFZSA-N 0 3 416.525 4.459 20 0 HIADHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(-c2nnc(-c3ccc(C)cc3)o2)cc1 ZINC000434503759 860376638 /nfs/dbraw/zinc/37/66/38/860376638.db2.gz JJEDDCPTMQILQP-YADHBBJMSA-N 0 3 416.525 4.411 20 0 HIADHN CC[C@H](Nc1ccccc1)C(=O)Nc1c(C)cnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000434552729 860397928 /nfs/dbraw/zinc/39/79/28/860397928.db2.gz YLCKBCJWFUTCNC-GOTSBHOMSA-N 0 3 417.557 4.468 20 0 HIADHN C[C@H](c1ccc(Cl)cc1)N(C)C(=O)CN1CCC(c2ncc3n2CCCC3)CC1 ZINC000434686262 860460959 /nfs/dbraw/zinc/46/09/59/860460959.db2.gz SCGWEONYYOJHLV-QGZVFWFLSA-N 0 3 414.981 4.272 20 0 HIADHN Cc1ccc(F)c(N2CCC[C@H](N3CCC(c4ncc5n4CCCC5)CC3)C2=O)c1 ZINC000434689965 860463030 /nfs/dbraw/zinc/46/30/30/860463030.db2.gz YIOBLKZKWQKWLO-NRFANRHFSA-N 0 3 410.537 4.042 20 0 HIADHN Cc1ccc([C@@]2(C)CCN(CC(=O)N3CCC(OCc4ccccc4)CC3)C2)cc1 ZINC000434738901 860477349 /nfs/dbraw/zinc/47/73/49/860477349.db2.gz SRESVIAENJPXIT-SANMLTNESA-N 0 3 406.570 4.166 20 0 HIADHN O[C@@H](COc1cc(Cl)ccc1Cl)CN1CCC(c2ncc3n2CCCC3)CC1 ZINC000434752672 860481935 /nfs/dbraw/zinc/48/19/35/860481935.db2.gz CLKYKMLEUINUAC-GOSISDBHSA-N 0 3 424.372 4.146 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)CCCCc2nc3ccccc3s2)C[C@H](C)O1 ZINC000434764871 860487174 /nfs/dbraw/zinc/48/71/74/860487174.db2.gz PJZJTCWEXMZDFG-HDICACEKSA-N 0 3 403.592 4.015 20 0 HIADHN FC(F)Oc1c(Br)cccc1CNCCOCC(F)(F)C(F)F ZINC000434789734 860494636 /nfs/dbraw/zinc/49/46/36/860494636.db2.gz NRTPNXBOXSJXRZ-UHFFFAOYSA-N 0 3 410.152 4.057 20 0 HIADHN COc1cc(-c2nnc(CN3CC[C@@H](c4ccccc4)[C@H]3C)o2)cc(OC)c1OC ZINC000434893718 860540574 /nfs/dbraw/zinc/54/05/74/860540574.db2.gz CSGBHOWCVDROEZ-CRAIPNDOSA-N 0 3 409.486 4.140 20 0 HIADHN C[C@@H]1[C@H](c2ccccc2)CCN1CC(=O)Nc1cccc(CN2CCSCC2)c1 ZINC000434897596 860542371 /nfs/dbraw/zinc/54/23/71/860542371.db2.gz XAFHRNJJXBRJNR-AUSIDOKSSA-N 0 3 409.599 4.052 20 0 HIADHN O[C@@H](COc1cccc(C(F)(F)F)c1)CN1CCC(OCC2CCCC2)CC1 ZINC000434907554 860549907 /nfs/dbraw/zinc/54/99/07/860549907.db2.gz YEWVNWKZUOBCPQ-GOSISDBHSA-N 0 3 401.469 4.116 20 0 HIADHN CC(=O)Nc1ccc(CN2CCC(Nc3cccc(Br)c3)CC2)cc1 ZINC000435036348 860609207 /nfs/dbraw/zinc/60/92/07/860609207.db2.gz SRGWLOYWHCMEDO-UHFFFAOYSA-N 0 3 402.336 4.484 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)CCc3ccc(Cl)c(OC)c3)c(C)c2)CC1 ZINC000435034957 860609624 /nfs/dbraw/zinc/60/96/24/860609624.db2.gz PBNJQQLFFXOCSQ-UHFFFAOYSA-N 0 3 415.965 4.370 20 0 HIADHN COc1cc(CCC(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)ccc1Cl ZINC000435086000 860635304 /nfs/dbraw/zinc/63/53/04/860635304.db2.gz SIGAIUROUKMWJF-SFHVURJKSA-N 0 3 400.950 4.404 20 0 HIADHN O=C(C1CCN(Cc2ccc(-c3cc[nH]n3)o2)CC1)N(Cc1ccccc1)C1CC1 ZINC000435130410 860655403 /nfs/dbraw/zinc/65/54/03/860655403.db2.gz ROVVQQXMTYLWJY-UHFFFAOYSA-N 0 3 404.514 4.073 20 0 HIADHN Cc1cc(NC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)n(Cc2ccccc2)n1 ZINC000435151379 860666610 /nfs/dbraw/zinc/66/66/10/860666610.db2.gz XQXITENUURHNLE-NRFANRHFSA-N 0 3 417.557 4.368 20 0 HIADHN COc1cnccc1N1CCN(C(=O)Nc2cc3sc(C)nc3cc2Cl)CC1 ZINC000435181058 860682676 /nfs/dbraw/zinc/68/26/76/860682676.db2.gz CZXDFMNVLLHGDN-UHFFFAOYSA-N 0 3 417.922 4.016 20 0 HIADHN Cc1cc(NC(=O)CCc2cccc(F)c2F)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435272924 860711291 /nfs/dbraw/zinc/71/12/91/860711291.db2.gz UPTFQSHPQVZTCC-HXUWFJFHSA-N 0 3 424.495 4.488 20 0 HIADHN Cc1cc(NC(=O)C2(c3ccc(F)cc3)CC2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435273348 860711847 /nfs/dbraw/zinc/71/18/47/860711847.db2.gz YRENLPICAFOVNC-QFIPXVFZSA-N 0 3 418.516 4.448 20 0 HIADHN Cc1cc(NC(=O)CCOc2ccccc2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435277554 860713950 /nfs/dbraw/zinc/71/39/50/860713950.db2.gz DBMCFVPGSUYDGB-NRFANRHFSA-N 0 3 404.514 4.046 20 0 HIADHN Cc1cc(NC(=O)[C@@H](C)COc2ccccc2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435277048 860714030 /nfs/dbraw/zinc/71/40/30/860714030.db2.gz IKPKWIZSQZYPAR-UGKGYDQZSA-N 0 3 418.541 4.292 20 0 HIADHN Cc1cc(NC(=O)[C@@H]2Cc3ccccc3S2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435277318 860714564 /nfs/dbraw/zinc/71/45/64/860714564.db2.gz BGMIEZLVXMFSMI-UNMCSNQZSA-N 0 3 418.566 4.294 20 0 HIADHN COCc1ccc(C(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000435285004 860719291 /nfs/dbraw/zinc/71/92/91/860719291.db2.gz MSSNQVBXPKKSSA-JOCHJYFZSA-N 0 3 404.514 4.037 20 0 HIADHN Cc1cc(NC(=O)C2(c3cccc(F)c3)CC2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435288555 860720019 /nfs/dbraw/zinc/72/00/19/860720019.db2.gz DBYVZUWYFAFMMN-JOCHJYFZSA-N 0 3 418.516 4.448 20 0 HIADHN Cc1cc(NC(=O)[C@@H]2CSc3ccccc32)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435290706 860721521 /nfs/dbraw/zinc/72/15/21/860721521.db2.gz LHJXQXVZJXMDBH-PZJWPPBQSA-N 0 3 418.566 4.467 20 0 HIADHN Cc1cc(NC(=O)c2cc(C)c(F)cc2F)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435297290 860725799 /nfs/dbraw/zinc/72/57/99/860725799.db2.gz JMIVQIJJJQXBPY-GOSISDBHSA-N 0 3 410.468 4.477 20 0 HIADHN Cc1cc(NC(=O)CCc2cc(F)ccc2F)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435299628 860726478 /nfs/dbraw/zinc/72/64/78/860726478.db2.gz PWHHMUWZQFGVFE-NRFANRHFSA-N 0 3 424.495 4.488 20 0 HIADHN COc1cc(CCC(=O)N(Cc2ccccc2)C2CCN(C)CC2)ccc1Cl ZINC000435341531 860749047 /nfs/dbraw/zinc/74/90/47/860749047.db2.gz YJOIRXUKZRFORE-UHFFFAOYSA-N 0 3 400.950 4.404 20 0 HIADHN CCOc1ccc(CCC(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000435364577 860763412 /nfs/dbraw/zinc/76/34/12/860763412.db2.gz CRSOBAGBMHLCMN-JOCHJYFZSA-N 0 3 418.541 4.300 20 0 HIADHN CCO[C@H](CC(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)C1=CCCC1 ZINC000435368391 860766204 /nfs/dbraw/zinc/76/62/04/860766204.db2.gz HUWLRYRSTIBEAG-FGZHOGPDSA-N 0 3 408.546 4.174 20 0 HIADHN COc1ccc(Cl)cc1C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435368519 860766267 /nfs/dbraw/zinc/76/62/67/860766267.db2.gz IMFGSDVDGJSNHF-GOSISDBHSA-N 0 3 410.905 4.244 20 0 HIADHN O=C(Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)c1cc(-c2ccccc2)no1 ZINC000435371278 860769275 /nfs/dbraw/zinc/76/92/75/860769275.db2.gz UBLMRHKXLGTKHQ-FQEVSTJZSA-N 0 3 413.481 4.237 20 0 HIADHN O=C(Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)c1cc(-c2ccccc2)on1 ZINC000435371895 860769416 /nfs/dbraw/zinc/76/94/16/860769416.db2.gz XXRSOTYHUAJVGO-FQEVSTJZSA-N 0 3 413.481 4.237 20 0 HIADHN CCC(CC)n1nccc1C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435372295 860770375 /nfs/dbraw/zinc/77/03/75/860770375.db2.gz JLRDOOLUFCKIQO-HXUWFJFHSA-N 0 3 406.534 4.140 20 0 HIADHN Cc1cccc(C)c1OCCC(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435373131 860770740 /nfs/dbraw/zinc/77/07/40/860770740.db2.gz MELANKBGDXOJTO-QFIPXVFZSA-N 0 3 418.541 4.355 20 0 HIADHN Cc1ccc(CC(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)c(Cl)c1 ZINC000435374073 860771848 /nfs/dbraw/zinc/77/18/48/860771848.db2.gz HDIHIORXRHCXBN-FQEVSTJZSA-N 0 3 408.933 4.473 20 0 HIADHN COc1ccc(CCC(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)cc1F ZINC000435374210 860772998 /nfs/dbraw/zinc/77/29/98/860772998.db2.gz WUOIDEQYKAJPOY-HXUWFJFHSA-N 0 3 422.504 4.049 20 0 HIADHN O=C(Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)[C@H]1CCCc2sccc21 ZINC000435377397 860775219 /nfs/dbraw/zinc/77/52/19/860775219.db2.gz BCVSLUDLJFDVLR-ICSRJNTNSA-N 0 3 406.555 4.450 20 0 HIADHN O=C(Cc1coc2cc(F)ccc12)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435379882 860776172 /nfs/dbraw/zinc/77/61/72/860776172.db2.gz KZDDRONCUAJDCZ-HXUWFJFHSA-N 0 3 418.472 4.397 20 0 HIADHN CCC(=O)c1ccc(C(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000435381075 860776773 /nfs/dbraw/zinc/77/67/73/860776773.db2.gz VBZCLHWWXZSYFM-OAQYLSRUSA-N 0 3 402.498 4.175 20 0 HIADHN Cc1cc(NC(=O)N(C)CCc2ccccc2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435510302 860828989 /nfs/dbraw/zinc/82/89/89/860828989.db2.gz GXLGCEDOBKWNAB-HSZRJFAPSA-N 0 3 417.557 4.345 20 0 HIADHN Cc1cc(NC(=O)N(C)CCc2ccccc2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435510303 860829262 /nfs/dbraw/zinc/82/92/62/860829262.db2.gz GXLGCEDOBKWNAB-QHCPKHFHSA-N 0 3 417.557 4.345 20 0 HIADHN Cc1cc(NC(=O)N[C@@H](C)c2csc(C)n2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435514871 860833040 /nfs/dbraw/zinc/83/30/40/860833040.db2.gz DGNCDVHPIVEZOM-QFBILLFUSA-N 0 3 424.574 4.286 20 0 HIADHN Cc1cc(NC(=O)NCc2ccccc2F)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435516558 860834199 /nfs/dbraw/zinc/83/41/99/860834199.db2.gz MJRLCYBVEZGOSJ-HXUWFJFHSA-N 0 3 407.493 4.099 20 0 HIADHN Cc1cc(NC(=O)N[C@@H]2CCCC(F)(F)C2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435518886 860836654 /nfs/dbraw/zinc/83/66/54/860836654.db2.gz WILYPLMATYMILW-MOPGFXCFSA-N 0 3 417.504 4.338 20 0 HIADHN CC[C@@H](NC(=O)Nc1cc(C)nn1[C@H]1CCN(Cc2ccccc2)C1)c1nccs1 ZINC000435520898 860838753 /nfs/dbraw/zinc/83/87/53/860838753.db2.gz FFDHICDQZBUWTP-RBUKOAKNSA-N 0 3 424.574 4.368 20 0 HIADHN Cc1cc(NC(=O)N(C)[C@@H](C)c2ccncc2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435521788 860839052 /nfs/dbraw/zinc/83/90/52/860839052.db2.gz YBECLMSXJGYVLU-SIKLNZKXSA-N 0 3 418.545 4.258 20 0 HIADHN Cc1cc(NC(=O)NCCc2cccc(F)c2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435533695 860849635 /nfs/dbraw/zinc/84/96/35/860849635.db2.gz KBYXJFYYZICSJT-JOCHJYFZSA-N 0 3 421.520 4.142 20 0 HIADHN Cc1cc(NC(=O)NCCc2ccc(F)cc2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435533796 860849810 /nfs/dbraw/zinc/84/98/10/860849810.db2.gz KPLLOSSUTUORTO-QFIPXVFZSA-N 0 3 421.520 4.142 20 0 HIADHN Cc1c(NC(=O)N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)cnn1-c1ccccc1F ZINC000435544006 860858524 /nfs/dbraw/zinc/85/85/24/860858524.db2.gz BTTARLKJOWBTOI-APWZRJJASA-N 0 3 407.493 4.104 20 0 HIADHN Cc1c(NC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)cnn1-c1ccccc1F ZINC000435560786 860881499 /nfs/dbraw/zinc/88/14/99/860881499.db2.gz XTRLJMIGQYSFHF-IBGZPJMESA-N 0 3 407.493 4.106 20 0 HIADHN COc1cc(OC)c(NC(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)cc1Cl ZINC000467773508 881593360 /nfs/dbraw/zinc/59/33/60/881593360.db2.gz RXYZHZKCLHFIET-QGZVFWFLSA-N 0 3 417.937 4.486 20 0 HIADHN O=C(Nc1ccc(F)cc1)[C@H](N[C@H]1CC[C@@H](C(=O)N2CCCCC2)C1)c1ccccc1 ZINC000435784314 861058905 /nfs/dbraw/zinc/05/89/05/861058905.db2.gz CIWMJSYXIHGLQX-WTIAFYNJSA-N 0 3 423.532 4.276 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)[C@@H](CC)Nc3ccccc3)c(OCC)c2)CC1 ZINC000435834344 861096688 /nfs/dbraw/zinc/09/66/88/861096688.db2.gz IHJGWZRXEQIGMP-JOCHJYFZSA-N 0 3 424.589 4.447 20 0 HIADHN C[C@H]1CCN(C(=O)Nc2ccc(OC[C@H]3CCCO3)cc2)CCN1Cc1ccccc1 ZINC000437742516 863069858 /nfs/dbraw/zinc/06/98/58/863069858.db2.gz GCIRORBPAUPQMQ-GBXCKJPGSA-N 0 3 423.557 4.373 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N[C@@H](CC(F)(F)F)C(C)C)c(C)c2)CC1 ZINC000437922060 863298289 /nfs/dbraw/zinc/29/82/89/863298289.db2.gz WXUMUKYEOZLSKW-SFHVURJKSA-N 0 3 400.489 4.235 20 0 HIADHN COCCc1ccc(Oc2ccc(NC(=O)N3CC[C@H](N4CC=CC4)C3)cc2)cc1 ZINC000438037623 863397377 /nfs/dbraw/zinc/39/73/77/863397377.db2.gz LPVSAPJRSLOXMR-NRFANRHFSA-N 0 3 407.514 4.146 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)N[C@H]3C[C@H](c4cccc(Cl)c4)C3)CC2)C[C@@H](C)O1 ZINC000438071821 863457341 /nfs/dbraw/zinc/45/73/41/863457341.db2.gz KNNWPZJVOIUUBK-ZFNVSSEQSA-N 0 3 419.997 4.117 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@H](C)NCc2ccc3nc(C)ccc3c2)cc1 ZINC000438074125 863460535 /nfs/dbraw/zinc/46/05/35/863460535.db2.gz MRXNYXPJEOAXRU-SFHVURJKSA-N 0 3 411.571 4.425 20 0 HIADHN Cc1cccc(O[C@@H](C)CNC(=O)Nc2ccc(CCN3CCSCC3)cc2)c1 ZINC000438104022 863514995 /nfs/dbraw/zinc/51/49/95/863514995.db2.gz MFIFKRORANUMTN-IBGZPJMESA-N 0 3 413.587 4.175 20 0 HIADHN O=C(Nc1cc2c(cc1Sc1ccccc1)OCCO2)N1CC[C@@H](N2CC=CC2)C1 ZINC000438127259 863546356 /nfs/dbraw/zinc/54/63/56/863546356.db2.gz CXUQGEPRWOVLIY-QGZVFWFLSA-N 0 3 423.538 4.087 20 0 HIADHN C[C@@H](NCc1cccc(NC(=O)Cn2cccn2)c1)c1cccc(Br)c1 ZINC000467840640 881678897 /nfs/dbraw/zinc/67/88/97/881678897.db2.gz VUOQGMPBKDTSHJ-OAHLLOKOSA-N 0 3 413.319 4.135 20 0 HIADHN Cc1nc(-c2cccc(NC(=O)N3CC[C@@H](C)N(Cc4ccccc4)CC3)c2)no1 ZINC000438221742 863655458 /nfs/dbraw/zinc/65/54/58/863655458.db2.gz BNBGNEACDMQEKK-QGZVFWFLSA-N 0 3 405.502 4.173 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)Nc2cccc(CSC3CCCC3)c2)CC1 ZINC000438248673 863712020 /nfs/dbraw/zinc/71/20/20/863712020.db2.gz UNLDATAURYRINH-IBGZPJMESA-N 0 3 418.651 4.258 20 0 HIADHN CCCn1ccc2ccc(NC(=O)N3CCC(CN4C[C@@H](C)O[C@H](C)C4)CC3)cc21 ZINC000438282645 863755033 /nfs/dbraw/zinc/75/50/33/863755033.db2.gz NJJYSXNUNOXHPX-RTBURBONSA-N 0 3 412.578 4.404 20 0 HIADHN CCOC(=O)CCc1ccc(NC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)cc1 ZINC000438303320 863782965 /nfs/dbraw/zinc/78/29/65/863782965.db2.gz XDAQHXLULOUQBN-FQEVSTJZSA-N 0 3 423.557 4.311 20 0 HIADHN CN(C)CCN(C[C@@H]1CCCO1)C(=O)Nc1ccnc(Oc2ccccc2Cl)c1 ZINC000438376001 863835271 /nfs/dbraw/zinc/83/52/71/863835271.db2.gz KOLCRECUSVHKNQ-KRWDZBQOSA-N 0 3 418.925 4.102 20 0 HIADHN Cc1cccc(Oc2ccc(NC(=O)N(CCN(C)C)C[C@H]3CCCO3)cn2)c1C ZINC000438382612 863838609 /nfs/dbraw/zinc/83/86/09/863838609.db2.gz YMFMFUJNKAVYIW-HXUWFJFHSA-N 0 3 412.534 4.065 20 0 HIADHN CC1CCN([C@H](CNC(=O)Nc2ccc3c(c2)NC(=O)CC3)c2cccs2)CC1 ZINC000438424356 863860084 /nfs/dbraw/zinc/86/00/84/863860084.db2.gz USZBIGDCZHRUQM-LJQANCHMSA-N 0 3 412.559 4.228 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)[C@H]1C[C@H]1c1ccccc1OC(F)(F)F ZINC000438455563 863879881 /nfs/dbraw/zinc/87/98/81/863879881.db2.gz CMEWKZVDUZWSAZ-IRXDYDNUSA-N 0 3 412.477 4.341 20 0 HIADHN CC[C@H](C(=O)Nc1ccc(Cl)c(C(=O)NCc2cccs2)c1)N(CC)CC ZINC000438548996 863977681 /nfs/dbraw/zinc/97/76/81/863977681.db2.gz UYFZUVASVWWYPO-GOSISDBHSA-N 0 3 407.967 4.390 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)c2nn(-c3ccccc3)c3c2CCC3)CC1 ZINC000438550984 863980212 /nfs/dbraw/zinc/98/02/12/863980212.db2.gz DRIHCXIKCNYQFK-UHFFFAOYSA-N 0 3 414.553 4.098 20 0 HIADHN COCCO[C@H]1CCN(Cc2cccc(NC(=O)c3ccc(Cl)cc3Cl)c2)C1 ZINC000438556827 863988390 /nfs/dbraw/zinc/98/83/90/863988390.db2.gz XRASOLLXEIMHIR-SFHVURJKSA-N 0 3 423.340 4.483 20 0 HIADHN CN(C(=O)Nc1ccccc1CC(F)(F)F)C1CCN(CCc2ccccn2)CC1 ZINC000438611208 864038038 /nfs/dbraw/zinc/03/80/38/864038038.db2.gz GBZBHXNJJSQUMW-UHFFFAOYSA-N 0 3 420.479 4.357 20 0 HIADHN CC(=O)Nc1ccc(Cl)c(NC(=O)N(Cc2ccccc2)C2CCN(C)CC2)c1 ZINC000438632201 864062414 /nfs/dbraw/zinc/06/24/14/864062414.db2.gz XNOLZMJZKAISPT-UHFFFAOYSA-N 0 3 414.937 4.427 20 0 HIADHN C[C@H](OC[C@@H](O)CN1CC=C(c2c[nH]c3ncccc23)CC1)c1ccc(Cl)cc1 ZINC000438651309 864093232 /nfs/dbraw/zinc/09/32/32/864093232.db2.gz MKNASJUPYJKAOT-JXFKEZNVSA-N 0 3 411.933 4.444 20 0 HIADHN CCN(C(=O)C(=O)Nc1cc(Cl)ccc1F)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000438661843 864110651 /nfs/dbraw/zinc/11/06/51/864110651.db2.gz VAYMXMWQAYSBAL-MAUKXSAKSA-N 0 3 417.912 4.102 20 0 HIADHN CCN(C(=O)C(=O)Nc1ccc(F)c(Cl)c1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000438664929 864116425 /nfs/dbraw/zinc/11/64/25/864116425.db2.gz BIMXKVWDSOYADM-YJBOKZPZSA-N 0 3 417.912 4.102 20 0 HIADHN Cc1ccc(NC(=O)N(CCN(C)C)Cc2cccs2)c(OC[C@H]2CCCO2)c1 ZINC000438681461 864146251 /nfs/dbraw/zinc/14/62/51/864146251.db2.gz PEUDVWAXLZQICG-GOSISDBHSA-N 0 3 417.575 4.210 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)C(=O)Nc1ccccc1Oc1ccccc1 ZINC000438730335 864214797 /nfs/dbraw/zinc/21/47/97/864214797.db2.gz HUJKCTDBKVFRKG-UHFFFAOYSA-N 0 3 423.538 4.069 20 0 HIADHN C[C@@H]1CC[C@H](O)[C@H]([C@H]2CCCCN2CC(=O)Nc2ccc(Br)cc2)C1 ZINC000438993441 864451566 /nfs/dbraw/zinc/45/15/66/864451566.db2.gz KHLGGZFQBOVTPY-FDPIWHGQSA-N 0 3 409.368 4.039 20 0 HIADHN O[C@@H]1CCCC[C@H]1[C@H]1CCCCN1Cc1cc2c(cc1Br)OCCO2 ZINC000439003133 864456698 /nfs/dbraw/zinc/45/66/98/864456698.db2.gz PWSFCXBLLBADNY-CGTJXYLNSA-N 0 3 410.352 4.126 20 0 HIADHN O[C@@H]1CCCC[C@H]1[C@@H]1CCCCN1Cc1cc2c(cc1Br)OCCO2 ZINC000439003136 864457354 /nfs/dbraw/zinc/45/73/54/864457354.db2.gz PWSFCXBLLBADNY-RYQLBKOJSA-N 0 3 410.352 4.126 20 0 HIADHN Cc1cc(O)c(C(C)C)cc1C(=O)N1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000439062235 864511572 /nfs/dbraw/zinc/51/15/72/864511572.db2.gz XDYRDVAMARYDKK-OALUTQOASA-N 0 3 402.579 4.176 20 0 HIADHN Cc1cc(O)c(C(C)C)cc1C(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000439062234 864512477 /nfs/dbraw/zinc/51/24/77/864512477.db2.gz XDYRDVAMARYDKK-KDURUIRLSA-N 0 3 402.579 4.176 20 0 HIADHN Cc1ccc(Br)cc1CN[C@H](C)c1cccc(N2CCCS2(=O)=O)c1 ZINC000439143773 864576796 /nfs/dbraw/zinc/57/67/96/864576796.db2.gz UVDWLSGZCCQYAR-OAHLLOKOSA-N 0 3 423.376 4.148 20 0 HIADHN CN(C)CCN(C(=O)Nc1ccc(-n2nccc2C(F)(F)F)cc1)C1CCCC1 ZINC000467913925 881780364 /nfs/dbraw/zinc/78/03/64/881780364.db2.gz KQXGMIPDLHUDGO-UHFFFAOYSA-N 0 3 409.456 4.229 20 0 HIADHN Cc1cc(NC(=O)C(=O)Nc2ccc(CCN3CCSCC3)cc2)ccc1C1CC1 ZINC000439192981 864619535 /nfs/dbraw/zinc/61/95/35/864619535.db2.gz QQQCTQIQDPPCBC-UHFFFAOYSA-N 0 3 423.582 4.041 20 0 HIADHN CCN(C[C@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)c1cc(Cl)ccc1C ZINC000439224543 864642283 /nfs/dbraw/zinc/64/22/83/864642283.db2.gz LLFPTUUAWKAQMR-IBGZPJMESA-N 0 3 406.979 4.181 20 0 HIADHN Cc1ccsc1[C@@H]1C[C@@H]1C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000439286676 864705315 /nfs/dbraw/zinc/70/53/15/864705315.db2.gz NUTXWGYSGYBVKZ-AQNXPRMDSA-N 0 3 406.555 4.442 20 0 HIADHN C[C@H]1C[C@H](c2ccccc2)CCN1CC(=O)N1CCC(OCc2ccccc2)CC1 ZINC000439315532 864748786 /nfs/dbraw/zinc/74/87/86/864748786.db2.gz JINCBQWGOPTWKY-XUZZJYLKSA-N 0 3 406.570 4.462 20 0 HIADHN COc1ccccc1O[C@H](C)CNCc1cc(Cl)ccc1OC[C@@H]1CCCO1 ZINC000439467663 864842830 /nfs/dbraw/zinc/84/28/30/864842830.db2.gz JKMNFQHABFYDQC-APWZRJJASA-N 0 3 405.922 4.464 20 0 HIADHN Clc1ccc(OC[C@@H]2CCCO2)c(CNCCN2CCc3sccc3C2)c1 ZINC000439477066 864845330 /nfs/dbraw/zinc/84/53/30/864845330.db2.gz SLXNUWAZCKRRGF-IBGZPJMESA-N 0 3 406.979 4.107 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)NC[C@H]2CCC[C@H](C(F)(F)F)C2)CC1 ZINC000439580983 864902629 /nfs/dbraw/zinc/90/26/29/864902629.db2.gz KVMXKVMPPJCUNS-HOTGVXAUSA-N 0 3 401.473 4.254 20 0 HIADHN C[C@@H](NCc1ccccc1CN(C)Cc1ccco1)C(=O)Nc1cc(F)ccc1F ZINC000439611750 864935307 /nfs/dbraw/zinc/93/53/07/864935307.db2.gz PTSWDAQOGVRPFI-MRXNPFEDSA-N 0 3 413.468 4.307 20 0 HIADHN CC(=O)Nc1cccc(NC(=O)[C@@H](C)NCC(C)(C)c2c(F)cccc2Cl)c1 ZINC000439650164 864976402 /nfs/dbraw/zinc/97/64/02/864976402.db2.gz RTBCKTYCPUSFDB-CYBMUJFWSA-N 0 3 405.901 4.332 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)c2cc(-c3ccccc3Cl)n[nH]2)CC1 ZINC000439728819 865060909 /nfs/dbraw/zinc/06/09/09/865060909.db2.gz FJNJWUNLFVRZOA-HNNXBMFYSA-N 0 3 409.921 4.081 20 0 HIADHN CC(C)c1ccccc1OC[C@@H](O)CN1CCC(c2nc(-c3ccccc3)n[nH]2)CC1 ZINC000439738618 865071626 /nfs/dbraw/zinc/07/16/26/865071626.db2.gz YNERPHOHRCNXBG-NRFANRHFSA-N 0 3 420.557 4.214 20 0 HIADHN Cc1cc(C(=O)NC2CCN([C@H](C)c3ccncc3)CC2)ccc1NC(=O)CC(C)C ZINC000439749703 865079411 /nfs/dbraw/zinc/07/94/11/865079411.db2.gz ZJEXFDNNGCIKNR-LJQANCHMSA-N 0 3 422.573 4.330 20 0 HIADHN CC(C)[C@H]1CC[C@@H](C)C[C@H]1OCC(=O)NC1CCN([C@H](C)c2ccncc2)CC1 ZINC000439759018 865085031 /nfs/dbraw/zinc/08/50/31/865085031.db2.gz SBGYPBMBKLCCJO-DAVBRLECSA-N 0 3 401.595 4.201 20 0 HIADHN CC(C)[C@H]1CC[C@@H](C)C[C@@H]1OCC(=O)NC1CCN([C@@H](C)c2ccncc2)CC1 ZINC000439759022 865085466 /nfs/dbraw/zinc/08/54/66/865085466.db2.gz SBGYPBMBKLCCJO-VNHKHXMHSA-N 0 3 401.595 4.201 20 0 HIADHN C[C@@H](Oc1cccc(Cl)c1Cl)C(=O)NC1CCN([C@H](C)c2ccncc2)CC1 ZINC000439762780 865088713 /nfs/dbraw/zinc/08/87/13/865088713.db2.gz CLNQIJKBSFUQKL-HUUCEWRRSA-N 0 3 422.356 4.498 20 0 HIADHN Cc1ccc(Br)cc1C(=O)NC1CCN([C@H](C)c2ccncc2)CC1 ZINC000439771123 865096041 /nfs/dbraw/zinc/09/60/41/865096041.db2.gz ZEEDWVAFCFOVIN-OAHLLOKOSA-N 0 3 402.336 4.108 20 0 HIADHN C[C@@H](C(=O)Nc1ccccc1CN1CCC[C@@H](C(N)=O)C1)c1ccc2ccccc2c1 ZINC000439796824 865117268 /nfs/dbraw/zinc/11/72/68/865117268.db2.gz ZFOLWALJMPEVQL-WZONZLPQSA-N 0 3 415.537 4.279 20 0 HIADHN Cc1ccc(Br)cc1CNC(=O)N(Cc1ccco1)C1CCN(C)CC1 ZINC000439796529 865117474 /nfs/dbraw/zinc/11/74/74/865117474.db2.gz VIFQJOSGVUWOKI-UHFFFAOYSA-N 0 3 420.351 4.157 20 0 HIADHN CCN(C(=O)c1ccc(-c2n[nH]c(C)n2)cc1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000467990301 881837791 /nfs/dbraw/zinc/83/77/91/881837791.db2.gz KJTHMNJUQGNGOI-VGSWGCGISA-N 0 3 403.530 4.078 20 0 HIADHN CCn1ncc(NC(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)c1C(F)(F)F ZINC000439918486 865225144 /nfs/dbraw/zinc/22/51/44/865225144.db2.gz UUALJHDHRFZJNO-KRWDZBQOSA-N 0 3 409.456 4.189 20 0 HIADHN C[C@@H](N[C@@H]1CC(=O)N(Cc2ccccc2C(F)(F)F)C1)c1ccc2c(c1)COC2 ZINC000468027072 881860452 /nfs/dbraw/zinc/86/04/52/881860452.db2.gz BNGWHQQZQDJXSX-AUUYWEPGSA-N 0 3 404.432 4.187 20 0 HIADHN C[C@H](N[C@H]1CC(=O)N(Cc2ccccc2C(F)(F)F)C1)c1ccc2c(c1)COC2 ZINC000468027075 881860580 /nfs/dbraw/zinc/86/05/80/881860580.db2.gz BNGWHQQZQDJXSX-LIRRHRJNSA-N 0 3 404.432 4.187 20 0 HIADHN O=C(Nc1cccc(COCC(F)(F)C(F)F)c1)[C@H]1CCCN1C1CCCC1 ZINC000440116134 865368045 /nfs/dbraw/zinc/36/80/45/865368045.db2.gz DEURKNMYMYJWRG-QGZVFWFLSA-N 0 3 402.432 4.449 20 0 HIADHN Cc1c([C@H](C)NC[C@@]2(C)CCO[C@@H]2C2CC2)nnn1-c1cccc(Br)c1 ZINC000468038657 881868716 /nfs/dbraw/zinc/86/87/16/881868716.db2.gz QJUHHSBSHHEXRT-CJMONDIMSA-N 0 3 419.367 4.194 20 0 HIADHN CC(=O)Nc1ccc(C)c(NC(=O)N2CCN(C3CCC(C(C)C)CC3)CC2)c1 ZINC000440255816 865502925 /nfs/dbraw/zinc/50/29/25/865502925.db2.gz NIGZBLDKFLJSJJ-UHFFFAOYSA-N 0 3 400.567 4.318 20 0 HIADHN CCN1CCN(c2ccc(C(=O)NCc3nc4cc(Cl)ccc4s3)cc2)CC1 ZINC000468058258 881880290 /nfs/dbraw/zinc/88/02/90/881880290.db2.gz GHECKWBGZZSJQQ-UHFFFAOYSA-N 0 3 414.962 4.022 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2ccccc2-c2nncn2C(C)C)N(C)C)cc1 ZINC000440311597 865579429 /nfs/dbraw/zinc/57/94/29/865579429.db2.gz MSLZDPNWYVTOCO-OAQYLSRUSA-N 0 3 406.534 4.259 20 0 HIADHN C[C@@H]1CN(Cc2ccc(CNCc3cnc(-c4ccncc4)s3)cc2)C[C@H](C)O1 ZINC000440340413 865617694 /nfs/dbraw/zinc/61/76/94/865617694.db2.gz KYWDHRXOHXJQCE-HDICACEKSA-N 0 3 408.571 4.104 20 0 HIADHN COc1ccc([C@@H](NC[C@@H](O)COCc2cccs2)c2ccc(F)cc2)cc1 ZINC000440413047 865708988 /nfs/dbraw/zinc/70/89/88/865708988.db2.gz IAAYXWNCTAJWEU-KNQAVFIVSA-N 0 3 401.503 4.153 20 0 HIADHN COc1ccc([C@@H](NC[C@@H](O)COCc2ccccc2F)c2ccc(F)cc2)cc1 ZINC000440414330 865709127 /nfs/dbraw/zinc/70/91/27/865709127.db2.gz KIWMQMMJSXSVJW-QPPBQGQZSA-N 0 3 413.464 4.230 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)C(C)(C)Cc3cccc(Cl)c3)CC2)C[C@@H](C)O1 ZINC000440589901 865827218 /nfs/dbraw/zinc/82/72/18/865827218.db2.gz VUPUCYQSFQDFNZ-QZTJIDSGSA-N 0 3 406.998 4.257 20 0 HIADHN Cc1cccc(C)c1NC(=O)CNC(=O)[C@@H](C)N[C@@H]1CC(C)(C)CCc2ccccc21 ZINC000440635883 865851472 /nfs/dbraw/zinc/85/14/72/865851472.db2.gz KTTXCTFAWLGMMP-DENIHFKCSA-N 0 3 421.585 4.440 20 0 HIADHN CCN(CC(=O)N(CC)c1ccccc1)C1CCN(c2cc(C)nc(C(C)C)n2)CC1 ZINC000440704018 865870355 /nfs/dbraw/zinc/87/03/55/865870355.db2.gz TYKVDZQTJVJTPL-UHFFFAOYSA-N 0 3 423.605 4.252 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)c2cc(-c3ccc(F)cc3)nc3onc(C4CC4)c32)CN1C1CC1 ZINC000440927531 866023100 /nfs/dbraw/zinc/02/31/00/866023100.db2.gz KUNNQGSDCGJQIH-SUMWQHHRSA-N 0 3 420.488 4.261 20 0 HIADHN COCc1nc(C(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)c(-c2ccccc2)s1 ZINC000441058231 866137416 /nfs/dbraw/zinc/13/74/16/866137416.db2.gz AFCBVGQLUOOYSN-FQEVSTJZSA-N 0 3 421.566 4.303 20 0 HIADHN CCOc1ccc2c(c1)CCN(CCC(=O)Nc1c(C)nn(-c3ccccc3)c1C)C2 ZINC000441075641 866169422 /nfs/dbraw/zinc/16/94/22/866169422.db2.gz WKYNBLNGSBJWGF-UHFFFAOYSA-N 0 3 418.541 4.275 20 0 HIADHN O=C(CN1CCC[C@H]([C@H]2CCOC2)C1)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 ZINC000441199759 866271183 /nfs/dbraw/zinc/27/11/83/866271183.db2.gz DRVAARHRIPHUCW-ABSDTBQOSA-N 0 3 411.373 4.405 20 0 HIADHN COC(=O)c1cccc(-c2nc(CN3CCCN(Cc4ccccc4)CC3)cs2)c1 ZINC000441269791 866343799 /nfs/dbraw/zinc/34/37/99/866343799.db2.gz ZOXRBPYSBIHPFR-UHFFFAOYSA-N 0 3 421.566 4.305 20 0 HIADHN O=C(CN1CCC[C@H]([C@H]2CCOC2)C1)N[C@H](c1ccccc1)c1cccc(Cl)c1 ZINC000441286011 866359822 /nfs/dbraw/zinc/35/98/22/866359822.db2.gz YZAJEORIZPFGJO-AWRGLXIESA-N 0 3 412.961 4.294 20 0 HIADHN CN(C(=O)CN1CCC[C@H]([C@H]2CCOC2)C1)[C@H](c1ccccc1)c1ccc(F)cc1 ZINC000441292607 866365983 /nfs/dbraw/zinc/36/59/83/866365983.db2.gz JWLDRGUDCXHVNY-WRALFONMSA-N 0 3 410.533 4.122 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)N(C)[C@@H]2CCSc3ccc(Br)cc32)CN1C1CC1 ZINC000441303694 866375189 /nfs/dbraw/zinc/37/51/89/866375189.db2.gz QBTJNKUCGFBKOS-HACGYAERSA-N 0 3 424.408 4.253 20 0 HIADHN CC[C@](C)(COc1ncccc1Cl)NCC(=O)Nc1ccccc1OC(F)F ZINC000441304827 866376976 /nfs/dbraw/zinc/37/69/76/866376976.db2.gz HSZFBZRFIUJOOE-LJQANCHMSA-N 0 3 413.852 4.112 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)c2cc(F)c(F)cc2Br)CC1 ZINC000441313304 866384588 /nfs/dbraw/zinc/38/45/88/866384588.db2.gz DJPJVBUPOBDWQX-UHFFFAOYSA-N 0 3 413.262 4.057 20 0 HIADHN C[C@H](C(=O)NCCc1c[nH]c2ccccc12)N1CCC[C@H]1c1cccc(N(C)C)c1 ZINC000441364925 866433641 /nfs/dbraw/zinc/43/36/41/866433641.db2.gz NUQJMHMYUNIHLM-KOSHJBKYSA-N 0 3 404.558 4.118 20 0 HIADHN C[C@H](NC(=O)[C@H](C)N1CC[C@H](COCc2ccccc2)C1)c1ccc(Cl)cc1 ZINC000441371323 866439659 /nfs/dbraw/zinc/43/96/59/866439659.db2.gz TUDRNLNBGSUYLN-BJLQDIEVSA-N 0 3 400.950 4.444 20 0 HIADHN COc1cccc(CN(C)C(=O)CN(C)[C@@H]2CCC[C@H]2c2ccc(C)cc2)c1OC ZINC000441376931 866444259 /nfs/dbraw/zinc/44/42/59/866444259.db2.gz LFOAFIYCNYOWKU-FCHUYYIVSA-N 0 3 410.558 4.239 20 0 HIADHN C[C@H](C(=O)N(C)Cc1c(F)cccc1Cl)N1CC[C@@H](COCc2ccccc2)C1 ZINC000441383698 866456575 /nfs/dbraw/zinc/45/65/75/866456575.db2.gz WSKPEUGPETYTQX-IEBWSBKVSA-N 0 3 418.940 4.365 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@@H](C)N2CCC[C@@H]2c2cccc(N(C)C)c2)cc1F ZINC000441386839 866459479 /nfs/dbraw/zinc/45/94/79/866459479.db2.gz XDAOUAASUTZTCH-VGOFRKELSA-N 0 3 413.537 4.084 20 0 HIADHN C[C@@H]1CCCN1C(=O)CCN1CCc2c(cccc2NC(=O)Nc2ccccc2)C1 ZINC000441390232 866461113 /nfs/dbraw/zinc/46/11/13/866461113.db2.gz XEJJPEXHDZOCIN-GOSISDBHSA-N 0 3 406.530 4.090 20 0 HIADHN COc1cc(CNC(=O)CN2CCC[C@@H]3CCC[C@H]32)ccc1OCc1ccccc1 ZINC000441441129 866516804 /nfs/dbraw/zinc/51/68/04/866516804.db2.gz BNSPKQZLNWWISN-FCHUYYIVSA-N 0 3 408.542 4.155 20 0 HIADHN COc1cc(CNC(=O)CN2CCC[C@@H]3CCC[C@@H]32)ccc1OCc1ccccc1 ZINC000441441131 866517308 /nfs/dbraw/zinc/51/73/08/866517308.db2.gz BNSPKQZLNWWISN-VXKWHMMOSA-N 0 3 408.542 4.155 20 0 HIADHN Cc1sc(NC(=O)CN2CCC(c3ncc(C(F)(F)F)[nH]3)CC2)c(C)c1C ZINC000441461035 866535846 /nfs/dbraw/zinc/53/58/46/866535846.db2.gz FKWKGLOCYBAJBK-UHFFFAOYSA-N 0 3 400.470 4.233 20 0 HIADHN COc1cc(-c2nnc(CN3CCCC[C@@H]3Cc3ccccc3)o2)cc(OC)c1OC ZINC000441469220 866545490 /nfs/dbraw/zinc/54/54/90/866545490.db2.gz DHTRQXIJQLTOBR-LJQANCHMSA-N 0 3 423.513 4.360 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N(C)Cc3ccc4cc(OC)ccc4c3)cc2)CC1 ZINC000468146916 882006214 /nfs/dbraw/zinc/00/62/14/882006214.db2.gz RTAIBZOBRULFAV-UHFFFAOYSA-N 0 3 417.553 4.263 20 0 HIADHN C[C@@H](NC(=O)C(=O)Nc1cccc(C(F)F)c1Cl)[C@@H](c1ccccc1)N(C)C ZINC000441707782 866815513 /nfs/dbraw/zinc/81/55/13/866815513.db2.gz ZPHDCIUYJNPCDW-PXAZEXFGSA-N 0 3 409.864 4.024 20 0 HIADHN Cc1cc(N2CCCC[C@@H]2C)ccc1NC(=O)C(=O)Nc1cccc(CN(C)C)c1 ZINC000441851131 866914642 /nfs/dbraw/zinc/91/46/42/866914642.db2.gz SCQDQXORYJIHRC-SFHVURJKSA-N 0 3 408.546 4.013 20 0 HIADHN Brc1ccc(-c2nccc(CN3CCC[C@@]4(CCCOC4)C3)n2)cc1 ZINC000441883942 866948340 /nfs/dbraw/zinc/94/83/40/866948340.db2.gz DXNGZPRWHSRITA-HXUWFJFHSA-N 0 3 402.336 4.299 20 0 HIADHN C[C@H](Sc1ccccc1)c1ccc(NC(=O)C(=O)N(C)CCN(C)C2CC2)cc1 ZINC000441943822 867008971 /nfs/dbraw/zinc/00/89/71/867008971.db2.gz UUDTYTRYVYTFLV-KRWDZBQOSA-N 0 3 411.571 4.031 20 0 HIADHN Cc1nn(C(C)(C)C)cc1[C@H](C)NC(=O)N(CCN(C)C)Cc1ccc(F)cc1F ZINC000468166241 882042463 /nfs/dbraw/zinc/04/24/63/882042463.db2.gz ATNFMRNFWOVWPP-HNNXBMFYSA-N 0 3 421.536 4.059 20 0 HIADHN COc1cc(F)c(NC(=O)N2CCCN(CCCc3ccccc3)CC2)cc1F ZINC000468168415 882045197 /nfs/dbraw/zinc/04/51/97/882045197.db2.gz GPVXYVCSRFRPLU-UHFFFAOYSA-N 0 3 403.473 4.146 20 0 HIADHN CCN1CCCN(C(=O)N[C@H]2CCCc3sc(-c4ccc(F)cc4)nc32)CC1 ZINC000468168579 882046281 /nfs/dbraw/zinc/04/62/81/882046281.db2.gz LMACNUCAOVCJMV-KRWDZBQOSA-N 0 3 402.539 4.064 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)Nc1cc(Cl)cc(F)c1F ZINC000442196062 867218152 /nfs/dbraw/zinc/21/81/52/867218152.db2.gz CHCIBAZBGXSBRO-UHFFFAOYSA-N 0 3 403.807 4.492 20 0 HIADHN COCc1nc(CNC(=O)N[C@@H](CN(C)C)c2ccccc2)c(-c2ccccc2)s1 ZINC000442471908 867454412 /nfs/dbraw/zinc/45/44/12/867454412.db2.gz JGQDUUDWGZKSIA-FQEVSTJZSA-N 0 3 424.570 4.059 20 0 HIADHN COc1ccc([C@H](CNC(=O)CCc2c[nH]c3ccc(C)cc23)N2CCCC2)cc1 ZINC000468212354 882094448 /nfs/dbraw/zinc/09/44/48/882094448.db2.gz OCUHESUYROLSFR-DEOSSOPVSA-N 0 3 405.542 4.371 20 0 HIADHN Cc1c2cc(Cl)ccc2sc1CNC(=O)NC(C)(C)CCN1CCN(C)CC1 ZINC000442731664 867654454 /nfs/dbraw/zinc/65/44/54/867654454.db2.gz VIENVNFUPRBTJV-UHFFFAOYSA-N 0 3 423.026 4.078 20 0 HIADHN COCCC[C@@H](NCC(=O)Nc1ccc(Br)cc1)c1ccc(F)cc1 ZINC000442767468 867669232 /nfs/dbraw/zinc/66/92/32/867669232.db2.gz MXBPOXSNSBMWJE-GOSISDBHSA-N 0 3 409.299 4.284 20 0 HIADHN COCCC[C@H](NCC(=O)N1CCC(Cc2ccccc2)CC1)c1ccc(F)cc1 ZINC000442779112 867672749 /nfs/dbraw/zinc/67/27/49/867672749.db2.gz LKZBXKSUZPDZPI-DEOSSOPVSA-N 0 3 412.549 4.364 20 0 HIADHN Cc1nccn1CCCN(C)Cc1cccc(Br)c1OC[C@H]1CCCO1 ZINC000442892100 867722003 /nfs/dbraw/zinc/72/20/03/867722003.db2.gz UBHNOOSPIQXNOL-GOSISDBHSA-N 0 3 422.367 4.034 20 0 HIADHN CC(C)N1CCc2nc(CN(C[C@@H](C)O)[C@H](C)Cc3ccc(Cl)cc3)sc2C1 ZINC000442964888 867767239 /nfs/dbraw/zinc/76/72/39/867767239.db2.gz JMPQEPMEJUJNAE-IAGOWNOFSA-N 0 3 422.038 4.377 20 0 HIADHN CC(C)N1CCc2nc(CN(C[C@@H](C)O)[C@@H](C)Cc3ccc(Cl)cc3)sc2C1 ZINC000442964887 867767760 /nfs/dbraw/zinc/76/77/60/867767760.db2.gz JMPQEPMEJUJNAE-DLBZAZTESA-N 0 3 422.038 4.377 20 0 HIADHN CSc1cc(C(=O)NCCN2CCC3(CCCCC3)CC2)ccc1NC(C)=O ZINC000442967899 867769211 /nfs/dbraw/zinc/76/92/11/867769211.db2.gz PCJWTGYPAVOOTR-UHFFFAOYSA-N 0 3 403.592 4.143 20 0 HIADHN COc1cc(C[NH2+][C@H](C)[C@@H](c2ccccc2C)N(C)C)cc(Br)c1[O-] ZINC000442994945 867783916 /nfs/dbraw/zinc/78/39/16/867783916.db2.gz VHYKOKAVODZAJO-KUHUBIRLSA-N 0 3 407.352 4.253 20 0 HIADHN O=C(Nc1ccccc1)[C@@H](Cc1ccccc1)NCc1cc(-n2ccnc2)cs1 ZINC000443007573 867791620 /nfs/dbraw/zinc/79/16/20/867791620.db2.gz AGDBEUMFEAOFET-JOCHJYFZSA-N 0 3 402.523 4.273 20 0 HIADHN CCOc1cc(CN2CC[C@@H](OC)C[C@@H]2C)ccc1OCC(=O)Nc1ccccc1 ZINC000443063306 867807166 /nfs/dbraw/zinc/80/71/66/867807166.db2.gz AFDJILFTEXPZLX-GHTZIAJQSA-N 0 3 412.530 4.102 20 0 HIADHN COc1cc(-c2noc([C@H](C)N3[C@H](C)CC[C@@H]3C)n2)ccc1OC[C@@H]1CCCO1 ZINC000443194211 867869418 /nfs/dbraw/zinc/86/94/18/867869418.db2.gz IDXTUKLXHJSZRN-DFGXFYAUSA-N 0 3 401.507 4.237 20 0 HIADHN C[C@H](c1nc(-c2cc(C(F)(F)F)ccc2-n2cncn2)no1)N1[C@H](C)CC[C@@H]1C ZINC000443213677 867878701 /nfs/dbraw/zinc/87/87/01/867878701.db2.gz RQGCQONUKSIZRZ-FRRDWIJNSA-N 0 3 406.412 4.270 20 0 HIADHN O[C@@H](COc1ccc(Cl)cc1)CN1CCC[C@H](c2nc3ccc(F)cc3o2)C1 ZINC000443636667 868218840 /nfs/dbraw/zinc/21/88/40/868218840.db2.gz FWORKTWVQJQAQZ-WMLDXEAASA-N 0 3 404.869 4.240 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)CSCc2ccc(Cl)cc2Cl)C[C@H](C)O1 ZINC000443671712 868277696 /nfs/dbraw/zinc/27/76/96/868277696.db2.gz DCYQQVMHXVLZSJ-GASCZTMLSA-N 0 3 419.418 4.232 20 0 HIADHN C[C@H]1CN(CCCCNC(=O)C23C[C@H]4C[C@@H](C2)CC(C(F)(F)F)(C4)C3)C[C@H](C)O1 ZINC000443671723 868277958 /nfs/dbraw/zinc/27/79/58/868277958.db2.gz DEOXTBKNADOZPJ-GVXWCZSESA-N 0 3 416.528 4.141 20 0 HIADHN Cc1nc(-c2ccc(C)cc2C)sc1C(=O)NCCCCN1C[C@H](C)O[C@@H](C)C1 ZINC000443674688 868281633 /nfs/dbraw/zinc/28/16/33/868281633.db2.gz NAAUDSDBQTZNFT-ROUUACIJSA-N 0 3 415.603 4.355 20 0 HIADHN Cc1ccccc1COc1cccc(CC(=O)NCCCCN2C[C@H](C)O[C@@H](C)C2)c1 ZINC000443675712 868282280 /nfs/dbraw/zinc/28/22/80/868282280.db2.gz QQVGFXWEKVWYGI-VXKWHMMOSA-N 0 3 424.585 4.122 20 0 HIADHN C[C@@H](NC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(Br)s1 ZINC000443734966 868314990 /nfs/dbraw/zinc/31/49/90/868314990.db2.gz VDEJTDJIPXLQRA-GDBMZVCRSA-N 0 3 422.392 4.488 20 0 HIADHN Cc1ccccc1[C@@H]([C@@H](C)NC(=O)C(=O)Nc1ccc(C)c(C(F)(F)F)c1)N(C)C ZINC000443839218 868369096 /nfs/dbraw/zinc/36/90/96/868369096.db2.gz KUYXCRJHCPXNGR-DNVCBOLYSA-N 0 3 421.463 4.068 20 0 HIADHN CCCn1ccc2ccc(NC(=O)C(=O)N[C@H](C)[C@@H](c3ccccc3C)N(C)C)cc21 ZINC000443841280 868372100 /nfs/dbraw/zinc/37/21/00/868372100.db2.gz ZLOFWPTVYVZCIN-JPYJTQIMSA-N 0 3 420.557 4.106 20 0 HIADHN Cc1ccccc1[C@H]([C@H](C)NC(=O)C(=O)Nc1ccc(OC2CCCC2)cc1)N(C)C ZINC000443845071 868375296 /nfs/dbraw/zinc/37/52/96/868375296.db2.gz SVBGIPGTWPLMBA-MBSDFSHPSA-N 0 3 423.557 4.063 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N[C@@H]3CCSc4ccc(Cl)cc43)cc2)CC1 ZINC000468266573 882185458 /nfs/dbraw/zinc/18/54/58/882185458.db2.gz PTFNYCMHFMNSEP-HXUWFJFHSA-N 0 3 415.990 4.449 20 0 HIADHN O=C(CCN1CCN(c2ccccc2)CC1)N[C@H]1CCSc2ccc(Cl)cc21 ZINC000468266523 882186215 /nfs/dbraw/zinc/18/62/15/882186215.db2.gz PABMWPPHRGSESX-FQEVSTJZSA-N 0 3 415.990 4.205 20 0 HIADHN CC(C)CN(CCN(C)C)C(=O)Nc1cc(Cl)ccc1-c1nc(C2CC2)no1 ZINC000443955236 868491022 /nfs/dbraw/zinc/49/10/22/868491022.db2.gz FYDWMXQLNONKLQ-UHFFFAOYSA-N 0 3 405.930 4.319 20 0 HIADHN CNS(=O)(=O)c1ccc([C@H](C)NCc2ccc(Oc3cccc(F)c3)cc2)cc1 ZINC000443968095 868499260 /nfs/dbraw/zinc/49/92/60/868499260.db2.gz NHEBXFQUCOTCQE-INIZCTEOSA-N 0 3 414.502 4.377 20 0 HIADHN COc1ccc(CNC[C@@H](c2ccc(C)o2)N2CCCC2)c(OCc2cccnc2)c1 ZINC000443978929 868505932 /nfs/dbraw/zinc/50/59/32/868505932.db2.gz JFTDNNZAHZIWJJ-QHCPKHFHSA-N 0 3 421.541 4.497 20 0 HIADHN OC[C@@H](CNCc1cnc(C(F)(F)F)s1)Cc1cccc(OC(F)(F)F)c1 ZINC000443983876 868509006 /nfs/dbraw/zinc/50/90/06/868509006.db2.gz GJQMQNMSBDVPIO-LLVKDONJSA-N 0 3 414.371 4.001 20 0 HIADHN Cc1ccc(-c2nc(CNC[C@@H](CO)Cc3cc(F)c(F)c(F)c3)cs2)cc1 ZINC000443999507 868519881 /nfs/dbraw/zinc/51/98/81/868519881.db2.gz COLXEIAGDSORNX-HNNXBMFYSA-N 0 3 406.473 4.477 20 0 HIADHN C[C@H]1CCN(C)CCN1C(=O)N[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 ZINC000444021212 868546460 /nfs/dbraw/zinc/54/64/60/868546460.db2.gz LMMPFEKBYVITST-SWLSCSKDSA-N 0 3 411.390 4.435 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)N[C@H](CC(F)(F)F)c3ccc(C(F)(F)F)cc3)[C@@H]2C1 ZINC000444021299 868548191 /nfs/dbraw/zinc/54/81/91/868548191.db2.gz DWWRWGJFAAQKNY-FVQBIDKESA-N 0 3 423.401 4.435 20 0 HIADHN C[C@H]1CN(CCCCNC(=O)C2(Cc3ccc(C(F)(F)F)cc3)CC2)C[C@H](C)O1 ZINC000444180384 868651744 /nfs/dbraw/zinc/65/17/44/868651744.db2.gz GKKXPFXLBKPMAE-IRXDYDNUSA-N 0 3 412.496 4.034 20 0 HIADHN CCOc1ccc([C@H]2CCCN2C(=O)CN2CC[C@@H](COCc3ccccc3)C2)cc1 ZINC000444186761 868657192 /nfs/dbraw/zinc/65/71/92/868657192.db2.gz RJWOFMXLUPQNCL-RCZVLFRGSA-N 0 3 422.569 4.288 20 0 HIADHN CCCN(CC(=O)Nc1ccc2c(c1)OC1(CCCC1)O2)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000444227294 868675900 /nfs/dbraw/zinc/67/59/00/868675900.db2.gz UOILLGSKSSIOKF-MTNREXPMSA-N 0 3 414.546 4.192 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)N([C@H](C)c3ccco3)C3CC3)CC2)c1 ZINC000444337034 868765294 /nfs/dbraw/zinc/76/52/94/868765294.db2.gz ANXZYPICGAWMGV-OAQYLSRUSA-N 0 3 424.589 4.425 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)[C@H]1C[C@@H]1c1ccccc1C(F)(F)F ZINC000444448154 868832058 /nfs/dbraw/zinc/83/20/58/868832058.db2.gz BKUHFASFFSBQOL-UXHICEINSA-N 0 3 418.459 4.404 20 0 HIADHN O=C(CCc1ccc(-c2ccccc2)o1)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000444454977 868834611 /nfs/dbraw/zinc/83/46/11/868834611.db2.gz QSKKUTJRDYIGQO-UHFFFAOYSA-N 0 3 404.510 4.475 20 0 HIADHN Cc1cc(C(=O)Nc2cccc(CN3CCC(O)CC3)c2)ccc1NC(=O)CC(C)C ZINC000444463158 868838856 /nfs/dbraw/zinc/83/88/56/868838856.db2.gz WTHGFIKBACEPCR-UHFFFAOYSA-N 0 3 423.557 4.189 20 0 HIADHN Cc1cc(Br)ccc1C(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000444545491 868876854 /nfs/dbraw/zinc/87/68/54/868876854.db2.gz LJPUNPILQIQLLN-UHFFFAOYSA-N 0 3 417.347 4.214 20 0 HIADHN O=C(Cn1ccc2ccc(Cl)cc21)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000444551285 868878284 /nfs/dbraw/zinc/87/82/84/868878284.db2.gz NVKLTJAZQHGGKP-UHFFFAOYSA-N 0 3 411.933 4.138 20 0 HIADHN CCCN(Cc1nc(-c2ccccc2F)no1)C1CCN(c2cc(C)nc(C)n2)CC1 ZINC000444567887 868885041 /nfs/dbraw/zinc/88/50/41/868885041.db2.gz AQFINTMBRFACHY-UHFFFAOYSA-N 0 3 424.524 4.164 20 0 HIADHN O=C(Nc1ccc(Nc2ncccn2)cc1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000444615517 868909524 /nfs/dbraw/zinc/90/95/24/868909524.db2.gz GRJQCGWBYWCRBT-SFHVURJKSA-N 0 3 405.477 4.210 20 0 HIADHN COc1ccc(-c2csc(NC(=O)[C@H](C)N[C@@H]3CC(C)(C)OC3(C)C)n2)cc1 ZINC000444637955 868925621 /nfs/dbraw/zinc/92/56/21/868925621.db2.gz HKGVRIPVRDVURW-SUMWQHHRSA-N 0 3 403.548 4.081 20 0 HIADHN CCc1ccccc1CCN1CCC(C(=O)c2ccc3c(c2)NC(=O)[C@@H](C)O3)CC1 ZINC000444657271 868934635 /nfs/dbraw/zinc/93/46/35/868934635.db2.gz BVTBJBWFPYUEIE-QGZVFWFLSA-N 0 3 406.526 4.106 20 0 HIADHN C[C@@H](NCCO[C@H]1CCCCO1)c1cccc(NC(=O)Cc2ccccc2F)c1 ZINC000444689950 868959635 /nfs/dbraw/zinc/95/96/35/868959635.db2.gz PTHIQALNRLZEEX-HXOBKFHXSA-N 0 3 400.494 4.201 20 0 HIADHN Cc1c([C@@H](C)NC(=O)N2CCN(Cc3ccccc3)C3(CCCCC3)C2)cnn1C ZINC000444703012 868965536 /nfs/dbraw/zinc/96/55/36/868965536.db2.gz JDCHAHFULONRBY-LJQANCHMSA-N 0 3 409.578 4.020 20 0 HIADHN COCCN1CCC[C@@H]1CNC(=O)N([C@H](C)c1cccc(C(F)(F)F)c1)C1CC1 ZINC000444718661 868973429 /nfs/dbraw/zinc/97/34/29/868973429.db2.gz WHQJEHHYOWZHGL-DNVCBOLYSA-N 0 3 413.484 4.051 20 0 HIADHN CCO[C@H](CNC(=O)Nc1ccc(N2CCN(CC)CC2)cc1C)c1ccccc1 ZINC000444841655 869047235 /nfs/dbraw/zinc/04/72/35/869047235.db2.gz WLYIFORMYLMYQL-HSZRJFAPSA-N 0 3 410.562 4.036 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N[C@H](C)c2ccc(Cl)cc2Cl)CC1 ZINC000445000836 869155138 /nfs/dbraw/zinc/15/51/38/869155138.db2.gz PNUKNRAPMJQAPK-CQSZACIVSA-N 0 3 402.366 4.243 20 0 HIADHN CC1CCN([C@@H](CNC(=O)Nc2ccc(OC3COC3)cc2)c2cccs2)CC1 ZINC000445024179 869173576 /nfs/dbraw/zinc/17/35/76/869173576.db2.gz VHGAWNZEIZLYID-FQEVSTJZSA-N 0 3 415.559 4.120 20 0 HIADHN CC(C)Oc1ccc(NC(=O)N2CCC(CN3C[C@H](C)O[C@@H](C)C3)CC2)c(Cl)c1 ZINC000445024037 869173798 /nfs/dbraw/zinc/17/37/98/869173798.db2.gz NDJIJMZEZBDBGU-IRXDYDNUSA-N 0 3 423.985 4.480 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N2C[C@H](c3ccccc3)c3ccccc32)CC1 ZINC000445111933 869222680 /nfs/dbraw/zinc/22/26/80/869222680.db2.gz JLBDGNMYYCPWHJ-HSZRJFAPSA-N 0 3 407.558 4.238 20 0 HIADHN Cc1cccc(C)c1NC(=O)Cc1noc([C@H]2CCCN(Cc3cccc(F)c3)C2)n1 ZINC000445314443 869368480 /nfs/dbraw/zinc/36/84/80/869368480.db2.gz CSRNSEYIQPUCKJ-IBGZPJMESA-N 0 3 422.504 4.386 20 0 HIADHN O=C(Cc1cccc(C(F)F)c1)NC1CCN(CCOc2ccc(Cl)cc2)CC1 ZINC000468360024 882300377 /nfs/dbraw/zinc/30/03/77/882300377.db2.gz ZBDKIOZERGEDLZ-UHFFFAOYSA-N 0 3 422.903 4.480 20 0 HIADHN Fc1cccc(CN2CCC[C@H](c3nc(-c4cnn(-c5ccccc5)c4)no3)C2)c1 ZINC000445440048 869522403 /nfs/dbraw/zinc/52/24/03/869522403.db2.gz YVKQTZWIEQZGLP-SFHVURJKSA-N 0 3 403.461 4.441 20 0 HIADHN COC(=O)c1cn(C2CCN([C@@H](C)c3ccc(Oc4ccccc4)cc3)CC2)nn1 ZINC000445488174 869558164 /nfs/dbraw/zinc/55/81/64/869558164.db2.gz CMJCQKSEZCUTLS-KRWDZBQOSA-N 0 3 406.486 4.255 20 0 HIADHN c1cncc(COc2ccc(-c3noc([C@@H]4CCCN4C4CCOCC4)n3)cc2)c1 ZINC000445560422 869617141 /nfs/dbraw/zinc/61/71/41/869617141.db2.gz HOWPQJUDMFOCPB-NRFANRHFSA-N 0 3 406.486 4.027 20 0 HIADHN CC(C)[C@@H](CC(F)(F)F)NCC(=O)N[C@@H](C)c1ccc(OC(F)(F)F)cc1 ZINC000445898409 869877820 /nfs/dbraw/zinc/87/78/20/869877820.db2.gz RBLJDMIZYOGOCH-SMDDNHRTSA-N 0 3 400.363 4.329 20 0 HIADHN C[C@H](C(=O)Nc1cccc(F)c1)N1CCN(CC2CCC(C(F)(F)F)CC2)CC1 ZINC000468409809 882352446 /nfs/dbraw/zinc/35/24/46/882352446.db2.gz WHWYBURRXYEAFE-KLAILNCOSA-N 0 3 415.475 4.139 20 0 HIADHN O=C(Cc1c[nH]c2ccccc12)N1CCN(CC2CCC(C(F)(F)F)CC2)CC1 ZINC000468412442 882356935 /nfs/dbraw/zinc/35/69/35/882356935.db2.gz OJXXRGGQIQLUNZ-UHFFFAOYSA-N 0 3 407.480 4.223 20 0 HIADHN c1ccc(-c2nnc(-c3noc(-c4ccc(CN5CCSCC5)cc4)n3)o2)cc1 ZINC000445998555 869961107 /nfs/dbraw/zinc/96/11/07/869961107.db2.gz LEVWODXKIVHRLT-UHFFFAOYSA-N 0 3 405.483 4.002 20 0 HIADHN O=C(c1cc(-c2cccs2)n(-c2ccccc2)n1)N1CC[C@H](N2CCCCC2)C1 ZINC000446064818 870023890 /nfs/dbraw/zinc/02/38/90/870023890.db2.gz ZSNYAMPJAISJKX-IBGZPJMESA-N 0 3 406.555 4.301 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)CCCc2cc(Cl)sc2Cl)C[C@@H](C)O1 ZINC000446386620 870291907 /nfs/dbraw/zinc/29/19/07/870291907.db2.gz PQSPEDOOXZPQEJ-ZIAGYGMSSA-N 0 3 407.407 4.383 20 0 HIADHN CN(C)Cc1cccc(NC(=O)C(=O)N(Cc2cccs2)Cc2cccs2)c1 ZINC000446541038 870455502 /nfs/dbraw/zinc/45/55/02/870455502.db2.gz SOFFKLBXBNFQJG-UHFFFAOYSA-N 0 3 413.568 4.039 20 0 HIADHN CN1CCN(CCC(C)(C)NC(=O)Nc2cccnc2-c2ccc(Cl)s2)CC1 ZINC000446580091 870489484 /nfs/dbraw/zinc/48/94/84/870489484.db2.gz AIZBPVZTDXURFV-UHFFFAOYSA-N 0 3 421.998 4.001 20 0 HIADHN Cc1ccc([C@H](CCn2cncn2)NCc2ccccc2OCC(F)(F)F)cc1 ZINC000446741368 870647562 /nfs/dbraw/zinc/64/75/62/870647562.db2.gz MKQGOVVHUGQXPH-IBGZPJMESA-N 0 3 404.436 4.449 20 0 HIADHN COc1ccc([C@@H](CCn2cncn2)NCc2ccc(F)cc2C(F)(F)F)cc1 ZINC000446741933 870650095 /nfs/dbraw/zinc/65/00/95/870650095.db2.gz CVLUPNHCABKQGX-LJQANCHMSA-N 0 3 408.399 4.366 20 0 HIADHN Cc1ccc([C@@H](CCn2cncn2)NCc2ccc(C(=O)OC(C)(C)C)cc2)cc1 ZINC000446842839 870762052 /nfs/dbraw/zinc/76/20/52/870762052.db2.gz HXTRVOQDXCHAAC-JOCHJYFZSA-N 0 3 406.530 4.463 20 0 HIADHN Cc1ccc(CN[C@H](C)CC(=O)Nc2ccccc2C(C)C)cc1S(C)(=O)=O ZINC000446898927 870817144 /nfs/dbraw/zinc/81/71/44/870817144.db2.gz OLFTUBPOIQPWQG-QGZVFWFLSA-N 0 3 402.560 4.029 20 0 HIADHN C[C@H](CC(=O)Nc1ccc(OC(F)(F)F)cc1)NCc1ccc2c(n1)CCCC2 ZINC000446901704 870820146 /nfs/dbraw/zinc/82/01/46/870820146.db2.gz FFLSBAOKFLXTQM-CQSZACIVSA-N 0 3 407.436 4.366 20 0 HIADHN CC[C@H](C)C(=O)Nc1cccc(CN[C@@H](CCn2cncn2)c2ccc(C)cc2)c1 ZINC000446922696 870836498 /nfs/dbraw/zinc/83/64/98/870836498.db2.gz NPMJNYIPPHSOCH-CVDCTZTESA-N 0 3 405.546 4.492 20 0 HIADHN COc1ccc([C@@H](CCn2cncn2)N[C@@H]2CC(C)(C)Oc3cc(F)ccc32)cc1 ZINC000446924194 870838162 /nfs/dbraw/zinc/83/81/62/870838162.db2.gz DJFZNJYAKSJRGH-NHCUHLMSSA-N 0 3 410.493 4.449 20 0 HIADHN Cc1ccc([C@@H](CCn2cncn2)NCc2ccc(C)cc2OC[C@H]2CCCO2)cc1 ZINC000446935592 870845340 /nfs/dbraw/zinc/84/53/40/870845340.db2.gz GIANGWYXOOQNKB-DNQXCXABSA-N 0 3 420.557 4.374 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N[C@@H](c1ccccc1)c1cccc(F)c1 ZINC000447039539 870915568 /nfs/dbraw/zinc/91/55/68/870915568.db2.gz PDEWXOHAHFSXLF-QHCPKHFHSA-N 0 3 419.500 4.040 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N[C@@H](c1ccccc1F)C1CCCC1 ZINC000447041162 870917545 /nfs/dbraw/zinc/91/75/45/870917545.db2.gz VIYCSSSCOXOYGW-JOCHJYFZSA-N 0 3 411.521 4.182 20 0 HIADHN COCC[C@]1(NCc2cn(-c3ccc(Br)cc3)nc2C(C)C)CCOC1 ZINC000447075697 870959808 /nfs/dbraw/zinc/95/98/08/870959808.db2.gz DTUQIWPQVREFPU-FQEVSTJZSA-N 0 3 422.367 4.043 20 0 HIADHN COCCO[C@@H]1C[C@H](CO)CN(Cc2ccc(-c3cccc(Cl)c3Cl)o2)C1 ZINC000447078513 870965738 /nfs/dbraw/zinc/96/57/38/870965738.db2.gz PSLASCPVKLQFND-GOEBONIOSA-N 0 3 414.329 4.099 20 0 HIADHN COCCO[C@@H]1C[C@H](CO)CN(Cc2ccc(-c3ccc(Cl)c(Cl)c3)o2)C1 ZINC000447093681 870990162 /nfs/dbraw/zinc/99/01/62/870990162.db2.gz LUULPDDHZFSYEM-WMLDXEAASA-N 0 3 414.329 4.099 20 0 HIADHN COc1ccccc1-c1csc([C@@H]2CCCN(C(=O)CN3[C@H](C)CC[C@@H]3C)C2)n1 ZINC000447149957 871048637 /nfs/dbraw/zinc/04/86/37/871048637.db2.gz COMKMXRSKGTPAG-FGTMMUONSA-N 0 3 413.587 4.398 20 0 HIADHN C[C@@H](N[C@H](C)c1cccc(OCc2ccccc2)c1)c1ccc(S(N)(=O)=O)cc1 ZINC000447602050 871510608 /nfs/dbraw/zinc/51/06/08/871510608.db2.gz SHLWVYMFDIJWGX-QZTJIDSGSA-N 0 3 410.539 4.325 20 0 HIADHN FC(F)C(F)(F)COCCN[C@@H]1CCCOc2cc(Br)ccc21 ZINC000447604917 871514174 /nfs/dbraw/zinc/51/41/74/871514174.db2.gz DYKWHSBGDRZNPD-GFCCVEGCSA-N 0 3 400.210 4.169 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N2CCC(Oc3ccncc3C)CC2)N2CCCC2)cc1 ZINC000447771831 871703009 /nfs/dbraw/zinc/70/30/09/871703009.db2.gz YXGXZASRZZRQSI-HSZRJFAPSA-N 0 3 422.573 4.088 20 0 HIADHN COc1ccc2ccccc2c1CN(C1CCCC1)[C@@H]1CCN(C2CCOCC2)C1=O ZINC000447857218 871777470 /nfs/dbraw/zinc/77/74/70/871777470.db2.gz VTIPJTBDDBUWKT-XMMPIXPASA-N 0 3 422.569 4.373 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)[C@H](C)N[C@@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000447885536 871799527 /nfs/dbraw/zinc/79/95/27/871799527.db2.gz HXGXNDLSFWUJGJ-BXWFABGCSA-N 0 3 402.922 4.433 20 0 HIADHN Cc1nc(-c2ccc(CCNCc3c(Br)c(C)nn3C)s2)cs1 ZINC000447936205 871819055 /nfs/dbraw/zinc/81/90/55/871819055.db2.gz NIFUZLGDXKGNKZ-UHFFFAOYSA-N 0 3 411.394 4.317 20 0 HIADHN Cc1ccc([C@H](NC[C@@H]2N(C)CCCC2(C)C)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000448020351 871864103 /nfs/dbraw/zinc/86/41/03/871864103.db2.gz BOMQEDNNUSTZAP-GOTSBHOMSA-N 0 3 414.615 4.198 20 0 HIADHN CO[C@H]1CCOc2c(NC(=O)NC[C@@H](c3cccs3)N3CCCC3)cccc21 ZINC000448049936 871880878 /nfs/dbraw/zinc/88/08/78/871880878.db2.gz MKYUOJBVGWKUAV-ROUUACIJSA-N 0 3 401.532 4.177 20 0 HIADHN O=S(=O)(c1c(Cl)cc(Cl)cc1Cl)N1CC[C@H]2[C@H](CCCN2C2CC2)C1 ZINC000448164131 872040397 /nfs/dbraw/zinc/04/03/97/872040397.db2.gz IETAESTWAIWYNQ-BZNIZROVSA-N 0 3 423.793 4.284 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NC[C@H]1CCSC1)c1ccc(C(F)(F)F)cc1 ZINC000448169156 872045019 /nfs/dbraw/zinc/04/50/19/872045019.db2.gz JSYUKMPNTJPQNR-PBHICJAKSA-N 0 3 403.514 4.141 20 0 HIADHN Cc1cc(C[C@@H](C)NC(=O)c2oc3ccccc3c2CN(C)C)n(-c2ccccc2)n1 ZINC000448188111 872068526 /nfs/dbraw/zinc/06/85/26/872068526.db2.gz AQUIDTSXWBWZEX-QGZVFWFLSA-N 0 3 416.525 4.350 20 0 HIADHN CCCN(C(=O)NC[C@]1(C)CCO[C@H]1C1CC1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000468536206 882568336 /nfs/dbraw/zinc/56/83/36/882568336.db2.gz LSSSQBHBYAQPRS-CUYJMHBOSA-N 0 3 413.606 4.278 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)c2ccc3cc(Br)ccc3c2)CC1 ZINC000448243440 872158455 /nfs/dbraw/zinc/15/84/55/872158455.db2.gz VVUPUOCYYVAYMS-UHFFFAOYSA-N 0 3 419.363 4.222 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)NCc1ccc(-c2ccco2)cc1F ZINC000448248975 872167339 /nfs/dbraw/zinc/16/73/39/872167339.db2.gz MHKMSWIKFUQFEQ-UHFFFAOYSA-N 0 3 401.507 4.421 20 0 HIADHN COc1cc(CN2C[C@@H](O)C(C)(C)C2)ccc1OCCOc1ccccc1Cl ZINC000448369130 872321267 /nfs/dbraw/zinc/32/12/67/872321267.db2.gz XROIFCAYAIWAFO-OAQYLSRUSA-N 0 3 405.922 4.009 20 0 HIADHN Cc1nn(C)c2ncc(CN3CCC[C@@H](Nc4cccc(Br)c4)C3)cc12 ZINC000448371991 872322112 /nfs/dbraw/zinc/32/21/12/872322112.db2.gz FWPRPKXCQWFBQS-GOSISDBHSA-N 0 3 414.351 4.116 20 0 HIADHN CCN(C(=O)Nc1ccc(C(=O)N2CCCC2)cc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000460130256 872611665 /nfs/dbraw/zinc/61/16/65/872611665.db2.gz DIZJJKLKCFCXQM-HSZRJFAPSA-N 0 3 420.557 4.051 20 0 HIADHN CCCN(CCN1CCN(CC)CC1)C(=O)N[C@@H](C)c1cc(Cl)ccc1Cl ZINC000460144087 872650986 /nfs/dbraw/zinc/65/09/86/872650986.db2.gz UIVAUXUHUHVDRH-INIZCTEOSA-N 0 3 415.409 4.114 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)c2ccc(NC(=O)CC(C)C)c(C)c2)c1 ZINC000460165780 872715557 /nfs/dbraw/zinc/71/55/57/872715557.db2.gz SNVZBTQZNOJYIQ-UHFFFAOYSA-N 0 3 409.574 4.492 20 0 HIADHN CCn1c(COCc2ccccc2)nnc1N1C[C@@H](C)N(Cc2ccccc2)C[C@H]1C ZINC000460181954 872744268 /nfs/dbraw/zinc/74/42/68/872744268.db2.gz YIKTWHWHDYRPOQ-NHCUHLMSSA-N 0 3 419.573 4.114 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)[C@H]2CCSc3ccccc32)cc1)[C@H]1CCCN(C)C1 ZINC000460214079 872800017 /nfs/dbraw/zinc/80/00/17/872800017.db2.gz GGIGTSZOQAHZDC-FPOVZHCZSA-N 0 3 423.582 4.071 20 0 HIADHN CN1CCC(N(Cc2ccccc2Br)C(=O)NC[C@H]2CC2(C)C)CC1 ZINC000460227457 872813558 /nfs/dbraw/zinc/81/35/58/872813558.db2.gz GPVDQICQOUPIST-MRXNPFEDSA-N 0 3 408.384 4.101 20 0 HIADHN C[C@@H](CNC(=O)N1CCCC[C@H]1c1nnc(C2CCC2)o1)N(C)Cc1ccccc1 ZINC000460277883 872865593 /nfs/dbraw/zinc/86/55/93/872865593.db2.gz VOBCJXBAKDYVPD-PXNSSMCTSA-N 0 3 411.550 4.094 20 0 HIADHN Cc1ccccc1[C@@H]1CN(C(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)[C@H](C)CO1 ZINC000460380077 873020596 /nfs/dbraw/zinc/02/05/96/873020596.db2.gz LAVGWTJXENSMRI-BWKNWUBXSA-N 0 3 421.585 4.128 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)NC(=O)N[C@H](C)CN(C)Cc2ccccc2)cc1 ZINC000460476023 873161956 /nfs/dbraw/zinc/16/19/56/873161956.db2.gz MPTVKHCFUHMXBI-MOPGFXCFSA-N 0 3 405.546 4.061 20 0 HIADHN Cc1ccc(CC[C@H](C)NC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)o1 ZINC000460508342 873195334 /nfs/dbraw/zinc/19/53/34/873195334.db2.gz FDNPWHHLYPCHRB-KKSFZXQISA-N 0 3 408.464 4.480 20 0 HIADHN Cc1ccc(CC[C@@H](C)NC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)o1 ZINC000460508341 873195469 /nfs/dbraw/zinc/19/54/69/873195469.db2.gz FDNPWHHLYPCHRB-IIBYNOLFSA-N 0 3 408.464 4.480 20 0 HIADHN CCCN(CCN1CCN(CC)CC1)C(=O)N[C@H](c1ccc(Cl)cc1)[C@@H]1C[C@@H]1C ZINC000460530593 873224664 /nfs/dbraw/zinc/22/46/64/873224664.db2.gz IGPFDAAIIGMCBC-VLCRHTCISA-N 0 3 421.029 4.096 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)c3ncoc3-c3ccccc3Cl)cc2)CC1 ZINC000460707799 873490124 /nfs/dbraw/zinc/49/01/24/873490124.db2.gz GDYGVHSXFFBQOE-UHFFFAOYSA-N 0 3 424.932 4.385 20 0 HIADHN CCOCCCn1c(-c2ccoc2)nnc1N1C[C@@H](C)N(Cc2ccccc2)C[C@H]1C ZINC000460720813 873519065 /nfs/dbraw/zinc/51/90/65/873519065.db2.gz CSWFQEZJSZAQLN-WOJBJXKFSA-N 0 3 423.561 4.064 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)[C@H](C)c3ccc(F)c(F)c3)CC2)c1 ZINC000460732086 873547549 /nfs/dbraw/zinc/54/75/49/873547549.db2.gz ZLTKFHTYZGXMCL-LJQANCHMSA-N 0 3 415.528 4.095 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)c2c[nH]cc2-c2ccc3c(c2)OCCO3)N(C)C)cc1 ZINC000460794424 873661938 /nfs/dbraw/zinc/66/19/38/873661938.db2.gz XCPQJUQISXGSMW-JOCHJYFZSA-N 0 3 419.525 4.048 20 0 HIADHN C[C@@H]1CC[C@H](NC(=O)N(Cc2ccccc2Br)C2CCN(C)CC2)C1 ZINC000460840685 873730273 /nfs/dbraw/zinc/73/02/73/873730273.db2.gz PMCBNXTYCGCKOR-WBVHZDCISA-N 0 3 408.384 4.244 20 0 HIADHN CCCN(C(=O)c1ccc(-n2cncn2)c(C)c1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000460878110 873787042 /nfs/dbraw/zinc/78/70/42/873787042.db2.gz DIWSOXMBQLQHMR-QHCPKHFHSA-N 0 3 417.557 4.093 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)N[C@H]1CCCc2cn(C3CCCC3)nc21 ZINC000460889945 873801278 /nfs/dbraw/zinc/80/12/78/873801278.db2.gz RVRTZLUELURXCZ-GCJKJVERSA-N 0 3 409.578 4.195 20 0 HIADHN O=C(NCc1ccccc1)[C@H](NC[C@H]1CCN(c2ccccc2F)C1)c1ccccc1 ZINC000461077187 873979152 /nfs/dbraw/zinc/97/91/52/873979152.db2.gz SPFMBRJTIQSOSN-PXDATVDWSA-N 0 3 417.528 4.299 20 0 HIADHN O=C(c1ccc(Oc2cccc(Cl)c2Cl)nn1)N1CC[C@H](N2CCCCC2)C1 ZINC000461079116 873983415 /nfs/dbraw/zinc/98/34/15/873983415.db2.gz CSATVBKEIXBCMU-AWEZNQCLSA-N 0 3 421.328 4.276 20 0 HIADHN CC[C@H](NCc1ccc(N2CCCS2(=O)=O)cc1)c1ccccc1OC(F)F ZINC000461095232 874011438 /nfs/dbraw/zinc/01/14/38/874011438.db2.gz OPZUCBJHXNZLMU-SFHVURJKSA-N 0 3 410.486 4.069 20 0 HIADHN CC[C@@H]1Cc2ccccc2CN1Cc1ccc(OCC(=O)N2CCCC2)c(OC)c1 ZINC000468685999 882811326 /nfs/dbraw/zinc/81/13/26/882811326.db2.gz BSLYQPYGZAYJRJ-JOCHJYFZSA-N 0 3 408.542 4.033 20 0 HIADHN COC(=O)[C@H](C)Oc1ccc(CNCc2cc3cc(Br)ccc3[nH]2)cc1 ZINC000468699944 882819904 /nfs/dbraw/zinc/81/99/04/882819904.db2.gz LQRPBAGVFXBNND-ZDUSSCGKSA-N 0 3 417.303 4.161 20 0 HIADHN O=C(CCNCc1ccccc1Oc1ccc(F)cc1Cl)NCc1cccnc1 ZINC000461407656 874423185 /nfs/dbraw/zinc/42/31/85/874423185.db2.gz QEALUPQVDWOGDD-UHFFFAOYSA-N 0 3 413.880 4.463 20 0 HIADHN C[C@H](CC(=O)N1CCC(N2CCc3ccccc3C2)CC1)C(=O)c1cccc(F)c1 ZINC000468717455 882827298 /nfs/dbraw/zinc/82/72/98/882827298.db2.gz NOXIQDJBRTYRGM-GOSISDBHSA-N 0 3 408.517 4.084 20 0 HIADHN COc1ccc(C(=O)CCCC(=O)N2C[C@@H]3CCN(Cc4ccccc4)C[C@@H]3C2)cc1 ZINC000461433251 874481840 /nfs/dbraw/zinc/48/18/40/874481840.db2.gz WLOJSLGSNKSKIZ-XZOQPEGZSA-N 0 3 420.553 4.029 20 0 HIADHN O=C(CCC(=O)N1C[C@H]2CCN(Cc3ccccc3)C[C@H]2C1)c1ccc(Cl)cc1 ZINC000461433324 874483040 /nfs/dbraw/zinc/48/30/40/874483040.db2.gz VUHWDZIURIATOA-RTWAWAEBSA-N 0 3 410.945 4.283 20 0 HIADHN Cc1cc(C(=O)CCC(=O)N2C[C@@H]3CCN(Cc4ccccc4)C[C@H]3C2)c(C)s1 ZINC000461444503 874500685 /nfs/dbraw/zinc/50/06/85/874500685.db2.gz LJLBOHRCHKPMMD-SFTDATJTSA-N 0 3 410.583 4.308 20 0 HIADHN CCOC(=O)[C@@](C)(CN[C@@H](C)C(=O)Nc1ccccc1C(F)(F)F)c1ccccc1 ZINC000468773908 882853991 /nfs/dbraw/zinc/85/39/91/882853991.db2.gz ASJYCMLXWFZJIP-BTYIYWSLSA-N 0 3 422.447 4.143 20 0 HIADHN CC(C)(C)[C@H](CN1CCc2ccccc2C1)NC(=O)c1ccoc1Br ZINC000468801566 882866268 /nfs/dbraw/zinc/86/62/68/882866268.db2.gz CDAAVXJBPRTZJO-KRWDZBQOSA-N 0 3 405.336 4.245 20 0 HIADHN CCc1nc2c(s1)[C@H](N[C@@H]1CCCN(Cc3ccc(F)cc3F)C1=O)CCC2 ZINC000468812389 882871756 /nfs/dbraw/zinc/87/17/56/882871756.db2.gz CFYNLJHZJFUWAV-SJLPKXTDSA-N 0 3 405.514 4.142 20 0 HIADHN COc1ccc(Oc2cc(CN[C@H](C)Cn3cc(Br)cn3)ccn2)cc1 ZINC000468822035 882876780 /nfs/dbraw/zinc/87/67/80/882876780.db2.gz DHRBSBCOHFKCOI-CQSZACIVSA-N 0 3 417.307 4.020 20 0 HIADHN C[C@H](Cn1cc(Br)cn1)NCc1ccc(Oc2ccc(F)cc2)nc1 ZINC000468826567 882878870 /nfs/dbraw/zinc/87/88/70/882878870.db2.gz DXOLHTWRKWEPBG-CYBMUJFWSA-N 0 3 405.271 4.150 20 0 HIADHN CC1CCN([C@@H](CNC(=O)N2CCC(OC(C)(C)C)CC2)c2ccccc2)CC1 ZINC000468827739 882879119 /nfs/dbraw/zinc/87/91/19/882879119.db2.gz DBOWOPMCLOMVIM-QFIPXVFZSA-N 0 3 401.595 4.449 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)N[C@H]1CCCc2cn(C3CCCC3)nc21 ZINC000461996660 875117624 /nfs/dbraw/zinc/11/76/24/875117624.db2.gz QYKPFRGNRGTUPP-GOTSBHOMSA-N 0 3 421.589 4.339 20 0 HIADHN C[C@H]1CCCN(c2cc(C(=O)N3CCCN(CCCc4ccccc4)CC3)ccn2)C1 ZINC000462023998 875140873 /nfs/dbraw/zinc/14/08/73/875140873.db2.gz AMJIMSSTHFTCQG-QFIPXVFZSA-N 0 3 420.601 4.099 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)N[C@H]1CCc2sc(Cl)cc21 ZINC000462052527 875164883 /nfs/dbraw/zinc/16/48/83/875164883.db2.gz YCIIMAPQODVOPE-INIZCTEOSA-N 0 3 413.921 4.440 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)N[C@@H]1CCCc2cn(C3CCCC3)nc21 ZINC000462159078 875254568 /nfs/dbraw/zinc/25/45/68/875254568.db2.gz ZHNAITDFNCXZFE-HXUWFJFHSA-N 0 3 415.607 4.211 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1cnn(-c2ccccc2)c1C1CC1 ZINC000462171586 875268331 /nfs/dbraw/zinc/26/83/31/875268331.db2.gz SSVGKPZBZGJEQN-WZONZLPQSA-N 0 3 400.526 4.000 20 0 HIADHN C[C@H](NC(=O)N1CC[C@H](CN(C)Cc2cccnc2)C1)c1ccc(C(F)(F)F)cc1 ZINC000462172901 875270685 /nfs/dbraw/zinc/27/06/85/875270685.db2.gz ZIBLNABAVMMRBM-FUHWJXTLSA-N 0 3 420.479 4.325 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)CSCc1coc(-c2ccccc2)n1 ZINC000462173467 875271282 /nfs/dbraw/zinc/27/12/82/875271282.db2.gz CSBRVRNMYBPSCF-PGRDOPGGSA-N 0 3 421.566 4.212 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1ccc(NC(=O)c2ccccc2)cc1 ZINC000462192708 875298404 /nfs/dbraw/zinc/29/84/04/875298404.db2.gz UIDNLQDITVXFBX-DVECYGJZSA-N 0 3 413.521 4.189 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)Cc1csc(-c2cccc(F)c2)n1 ZINC000462194675 875302791 /nfs/dbraw/zinc/30/27/91/875302791.db2.gz IRCKJSNFQPOQCS-IERDGZPVSA-N 0 3 409.530 4.128 20 0 HIADHN CN(C(=O)NC[C@@H](Cc1ccccc1)C(F)(F)F)[C@H]1CCN(Cc2ccccc2)C1 ZINC000462223616 875331548 /nfs/dbraw/zinc/33/15/48/875331548.db2.gz IULCTKFOOWWVAR-RTWAWAEBSA-N 0 3 419.491 4.324 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)NC[C@H](Cc2ccccc2)C(F)(F)F)o1 ZINC000462226889 875334538 /nfs/dbraw/zinc/33/45/38/875334538.db2.gz RHSQZGCDFWSETA-SFHVURJKSA-N 0 3 411.468 4.082 20 0 HIADHN Cc1nc(-c2ccc(CNC(=O)N[C@H]3CN(Cc4ccccc4)C[C@@H]3C)o2)cs1 ZINC000462308206 875429038 /nfs/dbraw/zinc/42/90/38/875429038.db2.gz IXUYDSHQYOZOQZ-KXBFYZLASA-N 0 3 410.543 4.031 20 0 HIADHN Cc1cc(C)cc(-c2ccc(CNCc3cccnc3N3CCN(C)CC3)cc2)c1 ZINC000462368974 875480993 /nfs/dbraw/zinc/48/09/93/875480993.db2.gz PFRIIUHGGSINEL-UHFFFAOYSA-N 0 3 400.570 4.407 20 0 HIADHN COc1ccc([C@@H](CNC(=O)NCc2ccc(C(F)F)cc2)N2CCCC2)cc1 ZINC000462526977 875645107 /nfs/dbraw/zinc/64/51/07/875645107.db2.gz OAKLAQBCRSPDBA-HXUWFJFHSA-N 0 3 403.473 4.269 20 0 HIADHN O=S1(=O)CCCN1c1cccc(CNCc2ccc(-c3ccccc3F)s2)c1 ZINC000462535909 875655455 /nfs/dbraw/zinc/65/54/55/875655455.db2.gz CSQWIIKNPDNYGO-UHFFFAOYSA-N 0 3 416.543 4.384 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2CNCc2sccc2Br)C[C@@H](C)O1 ZINC000462537394 875657398 /nfs/dbraw/zinc/65/73/98/875657398.db2.gz VSNDFYYXVNKYBA-HUUCEWRRSA-N 0 3 409.393 4.410 20 0 HIADHN O=S1(=O)CCCN1c1cccc(CNCc2ccc(-c3cccc(F)c3)s2)c1 ZINC000462542931 875665106 /nfs/dbraw/zinc/66/51/06/875665106.db2.gz PRUAUAMSWGKPNF-UHFFFAOYSA-N 0 3 416.543 4.384 20 0 HIADHN Cc1cc(C)cc(-c2ccc(CNCc3ccnc(N4CCN(C)CC4)c3)cc2)c1 ZINC000462685416 875778188 /nfs/dbraw/zinc/77/81/88/875778188.db2.gz PLHJNWUNULQVJQ-UHFFFAOYSA-N 0 3 400.570 4.407 20 0 HIADHN C[C@@H]1C[C@H](NCc2ccc(-n3ccc(C(F)(F)F)n3)cc2)C(=O)N1c1ccccc1 ZINC000462737755 875809813 /nfs/dbraw/zinc/80/98/13/875809813.db2.gz WNHARKFVSWOHFE-BEFAXECRSA-N 0 3 414.431 4.175 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@@H](C)N[C@@H]2CCCc3ccc(O)cc32)cc1 ZINC000462814012 875856372 /nfs/dbraw/zinc/85/63/72/875856372.db2.gz CPPRYCKZHITUDK-OPAMFIHVSA-N 0 3 402.560 4.151 20 0 HIADHN Cn1c(CNC[C@@H]2CCN(c3ccccc3F)C2)nc2cc(C(F)(F)F)ccc21 ZINC000462910472 875935858 /nfs/dbraw/zinc/93/58/58/875935858.db2.gz JZGLFASWBBXQKJ-AWEZNQCLSA-N 0 3 406.427 4.347 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N[C@H](c1cccc(F)c1)c1ccccn1 ZINC000463014478 876031169 /nfs/dbraw/zinc/03/11/69/876031169.db2.gz WKFHBYZDLDMKCQ-PUZWTLIVSA-N 0 3 418.516 4.130 20 0 HIADHN CCc1nc(C)c([C@H](C)N(C)C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)s1 ZINC000463018267 876035945 /nfs/dbraw/zinc/03/59/45/876035945.db2.gz BYLAEPALYBXKJB-HHXXYDBFSA-N 0 3 400.592 4.237 20 0 HIADHN COc1ccc(-c2nn(Cc3ccccc3)cc2CN2CC[C@@H](n3cccn3)C2)cc1 ZINC000463023972 876042340 /nfs/dbraw/zinc/04/23/40/876042340.db2.gz JSQHZIZVJLUESQ-HSZRJFAPSA-N 0 3 413.525 4.251 20 0 HIADHN CC(C)c1nn(-c2ccc(Br)cc2)cc1CN1CC[C@@H](n2cccn2)C1 ZINC000463039703 876064479 /nfs/dbraw/zinc/06/44/79/876064479.db2.gz ZARSHCGBJVZVSP-LJQANCHMSA-N 0 3 414.351 4.402 20 0 HIADHN CC(C)Cc1ccc([C@H](C)C(=O)Nc2ccccc2CN2CCC[C@H](C(N)=O)C2)cc1 ZINC000468932655 882997175 /nfs/dbraw/zinc/99/71/75/882997175.db2.gz LLWMSGSGLJGEFF-CVDCTZTESA-N 0 3 421.585 4.325 20 0 HIADHN CC[C@H](O[C@H]1CCC[C@H](C)C1)C(=O)Nc1ccc(CN2CCN(CC)CC2)cc1 ZINC000463106808 876145087 /nfs/dbraw/zinc/14/50/87/876145087.db2.gz BDUFKUDOBLVEBF-VJBMBRPKSA-N 0 3 401.595 4.137 20 0 HIADHN C[C@H](C(=O)N[C@@H]1CCO[C@H](c2ccccc2)C1)N1CCC(Cc2ccccc2)CC1 ZINC000463118623 876161956 /nfs/dbraw/zinc/16/19/56/876161956.db2.gz DHFDIHPXJHBEHC-ZPZUNKDASA-N 0 3 406.570 4.366 20 0 HIADHN CC(C)n1cc(Br)cc1C(=O)N[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000463152175 876204624 /nfs/dbraw/zinc/20/46/24/876204624.db2.gz REZWLWSVLUEVAV-QAPCUYQASA-N 0 3 404.352 4.397 20 0 HIADHN CC(C)c1nn(C)c2sc(C(=O)N3CCCN(CC4CCCCC4)CC3)cc12 ZINC000463193091 876250822 /nfs/dbraw/zinc/25/08/22/876250822.db2.gz UIUBFVSNGHOCDJ-UHFFFAOYSA-N 0 3 402.608 4.486 20 0 HIADHN CCN1CC[C@@H](NCc2cncc(C(F)(F)F)c2)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000463197088 876256366 /nfs/dbraw/zinc/25/63/66/876256366.db2.gz OEZJXSDNZBFERN-AEFFLSMTSA-N 0 3 403.370 4.443 20 0 HIADHN COC(=O)c1ccc(-c2nc(CN3CCCC[C@@H]3[C@@H]3C[C@@H](C)CC[C@@H]3O)co2)cc1 ZINC000463208412 876267828 /nfs/dbraw/zinc/26/78/28/876267828.db2.gz XMPUXGVTHNZLAY-ZIPUMODLSA-N 0 3 412.530 4.280 20 0 HIADHN CCOC(=O)c1ccc2c(c1)nc(CN1CCCC[C@@H]1[C@H]1CCCC[C@H]1O)n2CC ZINC000463218323 876276134 /nfs/dbraw/zinc/27/61/34/876276134.db2.gz JUZMBDMVSMMMDO-SYYKKAFVSA-N 0 3 413.562 4.139 20 0 HIADHN CCOC(=O)c1ccc2c(c1)nc(CN1CCCC[C@@H]1[C@@H]1CCCC[C@@H]1O)n2CC ZINC000463218322 876276669 /nfs/dbraw/zinc/27/66/69/876276669.db2.gz JUZMBDMVSMMMDO-DWLFOUALSA-N 0 3 413.562 4.139 20 0 HIADHN COc1cccc(Oc2ncccc2CN[C@@H](C)Cn2cc(Br)cn2)c1 ZINC000468951041 883016449 /nfs/dbraw/zinc/01/64/49/883016449.db2.gz KCBYOEXSLSSVIB-AWEZNQCLSA-N 0 3 417.307 4.020 20 0 HIADHN COc1ccc(NC(=O)[C@H](C)N2[C@H](C)CC[C@@H]2C)cc1OCc1cn2ccccc2n1 ZINC000463332607 876387825 /nfs/dbraw/zinc/38/78/25/876387825.db2.gz BTIULTGJPVQSST-KSZLIROESA-N 0 3 422.529 4.122 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NC[C@@H]1CCN(c2ccccc2F)C1)c1ccsc1 ZINC000463344775 876398778 /nfs/dbraw/zinc/39/87/78/876398778.db2.gz MIIMQSPJUPSAFF-UWJYYQICSA-N 0 3 418.582 4.096 20 0 HIADHN COc1c(Br)c(C)sc1C(=O)NCCCN1CCc2ccccc2C1 ZINC000463412176 876465134 /nfs/dbraw/zinc/46/51/34/876465134.db2.gz HXNOHNBTBOKMOA-UHFFFAOYSA-N 0 3 423.376 4.006 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2c[nH]nc2-c2cccc(OC(F)F)c2)N(C)C)cc1 ZINC000463510170 876573010 /nfs/dbraw/zinc/57/30/10/876573010.db2.gz ASTQWKXRVTTYIK-LJQANCHMSA-N 0 3 414.456 4.019 20 0 HIADHN CCc1ccc([C@H](CNC(=O)c2c(C)nn(C)c2Sc2ccccc2)N(C)C)cc1 ZINC000463524503 876594194 /nfs/dbraw/zinc/59/41/94/876594194.db2.gz QSHUVQDPWNYYGE-NRFANRHFSA-N 0 3 422.598 4.475 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)c1ccc(F)c(Br)c1 ZINC000463527504 876599709 /nfs/dbraw/zinc/59/97/09/876599709.db2.gz LJJXGRBBHQFHNM-UHFFFAOYSA-N 0 3 415.253 4.070 20 0 HIADHN CCCCN1CCCC[C@@H]1CNC(=O)c1scc(C)c1I ZINC000469001442 883068075 /nfs/dbraw/zinc/06/80/75/883068075.db2.gz QWNSLGYUWSUJEU-CYBMUJFWSA-N 0 3 420.360 4.046 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)[C@@H]1C[C@H]1c1cc(F)c(F)c(F)c1 ZINC000463709360 876827740 /nfs/dbraw/zinc/82/77/40/876827740.db2.gz KKQAEXHYWQXXGQ-ZWKOTPCHSA-N 0 3 420.500 4.437 20 0 HIADHN C[C@@H](C(=O)NC[C@H]1CCCN1Cc1ccccc1)c1ccc(Br)s1 ZINC000463742202 876863536 /nfs/dbraw/zinc/86/35/36/876863536.db2.gz VFGRXJCEXOPETL-GDBMZVCRSA-N 0 3 407.377 4.395 20 0 HIADHN COc1ccc(Cn2nc(C)c(CNC[C@@H](c3ccc(C)o3)N3CCCC3)c2C)cc1 ZINC000463747779 876870205 /nfs/dbraw/zinc/87/02/05/876870205.db2.gz IRNJHPKWNJXHAA-DEOSSOPVSA-N 0 3 422.573 4.385 20 0 HIADHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)c1ccoc1C(F)(F)F ZINC000463816823 876930400 /nfs/dbraw/zinc/93/04/00/876930400.db2.gz JVSDZINDHFISFK-UHFFFAOYSA-N 0 3 419.241 4.265 20 0 HIADHN COc1ccc([C@H](N[C@@H]2CCCN(Cc3ccc(F)cc3F)C2=O)C2CC2)cc1 ZINC000469011576 883079765 /nfs/dbraw/zinc/07/97/65/883079765.db2.gz ONLONMSVXSQKKV-FGZHOGPDSA-N 0 3 400.469 4.205 20 0 HIADHN COc1ccc([C@@H](N[C@H]2CCCN(Cc3ccc(F)cc3F)C2=O)C2CC2)cc1 ZINC000469011578 883079963 /nfs/dbraw/zinc/07/99/63/883079963.db2.gz ONLONMSVXSQKKV-VXKWHMMOSA-N 0 3 400.469 4.205 20 0 HIADHN CN(CCN(Cc1ccccc1)C(=O)Nc1cn(C)nc1C1CC1)Cc1ccccc1 ZINC000463849260 876972351 /nfs/dbraw/zinc/97/23/51/876972351.db2.gz JIUIYRLLXGVAKF-UHFFFAOYSA-N 0 3 417.557 4.464 20 0 HIADHN CCC(CC)c1cc(CNC(=O)NC[C@H](c2ccc(OC)cc2)N2CCCC2)on1 ZINC000463973624 877101592 /nfs/dbraw/zinc/10/15/92/877101592.db2.gz MVGACLLYKZUQGO-JOCHJYFZSA-N 0 3 414.550 4.223 20 0 HIADHN CN(C(=O)C(C)(C)c1csc(-c2c(F)cccc2Cl)n1)[C@@H]1CCCN(C)C1 ZINC000464054248 877197023 /nfs/dbraw/zinc/19/70/23/877197023.db2.gz UXQANDDRNNQIML-CYBMUJFWSA-N 0 3 409.958 4.433 20 0 HIADHN Cc1cc(NC(=O)c2ncsc2C(C)C)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000464209415 877377838 /nfs/dbraw/zinc/37/78/38/877377838.db2.gz VWVXIZIKFSOVFH-GOSISDBHSA-N 0 3 409.559 4.471 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)NCc1cccc(-c2cccnc2)c1 ZINC000464292277 877478943 /nfs/dbraw/zinc/47/89/43/877478943.db2.gz DBSUGOYCJLNMKT-DVECYGJZSA-N 0 3 400.526 4.068 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1CCCc2sc(-c3ccc(F)cc3)nc21)C1=CCN(C)CC1 ZINC000464308133 877498485 /nfs/dbraw/zinc/49/84/85/877498485.db2.gz OQHUHCCPOJTXCC-KBXCAEBGSA-N 0 3 414.550 4.276 20 0 HIADHN O=C(NCc1cccc(-c2cccnc2)c1)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000464311714 877503555 /nfs/dbraw/zinc/50/35/55/877503555.db2.gz OKMGURAVVPHPSX-DEOSSOPVSA-N 0 3 400.526 4.385 20 0 HIADHN O=C(c1cc(COc2ccccc2F)on1)N1C[C@H]2CCCN2Cc2ccccc21 ZINC000464444093 877658804 /nfs/dbraw/zinc/65/88/04/877658804.db2.gz SAQYUQQGQGMBEZ-QGZVFWFLSA-N 0 3 407.445 4.018 20 0 HIADHN COc1ccccc1S(=O)(=O)CCCN[C@@H](C)c1cccc(OC(F)(F)F)c1 ZINC000464483661 877702849 /nfs/dbraw/zinc/70/28/49/877702849.db2.gz DTDJAPOFEACTDT-AWEZNQCLSA-N 0 3 417.449 4.108 20 0 HIADHN CC(C)CN(C(=O)[C@H]1C[C@]12CCc1cc(Br)ccc12)C1CCN(C)CC1 ZINC000464572668 877793370 /nfs/dbraw/zinc/79/33/70/877793370.db2.gz HOXZKWWYRZJZNT-IRLDBZIGSA-N 0 3 419.407 4.232 20 0 HIADHN C[C@H](CNC(=O)c1cccc(CN2CCCC2)c1)Oc1ccc(Br)cc1 ZINC000464636700 877853766 /nfs/dbraw/zinc/85/37/66/877853766.db2.gz HHMAMAYVHDLEGW-MRXNPFEDSA-N 0 3 417.347 4.242 20 0 HIADHN C[C@H](CNC(=O)c1cccc(CN2CCCC2)c1)Oc1cccc(Br)c1 ZINC000464660831 877881898 /nfs/dbraw/zinc/88/18/98/877881898.db2.gz DDVDTVMZBUBXBP-MRXNPFEDSA-N 0 3 417.347 4.242 20 0 HIADHN COc1cc(F)c(F)cc1NC(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000464669485 877889657 /nfs/dbraw/zinc/88/96/57/877889657.db2.gz ZPGUURUILRUPOU-LJQANCHMSA-N 0 3 414.374 4.367 20 0 HIADHN CCC[C@@H]1[C@H](C)CCCN1CC(=O)N(C)CC(=O)Nc1ccccc1C(F)(F)F ZINC000464731992 877967306 /nfs/dbraw/zinc/96/73/06/877967306.db2.gz HXAVICLBWRXQKL-CRAIPNDOSA-N 0 3 413.484 4.003 20 0 HIADHN COc1ccc([C@H](CNC(=O)CN2C[C@@H]3CCC[C@H]3C2)c2c[nH]c3ccccc32)cc1 ZINC000464877352 878167917 /nfs/dbraw/zinc/16/79/17/878167917.db2.gz JEJLCGCAZJIAJN-JTAQYXEDSA-N 0 3 417.553 4.157 20 0 HIADHN C[C@H]1CCN(C(=O)Cc2ccc(F)c(Br)c2)CCN1Cc1ccccc1 ZINC000464890040 878189863 /nfs/dbraw/zinc/18/98/63/878189863.db2.gz GSSOVEYZORDYKC-INIZCTEOSA-N 0 3 419.338 4.254 20 0 HIADHN C[C@H]1CCN(C(=O)c2cnn(-c3ccc(Cl)cc3)c2)CCN1Cc1ccccc1 ZINC000464891198 878192022 /nfs/dbraw/zinc/19/20/22/878192022.db2.gz JHVAPUGFAGJHDA-SFHVURJKSA-N 0 3 408.933 4.262 20 0 HIADHN Cc1oc(-c2ccsc2)nc1CC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1 ZINC000464895297 878199486 /nfs/dbraw/zinc/19/94/86/878199486.db2.gz QOBFOXZHOKGBKI-KRWDZBQOSA-N 0 3 409.555 4.377 20 0 HIADHN C[C@@H]1CCN(C(=O)CCc2ncc(-c3ccccc3)o2)CCN1Cc1ccccc1 ZINC000464898099 878204168 /nfs/dbraw/zinc/20/41/68/878204168.db2.gz HBNQDLLEJHHAME-HXUWFJFHSA-N 0 3 403.526 4.397 20 0 HIADHN COc1ccc(C(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)cc1OC(F)F ZINC000464902691 878214393 /nfs/dbraw/zinc/21/43/93/878214393.db2.gz SPIIPWSVCPPTIK-INIZCTEOSA-N 0 3 404.457 4.033 20 0 HIADHN C[C@H]1CCN(C(=O)Cc2ccc(OC(F)(F)F)cc2)CCN1Cc1ccccc1 ZINC000464904891 878219088 /nfs/dbraw/zinc/21/90/88/878219088.db2.gz HWDRBMQGLNDGFL-KRWDZBQOSA-N 0 3 406.448 4.251 20 0 HIADHN Cc1c(C(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)cnn1-c1cccc(C)c1 ZINC000464906399 878222163 /nfs/dbraw/zinc/22/21/63/878222163.db2.gz NBVOMTZBVWPIMZ-HXUWFJFHSA-N 0 3 402.542 4.226 20 0 HIADHN COC(=O)c1ccsc1N1CC[C@H](N[C@H](Cc2ccccc2)c2ccccc2)C1=O ZINC000465081347 878443176 /nfs/dbraw/zinc/44/31/76/878443176.db2.gz VGQFUEAODOQOTL-LEWJYISDSA-N 0 3 420.534 4.214 20 0 HIADHN Cc1ccc(-c2nc(CNC(=O)c3ccc(N4CCN(C(C)C)CC4)cc3)co2)cc1 ZINC000465193239 878592480 /nfs/dbraw/zinc/59/24/80/878592480.db2.gz NQHXIWRGMLKAPV-UHFFFAOYSA-N 0 3 418.541 4.110 20 0 HIADHN O=C([C@@H](c1ccccc1)N1CCC[C@@H](c2ncc3n2CCCC3)C1)N1CCCCC1 ZINC000503407981 912389068 /nfs/dbraw/zinc/38/90/68/912389068.db2.gz GUTGYMQDZDDFBU-FYYLOGMGSA-N 0 3 406.574 4.153 20 0 HIADHN CCN(Cc1cccc(-c2ccncc2)c1)C(=O)NC[C@H](Cc1ccccc1)N(C)C ZINC000465433618 878865121 /nfs/dbraw/zinc/86/51/21/878865121.db2.gz NXZKFUZWUVCMCJ-VWLOTQADSA-N 0 3 416.569 4.453 20 0 HIADHN CCO[C@H](C)c1nc(CN(C)C(=O)NC[C@@H](c2ccc(CC)cc2)N(C)C)cs1 ZINC000465434116 878866531 /nfs/dbraw/zinc/86/65/31/878866531.db2.gz PEAKAGZISPFNRW-UZLBHIALSA-N 0 3 418.607 4.247 20 0 HIADHN O=C(c1cccc(CN2CCC[C@H](c3ncc4n3CCCC4)C2)c1)N1CCCCC1 ZINC000503411210 912393334 /nfs/dbraw/zinc/39/33/34/912393334.db2.gz ZZFJAERPCDLGMF-QFIPXVFZSA-N 0 3 406.574 4.225 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)NC(=O)c2ccc(CN3CCSCC3)cc2)cc1 ZINC000465472835 878910019 /nfs/dbraw/zinc/91/00/19/878910019.db2.gz XUFQPEYCGIIFNF-GOSISDBHSA-N 0 3 420.582 4.221 20 0 HIADHN COc1cccc([C@H](CNC(=O)NC[C@@H](C)c2ccc(F)cc2F)N2CCCC2)c1 ZINC000465482107 878921501 /nfs/dbraw/zinc/92/15/01/878921501.db2.gz WXBFBHPVBJQJEX-ZHRRBRCNSA-N 0 3 417.500 4.213 20 0 HIADHN C[C@H]1CCN(C(=O)NCCc2cccc3cccnc32)CCN1Cc1ccccc1 ZINC000465482329 878921949 /nfs/dbraw/zinc/92/19/49/878921949.db2.gz HJLABAAVNDZQEC-FQEVSTJZSA-N 0 3 402.542 4.083 20 0 HIADHN C[C@H]1CCN(C(=O)NCc2cccnc2OC2CCCC2)CCN1Cc1ccccc1 ZINC000465510174 878949352 /nfs/dbraw/zinc/94/93/52/878949352.db2.gz BIROWWQMBORKLK-FQEVSTJZSA-N 0 3 422.573 4.209 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCCc1nc(C(F)(F)F)cs1)c1ccsc1 ZINC000465516048 878961451 /nfs/dbraw/zinc/96/14/51/878961451.db2.gz ASFWKESDIWZQLM-ZDUSSCGKSA-N 0 3 420.526 4.148 20 0 HIADHN CCN1CCN(Cc2ccc(CNC(=O)N3CC[C@@H](C)C[C@@H]3c3ccco3)cc2)CC1 ZINC000465518460 878967467 /nfs/dbraw/zinc/96/74/67/878967467.db2.gz DWOKSBMBIFIQGD-NFBKMPQASA-N 0 3 424.589 4.100 20 0 HIADHN O[C@H](COc1ccc(Cl)cc1Cl)CN1CCC[C@@H](c2ncc3n2CCCC3)C1 ZINC000503416601 912403601 /nfs/dbraw/zinc/40/36/01/912403601.db2.gz RKTWALIPNSWAMA-QAPCUYQASA-N 0 3 424.372 4.146 20 0 HIADHN CC[C@@H](CNC(=O)N(C)[C@H](C)Cc1ccccc1OC)N1CCc2ccccc2C1 ZINC000465525120 878978333 /nfs/dbraw/zinc/97/83/33/878978333.db2.gz KIZULMPWWFUZLK-XXBNENTESA-N 0 3 409.574 4.105 20 0 HIADHN CC[C@H](CNC(=O)N[C@H](C)c1cccc(-n2cccn2)c1)N1CCc2ccccc2C1 ZINC000465535349 878993861 /nfs/dbraw/zinc/99/38/61/878993861.db2.gz AWJAMPJDBGUFRA-AUSIDOKSSA-N 0 3 417.557 4.069 20 0 HIADHN CC[C@H](CNC(=O)N[C@@H](C)c1cccc(-n2cccn2)c1)N1CCc2ccccc2C1 ZINC000465535351 878994371 /nfs/dbraw/zinc/99/43/71/878994371.db2.gz AWJAMPJDBGUFRA-WMZHIEFXSA-N 0 3 417.557 4.069 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1C[C@H](C)O[C@@H](c2ccc(F)cc2)C1)c1ccsc1 ZINC000465534465 878994535 /nfs/dbraw/zinc/99/45/35/878994535.db2.gz QUIBLSJILREHKE-ZLGUVYLKSA-N 0 3 419.566 4.442 20 0 HIADHN CC[C@H](CNC(=O)N[C@H](C)c1ccc(-n2cccn2)cc1)N1CCc2ccccc2C1 ZINC000465538132 878998682 /nfs/dbraw/zinc/99/86/82/878998682.db2.gz GAQDKZFDRVBXIS-AUSIDOKSSA-N 0 3 417.557 4.069 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)CSc1ccc(O)cc1 ZINC000465557420 879027947 /nfs/dbraw/zinc/02/79/47/879027947.db2.gz GNYQVCYXNSARFK-UHFFFAOYSA-N 0 3 412.477 4.094 20 0 HIADHN C[C@@H]1CCN(C(=O)NCCCN2CCN(C)C[C@@H]2c2ccccc2)[C@H](c2ccco2)C1 ZINC000465588804 879071160 /nfs/dbraw/zinc/07/11/60/879071160.db2.gz DPKFVLNCHBGOGL-AKIFATBCSA-N 0 3 424.589 4.141 20 0 HIADHN CC[C@H](C)c1ccc([C@@H](NC(=O)NC[C@@H](C)CN2CCN(C)CC2)C(C)C)cc1 ZINC000465632520 879144539 /nfs/dbraw/zinc/14/45/39/879144539.db2.gz OSIOOJRMEHFBAE-QTEQDKRBSA-N 0 3 402.627 4.080 20 0 HIADHN COc1ccc(Cl)cc1CNC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1 ZINC000465679507 879222375 /nfs/dbraw/zinc/22/23/75/879222375.db2.gz IXUKVLIZTCXTMV-KRWDZBQOSA-N 0 3 401.938 4.155 20 0 HIADHN Cc1ccc(-c2nc(CNC(=O)N[C@H]3CCCN(Cc4ccccc4)C3)co2)cc1 ZINC000465690015 879240857 /nfs/dbraw/zinc/24/08/57/879240857.db2.gz MGXOGRPQACPMIE-NRFANRHFSA-N 0 3 404.514 4.114 20 0 HIADHN C[C@@H]1CCN(C(=O)NC[C@@H]2CCCO[C@@H]2c2ccccc2)CCN1Cc1ccccc1 ZINC000465730792 879310383 /nfs/dbraw/zinc/31/03/83/879310383.db2.gz WEFKEPGYRCAFQP-IEZKXTBUSA-N 0 3 421.585 4.460 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)NCc2ccc(C(=O)OC(C)(C)C)cc2)C1 ZINC000465759693 879355368 /nfs/dbraw/zinc/35/53/68/879355368.db2.gz POSRGKJTKJHYBP-PGRDOPGGSA-N 0 3 423.557 4.277 20 0 HIADHN C[C@@H]1CCN(C(=O)NCCCCN(C)c2ccccc2)CCN1Cc1ccccc1 ZINC000465764382 879360365 /nfs/dbraw/zinc/36/03/65/879360365.db2.gz UOGIRLWSMAYPLM-JOCHJYFZSA-N 0 3 408.590 4.209 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N[C@@H](C)c2nc(-c3cccc(F)c3)no2)C1 ZINC000465767075 879365639 /nfs/dbraw/zinc/36/56/39/879365639.db2.gz YRFPGIRANRCIML-YRNRMSPPSA-N 0 3 423.492 4.071 20 0 HIADHN C[C@H]1CCN(C(=O)NCc2ccccc2Br)CCN1Cc1ccccc1 ZINC000465771667 879373047 /nfs/dbraw/zinc/37/30/47/879373047.db2.gz BGSFELQNBXTYNT-KRWDZBQOSA-N 0 3 416.363 4.255 20 0 HIADHN C[C@@H]1CCN(C(=O)NCc2cccc(OC(F)F)c2)CCN1Cc1ccccc1 ZINC000465814366 879436996 /nfs/dbraw/zinc/43/69/96/879436996.db2.gz PRGKGERANFPCLO-QGZVFWFLSA-N 0 3 403.473 4.094 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N2CC[C@@H](COCc3ccccc3)C2)N2CCCC2)cc1 ZINC000465816200 879438486 /nfs/dbraw/zinc/43/84/86/879438486.db2.gz SBVVBAFLJNWQKU-ILBGXUMGSA-N 0 3 421.585 4.380 20 0 HIADHN CCC[C@H](NC(=O)N(CCN(C)C)C[C@@H]1CCCO1)c1cccc(C(F)(F)F)c1 ZINC000465844946 879484877 /nfs/dbraw/zinc/48/48/77/879484877.db2.gz MUHWWKUBKNQDDT-OALUTQOASA-N 0 3 415.500 4.299 20 0 HIADHN C[C@@H]1CCN(C(=O)NCc2nc(C(C)(C)C)cs2)CCN1Cc1ccccc1 ZINC000465855637 879500379 /nfs/dbraw/zinc/50/03/79/879500379.db2.gz BBZRXXZGMTWATK-QGZVFWFLSA-N 0 3 400.592 4.247 20 0 HIADHN CC[C@@H](NC(=O)NC[C@@H](C)N(C)Cc1ccccc1)c1nc(C(F)(F)F)cs1 ZINC000465865920 879516527 /nfs/dbraw/zinc/51/65/27/879516527.db2.gz AWLRURQPMUVLAP-UKRRQHHQSA-N 0 3 414.497 4.433 20 0 HIADHN CC[C@H](NC(=O)NC[C@H](C)N(C)Cc1ccccc1)c1nc(C(F)(F)F)cs1 ZINC000465865921 879517159 /nfs/dbraw/zinc/51/71/59/879517159.db2.gz AWLRURQPMUVLAP-ZFWWWQNUSA-N 0 3 414.497 4.433 20 0 HIADHN CN(C)CCN(C[C@H]1CCCO1)C(=O)NCc1ccccc1Sc1ccccc1 ZINC000465900806 879561582 /nfs/dbraw/zinc/56/15/82/879561582.db2.gz BIZCTVGMKKFSIY-HXUWFJFHSA-N 0 3 413.587 4.090 20 0 HIADHN Cc1cccc2[nH]cc(CCNC(=O)N3CC[C@H](C)N(Cc4ccccc4)CC3)c21 ZINC000465910232 879571905 /nfs/dbraw/zinc/57/19/05/879571905.db2.gz ZDMFAQSAAISEHV-FQEVSTJZSA-N 0 3 404.558 4.325 20 0 HIADHN C[C@H](NC(=O)NC[C@@H]1CCCN1Cc1ccccc1)c1nc(C2CCCCC2)no1 ZINC000465921831 879584257 /nfs/dbraw/zinc/58/42/57/879584257.db2.gz ANTNSPKJQCUTGK-PXNSSMCTSA-N 0 3 411.550 4.142 20 0 HIADHN CC[C@@H](NC(=O)N(CCN(C)C)Cc1ccc(Br)cc1)c1ccncc1 ZINC000465951008 879618795 /nfs/dbraw/zinc/61/87/95/879618795.db2.gz FFQJOJIZGJEOBH-LJQANCHMSA-N 0 3 419.367 4.069 20 0 HIADHN Cc1cccc(COc2ccc([C@@H](C)NC(=O)N3CC[C@H](N4CC=CC4)C3)cc2)c1 ZINC000465953523 879620879 /nfs/dbraw/zinc/62/08/79/879620879.db2.gz QBKJJEYYXSACRV-OFNKIYASSA-N 0 3 405.542 4.291 20 0 HIADHN CCC[C@@H](CCc1ccccc1)NC(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000466053099 879744039 /nfs/dbraw/zinc/74/40/39/879744039.db2.gz PMFDWGHOQDABSC-IMSXRSKXSA-N 0 3 415.622 4.319 20 0 HIADHN COc1ccccc1[C@H](NC(=O)N(C)[C@H]1CCN(C2CC2)C1)c1ccccc1Cl ZINC000466095460 879814044 /nfs/dbraw/zinc/81/40/44/879814044.db2.gz FGXSHLTYXIWZGE-HTAPYJJXSA-N 0 3 413.949 4.316 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)N(C)[C@H](C)c2ccc(-c3ccccc3)cc2)CC1 ZINC000466111191 879825881 /nfs/dbraw/zinc/82/58/81/879825881.db2.gz YCUKYBBWXILHQF-FGZHOGPDSA-N 0 3 422.617 4.330 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)N2CCC(c3cccc4ccccc43)CC2)CC1 ZINC000466115022 879828346 /nfs/dbraw/zinc/82/83/46/879828346.db2.gz XQEPUQZTSYBQJH-NRFANRHFSA-N 0 3 422.617 4.002 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N[C@H](c3ncc(C)s3)C3CC3)c(C)c2)CC1 ZINC000466121937 879835504 /nfs/dbraw/zinc/83/55/04/879835504.db2.gz ZCQQJVHPQGFNGT-FQEVSTJZSA-N 0 3 413.591 4.175 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N[C@@H](C)c3c(F)cccc3OC)c(C)c2)CC1 ZINC000466122352 879836527 /nfs/dbraw/zinc/83/65/27/879836527.db2.gz QRIPHVDTABTJLB-KRWDZBQOSA-N 0 3 414.525 4.167 20 0 HIADHN C[C@H](CNC(=O)N(CC1CCCCC1)CC1CCCCC1)CN1CCN(C)CC1 ZINC000466141549 879851436 /nfs/dbraw/zinc/85/14/36/879851436.db2.gz WDCUHNGDOGGZGZ-OAQYLSRUSA-N 0 3 406.659 4.042 20 0 HIADHN C[C@@H](CNC(=O)N(Cc1ccco1)C1CCN(C)CC1)Oc1cccc(Cl)c1 ZINC000466211466 879902058 /nfs/dbraw/zinc/90/20/58/879902058.db2.gz VEXMNADQNDJMHG-INIZCTEOSA-N 0 3 405.926 4.006 20 0 HIADHN CCOc1ccc([C@H](C)NC(=O)N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)cc1OC ZINC000466217928 879913004 /nfs/dbraw/zinc/91/30/04/879913004.db2.gz METKDETXKAFYJT-LVCYWYKZSA-N 0 3 411.546 4.117 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)N[C@H](c2ccccc2)c2cccnc2)CN1Cc1ccccc1 ZINC000466236591 879942170 /nfs/dbraw/zinc/94/21/70/879942170.db2.gz APATZKUSXQIRQZ-VEXUSMLFSA-N 0 3 400.526 4.133 20 0 HIADHN COc1ccc([C@H](CNC(=O)Nc2ccc(NC(=O)C(C)C)cc2)N2CCCC2)cc1 ZINC000503476875 912517580 /nfs/dbraw/zinc/51/75/80/912517580.db2.gz AABUWIIVLUTXSN-QFIPXVFZSA-N 0 3 424.545 4.248 20 0 HIADHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)[C@H]1CCCC(F)(F)C1 ZINC000503482429 912525620 /nfs/dbraw/zinc/52/56/20/912525620.db2.gz KQPAWUPGBQRCAW-HNNXBMFYSA-N 0 3 403.311 4.165 20 0 HIADHN C[C@H](NCc1cncc(Br)c1)[C@H](OC1CCOCC1)c1ccccc1 ZINC000466362209 880120752 /nfs/dbraw/zinc/12/07/52/880120752.db2.gz JQXFUKYKLOKQDH-YWZLYKJASA-N 0 3 405.336 4.259 20 0 HIADHN Cc1cc(CNCc2c[nH]nc2-c2cccs2)ccc1I ZINC000466364803 880123516 /nfs/dbraw/zinc/12/35/16/880123516.db2.gz OMGGJRUUFSLJLO-UHFFFAOYSA-N 0 3 409.296 4.341 20 0 HIADHN Cc1oc2ccccc2c1C(=O)Nc1ccc(C(=O)N(C)[C@@H]2CCCN(C)C2)cc1 ZINC000466434904 880209526 /nfs/dbraw/zinc/20/95/26/880209526.db2.gz NQNFPAOWJSUACP-LJQANCHMSA-N 0 3 405.498 4.160 20 0 HIADHN C[C@H](NC(=O)N(CCN(C)C)CC1CCCCC1)c1nc(-c2cccc(F)c2)no1 ZINC000466465312 880247745 /nfs/dbraw/zinc/24/77/45/880247745.db2.gz PVIQABPVWZQQDY-INIZCTEOSA-N 0 3 417.529 4.090 20 0 HIADHN C[C@H]1C[C@H](NC(=O)N(C)Cc2ccccc2N2CCCC2)CN1Cc1ccccc1 ZINC000466511457 880286207 /nfs/dbraw/zinc/28/62/07/880286207.db2.gz BOWCEHVCNZDACK-REWPJTCUSA-N 0 3 406.574 4.091 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)Nc2cccc(OC[C@H]3CCCO3)c2)CN1Cc1ccccc1 ZINC000466515623 880289870 /nfs/dbraw/zinc/28/98/70/880289870.db2.gz BZZNXLRUSXYUNC-JMUQELJHSA-N 0 3 409.530 4.029 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)N(Cc2cccs2)C[C@@H]2CCCO2)CN1Cc1ccccc1 ZINC000466516743 880291798 /nfs/dbraw/zinc/29/17/98/880291798.db2.gz SIZAVIJRCWWOIN-GIVPXCGWSA-N 0 3 413.587 4.102 20 0 HIADHN C[C@H]1C[C@H](NC(=O)Nc2cccc(C(=O)N3CCCCC3)c2)CN1Cc1ccccc1 ZINC000466523214 880299721 /nfs/dbraw/zinc/29/97/21/880299721.db2.gz VAMYGKVVZWFXOD-CVDCTZTESA-N 0 3 420.557 4.097 20 0 HIADHN C[C@H]1C[C@H](NC(=O)N2CCC(C(F)(F)F)(C(F)(F)F)C2)CN1Cc1ccccc1 ZINC000466529000 880305168 /nfs/dbraw/zinc/30/51/68/880305168.db2.gz IZPZCMSABJNDGY-ZFWWWQNUSA-N 0 3 423.401 4.176 20 0 HIADHN COCCCCN(Cc1ccccc1)C(=O)N[C@H]1C[C@H](C)N(Cc2ccccc2)C1 ZINC000466529589 880305716 /nfs/dbraw/zinc/30/57/16/880305716.db2.gz OSFFRTHWJMJKKB-URXFXBBRSA-N 0 3 409.574 4.288 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)N1CCO[C@@H](c2cccc(Cl)c2)C1 ZINC000466566747 880341709 /nfs/dbraw/zinc/34/17/09/880341709.db2.gz YFWVAVHMLDEBQY-FGZHOGPDSA-N 0 3 413.949 4.260 20 0 HIADHN CCc1c(NC(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)cnn1-c1ccccc1 ZINC000466653738 880430288 /nfs/dbraw/zinc/43/02/88/880430288.db2.gz DHRDWUJHQICLAP-AZUAARDMSA-N 0 3 403.530 4.219 20 0 HIADHN CCc1c(NC(=O)N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)cnn1-c1ccccc1 ZINC000466653841 880430671 /nfs/dbraw/zinc/43/06/71/880430671.db2.gz DHRDWUJHQICLAP-UYAOXDASSA-N 0 3 403.530 4.219 20 0 HIADHN CN(C)[C@@H](CNC(=O)Nc1cc(Br)c(F)cc1F)Cc1ccccc1 ZINC000466669658 880454762 /nfs/dbraw/zinc/45/47/62/880454762.db2.gz PYSBOISZKHPHIB-CYBMUJFWSA-N 0 3 412.278 4.022 20 0 HIADHN FC(F)(F)Oc1ccc(OCCN2CCC[C@H](c3nnc4n3CCCCC4)C2)cc1 ZINC000466739073 880522419 /nfs/dbraw/zinc/52/24/19/880522419.db2.gz FXXQMTQYLTZGOG-INIZCTEOSA-N 0 3 424.467 4.162 20 0 HIADHN COCC[C@H]1CCCCN(C(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)C1 ZINC000466847013 880616135 /nfs/dbraw/zinc/61/61/35/880616135.db2.gz SQXLXECHOKYDOZ-TZIWHRDSSA-N 0 3 412.496 4.106 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)N[C@H]1C[C@H](c2ccc(Cl)c(Cl)c2)C1 ZINC000466847470 880617345 /nfs/dbraw/zinc/61/73/45/880617345.db2.gz SNMOYWLVKDVULV-SAABIXHNSA-N 0 3 421.372 4.408 20 0 HIADHN COc1ccc(CNCCN2CCc3ccccc3C2=O)cc1OCc1ccccc1 ZINC000466910459 880679731 /nfs/dbraw/zinc/67/97/31/880679731.db2.gz HPGLNZZOUAJVOV-UHFFFAOYSA-N 0 3 416.521 4.062 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1cccc(-c2cc[nH]n2)c1)c1cccc(OC)c1 ZINC000466914570 880683301 /nfs/dbraw/zinc/68/33/01/880683301.db2.gz WEDNRKHTVPQBDG-QFIPXVFZSA-N 0 3 407.518 4.290 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)NCc1ccc(-c2cccnc2)cc1 ZINC000466942976 880714420 /nfs/dbraw/zinc/71/44/20/880714420.db2.gz MKIOLAYIKWPLTD-UHFFFAOYSA-N 0 3 424.495 4.300 20 0 HIADHN Cc1ccc([C@H]2OCCC[C@H]2CNC(=O)N(CCN(C)C)Cc2ccccc2)cc1 ZINC000466949780 880725791 /nfs/dbraw/zinc/72/57/91/880725791.db2.gz FMWOTRCUPYFIEI-BJKOFHAPSA-N 0 3 409.574 4.236 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)c2cccc(-c3noc(C4CC4)n3)c2)CN1Cc1ccccc1 ZINC000467021322 880823247 /nfs/dbraw/zinc/82/32/47/880823247.db2.gz GDTXNHVYHWXBMC-IERDGZPVSA-N 0 3 402.498 4.007 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)c2cnn(-c3ccccc3)c2C2CC2)CN1Cc1ccccc1 ZINC000467028157 880827756 /nfs/dbraw/zinc/82/77/56/880827756.db2.gz GMASABGNJADHPC-NQIIRXRSSA-N 0 3 400.526 4.143 20 0 HIADHN C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)Cc1csc(-c2ccc(Cl)cc2Cl)n1 ZINC000467050094 880842499 /nfs/dbraw/zinc/84/24/99/880842499.db2.gz WTGHUOCNPVPRQU-PIGZYNQJSA-N 0 3 410.370 4.258 20 0 HIADHN COc1ccc(-c2cnc(CCC(=O)N[C@H]3C[C@@H](C)N(Cc4ccccc4)C3)o2)cc1 ZINC000467053394 880843310 /nfs/dbraw/zinc/84/33/10/880843310.db2.gz IGLGPVAQEDZGDM-NQIIRXRSSA-N 0 3 419.525 4.062 20 0 HIADHN CC(C)[C@@H](Cc1ccc(F)cc1)NC(=O)N(Cc1ccco1)C1CCN(C)CC1 ZINC000467060940 880846867 /nfs/dbraw/zinc/84/68/67/880846867.db2.gz UDRFIIFFLKHCKN-JOCHJYFZSA-N 0 3 401.526 4.292 20 0 HIADHN COCCOc1c(Cl)cccc1NC(=O)N[C@H]1C[C@@H](C)N(Cc2ccccc2)C1 ZINC000467113081 880871789 /nfs/dbraw/zinc/87/17/89/880871789.db2.gz OYFGHMQVOIJQIE-AEFFLSMTSA-N 0 3 417.937 4.150 20 0 HIADHN Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)N[C@@H]1C[C@@H](C)N(Cc2ccccc2)C1 ZINC000467116698 880873785 /nfs/dbraw/zinc/87/37/85/880873785.db2.gz MHYJHPRYRSNPJS-DENIHFKCSA-N 0 3 420.557 4.016 20 0 HIADHN C[C@H](C(=O)N(C)C1CCN(CCc2ccccn2)CC1)c1ccc(C(F)(F)F)cc1 ZINC000467177626 880906261 /nfs/dbraw/zinc/90/62/61/880906261.db2.gz WCPXMEJWVHTHFZ-KRWDZBQOSA-N 0 3 419.491 4.369 20 0 HIADHN O=C(Nc1ccccc1)NC1CCN(CCOc2ccc(OC(F)(F)F)cc2)CC1 ZINC000467184526 880910059 /nfs/dbraw/zinc/91/00/59/880910059.db2.gz WCSGFFXMCTZQMI-UHFFFAOYSA-N 0 3 423.435 4.250 20 0 HIADHN Cc1ccc(-c2cncc(C(=O)N3CCC(CN4C[C@@H](C)O[C@@H](C)C4)CC3)c2)cc1 ZINC000467254971 880987039 /nfs/dbraw/zinc/98/70/39/880987039.db2.gz WYOQKNPPORLMBA-BGYRXZFFSA-N 0 3 407.558 4.018 20 0 HIADHN FC(F)(F)c1nnc(N2CCCN(CCCSCc3ccccc3)CC2)s1 ZINC000467274389 881016616 /nfs/dbraw/zinc/01/66/16/881016616.db2.gz WUQUBUPSLSVDGB-UHFFFAOYSA-N 0 3 416.538 4.393 20 0 HIADHN O=C(NCCc1cccc2[nH]ccc21)Nc1ccc(CCN2CCSCC2)cc1 ZINC000503559768 912634692 /nfs/dbraw/zinc/63/46/92/912634692.db2.gz MBOGNYPFCZJIAI-UHFFFAOYSA-N 0 3 408.571 4.123 20 0 HIADHN C[C@H](CC(=O)Nc1cccc(Cl)c1)NCc1cc(Cl)ccc1N1CCOCC1 ZINC000467336044 881086811 /nfs/dbraw/zinc/08/68/11/881086811.db2.gz NFUALBPOYCWZGA-OAHLLOKOSA-N 0 3 422.356 4.337 20 0 HIADHN COc1ccc2c(c1)[C@@H](NC[C@H](O)COc1ccccc1Br)CCS2 ZINC000467391323 881173817 /nfs/dbraw/zinc/17/38/17/881173817.db2.gz BXMCELOYPAGIEG-GUYCJALGSA-N 0 3 424.360 4.024 20 0 HIADHN OCCOc1ccccc1CN[C@H](c1cccc(Br)c1)C1CCOCC1 ZINC000467410162 881197830 /nfs/dbraw/zinc/19/78/30/881197830.db2.gz DUFJZZRADCUDHR-NRFANRHFSA-N 0 3 420.347 4.078 20 0 HIADHN CC[C@H](NCc1cc(Cl)ccc1N1CCOCC1)c1ccc(OC)c(OC)c1 ZINC000467414659 881200955 /nfs/dbraw/zinc/20/09/55/881200955.db2.gz AXLITJVAFMFRDY-IBGZPJMESA-N 0 3 404.938 4.435 20 0 HIADHN Cc1cc(C(F)(F)F)ccc1CN[C@@H](C)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000467415359 881203403 /nfs/dbraw/zinc/20/34/03/881203403.db2.gz DPNNJFJKARHIHH-AWEZNQCLSA-N 0 3 400.466 4.115 20 0 HIADHN COc1ccc2c(c1)[C@H](NC[C@@H](O)COc1ccc(C(F)(F)F)cc1)CCS2 ZINC000467420120 881208668 /nfs/dbraw/zinc/20/86/68/881208668.db2.gz QOSWNKHXQWTRDH-RDTXWAMCSA-N 0 3 413.461 4.280 20 0 HIADHN Cc1cc(NC(=O)N[C@@H](C)CC(F)(F)F)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000467437480 881234851 /nfs/dbraw/zinc/23/48/51/881234851.db2.gz BKFXRDQOVBRFTK-RDJZCZTQSA-N 0 3 409.456 4.101 20 0 HIADHN Cc1nc(-c2cccnc2)sc1[C@H](C)N[C@@H]1CC(=O)N(Cc2ccccc2)[C@@H]1C ZINC000467440701 881241014 /nfs/dbraw/zinc/24/10/14/881241014.db2.gz WMSCRCKDNUJVPE-XAUMDUMWSA-N 0 3 406.555 4.354 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)c(Cl)c1 ZINC000467463604 881274597 /nfs/dbraw/zinc/27/45/97/881274597.db2.gz HBEXNYANKGTGAN-KBXCAEBGSA-N 0 3 400.910 4.083 20 0 HIADHN CCSCc1ccccc1C(=O)NCCCCN1CCN(c2ccccc2)CC1 ZINC000469054506 883126831 /nfs/dbraw/zinc/12/68/31/883126831.db2.gz PXWYRHRFBJMKKR-UHFFFAOYSA-N 0 3 411.615 4.272 20 0 HIADHN Cc1ccc([C@H](CCn2cncn2)NCc2ccc(C)nc2-n2cc(Cl)cn2)cc1 ZINC000469056629 883130515 /nfs/dbraw/zinc/13/05/15/883130515.db2.gz UFBMNQPOWIQEPR-NRFANRHFSA-N 0 3 421.936 4.050 20 0 HIADHN CSc1ccc([C@@H](C)N[C@H](C)C(=O)N[C@H](C)c2ccc3c(c2)OCCO3)cc1 ZINC000503587392 912672128 /nfs/dbraw/zinc/67/21/28/912672128.db2.gz TVOBQHVIOCSPQU-BZUAXINKSA-N 0 3 400.544 4.096 20 0 HIADHN Cc1c2cc(C)ccc2sc1C(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000469073587 883155871 /nfs/dbraw/zinc/15/58/71/883155871.db2.gz SFJRFYWMQBYMKZ-IAGOWNOFSA-N 0 3 400.588 4.480 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)c1cccc(Br)c1F ZINC000469100644 883191366 /nfs/dbraw/zinc/19/13/66/883191366.db2.gz VUIRPDPCAKAMRH-MRXNPFEDSA-N 0 3 420.326 4.110 20 0 HIADHN C[C@@H](N[C@@H]1CCCN(Cc2ccc(F)cc2F)C1=O)c1ccc2ncsc2c1 ZINC000469154290 883251870 /nfs/dbraw/zinc/25/18/70/883251870.db2.gz YTYYRYDGYIWCHR-BFUOFWGJSA-N 0 3 401.482 4.416 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)NCC3(c4cc(C(F)(F)F)ccc4Cl)CC3)[C@H]2C1 ZINC000469181251 883279803 /nfs/dbraw/zinc/27/98/03/883279803.db2.gz GBLDYKFQRAWINQ-GUYCJALGSA-N 0 3 415.887 4.126 20 0 HIADHN O=C1[C@@H](NCc2cccc(-c3cccnc3)c2)CCCN1Cc1ccc(F)cc1F ZINC000469213757 883312413 /nfs/dbraw/zinc/31/24/13/883312413.db2.gz MZLCHEMLDABVCU-QHCPKHFHSA-N 0 3 407.464 4.308 20 0 HIADHN NC(=O)C1CCN(c2ncccc2CN[C@H](CC2CC2)c2ccc(Cl)cc2)CC1 ZINC000469246882 883344932 /nfs/dbraw/zinc/34/49/32/883344932.db2.gz WPIIUUGOKWCDAC-OAQYLSRUSA-N 0 3 412.965 4.068 20 0 HIADHN Cc1csc(Nc2ccc(NC(=O)CCN3CCN(c4ccccc4)CC3)cc2)n1 ZINC000469318723 883422695 /nfs/dbraw/zinc/42/26/95/883422695.db2.gz GWVICEVEUFWSBI-UHFFFAOYSA-N 0 3 421.570 4.346 20 0 HIADHN CCN(C(=O)c1ccc(O[C@@H]2CCOC2)cc1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000469323482 883430952 /nfs/dbraw/zinc/43/09/52/883430952.db2.gz SIYQTHLBYGTJMV-ZFJSRUIDSA-N 0 3 408.542 4.152 20 0 HIADHN Cc1ccc(C(=O)NC2CC2)cc1NC(=O)N[C@@H](CN(C)Cc1ccccc1)C(C)C ZINC000469455733 883663389 /nfs/dbraw/zinc/66/33/89/883663389.db2.gz YEHZCYHNMNKCGG-QHCPKHFHSA-N 0 3 422.573 4.165 20 0 HIADHN Cc1nc2ccc(C(=O)Nc3ccc(C(=O)N(C)[C@H]4CCCN(C)C4)cc3)cc2s1 ZINC000469469064 883692501 /nfs/dbraw/zinc/69/25/01/883692501.db2.gz QWYYEJJKSUFAAH-IBGZPJMESA-N 0 3 422.554 4.023 20 0 HIADHN CSc1nc(C)c(CCC(=O)N[C@@H](CN(C)Cc2ccccc2)C(C)C)c(C)n1 ZINC000469480001 883710658 /nfs/dbraw/zinc/71/06/58/883710658.db2.gz OMAXGGLOEOUPLA-NRFANRHFSA-N 0 3 414.619 4.021 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)c1ccc2c(c1)NC(=O)[C@@H](C)S2 ZINC000469479182 883711017 /nfs/dbraw/zinc/71/10/17/883711017.db2.gz CLMGPLJZCLDPRT-OXQOHEQNSA-N 0 3 411.571 4.006 20 0 HIADHN Cc1cccc2nc(CCC(=O)NC[C@H](c3cccc(C(F)(F)F)c3)N(C)C)[nH]c21 ZINC000469488060 883725401 /nfs/dbraw/zinc/72/54/01/883725401.db2.gz OHZDDMJAZZLEDX-GOSISDBHSA-N 0 3 418.463 4.242 20 0 HIADHN Cc1oc(-c2ccccc2)nc1CC(=O)N[C@@H](CN(C)Cc1ccccc1)C(C)C ZINC000469504560 883752763 /nfs/dbraw/zinc/75/27/63/883752763.db2.gz HDMLRQFDHXPNGI-QHCPKHFHSA-N 0 3 405.542 4.465 20 0 HIADHN CCN(CC)CC(=O)N[C@@H](C)c1sc(-c2ccc(Br)cc2)nc1C ZINC000503648266 912754030 /nfs/dbraw/zinc/75/40/30/912754030.db2.gz OCDKWRLVASKYPQ-LBPRGKRZSA-N 0 3 410.381 4.400 20 0 HIADHN Cc1cc(Br)cc(C)c1NC(=O)CCCN[C@H](CCO)c1ccco1 ZINC000469526890 883799059 /nfs/dbraw/zinc/79/90/59/883799059.db2.gz HTKGCAYPQCSLDS-MRXNPFEDSA-N 0 3 409.324 4.091 20 0 HIADHN CC(=O)Nc1ccccc1CC(=O)N1CCN(Cc2ccccc2)C2(CCCCC2)C1 ZINC000469576971 883820637 /nfs/dbraw/zinc/82/06/37/883820637.db2.gz SHRRMNSLEZMXQG-UHFFFAOYSA-N 0 3 419.569 4.235 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)NCCc3c[nH]c4ccc(Cl)cc34)CC2)c1 ZINC000469595418 883828830 /nfs/dbraw/zinc/82/88/30/883828830.db2.gz UELYMWKWISPDDC-UHFFFAOYSA-N 0 3 424.976 4.001 20 0 HIADHN Cc1cccc(NC(=O)N2CCC(CN3C[C@@H](C)O[C@H](C)C3)CC2)c1Br ZINC000469598186 883829464 /nfs/dbraw/zinc/82/94/64/883829464.db2.gz DOPSXJIHPXAUJH-HZPDHXFCSA-N 0 3 424.383 4.111 20 0 HIADHN COc1cccc([C@@H](CNC(=O)Nc2ccccc2-n2ccc(C)n2)N2CCCC2)c1 ZINC000469646814 883847418 /nfs/dbraw/zinc/84/74/18/883847418.db2.gz ZKTBKNCYOUUEFI-HSZRJFAPSA-N 0 3 419.529 4.148 20 0 HIADHN CCn1cnnc1-c1ccccc1NC(=O)N[C@H](CN(C)Cc1ccccc1)C(C)C ZINC000469679737 883866776 /nfs/dbraw/zinc/86/67/76/883866776.db2.gz JRNXSQJPVAFARI-JOCHJYFZSA-N 0 3 420.561 4.243 20 0 HIADHN COc1ccc2c(c1)[C@H](N(Cc1ccccc1)C(=O)CN1[C@H](C)CC[C@H]1C)CCO2 ZINC000469699412 883878160 /nfs/dbraw/zinc/87/81/60/883878160.db2.gz IETYLDRKRPZQJY-DNVFCKCGSA-N 0 3 408.542 4.420 20 0 HIADHN COC(=O)c1cccc(NC(=O)CN[C@@H](CC(C)(C)C)c2ccc(Cl)cc2)n1 ZINC000469759985 883925329 /nfs/dbraw/zinc/92/53/29/883925329.db2.gz FZQORBWWVHRICI-KRWDZBQOSA-N 0 3 403.910 4.227 20 0 HIADHN Cc1ccc(C(=O)CCCCC(=O)NC[C@@H]2CN(Cc3ccccc3)CCCO2)cc1 ZINC000469828845 884009952 /nfs/dbraw/zinc/00/99/52/884009952.db2.gz FBFINBGTHZSLHQ-XMMPIXPASA-N 0 3 422.569 4.145 20 0 HIADHN COc1cc(Cl)c(Cl)cc1C(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000469845501 884028535 /nfs/dbraw/zinc/02/85/35/884028535.db2.gz WYOKKWBAXUKQRC-MRXNPFEDSA-N 0 3 423.340 4.023 20 0 HIADHN Cc1c2cccc(Cl)c2oc1C(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000469853704 884037524 /nfs/dbraw/zinc/03/75/24/884037524.db2.gz KSDFRLSWWSKULG-GOSISDBHSA-N 0 3 412.917 4.416 20 0 HIADHN CN(C)CCN(C[C@@H]1CCCO1)C(=O)Nc1ccccc1Oc1cc(F)cc(F)c1 ZINC000469854021 884038362 /nfs/dbraw/zinc/03/83/62/884038362.db2.gz DQKPCBUTYXZFEP-SFHVURJKSA-N 0 3 419.472 4.332 20 0 HIADHN O=C(NC[C@H]1CN(Cc2ccccc2)CCCO1)c1cc(F)c(Cl)cc1Cl ZINC000469854564 884039416 /nfs/dbraw/zinc/03/94/16/884039416.db2.gz MQAYNCZGVKJOKS-HNNXBMFYSA-N 0 3 411.304 4.153 20 0 HIADHN CC(C)(C(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1)c1cccc(Cl)c1 ZINC000469855634 884040390 /nfs/dbraw/zinc/04/03/90/884040390.db2.gz QEMQFDUDCDFMJX-NRFANRHFSA-N 0 3 400.950 4.025 20 0 HIADHN CO[C@](C)(C(=O)Nc1cc(C)cc(N2CCN(C(C)C)CC2)c1)c1ccccc1F ZINC000469856204 884041960 /nfs/dbraw/zinc/04/19/60/884041960.db2.gz SAVVAYPBSMSLLN-DEOSSOPVSA-N 0 3 413.537 4.165 20 0 HIADHN Cc1cc(CCCC(=O)NC[C@H]2CN(Cc3ccccc3)CCCO2)c(C)s1 ZINC000469867112 884057386 /nfs/dbraw/zinc/05/73/86/884057386.db2.gz SYDYRQSFYLEGSG-QFIPXVFZSA-N 0 3 400.588 4.095 20 0 HIADHN COc1cccc(Cl)c1C(=O)NC1CCN(CCOc2ccc(Cl)cc2)CC1 ZINC000469873680 884063334 /nfs/dbraw/zinc/06/33/34/884063334.db2.gz OALYGMXGOWSPKD-UHFFFAOYSA-N 0 3 423.340 4.275 20 0 HIADHN Cc1ccc(CNC(=O)C2CCN(Cc3ccc4c(c3)COC(C)(C)O4)CC2)cc1 ZINC000469909396 884098549 /nfs/dbraw/zinc/09/85/49/884098549.db2.gz SDRHSWZQLJHHDU-UHFFFAOYSA-N 0 3 408.542 4.169 20 0 HIADHN C[C@@H](CO)N1CCCN(C(=O)Nc2cc(Cl)ccc2Oc2ccccc2)CC1 ZINC000469916652 884107340 /nfs/dbraw/zinc/10/73/40/884107340.db2.gz KHUDKKXVBCTNAO-INIZCTEOSA-N 0 3 403.910 4.053 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)N3CC[C@@H](c4ccc(Cl)cc4)C3)CC2)c1 ZINC000469965007 884173067 /nfs/dbraw/zinc/17/30/67/884173067.db2.gz HEFWIXBMVANTHH-OAQYLSRUSA-N 0 3 411.977 4.177 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@H]2NC(=O)N(Cc2ccco2)C2CCN(C)CC2)cc1 ZINC000470043247 884285923 /nfs/dbraw/zinc/28/59/23/884285923.db2.gz HEYYJSRDZJKFMT-PKTZIBPZSA-N 0 3 411.546 4.114 20 0 HIADHN CC1CCN([C@H](CNC(=O)N[C@H]2CCCC[C@H]2n2cccn2)c2cccs2)CC1 ZINC000470049597 884293921 /nfs/dbraw/zinc/29/39/21/884293921.db2.gz GFBGHZFGBPYJGH-XUVXKRRUSA-N 0 3 415.607 4.201 20 0 HIADHN C[C@H](CO)N1CCCN(C(=O)c2cc(F)ccc2-c2cccc(C(F)(F)F)c2)CC1 ZINC000470050083 884294432 /nfs/dbraw/zinc/29/44/32/884294432.db2.gz ZLXNUJMRGAARSG-OAHLLOKOSA-N 0 3 424.438 4.040 20 0 HIADHN COc1cc(C2(C(=O)Nc3cccc(N4CCN(C(C)C)CC4)c3)CC2)ccc1C ZINC000503751788 912815714 /nfs/dbraw/zinc/81/57/14/912815714.db2.gz VAPBECKKONGTMK-UHFFFAOYSA-N 0 3 407.558 4.204 20 0 HIADHN C[C@@H](CO)N1CCCN(Cc2nc(-c3cc(Cl)ccc3Cl)cs2)CC1 ZINC000470137391 884402522 /nfs/dbraw/zinc/40/25/22/884402522.db2.gz KAQJJFZTWDQQOQ-ZDUSSCGKSA-N 0 3 400.375 4.005 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)[C@@H](OC1CCOCC1)c1ccccc1 ZINC000470166768 884444027 /nfs/dbraw/zinc/44/40/27/884444027.db2.gz HZIBBXAZHYGJLI-DQEYMECFSA-N 0 3 424.585 4.196 20 0 HIADHN Cc1ccccc1-c1cc(NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)n(C)n1 ZINC000470186805 884478982 /nfs/dbraw/zinc/47/89/82/884478982.db2.gz CTNOLOQXIWQWAR-LJQANCHMSA-N 0 3 406.505 4.385 20 0 HIADHN Cc1ccc([C@@H](Cc2ccccc2Br)N[C@H](C)C(=O)NCCF)cc1 ZINC000503883262 912849950 /nfs/dbraw/zinc/84/99/50/912849950.db2.gz CRLXDEJZFUEEJA-DNVCBOLYSA-N 0 3 407.327 4.105 20 0 HIADHN C[C@@H](CO)N1CCCN(C(=O)Nc2ccc(Sc3ccccc3Cl)cc2)CC1 ZINC000470360817 884754864 /nfs/dbraw/zinc/75/48/64/884754864.db2.gz GMOILBPDUTVOOK-INIZCTEOSA-N 0 3 419.978 4.412 20 0 HIADHN CC[C@@H](NCC(=O)N[C@@H]1CCOc2ccccc21)c1cccc(Br)c1 ZINC000503918624 912863812 /nfs/dbraw/zinc/86/38/12/912863812.db2.gz ALJQEBBXXZGCFN-QZTJIDSGSA-N 0 3 403.320 4.130 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(Oc2ccc(Br)cc2)cc1)C(=O)NCCF ZINC000503920825 912864925 /nfs/dbraw/zinc/86/49/25/912864925.db2.gz PLPDCNGQXVZODW-ZIAGYGMSSA-N 0 3 409.299 4.366 20 0 HIADHN O=C(CN[C@@H](Cc1ccc(F)cc1)c1ccccc1)N[C@H]1CCOc2ccccc21 ZINC000503920175 912865048 /nfs/dbraw/zinc/86/50/48/912865048.db2.gz KXEQGGJIIJXFLN-GOTSBHOMSA-N 0 3 404.485 4.339 20 0 HIADHN CCCOc1cc(F)ccc1NC(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000470417492 884820221 /nfs/dbraw/zinc/82/02/21/884820221.db2.gz GQVOBCLUOQKSLN-QZTJIDSGSA-N 0 3 421.557 4.358 20 0 HIADHN CCCOc1cc(F)ccc1NC(=O)N1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000470417493 884820721 /nfs/dbraw/zinc/82/07/21/884820721.db2.gz GQVOBCLUOQKSLN-ROUUACIJSA-N 0 3 421.557 4.358 20 0 HIADHN Cc1cccc(NC(=O)C[C@@H](C)N[C@@H](Cn2ccccc2=O)c2ccccc2)c1C ZINC000503927307 912868181 /nfs/dbraw/zinc/86/81/81/912868181.db2.gz PDIMCZWOSIQLED-XXBNENTESA-N 0 3 403.526 4.213 20 0 HIADHN C[C@@H]1CN(C2CCOCC2)CCN1C(=O)CCCc1ccc2c(c1)-c1ccccc1C2 ZINC000470477691 884867334 /nfs/dbraw/zinc/86/73/34/884867334.db2.gz OZRLLWSNHXRHLK-HXUWFJFHSA-N 0 3 418.581 4.292 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1nnc(-c2cc3ccccc3o2)s1 ZINC000470507677 884896185 /nfs/dbraw/zinc/89/61/85/884896185.db2.gz OJJSQINXAHBDGT-UHFFFAOYSA-N 0 3 411.487 4.140 20 0 HIADHN Cc1cccc(Oc2cc(CNC(=O)CC3(N4CCOCC4)CCCC3)ccn2)c1C ZINC000470533975 884933518 /nfs/dbraw/zinc/93/35/18/884933518.db2.gz MYQUVSXKVLOOOF-UHFFFAOYSA-N 0 3 423.557 4.142 20 0 HIADHN CCN1CCN(c2ccc(C(=O)NC[C@H]3CCCO[C@H]3c3ccc(C)cc3)cc2)CC1 ZINC000470542092 884948288 /nfs/dbraw/zinc/94/82/88/884948288.db2.gz DWLOLCNVXJVVIR-NOZRDPDXSA-N 0 3 421.585 4.035 20 0 HIADHN O[C@@H](COCc1cccs1)CN1CC[C@H](Oc2ccc(Cl)c(Cl)c2)C1 ZINC000470568155 884985121 /nfs/dbraw/zinc/98/51/21/884985121.db2.gz FAMPIYUYJXEHGL-HIFRSBDPSA-N 0 3 402.343 4.086 20 0 HIADHN C[C@@H]1[C@@H](C(F)(F)F)CCN1C(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000470628122 885054103 /nfs/dbraw/zinc/05/41/03/885054103.db2.gz RBTLNMXOCRCASN-KMFMINBZSA-N 0 3 408.386 4.240 20 0 HIADHN C[C@@H]1[C@@H](C(F)(F)F)CCN1C(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000470628123 885054650 /nfs/dbraw/zinc/05/46/50/885054650.db2.gz RBTLNMXOCRCASN-UKPHBRMFSA-N 0 3 408.386 4.240 20 0 HIADHN C[C@@H]1C[C@H]1C(=O)Nc1ccc(C(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000470654553 885076708 /nfs/dbraw/zinc/07/67/08/885076708.db2.gz UIBAOPLMMWIIMP-YFXJRYMSSA-N 0 3 405.542 4.018 20 0 HIADHN CSc1cc(C(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)ccc1NC(C)=O ZINC000470656612 885079049 /nfs/dbraw/zinc/07/90/49/885079049.db2.gz IQLFRZPAMKCSAU-HXUWFJFHSA-N 0 3 411.571 4.104 20 0 HIADHN COc1cc(C(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)ccc1OCC(C)C ZINC000470656429 885079098 /nfs/dbraw/zinc/07/90/98/885079098.db2.gz HSPUNUMILJJSIL-QFIPXVFZSA-N 0 3 410.558 4.467 20 0 HIADHN Cc1cc(C(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)c2c(n1)onc2C(C)C ZINC000470676906 885109081 /nfs/dbraw/zinc/10/90/81/885109081.db2.gz BXUHAQQYCJXTTN-LJQANCHMSA-N 0 3 406.530 4.391 20 0 HIADHN CN(C(=O)Cc1ccc(Br)s1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470679913 885110391 /nfs/dbraw/zinc/11/03/91/885110391.db2.gz BZZUIXSELMXKPA-INIZCTEOSA-N 0 3 407.377 4.176 20 0 HIADHN CCOC(=O)c1cc2cc(C(=O)N(C)[C@@H]3CCCN(Cc4ccccc4)C3)ccc2[nH]1 ZINC000470678820 885110855 /nfs/dbraw/zinc/11/08/55/885110855.db2.gz MJAQOAFSTVWFFE-OAQYLSRUSA-N 0 3 419.525 4.081 20 0 HIADHN COc1ccc(C(=O)C2CCN(C[C@@H](O)Cc3ccc4ccccc4c3)CC2)cc1 ZINC000470718583 885160142 /nfs/dbraw/zinc/16/01/42/885160142.db2.gz UQKABYDILINACK-DEOSSOPVSA-N 0 3 403.522 4.347 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N(C)Cc2nc(C(F)(F)F)cs2)C1 ZINC000470722476 885169555 /nfs/dbraw/zinc/16/95/55/885169555.db2.gz JUCRVHHSQAILSD-UKRRQHHQSA-N 0 3 412.481 4.139 20 0 HIADHN C[C@@H](CCc1ccc2c(c1)OCO2)NC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470723213 885171475 /nfs/dbraw/zinc/17/14/75/885171475.db2.gz NWJJXIIHCUTYRA-UGKGYDQZSA-N 0 3 423.557 4.042 20 0 HIADHN COc1ccc(CC[C@H](C)NC(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000470725669 885175933 /nfs/dbraw/zinc/17/59/33/885175933.db2.gz IBNRUBKXHLXJQR-NZQKXSOJSA-N 0 3 409.574 4.322 20 0 HIADHN CCN(CC)[C@H](CNC(=O)CCc1cnc2ccccc2c1)c1cccc(OC)c1 ZINC000470729518 885181558 /nfs/dbraw/zinc/18/15/58/885181558.db2.gz HWOLCUVNGDOSKS-XMMPIXPASA-N 0 3 405.542 4.375 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N(C)Cc1nccs1)c1ccc(C(F)(F)F)cc1 ZINC000470733305 885187145 /nfs/dbraw/zinc/18/71/45/885187145.db2.gz QZIOSXNHDLYHGN-MRXNPFEDSA-N 0 3 414.497 4.386 20 0 HIADHN CN(C(=O)NCc1ccccc1OC(F)F)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470742013 885205010 /nfs/dbraw/zinc/20/50/10/885205010.db2.gz DVALNZOMPIHFHR-IBGZPJMESA-N 0 3 403.473 4.094 20 0 HIADHN CN(C(=O)N[C@@H](c1ccccc1)c1ccccn1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470750179 885215066 /nfs/dbraw/zinc/21/50/66/885215066.db2.gz CFYGLSYNLJCMJP-NOZRDPDXSA-N 0 3 414.553 4.477 20 0 HIADHN CN(C(=O)c1ccccc1OCc1cscn1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470812102 885298914 /nfs/dbraw/zinc/29/89/14/885298914.db2.gz LHGDTUAFMIHLOH-NRFANRHFSA-N 0 3 421.566 4.459 20 0 HIADHN CCc1c(C(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)cnn1-c1ccccc1 ZINC000470823727 885310992 /nfs/dbraw/zinc/31/09/92/885310992.db2.gz YHULLONOXGIMBP-QFIPXVFZSA-N 0 3 402.542 4.171 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)Nc1cccc(OCCc2ccccc2)c1 ZINC000504020465 912924782 /nfs/dbraw/zinc/92/47/82/912924782.db2.gz OVBUYJGPOIFUTI-UHFFFAOYSA-N 0 3 418.541 4.299 20 0 HIADHN CC1(C)CN(C2(CNC(=O)CCc3cnc4ccccc4c3)CCCCC2)CCO1 ZINC000470881114 885371999 /nfs/dbraw/zinc/37/19/99/885371999.db2.gz TWLOLWKXARCOND-UHFFFAOYSA-N 0 3 409.574 4.097 20 0 HIADHN C[C@@H](CNC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1)c1ccc(F)cc1F ZINC000470884012 885377809 /nfs/dbraw/zinc/37/78/09/885377809.db2.gz TWBGXBGSFVCYOY-FXAWDEMLSA-N 0 3 401.501 4.374 20 0 HIADHN C[C@@H](NC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1)c1cccc(-n2cccn2)c1 ZINC000470885143 885379065 /nfs/dbraw/zinc/37/90/65/885379065.db2.gz XOVUXBDTZHXLPP-YKSBVNFPSA-N 0 3 417.557 4.239 20 0 HIADHN COc1ccccc1[C@]1(C)C[C@@H]1NC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470895131 885394396 /nfs/dbraw/zinc/39/43/96/885394396.db2.gz RTVIAYFJDVMITN-OPHFCASCSA-N 0 3 407.558 4.031 20 0 HIADHN Cc1nc2c(cccc2C(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)o1 ZINC000470937917 885440306 /nfs/dbraw/zinc/44/03/06/885440306.db2.gz QOETWHXZDJOHFQ-UHFFFAOYSA-N 0 3 405.420 4.359 20 0 HIADHN C[C@@H]1[C@@H](C(F)(F)F)CCN1C[C@H](O)COc1ccc(Cl)cc1Br ZINC000470962841 885461300 /nfs/dbraw/zinc/46/13/00/885461300.db2.gz YKLSTWSEAPWGNP-USWWRNFRSA-N 0 3 416.665 4.115 20 0 HIADHN COCCCC[C@H](NCC(=O)N1CCc2[nH]c3ccccc3c2C1)c1ccccc1 ZINC000471001404 885502438 /nfs/dbraw/zinc/50/24/38/885502438.db2.gz OWKOOLJPVJFJBQ-QFIPXVFZSA-N 0 3 405.542 4.200 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Cc1csc2ccc(Br)cc12 ZINC000471035872 885543753 /nfs/dbraw/zinc/54/37/53/885543753.db2.gz SDMUNVGGIJKQIS-UHFFFAOYSA-N 0 3 421.360 4.390 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1ccc2nc(C)oc2c1 ZINC000471047451 885558929 /nfs/dbraw/zinc/55/89/29/885558929.db2.gz MRQBVLBWUABUPF-FQEVSTJZSA-N 0 3 415.497 4.340 20 0 HIADHN CC[C@@H](c1nnc(NC(=O)N(CCN(C)C)Cc2ccccn2)s1)c1ccccc1 ZINC000504040425 912948236 /nfs/dbraw/zinc/94/82/36/912948236.db2.gz ZDSSEMLTKCNPJJ-LJQANCHMSA-N 0 3 424.574 4.071 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)c1ccn(C2CCCCC2)n1 ZINC000471050930 885563605 /nfs/dbraw/zinc/56/36/05/885563605.db2.gz AUUXYKSTMOGHAS-OAQYLSRUSA-N 0 3 418.545 4.284 20 0 HIADHN Cc1cc(NC(=O)c2ccc3nc(C)oc3c2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000471051038 885564005 /nfs/dbraw/zinc/56/40/05/885564005.db2.gz VPFCRSMCSKISMG-FQEVSTJZSA-N 0 3 415.497 4.340 20 0 HIADHN CCN1CCc2nc3ccccc3c(C(=O)N[C@@H](C)[C@@H](c3ccccc3)N(C)C)c2C1 ZINC000471122224 885658609 /nfs/dbraw/zinc/65/86/09/885658609.db2.gz WRMOEFFPHKLGPS-BVZFJXPGSA-N 0 3 416.569 4.034 20 0 HIADHN C[C@H](NC(=O)C1(c2ccccc2Cl)CCOCC1)[C@H](c1ccccc1)N(C)C ZINC000471127470 885664943 /nfs/dbraw/zinc/66/49/43/885664943.db2.gz NOTBTQXJYKAWRN-LAUBAEHRSA-N 0 3 400.950 4.196 20 0 HIADHN C[C@@H](NC(=O)C1(c2ccc(Cl)cc2)CCOCC1)[C@@H](c1ccccc1)N(C)C ZINC000471134033 885675670 /nfs/dbraw/zinc/67/56/70/885675670.db2.gz PSVMWQYZQZOLFK-UTKZUKDTSA-N 0 3 400.950 4.196 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3cccc(OCC)c3)c(OCC)c2)CC1 ZINC000471174360 885735003 /nfs/dbraw/zinc/73/50/03/885735003.db2.gz VYMIZCLCCVEYDR-UHFFFAOYSA-N 0 3 411.546 4.268 20 0 HIADHN CN(CCCCOc1cccc(C(F)(F)F)c1)[C@@H]1CCCC[C@H]1S(C)(=O)=O ZINC000471241285 885818471 /nfs/dbraw/zinc/81/84/71/885818471.db2.gz FHWLBRNVKHUURX-QZTJIDSGSA-N 0 3 407.498 4.152 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2cccc(NC(=O)N(C)C)c2C)N2CCCC2)cc1 ZINC000471377488 886022542 /nfs/dbraw/zinc/02/25/42/886022542.db2.gz WNHAENKBMXCCBQ-JOCHJYFZSA-N 0 3 423.561 4.356 20 0 HIADHN O=C(CCN1CCc2ccccc2C1)Nc1cc(Cl)ccc1OC[C@H]1CCCO1 ZINC000471384116 886032320 /nfs/dbraw/zinc/03/23/20/886032320.db2.gz GYPCDLUEKGPFMG-HXUWFJFHSA-N 0 3 414.933 4.285 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)Nc2cc(-c3ccccc3)ccc2Cl)CC1 ZINC000471398452 886047458 /nfs/dbraw/zinc/04/74/58/886047458.db2.gz NHUKPWNLGKTKIW-SFHVURJKSA-N 0 3 414.981 4.402 20 0 HIADHN COc1cccc2c1CC[C@H]2NC(=O)N(CCN(C)C)Cc1cccc(Cl)c1 ZINC000471484849 886181899 /nfs/dbraw/zinc/18/18/99/886181899.db2.gz MCOATIYRZKEEQD-HXUWFJFHSA-N 0 3 401.938 4.109 20 0 HIADHN C[C@H](NC(=O)c1cccc(NC(=O)c2ccc(F)cc2)c1)[C@H](c1ccccc1)N(C)C ZINC000471538204 886242859 /nfs/dbraw/zinc/24/28/59/886242859.db2.gz HYRMSORBHIHBLN-GAJHUEQPSA-N 0 3 419.500 4.499 20 0 HIADHN O=C(NCc1ccc(C(F)(F)F)cc1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000471544149 886251576 /nfs/dbraw/zinc/25/15/76/886251576.db2.gz YGNFLQOZGRZCSG-UHFFFAOYSA-N 0 3 423.401 4.310 20 0 HIADHN Cc1noc(CSc2ccc(C(=O)N[C@@H](C)[C@@H](c3ccccc3)N(C)C)cc2)n1 ZINC000471576926 886289013 /nfs/dbraw/zinc/28/90/13/886289013.db2.gz GFTKCAVLEFVJPY-BTYIYWSLSA-N 0 3 410.543 4.092 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)N[C@H]2C[C@H](c3cccc(Cl)c3)C2)cc1 ZINC000504124575 913028922 /nfs/dbraw/zinc/02/89/22/913028922.db2.gz ZUHNGRNHTOVCCP-CUWPLCDZSA-N 0 3 401.938 4.197 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)N[C@H]1C[C@@H]1c1ccccc1OC(F)F)c1ccco1 ZINC000504128635 913032935 /nfs/dbraw/zinc/03/29/35/913032935.db2.gz PFCCZPQKERTLSF-MXASKKJJSA-N 0 3 407.461 4.166 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)[C@@H](C)Oc3ccc(F)cc3Cl)c2)CC1 ZINC000471627622 886346636 /nfs/dbraw/zinc/34/66/36/886346636.db2.gz SEAOKLDYRSWBNZ-OAHLLOKOSA-N 0 3 405.901 4.027 20 0 HIADHN CCOc1ccc(C2(CN[C@@H](C)c3cn(-c4ccccc4)nn3)CCOCC2)cc1 ZINC000471640831 886357359 /nfs/dbraw/zinc/35/73/59/886357359.db2.gz AZPAYSILZYCWMI-IBGZPJMESA-N 0 3 406.530 4.065 20 0 HIADHN CC[C@H](C)n1ncc2c1nc(C)cc2C(=O)Nc1cccc(N2CCN(CC)CC2)c1 ZINC000471656981 886371649 /nfs/dbraw/zinc/37/16/49/886371649.db2.gz GBEGAGGHHJSJOX-SFHVURJKSA-N 0 3 420.561 4.105 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)c3cc4c(C(C)C)nn(C)c4s3)c2)CC1 ZINC000471661988 886374315 /nfs/dbraw/zinc/37/43/15/886374315.db2.gz ANSCZBNNEPLILB-UHFFFAOYSA-N 0 3 411.575 4.152 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCC1(C(F)F)CC1)c1ccc(C(F)(F)F)cc1 ZINC000471721523 886432101 /nfs/dbraw/zinc/43/21/01/886432101.db2.gz VNXKKEMPVGEQJZ-HNNXBMFYSA-N 0 3 407.427 4.433 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCC1(C(F)F)CC1)c1ccc(C(F)(F)F)cc1 ZINC000471721524 886432192 /nfs/dbraw/zinc/43/21/92/886432192.db2.gz VNXKKEMPVGEQJZ-OAHLLOKOSA-N 0 3 407.427 4.433 20 0 HIADHN O=C(NCCCc1ccc(Cl)cc1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000471765809 886498578 /nfs/dbraw/zinc/49/85/78/886498578.db2.gz CXSXAEBGPSODLD-UHFFFAOYSA-N 0 3 417.903 4.377 20 0 HIADHN CCN(C(=O)c1noc(-c2cccc(OC)c2)n1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000471807015 886545470 /nfs/dbraw/zinc/54/54/70/886545470.db2.gz BCGBFLFQUYDUPI-PXNSSMCTSA-N 0 3 420.513 4.043 20 0 HIADHN COc1cc(Br)cc(NC(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)c1 ZINC000471933488 886728489 /nfs/dbraw/zinc/72/84/89/886728489.db2.gz KKEXDRUBSYEBHR-ZWKOTPCHSA-N 0 3 404.308 4.025 20 0 HIADHN CCCc1c(NC(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)cnn1-c1ccccc1 ZINC000471969191 886800149 /nfs/dbraw/zinc/80/01/49/886800149.db2.gz HYPCCPPVWNSTIS-REWPJTCUSA-N 0 3 403.530 4.392 20 0 HIADHN CC(=O)Nc1cc(C(=O)N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)cc(C(F)(F)F)c1 ZINC000471970189 886801740 /nfs/dbraw/zinc/80/17/40/886801740.db2.gz WJXUPZNVKYHBCL-JLTOFOAXSA-N 0 3 419.447 4.057 20 0 HIADHN CC(=O)Nc1cc(C(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)cc(C(F)(F)F)c1 ZINC000471970190 886801773 /nfs/dbraw/zinc/80/17/73/886801773.db2.gz WJXUPZNVKYHBCL-VBKZILBWSA-N 0 3 419.447 4.057 20 0 HIADHN Cc1cc(C)n(-c2ccccc2CNC(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)n1 ZINC000471976231 886807128 /nfs/dbraw/zinc/80/71/28/886807128.db2.gz HUOSQHWZHBACNP-OFNKIYASSA-N 0 3 417.557 4.124 20 0 HIADHN Cc1ccc(NC(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)c(-c2nc(C3CC3)no2)c1 ZINC000471990473 886816562 /nfs/dbraw/zinc/81/65/62/886816562.db2.gz FIBQKWUGBXGUNE-SFTDATJTSA-N 0 3 417.513 4.489 20 0 HIADHN CCS[C@H]1CCC[C@@H](NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)C1 ZINC000472008591 886832591 /nfs/dbraw/zinc/83/25/91/886832591.db2.gz PHEFSGRDFVUCGT-VXLLPVPCSA-N 0 3 407.546 4.155 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)[C@H](c3cccc(Cl)c3)N(C)C)c2)CC1 ZINC000504199061 913081032 /nfs/dbraw/zinc/08/10/32/913081032.db2.gz IPBBVWVWWRPNDA-QFIPXVFZSA-N 0 3 414.981 4.112 20 0 HIADHN CCSc1cccc(CNCc2ccccc2CS(=O)(=O)N2CCCC2)c1 ZINC000472056702 886867694 /nfs/dbraw/zinc/86/76/94/886867694.db2.gz YMFLIUYSHAUZIT-UHFFFAOYSA-N 0 3 404.601 4.014 20 0 HIADHN C[C@H](CCN1CCN(C)CC1)NC(=O)c1cc(Cl)ccc1SC1CCCC1 ZINC000472118343 886904472 /nfs/dbraw/zinc/90/44/72/886904472.db2.gz SSYHIADPKMHWBK-MRXNPFEDSA-N 0 3 410.027 4.131 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)c3cc(F)ccc3-c3ccoc3)CC2)C[C@H](C)O1 ZINC000472250434 887059683 /nfs/dbraw/zinc/05/96/83/887059683.db2.gz IPEKRTXUKLMULN-ROUUACIJSA-N 0 3 414.521 4.437 20 0 HIADHN O=C(NC[C@H]1CCCCN1CCc1nc(-c2ccc(Cl)cc2)no1)c1ccccc1 ZINC000472268269 887082774 /nfs/dbraw/zinc/08/27/74/887082774.db2.gz GIDWQVOHKFTQFQ-HXUWFJFHSA-N 0 3 424.932 4.217 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)c1ccc2nc(C(F)(F)F)cn2c1 ZINC000472294739 887117292 /nfs/dbraw/zinc/11/72/92/887117292.db2.gz ICJWBGFYTZALKH-MRXNPFEDSA-N 0 3 416.447 4.090 20 0 HIADHN CC(=O)N(Cc1ccc(NC(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)cc1)C(C)C ZINC000472309673 887137505 /nfs/dbraw/zinc/13/75/05/887137505.db2.gz DKKKDWOOBIMSKP-PKTZIBPZSA-N 0 3 408.546 4.010 20 0 HIADHN Cc1cc(N2CCSCC2)ccc1NC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000472311030 887139643 /nfs/dbraw/zinc/13/96/43/887139643.db2.gz BYDULLRNFUJBIA-FCHUYYIVSA-N 0 3 410.587 4.115 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2ccc3oc(C(F)(F)F)nc3c2)[C@@H]1c1ccccc1 ZINC000472316222 887147992 /nfs/dbraw/zinc/14/79/92/887147992.db2.gz DTXHOALTRUASFF-YOEHRIQHSA-N 0 3 404.392 4.414 20 0 HIADHN COc1ccc(NC(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)cc1Br ZINC000472319772 887151925 /nfs/dbraw/zinc/15/19/25/887151925.db2.gz MUPVHRVTRCQSAQ-SJLPKXTDSA-N 0 3 404.308 4.025 20 0 HIADHN CCOCCOc1c(Cl)cccc1NC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000472321271 887153745 /nfs/dbraw/zinc/15/37/45/887153745.db2.gz YLGDTKFYAURBOB-ICSRJNTNSA-N 0 3 417.937 4.322 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2cccc(NC(=O)c3ccoc3)c2)[C@H]1c1ccccc1 ZINC000472334404 887169199 /nfs/dbraw/zinc/16/91/99/887169199.db2.gz IILLSCOJBBIMCV-LEWJYISDSA-N 0 3 404.470 4.099 20 0 HIADHN CCN(C(=O)NCC1CCN(c2ccccc2)CC1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000472393616 887239468 /nfs/dbraw/zinc/23/94/68/887239468.db2.gz GRMKDMODZUNFIN-VWLOTQADSA-N 0 3 420.601 4.209 20 0 HIADHN CN(Cc1cc(F)c(F)c(F)c1)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472444079 887294922 /nfs/dbraw/zinc/29/49/22/887294922.db2.gz NMCDMLSYVBISKA-UHFFFAOYSA-N 0 3 423.401 4.051 20 0 HIADHN C[C@@H]1[C@H](c2ccccc2)CCN1C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472462626 887321832 /nfs/dbraw/zinc/32/18/32/887321832.db2.gz HRCXHYXWBLKVRR-BTWUCOSQSA-N 0 3 409.496 4.379 20 0 HIADHN COCCCC[C@H](NC(=O)N(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1)c1ccccc1 ZINC000472464567 887323063 /nfs/dbraw/zinc/32/30/63/887323063.db2.gz PNSNQCFODKEQEU-HJOGWXRNSA-N 0 3 424.589 4.274 20 0 HIADHN CN(C(=O)N[C@H]1CC[C@H](c2ccc(F)cc2)C1)C1CCN(CCc2ccccn2)CC1 ZINC000472544674 887423805 /nfs/dbraw/zinc/42/38/05/887423805.db2.gz FZICIGVMQJPULL-REWPJTCUSA-N 0 3 424.564 4.205 20 0 HIADHN C[C@@H](CO)N(CC(=O)N1N=C(c2cccs2)C[C@@H]1c1cccs1)C1CCCC1 ZINC000472639500 887504175 /nfs/dbraw/zinc/50/41/75/887504175.db2.gz UXHHSTMANODNGQ-MAUKXSAKSA-N 0 3 417.600 4.113 20 0 HIADHN CCN(Cc1ccccc1NC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1)C(C)=O ZINC000472674998 887529309 /nfs/dbraw/zinc/52/93/09/887529309.db2.gz DJOYPGKGDPBDKR-HSZRJFAPSA-N 0 3 422.573 4.183 20 0 HIADHN CN(C(=O)Nc1ccc(C(=O)N2CCCC2)cc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000472768979 887615492 /nfs/dbraw/zinc/61/54/92/887615492.db2.gz JRROZELFSNSJJV-QHCPKHFHSA-N 0 3 420.557 4.051 20 0 HIADHN CN1CC[C@H](NC(=O)NCC2(CCOCc3ccccc3)CC2)[C@@H]1c1ccccc1 ZINC000472775775 887622134 /nfs/dbraw/zinc/62/21/34/887622134.db2.gz IQNIXXKPBSBAMJ-GOTSBHOMSA-N 0 3 407.558 4.118 20 0 HIADHN CN(C(=O)Nc1ccc(NC(=O)C2CC2)cc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000472784915 887630447 /nfs/dbraw/zinc/63/04/47/887630447.db2.gz GCFSTQOZJCEMJK-QFIPXVFZSA-N 0 3 406.530 4.163 20 0 HIADHN CC[C@H](C)c1ccc([C@H](NC(=O)N[C@@H](C)CCN2CCN(C)CC2)C(C)C)cc1 ZINC000472943789 887791984 /nfs/dbraw/zinc/79/19/84/887791984.db2.gz XMPHQFNNJJQFAR-SXWKCWPCSA-N 0 3 402.627 4.222 20 0 HIADHN C[C@@H](N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1=O)c1ccc(-n2ccnc2)cc1 ZINC000473045405 887867947 /nfs/dbraw/zinc/86/79/47/887867947.db2.gz WZJQXSGCCYYRFM-DNVCBOLYSA-N 0 3 414.431 4.347 20 0 HIADHN Cc1ccc(-c2noc([C@H](C)NC(=O)c3cccc(CN4CCCC4)c3)n2)cc1F ZINC000473065958 887885905 /nfs/dbraw/zinc/88/59/05/887885905.db2.gz BACIVNPRGNHJOS-INIZCTEOSA-N 0 3 408.477 4.271 20 0 HIADHN Cc1ccc(-c2noc([C@@H](C)NC(=O)c3cccc(CN4CCCC4)c3)n2)cc1F ZINC000473065959 887886218 /nfs/dbraw/zinc/88/62/18/887886218.db2.gz BACIVNPRGNHJOS-MRXNPFEDSA-N 0 3 408.477 4.271 20 0 HIADHN CCOC(=O)CCc1ccc(NC(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000473079939 887896092 /nfs/dbraw/zinc/89/60/92/887896092.db2.gz HUWROCKIRWQBQN-QHCPKHFHSA-N 0 3 423.557 4.311 20 0 HIADHN O=C(CCN1CC[C@@]2(C1)OCc1ccccc12)Nc1ccc(Br)cc1F ZINC000473151908 887930240 /nfs/dbraw/zinc/93/02/40/887930240.db2.gz MJFWPUOGVPGXRO-FQEVSTJZSA-N 0 3 419.294 4.048 20 0 HIADHN C[C@H](NC(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1)c1ccc(Cl)cn1 ZINC000473182921 887961604 /nfs/dbraw/zinc/96/16/04/887961604.db2.gz AKWXNBLFKRZCLC-IFXJQAMLSA-N 0 3 411.855 4.367 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1ccccc1OC(F)(F)F ZINC000473512260 888241062 /nfs/dbraw/zinc/24/10/62/888241062.db2.gz JRPPUSCZVFFXDL-UHFFFAOYSA-N 0 3 410.358 4.120 20 0 HIADHN O=C(Cc1c[nH]c2cc(Cl)ccc12)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473516757 888248246 /nfs/dbraw/zinc/24/82/46/888248246.db2.gz DPJJSMUPILDSHD-UHFFFAOYSA-N 0 3 413.871 4.285 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)[C@@H]1CCOc2ccc(Cl)cc21 ZINC000473517226 888248394 /nfs/dbraw/zinc/24/83/94/888248394.db2.gz HMKQNLDVJPTGCL-UYSNPLJNSA-N 0 3 416.871 4.128 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N[C@H](CCCCOC)c3ccccc3)cc2)CC1 ZINC000473518024 888250237 /nfs/dbraw/zinc/25/02/37/888250237.db2.gz KRGBHIURNDZAQX-XMMPIXPASA-N 0 3 409.574 4.116 20 0 HIADHN CCOc1ccc(SCC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cc1 ZINC000473533424 888269732 /nfs/dbraw/zinc/26/97/32/888269732.db2.gz SPEIYXJGMGYNQU-UHFFFAOYSA-N 0 3 416.509 4.099 20 0 HIADHN C[C@@H](CC(=O)N1C[C@H]2CN(Cc3ccccc3)C[C@H]2C1)C(=O)c1ccc(Cl)cc1 ZINC000473583884 888324945 /nfs/dbraw/zinc/32/49/45/888324945.db2.gz SRVSYDNIPWRZOD-DZFGPLHGSA-N 0 3 410.945 4.139 20 0 HIADHN Cc1nc(CNC(=O)NC[C@@H](c2ccccc2)N(C)C)oc1-c1ccc(Cl)cc1 ZINC000473678886 888443263 /nfs/dbraw/zinc/44/32/63/888443263.db2.gz RYQHWOALDGUVQQ-IBGZPJMESA-N 0 3 412.921 4.406 20 0 HIADHN Cc1ccc2nc(C3CC3)cc(C(=O)N3CCC(CN4C[C@H](C)O[C@@H](C)C4)CC3)c2c1 ZINC000473726415 888502247 /nfs/dbraw/zinc/50/22/47/888502247.db2.gz UBPDBBRYZFPQDM-OALUTQOASA-N 0 3 421.585 4.382 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N[C@@H]3CCOc4c(C)cccc43)c(C)c2)CC1 ZINC000473766846 888563187 /nfs/dbraw/zinc/56/31/87/888563187.db2.gz XPSXTXIOAWQSKI-JOCHJYFZSA-N 0 3 408.546 4.091 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N(Cc3ccccc3OC)C3CC3)c2)CC1 ZINC000473810855 888636610 /nfs/dbraw/zinc/63/66/10/888636610.db2.gz UMUCFNPGXZRBTI-UHFFFAOYSA-N 0 3 408.546 4.034 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)NC[C@H]3CCCO[C@H]3c3ccccc3)c2)CC1 ZINC000473818294 888647473 /nfs/dbraw/zinc/64/74/73/888647473.db2.gz CDOWGNYJPJAMQD-QPPBQGQZSA-N 0 3 422.573 4.118 20 0 HIADHN CC[C@@H](NC(=O)Nc1cccc(N2CCN(CC)CC2)c1)c1ccc(F)cc1F ZINC000473821001 888651599 /nfs/dbraw/zinc/65/15/99/888651599.db2.gz QORRBPILCYCDRM-OAQYLSRUSA-N 0 3 402.489 4.380 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CC(Cc4ccccc4Cl)C3)c2)CC1 ZINC000473825157 888658743 /nfs/dbraw/zinc/65/87/43/888658743.db2.gz BXSNGQWRWLZLCO-UHFFFAOYSA-N 0 3 412.965 4.188 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CCC[C@@H]3Cc3ccccc3C)c2)CC1 ZINC000473829129 888663660 /nfs/dbraw/zinc/66/36/60/888663660.db2.gz MQRYXEDIMBUCBO-XMMPIXPASA-N 0 3 406.574 4.376 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)NC[C@@H]3CCCC[C@H]3C(F)(F)F)c2)CC1 ZINC000473835064 888672283 /nfs/dbraw/zinc/67/22/83/888672283.db2.gz HFEHKVNYHRPJHK-QFBILLFUSA-N 0 3 412.500 4.319 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N(C)CCOc3cccc(Cl)c3)c2)CC1 ZINC000473835322 888672367 /nfs/dbraw/zinc/67/23/67/888672367.db2.gz JDHAXKITNQWAMJ-UHFFFAOYSA-N 0 3 416.953 4.025 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CCC[C@H]3c3ccccc3OC)c2)CC1 ZINC000473838470 888678413 /nfs/dbraw/zinc/67/84/13/888678413.db2.gz WUABBFMNZLYSRZ-QFIPXVFZSA-N 0 3 408.546 4.206 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CCC[C@@H]3c3cccc(OC)c3)c2)CC1 ZINC000473841210 888682420 /nfs/dbraw/zinc/68/24/20/888682420.db2.gz RPVFPRNVCLXHKC-HSZRJFAPSA-N 0 3 408.546 4.206 20 0 HIADHN C[C@@H](NC(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1)c1cc2cccc(F)c2o1 ZINC000473863295 888718538 /nfs/dbraw/zinc/71/85/38/888718538.db2.gz ISOVHLLZKTZLLU-BRWVUGGUSA-N 0 3 417.525 4.164 20 0 HIADHN CN(C)[C@H](CNC(=O)N[C@H](c1cccc(Cl)c1)c1ccccn1)Cc1ccccc1 ZINC000473885961 888753564 /nfs/dbraw/zinc/75/35/64/888753564.db2.gz MQNMHURBGVIORY-JTHBVZDNSA-N 0 3 422.960 4.297 20 0 HIADHN C[C@H](NC(=O)NC(C)(C)CCN1CCN(C)CC1)c1ccc(Oc2ccccc2)cc1 ZINC000473934155 888813423 /nfs/dbraw/zinc/81/34/23/888813423.db2.gz VKCDLJZCRJIFLN-FQEVSTJZSA-N 0 3 424.589 4.255 20 0 HIADHN Cc1ccc(Oc2ccccc2CNC(=O)NC(C)(C)CCN2CCN(C)CC2)cc1 ZINC000473940527 888818446 /nfs/dbraw/zinc/81/84/46/888818446.db2.gz MZAGYMZCMFVFIY-UHFFFAOYSA-N 0 3 424.589 4.003 20 0 HIADHN O=C(Nc1ccc(OC2CCCC2)cc1)N[C@H]1CCN(Cc2ccccc2)C[C@H]1CO ZINC000473975287 888841137 /nfs/dbraw/zinc/84/11/37/888841137.db2.gz NSKIMMAXIKQNCL-RDPSFJRHSA-N 0 3 423.557 4.013 20 0 HIADHN CC[C@@H](NCc1nc2ccc(OC)cc2s1)[C@@H](c1ccc(C)cc1)n1cncn1 ZINC000473993062 888853562 /nfs/dbraw/zinc/85/35/62/888853562.db2.gz GTFHIMNYWBFCBI-XMSQKQJNSA-N 0 3 407.543 4.363 20 0 HIADHN CSCc1cccc(CNCc2ccc(Br)cc2N2CCOCC2)c1 ZINC000474017663 888871438 /nfs/dbraw/zinc/87/14/38/888871438.db2.gz RKOWCVYALXBJAB-UHFFFAOYSA-N 0 3 421.404 4.439 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)N1CCSC[C@H]1c1nccs1 ZINC000474020206 888872372 /nfs/dbraw/zinc/87/23/72/888872372.db2.gz XFAPBQOUAMRURJ-OALUTQOASA-N 0 3 418.632 4.099 20 0 HIADHN CCOC1CC(CCN[C@H](C)c2nnn(-c3cccc(Br)c3)c2C)C1 ZINC000474028965 888878245 /nfs/dbraw/zinc/87/82/45/888878245.db2.gz GYYQXNSBONICNR-MJJDPTRDSA-N 0 3 407.356 4.194 20 0 HIADHN Cc1ccccc1NC(=O)C[C@@H](C)N[C@H]1CCN(c2ccc(Cl)cc2Cl)C1=O ZINC000474099226 888922307 /nfs/dbraw/zinc/92/23/07/888922307.db2.gz RPRWSEALSCERKY-KDOFPFPSSA-N 0 3 420.340 4.414 20 0 HIADHN COc1cc2c(cc1OC)CN(C(=O)CN1CCC[C@H]1c1cc(C)ccc1C)CC2 ZINC000474219422 889058888 /nfs/dbraw/zinc/05/88/88/889058888.db2.gz KZDRISUNXVEHRS-QFIPXVFZSA-N 0 3 408.542 4.042 20 0 HIADHN CCOc1ccc([C@@H]2CCCN2C(=O)CN2CC[C@H](c3ccc(OC)cc3)C2)cc1 ZINC000504533931 913312648 /nfs/dbraw/zinc/31/26/48/913312648.db2.gz PFDNOHXGEYGQSJ-URXFXBBRSA-N 0 3 408.542 4.247 20 0 HIADHN COc1ccccc1NC(=O)CN1CCN(C[C@H](CC(C)C)c2ccccc2)CC1 ZINC000474260980 889120097 /nfs/dbraw/zinc/12/00/97/889120097.db2.gz WFLAHYWUCFYYKS-QFIPXVFZSA-N 0 3 409.574 4.081 20 0 HIADHN CC1CCC(N(Cc2ccc3c(c2)OCO3)Cc2cnc(-c3cnn(C)c3)nc2)CC1 ZINC000474270117 889133047 /nfs/dbraw/zinc/13/30/47/889133047.db2.gz XCKRACDSAXVGKC-UHFFFAOYSA-N 0 3 419.529 4.187 20 0 HIADHN COc1cc(C)c(Br)cc1C(=O)NC1CCN(Cc2ccccc2)CC1 ZINC000504541079 913321464 /nfs/dbraw/zinc/32/14/64/913321464.db2.gz GFPYYPQOAFCOTH-UHFFFAOYSA-N 0 3 417.347 4.161 20 0 HIADHN CN(C(=O)NCc1ccc(OC(F)(F)F)cc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000474336656 889208677 /nfs/dbraw/zinc/20/86/77/889208677.db2.gz IQBKHBFOVJHGKS-SFHVURJKSA-N 0 3 407.436 4.001 20 0 HIADHN COc1ccc2nc(CNCc3ccccc3CN3C[C@@H](C)O[C@@H](C)C3)sc2c1 ZINC000474368048 889245651 /nfs/dbraw/zinc/24/56/51/889245651.db2.gz IZXDOVQQMOURTJ-CALCHBBNSA-N 0 3 411.571 4.204 20 0 HIADHN CN(C)[C@@H](CNC(=O)c1cc(F)c(Br)cc1Cl)Cc1ccccc1 ZINC000474398998 889267276 /nfs/dbraw/zinc/26/72/76/889267276.db2.gz IGBNUBGLESPTHF-CYBMUJFWSA-N 0 3 413.718 4.144 20 0 HIADHN C[C@H](NC(=O)Nc1cccc(CN2CCCCC2=O)c1)[C@@H](c1ccccc1)N(C)C ZINC000474425966 889290578 /nfs/dbraw/zinc/29/05/78/889290578.db2.gz IRDOAECXHSUPOS-MBSDFSHPSA-N 0 3 408.546 4.012 20 0 HIADHN COCc1c(Br)cccc1NC(=O)N[C@H](C)[C@@H](c1ccccc1)N(C)C ZINC000474431811 889298500 /nfs/dbraw/zinc/29/85/00/889298500.db2.gz LFOIESUNHRGUKS-KUHUBIRLSA-N 0 3 420.351 4.408 20 0 HIADHN CCN1CCN(Cc2ccccc2CNCc2c(F)cccc2Br)CC1 ZINC000474482756 889343374 /nfs/dbraw/zinc/34/33/74/889343374.db2.gz OSQWIGKZKNFKMW-UHFFFAOYSA-N 0 3 420.370 4.016 20 0 HIADHN Fc1cccc(Br)c1CNCC1(c2ccc3c(c2)OCO3)CCOCC1 ZINC000474498121 889359642 /nfs/dbraw/zinc/35/96/42/889359642.db2.gz ZMXLVCOFUHWTSR-UHFFFAOYSA-N 0 3 422.294 4.155 20 0 HIADHN CN(C)CCN(C(=O)N[C@@H](c1cccc(Cl)c1)c1ccccn1)C1CCCC1 ZINC000474514721 889380786 /nfs/dbraw/zinc/38/07/86/889380786.db2.gz NWGFXCCEWCZRQU-NRFANRHFSA-N 0 3 400.954 4.340 20 0 HIADHN C[C@H](NC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C)c1noc(-c2ccccc2)n1 ZINC000474517342 889384859 /nfs/dbraw/zinc/38/48/59/889384859.db2.gz IYTKDAPFEXNZPQ-MOPGFXCFSA-N 0 3 419.529 4.104 20 0 HIADHN Cc1cc(Br)ccc1NC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000474565816 889442705 /nfs/dbraw/zinc/44/27/05/889442705.db2.gz OBVZDNPCQZANAR-GOSISDBHSA-N 0 3 402.336 4.496 20 0 HIADHN CN(C(=O)Nc1cc(F)ccc1Br)[C@H]1CCN(Cc2ccccc2)C1 ZINC000474588880 889458079 /nfs/dbraw/zinc/45/80/79/889458079.db2.gz TXQBLRMAJYUMCW-INIZCTEOSA-N 0 3 406.299 4.326 20 0 HIADHN CN(C(=O)Nc1ccc(OCC2CCOCC2)cc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000474608663 889473375 /nfs/dbraw/zinc/47/33/75/889473375.db2.gz WYGNQZYFRNJXAP-QHCPKHFHSA-N 0 3 423.557 4.230 20 0 HIADHN COc1cc(NC(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)ccc1Br ZINC000474625298 889488012 /nfs/dbraw/zinc/48/80/12/889488012.db2.gz ZCMYXLWJTGXZFU-KRWDZBQOSA-N 0 3 418.335 4.196 20 0 HIADHN COc1ccc(C2(CNCc3c(F)cccc3Br)CCOCC2)cc1 ZINC000474628728 889491134 /nfs/dbraw/zinc/49/11/34/889491134.db2.gz AEURMRCNALIZAJ-UHFFFAOYSA-N 0 3 408.311 4.435 20 0 HIADHN C[C@@H]1CN(c2ccccc2NC(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)C[C@@H](C)O1 ZINC000474730982 889586570 /nfs/dbraw/zinc/58/65/70/889586570.db2.gz ZVRXFMZUMMVMQW-KCZVDYSFSA-N 0 3 422.573 4.038 20 0 HIADHN CN(C(=O)Nc1cccc(OCc2cccnc2)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000474732982 889588376 /nfs/dbraw/zinc/58/83/76/889588376.db2.gz OGOMOYWOMMQFJB-QHCPKHFHSA-N 0 3 416.525 4.399 20 0 HIADHN CC1CCN([C@H](CNC(=O)CCc2nc(C3CCCC3)no2)c2cccs2)CC1 ZINC000474839513 889698548 /nfs/dbraw/zinc/69/85/48/889698548.db2.gz XQFIUDUADVJHHB-GOSISDBHSA-N 0 3 416.591 4.311 20 0 HIADHN C[C@H](N[C@@H](c1nc(-c2nc[nH]n2)no1)C(C)(C)C)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000474885824 889741944 /nfs/dbraw/zinc/74/19/44/889741944.db2.gz WXKCUDLYNMFTRD-DYNIEEOBSA-N 0 3 406.943 4.439 20 0 HIADHN C[C@H]([NH2+][C@@H](c1nc(-c2nc[n-]n2)no1)C(C)(C)C)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000474885824 889741962 /nfs/dbraw/zinc/74/19/62/889741962.db2.gz WXKCUDLYNMFTRD-DYNIEEOBSA-N 0 3 406.943 4.439 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)C[C@@H](Cc2ccccc2)c2ccccc2)CC1 ZINC000474888442 889746114 /nfs/dbraw/zinc/74/61/14/889746114.db2.gz CVHIJMMPMDVDNW-XMMPIXPASA-N 0 3 408.586 4.409 20 0 HIADHN C[C@@H](Sc1ccccn1)C(=O)N(CCN(C)C)Cc1ccc(C(F)(F)F)cc1 ZINC000474940297 889798048 /nfs/dbraw/zinc/79/80/48/889798048.db2.gz DVZISIMYSOZRTK-OAHLLOKOSA-N 0 3 411.493 4.171 20 0 HIADHN Cc1c(F)ccc(Cl)c1C(=O)NCCCCN1CCN(c2ccccc2)CC1 ZINC000474959047 889813810 /nfs/dbraw/zinc/81/38/10/889813810.db2.gz YODLLDVMZZMWLP-UHFFFAOYSA-N 0 3 403.929 4.120 20 0 HIADHN CCN(C(=O)NCc1ccc(OC(F)F)cc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475009450 889862130 /nfs/dbraw/zinc/86/21/30/889862130.db2.gz ZSPIRNNAWFDPPI-IBGZPJMESA-N 0 3 403.473 4.094 20 0 HIADHN CN(Cc1cc(F)cc(C(F)(F)F)c1)C[C@@H]1C[C@H](F)CN1Cc1nccs1 ZINC000475089862 889937635 /nfs/dbraw/zinc/93/76/35/889937635.db2.gz OWDJGMFWMHOTBY-HOTGVXAUSA-N 0 3 405.436 4.345 20 0 HIADHN CCN(C(=O)Nc1ccc2c(c1)CCC(=O)N2CC)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475109196 889959310 /nfs/dbraw/zinc/95/93/10/889959310.db2.gz KYMMBEFURPNBOI-QFIPXVFZSA-N 0 3 420.557 4.114 20 0 HIADHN CN(C(=O)NCc1cccc(COC(C)(C)C)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475110725 889961353 /nfs/dbraw/zinc/96/13/53/889961353.db2.gz ACBMIKGRAXGKDV-QHCPKHFHSA-N 0 3 409.574 4.418 20 0 HIADHN CN(C(=O)NC[C@@H]1CCCO[C@@H]1c1ccccc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475127331 889986917 /nfs/dbraw/zinc/98/69/17/889986917.db2.gz BFDQUHKGMZLXJB-KMDXXIMOSA-N 0 3 407.558 4.070 20 0 HIADHN CC(C)[C@H](CCO)NCC(=O)Nc1nc(-c2ccc(Cl)c(Cl)c2)cs1 ZINC000475129639 889992525 /nfs/dbraw/zinc/99/25/25/889992525.db2.gz KUBFYJYBBWBNTN-AWEZNQCLSA-N 0 3 402.347 4.052 20 0 HIADHN CN(C(=O)NCc1ccc(F)cc1C(F)(F)F)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475131673 889996513 /nfs/dbraw/zinc/99/65/13/889996513.db2.gz VIJIDIIBGFFUPC-SFHVURJKSA-N 0 3 409.427 4.260 20 0 HIADHN CCN(C(=O)NCCc1csc(C(C)C)n1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475160619 890025603 /nfs/dbraw/zinc/02/56/03/890025603.db2.gz DIHIAYATBUUUBD-FQEVSTJZSA-N 0 3 400.592 4.115 20 0 HIADHN CCN(C(=O)NCc1cccc(OCC(F)F)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475163058 890027221 /nfs/dbraw/zinc/02/72/21/890027221.db2.gz OCKPWYVFPNTCBW-FQEVSTJZSA-N 0 3 417.500 4.137 20 0 HIADHN CCN(C(=O)NCc1ccccc1OC(F)F)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475167010 890031898 /nfs/dbraw/zinc/03/18/98/890031898.db2.gz ZPLGMBOYGDUGGX-IBGZPJMESA-N 0 3 403.473 4.094 20 0 HIADHN CCN(C(=O)NC[C@@H]1CCCO[C@H]1C(C)(C)C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475169619 890035537 /nfs/dbraw/zinc/03/55/37/890035537.db2.gz DGGQWQDFPUSMDM-FDFHNCONSA-N 0 3 401.595 4.134 20 0 HIADHN CCN(C(=O)N[C@H](c1ccccc1)[C@@H]1CCOC1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475172777 890039399 /nfs/dbraw/zinc/03/93/99/890039399.db2.gz GFCADHZGTVAJJI-WXFUMESZSA-N 0 3 407.558 4.070 20 0 HIADHN CCN(C(=O)NCCc1csc(C(C)(C)C)n1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475174559 890042432 /nfs/dbraw/zinc/04/24/32/890042432.db2.gz KUTZNBYJLDTJGZ-HXUWFJFHSA-N 0 3 414.619 4.289 20 0 HIADHN CCN(C(=O)NCC1(c2ccccc2)CCOCC1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475179232 890048424 /nfs/dbraw/zinc/04/84/24/890048424.db2.gz WCBROAJTUWCPEQ-XMMPIXPASA-N 0 3 421.585 4.041 20 0 HIADHN COC(=O)C[C@@H]1CC[C@H](N[C@H](C)c2nc(-c3ccc(Br)cc3)no2)[C@H]1C ZINC000475192808 890062509 /nfs/dbraw/zinc/06/25/09/890062509.db2.gz BZZJUOSNDTWFFX-LMWOUKEDSA-N 0 3 422.323 4.128 20 0 HIADHN CN(C(=O)NCCc1csc(-c2ccccc2)n1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475264369 890159430 /nfs/dbraw/zinc/15/94/30/890159430.db2.gz DZTZIHWUCTXZOE-JOCHJYFZSA-N 0 3 420.582 4.269 20 0 HIADHN C[C@H](NC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1)c1nc(C2CCCCC2)no1 ZINC000475269198 890164737 /nfs/dbraw/zinc/16/47/37/890164737.db2.gz KUGHXDUGMXTWFY-PXNSSMCTSA-N 0 3 411.550 4.094 20 0 HIADHN C[C@H](NC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1)c1nc(C2CCCCC2)no1 ZINC000475269195 890164869 /nfs/dbraw/zinc/16/48/69/890164869.db2.gz KUGHXDUGMXTWFY-FXAWDEMLSA-N 0 3 411.550 4.094 20 0 HIADHN CC(C)c1cc(C(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)c2cnn(C(C)C)c2n1 ZINC000475295335 890202874 /nfs/dbraw/zinc/20/28/74/890202874.db2.gz FAEPJNIOERMPLL-HXUWFJFHSA-N 0 3 419.573 4.482 20 0 HIADHN Cc1cccc(-c2nc(CC(=O)N(C)[C@@H]3CCN(Cc4ccccc4)C3)cs2)c1 ZINC000475306083 890216877 /nfs/dbraw/zinc/21/68/77/890216877.db2.gz QORNZUCHRJTEQF-JOCHJYFZSA-N 0 3 405.567 4.394 20 0 HIADHN CN(C(=O)c1cnn(-c2ccccc2)c1C1CC1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475312128 890225468 /nfs/dbraw/zinc/22/54/68/890225468.db2.gz AUSWXQZEWVYUKE-JOCHJYFZSA-N 0 3 400.526 4.096 20 0 HIADHN C[C@H](SCC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1)c1nc2ccccc2[nH]1 ZINC000475313121 890226294 /nfs/dbraw/zinc/22/62/94/890226294.db2.gz OUKDKCCRZZXCJT-HKUYNNGSSA-N 0 3 408.571 4.090 20 0 HIADHN C[C@@H]1C(=O)CC[C@@H]1CC(=O)N1CCC(N(C)Cc2cccc(C(F)(F)F)c2)CC1 ZINC000475329378 890248637 /nfs/dbraw/zinc/24/86/37/890248637.db2.gz UDALWMNJPUOSQL-DOTOQJQBSA-N 0 3 410.480 4.134 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)C(C)(C)c3cccc(Cl)c3F)CC2)C[C@H](C)O1 ZINC000475344913 890268449 /nfs/dbraw/zinc/26/84/49/890268449.db2.gz YHUROLFKEIPOSM-IYBDPMFKSA-N 0 3 410.961 4.105 20 0 HIADHN COC(=O)[C@@H]1CCN(Cc2cn(Cc3ccccc3)nc2-c2ccccc2)C[C@@H]1C ZINC000475370549 890301288 /nfs/dbraw/zinc/30/12/88/890301288.db2.gz NTDWOCRAJDTXBA-WMZHIEFXSA-N 0 3 403.526 4.229 20 0 HIADHN CC(C)n1cc2cc(NC(=O)NCC3(N4CCSCC4)CCCC3)ccc2n1 ZINC000475397564 890326202 /nfs/dbraw/zinc/32/62/02/890326202.db2.gz WRMSHIUDIIMCSU-UHFFFAOYSA-N 0 3 401.580 4.100 20 0 HIADHN C[C@@H](N[C@@H](C(N)=O)c1cccc(Br)c1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000475427715 890347691 /nfs/dbraw/zinc/34/76/91/890347691.db2.gz HWBFEVCTZPWXIX-LYNPINBMSA-N 0 3 413.768 4.472 20 0 HIADHN Fc1ccc2c(c1)[C@H](NCc1ccc(OCCN3CCOCC3)c(Cl)c1)CCC2 ZINC000475501950 890412508 /nfs/dbraw/zinc/41/25/08/890412508.db2.gz GWOPFSOZNNIIAU-JOCHJYFZSA-N 0 3 418.940 4.357 20 0 HIADHN CN(C(=O)c1cccc(CSc2nccn2C)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475553893 890480014 /nfs/dbraw/zinc/48/00/14/890480014.db2.gz GVBAIDIYXDRWEC-QFIPXVFZSA-N 0 3 420.582 4.059 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)Nc2ccc(Cl)cc2-n2cccc2)CC1 ZINC000475600071 890526141 /nfs/dbraw/zinc/52/61/41/890526141.db2.gz JEXIVBOTGZEEDS-UHFFFAOYSA-N 0 3 404.942 4.142 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)Nc2ccccc2N(C)Cc2ccccc2)CC1 ZINC000475606147 890532908 /nfs/dbraw/zinc/53/29/08/890532908.db2.gz VVXXSSMWXXULDX-UHFFFAOYSA-N 0 3 424.589 4.334 20 0 HIADHN CC(C)(C)OC1CC(N[C@@H](CO)c2ccc(Br)cc2C(F)(F)F)C1 ZINC000475622112 890557558 /nfs/dbraw/zinc/55/75/58/890557558.db2.gz FJUOUXZEIOYVSJ-QOZQQMKHSA-N 0 3 410.274 4.437 20 0 HIADHN Cc1nc(CN(C)[C@H]2CCCN(Cc3cnc(-c4ccc(C)cc4)s3)CC2)no1 ZINC000475634352 890574485 /nfs/dbraw/zinc/57/44/85/890574485.db2.gz MAXIAQSCYKSQDF-IBGZPJMESA-N 0 3 411.575 4.296 20 0 HIADHN COc1ccc(OC(F)F)c(NC(=O)NCC(C)(C)N2CCc3ccccc3C2)c1 ZINC000504733962 913470671 /nfs/dbraw/zinc/47/06/71/913470671.db2.gz ZDVUJQXUYIGGLP-UHFFFAOYSA-N 0 3 419.472 4.255 20 0 HIADHN CC1CCN([C@@H](CNC(=O)Nc2ccc([S@](C)=O)c(F)c2)c2cccs2)CC1 ZINC000475855374 890789504 /nfs/dbraw/zinc/78/95/04/890789504.db2.gz YKKOBFFASRMLCL-HPGBDJQBSA-N 0 3 423.579 4.219 20 0 HIADHN CC1CCN([C@@H](CNC(=O)Nc2ccc([S@](C)=O)c(F)c2)c2ccccc2)CC1 ZINC000475856162 890791354 /nfs/dbraw/zinc/79/13/54/890791354.db2.gz VSWQEUGNYCTINF-WRONEBCDSA-N 0 3 417.550 4.158 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N[C@H]2CCSc3ccc(Cl)cc32)CC1 ZINC000475908642 890837897 /nfs/dbraw/zinc/83/78/97/890837897.db2.gz WXQPAWPTGNHRMN-SFHVURJKSA-N 0 3 411.999 4.066 20 0 HIADHN CSc1ccc(NC(=O)N2CCC(CN3C[C@H](C)O[C@@H](C)C3)CC2)cc1Cl ZINC000475971134 890889269 /nfs/dbraw/zinc/88/92/69/890889269.db2.gz ZRWOWDKFQZCEDB-GJZGRUSLSA-N 0 3 411.999 4.415 20 0 HIADHN CC(C)(CNC(=O)Nc1ccc(OC[C@@H]2CCCO2)cc1)N1CCc2ccccc2C1 ZINC000504771298 913504201 /nfs/dbraw/zinc/50/42/01/913504201.db2.gz UOJBEDMBVPXQGN-QHCPKHFHSA-N 0 3 423.557 4.203 20 0 HIADHN Cc1nc(CNC(=O)N[C@@H](CN2CCc3ccccc3C2)C(C)(C)C)sc1C ZINC000476035430 890966488 /nfs/dbraw/zinc/96/64/88/890966488.db2.gz SHQLAWUYJBXFFX-IBGZPJMESA-N 0 3 400.592 4.032 20 0 HIADHN Cc1nc(CNC(=O)N[C@H](CN2CCc3ccccc3C2)C(C)(C)C)sc1C ZINC000476035432 890966937 /nfs/dbraw/zinc/96/69/37/890966937.db2.gz SHQLAWUYJBXFFX-LJQANCHMSA-N 0 3 400.592 4.032 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N[C@@H](C)c2nc(-c3ccccc3)cs2)CC1 ZINC000476038335 890968450 /nfs/dbraw/zinc/96/84/50/890968450.db2.gz AUQMREFLMHFTIT-KRWDZBQOSA-N 0 3 416.591 4.060 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N[C@H](c2ccc(Cl)cc2)[C@@H]2C[C@H]2C)CC1 ZINC000476037601 890969163 /nfs/dbraw/zinc/96/91/63/890969163.db2.gz ZEVDPMPMWCKUGM-MAODMQOUSA-N 0 3 407.986 4.226 20 0 HIADHN Cc1nc([C@@H](C)NC(=O)N[C@@H](CN2CCc3ccccc3C2)C(C)(C)C)cs1 ZINC000476052550 890982181 /nfs/dbraw/zinc/98/21/81/890982181.db2.gz UNFFOAKBXINYDL-QRWLVFNGSA-N 0 3 400.592 4.285 20 0 HIADHN Cc1c(F)ccc(Cl)c1C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000476098195 891020650 /nfs/dbraw/zinc/02/06/50/891020650.db2.gz VKFNUCSEYOPKQK-UHFFFAOYSA-N 0 3 408.876 4.200 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)NCC(C)(C)N2CCc3ccccc3C2)cc1 ZINC000504787747 913514910 /nfs/dbraw/zinc/51/49/10/913514910.db2.gz VGWLBUDBGIALAU-QHCPKHFHSA-N 0 3 407.558 4.379 20 0 HIADHN CCOC(=O)C1CCN(C(=O)[C@H](C)N2CCC(c3cccc4ccccc43)CC2)CC1 ZINC000476292661 891208163 /nfs/dbraw/zinc/20/81/63/891208163.db2.gz OSPGMLOAEDNBRT-IBGZPJMESA-N 0 3 422.569 4.209 20 0 HIADHN COc1cccc(C2=CCN(CCC(=O)Nc3cc(Cl)ccc3OC)CC2)c1 ZINC000476298376 891211002 /nfs/dbraw/zinc/21/10/02/891211002.db2.gz UMGVARZOKOXUDB-UHFFFAOYSA-N 0 3 400.906 4.475 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N(CCc2ccc(Cl)cc2)CC2CC2)CC1 ZINC000476447409 891359426 /nfs/dbraw/zinc/35/94/26/891359426.db2.gz LVVVFJZLOCQZQO-UHFFFAOYSA-N 0 3 422.013 4.194 20 0 HIADHN Cc1ccc(CN(Cc2ccco2)C(=O)NC2CCN(CCOC(C)C)CC2)s1 ZINC000476447897 891360063 /nfs/dbraw/zinc/36/00/63/891360063.db2.gz IMPYKJUFLJPEEO-UHFFFAOYSA-N 0 3 419.591 4.251 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N2Cc3ccccc3C[C@@H]2c2ccccc2)CC1 ZINC000476448837 891361704 /nfs/dbraw/zinc/36/17/04/891361704.db2.gz VBTAIUABKNQSCW-RUZDIDTESA-N 0 3 421.585 4.385 20 0 HIADHN CN(C)[C@H](CNC(=O)N1CCC(c2c[nH]c3cc(F)ccc32)CC1)Cc1ccccc1 ZINC000476566845 891486690 /nfs/dbraw/zinc/48/66/90/891486690.db2.gz NYCPWFNUVFXZSA-NRFANRHFSA-N 0 3 422.548 4.369 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)Nc2cccc(OCCF)c2)N(C)C)cc1 ZINC000476634649 891573589 /nfs/dbraw/zinc/57/35/89/891573589.db2.gz XRHVDSIIHBZCDN-NRFANRHFSA-N 0 3 403.498 4.247 20 0 HIADHN COc1c(F)cc(F)cc1NC(=O)NC[C@@H](c1ccc(OC(C)C)cc1)N(C)C ZINC000476651159 891590907 /nfs/dbraw/zinc/59/09/07/891590907.db2.gz GFRYDQUPBPUOHT-IBGZPJMESA-N 0 3 407.461 4.185 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCC[C@H](C(F)(F)F)[C@H]1C)c1cccc(OC)c1 ZINC000476713279 891674522 /nfs/dbraw/zinc/67/45/22/891674522.db2.gz GRSRLVYIXHRMHY-AYOQOUSVSA-N 0 3 415.500 4.451 20 0 HIADHN COCCN1CCC[C@H]1CNC(=O)Nc1ccc(OCc2ccccc2Cl)cc1 ZINC000477113142 892043067 /nfs/dbraw/zinc/04/30/67/892043067.db2.gz WFLZZJIRPBKSEE-IBGZPJMESA-N 0 3 417.937 4.151 20 0 HIADHN CC[C@@H](c1ccccc1)[C@@H]1CCCN1Cc1ccc(S(=O)(=O)N2CCCC2)o1 ZINC000477184846 892105869 /nfs/dbraw/zinc/10/58/69/892105869.db2.gz DUSMQKIXNRLAKZ-SFTDATJTSA-N 0 3 402.560 4.222 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1ccccc1-c1nncn1C(C)C)c1ccco1 ZINC000477184786 892105964 /nfs/dbraw/zinc/10/59/64/892105964.db2.gz CYPBMUDWDHNUIN-LPHOPBHVSA-N 0 3 410.522 4.370 20 0 HIADHN CC[C@@H](c1ccccc1)[C@H]1CCCN1CC(=O)Nc1cccc(N2CCCC2=O)c1 ZINC000477218324 892150105 /nfs/dbraw/zinc/15/01/05/892150105.db2.gz HQKWDVSMQFVPMX-XZOQPEGZSA-N 0 3 405.542 4.410 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(Cl)cc2)CC1)c1cccc(Cl)c1F ZINC000477221857 892156395 /nfs/dbraw/zinc/15/63/95/892156395.db2.gz LCLMOHOYEQHKFG-UHFFFAOYSA-N 0 3 411.304 4.406 20 0 HIADHN C[C@H](C(=O)N(C)Cc1ccc(Br)cc1)N1CC[C@H](c2ccccc2)C1 ZINC000477242220 892188503 /nfs/dbraw/zinc/18/85/03/892188503.db2.gz HELZMCPRBACXOW-APWZRJJASA-N 0 3 401.348 4.286 20 0 HIADHN COc1ccc([C@H](N[C@@H](C)C(=O)N[C@H](C)c2cc(OC)ccc2OC)C2CC2)cc1 ZINC000477326740 892292780 /nfs/dbraw/zinc/29/27/80/892292780.db2.gz WHBBAICGRFRELY-VBURHUQHSA-N 0 3 412.530 4.019 20 0 HIADHN Cc1nc(COc2ccc(CNCc3cc(Cl)c4c(c3)OCCCO4)cc2)no1 ZINC000477325047 892293980 /nfs/dbraw/zinc/29/39/80/892293980.db2.gz TVRZIVBNECRGTN-UHFFFAOYSA-N 0 3 415.877 4.062 20 0 HIADHN CN(C(=O)Cc1nc(-c2ccc(F)cc2)cs1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000477349603 892315743 /nfs/dbraw/zinc/31/57/43/892315743.db2.gz GYDDXGTWWZJOKI-FQEVSTJZSA-N 0 3 409.530 4.225 20 0 HIADHN C[C@@H](CNC(=O)N1CCn2cccc2[C@H]1c1ccccc1)N(C)Cc1ccccc1 ZINC000477397714 892351827 /nfs/dbraw/zinc/35/18/27/892351827.db2.gz XYTMHAGZCDSPGE-GBXCKJPGSA-N 0 3 402.542 4.123 20 0 HIADHN CC(C)CC(=O)Nc1ccc(NC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000504922830 913658059 /nfs/dbraw/zinc/65/80/59/913658059.db2.gz DBTNHYYLIALULO-QFIPXVFZSA-N 0 3 408.546 4.457 20 0 HIADHN CC1CCN([C@@H](CNC(=O)c2ccncc2Br)c2ccccc2)CC1 ZINC000477448395 892399854 /nfs/dbraw/zinc/39/98/54/892399854.db2.gz NRPZWHOPZKVDHT-IBGZPJMESA-N 0 3 402.336 4.047 20 0 HIADHN Cc1cccc(C(=O)N2CCCC2)c1NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000504922845 913659091 /nfs/dbraw/zinc/65/90/91/913659091.db2.gz DFTMVLRQFLUDQB-NRFANRHFSA-N 0 3 420.557 4.017 20 0 HIADHN Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)NC(=O)N(C)[C@@H]1CCN(C2CC2)C1 ZINC000477475397 892456801 /nfs/dbraw/zinc/45/68/01/892456801.db2.gz YCHXQHHUISCRNW-RDTXWAMCSA-N 0 3 402.539 4.197 20 0 HIADHN COCC[C@@H](NC(=O)Nc1ccc(CCN2CCSCC2)cc1)c1ccc(C)o1 ZINC000477528009 892552604 /nfs/dbraw/zinc/55/26/04/892552604.db2.gz HUYBLGZIRAUKLG-HXUWFJFHSA-N 0 3 417.575 4.079 20 0 HIADHN COCC[C@H](NC(=O)Nc1ccc(CCN2CCSCC2)cc1)c1ccc(C)o1 ZINC000477528008 892553486 /nfs/dbraw/zinc/55/34/86/892553486.db2.gz HUYBLGZIRAUKLG-FQEVSTJZSA-N 0 3 417.575 4.079 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1cncc(-c2ccccc2)c1 ZINC000477712570 892821798 /nfs/dbraw/zinc/82/17/98/892821798.db2.gz NGSXSBNNXSCXLP-UHFFFAOYSA-N 0 3 401.510 4.205 20 0 HIADHN COc1ccccc1CC(C)(C)C(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000477736958 892834466 /nfs/dbraw/zinc/83/44/66/892834466.db2.gz FABPHGALQHUMHH-UHFFFAOYSA-N 0 3 410.558 4.107 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N[C@@H]3COc4c3ccc(C)c4C)c(C)c2)CC1 ZINC000477791884 892869299 /nfs/dbraw/zinc/86/92/99/892869299.db2.gz DXJOINLHGSKEPV-JOCHJYFZSA-N 0 3 408.546 4.009 20 0 HIADHN CC[C@@H](CNC(=O)NCc1csc(-c2ccco2)n1)N1CCc2ccccc2C1 ZINC000477819158 892886803 /nfs/dbraw/zinc/88/68/03/892886803.db2.gz IOCGBLYVKWDVPI-IBGZPJMESA-N 0 3 410.543 4.039 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCc1ncoc1-c1ccccc1)c1cccc(OC)c1 ZINC000477821495 892888583 /nfs/dbraw/zinc/88/85/83/892888583.db2.gz MHZLWAMPZNAFLU-JOCHJYFZSA-N 0 3 422.529 4.233 20 0 HIADHN Cc1ccc([C@H](NC[C@](C)(O)C2CCCCC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000477844251 892902041 /nfs/dbraw/zinc/90/20/41/892902041.db2.gz CJLPTCJEWMMLGR-ZEQRLZLVSA-N 0 3 415.599 4.409 20 0 HIADHN C[C@H](NC(=O)N[C@@H](CN(C)C)c1ccc(F)cc1)c1nc2ccccc2n1C(F)F ZINC000477849540 892910537 /nfs/dbraw/zinc/91/05/37/892910537.db2.gz TXFVDZGOGBMCSW-GUYCJALGSA-N 0 3 419.451 4.234 20 0 HIADHN COC(=O)c1csc(-c2cccc(CN[C@@H](C)c3ccc(OC)c(OC)c3)c2)n1 ZINC000477869033 892926707 /nfs/dbraw/zinc/92/67/07/892926707.db2.gz WWVLRWVFWJUYMJ-AWEZNQCLSA-N 0 3 412.511 4.465 20 0 HIADHN COc1ccc2nc(NC(=O)c3ccc(N4CCN(C(C)C)CC4)cc3)sc2c1 ZINC000504979946 913723496 /nfs/dbraw/zinc/72/34/96/913723496.db2.gz SRMNKQUGZLPDPC-UHFFFAOYSA-N 0 3 410.543 4.088 20 0 HIADHN Cc1cc(NC(=O)N2Cc3ccccc3CO2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000477939873 893029833 /nfs/dbraw/zinc/02/98/33/893029833.db2.gz JRGRCACVELYNOQ-JOCHJYFZSA-N 0 3 417.513 4.118 20 0 HIADHN COc1cc(F)c([C@H](C)NCCCOc2ccc(C(F)(F)F)cn2)cc1OC ZINC000477941326 893030376 /nfs/dbraw/zinc/03/03/76/893030376.db2.gz ICRDDFIJAKTGRZ-LBPRGKRZSA-N 0 3 402.388 4.376 20 0 HIADHN Cc1c(Br)cccc1CC(=O)N(Cc1ccco1)C1CCN(C)CC1 ZINC000478054094 893206277 /nfs/dbraw/zinc/20/62/77/893206277.db2.gz PGUMZRVYTOGJHT-UHFFFAOYSA-N 0 3 405.336 4.016 20 0 HIADHN CCCN(C(=O)c1ccc(F)c(NC(C)=O)c1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000505011626 913754319 /nfs/dbraw/zinc/75/43/19/913754319.db2.gz YAURIGULHZHJBZ-NRFANRHFSA-N 0 3 411.521 4.301 20 0 HIADHN CN1C[C@H](NC(=O)Cc2csc(-c3ccccc3Cl)n2)[C@H](c2ccccc2)C1 ZINC000478370946 893634322 /nfs/dbraw/zinc/63/43/22/893634322.db2.gz MZHQSIRGROGKDS-ICSRJNTNSA-N 0 3 411.958 4.220 20 0 HIADHN CCOc1c(Cl)cccc1CC(=O)N1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000478500149 893815379 /nfs/dbraw/zinc/81/53/79/893815379.db2.gz YZBOIESOGCLHEY-ROUUACIJSA-N 0 3 422.997 4.019 20 0 HIADHN CC(C)c1noc(CCC(=O)N2CCN(Cc3ccccc3)C3(CCCCC3)C2)n1 ZINC000478539098 893839197 /nfs/dbraw/zinc/83/91/97/893839197.db2.gz PGACWBUWRKXQNT-UHFFFAOYSA-N 0 3 410.562 4.173 20 0 HIADHN COc1ccccc1-c1nn(-c2ccccc2)cc1C(=O)NCCN1CCC(C)CC1 ZINC000478554133 893846313 /nfs/dbraw/zinc/84/63/13/893846313.db2.gz CTYIYKOXWGFCRK-UHFFFAOYSA-N 0 3 418.541 4.010 20 0 HIADHN CCO[C@@H]1C[C@H](N(C)C(=O)Nc2ccc(CCN3CCSCC3)cc2)C12CCC2 ZINC000478668742 893916417 /nfs/dbraw/zinc/91/64/17/893916417.db2.gz VYCPUIGEAIVYJE-LEWJYISDSA-N 0 3 417.619 4.089 20 0 HIADHN CC(C)c1csc(CNC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)n1 ZINC000478724310 893997931 /nfs/dbraw/zinc/99/79/31/893997931.db2.gz ZQCOLGFTFZQYFJ-LJQANCHMSA-N 0 3 411.493 4.337 20 0 HIADHN C[C@H](NC(=O)NCc1ccnc(OCc2ccccc2)c1)[C@H](c1ccccc1)N(C)C ZINC000478770997 894046780 /nfs/dbraw/zinc/04/67/80/894046780.db2.gz OKUZBNHSTXVBNQ-YADARESESA-N 0 3 418.541 4.151 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2ccc3oc(C4CC4)nc3c2)c1 ZINC000478782370 894057719 /nfs/dbraw/zinc/05/77/19/894057719.db2.gz AOHFYFLHVFHMGZ-UHFFFAOYSA-N 0 3 408.502 4.310 20 0 HIADHN Cc1cc(Br)cc(Cl)c1C(=O)NCCCCN1C[C@@H](C)O[C@@H](C)C1 ZINC000478873738 894151264 /nfs/dbraw/zinc/15/12/64/894151264.db2.gz MKXUKRGLBYRPCE-OKILXGFUSA-N 0 3 417.775 4.030 20 0 HIADHN Cc1cc(C)c(S(N)(=O)=O)cc1[C@H](C)N[C@H]1CCCc2cc(OC(F)F)ccc21 ZINC000479059553 894319089 /nfs/dbraw/zinc/31/90/89/894319089.db2.gz LEMBEEKUCZTFJN-LIRRHRJNSA-N 0 3 424.513 4.280 20 0 HIADHN COCCSc1ccc([C@H](C)N[C@H](C)c2cc(S(N)(=O)=O)c(C)cc2C)cc1 ZINC000479060488 894320011 /nfs/dbraw/zinc/32/00/11/894320011.db2.gz AHPYSAJNMCLCRG-DLBZAZTESA-N 0 3 422.616 4.101 20 0 HIADHN C[C@H](NCCc1ccccc1Cl)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479064627 894326700 /nfs/dbraw/zinc/32/67/00/894326700.db2.gz GYVAGXPUYKMELS-JTQLQIEISA-N 0 3 407.750 4.188 20 0 HIADHN CC1CCN([C@@H](CNC(=O)[C@@H](CO)c2ccc(Cl)cc2)c2cccs2)CC1 ZINC000505170048 913858381 /nfs/dbraw/zinc/85/83/81/913858381.db2.gz ZCYOJLVVCQKCDY-OALUTQOASA-N 0 3 406.979 4.067 20 0 HIADHN Cc1cc(C)c(S(N)(=O)=O)cc1[C@H](C)N[C@H](C)c1ccc(Br)cc1 ZINC000479066183 894328053 /nfs/dbraw/zinc/32/80/53/894328053.db2.gz KIKQEUYAOYGRQQ-KGLIPLIRSA-N 0 3 411.365 4.125 20 0 HIADHN Cc1ccc(CC[C@@H](C)N[C@@H](C)c2cc(S(N)(=O)=O)c(Cl)cc2Cl)o1 ZINC000479074324 894339896 /nfs/dbraw/zinc/33/98/96/894339896.db2.gz ZZSVEAACMZTRIS-PWSUYJOCSA-N 0 3 405.347 4.214 20 0 HIADHN Cc1ccc(C[C@@H](C)N[C@@H](C)c2cc(S(N)(=O)=O)c(Cl)cc2Cl)s1 ZINC000479078961 894344316 /nfs/dbraw/zinc/34/43/16/894344316.db2.gz OWGKFIXVIKGCTH-KOLCDFICSA-N 0 3 407.388 4.293 20 0 HIADHN CC[C@H](C)NC(=O)[C@@H]1C[C@H](C)N(Cc2nc(-c3ccsc3)no2)[C@H]2CCCC[C@@H]12 ZINC000479114288 894382604 /nfs/dbraw/zinc/38/26/04/894382604.db2.gz IGXGGZLOAITQNC-JAQSECSASA-N 0 3 416.591 4.482 20 0 HIADHN C[C@H](NCCNC(=O)c1ccco1)c1ccc(Br)cc1C(F)(F)F ZINC000479253717 894518852 /nfs/dbraw/zinc/51/88/52/894518852.db2.gz MBCUKRODGPOMKH-JTQLQIEISA-N 0 3 405.214 4.142 20 0 HIADHN CC(C)CN(CCN(C)C)C(=O)Nc1cc(Br)ccc1N1CCCC1 ZINC000479297335 894580108 /nfs/dbraw/zinc/58/01/08/894580108.db2.gz VCRMIYUONBZANV-UHFFFAOYSA-N 0 3 411.388 4.101 20 0 HIADHN CSc1cccc(N(C(=O)c2sc3nccn3c2C)C2CCN(C)CC2)c1 ZINC000505207254 913884314 /nfs/dbraw/zinc/88/43/14/913884314.db2.gz MQXMPPWDHTZUCS-UHFFFAOYSA-N 0 3 400.573 4.167 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@H](CCO)c1ccc(Cl)cc1)c1ccsc1 ZINC000479385370 894686325 /nfs/dbraw/zinc/68/63/25/894686325.db2.gz MBILSSFHSMPJPE-RTBURBONSA-N 0 3 409.983 4.207 20 0 HIADHN COc1ccc(-c2ccc(CN[C@@H](C)c3cc(S(N)(=O)=O)c(C)cc3C)cc2)cc1 ZINC000479391742 894694279 /nfs/dbraw/zinc/69/42/79/894694279.db2.gz KULCVPAIHSTJOW-SFHVURJKSA-N 0 3 424.566 4.477 20 0 HIADHN O=C(NCc1csc(-c2ccco2)n1)NC[C@H](c1cccs1)N1CCCC1 ZINC000479423440 894736388 /nfs/dbraw/zinc/73/63/88/894736388.db2.gz PMRFGNPIODKKBZ-OAHLLOKOSA-N 0 3 402.545 4.101 20 0 HIADHN CCc1nc2c(s1)[C@@H](N(C)C(=O)N[C@H]1CCCN(Cc3ccccc3)C1)CCC2 ZINC000479426654 894739488 /nfs/dbraw/zinc/73/94/88/894739488.db2.gz RNQDTWRWCYFZEQ-ICSRJNTNSA-N 0 3 412.603 4.389 20 0 HIADHN COc1ccc([C@@H](CCO)N[C@@H](C)c2ccc(I)cc2)cc1 ZINC000479484406 894806971 /nfs/dbraw/zinc/80/69/71/894806971.db2.gz HZCCLZCAKJRPGW-SCLBCKFNSA-N 0 3 411.283 4.074 20 0 HIADHN COCCCC[C@H](N[C@@H](C)c1cccc(S(=O)(=O)N(C)C)c1)c1ccccc1 ZINC000479487735 894809239 /nfs/dbraw/zinc/80/92/39/894809239.db2.gz GQSTXAWTDJHVFY-AVRDEDQJSA-N 0 3 404.576 4.146 20 0 HIADHN COc1ccc(NC(=O)[C@@H](N[C@H]2CCc3cnn(C(C)C)c3C2)c2ccccc2)cc1 ZINC000479490154 894810658 /nfs/dbraw/zinc/81/06/58/894810658.db2.gz SAHACDKKQNNHHJ-URXFXBBRSA-N 0 3 418.541 4.300 20 0 HIADHN CC(=O)N1CCC[C@@H](CN[C@@H](c2ccc3c(c2)OCCO3)c2ccccc2Cl)C1 ZINC000479489289 894810762 /nfs/dbraw/zinc/81/07/62/894810762.db2.gz JLBFGHXHZLGQIP-SBUREZEXSA-N 0 3 414.933 4.049 20 0 HIADHN C[C@@H](NCc1ccc2ncccc2c1)c1ccc(S(=O)(=O)NCc2ccco2)cc1 ZINC000479489554 894810771 /nfs/dbraw/zinc/81/07/71/894810771.db2.gz MEJOEQVWLCEJBR-QGZVFWFLSA-N 0 3 421.522 4.157 20 0 HIADHN Cc1ccc([C@H](CNC(=O)NCc2csc(-c3ccco3)n2)N2CCCC2)cc1 ZINC000479496242 894814602 /nfs/dbraw/zinc/81/46/02/894814602.db2.gz AZPZSNDYTLLBFP-IBGZPJMESA-N 0 3 410.543 4.348 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(-c2ccc(C(F)(F)F)cc2)s1)C(=O)N1CCNC1=O ZINC000479502098 894817988 /nfs/dbraw/zinc/81/79/88/894817988.db2.gz MIQJTBUJPXQUQO-NWDGAFQWSA-N 0 3 411.449 4.025 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)NCc1csc(-c2ccco2)n1 ZINC000479592139 894875271 /nfs/dbraw/zinc/87/52/71/894875271.db2.gz MKGZVRZKMGLWJS-UHFFFAOYSA-N 0 3 418.950 4.330 20 0 HIADHN Cc1ccc([C@H](OC[C@H](O)CN(C)[C@H](CO)c2ccccc2)c2ccccc2)cc1 ZINC000479669660 894946930 /nfs/dbraw/zinc/94/69/30/894946930.db2.gz ZECIANGCQAQFGV-TWJOJJKGSA-N 0 3 405.538 4.127 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)NC[C@H]2CCC[C@@H](C(F)(F)F)C2)c1 ZINC000479680176 894964003 /nfs/dbraw/zinc/96/40/03/894964003.db2.gz VUSNSIQYHSJBOQ-FUHWJXTLSA-N 0 3 415.500 4.137 20 0 HIADHN COCC[C@H](NC(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1)c1ccc(C)o1 ZINC000479680423 894964580 /nfs/dbraw/zinc/96/45/80/894964580.db2.gz XKPQQZUDWHUZHR-RXVVDRJESA-N 0 3 424.463 4.236 20 0 HIADHN Cc1ccc(-c2nnc(-c3ccc(C(=O)NCCN4CCC[C@@H](C)C4)cc3)o2)cc1 ZINC000479771431 895073198 /nfs/dbraw/zinc/07/31/98/895073198.db2.gz GSLQTBWKQSAPAA-GOSISDBHSA-N 0 3 404.514 4.174 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N[C@@H](C)c1cc(OC)c(OC)cc1C)c1ccco1 ZINC000479778487 895080959 /nfs/dbraw/zinc/08/09/59/895080959.db2.gz BFCAWDKIXHTLIT-XYJFISCASA-N 0 3 403.523 4.095 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N[C@H](C)c1ccc(NC(=O)C2CC2)cc1)c1ccco1 ZINC000479789347 895092515 /nfs/dbraw/zinc/09/25/15/895092515.db2.gz QTQQTNBZYWFDMT-RZQQEMMASA-N 0 3 412.534 4.118 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N[C@@H](C)c1ccc(NC(=O)C2CC2)cc1)c1ccco1 ZINC000479789348 895092954 /nfs/dbraw/zinc/09/29/54/895092954.db2.gz QTQQTNBZYWFDMT-TWOQFEAHSA-N 0 3 412.534 4.118 20 0 HIADHN CCCOc1ccc([C@@H](C)NC(=O)N[C@H](CN(C)C)c2ccc(F)cc2)cc1OC ZINC000479809883 895116241 /nfs/dbraw/zinc/11/62/41/895116241.db2.gz DJVSPUDVYAZVMG-OXQOHEQNSA-N 0 3 417.525 4.286 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)N1CCCn2c(cc3ccccc32)C1 ZINC000479811408 895121238 /nfs/dbraw/zinc/12/12/38/895121238.db2.gz HMHPJJNWYBSCIS-QHCPKHFHSA-N 0 3 402.542 4.394 20 0 HIADHN C[C@@H](NC[C@@H](c1ccco1)N1CCCC1)c1ccc(S(=O)(=O)C2CCCC2)cc1 ZINC000479864986 895203427 /nfs/dbraw/zinc/20/34/27/895203427.db2.gz XSEQNKPXWYMPRR-GCJKJVERSA-N 0 3 416.587 4.484 20 0 HIADHN FC(F)(F)c1ccccc1N1CC[C@H](NCc2ccc(Br)cn2)C1 ZINC000479867488 895208156 /nfs/dbraw/zinc/20/81/56/895208156.db2.gz VJKMBHONOQSEEW-AWEZNQCLSA-N 0 3 400.242 4.231 20 0 HIADHN COc1cccc([C@H](CN[C@@H](C)c2nnn(-c3ccc(Cl)cc3)c2C)N(C)C)c1 ZINC000479870718 895212691 /nfs/dbraw/zinc/21/26/91/895212691.db2.gz FBESLVHJHCEJQJ-BTYIYWSLSA-N 0 3 413.953 4.191 20 0 HIADHN FC(F)(F)Oc1ccc2c(c1)[C@H](NCc1ccc(CN3CCOCC3)cc1)CC2 ZINC000479903558 895252037 /nfs/dbraw/zinc/25/20/37/895252037.db2.gz QCSRXDLMMXUUAG-OAQYLSRUSA-N 0 3 406.448 4.195 20 0 HIADHN FC(F)c1ccnc(NCc2ccccc2CN2CCN(c3ccccc3)CC2)n1 ZINC000479924144 895271752 /nfs/dbraw/zinc/27/17/52/895271752.db2.gz BALADQLVXCNUSS-UHFFFAOYSA-N 0 3 409.484 4.349 20 0 HIADHN CC(C)COC[C@@H](NC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1)c1ccco1 ZINC000505292647 913950943 /nfs/dbraw/zinc/95/09/43/913950943.db2.gz XSGLLHSVSBHLAS-PZJWPPBQSA-N 0 3 402.510 4.161 20 0 HIADHN C[C@H]1CCN(C(=O)Nc2nnc(-c3ccccc3)s2)CCN1Cc1ccccc1 ZINC000479951563 895304837 /nfs/dbraw/zinc/30/48/37/895304837.db2.gz AIFLHNCMZUZBAD-KRWDZBQOSA-N 0 3 407.543 4.333 20 0 HIADHN Cc1nc(-c2ccccc2)sc1C(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000479988199 895340798 /nfs/dbraw/zinc/34/07/98/895340798.db2.gz JDGNQPVUXIDPBY-UHFFFAOYSA-N 0 3 421.566 4.005 20 0 HIADHN C[C@@H](Sc1ccc(Cl)cc1)C(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000479989298 895341873 /nfs/dbraw/zinc/34/18/73/895341873.db2.gz JYACUZYKVIQDKU-MRXNPFEDSA-N 0 3 418.990 4.094 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)c3cc4c(cc(Cl)cc4Cl)[nH]3)CC2)C[C@H](C)O1 ZINC000480027864 895377159 /nfs/dbraw/zinc/37/71/59/895377159.db2.gz CSQJFCDQSXKYSP-KBPBESRZSA-N 0 3 424.372 4.436 20 0 HIADHN Cc1c(C(F)(F)F)nn(C)c1NC(=O)N[C@H](CN(C)Cc1ccccc1)C(C)C ZINC000480050791 895398288 /nfs/dbraw/zinc/39/82/88/895398288.db2.gz ZEZXJPYMPQMRIH-MRXNPFEDSA-N 0 3 411.472 4.025 20 0 HIADHN COc1cccc([C@H](CN[C@H](C)c2nnn(-c3ccc(F)cc3)c2C)N2CCCC2)c1 ZINC000480081453 895438252 /nfs/dbraw/zinc/43/82/52/895438252.db2.gz FOFHEOUPKLZTLB-HXOBKFHXSA-N 0 3 423.536 4.211 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2ccc(F)c3ccccc23)cc1)[C@@H]1CCCN(C)C1 ZINC000480114694 895487633 /nfs/dbraw/zinc/48/76/33/895487633.db2.gz HJORYNHBPJINTK-LJQANCHMSA-N 0 3 419.500 4.397 20 0 HIADHN O=S1(=O)CC[C@H](N[C@@H](Cc2ccccc2)C2CC2)c2cc(Br)ccc21 ZINC000480159217 895545250 /nfs/dbraw/zinc/54/52/50/895545250.db2.gz KYQBGRLDYQOYNR-OALUTQOASA-N 0 3 420.372 4.279 20 0 HIADHN CC(C)[C@@H](N[C@@H](C)c1ccc(S(C)(=O)=O)c(F)c1)c1ccc2c(c1)OCCO2 ZINC000480160948 895546840 /nfs/dbraw/zinc/54/68/40/895546840.db2.gz DYAWDITUQXORQN-LHSJRXKWSA-N 0 3 407.507 4.048 20 0 HIADHN O=C(Nc1ccc(Br)cn1)C1CCN(CCc2ccccc2Cl)CC1 ZINC000480181949 895576694 /nfs/dbraw/zinc/57/66/94/895576694.db2.gz SOECGRRJHOOJET-UHFFFAOYSA-N 0 3 422.754 4.391 20 0 HIADHN O=S1(=O)CC[C@@H](NCCC2Cc3ccccc3C2)c2cc(Br)ccc21 ZINC000480185363 895579965 /nfs/dbraw/zinc/57/99/65/895579965.db2.gz UEADAVNFGRIQDC-LJQANCHMSA-N 0 3 420.372 4.062 20 0 HIADHN Cc1cccc([C@@H](C)CN[C@H]2CCS(=O)(=O)c3ccc(Br)cc32)c1 ZINC000480202990 895601720 /nfs/dbraw/zinc/60/17/20/895601720.db2.gz ZOBKRQAKILXTQN-KSSFIOAISA-N 0 3 408.361 4.369 20 0 HIADHN Cc1cccc([C@H](C)CN[C@@H]2CCS(=O)(=O)c3ccc(Br)cc32)c1 ZINC000480202993 895602165 /nfs/dbraw/zinc/60/21/65/895602165.db2.gz ZOBKRQAKILXTQN-RDTXWAMCSA-N 0 3 408.361 4.369 20 0 HIADHN CC[C@@H](N[C@H](CN1CCCC1)c1ccccc1)c1ccccc1OCC(=O)N(C)C ZINC000480233227 895639107 /nfs/dbraw/zinc/63/91/07/895639107.db2.gz UQKDSYUDOWLJAZ-DHIUTWEWSA-N 0 3 409.574 4.031 20 0 HIADHN O=S1(=O)CC[C@@H](NCC2(c3ccc(F)cc3)CC2)c2cc(Br)ccc21 ZINC000480246427 895656998 /nfs/dbraw/zinc/65/69/98/895656998.db2.gz KOBNHOBSEMZFBM-QGZVFWFLSA-N 0 3 424.335 4.128 20 0 HIADHN COC[C@H](NC[C@H](c1ccccc1)N1CCOCC1)c1cccc(C(F)(F)F)c1 ZINC000480249884 895661057 /nfs/dbraw/zinc/66/10/57/895661057.db2.gz QNXNFWWQDNOQRQ-LEWJYISDSA-N 0 3 408.464 4.056 20 0 HIADHN COc1cc(OC)c([C@@H](C)NC[C@@H](c2ccccc2)N2CCOCC2)cc1Cl ZINC000480251137 895662824 /nfs/dbraw/zinc/66/28/24/895662824.db2.gz GVROTDXWPVZWJJ-UZLBHIALSA-N 0 3 404.938 4.081 20 0 HIADHN COc1ccc([C@@H](C)NC[C@@H](c2ccccc2Cl)N2CCOCC2)c(OC)c1 ZINC000480276105 895682747 /nfs/dbraw/zinc/68/27/47/895682747.db2.gz RWHFSSNMJABHPS-IERDGZPVSA-N 0 3 404.938 4.081 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)Nc2cc(C(F)(F)F)ccn2)N(C)C)cc1 ZINC000480296788 895702479 /nfs/dbraw/zinc/70/24/79/895702479.db2.gz SXPKFWVQIRGUSO-KRWDZBQOSA-N 0 3 410.440 4.312 20 0 HIADHN CCN(Cc1cccc(Br)c1)C(=O)NC[C@H](c1ccccc1)N(C)C ZINC000480298842 895704578 /nfs/dbraw/zinc/70/45/78/895704578.db2.gz ZMWFKSLMWZEHMP-LJQANCHMSA-N 0 3 404.352 4.284 20 0 HIADHN O=C1[C@H](NCc2ccc(OCC3CC3)cc2)CCCN1Cc1ccc(F)cc1F ZINC000480305914 895710354 /nfs/dbraw/zinc/71/03/54/895710354.db2.gz ITSLBCSEOMTXMB-JOCHJYFZSA-N 0 3 400.469 4.034 20 0 HIADHN CCN(C)c1ccc(CNC2(c3ccc(Br)cc3)CCOCC2)cn1 ZINC000480361424 895768240 /nfs/dbraw/zinc/76/82/40/895768240.db2.gz XCFDGMTWBWCBBR-UHFFFAOYSA-N 0 3 404.352 4.096 20 0 HIADHN CC(=O)Nc1cccc(OCCNCc2cc(Br)c(Cl)s2)c1 ZINC000480369891 895777832 /nfs/dbraw/zinc/77/78/32/895777832.db2.gz CPIQZLQANICZQX-UHFFFAOYSA-N 0 3 403.729 4.291 20 0 HIADHN COC(=O)c1csc(-c2cccc(CNCc3ccc(N(C)C(C)C)nc3)c2)n1 ZINC000480439128 895829273 /nfs/dbraw/zinc/82/92/73/895829273.db2.gz BZXFFMKTSITENU-UHFFFAOYSA-N 0 3 410.543 4.126 20 0 HIADHN C[C@H](O)[C@](C)(CNCc1csc(-c2ccc3c(c2)OCO3)n1)Cc1ccccc1 ZINC000480448637 895836775 /nfs/dbraw/zinc/83/67/75/895836775.db2.gz YHMPCHWPJZAJOZ-HJPURHCSSA-N 0 3 410.539 4.258 20 0 HIADHN COC(=O)c1csc(-c2cccc(CNCc3c(C)nn(C(C)(C)C)c3C)c2)n1 ZINC000480458682 895844951 /nfs/dbraw/zinc/84/49/51/895844951.db2.gz FCTACNDWSWFZCO-UHFFFAOYSA-N 0 3 412.559 4.455 20 0 HIADHN C[C@@H](N[C@H](CN1CCOCC1)c1ccccc1)c1ccc(OCC(F)(F)F)cc1 ZINC000480465535 895847961 /nfs/dbraw/zinc/84/79/61/895847961.db2.gz FXGRFDBVIKFQEK-DYESRHJHSA-N 0 3 408.464 4.352 20 0 HIADHN COC(=O)c1csc(-c2cccc(CNCc3cnc(C)n3-c3ccccc3)c2)n1 ZINC000480499608 895870025 /nfs/dbraw/zinc/87/00/25/895870025.db2.gz ZEMKTDNNOCEFRF-UHFFFAOYSA-N 0 3 418.522 4.381 20 0 HIADHN Cc1cccc(Oc2ccc(NC(=O)N3CC[C@@H](N4CCN(C)CC4)[C@H](C)C3)cc2)c1 ZINC000480542155 895903703 /nfs/dbraw/zinc/90/37/03/895903703.db2.gz RCGBCYZHVMUXBO-HYBUGGRVSA-N 0 3 422.573 4.277 20 0 HIADHN FC(F)(F)C1CCN(C2CC(Nc3nccc(OCc4ccccc4)n3)C2)CC1 ZINC000480560195 895920000 /nfs/dbraw/zinc/92/00/00/895920000.db2.gz FGEHJLFOJDYQAT-UHFFFAOYSA-N 0 3 406.452 4.273 20 0 HIADHN Cc1cc(C(=O)N2CCCN(CCCc3ccccc3)CC2)nn1-c1cccc(F)c1 ZINC000480571507 895931039 /nfs/dbraw/zinc/93/10/39/895931039.db2.gz KCTWBAVKXFTFOJ-UHFFFAOYSA-N 0 3 420.532 4.101 20 0 HIADHN CN1CC[C@H](NC(=O)[C@@H]2C[C@H]2c2ccc(OC(F)(F)F)cc2)[C@H]1c1ccccc1 ZINC000480578085 895938422 /nfs/dbraw/zinc/93/84/22/895938422.db2.gz MWLJRRTZLAWZKL-ZGXWSNOMSA-N 0 3 404.432 4.250 20 0 HIADHN COc1cc([C@H](C)NCc2ccc(N3C[C@@H](C)O[C@@H](C)C3)nc2)ccc1OC(F)F ZINC000480627097 895995891 /nfs/dbraw/zinc/99/58/91/895995891.db2.gz RCQIXQLZEUQYKP-XHSDSOJGSA-N 0 3 421.488 4.156 20 0 HIADHN CC(C)NC(=O)Nc1ccc([C@H](C)NCc2ccnc(OCC(F)(F)F)c2)cc1 ZINC000480636161 896006213 /nfs/dbraw/zinc/00/62/13/896006213.db2.gz XPCLSSRDLMIGFW-AWEZNQCLSA-N 0 3 410.440 4.403 20 0 HIADHN Cc1nc(-c2cccnc2)sc1[C@H](C)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)nc1 ZINC000480644261 896012322 /nfs/dbraw/zinc/01/23/22/896012322.db2.gz OWVUXWASNJIPBE-ZACQAIPSSA-N 0 3 423.586 4.373 20 0 HIADHN COc1cc2c(cc1OC)[C@@H](c1cccs1)N(C[C@H](O)Cc1ccccc1)CC2 ZINC000480645740 896013941 /nfs/dbraw/zinc/01/39/41/896013941.db2.gz JRUCEUSQJRONEO-DVECYGJZSA-N 0 3 409.551 4.316 20 0 HIADHN COc1ccc(-c2cc(C(=O)Nc3nc(CN4CCC[C@@H](C)C4)cs3)[nH]n2)cc1 ZINC000480672125 896036854 /nfs/dbraw/zinc/03/68/54/896036854.db2.gz OFHJEZXRJRVWKT-CQSZACIVSA-N 0 3 411.531 4.026 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)N2CCC[C@H]2c2ccc3c(c2)OCO3)N(C)C)cc1 ZINC000480679520 896043282 /nfs/dbraw/zinc/04/32/82/896043282.db2.gz BFBFVOHMSUDTIW-LEWJYISDSA-N 0 3 409.530 4.127 20 0 HIADHN C[C@@H](NCc1ccc(N2CCCS2(=O)=O)c(F)c1)c1ccc(OC(C)(C)C)cc1 ZINC000480708478 896070048 /nfs/dbraw/zinc/07/00/48/896070048.db2.gz LJZSHKSRFKSRDX-MRXNPFEDSA-N 0 3 420.550 4.394 20 0 HIADHN CS(=O)(=O)CCCCCN[C@H](c1ccc(F)cc1)c1cnc2ccccc2c1 ZINC000480742555 896105532 /nfs/dbraw/zinc/10/55/32/896105532.db2.gz CKFIUJKUNPPKCI-JOCHJYFZSA-N 0 3 400.519 4.268 20 0 HIADHN CCCOc1ccc([C@@H](C)N[C@H](C)c2cccc(NS(C)(=O)=O)c2)cc1OC ZINC000480742677 896105702 /nfs/dbraw/zinc/10/57/02/896105702.db2.gz RVZQMJNZRYLETL-HZPDHXFCSA-N 0 3 406.548 4.267 20 0 HIADHN C[C@H](N[C@H](c1ccccc1)C(C)(C)C)c1cccc(S(=O)(=O)N2CCOCC2)c1 ZINC000480770418 896133635 /nfs/dbraw/zinc/13/36/35/896133635.db2.gz RSTUUZAWRZHICB-PGRDOPGGSA-N 0 3 416.587 4.146 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N2CCC[C@@H]2c2ccc3c(c2)OCO3)N2CCCC2)cc1 ZINC000480797264 896164468 /nfs/dbraw/zinc/16/44/68/896164468.db2.gz ZVQQTNOPKIYJSL-FGZHOGPDSA-N 0 3 421.541 4.407 20 0 HIADHN C[C@@H](NCCC(=O)NC1CCCCC1)c1ccc(OC(F)F)cc1OC(F)F ZINC000480910312 896266298 /nfs/dbraw/zinc/26/62/98/896266298.db2.gz JWXUABGIGXKONZ-GFCCVEGCSA-N 0 3 406.420 4.379 20 0 HIADHN CC[C@@H](NCc1cccc(NC(=O)Cn2cccn2)c1)c1ccc(OC(F)F)cc1 ZINC000480912972 896269196 /nfs/dbraw/zinc/26/91/96/896269196.db2.gz SQFVVIONJGAMTO-HXUWFJFHSA-N 0 3 414.456 4.364 20 0 HIADHN CCc1cc(NC(=O)N2CCC[C@H](CN3CCN(c4ccccn4)CC3)C2)ccc1C ZINC000480969534 896307353 /nfs/dbraw/zinc/30/73/53/896307353.db2.gz WFFHOVCJDKNMJQ-OAQYLSRUSA-N 0 3 421.589 4.019 20 0 HIADHN CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)NCc1ccc(OC2CCCC2)cc1 ZINC000505390101 914054683 /nfs/dbraw/zinc/05/46/83/914054683.db2.gz XSMXSBRXOWMSSB-URXFXBBRSA-N 0 3 422.573 4.237 20 0 HIADHN CNS(=O)(=O)c1cccc(CN[C@@H](Cc2ccccc2)c2ccc(C)c(C)c2)c1 ZINC000481028405 896356211 /nfs/dbraw/zinc/35/62/11/896356211.db2.gz YNPSAHFTVCBRRO-DEOSSOPVSA-N 0 3 408.567 4.285 20 0 HIADHN CNS(=O)(=O)c1cccc(CN[C@@H](CC(C)C)c2cccc(C(F)(F)F)c2)c1 ZINC000481030211 896357856 /nfs/dbraw/zinc/35/78/56/896357856.db2.gz AQKDMJGEIUEQNE-IBGZPJMESA-N 0 3 414.493 4.491 20 0 HIADHN C[C@@H](NC[C@H](c1ccccc1)N1CCC(C)CC1)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000481053137 896376829 /nfs/dbraw/zinc/37/68/29/896376829.db2.gz ZPDTZRSSUBGROM-XMSQKQJNSA-N 0 3 418.578 4.353 20 0 HIADHN CNS(=O)(=O)c1ccc([C@H](C)N[C@H]2C[C@H](C)c3c2cccc3Br)cc1 ZINC000481176988 896511171 /nfs/dbraw/zinc/51/11/71/896511171.db2.gz PIYZYWLFBHSQQK-LXIYXOSZSA-N 0 3 423.376 4.256 20 0 HIADHN CC[C@@H](N[C@@H](C)c1ccc(S(=O)(=O)NC)cc1)c1cccc(Br)c1 ZINC000481181323 896521255 /nfs/dbraw/zinc/52/12/55/896521255.db2.gz ZBXVTZZSJUPSKD-SCLBCKFNSA-N 0 3 411.365 4.159 20 0 HIADHN Cc1nn(C)c(=O)c(-c2nc(CN[C@H]3CCCC[C@H]3Cc3ccccc3)cs2)c1C ZINC000481183527 896526770 /nfs/dbraw/zinc/52/67/70/896526770.db2.gz QXWYDHGZZIDDLS-FPOVZHCZSA-N 0 3 422.598 4.412 20 0 HIADHN CCOC(=O)[C@@]1(Cc2ccccc2)CCCN1C(=O)c1cccc(CN2CCCC2)c1 ZINC000481185080 896530087 /nfs/dbraw/zinc/53/00/87/896530087.db2.gz DECZKEDKQOXIBM-SANMLTNESA-N 0 3 420.553 4.063 20 0 HIADHN C[C@@H]1Cc2ccccc2[C@@H]1NCc1cccc(S(=O)(=O)NCc2cccc(F)c2)c1 ZINC000481189370 896539196 /nfs/dbraw/zinc/53/91/96/896539196.db2.gz MRVJZOFGYIQOPL-MZNJEOGPSA-N 0 3 424.541 4.327 20 0 HIADHN C[C@@H](NCc1ccccc1OCCN1CCOCC1)c1cccc(-c2ccncc2)c1 ZINC000481199940 896552304 /nfs/dbraw/zinc/55/23/04/896552304.db2.gz GLRIWQKYQIMQMT-OAQYLSRUSA-N 0 3 417.553 4.310 20 0 HIADHN Cc1nn(-c2ccccc2)cc1CCCNC(=O)N[C@H](C)[C@H](c1ccccc1)N(C)C ZINC000481224877 896576703 /nfs/dbraw/zinc/57/67/03/896576703.db2.gz IFBWUKFBSNTZSI-HYBUGGRVSA-N 0 3 419.573 4.104 20 0 HIADHN CCOc1cc(CN2CC[C@H](C(N)=O)C2)ccc1OCc1c(Cl)cccc1Cl ZINC000505415869 914080311 /nfs/dbraw/zinc/08/03/11/914080311.db2.gz PWHSFNABQQOURB-HNNXBMFYSA-N 0 3 423.340 4.278 20 0 HIADHN Cc1nc(-c2cc([C@H](C)NCc3cccnc3N3CCN(C)CC3)cs2)cs1 ZINC000481238473 896588548 /nfs/dbraw/zinc/58/85/48/896588548.db2.gz ZTEZNOKRLGOSFG-HNNXBMFYSA-N 0 3 413.616 4.178 20 0 HIADHN C[C@@H](NCc1cccnc1N1CCN(C)CC1)c1ccc(Oc2ccccc2)cc1 ZINC000481243193 896593930 /nfs/dbraw/zinc/59/39/30/896593930.db2.gz SNTSOUXXTMVQJK-HXUWFJFHSA-N 0 3 402.542 4.477 20 0 HIADHN CCC[C@@H](NCc1cccnc1N1CCN(C)CC1)c1cccc(C(F)(F)F)c1 ZINC000481255517 896605894 /nfs/dbraw/zinc/60/58/94/896605894.db2.gz IRASWQZDJNJPOQ-HXUWFJFHSA-N 0 3 406.496 4.483 20 0 HIADHN CN(C)C[C@H](NC(=O)N[C@H](c1cccc(F)c1F)C(F)(F)F)c1ccc(F)cc1 ZINC000481291478 896636490 /nfs/dbraw/zinc/63/64/90/896636490.db2.gz XYSJSBHBBRAOFG-DOTOQJQBSA-N 0 3 419.369 4.309 20 0 HIADHN CCOc1c(Cl)cc(CN[C@H](C)c2cccc(N3CCOCC3)c2)cc1OC ZINC000481303444 896649206 /nfs/dbraw/zinc/64/92/06/896649206.db2.gz BFLQRJODDICUSA-MRXNPFEDSA-N 0 3 404.938 4.435 20 0 HIADHN CCC(CC)C(=O)N1CCC(N[C@@H](C)c2nnn(-c3ccc(Cl)cc3)c2C)CC1 ZINC000481302582 896649272 /nfs/dbraw/zinc/64/92/72/896649272.db2.gz CVQUKGPVYWHXIM-HNNXBMFYSA-N 0 3 417.985 4.307 20 0 HIADHN COc1cc(C)c([C@H](C)N[C@@H](C)c2ccc(OCC(=O)NC3CC3)cc2)cc1OC ZINC000481327748 896686199 /nfs/dbraw/zinc/68/61/99/896686199.db2.gz MBHRCYRYIXZIOX-IRXDYDNUSA-N 0 3 412.530 4.081 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)Nc2c3c(nn2C(C)C)CCC3)N(C)C)cc1 ZINC000481383104 896782436 /nfs/dbraw/zinc/78/24/36/896782436.db2.gz QLFLXJWLISVFGE-NRFANRHFSA-N 0 3 413.566 4.164 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)N[C@H](C3CCCC3)C(F)(F)F)CC2)C[C@H](C)O1 ZINC000481388714 896790428 /nfs/dbraw/zinc/79/04/28/896790428.db2.gz SIKCUYSAOCWGSL-JTDSTZFVSA-N 0 3 419.532 4.028 20 0 HIADHN CN(C)C[C@@H](NC(=O)N[C@@H](c1ccc(F)cc1)C(F)(F)F)c1ccc(F)cc1 ZINC000481391414 896795408 /nfs/dbraw/zinc/79/54/08/896795408.db2.gz LVGPJWYFDJKWCE-SJORKVTESA-N 0 3 401.379 4.170 20 0 HIADHN Clc1cccc2c1SCC[C@H]2NCc1cccc(OCCN2CCOCC2)c1 ZINC000481421854 896824165 /nfs/dbraw/zinc/82/41/65/896824165.db2.gz RHHZLLLWNAPXKT-OAQYLSRUSA-N 0 3 418.990 4.378 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Cc2c[nH]c3cc(Br)ccc23)N(C)C)cc1 ZINC000481483129 896866260 /nfs/dbraw/zinc/86/62/60/896866260.db2.gz ZBZGBNMSWYGUGQ-HXUWFJFHSA-N 0 3 414.347 4.200 20 0 HIADHN CC(C)C[C@H](C)n1nccc1NC(=O)N1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000481489525 896869939 /nfs/dbraw/zinc/86/99/39/896869939.db2.gz HTYNDKJGDCRNPE-UFYCRDLUSA-N 0 3 419.614 4.233 20 0 HIADHN Cc1ccc(OCCCC(=O)N2CCC(CN3C[C@@H](C)O[C@H](C)C3)CC2)c(Cl)c1 ZINC000481519335 896885186 /nfs/dbraw/zinc/88/51/86/896885186.db2.gz NDLLSJFFWQJVFB-RTBURBONSA-N 0 3 422.997 4.155 20 0 HIADHN C[C@@H](COc1ccccc1C(F)(F)F)N[C@@H](C)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000481542197 896902680 /nfs/dbraw/zinc/90/26/80/896902680.db2.gz JOERMQRWEHKEBQ-STQMWFEESA-N 0 3 419.440 4.366 20 0 HIADHN CCOc1ccc(CN[C@H](C)c2ccc(S(=O)(=O)NCc3ccco3)cc2)cc1 ZINC000481561184 896937769 /nfs/dbraw/zinc/93/77/69/896937769.db2.gz YAHABKGZANISPK-QGZVFWFLSA-N 0 3 414.527 4.008 20 0 HIADHN CC[C@@H](NCc1cccc(C(=O)NC[C@@H]2CCCO2)c1)c1ccc(OC(F)F)cc1 ZINC000481562043 896938053 /nfs/dbraw/zinc/93/80/53/896938053.db2.gz KZWZJWSKELNUIG-LEWJYISDSA-N 0 3 418.484 4.438 20 0 HIADHN CCOc1ccc(CN[C@@H](C)c2ccc(S(=O)(=O)N3CCCCC3)cc2)cc1 ZINC000481561755 896938231 /nfs/dbraw/zinc/93/82/31/896938231.db2.gz YSGYOFVNCAGOBO-SFHVURJKSA-N 0 3 402.560 4.111 20 0 HIADHN COc1cc([C@@H](C)NCc2cccc(CN3CCO[C@@H](C)C3)c2)ccc1OC(F)F ZINC000481585337 896964261 /nfs/dbraw/zinc/96/42/61/896964261.db2.gz VAZQRMXFEDIFLZ-DLBZAZTESA-N 0 3 420.500 4.368 20 0 HIADHN Cc1cc(NC(=O)Cc2ccc(OC(F)F)cc2)cc(N2CCN(C(C)C)CC2)c1 ZINC000481647180 897033100 /nfs/dbraw/zinc/03/31/00/897033100.db2.gz ROOSYNDNLUQIAR-UHFFFAOYSA-N 0 3 417.500 4.308 20 0 HIADHN C[C@H](N[C@H]1CCCc2cc(OC(F)F)ccc21)c1cccc(NS(C)(=O)=O)c1 ZINC000481733550 897127774 /nfs/dbraw/zinc/12/77/74/897127774.db2.gz HYDOMGWAAFXXLJ-DJJJIMSYSA-N 0 3 410.486 4.388 20 0 HIADHN COc1ccc([C@@H](C)N[C@H](C)c2ccc(S(=O)(=O)N3CCCCC3)cc2)cc1 ZINC000481734604 897129484 /nfs/dbraw/zinc/12/94/84/897129484.db2.gz KMHKIKLQHOAAMT-QZTJIDSGSA-N 0 3 402.560 4.282 20 0 HIADHN C[C@H](N[C@@H]1CCCc2cc(OC(F)F)ccc21)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000481736349 897131105 /nfs/dbraw/zinc/13/11/05/897131105.db2.gz NLBLFCUTYBZVCW-VBKZILBWSA-N 0 3 424.513 4.267 20 0 HIADHN CCc1ccc(-c2nc(CC(=O)N[C@@H]3CN(C)C[C@@H]3c3ccccc3)cs2)cc1 ZINC000481753140 897144736 /nfs/dbraw/zinc/14/47/36/897144736.db2.gz GWTHRNYRYQKQFE-FGZHOGPDSA-N 0 3 405.567 4.129 20 0 HIADHN O=C(COc1ccccc1CNC1CC(F)(c2cccc(Cl)c2)C1)NCC1CC1 ZINC000481814547 897188222 /nfs/dbraw/zinc/18/82/22/897188222.db2.gz KOGFMNKMRQNNKO-UHFFFAOYSA-N 0 3 416.924 4.362 20 0 HIADHN CN(Cc1ccccc1)Cc1cccc(C(=O)N2CCN[C@@H](c3cccc(F)c3)C2)c1 ZINC000505466422 914136800 /nfs/dbraw/zinc/13/68/00/914136800.db2.gz AICXMADGXLGIBT-RUZDIDTESA-N 0 3 417.528 4.244 20 0 HIADHN CN1C[C@@H](c2ccccc2)[C@H](NC(=O)Cc2csc(-c3ccc(Cl)cc3)n2)C1 ZINC000481847127 897213456 /nfs/dbraw/zinc/21/34/56/897213456.db2.gz MMHYTIRFLLJCGQ-VQTJNVASSA-N 0 3 411.958 4.220 20 0 HIADHN C[C@H](Cc1ccccc1C(F)(F)F)N[C@@H](c1nc(-c2nc[nH]n2)no1)C(C)(C)C ZINC000482001843 897399377 /nfs/dbraw/zinc/39/93/77/897399377.db2.gz YCMRLJMTTMJUFH-RISCZKNCSA-N 0 3 408.428 4.182 20 0 HIADHN COc1ccc(-c2ccncc2)cc1CN1CCC[C@@H](CNC(=O)c2ccccc2)C1 ZINC000482005216 897403281 /nfs/dbraw/zinc/40/32/81/897403281.db2.gz JKUCXIJQOXVKNO-FQEVSTJZSA-N 0 3 415.537 4.399 20 0 HIADHN Cc1noc(Cl)c1CCC(=O)Nc1cc(C)cc(N2CCN(C(C)C)CC2)c1 ZINC000482026343 897432384 /nfs/dbraw/zinc/43/23/84/897432384.db2.gz OBGYUGPKSIZHKR-UHFFFAOYSA-N 0 3 404.942 4.047 20 0 HIADHN CC(=O)N1CCN(c2ccccc2CN[C@@H]2CCc3c2ccc(Cl)c3Cl)CC1 ZINC000482032448 897443774 /nfs/dbraw/zinc/44/37/74/897443774.db2.gz LABWIBNWQUEQGW-HXUWFJFHSA-N 0 3 418.368 4.439 20 0 HIADHN Cc1nc(-c2ccccc2)sc1[C@@H](C)NCc1ccc([C@]2(C)NC(=O)NC2=O)cc1 ZINC000482073191 897508852 /nfs/dbraw/zinc/50/88/52/897508852.db2.gz JRVPAZWZHIVYSY-FATZIPQQSA-N 0 3 420.538 4.024 20 0 HIADHN C[C@H](NCC(=O)NCC(F)F)c1ccc(-c2ccc(Br)cc2)s1 ZINC000482075211 897512154 /nfs/dbraw/zinc/51/21/54/897512154.db2.gz LIXWEDAWHXUKFJ-JTQLQIEISA-N 0 3 403.292 4.210 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Nc1cnn(-c2ccc(Cl)cc2)c1 ZINC000482093500 897537151 /nfs/dbraw/zinc/53/71/51/897537151.db2.gz AMCMMPPPGUWRPI-UHFFFAOYSA-N 0 3 403.939 4.183 20 0 HIADHN COc1ccc([C@H](C)NCc2ccc(NC(=O)c3ccncc3)cc2)cc1NC(C)=O ZINC000482131821 897588881 /nfs/dbraw/zinc/58/88/81/897588881.db2.gz YMFOGIODZQNXQP-INIZCTEOSA-N 0 3 418.497 4.152 20 0 HIADHN O=C(CCc1ccc(Br)cc1)NC[C@H](c1cccs1)N1CCCC1 ZINC000482154243 897617950 /nfs/dbraw/zinc/61/79/50/897617950.db2.gz CLHYQXVKGHPVSL-QGZVFWFLSA-N 0 3 407.377 4.397 20 0 HIADHN COC(=O)c1ccc(COc2ccc(CN[C@@H]3CCc4c3cccc4O)cc2OC)o1 ZINC000482201526 897678566 /nfs/dbraw/zinc/67/85/66/897678566.db2.gz XYDISXPCIQCDIE-LJQANCHMSA-N 0 3 423.465 4.137 20 0 HIADHN COC(=O)c1ccc(-c2ccc(CN[C@H](Cc3ccccc3)[C@H](O)C(F)F)o2)cc1 ZINC000482206456 897685170 /nfs/dbraw/zinc/68/51/70/897685170.db2.gz FIROKFWETXKZDL-CTNGQTDRSA-N 0 3 415.436 4.060 20 0 HIADHN CCc1c(NC(=O)N[C@@H](CN(C)C)c2ccc(F)cc2)cnn1-c1ccccc1C ZINC000482238908 897719986 /nfs/dbraw/zinc/71/99/86/897719986.db2.gz KNTNLFZPMMLRMU-FQEVSTJZSA-N 0 3 409.509 4.307 20 0 HIADHN Cc1nc2n(n1)C[C@@H](N[C@H](C)c1cnn(-c3ccc(Cl)cc3Cl)c1C)CC2 ZINC000482244651 897726100 /nfs/dbraw/zinc/72/61/00/897726100.db2.gz QDEWLQXWFFOPQU-ABAIWWIYSA-N 0 3 405.333 4.053 20 0 HIADHN CC[C@@H](N[C@@H](C)c1cccc(S(=O)(=O)NC)c1)c1cccc(Br)c1 ZINC000482249768 897731325 /nfs/dbraw/zinc/73/13/25/897731325.db2.gz ZZIPJDSZGLHFIP-SCLBCKFNSA-N 0 3 411.365 4.159 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)Cc1c[nH]c2cc(Br)ccc12 ZINC000482338535 897845238 /nfs/dbraw/zinc/84/52/38/897845238.db2.gz ZYLNYZMTKYUULD-UHFFFAOYSA-N 0 3 400.320 4.482 20 0 HIADHN COc1ccc([C@@H](NC(=O)N(CCN(C)C)Cc2ccccc2)C(F)(F)F)cc1 ZINC000482362343 897881189 /nfs/dbraw/zinc/88/11/89/897881189.db2.gz TUQBRVAKAHTQBK-LJQANCHMSA-N 0 3 409.452 4.072 20 0 HIADHN CN(C)CCN(C(=O)N[C@H](c1ccccc1OC(F)F)C(F)(F)F)C1CCCC1 ZINC000482377130 897904823 /nfs/dbraw/zinc/90/48/23/897904823.db2.gz OYVXOXOJAKTELW-MRXNPFEDSA-N 0 3 423.426 4.407 20 0 HIADHN CN(C)[C@H](CNC(=O)N[C@H](c1c(F)cccc1F)C(F)(F)F)c1ccccc1 ZINC000482404292 897944792 /nfs/dbraw/zinc/94/47/92/897944792.db2.gz MLBLCCDSKXXSNG-NVXWUHKLSA-N 0 3 401.379 4.170 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)N[C@H](c1c(F)cccc1F)C(F)(F)F ZINC000482419812 897970138 /nfs/dbraw/zinc/97/01/38/897970138.db2.gz WHNPPRQPNNWRPP-MRXNPFEDSA-N 0 3 421.435 4.403 20 0 HIADHN CCO[C@@H]1C[C@H](NCc2ccccc2OCc2ccccn2)[C@H]1Oc1ccccc1 ZINC000482494818 898074077 /nfs/dbraw/zinc/07/40/77/898074077.db2.gz GJPTVPYMWJUZJZ-ICDZXHCJSA-N 0 3 404.510 4.375 20 0 HIADHN CCO[C@@H]1C[C@@H](NCc2ccccc2OCc2ccncc2)[C@H]1Oc1ccccc1 ZINC000482496266 898074919 /nfs/dbraw/zinc/07/49/19/898074919.db2.gz SOYQXNDPHCGIQR-QLBJFCOMSA-N 0 3 404.510 4.375 20 0 HIADHN C[C@H](CN1CCC(c2nnc3n2CCCC3)CC1)c1cccc(Br)c1 ZINC000482496118 898075015 /nfs/dbraw/zinc/07/50/15/898075015.db2.gz NARPMNTZOWURDV-OAHLLOKOSA-N 0 3 403.368 4.360 20 0 HIADHN CCO[C@@H]1C[C@H](NCc2ccccc2OCc2cccnc2)[C@H]1Oc1ccccc1 ZINC000482495499 898075444 /nfs/dbraw/zinc/07/54/44/898075444.db2.gz OUAMJDSQIPUWCH-ICDZXHCJSA-N 0 3 404.510 4.375 20 0 HIADHN COC(=O)c1ccc(COc2ccc(CNC(C)(C)c3ccc(C)nc3)cc2OC)o1 ZINC000482497662 898077128 /nfs/dbraw/zinc/07/71/28/898077128.db2.gz CWCGDSYVPKPJRA-UHFFFAOYSA-N 0 3 424.497 4.382 20 0 HIADHN CC(=O)N[C@H](C)C1CCN(Cc2ccc(-c3cccc(Br)c3)o2)CC1 ZINC000482499152 898078990 /nfs/dbraw/zinc/07/89/90/898078990.db2.gz DDHDLSPYRPLVRC-CQSZACIVSA-N 0 3 405.336 4.446 20 0 HIADHN Cc1cc(CN2CCC(c3nnc4n3CCCC4)CC2)ccc1Oc1cccnc1 ZINC000482502720 898085373 /nfs/dbraw/zinc/08/53/73/898085373.db2.gz FHMPZTZUTXEXFL-UHFFFAOYSA-N 0 3 403.530 4.490 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)Nc2ccc3nnc(C(C)C)n3c2)N(C)C)cc1 ZINC000482509278 898093344 /nfs/dbraw/zinc/09/33/44/898093344.db2.gz NHRRRLZQFXGSCL-HXUWFJFHSA-N 0 3 424.549 4.064 20 0 HIADHN Cc1nc(Cc2ccccc2)sc1[C@H](C)NC[C@@H](O)COc1ccc(F)c(F)c1 ZINC000482538195 898125639 /nfs/dbraw/zinc/12/56/39/898125639.db2.gz PTGOEWBICRDOND-WMLDXEAASA-N 0 3 418.509 4.411 20 0 HIADHN C[C@@H](N[C@H](C)c1cc(F)ccc1N1CCN(C)CC1)c1ccc(F)cc1N(C)C ZINC000482544599 898133215 /nfs/dbraw/zinc/13/32/15/898133215.db2.gz TWIHJUWWCWQNJA-IAGOWNOFSA-N 0 3 402.533 4.194 20 0 HIADHN CC[C@H](N[C@H](C)c1cc(F)ccc1N1CCN(C)CC1)c1ccc2c(c1)OCCO2 ZINC000482565130 898158330 /nfs/dbraw/zinc/15/83/30/898158330.db2.gz MPMXLKGMYSRVLJ-UTKZUKDTSA-N 0 3 413.537 4.151 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)NCc1cccc(NC(=O)[C@H](C)CC)c1 ZINC000482571866 898167322 /nfs/dbraw/zinc/16/73/22/898167322.db2.gz DSHTZJFREUJVGF-LJQANCHMSA-N 0 3 402.583 4.079 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)[C@H]1CCCN(c2ncccc2C(F)(F)F)C1 ZINC000482607760 898209668 /nfs/dbraw/zinc/20/96/68/898209668.db2.gz LDFDRIZBKVWZCA-KRWDZBQOSA-N 0 3 420.479 4.326 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)[C@H](CC(C)C)NC(=O)c1ccc(Cl)cc1 ZINC000482616032 898217706 /nfs/dbraw/zinc/21/77/06/898217706.db2.gz FIZOQJUYVFKONF-NRFANRHFSA-N 0 3 415.965 4.493 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)N1CCC[C@@]2(C1)OCc1ccccc12 ZINC000482619386 898221251 /nfs/dbraw/zinc/22/12/51/898221251.db2.gz KRZXHXLLALINFL-REWPJTCUSA-N 0 3 411.571 4.116 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)C[C@@H](c3cccs3)n3cccc3)c2)CC1 ZINC000505537426 914231979 /nfs/dbraw/zinc/23/19/79/914231979.db2.gz AAHTXNIYLLDJPQ-NRFANRHFSA-N 0 3 408.571 4.310 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)c1cccc(N2C(=O)c3ccccc3C2=O)c1 ZINC000482629535 898233891 /nfs/dbraw/zinc/23/38/91/898233891.db2.gz LOHXKZPGOFCTCI-UHFFFAOYSA-N 0 3 413.477 4.110 20 0 HIADHN COC(=O)c1cc(NC(=O)c2oc3ccccc3c2CN(C)C)cc(Cl)c1F ZINC000482645055 898248559 /nfs/dbraw/zinc/24/85/59/898248559.db2.gz GACARZORXGXNDE-UHFFFAOYSA-N 0 3 404.825 4.326 20 0 HIADHN CN1C(=O)C[C@H](NCc2cccc(OCc3ccccn3)c2)[C@H]1c1ccc(F)c(F)c1 ZINC000482719581 898320970 /nfs/dbraw/zinc/32/09/70/898320970.db2.gz CIYIBDXTVFCJRL-LADGPHEKSA-N 0 3 423.463 4.000 20 0 HIADHN CN(CCOc1c(Br)cccc1Br)CCc1nccs1 ZINC000482797142 898405874 /nfs/dbraw/zinc/40/58/74/898405874.db2.gz LICWYADBHHQZSN-UHFFFAOYSA-N 0 3 420.170 4.221 20 0 HIADHN COc1ccc(-c2nc(C)c([C@H](C)N[C@@H](Cc3ccccc3)C(=O)N(C)C)s2)cc1 ZINC000482864795 898476332 /nfs/dbraw/zinc/47/63/32/898476332.db2.gz IVUAZIDTNWWMHC-KKSFZXQISA-N 0 3 423.582 4.477 20 0 HIADHN Cc1nc2ccccc2n1C1CCN([C@@H](C)C(=O)N(C)Cc2ccccc2C)CC1 ZINC000482870246 898483136 /nfs/dbraw/zinc/48/31/36/898483136.db2.gz OLKUDCXJNOCPIO-IBGZPJMESA-N 0 3 404.558 4.337 20 0 HIADHN COc1ccc(C[C@@H](NC[C@H]2CN(C)CCN2C)c2cc(Cl)ccc2Cl)cc1 ZINC000482893194 898511944 /nfs/dbraw/zinc/51/19/44/898511944.db2.gz UNNORORZMQBXKZ-PGRDOPGGSA-N 0 3 422.400 4.121 20 0 HIADHN C[C@@H]1CN(C(=O)Nc2ccc3c(c2)oc2ccccc23)CC[C@H]1N1CCN(C)CC1 ZINC000482908410 898527999 /nfs/dbraw/zinc/52/79/99/898527999.db2.gz PNADYJSFYAAPQM-DYESRHJHSA-N 0 3 406.530 4.076 20 0 HIADHN O=C1NC2(CCCCC2)C(=O)N1Cc1ccccc1CN[C@@H]1CCc2cc(F)ccc21 ZINC000482951105 898578780 /nfs/dbraw/zinc/57/87/80/898578780.db2.gz PSYVKNGBSSTZQO-JOCHJYFZSA-N 0 3 421.516 4.358 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(S(=O)(=O)C2CCCC2)cc1)c1ccc(NC(N)=O)cc1 ZINC000482969022 898602340 /nfs/dbraw/zinc/60/23/40/898602340.db2.gz ZWKVILBGYCESGC-HOTGVXAUSA-N 0 3 415.559 4.305 20 0 HIADHN Cc1nn(C)c(C)c1NC(=O)CN[C@@](C)(CC(C)C)c1cccc(Br)c1 ZINC000483045531 898716017 /nfs/dbraw/zinc/71/60/17/898716017.db2.gz IXIJJOCEIPLAKC-FQEVSTJZSA-N 0 3 421.383 4.289 20 0 HIADHN C[C@H]1CN(C(=O)Nc2ccccc2SC2CCCC2)CC[C@@H]1N1CCN(C)CC1 ZINC000483056626 898729986 /nfs/dbraw/zinc/72/99/86/898729986.db2.gz HCHHJVBAFHEYDY-RXVVDRJESA-N 0 3 416.635 4.211 20 0 HIADHN COc1cc([C@H](C)N[C@H](Cc2ccccc2)[C@@H](O)C(F)F)ccc1OC(F)F ZINC000483137711 898817247 /nfs/dbraw/zinc/81/72/47/898817247.db2.gz VGTOXMRRRPEXCF-WBHUJUFNSA-N 0 3 401.400 4.185 20 0 HIADHN CC[C@@H](CN(CC)C(=O)NCc1ccccc1CN1CCC(O)CC1)c1ccccc1 ZINC000483139512 898819252 /nfs/dbraw/zinc/81/92/52/898819252.db2.gz BOFBTQHNHOXHRS-NRFANRHFSA-N 0 3 423.601 4.369 20 0 HIADHN C[C@H](NCC(C)(C)S(=O)(=O)c1ccc(Br)cc1)c1cccs1 ZINC000483151961 898827037 /nfs/dbraw/zinc/82/70/37/898827037.db2.gz AZJWBEYGWVVBAL-LBPRGKRZSA-N 0 3 402.379 4.414 20 0 HIADHN C[C@H](NC[C@H](c1c(F)cccc1F)N(C)C)c1ccc(-n2cncn2)cc1Cl ZINC000483156696 898829005 /nfs/dbraw/zinc/82/90/05/898829005.db2.gz NSXOGINNWSAAQR-ORAYPTAESA-N 0 3 405.880 4.152 20 0 HIADHN Cc1ccc(CN(CCO)CCCC(=O)Nc2c(C)cc(Br)cc2C)o1 ZINC000483173573 898840193 /nfs/dbraw/zinc/84/01/93/898840193.db2.gz HPGXPVYOCRESSV-UHFFFAOYSA-N 0 3 423.351 4.181 20 0 HIADHN OC[C@H](NCCOc1ccccc1)c1ccc(Br)cc1C(F)(F)F ZINC000483263318 898904025 /nfs/dbraw/zinc/90/40/25/898904025.db2.gz XQHOVTHGJCQJAS-INIZCTEOSA-N 0 3 404.226 4.170 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)NCc1cc(F)cc(Br)c1)c1ccco1 ZINC000483282670 898918712 /nfs/dbraw/zinc/91/87/12/898918712.db2.gz KEQFWTSBPXQQOG-WBMJQRKESA-N 0 3 412.303 4.110 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)NCc1cc(F)cc(Br)c1)c1ccco1 ZINC000483282667 898919077 /nfs/dbraw/zinc/91/90/77/898919077.db2.gz KEQFWTSBPXQQOG-BLLLJJGKSA-N 0 3 412.303 4.110 20 0 HIADHN O=C(Nc1ccc(-c2noc(C(F)(F)F)n2)cc1)N1CCN(C2CCCCC2)CC1 ZINC000483334607 898963608 /nfs/dbraw/zinc/96/36/08/898963608.db2.gz ZOLIVSSHUXENGF-UHFFFAOYSA-N 0 3 423.439 4.238 20 0 HIADHN CCCN1CCN(c2ccccc2CN[C@@H](C)c2nc(-c3cccc(F)c3)no2)CC1 ZINC000483361781 898998642 /nfs/dbraw/zinc/99/86/42/898998642.db2.gz VLRPUQHVLWBNRY-SFHVURJKSA-N 0 3 423.536 4.259 20 0 HIADHN CN(C(=O)N[C@H](Cc1cccc(Br)c1)CC1CC1)[C@H]1CCN(C2CC2)C1 ZINC000483373363 899009257 /nfs/dbraw/zinc/00/92/57/899009257.db2.gz VVMQZCLKUPNHBW-ICSRJNTNSA-N 0 3 420.395 4.038 20 0 HIADHN CS[C@@H]1CN(C(=O)c2cc3cc(Br)cc(C)c3o2)C[C@H]1N1CCCC1 ZINC000483379622 899015180 /nfs/dbraw/zinc/01/51/80/899015180.db2.gz GERCDNHSDVDGLB-NVXWUHKLSA-N 0 3 423.376 4.156 20 0 HIADHN CS[C@H]1CN(C(=O)c2occc2CSc2ccccc2)C[C@@H]1N1CCCC1 ZINC000483392947 899027171 /nfs/dbraw/zinc/02/71/71/899027171.db2.gz IVZWJKGEOLWAJF-OALUTQOASA-N 0 3 402.585 4.224 20 0 HIADHN CS[C@@H]1CN(C(=O)c2sc(C3CC3)nc2-c2ccccc2)C[C@H]1N1CCCC1 ZINC000483399538 899032158 /nfs/dbraw/zinc/03/21/58/899032158.db2.gz CHYZMWGJVHYLBT-QZTJIDSGSA-N 0 3 413.612 4.339 20 0 HIADHN CS[C@H]1CN(C(=O)c2sc(-c3cccc(Cl)c3)nc2C)C[C@@H]1N1CCCC1 ZINC000483398276 899032192 /nfs/dbraw/zinc/03/21/92/899032192.db2.gz XJHWELYZNLHERU-IRXDYDNUSA-N 0 3 422.019 4.424 20 0 HIADHN Cc1noc(C)c1COc1ccc(CC(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)cc1 ZINC000505604338 914308371 /nfs/dbraw/zinc/30/83/71/914308371.db2.gz ORUZFYPDXYHENI-IQGLISFBSA-N 0 3 421.541 4.221 20 0 HIADHN CCc1n[nH]c(C2CCN(Cc3cc(Cl)ccc3OCc3cccnc3)CC2)n1 ZINC000483437151 899069338 /nfs/dbraw/zinc/06/93/38/899069338.db2.gz HCLYFDMKGRCLSJ-UHFFFAOYSA-N 0 3 411.937 4.374 20 0 HIADHN CCc1nc(C2CCN(Cc3cc(Cl)ccc3OCc3cccnc3)CC2)n[nH]1 ZINC000483437151 899069352 /nfs/dbraw/zinc/06/93/52/899069352.db2.gz HCLYFDMKGRCLSJ-UHFFFAOYSA-N 0 3 411.937 4.374 20 0 HIADHN CCc1nnc(C2CCN(Cc3cc(Cl)ccc3OCc3cccnc3)CC2)[nH]1 ZINC000483437151 899069363 /nfs/dbraw/zinc/06/93/63/899069363.db2.gz HCLYFDMKGRCLSJ-UHFFFAOYSA-N 0 3 411.937 4.374 20 0 HIADHN CO[C@H](c1ccccc1Cl)[C@H](C)NC(=O)N(CCN(C)C)Cc1ccc(C)o1 ZINC000483436169 899069479 /nfs/dbraw/zinc/06/94/79/899069479.db2.gz ZCQZOCWTOMNHGP-JXFKEZNVSA-N 0 3 407.942 4.091 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)Nc1cc(F)c(OC(F)F)cc1F)c1ccco1 ZINC000483448932 899085690 /nfs/dbraw/zinc/08/56/90/899085690.db2.gz RZKRIYICUKWGLN-QMTHXVAHSA-N 0 3 403.376 4.410 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1ccn(C)c1C1CCC1 ZINC000483473932 899118426 /nfs/dbraw/zinc/11/84/26/899118426.db2.gz WLOPVPCAZVAPAA-OAQYLSRUSA-N 0 3 417.557 4.497 20 0 HIADHN Cc1ccc(OCc2nc(CC(=O)N[C@H](C)[C@@H](c3ccccc3)N(C)C)cs2)cc1 ZINC000505613634 914318228 /nfs/dbraw/zinc/31/82/28/914318228.db2.gz ZTBDHVPOWIYDMY-KOSHJBKYSA-N 0 3 423.582 4.381 20 0 HIADHN COc1ccc2cc(CN(C)C(=O)[C@@H](C)N3CCN(C4CCCCC4)CC3)ccc2c1 ZINC000483491686 899146527 /nfs/dbraw/zinc/14/65/27/899146527.db2.gz PGDXIVFLIZFJLJ-HXUWFJFHSA-N 0 3 423.601 4.146 20 0 HIADHN O=C(CN1CCN(C2CCCCC2)CC1)N[C@H](c1ccc(F)cc1)C1CCCC1 ZINC000483493997 899150192 /nfs/dbraw/zinc/15/01/92/899150192.db2.gz SWXVRANGYFJHKB-DEOSSOPVSA-N 0 3 401.570 4.124 20 0 HIADHN Cc1cc(-n2ccnc2)ccc1CN1CCCN(C(=O)c2cccc(Cl)c2)CC1 ZINC000483544928 899205579 /nfs/dbraw/zinc/20/55/79/899205579.db2.gz PFRIBLOVMJLIPP-UHFFFAOYSA-N 0 3 408.933 4.182 20 0 HIADHN CCCN(CCC)C(=O)c1cccc(C(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)c1 ZINC000505634002 914333700 /nfs/dbraw/zinc/33/37/00/914333700.db2.gz QGMXMXMTGQXMOW-AUSIDOKSSA-N 0 3 409.574 4.370 20 0 HIADHN Cc1ccc(-c2noc([C@H](C)NC3CCN(CCC(F)(F)F)CC3)n2)cc1F ZINC000483653340 899310875 /nfs/dbraw/zinc/31/08/75/899310875.db2.gz AEOPYBSLWXWQEQ-ZDUSSCGKSA-N 0 3 400.420 4.252 20 0 HIADHN COCCC1(CNC(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)CCCCC1 ZINC000483690803 899349086 /nfs/dbraw/zinc/34/90/86/899349086.db2.gz YTDKLNVTTOUNPP-UHFFFAOYSA-N 0 3 411.537 4.025 20 0 HIADHN COc1ccccc1[C@@H](CC(C)C)N[C@@H](C)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000483709465 899364598 /nfs/dbraw/zinc/36/45/98/899364598.db2.gz JTAWLJLDKDLMOZ-LAUBAEHRSA-N 0 3 404.576 4.384 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCc1cc(-c2ccccc2)no1)c1cccc(OC)c1 ZINC000505651701 914349726 /nfs/dbraw/zinc/34/97/26/914349726.db2.gz LPLCFFQWBCBPDW-QHCPKHFHSA-N 0 3 422.529 4.233 20 0 HIADHN Cc1cc(NC(=O)C(C)(C)C2CCOCC2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000483874462 899552959 /nfs/dbraw/zinc/55/29/59/899552959.db2.gz VKGDITRVPMJODF-OAQYLSRUSA-N 0 3 410.562 4.030 20 0 HIADHN CN(C)C[C@@H](NC(=O)N[C@@H](c1cc(F)ccc1F)C(F)F)c1ccc(F)cc1 ZINC000483881537 899557544 /nfs/dbraw/zinc/55/75/44/899557544.db2.gz FHOSHNUHPJCDQT-SJORKVTESA-N 0 3 401.379 4.012 20 0 HIADHN Cc1ccc(NC(=O)C[C@H]2Sc3ccc(Cl)cc3NC2=O)c(CN(C)C)c1 ZINC000505663282 914360731 /nfs/dbraw/zinc/36/07/31/914360731.db2.gz YJGJFIDDQAISTE-GOSISDBHSA-N 0 3 403.935 4.152 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)NCC1(c2cccs2)CCCCC1 ZINC000483951308 899603220 /nfs/dbraw/zinc/60/32/20/899603220.db2.gz FSBYGDBWLHPFIN-UHFFFAOYSA-N 0 3 413.587 4.075 20 0 HIADHN COC(=O)[C@H](c1ccc(Cl)c(Cl)c1)N(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1 ZINC000483993564 899633993 /nfs/dbraw/zinc/63/39/93/899633993.db2.gz LFEVSDPUVUXAFS-VDGAXYAQSA-N 0 3 422.356 4.227 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)NC[C@H]1CCCC[C@@H]1C(F)(F)F ZINC000484042588 899673755 /nfs/dbraw/zinc/67/37/55/899673755.db2.gz KSDKNQVSMYSSIB-WBVHZDCISA-N 0 3 403.464 4.268 20 0 HIADHN COc1ccc(F)cc1CC(=O)N(c1cccc(SC)c1)C1CCN(C)CC1 ZINC000484042053 899674311 /nfs/dbraw/zinc/67/43/11/899674311.db2.gz JZSUUOQTMYKOPO-UHFFFAOYSA-N 0 3 402.535 4.226 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)NC[C@H]1CCCC[C@H]1C(F)(F)F ZINC000484051419 899683553 /nfs/dbraw/zinc/68/35/53/899683553.db2.gz VLKBTWXWWTZTNS-SJLPKXTDSA-N 0 3 403.464 4.268 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)Nc2nnc(/C=C/c3ccco3)s2)C1 ZINC000484092346 899722182 /nfs/dbraw/zinc/72/21/82/899722182.db2.gz BABAPADBGHWOBJ-AMMZPXFLSA-N 0 3 409.515 4.259 20 0 HIADHN O=C(Nc1nnc(/C=C/c2ccco2)s1)N[C@H](CN1CCCC1)c1ccccc1 ZINC000484160651 899780717 /nfs/dbraw/zinc/78/07/17/899780717.db2.gz HIBUZEFABRFXGK-DOJUMQAQSA-N 0 3 409.515 4.260 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N[C@@H](C)c1ccc(SC(C)C)cc1 ZINC000484183793 899800336 /nfs/dbraw/zinc/80/03/36/899800336.db2.gz AGONAXVJJFLNRI-KRWDZBQOSA-N 0 3 413.587 4.373 20 0 HIADHN O=C(c1ccnc2ccncc21)N1CCN(Cc2ccccc2)C2(CCCCC2)C1 ZINC000484192360 899805992 /nfs/dbraw/zinc/80/59/92/899805992.db2.gz REUSJZGVSJMKCM-UHFFFAOYSA-N 0 3 400.526 4.291 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)NCC1CCC(c2ccccc2)CC1 ZINC000484195738 899808057 /nfs/dbraw/zinc/80/80/57/899808057.db2.gz WFAPQQKVLLLMAV-UHFFFAOYSA-N 0 3 407.558 4.085 20 0 HIADHN CSc1cccc(N(C(=O)Cc2ccc(-n3cccn3)cc2)C2CCN(C)CC2)c1 ZINC000484282953 899850881 /nfs/dbraw/zinc/85/08/81/899850881.db2.gz LZHWORDSFZRQFH-UHFFFAOYSA-N 0 3 420.582 4.264 20 0 HIADHN CSc1cccc(N(C(=O)c2cccc(NC(=O)C3CC3)c2)C2CCN(C)CC2)c1 ZINC000484285900 899851811 /nfs/dbraw/zinc/85/18/11/899851811.db2.gz RWZCPVNLXQENMV-UHFFFAOYSA-N 0 3 423.582 4.498 20 0 HIADHN COc1cc(OC)cc(C(=O)N(c2cccc(SC)c2)C2CCN(C)CC2)c1 ZINC000484290418 899855491 /nfs/dbraw/zinc/85/54/91/899855491.db2.gz CUFQFSWMLIKRCU-UHFFFAOYSA-N 0 3 400.544 4.167 20 0 HIADHN COc1cc2[nH]c(CCCN[C@H](C)c3nnn(-c4ccccc4)c3C)cc2c(OC)c1 ZINC000484292965 899856625 /nfs/dbraw/zinc/85/66/25/899856625.db2.gz JMFZATJMPJQAEI-MRXNPFEDSA-N 0 3 419.529 4.358 20 0 HIADHN CSc1cccc(N(C(=O)c2ccc(-n3cccn3)cc2)C2CCN(C)CC2)c1 ZINC000484304750 899865139 /nfs/dbraw/zinc/86/51/39/899865139.db2.gz AZGXFDWCOGSKBY-UHFFFAOYSA-N 0 3 406.555 4.335 20 0 HIADHN COc1ccc(OC)c(CC(=O)N(c2cccc(SC)c2)C2CCN(C)CC2)c1 ZINC000484314933 899873722 /nfs/dbraw/zinc/87/37/22/899873722.db2.gz PRESCNJRACDMMG-UHFFFAOYSA-N 0 3 414.571 4.096 20 0 HIADHN CSc1cccc(N(C(=O)CSCc2cccnc2)C2CCN(C)CC2)c1 ZINC000484400865 899925947 /nfs/dbraw/zinc/92/59/47/899925947.db2.gz BGARTJDCTVMTGA-UHFFFAOYSA-N 0 3 401.601 4.164 20 0 HIADHN CSc1cccc(N(C(=O)C[C@@H](C)n2nc(C)cc2C)C2CCN(C)CC2)c1 ZINC000484407232 899930838 /nfs/dbraw/zinc/93/08/38/899930838.db2.gz RRZIOSZZOBGFAH-GOSISDBHSA-N 0 3 400.592 4.300 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(S(=O)(=O)N(C)C)cc1)c1ccc(-c2cccnc2)cc1 ZINC000484473157 899966633 /nfs/dbraw/zinc/96/66/33/899966633.db2.gz MCEGFIPDUUHFOM-QZTJIDSGSA-N 0 3 409.555 4.411 20 0 HIADHN CCCc1ccccc1NC(=O)C(=O)Nc1cc(C)cc(N2CCN(C(C)C)CC2)c1 ZINC000484478930 899972217 /nfs/dbraw/zinc/97/22/17/899972217.db2.gz VRXYWYLMUZFQOR-UHFFFAOYSA-N 0 3 422.573 4.055 20 0 HIADHN COc1cc(OC)cc(N2CC[C@@H](N[C@@H](C)c3ccc(F)cc3OC(F)F)C2)c1 ZINC000484491098 899982735 /nfs/dbraw/zinc/98/27/35/899982735.db2.gz JAFHVFFKSPTRBE-DZGCQCFKSA-N 0 3 410.436 4.374 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2cn(CC(C)C)nc2C(F)F)c1 ZINC000484492222 899984518 /nfs/dbraw/zinc/98/45/18/899984518.db2.gz MIYZEDUUVBEHAE-UHFFFAOYSA-N 0 3 423.508 4.081 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2cc(F)ccc2Br)c1 ZINC000484505964 899996493 /nfs/dbraw/zinc/99/64/93/899996493.db2.gz KJNGPADGLAVOGU-UHFFFAOYSA-N 0 3 424.314 4.193 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2sc(C)nc2CC(C)C)c1 ZINC000484520741 900009427 /nfs/dbraw/zinc/00/94/27/900009427.db2.gz UNTZQUDKGPYCOZ-UHFFFAOYSA-N 0 3 404.580 4.254 20 0 HIADHN CC(C)([C@H](NCC[S@](=O)c1ccccc1)c1ccc(F)c(F)c1)N1CCCC1 ZINC000484528846 900015441 /nfs/dbraw/zinc/01/54/41/900015441.db2.gz CQUQVJLDHLDWDY-PIKZIKFNSA-N 0 3 406.542 4.278 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2cnn(-c3ccc(C)cc3C)c2)c1 ZINC000484670275 900111516 /nfs/dbraw/zinc/11/15/16/900111516.db2.gz IPFDBPLWASCCFF-UHFFFAOYSA-N 0 3 421.545 4.093 20 0 HIADHN CCc1nnc(C2CCN([C@H](C)C(=O)Nc3ccc(Oc4ccccc4)cc3)CC2)[nH]1 ZINC000484701538 900137085 /nfs/dbraw/zinc/13/70/85/900137085.db2.gz USQOBUGTKZRRKL-QGZVFWFLSA-N 0 3 419.529 4.366 20 0 HIADHN CCc1nnc(C2CCN(Cc3ncc(-c4cccc(Br)c4)o3)CC2)[nH]1 ZINC000484736415 900162580 /nfs/dbraw/zinc/16/25/80/900162580.db2.gz IEOLGTBFFBURRH-UHFFFAOYSA-N 0 3 416.323 4.164 20 0 HIADHN CCc1nc(C2CCN([C@@H](C)C(=O)N[C@H](C)c3ccc(Cl)cc3Cl)CC2)n[nH]1 ZINC000484740628 900163978 /nfs/dbraw/zinc/16/39/78/900163978.db2.gz NUYKFAZIIJQUMP-OLZOCXBDSA-N 0 3 424.376 4.119 20 0 HIADHN CCc1n[nH]c(C2CCN([C@@H](C)C(=O)N[C@H](C)c3ccc(Cl)cc3Cl)CC2)n1 ZINC000484740628 900163985 /nfs/dbraw/zinc/16/39/85/900163985.db2.gz NUYKFAZIIJQUMP-OLZOCXBDSA-N 0 3 424.376 4.119 20 0 HIADHN CCc1nnc(C2CCN([C@@H](C)C(=O)N[C@H](C)c3ccc(Cl)cc3Cl)CC2)[nH]1 ZINC000484740628 900163990 /nfs/dbraw/zinc/16/39/90/900163990.db2.gz NUYKFAZIIJQUMP-OLZOCXBDSA-N 0 3 424.376 4.119 20 0 HIADHN CC(C)(C)OC(=O)[C@](C)(O)CNCc1cn(C(C)(C)C)nc1-c1ccccc1Cl ZINC000484754643 900172023 /nfs/dbraw/zinc/17/20/23/900172023.db2.gz SIPNCVSZWNJNHF-JOCHJYFZSA-N 0 3 421.969 4.141 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)NCc2ccccc2OC2CCCC2)cc1 ZINC000484763468 900177437 /nfs/dbraw/zinc/17/74/37/900177437.db2.gz OFAZGIZXJFSQKM-QFIPXVFZSA-N 0 3 411.546 4.119 20 0 HIADHN C[C@H](NCC(=O)NC(=O)NC1CC1)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 ZINC000484796511 900201651 /nfs/dbraw/zinc/20/16/51/900201651.db2.gz LACZHFRQDUWZQF-NSHDSACASA-N 0 3 411.449 4.073 20 0 HIADHN CCc1c(NC(=O)N[C@@H]2CCCN(C)[C@@H]2C)cnn1-c1ccc(C(F)(F)F)cc1 ZINC000484817458 900219951 /nfs/dbraw/zinc/21/99/51/900219951.db2.gz BCBSVTFBOUVDHR-CZUORRHYSA-N 0 3 409.456 4.058 20 0 HIADHN CC(=O)Nc1ccc(S(=O)(=O)CCCN[C@@H](C)c2oc3ccccc3c2C)cc1 ZINC000484999520 900351509 /nfs/dbraw/zinc/35/15/09/900351509.db2.gz YMAVXIHGPNCJLA-INIZCTEOSA-N 0 3 414.527 4.214 20 0 HIADHN Cc1nn(C)c2cc(NC(=O)[C@@]3(C(F)(F)F)CCN(Cc4ccccc4)C3)ccc12 ZINC000485023506 900368220 /nfs/dbraw/zinc/36/82/20/900368220.db2.gz RROGFLRRMAXJTL-OAQYLSRUSA-N 0 3 416.447 4.275 20 0 HIADHN CCOc1ccccc1NC(=O)CCN(Cc1cccc(F)c1)C[C@H]1CCCO1 ZINC000485038029 900376217 /nfs/dbraw/zinc/37/62/17/900376217.db2.gz XNTGDVFESBTRMF-HXUWFJFHSA-N 0 3 400.494 4.234 20 0 HIADHN CCOc1ccccc1NC(=O)CCN(Cc1cccc(F)c1)C[C@@H]1CCCO1 ZINC000485038027 900376390 /nfs/dbraw/zinc/37/63/90/900376390.db2.gz XNTGDVFESBTRMF-FQEVSTJZSA-N 0 3 400.494 4.234 20 0 HIADHN C[C@H]1CC(C)(C)C[C@](CO)(NCC(=O)Nc2c(Cl)cccc2C(F)(F)F)C1 ZINC000485056672 900385872 /nfs/dbraw/zinc/38/58/72/900385872.db2.gz CMKXRYZKHFSMGN-KPZWWZAWSA-N 0 3 406.876 4.464 20 0 HIADHN COc1ccc(-c2nc(CN[C@]3(CO)C[C@@H](C)CC(C)(C)C3)cs2)c(OC)c1 ZINC000485066075 900390946 /nfs/dbraw/zinc/39/09/46/900390946.db2.gz FSXBEFLSXZZYSV-OYHNWAKOSA-N 0 3 404.576 4.494 20 0 HIADHN COc1ccccc1-c1csc(C2CCN(C[C@@H](O)COc3ccccc3)CC2)n1 ZINC000485130388 900433123 /nfs/dbraw/zinc/43/31/23/900433123.db2.gz SQDWMZFJCAJYIZ-LJQANCHMSA-N 0 3 424.566 4.438 20 0 HIADHN CC(C)c1c(NC(=O)N2CC[C@@H]3CCN(C)C[C@@H]32)cnn1-c1ccccc1Cl ZINC000485144106 900444568 /nfs/dbraw/zinc/44/45/68/900444568.db2.gz IWLHCQFMPIXONJ-KXBFYZLASA-N 0 3 401.942 4.207 20 0 HIADHN CCCOCc1ccccc1CNC(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000505778269 914444997 /nfs/dbraw/zinc/44/49/97/914444997.db2.gz LJQPTQRGHFQCDN-FQEVSTJZSA-N 0 3 401.576 4.311 20 0 HIADHN Cc1c([C@H](C)NC(=O)N2CCN(C3CCCCC3)CC2)cnn1-c1ccc(F)cc1 ZINC000485186290 900480877 /nfs/dbraw/zinc/48/08/77/900480877.db2.gz FWWFVAUBLBZFHK-KRWDZBQOSA-N 0 3 413.541 4.041 20 0 HIADHN O=C(Nc1cccc(Cl)c1Br)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000485247845 900532895 /nfs/dbraw/zinc/53/28/95/900532895.db2.gz SMVORQLWUPGBOM-AWEZNQCLSA-N 0 3 408.727 4.499 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)Nc2cccc(Cl)c2Br)CC1 ZINC000485254562 900539801 /nfs/dbraw/zinc/53/98/01/900539801.db2.gz PBTSVMYSZOIDNG-UHFFFAOYSA-N 0 3 418.763 4.113 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)N[C@H](c1ccc(F)cc1)C(F)(F)F ZINC000485264024 900547482 /nfs/dbraw/zinc/54/74/82/900547482.db2.gz GWLWGHMXKGABRX-GOSISDBHSA-N 0 3 415.406 4.342 20 0 HIADHN C[C@@H](c1ccc([S@@](C)=O)cc1)N(C)CCC(=O)Nc1ccccc1C(F)(F)F ZINC000485413498 900712493 /nfs/dbraw/zinc/71/24/93/900712493.db2.gz YQFMXTGDKZJFTO-HJFSHJIFSA-N 0 3 412.477 4.464 20 0 HIADHN CCC1(C(=O)Nc2cccc(N3CCN(CCc4ccccc4)CC3)c2)CCOCC1 ZINC000485482044 900773460 /nfs/dbraw/zinc/77/34/60/900773460.db2.gz PVKTXNBCXKQUTC-UHFFFAOYSA-N 0 3 421.585 4.197 20 0 HIADHN Cc1cc(Br)ccc1CC(=O)NC1CCN([C@H](C)c2ccncc2)CC1 ZINC000485569075 900838023 /nfs/dbraw/zinc/83/80/23/900838023.db2.gz MDGZMYWTWLDLGW-MRXNPFEDSA-N 0 3 416.363 4.037 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCN1CCC(=O)Nc1ccccc1C(F)(F)F ZINC000485694784 900945915 /nfs/dbraw/zinc/94/59/15/900945915.db2.gz LMFONHROURVGDK-KRWDZBQOSA-N 0 3 405.464 4.240 20 0 HIADHN COCCO[C@@H]1COCC[C@@H]1NCc1ccc(-c2ccc(Cl)c(Cl)c2)o1 ZINC000485724188 900973613 /nfs/dbraw/zinc/97/36/13/900973613.db2.gz KSNBZBDFHMRYPJ-PKOBYXMFSA-N 0 3 400.302 4.164 20 0 HIADHN CC[C@H](NC[C@H](O)COc1ccc(C(C)=O)cc1)c1cc(F)cc(Br)c1 ZINC000485830126 901076024 /nfs/dbraw/zinc/07/60/24/901076024.db2.gz DISZIYLACUQJER-ICSRJNTNSA-N 0 3 424.310 4.271 20 0 HIADHN C[C@@H]1CCCCCN1CC(=O)N(Cc1nnc(-c2ccccc2Cl)o1)C1CC1 ZINC000485885682 901121190 /nfs/dbraw/zinc/12/11/90/901121190.db2.gz VXALPUJYUCAPKE-OAHLLOKOSA-N 0 3 402.926 4.146 20 0 HIADHN CC(=O)c1ccc(C(=O)N(C[C@@H]2CCN(Cc3ccccc3)C2)CC(F)(F)F)o1 ZINC000485901504 901131803 /nfs/dbraw/zinc/13/18/03/901131803.db2.gz SGHLFYOHKDRCES-QGZVFWFLSA-N 0 3 408.420 4.009 20 0 HIADHN Cc1ccc(NC(=O)c2ccc(N(C)C[C@@H]3CCN(C)[C@H]3c3cccnc3)nc2)cc1 ZINC000486010449 901221702 /nfs/dbraw/zinc/22/17/02/901221702.db2.gz SNEWMCWQKJJHNY-URXFXBBRSA-N 0 3 415.541 4.167 20 0 HIADHN CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)c1cnc2cc(Cl)c(Cl)cc2n1 ZINC000486023054 901230117 /nfs/dbraw/zinc/23/01/17/901230117.db2.gz LUCRSRRXWBXIQZ-XOBRGWDASA-N 0 3 402.329 4.461 20 0 HIADHN COc1ccc(Cl)cc1S(=O)(=O)N(C)[C@@H]1CCN(Cc2ccccc2)[C@@H](C)C1 ZINC000486250953 901434189 /nfs/dbraw/zinc/43/41/89/901434189.db2.gz GZUPVJOISWMOBD-QFBILLFUSA-N 0 3 422.978 4.022 20 0 HIADHN Cc1nc2c(s1)CCC[C@H]2C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000486302670 901482643 /nfs/dbraw/zinc/48/26/43/901482643.db2.gz FJLOQFJSQRKCKL-RBUKOAKNSA-N 0 3 421.570 4.154 20 0 HIADHN Fc1cccc(N2CCCC2)c1CN1C[C@H]2CCC[C@@]2(c2nc(CC3CC3)no2)C1 ZINC000486442140 901600354 /nfs/dbraw/zinc/60/03/54/901600354.db2.gz BXKGQNDUURDZHD-HOYKHHGWSA-N 0 3 410.537 4.315 20 0 HIADHN COc1cc(CN2C[C@H]3CCC[C@@]3(c3nc(CC4CC4)no3)C2)ccc1OC(C)C ZINC000486442175 901600487 /nfs/dbraw/zinc/60/04/87/901600487.db2.gz CCQTXKQGWQDTJL-NTKDMRAZSA-N 0 3 411.546 4.372 20 0 HIADHN O=C([C@@H]1CCCCCC(=O)C1)N(C[C@@H]1CCN(Cc2ccccc2)C1)CC(F)(F)F ZINC000486549231 901696934 /nfs/dbraw/zinc/69/69/34/901696934.db2.gz SIBZHNAOILIGKM-WOJBJXKFSA-N 0 3 424.507 4.439 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)C/C=C\c3cccc(F)c3)CC2)c1 ZINC000486816025 901871324 /nfs/dbraw/zinc/87/13/24/901871324.db2.gz BCQXCGKDSKBWDV-TWGQIWQCSA-N 0 3 409.549 4.256 20 0 HIADHN CO[C@H](c1ccc(Br)cc1)[C@@H](C)NC(=O)c1ccccc1CN(C)C ZINC000486847153 901892637 /nfs/dbraw/zinc/89/26/37/901892637.db2.gz PXOBVYCPNHQHLO-KUHUBIRLSA-N 0 3 405.336 4.017 20 0 HIADHN Clc1ccccc1OCCN1C[C@H]2CCC[C@@]2(c2nc(-c3cccnc3)no2)C1 ZINC000486846481 901893059 /nfs/dbraw/zinc/89/30/59/901893059.db2.gz ONIULWAVFMHTHA-VGOFRKELSA-N 0 3 410.905 4.218 20 0 HIADHN CC(=O)c1ccccc1OCCN1C[C@H]2CCC[C@@]2(c2nc(-c3ccccc3)no2)C1 ZINC000486855882 901900997 /nfs/dbraw/zinc/90/09/97/901900997.db2.gz MVXAPMVTDXHWJV-CJFMBICVSA-N 0 3 417.509 4.372 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N2C[C@H](c3ccccc3)[C@@H]3CCCC[C@H]32)CC1 ZINC000486878529 901923969 /nfs/dbraw/zinc/92/39/69/901923969.db2.gz ITAMWDRBKYPUDD-RBZQAINGSA-N 0 3 413.606 4.244 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)Nc3nc(-c4cccc(C(F)(F)F)c4)cs3)[C@H]2C1 ZINC000486881429 901927582 /nfs/dbraw/zinc/92/75/82/901927582.db2.gz APNLAMHDXVBHQZ-LRDDRELGSA-N 0 3 410.465 4.387 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)Nc1nnc(/C=C/c2ccco2)s1 ZINC000486943684 901980412 /nfs/dbraw/zinc/98/04/12/901980412.db2.gz NGGYKCMUVWFXOT-DVQDXYAYSA-N 0 3 409.515 4.088 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)CCOc2ccc3ccccc3c2)CC1 ZINC000486979846 902002754 /nfs/dbraw/zinc/00/27/54/902002754.db2.gz KEZHAQTVOPJKIL-LJQANCHMSA-N 0 3 403.526 4.346 20 0 HIADHN Brc1cccc(N2CC[C@@H](NCc3cnc([C@@H]4CCCO4)s3)C2)c1 ZINC000487176573 902086812 /nfs/dbraw/zinc/08/68/12/902086812.db2.gz YLBILLDAGBFWEO-PBHICJAKSA-N 0 3 408.365 4.126 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2c(F)cc(F)cc2Br)[C@@H]1c1ccccc1 ZINC000487193586 902096376 /nfs/dbraw/zinc/09/63/76/902096376.db2.gz HEEVNRBIBWUMBH-WBVHZDCISA-N 0 3 410.262 4.294 20 0 HIADHN CCOc1ccc(CNCCC(=O)Nc2cc(Br)ccc2C)cc1F ZINC000487313094 902148091 /nfs/dbraw/zinc/14/80/91/902148091.db2.gz AFNPKULUKCWFCD-UHFFFAOYSA-N 0 3 409.299 4.414 20 0 HIADHN CCCN(CC(=O)Nc1cc(C)ccc1-c1n[nH]c(C)n1)[C@H]1CCc2ccccc2C1 ZINC000487377315 902168806 /nfs/dbraw/zinc/16/88/06/902168806.db2.gz IMXDDJNJYVBEIH-NRFANRHFSA-N 0 3 417.557 4.297 20 0 HIADHN CCN(CC)CC(=O)N[C@H](c1ccccc1)c1ccc(OC)c(Br)c1 ZINC000487479505 902221951 /nfs/dbraw/zinc/22/19/51/902221951.db2.gz XSKLNFFWFRYRBZ-HXUWFJFHSA-N 0 3 405.336 4.005 20 0 HIADHN CN(C(=O)N[C@@H]1CCC[C@@H](c2ccccc2)C1)C1CCN(CCc2ccccn2)CC1 ZINC000487731833 902326261 /nfs/dbraw/zinc/32/62/61/902326261.db2.gz AUOSWDFYFVVLKG-ISKFKSNPSA-N 0 3 420.601 4.456 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCCC1)c1ccc(F)cc1C(F)(F)F ZINC000487790709 902368035 /nfs/dbraw/zinc/36/80/35/902368035.db2.gz XIRWYHXGYIVIOX-UHFFFAOYSA-N 0 3 404.473 4.326 20 0 HIADHN Cc1cccc(CN(C)C(=O)NCCCCN2CCN(c3ccccc3)CC2)c1C ZINC000487969612 902495700 /nfs/dbraw/zinc/49/57/00/902495700.db2.gz FXUNSCDSXHDURI-UHFFFAOYSA-N 0 3 408.590 4.047 20 0 HIADHN COCCN(CC(=O)Nc1ccc(NC(=O)c2cccs2)cc1)[C@@H]1CCC[C@H]1C ZINC000487985110 902507677 /nfs/dbraw/zinc/50/76/77/902507677.db2.gz CWJHLGXTLGLTJH-VQIMIIECSA-N 0 3 415.559 4.076 20 0 HIADHN COCCN(CC(=O)Nc1ccc(NC(=O)c2cccs2)cc1)[C@H]1CCC[C@@H]1C ZINC000487985108 902508486 /nfs/dbraw/zinc/50/84/86/902508486.db2.gz CWJHLGXTLGLTJH-LPHOPBHVSA-N 0 3 415.559 4.076 20 0 HIADHN Cc1cc(C)c2nc(C3CC3)cc(C(=O)N3CCN(C4CCOCC4)C[C@@H]3C)c2c1 ZINC000488313628 902760665 /nfs/dbraw/zinc/76/06/65/902760665.db2.gz ATYPZHLJTSFPQX-SFHVURJKSA-N 0 3 407.558 4.054 20 0 HIADHN Cc1c(COc2ccccc2)cccc1NC(=O)N1CCN(C2CCOCC2)C[C@@H]1C ZINC000488479571 902846846 /nfs/dbraw/zinc/84/68/46/902846846.db2.gz CTJOEMHGRKNKML-IBGZPJMESA-N 0 3 423.557 4.291 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N[C@@H](C)[C@@H]2OCCc3sccc32)N2CCCC2)cc1 ZINC000488508168 902861896 /nfs/dbraw/zinc/86/18/96/902861896.db2.gz ABYISEIHRNFCCV-XJABCFGWSA-N 0 3 413.587 4.195 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N[C@@H](C)[C@H]2OCCc3sccc32)N2CCCC2)cc1 ZINC000488508167 902862080 /nfs/dbraw/zinc/86/20/80/902862080.db2.gz ABYISEIHRNFCCV-RBDMOPTHSA-N 0 3 413.587 4.195 20 0 HIADHN CCOc1ccc(C(=O)CCC(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@H]2C)cc1 ZINC000488515016 902864915 /nfs/dbraw/zinc/86/49/15/902864915.db2.gz KRSJRYAZPANBNQ-AUSIDOKSSA-N 0 3 408.542 4.075 20 0 HIADHN CCOc1ccc(C(=O)CCC(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@@H]2C)cc1 ZINC000488515020 902865083 /nfs/dbraw/zinc/86/50/83/902865083.db2.gz KRSJRYAZPANBNQ-WMZHIEFXSA-N 0 3 408.542 4.075 20 0 HIADHN C[C@H]1CN(C2CCOCC2)CCN1C(=O)Nc1ccc(OC2CCCCC2)cc1 ZINC000488517946 902866375 /nfs/dbraw/zinc/86/63/75/902866375.db2.gz DGFIBTRLMXNNDW-SFHVURJKSA-N 0 3 401.551 4.115 20 0 HIADHN C[C@@H]1CN(C2CCOCC2)CCN1C(=O)Nc1cccc(-c2ccc3c(c2)CCO3)c1 ZINC000488562297 902885473 /nfs/dbraw/zinc/88/54/73/902885473.db2.gz HTMYLKVPJQIVMH-GOSISDBHSA-N 0 3 421.541 4.006 20 0 HIADHN C[C@H]1CN(C2CCOCC2)CCN1C(=O)Nc1ccc(-c2cccc(F)c2)c(F)c1 ZINC000488571221 902887587 /nfs/dbraw/zinc/88/75/87/902887587.db2.gz GGPRTISQJDNCDV-INIZCTEOSA-N 0 3 415.484 4.349 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)Nc3ccc(OC[C@@H]4CCCO4)cc3)cc2)CC1 ZINC000488634169 902910862 /nfs/dbraw/zinc/91/08/62/902910862.db2.gz ZFUOPLJYCYMMKM-DEOSSOPVSA-N 0 3 423.557 4.027 20 0 HIADHN Cc1c(C(=O)Nc2cccc(CN3CCC(O)CC3)c2)cnn1-c1cccc(Cl)c1 ZINC000488651569 902919988 /nfs/dbraw/zinc/91/99/88/902919988.db2.gz ACUIDQQXNYGNPW-UHFFFAOYSA-N 0 3 424.932 4.043 20 0 HIADHN Cc1cc(C(=O)Nc2cccc(CN3CCC(O)CC3)c2)cc(C)c1OC(F)F ZINC000488664430 902928924 /nfs/dbraw/zinc/92/89/24/902928924.db2.gz ISHRSPPDGICGFZ-UHFFFAOYSA-N 0 3 404.457 4.114 20 0 HIADHN Cc1ccc(NC(=O)C2CCN(c3ccc4cccc(O)c4n3)CC2)c(CN(C)C)c1 ZINC000505998927 914670541 /nfs/dbraw/zinc/67/05/41/914670541.db2.gz VNNRFVNKANWNOA-UHFFFAOYSA-N 0 3 418.541 4.166 20 0 HIADHN C[C@@H]1C[C@@H]1C(=O)Nc1cccc(C(=O)N(Cc2ccccc2)C2CCN(C)CC2)c1 ZINC000488672760 902932648 /nfs/dbraw/zinc/93/26/48/902932648.db2.gz FIDKOAITIYSABL-JPYJTQIMSA-N 0 3 405.542 4.018 20 0 HIADHN COc1cccc(C2(C(=O)Nc3cccc(CN4CCC(O)CC4)c3)CCCC2)c1 ZINC000488670973 902933707 /nfs/dbraw/zinc/93/37/07/902933707.db2.gz CAUUHXZOWOHBPS-UHFFFAOYSA-N 0 3 408.542 4.102 20 0 HIADHN C[C@@H](Cc1cccc(C(F)(F)F)c1)C(=O)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000488674787 902935462 /nfs/dbraw/zinc/93/54/62/902935462.db2.gz LKAJDTOWIIUOPK-INIZCTEOSA-N 0 3 420.475 4.479 20 0 HIADHN O=C(CCc1ncc(-c2ccccc2F)o1)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000488694729 902947814 /nfs/dbraw/zinc/94/78/14/902947814.db2.gz PZJOCCSCNOYDKL-UHFFFAOYSA-N 0 3 423.488 4.009 20 0 HIADHN Cc1cc(NC(=O)NCc2cscc2C)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000488931892 903082757 /nfs/dbraw/zinc/08/27/57/903082757.db2.gz AYGWJGQYJIHLJJ-FQEVSTJZSA-N 0 3 409.559 4.330 20 0 HIADHN COc1ccc(NC(=O)[C@@H](C)N[C@@H](COc2ccccc2F)C(C)(C)C)c(OC)c1 ZINC000489025197 903128842 /nfs/dbraw/zinc/12/88/42/903128842.db2.gz CLDWXXWBHGUTGY-VFNWGFHPSA-N 0 3 418.509 4.253 20 0 HIADHN CC(=O)Nc1cccc(NC(=O)[C@@H](C)N[C@@H](COc2ccccc2F)C(C)(C)C)c1 ZINC000489026539 903130033 /nfs/dbraw/zinc/13/00/33/903130033.db2.gz IWAVOAQGAQRXMO-VFNWGFHPSA-N 0 3 415.509 4.194 20 0 HIADHN C[C@@H](N[C@H](COc1ccccc1F)C(C)(C)C)C(=O)N1CCc2sccc2C1 ZINC000489034368 903141123 /nfs/dbraw/zinc/14/11/23/903141123.db2.gz KEHFDXKFKSGHDO-FOIQADDNSA-N 0 3 404.551 4.244 20 0 HIADHN Cc1cccc2c1[C@@H](C)C[C@H]2CC(=O)Nc1cccc(CN2CCC(C(N)=O)CC2)c1 ZINC000489069067 903172419 /nfs/dbraw/zinc/17/24/19/903172419.db2.gz GYVPGZCIBQHATC-RXVVDRJESA-N 0 3 419.569 4.312 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)NCc2cc(C)cc3c(C)c(C)[nH]c32)cc1 ZINC000489083799 903185955 /nfs/dbraw/zinc/18/59/55/903185955.db2.gz SUKHOFRSRZCILO-QFIPXVFZSA-N 0 3 408.546 4.204 20 0 HIADHN COc1ccc(OC)c(NC(=O)[C@@H](C)N[C@@H](COc2ccccc2F)C(C)(C)C)c1 ZINC000489143259 903228896 /nfs/dbraw/zinc/22/88/96/903228896.db2.gz XYSAJVCRBHFPHD-VFNWGFHPSA-N 0 3 418.509 4.253 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)NCc1ccc(Br)c(F)c1)c1ccco1 ZINC000489177247 903246322 /nfs/dbraw/zinc/24/63/22/903246322.db2.gz QNHFKHTYGZXYQA-MLGOLLRUSA-N 0 3 412.303 4.110 20 0 HIADHN Clc1ccc(-c2nc(CN3CCC(CCCN4CCOCC4)CC3)co2)cc1 ZINC000506023317 914702573 /nfs/dbraw/zinc/70/25/73/914702573.db2.gz WBQSNJIVZUWVPX-UHFFFAOYSA-N 0 3 403.954 4.319 20 0 HIADHN CC(C)C[C@H](NC(=O)NCc1ccccc1CN1CCC(O)CC1)c1cccs1 ZINC000489292412 903312915 /nfs/dbraw/zinc/31/29/15/903312915.db2.gz DHIFJFKYUWDJHQ-NRFANRHFSA-N 0 3 415.603 4.291 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)N2CCC(N(C)c3ccccc3)CC2)C1 ZINC000489292212 903313405 /nfs/dbraw/zinc/31/34/05/903313405.db2.gz MDBMAEKHRSJEHH-RBBKRZOGSA-N 0 3 406.574 4.132 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)NCCCn2ccc3ccccc32)CC1 ZINC000489323778 903330485 /nfs/dbraw/zinc/33/04/85/903330485.db2.gz HHNWCJKEJWBMQZ-UHFFFAOYSA-N 0 3 404.558 4.337 20 0 HIADHN CCN(CC1CCN(c2ccccn2)CC1)[C@H](C)c1nc(-c2ccc(OC)cc2)no1 ZINC000489331447 903334279 /nfs/dbraw/zinc/33/42/79/903334279.db2.gz PUGWQUJQGAWOAD-GOSISDBHSA-N 0 3 421.545 4.440 20 0 HIADHN C[C@@H](CCc1ccc2c(c1)OCO2)NC(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000489401841 903369843 /nfs/dbraw/zinc/36/98/43/903369843.db2.gz YLTRNNWDHBMYMI-IBGZPJMESA-N 0 3 423.557 4.042 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3ccc4c(c3)CCCC(=O)N4)c(C)c2)CC1 ZINC000489425080 903377269 /nfs/dbraw/zinc/37/72/69/903377269.db2.gz RLDRHVANBWSUDW-UHFFFAOYSA-N 0 3 421.545 4.056 20 0 HIADHN O=C(Nc1ccc(F)cc1)[C@H](N[C@@H]1CCO[C@@]2(CCSC2)C1)c1ccccc1 ZINC000489477967 903408387 /nfs/dbraw/zinc/40/83/87/903408387.db2.gz NEMQNBGLQQEAJZ-SJBKTWHCSA-N 0 3 400.519 4.150 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)NC1(c2ccccc2)CCCCC1 ZINC000489563390 903466374 /nfs/dbraw/zinc/46/63/74/903466374.db2.gz WPRPHVOKFNBLHO-UHFFFAOYSA-N 0 3 421.585 4.302 20 0 HIADHN CN(CCN(Cc1ccccc1)C(=O)NCCC1CCOCC1)Cc1ccccc1 ZINC000489601074 903490515 /nfs/dbraw/zinc/49/05/15/903490515.db2.gz FYXRSXKLOAVPNM-UHFFFAOYSA-N 0 3 409.574 4.147 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)NC[C@@H]2CCCO[C@H]2C(C)(C)C)CC1 ZINC000489623176 903503221 /nfs/dbraw/zinc/50/32/21/903503221.db2.gz VPMWXYNJSCJHBB-RBBKRZOGSA-N 0 3 401.595 4.134 20 0 HIADHN Cc1cccc(Cl)c1CC(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000489705933 903549028 /nfs/dbraw/zinc/54/90/28/903549028.db2.gz MZMWAWBMKASZKS-LJQANCHMSA-N 0 3 408.933 4.473 20 0 HIADHN CCc1ccc([C@@H](NC(=O)NCc2ccccc2CN2CCC(O)CC2)C(C)C)cc1 ZINC000489756297 903582619 /nfs/dbraw/zinc/58/26/19/903582619.db2.gz DMSDKXXFMIUEIL-VWLOTQADSA-N 0 3 423.601 4.402 20 0 HIADHN Cc1cc([C@@H]2CN(C(=O)NC[C@@H](c3cccs3)N3CCCC3)CCO2)ccc1F ZINC000489782606 903595030 /nfs/dbraw/zinc/59/50/30/903595030.db2.gz WSHNBQQITSHSPF-PMACEKPBSA-N 0 3 417.550 4.116 20 0 HIADHN Cc1cc([C@@H]2CN(C(=O)NC[C@H](c3cccs3)N3CCCC3)CCO2)ccc1F ZINC000489782607 903595767 /nfs/dbraw/zinc/59/57/67/903595767.db2.gz WSHNBQQITSHSPF-UXHICEINSA-N 0 3 417.550 4.116 20 0 HIADHN C[C@@H](NC(=O)NCc1ccccc1CN1CCC(O)CC1)c1cccc2ccccc21 ZINC000489786873 903598151 /nfs/dbraw/zinc/59/81/51/903598151.db2.gz CJGOMYKWXSJRCQ-LJQANCHMSA-N 0 3 417.553 4.357 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)N1CCCCC[C@H]1c1ccccc1 ZINC000489787146 903598376 /nfs/dbraw/zinc/59/83/76/903598376.db2.gz DLQNAZSYWOLUND-VWLOTQADSA-N 0 3 421.585 4.470 20 0 HIADHN CSc1ccc(Cl)cc1NC(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000489791701 903601175 /nfs/dbraw/zinc/60/11/75/903601175.db2.gz MQVKHPPORLYXCP-UHFFFAOYSA-N 0 3 419.978 4.340 20 0 HIADHN CSCC[C@H](N[C@H](C)c1ccc(OCc2ccccc2C)cc1)C(=O)N(C)C ZINC000489884328 903651161 /nfs/dbraw/zinc/65/11/61/903651161.db2.gz OAIXJHSFMDBPQI-GCJKJVERSA-N 0 3 400.588 4.435 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)NCc2ccccc2OC(F)F)CC1 ZINC000489917251 903674203 /nfs/dbraw/zinc/67/42/03/903674203.db2.gz WYDXNPMAICHTFC-UHFFFAOYSA-N 0 3 403.473 4.094 20 0 HIADHN Cc1ccc([C@@H]2C[C@@H](C)N(CC(=O)N3CCC(OCc4ccccc4)CC3)C2)cc1 ZINC000490051174 903744258 /nfs/dbraw/zinc/74/42/58/903744258.db2.gz BRDDFSCIQBJYPV-ZJSXRUAMSA-N 0 3 406.570 4.381 20 0 HIADHN Cc1ccc(C)c([C@H](NCc2ccc([C@]3(C)NC(=O)NC3=O)cc2)c2ccccc2)c1 ZINC000490137474 903786249 /nfs/dbraw/zinc/78/62/49/903786249.db2.gz RGMSDWKFQOWEGY-BVAGGSTKSA-N 0 3 413.521 4.237 20 0 HIADHN Cc1ccc([C@H](NCCc2ccccc2O)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000490142965 903789340 /nfs/dbraw/zinc/78/93/40/903789340.db2.gz KSOJWDQKQFULMY-XMMPIXPASA-N 0 3 409.551 4.334 20 0 HIADHN Cc1ccc([C@@H](NCCc2ccccc2O)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000490142964 903789563 /nfs/dbraw/zinc/78/95/63/903789563.db2.gz KSOJWDQKQFULMY-DEOSSOPVSA-N 0 3 409.551 4.334 20 0 HIADHN CN(C)C(=O)[C@@H]1CCCN1CCCN[C@@H](c1ccc(F)cc1)c1ccccc1Cl ZINC000490158059 903800037 /nfs/dbraw/zinc/80/00/37/903800037.db2.gz QAEIIPGQHGVIID-VXKWHMMOSA-N 0 3 417.956 4.101 20 0 HIADHN COC(=O)c1cc2c(o1)c(OC)ccc2CN(C)Cc1cc(OC)c(OC)cc1C ZINC000506051686 914750910 /nfs/dbraw/zinc/75/09/10/914750910.db2.gz QLPBSBXVCGTWFK-UHFFFAOYSA-N 0 3 413.470 4.186 20 0 HIADHN CC[C@H](CN[C@@H](c1cccc(S(C)(=O)=O)c1)c1ccc(C)cc1C)N1CCCC1 ZINC000490171850 903809444 /nfs/dbraw/zinc/80/94/44/903809444.db2.gz JBINJEFEKYNVOI-QPPBQGQZSA-N 0 3 414.615 4.260 20 0 HIADHN CC(C)[C@H](CN[C@H](c1ccc(F)cc1)c1cccc(S(C)(=O)=O)c1)N1CCCC1 ZINC000490173560 903811657 /nfs/dbraw/zinc/81/16/57/903811657.db2.gz WIGGNQZDVAYOTP-XZOQPEGZSA-N 0 3 418.578 4.029 20 0 HIADHN CC(=O)N1CC[C@H](NCc2ccc(OCc3ccccn3)cc2)c2ccccc2C1 ZINC000490191508 903818618 /nfs/dbraw/zinc/81/86/18/903818618.db2.gz TZZSPPDGOVADRF-VWLOTQADSA-N 0 3 401.510 4.244 20 0 HIADHN C[C@@H]1CCC[C@@H](N(Cc2ccc(C(=O)N(C)C)[nH]2)Cc2ccc3c(c2)OCO3)[C@H]1C ZINC000506055202 914755018 /nfs/dbraw/zinc/75/50/18/914755018.db2.gz IELLZLPYWILIFZ-LLGFUMIMSA-N 0 3 411.546 4.272 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N[C@H](c2ccccc2)c2ccncc2)C1 ZINC000490234118 903842763 /nfs/dbraw/zinc/84/27/63/903842763.db2.gz AAMXQNBIWIHZOX-CTUHWIOQSA-N 0 3 400.526 4.306 20 0 HIADHN CCN(C(=O)Nc1cc(-c2ccsc2)nn1C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000490235166 903843729 /nfs/dbraw/zinc/84/37/29/903843729.db2.gz DINSPXXWLHVGMQ-LJQANCHMSA-N 0 3 409.559 4.277 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)c3ccc(Oc4cccc(Cl)c4Cl)nc3)[C@@H]2C1 ZINC000490315620 903896660 /nfs/dbraw/zinc/89/66/60/903896660.db2.gz VESSKSHKWJCYRW-CZUORRHYSA-N 0 3 406.313 4.347 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)c2cc3sc(N(C)C)nc3s2)N(C)C)cc1 ZINC000506060252 914762931 /nfs/dbraw/zinc/76/29/31/914762931.db2.gz RFBMIBSEBXQGNG-OAHLLOKOSA-N 0 3 402.589 4.019 20 0 HIADHN O=C(Nc1ccc(Br)cc1F)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000490402662 903987108 /nfs/dbraw/zinc/98/71/08/903987108.db2.gz VIYBIQKRVZVCRT-UHFFFAOYSA-N 0 3 421.310 4.045 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)Nc3ccc(OC(F)F)c(Cc4ccccc4)c3)[C@@H]2C1 ZINC000490433714 904007562 /nfs/dbraw/zinc/00/75/62/904007562.db2.gz OHNNMSLEUCRIEW-FXAWDEMLSA-N 0 3 415.484 4.437 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Nc1cc(-c2ccc(Cl)s2)nn1C ZINC000490566002 904103674 /nfs/dbraw/zinc/10/36/74/904103674.db2.gz GBGAJDMDOIHVTO-UHFFFAOYSA-N 0 3 423.995 4.459 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)NC[C@H]1CCCCC(F)(F)C1 ZINC000490657869 904157983 /nfs/dbraw/zinc/15/79/83/904157983.db2.gz ODRNANPJBUUDLR-INIZCTEOSA-N 0 3 403.464 4.254 20 0 HIADHN O=C1C[C@@H]([C@H]2CCCCN2Cc2csc(-c3cccc(Br)c3)n2)CN1 ZINC000490668642 904164499 /nfs/dbraw/zinc/16/44/99/904164499.db2.gz CKYPCJDQKMSZSB-RHSMWYFYSA-N 0 3 420.376 4.063 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2ccc(NC(=O)C3CC3)cc2)N2CCCC2)cc1 ZINC000490669424 904164916 /nfs/dbraw/zinc/16/49/16/904164916.db2.gz LLXUOMIVIJTLNJ-JOCHJYFZSA-N 0 3 406.530 4.302 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)NCCc2csc(C(C)C)n2)N(C)C)cc1 ZINC000490712548 904187758 /nfs/dbraw/zinc/18/77/58/904187758.db2.gz YYACKDDAFMTTNF-HXUWFJFHSA-N 0 3 418.607 4.198 20 0 HIADHN CCOc1c(Br)cc(Cl)cc1NC(=O)N1CC[C@@H]2CCN(C)C[C@@H]21 ZINC000490808875 904254392 /nfs/dbraw/zinc/25/43/92/904254392.db2.gz VSZIXIRVUNVPKA-NHYWBVRUSA-N 0 3 416.747 4.059 20 0 HIADHN COc1ccccc1-c1ncc(CNCCc2coc(-c3ccc(F)cc3)n2)cn1 ZINC000490815308 904261774 /nfs/dbraw/zinc/26/17/74/904261774.db2.gz XCPRUKUJMRHHOF-UHFFFAOYSA-N 0 3 404.445 4.279 20 0 HIADHN O=C(CCN1CCN(c2ccccc2)CC1)NCC[C@H](c1ccccc1)C(F)(F)F ZINC000490857842 904290396 /nfs/dbraw/zinc/29/03/96/904290396.db2.gz VVZSZLQOSALOFI-OAQYLSRUSA-N 0 3 419.491 4.051 20 0 HIADHN CCN(CC)C[C@H](C)N[C@H](c1cccc(S(C)(=O)=O)c1)c1ccc(C)cc1C ZINC000491035352 904386961 /nfs/dbraw/zinc/38/69/61/904386961.db2.gz JJNVVBUCEQUTDN-WMZHIEFXSA-N 0 3 402.604 4.116 20 0 HIADHN COc1c(O)cccc1CNCc1ccccc1CN1CCN(c2ccccc2)CC1 ZINC000491056617 904400784 /nfs/dbraw/zinc/40/07/84/904400784.db2.gz BXOMGRBCVYRTON-UHFFFAOYSA-N 0 3 417.553 4.013 20 0 HIADHN C[C@H](CN[C@H](c1ccccc1Cl)c1cc(F)ccc1F)CN1CCN(C)CC1 ZINC000491061571 904405017 /nfs/dbraw/zinc/40/50/17/904405017.db2.gz RQYOBUWMOZTAIS-OPAMFIHVSA-N 0 3 407.936 4.181 20 0 HIADHN Cc1ccc([C@H](N[C@@H]2CCN(c3ccccc3)C2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000491062115 904405369 /nfs/dbraw/zinc/40/53/69/904405369.db2.gz USDGMVZCGGFCLS-RDGATRHJSA-N 0 3 420.578 4.356 20 0 HIADHN O=C(C1CCN(Cc2ccc(-c3ccc(Cl)c(Cl)c3)o2)CC1)N1CCOCC1 ZINC000506116172 914809335 /nfs/dbraw/zinc/80/93/35/914809335.db2.gz QXUSBUVSLZLJGH-UHFFFAOYSA-N 0 3 423.340 4.324 20 0 HIADHN CN(C)C[C@@H](NC(=O)NCc1cccc(COC(C)(C)C)c1)c1ccc(F)cc1 ZINC000491152173 904459700 /nfs/dbraw/zinc/45/97/00/904459700.db2.gz YUYLFENNNNUZDY-OAQYLSRUSA-N 0 3 401.526 4.243 20 0 HIADHN FC(F)(F)c1ccc2nnc([C@H]3CCCN(CC4=Cc5ccccc5OC4)C3)n2c1 ZINC000506128559 914815165 /nfs/dbraw/zinc/81/51/65/914815165.db2.gz HYRVCCAMOGRKPI-KRWDZBQOSA-N 0 3 414.431 4.404 20 0 HIADHN CN(C)C1(CN[C@H](c2ccc(Cl)cc2)c2cccc(S(C)(=O)=O)c2)CCCC1 ZINC000491318200 904534366 /nfs/dbraw/zinc/53/43/66/904534366.db2.gz ZMSZLTKCTXCYGB-OAQYLSRUSA-N 0 3 421.006 4.297 20 0 HIADHN CC(=O)N1CCC(N[C@H](c2ccccc2)c2cc(Br)ccc2F)CC1 ZINC000491357092 904555180 /nfs/dbraw/zinc/55/51/80/904555180.db2.gz VROJYCGRJSMVOG-HXUWFJFHSA-N 0 3 405.311 4.278 20 0 HIADHN CN(C)CC(C)(C)CN[C@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000491368691 904562678 /nfs/dbraw/zinc/56/26/78/904562678.db2.gz QGIJWQDDMNPSRC-HXUWFJFHSA-N 0 3 408.995 4.010 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)Nc1cc(F)c(OC(F)F)cc1F ZINC000491377145 904567748 /nfs/dbraw/zinc/56/77/48/904567748.db2.gz VAAKXEOAJHCMQH-UHFFFAOYSA-N 0 3 417.378 4.301 20 0 HIADHN Cc1ccc([C@@H](NC[C@@H]2Cc3ccccc3O2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000491392925 904574235 /nfs/dbraw/zinc/57/42/35/904574235.db2.gz BIFXEUBNLRFLOG-XUZZJYLKSA-N 0 3 407.535 4.081 20 0 HIADHN COc1ccc(CN(C)C(=O)Nc2ccc(CCN3CCSCC3)cc2)cc1C ZINC000491502340 904627503 /nfs/dbraw/zinc/62/75/03/904627503.db2.gz MBIYGUUDVCFJGX-UHFFFAOYSA-N 0 3 413.587 4.259 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)Nc2cccc(C)c2C(=O)N2CCCC2)c1 ZINC000491502588 904627893 /nfs/dbraw/zinc/62/78/93/904627893.db2.gz QKBXPCKPYBFWMV-UHFFFAOYSA-N 0 3 422.573 4.135 20 0 HIADHN CN(C)[C@H](CNC(=O)N1CCC[C@@H](c2nc3ccc(F)cc3o2)C1)c1ccccc1 ZINC000506170141 914831926 /nfs/dbraw/zinc/83/19/26/914831926.db2.gz IXGRHQSCOZCGSU-YLJYHZDGSA-N 0 3 410.493 4.159 20 0 HIADHN CCN1CC[C@@H](N(C)S(=O)(=O)c2cc(Cl)ccc2OCCC2CC2)C[C@H]1C ZINC000491587330 904664498 /nfs/dbraw/zinc/66/44/98/904664498.db2.gz WYSVYPIVESZHCL-CRAIPNDOSA-N 0 3 414.999 4.012 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)Nc2nnc(-c3ccsc3)s2)c1 ZINC000491648587 904679370 /nfs/dbraw/zinc/67/93/70/904679370.db2.gz PCQUFTNVGYVAMQ-UHFFFAOYSA-N 0 3 401.561 4.171 20 0 HIADHN CCOc1cc(CN(C)Cc2ccc(-n3cncn3)c(C)c2)ccc1OC(F)F ZINC000506193441 914840669 /nfs/dbraw/zinc/84/06/69/914840669.db2.gz XJYYPDXSMSYUFS-UHFFFAOYSA-N 0 3 402.445 4.208 20 0 HIADHN CCCCOc1ccc([C@@H](C)NC(=O)N2CCN(C3CCCC3)CC2)cc1OC ZINC000506199524 914842811 /nfs/dbraw/zinc/84/28/11/914842811.db2.gz IKZRJHFAGXCHCE-GOSISDBHSA-N 0 3 403.567 4.205 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)Nc3ccc(Oc4ccc(C(F)(F)F)cc4)nc3)[C@H]2C1 ZINC000492081389 904793951 /nfs/dbraw/zinc/79/39/51/904793951.db2.gz OQMVLIQSFGGTKG-KDOFPFPSSA-N 0 3 420.435 4.451 20 0 HIADHN O=C(Nc1ccc(Oc2ccccc2)nc1)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000492111240 904800821 /nfs/dbraw/zinc/80/08/21/904800821.db2.gz UTYQBQUOMRLRCN-UHFFFAOYSA-N 0 3 417.509 4.331 20 0 HIADHN Cc1ccc([C@H](NCCN2[C@H](C)CCC[C@@H]2C)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000492122438 904801878 /nfs/dbraw/zinc/80/18/78/904801878.db2.gz MXGGHESKVRFPTA-ROKPMTFOSA-N 0 3 414.615 4.340 20 0 HIADHN CN1CCN(C)[C@@H](CN[C@H](c2ccc(Cl)cc2)c2ccc(C(F)(F)F)cc2)C1 ZINC000492177088 904809891 /nfs/dbraw/zinc/80/98/91/904809891.db2.gz DNKXZSHBRIHEAC-PMACEKPBSA-N 0 3 411.899 4.284 20 0 HIADHN CCc1ccc([C@@H](NC[C@H]2CCCCN2CC)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000492194456 904812824 /nfs/dbraw/zinc/81/28/24/904812824.db2.gz FTCNUHWGASFBSJ-ISKFKSNPSA-N 0 3 414.615 4.206 20 0 HIADHN CCN(C(=O)Nc1nc(C2CCOCC2)cs1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000492464590 904854260 /nfs/dbraw/zinc/85/42/60/904854260.db2.gz LXVHQVDNYARKKI-IBGZPJMESA-N 0 3 414.575 4.165 20 0 HIADHN CN(C(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F)[C@@H](c1ncc[nH]1)c1ccccc1 ZINC000492468814 904855575 /nfs/dbraw/zinc/85/55/75/904855575.db2.gz WIHZMDSZICHJLG-LEWJYISDSA-N 0 3 424.495 4.115 20 0 HIADHN COc1ccc([C@H](N[C@@H](C)CN2CCOCC2)c2ccc(C(F)(F)F)cc2)cc1 ZINC000492517442 904864273 /nfs/dbraw/zinc/86/42/73/904864273.db2.gz XLYRYBLRQLXFLH-HRAATJIYSA-N 0 3 408.464 4.114 20 0 HIADHN C[C@H](CCCC(F)(F)F)N[C@H](C(=O)NCc1ccc2c(c1)OCO2)c1ccccc1 ZINC000492630416 904880218 /nfs/dbraw/zinc/88/02/18/904880218.db2.gz MSAKUKMYJOKALO-QRWLVFNGSA-N 0 3 422.447 4.484 20 0 HIADHN CCCCCOc1ccc(C(=O)CCC(=O)N2CCC[C@H]3CN(C)CC[C@H]32)cc1 ZINC000492788302 904908690 /nfs/dbraw/zinc/90/86/90/904908690.db2.gz HZPLFBQMCFQSKZ-RBBKRZOGSA-N 0 3 400.563 4.161 20 0 HIADHN CCC[C@H]1CN(CCSc2ccnc3cc(Cl)ccc32)CCN1CCOC ZINC000492834406 904919228 /nfs/dbraw/zinc/91/92/28/904919228.db2.gz RXHASMMAMBCQMQ-SFHVURJKSA-N 0 3 408.011 4.413 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)C(=O)Nc1ccc2ncccc2c1)c1ccc(Cl)cc1 ZINC000506231910 914855004 /nfs/dbraw/zinc/85/50/04/914855004.db2.gz KRZGKMXKVWBGLJ-NRFANRHFSA-N 0 3 424.932 4.026 20 0 HIADHN CC(=O)Nc1ccccc1CN1CCCN(Cc2ccc(C(F)(F)F)cc2)CC1 ZINC000506245099 914860573 /nfs/dbraw/zinc/86/05/73/914860573.db2.gz GZOCNQHRCJTSNP-UHFFFAOYSA-N 0 3 405.464 4.372 20 0 HIADHN CO[C@@H](CN[C@@H](c1cccc(S(C)(=O)=O)c1)c1ccc(C)cc1C)C(C)(C)C ZINC000493039468 905002955 /nfs/dbraw/zinc/00/29/55/905002955.db2.gz ZPXYYKXQHJBHPK-VXKWHMMOSA-N 0 3 403.588 4.447 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](NCCCC(F)(F)F)c2ccc(F)c(F)c2)c1 ZINC000493106112 905020239 /nfs/dbraw/zinc/02/02/39/905020239.db2.gz SMJLTQDSMMUVKO-KRWDZBQOSA-N 0 3 407.404 4.390 20 0 HIADHN COCC(=O)N1CCC(N[C@@H](c2ccc(F)c(C)c2)c2ccccc2Cl)CC1 ZINC000493245804 905065887 /nfs/dbraw/zinc/06/58/87/905065887.db2.gz FLBZLWLRLSCFMP-QFIPXVFZSA-N 0 3 404.913 4.104 20 0 HIADHN CCOc1cc(CN(C)[C@@H](C)c2ccc(F)cc2)ccc1O[C@H](C)C(=O)N(C)C ZINC000506259349 914868676 /nfs/dbraw/zinc/86/86/76/914868676.db2.gz OJCDRQGTQWGDQZ-DLBZAZTESA-N 0 3 402.510 4.273 20 0 HIADHN COCCC1(CN[C@H](c2cccc(S(C)(=O)=O)c2)c2ccc(F)c(F)c2)CCC1 ZINC000493275823 905072944 /nfs/dbraw/zinc/07/29/44/905072944.db2.gz CIHUVNBGWRVVDP-OAQYLSRUSA-N 0 3 423.525 4.254 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)c3cccc(Oc4ccc(Cl)c(Cl)c4)n3)[C@H]2C1 ZINC000493345450 905092952 /nfs/dbraw/zinc/09/29/52/905092952.db2.gz XVGYSYXDVCYMAB-ACJLOTCBSA-N 0 3 406.313 4.347 20 0 HIADHN COCCSc1ccc([C@H](C)NC(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)cc1 ZINC000493809638 905224825 /nfs/dbraw/zinc/22/48/25/905224825.db2.gz MNTZJTZQTKSLKN-NPPFBWRTSA-N 0 3 415.603 4.477 20 0 HIADHN Fc1ccc(OCCN2CCC[C@@H](c3nnc4ccc(C(F)(F)F)cn43)C2)cc1 ZINC000493870306 905237684 /nfs/dbraw/zinc/23/76/84/905237684.db2.gz FFVUZVLNLRJHLL-CQSZACIVSA-N 0 3 408.399 4.146 20 0 HIADHN C[C@@H](N[C@H](Cc1ccccc1)C(=O)N1CCCC1)c1cc(Br)cs1 ZINC000493888270 905247644 /nfs/dbraw/zinc/24/76/44/905247644.db2.gz LKTLDZGDFPBPBG-RHSMWYFYSA-N 0 3 407.377 4.395 20 0 HIADHN O=C(NCCCOc1ccccc1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000493902353 905256510 /nfs/dbraw/zinc/25/65/10/905256510.db2.gz CQLYQVOUJAUIMY-NRFANRHFSA-N 0 3 406.448 4.026 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)Nc3ccc(C(F)(F)F)cc3Br)[C@@H]2C1 ZINC000493936264 905288091 /nfs/dbraw/zinc/28/80/91/905288091.db2.gz XSSZCONWOKQJJR-IINYFYTJSA-N 0 3 406.246 4.026 20 0 HIADHN CCc1ccc([C@H](CNC(=O)c2cccc(OCc3cccnc3)c2)N(C)C)cc1 ZINC000493940348 905293058 /nfs/dbraw/zinc/29/30/58/905293058.db2.gz UZZYLSCZEJLVEG-DEOSSOPVSA-N 0 3 403.526 4.256 20 0 HIADHN O=C(c1cccc(CN[C@@H]2CCO[C@@H]2c2ccc(F)c(F)c2)c1)N1CCCCC1 ZINC000493960937 905309775 /nfs/dbraw/zinc/30/97/75/905309775.db2.gz NTYZRLKVUHFZBQ-FGZHOGPDSA-N 0 3 400.469 4.211 20 0 HIADHN CCN1CCN(c2ccc(N[C@H](C)C(=O)N(Cc3ccccc3)C(C)C)c(C)c2)CC1 ZINC000493995830 905337504 /nfs/dbraw/zinc/33/75/04/905337504.db2.gz GRAVGXLFLBPCEA-JOCHJYFZSA-N 0 3 422.617 4.375 20 0 HIADHN COCCC(=O)N1CCC(N[C@H](c2ccc(F)c(C)c2)c2ccccc2Cl)CC1 ZINC000493996485 905339515 /nfs/dbraw/zinc/33/95/15/905339515.db2.gz KPDNXIXGRRIECV-HSZRJFAPSA-N 0 3 418.940 4.494 20 0 HIADHN C[C@H]1[C@@H](NC(=O)c2ccc(NC(=O)c3cccs3)cc2)CCN1Cc1ccccc1 ZINC000493999113 905341233 /nfs/dbraw/zinc/34/12/33/905341233.db2.gz HECZEJYLVFYJEW-UWJYYQICSA-N 0 3 419.550 4.393 20 0 HIADHN CC(C)C(=O)Nc1ccc(Cl)c(C(=O)N[C@H]2CCN(Cc3ccccc3)[C@@H]2C)c1 ZINC000494007145 905348129 /nfs/dbraw/zinc/34/81/29/905348129.db2.gz OPIBEEFYFZQLMJ-IERDGZPVSA-N 0 3 413.949 4.327 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)c2ccc(-c3noc(C(F)F)n3)cc2)CCN1Cc1ccccc1 ZINC000494007168 905349450 /nfs/dbraw/zinc/34/94/50/905349450.db2.gz OSZPKBULPWFYAS-KDOFPFPSSA-N 0 3 412.440 4.067 20 0 HIADHN Cc1ccc([C@H](NCC(C)(C)C[C@@H](C)O)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000494019025 905357598 /nfs/dbraw/zinc/35/75/98/905357598.db2.gz GRBNSHBUBIXHAC-XMSQKQJNSA-N 0 3 403.588 4.183 20 0 HIADHN C[C@H]1[C@H](NC(=O)c2cn(C)nc2-c2ccccc2Cl)CCN1Cc1ccccc1 ZINC000494035759 905373564 /nfs/dbraw/zinc/37/35/64/905373564.db2.gz BCVZSOUELUSTTB-HRAATJIYSA-N 0 3 408.933 4.133 20 0 HIADHN COc1ccc(C(=O)N[C@H]2CCN(Cc3ccccc3)[C@@H]2C)cc1-c1ccccn1 ZINC000494046617 905386962 /nfs/dbraw/zinc/38/69/62/905386962.db2.gz GXSDKJRNDSHPPA-GCJKJVERSA-N 0 3 401.510 4.150 20 0 HIADHN O=C(NCCNCc1ccc(Br)c(Cl)c1)c1ccccc1Cl ZINC000494051336 905391039 /nfs/dbraw/zinc/39/10/39/905391039.db2.gz USRVAYPCZWSDCQ-UHFFFAOYSA-N 0 3 402.119 4.276 20 0 HIADHN CCCC(=O)NC[C@@H]1CCCN(Cc2ccc(OC)c(OCc3ccccc3)c2)C1 ZINC000512411336 921144029 /nfs/dbraw/zinc/14/40/29/921144029.db2.gz XVUAXHWSSLKWIP-QFIPXVFZSA-N 0 3 410.558 4.403 20 0 HIADHN C[C@@H]1CN(C(=O)c2csc(-c3ccc(Cl)cc3)c2)CC[C@H]1N1CCN(C)CC1 ZINC000494131091 905475548 /nfs/dbraw/zinc/47/55/48/905475548.db2.gz PENFYEQJBOOHQM-OXQOHEQNSA-N 0 3 418.006 4.167 20 0 HIADHN CCCn1ccc2ccc(NC(=O)N[C@H]3CCN(Cc4ccccc4)C[C@@H]3CO)cc21 ZINC000494152229 905490319 /nfs/dbraw/zinc/49/03/19/905490319.db2.gz IITWDGXHDRIJLU-GGAORHGYSA-N 0 3 420.557 4.056 20 0 HIADHN O=C(NC[C@H]1CCCN(Cc2cccc(OC(F)F)c2)C1)Nc1cccc(F)c1 ZINC000512426120 921152746 /nfs/dbraw/zinc/15/27/46/921152746.db2.gz FBLKCRNKVWHKOW-MRXNPFEDSA-N 0 3 407.436 4.461 20 0 HIADHN CCOc1ccc(CN2CCC[C@H](CNC(=O)Nc3ccc(C)cc3)C2)cc1OC ZINC000512426313 921152992 /nfs/dbraw/zinc/15/29/92/921152992.db2.gz FVSCACLCNMLJBO-HXUWFJFHSA-N 0 3 411.546 4.436 20 0 HIADHN CSc1ccc(NC(=O)N[C@H]2CCN(Cc3ccccc3)C[C@H]2CO)cc1Cl ZINC000494188660 905522365 /nfs/dbraw/zinc/52/23/65/905522365.db2.gz LKEHCJGEUDZDNZ-LPHOPBHVSA-N 0 3 419.978 4.066 20 0 HIADHN CCCc1ccc([C@H](NC(=O)N2CCN(C3CCOCC3)C[C@H]2C)C(C)C)cc1 ZINC000494194596 905529222 /nfs/dbraw/zinc/52/92/22/905529222.db2.gz IRSNLLWIXGBMFL-AUSIDOKSSA-N 0 3 401.595 4.231 20 0 HIADHN CCCc1ccc([C@@H](NC(=O)N2CCN(C3CCOCC3)C[C@H]2C)C(C)C)cc1 ZINC000494194599 905530083 /nfs/dbraw/zinc/53/00/83/905530083.db2.gz IRSNLLWIXGBMFL-XXBNENTESA-N 0 3 401.595 4.231 20 0 HIADHN CC(=O)c1c(C)cc(C)c(CN[C@H]2CC(=O)N(C)[C@H]2c2ccc(F)c(F)c2)c1C ZINC000494208926 905539282 /nfs/dbraw/zinc/53/92/82/905539282.db2.gz OIBPRTFHLYHHRA-REWPJTCUSA-N 0 3 400.469 4.154 20 0 HIADHN C[C@H](NC(=O)N1CCN(C2CCOCC2)C[C@H]1C)c1cc(F)c(Cl)cc1Cl ZINC000494238579 905563644 /nfs/dbraw/zinc/56/36/44/905563644.db2.gz RSSBEGGRZOACLF-OLZOCXBDSA-N 0 3 418.340 4.088 20 0 HIADHN Cc1cccc2sc(N(Cc3ccccc3)C(=O)CN[C@]3(C)CCO[C@H]3C)nc21 ZINC000494281142 905604104 /nfs/dbraw/zinc/60/41/04/905604104.db2.gz BTZHTRKKPFLRDY-GAJHUEQPSA-N 0 3 409.555 4.295 20 0 HIADHN CC1(C)Cc2ccc(Br)cc2[C@H]1NCc1ccc(S(C)(=O)=O)cc1 ZINC000494308844 905624814 /nfs/dbraw/zinc/62/48/14/905624814.db2.gz IBIKCRMQZXNHJM-GOSISDBHSA-N 0 3 408.361 4.266 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@@H](C)NCc2ccc3nc(C)sc3c2)cc1 ZINC000494328354 905641044 /nfs/dbraw/zinc/64/10/44/905641044.db2.gz KIBPUOSMEVDSCW-OAHLLOKOSA-N 0 3 417.600 4.486 20 0 HIADHN Cc1nn(-c2ccccc2)c(Oc2cccc(F)c2)c1CN[C@@H]1CCn2ccnc2C1 ZINC000494389757 905686664 /nfs/dbraw/zinc/68/66/64/905686664.db2.gz DMMJXMQJVZPXKA-LJQANCHMSA-N 0 3 417.488 4.413 20 0 HIADHN Cc1ccnc(-c2n[nH]c([C@@H](C)N[C@@H](C)Cc3ccc(Br)cc3)n2)c1 ZINC000494407744 905697829 /nfs/dbraw/zinc/69/78/29/905697829.db2.gz UWBUXYSNSSRVPS-UONOGXRCSA-N 0 3 400.324 4.219 20 0 HIADHN Cc1ccnc(-c2n[n-]c([C@H](C)N[C@@H]3C[C@H]4CC[C@@H](C3)[N@H+]4Cc3ccccc3)n2)c1 ZINC000494421866 905708480 /nfs/dbraw/zinc/70/84/80/905708480.db2.gz AKFAQIAWSSAJOV-ZIBCJSCZSA-N 0 3 402.546 4.021 20 0 HIADHN Cc1ccnc(-c2n[n-]c([C@H](C)N[C@@H]3C[C@H]4CC[C@@H](C3)[N@@H+]4Cc3ccccc3)n2)c1 ZINC000494421866 905708492 /nfs/dbraw/zinc/70/84/92/905708492.db2.gz AKFAQIAWSSAJOV-ZIBCJSCZSA-N 0 3 402.546 4.021 20 0 HIADHN COc1cccc(N(CC(C)C)C(=O)c2ccc(CN3CCC(CO)CC3)cc2)c1 ZINC000494479932 905760676 /nfs/dbraw/zinc/76/06/76/905760676.db2.gz PILCJIUUYPWZJN-UHFFFAOYSA-N 0 3 410.558 4.202 20 0 HIADHN O=C1[C@H](N[C@@H]2CCO[C@@H]2c2ccc(Cl)cc2)CCCN1Cc1ccc(F)cc1F ZINC000494481711 905763481 /nfs/dbraw/zinc/76/34/81/905763481.db2.gz BPPRGXQYVIZWRH-NJDAHSKKSA-N 0 3 420.887 4.229 20 0 HIADHN CC(C)CNC(=O)c1cccc(CN[C@@H]2CCO[C@@H]2c2ccc(Cl)c(F)c2)c1 ZINC000494490140 905774484 /nfs/dbraw/zinc/77/44/84/905774484.db2.gz XQZYLZFRADKQQD-NHCUHLMSSA-N 0 3 404.913 4.485 20 0 HIADHN C[C@H](N[C@H]1CCO[C@H]1c1ccc(Cl)cc1)C(=O)Nc1ccc(OC(F)F)cc1 ZINC000494493891 905779257 /nfs/dbraw/zinc/77/92/57/905779257.db2.gz JVHPYLBCSPOLAA-IGNZVWTISA-N 0 3 410.848 4.388 20 0 HIADHN COc1ccc(N(C(=O)c2ccc(CN3CCC(CO)CC3)cc2)[C@H](C)C2CC2)cc1 ZINC000494496527 905783484 /nfs/dbraw/zinc/78/34/84/905783484.db2.gz YGNOXXPYHHUWEJ-LJQANCHMSA-N 0 3 422.569 4.345 20 0 HIADHN Cc1ccc(S(=O)(=O)CCCN[C@H]2CCO[C@@H]2c2ccc(Cl)c(F)c2)cc1 ZINC000494496786 905783899 /nfs/dbraw/zinc/78/38/99/905783899.db2.gz PRCRBGYOIHRRSP-VQTJNVASSA-N 0 3 411.926 4.071 20 0 HIADHN Cc1ccc(-n2nc(C(=O)NC[C@H](c3ccccc3)N3CCCC3)c3c2CCC3)cc1 ZINC000512468405 921181176 /nfs/dbraw/zinc/18/11/76/921181176.db2.gz MBSIDTQJJXEFQJ-XMMPIXPASA-N 0 3 414.553 4.236 20 0 HIADHN CN(C)[C@@H](CNCc1cnn(Cc2ccc(C(F)(F)F)cc2)c1)c1ccsc1 ZINC000494611733 905861746 /nfs/dbraw/zinc/86/17/46/905861746.db2.gz DMGFQVJZNXITBP-IBGZPJMESA-N 0 3 408.493 4.404 20 0 HIADHN Cc1cc(NC(=O)N2CC[C@@H](C)C(F)(F)C2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000494653786 905885176 /nfs/dbraw/zinc/88/51/76/905885176.db2.gz VRIAEOKOSYKYCP-VQIMIIECSA-N 0 3 417.504 4.148 20 0 HIADHN C[C@H](c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCN(C[C@@H]2CCOC2)CC1 ZINC000494705410 905912726 /nfs/dbraw/zinc/91/27/26/905912726.db2.gz ZDKWOOAYJFHCTE-KGLIPLIRSA-N 0 3 410.402 4.439 20 0 HIADHN CC(C)[C@@H](O)C(C)(C)CN[C@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000494711387 905914420 /nfs/dbraw/zinc/91/44/20/905914420.db2.gz BDGCNOHDLSEDBO-NHCUHLMSSA-N 0 3 424.006 4.466 20 0 HIADHN COc1cc(C)c(NC(=O)NCCCN2CCN(C)C[C@@H]2c2ccccc2)c(C)c1C ZINC000494716175 905918993 /nfs/dbraw/zinc/91/89/93/905918993.db2.gz VUKNNSKUWFKCDE-JOCHJYFZSA-N 0 3 424.589 4.121 20 0 HIADHN CCSc1cccc(CNC(=O)N(C)C2CCN(CCc3ccccn3)CC2)c1 ZINC000494777160 905975004 /nfs/dbraw/zinc/97/50/04/905975004.db2.gz ANXVVECFWBQWDM-UHFFFAOYSA-N 0 3 412.603 4.042 20 0 HIADHN Cc1nc(-c2cccs2)sc1C(=O)N(CCN(C)C)Cc1cccc(O)c1 ZINC000494791691 905994026 /nfs/dbraw/zinc/99/40/26/905994026.db2.gz PBZXZBDLLGHDIV-UHFFFAOYSA-N 0 3 401.557 4.090 20 0 HIADHN CC(C)Oc1ccc(CN[C@@H](C)c2ccc(S(=O)(=O)N(C)C)cc2)cc1Cl ZINC000494795628 905996521 /nfs/dbraw/zinc/99/65/21/905996521.db2.gz PVFGOFMIVLKGBX-HNNXBMFYSA-N 0 3 410.967 4.228 20 0 HIADHN CN(Cc1ccc(Br)c(F)c1)C(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000494839477 906029553 /nfs/dbraw/zinc/02/95/53/906029553.db2.gz XSTFMLGBWMMAML-OALUTQOASA-N 0 3 420.326 4.175 20 0 HIADHN C[C@H](NC(=O)N1CCN(C2CCOCC2)C[C@@H]1C)c1ccc(Oc2ccccc2)cc1 ZINC000494912123 906086426 /nfs/dbraw/zinc/08/64/26/906086426.db2.gz SYCGPUJHEOVLJA-PMACEKPBSA-N 0 3 423.557 4.435 20 0 HIADHN O=S1(=O)CC[C@H](NC[C@H]2CCCCC(F)(F)C2)c2cc(Br)ccc21 ZINC000494996438 906158620 /nfs/dbraw/zinc/15/86/20/906158620.db2.gz ILFXEFZMXDLDSW-WFASDCNBSA-N 0 3 422.335 4.473 20 0 HIADHN COc1ccccc1[C@H](NC(=O)N[C@@H]1C[C@H](C)N(Cc2ccccc2)C1)c1ccco1 ZINC000495009100 906169874 /nfs/dbraw/zinc/16/98/74/906169874.db2.gz TUBNSMBYBQYSMY-NRYAXDJKSA-N 0 3 419.525 4.340 20 0 HIADHN CN(Cc1ccc(Br)c(F)c1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000495017208 906175490 /nfs/dbraw/zinc/17/54/90/906175490.db2.gz LUXSUOYYHLSWAV-KRWDZBQOSA-N 0 3 420.326 4.004 20 0 HIADHN COc1ccc([C@H](N[C@@H]2CCO[C@]3(CCOC3)C2)c2ccccc2Cl)cc1OC ZINC000495045523 906202670 /nfs/dbraw/zinc/20/26/70/906202670.db2.gz HQSPWWDNXGBHOY-MQNAVGNWSA-N 0 3 417.933 4.374 20 0 HIADHN CC(C)C(=O)NCCCN[C@@H](c1cccc(F)c1)c1cccc(Br)c1 ZINC000495053080 906207419 /nfs/dbraw/zinc/20/74/19/906207419.db2.gz WMARUFQNYWMVAQ-LJQANCHMSA-N 0 3 407.327 4.430 20 0 HIADHN Cc1cccc2[nH]c(CCC(=O)Nc3ccc(CN4CCSCC4)cc3C)nc21 ZINC000495095725 906236359 /nfs/dbraw/zinc/23/63/59/906236359.db2.gz YOCWUBCTCCOFAG-UHFFFAOYSA-N 0 3 408.571 4.300 20 0 HIADHN Cc1cccc2nc(CCC(=O)Nc3ccc(CN4CCSCC4)cc3C)[nH]c21 ZINC000495095725 906236382 /nfs/dbraw/zinc/23/63/82/906236382.db2.gz YOCWUBCTCCOFAG-UHFFFAOYSA-N 0 3 408.571 4.300 20 0 HIADHN CC1(C)CC[C@@H](CNCc2cc(Br)ccc2OCc2ccccn2)O1 ZINC000495169876 906284535 /nfs/dbraw/zinc/28/45/35/906284535.db2.gz VBXNNMULSFSTAW-SFHVURJKSA-N 0 3 405.336 4.470 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N[C@@H](C)c2nc(C(F)(F)F)cs2)N(C)C)cc1 ZINC000495178462 906288076 /nfs/dbraw/zinc/28/80/76/906288076.db2.gz QMRHXKHOLOKIBX-JSGCOSHPSA-N 0 3 400.470 4.133 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)NCc2ccnc(Oc3ccccc3F)c2)N(C)C)cc1 ZINC000495178192 906289136 /nfs/dbraw/zinc/28/91/36/906289136.db2.gz PQAQBFFYYUBRHO-OAQYLSRUSA-N 0 3 422.504 4.424 20 0 HIADHN C[C@H](C(=O)NCCCN1CCN(C)C[C@H]1c1ccccc1)c1ccc(Cl)s1 ZINC000495182641 906292800 /nfs/dbraw/zinc/29/28/00/906292800.db2.gz HVICHHIHZSCPIL-WMZOPIPTSA-N 0 3 405.995 4.000 20 0 HIADHN COCCC[C@H](CNCc1c(Br)c(C)nn1C)c1ccc(Cl)cc1 ZINC000512537562 921222626 /nfs/dbraw/zinc/22/26/26/921222626.db2.gz UWUNFUCMMOXLLF-OAHLLOKOSA-N 0 3 414.775 4.444 20 0 HIADHN CC(C)C[C@H](NC(=O)N1CCN(C2CCOCC2)C[C@H]1C)c1ccc(Cl)cc1 ZINC000495253972 906342925 /nfs/dbraw/zinc/34/29/25/906342925.db2.gz XELSIIRNSWLAGP-UTKZUKDTSA-N 0 3 407.986 4.322 20 0 HIADHN C[C@H]1CCCN(CCNC(=O)c2ccc(COc3ccc(Br)cc3)o2)C1 ZINC000495308723 906367838 /nfs/dbraw/zinc/36/78/38/906367838.db2.gz SGWCADMYZGTITI-HNNXBMFYSA-N 0 3 421.335 4.083 20 0 HIADHN COc1ccc(OC)c(NC(=O)C[C@@H](C)N[C@@H]2CCCOc3c(F)cccc32)c1 ZINC000495435515 906450082 /nfs/dbraw/zinc/45/00/82/906450082.db2.gz XOBLGXDFQDNOCS-RDTXWAMCSA-N 0 3 402.466 4.064 20 0 HIADHN O=C(c1cccc(CN[C@H](Cc2ccccc2)c2ccccc2)c1)N1CCOCC1 ZINC000495501012 906490033 /nfs/dbraw/zinc/49/00/33/906490033.db2.gz CKFFKDNDZAMOEJ-RUZDIDTESA-N 0 3 400.522 4.233 20 0 HIADHN CCCN1CCN(c2ccccc2CNCc2c(F)cccc2N2CCCC2)CC1 ZINC000512566359 921241217 /nfs/dbraw/zinc/24/12/17/921241217.db2.gz WHZFGVOVNUXSGA-UHFFFAOYSA-N 0 3 410.581 4.248 20 0 HIADHN C[C@H](NCc1cccc(NC(=O)CCN2CCOCC2)c1)c1ccc2ccccc2c1 ZINC000495588490 906507872 /nfs/dbraw/zinc/50/78/72/906507872.db2.gz AQFMGJCFZQIRDG-FQEVSTJZSA-N 0 3 417.553 4.351 20 0 HIADHN CC(C)NS(=O)(=O)c1cccc(CN[C@H](Cc2ccccc2)c2ccccc2)c1 ZINC000495652856 906518138 /nfs/dbraw/zinc/51/81/38/906518138.db2.gz CYXJDJOYQNWCHP-XMMPIXPASA-N 0 3 408.567 4.447 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)c2ccccc2NCc2ccco2)CC1 ZINC000496027757 906600734 /nfs/dbraw/zinc/60/07/34/906600734.db2.gz JASXIWPXLCICPQ-GOSISDBHSA-N 0 3 404.514 4.242 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)c1csc(-c2ccccc2)n1 ZINC000496248096 906640495 /nfs/dbraw/zinc/64/04/95/906640495.db2.gz YSGBZBLZVVHWQG-HXUWFJFHSA-N 0 3 406.555 4.332 20 0 HIADHN Cc1cccc(-c2nc(CC(=O)N(CCN(C)C)Cc3ccc(F)cc3)cs2)c1 ZINC000496262429 906642927 /nfs/dbraw/zinc/64/29/27/906642927.db2.gz KZCSVEZOUQMBFU-UHFFFAOYSA-N 0 3 411.546 4.391 20 0 HIADHN Cc1cc(Cl)ccc1Cc1cnc(NC(=O)N2CC[C@H]3CCN(C)C[C@H]32)s1 ZINC000496445561 906681333 /nfs/dbraw/zinc/68/13/33/906681333.db2.gz AOKNLCGXEDVUOL-RDTXWAMCSA-N 0 3 404.967 4.254 20 0 HIADHN COc1ccc(C2(NC(=O)NC[C@@H](c3ccc(OC(C)C)cc3)N(C)C)CC2)cc1 ZINC000496594058 906716647 /nfs/dbraw/zinc/71/66/47/906716647.db2.gz RHXHOVOGNIBTGJ-QFIPXVFZSA-N 0 3 411.546 4.074 20 0 HIADHN CO[C@H]1C[C@@H](CN(C)C(=O)N[C@@H](c2ccccc2)c2ccc3ccccc3c2)N(C)C1 ZINC000496610752 906719643 /nfs/dbraw/zinc/71/96/43/906719643.db2.gz IPWIDTRAMMQQFZ-SDHOMARFSA-N 0 3 417.553 4.290 20 0 HIADHN CC(C)c1cc(C(=O)NC[C@@H](Cc2ccccc2)N(C)C)c2cnn(C(C)C)c2n1 ZINC000497067849 906800788 /nfs/dbraw/zinc/80/07/88/906800788.db2.gz VYVLLAIGQGOEMF-LJQANCHMSA-N 0 3 407.562 4.038 20 0 HIADHN CN(Cc1cc(Br)ccc1OCc1ccccn1)C[C@H]1CCCC[C@@H]1O ZINC000497095003 906803091 /nfs/dbraw/zinc/80/30/91/906803091.db2.gz FQRNOZFGMKFQOJ-UZLBHIALSA-N 0 3 419.363 4.406 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)c2cc3ccc(OC(F)(F)F)cc3[nH]2)o1 ZINC000497400599 906881647 /nfs/dbraw/zinc/88/16/47/906881647.db2.gz UTQWGJYWWLIXTN-UHFFFAOYSA-N 0 3 409.408 4.172 20 0 HIADHN C[C@H](CC(=O)N[C@@H]1CN(C)C[C@@H]1c1ccccc1)c1ccc(Br)cc1 ZINC000497413595 906889825 /nfs/dbraw/zinc/88/98/25/906889825.db2.gz BKHUQBYXGMLGLW-CDHQVMDDSA-N 0 3 401.348 4.157 20 0 HIADHN COc1ccc(CCCN(C)[C@@H](C)C(=O)N(C)Cc2nc3ccccc3s2)cc1 ZINC000497457855 906934621 /nfs/dbraw/zinc/93/46/21/906934621.db2.gz CANRTAMWLAKEJY-KRWDZBQOSA-N 0 3 411.571 4.216 20 0 HIADHN COc1ccc(CNC(=O)C2CCN(Cc3cc(Cl)cc4cccnc43)CC2)cc1 ZINC000512664193 921280253 /nfs/dbraw/zinc/28/02/53/921280253.db2.gz XSBJCEVFYGTYRG-UHFFFAOYSA-N 0 3 423.944 4.425 20 0 HIADHN CN(C)Cc1cccc(C(=O)NCc2ccc(Br)cc2C(F)(F)F)c1 ZINC000497580930 907063838 /nfs/dbraw/zinc/06/38/38/907063838.db2.gz PWULGEFCWIHWSJ-UHFFFAOYSA-N 0 3 415.253 4.460 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)N[C@@H]3CCCc4nc(-c5ccc(F)cc5)sc43)[C@@H]2C1 ZINC000497645051 907132203 /nfs/dbraw/zinc/13/22/03/907132203.db2.gz YJQAZBFJFQTDSV-NIKGAXFTSA-N 0 3 414.550 4.062 20 0 HIADHN Cc1c(C(=O)NC[C@H](C(C)C)N2CCc3ccccc3C2)cnn1Cc1ccccc1 ZINC000512731635 921298294 /nfs/dbraw/zinc/29/82/94/921298294.db2.gz ZOCXQVVGVYVTOR-RUZDIDTESA-N 0 3 416.569 4.053 20 0 HIADHN CS[C@@H]1CN(C(=O)Nc2cc(C)ccc2SCC(F)(F)F)C[C@@H]1N(C)C ZINC000497671540 907171643 /nfs/dbraw/zinc/17/16/43/907171643.db2.gz YSDSTTRJTYUHLC-DZGCQCFKSA-N 0 3 407.527 4.159 20 0 HIADHN CN1CCC[C@@H](CNC(=O)c2occ3c2CCOC3)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000512745232 921300538 /nfs/dbraw/zinc/30/05/38/921300538.db2.gz WOCUJADMJODVSM-KXBFYZLASA-N 0 3 422.447 4.184 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1CCN(Cc2ccccc2)[C@H]1C)c1ncc(-c2ccccc2)o1 ZINC000497724188 907222941 /nfs/dbraw/zinc/22/29/41/907222941.db2.gz ADYZRXZANGGIIW-BBTUJRGHSA-N 0 3 404.514 4.365 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Cc1cn(CC)c2ccccc12)c1cccc(OC)c1 ZINC000497753950 907244886 /nfs/dbraw/zinc/24/48/86/907244886.db2.gz WCEWAXFYQHKDCX-XMMPIXPASA-N 0 3 407.558 4.412 20 0 HIADHN C[C@H](CC(=O)OC(C)(C)C)N[C@@H](CN1CCCC1=O)c1cccc(C(F)(F)F)c1 ZINC000497830961 907313422 /nfs/dbraw/zinc/31/34/22/907313422.db2.gz FSVCDIOGPDHBNX-PBHICJAKSA-N 0 3 414.468 4.079 20 0 HIADHN C[C@H](CC(=O)OC(C)(C)C)N[C@H](CN1CCCC1=O)c1cccc(C(F)(F)F)c1 ZINC000497830962 907313767 /nfs/dbraw/zinc/31/37/67/907313767.db2.gz FSVCDIOGPDHBNX-RHSMWYFYSA-N 0 3 414.468 4.079 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)NCCc1csc(C(C)(C)C)n1 ZINC000497954058 907423744 /nfs/dbraw/zinc/42/37/44/907423744.db2.gz YCKBAPSUIKKSNP-SFHVURJKSA-N 0 3 414.619 4.289 20 0 HIADHN CCN(C(=O)c1ccc2c(c1)NC(=O)[C@H](C)S2)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000497956544 907426796 /nfs/dbraw/zinc/42/67/96/907426796.db2.gz CQMZLAWKHKPLPJ-FUHIMQAGSA-N 0 3 423.582 4.417 20 0 HIADHN Cc1cccc([C@H](NC(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)c2ccccn2)c1 ZINC000497958592 907428800 /nfs/dbraw/zinc/42/88/00/907428800.db2.gz PXNZVRVEWKNZSX-TZRRMPRUSA-N 0 3 400.526 4.224 20 0 HIADHN COc1ccc([C@@H](CNC(=O)CCOc2ccccc2Cl)N2CCCC2)cc1 ZINC000497982169 907460153 /nfs/dbraw/zinc/46/01/53/907460153.db2.gz KYUYPHGDOSSSPP-HXUWFJFHSA-N 0 3 402.922 4.071 20 0 HIADHN CN(C)Cc1ccccc1C(=O)Nc1ccc(F)c(-c2nnc3n2CCCCC3)c1 ZINC000498006378 907494187 /nfs/dbraw/zinc/49/41/87/907494187.db2.gz RQYVNTRFLVUIOC-UHFFFAOYSA-N 0 3 407.493 4.125 20 0 HIADHN CCOC1CC2(C1)CCN(CC(=O)N1CCCCC[C@H]1c1ccc(OC)cc1)C2 ZINC000512827238 921331127 /nfs/dbraw/zinc/33/11/27/921331127.db2.gz JABBMDUVJHOQAL-MHIUNMELSA-N 0 3 400.563 4.030 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)[C@H]1C[C@H]1c1ccc(F)cc1F ZINC000498049545 907559624 /nfs/dbraw/zinc/55/96/24/907559624.db2.gz XMFROMOTWGZXQV-PMACEKPBSA-N 0 3 402.510 4.298 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)[C@@H]1C[C@@H]1c1ccccc1C(F)(F)F ZINC000498054860 907566205 /nfs/dbraw/zinc/56/62/05/907566205.db2.gz NHIORKGCPNQFDK-WOJBJXKFSA-N 0 3 402.460 4.374 20 0 HIADHN Cc1cnc([C@@H](NC(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)C2CC2)s1 ZINC000498105588 907616007 /nfs/dbraw/zinc/61/60/07/907616007.db2.gz CEGKDPZUOVDXJI-PMACEKPBSA-N 0 3 416.591 4.292 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)NC[C@H](c3c[nH]c4ccccc43)c3ccccc3)[C@H]2C1 ZINC000498112520 907624083 /nfs/dbraw/zinc/62/40/83/907624083.db2.gz ARUKLOFYIWFXAV-IZIIKQMZSA-N 0 3 402.542 4.035 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(Cl)cc2)CC1)[C@@H](c1ccccc1)C1CC1 ZINC000498124933 907640933 /nfs/dbraw/zinc/64/09/33/907640933.db2.gz KSXSNFXMCDSAMM-QHCPKHFHSA-N 0 3 412.961 4.493 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N[C@H](c2cccc(F)c2)c2ccccn2)C1 ZINC000498238805 907772092 /nfs/dbraw/zinc/77/20/92/907772092.db2.gz KCKHWAOGOBXQSD-IHLLOCCUSA-N 0 3 418.516 4.445 20 0 HIADHN CCC(CC)[C@@H]1C[C@H](NC(=O)N(CCN(C)C)Cc2cccc(Cl)c2)CCO1 ZINC000498392399 907876886 /nfs/dbraw/zinc/87/68/86/907876886.db2.gz QJZYDIMTYSUKFF-RTWAWAEBSA-N 0 3 410.002 4.397 20 0 HIADHN O=C(N[C@@H](c1ccccc1Cl)c1cc(F)ccc1F)N1CCN2CCC1CC2 ZINC000498403107 907884131 /nfs/dbraw/zinc/88/41/31/907884131.db2.gz SNJNLBMLJZAKTC-FQEVSTJZSA-N 0 3 405.876 4.197 20 0 HIADHN COc1ccccc1OCc1ccc(C(=O)N(Cc2ccco2)C2CCN(C)CC2)o1 ZINC000498466167 907934709 /nfs/dbraw/zinc/93/47/09/907934709.db2.gz NRYIZEFOKXRGSW-UHFFFAOYSA-N 0 3 424.497 4.197 20 0 HIADHN COc1cc(C(=O)N2CCN(C)CC[C@@H]2C)ccc1OCc1ccc(Cl)cc1 ZINC000498703155 908127279 /nfs/dbraw/zinc/12/72/79/908127279.db2.gz ABFSRPSJHQHZBH-INIZCTEOSA-N 0 3 402.922 4.094 20 0 HIADHN C[C@@H]1CCN(C)CCN1C(=O)c1cn(-c2ccccc2)nc1-c1ccc(Cl)cc1 ZINC000498715129 908139832 /nfs/dbraw/zinc/13/98/32/908139832.db2.gz IYNMTKJKCFENEV-QGZVFWFLSA-N 0 3 408.933 4.359 20 0 HIADHN C[C@H]1CCN(C)CCN1C(=O)c1ccc(COc2ccccc2Br)cc1 ZINC000498730722 908158306 /nfs/dbraw/zinc/15/83/06/908158306.db2.gz QQCDPEIXXYEVRD-INIZCTEOSA-N 0 3 417.347 4.194 20 0 HIADHN COc1ccc(CN(C)C(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)cc1C ZINC000512897776 921390572 /nfs/dbraw/zinc/39/05/72/921390572.db2.gz UQLPDBQFUFYAHC-JOCHJYFZSA-N 0 3 413.562 4.235 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)N[C@H]1CCCOc2c(F)cccc21 ZINC000498820044 908226594 /nfs/dbraw/zinc/22/65/94/908226594.db2.gz WSJHDBWNOHDNGS-FQEVSTJZSA-N 0 3 421.463 4.091 20 0 HIADHN Cc1nc([C@H]2CCCN2C(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)cs1 ZINC000512902389 921394208 /nfs/dbraw/zinc/39/42/08/921394208.db2.gz NYUDTJKDHWZQHV-NHCUHLMSSA-N 0 3 416.591 4.388 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)N2CCC[C@@H](c3nccs3)C2)N(C)C)cc1 ZINC000512902697 921395185 /nfs/dbraw/zinc/39/51/85/921395185.db2.gz QXDGGBWAIYZRLV-UYAOXDASSA-N 0 3 416.591 4.122 20 0 HIADHN O=C(NC[C@H]1CCCCN1Cc1ccccc1)C1(c2cccc(F)c2)CCOCC1 ZINC000498890954 908295909 /nfs/dbraw/zinc/29/59/09/908295909.db2.gz KARRQKGTRYYIFJ-HSZRJFAPSA-N 0 3 410.533 4.045 20 0 HIADHN C[C@@H](NC(=O)NCc1nccn1CCCc1ccccc1)[C@H](c1ccccc1)N(C)C ZINC000498891172 908296342 /nfs/dbraw/zinc/29/63/42/908296342.db2.gz MHKAZJCOMAVTDB-HYBUGGRVSA-N 0 3 419.573 4.007 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)NC[C@@H](c2cccnc2)C(C)C)N(C)C)cc1 ZINC000498901157 908309413 /nfs/dbraw/zinc/30/94/13/908309413.db2.gz YYVIEFDAYAKVAM-DHIUTWEWSA-N 0 3 412.578 4.211 20 0 HIADHN CCN1C[C@H](C)N(CC(=O)Nc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C[C@@H]1C ZINC000498924056 908334802 /nfs/dbraw/zinc/33/48/02/908334802.db2.gz JVRSOPRJYMNIDR-RYUDHWBXSA-N 0 3 411.390 4.077 20 0 HIADHN CCn1nc(C)c(CC(=O)N[C@H](c2ccc(F)c(F)c2)C(C)(C)N2CCCC2)c1C ZINC000498936364 908342831 /nfs/dbraw/zinc/34/28/31/908342831.db2.gz NDCALQAEUXQDPK-JOCHJYFZSA-N 0 3 418.532 4.072 20 0 HIADHN Cc1cccc([C@H](NC(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)c2ccccn2)c1 ZINC000499026676 908402830 /nfs/dbraw/zinc/40/28/30/908402830.db2.gz KPJDFBDCXHIZLV-ZCYQVOJMSA-N 0 3 414.553 4.395 20 0 HIADHN Cc1noc(CSc2ccc(C(=O)NC[C@@H](c3ccc(C)cc3)N(C)C)cc2)n1 ZINC000499147250 908505241 /nfs/dbraw/zinc/50/52/41/908505241.db2.gz ANIWNCZZMFDFPH-FQEVSTJZSA-N 0 3 410.543 4.011 20 0 HIADHN Cc1ccc([C@H](CNC(=O)CCc2ncc(-c3ccc(F)cc3F)o2)N(C)C)cc1 ZINC000499153338 908511285 /nfs/dbraw/zinc/51/12/85/908511285.db2.gz GEAWNVQPTSXFDK-FQEVSTJZSA-N 0 3 413.468 4.280 20 0 HIADHN C[C@@H](NC(=O)Nc1ccc(OCc2ccccn2)c(Cl)c1)C1=CCN(C)CC1 ZINC000512923279 921417034 /nfs/dbraw/zinc/41/70/34/921417034.db2.gz RWZCIXHKBJWRMB-OAHLLOKOSA-N 0 3 400.910 4.086 20 0 HIADHN C[C@H](C(=O)NCCCN1CCc2ccccc2C1)c1ccc(Br)cc1 ZINC000499194781 908549193 /nfs/dbraw/zinc/54/91/93/908549193.db2.gz PVHNKLPFRSYNSW-INIZCTEOSA-N 0 3 401.348 4.117 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)N[C@H](c2cccc(F)c2)c2ccccn2)CC1 ZINC000499299076 908669214 /nfs/dbraw/zinc/66/92/14/908669214.db2.gz GCQGUOBPRGDROK-HSZRJFAPSA-N 0 3 422.504 4.209 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)NCCc1csc(-c2ccccc2)n1)c1ccco1 ZINC000499333574 908709077 /nfs/dbraw/zinc/70/90/77/908709077.db2.gz FPAZMUUYGSENSW-QFBILLFUSA-N 0 3 412.559 4.374 20 0 HIADHN CC[C@@H](C)n1ncc2c1nc(C)cc2C(=O)N(CCN(C)C)Cc1cccc(F)c1 ZINC000499360317 908729715 /nfs/dbraw/zinc/72/97/15/908729715.db2.gz VOJQCVSJMWPJMK-QGZVFWFLSA-N 0 3 411.525 4.054 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2ccc(OC[C@@H]3CCCO3)cc2)N2CCCC2)cc1 ZINC000499395710 908755689 /nfs/dbraw/zinc/75/56/89/908755689.db2.gz BPXOAPRNOHNHAL-BJKOFHAPSA-N 0 3 408.542 4.120 20 0 HIADHN COc1ccc(Br)c(C(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)c1 ZINC000499397702 908759607 /nfs/dbraw/zinc/75/96/07/908759607.db2.gz ODMBAHFZYXFGIE-FQEVSTJZSA-N 0 3 417.347 4.333 20 0 HIADHN COc1ccc([C@H](CNC(=O)N[C@@H](C)c2cccc(F)c2F)N2CCCC2)cc1 ZINC000499477559 908810841 /nfs/dbraw/zinc/81/08/41/908810841.db2.gz BYSHRTHXGNGLMU-YWZLYKJASA-N 0 3 403.473 4.171 20 0 HIADHN CS(=O)(=O)C1(CNCc2cn(-c3ccccc3)nc2-c2cccs2)CCCC1 ZINC000512971483 921445835 /nfs/dbraw/zinc/44/58/35/921445835.db2.gz GXNXUTCRPZIYIB-UHFFFAOYSA-N 0 3 415.584 4.048 20 0 HIADHN C[C@H]1C[C@H](NCc2nnc3c(Cl)cc(C(F)(F)F)cn23)CN1Cc1ccccc1 ZINC000499661580 908868487 /nfs/dbraw/zinc/86/84/87/908868487.db2.gz DAKUIVWVAAJCAW-BBRMVZONSA-N 0 3 423.870 4.154 20 0 HIADHN O=C1[C@@H](NCc2cccc(OCc3ccc(F)cc3)c2)CCCN1CC(F)(F)F ZINC000499698681 908880537 /nfs/dbraw/zinc/88/05/37/908880537.db2.gz CTICIBNNEJBILS-IBGZPJMESA-N 0 3 410.411 4.048 20 0 HIADHN COc1ccccc1-c1csc([C@H]2CCCN(C[C@](C)(O)C(F)(F)F)C2)n1 ZINC000499732999 908893374 /nfs/dbraw/zinc/89/33/74/908893374.db2.gz JFNAJAYSGPVDKG-UGSOOPFHSA-N 0 3 400.466 4.311 20 0 HIADHN CCN(C(=O)Cc1cscc1Br)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000499734399 908894250 /nfs/dbraw/zinc/89/42/50/908894250.db2.gz XPRWTDNXXDPLTR-QGZVFWFLSA-N 0 3 407.377 4.176 20 0 HIADHN CCCOc1ccc(CNC(=O)N[C@@H](CN2CCCC2)c2ccccc2)cc1OC ZINC000499785386 908920451 /nfs/dbraw/zinc/92/04/51/908920451.db2.gz JBEKACNXPNRFLZ-NRFANRHFSA-N 0 3 411.546 4.120 20 0 HIADHN CCOC(=O)C1CCN(C(=O)CN(C)[C@H](c2ccc(Cl)cc2)C2CCCC2)CC1 ZINC000499911906 909028593 /nfs/dbraw/zinc/02/85/93/909028593.db2.gz OFDIEHGZXYDTGM-QFIPXVFZSA-N 0 3 420.981 4.305 20 0 HIADHN FC(F)(F)c1ccc(C[C@@]2(NCc3cncc(Br)c3)CCOC2)cc1 ZINC000513011765 921476717 /nfs/dbraw/zinc/47/67/17/921476717.db2.gz JIMWKOPRNGASEU-KRWDZBQOSA-N 0 3 415.253 4.354 20 0 HIADHN COc1ccc(CN2CCC[C@H](CNC(=O)c3ccccc3)C2)cc1OCC(C)C ZINC000513034404 921493779 /nfs/dbraw/zinc/49/37/79/921493779.db2.gz AAJUHRHJVWABAN-OAQYLSRUSA-N 0 3 410.558 4.372 20 0 HIADHN CCOc1cc2c(cc1[C@@H]1C[C@@H]1C(=O)NC[C@@H](c1ccc(C)cc1)N(C)C)O[C@H](C)C2 ZINC000499976319 909420464 /nfs/dbraw/zinc/42/04/64/909420464.db2.gz JRCDBOXMSHNAAK-BHVFFLMSSA-N 0 3 422.569 4.240 20 0 HIADHN Cc1nc(COc2ccc(CNCc3ccc(C[S@](C)=O)cc3)cc2)cs1 ZINC000513039585 921498222 /nfs/dbraw/zinc/49/82/22/921498222.db2.gz BPWIYUHFDMCZME-MHZLTWQESA-N 0 3 400.569 4.199 20 0 HIADHN Cc1noc(C)c1[C@@H](C)CNC(=O)NC[C@@H](c1ccc(CC(C)C)cc1)N(C)C ZINC000500101919 909580618 /nfs/dbraw/zinc/58/06/18/909580618.db2.gz JIXWTWWZKMKMJP-KKSFZXQISA-N 0 3 400.567 4.196 20 0 HIADHN COc1cccc(CN(C)C2CCN(C(=O)c3ccccc3)CC2)c1OC(F)F ZINC000513056171 921512687 /nfs/dbraw/zinc/51/26/87/921512687.db2.gz HQWMDKATOCMMKP-UHFFFAOYSA-N 0 3 404.457 4.033 20 0 HIADHN CCc1nnc(NC(=O)[C@@H](C)[C@H](C)NCc2cc(C(F)(F)F)ccc2F)s1 ZINC000513059890 921515030 /nfs/dbraw/zinc/51/50/30/921515030.db2.gz XMVPIKMRALFAPN-UWVGGRQHSA-N 0 3 404.433 4.011 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)CN2CCC[C@H](Cc3ccccc3)C2)c(OC)c1 ZINC000500220556 909711174 /nfs/dbraw/zinc/71/11/74/909711174.db2.gz SDRLQQXFNJWBRK-QPPBQGQZSA-N 0 3 422.569 4.322 20 0 HIADHN COc1ccc(OC)c([C@@H](C)NC(=O)[C@@H](C)N[C@@H](C)c2ccc(SC)cc2)c1 ZINC000500238481 909726987 /nfs/dbraw/zinc/72/69/87/909726987.db2.gz PUMVZRQSQCKMJW-ARFHVFGLSA-N 0 3 402.560 4.342 20 0 HIADHN CC(C)Oc1ccc([C@H](C)NC(=O)NCC2(N3CCSCC3)CCCC2)cc1 ZINC000500391514 909830339 /nfs/dbraw/zinc/83/03/39/909830339.db2.gz FVPKPOGRKMKZTH-SFHVURJKSA-N 0 3 405.608 4.196 20 0 HIADHN CC(C)N1CCC[C@@H](NC(=O)C(C)(C)c2csc(-c3c(F)cccc3F)n2)C1 ZINC000500490698 909887395 /nfs/dbraw/zinc/88/73/95/909887395.db2.gz WXRCOJQPKBXFRS-CQSZACIVSA-N 0 3 407.530 4.355 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N[C@@H](c1ccccn1)c1ccccc1OC)c1ccco1 ZINC000500534486 909911155 /nfs/dbraw/zinc/91/11/55/909911155.db2.gz HKXFWPNYVBGAPP-XTQVGHSUSA-N 0 3 422.529 4.201 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)N2CCC[C@H]2c2ccc(C)cc2)CC1 ZINC000500622737 909972904 /nfs/dbraw/zinc/97/29/04/909972904.db2.gz WTMSIFMHWHLTHR-VWLOTQADSA-N 0 3 420.601 4.179 20 0 HIADHN CC[C@H](NC(=O)NCc1ccc(CN2CCN(CC)CC2)cc1)c1ccc(C)cc1 ZINC000500625054 909974677 /nfs/dbraw/zinc/97/46/77/909974677.db2.gz CLUNACLBZLCHHZ-DEOSSOPVSA-N 0 3 408.590 4.083 20 0 HIADHN CCNC(=O)COc1ccc(CNCc2ccc(-c3cccc(C)c3)cc2)cc1OC ZINC000500742881 910052067 /nfs/dbraw/zinc/05/20/67/910052067.db2.gz BHSQYNRTIUHWOL-UHFFFAOYSA-N 0 3 418.537 4.475 20 0 HIADHN CN(Cc1ccc(Br)cc1F)C1CCN(C(=O)c2ccccc2)CC1 ZINC000513095690 921545967 /nfs/dbraw/zinc/54/59/67/921545967.db2.gz POUSSFIILVIVAU-UHFFFAOYSA-N 0 3 405.311 4.325 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)COc1ccc(-c2ccccc2)cc1Cl ZINC000500759781 910063904 /nfs/dbraw/zinc/06/39/04/910063904.db2.gz SQIILDAWNWEGCK-UHFFFAOYSA-N 0 3 423.944 4.371 20 0 HIADHN Cc1oc(-c2ccco2)nc1CC(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000500814308 910097768 /nfs/dbraw/zinc/09/77/68/910097768.db2.gz QJPMUOQNUPFBKC-UHFFFAOYSA-N 0 3 411.527 4.016 20 0 HIADHN c1ccc(CN2CCC(c3nc([C@H]4CN(Cc5ccccc5)CCO4)no3)CC2)cc1 ZINC000500835678 910113404 /nfs/dbraw/zinc/11/34/04/910113404.db2.gz KREMEUITNSISIC-HSZRJFAPSA-N 0 3 418.541 4.023 20 0 HIADHN Cc1cc(C)n(Cc2cccc(C(=O)N[C@H]3CCN([C@@H](C)c4ccccc4)C3)c2)n1 ZINC000500838113 910115608 /nfs/dbraw/zinc/11/56/08/910115608.db2.gz AIZGEHNJDLZKDF-RDPSFJRHSA-N 0 3 402.542 4.114 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)C2(c3ccc(Cl)cc3)CCOCC2)C1 ZINC000500852315 910124544 /nfs/dbraw/zinc/12/45/44/910124544.db2.gz MRUXLPMBNDEYNL-PGRDOPGGSA-N 0 3 412.961 4.340 20 0 HIADHN CC[C@@H](NCc1ccc(OC(F)(F)F)cc1)c1ccccc1OCC(=O)N(C)C ZINC000513109276 921556120 /nfs/dbraw/zinc/55/61/20/921556120.db2.gz ASQRKLYGQHMCQM-GOSISDBHSA-N 0 3 410.436 4.293 20 0 HIADHN COc1cc(CN2CCC(C(=O)Nc3ccc(F)cc3)CC2)ccc1OC(F)F ZINC000513111322 921559215 /nfs/dbraw/zinc/55/92/15/921559215.db2.gz CDLQONGIFYWLAT-UHFFFAOYSA-N 0 3 408.420 4.286 20 0 HIADHN Cc1cc(CN[C@H](C)c2cccc(N3CCCS3(=O)=O)c2)ccc1Br ZINC000501010363 910232445 /nfs/dbraw/zinc/23/24/45/910232445.db2.gz KKDHMJHWPOBMSB-OAHLLOKOSA-N 0 3 423.376 4.148 20 0 HIADHN COc1cccc(CNC(=O)NC[C@@H](c2ccccc2)N(C)C)c1OC1CCCC1 ZINC000501029648 910246705 /nfs/dbraw/zinc/24/67/05/910246705.db2.gz TYZVQASNJRAYCH-NRFANRHFSA-N 0 3 411.546 4.119 20 0 HIADHN CCOc1cc(CN2CCC3(C[C@H]3C(=O)N3CCCCC3)CC2)ccc1OC(F)F ZINC000501137267 910317533 /nfs/dbraw/zinc/31/75/33/910317533.db2.gz VNKZTGJDJXHFLW-SFHVURJKSA-N 0 3 422.516 4.301 20 0 HIADHN CN1CCCN(C(=O)Nc2cccc(NC(=O)c3cccc(C(F)(F)F)c3)c2)CC1 ZINC000501146897 910322830 /nfs/dbraw/zinc/32/28/30/910322830.db2.gz HKTPXKLRZZOXRB-UHFFFAOYSA-N 0 3 420.435 4.127 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1ccc(CN2CCCC2=O)cc1)c1ccsc1 ZINC000501186146 910352016 /nfs/dbraw/zinc/35/20/16/910352016.db2.gz IUMINYKWFMJTBN-FQEVSTJZSA-N 0 3 414.575 4.075 20 0 HIADHN COC(=O)c1cc(CNC(C)(C)c2ccc(Br)cc2)cc(C(=O)OC)c1 ZINC000501208562 910371182 /nfs/dbraw/zinc/37/11/82/910371182.db2.gz KGRXPGLCQFESHF-UHFFFAOYSA-N 0 3 420.303 4.047 20 0 HIADHN Cc1c(C(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)cnn1-c1ccc(Cl)cc1 ZINC000501228044 910387816 /nfs/dbraw/zinc/38/78/16/910387816.db2.gz OAYHANSAPRATNG-OXQOHEQNSA-N 0 3 408.933 4.399 20 0 HIADHN CC(C)(C)c1n[nH]cc1CN1CCC(C(=O)Nc2ccccc2Br)CC1 ZINC000513128166 921572379 /nfs/dbraw/zinc/57/23/79/921572379.db2.gz OHOBEAIAWVFDLM-UHFFFAOYSA-N 0 3 419.367 4.320 20 0 HIADHN CCN(C(=O)c1cnc(C2CCCC2)nc1N)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000501281210 910442862 /nfs/dbraw/zinc/44/28/62/910442862.db2.gz JPKAMFQDZGZSJL-FXAWDEMLSA-N 0 3 407.562 4.014 20 0 HIADHN CCN(C(=O)c1cnc(C2CCCC2)nc1N)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000501281218 910443344 /nfs/dbraw/zinc/44/33/44/910443344.db2.gz JPKAMFQDZGZSJL-XLIONFOSSA-N 0 3 407.562 4.014 20 0 HIADHN COC(=O)C1(c2ccccc2)CCN(CCOc2ccc(C(F)(F)F)cc2)CC1 ZINC000501294590 910450367 /nfs/dbraw/zinc/45/03/67/910450367.db2.gz KKYSXJXWATVWLW-UHFFFAOYSA-N 0 3 407.432 4.291 20 0 HIADHN CC[C@H](CNC(=O)Nc1ccc(C(=O)N(CC)CC)cc1)N1CCc2ccccc2C1 ZINC000501331712 910472756 /nfs/dbraw/zinc/47/27/56/910472756.db2.gz XACQSUWNHHRDPH-HSZRJFAPSA-N 0 3 422.573 4.127 20 0 HIADHN CCCOc1ccc(CN2CCC(C(=O)Nc3ccc(F)cc3)CC2)cc1OC ZINC000513143236 921581287 /nfs/dbraw/zinc/58/12/87/921581287.db2.gz BQGVBGVDRKWQFJ-UHFFFAOYSA-N 0 3 400.494 4.474 20 0 HIADHN CCC(CC)[C@@H]1C[C@@H](NC(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)CCO1 ZINC000501403793 910535494 /nfs/dbraw/zinc/53/54/94/910535494.db2.gz DOTAGTJPSDTZAS-WWNPGLIZSA-N 0 3 419.610 4.360 20 0 HIADHN CC[C@@H](CNC(=O)Nc1cc(OC)c(Cl)cc1OC)N1CCc2ccccc2C1 ZINC000501403993 910536714 /nfs/dbraw/zinc/53/67/14/910536714.db2.gz FAFFMZLVJZAESK-KRWDZBQOSA-N 0 3 417.937 4.316 20 0 HIADHN COc1cccc(C(=O)CCCC(=O)N[C@@H]2CCN(Cc3ccccc3)CC2(C)C)c1 ZINC000513152758 921587879 /nfs/dbraw/zinc/58/78/79/921587879.db2.gz GPHNZKRVQCGPAV-XMMPIXPASA-N 0 3 422.569 4.465 20 0 HIADHN O=C(NCc1nc(CN[C@H]2CCC[C@@H](c3cccnc3)C2)cs1)c1ccccc1 ZINC000501474627 910590008 /nfs/dbraw/zinc/59/00/08/910590008.db2.gz QVSKGDHRZGIIMS-QUCCMNQESA-N 0 3 406.555 4.284 20 0 HIADHN CC1CCN([C@H](CNC(=O)NC[C@@H](c2ccsc2)N(C)C)c2cccs2)CC1 ZINC000501520897 910629847 /nfs/dbraw/zinc/62/98/47/910629847.db2.gz XPSNYYUGRQNFKW-RBUKOAKNSA-N 0 3 420.648 4.185 20 0 HIADHN CC[C@H](CC(=O)N(C)C1CCN(CCc2ccccn2)CC1)c1ccc(OC)cc1 ZINC000501733511 910796600 /nfs/dbraw/zinc/79/66/00/910796600.db2.gz JHQJRNGEFQEEGD-HXUWFJFHSA-N 0 3 409.574 4.139 20 0 HIADHN CCc1ccc([C@H](CNC(=O)Nc2cc3c(cc2Cl)OCCO3)N(C)C)cc1 ZINC000501749990 910809264 /nfs/dbraw/zinc/80/92/64/910809264.db2.gz BPKXDWOMEOCOAW-SFHVURJKSA-N 0 3 403.910 4.098 20 0 HIADHN C[NH+](C)CCCC1CCN(Cc2nc(=O)c3c(-c4ccco4)csc3[n-]2)CC1 ZINC000501770344 910825381 /nfs/dbraw/zinc/82/53/81/910825381.db2.gz OLMORWORAAFWTD-UHFFFAOYSA-N 0 3 400.548 4.211 20 0 HIADHN C[C@@H]1CN(Cc2nc3c4ccccc4oc3c(=O)[nH]2)[C@@H](C)CN1Cc1ccccc1 ZINC000501784584 910839650 /nfs/dbraw/zinc/83/96/50/910839650.db2.gz HUJGTSJXBYZWSR-SJORKVTESA-N 0 3 402.498 4.176 20 0 HIADHN C[C@@H](NC(=O)N[C@H](CN1CCCC1)c1ccccc1)c1cccc(OC(F)F)c1 ZINC000501799050 910850563 /nfs/dbraw/zinc/85/05/63/910850563.db2.gz FPLBGHBXBDOXNN-OXQOHEQNSA-N 0 3 403.473 4.485 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N[C@@H]1CCCc2cn(C3CCCC3)nc21)c1ccco1 ZINC000501799316 910850593 /nfs/dbraw/zinc/85/05/93/910850593.db2.gz SAPKIAJDMLMNLD-DBVUQKKJSA-N 0 3 413.566 4.397 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cc(NC(=O)N(C)C)ccc1Cl)c1ccsc1 ZINC000501807590 910858249 /nfs/dbraw/zinc/85/82/49/910858249.db2.gz BGLFZPDIINKMLM-SFHVURJKSA-N 0 3 422.982 4.308 20 0 HIADHN COc1ccc([C@H]2CCCN2C(=O)N[C@H](CN2CCCC2)c2ccccc2)c(OC)c1 ZINC000501806503 910858266 /nfs/dbraw/zinc/85/82/66/910858266.db2.gz XVZRERAYRBCJSH-DHIUTWEWSA-N 0 3 423.557 4.387 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)N[C@@H](c1ccccc1)c1ccccn1 ZINC000501807801 910858448 /nfs/dbraw/zinc/85/84/48/910858448.db2.gz VMGGZBCUCCEHNJ-RPWUZVMVSA-N 0 3 400.526 4.307 20 0 HIADHN COc1ccc(OC(F)F)c(NC(=O)N[C@@H](CN2CCCC2)c2ccccc2)c1 ZINC000501809147 910859744 /nfs/dbraw/zinc/85/97/44/910859744.db2.gz HOZCSNHJJNRDCS-SFHVURJKSA-N 0 3 405.445 4.255 20 0 HIADHN CC(C)[C@H](NC(=O)N[C@H](CN1CCCC1)c1ccccc1)c1ccc2c(c1)OCCO2 ZINC000501853524 910885919 /nfs/dbraw/zinc/88/59/19/910885919.db2.gz UXZKQCKVAZXCDM-QPPBQGQZSA-N 0 3 423.557 4.291 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N3CCC[C@H]3Cc3ccc(F)cc3)cc2)CC1 ZINC000501883998 910902998 /nfs/dbraw/zinc/90/29/98/910902998.db2.gz VNYRRGXVLXNJBT-DEOSSOPVSA-N 0 3 409.549 4.203 20 0 HIADHN CCN(Cc1ccccc1)C(=O)CN[C@@]1(Cc2ccc(C(F)(F)F)cc2)CCOC1 ZINC000513196036 921615986 /nfs/dbraw/zinc/61/59/86/921615986.db2.gz LTECXVATLONLIZ-JOCHJYFZSA-N 0 3 420.475 4.045 20 0 HIADHN CCN(C(=O)c1ccc2c(c1)NC(=O)CS2)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000501953996 910941713 /nfs/dbraw/zinc/94/17/13/910941713.db2.gz CUKUVQCTWBOEJW-VQIMIIECSA-N 0 3 409.555 4.028 20 0 HIADHN CCN(C(=O)c1ccc(-n2nc(C)cc2C)nc1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000501955973 910943112 /nfs/dbraw/zinc/94/31/12/910943112.db2.gz IBGPLQUSQZXESN-NZQKXSOJSA-N 0 3 417.557 4.182 20 0 HIADHN C[C@H](NCC1(c2c(F)cccc2F)CCCC1)C(=O)Nc1ccc2c(c1)OCCO2 ZINC000501987371 910965031 /nfs/dbraw/zinc/96/50/31/910965031.db2.gz VSWPKPURGLSPTH-HNNXBMFYSA-N 0 3 416.468 4.165 20 0 HIADHN COc1cccc([C@@H](C)C(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)c1 ZINC000502019746 910980971 /nfs/dbraw/zinc/98/09/71/910980971.db2.gz RXYJROIIUBMXBS-MRXNPFEDSA-N 0 3 408.464 4.408 20 0 HIADHN CC(C)N(C(=O)[C@H](C)NCc1ccccc1-c1ccc(Cn2cncn2)cc1)C(C)C ZINC000513217506 921633067 /nfs/dbraw/zinc/63/30/67/921633067.db2.gz HFECEQYVEYKSRW-FQEVSTJZSA-N 0 3 419.573 4.117 20 0 HIADHN CN(C(=O)Nc1cn(C)nc1-c1ccccc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000502209952 911155790 /nfs/dbraw/zinc/15/57/90/911155790.db2.gz UBSYGPKGFSHXNR-NRFANRHFSA-N 0 3 403.530 4.215 20 0 HIADHN COc1cccc([C@@H](CNC(=O)C[C@H](C)c2ccc(F)cc2F)N2CCCC2)c1 ZINC000502269635 911218832 /nfs/dbraw/zinc/21/88/32/911218832.db2.gz PIQXNKHSISCBEA-KSFYIVLOSA-N 0 3 402.485 4.420 20 0 HIADHN CC(=O)Nc1c[nH]nc1[C@H]1CCCN(Cc2ccc(OCc3ccc(F)cc3)cc2)C1 ZINC000502298481 911258820 /nfs/dbraw/zinc/25/88/20/911258820.db2.gz FFRHWNKCRMKEAN-FQEVSTJZSA-N 0 3 422.504 4.466 20 0 HIADHN CC(=O)Nc1c[nH]nc1[C@@H]1CCCN(Cc2ccc(OCc3ccc(F)cc3)cc2)C1 ZINC000502298482 911259540 /nfs/dbraw/zinc/25/95/40/911259540.db2.gz FFRHWNKCRMKEAN-HXUWFJFHSA-N 0 3 422.504 4.466 20 0 HIADHN O=C(NC[C@H]1CCCN1Cc1ccccc1)c1ccc(COc2ccc(F)cc2)o1 ZINC000513239487 921650342 /nfs/dbraw/zinc/65/03/42/921650342.db2.gz YUIPIOFJVUHPHV-HXUWFJFHSA-N 0 3 408.473 4.392 20 0 HIADHN Cc1cc(C)n(-c2ccc(C(=O)N(CCCc3ccccc3)CCN(C)C)cc2)n1 ZINC000502353886 911335073 /nfs/dbraw/zinc/33/50/73/911335073.db2.gz SPDNOKLTMCYLHN-UHFFFAOYSA-N 0 3 404.558 4.126 20 0 HIADHN Cc1cccc(-c2nc(CC(=O)NC[C@H]3CCCN3Cc3ccccc3)cs2)c1 ZINC000513243574 921653347 /nfs/dbraw/zinc/65/33/47/921653347.db2.gz IUXXHDIUHSFHEL-JOCHJYFZSA-N 0 3 405.567 4.442 20 0 HIADHN Cc1cccc(-c2nc(CC(=O)NC[C@@H]3CCCN3Cc3ccccc3)cs2)c1 ZINC000513243575 921653847 /nfs/dbraw/zinc/65/38/47/921653847.db2.gz IUXXHDIUHSFHEL-QFIPXVFZSA-N 0 3 405.567 4.442 20 0 HIADHN Cc1ccc(C)c(OCCN2CCC[C@H](c3n[nH]cc3NC(=O)C3CCCC3)C2)c1 ZINC000502383297 911371479 /nfs/dbraw/zinc/37/14/79/911371479.db2.gz ZMSAXMAZRWTZKX-FQEVSTJZSA-N 0 3 410.562 4.414 20 0 HIADHN O=C(NCCc1ccc(F)cc1Cl)Nc1ccc(CCN2CCSCC2)cc1 ZINC000502491882 911491883 /nfs/dbraw/zinc/49/18/83/911491883.db2.gz BPJZBUYBFVXFHG-UHFFFAOYSA-N 0 3 421.969 4.435 20 0 HIADHN CCN(CC)[C@H](CNC(=O)[C@@H](C)n1nc(C)cc1C)c1ccc(C(F)(F)F)cc1 ZINC000502506920 911510938 /nfs/dbraw/zinc/51/09/38/911510938.db2.gz LKBLRUZULUYANP-VQIMIIECSA-N 0 3 410.484 4.279 20 0 HIADHN CCN(CC)[C@H](CNC(=O)[C@@H]1Cc2ccccc2O1)c1ccc(C(F)(F)F)cc1 ZINC000502515625 911519118 /nfs/dbraw/zinc/51/91/18/911519118.db2.gz JSUHCHCURWXKFW-QUCCMNQESA-N 0 3 406.448 4.208 20 0 HIADHN COCCN1CCC(NC(=O)N[C@H](c2ccccc2)[C@@H]2CCCc3ccccc32)CC1 ZINC000502564203 911571448 /nfs/dbraw/zinc/57/14/48/911571448.db2.gz UJVXKYGMJWTWIL-JWQCQUIFSA-N 0 3 421.585 4.258 20 0 HIADHN CC(C)(CNC(=O)CCCOc1ccc(F)cc1F)N1CCc2ccccc2C1 ZINC000502566322 911571536 /nfs/dbraw/zinc/57/15/36/911571536.db2.gz QQVGCLGFMYJTBO-UHFFFAOYSA-N 0 3 402.485 4.077 20 0 HIADHN CC[C@@H](NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1)c1ccccc1OC(F)F ZINC000502646232 911683503 /nfs/dbraw/zinc/68/35/03/911683503.db2.gz BHQVCRPEQRZFMD-IEBWSBKVSA-N 0 3 403.473 4.313 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)CCc1cc2ccccc2[nH]c1=O ZINC000502836501 911848463 /nfs/dbraw/zinc/84/84/63/911848463.db2.gz VPXBETWQPNFLCK-UHFFFAOYSA-N 0 3 411.933 4.117 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCC[C@H](COC)C1)c1ccc(C(F)(F)F)cc1 ZINC000502844456 911854577 /nfs/dbraw/zinc/85/45/77/911854577.db2.gz ACQAOZGDIXCQJH-QFBILLFUSA-N 0 3 415.500 4.156 20 0 HIADHN C[C@@]1(CNC(=O)N(CCN2CCCC2)Cc2ccc(Cl)c(Cl)c2)CCOC1 ZINC000502888893 911885442 /nfs/dbraw/zinc/88/54/42/911885442.db2.gz QALQRDLOVKUGHY-FQEVSTJZSA-N 0 3 414.377 4.027 20 0 HIADHN CCOc1ccc(SCC(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)cc1 ZINC000502887342 911885649 /nfs/dbraw/zinc/88/56/49/911885649.db2.gz DMTNJLYVSOHIOX-UHFFFAOYSA-N 0 3 413.587 4.347 20 0 HIADHN CC1(C)CN(C(=O)NC[C@@H]2CN(Cc3ccccc3)CCCO2)[C@H]1c1cccs1 ZINC000502910234 911897444 /nfs/dbraw/zinc/89/74/44/911897444.db2.gz KKJFHISILIPQEZ-CTNGQTDRSA-N 0 3 413.587 4.132 20 0 HIADHN CCc1c(C(=O)NC[C@H](c2ccc(CC)cc2)N(C)C)cnn1Cc1ccccc1 ZINC000513312008 921705239 /nfs/dbraw/zinc/70/52/39/921705239.db2.gz YNRYCWDMEYHFIW-XMMPIXPASA-N 0 3 404.558 4.089 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cnn(Cc2ccccc2)c1C)c1cccc(OC)c1 ZINC000513314079 921706422 /nfs/dbraw/zinc/70/64/22/921706422.db2.gz AQLXEMNDQWHRNF-DEOSSOPVSA-N 0 3 420.557 4.061 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)N[C@@H](c2ccccc2)c2ccncc2)N(C)C)cc1 ZINC000503024790 911995244 /nfs/dbraw/zinc/99/52/44/911995244.db2.gz OHJOFTFYPMPCPS-RPWUZVMVSA-N 0 3 402.542 4.336 20 0 HIADHN CCC[C@H]1C[C@H](C(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)CCO1 ZINC000503068471 912033838 /nfs/dbraw/zinc/03/38/38/912033838.db2.gz KESBTQBZKPWSLR-MJGOQNOKSA-N 0 3 400.485 4.191 20 0 HIADHN Cc1nccn1CCCN(C)CC(=O)Nc1nc(-c2c(C)cc(C)cc2C)cs1 ZINC000503076082 912046242 /nfs/dbraw/zinc/04/62/42/912046242.db2.gz WKZHIONUYVFQIQ-UHFFFAOYSA-N 0 3 411.575 4.201 20 0 HIADHN Cc1cccc2c1OCC[C@H]2NC(=O)NC[C@H](c1ccc(OC(C)C)cc1)N(C)C ZINC000503142457 912105330 /nfs/dbraw/zinc/10/53/30/912105330.db2.gz OSFQYFNPPVOHQF-FGZHOGPDSA-N 0 3 411.546 4.208 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)c1cnc(-c2ccc(F)c(F)c2)s1 ZINC000503159938 912127433 /nfs/dbraw/zinc/12/74/33/912127433.db2.gz ZHHFIXIDTJRAAM-UHFFFAOYSA-N 0 3 419.472 4.431 20 0 HIADHN Cc1ccn(C2CCN(C(=O)NC[C@@H](c3ccc(CC(C)C)cc3)N(C)C)CC2)n1 ZINC000513340717 921725325 /nfs/dbraw/zinc/72/53/25/921725325.db2.gz MYJRNVSREKKHJU-QHCPKHFHSA-N 0 3 411.594 4.039 20 0 HIADHN CCOC1CC2(C1)CCN(C(=O)NC[C@H](c1ccc(CC(C)C)cc1)N(C)C)C2 ZINC000513346358 921728955 /nfs/dbraw/zinc/72/89/55/921728955.db2.gz UBBANIPWQBBTTL-XERBYJISSA-N 0 3 401.595 4.088 20 0 HIADHN Cc1ccc(NC(=O)C2CC2)cc1NC(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000506296237 914891366 /nfs/dbraw/zinc/89/13/66/914891366.db2.gz XNRWEGFFCYHMFU-LAUBAEHRSA-N 0 3 406.530 4.301 20 0 HIADHN CCOC1CC(CN[C@@H](c2ccc(Cl)cc2)c2cccc(S(C)(=O)=O)c2)C1 ZINC000506296173 914891874 /nfs/dbraw/zinc/89/18/74/914891874.db2.gz XISXBXIKXNYDPN-ZJKHUDDUSA-N 0 3 407.963 4.238 20 0 HIADHN COc1cc(CN2CCC[C@H](C(=O)Nc3ccccc3)C2)ccc1OCC(F)(F)F ZINC000506312182 914899669 /nfs/dbraw/zinc/89/96/69/914899669.db2.gz YKBCOCPGRZONHD-KRWDZBQOSA-N 0 3 422.447 4.487 20 0 HIADHN Cc1cc(NC(=O)C2CCN(Cc3ccc(-c4c(F)cccc4F)o3)CC2)no1 ZINC000506311353 914899900 /nfs/dbraw/zinc/89/99/00/914899900.db2.gz CRMUDYJURVWKDE-UHFFFAOYSA-N 0 3 401.413 4.372 20 0 HIADHN COC(=O)c1cc2c(o1)c(OC)ccc2CN1CCC(OCc2ccccc2)CC1 ZINC000506312480 914903705 /nfs/dbraw/zinc/90/37/05/914903705.db2.gz LVXCIQZMPCTIJY-UHFFFAOYSA-N 0 3 409.482 4.409 20 0 HIADHN Clc1ccc(CN2CCC(CCN3CCOCC3)CC2)c(Br)c1 ZINC000506440256 915041021 /nfs/dbraw/zinc/04/10/21/915041021.db2.gz MVYAAZGTEYPURL-UHFFFAOYSA-N 0 3 401.776 4.037 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)Nc2cccc(CN3CCCCC3=O)c2)C1 ZINC000506488769 915095208 /nfs/dbraw/zinc/09/52/08/915095208.db2.gz SKZALVXOIQPASD-CVDCTZTESA-N 0 3 420.557 4.156 20 0 HIADHN COc1ccc(Br)c(NC(=O)N[C@H](CN2CCCC2)c2ccccc2)c1 ZINC000506515565 915144742 /nfs/dbraw/zinc/14/47/42/915144742.db2.gz IATMZMPLIAVLPT-LJQANCHMSA-N 0 3 418.335 4.416 20 0 HIADHN COc1ccc(Br)c(NC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000506534932 915180469 /nfs/dbraw/zinc/18/04/69/915180469.db2.gz XXSMUFSFJQHNJO-INIZCTEOSA-N 0 3 418.335 4.244 20 0 HIADHN Cc1noc(C)c1[C@H](C)CNC(=O)N[C@@H](CN1CCc2ccccc2C1)C(C)(C)C ZINC000506610509 915263884 /nfs/dbraw/zinc/26/38/84/915263884.db2.gz AKIOOKBXUZTMFI-IERDGZPVSA-N 0 3 412.578 4.167 20 0 HIADHN NC(=O)[C@H](Cc1ccc(Cl)cc1)NC[C@H](OCC1CC1)c1ccc(Cl)cc1 ZINC000506617040 915273004 /nfs/dbraw/zinc/27/30/04/915273004.db2.gz NDXNCNGVPVRNCJ-PMACEKPBSA-N 0 3 407.341 4.147 20 0 HIADHN CC[C@H](N[C@H](C)C(=O)Nc1ccc(OC(F)F)cc1)c1ccc(OC)c(OC)c1 ZINC000506661782 915336437 /nfs/dbraw/zinc/33/64/37/915336437.db2.gz JLYRJDBJJOKTBQ-DYVFJYSZSA-N 0 3 408.445 4.373 20 0 HIADHN COC(=O)C1(c2ccccc2)CCN(Cc2c[nH]nc2-c2cccc(Cl)c2)CC1 ZINC000506674785 915350624 /nfs/dbraw/zinc/35/06/24/915350624.db2.gz LZIJSAWHQSXLRY-UHFFFAOYSA-N 0 3 409.917 4.437 20 0 HIADHN Cc1nc2sc(-c3ccccc3)cc2c(NCCCN2CCC[C@H]2C(=O)N(C)C)n1 ZINC000506752425 915448450 /nfs/dbraw/zinc/44/84/50/915448450.db2.gz FVTMMZWXWUGCTC-IBGZPJMESA-N 0 3 423.586 4.021 20 0 HIADHN CCN(Cc1ccc(OC)c(OCc2cccnc2)c1)C[C@@H]1COc2ccccc2O1 ZINC000506753396 915448618 /nfs/dbraw/zinc/44/86/18/915448618.db2.gz QVVCFXHCOJFPFU-OAQYLSRUSA-N 0 3 420.509 4.331 20 0 HIADHN COc1ccccc1O[C@@H]1CCCN(CCc2nc(-c3ccc(Cl)cc3)no2)C1 ZINC000513406605 921774130 /nfs/dbraw/zinc/77/41/30/921774130.db2.gz VAAXEYPXFBVDET-GOSISDBHSA-N 0 3 413.905 4.485 20 0 HIADHN C[C@H](NCC(=O)N1CCc2sccc2[C@H]1c1ccccc1)c1ccc2n[nH]cc2c1 ZINC000513410815 921779012 /nfs/dbraw/zinc/77/90/12/921779012.db2.gz HIOBFPCKAICBAZ-UPCLLVRISA-N 0 3 416.550 4.449 20 0 HIADHN C[C@@H](CNC(=O)Nc1ccc(F)cc1OCC(F)(F)F)N(C)Cc1ccccc1 ZINC000506863651 915651193 /nfs/dbraw/zinc/65/11/93/915651193.db2.gz LZWVYWLFTOJRHX-AWEZNQCLSA-N 0 3 413.415 4.409 20 0 HIADHN FC(F)(F)c1cc(CN2CCC(CN3CCOCC3)CC2)cc(C(F)(F)F)c1 ZINC000506911145 915709785 /nfs/dbraw/zinc/70/97/85/915709785.db2.gz JMONDZQMVDQJCE-UHFFFAOYSA-N 0 3 410.402 4.268 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N(CCc1cccc(F)c1)C1CC1 ZINC000506915232 915713592 /nfs/dbraw/zinc/71/35/92/915713592.db2.gz GEEIUTNOASTHIR-HXUWFJFHSA-N 0 3 401.551 4.441 20 0 HIADHN CCOC(=O)c1c2ccccc2sc1NC(=O)N(CCN(C)C)Cc1ccco1 ZINC000506988088 915800771 /nfs/dbraw/zinc/80/07/71/915800771.db2.gz IFILXCWKBJLMOQ-UHFFFAOYSA-N 0 3 415.515 4.267 20 0 HIADHN CCCCNC(=O)C1CCN(Cc2cn(Cc3ccccc3)nc2C(C)(C)C)CC1 ZINC000507020914 915826701 /nfs/dbraw/zinc/82/67/01/915826701.db2.gz IMNIWCXCSKILME-UHFFFAOYSA-N 0 3 410.606 4.357 20 0 HIADHN CC(C)(COCc1ccccc1)NC(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000507076035 915856164 /nfs/dbraw/zinc/85/61/64/915856164.db2.gz XMAKJPJCPDNLGQ-LJQANCHMSA-N 0 3 401.576 4.180 20 0 HIADHN CCCN(C(=O)NC[C@H](c1ccccc1)N(C)C)[C@H](C)CC(=O)Nc1ccccc1 ZINC000507087367 915861655 /nfs/dbraw/zinc/86/16/55/915861655.db2.gz JZGYWZFAXUMPON-DENIHFKCSA-N 0 3 410.562 4.128 20 0 HIADHN COc1ccc(CN2CCC[C@@H](C(=O)NCC3CC3)C2)cc1OCc1ccccc1 ZINC000507096850 915867015 /nfs/dbraw/zinc/86/70/15/915867015.db2.gz AUIODSKJFBXYTH-JOCHJYFZSA-N 0 3 408.542 4.012 20 0 HIADHN C[C@@H]1C[C@H]1C(=O)Nc1ccc(C(=O)N2CCCN(CCCc3ccccc3)CC2)cc1 ZINC000507147659 915890739 /nfs/dbraw/zinc/89/07/39/915890739.db2.gz CPUKZIZHAIASBD-HYBUGGRVSA-N 0 3 419.569 4.062 20 0 HIADHN COc1ccccc1C[C@@H](C)N(Cc1ccccc1)Cc1cc(=O)n2ccccc2n1 ZINC000507218773 915970448 /nfs/dbraw/zinc/97/04/48/915970448.db2.gz MEPVUOPNOJFCMO-HXUWFJFHSA-N 0 3 413.521 4.337 20 0 HIADHN CN(CCC(=O)Nc1ccc(Br)cc1)C[C@H]1OCCc2ccccc21 ZINC000507259152 916019312 /nfs/dbraw/zinc/01/93/12/916019312.db2.gz PZNQCSJELTVEJD-LJQANCHMSA-N 0 3 403.320 4.024 20 0 HIADHN CC(C)[C@H](C)NC(=O)C1CCN(Cc2ccc(C(=O)Nc3ccccc3)cc2)CC1 ZINC000507353772 916107525 /nfs/dbraw/zinc/10/75/25/916107525.db2.gz BIQLDQTUWAMWNR-IBGZPJMESA-N 0 3 407.558 4.312 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)NCCOc2cccc(C(C)(C)C)c2)CC1 ZINC000507358919 916112368 /nfs/dbraw/zinc/11/23/68/916112368.db2.gz OEAYNJQANRFNJI-UHFFFAOYSA-N 0 3 413.562 4.262 20 0 HIADHN C[C@H]1CCCCN1CCNC(=O)c1cccnc1Oc1cccc(Br)c1 ZINC000507371530 916129275 /nfs/dbraw/zinc/12/92/75/916129275.db2.gz MCHMOLFAXLRNCB-HNNXBMFYSA-N 0 3 418.335 4.241 20 0 HIADHN C[C@@H]1CCCCN1CCNC(=O)c1cccnc1Oc1cccc(Br)c1 ZINC000507371533 916129897 /nfs/dbraw/zinc/12/98/97/916129897.db2.gz MCHMOLFAXLRNCB-OAHLLOKOSA-N 0 3 418.335 4.241 20 0 HIADHN O=C1NCCCC[C@@H]1N[C@H]1CCCc2nc(-c3ccc(Br)cc3)sc21 ZINC000507410665 916183532 /nfs/dbraw/zinc/18/35/32/916183532.db2.gz YZHTXYLENLQKRW-HOCLYGCPSA-N 0 3 420.376 4.208 20 0 HIADHN O=C1NCCCC[C@@H]1N[C@@H]1CCCc2nc(-c3ccccc3Br)sc21 ZINC000507441565 916210632 /nfs/dbraw/zinc/21/06/32/916210632.db2.gz ICPNBVFRSXCLPI-ZBFHGGJFSA-N 0 3 420.376 4.208 20 0 HIADHN COCCSc1ccc([C@H](C)N[C@@H](C)C(=O)Nc2cccc(NC(C)=O)c2)cc1 ZINC000507451859 916222419 /nfs/dbraw/zinc/22/24/19/916222419.db2.gz SBGRLLRJQBWTTH-HOTGVXAUSA-N 0 3 415.559 4.061 20 0 HIADHN COCCSc1ccc([C@@H](C)N[C@@H](C)C(=O)NCc2ccc(Cl)cc2)cc1 ZINC000507465908 916232365 /nfs/dbraw/zinc/23/23/65/916232365.db2.gz RDSPKUWRHNXKJU-CVEARBPZSA-N 0 3 406.979 4.434 20 0 HIADHN CN1CCC[C@@H](CNC(=O)c2csc(-c3ncccc3F)n2)[C@H]1c1cccs1 ZINC000507545364 916301824 /nfs/dbraw/zinc/30/18/24/916301824.db2.gz FJOIEQBBRSLKSG-UGSOOPFHSA-N 0 3 416.547 4.219 20 0 HIADHN CC[C@H]1C[C@@]1(NC(=O)NCc1ccccc1CN1CCC(O)CC1)c1cccc(C)c1 ZINC000507581706 916336712 /nfs/dbraw/zinc/33/67/12/916336712.db2.gz CWXZJKCZSKYAQS-NVQXNPDNSA-N 0 3 421.585 4.076 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3cc4nc(C)ccc4o3)c(OCC)c2)CC1 ZINC000507593421 916346924 /nfs/dbraw/zinc/34/69/24/916346924.db2.gz MJEKEHVVEBCJAZ-UHFFFAOYSA-N 0 3 422.529 4.319 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3ccc(F)c(OC)c3)c(OCC)c2)CC1 ZINC000507603899 916357720 /nfs/dbraw/zinc/35/77/20/916357720.db2.gz GMNJVOAYZYSMCS-UHFFFAOYSA-N 0 3 415.509 4.017 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)CC3(C(F)(F)F)CC3)c(OCC)c2)CC1 ZINC000507604696 916360464 /nfs/dbraw/zinc/36/04/64/916360464.db2.gz VVLJWMFIZFYNKW-UHFFFAOYSA-N 0 3 413.484 4.288 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)Cc3ccsc3C)c(OCC)c2)CC1 ZINC000507608720 916364808 /nfs/dbraw/zinc/36/48/08/916364808.db2.gz WXSNXQZIPKFZBI-UHFFFAOYSA-N 0 3 401.576 4.168 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3ccc4nc(C)oc4c3)c(OCC)c2)CC1 ZINC000507623488 916383239 /nfs/dbraw/zinc/38/32/39/916383239.db2.gz VTSZOCBKYILBPC-UHFFFAOYSA-N 0 3 422.529 4.319 20 0 HIADHN C[C@H](OC[C@@H](O)CN(Cc1ccccc1)C[C@H]1CCCO1)c1ccc(Cl)cc1 ZINC000507702025 916485076 /nfs/dbraw/zinc/48/50/76/916485076.db2.gz LVRJPJJJVIEVTO-OFAXGOBFSA-N 0 3 403.950 4.460 20 0 HIADHN COc1ccccc1C(C)(C)NCC(=O)Nc1ccc2nc(C(F)(F)F)[nH]c2c1 ZINC000507788556 916574565 /nfs/dbraw/zinc/57/45/65/916574565.db2.gz NSKYROHRAGHIQD-UHFFFAOYSA-N 0 3 406.408 4.054 20 0 HIADHN O=S1(=O)CCC(CCNCc2nc(-c3cc(Cl)ccc3Cl)cs2)CC1 ZINC000507834540 916637044 /nfs/dbraw/zinc/63/70/44/916637044.db2.gz SMIFGXCPHMUKMW-UHFFFAOYSA-N 0 3 419.399 4.421 20 0 HIADHN COc1ccc(C)cc1NC(=O)[C@@H](NCCc1c[nH]c2ncccc12)c1ccccc1 ZINC000507842106 916650775 /nfs/dbraw/zinc/65/07/75/916650775.db2.gz REPNSJKQGSHVTQ-QHCPKHFHSA-N 0 3 414.509 4.392 20 0 HIADHN CCCN(CC(=O)NC[C@@H](c1c[nH]c2ccccc21)c1ccc(OC)cc1)C1CC1 ZINC000507859958 916689876 /nfs/dbraw/zinc/68/98/76/916689876.db2.gz LHONASSJUKFCHR-JOCHJYFZSA-N 0 3 405.542 4.299 20 0 HIADHN CC[NH+](CC)CC1CCN(Cc2nc(=O)c3c(-c4ccco4)csc3[n-]2)CC1 ZINC000507979164 916826836 /nfs/dbraw/zinc/82/68/36/916826836.db2.gz LZQYRLCYZQHLAR-UHFFFAOYSA-N 0 3 400.548 4.211 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CN1CCC[C@@H](C(=O)Nc2ccc(C)cn2)C1 ZINC000508012051 916850480 /nfs/dbraw/zinc/85/04/80/916850480.db2.gz CGSIJLZIKKKYDY-HXUWFJFHSA-N 0 3 403.530 4.043 20 0 HIADHN Cc1ccc(NC(=O)[C@@H]2CCCN(Cc3ccccc3OCc3ccncc3)C2)nc1 ZINC000508016865 916852963 /nfs/dbraw/zinc/85/29/63/916852963.db2.gz ROUGNZHDMGYMOS-JOCHJYFZSA-N 0 3 416.525 4.215 20 0 HIADHN Cc1cccc(NC(=O)[C@H]2CCCN(Cc3ccc(-c4ccncc4)cc3F)C2)n1 ZINC000508037953 916867569 /nfs/dbraw/zinc/86/75/69/916867569.db2.gz BSSBBWXQTPTWIW-NRFANRHFSA-N 0 3 404.489 4.442 20 0 HIADHN CC[C@@H](C)c1ccccc1OCC(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000508071666 916893616 /nfs/dbraw/zinc/89/36/16/916893616.db2.gz OOIUJDANWCUBQX-LJQANCHMSA-N 0 3 410.558 4.422 20 0 HIADHN C[C@@H](Oc1cccc(Cl)c1)c1nnc(N2CCN(C3CCCCC3)CC2)n1C ZINC000508429468 917217745 /nfs/dbraw/zinc/21/77/45/917217745.db2.gz URHRIKGTEQPUSY-MRXNPFEDSA-N 0 3 403.958 4.063 20 0 HIADHN CCCN(C(=O)c1cc(C)nc2onc(C)c21)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000508459299 917243355 /nfs/dbraw/zinc/24/33/55/917243355.db2.gz UPWSVSQPNFOJGZ-FQEVSTJZSA-N 0 3 406.530 4.356 20 0 HIADHN CC(C)(C)OC(=O)c1ccc(CNc2ccc(C(=O)NCCN3CCCC3)cc2)cc1 ZINC000508491875 917277397 /nfs/dbraw/zinc/27/73/97/917277397.db2.gz VRDTYGPWOHUNEF-UHFFFAOYSA-N 0 3 423.557 4.080 20 0 HIADHN CC[C@H](C)NC(=O)[C@@H]1C[C@H](C)N(CC(=O)Nc2cccc(C)c2C)[C@H]2CCCC[C@@H]12 ZINC000508673615 917437455 /nfs/dbraw/zinc/43/74/55/917437455.db2.gz YLYQPOAWXGVVRP-YJPCQTTLSA-N 0 3 413.606 4.426 20 0 HIADHN CC[C@H](C)NC(=O)[C@@H]1C[C@H](C)N(CC(=O)Nc2cccc(C)c2C)[C@@H]2CCCC[C@H]12 ZINC000508673613 917438041 /nfs/dbraw/zinc/43/80/41/917438041.db2.gz YLYQPOAWXGVVRP-HUTZZIEHSA-N 0 3 413.606 4.426 20 0 HIADHN Brc1ccc2c(c1)[C@H](NCc1ccccc1Cn1cncn1)CCCO2 ZINC000508722865 917484550 /nfs/dbraw/zinc/48/45/50/917484550.db2.gz GDCXZLHGIUPZHL-LJQANCHMSA-N 0 3 413.319 4.092 20 0 HIADHN O=C(Nc1ccccc1)NC1CCN(CCOc2cccc(Br)c2)CC1 ZINC000508726706 917488358 /nfs/dbraw/zinc/48/83/58/917488358.db2.gz KQAJNZNXZDNOOZ-UHFFFAOYSA-N 0 3 418.335 4.114 20 0 HIADHN COc1cccc(C2(F)CCN(C(=O)N[C@@H](C)[C@H](c3ccccc3)N(C)C)CC2)c1 ZINC000508842552 917594642 /nfs/dbraw/zinc/59/46/42/917594642.db2.gz BZBGKFQFTNOSJM-PGRDOPGGSA-N 0 3 413.537 4.357 20 0 HIADHN C[C@@H](NC(=O)N1CCC(OC2CCC(C)CC2)CC1)[C@H](c1ccccc1)N(C)C ZINC000508850588 917602218 /nfs/dbraw/zinc/60/22/18/917602218.db2.gz FRCSQSBBEDCFLS-QWTQLVPVSA-N 0 3 401.595 4.447 20 0 HIADHN C[C@@H](NC(=O)Nc1ccc(NC(=O)c2ccco2)cc1)[C@H](c1ccccc1)N(C)C ZINC000508865072 917620420 /nfs/dbraw/zinc/62/04/20/917620420.db2.gz NVSFNTBNNPPTRO-IIBYNOLFSA-N 0 3 406.486 4.345 20 0 HIADHN C[C@H](NC(=O)N1CCn2cccc2[C@@H]1c1ccccc1)[C@@H](c1ccccc1)N(C)C ZINC000508873352 917626662 /nfs/dbraw/zinc/62/66/62/917626662.db2.gz TUGYBERRIIEZAG-IGKWTDBASA-N 0 3 402.542 4.294 20 0 HIADHN C[C@H](NC(=O)N(C)Cc1cc(Br)cs1)[C@@H](c1ccccc1)N(C)C ZINC000508875259 917628970 /nfs/dbraw/zinc/62/89/70/917628970.db2.gz BUVNMISVPXDXIL-GUYCJALGSA-N 0 3 410.381 4.343 20 0 HIADHN C[C@@H](NC(=O)Nc1ccc(Cl)c(C(=O)NC2CC2)c1)[C@@H](c1ccccc1)N(C)C ZINC000508878175 917630327 /nfs/dbraw/zinc/63/03/27/917630327.db2.gz GRRXMTZXTFBZML-VLIAUNLRSA-N 0 3 414.937 4.045 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1c2ccccc2CC[C@H]1n1ccnc1)[C@H](c1ccccc1)N(C)C ZINC000508888158 917642229 /nfs/dbraw/zinc/64/22/29/917642229.db2.gz CAQSSTHBQQEUMC-LWZKNFMGSA-N 0 3 417.557 4.102 20 0 HIADHN C[C@@H](NC(=O)Nc1ccccc1N1C[C@@H](C)O[C@H](C)C1)[C@@H](c1ccccc1)N(C)C ZINC000508895266 917650597 /nfs/dbraw/zinc/65/05/97/917650597.db2.gz LFKYKZVBHFWNHZ-ZQAYVECASA-N 0 3 410.562 4.113 20 0 HIADHN C[C@@H](NC(=O)N1CCC(C(F)(F)F)(C(F)(F)F)C1)[C@@H](c1ccccc1)N(C)C ZINC000508909051 917665233 /nfs/dbraw/zinc/66/52/33/917665233.db2.gz UHPZSEOUTBOSDI-OCCSQVGLSA-N 0 3 411.390 4.204 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)c1cn2cc(Cl)cc(Cl)c2n1 ZINC000508982729 917737252 /nfs/dbraw/zinc/73/72/52/917737252.db2.gz IYPVHNCVEMDHMU-OAHLLOKOSA-N 0 3 417.340 4.378 20 0 HIADHN O=C(NC1CCN(Cc2ccccc2)CC1)c1cn2cc(Cl)cc(Cl)c2n1 ZINC000509001372 917755214 /nfs/dbraw/zinc/75/52/14/917755214.db2.gz VYMFFBSOVVHQIX-UHFFFAOYSA-N 0 3 403.313 4.036 20 0 HIADHN Fc1ccc([C@H](NCCCN2CCN(c3ccccc3)CC2)c2ccccn2)cc1 ZINC000509023617 917776777 /nfs/dbraw/zinc/77/67/77/917776777.db2.gz RIFUEZAMLZBWNR-VWLOTQADSA-N 0 3 404.533 4.112 20 0 HIADHN CN(C)[C@H](CNC(=O)c1cccc(NC(=O)c2ccc(F)cc2)c1)c1ccccc1 ZINC000509094573 917835537 /nfs/dbraw/zinc/83/55/37/917835537.db2.gz BONZJGFRIZGWDO-JOCHJYFZSA-N 0 3 405.473 4.111 20 0 HIADHN COc1ccc2c(c1)CCN2C(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000509126292 917858256 /nfs/dbraw/zinc/85/82/56/917858256.db2.gz UECLHXSTOHAIPQ-OAQYLSRUSA-N 0 3 404.432 4.039 20 0 HIADHN Cc1nn(-c2ccccc2)cc1CN1CCC[C@H](C(=O)Nc2ccc(Cl)cn2)C1 ZINC000509357521 918022976 /nfs/dbraw/zinc/02/29/76/918022976.db2.gz LTODAZGRHYMRIQ-KRWDZBQOSA-N 0 3 409.921 4.080 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N[C@H](c1nccs1)c1ccccc1 ZINC000509366697 918032570 /nfs/dbraw/zinc/03/25/70/918032570.db2.gz PQASZAYHEJFPCG-MJGOQNOKSA-N 0 3 412.584 4.430 20 0 HIADHN CCCc1nc(C(=O)NC[C@@H]2CCCN(C)[C@@H]2c2ccc(C(F)(F)F)cc2)co1 ZINC000509401771 918067288 /nfs/dbraw/zinc/06/72/88/918067288.db2.gz OXRJQSGGTPNCIY-HNAYVOBHSA-N 0 3 409.452 4.459 20 0 HIADHN Cn1cnnc1C1CCN(Cc2cccc(NC(=O)c3ccc(Cl)cc3)c2)CC1 ZINC000509424360 918084493 /nfs/dbraw/zinc/08/44/93/918084493.db2.gz ZKOJGYXEIBMWJF-UHFFFAOYSA-N 0 3 409.921 4.100 20 0 HIADHN CCOc1cc(CN2CCC(C(=O)Nc3cc(Cl)ccc3O)CC2)ccc1OC ZINC000509531135 918178992 /nfs/dbraw/zinc/17/89/92/918178992.db2.gz AGSMAOXYQUKFCB-UHFFFAOYSA-N 0 3 418.921 4.304 20 0 HIADHN Cc1ccc(C)n1C1CCN(C(=O)[C@@H]2CN(Cc3ccccc3)CCC2(F)F)CC1 ZINC000509550369 918200323 /nfs/dbraw/zinc/20/03/23/918200323.db2.gz VBEATIVBZYSUJY-QFIPXVFZSA-N 0 3 415.528 4.426 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N1CCC[C@@H]1Cn1c(C)nc2ccccc21)c1ccco1 ZINC000509556903 918207729 /nfs/dbraw/zinc/20/77/29/918207729.db2.gz NYOCWNBEHHKVQX-DSKINZAPSA-N 0 3 423.561 4.241 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)N(C)CCc1ccc(Br)cc1)c1ccco1 ZINC000509572218 918221579 /nfs/dbraw/zinc/22/15/79/918221579.db2.gz ULZXEDPGGPSJKP-QAPCUYQASA-N 0 3 422.367 4.355 20 0 HIADHN CN1CCC(CCO)(NC(=O)c2ccc(-c3cc(Cl)cc(Cl)c3)s2)CC1 ZINC000509574357 918225328 /nfs/dbraw/zinc/22/53/28/918225328.db2.gz RSRUFVOQUTWDJI-UHFFFAOYSA-N 0 3 413.370 4.299 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)NC(C)(C)c1nc(C(F)(F)F)cs1)c1ccco1 ZINC000509579822 918228831 /nfs/dbraw/zinc/22/88/31/918228831.db2.gz XARBQFUNUFXMNX-NEPJUHHUSA-N 0 3 418.485 4.419 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N(C)Cc1ccccc1Br)c1ccco1 ZINC000509584448 918233770 /nfs/dbraw/zinc/23/37/70/918233770.db2.gz CKVGWDDNYGKOFP-YOEHRIQHSA-N 0 3 408.340 4.313 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N1C[C@H](C)O[C@@H](c2ccc(F)cc2)C1)c1ccco1 ZINC000509594020 918243156 /nfs/dbraw/zinc/24/31/56/918243156.db2.gz YZCSRIOTRXZVOL-ZOGSBNJCSA-N 0 3 403.498 4.020 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N1CCO[C@@H](c2cccc(Cl)c2)C1)c1ccco1 ZINC000509603836 918253414 /nfs/dbraw/zinc/25/34/14/918253414.db2.gz RXWRCUVVGIJJEE-QKYXUNIQSA-N 0 3 405.926 4.145 20 0 HIADHN Cc1ccc(-c2noc([C@@H](C)NCCCN3CCN(c4ccccc4)CC3)n2)cc1F ZINC000509605164 918253703 /nfs/dbraw/zinc/25/37/03/918253703.db2.gz OVAKAKPITFGWGA-LJQANCHMSA-N 0 3 423.536 4.047 20 0 HIADHN CC[C@@H](NC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1)c1ccc(OC)c(OC)c1 ZINC000509613390 918260918 /nfs/dbraw/zinc/26/09/18/918260918.db2.gz LJWAYJXOKKQFBJ-LEWJYISDSA-N 0 3 411.546 4.071 20 0 HIADHN CCc1cc(=O)[n-]c(-c2cccc(NC(=O)c3oc4ccccc4c3C[NH+](C)C)c2)n1 ZINC000509692233 918323019 /nfs/dbraw/zinc/32/30/19/918323019.db2.gz TWOKTBZQRCZDGZ-UHFFFAOYSA-N 0 3 416.481 4.472 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N[C@@H](C[C@H]2CCOC2)c2ccccc2)C1 ZINC000509767860 918381271 /nfs/dbraw/zinc/38/12/71/918381271.db2.gz QUXUPGUIWCZTIE-CHOVIJNXSA-N 0 3 407.558 4.289 20 0 HIADHN CCN(C(=O)NC[C@H]1CCCN1C)[C@H]1CCSc2ccc(Br)cc21 ZINC000509787145 918394763 /nfs/dbraw/zinc/39/47/63/918394763.db2.gz NITTUVPQJWKFAE-ZBFHGGJFSA-N 0 3 412.397 4.112 20 0 HIADHN CC(C)Cc1cccc([C@@H](C)C(=O)Nc2ccc3oc(=O)n(CCN(C)C)c3c2)c1 ZINC000509814327 918417459 /nfs/dbraw/zinc/41/74/59/918417459.db2.gz KMPMTMFPQOUKAZ-QGZVFWFLSA-N 0 3 409.530 4.097 20 0 HIADHN Cc1nc2sccn2c(=O)c1CCN1CCc2sccc2[C@H]1c1cccs1 ZINC000509819745 918422305 /nfs/dbraw/zinc/42/23/05/918422305.db2.gz MXWQZRBUFMPRBO-SFHVURJKSA-N 0 3 413.593 4.378 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)Nc2ccc(-c3cc(=O)[nH]c(C)n3)cc2)N(C)C)cc1 ZINC000509882273 918484178 /nfs/dbraw/zinc/48/41/78/918484178.db2.gz QEHITRRIXUYCBT-JOCHJYFZSA-N 0 3 419.529 4.144 20 0 HIADHN Cc1c(Br)c2ccccc2n1CC(=O)N(CC(C)C)C1CCN(C)CC1 ZINC000509918985 918518235 /nfs/dbraw/zinc/51/82/35/918518235.db2.gz VTSYQVDFXPYUTB-UHFFFAOYSA-N 0 3 420.395 4.291 20 0 HIADHN CC(C)c1nccn1Cc1cccc(NC(=O)NC[C@@H](c2ccccc2)N(C)C)c1 ZINC000509919475 918520544 /nfs/dbraw/zinc/52/05/44/918520544.db2.gz LLTGBKCSSXPLPA-QFIPXVFZSA-N 0 3 405.546 4.479 20 0 HIADHN O=C(Nc1ccccc1)N1CC[C@H](NCc2ccc(Cl)c(Br)c2)C1 ZINC000509964984 918556015 /nfs/dbraw/zinc/55/60/15/918556015.db2.gz YRKWDBLGVDBCLD-HNNXBMFYSA-N 0 3 408.727 4.499 20 0 HIADHN C[C@@H](NS(=O)(=O)c1csc2ccccc21)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000509973472 918563524 /nfs/dbraw/zinc/56/35/24/918563524.db2.gz DYJSFPKUYQYVOJ-SJLPKXTDSA-N 0 3 400.569 4.090 20 0 HIADHN CC(C)[C@H](CNC(=O)Cc1ccc(Br)s1)N1CCc2ccccc2C1 ZINC000510057267 918627186 /nfs/dbraw/zinc/62/71/86/918627186.db2.gz UBIJTCBGHFIPCS-SFHVURJKSA-N 0 3 421.404 4.252 20 0 HIADHN COc1ccc(NC(C)=O)cc1NC(=O)[C@H](C)N1CCC[C@@](C)(c2ccccc2)CC1 ZINC000510138716 918695984 /nfs/dbraw/zinc/69/59/84/918695984.db2.gz DHCPSJZGFFGVMJ-AVRWGWEMSA-N 0 3 423.557 4.424 20 0 HIADHN CN(Cc1c[nH]nc1-c1ccccc1F)C[C@@H](O)COc1ccc(C(F)(F)F)cc1 ZINC000510192884 918742116 /nfs/dbraw/zinc/74/21/16/918742116.db2.gz OQLQPHBXPMBRPD-MRXNPFEDSA-N 0 3 423.410 4.106 20 0 HIADHN FC(F)(F)c1ccc(-n2cc(CNC[C@H](c3ccco3)N3CCCC3)cn2)cc1 ZINC000510212386 918759436 /nfs/dbraw/zinc/75/94/36/918759436.db2.gz XSNMDYVJIPBPSD-LJQANCHMSA-N 0 3 404.436 4.411 20 0 HIADHN NC(=O)c1ccc(NC(=O)CCN(Cc2ccccc2Cl)CC2CC2)cc1Cl ZINC000510224531 918766960 /nfs/dbraw/zinc/76/69/60/918766960.db2.gz AAXQRDGOZJZIDC-UHFFFAOYSA-N 0 3 420.340 4.333 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)Nc1ccc2ncsc2c1 ZINC000510258859 918791142 /nfs/dbraw/zinc/79/11/42/918791142.db2.gz OIFSRFVWZOCFIY-UHFFFAOYSA-N 0 3 409.559 4.020 20 0 HIADHN CC[C@@H](N[C@H](C)C(=O)Nc1ccc(-c2c[nH]cn2)cc1)c1ccc(OC)c(OC)c1 ZINC000510272011 918799020 /nfs/dbraw/zinc/79/90/20/918799020.db2.gz WSWJIPNZLPDVSS-DNVCBOLYSA-N 0 3 408.502 4.162 20 0 HIADHN CCc1cccc2c1OCC[C@@H]2NC(=O)NC[C@H](c1ccc(OC)cc1)N1CCCC1 ZINC000510355301 918849645 /nfs/dbraw/zinc/84/96/45/918849645.db2.gz AWAMZGYSRCGISR-XZOQPEGZSA-N 0 3 423.557 4.218 20 0 HIADHN CN(C)[C@H](CNC(=O)Nc1ccc(C(=O)NC2CCCCC2)cc1)c1ccccc1 ZINC000510373729 918859815 /nfs/dbraw/zinc/85/98/15/918859815.db2.gz HUZDETYRLKPWRN-JOCHJYFZSA-N 0 3 408.546 4.174 20 0 HIADHN Cc1nn(Cc2ccc(C)cc2)c(C)c1CN1CCC(C(=O)N2CCC(C)CC2)CC1 ZINC000510404332 918877044 /nfs/dbraw/zinc/87/70/44/918877044.db2.gz OCNGGLGYXSNWGO-UHFFFAOYSA-N 0 3 422.617 4.327 20 0 HIADHN CN(CCCc1cc(-c2ccc(F)cc2)n(C)n1)Cc1cnn(CC(F)(F)F)c1 ZINC000510430356 918893028 /nfs/dbraw/zinc/89/30/28/918893028.db2.gz MRWHGPZFXJUYCH-UHFFFAOYSA-N 0 3 409.431 4.050 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)NCCc1ccc(F)c(Br)c1 ZINC000510460418 918915729 /nfs/dbraw/zinc/91/57/29/918915729.db2.gz ULCYKTWMDTXZOL-UHFFFAOYSA-N 0 3 419.294 4.369 20 0 HIADHN Cc1n[nH]c(C)c1[C@H]1CCCCCN1C(=O)N[C@H](CN1CCCC1)c1ccccc1 ZINC000510502665 918950734 /nfs/dbraw/zinc/95/07/34/918950734.db2.gz PRKTWLXWPUIXLO-FGZHOGPDSA-N 0 3 409.578 4.490 20 0 HIADHN CCCCCOc1ccc([C@H](C)NC(=O)N[C@H](C)C2=CCN(C)CC2)cc1OC ZINC000510502500 918951076 /nfs/dbraw/zinc/95/10/76/918951076.db2.gz QQJKUDBJRFHQTO-MSOLQXFVSA-N 0 3 403.567 4.275 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)Nc1ccc(OC[C@@H]2CCCO2)cc1 ZINC000510563821 919005998 /nfs/dbraw/zinc/00/59/98/919005998.db2.gz CPHBWOBLRMGKSU-PMACEKPBSA-N 0 3 415.559 4.265 20 0 HIADHN CN(Cc1c[nH]nc1-c1ccc(F)cc1)C[C@H](O)COc1ccccc1C(F)(F)F ZINC000510639182 919080012 /nfs/dbraw/zinc/08/00/12/919080012.db2.gz CCUNQKLPHJGVMG-KRWDZBQOSA-N 0 3 423.410 4.106 20 0 HIADHN Cc1ccc2nc(CN3CCC[C@H](c4nc5ccccc5n4C(C)C)C3)cc(=O)n2c1 ZINC000510661226 919101435 /nfs/dbraw/zinc/10/14/35/919101435.db2.gz UXTHREYWBMHYAE-IBGZPJMESA-N 0 3 415.541 4.313 20 0 HIADHN CC(C)[C@@H](NCC(=O)Nc1ccccc1C(F)(F)F)c1ccc2c(c1)OCCO2 ZINC000510660721 919101786 /nfs/dbraw/zinc/10/17/86/919101786.db2.gz HLCIJKINNSPIGH-HXUWFJFHSA-N 0 3 408.420 4.402 20 0 HIADHN CC[C@H](CS(=O)(=O)c1ccccc1)N[C@@H]1CCc2ccc(Br)cc21 ZINC000510693948 919131495 /nfs/dbraw/zinc/13/14/95/919131495.db2.gz DZKOCHKGPGWDOG-VQIMIIECSA-N 0 3 408.361 4.279 20 0 HIADHN C[C@@H](SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)N[C@@H](C)C1=CCN(C)CC1 ZINC000510774160 919232771 /nfs/dbraw/zinc/23/27/71/919232771.db2.gz ZYNWCXNVGKLJEG-LSDHHAIUSA-N 0 3 419.978 4.383 20 0 HIADHN C[C@H](NC(=O)[C@@H](Oc1ccc(F)cc1Cl)c1ccccc1)C1=CCN(C)CC1 ZINC000510787334 919251086 /nfs/dbraw/zinc/25/10/86/919251086.db2.gz KLLCTZBEZDCKDR-BTYIYWSLSA-N 0 3 402.897 4.366 20 0 HIADHN O=C1COc2ccc(CNCc3ccccc3-c3ccc(Cn4ccnc4)cc3)cc2N1 ZINC000510794190 919263043 /nfs/dbraw/zinc/26/30/43/919263043.db2.gz FMHGEPGDJHJOHB-UHFFFAOYSA-N 0 3 424.504 4.219 20 0 HIADHN O=C([C@@H]1CN(Cc2ccccc2)CCC1(F)F)N1CCC[C@H](c2nccs2)C1 ZINC000510824592 919304521 /nfs/dbraw/zinc/30/45/21/919304521.db2.gz FHSRCMVRELNNCB-ROUUACIJSA-N 0 3 405.514 4.007 20 0 HIADHN CC(C)COc1cccc(CNCc2ccc(S(=O)(=O)N(C)C(C)C)cc2)c1 ZINC000510845175 919330076 /nfs/dbraw/zinc/33/00/76/919330076.db2.gz LLDRDCBTKJAPKX-UHFFFAOYSA-N 0 3 404.576 4.040 20 0 HIADHN C[C@H](c1ccc(S(N)(=O)=O)cc1)N(C)CCSc1cc(Cl)ccc1Cl ZINC000510857654 919348313 /nfs/dbraw/zinc/34/83/13/919348313.db2.gz QEZBVIFKKRZPEN-GFCCVEGCSA-N 0 3 419.399 4.426 20 0 HIADHN CCN(CC)[C@H](CNC(=O)C1CCC(NC(=O)C2CCCC2)CC1)c1ccsc1 ZINC000510885472 919382046 /nfs/dbraw/zinc/38/20/46/919382046.db2.gz YDOZZLPUEMCNTQ-DQVLVPHSSA-N 0 3 419.635 4.112 20 0 HIADHN Cc1nc(C(C)(C)C)sc1[C@@H](C)N[C@H]1CCN(C(=O)COc2ccccc2)C1 ZINC000510958850 919496774 /nfs/dbraw/zinc/49/67/74/919496774.db2.gz DOSXQJNOJCWUGE-WBVHZDCISA-N 0 3 401.576 4.080 20 0 HIADHN O=C(Nc1ccccc1)N1CC[C@H](N[C@@H]2CCCc3nn(-c4ccccc4)cc32)C1 ZINC000510987536 919541157 /nfs/dbraw/zinc/54/11/57/919541157.db2.gz SGMVHJJAZCXDGE-SIKLNZKXSA-N 0 3 401.514 4.146 20 0 HIADHN Cc1c([C@@H](C)N[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)cnn1-c1ccc(F)cc1 ZINC000510991473 919546417 /nfs/dbraw/zinc/54/64/17/919546417.db2.gz ITMSCOKELYMOHK-XMSQKQJNSA-N 0 3 420.532 4.204 20 0 HIADHN COc1ccc2oc([C@H](C)N[C@H]3CCN(C(=O)COc4ccccc4)C3)c(C)c2c1 ZINC000511009392 919570857 /nfs/dbraw/zinc/57/08/57/919570857.db2.gz FNEDUBBCXSBYLT-ROUUACIJSA-N 0 3 408.498 4.080 20 0 HIADHN CC(C)[C@@H](NCC(=O)N1CCC[C@H]1c1ccc2c(c1)OCCCO2)c1ccccc1 ZINC000511047087 919638921 /nfs/dbraw/zinc/63/89/21/919638921.db2.gz TXDJFCJPXSNJHV-SQJMNOBHSA-N 0 3 408.542 4.498 20 0 HIADHN O=C(CC(F)(F)F)NC[C@H]1CCCN(Cc2ccccc2Oc2cccnc2)C1 ZINC000511066554 919667998 /nfs/dbraw/zinc/66/79/98/919667998.db2.gz RZPRNYYEQWHTFN-MRXNPFEDSA-N 0 3 407.436 4.155 20 0 HIADHN Cc1cccn2c(=O)cc(CN3CCC[C@@H](c4cccc(C(F)(F)F)c4)C3)nc12 ZINC000511066977 919668095 /nfs/dbraw/zinc/66/80/95/919668095.db2.gz SUDOMVVWQGWAAW-QGZVFWFLSA-N 0 3 401.432 4.401 20 0 HIADHN C[C@@H](NC(=O)N(C)CCCCCc1cc(-c2ccccc2)no1)C1=CCN(C)CC1 ZINC000511214247 919824604 /nfs/dbraw/zinc/82/46/04/919824604.db2.gz DPBDMNVSJFVDGG-LJQANCHMSA-N 0 3 410.562 4.346 20 0 HIADHN C[C@@H](NC(=O)N1CCC(c2nc3cc(Cl)ccc3s2)CC1)C1=CCN(C)CC1 ZINC000511216427 919827503 /nfs/dbraw/zinc/82/75/03/919827503.db2.gz LIXXZRKTOMOKAV-CQSZACIVSA-N 0 3 418.994 4.489 20 0 HIADHN C[C@H](NC(=O)N1CCC[C@@H](Oc2ccc(Cl)c(Cl)c2)C1)C1=CCN(C)CC1 ZINC000511273858 919870625 /nfs/dbraw/zinc/87/06/25/919870625.db2.gz PBHDMAYULIZCJF-WMLDXEAASA-N 0 3 412.361 4.197 20 0 HIADHN C[C@@H](NC(=O)N[C@H](c1ccccc1)c1ccc2c(c1)CCCO2)C1=CCN(C)CC1 ZINC000511275017 919871565 /nfs/dbraw/zinc/87/15/65/919871565.db2.gz UCQQWTXWMNISCN-HOYKHHGWSA-N 0 3 405.542 4.051 20 0 HIADHN C[C@@H](NC(=O)N[C@@H](c1ccccc1)c1ccc2c(c1)CCCO2)C1=CCN(C)CC1 ZINC000511275018 919871738 /nfs/dbraw/zinc/87/17/38/919871738.db2.gz UCQQWTXWMNISCN-KOSHJBKYSA-N 0 3 405.542 4.051 20 0 HIADHN C[C@@H](NC(=O)Nc1ccc(Br)cc1C(F)(F)F)C1=CCN(C)CC1 ZINC000511282972 919878702 /nfs/dbraw/zinc/87/87/02/919878702.db2.gz CEZDYTZPLSNMDW-SNVBAGLBSA-N 0 3 406.246 4.240 20 0 HIADHN COc1ccccc1C[C@H](C)N(Cc1ccccc1)C(=O)N[C@H](C)C1=CCN(C)CC1 ZINC000511287677 919883812 /nfs/dbraw/zinc/88/38/12/919883812.db2.gz OINQXXVPTWIVDC-LEWJYISDSA-N 0 3 421.585 4.488 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1CCCc2nc(-c3ccc(F)cc3)sc21)C1=CCN(C)CC1 ZINC000511293333 919890333 /nfs/dbraw/zinc/89/03/33/919890333.db2.gz ZAAYYDXTKAICRD-IFXJQAMLSA-N 0 3 414.550 4.276 20 0 HIADHN COCCN(C(=O)N[C@@H](C)C1=CCN(C)CC1)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000511295340 919891841 /nfs/dbraw/zinc/89/18/41/919891841.db2.gz UYEDVQBVMKXYBR-JKSUJKDBSA-N 0 3 413.484 4.075 20 0 HIADHN CC[C@H](C)n1ncc2c1nc(C)cc2C(=O)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000511354672 919948421 /nfs/dbraw/zinc/94/84/21/919948421.db2.gz FRSRCPUGHBUGKA-AVRDEDQJSA-N 0 3 405.546 4.278 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)N[C@@H](C[C@@H]2CCOC2)c2ccccc2)CC1 ZINC000511363256 919957296 /nfs/dbraw/zinc/95/72/96/919957296.db2.gz NAJFQFFGIGROAY-DHLKQENFSA-N 0 3 421.585 4.460 20 0 HIADHN CN1CCO[C@H]([C@H](NCCc2nc(C(F)(F)F)cs2)c2ccc(Cl)cc2)C1 ZINC000511383482 919984797 /nfs/dbraw/zinc/98/47/97/919984797.db2.gz YCDYIQBRIMNFQI-WMLDXEAASA-N 0 3 419.900 4.019 20 0 HIADHN CN1CCO[C@@H]([C@@H](NCCc2nc(C(F)(F)F)cs2)c2ccc(Cl)cc2)C1 ZINC000511383479 919986135 /nfs/dbraw/zinc/98/61/35/919986135.db2.gz YCDYIQBRIMNFQI-PBHICJAKSA-N 0 3 419.900 4.019 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)N[C@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000511389329 919994433 /nfs/dbraw/zinc/99/44/33/919994433.db2.gz BVAUJEAUOVREMF-NZQKXSOJSA-N 0 3 413.537 4.067 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)N[C@@H](C[C@H]1CCOC1)c1ccccc1 ZINC000511389330 919994551 /nfs/dbraw/zinc/99/45/51/919994551.db2.gz BVAUJEAUOVREMF-OFNKIYASSA-N 0 3 413.537 4.067 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)N[C@H](C[C@@H]2CCOC2)c2ccccc2)CN1Cc1ccccc1 ZINC000511392513 920001430 /nfs/dbraw/zinc/00/14/30/920001430.db2.gz WCQDRKFIXCQDNJ-BKXMBWNOSA-N 0 3 407.558 4.117 20 0 HIADHN CCN(c1ccc(C(=O)Nc2ccc(N3CCN(CC)CC3)cc2C)cn1)C(C)C ZINC000511406233 920021262 /nfs/dbraw/zinc/02/12/62/920021262.db2.gz VHXVDTYCAGNSSE-UHFFFAOYSA-N 0 3 409.578 4.019 20 0 HIADHN COc1ccc(C[C@@H](C)C(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)cc1OC ZINC000511530733 920151180 /nfs/dbraw/zinc/15/11/80/920151180.db2.gz FZHSHEXZZKFURS-KNQAVFIVSA-N 0 3 410.558 4.144 20 0 HIADHN CN(C)C[C@H](NC(=O)Nc1cccc(C(=O)N(C)c2ccccc2)c1)c1ccccc1 ZINC000511620139 920275880 /nfs/dbraw/zinc/27/58/80/920275880.db2.gz JUXDNTGRWDERSL-QHCPKHFHSA-N 0 3 416.525 4.388 20 0 HIADHN CN(C)[C@H](CNC(=O)Nc1cccc(C(=O)N(C)c2ccccc2)c1)c1ccccc1 ZINC000511620365 920276079 /nfs/dbraw/zinc/27/60/79/920276079.db2.gz NGBJIPRGOUIGFH-HSZRJFAPSA-N 0 3 416.525 4.388 20 0 HIADHN CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@H]3CN2Cc1csc(-c2cccc(Br)c2)n1 ZINC000511668812 920333397 /nfs/dbraw/zinc/33/33/97/920333397.db2.gz VXUSHWUMFWFVDB-WIHIRCLASA-N 0 3 405.361 4.428 20 0 HIADHN FC(F)(F)c1ccc(CN2CC[C@H](Nc3cc(N4CCCCC4)ncn3)C2)cc1 ZINC000511670100 920336739 /nfs/dbraw/zinc/33/67/39/920336739.db2.gz FRLBDVNFVRHAMV-SFHVURJKSA-N 0 3 405.468 4.172 20 0 HIADHN Cc1cc2c(cc1NC(=O)[C@]1(C(F)(F)F)CCN(Cc3ccccc3)C1)OCO2 ZINC000511692723 920356085 /nfs/dbraw/zinc/35/60/85/920356085.db2.gz RSUSTBBMKKIGJL-FQEVSTJZSA-N 0 3 406.404 4.117 20 0 HIADHN O=C(COc1ccc(Cl)c2cccnc12)NC[C@@H](c1cccs1)N1CCCC1 ZINC000511753313 920430414 /nfs/dbraw/zinc/43/04/14/920430414.db2.gz LGMUDTOTYXESEQ-KRWDZBQOSA-N 0 3 415.946 4.282 20 0 HIADHN O=C1NCCN1C1CCN(Cc2ccc(-c3ccc(Br)cc3)s2)CC1 ZINC000511754933 920434135 /nfs/dbraw/zinc/43/41/35/920434135.db2.gz KRHYURMTOPCZBH-UHFFFAOYSA-N 0 3 420.376 4.167 20 0 HIADHN CC(C)[C@H](NC(=O)CN1C[C@H](c2ccccc2)[C@H]2COCC[C@H]21)c1ccc(F)cc1 ZINC000511758097 920438937 /nfs/dbraw/zinc/43/89/37/920438937.db2.gz QOMDLXAFROCTRQ-WBJOIXBTSA-N 0 3 410.533 4.144 20 0 HIADHN O=C(CN1C[C@H](c2ccccc2)[C@@H]2COCC[C@H]21)Nc1cccc(C(F)(F)F)c1 ZINC000511759063 920441697 /nfs/dbraw/zinc/44/16/97/920441697.db2.gz SSFYYKKIXAJRAZ-HSALFYBXSA-N 0 3 404.432 4.148 20 0 HIADHN C[C@@H](CC(=O)Nc1cc(C(F)(F)F)ccc1Cl)N[C@@H](C)C(=O)N1CCCCC1 ZINC000511780466 920470747 /nfs/dbraw/zinc/47/07/47/920470747.db2.gz HXVKMKPLLGIPSG-STQMWFEESA-N 0 3 419.875 4.067 20 0 HIADHN CC(=O)c1c(C)[nH]c(C(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)c1C(C)C ZINC000511783479 920475582 /nfs/dbraw/zinc/47/55/82/920475582.db2.gz GTEIVXXSDOZMBY-IAGOWNOFSA-N 0 3 417.594 4.001 20 0 HIADHN Cc1cc(N2CCCC2)ccc1NC(=O)CN1C[C@H](c2ccccc2)[C@H]2COCC[C@@H]21 ZINC000511793248 920486301 /nfs/dbraw/zinc/48/63/01/920486301.db2.gz PSCGWWVKXVXDBP-OYRHQHFDSA-N 0 3 419.569 4.038 20 0 HIADHN COc1ccc([C@H](NC(=O)CN2C[C@H](c3ccccc3)[C@H]3COCC[C@@H]32)C(C)C)cc1 ZINC000511795016 920489319 /nfs/dbraw/zinc/48/93/19/920489319.db2.gz HJQSLAZHDVVILS-QJXQVQFTSA-N 0 3 422.569 4.013 20 0 HIADHN COc1ccc([C@H](NC(=O)CN2C[C@H](c3ccccc3)[C@H]3COCC[C@H]32)C(C)C)cc1 ZINC000511795015 920489556 /nfs/dbraw/zinc/48/95/56/920489556.db2.gz HJQSLAZHDVVILS-PMHJDTQVSA-N 0 3 422.569 4.013 20 0 HIADHN O=C(N[C@@H]1CN(Cc2ccccc2)C[C@H]1c1ccccc1)c1cnc2cnccc2c1 ZINC000511816609 920512904 /nfs/dbraw/zinc/51/29/04/920512904.db2.gz FLQNOXRTXSTEBK-UKILVPOCSA-N 0 3 408.505 4.028 20 0 HIADHN O=C(CCC(=O)c1cccs1)N[C@@H]1CN(Cc2ccccc2)C[C@H]1c1ccccc1 ZINC000511817369 920513683 /nfs/dbraw/zinc/51/36/83/920513683.db2.gz LDZMPFAZUIISTK-FCHUYYIVSA-N 0 3 418.562 4.495 20 0 HIADHN CSc1nccn1-c1ccc(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)cc1 ZINC000511818558 920515078 /nfs/dbraw/zinc/51/50/78/920515078.db2.gz WTWDVMNIKGNIHC-NRFANRHFSA-N 0 3 406.555 4.161 20 0 HIADHN O=C(CN1C[C@H](c2ccccc2)[C@H]2CCC[C@@H]21)NCC1(c2ccccc2)CCOCC1 ZINC000511829573 920531418 /nfs/dbraw/zinc/53/14/18/920531418.db2.gz KKGSPYKAZXKYQW-SDHSZQHLSA-N 0 3 418.581 4.119 20 0 HIADHN Cc1cc([C@@H](C)N[C@@H]2CCCN(Cc3ccccn3)C2=O)sc1Br ZINC000511924662 920669856 /nfs/dbraw/zinc/66/98/56/920669856.db2.gz BDAGCJWHVHBOAP-UKRRQHHQSA-N 0 3 408.365 4.056 20 0 HIADHN Cc1cc([C@H](C)NCc2n[nH]c(COc3ccccc3)n2)sc1Br ZINC000511940429 920695990 /nfs/dbraw/zinc/69/59/90/920695990.db2.gz STLAROZGNNIYJO-LBPRGKRZSA-N 0 3 407.337 4.367 20 0 HIADHN C[C@@H](CC(=O)Nc1cc(C(F)(F)F)ccc1Cl)N[C@H]1CCCc2c[nH]nc21 ZINC000512005281 920775981 /nfs/dbraw/zinc/77/59/81/920775981.db2.gz GOCRYBHNLVDVOX-HZMBPMFUSA-N 0 3 400.832 4.466 20 0 HIADHN O=C(C1CCCCC1)N1CC[C@H](NCc2cnn(-c3ccc(C(F)(F)F)cc3)c2)C1 ZINC000512014640 920785573 /nfs/dbraw/zinc/78/55/73/920785573.db2.gz LSSZONRICPZAJQ-IBGZPJMESA-N 0 3 420.479 4.162 20 0 HIADHN O=C(C1CCCCC1)N1CC[C@@H](NCc2cnn(-c3ccc(C(F)(F)F)cc3)c2)C1 ZINC000512014641 920786458 /nfs/dbraw/zinc/78/64/58/920786458.db2.gz LSSZONRICPZAJQ-LJQANCHMSA-N 0 3 420.479 4.162 20 0 HIADHN COc1cc(OC)cc(N2CC[C@@H](CNCc3cscc3Br)C2)c1 ZINC000512032761 920805729 /nfs/dbraw/zinc/80/57/29/920805729.db2.gz WLBMSLOZSRERBY-ZDUSSCGKSA-N 0 3 411.365 4.144 20 0 HIADHN O=C(NCCNCc1cnn(-c2ccc(C(F)(F)F)cc2)c1)c1ccccc1Cl ZINC000512059168 920828033 /nfs/dbraw/zinc/82/80/33/920828033.db2.gz QYCDBCQCXGQMNS-UHFFFAOYSA-N 0 3 422.838 4.064 20 0 HIADHN CNS(=O)(=O)c1ccc([C@@H](C)N[C@H](C)c2cc(C)c(Br)s2)cc1 ZINC000512112614 920868233 /nfs/dbraw/zinc/86/82/33/920868233.db2.gz FFBBHLJYANGJLW-VXGBXAGGSA-N 0 3 417.394 4.139 20 0 HIADHN C[C@@H](Cc1ccc(O)cc1)N[C@H](c1ccc(F)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000512117773 920870803 /nfs/dbraw/zinc/87/08/03/920870803.db2.gz ZVDASJRZCRVFSV-QMHKHESXSA-N 0 3 413.514 4.245 20 0 HIADHN C[C@@H](NC(=O)c1cnn(-c2cccc(C(F)(F)F)c2)c1C1CC1)C1=CCN(C)CC1 ZINC000512133914 920881555 /nfs/dbraw/zinc/88/15/55/920881555.db2.gz RVGPIMDLHHCVRC-CQSZACIVSA-N 0 3 418.463 4.149 20 0 HIADHN C[C@H](NC(=O)c1ccccc1CSc1nc2ccccc2[nH]1)C1=CCN(C)CC1 ZINC000512141547 920885940 /nfs/dbraw/zinc/88/59/40/920885940.db2.gz AXFHDSXVTPXVIS-INIZCTEOSA-N 0 3 406.555 4.235 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Cc1c(C)noc1Cl)c1ccc(C(F)(F)F)cc1 ZINC000512145587 920888451 /nfs/dbraw/zinc/88/84/51/920888451.db2.gz CRUOONSTEKSNKT-INIZCTEOSA-N 0 3 417.859 4.397 20 0 HIADHN Cc1cccc2sc(N(Cc3ccccc3)C(=O)CN[C@H]3CSC[C@@H]3C)nc21 ZINC000512167312 920903389 /nfs/dbraw/zinc/90/33/89/920903389.db2.gz WWJYTIKLVVEMSI-WMZOPIPTSA-N 0 3 411.596 4.479 20 0 HIADHN OCC[C@@H](NC[C@@H](O)COCc1ccccc1Cl)c1ccc(Cl)c(Cl)c1 ZINC000512192809 920936213 /nfs/dbraw/zinc/93/62/13/920936213.db2.gz FLTBFHRJWMJCBV-DNVCBOLYSA-N 0 3 418.748 4.238 20 0 HIADHN Cc1cc2ncn(C[C@@H](O)CN[C@@H](CCO)c3ccc(Cl)c(Cl)c3)c2cc1C ZINC000512194276 920936917 /nfs/dbraw/zinc/93/69/17/920936917.db2.gz HLAYPIUZNVKERI-LPHOPBHVSA-N 0 3 422.356 4.034 20 0 HIADHN Cc1cc2ncn(C[C@H](O)CN[C@H](CCO)c3ccc(Cl)c(Cl)c3)c2cc1C ZINC000512194278 920937455 /nfs/dbraw/zinc/93/74/55/920937455.db2.gz HLAYPIUZNVKERI-VQIMIIECSA-N 0 3 422.356 4.034 20 0 HIADHN COc1cc(F)c([C@H](C)NC(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)cc1OC ZINC000512197214 920943649 /nfs/dbraw/zinc/94/36/49/920943649.db2.gz ATBSUVBONSAUTK-LZLYRXPVSA-N 0 3 415.509 4.039 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N[C@@H](C[C@@H]3CCOC3)c3ccccc3)cc2)CC1 ZINC000512206677 920953076 /nfs/dbraw/zinc/95/30/76/920953076.db2.gz HZDUUDVYBRQUEJ-OFVILXPXSA-N 0 3 421.585 4.115 20 0 HIADHN OCC[C@H](NC[C@H](O)CO[C@@H]1CCCc2ccccc21)c1ccc(Cl)c(Cl)c1 ZINC000512213545 920960577 /nfs/dbraw/zinc/96/05/77/920960577.db2.gz PEAMVURMXDEERL-BULFRSBZSA-N 0 3 424.368 4.462 20 0 HIADHN COc1ccc(NC(=O)[C@H](NCCC2CCOCC2)c2ccccc2)cc1Cl ZINC000512234928 920989618 /nfs/dbraw/zinc/98/96/18/920989618.db2.gz USLAJMIYZKCNLE-OAQYLSRUSA-N 0 3 402.922 4.435 20 0 HIADHN O=C(C1CCN(Cc2ccccc2OCC(F)(F)F)CC1)N1CCc2ccccc21 ZINC000512257318 921016192 /nfs/dbraw/zinc/01/61/92/921016192.db2.gz DYRIQNXSNSPQLP-UHFFFAOYSA-N 0 3 418.459 4.429 20 0 HIADHN CCC[C@@]1(NCC(=O)N2N=C(c3ccc(Cl)cc3)C[C@@H]2c2ccco2)CCOC1 ZINC000512256739 921016360 /nfs/dbraw/zinc/01/63/60/921016360.db2.gz ASUPRAGBWZGAHU-DENIHFKCSA-N 0 3 415.921 4.160 20 0 HIADHN CCC[C@]1(NCC(=O)N2N=C(c3ccc(Cl)cc3)C[C@@H]2c2ccco2)CCOC1 ZINC000512256740 921017140 /nfs/dbraw/zinc/01/71/40/921017140.db2.gz ASUPRAGBWZGAHU-KNQAVFIVSA-N 0 3 415.921 4.160 20 0 HIADHN CCC[C@]1(NCC(=O)N(Cc2ccccc2)c2nc3c(s2)CCCC3)CCOC1 ZINC000512267014 921023925 /nfs/dbraw/zinc/02/39/25/921023925.db2.gz DMYQICWATHRWJT-QHCPKHFHSA-N 0 3 413.587 4.104 20 0 HIADHN CC(=O)N(C)C1CCN(Cc2cn(-c3ccccc3)nc2-c2ccc(C)cc2)CC1 ZINC000512291433 921046142 /nfs/dbraw/zinc/04/61/42/921046142.db2.gz JNBXIGXJBSUAJZ-UHFFFAOYSA-N 0 3 402.542 4.290 20 0 HIADHN CC(=O)N(C)C1CCN(Cc2cn(-c3ccccc3)nc2-c2ccccc2C)CC1 ZINC000512291636 921046524 /nfs/dbraw/zinc/04/65/24/921046524.db2.gz KWKQZMIBZOYZAM-UHFFFAOYSA-N 0 3 402.542 4.290 20 0 HIADHN CCC[C@]1(NCC(=O)N2N=C(c3cc4ccccc4o3)C[C@H]2c2ccco2)CCOC1 ZINC000512292961 921048414 /nfs/dbraw/zinc/04/84/14/921048414.db2.gz RGWXXCDLPGUOLY-CYFREDJKSA-N 0 3 421.497 4.252 20 0 HIADHN Fc1ccc(-c2nn(-c3ccccc3)cc2CN2CCC(n3cncn3)CC2)cc1 ZINC000512350315 921095277 /nfs/dbraw/zinc/09/52/77/921095277.db2.gz LSJAMHOFLATOGX-UHFFFAOYSA-N 0 3 402.477 4.107 20 0 HIADHN CC1(N(Cc2cnc(N3CCOCC3)s2)Cc2ccc3c(c2)OCO3)CCCC1 ZINC000513455191 921820388 /nfs/dbraw/zinc/82/03/88/921820388.db2.gz KWGCJAIGSRSYLI-UHFFFAOYSA-N 0 3 415.559 4.043 20 0 HIADHN CCOc1c(Br)cc(Br)cc1CN(C)C[C@@H]1CCCOC1 ZINC000513466498 921829090 /nfs/dbraw/zinc/82/90/90/921829090.db2.gz GPOAYZMHKWZXHS-LBPRGKRZSA-N 0 3 421.173 4.469 20 0 HIADHN CC(=O)c1cccc(OC[C@H](O)CN(Cc2cccc(Br)c2)C(C)C)c1 ZINC000513491475 921843857 /nfs/dbraw/zinc/84/38/57/921843857.db2.gz UDYIJBASKWGCJM-HXUWFJFHSA-N 0 3 420.347 4.302 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1ccc(-c2cc(=O)[nH]c(C)n2)cc1)c1ccco1 ZINC000513497500 921847148 /nfs/dbraw/zinc/84/71/48/921847148.db2.gz XPVMKPIYHPRTOR-LIRRHRJNSA-N 0 3 409.490 4.002 20 0 HIADHN CN(Cc1cccc(F)c1)C[C@@H](O)COc1ccc(Cl)cc1Br ZINC000513502790 921852474 /nfs/dbraw/zinc/85/24/74/921852474.db2.gz FSBSMDVMVBXJQL-OAHLLOKOSA-N 0 3 402.691 4.113 20 0 HIADHN Cc1nn(C)c(N2CCOCC2)c1CNC1(c2ccc(C(C)(C)C)cc2)CCCC1 ZINC000513505475 921854002 /nfs/dbraw/zinc/85/40/02/921854002.db2.gz KPCRGPQUAAXLQG-UHFFFAOYSA-N 0 3 410.606 4.422 20 0 HIADHN CCN1CCN(c2ccc(NCc3cc(Cl)c4c(c3)OCCO4)c(C)c2)CC1 ZINC000513561946 921895969 /nfs/dbraw/zinc/89/59/69/921895969.db2.gz CEBSUABMKDYZEW-UHFFFAOYSA-N 0 3 401.938 4.174 20 0 HIADHN CCOc1cc(C[NH2+]CCOc2cccc(Cl)c2)cc(Br)c1[O-] ZINC000513599616 921932122 /nfs/dbraw/zinc/93/21/22/921932122.db2.gz LMYMOLJUWHUESR-UHFFFAOYSA-N 0 3 400.700 4.375 20 0 HIADHN COc1ccc([C@@H](Cc2ccncc2)NCc2ccccc2CN2CCCC2=O)cc1 ZINC000513653821 921976067 /nfs/dbraw/zinc/97/60/67/921976067.db2.gz FWJKWKWOMXHTBF-RUZDIDTESA-N 0 3 415.537 4.286 20 0 HIADHN COc1ccc(CN2CCC[C@@H](c3nnc4n3CCC4)C2)cc1OCc1ccccc1 ZINC000513668369 921991782 /nfs/dbraw/zinc/99/17/82/921991782.db2.gz XMYAGSAYCZVCQY-OAQYLSRUSA-N 0 3 418.541 4.192 20 0 HIADHN C[C@H](C(=O)N(C)Cc1ccccc1)N(C)CCCc1cc(-c2ccc(F)cc2)n(C)n1 ZINC000513702396 922021888 /nfs/dbraw/zinc/02/18/88/922021888.db2.gz IPYCUORXFNNVGZ-LJQANCHMSA-N 0 3 422.548 4.138 20 0 HIADHN CNC(=O)c1ccc(CN(C)[C@H]2CCSc3ccc(Br)cc32)cc1 ZINC000513725637 922044319 /nfs/dbraw/zinc/04/43/19/922044319.db2.gz RMBQNUGDSMMSNU-KRWDZBQOSA-N 0 3 405.361 4.478 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cc(OC)c(OC)cc1Cl)c1cccc(OC)c1 ZINC000513757579 922076069 /nfs/dbraw/zinc/07/60/69/922076069.db2.gz OHFWYIMPAWQSIH-IBGZPJMESA-N 0 3 420.937 4.179 20 0 HIADHN O=c1c(Cl)c(NC[C@H]2CCCN2Cc2ccccc2)cnn1Cc1ccccc1 ZINC000513759140 922077540 /nfs/dbraw/zinc/07/75/40/922077540.db2.gz IWWHDGONWKHGOY-HXUWFJFHSA-N 0 3 408.933 4.022 20 0 HIADHN C[C@H](N[C@H]1CCc2c1cccc2Br)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000513861822 922188150 /nfs/dbraw/zinc/18/81/50/922188150.db2.gz NSMUUTHBNLVLPZ-DJJJIMSYSA-N 0 3 423.376 4.038 20 0 HIADHN CN(Cc1cccc(Br)c1)C(=O)NC[C@H](c1ccccc1)N1CCCC1 ZINC000513881567 922210142 /nfs/dbraw/zinc/21/01/42/922210142.db2.gz RPQZXPWWPKOQLJ-HXUWFJFHSA-N 0 3 416.363 4.428 20 0 HIADHN O=C(c1cc(F)ccc1F)C1CCN(C[C@@H]2CCN(C(=O)c3ccccc3)C2)CC1 ZINC000513882884 922211932 /nfs/dbraw/zinc/21/19/32/922211932.db2.gz RKBBKKWDOQWUMY-KRWDZBQOSA-N 0 3 412.480 4.022 20 0 HIADHN Cc1ccccc1C1(CNC(=O)NC[C@@H](c2ccccc2)N2CCCC2)CCOCC1 ZINC000513891519 922219682 /nfs/dbraw/zinc/21/96/82/922219682.db2.gz IFSUOFCINIYBRP-DEOSSOPVSA-N 0 3 421.585 4.180 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Cc1c[nH]c2cccc(Br)c12 ZINC000513925991 922248898 /nfs/dbraw/zinc/24/88/98/922248898.db2.gz OITQXMRSBXCKSX-UHFFFAOYSA-N 0 3 420.376 4.125 20 0 HIADHN CCCCc1nnc(NC(=O)N2CCCN(CCCc3ccccc3)CC2)s1 ZINC000513940281 922258579 /nfs/dbraw/zinc/25/85/79/922258579.db2.gz OBXSKNNDCJVING-UHFFFAOYSA-N 0 3 401.580 4.053 20 0 HIADHN C[C@H](Cc1ccccc1Cl)C(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000514012010 922336661 /nfs/dbraw/zinc/33/66/61/922336661.db2.gz WKGZGTGOIXYOIA-GUDVDZBRSA-N 0 3 406.998 4.257 20 0 HIADHN CCOC(=O)C1CCC(N(CC)C(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)CC1 ZINC000514037560 922359047 /nfs/dbraw/zinc/35/90/47/922359047.db2.gz GZTLQRPJGPTJNG-SNCIUUNGSA-N 0 3 418.553 4.008 20 0 HIADHN Cc1nc2ccccc2nc1CN1CCC[C@@H](CNC(=O)Nc2cccc(F)c2)C1 ZINC000514093476 922417324 /nfs/dbraw/zinc/41/73/24/922417324.db2.gz HGXAIJMZLBVIFF-KRWDZBQOSA-N 0 3 407.493 4.111 20 0 HIADHN COc1ccc(C[C@H](C)N[C@H](CCSC)c2nnc3ccccn32)c(C)c1OC ZINC000514096198 922421388 /nfs/dbraw/zinc/42/13/88/922421388.db2.gz VCNFHGZBXZLBMI-MAUKXSAKSA-N 0 3 414.575 4.070 20 0 HIADHN C[C@@H]1CN(c2ccc(CN[C@@H](c3cccc(OC(F)(F)F)c3)C3CC3)cn2)CCO1 ZINC000514096422 922421794 /nfs/dbraw/zinc/42/17/94/922421794.db2.gz VVARJOBIBRLPTR-QVKFZJNVSA-N 0 3 421.463 4.446 20 0 HIADHN COCCN(CCc1nc2sc3c(c2c(N)n1)CC[C@H](C)C3)Cc1cccs1 ZINC000514113681 922445540 /nfs/dbraw/zinc/44/55/40/922445540.db2.gz WZUGHWKQZCPBPS-AWEZNQCLSA-N 0 3 416.616 4.151 20 0 HIADHN CC(C)COC[C@H](NC(=O)NC[C@H](c1cccs1)N1CCCC1)c1ccco1 ZINC000514150168 922488033 /nfs/dbraw/zinc/48/80/33/922488033.db2.gz YEOBEFBNKXXVBR-ZWKOTPCHSA-N 0 3 405.564 4.191 20 0 HIADHN Cc1ccccc1CN(Cc1cccnc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000514157823 922496392 /nfs/dbraw/zinc/49/63/92/922496392.db2.gz KFLFIBPNKCRQON-VWLOTQADSA-N 0 3 414.553 4.376 20 0 HIADHN C[C@H](Cc1ccc(O)cc1)NC(=O)NC[C@H](c1cccs1)N1CCC(C)CC1 ZINC000514183119 922522438 /nfs/dbraw/zinc/52/24/38/922522438.db2.gz RVLDAWRJPJTYNY-YLJYHZDGSA-N 0 3 401.576 4.157 20 0 HIADHN Cc1ccccc1C[C@H]1CCCN1CC(=O)N1CCC(OCc2ccccc2)CC1 ZINC000514191528 922532372 /nfs/dbraw/zinc/53/23/72/922532372.db2.gz YTOMHNKOGPQSMY-XMMPIXPASA-N 0 3 406.570 4.210 20 0 HIADHN CC[C@@H]1C[C@@H](CC(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)CCO1 ZINC000514196412 922535765 /nfs/dbraw/zinc/53/57/65/922535765.db2.gz YIGNYCBFIXBCMT-QFBILLFUSA-N 0 3 400.485 4.191 20 0 HIADHN C[C@@H](NC(=O)N[C@H](CN1CCCC1)c1ccccc1)c1cccc(N2CCCC2=O)c1 ZINC000514207000 922544428 /nfs/dbraw/zinc/54/44/28/922544428.db2.gz XWMBMYKGRDTMKK-AUSIDOKSSA-N 0 3 420.557 4.011 20 0 HIADHN Cc1ccccc1C1(CNC(=O)N[C@H](CN2CCCC2)c2ccccc2)CCOCC1 ZINC000514217567 922552546 /nfs/dbraw/zinc/55/25/46/922552546.db2.gz DBRYEJBQYHSACT-XMMPIXPASA-N 0 3 421.585 4.180 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@@H](C)COc1ccc(F)cc1F)c1ccsc1 ZINC000514221020 922555183 /nfs/dbraw/zinc/55/51/83/922555183.db2.gz FGUXMTFKOAPISU-KBXCAEBGSA-N 0 3 411.518 4.176 20 0 HIADHN O=C(Nc1ccc(Br)cn1)[C@@H]1CCCN(C/C=C/c2ccccc2)C1 ZINC000514231359 922569270 /nfs/dbraw/zinc/56/92/70/922569270.db2.gz WUUCPMTUEJJOOS-IOMDMTNGSA-N 0 3 400.320 4.208 20 0 HIADHN Cc1nc(C(C)C)sc1[C@@H](C)N(C)C(=O)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000514407091 922614714 /nfs/dbraw/zinc/61/47/14/922614714.db2.gz OCPOCCHISMXBPK-IEBWSBKVSA-N 0 3 400.592 4.402 20 0 HIADHN CN(C)[C@@H](CNC(=O)Nc1ncc(Cc2ccc(F)c(F)c2)s1)c1ccccc1 ZINC000514560394 922698852 /nfs/dbraw/zinc/69/88/52/922698852.db2.gz LWSGUZSXQPEMQZ-IBGZPJMESA-N 0 3 416.497 4.437 20 0 HIADHN C[C@@H](c1ccc(F)cc1)N1CCC[C@@H](NCc2ccc(OCC(F)F)cc2)C1=O ZINC000514680754 922750792 /nfs/dbraw/zinc/75/07/92/922750792.db2.gz KSZWAHCGDFOIPN-MGPUTAFESA-N 0 3 406.448 4.311 20 0 HIADHN CCc1[nH]ccc1C(=O)N(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000514805973 922806770 /nfs/dbraw/zinc/80/67/70/922806770.db2.gz OJAGNHHHUHPQNM-QFIPXVFZSA-N 0 3 402.542 4.279 20 0 HIADHN Cc1cc(C(=O)NC[C@H](C(C)C)N2CCc3ccccc3C2)c(C)n1-c1nccs1 ZINC000514821359 922815404 /nfs/dbraw/zinc/81/54/04/922815404.db2.gz JMNWRCNGKMTWIL-JOCHJYFZSA-N 0 3 422.598 4.363 20 0 HIADHN CCOC(=O)C1CCC(N(CC)Cc2nc(-c3cc(F)c(F)c(F)c3)no2)CC1 ZINC000515073422 922893495 /nfs/dbraw/zinc/89/34/95/922893495.db2.gz IZOWKQNDWVUKKV-UHFFFAOYSA-N 0 3 411.424 4.098 20 0 HIADHN FC(F)(F)c1ccc(CN2C[C@H]3CCC[C@@]3(c3nc(-c4cccnc4)no3)C2)nc1 ZINC000515343432 923061087 /nfs/dbraw/zinc/06/10/87/923061087.db2.gz NXBWYZXIMRZOOA-OXQOHEQNSA-N 0 3 415.419 4.099 20 0 HIADHN Cc1nc(-c2cccc(NC(=O)NC[C@@H](c3ccc(OC(C)C)cc3)N(C)C)c2)no1 ZINC000515688959 923272734 /nfs/dbraw/zinc/27/27/34/923272734.db2.gz RJAZMRUDNDZYBV-NRFANRHFSA-N 0 3 423.517 4.257 20 0 HIADHN Cc1ccc([C@H](C)N[C@@H](C)C(=O)Nc2ccc(I)cc2)cc1 ZINC000515715978 923297711 /nfs/dbraw/zinc/29/77/11/923297711.db2.gz ZGRRHOOXZMFBEL-KBPBESRZSA-N 0 3 408.283 4.277 20 0 HIADHN CCC(CC)C(=O)N1CCC(N[C@H](C(=O)NCc2ccccc2)c2ccccc2)CC1 ZINC000515715947 923298051 /nfs/dbraw/zinc/29/80/51/923298051.db2.gz WXUZNDDEBZNUSB-DEOSSOPVSA-N 0 3 421.585 4.061 20 0 HIADHN O=C(CCc1ccccc1Br)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000515770994 923339515 /nfs/dbraw/zinc/33/95/15/923339515.db2.gz GIKCVSKSZPBLOP-FQEVSTJZSA-N 0 3 401.348 4.335 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)c1[nH]c2ccccc2c1Br ZINC000515773522 923340937 /nfs/dbraw/zinc/34/09/37/923340937.db2.gz UDBQMVOVEIPVBI-SFHVURJKSA-N 0 3 412.331 4.497 20 0 HIADHN COc1ccc(CNC(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)c(OC)c1 ZINC000515916551 923434264 /nfs/dbraw/zinc/43/42/64/923434264.db2.gz AGEBVPBLYDXPTJ-IBGZPJMESA-N 0 3 417.575 4.038 20 0 HIADHN CO[C@@H](CNC(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1)c1ccccc1 ZINC000516150692 923577904 /nfs/dbraw/zinc/57/79/04/923577904.db2.gz TUAXTLHRXQLRNN-PMACEKPBSA-N 0 3 401.576 4.208 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)N(C)Cc2ccc(OC(F)F)cc2)C1 ZINC000516163625 923581615 /nfs/dbraw/zinc/58/16/15/923581615.db2.gz MPJGSQHHZWGNRA-QFBILLFUSA-N 0 3 403.473 4.265 20 0 HIADHN O=C(CCCc1nnc(-c2ccccc2)o1)N[C@H](CN1CCCC1)c1ccccc1 ZINC000516436150 923731933 /nfs/dbraw/zinc/73/19/33/923731933.db2.gz PDDILGSOIASECH-OAQYLSRUSA-N 0 3 404.514 4.013 20 0 HIADHN C[C@H](CNC(=O)CSc1nnc(-c2ccc3ccccc3c2)o1)N1CCCC[C@@H]1C ZINC000516491428 923757402 /nfs/dbraw/zinc/75/74/02/923757402.db2.gz GVIKOUKJMVDDAY-DLBZAZTESA-N 0 3 424.570 4.361 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)NCc2ccc(F)cc2C(F)(F)F)C1 ZINC000516578894 923800272 /nfs/dbraw/zinc/80/02/72/923800272.db2.gz YJIDRGMPCBNMJK-KSSFIOAISA-N 0 3 409.427 4.479 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)NCc2ccc(F)cc2C(F)(F)F)C1 ZINC000516578893 923800451 /nfs/dbraw/zinc/80/04/51/923800451.db2.gz YJIDRGMPCBNMJK-KDOFPFPSSA-N 0 3 409.427 4.479 20 0 HIADHN Cc1c2ccc3ccccc3c2oc1C(=O)Nc1cnccc1N1CCN(C)CC1 ZINC000516624091 923819879 /nfs/dbraw/zinc/81/98/79/923819879.db2.gz IXDJSRCVNUYPEQ-UHFFFAOYSA-N 0 3 400.482 4.294 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)c2ccccc2OCc2ccncc2)C1 ZINC000516623194 923820530 /nfs/dbraw/zinc/82/05/30/923820530.db2.gz XGTQWBCZICJQKG-DENIHFKCSA-N 0 3 401.510 4.226 20 0 HIADHN COC(=O)c1ccc(CNCc2ccc(OC(F)F)c(Br)c2)cc1 ZINC000516894868 923931778 /nfs/dbraw/zinc/93/17/78/923931778.db2.gz WJODOUIODOEBNC-UHFFFAOYSA-N 0 3 400.219 4.127 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)c1c[nH]c(-c2ccccc2)n1 ZINC000516934629 923941396 /nfs/dbraw/zinc/94/13/96/923941396.db2.gz JGOPRCGPPZFXPL-UHFFFAOYSA-N 0 3 416.447 4.300 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)CCc2nc3ccccc3s2)N(C)C)cc1 ZINC000517048956 923974977 /nfs/dbraw/zinc/97/49/77/923974977.db2.gz ZPGGTMSBCRGARD-FQEVSTJZSA-N 0 3 411.571 4.435 20 0 HIADHN Cc1cc(=O)[nH]c2cc(C(=O)NC[C@H](c3ccccc3)N3CCC(C)CC3)ccc12 ZINC000517055725 923977787 /nfs/dbraw/zinc/97/77/87/923977787.db2.gz SIJFFQMOIVMERM-HSZRJFAPSA-N 0 3 403.526 4.452 20 0 HIADHN CCSc1cccc(F)c1NC(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000517060112 923981930 /nfs/dbraw/zinc/98/19/30/923981930.db2.gz DOIRWFDHATWSQF-UHFFFAOYSA-N 0 3 417.550 4.216 20 0 HIADHN Cc1sc2nc(C)nc(SCC(=O)NC[C@@H](C)N3CCCC[C@@H]3C)c2c1C ZINC000517347193 924120803 /nfs/dbraw/zinc/12/08/03/924120803.db2.gz ALOBPJACUYZTGD-QWHCGFSZSA-N 0 3 406.621 4.088 20 0 HIADHN Cc1sc2nc(C)nc(SCC(=O)NC[C@H](C)N3CCCC[C@H]3C)c2c1C ZINC000517347192 924121427 /nfs/dbraw/zinc/12/14/27/924121427.db2.gz ALOBPJACUYZTGD-OLZOCXBDSA-N 0 3 406.621 4.088 20 0 HIADHN CN(CCc1ccc(Br)cc1)C(=O)c1cccc(CN2CCCC2)c1 ZINC000517364490 924135402 /nfs/dbraw/zinc/13/54/02/924135402.db2.gz PNYDILPRCUJIJV-UHFFFAOYSA-N 0 3 401.348 4.360 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)Nc2ccc(C(=O)NC(C)C)c(C)c2)c1 ZINC000517502533 924233146 /nfs/dbraw/zinc/23/31/46/924233146.db2.gz YDCCKMSMWRYPBX-UHFFFAOYSA-N 0 3 410.562 4.037 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1ccc(C(=O)NC(C)C)c(C)c1)c1ccsc1 ZINC000517502883 924233422 /nfs/dbraw/zinc/23/34/22/924233422.db2.gz BTQMMRKYSHWYBP-FQEVSTJZSA-N 0 3 416.591 4.399 20 0 HIADHN C[C@@H]1CN([C@H](CNCc2cc(F)c(F)c(F)c2)c2c(F)cccc2Cl)CCO1 ZINC000517537390 924252099 /nfs/dbraw/zinc/25/20/99/924252099.db2.gz QZKMWQRCSVNQEW-KZULUSFZSA-N 0 3 416.846 4.448 20 0 HIADHN COc1ccc2ccccc2c1CNC(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000517539110 924253218 /nfs/dbraw/zinc/25/32/18/924253218.db2.gz FNFLOHGOANVQTB-GHTZIAJQSA-N 0 3 403.526 4.483 20 0 HIADHN CCCC[NH+]1CCC([N-]S(=O)(=O)c2csc(-c3ccc(Cl)cc3)n2)CC1 ZINC000517580172 926692819 /nfs/dbraw/zinc/69/28/19/926692819.db2.gz CZVFGTWJXXFXON-UHFFFAOYSA-N 0 3 413.996 4.006 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)c1ccc(F)cc1Br ZINC000517600463 926710169 /nfs/dbraw/zinc/71/01/69/926710169.db2.gz YYCHVTSCQFDJOI-QGZVFWFLSA-N 0 3 420.326 4.110 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)Nc1ccc2oc(C3CC3)nc2c1 ZINC000517639618 926746943 /nfs/dbraw/zinc/74/69/43/926746943.db2.gz INOZUVUXTGJVAG-UHFFFAOYSA-N 0 3 404.514 4.246 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1NC(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000517643561 926750408 /nfs/dbraw/zinc/75/04/08/926750408.db2.gz YBLNZNAFAWFTNM-GHTZIAJQSA-N 0 3 403.530 4.446 20 0 HIADHN CN(Cc1cccc(C(F)(F)F)c1)C(=O)CCCN1CCN(c2ccccc2)CC1 ZINC000517717707 926812656 /nfs/dbraw/zinc/81/26/56/926812656.db2.gz ZOZKPSLBYCBVBY-UHFFFAOYSA-N 0 3 419.491 4.266 20 0 HIADHN COc1ccc(Br)cc1-c1nc(CN[C@H](CO)C2CCCC2)cs1 ZINC000517786311 926835640 /nfs/dbraw/zinc/83/56/40/926835640.db2.gz UJRSIQKNMXJARF-MRXNPFEDSA-N 0 3 411.365 4.222 20 0 HIADHN CN(Cc1csc(Br)c1)C(=O)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000517792220 926839084 /nfs/dbraw/zinc/83/90/84/926839084.db2.gz LYDZCHZUMSVTDU-KRWDZBQOSA-N 0 3 422.392 4.489 20 0 HIADHN CC(C)OCCCC(=O)N(Cc1ccccc1Br)C1CCN(C)CC1 ZINC000517792544 926839252 /nfs/dbraw/zinc/83/92/52/926839252.db2.gz XFAALYXYJAYMKW-UHFFFAOYSA-N 0 3 411.384 4.077 20 0 HIADHN CC(=O)Nc1ccc(S[C@@H](C)C(=O)N(CCN(C)C)CC2CCCCC2)cc1 ZINC000517823354 926852729 /nfs/dbraw/zinc/85/27/29/926852729.db2.gz CGLYKBZYCXHVDA-KRWDZBQOSA-N 0 3 405.608 4.096 20 0 HIADHN CCCN1CCC[C@H]1C(=O)NCc1cn(Cc2ccccc2)nc1-c1ccccc1 ZINC000517891916 926878429 /nfs/dbraw/zinc/87/84/29/926878429.db2.gz FKBHHGBNGBXMFJ-QHCPKHFHSA-N 0 3 402.542 4.089 20 0 HIADHN CC(C)Sc1ccc(Cl)cc1NC(=O)C(=O)NC[C@@H](C)N1CCC[C@H](C)C1 ZINC000517951613 926899966 /nfs/dbraw/zinc/89/99/66/926899966.db2.gz YPNFWLRFPJPEBS-LSDHHAIUSA-N 0 3 411.999 4.016 20 0 HIADHN Cc1ccc2[nH]c(SCC(=O)N3CCCN(Cc4ccccc4C)CC3)nc2c1 ZINC000517979228 926925461 /nfs/dbraw/zinc/92/54/61/926925461.db2.gz QNFTYLGCLKNEPJ-UHFFFAOYSA-N 0 3 408.571 4.006 20 0 HIADHN Cc1ccc2nc(SCC(=O)N3CCCN(Cc4ccccc4C)CC3)[nH]c2c1 ZINC000517979228 926925470 /nfs/dbraw/zinc/92/54/70/926925470.db2.gz QNFTYLGCLKNEPJ-UHFFFAOYSA-N 0 3 408.571 4.006 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)c1ccc(OC)c(OC2CCCC2)c1)c1ccco1 ZINC000517992888 926936142 /nfs/dbraw/zinc/93/61/42/926936142.db2.gz RNMCUSYSPZNNSJ-APWZRJJASA-N 0 3 400.519 4.469 20 0 HIADHN C[C@H](NC(=O)N(CCN(C)C)Cc1ccccc1F)c1nc(C(C)(C)C)cs1 ZINC000518030625 926967737 /nfs/dbraw/zinc/96/77/37/926967737.db2.gz QPLPMQAAOKAWFU-HNNXBMFYSA-N 0 3 406.571 4.414 20 0 HIADHN C[C@@H]1CCC[C@@H](C)N1CCNC(=O)CSc1nnc(-c2ccc3ccccc3c2)o1 ZINC000518070695 927004940 /nfs/dbraw/zinc/00/49/40/927004940.db2.gz LWSGCKZYRQQWNE-IAGOWNOFSA-N 0 3 424.570 4.361 20 0 HIADHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)c1ccc2[nH]ccc2c1 ZINC000518076230 927008913 /nfs/dbraw/zinc/00/89/13/927008913.db2.gz YPSVSLUKRIDJKX-UHFFFAOYSA-N 0 3 400.320 4.134 20 0 HIADHN C[C@@H](c1ccc(Cl)cc1Cl)N(C)C(=O)C(=O)Nc1cccc(CN(C)C)c1 ZINC000518090242 927016217 /nfs/dbraw/zinc/01/62/17/927016217.db2.gz VYLLVLDPKLGEMI-ZDUSSCGKSA-N 0 3 408.329 4.213 20 0 HIADHN Cc1cc(C(=O)NC(C)C)ccc1NC(=O)NC[C@H](c1ccccc1)N1CCCC1 ZINC000518170783 927061223 /nfs/dbraw/zinc/06/12/23/927061223.db2.gz FFOVVXOPQZRMRS-JOCHJYFZSA-N 0 3 408.546 4.092 20 0 HIADHN CC[C@H](CNC(=O)Nc1ccc(C(=O)NC(C)C)cc1C)N1CCc2ccccc2C1 ZINC000518172468 927062196 /nfs/dbraw/zinc/06/21/96/927062196.db2.gz MQHQJEVWYBIJSA-JOCHJYFZSA-N 0 3 422.573 4.092 20 0 HIADHN COc1ccc(C[C@@H]2CCCN([C@@H](C)C(=O)N[C@H](C)c3ccccc3OC)C2)cc1 ZINC000518270951 927128428 /nfs/dbraw/zinc/12/84/28/927128428.db2.gz XFASCZPQVUSAEE-DYXWJJEUSA-N 0 3 410.558 4.224 20 0 HIADHN COc1ccccc1C1(CNCc2cc(OC)c(OC)cc2Br)CC1 ZINC000518273972 927131061 /nfs/dbraw/zinc/13/10/61/927131061.db2.gz QVTGUFGRYQTZDQ-UHFFFAOYSA-N 0 3 406.320 4.296 20 0 HIADHN c1ccc(-c2cccc(CNCc3ccccc3OCCN3CCOCC3)c2)cc1 ZINC000518280133 927137393 /nfs/dbraw/zinc/13/73/93/927137393.db2.gz RCHXYNIJSRWEEO-UHFFFAOYSA-N 0 3 402.538 4.354 20 0 HIADHN O=S(=O)(c1cccc(Cl)c1Cl)N1CCN(c2ccnc3ccccc32)CC1 ZINC000518352105 927215644 /nfs/dbraw/zinc/21/56/44/927215644.db2.gz SYAUOJFGQONNJA-UHFFFAOYSA-N 0 3 422.337 4.053 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)N(Cc1ccco1)c1ccccc1 ZINC000518371436 927225516 /nfs/dbraw/zinc/22/55/16/927225516.db2.gz SSZVUNQYXPEOMR-UHFFFAOYSA-N 0 3 403.526 4.415 20 0 HIADHN Cc1ncc(-c2ccc(NC(=O)CCCN3CCN(c4ccccc4)CC3)cc2)o1 ZINC000518372421 927225693 /nfs/dbraw/zinc/22/56/93/927225693.db2.gz UWIQEGCVWZAVFW-UHFFFAOYSA-N 0 3 404.514 4.191 20 0 HIADHN CC(C)Oc1ccc([C@@H](C)NC(=O)N(CCN(C)C)Cc2ccccc2F)cc1 ZINC000518409987 927250935 /nfs/dbraw/zinc/25/09/35/927250935.db2.gz ZJHXWVPGDIKZBN-GOSISDBHSA-N 0 3 401.526 4.447 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)Nc1ccc(C(=O)N2CCC(C)CC2)cc1 ZINC000518417579 927255568 /nfs/dbraw/zinc/25/55/68/927255568.db2.gz DOIKCXBDYAQXFT-UHFFFAOYSA-N 0 3 414.594 4.289 20 0 HIADHN CSc1ccc([C@H](CNC(=O)c2ccc(-c3n[nH]c(C4CC4)n3)cc2)N(C)C)cc1 ZINC000518430476 927264083 /nfs/dbraw/zinc/26/40/83/927264083.db2.gz UXGFHNMVGWMKLV-FQEVSTJZSA-N 0 3 421.570 4.104 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N(C)Cc2cccc(Br)c2)C1 ZINC000518499812 927310097 /nfs/dbraw/zinc/31/00/97/927310097.db2.gz MCJQWLPDOVMDON-UZLBHIALSA-N 0 3 416.363 4.426 20 0 HIADHN CCCN(C)CC(=O)NC[C@@H](c1ccc(SC)cc1)N1CCc2sccc2C1 ZINC000518575759 927355934 /nfs/dbraw/zinc/35/59/34/927355934.db2.gz OTQCIFFWAMDGIF-FQEVSTJZSA-N 0 3 417.644 4.027 20 0 HIADHN COc1cc(-c2ccccc2)sc1C(=O)NCC(C)(C)N1CCC(OC)CC1 ZINC000518611956 927378142 /nfs/dbraw/zinc/37/81/42/927378142.db2.gz QBHKVMPLTUVZNF-UHFFFAOYSA-N 0 3 402.560 4.043 20 0 HIADHN CC1CCN([C@H](CNC(=O)NCCCNc2ccccc2)c2cccs2)CC1 ZINC000518811430 927508382 /nfs/dbraw/zinc/50/83/82/927508382.db2.gz UDQKPWUYVHKDEQ-HXUWFJFHSA-N 0 3 400.592 4.323 20 0 HIADHN CC[C@H](C)Oc1ccc(NC(=O)N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)cc1 ZINC000518838332 927537601 /nfs/dbraw/zinc/53/76/01/927537601.db2.gz CUAGMTYFCKNKOK-GBESFXJTSA-N 0 3 403.567 4.217 20 0 HIADHN C[C@H](CNC(=O)[C@H](C)N(C)CCCc1cc(-c2cccc(F)c2)n[nH]1)c1ccccc1 ZINC000518862454 927567617 /nfs/dbraw/zinc/56/76/17/927567617.db2.gz SGBUXTFZWHJZPZ-MOPGFXCFSA-N 0 3 422.548 4.389 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)NCC1(Sc2ccccc2)CCCC1 ZINC000518861795 927567696 /nfs/dbraw/zinc/56/76/96/927567696.db2.gz ZLSAQIUBAYSXGP-UHFFFAOYSA-N 0 3 412.603 4.260 20 0 HIADHN CN(CCCN1CCN(C)CC1)c1nc(C2CC2)nc2scc(-c3ccccc3)c21 ZINC000518884504 927596409 /nfs/dbraw/zinc/59/64/09/927596409.db2.gz YKOVYNJSTOADFN-UHFFFAOYSA-N 0 3 421.614 4.309 20 0 HIADHN CC(=O)c1cccc(OCC(=O)N(CCN2CCCC2)Cc2ccc(Cl)cc2)c1 ZINC000518941950 927645198 /nfs/dbraw/zinc/64/51/98/927645198.db2.gz NEGQCPVRUWOLBK-UHFFFAOYSA-N 0 3 414.933 4.046 20 0 HIADHN CN(C(=O)c1cccnc1Oc1ccc(Cl)cc1Cl)[C@@H]1CCN(C2CC2)C1 ZINC000518956327 927656013 /nfs/dbraw/zinc/65/60/13/927656013.db2.gz AOHJGDJPRFMWPU-OAHLLOKOSA-N 0 3 406.313 4.489 20 0 HIADHN Cc1ccc(Oc2ccc(NC(=O)C(=O)NC[C@H](C)N3CCCC[C@H]3C)cc2)cc1 ZINC000519048746 927725443 /nfs/dbraw/zinc/72/54/43/927725443.db2.gz ALHFBKWRHINJHK-MOPGFXCFSA-N 0 3 409.530 4.105 20 0 HIADHN COc1ccc([C@@H](Cc2ccc(F)cc2)N[C@H](C)C(=O)Nc2c(C)nn(C)c2C)cc1 ZINC000519064251 927743397 /nfs/dbraw/zinc/74/33/97/927743397.db2.gz PUCXLQPLFJTUDP-OPAMFIHVSA-N 0 3 424.520 4.085 20 0 HIADHN CN1CCC(CNC(=O)c2ccccc2C(=O)c2ccc(Cl)c(Cl)c2)CC1 ZINC000519099183 927769174 /nfs/dbraw/zinc/76/91/74/927769174.db2.gz DDLBJMLMHUDNAG-UHFFFAOYSA-N 0 3 405.325 4.296 20 0 HIADHN COCc1cccc2sc(NC(=O)N[C@@H]3CCN([C@@H](C)c4ccccc4)C3)nc21 ZINC000519197403 927822692 /nfs/dbraw/zinc/82/26/92/927822692.db2.gz BECMDHJXIHFANC-MAUKXSAKSA-N 0 3 410.543 4.400 20 0 HIADHN C[C@@H](O)CN(CC(=O)N1N=C(c2ccco2)C[C@@H]1c1cccs1)C1CCCCC1 ZINC000519201639 927824358 /nfs/dbraw/zinc/82/43/58/927824358.db2.gz RMZHCAIVXKUIEE-VQIMIIECSA-N 0 3 415.559 4.034 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)Nc1ccc(C(=O)NC(C)(C)C)cc1 ZINC000519210412 927829107 /nfs/dbraw/zinc/82/91/07/927829107.db2.gz AWJNYQKWUFMXFS-UHFFFAOYSA-N 0 3 424.589 4.243 20 0 HIADHN COc1ccc(C(C)(C)CN[C@@H](C(=O)N2CCCCC2)c2ccccc2)cc1OC ZINC000519281856 927862272 /nfs/dbraw/zinc/86/22/72/927862272.db2.gz NVYRHOHMKCVHRK-HSZRJFAPSA-N 0 3 410.558 4.325 20 0 HIADHN COc1ccc(Cl)cc1NCCC(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000519432314 927943921 /nfs/dbraw/zinc/94/39/21/927943921.db2.gz DPJVUVBIXIGRTR-VQIMIIECSA-N 0 3 401.938 4.102 20 0 HIADHN O=C(N[C@@H]1CCOc2c(Cl)cccc21)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000519432593 927944427 /nfs/dbraw/zinc/94/44/27/927944427.db2.gz XIIYLJPHIUROGG-OXQOHEQNSA-N 0 3 402.897 4.331 20 0 HIADHN COc1cc(CN(Cc2ccccc2)[C@H](C)CN2CCOCC2)ccc1OC(F)F ZINC000519442648 927951809 /nfs/dbraw/zinc/95/18/09/927951809.db2.gz SVMXJHJLAKMUNB-GOSISDBHSA-N 0 3 420.500 4.020 20 0 HIADHN Cc1cccc(C)c1NC(=O)CN[C@@H]1CCN(C(C)C)[C@@H]1c1ccc(F)c(F)c1 ZINC000519835282 928086550 /nfs/dbraw/zinc/08/65/50/928086550.db2.gz FVVZZQLSAUFTKJ-NFBKMPQASA-N 0 3 401.501 4.334 20 0 HIADHN C[C@H](N[C@H](Cc1ccccc1Cl)c1ccccc1)C(=O)Nc1ccc(C(N)=O)cc1 ZINC000519876127 928110599 /nfs/dbraw/zinc/11/05/99/928110599.db2.gz WDSOPOGLQXDDCD-KSFYIVLOSA-N 0 3 421.928 4.340 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCCc1cccnc1)c1ccc(C(F)(F)F)cc1 ZINC000519950863 928182581 /nfs/dbraw/zinc/18/25/81/928182581.db2.gz HEJBARLOUINJRN-LJQANCHMSA-N 0 3 408.468 4.025 20 0 HIADHN COc1ccc(COC[C@@H](O)CN2CCC[C@@H]2Cc2c(F)cccc2Cl)cc1 ZINC000519968416 928197761 /nfs/dbraw/zinc/19/77/61/928197761.db2.gz DIQUZODESCLWPY-MSOLQXFVSA-N 0 3 407.913 4.072 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)NCc2cccc(COCc3ccco3)c2)N(C)C)cc1 ZINC000520071467 928293063 /nfs/dbraw/zinc/29/30/63/928293063.db2.gz LKZQZWYRISVDIW-XMMPIXPASA-N 0 3 421.541 4.407 20 0 HIADHN COc1ccccc1OCc1ccc(C(=O)N(CCN(C)C)Cc2ccccc2)o1 ZINC000520105402 928313347 /nfs/dbraw/zinc/31/33/47/928313347.db2.gz JFCAOJCOYOPGRW-UHFFFAOYSA-N 0 3 408.498 4.071 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)NCCc1csc2ccccc12 ZINC000520130597 928328349 /nfs/dbraw/zinc/32/83/49/928328349.db2.gz PXHGAXUOENEFIJ-UHFFFAOYSA-N 0 3 417.525 4.495 20 0 HIADHN CC(C)OCc1ccc(NC(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)cc1 ZINC000520131355 928328898 /nfs/dbraw/zinc/32/88/98/928328898.db2.gz KGTZYAVDWCEYRJ-UHFFFAOYSA-N 0 3 405.489 4.486 20 0 HIADHN Clc1cc(CNC2(c3ccc4c(c3)OCCO4)CCCC2)cc2c1OCCO2 ZINC000520213333 928392139 /nfs/dbraw/zinc/39/21/39/928392139.db2.gz XNKDWKINGYFKBZ-UHFFFAOYSA-N 0 3 401.890 4.442 20 0 HIADHN CCCN(CC)C(=O)NCCCCN1CCN(c2cccc(C(F)(F)F)c2)CC1 ZINC000520214768 928393842 /nfs/dbraw/zinc/39/38/42/928393842.db2.gz BVKQXRLAMUVWQG-UHFFFAOYSA-N 0 3 414.516 4.049 20 0 HIADHN CCn1c(CNCCCN2CCN(c3ccccc3Cl)CC2)nc2ccccc21 ZINC000520217122 928394931 /nfs/dbraw/zinc/39/49/31/928394931.db2.gz IIEMGYOUMVIBJJ-UHFFFAOYSA-N 0 3 411.981 4.012 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)c(Cl)c1 ZINC000520241429 928410216 /nfs/dbraw/zinc/41/02/16/928410216.db2.gz SCYVCDFFRBNMKK-UHFFFAOYSA-N 0 3 424.879 4.172 20 0 HIADHN C[C@H](Oc1ccc2c(c1)CCC2)C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000520302167 928464881 /nfs/dbraw/zinc/46/48/81/928464881.db2.gz CNYBDCWESXWVGB-SFHVURJKSA-N 0 3 410.583 4.173 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)NCc1ccc(F)cc1C(F)(F)F ZINC000520305164 928466909 /nfs/dbraw/zinc/46/69/09/928466909.db2.gz XBPRMGWWWZITEA-UHFFFAOYSA-N 0 3 423.454 4.063 20 0 HIADHN CCCC(=O)Nc1cccc(NC(=O)CCCN2CCN(c3ccccc3)CC2)c1C ZINC000520325611 928490052 /nfs/dbraw/zinc/49/00/52/928490052.db2.gz ZUOBYVYIGOZBEX-UHFFFAOYSA-N 0 3 422.573 4.275 20 0 HIADHN COc1cc(OC)c(OC)cc1CN[C@H]1CCCN(Cc2ccc(F)cc2Cl)C1 ZINC000520390217 928542665 /nfs/dbraw/zinc/54/26/65/928542665.db2.gz QALUZTKINRLUGA-SFHVURJKSA-N 0 3 422.928 4.259 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)NCc1ccc(-c2ccccc2)o1 ZINC000520398807 928547972 /nfs/dbraw/zinc/54/79/72/928547972.db2.gz RNKXDKDHPITHAG-UHFFFAOYSA-N 0 3 403.526 4.165 20 0 HIADHN C[C@H](N[C@H]1CCN(C(C)(C)C)[C@H]1c1ccc(Cl)c(F)c1)C(=O)Nc1nccs1 ZINC000520433249 928562375 /nfs/dbraw/zinc/56/23/75/928562375.db2.gz NCLUHGTVGZBXDV-ZLIFDBKOSA-N 0 3 424.973 4.466 20 0 HIADHN COc1ccc([C@@H](Cc2ccccc2)NCc2ccc(S(=O)(=O)N(C)C)cc2)cc1 ZINC000520463051 928579188 /nfs/dbraw/zinc/57/91/88/928579188.db2.gz NWGFJFYVOKZQDF-XMMPIXPASA-N 0 3 424.566 4.019 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N(C)C[C@@H]1CCCCO1)c1ccc(C(F)(F)F)cc1 ZINC000520474206 928586917 /nfs/dbraw/zinc/58/69/17/928586917.db2.gz WDUAQBJBQASEKZ-OALUTQOASA-N 0 3 415.500 4.299 20 0 HIADHN COc1ccc([C@@H](CNC(=O)NCc2ccc3[nH]c(C)c(C)c3c2)N2CCCC2)cc1 ZINC000520476165 928588678 /nfs/dbraw/zinc/58/86/78/928588678.db2.gz GHPGUJCRNXAPQU-XMMPIXPASA-N 0 3 420.557 4.430 20 0 HIADHN O=C([C@H](Sc1ccc(F)cc1F)c1ccccc1)N1CC[C@@H](N2CCCC2)C1 ZINC000520689103 928736954 /nfs/dbraw/zinc/73/69/54/928736954.db2.gz HMTISSMDEXWTMH-WIYYLYMNSA-N 0 3 402.510 4.495 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2cc(F)ccc2OC[C@H]2CCCO2)N(C)C)cc1 ZINC000520786766 928817345 /nfs/dbraw/zinc/81/73/45/928817345.db2.gz HGJQCOFAKNMKQO-CTNGQTDRSA-N 0 3 415.509 4.116 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2cc(N3CCCC3=O)ccc2Cl)N(C)C)cc1 ZINC000520830260 928836155 /nfs/dbraw/zinc/83/61/55/928836155.db2.gz XJPNDHVSCUECRO-FQEVSTJZSA-N 0 3 414.937 4.200 20 0 HIADHN O=C(CCCCOc1ccc(Br)cc1)N1CCN(C2CCCC2)CC1 ZINC000520862010 928848803 /nfs/dbraw/zinc/84/88/03/928848803.db2.gz NUDNBHBIHMZFGD-UHFFFAOYSA-N 0 3 409.368 4.085 20 0 HIADHN Cc1cc(NC(=O)c2cccc(F)c2)sc1C(=O)NC[C@H](C)N1CCC(C)CC1 ZINC000520867766 928852409 /nfs/dbraw/zinc/85/24/09/928852409.db2.gz NRKSAABQVURNIY-INIZCTEOSA-N 0 3 417.550 4.298 20 0 HIADHN CN(C)Cc1ccc(C(=O)Nc2cccc(C(=O)Nc3ccc(Cl)cn3)c2)cc1 ZINC000521038610 928953255 /nfs/dbraw/zinc/95/32/55/928953255.db2.gz ZKOSETJTBYTCTJ-UHFFFAOYSA-N 0 3 408.889 4.301 20 0 HIADHN C[C@H](NC(=O)N(CCN(C)C)Cc1cccc(F)c1)c1ccccc1OC(F)F ZINC000521068582 928970846 /nfs/dbraw/zinc/97/08/46/928970846.db2.gz AGPTWJALZDPCSV-HNNXBMFYSA-N 0 3 409.452 4.262 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)N[C@H]1CCCOc2ccc(F)cc21 ZINC000521070487 928971843 /nfs/dbraw/zinc/97/18/43/928971843.db2.gz YBRWLTIKESCMLH-FQEVSTJZSA-N 0 3 421.463 4.091 20 0 HIADHN O=C(c1cccc(CN2CCCC2)c1)N1CCC(CN2CCc3ccccc32)CC1 ZINC000521151379 929026675 /nfs/dbraw/zinc/02/66/75/929026675.db2.gz JLEGAWQJNFTIRN-UHFFFAOYSA-N 0 3 403.570 4.197 20 0 HIADHN C[C@@H](CNC(=O)N(C)CCCc1cc(-c2ccccc2)n[nH]1)N(C)Cc1ccccc1 ZINC000521163878 929036392 /nfs/dbraw/zinc/03/63/92/929036392.db2.gz FVPBTJNILNYLMQ-FQEVSTJZSA-N 0 3 419.573 4.171 20 0 HIADHN COCCN1CCC(NC(=O)c2sc3cc(C(F)(F)F)ccc3c2Cl)CC1 ZINC000521257171 929084927 /nfs/dbraw/zinc/08/49/27/929084927.db2.gz DYVCYAZWZGLRFV-UHFFFAOYSA-N 0 3 420.884 4.414 20 0 HIADHN Cn1cc(C(=O)NC[C@H](c2cccs2)N2CCCC2)c(-c2ccccc2Cl)n1 ZINC000521263303 929088809 /nfs/dbraw/zinc/08/88/09/929088809.db2.gz DAPBKPFZIQBHML-GOSISDBHSA-N 0 3 414.962 4.369 20 0 HIADHN CC1(C)CN(C2(CNC(=O)N[C@H]3CCCOc4ccccc43)CCCCC2)CCO1 ZINC000521301415 929111261 /nfs/dbraw/zinc/11/12/61/929111261.db2.gz PEAFKOVQPVOKCV-FQEVSTJZSA-N 0 3 415.578 4.013 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)N(C1CC1)[C@@H]1CCc2ccccc21 ZINC000521358824 929180150 /nfs/dbraw/zinc/18/01/50/929180150.db2.gz ASMIGJOBAWKPAA-RUZDIDTESA-N 0 3 403.570 4.267 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2ccc(C(=O)N3CCCC[C@@H]3C)cc2)N(C)C)cc1 ZINC000521468107 929235661 /nfs/dbraw/zinc/23/56/61/929235661.db2.gz QVWUHDOSHWDSHU-WMZHIEFXSA-N 0 3 422.573 4.434 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)N[C@H]1CCCOc2ccc(F)cc21 ZINC000521475510 929239811 /nfs/dbraw/zinc/23/98/11/929239811.db2.gz FZNNOWHEEAQABP-QFIPXVFZSA-N 0 3 413.537 4.245 20 0 HIADHN COc1ccc(CN(Cc2cc(OC)c(O)c(OC)c2)[C@@H](C)C2CC2)c(OC)c1 ZINC000521511807 929265008 /nfs/dbraw/zinc/26/50/08/929265008.db2.gz CPQBXRKBPABYQB-HNNXBMFYSA-N 0 3 401.503 4.227 20 0 HIADHN COc1ccc(OC(F)F)c(NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)c1 ZINC000521602235 929323757 /nfs/dbraw/zinc/32/37/57/929323757.db2.gz UNLUVOTZCFKJAZ-OAHLLOKOSA-N 0 3 408.420 4.286 20 0 HIADHN COc1ccc([C@H](C)NC(=O)N(CCN(C)C)Cc2cccc(Cl)c2)cc1F ZINC000521678251 929362122 /nfs/dbraw/zinc/36/21/22/929362122.db2.gz NYTXVONBVOMWLJ-HNNXBMFYSA-N 0 3 407.917 4.322 20 0 HIADHN C[C@H](CCc1ccc(O)cc1)NC(=O)N(CCN(C)C)Cc1cccc(Cl)c1 ZINC000521687039 929367043 /nfs/dbraw/zinc/36/70/43/929367043.db2.gz FOQFDIYISKULKR-QGZVFWFLSA-N 0 3 403.954 4.140 20 0 HIADHN O=C(CSc1nnc(-c2ccc3ccccc3c2)o1)N1CC[C@@H](N2CCCCC2)C1 ZINC000521692167 929369476 /nfs/dbraw/zinc/36/94/76/929369476.db2.gz VNJDXCWALLNXSN-HXUWFJFHSA-N 0 3 422.554 4.069 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)Nc1nc2c(s1)CCCCC2 ZINC000521693438 929369909 /nfs/dbraw/zinc/36/99/09/929369909.db2.gz YPAYVYNBSJATLY-UHFFFAOYSA-N 0 3 408.518 4.286 20 0 HIADHN O=C(CN1CCCCC[C@@H]1c1ccccc1)NCC1(c2ccccc2)CCOCC1 ZINC000521814557 929471915 /nfs/dbraw/zinc/47/19/15/929471915.db2.gz CCUSLZWYEMUDKQ-XMMPIXPASA-N 0 3 406.570 4.468 20 0 HIADHN O=C(CN(CCc1ccccc1F)C1CCCC1)NC[C@@H]1CCN(c2ccccc2)C1 ZINC000521815555 929474887 /nfs/dbraw/zinc/47/48/87/929474887.db2.gz NBODQFOFLWXENV-NRFANRHFSA-N 0 3 423.576 4.256 20 0 HIADHN COc1ccc(C[C@@H](NCc2cnc3n[nH]c(C)c3c2)c2ccc(OC)cc2)cc1 ZINC000521820899 929477568 /nfs/dbraw/zinc/47/75/68/929477568.db2.gz QDXXSYCYJZNDGQ-HSZRJFAPSA-N 0 3 402.498 4.357 20 0 HIADHN COc1ccccc1C[C@@H]1CCCN1C(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000521832016 929483598 /nfs/dbraw/zinc/48/35/98/929483598.db2.gz OEEMVSKTEPBSNA-PMOQBDJRSA-N 0 3 407.558 4.247 20 0 HIADHN CC[C@H]1CCCCN1C(=O)[C@@H](C)N(C)CCCc1cc(-c2cccc(F)c2)n[nH]1 ZINC000521879224 929527552 /nfs/dbraw/zinc/52/75/52/929527552.db2.gz ZUPXPVWNHYJMEL-UTKZUKDTSA-N 0 3 400.542 4.260 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)c1cnn(-c2ccc(C)cc2)c1C ZINC000521883226 929532560 /nfs/dbraw/zinc/53/25/60/929532560.db2.gz MMIQMXRLHFGUQL-QHCPKHFHSA-N 0 3 417.557 4.011 20 0 HIADHN COc1cccc(NC(=O)[C@@H](NC[C@@H](C)N(C)Cc2ccccc2)c2ccccc2)c1 ZINC000522057019 929625568 /nfs/dbraw/zinc/62/55/68/929625568.db2.gz XUVBNUJFHLASIB-NLFFAJNJSA-N 0 3 417.553 4.485 20 0 HIADHN Cc1cc(C)n(-c2cccc(NC(=O)NC[C@H]3CCCN3Cc3ccccc3)c2)n1 ZINC000524483274 929632809 /nfs/dbraw/zinc/63/28/09/929632809.db2.gz MIOPTXBJKOVLCW-HSZRJFAPSA-N 0 3 403.530 4.275 20 0 HIADHN Cc1ccc(NC(=O)NCC(C)(C)N2CCc3ccccc3C2)cc1C(=O)NC(C)C ZINC000524580849 929697310 /nfs/dbraw/zinc/69/73/10/929697310.db2.gz BUXCBOMJQLAVDA-UHFFFAOYSA-N 0 3 422.573 4.092 20 0 HIADHN CCN(Cc1ccc(OC)c(OC)c1)C(=O)CN1C[C@H](c2ccccc2C)C[C@H]1C ZINC000524595900 929705070 /nfs/dbraw/zinc/70/50/70/929705070.db2.gz ZBBRAPAIGROLHF-TZIWHRDSSA-N 0 3 410.558 4.239 20 0 HIADHN C[C@@H](NC(=O)NCCCN1CCc2ccccc2C1)c1ncc(-c2ccccc2)o1 ZINC000524611591 929721345 /nfs/dbraw/zinc/72/13/45/929721345.db2.gz BFNOPXLCAJOPED-GOSISDBHSA-N 0 3 404.514 4.150 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1ccn(Cc2ccccc2)n1 ZINC000524623913 929732560 /nfs/dbraw/zinc/73/25/60/929732560.db2.gz WWFROXBGBOZILV-HXUWFJFHSA-N 0 3 403.530 4.060 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)N1CCc2c(Br)cccc2C1 ZINC000524712796 929807821 /nfs/dbraw/zinc/80/78/21/929807821.db2.gz HOBBRKFNWAQVLX-UHFFFAOYSA-N 0 3 413.315 4.455 20 0 HIADHN CC[C@@H]1CCCCN1CCNC(=O)[C@H](C)CC(=O)c1cccc(Br)c1 ZINC000524714017 929808437 /nfs/dbraw/zinc/80/84/37/929808437.db2.gz UGAOBRZEOLAHBQ-CRAIPNDOSA-N 0 3 409.368 4.039 20 0 HIADHN C[C@H](SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)NCCN1CC[C@@H](C)C1 ZINC000524720405 929809518 /nfs/dbraw/zinc/80/95/18/929809518.db2.gz PCGMXINHHFSPSZ-CABCVRRESA-N 0 3 407.967 4.075 20 0 HIADHN COc1cccc([C@@H](CNC(=O)NCc2ccc3ccccc3c2)N2CCCC2)c1 ZINC000524779909 929827329 /nfs/dbraw/zinc/82/73/29/929827329.db2.gz PVWBBAISKUUJMT-XMMPIXPASA-N 0 3 403.526 4.485 20 0 HIADHN O=C(Nc1ccc(Oc2ccc(Cl)cc2)nc1)[C@@]1(O)CCN(Cc2ccccc2)C1 ZINC000524796806 929832082 /nfs/dbraw/zinc/83/20/82/929832082.db2.gz PIXNJQDGHMWJJB-HSZRJFAPSA-N 0 3 423.900 4.103 20 0 HIADHN COCCN1CCC(NC(=O)N[C@@H](C)c2ccccc2-c2ccc(Cl)cc2)CC1 ZINC000524801717 929835113 /nfs/dbraw/zinc/83/51/13/929835113.db2.gz LFHCHOCNDCMUSQ-KRWDZBQOSA-N 0 3 415.965 4.478 20 0 HIADHN O=C(CSc1ccccc1Cl)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000524817775 929842453 /nfs/dbraw/zinc/84/24/53/929842453.db2.gz USAZZVQCBLJPLK-UHFFFAOYSA-N 0 3 422.953 4.231 20 0 HIADHN CCOC(=O)CCc1ccc(NC(=O)NCC(C)(C)N2CCc3ccccc3C2)cc1 ZINC000524829443 929848773 /nfs/dbraw/zinc/84/87/73/929848773.db2.gz PATRZZGNEYZOGN-UHFFFAOYSA-N 0 3 423.557 4.141 20 0 HIADHN CCCN(CC)C(=O)c1ccc(C(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)cc1 ZINC000524866522 929864583 /nfs/dbraw/zinc/86/45/83/929864583.db2.gz CMPHWZPAWBYMSI-OAQYLSRUSA-N 0 3 421.585 4.295 20 0 HIADHN C/C=C\c1ccc(OCC(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)c(OC)c1 ZINC000524866114 929864769 /nfs/dbraw/zinc/86/47/69/929864769.db2.gz YINMSFDSCRJRBO-WVPUOPKMSA-N 0 3 408.542 4.230 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)c1ccc(N2CCCCCC2)nc1 ZINC000524868203 929865278 /nfs/dbraw/zinc/86/52/78/929865278.db2.gz JNIDCHITYKTDDY-NRFANRHFSA-N 0 3 406.574 4.199 20 0 HIADHN CCCNC(=O)c1cccc(C(=O)N(CC)[C@H]2CCN([C@H](C)c3ccccc3)C2)c1 ZINC000524939927 929901322 /nfs/dbraw/zinc/90/13/22/929901322.db2.gz CQMCJZFMTYGNKV-XXBNENTESA-N 0 3 407.558 4.124 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)[C@@H]1C[C@H]1c1ccccc1OC(F)(F)F ZINC000524969343 929933961 /nfs/dbraw/zinc/93/39/61/929933961.db2.gz WAMZMXOAIGBDOE-YSIASYRMSA-N 0 3 418.459 4.470 20 0 HIADHN COc1ccc(Br)cc1CNCCc1nc(-c2ccncc2)cs1 ZINC000524970304 929934481 /nfs/dbraw/zinc/93/44/81/929934481.db2.gz ZVNJCVNTMSCNIC-UHFFFAOYSA-N 0 3 404.333 4.309 20 0 HIADHN CN(C)Cc1cccc(C(=O)Nc2ccc(Oc3cccc(S(C)(=O)=O)c3)cc2)c1 ZINC000524973949 929939197 /nfs/dbraw/zinc/93/91/97/929939197.db2.gz QBZMUEQVVUPQNI-UHFFFAOYSA-N 0 3 424.522 4.196 20 0 HIADHN CN(C)Cc1cccc(C(=O)Nc2cc(-c3cc(F)cc(Br)c3)[nH]n2)c1 ZINC000524976854 929942322 /nfs/dbraw/zinc/94/23/22/929942322.db2.gz QKLOUHYDGLFGQC-UHFFFAOYSA-N 0 3 417.282 4.292 20 0 HIADHN C[C@H](O)CN(Cc1ccccc1)C(=O)NC[C@@H](c1ccccc1)N1CCC(C)CC1 ZINC000524981301 929946608 /nfs/dbraw/zinc/94/66/08/929946608.db2.gz QCBWFDBAVBAJKZ-URXFXBBRSA-N 0 3 409.574 4.052 20 0 HIADHN CC(C)C(=O)Nc1ccc(Cl)c(C(=O)NCCCN2CCc3ccccc3C2)c1 ZINC000525066506 930013474 /nfs/dbraw/zinc/01/34/74/930013474.db2.gz UOBLDVZIUNWKCA-UHFFFAOYSA-N 0 3 413.949 4.113 20 0 HIADHN CCN(CC)C(=O)c1cccc(NC(=O)[C@H](C)N2CC[C@@H](Cc3ccccc3)C2)c1 ZINC000525125912 930050803 /nfs/dbraw/zinc/05/08/03/930050803.db2.gz LBTZSFNDZXPWRB-FPOVZHCZSA-N 0 3 407.558 4.060 20 0 HIADHN C[C@H](CC(=O)c1cccc(Br)c1)C(=O)NCCN1[C@@H](C)CCC[C@@H]1C ZINC000525242910 930102371 /nfs/dbraw/zinc/10/23/71/930102371.db2.gz CUQWUBFRRXPEGU-PMPSAXMXSA-N 0 3 409.368 4.037 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)N1CCC(OCC2CCCCC2)CC1 ZINC000525247660 930104558 /nfs/dbraw/zinc/10/45/58/930104558.db2.gz JHFFKGYNQNHIBU-UHFFFAOYSA-N 0 3 413.606 4.206 20 0 HIADHN CC(C)(CNC(=O)NCc1ccc(-c2ccncc2)cc1)N1CCc2ccccc2C1 ZINC000525320186 930159083 /nfs/dbraw/zinc/15/90/83/930159083.db2.gz BMQIXOYIMAAXGA-UHFFFAOYSA-N 0 3 414.553 4.385 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)NCc1ccccc1OCC1CC1 ZINC000525321023 930159702 /nfs/dbraw/zinc/15/97/02/930159702.db2.gz XYWNZPARDTVHLZ-UHFFFAOYSA-N 0 3 417.500 4.027 20 0 HIADHN Cc1c2cccc(C)c2oc1C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000525335345 930170386 /nfs/dbraw/zinc/17/03/86/930170386.db2.gz WGDMBYOGPDOWGR-UHFFFAOYSA-N 0 3 410.489 4.462 20 0 HIADHN C[C@@H](c1ccccc1)N(CC(=O)Nc1ccc(CN2CCOCC2)cc1)CC1CCC1 ZINC000525409797 930223855 /nfs/dbraw/zinc/22/38/55/930223855.db2.gz OXHAZTDAYSCYJR-NRFANRHFSA-N 0 3 421.585 4.321 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1cccc(OC[C@@H]2CCCO2)c1 ZINC000525415276 930227642 /nfs/dbraw/zinc/22/76/42/930227642.db2.gz IYNKIJINALTCQQ-RDPSFJRHSA-N 0 3 423.557 4.373 20 0 HIADHN COc1cc(C)c(CN(C)CCc2nc(-c3ccc(Cl)cc3)no2)cc1OC ZINC000525421517 930231625 /nfs/dbraw/zinc/23/16/25/930231625.db2.gz QXGRRUNQVHTCIJ-UHFFFAOYSA-N 0 3 401.894 4.390 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)N[C@H]1C[C@@H]1c1c(F)cccc1Cl ZINC000525423509 930233243 /nfs/dbraw/zinc/23/32/43/930233243.db2.gz AVTRGSNFOOSCKK-RXVVDRJESA-N 0 3 415.940 4.054 20 0 HIADHN CCCNC(=O)c1cccc(C(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)c1 ZINC000525430228 930235094 /nfs/dbraw/zinc/23/50/94/930235094.db2.gz RMXCNXQMRQGTHA-FQEVSTJZSA-N 0 3 413.587 4.091 20 0 HIADHN Cc1cccc(NC2CCN(C(=O)N[C@H]3CCN([C@@H](C)c4ccccc4)C3)CC2)c1 ZINC000525498488 930285135 /nfs/dbraw/zinc/28/51/35/930285135.db2.gz ZBSNTLVWSKGXGR-RDPSFJRHSA-N 0 3 406.574 4.416 20 0 HIADHN Cc1cc(C)cc(C2(C(=O)Nc3ccc(C(=O)N(C)[C@@H]4CCCN(C)C4)cc3)CC2)c1 ZINC000525581509 930344514 /nfs/dbraw/zinc/34/45/14/930344514.db2.gz CQVFPIYYAYTHHH-HSZRJFAPSA-N 0 3 419.569 4.140 20 0 HIADHN CC(C)(C)CC(=O)Nc1ccc(CC(=O)N2CCCN(Cc3ccccc3)CC2)cc1 ZINC000525585449 930347317 /nfs/dbraw/zinc/34/73/17/930347317.db2.gz SJOQCDVPDHDBOO-UHFFFAOYSA-N 0 3 421.585 4.338 20 0 HIADHN Cc1ccc(-c2nn(Cc3ccccc3)cc2C(=O)N(C)[C@H]2CCCN(C)C2)cc1 ZINC000525618268 930364850 /nfs/dbraw/zinc/36/48/50/930364850.db2.gz RCDDKDPYPNGLIL-QFIPXVFZSA-N 0 3 402.542 4.073 20 0 HIADHN C[C@H](NC(=O)[C@H](C)N1CC[C@@H](c2ccccc2)[C@@H](C)C1)c1ccc2c(c1)OCCO2 ZINC000525635836 930376212 /nfs/dbraw/zinc/37/62/12/930376212.db2.gz SHMHOYBEMBAOAG-ZVVDCOBXSA-N 0 3 408.542 4.149 20 0 HIADHN CC[C@H](Cc1ccccc1)N(C)CC(=O)N1CCC[C@H]1c1cc(OC)ccc1OC ZINC000525638574 930378018 /nfs/dbraw/zinc/37/80/18/930378018.db2.gz RTJFYBVWCNMZFL-OFNKIYASSA-N 0 3 410.558 4.320 20 0 HIADHN COc1cc(C(=O)N(CCN2CCCC2)c2ccccc2)cc(OC)c1OC(F)F ZINC000525720990 930415322 /nfs/dbraw/zinc/41/53/22/930415322.db2.gz AEKWVAATPBZJBH-UHFFFAOYSA-N 0 3 420.456 4.048 20 0 HIADHN C[C@@H]1CCN(C(=O)NCCc2ccc(OC(F)F)cc2)CCN1Cc1ccccc1 ZINC000525754223 930430563 /nfs/dbraw/zinc/43/05/63/930430563.db2.gz XXRNASASHVYVNP-GOSISDBHSA-N 0 3 417.500 4.137 20 0 HIADHN C[C@H]1CN(Cc2cccc(NC(=O)c3oc4ccccc4c3CN(C)C)c2)C[C@H](C)O1 ZINC000525759009 930433001 /nfs/dbraw/zinc/43/30/01/930433001.db2.gz MSXPESJOZIYTNW-ROUUACIJSA-N 0 3 421.541 4.356 20 0 HIADHN O=C(CC1(N2CCOCC2)CCCC1)NC(c1ccc(F)cc1)c1ccc(F)cc1 ZINC000525826078 930459070 /nfs/dbraw/zinc/45/90/70/930459070.db2.gz RNFFYOXINPVSIZ-UHFFFAOYSA-N 0 3 414.496 4.206 20 0 HIADHN CC(C)[C@@H](CC(F)(F)F)NC(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000525841041 930462020 /nfs/dbraw/zinc/46/20/20/930462020.db2.gz ZSNMYPAZTRVOAT-QGZVFWFLSA-N 0 3 403.514 4.376 20 0 HIADHN COc1ccc([C@H](CCn2cncn2)NCc2ccc(OC(F)(F)F)cc2)cc1 ZINC000525858187 930469276 /nfs/dbraw/zinc/46/92/76/930469276.db2.gz KFVDKBPMFGCVLG-IBGZPJMESA-N 0 3 406.408 4.107 20 0 HIADHN CCN(C(=O)C(=O)Nc1cc(F)ccc1Cl)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000526123238 930539585 /nfs/dbraw/zinc/53/95/85/930539585.db2.gz RGGGKKVAHHRYQP-QAPCUYQASA-N 0 3 417.912 4.102 20 0 HIADHN C[C@@H](NCC(=O)Nc1ccc(CN2CCOCC2)cc1)c1cc2ccccc2s1 ZINC000526944949 930554167 /nfs/dbraw/zinc/55/41/67/930554167.db2.gz VLHBRSAQVGEMSO-QGZVFWFLSA-N 0 3 409.555 4.023 20 0 HIADHN Cc1ccccc1[C@H]([C@H](C)NC(=O)C(=O)Nc1ccc2oc(C(C)C)nc2c1)N(C)C ZINC000526957891 930558279 /nfs/dbraw/zinc/55/82/79/930558279.db2.gz VXJKDDJCEIZZAW-KKSFZXQISA-N 0 3 422.529 4.006 20 0 HIADHN CC(C)c1nc2c([nH]1)C[C@@H](C(=O)NC[C@H](c1ccccc1Cl)N1CCCC1)CC2 ZINC000526967376 930559651 /nfs/dbraw/zinc/55/96/51/930559651.db2.gz GAMWCVKBLSPKBL-HRAATJIYSA-N 0 3 414.981 4.245 20 0 HIADHN CC(C)c1nc2c([nH]1)CC[C@H](C(=O)NC[C@H](c1ccccc1Cl)N1CCCC1)C2 ZINC000526967376 930559655 /nfs/dbraw/zinc/55/96/55/930559655.db2.gz GAMWCVKBLSPKBL-HRAATJIYSA-N 0 3 414.981 4.245 20 0 HIADHN C[C@H](NCC(=O)N1CCC(C(=O)Nc2ccccc2)CC1)c1cc2ccccc2s1 ZINC000527193861 930609339 /nfs/dbraw/zinc/60/93/39/930609339.db2.gz ZZJCGHHJNOCRRU-KRWDZBQOSA-N 0 3 421.566 4.429 20 0 HIADHN Fc1cccnc1N1CC[C@H](N[C@H](c2ccc(Br)cc2F)C2CC2)C1 ZINC000527282920 930626240 /nfs/dbraw/zinc/62/62/40/930626240.db2.gz PWUMIYGTRBNXRY-KSSFIOAISA-N 0 3 408.290 4.442 20 0 HIADHN CC(C)(C)[C@@H](CN1CCc2ccccc2C1)NC(=O)c1c[nH]c(=O)c2ccccc12 ZINC000527294284 930628804 /nfs/dbraw/zinc/62/88/04/930628804.db2.gz CLSZGHYRFPOWIK-JOCHJYFZSA-N 0 3 403.526 4.143 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CN[C@@H](CCn1cncn1)c1ccc(C)cc1 ZINC000527349058 930643271 /nfs/dbraw/zinc/64/32/71/930643271.db2.gz OWACUTIHQMNHHF-VWLOTQADSA-N 0 3 414.557 4.369 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2ccc(OC(F)F)c3ncccc23)[C@H]1c1ccccc1 ZINC000530462024 930717585 /nfs/dbraw/zinc/71/75/85/930717585.db2.gz GFYAPXMRLBRJIJ-YLJYHZDGSA-N 0 3 412.440 4.403 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)c(C(F)(F)F)c1 ZINC000530515300 930732371 /nfs/dbraw/zinc/73/23/71/930732371.db2.gz VLMGWAUDLOZQQM-MOPGFXCFSA-N 0 3 420.435 4.231 20 0 HIADHN COc1ccc(CN(Cc2ccccc2)C(=O)CC2(N3CCOCC3)CCCC2)cc1 ZINC000530569241 930752680 /nfs/dbraw/zinc/75/26/80/930752680.db2.gz AJBSNSGLCUPXOQ-UHFFFAOYSA-N 0 3 422.569 4.259 20 0 HIADHN Cc1ccc(C(=O)Nc2ccccc2)cc1NC(=O)CC1(N2CCOCC2)CCCC1 ZINC000530572726 930754883 /nfs/dbraw/zinc/75/48/83/930754883.db2.gz BTRYWVIVIYKALR-UHFFFAOYSA-N 0 3 421.541 4.221 20 0 HIADHN Cc1noc(CSc2ccc(-c3nc(-c4ccc(CN(C)C)cc4)no3)cc2)n1 ZINC000530632174 930779144 /nfs/dbraw/zinc/77/91/44/930779144.db2.gz JNMPQFQWTOYZLV-UHFFFAOYSA-N 0 3 407.499 4.449 20 0 HIADHN COc1cc2c(cc1CNCCC(=O)Nc1cc(C)c(Cl)cc1OC)O[C@@H](C)C2 ZINC000530631026 930779293 /nfs/dbraw/zinc/77/92/93/930779293.db2.gz JYPQSTUWRSVPJH-AWEZNQCLSA-N 0 3 418.921 4.107 20 0 HIADHN CN(C)Cc1ccc(-c2noc(-c3ccc(CNC(=O)C4CCCC4)cc3)n2)cc1 ZINC000530633290 930779784 /nfs/dbraw/zinc/77/97/84/930779784.db2.gz NWBUVQYHOHXQNV-UHFFFAOYSA-N 0 3 404.514 4.272 20 0 HIADHN C[C@H](CNC(=O)C(=O)Nc1ccc([C@H](C)Sc2ccccc2)cc1)N1CCCC1 ZINC000530746911 930815763 /nfs/dbraw/zinc/81/57/63/930815763.db2.gz LYIYRRIIXVIUDX-MSOLQXFVSA-N 0 3 411.571 4.079 20 0 HIADHN O=C(CC1(N2CCOCC2)CCCC1)Nc1cccc(-c2nc3ccccc3[nH]2)c1 ZINC000530804216 930828257 /nfs/dbraw/zinc/82/82/57/930828257.db2.gz AWBHDVNYWPYFPE-UHFFFAOYSA-N 0 3 404.514 4.204 20 0 HIADHN O=C(CC1(N2CCOCC2)CCCC1)N[C@H]1CCOc2c(-c3ccccc3)cccc21 ZINC000530817963 930831109 /nfs/dbraw/zinc/83/11/09/930831109.db2.gz GUIPMFJJPNHXIO-QHCPKHFHSA-N 0 3 420.553 4.329 20 0 HIADHN CC(=O)Nc1ccc(Cl)c(NC(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000530838226 930837001 /nfs/dbraw/zinc/83/70/01/930837001.db2.gz PJOWBQDHQNEPNZ-IBGZPJMESA-N 0 3 414.937 4.427 20 0 HIADHN Cc1cccn2cc(COc3ccc(CN[C@@H](CO)c4ccccc4C)cc3)nc12 ZINC000530856412 930841552 /nfs/dbraw/zinc/84/15/52/930841552.db2.gz DHDZCRBGYYKDQJ-DEOSSOPVSA-N 0 3 401.510 4.353 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2c(Cl)cccc2Cl)cc1)[C@H]1CCCN(C)C1 ZINC000530859586 930842269 /nfs/dbraw/zinc/84/22/69/930842269.db2.gz SSXQAIGCTANLPA-INIZCTEOSA-N 0 3 420.340 4.412 20 0 HIADHN COc1cc(C[C@H](CO)CNCc2csc(-c3ccc(C)cc3)n2)cc(OC)c1 ZINC000530870469 930844404 /nfs/dbraw/zinc/84/44/04/930844404.db2.gz FBWQHKQUGVZSIH-SFHVURJKSA-N 0 3 412.555 4.077 20 0 HIADHN COc1ccc(-c2noc(CCCc3nc(-c4ccc(CN(C)C)cc4)no3)n2)cc1 ZINC000530871810 930844786 /nfs/dbraw/zinc/84/47/86/930844786.db2.gz ZYLNTTDUPJOYPY-UHFFFAOYSA-N 0 3 419.485 4.032 20 0 HIADHN CN(C)Cc1ccc(-c2noc(C[C@H]3Sc4ccc(Cl)cc4NC3=O)n2)cc1 ZINC000530871849 930845106 /nfs/dbraw/zinc/84/51/06/930845106.db2.gz HRGZDARCTLYQHO-QGZVFWFLSA-N 0 3 414.918 4.107 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(C)c1Cc1nc(-c2ccc(CN(C)C)cc2)no1 ZINC000530871604 930845117 /nfs/dbraw/zinc/84/51/17/930845117.db2.gz GAIRFYMWIINHIA-UHFFFAOYSA-N 0 3 405.477 4.331 20 0 HIADHN COC(=O)c1cc2c(o1)c(OC)ccc2CNCc1ccc(OC2CCCC2)nc1 ZINC000530904192 930854960 /nfs/dbraw/zinc/85/49/60/930854960.db2.gz PZALOTBGJCSVHX-UHFFFAOYSA-N 0 3 410.470 4.234 20 0 HIADHN CSCc1cccc(NC(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)c1 ZINC000530945170 930863585 /nfs/dbraw/zinc/86/35/85/930863585.db2.gz XCAGKZPJRKEBAI-QZTJIDSGSA-N 0 3 405.608 4.293 20 0 HIADHN CC[C@H](C(=O)Nc1ccc(CC(=O)N2CCCc3ccccc32)cc1)N(CC)CC ZINC000531057356 930900324 /nfs/dbraw/zinc/90/03/24/930900324.db2.gz WUVRUMHWCDHIIT-JOCHJYFZSA-N 0 3 407.558 4.267 20 0 HIADHN CC(C)OC1CCN(C(=O)N[C@H](CN2CCc3ccccc3C2)C(C)(C)C)CC1 ZINC000531186497 930956836 /nfs/dbraw/zinc/95/68/36/930956836.db2.gz WGAOYLSYBIAJBW-JOCHJYFZSA-N 0 3 401.595 4.058 20 0 HIADHN Cc1ccsc1[C@H](CO)NCc1ccc(OCc2cn3cccc(C)c3n2)cc1 ZINC000531206932 930965923 /nfs/dbraw/zinc/96/59/23/930965923.db2.gz UXKXDIDGHDKUIF-NRFANRHFSA-N 0 3 407.539 4.415 20 0 HIADHN C[C@H](c1ccc2ccccc2c1)N(C(=O)NCCCCN1CCN(C)CC1)C1CC1 ZINC000531260690 930985426 /nfs/dbraw/zinc/98/54/26/930985426.db2.gz VYJQGHNCXOXQJE-HXUWFJFHSA-N 0 3 408.590 4.102 20 0 HIADHN Cc1nc(-c2ccc([C@H](C)NC(=O)CC3(N4CCOCC4)CCCC3)cc2)cs1 ZINC000531291187 931003820 /nfs/dbraw/zinc/00/38/20/931003820.db2.gz YVNVNFVRFHOWCW-KRWDZBQOSA-N 0 3 413.587 4.331 20 0 HIADHN Cc1nc(-c2ccc([C@@H](C)NC(=O)CC3(N4CCOCC4)CCCC3)cc2)cs1 ZINC000531291188 931004349 /nfs/dbraw/zinc/00/43/49/931004349.db2.gz YVNVNFVRFHOWCW-QGZVFWFLSA-N 0 3 413.587 4.331 20 0 HIADHN CN(C)Cc1ccc(-c2noc(CCc3nnc(-c4cc5ccccc5o4)o3)n2)cc1 ZINC000531348987 931026321 /nfs/dbraw/zinc/02/63/21/931026321.db2.gz YMSFYGGFBHCLCW-UHFFFAOYSA-N 0 3 415.453 4.380 20 0 HIADHN Cc1nnc(SCc2nc(-c3ccc(CN(C)C)cc3)no2)n1Cc1ccccc1 ZINC000531348694 931026903 /nfs/dbraw/zinc/02/69/03/931026903.db2.gz SWJYETQRLRXYGN-UHFFFAOYSA-N 0 3 420.542 4.039 20 0 HIADHN CCNC(=O)COc1ccc(CN[C@H](c2cccc(F)c2)C(C)(C)C)cc1OC ZINC000531402560 931045320 /nfs/dbraw/zinc/04/53/20/931045320.db2.gz NCXHFWMXXPEQHR-JOCHJYFZSA-N 0 3 402.510 4.226 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)C3CC(c4cccc(F)c4)C3)CC2)C[C@H](C)O1 ZINC000531417792 931049189 /nfs/dbraw/zinc/04/91/89/931049189.db2.gz CGYXSRZKQNKQIE-OTXOEQGISA-N 0 3 402.554 4.057 20 0 HIADHN C[C@H](CC(=O)Nc1cccc(N2CCCC2)c1)NCc1c[nH]c(-c2ccccc2)n1 ZINC000531489007 931075226 /nfs/dbraw/zinc/07/52/26/931075226.db2.gz JBGHDMKOHKQFEQ-GOSISDBHSA-N 0 3 403.530 4.184 20 0 HIADHN COc1ccc(-c2ccccc2)cc1CNCc1ccccc1CN1CCOCC1 ZINC000531535674 931096280 /nfs/dbraw/zinc/09/62/80/931096280.db2.gz PPQDXBCKJFKNKR-UHFFFAOYSA-N 0 3 402.538 4.484 20 0 HIADHN CC(C)N1CCN([C@@H]2CCN(C(=O)c3ccc(-c4ccc(C(C)(C)C)cc4)o3)C2)CC1 ZINC000531578967 931108213 /nfs/dbraw/zinc/10/82/13/931108213.db2.gz UYYMQCUDVLATGC-JOCHJYFZSA-N 0 3 423.601 4.485 20 0 HIADHN CC(C)N1CCN([C@@H]2CCN(C(=O)CC3(CCc4ccccc4)CCCC3)C2)CC1 ZINC000531583500 931110174 /nfs/dbraw/zinc/11/01/74/931110174.db2.gz WHGDKFHQLWNPKD-XMMPIXPASA-N 0 3 411.634 4.197 20 0 HIADHN CC(C)N1CCN([C@H]2CCN(C(=O)CC3(CCc4ccccc4)CCCC3)C2)CC1 ZINC000531583499 931110185 /nfs/dbraw/zinc/11/01/85/931110185.db2.gz WHGDKFHQLWNPKD-DEOSSOPVSA-N 0 3 411.634 4.197 20 0 HIADHN Cc1c(CSC(C)C)cccc1NC(=O)N1CC[C@@H](N2CCN(C(C)C)CC2)C1 ZINC000531586802 931110200 /nfs/dbraw/zinc/11/02/00/931110200.db2.gz MXNLXGLPYWDIIL-OAQYLSRUSA-N 0 3 418.651 4.269 20 0 HIADHN C[C@@H]1CN([C@H](CNCc2cnc(C3CC3)s2)c2c(F)cccc2Cl)CCO1 ZINC000531630196 931132890 /nfs/dbraw/zinc/13/28/90/931132890.db2.gz WXMDUABMOPYPPB-FZKQIMNGSA-N 0 3 409.958 4.365 20 0 HIADHN Cc1nn(C)c(C)c1CCN[C@@H](C)c1ccc(Br)cc1Br ZINC000531687717 931152628 /nfs/dbraw/zinc/15/26/28/931152628.db2.gz GPLNDVUCPBVDQH-JTQLQIEISA-N 0 3 415.173 4.455 20 0 HIADHN C[C@@H](NCc1ccc(N2CCOCC2)nc1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000531689363 931153821 /nfs/dbraw/zinc/15/38/21/931153821.db2.gz OPYKIBRJWQYBLM-MRXNPFEDSA-N 0 3 424.526 4.406 20 0 HIADHN C[C@H](NCc1ccc(N2CCOCC2)nc1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000531689362 931154031 /nfs/dbraw/zinc/15/40/31/931154031.db2.gz OPYKIBRJWQYBLM-INIZCTEOSA-N 0 3 424.526 4.406 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)NCc2cccc(NC(=O)[C@H]3CCCO3)c2)cc1 ZINC000531695445 931158554 /nfs/dbraw/zinc/15/85/54/931158554.db2.gz VFNIEAQNMJFGKM-GAJHUEQPSA-N 0 3 404.514 4.149 20 0 HIADHN CC[C@@H](N[C@@H](C)c1ccc2c(c1)OCCCO2)c1ccccc1OCC(=O)N(C)C ZINC000531701226 931164283 /nfs/dbraw/zinc/16/42/83/931164283.db2.gz ODVWZBSBLJEAKT-FXAWDEMLSA-N 0 3 412.530 4.117 20 0 HIADHN C[C@H](NCc1ccc(OC2CCCCC2)nc1)c1ccc(NS(C)(=O)=O)cc1 ZINC000531707669 931167850 /nfs/dbraw/zinc/16/78/50/931167850.db2.gz YPFFBEXKOVLDCU-INIZCTEOSA-N 0 3 403.548 4.015 20 0 HIADHN CC[C@H](N[C@H](C)c1cccc(S(=O)(=O)N(C)C)c1)c1ccc(OC(F)F)cc1 ZINC000531710178 931169189 /nfs/dbraw/zinc/16/91/89/931169189.db2.gz NHZBDXMORUTZCF-KUHUBIRLSA-N 0 3 412.502 4.340 20 0 HIADHN C[C@@H](NCC(=O)N1CCC(Cc2ccccc2)CC1)c1ccc(-n2ccnc2)cc1 ZINC000531737723 931179137 /nfs/dbraw/zinc/17/91/37/931179137.db2.gz JSPINIVLKNFGIU-HXUWFJFHSA-N 0 3 402.542 4.004 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)c(C)c1CN[C@@H]1CCN(C(=O)C2CCCCC2)C1 ZINC000531863974 931226682 /nfs/dbraw/zinc/22/66/82/931226682.db2.gz RAOVNNBXDIZUFR-HXUWFJFHSA-N 0 3 414.981 4.413 20 0 HIADHN Cc1noc(-c2ccc(C)c(NC(=O)N(C)[C@H]3CCN(Cc4ccccc4)C3)c2)n1 ZINC000531883408 931233588 /nfs/dbraw/zinc/23/35/88/931233588.db2.gz VXZXQLSGKQPSTA-FQEVSTJZSA-N 0 3 405.502 4.092 20 0 HIADHN COc1ccc(NC(=O)[C@H](N[C@@H](C)C2CCOCC2)c2ccccc2)cc1Cl ZINC000531883822 931234091 /nfs/dbraw/zinc/23/40/91/931234091.db2.gz KUQBZDZFAYREIP-YCRPNKLZSA-N 0 3 402.922 4.433 20 0 HIADHN COc1ccc(NC(=O)[C@H](N[C@H](C)C2CCOCC2)c2ccccc2)cc1Cl ZINC000531883820 931234512 /nfs/dbraw/zinc/23/45/12/931234512.db2.gz KUQBZDZFAYREIP-QVKFZJNVSA-N 0 3 402.922 4.433 20 0 HIADHN C[C@@H](CC(=O)N(C)Cc1cccc(Cl)c1)NCc1cnn(Cc2ccccc2)c1 ZINC000531941335 931254871 /nfs/dbraw/zinc/25/48/71/931254871.db2.gz HJFARKIRDPGASQ-SFHVURJKSA-N 0 3 410.949 4.112 20 0 HIADHN C[C@@H](NCc1ccc(N2CCN(C)CC2)nc1)c1cccc(OCc2ccccc2)c1 ZINC000531941775 931254936 /nfs/dbraw/zinc/25/49/36/931254936.db2.gz UVXBGEVPSWZFOR-OAQYLSRUSA-N 0 3 416.569 4.263 20 0 HIADHN CCCOc1ccc([C@H](C)NCc2ccc(CS(=O)(=O)NC(C)C)cc2)cc1 ZINC000531950848 931260470 /nfs/dbraw/zinc/26/04/70/931260470.db2.gz RKBMYEITWUEKNZ-SFHVURJKSA-N 0 3 404.576 4.154 20 0 HIADHN C[C@H](NCCCS(=O)(=O)c1ccccc1)c1ccc(F)c(Br)c1 ZINC000531951887 931261572 /nfs/dbraw/zinc/26/15/72/931261572.db2.gz DXZKBBRANMCOBJ-ZDUSSCGKSA-N 0 3 400.313 4.103 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCC[C@H]1c1cccc(C)n1)c1cccc(OC)c1 ZINC000531963196 931267202 /nfs/dbraw/zinc/26/72/02/931267202.db2.gz QFYNJYLNEOTDSX-XZOQPEGZSA-N 0 3 410.562 4.328 20 0 HIADHN C[C@H](NCc1cccc(OCC(N)=O)c1)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000531982897 931275012 /nfs/dbraw/zinc/27/50/12/931275012.db2.gz BKORVLYEVLQGJC-KRWDZBQOSA-N 0 3 408.473 4.120 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](NC2CCN(c3ccccc3)CC2)c2ccccc2)c1 ZINC000531988635 931277558 /nfs/dbraw/zinc/27/75/58/931277558.db2.gz SWDKYSCFICUWLM-VWLOTQADSA-N 0 3 420.578 4.438 20 0 HIADHN O=C(N[C@H](c1ccccc1)c1cccc(F)c1)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000532030649 931290922 /nfs/dbraw/zinc/29/09/22/931290922.db2.gz JINIBAQSUOLEOX-LADGPHEKSA-N 0 3 403.501 4.339 20 0 HIADHN CCNC(=O)COc1ccc(CN[C@H](c2ccccc2F)C2CCCC2)cc1OC ZINC000532039868 931294763 /nfs/dbraw/zinc/29/47/63/931294763.db2.gz RFODXSJOKZUUBE-DEOSSOPVSA-N 0 3 414.521 4.370 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccnc2)C1)N(CCc1cccc(F)c1)C1CCCC1 ZINC000532051326 931297779 /nfs/dbraw/zinc/29/77/79/931297779.db2.gz QWCVXBVIMBYHRE-JOCHJYFZSA-N 0 3 409.549 4.447 20 0 HIADHN Cc1[nH]c(=O)c(C(=O)N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)cc1-c1ccccc1 ZINC000532079359 931304854 /nfs/dbraw/zinc/30/48/54/931304854.db2.gz TYQMJRJAGNIKFH-UWJYYQICSA-N 0 3 401.510 4.155 20 0 HIADHN Cc1cccc(Nc2ccccc2C(=O)N2CC[C@@H](N3CCN(C(C)C)CC3)C2)c1C ZINC000532087920 931307777 /nfs/dbraw/zinc/30/77/77/931307777.db2.gz OAZSNYBFHBQNAH-JOCHJYFZSA-N 0 3 420.601 4.288 20 0 HIADHN CC(C)N1CCN([C@H]2CCN(C(=O)N[C@H](CC3CCCCC3)C(C)(C)C)C2)CC1 ZINC000532094945 931309635 /nfs/dbraw/zinc/30/96/35/931309635.db2.gz XSQVPXBFQJYALB-FCHUYYIVSA-N 0 3 406.659 4.181 20 0 HIADHN Cc1c2ccc3ccccc3c2oc1C(=O)N1CC[C@H](N2CCN(C(C)C)CC2)C1 ZINC000532093376 931309750 /nfs/dbraw/zinc/30/97/50/931309750.db2.gz FQUYFQLAPHCTEE-FQEVSTJZSA-N 0 3 405.542 4.135 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(CNCCOc3ccc(Cl)cn3)c2)cc1 ZINC000532119558 931320007 /nfs/dbraw/zinc/32/00/07/931320007.db2.gz FNDNDPPFSRYWCQ-UHFFFAOYSA-N 0 3 411.889 4.165 20 0 HIADHN CC(C)(C)OC(=O)C[C@@H]1CCCN(C(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)C1 ZINC000532126365 931322583 /nfs/dbraw/zinc/32/25/83/931322583.db2.gz BGDZHFKEGKRXMN-PMACEKPBSA-N 0 3 418.553 4.008 20 0 HIADHN CC(C)(C)OC(=O)C[C@H]1CCCN(C[C@H](O)COc2c(Cl)cccc2Cl)C1 ZINC000532125174 931322990 /nfs/dbraw/zinc/32/29/90/931322990.db2.gz FXZHHMPVFJLAIX-CABCVRRESA-N 0 3 418.361 4.177 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccnc2)C1)N1CCCC[C@@H]1c1nc2ccccc2o1 ZINC000532153918 931329872 /nfs/dbraw/zinc/32/98/72/931329872.db2.gz WZLZGQZGMMNMGS-TZIWHRDSSA-N 0 3 404.514 4.189 20 0 HIADHN CCC(=O)Nc1cccc(CN[C@H](C)CC(=O)Nc2ccc(OC(F)(F)F)cc2)c1 ZINC000532192093 931343596 /nfs/dbraw/zinc/34/35/96/931343596.db2.gz UKKIYINXJGMDBV-CQSZACIVSA-N 0 3 423.435 4.441 20 0 HIADHN Cc1nc(-c2ccccc2F)sc1[C@H](C)NCc1ccc(N2CCOCC2)nc1 ZINC000532200779 931347288 /nfs/dbraw/zinc/34/72/88/931347288.db2.gz HBIMXGFGOHPKOU-HNNXBMFYSA-N 0 3 412.534 4.340 20 0 HIADHN CC(C)OCc1ccccc1CN[C@@H](C)c1cccc(N2CCCS2(=O)=O)c1 ZINC000532204457 931349415 /nfs/dbraw/zinc/34/94/15/931349415.db2.gz KZTWBSYQBXBSGH-SFHVURJKSA-N 0 3 402.560 4.002 20 0 HIADHN COc1ccc2oc([C@H](C)N[C@@H](CN3CCN(C)CC3)c3ccccc3)c(C)c2c1 ZINC000532213671 931355161 /nfs/dbraw/zinc/35/51/61/931355161.db2.gz UJBQRROKERCPGK-CVDCTZTESA-N 0 3 407.558 4.389 20 0 HIADHN Cc1ccc(Cl)cc1NC(=O)C[C@@H](C)NCc1ccnc(OC2CCOCC2)c1 ZINC000532228707 931362356 /nfs/dbraw/zinc/36/23/56/931362356.db2.gz KHFQKOMQKUEZAN-MRXNPFEDSA-N 0 3 417.937 4.108 20 0 HIADHN O=C1NC2(CCCCC2)C(=O)N1Cc1ccccc1CN[C@H]1CCc2ccccc21 ZINC000532228685 931362801 /nfs/dbraw/zinc/36/28/01/931362801.db2.gz FUSIHKPMOPPELQ-QFIPXVFZSA-N 0 3 403.526 4.218 20 0 HIADHN COc1ccccc1C[C@@H](NCc1csc(CNC(=O)c2ccccc2)n1)C(C)C ZINC000532232367 931364479 /nfs/dbraw/zinc/36/44/79/931364479.db2.gz BWPLYLRDNDCJAP-OAQYLSRUSA-N 0 3 423.582 4.439 20 0 HIADHN C[C@@H](CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)N[C@@H](CO)c1ccccc1 ZINC000532246369 931371163 /nfs/dbraw/zinc/37/11/63/931371163.db2.gz GZYFIGQLUJDNSQ-SJCJKPOMSA-N 0 3 400.828 4.399 20 0 HIADHN CC(C)(C)[C@H](NC(=O)[C@@H]1CCCN(Cc2cccnc2)C1)c1ccc(F)cc1F ZINC000532339116 931400343 /nfs/dbraw/zinc/40/03/43/931400343.db2.gz JHNSDMJFBJTNKV-DYESRHJHSA-N 0 3 401.501 4.475 20 0 HIADHN CCCn1nc(C)c(CNCCC(=O)Nc2cc(Br)ccc2C)c1C ZINC000532358464 931407573 /nfs/dbraw/zinc/40/75/73/931407573.db2.gz FVHFMVHCOAGFGF-UHFFFAOYSA-N 0 3 407.356 4.099 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@@H](C)N[C@H]2CCCc3ccc(OC)cc32)cc1 ZINC000532441347 931435462 /nfs/dbraw/zinc/43/54/62/931435462.db2.gz CAEOWNCDEGHSFB-HXOBKFHXSA-N 0 3 416.587 4.454 20 0 HIADHN COc1ccc(OC)c(NC(=O)C[C@@H](C)NCc2ccc(F)cc2C(F)(F)F)c1 ZINC000532446392 931437604 /nfs/dbraw/zinc/43/76/04/931437604.db2.gz UIZZDLJSWNTVBH-GFCCVEGCSA-N 0 3 414.399 4.369 20 0 HIADHN Cc1c([C@@H](C)N[C@@H](C)CC(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)cnn1C ZINC000532448015 931438599 /nfs/dbraw/zinc/43/85/99/931438599.db2.gz DKJKAOGTALZLER-WDEREUQCSA-N 0 3 402.848 4.469 20 0 HIADHN Cc1c([C@@H](C)N[C@H](C)CC(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)cnn1C ZINC000532448011 931438765 /nfs/dbraw/zinc/43/87/65/931438765.db2.gz DKJKAOGTALZLER-GHMZBOCLSA-N 0 3 402.848 4.469 20 0 HIADHN Cc1nc(Cc2ccccc2)sc1[C@H](C)NCc1ccc(N2CCN(C)CC2)nc1 ZINC000532453765 931441746 /nfs/dbraw/zinc/44/17/46/931441746.db2.gz MWDDHROYTSGHAE-SFHVURJKSA-N 0 3 421.614 4.040 20 0 HIADHN C[C@H](NCc1cccc(OCCN2CCOCC2)c1)c1ccccc1C(F)(F)F ZINC000532461652 931445948 /nfs/dbraw/zinc/44/59/48/931445948.db2.gz LHHOQHJIKXOFHF-KRWDZBQOSA-N 0 3 408.464 4.267 20 0 HIADHN COc1cc([C@@H](C)NCc2ccc3c(c2)nnn3C)ccc1OCc1ccccc1 ZINC000532477047 931453738 /nfs/dbraw/zinc/45/37/38/931453738.db2.gz KRQXZHKBLYJJSO-QGZVFWFLSA-N 0 3 402.498 4.407 20 0 HIADHN COc1cccc(CN(CCC(=O)Nc2ccccc2SC)C[C@H]2CCCO2)c1 ZINC000532486186 931457155 /nfs/dbraw/zinc/45/71/55/931457155.db2.gz HSAPOPSCADSWHB-HXUWFJFHSA-N 0 3 414.571 4.427 20 0 HIADHN COc1cc(CN(C)CCC(=O)N[C@@H](c2cccs2)c2ccccc2)cc(OC)c1 ZINC000532490718 931459150 /nfs/dbraw/zinc/45/91/50/931459150.db2.gz QTPDFMYAYPZDEV-XMMPIXPASA-N 0 3 424.566 4.493 20 0 HIADHN C[C@H](N[C@H](CN1CCN(C)CC1)c1ccccc1)c1ccc(Br)s1 ZINC000532498121 931462809 /nfs/dbraw/zinc/46/28/09/931462809.db2.gz BJZYTTPAAHXXKT-DOTOQJQBSA-N 0 3 408.409 4.150 20 0 HIADHN CC(C)c1ccc(NC(=O)C[C@@H](C)NCc2ccnc(OC3CCOCC3)c2)cc1 ZINC000532511537 931468938 /nfs/dbraw/zinc/46/89/38/931468938.db2.gz JPKTTZQOOZAUSN-GOSISDBHSA-N 0 3 411.546 4.270 20 0 HIADHN O=C(c1ccccc1Cl)N1CCC(NCc2csc(-c3ccco3)n2)CC1 ZINC000532538758 931515079 /nfs/dbraw/zinc/51/50/79/931515079.db2.gz JXVZAVSMMPBKDW-UHFFFAOYSA-N 0 3 401.919 4.451 20 0 HIADHN COc1ccc(NC(=O)C[C@H](C)NCc2ccc(C)cc2OC(C)C)c(OC)c1 ZINC000532544089 931517303 /nfs/dbraw/zinc/51/73/03/931517303.db2.gz LYGKOGUWQCZHBF-KRWDZBQOSA-N 0 3 400.519 4.306 20 0 HIADHN COc1ccc(Cl)cc1C[C@H]1CCCN(CCc2nc3ccccc3c(=O)[nH]2)C1 ZINC000532586790 931543957 /nfs/dbraw/zinc/54/39/57/931543957.db2.gz SSCRSGZLIXEFSJ-MRXNPFEDSA-N 0 3 411.933 4.495 20 0 HIADHN O=C(CN1CCCCC[C@@H]1c1ccco1)Nc1cccc(CN2CCSCC2)c1 ZINC000532586488 931545293 /nfs/dbraw/zinc/54/52/93/931545293.db2.gz WPESJXRUTPJKQB-OAQYLSRUSA-N 0 3 413.587 4.384 20 0 HIADHN O=C(CN[C@@H](Cc1ccccc1)c1ccccc1)NC[C@@H]1CCN(c2ccccc2)C1 ZINC000532642255 931564464 /nfs/dbraw/zinc/56/44/64/931564464.db2.gz PVPMWGANQSYMCV-OZXSUGGESA-N 0 3 413.565 4.203 20 0 HIADHN COC(=O)c1cc2cc(CN3CCC(C(=O)Nc4ccccc4OC)CC3)ccc2o1 ZINC000532643464 931565138 /nfs/dbraw/zinc/56/51/38/931565138.db2.gz IGIYEWZQMAYJSB-UHFFFAOYSA-N 0 3 422.481 4.079 20 0 HIADHN O=C(NC1CCN(CCc2nc(-c3cccc(Cl)c3)no2)CC1)C1CCCCC1 ZINC000532642733 931565151 /nfs/dbraw/zinc/56/51/51/931565151.db2.gz HYGSXHBVWVPGES-UHFFFAOYSA-N 0 3 416.953 4.093 20 0 HIADHN CN(C)C(=O)[C@H](c1ccccc1)N1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1 ZINC000532685726 931584279 /nfs/dbraw/zinc/58/42/79/931584279.db2.gz KECYEFMGRQPZOA-ICSRJNTNSA-N 0 3 424.932 4.399 20 0 HIADHN O=C(CNC1(c2ccccc2)CCOCC1)N[C@@H](Cc1ccccc1)c1ccccc1 ZINC000532708355 931600386 /nfs/dbraw/zinc/60/03/86/931600386.db2.gz HCAJHZKKMMIYAX-VWLOTQADSA-N 0 3 414.549 4.382 20 0 HIADHN CC(C)CN(CCN(C)C)C(=O)Cc1ccc(NC(=O)c2cc3ccccc3o2)cc1 ZINC000532872003 931675064 /nfs/dbraw/zinc/67/50/64/931675064.db2.gz KSOZFWDRFFIZJP-UHFFFAOYSA-N 0 3 421.541 4.274 20 0 HIADHN COc1ccccc1/C=C/CNCc1ccc(Br)cc1N1CCOCC1 ZINC000532886737 931678954 /nfs/dbraw/zinc/67/89/54/931678954.db2.gz PRXBLJDAUJEFRM-GQCTYLIASA-N 0 3 417.347 4.097 20 0 HIADHN O=C(CN1CCC(c2c[nH]c3ccccc32)CC1)N1CCc2[nH]c3ccccc3c2C1 ZINC000532899871 931684593 /nfs/dbraw/zinc/68/45/93/931684593.db2.gz DEKCQPZGQGWUEI-UHFFFAOYSA-N 0 3 412.537 4.414 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1cc2ccccc2n1C ZINC000532911092 931690575 /nfs/dbraw/zinc/69/05/75/931690575.db2.gz NGUUPFDCQGFSNT-NRFANRHFSA-N 0 3 413.525 4.383 20 0 HIADHN Cc1cc(C)c(CC(C(=O)Nc2ccc3c(c2)OCC(=O)N3C)C(F)(F)F)c(C)c1 ZINC000532932006 931701593 /nfs/dbraw/zinc/70/15/93/931701593.db2.gz FVNYZQLOCNPIQD-KRWDZBQOSA-N 0 3 420.431 4.327 20 0 HIADHN COc1ccc(CNC(C)(C)COc2ncc(Cl)cc2Cl)c(OC)c1OC ZINC000532931415 931701907 /nfs/dbraw/zinc/70/19/07/931701907.db2.gz OMWWLOKECVFRNA-UHFFFAOYSA-N 0 3 415.317 4.361 20 0 HIADHN C[C@@H]1C[C@H](c2ccc(F)cc2)CN1CC(=O)N1CCC(OCc2ccccc2)CC1 ZINC000532977020 931722964 /nfs/dbraw/zinc/72/29/64/931722964.db2.gz JLXHOXZFZBJYHV-KNQAVFIVSA-N 0 3 410.533 4.211 20 0 HIADHN C[C@@H](NC(=O)CNC1(c2ccc(Cl)cc2)CCOCC1)c1ccc(Cl)cc1 ZINC000533063257 931759594 /nfs/dbraw/zinc/75/95/94/931759594.db2.gz HGZIFOZKHKDVPW-OAHLLOKOSA-N 0 3 407.341 4.466 20 0 HIADHN C[C@]1(n2cc(CNC3(c4ccc(Cl)cc4)CCCCC3)cn2)CCS(=O)(=O)C1 ZINC000533191273 931805467 /nfs/dbraw/zinc/80/54/67/931805467.db2.gz HUMYPXWCZRLOQE-FQEVSTJZSA-N 0 3 421.994 4.019 20 0 HIADHN O=C([C@H]1CCCN(Cc2cccnc2)C1)N1CCC[C@H](c2nc3c(s2)CCCC3)C1 ZINC000533192543 931806029 /nfs/dbraw/zinc/80/60/29/931806029.db2.gz MJQSROWTJXCYNE-PMACEKPBSA-N 0 3 424.614 4.035 20 0 HIADHN CCCN1CCN(c2ccccc2CNc2cccc(Oc3cnccn3)c2)CC1 ZINC000533211939 931810898 /nfs/dbraw/zinc/81/08/98/931810898.db2.gz HXOVMNWSNHEQLS-UHFFFAOYSA-N 0 3 403.530 4.413 20 0 HIADHN COc1ccc(NC(=O)CCN2CCC(C(=O)c3ccc(Cl)cc3)CC2)cc1 ZINC000533248425 931818745 /nfs/dbraw/zinc/81/87/45/931818745.db2.gz MQEQKEUPTAKADL-UHFFFAOYSA-N 0 3 400.906 4.272 20 0 HIADHN CC[C@H](c1ccccc1)N(CC)CC(=O)N1CCC(NC(=O)c2ccccc2C)CC1 ZINC000533256623 931820896 /nfs/dbraw/zinc/82/08/96/931820896.db2.gz ZMPJHKIRJZYUGE-XMMPIXPASA-N 0 3 421.585 4.189 20 0 HIADHN CC(C)(C)OC(=O)C1CCN(CCC(=O)Nc2cc(Cl)ccc2Cl)CC1 ZINC000533263330 931822315 /nfs/dbraw/zinc/82/23/15/931822315.db2.gz VYBYFOIKWIVIOH-UHFFFAOYSA-N 0 3 401.334 4.376 20 0 HIADHN CCCN(CC(=O)Nc1ccc(OC(F)(F)F)cc1)[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC000533292438 931830570 /nfs/dbraw/zinc/83/05/70/931830570.db2.gz KOTDVOUGMGQVQL-JQHSSLGASA-N 0 3 400.441 4.049 20 0 HIADHN O[C@H](CNCc1cc(F)cc(C(F)(F)F)c1)COc1ccccc1Br ZINC000533308842 931835023 /nfs/dbraw/zinc/83/50/23/931835023.db2.gz BAKLRLBHJLJPOW-CQSZACIVSA-N 0 3 422.216 4.137 20 0 HIADHN COC(=O)c1cc2cc(CN3CCC(C(=O)N4CCc5ccccc54)CC3)ccc2o1 ZINC000533350049 931845420 /nfs/dbraw/zinc/84/54/20/931845420.db2.gz KKJWUTJFTAUZKZ-UHFFFAOYSA-N 0 3 418.493 4.021 20 0 HIADHN O=c1cc(CN(C2CC2)[C@H]2CCc3ccccc32)nc2ccc(Br)cn12 ZINC000533353148 931846717 /nfs/dbraw/zinc/84/67/17/931846717.db2.gz RNVKBFPQVNUKRJ-IBGZPJMESA-N 0 3 410.315 4.109 20 0 HIADHN CCN(CC)C(=O)c1ccc(NC(=O)CN[C@H](c2ccc(F)cc2)C2CCC2)cc1 ZINC000533367629 931850401 /nfs/dbraw/zinc/85/04/01/931850401.db2.gz CXGCRXUFSKYSDS-QHCPKHFHSA-N 0 3 411.521 4.377 20 0 HIADHN O=C(CNC1(c2ccc(F)cc2)CCCC1)NCC1(c2ccccc2)CCOCC1 ZINC000533374318 931852157 /nfs/dbraw/zinc/85/21/57/931852157.db2.gz GONWIIQBBZQSFZ-UHFFFAOYSA-N 0 3 410.533 4.049 20 0 HIADHN COc1ccc(OC)c([C@@H](C)NC(=O)CN[C@@H](c2ccc(F)cc2)C2CCC2)c1 ZINC000533376618 931852930 /nfs/dbraw/zinc/85/29/30/931852930.db2.gz GLBOFSVPSJYBEF-IQMFZBJNSA-N 0 3 400.494 4.151 20 0 HIADHN COc1ccc(OC)c([C@H](C)NC(=O)CN[C@@H](c2ccc(F)cc2)C2CCC2)c1 ZINC000533376619 931853107 /nfs/dbraw/zinc/85/31/07/931853107.db2.gz GLBOFSVPSJYBEF-NPMXOYFQSA-N 0 3 400.494 4.151 20 0 HIADHN O=C(CN(Cc1ccc2c(c1)CCO2)C1CCCC1)N1CCC[C@H](C(F)(F)F)C1 ZINC000533410983 931861246 /nfs/dbraw/zinc/86/12/46/931861246.db2.gz OEDNQLMJAORRSH-SFHVURJKSA-N 0 3 410.480 4.167 20 0 HIADHN COc1ccc(CCn2c(C)cc(C(=O)CN3CC[C@@H](N4CCCCC4)C3)c2C)cc1 ZINC000533417810 931862659 /nfs/dbraw/zinc/86/26/59/931862659.db2.gz WHUOBDWHYOSBMY-HSZRJFAPSA-N 0 3 423.601 4.099 20 0 HIADHN Cc1ccccc1COc1c(C)cc(CN(C)Cc2cc(=O)n3nccc3[nH]2)cc1C ZINC000533435137 931868082 /nfs/dbraw/zinc/86/80/82/931868082.db2.gz JTJKUUOGKBGHEV-UHFFFAOYSA-N 0 3 416.525 4.159 20 0 HIADHN CCN(C(=O)CNC1(c2cccc(Br)c2)CCOCC1)C1CCCCC1 ZINC000533485600 931881568 /nfs/dbraw/zinc/88/15/68/931881568.db2.gz ZMEIGVBRGHSLGR-UHFFFAOYSA-N 0 3 423.395 4.226 20 0 HIADHN C[C@@H]1CC[C@H](C)[N@H+]1[C@H]1CCCN(Cc2nc(=O)c3c(-c4ccco4)csc3[n-]2)C1 ZINC000533511663 931889831 /nfs/dbraw/zinc/88/98/31/931889831.db2.gz SMFZANVZOZGGLR-XHSDSOJGSA-N 0 3 412.559 4.494 20 0 HIADHN C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(Cc2nc(=O)c3c(-c4ccco4)csc3[n-]2)C1 ZINC000533511663 931889832 /nfs/dbraw/zinc/88/98/32/931889832.db2.gz SMFZANVZOZGGLR-XHSDSOJGSA-N 0 3 412.559 4.494 20 0 HIADHN C[C@@H]1CC[C@@H](C)[NH+]1[C@H]1CCCN(Cc2nc(=O)c3c(-c4ccco4)csc3[n-]2)C1 ZINC000533511661 931890165 /nfs/dbraw/zinc/89/01/65/931890165.db2.gz SMFZANVZOZGGLR-OAGGEKHMSA-N 0 3 412.559 4.494 20 0 HIADHN O=C(CNC1(c2ccccc2)CCOCC1)N[C@H](c1cccs1)c1ccccc1 ZINC000533517052 931891735 /nfs/dbraw/zinc/89/17/35/931891735.db2.gz AMDTZMLJBNBLEZ-QHCPKHFHSA-N 0 3 406.551 4.249 20 0 HIADHN Cc1nc2c(s1)[C@H](N(C)C[C@H](O)COc1cccc(C(F)(F)F)c1)CCC2 ZINC000533522979 931893919 /nfs/dbraw/zinc/89/39/19/931893919.db2.gz FYPLJWGVRNIGOI-WMLDXEAASA-N 0 3 400.466 4.219 20 0 HIADHN Cc1nc(CN[C@H]2CCCC[C@H](N3C(=O)c4ccccc4C3=O)C2)nc2ccccc12 ZINC000533548206 931898164 /nfs/dbraw/zinc/89/81/64/931898164.db2.gz GEKQBAIYODMUEP-ROUUACIJSA-N 0 3 414.509 4.025 20 0 HIADHN COc1cccc(CCC[NH+]2CCC(C(=O)Nc3cc(Cl)ccc3[O-])CC2)c1 ZINC000533606825 931920435 /nfs/dbraw/zinc/92/04/35/931920435.db2.gz YXEBGCKONRUKDF-UHFFFAOYSA-N 0 3 402.922 4.338 20 0 HIADHN CCc1oc2ccccc2c1CNCc1ccccc1CS(=O)(=O)N1CCCC1 ZINC000533637889 931938782 /nfs/dbraw/zinc/93/87/82/931938782.db2.gz AUVUKTVBNMDTTI-UHFFFAOYSA-N 0 3 412.555 4.211 20 0 HIADHN CC(C)(COc1ccc(C(F)(F)F)cn1)NCc1cnc([C@H]2CCCO2)s1 ZINC000533757284 932013511 /nfs/dbraw/zinc/01/35/11/932013511.db2.gz STURAXNPBFULRM-CQSZACIVSA-N 0 3 401.454 4.356 20 0 HIADHN COC(=O)CCSc1cccc(NC(=O)NC[C@H](c2ccc(C)cc2)N(C)C)c1 ZINC000533772261 932025231 /nfs/dbraw/zinc/02/52/31/932025231.db2.gz SAOKHSZQEDCTKO-HXUWFJFHSA-N 0 3 415.559 4.075 20 0 HIADHN CC(=O)N1CC[C@H](NCC2=Cc3cc(Br)ccc3OC2)c2ccccc21 ZINC000533804195 932039571 /nfs/dbraw/zinc/03/95/71/932039571.db2.gz RHZVBRGORUXRLU-IBGZPJMESA-N 0 3 413.315 4.312 20 0 HIADHN CN(C)[C@@H](CNC(=O)Nc1cccc(NC(=O)c2cccs2)c1)Cc1ccccc1 ZINC000533808510 932041242 /nfs/dbraw/zinc/04/12/42/932041242.db2.gz GYKFUOAJEKBVLA-HXUWFJFHSA-N 0 3 422.554 4.295 20 0 HIADHN COc1ccc2cc(CN(C)C(=O)NC[C@H](Cc3ccccc3)N(C)C)ccc2c1 ZINC000533809419 932042264 /nfs/dbraw/zinc/04/22/64/932042264.db2.gz NKGASEKMEPRAPF-QHCPKHFHSA-N 0 3 405.542 4.163 20 0 HIADHN CN(C)[C@@H](CNC(=O)N1CCC[C@@H](c2nc3ccccc3s2)C1)Cc1ccccc1 ZINC000533809692 932042394 /nfs/dbraw/zinc/04/23/94/932042394.db2.gz UGHZAHMZNDYERL-WOJBJXKFSA-N 0 3 422.598 4.358 20 0 HIADHN Cc1nc(-c2cccc(C)c2)[nH]c1C(=O)N1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000533843848 932057212 /nfs/dbraw/zinc/05/72/12/932057212.db2.gz UQOPQWIFOALCQT-OALUTQOASA-N 0 3 424.589 4.045 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)Nc1cccc2c1CN(c1ccccn1)C2 ZINC000533881576 932078915 /nfs/dbraw/zinc/07/89/15/932078915.db2.gz ZUHYSPUBWNQMNS-UHFFFAOYSA-N 0 3 415.541 4.198 20 0 HIADHN CN1CC[C@@H](NC(=O)NCc2cccnc2Oc2cccc(F)c2)[C@@H]1c1ccccc1 ZINC000533929571 932106516 /nfs/dbraw/zinc/10/65/16/932106516.db2.gz ZPHROISRCQGAEJ-YADHBBJMSA-N 0 3 420.488 4.258 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)Cc2csc(-c3ccc4c(c3)OCO4)n2)c1 ZINC000533966925 932142267 /nfs/dbraw/zinc/14/22/67/932142267.db2.gz IIMIULOEKUUERV-UHFFFAOYSA-N 0 3 409.511 4.090 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)N[C@H](c1cccnc1)C1CC1 ZINC000533966043 932142837 /nfs/dbraw/zinc/14/28/37/932142837.db2.gz GAFDMNLDLFNZHQ-FQEVSTJZSA-N 0 3 420.479 4.325 20 0 HIADHN O=C(N[C@H]1CCN(Cc2ccccc2)C[C@H]1CO)c1cccc(Oc2ccccc2)c1 ZINC000534181056 932318802 /nfs/dbraw/zinc/31/88/02/932318802.db2.gz AFHPRIGBUQJWJJ-DHLKQENFSA-N 0 3 416.521 4.092 20 0 HIADHN O=C(N[C@H]1CCN(Cc2ccccc2)C[C@@H]1CO)c1ccc(Oc2ccccc2)cc1 ZINC000534182690 932319837 /nfs/dbraw/zinc/31/98/37/932319837.db2.gz RKKUMJPJYCVQLU-RDGATRHJSA-N 0 3 416.521 4.092 20 0 HIADHN CCc1ccc(-c2nc(CC(=O)N(CCN(C)C)Cc3cccc(O)c3)cs2)cc1 ZINC000534189795 932322760 /nfs/dbraw/zinc/32/27/60/932322760.db2.gz BAXHGEJLARMJEX-UHFFFAOYSA-N 0 3 423.582 4.211 20 0 HIADHN CCN1CC[C@@H](N(C)C(=O)Nc2ccc(Cl)cc2C(=O)c2ccc[nH]2)[C@@H](C)C1 ZINC000534213808 932335960 /nfs/dbraw/zinc/33/59/60/932335960.db2.gz YXQPRFSHGBFZKI-IFXJQAMLSA-N 0 3 402.926 4.093 20 0 HIADHN CCN1CC[C@@H](N(C)C(=O)Nc2ccc(Cl)cc2C(=O)c2ccc[nH]2)[C@H](C)C1 ZINC000534213803 932336331 /nfs/dbraw/zinc/33/63/31/932336331.db2.gz YXQPRFSHGBFZKI-AUUYWEPGSA-N 0 3 402.926 4.093 20 0 HIADHN CC[C@H](C)n1ncc(NC(=O)N(CCN(C)C)Cc2cccc(F)c2)c1C1CC1 ZINC000534251879 932366095 /nfs/dbraw/zinc/36/60/95/932366095.db2.gz QOYXLCARGBUSGS-INIZCTEOSA-N 0 3 401.530 4.466 20 0 HIADHN CC[C@@H](C)n1ncc(NC(=O)N(CCN(C)C)Cc2cccc(F)c2)c1C1CC1 ZINC000534251883 932366160 /nfs/dbraw/zinc/36/61/60/932366160.db2.gz QOYXLCARGBUSGS-MRXNPFEDSA-N 0 3 401.530 4.466 20 0 HIADHN CC(C)N1CCN([C@@H]2CCN(C(=O)c3ccccc3NCCC3=CCCCC3)C2)CC1 ZINC000534278841 932374749 /nfs/dbraw/zinc/37/47/49/932374749.db2.gz GWOXVFOIDSNJQS-HSZRJFAPSA-N 0 3 424.633 4.230 20 0 HIADHN O=C(N[C@H](CC(F)(F)F)c1ccc(F)cc1)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000534341867 932387131 /nfs/dbraw/zinc/38/71/31/932387131.db2.gz IRVCPXSCHPBBFS-IEBWSBKVSA-N 0 3 409.427 4.243 20 0 HIADHN C[C@H](C(=O)Nc1ccc(OCc2ccccc2)cc1)N1CC[C@H](C2CCOCC2)C1 ZINC000534380226 932407173 /nfs/dbraw/zinc/40/71/73/932407173.db2.gz FSHILGLRIRQBQK-KNQAVFIVSA-N 0 3 408.542 4.341 20 0 HIADHN Cc1cnc(CCN(C)C(=O)NC[C@@H](c2ccccc2)N2CCC(C)CC2)s1 ZINC000534383159 932409936 /nfs/dbraw/zinc/40/99/36/932409936.db2.gz GYTQPHBHULVZTQ-FQEVSTJZSA-N 0 3 400.592 4.109 20 0 HIADHN CCN(C[C@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)Cc1ccc(F)c(Cl)c1 ZINC000534405455 932427801 /nfs/dbraw/zinc/42/78/01/932427801.db2.gz KOHZKIRGAYYMMT-IBGZPJMESA-N 0 3 424.969 4.153 20 0 HIADHN C[C@@H](Cc1ccc(Cl)cc1)C(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000534415790 932435518 /nfs/dbraw/zinc/43/55/18/932435518.db2.gz TXVHIUOOKMSAAZ-IPMKNSEASA-N 0 3 406.998 4.257 20 0 HIADHN COc1cccc(-c2nc(C)c(C(=O)N3CC[C@H](C)N(Cc4ccccc4)CC3)[nH]2)c1 ZINC000534424313 932441374 /nfs/dbraw/zinc/44/13/74/932441374.db2.gz SGHUGHRJFPLIIV-SFHVURJKSA-N 0 3 418.541 4.130 20 0 HIADHN CC1CCN(S(=O)(=O)Cc2ccccc2CNCc2ccnc3ccccc23)CC1 ZINC000534451474 932466391 /nfs/dbraw/zinc/46/63/91/932466391.db2.gz FELCAJHJDGKMGO-UHFFFAOYSA-N 0 3 423.582 4.086 20 0 HIADHN CC(C)(COc1ncccc1Br)NCc1cnc([C@H]2CCCO2)s1 ZINC000534453446 932468948 /nfs/dbraw/zinc/46/89/48/932468948.db2.gz LEIDUMGXPPYBHD-CQSZACIVSA-N 0 3 412.353 4.099 20 0 HIADHN Cc1cccc(N2CCN(CCCN[C@@H](C)c3ncc(Br)s3)CC2)c1 ZINC000534494127 932530144 /nfs/dbraw/zinc/53/01/44/932530144.db2.gz AAUPNQCCEKYZCH-INIZCTEOSA-N 0 3 423.424 4.077 20 0 HIADHN CN(C)[C@@H](CNC(=O)Nc1ccc2oc(C(F)(F)F)nc2c1)Cc1ccccc1 ZINC000534524171 932544227 /nfs/dbraw/zinc/54/42/27/932544227.db2.gz IGABPLHWISIYDR-OAHLLOKOSA-N 0 3 406.408 4.141 20 0 HIADHN CN(C)[C@H](CNC(=O)CCc1nc2cc(Cl)ccc2s1)Cc1ccccc1 ZINC000534522917 932545002 /nfs/dbraw/zinc/54/50/02/932545002.db2.gz DKCHUPVCOUNURV-KRWDZBQOSA-N 0 3 401.963 4.171 20 0 HIADHN Cc1cccc(C(=O)Nc2cccc(CN3CCC(CO)CC3)c2)c1Br ZINC000534552638 932558637 /nfs/dbraw/zinc/55/86/37/932558637.db2.gz CCEFEUDUDFEUDP-UHFFFAOYSA-N 0 3 417.347 4.214 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)c2cccc(N3C(=O)c4ccccc4C3=O)c2)c1 ZINC000534709265 932680275 /nfs/dbraw/zinc/68/02/75/932680275.db2.gz MEJSFQWMLISERT-UHFFFAOYSA-N 0 3 413.477 4.110 20 0 HIADHN CN1CC[C@@H](NC(=O)NC2(c3ccc(Br)cc3)CC2)[C@@H]1c1ccccc1 ZINC000534719688 932687894 /nfs/dbraw/zinc/68/78/94/932687894.db2.gz CHKLYEILACEXCK-MOPGFXCFSA-N 0 3 414.347 4.183 20 0 HIADHN CN1CC[C@@H](NC(=O)CCCc2ccc(Br)s2)[C@@H]1c1ccccc1 ZINC000534752475 932728159 /nfs/dbraw/zinc/72/81/59/932728159.db2.gz BJDBHDBQBBCDCP-APWZRJJASA-N 0 3 407.377 4.395 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)NCC2(c3ccc(F)cc3F)CC2)CC1 ZINC000534894578 932826665 /nfs/dbraw/zinc/82/66/65/932826665.db2.gz QEYZTWRZXGVFRR-UHFFFAOYSA-N 0 3 413.512 4.302 20 0 HIADHN COc1ccc(CNCc2ccc(CN(C)C)c(F)c2)cc1OCc1cccnc1 ZINC000534969304 932867233 /nfs/dbraw/zinc/86/72/33/932867233.db2.gz NYGOJLPMTMDOBA-UHFFFAOYSA-N 0 3 409.505 4.160 20 0 HIADHN CC(C)c1ccc([C@H]2CCCCN2C(=O)NCCCCN2CCN(C)CC2)cc1 ZINC000535006697 932884277 /nfs/dbraw/zinc/88/42/77/932884277.db2.gz LJUHKWNSMRFAJH-HSZRJFAPSA-N 0 3 400.611 4.074 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N[C@@H]1C[C@@H](C)O[C@@H](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000535061858 932895539 /nfs/dbraw/zinc/89/55/39/932895539.db2.gz SYPGNVGLPRUPMJ-QXGSTGNESA-N 0 3 415.500 4.344 20 0 HIADHN O=C(NC1CC1)c1ccc(CN(Cc2ccc(Oc3cnccn3)cc2)C2CC2)cc1 ZINC000535071571 932897469 /nfs/dbraw/zinc/89/74/69/932897469.db2.gz GSYOCVGPVGGJCG-UHFFFAOYSA-N 0 3 414.509 4.326 20 0 HIADHN O=C1NCCN1[C@H]1CCCN(Cc2ccc(-c3ccc(C(F)(F)F)cc3)s2)C1 ZINC000535083249 932899799 /nfs/dbraw/zinc/89/97/99/932899799.db2.gz VZCFYTJKXNBVDG-INIZCTEOSA-N 0 3 409.477 4.424 20 0 HIADHN O=C(CN1CC[C@@H](C2CCOCC2)C1)Nc1ccc(N2CCc3ccccc32)cc1 ZINC000535115781 932932207 /nfs/dbraw/zinc/93/22/07/932932207.db2.gz GLRZGXSVBMSJDA-OAQYLSRUSA-N 0 3 405.542 4.068 20 0 HIADHN COc1ccc([C@@H](CNCc2cnc([C@@H]3CCCO3)s2)N2CCCCC2)cc1 ZINC000535140862 932960149 /nfs/dbraw/zinc/96/01/49/932960149.db2.gz FHOHWVQTAYIKQU-RTWAWAEBSA-N 0 3 401.576 4.320 20 0 HIADHN Cc1cc(C)c(CC(C(=O)Nc2ccc3c(c2)N(C)C(=O)CO3)C(F)(F)F)c(C)c1 ZINC000535159084 932976259 /nfs/dbraw/zinc/97/62/59/932976259.db2.gz LTUULOANSZUPGL-KRWDZBQOSA-N 0 3 420.431 4.327 20 0 HIADHN CN(C)[C@@H](CNC(=O)N1CCC(Oc2ccccc2Cl)CC1)Cc1ccccc1 ZINC000535264596 933042713 /nfs/dbraw/zinc/04/27/13/933042713.db2.gz FUIQVAGYCKPFOX-LJQANCHMSA-N 0 3 415.965 4.066 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)c3ccccc3CCC(F)(F)F)CC2)C[C@H](C)O1 ZINC000535340578 933082087 /nfs/dbraw/zinc/08/20/87/933082087.db2.gz PEUSHXUTRVGEOS-IRXDYDNUSA-N 0 3 412.496 4.143 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cnn(CC(C)C)c3C(F)F)c(C)c2)CC1 ZINC000535370503 933097283 /nfs/dbraw/zinc/09/72/83/933097283.db2.gz LRKJJBBSKFFBIG-UHFFFAOYSA-N 0 3 419.520 4.179 20 0 HIADHN Cc1cc([C@H](NC(=O)N2CCC(CN3C[C@H](C)O[C@@H](C)C3)CC2)C2CC2)ccc1F ZINC000535414968 933124372 /nfs/dbraw/zinc/12/43/72/933124372.db2.gz KXUCJIAXDPBHLE-IUKKYPGJSA-N 0 3 417.569 4.116 20 0 HIADHN CC(C)Cn1ncc(C(=O)N(CCN(C)C)Cc2cccc(Cl)c2)c1C(F)F ZINC000535450998 933143864 /nfs/dbraw/zinc/14/38/64/933143864.db2.gz PDYZTADOUFUYAD-UHFFFAOYSA-N 0 3 412.912 4.334 20 0 HIADHN CN1CC[C@H](NC(=O)Cc2c[nH]c3cccc(Br)c23)[C@@H]1c1ccccc1 ZINC000535468404 933158611 /nfs/dbraw/zinc/15/86/11/933158611.db2.gz JISQDXMDGHWAPJ-RXVVDRJESA-N 0 3 412.331 4.035 20 0 HIADHN Cc1ccc(C(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)cc1NC(=O)c1ccco1 ZINC000535469139 933160586 /nfs/dbraw/zinc/16/05/86/933160586.db2.gz MLFNMBXULKCITB-SIKLNZKXSA-N 0 3 403.482 4.016 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)[C@@H](C)c2cccc(C(=O)c3ccccc3)c2)CC1 ZINC000535598267 933261176 /nfs/dbraw/zinc/26/11/76/933261176.db2.gz LMAYOHCELDJRGI-FQEVSTJZSA-N 0 3 422.569 4.027 20 0 HIADHN O=C(Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)c1cccc([C@@H]2CCOC2)c1 ZINC000535606909 933264864 /nfs/dbraw/zinc/26/48/64/933264864.db2.gz VWLBHZVKRMHCQQ-PKTZIBPZSA-N 0 3 416.525 4.086 20 0 HIADHN Cc1c(Cl)cc(F)c(NC(=O)N2CCC(CN3C[C@@H](C)O[C@H](C)C3)CC2)c1F ZINC000535621989 933272280 /nfs/dbraw/zinc/27/22/80/933272280.db2.gz NIVQSQRDMIQCQU-CHWSQXEVSA-N 0 3 415.912 4.280 20 0 HIADHN Cc1cc(NC(=O)[C@@H]2CCCN(Cc3cccnc3)C2)ccc1C(=O)OC(C)(C)C ZINC000535658167 933301702 /nfs/dbraw/zinc/30/17/02/933301702.db2.gz LALRETAVQHZHIM-LJQANCHMSA-N 0 3 409.530 4.196 20 0 HIADHN Cc1ccc2[nH]c([C@H]3CCCN([C@H](C)C(=O)N(C)Cc4cccc(F)c4)C3)nc2c1 ZINC000535666578 933312734 /nfs/dbraw/zinc/31/27/34/933312734.db2.gz VVWBNTIGKLLOBB-MJGOQNOKSA-N 0 3 408.521 4.237 20 0 HIADHN Cc1ccc2nc([C@H]3CCCN([C@H](C)C(=O)N(C)Cc4cccc(F)c4)C3)[nH]c2c1 ZINC000535666578 933312748 /nfs/dbraw/zinc/31/27/48/933312748.db2.gz VVWBNTIGKLLOBB-MJGOQNOKSA-N 0 3 408.521 4.237 20 0 HIADHN CN(C)Cc1cccc(NC(=O)N[C@@H]2CCN(C)[C@@H]2c2ccc(Cl)c(F)c2)c1 ZINC000535839377 933425015 /nfs/dbraw/zinc/42/50/15/933425015.db2.gz YGJDJIKXEYFKEB-WOJBJXKFSA-N 0 3 404.917 4.108 20 0 HIADHN CN(C)Cc1cccc(NC(=O)N[C@H]2CCN(C)[C@H]2c2ccc(Cl)c(F)c2)c1 ZINC000535839374 933425169 /nfs/dbraw/zinc/42/51/69/933425169.db2.gz YGJDJIKXEYFKEB-PMACEKPBSA-N 0 3 404.917 4.108 20 0 HIADHN COc1ccc(C(=O)NC[C@H](c2ccccc2)N2CCCC2)cc1-c1ccccn1 ZINC000535861783 933444538 /nfs/dbraw/zinc/44/45/38/933444538.db2.gz QCRWAVACLFNCOQ-HSZRJFAPSA-N 0 3 401.510 4.324 20 0 HIADHN Cc1cc(C)c(CC(C(=O)N(CCC(N)=O)c2ccccc2)C(F)(F)F)c(C)c1 ZINC000535879006 933459547 /nfs/dbraw/zinc/45/95/47/933459547.db2.gz BIABDRLXKHAZIS-IBGZPJMESA-N 0 3 406.448 4.241 20 0 HIADHN Cc1cc(C)c(CC(C(=O)Nc2ccc3c(c2)CCN3C(N)=O)C(F)(F)F)c(C)c1 ZINC000535960776 933526189 /nfs/dbraw/zinc/52/61/89/933526189.db2.gz WSWKLOQVTCTOIT-SFHVURJKSA-N 0 3 419.447 4.413 20 0 HIADHN CSc1ccc(CN(C)C(=O)CN2CCC[C@H]2Cn2c(C)nc3ccccc32)cc1 ZINC000535965274 933528024 /nfs/dbraw/zinc/52/80/24/933528024.db2.gz YGGJQBXRKZFUEK-FQEVSTJZSA-N 0 3 422.598 4.190 20 0 HIADHN CN(C)[C@H](CNC(=O)Nc1cc(C2CC2)nn1-c1ccccc1)Cc1ccccc1 ZINC000536012804 933571309 /nfs/dbraw/zinc/57/13/09/933571309.db2.gz UXURBWNSZRVCGN-NRFANRHFSA-N 0 3 403.530 4.044 20 0 HIADHN CCOc1cccc2cc([C@H](C)NC(=O)NC[C@H](Cc3ccccc3)N(C)C)oc21 ZINC000536013077 933571338 /nfs/dbraw/zinc/57/13/38/933571338.db2.gz HSNNNWRERGQDHS-PXNSSMCTSA-N 0 3 409.530 4.365 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)c1ccc(OC2CCC2)cc1Cl ZINC000536167528 933692145 /nfs/dbraw/zinc/69/21/45/933692145.db2.gz PGTLXTJDSWZQRR-UHFFFAOYSA-N 0 3 408.995 4.363 20 0 HIADHN O=C(CN[C@@H](c1ccccc1)C1CC1)N1CCC[C@H]1c1ccc2c(c1)OCCCO2 ZINC000537288360 933698146 /nfs/dbraw/zinc/69/81/46/933698146.db2.gz UTCCGLTUXSTUBE-OFVILXPXSA-N 0 3 406.526 4.252 20 0 HIADHN CCO[C@@H]1C[C@@H](N[C@H](c2ccc(C)cc2)c2cccc(S(C)(=O)=O)c2)C1(C)C ZINC000537289942 933699878 /nfs/dbraw/zinc/69/98/78/933699878.db2.gz ZGRZREAQLJPZKO-YPAWHYETSA-N 0 3 401.572 4.281 20 0 HIADHN COc1ccc(S(=O)(=O)[N-]c2cccc(C[NH2+]Cc3cccc4[nH]ccc43)c2)cc1 ZINC000537305415 933706956 /nfs/dbraw/zinc/70/69/56/933706956.db2.gz SCPFSAZVMKMCSD-UHFFFAOYSA-N 0 3 421.522 4.267 20 0 HIADHN O=C(Nc1cccc(CNCc2ccc(OCCO)cc2)c1)c1ccc(Cl)cc1 ZINC000537306764 933707827 /nfs/dbraw/zinc/70/78/27/933707827.db2.gz UIDANWBMQOTPGH-UHFFFAOYSA-N 0 3 410.901 4.253 20 0 HIADHN CN1CC[C@@H](NCc2nc(-c3ccc(Br)cc3)c[nH]2)[C@@H]1c1ccccc1 ZINC000537360744 933736301 /nfs/dbraw/zinc/73/63/01/933736301.db2.gz GWTRUVALKWPYHS-NQIIRXRSSA-N 0 3 411.347 4.374 20 0 HIADHN COCCC[C@@H](NCc1ccc2c(c1)OCCO2)c1ccc(Br)cc1 ZINC000537407397 933761768 /nfs/dbraw/zinc/76/17/68/933761768.db2.gz OVHXQTMXGZLXTK-GOSISDBHSA-N 0 3 406.320 4.478 20 0 HIADHN CN(CCCN(C)C(=O)[C@@H]1C[C@H]1c1cc(Cl)cc(Cl)c1)Cc1ccncc1 ZINC000562857291 945128747 /nfs/dbraw/zinc/12/87/47/945128747.db2.gz OCAXNQGJIFXARP-VQTJNVASSA-N 0 3 406.357 4.472 20 0 HIADHN CCOc1cc(CN(C)[C@@H](C)CO)cc(Br)c1OCc1ccccc1 ZINC000562901183 945146019 /nfs/dbraw/zinc/14/60/19/945146019.db2.gz BDABWNXONOTVLV-HNNXBMFYSA-N 0 3 408.336 4.239 20 0 HIADHN COc1ccc([C@@H](C)Nc2cccc(-n3nnnc3C)c2)cc1CN1CCCCC1 ZINC000537538752 938318387 /nfs/dbraw/zinc/31/83/87/938318387.db2.gz WWKWHFFLTZBWTH-QGZVFWFLSA-N 0 3 406.534 4.138 20 0 HIADHN COc1ccc(Cl)cc1C[C@@H]1CCCN(Cc2cnc(N3CCOCC3)s2)C1 ZINC000537615624 938333672 /nfs/dbraw/zinc/33/36/72/938333672.db2.gz ZRDQXAVKEYSHKU-INIZCTEOSA-N 0 3 421.994 4.096 20 0 HIADHN COC(=O)c1cc2c(o1)c(OC)ccc2CN1CCC(Nc2cccc(OC)c2)CC1 ZINC000537628239 938339476 /nfs/dbraw/zinc/33/94/76/938339476.db2.gz UOGGEMZYVNTQKA-UHFFFAOYSA-N 0 3 424.497 4.313 20 0 HIADHN Brc1ccc(OCc2ccccn2)c(CN2CC[C@@H]([C@H]3CCOC3)C2)c1 ZINC000537648010 938346203 /nfs/dbraw/zinc/34/62/03/938346203.db2.gz FZEVRYGKQQQFTQ-SJORKVTESA-N 0 3 417.347 4.282 20 0 HIADHN Cn1cc(CN[C@H]2CCN(c3ncc(C(F)(F)F)cc3Cl)C2)c(C(C)(C)C)n1 ZINC000537655732 938348110 /nfs/dbraw/zinc/34/81/10/938348110.db2.gz HIAYRUZWAJZADG-AWEZNQCLSA-N 0 3 415.891 4.153 20 0 HIADHN CC[C@@H]1c2ccsc2CCN1C(=O)CN1CCC[C@@H]1Cn1cnc2ccccc21 ZINC000537678899 938352376 /nfs/dbraw/zinc/35/23/76/938352376.db2.gz WCWKUIWXMPAHRX-YLJYHZDGSA-N 0 3 408.571 4.098 20 0 HIADHN C[C@@H]1CCN(Cc2cn(Cc3ccccc3)nc2-c2cccnc2)C[C@H]1n1ccnc1 ZINC000537724923 938363138 /nfs/dbraw/zinc/36/31/38/938363138.db2.gz JHFFSXVZGCVBRS-HYBUGGRVSA-N 0 3 412.541 4.273 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)c2cc(Br)ccc2F)cc1 ZINC000537729677 938364927 /nfs/dbraw/zinc/36/49/27/938364927.db2.gz HULQKVBEOUPPLC-LJQANCHMSA-N 0 3 421.310 4.164 20 0 HIADHN C[C@H](NCc1ccccc1CN1CCN(c2ccccc2)CC1)c1ccc(F)cn1 ZINC000537763140 938371861 /nfs/dbraw/zinc/37/18/61/938371861.db2.gz GCMUHNQNFXOAQD-FQEVSTJZSA-N 0 3 404.533 4.394 20 0 HIADHN Brc1ccc2c(c1)[C@H](NCc1cccnc1-n1cccn1)CCS2 ZINC000537768568 938373370 /nfs/dbraw/zinc/37/33/70/938373370.db2.gz XJSJRXTWCCXJGE-MRXNPFEDSA-N 0 3 401.333 4.357 20 0 HIADHN CC(C)(C)OC(=O)c1ccc(C(=O)Nc2cccc(CN3CCC(CO)CC3)c2)cc1 ZINC000537776452 938374368 /nfs/dbraw/zinc/37/43/68/938374368.db2.gz IFZPNZLZHBNLEJ-UHFFFAOYSA-N 0 3 424.541 4.099 20 0 HIADHN CCCn1cc(CNc2cccc(N3CCN(CCc4ccccc4)CC3)c2)cn1 ZINC000537776634 938374575 /nfs/dbraw/zinc/37/45/75/938374575.db2.gz LELZVQIZNOUGQT-UHFFFAOYSA-N 0 3 403.574 4.270 20 0 HIADHN CCc1nc2ccccc2n1C1CCN([C@@H](C)C(=O)N2CCc3sccc3C2)CC1 ZINC000537856639 938391553 /nfs/dbraw/zinc/39/15/53/938391553.db2.gz HFKJPPZUOVQEGA-KRWDZBQOSA-N 0 3 422.598 4.271 20 0 HIADHN COc1cc(NC(C)=O)ccc1[C@@H](C)N[C@H]1CCN(c2ccc(Cl)c(F)c2)C1 ZINC000537941644 938425522 /nfs/dbraw/zinc/42/55/22/938425522.db2.gz YPSUATVKKJDWDB-CJNGLKHVSA-N 0 3 405.901 4.376 20 0 HIADHN Cc1cccc(NC(=O)C[C@H](C)N[C@H](c2ccc(Cl)cc2)[C@H]2CN(C)CCO2)c1 ZINC000537943241 938426104 /nfs/dbraw/zinc/42/61/04/938426104.db2.gz HIVTWFPZUKRAJG-AMHTUMDSSA-N 0 3 415.965 4.027 20 0 HIADHN CC(C)C[C@H](N[C@@H](C)c1ccc(NC(=O)NC(C)C)cc1)C(=O)Nc1nccs1 ZINC000537952597 938430832 /nfs/dbraw/zinc/43/08/32/938430832.db2.gz MBFKIQKYAIAQCK-YJBOKZPZSA-N 0 3 417.579 4.377 20 0 HIADHN CC(C)CC[C@@H](NC[C@@H](O)CS(=O)(=O)c1cccs1)c1ccc(Cl)cc1 ZINC000537953941 938431148 /nfs/dbraw/zinc/43/11/48/938431148.db2.gz NUGINISTCNLCJH-QZTJIDSGSA-N 0 3 416.008 4.303 20 0 HIADHN CSc1ccc([C@@H](C)NC[C@H](O)COc2ccccc2Br)cc1F ZINC000537955074 938431168 /nfs/dbraw/zinc/43/11/68/938431168.db2.gz GDFYWTBLQFMORV-OCCSQVGLSA-N 0 3 414.340 4.401 20 0 HIADHN Cc1c([C@@H](C)NC2CCN(C(=O)c3ccccc3)CC2)nnn1-c1ccc(Cl)cc1 ZINC000537965027 938437250 /nfs/dbraw/zinc/43/72/50/938437250.db2.gz PWNGQZHZGSRZPY-MRXNPFEDSA-N 0 3 423.948 4.185 20 0 HIADHN C[C@H](NCc1ccc(OCCO)cc1)c1cccc(OCc2cn3ccccc3n2)c1 ZINC000537972874 938441700 /nfs/dbraw/zinc/44/17/00/938441700.db2.gz HARGJGLVMGFFLP-IBGZPJMESA-N 0 3 417.509 4.135 20 0 HIADHN CC(=O)Nc1cccc([C@@H](C)NCCC(=O)Nc2cc(Br)ccc2C)c1 ZINC000537979968 938446274 /nfs/dbraw/zinc/44/62/74/938446274.db2.gz CIGHPYVYYFRPIS-CQSZACIVSA-N 0 3 418.335 4.395 20 0 HIADHN COc1cc(NC(C)=O)ccc1[C@@H](C)NCCOc1cccc(Br)c1 ZINC000537985706 938448721 /nfs/dbraw/zinc/44/87/21/938448721.db2.gz DPMLQGQVVHFFRF-CYBMUJFWSA-N 0 3 407.308 4.146 20 0 HIADHN C[C@@H](NCc1ccccc1OCC(=O)NC[C@H]1CCCO1)c1ccc2ccccc2c1 ZINC000537987561 938449582 /nfs/dbraw/zinc/44/95/82/938449582.db2.gz QREGYFPYFVRMIP-NTKDMRAZSA-N 0 3 418.537 4.365 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(Cl)cc2)CC1)[C@H]1C[C@@H]1c1ccc(F)cc1 ZINC000537987335 938449845 /nfs/dbraw/zinc/44/98/45/938449845.db2.gz NSVRTZUVWDNOKI-YADHBBJMSA-N 0 3 416.924 4.242 20 0 HIADHN CC[C@H](N[C@@H](C)c1ccc(S(=O)(=O)N(C)C)cc1)c1ccc(OC(F)F)cc1 ZINC000537991283 938453015 /nfs/dbraw/zinc/45/30/15/938453015.db2.gz QSBLUVUJDQCJMC-LIRRHRJNSA-N 0 3 412.502 4.340 20 0 HIADHN CN(C)CCN(C[C@@H]1CCCO1)C(=O)Nc1ccc(Br)c2ccccc12 ZINC000538051084 938483905 /nfs/dbraw/zinc/48/39/05/938483905.db2.gz BTPWVKLNYDKGPJ-HNNXBMFYSA-N 0 3 420.351 4.177 20 0 HIADHN CCOc1c(Br)cc(Cl)cc1NC(=O)N1CCCN(CC)CC1 ZINC000538081415 938497618 /nfs/dbraw/zinc/49/76/18/938497618.db2.gz BYEIUZCBLVHCOR-UHFFFAOYSA-N 0 3 404.736 4.061 20 0 HIADHN COc1cc([C@H](C)N[C@@H](C)c2ccc(S(N)(=O)=O)cc2)ccc1OCCC(C)C ZINC000538116472 938507077 /nfs/dbraw/zinc/50/70/77/938507077.db2.gz LFTCSQMWBLFRTO-IRXDYDNUSA-N 0 3 420.575 4.179 20 0 HIADHN COCCOc1ccc(C(F)(F)F)cc1NC(=O)CN[C@@H](C)c1ccc(C)cc1 ZINC000538128108 938513207 /nfs/dbraw/zinc/51/32/07/938513207.db2.gz GSJMCFOJPCJLMX-HNNXBMFYSA-N 0 3 410.436 4.328 20 0 HIADHN COc1ccc(CNC(=O)CN[C@H](CC(C)(C)C)c2ccc(F)cc2)cc1OC ZINC000538151163 938522720 /nfs/dbraw/zinc/52/27/20/938522720.db2.gz ORXIEURZNQRKSQ-LJQANCHMSA-N 0 3 402.510 4.226 20 0 HIADHN CC(C)OC(=O)c1ccc(NC(=O)[C@H](C)N[C@@H](C)c2ccccc2-n2cccn2)cc1 ZINC000538159831 938529519 /nfs/dbraw/zinc/52/95/19/938529519.db2.gz IQPUAHOXMFNUHK-ROUUACIJSA-N 0 3 420.513 4.115 20 0 HIADHN C[C@H](NCC(=O)N1CCC(Cc2ccccc2)CC1)c1ccccc1-n1cccn1 ZINC000538160449 938529716 /nfs/dbraw/zinc/52/97/16/938529716.db2.gz YIAJOBQTXDDNQY-FQEVSTJZSA-N 0 3 402.542 4.004 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(OCC(F)(F)F)cc1)C(=O)NCCc1ccc(F)cc1 ZINC000538164820 938531869 /nfs/dbraw/zinc/53/18/69/938531869.db2.gz XMMPOSOHFNBQKX-HUUCEWRRSA-N 0 3 412.427 4.165 20 0 HIADHN CCOc1ccc([C@@H]2CCCN2C(=O)CN[C@@H](c2ccccc2)[C@@H]2CCOC2)cc1 ZINC000538189562 938545766 /nfs/dbraw/zinc/54/57/66/938545766.db2.gz GFJJFVHDVYLPGD-VTZPFEBOSA-N 0 3 408.542 4.116 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(NC(=O)c2ccncc2)cc1)C(=O)NCC1CCCCC1 ZINC000538195464 938548418 /nfs/dbraw/zinc/54/84/18/938548418.db2.gz UMUYYVRFRAYONE-QZTJIDSGSA-N 0 3 408.546 4.070 20 0 HIADHN CC[C@@H]1CCCCN1C(=O)[C@H](C)N[C@H](C)c1ccc(NC(=O)c2ccncc2)cc1 ZINC000538197812 938550133 /nfs/dbraw/zinc/55/01/33/938550133.db2.gz LLOQTHGWPUNMNC-KGVIQGDOSA-N 0 3 408.546 4.164 20 0 HIADHN Cc1ccc(NC(=O)CN[C@H](C[C@@H]2CCOC2)c2ccccc2)c(Br)c1 ZINC000538234605 938568688 /nfs/dbraw/zinc/56/86/88/938568688.db2.gz UBPMZUCIGJEGHX-OXJNMPFZSA-N 0 3 417.347 4.454 20 0 HIADHN C[C@@H](CCCc1ccccc1)C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000538299844 938586974 /nfs/dbraw/zinc/58/69/74/938586974.db2.gz WPNAHNXTIPIHJN-FQEVSTJZSA-N 0 3 412.549 4.444 20 0 HIADHN CCN(Cc1ccc(OC)c(OC)c1)C(=O)CN[C@H](c1ccc(F)c(C)c1)C1CC1 ZINC000538323424 938592556 /nfs/dbraw/zinc/59/25/56/938592556.db2.gz OSVSMNKSHDDNRZ-DEOSSOPVSA-N 0 3 414.521 4.241 20 0 HIADHN CCN(Cc1ccc(OC)c(OC)c1)C(=O)CN[C@@H](c1ccc(F)c(C)c1)C1CC1 ZINC000538323426 938592635 /nfs/dbraw/zinc/59/26/35/938592635.db2.gz OSVSMNKSHDDNRZ-XMMPIXPASA-N 0 3 414.521 4.241 20 0 HIADHN Cc1c(Cl)cccc1NC(=O)[C@@H](C)N[C@H](c1ccc2c(c1)OCCO2)C1CC1 ZINC000538389847 938608963 /nfs/dbraw/zinc/60/89/63/938608963.db2.gz JMIQNGAWHGQRTJ-SZNDQCEHSA-N 0 3 400.906 4.488 20 0 HIADHN CCOC(=O)C1CCN(C(=O)[C@H](C)N[C@@H](c2ccc(CC(C)C)cc2)C2CC2)CC1 ZINC000538390558 938609532 /nfs/dbraw/zinc/60/95/32/938609532.db2.gz SBEHCVZPILIDAG-MBSDFSHPSA-N 0 3 414.590 4.116 20 0 HIADHN C[C@H](N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1)c1ccc2c(c1)OCCO2 ZINC000538552938 938647734 /nfs/dbraw/zinc/64/77/34/938647734.db2.gz ZRPQYKIIDAKTRL-CVDCTZTESA-N 0 3 416.521 4.036 20 0 HIADHN COc1cc(CNc2cc(CN(C)C)ccn2)cc(OC)c1OCc1ccccc1 ZINC000538608615 938660705 /nfs/dbraw/zinc/66/07/05/938660705.db2.gz YIZKRGXIBWKLQJ-UHFFFAOYSA-N 0 3 407.514 4.352 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)c1cnn(Cc2ccccc2Cl)c1)c1ccco1 ZINC000563472592 945194419 /nfs/dbraw/zinc/19/44/19/945194419.db2.gz QARCLKLFHKPZKP-HNAYVOBHSA-N 0 3 400.910 4.037 20 0 HIADHN C[C@H](c1ccccc1)N(C)C(=O)CN1CCC[C@H](c2nc(C3CCCCC3)n[nH]2)C1 ZINC000538664901 938678945 /nfs/dbraw/zinc/67/89/45/938678945.db2.gz CGSYUXZMBCHGFS-NQIIRXRSSA-N 0 3 409.578 4.251 20 0 HIADHN C[C@H](c1ccccc1)N(C)C(=O)CN1CCC[C@H](c2n[nH]c(C3CCCCC3)n2)C1 ZINC000538664901 938678947 /nfs/dbraw/zinc/67/89/47/938678947.db2.gz CGSYUXZMBCHGFS-NQIIRXRSSA-N 0 3 409.578 4.251 20 0 HIADHN C/C(=C/c1ccccc1)CN1CCC(C(=O)c2ccc3c(c2)NC(=O)[C@H](C)O3)CC1 ZINC000538739615 938697801 /nfs/dbraw/zinc/69/78/01/938697801.db2.gz INTVNIBWZUHDOQ-DNKLCNGGSA-N 0 3 404.510 4.404 20 0 HIADHN C[C@H](NCc1cc(C(F)(F)F)ccc1N1CCN(C)CC1)c1ccccc1N(C)C ZINC000538747067 938700313 /nfs/dbraw/zinc/70/03/13/938700313.db2.gz ZSTWBEKMTHOKJR-KRWDZBQOSA-N 0 3 420.523 4.374 20 0 HIADHN Cc1cc(N2CCN(C)CC2)ccc1NCc1ccccc1OCc1ccncc1 ZINC000538824254 938720768 /nfs/dbraw/zinc/72/07/68/938720768.db2.gz RXJZGNXXTAEISP-UHFFFAOYSA-N 0 3 402.542 4.333 20 0 HIADHN Cc1nc(COc2ccc(CN(C)Cc3cccc(OC(F)(F)F)c3)cc2)no1 ZINC000538828068 938721250 /nfs/dbraw/zinc/72/12/50/938721250.db2.gz IYCABCBBBLFVCW-UHFFFAOYSA-N 0 3 407.392 4.488 20 0 HIADHN CS(=O)(=O)Cc1cccc(CN[C@@H]2CCCc3ccc(Br)cc32)c1 ZINC000538869324 938728693 /nfs/dbraw/zinc/72/86/93/938728693.db2.gz OGNKUXMMIQZLLJ-LJQANCHMSA-N 0 3 408.361 4.161 20 0 HIADHN COc1ccc([C@H](Cc2ccc(F)cc2)NCc2cccnc2-n2cccn2)cc1 ZINC000538869973 938728890 /nfs/dbraw/zinc/72/88/90/938728890.db2.gz ZCEFOSOOXOHEQV-QHCPKHFHSA-N 0 3 402.473 4.489 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)c2ccc(C(=O)OC(C)(C)C)cc2)CC1 ZINC000538875601 938729341 /nfs/dbraw/zinc/72/93/41/938729341.db2.gz SAQOMXFMJGVONG-UHFFFAOYSA-N 0 3 408.542 4.379 20 0 HIADHN COCCn1ccc2ccc(NC(=O)N(C)[C@@H]3CCN(Cc4ccccc4)C3)cc21 ZINC000538900447 938733564 /nfs/dbraw/zinc/73/35/64/938733564.db2.gz CIICVTXRYZBLLM-JOCHJYFZSA-N 0 3 406.530 4.026 20 0 HIADHN COCCn1ccc2ccc(NC(=O)N[C@H]3CCN([C@@H](C)c4ccccc4)C3)cc21 ZINC000538906471 938735336 /nfs/dbraw/zinc/73/53/36/938735336.db2.gz ODRAIJNBRBMNER-AVRDEDQJSA-N 0 3 406.530 4.245 20 0 HIADHN Cc1cc(NC(=O)N[C@@H]2CC23CCCCC3)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000538947553 938745106 /nfs/dbraw/zinc/74/51/06/938745106.db2.gz CUFMLBNMGKODET-LEWJYISDSA-N 0 3 407.562 4.483 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N[C@H](c2ccccc2)[C@@H]2CCOC2)N2CCCC2)cc1 ZINC000538999442 938764983 /nfs/dbraw/zinc/76/49/83/938764983.db2.gz RIPDZCNJRAJCQU-TZRRMPRUSA-N 0 3 407.558 4.209 20 0 HIADHN COc1ccc(CN(C(=O)N[C@@H]2CCN(C3CC3)C2)[C@@H]2CCCC[C@H]2C)cc1OC ZINC000539017014 938770169 /nfs/dbraw/zinc/77/01/69/938770169.db2.gz XWRZEBNORXTSBZ-YFVAEKQCSA-N 0 3 415.578 4.031 20 0 HIADHN C[C@@H]1Cc2ccc(F)cc2[C@@H]1NCc1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000539018481 938770429 /nfs/dbraw/zinc/77/04/29/938770429.db2.gz LZUXFYICPOWDOP-OPAMFIHVSA-N 0 3 402.535 4.023 20 0 HIADHN Cc1nc(Cc2ccccc2)sc1[C@@H](C)NCc1ccc(NS(C)(=O)=O)cc1 ZINC000539020283 938771017 /nfs/dbraw/zinc/77/10/17/938771017.db2.gz CZOWDIYYBFSWMD-OAHLLOKOSA-N 0 3 415.584 4.265 20 0 HIADHN CC(C)c1ccc([C@@H](C)NCc2ccc(S(=O)(=O)NC[C@H]3CCCO3)cc2)cc1 ZINC000539041336 938778761 /nfs/dbraw/zinc/77/87/61/938778761.db2.gz MAFJJDGZCIBRNQ-XMSQKQJNSA-N 0 3 416.587 4.118 20 0 HIADHN C[C@H]1CCc2c(F)cccc2[C@H]1NCc1ccccc1CS(=O)(=O)N1CCCC1 ZINC000539043219 938779494 /nfs/dbraw/zinc/77/94/94/938779494.db2.gz GAVIHTSDXSLKIU-SBUREZEXSA-N 0 3 416.562 4.165 20 0 HIADHN C[C@@H]1CCc2c(F)cccc2[C@@H]1NCc1ccccc1CS(=O)(=O)N1CCCC1 ZINC000539043220 938779725 /nfs/dbraw/zinc/77/97/25/938779725.db2.gz GAVIHTSDXSLKIU-UZUQRXQVSA-N 0 3 416.562 4.165 20 0 HIADHN C[C@H](Cn1ncc2ccccc2c1=O)N[C@H](C)c1ccc(F)c(Br)c1 ZINC000539044229 938780098 /nfs/dbraw/zinc/78/00/98/938780098.db2.gz VVRVXEOCMBWXHN-CHWSQXEVSA-N 0 3 404.283 4.037 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(S(=O)(=O)C2CCCC2)cc1)c1ccc(-n2ccnn2)cc1 ZINC000539043754 938780318 /nfs/dbraw/zinc/78/03/18/938780318.db2.gz QIXWOCZQQXSQOH-QZTJIDSGSA-N 0 3 424.570 4.395 20 0 HIADHN Cc1ccc(NC(=O)C[C@H](C)N[C@H](CO)c2ccc(Br)cc2)c(C)c1 ZINC000539045743 938780810 /nfs/dbraw/zinc/78/08/10/938780810.db2.gz BLLSPJJGFXJRQM-HNAYVOBHSA-N 0 3 405.336 4.106 20 0 HIADHN CCc1ccccc1NC(=O)C[C@H](C)N[C@H]1CC(=O)N(C)[C@H]1c1ccc(Cl)cc1 ZINC000539049569 938782574 /nfs/dbraw/zinc/78/25/74/938782574.db2.gz UVEYCTGQNOBBMZ-RSDPBLMXSA-N 0 3 413.949 4.181 20 0 HIADHN O[C@H](CN[C@@H]1CCSc2c(F)cccc21)COc1ccccc1Br ZINC000539060315 938787785 /nfs/dbraw/zinc/78/77/85/938787785.db2.gz UBNMBELQVHFSDW-MLGOLLRUSA-N 0 3 412.324 4.155 20 0 HIADHN COc1cccc2c1CC[C@H]2NCc1ccc(Br)cc1N1CCOCC1 ZINC000539067077 938791462 /nfs/dbraw/zinc/79/14/62/938791462.db2.gz SNKKYBCSBHWQJV-LJQANCHMSA-N 0 3 417.347 4.071 20 0 HIADHN O=C(Nc1ccccc1)[C@H](NC1CCN(Cc2ccccn2)CC1)c1ccccc1 ZINC000539074017 938794999 /nfs/dbraw/zinc/79/49/99/938794999.db2.gz SQNUSVHIBMXOJW-XMMPIXPASA-N 0 3 400.526 4.016 20 0 HIADHN C[C@H](NCc1ccc(C(=O)N2C[C@@H](C)O[C@@H](C)C2)cc1)c1cnc2ccsc2c1 ZINC000539089573 938800465 /nfs/dbraw/zinc/80/04/65/938800465.db2.gz AYYLGJBRXUBNEP-BBWFWOEESA-N 0 3 409.555 4.397 20 0 HIADHN CCN(CC)C(=O)Nc1ccc([C@H](C)N[C@@H]2C[C@H](C)N(c3ccccc3)C2=O)cc1 ZINC000539090055 938800832 /nfs/dbraw/zinc/80/08/32/938800832.db2.gz YSNGKEYMHRLTKX-NPPFBWRTSA-N 0 3 408.546 4.405 20 0 HIADHN CC[C@@H](NCc1ccccc1OCC(=O)NC[C@@H]1CCCO1)c1ccc(Cl)cc1 ZINC000539091163 938801000 /nfs/dbraw/zinc/80/10/00/938801000.db2.gz GYBKPEDFARRXFC-LEWJYISDSA-N 0 3 416.949 4.255 20 0 HIADHN C[C@H](NCc1ccc(S(=O)(=O)N2CCCC2)cc1)c1ccc(C(F)(F)F)cc1 ZINC000539093408 938801637 /nfs/dbraw/zinc/80/16/37/938801637.db2.gz LFATVQXQQPGOIE-HNNXBMFYSA-N 0 3 412.477 4.341 20 0 HIADHN CCCN1c2ccc(NC(=O)N(C)[C@H]3CCN(Cc4ccccc4)C3)cc2CCC1=O ZINC000539134631 938808854 /nfs/dbraw/zinc/80/88/54/938808854.db2.gz YNVXHBDUOONCND-QFIPXVFZSA-N 0 3 420.557 4.114 20 0 HIADHN CCN1CCCN(C(=O)Nc2nc(C3CC3)c(Cc3ccc(F)cc3)s2)CC1 ZINC000539145909 938810880 /nfs/dbraw/zinc/81/08/80/938810880.db2.gz GHAWODRDLDVLCO-UHFFFAOYSA-N 0 3 402.539 4.310 20 0 HIADHN C[C@H](NCc1ccc(Sc2ccc(F)cc2)cc1)c1ccc(S(N)(=O)=O)cc1 ZINC000539198343 938818271 /nfs/dbraw/zinc/81/82/71/938818271.db2.gz IICLTOFKZRRLGU-HNNXBMFYSA-N 0 3 416.543 4.475 20 0 HIADHN CS(=O)(=O)Cc1cccc(CN[C@H](c2ccc(Br)cc2)C2CC2)c1 ZINC000539201045 938818538 /nfs/dbraw/zinc/81/85/38/938818538.db2.gz LACNWVBSBSWKSL-IBGZPJMESA-N 0 3 408.361 4.235 20 0 HIADHN Cc1cc([C@@H](NCc2ccccc2CS(=O)(=O)NC(C)C)C2CC2)ccc1F ZINC000539199975 938818547 /nfs/dbraw/zinc/81/85/47/938818547.db2.gz QPZYLCPPTUABHN-QFIPXVFZSA-N 0 3 404.551 4.203 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)N1CCc2sccc2C1)c1ccc(OCc2cccnc2)cc1 ZINC000539226377 938821855 /nfs/dbraw/zinc/82/18/55/938821855.db2.gz NGFGRVCUKNSWOM-MSOLQXFVSA-N 0 3 421.566 4.346 20 0 HIADHN CC(C)c1ccc([C@H](NCC(=O)Nc2ccc(S(C)(=O)=O)cc2)C(C)C)cc1 ZINC000539241108 938824132 /nfs/dbraw/zinc/82/41/32/938824132.db2.gz ACQSMEWJJDKEKT-JOCHJYFZSA-N 0 3 402.560 4.139 20 0 HIADHN C[C@H](NCC(=O)NC1CCN(C(=O)C2CCCCC2)CC1)c1cccc2ccccc21 ZINC000539241796 938824181 /nfs/dbraw/zinc/82/41/81/938824181.db2.gz LPEDRTFEDBXHNP-IBGZPJMESA-N 0 3 421.585 4.178 20 0 HIADHN CC(C)[C@@H](NCC(=O)Nc1ccccc1Br)c1ccc2c(c1)OCCO2 ZINC000539242826 938824561 /nfs/dbraw/zinc/82/45/61/938824561.db2.gz AIDHSZZLPHUBRL-HXUWFJFHSA-N 0 3 419.319 4.146 20 0 HIADHN C[C@H](NC[C@H](O)COc1cccc(Br)c1)c1ccccc1OC(F)F ZINC000539245943 938824776 /nfs/dbraw/zinc/82/47/76/938824776.db2.gz IBLDOPAZBTUFOV-JSGCOSHPSA-N 0 3 416.262 4.141 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Nc1ccccc1C(=O)OC(C)(C)C ZINC000539258718 938828506 /nfs/dbraw/zinc/82/85/06/938828506.db2.gz GSDBTMWWYHZJIY-UHFFFAOYSA-N 0 3 403.548 4.299 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)N(C)Cc1c(F)cccc1Cl)c1ccccc1-n1cccn1 ZINC000539259886 938828866 /nfs/dbraw/zinc/82/88/66/938828866.db2.gz BYWSOWTZZCNSNX-CVEARBPZSA-N 0 3 414.912 4.363 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)N(C)Cc1nc2ccccc2s1)c1ccccc1-n1cccn1 ZINC000539261456 938829177 /nfs/dbraw/zinc/82/91/77/938829177.db2.gz PCLNSJPZMLBTPU-SJORKVTESA-N 0 3 419.554 4.180 20 0 HIADHN C[C@@H](NCC(=O)N(C)[C@H](C)c1cc2ccccc2o1)c1cccc(-n2cccn2)c1 ZINC000539286546 938833899 /nfs/dbraw/zinc/83/38/99/938833899.db2.gz LZLSVGSYALOEAR-QZTJIDSGSA-N 0 3 402.498 4.489 20 0 HIADHN O=C(CN[C@@H](c1ccccc1)[C@@H]1CCOC1)Nc1ccc2c(c1)OC1(CCCCC1)O2 ZINC000539288768 938834239 /nfs/dbraw/zinc/83/42/39/938834239.db2.gz FDWVDSSQSWOCOO-DVECYGJZSA-N 0 3 422.525 4.424 20 0 HIADHN COc1cc(F)c([C@H](C)NC[C@@H](O)Cc2ccc(C(F)(F)F)cc2)cc1OC ZINC000539288727 938834244 /nfs/dbraw/zinc/83/42/44/938834244.db2.gz DUZSOWRUJJONCX-WFASDCNBSA-N 0 3 401.400 4.116 20 0 HIADHN CCOc1ccccc1[C@H](CC)NC(=O)CN[C@H](C)c1cccc(-n2cccn2)c1 ZINC000539290351 938834498 /nfs/dbraw/zinc/83/44/98/938834498.db2.gz YEZRNJJJRPCPPZ-GCJKJVERSA-N 0 3 406.530 4.189 20 0 HIADHN C[C@H](NC[C@H]1CC[C@@H](C(=O)N(C)C)O1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000539295698 938835577 /nfs/dbraw/zinc/83/55/77/938835577.db2.gz QQYHFYZRCYDCQH-VQISRLSMSA-N 0 3 412.374 4.011 20 0 HIADHN COc1cc(C(C)=O)ccc1OC[C@H](O)CNC(C)(c1ccccc1)c1ccccc1 ZINC000539307077 938837814 /nfs/dbraw/zinc/83/78/14/938837814.db2.gz OGAGGQIQMJLYJY-HSZRJFAPSA-N 0 3 419.521 4.191 20 0 HIADHN Cc1cc(NC(=O)CN[C@@H](C[C@@H]2CCOC2)c2ccccc2)ccc1Br ZINC000539324106 938841276 /nfs/dbraw/zinc/84/12/76/938841276.db2.gz CJRWAESSSIDUKP-JXFKEZNVSA-N 0 3 417.347 4.454 20 0 HIADHN O=C(CN[C@H](C[C@@H]1CCOC1)c1ccccc1)Nc1ccc2c(c1)OC1(CCCC1)O2 ZINC000539325258 938841710 /nfs/dbraw/zinc/84/17/10/938841710.db2.gz GLTOUYMPYHCOGN-GHTZIAJQSA-N 0 3 422.525 4.424 20 0 HIADHN CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H](c2ccccc2F)C2CCCC2)cc1 ZINC000539325822 938842073 /nfs/dbraw/zinc/84/20/73/938842073.db2.gz PISBDRHZHOMXGD-WMZHIEFXSA-N 0 3 400.494 4.045 20 0 HIADHN O=C(CN[C@H](CC1CCCC1)c1ccccc1)NCc1cccc(C(=O)NC2CC2)c1 ZINC000539328532 938842648 /nfs/dbraw/zinc/84/26/48/938842648.db2.gz GLRYPJAAPFGGIV-XMMPIXPASA-N 0 3 419.569 4.106 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(-n2cccn2)cc1)C(=O)Nc1ccc(OC(F)F)cc1 ZINC000539337603 938844463 /nfs/dbraw/zinc/84/44/63/938844463.db2.gz CXIHWBCUBIMRTP-GJZGRUSLSA-N 0 3 400.429 4.152 20 0 HIADHN Cc1ccccc1[C@@H](NCC(=O)Nc1cc(S(C)(=O)=O)ccc1Cl)C(C)(C)C ZINC000539361613 938848792 /nfs/dbraw/zinc/84/87/92/938848792.db2.gz ZYWXEHFZGFHPGO-HXUWFJFHSA-N 0 3 422.978 4.367 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)N[C@@H](C)C(=O)Nc2ccc(OC(F)F)cc2)cc1 ZINC000539368352 938849977 /nfs/dbraw/zinc/84/99/77/938849977.db2.gz OQSWPMRIGWMIJW-CABCVRRESA-N 0 3 414.456 4.460 20 0 HIADHN COc1cc(N[C@@H]2CCCN(Cc3cn(C)nc3-c3ccccc3)C2)cc(OC)c1 ZINC000539406138 938855883 /nfs/dbraw/zinc/85/58/83/938855883.db2.gz YAGYQPUTQGHHOG-HXUWFJFHSA-N 0 3 406.530 4.181 20 0 HIADHN C[C@@H]1C[C@H]1[C@H](NCC(=O)Nc1ccccc1N1CCCC1=O)c1ccc(Cl)cc1 ZINC000539421132 938857928 /nfs/dbraw/zinc/85/79/28/938857928.db2.gz BGWSFAMAJSVMFU-OMXJDXKCSA-N 0 3 411.933 4.392 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)N[C@H]1CCO[C@H]1c1ccc(F)c(F)c1 ZINC000539439696 938860533 /nfs/dbraw/zinc/86/05/33/938860533.db2.gz PAQZQKNMIHVBKE-ICSRJNTNSA-N 0 3 400.425 4.033 20 0 HIADHN COc1ccc([C@H](NCC(=O)N(C)Cc2ccccc2Br)C2CC2)cc1 ZINC000539492381 938868209 /nfs/dbraw/zinc/86/82/09/938868209.db2.gz RPLVOGLAGNBGSW-OAQYLSRUSA-N 0 3 417.347 4.157 20 0 HIADHN C[C@H](N[C@H](c1ccc2c(c1)OCCO2)C1CC1)C(=O)Nc1ccccc1OC(F)F ZINC000539493028 938868269 /nfs/dbraw/zinc/86/82/69/938868269.db2.gz GPHDWGNQYSCZMT-RBZFPXEDSA-N 0 3 418.440 4.127 20 0 HIADHN CC(C)(C)c1nn(Cc2ccccc2)cc1CN[C@@H]1CCN(c2ncccc2F)C1 ZINC000539521844 938872860 /nfs/dbraw/zinc/87/28/60/938872860.db2.gz UGYLCXYWTILYQH-HXUWFJFHSA-N 0 3 407.537 4.132 20 0 HIADHN CCN1CCN(Cc2ccc(N[C@@H](C)c3cccc(N4CCCC4=O)c3)cc2)CC1 ZINC000539635115 938891428 /nfs/dbraw/zinc/89/14/28/938891428.db2.gz SDHQPOMMWHTJGO-FQEVSTJZSA-N 0 3 406.574 4.124 20 0 HIADHN CCN1CCN(c2ccccc2N[C@H](C)c2ccc(OCCOC)c(OC)c2)CC1 ZINC000539646730 938893332 /nfs/dbraw/zinc/89/33/32/938893332.db2.gz DHDWDQIAADECJQ-LJQANCHMSA-N 0 3 413.562 4.035 20 0 HIADHN O=C(Nc1ccc2nc(-c3ccccn3)oc2c1)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000539726039 938914221 /nfs/dbraw/zinc/91/42/21/938914221.db2.gz QHBHMXURTROYNZ-IBGZPJMESA-N 0 3 413.481 4.286 20 0 HIADHN C[C@H](NC(=O)CN1CCC[C@H](c2n[nH]c(C3CCCCC3)n2)C1)c1ccc(F)cc1 ZINC000539763712 938928066 /nfs/dbraw/zinc/92/80/66/938928066.db2.gz XONPUKSWGMOVDO-LPHOPBHVSA-N 0 3 413.541 4.048 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)CN[C@@]2(C)CCCc3ccccc32)c(C(F)(F)F)c1 ZINC000539798694 938937203 /nfs/dbraw/zinc/93/72/03/938937203.db2.gz OGHSTIRFBPPXHW-NRFANRHFSA-N 0 3 419.447 4.444 20 0 HIADHN COc1ccc([C@H](CO)N(C)Cc2cc(C)c(OCc3ccccn3)c(C)c2)cc1 ZINC000539828055 938949383 /nfs/dbraw/zinc/94/93/83/938949383.db2.gz DJLKYQHTTYYDIC-DEOSSOPVSA-N 0 3 406.526 4.451 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)CCn1c2ccccc2nc1C1CC1 ZINC000539841424 938954832 /nfs/dbraw/zinc/95/48/32/938954832.db2.gz YUFCNPKKZKWNCR-UHFFFAOYSA-N 0 3 408.521 4.033 20 0 HIADHN COc1cc(OC)cc(N2CCCN(Cc3ccc(OC)c(OC(F)F)c3)CC2)c1 ZINC000539859722 938960071 /nfs/dbraw/zinc/96/00/71/938960071.db2.gz HGGCTWAKNOWHTL-UHFFFAOYSA-N 0 3 422.472 4.026 20 0 HIADHN CO[C@@H](C)c1noc(CN2CCCN(Cc3cccc(-c4ccc(C)cc4)c3)CC2)n1 ZINC000539893011 938969441 /nfs/dbraw/zinc/96/94/41/938969441.db2.gz LCUYVRFNGMKPMD-FQEVSTJZSA-N 0 3 420.557 4.460 20 0 HIADHN CC(C)c1ccccc1NC(=O)C[C@@H](C)N[C@H]1CC(=O)N(c2c(F)cccc2F)C1 ZINC000539967474 938982235 /nfs/dbraw/zinc/98/22/35/938982235.db2.gz SHHKVGVWAOPGNF-CVEARBPZSA-N 0 3 415.484 4.200 20 0 HIADHN CC(C)c1ccccc1NC(=O)C[C@@H](C)N[C@@H]1CC(=O)N(c2c(F)cccc2F)C1 ZINC000539967480 938982410 /nfs/dbraw/zinc/98/24/10/938982410.db2.gz SHHKVGVWAOPGNF-HZPDHXFCSA-N 0 3 415.484 4.200 20 0 HIADHN CO[C@H](c1ccc(F)cc1)[C@@H](C)NC(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000540015420 939040432 /nfs/dbraw/zinc/04/04/32/939040432.db2.gz DZFTXZJVWZGHEN-ZTNFWEORSA-N 0 3 405.539 4.100 20 0 HIADHN COc1cc(OC)cc(N2CC[C@H](CN[C@@H](C)c3nc4c(s3)CCCC4)C2)c1 ZINC000540084388 939064231 /nfs/dbraw/zinc/06/42/31/939064231.db2.gz BKWSTRHQKVSOQV-JKSUJKDBSA-N 0 3 401.576 4.216 20 0 HIADHN C[C@@H](NC[C@@H](CO)Cc1cccc(OC(F)(F)F)c1)c1nc2c(s1)CCCC2 ZINC000540086790 939064967 /nfs/dbraw/zinc/06/49/67/939064967.db2.gz QLFKJVVUWKQGIH-HIFRSBDPSA-N 0 3 414.493 4.422 20 0 HIADHN C[C@@H](NCc1ccc(S(=O)(=O)N2CCCC2)cc1)c1ccc(-c2ccncc2)cc1 ZINC000540119361 939079601 /nfs/dbraw/zinc/07/96/01/939079601.db2.gz UIHKCJDIHKXNQV-LJQANCHMSA-N 0 3 421.566 4.384 20 0 HIADHN C[C@H](N[C@@H]1CCCN(CC(F)(F)F)C1=O)c1ccc(OCc2ccccc2)cc1 ZINC000540152152 939092781 /nfs/dbraw/zinc/09/27/81/939092781.db2.gz VWEJIYGDRAAIGN-OXJNMPFZSA-N 0 3 406.448 4.470 20 0 HIADHN COCCn1cc2c(n1)[C@@H](N[C@@H](C)Cc1ccc(F)cc1Br)CCC2 ZINC000563613965 945226680 /nfs/dbraw/zinc/22/66/80/945226680.db2.gz PLGSIQMDBYACDC-UGSOOPFHSA-N 0 3 410.331 4.029 20 0 HIADHN Cc1c([C@@H](C)N[C@@H]2CCOC3(CCSCC3)C2)nnn1-c1cccc(Cl)c1 ZINC000540160350 939096131 /nfs/dbraw/zinc/09/61/31/939096131.db2.gz ULCHQOLEKWYUPE-RHSMWYFYSA-N 0 3 406.983 4.325 20 0 HIADHN C[C@H]1C[C@@H](NC[C@H](O)COc2ccccc2Br)c2ccsc2S1 ZINC000540165923 939098935 /nfs/dbraw/zinc/09/89/35/939098935.db2.gz YYGCKKZRPLKHKW-SLEUVZQESA-N 0 3 414.390 4.466 20 0 HIADHN CC[C@@H](N[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O)c1cccc(Br)c1 ZINC000540180792 939107727 /nfs/dbraw/zinc/10/77/27/939107727.db2.gz BSZGRHHAKAJTFE-WOJBJXKFSA-N 0 3 417.347 4.300 20 0 HIADHN C[C@H](N[C@@H]1CC(=O)N(c2ccccc2Cl)C1)c1ccc(NC(=O)NC2CC2)cc1 ZINC000540180450 939107809 /nfs/dbraw/zinc/10/78/09/939107809.db2.gz DTTVTTHGFQSCNJ-KBXCAEBGSA-N 0 3 412.921 4.080 20 0 HIADHN C[C@H](NCc1ccc(S(=O)(=O)N2CCCCC2)cc1)c1cc2c(s1)CCC2 ZINC000540193003 939118396 /nfs/dbraw/zinc/11/83/96/939118396.db2.gz YLUXQDQJCUCTRM-INIZCTEOSA-N 0 3 404.601 4.262 20 0 HIADHN Cc1ccc2nc(CN3CCC(c4ccc(C(F)(F)F)cc4)CC3)cc(=O)n2c1 ZINC000540199717 939123913 /nfs/dbraw/zinc/12/39/13/939123913.db2.gz SEVWRKKLDMZKJE-UHFFFAOYSA-N 0 3 401.432 4.401 20 0 HIADHN C[C@@H](CNC(=O)c1ccc(Sc2ccc(Cl)cc2)cc1)CN1CCN(C)CC1 ZINC000540220126 939135889 /nfs/dbraw/zinc/13/58/89/939135889.db2.gz KDKZOIAAQCJLAM-KRWDZBQOSA-N 0 3 418.006 4.105 20 0 HIADHN CCN1CCCN(C(=O)Nc2cc(F)ccc2Oc2ccc(C)cc2OC)CC1 ZINC000540227982 939148286 /nfs/dbraw/zinc/14/82/86/939148286.db2.gz GSWNVJSZOJKMEW-UHFFFAOYSA-N 0 3 401.482 4.495 20 0 HIADHN COc1ccc([C@H](C)N[C@H](C)C(=O)N(C)Cc2ccc(Br)cc2)cc1 ZINC000540331252 939197584 /nfs/dbraw/zinc/19/75/84/939197584.db2.gz RRYSAQYBSDURQN-LSDHHAIUSA-N 0 3 405.336 4.155 20 0 HIADHN O=C(CCN1CCC[C@H](c2nncn2C2CC2)C1)Nc1c(Cl)cccc1Cl ZINC000540338396 939199383 /nfs/dbraw/zinc/19/93/83/939199383.db2.gz QXQPCTPXAKWOFO-ZDUSSCGKSA-N 0 3 408.333 4.128 20 0 HIADHN CC[C@H](NCCC(=O)Nc1ccccc1C)c1ccccc1OCC(=O)N1CCCC1 ZINC000540354472 939205931 /nfs/dbraw/zinc/20/59/31/939205931.db2.gz MNXJGWGOCKQQMR-NRFANRHFSA-N 0 3 423.557 4.066 20 0 HIADHN Cc1ccccc1[C@H](CC(C)C)NCC(=O)N1CCC(NC(=O)c2ccccc2)CC1 ZINC000540360955 939209101 /nfs/dbraw/zinc/20/91/01/939209101.db2.gz KIEPTDYFHYYJKP-DEOSSOPVSA-N 0 3 421.585 4.093 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(NC(=O)c2ccncc2)cc1)C(=O)N(C)C1CCCCC1 ZINC000540388913 939225591 /nfs/dbraw/zinc/22/55/91/939225591.db2.gz ZQLGINAOGRETBW-ROUUACIJSA-N 0 3 408.546 4.164 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)Nc1ccc(Br)cc1)c1cccc(-n2cccn2)c1 ZINC000540388637 939225640 /nfs/dbraw/zinc/22/56/40/939225640.db2.gz RYIGVUZRNHHLBY-CABCVRRESA-N 0 3 413.319 4.313 20 0 HIADHN Cc1cccc(Cc2cnc(NC(=O)CN[C@H](c3ccccc3)[C@H]3CCOC3)s2)c1 ZINC000540389261 939225927 /nfs/dbraw/zinc/22/59/27/939225927.db2.gz FZLDJZZWPUBGPW-NZQKXSOJSA-N 0 3 421.566 4.348 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)N[C@@H]2CCO[C@H]2c2ccc(Cl)cc2)CC1 ZINC000540391687 939230287 /nfs/dbraw/zinc/23/02/87/939230287.db2.gz IQHQXSKZKVRSBI-RTWAWAEBSA-N 0 3 417.937 4.069 20 0 HIADHN CC(C)C[C@H](NCC(=O)Nc1cccc(C(=O)N(C)C)c1)c1ccc(Cl)cc1 ZINC000540396164 939233012 /nfs/dbraw/zinc/23/30/12/939233012.db2.gz BXZFOOYJAJDWMJ-FQEVSTJZSA-N 0 3 401.938 4.357 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N[C@H]1CCO[C@H]1c1ccc(Cl)cc1 ZINC000540397561 939233932 /nfs/dbraw/zinc/23/39/32/939233932.db2.gz LJYDRCKNWFOXBX-NSHGMRRFSA-N 0 3 419.978 4.368 20 0 HIADHN C[C@@H](NCC(=O)N(Cc1ccccc1)c1ccccc1)c1ccc(-n2ccnn2)cc1 ZINC000540431831 939246265 /nfs/dbraw/zinc/24/62/65/939246265.db2.gz FTRUPLMBEBDOLM-HXUWFJFHSA-N 0 3 411.509 4.151 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(-n2ccnn2)cc1)C(=O)Nc1ccc(Cl)c(Cl)c1 ZINC000540431855 939246335 /nfs/dbraw/zinc/24/63/35/939246335.db2.gz GWIRGWBXGLSQLW-CHWSQXEVSA-N 0 3 404.301 4.252 20 0 HIADHN CCN(C(=O)CN[C@H](C[C@H]1CCOC1)c1ccccc1)c1nc2ccccc2s1 ZINC000540434782 939247600 /nfs/dbraw/zinc/24/76/00/939247600.db2.gz UHUQGXRDNHLKDW-YLJYHZDGSA-N 0 3 409.555 4.407 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(-c2ccncc2)cc1)C(=O)N1CCN(c2ccccc2)CC1 ZINC000540439891 939250596 /nfs/dbraw/zinc/25/05/96/939250596.db2.gz OHLDBODIAPJGPV-LEWJYISDSA-N 0 3 414.553 4.137 20 0 HIADHN CC(C)Oc1ccc(CCNC(=O)CN[C@H](C)c2cccc(N3CCCC3)c2)cc1 ZINC000540480726 939269295 /nfs/dbraw/zinc/26/92/95/939269295.db2.gz QWPNLMABZZXMQE-HXUWFJFHSA-N 0 3 409.574 4.084 20 0 HIADHN C[C@H](N[C@@H](c1ccc(Cl)c(C(F)(F)F)c1)C1CC1)C(=O)NC[C@H]1CCCO1 ZINC000540523264 939287499 /nfs/dbraw/zinc/28/74/99/939287499.db2.gz KJVIILWFJSWYDV-FABXCBLPSA-N 0 3 404.860 4.083 20 0 HIADHN COc1ccc([C@H](NCC(=O)Nc2ccc3[nH]c(C(F)(F)F)nc3c2)C2CC2)cc1 ZINC000540588983 939312513 /nfs/dbraw/zinc/31/25/13/939312513.db2.gz LDVCWCSTVVEYOG-LJQANCHMSA-N 0 3 418.419 4.270 20 0 HIADHN CC[C@@H](NCc1cccc(NS(C)(=O)=O)c1)c1cc(F)cc(Br)c1 ZINC000540594527 939314490 /nfs/dbraw/zinc/31/44/90/939314490.db2.gz LCACHCHDBYVPFJ-QGZVFWFLSA-N 0 3 415.328 4.201 20 0 HIADHN O=C1NC2(CCCCC2)C(=O)N1Cc1ccccc1CNCc1ccc(Cl)cc1 ZINC000540600609 939315980 /nfs/dbraw/zinc/31/59/80/939315980.db2.gz SLRRALCQOGLLTP-UHFFFAOYSA-N 0 3 411.933 4.385 20 0 HIADHN CCN(CC)c1ncc(CN[C@@H](C)[C@@H](OC2CCOCC2)c2ccccc2)s1 ZINC000540622004 939322155 /nfs/dbraw/zinc/32/21/55/939322155.db2.gz NERMMSSVPXTJCF-LAUBAEHRSA-N 0 3 403.592 4.404 20 0 HIADHN CCN(CC)c1ncc(CN[C@@H](C)[C@H](OC2CCOCC2)c2ccccc2)s1 ZINC000540622006 939322327 /nfs/dbraw/zinc/32/23/27/939322327.db2.gz NERMMSSVPXTJCF-UWJYYQICSA-N 0 3 403.592 4.404 20 0 HIADHN CCN1CCN(Cc2ccc(N[C@@H](C)c3cc(OC)c(OC)c(OC)c3)cc2)CC1 ZINC000540698506 939342692 /nfs/dbraw/zinc/34/26/92/939342692.db2.gz OYIFAVIXFWGZRV-SFHVURJKSA-N 0 3 413.562 4.023 20 0 HIADHN CC(C)[C@@H]1C[C@H](N[C@@H](c2cccc(S(C)(=O)=O)c2)c2ccc(F)c(F)c2)CCO1 ZINC000540705197 939344041 /nfs/dbraw/zinc/34/40/41/939344041.db2.gz CQZLFUIPSRKGHV-WTNAPCKOSA-N 0 3 423.525 4.251 20 0 HIADHN Cc1cc(C(=O)NC[C@@H]2CCCN(Cc3cccs3)C2)nn1-c1ccc(F)cc1 ZINC000540784979 939371372 /nfs/dbraw/zinc/37/13/72/939371372.db2.gz RJUJKSPPTSDBOK-KRWDZBQOSA-N 0 3 412.534 4.023 20 0 HIADHN C[C@@H](Nc1cccc(CN2CCSCC2)c1)[C@@H](c1ccccc1)N1CCOCC1 ZINC000540787124 939371874 /nfs/dbraw/zinc/37/18/74/939371874.db2.gz CCZIQYUOYYDSPI-YKSBVNFPSA-N 0 3 411.615 4.109 20 0 HIADHN C[C@H]1CN(Cc2ccccn2)CC[C@H]1Nc1cccc(I)c1 ZINC000540818206 939382897 /nfs/dbraw/zinc/38/28/97/939382897.db2.gz JFRFEYFVPNEDHO-KBXCAEBGSA-N 0 3 407.299 4.009 20 0 HIADHN O=C([C@H]1CCCN1Cc1ccccc1)N1CCC[C@H](c2nnc(C3CCCCC3)[nH]2)C1 ZINC000540850771 939393926 /nfs/dbraw/zinc/39/39/26/939393926.db2.gz OICHVJDGPCYNDC-FCHUYYIVSA-N 0 3 421.589 4.223 20 0 HIADHN Cc1nnc([C@@H]2CCCN([C@H](C)c3nc(-c4cccc(C(F)(F)F)c4)no3)C2)[nH]1 ZINC000540862691 939400597 /nfs/dbraw/zinc/40/05/97/939400597.db2.gz HZNDOMJKWZMVNV-BXUZGUMPSA-N 0 3 406.412 4.123 20 0 HIADHN COC(=O)c1oc([C@H](C)N2CCC[C@H](c3nnc(C4CCCCC4)[nH]3)C2)cc1C ZINC000540865286 939402590 /nfs/dbraw/zinc/40/25/90/939402590.db2.gz MYAOQAOKHADUBI-RDJZCZTQSA-N 0 3 400.523 4.481 20 0 HIADHN COC[C@H](NC1CCN(Cc2ccccc2Br)CC1)c1ccc(C)o1 ZINC000540983995 939424897 /nfs/dbraw/zinc/42/48/97/939424897.db2.gz QYGGGKFSTRZWAH-IBGZPJMESA-N 0 3 407.352 4.292 20 0 HIADHN CC(C)NS(=O)(=O)Cc1ccccc1CN[C@H](c1ccc(F)c(F)c1)C(C)C ZINC000540987264 939425303 /nfs/dbraw/zinc/42/53/03/939425303.db2.gz WEKSTXZZAYJAKS-NRFANRHFSA-N 0 3 410.530 4.280 20 0 HIADHN CCOc1ccc(NC(=O)CN[C@H](C)c2ccc(-n3ccnc3C)cc2)cc1OCC ZINC000541027180 939434908 /nfs/dbraw/zinc/43/49/08/939434908.db2.gz OYYCDBFUVBTKJZ-QGZVFWFLSA-N 0 3 422.529 4.267 20 0 HIADHN CN1CCN(Cc2ccc(CNC(=O)N(c3ccccc3)c3ccccc3)cc2)CC1 ZINC000541107684 939463007 /nfs/dbraw/zinc/46/30/07/939463007.db2.gz UIKNWZUDAVPONM-UHFFFAOYSA-N 0 3 414.553 4.482 20 0 HIADHN Cc1ccnc(OC2CCN(C[C@H](O)CO[C@H](C)c3ccc(Cl)cc3)CC2)c1 ZINC000541117523 939465656 /nfs/dbraw/zinc/46/56/56/939465656.db2.gz DGQIOVLFCIWUJJ-XLIONFOSSA-N 0 3 404.938 4.025 20 0 HIADHN CCN(CC)C(=O)CCC1CCN([C@@H](C)C(=O)N[C@H](C)c2ccc(Cl)cc2)CC1 ZINC000541119046 939466333 /nfs/dbraw/zinc/46/63/33/939466333.db2.gz AYVAZCZASDQQOX-MSOLQXFVSA-N 0 3 422.013 4.266 20 0 HIADHN CC(C)c1ccccc1OC[C@@H](O)CN1CCC[C@@H](n2ccc(C(F)(F)F)n2)C1 ZINC000541127757 939470434 /nfs/dbraw/zinc/47/04/34/939470434.db2.gz OURGMEGMURQWPT-SJORKVTESA-N 0 3 411.468 4.102 20 0 HIADHN C[C@H](CCc1n[nH]c2ccccc21)N[C@@H](CCO)c1ccccc1Br ZINC000541153020 939477894 /nfs/dbraw/zinc/47/78/94/939477894.db2.gz DEUAVJKARMCAOK-KDOFPFPSSA-N 0 3 402.336 4.360 20 0 HIADHN Cc1ccc(C2CCN(C(=O)NCC(C)(C)N3CCc4ccccc4C3)CC2)cn1 ZINC000541186296 939484878 /nfs/dbraw/zinc/48/48/78/939484878.db2.gz VREDEXIXLNQEIF-UHFFFAOYSA-N 0 3 406.574 4.116 20 0 HIADHN CCOC(=O)C1CCN(C(=O)C[C@@H](C)NC(C)(c2ccccc2)c2ccccc2)CC1 ZINC000541206489 939485587 /nfs/dbraw/zinc/48/55/87/939485587.db2.gz AEIYNLOVHCERJC-HXUWFJFHSA-N 0 3 422.569 4.120 20 0 HIADHN Cc1ccc2c(c1C)OC[C@@H]2N[C@H](C)CC(=O)Nc1ccc(NC(=O)C2CC2)cc1 ZINC000541213313 939486005 /nfs/dbraw/zinc/48/60/05/939486005.db2.gz KNFVLSBXNZWCAB-VFNWGFHPSA-N 0 3 407.514 4.092 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(F)cc2)CC1)c1ccc(SC2CC2)cc1 ZINC000541248358 939487581 /nfs/dbraw/zinc/48/75/81/939487581.db2.gz CBBAGXOJWHNIFJ-UHFFFAOYSA-N 0 3 414.546 4.353 20 0 HIADHN CC(C)(C)OCc1cccc(CN[C@@H](Cc2ccc(C(F)(F)F)cc2)C(N)=O)c1 ZINC000541304994 939490324 /nfs/dbraw/zinc/49/03/24/939490324.db2.gz VUJUUEATXZQRLN-IBGZPJMESA-N 0 3 408.464 4.207 20 0 HIADHN CC(C)(C)CCN1CCN(C(=O)[C@@H]2CCn3c(cnc3C3CCCCC3)C2)CC1 ZINC000541397470 939505295 /nfs/dbraw/zinc/50/52/95/939505295.db2.gz ILBVXXUHXPQWOG-HXUWFJFHSA-N 0 3 400.611 4.074 20 0 HIADHN CC1CCN([C@@H](CNC(=O)N(C)CCc2ccccc2O)c2cccs2)CC1 ZINC000541444716 939517447 /nfs/dbraw/zinc/51/74/47/939517447.db2.gz JMBURYDAIDRQNV-IBGZPJMESA-N 0 3 401.576 4.111 20 0 HIADHN Fc1ccc([C@@H](NCC2(N3CCSCC3)CCCCC2)c2cnccn2)cc1 ZINC000541542864 939548382 /nfs/dbraw/zinc/54/83/82/939548382.db2.gz BCCCFKMUYZJKHD-OAQYLSRUSA-N 0 3 400.567 4.046 20 0 HIADHN CCc1ccc([C@@H](CN2CCOCC2)NCc2ccc(OC)c(OC(F)F)c2)cc1 ZINC000541548709 939551471 /nfs/dbraw/zinc/55/14/71/939551471.db2.gz MLRVTKSRSUBXHZ-HXUWFJFHSA-N 0 3 420.500 4.022 20 0 HIADHN CCN1CCN(Cc2ccc(CN[C@H](c3ccccc3)c3ccc(F)cn3)cc2)CC1 ZINC000541552242 939553285 /nfs/dbraw/zinc/55/32/85/939553285.db2.gz YKXMSTCTJJLYFS-AREMUKBSSA-N 0 3 418.560 4.237 20 0 HIADHN Cc1c([C@H](C)NCC[C@H]2CCO[C@H](C)C2)nnn1-c1cccc(Br)c1 ZINC000541558147 939554942 /nfs/dbraw/zinc/55/49/42/939554942.db2.gz MGHRVMJISRXCLP-YCPHGPKFSA-N 0 3 407.356 4.194 20 0 HIADHN Cc1nc(-c2ccccc2)sc1[C@H](C)N[C@@H]1CCCN(Cc2ccccn2)C1=O ZINC000541568509 939557223 /nfs/dbraw/zinc/55/72/23/939557223.db2.gz UGSZWYLQPCUEHY-OXJNMPFZSA-N 0 3 406.555 4.355 20 0 HIADHN CC(C)([C@@H](NCC(=O)Nc1ccc(F)cc1F)c1ccc(F)c(F)c1)N1CCCC1 ZINC000541588915 939561395 /nfs/dbraw/zinc/56/13/95/939561395.db2.gz QSWYYHWXQQJNID-NRFANRHFSA-N 0 3 423.454 4.387 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N[C@H]2CCO[C@H](c3ccc(F)cc3)C2)C1 ZINC000541619780 939572610 /nfs/dbraw/zinc/57/26/10/939572610.db2.gz WVIGHZSNVFMZLF-SZOBAZRNSA-N 0 3 411.521 4.181 20 0 HIADHN COc1ccc(-c2nc(NC(=O)CN[C@@H](C)[C@@H]3COc4ccccc43)sc2C)cc1 ZINC000541697923 939608067 /nfs/dbraw/zinc/60/80/67/939608067.db2.gz QJJPFTWQWVXPTJ-LIRRHRJNSA-N 0 3 423.538 4.220 20 0 HIADHN C[C@@H](NCC(=O)N(Cc1ccc(C(F)(F)F)cc1)C1CC1)[C@@H]1COc2ccccc21 ZINC000541699232 939608204 /nfs/dbraw/zinc/60/82/04/939608204.db2.gz BTZZGUZDZAJIIB-QRWLVFNGSA-N 0 3 418.459 4.351 20 0 HIADHN C[C@@H]1N(CC(=O)Nc2ccc(N3CCc4ccccc43)cc2)CCC12CCOCC2 ZINC000541717927 939613246 /nfs/dbraw/zinc/61/32/46/939613246.db2.gz JFZTYOTUJCENQB-IBGZPJMESA-N 0 3 405.542 4.210 20 0 HIADHN CCCCSc1ccc(Cl)cc1C(=O)N1CC[C@H](N2CCN(C)CC2)[C@@H](C)C1 ZINC000541720489 939614252 /nfs/dbraw/zinc/61/42/52/939614252.db2.gz LSDUMGVLSPONJS-PXNSSMCTSA-N 0 3 424.054 4.330 20 0 HIADHN COc1ccc(C[C@@H](NCc2ccc3c(c2)C(=O)NCC3)c2ccc(OC)cc2)cc1 ZINC000541739304 939618238 /nfs/dbraw/zinc/61/82/38/939618238.db2.gz WYUSCYXGNOEMJY-RUZDIDTESA-N 0 3 416.521 4.063 20 0 HIADHN CCC[C@@H](NCc1ccccc1CS(=O)(=O)N1CCC(C)CC1)c1cccnc1 ZINC000541767038 939625268 /nfs/dbraw/zinc/62/52/68/939625268.db2.gz QWMMRCMGZCRJKG-HSZRJFAPSA-N 0 3 415.603 4.274 20 0 HIADHN C[C@@H](CN[C@@H](c1ccc(F)cc1)c1cccc(S(C)(=O)=O)c1)c1nccs1 ZINC000541767374 939625294 /nfs/dbraw/zinc/62/52/94/939625294.db2.gz YSLHIGPSCVHGKS-LIRRHRJNSA-N 0 3 404.532 4.168 20 0 HIADHN Cc1ccccc1[C@H]1C[C@H](NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)C1 ZINC000541793440 939632851 /nfs/dbraw/zinc/63/28/51/939632851.db2.gz AHYVMNZIJRKLMU-VHQLZKCGSA-N 0 3 409.496 4.346 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)c2cnn(-c3ccc(C)cc3)c2C)cc1 ZINC000541856800 939647455 /nfs/dbraw/zinc/64/74/55/939647455.db2.gz JMIBACPCVAQRTF-DEOSSOPVSA-N 0 3 418.541 4.065 20 0 HIADHN Cc1nn(-c2ccccc2)cc1NC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000541906634 939651032 /nfs/dbraw/zinc/65/10/32/939651032.db2.gz ZVCUWBLRJNKURT-QFIPXVFZSA-N 0 3 403.530 4.309 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](N[C@@H](CCO)c2ccccc2Br)C1 ZINC000541916793 939653235 /nfs/dbraw/zinc/65/32/35/939653235.db2.gz OMWYGPAUEZXAHM-MMOPVJDHSA-N 0 3 403.364 4.298 20 0 HIADHN CC[C@@H]1C[C@@H](CC(=O)Nc2c(C)cnn2[C@@H]2CCN(Cc3ccccc3)C2)CCO1 ZINC000541964662 939664223 /nfs/dbraw/zinc/66/42/23/939664223.db2.gz OGWPMDQQVITAIK-BHDDXSALSA-N 0 3 410.562 4.172 20 0 HIADHN Cc1ccc([C@H](OC[C@@H](O)CN[C@@H](CO)c2ccccc2C)c2ccccc2)cc1 ZINC000541983607 939669951 /nfs/dbraw/zinc/66/99/51/939669951.db2.gz KYRZLADFVHVMPT-AYRHNUGRSA-N 0 3 405.538 4.094 20 0 HIADHN CC(C)(C)N1CC[C@@H](NC(=O)c2[nH]nc3c2CCC3)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000542093663 939709253 /nfs/dbraw/zinc/70/92/53/939709253.db2.gz VGAAZYFNKWEAKU-MJGOQNOKSA-N 0 3 404.917 4.035 20 0 HIADHN COC(=O)[C@H](N[C@H](CN1CCCC1)c1ccccc1)c1ccccc1C(F)(F)F ZINC000542100944 939713502 /nfs/dbraw/zinc/71/35/02/939713502.db2.gz YQTFHWOVEINXII-WOJBJXKFSA-N 0 3 406.448 4.346 20 0 HIADHN C[C@@H](N[C@H]1CCCN(Cc2nccn2C)C1=O)c1ccc(SC2CCCC2)cc1 ZINC000542159832 939737441 /nfs/dbraw/zinc/73/74/41/939737441.db2.gz DWZHYROLPHKJAA-UTKZUKDTSA-N 0 3 412.603 4.297 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)N(CC=C(C)C)Cc2ccc(Cl)cc2)CC1 ZINC000542179891 939746791 /nfs/dbraw/zinc/74/67/91/939746791.db2.gz UOJASMGHXKMGEZ-HXUWFJFHSA-N 0 3 421.029 4.091 20 0 HIADHN COc1ccc(-c2nc(C)c([C@H](C)N[C@@H](Cc3ccc(F)cc3)C(N)=O)s2)cc1 ZINC000542232497 939767019 /nfs/dbraw/zinc/76/70/19/939767019.db2.gz LFNWECRXHVFKTC-DJJJIMSYSA-N 0 3 413.518 4.013 20 0 HIADHN COc1ccc(Oc2ccc(CN[C@@H]3CCCN(CC(F)(F)F)C3=O)cc2)cc1 ZINC000542310961 939795224 /nfs/dbraw/zinc/79/52/24/939795224.db2.gz YIPVHVMTHKQQKH-LJQANCHMSA-N 0 3 408.420 4.130 20 0 HIADHN O=C([C@@H]1CCn2c(cnc2C2CCCCC2)C1)N1CCCN(Cc2ccccc2)CC1 ZINC000542336199 939802662 /nfs/dbraw/zinc/80/26/62/939802662.db2.gz PFAFMPHYBUDUQG-HSZRJFAPSA-N 0 3 420.601 4.228 20 0 HIADHN Cc1cn(C2CCCCC2)nc1NC(=O)N1CCC(CN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000542370314 939809006 /nfs/dbraw/zinc/80/90/06/939809006.db2.gz PWHYTPXRRIEFRR-OALUTQOASA-N 0 3 417.598 4.050 20 0 HIADHN O=C(NCC[C@@H]1CCOC1)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000542449182 939824964 /nfs/dbraw/zinc/82/49/64/939824964.db2.gz FJPCZTOWKLTOJW-MRXNPFEDSA-N 0 3 414.377 4.027 20 0 HIADHN COc1cc(OC)cc(N2CC[C@@H](CN[C@H](c3ccc(F)cc3)c3ccccn3)C2)c1 ZINC000542474978 939829356 /nfs/dbraw/zinc/82/93/56/939829356.db2.gz PGKGMEOHDGIAFQ-AVRWGWEMSA-N 0 3 421.516 4.443 20 0 HIADHN Cc1ccccc1[C@H](CN1CCOCC1)NCc1cccc(COCc2ccco2)c1 ZINC000542479364 939830181 /nfs/dbraw/zinc/83/01/81/939830181.db2.gz UOXUIKDTERHVKL-SANMLTNESA-N 0 3 420.553 4.468 20 0 HIADHN C[C@H](CN[C@H](c1ccc(F)cc1)c1cccnc1)N1CCN(c2ccccc2)CC1 ZINC000542480700 939830878 /nfs/dbraw/zinc/83/08/78/939830878.db2.gz JWJMFIAFEBIPIE-CJFMBICVSA-N 0 3 404.533 4.110 20 0 HIADHN COC(=O)COc1ccccc1[C@H](C)N[C@@H]1CCO[C@@H]1c1ccc(Cl)c(F)c1 ZINC000542493475 939832673 /nfs/dbraw/zinc/83/26/73/939832673.db2.gz CVOBRCXBQBLFOY-WMHILYHISA-N 0 3 407.869 4.212 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(N[C@H](C[NH+]3CCCC3)c3ccc(OC)cc3)nc2)n1 ZINC000542505626 939833940 /nfs/dbraw/zinc/83/39/40/939833940.db2.gz JYGFUPYMWUQLLP-OAQYLSRUSA-N 0 3 419.529 4.064 20 0 HIADHN COCc1ccc(CNC(=O)CN[C@H](Cc2ccccc2)c2sccc2C)cc1 ZINC000542521314 939836823 /nfs/dbraw/zinc/83/68/23/939836823.db2.gz CVVPPRUPPJXGIB-JOCHJYFZSA-N 0 3 408.567 4.393 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)N[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000542547136 939841798 /nfs/dbraw/zinc/84/17/98/939841798.db2.gz WYFXNACKNIIGNL-XPWALMASSA-N 0 3 411.521 4.010 20 0 HIADHN CC[C@@H](NCCCS(=O)(=O)c1ccc(NC(C)=O)cc1)c1ccc(Cl)s1 ZINC000542556513 939843054 /nfs/dbraw/zinc/84/30/54/939843054.db2.gz RNEALUJFAOTBGJ-MRXNPFEDSA-N 0 3 414.980 4.265 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3C[C@H](C)C[C@@H]3c3cccnc3)c(C)c2)CC1 ZINC000542601399 939847561 /nfs/dbraw/zinc/84/75/61/939847561.db2.gz UFCMLYBRZMIEGR-WZONZLPQSA-N 0 3 407.562 4.147 20 0 HIADHN CSc1ccc(CN(C)C(=O)CN(C)[C@@H]2CCO[C@H](c3ccc(F)cc3)C2)cc1 ZINC000542626561 939850097 /nfs/dbraw/zinc/85/00/97/939850097.db2.gz IVXJXUAQJNEIQN-IRLDBZIGSA-N 0 3 416.562 4.358 20 0 HIADHN COc1ccccc1O[C@H](C)CN[C@@H]1CCCC[C@H]1S(=O)(=O)c1ccc(C)cc1 ZINC000542664022 939852467 /nfs/dbraw/zinc/85/24/67/939852467.db2.gz CAGHSSZGIRXJCY-KKLQWCBXSA-N 0 3 417.571 4.146 20 0 HIADHN C[C@H]1C[C@H](c2cccnc2)N(C(=O)Nc2ccc(CCN3CCSCC3)cc2)C1 ZINC000542669489 939852894 /nfs/dbraw/zinc/85/28/94/939852894.db2.gz JIMBOAKBAQCQEW-PGRDOPGGSA-N 0 3 410.587 4.288 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@H]2NC[C@@H](c2cccs2)N(C)C)cc1 ZINC000542671911 939853150 /nfs/dbraw/zinc/85/31/50/939853150.db2.gz VIEDUWASICFOML-SVFBPWRDSA-N 0 3 406.617 4.034 20 0 HIADHN Cc1ccc(S(=O)(=O)C[C@@H](C)NCCc2csc(-c3ccccc3)n2)cc1 ZINC000542675044 939853307 /nfs/dbraw/zinc/85/33/07/939853307.db2.gz YQFUZIRNQSMDEK-QGZVFWFLSA-N 0 3 400.569 4.113 20 0 HIADHN O=C(Nc1cccc(C(F)F)c1Cl)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1CO ZINC000542721592 939856710 /nfs/dbraw/zinc/85/67/10/939856710.db2.gz IAQGPTSZURQVLZ-WBVHZDCISA-N 0 3 423.891 4.282 20 0 HIADHN CC(C)c1nn(-c2ccc(Br)cc2)cc1CN1CCC[C@@H]([C@H](C)O)C1 ZINC000542820559 939861370 /nfs/dbraw/zinc/86/13/70/939861370.db2.gz RZVKMAYLRIBEOT-JKSUJKDBSA-N 0 3 406.368 4.351 20 0 HIADHN FC(F)(F)c1cccc(-c2ccc(CN3CCCN(c4cccnn4)CC3)o2)c1 ZINC000542855151 939863555 /nfs/dbraw/zinc/86/35/55/939863555.db2.gz YUJKQNCCWSIISP-UHFFFAOYSA-N 0 3 402.420 4.468 20 0 HIADHN COc1ccccc1[C@@H](C)N(C)C(=O)CN[C@@H](C)c1ccc(-n2ccnc2C)cc1 ZINC000542883746 939865398 /nfs/dbraw/zinc/86/53/98/939865398.db2.gz WQJHTXLCLCHNSZ-ZWKOTPCHSA-N 0 3 406.530 4.060 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)Nc2ccc(OC[C@@H]3CCCO3)cc2)CCN1Cc1ccccc1 ZINC000563744666 945278723 /nfs/dbraw/zinc/27/87/23/945278723.db2.gz OTCHQNJUCMHEFR-LEOXJPRUSA-N 0 3 409.530 4.029 20 0 HIADHN Cc1cc(C2CCN(Cc3ccnc(-c4ccc(Br)cc4)n3)CC2)n[nH]1 ZINC000542972054 939888913 /nfs/dbraw/zinc/88/89/13/939888913.db2.gz JIGOKPHEFPFWQA-UHFFFAOYSA-N 0 3 412.335 4.317 20 0 HIADHN Cc1cc(C2CCN(Cc3ccnc(-c4ccc(Br)cc4)n3)CC2)[nH]n1 ZINC000542972054 939888916 /nfs/dbraw/zinc/88/89/16/939888916.db2.gz JIGOKPHEFPFWQA-UHFFFAOYSA-N 0 3 412.335 4.317 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N2CCC(c3ccc(C)nc3)CC2)N2CCCC2)cc1 ZINC000543040183 939901900 /nfs/dbraw/zinc/90/19/00/939901900.db2.gz GWZICMAECRVQRG-DEOSSOPVSA-N 0 3 406.574 4.425 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc(CN[C@@H](C)Cc2ccccc2SC)s1 ZINC000543075431 939927280 /nfs/dbraw/zinc/92/72/80/939927280.db2.gz XTASPIGDQWVKFO-HNNXBMFYSA-N 0 3 412.646 4.221 20 0 HIADHN COc1cc(CNCc2cc(-n3ccnc3)cs2)cc(Br)c1OC ZINC000543175960 939986243 /nfs/dbraw/zinc/98/62/43/939986243.db2.gz MOAGCGVHWRFEGY-UHFFFAOYSA-N 0 3 408.321 4.003 20 0 HIADHN COc1cc(CN[C@@H](C)C[S@](C)=O)ccc1OCc1ccc(Cl)cc1Cl ZINC000543226929 940001129 /nfs/dbraw/zinc/00/11/29/940001129.db2.gz QUSMFHGDLXINEO-NRRJATNASA-N 0 3 416.370 4.438 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)Nc2ccc(-n3ncc4ccccc43)cc2)CC1 ZINC000543312524 940026059 /nfs/dbraw/zinc/02/60/59/940026059.db2.gz GEAVMCLRLNAIAX-UHFFFAOYSA-N 0 3 421.545 4.036 20 0 HIADHN CC(C)c1nccn1CCC(=O)N[C@@H](c1ccc(F)c(F)c1)C(C)(C)N1CCCC1 ZINC000543402621 940053051 /nfs/dbraw/zinc/05/30/51/940053051.db2.gz DKGNQIBETLLFSM-NRFANRHFSA-N 0 3 418.532 4.407 20 0 HIADHN Cc1nn(Cc2ccccc2Cl)c(C)c1CN1CCC(OC[C@@H]2CCOC2)CC1 ZINC000543414738 940057777 /nfs/dbraw/zinc/05/77/77/940057777.db2.gz LZBFBBCGNBJWSI-LJQANCHMSA-N 0 3 417.981 4.219 20 0 HIADHN CC[C@H](N[C@@H]1CCCN(Cc2ccccn2)C1=O)c1ccc2cc(OC)ccc2c1 ZINC000543426994 940060782 /nfs/dbraw/zinc/06/07/82/940060782.db2.gz PTQOAYWEZXAODF-BJKOFHAPSA-N 0 3 403.526 4.475 20 0 HIADHN COC[C@H](N[C@@H](C)C(=O)N1N=C(c2ccc(Cl)cc2)C[C@H]1c1ccco1)C1CC1 ZINC000543477710 940077582 /nfs/dbraw/zinc/07/75/82/940077582.db2.gz FAFRZKHVCVYTQV-GKCIPKSASA-N 0 3 415.921 4.014 20 0 HIADHN COc1ccc(Br)cc1-c1nc(CN[C@H](C)[C@@H]2CCCOC2)cs1 ZINC000543507058 940089018 /nfs/dbraw/zinc/08/90/18/940089018.db2.gz NLGATRBQCLZGKS-CHWSQXEVSA-N 0 3 411.365 4.486 20 0 HIADHN C[C@H](NCC(=O)Nc1ccc(Br)cc1F)[C@@H]1Oc2ccccc2[C@H]1C ZINC000543545266 940102291 /nfs/dbraw/zinc/10/22/91/940102291.db2.gz SAKPFONVWCEGRH-UYSIFFEZSA-N 0 3 407.283 4.070 20 0 HIADHN Cc1cc(NC(=O)[C@H](C)N[C@H](C)[C@@H]2COc3ccccc32)ccc1Br ZINC000543552356 940106449 /nfs/dbraw/zinc/10/64/49/940106449.db2.gz UUNBEFHOAQQZQK-KEYYUXOJSA-N 0 3 403.320 4.239 20 0 HIADHN CN(CC(=O)NC12CC3CC(CC(C3)C1)C2)[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000543560585 940108244 /nfs/dbraw/zinc/10/82/44/940108244.db2.gz IYMKWKDSJXSDDF-UMSMHOFCSA-N 0 3 400.538 4.063 20 0 HIADHN CN(CC(=O)NC12CC3CC(CC(C3)C1)C2)[C@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000543560584 940108715 /nfs/dbraw/zinc/10/87/15/940108715.db2.gz IYMKWKDSJXSDDF-OSIYRUHHSA-N 0 3 400.538 4.063 20 0 HIADHN Brc1cccc(N2CC[C@H](CN[C@H](c3ccccc3)c3cncnc3)C2)c1 ZINC000543601132 940127251 /nfs/dbraw/zinc/12/72/51/940127251.db2.gz VWFYXRWNHTYVME-VGOFRKELSA-N 0 3 423.358 4.445 20 0 HIADHN COc1ccc([C@H](CN[C@H](c2ccccc2)c2cncnc2)N2CCCCC2)cc1 ZINC000543604743 940128733 /nfs/dbraw/zinc/12/87/33/940128733.db2.gz CQCYUSSSKHXPPS-LOSJGSFVSA-N 0 3 402.542 4.391 20 0 HIADHN CCCn1nc(C)c(CNCCC(=O)Nc2ccc(Br)cc2C)c1C ZINC000543624146 940138857 /nfs/dbraw/zinc/13/88/57/940138857.db2.gz RELAIJOWJRLPDF-UHFFFAOYSA-N 0 3 407.356 4.099 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)Nc3ccc(Br)c(Cl)c3Cl)[C@H]2C1 ZINC000543647851 940149500 /nfs/dbraw/zinc/14/95/00/940149500.db2.gz MTCKZAIWVQSLSX-CABZTGNLSA-N 0 3 407.139 4.314 20 0 HIADHN CSC[C@@H](N[C@H](C)Cn1ncc2ccccc2c1=O)c1ccc(C(F)(F)F)cc1 ZINC000543774786 940181732 /nfs/dbraw/zinc/18/17/32/940181732.db2.gz DPJRUSXMDKESCL-AUUYWEPGSA-N 0 3 421.488 4.498 20 0 HIADHN C[C@H](NC[C@H](O)COc1ccc(-c2ccccc2)cc1)c1ccc([S@](C)=O)cc1 ZINC000543898400 940232286 /nfs/dbraw/zinc/23/22/86/940232286.db2.gz ZPCOMGKLUHGZSB-RIRMVKJXSA-N 0 3 409.551 4.182 20 0 HIADHN Cc1cc(C2CCN([C@H]3CCCN(Cc4cccc(C(F)(F)F)c4)C3=O)CC2)n[nH]1 ZINC000543902208 940233512 /nfs/dbraw/zinc/23/35/12/940233512.db2.gz SPHOVBIZDRMPNH-FQEVSTJZSA-N 0 3 420.479 4.108 20 0 HIADHN Cc1cc(C2CCN([C@H]3CCCN(Cc4cccc(C(F)(F)F)c4)C3=O)CC2)[nH]n1 ZINC000543902208 940233515 /nfs/dbraw/zinc/23/35/15/940233515.db2.gz SPHOVBIZDRMPNH-FQEVSTJZSA-N 0 3 420.479 4.108 20 0 HIADHN O=C(CN[C@@H](c1ccc(Cl)cc1)C1CC1)N1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000543989711 940284859 /nfs/dbraw/zinc/28/48/59/940284859.db2.gz XAXOXWMTGNRIKO-IFMALSPDSA-N 0 3 402.897 4.120 20 0 HIADHN C[C@@H](NC(=O)[C@@H](C)N1CCC(CCCn2ccnc2)CC1)c1ccc(Cl)cc1 ZINC000543988689 940285217 /nfs/dbraw/zinc/28/52/17/940285217.db2.gz WTSFDLXSCLOQEH-QZTJIDSGSA-N 0 3 402.970 4.295 20 0 HIADHN C[C@H](C1CC1)N(Cc1ccccc1)C(=O)CN1CCC(CCCn2ccnc2)CC1 ZINC000543990135 940286692 /nfs/dbraw/zinc/28/66/92/940286692.db2.gz QNGHWQYCMQEKQW-OAQYLSRUSA-N 0 3 408.590 4.203 20 0 HIADHN Cc1cccc(NC2CCN(C[C@H](O)COc3ccccc3C(F)(F)F)CC2)c1 ZINC000544070720 940317590 /nfs/dbraw/zinc/31/75/90/940317590.db2.gz KLNJSJSOULTUFW-IBGZPJMESA-N 0 3 408.464 4.330 20 0 HIADHN C[C@]1(NCC(=O)Nc2cc(C3CCCC3)nn2-c2ccccc2)CCO[C@@H]1C1CC1 ZINC000544175573 940344436 /nfs/dbraw/zinc/34/44/36/940344436.db2.gz NAPZNMYWDHIYRY-RPWUZVMVSA-N 0 3 408.546 4.016 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(C(C)(C)c4ccc(Cl)cc4)n3)cn2)CC1 ZINC000544345472 940395767 /nfs/dbraw/zinc/39/57/67/940395767.db2.gz BBAOPVZNYYPGAE-UHFFFAOYSA-N 0 3 411.937 4.253 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(-c4ccc(F)c(C(F)(F)F)c4)n3)cn2)CC1 ZINC000544351357 940397621 /nfs/dbraw/zinc/39/76/21/940397621.db2.gz WCELNUJQEMYWLA-UHFFFAOYSA-N 0 3 421.398 4.098 20 0 HIADHN Cc1cccc([C@@H](CN[C@@H](c2ccc(F)cc2)c2cccnc2)N2CCOCC2)c1 ZINC000544359248 940400548 /nfs/dbraw/zinc/40/05/48/940400548.db2.gz FUFNEFMALDQXQT-RPBOFIJWSA-N 0 3 405.517 4.282 20 0 HIADHN NC(=O)C1CCN(C[C@H](NCc2ccc(F)c(Cl)c2)c2ccc(Cl)cc2)CC1 ZINC000544359500 940400998 /nfs/dbraw/zinc/40/09/98/940400998.db2.gz LGDKTGXMNPRPHI-FQEVSTJZSA-N 0 3 424.347 4.161 20 0 HIADHN Cc1cc(C)c(CN[C@@H](CN2CCC(C(N)=O)CC2)c2ccc(Cl)cc2)c(C)c1 ZINC000544363706 940402257 /nfs/dbraw/zinc/40/22/57/940402257.db2.gz VPDHYQLVJDOJFW-QHCPKHFHSA-N 0 3 413.993 4.293 20 0 HIADHN Cc1cc([C@@H](NCCCN2C(=O)COc3ccccc32)c2cccnc2)ccc1F ZINC000544382370 940407318 /nfs/dbraw/zinc/40/73/18/940407318.db2.gz QOFNLPZAPDWZDZ-XMMPIXPASA-N 0 3 405.473 4.024 20 0 HIADHN CC[C@@H](Oc1cccc(C)c1)c1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1 ZINC000544388346 940408583 /nfs/dbraw/zinc/40/85/83/940408583.db2.gz PKMYTLTXESLAKX-HXUWFJFHSA-N 0 3 407.518 4.112 20 0 HIADHN Cc1ccc(C(C)C)c(OCc2nc(-c3ccc(N4CCCN(C)CC4)nc3)no2)c1 ZINC000544397151 940411490 /nfs/dbraw/zinc/41/14/90/940411490.db2.gz XHIKCFRJUSIEDF-UHFFFAOYSA-N 0 3 421.545 4.284 20 0 HIADHN COc1cccc(CN(C)C(=O)CN[C@@H](Cc2ccccc2)c2cccs2)c1OC ZINC000544414738 940417426 /nfs/dbraw/zinc/41/74/26/940417426.db2.gz DENSLEYSASXNFC-FQEVSTJZSA-N 0 3 424.566 4.297 20 0 HIADHN COCc1ccccc1CNC(=O)CN[C@@H](Cc1ccccc1)c1sccc1C ZINC000544416391 940417813 /nfs/dbraw/zinc/41/78/13/940417813.db2.gz YDEXHNFFMKVXSF-QFIPXVFZSA-N 0 3 408.567 4.393 20 0 HIADHN CC[C@@H](C)c1ccccc1OCc1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1 ZINC000544425555 940423934 /nfs/dbraw/zinc/42/39/34/940423934.db2.gz RXPVKXDAZLEQBZ-GOSISDBHSA-N 0 3 421.545 4.366 20 0 HIADHN CC(C)[C@H](NC[C@@H](O)Cn1c2ccccc2c2ccccc21)c1nnc2ccccn21 ZINC000544435197 940429283 /nfs/dbraw/zinc/42/92/83/940429283.db2.gz LTIXYKWGOFFQOO-KOSHJBKYSA-N 0 3 413.525 4.185 20 0 HIADHN Cc1sc([C@H](C)NCCCN2C(=O)NC(C)(C)C2=O)nc1-c1ccc(Cl)cc1 ZINC000544471434 940446190 /nfs/dbraw/zinc/44/61/90/940446190.db2.gz QTQVZCKCTNLYQF-LBPRGKRZSA-N 0 3 420.966 4.143 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)N(C)Cc1nc2ccccc2s1)[C@H]1Oc2ccccc2[C@@H]1C ZINC000544508535 940461003 /nfs/dbraw/zinc/46/10/03/940461003.db2.gz BRGYALHKIBNZKF-CPBBTPEFSA-N 0 3 409.555 4.186 20 0 HIADHN Cc1nccn1CCCCN[C@H](C)c1nc(-c2ccc(Br)cc2)no1 ZINC000544511448 940462935 /nfs/dbraw/zinc/46/29/35/940462935.db2.gz FPJFHRWUUHSQDA-CYBMUJFWSA-N 0 3 404.312 4.135 20 0 HIADHN Cc1ccc(SCCNC(=O)CN(C)[C@@H]2CCO[C@@H](c3ccc(F)cc3)C2)cc1 ZINC000544525610 940471424 /nfs/dbraw/zinc/47/14/24/940471424.db2.gz KMSPAIBXJPQXKV-IFMALSPDSA-N 0 3 416.562 4.195 20 0 HIADHN CN(CC(=O)N1CCc2[nH]c3ccccc3c2C1)[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000544529607 940472987 /nfs/dbraw/zinc/47/29/87/940472987.db2.gz OCHOQPVVULFCNJ-NTKDMRAZSA-N 0 3 421.516 4.044 20 0 HIADHN C[C@H](NCC(=O)N(C)Cc1cnn(C)c1)c1ccc(-c2ccc(Cl)cc2)s1 ZINC000544531606 940473386 /nfs/dbraw/zinc/47/33/86/940473386.db2.gz WUZXOBZOJLHFAL-AWEZNQCLSA-N 0 3 402.951 4.111 20 0 HIADHN COc1cc(CN[C@@H]2CCO[C@@H](c3ccc(F)cc3)C2)c(Br)cc1O ZINC000544618363 940491464 /nfs/dbraw/zinc/49/14/64/940491464.db2.gz NJUSHOWCXUNXLC-CRAIPNDOSA-N 0 3 410.283 4.312 20 0 HIADHN COC(=O)[C@@H](C)Cc1ccc(NC(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)cc1 ZINC000544797965 940515076 /nfs/dbraw/zinc/51/50/76/940515076.db2.gz GXBXOAJEWCYWSE-PMACEKPBSA-N 0 3 423.557 4.167 20 0 HIADHN CO[C@H](c1ccccc1Cl)[C@@H](C)N[C@H](C)c1cccc(S(=O)(=O)N(C)C)c1 ZINC000544828132 940517921 /nfs/dbraw/zinc/51/79/21/940517921.db2.gz OIZFYMGXPYAJCA-SXGZJXTBSA-N 0 3 410.967 4.017 20 0 HIADHN CCN(C(=O)c1cncc(-c2ccc(OC)cc2)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000544850483 940519206 /nfs/dbraw/zinc/51/92/06/940519206.db2.gz FCNFUDRUOQSHSY-XMMPIXPASA-N 0 3 415.537 4.494 20 0 HIADHN CCN(C(=O)c1ccc(NC(=O)[C@@H]2C[C@H]2C)cc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000544871737 940520696 /nfs/dbraw/zinc/52/06/96/940520696.db2.gz LWNVWQICWVSSQS-SXSPYAJSSA-N 0 3 405.542 4.018 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)[C@@H]1CCO[C@H]1c1ccc(Cl)c(F)c1 ZINC000545258875 940559138 /nfs/dbraw/zinc/55/91/38/940559138.db2.gz SFKTWHASMJIXSR-KNQAVFIVSA-N 0 3 416.924 4.121 20 0 HIADHN O=C(NC1(c2ccc(Cl)c(Cl)c2)CC1)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000545298674 940560703 /nfs/dbraw/zinc/56/07/03/940560703.db2.gz UZXSEQOWTFWJEL-INIZCTEOSA-N 0 3 404.341 4.406 20 0 HIADHN C[C@@H](CCN1C(=O)c2ccccc2C1=O)N[C@@H](CC(F)(F)F)c1ccc(F)cc1 ZINC000545302463 940560781 /nfs/dbraw/zinc/56/07/81/940560781.db2.gz PMFGWNGCIRAZIQ-UGSOOPFHSA-N 0 3 408.395 4.484 20 0 HIADHN Cc1nc(C(=O)Nc2ccc(CCN3CCSCC3)cc2)c(-c2ccccc2)o1 ZINC000545352216 940564010 /nfs/dbraw/zinc/56/40/10/940564010.db2.gz SPJRQOCWHHKVMN-UHFFFAOYSA-N 0 3 407.539 4.494 20 0 HIADHN CCc1cc(C(=O)NC[C@H](c2ccc(C(F)(F)F)cc2)N(CC)CC)c(C)nn1 ZINC000545395194 940568094 /nfs/dbraw/zinc/56/80/94/940568094.db2.gz PZXAHRSDDAFCQK-LJQANCHMSA-N 0 3 408.468 4.179 20 0 HIADHN COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)cc1 ZINC000545430225 940569460 /nfs/dbraw/zinc/56/94/60/940569460.db2.gz ZRANWUFTSULFMR-XLIONFOSSA-N 0 3 412.505 4.028 20 0 HIADHN COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)cc1 ZINC000545430224 940569502 /nfs/dbraw/zinc/56/95/02/940569502.db2.gz ZRANWUFTSULFMR-PXNSSMCTSA-N 0 3 412.505 4.028 20 0 HIADHN COc1cc(CN[C@@H](Cc2cccnc2)c2ccc(Cl)cc2)ccc1OCCO ZINC000545458568 940570775 /nfs/dbraw/zinc/57/07/75/940570775.db2.gz YYLWXIAUVMAMFC-NRFANRHFSA-N 0 3 412.917 4.188 20 0 HIADHN COc1cc(CN[C@H](Cc2cccnc2)c2ccc(Cl)cc2)ccc1OCCO ZINC000545458569 940570837 /nfs/dbraw/zinc/57/08/37/940570837.db2.gz YYLWXIAUVMAMFC-OAQYLSRUSA-N 0 3 412.917 4.188 20 0 HIADHN C[C@@H](N[C@H](Cc1ccc(Cl)cc1)C(N)=O)c1ccc(OCC(F)(F)F)cc1 ZINC000545473632 940571270 /nfs/dbraw/zinc/57/12/70/940571270.db2.gz OELFAPDCWHYYPE-SJKOYZFVSA-N 0 3 400.828 4.028 20 0 HIADHN CCN(C(=O)[C@H](C)Oc1ccc(CCC(C)=O)cc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000545474940 940571289 /nfs/dbraw/zinc/57/12/89/940571289.db2.gz IUUSPBQCMHPJAQ-URXFXBBRSA-N 0 3 422.569 4.099 20 0 HIADHN CCCc1c(NC(=O)N2CCN(CCC(C)(C)C)CC2)cnn1-c1cc(C)ccn1 ZINC000545512584 940572595 /nfs/dbraw/zinc/57/25/95/940572595.db2.gz CHGOAJCKEBIOPU-UHFFFAOYSA-N 0 3 412.582 4.114 20 0 HIADHN CCc1ccc([C@@H](C)Cc2nc(-c3ccc(N4CCCN(C)CC4)nc3)no2)cc1 ZINC000545653977 940579025 /nfs/dbraw/zinc/57/90/25/940579025.db2.gz NACKIPSSZMTTRE-SFHVURJKSA-N 0 3 405.546 4.182 20 0 HIADHN Fc1cccc(CN2CCC[C@H](c3nc(-c4cccnc4N4CCCC4)no3)C2)c1 ZINC000545668278 940579734 /nfs/dbraw/zinc/57/97/34/940579734.db2.gz SSWIWDFJMYVEIF-SFHVURJKSA-N 0 3 407.493 4.251 20 0 HIADHN CN(Cc1ccccc1)Cc1cccc(-c2nc([C@H]3CC(=O)N(CC4CC4)C3)no2)c1 ZINC000545797419 940599909 /nfs/dbraw/zinc/59/99/09/940599909.db2.gz BCSTXHJWXDAMGA-QFIPXVFZSA-N 0 3 416.525 4.095 20 0 HIADHN C(=Cc1ccc(OCc2cccnc2)cc1)c1nc(CC2=N[C@@H]3CCCC[C@@H]3N2)no1 ZINC000545845738 940629507 /nfs/dbraw/zinc/62/95/07/940629507.db2.gz HBVNKOUBSMNKEF-JCFIZXFYSA-N 0 3 415.497 4.069 20 0 HIADHN Cc1cc(C(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)c(C)n1Cc1ccncc1 ZINC000545856355 940639697 /nfs/dbraw/zinc/63/96/97/940639697.db2.gz DUTMEAFROICGMF-DEOSSOPVSA-N 0 3 416.569 4.285 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)c1ccc(NC(=O)c2cccs2)cc1)c1ccco1 ZINC000563989558 945337529 /nfs/dbraw/zinc/33/75/29/945337529.db2.gz WMRMCXHRIZNLJI-QAPCUYQASA-N 0 3 411.527 4.453 20 0 HIADHN Cc1ccc(CN2CCSCC2)cc1N[C@H](C)Cn1cc(Br)cn1 ZINC000545954420 940664727 /nfs/dbraw/zinc/66/47/27/940664727.db2.gz PDHIAGVDGOYVSQ-OAHLLOKOSA-N 0 3 409.397 4.003 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](NCCC[C@H]2CCCCO2)c2ccc(F)cc2)c1 ZINC000546165890 940719547 /nfs/dbraw/zinc/71/95/47/940719547.db2.gz HAXXXJQEULSZRA-IFMALSPDSA-N 0 3 405.535 4.258 20 0 HIADHN CCO[C@@H]1C[C@H](N[C@@H](C)c2ccc(OC(F)F)cc2OC(F)F)[C@@]12CCCO2 ZINC000546166883 940720017 /nfs/dbraw/zinc/72/00/17/940720017.db2.gz SLDUWPZCCZMZTR-ICSUNMLXSA-N 0 3 407.404 4.267 20 0 HIADHN CCO[C@@H]1C[C@H](N[C@H](C)c2ccc(OC(F)F)cc2OC(F)F)[C@@]12CCCO2 ZINC000546166882 940720149 /nfs/dbraw/zinc/72/01/49/940720149.db2.gz SLDUWPZCCZMZTR-HAJMXCNMSA-N 0 3 407.404 4.267 20 0 HIADHN Cc1ccc(Cc2noc([C@]3(C(F)(F)F)CCN(Cc4ccccc4)C3)n2)cn1 ZINC000546344766 940796498 /nfs/dbraw/zinc/79/64/98/940796498.db2.gz CWCSQZDYEKKHPY-FQEVSTJZSA-N 0 3 402.420 4.070 20 0 HIADHN C[C@@H]1C[C@H]1c1ccc(/C=C/c2nc(-c3ccc(N4CCCN(C)CC4)nc3)no2)o1 ZINC000546368697 940803431 /nfs/dbraw/zinc/80/34/31/940803431.db2.gz HRDHAVFVBNNARW-CSZITXDSSA-N 0 3 405.502 4.160 20 0 HIADHN CCc1cnccc1-c1noc([C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)n1 ZINC000546451883 940823552 /nfs/dbraw/zinc/82/35/52/940823552.db2.gz GGMXQSPCYRBCGD-FQEVSTJZSA-N 0 3 402.420 4.400 20 0 HIADHN CO[C@H](C)c1nc(Cc2noc([C@H]3CCCN(Cc4cccc(F)c4)C3)n2)cs1 ZINC000546533463 940845967 /nfs/dbraw/zinc/84/59/67/940845967.db2.gz QPBWTQZPLBQLCF-ZBFHGGJFSA-N 0 3 416.522 4.343 20 0 HIADHN Cc1cc(C(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)c(C)n1Cc1ccncc1 ZINC000546565005 940854768 /nfs/dbraw/zinc/85/47/68/940854768.db2.gz LZEXVZJTIRJTNF-OAQYLSRUSA-N 0 3 416.569 4.285 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCc1nc2ccccc2n1C1CC1)c1ccsc1 ZINC000546761897 940878595 /nfs/dbraw/zinc/87/85/95/940878595.db2.gz VDUMOLZGWCXQGP-HXUWFJFHSA-N 0 3 411.575 4.315 20 0 HIADHN COc1ccc(-c2csc(CN[C@H](Cc3ccc(Cl)cc3)C(N)=O)c2)cc1 ZINC000546886996 940901720 /nfs/dbraw/zinc/90/17/20/940901720.db2.gz IIMBOAHUCFIJFQ-HXUWFJFHSA-N 0 3 400.931 4.263 20 0 HIADHN CCN(C(=O)c1ccc(OC)c(-c2ccccn2)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000546889822 940902986 /nfs/dbraw/zinc/90/29/86/940902986.db2.gz SMMWHNBDACDIKF-JOCHJYFZSA-N 0 3 415.537 4.494 20 0 HIADHN CCN(C(=O)c1ccc(OC(F)F)c(OC)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000546893591 940904400 /nfs/dbraw/zinc/90/44/00/940904400.db2.gz XKHIWZDSCBTJGY-SFHVURJKSA-N 0 3 404.457 4.033 20 0 HIADHN CCN(C(=O)c1cn(CCOC)c2ccccc12)[C@H]1CCN(Cc2ccccc2)C1 ZINC000546905768 940908465 /nfs/dbraw/zinc/90/84/65/940908465.db2.gz YNNPTCXQBJDJEA-NRFANRHFSA-N 0 3 405.542 4.024 20 0 HIADHN CC[C@H](Cc1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1)c1ccc(C)cc1 ZINC000547071337 940983408 /nfs/dbraw/zinc/98/34/08/940983408.db2.gz YZUYADBWWCKHCD-LJQANCHMSA-N 0 3 405.546 4.318 20 0 HIADHN CC(C)Oc1cccc(/C=C\c2nc(-c3ccc(N4CCCN(C)CC4)nc3)no2)c1 ZINC000547074391 940985209 /nfs/dbraw/zinc/98/52/09/940985209.db2.gz XHONDVISBKUSBV-FLIBITNWSA-N 0 3 419.529 4.231 20 0 HIADHN COC(=O)CCC(C)(C)NCc1cc(Br)cc(Br)c1OC ZINC000547286422 941052196 /nfs/dbraw/zinc/05/21/96/941052196.db2.gz YJWMUBMIMUXCPK-UHFFFAOYSA-N 0 3 423.145 4.042 20 0 HIADHN Cc1c(CN2CCSCC2)cccc1N[C@@H](C)Cn1cc(Br)cn1 ZINC000547421335 941061600 /nfs/dbraw/zinc/06/16/00/941061600.db2.gz GUVIJXGRUMRAEX-AWEZNQCLSA-N 0 3 409.397 4.003 20 0 HIADHN CC(C)CN(C(=O)[C@@H]1CCCN(Cc2cccnc2)C1)[C@@H]1CCCc2cccnc21 ZINC000548147909 941088716 /nfs/dbraw/zinc/08/87/16/941088716.db2.gz LHPUPFQQGBSQLU-DHIUTWEWSA-N 0 3 406.574 4.251 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)CCn3c4ccccc4nc3C3CC3)c2)CC1 ZINC000548437495 941104207 /nfs/dbraw/zinc/10/42/07/941104207.db2.gz BPTUFOZIKJHPSQ-UHFFFAOYSA-N 0 3 417.557 4.084 20 0 HIADHN Cc1ccc(-n2c(SCCCN3CCN(C)CC3)nnc2-c2cccs2)cc1 ZINC000548474014 941106845 /nfs/dbraw/zinc/10/68/45/941106845.db2.gz LJKBHDBUXKTFLB-UHFFFAOYSA-N 0 3 413.616 4.034 20 0 HIADHN COc1ccc([C@H](CNC(=O)N[C@H](C(C)(C)C)C(F)(F)F)N2CCCC2)cc1 ZINC000548510292 941111159 /nfs/dbraw/zinc/11/11/59/941111159.db2.gz DEDFTNAQQAFWOS-DLBZAZTESA-N 0 3 401.473 4.108 20 0 HIADHN CN(C)C[C@H](NC(=O)Nc1cccc(C(=O)NC(C)(C)C)c1)c1ccc(Cl)cc1 ZINC000548972079 941136217 /nfs/dbraw/zinc/13/62/17/941136217.db2.gz FBXHGGJXSHFQTF-IBGZPJMESA-N 0 3 416.953 4.293 20 0 HIADHN CCN(C(=O)Nc1cn(Cc2ccccc2)nn1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000548983314 941138832 /nfs/dbraw/zinc/13/88/32/941138832.db2.gz ADGZAZLIXYJOFD-UGKGYDQZSA-N 0 3 418.545 4.016 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)Nc1ccc2nnc(C3CCC3)n2c1 ZINC000549001813 941141365 /nfs/dbraw/zinc/14/13/65/941141365.db2.gz LSGZQRLMQCMTRX-UHFFFAOYSA-N 0 3 420.561 4.025 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2ccc(NC(=O)CC(F)(F)F)cc2)[C@H]1c1ccccc1 ZINC000549063264 941151304 /nfs/dbraw/zinc/15/13/04/941151304.db2.gz JTKZZKGEUPCLNN-IEBWSBKVSA-N 0 3 420.435 4.144 20 0 HIADHN COc1ccccc1CCNC(=O)CN[C@@H](c1cccc(C(F)(F)F)c1)C1CC1 ZINC000549078777 941153754 /nfs/dbraw/zinc/15/37/54/941153754.db2.gz HZKXZPPZCBTZST-OAQYLSRUSA-N 0 3 406.448 4.114 20 0 HIADHN CC(C)C(=O)c1ccc([C@H](C)C(=O)N(C)C2CCN(CCc3ccccn3)CC2)cc1 ZINC000549083019 941154462 /nfs/dbraw/zinc/15/44/62/941154462.db2.gz AKYGNSRAWXNOLD-FQEVSTJZSA-N 0 3 421.585 4.189 20 0 HIADHN CC(C)C(=O)c1ccc([C@@H](C)C(=O)N(C)C2CCN(CCc3ccccn3)CC2)cc1 ZINC000549083024 941154852 /nfs/dbraw/zinc/15/48/52/941154852.db2.gz AKYGNSRAWXNOLD-HXUWFJFHSA-N 0 3 421.585 4.189 20 0 HIADHN CC(C)N(Cc1cccs1)C(=O)NCCCCN1CCN(c2ccccc2)CC1 ZINC000549167654 941167891 /nfs/dbraw/zinc/16/78/91/941167891.db2.gz ARCJXMSBFFCMMC-UHFFFAOYSA-N 0 3 414.619 4.271 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@H](N[C@H](Cc2nc(C)no2)c2ccccc2)c2ccccc21 ZINC000549236912 941172989 /nfs/dbraw/zinc/17/29/89/941172989.db2.gz HSYILWCHZSGBAG-BHIFYINESA-N 0 3 405.498 4.433 20 0 HIADHN COc1ccccc1NC(=O)CN[C@@H]1CCN(C(C)C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000549345355 941181629 /nfs/dbraw/zinc/18/16/29/941181629.db2.gz NDFMXIOHQOFJMY-DENIHFKCSA-N 0 3 419.928 4.240 20 0 HIADHN CCn1c([C@H](C)Oc2ccc(F)cc2)nnc1N1CCN(C2CCCCC2)CC1 ZINC000549375825 941183778 /nfs/dbraw/zinc/18/37/78/941183778.db2.gz JWPOTXJCAAXRSH-KRWDZBQOSA-N 0 3 401.530 4.032 20 0 HIADHN CCOC(=O)c1csc(C2CCN(Cc3ccc(-c4cnn(C)c4)s3)CC2)n1 ZINC000549406667 941186742 /nfs/dbraw/zinc/18/67/42/941186742.db2.gz KNWDVLZFSMBNNA-UHFFFAOYSA-N 0 3 416.572 4.161 20 0 HIADHN Cc1ccc(C)c(NC(=O)CN[C@H]2CCN(C(C)C)[C@@H]2c2ccc(F)c(F)c2)c1 ZINC000549469476 941193156 /nfs/dbraw/zinc/19/31/56/941193156.db2.gz UGMKOAWMDSJZHB-NZQKXSOJSA-N 0 3 401.501 4.334 20 0 HIADHN CCN1CC[C@H](N[C@@H](C)C(=O)Nc2ccccc2OC)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000549475161 941194169 /nfs/dbraw/zinc/19/41/69/941194169.db2.gz CNWFHGZGOJKUDD-JBYOLUDKSA-N 0 3 419.928 4.240 20 0 HIADHN CCN1CC[C@@H](NCC(=O)Nc2ccc(C)cc2C)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000549477107 941194637 /nfs/dbraw/zinc/19/46/37/941194637.db2.gz QUDRAZLZBUCPHT-KNQAVFIVSA-N 0 3 405.464 4.084 20 0 HIADHN CN(C)C[C@H](NC(=O)NC[C@H]1CCCO[C@@H]1c1ccccc1)c1ccc(Cl)cc1 ZINC000549480497 941194953 /nfs/dbraw/zinc/19/49/53/941194953.db2.gz BEYWTXNYYCTYQC-BAGYTPMASA-N 0 3 415.965 4.410 20 0 HIADHN CCN1CC[C@H](N[C@@H](C)C(=O)N(C)C2CCCCC2)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000549482086 941195188 /nfs/dbraw/zinc/19/51/88/941195188.db2.gz KWOFZBCGQLELQP-ONTRVFCTSA-N 0 3 411.512 4.008 20 0 HIADHN CN(C)C[C@H](NC(=O)N[C@H]1CCO[C@@H]1c1ccc(Cl)cc1)c1ccc(Cl)cc1 ZINC000549491002 941195873 /nfs/dbraw/zinc/19/58/73/941195873.db2.gz ZGMWJBKJNDSRBM-SLFFLAALSA-N 0 3 422.356 4.426 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@H](NCc2cccc(NC(=O)[C@@H]3CCCO3)c2)c2ccccc21 ZINC000549525018 941198030 /nfs/dbraw/zinc/19/80/30/941198030.db2.gz QCHFKOLZVGFQDU-VJBWXMMDSA-N 0 3 422.525 4.076 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@@H](N[C@H](CN2CCOCC2)c2ccc(C)cc2)c2ccccc21 ZINC000549527871 941198162 /nfs/dbraw/zinc/19/81/62/941198162.db2.gz OXFPFFIXZGZIEU-UBFVSLLYSA-N 0 3 422.569 4.140 20 0 HIADHN O=C(NCCN1CCCC1)c1ccc(NCc2cc(Cl)ccc2OC(F)F)cc1 ZINC000549682059 941204297 /nfs/dbraw/zinc/20/42/97/941204297.db2.gz QLLNOUBAKIDLJU-UHFFFAOYSA-N 0 3 423.891 4.379 20 0 HIADHN CC[C@H](N[C@@H]1CCN([C@@H](C)c2ccc(F)cc2)C1=O)c1ccc(OC)c(OC)c1 ZINC000549708898 941205329 /nfs/dbraw/zinc/20/53/29/941205329.db2.gz HADSLQKCQKRZKB-RYGJVYDSSA-N 0 3 400.494 4.246 20 0 HIADHN CC(C)Cn1c([C@@H](C)Oc2ccccc2F)nnc1N1CCN(C2CCCC2)CC1 ZINC000549835174 941209651 /nfs/dbraw/zinc/20/96/51/941209651.db2.gz OLVWZZGOSPVBRV-GOSISDBHSA-N 0 3 415.557 4.278 20 0 HIADHN O=C(NCCN1CCCC1)c1ccc(NCc2ccc(OCC(F)(F)F)cc2)cc1 ZINC000550066381 941278086 /nfs/dbraw/zinc/27/80/86/941278086.db2.gz MSWOMELTWJQLMD-UHFFFAOYSA-N 0 3 421.463 4.065 20 0 HIADHN COc1cc(-c2noc([C@]3(C(F)(F)F)CCN(Cc4ccccc4)C3)n2)cc(C)n1 ZINC000550066150 941278154 /nfs/dbraw/zinc/27/81/54/941278154.db2.gz FWDNKTGSMIDNQP-FQEVSTJZSA-N 0 3 418.419 4.155 20 0 HIADHN CC(=O)Nc1ccc(OC[C@@H](O)CN2CCc3ccccc3[C@H]2c2ccccc2)cc1 ZINC000550344282 941317152 /nfs/dbraw/zinc/31/71/52/941317152.db2.gz BAPNEETZPAROET-JYFHCDHNSA-N 0 3 416.521 4.032 20 0 HIADHN CCOc1ccc(CN2CCC(C(=O)NCc3ccc(F)cc3)CC2)cc1OCC ZINC000550348438 941317507 /nfs/dbraw/zinc/31/75/07/941317507.db2.gz IYHQSKYVGOYVBL-UHFFFAOYSA-N 0 3 414.521 4.152 20 0 HIADHN C[C@@H](NCc1ccccc1OCC(=O)NC[C@@H]1CCCO1)c1cccc(C2CC2)c1 ZINC000550618713 941346615 /nfs/dbraw/zinc/34/66/15/941346615.db2.gz FVSKDMBSEZUUMA-JPYJTQIMSA-N 0 3 408.542 4.089 20 0 HIADHN CN(C)CCN(C(=O)c1cc(CNC(=O)C(C)(C)C)ccc1Cl)c1ccccc1 ZINC000550647682 941349366 /nfs/dbraw/zinc/34/93/66/941349366.db2.gz TTZSSTKUQLLANQ-UHFFFAOYSA-N 0 3 415.965 4.211 20 0 HIADHN CC(C)Oc1ccc2ccccc2c1CN[C@@H]1CCCc2cc(S(N)(=O)=O)ccc21 ZINC000550795477 941368061 /nfs/dbraw/zinc/36/80/61/941368061.db2.gz TXTAMYJPAYJKHL-HSZRJFAPSA-N 0 3 424.566 4.442 20 0 HIADHN O=S1(=O)CC[C@H](NC[C@H](c2ccccc2)C2CC2)c2cc(Br)ccc21 ZINC000550848382 941374069 /nfs/dbraw/zinc/37/40/69/941374069.db2.gz UMDBMKWLDUICBK-MOPGFXCFSA-N 0 3 420.372 4.451 20 0 HIADHN COc1cc2c(cc1OC)[C@H](N[C@@H]1CCCN([C@@H](C)c3ccc(F)cc3)C1=O)CC2 ZINC000550894399 941380240 /nfs/dbraw/zinc/38/02/40/941380240.db2.gz FAAZPSGGJLRUBF-IWMITWMQSA-N 0 3 412.505 4.172 20 0 HIADHN CN(C(=O)c1ccc(NCc2cc(F)cc3cccnc32)cc1)[C@H]1CCCN(C)C1 ZINC000551085891 941406938 /nfs/dbraw/zinc/40/69/38/941406938.db2.gz CXCULFNWRAGFOG-QFIPXVFZSA-N 0 3 406.505 4.152 20 0 HIADHN CC(C)Cn1ncc(C(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)c1C(F)F ZINC000551223715 941430221 /nfs/dbraw/zinc/43/02/21/941430221.db2.gz IZLLUZDHZYAREP-KRWDZBQOSA-N 0 3 404.505 4.213 20 0 HIADHN COc1cccc(C(=O)CCCC(=O)N(C)C[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000551245718 941435140 /nfs/dbraw/zinc/43/51/40/941435140.db2.gz KJVMVGVYIYWIRX-NRFANRHFSA-N 0 3 408.542 4.029 20 0 HIADHN CCCOc1ccccc1Oc1ncccc1CN[C@@H]1CCC[C@@H](S(C)(=O)=O)C1 ZINC000551266103 941439295 /nfs/dbraw/zinc/43/92/95/941439295.db2.gz VZLRBCAPMIYZBZ-RTBURBONSA-N 0 3 418.559 4.108 20 0 HIADHN CCO[C@@H]1C[C@H](N[C@H](c2ccc(Br)cc2F)C2CC2)[C@H]1n1cccn1 ZINC000551320122 941451731 /nfs/dbraw/zinc/45/17/31/941451731.db2.gz JDMSBYJGBPAENX-ZSYWTGECSA-N 0 3 408.315 4.244 20 0 HIADHN CN(C(=O)Nc1ccc(Oc2cccnc2)nc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000551393078 941468385 /nfs/dbraw/zinc/46/83/85/941468385.db2.gz DGDJEIBIMHYULX-OAQYLSRUSA-N 0 3 417.513 4.397 20 0 HIADHN Cn1c2ccccc2nc1[C@@H]1CCCN1C[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000551395790 941469026 /nfs/dbraw/zinc/46/90/26/941469026.db2.gz PMUMTUNRLGVNNE-URXFXBBRSA-N 0 3 404.558 4.001 20 0 HIADHN COc1ccc2ccc(C(=O)N3CCC(CCN4C[C@H](C)O[C@@H](C)C4)CC3)cc2c1 ZINC000551464986 941484663 /nfs/dbraw/zinc/48/46/63/941484663.db2.gz RCCPUTGZCUQZHI-OALUTQOASA-N 0 3 410.558 4.200 20 0 HIADHN CCCCOc1ccc([C@H](C)NCc2ccc(N3CCCS3(=O)=O)c(F)c2)cc1 ZINC000551515819 941493133 /nfs/dbraw/zinc/49/31/33/941493133.db2.gz GTLLMZHOQNCEQZ-KRWDZBQOSA-N 0 3 420.550 4.395 20 0 HIADHN O[C@@H](CNCc1cc(Cl)c2c(c1)OCCCO2)COc1ccc2ccccc2c1 ZINC000551523646 941494464 /nfs/dbraw/zinc/49/44/64/941494464.db2.gz AFWXJUZEZIJNHG-IBGZPJMESA-N 0 3 413.901 4.184 20 0 HIADHN COc1ccc([C@H]2C[C@@H]2[C@@H](C)NCc2csc(CNC(=O)c3ccccc3)n2)cc1 ZINC000551533033 941496369 /nfs/dbraw/zinc/49/63/69/941496369.db2.gz IYUOMPYSMQEODF-NPFVIJTESA-N 0 3 421.566 4.364 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)c2cc(C(C)C)nc3c2cnn3C(C)C)cc1 ZINC000551532298 941496513 /nfs/dbraw/zinc/49/65/13/941496513.db2.gz BCBMTYVIEVJXBK-JOCHJYFZSA-N 0 3 423.561 4.177 20 0 HIADHN CC(=O)N(C)C1CCN(Cc2cn(-c3ccc(C)cc3)nc2-c2ccc(F)cc2)CC1 ZINC000551559491 941500941 /nfs/dbraw/zinc/50/09/41/941500941.db2.gz MYRJJQAGQHJHAA-UHFFFAOYSA-N 0 3 420.532 4.430 20 0 HIADHN CCS(=O)(=O)c1ccc([C@@H](C)N[C@H](C)CC(=O)Nc2ccc(C)cc2C)cc1 ZINC000551564909 941502619 /nfs/dbraw/zinc/50/26/19/941502619.db2.gz RHUQNZQRFOIXMC-QZTJIDSGSA-N 0 3 402.560 4.165 20 0 HIADHN CC[C@H](NCc1cccc(N2C(=O)N[C@](C)(C3CC3)C2=O)c1)c1ccc(OC)cc1 ZINC000551574455 941505239 /nfs/dbraw/zinc/50/52/39/941505239.db2.gz IWJUODPNBHZYDQ-XUZZJYLKSA-N 0 3 407.514 4.161 20 0 HIADHN O=C(N[C@@H](CCCO)c1ccccc1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000551680698 941525902 /nfs/dbraw/zinc/52/59/02/941525902.db2.gz UITFETXFACKNMJ-UNMCSNQZSA-N 0 3 420.475 4.071 20 0 HIADHN Cc1ccc(C(=O)C2CCN(C[C@@H]3CN(Cc4ccccc4)CCCO3)CC2)c(C)c1 ZINC000551697995 941528812 /nfs/dbraw/zinc/52/88/12/941528812.db2.gz HTMFSVFSLXFCFF-RUZDIDTESA-N 0 3 420.597 4.489 20 0 HIADHN CC1CCC(NC(=O)CN[C@H](c2cccc(C(F)(F)F)c2)C2CCOCC2)CC1 ZINC000551721708 941533085 /nfs/dbraw/zinc/53/30/85/941533085.db2.gz FOWRFDPNOFNYMS-ZJKHUDDUSA-N 0 3 412.496 4.458 20 0 HIADHN CCCCOc1ccc([C@@H](C)NCc2cccc(N3CCCS3(=O)=O)c2)cc1 ZINC000551779326 941543720 /nfs/dbraw/zinc/54/37/20/941543720.db2.gz ZEAHTZARYAOAHP-GOSISDBHSA-N 0 3 402.560 4.256 20 0 HIADHN C[C@@H]1CN([C@H](CNCc2cnc(C(C)(C)C)nc2)c2c(F)cccc2Cl)CCO1 ZINC000551799246 941547463 /nfs/dbraw/zinc/54/74/63/941547463.db2.gz OZFLHWOOXIDFLQ-DNVCBOLYSA-N 0 3 420.960 4.118 20 0 HIADHN CC1(C)C[C@@H](NCc2cccc(N3C(=O)N[C@](C)(C4CC4)C3=O)c2)c2ccccc21 ZINC000551818094 941552131 /nfs/dbraw/zinc/55/21/31/941552131.db2.gz SYDQPQQAZQBMAQ-PXDATVDWSA-N 0 3 403.526 4.424 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3CCCc4cc(OC)ccc4C3)c(C)c2)CC1 ZINC000551908861 941560421 /nfs/dbraw/zinc/56/04/21/941560421.db2.gz AMPKEPACTWBGHC-UHFFFAOYSA-N 0 3 422.573 4.126 20 0 HIADHN Cc1cc(OC[C@@H](O)CNCc2ccc3c(c2)OCCO3)c(C(C)C)cc1Cl ZINC000551972947 941564421 /nfs/dbraw/zinc/56/44/21/941564421.db2.gz WQKKZHOLJBODHO-KRWDZBQOSA-N 0 3 405.922 4.073 20 0 HIADHN CNC(=O)COc1cccc(CN[C@H](C)c2ccc(SCC(F)(F)F)cc2)c1 ZINC000552075497 941580181 /nfs/dbraw/zinc/58/01/81/941580181.db2.gz ZJHASQOGUQJSKR-CQSZACIVSA-N 0 3 412.477 4.317 20 0 HIADHN COCCCOc1cccc(NC(=O)[C@H]2CN(Cc3ccccc3)CCC2(F)F)c1 ZINC000552076908 941580780 /nfs/dbraw/zinc/58/07/80/941580780.db2.gz MRYXDNOKWGCKIP-OAQYLSRUSA-N 0 3 418.484 4.198 20 0 HIADHN O[C@@H](CN[C@H]1CCOc2c(Cl)cccc21)COc1cc(Cl)ccc1Cl ZINC000552226849 941608600 /nfs/dbraw/zinc/60/86/00/941608600.db2.gz QUHIWARAAGBHSC-LRDDRELGSA-N 0 3 402.705 4.500 20 0 HIADHN CCCN(C)[C@H](CNC(=O)CCc1nc(-c2ccco2)no1)c1ccc(Cl)cc1 ZINC000552242335 941611454 /nfs/dbraw/zinc/61/14/54/941611454.db2.gz XAYCQHCAWUKNKI-QGZVFWFLSA-N 0 3 416.909 4.115 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)CSCc1c(C)noc1C)c1ccc(Cl)cc1 ZINC000552243157 941612302 /nfs/dbraw/zinc/61/23/02/941612302.db2.gz RFGKSRDASZHZEQ-IBGZPJMESA-N 0 3 409.983 4.377 20 0 HIADHN COc1cc(OC)c([C@@H](C)NC[C@H]2CC[C@@H](c3nc(C4CC4)no3)O2)cc1Cl ZINC000552297974 941625837 /nfs/dbraw/zinc/62/58/37/941625837.db2.gz NIUOZOVXZOMOBO-KFNAQCHYSA-N 0 3 407.898 4.189 20 0 HIADHN C[C@H](Oc1ccc(-c2ccccc2)cc1)C(=O)NCCCCN1C[C@H](C)O[C@@H](C)C1 ZINC000552301504 941627484 /nfs/dbraw/zinc/62/74/84/941627484.db2.gz GKFYKKCJFXNHGW-ACRUOGEOSA-N 0 3 410.558 4.127 20 0 HIADHN Cc1cc(I)cc(N[C@@H]2CCN(Cc3ccccn3)C[C@H]2C)c1 ZINC000552335339 941635334 /nfs/dbraw/zinc/63/53/34/941635334.db2.gz PAIHAQXSLMSNRH-DNVCBOLYSA-N 0 3 421.326 4.317 20 0 HIADHN O=C(CCC(=O)N1CC[C@@]2(CCN(Cc3ccccc3)C2)C1)c1ccc(F)c(F)c1 ZINC000552350846 941641852 /nfs/dbraw/zinc/64/18/52/941641852.db2.gz HTIYJRPPOIFFBC-XMMPIXPASA-N 0 3 412.480 4.052 20 0 HIADHN C[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)N(C)CCCN(C)Cc1ccncc1 ZINC000552360681 941644128 /nfs/dbraw/zinc/64/41/28/941644128.db2.gz MXCAQFNUUUGCHM-QGZVFWFLSA-N 0 3 407.480 4.260 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)c2cccc(F)c2Br)N(C)C)cc1 ZINC000552457238 941676068 /nfs/dbraw/zinc/67/60/68/941676068.db2.gz LALWIONFWADANI-GOSISDBHSA-N 0 3 423.326 4.408 20 0 HIADHN COc1ccccc1CC(C)(C)NC(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000552651377 941730276 /nfs/dbraw/zinc/73/02/76/941730276.db2.gz MHCYMQTXJQFGBK-GOSISDBHSA-N 0 3 401.576 4.214 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c2sc(C(=O)N3C[C@H](N4CCCC4)C[C@H]3C)cc12 ZINC000552680319 941736399 /nfs/dbraw/zinc/73/63/99/941736399.db2.gz OMTBVUZWSLWDNV-RDTXWAMCSA-N 0 3 412.534 4.233 20 0 HIADHN CN(Cc1ccc(OCC(F)(F)F)cc1)C(=O)c1cccc(CN2CCCC2)c1 ZINC000552727135 941746227 /nfs/dbraw/zinc/74/62/27/941746227.db2.gz KXQDLOSVDXWPOU-UHFFFAOYSA-N 0 3 406.448 4.496 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)c2cc(-c3ccc(Cl)s3)on2)cc1 ZINC000552813986 941773774 /nfs/dbraw/zinc/77/37/74/941773774.db2.gz SRQUZLANUQKAMM-HNNXBMFYSA-N 0 3 405.907 4.098 20 0 HIADHN CC[C@@H]1C[C@@H](C(=O)N(Cc2ccncc2)[C@H]2CCCN(Cc3ccccc3)C2)CCO1 ZINC000552850305 941787856 /nfs/dbraw/zinc/78/78/56/941787856.db2.gz XOZJOICLZXZVIG-CCDWMCETSA-N 0 3 421.585 4.280 20 0 HIADHN O=C(Cc1cccc(F)c1)N(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000552852208 941788751 /nfs/dbraw/zinc/78/87/51/941788751.db2.gz NHIKMBJKTXUSGS-RUZDIDTESA-N 0 3 417.528 4.457 20 0 HIADHN Cc1c(Br)cccc1CN[C@H](C)c1cccc(N2CCCS2(=O)=O)c1 ZINC000552920363 941803053 /nfs/dbraw/zinc/80/30/53/941803053.db2.gz SYBLOGOBROHKSY-OAHLLOKOSA-N 0 3 423.376 4.148 20 0 HIADHN COC1CCN(C(C)(C)CNC(=O)c2cc(Cl)c(C)cc2Br)CC1 ZINC000552952207 941806879 /nfs/dbraw/zinc/80/68/79/941806879.db2.gz WGGLEOASVNHNQO-UHFFFAOYSA-N 0 3 417.775 4.030 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)N1[C@@H](C)CCC[C@@H]1C)c1ccc(NC(=O)c2ccncc2)cc1 ZINC000553002804 941814429 /nfs/dbraw/zinc/81/44/29/941814429.db2.gz KDTCOLGURVYNOU-OKYOBFRVSA-N 0 3 408.546 4.163 20 0 HIADHN CCCN(C)[C@H](CNC(=O)[C@@H]1CCCN(C(=O)[C@@H](C)CC)C1)c1ccc(Cl)cc1 ZINC000553027451 941819724 /nfs/dbraw/zinc/81/97/24/941819724.db2.gz ZUBYLJWZKHUZSO-FBBABVLZSA-N 0 3 422.013 4.124 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccc(F)c2)C1)N1C[C@H](c2ccccc2)[C@H]2COCC[C@H]21 ZINC000553040813 941822801 /nfs/dbraw/zinc/82/28/01/941822801.db2.gz OOGLYGKMTHLDMA-WJNCPCKPSA-N 0 3 422.544 4.069 20 0 HIADHN C[C@H](NCC(=O)Nc1ccc(OC(F)(F)F)cc1)c1cccc(N2CCCC2)c1 ZINC000553075456 941829027 /nfs/dbraw/zinc/82/90/27/941829027.db2.gz NRYFUCWGXOJCFZ-HNNXBMFYSA-N 0 3 407.436 4.475 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)C[C@H](c1ncc[nH]1)c1ccccc1 ZINC000553143240 941840044 /nfs/dbraw/zinc/84/00/44/941840044.db2.gz DFLLRTJGWWBSOH-OFNKIYASSA-N 0 3 402.542 4.055 20 0 HIADHN Cc1nn(-c2ccccc2C)c2sc(C(=O)N3C[C@H](N4CCCC4)C[C@H]3C)cc12 ZINC000553168236 941843711 /nfs/dbraw/zinc/84/37/11/941843711.db2.gz CJBOKELYYPEYKI-SJLPKXTDSA-N 0 3 408.571 4.403 20 0 HIADHN O=C([C@@H]1CCCC[C@@H]1C(F)(F)F)N1CCC[C@H](c2n[nH]cc2CN2CCCC2)C1 ZINC000553180831 941845497 /nfs/dbraw/zinc/84/54/97/941845497.db2.gz JYLHIRYLTVKVOB-JQHSSLGASA-N 0 3 412.500 4.080 20 0 HIADHN O=C(C1CCSCC1)N(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000553196429 941847260 /nfs/dbraw/zinc/84/72/60/941847260.db2.gz NKISVRVNTHLRAL-QHCPKHFHSA-N 0 3 409.599 4.218 20 0 HIADHN Cc1c2ccccc2oc1[C@@H](NCc1ccc(S(=O)(=O)N(C)C)cc1)C(C)C ZINC000553261625 941858270 /nfs/dbraw/zinc/85/82/70/941858270.db2.gz LIZFJRNROPNDCW-NRFANRHFSA-N 0 3 400.544 4.478 20 0 HIADHN C[C@H](NC(=O)NC[C@H](c1cccs1)N1CCC(C)CC1)c1ccc2n[nH]cc2c1 ZINC000553363918 941873581 /nfs/dbraw/zinc/87/35/81/941873581.db2.gz WKFNDYQDETVPRX-OXJNMPFZSA-N 0 3 411.575 4.458 20 0 HIADHN C[C@@H](NC(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1)c1ccc2n[nH]cc2c1 ZINC000553363920 941873595 /nfs/dbraw/zinc/87/35/95/941873595.db2.gz WKFNDYQDETVPRX-UZLBHIALSA-N 0 3 411.575 4.458 20 0 HIADHN CN(CCCN(C)C(=O)c1ccc(-n2cnc3ccccc32)cc1)Cc1ccco1 ZINC000553402263 941879579 /nfs/dbraw/zinc/87/95/79/941879579.db2.gz URIKXVNZXMFTAS-UHFFFAOYSA-N 0 3 402.498 4.213 20 0 HIADHN CC[C@H](NC(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1)c1ccc(OC)c(OC)c1 ZINC000553485006 941893788 /nfs/dbraw/zinc/89/37/88/941893788.db2.gz REXXDQZRQFCRBT-UIFIKXQLSA-N 0 3 411.546 4.290 20 0 HIADHN C[C@H]1CN(C(=O)c2ccc(NC(=O)Nc3ccccc3)s2)CCN(C2CCC2)C1 ZINC000553517948 941901248 /nfs/dbraw/zinc/90/12/48/941901248.db2.gz FPGHJSMPVZWBGO-MRXNPFEDSA-N 0 3 412.559 4.339 20 0 HIADHN C[C@@H]1C[C@@H]1[C@H](NCC(=O)NC[C@@H]1CCN(c2ccccc2)C1)c1ccc(Cl)cc1 ZINC000553622044 941922625 /nfs/dbraw/zinc/92/26/25/941922625.db2.gz QLTMMSBZXRTRJT-FUIFJNQPSA-N 0 3 411.977 4.269 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)c2cc(Br)cs2)N(C)C)cc1 ZINC000553672658 941941691 /nfs/dbraw/zinc/94/16/91/941941691.db2.gz MSBPDICPTRHVEF-INIZCTEOSA-N 0 3 411.365 4.331 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CNC[C@@H](O)COc1cccc2ccccc21 ZINC000553716987 941950369 /nfs/dbraw/zinc/95/03/69/941950369.db2.gz IFPSDNKGMGCNOP-JOCHJYFZSA-N 0 3 401.510 4.172 20 0 HIADHN Cc1cccc(C(=O)Nc2ccccc2C(=O)N2CCN([C@@H]3C[C@@H]3C)C[C@H](C)C2)c1 ZINC000553783181 941967609 /nfs/dbraw/zinc/96/76/09/941967609.db2.gz NVQYSWPJHNBPNE-SFYKDHMMSA-N 0 3 405.542 4.050 20 0 HIADHN Cc1cccc(C(=O)Nc2ccccc2C(=O)N2CCN([C@@H]3C[C@@H]3C)C[C@@H](C)C2)c1 ZINC000553783180 941967875 /nfs/dbraw/zinc/96/78/75/941967875.db2.gz NVQYSWPJHNBPNE-SELNLUPBSA-N 0 3 405.542 4.050 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)N1CCC2(CC(OCC)C2)C1)c1ccc(Cl)cc1 ZINC000553893134 941992219 /nfs/dbraw/zinc/99/22/19/941992219.db2.gz DVJINNHIUPHHOT-FUHYEJFZSA-N 0 3 407.986 4.324 20 0 HIADHN C[C@@H](CNC(=O)N(C)Cc1ccc(OCC(F)(F)F)cc1)N(C)Cc1ccccc1 ZINC000553895548 941992957 /nfs/dbraw/zinc/99/29/57/941992957.db2.gz OAFCXELSLSFIIG-KRWDZBQOSA-N 0 3 423.479 4.290 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)N1CCC[C@@H](c2ccnn2C)C1)c1ccc(Cl)cc1 ZINC000553895086 941993005 /nfs/dbraw/zinc/99/30/05/941993005.db2.gz LUVXCLRXBZQDGB-NQIIRXRSSA-N 0 3 417.985 4.046 20 0 HIADHN CCCN(C)[C@H](CNC(=O)N1CCC[C@H]([C@@H]2CCOC2)C1)c1ccc(Cl)cc1 ZINC000553895034 941993031 /nfs/dbraw/zinc/99/30/31/941993031.db2.gz LHTLHBQGYIFAQV-QKNQBKEWSA-N 0 3 407.986 4.181 20 0 HIADHN OCC[C@@H](NC[C@@H](O)COc1ccc(Cl)cc1Cl)c1ccc(Cl)cc1 ZINC000553944191 942004242 /nfs/dbraw/zinc/00/42/42/942004242.db2.gz PUHNTQQRBNPQSX-NVXWUHKLSA-N 0 3 404.721 4.100 20 0 HIADHN OCC[C@H](NC[C@@H](O)COc1ccc(Cl)cc1Cl)c1ccc(Cl)cc1 ZINC000553944196 942004354 /nfs/dbraw/zinc/00/43/54/942004354.db2.gz PUHNTQQRBNPQSX-WBVHZDCISA-N 0 3 404.721 4.100 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)Cc2coc(-c3ccccc3)n2)N(C)C)cc1 ZINC000554013573 942019374 /nfs/dbraw/zinc/01/93/74/942019374.db2.gz WBJFMWNWEDCMOH-JOCHJYFZSA-N 0 3 407.514 4.090 20 0 HIADHN COC[C@H](NC1CCN(C(=O)c2ccccc2F)CC1)c1cccc(Cl)c1F ZINC000554071676 942029441 /nfs/dbraw/zinc/02/94/41/942029441.db2.gz LUHVNEIUEIKITK-IBGZPJMESA-N 0 3 408.876 4.200 20 0 HIADHN CC(C)Cc1ccc([C@@H](CNC(=O)CCc2nnc(-c3ccccc3)o2)N(C)C)cc1 ZINC000554084716 942033245 /nfs/dbraw/zinc/03/32/45/942033245.db2.gz XAIDQAFGXRXLEE-JOCHJYFZSA-N 0 3 420.557 4.287 20 0 HIADHN COc1cc(Br)ccc1[C@H](C)N[C@H](C)c1cccc(-n2ccnn2)c1 ZINC000554094210 942034874 /nfs/dbraw/zinc/03/48/74/942034874.db2.gz BEWNVJNVKOZYGT-KGLIPLIRSA-N 0 3 401.308 4.450 20 0 HIADHN Cc1nn(Cc2ccccc2Cl)c(C)c1C(=O)N1CCN([C@@H]2C[C@@H]2C)C[C@@H](C)C1 ZINC000554132471 942044772 /nfs/dbraw/zinc/04/47/72/942044772.db2.gz UTSSONJZVAQMBB-VWKPWSFCSA-N 0 3 414.981 4.004 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1ccc(C(=O)NC(C)(C)C)cc1)c1ccco1 ZINC000554135411 942046282 /nfs/dbraw/zinc/04/62/82/942046282.db2.gz KKXBXAGQUZUMFJ-MAUKXSAKSA-N 0 3 400.523 4.059 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1ccccc1OC[C@H]1CCCCO1)c1ccco1 ZINC000554192919 942063397 /nfs/dbraw/zinc/06/33/97/942063397.db2.gz NLHFGNQAMSUCSY-NLWGTHIKSA-N 0 3 415.534 4.478 20 0 HIADHN CN(C)[C@H](CNC(=O)N[C@H](CCO)c1ccc(Cl)c(Cl)c1)c1ccccc1 ZINC000554216608 942070273 /nfs/dbraw/zinc/07/02/73/942070273.db2.gz LBSHMBCIBXDWIF-RTBURBONSA-N 0 3 410.345 4.019 20 0 HIADHN Brc1ccc2ncnc(N3CCN(c4ccnc5ccccc54)CC3)c2c1 ZINC000554224683 942072286 /nfs/dbraw/zinc/07/22/86/942072286.db2.gz IWBSICGJVWFYFP-UHFFFAOYSA-N 0 3 420.314 4.267 20 0 HIADHN CC(C)Cc1ccc([C@@H](CNC(=O)Nc2ccc3c(c2)NC(=O)CC3)N(C)C)cc1 ZINC000554232256 942073890 /nfs/dbraw/zinc/07/38/90/942073890.db2.gz CBMUVGIUQRQHNY-JOCHJYFZSA-N 0 3 408.546 4.194 20 0 HIADHN CSC[C@H]1CCCN(C(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)C1 ZINC000554278503 942088503 /nfs/dbraw/zinc/08/85/03/942088503.db2.gz IXMWSOVLIDPYLF-PKOBYXMFSA-N 0 3 400.510 4.043 20 0 HIADHN C[C@H](NC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C)c1nccn1-c1ccccc1 ZINC000554333679 942106522 /nfs/dbraw/zinc/10/65/22/942106522.db2.gz UIBOCZBYRKKTOF-SFTDATJTSA-N 0 3 417.557 4.239 20 0 HIADHN CC[C@@H](N[C@H]1CCN(Cc2ccc(OC)cc2OC)C1=O)c1ccc(Cl)cc1 ZINC000554366152 942115465 /nfs/dbraw/zinc/11/54/65/942115465.db2.gz HFPCEZNCMZFDFY-UXHICEINSA-N 0 3 402.922 4.199 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1ccc(NC(=O)c2ccco2)cc1)c1ccco1 ZINC000554400834 942127504 /nfs/dbraw/zinc/12/75/04/942127504.db2.gz FJPXYCXZEMPEAW-MAUKXSAKSA-N 0 3 410.474 4.376 20 0 HIADHN C[C@@H](NC(=O)Nc1cccc(C(=O)N2CCCCC2)c1)[C@H](c1ccccc1)N(C)C ZINC000554418787 942134577 /nfs/dbraw/zinc/13/45/77/942134577.db2.gz FZWPQXITOWBLOU-XMSQKQJNSA-N 0 3 408.546 4.126 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1cccc(C(=O)N2CCCCC2)c1)c1ccco1 ZINC000554418574 942134611 /nfs/dbraw/zinc/13/46/11/942134611.db2.gz BQMHXLBGWHHTGC-PXNSSMCTSA-N 0 3 412.534 4.157 20 0 HIADHN CCCNC(=O)c1ccc(NC(=O)N[C@H](CN(C)C)c2ccc(F)cc2)cc1Cl ZINC000554435260 942141937 /nfs/dbraw/zinc/14/19/37/942141937.db2.gz OFMRZTOHERMZOC-LJQANCHMSA-N 0 3 420.916 4.043 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)Nc1ccc(Br)c(OC)c1)c1ccco1 ZINC000554454797 942150298 /nfs/dbraw/zinc/15/02/98/942150298.db2.gz SZFOSMWDJAJAOU-DOMZBBRYSA-N 0 3 410.312 4.302 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccnc2)C1)N1CC[C@@](F)(c2cccc(Cl)c2)C1 ZINC000554811348 942254326 /nfs/dbraw/zinc/25/43/26/942254326.db2.gz BCQXNSXZRFUQRW-GCJKJVERSA-N 0 3 401.913 4.044 20 0 HIADHN CC(=O)NCCN(CCCC(=O)Nc1c(C)cc(C)cc1C)Cc1ccc(C)s1 ZINC000554830582 942268653 /nfs/dbraw/zinc/26/86/53/942268653.db2.gz NANYNGAMBNVXNQ-UHFFFAOYSA-N 0 3 415.603 4.339 20 0 HIADHN CC(C)C[C@H]([NH2+]C[C@@H](C)c1ccc(C(F)(F)F)cc1)c1nc(-c2nc[n-]n2)no1 ZINC000554862745 942295301 /nfs/dbraw/zinc/29/53/01/942295301.db2.gz QNQFTDVGKVTPDM-DOMZBBRYSA-N 0 3 408.428 4.354 20 0 HIADHN CC(C)C[C@H](NC[C@@H](C)c1ccc(C(F)(F)F)cc1)c1nc(-c2nc[nH]n2)no1 ZINC000554862745 942295317 /nfs/dbraw/zinc/29/53/17/942295317.db2.gz QNQFTDVGKVTPDM-DOMZBBRYSA-N 0 3 408.428 4.354 20 0 HIADHN CC(C)C(=O)Nc1ccc(NC(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)cc1 ZINC000554872339 942302603 /nfs/dbraw/zinc/30/26/03/942302603.db2.gz PJMQXZZWNIKWMN-IBGZPJMESA-N 0 3 402.926 4.359 20 0 HIADHN COC(=O)C(C)(C)c1ccc(NC(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)cc1 ZINC000554888182 942308419 /nfs/dbraw/zinc/30/84/19/942308419.db2.gz KEFNRUUAFJUQPC-IBGZPJMESA-N 0 3 417.937 4.215 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1ccc2nnc(C(C)C)n2c1)c1ccsc1 ZINC000554951158 942330447 /nfs/dbraw/zinc/33/04/47/942330447.db2.gz RWGQFQBITVAYSM-QGZVFWFLSA-N 0 3 400.552 4.119 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1ccc2nnc(C(C)C)n2c1)c1ccsc1 ZINC000554951143 942330807 /nfs/dbraw/zinc/33/08/07/942330807.db2.gz RWGQFQBITVAYSM-KRWDZBQOSA-N 0 3 400.552 4.119 20 0 HIADHN O=C(Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)c1ncsc1C(F)(F)F ZINC000554960122 942334417 /nfs/dbraw/zinc/33/44/17/942334417.db2.gz ZGEXNMVEGUKUFM-AWEZNQCLSA-N 0 3 421.448 4.058 20 0 HIADHN CCN1CC[C@@H](NC(=O)c2cccc3nc(C)[nH]c32)[C@H]1c1ccc(Cl)c(F)c1 ZINC000555011882 942355748 /nfs/dbraw/zinc/35/57/48/942355748.db2.gz UZWLPZRJICMVKD-UYAOXDASSA-N 0 3 400.885 4.229 20 0 HIADHN CN1CCN(CCC(C)(C)NC(=O)Nc2ccc(-c3ccc(Cl)s3)nc2)CC1 ZINC000555034229 942364777 /nfs/dbraw/zinc/36/47/77/942364777.db2.gz DKPUEXLDRLQBQN-UHFFFAOYSA-N 0 3 421.998 4.001 20 0 HIADHN O=C(c1cccc(CN2CCCC2)c1)N1CCCC[C@H]1c1nnc(CC(F)(F)F)o1 ZINC000555106420 942386859 /nfs/dbraw/zinc/38/68/59/942386859.db2.gz UFXGUXNTDQUHFM-KRWDZBQOSA-N 0 3 422.451 4.138 20 0 HIADHN CC(C)N1CC[C@H](NCC(=O)NCc2cccc(Cl)c2)[C@H]1c1ccc(F)c(F)c1 ZINC000555125204 942392701 /nfs/dbraw/zinc/39/27/01/942392701.db2.gz IIQQUWQCSLQEQM-RBBKRZOGSA-N 0 3 421.919 4.048 20 0 HIADHN COC(=O)c1cccc(CN[C@@H]2CCN(C(C)(C)C)[C@H]2c2ccc(Cl)c(F)c2)n1 ZINC000555127119 942394504 /nfs/dbraw/zinc/39/45/04/942394504.db2.gz AMOVQDYTVNAAGF-QUCCMNQESA-N 0 3 419.928 4.364 20 0 HIADHN COc1cccc([C@H]2[C@H](NCc3ccc(Oc4ccccc4)nn3)CCN2C2CC2)c1 ZINC000555128658 942394951 /nfs/dbraw/zinc/39/49/51/942394951.db2.gz KGKHFVXKGCYYCN-NOZRDPDXSA-N 0 3 416.525 4.345 20 0 HIADHN COc1cccc([C@H]2[C@@H](NCC(=O)Nc3c(C)cc(C)cc3C)CCN2C2CC2)c1 ZINC000555130079 942394985 /nfs/dbraw/zinc/39/49/85/942394985.db2.gz QIBOEEYBQFXZIC-DHLKQENFSA-N 0 3 407.558 4.127 20 0 HIADHN CCN1CC[C@H](NCC(=O)Nc2ccccc2Cl)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000555132350 942396457 /nfs/dbraw/zinc/39/64/57/942396457.db2.gz KGDMQZLYVURTIP-PXNSSMCTSA-N 0 3 411.855 4.121 20 0 HIADHN COc1cccc([C@@H]2[C@@H](N[C@H](C)C(=O)Nc3cccc(C)c3C)CCN2C2CC2)c1 ZINC000555133577 942397322 /nfs/dbraw/zinc/39/73/22/942397322.db2.gz UNSVVMBOORAIAS-PUZWTLIVSA-N 0 3 407.558 4.207 20 0 HIADHN COc1cc(C)c([C@@H](C)NC(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)cc1OC ZINC000555132526 942397362 /nfs/dbraw/zinc/39/73/62/942397362.db2.gz VYKVQJBBXJPZNG-DNVCBOLYSA-N 0 3 419.953 4.329 20 0 HIADHN CN(C)C[C@H](NC(=O)N[C@@H]1CCO[C@H](c2ccccc2)C1)c1ccc(Cl)cc1 ZINC000555146807 942404335 /nfs/dbraw/zinc/40/43/35/942404335.db2.gz NRSYNZXXTXOFDF-HKBOAZHASA-N 0 3 401.938 4.162 20 0 HIADHN C[C@@H]1CC=CC[C@H]1C(=O)N(Cc1ccccc1Br)C1CCN(C)CC1 ZINC000555161547 942411398 /nfs/dbraw/zinc/41/13/98/942411398.db2.gz MGQRBAGBLILYNV-VQIMIIECSA-N 0 3 405.380 4.474 20 0 HIADHN CN(C)C[C@@H](NC(=O)Cc1ccc(Br)s1)c1ccc(Cl)cc1 ZINC000555229446 942437932 /nfs/dbraw/zinc/43/79/32/942437932.db2.gz JDHQMACZQVTGEH-CQSZACIVSA-N 0 3 401.757 4.126 20 0 HIADHN CN(C)C[C@H](NC(=O)CCc1ncc(-c2ccccc2F)o1)c1ccc(Cl)cc1 ZINC000555230148 942437984 /nfs/dbraw/zinc/43/79/84/942437984.db2.gz VVMGQMVZPNLWHY-IBGZPJMESA-N 0 3 415.896 4.486 20 0 HIADHN Cc1oc(-c2cccs2)nc1CC(=O)N[C@@H](CN(C)C)c1ccc(Cl)cc1 ZINC000555230797 942439037 /nfs/dbraw/zinc/43/90/37/942439037.db2.gz PRPCLNVIIOOEGG-KRWDZBQOSA-N 0 3 403.935 4.327 20 0 HIADHN COc1cc2c(cc1F)CC[C@H]2NC(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000555236340 942440486 /nfs/dbraw/zinc/44/04/86/942440486.db2.gz SKKXMOWVTNPZNQ-JOCHJYFZSA-N 0 3 411.521 4.128 20 0 HIADHN CC[C@H](N[C@@H](C)c1ccc(Br)cn1)[C@H](c1ccc(C)cc1)n1cncn1 ZINC000555378195 942503491 /nfs/dbraw/zinc/50/34/91/942503491.db2.gz VEFJHMLWDAGWBX-QSFXBCCZSA-N 0 3 414.351 4.463 20 0 HIADHN Clc1cccc(N2CCOCC2)c1CNC[C@H](c1ccco1)N1CCCCC1 ZINC000555509781 942614700 /nfs/dbraw/zinc/61/47/00/942614700.db2.gz ARSXPYWSJNTBHN-OAQYLSRUSA-N 0 3 403.954 4.086 20 0 HIADHN O=C(Nc1ccc(OC[C@@H](O)CN2CCc3ccccc3C2)cc1)C1CCCCC1 ZINC000555564003 942644658 /nfs/dbraw/zinc/64/46/58/942644658.db2.gz WJZKADWNFXRYGK-QHCPKHFHSA-N 0 3 408.542 4.003 20 0 HIADHN COc1cc(C[NH2+]C2(Cc3ccc(F)cc3)CCOCC2)cc(Br)c1[O-] ZINC000555596212 942659838 /nfs/dbraw/zinc/65/98/38/942659838.db2.gz NJIKMRGEHFZBIR-UHFFFAOYSA-N 0 3 424.310 4.184 20 0 HIADHN CSc1ccc([C@H](CNCc2cc3c(cc2OC(F)F)OCO3)N(C)C)cc1 ZINC000555644317 942684924 /nfs/dbraw/zinc/68/49/24/942684924.db2.gz CPKYXUPYKDCTCN-INIZCTEOSA-N 0 3 410.486 4.131 20 0 HIADHN COc1cccc(C2(F)CCN(C(=O)Nc3cc(CN(C)C)ccc3OC)CC2)c1 ZINC000555910975 942770613 /nfs/dbraw/zinc/77/06/13/942770613.db2.gz ZBAAHJWUSMWFDM-UHFFFAOYSA-N 0 3 415.509 4.258 20 0 HIADHN C[C@@H](NCc1cccc(NC(=O)CCN2CCOCC2)c1)c1cccc(C2CC2)c1 ZINC000556058589 942797851 /nfs/dbraw/zinc/79/78/51/942797851.db2.gz MTWMFQLPDYCPPW-LJQANCHMSA-N 0 3 407.558 4.076 20 0 HIADHN COc1cc([C@H](C)N[C@H]2CCc3sc(Br)cc32)ccc1OCCO ZINC000556060478 942799338 /nfs/dbraw/zinc/79/93/38/942799338.db2.gz IFLCTTGMISIUFD-FZMZJTMJSA-N 0 3 412.349 4.228 20 0 HIADHN CC[C@@H](N[C@H](C)c1cc(F)ccc1N1CCN(C)CC1)c1ccc(C(=O)OC)cc1 ZINC000556076141 942801681 /nfs/dbraw/zinc/80/16/81/942801681.db2.gz KFYQMXLHYUOQJI-VGOFRKELSA-N 0 3 413.537 4.166 20 0 HIADHN C[C@@H](N[C@@H]1CCCc2cc(S(N)(=O)=O)ccc21)c1ccc(-c2ccncc2)cc1 ZINC000556079414 942802860 /nfs/dbraw/zinc/80/28/60/942802860.db2.gz MKKMDKNGFYBDEJ-WAIKUNEKSA-N 0 3 407.539 4.124 20 0 HIADHN Cc1ccc(Cl)cc1NC(=O)[C@H](C)N[C@H]1CCN(C)[C@H]1c1ccc(F)c(F)c1 ZINC000556103329 942805904 /nfs/dbraw/zinc/80/59/04/942805904.db2.gz MREODEGKMNJTRZ-GMVOTWDCSA-N 0 3 407.892 4.289 20 0 HIADHN CS(=O)(=O)[C@@H]1CCC[C@@H](N[C@@H](c2ccccc2)c2ccc(Br)cc2)C1 ZINC000556263946 942828042 /nfs/dbraw/zinc/82/80/42/942828042.db2.gz IGXXNIFUKUGDNC-AQNXPRMDSA-N 0 3 422.388 4.484 20 0 HIADHN C[C@@H](c1ccccc1)n1cnnc1SC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000556324703 942841008 /nfs/dbraw/zinc/84/10/08/942841008.db2.gz QELQAPNOPRESLF-UGKGYDQZSA-N 0 3 408.571 4.271 20 0 HIADHN FC(F)(F)[C@@]1(c2nc(-c3nccc4[nH]ccc43)no2)CCN(Cc2ccccc2)C1 ZINC000556328342 942842485 /nfs/dbraw/zinc/84/24/85/942842485.db2.gz RUPQSQQRIRCZDW-FQEVSTJZSA-N 0 3 413.403 4.319 20 0 HIADHN CN(C(=O)c1ccc(NCc2coc(-c3ccccc3)n2)cc1)[C@@H]1CCCN(C)C1 ZINC000556337367 942844799 /nfs/dbraw/zinc/84/47/99/942844799.db2.gz NOBXRLUEORGPSS-JOCHJYFZSA-N 0 3 404.514 4.120 20 0 HIADHN COc1ccc(COC[C@H](O)CNCc2cnc(-c3ccc(Cl)cc3)s2)cc1 ZINC000556385036 942854288 /nfs/dbraw/zinc/85/42/88/942854288.db2.gz DBTSSTFDGPCRBM-GOSISDBHSA-N 0 3 418.946 4.139 20 0 HIADHN O=C(NCCNCc1cnc(-c2ccc(Cl)cc2)s1)c1c(F)cccc1F ZINC000556385351 942854326 /nfs/dbraw/zinc/85/43/26/942854326.db2.gz HLHQSQJLYXOQEG-UHFFFAOYSA-N 0 3 407.873 4.261 20 0 HIADHN CC(C)(C)c1ccc(CNCc2cccc(N3C(=O)N[C@@](C)(C4CC4)C3=O)c2)cc1 ZINC000556414009 942860284 /nfs/dbraw/zinc/86/02/84/942860284.db2.gz ZSFMLFODPUEMHL-VWLOTQADSA-N 0 3 405.542 4.499 20 0 HIADHN Cc1cc(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)c2nccc(C)c2c1 ZINC000556476353 942879811 /nfs/dbraw/zinc/87/98/11/942879811.db2.gz LWHONVAMKWDPOB-UHFFFAOYSA-N 0 3 405.464 4.387 20 0 HIADHN CCOc1cc(NC(=O)C(=O)N(CC)[C@@H]2CCN([C@@H](C)c3ccccc3)C2)ccc1C ZINC000556548869 942897175 /nfs/dbraw/zinc/89/71/75/942897175.db2.gz RKSBBFCESNJRCC-SIKLNZKXSA-N 0 3 423.557 4.016 20 0 HIADHN CC(=O)NCC1CCN(Cc2cn(-c3ccc(C)cc3)nc2-c2ccc(F)cc2)CC1 ZINC000556598303 942909934 /nfs/dbraw/zinc/90/99/34/942909934.db2.gz KSKTVWQDVONOLC-UHFFFAOYSA-N 0 3 420.532 4.335 20 0 HIADHN COCCO[C@@H]1CCN(Cc2cn(-c3ccc(C)cc3)nc2-c2ccc(F)cc2)C1 ZINC000556603919 942912288 /nfs/dbraw/zinc/91/22/88/942912288.db2.gz PCYHSKAPAANHBQ-HSZRJFAPSA-N 0 3 409.505 4.224 20 0 HIADHN COC(=O)[C@H](Cc1ccccc1)[C@H](C)NCc1nc2cc(C(F)(F)F)ccc2n1C ZINC000556610186 942915235 /nfs/dbraw/zinc/91/52/35/942915235.db2.gz VAYSRCGDAUJEAY-WMLDXEAASA-N 0 3 419.447 4.102 20 0 HIADHN OC[C@H](CN[C@H](c1ncc[nH]1)C1CCCCC1)Cc1cccc(Br)c1 ZINC000556879303 942948655 /nfs/dbraw/zinc/94/86/55/942948655.db2.gz RQTBTJORULYKKA-LPHOPBHVSA-N 0 3 406.368 4.234 20 0 HIADHN Cc1cc(Br)cc(C)c1N1CCC[C@@H](N[C@@H](C)c2nccnc2C)C1 ZINC000556924106 942968102 /nfs/dbraw/zinc/96/81/02/942968102.db2.gz FXSKDXCEWZHRKE-FUHWJXTLSA-N 0 3 403.368 4.484 20 0 HIADHN Cc1cc(Br)cc(C)c1N1CCC[C@@H](N[C@H](C)c2nccnc2C)C1 ZINC000556924107 942968463 /nfs/dbraw/zinc/96/84/63/942968463.db2.gz FXSKDXCEWZHRKE-SJLPKXTDSA-N 0 3 403.368 4.484 20 0 HIADHN Cc1cc(NC(=O)c2nc(C(C)C)oc2C)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000556940422 942974793 /nfs/dbraw/zinc/97/47/93/942974793.db2.gz ZKQBMRNLPYRKFK-IBGZPJMESA-N 0 3 407.518 4.311 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)[C@H](C)[C@@H]2OCCc3sccc32)N(C)C)cc1 ZINC000556990278 942988831 /nfs/dbraw/zinc/98/88/31/942988831.db2.gz KXFDFQJJIZFQGD-BUVFEPMLSA-N 0 3 416.587 4.204 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)c1cc2c(C)nn(C)c2nc1C)c1ccc(Cl)cc1 ZINC000557062348 943009828 /nfs/dbraw/zinc/00/98/28/943009828.db2.gz NGJIDXQQRLHYQI-FQEVSTJZSA-N 0 3 413.953 4.051 20 0 HIADHN O=C(CCC(=O)N1CC[C@]2(CCN(Cc3ccccc3)C2)C1)c1ccc2c(c1)CCC2 ZINC000557115802 943023458 /nfs/dbraw/zinc/02/34/58/943023458.db2.gz BYCZQTGZHNVJPK-MHZLTWQESA-N 0 3 416.565 4.263 20 0 HIADHN C[C@H](CC(=O)N1CC[C@@]2(CCN(Cc3ccccc3)C2)C1)C(=O)c1cccc(F)c1 ZINC000557127529 943026499 /nfs/dbraw/zinc/02/64/99/943026499.db2.gz PUZYWKZUJAEYPM-KBMIEXCESA-N 0 3 408.517 4.159 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)c2cc3cc(Br)ccc3o2)cc1 ZINC000557206291 943051209 /nfs/dbraw/zinc/05/12/09/943051209.db2.gz GMVBRGVEIXSEPX-QGZVFWFLSA-N 0 3 417.303 4.237 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)c2cc3ccccc3n2CC(F)(F)F)cc1 ZINC000557207179 943051728 /nfs/dbraw/zinc/05/17/28/943051728.db2.gz ZPZIJGIMGGWYMR-SFHVURJKSA-N 0 3 419.447 4.245 20 0 HIADHN CN1CCC(N(Cc2ccccc2Br)C(=O)c2sccc2F)CC1 ZINC000557408448 943109114 /nfs/dbraw/zinc/10/91/14/943109114.db2.gz ZIZCJWMKCZFHHY-UHFFFAOYSA-N 0 3 411.340 4.386 20 0 HIADHN Cc1ccn(C)c1C(=O)N(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000557449440 943133853 /nfs/dbraw/zinc/13/38/53/943133853.db2.gz RYYJLZVEMBDRAF-QHCPKHFHSA-N 0 3 402.542 4.036 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(C)c1C(=O)N[C@@H]1CCN(Cc2ccccc2)[C@H]1C ZINC000557487771 943162471 /nfs/dbraw/zinc/16/24/71/943162471.db2.gz XXUNOSORZXYNBW-HTAPYJJXSA-N 0 3 406.505 4.021 20 0 HIADHN COc1ccc([C@@H](Cc2ccc(F)cc2)N[C@@H](C)C(=O)NCc2ccccc2)cc1 ZINC000557513042 943180466 /nfs/dbraw/zinc/18/04/66/943180466.db2.gz XSTFBNKAORMRJE-MHECFPHRSA-N 0 3 406.501 4.413 20 0 HIADHN COc1ccc(CN(C)C(=O)CN[C@@H](C)c2ccc(-c3ccncc3)cc2)cc1OC ZINC000557560494 943208855 /nfs/dbraw/zinc/20/88/55/943208855.db2.gz SJYZIDLMVUQYKR-SFHVURJKSA-N 0 3 419.525 4.075 20 0 HIADHN O=C(C[C@@H](c1ncc[nH]1)c1ccccc1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000557584366 943220323 /nfs/dbraw/zinc/22/03/23/943220323.db2.gz JFSOFLOHXCXUGR-JOCHJYFZSA-N 0 3 420.582 4.162 20 0 HIADHN O=C(N[C@H](c1c[nH]c2ccccc21)C(F)(F)F)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000557629702 943238521 /nfs/dbraw/zinc/23/85/21/943238521.db2.gz CMJHDAWEPSKGOT-OXJNMPFZSA-N 0 3 416.447 4.195 20 0 HIADHN O=C(c1ccc2c3c(cccc31)CC2)N1CCC[C@@H](c2n[nH]cc2CN2CCCC2)C1 ZINC000557642806 943245791 /nfs/dbraw/zinc/24/57/91/943245791.db2.gz BKHCPLLGPWMSRC-HXUWFJFHSA-N 0 3 414.553 4.277 20 0 HIADHN C[C@H](C(=O)N1CCC[C@@H](c2n[nH]cc2CN2CCCC2)C1)c1cc2ccccc2o1 ZINC000557645891 943246502 /nfs/dbraw/zinc/24/65/02/943246502.db2.gz MGOSEXHLANJQBI-PKOBYXMFSA-N 0 3 406.530 4.261 20 0 HIADHN COc1ccc([C@H](C)NCCc2nc3cc(F)ccc3n2C)c(Br)c1 ZINC000557791609 943292680 /nfs/dbraw/zinc/29/26/80/943292680.db2.gz HQSSTSVFXDJXJV-LBPRGKRZSA-N 0 3 406.299 4.377 20 0 HIADHN C[C@H]1C[C@@H](N(C)S(=O)(=O)c2ccc(C(F)F)cc2)CCN1Cc1ccccc1 ZINC000557824741 943305194 /nfs/dbraw/zinc/30/51/94/943305194.db2.gz LBVDYYXPRMEDOQ-LPHOPBHVSA-N 0 3 408.514 4.298 20 0 HIADHN COCCCCN(Cc1ccccc1)C(=O)N[C@H]1CCN(Cc2ccccc2)[C@H]1C ZINC000557885528 943320912 /nfs/dbraw/zinc/32/09/12/943320912.db2.gz UFSOLRNIKDKKGM-URXFXBBRSA-N 0 3 409.574 4.288 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)NC[C@H]1CCCn2cc(C)nc21)c1ccc(Cl)cc1 ZINC000557921704 943329890 /nfs/dbraw/zinc/32/98/90/943329890.db2.gz QZYWCDXWPMUNOQ-QUCCMNQESA-N 0 3 417.985 4.105 20 0 HIADHN Cc1c(C(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)cnn1-c1ccccc1F ZINC000557936373 943333948 /nfs/dbraw/zinc/33/39/48/943333948.db2.gz DJWBRKQLZKUSDD-QHCPKHFHSA-N 0 3 424.520 4.140 20 0 HIADHN CC(C)Cc1ccc([C@H](CNC(=O)c2csc([C@H]3CCCO3)n2)N(C)C)cc1 ZINC000557983079 943346391 /nfs/dbraw/zinc/34/63/91/943346391.db2.gz RPZDDFSMEDEPJO-VQTJNVASSA-N 0 3 401.576 4.226 20 0 HIADHN CC1CCN([C@@H](CNC(=O)N2CCCC[C@H]2c2ccnn2C)c2cccs2)CC1 ZINC000558003567 943352144 /nfs/dbraw/zinc/35/21/44/943352144.db2.gz QSQPSRIDPCNPQM-PMACEKPBSA-N 0 3 415.607 4.191 20 0 HIADHN CN(CCCN(C)C(=O)c1ccc(COc2ccccc2)cc1)Cc1ccncc1 ZINC000558060335 943369020 /nfs/dbraw/zinc/36/90/20/943369020.db2.gz FYRGKROPRUWJMH-UHFFFAOYSA-N 0 3 403.526 4.255 20 0 HIADHN C[C@H](CC(=O)NCCc1ccccc1)NC1(c2cccc(Br)c2)CC1 ZINC000558086366 943376602 /nfs/dbraw/zinc/37/66/02/943376602.db2.gz SGRSAMDPBGTSDU-MRXNPFEDSA-N 0 3 401.348 4.165 20 0 HIADHN CC(C)n1cnnc1-c1ccccc1NC(=O)N[C@@H]1CCN(Cc2ccccc2)[C@H]1C ZINC000558199435 943428320 /nfs/dbraw/zinc/42/83/20/943428320.db2.gz CXIXUSNDXJEXGE-GHTZIAJQSA-N 0 3 418.545 4.311 20 0 HIADHN CC(C)n1cnnc1-c1ccccc1NC(=O)N[C@H]1CCN(Cc2ccccc2)[C@H]1C ZINC000558199444 943429097 /nfs/dbraw/zinc/42/90/97/943429097.db2.gz CXIXUSNDXJEXGE-RXVVDRJESA-N 0 3 418.545 4.311 20 0 HIADHN CCc1c(NC(=O)N[C@@H]2CCN(Cc3ccccc3)[C@@H]2C)cnn1-c1ccccc1 ZINC000558210602 943434041 /nfs/dbraw/zinc/43/40/41/943434041.db2.gz NQFJNJKGPQMGSC-WIYYLYMNSA-N 0 3 403.530 4.219 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)Nc3ncsc3C(C)C)CC2)c1 ZINC000558224310 943444103 /nfs/dbraw/zinc/44/41/03/943444103.db2.gz LLZOGFCSMCYNPO-UHFFFAOYSA-N 0 3 415.607 4.299 20 0 HIADHN COC[C@H](NC1CCN(C(=O)c2cc(Cl)c[nH]2)CC1)c1cccc(Cl)c1F ZINC000558257866 943462667 /nfs/dbraw/zinc/46/26/67/943462667.db2.gz ZAUWFDMLIBHBCD-KRWDZBQOSA-N 0 3 414.308 4.043 20 0 HIADHN O=C(CCC(F)(F)F)N1CCC[C@@H](N[C@H]2CCCOc3ccc(Cl)cc32)C1 ZINC000558259708 943464192 /nfs/dbraw/zinc/46/41/92/943464192.db2.gz WKUJPURXVMPAOA-ZBFHGGJFSA-N 0 3 404.860 4.477 20 0 HIADHN O=C(CCC(F)(F)F)N1CCC[C@@H](N[C@@H]2CCCOc3ccc(Cl)cc32)C1 ZINC000558259704 943464580 /nfs/dbraw/zinc/46/45/80/943464580.db2.gz WKUJPURXVMPAOA-GDBMZVCRSA-N 0 3 404.860 4.477 20 0 HIADHN C[C@H](N[C@@H]1CCCN(S(=O)(=O)c2cccs2)C1)c1ccccc1C(F)(F)F ZINC000558259617 943464831 /nfs/dbraw/zinc/46/48/31/943464831.db2.gz UQBRVYPVFFSAEK-UONOGXRCSA-N 0 3 418.506 4.271 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)Nc2ccccc2N2CCCC2)N(C)C)cc1 ZINC000558272323 943473338 /nfs/dbraw/zinc/47/33/38/943473338.db2.gz FZXSCCRJSYBMRV-HSZRJFAPSA-N 0 3 410.562 4.498 20 0 HIADHN CN(C)C[C@@H](NC(=O)Nc1cc(F)ccc1OCC(F)(F)F)c1ccc(F)cc1 ZINC000558288825 943484800 /nfs/dbraw/zinc/48/48/00/943484800.db2.gz FGZXEWFYNGLBCW-MRXNPFEDSA-N 0 3 417.378 4.330 20 0 HIADHN CCC(=O)Nc1ccc(Cl)c(NC(=O)N[C@@H](CN(C)C)c2ccc(F)cc2)c1 ZINC000558290073 943486022 /nfs/dbraw/zinc/48/60/22/943486022.db2.gz DEGNPICETWUJLX-SFHVURJKSA-N 0 3 406.889 4.252 20 0 HIADHN CCC(C)(C)NC(=O)c1ccc(NC(=O)N[C@H](CN(C)C)c2ccc(F)cc2)cc1 ZINC000558297925 943490900 /nfs/dbraw/zinc/49/09/00/943490900.db2.gz YAKANBJKZYYHEY-HXUWFJFHSA-N 0 3 414.525 4.169 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)Nc1ccc(C(=O)N[C@H](C)CC)cc1C ZINC000558308474 943497461 /nfs/dbraw/zinc/49/74/61/943497461.db2.gz KPWJGUWVICXCGH-LJQANCHMSA-N 0 3 402.583 4.253 20 0 HIADHN C[C@H](NC(=O)Nc1cccc(NC(=O)c2ccoc2)c1)[C@H](c1ccccc1)N(C)C ZINC000558315782 943502098 /nfs/dbraw/zinc/50/20/98/943502098.db2.gz MPECWLOJVPQKDE-HRAATJIYSA-N 0 3 406.486 4.345 20 0 HIADHN C[C@H](NC(=O)Nc1ccccc1CC(=O)OC(C)(C)C)[C@@H](c1ccccc1)N(C)C ZINC000558380111 943536416 /nfs/dbraw/zinc/53/64/16/943536416.db2.gz HOZZPIACKLJEHF-JTSKRJEESA-N 0 3 411.546 4.384 20 0 HIADHN C[C@H](N[C@@H]1c2ccccc2CC12CCOCC2)C(=O)N1c2ccccc2CC[C@@H]1C ZINC000558483920 943572191 /nfs/dbraw/zinc/57/21/91/943572191.db2.gz MHSGLBAFNAWRBD-AXHZCLLHSA-N 0 3 404.554 4.427 20 0 HIADHN C[C@@H]1CC[C@@H](CCC(=O)N(Cc2ccccc2Br)C2CCN(C)CC2)O1 ZINC000558610453 943617051 /nfs/dbraw/zinc/61/70/51/943617051.db2.gz VFWDWYRIDRDYFG-APWZRJJASA-N 0 3 423.395 4.220 20 0 HIADHN CC[C@H](N[C@@H](C)c1ccc(Br)cn1)[C@H]1CN(Cc2ccccc2)CCO1 ZINC000558741181 943636935 /nfs/dbraw/zinc/63/69/35/943636935.db2.gz VWECNBUSAAHTBL-NBHGPNQESA-N 0 3 418.379 4.174 20 0 HIADHN Cc1c(NC(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)cccc1NC(=O)N(C)C ZINC000558769036 943653367 /nfs/dbraw/zinc/65/33/67/943653367.db2.gz YBQJSYQHVTVEJG-LJQANCHMSA-N 0 3 417.941 4.166 20 0 HIADHN Cc1nc(C(F)(F)F)ccc1NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000558839334 943689320 /nfs/dbraw/zinc/68/93/20/943689320.db2.gz WJLRYHRNJJCNFV-UHFFFAOYSA-N 0 3 424.389 4.336 20 0 HIADHN CC(C)c1noc(Cc2ccc(NC(=O)NC[C@H](C)N(C)Cc3ccccc3)cc2)n1 ZINC000558847057 943696264 /nfs/dbraw/zinc/69/62/64/943696264.db2.gz MIAMTVPMLCYSMI-SFHVURJKSA-N 0 3 421.545 4.426 20 0 HIADHN CC(C)N1CC[C@H](N[C@@H](C)C(=O)Nc2cc(F)ccc2F)[C@H]1c1ccc(F)c(F)c1 ZINC000558890973 943723620 /nfs/dbraw/zinc/72/36/20/943723620.db2.gz BNVAYLHLZPDUKJ-JBZDTAIVSA-N 0 3 423.454 4.384 20 0 HIADHN CC(C)N1CC[C@@H](NCC(=O)N[C@@H](C)c2ccc(F)cc2)[C@H]1c1ccc(F)c(F)c1 ZINC000558895658 943729082 /nfs/dbraw/zinc/72/90/82/943729082.db2.gz LBOYSYIRZDDCHQ-PNDGYVOYSA-N 0 3 419.491 4.095 20 0 HIADHN CSc1cccc(NC(=O)CN[C@H]2CCN(C(C)C)[C@@H]2c2ccc(F)c(F)c2)c1 ZINC000558902639 943737499 /nfs/dbraw/zinc/73/74/99/943737499.db2.gz SRJXEXPKYYGJFP-RBBKRZOGSA-N 0 3 419.541 4.439 20 0 HIADHN CC(=O)CCc1ccc(O[C@@H](C)C(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)cc1 ZINC000558973570 943778091 /nfs/dbraw/zinc/77/80/91/943778091.db2.gz QRFDZUSJFPHTDX-HTAPYJJXSA-N 0 3 416.949 4.048 20 0 HIADHN C[C@@H](NCC1CC(c2ccccc2)C1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000558976789 943781206 /nfs/dbraw/zinc/78/12/06/943781206.db2.gz WNSMVEIUFOAMHI-DNOWBOINSA-N 0 3 413.370 4.485 20 0 HIADHN C[C@@H]1C[C@H](N(C)S(=O)(=O)Cc2ccc(C(F)F)cc2)CCN1Cc1ccccc1 ZINC000559051633 943816292 /nfs/dbraw/zinc/81/62/92/943816292.db2.gz JHBVTZROGHLNNR-DYESRHJHSA-N 0 3 422.541 4.439 20 0 HIADHN COc1ccccc1SCc1nnc(N2CCN(C)[C@@H](C(C)C)C2)n1CC(C)C ZINC000559083302 943830739 /nfs/dbraw/zinc/83/07/39/943830739.db2.gz JCZUYDUVIVAEOP-GOSISDBHSA-N 0 3 417.623 4.011 20 0 HIADHN COCCc1ccc(OC[C@@H](O)CNC2(c3ccc(Cl)c(Cl)c3)CC2)cc1 ZINC000559130157 943850129 /nfs/dbraw/zinc/85/01/29/943850129.db2.gz PAVHZCKNTVFDOS-KRWDZBQOSA-N 0 3 410.341 4.201 20 0 HIADHN CC[C@H](c1nnc(N2CCN(C3CCCC3)CC2)n1C[C@H]1CCCO1)c1ccccc1 ZINC000559137634 943851700 /nfs/dbraw/zinc/85/17/00/943851700.db2.gz KUDMOOIILJDLQY-PKTZIBPZSA-N 0 3 423.605 4.064 20 0 HIADHN c1csc(Cn2c(-c3c[nH]c4ccccc34)nnc2N2CCN(CC3CC3)CC2)c1 ZINC000559161135 943856412 /nfs/dbraw/zinc/85/64/12/943856412.db2.gz PHIWMWILGPWMHT-UHFFFAOYSA-N 0 3 418.570 4.068 20 0 HIADHN O=C(NCCN1CCCC1)c1ccc(NCc2ccc(Cl)c3cccnc23)cc1 ZINC000559227493 943880139 /nfs/dbraw/zinc/88/01/39/943880139.db2.gz QZESRHXTDLWEJR-UHFFFAOYSA-N 0 3 408.933 4.326 20 0 HIADHN C[C@@H](NCc1nc2cc(Br)ccc2o1)C1CCN(CC(F)(F)F)CC1 ZINC000559231797 943881736 /nfs/dbraw/zinc/88/17/36/943881736.db2.gz ASKSJVGBJMUAHG-LLVKDONJSA-N 0 3 420.273 4.343 20 0 HIADHN C[C@@H](NCc1nnc(-c2cccc(Cl)c2)o1)C1CCN(CC(F)(F)F)CC1 ZINC000559233167 943882452 /nfs/dbraw/zinc/88/24/52/943882452.db2.gz XRANZKMMGMSLLW-GFCCVEGCSA-N 0 3 402.848 4.142 20 0 HIADHN Cc1csc(CCCC(=O)NC2CCN(CCOc3ccc(Cl)cc3)CC2)n1 ZINC000559277322 943888935 /nfs/dbraw/zinc/88/89/35/943888935.db2.gz JIPLMMMBQSSRHL-UHFFFAOYSA-N 0 3 421.994 4.087 20 0 HIADHN CCc1nc2ccccc2c(C(=O)N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)c1C ZINC000559279388 943889644 /nfs/dbraw/zinc/88/96/44/943889644.db2.gz WOCGCIYMGLMFIJ-HDICACEKSA-N 0 3 409.574 4.067 20 0 HIADHN C[C@H](NCc1ccc(OCc2nccn2C)cc1)c1ccc(-n2cccn2)c(F)c1 ZINC000559335088 943898394 /nfs/dbraw/zinc/89/83/94/943898394.db2.gz XDTKLTJWQZQNIQ-KRWDZBQOSA-N 0 3 405.477 4.175 20 0 HIADHN COc1ccc(CNCCc2ccc(Cl)c(OC)c2)c(Br)c1O ZINC000559351337 943904746 /nfs/dbraw/zinc/90/47/46/943904746.db2.gz IRJRCFVPIMQXNM-UHFFFAOYSA-N 0 3 400.700 4.158 20 0 HIADHN CCO[C@@H]1C[C@H](NCc2cn(-c3ccccc3)nc2-c2ccc(C)o2)[C@@H]1n1cccn1 ZINC000559360746 943909506 /nfs/dbraw/zinc/90/95/06/943909506.db2.gz QUPXKPYBDHJVFG-FJIJXJHWSA-N 0 3 417.513 4.146 20 0 HIADHN Cc1nc(NC(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)sc1C(F)(F)F ZINC000559734276 944040578 /nfs/dbraw/zinc/04/05/78/944040578.db2.gz SYLZEUHPJKCSLJ-UHFFFAOYSA-N 0 3 412.481 4.253 20 0 HIADHN Cc1cccc(-c2cccc(CN[C@@H]3CCCc4cc(S(N)(=O)=O)ccc43)c2)c1 ZINC000559752777 944044015 /nfs/dbraw/zinc/04/40/15/944044015.db2.gz UMLFCHDKCTZOHH-XMMPIXPASA-N 0 3 406.551 4.477 20 0 HIADHN COC(=O)CCC[C@@H]1CCC[C@H](N[C@H](c2nc(-c3cccnc3)no2)C(C)C)C1 ZINC000559752334 944044411 /nfs/dbraw/zinc/04/44/11/944044411.db2.gz RLQGFTCQOFVREO-QRFRQXIXSA-N 0 3 400.523 4.320 20 0 HIADHN C[C@@H](NC1CCN(Cc2coc(-c3ccccc3)n2)CC1)c1cn2ccccc2n1 ZINC000559899521 944079946 /nfs/dbraw/zinc/07/99/46/944079946.db2.gz CVSPPKXMDJLTPT-GOSISDBHSA-N 0 3 401.514 4.305 20 0 HIADHN C[C@H](NCCCS(=O)(=O)c1ccc(Cl)cc1)c1cnn(Cc2ccccc2)c1 ZINC000559919836 944084822 /nfs/dbraw/zinc/08/48/22/944084822.db2.gz UAZSARNIWOQRLQ-KRWDZBQOSA-N 0 3 417.962 4.099 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)Nc2ccc(Oc3cccnc3)nc2)C1 ZINC000559966156 944102851 /nfs/dbraw/zinc/10/28/51/944102851.db2.gz NZNZMIWHGFSGHM-XLIONFOSSA-N 0 3 403.486 4.226 20 0 HIADHN CN(C(=O)c1ccc(NCc2csc(Br)c2)cc1)[C@H]1CCCN(C)C1 ZINC000559997955 944120951 /nfs/dbraw/zinc/12/09/51/944120951.db2.gz JZBZABCZDNRXLG-KRWDZBQOSA-N 0 3 422.392 4.289 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NCc2ccc(-n3cnc4ccccc43)cc2)cc1 ZINC000560072508 944149116 /nfs/dbraw/zinc/14/91/16/944149116.db2.gz WMDZYFGCEFTLLM-XMMPIXPASA-N 0 3 400.526 4.427 20 0 HIADHN COc1ccc([C@H](CN(C)C)NCc2ccc(-n3cnc4ccccc43)cc2)cc1 ZINC000560072505 944149221 /nfs/dbraw/zinc/14/92/21/944149221.db2.gz WMDZYFGCEFTLLM-DEOSSOPVSA-N 0 3 400.526 4.427 20 0 HIADHN Cc1ccc2[nH]c(CNCc3cccc(N4C(=O)N[C@](C)(C5CC5)C4=O)c3)cc2c1C ZINC000560075079 944150145 /nfs/dbraw/zinc/15/01/45/944150145.db2.gz FCCUWJYSHRYZAA-RUZDIDTESA-N 0 3 416.525 4.299 20 0 HIADHN C[C@H](CCN1CCN(C)CC1)NC(=O)N[C@H]1CCCCC[C@H]1c1ccc(Cl)cc1 ZINC000560105296 944161361 /nfs/dbraw/zinc/16/13/61/944161361.db2.gz CATGQZFPJSQFIA-COPCDDAFSA-N 0 3 421.029 4.082 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@@H](C)NCc2ccc(C(F)(F)F)cn2)CC1 ZINC000560164601 944184212 /nfs/dbraw/zinc/18/42/12/944184212.db2.gz IWICCUFECZXJIP-OAHLLOKOSA-N 0 3 410.459 4.232 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)[C@@H](C)Cc2cccc(C(F)(F)F)c2)cc1 ZINC000560252749 944207886 /nfs/dbraw/zinc/20/78/86/944207886.db2.gz WMPGIUASABZDOG-MGPUTAFESA-N 0 3 408.464 4.312 20 0 HIADHN CCOC(=O)COc1ccc(CN[C@@H](c2cncc(Br)c2)C2CC2)cc1 ZINC000560266838 944212630 /nfs/dbraw/zinc/21/26/30/944212630.db2.gz LPGPLFOGDSYICZ-HXUWFJFHSA-N 0 3 419.319 4.027 20 0 HIADHN C[C@@H]1Cc2ccc(F)cc2[C@H]1NCc1cccc(N2C(=O)N[C@](C)(C3CC3)C2=O)c1 ZINC000560269674 944213900 /nfs/dbraw/zinc/21/39/00/944213900.db2.gz WSISLSAGCDYCMN-PNPIFTBSSA-N 0 3 407.489 4.074 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@H](C)N[C@@H](C)c2cc(C(=O)OC)cs2)CC1 ZINC000560528249 944242430 /nfs/dbraw/zinc/24/24/30/944242430.db2.gz OJGCDKGMPGDZPA-HOTGVXAUSA-N 0 3 419.566 4.228 20 0 HIADHN COc1cc(Br)ccc1[C@@H](C)N[C@H](C)c1ccccc1-n1ccnn1 ZINC000560549357 944250349 /nfs/dbraw/zinc/25/03/49/944250349.db2.gz MDMAPOPEAPAWNY-ZIAGYGMSSA-N 0 3 401.308 4.450 20 0 HIADHN Brc1ccc(-c2ncc(CN3CCC(O[C@H]4CCOC4)CC3)s2)cc1 ZINC000560564489 944255672 /nfs/dbraw/zinc/25/56/72/944255672.db2.gz WAJXXPNPAGEOPN-KRWDZBQOSA-N 0 3 423.376 4.343 20 0 HIADHN Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)NC[C@H](N1CCOCC1)C(F)(F)F ZINC000560580758 944262497 /nfs/dbraw/zinc/26/24/97/944262497.db2.gz JRVVMDSEYPNEHK-PBHICJAKSA-N 0 3 413.509 4.341 20 0 HIADHN CS(=O)(=O)C1(CN[C@@H]2CCCc3nc(-c4ccccc4F)sc32)CCCC1 ZINC000560580840 944262589 /nfs/dbraw/zinc/26/25/89/944262589.db2.gz JSZZKPJOHUBIFO-MRXNPFEDSA-N 0 3 408.564 4.274 20 0 HIADHN C[C@@H](N[C@@H](CCO)c1ccc(Cl)c(Cl)c1)c1ccc(NS(C)(=O)=O)cc1 ZINC000560584277 944263235 /nfs/dbraw/zinc/26/32/35/944263235.db2.gz ABHSVFUTUOIFNB-XIKOKIGWSA-N 0 3 417.358 4.139 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1nc(C2CC2)oc1C ZINC000560600142 944269467 /nfs/dbraw/zinc/26/94/67/944269467.db2.gz UCAGVPXZMMMIAG-IBGZPJMESA-N 0 3 405.502 4.065 20 0 HIADHN O=C(CCNCc1cncc(Br)c1)Nc1cc(Cl)cc(Cl)c1 ZINC000560612436 944274853 /nfs/dbraw/zinc/27/48/53/944274853.db2.gz YDOGDPFMTQVKKN-UHFFFAOYSA-N 0 3 403.107 4.269 20 0 HIADHN COc1cccc(C2=CCN(C(=O)[C@@H]3CN(Cc4ccccc4)CCC3(F)F)C2)c1 ZINC000560625588 944278760 /nfs/dbraw/zinc/27/87/60/944278760.db2.gz VQZPLUQRMDSLDC-QFIPXVFZSA-N 0 3 412.480 4.078 20 0 HIADHN CCCN(C)[C@H](CNC(=O)c1cc2nccnc2cc1F)c1ccc(Cl)cc1 ZINC000560707528 944301727 /nfs/dbraw/zinc/30/17/27/944301727.db2.gz SHHGCOQGDFRACR-HXUWFJFHSA-N 0 3 400.885 4.235 20 0 HIADHN Cc1cc(Br)ccc1NC(=O)CN[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000560890991 944365215 /nfs/dbraw/zinc/36/52/15/944365215.db2.gz HFEWZRBYIZRJML-LPHOPBHVSA-N 0 3 416.363 4.121 20 0 HIADHN O=S(=O)(Cc1ccccc1CN[C@@H]1CCc2ccc(Cl)cc21)N1CCCC1 ZINC000560908860 944368169 /nfs/dbraw/zinc/36/81/69/944368169.db2.gz KVJNASRNYGYULR-OAQYLSRUSA-N 0 3 404.963 4.043 20 0 HIADHN CN(C)[C@H](CNc1cncc(NC[C@H](c2ccsc2)N(C)C)n1)c1ccsc1 ZINC000561143459 944480467 /nfs/dbraw/zinc/48/04/67/944480467.db2.gz TYBKGFNWHQCTST-QZTJIDSGSA-N 0 3 416.620 4.029 20 0 HIADHN CCCN(CCN1CCCC1)C(=O)c1ccc(C)c(NC(=O)c2ccccc2F)c1 ZINC000561202343 944513539 /nfs/dbraw/zinc/51/35/39/944513539.db2.gz XXOWKIDDCWYJIT-UHFFFAOYSA-N 0 3 411.521 4.334 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)C[C@H](c2ncc[nH]2)c2ccccc2)N2CCCC2)cc1 ZINC000561206893 944514863 /nfs/dbraw/zinc/51/48/63/944514863.db2.gz YMTYIHKHFYXQOU-XZOQPEGZSA-N 0 3 402.542 4.193 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)c1cccc(C(=O)N(C)CC(C)(C)C)c1 ZINC000561263633 944532442 /nfs/dbraw/zinc/53/24/42/944532442.db2.gz YOXUKNKVRDFCDN-UHFFFAOYSA-N 0 3 401.595 4.143 20 0 HIADHN Cc1cc(NC(=O)N[C@@H](CN2CCCC2)c2ccccc2)ccc1C(=O)NC(C)C ZINC000561332337 944553856 /nfs/dbraw/zinc/55/38/56/944553856.db2.gz GZOSYGZXBBMGPI-QFIPXVFZSA-N 0 3 408.546 4.092 20 0 HIADHN CCOc1c(Br)cc(CN[C@H]2CCCc3[nH]c(=O)ccc32)cc1OC ZINC000561453062 944610219 /nfs/dbraw/zinc/61/02/19/944610219.db2.gz CQLAASYZLJHWND-HNNXBMFYSA-N 0 3 407.308 4.124 20 0 HIADHN COc1ccc2cc(-c3nn(-c4ccccc4)cc3CNC[C@@H](O)C(F)F)ccc2c1 ZINC000561527009 944656522 /nfs/dbraw/zinc/65/65/22/944656522.db2.gz GJIOIKVCWUZUTC-JOCHJYFZSA-N 0 3 423.463 4.417 20 0 HIADHN C[C@@H]1CN(C(=O)c2ccc(Sc3ccccc3Cl)nn2)CCN(C2CCC2)C1 ZINC000561533051 944658997 /nfs/dbraw/zinc/65/89/97/944658997.db2.gz BGKPUVVBIYLNFP-HNNXBMFYSA-N 0 3 416.978 4.228 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)CCc1ccc(Br)cc1OC)c1ccco1 ZINC000561609990 944705462 /nfs/dbraw/zinc/70/54/62/944705462.db2.gz GNQLIZBRNCRUDY-YOEHRIQHSA-N 0 3 423.351 4.229 20 0 HIADHN FC(F)(F)c1ccn([C@H]2CCCN(Cc3ccc(OC[C@@H]4CCCO4)cc3)C2)n1 ZINC000561625185 944713890 /nfs/dbraw/zinc/71/38/90/944713890.db2.gz CQJFFGOFLQSCQQ-HKUYNNGSSA-N 0 3 409.452 4.297 20 0 HIADHN CC(=O)Nc1cc(C(=O)N[C@@H]2CCN(Cc3ccccc3)[C@H]2C)cc(C(F)(F)F)c1 ZINC000561624120 944714266 /nfs/dbraw/zinc/71/42/66/944714266.db2.gz LHADDBNBNNMOKE-VBKZILBWSA-N 0 3 419.447 4.057 20 0 HIADHN CCO[C@@H](C)c1ncc(C(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)s1 ZINC000561651580 944729318 /nfs/dbraw/zinc/72/93/18/944729318.db2.gz KTPDCBRRQQNDFF-MAUKXSAKSA-N 0 3 405.564 4.061 20 0 HIADHN Cc1noc2nc(C3CC3)cc(C(=O)NC[C@H](c3ccc(OC(C)C)cc3)N(C)C)c12 ZINC000561657880 944732747 /nfs/dbraw/zinc/73/27/47/944732747.db2.gz QZVVMWFJVSOLPH-OAQYLSRUSA-N 0 3 422.529 4.229 20 0 HIADHN Cc1oc(-c2cccc(C(F)(F)F)c2)nc1C(=O)N1CCN([C@@H]2C[C@@H]2C)C[C@H](C)C1 ZINC000561746511 944775607 /nfs/dbraw/zinc/77/56/07/944775607.db2.gz KUJJKLZJRSQVNV-SUNYJGFJSA-N 0 3 421.463 4.471 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3ccccc3OC3CC3)c(OCC)c2)CC1 ZINC000561792435 944797822 /nfs/dbraw/zinc/79/78/22/944797822.db2.gz PBIMOWQMDNWFDQ-UHFFFAOYSA-N 0 3 423.557 4.411 20 0 HIADHN COc1nc(C)cc(C)c1CN1CCC[C@H](c2nnc3ccc(C(F)(F)F)cn32)C1 ZINC000561861823 944825224 /nfs/dbraw/zinc/82/52/24/944825224.db2.gz SSMVVCUEBIGDBF-HNNXBMFYSA-N 0 3 419.451 4.148 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccnc2)C1)N1CC[C@@H](Sc2cccc(Cl)c2)C1 ZINC000561888122 944838547 /nfs/dbraw/zinc/83/85/47/944838547.db2.gz ORUXIALLVJPLBL-WIYYLYMNSA-N 0 3 415.990 4.340 20 0 HIADHN CN1CC[C@H](NCC(=O)N(Cc2ccccc2)C(C)(C)C)[C@H]1c1ccc(F)c(F)c1 ZINC000562045972 944909244 /nfs/dbraw/zinc/90/92/44/944909244.db2.gz FOFCVRGECRCTQM-JTHBVZDNSA-N 0 3 415.528 4.127 20 0 HIADHN COc1ccc(CN2CC[C@@H](N[C@H](C)c3cccc4ccccc43)C2=O)c(OC)c1 ZINC000562047573 944910858 /nfs/dbraw/zinc/91/08/58/944910858.db2.gz LFPROPZAGMTDSL-UZUQRXQVSA-N 0 3 404.510 4.309 20 0 HIADHN Cc1ccccc1CN1CCC(NC(=O)C2(c3cccc(Cl)c3)CC(=O)C2)CC1 ZINC000562066863 944919574 /nfs/dbraw/zinc/91/95/74/944919574.db2.gz WGMLRFOECCPQNH-UHFFFAOYSA-N 0 3 410.945 4.030 20 0 HIADHN Cc1ccc2nc(NC(=O)CN[C@@H]3c4ccccc4CC34CCOCC4)sc2c1 ZINC000562070788 944921662 /nfs/dbraw/zinc/92/16/62/944921662.db2.gz VHUQCBWLBDFSGZ-OAQYLSRUSA-N 0 3 407.539 4.227 20 0 HIADHN O=C(CN[C@@H]1c2ccccc2CC12CCOCC2)Nc1ccc(C(F)(F)F)cc1 ZINC000562075141 944924497 /nfs/dbraw/zinc/92/44/97/944924497.db2.gz UVPMYWZUNLJGJQ-HXUWFJFHSA-N 0 3 404.432 4.328 20 0 HIADHN CC(=O)NC1CCC(N[C@@H](C)c2ccc(Br)cc2Br)CC1 ZINC000562088114 944931533 /nfs/dbraw/zinc/93/15/33/944931533.db2.gz XXIKRWXTKQUWSR-FNBIGBAISA-N 0 3 418.173 4.310 20 0 HIADHN CCCNC(=O)c1ccc(NC(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)cc1Cl ZINC000562140007 944967642 /nfs/dbraw/zinc/96/76/42/944967642.db2.gz OJBFBUMNOLKYFT-QRWLVFNGSA-N 0 3 416.953 4.293 20 0 HIADHN CN(C)[C@@H](CNC(=O)N(C)Cc1ccc(OCC(F)(F)F)cc1)c1ccccc1 ZINC000562181200 945006822 /nfs/dbraw/zinc/00/68/22/945006822.db2.gz QFJXQECENQTEKS-IBGZPJMESA-N 0 3 409.452 4.072 20 0 HIADHN C[C@@H](NC(=O)NCc1cccc(COCc2ccco2)c1)[C@H](c1ccccc1)N(C)C ZINC000562248030 945043182 /nfs/dbraw/zinc/04/31/82/945043182.db2.gz JKJOKBHBGQATKO-NTKDMRAZSA-N 0 3 421.541 4.487 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)Nc1cc(Cl)c(F)c(C(=O)OC)c1)c1ccco1 ZINC000562265697 945049919 /nfs/dbraw/zinc/04/99/19/945049919.db2.gz LKMRQPYTYAVXMD-ABAIWWIYSA-N 0 3 411.861 4.110 20 0 HIADHN CC(C)[C@@H](NC1CCC2(CC1)c1ccccc1NC2=O)c1nc(-c2ccncc2)no1 ZINC000562315995 945058215 /nfs/dbraw/zinc/05/82/15/945058215.db2.gz JBSCGBJOOBFWFU-STWKMJTMSA-N 0 3 417.513 4.251 20 0 HIADHN C[C@H](N[C@H]1CCN(C)[C@H]1c1ccc(Cl)c(F)c1)C(=O)Nc1ccccc1Cl ZINC000564069895 945370564 /nfs/dbraw/zinc/37/05/64/945370564.db2.gz KKGVNRUCNVSGSH-NXXSPTCGSA-N 0 3 410.320 4.495 20 0 HIADHN CC[C@H](C)n1ncc(C(=O)NC[C@@H](c2ccc(SC)cc2)N(C)C)c1C1CC1 ZINC000564092502 945376061 /nfs/dbraw/zinc/37/60/61/945376061.db2.gz FXKMUDFZELMIJX-YWZLYKJASA-N 0 3 400.592 4.486 20 0 HIADHN CSc1ccc([C@@H](CNC(=O)c2ccc(-c3nc(C4CC4)no3)cc2)N(C)C)cc1 ZINC000564094965 945376838 /nfs/dbraw/zinc/37/68/38/945376838.db2.gz PNZYDEZCVLJUQT-HXUWFJFHSA-N 0 3 422.554 4.369 20 0 HIADHN CSc1ccc([C@@H](CNC(=O)c2cc(C)n(Cc3ccccn3)c2C)N(C)C)cc1 ZINC000564095813 945377573 /nfs/dbraw/zinc/37/75/73/945377573.db2.gz YVEDBBKEBCUXMI-HSZRJFAPSA-N 0 3 422.598 4.303 20 0 HIADHN C[C@H](c1ccccc1F)N1CCC[C@@H](NCc2ccc(-c3cnn(C)c3)s2)C1=O ZINC000564229606 945443683 /nfs/dbraw/zinc/44/36/83/945443683.db2.gz FAHAUENFNDXQQS-FOIQADDNSA-N 0 3 412.534 4.130 20 0 HIADHN CC(C)N1CC[C@H](NCC(=O)N(C)[C@H](C)c2ccccc2)[C@H]1c1ccc(F)c(F)c1 ZINC000564232160 945448352 /nfs/dbraw/zinc/44/83/52/945448352.db2.gz UWIZCYCKCVOXTN-OUPRXKBMSA-N 0 3 415.528 4.298 20 0 HIADHN COC(=O)c1cc(CN[C@H](Cc2ccccc2C)c2ccc(OC)c(OC)c2)cn1C ZINC000564294759 945504879 /nfs/dbraw/zinc/50/48/79/945504879.db2.gz JXVPDRLSOUTGRR-OAQYLSRUSA-N 0 3 422.525 4.211 20 0 HIADHN Fc1ccc(OC(F)F)cc1-c1noc([C@@H]2CCCN(Cc3cccnc3)C2)n1 ZINC000564360053 945526732 /nfs/dbraw/zinc/52/67/32/945526732.db2.gz ZFHMSGNSGXUDEP-CQSZACIVSA-N 0 3 404.392 4.252 20 0 HIADHN Cn1c(-c2ccccc2)nnc1N1CCCN(Cc2ccc(C(F)(F)F)cc2)CC1 ZINC000564375463 945539446 /nfs/dbraw/zinc/53/94/46/945539446.db2.gz ARZPYGOLZLNHRF-UHFFFAOYSA-N 0 3 415.463 4.213 20 0 HIADHN O=c1[nH]c2ccccc2n1CCCN[C@H](CO)c1ccc(Cl)cc1C(F)(F)F ZINC000564390240 945549183 /nfs/dbraw/zinc/54/91/83/945549183.db2.gz RJYPBDGCBMJNPI-MRXNPFEDSA-N 0 3 413.827 4.127 20 0 HIADHN CCc1ccc([C@H](C)NC(=O)[C@@H](C)N[C@@H]2c3ccccc3CC23CCOCC3)cc1 ZINC000564407381 945559283 /nfs/dbraw/zinc/55/92/83/945559283.db2.gz CRBVLYGRFBFCEM-XLNZFTOWSA-N 0 3 406.570 4.499 20 0 HIADHN C[C@H](N[C@H]1c2ccccc2CC12CCOCC2)C(=O)Nc1nc2ccccc2s1 ZINC000564410366 945562268 /nfs/dbraw/zinc/56/22/68/945562268.db2.gz VQXYQTZXCWANNL-YWZLYKJASA-N 0 3 407.539 4.307 20 0 HIADHN CC[C@H](NCc1cccc(N2C(=O)NC3(CCCC3)C2=O)c1)c1ccc(OC)cc1 ZINC000564434480 945583518 /nfs/dbraw/zinc/58/35/18/945583518.db2.gz XRCXZIAIBMDYMZ-NRFANRHFSA-N 0 3 407.514 4.305 20 0 HIADHN C[C@@H](NCc1ccccc1Cn1ccnc1)c1ccc(S(=O)(=O)C2CCCC2)cc1 ZINC000564439669 945588523 /nfs/dbraw/zinc/58/85/23/945588523.db2.gz TWMHSSLOILNNQT-LJQANCHMSA-N 0 3 423.582 4.499 20 0 HIADHN NS(=O)(=O)c1ccc2c(c1)CCC[C@H]2NCc1cccc(COc2ccccc2)c1 ZINC000564475158 945608931 /nfs/dbraw/zinc/60/89/31/945608931.db2.gz YTTKVYWQINNJQE-XMMPIXPASA-N 0 3 422.550 4.080 20 0 HIADHN Cc1noc(CSc2ccccc2C(=O)N[C@@H]2CCN(Cc3ccccc3)[C@H]2C)n1 ZINC000564680901 945726910 /nfs/dbraw/zinc/72/69/10/945726910.db2.gz ILPRZTWBNCRFOA-OXJNMPFZSA-N 0 3 422.554 4.063 20 0 HIADHN Cc1ccc2nc(-c3ccc(NC(=O)[C@@H](C)N4CCCN(C)CC4)cc3)sc2c1 ZINC000564741593 945743794 /nfs/dbraw/zinc/74/37/94/945743794.db2.gz MBYHXZVCBXLYEX-QGZVFWFLSA-N 0 3 408.571 4.236 20 0 HIADHN COc1cc(CNC[C@H](O)COc2cccc3[nH]ccc32)ccc1OC1CCCC1 ZINC000564747826 945746110 /nfs/dbraw/zinc/74/61/10/945746110.db2.gz BQUNVYTXNOWUNI-SFHVURJKSA-N 0 3 410.514 4.027 20 0 HIADHN COc1ccc([C@@H]2CCCCCN2C(=O)CN[C@H]2CCN(C)[C@@H]2c2ccccc2)cc1 ZINC000564760060 945752103 /nfs/dbraw/zinc/75/21/03/945752103.db2.gz ICXBHBKVZHSKAM-KYPHJKQUSA-N 0 3 421.585 4.174 20 0 HIADHN COc1cc(CN[C@H](C)c2cc[nH]c(=O)c2)cc(Br)c1OC(F)F ZINC000565057480 945765797 /nfs/dbraw/zinc/76/57/97/945765797.db2.gz SJYNGUGKVBKMJS-SECBINFHSA-N 0 3 403.223 4.011 20 0 HIADHN COC[C@@H](NC(=O)NC[C@@H](c1cccs1)N1CCCC1)c1cccc(Cl)c1 ZINC000565278619 945802838 /nfs/dbraw/zinc/80/28/38/945802838.db2.gz WRCCOBXJRNCSFR-MSOLQXFVSA-N 0 3 407.967 4.225 20 0 HIADHN COCCCN(C(=O)c1coc2c1cc(Br)cc2C)C1CCN(C)CC1 ZINC000565513810 945844069 /nfs/dbraw/zinc/84/40/69/945844069.db2.gz HPPYIXHZJQNCLC-UHFFFAOYSA-N 0 3 423.351 4.077 20 0 HIADHN COC(=O)c1cc(CN[C@@H](CC2CC2)c2cc(F)cc(Br)c2)cn1C ZINC000565565605 945849984 /nfs/dbraw/zinc/84/99/84/945849984.db2.gz GAAWWNUDXMLOIO-KRWDZBQOSA-N 0 3 409.299 4.344 20 0 HIADHN C[C@@H]1C[C@H]1N1CCN(C(=O)c2ccc3c(c2)nc(Cc2cccs2)n3C)C[C@@H](C)C1 ZINC000565617091 945856021 /nfs/dbraw/zinc/85/60/21/945856021.db2.gz NEQNTLFPIWXTEG-GSHUGGBRSA-N 0 3 422.598 4.028 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)Nc2ccccc2C(=O)N2CCCCC2)CCN1Cc1ccccc1 ZINC000565794452 945884220 /nfs/dbraw/zinc/88/42/20/945884220.db2.gz LHXUIZZKQKJXMU-KNQAVFIVSA-N 0 3 420.557 4.097 20 0 HIADHN C[C@H]1[C@@H](NC(=O)Nc2ccccc2C(=O)N2CCCCC2)CCN1Cc1ccccc1 ZINC000565794454 945884477 /nfs/dbraw/zinc/88/44/77/945884477.db2.gz LHXUIZZKQKJXMU-UGKGYDQZSA-N 0 3 420.557 4.097 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)Cc1coc(-c2ccc(Cl)cc2)n1)c1ccco1 ZINC000565826842 945891100 /nfs/dbraw/zinc/89/11/00/945891100.db2.gz TVYGVEKHGQGCEC-KDOFPFPSSA-N 0 3 401.894 4.376 20 0 HIADHN O=C(NCC1(c2ccccn2)CCC1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000565883223 945901840 /nfs/dbraw/zinc/90/18/40/945901840.db2.gz BRFPHYVVAJPZIZ-QFIPXVFZSA-N 0 3 417.475 4.074 20 0 HIADHN COc1cccc([C@@H]2[C@@H](NCc3nc4sc(C)c(C)c4c(=O)[nH]3)CCN2C2CC2)c1 ZINC000566022116 945974111 /nfs/dbraw/zinc/97/41/11/945974111.db2.gz SLJHRXDCEZXLOB-GHTZIAJQSA-N 0 3 424.570 4.090 20 0 HIADHN CC(=O)c1ccc(NC(=O)CCN2CCCN(Cc3ccc(Cl)cc3)CC2)cc1 ZINC000566519755 946027326 /nfs/dbraw/zinc/02/73/26/946027326.db2.gz MTIAVEGCNKOGTF-UHFFFAOYSA-N 0 3 413.949 4.079 20 0 HIADHN CN(C)C[C@@H](NC(=O)[C@H]1CCn2c(cnc2C2CCCCC2)C1)c1ccc(F)cc1 ZINC000566523311 946029459 /nfs/dbraw/zinc/02/94/59/946029459.db2.gz NJSDCAXDNIDFBC-SIKLNZKXSA-N 0 3 412.553 4.051 20 0 HIADHN C[C@H]1C[C@H](NC(=O)C(C)(C)c2csc(-c3c(F)cccc3F)n2)CN1C1CC1 ZINC000566552477 946038710 /nfs/dbraw/zinc/03/87/10/946038710.db2.gz CQQMQKMMSASJQP-STQMWFEESA-N 0 3 405.514 4.107 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)C(C)(C)c2csc(-c3c(F)cccc3F)n2)CN1C1CC1 ZINC000566552475 946039947 /nfs/dbraw/zinc/03/99/47/946039947.db2.gz CQQMQKMMSASJQP-OLZOCXBDSA-N 0 3 405.514 4.107 20 0 HIADHN CC(=O)N1C[C@@H]2CCC[C@@H](NCc3csc(COc4ccc(Cl)cc4)n3)[C@H]2C1 ZINC000566877793 946144391 /nfs/dbraw/zinc/14/43/91/946144391.db2.gz BGHIBDPZMWQUDR-RYGJVYDSSA-N 0 3 419.978 4.112 20 0 HIADHN CSc1ccc([C@@H](CNC(=O)c2ccc(OCC(F)(F)F)cc2)N(C)C)cc1 ZINC000566919786 946166749 /nfs/dbraw/zinc/16/67/49/946166749.db2.gz VSCIWHDABDIUJV-GOSISDBHSA-N 0 3 412.477 4.382 20 0 HIADHN Cc1nc2ccccn2c(=O)c1CCN1CC=C(c2cccc(Br)c2)CC1 ZINC000566941942 946181725 /nfs/dbraw/zinc/18/17/25/946181725.db2.gz CFBYDMNFUZUKDQ-UHFFFAOYSA-N 0 3 424.342 4.097 20 0 HIADHN Cc1cc2ncn(C[C@@H](O)CNCc3cn(-c4ccccc4)nc3C(C)C)c2cc1C ZINC000567070925 946233237 /nfs/dbraw/zinc/23/32/37/946233237.db2.gz OPNJYLBLNXJEQP-QFIPXVFZSA-N 0 3 417.557 4.113 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CNC[C@@H](O)COc1cccc2ccccc21 ZINC000567153783 946257510 /nfs/dbraw/zinc/25/75/10/946257510.db2.gz LVCLPHGORRNYFE-HSZRJFAPSA-N 0 3 415.537 4.231 20 0 HIADHN C[C@H](Cc1cncc2ccccc21)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000567224673 946275265 /nfs/dbraw/zinc/27/52/65/946275265.db2.gz POPKGKKLODUBTO-APMMTJHUSA-N 0 3 419.491 4.335 20 0 HIADHN CC(C)OC(=O)c1ccc(NC(=O)[C@H](C)N[C@@H](C[C@H]2CCOC2)c2ccccc2)cc1 ZINC000567335426 946313616 /nfs/dbraw/zinc/31/36/16/946313616.db2.gz PBNFKVBWQQEMJZ-YYDVJCTNSA-N 0 3 424.541 4.336 20 0 HIADHN COc1ccc([C@H](C)NCc2cc(Cl)ccc2N2CCOCC2)c(C)c1OC ZINC000567339325 946313756 /nfs/dbraw/zinc/31/37/56/946313756.db2.gz NBKKKSYKJIQLJN-INIZCTEOSA-N 0 3 404.938 4.353 20 0 HIADHN CC(C)OC(=O)c1ccc(NC(=O)[C@H](C)N[C@H](C[C@@H]2CCOC2)c2ccccc2)cc1 ZINC000567335423 946314437 /nfs/dbraw/zinc/31/44/37/946314437.db2.gz PBNFKVBWQQEMJZ-SFYKDHMMSA-N 0 3 424.541 4.336 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)c1ccc(C(=O)Nc2ccccc2)cc1 ZINC000567426923 946334900 /nfs/dbraw/zinc/33/49/00/946334900.db2.gz RDFQQKGKIOCIIB-LJQANCHMSA-N 0 3 401.510 4.189 20 0 HIADHN CN(C)C[C@@H](NC(=O)c1cc(F)c(F)cc1Br)c1ccc(Cl)cc1 ZINC000567472330 946344908 /nfs/dbraw/zinc/34/49/08/946344908.db2.gz NDWCIUHTYOUAQP-MRXNPFEDSA-N 0 3 417.681 4.413 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1ccc(CN(C(C)=O)C2CC2)cc1)c1ccco1 ZINC000567480240 946346882 /nfs/dbraw/zinc/34/68/82/946346882.db2.gz ABDYWLFPYBVFOA-KKSFZXQISA-N 0 3 412.534 4.041 20 0 HIADHN COC(=O)c1ccc(CN[C@@H](Cc2ccccc2C)c2ccc(OC)c(OC)c2)[nH]1 ZINC000567505566 946351872 /nfs/dbraw/zinc/35/18/72/946351872.db2.gz GBLGUZVJZJDQKT-NRFANRHFSA-N 0 3 408.498 4.201 20 0 HIADHN COc1cc(CN2CC[C@H](c3nccn3C)C2)cc(OC)c1OCc1ccccc1 ZINC000568026019 946446298 /nfs/dbraw/zinc/44/62/98/946446298.db2.gz ZJUFMGJHKZDMBQ-FQEVSTJZSA-N 0 3 407.514 4.006 20 0 HIADHN CCn1nccc1N1CCC[C@@H](NC/C(C)=C\c2cccc(C(F)(F)F)c2)C1=O ZINC000568132108 946474355 /nfs/dbraw/zinc/47/43/55/946474355.db2.gz LEFUDGVHQWNKCS-WTQUMQLASA-N 0 3 406.452 4.110 20 0 HIADHN CC(C)Oc1ccc(Cl)cc1NC(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000568518232 946575255 /nfs/dbraw/zinc/57/52/55/946575255.db2.gz VHRZQAKRWIPGDM-IAGOWNOFSA-N 0 3 423.985 4.480 20 0 HIADHN CC(C)Oc1ccc([C@H](CNCc2nc3cc(Cl)ccc3n2C)N(C)C)cc1 ZINC000568677641 946650049 /nfs/dbraw/zinc/65/00/49/946650049.db2.gz PWFZRGONUZKRKA-NRFANRHFSA-N 0 3 400.954 4.406 20 0 HIADHN COc1cc(CN2CCC[C@@H](c3nnc(C4CC4)[nH]3)C2)ccc1OCC(F)(F)F ZINC000568733313 946673948 /nfs/dbraw/zinc/67/39/48/946673948.db2.gz GYLULNFCMPBPBG-OAHLLOKOSA-N 0 3 410.440 4.011 20 0 HIADHN C[C@H](NC[C@@H](Cc1ccccc1)C(F)(F)F)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000568805864 946705130 /nfs/dbraw/zinc/70/51/30/946705130.db2.gz CAQCXRXJGCAPDI-XJKSGUPXSA-N 0 3 403.441 4.301 20 0 HIADHN COCC[C@H](COC)NCc1cccc(NC(=O)c2ccc(Cl)cc2Cl)c1 ZINC000568817205 946714477 /nfs/dbraw/zinc/71/44/77/946714477.db2.gz DNLFSNPGMMFXAB-QGZVFWFLSA-N 0 3 411.329 4.387 20 0 HIADHN C[C@@H](NC(=O)[C@H](C)N[C@@H]1CCN(C)[C@@H]1c1ccc(Cl)c(F)c1)c1ccc(F)cc1 ZINC000568871316 946729311 /nfs/dbraw/zinc/72/93/11/946729311.db2.gz QSEMBKKTFKZDHC-RZVAPFGTSA-N 0 3 421.919 4.219 20 0 HIADHN CN(C)CCN(C[C@H]1CCCO1)C(=O)Nc1cccc(CCCc2ccccc2)c1 ZINC000568913894 946750829 /nfs/dbraw/zinc/75/08/29/946750829.db2.gz SAUNYXUAXMCPHY-XMMPIXPASA-N 0 3 409.574 4.436 20 0 HIADHN Nc1c(Br)cc(Br)cc1CNCC1(C(F)(F)F)CC1 ZINC000568918089 946755322 /nfs/dbraw/zinc/75/53/22/946755322.db2.gz TWODQUPOSUVDJX-UHFFFAOYSA-N 0 3 402.052 4.226 20 0 HIADHN CC(C)Cc1ccc([C@@H](CNC(=O)c2ccc(-c3ccccn3)[nH]c2=O)N(C)C)cc1 ZINC000569044123 946807103 /nfs/dbraw/zinc/80/71/03/946807103.db2.gz UAEFLJLAUHEYMY-HSZRJFAPSA-N 0 3 418.541 4.080 20 0 HIADHN Cc1c(NC(=O)N(CCN(C)C)Cc2ccco2)cnn1-c1ccc(Cl)cc1 ZINC000569048536 946809096 /nfs/dbraw/zinc/80/90/96/946809096.db2.gz IVZKRZVYSRHHRQ-UHFFFAOYSA-N 0 3 401.898 4.023 20 0 HIADHN CN1CC[C@@H](NCCS(=O)(=O)c2ccc(C(C)(C)C)cc2)C[C@H]1c1ccccc1 ZINC000569146929 946822990 /nfs/dbraw/zinc/82/29/90/946822990.db2.gz SKQNOPYAFGHOSL-GGAORHGYSA-N 0 3 414.615 4.183 20 0 HIADHN CC(C)OC(=O)C1(C(=O)OC(C)C)CC(N[C@@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000569162783 946829004 /nfs/dbraw/zinc/82/90/04/946829004.db2.gz PWORBJIBBSWBCU-AWEZNQCLSA-N 0 3 415.452 4.408 20 0 HIADHN Nc1nccc([C@H]2CCCN(Cc3cccc(NC(=O)c4ccccc4Cl)c3)C2)n1 ZINC000569272460 946846411 /nfs/dbraw/zinc/84/64/11/946846411.db2.gz LCHMHJRNOYHKOF-KRWDZBQOSA-N 0 3 421.932 4.344 20 0 HIADHN COc1ccc(S(=O)(=O)N(C)[C@@H]2CCN(Cc3ccccc3)[C@@H](C)C2)c(Cl)c1 ZINC000569284808 946849737 /nfs/dbraw/zinc/84/97/37/946849737.db2.gz QAWLTFPXHJTTIV-FUHWJXTLSA-N 0 3 422.978 4.022 20 0 HIADHN COc1ccc(CNC[C@@]2(C)OCCc3sccc32)c(OCc2cccnc2)c1 ZINC000569293858 946853626 /nfs/dbraw/zinc/85/36/26/946853626.db2.gz YBZOSXNRECGBKR-HSZRJFAPSA-N 0 3 410.539 4.308 20 0 HIADHN C[C@H](N[C@@H]1CCN(C)[C@@H]1c1ccc(Cl)cc1)C(=O)Nc1ccccc1OC(F)F ZINC000569394810 946865874 /nfs/dbraw/zinc/86/58/74/946865874.db2.gz QJIRKDZTALHIMI-BOFPYLFWSA-N 0 3 423.891 4.303 20 0 HIADHN CCN(C(=O)CN[C@@H]1CCN(C)[C@@H]1c1ccc(F)c(F)c1)[C@H](C)c1ccc(F)cc1 ZINC000569510877 946882237 /nfs/dbraw/zinc/88/22/37/946882237.db2.gz QIGCPJFOKWSOTJ-YCASGBEESA-N 0 3 419.491 4.048 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)CSc1cccc(Br)c1)c1ccco1 ZINC000569842520 947017017 /nfs/dbraw/zinc/01/70/17/947017017.db2.gz KGCKOCAUOPYSJE-CJNGLKHVSA-N 0 3 411.365 4.380 20 0 HIADHN C[C@H]1C[C@H](N2CCCC2)CN1C(=O)c1cc2sc(Nc3ccccc3)nc2s1 ZINC000569857054 947022081 /nfs/dbraw/zinc/02/20/81/947022081.db2.gz JMJUZJIQTWLEBZ-HOCLYGCPSA-N 0 3 412.584 4.800 20 0 HIADHN CS(=O)(=O)c1ccc(NCC2CCN(Cc3ccccc3Cl)CC2)c(F)c1 ZINC000569882286 947032089 /nfs/dbraw/zinc/03/20/89/947032089.db2.gz SDHWIPJHRCOKLW-UHFFFAOYSA-N 0 3 410.942 4.207 20 0 HIADHN O=C(N1CCC=C(c2ccccn2)C1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000569970554 947057215 /nfs/dbraw/zinc/05/72/15/947057215.db2.gz RHDWIFSOOZFMCR-QFIPXVFZSA-N 0 3 415.459 4.152 20 0 HIADHN C[C@@H](NCc1ccccc1CN1CCN(c2ccccc2)CC1)c1ccncc1F ZINC000569992557 947064124 /nfs/dbraw/zinc/06/41/24/947064124.db2.gz XKSCHAINYCAQGP-HXUWFJFHSA-N 0 3 404.533 4.394 20 0 HIADHN COc1c2ccccc2[nH]c1C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000569994921 947065620 /nfs/dbraw/zinc/06/56/20/947065620.db2.gz XFXKMOXSWQRJMV-SFHVURJKSA-N 0 3 415.497 4.072 20 0 HIADHN Clc1ccccc1[C@H](CNCc1conc1Cc1ccccc1)N1CCOCC1 ZINC000570414548 947233133 /nfs/dbraw/zinc/23/31/33/947233133.db2.gz PINAMVYLEDIMOS-QHCPKHFHSA-N 0 3 411.933 4.082 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](NC2CCC3(CCCO3)CC2)c2ccc(F)cc2)c1 ZINC000570617031 947316286 /nfs/dbraw/zinc/31/62/86/947316286.db2.gz RCZQHOMJLQMRDA-APKLWFBNSA-N 0 3 417.546 4.400 20 0 HIADHN NC(=O)[C@@H](Cc1ccc(C(F)(F)F)cc1)NC[C@@H](Cc1ccccc1)C(F)(F)F ZINC000570737915 947341341 /nfs/dbraw/zinc/34/13/41/947341341.db2.gz PBLDDSBXPBRTFP-IAGOWNOFSA-N 0 3 418.381 4.113 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@@H](NCc2cc(Cl)c3c(c2)OCCO3)c2ccccc21 ZINC000570855911 947371477 /nfs/dbraw/zinc/37/14/77/947371477.db2.gz SRAVNQYAYNPDCA-IEBWSBKVSA-N 0 3 401.890 4.383 20 0 HIADHN CSc1ccc([C@H](CNC(=O)c2cnn(-c3ccc(C)cc3)c2C)N(C)C)cc1 ZINC000570880573 947380913 /nfs/dbraw/zinc/38/09/13/947380913.db2.gz FDCAEVWCPITQJM-QFIPXVFZSA-N 0 3 408.571 4.244 20 0 HIADHN COCCCN(C(=O)[C@@H](C)Oc1ccc(-c2ccccc2)cc1)C1CCN(C)CC1 ZINC000571013172 947436277 /nfs/dbraw/zinc/43/62/77/947436277.db2.gz JFIAXNSWAAIJLK-HXUWFJFHSA-N 0 3 410.558 4.080 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)Cc1csc(Cc2ccc(F)cc2)n1 ZINC000571071330 947469383 /nfs/dbraw/zinc/46/93/83/947469383.db2.gz IGNCDCFTGKEAGY-UHFFFAOYSA-N 0 3 403.567 4.140 20 0 HIADHN O=C(NC[C@H]1CCCO1)c1cccc(CN[C@@H]2CCCc3c4ccccc4[nH]c32)c1 ZINC000571153510 947531744 /nfs/dbraw/zinc/53/17/44/947531744.db2.gz IAKZWSYILKHRJL-AUSIDOKSSA-N 0 3 403.526 4.244 20 0 HIADHN CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)cc1)[C@H]1C[C@H]1C ZINC000571356763 947616364 /nfs/dbraw/zinc/61/63/64/947616364.db2.gz UOAPKYIBDXXDJR-PWAGRJGVSA-N 0 3 423.532 4.438 20 0 HIADHN CCN1CC[C@@H](NCC(=O)Nc2ccccc2Cl)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000571421701 947638804 /nfs/dbraw/zinc/63/88/04/947638804.db2.gz YFEWZIPNPFWLFJ-QUCCMNQESA-N 0 3 410.320 4.496 20 0 HIADHN CCOC(=O)c1nnc(-c2cccc(C[NH2+][C@H]3CCC[C@@H](c4ncccc4C)C3)c2)[n-]1 ZINC000571448174 947653111 /nfs/dbraw/zinc/65/31/11/947653111.db2.gz UZIGCLQDNHXNKT-QUCCMNQESA-N 0 3 419.529 4.168 20 0 HIADHN CCOC(=O)c1nc(-c2cccc(C[NH2+][C@H]3CCC[C@@H](c4ncccc4C)C3)c2)n[n-]1 ZINC000571448174 947653126 /nfs/dbraw/zinc/65/31/26/947653126.db2.gz UZIGCLQDNHXNKT-QUCCMNQESA-N 0 3 419.529 4.168 20 0 HIADHN COc1ccc(CN[C@H]2CCN(C)[C@H]2c2ccccc2)c(Br)c1OC ZINC000571690535 947748916 /nfs/dbraw/zinc/74/89/16/947748916.db2.gz FJLJQGCNTGBGCN-LPHOPBHVSA-N 0 3 405.336 4.001 20 0 HIADHN Cc1ccccc1-n1cc(CNC[C@H]2CCN(C)[C@H]2c2ccc(Cl)c(F)c2)nn1 ZINC000571717585 947760658 /nfs/dbraw/zinc/76/06/58/947760658.db2.gz DYKNOWFJHYCYBR-VGSWGCGISA-N 0 3 413.928 4.151 20 0 HIADHN Cc1[nH]c(=O)c(C(=O)N[C@@H]2CCN(Cc3ccccc3)[C@@H]2C)cc1-c1ccccc1 ZINC000571736852 947770521 /nfs/dbraw/zinc/77/05/21/947770521.db2.gz WIQVBOIMNLRWJX-WZONZLPQSA-N 0 3 401.510 4.155 20 0 HIADHN Cc1[nH]c(=O)c(C(=O)N[C@H]2CCN(Cc3ccccc3)[C@@H]2C)cc1-c1ccccc1 ZINC000571736850 947771568 /nfs/dbraw/zinc/77/15/68/947771568.db2.gz WIQVBOIMNLRWJX-JPYJTQIMSA-N 0 3 401.510 4.155 20 0 HIADHN Cc1cccnc1OC1CCN(C[C@H](O)CO[C@H](C)c2ccc(Cl)cc2)CC1 ZINC000571930408 947814822 /nfs/dbraw/zinc/81/48/22/947814822.db2.gz PBJAHISIUIBGRR-XLIONFOSSA-N 0 3 404.938 4.025 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N[C@@H]2c3ccccc3CC23CCOCC3)C1 ZINC000571936276 947817355 /nfs/dbraw/zinc/81/73/55/947817355.db2.gz UNRJPMAEMBYLCZ-WNOPAQSVSA-N 0 3 419.569 4.215 20 0 HIADHN CNS(=O)(=O)c1cccc([C@H](C)NC/C(C)=C/c2cccc(C(F)(F)F)c2)c1 ZINC000571955033 947821419 /nfs/dbraw/zinc/82/14/19/947821419.db2.gz WRJHNZOMRACECF-IPJDOKCGSA-N 0 3 412.477 4.368 20 0 HIADHN C[C@H](c1ccc(F)c(F)c1)N(C)C(=O)CN[C@H]1CCN(C)[C@H]1c1ccc(Cl)cc1 ZINC000571963125 947823297 /nfs/dbraw/zinc/82/32/97/947823297.db2.gz SOESRDDIKUNZHF-XDCJIHQESA-N 0 3 421.919 4.173 20 0 HIADHN C/C(=C\c1ccccc1OC(F)F)CN(C)[C@@H](C)c1cccc(S(N)(=O)=O)c1 ZINC000571966342 947823933 /nfs/dbraw/zinc/82/39/33/947823933.db2.gz OBQGDWWFGDQYGX-GOFCXVBSSA-N 0 3 410.486 4.032 20 0 HIADHN O=C(CN[C@H]1c2ccccc2CC12CCOCC2)Nc1ccc(Br)cc1 ZINC000572080976 947842254 /nfs/dbraw/zinc/84/22/54/947842254.db2.gz DJBAYMNDAYPJMH-FQEVSTJZSA-N 0 3 415.331 4.071 20 0 HIADHN CN(C)C[C@H](NC(=O)N[C@H]1CCO[C@@H](c2ccc(F)cc2)C1)c1ccc(Cl)cc1 ZINC000572224659 947866628 /nfs/dbraw/zinc/86/66/28/947866628.db2.gz DRRCMCBZPZSQJH-PCCBWWKXSA-N 0 3 419.928 4.301 20 0 HIADHN C[C@H]1[C@@H](NC(=O)Nc2ccc(NC(=O)c3ccco3)cc2)CCN1Cc1ccccc1 ZINC000572273128 947873216 /nfs/dbraw/zinc/87/32/16/947873216.db2.gz LBLQOXXZUKGYAT-UWJYYQICSA-N 0 3 418.497 4.316 20 0 HIADHN COC(=O)c1csc(-c2cccc(CN[C@@H](C)c3ccc4c(c3)CCC(=O)N4)c2)n1 ZINC000572427785 947899976 /nfs/dbraw/zinc/89/99/76/947899976.db2.gz VUAAMQYMCUPNIL-AWEZNQCLSA-N 0 3 421.522 4.332 20 0 HIADHN CN(C)Cc1ccccc1C(=O)Nc1nnc(SCc2ccc(F)cc2)s1 ZINC000572457173 947912687 /nfs/dbraw/zinc/91/26/87/947912687.db2.gz ZIHNVHZPMJTPOC-UHFFFAOYSA-N 0 3 402.520 4.283 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)Nc1cccc(OCc2cccnc2)c1 ZINC000572633653 947961508 /nfs/dbraw/zinc/96/15/08/947961508.db2.gz ZCXUQSOTTYARKE-QHCPKHFHSA-N 0 3 416.525 4.447 20 0 HIADHN COc1c(C)cnc(CN2CCC(N(C)Cc3cc(C(C)(C)C)on3)CC2)c1C ZINC000572767058 948004894 /nfs/dbraw/zinc/00/48/94/948004894.db2.gz YRLSZXDRVQYZJA-UHFFFAOYSA-N 0 3 400.567 4.089 20 0 HIADHN Fc1ccc([C@H](NCCc2ccc(OCc3ccccc3)cc2)c2c[nH]nn2)cc1 ZINC000572785864 948009409 /nfs/dbraw/zinc/00/94/09/948009409.db2.gz BGKKONDYVCBUEZ-DEOSSOPVSA-N 0 3 402.473 4.445 20 0 HIADHN COc1ccc(C[C@H]2CCCN(CC(=O)N3CCc4[nH]c5ccccc5c4C3)C2)cc1 ZINC000573296110 948152158 /nfs/dbraw/zinc/15/21/58/948152158.db2.gz UKHGLFDLNICXGO-HXUWFJFHSA-N 0 3 417.553 4.016 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)N1CCC[C@@H](c2nc3ccc(F)cc3o2)C1 ZINC000573520343 948229162 /nfs/dbraw/zinc/22/91/62/948229162.db2.gz PLSJJGONXVCEQF-IEBWSBKVSA-N 0 3 424.520 4.376 20 0 HIADHN COc1ccc(OCc2ccccn2)c(CNC[C@@]2(C)OCCc3sccc32)c1 ZINC000574005439 948347247 /nfs/dbraw/zinc/34/72/47/948347247.db2.gz MSBSSHDARYQHQF-HSZRJFAPSA-N 0 3 410.539 4.308 20 0 HIADHN COC(=O)c1cc(NC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)cc2[nH]ccc21 ZINC000574076329 948359181 /nfs/dbraw/zinc/35/91/81/948359181.db2.gz IFSHQTFILFCOTE-KRWDZBQOSA-N 0 3 420.513 4.083 20 0 HIADHN CC(C)[C@H](CNC(=O)[C@@H](C)Cc1cnc2ccccc2n1)N1CCc2ccccc2C1 ZINC000574295451 948403643 /nfs/dbraw/zinc/40/36/43/948403643.db2.gz OGKXLBFKDLWESI-DFBJGRDBSA-N 0 3 416.569 4.008 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)[C@@H](C)N[C@H]1c2ccccc2CC12CCOCC2 ZINC000574489759 948457598 /nfs/dbraw/zinc/45/75/98/948457598.db2.gz RJISIYGTQGPZMK-VFNWGFHPSA-N 0 3 414.933 4.359 20 0 HIADHN O=C(CN[C@H]1c2ccccc2CC12CCOCC2)Nc1nc(-c2ccccc2)cs1 ZINC000574679852 948504141 /nfs/dbraw/zinc/50/41/41/948504141.db2.gz NONVVANWGBIRPK-QFIPXVFZSA-N 0 3 419.550 4.432 20 0 HIADHN CCOc1cc(CNCc2ccc(C(C)(F)F)cc2)ccc1O[C@@H](C)C(=O)N(C)C ZINC000574706549 948507346 /nfs/dbraw/zinc/50/73/46/948507346.db2.gz AADWPSCZLISJOK-INIZCTEOSA-N 0 3 420.500 4.342 20 0 HIADHN O=S(=O)(Cc1ccc2ccccc2c1)N1CCC(N2CCc3ccccc3C2)CC1 ZINC000574796921 948528906 /nfs/dbraw/zinc/52/89/06/948528906.db2.gz IHUZEICJYLWQCN-UHFFFAOYSA-N 0 3 420.578 4.192 20 0 HIADHN CC(C)C(=O)c1ccc([C@@H](C)C(=O)NC[C@H]2CN(Cc3ccccc3)CCCO2)cc1 ZINC000574858936 948545430 /nfs/dbraw/zinc/54/54/30/948545430.db2.gz KSXFTZXPESLSLU-YKSBVNFPSA-N 0 3 422.569 4.036 20 0 HIADHN CC(C)N1CC[C@H](NCC(=O)N[C@@H](C)c2cccs2)[C@H]1c1ccc(F)c(F)c1 ZINC000574929184 948553473 /nfs/dbraw/zinc/55/34/73/948553473.db2.gz TZZZNPXOMNRVCT-DHUIEDIVSA-N 0 3 407.530 4.017 20 0 HIADHN CN(C(=O)c1ccc(NCc2ccc(C(F)(F)F)cc2)cc1)[C@@H]1CCCN(C)C1 ZINC000574931356 948554714 /nfs/dbraw/zinc/55/47/14/948554714.db2.gz NTDABEIZVRLBPN-HXUWFJFHSA-N 0 3 405.464 4.484 20 0 HIADHN CN(C)C[C@@H](NC(=O)c1cnc(Cc2ccc(F)cc2)s1)c1ccc(F)cc1 ZINC000575085329 948587435 /nfs/dbraw/zinc/58/74/35/948587435.db2.gz JFXJYCQWKKSNIU-GOSISDBHSA-N 0 3 401.482 4.045 20 0 HIADHN CN(Cc1c[nH]nc1-c1ccc2c(c1)OCO2)Cc1ccc(OCC(F)(F)F)cc1 ZINC000575163493 948611870 /nfs/dbraw/zinc/61/18/70/948611870.db2.gz CERKDEJMCARKAD-UHFFFAOYSA-N 0 3 419.403 4.379 20 0 HIADHN CN(C)[C@@]1(CN[C@@H](c2ccc(Br)o2)c2ccc(F)cc2)CCSC1 ZINC000575783883 948705751 /nfs/dbraw/zinc/70/57/51/948705751.db2.gz LSTTYIOPXJCLJL-QZTJIDSGSA-N 0 3 413.356 4.298 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)[C@@H]2CCn3c(cnc3C3CCCCC3)C2)CC1 ZINC000575825416 948726781 /nfs/dbraw/zinc/72/67/81/948726781.db2.gz KIKMJRWHDZEZGP-HXUWFJFHSA-N 0 3 424.589 4.209 20 0 HIADHN C[C@@H]1CN(C)[C@@H](C)CN1c1cc(-c2ccc(Cl)nc2)ccc1C1OCCCO1 ZINC001164632863 719224867 /nfs/dbraw/zinc/22/48/67/719224867.db2.gz BXRHGZXKDZARLW-JKSUJKDBSA-N 0 3 401.938 4.366 20 0 HIADHN Clc1cccc2nc(Cl)nc(N3CC[C@@H]4[C@H]3CCN4Cc3cccnc3)c12 ZINC001164722125 720383328 /nfs/dbraw/zinc/38/33/28/720383328.db2.gz CCGQCVJPESUEEE-IAGOWNOFSA-N 0 3 400.313 4.185 20 0 HIADHN FC1(F)CCN(c2ccc(CN3CCCC3)cn2)C[C@]12CCN(c1ccccc1)C2 ZINC001164824964 720395918 /nfs/dbraw/zinc/39/59/18/720395918.db2.gz STTZEXVEYUZQQQ-HSZRJFAPSA-N 0 3 412.528 4.420 20 0 HIADHN Fc1ccc(F)c2c(N3CC[C@H]4[C@@H]3CCN4Cc3cccnc3)cc(Cl)nc12 ZINC001164727655 720481121 /nfs/dbraw/zinc/48/11/21/720481121.db2.gz NRMYJYQHMKUHGB-IRXDYDNUSA-N 0 3 400.860 4.415 20 0 HIADHN c1ccc(-c2cc(N3CCN4C[C@@H](Oc5cncnc5)C[C@@H]4C3)nc3ccccc32)cc1 ZINC001164737192 720756014 /nfs/dbraw/zinc/75/60/14/720756014.db2.gz AMWKNJRJMAQHJI-RTWAWAEBSA-N 0 3 423.520 4.034 20 0 HIADHN Clc1cc(-c2ccccc2)cc(N2CCN3C[C@@H](OCc4cccnc4)C[C@@H]3C2)n1 ZINC001164863456 721086594 /nfs/dbraw/zinc/08/65/94/721086594.db2.gz CIFXWCIJBGOLQK-YADHBBJMSA-N 0 3 420.944 4.277 20 0 HIADHN Cc1nc2ccsc2c(N2CCC(F)(F)[C@]3(CCN(Cc4ccccn4)C3)C2)n1 ZINC001164906044 721583475 /nfs/dbraw/zinc/58/34/75/721583475.db2.gz YPWWOOIWCIXFDR-FQEVSTJZSA-N 0 3 415.513 4.132 20 0 HIADHN Cc1nc(C(C)C)cc(N2CCC(F)(F)[C@@]3(CCN(Cc4ccccn4)C3)C2)n1 ZINC001164907452 721585602 /nfs/dbraw/zinc/58/56/02/721585602.db2.gz SZNJXAUPJLNXFB-OAQYLSRUSA-N 0 3 401.505 4.041 20 0 HIADHN COc1cccc2ccc(N3CCC(F)(F)[C@]4(CCN(Cc5ccccn5)C4)C3)nc21 ZINC001164903712 721693586 /nfs/dbraw/zinc/69/35/86/721693586.db2.gz BUBXOFOQFRAOQA-QHCPKHFHSA-N 0 3 424.495 4.376 20 0 HIADHN COc1ccc2cnc(N3CCC(F)(F)[C@@]4(CCN(Cc5ccccn5)C4)C3)cc2c1 ZINC001164906557 721716002 /nfs/dbraw/zinc/71/60/02/721716002.db2.gz MUKXILQJCRLRKR-HSZRJFAPSA-N 0 3 424.495 4.376 20 0 HIADHN Cc1cc2ccncc2nc1N1CCC(F)(F)[C@@]2(CCN(Cc3ccccn3)C2)C1 ZINC001164913526 721732282 /nfs/dbraw/zinc/73/22/82/721732282.db2.gz WUUZOXONFGVKDF-JOCHJYFZSA-N 0 3 409.484 4.071 20 0 HIADHN Clc1ccc2nc(N3CC[C@@H]4CN(Cc5cccnc5)CCO[C@H]4C3)ccc2c1 ZINC001164986158 722103932 /nfs/dbraw/zinc/10/39/32/722103932.db2.gz YFGUMDFEFGFQCA-KNQAVFIVSA-N 0 3 408.933 4.011 20 0 HIADHN Clc1cc(N2CC[C@@H]3CN(Cc4cccnc4)CCO[C@@H]3C2)c2ccsc2n1 ZINC001164982525 722110190 /nfs/dbraw/zinc/11/01/90/722110190.db2.gz WWCCPSJSZHOQPM-VQIMIIECSA-N 0 3 414.962 4.072 20 0 HIADHN COC(=O)c1ccc2nc(N3CCC[C@@]4(CCN4Cc4cccc(F)c4)C3)ccc2c1 ZINC001164993913 722198573 /nfs/dbraw/zinc/19/85/73/722198573.db2.gz JDVJKHYXGAUPJB-RUZDIDTESA-N 0 3 419.500 4.405 20 0 HIADHN Cc1cc(N2CCC[C@@]3(CCN3Cc3cccc(F)c3)C2)nc(-c2ccccn2)n1 ZINC001164996699 722207771 /nfs/dbraw/zinc/20/77/71/722207771.db2.gz VTXXRIPJQBOFNW-XMMPIXPASA-N 0 3 403.505 4.231 20 0 HIADHN C[C@H]1CCCCN1C(=O)c1ccc(NC(=O)N(CCN(C)C)C2CCCC2)cc1 ZINC000436001014 861286944 /nfs/dbraw/zinc/28/69/44/861286944.db2.gz AHECWLGBUMEDSW-SFHVURJKSA-N 0 3 400.567 4.039 20 0 HIADHN CC[C@@](C)(COc1ncccc1Cl)NC(=O)c1cccc(CN2CCCC2)c1 ZINC000436001433 861287666 /nfs/dbraw/zinc/28/76/66/861287666.db2.gz NTAVYPGNVJDKAZ-QFIPXVFZSA-N 0 3 401.938 4.308 20 0 HIADHN COc1ccc([C@@H](C/N=C/c2cc(Br)ccc2O)N2CCCC2)cc1 ZINC000005291388 845098977 /nfs/dbraw/zinc/09/89/77/845098977.db2.gz PFDDISKQSDJFGX-PPRFWAEMSA-N 0 3 403.320 4.419 20 0 HIADHN COc1cc(OC)c(NC(=O)CN[C@@H]2CCCC[C@H]2OCCC(C)C)cc1Cl ZINC000436263419 861573095 /nfs/dbraw/zinc/57/30/95/861573095.db2.gz HUYHFGNSUNWYLN-SJLPKXTDSA-N 0 3 412.958 4.259 20 0 HIADHN CN(C)C(=O)COc1cccc(CNCc2cc(Cl)cc(C(F)(F)F)c2)c1 ZINC000436275179 861583715 /nfs/dbraw/zinc/58/37/15/861583715.db2.gz OLBFCYXFOYHBMR-UHFFFAOYSA-N 0 3 400.828 4.116 20 0 HIADHN c1cc(-c2n[nH]cc2CNCc2ccc(N3CCc4ccccc4C3)nc2)cs1 ZINC000436277693 861586005 /nfs/dbraw/zinc/58/60/05/861586005.db2.gz ZCRNZNIQTSJKNG-UHFFFAOYSA-N 0 3 401.539 4.386 20 0 HIADHN COc1ccc(CNC(=O)[C@H](C)N2CCC(CCc3ccccc3)CC2)cc1OC ZINC000011720571 845828825 /nfs/dbraw/zinc/82/88/25/845828825.db2.gz UUNVISIRALNSOO-IBGZPJMESA-N 0 3 410.558 4.053 20 0 HIADHN COc1ccc(CNC(=O)[C@@H](C)N2CCC(CCc3ccccc3)CC2)cc1OC ZINC000011720580 845829140 /nfs/dbraw/zinc/82/91/40/845829140.db2.gz UUNVISIRALNSOO-LJQANCHMSA-N 0 3 410.558 4.053 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3ccc(OCC(C)C)c(OC)c3)cc2)CC1 ZINC000011945999 845842950 /nfs/dbraw/zinc/84/29/50/845842950.db2.gz XBJFHLCDHYVDJG-UHFFFAOYSA-N 0 3 411.546 4.124 20 0 HIADHN O=C(N[C@@H]1CCN(Cc2ccccc2)C1)c1cc(-c2ccccn2)nc2ccccc21 ZINC000013049036 845904156 /nfs/dbraw/zinc/90/41/56/845904156.db2.gz OZHHOXCIDVOXOG-HXUWFJFHSA-N 0 3 408.505 4.301 20 0 HIADHN Cc1nn(Cc2ccc(C)cc2)c(Cl)c1C(=O)NC[C@@H](c1ccccc1)N(C)C ZINC000016599166 846189262 /nfs/dbraw/zinc/18/92/62/846189262.db2.gz AWHNBBZFBUGECJ-FQEVSTJZSA-N 0 3 410.949 4.234 20 0 HIADHN CN(C)[C@@H](CNC(=O)COc1ccc(C2SCCCS2)cc1)c1ccccc1 ZINC000016599624 846189669 /nfs/dbraw/zinc/18/96/69/846189669.db2.gz SHQSOHLVBGOBBN-FQEVSTJZSA-N 0 3 416.612 4.353 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)CSc3ccc4ccccc4n3)cc2)CC1 ZINC000018186518 846307291 /nfs/dbraw/zinc/30/72/91/846307291.db2.gz ZJCOSKULYSXGMR-UHFFFAOYSA-N 0 3 406.555 4.108 20 0 HIADHN Cc1cccc2nc(C3CCN(C(=O)N[C@H]4CCN(C)[C@@H]4c4ccccc4)CC3)oc21 ZINC000436370738 861709747 /nfs/dbraw/zinc/70/97/47/861709747.db2.gz ZZZXPNKJGSCJOV-RBBKRZOGSA-N 0 3 418.541 4.471 20 0 HIADHN CCOC(=O)c1sc2ncnc(NC[C@H](c3ccco3)N3CCCC3)c2c1C ZINC000023745027 846746218 /nfs/dbraw/zinc/74/62/18/846746218.db2.gz HKBLMLDEHOBARQ-CQSZACIVSA-N 0 3 400.504 4.018 20 0 HIADHN CCO[C@@H]1C[C@@](CO)(NCc2cccc(NC(=O)c3ccccc3Cl)c2)C1(C)C ZINC000436377594 861719522 /nfs/dbraw/zinc/71/95/22/861719522.db2.gz IGDDAYRNOOXRKS-OFNKIYASSA-N 0 3 416.949 4.248 20 0 HIADHN O=C(CN[C@@H](Cc1ccccc1)c1ccccc1)NCc1cnn(-c2ccccc2)c1 ZINC000024735020 846860193 /nfs/dbraw/zinc/86/01/93/846860193.db2.gz HNIDNNXJAFPECI-VWLOTQADSA-N 0 3 410.521 4.062 20 0 HIADHN Cc1c(C(=O)N[C@@H](CN2CCCC2)c2ccccc2)cnn1-c1cccc(Cl)c1 ZINC000024984307 846899576 /nfs/dbraw/zinc/89/95/76/846899576.db2.gz RAWSXVMGPHDXOP-QFIPXVFZSA-N 0 3 408.933 4.401 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)COc3ccc(Cl)c(C)c3)c(C)c2)CC1 ZINC000025185711 846939490 /nfs/dbraw/zinc/93/94/90/846939490.db2.gz WGZGIYDRGOKGPB-UHFFFAOYSA-N 0 3 401.938 4.116 20 0 HIADHN O[C@H](COc1cc(Cl)ccc1Cl)CN1CCC[C@@H]1c1ccc2c(c1)OCCO2 ZINC000025227995 846945091 /nfs/dbraw/zinc/94/50/91/846945091.db2.gz UFVHFZPLLCCBHD-FUHWJXTLSA-N 0 3 424.324 4.341 20 0 HIADHN Cc1noc2nc(-c3ccccc3)cc(C(=O)N[C@@H]3CCN(Cc4ccccc4)C3)c12 ZINC000025252777 846947878 /nfs/dbraw/zinc/94/78/78/846947878.db2.gz LPYQITCILLNYLJ-HXUWFJFHSA-N 0 3 412.493 4.203 20 0 HIADHN COc1cc(CNCc2ccc(NC(C)=O)cc2)ccc1OCc1c(C)noc1C ZINC000025312969 846958709 /nfs/dbraw/zinc/95/87/09/846958709.db2.gz ZSFVPBZBZNTZNY-UHFFFAOYSA-N 0 3 409.486 4.127 20 0 HIADHN Cc1ccc(NC(=O)[C@@H](NC2CCN(C(=O)c3ccoc3)CC2)c2ccccc2)cc1 ZINC000025480458 846985476 /nfs/dbraw/zinc/98/54/76/846985476.db2.gz HQABBRDKEKFHFE-QHCPKHFHSA-N 0 3 417.509 4.162 20 0 HIADHN CC(C)[C@@H](CNC(=O)c1ccc(OC[C@H]2CCCO2)cc1)N1CCc2ccccc2C1 ZINC000025534528 846994683 /nfs/dbraw/zinc/99/46/83/846994683.db2.gz OXRTVUAXYFYNJV-JWQCQUIFSA-N 0 3 422.569 4.057 20 0 HIADHN Cc1onc(-c2ccccc2)c1C(=O)NC[C@@H](C(C)C)N1CCc2ccccc2C1 ZINC000025534552 846994697 /nfs/dbraw/zinc/99/46/97/846994697.db2.gz COSPLISMHUIAMW-QFIPXVFZSA-N 0 3 403.526 4.463 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1ccccc1Br)c1cccc(OC)c1 ZINC000025858542 847047547 /nfs/dbraw/zinc/04/75/47/847047547.db2.gz XBFRINQKQUMPHJ-IBGZPJMESA-N 0 3 405.336 4.271 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cnn(-c2ccccc2F)c1C)c1cccc(OC)c1 ZINC000025863581 847048289 /nfs/dbraw/zinc/04/82/89/847048289.db2.gz HGLOZRBGNHXABH-HSZRJFAPSA-N 0 3 424.520 4.141 20 0 HIADHN Cn1c2ccc(C(F)(F)F)cc2nc1CNC[C@@]1(O)CCC[C@@H](C(F)(F)F)C1 ZINC000436408774 861758826 /nfs/dbraw/zinc/75/88/26/861758826.db2.gz WWPPWEUCVVDULJ-MLGOLLRUSA-N 0 3 409.374 4.165 20 0 HIADHN COc1ccc(CN(C)CCC(=O)N[C@H]2CCCc3ccccc32)cc1OC(F)F ZINC000026453590 847152331 /nfs/dbraw/zinc/15/23/31/847152331.db2.gz ZLMDZHMYGBAQFB-IBGZPJMESA-N 0 3 418.484 4.312 20 0 HIADHN COc1ccc(CN(C)C(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)cc1 ZINC000026522149 847162211 /nfs/dbraw/zinc/16/22/11/847162211.db2.gz GFBUWVORFTUEFW-HXUWFJFHSA-N 0 3 401.576 4.371 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)/C=C/c3ccc(Br)o3)c(C)c2)CC1 ZINC000026908623 847220890 /nfs/dbraw/zinc/22/08/90/847220890.db2.gz XIRDXUSAFVVEOC-RMKNXTFCSA-N 0 3 418.335 4.144 20 0 HIADHN CCOc1ccccc1NC(=O)[C@H](c1ccccc1)N1CCN(C2CCCC2)CC1 ZINC000027118386 847250574 /nfs/dbraw/zinc/25/05/74/847250574.db2.gz KLHJVRPHFJJOLZ-DEOSSOPVSA-N 0 3 407.558 4.325 20 0 HIADHN COc1ccc(CN(C)C[C@@H](O)COc2cccc3ccccc32)cc1OC(F)F ZINC000027210021 847266830 /nfs/dbraw/zinc/26/68/30/847266830.db2.gz FIZMJSMNVCRAQP-GOSISDBHSA-N 0 3 417.452 4.322 20 0 HIADHN CCOc1cc(CN[C@@H](C)c2cc(C)sc2C)ccc1O[C@H](C)C(=O)N(C)C ZINC000027218275 847268190 /nfs/dbraw/zinc/26/81/90/847268190.db2.gz WPWVPVITTCKKNH-JKSUJKDBSA-N 0 3 404.576 4.470 20 0 HIADHN Cc1nc(COc2ccc(CN[C@H](C)c3ccc4c(c3)NC(=O)CO4)cc2)cs1 ZINC000027221548 847268619 /nfs/dbraw/zinc/26/86/19/847268619.db2.gz FRZHNLVKECADIN-CQSZACIVSA-N 0 3 409.511 4.212 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)c2ccccc2OCc2c(C)noc2C)N(C)C)cc1 ZINC000027598132 847326065 /nfs/dbraw/zinc/32/60/65/847326065.db2.gz KBEQOEJRGMICQH-HSZRJFAPSA-N 0 3 421.541 4.466 20 0 HIADHN C[C@H](CN1CCCCC1)NC(=O)c1cnn(-c2cccc(C(F)(F)F)c2)c1C1CC1 ZINC000027767618 847349227 /nfs/dbraw/zinc/34/92/27/847349227.db2.gz NEEWTIPSKNPTGQ-OAHLLOKOSA-N 0 3 420.479 4.373 20 0 HIADHN COc1ccc2cc(CN(C)C(=O)NCCCN3CCc4ccccc4C3)ccc2c1 ZINC000028353134 847410548 /nfs/dbraw/zinc/41/05/48/847410548.db2.gz RXNOCTWFPALTDT-UHFFFAOYSA-N 0 3 417.553 4.438 20 0 HIADHN CN(CCC(=O)NCc1ccccc1Cl)Cc1ccc(Br)s1 ZINC000028885012 847471854 /nfs/dbraw/zinc/47/18/54/847471854.db2.gz CLYSQBHHMJGPEH-UHFFFAOYSA-N 0 3 401.757 4.302 20 0 HIADHN Cc1nc2c(cnn2C(C)C)cc1C(=O)NC[C@H](C(C)C)N1CCc2ccccc2C1 ZINC000029174300 847519592 /nfs/dbraw/zinc/51/95/92/847519592.db2.gz ARVHXYBFYSCPBA-HSZRJFAPSA-N 0 3 419.573 4.133 20 0 HIADHN COc1ccc2c(CC(=O)NC[C@@H](C(C)C)N3CCc4ccccc4C3)coc2c1 ZINC000029174705 847520685 /nfs/dbraw/zinc/52/06/85/847520685.db2.gz FIUPJPJHTXRCFY-QHCPKHFHSA-N 0 3 406.526 4.183 20 0 HIADHN O=C(NCc1ccccc1OC(F)(F)F)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000029326946 847545709 /nfs/dbraw/zinc/54/57/09/847545709.db2.gz GMSCTOSLCLPSEX-SFHVURJKSA-N 0 3 407.436 4.222 20 0 HIADHN COc1ccc2cc(CNC(=O)N[C@H](CN3CCCC3)c3ccccc3)ccc2c1 ZINC000029724919 847609741 /nfs/dbraw/zinc/60/97/41/847609741.db2.gz WAPYWZOVGVRNLM-XMMPIXPASA-N 0 3 403.526 4.485 20 0 HIADHN CC(C)(CNC(=O)N[C@H](c1ccccc1)c1ccccn1)N1CCc2ccccc2C1 ZINC000029731694 847610966 /nfs/dbraw/zinc/61/09/66/847610966.db2.gz RGSOLZYUCDYHHM-XMMPIXPASA-N 0 3 414.553 4.307 20 0 HIADHN Cc1ccc(-c2nc(CC(=O)NCCCN3CCc4ccccc4C3)cs2)cc1 ZINC000029839929 847629693 /nfs/dbraw/zinc/62/96/93/847629693.db2.gz WKKXGYMRGFSZLH-UHFFFAOYSA-N 0 3 405.567 4.226 20 0 HIADHN CC[C@@H](CNC(=O)CCc1c(C)nn(CC(C)C)c1C)N1CCc2ccccc2C1 ZINC000029911096 847647718 /nfs/dbraw/zinc/64/77/18/847647718.db2.gz GCCPLQZXEVPDPA-QHCPKHFHSA-N 0 3 410.606 4.042 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)CN(C)[C@@H](C)c3cc4ccccc4o3)cc2)CC1 ZINC000030005650 847668495 /nfs/dbraw/zinc/66/84/95/847668495.db2.gz INIHLUIGGJLZEX-IBGZPJMESA-N 0 3 420.557 4.206 20 0 HIADHN Fc1ccccc1COc1ccc(CNCc2ccc(Cn3cncn3)cc2)cc1 ZINC000030634538 847748689 /nfs/dbraw/zinc/74/86/89/847748689.db2.gz VOHJZPMNKRVODG-UHFFFAOYSA-N 0 3 402.473 4.334 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1ccc(NC(=O)[C@@H]2C[C@@H]2C)cc1)c1cccc(OC)c1 ZINC000030680595 847758457 /nfs/dbraw/zinc/75/84/57/847758457.db2.gz GQICPRGVVDVYFQ-JJEOQYAHSA-N 0 3 423.557 4.103 20 0 HIADHN Cc1cc(CNCc2ccccc2Cn2cncn2)cc(C)c1OCc1ccccn1 ZINC000030900712 847794169 /nfs/dbraw/zinc/79/41/69/847794169.db2.gz JYHSAKIDCFMPMV-UHFFFAOYSA-N 0 3 413.525 4.207 20 0 HIADHN c1c(CNCc2ccc(N3CCCC3)nc2)c(-c2ccncc2)nn1-c1ccccc1 ZINC000030900259 847794593 /nfs/dbraw/zinc/79/45/93/847794593.db2.gz YHKYVXNAOWKAHL-UHFFFAOYSA-N 0 3 410.525 4.219 20 0 HIADHN C[C@@H]1CCC[C@H](C)N1C(=O)COc1ccc(C(=O)Nc2ccccc2CN(C)C)cc1 ZINC000031232677 847848272 /nfs/dbraw/zinc/84/82/72/847848272.db2.gz KNHDKKRWDIKLFP-KDURUIRLSA-N 0 3 423.557 4.169 20 0 HIADHN Cc1[nH]c2ccc(Br)cc2c1CC(=O)NC[C@H](c1ccccc1)N(C)C ZINC000031519783 847899814 /nfs/dbraw/zinc/89/98/14/847899814.db2.gz HZADLVKYBKRNTJ-HXUWFJFHSA-N 0 3 414.347 4.200 20 0 HIADHN CCOC(=O)c1cc2cc(C(=O)NC[C@@H](c3ccsc3)N(CC)CC)ccc2[nH]1 ZINC000031984133 847974518 /nfs/dbraw/zinc/97/45/18/847974518.db2.gz GTGZCUAWVJSOOR-FQEVSTJZSA-N 0 3 413.543 4.219 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1sc(-c2ccccn2)nc1C)c1ccsc1 ZINC000031985946 847974976 /nfs/dbraw/zinc/97/49/76/847974976.db2.gz LLPAKGDFLGIOHT-QGZVFWFLSA-N 0 3 400.573 4.388 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cnn(-c2ccccc2F)c1C)c1ccsc1 ZINC000031984370 847975072 /nfs/dbraw/zinc/97/50/72/847975072.db2.gz NAUPSAIOOAPMCC-HXUWFJFHSA-N 0 3 400.523 4.194 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1ccc(Cl)c(N2CCCC2=O)c1)c1ccsc1 ZINC000031986184 847975092 /nfs/dbraw/zinc/97/50/92/847975092.db2.gz XLFUOPXEDNYGNJ-LJQANCHMSA-N 0 3 419.978 4.341 20 0 HIADHN CCN(CC)[C@H](CNC(=O)[C@H](NC(=O)c1cccc(C)c1)C(C)C)c1ccsc1 ZINC000031987752 847975955 /nfs/dbraw/zinc/97/59/55/847975955.db2.gz DSXINAGOGQOVHK-NHCUHLMSSA-N 0 3 415.603 4.010 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)CCOc3ccccc3Cl)c(C)c2)CC1 ZINC000032235497 847992658 /nfs/dbraw/zinc/99/26/58/847992658.db2.gz NKYQWLCDAHTVRC-UHFFFAOYSA-N 0 3 401.938 4.198 20 0 HIADHN O=C(CCCc1nc(-c2cccs2)no1)NC[C@H](c1cccs1)N1CCCC1 ZINC000032485358 848037695 /nfs/dbraw/zinc/03/76/95/848037695.db2.gz VNFHPVUKJWFYCY-OAHLLOKOSA-N 0 3 416.572 4.136 20 0 HIADHN O=C(Cc1csc(-c2cccs2)n1)NC[C@@H](c1cccs1)N1CCCC1 ZINC000032762020 848072475 /nfs/dbraw/zinc/07/24/75/848072475.db2.gz YVYXJXDWKIDVPH-HNNXBMFYSA-N 0 3 403.598 4.429 20 0 HIADHN CN1CCN(CCCNC(=O)c2ccc(Cl)cc2Cl)[C@@H](c2ccccc2)C1 ZINC000033135250 848112192 /nfs/dbraw/zinc/11/21/92/848112192.db2.gz YQBIXIGBDIJCOF-HXUWFJFHSA-N 0 3 406.357 4.102 20 0 HIADHN Cc1cc(CSc2ccccc2C(=O)NC[C@@H](Cc2ccccc2)N(C)C)on1 ZINC000041799397 848252609 /nfs/dbraw/zinc/25/26/09/848252609.db2.gz QZMVMBLWUBUGOY-LJQANCHMSA-N 0 3 409.555 4.178 20 0 HIADHN CC(C)C(=O)N1CCC(NCc2c(Cl)n(-c3ccccc3)nc2C(C)C)CC1 ZINC000042225723 848304194 /nfs/dbraw/zinc/30/41/94/848304194.db2.gz CJCCKTGWXDJFDW-UHFFFAOYSA-N 0 3 402.970 4.386 20 0 HIADHN COc1ccc(CNCc2ccc(Cn3ccnc3)cc2)cc1OCc1cccnc1 ZINC000042228092 848305485 /nfs/dbraw/zinc/30/54/85/848305485.db2.gz KMXXGZFXSRBXBP-UHFFFAOYSA-N 0 3 414.509 4.204 20 0 HIADHN O[C@@H](COc1cc(Cl)ccc1Cl)CN1CCC([C@H](O)c2ccccc2)CC1 ZINC000042657706 848340417 /nfs/dbraw/zinc/34/04/17/848340417.db2.gz ILDADSSZZDBLRT-WIYYLYMNSA-N 0 3 410.341 4.179 20 0 HIADHN CCN(Cc1ccc(OC)c(OC)c1)C(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000043231135 848396743 /nfs/dbraw/zinc/39/67/43/848396743.db2.gz RLIRGDMWHWHJBA-SFHVURJKSA-N 0 3 417.575 4.134 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)Nc1nc(CN2CCCCC2)cs1 ZINC000043517555 848434945 /nfs/dbraw/zinc/43/49/45/848434945.db2.gz XCHXFYKKXROJPQ-HXUWFJFHSA-N 0 3 413.591 4.088 20 0 HIADHN CC(C)CC(=O)Nc1ccc(NC(=O)NCC2(N3CCSCC3)CCCC2)cc1 ZINC000044031077 848504261 /nfs/dbraw/zinc/50/42/61/848504261.db2.gz FKWZORWRBFKPJQ-UHFFFAOYSA-N 0 3 418.607 4.154 20 0 HIADHN S=C(NCCCCN1CCN(Cc2ccccc2)CC1)Nc1ccccc1Cl ZINC000044238469 848536004 /nfs/dbraw/zinc/53/60/04/848536004.db2.gz YYHCBXWCBAPFSN-UHFFFAOYSA-N 0 3 417.022 4.224 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)c1cccc(OCc2cccnc2)c1 ZINC000044314680 848544999 /nfs/dbraw/zinc/54/49/99/848544999.db2.gz ZSVHYZHDBVALLD-DEOSSOPVSA-N 0 3 401.510 4.228 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3c(C)oc4ccc(OC)cc43)c(C)c2)CC1 ZINC000044877160 848611703 /nfs/dbraw/zinc/61/17/03/848611703.db2.gz JNWKTSUBJBLTRK-UHFFFAOYSA-N 0 3 407.514 4.452 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N[C@H](C)c1ccc2c(c1)CCC(=O)N2)c1ccsc1 ZINC000046253834 848812081 /nfs/dbraw/zinc/81/20/81/848812081.db2.gz HWRPPERRXCODTL-QRWLVFNGSA-N 0 3 414.575 4.076 20 0 HIADHN COC(=O)C1CCN(CCCNc2ncnc3scc(-c4ccccc4)c32)CC1 ZINC000046920075 848960399 /nfs/dbraw/zinc/96/03/99/848960399.db2.gz RDDJXRZTBWUBGG-UHFFFAOYSA-N 0 3 410.543 4.045 20 0 HIADHN Cc1ccccc1CN1CCCN(C(=O)NCc2cc(-c3ccccc3)no2)CC1 ZINC000047083888 848982363 /nfs/dbraw/zinc/98/23/63/848982363.db2.gz VATPAZUMJFNIDD-UHFFFAOYSA-N 0 3 404.514 4.068 20 0 HIADHN CCn1c(SCC(=O)Nc2cccc(CN(C)C)c2)nnc1-c1cccc(C)c1 ZINC000047453699 849050954 /nfs/dbraw/zinc/05/09/54/849050954.db2.gz JASDVGIHFHFTLS-UHFFFAOYSA-N 0 3 409.559 4.066 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)NCc3ccc(Cl)cc3)CC2)c1 ZINC000047578623 849075876 /nfs/dbraw/zinc/07/58/76/849075876.db2.gz OMPHQLQYKFZLRN-UHFFFAOYSA-N 0 3 414.981 4.050 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCc3cc(-c4ccccc4)no3)c(C)c2)CC1 ZINC000047746828 849103033 /nfs/dbraw/zinc/10/30/33/849103033.db2.gz KDVBQZHOSINKMN-UHFFFAOYSA-N 0 3 419.529 4.114 20 0 HIADHN CCCC(=O)Nc1ccc(CNC(=O)NC[C@H](c2ccccc2)N2CCCC2)cc1 ZINC000047949263 849142980 /nfs/dbraw/zinc/14/29/80/849142980.db2.gz YBQTZFMKNSARFE-JOCHJYFZSA-N 0 3 408.546 4.062 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N[C@@H](c1ccccc1)c1ccccn1 ZINC000047950485 849143639 /nfs/dbraw/zinc/14/36/39/849143639.db2.gz ACFTXAOIFKLJJM-IRLDBZIGSA-N 0 3 406.555 4.369 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)c2cccc(NC(=O)c3ccco3)c2)N(C)C)cc1 ZINC000048381082 849214778 /nfs/dbraw/zinc/21/47/78/849214778.db2.gz BTYNWLUMTXSTFS-OAQYLSRUSA-N 0 3 405.498 4.127 20 0 HIADHN Cc1nn(-c2ccc(F)cc2F)c(C)c1CNC[C@H](c1ccco1)N1CCCC1 ZINC000048681192 849254263 /nfs/dbraw/zinc/25/42/63/849254263.db2.gz HWUQTAJWSLTPMB-OAQYLSRUSA-N 0 3 400.473 4.287 20 0 HIADHN Cc1nn(-c2ccc(F)cc2F)c(C)c1CNCc1ccc(Cn2cccn2)cc1 ZINC000048685368 849255138 /nfs/dbraw/zinc/25/51/38/849255138.db2.gz GWNOHGUOUCNNJD-UHFFFAOYSA-N 0 3 407.468 4.302 20 0 HIADHN COc1ccc(CSCC(=O)C(C#N)c2nc3ccccc3s2)cc1[N+](=O)[O-] ZINC000048824381 849271599 /nfs/dbraw/zinc/27/15/99/849271599.db2.gz DOADVLHBKIDFBQ-CYBMUJFWSA-N 0 3 413.480 4.323 20 0 HIADHN Cc1ccc(OC(F)F)c([C@@H](C)[NH2+]C2CCN(C(=O)c3ccccc3[O-])CC2)c1 ZINC000436825260 862005272 /nfs/dbraw/zinc/00/52/72/862005272.db2.gz CHWWTKBAWYFXLP-OAHLLOKOSA-N 0 3 404.457 4.257 20 0 HIADHN CN(C)Cc1ccccc1NC(=O)c1cccc(NC(=O)c2ccc3[nH]cnc3c2)c1 ZINC000050030012 849342954 /nfs/dbraw/zinc/34/29/54/849342954.db2.gz BTMDSPJDQMPLEG-UHFFFAOYSA-N 0 3 413.481 4.129 20 0 HIADHN O=C(NCc1ccnc(OCc2ccccc2)c1)c1cccc(CN2CCCC2)c1 ZINC000050032067 849343616 /nfs/dbraw/zinc/34/36/16/849343616.db2.gz BFMBLQKNPGYXJT-UHFFFAOYSA-N 0 3 401.510 4.186 20 0 HIADHN C[C@@H]([NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1)c1ccc(OCC(F)(F)F)cc1 ZINC000436829318 862010233 /nfs/dbraw/zinc/01/02/33/862010233.db2.gz ORYVBNWHVCLYKO-OAHLLOKOSA-N 0 3 422.447 4.289 20 0 HIADHN C[C@H]([NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1)c1nc(-c2ccccc2)cs1 ZINC000436829853 862010593 /nfs/dbraw/zinc/01/05/93/862010593.db2.gz PQWWVMFPBQCASB-INIZCTEOSA-N 0 3 407.539 4.471 20 0 HIADHN C[C@@H]([NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1)c1cccc(Br)c1 ZINC000436830317 862010789 /nfs/dbraw/zinc/01/07/89/862010789.db2.gz QIBNVSHHFSCCLB-CQSZACIVSA-N 0 3 403.320 4.110 20 0 HIADHN O=C(c1ccccc1[O-])N1CCC([NH2+][C@@H]2CCCOc3cc4c(cc32)CCCC4)CC1 ZINC000436832817 862012704 /nfs/dbraw/zinc/01/27/04/862012704.db2.gz WIPPRPHAOOCWQD-HSZRJFAPSA-N 0 3 420.553 4.379 20 0 HIADHN O=C(NC[C@H]1CCCN(Cc2cccs2)C1)c1ccn(-c2ccccc2Cl)n1 ZINC000050631528 849400892 /nfs/dbraw/zinc/40/08/92/849400892.db2.gz RZBXMRRKQBYOMW-MRXNPFEDSA-N 0 3 414.962 4.229 20 0 HIADHN Cc1ccc(C(=O)NC2CCN(C[C@@H](O)c3ccc(C(F)(F)F)cc3)CC2)s1 ZINC000051098213 849432384 /nfs/dbraw/zinc/43/23/84/849432384.db2.gz VUZSOALGPRYQBP-QGZVFWFLSA-N 0 3 412.477 4.003 20 0 HIADHN CC(=O)c1cccc(OC[C@@H](O)CN2CCC(c3c(C)[nH]c4ccccc43)CC2)c1 ZINC000051473273 849473277 /nfs/dbraw/zinc/47/32/77/849473277.db2.gz ASLPZLPJDRMCJZ-NRFANRHFSA-N 0 3 406.526 4.298 20 0 HIADHN Cc1ccc(C(=O)N(Cc2ccncc2)[C@@H]2CCCN(Cc3ccccc3)C2)c(O)c1 ZINC000436850559 862026999 /nfs/dbraw/zinc/02/69/99/862026999.db2.gz IKMCZFXAPGUXGF-HSZRJFAPSA-N 0 3 415.537 4.403 20 0 HIADHN Cc1ccccc1[C@H]1CCCN1CC(=O)N1CCC(C(=O)Nc2ccccc2)CC1 ZINC000052211708 849560564 /nfs/dbraw/zinc/56/05/64/849560564.db2.gz MVXZPSMZQWZPPK-HSZRJFAPSA-N 0 3 405.542 4.009 20 0 HIADHN CN(C)[C@@H](CNC(=O)N(CCc1ccccc1)Cc1cccnc1)Cc1ccccc1 ZINC000052499440 849588922 /nfs/dbraw/zinc/58/89/22/849588922.db2.gz QDHADNIAQCHLBV-RUZDIDTESA-N 0 3 416.569 4.009 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1ccc(NC(=O)NC(C)C)cc1)c1ccsc1 ZINC000052877954 849638826 /nfs/dbraw/zinc/63/88/26/849638826.db2.gz MTSXTMFWXHRWKC-LJQANCHMSA-N 0 3 402.564 4.091 20 0 HIADHN CN(Cc1ccc(OC(F)F)cc1)C(=O)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000053547618 849729863 /nfs/dbraw/zinc/72/98/63/849729863.db2.gz HCEZGUJEBKJGHX-FQEVSTJZSA-N 0 3 403.473 4.267 20 0 HIADHN CSc1ccc(Cl)c(C(=O)Nc2cccc(CN3CCC(C(N)=O)CC3)c2)c1 ZINC000053996645 849790293 /nfs/dbraw/zinc/79/02/93/849790293.db2.gz KASMBAYHQBMMNY-UHFFFAOYSA-N 0 3 417.962 4.012 20 0 HIADHN CCn1c(CNC2CCN(c3ccc(C(F)(F)F)cn3)CC2)nc2ccccc21 ZINC000054175126 849820515 /nfs/dbraw/zinc/82/05/15/849820515.db2.gz PHJYKPWUCIMIEU-UHFFFAOYSA-N 0 3 403.452 4.229 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)CCN(Cc1cccs1)C[C@H]1CCCO1 ZINC000054427656 849866014 /nfs/dbraw/zinc/86/60/14/849866014.db2.gz OYHBCCUQOBHISZ-MRXNPFEDSA-N 0 3 408.951 4.420 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N(Cc1ccccc1)C[C@@H]1CCCO1 ZINC000054541891 849886529 /nfs/dbraw/zinc/88/65/29/849886529.db2.gz YLDPXGWIYAFQOI-LEWJYISDSA-N 0 3 413.587 4.276 20 0 HIADHN Cc1cccc(-n2c(=S)n(CN3CCN(CC4CC4)CC3)nc2-c2ccccc2)c1 ZINC000054551259 849887178 /nfs/dbraw/zinc/88/71/78/849887178.db2.gz IHGHNVUFEMANBK-UHFFFAOYSA-N 0 3 419.598 4.364 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)N2CCC(c3nc4ccccc4[nH]3)CC2)C1 ZINC000054717625 849912339 /nfs/dbraw/zinc/91/23/39/849912339.db2.gz MQMWQCQAFUHDQK-RXVVDRJESA-N 0 3 417.557 4.287 20 0 HIADHN CCN(Cc1ccc(OC)c(OC)c1)C(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000054717170 849912684 /nfs/dbraw/zinc/91/26/84/849912684.db2.gz XNHHAGOIGONCLS-GHTZIAJQSA-N 0 3 411.546 4.071 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N(C)Cc2ccc(OC(F)F)cc2)C1 ZINC000054718545 849913192 /nfs/dbraw/zinc/91/31/92/849913192.db2.gz MPJGSQHHZWGNRA-APWZRJJASA-N 0 3 403.473 4.265 20 0 HIADHN O[C@H](CNCc1cc(Br)ccc1OCc1ccccn1)c1ccccc1 ZINC000055371651 850007695 /nfs/dbraw/zinc/00/76/95/850007695.db2.gz MOJXODILMQUNBF-HXUWFJFHSA-N 0 3 413.315 4.246 20 0 HIADHN C[C@H]([NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000436909834 862085989 /nfs/dbraw/zinc/08/59/89/862085989.db2.gz NYNLTGBQDJRLJJ-RRQGHBQHSA-N 0 3 404.963 4.494 20 0 HIADHN COc1cc(-c2nc(CN3CCCN(Cc4ccccc4)CC3)cs2)ccc1O ZINC000436931274 862109687 /nfs/dbraw/zinc/10/96/87/862109687.db2.gz KECNOYZHCZYSOU-UHFFFAOYSA-N 0 3 409.555 4.232 20 0 HIADHN CCc1cccc(CC)c1NC(=O)CNc1ccc(N2CCN(CC)CC2)cc1C ZINC000056170255 850269008 /nfs/dbraw/zinc/26/90/08/850269008.db2.gz HSVIWZURTOSRPV-UHFFFAOYSA-N 0 3 408.590 4.312 20 0 HIADHN CCN1CCN(c2ccc(N[C@@H](C)C(=O)Nc3ccccc3Cl)c(C)c2)CC1 ZINC000056170288 850270684 /nfs/dbraw/zinc/27/06/84/850270684.db2.gz AJTURFKRGGBJJO-KRWDZBQOSA-N 0 3 400.954 4.229 20 0 HIADHN Cc1nc(NC(=O)N(CCN(C)C)Cc2ccc(Br)cc2)sc1C ZINC000056555212 850391562 /nfs/dbraw/zinc/39/15/62/850391562.db2.gz CTUGBMHILUEMCX-UHFFFAOYSA-N 0 3 411.369 4.118 20 0 HIADHN CC(=O)Nc1ccc(Cl)c(NC(=O)NC[C@H](c2ccccc2)N2CCCC2)c1 ZINC000056693113 850442303 /nfs/dbraw/zinc/44/23/03/850442303.db2.gz IFXYJVKXKLZBCW-HXUWFJFHSA-N 0 3 400.910 4.257 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)C1(c2ccc(Cl)cc2)CCOCC1 ZINC000057192566 850576617 /nfs/dbraw/zinc/57/66/17/850576617.db2.gz SQVNHMVPBQKWPO-JOCHJYFZSA-N 0 3 412.961 4.342 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCc1ncc(-c2ccccc2)o1)c1cccc(OC)c1 ZINC000057562161 850668071 /nfs/dbraw/zinc/66/80/71/850668071.db2.gz GJEHZQDQDXVIJQ-OAQYLSRUSA-N 0 3 422.529 4.233 20 0 HIADHN C[C@H](CNC(=O)C(=O)Nc1ccc(Sc2ccc(Cl)cc2)cc1)N1CCCC1 ZINC000057940532 850744990 /nfs/dbraw/zinc/74/49/90/850744990.db2.gz TZERQKHLYABQOP-OAHLLOKOSA-N 0 3 417.962 4.030 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)Nc1cccc(OCC(F)(F)F)c1 ZINC000058075786 850762483 /nfs/dbraw/zinc/76/24/83/850762483.db2.gz XTINVOMPKLMCPW-UHFFFAOYSA-N 0 3 417.497 4.111 20 0 HIADHN CC[C@H](c1ccccc1)[C@@H]1CCCN1CC(=O)Nc1ccccc1N1CCCC1=O ZINC000058524060 850845425 /nfs/dbraw/zinc/84/54/25/850845425.db2.gz WTKBDSXAZMHORI-IRLDBZIGSA-N 0 3 405.542 4.410 20 0 HIADHN Cc1cccc(NC(=O)NC[C@@H](c2ccccc2)N2CCCC2)c1C(=O)N1CCCC1 ZINC000058550748 850853891 /nfs/dbraw/zinc/85/38/91/850853891.db2.gz WYLCKWCUIKWNCQ-QFIPXVFZSA-N 0 3 420.557 4.190 20 0 HIADHN CCc1c(C(=O)NC[C@@H](c2cccc(OC)c2)N(CC)CC)cnn1-c1ccccc1 ZINC000058678803 850886250 /nfs/dbraw/zinc/88/62/50/850886250.db2.gz JTFDJVZFPQLYGU-DEOSSOPVSA-N 0 3 420.557 4.256 20 0 HIADHN CN(C)CCn1c(=O)oc2ccc(NC(=O)CCc3ccc(Cl)cc3Cl)cc21 ZINC000058739239 850908933 /nfs/dbraw/zinc/90/89/33/850908933.db2.gz PGZCBXYPBFLKGP-UHFFFAOYSA-N 0 3 422.312 4.034 20 0 HIADHN Cc1ccc(-c2cnc(CCC(=O)N(CCN(C)C)Cc3ccc(F)cc3)o2)cc1 ZINC000059001317 850976412 /nfs/dbraw/zinc/97/64/12/850976412.db2.gz UIODSVBCJOYHLO-UHFFFAOYSA-N 0 3 409.505 4.312 20 0 HIADHN COC(=O)c1cc(NC(=O)NC[C@H](c2ccccc2)N2CCCC2)ccc1Cl ZINC000059041039 850982238 /nfs/dbraw/zinc/98/22/38/850982238.db2.gz PTZGAOMLDOXFDE-LJQANCHMSA-N 0 3 401.894 4.085 20 0 HIADHN Cn1ccnc1COc1ccc(CN2CCCN(Cc3ccc(Cl)cc3)CC2)cc1 ZINC000059421125 851007056 /nfs/dbraw/zinc/00/70/56/851007056.db2.gz IIRXBUIJPDRKMZ-UHFFFAOYSA-N 0 3 424.976 4.360 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)c2nc(-c3ccccc3)n3c2CCCCC3)o1 ZINC000060407191 851088998 /nfs/dbraw/zinc/08/89/98/851088998.db2.gz YRMANBROEBQTDF-UHFFFAOYSA-N 0 3 420.557 4.382 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)c2sc(NC(=O)c3ccco3)cc2C)o1 ZINC000060407360 851089795 /nfs/dbraw/zinc/08/97/95/851089795.db2.gz AQIFHGRXFSOGRJ-UHFFFAOYSA-N 0 3 415.515 4.007 20 0 HIADHN COc1ccc(CN(C)C[C@H](O)c2ccccc2C(F)(F)F)cc1OC(F)F ZINC000060468116 851109253 /nfs/dbraw/zinc/10/92/53/851109253.db2.gz ZYKJZIUXTBDAFU-HNNXBMFYSA-N 0 3 405.363 4.481 20 0 HIADHN COc1ccc(Br)cc1CNC[C@@H](c1ccccc1OC)N1CCCC1 ZINC000060832228 851225946 /nfs/dbraw/zinc/22/59/46/851225946.db2.gz VCGWJTOJAVTZAU-IBGZPJMESA-N 0 3 419.363 4.393 20 0 HIADHN CCOc1ccc(NC(=S)Nc2ccc(CCN3CCSCC3)cc2)cc1 ZINC000060837516 851226969 /nfs/dbraw/zinc/22/69/69/851226969.db2.gz PMZOAXOMXCZERN-UHFFFAOYSA-N 0 3 401.601 4.486 20 0 HIADHN O[C@H](CNCc1ccc(Br)cc1F)c1ccc(OC(F)(F)F)cc1 ZINC000060953082 851256161 /nfs/dbraw/zinc/25/61/61/851256161.db2.gz HBZXOKVMTVDCIO-OAHLLOKOSA-N 0 3 408.189 4.310 20 0 HIADHN O[C@H](CNCc1ccccc1OCc1ccncc1)c1ccc(OC(F)(F)F)cc1 ZINC000060952958 851256814 /nfs/dbraw/zinc/25/68/14/851256814.db2.gz OBQWKKZYKDMMRN-HXUWFJFHSA-N 0 3 418.415 4.382 20 0 HIADHN CCCCc1oc2ccccc2c1CNCc1ccc(S(=O)(=O)N(C)C)cc1 ZINC000061045154 851281775 /nfs/dbraw/zinc/28/17/75/851281775.db2.gz PIZJSZQJWLKDFN-UHFFFAOYSA-N 0 3 400.544 4.316 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)Nc3ccc(OC(F)F)c(F)c3)cc2)CC1 ZINC000061165758 851308849 /nfs/dbraw/zinc/30/88/49/851308849.db2.gz ISXNANWSSGESRR-UHFFFAOYSA-N 0 3 407.436 4.210 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N(Cc3ccccc3)C[C@@H]3CCCO3)cc2)CC1 ZINC000061190557 851313546 /nfs/dbraw/zinc/31/35/46/851313546.db2.gz MEUFQLLRKCHCKY-VWLOTQADSA-N 0 3 421.585 4.038 20 0 HIADHN Cc1cc(/C=C(/C#N)C(=O)NCc2ccccc2CN(C)C)c(C)n1CCC(C)C ZINC000061232171 851323830 /nfs/dbraw/zinc/32/38/30/851323830.db2.gz DVKWLSZVTVFNGU-OYKKKHCWSA-N 0 3 406.574 4.436 20 0 HIADHN C[C@@H](OC(=O)C1CCN(c2ccccc2Br)C1=O)c1c(F)cccc1F ZINC000061753258 851440974 /nfs/dbraw/zinc/44/09/74/851440974.db2.gz BIQCKCDCCADBNY-VXGBXAGGSA-N 0 3 424.241 4.385 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)C(=O)Nc1cc(Cl)cc(Cl)c1)c1ccccc1 ZINC000061878767 851467711 /nfs/dbraw/zinc/46/77/11/851467711.db2.gz LCASGLYIQIFOBI-SFHVURJKSA-N 0 3 408.329 4.131 20 0 HIADHN CC[C@@H](CNC(=O)NCc1ccccc1COC(C)C)N1CCc2ccccc2C1 ZINC000061953683 851478752 /nfs/dbraw/zinc/47/87/52/851478752.db2.gz XADOBPQOGNOPIY-DEOSSOPVSA-N 0 3 409.574 4.248 20 0 HIADHN CC(C)OCc1ccccc1CNC(=O)NCC(C)(C)N1CCc2ccccc2C1 ZINC000062016583 851491878 /nfs/dbraw/zinc/49/18/78/851491878.db2.gz FEGKIUXLRHWJTA-UHFFFAOYSA-N 0 3 409.574 4.248 20 0 HIADHN COC(=O)c1ccc(NC(=O)N(CCN(C)C)Cc2cccc(Cl)c2)c(C)c1 ZINC000062390938 851539554 /nfs/dbraw/zinc/53/95/54/851539554.db2.gz IAFOQLUGLUTYRX-UHFFFAOYSA-N 0 3 403.910 4.031 20 0 HIADHN CCC(=O)Nc1ccc(C)c(NC(=O)N(CCN(C)C)Cc2cccc(F)c2)c1 ZINC000062392281 851539960 /nfs/dbraw/zinc/53/99/60/851539960.db2.gz IBPHVJYRYCVFAD-UHFFFAOYSA-N 0 3 400.498 4.078 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)Nc1nnc(-c2ccsc2)s1 ZINC000062406810 851544009 /nfs/dbraw/zinc/54/40/09/851544009.db2.gz PZVZLCWFKXVEFR-UHFFFAOYSA-N 0 3 423.514 4.141 20 0 HIADHN COC(=O)N(C)c1ccc(NC(=O)N(CCN(C)C)Cc2cccc(Cl)c2)cc1 ZINC000062410768 851546045 /nfs/dbraw/zinc/54/60/45/851546045.db2.gz OZLJAUZQSZQZKT-UHFFFAOYSA-N 0 3 418.925 4.138 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)NCCCc1ccccc1 ZINC000062473969 851559126 /nfs/dbraw/zinc/55/91/26/851559126.db2.gz HLODZBJIDANFHA-UHFFFAOYSA-N 0 3 407.480 4.411 20 0 HIADHN CCOc1ccc([C@@H](C)NC(=O)N(CCN(C)C)Cc2ccc(F)cc2F)cc1 ZINC000062477027 851560482 /nfs/dbraw/zinc/56/04/82/851560482.db2.gz VMCRMTCZDWYMOQ-MRXNPFEDSA-N 0 3 405.489 4.198 20 0 HIADHN COCc1ccc(CNC(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)cc1 ZINC000062485504 851562751 /nfs/dbraw/zinc/56/27/51/851562751.db2.gz KWXQFFSEWGCMRW-UHFFFAOYSA-N 0 3 423.479 4.125 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)N[C@H]1CCSc2ccccc21 ZINC000062486913 851562822 /nfs/dbraw/zinc/56/28/22/851562822.db2.gz PNTZELKQNPSHEO-IBGZPJMESA-N 0 3 405.514 4.275 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)NCCSC(F)(F)F ZINC000062488627 851564062 /nfs/dbraw/zinc/56/40/62/851564062.db2.gz WVYHSCJOOGCHOU-UHFFFAOYSA-N 0 3 417.419 4.032 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)NCCc1ccccc1C(F)(F)F ZINC000062499756 851566179 /nfs/dbraw/zinc/56/61/79/851566179.db2.gz KJVQCCAXEFJFQX-UHFFFAOYSA-N 0 3 411.443 4.160 20 0 HIADHN CC(C)Oc1ccccc1CNC(=O)N(CCN(C)C)Cc1cccc(Cl)c1 ZINC000062498977 851566348 /nfs/dbraw/zinc/56/63/48/851566348.db2.gz ODAVKOYYKBAJJU-UHFFFAOYSA-N 0 3 403.954 4.401 20 0 HIADHN Cc1[nH]c2ccc(CNC(=O)N(CCN(C)C)Cc3ccc(F)cc3F)cc2c1C ZINC000062502431 851566493 /nfs/dbraw/zinc/56/64/93/851566493.db2.gz VEBUGUFWJQMGPW-UHFFFAOYSA-N 0 3 414.500 4.336 20 0 HIADHN CC1CCN([C@H](CNC(=O)N(C)Cc2ccc3c(c2)OCO3)c2ccccc2)CC1 ZINC000062647644 851585244 /nfs/dbraw/zinc/58/52/44/851585244.db2.gz IANDCRWLACAWJJ-OAQYLSRUSA-N 0 3 409.530 4.030 20 0 HIADHN COc1ccc(-c2cc(NC(=S)NC3CCN(C)CC3)ccc2OC(F)F)cc1 ZINC000063144698 851619584 /nfs/dbraw/zinc/61/95/84/851619584.db2.gz IEJGYJTZQFDIMN-UHFFFAOYSA-N 0 3 421.513 4.344 20 0 HIADHN CN1CCC(NC(=S)Nc2ccc(OC(F)F)c(Cc3ccccc3)c2)CC1 ZINC000063145802 851622356 /nfs/dbraw/zinc/62/23/56/851622356.db2.gz OHEAGIJXUZCPCZ-UHFFFAOYSA-N 0 3 405.514 4.259 20 0 HIADHN CCCCOc1cccc(CNC(=S)NC2CCN(Cc3ccccc3)CC2)c1 ZINC000063149394 851623507 /nfs/dbraw/zinc/62/35/07/851623507.db2.gz WVAHCOUXSFHDPN-UHFFFAOYSA-N 0 3 411.615 4.494 20 0 HIADHN Cc1cc2oc(=O)cc(CN3CCC(C(=O)NCCc4cccs4)CC3)c2cc1C ZINC000063301779 851654786 /nfs/dbraw/zinc/65/47/86/851654786.db2.gz SNLZRUDKSFTDIF-UHFFFAOYSA-N 0 3 424.566 4.042 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)c2cccc(NC(=O)c3cccs3)c2)o1 ZINC000063497824 851703098 /nfs/dbraw/zinc/70/30/98/851703098.db2.gz HOKYAOAHPYWXDO-UHFFFAOYSA-N 0 3 411.527 4.106 20 0 HIADHN O[C@@H](CNCc1ccc(F)c(Br)c1)COc1cccc(C(F)(F)F)c1 ZINC000063548480 851711865 /nfs/dbraw/zinc/71/18/65/851711865.db2.gz QLIFZBUNAGOUDI-ZDUSSCGKSA-N 0 3 422.216 4.137 20 0 HIADHN COc1ccc(CNCc2ccc(-n3ccnc3)c(F)c2)cc1OCc1cccnc1 ZINC000063548751 851712142 /nfs/dbraw/zinc/71/21/42/851712142.db2.gz ADXMSWIMCWOMRY-UHFFFAOYSA-N 0 3 418.472 4.284 20 0 HIADHN COc1cc2c(cc1OC)CN(C(=O)CN1CCC[C@H]1c1ccc(C)c(C)c1)CC2 ZINC000063619487 851726117 /nfs/dbraw/zinc/72/61/17/851726117.db2.gz SZEYPYCNMZIEKT-QFIPXVFZSA-N 0 3 408.542 4.042 20 0 HIADHN CCOC(=O)c1c(C)c(C)sc1NC(=O)C[C@H](C)N[C@H](C)c1ccncc1OC ZINC000437082897 862276933 /nfs/dbraw/zinc/27/69/33/862276933.db2.gz MSKNXGBRBPZUEV-GXTWGEPZSA-N 0 3 419.547 4.013 20 0 HIADHN CN1C(=O)Cc2cc(-c3csc(NC4CCN(Cc5ccccc5)CC4)n3)ccc21 ZINC000063630515 851729668 /nfs/dbraw/zinc/72/96/68/851729668.db2.gz DMWFYCYUXHTKQY-UHFFFAOYSA-N 0 3 418.566 4.406 20 0 HIADHN O=C(Nc1cccnc1)c1ccc(NC(=O)c2cccc(CN3CCCC3)c2)cc1 ZINC000063916298 851793193 /nfs/dbraw/zinc/79/31/93/851793193.db2.gz FAJJSVGNPFAKJV-UHFFFAOYSA-N 0 3 400.482 4.182 20 0 HIADHN Cc1oncc1C(=O)Nc1ccc(NC(=O)c2cccc(CN3CCCC3)c2)cc1 ZINC000064026958 851817493 /nfs/dbraw/zinc/81/74/93/851817493.db2.gz ISJQLEPTCPGFHA-UHFFFAOYSA-N 0 3 404.470 4.083 20 0 HIADHN CCN(c1ccc(NC(=O)CN2CCN(CC3CCCCC3)CC2)cc1)C(C)C ZINC000064129940 851833663 /nfs/dbraw/zinc/83/36/63/851833663.db2.gz NFRUKEQSWHEYIK-UHFFFAOYSA-N 0 3 400.611 4.058 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N2CCO[C@@H](c3ccc(F)cc3)C2)N2CCCC2)cc1 ZINC000064237335 851855083 /nfs/dbraw/zinc/85/50/83/851855083.db2.gz ZUECQXUIZQQVHQ-DHIUTWEWSA-N 0 3 411.521 4.054 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=S)Nc1ccccc1C#N ZINC000064371328 851880711 /nfs/dbraw/zinc/88/07/11/851880711.db2.gz BQMRRPXAZGHKHZ-UHFFFAOYSA-N 0 3 406.477 4.338 20 0 HIADHN CCOC(=O)c1ccc(NC(=S)NC[C@@H]2CCCN(Cc3cccs3)C2)cc1 ZINC000064377967 851882746 /nfs/dbraw/zinc/88/27/46/851882746.db2.gz JAPGYJDWJGPWHI-INIZCTEOSA-N 0 3 417.600 4.123 20 0 HIADHN O=C(CCN1CCCN(c2nccs2)CC1)Nc1ccccc1Oc1ccccc1 ZINC000064401878 851890284 /nfs/dbraw/zinc/89/02/84/851890284.db2.gz QZQGIANUOMLJOB-UHFFFAOYSA-N 0 3 422.554 4.476 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)CCOc1ccccc1F ZINC000064470668 851905589 /nfs/dbraw/zinc/90/55/89/851905589.db2.gz LACOIVFWBJWLBG-UHFFFAOYSA-N 0 3 412.427 4.204 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)cc1 ZINC000064520540 851918818 /nfs/dbraw/zinc/91/88/18/851918818.db2.gz SBYYSAURBAQRMH-UHFFFAOYSA-N 0 3 422.451 4.260 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)c1ccnc(OCc2ccccc2)c1 ZINC000064745441 851974346 /nfs/dbraw/zinc/97/43/46/851974346.db2.gz CQGXCTRWMVQOLK-UHFFFAOYSA-N 0 3 407.489 4.004 20 0 HIADHN CO[C@@H](CNC(=O)N(CCN(C)C)Cc1ccc(C(F)(F)F)cc1)c1ccccc1 ZINC000064755136 851977868 /nfs/dbraw/zinc/97/78/68/851977868.db2.gz KIXDTVMRPFWACL-FQEVSTJZSA-N 0 3 423.479 4.166 20 0 HIADHN COc1ccc([C@H](CNc2ccc3nnc(-c4ccccc4)n3n2)N2CCCC2)cc1 ZINC000064904724 852017784 /nfs/dbraw/zinc/01/77/84/852017784.db2.gz CLDGZYGISPTNKH-NRFANRHFSA-N 0 3 414.513 4.049 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)CSc1ccncc1)c1ccc(C(F)(F)F)cc1 ZINC000065121950 852071953 /nfs/dbraw/zinc/07/19/53/852071953.db2.gz PLIVRNRWTSTZMF-SFHVURJKSA-N 0 3 411.493 4.392 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)c2ccccc2OCc2cscn2)C1 ZINC000065140507 852076160 /nfs/dbraw/zinc/07/61/60/852076160.db2.gz DKLQZXWLDTVSGI-IEBWSBKVSA-N 0 3 407.539 4.287 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)c2cnn(Cc3ccccc3Cl)c2)C1 ZINC000065140588 852076257 /nfs/dbraw/zinc/07/62/57/852076257.db2.gz RFQMGJPFIMJXEI-UWJYYQICSA-N 0 3 408.933 4.150 20 0 HIADHN CCOC(=O)C1=C(C)NC(SC[C@@H](O)c2ccc(F)cc2)=N[C@@H]1c1ccccc1 ZINC000065271023 852096813 /nfs/dbraw/zinc/09/68/13/852096813.db2.gz WKKULJYYZFOXJF-UYAOXDASSA-N 0 3 414.502 4.130 20 0 HIADHN Cc1ccc(NC(=O)[C@H](C)N[C@H](C)c2ccc(N3CCOCC3)cc2)c(Cl)c1 ZINC000065278352 852097685 /nfs/dbraw/zinc/09/76/85/852097685.db2.gz MDUZFUWAXYIVRS-SJORKVTESA-N 0 3 401.938 4.163 20 0 HIADHN COC(=O)c1cc(NC(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)ccc1Cl ZINC000065445368 852136619 /nfs/dbraw/zinc/13/66/19/852136619.db2.gz IXKSPFDCWOWELL-WMLDXEAASA-N 0 3 401.894 4.084 20 0 HIADHN COCCOc1ccc(NC(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)cc1Cl ZINC000065451172 852139627 /nfs/dbraw/zinc/13/96/27/852139627.db2.gz JPLLVAFTPOETTP-QFBILLFUSA-N 0 3 417.937 4.322 20 0 HIADHN COc1ccc(CC[C@H](C)NC(=O)NC[C@H](c2cccs2)N2CCCC2)cc1 ZINC000065485258 852156104 /nfs/dbraw/zinc/15/61/04/852156104.db2.gz WGIFTUKIRQTYPX-FXAWDEMLSA-N 0 3 401.576 4.214 20 0 HIADHN COc1cccc(CN2CCC(NC(=O)Cc3coc4cc(C)c(C)cc34)CC2)c1 ZINC000065506365 852161060 /nfs/dbraw/zinc/16/10/60/852161060.db2.gz ACUDXWPJPGFGPG-UHFFFAOYSA-N 0 3 406.526 4.382 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)NNc2ccc(OC(F)(F)F)cc2)C1 ZINC000065521740 852167312 /nfs/dbraw/zinc/16/73/12/852167312.db2.gz LPFRWEFNHNLOFF-YOEHRIQHSA-N 0 3 408.424 4.047 20 0 HIADHN Cc1ccc([C@@H](C)NC(=O)NCCCCN2CCN(Cc3ccccc3)CC2)s1 ZINC000065528175 852169550 /nfs/dbraw/zinc/16/95/50/852169550.db2.gz BKFPTNUBBKHALX-HXUWFJFHSA-N 0 3 414.619 4.015 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N[C@@H]1CCCOc2ccc(F)cc21)c1ccsc1 ZINC000065547403 852173035 /nfs/dbraw/zinc/17/30/35/852173035.db2.gz SFHHLXQMKXTLNN-MOPGFXCFSA-N 0 3 405.539 4.483 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCCc1cccnc1)c1ccc(C(F)(F)F)cc1 ZINC000065696746 852222853 /nfs/dbraw/zinc/22/28/53/852222853.db2.gz HEJBARLOUINJRN-IBGZPJMESA-N 0 3 408.468 4.025 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N(C)Cc1ccccn1)c1ccc(C(F)(F)F)cc1 ZINC000065697615 852223177 /nfs/dbraw/zinc/22/31/77/852223177.db2.gz WNAPYWWBMBHUDN-IBGZPJMESA-N 0 3 408.468 4.325 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=S)NCc1cccs1 ZINC000065704413 852225728 /nfs/dbraw/zinc/22/57/28/852225728.db2.gz IICYUFFIFRYOJT-UHFFFAOYSA-N 0 3 401.523 4.205 20 0 HIADHN CN(C)CCN(C(=O)Cc1csc(Cc2ccc(F)cc2)n1)C1CCCCC1 ZINC000065746224 852243386 /nfs/dbraw/zinc/24/33/86/852243386.db2.gz MFZWGUOBMPJVHX-UHFFFAOYSA-N 0 3 403.567 4.138 20 0 HIADHN CC1CCN([C@@H](CNC(=O)c2cc(Cl)ccc2[N+](=O)[O-])c2ccccc2)CC1 ZINC000065802333 852260974 /nfs/dbraw/zinc/26/09/74/852260974.db2.gz KRYZVECIEUETND-FQEVSTJZSA-N 0 3 401.894 4.451 20 0 HIADHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)Nc1ccc(Cl)nc1 ZINC000065821160 852269130 /nfs/dbraw/zinc/26/91/30/852269130.db2.gz BQTHYHOFIXMRGD-UHFFFAOYSA-N 0 3 411.731 4.093 20 0 HIADHN C[C@@H](NC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1)c1cccc(N2CCCC2=O)c1 ZINC000065898820 852307571 /nfs/dbraw/zinc/30/75/71/852307571.db2.gz XHJMHXQQNGTODM-NQIIRXRSSA-N 0 3 423.532 4.042 20 0 HIADHN O=C(NC1CCN(c2nc3ccccc3s2)CC1)c1cccc(CN2CCCC2)c1 ZINC000065925921 852318190 /nfs/dbraw/zinc/31/81/90/852318190.db2.gz NEUXVWZTLVZMLW-UHFFFAOYSA-N 0 3 420.582 4.291 20 0 HIADHN COc1cc(CNCc2ccc(Oc3cc(F)cc(F)c3)cc2)ccc1OCCO ZINC000065932593 852322322 /nfs/dbraw/zinc/32/23/22/852322322.db2.gz VCVPRXUGWMFZMV-UHFFFAOYSA-N 0 3 415.436 4.427 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)c1ccc(COc2ccc(F)cc2)o1 ZINC000065931669 852322520 /nfs/dbraw/zinc/32/25/20/852322520.db2.gz JXCUQCZNUKWJGN-UHFFFAOYSA-N 0 3 414.452 4.341 20 0 HIADHN CCC(=O)Nc1cccc(C(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)c1 ZINC000065938911 852327985 /nfs/dbraw/zinc/32/79/85/852327985.db2.gz ZFZHGTAIMDOWQR-UHFFFAOYSA-N 0 3 421.463 4.258 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)CCOc1ccccc1F ZINC000065938994 852328157 /nfs/dbraw/zinc/32/81/57/852328157.db2.gz XVLAMAKPZLCSHA-UHFFFAOYSA-N 0 3 412.427 4.204 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)c1cc2ccccc2n1C ZINC000065938879 852328406 /nfs/dbraw/zinc/32/84/06/852328406.db2.gz PLNRFHBOWYWFTE-UHFFFAOYSA-N 0 3 403.448 4.401 20 0 HIADHN CCOc1ncccc1NC(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1 ZINC000065984105 852340062 /nfs/dbraw/zinc/34/00/62/852340062.db2.gz MXSYDRCIRUDLRD-UHFFFAOYSA-N 0 3 410.440 4.095 20 0 HIADHN COc1cccc([C@H](CNC(=O)CCOc2ccc(Cl)cc2)N2CCCC2)c1 ZINC000071906579 852429071 /nfs/dbraw/zinc/42/90/71/852429071.db2.gz MAWOPNKSUHYBKY-NRFANRHFSA-N 0 3 402.922 4.071 20 0 HIADHN O=C(CN1CCC[C@H](c2ccccc2)CC1)N1CCC[C@@H]1c1ccc2c(c1)OCCO2 ZINC000072093078 852506725 /nfs/dbraw/zinc/50/67/25/852506725.db2.gz DVFHSUWGDVTCGA-JTHBVZDNSA-N 0 3 420.553 4.391 20 0 HIADHN C[C@H](CN1CCN(C)CC1)Nc1nc(C2CC2)nc2scc(-c3ccccc3)c21 ZINC000078604237 852519670 /nfs/dbraw/zinc/51/96/70/852519670.db2.gz LHKRLEQXMYZEBD-MRXNPFEDSA-N 0 3 407.587 4.284 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cnn(-c2ccccc2C)c1)c1cccc(OC)c1 ZINC000078989489 852536315 /nfs/dbraw/zinc/53/63/15/852536315.db2.gz BWPDVCVPGROXAK-HSZRJFAPSA-N 0 3 406.530 4.002 20 0 HIADHN C[C@@H](CN1CCCCC1)NC(=O)c1ccc(Oc2ccc(Br)cc2)nc1 ZINC000078957125 852536738 /nfs/dbraw/zinc/53/67/38/852536738.db2.gz VSIDRIAVYCWSQH-HNNXBMFYSA-N 0 3 418.335 4.241 20 0 HIADHN CC(C)c1ccc(-c2ncc(CN3CCC[C@H](C(=O)N4CCOCC4)C3)s2)cc1 ZINC000097024896 852574176 /nfs/dbraw/zinc/57/41/76/852574176.db2.gz TYYNPBFVTNIMTJ-FQEVSTJZSA-N 0 3 413.587 4.004 20 0 HIADHN CN(C)[C@H](CNC(=O)N1CCC(c2c[nH]c3ccccc32)CC1)Cc1ccccc1 ZINC000097025795 852574491 /nfs/dbraw/zinc/57/44/91/852574491.db2.gz YHPBOUUQAIZSNG-NRFANRHFSA-N 0 3 404.558 4.230 20 0 HIADHN COc1cc(CNC[C@H](c2ccco2)N(C)C)cc(Br)c1OC(F)F ZINC000097465482 852614612 /nfs/dbraw/zinc/61/46/12/852614612.db2.gz WLFQFHACRHBLKE-CYBMUJFWSA-N 0 3 419.266 4.045 20 0 HIADHN O=C(COc1ccc(Cl)cc1)NC1CCN(CCOc2ccc(Cl)cc2)CC1 ZINC000097577232 852637361 /nfs/dbraw/zinc/63/73/61/852637361.db2.gz CUUAMCCAKPMQPY-UHFFFAOYSA-N 0 3 423.340 4.032 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)C1(c2cccc(Br)c2)CC1 ZINC000105766645 852727401 /nfs/dbraw/zinc/72/74/01/852727401.db2.gz KYPCQSLNVCFRLY-HXUWFJFHSA-N 0 3 413.359 4.434 20 0 HIADHN COc1ccc(CCC(=O)N2CCCN(Cc3ccccc3C)CC2)cc1Cl ZINC000106154939 852758746 /nfs/dbraw/zinc/75/87/46/852758746.db2.gz VWGZWCGXUPVUAF-UHFFFAOYSA-N 0 3 400.950 4.324 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cc(C)n(-c2ccccc2)n1)c1cccc(OC)c1 ZINC000107786129 852796325 /nfs/dbraw/zinc/79/63/25/852796325.db2.gz ZEGRRRFDISRDIK-HSZRJFAPSA-N 0 3 406.530 4.002 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cc(C2CC2)n(C(C)(C)C)n1)c1cccc(OC)c1 ZINC000107821580 852801012 /nfs/dbraw/zinc/80/10/12/852801012.db2.gz SELQDSIMJVJVOC-JOCHJYFZSA-N 0 3 412.578 4.337 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)CCCc2ccc(Cl)cc2)CC1 ZINC000107867450 852805073 /nfs/dbraw/zinc/80/50/73/852805073.db2.gz MSMKCVAKUUOIFC-UHFFFAOYSA-N 0 3 413.993 4.117 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cc(F)cc4nc(C)c(C)nc43)c(C)c2)CC1 ZINC000108276012 852834095 /nfs/dbraw/zinc/83/40/95/852834095.db2.gz SZFTYQRIPGEPNS-UHFFFAOYSA-N 0 3 421.520 4.088 20 0 HIADHN COc1ccc(CNC(=O)CN2CCC[C@@H]2c2cccc3ccccc32)cc1OC ZINC000108982268 852903280 /nfs/dbraw/zinc/90/32/80/852903280.db2.gz PCZIGXWGJJGHGK-JOCHJYFZSA-N 0 3 404.510 4.310 20 0 HIADHN O=C(CN(Cc1ccccc1)CC1CCC1)NCC1(c2ccccc2)CCOCC1 ZINC000108976098 852903530 /nfs/dbraw/zinc/90/35/30/852903530.db2.gz XOTGOJNPJUEJFA-UHFFFAOYSA-N 0 3 406.570 4.153 20 0 HIADHN Cc1cc(-c2cc(C(=O)N[C@H]3CCN(C4CC4)C3)c3cnn(C(C)C)c3n2)c(C)s1 ZINC000109029384 852911067 /nfs/dbraw/zinc/91/10/67/852911067.db2.gz WPVYGHTWJHEPKU-INIZCTEOSA-N 0 3 423.586 4.324 20 0 HIADHN O=C(NCc1ccccc1OC(F)(F)F)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000109339143 852955528 /nfs/dbraw/zinc/95/55/28/852955528.db2.gz SYSOAFINVDJZSV-KRWDZBQOSA-N 0 3 410.411 4.253 20 0 HIADHN O=C(NCc1ccnc(OC2CCCC2)c1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000109347219 852956843 /nfs/dbraw/zinc/95/68/43/852956843.db2.gz BWIQJXRJCMKUAP-HXUWFJFHSA-N 0 3 411.521 4.071 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3ccn(-c4ccccc4Cl)n3)c(C)c2)CC1 ZINC000109583720 852988152 /nfs/dbraw/zinc/98/81/52/852988152.db2.gz MYUVIGDTGQXBFO-UHFFFAOYSA-N 0 3 423.948 4.228 20 0 HIADHN CN(C(=O)c1cc(-c2cccc(Cl)c2)on1)C1CCN(CCc2ccccn2)CC1 ZINC000109810402 853018267 /nfs/dbraw/zinc/01/82/67/853018267.db2.gz YREVWBVYVWAMRX-UHFFFAOYSA-N 0 3 424.932 4.169 20 0 HIADHN C[C@@H](Cc1ccccc1F)NC(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000110121446 853062643 /nfs/dbraw/zinc/06/26/43/853062643.db2.gz JFDDBUGJCXLSBN-HRAATJIYSA-N 0 3 408.439 4.328 20 0 HIADHN CC(=O)Nc1ccc(C)c(NC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)c1 ZINC000110127013 853063973 /nfs/dbraw/zinc/06/39/73/853063973.db2.gz CGNLVLNOTAEJSK-NRFANRHFSA-N 0 3 419.447 4.347 20 0 HIADHN CCOc1ccc(CN(C)C(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)cc1 ZINC000110172304 853068121 /nfs/dbraw/zinc/06/81/21/853068121.db2.gz QIMZLTJGXRWDBW-JOCHJYFZSA-N 0 3 420.475 4.498 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)CCSc3ccc(Cl)cc3)CC2)C[C@@H](C)O1 ZINC000110452891 853101110 /nfs/dbraw/zinc/10/11/10/853101110.db2.gz UZBMUDAFHIKBPI-IAGOWNOFSA-N 0 3 411.011 4.170 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)c3ccc4[nH]c5c(c4c3)CCCC5)CC2)C[C@H](C)O1 ZINC000110458789 853102215 /nfs/dbraw/zinc/10/22/15/853102215.db2.gz VDYTTWIROBKMFR-HDICACEKSA-N 0 3 409.574 4.008 20 0 HIADHN Cc1nc(-c2ccccc2)ccc1C(=O)N(C)C1CCN(CCc2ccccn2)CC1 ZINC000110488705 853106912 /nfs/dbraw/zinc/10/69/12/853106912.db2.gz CAVRCRKDQFEJKG-UHFFFAOYSA-N 0 3 414.553 4.231 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1ccc2[nH]c(C(F)F)nc2c1)c1cccc(OC)c1 ZINC000110674575 853136749 /nfs/dbraw/zinc/13/67/49/853136749.db2.gz ATFWXJCZZBWDFO-IBGZPJMESA-N 0 3 416.472 4.322 20 0 HIADHN Cc1nnc(SCc2c3ccccc3oc2C(=O)N(C)CCN2CCCC2)s1 ZINC000110970753 853176026 /nfs/dbraw/zinc/17/60/26/853176026.db2.gz LQHUKMWWPCEZKN-UHFFFAOYSA-N 0 3 416.572 4.053 20 0 HIADHN O=C(CCN1CCC(NC(=O)Nc2ccccc2)CC1)Nc1ccc(Cl)cc1F ZINC000110986587 853180873 /nfs/dbraw/zinc/18/08/73/853180873.db2.gz VSGPQILDSRQLQX-UHFFFAOYSA-N 0 3 418.900 4.094 20 0 HIADHN COc1cccc([C@H](CNC(=O)CNc2cccc(C(F)(F)F)c2)N2CCCC2)c1 ZINC000111088256 853200293 /nfs/dbraw/zinc/20/02/93/853200293.db2.gz AVKYOGIPHBUQQK-FQEVSTJZSA-N 0 3 421.463 4.079 20 0 HIADHN C[C@H]1Cc2ccccc2N1Cc1occc1C(=O)NC[C@@H](Cc1ccccc1)N(C)C ZINC000111140340 853207973 /nfs/dbraw/zinc/20/79/73/853207973.db2.gz NLFWIAYXSZETAO-SIKLNZKXSA-N 0 3 417.553 4.134 20 0 HIADHN CN(C)[C@@H](CNc1ncc(C(=O)N2CCCCC2)cc1Cl)c1cccc(F)c1 ZINC000111221284 853226579 /nfs/dbraw/zinc/22/65/79/853226579.db2.gz YWEKVZVJULYDLA-IBGZPJMESA-N 0 3 404.917 4.215 20 0 HIADHN CC(C)(C)[S@@](=O)Cc1cccc(NC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000112637002 853235255 /nfs/dbraw/zinc/23/52/55/853235255.db2.gz ODAUXAZPGGSXGO-ONOMSOESSA-N 0 3 413.587 4.130 20 0 HIADHN COc1ccc(CN(C)CCC(=O)N[C@H](c2cccs2)c2ccccc2)c(OC)c1 ZINC000115411858 853251782 /nfs/dbraw/zinc/25/17/82/853251782.db2.gz CLGFEUCRWDUCAU-DEOSSOPVSA-N 0 3 424.566 4.493 20 0 HIADHN Cc1sc2ncnc(SCCC(=O)NCCN(C)Cc3ccccc3)c2c1C ZINC000115761646 853263618 /nfs/dbraw/zinc/26/36/18/853263618.db2.gz LWGPKAFZUHUZKJ-UHFFFAOYSA-N 0 3 414.600 4.039 20 0 HIADHN CCOc1ccc2cc(C(=O)N(CCN(C)C)Cc3ccc(F)c(F)c3)[nH]c2c1 ZINC000116072705 853280943 /nfs/dbraw/zinc/28/09/43/853280943.db2.gz YZTJRVBMMDCVTI-UHFFFAOYSA-N 0 3 401.457 4.049 20 0 HIADHN CCN(C(=O)c1ccn(-c2ccc(OC)cc2)n1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000116349399 853298519 /nfs/dbraw/zinc/29/85/19/853298519.db2.gz YIKLPQMOUCOEIU-UGKGYDQZSA-N 0 3 418.541 4.179 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)[C@@H]2C[C@H]2c2ccc(Br)cc2)o1 ZINC000116378162 853300017 /nfs/dbraw/zinc/30/00/17/853300017.db2.gz BZMZSIXWJMGFPR-RBUKOAKNSA-N 0 3 405.336 4.044 20 0 HIADHN O=C(NC1CCN(Cc2ccc(OCc3cccnc3)cc2)CC1)c1ccc(F)cc1 ZINC000139228089 853405931 /nfs/dbraw/zinc/40/59/31/853405931.db2.gz YLGGBDCACUPXGF-UHFFFAOYSA-N 0 3 419.500 4.194 20 0 HIADHN COc1cc(CNCc2ccccc2-n2ccnc2)ccc1OCc1ccncc1 ZINC000140462935 853445133 /nfs/dbraw/zinc/44/51/33/853445133.db2.gz ODTUBNIDLKKOSU-UHFFFAOYSA-N 0 3 400.482 4.145 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2cnn(-c3ccccn3)c2C(C)C)N2CCCC2)cc1 ZINC000143109851 853508209 /nfs/dbraw/zinc/50/82/09/853508209.db2.gz IQEUIDUSKXDSRO-QFIPXVFZSA-N 0 3 417.557 4.266 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2cccc(NC(=O)NC(C)C)c2)N2CCCC2)cc1 ZINC000143103899 853508695 /nfs/dbraw/zinc/50/86/95/853508695.db2.gz XNLXVIWCLVBAMA-JOCHJYFZSA-N 0 3 408.546 4.092 20 0 HIADHN S=C(NC1CCN(Cc2ccccc2)CC1)N[C@H]1CCOc2c(Cl)cccc21 ZINC000145705999 853555973 /nfs/dbraw/zinc/55/59/73/853555973.db2.gz YVFDRRGASNYTMF-FQEVSTJZSA-N 0 3 415.990 4.292 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)c1cccc(Nc2ncccn2)c1 ZINC000146070948 853563283 /nfs/dbraw/zinc/56/32/83/853563283.db2.gz MTDBDLIPOXOJTQ-UHFFFAOYSA-N 0 3 419.554 4.064 20 0 HIADHN C[C@H](OC(=O)C1CCN(c2ccc(Cl)cc2)C1=O)c1nnc(-c2cccs2)o1 ZINC000146495610 853570241 /nfs/dbraw/zinc/57/02/41/853570241.db2.gz XKBXTVHIBATJLD-FZMZJTMJSA-N 0 3 417.874 4.109 20 0 HIADHN Cc1cc(C(=O)C(C#N)C(=O)Nc2ccc(SC(F)F)cc2)cc([N+](=O)[O-])c1 ZINC000146870953 853577609 /nfs/dbraw/zinc/57/76/09/853577609.db2.gz BFSKYOGENXZDNX-OAHLLOKOSA-N 0 3 405.382 4.179 20 0 HIADHN COc1ccc(CCCC(=O)C(C#N)C(=O)Nc2cc(C)c(Cl)cc2OC)cc1 ZINC000147083838 853582030 /nfs/dbraw/zinc/58/20/30/853582030.db2.gz KDPMLLMOTIZWCE-KRWDZBQOSA-N 0 3 414.889 4.336 20 0 HIADHN CCc1nc(CN(C)C(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)cs1 ZINC000147217623 853585128 /nfs/dbraw/zinc/58/51/28/853585128.db2.gz BFJISOQXRXBGOJ-KRWDZBQOSA-N 0 3 406.621 4.382 20 0 HIADHN CCc1nc(CN(C)C(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)cs1 ZINC000147217828 853585269 /nfs/dbraw/zinc/58/52/69/853585269.db2.gz BFJISOQXRXBGOJ-QGZVFWFLSA-N 0 3 406.621 4.382 20 0 HIADHN COc1ccc2[nH]cc(C3=CCN(C[C@@H](O)COc4cccc5[nH]ccc54)CC3)c2c1 ZINC000147352012 853586525 /nfs/dbraw/zinc/58/65/25/853586525.db2.gz GBSLJJRFLANJRX-GOSISDBHSA-N 0 3 417.509 4.187 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3sc(C(C)(C)C)nc3C)c(C)c2)CC1 ZINC000148426864 853607866 /nfs/dbraw/zinc/60/78/66/853607866.db2.gz UQYHOVWWHWGRMO-UHFFFAOYSA-N 0 3 400.592 4.452 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc(CNCc2ccc(OC)c3ccccc23)cc1 ZINC000165017467 853650341 /nfs/dbraw/zinc/65/03/41/853650341.db2.gz LCDOSCCZJFGZOP-UHFFFAOYSA-N 0 3 412.555 4.169 20 0 HIADHN C[C@H]1CCCC[C@@H]1N(C)C(=O)CNC1(c2ccc(Br)cc2)CCOCC1 ZINC000195600967 853706605 /nfs/dbraw/zinc/70/66/05/853706605.db2.gz RFMRSQGUYJSDLU-LPHOPBHVSA-N 0 3 423.395 4.082 20 0 HIADHN C[C@@H](CNC(=O)NC[C@@H](c1cccs1)N1CCCC1)COCc1ccccc1 ZINC000195615807 853716047 /nfs/dbraw/zinc/71/60/47/853716047.db2.gz VJTOIIJKGUINIG-ICSRJNTNSA-N 0 3 401.576 4.037 20 0 HIADHN C[C@@H](N[C@H](C)c1cccc(C(F)(F)F)c1)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000195702190 853768561 /nfs/dbraw/zinc/76/85/61/853768561.db2.gz WKPWRNUEFPQDEC-ZIAGYGMSSA-N 0 3 400.466 4.368 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)c1ccc(N(C)c2ccccc2)nc1 ZINC000195724636 853779549 /nfs/dbraw/zinc/77/95/49/853779549.db2.gz WEYAFAYKXNVTKB-UHFFFAOYSA-N 0 3 406.505 4.193 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)[C@H]2C[C@@H]2c2cccc(Br)c2)CC1 ZINC000195747719 853791891 /nfs/dbraw/zinc/79/18/91/853791891.db2.gz LGGKLEFDYLZJDV-UXHICEINSA-N 0 3 417.347 4.269 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2C(=O)N(C)C2CCN(C)CC2)cc1C ZINC000215836136 853838591 /nfs/dbraw/zinc/83/85/91/853838591.db2.gz FISMGJLFLFIGGL-UHFFFAOYSA-N 0 3 402.542 4.322 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)c2sc(C(=O)N(C)C3CCN(C)CC3)cc12 ZINC000215900828 853839341 /nfs/dbraw/zinc/83/93/41/853839341.db2.gz DSELRVMXVLZTSP-UHFFFAOYSA-N 0 3 402.951 4.215 20 0 HIADHN Cc1nn(-c2cccc(Cl)c2)c2sc(C(=O)N(C)C3CCN(C)CC3)cc12 ZINC000216537850 853855109 /nfs/dbraw/zinc/85/51/09/853855109.db2.gz NGRPNHGPWSZGMG-UHFFFAOYSA-N 0 3 402.951 4.215 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)c2cccc(NC(=O)c3ccco3)c2)C1 ZINC000227388814 853885923 /nfs/dbraw/zinc/88/59/23/853885923.db2.gz ONUCRRNVWHZPLO-DYESRHJHSA-N 0 3 403.482 4.097 20 0 HIADHN c1cnn(-c2cc(CNCc3cn(-c4ccccc4)nc3-c3cccs3)ccn2)c1 ZINC000236584041 853900434 /nfs/dbraw/zinc/90/04/34/853900434.db2.gz UIAKNKZRRHWBPC-UHFFFAOYSA-N 0 3 412.522 4.471 20 0 HIADHN Cc1nn(-c2ccc(F)cc2F)c(C)c1CNC[C@@H](O)c1cccc(OC(C)C)c1 ZINC000236599349 853901390 /nfs/dbraw/zinc/90/13/90/853901390.db2.gz QSQBEHTUUBXOOQ-HSZRJFAPSA-N 0 3 415.484 4.378 20 0 HIADHN CC(=O)N1CCC(N[C@H](c2ccccc2)c2ccc(Br)cc2F)CC1 ZINC000236613510 853902750 /nfs/dbraw/zinc/90/27/50/853902750.db2.gz CBDFVDNYABKHCH-HXUWFJFHSA-N 0 3 405.311 4.278 20 0 HIADHN c1c(CNCc2ccc3c(c2)OCCCO3)c(-c2cccnc2)nn1-c1ccccc1 ZINC000236633513 853906269 /nfs/dbraw/zinc/90/62/69/853906269.db2.gz YPKMVACCVPHURD-UHFFFAOYSA-N 0 3 412.493 4.385 20 0 HIADHN CC(C)(C)c1n[nH]cc1CN[C@H]1CCN(c2ncc(C(F)(F)F)cc2Cl)C1 ZINC000236765239 853920446 /nfs/dbraw/zinc/92/04/46/853920446.db2.gz LSHXAMUTGGEORL-ZDUSSCGKSA-N 0 3 401.864 4.143 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@H](C)NCc2cn(-c3ccccc3)nc2C)CC1 ZINC000236853191 853929057 /nfs/dbraw/zinc/92/90/57/853929057.db2.gz QIHGJAGIIIEOOL-FQEVSTJZSA-N 0 3 421.564 4.313 20 0 HIADHN CCCNC(=O)c1cccc(CN[C@@H](C)CC(=O)Nc2ccccc2C(F)(F)F)c1 ZINC000236887030 853932164 /nfs/dbraw/zinc/93/21/64/853932164.db2.gz OLOJKUJBJPLCER-HNNXBMFYSA-N 0 3 421.463 4.352 20 0 HIADHN CCC[C@@H](NCc1ccc(O[C@H](C)C#N)cc1)C(=O)Nc1cccc(N2CCCC2)c1 ZINC000236917261 853937208 /nfs/dbraw/zinc/93/72/08/853937208.db2.gz DWMOJMABAOAQLZ-NTKDMRAZSA-N 0 3 420.557 4.475 20 0 HIADHN CCOc1ccc(CNCc2ccnc(N3CCN(c4ccc(F)cc4)CC3)c2)cc1 ZINC000236971052 853944403 /nfs/dbraw/zinc/94/44/03/853944403.db2.gz LROYUSJIELGHLX-UHFFFAOYSA-N 0 3 420.532 4.236 20 0 HIADHN CCOc1cc(CNCc2sccc2C)ccc1OCC(=O)N1CCCCC1 ZINC000236983633 853947319 /nfs/dbraw/zinc/94/73/19/853947319.db2.gz NJOWDOHVEBNAJK-UHFFFAOYSA-N 0 3 402.560 4.136 20 0 HIADHN CCOc1c(Br)cc(CNC[C@@H](c2ccco2)N2CCCC2)cc1OC ZINC000237005445 853950215 /nfs/dbraw/zinc/95/02/15/853950215.db2.gz WOGIRDRXKRUYGG-KRWDZBQOSA-N 0 3 423.351 4.376 20 0 HIADHN CN1CCN(Cc2cccc(NCc3ccccc3OCc3cccnc3)c2)CC1 ZINC000237093325 853963246 /nfs/dbraw/zinc/96/32/46/853963246.db2.gz SQIXIBJYSYQQQD-UHFFFAOYSA-N 0 3 402.542 4.020 20 0 HIADHN CN(C(=O)c1ccncc1)c1ccc(CNCc2c[nH]nc2-c2ccccc2F)cc1 ZINC000237095682 853964039 /nfs/dbraw/zinc/96/40/39/853964039.db2.gz KJBXEXZOAPRVKY-UHFFFAOYSA-N 0 3 415.472 4.177 20 0 HIADHN COC(=O)COc1c(C)cc(CNC2(c3ccc(Br)cc3)CC2)cc1C ZINC000237180732 853976190 /nfs/dbraw/zinc/97/61/90/853976190.db2.gz GNKCUDJBIRLZMC-UHFFFAOYSA-N 0 3 418.331 4.397 20 0 HIADHN COCCOc1ccc([C@H](C)NCc2ccc(F)c(Br)c2)cc1OC ZINC000237180225 853976680 /nfs/dbraw/zinc/97/66/80/853976680.db2.gz QKNFWCCPUZMHKE-ZDUSSCGKSA-N 0 3 412.299 4.473 20 0 HIADHN COc1cc(CN[C@H](C)c2ccc(C)cc2)cc(I)c1OC ZINC000237219645 853985373 /nfs/dbraw/zinc/98/53/73/853985373.db2.gz CDNBSTJDZYHFDN-CYBMUJFWSA-N 0 3 411.283 4.468 20 0 HIADHN COc1ccc(NC(=O)C[C@H](C)N[C@@H]2CCSc3ccc(F)cc32)c(OC)c1 ZINC000237306267 854002975 /nfs/dbraw/zinc/00/29/75/854002975.db2.gz HISUYOJOQCKHCQ-SUMWQHHRSA-N 0 3 404.507 4.387 20 0 HIADHN COc1ccc(OCc2nc(CN[C@H]3C[C@H](C)N(Cc4ccccc4)C3)cs2)cc1 ZINC000237310567 854003655 /nfs/dbraw/zinc/00/36/55/854003655.db2.gz LNOZRXQRQLNLIQ-ICSRJNTNSA-N 0 3 423.582 4.483 20 0 HIADHN COc1ccc(CN[C@H]2CCCN(Cc3ccc(F)cc3Cl)C2)c(OC)c1OC ZINC000237367904 854015847 /nfs/dbraw/zinc/01/58/47/854015847.db2.gz GLEVFPUXXLFJMX-SFHVURJKSA-N 0 3 422.928 4.259 20 0 HIADHN COc1cc(CN[C@@H](c2cccc(F)c2)C2CCCC2)cc(Cl)c1OCC(N)=O ZINC000237404939 854025432 /nfs/dbraw/zinc/02/54/32/854025432.db2.gz ZDBFWMYSWMJWIS-OAQYLSRUSA-N 0 3 420.912 4.373 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2CNCc2cc(Br)ccc2F)C[C@@H](C)O1 ZINC000237411062 854026756 /nfs/dbraw/zinc/02/67/56/854026756.db2.gz DJGAHCLLEYGUJV-HZPDHXFCSA-N 0 3 421.354 4.487 20 0 HIADHN COc1ccc(Br)c(C(=O)NCCCNCc2ccc([C@H]3C[C@H]3C)o2)c1 ZINC000237419175 854028380 /nfs/dbraw/zinc/02/83/80/854028380.db2.gz NOJZVSCQSODOIZ-CJNGLKHVSA-N 0 3 421.335 4.084 20 0 HIADHN COc1ccc(-c2ccc(CNC[C@@](C)(O)c3ccc(F)cc3F)o2)c([N+](=O)[O-])c1 ZINC000237429609 854031626 /nfs/dbraw/zinc/03/16/26/854031626.db2.gz KVVKIPJKYOLNPH-OAQYLSRUSA-N 0 3 418.396 4.139 20 0 HIADHN C[C@@H]1CN([C@@H](CNCc2c[nH]nc2C(C)(C)C)c2c(F)cccc2Cl)CCO1 ZINC000237431566 854031808 /nfs/dbraw/zinc/03/18/08/854031808.db2.gz NRVJDIBAVSUJQZ-KDOFPFPSSA-N 0 3 408.949 4.051 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(CNC[C@H](O)c3c(F)cccc3F)c2)cc1 ZINC000237466327 854038225 /nfs/dbraw/zinc/03/82/25/854038225.db2.gz OMZUQOQVRCRGPW-NRFANRHFSA-N 0 3 412.436 4.049 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(CNCc3ccc(-n4ccnc4)cc3)c2)cc1 ZINC000237495212 854045062 /nfs/dbraw/zinc/04/50/62/854045062.db2.gz MAHAVLUFKDQLRC-UHFFFAOYSA-N 0 3 412.493 4.423 20 0 HIADHN COc1ccc(C[C@@H](NCc2cnc3c(c2)c(C)nn3C)c2ccccc2)cc1OC ZINC000237555706 854054119 /nfs/dbraw/zinc/05/41/19/854054119.db2.gz DBRNCKKNHRGYME-JOCHJYFZSA-N 0 3 416.525 4.368 20 0 HIADHN C[C@H]1CN(CCCNCc2csc(-c3ccc(C(F)(F)F)cc3)n2)C[C@H](C)O1 ZINC000237614834 854062693 /nfs/dbraw/zinc/06/26/93/854062693.db2.gz RNEWZJHGSCFHKB-GJZGRUSLSA-N 0 3 413.509 4.418 20 0 HIADHN C[C@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@@H]1CNCc1cnc(-c2ccccn2)s1 ZINC000237675209 854073184 /nfs/dbraw/zinc/07/31/84/854073184.db2.gz HJPHASOOLAUEAG-RHSMWYFYSA-N 0 3 418.563 4.055 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)c(C)c1CNC[C@@](C)(O)c1ccc(F)cc1F ZINC000237722889 854084045 /nfs/dbraw/zinc/08/40/45/854084045.db2.gz ZBUVCBBANAJVQZ-OAQYLSRUSA-N 0 3 405.876 4.418 20 0 HIADHN Cc1ccsc1CNCC(C)(C)S(=O)(=O)c1ccc(Br)cc1 ZINC000237772588 854093658 /nfs/dbraw/zinc/09/36/58/854093658.db2.gz YHHBQGAHJBNABX-UHFFFAOYSA-N 0 3 402.379 4.161 20 0 HIADHN Clc1nc2ccccn2c1CNC[C@H]1CCN(c2ccc(Br)cc2)C1 ZINC000237805451 854100742 /nfs/dbraw/zinc/10/07/42/854100742.db2.gz QWNPKCLOCQXUEX-CQSZACIVSA-N 0 3 419.754 4.366 20 0 HIADHN Cn1cc(CNCc2cccc3cccnc32)c(-c2ccc3c(c2)OCCCO3)n1 ZINC000237820251 854103385 /nfs/dbraw/zinc/10/33/85/854103385.db2.gz NYJUTIVOVTZPKK-UHFFFAOYSA-N 0 3 400.482 4.086 20 0 HIADHN Cc1cccn2cc(COc3ccc(CNC[C@@H](O)c4c(F)cccc4F)cc3)nc12 ZINC000237853943 854108738 /nfs/dbraw/zinc/10/87/38/854108738.db2.gz BXDXBCLJIFFZEK-JOCHJYFZSA-N 0 3 423.463 4.323 20 0 HIADHN Cc1nn(Cc2ccc(Cl)cc2)c(C)c1CNCc1ccc(N2CCOCC2)cc1 ZINC000237885489 854114774 /nfs/dbraw/zinc/11/47/74/854114774.db2.gz CCRZSVQUIPRPID-UHFFFAOYSA-N 0 3 424.976 4.328 20 0 HIADHN O=C(Nc1ccccc1)[C@@H](NC1CCN(Cc2ccncc2)CC1)c1ccccc1 ZINC000237914996 854118768 /nfs/dbraw/zinc/11/87/68/854118768.db2.gz AANFSKJNKPCXIW-DEOSSOPVSA-N 0 3 400.526 4.016 20 0 HIADHN O=[N+]([O-])c1cc(CNC[C@@H](O)c2ccc(F)cc2)ccc1Oc1ccc(F)cc1 ZINC000237962805 854126636 /nfs/dbraw/zinc/12/66/36/854126636.db2.gz RGJUHHHNZDUSRX-HXUWFJFHSA-N 0 3 400.381 4.489 20 0 HIADHN O=[N+]([O-])c1cc(CNC[C@@H](O)c2ccccc2F)ccc1Oc1ccc(F)cc1 ZINC000237962849 854126835 /nfs/dbraw/zinc/12/68/35/854126835.db2.gz XRZMARMNTJUTBS-HXUWFJFHSA-N 0 3 400.381 4.489 20 0 HIADHN O[C@H](CNCc1cn(Cc2ccccc2)nc1-c1cccnc1)c1c(F)cccc1F ZINC000237974003 854127841 /nfs/dbraw/zinc/12/78/41/854127841.db2.gz YYVWYGUYJVLKPE-JOCHJYFZSA-N 0 3 420.463 4.095 20 0 HIADHN CCN(C(=O)c1cc(OC)c(OC)c(OC)c1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000249883546 854192454 /nfs/dbraw/zinc/19/24/54/854192454.db2.gz BKMJYGJFPWHXGR-YLJYHZDGSA-N 0 3 412.530 4.010 20 0 HIADHN CCn1c2ccccc2nc1SCC(=O)N[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000250348453 854193770 /nfs/dbraw/zinc/19/37/70/854193770.db2.gz RZBHZAMETMAYGC-MJGOQNOKSA-N 0 3 408.571 4.100 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N2CCC(OC3CCCCC3)CC2)N(C)C)cc1 ZINC000261384970 854243084 /nfs/dbraw/zinc/24/30/84/854243084.db2.gz VAGJRZPKZILAMR-QHCPKHFHSA-N 0 3 401.595 4.375 20 0 HIADHN O=C([C@H]1CCCN(Cc2cccc(F)c2)C1)N1CCC([C@@H](O)c2ccccc2)CC1 ZINC000261415087 854254082 /nfs/dbraw/zinc/25/40/82/854254082.db2.gz FLUGMDREROURIS-UPVQGACJSA-N 0 3 410.533 4.010 20 0 HIADHN CN1CCN(Cc2ccc(CNc3nc(-c4cccnc4)nc4ccccc43)cc2)CC1 ZINC000301110159 854299389 /nfs/dbraw/zinc/29/93/89/854299389.db2.gz YCTVXKAACRYNQL-UHFFFAOYSA-N 0 3 424.552 4.051 20 0 HIADHN CN(C)[C@@H](CNc1cc(C(F)(F)F)nc(-c2ccncc2)n1)c1cccc(F)c1 ZINC000301347826 854366514 /nfs/dbraw/zinc/36/65/14/854366514.db2.gz LHRMURVUZKMRIR-INIZCTEOSA-N 0 3 405.399 4.411 20 0 HIADHN Cc1nc(-c2ccc(N[C@@H]3CC[N@H+](Cc4ccccc4)[C@H](C)C3)nc2)[n-]c(=O)c1C ZINC000301573217 854422639 /nfs/dbraw/zinc/42/26/39/854422639.db2.gz YWICWFKOFCSYOF-IIBYNOLFSA-N 0 3 403.530 4.326 20 0 HIADHN Cc1nc(-c2ccc(N[C@@H]3CC[N@@H+](Cc4ccccc4)[C@H](C)C3)nc2)[n-]c(=O)c1C ZINC000301573217 854422643 /nfs/dbraw/zinc/42/26/43/854422643.db2.gz YWICWFKOFCSYOF-IIBYNOLFSA-N 0 3 403.530 4.326 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(Nc2nc(-c3ccncc3)nc3c2CCC3)CC1 ZINC000301782722 854465045 /nfs/dbraw/zinc/46/50/45/854465045.db2.gz JZVGSZWZUQHAFC-QGZVFWFLSA-N 0 3 400.530 4.060 20 0 HIADHN Cc1sc2nc(CN3CCN(c4ccnc5ccc(C)cc54)CC3)[nH]c(=O)c2c1C ZINC000302146849 854537477 /nfs/dbraw/zinc/53/74/77/854537477.db2.gz IGWRLOKOZOULKY-UHFFFAOYSA-N 0 3 419.554 4.193 20 0 HIADHN COc1ccc(CCC(=O)N2CCCN(c3ccnc4ccc(C)cc43)CC2)cc1 ZINC000302154440 854538886 /nfs/dbraw/zinc/53/88/86/854538886.db2.gz LUVBVDIYRFAOFR-UHFFFAOYSA-N 0 3 403.526 4.223 20 0 HIADHN Brc1ccc2nccc(NCc3n[nH]c(COc4ccccc4)n3)c2c1 ZINC000302277796 854559497 /nfs/dbraw/zinc/55/94/97/854559497.db2.gz UCHYVIRPSJLBAW-UHFFFAOYSA-N 0 3 410.275 4.307 20 0 HIADHN c1cc(-c2nnc3ccc(Nc4cccc(CN5CCSCC5)c4)nn32)cs1 ZINC000302553897 854584375 /nfs/dbraw/zinc/58/43/75/854584375.db2.gz JAORACKWCXBCNH-UHFFFAOYSA-N 0 3 408.556 4.145 20 0 HIADHN O=C(CN[C@@H](c1ccc(Cl)cc1)C1CC1)Nc1cc(Cl)ccc1-n1cncn1 ZINC000302759536 854624170 /nfs/dbraw/zinc/62/41/70/854624170.db2.gz OLJMHLIZFJZBCP-HXUWFJFHSA-N 0 3 416.312 4.254 20 0 HIADHN COc1cc2c(cc1OC)CN(C(=O)CN[C@H](C)c1cccc3ccccc31)CC2 ZINC000302763765 854626149 /nfs/dbraw/zinc/62/61/49/854626149.db2.gz YJBYJXOJLUQAJM-QGZVFWFLSA-N 0 3 404.510 4.093 20 0 HIADHN COc1ccc([C@H](CNC(=O)NCCCn2ccc3ccccc32)N2CCCC2)cc1 ZINC000302818795 854645781 /nfs/dbraw/zinc/64/57/81/854645781.db2.gz ZUPCAJRBNOGHKG-DEOSSOPVSA-N 0 3 420.557 4.176 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N(C)Cc2ccc(OC(F)F)cc2)N(C)C)cc1 ZINC000302893447 854668944 /nfs/dbraw/zinc/66/89/44/854668944.db2.gz HVRORJZGFIEUHY-FQEVSTJZSA-N 0 3 405.489 4.295 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)N(C)Cc2ccc(OC(F)F)cc2)N(C)C)cc1 ZINC000302893448 854669143 /nfs/dbraw/zinc/66/91/43/854669143.db2.gz HVRORJZGFIEUHY-HXUWFJFHSA-N 0 3 405.489 4.295 20 0 HIADHN CN(CCOc1ccc(Cl)cc1)C(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000302894302 854669190 /nfs/dbraw/zinc/66/91/90/854669190.db2.gz IKARPXAASXZOOE-GOSISDBHSA-N 0 3 407.967 4.259 20 0 HIADHN C[C@@H](NCC(=O)N1CCC(C(=O)Nc2ccccc2)CC1)c1cccc2ccccc21 ZINC000302918560 854679244 /nfs/dbraw/zinc/67/92/44/854679244.db2.gz BXHFRRJRLRKGOM-LJQANCHMSA-N 0 3 415.537 4.368 20 0 HIADHN COc1ccc([C@H](NCC(=O)Nc2cc3c(cc2Cl)OCCCO3)C(C)C)cc1 ZINC000302918311 854679260 /nfs/dbraw/zinc/67/92/60/854679260.db2.gz BMUBCVOZZUSGBH-JOCHJYFZSA-N 0 3 418.921 4.435 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cc(C(C)C)nc2onc(C)c21)c1cccc(OC)c1 ZINC000302929776 854684231 /nfs/dbraw/zinc/68/42/31/854684231.db2.gz DSNQVRJVFDIVMQ-OAQYLSRUSA-N 0 3 424.545 4.476 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)c1cc(F)cc(Br)c1 ZINC000302943492 854690822 /nfs/dbraw/zinc/69/08/22/854690822.db2.gz BPVMHOIMXXVZBH-UHFFFAOYSA-N 0 3 415.253 4.070 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)c1cc(-c2cccc(Cl)c2)no1 ZINC000302969687 854701511 /nfs/dbraw/zinc/70/15/11/854701511.db2.gz BAFFJEGMVPUGJQ-UHFFFAOYSA-N 0 3 419.859 4.477 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)Cc1cccc(C(F)(F)F)c1 ZINC000303006129 854720089 /nfs/dbraw/zinc/72/00/89/854720089.db2.gz PLNXUZARUJOQLD-UHFFFAOYSA-N 0 3 400.391 4.117 20 0 HIADHN COc1ccc(OC)c(NC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)c1 ZINC000303071282 854747739 /nfs/dbraw/zinc/74/77/39/854747739.db2.gz XMGGSBIGJJJPSP-FQEVSTJZSA-N 0 3 408.420 4.097 20 0 HIADHN CN(C[C@@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)c1cc(Cl)ccc1Cl ZINC000437331149 862600919 /nfs/dbraw/zinc/60/09/19/862600919.db2.gz WDCIAXAAMIQZLU-INIZCTEOSA-N 0 3 413.370 4.136 20 0 HIADHN COc1ccc(CNC(=O)N[C@H](CN2CCCC2)c2ccccc2)c(C(F)(F)F)c1 ZINC000303180167 854803498 /nfs/dbraw/zinc/80/34/98/854803498.db2.gz SQWPTVUXYDMAQI-HXUWFJFHSA-N 0 3 421.463 4.350 20 0 HIADHN COc1ccc(CCNC(=O)[C@H](C)N2CCC[C@@H](c3ccccc3)CC2)cc1OC ZINC000303195745 854812237 /nfs/dbraw/zinc/81/22/37/854812237.db2.gz NKMBSRJIOGVSPJ-SIKLNZKXSA-N 0 3 410.558 4.021 20 0 HIADHN O=C(NCc1ccc(Br)cc1)NC[C@H](c1ccccc1)N1CCCC1 ZINC000303286155 854852632 /nfs/dbraw/zinc/85/26/32/854852632.db2.gz KAAMRXVOYYJLBK-LJQANCHMSA-N 0 3 402.336 4.085 20 0 HIADHN Cc1c(Br)cccc1NC(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000303360489 854892061 /nfs/dbraw/zinc/89/20/61/854892061.db2.gz HMTWQBYUWQEBGA-HUUCEWRRSA-N 0 3 424.383 4.111 20 0 HIADHN CCOc1ccc(CNC(=O)[C@@H](C)N2CCC(Cc3ccccc3)CC2)cc1OC ZINC000303438493 854938682 /nfs/dbraw/zinc/93/86/82/854938682.db2.gz BKPIMSHMMWHWTD-LJQANCHMSA-N 0 3 410.558 4.053 20 0 HIADHN C[C@H](CNC(=O)[C@@H]1C[C@@H]1c1ccc(Br)cc1)N(C)Cc1ccccc1 ZINC000303450934 854949190 /nfs/dbraw/zinc/94/91/90/854949190.db2.gz JMVOPINLYXHVIG-CDHQVMDDSA-N 0 3 401.348 4.189 20 0 HIADHN Cc1c(C(=O)N(CCN(C)C)Cc2ccccc2F)cnn1-c1ccccc1Cl ZINC000303499324 854987657 /nfs/dbraw/zinc/98/76/57/854987657.db2.gz YEGAMUYCJUMUQL-UHFFFAOYSA-N 0 3 414.912 4.177 20 0 HIADHN CN(C(=O)CN(Cc1ccccc1)CC1CCOCC1)[C@@H]1CCCc2ccccc21 ZINC000303516109 855004065 /nfs/dbraw/zinc/00/40/65/855004065.db2.gz XYQBJEOKTKBHET-RUZDIDTESA-N 0 3 406.570 4.451 20 0 HIADHN CCCN(C(=O)c1cccc(-n2cccn2)c1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000303604461 855072450 /nfs/dbraw/zinc/07/24/50/855072450.db2.gz APJYZTUJIHOERQ-XMMPIXPASA-N 0 3 402.542 4.389 20 0 HIADHN CN(C)Cc1cccc(NC(=O)C(=O)Nc2cccc(COc3cccc(F)c3)c2)c1 ZINC000437356534 862638113 /nfs/dbraw/zinc/63/81/13/862638113.db2.gz XXFHQDWGUIBAQV-UHFFFAOYSA-N 0 3 421.472 4.044 20 0 HIADHN C[C@H](CNC(=O)c1cc(Br)sc1Br)N1CCC(C)CC1 ZINC000303683310 855130421 /nfs/dbraw/zinc/13/04/21/855130421.db2.gz SNLLVWNNJORRBE-SNVBAGLBSA-N 0 3 424.202 4.123 20 0 HIADHN CCCN(C(=O)c1cccc(-n2ccnc2)c1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000303713716 855147511 /nfs/dbraw/zinc/14/75/11/855147511.db2.gz UUWJJSDWKOXNFQ-DEOSSOPVSA-N 0 3 402.542 4.389 20 0 HIADHN COc1ccc(Cl)cc1C(=O)NC1CCN(CCOc2ccc(Cl)cc2)CC1 ZINC000303732585 855158519 /nfs/dbraw/zinc/15/85/19/855158519.db2.gz VPYPZQIMQPFYJX-UHFFFAOYSA-N 0 3 423.340 4.275 20 0 HIADHN COc1ccc(C(=O)CCC(=O)N(C)[C@@H]2CCN(Cc3ccccc3)[C@H](C)C2)cc1 ZINC000303737412 855162390 /nfs/dbraw/zinc/16/23/90/855162390.db2.gz HCXLCFLXNIHMQE-DENIHFKCSA-N 0 3 408.542 4.170 20 0 HIADHN Cc1c(Cl)cccc1S(=O)(=O)N(C)[C@@H]1CCN(Cc2ccccc2)[C@H](C)C1 ZINC000303760803 855179624 /nfs/dbraw/zinc/17/96/24/855179624.db2.gz FAWQGLZJHZHWBR-VQIMIIECSA-N 0 3 406.979 4.322 20 0 HIADHN CCOc1cc(C(=O)NC2CCN(CCOc3ccc(Cl)cc3)CC2)ccc1C ZINC000303799171 855204431 /nfs/dbraw/zinc/20/44/31/855204431.db2.gz SBIACVYQKHRVKM-UHFFFAOYSA-N 0 3 416.949 4.320 20 0 HIADHN Cc1cc(C)n(Cc2ccc(C(=O)N3CCCN(Cc4ccccc4)C[C@@H]3C)cc2)n1 ZINC000303834306 855233633 /nfs/dbraw/zinc/23/36/33/855233633.db2.gz LYWNSEPCIQLZCV-QFIPXVFZSA-N 0 3 416.569 4.285 20 0 HIADHN CC(C)c1nn(C)c(Cl)c1C(=O)NC[C@@H](c1ccccc1)N1CCC(C)CC1 ZINC000303852958 855248581 /nfs/dbraw/zinc/24/85/81/855248581.db2.gz FXWAAJRSMDOILI-SFHVURJKSA-N 0 3 402.970 4.400 20 0 HIADHN CN(C)Cc1cccc(C(=O)N2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)c1 ZINC000303858087 855253804 /nfs/dbraw/zinc/25/38/04/855253804.db2.gz LYCOYBZACLPMKK-UHFFFAOYSA-N 0 3 417.912 4.032 20 0 HIADHN CCCNC(=O)c1cccc(C(=O)N(CCC)[C@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000303919867 855291116 /nfs/dbraw/zinc/29/11/16/855291116.db2.gz TWYDQPAKRRSCTH-DEOSSOPVSA-N 0 3 421.585 4.343 20 0 HIADHN COc1ccc(Br)cc1CN[C@@](C)(CNC(=O)OC(C)(C)C)C1CC1 ZINC000304930917 855358643 /nfs/dbraw/zinc/35/86/43/855358643.db2.gz ZCPJHTBVFYQOTE-IBGZPJMESA-N 0 3 413.356 4.241 20 0 HIADHN COc1ccc(CNC2(C)CCN(C(=O)OC(C)(C)C)CC2)c(Br)c1 ZINC000310675535 855365805 /nfs/dbraw/zinc/36/58/05/855365805.db2.gz JXUGSRNWCNYSEZ-UHFFFAOYSA-N 0 3 413.356 4.337 20 0 HIADHN COc1ccc(CNCC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c(Br)c1 ZINC000310687113 855367057 /nfs/dbraw/zinc/36/70/57/855367057.db2.gz PLBFFOMXWYYIRA-CQSZACIVSA-N 0 3 413.356 4.194 20 0 HIADHN CN(C(=O)c1c(F)cc(Br)cc1F)C1CCN(Cc2ccccc2)CC1 ZINC000311469986 855370619 /nfs/dbraw/zinc/37/06/19/855370619.db2.gz OFKAYBIGKZXVHP-UHFFFAOYSA-N 0 3 423.301 4.464 20 0 HIADHN C[C@H](NCCCn1cc(Br)cn1)c1ccc(F)cc1Br ZINC000312359657 855372235 /nfs/dbraw/zinc/37/22/35/855372235.db2.gz YZRWDLYZLZYYJC-JTQLQIEISA-N 0 3 405.109 4.288 20 0 HIADHN COCC1(CNCc2cc(Cl)ccc2F)CCN(C(=O)OC(C)(C)C)CC1 ZINC000312842726 855373696 /nfs/dbraw/zinc/37/36/96/855373696.db2.gz KYRBSVBQDJAOCV-UHFFFAOYSA-N 0 3 400.922 4.232 20 0 HIADHN CN(C(=O)c1cccc(Br)c1Cl)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000383626973 855438293 /nfs/dbraw/zinc/43/82/93/855438293.db2.gz WKHNGCIZBBQAMJ-OAHLLOKOSA-N 0 3 407.739 4.449 20 0 HIADHN CN(C(=O)c1cccc(F)c1Br)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000388938092 855449138 /nfs/dbraw/zinc/44/91/38/855449138.db2.gz WZBFNVSIIPNNQX-INIZCTEOSA-N 0 3 405.311 4.325 20 0 HIADHN CN(C(=O)c1cccc(F)c1Br)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000388938103 855449275 /nfs/dbraw/zinc/44/92/75/855449275.db2.gz WZBFNVSIIPNNQX-MRXNPFEDSA-N 0 3 405.311 4.325 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1cccc(Br)c1Cl ZINC000389851798 855452328 /nfs/dbraw/zinc/45/23/28/855452328.db2.gz WBFWFTMOHBJIQY-CXAGYDPISA-N 0 3 407.739 4.353 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1ccc(Cl)cc1Br ZINC000389849654 855452777 /nfs/dbraw/zinc/45/27/77/855452777.db2.gz SSSKOQLJYDFQTJ-UGSOOPFHSA-N 0 3 407.739 4.353 20 0 HIADHN CC(C)n1cc(Br)cc1C(=O)NC[C@H](c1ccccc1)N1CCCC1 ZINC000392774653 855466880 /nfs/dbraw/zinc/46/68/80/855466880.db2.gz YITCOLSXYXUMGZ-LJQANCHMSA-N 0 3 404.352 4.398 20 0 HIADHN C[C@H](NCC1([S@](C)=O)CCC1)c1ccc(Br)cc1Br ZINC000393697200 855468996 /nfs/dbraw/zinc/46/89/96/855468996.db2.gz HKUVMUSHWDGHIN-OVWNDWIMSA-N 0 3 409.187 4.163 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)c2cc(Cl)ccc2Br)CN1Cc1ccccc1 ZINC000398058963 855475209 /nfs/dbraw/zinc/47/52/09/855475209.db2.gz BFMMTUXGDDRDGN-XJKSGUPXSA-N 0 3 407.739 4.495 20 0 HIADHN C[C@]1(NC(=O)c2cc(Cl)ccc2Br)CCN(Cc2ccccc2)C1 ZINC000406041993 855482736 /nfs/dbraw/zinc/48/27/36/855482736.db2.gz UPPHOTXBUAMDFD-IBGZPJMESA-N 0 3 407.739 4.497 20 0 HIADHN C[C@@]1(NC(=O)c2cc(Cl)ccc2Br)CCN(Cc2ccccc2)C1 ZINC000406041994 855482761 /nfs/dbraw/zinc/48/27/61/855482761.db2.gz UPPHOTXBUAMDFD-LJQANCHMSA-N 0 3 407.739 4.497 20 0 HIADHN CCN(CC)[C@H](CNC(=O)C1(c2cncc(Br)c2)CC1)c1ccsc1 ZINC000409460754 855490370 /nfs/dbraw/zinc/49/03/70/855490370.db2.gz VNIPCNHXQNRSPL-QGZVFWFLSA-N 0 3 422.392 4.137 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)C2(c3cccc(Cl)c3)CCOCC2)C1 ZINC000409459952 855490431 /nfs/dbraw/zinc/49/04/31/855490431.db2.gz QWEKPFQERBXRLQ-PGRDOPGGSA-N 0 3 412.961 4.340 20 0 HIADHN CN(C)[C@@H](CNC(=O)Nc1cc(Cl)ccc1OC[C@H]1CCCO1)c1ccccc1 ZINC000409654431 855585921 /nfs/dbraw/zinc/58/59/21/855585921.db2.gz WYVKCHYQGUNGOC-QUCCMNQESA-N 0 3 417.937 4.322 20 0 HIADHN CN(C)[C@H](CNC(=O)Nc1cc(Cl)ccc1OC[C@H]1CCCO1)c1ccccc1 ZINC000409654434 855585997 /nfs/dbraw/zinc/58/59/97/855585997.db2.gz WYVKCHYQGUNGOC-UYAOXDASSA-N 0 3 417.937 4.322 20 0 HIADHN CSc1ccccc1NC(=O)NCCCCN1CCN(Cc2ccccc2)CC1 ZINC000409745707 855632013 /nfs/dbraw/zinc/63/20/13/855632013.db2.gz JACSLCAFBNHYGX-UHFFFAOYSA-N 0 3 412.603 4.128 20 0 HIADHN COCC1(CN[C@@H](C(=O)Nc2ccc(OC)c(Cl)c2)c2ccccc2)CCC1 ZINC000409844967 855684342 /nfs/dbraw/zinc/68/43/42/855684342.db2.gz OMNKTQVAIZNCHW-HXUWFJFHSA-N 0 3 402.922 4.435 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)C2(c3ccccc3Cl)CCOCC2)C1 ZINC000409849785 855686094 /nfs/dbraw/zinc/68/60/94/855686094.db2.gz QZRFOEDITYZYPQ-ICSRJNTNSA-N 0 3 412.961 4.340 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)C2(c3ccccc3Cl)CCOCC2)C1 ZINC000409849784 855686377 /nfs/dbraw/zinc/68/63/77/855686377.db2.gz QZRFOEDITYZYPQ-AZUAARDMSA-N 0 3 412.961 4.340 20 0 HIADHN Cc1ccc(-c2ccnn2C)cc1NC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000410194333 855857704 /nfs/dbraw/zinc/85/77/04/855857704.db2.gz JRACHQPRAWPNDX-HXUWFJFHSA-N 0 3 406.505 4.385 20 0 HIADHN CN1CC[C@@H](NC(=O)NCc2ccnc(Oc3ccccc3F)c2)[C@@H]1c1ccccc1 ZINC000425975946 856025830 /nfs/dbraw/zinc/02/58/30/856025830.db2.gz DJADZQMRWXVWDX-OFNKIYASSA-N 0 3 420.488 4.258 20 0 HIADHN Cc1nc(CCCC(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)cs1 ZINC000426115143 856117376 /nfs/dbraw/zinc/11/73/76/856117376.db2.gz NPJZJBFTCQEZNB-UHFFFAOYSA-N 0 3 413.509 4.383 20 0 HIADHN Cc1nc(CCCC(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)cs1 ZINC000426117323 856118127 /nfs/dbraw/zinc/11/81/27/856118127.db2.gz ZXIDKUBKGIFCAJ-UHFFFAOYSA-N 0 3 413.509 4.383 20 0 HIADHN COc1ccccc1[C@@H](CNC(=O)CCc1nc2cccc(C)c2[nH]1)N1CCCCC1 ZINC000426136915 856132076 /nfs/dbraw/zinc/13/20/76/856132076.db2.gz CJSRZPADABUJCN-OAQYLSRUSA-N 0 3 420.557 4.156 20 0 HIADHN CC(C)c1ccc(-c2ncc(CN3CC[C@H](C(=O)NCC(F)(F)F)C3)s2)cc1 ZINC000426151401 856141439 /nfs/dbraw/zinc/14/14/39/856141439.db2.gz XHQSBJJGBXPXLC-INIZCTEOSA-N 0 3 411.493 4.434 20 0 HIADHN Cn1cc(-c2noc([C@@H]3CCCN(Cc4cccc(F)c4)C3)n2)c(C(F)(F)F)n1 ZINC000426225553 856187499 /nfs/dbraw/zinc/18/74/99/856187499.db2.gz JKRROZTYZZXIGM-CYBMUJFWSA-N 0 3 409.387 4.008 20 0 HIADHN CC[C@@H](NC(=O)c1ccccc1)c1noc([C@@H]2CN(C(C)(C)C)C[C@H]2C(F)(F)F)n1 ZINC000426585614 856360993 /nfs/dbraw/zinc/36/09/93/856360993.db2.gz YHRBWWKIUHZISW-BZUAXINKSA-N 0 3 424.467 4.327 20 0 HIADHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)N[C@H]1CCCC(F)(F)C1 ZINC000426623314 856378291 /nfs/dbraw/zinc/37/82/91/856378291.db2.gz MRKPUBGJSKXOCT-INIZCTEOSA-N 0 3 418.326 4.100 20 0 HIADHN COc1ccccc1[C@H](NC(=O)N(CCN(C)C)Cc1ccccc1)c1ccco1 ZINC000426817075 856495421 /nfs/dbraw/zinc/49/54/21/856495421.db2.gz RTIIFOFDEMMYTQ-QHCPKHFHSA-N 0 3 407.514 4.151 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)Nc1ccc(OC(C)C)c(Cl)c1 ZINC000437431017 862804353 /nfs/dbraw/zinc/80/43/53/862804353.db2.gz TVMQZUOLPZNRMR-UHFFFAOYSA-N 0 3 403.910 4.074 20 0 HIADHN Cc1ccc(C(=O)NCCCCN2C[C@H](C)O[C@@H](C)C2)c(Sc2ccccc2)n1 ZINC000426878973 856524064 /nfs/dbraw/zinc/52/40/64/856524064.db2.gz NKEZMGZHLLBGKF-OALUTQOASA-N 0 3 413.587 4.160 20 0 HIADHN CN(C(=O)NCc1nc(-c2ccccc2F)cs1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000426897105 856531561 /nfs/dbraw/zinc/53/15/61/856531561.db2.gz DOGPDSUERTZMQV-SFHVURJKSA-N 0 3 424.545 4.365 20 0 HIADHN C[C@@H](NC(=O)N(CCN(C)C)Cc1ccccc1F)c1nc(C(F)(F)F)cs1 ZINC000426899659 856532641 /nfs/dbraw/zinc/53/26/41/856532641.db2.gz WYGCIFYKLLLVFC-GFCCVEGCSA-N 0 3 418.460 4.135 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)c1cc(-c2ccc(C)cc2C)n[nH]1 ZINC000426998968 856587259 /nfs/dbraw/zinc/58/72/59/856587259.db2.gz IOTWRISUKCGLBM-NRFANRHFSA-N 0 3 417.557 4.215 20 0 HIADHN CCc1oc(C(=O)OC)cc1CN1CCC[C@H](c2nc(-c3ccc(F)cc3)no2)C1 ZINC000427017914 856597107 /nfs/dbraw/zinc/59/71/07/856597107.db2.gz XZLNTSOUJOQOES-HNNXBMFYSA-N 0 3 413.449 4.197 20 0 HIADHN Cc1ccc(-c2cc(C(=O)N3CCC(CCN4C[C@@H](C)O[C@@H](C)C4)CC3)[nH]n2)c(C)c1 ZINC000427156309 856675973 /nfs/dbraw/zinc/67/59/73/856675973.db2.gz XWFTXFOESMADOE-BGYRXZFFSA-N 0 3 424.589 4.045 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1c[nH]cc1-c1ccccc1F ZINC000427169412 856687417 /nfs/dbraw/zinc/68/74/17/856687417.db2.gz CUHBVEZPVBEYAM-UHFFFAOYSA-N 0 3 407.489 4.277 20 0 HIADHN Cc1ccc(S[C@H](C)C(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)cc1 ZINC000427286471 856751180 /nfs/dbraw/zinc/75/11/80/856751180.db2.gz GADGKTDOXFFABA-HSALFYBXSA-N 0 3 404.620 4.214 20 0 HIADHN CC[C@H](C)Oc1ccc(C(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)cc1 ZINC000427286057 856751311 /nfs/dbraw/zinc/75/13/11/856751311.db2.gz CCVONROMCAZJBF-XUVXKRRUSA-N 0 3 402.579 4.215 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3cccc(Oc4ccncc4)c3)CC2)C[C@@H](C)O1 ZINC000427286736 856752352 /nfs/dbraw/zinc/75/23/52/856752352.db2.gz GZPFXYOPCMETSI-WOJBJXKFSA-N 0 3 423.557 4.225 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)C3(c4ccc(Cl)cc4)CC3)CC2)C[C@H](C)O1 ZINC000427290315 856753730 /nfs/dbraw/zinc/75/37/30/856753730.db2.gz AITYUKNCYYYJNU-ROUUACIJSA-N 0 3 404.982 4.110 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)c3cc(Cl)sc3Cl)CC2)C[C@H](C)O1 ZINC000427298173 856758083 /nfs/dbraw/zinc/75/80/83/856758083.db2.gz ACAHIBHFKSYCNZ-STQMWFEESA-N 0 3 405.391 4.406 20 0 HIADHN C[C@@H]1C[C@H]1C(=O)Nc1ccc(C(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)cc1 ZINC000437471778 862833076 /nfs/dbraw/zinc/83/30/76/862833076.db2.gz XDEBKWZMQFQROO-SELNLUPBSA-N 0 3 405.542 4.018 20 0 HIADHN C[C@@H]1C[C@@H]1C(=O)Nc1ccc(C(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)cc1 ZINC000437471773 862833300 /nfs/dbraw/zinc/83/33/00/862833300.db2.gz XDEBKWZMQFQROO-MSYCTHLASA-N 0 3 405.542 4.018 20 0 HIADHN Cc1nc(-c2ccccc2)oc1C(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000427309787 856763190 /nfs/dbraw/zinc/76/31/90/856763190.db2.gz WANZWVDBBPEBOI-QZTJIDSGSA-N 0 3 411.546 4.002 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)CCc3ccc(-c4ccccc4)[nH]3)CC2)C[C@H](C)O1 ZINC000427315075 856767019 /nfs/dbraw/zinc/76/70/19/856767019.db2.gz SVNVSCASMIBNJL-SFTDATJTSA-N 0 3 423.601 4.352 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)c3cc(Cl)cc4cccnc43)CC2)C[C@H](C)O1 ZINC000427322943 856771557 /nfs/dbraw/zinc/77/15/57/856771557.db2.gz VKSOBOLEIYTUMU-IRXDYDNUSA-N 0 3 415.965 4.240 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)[C@@H]3C[C@@H]3c3c(F)cccc3Cl)CC2)C[C@@H](C)O1 ZINC000427341277 856781893 /nfs/dbraw/zinc/78/18/93/856781893.db2.gz CFJLMPNWXWLGAM-ZAWLATJESA-N 0 3 422.972 4.321 20 0 HIADHN C[C@H]1CCN(C(=O)c2ccc(OCc3ccncc3)cc2)CCN1Cc1ccccc1 ZINC000437475118 862835442 /nfs/dbraw/zinc/83/54/42/862835442.db2.gz AYHIZMQAEJXBIH-NRFANRHFSA-N 0 3 415.537 4.397 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)[C@@H]3C[C@@H]3c3ccccc3Cl)CC2)C[C@@H](C)O1 ZINC000427362486 856793956 /nfs/dbraw/zinc/79/39/56/856793956.db2.gz MUGDVJOEXZHEKK-DEPWHIHDSA-N 0 3 404.982 4.181 20 0 HIADHN Cc1ccc2[nH]cc(CCC(=O)N3CCC(CCN4C[C@@H](C)O[C@H](C)C4)CC3)c2c1 ZINC000427363584 856795419 /nfs/dbraw/zinc/79/54/19/856795419.db2.gz XCOSMBKWNIOXAN-WOJBJXKFSA-N 0 3 411.590 4.147 20 0 HIADHN Cc1ccccc1[C@@H]([C@H](C)NC(=O)C(=O)Nc1ccc(-c2ccco2)cc1F)N(C)C ZINC000427373651 856800122 /nfs/dbraw/zinc/80/01/22/856800122.db2.gz BOZCIQZVSSFHNU-KSFYIVLOSA-N 0 3 423.488 4.140 20 0 HIADHN O=C(CC1(N2CCOCC2)CCCC1)Nc1cccc(NC(=O)C2CCCCC2)c1 ZINC000427462612 856830884 /nfs/dbraw/zinc/83/08/84/856830884.db2.gz NUPWCVUZKAXZCM-UHFFFAOYSA-N 0 3 413.562 4.179 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3cnn(-c4cc(C)ccc4C)c3C)cc2)CC1 ZINC000437486503 862844702 /nfs/dbraw/zinc/84/47/02/862844702.db2.gz VXQOFWQZVWSBHW-UHFFFAOYSA-N 0 3 417.557 4.192 20 0 HIADHN COc1ccc(C2(CN[C@H](C)c3ncc(Br)cc3F)CCOCC2)cc1 ZINC000427605979 856886354 /nfs/dbraw/zinc/88/63/54/856886354.db2.gz FZQZWKCRNCIMBO-CQSZACIVSA-N 0 3 423.326 4.391 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)CCCCC(=O)c2ccc(F)cc2)CC1 ZINC000427669355 856903235 /nfs/dbraw/zinc/90/32/35/856903235.db2.gz YNXKHMGVTRVVGC-GOSISDBHSA-N 0 3 411.521 4.306 20 0 HIADHN C[C@@H]1C[C@@H]1C(=O)Nc1cccc(C(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)c1 ZINC000437492414 862850275 /nfs/dbraw/zinc/85/02/75/862850275.db2.gz GAYHDVZOSNXHLZ-MSYCTHLASA-N 0 3 405.542 4.018 20 0 HIADHN C[C@@H](NCC1CCN(C(=O)c2ccccc2)CC1)c1ncc(Br)cc1F ZINC000427709018 856918224 /nfs/dbraw/zinc/91/82/24/856918224.db2.gz FKJDXPWPBWRCHU-CQSZACIVSA-N 0 3 420.326 4.186 20 0 HIADHN Cc1cnc([C@H](C)Nc2cccc(N3CCN(CCc4ccccc4)CC3)c2)cn1 ZINC000427830622 856973517 /nfs/dbraw/zinc/97/35/17/856973517.db2.gz HTWQUOAVNUBRHZ-NRFANRHFSA-N 0 3 401.558 4.323 20 0 HIADHN Fc1cccc([C@@H](N[C@@H]2CCn3ccnc3C2)c2cccc(Br)c2)c1 ZINC000427866094 856986917 /nfs/dbraw/zinc/98/69/17/856986917.db2.gz OZCROSYHZBQHAM-QUCCMNQESA-N 0 3 400.295 4.479 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1sc([C@@H]2CCCOC2)nc1C)c1ccsc1 ZINC000428179698 857099652 /nfs/dbraw/zinc/09/96/52/857099652.db2.gz YUWAWKFXZQQQPB-NVXWUHKLSA-N 0 3 407.605 4.220 20 0 HIADHN C[C@@H]1CCN(Cc2cnn(Cc3ccc(C(F)(F)F)cc3)c2)C[C@H]1n1ccnc1 ZINC000428265516 857133219 /nfs/dbraw/zinc/13/32/19/857133219.db2.gz OXIJXBGDDQBFRQ-OXQOHEQNSA-N 0 3 403.452 4.230 20 0 HIADHN O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)c1cc(C2CC2)nc2ccccc21 ZINC000428447367 857205956 /nfs/dbraw/zinc/20/59/56/857205956.db2.gz LXJTVMLNVIYCQA-OAQYLSRUSA-N 0 3 415.537 4.133 20 0 HIADHN CC(C)COc1cccc(CN(C)[C@@H](C)c2cccc(N3CCCS3(=O)=O)c2)c1 ZINC000428478849 857217982 /nfs/dbraw/zinc/21/79/82/857217982.db2.gz GZHWXADTJPYOLT-IBGZPJMESA-N 0 3 416.587 4.454 20 0 HIADHN O=C(Nc1cccc(CN2CCC(Cn3cncn3)CC2)c1)c1ccccc1Cl ZINC000428478943 857217999 /nfs/dbraw/zinc/21/79/99/857217999.db2.gz XCHDUDSXBJFNMZ-UHFFFAOYSA-N 0 3 409.921 4.096 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N2CCC(c3ncccc3Cl)CC2)N(C)C)cc1 ZINC000428528370 857242421 /nfs/dbraw/zinc/24/24/21/857242421.db2.gz DJZLFLMKQIHWOL-HXUWFJFHSA-N 0 3 400.954 4.235 20 0 HIADHN CCc1ccc(-c2nc(CC(=O)Nc3cccc(CN4CC[C@@H](O)C4)c3)cs2)cc1 ZINC000428531267 857243679 /nfs/dbraw/zinc/24/36/79/857243679.db2.gz FLUUROFUYKQEBZ-JOCHJYFZSA-N 0 3 421.566 4.120 20 0 HIADHN OC[C@H](CNCc1sccc1Br)Cc1cccc(Br)c1 ZINC000428535605 857247461 /nfs/dbraw/zinc/24/74/61/857247461.db2.gz LKZQBXYXDANGLG-LBPRGKRZSA-N 0 3 419.182 4.214 20 0 HIADHN Cc1nc(-c2ccccc2C)sc1C(=O)Nc1cccc(CN2CC[C@@H](O)C2)c1 ZINC000428541893 857253199 /nfs/dbraw/zinc/25/31/99/857253199.db2.gz QBRNRRPZZGRWHS-LJQANCHMSA-N 0 3 407.539 4.246 20 0 HIADHN Cn1c(CNC[C@]2(Cc3ccc(F)cc3)CCC[C@@H]2O)nc2cc(Cl)ccc21 ZINC000428573953 857269088 /nfs/dbraw/zinc/26/90/88/857269088.db2.gz QJIQXNXUTQWFFF-RBBKRZOGSA-N 0 3 401.913 4.229 20 0 HIADHN Cc1ccccc1[C@H](NC(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1)C1CC1 ZINC000428586492 857273085 /nfs/dbraw/zinc/27/30/85/857273085.db2.gz OHFXIVPWTXTQEU-LADGPHEKSA-N 0 3 407.558 4.036 20 0 HIADHN C[C@@H](NC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1)c1nc(C(F)(F)F)cs1 ZINC000428624117 857281348 /nfs/dbraw/zinc/28/13/48/857281348.db2.gz IQYKIUQSFNVGFD-TZMCWYRMSA-N 0 3 415.456 4.390 20 0 HIADHN COc1cc(OC)c(NC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)cc1Cl ZINC000437576368 862895103 /nfs/dbraw/zinc/89/51/03/862895103.db2.gz FUNIICFDXXGZEB-MRXNPFEDSA-N 0 3 417.937 4.486 20 0 HIADHN CC(C)c1noc(CN(Cc2ccncc2)[C@H]2CCCN(Cc3ccccc3)C2)n1 ZINC000428812888 857357108 /nfs/dbraw/zinc/35/71/08/857357108.db2.gz ODZFJZYGPGJWNX-QFIPXVFZSA-N 0 3 405.546 4.255 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)N[C@H]3CCSc4ccccc43)CC2)C[C@@H](C)O1 ZINC000428917971 857413380 /nfs/dbraw/zinc/41/33/80/857413380.db2.gz SLKMIZZJKFQYFW-OPYAIIAOSA-N 0 3 417.619 4.144 20 0 HIADHN CC(C)c1cc(C(=O)N(C)C[C@]2(O)CCN(Cc3ccccc3)C2)c2ccccc2n1 ZINC000428959610 857434762 /nfs/dbraw/zinc/43/47/62/857434762.db2.gz YVCXLPOVPZRNSM-AREMUKBSSA-N 0 3 417.553 4.067 20 0 HIADHN C[C@@H](c1ccccc1Cl)N(C)C(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000429007420 857454112 /nfs/dbraw/zinc/45/41/12/857454112.db2.gz KAWUTAWXDWHBFE-ICSRJNTNSA-N 0 3 415.965 4.334 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3cccc(Cl)c3N(C)C)CC2)C[C@@H](C)O1 ZINC000429033934 857467712 /nfs/dbraw/zinc/46/77/12/857467712.db2.gz ZFDUQIVRYWDBET-IAGOWNOFSA-N 0 3 423.001 4.149 20 0 HIADHN CCN(C(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1)[C@@H](C)Cc1ccsc1 ZINC000429040682 857472178 /nfs/dbraw/zinc/47/21/78/857472178.db2.gz IWKDDRSPZWBYBM-UGKGYDQZSA-N 0 3 415.603 4.002 20 0 HIADHN CO[C@@H](C)c1cccc(NC(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)c1 ZINC000429060454 857485562 /nfs/dbraw/zinc/48/55/62/857485562.db2.gz PBJLHFJWPNBMKH-OTWHNJEPSA-N 0 3 403.567 4.137 20 0 HIADHN CO[C@H](C)c1cccc(NC(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)c1 ZINC000429060452 857486070 /nfs/dbraw/zinc/48/60/70/857486070.db2.gz PBJLHFJWPNBMKH-GUDVDZBRSA-N 0 3 403.567 4.137 20 0 HIADHN CC(=O)N1CCC(N(Cc2cncs2)C[C@@H](OC(C)C)c2ccccc2)CC1 ZINC000429116749 857517980 /nfs/dbraw/zinc/51/79/80/857517980.db2.gz OAVKCRBIAQCDLK-JOCHJYFZSA-N 0 3 401.576 4.122 20 0 HIADHN CC[C@H](NC(=O)N1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1)c1ccc(OC)cc1 ZINC000429208151 857554733 /nfs/dbraw/zinc/55/47/33/857554733.db2.gz ZNYBFSDPQKLPBD-YDHSSHFGSA-N 0 3 417.594 4.067 20 0 HIADHN Cc1nc2ccc(NC(=O)N3CCC(CCN4C[C@@H](C)O[C@@H](C)C4)CC3)cc2s1 ZINC000429219370 857560475 /nfs/dbraw/zinc/56/04/75/857560475.db2.gz HPYBQQATMLNPCL-IYBDPMFKSA-N 0 3 416.591 4.348 20 0 HIADHN CCCn1ccnc1CCCN(C)[C@@H]1CCN(c2ccc(Cl)cc2Cl)C1=O ZINC000429246974 857573250 /nfs/dbraw/zinc/57/32/50/857573250.db2.gz PRRBZVDPTBDNJU-GOSISDBHSA-N 0 3 409.361 4.270 20 0 HIADHN O=C(NC1CC(F)(F)C1)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000429255793 857577879 /nfs/dbraw/zinc/57/78/79/857577879.db2.gz UJKORPOTYBHOOI-UHFFFAOYSA-N 0 3 406.304 4.399 20 0 HIADHN COc1ccc(OCC(=O)N(c2cccc(SC)c2)C2CCN(C)CC2)cc1C ZINC000429286754 857592223 /nfs/dbraw/zinc/59/22/23/857592223.db2.gz SQXQXFVHPXYRPD-UHFFFAOYSA-N 0 3 414.571 4.232 20 0 HIADHN CC(C)n1nccc1NC(=O)[C@@H](C)N[C@@H]1c2cc(Br)ccc2CC1(C)C ZINC000429292098 857594449 /nfs/dbraw/zinc/59/44/49/857594449.db2.gz ICRYSAKQBQTXCV-FZKQIMNGSA-N 0 3 419.367 4.467 20 0 HIADHN O=C(CN[C@@H]1Cc2cccc(O)c2C1)N[C@@H](c1ccccc1)c1ccc(Cl)cc1 ZINC000429302260 857597131 /nfs/dbraw/zinc/59/71/31/857597131.db2.gz RNMJSBQHAXGPJH-YKSBVNFPSA-N 0 3 406.913 4.008 20 0 HIADHN CCC1(CC)[C@H](NCC(=O)Nc2c(F)cc(F)cc2Br)[C@@H](C)[C@H]1OC ZINC000429316799 857601363 /nfs/dbraw/zinc/60/13/63/857601363.db2.gz WYWLUNQURXKFHE-FDOKIQAASA-N 0 3 419.310 4.095 20 0 HIADHN CC(C)C[C@H]1CN(CCCc2ccccc2)CCN1CC(=O)Nc1ccccc1F ZINC000429362985 857622629 /nfs/dbraw/zinc/62/26/29/857622629.db2.gz CGNSZCVQYALJEP-QFIPXVFZSA-N 0 3 411.565 4.429 20 0 HIADHN CN(C)S(=O)(=O)c1ccc(CN[C@H](Cc2ccccc2F)c2ccccc2)cc1 ZINC000429416586 857654469 /nfs/dbraw/zinc/65/44/69/857654469.db2.gz IUFYMXVPIRKOFH-HSZRJFAPSA-N 0 3 412.530 4.150 20 0 HIADHN Fc1ccc([C@H](NC[C@H]2CN(Cc3ccccc3)CCCO2)c2cccnc2)cc1 ZINC000429445255 857673225 /nfs/dbraw/zinc/67/32/25/857673225.db2.gz FSBBLZKZQLRXJE-DQEYMECFSA-N 0 3 405.517 4.191 20 0 HIADHN CC(C)c1ccc(NC(=O)C[C@@H](C)NCc2ccc(S(C)(=O)=O)c(Cl)c2)cc1 ZINC000429459240 857682585 /nfs/dbraw/zinc/68/25/85/857682585.db2.gz VQVPYQOMWPDMJU-OAHLLOKOSA-N 0 3 422.978 4.374 20 0 HIADHN CC(C)(C)[C@H](CN1CCc2ccccc2C1)NC(=O)N(Cc1ccccn1)C1CC1 ZINC000429492157 857695006 /nfs/dbraw/zinc/69/50/06/857695006.db2.gz FTNOYDUJEMKVTA-QHCPKHFHSA-N 0 3 406.574 4.229 20 0 HIADHN Cc1cc([C@@H]2CCCN2C(=O)N[C@H](CN2CCc3ccccc3C2)C(C)(C)C)on1 ZINC000429502494 857701596 /nfs/dbraw/zinc/70/15/96/857701596.db2.gz JXLGSAOXRLMDEY-RBBKRZOGSA-N 0 3 410.562 4.303 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)c1ccccc1COC1CCOCC1 ZINC000429665725 857826631 /nfs/dbraw/zinc/82/66/31/857826631.db2.gz AKSDMZVRKDBZQV-OAQYLSRUSA-N 0 3 422.569 4.119 20 0 HIADHN COc1ccc([C@@H](NC[C@H]2CN(Cc3ccccc3)CCCO2)C(F)(F)F)cc1 ZINC000429684813 857833431 /nfs/dbraw/zinc/83/34/31/857833431.db2.gz LEDHCKFWHPEZSG-LEWJYISDSA-N 0 3 408.464 4.179 20 0 HIADHN C[C@H](NC(=O)Nc1ccnn1Cc1c(Cl)cccc1Cl)C1=CCN(C)CC1 ZINC000429735300 857858627 /nfs/dbraw/zinc/85/86/27/857858627.db2.gz DLLUGXUQROLWCM-ZDUSSCGKSA-N 0 3 408.333 4.010 20 0 HIADHN CC(C)n1ncc2ccc(NC(=O)NC[C@@H]3CN(Cc4ccccc4)CCCO3)cc21 ZINC000429736520 857859386 /nfs/dbraw/zinc/85/93/86/857859386.db2.gz OXWBZCYSWOANAG-JOCHJYFZSA-N 0 3 421.545 4.030 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCc1ccncc1C)c1ccc(C(F)(F)F)cc1 ZINC000429777314 857881600 /nfs/dbraw/zinc/88/16/00/857881600.db2.gz VMALQWZQWNPDMU-LJQANCHMSA-N 0 3 408.468 4.291 20 0 HIADHN CCO[C@@H]1C[C@H](NCC(=O)Nc2c(C)nn(-c3ccc(C)cc3)c2C)C12CCCCC2 ZINC000429792761 857886419 /nfs/dbraw/zinc/88/64/19/857886419.db2.gz UWCIGQGJSMHXTP-FCHUYYIVSA-N 0 3 424.589 4.454 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)CO[C@H]3CCCc4ccccc43)c(C)c2)CC1 ZINC000430098866 858032045 /nfs/dbraw/zinc/03/20/45/858032045.db2.gz KHDPYFVRRJBXLH-DEOSSOPVSA-N 0 3 407.558 4.170 20 0 HIADHN COC(=O)[C@@H]1CCO[C@H]1C1CCN(Cc2ccc(-c3c(F)cccc3F)o2)CC1 ZINC000430101056 858033011 /nfs/dbraw/zinc/03/30/11/858033011.db2.gz HWSMKNJPYYFJQK-IERDGZPVSA-N 0 3 405.441 4.015 20 0 HIADHN COC(=O)[C@@H]1CCO[C@H]1C1CCN(Cc2ccc(F)c(-c3cccs3)c2)CC1 ZINC000430103173 858033171 /nfs/dbraw/zinc/03/31/71/858033171.db2.gz GOARBAXBAJXMMW-UTKZUKDTSA-N 0 3 403.519 4.344 20 0 HIADHN CN1CCN(CCC(C)(C)NC(=O)N[C@H]2CCc3ccc(-c4ccccc4)cc32)CC1 ZINC000430175892 858066591 /nfs/dbraw/zinc/06/65/91/858066591.db2.gz DQBIPNZXDNBHIZ-DEOSSOPVSA-N 0 3 420.601 4.056 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N[C@@H]2C[C@H]2c2cc(F)c(F)c(F)c2)C1 ZINC000437648951 862981260 /nfs/dbraw/zinc/98/12/60/862981260.db2.gz WFHVYAXSJHGCDN-LKCJXIOFSA-N 0 3 403.448 4.095 20 0 HIADHN Cc1cc([C@@H]2CCCN2CCc2nnnn2-c2ccccc2)ccc1Br ZINC000430229411 858090175 /nfs/dbraw/zinc/09/01/75/858090175.db2.gz VGHFXXLZJWFKJY-IBGZPJMESA-N 0 3 412.335 4.113 20 0 HIADHN C[C@@H]1C[C@]2(CCO1)CN(CCC(=O)Nc1ccc(Oc3ccccc3)cc1)C[C@H](C)O2 ZINC000430259862 858099573 /nfs/dbraw/zinc/09/95/73/858099573.db2.gz FXVLARLGOIONRO-OHUGHZGNSA-N 0 3 424.541 4.466 20 0 HIADHN CN(C(=O)N[C@@H](CC1CC1)c1cc(F)cc(Br)c1)[C@H]1CCN(C2CC2)C1 ZINC000430295537 858111894 /nfs/dbraw/zinc/11/18/94/858111894.db2.gz CYGILVIMKDYZCI-OALUTQOASA-N 0 3 424.358 4.308 20 0 HIADHN CSc1ccccc1NC(=O)CCN(CCc1ccccn1)Cc1cccnc1 ZINC000430333952 858124125 /nfs/dbraw/zinc/12/41/25/858124125.db2.gz CGBBRSYYXCRHKR-UHFFFAOYSA-N 0 3 406.555 4.272 20 0 HIADHN COc1ccc(NC(=O)CCN(CCc2ccccn2)Cc2cccnc2)cc1Cl ZINC000430342166 858127309 /nfs/dbraw/zinc/12/73/09/858127309.db2.gz GUUOMZJRJWKRPN-UHFFFAOYSA-N 0 3 424.932 4.212 20 0 HIADHN CN(C(=O)c1cccc(CN2CCCC2)c1)[C@@H]1c2cc(Cl)cc(Cl)c2C[C@@H]1O ZINC000430423426 858154457 /nfs/dbraw/zinc/15/44/57/858154457.db2.gz GCYGOBRSYGBUFY-LEWJYISDSA-N 0 3 419.352 4.320 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2ccc(OC(C)(C)C)cc2)cc1)[C@@H]1CCCN(C)C1 ZINC000430596364 858231338 /nfs/dbraw/zinc/23/13/38/858231338.db2.gz WKNPGWGKGWOEHX-OAQYLSRUSA-N 0 3 423.557 4.282 20 0 HIADHN CC(C)[C@@H](N[C@@H](C)c1ccc(Br)c(S(N)(=O)=O)c1)c1ccccc1 ZINC000430694431 858272286 /nfs/dbraw/zinc/27/22/86/858272286.db2.gz DOGCHZZRZLNVDD-SCLBCKFNSA-N 0 3 411.365 4.144 20 0 HIADHN CCC[C@H](N[C@H](C)c1ccc(Br)c(S(N)(=O)=O)c1)c1ccccc1 ZINC000430695572 858272526 /nfs/dbraw/zinc/27/25/26/858272526.db2.gz OCLYMYDZNNVBFC-DYVFJYSZSA-N 0 3 411.365 4.289 20 0 HIADHN Cc1cccc([C@@H](C)N[C@@H](C)c2ccc(Br)c(S(N)(=O)=O)c2)c1C ZINC000430719957 858278216 /nfs/dbraw/zinc/27/82/16/858278216.db2.gz LIVLBEYBFMUSQC-UONOGXRCSA-N 0 3 411.365 4.125 20 0 HIADHN CNC(=O)[C@]1(C)CCN(Cc2c(C)nn(-c3ccccc3)c2Oc2cccc(F)c2)C1 ZINC000430758469 858292288 /nfs/dbraw/zinc/29/22/88/858292288.db2.gz AQSZFLWDQOFLPB-XMMPIXPASA-N 0 3 422.504 4.070 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)c1cccc(C(F)(F)F)c1F ZINC000430763393 858294113 /nfs/dbraw/zinc/29/41/13/858294113.db2.gz NZHQTAIPKFLDIA-MRXNPFEDSA-N 0 3 409.427 4.366 20 0 HIADHN CCN(CC)[C@@H](CN1C(=O)N[C@@H](c2ccc(OC(F)F)cc2)C1=O)c1ccsc1 ZINC000430869011 858347182 /nfs/dbraw/zinc/34/71/82/858347182.db2.gz PAHOEVALSYFMQW-IRXDYDNUSA-N 0 3 423.485 4.026 20 0 HIADHN CCn1ccnc1[C@H]1CCCCN1C(=O)N[C@@H](CN(C)Cc1ccccc1)C(C)C ZINC000430895345 858358608 /nfs/dbraw/zinc/35/86/08/858358608.db2.gz UBOIKWLLZUJCHR-FCHUYYIVSA-N 0 3 411.594 4.296 20 0 HIADHN C[C@@H]1CCN(C(=O)Nc2ccc(C(=O)NC(C)(C)C)cc2)CCN1Cc1ccccc1 ZINC000437675739 863017714 /nfs/dbraw/zinc/01/77/14/863017714.db2.gz HXLLTMGDBATEHV-LJQANCHMSA-N 0 3 422.573 4.343 20 0 HIADHN CC[C@H](c1ccccc1)N1CC(=O)N(C[C@H](c2ccc(OC)cc2)N2CCCC2)C1=O ZINC000430980818 858389977 /nfs/dbraw/zinc/38/99/77/858389977.db2.gz UOSRAFIIFKXNLZ-DHIUTWEWSA-N 0 3 421.541 4.248 20 0 HIADHN O=C1N[C@@H](Cc2cccc3ccccc32)C(=O)N1C[C@H](c1cccs1)N1CCCC1 ZINC000430979727 858390174 /nfs/dbraw/zinc/39/01/74/858390174.db2.gz QDAVHQCMSSLZBZ-LEWJYISDSA-N 0 3 419.550 4.201 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3ccc4oc(COC)nc4c3)c(C)c2)CC1 ZINC000431057271 858423485 /nfs/dbraw/zinc/42/34/85/858423485.db2.gz HJJXPFZNQCKGKQ-UHFFFAOYSA-N 0 3 423.517 4.069 20 0 HIADHN CN(C(=O)N[C@@H]1CC[C@@H](c2ccccc2F)C1)C1CCN(CCc2ccccn2)CC1 ZINC000431058882 858425209 /nfs/dbraw/zinc/42/52/09/858425209.db2.gz AHGVYKPGAOETIC-TZIWHRDSSA-N 0 3 424.564 4.205 20 0 HIADHN CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)N[C@H]1CC[C@@H](c2ccccc2F)C1 ZINC000431060559 858427529 /nfs/dbraw/zinc/42/75/29/858427529.db2.gz SQIPQKJLTTYLKQ-UYOCQKMUSA-N 0 3 410.537 4.191 20 0 HIADHN O=C1N[C@H](c2ccc3ccccc3c2)C(=O)N1C[C@@H]1CCCN(Cc2cccs2)C1 ZINC000431166958 858482598 /nfs/dbraw/zinc/48/25/98/858482598.db2.gz MJIFHJMPFNETSX-VGOFRKELSA-N 0 3 419.550 4.406 20 0 HIADHN C[C@H](NC(=O)NC[C@@H](c1ccccc1)N(C)C)c1noc(-c2ccc(Cl)cc2)n1 ZINC000431723019 858764224 /nfs/dbraw/zinc/76/42/24/858764224.db2.gz IQZRKWFTKODRAB-KSSFIOAISA-N 0 3 413.909 4.053 20 0 HIADHN C[C@H]1CCN(C(=O)CCc2cccc(OC(C)(C)C)n2)CCN1Cc1ccccc1 ZINC000467530506 881348807 /nfs/dbraw/zinc/34/88/07/881348807.db2.gz SSCXOJIXDOHWLS-FQEVSTJZSA-N 0 3 409.574 4.315 20 0 HIADHN O=C(NCCN1CCCC1)c1ccc(NC(=O)c2c(Cl)cc(F)cc2Cl)cc1 ZINC000431841275 858836159 /nfs/dbraw/zinc/83/61/59/858836159.db2.gz QTDKDXCQUQAFSQ-UHFFFAOYSA-N 0 3 424.303 4.210 20 0 HIADHN CN(Cc1cccc(C(F)(F)F)c1)C1CCN(C(=O)C2C[C@H]3CC[C@@H](C2)C3=O)CC1 ZINC000431935743 858878025 /nfs/dbraw/zinc/87/80/25/858878025.db2.gz HOQVERADGOJYDC-JWTNVVGKSA-N 0 3 422.491 4.134 20 0 HIADHN COc1cccc(C2(F)CCN(Cc3ccc(OCc4noc(C)n4)cc3)CC2)c1 ZINC000467546540 881367415 /nfs/dbraw/zinc/36/74/15/881367415.db2.gz ANBGPHZGTQSOIU-UHFFFAOYSA-N 0 3 411.477 4.426 20 0 HIADHN O=C(NCCN1CCCC1)c1ccc(CNCc2csc(Cl)c2Cl)cc1 ZINC000432253493 859069843 /nfs/dbraw/zinc/06/98/43/859069843.db2.gz KSCQPRCDQDISTL-UHFFFAOYSA-N 0 3 412.386 4.170 20 0 HIADHN Cc1ccc(S(=O)(=O)N2CCC(NCc3csc(Cl)c3Cl)CC2)cc1 ZINC000432258876 859072031 /nfs/dbraw/zinc/07/20/31/859072031.db2.gz MNPPPXHDXKUMFQ-UHFFFAOYSA-N 0 3 419.399 4.306 20 0 HIADHN Cc1cc(NC(=O)N2CC(C3CCCC3)C2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000432284347 859085536 /nfs/dbraw/zinc/08/55/36/859085536.db2.gz HOZKWISDJQMOMK-JOCHJYFZSA-N 0 3 407.562 4.292 20 0 HIADHN COCC[C@H]1CCCCN(C(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)C1 ZINC000467559354 881382352 /nfs/dbraw/zinc/38/23/52/881382352.db2.gz GDVYKZXTXCDOCM-UXHICEINSA-N 0 3 407.624 4.369 20 0 HIADHN Cc1nn(C(C)(C)C)cc1[C@H](C)NC(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000467565350 881387566 /nfs/dbraw/zinc/38/75/66/881387566.db2.gz UMUNLAPOGDJEAU-YJBOKZPZSA-N 0 3 403.596 4.205 20 0 HIADHN O=C(NCc1cccc(-c2cccnc2)c1)NC[C@@H](c1cccs1)N1CCCC1 ZINC000467565659 881388404 /nfs/dbraw/zinc/38/84/04/881388404.db2.gz VANHXRWJTIDGFF-NRFANRHFSA-N 0 3 406.555 4.446 20 0 HIADHN O=C(NCC[C@H](c1ccccc1)C(F)(F)F)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000432470918 859180245 /nfs/dbraw/zinc/18/02/45/859180245.db2.gz VVHXHGZNGFBGQT-VQTJNVASSA-N 0 3 405.464 4.296 20 0 HIADHN COC(=O)C12CCC(C(=O)NC[C@H](c3ccccc3)N3CCC(C)CC3)(CC1)CC2 ZINC000432683561 859292488 /nfs/dbraw/zinc/29/24/88/859292488.db2.gz ZKJZCBRUPJFYGP-BURHJUHKSA-N 0 3 412.574 4.089 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)C2(Cc3cccc(F)c3)CCOCC2)C1 ZINC000432881285 859405216 /nfs/dbraw/zinc/40/52/16/859405216.db2.gz QOOQBXLBOYRHTM-XXBNENTESA-N 0 3 410.533 4.117 20 0 HIADHN CN(C)Cc1ccc(S(=O)(=O)N2CCc3sccc3[C@@H]2c2cccs2)cc1 ZINC000432944122 859440417 /nfs/dbraw/zinc/44/04/17/859440417.db2.gz LFVOJYSSRHEAMK-HXUWFJFHSA-N 0 3 418.609 4.208 20 0 HIADHN COc1cnccc1N1CCN(C(=O)Nc2cc(-c3ccc(C)o3)ccc2C)CC1 ZINC000432979070 859460831 /nfs/dbraw/zinc/46/08/31/859460831.db2.gz LTYVEMBBQWTYEO-UHFFFAOYSA-N 0 3 406.486 4.321 20 0 HIADHN C[C@@H]1OCC[C@]1(O)CN[C@@H](Cc1ccccc1F)c1ccccc1Br ZINC000433004496 859473119 /nfs/dbraw/zinc/47/31/19/859473119.db2.gz YXGFHUWBDWALDN-GKCIPKSASA-N 0 3 408.311 4.002 20 0 HIADHN COc1cc(NC(=O)CSCCN(C)Cc2ccccc2)c(OC)cc1Cl ZINC000433040780 859495899 /nfs/dbraw/zinc/49/58/99/859495899.db2.gz UGEWBQFIXMKVEO-UHFFFAOYSA-N 0 3 408.951 4.161 20 0 HIADHN OCC1(c2ccccc2)CCN(CCc2cc(Cl)c3c(c2)OCCCO3)CC1 ZINC000433069370 859508793 /nfs/dbraw/zinc/50/87/93/859508793.db2.gz RNWGOLFPJHNRFG-UHFFFAOYSA-N 0 3 401.934 4.070 20 0 HIADHN CCc1ccc([C@H](CNC(=O)Nc2cccc([S@@](C)=O)c2)N(CC)CC)cc1 ZINC000433137475 859535341 /nfs/dbraw/zinc/53/53/41/859535341.db2.gz TZVNFYADJCKIAY-RBTNQOKQSA-N 0 3 401.576 4.191 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)[C@@H]1C[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000467635514 881433491 /nfs/dbraw/zinc/43/34/91/881433491.db2.gz YTVLIGNUGXYCPK-RTBURBONSA-N 0 3 418.459 4.050 20 0 HIADHN CCNC(=O)N(C)c1cccc(NC(=O)NC[C@@H](c2ccsc2)N(CC)CC)c1 ZINC000433244895 859588374 /nfs/dbraw/zinc/58/83/74/859588374.db2.gz ZFCSCRURUUIQRJ-IBGZPJMESA-N 0 3 417.579 4.118 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)C2(Cc3cccc(F)c3)CCOCC2)N2CCCC2)cc1 ZINC000433250117 859592185 /nfs/dbraw/zinc/59/21/85/859592185.db2.gz YQLYQVYWXZANBP-XMMPIXPASA-N 0 3 424.560 4.427 20 0 HIADHN C[C@@H](C(=O)Nc1cccc(Oc2ncc(Br)cn2)c1)N1[C@H](C)CC[C@H]1C ZINC000433271454 859606584 /nfs/dbraw/zinc/60/65/84/859606584.db2.gz TZPXGVKTHDQLPQ-MCIONIFRSA-N 0 3 419.323 4.231 20 0 HIADHN C[C@H]1CN(C(=O)Nc2ccc(Cl)cc2C(=O)c2ccc[nH]2)CCN(C2CCC2)C1 ZINC000433288478 859619446 /nfs/dbraw/zinc/61/94/46/859619446.db2.gz ZJOHIAXEPUXBOO-OAHLLOKOSA-N 0 3 414.937 4.237 20 0 HIADHN CCOc1ccc(C2(CNCc3ncc(C(F)(F)F)s3)CCOCC2)cc1 ZINC000433339008 859653822 /nfs/dbraw/zinc/65/38/22/859653822.db2.gz YPPIYPHOOCGOHZ-UHFFFAOYSA-N 0 3 400.466 4.399 20 0 HIADHN NC(=O)c1cccc(Oc2ccc(NC(=O)[C@H]3CCCCN3C3CCCC3)cc2)c1 ZINC000433358860 859657972 /nfs/dbraw/zinc/65/79/72/859657972.db2.gz FGHXIKOQQVXDMC-JOCHJYFZSA-N 0 3 407.514 4.313 20 0 HIADHN O=C(NCc1ccccc1)[C@@H](N[C@@H]1CCOC2(CCSCC2)C1)c1ccccc1 ZINC000433460965 859714099 /nfs/dbraw/zinc/71/40/99/859714099.db2.gz COBRVEMJDFETBF-YADHBBJMSA-N 0 3 410.583 4.079 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N[C@@H](c1cc(F)ccc1F)C(F)F ZINC000433612574 859809971 /nfs/dbraw/zinc/80/99/71/859809971.db2.gz NELFVLYQACHVQL-WBVHZDCISA-N 0 3 415.456 4.469 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)N[C@H](c1cc(F)ccc1F)C(F)F ZINC000433646686 859823112 /nfs/dbraw/zinc/82/31/12/859823112.db2.gz AKKZURAHBJXDSA-LJQANCHMSA-N 0 3 409.427 4.019 20 0 HIADHN C[C@@H]1[C@H](NC(=O)Nc2ccc(Oc3ncc(Cl)cn3)c(Cl)c2)CCCN1C ZINC000433670224 859832552 /nfs/dbraw/zinc/83/25/52/859832552.db2.gz QBSARNPWSOLLQW-IAQYHMDHSA-N 0 3 410.305 4.180 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)c2ccc(C(C)(C)C(F)(F)F)cc2)C[C@@H](C)O1 ZINC000433708486 859846876 /nfs/dbraw/zinc/84/68/76/859846876.db2.gz ISCUVCAKIKWYNO-HZPDHXFCSA-N 0 3 400.485 4.146 20 0 HIADHN CCNC(=O)Nc1cccc(NC(=O)NCC(C)(C)N2CCc3ccccc3C2)c1C ZINC000433728407 859858301 /nfs/dbraw/zinc/85/83/01/859858301.db2.gz MCCDEYKHBZJJID-UHFFFAOYSA-N 0 3 423.561 4.095 20 0 HIADHN CCNC(=O)Nc1cccc(NC(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)c1C ZINC000433744653 859871352 /nfs/dbraw/zinc/87/13/52/859871352.db2.gz LQILZVJEMHSFBL-MJGOQNOKSA-N 0 3 409.534 4.093 20 0 HIADHN CN(C(=O)Nc1ccc(F)cc1-c1cnn(C)c1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000433805342 859901780 /nfs/dbraw/zinc/90/17/80/859901780.db2.gz VNVAWUOCKXZXLG-NRFANRHFSA-N 0 3 421.520 4.355 20 0 HIADHN Cc1c(NC(=O)N(CCN(C)C)Cc2cccc(C)c2)noc1-c1ccccc1F ZINC000433919338 859971153 /nfs/dbraw/zinc/97/11/53/859971153.db2.gz MTYDAIRYXFGBQC-UHFFFAOYSA-N 0 3 410.493 4.693 20 0 HIADHN O=C(NC[C@H]1CCCCN1C1CC1)N1CCC[C@H](c2nc(C(F)(F)F)cs2)C1 ZINC000433955524 860000056 /nfs/dbraw/zinc/00/00/56/860000056.db2.gz ONQKQZDLIUHYKP-DZGCQCFKSA-N 0 3 416.513 4.068 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)COc2ccc(Oc3ccccn3)cc2)CN1Cc1ccccc1 ZINC000467698882 881493857 /nfs/dbraw/zinc/49/38/57/881493857.db2.gz CGVXYEGPOVVNFR-CTNGQTDRSA-N 0 3 417.509 4.032 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)Cc2csc(Cc3ccccc3)n2)CN1Cc1ccccc1 ZINC000467699207 881494054 /nfs/dbraw/zinc/49/40/54/881494054.db2.gz DFYTXHPSQJLSFH-NQIIRXRSSA-N 0 3 405.567 4.056 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)Cc2cc(Br)ccc2F)CC1 ZINC000434034751 860054618 /nfs/dbraw/zinc/05/46/18/860054618.db2.gz FCTQYILORRNQAB-UHFFFAOYSA-N 0 3 419.338 4.254 20 0 HIADHN C[C@H]1CN(C2CC2)C[C@H]1NC(=O)CSc1ncnc2scc(-c3ccccc3)c21 ZINC000467713998 881511112 /nfs/dbraw/zinc/51/11/12/881511112.db2.gz KUJKNQJXZHCFJX-KBXCAEBGSA-N 0 3 424.595 4.049 20 0 HIADHN Cc1ccccc1-c1nn(-c2ccccc2)cc1C(=O)N[C@@H]1CN(C2CC2)C[C@@H]1C ZINC000467718888 881518100 /nfs/dbraw/zinc/51/81/00/881518100.db2.gz VDKCUHFIJAAVKO-FDDCHVKYSA-N 0 3 400.526 4.060 20 0 HIADHN C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)c1cc(-c2ccc(F)cc2)nc2onc(C3CC3)c21 ZINC000467718118 881518323 /nfs/dbraw/zinc/51/83/23/881518323.db2.gz LBOYXXDXASIYEH-XCLFUZPHSA-N 0 3 420.488 4.119 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)CCOc1ccccc1 ZINC000434309740 860271106 /nfs/dbraw/zinc/27/11/06/860271106.db2.gz TXSDGMFZFMAFBX-OAQYLSRUSA-N 0 3 404.514 4.046 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)CCc1ccc(F)cc1 ZINC000434315670 860276046 /nfs/dbraw/zinc/27/60/46/860276046.db2.gz KFEBSJAEQGFITI-QFIPXVFZSA-N 0 3 406.505 4.349 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)C[C@@H](C)c1cccnc1 ZINC000434315599 860276227 /nfs/dbraw/zinc/27/62/27/860276227.db2.gz CZWDPKXJNGTMAB-GCJKJVERSA-N 0 3 403.530 4.166 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)CCOc1cccc(C)c1 ZINC000434317073 860278204 /nfs/dbraw/zinc/27/82/04/860278204.db2.gz ORJYYWHSIAFQGH-QFIPXVFZSA-N 0 3 418.541 4.355 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)CO[C@@H]1CCCC[C@@H]1C ZINC000434319569 860279336 /nfs/dbraw/zinc/27/93/36/860279336.db2.gz YLDOSWGLGXMQIC-VLCRHTCISA-N 0 3 410.562 4.172 20 0 HIADHN CCCCS[C@H](C)C(=O)Nc1c(C)cnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000434322097 860282495 /nfs/dbraw/zinc/28/24/95/860282495.db2.gz TXWNYNUWNXEMOI-QUCCMNQESA-N 0 3 400.592 4.499 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)CCOCc1ccccc1 ZINC000434322284 860283531 /nfs/dbraw/zinc/28/35/31/860283531.db2.gz URFNIYJLPGBYNT-HSZRJFAPSA-N 0 3 418.541 4.184 20 0 HIADHN CC[C@@H](C)c1cc(C(=O)Nc2c(C)cnn2[C@H]2CCN(Cc3ccccc3)C2)on1 ZINC000434322712 860283576 /nfs/dbraw/zinc/28/35/76/860283576.db2.gz XJLUKHTXCVZHFA-APWZRJJASA-N 0 3 407.518 4.392 20 0 HIADHN COc1cc(CC(=O)Nc2c(C)cnn2[C@H]2CCN(Cc3ccccc3)C2)ccc1C ZINC000434324676 860286119 /nfs/dbraw/zinc/28/61/19/860286119.db2.gz NYCSUMJZQKDVKE-QFIPXVFZSA-N 0 3 418.541 4.137 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1cc(C)n(C(C)(C)C)n1 ZINC000434324475 860286195 /nfs/dbraw/zinc/28/61/95/860286195.db2.gz DLALDMHCMJRQST-FQEVSTJZSA-N 0 3 420.561 4.151 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1cc2c(s1)CCC2 ZINC000434326978 860288285 /nfs/dbraw/zinc/28/82/85/860288285.db2.gz UXJJFEUBXGJMPC-IBGZPJMESA-N 0 3 406.555 4.441 20 0 HIADHN CCOc1ccc(C(=O)Nc2c(C)cnn2[C@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000434336304 860297716 /nfs/dbraw/zinc/29/77/16/860297716.db2.gz ZMHRPIKNGSKJGX-NRFANRHFSA-N 0 3 404.514 4.290 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)CCO[C@@H](C)CC(C)C ZINC000434335097 860298011 /nfs/dbraw/zinc/29/80/11/860298011.db2.gz UEZHYVCBNVJBPM-UNMCSNQZSA-N 0 3 412.578 4.418 20 0 HIADHN O=C([C@H]1CCCN(Cc2cccc(F)c2)C1)N1CCC(OCC2CCCC2)CC1 ZINC000434369790 860316485 /nfs/dbraw/zinc/31/64/85/860316485.db2.gz MLBJVUIFLKSTEO-NRFANRHFSA-N 0 3 402.554 4.236 20 0 HIADHN C[C@H]1CCN(C(=O)c2ccccc2NCc2cccnc2)CCN1Cc1ccccc1 ZINC000434395323 860331458 /nfs/dbraw/zinc/33/14/58/860331458.db2.gz HAKFORRCTQPEIN-NRFANRHFSA-N 0 3 414.553 4.430 20 0 HIADHN COc1cccc(CCC(=O)Nc2c(C)cnn2[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000434413549 860339995 /nfs/dbraw/zinc/33/99/95/860339995.db2.gz UOWJKRRPHPGANM-QFIPXVFZSA-N 0 3 418.541 4.218 20 0 HIADHN Cc1nn(C(C)(C)C)c2nc(C3CC3)cc(C(=O)NC[C@@H]3CCCCN3C3CC3)c12 ZINC000434443810 860354595 /nfs/dbraw/zinc/35/45/95/860354595.db2.gz DCYPBXFXXHPYPS-SFHVURJKSA-N 0 3 409.578 4.119 20 0 HIADHN Cc1cc2sc(NC(=O)N3CCC(CN4C[C@@H](C)O[C@@H](C)C4)CC3)nc2cc1F ZINC000434527630 860387421 /nfs/dbraw/zinc/38/74/21/860387421.db2.gz XVGOMVDSFMPIDX-GASCZTMLSA-N 0 3 420.554 4.097 20 0 HIADHN COc1ccc(Br)cc1CN1CCC(c2ncc3n2CCCC3)CC1 ZINC000434682390 860458242 /nfs/dbraw/zinc/45/82/42/860458242.db2.gz BYTFHMYYTAUOAP-UHFFFAOYSA-N 0 3 404.352 4.370 20 0 HIADHN Brc1ccc2[nH]c(CN3CCC(c4ncc5n4CCCC5)CC3)nc2c1 ZINC000434685196 860459281 /nfs/dbraw/zinc/45/92/81/860459281.db2.gz OUPDKBBPRFBCJX-UHFFFAOYSA-N 0 3 414.351 4.238 20 0 HIADHN Brc1ccc2nc(CN3CCC(c4ncc5n4CCCC5)CC3)[nH]c2c1 ZINC000434685196 860459292 /nfs/dbraw/zinc/45/92/92/860459292.db2.gz OUPDKBBPRFBCJX-UHFFFAOYSA-N 0 3 414.351 4.238 20 0 HIADHN C[C@@H](NC(=O)[C@@H](C)N1CCC(c2ncc3n2CCCC3)CC1)c1cc2ccccc2o1 ZINC000434685070 860459751 /nfs/dbraw/zinc/45/97/51/860459751.db2.gz MGCYMKRDZUKIEF-QZTJIDSGSA-N 0 3 420.557 4.411 20 0 HIADHN O=C(CCN1CCC(C(=O)c2ccc(F)cc2)CC1)N[C@H]1CCCc2ccccc21 ZINC000434687663 860461816 /nfs/dbraw/zinc/46/18/16/860461816.db2.gz YMAGCISSGUVNHD-QHCPKHFHSA-N 0 3 408.517 4.304 20 0 HIADHN CC(C)N(Cc1ccccc1)C(=O)[C@H](C)N1CCC(c2ncc3n2CCCC3)CC1 ZINC000434689429 860462951 /nfs/dbraw/zinc/46/29/51/860462951.db2.gz WESKRJSOQVQIPH-FQEVSTJZSA-N 0 3 408.590 4.225 20 0 HIADHN CCOc1ccccc1[C@H](CC)NC(=O)CN1CCC(c2ncc3n2CCCC3)CC1 ZINC000434690412 860463065 /nfs/dbraw/zinc/46/30/65/860463065.db2.gz GYKFJARQYMFROD-QFIPXVFZSA-N 0 3 424.589 4.065 20 0 HIADHN C[C@@H](C(=O)Nc1ccc(OC(F)F)cc1)N1CCC(c2ncc3n2CCCC3)CC1 ZINC000434692422 860464179 /nfs/dbraw/zinc/46/41/79/860464179.db2.gz XSRQEPTYXNKWFR-HNNXBMFYSA-N 0 3 418.488 4.027 20 0 HIADHN Cc1c(F)cccc1NC(=O)CCN(C)[C@@H]1c2cc(Cl)cc(Cl)c2C[C@@H]1O ZINC000434782244 860493837 /nfs/dbraw/zinc/49/38/37/860493837.db2.gz HXYYVPBPOKLSOD-AZUAARDMSA-N 0 3 411.304 4.360 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)Cc2csc(-c3ccccc3Cl)n2)C[C@H](C)O1 ZINC000434786432 860494587 /nfs/dbraw/zinc/49/45/87/860494587.db2.gz ONNNVBLHLFGUTD-IYBDPMFKSA-N 0 3 421.994 4.012 20 0 HIADHN COc1cc(CCC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)ccc1Cl ZINC000434848949 860521668 /nfs/dbraw/zinc/52/16/68/860521668.db2.gz OVIWHPUICUUPGR-GOSISDBHSA-N 0 3 400.950 4.404 20 0 HIADHN NC(=O)c1ccc(NC(=O)CCN2CC=C(c3ccc(Cl)cc3)CC2)cc1Cl ZINC000434901472 860545702 /nfs/dbraw/zinc/54/57/02/860545702.db2.gz WDUUWINWLGGSQU-UHFFFAOYSA-N 0 3 418.324 4.210 20 0 HIADHN Cc1cc(NC(=O)c2cc3c(s2)CCC3)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435267030 860708809 /nfs/dbraw/zinc/70/88/09/860708809.db2.gz LERWNAMTOAMERH-LJQANCHMSA-N 0 3 406.555 4.441 20 0 HIADHN COCc1ccccc1C(=O)Nc1cc(C)nn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435269671 860709725 /nfs/dbraw/zinc/70/97/25/860709725.db2.gz IWWAYLXOJVAYMK-OAQYLSRUSA-N 0 3 404.514 4.037 20 0 HIADHN Cc1cc(NC(=O)c2cc(C)n(C(C)(C)C)n2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435272610 860711638 /nfs/dbraw/zinc/71/16/38/860711638.db2.gz SEQCLFUXXVGCNP-FQEVSTJZSA-N 0 3 420.561 4.151 20 0 HIADHN Cc1cc(NC(=O)[C@@H](C)OCc2ccccc2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435273236 860711753 /nfs/dbraw/zinc/71/17/53/860711753.db2.gz XUDYOCOTJKEASB-NFBKMPQASA-N 0 3 418.541 4.182 20 0 HIADHN Cc1cc(NC(=O)c2cccc3cccnc32)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435279029 860715510 /nfs/dbraw/zinc/71/55/10/860715510.db2.gz ILZQTOQGFRVVGP-OAQYLSRUSA-N 0 3 411.509 4.439 20 0 HIADHN CC[C@H](C(=O)Nc1cc(C)nn1[C@H]1CCN(Cc2ccccc2)C1)c1c(C)noc1C ZINC000435286389 860719126 /nfs/dbraw/zinc/71/91/26/860719126.db2.gz CXJYABMHKHAPIB-SFTDATJTSA-N 0 3 421.545 4.376 20 0 HIADHN CC(=O)c1ccc(CC(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000435284970 860719340 /nfs/dbraw/zinc/71/93/40/860719340.db2.gz MMBKRBJXARRNGB-QHCPKHFHSA-N 0 3 416.525 4.022 20 0 HIADHN Cc1cc(NC(=O)C2(c3ccccc3)CC2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435294031 860722967 /nfs/dbraw/zinc/72/29/67/860722967.db2.gz FPSOQSFUAJKPFD-JOCHJYFZSA-N 0 3 400.526 4.309 20 0 HIADHN Cc1cc(NC(=O)c2ccn(C3CCCC3)n2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435295996 860725147 /nfs/dbraw/zinc/72/51/47/860725147.db2.gz QSMXSNPCUGARBR-OAQYLSRUSA-N 0 3 418.545 4.202 20 0 HIADHN CCCc1nc(C)c(C(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)s1 ZINC000435369842 860767241 /nfs/dbraw/zinc/76/72/41/860767241.db2.gz NAIHKUWLJPHNNS-GOSISDBHSA-N 0 3 409.559 4.300 20 0 HIADHN CC(C)(C)c1nc(CC(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)cs1 ZINC000435371982 860769239 /nfs/dbraw/zinc/76/92/39/860769239.db2.gz PQRFVHDJSCNFPG-IBGZPJMESA-N 0 3 423.586 4.265 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)c1cccc(-n2cccc2)c1 ZINC000435373154 860770204 /nfs/dbraw/zinc/77/02/04/860770204.db2.gz MHENPGVRXKGZEI-HSZRJFAPSA-N 0 3 411.509 4.373 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)[C@@H]1C[C@H]1c1c(F)cccc1F ZINC000435372511 860770856 /nfs/dbraw/zinc/77/08/56/860770856.db2.gz JVEXNPUHAMQDKV-GUDVDZBRSA-N 0 3 422.479 4.351 20 0 HIADHN Cc1ccccc1OCCCC(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435373514 860771540 /nfs/dbraw/zinc/77/15/40/860771540.db2.gz VAPDCKFCEZNOEI-JOCHJYFZSA-N 0 3 418.541 4.436 20 0 HIADHN O=C(Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)[C@@H]1CCCc2ccccc21 ZINC000435373839 860771739 /nfs/dbraw/zinc/77/17/39/860771739.db2.gz GDRFYMGMPJDENK-JTHBVZDNSA-N 0 3 400.526 4.389 20 0 HIADHN CC(C)(C)c1ncc(C(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)s1 ZINC000435373696 860772139 /nfs/dbraw/zinc/77/21/39/860772139.db2.gz OCJIUIMZPCLBNX-QGZVFWFLSA-N 0 3 409.559 4.336 20 0 HIADHN Cc1cc(Cl)ccc1OCC(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435377055 860773727 /nfs/dbraw/zinc/77/37/27/860773727.db2.gz XOUJEPRLIBUNKG-HXUWFJFHSA-N 0 3 424.932 4.309 20 0 HIADHN COc1ccc(SCC(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000435375723 860773858 /nfs/dbraw/zinc/77/38/58/860773858.db2.gz OBPXNMZQYWFVFU-IBGZPJMESA-N 0 3 422.554 4.070 20 0 HIADHN CC[C@@H](Oc1cccc(C)c1)C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435382033 860777779 /nfs/dbraw/zinc/77/77/79/860777779.db2.gz XETOEGXKUIXIOH-FYYLOGMGSA-N 0 3 418.541 4.435 20 0 HIADHN CC[C@H](OC1CCCCC1)C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435381726 860777857 /nfs/dbraw/zinc/77/78/57/860777857.db2.gz XPINQQMVKIARGZ-IRLDBZIGSA-N 0 3 410.562 4.397 20 0 HIADHN Cc1cc(NC(=O)N[C@@H](C)c2ccc(C)o2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435511425 860828932 /nfs/dbraw/zinc/82/89/32/860828932.db2.gz NMNDPYLMQZBGHM-AZUAARDMSA-N 0 3 407.518 4.423 20 0 HIADHN Cc1cc(NC(=O)N(C)Cc2ccoc2C)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435513245 860831270 /nfs/dbraw/zinc/83/12/70/860831270.db2.gz CNJVGNGJACATGK-OAQYLSRUSA-N 0 3 407.518 4.204 20 0 HIADHN CC[C@H](NC(=O)Nc1cc(C)nn1[C@@H]1CCN(Cc2ccccc2)C1)c1nccs1 ZINC000435520896 860838629 /nfs/dbraw/zinc/83/86/29/860838629.db2.gz FFDHICDQZBUWTP-MOPGFXCFSA-N 0 3 424.574 4.368 20 0 HIADHN CSCC[C@H](C)N(C)C(=O)Nc1cc(C)nn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435527799 860843972 /nfs/dbraw/zinc/84/39/72/860843972.db2.gz NOBAGJXEPQQBCG-AZUAARDMSA-N 0 3 415.607 4.244 20 0 HIADHN Cc1cc(NC(=O)NCc2ccccc2C)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435531300 860846842 /nfs/dbraw/zinc/84/68/42/860846842.db2.gz ADWLLYQDIWOCQK-JOCHJYFZSA-N 0 3 403.530 4.269 20 0 HIADHN Cc1cc(NC(=O)NCc2ccccc2C)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435531301 860847109 /nfs/dbraw/zinc/84/71/09/860847109.db2.gz ADWLLYQDIWOCQK-QFIPXVFZSA-N 0 3 403.530 4.269 20 0 HIADHN CCN(Cc1ccncc1)C(=O)Nc1cc(C)nn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435536650 860850751 /nfs/dbraw/zinc/85/07/51/860850751.db2.gz UWFKTMYWMCSUBD-JOCHJYFZSA-N 0 3 418.545 4.088 20 0 HIADHN Cc1c(NC(=O)N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)cnn1-c1ccccc1F ZINC000435544011 860858454 /nfs/dbraw/zinc/85/84/54/860858454.db2.gz BTTARLKJOWBTOI-VQIMIIECSA-N 0 3 407.493 4.104 20 0 HIADHN Cc1c(NC(=O)NC[C@@H](c2cccs2)N2CCCC2)cnn1-c1ccccc1F ZINC000435545109 860860109 /nfs/dbraw/zinc/86/01/09/860860109.db2.gz UQLWEJVTRHLANV-IBGZPJMESA-N 0 3 413.522 4.340 20 0 HIADHN Cc1c(NC(=O)NCC(C)(C)N2CCc3ccccc3C2)cnn1-c1ccccc1F ZINC000435545488 860860166 /nfs/dbraw/zinc/86/01/66/860860166.db2.gz WPVGUCUKLASQTJ-UHFFFAOYSA-N 0 3 421.520 4.278 20 0 HIADHN CC[C@H](CNC(=O)Nc1cnn(-c2ccccc2)c1C)N1CCc2ccccc2C1 ZINC000435549630 860865749 /nfs/dbraw/zinc/86/57/49/860865749.db2.gz LEKUOXFMKXNHFT-OAQYLSRUSA-N 0 3 403.530 4.139 20 0 HIADHN Cc1c(NC(=O)N[C@H](CN2CCCC2)c2ccccc2)cnn1-c1ccccc1F ZINC000435561883 860882724 /nfs/dbraw/zinc/88/27/24/860882724.db2.gz ZDUAATVQQQMVBX-OAQYLSRUSA-N 0 3 407.493 4.278 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)N2CCC(OCC3CCCC3)CC2)N(C)C)cc1 ZINC000435585607 860897917 /nfs/dbraw/zinc/89/79/17/860897917.db2.gz VHROTCQTVLDMDJ-HSZRJFAPSA-N 0 3 401.595 4.233 20 0 HIADHN CC(C)c1ccc(C(=O)NC2CCN(CCOc3ccc(Cl)cc3)CC2)cn1 ZINC000435589182 860898494 /nfs/dbraw/zinc/89/84/94/860898494.db2.gz QSBSBFBGHZFFCN-UHFFFAOYSA-N 0 3 401.938 4.132 20 0 HIADHN Cc1cc(CN[C@@H](C)c2cc(F)ccc2N2CCN(C)CC2)ccc1Br ZINC000467777408 881598039 /nfs/dbraw/zinc/59/80/39/881598039.db2.gz WGGYBILFTDADCS-INIZCTEOSA-N 0 3 420.370 4.499 20 0 HIADHN CN(c1ccccc1)c1ccc(CNc2ccccc2CN2CCC(O)CC2)cn1 ZINC000435786867 861059508 /nfs/dbraw/zinc/05/95/08/861059508.db2.gz WQZFDZOYBWDYGW-UHFFFAOYSA-N 0 3 402.542 4.418 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)c1c[nH]nc1-c1cc2ccccc2o1 ZINC000435813651 861079150 /nfs/dbraw/zinc/07/91/50/861079150.db2.gz LEGWXRSNJIPDND-KRWDZBQOSA-N 0 3 406.511 4.451 20 0 HIADHN Cc1cccc2nc(C3CCN(C(=O)NC[C@H](Cc4ccccc4)N(C)C)CC3)oc21 ZINC000435843813 861105381 /nfs/dbraw/zinc/10/53/81/861105381.db2.gz GUDJSRHMHZMPTK-NRFANRHFSA-N 0 3 420.557 4.198 20 0 HIADHN Cc1ccc([C@@H](NCCCc2ccccc2Br)[C@H](C)S(C)(=O)=O)cc1 ZINC000435895198 861151235 /nfs/dbraw/zinc/15/12/35/861151235.db2.gz XMUCYQKLXLCZHE-JXFKEZNVSA-N 0 3 424.404 4.454 20 0 HIADHN Cc1cc(-c2cc(C(=O)N[C@H]3CN(C4CC4)C[C@@H]3C)c3c(C)noc3n2)c(C)s1 ZINC000467806597 881630555 /nfs/dbraw/zinc/63/05/55/881630555.db2.gz SGEUXQUBCWEBTE-WLRWDXFRSA-N 0 3 410.543 4.089 20 0 HIADHN C[C@H]1CN(C2CC2)C[C@H]1NC(=O)c1ccccc1CSc1nc2ccccc2[nH]1 ZINC000467806994 881631090 /nfs/dbraw/zinc/63/10/90/881631090.db2.gz VNWPCVWLSZUJKZ-YCRPNKLZSA-N 0 3 406.555 4.068 20 0 HIADHN COc1cccc(Oc2ccc(NC(=O)N(CCN(C)C)C[C@H]3CCCO3)cc2)c1 ZINC000437898366 863268573 /nfs/dbraw/zinc/26/85/73/863268573.db2.gz PRBAORPFZCJWFR-JOCHJYFZSA-N 0 3 413.518 4.062 20 0 HIADHN Cc1cc(C(=O)NC(C)C)ccc1NC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC000437897223 863269327 /nfs/dbraw/zinc/26/93/27/863269327.db2.gz RRVCZGDCCFRBFC-HXUWFJFHSA-N 0 3 422.573 4.262 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NC(C)(C)Cc3ccc(OC)cc3)c(C)c2)CC1 ZINC000437908023 863282349 /nfs/dbraw/zinc/28/23/49/863282349.db2.gz LHKQBOMEGAPNDS-UHFFFAOYSA-N 0 3 424.589 4.288 20 0 HIADHN Cc1ccc(NC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)cc1C(=O)NC(C)C ZINC000438046832 863409398 /nfs/dbraw/zinc/40/93/98/863409398.db2.gz YRDMUUAURNXBQR-HXUWFJFHSA-N 0 3 422.573 4.262 20 0 HIADHN C[C@@H](CN1CCCCC1)NC(=O)c1cc(COc2c(Cl)cccc2Cl)on1 ZINC000467827029 881659978 /nfs/dbraw/zinc/65/99/78/881659978.db2.gz QXYDSJFNPFRBJV-ZDUSSCGKSA-N 0 3 412.317 4.165 20 0 HIADHN COC(=O)c1ccc(COc2ccccc2CN2CC[C@@H](C)[C@H](n3ccnc3)C2)cc1 ZINC000438104850 863516392 /nfs/dbraw/zinc/51/63/92/863516392.db2.gz MVIXOXWTLGMTMK-AUSIDOKSSA-N 0 3 419.525 4.332 20 0 HIADHN O=C(Nc1ccccc1)c1cc(NC(=O)N2CC[C@@H](N3CC=CC3)C2)ccc1Cl ZINC000438173698 863597045 /nfs/dbraw/zinc/59/70/45/863597045.db2.gz FGODOPQFSJAMGN-GOSISDBHSA-N 0 3 410.905 4.070 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N[C@H]1C[C@@H]1c1ccccc1OC(F)F ZINC000438202469 863631375 /nfs/dbraw/zinc/63/13/75/863631375.db2.gz NJYMODCXCVPYME-IXDOHACOSA-N 0 3 421.513 4.342 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N[C@H]1C[C@H](c2cc(F)cc(F)c2)C1 ZINC000438203894 863633110 /nfs/dbraw/zinc/63/31/10/863633110.db2.gz UBVQOTMESCJXOF-ATZDWAIDSA-N 0 3 405.514 4.409 20 0 HIADHN COc1cc(N2CCOC(C)(C)C2)ccc1NC(=O)c1cccc(CN2CCCC2)c1 ZINC000438220684 863653660 /nfs/dbraw/zinc/65/36/60/863653660.db2.gz CSDTZTMYGPOBSM-UHFFFAOYSA-N 0 3 423.557 4.159 20 0 HIADHN CCOC(=O)COc1ccc(CN2CCC(c3nc4cccc(C)c4o3)CC2)cc1 ZINC000438341632 863813663 /nfs/dbraw/zinc/81/36/63/863813663.db2.gz KJPLZIYGTSASQT-UHFFFAOYSA-N 0 3 408.498 4.458 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)N[C@@H]1C[C@H]1c1ccc(Br)cc1 ZINC000438350546 863819336 /nfs/dbraw/zinc/81/93/36/863819336.db2.gz VUHNCYJPOBKJQB-ZWKOTPCHSA-N 0 3 422.392 4.140 20 0 HIADHN COc1ccc(Oc2ccc(NC(=O)NC[C@@H](c3ccccc3)N(C)C)cn2)cc1 ZINC000438402444 863849711 /nfs/dbraw/zinc/84/97/11/863849711.db2.gz ORVYQRWEJSYPLG-NRFANRHFSA-N 0 3 406.486 4.307 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)N[C@H]1C[C@H](c2cc(F)cc(F)c2)C1 ZINC000438432539 863862932 /nfs/dbraw/zinc/86/29/32/863862932.db2.gz QHXPSHRTALAQER-RUCARUNLSA-N 0 3 423.454 4.262 20 0 HIADHN COc1ccc(Oc2ccc(NC(=O)NC[C@H](Cc3ccccc3)N(C)C)cn2)cc1 ZINC000438441223 863868059 /nfs/dbraw/zinc/86/80/59/863868059.db2.gz HCEVERMGCHFRQK-FQEVSTJZSA-N 0 3 420.513 4.177 20 0 HIADHN COC(=O)C(C)(C)c1ccc(NC(=O)N[C@H](CN2CCCC2)c2ccccc2)cc1 ZINC000438461533 863884028 /nfs/dbraw/zinc/88/40/28/863884028.db2.gz OTOXHLAZFUWPBP-OAQYLSRUSA-N 0 3 409.530 4.096 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)c1csc(Cc2ccc(F)cc2)n1 ZINC000438466659 863888450 /nfs/dbraw/zinc/88/84/50/863888450.db2.gz NUIHGCWEULNKFM-UHFFFAOYSA-N 0 3 403.548 4.139 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Cc1csc(-c2cccc(F)c2)n1 ZINC000438473499 863892005 /nfs/dbraw/zinc/89/20/05/863892005.db2.gz DURRSPBVTNUTRX-UHFFFAOYSA-N 0 3 403.548 4.144 20 0 HIADHN C[C@@H](SCC(=O)N(CCN(C)C)Cc1cccs1)c1nc2ccccc2[nH]1 ZINC000438542003 863969875 /nfs/dbraw/zinc/96/98/75/863969875.db2.gz UJBFEGJJDUJCLI-OAHLLOKOSA-N 0 3 402.589 4.009 20 0 HIADHN CCOc1cn(-c2ccccc2)nc1C(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000438551977 863982310 /nfs/dbraw/zinc/98/23/10/863982310.db2.gz GXLAQBJSEDAWGX-UHFFFAOYSA-N 0 3 418.541 4.008 20 0 HIADHN COCCO[C@@H]1CCN(Cc2cn(Cc3ccccc3)nc2-c2cccc(C)c2)C1 ZINC000438555574 863986641 /nfs/dbraw/zinc/98/66/41/863986641.db2.gz SZXWMDFZSIVPTO-XMMPIXPASA-N 0 3 405.542 4.144 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3ccccc3CC(F)(F)F)CC2)C[C@H](C)O1 ZINC000438623549 864049525 /nfs/dbraw/zinc/04/95/25/864049525.db2.gz NAOPTBUHDMYOLA-IYBDPMFKSA-N 0 3 413.484 4.145 20 0 HIADHN NC(=O)c1ccc(NC(=O)CCNC(c2ccccc2)c2ccccc2)cc1Cl ZINC000438626334 864054884 /nfs/dbraw/zinc/05/48/84/864054884.db2.gz OIUXOLFWYLVBPD-UHFFFAOYSA-N 0 3 407.901 4.147 20 0 HIADHN CN(C)CCN(C[C@H]1CCCO1)C(=O)Nc1ccc(Oc2ccc(Cl)cn2)cc1 ZINC000438632667 864062705 /nfs/dbraw/zinc/06/27/05/864062705.db2.gz LTRKDQWFGGQNDA-LJQANCHMSA-N 0 3 418.925 4.102 20 0 HIADHN CCN(C(=O)C(=O)Nc1ccc(Cl)cc1F)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000438663960 864116095 /nfs/dbraw/zinc/11/60/95/864116095.db2.gz XZYQZEDXCHGVQR-MAUKXSAKSA-N 0 3 417.912 4.102 20 0 HIADHN CCN(C(=O)C(=O)Nc1ccc(OC(C)C)cc1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000438668627 864127252 /nfs/dbraw/zinc/12/72/52/864127252.db2.gz YSDPUSKYBOERDW-UGKGYDQZSA-N 0 3 423.557 4.096 20 0 HIADHN CCSc1ccc(Cl)cc1C(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000438671188 864132451 /nfs/dbraw/zinc/13/24/51/864132451.db2.gz FPONHHXCUHJWAJ-UHFFFAOYSA-N 0 3 418.990 4.339 20 0 HIADHN Cc1c(F)cccc1NC(=O)CCN1CCCC[C@@H]1CNC(=O)Nc1ccccc1 ZINC000438698178 864168140 /nfs/dbraw/zinc/16/81/40/864168140.db2.gz ROIFZZJYIIQOQQ-LJQANCHMSA-N 0 3 412.509 4.139 20 0 HIADHN Cc1ccc(NC(=O)C2CC2)cc1NC(=O)N(CCN(C)C)Cc1cccs1 ZINC000438699068 864169471 /nfs/dbraw/zinc/16/94/71/864169471.db2.gz OPDOSZBOFSVGBW-UHFFFAOYSA-N 0 3 400.548 4.001 20 0 HIADHN CCCN(CC)C(=O)c1ccc(C(=O)N(Cc2ccccc2)C2CCN(C)CC2)cc1 ZINC000438714216 864197157 /nfs/dbraw/zinc/19/71/57/864197157.db2.gz LMLODTXAXUKILK-UHFFFAOYSA-N 0 3 421.585 4.295 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)c2ccc(N3CCCCCC3)nc2)CC1 ZINC000438717278 864200375 /nfs/dbraw/zinc/20/03/75/864200375.db2.gz TZSIETPPRRRLSH-UHFFFAOYSA-N 0 3 406.574 4.199 20 0 HIADHN CCC[C@H](N[C@@H](C)c1ccc(OC)c(OC)c1)C(=O)N1CCc2sccc2C1 ZINC000467876336 881738813 /nfs/dbraw/zinc/73/88/13/881738813.db2.gz GGECUXSAXFOQLC-YJBOKZPZSA-N 0 3 402.560 4.170 20 0 HIADHN COc1cc(NC(=O)N(CCN(C)C)Cc2cccs2)ccc1Br ZINC000438774325 864270110 /nfs/dbraw/zinc/27/01/10/864270110.db2.gz RMRPEKMWSGLPOO-UHFFFAOYSA-N 0 3 412.353 4.115 20 0 HIADHN Cc1ccsc1CCCC(=O)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000438828619 864322674 /nfs/dbraw/zinc/32/26/74/864322674.db2.gz XCMFRXRLDXBPJS-UHFFFAOYSA-N 0 3 404.551 4.178 20 0 HIADHN COCCCOc1cccc(NC(=O)N(Cc2ccccc2)C2CCN(C)CC2)c1 ZINC000438878800 864366549 /nfs/dbraw/zinc/36/65/49/864366549.db2.gz YBJMVDMPOJRMNO-UHFFFAOYSA-N 0 3 411.546 4.230 20 0 HIADHN C[C@@H]1CC[C@H](O)[C@@H]([C@H]2CCCCN2CC(=O)Nc2ccc(Br)cc2)C1 ZINC000438993439 864452123 /nfs/dbraw/zinc/45/21/23/864452123.db2.gz KHLGGZFQBOVTPY-AXUOBQJMSA-N 0 3 409.368 4.039 20 0 HIADHN O=C(Nc1ccccc1-c1ncc2n1CCCC2)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000439073662 864525864 /nfs/dbraw/zinc/52/58/64/864525864.db2.gz XVJCRYVXJBQQFP-FQEVSTJZSA-N 0 3 415.541 4.282 20 0 HIADHN CCN(C[C@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)c1ccc(C)cc1Cl ZINC000439223888 864640956 /nfs/dbraw/zinc/64/09/56/864640956.db2.gz NDOVNJTZDFSBNV-IBGZPJMESA-N 0 3 406.979 4.181 20 0 HIADHN CCN(C[C@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)c1ccc(F)cc1Cl ZINC000439229793 864646901 /nfs/dbraw/zinc/64/69/01/864646901.db2.gz OWXBNEPAKILKBI-KRWDZBQOSA-N 0 3 410.942 4.012 20 0 HIADHN C[C@@H](NC(=O)N(CCN(C)C)Cc1cccs1)c1ccc(Br)cc1 ZINC000439262089 864679946 /nfs/dbraw/zinc/67/99/46/864679946.db2.gz XSFKYQNOVQQWTJ-CQSZACIVSA-N 0 3 410.381 4.345 20 0 HIADHN CCc1nc2cc(NC(=O)NC3CC(N4CCC(C(F)(F)F)CC4)C3)ccc2o1 ZINC000467923488 881795915 /nfs/dbraw/zinc/79/59/15/881795915.db2.gz VPXJOSALOLSEQW-UHFFFAOYSA-N 0 3 410.440 4.317 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)Nc1cc(F)ccc1Br ZINC000467927430 881802020 /nfs/dbraw/zinc/80/20/20/881802020.db2.gz QRBYODNFIKHRQK-UHFFFAOYSA-N 0 3 406.299 4.158 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)N[C@@H](c1nccs1)c1ccccc1 ZINC000439375317 864808353 /nfs/dbraw/zinc/80/83/53/864808353.db2.gz STZVAVNEJZCJAH-GOSISDBHSA-N 0 3 400.573 4.067 20 0 HIADHN COc1ccccc1O[C@@H](C)CNCc1cc(Cl)ccc1OC[C@@H]1CCCO1 ZINC000439467666 864842661 /nfs/dbraw/zinc/84/26/61/864842661.db2.gz JKMNFQHABFYDQC-LPHOPBHVSA-N 0 3 405.922 4.464 20 0 HIADHN C[C@H](C(=O)N(C)Cc1nc2ccccc2s1)N(C)CCCOCc1ccccc1 ZINC000439471094 864843856 /nfs/dbraw/zinc/84/38/56/864843856.db2.gz QSDLXZKBFAHZNM-GOSISDBHSA-N 0 3 411.571 4.182 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)NC[C@H]1CCC[C@H](C(F)(F)F)C1 ZINC000439580787 864903241 /nfs/dbraw/zinc/90/32/41/864903241.db2.gz KBJFZLDOJOKPSV-HOCLYGCPSA-N 0 3 421.454 4.407 20 0 HIADHN Cc1ccccc1CNC(=O)[C@H](C)NCc1ccccc1CN(C)Cc1ccco1 ZINC000439600965 864922838 /nfs/dbraw/zinc/92/28/38/864922838.db2.gz YPEQVTPVZPETQP-FQEVSTJZSA-N 0 3 405.542 4.015 20 0 HIADHN Cc1ccc(CNC(=O)[C@H](C)NCc2ccccc2CN(C)Cc2ccco2)cc1 ZINC000439599341 864924180 /nfs/dbraw/zinc/92/41/80/864924180.db2.gz VNVRCZSZIRKBOO-FQEVSTJZSA-N 0 3 405.542 4.015 20 0 HIADHN C[C@H](NCc1ccccc1CN(C)Cc1ccco1)C(=O)Nc1cc(F)ccc1F ZINC000439611748 864934669 /nfs/dbraw/zinc/93/46/69/864934669.db2.gz PTSWDAQOGVRPFI-INIZCTEOSA-N 0 3 413.468 4.307 20 0 HIADHN COc1cc(C(=O)N(CCN(C)C)C(C)C)ccc1OCc1ccc(Cl)cc1 ZINC000439612083 864934769 /nfs/dbraw/zinc/93/47/69/864934769.db2.gz HXRUUUZNGRLGCY-UHFFFAOYSA-N 0 3 404.938 4.340 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)NC[C@H]1CCC[C@H](C(F)(F)F)C1 ZINC000439623764 864947514 /nfs/dbraw/zinc/94/75/14/864947514.db2.gz KPGRHWAABDVSKP-RDJZCZTQSA-N 0 3 403.464 4.268 20 0 HIADHN Cc1ccc(C(=O)NCC2CC2)cc1NC(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000439683111 865018781 /nfs/dbraw/zinc/01/87/81/865018781.db2.gz GCPQKEJHDYOGRZ-AVRDEDQJSA-N 0 3 420.557 4.092 20 0 HIADHN CC[C@](C)(O)CN(Cc1ccccc1)C(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000439702995 865039660 /nfs/dbraw/zinc/03/96/60/865039660.db2.gz BOUOXSZVBADXRD-OPHFCASCSA-N 0 3 409.574 4.195 20 0 HIADHN CC[C@](C)(O)CN(Cc1ccccc1)C(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000439703001 865039962 /nfs/dbraw/zinc/03/99/62/865039962.db2.gz BOUOXSZVBADXRD-ZWSUVBHBSA-N 0 3 409.574 4.195 20 0 HIADHN Cc1cc(Cl)ccc1O[C@H](C)C(=O)NC1CCN([C@H](C)c2ccncc2)CC1 ZINC000439732266 865064358 /nfs/dbraw/zinc/06/43/58/865064358.db2.gz LRACXMSXVMHGSM-IAGOWNOFSA-N 0 3 401.938 4.153 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)CCc2ccccc2Br)CC1 ZINC000439731957 865064661 /nfs/dbraw/zinc/06/46/61/865064661.db2.gz OXIUUVGUZSFWMW-INIZCTEOSA-N 0 3 416.363 4.119 20 0 HIADHN CC[C@H](Oc1ccccc1Cl)C(=O)NC1CCN([C@@H](C)c2ccncc2)CC1 ZINC000439737899 865068528 /nfs/dbraw/zinc/06/85/28/865068528.db2.gz ZAXJAUBSMZNTDE-JXFKEZNVSA-N 0 3 401.938 4.234 20 0 HIADHN CC[C@@H](Oc1ccccc1Cl)C(=O)NC1CCN([C@H](C)c2ccncc2)CC1 ZINC000439737902 865071550 /nfs/dbraw/zinc/07/15/50/865071550.db2.gz ZAXJAUBSMZNTDE-OXQOHEQNSA-N 0 3 401.938 4.234 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)CCOc2ccc(Cl)cc2Cl)CC1 ZINC000439740383 865072193 /nfs/dbraw/zinc/07/21/93/865072193.db2.gz CFZKFCIQGMFFBC-HNNXBMFYSA-N 0 3 422.356 4.499 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)[C@H]2C[C@@H]2c2c(F)cccc2Cl)CC1 ZINC000439749391 865079267 /nfs/dbraw/zinc/07/92/67/865079267.db2.gz YKIHRWQQSOKHIW-JLSDUUJJSA-N 0 3 401.913 4.319 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)CCCOc2ccc3c(c2)CCC3)CC1 ZINC000439764019 865088957 /nfs/dbraw/zinc/08/89/57/865088957.db2.gz XANRJCNXORLJDO-IBGZPJMESA-N 0 3 407.558 4.071 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)CCCOc2ccccc2Cl)CC1 ZINC000439765530 865090893 /nfs/dbraw/zinc/09/08/93/865090893.db2.gz LMSSUWDFESDABD-KRWDZBQOSA-N 0 3 401.938 4.236 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)COc2ccc(Cl)c3cccnc23)CC1 ZINC000439766034 865092655 /nfs/dbraw/zinc/09/26/55/865092655.db2.gz MMBKVOHVSPSXNY-INIZCTEOSA-N 0 3 424.932 4.004 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)CCc2ccc(OC(F)(F)F)cc2)CC1 ZINC000439771235 865095308 /nfs/dbraw/zinc/09/53/08/865095308.db2.gz RWMFJFCXBOIAPF-INIZCTEOSA-N 0 3 421.463 4.255 20 0 HIADHN C[C@@H](C(=O)Nc1ccccc1CN1CCC[C@H](C(N)=O)C1)c1ccc2ccccc2c1 ZINC000439796822 865117436 /nfs/dbraw/zinc/11/74/36/865117436.db2.gz ZFOLWALJMPEVQL-JPYJTQIMSA-N 0 3 415.537 4.279 20 0 HIADHN CCN(C(=O)c1ccc(-c2n[nH]c(C)n2)cc1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000467990300 881837639 /nfs/dbraw/zinc/83/76/39/881837639.db2.gz KJTHMNJUQGNGOI-VGOFRKELSA-N 0 3 403.530 4.078 20 0 HIADHN Cc1ccc(NC(=O)NC[C@@H]2CCCN([C@H](C)C(=O)N3[C@H](C)CCC[C@H]3C)C2)cc1 ZINC000439885181 865197901 /nfs/dbraw/zinc/19/79/01/865197901.db2.gz CCTMAIUIKFLXNX-NCYKPQTJSA-N 0 3 414.594 4.007 20 0 HIADHN Cc1ccc(-c2ccnn2C)cc1NC(=O)N[C@H](CN1CCCC1)c1ccccc1 ZINC000439956150 865249184 /nfs/dbraw/zinc/24/91/84/865249184.db2.gz LGIUNEPQRUGOMR-JOCHJYFZSA-N 0 3 403.530 4.354 20 0 HIADHN O=C(CCN1CCN(c2ccccc2)CC1)Nc1ccc(CCC(F)(F)F)cc1 ZINC000439984569 865288399 /nfs/dbraw/zinc/28/83/99/865288399.db2.gz QSGVOYYOHXUMEH-UHFFFAOYSA-N 0 3 405.464 4.332 20 0 HIADHN COc1ccc([C@H](C)N[C@@H]2CC(=O)N(Cc3ccccc3C(F)(F)F)C2)cc1OC ZINC000468031732 881863800 /nfs/dbraw/zinc/86/38/00/881863800.db2.gz XLDOHJYZJNWVSR-WMLDXEAASA-N 0 3 422.447 4.174 20 0 HIADHN NC(=O)C1CCN(C[C@H](N[C@H]2CCCc3sccc32)c2ccc(Cl)cc2)CC1 ZINC000468038423 881868654 /nfs/dbraw/zinc/86/86/54/881868654.db2.gz NJTYPGRWMSXXTH-PMACEKPBSA-N 0 3 418.006 4.307 20 0 HIADHN CC(C)N(CCN(C)C)C(=O)NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1 ZINC000440200851 865434718 /nfs/dbraw/zinc/43/47/18/865434718.db2.gz MZICFUUDQYQHMZ-UHFFFAOYSA-N 0 3 423.536 4.160 20 0 HIADHN O=C(NCc1cccc(-c2ccccn2)c1)N[C@H](CN1CCCC1)c1ccccc1 ZINC000440207178 865440627 /nfs/dbraw/zinc/44/06/27/865440627.db2.gz OMZAUDPDIBALIU-XMMPIXPASA-N 0 3 400.526 4.385 20 0 HIADHN COc1ccc(OC)c(NC(=O)C[C@@H](C)N[C@@H](C)c2cn(C(C)(C)C)nc2C)c1 ZINC000468042245 881871301 /nfs/dbraw/zinc/87/13/01/881871301.db2.gz KNMIUUDJRYOMBO-CABCVRRESA-N 0 3 402.539 4.032 20 0 HIADHN Cc1cccc(COc2cccc(NC(=O)C(=O)Nc3cccc(CN(C)C)c3)c2)c1 ZINC000440237064 865473909 /nfs/dbraw/zinc/47/39/09/865473909.db2.gz ABZMRZQBVGUTSA-UHFFFAOYSA-N 0 3 417.509 4.213 20 0 HIADHN C[C@H](NC(=O)N(CCN(C)C)C1CCCC1)c1ccc(OCC(F)(F)F)cc1 ZINC000468049831 881875609 /nfs/dbraw/zinc/87/56/09/881875609.db2.gz AOFNKFUIOYLDQX-HNNXBMFYSA-N 0 3 401.473 4.205 20 0 HIADHN C[C@]1(CN[C@@H](c2ccc(F)cc2)c2cccc(S(C)(=O)=O)c2)CCO[C@@H]1C1CC1 ZINC000468050419 881876647 /nfs/dbraw/zinc/87/66/47/881876647.db2.gz YJCBPKFOIIYGJL-YTFSRNRJSA-N 0 3 417.546 4.113 20 0 HIADHN CC(C)n1cnnc1-c1ccccc1NC(=O)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000440312876 865578729 /nfs/dbraw/zinc/57/87/29/865578729.db2.gz PCZRUSYOMGMUFY-QFIPXVFZSA-N 0 3 418.545 4.485 20 0 HIADHN CC(C)n1cnnc1-c1ccccc1NC(=O)NC[C@H](c1ccccc1)N1CCCC1 ZINC000440312873 865580608 /nfs/dbraw/zinc/58/06/08/865580608.db2.gz PCZRUSYOMGMUFY-JOCHJYFZSA-N 0 3 418.545 4.485 20 0 HIADHN O[C@@H](CNCc1cnc(-c2ccncc2)s1)COc1cccc(Cl)c1Cl ZINC000440332400 865612258 /nfs/dbraw/zinc/61/22/58/865612258.db2.gz AFPZWQMAJARFDE-ZDUSSCGKSA-N 0 3 410.326 4.041 20 0 HIADHN CC(=O)c1ccc(C(=O)N(C[C@@H]2CCN(Cc3ccccc3)C2)CC(F)(F)F)s1 ZINC000440436513 865739919 /nfs/dbraw/zinc/73/99/19/865739919.db2.gz VEQZGHPGWGNPQR-QGZVFWFLSA-N 0 3 424.488 4.477 20 0 HIADHN CC(=O)c1csc(C(=O)N(C[C@@H]2CCN(Cc3ccccc3)C2)CC(F)(F)F)c1 ZINC000440446664 865748580 /nfs/dbraw/zinc/74/85/80/865748580.db2.gz BQRFBUQYDWINMU-QGZVFWFLSA-N 0 3 424.488 4.477 20 0 HIADHN CCc1nnc(C2CCN(CC(=O)N3c4ccccc4CCc4ccccc43)CC2)[nH]1 ZINC000440535391 865808113 /nfs/dbraw/zinc/80/81/13/865808113.db2.gz VPAKGMPOMFGTNT-UHFFFAOYSA-N 0 3 415.541 4.010 20 0 HIADHN CCc1nnc(-c2cccc(NC(=O)c3ccc(N4CCN(C(C)C)CC4)cc3)c2)o1 ZINC000440594198 865829027 /nfs/dbraw/zinc/82/90/27/865829027.db2.gz LDDLCKRJHYZGON-UHFFFAOYSA-N 0 3 419.529 4.082 20 0 HIADHN COc1ccccc1COC[C@H](O)CN1CC=C(c2c(C)[nH]c3ccccc32)CC1 ZINC000440609674 865836609 /nfs/dbraw/zinc/83/66/09/865836609.db2.gz FBYDRCYEAQZCDV-OAQYLSRUSA-N 0 3 406.526 4.152 20 0 HIADHN CC(C)n1c2ccccc2nc1[C@H]1CCCN(C[C@@H](O)COc2ccccc2F)C1 ZINC000440655019 865857612 /nfs/dbraw/zinc/85/76/12/865857612.db2.gz OIZBFGDZWNKZKQ-RBUKOAKNSA-N 0 3 411.521 4.376 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)N(Cc1ccsc1)c1cccnc1 ZINC000440725164 865876123 /nfs/dbraw/zinc/87/61/23/865876123.db2.gz AOLXLFNCGMWWGU-UHFFFAOYSA-N 0 3 420.582 4.279 20 0 HIADHN COc1ccc(NC(=O)C2(NCCOC3CCCCCC3)CCCC2)cc1OC ZINC000440909399 866006255 /nfs/dbraw/zinc/00/62/55/866006255.db2.gz NVPARGPAUDMMJJ-UHFFFAOYSA-N 0 3 404.551 4.284 20 0 HIADHN Cc1ccccc1[C@H](OC[C@H](O)CN1CCc2ccccc2[C@H]1CO)c1ccccc1 ZINC000440911058 866008513 /nfs/dbraw/zinc/00/85/13/866008513.db2.gz KRPMBRFJBKNSCC-XSBVVTFOSA-N 0 3 417.549 4.054 20 0 HIADHN CC(C)n1ncc2c1nc(-c1ccccc1)cc2C(=O)N[C@@H]1C[C@H](C)N(C2CC2)C1 ZINC000440916734 866011840 /nfs/dbraw/zinc/01/18/40/866011840.db2.gz YMJULXRHDBCQFU-FUHWJXTLSA-N 0 3 403.530 4.034 20 0 HIADHN Cc1noc(C)c1COc1cc2ccccc2cc1C(=O)N[C@@H]1C[C@@H](C)N(C2CC2)C1 ZINC000440916295 866013055 /nfs/dbraw/zinc/01/30/55/866013055.db2.gz RSZLNUNADYQWQA-FOIQADDNSA-N 0 3 419.525 4.379 20 0 HIADHN Cc1ccc(NC(=O)CSc2ccccc2C(=O)N[C@@H]2C[C@@H](C)N(C3CC3)C2)cc1 ZINC000440921929 866017646 /nfs/dbraw/zinc/01/76/46/866017646.db2.gz FHFKKOJTZFUOKD-IEBWSBKVSA-N 0 3 423.582 4.081 20 0 HIADHN CC(=O)CCc1ccc(OCc2cccc(C(=O)N[C@H]3C[C@@H](C)N(C4CC4)C3)c2)cc1 ZINC000440931901 866028694 /nfs/dbraw/zinc/02/86/94/866028694.db2.gz LRZCDDCTGZGZFJ-JPYJTQIMSA-N 0 3 420.553 4.142 20 0 HIADHN CC(=O)Nc1cccc(C(=O)N[C@@H](CN2CCc3ccccc3C2)C(C)(C)C)c1C ZINC000468116239 881942486 /nfs/dbraw/zinc/94/24/86/881942486.db2.gz WNYAKQPYYZPNEB-QHCPKHFHSA-N 0 3 407.558 4.156 20 0 HIADHN CCN(CC(F)(F)F)C(=O)[C@@H]1CCCN(Cc2cc(-c3ccc(C)cc3)no2)C1 ZINC000441343239 866415649 /nfs/dbraw/zinc/41/56/49/866415649.db2.gz FVOSIYDQROCCPA-QGZVFWFLSA-N 0 3 409.452 4.273 20 0 HIADHN CC(C)(C)N(Cc1cccc(F)c1)C(=O)CN1CC[C@H](COCc2ccccc2)C1 ZINC000441360009 866429818 /nfs/dbraw/zinc/42/98/18/866429818.db2.gz QKGGWEARZVAPDG-QFIPXVFZSA-N 0 3 412.549 4.492 20 0 HIADHN C[S@@](=O)C1(CNCc2cccc(NC(=O)c3ccc(Cl)cc3Cl)c2)CC1 ZINC000441369754 866438042 /nfs/dbraw/zinc/43/80/42/866438042.db2.gz VWJQXZOGIGTWHN-AREMUKBSSA-N 0 3 411.354 4.246 20 0 HIADHN C[C@H](NC(=O)[C@H](C)N1CC[C@@H](COCc2ccccc2)C1)c1ccc(Cl)cc1 ZINC000441371324 866439911 /nfs/dbraw/zinc/43/99/11/866439911.db2.gz TUDRNLNBGSUYLN-CMKODMSKSA-N 0 3 400.950 4.444 20 0 HIADHN C[C@H]1C[C@H](NC(=O)N(C)CCCCCc2cc(-c3ccccc3)no2)CN1C1CC1 ZINC000441394338 866466334 /nfs/dbraw/zinc/46/63/34/866466334.db2.gz OJMYVRPRBQAWQX-ICSRJNTNSA-N 0 3 410.562 4.321 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N(C)[C@H](C)[C@@H](C)c1ccc(Cl)cc1 ZINC000441399990 866473993 /nfs/dbraw/zinc/47/39/93/866473993.db2.gz FVWIDHAVCUYNLQ-IAGOWNOFSA-N 0 3 415.965 4.299 20 0 HIADHN CC[C@@H](Cc1ccccc1)N(C)Cc1nnc(-c2cc(OC)c(OC)c(OC)c2)o1 ZINC000441434690 866511899 /nfs/dbraw/zinc/51/18/99/866511899.db2.gz KNUUZFUKJWSCIH-SFHVURJKSA-N 0 3 411.502 4.216 20 0 HIADHN C[C@H](CCC(=O)Nc1ccc(C(=O)N(C)[C@H]2CCCN(C)C2)cc1)c1ccccc1 ZINC000441461530 866538452 /nfs/dbraw/zinc/53/84/52/866538452.db2.gz GUWAVHSSIDJJPD-XXBNENTESA-N 0 3 407.558 4.375 20 0 HIADHN CC[C@@H](CNC(=O)N(Cc1ccco1)C1CCN(C)CC1)Oc1cccc(Cl)c1 ZINC000441493319 866576312 /nfs/dbraw/zinc/57/63/12/866576312.db2.gz SHOMETFAILQOKO-IBGZPJMESA-N 0 3 419.953 4.396 20 0 HIADHN COc1ccc([C@H]2CCN([C@@H]3CCCN(c4ccc(OC(F)F)cc4)C3=O)C2)cc1 ZINC000441529757 866606087 /nfs/dbraw/zinc/60/60/87/866606087.db2.gz AYWZBUZSFLNYSI-LAUBAEHRSA-N 0 3 416.468 4.282 20 0 HIADHN COC(=O)c1ccc(OCCN(C)Cc2ccc(SC)c(OC)c2)c(Cl)c1 ZINC000441532565 866610054 /nfs/dbraw/zinc/61/00/54/866610054.db2.gz FTHFWSNKCNHRBZ-UHFFFAOYSA-N 0 3 409.935 4.368 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCC(C)(C)c3cccc(OC)c3)c(C)c2)CC1 ZINC000441613425 866711780 /nfs/dbraw/zinc/71/17/80/866711780.db2.gz NBILJNDGXULNRG-UHFFFAOYSA-N 0 3 424.589 4.245 20 0 HIADHN CCC(C)(C)[C@@H]1CCCN1CC(=O)N(C)CC(=O)Nc1ccccc1C(F)(F)F ZINC000441648581 866761744 /nfs/dbraw/zinc/76/17/44/866761744.db2.gz PTHFPKOWISOXLA-KRWDZBQOSA-N 0 3 413.484 4.003 20 0 HIADHN C[C@H](NC(=O)C(=O)Nc1ccc2c(c1)Cc1ccccc1-2)[C@@H](c1ccccc1)N(C)C ZINC000441705075 866813313 /nfs/dbraw/zinc/81/33/13/866813313.db2.gz RGBHGQVCILXVSR-XDHUDOTRSA-N 0 3 413.521 4.004 20 0 HIADHN CC(C)Sc1c(Cl)cccc1NC(=O)C(=O)NC[C@H](C)N1CCC[C@H](C)C1 ZINC000441777040 866851330 /nfs/dbraw/zinc/85/13/30/866851330.db2.gz OZEJOSTWWIUBKR-GJZGRUSLSA-N 0 3 411.999 4.016 20 0 HIADHN Cc1ccc(Cc2cnc(NC(=O)N(CCN(C)C)Cc3ccccn3)s2)cc1C ZINC000441866484 866933995 /nfs/dbraw/zinc/93/39/95/866933995.db2.gz DVDQZYBYSIYTJR-UHFFFAOYSA-N 0 3 423.586 4.341 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)Nc1nc2c(s1)C[C@H](C(C)(C)C)CC2 ZINC000442074064 867104687 /nfs/dbraw/zinc/10/46/87/867104687.db2.gz BLPADXUXIGQEIM-MRXNPFEDSA-N 0 3 415.607 4.285 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3cc(Cl)cc(F)c3F)CC2)C[C@@H](C)O1 ZINC000442206761 867229864 /nfs/dbraw/zinc/22/98/64/867229864.db2.gz HOYKUJLSONBVGJ-ZIAGYGMSSA-N 0 3 415.912 4.361 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N[C@H]1c2ccccc2CC[C@@H]1C(C)C ZINC000442549358 867525068 /nfs/dbraw/zinc/52/50/68/867525068.db2.gz YMIIGJYTSPYPON-NFBKMPQASA-N 0 3 407.558 4.071 20 0 HIADHN Cc1nc(-c2ccc(C(=O)Nc3cccc(CN4CCC(O)CC4)c3)cc2)cs1 ZINC000442687989 867623177 /nfs/dbraw/zinc/62/31/77/867623177.db2.gz NZCGZUGFEVHISH-UHFFFAOYSA-N 0 3 407.539 4.328 20 0 HIADHN COCc1nc(C(=O)N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)c(-c2ccccc2)s1 ZINC000442694448 867628792 /nfs/dbraw/zinc/62/87/92/867628792.db2.gz SDIJGGGBMJCANA-PXNSSMCTSA-N 0 3 421.566 4.349 20 0 HIADHN COc1ccccc1[C@@H](CNC(=O)c1cc(Cl)c([O-])c(OC)c1)[NH+]1CCCCC1 ZINC000442718582 867646998 /nfs/dbraw/zinc/64/69/98/867646998.db2.gz HMIGYVFNARRVFK-GOSISDBHSA-N 0 3 418.921 4.020 20 0 HIADHN CC(C)(O)CN1CCc2c(cccc2NC(=O)c2ccncc2Oc2ccccc2)C1 ZINC000442887404 867720907 /nfs/dbraw/zinc/72/09/07/867720907.db2.gz WKJRAPQTUPRIPA-UHFFFAOYSA-N 0 3 417.509 4.255 20 0 HIADHN O=C(NCCc1ccc2[nH]ccc2c1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000442989272 867780606 /nfs/dbraw/zinc/78/06/06/867780606.db2.gz HZZJCJLQVLMNNO-JOCHJYFZSA-N 0 3 415.459 4.281 20 0 HIADHN CCOc1cc(CN2CC[C@@H](OC)C[C@H]2C)ccc1OCC(=O)Nc1ccccc1 ZINC000443063309 867806478 /nfs/dbraw/zinc/80/64/78/867806478.db2.gz AFDJILFTEXPZLX-WIYYLYMNSA-N 0 3 412.530 4.102 20 0 HIADHN CCOc1cc(CN2CC[C@@H](OC)C[C@@H]2C)ccc1OCc1ccc(C(=O)OC)o1 ZINC000443065677 867808536 /nfs/dbraw/zinc/80/85/36/867808536.db2.gz IGAZMOSQCBVQQU-FUHWJXTLSA-N 0 3 417.502 4.043 20 0 HIADHN COc1cc(-c2noc([C@H](C)N3[C@H](C)CC[C@H]3C)n2)ccc1OC[C@@H]1CCCO1 ZINC000443194209 867869837 /nfs/dbraw/zinc/86/98/37/867869837.db2.gz IDXTUKLXHJSZRN-CBZIJGRNSA-N 0 3 401.507 4.237 20 0 HIADHN C[C@H](c1nc(-c2cc(C(F)(F)F)ccc2-n2cncn2)no1)N1[C@H](C)CC[C@H]1C ZINC000443213678 867878490 /nfs/dbraw/zinc/87/84/90/867878490.db2.gz RQGCQONUKSIZRZ-JHJVBQTASA-N 0 3 406.412 4.270 20 0 HIADHN Cc1nc(CC(C)C)sc1C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000443334204 867907935 /nfs/dbraw/zinc/90/79/35/867907935.db2.gz RVJWPBIDVPERLB-UHFFFAOYSA-N 0 3 419.566 4.062 20 0 HIADHN C[C@@]1(C(=O)NC2CCN(CCOc3ccc(F)cc3)CC2)CCCc2ccccc21 ZINC000443339553 867912555 /nfs/dbraw/zinc/91/25/55/867912555.db2.gz CYVXHYNNDPYZBI-RUZDIDTESA-N 0 3 410.533 4.079 20 0 HIADHN Cc1nc(-c2ccccc2)oc1C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000443348346 867917826 /nfs/dbraw/zinc/91/78/26/867917826.db2.gz UESOXERYHVBPNO-UHFFFAOYSA-N 0 3 423.488 4.062 20 0 HIADHN CC[C@]1(C)Oc2ccc(NC(=O)N(CCN(C)C)Cc3ccc(F)c(F)c3)cc2O1 ZINC000443375498 867937750 /nfs/dbraw/zinc/93/77/50/867937750.db2.gz SQTFJDVVOIALHD-JOCHJYFZSA-N 0 3 419.472 4.458 20 0 HIADHN CO[C@H](C)c1noc(CN2CCCN([C@@H](C)c3ccc(C(F)(F)F)cc3)CC2)n1 ZINC000468239358 882136150 /nfs/dbraw/zinc/13/61/50/882136150.db2.gz FOIAFAHREHPNJK-LSDHHAIUSA-N 0 3 412.456 4.065 20 0 HIADHN COc1ccc(CN(C)C[C@@H](O)Cc2ccccc2C(F)(F)F)cc1OC(F)F ZINC000443453687 868042485 /nfs/dbraw/zinc/04/24/85/868042485.db2.gz IOGKFFIXPJTJPX-HNNXBMFYSA-N 0 3 419.390 4.351 20 0 HIADHN CN(C)[C@@H](CNC(=O)Nc1cc(F)cc(F)c1Br)Cc1ccccc1 ZINC000443527910 868085846 /nfs/dbraw/zinc/08/58/46/868085846.db2.gz COFICBVMQNSXET-CQSZACIVSA-N 0 3 412.278 4.022 20 0 HIADHN Clc1ccc(-c2nc3sccn3c2CN2CCC[C@H](Cn3ccnn3)C2)cc1 ZINC000443599319 868156077 /nfs/dbraw/zinc/15/60/77/868156077.db2.gz BLMMBAGBZVTHOK-HNNXBMFYSA-N 0 3 412.950 4.220 20 0 HIADHN Clc1ccc(-c2nc3sccn3c2CN2CCC[C@@H](Cn3ccnn3)C2)cc1 ZINC000443599321 868156137 /nfs/dbraw/zinc/15/61/37/868156137.db2.gz BLMMBAGBZVTHOK-OAHLLOKOSA-N 0 3 412.950 4.220 20 0 HIADHN CCN1CCN(C(=O)CC2CCN([C@@H]3CCc4c3cc(Cl)cc4Cl)CC2)CC1 ZINC000443610775 868175969 /nfs/dbraw/zinc/17/59/69/868175969.db2.gz QGVOKJNKPVLNHE-OAQYLSRUSA-N 0 3 424.416 4.247 20 0 HIADHN CCCCNC(=O)C1CCN(Cc2cc(C)nc(-c3ccc(Cl)cc3)n2)CC1 ZINC000443628533 868203200 /nfs/dbraw/zinc/20/32/00/868203200.db2.gz ZJGMLVDJNNTGKG-UHFFFAOYSA-N 0 3 400.954 4.234 20 0 HIADHN CC(C)COc1ccc(C(C)(C)C(=O)NCCCCN2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000443648808 868241914 /nfs/dbraw/zinc/24/19/14/868241914.db2.gz FOMWTBSOSCQJMJ-BGYRXZFFSA-N 0 3 404.595 4.005 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccc(F)c2)C1)N1CC(Cc2ccc(F)c(F)c2)C1 ZINC000443666011 868271697 /nfs/dbraw/zinc/27/16/97/868271697.db2.gz JYTRHIYIMLXLCR-LJQANCHMSA-N 0 3 402.460 4.017 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)CCOc2ccccc2-c2ccccc2)C[C@@H](C)O1 ZINC000443670772 868276969 /nfs/dbraw/zinc/27/69/69/868276969.db2.gz ALPQFHIUOPJXND-NHCUHLMSSA-N 0 3 410.558 4.128 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)C2(c3ccc(Cl)c(Cl)c3)CCC2)C[C@@H](C)O1 ZINC000443673857 868280030 /nfs/dbraw/zinc/28/00/30/868280030.db2.gz KUWXBJOYDDKUPE-HZPDHXFCSA-N 0 3 413.389 4.421 20 0 HIADHN Cc1nc(-c2ccc(C)cc2C)sc1C(=O)NCCCCN1C[C@@H](C)O[C@@H](C)C1 ZINC000443674686 868280959 /nfs/dbraw/zinc/28/09/59/868280959.db2.gz NAAUDSDBQTZNFT-HDICACEKSA-N 0 3 415.603 4.355 20 0 HIADHN Cc1ccccc1[C@@H]([C@@H](C)NC(=O)C(=O)Nc1cc(Cl)ccc1Cl)N(C)C ZINC000443836751 868367782 /nfs/dbraw/zinc/36/77/82/868367782.db2.gz HMZPXANDWUPSLY-FZKQIMNGSA-N 0 3 408.329 4.048 20 0 HIADHN Cc1ccccc1[C@H]([C@H](C)NC(=O)C(=O)Nc1cccc(OC2CCCC2)c1)N(C)C ZINC000443841230 868373034 /nfs/dbraw/zinc/37/30/34/868373034.db2.gz ZIAGSRGKYUFJQR-MBSDFSHPSA-N 0 3 423.557 4.063 20 0 HIADHN CN1CCN(c2ncccc2CNCc2ccc(Oc3cccc(F)c3)cc2)CC1 ZINC000443973126 868502190 /nfs/dbraw/zinc/50/21/90/868502190.db2.gz OBKTVOMLZCQTLP-UHFFFAOYSA-N 0 3 406.505 4.055 20 0 HIADHN COc1ccc(CN[C@H]2CCN(c3ncccc3Cl)C2)c(OCc2cccnc2)c1 ZINC000444000510 868519946 /nfs/dbraw/zinc/51/99/46/868519946.db2.gz GVMWIRJGWVMLEF-IBGZPJMESA-N 0 3 424.932 4.086 20 0 HIADHN Cc1cc(C(=O)N2CCCC[C@@H]2C)ccc1NC(=O)N(CCN(C)C)CC(C)C ZINC000444028814 868560011 /nfs/dbraw/zinc/56/00/11/868560011.db2.gz AIYYECYLYHALMY-IBGZPJMESA-N 0 3 402.583 4.061 20 0 HIADHN COc1cc(CN(C)CCC(=O)Nc2cc(F)cc(F)c2)c(SC)cc1OC ZINC000444228882 868677627 /nfs/dbraw/zinc/67/76/27/868677627.db2.gz YGMREOFVWADNJA-UHFFFAOYSA-N 0 3 410.486 4.165 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)NC(=O)NC[C@H](c2cccs2)N2CCCC2)cc1 ZINC000444337976 868765145 /nfs/dbraw/zinc/76/51/45/868765145.db2.gz MYVNNTCTDGJELY-DYESRHJHSA-N 0 3 423.586 4.440 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)N([C@@H](C)c3ccco3)C3CC3)CC2)c1 ZINC000444337033 868765498 /nfs/dbraw/zinc/76/54/98/868765498.db2.gz ANXZYPICGAWMGV-NRFANRHFSA-N 0 3 424.589 4.425 20 0 HIADHN CN(Cc1cccnc1)C[C@@H]1CCN(C(=O)C2(c3ccc(C(F)(F)F)cc3)CC2)C1 ZINC000444358242 868785469 /nfs/dbraw/zinc/78/54/69/868785469.db2.gz SHFCENZXEGXPBB-SFHVURJKSA-N 0 3 417.475 4.113 20 0 HIADHN COc1ccc(CN(C)C[C@H](O)CO[C@@H](c2ccccc2)c2ccc(C)cc2)cc1O ZINC000444401479 868812394 /nfs/dbraw/zinc/81/23/94/868812394.db2.gz GQJJVQXCJYXQCG-OZXSUGGESA-N 0 3 421.537 4.308 20 0 HIADHN CN(C)CCN(C(=O)N[C@H](c1nc2ccccc2n1C)c1ccccc1)C1CCCC1 ZINC000468305664 882229841 /nfs/dbraw/zinc/22/98/41/882229841.db2.gz FRYUGTQHUQZBSR-QHCPKHFHSA-N 0 3 419.573 4.179 20 0 HIADHN Cc1ccc(-c2nc(C(=O)Nc3cccc(CN4CCC(CO)CC4)c3)cs2)o1 ZINC000444549826 868878484 /nfs/dbraw/zinc/87/84/84/868878484.db2.gz LQWPQNIHJWNHAW-UHFFFAOYSA-N 0 3 411.527 4.168 20 0 HIADHN COc1ccc2c(c1)CCC[C@@H]2CC(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000444555964 868880259 /nfs/dbraw/zinc/88/02/59/868880259.db2.gz UPEPKWDSLJKMJB-JOCHJYFZSA-N 0 3 422.569 4.348 20 0 HIADHN COc1ccc2c(c1)CCC[C@H]2CC(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000444555966 868880439 /nfs/dbraw/zinc/88/04/39/868880439.db2.gz UPEPKWDSLJKMJB-QFIPXVFZSA-N 0 3 422.569 4.348 20 0 HIADHN O=C(CCCOc1ccccc1Cl)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000444562965 868884203 /nfs/dbraw/zinc/88/42/03/868884203.db2.gz XIWQRZOGOSLMQB-UHFFFAOYSA-N 0 3 416.949 4.342 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)N([C@@H](C)c2ccc3ccccc3c2)C2CC2)CC1 ZINC000444717864 868973884 /nfs/dbraw/zinc/97/38/84/868973884.db2.gz TZRPYXDEZSLNBE-RTWAWAEBSA-N 0 3 422.617 4.348 20 0 HIADHN Cc1cccc2nc(C3CCN(C[C@@H](O)COc4ccccc4Cl)CC3)oc21 ZINC000444769917 868995002 /nfs/dbraw/zinc/99/50/02/868995002.db2.gz ATSFMQOKKUVGRJ-QGZVFWFLSA-N 0 3 400.906 4.409 20 0 HIADHN CC(C)N(Cc1ccccc1)C(=O)[C@@H](C)N1CCC(CO)(Cc2ccccc2)CC1 ZINC000444780358 869000010 /nfs/dbraw/zinc/00/00/10/869000010.db2.gz DVXPJLYOGTZYPL-JOCHJYFZSA-N 0 3 408.586 4.129 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N[C@@H](C)c2ccc(Cl)cc2Cl)CC1 ZINC000445008112 869161696 /nfs/dbraw/zinc/16/16/96/869161696.db2.gz PNUKNRAPMJQAPK-AWEZNQCLSA-N 0 3 402.366 4.243 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N2C[C@@H](c3ccccc3)c3ccccc32)CC1 ZINC000445111937 869222883 /nfs/dbraw/zinc/22/28/83/869222883.db2.gz JLBDGNMYYCPWHJ-QHCPKHFHSA-N 0 3 407.558 4.238 20 0 HIADHN COc1ccc([C@H](CNC(=O)CCCc2ccc(F)c(F)c2)N2CCCC2)cc1 ZINC000445644586 869716001 /nfs/dbraw/zinc/71/60/01/869716001.db2.gz HUFRJXCTADNCCE-QFIPXVFZSA-N 0 3 402.485 4.249 20 0 HIADHN Cc1cccc(C)c1NC(=O)CN1CCN(CC2CCC(C(F)(F)F)CC2)CC1 ZINC000468401767 882343634 /nfs/dbraw/zinc/34/36/34/882343634.db2.gz MFKVGPOVYPHQLQ-UHFFFAOYSA-N 0 3 411.512 4.228 20 0 HIADHN CN(CCc1nc(-c2ccccc2)no1)[C@@H]1CCOc2ccc(Br)cc21 ZINC000445878141 869868912 /nfs/dbraw/zinc/86/89/12/869868912.db2.gz FEQCBKYXIGGXJO-QGZVFWFLSA-N 0 3 414.303 4.497 20 0 HIADHN CN(C)Cc1cccc(C(=O)Nc2ccc(C(=O)NCc3ccccc3F)cc2)c1 ZINC000468406197 882349242 /nfs/dbraw/zinc/34/92/42/882349242.db2.gz ULDYRWLICKQLMM-UHFFFAOYSA-N 0 3 405.473 4.070 20 0 HIADHN FC(F)(F)C1CCC(CN2CCN(Cc3nc(-c4cccs4)no3)CC2)CC1 ZINC000468407758 882350238 /nfs/dbraw/zinc/35/02/38/882350238.db2.gz JMNWXHYRLDQSRN-UHFFFAOYSA-N 0 3 414.497 4.284 20 0 HIADHN C[C@H](c1ccccc1)N1CCC(NC(=O)CCC(=O)c2ccc(F)c(F)c2)CC1 ZINC000445962730 869930254 /nfs/dbraw/zinc/93/02/54/869930254.db2.gz OSYCBQMMMQZKJG-MRXNPFEDSA-N 0 3 400.469 4.270 20 0 HIADHN CCOC(=O)c1sc2nc(CN[C@H]3CCC[C@H]3c3ccccc3)nc(N)c2c1C ZINC000445987531 869951363 /nfs/dbraw/zinc/95/13/63/869951363.db2.gz GHIGMDXLWRFRPH-HOTGVXAUSA-N 0 3 410.543 4.185 20 0 HIADHN COCCN1CCC[C@H]1CNC(=O)c1c(F)cccc1Sc1ccc(Cl)cc1 ZINC000446079548 870029333 /nfs/dbraw/zinc/02/93/33/870029333.db2.gz JGJGNLRVAUXKSB-INIZCTEOSA-N 0 3 422.953 4.471 20 0 HIADHN CCN1CC[C@@H](N(C)C(=O)CCCC(=O)c2ccc(Br)cc2)C[C@@H]1C ZINC000446150572 870090962 /nfs/dbraw/zinc/09/09/62/870090962.db2.gz ZGZPCKYONVWAET-MAUKXSAKSA-N 0 3 409.368 4.133 20 0 HIADHN O=C(CCCc1csc2ccccc12)NCc1ccccc1CN1CCC(O)CC1 ZINC000446234902 870174132 /nfs/dbraw/zinc/17/41/32/870174132.db2.gz GYDSBKUHSZDOMZ-UHFFFAOYSA-N 0 3 422.594 4.497 20 0 HIADHN CCN(C[C@@H]1CCN(Cc2ccccc2)C1)C(=O)CCC(=O)c1ccc(F)c(F)c1 ZINC000446235228 870174601 /nfs/dbraw/zinc/17/46/01/870174601.db2.gz RJWZUTIRPMLJBY-LJQANCHMSA-N 0 3 414.496 4.298 20 0 HIADHN O=C(CCC(=O)N1CCCN(C2CCCC2)CC1)c1cc(Cl)sc1Cl ZINC000446284272 870216317 /nfs/dbraw/zinc/21/63/17/870216317.db2.gz LPRJSSIYMLMBBR-UHFFFAOYSA-N 0 3 403.375 4.495 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)c2cnc(Cc3ccccc3)s2)CC1 ZINC000446335267 870248747 /nfs/dbraw/zinc/24/87/47/870248747.db2.gz XHFINDQJIFBHGK-UHFFFAOYSA-N 0 3 405.567 4.471 20 0 HIADHN COc1cc(SC)ccc1NC(=O)N(CCN(C)C)Cc1ccc(F)c(F)c1 ZINC000446400354 870302449 /nfs/dbraw/zinc/30/24/49/870302449.db2.gz JMOJSHKURSLJLI-UHFFFAOYSA-N 0 3 409.502 4.291 20 0 HIADHN COc1cc(SC)ccc1NC(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000446414513 870322398 /nfs/dbraw/zinc/32/23/98/870322398.db2.gz XPNKNNBMSRIVJQ-IAGOWNOFSA-N 0 3 421.607 4.160 20 0 HIADHN CCCOc1ccc(-c2nc(C(=O)N(CCN(C)C)Cc3ccco3)cs2)cc1 ZINC000446422337 870335922 /nfs/dbraw/zinc/33/59/22/870335922.db2.gz HSBJDLXBGWQILF-UHFFFAOYSA-N 0 3 413.543 4.396 20 0 HIADHN Cc1cc(C(=O)N(CCN(C)C)Cc2ccco2)cc(C)c1OCc1cccnc1 ZINC000446427682 870344441 /nfs/dbraw/zinc/34/44/41/870344441.db2.gz JBLFWEZAXDNFCG-UHFFFAOYSA-N 0 3 407.514 4.074 20 0 HIADHN CC(C)OC(=O)C[C@@H]1CCCN(Cc2cn(-c3ccccc3)nc2-c2ccncc2)C1 ZINC000468471159 882423291 /nfs/dbraw/zinc/42/32/91/882423291.db2.gz DXVKCANVCRZIOV-FQEVSTJZSA-N 0 3 418.541 4.488 20 0 HIADHN CN(CC(=O)Nc1ccccc1C(F)(F)F)C(=O)CN(C)C1CCC(C)(C)CC1 ZINC000446711386 870627539 /nfs/dbraw/zinc/62/75/39/870627539.db2.gz LUZUKKSLOSLSER-UHFFFAOYSA-N 0 3 413.484 4.003 20 0 HIADHN COc1ccc([C@H](CCn2cncn2)NCc2ccc(Br)s2)cc1 ZINC000446754726 870666076 /nfs/dbraw/zinc/66/60/76/870666076.db2.gz XRMAVWGNPCTZIZ-INIZCTEOSA-N 0 3 407.337 4.032 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1ccccc1OCCc1ccccc1 ZINC000446931644 870842650 /nfs/dbraw/zinc/84/26/50/870842650.db2.gz RLJBENRHAJGPOD-UHFFFAOYSA-N 0 3 407.514 4.497 20 0 HIADHN Cc1ccc([C@@H](CCn2cncn2)NCc2ccc(C)cc2OC[C@@H]2CCCO2)cc1 ZINC000446935591 870845503 /nfs/dbraw/zinc/84/55/03/870845503.db2.gz GIANGWYXOOQNKB-BJKOFHAPSA-N 0 3 420.557 4.374 20 0 HIADHN Cc1nc(-c2ccc(C)c(NC(=O)N[C@H]3CCN([C@@H](C)c4ccccc4)C3)c2)n[nH]1 ZINC000447076287 870960756 /nfs/dbraw/zinc/96/07/56/870960756.db2.gz JMCQWEZNUFXVIK-JXFKEZNVSA-N 0 3 404.518 4.046 20 0 HIADHN COc1ccccc1-c1csc([C@H]2CCCN(C(=O)CN3[C@H](C)CC[C@@H]3C)C2)n1 ZINC000447149958 871049095 /nfs/dbraw/zinc/04/90/95/871049095.db2.gz COMKMXRSKGTPAG-KSZLIROESA-N 0 3 413.587 4.398 20 0 HIADHN Cc1ccc([C@H](C)NC(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)cc1F ZINC000447224795 871110370 /nfs/dbraw/zinc/11/03/70/871110370.db2.gz YGCORLOBRDLVPM-OTWHNJEPSA-N 0 3 405.558 4.116 20 0 HIADHN Cc1ccc(NC(=O)CCN2CCC(Oc3cccc(Br)c3)CC2)nc1 ZINC000447312821 871205357 /nfs/dbraw/zinc/20/53/57/871205357.db2.gz IEKDMDVYSIYFRQ-UHFFFAOYSA-N 0 3 418.335 4.025 20 0 HIADHN COCc1cccc(OCC2(CN3CCC(Oc4ncccc4F)CC3)CC2)c1 ZINC000447356303 871260615 /nfs/dbraw/zinc/26/06/15/871260615.db2.gz UCRAMDRJWDYEHV-UHFFFAOYSA-N 0 3 400.494 4.070 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N[C@H](C)c1ccc(Cl)cc1Cl ZINC000447366222 871273559 /nfs/dbraw/zinc/27/35/59/871273559.db2.gz RFSVWCWLNKBERF-CYBMUJFWSA-N 0 3 408.329 4.179 20 0 HIADHN COc1ccccc1-c1csc([C@@H]2CCCN([C@@H]3CCCN(C(C)C)C3=O)C2)n1 ZINC000447401399 871310473 /nfs/dbraw/zinc/31/04/73/871310473.db2.gz YCFJJJFJWISIIM-YLJYHZDGSA-N 0 3 413.587 4.398 20 0 HIADHN CN1CCC(n2ccc(N[C@H](C(=O)c3c[nH]c4ccccc34)c3ccccc3)n2)CC1 ZINC000447412902 871322096 /nfs/dbraw/zinc/32/20/96/871322096.db2.gz JKSBGZUVFYOJON-DEOSSOPVSA-N 0 3 413.525 4.667 20 0 HIADHN O=C(c1cccc(CN[C@H](Cc2ccc(F)cc2)c2ccccc2)c1)N1CCOCC1 ZINC000447545311 871412943 /nfs/dbraw/zinc/41/29/43/871412943.db2.gz QZIMBLLEYJCUKG-RUZDIDTESA-N 0 3 418.512 4.372 20 0 HIADHN CC(=O)c1cc(C(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)ccc1C ZINC000447548346 871421349 /nfs/dbraw/zinc/42/13/49/871421349.db2.gz AKMGLJYTHPGWBJ-JOCHJYFZSA-N 0 3 416.525 4.402 20 0 HIADHN CN(C(=O)c1ccnc(Oc2ccc(F)cc2F)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000447567005 871466344 /nfs/dbraw/zinc/46/63/44/871466344.db2.gz YJAWRUCCSJZKOE-FQEVSTJZSA-N 0 3 423.463 4.499 20 0 HIADHN Cn1nccc1N1CCC[C@@H](N[C@@H](c2ccc(F)cc2)c2cnc3ccccc3c2)C1 ZINC000447578557 871479124 /nfs/dbraw/zinc/47/91/24/871479124.db2.gz LBPJJULAFQOKDJ-RDGATRHJSA-N 0 3 415.516 4.455 20 0 HIADHN COC(=O)c1coc([C@@H](C)NC2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)c1 ZINC000447594357 871499298 /nfs/dbraw/zinc/49/92/98/871499298.db2.gz YHTVRYQAWKUEPP-CYBMUJFWSA-N 0 3 424.419 4.040 20 0 HIADHN CSc1cccc([C@H](NCC2(N3CCOCC3)CC2)c2ccc(F)c(F)c2)c1 ZINC000447598444 871504896 /nfs/dbraw/zinc/50/48/96/871504896.db2.gz HKBNRPOWOVCWIR-NRFANRHFSA-N 0 3 404.526 4.231 20 0 HIADHN C[C@H](NC[C@@H](CO)Cc1cc(F)c(F)c(F)c1)c1nc2ccc(Cl)cc2n1C ZINC000447604365 871512485 /nfs/dbraw/zinc/51/24/85/871512485.db2.gz AFNMWXOBVPQDBM-AAEUAGOBSA-N 0 3 411.855 4.146 20 0 HIADHN CCN1CCC[C@@H](CN(C)C(=O)c2ccc(C)c(Cl)c2F)[C@@H]1c1cnn(C)c1 ZINC000447605506 871513935 /nfs/dbraw/zinc/51/39/35/871513935.db2.gz JETHTJNHTOAGDJ-MGPUTAFESA-N 0 3 406.933 4.066 20 0 HIADHN O=C(NC[C@@H]1CCCN(c2ccccc2)C1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000447735225 871686784 /nfs/dbraw/zinc/68/67/84/871686784.db2.gz CGYBEVJWVHCRMI-FCHUYYIVSA-N 0 3 409.549 4.071 20 0 HIADHN COc1ccc2ccccc2c1CN(C1CCCC1)[C@H]1CCN(C2CCOCC2)C1=O ZINC000447857216 871777736 /nfs/dbraw/zinc/77/77/36/871777736.db2.gz VTIPJTBDDBUWKT-DEOSSOPVSA-N 0 3 422.569 4.373 20 0 HIADHN C[C@@H]1OCC[C@]1(O)CN(Cc1ccccc1)Cc1ccccc1Oc1cccnc1 ZINC000447926751 871815916 /nfs/dbraw/zinc/81/59/16/871815916.db2.gz NFMNQMJRAVWLHV-CPJSRVTESA-N 0 3 404.510 4.416 20 0 HIADHN CC[C@@H](CNC(=O)Nc1cccc2c1OCC[C@@H]2OC)N1CCc2ccccc2C1 ZINC000448045354 871876422 /nfs/dbraw/zinc/87/64/22/871876422.db2.gz QKWMCXSVEMKILJ-UGKGYDQZSA-N 0 3 409.530 4.115 20 0 HIADHN CO[C@H]1CCOc2c(NC(=O)NC[C@H](C(C)C)N3CCc4ccccc4C3)cccc21 ZINC000448053521 871883696 /nfs/dbraw/zinc/88/36/96/871883696.db2.gz ZAXYWHZLEMQYSU-PKTZIBPZSA-N 0 3 423.557 4.361 20 0 HIADHN Cc1ccc(NC(=O)N2CCCN(C)CC2)cc1Oc1ncccc1Br ZINC000448083167 871909988 /nfs/dbraw/zinc/90/99/88/871909988.db2.gz YJHXZFRFRKVATM-UHFFFAOYSA-N 0 3 419.323 4.114 20 0 HIADHN Cc1cc(NC(=O)c2cnc(C(C)C)s2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000448252306 872170284 /nfs/dbraw/zinc/17/02/84/872170284.db2.gz NVMRHPGOGFCUBJ-GOSISDBHSA-N 0 3 409.559 4.471 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)NC[C@@H]1C[C@@H](C(C)C)c2ccccc21 ZINC000448323010 872259817 /nfs/dbraw/zinc/25/98/17/872259817.db2.gz VHDHWFCXEWAZSP-UGKGYDQZSA-N 0 3 407.558 4.038 20 0 HIADHN Brc1cccc(N[C@@H]2CCCN(Cc3c[nH]nc3-c3cccnc3)C2)c1 ZINC000448370332 872321035 /nfs/dbraw/zinc/32/10/35/872321035.db2.gz HMGCMXMFLNMMTP-LJQANCHMSA-N 0 3 412.335 4.311 20 0 HIADHN Cc1cccc(CN(Cc2ccco2)C(=O)CCN2CCN(c3ccccc3)CC2)c1 ZINC000468562296 882616473 /nfs/dbraw/zinc/61/64/73/882616473.db2.gz ZUPYGHGDHJZMMS-UHFFFAOYSA-N 0 3 417.553 4.329 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CC(C)(CCOC)C1)c1ccc(C(F)(F)F)cc1 ZINC000460107658 872572982 /nfs/dbraw/zinc/57/29/82/872572982.db2.gz PNRHPBMPLZUCCK-GOSISDBHSA-N 0 3 415.500 4.156 20 0 HIADHN CCN(C(=O)Nc1ccc(NC(=O)C(C)C)cc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000460122993 872596431 /nfs/dbraw/zinc/59/64/31/872596431.db2.gz HUYOETSZUYGFCB-QFIPXVFZSA-N 0 3 408.546 4.409 20 0 HIADHN CCN(C(=O)Nc1cnn(Cc2ccccc2)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000460130396 872611363 /nfs/dbraw/zinc/61/13/63/872611363.db2.gz FELUBSKOGVVKLP-QHCPKHFHSA-N 0 3 403.530 4.060 20 0 HIADHN CCN(C(=O)Nc1ccc(C(=O)N2CCCC2)cc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000460130260 872612738 /nfs/dbraw/zinc/61/27/38/872612738.db2.gz DIZJJKLKCFCXQM-QHCPKHFHSA-N 0 3 420.557 4.051 20 0 HIADHN CCCN(CCN1CCN(CC)CC1)C(=O)N[C@@H](CC(C)(C)C)c1ccc(F)cc1 ZINC000460133162 872617845 /nfs/dbraw/zinc/61/78/45/872617845.db2.gz VOOICHZXWSNXHV-QFIPXVFZSA-N 0 3 420.617 4.362 20 0 HIADHN CCn1c([C@@H](C)Oc2ccc3ccccc3c2)nnc1N(C)[C@@H]1CCN(C2CC2)C1 ZINC000460204353 872783682 /nfs/dbraw/zinc/78/36/82/872783682.db2.gz UVNKALPLLHLLCZ-DYESRHJHSA-N 0 3 405.546 4.264 20 0 HIADHN CCCN(CCN1CCN(CC)CC1)C(=O)N[C@@H](CC(C)C)c1ccccc1C ZINC000460245389 872833567 /nfs/dbraw/zinc/83/35/67/872833567.db2.gz LYWYXNJQVHWYCA-QHCPKHFHSA-N 0 3 402.627 4.141 20 0 HIADHN O=C(NC[C@H]1CCCN1Cc1ccccc1)N1CCCC[C@@H]1c1nnc(C2CCC2)o1 ZINC000460342213 872954706 /nfs/dbraw/zinc/95/47/06/872954706.db2.gz YLGCTVCXOQIADS-NHCUHLMSSA-N 0 3 423.561 4.238 20 0 HIADHN CC(C)[C@@H](C)CNC(=O)N(Cc1ccccc1Br)C1CCN(C)CC1 ZINC000460534433 873232181 /nfs/dbraw/zinc/23/21/81/873232181.db2.gz ROZBYZYIBVJHQC-INIZCTEOSA-N 0 3 410.400 4.347 20 0 HIADHN Cc1nc2ccccc2n1CCc1noc([C@@H]2CCCN(Cc3cccc(F)c3)C2)n1 ZINC000460828280 873715209 /nfs/dbraw/zinc/71/52/09/873715209.db2.gz MXMAMLFGJRDPTG-LJQANCHMSA-N 0 3 419.504 4.489 20 0 HIADHN C[C@H]1CC[C@@H](NC(=O)N(Cc2ccccc2Br)C2CCN(C)CC2)C1 ZINC000460840682 873730459 /nfs/dbraw/zinc/73/04/59/873730459.db2.gz PMCBNXTYCGCKOR-DOTOQJQBSA-N 0 3 408.384 4.244 20 0 HIADHN CCN1C[C@@H](C)N(c2nnc([C@H]3OCC[C@H]3c3ccccc3)n2CC(C)C)C[C@@H]1C ZINC000460919461 873824415 /nfs/dbraw/zinc/82/44/15/873824415.db2.gz XFFWRMXXCRIMRT-MXNKGDRCSA-N 0 3 411.594 4.098 20 0 HIADHN CN(C)CCN(C(=O)CCNc1ncc(C(F)(F)F)cc1Cl)c1ccccc1 ZINC000460936211 873837761 /nfs/dbraw/zinc/83/77/61/873837761.db2.gz LURHQYKJSJHTHK-UHFFFAOYSA-N 0 3 414.859 4.151 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)c2ccc(OCc3ccccn3)cc2)C1 ZINC000460977231 873870880 /nfs/dbraw/zinc/87/08/80/873870880.db2.gz LBZPHAVJHAWRBW-KNQAVFIVSA-N 0 3 401.510 4.226 20 0 HIADHN CO[C@@H](CNC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1)c1ccc(Cl)cc1 ZINC000461031526 873894720 /nfs/dbraw/zinc/89/47/20/873894720.db2.gz DNKHRHCJZPRSEU-NQIIRXRSSA-N 0 3 404.913 4.195 20 0 HIADHN Cc1nc(C(C)(C)C)sc1[C@@H](C)NCc1ccc(N2CCCS2(=O)=O)cc1 ZINC000461096132 874011686 /nfs/dbraw/zinc/01/16/86/874011686.db2.gz YJEUUYRZJYBRPJ-CQSZACIVSA-N 0 3 407.605 4.140 20 0 HIADHN CCCN(C(=O)CCN1CCN(c2ccccc2)CC1)[C@H](C)c1ccccc1OC ZINC000468677777 882805857 /nfs/dbraw/zinc/80/58/57/882805857.db2.gz RDTJUCBGEHZKBB-OAQYLSRUSA-N 0 3 409.574 4.207 20 0 HIADHN CCC1(CC)CCCN(C(=O)NCc2ccccc2CN2CCC(O)CC2)CC1 ZINC000468693351 882816410 /nfs/dbraw/zinc/81/64/10/882816410.db2.gz JWTDCIZRIXNXGO-UHFFFAOYSA-N 0 3 401.595 4.145 20 0 HIADHN COc1ccc(C(=O)CCCC(=O)N2C[C@H]3CN(Cc4ccccc4)CC[C@@H]3C2)cc1 ZINC000461433248 874481961 /nfs/dbraw/zinc/48/19/61/874481961.db2.gz WLOJSLGSNKSKIZ-DHIUTWEWSA-N 0 3 420.553 4.029 20 0 HIADHN COc1ccc(C(=O)CCCC(=O)N2C[C@@H]3CCN(Cc4ccccc4)C[C@H]3C2)cc1 ZINC000461433249 874482406 /nfs/dbraw/zinc/48/24/06/874482406.db2.gz WLOJSLGSNKSKIZ-GOTSBHOMSA-N 0 3 420.553 4.029 20 0 HIADHN C[C@H](CC(=O)c1ccccc1F)C(=O)N1C[C@@H]2CCN(Cc3ccccc3)C[C@H]2C1 ZINC000461438564 874490772 /nfs/dbraw/zinc/49/07/72/874490772.db2.gz MFVDGNJOIFISBH-GIVPXCGWSA-N 0 3 408.517 4.015 20 0 HIADHN Cc1c(C(=O)N2C[C@H]3CCN(Cc4ccccc4)C[C@H]3C2)[nH]c2c1C(=O)CC(C)(C)C2 ZINC000461439718 874493370 /nfs/dbraw/zinc/49/33/70/874493370.db2.gz UIXCWQGDVDDTDV-UXHICEINSA-N 0 3 419.569 4.072 20 0 HIADHN Cc1ccc(C)c(C(=O)CCC(=O)N2C[C@H]3CN(Cc4ccccc4)CC[C@@H]3C2)c1 ZINC000461445259 874500324 /nfs/dbraw/zinc/50/03/24/874500324.db2.gz MUFWGMOZEHATCV-DHIUTWEWSA-N 0 3 404.554 4.247 20 0 HIADHN COc1ccc2c(c1)C1(CC1)CN(C(=O)[C@@H]1CCCN(Cc3cccc(F)c3)C1)C2 ZINC000461448257 874508289 /nfs/dbraw/zinc/50/82/89/874508289.db2.gz OCZPTYOYVACDKX-HXUWFJFHSA-N 0 3 408.517 4.120 20 0 HIADHN CC(C)(C)c1noc(CCC(=O)N2CCN(Cc3ccccc3)C3(CCCCC3)C2)n1 ZINC000461579565 874686287 /nfs/dbraw/zinc/68/62/87/874686287.db2.gz OFVUNSMOPMLTMA-UHFFFAOYSA-N 0 3 424.589 4.347 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)Nc3cccc(Oc4cccnn4)c3)cc2)CC1 ZINC000461594031 874715450 /nfs/dbraw/zinc/71/54/50/874715450.db2.gz ACPKUMNSXRCIPW-UHFFFAOYSA-N 0 3 417.513 4.052 20 0 HIADHN CN(C(=O)NC1CCN(CCOc2ccc(Cl)cc2)CC1)c1ccc(F)cc1 ZINC000468802420 882866177 /nfs/dbraw/zinc/86/61/77/882866177.db2.gz BUDKDTQNGBIBGH-UHFFFAOYSA-N 0 3 405.901 4.168 20 0 HIADHN CC[C@H](Cc1ccccc1)N(CC)Cc1nc2c(cnn2-c2ccccc2)c(=O)[nH]1 ZINC000468829696 882880648 /nfs/dbraw/zinc/88/06/48/882880648.db2.gz DOZTZOJEWJRQRG-LJQANCHMSA-N 0 3 401.514 4.364 20 0 HIADHN CC[C@H](Cc1ccccc1)[N@H+](CC)Cc1nc2c(cnn2-c2ccccc2)c(=O)[n-]1 ZINC000468829696 882880649 /nfs/dbraw/zinc/88/06/49/882880649.db2.gz DOZTZOJEWJRQRG-LJQANCHMSA-N 0 3 401.514 4.364 20 0 HIADHN CC[C@H](Cc1ccccc1)[N@@H+](CC)Cc1nc2c(cnn2-c2ccccc2)c(=O)[n-]1 ZINC000468829696 882880652 /nfs/dbraw/zinc/88/06/52/882880652.db2.gz DOZTZOJEWJRQRG-LJQANCHMSA-N 0 3 401.514 4.364 20 0 HIADHN Cc1c([C@H](C)NC[C@@H](O)COc2cccc(Cl)c2Cl)cnn1C(C)(C)C ZINC000468845356 882887099 /nfs/dbraw/zinc/88/70/99/882887099.db2.gz GBTBZLSPNZWHCN-GXTWGEPZSA-N 0 3 400.350 4.344 20 0 HIADHN CN1CC[C@H](NC(=O)N[C@@H]2CCCc3cn(C4CCCC4)nc32)[C@H]1c1ccccc1 ZINC000461944103 875076813 /nfs/dbraw/zinc/07/68/13/875076813.db2.gz ADLDOAMQDMWJNV-FUPPJEDESA-N 0 3 407.562 4.120 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)Nc3cccc(OCC(F)(F)F)c3)CC2)c1 ZINC000461965264 875090238 /nfs/dbraw/zinc/09/02/38/875090238.db2.gz MYTMCXHORJTKSN-UHFFFAOYSA-N 0 3 421.463 4.087 20 0 HIADHN CCN1CCN(CCC(=O)Nc2ccccc2NC23CC4CC(CC(C4)C2)C3)CC1 ZINC000461983640 875103090 /nfs/dbraw/zinc/10/30/90/875103090.db2.gz JEYJAJZPSDMUJM-UHFFFAOYSA-N 0 3 410.606 4.033 20 0 HIADHN Cc1nc(C(F)(F)F)sc1C(=O)NC[C@H]1CCCN(Cc2cccs2)C1 ZINC000462020506 875138026 /nfs/dbraw/zinc/13/80/26/875138026.db2.gz NBGQBYAZJLHYBV-GFCCVEGCSA-N 0 3 403.495 4.174 20 0 HIADHN C[C@H](CC(=O)Nc1ccc(CCN2CCSCC2)cc1)C(=O)c1cccc(F)c1 ZINC000468868297 882899032 /nfs/dbraw/zinc/89/90/32/882899032.db2.gz GTPKIBGSIWQUIK-QGZVFWFLSA-N 0 3 414.546 4.265 20 0 HIADHN C[C@H](NC(=O)CCN1CCN(c2ccccc2)CC1)c1cccc(C(F)(F)F)c1 ZINC000462047889 875161723 /nfs/dbraw/zinc/16/17/23/875161723.db2.gz QTSIQHLZIZLWHS-KRWDZBQOSA-N 0 3 405.464 4.095 20 0 HIADHN COc1ccc([C@@H]2CCCCCN2C(=O)CCN2CCN(c3ccccc3)CC2)cc1 ZINC000462059377 875172068 /nfs/dbraw/zinc/17/20/68/875172068.db2.gz NVDFDSPJWRLIKA-VWLOTQADSA-N 0 3 421.585 4.351 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)Nc3ccc(Br)cc3C)CC2)c1 ZINC000462063674 875174896 /nfs/dbraw/zinc/17/48/96/875174896.db2.gz SLGAPIOPFPJQER-UHFFFAOYSA-N 0 3 416.363 4.217 20 0 HIADHN COc1ccc([C@H](CNc2ncccc2C(=O)N2CCCCC2)N2CCCCC2)cc1 ZINC000462122096 875224761 /nfs/dbraw/zinc/22/47/61/875224761.db2.gz RCYGYYFWWBSVHR-QHCPKHFHSA-N 0 3 422.573 4.355 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCc1ncc(-c2ccccc2)cn1)c1ccsc1 ZINC000462130522 875231674 /nfs/dbraw/zinc/23/16/74/875231674.db2.gz OCYDXKZZUFNECC-FQEVSTJZSA-N 0 3 409.559 4.087 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C1(c2cccc(Cl)c2)CCOCC1 ZINC000462162025 875256820 /nfs/dbraw/zinc/25/68/20/875256820.db2.gz ZKJDZPWDHYSKRK-AVRDEDQJSA-N 0 3 412.961 4.025 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1cc(NC(=O)C(C)(C)C)ccc1F ZINC000462174588 875273079 /nfs/dbraw/zinc/27/30/79/875273079.db2.gz GUKRYEIVZUIASH-KKSFZXQISA-N 0 3 411.521 4.061 20 0 HIADHN C[C@H]1CCCN(c2cc(C(=O)N3CC[C@H](C)N(Cc4ccccc4)CC3)ccn2)C1 ZINC000462176249 875275022 /nfs/dbraw/zinc/27/50/22/875275022.db2.gz BWAQTHCTPURBCM-SFTDATJTSA-N 0 3 406.574 4.055 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)CCc1cc(Br)cs1 ZINC000462180933 875280085 /nfs/dbraw/zinc/28/00/85/875280085.db2.gz WFBOLJJGCNEDSW-KSSFIOAISA-N 0 3 407.377 4.080 20 0 HIADHN Cc1ccc(-c2cnc(CCC(=O)N[C@@H]3CN(Cc4ccccc4)C[C@@H]3C)o2)cc1 ZINC000462181321 875280772 /nfs/dbraw/zinc/28/07/72/875280772.db2.gz JVCWZFSSFDGIKX-SIKLNZKXSA-N 0 3 403.526 4.219 20 0 HIADHN Cc1ccc(C(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)cc1NC(=O)c1ccco1 ZINC000462185852 875289660 /nfs/dbraw/zinc/28/96/60/875289660.db2.gz BMJFCTAYVYFKMS-GCJKJVERSA-N 0 3 417.509 4.091 20 0 HIADHN C[C@H](NC(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C)c1nc(C(C)(C)C)cs1 ZINC000462191425 875298547 /nfs/dbraw/zinc/29/85/47/875298547.db2.gz SINFKXCLEBEZKS-RYRKJORJSA-N 0 3 400.592 4.321 20 0 HIADHN Cc1nc(COc2ccccc2C(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)cs1 ZINC000462195765 875303444 /nfs/dbraw/zinc/30/34/44/875303444.db2.gz MNEZCQBFIDVVOO-VGSWGCGISA-N 0 3 421.566 4.281 20 0 HIADHN O=C(CCN1CCC(c2noc(C3CC3)n2)CC1)Nc1ccccc1C(F)(F)F ZINC000462242156 875358887 /nfs/dbraw/zinc/35/88/87/875358887.db2.gz UNCDWAVGGVVJOI-UHFFFAOYSA-N 0 3 408.424 4.174 20 0 HIADHN C[C@H]1CC[C@H](C)N1CC(=O)Nc1ccc(CC(=O)N2CCCc3ccccc32)cc1 ZINC000468884199 882922446 /nfs/dbraw/zinc/92/24/46/882922446.db2.gz FXVROIDRROHUHZ-OALUTQOASA-N 0 3 405.542 4.020 20 0 HIADHN CCC(=O)Nc1ccc(Cl)c(NC(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)c1 ZINC000462254350 875376539 /nfs/dbraw/zinc/37/65/39/875376539.db2.gz JBVVRDHDIQQWCF-QRWLVFNGSA-N 0 3 414.937 4.331 20 0 HIADHN CC(C)(C)[C@H](Cc1ccccc1C(F)(F)F)NC(=O)N1CC[C@@H](N2CC=CC2)C1 ZINC000462305815 875426358 /nfs/dbraw/zinc/42/63/58/875426358.db2.gz MZEXWVQPKHPDAZ-MJGOQNOKSA-N 0 3 409.496 4.318 20 0 HIADHN C[C@H](NCC(=O)Nc1cccc(C(=O)N(C)C)c1)c1ccc(Cl)c2ccccc21 ZINC000462465962 875572896 /nfs/dbraw/zinc/57/28/96/875572896.db2.gz MXZQKQFUCSYKFF-HNNXBMFYSA-N 0 3 409.917 4.484 20 0 HIADHN Cc1c(NC(=O)[C@H](C)N2CC[C@H](C)C3(CCCCC3)C2)c(=O)n(-c2ccccc2)n1C ZINC000462467523 875576250 /nfs/dbraw/zinc/57/62/50/875576250.db2.gz VEYXFNCSBZQJKH-ICSRJNTNSA-N 0 3 424.589 4.104 20 0 HIADHN CN(C)C[C@@H](NC(=O)NC[C@H]1CC[C@@H](c2ccccc2)O1)c1ccc(Cl)cc1 ZINC000462480040 875587979 /nfs/dbraw/zinc/58/79/79/875587979.db2.gz OTVXACKVDUTVDQ-NJYVYQBISA-N 0 3 401.938 4.162 20 0 HIADHN CC(C)[C@H](Oc1ccc(Cl)cc1)C(=O)N1CC[C@H](CN(C)Cc2cccnc2)C1 ZINC000462536064 875655716 /nfs/dbraw/zinc/65/57/16/875655716.db2.gz DTMSUSQKKRPXCS-KNQAVFIVSA-N 0 3 415.965 4.119 20 0 HIADHN C[C@H](C(=O)N(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1)c1cccc(Br)c1 ZINC000462539516 875659575 /nfs/dbraw/zinc/65/95/75/875659575.db2.gz SNTYRBUMHVCCRS-QSFXBCCZSA-N 0 3 416.363 4.099 20 0 HIADHN CCCCCOc1ccc(CNCc2cccc(N3CCCS3(=O)=O)c2)cc1 ZINC000462544976 875666849 /nfs/dbraw/zinc/66/68/49/875666849.db2.gz DSFWFBHZMNXSCP-UHFFFAOYSA-N 0 3 402.560 4.085 20 0 HIADHN COc1cc(NC(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)cc(OC)c1C(C)C ZINC000462705274 875791476 /nfs/dbraw/zinc/79/14/76/875791476.db2.gz PBSQWMZXGWJYBP-PXNSSMCTSA-N 0 3 411.546 4.469 20 0 HIADHN CC(C)Oc1ccc(CN[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2=O)cc1 ZINC000462740736 875811504 /nfs/dbraw/zinc/81/15/04/875811504.db2.gz RJIBPRACNAOABU-FQEVSTJZSA-N 0 3 404.457 4.360 20 0 HIADHN Cc1cc(CN[C@@H]2CC(=O)N([C@@H]3C[C@H]3c3ccccc3)C2)ccc1Oc1cccnc1 ZINC000462744390 875813829 /nfs/dbraw/zinc/81/38/29/875813829.db2.gz GHXGUOVDBLJRFI-YFNKSVMNSA-N 0 3 413.521 4.429 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)CCc3cncc4ccccc43)c2)CC1 ZINC000462771617 875829937 /nfs/dbraw/zinc/82/99/37/875829937.db2.gz CIDGHMCGWOLZNM-UHFFFAOYSA-N 0 3 402.542 4.337 20 0 HIADHN COC(=O)c1cc(CN[C@@H](C)c2ccc(OC3CCCC3)c(OC)c2)n(C)c1C ZINC000462781948 875835764 /nfs/dbraw/zinc/83/57/64/875835764.db2.gz XCJOWLAZARUOCE-HNNXBMFYSA-N 0 3 400.519 4.301 20 0 HIADHN COc1ccc(F)cc1CN[C@@H]1CCN(c2ncc(C(F)(F)F)cc2Cl)C1 ZINC000462787389 875839902 /nfs/dbraw/zinc/83/99/02/875839902.db2.gz BBOMDPNBTIMRCP-CQSZACIVSA-N 0 3 403.807 4.270 20 0 HIADHN FC(F)(F)c1cc(Cl)c2nnc(CN[C@@H]3CCC[C@H]([C@@H]4CCOC4)C3)n2c1 ZINC000462791867 875843130 /nfs/dbraw/zinc/84/31/30/875843130.db2.gz SSTCJWXJCGQBLP-OUCADQQQSA-N 0 3 402.848 4.086 20 0 HIADHN Cc1nc2ccc(Br)cc2c(N[C@H]2CCc3nnc(C(C)C)n3C2)c1C ZINC000462800107 875848919 /nfs/dbraw/zinc/84/89/19/875848919.db2.gz CGJALNFTEGRIME-HNNXBMFYSA-N 0 3 414.351 4.178 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)[C@@H]1CCn2c(cnc2C2CCCCC2)C1 ZINC000462804744 875851311 /nfs/dbraw/zinc/85/13/11/875851311.db2.gz CKPAMZIWXSWMNL-CKUXNOBLSA-N 0 3 420.601 4.130 20 0 HIADHN CCc1ccc([C@H](NC[C@@](C)(OC)C2CC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000462811508 875854765 /nfs/dbraw/zinc/85/47/65/875854765.db2.gz XCSGPOLZLNTBDH-XZOQPEGZSA-N 0 3 401.572 4.147 20 0 HIADHN Cn1nc2c(c1CN[C@H](c1cccc(Br)c1)C1CCOCC1)CCCC2 ZINC000462818886 875859199 /nfs/dbraw/zinc/85/91/99/875859199.db2.gz LDTCHTATSYZILM-NRFANRHFSA-N 0 3 418.379 4.319 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](N[C@H]2CCO[C@H](C3CC3)C2)c2ccc(F)c(F)c2)c1 ZINC000462840246 875875397 /nfs/dbraw/zinc/87/53/97/875875397.db2.gz QLHSNYYHBJKSQX-HSQYWUDLSA-N 0 3 421.509 4.005 20 0 HIADHN CCc1ccccc1NC(=O)C[C@H](C)NCc1cc(Br)cc2c1OCC2 ZINC000462841683 875876612 /nfs/dbraw/zinc/87/66/12/875876612.db2.gz FALVVQXCUDMJES-AWEZNQCLSA-N 0 3 417.347 4.453 20 0 HIADHN COC(=O)c1cc(CN[C@H](c2cccc(C(F)(F)F)c2)C2CCOCC2)n(C)c1C ZINC000462910470 875935346 /nfs/dbraw/zinc/93/53/46/875935346.db2.gz RKWHKEVLJUTQBM-FQEVSTJZSA-N 0 3 424.463 4.396 20 0 HIADHN Cn1cc(CN2CCCN(Cc3ccc(C(F)(F)F)cc3)CC2)c(C(F)F)n1 ZINC000462953382 875971443 /nfs/dbraw/zinc/97/14/43/875971443.db2.gz XDXJQMNSRCLRKJ-UHFFFAOYSA-N 0 3 402.411 4.084 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N[C@@H](c1cccc(F)c1)c1ccccn1 ZINC000463014479 876032269 /nfs/dbraw/zinc/03/22/69/876032269.db2.gz WKFHBYZDLDMKCQ-QFWMQHCXSA-N 0 3 418.516 4.130 20 0 HIADHN CCCN1CCN(c2ccccc2CN[C@@H]2CCOc3c(F)ccc(F)c32)CC1 ZINC000463026476 876045934 /nfs/dbraw/zinc/04/59/34/876045934.db2.gz YOOVIWROPTYEMT-HXUWFJFHSA-N 0 3 401.501 4.110 20 0 HIADHN OC[C@@]1(c2ccccc2)CCN(Cc2cnn(-c3ccc(C(F)(F)F)cc3)c2)C1 ZINC000463045670 876072030 /nfs/dbraw/zinc/07/20/30/876072030.db2.gz XBAONRTUYAUCPU-OAQYLSRUSA-N 0 3 401.432 4.027 20 0 HIADHN c1csc(-c2noc(CCCN3CCN(C[C@@H]4C[C@H]4c4ccccc4)CC3)n2)c1 ZINC000463075323 876106424 /nfs/dbraw/zinc/10/64/24/876106424.db2.gz AXDRAFWFTRQOBM-PMACEKPBSA-N 0 3 408.571 4.152 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)c2cc(NC(=O)C(C)(C)C)ccc2F)C1 ZINC000463155844 876208255 /nfs/dbraw/zinc/20/82/55/876208255.db2.gz KJDJJCRUWYMVSX-APWZRJJASA-N 0 3 411.521 4.376 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)c2cc(NC(=O)C(C)(C)C)ccc2F)C1 ZINC000463155846 876209815 /nfs/dbraw/zinc/20/98/15/876209815.db2.gz KJDJJCRUWYMVSX-QFBILLFUSA-N 0 3 411.521 4.376 20 0 HIADHN O=C(CN1CCCC[C@@H]1[C@@H]1CCCC[C@H]1O)N[C@@H](c1cccs1)c1ccccc1 ZINC000463200221 876260736 /nfs/dbraw/zinc/26/07/36/876260736.db2.gz AWOXEZXUMKTBMP-FBHSLPMESA-N 0 3 412.599 4.359 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N(Cc1ccccc1)CC1CCOCC1 ZINC000463259813 876318067 /nfs/dbraw/zinc/31/80/67/876318067.db2.gz FHHANHCYYTYEOH-PXDATVDWSA-N 0 3 421.585 4.145 20 0 HIADHN CCCN1CCN(c2ccccc2CNc2cc(C[S@](C)=O)ccc2Cl)CC1 ZINC000463272048 876329782 /nfs/dbraw/zinc/32/97/82/876329782.db2.gz NQJILUBKVTYZKU-NDEPHWFRSA-N 0 3 420.022 4.363 20 0 HIADHN FC(F)CN1CCC(NCc2cc(Br)ccc2Br)CC1 ZINC000463276722 876332711 /nfs/dbraw/zinc/33/27/11/876332711.db2.gz ARQDIVOQUUZMHV-UHFFFAOYSA-N 0 3 412.116 4.031 20 0 HIADHN CO[C@H](CNCc1cc(Br)cc(Br)c1N)c1ccccc1 ZINC000463285414 876344728 /nfs/dbraw/zinc/34/47/28/876344728.db2.gz XKRMQWQVTPPTSK-OAHLLOKOSA-N 0 3 414.141 4.271 20 0 HIADHN CC[C@H](O[C@@H]1CCC[C@H](C)C1)C(=O)Nc1ccc(N2CCN(CC)CC2)cc1C ZINC000463429617 876483977 /nfs/dbraw/zinc/48/39/77/876483977.db2.gz JRGJERMXSRIWLZ-ZEYPLWLESA-N 0 3 401.595 4.449 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)c2cc(NC(=O)C(C)(C)C)ccc2F)N(C)C)cc1 ZINC000463434560 876491974 /nfs/dbraw/zinc/49/19/74/876491974.db2.gz NQQDYGSISYXRHL-OAQYLSRUSA-N 0 3 413.537 4.405 20 0 HIADHN Cc1cc(OC[C@H](O)CN2CC[C@@](CO)(c3ccccc3)C2)c(C(C)C)cc1Cl ZINC000463440517 876496892 /nfs/dbraw/zinc/49/68/92/876496892.db2.gz FUCDQSDSPDYSPO-HYBUGGRVSA-N 0 3 417.977 4.148 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)N1CCn2c(cc3ccccc32)C1 ZINC000463523029 876590145 /nfs/dbraw/zinc/59/01/45/876590145.db2.gz KXBALPNHFFSALQ-UHFFFAOYSA-N 0 3 420.582 4.280 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)Cc1cc(F)ccc1F ZINC000463524356 876592390 /nfs/dbraw/zinc/59/23/90/876592390.db2.gz CWNUWQOVMRZDOC-UHFFFAOYSA-N 0 3 400.391 4.117 20 0 HIADHN Cc1cc(Br)cc(C(=O)NC2CCN([C@H](C)c3ccncc3)CC2)c1 ZINC000463579968 876677681 /nfs/dbraw/zinc/67/76/81/876677681.db2.gz UTGZJNOYQNMSIZ-OAHLLOKOSA-N 0 3 402.336 4.108 20 0 HIADHN C[C@H]1CCN(C(=O)N[C@@H]2CCOc3c(F)ccc(F)c32)CCN1Cc1ccccc1 ZINC000463614970 876734902 /nfs/dbraw/zinc/73/49/02/876734902.db2.gz UYXVTLKDJHMRNX-OXJNMPFZSA-N 0 3 415.484 4.094 20 0 HIADHN Cc1cc(F)ccc1-c1nc(C(C)(C)C(=O)N(C)[C@@H]2CCN(C3CC3)C2)cs1 ZINC000463776615 876896501 /nfs/dbraw/zinc/89/65/01/876896501.db2.gz QNUNYFMONHRXLL-QGZVFWFLSA-N 0 3 401.551 4.230 20 0 HIADHN O=C(CCCc1ccccc1Cl)Nc1ccc(C(=O)NCCN2CCCC2)cc1 ZINC000463822264 876935444 /nfs/dbraw/zinc/93/54/44/876935444.db2.gz VSAFVNOEVSCIPG-UHFFFAOYSA-N 0 3 413.949 4.127 20 0 HIADHN Cc1cc(N2CC[C@@H](N[C@@H](Cc3ccc(Cl)cc3)c3ccccc3)C2=O)n(C)n1 ZINC000463885293 877006129 /nfs/dbraw/zinc/00/61/29/877006129.db2.gz AHOWEZKZFYRYDN-RTWAWAEBSA-N 0 3 408.933 4.061 20 0 HIADHN Cc1cc(N2CC[C@H](N[C@@H](Cc3ccccc3Cl)c3ccccc3)C2=O)n(C)n1 ZINC000463906921 877029425 /nfs/dbraw/zinc/02/94/25/877029425.db2.gz VENHZXGPZYRYEI-SFTDATJTSA-N 0 3 408.933 4.061 20 0 HIADHN C[C@H](CNC(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1)Oc1ccccc1F ZINC000463929485 877049565 /nfs/dbraw/zinc/04/95/65/877049565.db2.gz VUKGLXMXADUKSK-IERDGZPVSA-N 0 3 424.438 4.164 20 0 HIADHN COc1ccc([C@@H](CNC(=O)N[C@@H](c2nc(C)cs2)C2CC2)N2CCCC2)cc1 ZINC000463956016 877078215 /nfs/dbraw/zinc/07/82/15/877078215.db2.gz SSWKZWSJKCNEBN-WOJBJXKFSA-N 0 3 414.575 4.048 20 0 HIADHN COc1ccccc1[C@H](NC(=O)NCCN1CCCCC1)c1ccccc1Cl ZINC000463957038 877079603 /nfs/dbraw/zinc/07/96/03/877079603.db2.gz ARHRDDXFPJFCTB-OAQYLSRUSA-N 0 3 401.938 4.223 20 0 HIADHN O=C(NCCCN(Cc1ccccc1)Cc1ccccc1)[C@H]1CCC(=O)c2cccn21 ZINC000469027152 883094531 /nfs/dbraw/zinc/09/45/31/883094531.db2.gz NMVXZZFSPGERNP-XMMPIXPASA-N 0 3 415.537 4.214 20 0 HIADHN COc1ccc([C@@H](CNC(=O)NC[C@@H](C)Cc2cccs2)N2CCCC2)cc1 ZINC000463967584 877093058 /nfs/dbraw/zinc/09/30/58/877093058.db2.gz XFSGNSXXVOYPRR-LAUBAEHRSA-N 0 3 401.576 4.072 20 0 HIADHN Cc1c(C(=O)N(C)[C@H]2CCCN(C)C2)c2cc(Br)ccc2nc1C1CC1 ZINC000464056360 877200776 /nfs/dbraw/zinc/20/07/76/877200776.db2.gz YATHSDOQTXOWME-INIZCTEOSA-N 0 3 416.363 4.349 20 0 HIADHN Cc1cc(N2CCC[C@@H](N[C@H](C)c3cccc(CO)c3)C2=O)ccc1Br ZINC000464076046 877224880 /nfs/dbraw/zinc/22/48/80/877224880.db2.gz XXQZSFFCPGOHDP-FOIQADDNSA-N 0 3 417.347 4.096 20 0 HIADHN Cc1cc(N2CCC[C@@H](N[C@@H](C)c3cccc(CO)c3)C2=O)ccc1Br ZINC000464076047 877225667 /nfs/dbraw/zinc/22/56/67/877225667.db2.gz XXQZSFFCPGOHDP-MGPUTAFESA-N 0 3 417.347 4.096 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@H](C)c1cn(C(C)(C)C)nc1C)c1ccsc1 ZINC000464136537 877298923 /nfs/dbraw/zinc/29/89/23/877298923.db2.gz BNMLDSLDFONCRL-DNVCBOLYSA-N 0 3 405.612 4.451 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)c1ccoc1C(F)(F)F ZINC000464203705 877374478 /nfs/dbraw/zinc/37/44/78/877374478.db2.gz ILKJYGJANOJHRJ-OAHLLOKOSA-N 0 3 404.392 4.194 20 0 HIADHN C[C@@H]1C[C@H](c2ccccc2F)N(C(=O)CCCN2CCN(c3ccccc3)CC2)C1 ZINC000464229729 877405811 /nfs/dbraw/zinc/40/58/11/877405811.db2.gz FHCCXHMFOIGSIX-HYBUGGRVSA-N 0 3 409.549 4.338 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)Nc1cccc(CC(F)(F)F)c1 ZINC000464424418 877634861 /nfs/dbraw/zinc/63/48/61/877634861.db2.gz HACDIZYDOONILI-UHFFFAOYSA-N 0 3 405.464 4.332 20 0 HIADHN CC(C)CN(C(=O)Cc1cc(Cl)ccc1Br)C1CCN(C)CC1 ZINC000464573013 877795679 /nfs/dbraw/zinc/79/56/79/877795679.db2.gz WNBLYWYXHSFIET-UHFFFAOYSA-N 0 3 401.776 4.224 20 0 HIADHN Cc1nn(C(C)(C)C)cc1[C@@H](C)NC[C@H](O)COc1cc(Cl)ccc1Cl ZINC000464632555 877850393 /nfs/dbraw/zinc/85/03/93/877850393.db2.gz XWFMSVNOLCWGNE-DOMZBBRYSA-N 0 3 400.350 4.344 20 0 HIADHN O=C(Cc1cccc(F)c1)c1cc(Cl)cnc1NC(=O)C1CCN(C2CC2)CC1 ZINC000464711619 877936077 /nfs/dbraw/zinc/93/60/77/877936077.db2.gz UTXPTWLPIJRQQF-UHFFFAOYSA-N 0 3 415.896 4.112 20 0 HIADHN CCC[C@@H]1[C@@H](C)CCCN1CC(=O)N(C)CC(=O)Nc1ccccc1C(F)(F)F ZINC000464731993 877967740 /nfs/dbraw/zinc/96/77/40/877967740.db2.gz HXAVICLBWRXQKL-MAUKXSAKSA-N 0 3 413.484 4.003 20 0 HIADHN CCS[C@H]1CC[C@@H](N(C)CC(=O)N(C)Cc2ccc3cc(OC)ccc3c2)C1 ZINC000464768929 878010284 /nfs/dbraw/zinc/01/02/84/878010284.db2.gz COKJSCPKURELBB-IRLDBZIGSA-N 0 3 400.588 4.413 20 0 HIADHN CCS[C@H]1CC[C@H](N(C)CC(=O)N(C)Cc2ccc3cc(OC)ccc3c2)C1 ZINC000464768931 878011981 /nfs/dbraw/zinc/01/19/81/878011981.db2.gz COKJSCPKURELBB-UNMCSNQZSA-N 0 3 400.588 4.413 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@@H](C)N2CC[C@H](CSc3ccccc3)C2)cc1F ZINC000464773396 878016423 /nfs/dbraw/zinc/01/64/23/878016423.db2.gz NJJJBKGJQYYXDK-MJGOQNOKSA-N 0 3 416.562 4.295 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@H](C)N2CC[C@H](CSc3ccccc3)C2)cc1F ZINC000464773390 878017587 /nfs/dbraw/zinc/01/75/87/878017587.db2.gz NJJJBKGJQYYXDK-HKUYNNGSSA-N 0 3 416.562 4.295 20 0 HIADHN CCc1ccc([C@@H]2C[C@H](C)CCN2C[C@@H](O)COc2c(OC)cccc2OC)o1 ZINC000464846644 878120723 /nfs/dbraw/zinc/12/07/23/878120723.db2.gz SENMVCFEIAZPEK-LMMKCTJWSA-N 0 3 403.519 4.072 20 0 HIADHN CC[C@@H]1c2ccsc2CCN1C(=O)CN1CC[C@H](C)N(Cc2ccccc2)CC1 ZINC000464849437 878124733 /nfs/dbraw/zinc/12/47/33/878124733.db2.gz ZERSHLBDXROLMI-SIKLNZKXSA-N 0 3 411.615 4.180 20 0 HIADHN CCN(Cc1ccc(OCc2ccccc2)cc1)C(=O)CN1CCC[C@H]2COCC[C@H]21 ZINC000464851553 878130733 /nfs/dbraw/zinc/13/07/33/878130733.db2.gz PRMDJVRPJNLDLQ-UKILVPOCSA-N 0 3 422.569 4.115 20 0 HIADHN C[C@H]1CCN(C(=O)Cc2coc(-c3ccc(F)cc3)n2)CCN1Cc1ccccc1 ZINC000464884527 878180061 /nfs/dbraw/zinc/18/00/61/878180061.db2.gz IGTMLTHUORRDQJ-SFHVURJKSA-N 0 3 407.489 4.146 20 0 HIADHN CC(=O)CCc1ccc(O[C@H](C)C(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)cc1 ZINC000464890062 878189497 /nfs/dbraw/zinc/18/94/97/878189497.db2.gz GYPMLWSWJHOCHA-RBBKRZOGSA-N 0 3 422.569 4.099 20 0 HIADHN C[C@H]1CCN(C(=O)c2cnn(-c3ccccc3)c2C2CC2)CCN1Cc1ccccc1 ZINC000464889511 878189546 /nfs/dbraw/zinc/18/95/46/878189546.db2.gz GKHDGUUTBLHINK-FQEVSTJZSA-N 0 3 414.553 4.486 20 0 HIADHN COc1ccc(OC)c(NC(=O)CN(CCc2cccc(F)c2)C2CCCC2)c1 ZINC000464893156 878196781 /nfs/dbraw/zinc/19/67/81/878196781.db2.gz IWAZNQCOGUOWCT-UHFFFAOYSA-N 0 3 400.494 4.269 20 0 HIADHN Cc1nn(CC(C)C)c(C)c1CCC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1 ZINC000464894542 878198415 /nfs/dbraw/zinc/19/84/15/878198415.db2.gz LSHAARQOQLKFPO-FQEVSTJZSA-N 0 3 410.606 4.212 20 0 HIADHN C[C@@H]1CCN(C(=O)CCOc2ccc(F)cc2Cl)CCN1Cc1ccccc1 ZINC000464900755 878210189 /nfs/dbraw/zinc/21/01/89/878210189.db2.gz NBNSMUYQUXGSOF-QGZVFWFLSA-N 0 3 404.913 4.371 20 0 HIADHN Cc1c(C(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)cnn1-c1cccc(C)c1 ZINC000464906398 878220838 /nfs/dbraw/zinc/22/08/38/878220838.db2.gz NBVOMTZBVWPIMZ-FQEVSTJZSA-N 0 3 402.542 4.226 20 0 HIADHN C/C=C\c1ccc(OCC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)c(OC)c1 ZINC000464909493 878225317 /nfs/dbraw/zinc/22/53/17/878225317.db2.gz LRYOBVFNKZDJCX-HOKKKISVSA-N 0 3 408.542 4.230 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Cc1c[nH]c2ncccc12)c1ccc(C(F)(F)F)cc1 ZINC000464921704 878245066 /nfs/dbraw/zinc/24/50/66/878245066.db2.gz OCPWGEUBYUKWDJ-IBGZPJMESA-N 0 3 418.463 4.324 20 0 HIADHN C[C@@H]1CCN(C(=O)NC[C@@H](c2ccco2)N2CCCCC2)CCN1Cc1ccccc1 ZINC000465398073 878835086 /nfs/dbraw/zinc/83/50/86/878835086.db2.gz AZVYXGZTMBZECG-GGAORHGYSA-N 0 3 424.589 4.113 20 0 HIADHN CO[C@]1(C)C[C@H](N[C@@H](C)C(=O)Nc2cccc(CSc3ccccn3)c2)C1(C)C ZINC000465405456 878841399 /nfs/dbraw/zinc/84/13/99/878841399.db2.gz JIICHGODKPDCJM-BTCOZLQPSA-N 0 3 413.587 4.494 20 0 HIADHN CC1CCN([C@H](CNC(=O)N[C@@H]2[C@@H]3CCCO[C@H]3C2(C)C)c2cccs2)CC1 ZINC000465424368 878854137 /nfs/dbraw/zinc/85/41/37/878854137.db2.gz OYDQQBZDBGSDEP-ONCXSQPRSA-N 0 3 405.608 4.024 20 0 HIADHN C[C@H](NC(=O)NC[C@H](c1ccccc1)N1CCCC1)c1nc(-c2cccc(F)c2)no1 ZINC000465426664 878856046 /nfs/dbraw/zinc/85/60/46/878856046.db2.gz HPRCMBONDWXQGO-OXJNMPFZSA-N 0 3 423.492 4.073 20 0 HIADHN C[C@@H](NC(=O)NC[C@H](c1ccccc1)N1CCCC1)c1ccc(-n2cccn2)cc1 ZINC000465433027 878864650 /nfs/dbraw/zinc/86/46/50/878864650.db2.gz ZWHXYAFTTQRBRC-AUSIDOKSSA-N 0 3 403.530 4.070 20 0 HIADHN CC[C@H](NC(=O)NC[C@H](Cc1ccccc1)N(C)C)c1nc(C(F)(F)F)cs1 ZINC000465440346 878871190 /nfs/dbraw/zinc/87/11/90/878871190.db2.gz ZWVVBBPSIIOMPY-GJZGRUSLSA-N 0 3 414.497 4.085 20 0 HIADHN CO[C@H](CNC(=O)NC[C@@H](c1ccccc1)N1CCCC1)c1ccc(Cl)cc1 ZINC000465439375 878871376 /nfs/dbraw/zinc/87/13/76/878871376.db2.gz FUHZEFZSKKYQAL-LEWJYISDSA-N 0 3 401.938 4.164 20 0 HIADHN CO[C@H](CNC(=O)NC[C@H](c1cccs1)N1CCCC1)c1ccc(Cl)cc1 ZINC000465440031 878871429 /nfs/dbraw/zinc/87/14/29/878871429.db2.gz ZJRZFBLPOQQRID-QZTJIDSGSA-N 0 3 407.967 4.225 20 0 HIADHN CC[C@H](NC(=O)NC[C@@H](Cc1ccccc1)N(C)C)c1nc(C(F)(F)F)cs1 ZINC000465440344 878871747 /nfs/dbraw/zinc/87/17/47/878871747.db2.gz ZWVVBBPSIIOMPY-CABCVRRESA-N 0 3 414.497 4.085 20 0 HIADHN Cc1ccccc1[C@@H]1CN(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)[C@@H](C)CO1 ZINC000465446345 878877490 /nfs/dbraw/zinc/87/74/90/878877490.db2.gz VYRMQLKFUNPQDU-OYDLWJJNSA-N 0 3 407.558 4.304 20 0 HIADHN Cc1ccc(CCN(C[C@H]2CCCO2)C(=O)NC[C@H](c2ccccc2)N(C)C)cc1 ZINC000465454148 878885461 /nfs/dbraw/zinc/88/54/61/878885461.db2.gz LYTCAXXKKXUOTK-DNQXCXABSA-N 0 3 409.574 4.031 20 0 HIADHN COc1cccc([C@@H](CNC(=O)N[C@@H](c2nc(C)cs2)C2CC2)N2CCCC2)c1 ZINC000465464583 878898026 /nfs/dbraw/zinc/89/80/26/878898026.db2.gz DJGVSNYHDHHIDJ-WOJBJXKFSA-N 0 3 414.575 4.048 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@@H]2CNC(=O)NCCCN2CCc3ccccc3C2)cc1 ZINC000465535226 878994501 /nfs/dbraw/zinc/99/45/01/878994501.db2.gz XBFVECNSBQHNLM-NOZRDPDXSA-N 0 3 421.585 4.210 20 0 HIADHN CC[C@@H](CNC(=O)N1CC[C@H](COCc2ccccc2)C1)N1CCc2ccccc2C1 ZINC000465537019 878996786 /nfs/dbraw/zinc/99/67/86/878996786.db2.gz GEGBEDICCGTBDA-DHLKQENFSA-N 0 3 421.585 4.072 20 0 HIADHN Cc1ccc([C@H]2C[C@H](C)CCN2C(=O)NCc2ccc(CN3CCN(C)CC3)cc2)o1 ZINC000465558170 879026271 /nfs/dbraw/zinc/02/62/71/879026271.db2.gz NAOKWVPDPQVIBS-AUSIDOKSSA-N 0 3 424.589 4.018 20 0 HIADHN COCCN1CCC(NC(=O)N(Cc2cccc3ccccc32)C2CCCC2)CC1 ZINC000465731999 879313549 /nfs/dbraw/zinc/31/35/49/879313549.db2.gz ZFAQQTHAOUWOKS-UHFFFAOYSA-N 0 3 409.574 4.405 20 0 HIADHN C[C@H]1CCN(C(=O)N[C@@H]2CCCOc3ccc(F)cc32)CCN1Cc1ccccc1 ZINC000465760022 879354902 /nfs/dbraw/zinc/35/49/02/879354902.db2.gz QLOJRHFFLRMCHD-PGRDOPGGSA-N 0 3 411.521 4.345 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N[C@@H](C)c2ccc(-n3cccn3)cc2)C1 ZINC000465767189 879364803 /nfs/dbraw/zinc/36/48/03/879364803.db2.gz YWDIVGJZDZAFLQ-NNMXDRDESA-N 0 3 403.530 4.068 20 0 HIADHN COc1ccc(CC[C@H](C)NC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)cc1 ZINC000465818351 879442695 /nfs/dbraw/zinc/44/26/95/879442695.db2.gz PVBBHNIYWJPBFZ-LEWJYISDSA-N 0 3 409.574 4.322 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)N[C@H](C)c2ccc(Oc3ccccc3)cc2)CC1 ZINC000465823456 879452390 /nfs/dbraw/zinc/45/23/90/879452390.db2.gz WHJUYPJBPZAWCT-LEWJYISDSA-N 0 3 424.589 4.113 20 0 HIADHN CC(C)[C@@H](NC(=O)N(CCN(C)C)C[C@@H]1CCCO1)c1cccc(C(F)(F)F)c1 ZINC000465830189 879463159 /nfs/dbraw/zinc/46/31/59/879463159.db2.gz HRTKUVKNRDRMDD-RBUKOAKNSA-N 0 3 415.500 4.155 20 0 HIADHN CC(C)c1nc(CCNC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)cs1 ZINC000465849520 879491768 /nfs/dbraw/zinc/49/17/68/879491768.db2.gz ZKRIWMUALWEFGU-GOSISDBHSA-N 0 3 400.592 4.115 20 0 HIADHN C[C@@H]1CCN(C(=O)NCc2ccc(Br)cc2)CCN1Cc1ccccc1 ZINC000465861297 879509886 /nfs/dbraw/zinc/50/98/86/879509886.db2.gz GXXDJYKJDHLJLZ-QGZVFWFLSA-N 0 3 416.363 4.255 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@@H]2CNC(=O)NC[C@H](C)N(C)Cc2ccccc2)cc1 ZINC000465894185 879551103 /nfs/dbraw/zinc/55/11/03/879551103.db2.gz UIHFGHMUBKRKTR-ZTCOLXNVSA-N 0 3 409.574 4.282 20 0 HIADHN Cc1ccc(-c2nc(CNC(=O)NC[C@@H]3CCCN3Cc3ccccc3)co2)cc1 ZINC000465931637 879595150 /nfs/dbraw/zinc/59/51/50/879595150.db2.gz JSOSGHLRGWTUHM-QFIPXVFZSA-N 0 3 404.514 4.114 20 0 HIADHN O=C(N[C@H]1CCN(C2CC2)C1)N(Cc1ccccc1OC(F)(F)F)C1CCCC1 ZINC000466022768 879709939 /nfs/dbraw/zinc/70/99/39/879709939.db2.gz OQNGXTMZMVETKF-INIZCTEOSA-N 0 3 411.468 4.276 20 0 HIADHN CSc1cccc([C@H](NC(=O)N[C@@H]2CCN(C3CC3)C2)c2cc(F)ccc2F)c1 ZINC000466026328 879713100 /nfs/dbraw/zinc/71/31/00/879713100.db2.gz OAXADTOSXHZIMK-IERDGZPVSA-N 0 3 417.525 4.312 20 0 HIADHN COc1ccc([C@H](C)CCNC(=O)N(CCN(C)C)Cc2cccc(F)c2)cc1 ZINC000466042863 879731579 /nfs/dbraw/zinc/73/15/79/879731579.db2.gz YKSNZOMWXPUQRR-GOSISDBHSA-N 0 3 401.526 4.101 20 0 HIADHN COc1ccccc1[C@]1(C)C[C@H]1NC(=O)N(CCN(C)C)Cc1cccc(Cl)c1 ZINC000466047653 879736540 /nfs/dbraw/zinc/73/65/40/879736540.db2.gz GXAZRXJJEAIJMV-GGAORHGYSA-N 0 3 415.965 4.152 20 0 HIADHN CC[C@H](C)[C@@H](NC(=O)NC[C@H](C)CN1CCN(CC)CC1)c1ccc(Cl)cc1 ZINC000466085597 879804600 /nfs/dbraw/zinc/80/46/00/879804600.db2.gz MZAKKTGXUNPCHF-BBTUJRGHSA-N 0 3 409.018 4.000 20 0 HIADHN COc1ccccc1[C@@H](NC(=O)N(C)[C@@H]1CCN(C2CC2)C1)c1ccccc1Cl ZINC000466095468 879814102 /nfs/dbraw/zinc/81/41/02/879814102.db2.gz FGXSHLTYXIWZGE-VGSWGCGISA-N 0 3 413.949 4.316 20 0 HIADHN CCCN(C(=O)N[C@@H]1[C@@H]2CCCO[C@@H]2C1(C)C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000466133261 879845736 /nfs/dbraw/zinc/84/57/36/879845736.db2.gz FCYBYCKZAJUNMS-GPJHCHHRSA-N 0 3 413.606 4.276 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NC[C@@H](C)Cc3cccs3)c(C)c2)CC1 ZINC000466139190 879849722 /nfs/dbraw/zinc/84/97/22/879849722.db2.gz ULAODFVQCDYRRH-KRWDZBQOSA-N 0 3 400.592 4.199 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)N[C@@H](c2ccccc2)c2ccccn2)CN1Cc1ccccc1 ZINC000466140082 879849822 /nfs/dbraw/zinc/84/98/22/879849822.db2.gz FRKRSWDEVBBBTF-CKUXNOBLSA-N 0 3 400.526 4.133 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)N2CCC[C@H]2c2ccc(C(C)(C)C)cc2)CC1 ZINC000466146051 879854909 /nfs/dbraw/zinc/85/49/09/879854909.db2.gz ZYVCEGRDMCNTLI-OFNKIYASSA-N 0 3 414.638 4.104 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)N2CCC[C@H]2c2ccc(C(C)(C)C)cc2)CC1 ZINC000466146052 879855132 /nfs/dbraw/zinc/85/51/32/879855132.db2.gz ZYVCEGRDMCNTLI-REWPJTCUSA-N 0 3 414.638 4.104 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NC[C@H](C)Oc3ccc(C)cc3)c(C)c2)CC1 ZINC000466163252 879866062 /nfs/dbraw/zinc/86/60/62/879866062.db2.gz JOAXTIIJSZIPOQ-FQEVSTJZSA-N 0 3 410.562 4.034 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NC[C@H](C)Oc3ccccc3C)c(C)c2)CC1 ZINC000466171868 879873174 /nfs/dbraw/zinc/87/31/74/879873174.db2.gz JMLHKNFVOXFBPB-FQEVSTJZSA-N 0 3 410.562 4.034 20 0 HIADHN C[C@H](CNC(=O)N(Cc1ccco1)C1CCN(C)CC1)Oc1ccccc1Cl ZINC000466178624 879877097 /nfs/dbraw/zinc/87/70/97/879877097.db2.gz QGBOSGWKSUNYDA-MRXNPFEDSA-N 0 3 405.926 4.006 20 0 HIADHN Cc1ccccc1C1(CNC(=O)N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)CCOCC1 ZINC000466225314 879924484 /nfs/dbraw/zinc/92/44/84/879924484.db2.gz KZZKTEDMCITAGB-FYYLOGMGSA-N 0 3 421.585 4.005 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccc(O)cc1)C(=O)c1oc(-c2ccccc2)nc1C ZINC000503475021 912514426 /nfs/dbraw/zinc/51/44/26/912514426.db2.gz YSOHDKOVHKMZPM-OAQYLSRUSA-N 0 3 419.525 4.482 20 0 HIADHN CO[C@@H](CNC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C)c1cccc(Cl)c1 ZINC000466343845 880101565 /nfs/dbraw/zinc/10/15/65/880101565.db2.gz PSKNVVLDALMJIF-GCJKJVERSA-N 0 3 415.965 4.334 20 0 HIADHN CN1CCCC(C)(C)[C@@H]1CNC(=O)c1c(Br)cccc1Br ZINC000466353464 880110860 /nfs/dbraw/zinc/11/08/60/880110860.db2.gz TYZUNJIBQBNVAH-ZDUSSCGKSA-N 0 3 418.173 4.062 20 0 HIADHN Cc1cc(CNCc2cccc(OC(F)F)c2)ccc1I ZINC000466364619 880121647 /nfs/dbraw/zinc/12/16/47/880121647.db2.gz MRAJYRVYTYJTON-UHFFFAOYSA-N 0 3 403.210 4.491 20 0 HIADHN COc1ccc([C@@H](NC(=O)N2CCN(C)CC[C@@H]2C)c2ccccc2Cl)c(C)c1 ZINC000466385236 880144634 /nfs/dbraw/zinc/14/46/34/880144634.db2.gz BWUYWFBFFVCRGI-HTAPYJJXSA-N 0 3 415.965 4.482 20 0 HIADHN C[C@H](CCNC(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1)c1ccccc1 ZINC000466389846 880150125 /nfs/dbraw/zinc/15/01/25/880150125.db2.gz RSLDMWXLWOLBJV-NJDAHSKKSA-N 0 3 401.595 4.101 20 0 HIADHN COc1ccc([C@@H](CNC(=O)Nc2ccc(NC(=O)C3CC3)cc2)N2CCCC2)cc1 ZINC000503492838 912540778 /nfs/dbraw/zinc/54/07/78/912540778.db2.gz JOLWVGIQKWSZKL-JOCHJYFZSA-N 0 3 422.529 4.002 20 0 HIADHN COc1ccc([C@@H](CNC(=O)Nc2cccc(NC(=O)C(C)C)c2)N2CCCC2)cc1 ZINC000503498989 912546418 /nfs/dbraw/zinc/54/64/18/912546418.db2.gz PWSMSWIMZWHLGY-JOCHJYFZSA-N 0 3 424.545 4.248 20 0 HIADHN C[C@H](C(=O)Nc1cccc(CSc2ccccn2)c1)N(C)CCC1CCOCC1 ZINC000466490288 880268933 /nfs/dbraw/zinc/26/89/33/880268933.db2.gz JYEXXPWUATUGEP-GOSISDBHSA-N 0 3 413.587 4.449 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)Nc2ccc(OC[C@@H]3CCCO3)cc2)CN1Cc1ccccc1 ZINC000466514317 880287267 /nfs/dbraw/zinc/28/72/67/880287267.db2.gz KXSFVRZVDDGNHO-JZWVFAODSA-N 0 3 409.530 4.029 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)Nc2cccc(OC[C@@H]3CCCO3)c2)CN1Cc1ccccc1 ZINC000466515625 880288995 /nfs/dbraw/zinc/28/89/95/880288995.db2.gz BZZNXLRUSXYUNC-JZWVFAODSA-N 0 3 409.530 4.029 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)Nc2cc3c(cc2Cl)OCCCO3)CN1Cc1ccccc1 ZINC000466514363 880289782 /nfs/dbraw/zinc/28/97/82/880289782.db2.gz LHPREAHBQVJFGB-NVXWUHKLSA-N 0 3 415.921 4.286 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)cc1OC ZINC000466517005 880291255 /nfs/dbraw/zinc/29/12/55/880291255.db2.gz TYRFQJYAJIPLKZ-BWAGFHJFSA-N 0 3 423.557 4.213 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)NCc2csc(-c3ccccc3)n2)CN1Cc1ccccc1 ZINC000466517222 880291865 /nfs/dbraw/zinc/29/18/65/880291865.db2.gz ISBFZBPCLXTJAM-FXAWDEMLSA-N 0 3 406.555 4.272 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)Nc2ccc(C(=O)NC3CCCC3)cc2)CN1Cc1ccccc1 ZINC000466518176 880293731 /nfs/dbraw/zinc/29/37/31/880293731.db2.gz LSIYTWNERYLCNT-FDDCHVKYSA-N 0 3 420.557 4.144 20 0 HIADHN C[C@H]1C[C@H](NC(=O)N2CCC(c3c[nH]c4ncccc34)CC2)CN1Cc1ccccc1 ZINC000466523153 880299495 /nfs/dbraw/zinc/29/94/95/880299495.db2.gz UFVVJMXRWNTDEG-RXVVDRJESA-N 0 3 417.557 4.115 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)N2CCC(C(F)(F)F)(C(F)(F)F)C2)CN1Cc1ccccc1 ZINC000466528997 880305323 /nfs/dbraw/zinc/30/53/23/880305323.db2.gz IZPZCMSABJNDGY-DZGCQCFKSA-N 0 3 423.401 4.176 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)N2CCC(Nc3ccc(F)cc3)CC2)CN1Cc1ccccc1 ZINC000466534033 880308482 /nfs/dbraw/zinc/30/84/82/880308482.db2.gz MDQQJHIKRQALEG-JPYJTQIMSA-N 0 3 410.537 4.075 20 0 HIADHN COCc1ccc([C@H]2CCCN2C(=O)NCC(C)(C)N2CCc3ccccc3C2)o1 ZINC000466563264 880337234 /nfs/dbraw/zinc/33/72/34/880337234.db2.gz CTTFNUGYMSOYPV-OAQYLSRUSA-N 0 3 411.546 4.109 20 0 HIADHN CC[C@@H](CNC(=O)N1CCC[C@H]1c1ccc(COC)o1)N1CCc2ccccc2C1 ZINC000466564012 880338900 /nfs/dbraw/zinc/33/89/00/880338900.db2.gz QEHXTWIKIGBAIX-UNMCSNQZSA-N 0 3 411.546 4.109 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)N[C@H]1CCCc2sccc21 ZINC000466567442 880343673 /nfs/dbraw/zinc/34/36/73/880343673.db2.gz QQFRJYCUKLJLKK-NRFANRHFSA-N 0 3 412.603 4.027 20 0 HIADHN CCc1c(NC(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)cnn1-c1ccccc1 ZINC000466664762 880446445 /nfs/dbraw/zinc/44/64/45/880446445.db2.gz LYEFTZWTEZCQDE-AVRDEDQJSA-N 0 3 403.530 4.077 20 0 HIADHN O=C(CC1CCCC1)NC1CCN(CCOc2ccc(OC(F)(F)F)cc2)CC1 ZINC000466728718 880513867 /nfs/dbraw/zinc/51/38/67/880513867.db2.gz VVOOPXIJGZIUPB-UHFFFAOYSA-N 0 3 414.468 4.125 20 0 HIADHN COc1cc(CNCc2cccc3cc[nH]c32)cc(I)c1OC ZINC000466889976 880657326 /nfs/dbraw/zinc/65/73/26/880657326.db2.gz FWONIEGURUAHDL-UHFFFAOYSA-N 0 3 422.266 4.080 20 0 HIADHN CC(C)(C)c1nn(Cc2ccccc2)cc1CNCCN1CCc2ccccc2C1=O ZINC000466914109 880680842 /nfs/dbraw/zinc/68/08/42/880680842.db2.gz XXZIHCKBVWIVFQ-UHFFFAOYSA-N 0 3 416.569 4.017 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)c2ccc3c(c2)nc(C(F)F)n3C)N(C)C)cc1 ZINC000466986894 880799355 /nfs/dbraw/zinc/79/93/55/880799355.db2.gz IEGOSNJONJOMCU-LJQANCHMSA-N 0 3 400.473 4.106 20 0 HIADHN COc1ccc(C)cc1NC(=O)[C@H](NC[C@@]1(C)CCO[C@H]1C1CC1)c1ccccc1 ZINC000467001884 880811124 /nfs/dbraw/zinc/81/11/24/880811124.db2.gz NIJSWCXWGVPVMK-GIFXNVAJSA-N 0 3 408.542 4.478 20 0 HIADHN COc1ccc(C)cc1NC(=O)[C@H](NC[C@]1(C)CCO[C@H]1C1CC1)c1ccccc1 ZINC000467001883 880811143 /nfs/dbraw/zinc/81/11/43/880811143.db2.gz NIJSWCXWGVPVMK-CUYJMHBOSA-N 0 3 408.542 4.478 20 0 HIADHN COCc1ccc([C@@H]2CCCN2CCC(=O)Nc2c(C)nn(-c3ccccc3)c2C)o1 ZINC000467018322 880820938 /nfs/dbraw/zinc/82/09/38/880820938.db2.gz HOXWOOGQCCIWBZ-NRFANRHFSA-N 0 3 422.529 4.394 20 0 HIADHN C[C@H]1C[C@H](NC(=O)C2(c3cccc(Cl)c3)CCOCC2)CN1Cc1ccccc1 ZINC000467029351 880828627 /nfs/dbraw/zinc/82/86/27/880828627.db2.gz SSFYPZISPXIIRZ-AVRDEDQJSA-N 0 3 412.961 4.167 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)CCc2ncc(-c3ccccc3F)o2)CN1Cc1ccccc1 ZINC000467035731 880833567 /nfs/dbraw/zinc/83/35/67/880833567.db2.gz RUJVNALKJPHSCQ-MJGOQNOKSA-N 0 3 407.489 4.193 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)N[C@@H](C)c2ccc(Br)cc2)cc1 ZINC000503547593 912612020 /nfs/dbraw/zinc/61/20/20/912612020.db2.gz YBXUUHHCZBRNDF-LIRRHRJNSA-N 0 3 420.351 4.121 20 0 HIADHN COc1ccc(-c2cnc(CCC(=O)N[C@@H]3C[C@@H](C)N(Cc4ccccc4)C3)o2)cc1 ZINC000467053396 880843341 /nfs/dbraw/zinc/84/33/41/880843341.db2.gz IGLGPVAQEDZGDM-WIYYLYMNSA-N 0 3 419.525 4.062 20 0 HIADHN CCS[C@H]1CC[C@H](N(C)C(=O)Nc2ccc(CCN3CCSCC3)cc2)C1 ZINC000467105694 880865809 /nfs/dbraw/zinc/86/58/09/880865809.db2.gz GJAUZWWNRKWZOE-PMACEKPBSA-N 0 3 407.649 4.416 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)[C@@H]1CCCc2n[nH]cc21)c1ccc(C(F)(F)F)cc1 ZINC000467107643 880866538 /nfs/dbraw/zinc/86/65/38/880866538.db2.gz SNGUMJLNYVHDLR-APWZRJJASA-N 0 3 408.468 4.048 20 0 HIADHN Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)N[C@@H]1C[C@@H](C)N(Cc2ccccc2)C1 ZINC000467107348 880866698 /nfs/dbraw/zinc/86/66/98/880866698.db2.gz PPQSHKIGIRBOIS-DENIHFKCSA-N 0 3 422.573 4.165 20 0 HIADHN C[C@@H](C(=O)N(C)C1CCN(CCc2ccccn2)CC1)c1ccc(C(F)(F)F)cc1 ZINC000467177627 880906913 /nfs/dbraw/zinc/90/69/13/880906913.db2.gz WCPXMEJWVHTHFZ-QGZVFWFLSA-N 0 3 419.491 4.369 20 0 HIADHN COC(=O)COc1ccc([C@@H](C)N[C@@H](C)C(=O)Nc2c(C)cccc2C(C)C)cc1 ZINC000467179753 880907746 /nfs/dbraw/zinc/90/77/46/880907746.db2.gz IXJDICZMBJNSKZ-MSOLQXFVSA-N 0 3 412.530 4.348 20 0 HIADHN COc1cc2nc(CNC3(Cc4ccccc4)CCCCC3)[nH]c(=O)c2cc1OC ZINC000467196374 880924820 /nfs/dbraw/zinc/92/48/20/880924820.db2.gz QEEZUBQMMMPMMX-UHFFFAOYSA-N 0 3 407.514 4.388 20 0 HIADHN COCC[C@@H]1CCCCN(CC(=O)NCc2ccc(COc3ccccc3)cc2)C1 ZINC000467264281 881001026 /nfs/dbraw/zinc/00/10/26/881001026.db2.gz LBRYLMVANICWMA-QFIPXVFZSA-N 0 3 410.558 4.020 20 0 HIADHN C[C@H](NC(=O)NCc1nc(-c2ccccc2F)cs1)[C@H](c1ccccc1)N(C)C ZINC000503558623 912631025 /nfs/dbraw/zinc/63/10/25/912631025.db2.gz VLKZQPOASRASEN-YCRPNKLZSA-N 0 3 412.534 4.440 20 0 HIADHN C[C@@H](NC(=O)NCc1nc(-c2ccccc2F)cs1)[C@H](c1ccccc1)N(C)C ZINC000503558621 912631881 /nfs/dbraw/zinc/63/18/81/912631881.db2.gz VLKZQPOASRASEN-QVKFZJNVSA-N 0 3 412.534 4.440 20 0 HIADHN CC(C)C[C@H](N[C@@H](C)Cc1cccc(C(F)(F)F)c1)c1nc(-c2nc[nH]n2)no1 ZINC000467334754 881084694 /nfs/dbraw/zinc/08/46/94/881084694.db2.gz OQQSSKXJLNIURY-WFASDCNBSA-N 0 3 408.428 4.182 20 0 HIADHN C[C@@H](Cc1cccc(C(F)(F)F)c1)N[C@H](c1nc(-c2nc[nH]n2)no1)C(C)(C)C ZINC000467351368 881107218 /nfs/dbraw/zinc/10/72/18/881107218.db2.gz BBCMJDOXPJNGCO-SMDDNHRTSA-N 0 3 408.428 4.182 20 0 HIADHN C[C@@H](CCc1cccc(F)c1)N1CCCN(c2nnc(C(F)(F)F)s2)CC1 ZINC000467360310 881126049 /nfs/dbraw/zinc/12/60/49/881126049.db2.gz XJNJCASHXQCHGE-ZDUSSCGKSA-N 0 3 402.461 4.229 20 0 HIADHN COc1ccc2c(c1)[C@H](N[C@@H](C)c1cc(F)ccc1N1CCN(C)CC1)CCS2 ZINC000467422235 881210776 /nfs/dbraw/zinc/21/07/76/881210776.db2.gz ZJOVUSCPFSVAAN-HRAATJIYSA-N 0 3 415.578 4.474 20 0 HIADHN C[C@H](C(=O)Nc1cccc(CN2CCC(O)CC2)c1)c1ccc(C(F)(F)F)cc1 ZINC000467428512 881221744 /nfs/dbraw/zinc/22/17/44/881221744.db2.gz QKETYHCWQYKDDI-HNNXBMFYSA-N 0 3 406.448 4.404 20 0 HIADHN Cc1cc(NC(=O)N[C@H](C)CC(F)(F)F)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000467437479 881234085 /nfs/dbraw/zinc/23/40/85/881234085.db2.gz BKFXRDQOVBRFTK-NVXWUHKLSA-N 0 3 409.456 4.101 20 0 HIADHN C[C@@H](NC1CCN(c2nccs2)CC1)c1ccccc1I ZINC000467447472 881250484 /nfs/dbraw/zinc/25/04/84/881250484.db2.gz ICPFNOSKBYWBJD-GFCCVEGCSA-N 0 3 413.328 4.067 20 0 HIADHN Cc1ccc([C@@H](NC[C@@H](CO)CC2CCCC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000467451833 881255892 /nfs/dbraw/zinc/25/58/92/881255892.db2.gz YZOGHHUGVFBCBT-GBXCKJPGSA-N 0 3 415.599 4.266 20 0 HIADHN Cc1cc(C(=O)NCc2ccccc2CN2CCC(O)CC2)c(C)n1C1CCCCC1 ZINC000467498848 881315151 /nfs/dbraw/zinc/31/51/51/881315151.db2.gz MUYDRPZADNWTGS-UHFFFAOYSA-N 0 3 423.601 4.497 20 0 HIADHN Cc1c2cc(C)ccc2sc1C(=O)Nc1ccc2oc(=O)n(CCN(C)C)c2c1 ZINC000469050763 883122826 /nfs/dbraw/zinc/12/28/26/883122826.db2.gz RQPVDLMSIVSCLM-UHFFFAOYSA-N 0 3 409.511 4.240 20 0 HIADHN CCOC(=O)c1csc(CCN[C@@H](C)c2cc(Cl)ccc2OC(F)F)n1 ZINC000469058964 883133750 /nfs/dbraw/zinc/13/37/50/883133750.db2.gz VNXBWMPIISUURY-JTQLQIEISA-N 0 3 404.866 4.468 20 0 HIADHN CC[N@@H+]1CCC[C@H]1CN(Cc1ccc(O)cc1)C(=O)CCCc1ccc([O-])c(F)c1 ZINC000469099039 883189304 /nfs/dbraw/zinc/18/93/04/883189304.db2.gz WOROKILLFQYRTB-FQEVSTJZSA-N 0 3 414.521 4.073 20 0 HIADHN CC[N@H+]1CCC[C@H]1CN(Cc1ccc(O)cc1)C(=O)CCCc1ccc([O-])c(F)c1 ZINC000469099039 883189309 /nfs/dbraw/zinc/18/93/09/883189309.db2.gz WOROKILLFQYRTB-FQEVSTJZSA-N 0 3 414.521 4.073 20 0 HIADHN C[C@@H]1CC[C@@H](C)N1CC(=O)N[C@H](c1ccc2c(c1)OCCO2)c1ccccc1Cl ZINC000469101764 883193112 /nfs/dbraw/zinc/19/31/12/883193112.db2.gz ZULSMZNBAGIHFN-CKNGIIGNSA-N 0 3 414.933 4.190 20 0 HIADHN C[C@H](N[C@H]1CCCN(Cc2ccc(F)cc2F)C1=O)c1cccc(N2CCCC2)c1 ZINC000469164342 883262614 /nfs/dbraw/zinc/26/26/14/883262614.db2.gz ZXCIWEUYGGBHRR-SBUREZEXSA-N 0 3 413.512 4.407 20 0 HIADHN COc1ccc(CC[C@@H]2CCCCN2C(=O)c2cccc(CN(C)C)c2)cc1OC ZINC000469179675 883279070 /nfs/dbraw/zinc/27/90/70/883279070.db2.gz QIDFBYGWJXYUIW-QFIPXVFZSA-N 0 3 410.558 4.393 20 0 HIADHN O=C(NCC1(c2cc(C(F)(F)F)ccc2Cl)CC1)N1CC[C@H](N2CC=CC2)C1 ZINC000469214038 883312957 /nfs/dbraw/zinc/31/29/57/883312957.db2.gz GOMIEWOIMRUGTN-HNNXBMFYSA-N 0 3 413.871 4.046 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@H](C)N[C@H](C)c2cnn(C(C)C)c2C)CC1 ZINC000469240499 883339733 /nfs/dbraw/zinc/33/97/33/883339733.db2.gz PTQIYXKLGWMHOT-ZWKOTPCHSA-N 0 3 401.574 4.465 20 0 HIADHN C[C@H](Cn1cc(Br)cn1)NCc1cccnc1Oc1cccc(F)c1 ZINC000469326820 883432219 /nfs/dbraw/zinc/43/22/19/883432219.db2.gz ZGZXXZKDDSZVHP-CYBMUJFWSA-N 0 3 405.271 4.150 20 0 HIADHN CCN1CC[C@H](N(C)S(=O)(=O)c2cc(Cl)ccc2OCC2CCC2)C[C@H]1C ZINC000469339003 883452295 /nfs/dbraw/zinc/45/22/95/883452295.db2.gz SOVXSLBUJVNBHQ-QAPCUYQASA-N 0 3 414.999 4.012 20 0 HIADHN COc1ccc2c(c1)CN(CCc1nnnn1-c1ccccc1)[C@H](c1ccccc1)C2 ZINC000469447381 883644079 /nfs/dbraw/zinc/64/40/79/883644079.db2.gz BINNUOAOGTZQND-DEOSSOPVSA-N 0 3 411.509 4.013 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)c1ccc(OC2CCOCC2)cc1 ZINC000469475088 883704743 /nfs/dbraw/zinc/70/47/43/883704743.db2.gz VJRBXIYJAASPNV-DEOSSOPVSA-N 0 3 410.558 4.131 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)c1ccc(CNC(=O)C(C)(C)C)cc1 ZINC000469506501 883757981 /nfs/dbraw/zinc/75/79/81/883757981.db2.gz IEXNNLBEVRVZCU-QHCPKHFHSA-N 0 3 423.601 4.235 20 0 HIADHN COc1ccc(Cl)cc1C[C@@H]1CCCN(Cc2cc(-c3cnn(C)c3)no2)C1 ZINC000469521865 883790979 /nfs/dbraw/zinc/79/09/79/883790979.db2.gz JXFJOWXSVGJPJJ-HNNXBMFYSA-N 0 3 400.910 4.192 20 0 HIADHN COc1cc(OC)c(OC)cc1CNC[C@@H](c1cccc(C(F)(F)F)c1)N(C)C ZINC000469563132 883815667 /nfs/dbraw/zinc/81/56/67/883815667.db2.gz CGVRLTCYTOCGQS-KRWDZBQOSA-N 0 3 412.452 4.124 20 0 HIADHN COc1ccc(CNC[C@@H](c2cccc(C(F)(F)F)c2)N(C)C)c(OC)c1OC ZINC000469564481 883815694 /nfs/dbraw/zinc/81/56/94/883815694.db2.gz ZECBYYXNJYNHMM-KRWDZBQOSA-N 0 3 412.452 4.124 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)N3C[C@@H](C)C[C@H]3c3cccc(F)c3)CC2)c1 ZINC000469568286 883817595 /nfs/dbraw/zinc/81/75/95/883817595.db2.gz FGJUQYSDAKTJJL-RDPSFJRHSA-N 0 3 409.549 4.256 20 0 HIADHN COc1cccc([C@H](CNC(=O)Nc2ccccc2-n2ccc(C)n2)N2CCCC2)c1 ZINC000469646815 883847207 /nfs/dbraw/zinc/84/72/07/883847207.db2.gz ZKTBKNCYOUUEFI-QHCPKHFHSA-N 0 3 419.529 4.148 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)Nc1ccc2c(c1)CCCC(=O)N2 ZINC000469661308 883855587 /nfs/dbraw/zinc/85/55/87/883855587.db2.gz NERQGIQPLJUJGA-JOCHJYFZSA-N 0 3 408.546 4.240 20 0 HIADHN COC(=O)c1ccccc1-c1ccccc1C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000469687815 883871320 /nfs/dbraw/zinc/87/13/20/883871320.db2.gz OMBGGKNLNAZEPM-DNQXCXABSA-N 0 3 414.505 4.315 20 0 HIADHN CCN1CCN(CCC(=O)N[C@H](c2ccc(F)c(C)c2)c2ccccc2Cl)CC1 ZINC000469711671 883882230 /nfs/dbraw/zinc/88/22/30/883882230.db2.gz GHXQHPZJFAGDII-HSZRJFAPSA-N 0 3 417.956 4.021 20 0 HIADHN C[C@@H](NCc1cccc(C(=O)N2CCOCC2)c1)c1cccc(-c2ccncc2)c1 ZINC000469810157 883985455 /nfs/dbraw/zinc/98/54/55/883985455.db2.gz PSSOSZAYVPXSQG-LJQANCHMSA-N 0 3 401.510 4.072 20 0 HIADHN CC[C@H](NCc1cccc(C(=O)N2CCOCC2)c1)c1cccc(Br)c1 ZINC000469812234 883987943 /nfs/dbraw/zinc/98/79/43/883987943.db2.gz XPUWNLNWBXETQM-FQEVSTJZSA-N 0 3 417.347 4.162 20 0 HIADHN CN1CCCN(C(=O)N[C@H](c2cccc(F)c2)c2cccc(Br)c2)CC1 ZINC000469831343 884011333 /nfs/dbraw/zinc/01/13/33/884011333.db2.gz QMBGZXPHAVNICN-IBGZPJMESA-N 0 3 420.326 4.025 20 0 HIADHN O=C(CCc1ccc(-c2ccccc2)[nH]1)NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000469846328 884030559 /nfs/dbraw/zinc/03/05/59/884030559.db2.gz KFUZEVMGDODURK-XMMPIXPASA-N 0 3 417.553 4.022 20 0 HIADHN C[C@H](CC(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1)c1c[nH]c2ccccc21 ZINC000469849800 884031443 /nfs/dbraw/zinc/03/14/43/884031443.db2.gz AMSVEXVQGJTKIG-CTNGQTDRSA-N 0 3 405.542 4.069 20 0 HIADHN O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)[C@@H]1C[C@H]1c1ccc2ccccc2c1 ZINC000469862474 884048672 /nfs/dbraw/zinc/04/86/72/884048672.db2.gz MTAORYBFNGSDCH-UODIDJSMSA-N 0 3 414.549 4.351 20 0 HIADHN C[C@@H](C(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1)c1ccc2ccccc2c1 ZINC000469862082 884049344 /nfs/dbraw/zinc/04/93/44/884049344.db2.gz LKIIEYCCLDZFTJ-CJFMBICVSA-N 0 3 402.538 4.351 20 0 HIADHN Cc1ccnn1-c1ccccc1NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000469911516 884101937 /nfs/dbraw/zinc/10/19/37/884101937.db2.gz ZTSZWIQKPPIGFS-UHFFFAOYSA-N 0 3 421.467 4.108 20 0 HIADHN Cc1ccc(C)c(Sc2ccc(NC(=O)N3CCCN([C@@H](C)CO)CC3)cc2)c1 ZINC000469916051 884106322 /nfs/dbraw/zinc/10/63/22/884106322.db2.gz IIAHTLUNVKKZGK-IBGZPJMESA-N 0 3 413.587 4.375 20 0 HIADHN C[C@H](CO)N1CCCN(C(=O)Nc2cc(Cl)ccc2Oc2ccccc2)CC1 ZINC000469916653 884106804 /nfs/dbraw/zinc/10/68/04/884106804.db2.gz KHUDKKXVBCTNAO-MRXNPFEDSA-N 0 3 403.910 4.053 20 0 HIADHN Cc1ccc(NC(=O)C(C)(C)C)cc1NC(=O)CCN1CCN(c2ccccc2)CC1 ZINC000469962342 884168528 /nfs/dbraw/zinc/16/85/28/884168528.db2.gz KQDNHKODCHSDEP-UHFFFAOYSA-N 0 3 422.573 4.130 20 0 HIADHN CC(C)[C@@H](NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1)c1nc2ccccc2[nH]1 ZINC000503698146 912802004 /nfs/dbraw/zinc/80/20/04/912802004.db2.gz IESFMRZWRNZLQW-DENIHFKCSA-N 0 3 405.546 4.224 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@H]2NC(=O)NC[C@@H](c2cccs2)N2CCCC2)cc1 ZINC000470025435 884245216 /nfs/dbraw/zinc/24/52/16/884245216.db2.gz WSFKTBTTZUWXEH-URVUXULASA-N 0 3 413.587 4.413 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)Nc1ccc(Br)cc1Cl ZINC000503714992 912807036 /nfs/dbraw/zinc/80/70/36/912807036.db2.gz GMJZBOCMHXQEGW-UHFFFAOYSA-N 0 3 411.731 4.093 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N[C@H](C)c1ccccc1-n1cccn1)c1ccsc1 ZINC000470040302 884280130 /nfs/dbraw/zinc/28/01/30/884280130.db2.gz BJKLJMBXVRSCGW-UTKZUKDTSA-N 0 3 411.575 4.377 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)N[C@H](c1nc(C2CC2)no1)C(C)C ZINC000470062168 884314320 /nfs/dbraw/zinc/31/43/20/884314320.db2.gz MVRGVUHJYUZQGT-UXHICEINSA-N 0 3 413.566 4.100 20 0 HIADHN Cc1onc(-c2cccc(Br)c2)c1C(=O)NC[C@@H]1CCCCN1C1CC1 ZINC000470178587 884460706 /nfs/dbraw/zinc/46/07/06/884460706.db2.gz LDXBRKAOBRRLPZ-KRWDZBQOSA-N 0 3 418.335 4.159 20 0 HIADHN CC(C)[C@H](CNC(=O)Nc1ccccc1O[C@@H]1CCOC1)N1CCc2ccccc2C1 ZINC000470261407 884605031 /nfs/dbraw/zinc/60/50/31/884605031.db2.gz PTBMSVXOPDIMGL-GGAORHGYSA-N 0 3 423.557 4.059 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)Nc1ccccc1O[C@@H]1CCOC1 ZINC000470270414 884624663 /nfs/dbraw/zinc/62/46/63/884624663.db2.gz JGANEXFRJBBDDN-LJQANCHMSA-N 0 3 417.937 4.103 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)Nc1cc(F)ccc1OC(F)F ZINC000470276911 884635203 /nfs/dbraw/zinc/63/52/03/884635203.db2.gz UFPWBNSLCYYAMO-UHFFFAOYSA-N 0 3 417.378 4.301 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)N1CCC[C@@H](c2nccs2)C1 ZINC000470279144 884639838 /nfs/dbraw/zinc/63/98/38/884639838.db2.gz JDTKHPNOTLQLCN-UXHICEINSA-N 0 3 400.592 4.189 20 0 HIADHN COc1cc(F)c(C(=O)N[C@@H](CN2CCc3ccccc3C2)C(C)(C)C)cc1OC ZINC000470336593 884722112 /nfs/dbraw/zinc/72/21/12/884722112.db2.gz ILHNYVJHIRLHIB-QFIPXVFZSA-N 0 3 414.521 4.046 20 0 HIADHN COC[C@H](C)Oc1ccc(Cl)cc1NC(=O)N(CCN(C)C)Cc1ccccc1 ZINC000470521805 884914303 /nfs/dbraw/zinc/91/43/03/884914303.db2.gz VKEUTDVXESPYRB-KRWDZBQOSA-N 0 3 419.953 4.349 20 0 HIADHN C[C@@H]1[C@H](C(F)(F)F)CCN1C(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000470628124 885054608 /nfs/dbraw/zinc/05/46/08/885054608.db2.gz RBTLNMXOCRCASN-UNEWFSDZSA-N 0 3 408.386 4.240 20 0 HIADHN CCN(CC)CCN(Cc1cccs1)C(=O)C(=O)c1ccc(Br)cc1 ZINC000470645426 885069894 /nfs/dbraw/zinc/06/98/94/885069894.db2.gz WDLNVIWPOOUZNG-UHFFFAOYSA-N 0 3 423.376 4.064 20 0 HIADHN COc1cc(C(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)ccc1OCC(C)C ZINC000470656426 885077813 /nfs/dbraw/zinc/07/78/13/885077813.db2.gz HSPUNUMILJJSIL-JOCHJYFZSA-N 0 3 410.558 4.467 20 0 HIADHN Cc1c(C(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)cnn1-c1ccccc1F ZINC000470673938 885103097 /nfs/dbraw/zinc/10/30/97/885103097.db2.gz ITVKLESEQANTJO-HXUWFJFHSA-N 0 3 406.505 4.056 20 0 HIADHN Cc1c(C(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)cnn1-c1cccc(C)c1 ZINC000470675707 885106754 /nfs/dbraw/zinc/10/67/54/885106754.db2.gz TZQYILBHTIGHNR-QHCPKHFHSA-N 0 3 402.542 4.226 20 0 HIADHN CN(C(=O)c1ccc(C(=O)NCC(C)(C)C)cc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470675791 885107188 /nfs/dbraw/zinc/10/71/88/885107188.db2.gz UPECHFBAOHISCC-HSZRJFAPSA-N 0 3 421.585 4.199 20 0 HIADHN C[C@@H]1CN(C(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)C[C@@H](c2ccsc2)O1 ZINC000470735992 885192105 /nfs/dbraw/zinc/19/21/05/885192105.db2.gz IAQSHWZCSAEWHR-MMOPVJDHSA-N 0 3 402.535 4.088 20 0 HIADHN CN(C(=O)NCc1ccccc1OC(F)F)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470742014 885205223 /nfs/dbraw/zinc/20/52/23/885205223.db2.gz DVALNZOMPIHFHR-LJQANCHMSA-N 0 3 403.473 4.094 20 0 HIADHN CN(C(=O)NCc1ccc(OC2CCCC2)nc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470750950 885217010 /nfs/dbraw/zinc/21/70/10/885217010.db2.gz HFHPXIZZCKDDAC-JOCHJYFZSA-N 0 3 422.573 4.209 20 0 HIADHN C[C@@H](NC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1)c1ccccc1-n1cccn1 ZINC000470771985 885237914 /nfs/dbraw/zinc/23/79/14/885237914.db2.gz IGNMVFZWXOJFDJ-UYAOXDASSA-N 0 3 406.505 4.101 20 0 HIADHN CSc1ncc(C(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)n1-c1ccccc1 ZINC000470813500 885301080 /nfs/dbraw/zinc/30/10/80/885301080.db2.gz WAZHGOLPBHFSMO-OAQYLSRUSA-N 0 3 420.582 4.331 20 0 HIADHN CSc1ncc(C(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)n1-c1ccccc1 ZINC000470813499 885301313 /nfs/dbraw/zinc/30/13/13/885301313.db2.gz WAZHGOLPBHFSMO-NRFANRHFSA-N 0 3 420.582 4.331 20 0 HIADHN CCc1c(C(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)cnn1-c1ccc(F)cc1 ZINC000470819675 885307230 /nfs/dbraw/zinc/30/72/30/885307230.db2.gz GYUJCKPRBIWJQI-JOCHJYFZSA-N 0 3 420.532 4.310 20 0 HIADHN CC[C@@H]1CN(C[C@H](O)COc2ccc(C(C)=O)cc2OC)CC[C@H]1c1ccccc1 ZINC000470872749 885361988 /nfs/dbraw/zinc/36/19/88/885361988.db2.gz KPUHZAAOYUBLOS-WTIAFYNJSA-N 0 3 411.542 4.153 20 0 HIADHN CN(C(=O)NCc1ccc(Br)cc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470879485 885370621 /nfs/dbraw/zinc/37/06/21/885370621.db2.gz JHNVLZWLJTUSMZ-FQEVSTJZSA-N 0 3 416.363 4.255 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)c2cc3cc(Br)ccc3[nH]2)o1 ZINC000504025586 912929921 /nfs/dbraw/zinc/92/99/21/912929921.db2.gz RITMKQHTNRKBSD-UHFFFAOYSA-N 0 3 404.308 4.036 20 0 HIADHN Cc1cccc2c(CCNC(=O)N(C)[C@H]3CCCN(Cc4ccccc4)C3)c[nH]c21 ZINC000470900346 885402169 /nfs/dbraw/zinc/40/21/69/885402169.db2.gz APCJFCFACACSPV-QFIPXVFZSA-N 0 3 404.558 4.325 20 0 HIADHN Cc1nc2cc(C(=O)N(CCN(C)C)Cc3ccc(Br)cc3)ccc2o1 ZINC000470929458 885434559 /nfs/dbraw/zinc/43/45/59/885434559.db2.gz DTZQVXZOSGKJKG-UHFFFAOYSA-N 0 3 416.319 4.103 20 0 HIADHN Cn1nc(C(F)F)c2cc(C(=O)NC[C@H]3CCCN(C)[C@@H]3c3cccs3)sc21 ZINC000470996072 885496702 /nfs/dbraw/zinc/49/67/02/885496702.db2.gz VCTZJFHUDVSUFW-BZNIZROVSA-N 0 3 424.542 4.447 20 0 HIADHN CCOc1cc(CN2CC[C@H](c3ccc(C)cc3C)C2)nc2nc(C(F)(F)F)nn21 ZINC000471019771 885524570 /nfs/dbraw/zinc/52/45/70/885524570.db2.gz TXZXSFTZSXBRGK-HNNXBMFYSA-N 0 3 419.451 4.148 20 0 HIADHN CN(C(=O)c1cc(C(F)(F)F)ccc1F)C1CCN(CCc2ccccn2)CC1 ZINC000471023164 885530052 /nfs/dbraw/zinc/53/00/52/885530052.db2.gz SORBQJSYXZVOQK-UHFFFAOYSA-N 0 3 409.427 4.019 20 0 HIADHN Cc1cc(NC(=O)c2ccc3oc(C)nc3c2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000471051140 885565978 /nfs/dbraw/zinc/56/59/78/885565978.db2.gz CFSQTBFHVUPXSI-HXUWFJFHSA-N 0 3 415.497 4.340 20 0 HIADHN COC(=O)c1c(CN2CCC[C@@](C)(O)CC2)nc2ccccc2c1-c1ccccc1 ZINC000471067808 885585665 /nfs/dbraw/zinc/58/56/65/885585665.db2.gz YEUJIUPVRGLIQJ-RUZDIDTESA-N 0 3 404.510 4.425 20 0 HIADHN CC1CCN([C@@H](CNC(=O)CCc2nnc(C3CCCC3)o2)c2cccs2)CC1 ZINC000471084949 885613724 /nfs/dbraw/zinc/61/37/24/885613724.db2.gz JPBDGDFXAWBKGE-SFHVURJKSA-N 0 3 416.591 4.311 20 0 HIADHN CSc1nc(-c2ccco2)nc(C)c1C(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C ZINC000471136320 885677400 /nfs/dbraw/zinc/67/74/00/885677400.db2.gz JQMCRUUSAWYEKR-KXBFYZLASA-N 0 3 410.543 4.188 20 0 HIADHN COc1ccc(C2(C(=O)N[C@H](C)[C@@H](c3ccccc3)N(C)C)CCCC2)cc1OC ZINC000471139225 885681651 /nfs/dbraw/zinc/68/16/51/885681651.db2.gz DXZVVVXUYKDYPM-JPYJTQIMSA-N 0 3 410.558 4.323 20 0 HIADHN Cc1cc(C)c(CC(C(=O)Nc2ccc(C(=O)N(C)C)cn2)C(F)(F)F)c(C)c1 ZINC000471209920 885782933 /nfs/dbraw/zinc/78/29/33/885782933.db2.gz HONRZCZHAOXJFW-KRWDZBQOSA-N 0 3 407.436 4.068 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)c1ccc(Cl)cc1Br ZINC000471228981 885803199 /nfs/dbraw/zinc/80/31/99/885803199.db2.gz RRKKBSYSXBTFEC-UHFFFAOYSA-N 0 3 417.800 4.194 20 0 HIADHN COc1cccc(Oc2ccc(NC(=O)N(CCN(C)C)Cc3ccccn3)cc2)c1 ZINC000504075852 912978995 /nfs/dbraw/zinc/97/89/95/912978995.db2.gz MOJBIXMURWTJTG-UHFFFAOYSA-N 0 3 420.513 4.478 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1cccc(NC(=O)N(C)C)c1C)c1ccsc1 ZINC000471359909 885985429 /nfs/dbraw/zinc/98/54/29/885985429.db2.gz GHFLIRAOBNLWKZ-LJQANCHMSA-N 0 3 417.579 4.355 20 0 HIADHN CC(C)(C)CCN1CCN(C(=O)Nc2cccc(OCc3cscn3)c2)CC1 ZINC000504095514 913006743 /nfs/dbraw/zinc/00/67/43/913006743.db2.gz LUCXHVYOFPFCTR-UHFFFAOYSA-N 0 3 402.564 4.308 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1cc(OC)cc(-n2cccn2)c1)c1ccsc1 ZINC000471493947 886194770 /nfs/dbraw/zinc/19/47/70/886194770.db2.gz VPDHTDLXNBKWEF-HXUWFJFHSA-N 0 3 413.547 4.147 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1cc(OC)cc(-n2cccn2)c1)c1ccsc1 ZINC000471493946 886194980 /nfs/dbraw/zinc/19/49/80/886194980.db2.gz VPDHTDLXNBKWEF-FQEVSTJZSA-N 0 3 413.547 4.147 20 0 HIADHN CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)Nc1ccc(OC(F)(F)F)cc1 ZINC000471498432 886198325 /nfs/dbraw/zinc/19/83/25/886198325.db2.gz BTLNHMQZHOUHQO-YJBOKZPZSA-N 0 3 408.424 4.137 20 0 HIADHN O=C(NCC1(c2ccccc2)CCC1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000471498244 886198414 /nfs/dbraw/zinc/19/84/14/886198414.db2.gz ADLUFWFGCLIDOA-UHFFFAOYSA-N 0 3 409.496 4.213 20 0 HIADHN CCCCCn1nc(C(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)c2ccccc2c1=O ZINC000471528011 886231271 /nfs/dbraw/zinc/23/12/71/886231271.db2.gz DRCSDAUAPNBPIW-MBSDFSHPSA-N 0 3 420.557 4.008 20 0 HIADHN Cc1cccc(NC(=O)N2CCC[C@H](C(=O)N[C@H](C)[C@@H](c3ccccc3)N(C)C)C2)c1 ZINC000471530680 886234924 /nfs/dbraw/zinc/23/49/24/886234924.db2.gz LWLKDLWKYSXLTJ-NWSQWKLXSA-N 0 3 422.573 4.047 20 0 HIADHN COc1ccc(CCC(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)cc1Br ZINC000471543121 886250081 /nfs/dbraw/zinc/25/00/81/886250081.db2.gz XDDLFEPJGPNDEB-VFNWGFHPSA-N 0 3 419.363 4.198 20 0 HIADHN Cc1c(I)cccc1C(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C ZINC000471545506 886252480 /nfs/dbraw/zinc/25/24/80/886252480.db2.gz GHUPCTFETANHJW-KSSFIOAISA-N 0 3 422.310 4.021 20 0 HIADHN C[C@H](CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)N[C@@H](CO)c1ccsc1 ZINC000471586544 886296116 /nfs/dbraw/zinc/29/61/16/886296116.db2.gz DHZSLVFRQRUTQE-BMIGLBTASA-N 0 3 406.857 4.461 20 0 HIADHN COc1ccccc1[C@@H](CN[C@H](C)c1ccc(NC(C)=O)cc1OC)OC(C)C ZINC000471593933 886305942 /nfs/dbraw/zinc/30/59/42/886305942.db2.gz NPGCBPGTUXSDMZ-WAIKUNEKSA-N 0 3 400.519 4.479 20 0 HIADHN C[C@@H](CCCCN1C(=O)c2ccccc2C1=O)NCc1csc(-c2ccco2)n1 ZINC000471600231 886314579 /nfs/dbraw/zinc/31/45/79/886314579.db2.gz AXBGZJYDIMWXNW-HNNXBMFYSA-N 0 3 409.511 4.348 20 0 HIADHN CC(C)Oc1ccc(CNC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cc1 ZINC000471612905 886327930 /nfs/dbraw/zinc/32/79/30/886327930.db2.gz VDVKDIAJEHEIHB-UHFFFAOYSA-N 0 3 413.484 4.078 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)[C@@H](OC3CCCC3)c3ccccc3)c2)CC1 ZINC000471644118 886359122 /nfs/dbraw/zinc/35/91/22/886359122.db2.gz AFFHQXIGJSOMMD-DEOSSOPVSA-N 0 3 407.558 4.468 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)c3ccnc(SCC(F)(F)F)c3)c2)CC1 ZINC000471645805 886360807 /nfs/dbraw/zinc/36/08/07/886360807.db2.gz ZMFJQPZDOBJCNU-UHFFFAOYSA-N 0 3 424.492 4.130 20 0 HIADHN C[C@@H](NC(=O)N[C@@H]1C[C@H]1c1ccc(OC(F)F)cc1)[C@@H](c1ccccc1)N(C)C ZINC000504146186 913044313 /nfs/dbraw/zinc/04/43/13/913044313.db2.gz UDCBMLRUNFOKDJ-YGBSJELFSA-N 0 3 403.473 4.135 20 0 HIADHN COc1ccc(NC(=O)[C@H](C)N[C@H]2C[C@H](OCc3ccccc3)C2(C)C)cc1OC ZINC000471860022 886632243 /nfs/dbraw/zinc/63/22/43/886632243.db2.gz WZEVEXZNVVQNQF-SSKFGXFMSA-N 0 3 412.530 4.004 20 0 HIADHN COc1ccc(OC)c(NC(=O)[C@H](C)N[C@@H]2C[C@@H](OCc3ccccc3)C2(C)C)c1 ZINC000471860749 886635032 /nfs/dbraw/zinc/63/50/32/886635032.db2.gz YIWUIQZVBRMOLR-KNXBSLHKSA-N 0 3 412.530 4.004 20 0 HIADHN Cc1cn([C@H](C)c2ccccc2)nc1NC(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C ZINC000471864335 886641515 /nfs/dbraw/zinc/64/15/15/886641515.db2.gz ROPWYUAPXCMQKN-NOXFTYBFSA-N 0 3 417.557 4.443 20 0 HIADHN CSc1cc(C(=O)NCCCCN2C[C@@H](C)O[C@H](C)C2)c(Cl)cc1Cl ZINC000471908995 886693920 /nfs/dbraw/zinc/69/39/20/886693920.db2.gz HFFFHEANFSGWMX-CHWSQXEVSA-N 0 3 405.391 4.335 20 0 HIADHN Cc1cccnc1[C@H](NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1)C(C)C ZINC000471915554 886703455 /nfs/dbraw/zinc/70/34/55/886703455.db2.gz RCWGWCPNKTVRMQ-DAWZGUTISA-N 0 3 412.500 4.192 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2cccc3c2CN(c2ccccn2)C3)[C@@H]1c1ccccc1 ZINC000471939712 886739182 /nfs/dbraw/zinc/73/91/82/886739182.db2.gz LLVKDODHTBBJHE-UPVQGACJSA-N 0 3 413.525 4.169 20 0 HIADHN CCCc1c(NC(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)cnn1-c1cc(C)ccn1 ZINC000471955900 886768809 /nfs/dbraw/zinc/76/88/09/886768809.db2.gz SHTCWLXOGJSHQY-AUSIDOKSSA-N 0 3 418.545 4.095 20 0 HIADHN CCCc1c(NC(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)cnn1-c1cc(C)ccn1 ZINC000471955902 886770022 /nfs/dbraw/zinc/77/00/22/886770022.db2.gz SHTCWLXOGJSHQY-WMZHIEFXSA-N 0 3 418.545 4.095 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2cc(F)cc(F)c2Br)[C@@H]1c1ccccc1 ZINC000471967932 886798681 /nfs/dbraw/zinc/79/86/81/886798681.db2.gz SZLZIGZTGKYGNR-YOEHRIQHSA-N 0 3 410.262 4.294 20 0 HIADHN CC1CCN([C@H](CNC(=O)Nc2ccc(C(F)(F)F)nn2)c2ccccc2)CC1 ZINC000471975712 886805924 /nfs/dbraw/zinc/80/59/24/886805924.db2.gz CQARZPCTXLUFKF-MRXNPFEDSA-N 0 3 407.440 4.090 20 0 HIADHN Cc1ccc(C2(C(=O)Nc3cccc(N4CCN(C(C)C)CC4)c3)CCOCC2)cc1 ZINC000504199817 913082620 /nfs/dbraw/zinc/08/26/20/913082620.db2.gz SZNRTFCAWLXTJW-UHFFFAOYSA-N 0 3 421.585 4.212 20 0 HIADHN CCO[C@@H]1C[C@H](NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)C1(CC)CC ZINC000471989792 886816343 /nfs/dbraw/zinc/81/63/43/886816343.db2.gz BYRPQWNWELFLDH-ZGUYJTEBSA-N 0 3 419.532 4.075 20 0 HIADHN CC(C)c1ncc(Cl)c(C(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)n1 ZINC000504199464 913082995 /nfs/dbraw/zinc/08/29/95/913082995.db2.gz OUCRJUGRACCWAW-UHFFFAOYSA-N 0 3 401.942 4.036 20 0 HIADHN CCC(CC)[C@@H](c1ccc(Cl)cc1)N(C)C(=O)NC[C@@H](C)CN1CCN(C)CC1 ZINC000471993361 886819634 /nfs/dbraw/zinc/81/96/34/886819634.db2.gz TUJCSNKXTAIPOU-GCJKJVERSA-N 0 3 423.045 4.342 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2cccc(-c3noc(C4CC4)n3)c2)[C@@H]1c1ccccc1 ZINC000472010213 886833856 /nfs/dbraw/zinc/83/38/56/886833856.db2.gz CJEMSSOPRBWHSX-UXHICEINSA-N 0 3 403.486 4.181 20 0 HIADHN CCn1nc(CN[C@@H]2CCN(CC)[C@H]2c2cc(F)c(F)c(F)c2)c2ccccc21 ZINC000472041992 886858851 /nfs/dbraw/zinc/85/88/51/886858851.db2.gz BFNIVUKZLKOVOQ-GCJKJVERSA-N 0 3 402.464 4.399 20 0 HIADHN Cc1ccc([C@H](NC(=O)N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)c2ccccn2)cc1 ZINC000472069621 886875597 /nfs/dbraw/zinc/87/55/97/886875597.db2.gz KRXUFAZYNMNHAH-PBXXJUDPSA-N 0 3 414.553 4.442 20 0 HIADHN Cc1ccc([C@H](NC(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)c2ccccn2)cc1 ZINC000472111127 886898343 /nfs/dbraw/zinc/89/83/43/886898343.db2.gz SRFUZVNPEROCCB-TZRRMPRUSA-N 0 3 400.526 4.224 20 0 HIADHN C[C@@H]1CCc2ccccc2[C@H]1NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472132711 886924523 /nfs/dbraw/zinc/92/45/23/886924523.db2.gz OSDITBLNGBLHJP-ZPHYSPEPSA-N 0 3 409.496 4.415 20 0 HIADHN Cc1nc2ccc(C(=O)NC3CCN(CCOc4ccc(Cl)cc4)CC3)cc2o1 ZINC000472155409 886953399 /nfs/dbraw/zinc/95/33/99/886953399.db2.gz LSOSRNUJUGJURT-UHFFFAOYSA-N 0 3 413.905 4.063 20 0 HIADHN Cc1oc2ccccc2c1CNC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472170637 886969060 /nfs/dbraw/zinc/96/90/60/886969060.db2.gz BJEFAPRDNGINKG-UHFFFAOYSA-N 0 3 409.452 4.346 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2ccc3oc(C(F)(F)F)nc3c2)[C@H]1c1ccccc1 ZINC000472316221 887148110 /nfs/dbraw/zinc/14/81/10/887148110.db2.gz DTXHOALTRUASFF-WMLDXEAASA-N 0 3 404.392 4.414 20 0 HIADHN COc1ccc(Br)c(NC(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)c1 ZINC000472333158 887166260 /nfs/dbraw/zinc/16/62/60/887166260.db2.gz BEEXTLMQFXSPID-WMZOPIPTSA-N 0 3 404.308 4.025 20 0 HIADHN CN(Cc1ccc(F)cc1Cl)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472451761 887304326 /nfs/dbraw/zinc/30/43/26/887304326.db2.gz KNGDTFNIXIBJTH-UHFFFAOYSA-N 0 3 421.866 4.426 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N1CCC[C@@H]1c1cccs1 ZINC000472453699 887307142 /nfs/dbraw/zinc/30/71/42/887307142.db2.gz MSZVYSLPHUHDIU-UYSNPLJNSA-N 0 3 401.498 4.400 20 0 HIADHN C[C@@H](c1cc(F)ccc1F)N(C)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472455152 887309314 /nfs/dbraw/zinc/30/93/14/887309314.db2.gz KOLUODMVVIWTGP-JQRITLKVSA-N 0 3 419.438 4.473 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N1CC[C@H](c2ccccc2F)C1 ZINC000472458876 887315824 /nfs/dbraw/zinc/31/58/24/887315824.db2.gz YSPQOZLKQOULCA-OOHWJJMZSA-N 0 3 413.459 4.130 20 0 HIADHN C[C@H]1[C@@H](c2ccccc2)CCN1C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472462628 887322315 /nfs/dbraw/zinc/32/23/15/887322315.db2.gz HRCXHYXWBLKVRR-GRCLEANCSA-N 0 3 409.496 4.379 20 0 HIADHN COCCC[C@H](Cc1ccccc1)NC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1 ZINC000472465033 887323324 /nfs/dbraw/zinc/32/33/24/887323324.db2.gz UCSXSDMJNSLRKW-WIOPSUGQSA-N 0 3 423.601 4.330 20 0 HIADHN Cc1ccc([C@@H](NC(=O)N(CCN(C)C)Cc2ccccc2F)c2ccccn2)cc1 ZINC000472475410 887336592 /nfs/dbraw/zinc/33/65/92/887336592.db2.gz KYXKFAUORUTTCO-XMMPIXPASA-N 0 3 420.532 4.392 20 0 HIADHN CC(C)(C(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1)C(F)F ZINC000472488181 887354542 /nfs/dbraw/zinc/35/45/42/887354542.db2.gz WVWUCNPARBQZQW-UHFFFAOYSA-N 0 3 401.501 4.281 20 0 HIADHN Cc1nn(C)c(=O)c(-c2nc(CN[C@@H]3CCC[C@@H]3Cc3ccccc3)cs2)c1C ZINC000472630056 887495444 /nfs/dbraw/zinc/49/54/44/887495444.db2.gz MOXPNMXOIPXSEH-UYAOXDASSA-N 0 3 408.571 4.022 20 0 HIADHN C[C@H](CNC(=O)N[C@H](c1cccc(Cl)c1)C1CCCCC1)CN1CCN(C)CC1 ZINC000472636291 887500952 /nfs/dbraw/zinc/50/09/52/887500952.db2.gz FFKXGHYORDEWQA-GCJKJVERSA-N 0 3 421.029 4.144 20 0 HIADHN CN(C(=O)Nc1ccc(OC[C@H]2CCCO2)cc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000472676723 887530806 /nfs/dbraw/zinc/53/08/06/887530806.db2.gz IHJIBGJWGUBHOV-ISKFKSNPSA-N 0 3 423.557 4.373 20 0 HIADHN Cc1cc(C)n(-c2ccccc2CNC(=O)NC[C@@H](c2ccccc2)N2CCCC2)n1 ZINC000472717038 887565633 /nfs/dbraw/zinc/56/56/33/887565633.db2.gz ZLZATGLRMFKTFY-DEOSSOPVSA-N 0 3 417.557 4.125 20 0 HIADHN Cc1ccc(NC(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)cc1C(=O)NC(C)C ZINC000472732857 887579355 /nfs/dbraw/zinc/57/93/55/887579355.db2.gz GXKFGAMLGQUQGU-QFIPXVFZSA-N 0 3 422.573 4.262 20 0 HIADHN CN(C(=O)Nc1ccc(C(=O)NC(C)(C)C)cc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000472750036 887595888 /nfs/dbraw/zinc/59/58/88/887595888.db2.gz KYZGJLJIPJRLQN-QFIPXVFZSA-N 0 3 422.573 4.343 20 0 HIADHN CC(C)C(=O)Nc1ccc(NC(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000472769145 887615467 /nfs/dbraw/zinc/61/54/67/887615467.db2.gz IRUJHULADQPAQA-JOCHJYFZSA-N 0 3 408.546 4.409 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N[C@H](CC1CCCC1)c1ccccc1 ZINC000504317872 913162903 /nfs/dbraw/zinc/16/29/03/913162903.db2.gz VRDGNEKEQWVBAH-HSZRJFAPSA-N 0 3 407.558 4.433 20 0 HIADHN COc1cc(NC(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)ccc1Br ZINC000472863282 887718428 /nfs/dbraw/zinc/71/84/28/887718428.db2.gz NDLUVAWOWUJBHK-PBHICJAKSA-N 0 3 418.335 4.415 20 0 HIADHN C[C@H](CNC(=O)Nc1ccc(OCc2ccccn2)c(F)c1)N(C)Cc1ccccc1 ZINC000472896424 887743663 /nfs/dbraw/zinc/74/36/63/887743663.db2.gz JULJNINXTDGXNB-GOSISDBHSA-N 0 3 422.504 4.442 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)Nc1ccc(F)cc1-c1nc(C2CC2)no1 ZINC000472929098 887778606 /nfs/dbraw/zinc/77/86/06/887778606.db2.gz HPDLHLLKBBYLTJ-UHFFFAOYSA-N 0 3 423.492 4.349 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N3CCC(=Cc4cccc(OC)c4)CC3)cc2)CC1 ZINC000472964092 887811439 /nfs/dbraw/zinc/81/14/39/887811439.db2.gz BOHYLECUOMMETR-UHFFFAOYSA-N 0 3 419.569 4.157 20 0 HIADHN COc1ccc(CN2CC[C@]3(C2)OCc2ccccc23)cc1OCc1cccnc1 ZINC000473128484 887919735 /nfs/dbraw/zinc/91/97/35/887919735.db2.gz NZGPLTBNDUMGLI-RUZDIDTESA-N 0 3 402.494 4.301 20 0 HIADHN Cc1c(F)c(C(F)(F)F)ccc1C(=O)N(C)C1CCN(CCc2ccccn2)CC1 ZINC000473180550 887959719 /nfs/dbraw/zinc/95/97/19/887959719.db2.gz FJWNCVUBXTVJKO-UHFFFAOYSA-N 0 3 423.454 4.327 20 0 HIADHN COc1cccc([C@H](CNC(=O)C[C@H](c2cccs2)n2cccc2)N2CCCC2)c1 ZINC000473291422 888045168 /nfs/dbraw/zinc/04/51/68/888045168.db2.gz DRNAPWXWGFNJFR-YADHBBJMSA-N 0 3 423.582 4.491 20 0 HIADHN COc1cccc([C@H](CNC(=O)C[C@@H](c2cccs2)n2cccc2)N2CCCC2)c1 ZINC000473291421 888045355 /nfs/dbraw/zinc/04/53/55/888045355.db2.gz DRNAPWXWGFNJFR-VXKWHMMOSA-N 0 3 423.582 4.491 20 0 HIADHN Cc1ccc(SCCC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cc1 ZINC000473508546 888237376 /nfs/dbraw/zinc/23/73/76/888237376.db2.gz BONSECNQAFYZQF-UHFFFAOYSA-N 0 3 400.510 4.399 20 0 HIADHN COCc1c2ccccc2oc1C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473514434 888245080 /nfs/dbraw/zinc/24/50/80/888245080.db2.gz RVJJUXNUTTWDDX-UHFFFAOYSA-N 0 3 410.436 4.114 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1cccc([C@@H]2CCCOC2)c1 ZINC000473516322 888247219 /nfs/dbraw/zinc/24/72/19/888247219.db2.gz ANRPUQNCYVBKHS-QHGAOEGBSA-N 0 3 410.480 4.116 20 0 HIADHN C[C@H]1CCc2c(C(=O)NC3CC(N4CCC(C(F)(F)F)CC4)C3)csc2C1 ZINC000473515665 888247285 /nfs/dbraw/zinc/24/72/85/888247285.db2.gz ZPBIPTDSPMGIOG-GRTSSRMGSA-N 0 3 400.510 4.408 20 0 HIADHN O=C(CSc1nccc2ccccc21)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473517892 888250409 /nfs/dbraw/zinc/25/04/09/888250409.db2.gz BVNDIQJKPLGOAD-UHFFFAOYSA-N 0 3 423.504 4.248 20 0 HIADHN CCOc1c(Cl)cccc1CC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473524339 888259986 /nfs/dbraw/zinc/25/99/86/888259986.db2.gz UGLCQWFKTUDKLO-UHFFFAOYSA-N 0 3 418.887 4.203 20 0 HIADHN Cc1cc(OC(F)F)c(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)s1 ZINC000473528696 888266647 /nfs/dbraw/zinc/26/66/47/888266647.db2.gz UMDFCOWPILURNM-UHFFFAOYSA-N 0 3 412.424 4.193 20 0 HIADHN COc1ccc2nc(C)cc(C(=O)NC3CC(N4CCC(C(F)(F)F)CC4)C3)c2c1 ZINC000473531319 888267965 /nfs/dbraw/zinc/26/79/65/888267965.db2.gz PSXRQCFRJRNXNQ-UHFFFAOYSA-N 0 3 421.463 4.087 20 0 HIADHN Cc1cc(Br)ccc1C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473534199 888271580 /nfs/dbraw/zinc/27/15/80/888271580.db2.gz PZKDFLGWWDLFKQ-UHFFFAOYSA-N 0 3 419.285 4.293 20 0 HIADHN C[C@H]1CCc2ccccc2N1CCC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473535348 888273223 /nfs/dbraw/zinc/27/32/23/888273223.db2.gz XQBLBZWDYYNUSO-DZIBYMRMSA-N 0 3 423.523 4.139 20 0 HIADHN Cc1cc(Cl)ccc1O[C@@H](C)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473536858 888274417 /nfs/dbraw/zinc/27/44/17/888274417.db2.gz XSSADUXWNRXUOH-IGEOTXOUSA-N 0 3 418.887 4.337 20 0 HIADHN C[C@@H](CCN1CCN(C)CC1)NC(=O)Nc1cccc(CCCc2ccccc2)c1 ZINC000473673643 888435044 /nfs/dbraw/zinc/43/50/44/888435044.db2.gz GEKOBBQFAYIBIL-NRFANRHFSA-N 0 3 408.590 4.009 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)N[C@H]1C[C@H](c2ccc(OC)c(F)c2)C1)c1ccco1 ZINC000504433444 913244501 /nfs/dbraw/zinc/24/45/01/913244501.db2.gz IIQYNOXYHVSTMY-KLICCBINSA-N 0 3 403.498 4.102 20 0 HIADHN Cc1ccc(NC(=O)N[C@@H](C)CCN2CCN(C)CC2)cc1OCC1CCCCC1 ZINC000473696024 888471858 /nfs/dbraw/zinc/47/18/58/888471858.db2.gz JQWDDNXVKXMJAT-FQEVSTJZSA-N 0 3 416.610 4.102 20 0 HIADHN COc1c(CNC(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)oc2ccccc21 ZINC000473712544 888489115 /nfs/dbraw/zinc/48/91/15/888489115.db2.gz CZJMOLAXPVNHIM-IBGZPJMESA-N 0 3 407.514 4.247 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)CC3(CSc4ccccc4)CC3)CC2)C[C@H](C)O1 ZINC000473722148 888499337 /nfs/dbraw/zinc/49/93/37/888499337.db2.gz DICJWROSVMBQAI-BGYRXZFFSA-N 0 3 416.631 4.297 20 0 HIADHN COc1c2ccccc2oc1CNC(=O)N(CCN(C)C)Cc1cccc(Cl)c1 ZINC000473727964 888504560 /nfs/dbraw/zinc/50/45/60/888504560.db2.gz APYPUZKJJZJGEO-UHFFFAOYSA-N 0 3 415.921 4.368 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)N2CCCC[C@H]2c2nc(-c3cccc(F)c3)c[nH]2)CN1C1CC1 ZINC000473737045 888515959 /nfs/dbraw/zinc/51/59/59/888515959.db2.gz APDRLGISGMSSAD-YWMUFLPLSA-N 0 3 411.525 4.078 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@@H](c3nc4ccccc4[nH]3)C(C)C)c2)CC1 ZINC000473802747 888622854 /nfs/dbraw/zinc/62/28/54/888622854.db2.gz BSZBDKXZYHVKPJ-JOCHJYFZSA-N 0 3 420.561 4.224 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N(C)[C@@H](C)c3ccc(F)c(F)c3)c2)CC1 ZINC000473822464 888653807 /nfs/dbraw/zinc/65/38/07/888653807.db2.gz IRRFWQVFDJJSHM-INIZCTEOSA-N 0 3 402.489 4.332 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CC[C@@H](Cc4ccccc4)[C@@H]3C)c2)CC1 ZINC000473826570 888660281 /nfs/dbraw/zinc/66/02/81/888660281.db2.gz FOFGWDNJNRZKNX-UNMCSNQZSA-N 0 3 406.574 4.314 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N(C)Cc3ccc(OC(F)F)cc3)c2)CC1 ZINC000473827313 888660466 /nfs/dbraw/zinc/66/04/66/888660466.db2.gz HDVDXUMFZVUAAB-UHFFFAOYSA-N 0 3 418.488 4.094 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@H]3CCC[C@@H]3OCc3ccccc3)c2)CC1 ZINC000473830279 888663586 /nfs/dbraw/zinc/66/35/86/888663586.db2.gz PCPBGTUODIASST-ZEQRLZLVSA-N 0 3 422.573 4.088 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)NCc3cccc(-c4cccnc4)c3)c2)CC1 ZINC000473830623 888664942 /nfs/dbraw/zinc/66/49/42/888664942.db2.gz PXMAAAGSNOGYSA-UHFFFAOYSA-N 0 3 415.541 4.212 20 0 HIADHN CCN(C(=O)Nc1cccc(N2CCN(CC)CC2)c1)[C@@H](C)Cc1ccc(OC)cc1 ZINC000473831743 888666473 /nfs/dbraw/zinc/66/64/73/888666473.db2.gz WWXMQBGUIRGXFH-FQEVSTJZSA-N 0 3 424.589 4.322 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)NCc3cc(C)ccc3OC(F)F)c2)CC1 ZINC000473831687 888667169 /nfs/dbraw/zinc/66/71/69/888667169.db2.gz UFYNROSRTSASGL-UHFFFAOYSA-N 0 3 418.488 4.060 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3C[C@@H](c4ccccc4)C(C)(C)C3)c2)CC1 ZINC000473833271 888668439 /nfs/dbraw/zinc/66/84/39/888668439.db2.gz BRSNHIDHQUTBPP-QHCPKHFHSA-N 0 3 406.574 4.486 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CCC(OCc4ccccc4)CC3)c2)CC1 ZINC000473835454 888672343 /nfs/dbraw/zinc/67/23/43/888672343.db2.gz DAGYDIGNIYHQAI-UHFFFAOYSA-N 0 3 422.573 4.042 20 0 HIADHN CCOc1cccc2[nH]cc(CC(=O)N3CCCN(Cc4ccccc4)C[C@H]3C)c21 ZINC000473841163 888682351 /nfs/dbraw/zinc/68/23/51/888682351.db2.gz QZRCGRXBHLAGEO-LJQANCHMSA-N 0 3 405.542 4.232 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N(C)Cc3c(F)cccc3Cl)c2)CC1 ZINC000473841548 888683643 /nfs/dbraw/zinc/68/36/43/888683643.db2.gz SHDCLQVAKBRKMU-UHFFFAOYSA-N 0 3 404.917 4.285 20 0 HIADHN C[C@H](NC(=O)N(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1)c1cc2cccc(F)c2o1 ZINC000473885817 888754322 /nfs/dbraw/zinc/75/43/22/888754322.db2.gz KZTLPRXPUNEHOA-XERREHJYSA-N 0 3 410.493 4.362 20 0 HIADHN CN1CCN(CCC(C)(C)NC(=O)N[C@@H](CCc2ccccc2)c2ccccc2)CC1 ZINC000473908250 888786263 /nfs/dbraw/zinc/78/62/63/888786263.db2.gz VUKBMDZJCKYEOK-DEOSSOPVSA-N 0 3 422.617 4.076 20 0 HIADHN Cc1ccc(-c2cc(C(=O)N3CCC(CCN4C[C@@H](C)O[C@@H](C)C4)CC3)[nH]n2)cc1C ZINC000473918077 888799997 /nfs/dbraw/zinc/79/99/97/888799997.db2.gz AEMXFQRATHQJAD-BGYRXZFFSA-N 0 3 424.589 4.045 20 0 HIADHN O=C(NCc1nc2c(s1)CCCC2)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000473919893 888801478 /nfs/dbraw/zinc/80/14/78/888801478.db2.gz FISMVYGJLZZEMD-HXUWFJFHSA-N 0 3 423.504 4.093 20 0 HIADHN CN1CCN(CCC(C)(C)NC(=O)N[C@H](c2ccc(Cl)cc2)C2CCCC2)CC1 ZINC000473939794 888816896 /nfs/dbraw/zinc/81/68/96/888816896.db2.gz KHVKOZLTQHWUCA-NRFANRHFSA-N 0 3 421.029 4.287 20 0 HIADHN COc1ccc(CN[C@@H]2CCN(c3ccc(Cl)cc3Cl)C2)c(OC)c1OC ZINC000473989721 888851114 /nfs/dbraw/zinc/85/11/14/888851114.db2.gz MDNUXUUALPZNID-OAHLLOKOSA-N 0 3 411.329 4.388 20 0 HIADHN CSc1cccc(C)c1NC(=O)NCCCN1CCN(C)C[C@@H]1c1ccccc1 ZINC000473990662 888852908 /nfs/dbraw/zinc/85/29/08/888852908.db2.gz KGZPILJLUMKCNH-HXUWFJFHSA-N 0 3 412.603 4.217 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@@H]1C[C@H]1c1cnn(-c2ccccc2)c1)c1ccsc1 ZINC000474034287 888880327 /nfs/dbraw/zinc/88/03/27/888880327.db2.gz MHYIAHAITAPWRU-BHDDXSALSA-N 0 3 423.586 4.172 20 0 HIADHN COc1ccc2c(c1)C(C)(C)C[C@H]2NCc1ccccc1CS(=O)(=O)NC(C)C ZINC000474033738 888880698 /nfs/dbraw/zinc/88/06/98/888880698.db2.gz LRZSROGJDOZEIS-JOCHJYFZSA-N 0 3 416.587 4.035 20 0 HIADHN O=C(N[C@H](CO)c1c(Cl)cccc1Cl)N[C@H](CN1CCCC1)c1ccccc1 ZINC000474037412 888882628 /nfs/dbraw/zinc/88/26/28/888882628.db2.gz VLTLNLLEYJURGR-RTBURBONSA-N 0 3 422.356 4.163 20 0 HIADHN Cc1ccc(CNC(=O)NC(C)(C)CCN2CCN(C)CC2)c(Oc2ccccc2)c1 ZINC000474057233 888893170 /nfs/dbraw/zinc/89/31/70/888893170.db2.gz MROMPLRTXFWADF-UHFFFAOYSA-N 0 3 424.589 4.003 20 0 HIADHN CN(C)CCN(C(=O)CNC(=O)c1sc2ccccc2c1Cl)C1CCCCC1 ZINC000474054995 888893249 /nfs/dbraw/zinc/89/32/49/888893249.db2.gz GDTUWTWPTVIKGF-UHFFFAOYSA-N 0 3 421.994 4.007 20 0 HIADHN COc1ccc2c(c1)C(C)(C)C[C@@H]2NCc1cccc(NC(=O)Cn2cccn2)c1 ZINC000474057157 888893322 /nfs/dbraw/zinc/89/33/22/888893322.db2.gz OKHOSIJPJGHJAW-QFIPXVFZSA-N 0 3 404.514 4.043 20 0 HIADHN C[C@H](CC(=O)N(C)c1ccccc1)N[C@H]1CCN(c2ccc(Cl)cc2Cl)C1=O ZINC000474108064 888929001 /nfs/dbraw/zinc/92/90/01/888929001.db2.gz UPRLHMBYJHZSQD-KDOFPFPSSA-N 0 3 420.340 4.130 20 0 HIADHN CCC(CC)[C@@H](NC(=O)N1CCN(c2ccncc2OC)CC1)c1cccs1 ZINC000474132267 888952577 /nfs/dbraw/zinc/95/25/77/888952577.db2.gz BZLSPWJEJVPTAE-HXUWFJFHSA-N 0 3 402.564 4.161 20 0 HIADHN COc1ccc(C(=O)CCCCCC(=O)N2CCN(C3CCCCC3)CC2)cc1 ZINC000474240316 889086930 /nfs/dbraw/zinc/08/69/30/889086930.db2.gz VYJZCDKWGCDFGU-UHFFFAOYSA-N 0 3 400.563 4.305 20 0 HIADHN Cc1nc2ccccc2n1C1CCN(C(=O)NC[C@@H](c2ccc(C)cc2)N(C)C)CC1 ZINC000474251768 889104000 /nfs/dbraw/zinc/10/40/00/889104000.db2.gz YMPDYGQVMXOTTA-DEOSSOPVSA-N 0 3 419.573 4.303 20 0 HIADHN Cc1csc(N2CCC(N[C@@H]3COc4cc(F)c(Br)cc43)CC2)n1 ZINC000504556662 913329794 /nfs/dbraw/zinc/32/97/94/913329794.db2.gz WJZFNKQHCZEAIM-OAHLLOKOSA-N 0 3 412.328 4.045 20 0 HIADHN NC(=O)Nc1ccc(CNCc2ccc(OC(F)(F)F)c(Br)c2)cc1 ZINC000474466354 889330149 /nfs/dbraw/zinc/33/01/49/889330149.db2.gz BYVPIFWZYRTRFL-UHFFFAOYSA-N 0 3 418.213 4.128 20 0 HIADHN NC(=O)Nc1ccc(CNCc2ccc(Br)cc2C(F)(F)F)cc1 ZINC000474474193 889335579 /nfs/dbraw/zinc/33/55/79/889335579.db2.gz RWANBJVQSOTECP-UHFFFAOYSA-N 0 3 402.214 4.248 20 0 HIADHN CCN(C(=O)c1cccc(-c2n[nH]c(C)n2)c1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000474521104 889389836 /nfs/dbraw/zinc/38/98/36/889389836.db2.gz OXHYWTXVESMBEQ-VGOFRKELSA-N 0 3 403.530 4.078 20 0 HIADHN C[C@@H](NC(=O)N(CCCc1ccccc1)CCN(C)C)c1noc(-c2ccccc2)n1 ZINC000474524002 889394756 /nfs/dbraw/zinc/39/47/56/889394756.db2.gz QWYXTERKLHBIQA-LJQANCHMSA-N 0 3 421.545 4.004 20 0 HIADHN C[C@H](Sc1nnnn1CCN(C)C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000504585771 913347453 /nfs/dbraw/zinc/34/74/53/913347453.db2.gz PKKOKXSTFGLOPP-VIFPVBQESA-N 0 3 413.391 4.126 20 0 HIADHN COCc1cccc2sc(NC(=O)N(C)[C@H]3CCN(Cc4ccccc4)C3)nc21 ZINC000474631636 889494670 /nfs/dbraw/zinc/49/46/70/889494670.db2.gz SWRMQRVJPRDNDU-SFHVURJKSA-N 0 3 410.543 4.181 20 0 HIADHN Cc1noc(C)c1COc1ccccc1C(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C ZINC000474670375 889533745 /nfs/dbraw/zinc/53/37/45/889533745.db2.gz SRJKKYAOMXKSKC-SBUREZEXSA-N 0 3 407.514 4.292 20 0 HIADHN Cc1cc(C)n(-c2ccc(Cl)c(C(=O)N[C@H](CN3CCCC3)c3ccccc3)n2)n1 ZINC000474697904 889558083 /nfs/dbraw/zinc/55/80/83/889558083.db2.gz PGBYSBMVPSQLCB-HXUWFJFHSA-N 0 3 423.948 4.104 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)c(C)c1 ZINC000474729374 889585364 /nfs/dbraw/zinc/58/53/64/889585364.db2.gz GJGHJUAXVREISJ-SIKLNZKXSA-N 0 3 422.573 4.262 20 0 HIADHN CN(C)[C@H](CNC(=O)C1(c2cc(F)cc(Br)c2)CC1)c1ccccc1 ZINC000504606889 913361048 /nfs/dbraw/zinc/36/10/48/913361048.db2.gz ONBLEGJHIXRXLW-GOSISDBHSA-N 0 3 405.311 4.039 20 0 HIADHN Cc1cc(C)n(-c2cccc(NC(=O)N(C)[C@@H]3CCN(Cc4ccccc4)C3)c2)n1 ZINC000474737755 889593383 /nfs/dbraw/zinc/59/33/83/889593383.db2.gz FEXCDDUIMQBJDH-HSZRJFAPSA-N 0 3 403.530 4.227 20 0 HIADHN CN(C)[C@@H](CNC(=O)c1ccc(NC(=O)Nc2ccccc2)s1)Cc1ccccc1 ZINC000474768433 889625713 /nfs/dbraw/zinc/62/57/13/889625713.db2.gz RCIXHCZUXUOUKU-LJQANCHMSA-N 0 3 422.554 4.295 20 0 HIADHN Cc1cc(C)c(C(=O)Nc2cccc(CN(C)C)c2)cc1I ZINC000474772322 889631020 /nfs/dbraw/zinc/63/10/20/889631020.db2.gz CWJVOHCKDPOHPM-UHFFFAOYSA-N 0 3 408.283 4.222 20 0 HIADHN CN1CCN(CCC(C)(C)NC(=O)c2cccc(Oc3ccc(Cl)cc3)c2)CC1 ZINC000474803023 889655360 /nfs/dbraw/zinc/65/53/60/889655360.db2.gz XBMZTRBPLGUHIA-UHFFFAOYSA-N 0 3 415.965 4.278 20 0 HIADHN COc1cc(OC)cc(N2CC[C@@H](CNCc3c(F)cccc3Br)C2)c1 ZINC000474806440 889658958 /nfs/dbraw/zinc/65/89/58/889658958.db2.gz DNIHHVRPXRLIIU-AWEZNQCLSA-N 0 3 423.326 4.222 20 0 HIADHN CC(C)[C@@H]([NH2+]CCCCc1cccc(C(F)(F)F)c1)c1nc(-c2nc[n-]n2)no1 ZINC000474806837 889660225 /nfs/dbraw/zinc/66/02/25/889660225.db2.gz YUKPCTCJZSHECE-OAHLLOKOSA-N 0 3 408.428 4.183 20 0 HIADHN CC(C)[C@@H](NCCCCc1cccc(C(F)(F)F)c1)c1nc(-c2nc[nH]n2)no1 ZINC000474806837 889660232 /nfs/dbraw/zinc/66/02/32/889660232.db2.gz YUKPCTCJZSHECE-OAHLLOKOSA-N 0 3 408.428 4.183 20 0 HIADHN Cc1ccc(CCCN[C@@H](c2ccc(F)cc2)c2cccc(S(C)(=O)=O)c2)cn1 ZINC000474866715 889721650 /nfs/dbraw/zinc/72/16/50/889721650.db2.gz FKECBAYWXNOMIU-QHCPKHFHSA-N 0 3 412.530 4.244 20 0 HIADHN C[C@H]([NH2+][C@H](c1nc(-c2nc[n-]n2)no1)C(C)(C)C)C1CCC(C(F)(F)F)CC1 ZINC000474882102 889736780 /nfs/dbraw/zinc/73/67/80/889736780.db2.gz KEHUCGVOLSGCPZ-YWPUVAFDSA-N 0 3 400.449 4.289 20 0 HIADHN C[C@@H](N[C@@H](c1nc(-c2nc[nH]n2)no1)C(C)(C)C)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000474885823 889741895 /nfs/dbraw/zinc/74/18/95/889741895.db2.gz WXKCUDLYNMFTRD-DEKYYXRVSA-N 0 3 406.943 4.439 20 0 HIADHN C[C@@H]([NH2+][C@@H](c1nc(-c2nc[n-]n2)no1)C(C)(C)C)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000474885823 889741914 /nfs/dbraw/zinc/74/19/14/889741914.db2.gz WXKCUDLYNMFTRD-DEKYYXRVSA-N 0 3 406.943 4.439 20 0 HIADHN CC(C)(C)[C@@H]1C[C@H](NCc2c(F)ccc(I)c2F)CCO1 ZINC000474894837 889753426 /nfs/dbraw/zinc/75/34/26/889753426.db2.gz UAUUHZFFULLAID-YGRLFVJLSA-N 0 3 409.258 4.253 20 0 HIADHN O=C(Nc1ccc(-c2ncc[nH]2)cc1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000504628310 913381306 /nfs/dbraw/zinc/38/13/06/913381306.db2.gz KAJWPXRVAVSHAA-OAQYLSRUSA-N 0 3 414.431 4.470 20 0 HIADHN Cn1cc(-c2ncc(CN3CCC(c4ccc(C(F)(F)F)cc4)CC3)cn2)cn1 ZINC000474933930 889791437 /nfs/dbraw/zinc/79/14/37/889791437.db2.gz XYBLUNRPPKUNQY-UHFFFAOYSA-N 0 3 401.436 4.276 20 0 HIADHN CCN(C(=O)Nc1ccc(N2CCCC2=O)c(F)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475007564 889860518 /nfs/dbraw/zinc/86/05/18/889860518.db2.gz ICOVXJKZSKCYAA-FQEVSTJZSA-N 0 3 424.520 4.081 20 0 HIADHN C[C@H](NC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1)c1ncc(-c2ccccc2)o1 ZINC000475114382 889966470 /nfs/dbraw/zinc/96/64/70/889966470.db2.gz HMRNPFYVMNKHKF-GHTZIAJQSA-N 0 3 404.514 4.319 20 0 HIADHN CN(C(=O)NCc1ccc(OCC(F)(F)F)cc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475127202 889987963 /nfs/dbraw/zinc/98/79/63/889987963.db2.gz BIYYAEOGQOWUBA-LJQANCHMSA-N 0 3 421.463 4.044 20 0 HIADHN CC(C)CC(=O)Nc1cccc(CNC(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000475128718 889990656 /nfs/dbraw/zinc/99/06/56/889990656.db2.gz HSLGFURTAVSYLX-QHCPKHFHSA-N 0 3 422.573 4.087 20 0 HIADHN Brc1cccc(CN(Cc2cnc(N3CCOCC3)s2)CC2CC2)c1 ZINC000475153231 890018652 /nfs/dbraw/zinc/01/86/52/890018652.db2.gz GAUWQJLNJFOPTC-UHFFFAOYSA-N 0 3 422.392 4.154 20 0 HIADHN CCN(C(=O)N[C@@H](C)c1cn(C(C)(C)C)nc1C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475166898 890032888 /nfs/dbraw/zinc/03/28/88/890032888.db2.gz XZYJHKUHQDVXNB-GHTZIAJQSA-N 0 3 411.594 4.314 20 0 HIADHN CCN(C(=O)N[C@@H](C)c1cccc(-n2cccn2)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475172765 890040032 /nfs/dbraw/zinc/04/00/32/890040032.db2.gz IOOJNGKGLFYCRK-RDPSFJRHSA-N 0 3 417.557 4.239 20 0 HIADHN CCN(C(=O)NCc1csc(Br)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475179669 890049360 /nfs/dbraw/zinc/04/93/60/890049360.db2.gz WRXUPYPJDWXKOG-KRWDZBQOSA-N 0 3 422.392 4.317 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)NC(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000475278519 890175466 /nfs/dbraw/zinc/17/54/66/890175466.db2.gz HNHJSIPGVWYPMW-YADARESESA-N 0 3 417.557 4.158 20 0 HIADHN Cc1ccc(-n2nc(C(=O)N(C)[C@@H]3CCN(Cc4ccccc4)C3)c3c2CCC3)cc1 ZINC000475307873 890218472 /nfs/dbraw/zinc/21/84/72/890218472.db2.gz IHJSXAGPDKEPLP-JOCHJYFZSA-N 0 3 414.553 4.016 20 0 HIADHN CC(C)CC(=O)Nc1ccc(C(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)cc1F ZINC000475317675 890233295 /nfs/dbraw/zinc/23/32/95/890233295.db2.gz ORBOGTANJSLMGC-FQEVSTJZSA-N 0 3 411.521 4.157 20 0 HIADHN Cc1ccc([C@@H](N[C@@H](C)CCCOc2ccccc2C(N)=O)c2ccccn2)cc1 ZINC000475332503 890251805 /nfs/dbraw/zinc/25/18/05/890251805.db2.gz HKPMKPZYUBYXMZ-YADARESESA-N 0 3 403.526 4.416 20 0 HIADHN COc1ccc(C2CCC(N[C@@H](C(N)=O)c3cccc(Br)c3)CC2)cc1 ZINC000475426603 890346264 /nfs/dbraw/zinc/34/62/64/890346264.db2.gz XSMOTVZBIPILCY-FPMRRHDISA-N 0 3 417.347 4.300 20 0 HIADHN CCc1c(C(=O)Nc2ccc(N3CCN(CC)CC3)cc2C)cnn1C1CCCC1 ZINC000475482094 890388402 /nfs/dbraw/zinc/38/84/02/890388402.db2.gz YWQNZEPZOGGWLA-UHFFFAOYSA-N 0 3 409.578 4.263 20 0 HIADHN Cc1nc(CC(C)C)oc1C(=O)N(CCN(C)C)Cc1ccc(Br)cc1 ZINC000475505576 890419759 /nfs/dbraw/zinc/41/97/59/890419759.db2.gz VLUXVOPBDVAIFQ-UHFFFAOYSA-N 0 3 422.367 4.148 20 0 HIADHN CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)N[C@H]1CC[C@H](c2cccc(F)c2)C1 ZINC000475517742 890434924 /nfs/dbraw/zinc/43/49/24/890434924.db2.gz KBNFPPSUIVFCPV-HMNCIZAVSA-N 0 3 410.537 4.191 20 0 HIADHN C[C@H](NCc1ccc(Br)c2cccnc12)C(=O)N1Cc2ccccc2C1 ZINC000475516948 890436218 /nfs/dbraw/zinc/43/62/18/890436218.db2.gz PIIACUYZKLYULB-AWEZNQCLSA-N 0 3 410.315 4.018 20 0 HIADHN CN(C(=O)c1ccnc(OCc2ccccc2)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475541747 890466543 /nfs/dbraw/zinc/46/65/43/890466543.db2.gz HHPAFVIOWIRNLO-QHCPKHFHSA-N 0 3 401.510 4.007 20 0 HIADHN CCCOc1ccc(CN2CCC[C@@H](N(C)Cc3noc(C)n3)CC2)cc1OCC ZINC000475628006 890567228 /nfs/dbraw/zinc/56/72/28/890567228.db2.gz VHMQOHCIXUJLHE-HXUWFJFHSA-N 0 3 416.566 4.052 20 0 HIADHN Cc1nc(CN(C)[C@@H]2CCCN(Cc3c(Cl)cccc3N3CCCC3)CC2)no1 ZINC000475630319 890570945 /nfs/dbraw/zinc/57/09/45/890570945.db2.gz ZJCRHAXROXLLGI-GOSISDBHSA-N 0 3 417.985 4.118 20 0 HIADHN CCN(C(=O)c1ccn(-c2c(F)cccc2F)n1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000475656207 890600967 /nfs/dbraw/zinc/60/09/67/890600967.db2.gz MNWSFBAHDNVLEJ-MJGOQNOKSA-N 0 3 424.495 4.448 20 0 HIADHN CCN(C(=O)c1ccc(OCCCOC)cc1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000475656977 890602904 /nfs/dbraw/zinc/60/29/04/890602904.db2.gz RRKXBGPWUOOPOF-NZQKXSOJSA-N 0 3 410.558 4.400 20 0 HIADHN O=C(CN1CCC[C@@]1(CO)Cc1ccccc1)Nc1ccccc1-c1ccccc1 ZINC000475686041 890627310 /nfs/dbraw/zinc/62/73/10/890627310.db2.gz JKTDWKCLGJHXCQ-SANMLTNESA-N 0 3 400.522 4.362 20 0 HIADHN C[C@H](c1ccc([S@](C)=O)cc1)N(C)CCc1nc(-c2cccc(Cl)c2)no1 ZINC000475725626 890663407 /nfs/dbraw/zinc/66/34/07/890663407.db2.gz DBBYACQSILGDSO-ASHKIFAZSA-N 0 3 403.935 4.363 20 0 HIADHN C[C@H](c1ccc(Cl)cc1)[C@@H](C)N(C)Cc1ccc(S(=O)(=O)N2CCCC2)o1 ZINC000475729228 890666986 /nfs/dbraw/zinc/66/69/86/890666986.db2.gz DXBWVWRNXCNEIJ-JKSUJKDBSA-N 0 3 410.967 4.342 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)c1ccc2nc(-c3ccccc3)oc2c1 ZINC000475758329 890706028 /nfs/dbraw/zinc/70/60/28/890706028.db2.gz LRMAQBJNVXARTM-UHFFFAOYSA-N 0 3 400.482 4.094 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N(C)Cc2nc3c(s2)CCCC3)N(C)C)cc1 ZINC000475985226 890900528 /nfs/dbraw/zinc/90/05/28/890900528.db2.gz MENQGHXLKSSJEQ-IBGZPJMESA-N 0 3 400.592 4.029 20 0 HIADHN CC[C@H](NC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1CO)c1ccc(Cl)s1 ZINC000476026705 890958923 /nfs/dbraw/zinc/95/89/23/890958923.db2.gz CGPQOXWIVCBMJY-BZSNNMDCSA-N 0 3 421.994 4.035 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N[C@H](c2ccc(Cl)cc2)[C@H]2C[C@H]2C)CC1 ZINC000476037603 890968373 /nfs/dbraw/zinc/96/83/73/890968373.db2.gz ZEVDPMPMWCKUGM-TYCQWZJGSA-N 0 3 407.986 4.226 20 0 HIADHN COc1cccc([C@@H]2CCCN2C(=O)NCC(C)(C)N2CCc3ccccc3C2)c1 ZINC000504779354 913508183 /nfs/dbraw/zinc/50/81/83/913508183.db2.gz PKTOFEYNWJSYFM-QHCPKHFHSA-N 0 3 407.558 4.379 20 0 HIADHN COc1cc([C@H](C)NC(=O)N(C)[C@@H]2CCN(C3CC3)C2)ccc1OCCC(C)C ZINC000476163624 891091194 /nfs/dbraw/zinc/09/11/94/891091194.db2.gz RWGZHSKDJYLNDC-FXAWDEMLSA-N 0 3 403.567 4.059 20 0 HIADHN CC(C)c1nc2c([nH]1)CC[C@H](C(=O)NCc1ccccc1CN(C)Cc1ccco1)C2 ZINC000476176645 891107020 /nfs/dbraw/zinc/10/70/20/891107020.db2.gz VAACYYDLZXITRJ-SFHVURJKSA-N 0 3 420.557 4.179 20 0 HIADHN CCc1onc(-c2ccc(Br)cc2)c1C(=O)N[C@H]1C[C@H](C)N(C2CC2)C1 ZINC000476297298 891211577 /nfs/dbraw/zinc/21/15/77/891211577.db2.gz DGBAFUDDMNTCHR-WFASDCNBSA-N 0 3 418.335 4.022 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)[C@H]1CCCc2c(O)cccc21 ZINC000476334486 891238859 /nfs/dbraw/zinc/23/88/59/891238859.db2.gz PYCHDWWPYJUKGD-KNQAVFIVSA-N 0 3 416.525 4.094 20 0 HIADHN CCN(C(=O)Nc1ccc2nnc(C3CCC3)n2c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000476374456 891287769 /nfs/dbraw/zinc/28/77/69/891287769.db2.gz DRMNBEOMNHAJTK-NRFANRHFSA-N 0 3 418.545 4.125 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1cc2[nH]ccc2s1 ZINC000476414543 891328048 /nfs/dbraw/zinc/32/80/48/891328048.db2.gz XJVKJHQGMAMEPZ-QGZVFWFLSA-N 0 3 405.527 4.434 20 0 HIADHN CC[C@@H]1CN(C(=O)NC2CCN(CCOC(C)C)CC2)CC[C@H]1c1ccccc1 ZINC000476446563 891358437 /nfs/dbraw/zinc/35/84/37/891358437.db2.gz IQFMUFBMGSAJRI-NFBKMPQASA-N 0 3 401.595 4.101 20 0 HIADHN c1cnc(N2CCCCC2)c(-c2noc(-c3ccc(CN4CCSCC4)cc3)n2)c1 ZINC000504833204 913554439 /nfs/dbraw/zinc/55/44/39/913554439.db2.gz GUDNFVIXTBRMOW-UHFFFAOYSA-N 0 3 421.570 4.338 20 0 HIADHN CCN(C(=O)NC1CCN(CCOC(C)C)CC1)[C@H](C)c1cc2ccccc2o1 ZINC000476451064 891362365 /nfs/dbraw/zinc/36/23/65/891362365.db2.gz XBIZZDMUGDEHOE-GOSISDBHSA-N 0 3 401.551 4.415 20 0 HIADHN Cc1cccc([C@H]2CCCCN2C(=O)NC2CCN(CCOC(C)C)CC2)c1C ZINC000476455276 891367824 /nfs/dbraw/zinc/36/78/24/891367824.db2.gz XBRVOSXQSLUFFM-HSZRJFAPSA-N 0 3 401.595 4.429 20 0 HIADHN Cc1nc2ccc(Br)cn2c1C(=O)Nc1cc(C)cc(CN(C)C)c1 ZINC000476478528 891387769 /nfs/dbraw/zinc/38/77/69/891387769.db2.gz BGYZHPXQXNZYNH-UHFFFAOYSA-N 0 3 401.308 4.028 20 0 HIADHN C[C@@H]1CC[C@@H](C)N1CC(=O)N[C@H](Cc1ccccn1)c1ccc(Br)cc1 ZINC000476538117 891452944 /nfs/dbraw/zinc/45/29/44/891452944.db2.gz GVHARADHTATJPK-JXXFODFXSA-N 0 3 416.363 4.117 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)N(Cc2ccccc2)CC2CCOCC2)N(C)C)cc1 ZINC000476633575 891570785 /nfs/dbraw/zinc/57/07/85/891570785.db2.gz WNTMSHGYUWCCMD-RUZDIDTESA-N 0 3 423.601 4.490 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(Cl)cc2)CC1)c1c(F)ccc(F)c1F ZINC000476759007 891731350 /nfs/dbraw/zinc/73/13/50/891731350.db2.gz JIUMMCHQKMCUJY-UHFFFAOYSA-N 0 3 412.839 4.031 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N2CCC[C@@]3(C2)OCc2ccccc23)C1 ZINC000476892653 891851431 /nfs/dbraw/zinc/85/14/31/891851431.db2.gz ZSMRGXHDRCPNFQ-QNIAMRLHSA-N 0 3 405.542 4.053 20 0 HIADHN CCC(=O)Nc1ccc(Cl)c(NC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000504881386 913610272 /nfs/dbraw/zinc/61/02/72/913610272.db2.gz HOVMEABXNZMRLR-GOSISDBHSA-N 0 3 414.937 4.475 20 0 HIADHN C[C@@H](NC(=O)Nc1cccc(-c2noc(C3CC3)n2)c1)[C@@H](c1ccccc1)N(C)C ZINC000477071062 892004956 /nfs/dbraw/zinc/00/49/56/892004956.db2.gz RMZNXPWJIUSFAP-QRWLVFNGSA-N 0 3 405.502 4.427 20 0 HIADHN CCOc1ccc(Oc2ccc(NC(=O)NC[C@H]3CCCN3CCOC)cc2)cc1 ZINC000477133597 892061617 /nfs/dbraw/zinc/06/16/17/892061617.db2.gz MSPBECAOQXJRLS-LJQANCHMSA-N 0 3 413.518 4.110 20 0 HIADHN COc1cccc(Cl)c1-c1noc(C)c1C(=O)NC[C@H]1N(C)CCCC1(C)C ZINC000477153614 892077626 /nfs/dbraw/zinc/07/76/26/892077626.db2.gz USTBBNSHMJBWLR-MRXNPFEDSA-N 0 3 405.926 4.162 20 0 HIADHN COCCN1CCC[C@H]1CNC(=O)N(Cc1ccc(Cl)c(Cl)c1)C(C)C ZINC000477162662 892085859 /nfs/dbraw/zinc/08/58/59/892085859.db2.gz ONUKWOZQNBAUNK-INIZCTEOSA-N 0 3 402.366 4.024 20 0 HIADHN Cc1onc(-c2ccccc2C)c1C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000477169855 892091436 /nfs/dbraw/zinc/09/14/36/892091436.db2.gz VUCGXEQQRNGCGT-UHFFFAOYSA-N 0 3 421.463 4.494 20 0 HIADHN CN1CC[C@H](NC(=O)N2CCO[C@H](c3ccc(F)cc3Cl)C2)[C@H]1c1ccccc1 ZINC000477173482 892094509 /nfs/dbraw/zinc/09/45/09/892094509.db2.gz BWYQZLDSFFUVQW-PCCBWWKXSA-N 0 3 417.912 4.007 20 0 HIADHN CC[C@@H](C)C(=O)Nc1cccc(CNC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000504904248 913636869 /nfs/dbraw/zinc/63/68/69/913636869.db2.gz VKZCACYRBUPLRY-AUSIDOKSSA-N 0 3 422.573 4.135 20 0 HIADHN C[C@@H](C(=O)N(C)Cc1ccc(Br)cc1)N1CC[C@H](c2ccccc2)C1 ZINC000477242223 892189040 /nfs/dbraw/zinc/18/90/40/892189040.db2.gz HELZMCPRBACXOW-LPHOPBHVSA-N 0 3 401.348 4.286 20 0 HIADHN COc1ccc([C@H](N[C@H](C)C(=O)N[C@@H](C)c2cc(OC)ccc2OC)C2CC2)cc1 ZINC000477326738 892294198 /nfs/dbraw/zinc/29/41/98/892294198.db2.gz WHBBAICGRFRELY-NXHTTZLHSA-N 0 3 412.530 4.019 20 0 HIADHN CCn1ncc2ccc(NC(=O)NC[C@@H](c3cccc(OC)c3)N3CCCC3)cc21 ZINC000477401577 892356205 /nfs/dbraw/zinc/35/62/05/892356205.db2.gz ABKWEEWVALHIRL-QFIPXVFZSA-N 0 3 407.518 4.023 20 0 HIADHN Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)NC(=O)N(C)[C@@H]1CCN(C2CC2)C1 ZINC000477475388 892455431 /nfs/dbraw/zinc/45/54/31/892455431.db2.gz YCHXQHHUISCRNW-KBXCAEBGSA-N 0 3 402.539 4.197 20 0 HIADHN C[C@H](c1cccc(C(F)(F)F)c1)N(C)S(=O)(=O)c1ccc(CN(C)C)cc1 ZINC000477512719 892525793 /nfs/dbraw/zinc/52/57/93/892525793.db2.gz FHSIZLFHCPDUIA-CQSZACIVSA-N 0 3 400.466 4.149 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@@H](C)c2cn(C)c3ccccc23)cc1 ZINC000477621846 892728170 /nfs/dbraw/zinc/72/81/70/892728170.db2.gz NHOPOTHSAZRYOT-FDDCHVKYSA-N 0 3 405.542 4.244 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1c(F)cccc1Br ZINC000477732544 892831358 /nfs/dbraw/zinc/83/13/58/892831358.db2.gz UMQXCDAXJAFSJW-UHFFFAOYSA-N 0 3 421.310 4.045 20 0 HIADHN CC(C)(C)c1ccc(OCC(=O)Nc2cccc(CN3CCC(CO)CC3)c2)cc1 ZINC000477739520 892835523 /nfs/dbraw/zinc/83/55/23/892835523.db2.gz CKDRNWSOXFYCGF-UHFFFAOYSA-N 0 3 410.558 4.206 20 0 HIADHN CC(=O)N(C)c1cccc(NC(=O)N[C@H](CN2CCc3ccccc3C2)C(C)(C)C)c1 ZINC000477779201 892862953 /nfs/dbraw/zinc/86/29/53/892862953.db2.gz IASDKCVWLVBCDZ-HSZRJFAPSA-N 0 3 422.573 4.264 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)Nc1ccccc1N1CCCCC1 ZINC000504969440 913706913 /nfs/dbraw/zinc/70/69/13/913706913.db2.gz BIUHKFMRIZOCGV-UHFFFAOYSA-N 0 3 402.608 4.160 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)c1cccnc1OCc1ccccc1F ZINC000477821594 892888367 /nfs/dbraw/zinc/88/83/67/892888367.db2.gz MQNJJWHSIMYFPQ-UHFFFAOYSA-N 0 3 407.489 4.004 20 0 HIADHN O=C(NCc1ncoc1-c1ccccc1)NC[C@@H]1CCCCN1Cc1ccccc1 ZINC000477836649 892897449 /nfs/dbraw/zinc/89/74/49/892897449.db2.gz XAJJBVWOLMGVHD-NRFANRHFSA-N 0 3 404.514 4.196 20 0 HIADHN COC(=O)c1csc(-c2cccc(CN[C@H](C)c3ccc([S@@](C)=O)cc3)c2)n1 ZINC000477849236 892908434 /nfs/dbraw/zinc/90/84/34/892908434.db2.gz OYHALOCLDQXHCA-GMYLUUGSSA-N 0 3 414.552 4.185 20 0 HIADHN COC(=O)c1csc(-c2cccc(CN[C@H](C)c3ccc(OC)c(OC)c3)c2)n1 ZINC000477869035 892927769 /nfs/dbraw/zinc/92/77/69/892927769.db2.gz WWVLRWVFWJUYMJ-CQSZACIVSA-N 0 3 412.511 4.465 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)NCCc2cccc3cccnc32)N(C)C)cc1 ZINC000477904185 892977477 /nfs/dbraw/zinc/97/74/77/892977477.db2.gz DLQYOUPMONRVSV-HSZRJFAPSA-N 0 3 420.557 4.167 20 0 HIADHN C[C@H](N[C@@H]1CCCc2nc(-c3ccc(Br)cc3)sc21)C(=O)N(C)C ZINC000477908880 892982406 /nfs/dbraw/zinc/98/24/06/892982406.db2.gz CINCMZFRLNBRFO-SMDDNHRTSA-N 0 3 408.365 4.016 20 0 HIADHN Cc1ccc(CN2CC[C@H](N[C@H](C)CC(=O)Nc3ccc(C(C)C)cc3)C2=O)cc1 ZINC000477917630 893002374 /nfs/dbraw/zinc/00/23/74/893002374.db2.gz NVOGZRNGVNYKLR-XXBNENTESA-N 0 3 407.558 4.226 20 0 HIADHN O=C(CSCc1ccccn1)N(CCN1CCCC1)Cc1ccc(Cl)cc1 ZINC000477979597 893077462 /nfs/dbraw/zinc/07/74/62/893077462.db2.gz BPLWJWZYJSQYQY-UHFFFAOYSA-N 0 3 403.979 4.093 20 0 HIADHN Cc1c(NC(=O)N[C@@H](CN(C)C)c2ccc(F)cc2)cnn1-c1cc(C)ccc1C ZINC000478068505 893229165 /nfs/dbraw/zinc/22/91/65/893229165.db2.gz CYLZLJJNOJMCLF-NRFANRHFSA-N 0 3 409.509 4.361 20 0 HIADHN CC[C@@H](C)NC(=O)CCNCc1cn(-c2ccc(Br)cc2)nc1C(C)C ZINC000478216264 893376082 /nfs/dbraw/zinc/37/60/82/893376082.db2.gz YXDMHJSUURPYMK-OAHLLOKOSA-N 0 3 421.383 4.153 20 0 HIADHN CCN(CC(=O)Nc1c(Cl)cccc1Cl)C(=O)[C@H](C)N1[C@H](C)CC[C@@H]1C ZINC000478231935 893394257 /nfs/dbraw/zinc/39/42/57/893394257.db2.gz HEXRGXRXFXTTIV-MJBXVCDLSA-N 0 3 400.350 4.042 20 0 HIADHN CCOc1c(Cl)cccc1CC(=O)NC1CCN([C@H](C)c2ccncc2)CC1 ZINC000478322662 893551717 /nfs/dbraw/zinc/55/17/17/893551717.db2.gz BXMHMFBOHYQLSQ-MRXNPFEDSA-N 0 3 401.938 4.018 20 0 HIADHN C[C@@H](NCc1ccc(N2CCCS2(=O)=O)c(F)c1)c1ccc(F)c(Cl)c1 ZINC000478445000 893753606 /nfs/dbraw/zinc/75/36/06/893753606.db2.gz GUITXROVHPQMAW-GFCCVEGCSA-N 0 3 400.878 4.009 20 0 HIADHN CCc1c(C(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)cnn1C(CC)CC ZINC000478477339 893802751 /nfs/dbraw/zinc/80/27/51/893802751.db2.gz FIHSGUOBCTTYMX-KDURUIRLSA-N 0 3 418.626 4.158 20 0 HIADHN CC(C)[C@@H](C(=O)N[C@@H](C)c1nc(-c2ccc(Br)cc2)cs1)N(C)C ZINC000478503067 893816849 /nfs/dbraw/zinc/81/68/49/893816849.db2.gz DQCGXWJGZANFMX-LRDDRELGSA-N 0 3 410.381 4.336 20 0 HIADHN C[C@H](Cc1ccc(C(F)(F)F)cc1)NC(=O)N(CCN(C)C)Cc1ccccc1 ZINC000478632659 893886832 /nfs/dbraw/zinc/88/68/32/893886832.db2.gz QNIHYSOESHMBOP-QGZVFWFLSA-N 0 3 407.480 4.410 20 0 HIADHN O=C(N[C@@H](c1ccccc1)c1ccccn1)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000505105588 913819825 /nfs/dbraw/zinc/81/98/25/913819825.db2.gz QMWHNOLKWAMFBE-GMAHTHKFSA-N 0 3 421.491 4.445 20 0 HIADHN CC[C@@H](CNC(=O)N1CC2(CCOCC2)c2ccccc21)N1CCc2ccccc2C1 ZINC000478758535 894035546 /nfs/dbraw/zinc/03/55/46/894035546.db2.gz KWPVRADNUQZOEP-QFIPXVFZSA-N 0 3 419.569 4.101 20 0 HIADHN C[C@@H](NC(=O)NCc1ccnc(OCc2ccccc2)c1)[C@@H](c1ccccc1)N(C)C ZINC000478770995 894047131 /nfs/dbraw/zinc/04/71/31/894047131.db2.gz OKUZBNHSTXVBNQ-DVECYGJZSA-N 0 3 418.541 4.151 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2cccc(Cl)c2N(C)C)c1 ZINC000478790779 894066982 /nfs/dbraw/zinc/06/69/82/894066982.db2.gz WOPAZXCOEBAGCG-UHFFFAOYSA-N 0 3 404.942 4.010 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2ccccc2-n2nc(C)cc2C)c1 ZINC000478790330 894067635 /nfs/dbraw/zinc/06/76/35/894067635.db2.gz VWSARKCPRKQKQH-UHFFFAOYSA-N 0 3 421.545 4.093 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)NCCc2ccccc2C(F)(F)F)c1 ZINC000478796204 894071475 /nfs/dbraw/zinc/07/14/75/894071475.db2.gz KCQVPDVXKAUCNI-UHFFFAOYSA-N 0 3 423.479 4.030 20 0 HIADHN CCc1cc(C(=O)N(CCN(C)Cc2ccccc2)Cc2ccccc2)cc(=O)[nH]1 ZINC000478872665 894150861 /nfs/dbraw/zinc/15/08/61/894150861.db2.gz KPVGHDLLJWFOFZ-UHFFFAOYSA-N 0 3 403.526 4.124 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3CC[C@H](c4ccc(F)cc4)C3)c(C)c2)CC1 ZINC000478908195 894188076 /nfs/dbraw/zinc/18/80/76/894188076.db2.gz DUKRQTIXHHSNFH-FQEVSTJZSA-N 0 3 410.537 4.297 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2ccc(-c3nccs3)cc2)c1 ZINC000478980654 894257618 /nfs/dbraw/zinc/25/76/18/894257618.db2.gz BAQWJPKJILJIIY-UHFFFAOYSA-N 0 3 410.543 4.414 20 0 HIADHN NC(=O)[C@H](NCCCc1cccc(C(F)(F)F)c1)c1cccc(Br)c1 ZINC000479017484 894282727 /nfs/dbraw/zinc/28/27/27/894282727.db2.gz WUXXIKQPEKQTFO-MRXNPFEDSA-N 0 3 415.253 4.217 20 0 HIADHN Cc1nc(-c2ccc(F)c(F)c2)sc1C(=O)NC1CCN(CCOC(C)C)CC1 ZINC000479021915 894287224 /nfs/dbraw/zinc/28/72/24/894287224.db2.gz LYBKOVVLUIGEGM-UHFFFAOYSA-N 0 3 423.529 4.016 20 0 HIADHN COCCSc1ccc([C@H](C)N[C@@H]2CCCN(c3ccccc3F)C2=O)cc1 ZINC000479043253 894303593 /nfs/dbraw/zinc/30/35/93/894303593.db2.gz WCNAPEZLOJHAKP-OXJNMPFZSA-N 0 3 402.535 4.410 20 0 HIADHN CN(C)C(=O)Nc1ccc(CNCc2ccc(Br)c3cccnc23)cc1 ZINC000479053508 894312211 /nfs/dbraw/zinc/31/22/11/894312211.db2.gz FGXMSQWYQQIHLS-UHFFFAOYSA-N 0 3 413.319 4.381 20 0 HIADHN CN(C)C(=O)Nc1ccc(CNCc2ccc(-n3ccc(C(F)(F)F)n3)cc2)cc1 ZINC000479057142 894315851 /nfs/dbraw/zinc/31/58/51/894315851.db2.gz JHFVXAKRLFCGGT-UHFFFAOYSA-N 0 3 417.435 4.274 20 0 HIADHN Cc1cc(C)c(S(N)(=O)=O)cc1[C@@H](C)NCCOc1ccccc1-c1ccccc1 ZINC000479058568 894318589 /nfs/dbraw/zinc/31/85/89/894318589.db2.gz KAYQWRIPTQUSGF-LJQANCHMSA-N 0 3 424.566 4.347 20 0 HIADHN Cc1ccccc1C1(CN[C@@H](C)c2cc(S(N)(=O)=O)c(Cl)cc2Cl)CC1 ZINC000479064686 894326621 /nfs/dbraw/zinc/32/66/21/894326621.db2.gz HNOVIEXGUWELPF-ZDUSSCGKSA-N 0 3 413.370 4.332 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)Nc1ccc(Oc2ccccn2)cc1 ZINC000505203496 913880877 /nfs/dbraw/zinc/88/08/77/913880877.db2.gz JYVZZXYLPQAPDS-UHFFFAOYSA-N 0 3 416.525 4.415 20 0 HIADHN Cc1cc(C)c(S(N)(=O)=O)cc1[C@@H](C)N[C@@H](C)c1ccc(C(F)(F)F)cc1 ZINC000479332237 894625352 /nfs/dbraw/zinc/62/53/52/894625352.db2.gz SLOBOJMAZGVAFV-UONOGXRCSA-N 0 3 400.466 4.381 20 0 HIADHN CS(=O)(=O)Cc1ccc(CN[C@H]2CCCc3cc(Br)ccc32)cc1 ZINC000479331893 894625928 /nfs/dbraw/zinc/62/59/28/894625928.db2.gz SCQSNMXIMXRVDL-IBGZPJMESA-N 0 3 408.361 4.161 20 0 HIADHN C[C@@H](NCC(C)(C)c1ccccc1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479347760 894643555 /nfs/dbraw/zinc/64/35/55/894643555.db2.gz PXBPFCRKZOZDME-GFCCVEGCSA-N 0 3 401.359 4.269 20 0 HIADHN Cc1c(CN[C@H]2CCCc3c(Br)cc(Br)cc32)cnn1C ZINC000479402147 894707279 /nfs/dbraw/zinc/70/72/79/894707279.db2.gz LEMHDHSQXALHTH-INIZCTEOSA-N 0 3 413.157 4.421 20 0 HIADHN Fc1ccc([C@@H](NCCCCn2cc(Br)cn2)c2ccccc2)nc1 ZINC000479466733 894789786 /nfs/dbraw/zinc/78/97/86/894789786.db2.gz SPJTWTQJEPKVPV-IBGZPJMESA-N 0 3 403.299 4.339 20 0 HIADHN CS(=O)(=O)C1(CN[C@H]2CCCc3nc(-c4ccc(Cl)cc4)sc32)CCC1 ZINC000479477030 894800049 /nfs/dbraw/zinc/80/00/49/894800049.db2.gz QWZYDADJVFYGCZ-HNNXBMFYSA-N 0 3 410.992 4.398 20 0 HIADHN Cc1ccc([C@H](Cc2ccccc2Br)NCC2(S(C)(=O)=O)CC2)cc1 ZINC000479479124 894802983 /nfs/dbraw/zinc/80/29/83/894802983.db2.gz XYVNCCTTXGTARF-IBGZPJMESA-N 0 3 422.388 4.208 20 0 HIADHN COc1cccc(NC(=O)[C@H](N[C@H]2CCc3cnn(C(C)C)c3C2)c2ccccc2)c1 ZINC000479484286 894807216 /nfs/dbraw/zinc/80/72/16/894807216.db2.gz AUNQBLRBHZHHRU-XUZZJYLKSA-N 0 3 418.541 4.300 20 0 HIADHN C[C@@H](NCC1(S(C)(=O)=O)CC1)c1ccc(Oc2ccc(Br)cc2)cc1 ZINC000479490429 894810958 /nfs/dbraw/zinc/81/09/58/894810958.db2.gz NMRDSPYPLKNWPS-CQSZACIVSA-N 0 3 424.360 4.469 20 0 HIADHN CC(C)n1ncc2c1C[C@@H](N[C@H](C(=O)Nc1ccc(F)cc1)c1ccccc1)CC2 ZINC000479491836 894811847 /nfs/dbraw/zinc/81/18/47/894811847.db2.gz QPLAWSDJFVIGDK-GMAHTHKFSA-N 0 3 406.505 4.430 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)N1CCNC1=O)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 ZINC000479502096 894818162 /nfs/dbraw/zinc/81/81/62/894818162.db2.gz MIQJTBUJPXQUQO-NEPJUHHUSA-N 0 3 411.449 4.025 20 0 HIADHN COCCCC[C@H](N[C@H](C)c1cc(S(N)(=O)=O)c(C)cc1C)c1ccccc1 ZINC000479500089 894818583 /nfs/dbraw/zinc/81/85/83/894818583.db2.gz PJPLOOXKWQWSIC-NQIIRXRSSA-N 0 3 404.576 4.159 20 0 HIADHN CCc1nc2c(s1)[C@@H](N(C)C(=O)NC[C@@H](C)N(C)Cc1ccccc1)CCC2 ZINC000479525111 894834122 /nfs/dbraw/zinc/83/41/22/894834122.db2.gz DIWQBCOCYKLWBY-APWZRJJASA-N 0 3 400.592 4.245 20 0 HIADHN O=S1(=O)CCCN1c1ccc(CNCc2cc(-c3ccccc3)cs2)cc1F ZINC000479609741 894883530 /nfs/dbraw/zinc/88/35/30/894883530.db2.gz HCBHENIEAOGNMH-UHFFFAOYSA-N 0 3 416.543 4.384 20 0 HIADHN Cc1onc(-c2cccc(Cl)c2)c1C(=O)NCC1(N2CCSCC2)CCCC1 ZINC000479728419 895025142 /nfs/dbraw/zinc/02/51/42/895025142.db2.gz HBVMUYSBDSPNPC-UHFFFAOYSA-N 0 3 419.978 4.395 20 0 HIADHN CN(Cc1ccc(F)cc1Br)C(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000479729340 895027625 /nfs/dbraw/zinc/02/76/25/895027625.db2.gz LJJDLQYGVAMCER-MOPGFXCFSA-N 0 3 420.326 4.175 20 0 HIADHN C[C@@H](NC(=O)N[C@@H](C)c1ccc(NC(=O)C2CC2)cc1)[C@@H](c1ccccc1)N(C)C ZINC000479760449 895061895 /nfs/dbraw/zinc/06/18/95/895061895.db2.gz SHSQWXZVHFRUNK-JKSBSHDWSA-N 0 3 408.546 4.087 20 0 HIADHN C[C@@H](NC[C@@H](c1cccs1)N1CCOCC1)c1cc(Br)ccc1F ZINC000479851199 895183909 /nfs/dbraw/zinc/18/39/09/895183909.db2.gz KMTKOENVLKDITN-DYVFJYSZSA-N 0 3 413.356 4.374 20 0 HIADHN CC(C)N1CCc2nc(CN[C@H]3CCN(c4ccccc4C(F)(F)F)C3)sc2C1 ZINC000479867149 895207277 /nfs/dbraw/zinc/20/72/77/895207277.db2.gz PCOLAGIYMMLTQL-HNNXBMFYSA-N 0 3 424.536 4.297 20 0 HIADHN COc1ccc([C@H](C)NCc2ccc(CN3CCOCC3)cc2)cc1Br ZINC000479879518 895223749 /nfs/dbraw/zinc/22/37/49/895223749.db2.gz KODGJEXMSCJCIK-INIZCTEOSA-N 0 3 419.363 4.141 20 0 HIADHN Cc1ccc(F)cc1CNCc1ccnc(N2CCN(c3ccc(F)cc3)CC2)c1 ZINC000479894237 895241826 /nfs/dbraw/zinc/24/18/26/895241826.db2.gz SXQIOUQOHGFVMA-UHFFFAOYSA-N 0 3 408.496 4.285 20 0 HIADHN CC(C)COC[C@@H](NC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1)c1ccco1 ZINC000505292648 913950539 /nfs/dbraw/zinc/95/05/39/913950539.db2.gz XSGLLHSVSBHLAS-TZIWHRDSSA-N 0 3 402.510 4.161 20 0 HIADHN CC[C@H](Oc1ccccc1C(C)C)C(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000479977608 895331867 /nfs/dbraw/zinc/33/18/67/895331867.db2.gz CTBINSHPIGXYEO-DEOSSOPVSA-N 0 3 424.585 4.241 20 0 HIADHN C[C@H](Sc1ccc(Cl)cc1)C(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000479989292 895341916 /nfs/dbraw/zinc/34/19/16/895341916.db2.gz JYACUZYKVIQDKU-INIZCTEOSA-N 0 3 418.990 4.094 20 0 HIADHN CC(C)Cc1ccc([C@H](CNC(=O)Nc2cn(C)nc2C(F)(F)F)N(C)C)cc1 ZINC000480040752 895389799 /nfs/dbraw/zinc/38/97/99/895389799.db2.gz DLDHPSYNDYKBQH-KRWDZBQOSA-N 0 3 411.472 4.062 20 0 HIADHN CC[C@@H](c1ccccc1)[C@H]1CCCN1CC(=O)Nc1cccc(C(=O)NC2CC2)c1 ZINC000480118888 895491972 /nfs/dbraw/zinc/49/19/72/895491972.db2.gz DWEDSZOKOKMUJT-XZOQPEGZSA-N 0 3 405.542 4.176 20 0 HIADHN Cc1ccccc1C[C@@H](C)N[C@@H]1CCS(=O)(=O)c2ccc(Br)cc21 ZINC000480190091 895588464 /nfs/dbraw/zinc/58/84/64/895588464.db2.gz CYHMTVDBIBBPLG-RDTXWAMCSA-N 0 3 408.361 4.197 20 0 HIADHN CCS[C@@H]1CCC[C@@H](N[C@@H]2CCS(=O)(=O)c3ccc(Br)cc32)C1 ZINC000480194632 895590446 /nfs/dbraw/zinc/59/04/46/895590446.db2.gz AVIQLOVKUJICAD-IIAWOOMASA-N 0 3 418.422 4.322 20 0 HIADHN Cc1ccc(C[C@@H](C)N[C@@H]2CCS(=O)(=O)c3ccc(Br)cc32)s1 ZINC000480206929 895610030 /nfs/dbraw/zinc/61/00/30/895610030.db2.gz BXPLVCVBOSYMFU-BDJLRTHQSA-N 0 3 414.390 4.258 20 0 HIADHN COc1cc(OC)c([C@@H](C)NC[C@H](c2ccccc2)N2CCOCC2)cc1Cl ZINC000480251136 895663107 /nfs/dbraw/zinc/66/31/07/895663107.db2.gz GVROTDXWPVZWJJ-OXQOHEQNSA-N 0 3 404.938 4.081 20 0 HIADHN Cc1cc([C@H]2CN(C(=O)N[C@@H](CN3CCCC3)c3ccccc3)CCO2)ccc1F ZINC000480264420 895672424 /nfs/dbraw/zinc/67/24/24/895672424.db2.gz YIGYABBPFUJMML-XZOQPEGZSA-N 0 3 411.521 4.054 20 0 HIADHN CCS(=O)(=O)Nc1ccc([C@H](C)NCc2ccc(OC(F)(F)F)cc2)cc1 ZINC000480274144 895681144 /nfs/dbraw/zinc/68/11/44/895681144.db2.gz LJIBZDHXDDSQQX-ZDUSSCGKSA-N 0 3 402.438 4.198 20 0 HIADHN COCc1ccccc1CN[C@H]1CCCOc2ccc(I)cc21 ZINC000480276536 895682534 /nfs/dbraw/zinc/68/25/34/895682534.db2.gz UHLNTCNKBGRCKY-SFHVURJKSA-N 0 3 423.294 4.441 20 0 HIADHN Fc1cccc(-c2ccc(CNC[C@H]3CC[C@@H](c4nc(C5CC5)no4)O3)o2)c1F ZINC000480292295 895697707 /nfs/dbraw/zinc/69/77/07/895697707.db2.gz UYHJJLSQYSXIFZ-KDOFPFPSSA-N 0 3 401.413 4.495 20 0 HIADHN COc1ccc(-c2nc3c(s2)[C@@H](NCc2ccc(NC(N)=O)cc2)CCC3)cc1 ZINC000480315816 895718395 /nfs/dbraw/zinc/71/83/95/895718395.db2.gz RYOFUBCKXTVJNK-SFHVURJKSA-N 0 3 408.527 4.477 20 0 HIADHN Cc1cc(NC(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)nn1[C@@H](C)C1CC1 ZINC000480320564 895723252 /nfs/dbraw/zinc/72/32/52/895723252.db2.gz RCTXDXBGENSPCE-UWJYYQICSA-N 0 3 413.566 4.374 20 0 HIADHN CC(C)N(C)c1ccc(CNC2(c3ccc(Br)cc3)CCOCC2)cn1 ZINC000480361205 895767541 /nfs/dbraw/zinc/76/75/41/895767541.db2.gz WGSPBTMOTWVBPH-UHFFFAOYSA-N 0 3 418.379 4.484 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@@H](C)NCc2ccc(Br)o2)CC1 ZINC000480384138 895791309 /nfs/dbraw/zinc/79/13/09/895791309.db2.gz NFYZDWRPZYPOAI-CQSZACIVSA-N 0 3 410.331 4.174 20 0 HIADHN C[C@@H](NCc1ccccc1Cn1cccn1)c1ccc(S(=O)(=O)C2CCCC2)cc1 ZINC000480416415 895814030 /nfs/dbraw/zinc/81/40/30/895814030.db2.gz ZQYXUGQUHNHIEN-LJQANCHMSA-N 0 3 423.582 4.499 20 0 HIADHN CCN(CC)C(=O)Nc1ccc([C@H](C)N[C@@H](CN2CCOCC2)c2ccccc2)cc1 ZINC000480445780 895834234 /nfs/dbraw/zinc/83/42/34/895834234.db2.gz HDDHUDRSVAKRMB-RDPSFJRHSA-N 0 3 424.589 4.284 20 0 HIADHN Brc1ccc(CNCc2ccc(C3CC3)cc2)c(N2CCOCC2)c1 ZINC000480466303 895849681 /nfs/dbraw/zinc/84/96/81/895849681.db2.gz HGSZKLORVMKNPB-UHFFFAOYSA-N 0 3 401.348 4.453 20 0 HIADHN FC(F)(F)C1CCN(C2CC(Nc3ncnc4c3cnn4-c3ccccc3)C2)CC1 ZINC000480548991 895909251 /nfs/dbraw/zinc/90/92/51/895909251.db2.gz DMHCYYLAOZALGX-UHFFFAOYSA-N 0 3 416.451 4.033 20 0 HIADHN Cc1cc(C(=O)NC[C@@H]2CCCN(Cc3cccs3)C2)nn1-c1cccc(F)c1 ZINC000480570233 895929731 /nfs/dbraw/zinc/92/97/31/895929731.db2.gz UBIWXCASYIYODB-KRWDZBQOSA-N 0 3 412.534 4.023 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)c3cnc(Nc4ccc(Cl)cc4)c(Cl)c3)[C@H]2C1 ZINC000480577590 895936731 /nfs/dbraw/zinc/93/67/31/895936731.db2.gz IPGAWLUZZDPEFG-ACJLOTCBSA-N 0 3 405.329 4.298 20 0 HIADHN CN1CCN(C(=O)c2ccc(CN[C@H]3CCSc4c(Cl)cccc43)cc2)CC1 ZINC000480603303 895967730 /nfs/dbraw/zinc/96/77/30/895967730.db2.gz CAKIVIVKNQCSSS-FQEVSTJZSA-N 0 3 415.990 4.054 20 0 HIADHN C[C@H](NCc1cccc(N2CCCC2=O)c1)c1ccc(I)cc1 ZINC000480616429 895982313 /nfs/dbraw/zinc/98/23/13/895982313.db2.gz XDIZVLIQBQOQQD-AWEZNQCLSA-N 0 3 420.294 4.269 20 0 HIADHN CCCCOc1ccc([C@H](C)NCc2ccc(N3CCO[C@@H](C)C3)nc2)cc1OC ZINC000480622268 895990089 /nfs/dbraw/zinc/99/00/89/895990089.db2.gz GDLVVKUIFUHSGF-OALUTQOASA-N 0 3 413.562 4.345 20 0 HIADHN C[C@@H](N[C@@H](C)c1cccc(N2CCCS2(=O)=O)c1)c1cccc(OC(F)F)c1 ZINC000480630858 895998504 /nfs/dbraw/zinc/99/85/04/895998504.db2.gz NUIBVFZHPONIAR-LSDHHAIUSA-N 0 3 410.486 4.240 20 0 HIADHN C[C@@H](N[C@@H](C)c1cccc(OC(F)F)c1)c1cccc(N2CCCS2(=O)=O)c1 ZINC000480630855 895998527 /nfs/dbraw/zinc/99/85/27/895998527.db2.gz NUIBVFZHPONIAR-CABCVRRESA-N 0 3 410.486 4.240 20 0 HIADHN C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000480638141 896007299 /nfs/dbraw/zinc/00/72/99/896007299.db2.gz QWLWNUGOHLFSAT-QAPCUYQASA-N 0 3 415.525 4.473 20 0 HIADHN C[C@@H]1CN(C(=O)c2ccc(CNCc3ccc(OCC4CC4)cc3)cc2)C[C@H](C)O1 ZINC000480641601 896011176 /nfs/dbraw/zinc/01/11/76/896011176.db2.gz XFISMVMRQMQBQU-KDURUIRLSA-N 0 3 408.542 4.015 20 0 HIADHN CN1CCN(c2cc(CN[C@H]3CCCc4nc(-c5ccccc5)sc43)ccn2)CC1 ZINC000480691471 896054565 /nfs/dbraw/zinc/05/45/65/896054565.db2.gz BTIANDFJWLXRPN-FQEVSTJZSA-N 0 3 419.598 4.124 20 0 HIADHN Cc1ccccc1NC(=O)C[C@@H](C)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1=O ZINC000480694790 896058380 /nfs/dbraw/zinc/05/83/80/896058380.db2.gz PWHCZRSMJSZEJW-QAPCUYQASA-N 0 3 419.447 4.126 20 0 HIADHN CCOc1cccc(CN[C@H](C)c2ccc(S(=O)(=O)N3CCCCC3)cc2)c1 ZINC000480702822 896063117 /nfs/dbraw/zinc/06/31/17/896063117.db2.gz XSXQLMZWFOBBRC-GOSISDBHSA-N 0 3 402.560 4.111 20 0 HIADHN COc1ccc2ccccc2c1-c1cc(CN2CCC[C@@H](CNC(=O)C(C)C)C2)on1 ZINC000480745091 896107691 /nfs/dbraw/zinc/10/76/91/896107691.db2.gz DCWMMWRGJMHHIR-SFHVURJKSA-N 0 3 421.541 4.488 20 0 HIADHN CC[C@@H](N[C@H](C)c1ccc(S(=O)(=O)N2CCOCC2)cc1)c1cccc(Cl)c1 ZINC000480767308 896129089 /nfs/dbraw/zinc/12/90/89/896129089.db2.gz DWZMIUHEHMYJOC-IIBYNOLFSA-N 0 3 422.978 4.163 20 0 HIADHN C[C@@H](NC[C@H]1CCN(c2ccccc2)C1)c1ccccc1I ZINC000480774772 896138839 /nfs/dbraw/zinc/13/88/39/896138839.db2.gz VVKODHFEWAZNJR-HZPDHXFCSA-N 0 3 406.311 4.468 20 0 HIADHN C[C@@H](NCCCS(=O)(=O)Cc1ccccc1)c1ccccc1OC(F)(F)F ZINC000480901850 896256649 /nfs/dbraw/zinc/25/66/49/896256649.db2.gz RHKCNPAWGUTPOQ-OAHLLOKOSA-N 0 3 401.450 4.241 20 0 HIADHN COc1cccc([C@H](C)N[C@@H](C)c2ccc(S(=O)(=O)N3CCCCC3)cc2)c1 ZINC000480909023 896265633 /nfs/dbraw/zinc/26/56/33/896265633.db2.gz GVHIGWIXGLAGIN-ROUUACIJSA-N 0 3 402.560 4.282 20 0 HIADHN COc1ccc2oc([C@@H](C)NCCCS(=O)(=O)Cc3ccccc3)c(C)c2c1 ZINC000480923353 896280116 /nfs/dbraw/zinc/28/01/16/896280116.db2.gz ZMWPIHZPUAVVGJ-QGZVFWFLSA-N 0 3 401.528 4.406 20 0 HIADHN COC(=O)c1cc(NC(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)cc(Cl)c1F ZINC000480971391 896309178 /nfs/dbraw/zinc/30/91/78/896309178.db2.gz NNPULICFYOHAKT-KPZWWZAWSA-N 0 3 407.873 4.079 20 0 HIADHN CNS(=O)(=O)c1cccc(CN[C@H](Cc2ccc(C)cc2)c2ccc(C)cc2)c1 ZINC000481017481 896347815 /nfs/dbraw/zinc/34/78/15/896347815.db2.gz CZWSRPBVMGWFDD-XMMPIXPASA-N 0 3 408.567 4.285 20 0 HIADHN CNS(=O)(=O)c1cccc(CN[C@H](Cc2ccccc2)c2ccc(C)c(C)c2)c1 ZINC000481028407 896356092 /nfs/dbraw/zinc/35/60/92/896356092.db2.gz YNPSAHFTVCBRRO-XMMPIXPASA-N 0 3 408.567 4.285 20 0 HIADHN COc1ccc([C@H](C)NCc2cccc(S(=O)(=O)NC(C)C)c2)c2ccccc12 ZINC000481041956 896366885 /nfs/dbraw/zinc/36/68/85/896366885.db2.gz BNJMNPNHGYBYGX-KRWDZBQOSA-N 0 3 412.555 4.386 20 0 HIADHN COc1ccc2ccccc2c1-c1cc(CN2CCC[C@H](C(=O)N3CCCC3)C2)on1 ZINC000481052888 896377480 /nfs/dbraw/zinc/37/74/80/896377480.db2.gz IRMQLMNYEAQBBB-IBGZPJMESA-N 0 3 419.525 4.338 20 0 HIADHN COC(=O)COc1ccc(CN(C)Cc2c(-c3ccccc3)nc3ccccn32)cc1 ZINC000481134362 896460531 /nfs/dbraw/zinc/46/05/31/896460531.db2.gz BYJXANFOYFQMTG-UHFFFAOYSA-N 0 3 415.493 4.185 20 0 HIADHN COC(=O)[C@@H]1CC12CCN(Cc1cc(-c3c(OC)ccc4ccccc43)no1)CC2 ZINC000481149053 896476995 /nfs/dbraw/zinc/47/69/95/896476995.db2.gz YACOSNPKHMEIDI-IBGZPJMESA-N 0 3 406.482 4.279 20 0 HIADHN CCOc1ccc([C@H](CC)N[C@@H](C)c2ccc(S(=O)(=O)NC)cc2)cc1OCC ZINC000481182784 896523624 /nfs/dbraw/zinc/52/36/24/896523624.db2.gz QEGIIWDOQXXZJI-JXFKEZNVSA-N 0 3 420.575 4.194 20 0 HIADHN C[C@H]1Cc2ccccc2[C@H]1NCc1cccc(S(=O)(=O)NCc2cccc(F)c2)c1 ZINC000481189374 896539063 /nfs/dbraw/zinc/53/90/63/896539063.db2.gz MRVJZOFGYIQOPL-XDHUDOTRSA-N 0 3 424.541 4.327 20 0 HIADHN Cc1c([C@@H](C)NCCCS(=O)(=O)c2ccccc2)cnn1-c1cccc(Cl)c1 ZINC000481237420 896587107 /nfs/dbraw/zinc/58/71/07/896587107.db2.gz CIQULXRRBWBLJY-MRXNPFEDSA-N 0 3 417.962 4.349 20 0 HIADHN C[C@H](N[C@@H](C)c1cccc(OC(F)F)c1)c1ccc(OCC(=O)NC2CC2)cc1 ZINC000481293659 896638349 /nfs/dbraw/zinc/63/83/49/896638349.db2.gz HYHMYRVIHGPUDM-GJZGRUSLSA-N 0 3 404.457 4.357 20 0 HIADHN Cc1nc2c(s1)[C@H](NCc1ccc(S(=O)(=O)N3CCC[C@@H](C)C3)cc1)CCC2 ZINC000481303050 896648980 /nfs/dbraw/zinc/64/89/80/896648980.db2.gz FOJFHOGNWHYGDL-DNVCBOLYSA-N 0 3 419.616 4.039 20 0 HIADHN CC[C@@H](N[C@H]1CCc2c1cccc2OC)c1ccccc1OCC(=O)N1CCCC1 ZINC000481312286 896660199 /nfs/dbraw/zinc/66/01/99/896660199.db2.gz HNSDANONRDALLT-YADHBBJMSA-N 0 3 408.542 4.425 20 0 HIADHN Cc1ccc(NC(=O)C(C)(C)C)cc1NC(=O)NC[C@H](Cc1ccccc1)N(C)C ZINC000481312819 896660450 /nfs/dbraw/zinc/66/04/50/896660450.db2.gz GLFRXHBZIGMAFF-FQEVSTJZSA-N 0 3 410.562 4.274 20 0 HIADHN Cc1nc(-c2ccccc2)sc1[C@@H](C)NCc1cccc(OCC(=O)N(C)C)c1 ZINC000481315260 896664957 /nfs/dbraw/zinc/66/49/57/896664957.db2.gz QMZKCCVKIFCHBW-MRXNPFEDSA-N 0 3 409.555 4.436 20 0 HIADHN C[C@@H](N[C@H]1CCSc2ccc(F)cc21)c1ccc(OCC(=O)NC2CC2)cc1 ZINC000481316551 896667939 /nfs/dbraw/zinc/66/79/39/896667939.db2.gz ANYMUPAEWSMTSB-VLIAUNLRSA-N 0 3 400.519 4.371 20 0 HIADHN C[C@H]1C[C@@H](NCc2cccc(OCC(=O)N(C)C)c2)c2cccc(Br)c21 ZINC000481317680 896669360 /nfs/dbraw/zinc/66/93/60/896669360.db2.gz QMBCPHOYSIUITJ-IFXJQAMLSA-N 0 3 417.347 4.254 20 0 HIADHN COc1cc([C@H](C)N[C@@H](C)c2ccc(OCC(=O)NC3CC3)cc2)ccc1SC ZINC000481317670 896669597 /nfs/dbraw/zinc/66/95/97/896669597.db2.gz YVNFEJHQEBRWSI-HOTGVXAUSA-N 0 3 414.571 4.486 20 0 HIADHN CC[C@@H](N[C@H](C)c1ccc(-n2cccn2)cc1)c1ccccc1OCC(=O)N(C)C ZINC000481318329 896670238 /nfs/dbraw/zinc/67/02/38/896670238.db2.gz KDUPAXBXYIICFX-XMSQKQJNSA-N 0 3 406.530 4.141 20 0 HIADHN C[C@@H](NCc1cccc(OCC(=O)N(C)C)c1)c1ccc(SCC(F)F)cc1 ZINC000481319241 896673729 /nfs/dbraw/zinc/67/37/29/896673729.db2.gz TWWVAHYBHCMENW-OAHLLOKOSA-N 0 3 408.514 4.362 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N[C@@H](c1ccc(F)cc1)C(F)(F)F)c1ccco1 ZINC000481390151 896792655 /nfs/dbraw/zinc/79/26/55/896792655.db2.gz IRTYYUAREQGWBX-NUTKFTJISA-N 0 3 401.404 4.451 20 0 HIADHN CCS(=O)(=O)Nc1ccc([C@H](C)NCc2cccc(NC(=O)CC(C)C)c2)cc1 ZINC000481407161 896812375 /nfs/dbraw/zinc/81/23/75/896812375.db2.gz ROALPSWZOAILPD-KRWDZBQOSA-N 0 3 417.575 4.284 20 0 HIADHN Clc1ccc2c(c1Cl)CC[C@@H]2NCc1cccc(OCCN2CCOCC2)c1 ZINC000481418571 896821754 /nfs/dbraw/zinc/82/17/54/896821754.db2.gz MBVNGXQOHDYZQA-NRFANRHFSA-N 0 3 421.368 4.482 20 0 HIADHN Cc1noc(-c2ccccc2)c1NC(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000481465146 896857383 /nfs/dbraw/zinc/85/73/83/896857383.db2.gz NEJDLSXIYZSOJA-CALCHBBNSA-N 0 3 412.534 4.003 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)Cc1c[nH]c2cc(Br)ccc12 ZINC000481480778 896865192 /nfs/dbraw/zinc/86/51/92/896865192.db2.gz MGHNIWBLZDEDEG-UHFFFAOYSA-N 0 3 414.347 4.063 20 0 HIADHN CC(C)C[C@H](C)n1nccc1NC(=O)N(CCN(C)C)Cc1ccc(F)c(F)c1 ZINC000481490362 896870403 /nfs/dbraw/zinc/87/04/03/896870403.db2.gz JSOKKBUAOQBRIK-INIZCTEOSA-N 0 3 407.509 4.364 20 0 HIADHN CC(C)(CNC(=O)C[C@H](c1cccs1)n1cccc1)N1CCc2ccccc2C1 ZINC000481520885 896886564 /nfs/dbraw/zinc/88/65/64/896886564.db2.gz WDJKUZMLSARMHW-OAQYLSRUSA-N 0 3 407.583 4.482 20 0 HIADHN CCOc1cc(O)ccc1NC(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000481524571 896888813 /nfs/dbraw/zinc/88/88/13/896888813.db2.gz YVQIXPMRXLEZBP-HXUWFJFHSA-N 0 3 408.420 4.184 20 0 HIADHN Cc1c([C@@H](C)NCc2cccc(CN3CCO[C@H](C)C3)c2)cnn1-c1ccc(F)cc1 ZINC000481534929 896895543 /nfs/dbraw/zinc/89/55/43/896895543.db2.gz OJJPUSLKZGWGIZ-RTBURBONSA-N 0 3 422.548 4.391 20 0 HIADHN C[C@@H](N[C@@H](C)COc1ccccc1C(F)(F)F)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000481542195 896902492 /nfs/dbraw/zinc/90/24/92/896902492.db2.gz JOERMQRWEHKEBQ-QWHCGFSZSA-N 0 3 419.440 4.366 20 0 HIADHN C[C@H](NC[C@H](O)COc1cccc(Cl)c1Cl)c1cnn(Cc2ccccc2)c1 ZINC000481546052 896907345 /nfs/dbraw/zinc/90/73/45/896907345.db2.gz KSEKAZAVBOEUGF-YJBOKZPZSA-N 0 3 420.340 4.329 20 0 HIADHN COc1ccc([C@H](C)NC[C@@H](O)COc2cccc(Cl)c2Cl)c(OC)c1 ZINC000481556015 896928825 /nfs/dbraw/zinc/92/88/25/896928825.db2.gz HVHDMAGMHLBMDA-QWHCGFSZSA-N 0 3 400.302 4.101 20 0 HIADHN COCCOc1ccc([C@H](C)NCc2ccc(-n3ccnc3C)c(F)c2)cc1OC ZINC000481558127 896931365 /nfs/dbraw/zinc/93/13/65/896931365.db2.gz CEDHEZDERQSTGK-INIZCTEOSA-N 0 3 413.493 4.204 20 0 HIADHN O[C@H](CN[C@@H]1CCSc2c(F)cccc21)COc1ccc(C(F)(F)F)cc1 ZINC000481567938 896945588 /nfs/dbraw/zinc/94/55/88/896945588.db2.gz BNABYPJWJHRIIW-CXAGYDPISA-N 0 3 401.425 4.411 20 0 HIADHN Cc1ccc(NC(=O)C[C@H](C)N[C@H](CC(=O)N(C)C)c2ccccc2)c(Cl)c1 ZINC000481569319 896949013 /nfs/dbraw/zinc/94/90/13/896949013.db2.gz VVQHCWMKDCTLFK-OXJNMPFZSA-N 0 3 401.938 4.175 20 0 HIADHN C[C@@H](NC[C@@H](O)COc1ccc(C(F)(F)F)cc1)c1ccccc1OC(F)F ZINC000481580365 896961385 /nfs/dbraw/zinc/96/13/85/896961385.db2.gz XWBXCVYMDJMHDU-TZMCWYRMSA-N 0 3 405.363 4.397 20 0 HIADHN CC(C)CN(C(=O)NCCCCN1CCN(Cc2ccccc2)CC1)C1CCCC1 ZINC000481582864 896963121 /nfs/dbraw/zinc/96/31/21/896963121.db2.gz DWOZNRXBQSAVJJ-UHFFFAOYSA-N 0 3 414.638 4.195 20 0 HIADHN CC(=O)Nc1cccc(C(=O)Nc2cc(C)cc(N3CCN(C(C)C)CC3)c2)c1C ZINC000481639438 897023185 /nfs/dbraw/zinc/02/31/85/897023185.db2.gz BUURPOMKOZIPOH-UHFFFAOYSA-N 0 3 408.546 4.045 20 0 HIADHN Brc1ccc(CN[C@@H](c2cccnc2)C2CCC2)c(N2CCOCC2)c1 ZINC000481671647 897055572 /nfs/dbraw/zinc/05/55/72/897055572.db2.gz PWSQLZVZWJDHKN-OAQYLSRUSA-N 0 3 416.363 4.312 20 0 HIADHN Cc1cc(NC(=O)c2csc([C@@H]3CCCO3)n2)cc(N2CCN(C(C)C)CC2)c1 ZINC000481675885 897058292 /nfs/dbraw/zinc/05/82/92/897058292.db2.gz WVRYWGVYTKWRPI-FQEVSTJZSA-N 0 3 414.575 4.086 20 0 HIADHN CC[C@H](NCCOC1CCCCCC1)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000481677031 897060878 /nfs/dbraw/zinc/06/08/78/897060878.db2.gz JZWKQSSXKKXKLQ-SFHVURJKSA-N 0 3 402.988 4.028 20 0 HIADHN c1ccc2c(c1)CO[C@]21CCCN(CCN2CCC[C@@]3(C2)OCc2ccccc23)C1 ZINC000481692873 897078589 /nfs/dbraw/zinc/07/85/89/897078589.db2.gz HLIHWAKISSOEMW-UIOOFZCWSA-N 0 3 404.554 4.029 20 0 HIADHN CCOC(=O)C[C@](C)(NCC(=O)Nc1c(Cl)cccc1C(F)(F)F)C(C)C ZINC000481698605 897086367 /nfs/dbraw/zinc/08/63/67/897086367.db2.gz UJLJGYOWEYNVDD-KRWDZBQOSA-N 0 3 408.848 4.255 20 0 HIADHN C[C@H](N[C@H]1CCCc2cc(OC(F)F)ccc21)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000481736351 897131460 /nfs/dbraw/zinc/13/14/60/897131460.db2.gz NLBLFCUTYBZVCW-XOBRGWDASA-N 0 3 424.513 4.267 20 0 HIADHN C[C@@H](NCc1cccc2cccnc21)c1ccc(S(=O)(=O)NCc2ccco2)cc1 ZINC000481739862 897135461 /nfs/dbraw/zinc/13/54/61/897135461.db2.gz TTWIQQDZUHVTJE-QGZVFWFLSA-N 0 3 421.522 4.157 20 0 HIADHN CCCCN(C)C(=O)C1CCN(Cc2ccc(-c3ccc(C(=O)OC)cc3)o2)CC1 ZINC000481907428 897289654 /nfs/dbraw/zinc/28/96/54/897289654.db2.gz VFAYIGJSELRDQU-UHFFFAOYSA-N 0 3 412.530 4.204 20 0 HIADHN COC(=O)c1ccc(-c2ccc(CN3CCC(NC(=O)CC4CCCC4)CC3)o2)cc1 ZINC000481993008 897388025 /nfs/dbraw/zinc/38/80/25/897388025.db2.gz QQCGPOWVARWQSC-UHFFFAOYSA-N 0 3 424.541 4.394 20 0 HIADHN CC[C@H](N[C@H](CC(F)(F)F)C(C)C)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000481992466 897388467 /nfs/dbraw/zinc/38/84/67/897388467.db2.gz OJPCHYDLFANPSW-UONOGXRCSA-N 0 3 400.894 4.266 20 0 HIADHN CCCNc1ccc(CN[C@H](CC)c2ccc(Cl)c(S(=O)(=O)NC)c2)cc1 ZINC000481995480 897392322 /nfs/dbraw/zinc/39/23/22/897392322.db2.gz VKMWTSAJTVRAJL-LJQANCHMSA-N 0 3 409.983 4.311 20 0 HIADHN CC(=O)N1CCN(c2ccccc2CN[C@H](C)c2cccc(C(F)(F)F)c2)CC1 ZINC000482024312 897430739 /nfs/dbraw/zinc/43/07/39/897430739.db2.gz FFTSIVHPMGOLKJ-MRXNPFEDSA-N 0 3 405.464 4.225 20 0 HIADHN Cc1cc(NC(=O)c2sccc2OC(F)F)cc(N2CCN(C(C)C)CC2)c1 ZINC000482032493 897443648 /nfs/dbraw/zinc/44/36/48/897443648.db2.gz LOZKAWXNHYHBHP-UHFFFAOYSA-N 0 3 409.502 4.441 20 0 HIADHN CC(C)c1ccc(-c2noc(CCC(=O)N3CCN(C4CCCCC4)CC3)n2)cc1 ZINC000482060492 897489923 /nfs/dbraw/zinc/48/99/23/897489923.db2.gz LPVNXDZBAJGXEW-UHFFFAOYSA-N 0 3 410.562 4.270 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1ccc(OC(F)F)c2cccnc12 ZINC000482065902 897499798 /nfs/dbraw/zinc/49/97/98/897499798.db2.gz FRSYRZVNYZAZKM-UHFFFAOYSA-N 0 3 404.417 4.025 20 0 HIADHN C[C@@H](NCC(=O)NCC(F)F)c1ccc(-c2ccccc2Br)s1 ZINC000482066119 897500230 /nfs/dbraw/zinc/50/02/30/897500230.db2.gz MCMTWRKOMPVXQG-SNVBAGLBSA-N 0 3 403.292 4.210 20 0 HIADHN C[C@H](NC1CC(F)(c2cccc(Cl)c2)C1)c1cccc(S(=O)(=O)N(C)C)c1 ZINC000482067120 897501306 /nfs/dbraw/zinc/50/13/06/897501306.db2.gz HOAJYEBVVBHSAH-KLOIUYPJSA-N 0 3 410.942 4.268 20 0 HIADHN C[C@@H](NC1CC(F)(c2cccc(Cl)c2)C1)c1cccc(S(=O)(=O)N(C)C)c1 ZINC000482067119 897501712 /nfs/dbraw/zinc/50/17/12/897501712.db2.gz HOAJYEBVVBHSAH-FHTBDLFWSA-N 0 3 410.942 4.268 20 0 HIADHN C[C@@H](NCC(=O)NCC(F)F)c1ccc(-c2ccc(Br)cc2)s1 ZINC000482075217 897512737 /nfs/dbraw/zinc/51/27/37/897512737.db2.gz LIXWEDAWHXUKFJ-SNVBAGLBSA-N 0 3 403.292 4.210 20 0 HIADHN CC1CCN([C@@H](CNC(=O)NCc2nc(C3CC3)cs2)c2cccs2)CC1 ZINC000482102615 897550645 /nfs/dbraw/zinc/55/06/45/897550645.db2.gz UJBPXFVPEOKTHZ-KRWDZBQOSA-N 0 3 404.605 4.354 20 0 HIADHN C[C@@H](N[C@H](Cc1ccccc1)C(=O)N1CCCC1)c1ccc(OC(F)(F)F)cc1 ZINC000482108282 897557530 /nfs/dbraw/zinc/55/75/30/897557530.db2.gz HNOXEKPOISLURN-OXQOHEQNSA-N 0 3 406.448 4.470 20 0 HIADHN C[C@H](NCc1ccnc(OC2CCCCC2)c1)c1ccc(NS(C)(=O)=O)cc1 ZINC000482120009 897573302 /nfs/dbraw/zinc/57/33/02/897573302.db2.gz IHFNKRTVFGFYSR-INIZCTEOSA-N 0 3 403.548 4.015 20 0 HIADHN CCS(=O)(=O)Nc1ccc([C@@H](C)NCc2ccnc(OC3CCCCC3)c2)cc1 ZINC000482121743 897576576 /nfs/dbraw/zinc/57/65/76/897576576.db2.gz LPVIRUTVFGYNIJ-QGZVFWFLSA-N 0 3 417.575 4.406 20 0 HIADHN C[C@@H](NCc1ccc(Oc2cccc(F)c2)nc1)c1ccc(NS(C)(=O)=O)cc1 ZINC000482134656 897591821 /nfs/dbraw/zinc/59/18/21/897591821.db2.gz LOPHSHKJKTXMCK-OAHLLOKOSA-N 0 3 415.490 4.235 20 0 HIADHN CC1CCC(N(C)C(=O)CNC2(c3ccc(Br)cc3)CCOCC2)CC1 ZINC000505492774 914177250 /nfs/dbraw/zinc/17/72/50/914177250.db2.gz DKPLQCYYRLGUGI-UHFFFAOYSA-N 0 3 423.395 4.082 20 0 HIADHN COC(=O)c1ccc(-c2ccc(CN[C@H](Cc3ccccc3)[C@@H](O)C(F)F)o2)cc1 ZINC000482207127 897686809 /nfs/dbraw/zinc/68/68/09/897686809.db2.gz FIROKFWETXKZDL-TZIWHRDSSA-N 0 3 415.436 4.060 20 0 HIADHN COC(=O)c1ccccc1-c1ccc(CN[C@@H](Cc2ccccc2)[C@H](O)C(F)F)o1 ZINC000482210677 897690146 /nfs/dbraw/zinc/69/01/46/897690146.db2.gz IXVFXLVUNXIVEN-FPOVZHCZSA-N 0 3 415.436 4.060 20 0 HIADHN Cc1c([C@@H](C)NC2CCN(C(=O)c3ccc(C)cc3)CC2)nnn1-c1ccc(C)cc1 ZINC000482242006 897723851 /nfs/dbraw/zinc/72/38/51/897723851.db2.gz JDSSPNBBBKSRDH-LJQANCHMSA-N 0 3 417.557 4.148 20 0 HIADHN CCC[C@H](N[C@H](C)c1ccc(-n2ccnc2)cc1)C(=O)N1CCc2sccc2C1 ZINC000482253634 897734693 /nfs/dbraw/zinc/73/46/93/897734693.db2.gz RFFUYMAYLFFBGD-UTKZUKDTSA-N 0 3 408.571 4.338 20 0 HIADHN C[C@H](C(=O)Nc1ccc(C(=O)N(C)[C@H]2CCCN(C)C2)cc1)c1cc2ccccc2o1 ZINC000482318228 897816757 /nfs/dbraw/zinc/81/67/57/897816757.db2.gz SBEFDVCLVZTAMZ-UWJYYQICSA-N 0 3 419.525 4.341 20 0 HIADHN C[C@H](C(=O)Nc1ccc(C(=O)N(C)[C@@H]2CCCN(C)C2)cc1)c1cc2ccccc2o1 ZINC000482318226 897816785 /nfs/dbraw/zinc/81/67/85/897816785.db2.gz SBEFDVCLVZTAMZ-LAUBAEHRSA-N 0 3 419.525 4.341 20 0 HIADHN COc1ccc([C@H](NC(=O)N(CCN(C)C)Cc2cccc(C)c2)C(F)(F)F)cc1 ZINC000482356911 897871944 /nfs/dbraw/zinc/87/19/44/897871944.db2.gz AIZHATFSDKPYJD-FQEVSTJZSA-N 0 3 423.479 4.380 20 0 HIADHN O=C(CCN1CCN(c2ccccc2)CC1)N(CCC(F)(F)F)Cc1ccccc1 ZINC000482358608 897875326 /nfs/dbraw/zinc/87/53/26/897875326.db2.gz OOWYURKDKIYQSL-UHFFFAOYSA-N 0 3 419.491 4.180 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)c2sc(-c3ccc(C)o3)nc2C)c1 ZINC000482358921 897875416 /nfs/dbraw/zinc/87/54/16/897875416.db2.gz FIYXWVYICPUHGL-UHFFFAOYSA-N 0 3 413.543 4.233 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)c2cc(C3CC3)nc3ccccc32)c1 ZINC000482400210 897937952 /nfs/dbraw/zinc/93/79/52/897937952.db2.gz CZKHMMAUCFUURY-UHFFFAOYSA-N 0 3 403.526 4.325 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)Nc1cc(C(=O)OC)ccc1C(C)C)c1ccco1 ZINC000482425846 897978805 /nfs/dbraw/zinc/97/88/05/897978805.db2.gz YBLYYSNRMWZAFI-DNVCBOLYSA-N 0 3 401.507 4.441 20 0 HIADHN CC(C)Cc1ccc([C@H](CNC(=O)Nc2cnn(C)c2C(F)(F)F)N(C)C)cc1 ZINC000482443154 898005355 /nfs/dbraw/zinc/00/53/55/898005355.db2.gz CPIKDYJHXBKVRU-KRWDZBQOSA-N 0 3 411.472 4.062 20 0 HIADHN Cc1cc(NC(=O)CCc2ccc(F)cc2F)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000505522129 914211997 /nfs/dbraw/zinc/21/19/97/914211997.db2.gz BOTWGZCFLUVEOH-NRFANRHFSA-N 0 3 424.495 4.488 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)N[C@@H](c1cccc(F)c1F)C(F)(F)F ZINC000482456726 898026860 /nfs/dbraw/zinc/02/68/60/898026860.db2.gz RHMKPSONARIUGM-INIZCTEOSA-N 0 3 421.435 4.403 20 0 HIADHN CCO[C@@H]1C[C@@H](NCc2ccccc2OCc2cccnc2)[C@H]1Oc1ccccc1 ZINC000482495500 898075721 /nfs/dbraw/zinc/07/57/21/898075721.db2.gz OUAMJDSQIPUWCH-QLBJFCOMSA-N 0 3 404.510 4.375 20 0 HIADHN CCNC(=O)COc1ccc(CN2CCC(c3ccc(Cl)cc3)CC2)cc1OC ZINC000482496598 898077361 /nfs/dbraw/zinc/07/73/61/898077361.db2.gz QWJONVMNWPYDTD-UHFFFAOYSA-N 0 3 416.949 4.243 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@@H](C)N[C@H](C)c2cc(OC)ccc2OC)CC1 ZINC000482549633 898138117 /nfs/dbraw/zinc/13/81/17/898138117.db2.gz HSXDGHMNUFTWLF-QZTJIDSGSA-N 0 3 415.553 4.397 20 0 HIADHN COCCOc1ccc([C@@H](C)N[C@H](C)c2cc(F)ccc2N2CCN(C)CC2)cc1 ZINC000482564872 898158365 /nfs/dbraw/zinc/15/83/65/898158365.db2.gz LXHJNKWRSACURB-RTBURBONSA-N 0 3 415.553 4.015 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)c1csc(-c2ccc3c(c2)OCCO3)n1 ZINC000482582730 898178864 /nfs/dbraw/zinc/17/88/64/898178864.db2.gz GOSAFWFSBPEQOW-UHFFFAOYSA-N 0 3 409.511 4.204 20 0 HIADHN CC[C@H](NCc1nc2ccc(Cl)cc2n1C)[C@@H](c1ccc(C)cc1)n1cncn1 ZINC000482582509 898179063 /nfs/dbraw/zinc/17/90/63/898179063.db2.gz RTMBLKFTYONIPR-PGRDOPGGSA-N 0 3 408.937 4.284 20 0 HIADHN CC[C@@H](NCc1nc2ccc(Cl)cc2n1C)[C@@H](c1ccc(C)cc1)n1cncn1 ZINC000482582513 898179219 /nfs/dbraw/zinc/17/92/19/898179219.db2.gz RTMBLKFTYONIPR-XMSQKQJNSA-N 0 3 408.937 4.284 20 0 HIADHN CCCc1c(C(=O)Nc2cc(CN(C)C)ccc2C)nnn1-c1cccc(Cl)c1 ZINC000482587604 898186073 /nfs/dbraw/zinc/18/60/73/898186073.db2.gz WNLFWUGUDVPGBL-UHFFFAOYSA-N 0 3 411.937 4.496 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)c1ccc(S(=O)(=O)C2CCCC2)cc1 ZINC000482592731 898193278 /nfs/dbraw/zinc/19/32/78/898193278.db2.gz LTVRYRJQYQBPSD-UHFFFAOYSA-N 0 3 400.544 4.025 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)[C@H](NC(=O)c1ccccc1Cl)C(C)C ZINC000482615819 898216884 /nfs/dbraw/zinc/21/68/84/898216884.db2.gz JPJUZUCYZVPQLZ-HXUWFJFHSA-N 0 3 401.938 4.103 20 0 HIADHN CCc1ccnc(-c2noc([C@]3(C(F)(F)F)CCN(Cc4ccccc4)C3)n2)c1 ZINC000482779605 898387477 /nfs/dbraw/zinc/38/74/77/898387477.db2.gz GXIZHZQHHZAQQF-FQEVSTJZSA-N 0 3 402.420 4.400 20 0 HIADHN C[C@H](CC(=O)NC1CCN(CCOc2ccc(F)cc2)CC1)c1ccc(F)cc1F ZINC000505551180 914253524 /nfs/dbraw/zinc/25/35/24/914253524.db2.gz QZGUNLRKBFGRLE-MRXNPFEDSA-N 0 3 420.475 4.257 20 0 HIADHN Cc1nc2ccccc2n1C1CCN(CC(=O)N(Cc2ccccc2)C(C)C)CC1 ZINC000482901603 898520134 /nfs/dbraw/zinc/52/01/34/898520134.db2.gz PJQHHFOLMFJPDA-UHFFFAOYSA-N 0 3 404.558 4.419 20 0 HIADHN Cc1ccc(NC(=O)N2CCN(C3CCCCC3)CC2)c(OC[C@@H]2CCCO2)c1 ZINC000482917489 898535386 /nfs/dbraw/zinc/53/53/86/898535386.db2.gz JAPDXUZLVWYAQW-FQEVSTJZSA-N 0 3 401.551 4.035 20 0 HIADHN C[C@@H](NC[C@H](O)Cc1ccc(C(F)(F)F)cc1)c1ccc(Br)cn1 ZINC000482946201 898571599 /nfs/dbraw/zinc/57/15/99/898571599.db2.gz IKYYQXJFHJRUCP-IAQYHMDHSA-N 0 3 403.242 4.117 20 0 HIADHN C[C@H](NCc1ccc(-c2nc3ccccc3[nH]2)cc1)c1cccc(NS(C)(=O)=O)c1 ZINC000482948772 898576428 /nfs/dbraw/zinc/57/64/28/898576428.db2.gz RWHVBXMSLNXHDB-INIZCTEOSA-N 0 3 420.538 4.452 20 0 HIADHN C[C@@H](NCc1ccnc(OC2CCC(C)CC2)c1)c1ccc(NS(C)(=O)=O)cc1 ZINC000482957850 898586614 /nfs/dbraw/zinc/58/66/14/898586614.db2.gz JDTQZKKSHMQECW-BQIYRTECSA-N 0 3 417.575 4.261 20 0 HIADHN CC[C@H](C)Sc1ccc(NC(=O)N2CC[C@@H](N3CCN(C)CC3)[C@@H](C)C2)c(C)c1 ZINC000482990577 898633742 /nfs/dbraw/zinc/63/37/42/898633742.db2.gz JHWHKDMQJZQAKX-CNNODRBYSA-N 0 3 418.651 4.375 20 0 HIADHN CCCC[C@](C)(NCC(=O)Nc1cc(C)nn1C)c1cccc(Br)c1 ZINC000483094278 898782862 /nfs/dbraw/zinc/78/28/62/898782862.db2.gz XVFDRXVYWOQQII-IBGZPJMESA-N 0 3 407.356 4.125 20 0 HIADHN CC(C)OCCCNC(=O)C1CCN(Cc2ccc(-c3cccc(F)c3F)o2)CC1 ZINC000483174427 898841531 /nfs/dbraw/zinc/84/15/31/898841531.db2.gz KFNCBJUQLQIFLS-UHFFFAOYSA-N 0 3 420.500 4.368 20 0 HIADHN CCCN(Cc1nccn1-c1ccccc1)C1CCN(c2cc(C)nc(C)n2)CC1 ZINC000483266980 898905632 /nfs/dbraw/zinc/90/56/32/898905632.db2.gz KUGWWUMYBXTJCE-UHFFFAOYSA-N 0 3 404.562 4.160 20 0 HIADHN COc1ccc(C[C@@H](N[C@@H]2CCC(=O)N(C)C2)c2cc(Cl)ccc2Cl)cc1 ZINC000483293336 898927852 /nfs/dbraw/zinc/92/78/52/898927852.db2.gz GOJBDAANSORJES-OXQOHEQNSA-N 0 3 407.341 4.496 20 0 HIADHN C[C@@H](NC(=O)c1ccc(-c2noc(C(F)F)n2)cc1)[C@@H](c1ccccc1)N(C)C ZINC000505591232 914296753 /nfs/dbraw/zinc/29/67/53/914296753.db2.gz MAPSVULZQCMUJJ-DYVFJYSZSA-N 0 3 400.429 4.095 20 0 HIADHN C[C@H]1CN(CCC(=O)Nc2ccc(Oc3ccccc3)cc2)C[C@]2(CCCOC2)O1 ZINC000483367086 899003533 /nfs/dbraw/zinc/00/35/33/899003533.db2.gz LDCDTLRNEYLLTA-CYFREDJKSA-N 0 3 410.514 4.077 20 0 HIADHN COc1ccc(-c2cc(C(=O)N3C[C@@H](N4CCCC4)[C@@H](SC)C3)sc2C)cc1 ZINC000483390735 899024633 /nfs/dbraw/zinc/02/46/33/899024633.db2.gz CUYZRNKLNGKTCL-CTNGQTDRSA-N 0 3 416.612 4.384 20 0 HIADHN CS[C@@H]1CN(C(=O)c2occc2CSc2ccccc2)C[C@H]1N1CCCC1 ZINC000483392949 899027051 /nfs/dbraw/zinc/02/70/51/899027051.db2.gz IVZWJKGEOLWAJF-RTBURBONSA-N 0 3 402.585 4.224 20 0 HIADHN CS[C@@H]1CN(C(=O)c2occc2CSc2ccccc2)C[C@@H]1N1CCCC1 ZINC000483392948 899027508 /nfs/dbraw/zinc/02/75/08/899027508.db2.gz IVZWJKGEOLWAJF-RBUKOAKNSA-N 0 3 402.585 4.224 20 0 HIADHN CS[C@@H]1CN(C(=O)[C@H](C)c2cccc(C(=O)c3ccccc3)c2)C[C@H]1N1CCCC1 ZINC000483398337 899031589 /nfs/dbraw/zinc/03/15/89/899031589.db2.gz XQHREEINDAUHLX-SXSPYAJSSA-N 0 3 422.594 4.059 20 0 HIADHN CS[C@H]1CN(C(=O)c2sc(-c3ccccc3C)nc2C)C[C@@H]1N1CCCC1 ZINC000483409096 899040288 /nfs/dbraw/zinc/04/02/88/899040288.db2.gz OYHUFTBDJPTDSL-ROUUACIJSA-N 0 3 401.601 4.079 20 0 HIADHN C[C@@H](NC(=O)C1(c2cccc(Br)c2)CC1)[C@H](c1ccccc1)N(C)C ZINC000505606030 914309995 /nfs/dbraw/zinc/30/99/95/914309995.db2.gz JMIVBPXQHXMTSZ-DNVCBOLYSA-N 0 3 401.348 4.288 20 0 HIADHN COc1ccccc1-c1nc(C2CCN(Cc3ccc4c(c3)ncn4C)CC2)no1 ZINC000483442792 899078364 /nfs/dbraw/zinc/07/83/64/899078364.db2.gz VXFGSSFHDJJDRW-UHFFFAOYSA-N 0 3 403.486 4.012 20 0 HIADHN C[C@@H](NC(=O)C1CCC(NC(=O)CC2CCCC2)CC1)[C@H](c1ccccc1)N(C)C ZINC000505610002 914314516 /nfs/dbraw/zinc/31/45/16/914314516.db2.gz LSRDSGCLUBDOBL-BEBLGJCVSA-N 0 3 413.606 4.049 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1oc(C(C)C)nc1C ZINC000483469063 899111850 /nfs/dbraw/zinc/11/18/50/899111850.db2.gz LKALXMYTTULOOE-IBGZPJMESA-N 0 3 407.518 4.311 20 0 HIADHN CN(C(=O)CN1CCN(C2CCCCC2)CC1)[C@@H](c1ccccc1)c1ccc(F)cc1 ZINC000483489688 899142222 /nfs/dbraw/zinc/14/22/22/899142222.db2.gz KFAAXWLXEDQORO-SANMLTNESA-N 0 3 423.576 4.324 20 0 HIADHN O=C(CN1CCN(C2CCCCC2)CC1)N[C@@H](Cc1ccccc1)c1ccccc1 ZINC000483492445 899148046 /nfs/dbraw/zinc/14/80/46/899148046.db2.gz UKBACDIYUQZJSS-VWLOTQADSA-N 0 3 405.586 4.037 20 0 HIADHN CCCCCn1nc(C)cc1NC(=O)N(CCN(C)C)Cc1ccc(F)cc1F ZINC000483495871 899153107 /nfs/dbraw/zinc/15/31/07/899153107.db2.gz ZQTOGUNFWSXZJC-UHFFFAOYSA-N 0 3 407.509 4.256 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1ccc(C)c(C(=O)N(C)C(C)C)c1)c1ccco1 ZINC000483571911 899226377 /nfs/dbraw/zinc/22/63/77/899226377.db2.gz DBPXZZSBTTYLAF-PXNSSMCTSA-N 0 3 414.550 4.319 20 0 HIADHN CCN1CCN(c2ccccc2CN[C@@H](C)c2nc(-c3ccc(C)c(F)c3)no2)CC1 ZINC000483647625 899304891 /nfs/dbraw/zinc/30/48/91/899304891.db2.gz UCUXYAIOKQSPHI-SFHVURJKSA-N 0 3 423.536 4.177 20 0 HIADHN COc1ccc2[nH]c3c(c2c1)C[C@H](N[C@@H](C)c1nc(-c2ccccc2OC)no1)CC3 ZINC000483656486 899316592 /nfs/dbraw/zinc/31/65/92/899316592.db2.gz QVRXHDOZTNJMGR-LSDHHAIUSA-N 0 3 418.497 4.443 20 0 HIADHN COCCN(C[C@@H]1CC=CCC1)C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000483691299 899349523 /nfs/dbraw/zinc/34/95/23/899349523.db2.gz ZIXNACBQYCXVPF-OAQYLSRUSA-N 0 3 417.619 4.115 20 0 HIADHN CC[C@H](C)n1ncc(NC(=O)Nc2ccc(CCN3CCSCC3)cc2)c1C ZINC000483690684 899350020 /nfs/dbraw/zinc/35/00/20/899350020.db2.gz YCEVNSLDPOCBSZ-INIZCTEOSA-N 0 3 401.580 4.398 20 0 HIADHN COc1cccc(-c2ccc(CN[C@H](C)c3ccc(S(=O)(=O)N(C)C)cc3)cc2)c1 ZINC000483713656 899370609 /nfs/dbraw/zinc/37/06/09/899370609.db2.gz NHZDKVYDTVZNAF-GOSISDBHSA-N 0 3 424.566 4.463 20 0 HIADHN COCCOc1ccc([C@H](C)N[C@@H]2CCCN(c3ccccc3Cl)C2=O)cc1 ZINC000483716585 899374003 /nfs/dbraw/zinc/37/40/03/899374003.db2.gz VOYRUOWFHRMPAQ-OXJNMPFZSA-N 0 3 402.922 4.211 20 0 HIADHN CC[C@@H](N[C@@H](C)c1cccc(-n2ccnc2)c1)c1ccccc1OCC(=O)N(C)C ZINC000483816108 899493817 /nfs/dbraw/zinc/49/38/17/899493817.db2.gz DMBSNGYKMYTMJZ-PGRDOPGGSA-N 0 3 406.530 4.141 20 0 HIADHN COc1cc(C(=O)Nc2ccc(C)cc2CN(C)C)cc(OC)c1Br ZINC000505667676 914364534 /nfs/dbraw/zinc/36/45/34/914364534.db2.gz ZFLYAKSJRAIMNN-UHFFFAOYSA-N 0 3 407.308 4.089 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1nnc(/C=C/c2ccco2)s1 ZINC000484004501 899642020 /nfs/dbraw/zinc/64/20/20/899642020.db2.gz JFWGQNNDQOSWQH-SXSDINLZSA-N 0 3 423.542 4.430 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1ccc2oc(N(C)C)nc2c1 ZINC000484037839 899670771 /nfs/dbraw/zinc/67/07/71/899670771.db2.gz FMIOUDBZSNQFPW-KRWDZBQOSA-N 0 3 407.518 4.022 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)NC[C@H]1CCCC[C@@H]1C(F)(F)F ZINC000484047675 899680504 /nfs/dbraw/zinc/68/05/04/899680504.db2.gz XAQQIZTVPRELOA-AEFFLSMTSA-N 0 3 403.464 4.268 20 0 HIADHN Cc1cc(C)n(-c2ccc(C(=O)N(CCN(C)C)Cc3cccc(C)c3)cc2F)n1 ZINC000484228435 899824351 /nfs/dbraw/zinc/82/43/51/899824351.db2.gz CZSFUPPKZGTPIF-UHFFFAOYSA-N 0 3 408.521 4.141 20 0 HIADHN COc1ccc([C@@H](C)NCc2ccc(C)cc2N2CCOCC2)cc1Br ZINC000484299117 899861451 /nfs/dbraw/zinc/86/14/51/899861451.db2.gz ZVJKRIAPKDGKSA-MRXNPFEDSA-N 0 3 419.363 4.454 20 0 HIADHN Cc1ccc(CN[C@@H](C)c2ccc(NC(=O)NC(C)C)cc2)c(N2CCOCC2)c1 ZINC000484301403 899863764 /nfs/dbraw/zinc/86/37/64/899863764.db2.gz NFZJDZZENXBZBB-IBGZPJMESA-N 0 3 410.562 4.212 20 0 HIADHN CCOc1ccc(OCCN2CCC(c3noc(-c4ccccc4OC)n3)CC2)cc1 ZINC000484308089 899867848 /nfs/dbraw/zinc/86/78/48/899867848.db2.gz IMVYCRCHGUDZOW-UHFFFAOYSA-N 0 3 423.513 4.402 20 0 HIADHN Cc1cccc(-c2cc(Cl)ccc2NC(=O)C(=O)N[C@@H](C)C2=CCN(C)CC2)c1 ZINC000484416323 899934341 /nfs/dbraw/zinc/93/43/41/899934341.db2.gz ZIJCZEBILJGMFX-INIZCTEOSA-N 0 3 411.933 4.021 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)c1cnc(Cc2ccccc2F)s1 ZINC000505711934 914395728 /nfs/dbraw/zinc/39/57/28/914395728.db2.gz DCQLAUNTYTXVLW-UHFFFAOYSA-N 0 3 403.548 4.139 20 0 HIADHN COc1cc(C[C@@H](CO)CN[C@H](C)c2nc(-c3ccccc3)cs2)cc(OC)c1 ZINC000484477518 899970115 /nfs/dbraw/zinc/97/01/15/899970115.db2.gz PWSADAIFKGSLQH-SJLPKXTDSA-N 0 3 412.555 4.329 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2cc(-c3ncco3)ccc2C)c1 ZINC000484485755 899976809 /nfs/dbraw/zinc/97/68/09/899976809.db2.gz JTIPAKUWASUZPB-UHFFFAOYSA-N 0 3 408.502 4.254 20 0 HIADHN Cc1ccc(CN[C@@H](C)c2cccc(N3CCOCC3)c2)c(OC[C@H]2CCCO2)c1 ZINC000484497986 899988671 /nfs/dbraw/zinc/98/86/71/899988671.db2.gz KCWOOUBQJOAKFP-GBXCKJPGSA-N 0 3 410.558 4.240 20 0 HIADHN Cc1c([C@H](C)N[C@@H]2CCN(C(=O)CCc3ccccc3)C2)cnn1-c1ccc(F)cc1 ZINC000484508446 899999311 /nfs/dbraw/zinc/99/93/11/899999311.db2.gz PIHREVWRHYYRGK-PGRDOPGGSA-N 0 3 420.532 4.204 20 0 HIADHN COCCC1(CN[C@@H](C)c2nnn(-c3cccc(Br)c3)c2C)CCC1 ZINC000484522213 900010649 /nfs/dbraw/zinc/01/06/49/900010649.db2.gz RHWVKTAWLDDMLS-AWEZNQCLSA-N 0 3 407.356 4.196 20 0 HIADHN O[C@@H](CN[C@H](Cn1cnc2ccccc21)c1ccc(F)cc1)COc1ccccc1F ZINC000484549443 900029937 /nfs/dbraw/zinc/02/99/37/900029937.db2.gz VHEYWTZOBWCZAG-SIKLNZKXSA-N 0 3 423.463 4.085 20 0 HIADHN Cc1ccc(CN[C@H](C)c2cccc(N3CCOCC3)c2)c(OC[C@H]2CCOC2)c1 ZINC000484616084 900072249 /nfs/dbraw/zinc/07/22/49/900072249.db2.gz KRUPZKFEVQBTKX-RTWAWAEBSA-N 0 3 410.558 4.098 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N2C[C@H](c3ccccc3)[C@H]3COCC[C@@H]32)C1 ZINC000484693510 900131075 /nfs/dbraw/zinc/13/10/75/900131075.db2.gz GCEBSNOMRGENID-AQENTZESSA-N 0 3 419.569 4.036 20 0 HIADHN CCc1nnc(C2CCN([C@@H](C)c3nc(-c4cccc(C(F)(F)F)c4)no3)CC2)[nH]1 ZINC000484731962 900159383 /nfs/dbraw/zinc/15/93/83/900159383.db2.gz XHQYDPDZEZFAPR-LBPRGKRZSA-N 0 3 420.439 4.377 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)N[C@@H](c2cccc(C)c2)C(F)(F)F)c1 ZINC000484795090 900200199 /nfs/dbraw/zinc/20/01/99/900200199.db2.gz JWGVUPQPLZKEKR-FQEVSTJZSA-N 0 3 423.479 4.380 20 0 HIADHN Cc1cccc(C(=O)N2CCCN(CCCC(=O)Nc3c(C)cc(C)cc3C)CC2)c1 ZINC000484986074 900340586 /nfs/dbraw/zinc/34/05/86/900340586.db2.gz JNXIXPLSWZVSOR-UHFFFAOYSA-N 0 3 421.585 4.487 20 0 HIADHN CCOc1ccccc1NC(=O)CCN(C)[C@H]1c2cc(Cl)cc(Cl)c2C[C@@H]1O ZINC000484988972 900343823 /nfs/dbraw/zinc/34/38/23/900343823.db2.gz UADGIRRPIZNJID-RXVVDRJESA-N 0 3 423.340 4.311 20 0 HIADHN CCOc1cc(CN(Cc2ccccc2)[C@H](C)CC)nc2nc(C(F)(F)F)nn21 ZINC000485033200 900373641 /nfs/dbraw/zinc/37/36/41/900373641.db2.gz LRTMKDSTWVUTLI-CQSZACIVSA-N 0 3 407.440 4.343 20 0 HIADHN COc1cccc([C@@H](C)N2CCN(CCCC(=O)Nc3c(C)cccc3C)CC2)c1 ZINC000485128895 900431224 /nfs/dbraw/zinc/43/12/24/900431224.db2.gz FBNYMDRRJFWDHN-OAQYLSRUSA-N 0 3 409.574 4.410 20 0 HIADHN CCSc1cccc(C(=O)Nc2ccc(C(=O)N(C)[C@@H]3CCCN(C)C3)cc2)c1 ZINC000485284553 900562222 /nfs/dbraw/zinc/56/22/22/900562222.db2.gz KVOFVVLNAVPDPL-HXUWFJFHSA-N 0 3 411.571 4.217 20 0 HIADHN CCc1c(NC(=O)N[C@@H](C)C2=CCN(C)CC2)cnn1-c1cccc(C(F)(F)F)c1 ZINC000485327637 900610765 /nfs/dbraw/zinc/61/07/65/900610765.db2.gz ZHMQKKKJPIHMBP-AWEZNQCLSA-N 0 3 421.467 4.225 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CCC[C@]12CCOC2)c1ccc(C(F)(F)F)cc1 ZINC000485333077 900618649 /nfs/dbraw/zinc/61/86/49/900618649.db2.gz TTYZTJQOHVCFGC-AZUAARDMSA-N 0 3 413.484 4.053 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)NCc2nc3cc(Cl)ccc3s2)cc1 ZINC000485358692 900652975 /nfs/dbraw/zinc/65/29/75/900652975.db2.gz OEZJVTVLMDMXLY-KRWDZBQOSA-N 0 3 418.950 4.060 20 0 HIADHN CCn1ccnc1[C@H]1CCCCN1C(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000485376936 900673643 /nfs/dbraw/zinc/67/36/43/900673643.db2.gz CCUIXWYJCGNOII-MSOLQXFVSA-N 0 3 401.580 4.038 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)NCc1nc2cc(Cl)ccc2s1)c1ccco1 ZINC000485411452 900709628 /nfs/dbraw/zinc/70/96/28/900709628.db2.gz KPEMXLPSYOTXQW-DOMZBBRYSA-N 0 3 406.939 4.471 20 0 HIADHN CCOc1cc(CN(C)CC(C)(C)c2ccc(C)cc2)nc2nc(C(F)(F)F)nn21 ZINC000485441698 900738745 /nfs/dbraw/zinc/73/87/45/900738745.db2.gz SBOJDUJAZUXZBM-UHFFFAOYSA-N 0 3 421.467 4.260 20 0 HIADHN O=C(NCCN1CCCC1)c1ccc(NC(=O)C2(c3ccc(F)cc3)CCCC2)cc1 ZINC000485479435 900772475 /nfs/dbraw/zinc/77/24/75/900772475.db2.gz WZJOFIRRUQQDRG-UHFFFAOYSA-N 0 3 423.532 4.102 20 0 HIADHN CC[C@@H](C)[C@@H](C(=O)Nc1ccc(C(=O)NCCN2CCCC2)cc1)c1ccccc1 ZINC000485521823 900805188 /nfs/dbraw/zinc/80/51/88/900805188.db2.gz RWYMJRRQDSIRHY-AUSIDOKSSA-N 0 3 407.558 4.281 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2cccn2C2CCCC2)cc1)[C@@H]1CCCN(C)C1 ZINC000485602865 900863375 /nfs/dbraw/zinc/86/33/75/900863375.db2.gz UYPCXSPGCUWDOU-OAQYLSRUSA-N 0 3 408.546 4.022 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@@H]1CCCc2c[nH]nc21)c1ccc(C(F)(F)F)cc1 ZINC000485613325 900871295 /nfs/dbraw/zinc/87/12/95/900871295.db2.gz LSONQVLRLMUVQH-QZTJIDSGSA-N 0 3 423.483 4.188 20 0 HIADHN C[C@H](NC(=O)N1CCN(C2CCCCC2)CC1)c1cccc(OCc2ccccn2)c1 ZINC000485613103 900871450 /nfs/dbraw/zinc/87/14/50/900871450.db2.gz JTKLQWPMWFJCJV-FQEVSTJZSA-N 0 3 422.573 4.382 20 0 HIADHN CCc1ccc(Cl)c(CC)c1NC(=O)CCCN1CC[C@@](O)(C(F)(F)F)C1 ZINC000485677442 900930073 /nfs/dbraw/zinc/93/00/73/900930073.db2.gz FDFSPHHDRLKFLR-SFHVURJKSA-N 0 3 406.876 4.183 20 0 HIADHN Cc1cccc(C)c1NC(=O)CCCN(C)Cc1cc2c(cc1OC(F)F)OCO2 ZINC000485685354 900935423 /nfs/dbraw/zinc/93/54/23/900935423.db2.gz SQWXTMFYDNOVHD-UHFFFAOYSA-N 0 3 420.456 4.484 20 0 HIADHN Fc1cccc(CCCN2CCN(CCCc3nc(-c4cccs4)no3)CC2)c1 ZINC000485713336 900962720 /nfs/dbraw/zinc/96/27/20/900962720.db2.gz BOUWLXPFLKLYNZ-UHFFFAOYSA-N 0 3 414.550 4.120 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@@H](C)N[C@@H](C)c2ccc3ncsc3c2)cc1F ZINC000485820789 901067601 /nfs/dbraw/zinc/06/76/01/901067601.db2.gz UUIQSFCJDHYPDC-UONOGXRCSA-N 0 3 401.507 4.142 20 0 HIADHN CCCN(Cc1nc2ccc(Br)cc2n1C)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000485819379 901068264 /nfs/dbraw/zinc/06/82/64/901068264.db2.gz XKMSURCPGAREPV-GDIGMMSISA-N 0 3 406.368 4.361 20 0 HIADHN COc1ccc(OC)c([C@H](C)NC(=O)[C@H](C)N[C@@H](C)c2ccc3ncsc3c2)c1 ZINC000485830111 901076579 /nfs/dbraw/zinc/07/65/79/901076579.db2.gz FEVCJTRTSHSFEL-KKUMJFAQSA-N 0 3 413.543 4.230 20 0 HIADHN CCN(C(=O)c1cnnc(-c2ccccc2)c1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000485882324 901117998 /nfs/dbraw/zinc/11/79/98/901117998.db2.gz JBDVANASAKCAIG-AUSIDOKSSA-N 0 3 400.526 4.441 20 0 HIADHN CCN(C(=O)C(=O)Nc1ccc(Cl)c(F)c1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000485883413 901118065 /nfs/dbraw/zinc/11/80/65/901118065.db2.gz NISCNGSLFPUPBX-MAUKXSAKSA-N 0 3 417.912 4.102 20 0 HIADHN COc1cc(NC(=O)CN2C[C@H](c3ccccc3)[C@H]3CCCC[C@H]32)cc(OC)c1OC ZINC000485885197 901119393 /nfs/dbraw/zinc/11/93/93/901119393.db2.gz ZKPJELNYFTURQR-NJDAHSKKSA-N 0 3 424.541 4.309 20 0 HIADHN O=C(CCc1ccc2ccccc2n1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000486010464 901221311 /nfs/dbraw/zinc/22/13/11/901221311.db2.gz UZSYFIFAWVCGGH-UHFFFAOYSA-N 0 3 405.567 4.397 20 0 HIADHN C[C@@H](NC[C@@H](c1ccccc1)C(F)(F)F)c1cccc(N2CCCS2(=O)=O)c1 ZINC000486069830 901262361 /nfs/dbraw/zinc/26/23/61/901262361.db2.gz OCWTUWPYBUNJSS-BEFAXECRSA-N 0 3 412.477 4.223 20 0 HIADHN COc1cccc(Oc2ncccc2CNC(=O)N2CCN(C3CCCCC3)CC2)c1 ZINC000486115956 901302502 /nfs/dbraw/zinc/30/25/02/901302502.db2.gz LUAKTLPTWFMZKH-UHFFFAOYSA-N 0 3 424.545 4.042 20 0 HIADHN CC1(C)CN(C2(CNC(=O)CCc3ccc4ccccc4n3)CCCCC2)CCO1 ZINC000486228762 901411785 /nfs/dbraw/zinc/41/17/85/901411785.db2.gz HXYJECBDJGXKCE-UHFFFAOYSA-N 0 3 409.574 4.097 20 0 HIADHN O=C(CN1CCN(C2CCCCC2)CC1)N1Cc2ccccc2[C@H](c2ccccc2)C1 ZINC000486256986 901440744 /nfs/dbraw/zinc/44/07/44/901440744.db2.gz YQZPENQJVSKZIV-SANMLTNESA-N 0 3 417.597 4.111 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)NCc2ccccc2Br)CC1 ZINC000486342074 901516484 /nfs/dbraw/zinc/51/64/84/901516484.db2.gz PAQOMGYUCJUQLN-UHFFFAOYSA-N 0 3 416.363 4.255 20 0 HIADHN Fc1ccc(/C=C\CN2C[C@H]3CCC[C@@]3(c3nc(-c4cccnc4)no3)C2)c(F)c1 ZINC000486461721 901621837 /nfs/dbraw/zinc/62/18/37/901621837.db2.gz PNMYAGPDYWBJBU-GIHALPQZSA-N 0 3 408.452 4.477 20 0 HIADHN CN(CCN(Cc1ccccc1)C(=O)N[C@@H]1CCCc2c[nH]nc21)Cc1ccccc1 ZINC000486480737 901639548 /nfs/dbraw/zinc/63/95/48/901639548.db2.gz RDUQOSWAXJAXOW-HSZRJFAPSA-N 0 3 417.557 4.131 20 0 HIADHN C[C@@H]1CN(C2CCOCC2)CCN1C(=O)Nc1cc(Cl)ccc1N1CCCCC1 ZINC000486750614 901827932 /nfs/dbraw/zinc/82/79/32/901827932.db2.gz ZPQRLTCTKNIBKQ-QGZVFWFLSA-N 0 3 420.985 4.047 20 0 HIADHN CC(C)[C@H](C(=O)N1C[C@H]2CCC[C@@]2(c2nc(-c3ccccc3)no2)C1)N1CCCCC1 ZINC000486827311 901878872 /nfs/dbraw/zinc/87/88/72/901878872.db2.gz YBEYXZDDBSYRNJ-DNRQZRRGSA-N 0 3 422.573 4.127 20 0 HIADHN CC(C)c1c(NC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cnn1-c1ccccc1 ZINC000486856934 901902428 /nfs/dbraw/zinc/90/24/28/901902428.db2.gz JVMOWGBFYNLUTN-HXUWFJFHSA-N 0 3 403.530 4.392 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)c2nc3ccccc3cc2Cl)cc1 ZINC000486894592 901937531 /nfs/dbraw/zinc/93/75/31/901937531.db2.gz ARWKQEYKQQTXIY-OAQYLSRUSA-N 0 3 409.917 4.464 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)Nc1nnc(/C=C/c2ccco2)s1 ZINC000486899935 901944204 /nfs/dbraw/zinc/94/42/04/901944204.db2.gz LIGXBVJVQCACQE-MDZDMXLPSA-N 0 3 415.494 4.036 20 0 HIADHN CCOc1ccc(CNCCC(=O)Nc2ccc(Br)cc2C)cc1F ZINC000486929678 901972155 /nfs/dbraw/zinc/97/21/55/901972155.db2.gz WYTGJCJJAYQFAP-UHFFFAOYSA-N 0 3 409.299 4.414 20 0 HIADHN CCn1c2ccc(Br)cc2nc1NC(=O)c1ccccc1CN(C)C ZINC000486951386 901985786 /nfs/dbraw/zinc/98/57/86/901985786.db2.gz QEOYGGNIKXRIGH-UHFFFAOYSA-N 0 3 401.308 4.133 20 0 HIADHN C[C@@H](NC(=O)N(C)C1CCN(CCc2ccccn2)CC1)c1ccc2ncsc2c1 ZINC000487016894 902016125 /nfs/dbraw/zinc/01/61/25/902016125.db2.gz IRVIQCZRLVMKPB-QGZVFWFLSA-N 0 3 423.586 4.101 20 0 HIADHN O=C(N[C@H](c1ccccc1)c1ccc(F)cc1)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000505936239 914588178 /nfs/dbraw/zinc/58/81/78/914588178.db2.gz CDAFPRMGMKTWDC-BJKOFHAPSA-N 0 3 403.501 4.489 20 0 HIADHN CCc1ccc(Cl)c(CC)c1NC(=O)CCCN1CCOC2(CCOCC2)C1 ZINC000487151738 902077351 /nfs/dbraw/zinc/07/73/51/902077351.db2.gz DQRJDINZPIKKPZ-UHFFFAOYSA-N 0 3 408.970 4.065 20 0 HIADHN C[C@@H]1CN(C(=O)N[C@@H](CC2CCCCC2)C(C)(C)C)CC[C@H]1N1CCN(C)CC1 ZINC000487295360 902138495 /nfs/dbraw/zinc/13/84/95/902138495.db2.gz WFGJAEJTARLYGD-FCEUIQTBSA-N 0 3 406.659 4.039 20 0 HIADHN CC[C@H](Cc1ccccc1)N(C)Cc1nc(-c2cc(OC)c(OC)c(OC)c2)no1 ZINC000487358357 902161334 /nfs/dbraw/zinc/16/13/34/902161334.db2.gz COVOGPFINQXRJU-GOSISDBHSA-N 0 3 411.502 4.216 20 0 HIADHN Cc1noc(C)c1CCC(=O)N(CCN(C)Cc1ccccc1)Cc1ccccc1 ZINC000487410965 902193291 /nfs/dbraw/zinc/19/32/91/902193291.db2.gz JUJINJUBJYBJGE-UHFFFAOYSA-N 0 3 405.542 4.385 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N(C[C@@H]3CCCO3)C3CCCC3)c(C)c2)CC1 ZINC000487525482 902233949 /nfs/dbraw/zinc/23/39/49/902233949.db2.gz ZTNVGHHDTSTPIW-QFIPXVFZSA-N 0 3 414.594 4.092 20 0 HIADHN CN(CCN1CCCC1)C(=O)c1ccccc1Sc1ccc(Br)cn1 ZINC000487528208 902235417 /nfs/dbraw/zinc/23/54/17/902235417.db2.gz JJYVXMGMLSBNDQ-UHFFFAOYSA-N 0 3 420.376 4.163 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NC[C@@H]3SCCc4ccccc43)c(C)c2)CC1 ZINC000487718109 902313819 /nfs/dbraw/zinc/31/38/19/902313819.db2.gz GZZXJUWNNBDJRQ-QHCPKHFHSA-N 0 3 424.614 4.289 20 0 HIADHN CC[C@@H](C)NC(=O)c1ccc(NC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000505959234 914614767 /nfs/dbraw/zinc/61/47/67/914614767.db2.gz FHYRNTUYIPVEJX-XMSQKQJNSA-N 0 3 408.546 4.001 20 0 HIADHN CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)N[C@H]1CCC[C@@H](c2ccccc2)C1 ZINC000487747081 902338427 /nfs/dbraw/zinc/33/84/27/902338427.db2.gz GLECXBYJXNIVSM-KAMZKSLDSA-N 0 3 406.574 4.442 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000505959232 914615841 /nfs/dbraw/zinc/61/58/41/914615841.db2.gz FHYRNTUYIPVEJX-AVRDEDQJSA-N 0 3 408.546 4.001 20 0 HIADHN COc1ccc(CNC(=O)[C@@H](C)N[C@@H](C)c2ccc(F)c3ccccc32)cc1OC ZINC000487861417 902411628 /nfs/dbraw/zinc/41/16/28/902411628.db2.gz WWHCHPPKOXBJQR-JKSUJKDBSA-N 0 3 410.489 4.352 20 0 HIADHN Cc1cc(CN2CC[C@@H]3[C@@H](CCC(=O)N3C3CC3)C2)nc(-c2ccc(Cl)cc2)n1 ZINC000487975848 902500334 /nfs/dbraw/zinc/50/03/34/902500334.db2.gz FNXNXRCZXBUNDK-LAUBAEHRSA-N 0 3 410.949 4.081 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(Oc2cccnc2)cc1)C(=O)NC(=O)Nc1ccccc1 ZINC000488008238 902526777 /nfs/dbraw/zinc/52/67/77/902526777.db2.gz QYGCRGGLEYYNIE-IAGOWNOFSA-N 0 3 404.470 4.261 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)NC(=O)Nc1ccccc1)c1ccc(Oc2cccnc2)cc1 ZINC000488008240 902528644 /nfs/dbraw/zinc/52/86/44/902528644.db2.gz QYGCRGGLEYYNIE-SJORKVTESA-N 0 3 404.470 4.261 20 0 HIADHN CCc1c(NC(=O)c2ccnc(-c3ccc(Cl)cc3)n2)[nH]nc1-c1ccncc1 ZINC000488046146 902562288 /nfs/dbraw/zinc/56/22/88/902562288.db2.gz KISKEYBXFLLWTR-UHFFFAOYSA-N 0 3 404.861 4.397 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CC(C)(C)[C@H]1c1cccnc1)c1cccc(OC)c1 ZINC000488146416 902641055 /nfs/dbraw/zinc/64/10/55/902641055.db2.gz VJBXUKSQOHKIMY-FGZHOGPDSA-N 0 3 410.562 4.266 20 0 HIADHN CC(=O)N(c1nc(CN2CCN(C)[C@H](C(C)C)C2)cs1)c1cccc(Cl)c1 ZINC000488181827 902669990 /nfs/dbraw/zinc/66/99/90/902669990.db2.gz GCYAPJBHTBGQSK-IBGZPJMESA-N 0 3 406.983 4.253 20 0 HIADHN C[C@@H](NC(=O)N(C)C1CCN(CCc2ccccn2)CC1)c1cccc(Cl)c1 ZINC000488280836 902743374 /nfs/dbraw/zinc/74/33/74/902743374.db2.gz LSBVIZFFDGDUFG-QGZVFWFLSA-N 0 3 400.954 4.145 20 0 HIADHN C[C@@H](NCC1(c2ccc3c(c2)OCO3)CCOCC1)c1nccn1-c1ccccc1 ZINC000488286478 902749516 /nfs/dbraw/zinc/74/95/16/902749516.db2.gz HEWBMVGWXXSWAW-GOSISDBHSA-N 0 3 405.498 4.000 20 0 HIADHN Cc1ccc(Oc2ccc(NC(=O)N3CCN(C4CCOCC4)C[C@@H]3C)cn2)cc1C ZINC000488371703 902785508 /nfs/dbraw/zinc/78/55/08/902785508.db2.gz JZAPGMCMLCPDEX-IBGZPJMESA-N 0 3 424.545 4.208 20 0 HIADHN Cc1ccccc1[C@@H](C(C)C)N(C)CC(=O)N1CCC(C(=O)NCCC(C)C)CC1 ZINC000488675105 902936102 /nfs/dbraw/zinc/93/61/02/902936102.db2.gz VUIUPQZHVAEASK-XMMPIXPASA-N 0 3 415.622 4.025 20 0 HIADHN Cc1ccc(C)c(NC(=O)[C@@H](c2ccccc2)N2CCN(C3CCOCC3)C[C@H]2C)c1 ZINC000488692703 902947008 /nfs/dbraw/zinc/94/70/08/902947008.db2.gz UFUBJLNUROWLHM-PXDATVDWSA-N 0 3 421.585 4.168 20 0 HIADHN CC(=O)c1ccc(-c2ccc(C(=O)Nc3cccc(CN4CCC(O)CC4)c3)o2)cc1 ZINC000488694286 902948694 /nfs/dbraw/zinc/94/86/94/902948694.db2.gz FJOQQUOIVXQJAI-UHFFFAOYSA-N 0 3 418.493 4.358 20 0 HIADHN C[C@H](NC(=O)Nc1ccc(F)cc1OC1CCOCC1)[C@@H](c1ccccc1)N(C)C ZINC000488701721 902951823 /nfs/dbraw/zinc/95/18/23/902951823.db2.gz YPDMIWQDAATWGX-AOMKIAJQSA-N 0 3 415.509 4.196 20 0 HIADHN CN(C)C[C@@H](NC(=O)c1[nH]c2ccccc2c1Br)c1ccc(F)cc1 ZINC000488896498 903065825 /nfs/dbraw/zinc/06/58/25/903065825.db2.gz JSOABSGUZOZYSB-MRXNPFEDSA-N 0 3 404.283 4.102 20 0 HIADHN CC(C)C(=O)Nc1ccc(NC(=O)N(Cc2ccccc2)C2CCN(C)CC2)cc1 ZINC000489005365 903115062 /nfs/dbraw/zinc/11/50/62/903115062.db2.gz PPMWGLAYINKEBX-UHFFFAOYSA-N 0 3 408.546 4.409 20 0 HIADHN CC(=O)c1ccc(NC(=O)[C@@H](C)N[C@@H](COc2ccccc2F)C(C)(C)C)cc1 ZINC000489033661 903139657 /nfs/dbraw/zinc/13/96/57/903139657.db2.gz IEJWBNSSPXRLSJ-VFNWGFHPSA-N 0 3 400.494 4.439 20 0 HIADHN O=C(NC[C@@H](OCc1ccccc1)c1ccc(Cl)cc1)N[C@@H]1CCN(C2CC2)C1 ZINC000489049391 903155363 /nfs/dbraw/zinc/15/53/63/903155363.db2.gz VGEMZFLSEWKZAW-IFMALSPDSA-N 0 3 413.949 4.134 20 0 HIADHN Cc1cc(NC(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)n(-c2cc(C)ccn2)n1 ZINC000489093108 903191762 /nfs/dbraw/zinc/19/17/62/903191762.db2.gz URONIFLQGSZAMM-FQEVSTJZSA-N 0 3 418.545 4.012 20 0 HIADHN Cc1ccc(NC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)cc1C(=O)N(C)C(C)C ZINC000489126604 903216368 /nfs/dbraw/zinc/21/63/68/903216368.db2.gz HPBFHKBJMUHFKL-QFIPXVFZSA-N 0 3 422.573 4.262 20 0 HIADHN CN(CCCCNC(=O)N(Cc1ccccc1)C1CCN(C)CC1)c1ccccc1 ZINC000489319717 903329902 /nfs/dbraw/zinc/32/99/02/903329902.db2.gz XJRYRZOEMJQYLK-UHFFFAOYSA-N 0 3 408.590 4.209 20 0 HIADHN COc1cccc(-c2nc(CN3CCC(CCCN4CCOCC4)CC3)cs2)c1 ZINC000506026359 914708132 /nfs/dbraw/zinc/70/81/32/914708132.db2.gz GIFYVSSHSXVMFM-UHFFFAOYSA-N 0 3 415.603 4.143 20 0 HIADHN Cc1noc(C)c1CNC(=O)N(CCN(C)Cc1ccccc1)Cc1ccccc1 ZINC000489399796 903366638 /nfs/dbraw/zinc/36/66/38/903366638.db2.gz UYQIXPQGTIFIBW-UHFFFAOYSA-N 0 3 406.530 4.135 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)NC[C@@H](Cc2ccccc2)c2ccccc2)CC1 ZINC000489452130 903390860 /nfs/dbraw/zinc/39/08/60/903390860.db2.gz SUWOIGFRXKHFAP-XMMPIXPASA-N 0 3 423.601 4.202 20 0 HIADHN CC[C@H](CN1CCN(CC(=O)Nc2ccccc2C(F)(F)F)CC1)c1ccccc1 ZINC000506034409 914717242 /nfs/dbraw/zinc/71/72/42/914717242.db2.gz CUUXWAMFJDKRIX-GOSISDBHSA-N 0 3 419.491 4.455 20 0 HIADHN CC(C)c1ccccc1OCCNC(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000489554656 903460354 /nfs/dbraw/zinc/46/03/54/903460354.db2.gz UJIMSYRPYHQNNH-UHFFFAOYSA-N 0 3 409.574 4.495 20 0 HIADHN O=C(Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)c1cccn1C1CCCC1 ZINC000489651218 903516206 /nfs/dbraw/zinc/51/62/06/903516206.db2.gz JSQAOCLDZZBLCD-NRFANRHFSA-N 0 3 403.530 4.499 20 0 HIADHN COc1cc(C)cc(NC(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)c1C ZINC000489701472 903547526 /nfs/dbraw/zinc/54/75/26/903547526.db2.gz KAWIKHMDLBUPIJ-HDICACEKSA-N 0 3 403.567 4.055 20 0 HIADHN CCCN(C(=O)NCc1ccccc1CN1CCC(O)CC1)[C@H]1CCc2ccccc21 ZINC000489710220 903552434 /nfs/dbraw/zinc/55/24/34/903552434.db2.gz HUGUUYLAVYLHQX-VWLOTQADSA-N 0 3 421.585 4.252 20 0 HIADHN CN(Cc1cccc2ccccc21)C(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000489769422 903590478 /nfs/dbraw/zinc/59/04/78/903590478.db2.gz DCPQHPLSVOUZIF-UHFFFAOYSA-N 0 3 417.553 4.138 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)N1CCCCC[C@@H]1c1ccco1 ZINC000489812330 903608326 /nfs/dbraw/zinc/60/83/26/903608326.db2.gz SSWBCTSONOIFJL-JOCHJYFZSA-N 0 3 411.546 4.063 20 0 HIADHN Cc1ccc([C@H]2C[C@H](C)N(CC(=O)N3CCC(OCc4ccccc4)CC3)C2)cc1 ZINC000490051172 903743830 /nfs/dbraw/zinc/74/38/30/903743830.db2.gz BRDDFSCIQBJYPV-URXFXBBRSA-N 0 3 406.570 4.381 20 0 HIADHN C[C@H](NCCCCCn1nnc(-c2ccccc2)n1)c1nc(C(F)(F)F)cs1 ZINC000490080520 903762629 /nfs/dbraw/zinc/76/26/29/903762629.db2.gz PEHPJVHSTZQGGS-ZDUSSCGKSA-N 0 3 410.469 4.337 20 0 HIADHN Fc1ccccc1-c1nc(CN2CCC(CCCN3CCOCC3)CC2)cs1 ZINC000506050379 914748975 /nfs/dbraw/zinc/74/89/75/914748975.db2.gz AYUUYWMPETXREH-UHFFFAOYSA-N 0 3 403.567 4.274 20 0 HIADHN CC(C)C[C@H](CN[C@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1)N(C)C ZINC000490135133 903784286 /nfs/dbraw/zinc/78/42/86/903784286.db2.gz FGSDKCOWMWQGBV-IFMALSPDSA-N 0 3 423.022 4.399 20 0 HIADHN CCc1ccc([C@H](NC[C@H](CC(C)C)N(C)C)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000490138818 903785997 /nfs/dbraw/zinc/78/59/97/903785997.db2.gz XNCNFAUJXZEXIX-UPVQGACJSA-N 0 3 416.631 4.308 20 0 HIADHN Cc1ccc([C@@H](NC[C@H](CC(C)C)N(C)C)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000490139045 903788024 /nfs/dbraw/zinc/78/80/24/903788024.db2.gz YEEUBMXXMVOWBQ-URXFXBBRSA-N 0 3 416.631 4.362 20 0 HIADHN CCc1ccc([C@@H](NCCc2ccc(O)cc2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000490145158 903791059 /nfs/dbraw/zinc/79/10/59/903791059.db2.gz SCCNRRYYANLEJR-XMMPIXPASA-N 0 3 409.551 4.280 20 0 HIADHN Cc1ccc([C@@H](NCCc2nccs2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000490171706 903808833 /nfs/dbraw/zinc/80/88/33/903808833.db2.gz HJGUKJNVGVFBKE-NRFANRHFSA-N 0 3 400.569 4.085 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)Nc3nnc(/C=C\c4ccco4)s3)cc2)CC1 ZINC000490234933 903843823 /nfs/dbraw/zinc/84/38/23/903843823.db2.gz CNBIKWJMKSMTSO-KTKRTIGZSA-N 0 3 423.542 4.084 20 0 HIADHN O=C(NCCc1nc2ccccc2s1)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000506056657 914756733 /nfs/dbraw/zinc/75/67/33/914756733.db2.gz XAUMVZYRXGGPIK-QGZVFWFLSA-N 0 3 415.509 4.112 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)c3ccc(Oc4cccc(Cl)c4Cl)nc3)[C@H]2C1 ZINC000490315619 903897048 /nfs/dbraw/zinc/89/70/48/903897048.db2.gz VESSKSHKWJCYRW-CJNGLKHVSA-N 0 3 406.313 4.347 20 0 HIADHN CCNC(=O)Nc1ccc(C)c(NC(=O)NC[C@H](CC)N2CCc3ccccc3C2)c1 ZINC000490337567 903926065 /nfs/dbraw/zinc/92/60/65/903926065.db2.gz OUWPBALJLGXNNU-NRFANRHFSA-N 0 3 423.561 4.095 20 0 HIADHN CCNC(=O)Nc1ccc(C)c(NC(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)c1 ZINC000490338834 903927923 /nfs/dbraw/zinc/92/79/23/903927923.db2.gz YGZUHCASPJOZAZ-JOCHJYFZSA-N 0 3 423.561 4.403 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Nc1cc(F)cc(Br)c1F ZINC000490528318 904076566 /nfs/dbraw/zinc/07/65/66/904076566.db2.gz PGMYSHNTBIRHID-UHFFFAOYSA-N 0 3 418.307 4.385 20 0 HIADHN C[C@@H]1CCCCN1CCNC(=O)C(=O)Nc1ccc(Oc2cccc(Cl)c2)cc1 ZINC000490544166 904089491 /nfs/dbraw/zinc/08/94/91/904089491.db2.gz LSJRDYLONVEAFT-MRXNPFEDSA-N 0 3 415.921 4.061 20 0 HIADHN COc1ccccc1-c1ncc(CNCCOc2cccc(C(F)(F)F)c2)cn1 ZINC000490616794 904139212 /nfs/dbraw/zinc/13/92/12/904139212.db2.gz GPOJWTXZQJUITL-UHFFFAOYSA-N 0 3 403.404 4.340 20 0 HIADHN CCN(CC)C(=O)c1cccc(NC(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)c1 ZINC000490661819 904161542 /nfs/dbraw/zinc/16/15/42/904161542.db2.gz LAAZNDGMEFZVEV-HSZRJFAPSA-N 0 3 422.573 4.436 20 0 HIADHN O=C1C[C@@H]([C@@H]2CCCCN2Cc2csc(-c3ccc(C(F)(F)F)cc3)n2)CN1 ZINC000490676220 904167999 /nfs/dbraw/zinc/16/79/99/904167999.db2.gz SFNXLRWXNCUQDP-PBHICJAKSA-N 0 3 409.477 4.320 20 0 HIADHN CCCN1CCC(N(C)S(=O)(=O)c2cc(Cl)ccc2OCCC2CC2)CC1 ZINC000490719055 904190835 /nfs/dbraw/zinc/19/08/35/904190835.db2.gz GTRDAGITSZYWME-UHFFFAOYSA-N 0 3 414.999 4.014 20 0 HIADHN Cc1ccc(NC(=O)Nc2ccccc2)cc1NC(=O)N1CC[C@@H]2CCN(C)C[C@H]21 ZINC000490805605 904252847 /nfs/dbraw/zinc/25/28/47/904252847.db2.gz LYMCGFCPQQUAMV-LAUBAEHRSA-N 0 3 407.518 4.197 20 0 HIADHN COc1ccccc1-c1ncc(CNCCCOc2cccc3cccnc32)cn1 ZINC000490883378 904301147 /nfs/dbraw/zinc/30/11/47/904301147.db2.gz IIIOMDZCIUCIAD-UHFFFAOYSA-N 0 3 400.482 4.259 20 0 HIADHN COc1cccc([C@H](CNC(=O)N2CCC[C@@H]2c2nc3cc(C)ccc3[nH]2)N(C)C)c1 ZINC000490929853 904324267 /nfs/dbraw/zinc/32/42/67/904324267.db2.gz ZCFNYZFULKDPEX-YADHBBJMSA-N 0 3 421.545 4.029 20 0 HIADHN COc1cccc([C@H](CNC(=O)N2CCC[C@@H]2c2nc3ccc(C)cc3[nH]2)N(C)C)c1 ZINC000490929853 904324272 /nfs/dbraw/zinc/32/42/72/904324272.db2.gz ZCFNYZFULKDPEX-YADHBBJMSA-N 0 3 421.545 4.029 20 0 HIADHN CC(C)N(Cc1ccc([S@](C)=O)cc1)C[C@H](O)COc1cccc2ccccc21 ZINC000506099414 914803145 /nfs/dbraw/zinc/80/31/45/914803145.db2.gz QDQZWTPPUKVOEG-LGGPFLRQSA-N 0 3 411.567 4.228 20 0 HIADHN Cc1cccc(-c2nn(-c3ccc(F)cc3)cc2CN2CCC(C(=O)N(C)C)CC2)c1 ZINC000506100682 914803192 /nfs/dbraw/zinc/80/31/92/914803192.db2.gz GDOWALIDBKJNMZ-UHFFFAOYSA-N 0 3 420.532 4.287 20 0 HIADHN O=C(NCCc1cccc2cccnc21)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000506100426 914803492 /nfs/dbraw/zinc/80/34/92/914803492.db2.gz ANIXEGLKRRFMPS-NRFANRHFSA-N 0 3 409.480 4.051 20 0 HIADHN CN(CCN[C@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1)C1CCCC1 ZINC000491033576 904385322 /nfs/dbraw/zinc/38/53/22/904385322.db2.gz FGFJZBYJMRSHDH-JOCHJYFZSA-N 0 3 421.006 4.297 20 0 HIADHN Brc1ccc(CN2CCC[C@@H](c3nnc4ccccn43)C2)c2ncccc12 ZINC000491088579 904420907 /nfs/dbraw/zinc/42/09/07/904420907.db2.gz AZVMZJOQKRBTNV-MRXNPFEDSA-N 0 3 422.330 4.420 20 0 HIADHN Cc1ccccc1[C@H](NC(=O)N(CCN(C)C)Cc1ccc(F)c(F)c1)C1CC1 ZINC000491181536 904468811 /nfs/dbraw/zinc/46/88/11/904468811.db2.gz FBVMBFYGQKFAMX-JOCHJYFZSA-N 0 3 401.501 4.498 20 0 HIADHN COc1ccccc1-c1ncc(CNCCc2nc(-c3ccncc3)cs2)cn1 ZINC000491213569 904483730 /nfs/dbraw/zinc/48/37/30/904483730.db2.gz NGEBKKGDEBCCEJ-UHFFFAOYSA-N 0 3 403.511 4.003 20 0 HIADHN COc1ccccc1-c1ncc(CNCCNc2cccc(Br)c2)cn1 ZINC000491311547 904530705 /nfs/dbraw/zinc/53/07/05/904530705.db2.gz WSQHTYHLWAWYIE-UHFFFAOYSA-N 0 3 413.319 4.116 20 0 HIADHN Cn1cc(CN2CCC[C@H](c3nnc4ccccn43)C2)c(-c2ccccc2Cl)n1 ZINC000506140751 914820873 /nfs/dbraw/zinc/82/08/73/914820873.db2.gz IHGFVNNKLCSRNP-INIZCTEOSA-N 0 3 406.921 4.163 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](NCCc2ccc(F)cc2)c2ccc(F)c(F)c2)c1 ZINC000491343491 904545893 /nfs/dbraw/zinc/54/58/93/904545893.db2.gz OLLBFXKRGUAAOW-QFIPXVFZSA-N 0 3 419.468 4.429 20 0 HIADHN Cc1ccc([C@H](NC[C@@H](c2ccccc2)N(C)C)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000491343596 904548129 /nfs/dbraw/zinc/54/81/29/904548129.db2.gz PKTPCFMSDIGBNK-DQEYMECFSA-N 0 3 422.594 4.380 20 0 HIADHN CC(=O)N1CCC(N[C@@H](c2ccccc2)c2cc(Br)ccc2F)CC1 ZINC000491357091 904555493 /nfs/dbraw/zinc/55/54/93/904555493.db2.gz VROJYCGRJSMVOG-FQEVSTJZSA-N 0 3 405.311 4.278 20 0 HIADHN C[C@@]1(C2CC2)NC(=O)N(c2cccc(CNCc3ccc4c(c3)CCCC4)c2)C1=O ZINC000491357933 904556975 /nfs/dbraw/zinc/55/69/75/904556975.db2.gz CCQVDKJJRIIIFB-VWLOTQADSA-N 0 3 403.526 4.080 20 0 HIADHN CC(C)(CN[C@@H](c1ccc(F)cc1)c1cccc(S(C)(=O)=O)c1)N1CCCCC1 ZINC000491365325 904560708 /nfs/dbraw/zinc/56/07/08/904560708.db2.gz DGFDWEBAKOBPHO-QFIPXVFZSA-N 0 3 418.578 4.173 20 0 HIADHN CC[C@H]1CCCCN1CCNC(=O)C(=O)Nc1cccc(COC(C)(C)CC)c1C ZINC000491389745 904572338 /nfs/dbraw/zinc/57/23/38/904572338.db2.gz PLTXNZIEBHEYTE-FQEVSTJZSA-N 0 3 417.594 4.019 20 0 HIADHN Cc1ccc([C@@H](NC[C@H]2Cc3ccccc3O2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000491392584 904573727 /nfs/dbraw/zinc/57/37/27/904573727.db2.gz AUQMRKNSJLYSQR-BWKNWUBXSA-N 0 3 421.562 4.390 20 0 HIADHN COc1ccccc1CCN[C@H](c1ccc(C)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000491410956 904583006 /nfs/dbraw/zinc/58/30/06/904583006.db2.gz SWRCVKIVBZAANL-XMMPIXPASA-N 0 3 409.551 4.329 20 0 HIADHN CCc1ccc([C@H](NC2CCN(S(C)(=O)=O)CC2)c2ccccc2Cl)cc1 ZINC000491411511 904584517 /nfs/dbraw/zinc/58/45/17/904584517.db2.gz XQEWWCHUTDVLAD-NRFANRHFSA-N 0 3 406.979 4.005 20 0 HIADHN CCN(CC)[C@H](CN[C@@H](c1cnn(C)c1)c1cccc(F)c1)c1cccc(OC)c1 ZINC000491425161 904589580 /nfs/dbraw/zinc/58/95/80/904589580.db2.gz ZCSPWADZSICKOL-DNQXCXABSA-N 0 3 410.537 4.330 20 0 HIADHN O=C(Nc1cc(F)c(OC(F)F)cc1F)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000491437025 904597287 /nfs/dbraw/zinc/59/72/87/904597287.db2.gz YAAJNIVPROINLM-AWEZNQCLSA-N 0 3 411.399 4.352 20 0 HIADHN O=C(Nc1ccccc1O)C1CCN(Cc2ccccc2OCc2ccncc2)CC1 ZINC000506152001 914825856 /nfs/dbraw/zinc/82/58/56/914825856.db2.gz URTBADCMWBNFSO-UHFFFAOYSA-N 0 3 417.509 4.217 20 0 HIADHN C[C@@H](NC(=O)NC[C@@H](c1ccccc1)N1CCCC1)c1nc(C(F)(F)F)cs1 ZINC000491527644 904638503 /nfs/dbraw/zinc/63/85/03/904638503.db2.gz BHEUAFLZXVNADO-HIFRSBDPSA-N 0 3 412.481 4.359 20 0 HIADHN CCOc1cc2c(cc1NC(=O)N(CCN(C)C)Cc1cccc(C)c1)O[C@@H](C)C2 ZINC000491723184 904689366 /nfs/dbraw/zinc/68/93/66/904689366.db2.gz WLGZUFJLAAMHTR-SFHVURJKSA-N 0 3 411.546 4.313 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)Nc3ccc(Cl)c(C(=O)Nc4ccccc4)c3)[C@@H]2C1 ZINC000492049096 904773356 /nfs/dbraw/zinc/77/33/56/904773356.db2.gz WXURZBOQCJGUSI-FOIQADDNSA-N 0 3 412.921 4.150 20 0 HIADHN Cc1noc(C)c1CCN[C@@H](c1cccc(S(C)(=O)=O)c1)c1ccc(C)cc1C ZINC000492100802 904799015 /nfs/dbraw/zinc/79/90/15/904799015.db2.gz QIISPTIUUKFXBY-QHCPKHFHSA-N 0 3 412.555 4.233 20 0 HIADHN Cc1ccc([C@H](NCCN2[C@H](C)CCC[C@H]2C)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000492122437 904801767 /nfs/dbraw/zinc/80/17/67/904801767.db2.gz MXGGHESKVRFPTA-REHUZNOOSA-N 0 3 414.615 4.340 20 0 HIADHN CCN1CCCC[C@H]1CN[C@@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000492181567 904810730 /nfs/dbraw/zinc/81/07/30/904810730.db2.gz UGSJXFBQMNHGQS-UNMCSNQZSA-N 0 3 421.006 4.297 20 0 HIADHN CCN1CCCN(C(=O)Nc2c(-c3ccc(C)cc3)csc2C(=O)OC)CC1 ZINC000492226211 904818891 /nfs/dbraw/zinc/81/88/91/904818891.db2.gz UNPBWBZELZRJRK-UHFFFAOYSA-N 0 3 401.532 4.070 20 0 HIADHN CCSc1cccc(CNCc2ccc(OCC(=O)N3CCCC3)c(OC)c2)c1 ZINC000492312199 904832447 /nfs/dbraw/zinc/83/24/47/904832447.db2.gz KWFGQWODRAIDMG-UHFFFAOYSA-N 0 3 414.571 4.098 20 0 HIADHN CN(C(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F)[C@H](c1ncc[nH]1)c1ccccc1 ZINC000492468817 904855700 /nfs/dbraw/zinc/85/57/00/904855700.db2.gz WIHZMDSZICHJLG-SFTDATJTSA-N 0 3 424.495 4.115 20 0 HIADHN COc1ccc(CN(C)Cc2ccc(OCc3noc(C)n3)cc2)cc1OC(F)F ZINC000506230541 914854417 /nfs/dbraw/zinc/85/44/17/914854417.db2.gz CBODWIWQAWDSGX-UHFFFAOYSA-N 0 3 419.428 4.199 20 0 HIADHN COc1ccccc1OCc1ccc(C(=O)NC2CCN(Cc3ccccc3)CC2)o1 ZINC000492849788 904924004 /nfs/dbraw/zinc/92/40/04/904924004.db2.gz DKHIVNLEXYUYBE-UHFFFAOYSA-N 0 3 420.509 4.262 20 0 HIADHN C[C@H](C(=O)N(C)[C@H](c1ncc[nH]1)c1ccccc1)N1CCC(Cc2ccccc2)CC1 ZINC000493010018 904988231 /nfs/dbraw/zinc/98/82/31/904988231.db2.gz PGGYVRZAJKBERI-YKSBVNFPSA-N 0 3 416.569 4.301 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](NCCc2ccncc2)c2ccc(Cl)cc2)c1 ZINC000493074905 905011005 /nfs/dbraw/zinc/01/10/05/905011005.db2.gz AHRDIQPTBNHPOM-NRFANRHFSA-N 0 3 400.931 4.060 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](NCC2CCSCC2)c2ccc(F)c(F)c2)c1 ZINC000493224769 905055561 /nfs/dbraw/zinc/05/55/61/905055561.db2.gz FCHMNGMHERNCLO-HXUWFJFHSA-N 0 3 411.539 4.191 20 0 HIADHN Cc1ccc([C@H](NC[C@H](O)CC(C)(C)C)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000493236200 905060705 /nfs/dbraw/zinc/06/07/05/905060705.db2.gz ZVAQKRPMTHPETL-DENIHFKCSA-N 0 3 403.588 4.183 20 0 HIADHN Fc1ccc(Br)cc1[C@@H](NCCCO[C@H]1CCOC1)c1ccccc1 ZINC000493249574 905067609 /nfs/dbraw/zinc/06/76/09/905067609.db2.gz QJCLXDCUDUMARB-PXNSSMCTSA-N 0 3 408.311 4.463 20 0 HIADHN Cc1cccc2sc(N(Cc3ccccc3)C(=O)CN[C@@H]3CCC[C@]3(C)CO)nc21 ZINC000493413425 905114335 /nfs/dbraw/zinc/11/43/35/905114335.db2.gz PADDSKLCMUPZTH-HYBUGGRVSA-N 0 3 423.582 4.279 20 0 HIADHN COc1ccc(-c2[nH]c3ccccc3c2CCC(=O)N2CC[C@@H]3CCN(C)C[C@H]32)cc1 ZINC000493441646 905123913 /nfs/dbraw/zinc/12/39/13/905123913.db2.gz YIWVXJZVHFTMMI-MHECFPHRSA-N 0 3 417.553 4.329 20 0 HIADHN Cc1cc(NC(=O)C[C@@H](C)c2c(C)n[nH]c2C)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000493463563 905130640 /nfs/dbraw/zinc/13/06/40/905130640.db2.gz VSYAFGCLVMGATQ-IERDGZPVSA-N 0 3 420.561 4.111 20 0 HIADHN Cc1ccccc1-c1cc(C(=O)N2CC[C@@H]3CCN(C)C[C@H]32)c2cnn(C(C)C)c2n1 ZINC000493469430 905133186 /nfs/dbraw/zinc/13/31/86/905133186.db2.gz ZYRXAPBOULCWJH-FDDCHVKYSA-N 0 3 417.557 4.154 20 0 HIADHN COc1cc(C(=O)NCCN2CCCC2)ccc1OCc1ccc(Cl)cc1Cl ZINC000493559204 905161116 /nfs/dbraw/zinc/16/11/16/905161116.db2.gz AILGPBKLLFAKHD-UHFFFAOYSA-N 0 3 423.340 4.407 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCCC1)c1cccc(Oc2ccncc2)c1 ZINC000493603563 905170114 /nfs/dbraw/zinc/17/01/14/905170114.db2.gz SLWASECVCXZQKW-UHFFFAOYSA-N 0 3 411.571 4.355 20 0 HIADHN COC[C@H](NCc1ccc(CN2C[C@H](C)O[C@@H](C)C2)cc1)c1ccc(Cl)cc1 ZINC000493738512 905207971 /nfs/dbraw/zinc/20/79/71/905207971.db2.gz PQDODLKAAQOQGC-BSRJHKFKSA-N 0 3 402.966 4.427 20 0 HIADHN COc1cc([C@@H](C)N[C@@H](C)c2cc(Br)cs2)ccc1OCCO ZINC000493810589 905225507 /nfs/dbraw/zinc/22/55/07/905225507.db2.gz AWUVCYSLXBJCCQ-NEPJUHHUSA-N 0 3 400.338 4.302 20 0 HIADHN COC(=O)c1ccccc1CC1CCN(C(=O)Nc2cccc(CN(C)C)c2)CC1 ZINC000493883848 905242135 /nfs/dbraw/zinc/24/21/35/905242135.db2.gz SMQNCRVCWAABTJ-UHFFFAOYSA-N 0 3 409.530 4.021 20 0 HIADHN Cc1cc(Br)cc2c1[C@H](NCc1ccc(N3CCO[C@H](C)C3)nc1)CC2 ZINC000493882183 905242263 /nfs/dbraw/zinc/24/22/63/905242263.db2.gz HVXYSUJLLVXPKS-DNVCBOLYSA-N 0 3 416.363 4.155 20 0 HIADHN CN1C(=O)C[C@@H](NCc2cc(F)cc3cccnc32)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000493909551 905261456 /nfs/dbraw/zinc/26/14/56/905261456.db2.gz WBQKIFOTYKOFAE-NQIIRXRSSA-N 0 3 401.844 4.228 20 0 HIADHN CC[C@H](NC(=O)NC[C@H](c1ccc(OC(C)C)cc1)N(C)C)c1nc(C)cs1 ZINC000493919131 905269921 /nfs/dbraw/zinc/26/99/21/905269921.db2.gz GWCYUELKZWIJDU-RBUKOAKNSA-N 0 3 404.580 4.292 20 0 HIADHN Cc1cc(Br)cc2c1[C@H](NCc1ccc(CS(C)(=O)=O)cc1)CC2 ZINC000493943892 905295298 /nfs/dbraw/zinc/29/52/98/905295298.db2.gz GHTZQESNADJZCV-GOSISDBHSA-N 0 3 408.361 4.079 20 0 HIADHN COc1cccc(Cn2ccc3ccc(NC(=O)N4CC[C@@H]5CCN(C)C[C@@H]54)cc32)c1 ZINC000493965846 905315377 /nfs/dbraw/zinc/31/53/77/905315377.db2.gz XAVYOQUZPIVEOP-RDPSFJRHSA-N 0 3 418.541 4.256 20 0 HIADHN CCN(C(=O)[C@@H](C)Nc1ccc(N2CCN(CC)CC2)cc1C)C1CCCCC1 ZINC000493975065 905322490 /nfs/dbraw/zinc/32/24/90/905322490.db2.gz ALXLWHQCCFEAOF-HXUWFJFHSA-N 0 3 400.611 4.119 20 0 HIADHN CCc1ccc([C@H](NCC(C)(C)C[C@@H](C)O)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000494018789 905356706 /nfs/dbraw/zinc/35/67/06/905356706.db2.gz FIFOPQYDAFSQHH-VGSWGCGISA-N 0 3 403.588 4.129 20 0 HIADHN Cc1nn(Cc2ccccc2Cl)c(C)c1CN1CCC[C@H](CNC(=O)C(C)C)C1 ZINC000512405287 921139697 /nfs/dbraw/zinc/13/96/97/921139697.db2.gz YMBHRPMBVDKSSO-LJQANCHMSA-N 0 3 416.997 4.186 20 0 HIADHN CSc1nc(-c2ccco2)nc(C)c1C(=O)N[C@@H]1CCN(Cc2ccccc2)[C@@H]1C ZINC000494025534 905365978 /nfs/dbraw/zinc/36/59/78/905365978.db2.gz CMELWKFVXBLQIQ-SJLPKXTDSA-N 0 3 422.554 4.160 20 0 HIADHN C[C@H]1[C@@H](NC(=O)c2cn(C)nc2-c2ccccc2Cl)CCN1Cc1ccccc1 ZINC000494035762 905372887 /nfs/dbraw/zinc/37/28/87/905372887.db2.gz BCVZSOUELUSTTB-KKSFZXQISA-N 0 3 408.933 4.133 20 0 HIADHN C[C@H]1[C@@H](NC(=O)CCn2c3ccccc3nc2C2CC2)CCN1Cc1ccccc1 ZINC000494036591 905375132 /nfs/dbraw/zinc/37/51/32/905375132.db2.gz GAXKTHAHUSZUJX-RXVVDRJESA-N 0 3 402.542 4.083 20 0 HIADHN COc1ccc(C(=O)N[C@@H]2CCN(Cc3ccccc3)[C@H]2C)cc1-c1ccccn1 ZINC000494046618 905385572 /nfs/dbraw/zinc/38/55/72/905385572.db2.gz GXSDKJRNDSHPPA-PGRDOPGGSA-N 0 3 401.510 4.150 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)c1ccnc(SCC(F)(F)F)c1 ZINC000494098502 905432829 /nfs/dbraw/zinc/43/28/29/905432829.db2.gz AYLKIFMXNZQLKI-KRWDZBQOSA-N 0 3 409.477 4.303 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)C[C@H](C)c2c[nH]c3ccccc32)CC1 ZINC000494279658 905601815 /nfs/dbraw/zinc/60/18/15/905601815.db2.gz MXDXEVKOYOEMDV-FQEVSTJZSA-N 0 3 418.585 4.115 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cc(F)cc2nc(C)c(C)nc21)c1ccsc1 ZINC000494360398 905661790 /nfs/dbraw/zinc/66/17/90/905661790.db2.gz PXHGPZYKLJIMPX-LJQANCHMSA-N 0 3 400.523 4.260 20 0 HIADHN CCCOc1c(Cl)cc(CN2CCC(CCN3CCOCC3)CC2)cc1OC ZINC000512445258 921166372 /nfs/dbraw/zinc/16/63/72/921166372.db2.gz YIYCJCSMNDHEHN-UHFFFAOYSA-N 0 3 410.986 4.072 20 0 HIADHN Cc1ccc(C(C)(C)CNC(=O)N(C)C[C@@H]2CCN(C)[C@H]2c2cccnc2)c(C)c1 ZINC000494428171 905715315 /nfs/dbraw/zinc/71/53/15/905715315.db2.gz VPSOKJFVEMSIKB-GMAHTHKFSA-N 0 3 408.590 4.310 20 0 HIADHN OCC1(CN[C@H](c2ccc(Cl)cc2)c2ccc(OC(F)F)cc2)CCOCC1 ZINC000494460706 905744750 /nfs/dbraw/zinc/74/47/50/905744750.db2.gz YRXBTSKHLOSXJN-LJQANCHMSA-N 0 3 411.876 4.410 20 0 HIADHN C[C@@H](CC(=O)NCCc1ccccc1)NCc1ccnc(Oc2ccccc2F)c1 ZINC000494489971 905775299 /nfs/dbraw/zinc/77/52/99/905775299.db2.gz XEKRYSAQGBPJPJ-SFHVURJKSA-N 0 3 407.489 4.240 20 0 HIADHN Cc1ccc(NC(=O)NC(=O)[C@H](C)N[C@H]2CCO[C@H]2c2ccc(Cl)cc2)c(C)c1 ZINC000494493174 905779480 /nfs/dbraw/zinc/77/94/80/905779480.db2.gz HZVNNNXYJPMCSD-YSSFQJQWSA-N 0 3 415.921 4.113 20 0 HIADHN Cc1cc(Br)cc2c1[C@H](NCc1ccc(C)c(S(C)(=O)=O)c1)CC2 ZINC000494496478 905783860 /nfs/dbraw/zinc/78/38/60/905783860.db2.gz PLPSNMXQMAEQMO-QGZVFWFLSA-N 0 3 408.361 4.247 20 0 HIADHN O=C(NCc1ccco1)c1cccc(CN[C@H]2CCO[C@@H]2c2ccc(Cl)cc2)c1 ZINC000494499164 905788926 /nfs/dbraw/zinc/78/89/26/905788926.db2.gz XXCVXHGZPHYIRC-FCHUYYIVSA-N 0 3 410.901 4.483 20 0 HIADHN CCCC(=O)NC[C@H]1CCCN(Cc2cc3ccccc3nc2N2CCCCC2)C1 ZINC000512470252 921182875 /nfs/dbraw/zinc/18/28/75/921182875.db2.gz WNLIKHJNABGQLB-HXUWFJFHSA-N 0 3 408.590 4.353 20 0 HIADHN CC1CCN(CCNC(=O)c2cn(Cc3ccccc3)nc2-c2cccs2)CC1 ZINC000512473394 921183675 /nfs/dbraw/zinc/18/36/75/921183675.db2.gz CTLRBPAIFNTZEC-UHFFFAOYSA-N 0 3 408.571 4.122 20 0 HIADHN C[C@H](CC(=O)N(CCN(C)C)Cc1cccc(O)c1)c1ccccc1C(F)(F)F ZINC000494771992 905969449 /nfs/dbraw/zinc/96/94/49/905969449.db2.gz JQGHMDGNWTYDIB-MRXNPFEDSA-N 0 3 408.464 4.495 20 0 HIADHN CN(C)CCN(Cc1cccc(O)c1)C(=O)[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000494794732 905995953 /nfs/dbraw/zinc/99/59/53/905995953.db2.gz YYXSWFXHPTYKNL-ZWKOTPCHSA-N 0 3 407.341 4.393 20 0 HIADHN O=C(Nc1cccc(CN[C@H](C[C@@H]2CCOC2)c2ccc(F)cc2)c1)[C@H]1CCCO1 ZINC000494901978 906077465 /nfs/dbraw/zinc/07/74/65/906077465.db2.gz HIJILTHKFKRJRT-CDNPAEQRSA-N 0 3 412.505 4.201 20 0 HIADHN C[C@H](NC(=O)N1CCN(C2CCOCC2)C[C@@H]1C)c1ccccc1Oc1ccccc1 ZINC000494902890 906078130 /nfs/dbraw/zinc/07/81/30/906078130.db2.gz KKRHZDBMAUYPHQ-PMACEKPBSA-N 0 3 423.557 4.435 20 0 HIADHN C[C@H](N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1)c1ccc(C(=O)N(C)C)cc1 ZINC000494929502 906101800 /nfs/dbraw/zinc/10/18/00/906101800.db2.gz ITZFCLFSISNREP-CYFREDJKSA-N 0 3 415.537 4.289 20 0 HIADHN CC(C)N(C)C(=O)C1CCN(Cc2c[nH]nc2-c2ccc(C(F)(F)F)cc2)CC1 ZINC000494962440 906132193 /nfs/dbraw/zinc/13/21/93/906132193.db2.gz VDKYZCYHKRSCDH-UHFFFAOYSA-N 0 3 408.468 4.174 20 0 HIADHN Cc1ccc([C@@H](NCC2([C@@H](O)C(C)C)CC2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000494969432 906137452 /nfs/dbraw/zinc/13/74/52/906137452.db2.gz MMSXRFFFGAPHBX-GOTSBHOMSA-N 0 3 415.599 4.183 20 0 HIADHN COc1cccc([C@@H](NCCC2CCS(=O)(=O)CC2)c2ccccc2Cl)c1 ZINC000494989425 906153532 /nfs/dbraw/zinc/15/35/32/906153532.db2.gz SRIGKGMDQRANBF-OAQYLSRUSA-N 0 3 407.963 4.243 20 0 HIADHN Cc1cc(C)n(-c2ccc(C(=O)NC[C@@H](c3cccs3)N3CCC(C)CC3)cn2)n1 ZINC000512520492 921211543 /nfs/dbraw/zinc/21/15/43/921211543.db2.gz NWPBNDZZPUNRBN-FQEVSTJZSA-N 0 3 423.586 4.149 20 0 HIADHN C[C@H](N[C@@H](c1cncc(Br)c1)C1CC1)c1ccc(C(=O)N(C)C)cc1 ZINC000495020920 906179347 /nfs/dbraw/zinc/17/93/47/906179347.db2.gz VLIDRBOATUIFJD-ORAYPTAESA-N 0 3 402.336 4.348 20 0 HIADHN CCOc1c(OC)cc(CN[C@H](C[C@@H]2CCOC2)c2ccc(F)cc2)cc1OC ZINC000495054663 906209143 /nfs/dbraw/zinc/20/91/43/906209143.db2.gz VVJCUFUXEVHGSK-OXJNMPFZSA-N 0 3 403.494 4.499 20 0 HIADHN Cc1ccc(-c2c[nH]cc2C(=O)Nc2cccc(CN3CCC(C(N)=O)CC3)c2)s1 ZINC000495061640 906213459 /nfs/dbraw/zinc/21/34/59/906213459.db2.gz SYOPZUOTAZMYIS-UHFFFAOYSA-N 0 3 422.554 4.001 20 0 HIADHN Brc1ccccc1[C@H](N[C@@H]1CCO[C@@]2(CCOC2)C1)c1ccccc1 ZINC000495063016 906215916 /nfs/dbraw/zinc/21/59/16/906215916.db2.gz GKRMKSJSRYSSBT-UIFIKXQLSA-N 0 3 402.332 4.466 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)[C@@H](C)[C@H]3OCCc4sccc43)c2)CC1 ZINC000495365607 906407811 /nfs/dbraw/zinc/40/78/11/906407811.db2.gz JGUPRNIKJBWGQH-HTAPYJJXSA-N 0 3 413.587 4.167 20 0 HIADHN COc1cccc([C@@H]2[C@@H](N[C@@H](C)c3cc(OC)c(OC)cc3F)CCN2C2CC2)c1 ZINC000495407941 906432439 /nfs/dbraw/zinc/43/24/39/906432439.db2.gz KFVULJABNFLJID-OQHVVPOVSA-N 0 3 414.521 4.480 20 0 HIADHN Cc1ccc2nc(-c3ccc(NC(=O)[C@H](C)NCCn4cccn4)cc3)sc2c1 ZINC000495445524 906455663 /nfs/dbraw/zinc/45/56/63/906455663.db2.gz WTCBPIULVMLPJI-INIZCTEOSA-N 0 3 405.527 4.085 20 0 HIADHN Cc1ccc2nc(-c3ccc(NC(=O)[C@H](C)N[C@@H](C)Cn4cccn4)cc3)sc2c1 ZINC000495470401 906470635 /nfs/dbraw/zinc/47/06/35/906470635.db2.gz NTOAFCPJMYQKNH-IRXDYDNUSA-N 0 3 419.554 4.474 20 0 HIADHN CCCC[C@@H](NCCc1nc(-c2ccc(Cl)cc2)no1)C(=O)Nc1cc(C)on1 ZINC000495470355 906471015 /nfs/dbraw/zinc/47/10/15/906471015.db2.gz NHLLCDPXBXYYPP-MRXNPFEDSA-N 0 3 417.897 4.016 20 0 HIADHN Fc1ccc(-c2n[nH]cc2CN2CCC(c3nc(-c4ccccn4)no3)CC2)cc1 ZINC000512573775 921245370 /nfs/dbraw/zinc/24/53/70/921245370.db2.gz OFLZOJQLUYEFPN-UHFFFAOYSA-N 0 3 404.449 4.040 20 0 HIADHN CNC(=O)c1ccc(CNCc2cccc(Oc3cc(OC)cc(OC)c3)c2)cc1 ZINC000512569347 921242300 /nfs/dbraw/zinc/24/23/00/921242300.db2.gz NYHURWURYOVVTL-UHFFFAOYSA-N 0 3 406.482 4.146 20 0 HIADHN COc1ccsc1CN1CCC(C(=O)Nc2cccc(Br)c2)CC1 ZINC000512579929 921248114 /nfs/dbraw/zinc/24/81/14/921248114.db2.gz XYVQOUYAVLXXQR-UHFFFAOYSA-N 0 3 409.349 4.370 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)c1cc(F)cc(Br)c1 ZINC000496259997 906639848 /nfs/dbraw/zinc/63/98/48/906639848.db2.gz CJHKJKXRWIHOMK-LJQANCHMSA-N 0 3 420.326 4.110 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)c1nc(-c2ccccc2)oc1C ZINC000496261563 906640732 /nfs/dbraw/zinc/64/07/32/906640732.db2.gz IRPWUVICCUASID-NRFANRHFSA-N 0 3 404.514 4.172 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CN1CCC(C(=O)Nc2ccc(O)cc2)CC1 ZINC000512600153 921255221 /nfs/dbraw/zinc/25/52/21/921255221.db2.gz PWKQYEPCPYMPML-UHFFFAOYSA-N 0 3 404.514 4.045 20 0 HIADHN Cc1cc(Cl)ccc1Cc1cnc(NC(=O)N2CC[C@@H]3CCN(C)C[C@H]32)s1 ZINC000496445558 906681522 /nfs/dbraw/zinc/68/15/22/906681522.db2.gz AOKNLCGXEDVUOL-KBXCAEBGSA-N 0 3 404.967 4.254 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)Cc1csc(-c2cccc(F)c2)n1 ZINC000496438716 906681661 /nfs/dbraw/zinc/68/16/61/906681661.db2.gz TWFOVEUSGIIWKF-UHFFFAOYSA-N 0 3 415.509 4.221 20 0 HIADHN Cc1nc(-c2ccc(C(=O)N(CCN3CCCC3)Cc3ccc(Cl)cc3)cc2)n[nH]1 ZINC000496831122 906764352 /nfs/dbraw/zinc/76/43/52/906764352.db2.gz MSSYPEIAGIEVFM-UHFFFAOYSA-N 0 3 423.948 4.172 20 0 HIADHN Clc1ccc(Br)cc1CN1CCC(CCN2CCOCC2)CC1 ZINC000496839850 906765956 /nfs/dbraw/zinc/76/59/56/906765956.db2.gz ONQJMBKQVCIUHW-UHFFFAOYSA-N 0 3 401.776 4.037 20 0 HIADHN CCOc1cc(CN2CCC(C(=O)N[C@@H](C)C(C)C)CC2)ccc1OCC(C)C ZINC000512623694 921266210 /nfs/dbraw/zinc/26/62/10/921266210.db2.gz UFCCBLHQQGFMRQ-IBGZPJMESA-N 0 3 404.595 4.493 20 0 HIADHN COc1ccc([C@H]2CCCN2C[C@@H](O)COCc2ccccc2Cl)cc1OC ZINC000497095017 906803179 /nfs/dbraw/zinc/80/31/79/906803179.db2.gz FRLRRCWHIWWIAF-UYAOXDASSA-N 0 3 405.922 4.072 20 0 HIADHN COc1ccc([C@@H]2CCCN2C[C@@H](O)COCc2ccccc2Cl)cc1OC ZINC000497095015 906803892 /nfs/dbraw/zinc/80/38/92/906803892.db2.gz FRLRRCWHIWWIAF-QUCCMNQESA-N 0 3 405.922 4.072 20 0 HIADHN Cc1nc(COc2ccc(CN3CCC4(CC3)OCCc3ccsc34)cc2)no1 ZINC000497101152 906805012 /nfs/dbraw/zinc/80/50/12/906805012.db2.gz WGKCVSOLJUSXOE-UHFFFAOYSA-N 0 3 411.527 4.083 20 0 HIADHN COc1ccc(OC(F)F)c(CNCCOc2ccc(Br)cc2)c1 ZINC000497200379 906819121 /nfs/dbraw/zinc/81/91/21/906819121.db2.gz RJOARAMLNNFNOS-UHFFFAOYSA-N 0 3 402.235 4.228 20 0 HIADHN Cc1cn(-c2ccc(F)cc2)nc1C(=O)N1CCCN(CCCc2ccccc2)CC1 ZINC000512651444 921274561 /nfs/dbraw/zinc/27/45/61/921274561.db2.gz VHGDMIPJKVXOFI-UHFFFAOYSA-N 0 3 420.532 4.101 20 0 HIADHN CN1C[C@@H](c2ccccc2)[C@H](NC(=O)CCCc2ccc(Br)s2)C1 ZINC000497415649 906890956 /nfs/dbraw/zinc/89/09/56/906890956.db2.gz HWXYRSOIHDTASZ-DLBZAZTESA-N 0 3 407.377 4.047 20 0 HIADHN Cc1cc(NC(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)c(F)cc1Br ZINC000497446600 906921503 /nfs/dbraw/zinc/92/15/03/906921503.db2.gz YUMMJZFFOXASIX-SJLPKXTDSA-N 0 3 406.299 4.464 20 0 HIADHN Cc1ccc(C(=O)NC2CCN(Cc3cccc(OCc4ccccn4)c3)CC2)s1 ZINC000512674279 921283435 /nfs/dbraw/zinc/28/34/35/921283435.db2.gz VFBKNDQGUXDOAZ-UHFFFAOYSA-N 0 3 421.566 4.425 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)NCc3ccccc3COc3ccccc3Cl)[C@@H]2C1 ZINC000497506456 906996823 /nfs/dbraw/zinc/99/68/23/906996823.db2.gz IANFVEDQUZLJGI-DYESRHJHSA-N 0 3 413.949 4.155 20 0 HIADHN COc1cc(F)c([C@H](C)NC(=O)NC[C@@H](c2cccs2)N2CCCC2)cc1OC ZINC000512678124 921284723 /nfs/dbraw/zinc/28/47/23/921284723.db2.gz OQNMHGHUIAEZCU-YOEHRIQHSA-N 0 3 421.538 4.102 20 0 HIADHN Cc1cn(-c2ccc(F)cc2)nc1C(=O)NC[C@H]1CCCN(Cc2cccs2)C1 ZINC000512686048 921287072 /nfs/dbraw/zinc/28/70/72/921287072.db2.gz RPNBOPFSQAPESR-QGZVFWFLSA-N 0 3 412.534 4.023 20 0 HIADHN COc1ccc(CNC(=O)C2CCN(Cc3ccccc3OCC3CC3)CC2)cc1 ZINC000512692151 921288878 /nfs/dbraw/zinc/28/88/78/921288878.db2.gz BQBVOBVMRHTNTI-UHFFFAOYSA-N 0 3 408.542 4.012 20 0 HIADHN O[C@H](COc1ccc(Cl)cc1Cl)CN1CCC[C@H]1c1ccc2c(c1)OCCO2 ZINC000497587820 907067979 /nfs/dbraw/zinc/06/79/79/907067979.db2.gz WTQNHUXGOXBNPE-WMZOPIPTSA-N 0 3 424.324 4.341 20 0 HIADHN COc1cc(C)c([C@H](C)NC(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)cc1OC ZINC000497608898 907087201 /nfs/dbraw/zinc/08/72/01/907087201.db2.gz SJKDOLNUQNHHLI-CMKODMSKSA-N 0 3 411.546 4.035 20 0 HIADHN COC(=O)COc1c(C)cc(CN(C)Cc2ccc(SC)c(OC)c2)cc1C ZINC000512705850 921293007 /nfs/dbraw/zinc/29/30/07/921293007.db2.gz QWKQKXIYFDAICM-UHFFFAOYSA-N 0 3 403.544 4.218 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)N[C@@H](c3cccc(F)c3)c3cccc(Cl)c3)[C@H]2C1 ZINC000497619043 907098525 /nfs/dbraw/zinc/09/85/25/907098525.db2.gz WGWATWJUHJEZCO-GQWLDOHISA-N 0 3 401.913 4.304 20 0 HIADHN Cc1noc(C)c1C(C)(C)NC(=O)N[C@@H](CN1CCc2ccccc2C1)C(C)(C)C ZINC000497619299 907099048 /nfs/dbraw/zinc/09/90/48/907099048.db2.gz WXHGPIQPJYUDKM-FQEVSTJZSA-N 0 3 412.578 4.299 20 0 HIADHN Cc1cccnc1[C@H](NC(=O)NC[C@@H](c1ccc(OC(C)C)cc1)N(C)C)C(C)C ZINC000497629905 907111558 /nfs/dbraw/zinc/11/15/58/907111558.db2.gz UQINSEWDZTZNKN-FCHUYYIVSA-N 0 3 412.578 4.476 20 0 HIADHN COc1cc(C)c([C@H](C)NC(=O)NC[C@@H]2CCCN2Cc2ccccc2)cc1OC ZINC000497668526 907166795 /nfs/dbraw/zinc/16/67/95/907166795.db2.gz LIAZCEPOKOLQRW-ICSRJNTNSA-N 0 3 411.546 4.037 20 0 HIADHN CCOc1cc(C[NH2+]C[C@H](c2cccc(OC)c2)N2CCCC2)cc(Cl)c1[O-] ZINC000497670994 907170383 /nfs/dbraw/zinc/17/03/83/907170383.db2.gz OWQIIGSFVLKAQV-HXUWFJFHSA-N 0 3 404.938 4.380 20 0 HIADHN Cc1ccccc1-n1nc(C(=O)NC[C@H](c2ccccc2)N2CCCC2)c2c1CCC2 ZINC000497711226 907215244 /nfs/dbraw/zinc/21/52/44/907215244.db2.gz RVFYRDVZXKZCFM-XMMPIXPASA-N 0 3 414.553 4.236 20 0 HIADHN O[C@H](CO[C@H]1CCCc2ccccc21)CN(Cc1cccc(F)c1)C[C@H]1CCCO1 ZINC000497736169 907235091 /nfs/dbraw/zinc/23/50/91/907235091.db2.gz RPPSPFALYCTUTF-ARNLJNQMSA-N 0 3 413.533 4.262 20 0 HIADHN CCc1nc(C)c([C@@H](C)N(C)CC(O)CN(C)[C@H](C)c2sc(CC)nc2C)s1 ZINC000497750092 907242522 /nfs/dbraw/zinc/24/25/22/907242522.db2.gz KEQBLHKSOQAJGI-HZPDHXFCSA-N 0 3 424.680 4.388 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)C2(c3ccc(Cl)cc3)CCOCC2)N(C)C)cc1 ZINC000497814080 907300373 /nfs/dbraw/zinc/30/03/73/907300373.db2.gz CBXITGNLXKZWRE-JOCHJYFZSA-N 0 3 414.977 4.370 20 0 HIADHN O=C(c1ccoc1)N1CCC(N[C@@H](c2cc3ccccc3o2)c2cccnc2)CC1 ZINC000497842546 907321552 /nfs/dbraw/zinc/32/15/52/907321552.db2.gz JODYRHMZUQHBSW-HSZRJFAPSA-N 0 3 401.466 4.405 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)N2CCC(c3ccncc3)CC2)N(C)C)cc1 ZINC000512809806 921315757 /nfs/dbraw/zinc/31/57/57/921315757.db2.gz WFRCXKAIAPQULU-QHCPKHFHSA-N 0 3 410.562 4.061 20 0 HIADHN CCOC1CC2(C1)CCN([C@H]1CCCN(c3ccc(Br)c(C)c3)C1=O)C2 ZINC000512812313 921318138 /nfs/dbraw/zinc/31/81/38/921318138.db2.gz RZHRBVPWTKRQQQ-BIXGBWIQSA-N 0 3 421.379 4.144 20 0 HIADHN Cc1c(NCC(C)(C)C)cccc1C(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1CO ZINC000497888351 907360719 /nfs/dbraw/zinc/36/07/19/907360719.db2.gz IIRLZABNURCJEG-URXFXBBRSA-N 0 3 423.601 4.066 20 0 HIADHN Cc1cccc2nc(CNC(=O)NC[C@H](c3cccc(Cl)c3)N3CCCC3)[nH]c21 ZINC000497963832 907431518 /nfs/dbraw/zinc/43/15/18/907431518.db2.gz FEEQRQSXVAOQAQ-LJQANCHMSA-N 0 3 411.937 4.161 20 0 HIADHN CN(C)Cc1cccc(NC(=O)c2csc(-c3cnn(-c4ccccc4)c3)n2)c1 ZINC000497964425 907432807 /nfs/dbraw/zinc/43/28/07/907432807.db2.gz BLPALVINWNHGOB-UHFFFAOYSA-N 0 3 403.511 4.310 20 0 HIADHN COc1ccc([C@@H](CNC(=O)CCOc2ccc(Cl)cc2)N2CCCC2)cc1 ZINC000497987431 907467115 /nfs/dbraw/zinc/46/71/15/907467115.db2.gz XKDITMXTWRFEFQ-OAQYLSRUSA-N 0 3 402.922 4.071 20 0 HIADHN Cc1oc(-c2ccco2)nc1CC(=O)NC[C@H](c1cccs1)N1CCC(C)CC1 ZINC000497993338 907471766 /nfs/dbraw/zinc/47/17/66/907471766.db2.gz MEKNIRZFBWPRQW-GOSISDBHSA-N 0 3 413.543 4.436 20 0 HIADHN COc1ccc([C@H](CNC(=O)CCCOc2ccccc2Cl)N2CCCC2)cc1 ZINC000497999526 907481394 /nfs/dbraw/zinc/48/13/94/907481394.db2.gz ZJHHQCVNLVZRDI-NRFANRHFSA-N 0 3 416.949 4.461 20 0 HIADHN COc1cccc(C2=CCN(C(=O)NC[C@@H](c3ccc(OC(C)C)cc3)N(C)C)C2)c1 ZINC000512825281 921329106 /nfs/dbraw/zinc/32/91/06/921329106.db2.gz DEALNJFHZKTIMN-DEOSSOPVSA-N 0 3 423.557 4.194 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)[C@H]1C[C@@H]1c1ccc(F)cc1F ZINC000498049546 907560034 /nfs/dbraw/zinc/56/00/34/907560034.db2.gz XMFROMOTWGZXQV-UXHICEINSA-N 0 3 402.510 4.298 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)c1ccc(OCc2ccccc2)nc1 ZINC000498121090 907632159 /nfs/dbraw/zinc/63/21/59/907632159.db2.gz MEWTYUAIKAUUEX-UHFFFAOYSA-N 0 3 407.489 4.004 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(Cl)cc2)CC1)[C@H](c1ccccc1)C1CC1 ZINC000498124932 907640446 /nfs/dbraw/zinc/64/04/46/907640446.db2.gz KSXSNFXMCDSAMM-HSZRJFAPSA-N 0 3 412.961 4.493 20 0 HIADHN CCCOc1ccc([C@H](C)NC(=O)N2CC[C@@H]3CCN(C)C[C@H]32)cc1OCCC ZINC000498129146 907648025 /nfs/dbraw/zinc/64/80/25/907648025.db2.gz YLWUTDSPFRONAC-CMKODMSKSA-N 0 3 403.567 4.061 20 0 HIADHN Cc1c2cccc(C)c2oc1C(=O)NCCCN1CCN(C)C[C@H]1c1ccccc1 ZINC000498140485 907660295 /nfs/dbraw/zinc/66/02/95/907660295.db2.gz OMHSWFCPWUZMFT-QFIPXVFZSA-N 0 3 405.542 4.158 20 0 HIADHN CC(C)CN(C(=O)Cc1ccc(OCCOc2ccccc2)cc1)C1CCN(C)CC1 ZINC000498144359 907668104 /nfs/dbraw/zinc/66/81/04/907668104.db2.gz AUCLZYGNWXKBHJ-UHFFFAOYSA-N 0 3 424.585 4.266 20 0 HIADHN O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)[C@@H]1C[C@@H]1c1ccc(Br)cc1 ZINC000498161879 907688475 /nfs/dbraw/zinc/68/84/75/907688475.db2.gz HKDQYWNYDCEQEF-NJDAHSKKSA-N 0 3 413.359 4.333 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N[C@@H](c2cccc(C)c2)c2ccccn2)N(C)C)cc1 ZINC000498253066 907789853 /nfs/dbraw/zinc/78/98/53/907789853.db2.gz OZKXEEOUKKKIEM-ZEQRLZLVSA-N 0 3 402.542 4.390 20 0 HIADHN COc1ccc(F)cc1[C@@H](C)NC(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000498273437 907810531 /nfs/dbraw/zinc/81/05/31/907810531.db2.gz BPEBFVFPAUEFOW-QVKFZJNVSA-N 0 3 424.438 4.466 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@H](C)NCc2nc3c(s2)C[C@@H](C)CC3)CC1 ZINC000498350426 907852119 /nfs/dbraw/zinc/85/21/19/907852119.db2.gz XHISDJVWXAJZOU-IRXDYDNUSA-N 0 3 416.610 4.400 20 0 HIADHN CC[C@H](NCc1ccc(OCc2cn3cccc(C)c3n2)cc1)[C@@H](O)C(F)(F)F ZINC000498369931 907861675 /nfs/dbraw/zinc/86/16/75/907861675.db2.gz YCDRBKBWHLJFEJ-RBUKOAKNSA-N 0 3 407.436 4.013 20 0 HIADHN CCC(CC)[C@H]1C[C@H](NC(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)CCO1 ZINC000498377769 907867102 /nfs/dbraw/zinc/86/71/02/907867102.db2.gz VPCOWAMAGRLZPL-WIYYLYMNSA-N 0 3 411.537 4.022 20 0 HIADHN c1c2ccccc2oc1[C@H](NCCCc1nnc2n1CCCCC2)c1cccnc1 ZINC000498414127 907889826 /nfs/dbraw/zinc/88/98/26/907889826.db2.gz NPFAIXOXXXOVIJ-XMMPIXPASA-N 0 3 401.514 4.458 20 0 HIADHN Cc1nn(Cc2ccccc2)c2sc(C(=O)N(CCN(C)C)C3CCCC3)cc12 ZINC000498455695 907919386 /nfs/dbraw/zinc/91/93/86/907919386.db2.gz XDCNGGUJWOLVHJ-UHFFFAOYSA-N 0 3 410.587 4.401 20 0 HIADHN CN(C)CCN(C(=O)Cc1csc(COc2ccc(Cl)cc2)n1)C1CCCC1 ZINC000498466387 907934656 /nfs/dbraw/zinc/93/46/56/907934656.db2.gz OMLULJACEWUDQI-UHFFFAOYSA-N 0 3 421.994 4.251 20 0 HIADHN CN(C)C[C@H](NC(=O)NCc1cc(F)c(C(F)(F)F)cc1F)c1ccc(F)cc1 ZINC000512871552 921370332 /nfs/dbraw/zinc/37/03/32/921370332.db2.gz FRBWHCQFEZUYAM-KRWDZBQOSA-N 0 3 419.369 4.225 20 0 HIADHN Cc1c(C(=O)NCc2ccc(CN3CCN(C)CC3)cc2)oc2c1c(C)ccc2C ZINC000498566829 908027093 /nfs/dbraw/zinc/02/70/93/908027093.db2.gz IZNKBOQMGDVJMK-UHFFFAOYSA-N 0 3 405.542 4.035 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N[C@@H](C)c2ccc(F)c3ccccc32)CC1 ZINC000498596875 908045116 /nfs/dbraw/zinc/04/51/16/908045116.db2.gz XNIYMLAGGNLRCY-KRWDZBQOSA-N 0 3 401.526 4.229 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)N[C@@H]2CCc3[nH]c4ccc(C)cc4c3C2)o1 ZINC000498721088 908148101 /nfs/dbraw/zinc/14/81/01/908148101.db2.gz UAUUUTZVCZUJAF-GOSISDBHSA-N 0 3 408.546 4.008 20 0 HIADHN Cc1cccc2oc(CCNC(=O)NC[C@@H](c3ccc(OC(C)C)cc3)N(C)C)nc21 ZINC000498733120 908160082 /nfs/dbraw/zinc/16/00/82/908160082.db2.gz CHOKWHPKWDDPFT-FQEVSTJZSA-N 0 3 424.545 4.068 20 0 HIADHN C[C@H]1CCN(C)CCN1C(=O)Cc1cn(-c2ccccc2)nc1-c1ccc(Cl)cc1 ZINC000498738725 908165911 /nfs/dbraw/zinc/16/59/11/908165911.db2.gz RDZCHSVLKCXQNJ-SFHVURJKSA-N 0 3 422.960 4.288 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2C(=O)N2CCN(C)CC[C@H]2C)c(C)c1 ZINC000498741341 908170220 /nfs/dbraw/zinc/17/02/20/908170220.db2.gz YIJKPMLELOGWED-HXUWFJFHSA-N 0 3 402.542 4.322 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)N[C@H]1CCCOc2c(F)cccc21 ZINC000498833632 908242846 /nfs/dbraw/zinc/24/28/46/908242846.db2.gz LQACLWLTEMLVGI-FQEVSTJZSA-N 0 3 421.463 4.091 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)N2CCC[C@H](c3nccs3)C2)N(C)C)cc1 ZINC000512902694 921394920 /nfs/dbraw/zinc/39/49/20/921394920.db2.gz QXDGGBWAIYZRLV-AZUAARDMSA-N 0 3 416.591 4.122 20 0 HIADHN C[C@H](NC(=O)NCc1csc(CCc2ccccc2)n1)[C@H](c1ccccc1)N(C)C ZINC000498907975 908316680 /nfs/dbraw/zinc/31/66/80/908316680.db2.gz PUEUYXVRSDTIKO-FDDCHVKYSA-N 0 3 422.598 4.419 20 0 HIADHN CCN1C[C@@H](C)N(Cc2csc(N(C(C)=O)c3cccc(C)c3C)n2)C[C@H]1C ZINC000498914790 908323041 /nfs/dbraw/zinc/32/30/41/908323041.db2.gz KBBFSUAQKXDSMU-IAGOWNOFSA-N 0 3 400.592 4.359 20 0 HIADHN CCn1nc(C)c(CC(=O)N[C@@H](c2ccc(F)c(F)c2)C(C)(C)N2CCCC2)c1C ZINC000498936367 908343104 /nfs/dbraw/zinc/34/31/04/908343104.db2.gz NDCALQAEUXQDPK-QFIPXVFZSA-N 0 3 418.532 4.072 20 0 HIADHN C[C@H](NC(=O)[C@H](C)N1CCC[C@H](c2nc(C3CC3)n[nH]2)C1)c1ccc2ccccc2c1 ZINC000498939954 908348392 /nfs/dbraw/zinc/34/83/92/908348392.db2.gz OVLWSWBYOMWBOB-HOIFWPIMSA-N 0 3 417.557 4.281 20 0 HIADHN C[C@H](NC(=O)[C@H](C)N1CCC[C@H](c2n[nH]c(C3CC3)n2)C1)c1ccc2ccccc2c1 ZINC000498939954 908348409 /nfs/dbraw/zinc/34/84/09/908348409.db2.gz OVLWSWBYOMWBOB-HOIFWPIMSA-N 0 3 417.557 4.281 20 0 HIADHN COc1ccc(C[C@@H](N[C@H](C)C(=O)N2CCC(C)CC2)c2ccc(OC)cc2)cc1 ZINC000499058309 908427668 /nfs/dbraw/zinc/42/76/68/908427668.db2.gz WRMITMCUPNGRKA-NTKDMRAZSA-N 0 3 410.558 4.224 20 0 HIADHN COc1ccc(C[C@H](N[C@@H](C)C(=O)N2CCC(C)CC2)c2ccc(OC)cc2)cc1 ZINC000499058307 908427857 /nfs/dbraw/zinc/42/78/57/908427857.db2.gz WRMITMCUPNGRKA-CYFREDJKSA-N 0 3 410.558 4.224 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)N(C)[C@@H](C)Cc2ccc(O)cc2)N(C)C)cc1 ZINC000512916614 921410296 /nfs/dbraw/zinc/41/02/96/921410296.db2.gz DXDKNMYGDWZLPI-MBSDFSHPSA-N 0 3 413.562 4.055 20 0 HIADHN COCCOc1ccccc1NC(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1 ZINC000512917117 921410340 /nfs/dbraw/zinc/41/03/40/921410340.db2.gz ODOJCBJWISELBW-IBGZPJMESA-N 0 3 417.575 4.368 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)N[C@@H](c1cccc(F)c1)c1ccccn1 ZINC000499086477 908449792 /nfs/dbraw/zinc/44/97/92/908449792.db2.gz ZAWKXZRUAIGLJO-RPWUZVMVSA-N 0 3 418.516 4.446 20 0 HIADHN Cc1cc(NC(=O)c2ccco2)sc1C(=O)NC[C@H](c1ccc(C)cc1)N(C)C ZINC000499137331 908493337 /nfs/dbraw/zinc/49/33/37/908493337.db2.gz RTONDSVUSPRJLG-QGZVFWFLSA-N 0 3 411.527 4.243 20 0 HIADHN C[C@@H]1CN(C(=O)NCC2(C3CCCCC3)CCCCC2)CC[C@@H]1N1CCN(C)CC1 ZINC000499148663 908507809 /nfs/dbraw/zinc/50/78/09/908507809.db2.gz FZJWWVYFDSMGKR-GGAORHGYSA-N 0 3 418.670 4.185 20 0 HIADHN Cc1noc(C)c1CSc1ncccc1C(=O)NC[C@@H](c1ccc(C)cc1)N(C)C ZINC000499167826 908519612 /nfs/dbraw/zinc/51/96/12/908519612.db2.gz MDHQUDCMULGIJY-NRFANRHFSA-N 0 3 424.570 4.320 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)c1ccc(OC[C@@H]2CCCO2)cc1 ZINC000499241390 908608800 /nfs/dbraw/zinc/60/88/00/908608800.db2.gz GCBXHTBIOIUABW-QFIPXVFZSA-N 0 3 416.949 4.102 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)CCc1ccc(OC(F)F)cc1 ZINC000499244894 908613589 /nfs/dbraw/zinc/61/35/89/908613589.db2.gz BLGONVURMJRAFZ-UHFFFAOYSA-N 0 3 410.892 4.464 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)N[C@H](c1cccc(F)c1)c1ccccn1 ZINC000499305477 908677939 /nfs/dbraw/zinc/67/79/39/908677939.db2.gz GVAZFHXBMFHWBE-HSZRJFAPSA-N 0 3 424.495 4.223 20 0 HIADHN Cc1cc(C)n([C@H](C)CC(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)n1 ZINC000499358293 908726998 /nfs/dbraw/zinc/72/69/98/908726998.db2.gz QLNFHCXLMUNKKP-QGZVFWFLSA-N 0 3 410.484 4.060 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)c1cc(F)ccc1Br ZINC000499373551 908741756 /nfs/dbraw/zinc/74/17/56/908741756.db2.gz AMQQMKCXMWMBEP-UHFFFAOYSA-N 0 3 415.253 4.070 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)c1cccc([C@@H]2CCCOC2)c1 ZINC000499382488 908747496 /nfs/dbraw/zinc/74/74/96/908747496.db2.gz RISCWHDJKJESNX-JOCHJYFZSA-N 0 3 410.583 4.424 20 0 HIADHN Cc1nc2cc(F)cc(C(=O)N(C)C3CCN(Cc4ccccc4)CC3)c2nc1C ZINC000499517317 908825535 /nfs/dbraw/zinc/82/55/35/908825535.db2.gz DPDQGQVCVNYJBY-UHFFFAOYSA-N 0 3 406.505 4.122 20 0 HIADHN C[C@@H](NC(=O)Nc1ccc(CCN2CCSCC2)cc1)c1cccc(F)c1F ZINC000499569892 908843563 /nfs/dbraw/zinc/84/35/63/908843563.db2.gz OHIZVAWRZBBGRY-OAHLLOKOSA-N 0 3 405.514 4.439 20 0 HIADHN CC(C)c1nn(-c2ccccc2)cc1CNC(=O)N[C@H](CN(C)C)c1ccc(F)cc1 ZINC000499691144 908878032 /nfs/dbraw/zinc/87/80/32/908878032.db2.gz DOGPITLNEFZPGA-JOCHJYFZSA-N 0 3 423.536 4.237 20 0 HIADHN Cc1cc(=O)n2nc(CN(C)[C@H](c3ccc(Cl)cc3)C3CCCC3)sc2n1 ZINC000499902091 909024146 /nfs/dbraw/zinc/02/41/46/909024146.db2.gz DNCADIAPOJYELD-IBGZPJMESA-N 0 3 402.951 4.476 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)CCc1cc(Br)cs1 ZINC000499939202 909046761 /nfs/dbraw/zinc/04/67/61/909046761.db2.gz NNMSAKFSSACBGO-UHFFFAOYSA-N 0 3 413.356 4.173 20 0 HIADHN CCOc1c(Br)cc(Br)cc1CNCCc1cc(C)no1 ZINC000513001754 921468243 /nfs/dbraw/zinc/46/82/43/921468243.db2.gz MWFJBVSEXOQDOA-UHFFFAOYSA-N 0 3 418.129 4.239 20 0 HIADHN FC(F)(F)c1ccc(C[C@@]2(NCc3ccc(Br)cn3)CCOC2)cc1 ZINC000513012882 921476461 /nfs/dbraw/zinc/47/64/61/921476461.db2.gz SZARMBVODGADNM-KRWDZBQOSA-N 0 3 415.253 4.354 20 0 HIADHN Cc1cc(C[C@H](C)NC(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)n(-c2ccccc2)n1 ZINC000499957686 909398617 /nfs/dbraw/zinc/39/86/17/909398617.db2.gz NFOLNICGFPEUIW-NRYAXDJKSA-N 0 3 419.573 4.102 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CN1CCC[C@@H](CNC(=O)c2ccccc2)C1 ZINC000513034762 921493152 /nfs/dbraw/zinc/49/31/52/921493152.db2.gz CLRPTMSWOJIPAK-QHCPKHFHSA-N 0 3 416.569 4.190 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N[C@@H](C)Cc1cc(C)nn1-c1ccccc1)c1ccco1 ZINC000499968090 909409712 /nfs/dbraw/zinc/40/97/12/909409712.db2.gz JSZCAYKQQFAKHH-SPEDKVCISA-N 0 3 423.561 4.133 20 0 HIADHN CC(C)Cn1ncc(NC(=O)N(CCN(C)C)Cc2cccc(F)c2)c1C(C)C ZINC000499970085 909412814 /nfs/dbraw/zinc/41/28/14/909412814.db2.gz DQQSAERQKKLCFU-UHFFFAOYSA-N 0 3 403.546 4.397 20 0 HIADHN O=C(Cc1coc(-c2ccc(F)cc2)n1)N1CCCN(CCCc2ccccc2)CC1 ZINC000500007760 909459172 /nfs/dbraw/zinc/45/91/72/909459172.db2.gz OIWWIXHZCDCJID-UHFFFAOYSA-N 0 3 421.516 4.190 20 0 HIADHN C[C@@H]1C[C@@H]1c1ccc([C@H]2C[C@@H]2C(=O)NCCCCN2CCN(c3ccccc3)CC2)o1 ZINC000500068479 909537550 /nfs/dbraw/zinc/53/75/50/909537550.db2.gz WQWMUSSHZHCFHB-SWUCNREESA-N 0 3 421.585 4.225 20 0 HIADHN COc1cc(Br)cc(NC(=O)N(CCN(C)C)Cc2ccccc2)c1 ZINC000500113584 909594861 /nfs/dbraw/zinc/59/48/61/909594861.db2.gz WIIDPNRRZAPGNR-UHFFFAOYSA-N 0 3 406.324 4.053 20 0 HIADHN CNC(=O)[C@H]1CCC[C@@H]1NCc1c(C)nn(-c2ccccc2)c1Oc1ccc(F)cc1 ZINC000500232478 909722004 /nfs/dbraw/zinc/72/20/04/909722004.db2.gz VZNLFSIUGRSFFL-UNMCSNQZSA-N 0 3 422.504 4.116 20 0 HIADHN CC(=O)Nc1ccc(OC[C@H](O)CN(C)[C@H](c2ccccc2Cl)C(C)C)cc1 ZINC000500237486 909725402 /nfs/dbraw/zinc/72/54/02/909725402.db2.gz NSXHRQZFXZMTRF-GCJKJVERSA-N 0 3 404.938 4.367 20 0 HIADHN C[C@@H](NC(=O)C(=O)Nc1cccc(CN(C)C)c1)[C@H](C)c1ccccc1C(F)(F)F ZINC000500377088 909824314 /nfs/dbraw/zinc/82/43/14/909824314.db2.gz IDPJODBAJCTVKG-LSDHHAIUSA-N 0 3 421.463 4.014 20 0 HIADHN C[C@H](NC(=O)N1CCCN(Cc2ccccc2)CC1)c1ccccc1OC(F)F ZINC000500400313 909836480 /nfs/dbraw/zinc/83/64/80/909836480.db2.gz GRCGZPRMNHOUPB-KRWDZBQOSA-N 0 3 403.473 4.267 20 0 HIADHN C/C(=C/c1ccccc1C(F)(F)F)CNCc1cnc(N2CCOCC2)c(F)c1 ZINC000500398550 909836666 /nfs/dbraw/zinc/83/66/66/909836666.db2.gz DEOQSZVBXQMIGC-GDNBJRDFSA-N 0 3 409.427 4.269 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)c2cccc(OCC(F)(F)F)c2)cc1 ZINC000500410113 909842532 /nfs/dbraw/zinc/84/25/32/909842532.db2.gz RJLYIMKDTFOFEG-HXUWFJFHSA-N 0 3 422.447 4.203 20 0 HIADHN C[C@H](NC(=O)NC[C@@H](c1ccccc1)N1CCCC1)c1ccccc1OC(F)F ZINC000500426759 909850228 /nfs/dbraw/zinc/85/02/28/909850228.db2.gz GMLLEOJIVGODDG-LPHOPBHVSA-N 0 3 403.473 4.485 20 0 HIADHN CC[C@H](NC(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1)c1ccc(Cl)s1 ZINC000513075011 921529313 /nfs/dbraw/zinc/52/93/13/921529313.db2.gz KBASXTWKJHUPDQ-INMHGKMJSA-N 0 3 414.015 4.383 20 0 HIADHN C/C(=C/c1ccccc1C(F)(F)F)CNCc1cccc(C(=O)N2CCOCC2)c1 ZINC000500451603 909868387 /nfs/dbraw/zinc/86/83/87/909868387.db2.gz MIQQZZUKYGJAMA-LGMDPLHJSA-N 0 3 418.459 4.371 20 0 HIADHN CC[C@H](NC(=O)N1CCC(CN2C[C@H](C)O[C@@H](C)C2)CC1)c1ccc(Cl)s1 ZINC000513075016 921529512 /nfs/dbraw/zinc/52/95/12/921529512.db2.gz KBASXTWKJHUPDQ-ZOBUZTSGSA-N 0 3 414.015 4.383 20 0 HIADHN COc1cc(CN[C@H](C)c2ccccc2SC)ccc1OCC(=O)N1CCCC1 ZINC000500451214 909868808 /nfs/dbraw/zinc/86/88/08/909868808.db2.gz LJRXNMXOKMNDEI-QGZVFWFLSA-N 0 3 414.571 4.269 20 0 HIADHN CC(C)N1CCc2nc(CN[C@@]3(Cc4ccc(Cl)cc4)CCOC3)sc2C1 ZINC000500463172 909872758 /nfs/dbraw/zinc/87/27/58/909872758.db2.gz OSDKYUFBHLSVRD-OAQYLSRUSA-N 0 3 405.995 4.054 20 0 HIADHN COc1ccc(C(=O)CCCC(=O)N[C@@H]2CCN(Cc3ccccc3)[C@@H](C)C2)cc1 ZINC000500494794 909890514 /nfs/dbraw/zinc/89/05/14/909890514.db2.gz ABSQLHWEXQBYAQ-SIKLNZKXSA-N 0 3 408.542 4.218 20 0 HIADHN CCc1nnc(NC(=O)[C@@H](C)[C@H](C)NCc2cc(Cl)ccc2OC(F)F)s1 ZINC000513081855 921534373 /nfs/dbraw/zinc/53/43/73/921534373.db2.gz HNIWSICLPSAJAW-UWVGGRQHSA-N 0 3 418.897 4.108 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)[C@H](C)Cc1cnc2ccccc2n1 ZINC000500588514 909950686 /nfs/dbraw/zinc/95/06/86/909950686.db2.gz XYJXZNVODRGTNL-NTKDMRAZSA-N 0 3 404.558 4.081 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)N(C)Cc2ccc(C(C)C)cc2)CC1 ZINC000500620986 909971667 /nfs/dbraw/zinc/97/16/67/909971667.db2.gz ZAYUDLGAWYOYJD-UHFFFAOYSA-N 0 3 422.617 4.289 20 0 HIADHN CCC[C@H](NCc1cc(C(F)(F)F)ccc1N1CCN(C)CC1)c1ccccn1 ZINC000500645283 909988658 /nfs/dbraw/zinc/98/86/58/909988658.db2.gz CKBRNZOCJQUURG-IBGZPJMESA-N 0 3 406.496 4.483 20 0 HIADHN C[C@H](NC(=O)C(=O)Nc1cc(C(F)F)ccc1Cl)[C@@H](c1ccccc1)N(C)C ZINC000500689511 910024281 /nfs/dbraw/zinc/02/42/81/910024281.db2.gz WYOLEVOFLHNRAJ-SJCJKPOMSA-N 0 3 409.864 4.024 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CN(C)C1CCN(C(=O)c2ccccc2)CC1 ZINC000513095780 921545872 /nfs/dbraw/zinc/54/58/72/921545872.db2.gz QPSQTIFUMVICQZ-UHFFFAOYSA-N 0 3 416.569 4.285 20 0 HIADHN CC(C)CN(CCN(C)C)C(=O)CCc1nc2cc(C(F)(F)F)ccc2s1 ZINC000500723966 910041509 /nfs/dbraw/zinc/04/15/09/910041509.db2.gz XQRGFSWFKAPGEK-UHFFFAOYSA-N 0 3 401.498 4.294 20 0 HIADHN COc1cccc([C@H](CNC(=O)N[C@H](C)c2cccc(F)c2F)N2CCCC2)c1 ZINC000500834537 910111389 /nfs/dbraw/zinc/11/13/89/910111389.db2.gz REBBTBYHTKUHEH-QRWLVFNGSA-N 0 3 403.473 4.171 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)c2ccc(-c3noc(C(F)F)n3)cc2)CN1Cc1ccccc1 ZINC000500855039 910128279 /nfs/dbraw/zinc/12/82/79/910128279.db2.gz CKMGOMJLEVLRRJ-RDTXWAMCSA-N 0 3 412.440 4.067 20 0 HIADHN COc1cc(Br)ccc1C(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000500880857 910153533 /nfs/dbraw/zinc/15/35/33/910153533.db2.gz QODFVSNXWGPTJW-WMLDXEAASA-N 0 3 403.320 4.023 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(C)c1CN1CCC[C@@H](CNC(=O)c2ccccc2)C1 ZINC000513106330 921554211 /nfs/dbraw/zinc/55/42/11/921554211.db2.gz KMTWHKOMTLQWMD-FQEVSTJZSA-N 0 3 420.532 4.270 20 0 HIADHN FC(F)Cn1cc(CN(Cc2cccc(Br)c2)C2CCOCC2)cn1 ZINC000513107466 921554855 /nfs/dbraw/zinc/55/48/55/921554855.db2.gz WGZKTXPSDFXCMF-UHFFFAOYSA-N 0 3 414.294 4.092 20 0 HIADHN COc1ccsc1CN1CCC(C(=O)Nc2ccccc2Br)CC1 ZINC000513112331 921559104 /nfs/dbraw/zinc/55/91/04/921559104.db2.gz XIJKBDWZWKJIAB-UHFFFAOYSA-N 0 3 409.349 4.370 20 0 HIADHN Cc1cc(C)c(CNCc2ccc(S(=O)(=O)N3CCC[C@@H](C)C3)cc2)c(C)c1 ZINC000513114379 921560329 /nfs/dbraw/zinc/56/03/29/921560329.db2.gz AYXYATWVVGUAPT-QGZVFWFLSA-N 0 3 400.588 4.322 20 0 HIADHN O=C([C@H]1CC12CCN(Cc1ccccc1OCc1ccncc1)CC2)N1CCCCC1 ZINC000501083831 910283098 /nfs/dbraw/zinc/28/30/98/910283098.db2.gz CZOXGECIIAVTKZ-HSZRJFAPSA-N 0 3 419.569 4.275 20 0 HIADHN Cc1cc(C)c(CNCc2ccc(S(=O)(=O)N3CCC[C@@H](C)C3)cc2)cc1C ZINC000513126755 921570805 /nfs/dbraw/zinc/57/08/05/921570805.db2.gz XUUMMZCRDGTHSH-QGZVFWFLSA-N 0 3 400.588 4.322 20 0 HIADHN C[C@H](CC(=O)c1ccccc1F)C(=O)N[C@H]1CCN(Cc2ccccc2)CC1(C)C ZINC000513126315 921570852 /nfs/dbraw/zinc/57/08/52/921570852.db2.gz RCRJIETZLFDGBX-JPYJTQIMSA-N 0 3 410.533 4.452 20 0 HIADHN O=C(Nc1ccccc1Br)C1CCN(Cc2ccc3c(c2)CCO3)CC1 ZINC000513122580 921567442 /nfs/dbraw/zinc/56/74/42/921567442.db2.gz OSLWHPQLYSVBAT-UHFFFAOYSA-N 0 3 415.331 4.235 20 0 HIADHN Cc1c(NC(=O)N[C@@H](CN2CCCC2)c2ccccc2)cccc1C(=O)N1CCCC1 ZINC000501169269 910339136 /nfs/dbraw/zinc/33/91/36/910339136.db2.gz IMXLDPDYUWAZNA-QHCPKHFHSA-N 0 3 420.557 4.190 20 0 HIADHN COc1ccc([C@H](CNC(=O)Nc2c(C)cc(N(C)C)cc2C)N2CCCC2)cc1 ZINC000501193436 910355726 /nfs/dbraw/zinc/35/57/26/910355726.db2.gz GCVJERSIKQKZQV-QFIPXVFZSA-N 0 3 410.562 4.337 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(C)c1C(=O)N[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000501233375 910390956 /nfs/dbraw/zinc/39/09/56/910390956.db2.gz ZYTMIKAQSDUGGJ-UTKZUKDTSA-N 0 3 406.505 4.194 20 0 HIADHN O=C(NCC1CCC(F)(F)CC1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000501235017 910392520 /nfs/dbraw/zinc/39/25/20/910392520.db2.gz MFHDKFCAQFSKOU-SFHVURJKSA-N 0 3 404.423 4.383 20 0 HIADHN C[C@@H](Cn1cccn1)NCC(=O)Nc1ccccc1Sc1ccc(Cl)cc1 ZINC000501277144 910439504 /nfs/dbraw/zinc/43/95/04/910439504.db2.gz MKOFCDKFMAGMMT-HNNXBMFYSA-N 0 3 400.935 4.305 20 0 HIADHN CC1CCN([C@@H](CNC(=O)[C@H](c2ccccc2)n2cccn2)c2ccccc2)CC1 ZINC000513137298 921578118 /nfs/dbraw/zinc/57/81/18/921578118.db2.gz JIJOYLWJWIPLMP-ZEQRLZLVSA-N 0 3 402.542 4.062 20 0 HIADHN CC[C@H](CNC(=O)Nc1cccc(OC[C@H]2CCCO2)c1)N1CCc2ccccc2C1 ZINC000501333472 910475113 /nfs/dbraw/zinc/47/51/13/910475113.db2.gz OCNGOPUIFBWAJD-ISKFKSNPSA-N 0 3 423.557 4.203 20 0 HIADHN COc1cccc(CN(Cc2ccc(Br)cn2)C2CCC(O)CC2)c1 ZINC000513155207 921589342 /nfs/dbraw/zinc/58/93/42/921589342.db2.gz UUAHZFKWWHAUHU-UHFFFAOYSA-N 0 3 405.336 4.158 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N[C@@H]1CCO[C@@H]1c1ccc(Cl)cc1)c1ccco1 ZINC000501562399 910670562 /nfs/dbraw/zinc/67/05/62/910670562.db2.gz ASTSNZAUIXIDQO-LMVHDODDSA-N 0 3 405.926 4.192 20 0 HIADHN CC(C)Cn1ncc(NC(=O)c2ccc(CN3CCC(CO)CC3)cc2)c1C(C)C ZINC000501618400 910719510 /nfs/dbraw/zinc/71/95/10/910719510.db2.gz NHKCLTNGITZCHG-UHFFFAOYSA-N 0 3 412.578 4.119 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)c1cc(-n2cccc2)ccn1 ZINC000501725480 910790310 /nfs/dbraw/zinc/79/03/10/910790310.db2.gz BLUDBMSJFJZCEA-UHFFFAOYSA-N 0 3 416.447 4.095 20 0 HIADHN Cc1ccc(C(C)C)c(OCCC(=O)N(C)C2CCN(CCc3ccccn3)CC2)c1 ZINC000501732427 910793881 /nfs/dbraw/zinc/79/38/81/910793881.db2.gz CCMBDQKJIJSIIH-UHFFFAOYSA-N 0 3 423.601 4.448 20 0 HIADHN CC(C)Cc1ccc(CCC(=O)N(C)C2CCN(CCc3ccccn3)CC2)cc1 ZINC000501735784 910797238 /nfs/dbraw/zinc/79/72/38/910797238.db2.gz UJVTYQYYEYGTJG-UHFFFAOYSA-N 0 3 407.602 4.378 20 0 HIADHN Cc1cc(C)n(-c2cccc(NC(=O)NCCCN3CCc4ccccc4C3)c2)n1 ZINC000501758791 910815238 /nfs/dbraw/zinc/81/52/38/910815238.db2.gz JHIBKYVQSWMLJP-UHFFFAOYSA-N 0 3 403.530 4.059 20 0 HIADHN CC(C)Cc1ccc(CCC(=O)Nc2ccccc2CN2CCC[C@@H](C(N)=O)C2)cc1 ZINC000501758552 910815904 /nfs/dbraw/zinc/81/59/04/910815904.db2.gz ULNYRUGONNKFOS-HSZRJFAPSA-N 0 3 421.585 4.154 20 0 HIADHN CCOc1ccc([C@H](C)NC(=O)N[C@H](CN2CCCC2)c2ccccc2)cc1OC ZINC000501852189 910884564 /nfs/dbraw/zinc/88/45/64/910884564.db2.gz UPVJQKHHJRQTKP-GHTZIAJQSA-N 0 3 411.546 4.291 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3occc3-c3ccc(F)cc3)CC2)C[C@@H](C)O1 ZINC000501873533 910898111 /nfs/dbraw/zinc/89/81/11/910898111.db2.gz OIHPASIWUJHZKP-QZTJIDSGSA-N 0 3 414.521 4.437 20 0 HIADHN CCN(C(=O)[C@H](C)Oc1cccc(C(C)=O)c1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000501954017 910942167 /nfs/dbraw/zinc/94/21/67/910942167.db2.gz DCSONAVMYROUJL-QMHWCDLVSA-N 0 3 408.542 4.341 20 0 HIADHN CCN1CCCC[C@H]1CNC(=O)c1c(C)onc1-c1cccc(Br)c1 ZINC000502059767 911007371 /nfs/dbraw/zinc/00/73/71/911007371.db2.gz ADYLXHJENDHLTB-INIZCTEOSA-N 0 3 406.324 4.017 20 0 HIADHN Cc1sc(NC(=O)CNC(C)(C)COc2ccc(C(F)(F)F)cn2)c(C)c1C ZINC000502224004 911169628 /nfs/dbraw/zinc/16/96/28/911169628.db2.gz RLNZQZUVSUQGCU-UHFFFAOYSA-N 0 3 415.481 4.473 20 0 HIADHN C[C@H](NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1)c1cccc(OC(F)F)c1 ZINC000502277275 911225985 /nfs/dbraw/zinc/22/59/85/911225985.db2.gz CDMDGBVFQRIQEH-LPHOPBHVSA-N 0 3 403.473 4.313 20 0 HIADHN O=C(Cc1ccc(Br)c(F)c1)NC[C@@H](c1cccs1)N1CCCC1 ZINC000502277001 911226428 /nfs/dbraw/zinc/22/64/28/911226428.db2.gz RWTRYSFGDBBZOJ-INIZCTEOSA-N 0 3 411.340 4.146 20 0 HIADHN Cc1onc(-c2cccc(Br)c2)c1C(=O)N[C@@H](C)CN1CCCCC1 ZINC000502280758 911230913 /nfs/dbraw/zinc/23/09/13/911230913.db2.gz GOVKIMPTCNMXGN-ZDUSSCGKSA-N 0 3 406.324 4.017 20 0 HIADHN COc1cc(C)c(C[C@@H](C)N[C@@H](CCSC)c2nnc3ccccn32)cc1OC ZINC000502280616 911232025 /nfs/dbraw/zinc/23/20/25/911232025.db2.gz WKNACZHTKZDSFL-AEFFLSMTSA-N 0 3 414.575 4.070 20 0 HIADHN COc1cccc(NC(=O)C[C@H](C)N[C@@H]2CCOc3c(Br)cccc32)c1 ZINC000502320722 911294934 /nfs/dbraw/zinc/29/49/34/911294934.db2.gz VKDQAZHPRRRYQR-SCLBCKFNSA-N 0 3 419.319 4.288 20 0 HIADHN C[C@H](CC(=O)Nc1ccc(F)cc1)N[C@@H]1CCOc2c(Br)cccc21 ZINC000502322044 911297477 /nfs/dbraw/zinc/29/74/77/911297477.db2.gz PHSMQNVMLCVKBK-SJKOYZFVSA-N 0 3 407.283 4.419 20 0 HIADHN COCCn1cc(CN[C@H](C)COc2ccc3cc(Br)ccc3c2)cn1 ZINC000502327279 911303298 /nfs/dbraw/zinc/30/32/98/911303298.db2.gz QOJXNXTUYUVFPQ-OAHLLOKOSA-N 0 3 418.335 4.002 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)c1ccc(COc2ccc(F)cc2)o1 ZINC000513239486 921650748 /nfs/dbraw/zinc/65/07/48/921650748.db2.gz YUIPIOFJVUHPHV-FQEVSTJZSA-N 0 3 408.473 4.392 20 0 HIADHN Cc1ccc(NC(=O)CNC(C)(C)COc2ncccc2C(F)(F)F)c(Cl)c1 ZINC000502337487 911316406 /nfs/dbraw/zinc/31/64/06/911316406.db2.gz KCWGNCFYXSUBAO-UHFFFAOYSA-N 0 3 415.843 4.448 20 0 HIADHN CN1CCN(CCCNC(=O)Nc2ccccc2C(F)(F)F)[C@@H](c2ccccc2)C1 ZINC000502349974 911330037 /nfs/dbraw/zinc/33/00/37/911330037.db2.gz ACITWGSARJWPSV-HXUWFJFHSA-N 0 3 420.479 4.206 20 0 HIADHN COCC[C@@H]1CCC[C@@H]1N[C@@H](c1cccc(S(C)(=O)=O)c1)c1ccc(F)c(F)c1 ZINC000502404598 911387138 /nfs/dbraw/zinc/38/71/38/911387138.db2.gz QOAMPKFGHHDXSD-RXYZOABWSA-N 0 3 423.525 4.253 20 0 HIADHN O=C(CN[C@@H]1CCCC[C@H]1OC(F)F)Nc1ccc(Br)cc1Cl ZINC000502564092 911570548 /nfs/dbraw/zinc/57/05/48/911570548.db2.gz CMZGTEXOVBINJH-CHWSQXEVSA-N 0 3 411.674 4.181 20 0 HIADHN COc1cc(C)c([C@H](C)NC(=O)CN[C@H](c2ccc(F)cc2)C(C)C)cc1OC ZINC000502578453 911584914 /nfs/dbraw/zinc/58/49/14/911584914.db2.gz JONYGGFNPCFIGT-HJPURHCSSA-N 0 3 402.510 4.315 20 0 HIADHN Cc1nc2c(s1)[C@@H](N[C@@H]1CCCN(c3ccc(OC(F)F)cc3)C1=O)CCC2 ZINC000502597874 911602595 /nfs/dbraw/zinc/60/25/95/911602595.db2.gz VHZDFPXZPRITJZ-DLBZAZTESA-N 0 3 407.486 4.216 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)NCCc1nc(-c2cccc(Cl)c2)no1 ZINC000513275060 921674993 /nfs/dbraw/zinc/67/49/93/921674993.db2.gz ZUDWMGQJBRXXPV-UHFFFAOYSA-N 0 3 424.888 4.170 20 0 HIADHN O=C(NCCc1ccc(OC(F)(F)F)cc1)N1CCCN(Cc2ccccc2)CC1 ZINC000502644522 911680007 /nfs/dbraw/zinc/68/00/07/911680007.db2.gz PGTLHTDLBMOGJH-UHFFFAOYSA-N 0 3 421.463 4.045 20 0 HIADHN Cc1c(C(=O)N(CCN(C)C)C2CCCC2)cnn1-c1cccc(C(F)(F)F)c1 ZINC000502807185 911824829 /nfs/dbraw/zinc/82/48/29/911824829.db2.gz UJKPQWWCXKQYTK-UHFFFAOYSA-N 0 3 408.468 4.146 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)NCCCC[N@H+]3C[C@H](C)C[C@H](C)C3)cc2)cc(=O)[n-]1 ZINC000502862489 911869179 /nfs/dbraw/zinc/86/91/79/911869179.db2.gz OGTCGGMZRQNZME-CALCHBBNSA-N 0 3 411.550 4.037 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)NCCCC[N@@H+]3C[C@H](C)C[C@H](C)C3)cc2)cc(=O)[n-]1 ZINC000502862489 911869180 /nfs/dbraw/zinc/86/91/80/911869180.db2.gz OGTCGGMZRQNZME-CALCHBBNSA-N 0 3 411.550 4.037 20 0 HIADHN C[C@]1(CNC(=O)N(CCN2CCCC2)Cc2ccc(Cl)c(Cl)c2)CCOC1 ZINC000502888895 911885701 /nfs/dbraw/zinc/88/57/01/911885701.db2.gz QALQRDLOVKUGHY-HXUWFJFHSA-N 0 3 414.377 4.027 20 0 HIADHN CCCN(CC(=O)Nc1ccnn1C1CCCC1)[C@@H](C)CC(=O)Nc1ccccc1 ZINC000502920310 911906336 /nfs/dbraw/zinc/90/63/36/911906336.db2.gz RWSJITKROPJISC-SFHVURJKSA-N 0 3 411.550 4.066 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)N[C@H](c1ccccc1)c1ccncc1 ZINC000503040474 912009018 /nfs/dbraw/zinc/00/90/18/912009018.db2.gz AZXCTAUNSKJLBK-DNQXCXABSA-N 0 3 400.526 4.307 20 0 HIADHN Cc1cccc2c1OCC[C@H]2NC(=O)NC[C@@H](c1ccc(OC(C)C)cc1)N(C)C ZINC000503142458 912104572 /nfs/dbraw/zinc/10/45/72/912104572.db2.gz OSFQYFNPPVOHQF-YADHBBJMSA-N 0 3 411.546 4.208 20 0 HIADHN CCN(C(=O)CSc1nccn1C(C)(C)C)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000503158723 912124496 /nfs/dbraw/zinc/12/44/96/912124496.db2.gz VFIMFDZNYIFJGE-AZUAARDMSA-N 0 3 414.619 4.414 20 0 HIADHN Cc1cc(C(=O)NC(C)C)ccc1NC(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000503158024 912124939 /nfs/dbraw/zinc/12/49/39/912124939.db2.gz ALFJDVQFGBPNSX-LJQANCHMSA-N 0 3 414.575 4.153 20 0 HIADHN O[C@@H](Cc1ccc(C(F)(F)F)cc1)CN1CCC[C@H]1c1nnc(-c2ccccc2)[nH]1 ZINC000503168077 912139482 /nfs/dbraw/zinc/13/94/82/912139482.db2.gz BLUXUXLBMSLOLD-OALUTQOASA-N 0 3 416.447 4.231 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)Nc1ccc(OCC2CC2)cc1 ZINC000503188078 912166464 /nfs/dbraw/zinc/16/64/64/912166464.db2.gz GHHZNQANDLJJMZ-UHFFFAOYSA-N 0 3 403.473 4.349 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)N3c4ccccc4C[C@H]3C)CC2)c1 ZINC000503208952 912189593 /nfs/dbraw/zinc/18/95/93/912189593.db2.gz LNOIAPKLKQONNF-OAQYLSRUSA-N 0 3 406.574 4.058 20 0 HIADHN CCc1ccc([C@@H](NCCc2scnc2C)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000506294826 914889787 /nfs/dbraw/zinc/88/97/87/914889787.db2.gz MMKQAJPHHUYWQO-JOCHJYFZSA-N 0 3 414.596 4.339 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)Nc2cccc(N3CCCCC3=O)c2)C1 ZINC000506296468 914891832 /nfs/dbraw/zinc/89/18/32/914891832.db2.gz ZAIOUQIKTPSOGT-GHTZIAJQSA-N 0 3 406.530 4.161 20 0 HIADHN CC(C)(C)c1nn(Cc2ccccc2)cc1CN1CCC(C(=O)N2CCCC2)CC1 ZINC000506298111 914892227 /nfs/dbraw/zinc/89/22/27/914892227.db2.gz OQUMSTFOJWIKBE-UHFFFAOYSA-N 0 3 408.590 4.063 20 0 HIADHN COc1cc(CN2CCC[C@@H](C(=O)Nc3ccccc3)C2)ccc1OCC(F)(F)F ZINC000506312183 914900152 /nfs/dbraw/zinc/90/01/52/914900152.db2.gz YKBCOCPGRZONHD-QGZVFWFLSA-N 0 3 422.447 4.487 20 0 HIADHN COc1ccc([C@H]2C[C@H](NC(=O)[C@H]3CCCN(Cc4cccc(F)c4)C3)C2)cc1F ZINC000506315939 914909978 /nfs/dbraw/zinc/90/99/78/914909978.db2.gz FWILUXHLTFWUGO-ZJOUEHCJSA-N 0 3 414.496 4.248 20 0 HIADHN CCOc1cc(C[NH2+]C[C@@H](C)N2CCc3ccccc32)cc(Br)c1[O-] ZINC000506319936 914918287 /nfs/dbraw/zinc/91/82/87/914918287.db2.gz GXWLKLYGQSMECJ-CQSZACIVSA-N 0 3 405.336 4.094 20 0 HIADHN CCCNC(=O)C1CCN(Cc2ccc(OCc3ccc(F)cc3)c(OC)c2)CC1 ZINC000506339647 914956007 /nfs/dbraw/zinc/95/60/07/914956007.db2.gz DSIQTNMYMJPCNN-UHFFFAOYSA-N 0 3 414.521 4.152 20 0 HIADHN O=C(NC1CCN(Cc2cccc(OCc3ccccn3)c2)CC1)c1ccc(F)cc1 ZINC000506416484 915025917 /nfs/dbraw/zinc/02/59/17/915025917.db2.gz NTYSUZUIJRYLAA-UHFFFAOYSA-N 0 3 419.500 4.194 20 0 HIADHN CC(C)N(C(=O)[C@@H](C)N1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1)C(C)C ZINC000506454694 915054883 /nfs/dbraw/zinc/05/48/83/915054883.db2.gz KMGFGDWWEBMHKP-OAHLLOKOSA-N 0 3 411.949 4.164 20 0 HIADHN CN(C)C(=O)CC1CCN(Cc2cccc(NC(=O)c3ccccc3Cl)c2)CC1 ZINC000513383461 921757337 /nfs/dbraw/zinc/75/73/37/921757337.db2.gz JUFXDMLTJNCNFX-UHFFFAOYSA-N 0 3 413.949 4.283 20 0 HIADHN CC(C)Cc1cccc([C@H](C)C(=O)Nc2cccc(CN3CCC(C(N)=O)CC3)c2)c1 ZINC000506614740 915269829 /nfs/dbraw/zinc/26/98/29/915269829.db2.gz VTIQNDIMZHVHEQ-IBGZPJMESA-N 0 3 421.585 4.325 20 0 HIADHN COC(=O)C1(c2ccccc2)CCN(Cc2cccc(OCc3ccccn3)c2)CC1 ZINC000506625389 915285892 /nfs/dbraw/zinc/28/58/92/915285892.db2.gz SQVVCYNWXNWAPX-UHFFFAOYSA-N 0 3 416.521 4.367 20 0 HIADHN CN(C)[C@H](CNC(=O)Nc1ccc(C(=O)Nc2ccccc2)cc1)c1ccccc1 ZINC000506637072 915305491 /nfs/dbraw/zinc/30/54/91/915305491.db2.gz RILLTLIPDDFJJC-JOCHJYFZSA-N 0 3 402.498 4.363 20 0 HIADHN O=C(NC1CCN(Cc2ccc(OC(F)(F)[C@H](F)C(F)(F)F)cc2)CC1)C1CC1 ZINC000506648038 915316865 /nfs/dbraw/zinc/31/68/65/915316865.db2.gz ZSOYSDVIQAZSCW-QGZVFWFLSA-N 0 3 424.385 4.049 20 0 HIADHN CCCNC(=O)C1CCN(Cc2cn(Cc3ccccc3)nc2-c2ccccc2)CC1 ZINC000506670483 915346512 /nfs/dbraw/zinc/34/65/12/915346512.db2.gz UFFQOLCEJWMAPN-UHFFFAOYSA-N 0 3 416.569 4.337 20 0 HIADHN COc1ccc(CN(Cc2cn(C)nc2-c2ccc3c(c2)OCCCO3)C2CC2)cc1 ZINC000506734907 915421288 /nfs/dbraw/zinc/42/12/88/915421288.db2.gz LWWBMXBJYGMWDK-UHFFFAOYSA-N 0 3 419.525 4.422 20 0 HIADHN CCOc1cc(CN(C)Cc2ccc(Cl)cc2)ccc1O[C@H](C)C(=O)N(C)C ZINC000506766908 915473951 /nfs/dbraw/zinc/47/39/51/915473951.db2.gz JNHJBCJLBIUZAE-MRXNPFEDSA-N 0 3 404.938 4.226 20 0 HIADHN CN(C)Cc1cccc(NC(=O)[C@@H]2CCCN2C(=O)c2cc(Cl)cc(Cl)c2)c1 ZINC000506774005 915490425 /nfs/dbraw/zinc/49/04/25/915490425.db2.gz GSZSJHBRISTCNV-IBGZPJMESA-N 0 3 420.340 4.298 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)NCCCO[C@H]2CCCc3ccccc32)o1 ZINC000506795633 915528693 /nfs/dbraw/zinc/52/86/93/915528693.db2.gz LNVLEASPJQWHQJ-QHCPKHFHSA-N 0 3 413.562 4.146 20 0 HIADHN COc1ccc(CN2CC[C@@H](n3ncc4ccccc43)C2)cc1OCc1cccnc1 ZINC000513412467 921780408 /nfs/dbraw/zinc/78/04/08/921780408.db2.gz AFEOPCOLKXSKOC-JOCHJYFZSA-N 0 3 414.509 4.466 20 0 HIADHN CCCOc1c(Cl)cc(CN2CCC(CN3CCOCC3)CC2)cc1OCC ZINC000506898426 915696307 /nfs/dbraw/zinc/69/63/07/915696307.db2.gz VEQVKZYGRLUOIV-UHFFFAOYSA-N 0 3 410.986 4.072 20 0 HIADHN CN(C(=O)CCc1ccc(-c2ccccc2)[nH]1)C1CCN(CCc2ccccn2)CC1 ZINC000513423037 921792184 /nfs/dbraw/zinc/79/21/84/921792184.db2.gz AGHMFDGSEFHDHM-UHFFFAOYSA-N 0 3 416.569 4.175 20 0 HIADHN C[C@H]1CCc2c(sc3nc(CCC(=O)Nc4cccc(CN(C)C)c4)[nH]c(=O)c32)C1 ZINC000506903577 915703063 /nfs/dbraw/zinc/70/30/63/915703063.db2.gz PYRZKLJRPWAZCR-AWEZNQCLSA-N 0 3 424.570 4.155 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1csc(-c2ncccc2F)n1)c1ccsc1 ZINC000506994367 915807449 /nfs/dbraw/zinc/80/74/49/915807449.db2.gz GKBGSRSOPCQONP-INIZCTEOSA-N 0 3 404.536 4.219 20 0 HIADHN Cc1cccc(-c2n[nH]cc2CN2CCC(C(=O)NCc3ccc(F)cc3)CC2)c1 ZINC000507014076 915821965 /nfs/dbraw/zinc/82/19/65/915821965.db2.gz UGKVOTDTXAAYHM-UHFFFAOYSA-N 0 3 406.505 4.053 20 0 HIADHN CCOc1cc(CN(Cc2cccs2)C(C)C)ccc1O[C@H](C)C(=O)N(C)C ZINC000507020894 915826580 /nfs/dbraw/zinc/82/65/80/915826580.db2.gz KOSAJAAULXRVOX-QGZVFWFLSA-N 0 3 404.576 4.413 20 0 HIADHN O=C(c1ccc(OC[C@@H]2CCCO2)cc1)N1CCCN(CCCc2ccccc2)CC1 ZINC000507115697 915876768 /nfs/dbraw/zinc/87/67/68/915876768.db2.gz ARYQYLLQIHFJHI-VWLOTQADSA-N 0 3 422.569 4.025 20 0 HIADHN Cc1oc(-c2cccs2)nc1CC(=O)N1CCCN(CCCc2ccccc2)CC1 ZINC000507125685 915880536 /nfs/dbraw/zinc/88/05/36/915880536.db2.gz IBKBYUWFNGPRAO-UHFFFAOYSA-N 0 3 423.582 4.421 20 0 HIADHN COc1ccc2c(c1)CCC[C@H]2N(C)Cc1ccccc1OCC(=O)N1CCCC1 ZINC000507161070 915898983 /nfs/dbraw/zinc/89/89/83/915898983.db2.gz OZTGGKXTUYXJBF-HSZRJFAPSA-N 0 3 408.542 4.206 20 0 HIADHN Cc1noc2nc(C(C)C)cc(C(=O)N3CCCN(CCCc4ccccc4)CC3)c12 ZINC000507164326 915904109 /nfs/dbraw/zinc/90/41/09/915904109.db2.gz XWYHDWKWKMIJLD-UHFFFAOYSA-N 0 3 420.557 4.435 20 0 HIADHN Cc1nn(C(C)(C)C)c(C)c1CN1CCC(C(=O)NCc2ccc(C)c(F)c2)CC1 ZINC000507168564 915911398 /nfs/dbraw/zinc/91/13/98/915911398.db2.gz DORBXECYFCKDMN-UHFFFAOYSA-N 0 3 414.569 4.231 20 0 HIADHN COc1ccccc1C[C@H](C)N(Cc1ccccc1)Cc1cc(=O)n2ccccc2n1 ZINC000507218772 915969219 /nfs/dbraw/zinc/96/92/19/915969219.db2.gz MEPVUOPNOJFCMO-FQEVSTJZSA-N 0 3 413.521 4.337 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1NC(=O)CCN(C)C[C@H]1OCCc2ccccc21 ZINC000507260168 916022114 /nfs/dbraw/zinc/02/21/14/916022114.db2.gz RUNRYCILNFVNNT-HSZRJFAPSA-N 0 3 418.541 4.064 20 0 HIADHN CN(CCC(=O)Nc1ccc(Br)cc1F)C[C@@H]1OCCc2ccccc21 ZINC000507263932 916027622 /nfs/dbraw/zinc/02/76/22/916027622.db2.gz QETXGROCDNPTCB-IBGZPJMESA-N 0 3 421.310 4.163 20 0 HIADHN CCCn1nccc1C1CCN(C(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)CC1 ZINC000507308323 916070347 /nfs/dbraw/zinc/07/03/47/916070347.db2.gz YFXLMYMSSULHFG-DENIHFKCSA-N 0 3 409.578 4.018 20 0 HIADHN CCSc1ccc([C@@H](C)N[C@H](C)C(=O)NCc2ccc(OC)c(OC)c2)cc1 ZINC000507537917 916295331 /nfs/dbraw/zinc/29/53/31/916295331.db2.gz SSJIUTWFQHAXKF-HZPDHXFCSA-N 0 3 402.560 4.171 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)Cc3cccc(F)c3F)c(OCC)c2)CC1 ZINC000507592095 916346343 /nfs/dbraw/zinc/34/63/43/916346343.db2.gz BMXPBNYCMRGBHR-UHFFFAOYSA-N 0 3 417.500 4.077 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)CCCc2nc(-c3ccc(F)cc3)no2)C1 ZINC000507616996 916375016 /nfs/dbraw/zinc/37/50/16/916375016.db2.gz MWUDGBXXIIWNMD-UWJYYQICSA-N 0 3 422.504 4.150 20 0 HIADHN C[C@@H](N[C@@H]1CCc2nnc(-c3ccc(F)cc3)n2C1)c1ccc(F)cc1OC(F)F ZINC000507624576 916384761 /nfs/dbraw/zinc/38/47/61/916384761.db2.gz ZUEPXIWPPJIGJS-MLGOLLRUSA-N 0 3 420.410 4.490 20 0 HIADHN Cc1nn(-c2ccc(F)cc2F)c(C)c1CN1CCC(n2cc(Cl)cn2)CC1 ZINC000507705003 916487892 /nfs/dbraw/zinc/48/78/92/916487892.db2.gz DXDPRYZXAIEBPF-UHFFFAOYSA-N 0 3 405.880 4.454 20 0 HIADHN CCOc1cccc(CN2CCC(CCCN3CCOCC3)CC2)c1OC(F)F ZINC000507725081 916519132 /nfs/dbraw/zinc/51/91/32/916519132.db2.gz ZJODJDNEJJHMGI-UHFFFAOYSA-N 0 3 412.521 4.011 20 0 HIADHN COCCOc1ccc(NC(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)cc1Cl ZINC000507746924 916536718 /nfs/dbraw/zinc/53/67/18/916536718.db2.gz JPLLVAFTPOETTP-APWZRJJASA-N 0 3 417.937 4.322 20 0 HIADHN COc1ccc(CN[C@H]2CC(=O)N(C)[C@@H]2c2ccc(Cl)cc2)cc1OC(F)F ZINC000507859109 916690576 /nfs/dbraw/zinc/69/05/76/916690576.db2.gz IGYCRURIBFIGHS-HNAYVOBHSA-N 0 3 410.848 4.012 20 0 HIADHN Cc1ccc(CN[C@@H]2CCc3nnc(-c4ccc(F)cc4)n3C2)c(Br)c1 ZINC000507874635 916712586 /nfs/dbraw/zinc/71/25/86/916712586.db2.gz QLSNBHMFCOLXFU-QGZVFWFLSA-N 0 3 415.310 4.260 20 0 HIADHN Cc1nccn1CCCN(C)[C@@H](C)C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 ZINC000507912929 916788395 /nfs/dbraw/zinc/78/83/95/916788395.db2.gz JHBSJLOONZVKGS-LBPRGKRZSA-N 0 3 402.848 4.213 20 0 HIADHN O=C(c1c[nH]c2ccccc12)[C@@H](c1ccccc1)N1CCC(CN2CCOCC2)CC1 ZINC000507939584 916808508 /nfs/dbraw/zinc/80/85/08/916808508.db2.gz RCSZXCQNJRPVRR-RUZDIDTESA-N 0 3 417.553 4.136 20 0 HIADHN O=C(NC1CCN(Cc2ccccc2)CC1)c1ccc(-c2noc(C(F)F)n2)cc1 ZINC000507969409 916821475 /nfs/dbraw/zinc/82/14/75/916821475.db2.gz LUYDUPCYYUSITK-UHFFFAOYSA-N 0 3 412.440 4.069 20 0 HIADHN Cc1cccc(NC(=O)[C@H]2CCCN(Cc3ccccc3OCc3ccncc3)C2)n1 ZINC000507986941 916830015 /nfs/dbraw/zinc/83/00/15/916830015.db2.gz QURKGFGBIZNESH-QFIPXVFZSA-N 0 3 416.525 4.215 20 0 HIADHN CCOc1cc(CN2CCC[C@@H](C(=O)Nc3ccc(C)cn3)C2)ccc1OC(F)F ZINC000507994251 916835537 /nfs/dbraw/zinc/83/55/37/916835537.db2.gz DKBQYXJQRPSPLR-QGZVFWFLSA-N 0 3 419.472 4.241 20 0 HIADHN O=C(Cc1csc(-c2ccccc2)n1)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000508064952 916888600 /nfs/dbraw/zinc/88/86/00/916888600.db2.gz VDWJJEBWYVTWJE-UHFFFAOYSA-N 0 3 421.566 4.196 20 0 HIADHN COc1ccc(S[C@H](C)C(=O)Nc2cccc(CN3CCC(CO)CC3)c2)cc1 ZINC000508069117 916891966 /nfs/dbraw/zinc/89/19/66/916891966.db2.gz HEWDFHLLWCNCEF-QGZVFWFLSA-N 0 3 414.571 4.019 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)c1csc(-c2ncccc2F)n1 ZINC000508112621 916929236 /nfs/dbraw/zinc/92/92/36/916929236.db2.gz NLUNVLMBKYGNFO-UHFFFAOYSA-N 0 3 418.925 4.202 20 0 HIADHN COc1cccc(NC(=O)C[C@H](C)NCc2cc(Cl)c3c(c2)OCCCO3)c1 ZINC000508341479 917144164 /nfs/dbraw/zinc/14/41/64/917144164.db2.gz HGNYXYJANMPTDB-AWEZNQCLSA-N 0 3 404.894 4.017 20 0 HIADHN COCCSc1ccc([C@H](C)NC(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000508562757 917338879 /nfs/dbraw/zinc/33/88/79/917338879.db2.gz WYWOFCJUVFUNIS-RXVVDRJESA-N 0 3 413.587 4.060 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)C1CCC(OC(F)F)CC1 ZINC000508571857 917344437 /nfs/dbraw/zinc/34/44/37/917344437.db2.gz VSWKACXMYKXXTO-UHFFFAOYSA-N 0 3 422.438 4.394 20 0 HIADHN CCSc1ccc([C@@H](C)NC(=O)N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)cc1 ZINC000508580396 917351654 /nfs/dbraw/zinc/35/16/54/917351654.db2.gz FZRLYRSPUYDHCA-CEXWTWQISA-N 0 3 419.635 4.390 20 0 HIADHN O=C(N[C@@H]1CCOc2c(F)cccc21)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000508604276 917373656 /nfs/dbraw/zinc/37/36/56/917373656.db2.gz OEXDSQNCFDTJSR-WIYYLYMNSA-N 0 3 422.422 4.220 20 0 HIADHN CN(C(=O)NCCCc1c[nH]c2ccc(F)cc12)[C@H]1CCN(Cc2ccccc2)C1 ZINC000508618678 917386393 /nfs/dbraw/zinc/38/63/93/917386393.db2.gz CSPPTFHSJJMKTJ-NRFANRHFSA-N 0 3 408.521 4.156 20 0 HIADHN CC(C)[C@@H](NC(=O)N(C)C1CCN(CCc2ccccn2)CC1)c1ccc(F)cc1 ZINC000508647439 917412987 /nfs/dbraw/zinc/41/29/87/917412987.db2.gz GKUPUVYWSMWUPL-HSZRJFAPSA-N 0 3 412.553 4.266 20 0 HIADHN Cc1nn(Cc2ccc(Cl)cc2)c(C)c1CNCc1ccccc1Cn1cncn1 ZINC000508724721 917486136 /nfs/dbraw/zinc/48/61/36/917486136.db2.gz UOGLYCOXKQMZOA-UHFFFAOYSA-N 0 3 420.948 4.131 20 0 HIADHN C[C@H](NC(=O)N(CCN(C)Cc1ccccc1)Cc1ccccc1)[C@@H]1CCCOC1 ZINC000508756201 917512347 /nfs/dbraw/zinc/51/23/47/917512347.db2.gz SSKWUMCPTIJBSE-XUZZJYLKSA-N 0 3 409.574 4.145 20 0 HIADHN CCOc1ccc(NC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)cc1OC ZINC000508771296 917525526 /nfs/dbraw/zinc/52/55/26/917525526.db2.gz XEOCKXMQPNPPKZ-NRFANRHFSA-N 0 3 422.447 4.487 20 0 HIADHN CCO[C@@H](C)c1noc(CN2CCN(CC(c3ccccc3)c3ccccc3)CC2)n1 ZINC000508827155 917580713 /nfs/dbraw/zinc/58/07/13/917580713.db2.gz JPWPWYMIQCAANV-FQEVSTJZSA-N 0 3 420.557 4.117 20 0 HIADHN C[C@@H](NC(=O)Nc1ccc(NC(=O)c2ccco2)cc1)[C@@H](c1ccccc1)N(C)C ZINC000508865071 917620214 /nfs/dbraw/zinc/62/02/14/917620214.db2.gz NVSFNTBNNPPTRO-IERDGZPVSA-N 0 3 406.486 4.345 20 0 HIADHN C[C@H](NC(=O)N1CCC(c2ncccc2Cl)CC1)[C@@H](c1ccccc1)N(C)C ZINC000508875217 917628400 /nfs/dbraw/zinc/62/84/00/917628400.db2.gz BQRJJOMQUYELLU-KKSFZXQISA-N 0 3 400.954 4.315 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)c(C(F)(F)F)c1 ZINC000508876581 917630276 /nfs/dbraw/zinc/63/02/76/917630276.db2.gz DGKIUDKVSIMZOM-DJJJIMSYSA-N 0 3 422.451 4.477 20 0 HIADHN C[C@H](NC(=O)N(CCO)Cc1ccc(Cl)c(Cl)c1)[C@@H](c1ccccc1)N(C)C ZINC000508893938 917649076 /nfs/dbraw/zinc/64/90/76/917649076.db2.gz JPYAXTCPYMWASE-YWZLYKJASA-N 0 3 424.372 4.189 20 0 HIADHN C[C@H](NC(=O)N(CCO)Cc1ccc(Cl)c(Cl)c1)[C@H](c1ccccc1)N(C)C ZINC000508893936 917649430 /nfs/dbraw/zinc/64/94/30/917649430.db2.gz JPYAXTCPYMWASE-MGPUTAFESA-N 0 3 424.372 4.189 20 0 HIADHN C[C@@H](NC(=O)N1CCC(OCCc2ccccc2)CC1)[C@@H](c1ccccc1)N(C)C ZINC000508902389 917658630 /nfs/dbraw/zinc/65/86/30/917658630.db2.gz DBNWMXRGAFFKIT-YKSBVNFPSA-N 0 3 409.574 4.111 20 0 HIADHN C[C@H](NC(=O)Nc1ccc(C(=O)NC2CCCC2)cc1)[C@H](c1ccccc1)N(C)C ZINC000508904623 917659973 /nfs/dbraw/zinc/65/99/73/917659973.db2.gz IICBMQRMUALZOV-HTAPYJJXSA-N 0 3 408.546 4.172 20 0 HIADHN Cc1ccc(NC(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)c(OC[C@@H]2CCCO2)c1 ZINC000508905445 917662291 /nfs/dbraw/zinc/66/22/91/917662291.db2.gz KWBCKWDQLUHALY-RFWXGWTQSA-N 0 3 411.546 4.366 20 0 HIADHN CC(C)COC1CCN(C(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)CC1 ZINC000508982393 917737290 /nfs/dbraw/zinc/73/72/90/917737290.db2.gz RTAUHWDMGKJPQB-NRFANRHFSA-N 0 3 412.496 4.105 20 0 HIADHN CN(C)C[C@@H](NC(=O)NCc1c(F)cccc1N1CCCC1)c1ccc(Cl)cc1 ZINC000509015464 917769171 /nfs/dbraw/zinc/76/91/71/917769171.db2.gz IKYJTYVDMFYEDR-HXUWFJFHSA-N 0 3 418.944 4.181 20 0 HIADHN COc1ccc(-c2nn(Cc3ccccc3)cc2CN2CCC[C@@H](OC)C2)cc1OC ZINC000509135726 917863817 /nfs/dbraw/zinc/86/38/17/917863817.db2.gz GOOUTIYLCSADNZ-JOCHJYFZSA-N 0 3 421.541 4.226 20 0 HIADHN O=C(NCc1cc(-c2ccccc2)on1)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000509193866 917898667 /nfs/dbraw/zinc/89/86/67/917898667.db2.gz FRKNAXSPMOHQMZ-FQEVSTJZSA-N 0 3 411.452 4.115 20 0 HIADHN Cc1noc([C@@H]2CCCN(Cc3cn(Cc4ccccc4)nc3-c3cccnc3)C2)n1 ZINC000509360991 918026640 /nfs/dbraw/zinc/02/66/40/918026640.db2.gz YPNWHTKPOPUIAM-OAQYLSRUSA-N 0 3 414.513 4.064 20 0 HIADHN O=C(Nc1ccc(Cl)cn1)[C@@H]1CCCN(Cc2cnc(-c3ccncc3)s2)C1 ZINC000509380486 918046370 /nfs/dbraw/zinc/04/63/70/918046370.db2.gz SZYHNDHFBUGCOP-OAHLLOKOSA-N 0 3 413.934 4.104 20 0 HIADHN Cn1cnnc1C1CCN(Cc2ccc(OC(F)(F)[C@H](F)C(F)(F)F)cc2)CC1 ZINC000509398990 918065755 /nfs/dbraw/zinc/06/57/55/918065755.db2.gz JRUBUHKCNPBRSM-MRXNPFEDSA-N 0 3 422.373 4.067 20 0 HIADHN CCCc1nc(C(=O)NC[C@H]2CCCN(C)[C@@H]2c2ccc(C(F)(F)F)cc2)co1 ZINC000509401769 918068103 /nfs/dbraw/zinc/06/81/03/918068103.db2.gz OXRJQSGGTPNCIY-DNVCBOLYSA-N 0 3 409.452 4.459 20 0 HIADHN Cn1cc(-c2ccc(CN[C@@H]3CCN(c4ccc(Cl)c(Cl)c4)C3=O)s2)cn1 ZINC000509488152 918133661 /nfs/dbraw/zinc/13/36/61/918133661.db2.gz VQWAFQITAZCBCI-QGZVFWFLSA-N 0 3 421.353 4.351 20 0 HIADHN O=C([C@H]1CN(Cc2ccccc2)CCC1(F)F)N(Cc1ccco1)CC(F)(F)F ZINC000509508917 918155699 /nfs/dbraw/zinc/15/56/99/918155699.db2.gz OMSJAKMDBIOLPW-QGZVFWFLSA-N 0 3 416.390 4.328 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(C)c1CN1CCC(C(=O)N2CCC[C@H](C)C2)CC1 ZINC000509554983 918204948 /nfs/dbraw/zinc/20/49/48/918204948.db2.gz IJSNMHAEYRWDDI-KRWDZBQOSA-N 0 3 412.553 4.099 20 0 HIADHN CC(C)Cc1cccc([C@H](C)C(=O)Nc2ccccc2CN2CCC[C@H](C(N)=O)C2)c1 ZINC000509563440 918212345 /nfs/dbraw/zinc/21/23/45/918212345.db2.gz GQPIULACWCSWBN-CVDCTZTESA-N 0 3 421.585 4.325 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N1CCC[C@@H]1c1cccc2c1OCCO2)c1ccco1 ZINC000509565672 918215159 /nfs/dbraw/zinc/21/51/59/918215159.db2.gz AVHJHTFISPDGAE-YTQUADARSA-N 0 3 413.518 4.027 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N1CCC(n2c(C)nc3ccccc32)CC1)c1ccco1 ZINC000509565935 918215294 /nfs/dbraw/zinc/21/52/94/918215294.db2.gz BZAKKNBSFUEJBJ-LAUBAEHRSA-N 0 3 423.561 4.414 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N(C)[C@H](COC)c1ccc(Cl)cc1)c1ccco1 ZINC000509571024 918221672 /nfs/dbraw/zinc/22/16/72/918221672.db2.gz RNKMQYFZMLGGSM-KFKAGJAMSA-N 0 3 407.942 4.391 20 0 HIADHN Cc1nn(Cc2ccc(Cl)cc2)c(C)c1CN1CCC(C(=O)N(C)C(C)C)CC1 ZINC000509579168 918228148 /nfs/dbraw/zinc/22/81/48/918228148.db2.gz LGJFGKMHEMAGTQ-UHFFFAOYSA-N 0 3 416.997 4.280 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N1CCC[C@H]1c1nc2cc(C)ccc2[nH]1)c1ccco1 ZINC000509582956 918232276 /nfs/dbraw/zinc/23/22/76/918232276.db2.gz IYOMDPZQLLCLEN-VDGAXYAQSA-N 0 3 409.534 4.440 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N1CCC[C@H]1c1nc2ccc(C)cc2[nH]1)c1ccco1 ZINC000509582956 918232297 /nfs/dbraw/zinc/23/22/97/918232297.db2.gz IYOMDPZQLLCLEN-VDGAXYAQSA-N 0 3 409.534 4.440 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(CN3CCC(C(=O)N(C)C(C)C)CC3)c2)cc1 ZINC000509584284 918233298 /nfs/dbraw/zinc/23/32/98/918233298.db2.gz NBQOVVWYGNVNER-UHFFFAOYSA-N 0 3 423.557 4.026 20 0 HIADHN CCOc1c(OC)cc(CN[C@H](C)c2ccc(NC(=O)NC(C)C)cc2)cc1OC ZINC000509586265 918235193 /nfs/dbraw/zinc/23/51/93/918235193.db2.gz MMYGEROJVXHHRJ-MRXNPFEDSA-N 0 3 415.534 4.483 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N(Cc1cccc(F)c1)C[C@@H]1CCCO1)c1ccco1 ZINC000509589142 918238587 /nfs/dbraw/zinc/23/85/87/918238587.db2.gz YNEXYZGQDBEYJZ-YYWHXJBOSA-N 0 3 417.525 4.239 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N1CC[C@@H](C(F)(F)F)C2(CCC2)C1)c1ccco1 ZINC000509592644 918241457 /nfs/dbraw/zinc/24/14/57/918241457.db2.gz UNVPSQMVCAQTDU-YQQAZPJKSA-N 0 3 401.473 4.473 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N(C)Cc1ccccc1OC(F)(F)F)c1ccco1 ZINC000509597722 918248781 /nfs/dbraw/zinc/24/87/81/918248781.db2.gz ALXDUFDKMFLAIV-HOCLYGCPSA-N 0 3 413.440 4.449 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)N1CCC(c2ncccc2Cl)CC1)c1ccco1 ZINC000509599064 918250229 /nfs/dbraw/zinc/25/02/29/918250229.db2.gz FEKHKYXJYUYFRN-QAPCUYQASA-N 0 3 404.942 4.346 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)N1CC=C(c2c[nH]c3ncccc23)CC1)c1ccco1 ZINC000509611105 918258382 /nfs/dbraw/zinc/25/83/82/918258382.db2.gz MWDVLRHBNZYAAJ-UZLBHIALSA-N 0 3 407.518 4.084 20 0 HIADHN COc1cc(CNCc2ccccc2Cn2ccnc2)ccc1OCC(F)(F)F ZINC000509623273 918269449 /nfs/dbraw/zinc/26/94/49/918269449.db2.gz YDAWCKGKOYIMIS-UHFFFAOYSA-N 0 3 405.420 4.171 20 0 HIADHN CC[C@@H](CNC(=O)c1c[nH]cc1-c1cccc(OC)c1)N1CCc2ccccc2C1 ZINC000509700419 918330951 /nfs/dbraw/zinc/33/09/51/918330951.db2.gz KHZDOLBVPKJLTC-NRFANRHFSA-N 0 3 403.526 4.257 20 0 HIADHN O=C(N[C@@H]1C[C@H]1c1ccccc1C(F)(F)F)N1CCCN(Cc2ccccc2)CC1 ZINC000509900124 918502011 /nfs/dbraw/zinc/50/20/11/918502011.db2.gz GHIXNQPNDZKWBI-PZJWPPBQSA-N 0 3 417.475 4.479 20 0 HIADHN CCOc1ccc(-c2nc(CC(=O)N(CC(C)C)C3CCN(C)CC3)cs2)cc1 ZINC000509939962 918536021 /nfs/dbraw/zinc/53/60/21/918536021.db2.gz VLXUBOLGKFFTEF-UHFFFAOYSA-N 0 3 415.603 4.330 20 0 HIADHN O=C(Nc1ccccc1)N1CC[C@H](NCc2ccc(Br)c(Cl)c2)C1 ZINC000509964584 918555443 /nfs/dbraw/zinc/55/54/43/918555443.db2.gz VYXCWMKJMWTWCH-HNNXBMFYSA-N 0 3 408.727 4.499 20 0 HIADHN C[C@H](NS(=O)(=O)c1csc2ccccc21)[C@H]1CCN(Cc2ccccc2)C1 ZINC000509973474 918563096 /nfs/dbraw/zinc/56/30/96/918563096.db2.gz DYJSFPKUYQYVOJ-WMZOPIPTSA-N 0 3 400.569 4.090 20 0 HIADHN Cn1nccc1-c1ccccc1CNCc1ccc(OCCOc2ccccc2)nc1 ZINC000510013002 918592973 /nfs/dbraw/zinc/59/29/73/918592973.db2.gz HUOFBLVZFIBQPX-UHFFFAOYSA-N 0 3 414.509 4.230 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Cc1ccc(Br)s1)c1ccsc1 ZINC000510039609 918610893 /nfs/dbraw/zinc/61/08/93/918610893.db2.gz GHJXBWZSVZWTLU-CQSZACIVSA-N 0 3 401.395 4.314 20 0 HIADHN CCn1c2ccc(Br)cc2nc1NC(=O)c1cccc(CN(C)C)c1 ZINC000510198212 918747819 /nfs/dbraw/zinc/74/78/19/918747819.db2.gz HWSZGVUTXHMFRS-UHFFFAOYSA-N 0 3 401.308 4.133 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N(C)C[C@@H]1OCCc2ccccc21)c1ccsc1 ZINC000510255000 918789374 /nfs/dbraw/zinc/78/93/74/918789374.db2.gz IKJWLWAXCJLECI-RTWAWAEBSA-N 0 3 401.576 4.086 20 0 HIADHN Cc1cc2cccnc2c(NC(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)c1 ZINC000510273024 918799865 /nfs/dbraw/zinc/79/98/65/918799865.db2.gz SDNSWFQKHAGKDR-OALUTQOASA-N 0 3 410.562 4.286 20 0 HIADHN CN(C)C[C@H](NC(=O)c1ccc(-c2noc(C(F)F)n2)cc1)c1ccc(Cl)cc1 ZINC000510294363 918812855 /nfs/dbraw/zinc/81/28/55/918812855.db2.gz GZKZHNFYOXYGFZ-INIZCTEOSA-N 0 3 420.847 4.360 20 0 HIADHN CCc1cccc2c1OCC[C@@H]2NC(=O)NC[C@@H](c1ccc(OC)cc1)N1CCCC1 ZINC000510355299 918849099 /nfs/dbraw/zinc/84/90/99/918849099.db2.gz AWAMZGYSRCGISR-GOTSBHOMSA-N 0 3 423.557 4.218 20 0 HIADHN CN(C)[C@@H](CNC(=O)Nc1ccc(C(=O)NC2CCCCC2)cc1)c1ccccc1 ZINC000510373730 918859726 /nfs/dbraw/zinc/85/97/26/918859726.db2.gz HUZDETYRLKPWRN-QFIPXVFZSA-N 0 3 408.546 4.174 20 0 HIADHN O[C@H](COc1c(Cl)cccc1Cl)CN1CC[C@H](n2ncc3ccccc32)C1 ZINC000510419053 918885911 /nfs/dbraw/zinc/88/59/11/918885911.db2.gz CFQKOMMQSDKSJR-HOTGVXAUSA-N 0 3 406.313 4.030 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3cc(C(C)(C)C)nn3C(C)(C)C)cc2)CC1 ZINC000510423633 918888278 /nfs/dbraw/zinc/88/82/78/918888278.db2.gz GOABCMLHOXNVAQ-UHFFFAOYSA-N 0 3 411.594 4.330 20 0 HIADHN COc1ccc(Br)c(CNC(=O)c2oc3ccccc3c2CN(C)C)c1 ZINC000510470599 918926763 /nfs/dbraw/zinc/92/67/63/918926763.db2.gz IZKNZGUXVYTVSA-UHFFFAOYSA-N 0 3 417.303 4.196 20 0 HIADHN CCOc1cc(CNC(=O)c2oc3ccccc3c2CN(C)C)ccc1OC(F)F ZINC000510505036 918952698 /nfs/dbraw/zinc/95/26/98/918952698.db2.gz VXWJQWUTJJMQKP-UHFFFAOYSA-N 0 3 418.440 4.425 20 0 HIADHN CN(C(=O)c1cccc(Oc2ccc(Cl)c(Cl)c2)n1)[C@@H]1CCN(C2CC2)C1 ZINC000510531214 918977293 /nfs/dbraw/zinc/97/72/93/918977293.db2.gz BMGYEGIDKWYTDQ-CQSZACIVSA-N 0 3 406.313 4.489 20 0 HIADHN Cn1c2ccc(CNCc3ccc(-c4ccc5c(c4)CCCO5)cc3)cc2oc1=O ZINC000510532859 918979235 /nfs/dbraw/zinc/97/92/35/918979235.db2.gz HPOLRYJBTVIAHN-UHFFFAOYSA-N 0 3 400.478 4.413 20 0 HIADHN Cc1n[nH]c(C)c1[C@@H]1CCCCCN1C(=O)N[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000510546737 918991274 /nfs/dbraw/zinc/99/12/74/918991274.db2.gz NOKQPAAWECJZDQ-HJNYFJLDSA-N 0 3 409.578 4.489 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)Nc1ccc(OC[C@H]2CCCO2)cc1 ZINC000510563824 919005688 /nfs/dbraw/zinc/00/56/88/919005688.db2.gz CPHBWOBLRMGKSU-WOJBJXKFSA-N 0 3 415.559 4.265 20 0 HIADHN C[C@@H](NC(=O)NCC1(c2cccc(Br)c2)CCCC1)C1=CCN(C)CC1 ZINC000510595339 919037641 /nfs/dbraw/zinc/03/76/41/919037641.db2.gz FOKMWYLZBQNLOR-MRXNPFEDSA-N 0 3 420.395 4.211 20 0 HIADHN C[C@@H](NC(=O)NCc1ccc(-c2ccc3c(c2)C[C@H](C)O3)cc1)C1=CCN(C)CC1 ZINC000510605169 919045744 /nfs/dbraw/zinc/04/57/44/919045744.db2.gz ATMAGUBSOREMFR-ZWKOTPCHSA-N 0 3 405.542 4.127 20 0 HIADHN C[C@H]1COCC[C@@H]1CNC(=O)N(CCN(C)Cc1ccccc1)Cc1ccccc1 ZINC000510618646 919060835 /nfs/dbraw/zinc/06/08/35/919060835.db2.gz VGLRHLYUKVNGDQ-XUZZJYLKSA-N 0 3 409.574 4.003 20 0 HIADHN COc1ccc(C[C@H](NCc2ccc3c(c2)NC(=O)CO3)c2ccccc2)cc1OC ZINC000510626927 919068419 /nfs/dbraw/zinc/06/84/19/919068419.db2.gz BIVHDVFYKDSVDJ-FQEVSTJZSA-N 0 3 418.493 4.108 20 0 HIADHN CN(Cc1c[nH]nc1-c1ccccc1F)C[C@H](O)COc1ccccc1C(F)(F)F ZINC000510632691 919072480 /nfs/dbraw/zinc/07/24/80/919072480.db2.gz ICYUMTCNFHTJJG-HNNXBMFYSA-N 0 3 423.410 4.106 20 0 HIADHN CC(C)(C)n1cc(CN2CCC[C@@H]2CN2CCOCC2)c(-c2ccccc2Cl)n1 ZINC000510632578 919072898 /nfs/dbraw/zinc/07/28/98/919072898.db2.gz WFANLBOHZRTYHL-LJQANCHMSA-N 0 3 416.997 4.255 20 0 HIADHN COc1ccc(CCNCc2ccc(Sc3ccccn3)o2)c(OC)c1OC ZINC000510638943 919080113 /nfs/dbraw/zinc/08/01/13/919080113.db2.gz BJUZFGJJGOSEOF-UHFFFAOYSA-N 0 3 400.500 4.184 20 0 HIADHN CC(C)[C@H]([NH2+][C@H](C)CCc1ccc(C(F)(F)F)cc1)c1nc(-c2nc[n-]n2)no1 ZINC000510680839 919120047 /nfs/dbraw/zinc/12/00/47/919120047.db2.gz JFPUCIGHTNDHKS-DOMZBBRYSA-N 0 3 408.428 4.182 20 0 HIADHN COc1cccc([C@@H](CNC(=O)Nc2ccc(OC(F)F)c(F)c2)N2CCCC2)c1 ZINC000510683528 919122936 /nfs/dbraw/zinc/12/29/36/919122936.db2.gz GRSCQZGFPSUEOX-GOSISDBHSA-N 0 3 423.435 4.394 20 0 HIADHN Brc1ccc2c(c1)[C@H](NCc1ccnc(OC3CCOCC3)c1)CC2 ZINC000510688123 919126045 /nfs/dbraw/zinc/12/60/45/919126045.db2.gz QKCZWHKFDLKRCZ-LJQANCHMSA-N 0 3 403.320 4.179 20 0 HIADHN Cc1ccc(NC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)c(OC[C@@H]2CCCO2)c1 ZINC000510736399 919182151 /nfs/dbraw/zinc/18/21/51/919182151.db2.gz PWGWATSBDAYEKM-VXKWHMMOSA-N 0 3 423.557 4.339 20 0 HIADHN C[C@H](NC(=O)Cc1csc(-c2cccc(C(F)(F)F)c2)n1)C1=CCN(C)CC1 ZINC000510788881 919254871 /nfs/dbraw/zinc/25/48/71/919254871.db2.gz VONUGYPWETWYFS-ZDUSSCGKSA-N 0 3 409.477 4.138 20 0 HIADHN CC(C)c1nc(C(=O)N[C@@H](C)C2=CCN(C)CC2)nn1-c1c(Cl)cccc1Cl ZINC000510788980 919255842 /nfs/dbraw/zinc/25/58/42/919255842.db2.gz WXHICPVSTKQJGT-ZDUSSCGKSA-N 0 3 422.360 4.078 20 0 HIADHN C[C@@H](NC(=O)[C@H](Oc1ccc(F)c(Cl)c1)c1ccccc1)C1=CCN(C)CC1 ZINC000510801304 919271568 /nfs/dbraw/zinc/27/15/68/919271568.db2.gz VKWNTTIWGIDVFN-QVKFZJNVSA-N 0 3 402.897 4.366 20 0 HIADHN C[C@H](NC(=O)[C@H](Oc1ccc(F)c(Cl)c1)c1ccccc1)C1=CCN(C)CC1 ZINC000510801306 919272496 /nfs/dbraw/zinc/27/24/96/919272496.db2.gz VKWNTTIWGIDVFN-YCRPNKLZSA-N 0 3 402.897 4.366 20 0 HIADHN COC(=O)c1ccc(CN2CCC[C@@H](c3nc(-c4ccccc4OC)cs3)C2)nc1 ZINC000510808482 919285046 /nfs/dbraw/zinc/28/50/46/919285046.db2.gz DTUHLPCIFSPSFA-QGZVFWFLSA-N 0 3 423.538 4.380 20 0 HIADHN O=C(N[C@@H](c1ccccc1)c1ccncc1)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000510857643 919347650 /nfs/dbraw/zinc/34/76/50/919347650.db2.gz PZUBUDFMJPOZQN-PKTZIBPZSA-N 0 3 421.491 4.445 20 0 HIADHN O=C(Cc1ccccc1)N1CCC[C@@H](N[C@@H]2CCCc3nn(-c4ccccc4)cc32)C1 ZINC000510934364 919456719 /nfs/dbraw/zinc/45/67/19/919456719.db2.gz YGBLNHFSAYOXBK-ZJSXRUAMSA-N 0 3 414.553 4.073 20 0 HIADHN COc1ccccc1CCCN(CCn1ccnc1)Cc1ccc(Br)o1 ZINC000510938249 919462093 /nfs/dbraw/zinc/46/20/93/919462093.db2.gz UZCKHZGNIUOVJK-UHFFFAOYSA-N 0 3 418.335 4.382 20 0 HIADHN Cc1c([C@H](C)N[C@H]2CCN(C(=O)Nc3ccccc3)C2)cnn1-c1ccc(F)cc1 ZINC000510946217 919475804 /nfs/dbraw/zinc/47/58/04/919475804.db2.gz VFYYGXGWIFFGAY-JXFKEZNVSA-N 0 3 407.493 4.277 20 0 HIADHN O=C(COc1ccccc1)N1CC[C@H](N[C@@H]2CCSc3c(Cl)cccc32)C1 ZINC000510979663 919530261 /nfs/dbraw/zinc/53/02/61/919530261.db2.gz PFRKSWJBJITYJH-HNAYVOBHSA-N 0 3 402.947 4.146 20 0 HIADHN COc1cccc(NC(=O)[C@H](N[C@H](Cc2ccccc2)CN(C)C)c2ccccc2)c1 ZINC000511012078 919576709 /nfs/dbraw/zinc/57/67/09/919576709.db2.gz RQZYBLZWEWKEEJ-ILBGXUMGSA-N 0 3 417.553 4.138 20 0 HIADHN COc1cc(C(=O)N(CCN(C)C)Cc2ccc(F)cc2F)cc(OC)c1C(C)C ZINC000511014601 919583482 /nfs/dbraw/zinc/58/34/82/919583482.db2.gz MSKYGQUHQBLQLQ-UHFFFAOYSA-N 0 3 420.500 4.309 20 0 HIADHN CC(C)CN(C(=O)c1cccc(C(=O)N(C)c2ccccc2)c1)C1CCN(C)CC1 ZINC000511026153 919598536 /nfs/dbraw/zinc/59/85/36/919598536.db2.gz ISAOFNMDSCZHRX-UHFFFAOYSA-N 0 3 407.558 4.156 20 0 HIADHN Cc1ccc(NC(=O)N2CCN(CCC(C)(C)C)CC2)c(OC[C@@H]2CCCO2)c1 ZINC000511030098 919609343 /nfs/dbraw/zinc/60/93/43/919609343.db2.gz LUWWYIAGDSWNQD-IBGZPJMESA-N 0 3 403.567 4.139 20 0 HIADHN COC[C@@H](N[C@@H]1CCCN(C(=O)Cc2ccccc2)C1)c1cccc(C(F)(F)F)c1 ZINC000511052558 919647503 /nfs/dbraw/zinc/64/75/03/919647503.db2.gz BXXIQZMIXMCFEN-NHCUHLMSSA-N 0 3 420.475 4.216 20 0 HIADHN Cc1cc(C)cc(-n2ccnc2SCC(=O)N(CC(C)C)C2CCN(C)CC2)c1 ZINC000511056374 919653132 /nfs/dbraw/zinc/65/31/32/919653132.db2.gz LWCXJHDIDVDRPN-UHFFFAOYSA-N 0 3 414.619 4.160 20 0 HIADHN C[C@@H]1CN(c2ccccc2NC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)C[C@@H](C)O1 ZINC000511080037 919682200 /nfs/dbraw/zinc/68/22/00/919682200.db2.gz MOTDLXQTLFQYDB-KCZVDYSFSA-N 0 3 422.573 4.086 20 0 HIADHN CN(C)[C@H](CNC(=O)Nc1cc(F)c(Br)cc1F)Cc1ccccc1 ZINC000511131076 919747069 /nfs/dbraw/zinc/74/70/69/919747069.db2.gz LOAJBUCWMQLTSF-ZDUSSCGKSA-N 0 3 412.278 4.022 20 0 HIADHN COc1ccc(CCN(Cc2ccccc2)C(=O)N[C@H](C)C2=CCN(C)CC2)cc1 ZINC000511249372 919850630 /nfs/dbraw/zinc/85/06/30/919850630.db2.gz OWUVYSCZMVECIU-HXUWFJFHSA-N 0 3 407.558 4.100 20 0 HIADHN C[C@H](NC(=O)Nc1ccc(NC(=O)c2ccc(Cl)cc2)cc1)C1=CCN(C)CC1 ZINC000511263336 919861246 /nfs/dbraw/zinc/86/12/46/919861246.db2.gz AODKWRPNFGCSBW-HNNXBMFYSA-N 0 3 412.921 4.364 20 0 HIADHN CC(C)NC(=O)c1ccc(NC(=O)NC[C@H](C(C)C)N2CCc3ccccc3C2)cc1 ZINC000511280619 919876423 /nfs/dbraw/zinc/87/64/23/919876423.db2.gz ZXWCOEKVLRCRRU-HSZRJFAPSA-N 0 3 422.573 4.029 20 0 HIADHN Cc1cc(C(=O)N2CCC(C)CC2)ccc1NC(=O)NC[C@H](c1ccccc1)N(C)C ZINC000511284611 919880128 /nfs/dbraw/zinc/88/01/28/919880128.db2.gz ZDNLRGBHHVKSBX-HSZRJFAPSA-N 0 3 422.573 4.292 20 0 HIADHN C[C@H]1CCCCN1C(=O)c1ccc(NC(=O)NC[C@@H](c2ccccc2)N(C)C)cc1 ZINC000511297247 919893120 /nfs/dbraw/zinc/89/31/20/919893120.db2.gz NMRNAIDTPGSWSS-AVRDEDQJSA-N 0 3 408.546 4.126 20 0 HIADHN C[C@@H](NC(=O)c1ccccc1Nc1ccc(OC(F)F)cc1)C1=CCN(C)CC1 ZINC000511308148 919900301 /nfs/dbraw/zinc/90/03/01/919900301.db2.gz MIINRIORXSAQFN-OAHLLOKOSA-N 0 3 401.457 4.412 20 0 HIADHN COc1cc(C(=O)N[C@@H](C)C2=CCN(C)CC2)ccc1OCc1ccc(Cl)cc1 ZINC000511332337 919922445 /nfs/dbraw/zinc/92/24/45/919922445.db2.gz IHAOXFRSNRJMBM-INIZCTEOSA-N 0 3 414.933 4.308 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)N[C@@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000511384813 919986992 /nfs/dbraw/zinc/98/69/92/919986992.db2.gz RPDSUZWCKPRBBI-REWPJTCUSA-N 0 3 413.537 4.067 20 0 HIADHN O=C(N[C@H](C[C@H]1CCOC1)c1ccccc1)N1CCCN(Cc2ccccc2)CC1 ZINC000511390287 919997121 /nfs/dbraw/zinc/99/71/21/919997121.db2.gz HVEPNUHQIFUUPQ-ISKFKSNPSA-N 0 3 407.558 4.072 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)N[C@@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000511392414 920001373 /nfs/dbraw/zinc/00/13/73/920001373.db2.gz UQPRMGGEGKWSDG-VTZPFEBOSA-N 0 3 421.585 4.460 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)N[C@H](C[C@H]2CCOC2)c2ccccc2)CN1Cc1ccccc1 ZINC000511392514 920001623 /nfs/dbraw/zinc/00/16/23/920001623.db2.gz WCQDRKFIXCQDNJ-HFGNEKBZSA-N 0 3 407.558 4.117 20 0 HIADHN C[C@@H]1CCN(C(=O)N[C@H](C[C@@H]2CCOC2)c2ccccc2)CCN1Cc1ccccc1 ZINC000511395190 920005544 /nfs/dbraw/zinc/00/55/44/920005544.db2.gz CFYIKUKHSZKJNB-NMVJMZGASA-N 0 3 421.585 4.460 20 0 HIADHN C[C@@H]1CCN(C(=O)N[C@@H](C[C@@H]2CCOC2)c2ccccc2)CCN1Cc1ccccc1 ZINC000511395194 920005844 /nfs/dbraw/zinc/00/58/44/920005844.db2.gz CFYIKUKHSZKJNB-VTZPFEBOSA-N 0 3 421.585 4.460 20 0 HIADHN Cc1n[nH]c(C)c1[C@@H]1CCCCCN1C(=O)N[C@H]1C[C@@H](C)N(Cc2ccccc2)C1 ZINC000511415546 920028367 /nfs/dbraw/zinc/02/83/67/920028367.db2.gz BGMRUCGMZIABAN-WTNAPCKOSA-N 0 3 409.578 4.316 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N2CC[C@@H](n3ncc4ccccc43)C2)N2CCCC2)cc1 ZINC000511417853 920030879 /nfs/dbraw/zinc/03/08/79/920030879.db2.gz JUXCNUAFYIRBGY-VWNXMTODSA-N 0 3 417.557 4.138 20 0 HIADHN CC(C)CNC(=O)c1ccc(NC(=O)NC[C@@H](c2ccccc2)N(C)C)cc1Cl ZINC000511513333 920131396 /nfs/dbraw/zinc/13/13/96/920131396.db2.gz OOFFZIWVUCVTNN-FQEVSTJZSA-N 0 3 416.953 4.150 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Cc2ccc(Br)s2)N2CCCC2)cc1 ZINC000511556853 920192799 /nfs/dbraw/zinc/19/27/99/920192799.db2.gz UUPXDYUPZUOVCP-KRWDZBQOSA-N 0 3 407.377 4.315 20 0 HIADHN CC(=O)Nc1cccc(NC(=O)CN[C@H](c2cccc(OC(F)(F)F)c2)C2CC2)c1 ZINC000511561358 920200938 /nfs/dbraw/zinc/20/09/38/920200938.db2.gz IGSKATYUNSYUAP-FQEVSTJZSA-N 0 3 421.419 4.223 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)Cc2cn3cc(Cl)cc(Cl)c3n2)C1 ZINC000511660306 920325406 /nfs/dbraw/zinc/32/54/06/920325406.db2.gz FLVVYXNLHTXSKK-WMLDXEAASA-N 0 3 417.340 4.135 20 0 HIADHN O=C(CN1C[C@H](c2ccccc2)[C@H]2COCC[C@H]21)Nc1ccc(C(F)(F)F)cc1 ZINC000511668347 920333772 /nfs/dbraw/zinc/33/37/72/920333772.db2.gz SZYLAABWJOPRAD-VAMGGRTRSA-N 0 3 404.432 4.148 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)c2ccc3c(c2)[nH]c(=O)n3C2CCCC2)C1 ZINC000511677057 920341188 /nfs/dbraw/zinc/34/11/88/920341188.db2.gz FJWOBVTZQWQLIA-PXNSSMCTSA-N 0 3 418.541 4.422 20 0 HIADHN Cn1cc(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2c2ccccc2)c(C(C)(C)C)n1 ZINC000511731978 920398023 /nfs/dbraw/zinc/39/80/23/920398023.db2.gz UNMXROBWOSTVLP-JTHBVZDNSA-N 0 3 416.569 4.116 20 0 HIADHN Cc1nc(C2CC2)oc1C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1c1ccccc1 ZINC000511750490 920427837 /nfs/dbraw/zinc/42/78/37/920427837.db2.gz CHEYHJRWXAIOFJ-FCHUYYIVSA-N 0 3 401.510 4.258 20 0 HIADHN Cc1cc(C(=O)CN2C[C@H](c3ccccc3)[C@@H]3COCC[C@H]32)c(C)n1Cc1ccco1 ZINC000511754849 920434111 /nfs/dbraw/zinc/43/41/11/920434111.db2.gz JRLMJKQZYLRIKQ-DSNGMDLFSA-N 0 3 418.537 4.433 20 0 HIADHN Fc1cc(-c2noc(CN3C[C@H](c4ccccc4)[C@H]4COCC[C@@H]43)n2)cc(F)c1F ZINC000511761410 920443101 /nfs/dbraw/zinc/44/31/01/920443101.db2.gz IMVUUSWRWCDZIR-MDZRGWNJSA-N 0 3 415.415 4.158 20 0 HIADHN Brc1cc(CN2C[C@H](c3ccccc3)[C@H]3COCC[C@H]32)cc2c1OCO2 ZINC000511765226 920449736 /nfs/dbraw/zinc/44/97/36/920449736.db2.gz NYPIRMDNBJNEIL-ZHALLVOQSA-N 0 3 416.315 4.182 20 0 HIADHN COc1cccc(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2c2ccccc2)c1F ZINC000511770958 920459167 /nfs/dbraw/zinc/45/91/67/920459167.db2.gz VZXFGODHAYYTKX-FCHUYYIVSA-N 0 3 404.485 4.232 20 0 HIADHN Cn1c(CN[C@@H]2CCC[C@H]2c2cccc(C(F)(F)F)c2)nc2ccccc2c1=O ZINC000511806845 920501145 /nfs/dbraw/zinc/50/11/45/920501145.db2.gz BCRZZAJUBSKWBF-FUHWJXTLSA-N 0 3 401.432 4.378 20 0 HIADHN Cc1cc(N2CCCC2)ccc1NC(=O)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000511833634 920540469 /nfs/dbraw/zinc/54/04/69/920540469.db2.gz HOZCZHVUKOXSSC-UHFFFAOYSA-N 0 3 407.558 4.052 20 0 HIADHN CCN1CCN(CCC(=O)NCc2ccc(Oc3cc(C)cc(C)c3)c(C)c2)CC1 ZINC000511958817 920720030 /nfs/dbraw/zinc/72/00/30/920720030.db2.gz BRHYAGGGMFMRAB-UHFFFAOYSA-N 0 3 409.574 4.048 20 0 HIADHN FC(F)(F)[C@H]1CCC[C@@H](CNCc2ncc(I)s2)C1 ZINC000512015924 920788016 /nfs/dbraw/zinc/78/80/16/920788016.db2.gz QNTGZAISYDSKSK-BDAKNGLRSA-N 0 3 404.239 4.206 20 0 HIADHN Cc1ccc(NC(=O)C2(CNCc3ncc(CN(C)C)s3)CCCC2)cc1C ZINC000512022493 920798030 /nfs/dbraw/zinc/79/80/30/920798030.db2.gz GPHQWJIFDLYYJG-UHFFFAOYSA-N 0 3 400.592 4.110 20 0 HIADHN O=C(Cc1cccc(Br)c1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000512028680 920802220 /nfs/dbraw/zinc/80/22/20/920802220.db2.gz ZLADGQPQJRWYNG-UHFFFAOYSA-N 0 3 419.388 4.222 20 0 HIADHN CCc1nc([C@@H](C)N[C@@H](C)CC(=O)Nc2cc(C(F)(F)F)ccc2Cl)n[nH]1 ZINC000512068364 920835328 /nfs/dbraw/zinc/83/53/28/920835328.db2.gz QZUCGWRWXNYJJD-VHSXEESVSA-N 0 3 403.836 4.107 20 0 HIADHN COc1cccc(CN(Cc2ccc(OCc3noc(C)n3)cc2)C[C@H]2CCCO2)c1 ZINC000512070452 920837200 /nfs/dbraw/zinc/83/72/00/920837200.db2.gz FSLFEXKTDMIAOQ-HSZRJFAPSA-N 0 3 423.513 4.147 20 0 HIADHN C[C@@H](Cc1ccc(O)cc1)N[C@@H](c1ccc(F)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000512117771 920870175 /nfs/dbraw/zinc/87/01/75/920870175.db2.gz ZVDASJRZCRVFSV-HJPURHCSSA-N 0 3 413.514 4.245 20 0 HIADHN COc1cc(C(=O)N[C@H](C)C2=CCN(C)CC2)ccc1OCc1ccccc1Cl ZINC000512126253 920875180 /nfs/dbraw/zinc/87/51/80/920875180.db2.gz XXFYHAZRHDUHGX-MRXNPFEDSA-N 0 3 414.933 4.308 20 0 HIADHN C[C@@H](NC(=O)c1cccnc1Oc1cccc(Br)c1)C1=CCN(C)CC1 ZINC000512128356 920877983 /nfs/dbraw/zinc/87/79/83/920877983.db2.gz QUPJXANEUJVCQJ-CQSZACIVSA-N 0 3 416.319 4.017 20 0 HIADHN Cc1cccc(-c2nnc(-c3ccc(C(=O)N[C@@H](C)C4=CCN(C)CC4)cc3)o2)c1 ZINC000512137689 920883688 /nfs/dbraw/zinc/88/36/88/920883688.db2.gz JPOZZONBECLDJQ-KRWDZBQOSA-N 0 3 402.498 4.092 20 0 HIADHN COc1ccc(CN[C@H](C)CC(=O)Nc2cc(C(F)(F)F)ccc2Cl)cn1 ZINC000512147181 920889532 /nfs/dbraw/zinc/88/95/32/920889532.db2.gz SMNZLJDKVRSGFP-LLVKDONJSA-N 0 3 401.816 4.269 20 0 HIADHN OCC[C@@H](NC[C@H](O)COc1ccc(Cl)cc1)c1ccc(Cl)c(Cl)c1 ZINC000512153024 920893724 /nfs/dbraw/zinc/89/37/24/920893724.db2.gz QHXKUOWYXLDKOS-KBXCAEBGSA-N 0 3 404.721 4.100 20 0 HIADHN COCc1ccccc1/C=C(/C)CNc1ccc2nc(CCN3CCOCC3)[nH]c2c1 ZINC000512153278 920894486 /nfs/dbraw/zinc/89/44/86/920894486.db2.gz RYBUMDDVFANVGF-CYVLTUHYSA-N 0 3 420.557 4.099 20 0 HIADHN C[C@H]1CSC[C@H]1NCC(=O)Nc1nc(-c2ccc(Cl)cc2Cl)cs1 ZINC000512180223 920920998 /nfs/dbraw/zinc/92/09/98/920920998.db2.gz NIXMSKMLZQWWLG-TVQRCGJNSA-N 0 3 402.372 4.397 20 0 HIADHN OCC[C@H](NC[C@@H](O)CO[C@@H]1CCCc2ccccc21)c1ccc(Cl)c(Cl)c1 ZINC000512213571 920961120 /nfs/dbraw/zinc/96/11/20/920961120.db2.gz PEAMVURMXDEERL-VOQZNFBZSA-N 0 3 424.368 4.462 20 0 HIADHN Cc1ccc(S(=O)(=O)CCCN[C@H](CCO)c2ccc(Cl)c(Cl)c2)cc1 ZINC000512229192 920981389 /nfs/dbraw/zinc/98/13/89/920981389.db2.gz QNGOJHDITJYIEU-LJQANCHMSA-N 0 3 416.370 4.179 20 0 HIADHN CCCN(CC(=O)Nc1ccc(C)cc1C)C1CCN(c2cc(C)nc(C)n2)CC1 ZINC000512275671 921031482 /nfs/dbraw/zinc/03/14/82/921031482.db2.gz ASXFGCJOPOXSKB-UHFFFAOYSA-N 0 3 409.578 4.030 20 0 HIADHN CCCOc1ccc(CN2CCC(C(=O)N3CCc4ccccc43)CC2)cc1OC ZINC000512286338 921040726 /nfs/dbraw/zinc/04/07/26/921040726.db2.gz OMXQWHIGHKXNPH-UHFFFAOYSA-N 0 3 408.542 4.285 20 0 HIADHN O=C(NC1CCCCC1)C1CCN(Cc2c[nH]nc2-c2cccc(Cl)c2)CC1 ZINC000512345588 921091622 /nfs/dbraw/zinc/09/16/22/921091622.db2.gz HKJQGUCYUSVCEF-UHFFFAOYSA-N 0 3 400.954 4.391 20 0 HIADHN CCCCOc1ccc(CN2CCC(C(=O)NCCc3cccs3)CC2)cc1 ZINC000512347228 921092665 /nfs/dbraw/zinc/09/26/65/921092665.db2.gz RMVIRODMRCNSBB-UHFFFAOYSA-N 0 3 400.588 4.498 20 0 HIADHN CCc1ccc2occ(C(=O)Nc3ccc(C(=O)N(C)[C@@H]4CCCN(C)C4)cc3)c2c1 ZINC000513451481 921818263 /nfs/dbraw/zinc/81/82/63/921818263.db2.gz QNXGUYWFIGPIDB-HXUWFJFHSA-N 0 3 419.525 4.414 20 0 HIADHN COc1ccc2c(c1)C[C@@H](NCc1nnc3c(Cl)cc(C(F)(F)F)cn13)CC2 ZINC000513487854 921840868 /nfs/dbraw/zinc/84/08/68/921840868.db2.gz LCEPYSMXQLWYRS-AWEZNQCLSA-N 0 3 410.827 4.057 20 0 HIADHN C[C@@H]1CN(Cc2ccc(CN[C@H](Cc3ccccn3)c3cccnc3)cc2)C[C@@H](C)O1 ZINC000513500350 921849831 /nfs/dbraw/zinc/84/98/31/921849831.db2.gz MCNMPNBCFVRFCV-IPVFLDMMSA-N 0 3 416.569 4.159 20 0 HIADHN COc1ccc2[nH]cc(C3CCN([C@H](C)C(=O)N(C)Cc4ccccc4)CC3)c2c1 ZINC000513624937 921952870 /nfs/dbraw/zinc/95/28/70/921952870.db2.gz PFVFBJVRKIQWIN-GOSISDBHSA-N 0 3 405.542 4.403 20 0 HIADHN Clc1ccccc1COc1cccc(CN2CCCN(c3cccnn3)CC2)c1 ZINC000513648483 921971696 /nfs/dbraw/zinc/97/16/96/921971696.db2.gz SIBHXFLDUDCGHF-UHFFFAOYSA-N 0 3 408.933 4.421 20 0 HIADHN CC(C)(O)CN1CCc2c(cccc2NC(=O)c2ccccc2Oc2ccncc2)C1 ZINC000513666850 921989621 /nfs/dbraw/zinc/98/96/21/921989621.db2.gz PKCZNXZKNASAMX-UHFFFAOYSA-N 0 3 417.509 4.255 20 0 HIADHN COc1cc(Cl)c(C(=O)NC[C@@H](C(C)C)N2CCc3ccccc3C2)cc1OC ZINC000513692925 922013937 /nfs/dbraw/zinc/01/39/37/922013937.db2.gz WXSKVFKYZNZWPK-FQEVSTJZSA-N 0 3 416.949 4.170 20 0 HIADHN O=C1CCCN1C1CCN(Cc2ccc(OC(F)(F)[C@H](F)C(F)(F)F)cc2)CC1 ZINC000513725094 922044140 /nfs/dbraw/zinc/04/41/40/922044140.db2.gz LSOSIHGNCWTCES-QGZVFWFLSA-N 0 3 424.385 4.145 20 0 HIADHN CC(=O)c1ccc(NC(=O)[C@H](C)N[C@H]2CCC[C@H]2Oc2cc(F)cc(F)c2)cc1 ZINC000513751174 922070165 /nfs/dbraw/zinc/07/01/65/922070165.db2.gz YHTWKSQFCJATGZ-SKOKVVANSA-N 0 3 402.441 4.084 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)c3nc(-c4ccccc4)cs3)CC2)C[C@H](C)O1 ZINC000513831451 922157917 /nfs/dbraw/zinc/15/79/17/922157917.db2.gz RMUBMHRNOQEIMX-ROUUACIJSA-N 0 3 413.587 4.162 20 0 HIADHN CC(=O)[C@@H]1C[C@H](CC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2c2ccccc2)C1(C)C ZINC000513924517 922247339 /nfs/dbraw/zinc/24/73/39/922247339.db2.gz ULGQPEYAKWXLGL-WSOYEBOPSA-N 0 3 418.581 4.412 20 0 HIADHN O=C(Nc1ccn(-c2ccccc2)n1)N1CCCN(CCCc2ccccc2)CC1 ZINC000513935716 922255483 /nfs/dbraw/zinc/25/54/83/922255483.db2.gz LFKKDMYQMTWJFF-UHFFFAOYSA-N 0 3 403.530 4.045 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)NCc2cc(Br)ccc2F)C1 ZINC000514044757 922364615 /nfs/dbraw/zinc/36/46/15/922364615.db2.gz PJPFZZXSVPPHRZ-KDOFPFPSSA-N 0 3 420.326 4.223 20 0 HIADHN CN1CCC(Oc2ccc(NCc3csc(-c4ccc5c(c4)OCO5)n3)cn2)CC1 ZINC000514068040 922391690 /nfs/dbraw/zinc/39/16/90/922391690.db2.gz APMKSTREJYLLSX-UHFFFAOYSA-N 0 3 424.526 4.019 20 0 HIADHN Clc1ccccc1[C@H](CN[C@H](c1ncc[nH]1)C1CCCCC1)N1CCOCC1 ZINC000514081936 922404463 /nfs/dbraw/zinc/40/44/63/922404463.db2.gz DVQAMTWYHCSJMC-SFTDATJTSA-N 0 3 402.970 4.348 20 0 HIADHN CN(Cc1cccc(Br)c1)C(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000514190048 922530583 /nfs/dbraw/zinc/53/05/83/922530583.db2.gz MOYCKDXUSICDHC-KRWDZBQOSA-N 0 3 422.392 4.489 20 0 HIADHN O=C(NCc1cccc(Br)c1)N[C@H](CN1CCCC1)c1ccccc1 ZINC000514220606 922554800 /nfs/dbraw/zinc/55/48/00/922554800.db2.gz ZLSXVITXHWFTNG-LJQANCHMSA-N 0 3 402.336 4.085 20 0 HIADHN CCC[C@@H](NC(=O)NC[C@@H](c1ccsc1)N(CC)CC)c1nnc2ccccn21 ZINC000514242241 922582770 /nfs/dbraw/zinc/58/27/70/922582770.db2.gz QZQWKQVSDJZDDG-MSOLQXFVSA-N 0 3 414.579 4.014 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)CSc1nccn1-c1ccc(C)c(C)c1 ZINC000514398423 922612054 /nfs/dbraw/zinc/61/20/54/922612054.db2.gz YYKOIZMPVKSWMD-UHFFFAOYSA-N 0 3 424.570 4.290 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)N[C@H]2CCSc3ccc(F)cc32)CC1 ZINC000514579502 922715809 /nfs/dbraw/zinc/71/58/09/922715809.db2.gz BQOLVFVLVFCJQA-IBGZPJMESA-N 0 3 403.523 4.262 20 0 HIADHN Cc1cc(Oc2ncccn2)ccc1NC(=O)N[C@H](C)CN(C)Cc1ccccc1 ZINC000514631905 922734513 /nfs/dbraw/zinc/73/45/13/922734513.db2.gz ZZZOOTJJXRDKDJ-GOSISDBHSA-N 0 3 405.502 4.219 20 0 HIADHN CN1CC[C@H](NCC(=O)Nc2ccccc2Br)[C@H]1c1ccc(Cl)cc1 ZINC000514693836 922759968 /nfs/dbraw/zinc/75/99/68/922759968.db2.gz ACZXLVHOIRIRCD-PKOBYXMFSA-N 0 3 422.754 4.076 20 0 HIADHN CN1CC[C@@H](NCC(=O)Nc2ccccc2Br)[C@H]1c1ccc(Cl)cc1 ZINC000514693832 922760509 /nfs/dbraw/zinc/76/05/09/922760509.db2.gz ACZXLVHOIRIRCD-IEBWSBKVSA-N 0 3 422.754 4.076 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)c1cccc(-n2ccc(C(F)(F)F)n2)c1)c1ccco1 ZINC000514750652 922781422 /nfs/dbraw/zinc/78/14/22/922781422.db2.gz ZURUBKYQOWRNGI-PBHICJAKSA-N 0 3 420.435 4.343 20 0 HIADHN CC(=O)Nc1cccc([C@@H](C)N(Cc2ccccc2)C(=O)CN2CCC(C)(C)C2)c1 ZINC000514929807 922848122 /nfs/dbraw/zinc/84/81/22/922848122.db2.gz WMAXJDIVRBPPLZ-LJQANCHMSA-N 0 3 407.558 4.467 20 0 HIADHN O=S(=O)(c1ccc(C(F)(F)F)c(F)c1)N1C[C@@H]2CCCN2Cc2ccccc21 ZINC000514991207 922870351 /nfs/dbraw/zinc/87/03/51/922870351.db2.gz HLQBPCCTSHBMPS-AWEZNQCLSA-N 0 3 414.424 4.018 20 0 HIADHN CSc1ccc([C@H](CNC(=O)c2cc(F)cc3nc(C)c(C)nc32)N(C)C)cc1 ZINC000515087506 922899694 /nfs/dbraw/zinc/89/96/94/922899694.db2.gz PKEOQEBBHKIQAS-FQEVSTJZSA-N 0 3 412.534 4.140 20 0 HIADHN CNC(=O)[C@H](CCSC)NCc1ccc(-c2ccc(C(F)(F)F)cc2)s1 ZINC000515087278 922899782 /nfs/dbraw/zinc/89/97/82/922899782.db2.gz HDXGESXKRYASGT-HNNXBMFYSA-N 0 3 402.507 4.391 20 0 HIADHN CCSc1nnc(NC(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)s1 ZINC000515108732 922921307 /nfs/dbraw/zinc/92/13/07/922921307.db2.gz DHWQGMPUWBZCDP-ZDUSSCGKSA-N 0 3 411.622 4.306 20 0 HIADHN COc1cccc([C@H](CNC(=O)Nc2cccc(NC(=O)C3CC3)c2)N2CCCC2)c1 ZINC000515120873 922933836 /nfs/dbraw/zinc/93/38/36/922933836.db2.gz NSIQTZGUTUHQPX-QFIPXVFZSA-N 0 3 422.529 4.002 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Cc1ccc(-n2nc(C)cc2C)cc1)c1ccsc1 ZINC000515133742 922943141 /nfs/dbraw/zinc/94/31/41/922943141.db2.gz RKSOPFXLQNZODH-JOCHJYFZSA-N 0 3 410.587 4.292 20 0 HIADHN CC(C)Cc1ccc([C@H](NC(=O)C(=O)Nc2cccc(CN(C)C)c2)C(C)C)cc1 ZINC000515144105 922947934 /nfs/dbraw/zinc/94/79/34/922947934.db2.gz JBQLTHDTKJVUGT-HSZRJFAPSA-N 0 3 409.574 4.399 20 0 HIADHN Cc1cc(NC(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)n(-c2ccccn2)n1 ZINC000515222380 923002618 /nfs/dbraw/zinc/00/26/18/923002618.db2.gz AFEQCNRCFGDUNZ-SFHVURJKSA-N 0 3 424.574 4.232 20 0 HIADHN CC[C@@H](CNC(=O)Nc1nnc(-c2ccccc2)s1)N1CCc2ccccc2C1 ZINC000515233474 923006441 /nfs/dbraw/zinc/00/64/41/923006441.db2.gz IBZZLHRUNROJTB-IBGZPJMESA-N 0 3 407.543 4.164 20 0 HIADHN Cc1ccc(Oc2ccccc2NC(=O)C(=O)NC[C@@H](C)N2CCCC[C@H]2C)cc1 ZINC000515277874 923030743 /nfs/dbraw/zinc/03/07/43/923030743.db2.gz MHLQMXVDLFUCRB-RTBURBONSA-N 0 3 409.530 4.105 20 0 HIADHN COCCN(Cc1cccs1)C(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1 ZINC000515290639 923037150 /nfs/dbraw/zinc/03/71/50/923037150.db2.gz BIDBKOYJEWMUJC-IBGZPJMESA-N 0 3 421.632 4.441 20 0 HIADHN CCn1ncc(C(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)c1-c1ccccc1 ZINC000515396798 923080574 /nfs/dbraw/zinc/08/05/74/923080574.db2.gz VVSAOCQSRZQIEN-HSZRJFAPSA-N 0 3 420.557 4.390 20 0 HIADHN CCN(CC)[C@H](CNC(=O)C(=O)Nc1cccc(OC2CCCC2)c1)c1ccccc1 ZINC000515399073 923081391 /nfs/dbraw/zinc/08/13/91/923081391.db2.gz VBPJCLCRKQDVBD-HSZRJFAPSA-N 0 3 423.557 4.146 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)N1CC[C@](F)(c2ccccc2)C1 ZINC000515436534 923099889 /nfs/dbraw/zinc/09/98/89/923099889.db2.gz QLJJYBFQQOFUFQ-HSZRJFAPSA-N 0 3 413.562 4.381 20 0 HIADHN CCc1noc(-c2ccc(C)c(NC(=O)N[C@@H]3CCN(Cc4ccccc4)[C@@H]3C)c2)n1 ZINC000515461089 923118310 /nfs/dbraw/zinc/11/83/10/923118310.db2.gz FBEDBKKNMZAFOL-YLJYHZDGSA-N 0 3 419.529 4.392 20 0 HIADHN CCc1noc(-c2ccc(C)c(NC(=O)N[C@H]3CCN(Cc4ccccc4)[C@H]3C)c2)n1 ZINC000515461087 923118783 /nfs/dbraw/zinc/11/87/83/923118783.db2.gz FBEDBKKNMZAFOL-PXNSSMCTSA-N 0 3 419.529 4.392 20 0 HIADHN CN(C(=O)NCCCN1CCN(C)C[C@H]1c1ccccc1)[C@H]1CCCc2ccccc21 ZINC000515465589 923120331 /nfs/dbraw/zinc/12/03/31/923120331.db2.gz VGBQTQBRRLMEIY-DQEYMECFSA-N 0 3 420.601 4.084 20 0 HIADHN CCN(CC)C(=O)c1cccc(NC(=O)CN2CCC[C@H]2CCc2ccccc2)c1 ZINC000515553549 923172222 /nfs/dbraw/zinc/17/22/22/923172222.db2.gz DSRDWEDNKYFRGP-QHCPKHFHSA-N 0 3 407.558 4.204 20 0 HIADHN Cc1[nH]c2ccc(C(=O)NCCCCN3CCN(c4ccccc4)CC3)cc2c1C ZINC000515584835 923198957 /nfs/dbraw/zinc/19/89/57/923198957.db2.gz GIORTAXZFWPVRN-UHFFFAOYSA-N 0 3 404.558 4.117 20 0 HIADHN Cc1cc(NC(=O)N2CC(C)(C)[C@H]2C2CC2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000515716017 923297511 /nfs/dbraw/zinc/29/75/11/923297511.db2.gz BEDZOVGDKXSLFO-IFMALSPDSA-N 0 3 407.562 4.291 20 0 HIADHN COc1cccc([C@H](C)N[C@@H](C)C(=O)N(C)Cc2ccc(Br)cc2)c1 ZINC000515736649 923312483 /nfs/dbraw/zinc/31/24/83/923312483.db2.gz OGQAKBNILFCXAU-GJZGRUSLSA-N 0 3 405.336 4.155 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)NCc3ccc([C@@H]4C[C@H]4C)o3)CC2)c1 ZINC000515794316 923353532 /nfs/dbraw/zinc/35/35/32/923353532.db2.gz KRLXLABMNPNYCD-NFBKMPQASA-N 0 3 424.589 4.113 20 0 HIADHN Cc1ccc(S[C@H](C)C(=O)NCCCCN2CCN(c3ccccc3)CC2)cc1 ZINC000515814235 923369961 /nfs/dbraw/zinc/36/99/61/923369961.db2.gz UBURRILUTXKUKD-OAQYLSRUSA-N 0 3 411.615 4.194 20 0 HIADHN CN(Cc1ccc(Cl)cc1)C(=O)NCCCCN1CCN(c2ccccc2)CC1 ZINC000515903549 923421359 /nfs/dbraw/zinc/42/13/59/923421359.db2.gz SDEKPCICIOKSGC-UHFFFAOYSA-N 0 3 414.981 4.084 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)Nc1ccc(C(=O)N2CCCCCC2)cc1 ZINC000515910408 923429075 /nfs/dbraw/zinc/42/90/75/923429075.db2.gz NUYZSOFJWPKINB-HXUWFJFHSA-N 0 3 422.573 4.345 20 0 HIADHN CC(C)n1ncc2cc(C(=O)NC[C@H](c3ccccc3)N3CCC(C)CC3)cnc21 ZINC000515981714 923476758 /nfs/dbraw/zinc/47/67/58/923476758.db2.gz MTZBXEUIOPFHCK-JOCHJYFZSA-N 0 3 405.546 4.215 20 0 HIADHN CCc1ccc([C@H](CNC(=O)Nc2ccc(OCCOC)c(Cl)c2)N(C)C)cc1 ZINC000516086114 923536351 /nfs/dbraw/zinc/53/63/51/923536351.db2.gz GSGJTZZLHWSGSU-FQEVSTJZSA-N 0 3 419.953 4.352 20 0 HIADHN Cc1ccc2cc(CNc3ccc(C(=O)N(C)[C@@H]4CCCN(C)C4)cc3)ccc2n1 ZINC000516098713 923541327 /nfs/dbraw/zinc/54/13/27/923541327.db2.gz XRKXMNBQAUQPSF-HSZRJFAPSA-N 0 3 402.542 4.322 20 0 HIADHN CC1CCN([C@@H](CNC(=O)N(C)Cc2ccc3c(c2)OCCO3)c2ccccc2)CC1 ZINC000516149544 923576380 /nfs/dbraw/zinc/57/63/80/923576380.db2.gz NNUNNRVOQHYAAJ-QFIPXVFZSA-N 0 3 423.557 4.072 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)N2CCC(COc3ccccc3)CC2)C1 ZINC000516223609 923610301 /nfs/dbraw/zinc/61/03/01/923610301.db2.gz ROHPVAOOUZRBPD-NZQKXSOJSA-N 0 3 407.558 4.323 20 0 HIADHN CSc1ccccc1NC(=O)[C@H](C)N[C@H]1CCN(C)[C@H]1c1ccc(Cl)cc1 ZINC000516351753 923682184 /nfs/dbraw/zinc/68/21/84/923682184.db2.gz KBEFGDHELPAGCA-DCPHZVHLSA-N 0 3 403.979 4.424 20 0 HIADHN CN(C)Cc1cccc(NC(=O)C(=O)N[C@@H](c2ccccc2)c2cccc(Cl)c2)c1 ZINC000516434178 923730550 /nfs/dbraw/zinc/73/05/50/923730550.db2.gz PZSAFWKVTZATGI-QFIPXVFZSA-N 0 3 421.928 4.246 20 0 HIADHN CCO[C@@H]1C[C@H](N[C@@H](C)c2cc3cc(Br)ccc3o2)[C@@H]1n1cccn1 ZINC000516496790 923760084 /nfs/dbraw/zinc/76/00/84/923760084.db2.gz AJHSMTFAFNSGLE-SRRFXAJZSA-N 0 3 404.308 4.461 20 0 HIADHN CC1CCN(CCNC(=O)N(C)CCCCCc2cc(-c3ccccc3)n[nH]2)CC1 ZINC000516564775 923797332 /nfs/dbraw/zinc/79/73/32/923797332.db2.gz HHUCOVVJKAUIQR-UHFFFAOYSA-N 0 3 411.594 4.163 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CNC(=O)N[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000516578699 923800598 /nfs/dbraw/zinc/80/05/98/923800598.db2.gz JVZYGRBYUCXBBZ-KNQAVFIVSA-N 0 3 417.557 4.124 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)NCc2ccc(OC3CCCC3)nc2)C1 ZINC000516579375 923800765 /nfs/dbraw/zinc/80/07/65/923800765.db2.gz SFOOYVBDHVASTB-NQIIRXRSSA-N 0 3 408.546 4.038 20 0 HIADHN COc1ccc(OC2CCN(C(=O)N[C@@H]3CCN([C@@H](C)c4ccccc4)C3)CC2)cc1 ZINC000516581461 923801797 /nfs/dbraw/zinc/80/17/97/923801797.db2.gz GMWFPQSXWCOXFB-PZJWPPBQSA-N 0 3 423.557 4.084 20 0 HIADHN O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)N(Cc1ccccc1)C[C@H]1CCCO1 ZINC000516590059 923804439 /nfs/dbraw/zinc/80/44/39/923804439.db2.gz KSTLCBXRCGXATL-DNQXCXABSA-N 0 3 407.558 4.042 20 0 HIADHN CC1CCN([C@H](CNC(=O)N2CC(C)(C)[C@H]2[C@@H]2CCCO2)c2cccs2)CC1 ZINC000516610661 923816987 /nfs/dbraw/zinc/81/69/87/923816987.db2.gz ZNUPCEHSLCFQRE-WSTZPKSXSA-N 0 3 405.608 4.120 20 0 HIADHN CN(C)[C@H](CNC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1)c1ccccc1Cl ZINC000516767650 923881909 /nfs/dbraw/zinc/88/19/09/923881909.db2.gz XZSNSNPNKCFFLR-XMSQKQJNSA-N 0 3 417.956 4.110 20 0 HIADHN C[C@H](NC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1)c1ccc(NC(=O)C2CC2)cc1 ZINC000516769761 923882155 /nfs/dbraw/zinc/88/21/55/923882155.db2.gz NHSKVSBZISYJED-UWJYYQICSA-N 0 3 423.532 4.264 20 0 HIADHN C[C@H](Oc1ccccc1NC(=O)N(CCN(C)C)Cc1ccccn1)C(F)(F)F ZINC000516808415 923895174 /nfs/dbraw/zinc/89/51/74/923895174.db2.gz FPVAQGVRJSTAIM-HNNXBMFYSA-N 0 3 410.440 4.007 20 0 HIADHN COc1ccc(CN2CCC[C@@H](c3nnc(C4CCCCC4)[nH]3)C2)c(OC)c1OC ZINC000516997050 923958931 /nfs/dbraw/zinc/95/89/31/923958931.db2.gz AZTUVIAJYZXQDP-GOSISDBHSA-N 0 3 414.550 4.258 20 0 HIADHN C[C@@H](O)CN(CC(=O)N1N=C(c2cccs2)C[C@H]1c1ccco1)C1CCCCC1 ZINC000517119197 924008291 /nfs/dbraw/zinc/00/82/91/924008291.db2.gz PBXAWKKSMUPVIX-APWZRJJASA-N 0 3 415.559 4.034 20 0 HIADHN CN(C(=O)Nc1cc(C(F)(F)F)ccc1F)C1CCN(CCc2ccccn2)CC1 ZINC000517288366 924078500 /nfs/dbraw/zinc/07/85/00/924078500.db2.gz RKJJXMZVRVYDJN-UHFFFAOYSA-N 0 3 424.442 4.410 20 0 HIADHN CCOc1ccc(NC(=O)N(C)C2CCN(CCc3ccccn3)CC2)cc1Cl ZINC000517288534 924078716 /nfs/dbraw/zinc/07/87/16/924078716.db2.gz VNXBXVRMFRFYTR-UHFFFAOYSA-N 0 3 416.953 4.305 20 0 HIADHN Cc1cccc(-c2nnc(SC[C@H]3CN(Cc4ccccc4)CCCO3)n2C)c1 ZINC000517402526 924159513 /nfs/dbraw/zinc/15/95/13/924159513.db2.gz ZAGZZVVMNUKBRG-OAQYLSRUSA-N 0 3 408.571 4.174 20 0 HIADHN Cc1ccc(NC(=O)C(C)C)cc1NC(=O)N[C@H]1CCN(Cc2ccccc2)[C@@H]1C ZINC000517420486 924171207 /nfs/dbraw/zinc/17/12/07/924171207.db2.gz FDMCWTSQNRBISU-NQIIRXRSSA-N 0 3 408.546 4.374 20 0 HIADHN C[C@H](CNC(=O)N1CCC(C(=O)c2ccc(Cl)cc2)CC1)N1CCCC[C@H]1C ZINC000517523345 924244393 /nfs/dbraw/zinc/24/43/93/924244393.db2.gz VDVVUTYRXDMRJC-IAGOWNOFSA-N 0 3 405.970 4.207 20 0 HIADHN COc1cc(CNCc2ccc(-n3cncn3)cc2)ccc1OCc1ccccc1 ZINC000517525053 924245914 /nfs/dbraw/zinc/24/59/14/924245914.db2.gz HBNBNXLPVAJPRV-UHFFFAOYSA-N 0 3 400.482 4.145 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)Nc1ccc(-c2ccccc2)cn1 ZINC000517636550 926742985 /nfs/dbraw/zinc/74/29/85/926742985.db2.gz YDWIGWCDHVUKCC-UHFFFAOYSA-N 0 3 400.526 4.290 20 0 HIADHN Cc1ccc(-c2cc(C(=O)N(C)[C@@H]3CCN(C4CC4)C3)c3cnn(C(C)C)c3n2)s1 ZINC000517648804 926756104 /nfs/dbraw/zinc/75/61/04/926756104.db2.gz XPNSQBBAROLOKL-QGZVFWFLSA-N 0 3 423.586 4.358 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)NCc1cccc(Cl)c1Cl ZINC000517653231 926760241 /nfs/dbraw/zinc/76/02/41/926760241.db2.gz BEXNYUHVDDUIIQ-UHFFFAOYSA-N 0 3 406.357 4.212 20 0 HIADHN Cc1ccc(-n2cc(C(=O)N(C)[C@H]3CCN(C4CC4)C3)c(-c3ccccc3)n2)cc1 ZINC000517694738 926797753 /nfs/dbraw/zinc/79/77/53/926797753.db2.gz LFDYQSOVDFHDDR-QFIPXVFZSA-N 0 3 400.526 4.156 20 0 HIADHN Cc1ccc(CNC(=O)N(CCN(C)C)Cc2ccc(Br)cc2)cc1 ZINC000517730666 926817035 /nfs/dbraw/zinc/81/70/35/926817035.db2.gz YAHAPUISVDBPLI-UHFFFAOYSA-N 0 3 404.352 4.031 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1c(C)cccc1C(=O)N1CCCC1)c1ccco1 ZINC000517768833 926828189 /nfs/dbraw/zinc/82/81/89/926828189.db2.gz PKSLBOYHMLYRIZ-PKOBYXMFSA-N 0 3 412.534 4.075 20 0 HIADHN C[C@@H](C(=O)NCCc1c[nH]c2ccccc12)N1CCC(CCc2ccc(O)cc2)CC1 ZINC000517827797 926854766 /nfs/dbraw/zinc/85/47/66/926854766.db2.gz ZBDTZFZNMMQNND-IBGZPJMESA-N 0 3 419.569 4.266 20 0 HIADHN O=C([C@H]1CCCN(Cc2cccc(F)c2)C1)N1CCC[C@@H]1c1ccc2c(c1)OCCO2 ZINC000517889126 926876507 /nfs/dbraw/zinc/87/65/07/926876507.db2.gz SGNKWKUASBYIHQ-RBBKRZOGSA-N 0 3 424.516 4.173 20 0 HIADHN Cc1nc2ccc(NC(=O)N(C)C3CCN(CCc4ccccn4)CC3)cc2s1 ZINC000517958766 926904155 /nfs/dbraw/zinc/90/41/55/926904155.db2.gz YTDFJXWTAAIOGE-UHFFFAOYSA-N 0 3 409.559 4.171 20 0 HIADHN CC(C)Oc1ccc(NC(=O)N(C)C2CCN(CCc3ccccn3)CC2)c(F)c1 ZINC000517967157 926910370 /nfs/dbraw/zinc/91/03/70/926910370.db2.gz ALZFQSBKLRNZAH-UHFFFAOYSA-N 0 3 414.525 4.179 20 0 HIADHN CC(=O)N1CCN(c2ccccc2CN[C@@H]2CCCc3c4ccccc4[nH]c32)CC1 ZINC000517999321 926940838 /nfs/dbraw/zinc/94/08/38/926940838.db2.gz PDJQQBLEBJGPTK-HSZRJFAPSA-N 0 3 402.542 4.004 20 0 HIADHN Cc1nn(Cc2ccccc2)c2sc(C(=O)N[C@H]3CCN(C4CCCC4)C3)cc12 ZINC000518045785 926984777 /nfs/dbraw/zinc/98/47/77/926984777.db2.gz CIPPCTUNVFDHFR-SFHVURJKSA-N 0 3 408.571 4.201 20 0 HIADHN Cc1cc(NC(=O)c2cccc(F)c2)sc1C(=O)NC[C@@H](C)N1CCC[C@@H](C)C1 ZINC000518054136 926990821 /nfs/dbraw/zinc/99/08/21/926990821.db2.gz OKLFSHODRFKQCL-GDBMZVCRSA-N 0 3 417.550 4.298 20 0 HIADHN O=C(N[C@H](COc1ccccc1)c1ccccc1)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000518070604 927006013 /nfs/dbraw/zinc/00/60/13/927006013.db2.gz IMWRQAPVHKCHMB-ILBGXUMGSA-N 0 3 415.537 4.230 20 0 HIADHN COc1ccc(SCCC(=O)NC[C@@H](c2ccc(SC)cc2)N(C)C)cc1 ZINC000518151941 927049125 /nfs/dbraw/zinc/04/91/25/927049125.db2.gz VNCNJIILDJEHGZ-FQEVSTJZSA-N 0 3 404.601 4.318 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1ccc(C(=O)NC(C)C)cc1C)c1ccsc1 ZINC000518171589 927061772 /nfs/dbraw/zinc/06/17/72/927061772.db2.gz BEQSDGRNXKVUFE-FQEVSTJZSA-N 0 3 416.591 4.399 20 0 HIADHN CC[C@H](C(=O)N1CCC(NCc2nc3ccccc3n2CC)CC1)c1ccccc1 ZINC000518273895 927130934 /nfs/dbraw/zinc/13/09/34/927130934.db2.gz NJWONJZDPUZEOK-NRFANRHFSA-N 0 3 404.558 4.331 20 0 HIADHN CC[C@@H](C(=O)N1CCC(NCc2nc3ccccc3n2CC)CC1)c1ccccc1 ZINC000518273896 927131663 /nfs/dbraw/zinc/13/16/63/927131663.db2.gz NJWONJZDPUZEOK-OAQYLSRUSA-N 0 3 404.558 4.331 20 0 HIADHN CCOc1ccc(NC(=O)N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)cc1Cl ZINC000518314401 927176706 /nfs/dbraw/zinc/17/67/06/927176706.db2.gz CCNJFCUELHYPAQ-IYBDPMFKSA-N 0 3 409.958 4.092 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)c1ccnc(Oc2ccccc2)c1 ZINC000518316577 927179875 /nfs/dbraw/zinc/17/98/75/927179875.db2.gz NQMBMZBJJGYBOQ-QFIPXVFZSA-N 0 3 416.525 4.396 20 0 HIADHN CCN1CCCC[C@H]1C(=O)N1CCc2c(cccc2NC(=O)Nc2ccccc2)C1 ZINC000518337077 927202020 /nfs/dbraw/zinc/20/20/20/927202020.db2.gz XVXNBEKDBSDRJX-QFIPXVFZSA-N 0 3 406.530 4.090 20 0 HIADHN C[C@@H](C(=O)NC[C@H]1CCN(c2ccc(F)cc2)C1)N1CCC(Cc2ccccc2)CC1 ZINC000518385892 927234250 /nfs/dbraw/zinc/23/42/50/927234250.db2.gz FKIVTSPXOSMWFV-NZQKXSOJSA-N 0 3 423.576 4.111 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)N2CCC(OCc3ccccc3)CC2)C1 ZINC000518402642 927243288 /nfs/dbraw/zinc/24/32/88/927243288.db2.gz KBHABCHJQXDZBI-NZQKXSOJSA-N 0 3 407.558 4.213 20 0 HIADHN CCCCCOc1ccc(C(=O)CCC(=O)N2CC[C@H](N3CCCCC3)C2)cc1 ZINC000518619625 927383568 /nfs/dbraw/zinc/38/35/68/927383568.db2.gz CCMQOEHMMBLUDL-NRFANRHFSA-N 0 3 400.563 4.305 20 0 HIADHN C[C@@H]1CCCCN1CCNC(=O)C(=O)Nc1ccccc1Oc1ccc(Cl)cc1 ZINC000518666427 927417454 /nfs/dbraw/zinc/41/74/54/927417454.db2.gz KBGRRCRBCACVMD-MRXNPFEDSA-N 0 3 415.921 4.061 20 0 HIADHN O=C([C@H]1CCCN1Cc1ccccc1)N1CCCN(Cc2ccc(Cl)cc2)CC1 ZINC000518763632 927481739 /nfs/dbraw/zinc/48/17/39/927481739.db2.gz GKLYMKVQYUDWMP-HSZRJFAPSA-N 0 3 411.977 4.039 20 0 HIADHN CCc1c(C(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)nnn1-c1cccc(Cl)c1 ZINC000518788218 927493115 /nfs/dbraw/zinc/49/31/15/927493115.db2.gz VMYRGEDRQFVHSE-LPHOPBHVSA-N 0 3 423.948 4.048 20 0 HIADHN O=C(N1CCC=C(c2ccncc2)C1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000518810492 927506013 /nfs/dbraw/zinc/50/60/13/927506013.db2.gz JYCUMAVLPPWCFJ-QFIPXVFZSA-N 0 3 415.459 4.152 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)NCCCc2cccc(C(F)(F)F)c2)o1 ZINC000518878648 927593593 /nfs/dbraw/zinc/59/35/93/927593593.db2.gz MAKYBCOSDLNBJP-UHFFFAOYSA-N 0 3 411.468 4.313 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1ccc(NC(N)=O)cc1)c1ccc(C(F)(F)F)cc1 ZINC000518890777 927603195 /nfs/dbraw/zinc/60/31/95/927603195.db2.gz GCTSEWPFVQLCIF-GOSISDBHSA-N 0 3 422.451 4.009 20 0 HIADHN O=C(Cc1csc(Cc2ccc(F)cc2)n1)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000518927211 927634919 /nfs/dbraw/zinc/63/49/19/927634919.db2.gz XMFXNAZFZFLZCY-QFIPXVFZSA-N 0 3 423.557 4.369 20 0 HIADHN CCN(CC)[C@H](CNC(=O)C(=O)Nc1cccc(C)c1)c1ccc(C(F)(F)F)cc1 ZINC000518940864 927643278 /nfs/dbraw/zinc/64/32/78/927643278.db2.gz PRBAPDYVBCOTIP-LJQANCHMSA-N 0 3 421.463 4.152 20 0 HIADHN C[C@H](CNC(=O)c1[nH]c2ccccc2c1Br)N(C)Cc1ccccc1 ZINC000518964479 927661471 /nfs/dbraw/zinc/66/14/71/927661471.db2.gz VCDRMLFVEKRZER-CQSZACIVSA-N 0 3 400.320 4.181 20 0 HIADHN COc1cccc(COC[C@@H](O)CN2CCC[C@H]2Cc2c(F)cccc2Cl)c1 ZINC000519000274 927683147 /nfs/dbraw/zinc/68/31/47/927683147.db2.gz CFPABCCJRGNBMJ-ROUUACIJSA-N 0 3 407.913 4.072 20 0 HIADHN COC(=O)c1cc(CN[C@@H](C)c2ccc(NC(=O)c3ccc(F)cc3)cc2)cn1C ZINC000519037246 927714049 /nfs/dbraw/zinc/71/40/49/927714049.db2.gz WPKHZJFOJKAAHJ-HNNXBMFYSA-N 0 3 409.461 4.054 20 0 HIADHN CN(C)[C@H](CNC(=O)c1ccccc1C(=O)c1ccc(Cl)c(Cl)c1)C1CC1 ZINC000519236705 927840864 /nfs/dbraw/zinc/84/08/64/927840864.db2.gz QBUOKDWBFXIVSM-LJQANCHMSA-N 0 3 405.325 4.294 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2ccc(C(=O)NC3CCCCC3)cc2)N(C)C)cc1 ZINC000519264288 927854929 /nfs/dbraw/zinc/85/49/29/927854929.db2.gz VYFBOJJRVPBULR-QHCPKHFHSA-N 0 3 422.573 4.482 20 0 HIADHN C[C@@H]1C[C@H]1C(=O)Nc1cccc(C(=O)NC[C@@H]2CCCCN2Cc2ccccc2)c1 ZINC000519271913 927858212 /nfs/dbraw/zinc/85/82/12/927858212.db2.gz XGFNBOOKZAURJB-YFXJRYMSSA-N 0 3 405.542 4.066 20 0 HIADHN Cc1nc(COc2ccc(F)cc2)sc1C(=O)NCCN1[C@@H](C)CCC[C@@H]1C ZINC000519360033 927896847 /nfs/dbraw/zinc/89/68/47/927896847.db2.gz IKGUPYCWXBAMRC-GJZGRUSLSA-N 0 3 405.539 4.162 20 0 HIADHN COc1cccc([C@@H](CNC(=O)NCCCc2c[nH]c3ccccc23)N2CCCC2)c1 ZINC000519379099 927904652 /nfs/dbraw/zinc/90/46/52/927904652.db2.gz MSEKCJAHHXAQES-XMMPIXPASA-N 0 3 420.557 4.245 20 0 HIADHN O=C(N[C@H](c1ccc(F)cc1)[C@@H]1CCCO1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000519421629 927937046 /nfs/dbraw/zinc/93/70/46/927937046.db2.gz OZIYIPSVMXZUQT-WTIAFYNJSA-N 0 3 414.496 4.213 20 0 HIADHN O=C(N[C@H]1CCOc2c(Cl)cccc21)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000519432594 927944649 /nfs/dbraw/zinc/94/46/49/927944649.db2.gz XIIYLJPHIUROGG-UZLBHIALSA-N 0 3 402.897 4.331 20 0 HIADHN Cc1ccc(Cc2nnc(NC(=O)N[C@@H](CN3CCCC3)c3ccccc3)s2)cc1 ZINC000519452310 927960630 /nfs/dbraw/zinc/96/06/30/927960630.db2.gz YJLPOYKGZHOPKL-FQEVSTJZSA-N 0 3 421.570 4.396 20 0 HIADHN COCCN(CCCc1ccccc1)C(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000519488742 927985746 /nfs/dbraw/zinc/98/57/46/927985746.db2.gz LNHSSKJWSAGQSO-ZJSXRUAMSA-N 0 3 409.574 4.113 20 0 HIADHN COCCN(CCCc1ccccc1)C(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000519488741 927985892 /nfs/dbraw/zinc/98/58/92/927985892.db2.gz LNHSSKJWSAGQSO-XUZZJYLKSA-N 0 3 409.574 4.113 20 0 HIADHN CCOc1ccc([C@@H](C)NC(=O)N(CCN(C)C)CC2CCCCC2)cc1OC ZINC000519723795 928058646 /nfs/dbraw/zinc/05/86/46/928058646.db2.gz NGONTDOZMLFJRK-GOSISDBHSA-N 0 3 405.583 4.308 20 0 HIADHN CCOCC(C)(C)CN[C@H](c1ccc(CC)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000519772757 928069062 /nfs/dbraw/zinc/06/90/62/928069062.db2.gz ALKHTNFQTPJVAQ-JOCHJYFZSA-N 0 3 403.588 4.394 20 0 HIADHN CN(C(=O)c1ccc(NCc2ccc(Br)s2)cc1)[C@H]1CCCN(C)C1 ZINC000519770413 928070362 /nfs/dbraw/zinc/07/03/62/928070362.db2.gz ZRDFJBUKYHDYQO-INIZCTEOSA-N 0 3 422.392 4.289 20 0 HIADHN CSc1ccc([C@H](CNC(=O)c2ccc3nc(C(F)(F)F)cn3c2)N(C)C)cc1 ZINC000519778716 928072487 /nfs/dbraw/zinc/07/24/87/928072487.db2.gz BIPDXXIUHSRBKU-INIZCTEOSA-N 0 3 422.476 4.108 20 0 HIADHN C[C@@H](NC(=O)[C@@H]1CCCN(Cc2cccnc2)C1)c1ccc(Oc2cccnc2)cc1 ZINC000519792705 928079510 /nfs/dbraw/zinc/07/95/10/928079510.db2.gz QHDKYOJQUKIABX-DENIHFKCSA-N 0 3 416.525 4.358 20 0 HIADHN Cc1cccc(C)c1NC(=O)CN[C@@H]1CCN(C(C)C)[C@H]1c1ccc(F)c(F)c1 ZINC000519835287 928087656 /nfs/dbraw/zinc/08/76/56/928087656.db2.gz FVVZZQLSAUFTKJ-OFNKIYASSA-N 0 3 401.501 4.334 20 0 HIADHN CCOc1ccc(CNC(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)cc1OC ZINC000519935414 928169295 /nfs/dbraw/zinc/16/92/95/928169295.db2.gz LKLOBYQGBWIVKQ-OAQYLSRUSA-N 0 3 411.546 4.039 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)Cc2csc(Cc3ccc(F)cc3)n2)C1 ZINC000519945058 928178241 /nfs/dbraw/zinc/17/82/41/928178241.db2.gz UGLSEEJKWJZCFC-DYESRHJHSA-N 0 3 423.557 4.367 20 0 HIADHN CN(C)[C@@H](CNC(=O)N(Cc1cccc(Br)c1)C1CC1)c1ccccc1 ZINC000520055404 928281386 /nfs/dbraw/zinc/28/13/86/928281386.db2.gz OPPMNSRLQQFUNT-FQEVSTJZSA-N 0 3 416.363 4.426 20 0 HIADHN Cc1nc(-c2ccc(C)cc2C)sc1C(=O)Nc1cnccc1N1CCN(C)CC1 ZINC000520092977 928304355 /nfs/dbraw/zinc/30/43/55/928304355.db2.gz SYWDGRADGXKGFZ-UHFFFAOYSA-N 0 3 421.570 4.134 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)Cc1csc(Cc2ccc(F)cc2)n1 ZINC000520105414 928314277 /nfs/dbraw/zinc/31/42/77/928314277.db2.gz KITMMWNKHLYOQP-UHFFFAOYSA-N 0 3 411.546 4.006 20 0 HIADHN CCOc1cc2c(cc1NC(=O)[C@H]1CCCN(Cc3cccc(F)c3)C1)O[C@@H](C)C2 ZINC000520106906 928315022 /nfs/dbraw/zinc/31/50/22/928315022.db2.gz RNPMVJUTEPPQOP-WMZOPIPTSA-N 0 3 412.505 4.399 20 0 HIADHN C[C@H]1C[C@H]1C(=O)Nc1ccc(C(=O)N(CCN(C)C)Cc2cccc(Cl)c2)cc1 ZINC000520106235 928315548 /nfs/dbraw/zinc/31/55/48/928315548.db2.gz MFHXCTJTMVFZHA-HRAATJIYSA-N 0 3 413.949 4.139 20 0 HIADHN C[C@@H]1C[C@H]1C(=O)Nc1ccc(C(=O)N(CCN(C)C)Cc2cccc(Cl)c2)cc1 ZINC000520106236 928315890 /nfs/dbraw/zinc/31/58/90/928315890.db2.gz MFHXCTJTMVFZHA-IIBYNOLFSA-N 0 3 413.949 4.139 20 0 HIADHN CC[C@H](NC(=O)N(CCN(C)C)Cc1ccc(F)c(F)c1)c1ccc(OC)cc1 ZINC000520128594 928327081 /nfs/dbraw/zinc/32/70/81/928327081.db2.gz XZHDUTXRCBYIMW-NRFANRHFSA-N 0 3 405.489 4.198 20 0 HIADHN COCCN1CCC(NC(=O)Nc2cccc(CO[C@H]3CCC[C@@H](C)C3)c2)CC1 ZINC000520132690 928329854 /nfs/dbraw/zinc/32/98/54/928329854.db2.gz PZTYJYLMOWETCE-GCJKJVERSA-N 0 3 403.567 4.014 20 0 HIADHN CCOc1cccc([C@H](C)NC(=O)NCCCCN2CCN(c3ccccc3)CC2)c1 ZINC000520135870 928333203 /nfs/dbraw/zinc/33/32/03/928333203.db2.gz VBLPNYFYYNORSS-NRFANRHFSA-N 0 3 424.589 4.048 20 0 HIADHN CN(CCCc1cc(-c2cccc(F)c2)n[nH]1)C(=O)[C@@H]1CCCN1Cc1ccccc1 ZINC000520146906 928341939 /nfs/dbraw/zinc/34/19/39/928341939.db2.gz PWVOTPYMRWYDHL-DEOSSOPVSA-N 0 3 420.532 4.271 20 0 HIADHN CCN(Cc1ccc(C)cc1)C(=O)NCCCCN1CCN(c2ccccc2)CC1 ZINC000520160539 928354359 /nfs/dbraw/zinc/35/43/59/928354359.db2.gz XTZINGZYVPIOFT-UHFFFAOYSA-N 0 3 408.590 4.129 20 0 HIADHN CC(=O)Nc1ccc(OC[C@@H](O)CN(C)[C@H](C)c2ccc(Cl)c(Cl)c2)cc1 ZINC000520173257 928361524 /nfs/dbraw/zinc/36/15/24/928361524.db2.gz ZZZNLKUOQGURRD-DYVFJYSZSA-N 0 3 411.329 4.385 20 0 HIADHN CCN(CC)CC(=O)N[C@H](c1ccccc1)c1ccc2[nH]c(C(F)(F)F)nc2c1 ZINC000520188923 928377293 /nfs/dbraw/zinc/37/72/93/928377293.db2.gz PEIRWAGZKPBIEY-LJQANCHMSA-N 0 3 404.436 4.129 20 0 HIADHN CCN(CC)CC(=O)N[C@H](c1ccccc1)c1ccc2nc(C(F)(F)F)[nH]c2c1 ZINC000520188923 928377298 /nfs/dbraw/zinc/37/72/98/928377298.db2.gz PEIRWAGZKPBIEY-LJQANCHMSA-N 0 3 404.436 4.129 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)Nc3ccc(Cl)c(Cl)c3)CC2)C[C@H](C)O1 ZINC000520265012 928430156 /nfs/dbraw/zinc/43/01/56/928430156.db2.gz HIRLTTSIUORXME-KBPBESRZSA-N 0 3 400.350 4.347 20 0 HIADHN Cc1cccc(-c2nn(-c3ccc(F)cc3)cc2C(=O)N(C)[C@H]2CCN(C3CC3)C2)c1 ZINC000520318673 928480217 /nfs/dbraw/zinc/48/02/17/928480217.db2.gz AVIOGDKPXYHPDV-QFIPXVFZSA-N 0 3 418.516 4.296 20 0 HIADHN Cc1c(Br)cccc1NC(=O)CCCN1CCN(c2ccccc2)CC1 ZINC000520328694 928492673 /nfs/dbraw/zinc/49/26/73/928492673.db2.gz BPEQWRKJUXKOPR-UHFFFAOYSA-N 0 3 416.363 4.298 20 0 HIADHN Brc1cccc(OCCSCCNCc2cccc3c2OCCO3)c1 ZINC000520389490 928540824 /nfs/dbraw/zinc/54/08/24/928540824.db2.gz UFKBMZZOXHLVEK-UHFFFAOYSA-N 0 3 424.360 4.122 20 0 HIADHN Cc1ccncc1CCCNCc1ccc(Cl)cc1I ZINC000520459724 928578273 /nfs/dbraw/zinc/57/82/73/928578273.db2.gz FYGDCRLFAYCTFU-UHFFFAOYSA-N 0 3 400.691 4.370 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N(C)C[C@H]1CCCCO1)c1ccc(C(F)(F)F)cc1 ZINC000520474205 928587109 /nfs/dbraw/zinc/58/71/09/928587109.db2.gz WDUAQBJBQASEKZ-MOPGFXCFSA-N 0 3 415.500 4.299 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)NCc2nc(C(C)(C)C)cs2)N2CCCC2)cc1 ZINC000520622095 928679809 /nfs/dbraw/zinc/67/98/09/928679809.db2.gz WTWAOTITBYWEAX-GOSISDBHSA-N 0 3 400.592 4.385 20 0 HIADHN Cc1sc2nc(C)nc(SCC(=O)NCCN3[C@@H](C)CCC[C@@H]3C)c2c1C ZINC000520761912 928806270 /nfs/dbraw/zinc/80/62/70/928806270.db2.gz HMTKYXOFYWVKDL-STQMWFEESA-N 0 3 406.621 4.088 20 0 HIADHN COC1CCN(C(C)(C)CNC(=O)c2ccccc2OCc2ccc(F)cc2)CC1 ZINC000520769935 928809027 /nfs/dbraw/zinc/80/90/27/928809027.db2.gz NTRJWDUVTJNLAX-UHFFFAOYSA-N 0 3 414.521 4.024 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2cc(F)ccc2OC[C@@H]2CCCO2)N(C)C)cc1 ZINC000520786767 928817527 /nfs/dbraw/zinc/81/75/27/928817527.db2.gz HGJQCOFAKNMKQO-FPOVZHCZSA-N 0 3 415.509 4.116 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)NCc1ccc(Br)s1 ZINC000520820719 928832207 /nfs/dbraw/zinc/83/22/07/928832207.db2.gz VKXLDCLWPHCNMU-UHFFFAOYSA-N 0 3 424.408 4.217 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2cc(N3CCCC3=O)ccc2Cl)N(C)C)cc1 ZINC000520830261 928835883 /nfs/dbraw/zinc/83/58/83/928835883.db2.gz XJPNDHVSCUECRO-HXUWFJFHSA-N 0 3 414.937 4.200 20 0 HIADHN CCOC(=O)c1ccn(-c2cccc(CNCc3cc(F)cc4cccnc43)c2)n1 ZINC000520893511 928864320 /nfs/dbraw/zinc/86/43/20/928864320.db2.gz WRYLUIOBBHGEFH-UHFFFAOYSA-N 0 3 404.445 4.026 20 0 HIADHN COc1ccc(CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)[C@H](C)C2CC2)cc1 ZINC000520905995 928868482 /nfs/dbraw/zinc/86/84/82/928868482.db2.gz NYHKTVRBMQWJPH-XXBNENTESA-N 0 3 407.558 4.280 20 0 HIADHN COc1ccc(CN(C(=O)NCCCN2CCc3ccccc3C2)[C@@H](C)C2CC2)cc1 ZINC000520909293 928869747 /nfs/dbraw/zinc/86/97/47/928869747.db2.gz NJVDFGKPJZOCTH-FQEVSTJZSA-N 0 3 421.585 4.454 20 0 HIADHN Cc1cccc([C@@H](CNCc2cc(Br)ccc2F)N2CCOCC2)c1 ZINC000520946896 928885630 /nfs/dbraw/zinc/88/56/30/928885630.db2.gz SPESYFJEGDWLGX-HXUWFJFHSA-N 0 3 407.327 4.060 20 0 HIADHN O[C@H](CNCc1ccc(F)c(Br)c1)COc1cccc(Cl)c1Cl ZINC000520960863 928890903 /nfs/dbraw/zinc/89/09/03/928890903.db2.gz WOLMUKHOHQMRRB-LLVKDONJSA-N 0 3 423.109 4.425 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)N(CCN(C)C)Cc2cccc(C)c2)c(Cl)c1 ZINC000520985131 928903419 /nfs/dbraw/zinc/90/34/19/928903419.db2.gz FDANLYGIMSNWHE-UHFFFAOYSA-N 0 3 402.926 4.203 20 0 HIADHN CC(=O)c1ccc(CC(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)cc1 ZINC000520989247 928906076 /nfs/dbraw/zinc/90/60/76/928906076.db2.gz ZHFYPDXTBNIFPX-UHFFFAOYSA-N 0 3 406.448 4.041 20 0 HIADHN O=C(NCc1csc(-c2ccccc2)n1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000520994014 928911398 /nfs/dbraw/zinc/91/13/98/928911398.db2.gz NOQWDJFFDVVNDK-IBGZPJMESA-N 0 3 409.530 4.478 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)Nc3cccc(-c4nccs4)c3)CC2)C[C@H](C)O1 ZINC000521007351 928922395 /nfs/dbraw/zinc/92/23/95/928922395.db2.gz KBWBIXFZLPYZCL-IRXDYDNUSA-N 0 3 414.575 4.163 20 0 HIADHN CCN1CCCC[C@@H]1C(=O)N1CCc2c(cccc2NC(=O)Nc2ccc(C)cc2)C1 ZINC000521038498 928954098 /nfs/dbraw/zinc/95/40/98/928954098.db2.gz QEXPGNYCWUKWMJ-HSZRJFAPSA-N 0 3 420.557 4.398 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)NCc1cc2c(s1)CCCC2 ZINC000521070308 928972096 /nfs/dbraw/zinc/97/20/96/928972096.db2.gz OWDRTZSKDPLBQT-UHFFFAOYSA-N 0 3 407.530 4.179 20 0 HIADHN O=C(NC[C@@H]1CCc2ccccc21)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000521082982 928980760 /nfs/dbraw/zinc/98/07/60/928980760.db2.gz KVRVTXDTMHBXTD-UGKGYDQZSA-N 0 3 402.460 4.287 20 0 HIADHN O=C(NC[C@H]1CCc2ccccc21)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000521082979 928981158 /nfs/dbraw/zinc/98/11/58/928981158.db2.gz KVRVTXDTMHBXTD-DENIHFKCSA-N 0 3 402.460 4.287 20 0 HIADHN CCOc1ncccc1-c1noc([C@H]2CN(Cc3ccccc3)CCC2(F)F)n1 ZINC000521110935 929001961 /nfs/dbraw/zinc/00/19/61/929001961.db2.gz GLIJCKNVLMGGEX-QGZVFWFLSA-N 0 3 400.429 4.155 20 0 HIADHN CN(C)CCN(C(=O)c1csc(-c2cnn(-c3ccccc3)c2)n1)C1CCCCC1 ZINC000521148707 929026114 /nfs/dbraw/zinc/02/61/14/929026114.db2.gz LKZIAQSCTTVQAB-UHFFFAOYSA-N 0 3 423.586 4.332 20 0 HIADHN CC[C@H](CNC(=O)N(CCOC)[C@H](C)c1ccccc1)N1CCc2ccccc2C1 ZINC000521167294 929039551 /nfs/dbraw/zinc/03/95/51/929039551.db2.gz STDNJRBHLAWARS-HYBUGGRVSA-N 0 3 409.574 4.243 20 0 HIADHN C[C@@H](C1CC1)N(CC(=O)NCC1(c2ccccc2)CCOCC1)Cc1ccccc1 ZINC000521194305 929054275 /nfs/dbraw/zinc/05/42/75/929054275.db2.gz HFWVSZMJKGJGNF-NRFANRHFSA-N 0 3 406.570 4.152 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCc3c(F)cccc3Cl)c(C)c2)CC1 ZINC000521197215 929056863 /nfs/dbraw/zinc/05/68/63/929056863.db2.gz ACGQUDWTULBYTL-UHFFFAOYSA-N 0 3 404.917 4.251 20 0 HIADHN COc1cc(CN(C)C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)ccc1SC ZINC000521205674 929060171 /nfs/dbraw/zinc/06/01/71/929060171.db2.gz XMKFFRVLVXSJCG-FQEVSTJZSA-N 0 3 413.587 4.223 20 0 HIADHN Cn1cc(C(=O)N2CCN(CC3CCCCC3)CC2)c(-c2ccccc2Cl)n1 ZINC000521283556 929099136 /nfs/dbraw/zinc/09/91/36/929099136.db2.gz NJYLAQNKQSBMJU-UHFFFAOYSA-N 0 3 400.954 4.079 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)Nc3cccc(Br)c3)cc2)CC1 ZINC000521315029 929127859 /nfs/dbraw/zinc/12/78/59/929127859.db2.gz IMMBYTXFZWAALU-UHFFFAOYSA-N 0 3 402.336 4.232 20 0 HIADHN CC1CCN(C(=O)CN(C)CCCCCc2cc(-c3ccc(F)cc3)n[nH]2)CC1 ZINC000521349429 929168706 /nfs/dbraw/zinc/16/87/06/929168706.db2.gz FXTMRNMZNWXMGM-UHFFFAOYSA-N 0 3 400.542 4.119 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)N(C1CC1)[C@H]1CCc2ccccc21 ZINC000521358825 929180799 /nfs/dbraw/zinc/18/07/99/929180799.db2.gz ASMIGJOBAWKPAA-VWLOTQADSA-N 0 3 403.570 4.267 20 0 HIADHN O=C(CN1CCCCC[C@H]1c1ccccc1)NCc1ccc(C(=O)N2CCCC2)cc1 ZINC000521425080 929217176 /nfs/dbraw/zinc/21/71/76/929217176.db2.gz HOEQLGRVIIHYTG-DEOSSOPVSA-N 0 3 419.569 4.156 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)N[C@@H](c1ccc(F)cc1)[C@@H]1CCCO1 ZINC000521456296 929229841 /nfs/dbraw/zinc/22/98/41/929229841.db2.gz ZCDYNJFJGUFDBQ-VJBWXMMDSA-N 0 3 411.521 4.182 20 0 HIADHN Cc1ccc(NC(=O)N2CCN(CC3CCCCC3)CC2)c(OC[C@@H]2CCCO2)c1 ZINC000521461902 929232510 /nfs/dbraw/zinc/23/25/10/929232510.db2.gz POJHONZSNHTNGR-NRFANRHFSA-N 0 3 415.578 4.283 20 0 HIADHN CN(C)CCN(CC1CCCCC1)C(=O)CCCc1nc(-c2ccc(F)cc2)no1 ZINC000521477059 929239754 /nfs/dbraw/zinc/23/97/54/929239754.db2.gz NUJFIYZPTAFAJN-UHFFFAOYSA-N 0 3 416.541 4.169 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N(Cc2cccs2)C[C@@H]2CCCO2)N(C)C)cc1 ZINC000521511024 929263250 /nfs/dbraw/zinc/26/32/50/929263250.db2.gz NKDMTRQMIZCRAC-PZJWPPBQSA-N 0 3 401.576 4.050 20 0 HIADHN CC(C)Sc1ccc(Cl)cc1NC(=O)C(=O)N[C@H](C)CN1CCC[C@@H](C)C1 ZINC000521545411 929287345 /nfs/dbraw/zinc/28/73/45/929287345.db2.gz MWFSELFNLYLMHU-HUUCEWRRSA-N 0 3 411.999 4.016 20 0 HIADHN O=C(Nc1ccc(OC[C@H]2CCCO2)cc1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000521597592 929319040 /nfs/dbraw/zinc/31/90/40/929319040.db2.gz HEECASVLBXLGSX-WMZHIEFXSA-N 0 3 412.505 4.234 20 0 HIADHN COC(=O)c1cc2cc(NC(=O)[C@H]3CCCN(Cc4cccc(F)c4)C3)ccc2o1 ZINC000521601891 929322918 /nfs/dbraw/zinc/32/29/18/929322918.db2.gz LVTILRAPCSVKSX-INIZCTEOSA-N 0 3 410.445 4.209 20 0 HIADHN Brc1cc(CNC[C@H](c2ccco2)N2CCCCC2)cc2c1OCCO2 ZINC000521678579 929361786 /nfs/dbraw/zinc/36/17/86/929361786.db2.gz REEHBHPYHUGIEH-QGZVFWFLSA-N 0 3 421.335 4.130 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)NC1CCN(c2ccccc2)CC1 ZINC000521686211 929367203 /nfs/dbraw/zinc/36/72/03/929367203.db2.gz YPTDUVNGECFVED-UHFFFAOYSA-N 0 3 414.981 4.082 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)c2cn(C)nc2-c2ccccc2Cl)C1 ZINC000521751672 929412691 /nfs/dbraw/zinc/41/26/91/929412691.db2.gz BJCPBUXIZHHWGC-FUHWJXTLSA-N 0 3 408.933 4.306 20 0 HIADHN CC1(C)CN(C2(CNC(=O)Nc3cccc(OC(F)F)c3)CCCCC2)CCO1 ZINC000521786420 929445765 /nfs/dbraw/zinc/44/57/65/929445765.db2.gz YGYKOLYVRYHZAA-UHFFFAOYSA-N 0 3 411.493 4.223 20 0 HIADHN O=C(CN1CCCCC[C@H]1c1ccccc1)NCC1(c2ccccc2)CCOCC1 ZINC000521814556 929472662 /nfs/dbraw/zinc/47/26/62/929472662.db2.gz CCUSLZWYEMUDKQ-DEOSSOPVSA-N 0 3 406.570 4.468 20 0 HIADHN O[C@@H](CNCc1c(OC(F)F)ccc2ccccc21)COc1ccc(F)c(F)c1 ZINC000521829165 929482001 /nfs/dbraw/zinc/48/20/01/929482001.db2.gz SZKZIMBPBUVVNH-AWEZNQCLSA-N 0 3 409.379 4.249 20 0 HIADHN O=S(=O)(NCCNCc1ccc(-c2ccccc2Cl)s1)c1ccccc1 ZINC000521833702 929486229 /nfs/dbraw/zinc/48/62/29/929486229.db2.gz FJTFNHMQHKXMGL-UHFFFAOYSA-N 0 3 406.960 4.137 20 0 HIADHN CC(C)CCOc1cccc(NC(=O)N2CCC(CN3C[C@@H](C)O[C@H](C)C3)CC2)c1 ZINC000521876074 929524102 /nfs/dbraw/zinc/52/41/02/929524102.db2.gz ZPQMAFZQJFADLT-WOJBJXKFSA-N 0 3 417.594 4.465 20 0 HIADHN Cc1ccnc(NC(=O)N(Cc2ccccc2Br)C2CCN(C)CC2)c1 ZINC000521943177 929578647 /nfs/dbraw/zinc/57/86/47/929578647.db2.gz OCPOUYPGHIAFCG-UHFFFAOYSA-N 0 3 417.351 4.281 20 0 HIADHN CCN1CC[C@H](NCC(=O)Nc2c(C)cccc2C)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000522008812 929617360 /nfs/dbraw/zinc/61/73/60/929617360.db2.gz ZXRWWCJHRBWTMJ-PGRDOPGGSA-N 0 3 405.464 4.084 20 0 HIADHN COC(=O)c1cc2cc(NC(=O)NC[C@@H]3CCCN3Cc3ccccc3)ccc2o1 ZINC000524480953 929630718 /nfs/dbraw/zinc/63/07/18/929630718.db2.gz BFEXDUMKMNYRIN-IBGZPJMESA-N 0 3 407.470 4.006 20 0 HIADHN CCCN(Cc1csc(C(=O)OCC)n1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000524540239 929672871 /nfs/dbraw/zinc/67/28/71/929672871.db2.gz DOAGLXMQOPUPNW-HXUWFJFHSA-N 0 3 401.576 4.196 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1ccc(=O)n(CC)c1)c1ccc(C(F)(F)F)cc1 ZINC000524546286 929676965 /nfs/dbraw/zinc/67/69/65/929676965.db2.gz KGQSLVQEHUEZRZ-SFHVURJKSA-N 0 3 424.467 4.092 20 0 HIADHN CC1CCC(N2CCN(C(=O)c3cn(C)nc3-c3ccccc3Cl)CC2)CC1 ZINC000524546183 929677189 /nfs/dbraw/zinc/67/71/89/929677189.db2.gz ZCLGRGNXUAKLNO-UHFFFAOYSA-N 0 3 400.954 4.077 20 0 HIADHN CN(C(=O)c1ccccc1Oc1cccc(Br)c1)[C@H]1CCCN(C)C1 ZINC000524653414 929766120 /nfs/dbraw/zinc/76/61/20/929766120.db2.gz YGLLHEGEBMQPAR-INIZCTEOSA-N 0 3 403.320 4.408 20 0 HIADHN C[C@@H]1CCN(CCNC(=O)c2cccnc2Sc2ccc(Br)cc2)C1 ZINC000524719792 929809434 /nfs/dbraw/zinc/80/94/34/929809434.db2.gz LBVJERQQGUVYPK-CQSZACIVSA-N 0 3 420.376 4.067 20 0 HIADHN COc1ccc(CC[C@@H](C)NC(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)cc1 ZINC000524882174 929871273 /nfs/dbraw/zinc/87/12/73/929871273.db2.gz IWAQSBDNNVSHMA-RTWAWAEBSA-N 0 3 409.574 4.322 20 0 HIADHN CCCOc1c(Br)cc(Br)cc1CNC[C@@H](O)C(C)C ZINC000524889032 929875107 /nfs/dbraw/zinc/87/51/07/929875107.db2.gz GDOSZAIQADGPLW-CQSZACIVSA-N 0 3 409.162 4.107 20 0 HIADHN CCC(=O)Nc1ccc(C)c(NC(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)c1 ZINC000524897088 929878094 /nfs/dbraw/zinc/87/80/94/929878094.db2.gz JQPDAWOBGAYFSA-IBGZPJMESA-N 0 3 408.546 4.472 20 0 HIADHN CC(C)C(=O)Nc1cccc(NC(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)c1 ZINC000524928124 929894862 /nfs/dbraw/zinc/89/48/62/929894862.db2.gz LAQSESLLPLSJFW-IBGZPJMESA-N 0 3 408.546 4.409 20 0 HIADHN CCCNC(=O)c1cccc(C(=O)N(CC)[C@@H]2CCN([C@H](C)c3ccccc3)C2)c1 ZINC000524939924 929900948 /nfs/dbraw/zinc/90/09/48/929900948.db2.gz CQMCJZFMTYGNKV-AUSIDOKSSA-N 0 3 407.558 4.124 20 0 HIADHN O=C(NC[C@@]1(O)CCN(Cc2ccccc2)C1)Nc1ccc(Oc2ccccc2)cc1 ZINC000524994094 929962156 /nfs/dbraw/zinc/96/21/56/929962156.db2.gz NHJVBJULJOSSRH-VWLOTQADSA-N 0 3 417.509 4.237 20 0 HIADHN O=C(N[C@@H]1C[C@H]1Cc1ccccc1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000525009449 929971000 /nfs/dbraw/zinc/97/10/00/929971000.db2.gz QVKOURNWHPFPCT-SJBKTWHCSA-N 0 3 402.460 4.188 20 0 HIADHN C[C@@H](CNC(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1)Cc1cccs1 ZINC000525016460 929976567 /nfs/dbraw/zinc/97/65/67/929976567.db2.gz MHZSLHUXCPVHIZ-UZLBHIALSA-N 0 3 410.505 4.498 20 0 HIADHN C[C@@H](CNC(=O)Cc1ccc(NC(=O)CC(C)(C)C)cc1)N(C)Cc1ccccc1 ZINC000525049304 930002911 /nfs/dbraw/zinc/00/29/11/930002911.db2.gz NFHCXAMWLGLFKY-IBGZPJMESA-N 0 3 409.574 4.241 20 0 HIADHN CN(C)c1nc2sc(C(=O)NC[C@@H]3CCCN(C)[C@H]3c3cccs3)cc2s1 ZINC000525057808 930008156 /nfs/dbraw/zinc/00/81/56/930008156.db2.gz TZLIVOPRNQMTSH-BLLLJJGKSA-N 0 3 420.629 4.298 20 0 HIADHN Cc1ccc2oc(C(=O)Nc3ccc(C(=O)N(C)[C@@H]4CCCN(C)C4)cc3)cc2c1 ZINC000525065421 930012798 /nfs/dbraw/zinc/01/27/98/930012798.db2.gz WDDCKLQFEQCURW-HXUWFJFHSA-N 0 3 405.498 4.160 20 0 HIADHN Cc1ccc2oc(C(=O)Nc3ccc(C(=O)N(C)[C@H]4CCCN(C)C4)cc3)cc2c1 ZINC000525065420 930013017 /nfs/dbraw/zinc/01/30/17/930013017.db2.gz WDDCKLQFEQCURW-FQEVSTJZSA-N 0 3 405.498 4.160 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2ccc(C(F)(F)F)cc2)cc1)[C@@H]1CCCN(C)C1 ZINC000525065970 930013484 /nfs/dbraw/zinc/01/34/84/930013484.db2.gz FKMUIYFVEXHEJX-LJQANCHMSA-N 0 3 419.447 4.124 20 0 HIADHN CN(C)CCN(CC1CCCCC1)C(=O)c1cccc(C(=O)N(C)CC(C)(C)C)c1 ZINC000525068908 930016015 /nfs/dbraw/zinc/01/60/15/930016015.db2.gz PCCIOZGZDIPMTR-UHFFFAOYSA-N 0 3 415.622 4.389 20 0 HIADHN Cc1ccc(Oc2ccc(NC(=O)[C@]3(O)CCN(Cc4ccccc4)C3)cn2)cc1C ZINC000525176882 930076741 /nfs/dbraw/zinc/07/67/41/930076741.db2.gz RMCCOISPLZBPJY-VWLOTQADSA-N 0 3 417.509 4.066 20 0 HIADHN O=C(Nc1ccccc1OCC(F)(F)F)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000525225652 930093250 /nfs/dbraw/zinc/09/32/50/930093250.db2.gz ITAFLKINMDCUFA-KRWDZBQOSA-N 0 3 407.436 4.414 20 0 HIADHN C[C@@H](CC(=O)c1cccc(Br)c1)C(=O)NCC(C)(C)N1CCC[C@H](C)C1 ZINC000525241150 930101325 /nfs/dbraw/zinc/10/13/25/930101325.db2.gz SJKFOMKIPVBOAC-HOTGVXAUSA-N 0 3 423.395 4.285 20 0 HIADHN C[C@H](N[C@@H](C)c1cccc2ccccc21)C(=O)NCCc1ccc2c(c1)OCCO2 ZINC000525248809 930105805 /nfs/dbraw/zinc/10/58/05/930105805.db2.gz AVQOJTNXUGGZKA-ROUUACIJSA-N 0 3 404.510 4.009 20 0 HIADHN Cc1nc(-c2ccco2)ccc1C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000525330543 930167841 /nfs/dbraw/zinc/16/78/41/930167841.db2.gz OBEDICNZRQFNJW-UHFFFAOYSA-N 0 3 423.488 4.062 20 0 HIADHN C[C@H](CC(=O)NC1CCN(CCOc2ccc(F)cc2)CC1)c1ccc(F)cc1 ZINC000525332088 930168578 /nfs/dbraw/zinc/16/85/78/930168578.db2.gz PQPDYICCJKGVNI-QGZVFWFLSA-N 0 3 402.485 4.118 20 0 HIADHN O=C(COc1ccc2ccccc2c1)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000525334292 930170825 /nfs/dbraw/zinc/17/08/25/930170825.db2.gz WSDFRXONKGVBLM-UHFFFAOYSA-N 0 3 422.500 4.017 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)NCc1ccccc1OCC1CC1 ZINC000525399122 930218282 /nfs/dbraw/zinc/21/82/82/930218282.db2.gz ADUDHVTXFRZFDE-HXUWFJFHSA-N 0 3 407.558 4.281 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1ccc(OC[C@@H]2CCCO2)cc1 ZINC000525412466 930225364 /nfs/dbraw/zinc/22/53/64/930225364.db2.gz AQJKYHFSJTWIRS-YKSBVNFPSA-N 0 3 423.557 4.373 20 0 HIADHN CC(=O)Nc1ccc(Cl)c(NC(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)c1 ZINC000525416659 930228292 /nfs/dbraw/zinc/22/82/92/930228292.db2.gz SNOSJBLDSWLTJI-MRXNPFEDSA-N 0 3 414.937 4.427 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)N[C@H]1C[C@H]1c1c(F)cccc1Cl ZINC000525423508 930232866 /nfs/dbraw/zinc/23/28/66/930232866.db2.gz AVTRGSNFOOSCKK-NQIIRXRSSA-N 0 3 415.940 4.054 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)NCCCc1c[nH]c2ccccc12 ZINC000525437388 930239472 /nfs/dbraw/zinc/23/94/72/930239472.db2.gz MBORRZCOJNEYTL-FQEVSTJZSA-N 0 3 404.558 4.407 20 0 HIADHN O=C(N[C@@H]1CCN(Cc2ccccc2)C1)[C@@H]1C[C@@H]1c1ccccc1OC(F)(F)F ZINC000525474505 930265081 /nfs/dbraw/zinc/26/50/81/930265081.db2.gz CLAWPHIQWVNYJF-BHIYHBOVSA-N 0 3 404.432 4.079 20 0 HIADHN CCc1ccc(Cl)c(CC)c1NC(=O)NC[C@]1(O)CCN(Cc2ccccc2)C1 ZINC000525510086 930293404 /nfs/dbraw/zinc/29/34/04/930293404.db2.gz XHXGLPVQULDJDE-HSZRJFAPSA-N 0 3 415.965 4.223 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cnc(-c2ccncc2)s1)c1cccc(OC)c1 ZINC000525579049 930341846 /nfs/dbraw/zinc/34/18/46/930341846.db2.gz XCSICACACWWLRA-LJQANCHMSA-N 0 3 410.543 4.027 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)Cc2cccc3ccccc32)cc1)[C@H]1CCCN(C)C1 ZINC000525580438 930343718 /nfs/dbraw/zinc/34/37/18/930343718.db2.gz UUHAWFOSVFYNJZ-QHCPKHFHSA-N 0 3 415.537 4.187 20 0 HIADHN CCCCOc1ccc(C(=O)Nc2ccc(C(=O)N(C)[C@@H]3CCCN(C)C3)cc2)cc1 ZINC000525581907 930344072 /nfs/dbraw/zinc/34/40/72/930344072.db2.gz WANRWQQRROUQEN-JOCHJYFZSA-N 0 3 423.557 4.284 20 0 HIADHN CN(C(=O)c1ccccc1Sc1ccc(Br)cn1)[C@@H]1CCCN(C)C1 ZINC000525618889 930365550 /nfs/dbraw/zinc/36/55/50/930365550.db2.gz JWDKNUORCGBZAN-OAHLLOKOSA-N 0 3 420.376 4.162 20 0 HIADHN CCCN(CC(=O)Nc1cccc(NC(C)=O)c1)[C@H]1C[C@@H](OCC)C12CCCCC2 ZINC000525640053 930377775 /nfs/dbraw/zinc/37/77/75/930377775.db2.gz NMKUPZLFHLRARD-FCHUYYIVSA-N 0 3 415.578 4.423 20 0 HIADHN CC[C@@H](Cc1ccccc1)N(C)CC(=O)N1CCC[C@@H]1c1cc(OC)ccc1OC ZINC000525638573 930378247 /nfs/dbraw/zinc/37/82/47/930378247.db2.gz RTJFYBVWCNMZFL-NZQKXSOJSA-N 0 3 410.558 4.320 20 0 HIADHN CC(C)c1c(C(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)cnn1-c1ccccn1 ZINC000525774995 930440408 /nfs/dbraw/zinc/44/04/08/930440408.db2.gz VGELGBSENCIPPK-FQEVSTJZSA-N 0 3 417.557 4.127 20 0 HIADHN CCCN(CC(F)(F)F)C(=O)[C@H]1CCCN(Cc2ccc(SC)c(OC)c2)C1 ZINC000525779195 930441760 /nfs/dbraw/zinc/44/17/60/930441760.db2.gz HNCDWWNWPZTXPJ-INIZCTEOSA-N 0 3 418.525 4.430 20 0 HIADHN CC(C)OCc1ccccc1CNC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1 ZINC000525811053 930453163 /nfs/dbraw/zinc/45/31/63/930453163.db2.gz ZHNGTLFOHSFVSF-NRFANRHFSA-N 0 3 409.574 4.418 20 0 HIADHN C[C@H](CN[C@H](C(N)=O)c1ccc(Br)cc1)c1ccc(C(F)(F)F)cc1 ZINC000525951891 930492935 /nfs/dbraw/zinc/49/29/35/930492935.db2.gz ISLHTVOLDINLFQ-BZNIZROVSA-N 0 3 415.253 4.388 20 0 HIADHN CC[C@H](N[C@H]1CCC[C@H](S(C)(=O)=O)C1)c1ccc(Br)cc1Cl ZINC000526117033 930538440 /nfs/dbraw/zinc/53/84/40/930538440.db2.gz PQQBJLXWOJPRJM-XEZPLFJOSA-N 0 3 408.789 4.499 20 0 HIADHN CC[C@H](N[C@@H]1CCC[C@@H](S(C)(=O)=O)C1)c1ccc(Br)cc1Cl ZINC000526117031 930538698 /nfs/dbraw/zinc/53/86/98/930538698.db2.gz PQQBJLXWOJPRJM-IOASZLSFSA-N 0 3 408.789 4.499 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)N[C@H]2CCCN(Cc3ccc(F)cc3F)C2=O)cc1 ZINC000527039980 930574263 /nfs/dbraw/zinc/57/42/63/930574263.db2.gz RTRMGGOXWCUTEG-MWTRTKDXSA-N 0 3 424.495 4.301 20 0 HIADHN COc1ccc([C@H](C)[C@@H](C)Nc2ccc3nc(CCN4CCOCC4)[nH]c3c2)cc1 ZINC000527233215 930617431 /nfs/dbraw/zinc/61/74/31/930617431.db2.gz VXMLBFFEAMDELB-QZTJIDSGSA-N 0 3 408.546 4.050 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CN[C@@H](CCn1cncn1)c1ccc(C)cc1 ZINC000527348616 930643231 /nfs/dbraw/zinc/64/32/31/930643231.db2.gz CPFVTUSNFKZTLI-DEOSSOPVSA-N 0 3 400.530 4.310 20 0 HIADHN Cc1ccc([C@H]2CCN(C(=O)NC3CC(N4CCC(C(F)(F)F)CC4)C3)C2)cc1 ZINC000527461484 930660533 /nfs/dbraw/zinc/66/05/33/930660533.db2.gz VVEXRSFJDOCPHL-KKXNLOMOSA-N 0 3 409.496 4.299 20 0 HIADHN CC1CCN(C(=O)c2ccc(NC(=O)N[C@@H]3CCN(C)[C@@H]3c3ccccc3)cc2)CC1 ZINC000530356889 930691503 /nfs/dbraw/zinc/69/15/03/930691503.db2.gz ONECKZMPWXJEIL-DHIUTWEWSA-N 0 3 420.557 4.126 20 0 HIADHN CC1CCN(C(=O)c2ccc(NC(=O)N[C@H]3CCN(C)[C@@H]3c3ccccc3)cc2)CC1 ZINC000530356892 930692687 /nfs/dbraw/zinc/69/26/87/930692687.db2.gz ONECKZMPWXJEIL-XZOQPEGZSA-N 0 3 420.557 4.126 20 0 HIADHN COc1cc(Br)cc(C)c1NC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000530409445 930703234 /nfs/dbraw/zinc/70/32/34/930703234.db2.gz CZYMVVLOQBXPPX-QFBILLFUSA-N 0 3 418.335 4.333 20 0 HIADHN Cc1cc(C)n(-c2ccc(NC(=O)N[C@@H]3CCN(C)[C@@H]3c3ccccc3)cc2F)n1 ZINC000530409926 930705174 /nfs/dbraw/zinc/70/51/74/930705174.db2.gz ZVYVVFSXRVUJOM-IFMALSPDSA-N 0 3 407.493 4.195 20 0 HIADHN O=C1[C@@H](NCc2cccc(-n3cccn3)c2)CCN1c1ccc(Cl)cc1Cl ZINC000530440114 930708962 /nfs/dbraw/zinc/70/89/62/930708962.db2.gz LGTADGXGVVGFGO-SFHVURJKSA-N 0 3 401.297 4.074 20 0 HIADHN O=C(CC1(N2CCOCC2)CCCC1)N(CCc1ccccc1F)C1CCCC1 ZINC000530574832 930755819 /nfs/dbraw/zinc/75/58/19/930755819.db2.gz LRJQBXXGNGBYBH-UHFFFAOYSA-N 0 3 402.554 4.175 20 0 HIADHN Cc1c(C(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)cnn1-c1ccc(C)cc1 ZINC000530585736 930759136 /nfs/dbraw/zinc/75/91/36/930759136.db2.gz MUGZWQISAXCZBX-HSZRJFAPSA-N 0 3 402.542 4.226 20 0 HIADHN COc1cc(C(C)=O)ccc1OCCCc1nc(-c2ccc(CN(C)C)cc2)no1 ZINC000530632085 930778555 /nfs/dbraw/zinc/77/85/55/930778555.db2.gz MWALUQZWIVWDBM-UHFFFAOYSA-N 0 3 409.486 4.021 20 0 HIADHN COc1ccc(-c2cnc(CCc3nc(-c4ccc(CN(C)C)cc4)no3)o2)cc1 ZINC000530632365 930780484 /nfs/dbraw/zinc/78/04/84/930780484.db2.gz RXVSWSSBMFWHDE-UHFFFAOYSA-N 0 3 404.470 4.247 20 0 HIADHN COC(=O)c1cc2c(o1)c(OC)ccc2CNCc1cccc(OCC(F)F)c1 ZINC000530664916 930792285 /nfs/dbraw/zinc/79/22/85/930792285.db2.gz GGEQBLVYAUHLDP-UHFFFAOYSA-N 0 3 405.397 4.162 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)c2cc(Br)ccc2F)CC1 ZINC000530680274 930796608 /nfs/dbraw/zinc/79/66/08/930796608.db2.gz UHMHFQQRDXUGOE-UHFFFAOYSA-N 0 3 405.311 4.325 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)C(=O)Nc1ccc2oc3ccccc3c2c1 ZINC000530746437 930815117 /nfs/dbraw/zinc/81/51/17/930815117.db2.gz MXLORXVTGSMSQU-UHFFFAOYSA-N 0 3 421.522 4.176 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)Nc1cccc(-c2cn3cccnc3n2)c1 ZINC000530808382 930828682 /nfs/dbraw/zinc/82/86/82/930828682.db2.gz KNFRIEBAVRIEKO-UHFFFAOYSA-N 0 3 411.465 4.456 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N3CCCC[C@@H]3Cc3ccc(F)cc3)cc2)CC1 ZINC000530816617 930830893 /nfs/dbraw/zinc/83/08/93/930830893.db2.gz MXGQGOXCYZPRRO-XMMPIXPASA-N 0 3 409.549 4.205 20 0 HIADHN COC(=O)c1cc2c(o1)c(OC)ccc2CNCc1cc(F)cc(Br)c1 ZINC000530904088 930855170 /nfs/dbraw/zinc/85/51/70/930855170.db2.gz DNYPXYUWFBSXFN-UHFFFAOYSA-N 0 3 422.250 4.419 20 0 HIADHN CCC[C@@H](N[C@H](C)CC(=O)Nc1ccccc1)C(=O)Nc1cccc(N2CCCC2)c1 ZINC000530907395 930855180 /nfs/dbraw/zinc/85/51/80/930855180.db2.gz JYIVOIYWEYATOV-AUSIDOKSSA-N 0 3 422.573 4.401 20 0 HIADHN COc1cc([C@H](C)NCc2cnc3cccc(C)n23)ccc1OCc1ccncc1 ZINC000530904199 930855353 /nfs/dbraw/zinc/85/53/53/930855353.db2.gz GKRRHYNPLHWJDK-SFHVURJKSA-N 0 3 402.498 4.476 20 0 HIADHN CC(C)Oc1ccc(CCNC(=O)N(Cc2ccccc2)C2CCN(C)CC2)cc1 ZINC000530922646 930858869 /nfs/dbraw/zinc/85/88/69/930858869.db2.gz UPXRYSLGEYNEAD-UHFFFAOYSA-N 0 3 409.574 4.322 20 0 HIADHN COC[C@@](C)(CCO)NCc1cn(-c2ccccc2)nc1-c1cc2ccccc2o1 ZINC000530933532 930862486 /nfs/dbraw/zinc/86/24/86/930862486.db2.gz HTRROFQMUUTMBE-XMMPIXPASA-N 0 3 405.498 4.163 20 0 HIADHN O=C(Nc1cc(F)ccc1OCC(F)(F)F)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000530988088 930877607 /nfs/dbraw/zinc/87/76/07/930877607.db2.gz OERQLXJNPLUOHM-OAHLLOKOSA-N 0 3 411.399 4.013 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)CN[C@H](c2ccccc2)C(F)(F)F)N2CCCC2)cc1 ZINC000531049056 930897404 /nfs/dbraw/zinc/89/74/04/930897404.db2.gz LRJAPWZWTUVHAU-IFMALSPDSA-N 0 3 419.491 4.141 20 0 HIADHN COc1cc(C[NH2+][C@H]2CCCO[C@@H]2c2ccc(C)cc2)cc(Br)c1[O-] ZINC000531094313 930917522 /nfs/dbraw/zinc/91/75/22/930917522.db2.gz AMCYNHHECWCONV-FXAWDEMLSA-N 0 3 406.320 4.482 20 0 HIADHN CC(C)n1cc([C@H](C)NC(=O)N[C@H](CN2CCc3ccccc3C2)C(C)(C)C)cn1 ZINC000531107872 930921978 /nfs/dbraw/zinc/92/19/78/930921978.db2.gz ABWLLRBRZIHPAE-PGRDOPGGSA-N 0 3 411.594 4.297 20 0 HIADHN COC(=O)c1cc2c(o1)c(OC)ccc2CNCc1ccc(N2CCC(C)CC2)nc1 ZINC000531142235 930943830 /nfs/dbraw/zinc/94/38/30/930943830.db2.gz FIQWIIPTVNUDLM-UHFFFAOYSA-N 0 3 423.513 4.149 20 0 HIADHN CC(C)OC1CCN(C(=O)N[C@@H](CN2CCc3ccccc3C2)C(C)(C)C)CC1 ZINC000531186499 930956916 /nfs/dbraw/zinc/95/69/16/930956916.db2.gz WGAOYLSYBIAJBW-QFIPXVFZSA-N 0 3 401.595 4.058 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)CCOc2ccc(F)c(Cl)c2)CC1 ZINC000531222502 930972027 /nfs/dbraw/zinc/97/20/27/930972027.db2.gz FSABAWXCQKCHNY-UHFFFAOYSA-N 0 3 404.913 4.371 20 0 HIADHN Cc1nnc(-c2cccc(C(=O)N[C@H](CN3CCc4ccccc4C3)C(C)(C)C)c2)o1 ZINC000531290553 931003779 /nfs/dbraw/zinc/00/37/79/931003779.db2.gz VBSYOOMHLTVXHG-JOCHJYFZSA-N 0 3 418.541 4.248 20 0 HIADHN CCCN1CCC[C@@H]1C(=O)Nc1ccc(Cl)c(-c2nnc3n2CCCCC3)c1 ZINC000531305936 931009190 /nfs/dbraw/zinc/00/91/90/931009190.db2.gz BFUQUXXRMLEMGI-GOSISDBHSA-N 0 3 401.942 4.138 20 0 HIADHN CCNC(=O)COc1ccc(CN[C@@H](C)c2ccc(-c3cccnc3)cc2)cc1OC ZINC000531346825 931025201 /nfs/dbraw/zinc/02/52/01/931025201.db2.gz DCGOAXSMIFUGQU-SFHVURJKSA-N 0 3 419.525 4.123 20 0 HIADHN COC(=O)c1cc2c(o1)c(OC)ccc2CNCc1ccc(OCC(F)(F)F)cc1 ZINC000531380743 931037520 /nfs/dbraw/zinc/03/75/20/931037520.db2.gz YMVAGSOTACSSTF-UHFFFAOYSA-N 0 3 423.387 4.459 20 0 HIADHN Cc1[nH]c(=O)c(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)cc1-c1ccccc1 ZINC000531407833 931045786 /nfs/dbraw/zinc/04/57/86/931045786.db2.gz YBLIVBOKXVJSCO-NRFANRHFSA-N 0 3 401.510 4.157 20 0 HIADHN CO[C@@H](C)c1noc(CN2CCCN(Cc3ccc(-c4ccccc4)cc3)CC2)n1 ZINC000531416758 931048299 /nfs/dbraw/zinc/04/82/99/931048299.db2.gz OFGIOKSCFQPAOT-IBGZPJMESA-N 0 3 406.530 4.152 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3ccnc(Oc4ccccc4)c3)CC2)C[C@H](C)O1 ZINC000531417713 931049722 /nfs/dbraw/zinc/04/97/22/931049722.db2.gz IOBSKGZLIATNKQ-BGYRXZFFSA-N 0 3 423.557 4.225 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1cc(Cl)ccc1OCC(F)(F)F ZINC000531520775 931090118 /nfs/dbraw/zinc/09/01/18/931090118.db2.gz XZMGPRJLRZOETK-UHFFFAOYSA-N 0 3 419.831 4.470 20 0 HIADHN COc1cc(OC)cc(N2CCCN(Cc3ccc(OC(F)F)c(OC)c3)CC2)c1 ZINC000531580191 931108407 /nfs/dbraw/zinc/10/84/07/931108407.db2.gz RWJXAKKKVAFKOR-UHFFFAOYSA-N 0 3 422.472 4.026 20 0 HIADHN CCCc1ccc([C@H](NC(=O)N2CC[C@H](N3CCN(C(C)C)CC3)C2)C(C)C)cc1 ZINC000531584864 931110584 /nfs/dbraw/zinc/11/05/84/931110584.db2.gz OTQSYHPLTNQLJJ-BJKOFHAPSA-N 0 3 414.638 4.146 20 0 HIADHN O=C(N[C@H](c1cccc(Cl)c1)c1ccccn1)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000531618417 931129326 /nfs/dbraw/zinc/12/93/26/931129326.db2.gz IBXXOBAMHCOHRL-NFBKMPQASA-N 0 3 420.944 4.248 20 0 HIADHN C[C@@H]1CN([C@@H](CNCc2cnc(C3CC3)s2)c2c(F)cccc2Cl)CCO1 ZINC000531630195 931132785 /nfs/dbraw/zinc/13/27/85/931132785.db2.gz WXMDUABMOPYPPB-ACJLOTCBSA-N 0 3 409.958 4.365 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@@H](C)N[C@H]2CCCc3nc(C)sc32)cc1 ZINC000531677058 931147628 /nfs/dbraw/zinc/14/76/28/931147628.db2.gz WHFMZPGSULSECV-KDOFPFPSSA-N 0 3 407.605 4.210 20 0 HIADHN C[C@@H](NC[C@H](O)COc1cccc(C(F)(F)F)c1)c1cnn(Cc2ccccc2)c1 ZINC000531695697 931158474 /nfs/dbraw/zinc/15/84/74/931158474.db2.gz QJLHVJJAQGDIPG-UZLBHIALSA-N 0 3 419.447 4.041 20 0 HIADHN O[C@H](CNCc1cnc(-c2ccccc2)s1)COc1ccccc1Br ZINC000531698386 931163065 /nfs/dbraw/zinc/16/30/65/931163065.db2.gz XZVNHANIRSPOKA-OAHLLOKOSA-N 0 3 419.344 4.102 20 0 HIADHN C[C@@H](NCc1cc(Cl)c2c(c1)OCCO2)c1ccc(OCc2nccn2C)cc1 ZINC000531701326 931164213 /nfs/dbraw/zinc/16/42/13/931164213.db2.gz ZRWNYOUAJUSKAO-OAHLLOKOSA-N 0 3 413.905 4.275 20 0 HIADHN CN1CCN(C[C@H](N[C@H]2CCSc3ccc(Cl)cc32)c2ccccc2)CC1 ZINC000531710120 931169226 /nfs/dbraw/zinc/16/92/26/931169226.db2.gz KKHSZGILHXDBGF-SFTDATJTSA-N 0 3 402.007 4.455 20 0 HIADHN C[C@@H](CC(=O)Nc1ccccc1C(F)(F)F)N[C@H]1CCCN(c2ccccc2)C1=O ZINC000531711489 931169871 /nfs/dbraw/zinc/16/98/71/931169871.db2.gz JLQRQTMXYBNANS-KXBFYZLASA-N 0 3 419.447 4.208 20 0 HIADHN CC(=O)CCc1ccc2oc(C(=O)N(CCN(C)C)Cc3ccc(C)o3)c(C)c2c1 ZINC000531853721 931221667 /nfs/dbraw/zinc/22/16/67/931221667.db2.gz BNMUPRWHSYGKIY-UHFFFAOYSA-N 0 3 410.514 4.368 20 0 HIADHN CCOC(=O)C1CCN(C(=O)CN[C@H](c2cccc(Cl)c2)C2CCCCC2)CC1 ZINC000531859215 931223702 /nfs/dbraw/zinc/22/37/02/931223702.db2.gz KIOTWAPZWBRDFM-QFIPXVFZSA-N 0 3 420.981 4.353 20 0 HIADHN CC(C)CCNC(=O)C1CCN(C(=O)CN2CCCCC[C@H]2c2ccccc2)CC1 ZINC000531897769 931239150 /nfs/dbraw/zinc/23/91/50/931239150.db2.gz KXFLFELWDZLCEN-QHCPKHFHSA-N 0 3 413.606 4.005 20 0 HIADHN CC(C)Oc1cccc(CNC(=O)CN(Cc2ccccc2)CC2CCOCC2)c1 ZINC000531905074 931242317 /nfs/dbraw/zinc/24/23/17/931242317.db2.gz KSDDVVQGACHIHG-UHFFFAOYSA-N 0 3 410.558 4.019 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1ccnc(Oc2ccccc2)c1 ZINC000531908324 931243079 /nfs/dbraw/zinc/24/30/79/931243079.db2.gz JJJAHRYCOKCMEN-UHFFFAOYSA-N 0 3 417.509 4.331 20 0 HIADHN Cc1nc([C@@H](C)N2CC[C@@H](N3CCN(C(C)C)CC3)C2)oc1-c1ccc(Cl)cc1 ZINC000531912602 931243973 /nfs/dbraw/zinc/24/39/73/931243973.db2.gz KSRHYWAFFZAOLE-WIYYLYMNSA-N 0 3 416.997 4.465 20 0 HIADHN CCOc1ccc([C@@H](CNC(=O)[C@@H](CC)N(C)C)c2c[nH]c3ccccc32)cc1OC ZINC000531932794 931251222 /nfs/dbraw/zinc/25/12/22/931251222.db2.gz MJOCMZPURAJJOR-DENIHFKCSA-N 0 3 423.557 4.164 20 0 HIADHN CCOc1ccc([C@H](CNC(=O)[C@H](CC)N(C)C)c2c[nH]c3ccccc32)cc1OC ZINC000531932797 931252128 /nfs/dbraw/zinc/25/21/28/931252128.db2.gz MJOCMZPURAJJOR-UGKGYDQZSA-N 0 3 423.557 4.164 20 0 HIADHN C[C@H](NCc1ccc(N2C[C@@H](C)O[C@@H](C)C2)nc1)c1ccc(Br)cc1 ZINC000531936282 931252724 /nfs/dbraw/zinc/25/27/24/931252724.db2.gz JGJPUCYFTNBOHQ-XHSDSOJGSA-N 0 3 404.352 4.309 20 0 HIADHN C[C@H](CC(=O)Nc1ccccc1C(F)(F)F)NCc1cnn(-c2ccccc2)c1 ZINC000531943105 931255626 /nfs/dbraw/zinc/25/56/26/931255626.db2.gz MOLSKIMGLGGAIU-OAHLLOKOSA-N 0 3 402.420 4.398 20 0 HIADHN COc1cc([C@H](C)N[C@@H](C)c2ccc(S(=O)(=O)N(C)C)cc2)ccc1OC(C)C ZINC000531944785 931256603 /nfs/dbraw/zinc/25/66/03/931256603.db2.gz KSVPPHSJJMRBPK-IRXDYDNUSA-N 0 3 420.575 4.145 20 0 HIADHN COc1cccc(C(=O)NCCN[C@H]2CCSc3ccc(Br)cc32)c1 ZINC000531951940 931261849 /nfs/dbraw/zinc/26/18/49/931261849.db2.gz MQYCCNXEOWBDMA-KRWDZBQOSA-N 0 3 421.360 4.014 20 0 HIADHN O=C(N[C@@H](c1ccccc1)c1cccc(F)c1)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000532030650 931290958 /nfs/dbraw/zinc/29/09/58/931290958.db2.gz JINIBAQSUOLEOX-UPVQGACJSA-N 0 3 403.501 4.339 20 0 HIADHN CSCc1cc(F)ccc1CNC(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000532033456 931292125 /nfs/dbraw/zinc/29/21/25/931292125.db2.gz VGWSCTRHUVAEON-SFHVURJKSA-N 0 3 407.580 4.387 20 0 HIADHN CCCN(C(=O)NCc1c(CC)noc1CC)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000532038974 931294029 /nfs/dbraw/zinc/29/40/29/931294029.db2.gz DAYIWUFKTAXXEL-HXUWFJFHSA-N 0 3 412.578 4.386 20 0 HIADHN COc1ccc(-c2ccccc2)cc1CNCc1cccc(CN2CCOCC2)c1 ZINC000532045820 931296181 /nfs/dbraw/zinc/29/61/81/931296181.db2.gz CBVVOSIMUWOKOS-UHFFFAOYSA-N 0 3 402.538 4.484 20 0 HIADHN CC(C)N1CCN([C@@H]2CCN(C(=O)Nc3cccc(Oc4ccccc4)c3)C2)CC1 ZINC000532097471 931310722 /nfs/dbraw/zinc/31/07/22/931310722.db2.gz JMCQLXDKRBPWCX-OAQYLSRUSA-N 0 3 408.546 4.111 20 0 HIADHN CC(C)N1CCN([C@H]2CCN(C(=O)Nc3ccc4oc5ccccc5c4c3)C2)CC1 ZINC000532097523 931310945 /nfs/dbraw/zinc/31/09/45/931310945.db2.gz MRBNWPJFBGOMAK-IBGZPJMESA-N 0 3 406.530 4.218 20 0 HIADHN Cc1[nH]c(=O)c(C(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)cc1-c1ccccc1 ZINC000532149054 931328768 /nfs/dbraw/zinc/32/87/68/931328768.db2.gz UYTCZGURQWUKJS-NRFANRHFSA-N 0 3 401.510 4.109 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@@H](C)N[C@@H](C)c2ccc(OC)c(F)c2)cc1 ZINC000532186780 931341100 /nfs/dbraw/zinc/34/11/00/931341100.db2.gz UMCUDQBCYYBUKZ-CVEARBPZSA-N 0 3 408.539 4.277 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@H](C)N[C@@H](C)c2ccc(OC)c(F)c2)cc1 ZINC000532186781 931341243 /nfs/dbraw/zinc/34/12/43/931341243.db2.gz UMCUDQBCYYBUKZ-HOTGVXAUSA-N 0 3 408.539 4.277 20 0 HIADHN CC(C)NS(=O)(=O)Cc1ccc(CN[C@@H](C)c2cccc(C(F)(F)F)c2)cc1 ZINC000532206358 931350221 /nfs/dbraw/zinc/35/02/21/931350221.db2.gz JDPHIRFTLRBEKD-HNNXBMFYSA-N 0 3 414.493 4.384 20 0 HIADHN COc1ccc2oc([C@H](C)N[C@H](CN3CCN(C)CC3)c3ccccc3)c(C)c2c1 ZINC000532213672 931355421 /nfs/dbraw/zinc/35/54/21/931355421.db2.gz UJBQRROKERCPGK-WMZHIEFXSA-N 0 3 407.558 4.389 20 0 HIADHN Cc1nn(C)cc1[C@H](C)N[C@@H](C)CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 ZINC000532214806 931355837 /nfs/dbraw/zinc/35/58/37/931355837.db2.gz FRZKEVYSSDQGSH-QWRGUYRKSA-N 0 3 402.848 4.469 20 0 HIADHN Cc1nn(C)cc1[C@@H](C)N[C@@H](C)CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 ZINC000532214807 931356235 /nfs/dbraw/zinc/35/62/35/931356235.db2.gz FRZKEVYSSDQGSH-WDEREUQCSA-N 0 3 402.848 4.469 20 0 HIADHN COc1ccccc1[C@@H](NC(=O)N(CCN(C)C)Cc1ccco1)c1ccccc1 ZINC000532290884 931387659 /nfs/dbraw/zinc/38/76/59/931387659.db2.gz DVQKPFMSJKQNPF-QHCPKHFHSA-N 0 3 407.514 4.151 20 0 HIADHN CC(C)(C)OC(=O)C[C@@H]1CCCN(CCc2nc(-c3cccc(Cl)c3)no2)C1 ZINC000532379351 931416310 /nfs/dbraw/zinc/41/63/10/931416310.db2.gz HWAQRHFPNLUHSZ-HNNXBMFYSA-N 0 3 405.926 4.376 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@H](C)N[C@H](C)c2ccc(OC)c(OC)c2)cc1 ZINC000532441190 931435803 /nfs/dbraw/zinc/43/58/03/931435803.db2.gz GYHUJDKZBZNMFT-DLBZAZTESA-N 0 3 420.575 4.146 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)NCc2ccc(N3C[C@@H](C)O[C@@H](C)C3)nc2)cc1 ZINC000532446771 931438621 /nfs/dbraw/zinc/43/86/21/931438621.db2.gz XPOSRUPDMVWROA-OTWHNJEPSA-N 0 3 405.546 4.040 20 0 HIADHN CN1CCN(c2ccc(CN[C@@H](Cc3cccc(F)c3)c3cccc(F)c3)cn2)CC1 ZINC000532452111 931440843 /nfs/dbraw/zinc/44/08/43/931440843.db2.gz SIQVGCVPCMWJHA-DEOSSOPVSA-N 0 3 422.523 4.185 20 0 HIADHN O[C@H](CN[C@@H]1CCSc2ccc(F)cc21)COc1cccc(C(F)(F)F)c1 ZINC000532465276 931447689 /nfs/dbraw/zinc/44/76/89/931447689.db2.gz VAEBRYSSAPAIOB-RHSMWYFYSA-N 0 3 401.425 4.411 20 0 HIADHN C[C@@H](NCCNS(=O)(=O)c1cccc(Cl)c1)c1cccc(-c2ccncc2)c1 ZINC000532468449 931449199 /nfs/dbraw/zinc/44/91/99/931449199.db2.gz SZBLOVJCNBYICB-MRXNPFEDSA-N 0 3 415.946 4.031 20 0 HIADHN CCN(CC)C(=O)Nc1ccc([C@@H](C)NCc2ccccc2N2CCOCC2)cc1 ZINC000532468408 931449332 /nfs/dbraw/zinc/44/93/32/931449332.db2.gz ZHLXBELVKGGHKB-LJQANCHMSA-N 0 3 410.562 4.248 20 0 HIADHN C[C@@H]1CSc2ccc(Br)cc2[C@H]1NCc1ccc2c(c1)nnn2C ZINC000532479128 931454766 /nfs/dbraw/zinc/45/47/66/931454766.db2.gz DSIJURNPQFVJRW-ZMZPIMSZSA-N 0 3 403.349 4.304 20 0 HIADHN Cc1cc(NC(=O)c2cnc(C3CC3)s2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000532513989 931469624 /nfs/dbraw/zinc/46/96/24/931469624.db2.gz MANYLGBTYDJIRQ-SFHVURJKSA-N 0 3 407.543 4.225 20 0 HIADHN Cc1ccc2nc(CN[C@@H](C)CC(=O)Nc3cccc(Br)c3)[nH]c2c1 ZINC000532531861 931513283 /nfs/dbraw/zinc/51/32/83/931513283.db2.gz WZJMWHKWFXNARL-ZDUSSCGKSA-N 0 3 401.308 4.141 20 0 HIADHN O=C(CCN1CCC[C@H]1[C@H](O)C(F)(F)F)Nc1ccccc1Oc1ccccc1 ZINC000532553283 931520527 /nfs/dbraw/zinc/52/05/27/931520527.db2.gz WIAKHIOSWJPHHQ-PXNSSMCTSA-N 0 3 408.420 4.195 20 0 HIADHN CCCN(CC(F)(F)F)C(=O)[C@H]1CCCN(Cc2cnc(-c3ccccc3)nc2)C1 ZINC000532581085 931539534 /nfs/dbraw/zinc/53/95/34/931539534.db2.gz ILUQSICSACPPRH-IBGZPJMESA-N 0 3 420.479 4.157 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(NC(=O)NC2CC2)cc1)C(=O)N1c2ccccc2CC[C@@H]1C ZINC000532614612 931554558 /nfs/dbraw/zinc/55/45/58/931554558.db2.gz RINMUYSZFJQQGA-BZSNNMDCSA-N 0 3 420.557 4.378 20 0 HIADHN COc1cc(CNCCOc2ncccc2C(F)(F)F)c(SC)cc1OC ZINC000532615633 931555228 /nfs/dbraw/zinc/55/52/28/931555228.db2.gz QFNNBPQTPXZGOK-UHFFFAOYSA-N 0 3 402.438 4.008 20 0 HIADHN COc1ccc([C@H](NCCOC[C@H]2CCCO2)c2ccccc2)cc1Br ZINC000532697659 931591654 /nfs/dbraw/zinc/59/16/54/931591654.db2.gz LIWMOTFQERPJSI-WIYYLYMNSA-N 0 3 420.347 4.332 20 0 HIADHN C[C@@H](N[C@@H](c1ccc(F)cc1)C1CCC1)C(=O)Nc1cccc(N2CCCC2=O)c1 ZINC000532701532 931594783 /nfs/dbraw/zinc/59/47/83/931594783.db2.gz DPRKOTKBVDNWIC-WAIKUNEKSA-N 0 3 409.505 4.411 20 0 HIADHN COc1ccccc1[C@H](C)N(C)C(=O)CNC1(c2ccc(Cl)cc2)CCOCC1 ZINC000532713939 931604550 /nfs/dbraw/zinc/60/45/50/931604550.db2.gz BEVARFCFWCYJMD-KRWDZBQOSA-N 0 3 416.949 4.164 20 0 HIADHN O=C(c1ccccc1)N1CCC(NCc2ccc(Cl)cc2Br)CC1 ZINC000532724896 931609676 /nfs/dbraw/zinc/60/96/76/931609676.db2.gz RTOUCAUCVWWPPH-UHFFFAOYSA-N 0 3 407.739 4.497 20 0 HIADHN CCOC(=O)c1oc2ccc(Br)cc2c1CN(C[C@@H]1CCOC1)C1CC1 ZINC000532921845 931695764 /nfs/dbraw/zinc/69/57/64/931695764.db2.gz QVTRPXPVUSWYGX-ZDUSSCGKSA-N 0 3 422.319 4.373 20 0 HIADHN C[C@@H]1CN(C[C@H]2CCCN2Cc2cccc(C(=O)Nc3ccccc3)c2)C[C@H](C)O1 ZINC000532929386 931699536 /nfs/dbraw/zinc/69/95/36/931699536.db2.gz LYNZKZOZZQKRDQ-JXALWOEJSA-N 0 3 407.558 4.013 20 0 HIADHN CCCO[C@@H]1CCCN([C@H](C)C(=O)N(C)Cc2ccc(Br)cc2)CC1 ZINC000532961015 931715805 /nfs/dbraw/zinc/71/58/05/931715805.db2.gz WYFZDIWAHXOXFC-VQIMIIECSA-N 0 3 411.384 4.077 20 0 HIADHN CC[C@@H](C)[C@H](C)N(CC(=O)Nc1ccccc1I)C1CC1 ZINC000532966322 931716902 /nfs/dbraw/zinc/71/69/02/931716902.db2.gz FKBFCQHETOCAOP-OLZOCXBDSA-N 0 3 400.304 4.129 20 0 HIADHN CCCN(CC(=O)Nc1ccc(Br)cc1F)[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000532970200 931720328 /nfs/dbraw/zinc/72/03/28/931720328.db2.gz ADGDLTPBEUTRKY-FSPWUOQZSA-N 0 3 413.331 4.052 20 0 HIADHN C/C=C\c1ccc(OC[C@@H](O)CN2CC=C(c3c[nH]c4ncccc34)CC2)c(OC)c1 ZINC000533022033 931741372 /nfs/dbraw/zinc/74/13/72/931741372.db2.gz AXGFERCPCGPQJR-BOYDRYHPSA-N 0 3 419.525 4.134 20 0 HIADHN O=C(CN[C@@H](c1ccccc1)C1CCC1)Nc1ccccc1I ZINC000533045310 931750897 /nfs/dbraw/zinc/75/08/97/931750897.db2.gz DDPSVYNYBROSSQ-IBGZPJMESA-N 0 3 420.294 4.361 20 0 HIADHN CC(C)n1c2ccccc2nc1[C@H]1CCCN(CCn2cnc3ccccc3c2=O)C1 ZINC000533070353 931762590 /nfs/dbraw/zinc/76/25/90/931762590.db2.gz CHIBQQVDVGHYPD-IBGZPJMESA-N 0 3 415.541 4.207 20 0 HIADHN COc1ccc(OC2CCN(C[C@@H](O)Cc3ccccc3C(F)(F)F)CC2)cc1 ZINC000533099716 931770831 /nfs/dbraw/zinc/77/08/31/931770831.db2.gz SMWRHTCZYCDFGZ-KRWDZBQOSA-N 0 3 409.448 4.161 20 0 HIADHN O=C([C@H]1CCCN(Cc2cccnc2)C1)N1CCC[C@@H](Oc2ccccc2Cl)C1 ZINC000533109539 931773309 /nfs/dbraw/zinc/77/33/09/931773309.db2.gz BEBINNPOQUXLPU-VQTJNVASSA-N 0 3 413.949 4.017 20 0 HIADHN COc1ccc(NC(=O)[C@H](N[C@@H]2[C@H]3CCO[C@@H]3C23CCCC3)c2ccccc2)cc1 ZINC000533177151 931802696 /nfs/dbraw/zinc/80/26/96/931802696.db2.gz WSPMHXAQFCXHSA-ODAXIHTASA-N 0 3 406.526 4.312 20 0 HIADHN COc1cc(CN(C)CCC(=O)Nc2ccccc2SC)ccc1OC(F)F ZINC000533233868 931815477 /nfs/dbraw/zinc/81/54/77/931815477.db2.gz LKPNVDSSTHVKTB-UHFFFAOYSA-N 0 3 410.486 4.479 20 0 HIADHN O=C(Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)c1cc2cc(F)ccc2o1 ZINC000533260288 931821854 /nfs/dbraw/zinc/82/18/54/931821854.db2.gz QFVQCHAYQHOCEQ-IBGZPJMESA-N 0 3 404.445 4.468 20 0 HIADHN COC(=O)[C@@H]1CC12CCN(Cc1cc(Cl)ccc1OCc1cccnc1)CC2 ZINC000533296412 931831604 /nfs/dbraw/zinc/83/16/04/931831604.db2.gz UOVZHNIVTQCCLW-IBGZPJMESA-N 0 3 400.906 4.089 20 0 HIADHN Cc1ccc(C)c([C@@H](C)N(C)Cc2cc(=O)n3cc(Br)ccc3n2)c1 ZINC000533299631 931833164 /nfs/dbraw/zinc/83/31/64/931833164.db2.gz GDNAUOKBEVRWHP-OAHLLOKOSA-N 0 3 400.320 4.267 20 0 HIADHN O[C@H](COc1cccc2[nH]ccc21)CN1CCC[C@H](c2nc3ccccc3s2)C1 ZINC000533334972 931840888 /nfs/dbraw/zinc/84/08/88/931840888.db2.gz ZEVAGKMMLDTYFJ-IRXDYDNUSA-N 0 3 407.539 4.397 20 0 HIADHN Cc1ccc(OC[C@H](O)CN2CCC(c3nc4cc(Cl)ccc4o3)CC2)cc1 ZINC000533353726 931846892 /nfs/dbraw/zinc/84/68/92/931846892.db2.gz SSRPXXOBBNJVBP-GOSISDBHSA-N 0 3 400.906 4.409 20 0 HIADHN Cc1cccc(NC(=O)[C@H]2CCCN(Cc3ccccc3Oc3cccnc3)C2)n1 ZINC000533355081 931847238 /nfs/dbraw/zinc/84/72/38/931847238.db2.gz XMEWYMNBDCQKPT-FQEVSTJZSA-N 0 3 402.498 4.428 20 0 HIADHN COc1ccc(NC(C)=O)cc1NC(=O)[C@H](C)N[C@@H](c1ccc(F)cc1)C1CCC1 ZINC000533368218 931850389 /nfs/dbraw/zinc/85/03/89/931850389.db2.gz WBSBCIHOTJXRGW-RCDICMHDSA-N 0 3 413.493 4.251 20 0 HIADHN COc1ccc(CCn2c(C)cc(C(=O)CN3CC[C@H](N4CCCCC4)C3)c2C)cc1 ZINC000533417811 931862414 /nfs/dbraw/zinc/86/24/14/931862414.db2.gz WHUOBDWHYOSBMY-QHCPKHFHSA-N 0 3 423.601 4.099 20 0 HIADHN Cc1cccc([C@H]2CCCN2CCc2nc3sc4c(c3c(N)n2)CC[C@@H](C)C4)n1 ZINC000533483219 931881057 /nfs/dbraw/zinc/88/10/57/931881057.db2.gz PUCBMZGKJQVQSN-RDTXWAMCSA-N 0 3 407.587 4.481 20 0 HIADHN O=C(CNC1(c2ccccc2)CCOCC1)N[C@@H](c1cccs1)c1ccccc1 ZINC000533517049 931891988 /nfs/dbraw/zinc/89/19/88/931891988.db2.gz AMDTZMLJBNBLEZ-HSZRJFAPSA-N 0 3 406.551 4.249 20 0 HIADHN CCN(Cc1cn2c(cccc2C)n1)C1CCN(c2cc(C)nc(C(C)C)n2)CC1 ZINC000533532784 931896298 /nfs/dbraw/zinc/89/62/98/931896298.db2.gz MSWNRBHOVSHHIR-UHFFFAOYSA-N 0 3 406.578 4.355 20 0 HIADHN CCN(CCc1nccs1)C(=O)N[C@H](CN1CCc2ccccc2C1)C(C)(C)C ZINC000533621724 931929065 /nfs/dbraw/zinc/92/90/65/931929065.db2.gz HMDWTXUGNPYRTI-HXUWFJFHSA-N 0 3 414.619 4.190 20 0 HIADHN COc1ccc(C(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)cc1-c1ccccn1 ZINC000533650805 931946835 /nfs/dbraw/zinc/94/68/35/931946835.db2.gz HMDXYMKNQPEGAA-FQEVSTJZSA-N 0 3 415.537 4.494 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)c3cccc(-c4ccccn4)c3C)cc2)CC1 ZINC000533654851 931950312 /nfs/dbraw/zinc/95/03/12/931950312.db2.gz KEPYZUBATIDEQU-UHFFFAOYSA-N 0 3 414.553 4.447 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)Nc1cccnc1-c1ccccc1 ZINC000533659355 931953399 /nfs/dbraw/zinc/95/33/99/931953399.db2.gz WNKYLJZRLMWTRP-UHFFFAOYSA-N 0 3 400.526 4.290 20 0 HIADHN CCc1ccc([C@@H](NC(=O)CN2CC[C@@H](C3CCOCC3)C2)c2cccs2)cc1 ZINC000533670335 931961039 /nfs/dbraw/zinc/96/10/39/931961039.db2.gz LBUNOMNFVJKECM-ZJSXRUAMSA-N 0 3 412.599 4.265 20 0 HIADHN CN(C)[C@H](CNC(=O)C(C)(C)c1cccc(Br)c1)Cc1ccccc1 ZINC000533811231 932043024 /nfs/dbraw/zinc/04/30/24/932043024.db2.gz MWFRMEKTHRYDIA-IBGZPJMESA-N 0 3 403.364 4.016 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccc(O)cc1)C(=O)c1nc(C(C)C)ncc1Cl ZINC000533829965 932049302 /nfs/dbraw/zinc/04/93/02/932049302.db2.gz MVXIXZYYWCGHIR-QGZVFWFLSA-N 0 3 416.953 4.086 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)c1ccn(-c2ccc(Cl)cc2)n1 ZINC000533851703 932060777 /nfs/dbraw/zinc/06/07/77/932060777.db2.gz QVJDXWJBHIGEBK-OAQYLSRUSA-N 0 3 423.948 4.047 20 0 HIADHN O=C(NC1CCN(Cc2ccccc2)CC1)c1c[nH]c2cccc(Br)c12 ZINC000533869085 932071538 /nfs/dbraw/zinc/07/15/38/932071538.db2.gz AANXDNCWEUGGKS-UHFFFAOYSA-N 0 3 412.331 4.325 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)[C@H](OC2CCOCC2)c2ccccc2)N2CCCC2)cc1 ZINC000533907146 932093670 /nfs/dbraw/zinc/09/36/70/932093670.db2.gz NUKQFQKQKNZTOV-JWQCQUIFSA-N 0 3 422.569 4.185 20 0 HIADHN CN(Cc1csc(Br)c1)C(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000533945247 932119208 /nfs/dbraw/zinc/11/92/08/932119208.db2.gz SXJPTMQMWBCLGN-RDJZCZTQSA-N 0 3 408.365 4.097 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)C(=O)N1CCC[C@H]1c1ccc(C(C)C)cc1 ZINC000533946353 932119907 /nfs/dbraw/zinc/11/99/07/932119907.db2.gz DXBFRRXPXBYGTC-QFIPXVFZSA-N 0 3 423.557 4.182 20 0 HIADHN C[C@H](Cc1c(Cl)cccc1Cl)NC(=O)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000534003565 932186223 /nfs/dbraw/zinc/18/62/23/932186223.db2.gz SYCRHJFGODCEOW-WBVHZDCISA-N 0 3 406.357 4.348 20 0 HIADHN CN1CC[C@@H](NC(=O)CCCc2nc(-c3ccc(Cl)cc3)no2)[C@@H]1c1ccccc1 ZINC000534018151 932200073 /nfs/dbraw/zinc/20/00/73/932200073.db2.gz AZHGJKHNISDHMU-KNQAVFIVSA-N 0 3 424.932 4.274 20 0 HIADHN CN1CC[C@@H](NC(=O)c2cccc(-n3ccc(C(F)(F)F)n3)c2)[C@H]1c1ccccc1 ZINC000534019279 932200819 /nfs/dbraw/zinc/20/08/19/932200819.db2.gz OQTSAIVVRHQABZ-UYAOXDASSA-N 0 3 414.431 4.066 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)c(C)c1CC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000534018899 932201019 /nfs/dbraw/zinc/20/10/19/932201019.db2.gz LYEVZNRUVZZLHP-ISKFKSNPSA-N 0 3 422.960 4.247 20 0 HIADHN O=C(N[C@@H]1CCN(Cc2ccccc2)C[C@H]1CO)c1ccc(Oc2ccccc2)cc1 ZINC000534182692 932320040 /nfs/dbraw/zinc/32/00/40/932320040.db2.gz RKKUMJPJYCVQLU-WIOPSUGQSA-N 0 3 416.521 4.092 20 0 HIADHN O=C(N[C@H]1CCN(Cc2ccccc2)C[C@H]1CO)c1ccc(OC2CCCCC2)cc1 ZINC000534182678 932320196 /nfs/dbraw/zinc/32/01/96/932320196.db2.gz WMMMPURGOFINJD-DHLKQENFSA-N 0 3 422.569 4.011 20 0 HIADHN Cc1ccc2[nH]c([C@H]3CCCN([C@@H](C)C(=O)N4CCc5sccc5C4)C3)nc2c1 ZINC000534216254 932338190 /nfs/dbraw/zinc/33/81/90/932338190.db2.gz JYFRFOJGIRLEMV-WMZOPIPTSA-N 0 3 408.571 4.086 20 0 HIADHN Cc1ccc2nc([C@H]3CCCN([C@@H](C)C(=O)N4CCc5sccc5C4)C3)[nH]c2c1 ZINC000534216254 932338195 /nfs/dbraw/zinc/33/81/95/932338195.db2.gz JYFRFOJGIRLEMV-WMZOPIPTSA-N 0 3 408.571 4.086 20 0 HIADHN CCOc1ccc(-c2nc(CN3CC[C@H](C4CCOCC4)C3)cs2)cc1OC ZINC000534381422 932409103 /nfs/dbraw/zinc/40/91/03/932409103.db2.gz UTWOHTBOJFOOIQ-SFHVURJKSA-N 0 3 402.560 4.466 20 0 HIADHN COc1cc(NC(=O)C(Cc2c(C)cc(C)cc2C)C(F)(F)F)ccc1NC(N)=O ZINC000534409774 932430656 /nfs/dbraw/zinc/43/06/56/932430656.db2.gz DCMQWGAHWPIYIE-INIZCTEOSA-N 0 3 423.435 4.471 20 0 HIADHN Cc1cc(C)c(CC(C(=O)Nc2cccc(-n3cnnn3)c2C)C(F)(F)F)c(C)c1 ZINC000534430791 932446762 /nfs/dbraw/zinc/44/67/62/932446762.db2.gz YGCSCNASUSVXSL-KRWDZBQOSA-N 0 3 417.435 4.256 20 0 HIADHN COc1ccc(CN[C@@H](C)c2ccc(-n3ccnn3)cc2)cc1OCc1cccnc1 ZINC000534465197 932483230 /nfs/dbraw/zinc/48/32/30/932483230.db2.gz TZCDJGRJIMOVDO-SFHVURJKSA-N 0 3 415.497 4.101 20 0 HIADHN Cc1nc(C(C)C)sc1[C@H](C)N(C)CCC(=O)Nc1ccc(C(N)=O)c(Cl)c1 ZINC000534477701 932511009 /nfs/dbraw/zinc/51/10/09/932511009.db2.gz MEJMITMKCGJCBD-ZDUSSCGKSA-N 0 3 422.982 4.349 20 0 HIADHN CN(C)CCn1cc(NC(=O)c2ccc(-c3ccc(Cl)cc3)s2)ccc1=O ZINC000534489814 932528829 /nfs/dbraw/zinc/52/88/29/932528829.db2.gz UAWKJJPMFPTZDY-UHFFFAOYSA-N 0 3 401.919 4.044 20 0 HIADHN CC(=O)N1CC[C@H](NCc2ccc(-n3ccc(C(F)(F)F)n3)cc2)c2ccccc21 ZINC000534511381 932539784 /nfs/dbraw/zinc/53/97/84/932539784.db2.gz WSDCYQNYXHJOKB-IBGZPJMESA-N 0 3 414.431 4.479 20 0 HIADHN CN(C)[C@@H](CNC(=O)CCc1nc2cc(Cl)ccc2s1)Cc1ccccc1 ZINC000534522918 932544349 /nfs/dbraw/zinc/54/43/49/932544349.db2.gz DKCHUPVCOUNURV-QGZVFWFLSA-N 0 3 401.963 4.171 20 0 HIADHN Cc1nc(-c2cccc(C(F)(F)F)c2)[nH]c1C(=O)NCc1ccccc1CN(C)C ZINC000534570029 932572551 /nfs/dbraw/zinc/57/25/51/932572551.db2.gz PFTAANOXGAXMDS-UHFFFAOYSA-N 0 3 416.447 4.396 20 0 HIADHN CN1CC[C@H](NC(=O)N2CCC[C@@H](c3nc4c(s3)CCCC4)C2)[C@H]1c1ccccc1 ZINC000534682386 932651781 /nfs/dbraw/zinc/65/17/81/932651781.db2.gz QPWFKXRNIKHNNB-KAGYGMCKSA-N 0 3 424.614 4.356 20 0 HIADHN CN1CC[C@@H](NC(=O)NCCc2csc(-c3ccccc3)n2)[C@@H]1c1ccccc1 ZINC000534718239 932685306 /nfs/dbraw/zinc/68/53/06/932685306.db2.gz YHBRSGSDXUQCCF-RTWAWAEBSA-N 0 3 406.555 4.097 20 0 HIADHN CN1CC[C@@H](NC(=O)CCCc2ccccc2Br)[C@H]1c1ccccc1 ZINC000534756166 932735118 /nfs/dbraw/zinc/73/51/18/932735118.db2.gz PDPRHZBGSPPFKG-TZIWHRDSSA-N 0 3 401.348 4.333 20 0 HIADHN CC(=O)c1ccc(Oc2ccc(C(=O)NCCCCN3C[C@@H](C)O[C@@H](C)C3)cc2)cc1 ZINC000534883022 932821564 /nfs/dbraw/zinc/82/15/64/932821564.db2.gz SIOSZGZSTKQFGZ-KDURUIRLSA-N 0 3 424.541 4.301 20 0 HIADHN CC(=O)c1ccc(Oc2ccc(C(=O)NC3CCN(CCOC(C)C)CC3)cc2)cc1 ZINC000534882607 932821897 /nfs/dbraw/zinc/82/18/97/932821897.db2.gz FIXNAYFNYLHKAW-UHFFFAOYSA-N 0 3 424.541 4.301 20 0 HIADHN CN(C)CCN(Cc1cccc(O)c1)C(=O)c1cc2c(ccc(Cl)c2Cl)[nH]1 ZINC000534924600 932841058 /nfs/dbraw/zinc/84/10/58/932841058.db2.gz HLBQKZNYCRELFR-UHFFFAOYSA-N 0 3 406.313 4.384 20 0 HIADHN CCOc1cc(CN(Cc2ccccc2)C[C@H](C)O)cc(Br)c1OC ZINC000535081296 932899649 /nfs/dbraw/zinc/89/96/49/932899649.db2.gz VMVFOVSRPHZRFC-HNNXBMFYSA-N 0 3 408.336 4.239 20 0 HIADHN COc1cc(Cl)c(C)cc1NC(=O)CCNCc1cnc([C@@H]2CCCO2)s1 ZINC000535187022 933002643 /nfs/dbraw/zinc/00/26/43/933002643.db2.gz WXKQQTUOTWNLMC-INIZCTEOSA-N 0 3 409.939 4.083 20 0 HIADHN CN(C)[C@@H](CNC(=O)c1cc2cc(Br)ccc2o1)Cc1ccccc1 ZINC000535255527 933038945 /nfs/dbraw/zinc/03/89/45/933038945.db2.gz RYABRDWGDKGCGB-QGZVFWFLSA-N 0 3 401.304 4.098 20 0 HIADHN COc1ccccc1[C@@H](NC(=O)NC[C@H](Cc1ccccc1)N(C)C)c1ccccc1 ZINC000535260897 933040726 /nfs/dbraw/zinc/04/07/26/933040726.db2.gz IEDDOYKDWMQNPV-DHLKQENFSA-N 0 3 417.553 4.257 20 0 HIADHN COc1ccc2oc([C@H](C)NC(=O)NC[C@@H](Cc3ccccc3)N(C)C)c(C)c2c1 ZINC000535261615 933040810 /nfs/dbraw/zinc/04/08/10/933040810.db2.gz KECXSYNCDVYZBE-PKOBYXMFSA-N 0 3 409.530 4.283 20 0 HIADHN Cc1nc(C(C)C)sc1[C@@H](C)N(C)C(=O)NC[C@@H](Cc1ccccc1)N(C)C ZINC000535266575 933042741 /nfs/dbraw/zinc/04/27/41/933042741.db2.gz XACAMUFQBDBCEY-IEBWSBKVSA-N 0 3 402.608 4.450 20 0 HIADHN COCCSc1ccc([C@H](C)NC(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)cc1 ZINC000535364785 933093929 /nfs/dbraw/zinc/09/39/29/933093929.db2.gz MQKXMIUTTXPJGT-MTNREXPMSA-N 0 3 413.587 4.231 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N[C@H](C)Cc1c(Cl)cccc1Cl ZINC000535396987 933114616 /nfs/dbraw/zinc/11/46/16/933114616.db2.gz VLRKYZYJGIFPRS-CQSZACIVSA-N 0 3 422.356 4.049 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)[C@@H]2CCCN(c3ncccc3C(F)(F)F)C2)c1 ZINC000535421838 933128371 /nfs/dbraw/zinc/12/83/71/933128371.db2.gz TVKALXKOLVZORC-QGZVFWFLSA-N 0 3 420.479 4.326 20 0 HIADHN CN1CC[C@@H](NC(=O)NCc2ccc(Oc3ccccc3)nc2)[C@@H]1c1ccccc1 ZINC000535438884 933136355 /nfs/dbraw/zinc/13/63/55/933136355.db2.gz XSVYIOIVBUDBBE-GGAORHGYSA-N 0 3 402.498 4.119 20 0 HIADHN CN1CC[C@H](NC(=O)CCc2cc(Br)ccc2F)[C@H]1c1ccccc1 ZINC000535467266 933155892 /nfs/dbraw/zinc/15/58/92/933155892.db2.gz COTLJNRJAGHYNP-AZUAARDMSA-N 0 3 405.311 4.082 20 0 HIADHN CN1CC[C@H](NC(=O)CCCOc2ccccc2Br)[C@@H]1c1ccccc1 ZINC000535466988 933156042 /nfs/dbraw/zinc/15/60/42/933156042.db2.gz AOVGPRIEPBIEKK-RXVVDRJESA-N 0 3 417.347 4.170 20 0 HIADHN CN1CC[C@@H](NC(=O)CCc2cc(Br)ccc2F)[C@H]1c1ccccc1 ZINC000535467276 933156212 /nfs/dbraw/zinc/15/62/12/933156212.db2.gz COTLJNRJAGHYNP-UYAOXDASSA-N 0 3 405.311 4.082 20 0 HIADHN CN1CC[C@@H](NC(=O)CCCOc2ccccc2Br)[C@@H]1c1ccccc1 ZINC000535466986 933156336 /nfs/dbraw/zinc/15/63/36/933156336.db2.gz AOVGPRIEPBIEKK-NQIIRXRSSA-N 0 3 417.347 4.170 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)C3(c4ccc(F)cc4F)CCCC3)CC2)C[C@H](C)O1 ZINC000535520056 933210904 /nfs/dbraw/zinc/21/09/04/933210904.db2.gz QFSUVUCLBWRVNS-ROUUACIJSA-N 0 3 420.544 4.124 20 0 HIADHN Cc1ccc(Br)c(NC(=O)N(CCN(C)C)Cc2cccc(F)c2)c1 ZINC000535608088 933265260 /nfs/dbraw/zinc/26/52/60/933265260.db2.gz HRPLZNUMRSOXDZ-UHFFFAOYSA-N 0 3 408.315 4.492 20 0 HIADHN COc1ccc(C(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)cc1-c1ccccn1 ZINC000535852634 933435345 /nfs/dbraw/zinc/43/53/45/933435345.db2.gz KLJLJOXWBQAXMC-JOCHJYFZSA-N 0 3 415.537 4.494 20 0 HIADHN Cc1cnc(CCN(C)C[C@@H](O)CO[C@@H](c2ccccc2)c2ccc(C)cc2)s1 ZINC000535869138 933450928 /nfs/dbraw/zinc/45/09/28/933450928.db2.gz DIQQZBAVUHXAHJ-VWNXMTODSA-N 0 3 410.583 4.401 20 0 HIADHN COc1cc(CN[C@H]2CCN(C(C)=O)c3ccccc32)ccc1OCC(F)(F)F ZINC000536008942 933566685 /nfs/dbraw/zinc/56/66/85/933566685.db2.gz WVQXNXKOACVLQB-KRWDZBQOSA-N 0 3 408.420 4.224 20 0 HIADHN CN1CCC[C@H](CNC(=O)c2ccn(-c3ccc(Cl)cc3)n2)[C@@H]1c1cccs1 ZINC000536046573 933593223 /nfs/dbraw/zinc/59/32/23/933593223.db2.gz XEPPUWJNQXWXOE-FOIQADDNSA-N 0 3 414.962 4.400 20 0 HIADHN CCC(CC)n1ncc(C(=O)Nc2ccc(CCN3CCSCC3)cc2)c1C ZINC000536053195 933600702 /nfs/dbraw/zinc/60/07/02/933600702.db2.gz CIFHRQQRADDILF-UHFFFAOYSA-N 0 3 400.592 4.396 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)c2ccc(F)cc2Br)cc1 ZINC000536095027 933643535 /nfs/dbraw/zinc/64/35/35/933643535.db2.gz LCVPITALBXBXCL-LJQANCHMSA-N 0 3 421.310 4.164 20 0 HIADHN C[C@H](N[C@@H](c1ccc2c(c1)OCCO2)C1CC1)C(=O)N1CCC[C@H]1c1cccs1 ZINC000537289807 933699644 /nfs/dbraw/zinc/69/96/44/933699644.db2.gz JPVJNMTWSLGOSN-LZFQIVBZSA-N 0 3 412.555 4.312 20 0 HIADHN CC[C@H](NCc1ccc(N2CCO[C@@H](C)C2)nc1)c1cc(F)cc(Br)c1 ZINC000537294946 933702176 /nfs/dbraw/zinc/70/21/76/933702176.db2.gz HGHLFGBHSIZBBU-LIRRHRJNSA-N 0 3 422.342 4.449 20 0 HIADHN COc1cccc(COc2cccc(Cl)c2CNCCCc2nc(C)no2)c1 ZINC000537299686 933703102 /nfs/dbraw/zinc/70/31/02/933703102.db2.gz AFRWSYXLBRAJLJ-UHFFFAOYSA-N 0 3 401.894 4.341 20 0 HIADHN C[C@H](N[C@@H]1CCC[C@@H](S(C)(=O)=O)C1)c1cc2cc(Br)ccc2o1 ZINC000537307072 933708095 /nfs/dbraw/zinc/70/80/95/933708095.db2.gz KMGKPYSESIQAPC-NILFDRSVSA-N 0 3 400.338 4.202 20 0 HIADHN CC[C@H](NCc1ccccc1CS(C)(=O)=O)c1cc(F)cc(Br)c1 ZINC000537308462 933708820 /nfs/dbraw/zinc/70/88/20/933708820.db2.gz WUVBIPKCVICQBG-SFHVURJKSA-N 0 3 414.340 4.374 20 0 HIADHN Cc1cc(C(=O)N2CCCN(CCCc3ccccc3)CC2)nn1C1CCCCC1 ZINC000537390099 933752588 /nfs/dbraw/zinc/75/25/88/933752588.db2.gz QASRDASSUIGICO-UHFFFAOYSA-N 0 3 408.590 4.477 20 0 HIADHN CC[C@H](C)n1nc(C(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)cc1C ZINC000537588254 938329664 /nfs/dbraw/zinc/32/96/64/938329664.db2.gz CFTZKFJXGOXLCD-HNNXBMFYSA-N 0 3 410.484 4.385 20 0 HIADHN c1[nH]nc(-c2ccc3c(c2)OCCO3)c1CN1CC[C@@H](OCCCc2ccccc2)C1 ZINC000537623027 938337546 /nfs/dbraw/zinc/33/75/46/938337546.db2.gz UOCHEUVIRFQLBV-JOCHJYFZSA-N 0 3 419.525 4.072 20 0 HIADHN CCN(CC(F)(F)F)C(=O)[C@@H]1CCCN(Cc2ccc(OC(F)F)c(F)c2)C1 ZINC000537648571 938346123 /nfs/dbraw/zinc/34/61/23/938346123.db2.gz VEYQGKBEGMVJBZ-CYBMUJFWSA-N 0 3 412.374 4.050 20 0 HIADHN CN(C)C(=O)COc1ccccc1CN1CCC[C@H](COc2ccccc2Cl)C1 ZINC000537661500 938349097 /nfs/dbraw/zinc/34/90/97/938349097.db2.gz SBUFQDUMWNQGNK-SFHVURJKSA-N 0 3 416.949 4.098 20 0 HIADHN CC[C@H]1c2ccsc2CCN1C(=O)CN1CCC[C@H]1Cn1cnc2ccccc21 ZINC000537678897 938352219 /nfs/dbraw/zinc/35/22/19/938352219.db2.gz WCWKUIWXMPAHRX-PXNSSMCTSA-N 0 3 408.571 4.098 20 0 HIADHN C[C@@H]1CCN(Cc2cn(Cc3ccccc3)nc2-c2cccnc2)C[C@@H]1n1ccnc1 ZINC000537724927 938363754 /nfs/dbraw/zinc/36/37/54/938363754.db2.gz JHFFSXVZGCVBRS-YKSBVNFPSA-N 0 3 412.541 4.273 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)c2cc(C3CC3)n(C(C)(C)C)n2)cc1 ZINC000537730333 938364877 /nfs/dbraw/zinc/36/48/77/938364877.db2.gz MVNPZEDLZVYQTG-NRFANRHFSA-N 0 3 410.562 4.091 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)C3(Cc4ccc(Cl)cc4)CC3)CC2)C[C@H](C)O1 ZINC000537747628 938368587 /nfs/dbraw/zinc/36/85/87/938368587.db2.gz NIAXWJAEHMSGCK-HDICACEKSA-N 0 3 404.982 4.011 20 0 HIADHN Cc1nc([C@@H](NC(=O)c2cccc(CN3CCCC3)c2)c2ccc(Cl)cc2)no1 ZINC000537792651 938377149 /nfs/dbraw/zinc/37/71/49/938377149.db2.gz PZTWODZIBIIHEH-FQEVSTJZSA-N 0 3 410.905 4.147 20 0 HIADHN C[C@H](NC(=O)N1CCO[C@H](CN(C)C)C1)c1ccc(-c2ccc(Cl)cc2)s1 ZINC000537814604 938383411 /nfs/dbraw/zinc/38/34/11/938383411.db2.gz FGCUPTNCEFKVQO-WMLDXEAASA-N 0 3 407.967 4.102 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@@H](c1ccccc1)[C@@H]1CCOC1)c1ccsc1 ZINC000537856489 938391364 /nfs/dbraw/zinc/39/13/64/938391364.db2.gz FUFIGZJETUNHNK-NRSPTQNISA-N 0 3 401.576 4.208 20 0 HIADHN Cc1c([C@H](C)NCc2ccc(NS(C)(=O)=O)cc2)cnn1-c1cc(C)ccc1C ZINC000537918791 938413120 /nfs/dbraw/zinc/41/31/20/938413120.db2.gz MIQOMVLXVQTNJZ-KRWDZBQOSA-N 0 3 412.559 4.020 20 0 HIADHN COc1cccc(COCCN[C@@H](C)c2ccc(S(=O)(=O)C3CCCC3)cc2)c1 ZINC000537942918 938426419 /nfs/dbraw/zinc/42/64/19/938426419.db2.gz UQUYEPTUVIWFNC-SFHVURJKSA-N 0 3 417.571 4.279 20 0 HIADHN C[C@@H]1C[C@@H](N[C@@H]2CCCN(CC(F)(F)F)C2=O)c2cccc(Br)c21 ZINC000537948298 938428851 /nfs/dbraw/zinc/42/88/51/938428851.db2.gz GMLSZXOWECMRSV-LERXQTSPSA-N 0 3 405.258 4.140 20 0 HIADHN COCCC[C@H](NCC(=O)N(C)C1CCCCC1)c1ccc(Br)cc1 ZINC000537955397 938432638 /nfs/dbraw/zinc/43/26/38/938432638.db2.gz UZOSLUZLQRWBGH-IBGZPJMESA-N 0 3 411.384 4.298 20 0 HIADHN Cc1c([C@H](C)NCCC[C@H]2CCCC[C@@H]2O)nnn1-c1cccc(Br)c1 ZINC000537957922 938433053 /nfs/dbraw/zinc/43/30/53/938433053.db2.gz YYWWSTXTLILCHW-GMBSWORKSA-N 0 3 421.383 4.320 20 0 HIADHN C[C@@H](NC[C@H]1CCCN(c2nccn3cnnc23)C1)c1cc(Cl)sc1Cl ZINC000537959439 938434794 /nfs/dbraw/zinc/43/47/94/938434794.db2.gz GVWIZCOASNIVAV-VXGBXAGGSA-N 0 3 411.362 4.060 20 0 HIADHN C[C@@H]1Cc2ccc(F)cc2[C@@H]1NCc1ccc(Br)cc1N1CCOCC1 ZINC000537960616 938435535 /nfs/dbraw/zinc/43/55/35/938435535.db2.gz BNYISQPYRKBBDS-SPLOXXLWSA-N 0 3 419.338 4.448 20 0 HIADHN Cc1ccccc1NC(=O)C[C@H](C)N[C@@H](c1ccc(Cl)cc1)[C@@H]1CN(C)CCO1 ZINC000537963370 938436623 /nfs/dbraw/zinc/43/66/23/938436623.db2.gz JMTKJMFQHHBPET-HYVJGQCMSA-N 0 3 415.965 4.027 20 0 HIADHN COc1ccc(CN[C@H](C)c2ccc(S(=O)(=O)N3CCCCC3)cc2)c(C)c1 ZINC000537963449 938436647 /nfs/dbraw/zinc/43/66/47/938436647.db2.gz LYTBUDVJDBSLPA-GOSISDBHSA-N 0 3 402.560 4.029 20 0 HIADHN CCSc1ccc([C@@H](C)NCc2ccc(CS(=O)(=O)NC(C)C)cc2)cc1 ZINC000537965496 938437988 /nfs/dbraw/zinc/43/79/88/938437988.db2.gz ONLOSUKLZCLBJE-QGZVFWFLSA-N 0 3 406.617 4.477 20 0 HIADHN O=C1CCCN1Cc1cccc(CN[C@H]2CCc3c2cc(Br)cc3F)c1 ZINC000537974868 938444109 /nfs/dbraw/zinc/44/41/09/938444109.db2.gz RWGAPLWZYGUWLD-FQEVSTJZSA-N 0 3 417.322 4.488 20 0 HIADHN COc1ccc(CN2CC[C@H](N[C@@H](C)c3ccc(OC)c4ccccc43)C2=O)cc1 ZINC000537983183 938448005 /nfs/dbraw/zinc/44/80/05/938448005.db2.gz BCFICYWBEUNRFG-SBUREZEXSA-N 0 3 404.510 4.309 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)c1ccc(-c2noc(C(F)F)n2)cc1 ZINC000538002519 938457913 /nfs/dbraw/zinc/45/79/13/938457913.db2.gz OGAKKJWDLQGGGS-GOSISDBHSA-N 0 3 412.440 4.241 20 0 HIADHN C[C@H](NCc1nnc(-c2ccc(Br)cc2)[nH]1)c1ccc(-n2ccnc2)cc1 ZINC000538017502 938463253 /nfs/dbraw/zinc/46/32/53/938463253.db2.gz DSVKAMCQAMTBBL-AWEZNQCLSA-N 0 3 423.318 4.271 20 0 HIADHN C[C@H]([NH2+]Cc1nnc(-c2ccc(Br)cc2)[n-]1)c1ccc(-n2ccnc2)cc1 ZINC000538017502 938463254 /nfs/dbraw/zinc/46/32/54/938463254.db2.gz DSVKAMCQAMTBBL-AWEZNQCLSA-N 0 3 423.318 4.271 20 0 HIADHN COc1cc(OC)c(OC)cc1CN[C@H](C)[C@H](OC)c1ccc(Br)cc1 ZINC000538018237 938464284 /nfs/dbraw/zinc/46/42/84/938464284.db2.gz MZNSCYNYLHUQIG-XCLFUZPHSA-N 0 3 424.335 4.341 20 0 HIADHN COc1cc(OC)c(OC)cc1CN[C@@H](C)[C@@H](OC)c1ccc(Br)cc1 ZINC000538018236 938464409 /nfs/dbraw/zinc/46/44/09/938464409.db2.gz MZNSCYNYLHUQIG-RNODOKPDSA-N 0 3 424.335 4.341 20 0 HIADHN CN(CCCN1CCN(C)CC1)C(=O)c1ccc(Sc2ccc(Cl)cc2)cc1 ZINC000538021834 938466587 /nfs/dbraw/zinc/46/65/87/938466587.db2.gz WAGJVUDHWHLMDW-UHFFFAOYSA-N 0 3 418.006 4.201 20 0 HIADHN C[C@@H](N[C@H]1CC(=O)N(c2cccc(C(F)(F)F)c2)C1)c1ccc2c(c1)CCC(=O)N2 ZINC000538021837 938466727 /nfs/dbraw/zinc/46/67/27/938466727.db2.gz UZZCTWLMSRTFTD-DYVFJYSZSA-N 0 3 417.431 4.046 20 0 HIADHN C[C@H](NC[C@H](c1ccc(F)cc1)N1CCOCC1)c1nc2ccc(Cl)cc2n1C ZINC000538061178 938491054 /nfs/dbraw/zinc/49/10/54/938491054.db2.gz DYGRBKOOCRBHNN-YCRPNKLZSA-N 0 3 416.928 4.090 20 0 HIADHN CC(C)[C@H](NCc1ccc(N2C[C@@H](C)O[C@@H](C)C2)nc1)c1ccc2[nH]c(=O)oc2c1 ZINC000538062029 938491219 /nfs/dbraw/zinc/49/12/19/938491219.db2.gz KLEWFIZKUFFBHJ-DMPWYTOCSA-N 0 3 410.518 4.029 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)N[C@H]1CCO[C@@H]1c1ccc(Cl)c(F)c1 ZINC000538081724 938497548 /nfs/dbraw/zinc/49/75/48/938497548.db2.gz GUXVQYHEAKTWQZ-FXAWDEMLSA-N 0 3 421.900 4.201 20 0 HIADHN COc1cc([C@@H](C)N[C@@H]2CCc3c2cccc3Br)ccc1OCCO ZINC000538099830 938501595 /nfs/dbraw/zinc/50/15/95/938501595.db2.gz CTKSKBJNCDKQRX-FZKQIMNGSA-N 0 3 406.320 4.167 20 0 HIADHN COc1cc([C@H](C)N[C@H](C)c2ccc(S(N)(=O)=O)cc2)ccc1OCCC(C)C ZINC000538116473 938506825 /nfs/dbraw/zinc/50/68/25/938506825.db2.gz LFTCSQMWBLFRTO-SJORKVTESA-N 0 3 420.575 4.179 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(OCc2cccnc2)cc1)C(=O)N(C)Cc1cccc(F)c1 ZINC000538123746 938509801 /nfs/dbraw/zinc/50/98/01/938509801.db2.gz AZAPTSQPFZMBHQ-OALUTQOASA-N 0 3 421.516 4.497 20 0 HIADHN COCCOc1ccc(C(F)(F)F)cc1NC(=O)CN[C@H](C)c1ccc(C)cc1 ZINC000538128109 938513478 /nfs/dbraw/zinc/51/34/78/938513478.db2.gz GSJMCFOJPCJLMX-OAHLLOKOSA-N 0 3 410.436 4.328 20 0 HIADHN COc1ccc(CNC(=O)CN[C@@H](Cc2ccc(F)cc2)c2ccc(OC)cc2)cc1 ZINC000538176311 938537265 /nfs/dbraw/zinc/53/72/65/938537265.db2.gz XNVHNSCAFHTBIZ-DEOSSOPVSA-N 0 3 422.500 4.033 20 0 HIADHN O=C1[C@@H](N[C@@H](c2ccc(Br)cc2)C2CCC2)CCN1CC(F)(F)F ZINC000538177399 938538082 /nfs/dbraw/zinc/53/80/82/938538082.db2.gz UKVDTTSJNNENLH-LSDHHAIUSA-N 0 3 405.258 4.043 20 0 HIADHN CC(C)(C)C[C@H](NCC(=O)Nc1ccc(CN2CCOCC2)cc1)c1ccccc1 ZINC000538179108 938540145 /nfs/dbraw/zinc/54/01/45/938540145.db2.gz KHWLTEJBMYYIQB-QHCPKHFHSA-N 0 3 409.574 4.224 20 0 HIADHN O=C(CN[C@@H](c1ccccc1)[C@@H]1CCOC1)Nc1nc(-c2ccc(F)cc2)cs1 ZINC000538187471 938543707 /nfs/dbraw/zinc/54/37/07/938543707.db2.gz HVJIKYNJVYECEJ-UTKZUKDTSA-N 0 3 411.502 4.255 20 0 HIADHN COc1cc(F)c([C@H](C)NC[C@H](O)Cc2ccccc2C(F)(F)F)cc1OC ZINC000538198464 938550777 /nfs/dbraw/zinc/55/07/77/938550777.db2.gz SIDUUFVYGVJPIV-GXTWGEPZSA-N 0 3 401.400 4.116 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)Nc1c(F)cc(Cl)cc1F ZINC000538206434 938554534 /nfs/dbraw/zinc/55/45/34/938554534.db2.gz OGVOIXROPPMTKM-UHFFFAOYSA-N 0 3 403.807 4.492 20 0 HIADHN O=C(CN[C@H](C[C@@H]1CCOC1)c1ccccc1)NCC1(c2ccccc2)CCCC1 ZINC000538225881 938564895 /nfs/dbraw/zinc/56/48/95/938564895.db2.gz JMLAHBMRZMQACN-XUZZJYLKSA-N 0 3 406.570 4.372 20 0 HIADHN COc1cc(Cl)c(C)cc1NC(=O)CN[C@@H](C[C@H]1CCOC1)c1ccccc1 ZINC000538225782 938565073 /nfs/dbraw/zinc/56/50/73/938565073.db2.gz WLMQNZOMDIFXLY-APWZRJJASA-N 0 3 402.922 4.353 20 0 HIADHN O=C(CN[C@H](C[C@H]1CCOC1)c1ccccc1)Nc1ccccc1Br ZINC000538232531 938567393 /nfs/dbraw/zinc/56/73/93/938567393.db2.gz DFEQGFJRPLTHRW-DNVCBOLYSA-N 0 3 403.320 4.145 20 0 HIADHN COc1ccc(CNC(=O)[C@@H](C)N[C@H](C)c2ccc(-c3ccncc3)cc2)cc1OC ZINC000538235833 938568458 /nfs/dbraw/zinc/56/84/58/938568458.db2.gz PYGZZVIOZDXXHB-QZTJIDSGSA-N 0 3 419.525 4.121 20 0 HIADHN COc1ccc(CNC(=O)[C@H](C)N[C@H](C)c2ccc(-c3ccncc3)cc2)cc1OC ZINC000538235832 938568639 /nfs/dbraw/zinc/56/86/39/938568639.db2.gz PYGZZVIOZDXXHB-MSOLQXFVSA-N 0 3 419.525 4.121 20 0 HIADHN Cc1cc(NC(=O)CN[C@@H](C)c2ccc(-n3cccn3)cc2)ccc1Br ZINC000538236976 938569430 /nfs/dbraw/zinc/56/94/30/938569430.db2.gz GCMACIQIWCAPJW-HNNXBMFYSA-N 0 3 413.319 4.233 20 0 HIADHN CS(=O)(=O)c1ccc(OCCN[C@@H](Cc2ccccc2)c2ccccc2F)cc1 ZINC000538257021 938576091 /nfs/dbraw/zinc/57/60/91/938576091.db2.gz GGSGOESLCJDIPE-QHCPKHFHSA-N 0 3 413.514 4.182 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)Nc1cccc(N2CCCC2=O)c1)c1cccc(N2CCCC2)c1 ZINC000538277406 938581533 /nfs/dbraw/zinc/58/15/33/938581533.db2.gz TXKYXCCNBGPFNL-MOPGFXCFSA-N 0 3 420.557 4.091 20 0 HIADHN C[C@H](NCC(=O)Nc1ccc(Br)cc1)c1cccc(N2CCCC2)c1 ZINC000538280835 938582522 /nfs/dbraw/zinc/58/25/22/938582522.db2.gz WGMLJNDSGVNLCD-HNNXBMFYSA-N 0 3 402.336 4.339 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)c1cc(OC(F)F)cc(OC(F)F)c1 ZINC000538297494 938586274 /nfs/dbraw/zinc/58/62/74/938586274.db2.gz XSIBUZTWEIZAJO-UHFFFAOYSA-N 0 3 416.371 4.212 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)Nc1ccc2c(c1)N(C)CC2 ZINC000538322370 938592205 /nfs/dbraw/zinc/59/22/05/938592205.db2.gz USDZCQRBBDKBRE-UHFFFAOYSA-N 0 3 420.479 4.293 20 0 HIADHN CN(CC[C@@H]1CCCCN1C)C(=O)Nc1ccc(Cl)cc1C(=O)c1ccc[nH]1 ZINC000538352274 938601454 /nfs/dbraw/zinc/60/14/54/938601454.db2.gz UZRWRRQJBCHRDQ-INIZCTEOSA-N 0 3 402.926 4.237 20 0 HIADHN C[C@@H](NC(=O)CN[C@@H](c1ccc2c(c1)OCCO2)C1CC1)c1ccc(Cl)cc1 ZINC000538391873 938609583 /nfs/dbraw/zinc/60/95/83/938609583.db2.gz ZXIOERIQPFXSTC-JLCFBVMHSA-N 0 3 400.906 4.029 20 0 HIADHN OCC1(CNCc2c(Cl)cccc2OCc2ccccc2Cl)CCOCC1 ZINC000538427723 938617743 /nfs/dbraw/zinc/61/77/43/938617743.db2.gz NKMKUYLKQVJAPQ-UHFFFAOYSA-N 0 3 410.341 4.451 20 0 HIADHN CN(C)Cc1cccc(NC(=O)C(=O)N[C@@H]2C[C@@H]3CCC(C)(C)c4cccc2c43)c1 ZINC000538483231 938632149 /nfs/dbraw/zinc/63/21/49/938632149.db2.gz DYRQLKBRTNGAJD-LAUBAEHRSA-N 0 3 405.542 4.103 20 0 HIADHN COc1ccc([C@@H](C)N[C@H](Cc2ccccc2)C(=O)NCc2ccccc2)cc1OC ZINC000538553336 938647629 /nfs/dbraw/zinc/64/76/29/938647629.db2.gz DEMRTPDYVCIAGS-AUSIDOKSSA-N 0 3 418.537 4.282 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)c1cc(C)n(-c2ccc(C)cc2)n1 ZINC000538572685 938652602 /nfs/dbraw/zinc/65/26/02/938652602.db2.gz IDTGRXNOZKQWDC-QHCPKHFHSA-N 0 3 417.557 4.011 20 0 HIADHN CNC(=O)CC1CCN(Cc2cn(-c3ccc(F)cc3)nc2-c2ccc(C)cc2)CC1 ZINC000538719328 938690243 /nfs/dbraw/zinc/69/02/43/938690243.db2.gz CEFDGXIEUMTSFO-UHFFFAOYSA-N 0 3 420.532 4.335 20 0 HIADHN Brc1ccccc1-c1ccc(CN2CCN(C[C@@H]3CCOC3)CC2)s1 ZINC000538723230 938691841 /nfs/dbraw/zinc/69/18/41/938691841.db2.gz QDBKCCNLCADXDX-INIZCTEOSA-N 0 3 421.404 4.332 20 0 HIADHN O=C([C@H]1CCCN(Cc2cc3ccccc3nc2N2CCCCC2)C1)N1CCCC1 ZINC000538730262 938695072 /nfs/dbraw/zinc/69/50/72/938695072.db2.gz VHLLTCRKVUYASG-NRFANRHFSA-N 0 3 406.574 4.060 20 0 HIADHN C/C(=C/c1ccccc1)CN1CCC(C(=O)c2ccc3c(c2)NC(=O)[C@@H](C)O3)CC1 ZINC000538739616 938697870 /nfs/dbraw/zinc/69/78/70/938697870.db2.gz INTVNIBWZUHDOQ-HGLWPWQMSA-N 0 3 404.510 4.404 20 0 HIADHN COc1cc(CN(CCO)[C@H]2CCc3ccccc32)ccc1OCc1ccncc1 ZINC000538740058 938698323 /nfs/dbraw/zinc/69/83/23/938698323.db2.gz FYHWNFQNVDDQCK-QHCPKHFHSA-N 0 3 404.510 4.151 20 0 HIADHN C[C@@H](NCc1cc(C(F)(F)F)ccc1N1CCN(C)CC1)c1ccccc1N(C)C ZINC000538747068 938700424 /nfs/dbraw/zinc/70/04/24/938700424.db2.gz ZSTWBEKMTHOKJR-QGZVFWFLSA-N 0 3 420.523 4.374 20 0 HIADHN COc1cc(CN2CC[C@](C)(CCc3ccccc3)C2)cc(Cl)c1OCC(N)=O ZINC000538751020 938701631 /nfs/dbraw/zinc/70/16/31/938701631.db2.gz KVHMSRJTRZSTMU-QHCPKHFHSA-N 0 3 416.949 4.058 20 0 HIADHN COc1c(C)cc(CN2CCCN(Cc3csc([C@@H](C)OC)n3)CC2)cc1C ZINC000538811952 938719062 /nfs/dbraw/zinc/71/90/62/938719062.db2.gz PMGUQNJSYCNREE-GOSISDBHSA-N 0 3 403.592 4.184 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)c2cc(C)n(-c3nccs3)c2C)cc1 ZINC000538830397 938721223 /nfs/dbraw/zinc/72/12/23/938721223.db2.gz LJLXIWKSBWCRQX-NRFANRHFSA-N 0 3 424.570 4.126 20 0 HIADHN COCCc1nc(C)c([C@H](C)NCc2ccc(CN3C[C@H](C)O[C@@H](C)C3)cc2)s1 ZINC000538867697 938728154 /nfs/dbraw/zinc/72/81/54/938728154.db2.gz PFXTXNFIXDWDED-BZSNNMDCSA-N 0 3 417.619 4.100 20 0 HIADHN CNS(=O)(=O)c1cccc([C@H](C)N[C@H]2CCCc3ccc(Br)cc32)c1 ZINC000538868638 938728341 /nfs/dbraw/zinc/72/83/41/938728341.db2.gz BXPJYWXMDAJLBG-DJJJIMSYSA-N 0 3 423.376 4.085 20 0 HIADHN CC(C)N(Cc1cccnc1)C[C@@H](O)COc1ccc(Cl)cc1Br ZINC000538996596 938763673 /nfs/dbraw/zinc/76/36/73/938763673.db2.gz BLLTVFDYUFFVBM-MRXNPFEDSA-N 0 3 413.743 4.148 20 0 HIADHN C[C@H]1Cc2ccc(F)cc2[C@H]1NCc1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000539018473 938770518 /nfs/dbraw/zinc/77/05/18/938770518.db2.gz LZUXFYICPOWDOP-AOMKIAJQSA-N 0 3 402.535 4.023 20 0 HIADHN Cc1ccc(NC(=O)C[C@H](C)N[C@@H](CO)c2ccc(Br)cc2)c(C)c1 ZINC000539045744 938780900 /nfs/dbraw/zinc/78/09/00/938780900.db2.gz BLLSPJJGFXJRQM-KXBFYZLASA-N 0 3 405.336 4.106 20 0 HIADHN CCOc1ccc([C@@H](CC)N[C@@H]2CCCN(CC(F)(F)F)C2=O)cc1OCC ZINC000539052566 938783912 /nfs/dbraw/zinc/78/39/12/938783912.db2.gz MHIZICRIYQQOLZ-HZPDHXFCSA-N 0 3 402.457 4.078 20 0 HIADHN Cc1ccc([C@H](C)NCc2ccccc2CS(=O)(=O)N2CCC(C)CC2)s1 ZINC000539054014 938785048 /nfs/dbraw/zinc/78/50/48/938785048.db2.gz KHSXMNNOGUZBEU-SFHVURJKSA-N 0 3 406.617 4.469 20 0 HIADHN CC[C@H]([NH2+]Cc1nnc(-c2ccc(Br)cc2)[n-]1)c1ccc(OC)cc1 ZINC000539056370 938785541 /nfs/dbraw/zinc/78/55/41/938785541.db2.gz IRMJVSVHMPJCGM-KRWDZBQOSA-N 0 3 401.308 4.484 20 0 HIADHN CC[C@H](NCc1nnc(-c2ccc(Br)cc2)[nH]1)c1ccc(OC)cc1 ZINC000539056370 938785544 /nfs/dbraw/zinc/78/55/44/938785544.db2.gz IRMJVSVHMPJCGM-KRWDZBQOSA-N 0 3 401.308 4.484 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)N[C@H](CO)c2cccc(Br)c2)cc1 ZINC000539066544 938790423 /nfs/dbraw/zinc/79/04/23/938790423.db2.gz OPHANUWVAKCYNI-VBKZILBWSA-N 0 3 400.320 4.327 20 0 HIADHN Cc1c([C@H](C)NCCNC(=O)c2c(F)cccc2F)cnn1-c1cccc(Cl)c1 ZINC000539079442 938797385 /nfs/dbraw/zinc/79/73/85/938797385.db2.gz TTZULEYZRNVLQV-ZDUSSCGKSA-N 0 3 418.875 4.193 20 0 HIADHN C[C@H](NCCNC(=O)c1cccc(Br)c1)c1cnc2ccsc2c1 ZINC000539081423 938798051 /nfs/dbraw/zinc/79/80/51/938798051.db2.gz KMKGKFTYIGTOAQ-LBPRGKRZSA-N 0 3 404.333 4.139 20 0 HIADHN CCN(CC)C(=O)Nc1ccc([C@H](C)N[C@@H]2C[C@@H](C)N(c3ccccc3)C2=O)cc1 ZINC000539090054 938800714 /nfs/dbraw/zinc/80/07/14/938800714.db2.gz YSNGKEYMHRLTKX-KGVIQGDOSA-N 0 3 408.546 4.405 20 0 HIADHN COC[C@H](N[C@H](C)CC(=O)Nc1ccc(OC(F)(F)F)cc1)c1ccc(F)cc1 ZINC000539090006 938800790 /nfs/dbraw/zinc/80/07/90/938800790.db2.gz GGHWMZZNBXLEIA-ACJLOTCBSA-N 0 3 414.399 4.419 20 0 HIADHN COc1ccc2c(c1)[C@H](NCc1ccc(C(=O)N3C[C@@H](C)O[C@@H](C)C3)cc1)CCC2 ZINC000539091077 938800977 /nfs/dbraw/zinc/80/09/77/938800977.db2.gz FWAGTXBUDKCYIH-NXMSCROESA-N 0 3 408.542 4.112 20 0 HIADHN CC[C@H](NCc1ccccc1OCC(=O)NC[C@@H]1CCCO1)c1ccc(Cl)cc1 ZINC000539091168 938801098 /nfs/dbraw/zinc/80/10/98/938801098.db2.gz GYBKPEDFARRXFC-SFTDATJTSA-N 0 3 416.949 4.255 20 0 HIADHN CCCN1c2ccc(NC(=O)N[C@@H]3C[C@H](C)N(Cc4ccccc4)C3)cc2CCC1=O ZINC000539130787 938808217 /nfs/dbraw/zinc/80/82/17/938808217.db2.gz OKGPDALXNACYPD-PGRDOPGGSA-N 0 3 420.557 4.160 20 0 HIADHN O=S1(=O)CCc2cc(CN[C@@H](c3ccc(Br)cc3)C3CC3)ccc21 ZINC000539216104 938819979 /nfs/dbraw/zinc/81/99/79/938819979.db2.gz CHPMXDUJRAYILM-LJQANCHMSA-N 0 3 406.345 4.020 20 0 HIADHN COc1ccc([C@H](CN[C@@H](C)c2nc3ccc(Cl)cc3n2C)N(C)C)cc1OC ZINC000539217547 938820089 /nfs/dbraw/zinc/82/00/89/938820089.db2.gz XUJUKACSQKLNEH-LIRRHRJNSA-N 0 3 416.953 4.197 20 0 HIADHN Cc1cc([C@@H](NCc2ccccc2CS(=O)(=O)N2CCCC2)C2CC2)ccc1F ZINC000539217679 938820276 /nfs/dbraw/zinc/82/02/76/938820276.db2.gz ZNZGBAWAMZFLKY-QHCPKHFHSA-N 0 3 416.562 4.301 20 0 HIADHN COc1ccccc1CNC(=O)[C@@H](C)N[C@@H](C)c1ccc(OCc2cccnc2)cc1 ZINC000539225234 938821421 /nfs/dbraw/zinc/82/14/21/938821421.db2.gz GUZSETJUVUNYSG-RBUKOAKNSA-N 0 3 419.525 4.025 20 0 HIADHN Cc1cccc(OC[C@H](O)CN[C@H](C)c2cccc(NC(=O)c3ccccc3)c2)c1 ZINC000539232683 938822776 /nfs/dbraw/zinc/82/27/76/938822776.db2.gz CNHTZBWKEFCHNS-AUSIDOKSSA-N 0 3 404.510 4.338 20 0 HIADHN CC[C@@H](NCC(=O)N1CCC[C@H]1c1ccc(OC)cc1OC)c1ccc(OC)cc1 ZINC000539241157 938824042 /nfs/dbraw/zinc/82/40/42/938824042.db2.gz AMXJEMOHZIBALD-YADHBBJMSA-N 0 3 412.530 4.117 20 0 HIADHN CC[C@H](NCC(=O)N1CCC[C@H]1c1ccc(OC)cc1OC)c1ccc(OC)cc1 ZINC000539241155 938824193 /nfs/dbraw/zinc/82/41/93/938824193.db2.gz AMXJEMOHZIBALD-VXKWHMMOSA-N 0 3 412.530 4.117 20 0 HIADHN Cc1cc(NC(=O)CN[C@@H](C)c2ccccc2-n2cccn2)ccc1Br ZINC000539261069 938828913 /nfs/dbraw/zinc/82/89/13/938828913.db2.gz XUYRENRNMPEFJL-HNNXBMFYSA-N 0 3 413.319 4.233 20 0 HIADHN COc1ccc(C[C@@H](NCC(=O)Nc2cccc(F)c2)c2ccccc2)cc1OC ZINC000539261545 938829156 /nfs/dbraw/zinc/82/91/56/938829156.db2.gz SISSDFXOJDEWQV-OAQYLSRUSA-N 0 3 408.473 4.355 20 0 HIADHN Cc1ccccc1[C@@H](CC(C)C)NCC(=O)N1CCC(C(=O)NCCC(C)C)CC1 ZINC000539261682 938829290 /nfs/dbraw/zinc/82/92/90/938829290.db2.gz SLZJGLLICNJWHK-HSZRJFAPSA-N 0 3 415.622 4.073 20 0 HIADHN CC(=O)Nc1ccc(S(=O)(=O)CCCN[C@H](c2ccccc2Cl)C(C)C)cc1 ZINC000539287576 938833870 /nfs/dbraw/zinc/83/38/70/938833870.db2.gz RQBAUYBMGVLIIQ-NRFANRHFSA-N 0 3 422.978 4.449 20 0 HIADHN COc1ccc(-c2csc(NC(=O)CN[C@@H](c3ccccc3)[C@@H]3CCOC3)n2)cc1 ZINC000539289386 938834093 /nfs/dbraw/zinc/83/40/93/938834093.db2.gz MWUYXUUTPZGUJU-GCJKJVERSA-N 0 3 423.538 4.125 20 0 HIADHN CCOC(=O)c1c2c(sc1NC(=O)[C@@H]1CCC(=O)[C@@H](C)C1)C(C)(C)NC(C)(C)C2 ZINC000539298206 938836152 /nfs/dbraw/zinc/83/61/52/938836152.db2.gz PTJMRCBQBQWRCM-QWHCGFSZSA-N 0 3 420.575 4.028 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(NC(=O)c2ccncc2)cc1)C(=O)NCCC1=CCCCC1 ZINC000539298310 938836220 /nfs/dbraw/zinc/83/62/20/938836220.db2.gz ORVGMPYXQKPQTF-RTBURBONSA-N 0 3 420.557 4.380 20 0 HIADHN CC(C)(C)c1ccc(C(C)(C)NCC(=O)Nc2ccccc2SCC(N)=O)cc1 ZINC000539307315 938838037 /nfs/dbraw/zinc/83/80/37/938838037.db2.gz HOUNMUZYQAWBKN-UHFFFAOYSA-N 0 3 413.587 4.025 20 0 HIADHN C[C@H](NC[C@H](O)COc1ccc2ccccc2c1)c1cccc(N2CCCC2=O)c1 ZINC000539308744 938838357 /nfs/dbraw/zinc/83/83/57/938838357.db2.gz KDHQSUWPPFQYHK-MBSDFSHPSA-N 0 3 404.510 4.057 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@H](C)NCc2ccccc2OC(F)F)CC1 ZINC000539309865 938838587 /nfs/dbraw/zinc/83/85/87/938838587.db2.gz BNRRPYIXZKMAQD-INIZCTEOSA-N 0 3 407.480 4.420 20 0 HIADHN COc1ccc(CN(C)C(=O)CN[C@@H](c2ccc(F)cc2)C2CCCC2)cc1OC ZINC000539310264 938838847 /nfs/dbraw/zinc/83/88/47/938838847.db2.gz OJIPUQRCKOHKRR-XMMPIXPASA-N 0 3 414.521 4.322 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1NC(=O)CN[C@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000539326900 938842028 /nfs/dbraw/zinc/84/20/28/938842028.db2.gz ZFHKHENHMXXSTF-NZQKXSOJSA-N 0 3 418.541 4.185 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)Nc1ccc(Cl)cc1Cl)c1ccc(-n2ccnn2)cc1 ZINC000539328950 938842644 /nfs/dbraw/zinc/84/26/44/938842644.db2.gz UDCMJLKIYVSPJJ-OLZOCXBDSA-N 0 3 404.301 4.252 20 0 HIADHN C[C@@H](NCC(=O)N[C@@H](C)c1ccc(Cl)c(Cl)c1)c1ccc(-n2ccnn2)cc1 ZINC000539330522 938842876 /nfs/dbraw/zinc/84/28/76/938842876.db2.gz QZCCYEPCDODZKX-KGLIPLIRSA-N 0 3 418.328 4.102 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)N[C@@H]1CCOc2ccccc21)c1ccc(-c2cccnc2)cc1 ZINC000539332285 938843142 /nfs/dbraw/zinc/84/31/42/938843142.db2.gz OYMFYBPVIPPLTL-IEGUWTFLSA-N 0 3 401.510 4.428 20 0 HIADHN CCOc1ccc([C@@H]2CCCN2C(=O)CN[C@@H](C)c2ccc(-n3cccn3)cc2)cc1 ZINC000539337716 938844341 /nfs/dbraw/zinc/84/43/41/938844341.db2.gz USNMFBHNMZWMDX-CYFREDJKSA-N 0 3 418.541 4.285 20 0 HIADHN C[C@@H](NCC(=O)N(Cc1ccco1)c1ccccc1)c1ccc(-n2cccn2)cc1 ZINC000539339461 938844896 /nfs/dbraw/zinc/84/48/96/938844896.db2.gz ZVXQVGZFSXVEBT-LJQANCHMSA-N 0 3 400.482 4.349 20 0 HIADHN CC[C@H](NCC(=O)Nc1cccc(CN2CCSCC2)c1)c1cc(F)ccc1F ZINC000539360633 938848376 /nfs/dbraw/zinc/84/83/76/938848376.db2.gz NABCJJBWPQIKRI-NRFANRHFSA-N 0 3 419.541 4.193 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)NCC(=O)Nc2ccccc2OC(F)F)cc1 ZINC000539368175 938849779 /nfs/dbraw/zinc/84/97/79/938849779.db2.gz GMLVKBQYONCUHY-CQSZACIVSA-N 0 3 400.429 4.071 20 0 HIADHN COCc1cccc(OCC2(CN3CCN(CCc4cccs4)CC3)CCC2)c1 ZINC000539413802 938857206 /nfs/dbraw/zinc/85/72/06/938857206.db2.gz VGGCBSBZTRUTCI-UHFFFAOYSA-N 0 3 414.615 4.304 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)N[C@@H]1CCO[C@@H]1c1ccc(F)c(F)c1 ZINC000539439698 938860583 /nfs/dbraw/zinc/86/05/83/938860583.db2.gz PAQZQKNMIHVBKE-UYAOXDASSA-N 0 3 400.425 4.033 20 0 HIADHN Cc1cccc(NC(=O)N(CCN(C)C)Cc2ccc(Br)cc2)c1F ZINC000539491080 938867640 /nfs/dbraw/zinc/86/76/40/938867640.db2.gz NFPIIHWMOYLIOY-UHFFFAOYSA-N 0 3 408.315 4.492 20 0 HIADHN Cc1ccc(NC(=O)[C@H](C)N[C@@H](c2ccc3c(c2)OCCO3)C2CC2)c(Cl)c1 ZINC000539492366 938867950 /nfs/dbraw/zinc/86/79/50/938867950.db2.gz RLUZCMAHLGLZLL-LHSJRXKWSA-N 0 3 400.906 4.488 20 0 HIADHN CCOc1ccccc1[C@H](CC)NC(=O)CN[C@@H](c1ccc2c(c1)OCCO2)C1CC1 ZINC000539491673 938867999 /nfs/dbraw/zinc/86/79/99/938867999.db2.gz XGUYGKKYOQJOAV-NBGIEHNGSA-N 0 3 424.541 4.165 20 0 HIADHN CCOc1cccc2cc([C@H](C)N[C@H](CN3CCN(C)CC3)c3ccccc3)oc21 ZINC000539497798 938868848 /nfs/dbraw/zinc/86/88/48/938868848.db2.gz YETUQIJTBBWBEP-SIKLNZKXSA-N 0 3 407.558 4.471 20 0 HIADHN COC(=O)c1cc(CNC2CCN(Cc3ccc(Cl)c(Cl)c3)CC2)oc1C ZINC000539502714 938869498 /nfs/dbraw/zinc/86/94/98/938869498.db2.gz PPKDDAKNUVMKBK-UHFFFAOYSA-N 0 3 411.329 4.436 20 0 HIADHN COc1ccc([C@@H](C)NCCCN(C(=O)C2CCC2)C2CC2)c(Br)c1 ZINC000539509373 938870752 /nfs/dbraw/zinc/87/07/52/938870752.db2.gz YTTKKQMWCXZFEO-CQSZACIVSA-N 0 3 409.368 4.290 20 0 HIADHN CS(=O)(=O)[C@@H]1CCC[C@H](NCc2cccc(NC(=O)c3ccc(Cl)cc3)c2)C1 ZINC000539520183 938872934 /nfs/dbraw/zinc/87/29/34/938872934.db2.gz XHNDHBOBWHMUTM-AZUAARDMSA-N 0 3 420.962 4.038 20 0 HIADHN CC(C)N1CCN([C@@H]2CCN(C(=O)N[C@H]3C[C@@H]4CCC(C)(C)c5cccc3c54)C2)CC1 ZINC000539566724 938880950 /nfs/dbraw/zinc/88/09/50/938880950.db2.gz SOIGJKBHNFRCPX-MZKRTTBSSA-N 0 3 424.633 4.096 20 0 HIADHN C[C@@]1(CCCO)CCCN1CC(=O)N[C@H](c1ccccc1)c1cccc(Cl)c1 ZINC000539613638 938888078 /nfs/dbraw/zinc/88/80/78/938888078.db2.gz FOELGONGJJCKMT-PKTZIBPZSA-N 0 3 400.950 4.173 20 0 HIADHN COCCNC(=O)[C@H](CC(C)C)N[C@H](C)c1sc(-c2ccccc2F)nc1C ZINC000539690484 938902478 /nfs/dbraw/zinc/90/24/78/938902478.db2.gz RGTJWUJQUVVESP-KDOFPFPSSA-N 0 3 407.555 4.086 20 0 HIADHN COc1ccc([C@@H](C)Nc2cnn(Cc3ccncc3)c2)cc1CN1CCCCC1 ZINC000539714944 938910006 /nfs/dbraw/zinc/91/00/06/938910006.db2.gz UZMRGCXYJCMPSP-LJQANCHMSA-N 0 3 405.546 4.494 20 0 HIADHN CNC(=O)CC1CCN(Cc2cn(Cc3ccccc3)nc2-c2cccs2)CC1 ZINC000539818573 938942727 /nfs/dbraw/zinc/94/27/27/938942727.db2.gz XZTXFSVGODDUPZ-UHFFFAOYSA-N 0 3 408.571 4.008 20 0 HIADHN CN(Cc1cc(Br)c2c(c1)OCCCO2)[C@H](CCO)c1ccccc1 ZINC000539824616 938947591 /nfs/dbraw/zinc/94/75/91/938947591.db2.gz DVTAXVOZQIXHJR-GOSISDBHSA-N 0 3 406.320 4.166 20 0 HIADHN COc1ccc(CN2CCC[C@H](CNC(=O)C(C)(C)C)C2)cc1OCCC(C)C ZINC000539832639 938951575 /nfs/dbraw/zinc/95/15/75/938951575.db2.gz RJHQZNFENPRVGQ-HXUWFJFHSA-N 0 3 404.595 4.494 20 0 HIADHN CCOc1ccc(CN2CCC[C@H](C(=O)N(CC)CC(F)(F)F)C2)cc1OCC ZINC000539852190 938958059 /nfs/dbraw/zinc/95/80/59/938958059.db2.gz OYENYAFRZOZBED-KRWDZBQOSA-N 0 3 416.484 4.107 20 0 HIADHN CCOc1ccc(CN2CCC[C@@H](C(=O)N(CC)CC(F)(F)F)C2)cc1OCC ZINC000539852191 938958323 /nfs/dbraw/zinc/95/83/23/938958323.db2.gz OYENYAFRZOZBED-QGZVFWFLSA-N 0 3 416.484 4.107 20 0 HIADHN CCN(CC(F)(F)F)C(=O)[C@H]1CCCN(Cc2cnc(-c3ccsc3)s2)C1 ZINC000539852305 938958444 /nfs/dbraw/zinc/95/84/44/938958444.db2.gz UETIFNLMAZJJMK-ZDUSSCGKSA-N 0 3 417.522 4.494 20 0 HIADHN O=C(Nc1cccc(CN2CCS[C@@H]3COCC[C@@H]32)c1)c1ccc(Cl)cc1 ZINC000539909761 938976172 /nfs/dbraw/zinc/97/61/72/938976172.db2.gz HNIJCARFHJYBKA-VQTJNVASSA-N 0 3 402.947 4.299 20 0 HIADHN Clc1cc2c(c(Br)c1)CC[C@H]2NCc1cccnc1-n1cccn1 ZINC000539969897 938982512 /nfs/dbraw/zinc/98/25/12/938982512.db2.gz XDAXNBCNTLADNU-QGZVFWFLSA-N 0 3 403.711 4.460 20 0 HIADHN C[C@H]1CN(c2ccc(CN[C@@H]3CCCc4ccc(Br)cc43)cn2)CCO1 ZINC000539969697 938982624 /nfs/dbraw/zinc/98/26/24/938982624.db2.gz RRASELOAKHKKQC-MGPUTAFESA-N 0 3 416.363 4.236 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)N1CC=C(c2ccc3c(c2)OCCO3)CC1 ZINC000540025738 939042129 /nfs/dbraw/zinc/04/21/29/939042129.db2.gz ZRKUEFLCYQTUBH-UHFFFAOYSA-N 0 3 418.493 4.195 20 0 HIADHN Cc1cccnc1C(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1 ZINC000540030733 939044270 /nfs/dbraw/zinc/04/42/70/939044270.db2.gz QNKTYTUULKAMAD-UHFFFAOYSA-N 0 3 400.526 4.007 20 0 HIADHN CC(C)n1cnnc1[C@H]1CCCN(Cc2ccc(C(=O)Nc3ccccc3)cc2)C1 ZINC000540065220 939056201 /nfs/dbraw/zinc/05/62/01/939056201.db2.gz PFGNRUJIKOEJRO-NRFANRHFSA-N 0 3 403.530 4.491 20 0 HIADHN COCc1cnc(CNCC2(c3ccc(Cl)cc3Cl)CCOCC2)s1 ZINC000540069669 939057846 /nfs/dbraw/zinc/05/78/46/939057846.db2.gz GHXNDISLLLBZEU-UHFFFAOYSA-N 0 3 401.359 4.434 20 0 HIADHN Cc1cc(NC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)nn1-c1ccccc1 ZINC000540110482 939075864 /nfs/dbraw/zinc/07/58/64/939075864.db2.gz HLOLQVRQMTZEPX-LJQANCHMSA-N 0 3 403.530 4.309 20 0 HIADHN CCOCCC1(CN[C@H](C)c2nnn(-c3cccc(Br)c3)c2C)CC1 ZINC000540149086 939092084 /nfs/dbraw/zinc/09/20/84/939092084.db2.gz GDRBYEQETWMIPW-CQSZACIVSA-N 0 3 407.356 4.196 20 0 HIADHN COc1ccc([C@@H](C)NCc2ccc(COC3CCOCC3)cc2)cc1NC(C)=O ZINC000540148207 939092287 /nfs/dbraw/zinc/09/22/87/939092287.db2.gz WHWRNNMNDMUZAO-QGZVFWFLSA-N 0 3 412.530 4.200 20 0 HIADHN Cc1cccc([C@H](C)NCc2ccccc2CS(=O)(=O)N2CCC(C)CC2)c1 ZINC000540150319 939092722 /nfs/dbraw/zinc/09/27/22/939092722.db2.gz IMRBMBOZCOYZGU-FQEVSTJZSA-N 0 3 400.588 4.408 20 0 HIADHN C[C@H](CC(=O)Nc1ccccc1C(F)(F)F)NCc1cccc2c1OCCCO2 ZINC000540163575 939098119 /nfs/dbraw/zinc/09/81/19/939098119.db2.gz GRSOMEISJWSWSR-CQSZACIVSA-N 0 3 408.420 4.374 20 0 HIADHN CS(=O)(=O)Nc1cccc(CN[C@@H](Cc2cccc(F)c2)c2cccc(F)c2)c1 ZINC000540166644 939098778 /nfs/dbraw/zinc/09/87/78/939098778.db2.gz LZXCBHZWYFYBBT-QFIPXVFZSA-N 0 3 416.493 4.410 20 0 HIADHN CC[C@H](N[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O)c1cccc(Br)c1 ZINC000540180791 939107898 /nfs/dbraw/zinc/10/78/98/939107898.db2.gz BSZGRHHAKAJTFE-VQTJNVASSA-N 0 3 417.347 4.300 20 0 HIADHN O=C(NCc1ccco1)c1cccc(CN[C@@H](C[C@H]2CCOC2)c2ccccc2)c1 ZINC000540190244 939114736 /nfs/dbraw/zinc/11/47/36/939114736.db2.gz HUDGNVIVLHYMJG-YKSBVNFPSA-N 0 3 404.510 4.467 20 0 HIADHN CC(=O)Nc1cccc(OCCN[C@H](C)c2cnn(-c3cc(C)ccc3C)c2C)c1 ZINC000540193573 939118784 /nfs/dbraw/zinc/11/87/84/939118784.db2.gz AVWHBWHPNSJVIX-GOSISDBHSA-N 0 3 406.530 4.486 20 0 HIADHN Cc1nc(-c2ccc(Br)cc2)sc1[C@@H](C)N[C@@H]1CC(=O)N(C2CC2)C1 ZINC000540219648 939134828 /nfs/dbraw/zinc/13/48/28/939134828.db2.gz JOCZEYWYJWDFAZ-IAQYHMDHSA-N 0 3 420.376 4.295 20 0 HIADHN C[C@@H](N[C@@H]1CCCc2nc(-c3ccccc3Br)sc21)C(=O)N(C)C ZINC000540221070 939135746 /nfs/dbraw/zinc/13/57/46/939135746.db2.gz STNVESJCCJOQKN-BXUZGUMPSA-N 0 3 408.365 4.016 20 0 HIADHN CCc1nn(C)cc1NC(=O)NC[C@H](c1ccc(C(F)(F)F)cc1)N(CC)CC ZINC000540233239 939154502 /nfs/dbraw/zinc/15/45/02/939154502.db2.gz HDMOJJMHBUQDBE-GOSISDBHSA-N 0 3 411.472 4.206 20 0 HIADHN CCN1CCCN(C(=O)Nc2ncc(Cc3ccc(Br)cc3)s2)CC1 ZINC000540281814 939181748 /nfs/dbraw/zinc/18/17/48/939181748.db2.gz VOOAYMRNUSODES-UHFFFAOYSA-N 0 3 423.380 4.056 20 0 HIADHN CCN1CCCN(C(=O)Nc2ccc(NC(=O)c3ccco3)cc2C(F)(F)F)CC1 ZINC000540283312 939182429 /nfs/dbraw/zinc/18/24/29/939182429.db2.gz WGEGQOPRHVWHQT-UHFFFAOYSA-N 0 3 424.423 4.110 20 0 HIADHN CC[C@H](CS(=O)(=O)c1ccccc1)N[C@@H]1CCc2c1cccc2Br ZINC000540314799 939191375 /nfs/dbraw/zinc/19/13/75/939191375.db2.gz YTLGCTHZDHYULN-AUUYWEPGSA-N 0 3 408.361 4.279 20 0 HIADHN O=C1CCCN1C[C@@H](NCCOc1ccc(F)cc1)c1cccc(C(F)(F)F)c1 ZINC000540322896 939194480 /nfs/dbraw/zinc/19/44/80/939194480.db2.gz SKWHZINNAAUOMV-LJQANCHMSA-N 0 3 410.411 4.177 20 0 HIADHN CC(C)[C@@H](NCc1cccc(C(=O)NCc2ccco2)c1)c1ccc2c(c1)OCCO2 ZINC000540341819 939200367 /nfs/dbraw/zinc/20/03/67/939200367.db2.gz XMOPZVXBLCZIHP-XMMPIXPASA-N 0 3 420.509 4.468 20 0 HIADHN C[C@@H](NCC(=O)N(Cc1ccccc1)CC(F)(F)F)c1ccccc1-n1cccn1 ZINC000540359621 939208136 /nfs/dbraw/zinc/20/81/36/939208136.db2.gz DSKYDVBNJBLZPD-QGZVFWFLSA-N 0 3 416.447 4.114 20 0 HIADHN C[C@H](NCC(=O)Nc1ccc(OC(F)(F)F)cc1)c1ccccc1-n1cccn1 ZINC000540358481 939208769 /nfs/dbraw/zinc/20/87/69/939208769.db2.gz BDHBPRTUWKJUQW-AWEZNQCLSA-N 0 3 404.392 4.060 20 0 HIADHN C[C@@H](NCC(=O)N1CC[C@@H](C)Sc2ccccc21)c1ccccc1-n1cccn1 ZINC000540361251 939209186 /nfs/dbraw/zinc/20/91/86/939209186.db2.gz UVBAOTTVTVUZAT-QZTJIDSGSA-N 0 3 406.555 4.440 20 0 HIADHN COc1ccc(CNC(=O)CN[C@@H](c2cccc(C(F)(F)F)c2)C(C)C)cc1OC ZINC000540360311 939209563 /nfs/dbraw/zinc/20/95/63/939209563.db2.gz STWNDACTBZGSLI-OAQYLSRUSA-N 0 3 424.463 4.326 20 0 HIADHN CNC(=O)c1ccc(CN[C@H](C)c2ccc(NC(=O)c3ccc(F)cc3)cc2)cc1 ZINC000540375363 939215349 /nfs/dbraw/zinc/21/53/49/939215349.db2.gz GYFUFCZRSYDZBB-MRXNPFEDSA-N 0 3 405.473 4.288 20 0 HIADHN C[C@@H](N[C@H](C)c1cccc(-n2cccn2)c1)C(=O)Nc1ccc(OC(F)(F)F)cc1 ZINC000540387121 939222827 /nfs/dbraw/zinc/22/28/27/939222827.db2.gz NENACVLMMILLMT-HUUCEWRRSA-N 0 3 418.419 4.449 20 0 HIADHN Cc1n[nH]c(C)c1[C@H]1CCCN1C(=O)NC[C@@H](c1ccccc1)N1CCC(C)CC1 ZINC000540387378 939224432 /nfs/dbraw/zinc/22/44/32/939224432.db2.gz YOVYGLQBLNMVTL-YADHBBJMSA-N 0 3 409.578 4.346 20 0 HIADHN CCOc1ccc2nc(NC(=O)CN[C@H](c3ccccc3)[C@H]3CCOC3)sc2c1 ZINC000540388282 939226164 /nfs/dbraw/zinc/22/61/64/939226164.db2.gz PRLGZAAZJGIMNE-HRAATJIYSA-N 0 3 411.527 4.001 20 0 HIADHN Cc1cc(C)cc([C@H](C)NCC(=O)Nc2cc(C(F)(F)F)ccc2-n2cncn2)c1 ZINC000540406252 939237008 /nfs/dbraw/zinc/23/70/08/939237008.db2.gz FNOGNSBYZFFBFF-HNNXBMFYSA-N 0 3 417.435 4.192 20 0 HIADHN Cc1cc(C)cc([C@@H](C)NCC(=O)N2c3ccccc3NC(=O)C[C@H]2C(F)(F)F)c1 ZINC000540410424 939238568 /nfs/dbraw/zinc/23/85/68/939238568.db2.gz XZMXJFFGWUPFGI-BEFAXECRSA-N 0 3 419.447 4.260 20 0 HIADHN COc1ccc([C@H](NC(=O)CN[C@H](C[C@@H]2CCOC2)c2ccccc2)C2CC2)cc1 ZINC000540435014 939248177 /nfs/dbraw/zinc/24/81/77/939248177.db2.gz WWRJLPQBJVWVJI-XYURVEJXSA-N 0 3 408.542 4.020 20 0 HIADHN COc1ccc(NC(=O)[C@H](C)N[C@H](C)c2ccc(-c3ccncc3)cc2)cc1OC ZINC000540440243 939251016 /nfs/dbraw/zinc/25/10/16/939251016.db2.gz RSESNVDPCYQIRY-SJORKVTESA-N 0 3 405.498 4.444 20 0 HIADHN CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H](Cc2ccccc2)c2ccccc2F)cc1 ZINC000540458353 939259766 /nfs/dbraw/zinc/25/97/66/939259766.db2.gz OBNDMCPRAVRMBN-OFVILXPXSA-N 0 3 422.500 4.097 20 0 HIADHN O=C(CN[C@@H](c1cccs1)C1CC1)Nc1cc(C(F)(F)F)ccc1-n1cncn1 ZINC000540468377 939264606 /nfs/dbraw/zinc/26/46/06/939264606.db2.gz NGCGPSLLROJLRU-GOSISDBHSA-N 0 3 421.448 4.027 20 0 HIADHN Cc1cc(NC(=O)CN[C@@H](C)c2cccc(N3CCCC3)c2)n(-c2ccccc2F)n1 ZINC000540477023 939267977 /nfs/dbraw/zinc/26/79/77/939267977.db2.gz WWHFLIRUHCOJLH-SFHVURJKSA-N 0 3 421.520 4.209 20 0 HIADHN CC(C)OCc1ccc(CNC(=O)CN[C@@H](C)c2cccc(N3CCCC3)c2)cc1 ZINC000540476465 939268451 /nfs/dbraw/zinc/26/84/51/939268451.db2.gz OXGPSMHATPKOLH-FQEVSTJZSA-N 0 3 409.574 4.179 20 0 HIADHN C[C@H](NCC(=O)Nc1ccccc1Br)c1cccc(N2CCCC2)c1 ZINC000540478503 939268748 /nfs/dbraw/zinc/26/87/48/939268748.db2.gz JXFFIEISJZPPOY-HNNXBMFYSA-N 0 3 402.336 4.339 20 0 HIADHN C[C@@H](CCCc1ccccc1)C(=O)Nc1ccc(C(=O)N(C)[C@@H]2CCCN(C)C2)cc1 ZINC000540499407 939278038 /nfs/dbraw/zinc/27/80/38/939278038.db2.gz HDXYDAPCFDZJIP-GBXCKJPGSA-N 0 3 421.585 4.450 20 0 HIADHN O=C(CCCc1ccc2ccccc2c1)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1CO ZINC000540508677 939281299 /nfs/dbraw/zinc/28/12/99/939281299.db2.gz JSSYCHVJSJGWBS-FTJBHMTQSA-N 0 3 416.565 4.162 20 0 HIADHN COc1cc(NC(=O)c2cccc(CN3CCCC3)c2)cc(OC)c1Br ZINC000540509250 939281965 /nfs/dbraw/zinc/28/19/65/939281965.db2.gz PIPCMRCDGXJNDT-UHFFFAOYSA-N 0 3 419.319 4.314 20 0 HIADHN Cc1cc([C@H](NCC(=O)N2CCC(OCc3ccccc3)CC2)C2CC2)ccc1F ZINC000540520909 939286089 /nfs/dbraw/zinc/28/60/89/939286089.db2.gz HQEKBPASCZVEDM-RUZDIDTESA-N 0 3 410.533 4.383 20 0 HIADHN C[C@@H](c1ccc(Cl)cc1)N(C)C(=O)CN[C@@H](c1ccc2c(c1)OCCO2)C1CC1 ZINC000540591208 939313043 /nfs/dbraw/zinc/31/30/43/939313043.db2.gz GFTNJOAFRJLCHO-NPMXOYFQSA-N 0 3 414.933 4.372 20 0 HIADHN CC[C@@H](NCc1ccc(N2CCOCC2)nc1)c1cc(F)cc(Br)c1 ZINC000540597117 939315213 /nfs/dbraw/zinc/31/52/13/939315213.db2.gz JFDJFVSJBNOFQC-GOSISDBHSA-N 0 3 408.315 4.061 20 0 HIADHN COc1cc(OC)cc(N2CC[C@@H](NCc3ccccc3OCc3ccncc3)C2)c1 ZINC000540699788 939343083 /nfs/dbraw/zinc/34/30/83/939343083.db2.gz IXRQSURMOZUURX-OAQYLSRUSA-N 0 3 419.525 4.046 20 0 HIADHN C[C@H](C(=O)N(C)Cc1ccccc1)N1CCC[C@H](c2nc(C3CCCCC3)n[nH]2)C1 ZINC000540865810 939402226 /nfs/dbraw/zinc/40/22/26/939402226.db2.gz NYAKLKYCVXXDOS-NQIIRXRSSA-N 0 3 409.578 4.079 20 0 HIADHN CCCn1c2cc(C(F)(F)F)ccc2nc1SCCCN1CCN(C)CC1 ZINC000540957554 939420788 /nfs/dbraw/zinc/42/07/88/939420788.db2.gz OCYHZDIOOSDUMN-UHFFFAOYSA-N 0 3 400.514 4.195 20 0 HIADHN CC(=O)Nc1ccc([C@H](C)NCc2ccc(N3CCc4ccccc4C3)nc2)cc1 ZINC000540988910 939426216 /nfs/dbraw/zinc/42/62/16/939426216.db2.gz KUQYLTLICMDDER-SFHVURJKSA-N 0 3 400.526 4.454 20 0 HIADHN Cc1cc2cc(C(=O)NCCCCN3C[C@@H](C)O[C@H](C)C3)oc2c(Br)c1 ZINC000541092466 939456695 /nfs/dbraw/zinc/45/66/95/939456695.db2.gz KFXPXNQRCJNSMH-HUUCEWRRSA-N 0 3 423.351 4.123 20 0 HIADHN Cc1cc2cc(C(=O)N(CCN(C)C)Cc3ccccn3)oc2c(Br)c1 ZINC000541153510 939478605 /nfs/dbraw/zinc/47/86/05/939478605.db2.gz LCRYBIRZWOXVHI-UHFFFAOYSA-N 0 3 416.319 4.103 20 0 HIADHN COC1CCN(C(C)(C)CNC(=O)c2cc3cc(C)cc(Br)c3o2)CC1 ZINC000541154148 939479081 /nfs/dbraw/zinc/47/90/81/939479081.db2.gz VQHYWBXCPQAZTB-UHFFFAOYSA-N 0 3 423.351 4.123 20 0 HIADHN Cc1c2cccc(Br)c2oc1C(=O)NCc1ccccc1CN(C)C ZINC000541170407 939484076 /nfs/dbraw/zinc/48/40/76/939484076.db2.gz SMXKVSGQZPCTCH-UHFFFAOYSA-N 0 3 401.304 4.495 20 0 HIADHN CC(=O)Nc1ccc(CN[C@H]2CC(=O)N(C(C)C)[C@H]2c2ccc(Cl)c(F)c2)cc1 ZINC000541203868 939485541 /nfs/dbraw/zinc/48/55/41/939485541.db2.gz JMDJAIXZVGFNOZ-UNMCSNQZSA-N 0 3 417.912 4.278 20 0 HIADHN CC(C)n1ccc(C[C@@H](C)N[C@@H](CN2CCCC2=O)c2cccc(C(F)(F)F)c2)n1 ZINC000541212489 939485880 /nfs/dbraw/zinc/48/58/80/939485880.db2.gz JIISKZLXAWCNLR-UZLBHIALSA-N 0 3 422.495 4.367 20 0 HIADHN CC(C)n1ccc(C[C@@H](C)N[C@H](CN2CCCC2=O)c2cccc(C(F)(F)F)c2)n1 ZINC000541212488 939485913 /nfs/dbraw/zinc/48/59/13/939485913.db2.gz JIISKZLXAWCNLR-OXQOHEQNSA-N 0 3 422.495 4.367 20 0 HIADHN CCCCN1Cc2cccc(N[C@H](Cc3ccc(C(F)(F)F)cc3)C(N)=O)c2C1 ZINC000541259975 939488150 /nfs/dbraw/zinc/48/81/50/939488150.db2.gz WWBQXEWSTVYWPV-HXUWFJFHSA-N 0 3 405.464 4.330 20 0 HIADHN CCc1ccc([C@H](CNC(=O)[C@H]2CCn3c(cnc3C3CCCCC3)C2)N(C)C)cc1 ZINC000541406709 939507452 /nfs/dbraw/zinc/50/74/52/939507452.db2.gz PBFSHVHMLZYSEN-UPVQGACJSA-N 0 3 422.617 4.475 20 0 HIADHN CC(C)n1ncc2c1nc(-c1cccs1)cc2C(=O)N1[C@@H]2CC[C@H]1CCN(C)C2 ZINC000563698094 945255750 /nfs/dbraw/zinc/25/57/50/945255750.db2.gz SRMKCNAGFIIWIM-JKSUJKDBSA-N 0 3 409.559 4.049 20 0 HIADHN CC(C)[C@@H](CN[C@@H](c1ccc(F)cc1)c1cnc2ccccc2c1)N1CCOCC1 ZINC000541549225 939552354 /nfs/dbraw/zinc/55/23/54/939552354.db2.gz QSZRJAYWMHIMKD-RPBOFIJWSA-N 0 3 407.533 4.410 20 0 HIADHN COc1ccccc1CC(=O)N[C@@H](c1ccc(F)c(F)c1)C(C)(C)N1CCCC1 ZINC000541552867 939553742 /nfs/dbraw/zinc/55/37/42/939553742.db2.gz SMQKFQDADVSHNS-QFIPXVFZSA-N 0 3 402.485 4.248 20 0 HIADHN O=C(NC1CCCCC1)N1CCC(N[C@@H](c2ccccc2)c2ccc(F)cn2)CC1 ZINC000541564781 939556513 /nfs/dbraw/zinc/55/65/13/939556513.db2.gz BAOAUGAHRGBRBI-QHCPKHFHSA-N 0 3 410.537 4.406 20 0 HIADHN COC[C@H](Cc1ccccc1)N[C@@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O ZINC000541590488 939561815 /nfs/dbraw/zinc/56/18/15/939561815.db2.gz PJOCQZLHPZGRBK-LEWJYISDSA-N 0 3 420.475 4.044 20 0 HIADHN C[C@H](NCC(=O)Nc1nnc(-c2ccco2)o1)[C@@H](C)c1ccccc1C(F)(F)F ZINC000541637251 939579551 /nfs/dbraw/zinc/57/95/51/939579551.db2.gz QTXBIZUGPWOYKZ-NEPJUHHUSA-N 0 3 408.380 4.069 20 0 HIADHN COc1ccccc1[C@H](C)N(C)C(=O)CN(C)[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000541700085 939608383 /nfs/dbraw/zinc/60/83/83/939608383.db2.gz SHUGBVXUTVHYAZ-XTQVGHSUSA-N 0 3 414.521 4.206 20 0 HIADHN CN(CC(=O)NCCCSc1ccccc1)[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000541700821 939608794 /nfs/dbraw/zinc/60/87/94/939608794.db2.gz DJQBZMXRLJMSGS-IFMALSPDSA-N 0 3 416.562 4.276 20 0 HIADHN C[C@H](C(=O)Nc1ccc2c(c1)OC1(CCCCC1)O2)N1CCC2(CCOCC2)[C@@H]1C ZINC000541718203 939613400 /nfs/dbraw/zinc/61/34/00/939613400.db2.gz NISHPKMGQFSELJ-MSOLQXFVSA-N 0 3 414.546 4.336 20 0 HIADHN O=C(N[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000541749475 939620345 /nfs/dbraw/zinc/62/03/45/939620345.db2.gz MFQGUPNLSJJJIP-UEVCKROQSA-N 0 3 414.496 4.213 20 0 HIADHN CCn1cc(C(=O)NCc2cccc(CN3CCCC3)c2)c(=O)c2cc(Cl)ccc21 ZINC000541773873 939626801 /nfs/dbraw/zinc/62/68/01/939626801.db2.gz DQXCCJOGVSPWIL-UHFFFAOYSA-N 0 3 423.944 4.201 20 0 HIADHN C[C@H]1CCCN(Cc2ccccc2CNCc2c(Cl)cccc2S(C)(=O)=O)C1 ZINC000541794449 939632787 /nfs/dbraw/zinc/63/27/87/939632787.db2.gz ASWLHCRWQLQATH-KRWDZBQOSA-N 0 3 421.006 4.265 20 0 HIADHN COc1ccc([C@@H](NC2CCN(C(C)=O)CC2)c2ccccc2Cl)cc1OC ZINC000541843766 939645943 /nfs/dbraw/zinc/64/59/43/939645943.db2.gz HYTGCAVEAODOCQ-JOCHJYFZSA-N 0 3 402.922 4.047 20 0 HIADHN CN1CCN(c2ccc(CN[C@@H](c3ccccc3)c3ccc(Cl)cc3)cn2)CC1 ZINC000541844437 939646520 /nfs/dbraw/zinc/64/65/20/939646520.db2.gz MZMQZLBAWXKKQW-DEOSSOPVSA-N 0 3 406.961 4.366 20 0 HIADHN C[C@@H]1C[C@@H](N[C@@H](c2ccc(Cl)cc2)c2cccc(S(C)(=O)=O)c2)C[C@H](C)O1 ZINC000541847728 939646707 /nfs/dbraw/zinc/64/67/07/939646707.db2.gz BCTCYXUFZCVPSI-YOBSMXQVSA-N 0 3 407.963 4.379 20 0 HIADHN C[C@@H]1CC(N[C@H](c2ccc(Cl)cc2)c2cccc(S(C)(=O)=O)c2)C[C@@H](C)O1 ZINC000541847727 939646864 /nfs/dbraw/zinc/64/68/64/939646864.db2.gz BCTCYXUFZCVPSI-VTJXTGGHSA-N 0 3 407.963 4.379 20 0 HIADHN CCOc1ccc(CN2CCC3(C[C@H]3C(=O)N3CCCCC3)CC2)cc1OCC ZINC000541853496 939647168 /nfs/dbraw/zinc/64/71/68/939647168.db2.gz ATRWQGLMLHLKGK-FQEVSTJZSA-N 0 3 400.563 4.099 20 0 HIADHN Cc1cc(NC(=O)N[C@@H](C)C2=CCN(C)CC2)nn1-c1ccc(Cl)cc1Cl ZINC000541907403 939650985 /nfs/dbraw/zinc/65/09/85/939650985.db2.gz MWNQMVJTUNPHAD-ZDUSSCGKSA-N 0 3 408.333 4.259 20 0 HIADHN CC(C)[C@H]1C[C@@H](CC(=O)NC2CCN(CCOc3ccc(Cl)cc3)CC2)CCO1 ZINC000541961947 939663274 /nfs/dbraw/zinc/66/32/74/939663274.db2.gz QODHWBKHWIPAKO-PGRDOPGGSA-N 0 3 422.997 4.141 20 0 HIADHN CCOc1ccc(NC(=O)c2ccc(NC(=O)N(CCN(C)C)C(C)C)cc2)cc1 ZINC000541972418 939666528 /nfs/dbraw/zinc/66/65/28/939666528.db2.gz DVZMXWFPYNZDOG-UHFFFAOYSA-N 0 3 412.534 4.142 20 0 HIADHN COC(=O)c1ccc(-c2nc(CN3CCC[C@@H]3Cc3ccccc3OC)co2)cc1 ZINC000541997129 939674485 /nfs/dbraw/zinc/67/44/85/939674485.db2.gz UOJRBCAAUZJSBX-OAQYLSRUSA-N 0 3 406.482 4.344 20 0 HIADHN Cc1c(NC2CCN(Cc3ccncc3)CC2)cccc1-c1nnc2n1CCCCC2 ZINC000542019528 939687897 /nfs/dbraw/zinc/68/78/97/939687897.db2.gz XBYLDOYQQUUDOD-UHFFFAOYSA-N 0 3 416.573 4.451 20 0 HIADHN C[C@@H]1COc2ccccc2CN1C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000542024409 939690252 /nfs/dbraw/zinc/69/02/52/939690252.db2.gz PPFGZXLDFOIPSB-GOSISDBHSA-N 0 3 411.571 4.093 20 0 HIADHN C[C@H](NCC[S@](=O)c1cc(Cl)ccc1Cl)c1ccc([S@](C)=O)cc1 ZINC000542048446 939699143 /nfs/dbraw/zinc/69/91/43/939699143.db2.gz WZCKACIKAHXTMQ-KHFQTWQWSA-N 0 3 404.384 4.189 20 0 HIADHN O[C@@H](CN[C@H](Cc1ccc(Cl)cc1)c1ccccn1)COCc1cccs1 ZINC000542123324 939722319 /nfs/dbraw/zinc/72/23/19/939722319.db2.gz NVZXIILHBWCRTE-GHTZIAJQSA-N 0 3 402.947 4.248 20 0 HIADHN CCOC(=O)C1CCN(C(=O)C[C@@H](C)NC(c2cccs2)c2cccs2)CC1 ZINC000542137161 939727241 /nfs/dbraw/zinc/72/72/41/939727241.db2.gz YGRFXXDJCDSSHB-OAHLLOKOSA-N 0 3 420.600 4.069 20 0 HIADHN C[C@@H](CC(=O)Nc1ccc(NC(=O)C2CC2)cc1)NCc1ccccc1OC(F)F ZINC000542141166 939728133 /nfs/dbraw/zinc/72/81/33/939728133.db2.gz DBSOOYLKKMPWLJ-AWEZNQCLSA-N 0 3 417.456 4.143 20 0 HIADHN C[C@@H](N[C@@H]1CCCN(Cc2nccn2C)C1=O)c1ccc(SC2CCCC2)cc1 ZINC000542159824 939737616 /nfs/dbraw/zinc/73/76/16/939737616.db2.gz DWZHYROLPHKJAA-DYESRHJHSA-N 0 3 412.603 4.297 20 0 HIADHN COC(=O)c1ccc(CN[C@@H]2CCCc3c(Br)cccc32)cc1OC ZINC000542185383 939748776 /nfs/dbraw/zinc/74/87/76/939748776.db2.gz GTMPTOBMNNKYGB-GOSISDBHSA-N 0 3 404.304 4.412 20 0 HIADHN C[C@@H](CN(C)C[C@@H](O)COc1ccc(Cl)cc1Br)c1nccs1 ZINC000542307310 939793410 /nfs/dbraw/zinc/79/34/10/939793410.db2.gz PZJGMRMTEMKGGW-WCQYABFASA-N 0 3 419.772 4.034 20 0 HIADHN COc1ccc(Oc2ccc(CN[C@H]3CCCN(CC(F)(F)F)C3=O)cc2)cc1 ZINC000542310959 939795323 /nfs/dbraw/zinc/79/53/23/939795323.db2.gz YIPVHVMTHKQQKH-IBGZPJMESA-N 0 3 408.420 4.130 20 0 HIADHN C[C@]1(NCC(=O)N2N=C(c3cccs3)C[C@H]2c2cccs2)CCO[C@@H]1C1CC1 ZINC000542315620 939797665 /nfs/dbraw/zinc/79/76/65/939797665.db2.gz TUBZFQWEPQGVST-DQLDELGASA-N 0 3 415.584 4.035 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)CN2CC[C@@H](c3ccc(C)cc3)C2)c(OC)c1 ZINC000542323460 939800318 /nfs/dbraw/zinc/80/03/18/939800318.db2.gz VZJWFCGQDCGLHL-OFNKIYASSA-N 0 3 408.542 4.165 20 0 HIADHN Cc1ccc([C@H]2CCN(CC(=O)N3CCC[C@@H]3c3ccc4c(c3)OCCCO4)C2)cc1 ZINC000542323110 939800351 /nfs/dbraw/zinc/80/03/51/939800351.db2.gz PINQMURUDZSCMU-XZOQPEGZSA-N 0 3 420.553 4.309 20 0 HIADHN C[C@H](CN(C)C(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1)c1nccs1 ZINC000542346106 939804414 /nfs/dbraw/zinc/80/44/14/939804414.db2.gz OVUGNYMYNCNODD-DNVCBOLYSA-N 0 3 411.493 4.160 20 0 HIADHN Cc1cn(C2CCCCC2)nc1NC(=O)N(C)C1CCN(CCc2ccccn2)CC1 ZINC000542364152 939808168 /nfs/dbraw/zinc/80/81/68/939808168.db2.gz GDDZWWSDJRVPHH-UHFFFAOYSA-N 0 3 424.593 4.263 20 0 HIADHN CCN1CCN(CCC(=O)N[C@H](c2ccccc2)c2cc(Cl)ccc2Cl)CC1 ZINC000542456425 939825859 /nfs/dbraw/zinc/82/58/59/939825859.db2.gz SKNZOAQUISLLMB-JOCHJYFZSA-N 0 3 420.384 4.227 20 0 HIADHN COc1cc(CN2CC[C@H](N[C@@H](c3ccc(F)cc3)c3cccnc3)C2)cc(OC)c1 ZINC000542474029 939829120 /nfs/dbraw/zinc/82/91/20/939829120.db2.gz YZLYJFPRWVEEFG-DHLKQENFSA-N 0 3 421.516 4.191 20 0 HIADHN COc1ccc([C@H](CN[C@H](c2ccc(F)cc2)c2cccnc2)N(C)C)cc1OC ZINC000542475502 939829577 /nfs/dbraw/zinc/82/95/77/939829577.db2.gz XNNSNEWQIIDWGG-XUZZJYLKSA-N 0 3 409.505 4.220 20 0 HIADHN O=C(c1ccccc1F)N1CCC(N[C@H](c2ccc(F)cc2)c2cccnc2)CC1 ZINC000542477405 939829845 /nfs/dbraw/zinc/82/98/45/939829845.db2.gz GAQUFMHSASNXOT-HSZRJFAPSA-N 0 3 407.464 4.344 20 0 HIADHN Cc1ccccc1[C@H](CN1CCOCC1)NCc1cccc(COCC(F)(F)F)c1 ZINC000542493392 939832633 /nfs/dbraw/zinc/83/26/33/939832633.db2.gz KRVWLRSMTHUUBV-QFIPXVFZSA-N 0 3 422.491 4.237 20 0 HIADHN C[C@@H]1C[C@@H](N[C@@H]2CCCN(Cc3ccccn3)C2=O)c2cccc(Br)c21 ZINC000542499015 939833271 /nfs/dbraw/zinc/83/32/71/939833271.db2.gz MPIYCRFDVUVZSO-NIKGAXFTSA-N 0 3 414.347 4.173 20 0 HIADHN C[C@@H](N[C@H](Cc1ccccc1)c1cccs1)C(=O)Nc1ccc2c(c1)OCCO2 ZINC000542525837 939837368 /nfs/dbraw/zinc/83/73/68/939837368.db2.gz MQBRJRPSLVTPQR-VQIMIIECSA-N 0 3 408.523 4.420 20 0 HIADHN C[C@H]1N(C(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)CCC12CCOCC2 ZINC000542554594 939842731 /nfs/dbraw/zinc/84/27/31/939842731.db2.gz OXUUTWIEGSDWHC-MOPGFXCFSA-N 0 3 405.608 4.122 20 0 HIADHN CC[C@H](NCCCS(=O)(=O)c1ccc(NC(C)=O)cc1)c1ccc(Cl)s1 ZINC000542556512 939843100 /nfs/dbraw/zinc/84/31/00/939843100.db2.gz RNEALUJFAOTBGJ-INIZCTEOSA-N 0 3 414.980 4.265 20 0 HIADHN C[C@@H](NCC(=O)N1CCC(c2ccccc2)=N1)[C@H](C)c1ccccc1C(F)(F)F ZINC000542564725 939844413 /nfs/dbraw/zinc/84/44/13/939844413.db2.gz XIOYBKYUKPFSAT-JKSUJKDBSA-N 0 3 403.448 4.424 20 0 HIADHN Clc1cccc2c1CCC[C@@H]2NCc1cccc(OCCN2CCOCC2)c1 ZINC000542667663 939852831 /nfs/dbraw/zinc/85/28/31/939852831.db2.gz UUAQZFYGLRWYEX-QHCPKHFHSA-N 0 3 400.950 4.218 20 0 HIADHN O=C(NCc1ccncc1)Nc1cccc(CNC/C=C\c2ccc(F)cc2F)c1 ZINC000542688149 939854185 /nfs/dbraw/zinc/85/41/85/939854185.db2.gz RMBRWBNRDTVTCC-RQOWECAXSA-N 0 3 408.452 4.485 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCCC1)Nc1csc(-c2ccccn2)n1 ZINC000542690704 939854444 /nfs/dbraw/zinc/85/44/44/939854444.db2.gz PDYWXBCMWPGSTB-UHFFFAOYSA-N 0 3 417.604 4.078 20 0 HIADHN COc1cc(C)c(CN2CCC[C@H](c3n[nH]cc3NC(=O)c3ccccc3)C2)c(C)n1 ZINC000542849550 939863073 /nfs/dbraw/zinc/86/30/73/939863073.db2.gz CYGMVUUMXVUNSO-IBGZPJMESA-N 0 3 419.529 4.062 20 0 HIADHN CCN1CC[C@H](NC(=O)Nc2cccc(CN(C)C)c2)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000542936197 939881882 /nfs/dbraw/zinc/88/18/82/939881882.db2.gz MIXTXFLXFRQONW-FPOVZHCZSA-N 0 3 420.479 4.123 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3CC=C(c4ccccc4C)C3)c(C)c2)CC1 ZINC000542987214 939891846 /nfs/dbraw/zinc/89/18/46/939891846.db2.gz RTNGVHCLTBSKRW-UHFFFAOYSA-N 0 3 404.558 4.376 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)c3csc(Br)c3C)cc2)CC1 ZINC000543032971 939899105 /nfs/dbraw/zinc/89/91/05/939899105.db2.gz OUXCNJWXIRQWGM-UHFFFAOYSA-N 0 3 422.392 4.209 20 0 HIADHN O[C@H](CN[C@H](Cc1ccc(Cl)cc1)c1ccccn1)COc1ccccc1F ZINC000543051765 939909883 /nfs/dbraw/zinc/90/98/83/939909883.db2.gz FTDLALQJSYYIRM-WIYYLYMNSA-N 0 3 400.881 4.187 20 0 HIADHN CCOC(=O)C1CCN(C(=O)C[C@@H](C)N[C@@H](C)c2cccc(Cl)c2Cl)CC1 ZINC000543066970 939920011 /nfs/dbraw/zinc/92/00/11/939920011.db2.gz NOLHKLNUMZXVQL-KGLIPLIRSA-N 0 3 415.361 4.224 20 0 HIADHN C[C@@H](N[C@@H](C)CC(=O)Nc1ccc(NC(=O)C2CC2)cc1)c1ccc(F)cc1F ZINC000543072286 939923727 /nfs/dbraw/zinc/92/37/27/939923727.db2.gz KTVOKEJGWURNME-UONOGXRCSA-N 0 3 401.457 4.381 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc(CN[C@H](C)Cc2ccccc2SC)s1 ZINC000543075432 939927111 /nfs/dbraw/zinc/92/71/11/939927111.db2.gz XTASPIGDQWVKFO-OAHLLOKOSA-N 0 3 412.646 4.221 20 0 HIADHN CCOc1ccc(C(C)(C)C(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)cc1OCC ZINC000543095295 939941630 /nfs/dbraw/zinc/94/16/30/939941630.db2.gz LRGUTRNRLURFHC-OFNKIYASSA-N 0 3 410.558 4.323 20 0 HIADHN COc1cccc([C@H]2C[C@@H](C)CN2CC(=O)N2CCc3[nH]c4ccccc4c3C2)c1 ZINC000543181048 939987896 /nfs/dbraw/zinc/98/78/96/939987896.db2.gz IIDSSKUSTGHLNJ-MZNJEOGPSA-N 0 3 403.526 4.144 20 0 HIADHN COc1ccc(Oc2ccc(CNCc3ccccc3CS(C)(=O)=O)cc2)cc1 ZINC000543236684 940004001 /nfs/dbraw/zinc/00/40/01/940004001.db2.gz WOXRGQSPJFISNP-UHFFFAOYSA-N 0 3 411.523 4.322 20 0 HIADHN FC(F)(F)c1ccc([C@@H]2CCC[C@@H]2NCc2cn(Cc3cccnc3)nn2)cc1 ZINC000543240389 940005425 /nfs/dbraw/zinc/00/54/25/940005425.db2.gz XOGQLMIEUZCBDY-PMACEKPBSA-N 0 3 401.436 4.166 20 0 HIADHN C[C@@H](CN(C)C(=O)N[C@H](CN1CCc2ccccc2C1)C(C)(C)C)c1nccs1 ZINC000543338199 940035265 /nfs/dbraw/zinc/03/52/65/940035265.db2.gz IJTHHQRWFUTSDZ-FXAWDEMLSA-N 0 3 414.619 4.361 20 0 HIADHN CCc1ccc([C@@H](CN2CCOCC2)NCc2ccc(NC(=O)C(C)C)cc2)cc1 ZINC000543399912 940051744 /nfs/dbraw/zinc/05/17/44/940051744.db2.gz PEBMNZJJIIGREE-XMMPIXPASA-N 0 3 409.574 4.007 20 0 HIADHN CCN(CC)[C@H](CN[C@H](c1ccc(F)cc1)c1cnccn1)c1cccc(OC)c1 ZINC000543410239 940056910 /nfs/dbraw/zinc/05/69/10/940056910.db2.gz BPNZCXKRIGSXCQ-DNQXCXABSA-N 0 3 408.521 4.386 20 0 HIADHN C[C@@H]1C[C@@H](CCN[C@@H](c2cccc(S(C)(=O)=O)c2)c2ccc(F)c(F)c2)CCO1 ZINC000543419044 940059317 /nfs/dbraw/zinc/05/93/17/940059317.db2.gz NHKOWWREWMQRPZ-VVBPWWLESA-N 0 3 423.525 4.253 20 0 HIADHN COc1ccc(NC(C)=O)cc1NC(=O)[C@@H](C)N[C@H](CC(C)C)c1cccs1 ZINC000543486172 940079968 /nfs/dbraw/zinc/07/99/68/940079968.db2.gz SQACARAWHXXALS-RDTXWAMCSA-N 0 3 403.548 4.419 20 0 HIADHN C[C@H](N[C@@H](CC(N)=O)C1CCCCC1)C(=O)Nc1ccccc1Oc1ccccc1 ZINC000543495025 940084013 /nfs/dbraw/zinc/08/40/13/940084013.db2.gz BYYGCPKSTQITND-UWJYYQICSA-N 0 3 409.530 4.220 20 0 HIADHN C[C@H](c1ccc(F)c(F)c1)N(C)C(=O)CN(C)[C@@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000543555729 940107168 /nfs/dbraw/zinc/10/71/68/940107168.db2.gz UUQGGOZEOCUISB-YOMUGFJLSA-N 0 3 420.475 4.475 20 0 HIADHN Cc1cc(NC(=O)NC[C@H](C)c2nccs2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000543631901 940143263 /nfs/dbraw/zinc/14/32/63/940143263.db2.gz UEBXMGICOQHXBT-LPHOPBHVSA-N 0 3 424.574 4.020 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)Nc3ccc(Br)c(Cl)c3Cl)[C@@H]2C1 ZINC000543647850 940149574 /nfs/dbraw/zinc/14/95/74/940149574.db2.gz MTCKZAIWVQSLSX-BXKDBHETSA-N 0 3 407.139 4.314 20 0 HIADHN CS[C@H]1CN(C(=O)c2csc(-c3cccc(Cl)c3)n2)C[C@H]1N1CCCC1 ZINC000543701430 940165225 /nfs/dbraw/zinc/16/52/25/940165225.db2.gz UMWFAMZHSKGTRY-SJORKVTESA-N 0 3 407.992 4.115 20 0 HIADHN O=C(CN[C@H](C[C@H]1CCOC1)c1ccccc1)Nc1cccc(Br)c1 ZINC000543704926 940166299 /nfs/dbraw/zinc/16/62/99/940166299.db2.gz SZUOPLGSGLPHCR-DNVCBOLYSA-N 0 3 403.320 4.145 20 0 HIADHN Cc1c2cc(Cl)ccc2oc1C(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1CO ZINC000543707086 940167113 /nfs/dbraw/zinc/16/71/13/940167113.db2.gz JQJODWRRMHJGFO-PXNSSMCTSA-N 0 3 412.917 4.007 20 0 HIADHN CC[C@H](N[C@@H](C)c1ccc(NC(C)=O)cc1)c1ccccc1OCC(=O)N1CCCC1 ZINC000543773901 940181501 /nfs/dbraw/zinc/18/15/01/940181501.db2.gz IDLLDSKSLMWWJD-MBSDFSHPSA-N 0 3 423.557 4.448 20 0 HIADHN O[C@H](COc1cccc2ccccc21)CN1CCC[C@H](n2ccc(C(F)(F)F)n2)C1 ZINC000543873036 940219312 /nfs/dbraw/zinc/21/93/12/940219312.db2.gz LHPCRNCRZWXKKX-ROUUACIJSA-N 0 3 419.447 4.132 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3CC=C(c4cccc(OC)c4)C3)c(C)c2)CC1 ZINC000543915174 940242412 /nfs/dbraw/zinc/24/24/12/940242412.db2.gz YMQBUXYMMWKOLA-UHFFFAOYSA-N 0 3 420.557 4.077 20 0 HIADHN CCc1cnccc1[C@H](C)NC[C@H](O)COc1ccc(Cl)cc1Br ZINC000543981172 940282541 /nfs/dbraw/zinc/28/25/41/940282541.db2.gz GQENBWLHZRLAFN-WFASDCNBSA-N 0 3 413.743 4.150 20 0 HIADHN COC(=O)c1cccc(NC(=O)C[C@H](C)NCc2ccc(Oc3ccccc3)nc2)c1 ZINC000543991791 940286623 /nfs/dbraw/zinc/28/66/23/940286623.db2.gz DWCSLFKESJKQBP-KRWDZBQOSA-N 0 3 419.481 4.167 20 0 HIADHN CN(C(=O)CC1CCC(C(F)(F)F)CC1)C1CCN(CCc2ccccn2)CC1 ZINC000544001761 940292990 /nfs/dbraw/zinc/29/29/90/940292990.db2.gz QZPWDEAQBUYEJV-UHFFFAOYSA-N 0 3 411.512 4.306 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)CC3CCC(C(F)(F)F)CC3)CC2)C[C@H](C)O1 ZINC000544031097 940304904 /nfs/dbraw/zinc/30/49/04/940304904.db2.gz XHUCKRWPDDNFIZ-BEEJXANESA-N 0 3 418.544 4.483 20 0 HIADHN Cc1cc(NC(=O)N(Cc2ccccc2)C2CCN(C)CC2)nn1C1CCCCC1 ZINC000563843809 945311989 /nfs/dbraw/zinc/31/19/89/945311989.db2.gz XRJPEQJEAYAOHG-UHFFFAOYSA-N 0 3 409.578 4.825 20 0 HIADHN Cc1nc(N(C)C[C@H](C)c2nccs2)cc(N(C)C[C@H](C)c2nccs2)n1 ZINC000544123105 940331897 /nfs/dbraw/zinc/33/18/97/940331897.db2.gz GXFHUVDVKXJFKC-KBPBESRZSA-N 0 3 402.593 4.178 20 0 HIADHN O[C@@H](COc1ccccc1C(F)(F)F)CN1CC=C(c2c[nH]c3ncccc23)CC1 ZINC000544146805 940337709 /nfs/dbraw/zinc/33/77/09/940337709.db2.gz VRHWTKBLYUOSBB-MRXNPFEDSA-N 0 3 417.431 4.111 20 0 HIADHN C[C@H](C[S@@](C)=O)NCc1cn(Cc2ccccc2Cl)nc1-c1ccccc1 ZINC000544168116 940341989 /nfs/dbraw/zinc/34/19/89/940341989.db2.gz BHGUQPMZJBAXSS-CHAGWJKLSA-N 0 3 401.963 4.108 20 0 HIADHN Cc1cccc([C@H]2CCN(CC(=O)N3CCC[C@H]3c3ccc4c(c3)OCCCO4)C2)c1 ZINC000544183412 940346689 /nfs/dbraw/zinc/34/66/89/940346689.db2.gz GOZLCDSYCYFSJR-GOTSBHOMSA-N 0 3 420.553 4.309 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)[C@@H]1CCn2c(cnc2C2CCCCC2)C1 ZINC000544197927 940351712 /nfs/dbraw/zinc/35/17/12/940351712.db2.gz WTEVRCQNOBCQOD-LJQANCHMSA-N 0 3 410.562 4.202 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(-c4cccc(C(F)(F)F)c4F)n3)cn2)CC1 ZINC000544333083 940392666 /nfs/dbraw/zinc/39/26/66/940392666.db2.gz OJNOTIJFSBFFIR-UHFFFAOYSA-N 0 3 421.398 4.098 20 0 HIADHN CN1CCCN(c2ccc(-c3noc([C@@H]4C[C@@H]4c4cccc(Cl)c4)n3)cn2)CC1 ZINC000544346425 940396297 /nfs/dbraw/zinc/39/62/97/940396297.db2.gz QEAOVMBDDHCVFL-RTBURBONSA-N 0 3 409.921 4.198 20 0 HIADHN NC(=O)C1CCN(C[C@@H](NCc2cc3ccccc3o2)c2ccc(Cl)cc2)CC1 ZINC000544355769 940399140 /nfs/dbraw/zinc/39/91/40/940399140.db2.gz NABBHHUATDOJLS-OAQYLSRUSA-N 0 3 411.933 4.114 20 0 HIADHN CCc1ccc([C@@H](CN2CCOCC2)NCc2ccc(-n3ccnc3C)c(F)c2)cc1 ZINC000544363361 940402063 /nfs/dbraw/zinc/40/20/63/940402063.db2.gz SMQFBTPUDQUJIP-XMMPIXPASA-N 0 3 422.548 4.045 20 0 HIADHN C[C@H](c1cc2ccccc2o1)c1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1 ZINC000544362969 940402169 /nfs/dbraw/zinc/40/21/69/940402169.db2.gz PEDYQMDECYQCJM-MRXNPFEDSA-N 0 3 403.486 4.172 20 0 HIADHN NC(=O)C1CCN(C[C@@H](NCc2ccc(Cl)cc2)c2ccc(Cl)cc2)CC1 ZINC000544367680 940403637 /nfs/dbraw/zinc/40/36/37/940403637.db2.gz HNAYIUOAHUTOSD-HXUWFJFHSA-N 0 3 406.357 4.022 20 0 HIADHN O=C(CCCN[C@@H](c1ccco1)c1ccccc1)N1CCN(c2ccccc2)CC1 ZINC000544379249 940407302 /nfs/dbraw/zinc/40/73/02/940407302.db2.gz FEIHYZFLQUDHQX-RUZDIDTESA-N 0 3 403.526 4.088 20 0 HIADHN Cc1nc(-c2ccccc2F)sc1[C@@H](C)N[C@H]1CCCN(Cc2ccccn2)C1=O ZINC000544386031 940408323 /nfs/dbraw/zinc/40/83/23/940408323.db2.gz RKERHIPPCOQCND-QRWLVFNGSA-N 0 3 424.545 4.494 20 0 HIADHN COc1ccc([C@H]2CCCN2C(=O)CN[C@H](c2cccs2)C2CC2)c(OC)c1 ZINC000544400088 940412602 /nfs/dbraw/zinc/41/26/02/940412602.db2.gz POSQVEACGRRYEH-GCJKJVERSA-N 0 3 400.544 4.170 20 0 HIADHN CCOc1cc(Cc2noc([C@@H]3CCN(C)C3)n2)cc(Cl)c1OCC(F)(F)F ZINC000544406591 940414684 /nfs/dbraw/zinc/41/46/84/940414684.db2.gz WLDJJDDRRRJSTC-GFCCVEGCSA-N 0 3 419.831 4.073 20 0 HIADHN CC[C@H](NC[C@H](O)COc1ccc(Oc2ccccc2)cc1)c1c(C)nn(C)c1C ZINC000544417272 940417754 /nfs/dbraw/zinc/41/77/54/940417754.db2.gz SARSVQKURAKYRO-CVDCTZTESA-N 0 3 409.530 4.310 20 0 HIADHN COc1cc(-c2noc(CN[C@@H]3C[C@H](C)CC[C@@H]3C(C)C)n2)cc(OC)c1OC ZINC000544434913 940429278 /nfs/dbraw/zinc/42/92/78/940429278.db2.gz DRFVSAQFRASRKB-DJIMGWMZSA-N 0 3 403.523 4.313 20 0 HIADHN Cc1ccc(Cl)c(OC[C@H](O)CN2CCC3(CC2)OCCc2ccsc23)c1 ZINC000544442051 940432842 /nfs/dbraw/zinc/43/28/42/940432842.db2.gz ATAHHDGOOVZNEI-QGZVFWFLSA-N 0 3 407.963 4.014 20 0 HIADHN COc1ccccc1C[C@@H](NCc1nnnn1-c1ccc(C(F)(F)F)cc1)C(C)C ZINC000544458977 940439686 /nfs/dbraw/zinc/43/96/86/940439686.db2.gz JELIKTCGSXJKQA-GOSISDBHSA-N 0 3 419.451 4.047 20 0 HIADHN Cc1csc([C@@H](C)NCCCOc2cccc(I)c2)n1 ZINC000544476996 940448832 /nfs/dbraw/zinc/44/88/32/940448832.db2.gz HBGMVQHAEBSEMW-GFCCVEGCSA-N 0 3 402.301 4.176 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)N(C)Cc1nc2ccccc2s1)[C@@H]1Oc2ccccc2[C@H]1C ZINC000544508537 940460377 /nfs/dbraw/zinc/46/03/77/940460377.db2.gz BRGYALHKIBNZKF-LUDNOHBGSA-N 0 3 409.555 4.186 20 0 HIADHN C[C@H](NCC(=O)Nc1cccc(CSc2ccccn2)c1)[C@H]1COc2ccccc21 ZINC000544523407 940471335 /nfs/dbraw/zinc/47/13/35/940471335.db2.gz ULCMGOXPCHREDN-LAUBAEHRSA-N 0 3 419.550 4.467 20 0 HIADHN CN(CC(=O)N1CCc2[nH]c3ccccc3c2C1)[C@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000544529609 940472866 /nfs/dbraw/zinc/47/28/66/940472866.db2.gz OCHOQPVVULFCNJ-YADARESESA-N 0 3 421.516 4.044 20 0 HIADHN C[C@@H](C(=O)Nc1ccc(OCc2ccccc2)cc1)N1CCC2(CCOCC2)[C@@H]1C ZINC000544546643 940476277 /nfs/dbraw/zinc/47/62/77/940476277.db2.gz BUTTZILXYGIQII-PMACEKPBSA-N 0 3 408.542 4.484 20 0 HIADHN OC[C@H](CN[C@@H](c1ccccc1)c1cncnc1)Cc1ccc(C(F)(F)F)cc1 ZINC000544576050 940483084 /nfs/dbraw/zinc/48/30/84/940483084.db2.gz KYFRQYABBDPKHG-UWJYYQICSA-N 0 3 401.432 4.026 20 0 HIADHN OC[C@@H](CN[C@@H](c1ccccc1)c1cncnc1)Cc1ccc(C(F)(F)F)cc1 ZINC000544576048 940483308 /nfs/dbraw/zinc/48/33/08/940483308.db2.gz KYFRQYABBDPKHG-UTKZUKDTSA-N 0 3 401.432 4.026 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@H]2CCCC[C@H]2NCc2cccc(Cn3ccnc3)c2)cc1 ZINC000544579227 940483624 /nfs/dbraw/zinc/48/36/24/940483624.db2.gz NRPQKPRVAYHJGT-RPWUZVMVSA-N 0 3 423.582 4.115 20 0 HIADHN CS[C@@H]1CN(C(=O)Nc2ccc(C)c(Oc3cc(C)ccn3)c2)C[C@@H]1N(C)C ZINC000544792753 940514456 /nfs/dbraw/zinc/51/44/56/940514456.db2.gz IQOUHCQRVSFTDI-PKOBYXMFSA-N 0 3 400.548 4.000 20 0 HIADHN CCN(C(=O)c1cnc2onc(C(C)(C)C)c2c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000544850139 940519182 /nfs/dbraw/zinc/51/91/82/940519182.db2.gz YADFEXRTXSWPIZ-IBGZPJMESA-N 0 3 406.530 4.257 20 0 HIADHN CCN(C(=O)c1cc(-c2ccccc2)c(C)[nH]c1=O)[C@H]1CCN(Cc2ccccc2)C1 ZINC000544877581 940521141 /nfs/dbraw/zinc/52/11/41/940521141.db2.gz SXMROVXFYFQWGR-QFIPXVFZSA-N 0 3 415.537 4.499 20 0 HIADHN Fc1cccc(CN2CCC[C@@H](c3nc(CCn4cnc5ccccc54)no3)C2)c1 ZINC000544923393 940525713 /nfs/dbraw/zinc/52/57/13/940525713.db2.gz QDJPDEYTOZROLP-GOSISDBHSA-N 0 3 405.477 4.181 20 0 HIADHN C[C@@H](CNC(=O)c1ccccc1)c1noc([C@@H]2CCCN(Cc3cccc(F)c3)C2)n1 ZINC000545046311 940536584 /nfs/dbraw/zinc/53/65/84/940536584.db2.gz AFGKXNWWXOLDCY-FXAWDEMLSA-N 0 3 422.504 4.122 20 0 HIADHN CC(C)c1nn(-c2ccc(Br)cc2)cc1CN1CCC(C)(CO)CC1 ZINC000545163249 940552942 /nfs/dbraw/zinc/55/29/42/940552942.db2.gz CTWMUNYDQOYBLN-UHFFFAOYSA-N 0 3 406.368 4.353 20 0 HIADHN COc1ccc(C2(C(=O)N[C@H](CN(C)Cc3ccccc3)C(C)C)CCOCC2)cc1 ZINC000545307013 940561186 /nfs/dbraw/zinc/56/11/86/940561186.db2.gz JUBZTTXLKXYYJU-XMMPIXPASA-N 0 3 424.585 4.016 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1oc(C2CC2)nc1C ZINC000545344005 940563302 /nfs/dbraw/zinc/56/33/02/940563302.db2.gz LAAGCKQJYCMPOF-IBGZPJMESA-N 0 3 405.502 4.065 20 0 HIADHN CS[C@H]1CN(C(=O)Nc2ccc(OCc3cccc(F)c3)cc2C)C[C@@H]1N(C)C ZINC000545423864 940569205 /nfs/dbraw/zinc/56/92/05/940569205.db2.gz RWIJWKWQHSRWAA-SFTDATJTSA-N 0 3 417.550 4.222 20 0 HIADHN CCN1CCc2nc3ccccc3c(C(=O)Nc3cc(C)cc(CN(C)C)c3)c2C1 ZINC000545424524 940569220 /nfs/dbraw/zinc/56/92/20/940569220.db2.gz ZBJPHIPXBCTMDT-UHFFFAOYSA-N 0 3 402.542 4.235 20 0 HIADHN COC(=O)[C@H](C)Cc1ccc(NC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)cc1 ZINC000545428547 940569395 /nfs/dbraw/zinc/56/93/95/940569395.db2.gz LOFDLVBALUUORQ-WOJBJXKFSA-N 0 3 423.557 4.167 20 0 HIADHN CCC(CC)(C(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1)c1ccc(OC)c(OC)c1 ZINC000545443529 940570177 /nfs/dbraw/zinc/57/01/77/940570177.db2.gz ZNUNXLYVRJZBLN-REWPJTCUSA-N 0 3 410.558 4.323 20 0 HIADHN Clc1ccc([C@H](Cc2cccnc2)NCc2ccc(N3CCOCC3)nc2)cc1 ZINC000545459115 940570916 /nfs/dbraw/zinc/57/09/16/940570916.db2.gz GQUKWPNNMJUNPD-QFIPXVFZSA-N 0 3 408.933 4.040 20 0 HIADHN CCN(C(=O)c1cccc(-c2noc(C3CC3)n2)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000545475442 940571355 /nfs/dbraw/zinc/57/13/55/940571355.db2.gz QUIUKOCNGCOKAM-QFIPXVFZSA-N 0 3 416.525 4.351 20 0 HIADHN CCN(C(=O)CCc1c(C)nn(CC(C)C)c1C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000545475797 940571360 /nfs/dbraw/zinc/57/13/60/940571360.db2.gz MWFFAISAQMPXFV-HSZRJFAPSA-N 0 3 410.606 4.212 20 0 HIADHN CCOc1c(Cl)cc(C(=O)N(CC)[C@H]2CCN(Cc3ccccc3)C2)cc1OC ZINC000545475917 940571470 /nfs/dbraw/zinc/57/14/70/940571470.db2.gz SRHDYNQOKPOZLQ-IBGZPJMESA-N 0 3 416.949 4.484 20 0 HIADHN CCN(Cc1nc(-c2cc(F)c(F)c(F)c2)no1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000545517412 940572828 /nfs/dbraw/zinc/57/28/28/940572828.db2.gz YDYCDHCVKFOGLD-KRWDZBQOSA-N 0 3 416.447 4.250 20 0 HIADHN Cc1cc(-c2nc(-c3ccc(N4CCCN(C)CC4)nc3)no2)c(Cl)cc1F ZINC000545651970 940578937 /nfs/dbraw/zinc/57/89/37/940578937.db2.gz ROFGLAQEYONMHY-UHFFFAOYSA-N 0 3 401.873 4.041 20 0 HIADHN CC(C)[C@@H](Cc1ccccc1)c1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1 ZINC000545657601 940579222 /nfs/dbraw/zinc/57/92/22/940579222.db2.gz HPVIPNHLCMEPLD-OAQYLSRUSA-N 0 3 405.546 4.256 20 0 HIADHN Fc1cccc(CN2CCC[C@@H](c3nc(-c4ccnc(OCC(F)F)c4)no3)C2)c1 ZINC000545845331 940629834 /nfs/dbraw/zinc/62/98/34/940629834.db2.gz ZYFPPOMMYMVDBZ-MRXNPFEDSA-N 0 3 418.419 4.294 20 0 HIADHN COCCC(C)(C)C(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1 ZINC000546122466 940705688 /nfs/dbraw/zinc/70/56/88/940705688.db2.gz JDFYAAAZBZXHCJ-UHFFFAOYSA-N 0 3 409.574 4.053 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)NCc1nc2ccccc2n1C1CC1 ZINC000546155646 940716099 /nfs/dbraw/zinc/71/60/99/940716099.db2.gz NXBORRUVFOEESN-IBGZPJMESA-N 0 3 417.557 4.177 20 0 HIADHN CCN(C(=O)Cc1coc(-c2ccc(F)cc2)n1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000546183356 940722952 /nfs/dbraw/zinc/72/29/52/940722952.db2.gz BHFNSLUVNDGCMZ-JOCHJYFZSA-N 0 3 407.489 4.146 20 0 HIADHN CCN(C(=O)c1cc(C)n(-c2ccc(F)cc2F)n1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000546183574 940723613 /nfs/dbraw/zinc/72/36/13/940723613.db2.gz POEGKARWLKWLPC-HXUWFJFHSA-N 0 3 424.495 4.196 20 0 HIADHN CCN(C(=O)Cc1nc(-c2ccsc2)oc1C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000546182756 940723637 /nfs/dbraw/zinc/72/36/37/940723637.db2.gz IZTZXIWYFZVINA-FQEVSTJZSA-N 0 3 409.555 4.377 20 0 HIADHN CCCc1c(NC(=O)NC[C@H](C)N(C)Cc2ccccc2)cnn1-c1cc(C)ccn1 ZINC000546217326 940732238 /nfs/dbraw/zinc/73/22/38/940732238.db2.gz JWNIHIMYFXYZEL-IBGZPJMESA-N 0 3 420.561 4.170 20 0 HIADHN COc1ccc(C[C@H](C)CN2CCCN(C(=O)c3ccc(F)cc3)CC2)cc1F ZINC000546308178 940776252 /nfs/dbraw/zinc/77/62/52/940776252.db2.gz VSAHZEBSLZWZJC-KRWDZBQOSA-N 0 3 402.485 4.000 20 0 HIADHN Fc1cccc(CN2CCC[C@H](c3nc(-c4ccc(OCC5CC5)nc4)no3)C2)c1 ZINC000546359224 940801168 /nfs/dbraw/zinc/80/11/68/940801168.db2.gz NYCJBKAWWXXIPC-IBGZPJMESA-N 0 3 408.477 4.439 20 0 HIADHN C[C@@H](CCc1cccc(F)c1)c1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1 ZINC000546363108 940802210 /nfs/dbraw/zinc/80/22/10/940802210.db2.gz PGUHQKZROOIMMH-KRWDZBQOSA-N 0 3 409.509 4.149 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(CSc4ccccc4Cl)n3)cn2)CC1 ZINC000546367581 940803178 /nfs/dbraw/zinc/80/31/78/940803178.db2.gz VHRFBSGPUPDRSE-UHFFFAOYSA-N 0 3 415.950 4.219 20 0 HIADHN CC[C@@H](CNC(=O)c1cc(C)n(Cc2ccncc2)c1C)N1CCc2ccccc2C1 ZINC000546583298 940857560 /nfs/dbraw/zinc/85/75/60/940857560.db2.gz MFEBAEDCJAGDMF-DEOSSOPVSA-N 0 3 416.569 4.115 20 0 HIADHN Cc1ccc(S(=O)(=O)N2CCC(N[C@@H](C)c3csc(C(C)C)n3)CC2)cc1 ZINC000546692969 940869534 /nfs/dbraw/zinc/86/95/34/940869534.db2.gz TUYXYXJTMMGSMH-INIZCTEOSA-N 0 3 407.605 4.079 20 0 HIADHN Fc1ccc(-c2nn(-c3ccccc3)cc2CN2CCOC3(CCOCC3)CC2)cc1 ZINC000546717894 940872205 /nfs/dbraw/zinc/87/22/05/940872205.db2.gz LSPQYLPKIFGRMM-UHFFFAOYSA-N 0 3 421.516 4.450 20 0 HIADHN Cc1ccc(-c2csc3ncnc(NC(C)(C)CCN4CCN(C)CC4)c23)cc1 ZINC000546732235 940874415 /nfs/dbraw/zinc/87/44/15/940874415.db2.gz JFBHZKUCRKMXBI-UHFFFAOYSA-N 0 3 409.603 4.495 20 0 HIADHN CCN1c2ccc(NC(=O)NC[C@@H](c3ccc(C)cc3)N3CCCC3)cc2CCC1=O ZINC000546844845 940893595 /nfs/dbraw/zinc/89/35/95/940893595.db2.gz NRJQAVIPEMHLGA-QHCPKHFHSA-N 0 3 420.557 4.253 20 0 HIADHN CCN(C(=O)c1cccc(OCc2cccnc2)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000546893595 940904303 /nfs/dbraw/zinc/90/43/03/940904303.db2.gz XRMRVSPLCFKFGG-DEOSSOPVSA-N 0 3 415.537 4.397 20 0 HIADHN CCN(C(=O)c1cn(CCOC)c2ccccc12)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000546905769 940907910 /nfs/dbraw/zinc/90/79/10/940907910.db2.gz YNNPTCXQBJDJEA-OAQYLSRUSA-N 0 3 405.542 4.024 20 0 HIADHN Cc1cc(C)nc(NC2CCN(C(=O)c3ccc(Br)cc3C)CC2)c1 ZINC000546904637 940908287 /nfs/dbraw/zinc/90/82/87/940908287.db2.gz BKIRLIWYFMZHKV-UHFFFAOYSA-N 0 3 402.336 4.486 20 0 HIADHN CCOCc1ccccc1-c1noc(-c2ccc(N3CCN(C(C)C)CC3)cc2)n1 ZINC000547050332 940974652 /nfs/dbraw/zinc/97/46/52/940974652.db2.gz LHFUZTZVFWFQFN-UHFFFAOYSA-N 0 3 406.530 4.471 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(-c4cccc(OC5CCCC5)c4)n3)cn2)CC1 ZINC000547066821 940981688 /nfs/dbraw/zinc/98/16/88/940981688.db2.gz TZPVZEQXGPOORC-UHFFFAOYSA-N 0 3 419.529 4.262 20 0 HIADHN CN1CCCN(c2ccc(-c3noc([C@H]4C[C@]45CCCc4ccccc45)n3)cn2)CC1 ZINC000547067354 940981778 /nfs/dbraw/zinc/98/17/78/940981778.db2.gz CKWODHLAALBHLF-BWKNWUBXSA-N 0 3 415.541 4.035 20 0 HIADHN C/C(=C/c1cccc(Cl)c1)c1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1 ZINC000547073725 940985177 /nfs/dbraw/zinc/98/51/77/940985177.db2.gz UWQMSGCDGHOWSE-SSZFMOIBSA-N 0 3 409.921 4.487 20 0 HIADHN CCc1cccnc1-c1noc([C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)n1 ZINC000547124986 941004581 /nfs/dbraw/zinc/00/45/81/941004581.db2.gz GFAHGJIVKOGNTC-FQEVSTJZSA-N 0 3 402.420 4.400 20 0 HIADHN O=C1C[C@H](c2noc([C@@H]3CCCN(Cc4cccc(F)c4)C3)n2)CN1c1ccccc1 ZINC000547133670 941007482 /nfs/dbraw/zinc/00/74/82/941007482.db2.gz GGZXJMAAPBURQQ-MOPGFXCFSA-N 0 3 420.488 4.109 20 0 HIADHN CN(C)c1nc2cc(-c3noc(-c4ccc(CN5CCSCC5)cc4)n3)ccc2o1 ZINC000547227607 941037948 /nfs/dbraw/zinc/03/79/48/941037948.db2.gz FOOKPEVFLYXYEO-UHFFFAOYSA-N 0 3 421.526 4.160 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N[C@H]1CCOc2ccc(F)cc21)c1cccc(OC)c1 ZINC000547699808 941072482 /nfs/dbraw/zinc/07/24/82/941072482.db2.gz SVYZTXKSPWFIDK-SFTDATJTSA-N 0 3 415.509 4.040 20 0 HIADHN CC(C)N1CCN([C@@H]2CCN(Cc3nc(-c4ccccc4Cl)cs3)C2)CC1 ZINC000547829542 941077674 /nfs/dbraw/zinc/07/76/74/941077674.db2.gz VMRMAERFAKNFIP-QGZVFWFLSA-N 0 3 405.011 4.064 20 0 HIADHN Cc1ccnc2c1cccc2S(=O)(=O)N(C)[C@@H]1CCN(Cc2ccccc2)[C@@H](C)C1 ZINC000547966470 941081168 /nfs/dbraw/zinc/08/11/68/941081168.db2.gz PMTCHMYPWVGPMX-PZJWPPBQSA-N 0 3 423.582 4.217 20 0 HIADHN COc1cc(NC(=O)CCN2CC(Cc3ccc(F)c(F)c3)C2)c(OC)cc1Cl ZINC000548028175 941083399 /nfs/dbraw/zinc/08/33/99/941083399.db2.gz PXUGWKPHMGIDTN-UHFFFAOYSA-N 0 3 424.875 4.139 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)N[C@@H](C)c1ccc(Br)s1 ZINC000548078057 941085715 /nfs/dbraw/zinc/08/57/15/941085715.db2.gz AEPMSJPVMGHRQB-NSHDSACASA-N 0 3 412.353 4.464 20 0 HIADHN C[C@@H](CN[C@H]1CCS(=O)(=O)c2ccc(Br)cc21)C1CCCCC1 ZINC000548155973 941089798 /nfs/dbraw/zinc/08/97/98/941089798.db2.gz YWJDHFJEPMQQGS-GUYCJALGSA-N 0 3 400.382 4.474 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccnc2)C1)N1C[C@H](c2ccccc2)[C@@H]2CCCC[C@H]21 ZINC000548253303 941092477 /nfs/dbraw/zinc/09/24/77/941092477.db2.gz HAYGXTYWUXBFQI-ZFFYZDHPSA-N 0 3 403.570 4.478 20 0 HIADHN O=C(Nc1ccc(OC(F)F)c2cccnc12)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000548476574 941106647 /nfs/dbraw/zinc/10/66/47/941106647.db2.gz TWRBTUUXZYUZQC-MRXNPFEDSA-N 0 3 412.440 4.082 20 0 HIADHN CC1(C(=O)NC2CCN(CCOc3ccc(Br)cc3)CC2)CCCCC1 ZINC000548695534 941119868 /nfs/dbraw/zinc/11/98/68/941119868.db2.gz LUIGEXCVHIFMPV-UHFFFAOYSA-N 0 3 423.395 4.379 20 0 HIADHN CN(Cc1ccccc1)Cc1cccc(C(=O)N2CCN(Cc3ccccc3)CC2)c1 ZINC000548889372 941127977 /nfs/dbraw/zinc/12/79/77/941127977.db2.gz CPKVOGTWAYOFBV-UHFFFAOYSA-N 0 3 413.565 4.277 20 0 HIADHN CCc1nnc(-c2ccc(NC(=O)N[C@@H](CN(C)C)c3ccc(Cl)cc3)cc2)o1 ZINC000548964153 941134890 /nfs/dbraw/zinc/13/48/90/941134890.db2.gz KFCSJQPAYUAJIX-SFHVURJKSA-N 0 3 413.909 4.377 20 0 HIADHN CCn1nccc1CCN1CCc2c(cccc2NC(=O)Nc2ccc(C)cc2)C1 ZINC000549040520 941147501 /nfs/dbraw/zinc/14/75/01/941147501.db2.gz GFUZZJBIWCZGNG-UHFFFAOYSA-N 0 3 403.530 4.456 20 0 HIADHN Cn1nccc1C1C[C@H]2CC[C@@H](C1)N2Cc1ccc(OCc2ccccc2F)nc1 ZINC000549079689 941153925 /nfs/dbraw/zinc/15/39/25/941153925.db2.gz IPNOIQFRSTXLCR-SEJPIABJSA-N 0 3 406.505 4.444 20 0 HIADHN O=C(Nc1cccc(Br)c1Cl)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000549086717 941155483 /nfs/dbraw/zinc/15/54/83/941155483.db2.gz PHFQNBFYCVESPU-AWEZNQCLSA-N 0 3 408.727 4.499 20 0 HIADHN Cc1cccc(NC(=O)CN[C@H]2CCN(C(C)C)[C@H]2c2ccc(F)c(F)c2)c1C ZINC000549113891 941161180 /nfs/dbraw/zinc/16/11/80/941161180.db2.gz UBUCFWONJHCGMR-GMAHTHKFSA-N 0 3 401.501 4.334 20 0 HIADHN CCN1CC[C@@H](NCC(=O)Nc2cccc(Cl)c2)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000549116262 941161667 /nfs/dbraw/zinc/16/16/67/941161667.db2.gz MQFRCMZPHMLZQV-XLIONFOSSA-N 0 3 411.855 4.121 20 0 HIADHN COc1cc(OC)cc(C2(F)CCN(C[C@H](O)COc3ccccc3Cl)CC2)c1 ZINC000549117924 941161806 /nfs/dbraw/zinc/16/18/06/941161806.db2.gz YUAPZSFROMMGCD-KRWDZBQOSA-N 0 3 423.912 4.058 20 0 HIADHN CN(C)C[C@H](NC(=O)NCC1CCN(c2ccccc2)CC1)c1ccc(Cl)cc1 ZINC000549195827 941170293 /nfs/dbraw/zinc/17/02/93/941170293.db2.gz ADCGVOMWUYWYBN-QFIPXVFZSA-N 0 3 414.981 4.159 20 0 HIADHN CC[C@@H](C)NC(=O)c1ccc(NC(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)cc1 ZINC000549231492 941172709 /nfs/dbraw/zinc/17/27/09/941172709.db2.gz OQYYLPLXGZWGOP-QRWLVFNGSA-N 0 3 416.953 4.293 20 0 HIADHN Cc1cc(C)n(-c2ccc(CC(=O)N[C@H](CN(C)C)c3ccc(Cl)cc3)cc2)n1 ZINC000549246302 941173941 /nfs/dbraw/zinc/17/39/41/941173941.db2.gz YBENIWRNBTZGNK-JOCHJYFZSA-N 0 3 410.949 4.104 20 0 HIADHN CCc1nc2cc(CNCc3ccc(OCc4noc(C)n4)cc3)ccc2n1C1CC1 ZINC000549247538 941173961 /nfs/dbraw/zinc/17/39/61/941173961.db2.gz SQNRVJMINWVMNV-UHFFFAOYSA-N 0 3 417.513 4.494 20 0 HIADHN O=C(COc1ccccc1CN1CC[C@@H](C(F)(F)F)C2(CCC2)C1)NCC1CC1 ZINC000549425381 941188639 /nfs/dbraw/zinc/18/86/39/941188639.db2.gz NFLWOIHVZATOCF-LJQANCHMSA-N 0 3 410.480 4.146 20 0 HIADHN CC[C@H](C)c1nnc(N2CCN(Cc3ccccc3)C(C)(C)C2)n1C[C@@H]1CCCO1 ZINC000549473605 941193869 /nfs/dbraw/zinc/19/38/69/941193869.db2.gz NYINAISAAULZNF-FPOVZHCZSA-N 0 3 411.594 4.071 20 0 HIADHN COc1ccc(NC(=O)[C@H](C)N[C@H]2CCN(C(C)C)[C@@H]2c2ccc(F)c(F)c2)cc1 ZINC000549476920 941194598 /nfs/dbraw/zinc/19/45/98/941194598.db2.gz OPTDLALRZTWKSU-UZQPLGKSSA-N 0 3 417.500 4.114 20 0 HIADHN COc1cccc([C@H]2[C@@H](NCc3nccn3Cc3ccccc3)CCN2C2CC2)c1 ZINC000549477031 941194719 /nfs/dbraw/zinc/19/47/19/941194719.db2.gz IFYNVSFPVHOAOE-ZCYQVOJMSA-N 0 3 402.542 4.008 20 0 HIADHN CN(C)C[C@H](NC(=O)NC[C@@H]1CCCO[C@@H]1c1ccccc1)c1ccc(Cl)cc1 ZINC000549480510 941194947 /nfs/dbraw/zinc/19/49/47/941194947.db2.gz BEYWTXNYYCTYQC-ILWGZMRPSA-N 0 3 415.965 4.410 20 0 HIADHN Cc1nn(C(C)(C)C)cc1[C@@H](C)NC(=O)N[C@@H](CN(C)C)c1ccc(Cl)cc1 ZINC000549493767 941196292 /nfs/dbraw/zinc/19/62/92/941196292.db2.gz VPUQAWSSVVRFBQ-KUHUBIRLSA-N 0 3 405.974 4.263 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@@H](NCc2cccc(NC(=O)[C@@H]3CCCO3)c2)c2ccccc21 ZINC000549525020 941198025 /nfs/dbraw/zinc/19/80/25/941198025.db2.gz QCHFKOLZVGFQDU-ZLNRFVROSA-N 0 3 422.525 4.076 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)NCc2ccsc2Br)CC1 ZINC000549559041 941199254 /nfs/dbraw/zinc/19/92/54/941199254.db2.gz DFOWGWRDGIWHCC-UHFFFAOYSA-N 0 3 422.392 4.317 20 0 HIADHN Cc1ccc(Nc2nc(CN3CCC(CCN4CCOCC4)CC3)cs2)cc1 ZINC000549582362 941200352 /nfs/dbraw/zinc/20/03/52/941200352.db2.gz IMKOYABRMAIFBW-UHFFFAOYSA-N 0 3 400.592 4.129 20 0 HIADHN C[C@H](c1ccc(F)cc1)N1CC[C@H](N[C@H]2CCO[C@@H]2c2ccc(Cl)cc2)C1=O ZINC000549609835 941201238 /nfs/dbraw/zinc/20/12/38/941201238.db2.gz BZQYOMFSEMHPKU-AKQDLLBKSA-N 0 3 402.897 4.261 20 0 HIADHN Cc1oc(-c2ccsc2)nc1CC(=O)N[C@@H](CN(C)C)c1ccc(Cl)cc1 ZINC000549617853 941201569 /nfs/dbraw/zinc/20/15/69/941201569.db2.gz NPKXFGOYFXMDJU-SFHVURJKSA-N 0 3 403.935 4.327 20 0 HIADHN Cn1c(COc2ccccc2Cl)nnc1S[C@@H]1CCN(Cc2ccccc2)C1 ZINC000549619110 941201604 /nfs/dbraw/zinc/20/16/04/941201604.db2.gz WFODSUGEXYBHKO-QGZVFWFLSA-N 0 3 414.962 4.414 20 0 HIADHN O=C(NCCN1CCCC1)c1ccc(NCc2ccc(F)c(Br)c2)cc1 ZINC000549681594 941204301 /nfs/dbraw/zinc/20/43/01/941204301.db2.gz RESOCEXJNVOSJK-UHFFFAOYSA-N 0 3 420.326 4.026 20 0 HIADHN Fc1ccc(CC2(NCc3csc(-c4ncccn4)n3)CCOCC2)c(Cl)c1 ZINC000549923837 941239759 /nfs/dbraw/zinc/23/97/59/941239759.db2.gz QGINEZRWICXZNZ-UHFFFAOYSA-N 0 3 418.925 4.274 20 0 HIADHN CC[C@@H]1CN(c2nnc(C3CCC3)n2C[C@H]2CCCCO2)CCN1Cc1ccccc1 ZINC000550055919 941275312 /nfs/dbraw/zinc/27/53/12/941275312.db2.gz DWRSQRLOYJIBFZ-DHIUTWEWSA-N 0 3 423.605 4.216 20 0 HIADHN COCCc1ccc(OC[C@H](O)CN2CCC([C@@H](F)c3ccccc3F)CC2)cc1 ZINC000550097813 941284042 /nfs/dbraw/zinc/28/40/42/941284042.db2.gz VERXMWOWVQXYFK-HYBUGGRVSA-N 0 3 419.512 4.177 20 0 HIADHN C[C@H]1CCCCN1CCC(=O)Nc1cccc(CS(=O)(=O)Cc2ccccc2)c1 ZINC000550160190 941291644 /nfs/dbraw/zinc/29/16/44/941291644.db2.gz VVBLGSSFUGBHRC-IBGZPJMESA-N 0 3 414.571 4.005 20 0 HIADHN Cc1ccc([C@H](CNC(=O)C2CCC(OC[C@H]3CCCO3)CC2)N2CCCC2)cc1 ZINC000550272783 941307567 /nfs/dbraw/zinc/30/75/67/941307567.db2.gz AAYFHTPGTUQTPP-ZQHBMWIYSA-N 0 3 414.590 4.003 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)c1cnc2c(F)ccc(F)c2c1 ZINC000550572027 941340607 /nfs/dbraw/zinc/34/06/07/941340607.db2.gz GUCWDWHRQDWINM-SFHVURJKSA-N 0 3 410.468 4.035 20 0 HIADHN CS(=O)(=O)C[C@H](NC[C@H](OCc1ccccc1)c1ccc(Cl)cc1)C1CC1 ZINC000550822176 941371140 /nfs/dbraw/zinc/37/11/40/941371140.db2.gz FNZOFPJNWBTYIM-SFTDATJTSA-N 0 3 407.963 4.011 20 0 HIADHN CCO[C@@H]1C[C@H](N[C@H](C)c2sc(-c3ccc(OC)cc3)nc2C)[C@@H]1n1cccn1 ZINC000550947191 941384689 /nfs/dbraw/zinc/38/46/89/941384689.db2.gz ZCMVTTZVRFOCFZ-YGBSJELFSA-N 0 3 412.559 4.393 20 0 HIADHN CN(C)Cc1ccc(S(=O)(=O)N[C@H](c2cccc3ccccc32)C(F)(F)F)cc1 ZINC000551018657 941395734 /nfs/dbraw/zinc/39/57/34/941395734.db2.gz MXUYYWJYCCZKCX-HXUWFJFHSA-N 0 3 422.472 4.483 20 0 HIADHN C[C@H]1C[C@H](NC(=O)Nc2ccc(Oc3cccnc3)nc2)CN1Cc1ccccc1 ZINC000551026845 941397158 /nfs/dbraw/zinc/39/71/58/941397158.db2.gz CMCWIGZNGYQNTE-PXNSSMCTSA-N 0 3 403.486 4.053 20 0 HIADHN CC[C@@H](NCc1ccc(NC(=O)c2ccncc2)cc1)c1ccc(C(=O)OC)cc1 ZINC000551029438 941397381 /nfs/dbraw/zinc/39/73/81/941397381.db2.gz DPMXTQJGTXMTQI-JOCHJYFZSA-N 0 3 403.482 4.361 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)[C@@H]1CCCc2cccnc21 ZINC000551206721 941427509 /nfs/dbraw/zinc/42/75/09/941427509.db2.gz JRGDMCUJZMBNDR-LJQANCHMSA-N 0 3 405.464 4.111 20 0 HIADHN OC[C@@H]1CC[C@H](CN[C@@H](Cc2ccccc2F)c2ccccc2Br)O1 ZINC000551229303 941431226 /nfs/dbraw/zinc/43/12/26/941431226.db2.gz RXWSHRBOPZQKML-GUXCAODWSA-N 0 3 408.311 4.002 20 0 HIADHN C[C@H](c1ccccc1F)N1CCC[C@@H](N[C@@H](C)c2ccc3c(c2)CCC(=O)N3)C1=O ZINC000551242891 941434615 /nfs/dbraw/zinc/43/46/15/941434615.db2.gz XYPCTHNARNXKSP-WJONJSRFSA-N 0 3 409.505 4.113 20 0 HIADHN CCS(=O)(=O)c1ccc([C@@H](C)NCCOc2ccccc2C(F)(F)F)cc1 ZINC000551411321 941472477 /nfs/dbraw/zinc/47/24/77/941472477.db2.gz FIRSTBGRLPLXCE-CQSZACIVSA-N 0 3 401.450 4.229 20 0 HIADHN COc1cccc(NC(=O)CN[C@H](c2cccc(C(F)(F)F)c2)C2CCOCC2)c1 ZINC000551419133 941474739 /nfs/dbraw/zinc/47/47/39/941474739.db2.gz UADZOVSOSLUGLC-NRFANRHFSA-N 0 3 422.447 4.410 20 0 HIADHN CC(C)c1ccccc1OC[C@H](O)CN[C@@H](c1cncc(Br)c1)C1CC1 ZINC000551419125 941474838 /nfs/dbraw/zinc/47/48/38/941474838.db2.gz TVHJFLFZAXDHAD-WIYYLYMNSA-N 0 3 419.363 4.448 20 0 HIADHN COC(=O)[C@@H](Cc1ccccc1)[C@@H](C)NCC(=O)Nc1ccccc1-c1ccccc1 ZINC000551421984 941475856 /nfs/dbraw/zinc/47/58/56/941475856.db2.gz MXCOWNAYSJSQEH-XXBNENTESA-N 0 3 416.521 4.302 20 0 HIADHN COC(=O)[C@H](Cc1ccccc1)[C@H](C)NCC(=O)Nc1ccccc1-c1ccccc1 ZINC000551421983 941475924 /nfs/dbraw/zinc/47/59/24/941475924.db2.gz MXCOWNAYSJSQEH-WMZHIEFXSA-N 0 3 416.521 4.302 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1cccc(F)c1Br ZINC000551545095 941498685 /nfs/dbraw/zinc/49/86/85/941498685.db2.gz MHKFKUKXOQANLO-UHFFFAOYSA-N 0 3 421.310 4.045 20 0 HIADHN COc1ccc([C@@H](NCc2cccc(N3C(=O)N[C@](C)(C4CC4)C3=O)c2)C(C)C)cc1 ZINC000551562954 941501970 /nfs/dbraw/zinc/50/19/70/941501970.db2.gz CZUPXNZBSMZBLD-WIOPSUGQSA-N 0 3 421.541 4.407 20 0 HIADHN CC[C@@H](NCc1cccc(N2C(=O)N[C@](C)(C3CC3)C2=O)c1)c1ccc(OC)cc1 ZINC000551574456 941505324 /nfs/dbraw/zinc/50/53/24/941505324.db2.gz IWJUODPNBHZYDQ-ZJSXRUAMSA-N 0 3 407.514 4.161 20 0 HIADHN C[C@H]1CCN(C(=O)Cc2cscc2Br)CCN1Cc1ccccc1 ZINC000551598062 941509268 /nfs/dbraw/zinc/50/92/68/941509268.db2.gz LDGIZQYYHCYARP-HNNXBMFYSA-N 0 3 407.377 4.176 20 0 HIADHN COc1cc(CN2CCN(C)[C@@H](Cc3ccccc3)C2)ccc1OCc1ccncc1 ZINC000551602515 941510180 /nfs/dbraw/zinc/51/01/80/941510180.db2.gz KKXUBEXHTBXMMF-DEOSSOPVSA-N 0 3 417.553 4.028 20 0 HIADHN COCC[C@H](N[C@@H]1CCCN(CC(F)(F)F)C1=O)c1ccc(Cl)c(Cl)c1 ZINC000551724181 941533939 /nfs/dbraw/zinc/53/39/39/941533939.db2.gz MRGPADGYGLMKPE-LSDHHAIUSA-N 0 3 413.267 4.214 20 0 HIADHN O=C(c1ccccc1NCc1cccnc1)N1CCN(c2ccnc3ccccc32)CC1 ZINC000552008513 941567853 /nfs/dbraw/zinc/56/78/53/941567853.db2.gz ILFVFLMUFRJJLR-UHFFFAOYSA-N 0 3 423.520 4.204 20 0 HIADHN Cc1cc(CN2CCC(C(=O)NCC(F)(F)F)CC2)ccc1Oc1cccnc1 ZINC000552071742 941579721 /nfs/dbraw/zinc/57/97/21/941579721.db2.gz XHILYDMRMANKIS-UHFFFAOYSA-N 0 3 407.436 4.073 20 0 HIADHN CC[C@H](N[C@@H](C)c1cccc(N2CCCS2(=O)=O)c1)c1ccc(OC)c(OC)c1 ZINC000552090434 941583265 /nfs/dbraw/zinc/58/32/65/941583265.db2.gz KCTRDZWQFPHCFB-JXFKEZNVSA-N 0 3 418.559 4.046 20 0 HIADHN C[C@@H](Cn1ccc2ccccc21)C(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000552093037 941583684 /nfs/dbraw/zinc/58/36/84/941583684.db2.gz SUWBBLONIHTOAP-IBGZPJMESA-N 0 3 405.542 4.120 20 0 HIADHN Cc1ccc2nc(C3CC3)cc(C(=O)N(C)CCCN(C)Cc3ccncc3)c2c1 ZINC000552112147 941586888 /nfs/dbraw/zinc/58/68/88/941586888.db2.gz NGZODSXHTTVERZ-UHFFFAOYSA-N 0 3 402.542 4.410 20 0 HIADHN CN(CCCN(C)C(=O)c1ccccc1OCc1ccc(F)cc1)Cc1ccncc1 ZINC000552112558 941587315 /nfs/dbraw/zinc/58/73/15/941587315.db2.gz JKTSYBYGDFFUSK-UHFFFAOYSA-N 0 3 421.516 4.394 20 0 HIADHN O=C(c1cc(C2CC2)nn1-c1ccccc1)N1CCN(c2ccnc3ccccc32)CC1 ZINC000552150107 941594261 /nfs/dbraw/zinc/59/42/61/941594261.db2.gz KEGYMASPLABZKY-UHFFFAOYSA-N 0 3 423.520 4.260 20 0 HIADHN C[C@@H](CC(=O)Nc1cccc(CN2CC[C@H](O)C2)c1)c1ccc(C(F)(F)F)cc1 ZINC000552198773 941600316 /nfs/dbraw/zinc/60/03/16/941600316.db2.gz FJZBJKJUSYIIRD-YWZLYKJASA-N 0 3 406.448 4.404 20 0 HIADHN C[C@H](N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1)c1ccccc1-n1ccnn1 ZINC000552249815 941614193 /nfs/dbraw/zinc/61/41/93/941614193.db2.gz LJJRCVSOKHWQSB-CVDCTZTESA-N 0 3 411.509 4.168 20 0 HIADHN CC[C@H](NCc1cccc(OCC(=O)N(C)C)c1)c1ccc(OC(F)(F)F)cc1 ZINC000552255395 941615196 /nfs/dbraw/zinc/61/51/96/941615196.db2.gz DRAOCCCWTVLXDU-IBGZPJMESA-N 0 3 410.436 4.293 20 0 HIADHN C[C@H](N[C@@H]1CCC(=O)N[C@H]1C(C)(C)C)c1ccc(OC(F)F)cc1OC(F)F ZINC000552296333 941625002 /nfs/dbraw/zinc/62/50/02/941625002.db2.gz HPVZJIMQSAMJQU-OWRWGESLSA-N 0 3 406.420 4.233 20 0 HIADHN C[C@H](N[C@@H](c1cccc(OC(F)(F)F)c1)C1CC1)c1cccc(S(N)(=O)=O)c1 ZINC000552317742 941630355 /nfs/dbraw/zinc/63/03/55/941630355.db2.gz HEPFZNXKSPFXOH-KPZWWZAWSA-N 0 3 414.449 4.035 20 0 HIADHN Cc1ccc(-c2nc3c(s2)[C@H](NCC2(S(C)(=O)=O)CCCC2)CCC3)cc1 ZINC000552335276 941635378 /nfs/dbraw/zinc/63/53/78/941635378.db2.gz NASWIFHPZKMNSZ-QGZVFWFLSA-N 0 3 404.601 4.443 20 0 HIADHN CC(=O)c1cccc(OC[C@H](O)CNCc2ccc(Oc3ccc(F)cc3)cc2)c1 ZINC000552501863 941689763 /nfs/dbraw/zinc/68/97/63/941689763.db2.gz GJYKHPAOSGPYCB-OAQYLSRUSA-N 0 3 409.457 4.350 20 0 HIADHN CCCN(C)[C@H](CNC(=O)c1cn(CC(F)(F)F)nc1C)c1ccc(Cl)cc1 ZINC000552580492 941711135 /nfs/dbraw/zinc/71/11/35/941711135.db2.gz IQMAPALRBCIXQN-QGZVFWFLSA-N 0 3 416.875 4.220 20 0 HIADHN CC(C)c1nc(C2CCN(C(=O)[C@@H](C)N3CCC(Cc4ccccc4)CC3)CC2)no1 ZINC000552609056 941721567 /nfs/dbraw/zinc/72/15/67/941721567.db2.gz OJHGQTXVDOKBJE-LJQANCHMSA-N 0 3 424.589 4.242 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)[C@H]1CCCN(C(=O)C(C)(C)C)C1)c1ccc(Cl)cc1 ZINC000552681029 941736512 /nfs/dbraw/zinc/73/65/12/941736512.db2.gz NBUKUOUOJDCGOS-ICSRJNTNSA-N 0 3 422.013 4.124 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)c2cccc(OCc3cccs3)c2)cc1 ZINC000552817235 941775890 /nfs/dbraw/zinc/77/58/90/941775890.db2.gz HSMYMFGFVPGKJL-JOCHJYFZSA-N 0 3 410.539 4.368 20 0 HIADHN C[C@@H](C(=O)N(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1)c1ccccn1 ZINC000552827761 941780201 /nfs/dbraw/zinc/78/02/01/941780201.db2.gz YIZHFJCDSAEVBL-QPPBQGQZSA-N 0 3 414.553 4.274 20 0 HIADHN O=C(CCC(F)(F)F)N(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000552850079 941787795 /nfs/dbraw/zinc/78/77/95/941787795.db2.gz LWKZGFKJGJLNSC-FQEVSTJZSA-N 0 3 405.464 4.417 20 0 HIADHN Cc1cnc(CC(=O)N(Cc2ccncc2)[C@H]2CCCN(Cc3ccccc3)C2)s1 ZINC000552850898 941788203 /nfs/dbraw/zinc/78/82/03/941788203.db2.gz AYRSNMYVRQSBCR-QFIPXVFZSA-N 0 3 420.582 4.082 20 0 HIADHN Cc1nc(-c2cc([C@H](C)NCc3ccc(NS(C)(=O)=O)cc3)cs2)cs1 ZINC000552880319 941797358 /nfs/dbraw/zinc/79/73/58/941797358.db2.gz ZYWPKMDBMIDUTJ-LBPRGKRZSA-N 0 3 407.586 4.402 20 0 HIADHN Cc1cc2ncn(C[C@@H](O)CNCc3cc(Cl)ccc3OC(F)F)c2cc1C ZINC000553454748 941887491 /nfs/dbraw/zinc/88/74/91/941887491.db2.gz RIYYVZXVBOENFY-INIZCTEOSA-N 0 3 409.864 4.059 20 0 HIADHN Cc1ccc(C(=O)Nc2cccc(CNCCC(=O)Nc3ccc(C)cn3)c2)cc1 ZINC000553463118 941889407 /nfs/dbraw/zinc/88/94/07/941889407.db2.gz DEYFAZTZNWRZOA-UHFFFAOYSA-N 0 3 402.498 4.069 20 0 HIADHN CCCN(C)[C@H](CNC(=O)N[C@@H](C)Cc1c(C)noc1C)c1ccc(Cl)cc1 ZINC000553582456 941914165 /nfs/dbraw/zinc/91/41/65/941914165.db2.gz VQYPOBHYZJISEO-VBKZILBWSA-N 0 3 406.958 4.258 20 0 HIADHN C[C@H]1CN(C(=O)c2ccccc2CN(C)C)C[C@@H](c2cccc(C(F)(F)F)c2)O1 ZINC000553722153 941952754 /nfs/dbraw/zinc/95/27/54/941952754.db2.gz GCIMFELXBBYLCU-YWZLYKJASA-N 0 3 406.448 4.369 20 0 HIADHN CC(C)Oc1cc(Br)ccc1C(=O)N1CCN([C@H]2C[C@H]2C)C[C@H](C)C1 ZINC000553782682 941967936 /nfs/dbraw/zinc/96/79/36/941967936.db2.gz DOMDYUPDDKQSOD-DAYGRLMNSA-N 0 3 409.368 4.039 20 0 HIADHN CCCN(C)[C@H](CNC(=O)N1CCC[C@@H](c2ccnn2C)C1)c1ccc(Cl)cc1 ZINC000553895090 941992644 /nfs/dbraw/zinc/99/26/44/941992644.db2.gz LUVXCLRXBZQDGB-WIYYLYMNSA-N 0 3 417.985 4.046 20 0 HIADHN OC[C@H]1C=C[C@@H](N(CCOc2ccccc2Br)Cc2cccs2)C1 ZINC000553937605 942002958 /nfs/dbraw/zinc/00/29/58/942002958.db2.gz ALWYTYIUKSIRNW-JKSUJKDBSA-N 0 3 408.361 4.329 20 0 HIADHN OCC[C@H](NC[C@H](O)COc1c(Cl)cccc1Cl)c1ccc(Cl)cc1 ZINC000553959568 942007068 /nfs/dbraw/zinc/00/70/68/942007068.db2.gz YPYRWFSLAWCNIZ-YOEHRIQHSA-N 0 3 404.721 4.100 20 0 HIADHN Cc1cc(I)ccc1NC(=O)CN(C)C1CCC(F)(F)CC1 ZINC000553990796 942014360 /nfs/dbraw/zinc/01/43/60/942014360.db2.gz HGOSMLQKMILMJB-UHFFFAOYSA-N 0 3 422.257 4.048 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](NC[C@H]2CCCSC2)c2ccc(F)c(F)c2)c1 ZINC000554068434 942028957 /nfs/dbraw/zinc/02/89/57/942028957.db2.gz COTUSWMMFVOFAY-JLTOFOAXSA-N 0 3 411.539 4.191 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1cccc(C(=O)NC(C)(C)C)c1)c1ccco1 ZINC000554133391 942045542 /nfs/dbraw/zinc/04/55/42/942045542.db2.gz WAXMFVFJHVCYQA-YJBOKZPZSA-N 0 3 400.523 4.059 20 0 HIADHN CC[C@@H](C)NC(=O)c1ccc(NC(=O)N[C@H](CN(C)C)c2ccc(F)cc2)c(C)c1 ZINC000554162333 942053215 /nfs/dbraw/zinc/05/32/15/942053215.db2.gz QSQDDRCCERHOEK-IIBYNOLFSA-N 0 3 414.525 4.087 20 0 HIADHN COc1ccc([C@@H](C)NC(=O)NC[C@@H](c2ccccc2)N2CCCC2)c(C)c1OC ZINC000554201605 942065370 /nfs/dbraw/zinc/06/53/70/942065370.db2.gz WEOBOIXZTHREHV-NQIIRXRSSA-N 0 3 411.546 4.210 20 0 HIADHN COc1ccc([C@@H](C)NC(=O)NC[C@H](c2ccccc2)N2CCCC2)c(C)c1OC ZINC000554201607 942065384 /nfs/dbraw/zinc/06/53/84/942065384.db2.gz WEOBOIXZTHREHV-WIYYLYMNSA-N 0 3 411.546 4.210 20 0 HIADHN COc1ccc([C@H](C)NC(=O)NC[C@H](c2ccccc2)N2CCCC2)c(C)c1OC ZINC000554201599 942065650 /nfs/dbraw/zinc/06/56/50/942065650.db2.gz WEOBOIXZTHREHV-GHTZIAJQSA-N 0 3 411.546 4.210 20 0 HIADHN C[C@H](NC(=O)NC[C@@H](c1cccs1)N1CCCC1)c1nccn1-c1ccccc1 ZINC000554219609 942070928 /nfs/dbraw/zinc/07/09/28/942070928.db2.gz ZBXNNQAFBMXVAC-HKUYNNGSSA-N 0 3 409.559 4.131 20 0 HIADHN Cc1nn(C)c2sc([C@H](C)N[C@@H]3CC(=O)N(C)[C@@H]3c3ccc(Cl)c(F)c3)cc12 ZINC000554385131 942121519 /nfs/dbraw/zinc/12/15/19/942121519.db2.gz RNYVRPAFDFUKFQ-YARKZXGKSA-N 0 3 420.941 4.358 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)Nc1ccc(NC(C)=O)cc1C(F)(F)F ZINC000554399955 942126504 /nfs/dbraw/zinc/12/65/04/942126504.db2.gz MCCIAJKULJCPDY-UHFFFAOYSA-N 0 3 414.472 4.394 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)Nc1cccc(C(=O)N2CCCCC2)c1 ZINC000554418610 942134474 /nfs/dbraw/zinc/13/44/74/942134474.db2.gz CURBNZYQWDAWDE-UHFFFAOYSA-N 0 3 400.567 4.043 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1cccc(C(=O)N2CCCCC2)c1)c1ccco1 ZINC000554418573 942134639 /nfs/dbraw/zinc/13/46/39/942134639.db2.gz BQMHXLBGWHHTGC-FXAWDEMLSA-N 0 3 412.534 4.157 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1ccc(Br)c(OC)c1)c1ccco1 ZINC000554454802 942150213 /nfs/dbraw/zinc/15/02/13/942150213.db2.gz SZFOSMWDJAJAOU-WFASDCNBSA-N 0 3 410.312 4.302 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)Nc1ccccc1CC(=O)OC(C)(C)C ZINC000554481072 942157830 /nfs/dbraw/zinc/15/78/30/942157830.db2.gz ULBMTNFGNWHAIP-UHFFFAOYSA-N 0 3 403.567 4.301 20 0 HIADHN COC[C@H](NC(=O)N[C@H](CN1CCCC1)c1ccccc1)c1cccc(Cl)c1 ZINC000554696324 942203390 /nfs/dbraw/zinc/20/33/90/942203390.db2.gz XGPPWQUMLUFTTC-RTWAWAEBSA-N 0 3 401.938 4.164 20 0 HIADHN CSc1ccc([C@@H](CNC(=O)Cc2cccc(Br)c2)N(C)C)cc1 ZINC000554707548 942206395 /nfs/dbraw/zinc/20/63/95/942206395.db2.gz LZPPMBAFAANLDY-GOSISDBHSA-N 0 3 407.377 4.133 20 0 HIADHN c1nc(CN[C@@H]2CN(Cc3ccccc3)C[C@H]2c2ccccc2)nn1-c1ccccc1 ZINC000554843606 942282509 /nfs/dbraw/zinc/28/25/09/942282509.db2.gz MMYWVLGBNNRIBX-LOSJGSFVSA-N 0 3 409.537 4.025 20 0 HIADHN CCOC(=O)C1CCC(N(CC)Cc2nc(-c3ccc(OCC)cc3)no2)CC1 ZINC000554856052 942292937 /nfs/dbraw/zinc/29/29/37/942292937.db2.gz NRDGQKJLFCHQIA-UHFFFAOYSA-N 0 3 401.507 4.079 20 0 HIADHN CC(C)(CO)[C@H](NCc1cc(Br)c2c(c1)OCCO2)c1ccccc1 ZINC000554866599 942299687 /nfs/dbraw/zinc/29/96/87/942299687.db2.gz AWSQYBVHOYCSOD-LJQANCHMSA-N 0 3 406.320 4.070 20 0 HIADHN Cc1ccc(-c2nnc(-c3ccc(C(=O)N4[C@@H]5CC[C@H]4CCN(C)C5)cc3)o2)cc1 ZINC000554894223 942310921 /nfs/dbraw/zinc/31/09/21/942310921.db2.gz DWZYPLNOVOAEKR-LEWJYISDSA-N 0 3 402.498 4.021 20 0 HIADHN Cc1noc(-c2ccc(C)c(NC(=O)N[C@H](CN(C)C)c3ccc(Cl)cc3)c2)n1 ZINC000554908776 942315414 /nfs/dbraw/zinc/31/54/14/942315414.db2.gz NREOASYTYNVMLQ-LJQANCHMSA-N 0 3 413.909 4.431 20 0 HIADHN CC(C)[C@@H](NC(=O)CN[C@H]1c2ccccc2CC12CCOCC2)c1ccc(F)cc1 ZINC000554972579 942338518 /nfs/dbraw/zinc/33/85/18/942338518.db2.gz LHEDFBKIFXQTCJ-RPWUZVMVSA-N 0 3 410.533 4.323 20 0 HIADHN Cc1cccc(C)c1NC(=O)CCCN1CCN(c2cncc3ccccc32)CC1 ZINC000555005787 942352495 /nfs/dbraw/zinc/35/24/95/942352495.db2.gz BJPDSAOCPRTDTR-UHFFFAOYSA-N 0 3 402.542 4.393 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3c4c(cc5c3CCC5)CCC4)CC2)C[C@@H](C)O1 ZINC000555010370 942354541 /nfs/dbraw/zinc/35/45/41/942354541.db2.gz NKBLYLOMFBRHJG-QZTJIDSGSA-N 0 3 411.590 4.017 20 0 HIADHN CC(C)C(=O)c1ccc([C@H](C)C(=O)Nc2cccc(CN3CCC(O)CC3)c2)cc1 ZINC000555044045 942368339 /nfs/dbraw/zinc/36/83/39/942368339.db2.gz CCAFERPBAJTOBY-SFHVURJKSA-N 0 3 408.542 4.224 20 0 HIADHN Cn1nccc1C1C[C@H]2CC[C@@H](C1)N2[C@H]1CCN(c2ccc(Cl)cc2Cl)C1=O ZINC000555074240 942377529 /nfs/dbraw/zinc/37/75/29/942377529.db2.gz NSLLBFMSJZXCNE-UIXGOWAKSA-N 0 3 419.356 4.243 20 0 HIADHN CCN1CC[C@@H](NCC(=O)Nc2ccccc2Cl)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000555132352 942396568 /nfs/dbraw/zinc/39/65/68/942396568.db2.gz KGDMQZLYVURTIP-XLIONFOSSA-N 0 3 411.855 4.121 20 0 HIADHN COc1cccc([C@@H]2[C@@H](N[C@@H](C)C(=O)Nc3cccc(C)c3C)CCN2C2CC2)c1 ZINC000555133575 942397605 /nfs/dbraw/zinc/39/76/05/942397605.db2.gz UNSVVMBOORAIAS-GKVQRAMASA-N 0 3 407.558 4.207 20 0 HIADHN CN(C)C[C@H](NC(=O)N[C@H]1CCO[C@H](c2ccccc2)C1)c1ccc(Cl)cc1 ZINC000555146806 942404462 /nfs/dbraw/zinc/40/44/62/942404462.db2.gz NRSYNZXXTXOFDF-ACRUOGEOSA-N 0 3 401.938 4.162 20 0 HIADHN CCc1[nH]ccc1C(=O)N(Cc1ccccc1Br)C1CCN(C)CC1 ZINC000555162463 942411512 /nfs/dbraw/zinc/41/15/12/942411512.db2.gz MHNFFFSEWUNKSO-UHFFFAOYSA-N 0 3 404.352 4.076 20 0 HIADHN CN(C)C[C@H](NC(=O)Cc1csc(-c2cccs2)n1)c1ccc(Cl)cc1 ZINC000555230436 942437665 /nfs/dbraw/zinc/43/76/65/942437665.db2.gz ANSHLGQHSXGTQV-INIZCTEOSA-N 0 3 405.976 4.487 20 0 HIADHN CN(C)C[C@H](NC(=O)c1cc(NC(=O)C(C)(C)C)ccc1F)c1ccc(Cl)cc1 ZINC000555230950 942439021 /nfs/dbraw/zinc/43/90/21/942439021.db2.gz QRZBPTVUUBCPNJ-IBGZPJMESA-N 0 3 419.928 4.496 20 0 HIADHN COCCO[C@H]1CCCN(Cc2cccc(NC(=O)c3ccc(Cl)cc3)c2)C1 ZINC000555339712 942484018 /nfs/dbraw/zinc/48/40/18/942484018.db2.gz JKSQTZAXPWONPS-NRFANRHFSA-N 0 3 402.922 4.220 20 0 HIADHN COc1ccc(CN(Cc2cn(C)nc2-c2cccnc2)CC2CCC2)c(OC)c1 ZINC000555348832 942487413 /nfs/dbraw/zinc/48/74/13/942487413.db2.gz JZBIGKRUTPYFEV-UHFFFAOYSA-N 0 3 406.530 4.302 20 0 HIADHN CC(C)Cn1c(-c2ccc3ccccc3c2)nnc1N1CCN(C2CCOCC2)CC1 ZINC000555356698 942492170 /nfs/dbraw/zinc/49/21/70/942492170.db2.gz GGWZJCPQSNSDHJ-UHFFFAOYSA-N 0 3 419.573 4.055 20 0 HIADHN C[C@H](c1ccc(F)cc1)N1CC[C@H](N[C@H]2CCN(C)[C@@H]2c2ccc(Cl)cc2)C1=O ZINC000555527836 942629067 /nfs/dbraw/zinc/62/90/67/942629067.db2.gz TVFJJBOFUACHAD-NSEXGNSCSA-N 0 3 415.940 4.176 20 0 HIADHN CC(=O)CCc1ccc2oc(C(=O)N[C@@H](CN(C)C)c3ccc(F)cc3)c(C)c2c1 ZINC000555550544 942638705 /nfs/dbraw/zinc/63/87/05/942638705.db2.gz HRYSZYFXKYSXLS-NRFANRHFSA-N 0 3 410.489 4.435 20 0 HIADHN CCS(=O)(=O)c1ccc([C@H](C)NCCOc2ccc(C(F)(F)F)cc2)cc1 ZINC000555710412 942709051 /nfs/dbraw/zinc/70/90/51/942709051.db2.gz HVQFVVHUDPDTCU-AWEZNQCLSA-N 0 3 401.450 4.229 20 0 HIADHN COc1cnccc1[C@H](C)NC[C@H](O)CO[C@H](c1ccccc1)c1ccccc1C ZINC000556018124 942786648 /nfs/dbraw/zinc/78/66/48/942786648.db2.gz GSQWMCLPIWCQPW-QYXIYQDXSA-N 0 3 406.526 4.216 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)c1cccc(F)c1Br ZINC000556028779 942788779 /nfs/dbraw/zinc/78/87/79/942788779.db2.gz NGCUVKBNLQVIRI-INIZCTEOSA-N 0 3 420.326 4.110 20 0 HIADHN O=C(NC1(c2cccc(C(F)(F)F)c2)CC1)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000556039824 942793196 /nfs/dbraw/zinc/79/31/96/942793196.db2.gz YXJKBYBGOWVBOV-QGZVFWFLSA-N 0 3 403.448 4.118 20 0 HIADHN CCCOc1ccc(OCCNC2(c3cccc(OC)c3F)CCOCC2)cc1 ZINC000556058006 942797807 /nfs/dbraw/zinc/79/78/07/942797807.db2.gz DLVCRIZPTKNAAT-UHFFFAOYSA-N 0 3 403.494 4.297 20 0 HIADHN COc1cc([C@H](C)N[C@@H]2CCc3sc(Br)cc32)ccc1OCCO ZINC000556060480 942799219 /nfs/dbraw/zinc/79/92/19/942799219.db2.gz IFLCTTGMISIUFD-SMDDNHRTSA-N 0 3 412.349 4.228 20 0 HIADHN CC[C@@H](N[C@@H](C)c1cc(F)ccc1N1CCN(C)CC1)c1ccc(C(=O)OC)cc1 ZINC000556076138 942801527 /nfs/dbraw/zinc/80/15/27/942801527.db2.gz KFYQMXLHYUOQJI-HTAPYJJXSA-N 0 3 413.537 4.166 20 0 HIADHN CN1CC[C@H](CN[C@@H](c2cccs2)c2nc[nH]n2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000556118946 942807521 /nfs/dbraw/zinc/80/75/21/942807521.db2.gz NRDMIHCFUCFRAJ-BVGQSLNGSA-N 0 3 405.930 4.031 20 0 HIADHN C[C@H](NCc1nnc(-c2ccc(Cl)cc2)o1)C1CCN(CC(F)(F)F)CC1 ZINC000556124353 942808156 /nfs/dbraw/zinc/80/81/56/942808156.db2.gz DNIVBEYYJJUNPY-LBPRGKRZSA-N 0 3 402.848 4.142 20 0 HIADHN CCCOc1ccc(Oc2ncccc2CN[C@@H]2CCC[C@H](S(C)(=O)=O)C2)cc1 ZINC000556236929 942824533 /nfs/dbraw/zinc/82/45/33/942824533.db2.gz XIRGEGKGPKUHQL-NQIIRXRSSA-N 0 3 418.559 4.108 20 0 HIADHN CC(C)NC(=O)Nc1ccc([C@H](C)N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)cc1 ZINC000556247062 942825549 /nfs/dbraw/zinc/82/55/49/942825549.db2.gz YAJCTMPNKHSBHV-SQNIBIBYSA-N 0 3 408.546 4.233 20 0 HIADHN C[C@@H](Cn1cc(Br)ccc1=O)N[C@H]1CCCOc2c(Cl)cccc21 ZINC000556257692 942827317 /nfs/dbraw/zinc/82/73/17/942827317.db2.gz JZXAJMAPMVDNRT-LRDDRELGSA-N 0 3 411.727 4.156 20 0 HIADHN C[C@@H]1CC[C@@H](NCc2cc(Br)ccc2OC(F)F)[C@H](n2cncn2)C1 ZINC000556260607 942828216 /nfs/dbraw/zinc/82/82/16/942828216.db2.gz FQKVZVGHHHUSGB-KCPJHIHWSA-N 0 3 415.282 4.162 20 0 HIADHN C[C@]1(C2CC2)NC(=O)N(c2cccc(CN[C@@H]3CCCCc4ccccc43)c2)C1=O ZINC000556292080 942834308 /nfs/dbraw/zinc/83/43/08/942834308.db2.gz NVZJWERZGOZCBC-RCZVLFRGSA-N 0 3 403.526 4.469 20 0 HIADHN CN(CCC(F)(F)F)[C@H](CNCc1cc(C(N)=O)cs1)c1ccc(Cl)cc1 ZINC000556413612 942860184 /nfs/dbraw/zinc/86/01/84/942860184.db2.gz ZTPMGBIRJMKASZ-MRXNPFEDSA-N 0 3 419.900 4.216 20 0 HIADHN COc1ccccc1NC(=O)CN[C@H](c1cccc(C(F)(F)F)c1)C1CCOCC1 ZINC000556515149 942889767 /nfs/dbraw/zinc/88/97/67/942889767.db2.gz LSBVMRUSHLOMDF-NRFANRHFSA-N 0 3 422.447 4.410 20 0 HIADHN COC(=O)[C@H](Cc1ccccc1)[C@@H](C)N[C@H](C)C(=O)Nc1cccc(Cl)c1Cl ZINC000556522602 942891243 /nfs/dbraw/zinc/89/12/43/942891243.db2.gz KFHNOSVEMCUKOV-IIAWOOMASA-N 0 3 423.340 4.330 20 0 HIADHN COC(=O)c1ccc(CN[C@H]2CCO[C@H](c3ccccc3)C2)c(Br)c1 ZINC000556603363 942912309 /nfs/dbraw/zinc/91/23/09/942912309.db2.gz IWYXOIFCXKBKMZ-HKUYNNGSSA-N 0 3 404.304 4.246 20 0 HIADHN CSc1ccc([C@H](C)NCc2cccc(N3C(=O)N[C@](C)(C4CC4)C3=O)c2)cc1 ZINC000556607929 942913065 /nfs/dbraw/zinc/91/30/65/942913065.db2.gz IPMOGPURRLISQX-NPMXOYFQSA-N 0 3 409.555 4.484 20 0 HIADHN C[C@]1(C2CC2)NC(=O)N(c2cccc(CN[C@@H]3CCc4cc(Cl)ccc43)c2)C1=O ZINC000556609756 942914203 /nfs/dbraw/zinc/91/42/03/942914203.db2.gz ATLGBQCCFRZTIN-NFBKMPQASA-N 0 3 409.917 4.342 20 0 HIADHN COCCC1(CNc2ccc(C(=O)N(C)[C@@H]3CCCN(C)C3)cc2)CCCCC1 ZINC000556618255 942918686 /nfs/dbraw/zinc/91/86/86/942918686.db2.gz JSAQBBLBUPCWFP-JOCHJYFZSA-N 0 3 401.595 4.252 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)Nc3scnc3C3CC3)CC2)c1 ZINC000556640587 942924838 /nfs/dbraw/zinc/92/48/38/942924838.db2.gz PJFHSVODJVGOAC-UHFFFAOYSA-N 0 3 413.591 4.053 20 0 HIADHN O=C(c1cc(F)cc(Br)c1)N1CCN(c2ccnc3ccccc32)CC1 ZINC000556832622 942937571 /nfs/dbraw/zinc/93/75/71/942937571.db2.gz HFRZQKUSUOCBFK-UHFFFAOYSA-N 0 3 414.278 4.099 20 0 HIADHN C[C@H](NC[C@H](c1ccc(Cl)cc1)N1CCc2sccc2C1)c1ccc(=O)[nH]n1 ZINC000556857512 942940989 /nfs/dbraw/zinc/94/09/89/942940989.db2.gz BQGSMRXWSVNBLZ-IFXJQAMLSA-N 0 3 414.962 4.347 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)[C@@H]1CC[C@@H](C(F)(F)F)C1 ZINC000556937412 942973239 /nfs/dbraw/zinc/97/32/39/942973239.db2.gz NHVPHKNLEYCLRS-KZNAEPCWSA-N 0 3 406.452 4.247 20 0 HIADHN O=C(NCc1c(F)cc(F)c(F)c1F)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000557036859 943000698 /nfs/dbraw/zinc/00/06/98/943000698.db2.gz XYELXWJTCOVHDM-CQSZACIVSA-N 0 3 416.365 4.017 20 0 HIADHN CCn1ccnc1[C@H]1CCCCN1C(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000557061382 943009636 /nfs/dbraw/zinc/00/96/36/943009636.db2.gz JOQRQUWAHLXWNI-VQTJNVASSA-N 0 3 416.516 4.114 20 0 HIADHN CCOc1ccc(-c2nc(CC)c(C(=O)N3C[C@H](N4CCCC4)C[C@@H]3C)s2)cc1 ZINC000557128087 943026213 /nfs/dbraw/zinc/02/62/13/943026213.db2.gz VLIDSGMRMFGAES-FUHWJXTLSA-N 0 3 413.587 4.470 20 0 HIADHN C[C@H](C(=O)N(Cc1ccccc1Br)C1CCN(C)CC1)C(C)(F)F ZINC000557160852 943035288 /nfs/dbraw/zinc/03/52/88/943035288.db2.gz YPISIWZFKYJKEK-CYBMUJFWSA-N 0 3 403.311 4.163 20 0 HIADHN O=C(Nc1ccc(F)cc1OCC(F)F)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000557316735 943070217 /nfs/dbraw/zinc/07/02/17/943070217.db2.gz XQWSOHYWBMQINJ-HNNXBMFYSA-N 0 3 410.411 4.459 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)cc1 ZINC000557356617 943084160 /nfs/dbraw/zinc/08/41/60/943084160.db2.gz IMABYHWEVSIACR-DEOSSOPVSA-N 0 3 407.558 4.203 20 0 HIADHN O=C(Cc1ccc(F)cc1)N(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000557448573 943132999 /nfs/dbraw/zinc/13/29/99/943132999.db2.gz MDMDPCPDEXONQI-VWLOTQADSA-N 0 3 417.528 4.457 20 0 HIADHN O=C(Cc1cccs1)N(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000557449414 943134818 /nfs/dbraw/zinc/13/48/18/943134818.db2.gz REJYRXGAVVETPR-QFIPXVFZSA-N 0 3 405.567 4.379 20 0 HIADHN O=C(CCc1cc2ccccc2o1)N1CCC[C@@H](c2n[nH]cc2CN2CCCC2)C1 ZINC000557643330 943245530 /nfs/dbraw/zinc/24/55/30/943245530.db2.gz GINFIDFMACIOMO-LJQANCHMSA-N 0 3 406.530 4.091 20 0 HIADHN Cc1ccccc1[C@@H](OC[C@H](O)CN1CC[C@@H](Oc2ccncc2)C1)c1ccccc1 ZINC000557700841 943263073 /nfs/dbraw/zinc/26/30/73/943263073.db2.gz IUTDIDXULRYOPB-NOOIUNMQSA-N 0 3 418.537 4.010 20 0 HIADHN COc1ccc([C@@H](C)NCCc2nc3cc(F)ccc3n2C)c(Br)c1 ZINC000557791603 943292693 /nfs/dbraw/zinc/29/26/93/943292693.db2.gz HQSSTSVFXDJXJV-GFCCVEGCSA-N 0 3 406.299 4.377 20 0 HIADHN CCCN(C)[C@H](CNC(=O)NC[C@H]1CCCn2cc(C)nc21)c1ccc(Cl)cc1 ZINC000557921705 943329520 /nfs/dbraw/zinc/32/95/20/943329520.db2.gz QZYWCDXWPMUNOQ-UYAOXDASSA-N 0 3 417.985 4.105 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)NCCCc1c(C)nn(C)c1C)c1ccc(Cl)cc1 ZINC000557949850 943337321 /nfs/dbraw/zinc/33/73/21/943337321.db2.gz ARQUIONWGRNPOJ-NRFANRHFSA-N 0 3 420.001 4.005 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c2sc(C(=O)N3CC[C@@H](N4CCCC4)[C@H]3C)cc12 ZINC000558017051 943356582 /nfs/dbraw/zinc/35/65/82/943356582.db2.gz XHIPVTOYHXBQGG-DNVCBOLYSA-N 0 3 412.534 4.233 20 0 HIADHN Cc1cccc(C(=O)N2CCN([C@@H]3C[C@H]3C)C[C@H](C)C2)c1NC(=O)c1ccccc1F ZINC000558026341 943359395 /nfs/dbraw/zinc/35/93/95/943359395.db2.gz WMEHHIUIAGIYDY-AQOAWAETSA-N 0 3 423.532 4.189 20 0 HIADHN CCCN(C)[C@H](CNC(=O)N1CCC[C@H](c2nc(C)no2)C1)c1ccc(Cl)cc1 ZINC000558107354 943381371 /nfs/dbraw/zinc/38/13/71/943381371.db2.gz LOIILMCRRWHFAQ-PKOBYXMFSA-N 0 3 419.957 4.004 20 0 HIADHN COC[C@H](N[C@H](C)CC(=O)Nc1ccc(OC)cc1OC)c1cccc(Cl)c1 ZINC000558166552 943405036 /nfs/dbraw/zinc/40/50/36/943405036.db2.gz SEIDNSUOGLTCNR-KUHUBIRLSA-N 0 3 406.910 4.052 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)Nc1ccc(OC)c(OCC(F)(F)F)c1 ZINC000558265005 943466649 /nfs/dbraw/zinc/46/66/49/943466649.db2.gz FGAUTNNJZRMVIB-UHFFFAOYSA-N 0 3 417.472 4.366 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)Nc1ccc(C(=O)N[C@@H](C)CC)cc1C ZINC000558308471 943497748 /nfs/dbraw/zinc/49/77/48/943497748.db2.gz KPWJGUWVICXCGH-IBGZPJMESA-N 0 3 402.583 4.253 20 0 HIADHN C[C@@H](NC(=O)Nc1cccc(NC(=O)c2ccoc2)c1)[C@H](c1ccccc1)N(C)C ZINC000558315790 943502340 /nfs/dbraw/zinc/50/23/40/943502340.db2.gz MPECWLOJVPQKDE-IIBYNOLFSA-N 0 3 406.486 4.345 20 0 HIADHN C[C@H](CCOCc1ccccc1)NC(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000558348585 943520412 /nfs/dbraw/zinc/52/04/12/943520412.db2.gz PAGJBDYXAZJLAZ-UYAOXDASSA-N 0 3 401.576 4.180 20 0 HIADHN CNS(=O)(=O)c1ccc([C@@H](C)N[C@H](Cc2ccccc2)c2ccc(OC)cc2)cc1 ZINC000558505684 943579344 /nfs/dbraw/zinc/57/93/44/943579344.db2.gz NKQJGHUVIAWETR-HOYKHHGWSA-N 0 3 424.566 4.238 20 0 HIADHN COc1ccc2c(c1)CCC[C@H]2NCc1cccc(N2C(=O)NC3(CCCC3)C2=O)c1 ZINC000558506945 943579463 /nfs/dbraw/zinc/57/94/63/943579463.db2.gz AJAUFBQJNINMEE-JOCHJYFZSA-N 0 3 419.525 4.231 20 0 HIADHN COc1cc(Br)c(CN2CCCC[C@@H]2[C@H]2CCCC[C@H]2O)cc1OC ZINC000558658310 943625079 /nfs/dbraw/zinc/62/50/79/943625079.db2.gz CFBKMXWLFIDFHV-KBAYOESNSA-N 0 3 412.368 4.372 20 0 HIADHN CCNC(=O)c1ccc(CNC[C@@H](O)COc2cc(C)c(Cl)cc2C(C)C)cc1 ZINC000558750500 943642563 /nfs/dbraw/zinc/64/25/63/943642563.db2.gz GNRIZTNBBMKFKJ-LJQANCHMSA-N 0 3 418.965 4.051 20 0 HIADHN CC(C)C(=O)c1ccc([C@@H](C)C(=O)NCC2(N3CCSCC3)CCCC2)cc1 ZINC000558760429 943649710 /nfs/dbraw/zinc/64/97/10/943649710.db2.gz VMROJDKZQOTBED-GOSISDBHSA-N 0 3 402.604 4.107 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N3CC[C@@](F)(c4ccccc4F)C3)cc2)CC1 ZINC000558816376 943676391 /nfs/dbraw/zinc/67/63/91/943676391.db2.gz SUFTURLQHHDBDE-DEOSSOPVSA-N 0 3 413.512 4.067 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2ccc(NC(=O)CC(F)(F)F)cc2)N(C)C)cc1 ZINC000558848608 943697769 /nfs/dbraw/zinc/69/77/69/943697769.db2.gz VGVRLHVEYIRCEN-SFHVURJKSA-N 0 3 422.451 4.310 20 0 HIADHN CC(C)c1noc(Cc2ccc(NC(=O)NC[C@@H](Cc3ccccc3)N(C)C)cc2)n1 ZINC000558848270 943697834 /nfs/dbraw/zinc/69/78/34/943697834.db2.gz XDXDJYUUQNNTJO-OAQYLSRUSA-N 0 3 421.545 4.078 20 0 HIADHN CCOC(=O)C1CCC(N(CC)C(=O)NC[C@H](c2ccc(CC)cc2)N(C)C)CC1 ZINC000558883344 943718060 /nfs/dbraw/zinc/71/80/60/943718060.db2.gz TZLXUYFGFSXAAN-LZBANZJXSA-N 0 3 417.594 4.005 20 0 HIADHN CCN1CC[C@H](N[C@H](C)C(=O)NCCc2cccs2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000558898743 943732100 /nfs/dbraw/zinc/73/21/00/943732100.db2.gz QMBHPFCHQYDRDF-VOBQZIQPSA-N 0 3 423.985 4.013 20 0 HIADHN C[C@@H](NC(=O)N[C@@H](CN(C)C)c1ccc(Cl)cc1)c1ccccc1-n1cccn1 ZINC000558914246 943744045 /nfs/dbraw/zinc/74/40/45/943744045.db2.gz PSRRMZKBUKYTLG-UZLBHIALSA-N 0 3 411.937 4.189 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)[C@H](C)Cc1cnc2ccccc2n1)c1cccc(OC)c1 ZINC000558932141 943753787 /nfs/dbraw/zinc/75/37/87/943753787.db2.gz SYGWNENFTIEGAZ-KOSHJBKYSA-N 0 3 420.557 4.016 20 0 HIADHN CN(C)C[C@@H](NC(=O)CCCc1nc(-c2cccs2)no1)c1ccc(Cl)cc1 ZINC000558974007 943777328 /nfs/dbraw/zinc/77/73/28/943777328.db2.gz UQMUGKRQBVUCFU-MRXNPFEDSA-N 0 3 418.950 4.193 20 0 HIADHN CNS(=O)(=O)c1cccc([C@@H](C)N[C@@H](c2cccc(C(F)(F)F)c2)C2CC2)c1 ZINC000558973319 943777444 /nfs/dbraw/zinc/77/74/44/943777444.db2.gz WOAJWCYNSNYEKD-BFUOFWGJSA-N 0 3 412.477 4.415 20 0 HIADHN C[C@H](CN1CCN(CC(=O)Nc2ccccc2C(F)(F)F)CC1)C1CCCCC1 ZINC000559032548 943810409 /nfs/dbraw/zinc/81/04/09/943810409.db2.gz YJOAXIDOLGWDQI-QGZVFWFLSA-N 0 3 411.512 4.478 20 0 HIADHN Cc1ccccc1CN1CCCN(C(=O)CN(Cc2ccco2)C2CCCC2)CC1 ZINC000559110052 943844005 /nfs/dbraw/zinc/84/40/05/943844005.db2.gz QPACIPWJNCCKKV-UHFFFAOYSA-N 0 3 409.574 4.067 20 0 HIADHN CC[C@@H](c1nnc(N2CCN(C3CCCC3)CC2)n1C[C@H]1CCCO1)c1ccccc1 ZINC000559137632 943851851 /nfs/dbraw/zinc/85/18/51/943851851.db2.gz KUDMOOIILJDLQY-DHIUTWEWSA-N 0 3 423.605 4.064 20 0 HIADHN C[C@@H]1CN(Cc2ccc(CNCc3conc3Cc3ccccc3)cc2)C[C@H](C)O1 ZINC000559245200 943885390 /nfs/dbraw/zinc/88/53/90/943885390.db2.gz VDERHVMRGCBMOE-BGYRXZFFSA-N 0 3 405.542 4.164 20 0 HIADHN Clc1cccc(N2CCOCC2)c1CNCCc1ccc(Br)s1 ZINC000559247156 943885714 /nfs/dbraw/zinc/88/57/14/943885714.db2.gz IGJMUSUAGBOANG-UHFFFAOYSA-N 0 3 415.784 4.333 20 0 HIADHN COc1ccc([C@H]2C[C@H](NCc3c(Cl)cccc3N3CCOCC3)C2)cc1F ZINC000559304472 943893641 /nfs/dbraw/zinc/89/36/41/943893641.db2.gz YXAOTJYLOQYRHZ-QAQDUYKDSA-N 0 3 404.913 4.360 20 0 HIADHN Fc1cccc(CC2(NCc3ccn(-c4ccc(F)cc4F)n3)CCOCC2)c1 ZINC000559333966 943898364 /nfs/dbraw/zinc/89/83/64/943898364.db2.gz GTNIFIUFLAZETG-UHFFFAOYSA-N 0 3 401.432 4.171 20 0 HIADHN CCc1nc(-c2ccccc2NC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)n[nH]1 ZINC000559352950 943905187 /nfs/dbraw/zinc/90/51/87/943905187.db2.gz NOPOEAWUQMDWKQ-KRWDZBQOSA-N 0 3 407.493 4.024 20 0 HIADHN CCO[C@@H]1C[C@H](NCc2cccc(NC(=O)c3ccccc3Cl)c2)[C@@H]1n1cccn1 ZINC000559364273 943910410 /nfs/dbraw/zinc/91/04/10/943910410.db2.gz KZPQZVHCXADSLQ-BDTNDASRSA-N 0 3 424.932 4.297 20 0 HIADHN CCO[C@@H]1C[C@@H](NCc2cccc(NC(=O)c3ccc(Cl)cc3)c2)[C@H]1n1cccn1 ZINC000559365051 943912871 /nfs/dbraw/zinc/91/28/71/943912871.db2.gz OOQROHHOXKWGAC-YPAWHYETSA-N 0 3 424.932 4.297 20 0 HIADHN CCS(=O)(=O)c1ccc([C@@H](C)N[C@@H](C)c2ccc(NC(=O)NC(C)C)cc2)cc1 ZINC000559421232 943943580 /nfs/dbraw/zinc/94/35/80/943943580.db2.gz WCAVBSQXZYSVIY-DLBZAZTESA-N 0 3 417.575 4.422 20 0 HIADHN O=c1c2ccccc2ncn1CCN1CCC(c2ccc(OC(F)(F)F)cc2)CC1 ZINC000559438830 943955578 /nfs/dbraw/zinc/95/55/78/943955578.db2.gz LLTMARVTMVNLLU-UHFFFAOYSA-N 0 3 417.431 4.175 20 0 HIADHN CCC(CC)(C[NH2+][C@@H](c1cccs1)c1nnc[n-]1)c1ccc(OC)c(OC)c1 ZINC000559841856 944064216 /nfs/dbraw/zinc/06/42/16/944064216.db2.gz BVCKMQQIQASPPC-IBGZPJMESA-N 0 3 400.548 4.320 20 0 HIADHN COc1ccc2ccccc2c1-c1cc(CN[C@H]2CCCC[C@H]2N2CCOCC2)on1 ZINC000559841407 944064582 /nfs/dbraw/zinc/06/45/82/944064582.db2.gz JQZBAMGYBLMZGK-JTHBVZDNSA-N 0 3 421.541 4.236 20 0 HIADHN Clc1ccc(OCc2cccnc2)c(CNCCN2CCc3ccccc3C2)c1 ZINC000559869438 944071326 /nfs/dbraw/zinc/07/13/26/944071326.db2.gz ADYXUKOKCGABER-UHFFFAOYSA-N 0 3 407.945 4.462 20 0 HIADHN C[C@@H](N[C@H](C)c1cc[nH]c(=O)c1)c1cccc(S(=O)(=O)NC2CCCCCC2)c1 ZINC000559878807 944072817 /nfs/dbraw/zinc/07/28/17/944072817.db2.gz RDONPPWCXOJVBJ-IAGOWNOFSA-N 0 3 417.575 4.200 20 0 HIADHN COc1ccc2oc([C@@H](C)N[C@@H](C)Cn3cc(Br)ccc3=O)c(C)c2c1 ZINC000559892780 944078092 /nfs/dbraw/zinc/07/80/92/944078092.db2.gz FODBBUFDYUSRAE-GXTWGEPZSA-N 0 3 419.319 4.413 20 0 HIADHN C[C@H](NC1CCN(Cc2coc(-c3ccccc3)n2)CC1)c1cn2ccccc2n1 ZINC000559899522 944079853 /nfs/dbraw/zinc/07/98/53/944079853.db2.gz CVSPPKXMDJLTPT-SFHVURJKSA-N 0 3 401.514 4.305 20 0 HIADHN c1ccc(CN2CCCO[C@H](CSc3nnc(-c4ccncc4)n3C3CC3)C2)cc1 ZINC000559982957 944110267 /nfs/dbraw/zinc/11/02/67/944110267.db2.gz TUCBAZAJSAEAHF-NRFANRHFSA-N 0 3 421.570 4.058 20 0 HIADHN COc1ncc(C(=O)N(c2cccc(SC)c2)C2CCN(C)CC2)cc1Cl ZINC000560059550 944144575 /nfs/dbraw/zinc/14/45/75/944144575.db2.gz BRUQDKWBMRCOTI-UHFFFAOYSA-N 0 3 405.951 4.207 20 0 HIADHN COc1cc(OC)cc(Oc2ccc(CNCc3ccc4c(c3)nnn4C)cc2)c1 ZINC000560075900 944150008 /nfs/dbraw/zinc/15/00/08/944150008.db2.gz KLVMMRCMSKZODM-UHFFFAOYSA-N 0 3 404.470 4.068 20 0 HIADHN Cc1ccc2[nH]c(CNCc3cccc(N4C(=O)N[C@@](C)(C5CC5)C4=O)c3)cc2c1C ZINC000560075083 944150014 /nfs/dbraw/zinc/15/00/14/944150014.db2.gz FCCUWJYSHRYZAA-VWLOTQADSA-N 0 3 416.525 4.299 20 0 HIADHN CCc1ccccc1NC(=O)C[C@H](C)N[C@H](C)c1ccc(S(=O)(=O)CC)cc1 ZINC000560270333 944214268 /nfs/dbraw/zinc/21/42/68/944214268.db2.gz METTZPIKTSSHPL-DLBZAZTESA-N 0 3 402.560 4.111 20 0 HIADHN Cc1cc(C(=O)N2CCN(c3ccnc4ccccc43)CC2)c(C)n1-c1nccs1 ZINC000560489337 944238207 /nfs/dbraw/zinc/23/82/07/944238207.db2.gz MHVTVQDXJVIPEX-UHFFFAOYSA-N 0 3 417.538 4.061 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@@H](C)N[C@@H](C)c2cc(C(=O)OC)cs2)CC1 ZINC000560528248 944242833 /nfs/dbraw/zinc/24/28/33/944242833.db2.gz OJGCDKGMPGDZPA-CVEARBPZSA-N 0 3 419.566 4.228 20 0 HIADHN COc1ccc([C@@H](C)N[C@@H](C)c2cc(F)ccc2N2CCN(C)CC2)c(C)c1OC ZINC000560528592 944244108 /nfs/dbraw/zinc/24/41/08/944244108.db2.gz JEEAAROPGJRKMS-MSOLQXFVSA-N 0 3 415.553 4.315 20 0 HIADHN COC(=O)c1ccc(C)c(NC(=O)[C@H](C)N[C@@H]2CC[C@H](c3ccccc3)C[C@H]2OC)c1 ZINC000560539026 944247428 /nfs/dbraw/zinc/24/74/28/944247428.db2.gz ZSORIYOMFPQMKC-VARILPKDSA-N 0 3 424.541 4.050 20 0 HIADHN C[C@@H](NC[C@H]1CC[C@@H](c2nc(C3CC3)no2)O1)c1ccc(Br)cc1F ZINC000560557035 944253673 /nfs/dbraw/zinc/25/36/73/944253673.db2.gz JGTGIPURWOAFJU-ZXIHIIQKSA-N 0 3 410.287 4.420 20 0 HIADHN CCOc1cc(CN2CCC(O[C@@H]3CCOC3)CC2)ccc1OCc1ccccc1 ZINC000560562767 944255604 /nfs/dbraw/zinc/25/56/04/944255604.db2.gz UCPMITZSXMQPHS-HSZRJFAPSA-N 0 3 411.542 4.434 20 0 HIADHN CS(=O)(=O)C1(CN[C@H]2CCCc3nc(-c4ccccc4F)sc32)CCCC1 ZINC000560580838 944262133 /nfs/dbraw/zinc/26/21/33/944262133.db2.gz JSZZKPJOHUBIFO-INIZCTEOSA-N 0 3 408.564 4.274 20 0 HIADHN O=C(N[C@@H]1CCO[C@@H](c2ccccc2)C1)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000560632499 944281093 /nfs/dbraw/zinc/28/10/93/944281093.db2.gz NRFBQDHNSUCZMX-YPAWHYETSA-N 0 3 414.496 4.180 20 0 HIADHN C[C@H]1CCc2[nH]c3ccc(C(=O)Nc4cccc(CN5CC[C@@H](O)C5)c4)cc3c2C1 ZINC000560675348 944290616 /nfs/dbraw/zinc/29/06/16/944290616.db2.gz IDJZFXPYOQJQFN-OXJNMPFZSA-N 0 3 403.526 4.112 20 0 HIADHN CSc1ccc([C@@H](C)NCc2ccccc2CS(=O)(=O)N2CCCC2)cc1 ZINC000560907239 944367882 /nfs/dbraw/zinc/36/78/82/944367882.db2.gz CKURCJNCKPFLRT-QGZVFWFLSA-N 0 3 404.601 4.185 20 0 HIADHN Brc1cc2cccnc2c(CN2CCC[C@@H](c3nncn3C3CC3)C2)c1 ZINC000561060081 944421028 /nfs/dbraw/zinc/42/10/28/944421028.db2.gz ISTXKYDOMIJVAX-OAHLLOKOSA-N 0 3 412.335 4.303 20 0 HIADHN O=C1NC(CC(F)(F)F)C(=O)N1c1ccc(-c2ccc(Cl)cc2Cl)nc1 ZINC000561058691 944421605 /nfs/dbraw/zinc/42/16/05/944421605.db2.gz SIRHHBNNHANWBV-CYBMUJFWSA-N 0 3 404.175 4.433 20 0 HIADHN Cc1ccc(CC(=O)N(Cc2ccncc2)[C@@H]2CCCN(Cc3ccccc3)C2)cn1 ZINC000561059785 944421636 /nfs/dbraw/zinc/42/16/36/944421636.db2.gz KJWGTYARPGQTAF-RUZDIDTESA-N 0 3 414.553 4.021 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)N[C@@H]1CCC[C@@H](C)[C@@H]1C)c1ccc(NC(=O)c2ccncc2)cc1 ZINC000561157399 944486441 /nfs/dbraw/zinc/48/64/41/944486441.db2.gz NSXPPDBCIGIJSI-BANDYGIESA-N 0 3 422.573 4.314 20 0 HIADHN CCCN(CCN1CCCC1)C(=O)c1sc(NC(=O)c2cccc(F)c2)cc1C ZINC000561201877 944513076 /nfs/dbraw/zinc/51/30/76/944513076.db2.gz OBKUCNNTTLUVBR-UHFFFAOYSA-N 0 3 417.550 4.396 20 0 HIADHN O[C@H](CN[C@H]1CCCOc2ccc(F)cc21)COc1c(Cl)cccc1Cl ZINC000561257261 944530831 /nfs/dbraw/zinc/53/08/31/944530831.db2.gz NLFNQULQNIARMM-DYVFJYSZSA-N 0 3 400.277 4.376 20 0 HIADHN CSc1ccc([C@H](CNC(=O)CCc2ccc(OC(F)F)cc2)N(C)C)cc1 ZINC000561381531 944568934 /nfs/dbraw/zinc/56/89/34/944568934.db2.gz SKRAORCGLMKRAR-IBGZPJMESA-N 0 3 408.514 4.362 20 0 HIADHN CC(C)(C)n1cc(-c2noc([C@@H]3CN(Cc4ccccc4)CCC3(F)F)n2)cn1 ZINC000561391966 944575373 /nfs/dbraw/zinc/57/53/73/944575373.db2.gz PSHWASBDNZTJIL-KRWDZBQOSA-N 0 3 401.461 4.313 20 0 HIADHN CC(C)(C)n1cc(-c2noc([C@H]3CN(Cc4ccccc4)CCC3(F)F)n2)cn1 ZINC000561391967 944575726 /nfs/dbraw/zinc/57/57/26/944575726.db2.gz PSHWASBDNZTJIL-QGZVFWFLSA-N 0 3 401.461 4.313 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)NCc2c(F)cccc2N2CCCC2)C1 ZINC000561506539 944642089 /nfs/dbraw/zinc/64/20/89/944642089.db2.gz SAYJTDBQAIXBDE-AZUAARDMSA-N 0 3 410.537 4.061 20 0 HIADHN COc1ccc2cc(-c3nn(-c4ccccc4)cc3CNC[C@H](O)C(F)F)ccc2c1 ZINC000561527010 944656664 /nfs/dbraw/zinc/65/66/64/944656664.db2.gz GJIOIKVCWUZUTC-QFIPXVFZSA-N 0 3 423.463 4.417 20 0 HIADHN C[C@H]1Cc2ccccc2N1Cc1occc1C(=O)N1CCN(C2CCC2)C[C@@H](C)C1 ZINC000561533381 944659515 /nfs/dbraw/zinc/65/95/15/944659515.db2.gz SMNBPNAPTUYFCQ-MOPGFXCFSA-N 0 3 407.558 4.177 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)Cc3c4ccc(C)cc4oc3C(C)=O)c2)CC1 ZINC000561616536 944711319 /nfs/dbraw/zinc/71/13/19/944711319.db2.gz QSUDIRNDBMVSPA-UHFFFAOYSA-N 0 3 419.525 4.267 20 0 HIADHN COc1cc(C(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)ccc1OC(F)F ZINC000561651874 944728604 /nfs/dbraw/zinc/72/86/04/944728604.db2.gz UFLUUROANQTGBL-GOSISDBHSA-N 0 3 422.472 4.117 20 0 HIADHN CCOc1cn(-c2ccccc2)nc1C(=O)NC[C@@H](c1ccc(SC)cc1)N(C)C ZINC000561727484 944767001 /nfs/dbraw/zinc/76/70/01/944767001.db2.gz XULMDXJZYFQFPV-FQEVSTJZSA-N 0 3 424.570 4.026 20 0 HIADHN C[C@@H]1[C@@H](N2CCCC2)CCN1C(=O)c1cc2sc(Nc3ccccc3)nc2s1 ZINC000561753394 944779454 /nfs/dbraw/zinc/77/94/54/944779454.db2.gz KBUFGKLIMFBUMZ-ZBFHGGJFSA-N 0 3 412.584 4.800 20 0 HIADHN C[C@H]1C[C@@H]1N1CCN(C(=O)c2occc2CN2c3ccccc3C[C@@H]2C)C[C@@H](C)C1 ZINC000561765949 944786682 /nfs/dbraw/zinc/78/66/82/944786682.db2.gz XUZOONLESOIWOG-KGYLXKDPSA-N 0 3 407.558 4.033 20 0 HIADHN CCS(=O)(=O)N1CCC([C@@H](C)N(C)Cc2nc3ccccc3c(C)c2Cl)CC1 ZINC000561786207 944796522 /nfs/dbraw/zinc/79/65/22/944796522.db2.gz UJGLEWBUFHKMBE-MRXNPFEDSA-N 0 3 424.010 4.079 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)N1CCC(OCC2CC2)CC1)c1ccc(Cl)cc1 ZINC000561870328 944828895 /nfs/dbraw/zinc/82/88/95/944828895.db2.gz GVRZVSPGSANVPD-NRFANRHFSA-N 0 3 407.986 4.324 20 0 HIADHN Cc1nc2ccccc2cc1C(=O)NC1CCN(CCOc2ccc(Cl)cc2)CC1 ZINC000561893758 944842089 /nfs/dbraw/zinc/84/20/89/944842089.db2.gz TWIRIYAKRHBZPW-UHFFFAOYSA-N 0 3 423.944 4.470 20 0 HIADHN CCOC(=O)c1ccn(-c2cccc(CNCc3ccc(C(F)(F)F)s3)c2)n1 ZINC000561974731 944883195 /nfs/dbraw/zinc/88/31/95/944883195.db2.gz DSTUMTJUJGGCHE-UHFFFAOYSA-N 0 3 409.433 4.419 20 0 HIADHN COC[C@@H](NCCCCn1cc(Br)cn1)c1cccc(Cl)c1F ZINC000562064367 944919707 /nfs/dbraw/zinc/91/97/07/944919707.db2.gz KZCNOJPUMXCPCB-OAHLLOKOSA-N 0 3 404.711 4.196 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3cnn(C)c3-c3ccccc3)c(C)c2)CC1 ZINC000562081523 944927863 /nfs/dbraw/zinc/92/78/63/944927863.db2.gz OZPRFVKJQSNSPU-UHFFFAOYSA-N 0 3 418.545 4.181 20 0 HIADHN CN(C(=O)Nc1c2c(cc3c1CCC3)CCC2)C1CCN(CCc2ccccn2)CC1 ZINC000562113720 944947778 /nfs/dbraw/zinc/94/77/78/944947778.db2.gz OFTCGTGKSFAOAZ-UHFFFAOYSA-N 0 3 418.585 4.230 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)Nc1ccccc1CN1CCSCC1)c1ccco1 ZINC000562123726 944955753 /nfs/dbraw/zinc/95/57/53/944955753.db2.gz FHAUSVDUEINUEW-XLIONFOSSA-N 0 3 416.591 4.079 20 0 HIADHN Cc1ccc(C(=O)N(C)C)cc1NC(=O)NC[C@H](c1ccc(CC(C)C)cc1)N(C)C ZINC000562126753 944957676 /nfs/dbraw/zinc/95/76/76/944957676.db2.gz AJVBOYJJGIALTQ-HSZRJFAPSA-N 0 3 424.589 4.320 20 0 HIADHN CN(C)C[C@@H](NC(=O)Nc1ccc(OC(F)F)c2ncccc12)c1ccc(F)cc1 ZINC000562153663 944983485 /nfs/dbraw/zinc/98/34/85/944983485.db2.gz NLWODUWNSJOCBK-QGZVFWFLSA-N 0 3 418.419 4.400 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)NCc2ncc(-c3ccccc3)o2)N(C)C)cc1 ZINC000562263656 945048784 /nfs/dbraw/zinc/04/87/84/945048784.db2.gz HWYYYARMIFJHJJ-NRFANRHFSA-N 0 3 422.529 4.231 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)Nc1cc(-c2ccc(F)cc2F)nn1C)c1ccco1 ZINC000562276382 945052915 /nfs/dbraw/zinc/05/29/15/945052915.db2.gz DMOMOYBCVIZVMI-FZKQIMNGSA-N 0 3 417.460 4.209 20 0 HIADHN Cn1cc(C(F)(F)F)nc1[C@H]1CCCN(Cc2cnc(-c3ccccn3)s2)C1 ZINC000564304647 945507278 /nfs/dbraw/zinc/50/72/78/945507278.db2.gz YXPVNPWREIUOJD-ZDUSSCGKSA-N 0 3 407.465 4.337 20 0 HIADHN FC(F)(F)c1cccc(CN2CCC(N[C@@H](c3nc[nH]n3)c3ccccc3)CC2)c1 ZINC000564368047 945533566 /nfs/dbraw/zinc/53/35/66/945533566.db2.gz GEKAKLQTFFRGKH-HXUWFJFHSA-N 0 3 415.463 4.167 20 0 HIADHN C[C@@H](N[C@@H]1CCCc2ccc(S(N)(=O)=O)cc21)c1ccc(-c2cccnc2)cc1 ZINC000564422905 945574666 /nfs/dbraw/zinc/57/46/66/945574666.db2.gz BWAWUVLJKFKPOV-WAIKUNEKSA-N 0 3 407.539 4.124 20 0 HIADHN Cc1cc([C@@H](NCC2(OCCO)CCOCC2)c2cccc(Cl)c2)c(C)s1 ZINC000564433239 945583470 /nfs/dbraw/zinc/58/34/70/945583470.db2.gz ALBWQHOVWRLLCT-FQEVSTJZSA-N 0 3 409.979 4.255 20 0 HIADHN Cc1nc2ccccc2n1CCCNC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C ZINC000564479319 945611751 /nfs/dbraw/zinc/61/17/51/945611751.db2.gz ONFMSYADLQEQFM-FQEVSTJZSA-N 0 3 419.573 4.041 20 0 HIADHN Cc1cnccc1CC(=O)N(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000564479996 945613560 /nfs/dbraw/zinc/61/35/60/945613560.db2.gz LAMOCRRLQAYPRX-RUZDIDTESA-N 0 3 414.553 4.021 20 0 HIADHN Cc1cccc(CC(=O)N(Cc2ccccc2Br)C2CCN(C)CC2)c1 ZINC000564591757 945691422 /nfs/dbraw/zinc/69/14/22/945691422.db2.gz XZBGFAVJDXVWIJ-UHFFFAOYSA-N 0 3 415.375 4.423 20 0 HIADHN CO[C@H](C)[C@@H](C)N[C@H](C)C(=O)N1N=C(c2ccc(Cl)cc2)C[C@@H]1c1ccco1 ZINC000565109940 945775644 /nfs/dbraw/zinc/77/56/44/945775644.db2.gz UQKNZWADXORXEN-DEXNDLTESA-N 0 3 403.910 4.012 20 0 HIADHN CO[C@H](C)[C@@H](C)N[C@@H](C)C(=O)N1N=C(c2ccc(Cl)cc2)C[C@H]1c1ccco1 ZINC000565109946 945775919 /nfs/dbraw/zinc/77/59/19/945775919.db2.gz UQKNZWADXORXEN-GJRWTSMGSA-N 0 3 403.910 4.012 20 0 HIADHN O=C(CN[C@H]1CCC[C@H]1Oc1cc(F)cc(F)c1)Nc1ccccc1OC(F)F ZINC000565121797 945778808 /nfs/dbraw/zinc/77/88/08/945778808.db2.gz BWHMLHYRNVTMBS-DOTOQJQBSA-N 0 3 412.383 4.094 20 0 HIADHN CC[C@H](NC(=O)NC[C@@H](c1cccs1)N1CCCC1)c1ccc(OC)c(OC)c1 ZINC000565321697 945809012 /nfs/dbraw/zinc/80/90/12/945809012.db2.gz HIXHIADNQFCHDH-ROUUACIJSA-N 0 3 417.575 4.353 20 0 HIADHN CCCC[C@H](N[C@H]1CCCc2ccc(S(N)(=O)=O)cc21)c1ccc(OC)cc1 ZINC000565450169 945833368 /nfs/dbraw/zinc/83/33/68/945833368.db2.gz LAAMRBXQUBAKAR-VXKWHMMOSA-N 0 3 402.560 4.241 20 0 HIADHN Cc1nc2ccc(Br)cc2c(N2CCOC3(CCOCC3)CC2)c1C ZINC000565573272 945851891 /nfs/dbraw/zinc/85/18/91/945851891.db2.gz CSFLBYBTZHICOB-UHFFFAOYSA-N 0 3 405.336 4.390 20 0 HIADHN Cc1cc(=O)[nH]c2cc(C(=O)NC[C@H](C(C)C)N3CCc4ccccc4C3)ccc12 ZINC000565618186 945855729 /nfs/dbraw/zinc/85/57/29/945855729.db2.gz BANWMZWUNRPGGC-HSZRJFAPSA-N 0 3 403.526 4.062 20 0 HIADHN CN(C)S(=O)(=O)c1ccc(CN[C@@H](Cc2ccc(F)cc2)c2ccccc2)cc1 ZINC000565648497 945861606 /nfs/dbraw/zinc/86/16/06/945861606.db2.gz IBJUYPANIMTHJD-QHCPKHFHSA-N 0 3 412.530 4.150 20 0 HIADHN Brc1ccc2c(c1)C=C(CNCc1ccnc(N3CCCC3)c1)CO2 ZINC000565672029 945863151 /nfs/dbraw/zinc/86/31/51/945863151.db2.gz SHVZLWCGGCQMIS-UHFFFAOYSA-N 0 3 400.320 4.010 20 0 HIADHN Cc1ccc(NC(=O)[C@H](C)N[C@H]2CCN(C)[C@H]2c2ccc(Cl)c(F)c2)c(C)c1 ZINC000565743708 945877661 /nfs/dbraw/zinc/87/76/61/945877661.db2.gz NJUYWSMMUWUCCE-JHVJFLLYSA-N 0 3 403.929 4.458 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)Nc2ccccc2SC2CCCC2)CC1 ZINC000566034370 945984672 /nfs/dbraw/zinc/98/46/72/945984672.db2.gz IJTXLDQOUDEPAT-GOSISDBHSA-N 0 3 404.624 4.116 20 0 HIADHN Cc1nc(-c2cccc(NC(=O)CN[C@H]3CCN(C)[C@H]3c3ccccc3)c2)cs1 ZINC000566038300 945989149 /nfs/dbraw/zinc/98/91/49/945989149.db2.gz NIYFPQOCUHPHAY-REWPJTCUSA-N 0 3 406.555 4.092 20 0 HIADHN CCN1CC[C@H](N[C@@H](C)C(=O)Nc2ccccc2C)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000566347717 946006477 /nfs/dbraw/zinc/00/64/77/946006477.db2.gz WGWIPQYQMUNFMY-ONTRVFCTSA-N 0 3 405.464 4.164 20 0 HIADHN COc1cccc([C@H]2[C@@H](NCC(=O)Nc3c(C)cccc3Cl)CCN2C2CC2)c1 ZINC000566400552 946022130 /nfs/dbraw/zinc/02/21/30/946022130.db2.gz HRYUUVHDQBKADO-REWPJTCUSA-N 0 3 413.949 4.163 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)N[C@@H](C)c1ccncc1OC)c1ccc(Cl)cc1 ZINC000566553836 946040750 /nfs/dbraw/zinc/04/07/50/946040750.db2.gz YGESXGSFHZBPJG-KXBFYZLASA-N 0 3 404.942 4.187 20 0 HIADHN C[C@@H](NCc1cccc(COCc2ccco2)c1)c1cccc(NS(C)(=O)=O)c1 ZINC000567044441 946226457 /nfs/dbraw/zinc/22/64/57/946226457.db2.gz AMQQUQFSXSJNBA-QGZVFWFLSA-N 0 3 414.527 4.219 20 0 HIADHN Cc1cc(F)ccc1-c1nc(C(C)(C)C(=O)NCCN2CCC[C@H](C)C2)cs1 ZINC000567244176 946276493 /nfs/dbraw/zinc/27/64/93/946276493.db2.gz RQZAXDTXFGMGGZ-HNNXBMFYSA-N 0 3 403.567 4.383 20 0 HIADHN COCc1cccc2sc(NC(=O)N[C@@H](CN(C)C)c3ccc(F)cc3)nc21 ZINC000567301087 946302039 /nfs/dbraw/zinc/30/20/39/946302039.db2.gz MMKCQPQVYSNDRC-INIZCTEOSA-N 0 3 402.495 4.006 20 0 HIADHN CN1CC[C@@H](NCC(=O)Nc2ccc(Cl)cc2Cl)[C@H]1c1ccc(F)c(F)c1 ZINC000567373743 946318834 /nfs/dbraw/zinc/31/88/34/946318834.db2.gz ZPIUGHHNPWYNDE-IEBWSBKVSA-N 0 3 414.283 4.245 20 0 HIADHN CCOc1cccc(CN[C@@H]2CCCN(C(=O)CCC(F)(F)F)C2)c1OC(F)F ZINC000567390119 946321840 /nfs/dbraw/zinc/32/18/40/946321840.db2.gz DIAFLINXUCZUOM-CQSZACIVSA-N 0 3 424.410 4.110 20 0 HIADHN COC[C@]1(CNCc2cc(Br)c(Cl)s2)OCCc2ccccc21 ZINC000567403874 946325416 /nfs/dbraw/zinc/32/54/16/946325416.db2.gz UWAIBPSRIWPXEH-KRWDZBQOSA-N 0 3 416.768 4.368 20 0 HIADHN Cc1ccccc1-c1nnc(N2CCN(C3CCCC3)CC2)n1Cc1cccs1 ZINC000567412055 946329720 /nfs/dbraw/zinc/32/97/20/946329720.db2.gz SPWHASWKBVGUJL-UHFFFAOYSA-N 0 3 407.587 4.428 20 0 HIADHN CC(=O)N(c1nc(CNC[C@H](c2ccc(CC(C)C)cc2)N(C)C)cs1)C1CC1 ZINC000567785291 946408082 /nfs/dbraw/zinc/40/80/82/946408082.db2.gz ICOOYPGFLDVCDV-JOCHJYFZSA-N 0 3 414.619 4.249 20 0 HIADHN CCOC(=O)c1nnc(-c2cccc(C[NH2+]Cc3cc(Cl)cc4cccnc43)c2)[n-]1 ZINC000567966387 946432438 /nfs/dbraw/zinc/43/24/38/946432438.db2.gz YKQCZVOQQHDBHM-UHFFFAOYSA-N 0 3 421.888 4.140 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)Nc1ccc(C(=O)N2CCCC2)cc1C)c1ccco1 ZINC000568128609 946472684 /nfs/dbraw/zinc/47/26/84/946472684.db2.gz BXVQGEVEIRCOCF-XLIONFOSSA-N 0 3 412.534 4.075 20 0 HIADHN COc1ccccc1C1(C(=O)Nc2cccc(CN3CCC(O)CC3)c2)CCCCC1 ZINC000568142824 946480496 /nfs/dbraw/zinc/48/04/96/946480496.db2.gz IVEGEHYSNJCHPO-UHFFFAOYSA-N 0 3 422.569 4.493 20 0 HIADHN CC(=O)Nc1ccccc1-c1noc([C@@H]2CN(Cc3ccccc3)CCC2(F)F)n1 ZINC000568324336 946507024 /nfs/dbraw/zinc/50/70/24/946507024.db2.gz BCHJYWKSPBZFSZ-SFHVURJKSA-N 0 3 412.440 4.320 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)c1cc2sc(N3CCCC3)nc2s1)c1ccco1 ZINC000568551120 946589781 /nfs/dbraw/zinc/58/97/81/946589781.db2.gz PTCXEXWNVVDTMT-UONOGXRCSA-N 0 3 418.588 4.410 20 0 HIADHN CCC[C@@H](C(=O)NC1CCN(CCOc2ccc(Cl)cc2)CC1)c1ccccn1 ZINC000568655425 946636045 /nfs/dbraw/zinc/63/60/45/946636045.db2.gz AYVUKJUYVBKDNG-OAQYLSRUSA-N 0 3 415.965 4.278 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(CN[C@@H](CN(C)C)c3ccc(F)cc3)c2)cc1 ZINC000568807547 946706518 /nfs/dbraw/zinc/70/65/18/946706518.db2.gz GWKOGAQEWINVCX-DEOSSOPVSA-N 0 3 421.516 4.479 20 0 HIADHN COc1ccccc1[C@H](CC(C)C)N[C@H]1CCCc2cc(S(N)(=O)=O)ccc21 ZINC000568908029 946745348 /nfs/dbraw/zinc/74/53/48/946745348.db2.gz QNWIMHTYOVXLIC-SFTDATJTSA-N 0 3 402.560 4.097 20 0 HIADHN CCCN(C)[C@H](CNC(=O)NCc1cccc(NC(C)=O)c1)c1ccc(Cl)cc1 ZINC000568914539 946750053 /nfs/dbraw/zinc/75/00/53/946750053.db2.gz FJXYJWAUNXDJGL-OAQYLSRUSA-N 0 3 416.953 4.181 20 0 HIADHN CCN1CC[C@H](N[C@H](C)C(=O)N2[C@H](C)CCC[C@@H]2C)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000568991791 946792688 /nfs/dbraw/zinc/79/26/88/946792688.db2.gz WOLDMPFIPVZFRZ-PLCCHYODSA-N 0 3 411.512 4.007 20 0 HIADHN COc1ccc([C@H](Cc2ccccc2)N[C@@H](C)C(=O)Nc2ccnn2C(C)C)cc1 ZINC000569046721 946808324 /nfs/dbraw/zinc/80/83/24/946808324.db2.gz YCTSAJLKZFQNKN-AVRDEDQJSA-N 0 3 406.530 4.373 20 0 HIADHN COc1cccc(C2(NCCOc3ccc(Br)cc3)CCOCC2)c1F ZINC000569067912 946814687 /nfs/dbraw/zinc/81/46/87/946814687.db2.gz HPSIHCSQJDAUSA-UHFFFAOYSA-N 0 3 424.310 4.271 20 0 HIADHN CN1CC[C@H](NCCS(=O)(=O)c2ccc(C(C)(C)C)cc2)C[C@H]1c1ccccc1 ZINC000569146930 946822947 /nfs/dbraw/zinc/82/29/47/946822947.db2.gz SKQNOPYAFGHOSL-GMAHTHKFSA-N 0 3 414.615 4.183 20 0 HIADHN COc1ccc(CN(Cc2cnc(-c3cnn(C)c3)nc2)C2CCCCC2)cc1OC ZINC000569276918 946847733 /nfs/dbraw/zinc/84/77/33/946847733.db2.gz WWXAQRIMZPJQOY-UHFFFAOYSA-N 0 3 421.545 4.229 20 0 HIADHN C[C@H](NC[C@]1(CO)C[C@@H]1c1ccccc1)c1ccccc1I ZINC000569397069 946866919 /nfs/dbraw/zinc/86/69/19/946866919.db2.gz ZRVJPTVZUNAXNC-YJLNNSPDSA-N 0 3 407.295 4.108 20 0 HIADHN O=C(NCCCNCc1cc(C(F)(F)F)ccc1Br)c1cccs1 ZINC000569413426 946871365 /nfs/dbraw/zinc/87/13/65/946871365.db2.gz FYSSKRCHUNTLAM-UHFFFAOYSA-N 0 3 421.282 4.439 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)NCC(C)(C)Oc1cc(F)cc(F)c1 ZINC000569718583 946954538 /nfs/dbraw/zinc/95/45/38/946954538.db2.gz RGASXLWOHRTECF-UHFFFAOYSA-N 0 3 402.441 4.360 20 0 HIADHN O=C(CCc1ccccn1)N(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000569755534 946987106 /nfs/dbraw/zinc/98/71/06/946987106.db2.gz JFSOZMNZXYBMNA-RUZDIDTESA-N 0 3 414.553 4.103 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)c2ccc(-c3noc(CC(C)(C)C)n3)cc2)o1 ZINC000569774490 947004923 /nfs/dbraw/zinc/00/49/23/947004923.db2.gz LNZVOEJARSZJML-UHFFFAOYSA-N 0 3 424.545 4.431 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)CSc1cccc(Br)c1)c1ccco1 ZINC000569842519 947017487 /nfs/dbraw/zinc/01/74/87/947017487.db2.gz KGCKOCAUOPYSJE-BBRMVZONSA-N 0 3 411.365 4.380 20 0 HIADHN CNC(=O)[C@H](CCSC)NCc1ccc(-c2ccccc2Br)s1 ZINC000569959998 947053229 /nfs/dbraw/zinc/05/32/29/947053229.db2.gz NSRAKXGBLFAMKZ-HNNXBMFYSA-N 0 3 413.406 4.135 20 0 HIADHN FC(F)n1c2ccccc2nc1CCNCc1cn2ccc(Br)cc2n1 ZINC000570011543 947073362 /nfs/dbraw/zinc/07/33/62/947073362.db2.gz GYFLHVSTUFAQES-UHFFFAOYSA-N 0 3 420.261 4.174 20 0 HIADHN CN(C)CCn1nccc1NC(=O)c1ccc(-c2ccc(Br)cc2)s1 ZINC000570079036 947087645 /nfs/dbraw/zinc/08/76/45/947087645.db2.gz FEICGKBRODSHRQ-UHFFFAOYSA-N 0 3 419.348 4.188 20 0 HIADHN COc1ccc([C@H](C)NC[C@@]2(CO)C[C@@H]2c2ccc(F)cc2)c(Br)c1 ZINC000570084460 947090299 /nfs/dbraw/zinc/09/02/99/947090299.db2.gz DRKHCBZDCCUDNE-CYFNAFFESA-N 0 3 408.311 4.414 20 0 HIADHN CC(=O)N(Cc1ccc(NC(=O)N[C@H]2CCN(Cc3ccccc3)[C@@H]2C)cc1)C(C)C ZINC000570125018 947104714 /nfs/dbraw/zinc/10/47/14/947104714.db2.gz YKCVMAKHXYFQFE-DVECYGJZSA-N 0 3 422.573 4.228 20 0 HIADHN CCOc1ccc(NC(=O)COc2ccc(CN[C@H]3CCC[C@H]3F)cc2OC)cc1 ZINC000570414957 947233184 /nfs/dbraw/zinc/23/31/84/947233184.db2.gz YCBIRENHMHQCEW-UXHICEINSA-N 0 3 416.493 4.092 20 0 HIADHN C[C@@H]1CN(CCOC2CCN(Cc3cnc(C4CCCCC4)s3)CC2)C[C@H](C)O1 ZINC000570551706 947289871 /nfs/dbraw/zinc/28/98/71/947289871.db2.gz NGKOLKOEHOJCJT-KDURUIRLSA-N 0 3 421.651 4.281 20 0 HIADHN Cc1cc(CSc2ncccc2C(=O)N[C@H]2CCN(Cc3ccccc3)[C@H]2C)no1 ZINC000570595377 947308274 /nfs/dbraw/zinc/30/82/74/947308274.db2.gz LUHPFYHFCMPTIH-UWJYYQICSA-N 0 3 422.554 4.063 20 0 HIADHN O=C1[C@H](N[C@H](C[C@H]2CCOC2)c2ccccc2)CCN1c1ccc(F)c(Cl)c1 ZINC000570639245 947319679 /nfs/dbraw/zinc/31/96/79/947319679.db2.gz HGADORKXVHDNNC-IPHXSNPTSA-N 0 3 402.897 4.342 20 0 HIADHN CC(=O)Nc1cccc(NC(=O)[C@H](C)N[C@H](C)c2ccc(-c3ccncc3)cc2)c1 ZINC000570700790 947330111 /nfs/dbraw/zinc/33/01/11/947330111.db2.gz VWOMBHZVHMNRME-SJORKVTESA-N 0 3 402.498 4.385 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)NCc2sccc2Br)C1 ZINC000570828440 947363971 /nfs/dbraw/zinc/36/39/71/947363971.db2.gz LSIBLPMHOCHYLQ-HIFRSBDPSA-N 0 3 408.365 4.145 20 0 HIADHN C[C@@H]1CCc2c(F)cccc2[C@H]1NCc1cccc(N2C(=O)N[C@](C)(C3CC3)C2=O)c1 ZINC000570948155 947396306 /nfs/dbraw/zinc/39/63/06/947396306.db2.gz APHHDKSMGLFIQL-NBCYMOSYSA-N 0 3 421.516 4.464 20 0 HIADHN CN(C)C[C@H](NCc1cc(Br)c2c(c1)OCCCO2)c1ccc(F)cc1 ZINC000570963164 947400488 /nfs/dbraw/zinc/40/04/88/947400488.db2.gz FYXQYEORYFSTFW-SFHVURJKSA-N 0 3 423.326 4.142 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)c1cccnc1OCc1ccccc1F)c1ccco1 ZINC000571117198 947510423 /nfs/dbraw/zinc/51/04/23/947510423.db2.gz RHMMEVMSYLSPPE-JXFKEZNVSA-N 0 3 411.477 4.252 20 0 HIADHN COCCn1cc(C(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)c2ccccc21 ZINC000571195276 947540781 /nfs/dbraw/zinc/54/07/81/947540781.db2.gz SGZKLBHSUJQNIV-XMMPIXPASA-N 0 3 423.557 4.108 20 0 HIADHN CCOc1ccc(/C=C\c2nc(-c3ccc(N4CCCN(C)CC4)nc3)no2)cc1C ZINC000571205566 947544409 /nfs/dbraw/zinc/54/44/09/947544409.db2.gz WEWVTSHYHXYHMZ-XFFZJAGNSA-N 0 3 419.529 4.151 20 0 HIADHN C[C@H](c1ccc(F)c(F)c1)N(C)C(=O)CN[C@H]1c2ccccc2CC12CCOCC2 ZINC000571210506 947547866 /nfs/dbraw/zinc/54/78/66/947547866.db2.gz GMAIOBJBVSVYCW-MWTRTKDXSA-N 0 3 414.496 4.168 20 0 HIADHN O[C@@H](CO[C@@H]1CCCc2ccccc21)CN1CCC(Oc2cncc(Cl)c2)CC1 ZINC000571242388 947564154 /nfs/dbraw/zinc/56/41/54/947564154.db2.gz AGFIWQGFCQVEMF-AUSIDOKSSA-N 0 3 416.949 4.033 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1sc(C(C)(C)OC)nc1C)c1cccc(OC)c1 ZINC000571366994 947625749 /nfs/dbraw/zinc/62/57/49/947625749.db2.gz ZQBFZWOJSNGZLE-SFHVURJKSA-N 0 3 419.591 4.155 20 0 HIADHN Cc1cc(C(=O)N(Cc2ccccc2Br)C2CCN(C)CC2)oc1C ZINC000571608893 947729606 /nfs/dbraw/zinc/72/96/06/947729606.db2.gz FORYREXWADUJMA-UHFFFAOYSA-N 0 3 405.336 4.396 20 0 HIADHN C[C@@H]1CN(c2ccc(CN[C@H]3CCc4c3cccc4Br)cn2)C[C@@H](C)O1 ZINC000571666435 947740717 /nfs/dbraw/zinc/74/07/17/947740717.db2.gz CRVZQDPUOGUTLT-SXGZJXTBSA-N 0 3 416.363 4.235 20 0 HIADHN CC(=O)Nc1cccc(NC(=O)CN[C@@H](c2cccc(C(F)(F)F)c2)C2CC2)c1 ZINC000571898728 947808025 /nfs/dbraw/zinc/80/80/25/947808025.db2.gz PRFBRVDCFMULOC-HXUWFJFHSA-N 0 3 405.420 4.343 20 0 HIADHN CN(C)C[C@H](NC(=O)Nc1ccc(F)cc1-c1cnn(C)c1)c1ccc(Cl)cc1 ZINC000571898439 947808336 /nfs/dbraw/zinc/80/83/36/947808336.db2.gz MPRWQHIMWWRUAC-FQEVSTJZSA-N 0 3 415.900 4.304 20 0 HIADHN C[C@H](c1ccc(F)c(F)c1)N(C)C(=O)CN[C@@H]1CCN(C)[C@H]1c1ccc(Cl)cc1 ZINC000571963126 947823178 /nfs/dbraw/zinc/82/31/78/947823178.db2.gz SOESRDDIKUNZHF-ZFGLAFRWSA-N 0 3 421.919 4.173 20 0 HIADHN CC(=O)Nc1ccccc1CN1CCC(O)(Cc2ccc(OC(F)(F)F)cc2)CC1 ZINC000572047619 947832787 /nfs/dbraw/zinc/83/27/87/947832787.db2.gz PTQRFWZVJXKOCL-UHFFFAOYSA-N 0 3 422.447 4.113 20 0 HIADHN CN1CCCN(c2ccc(-c3noc([C@@H]4C[C@H]4c4ccccc4Cl)n3)cn2)CC1 ZINC000572085614 947843638 /nfs/dbraw/zinc/84/36/38/947843638.db2.gz UMEDVDLYVXCUPH-ZWKOTPCHSA-N 0 3 409.921 4.198 20 0 HIADHN CN(C)c1cc(Cl)cc(Cl)c1CNCCCC(=O)N1Cc2ccccc2C1 ZINC000572170351 947855215 /nfs/dbraw/zinc/85/52/15/947855215.db2.gz NBVBOAVYFVSBSI-UHFFFAOYSA-N 0 3 406.357 4.472 20 0 HIADHN CC[C@@H](C(=O)Nc1cccc(CN2CC[C@@H](O)C2)c1)c1cccc(C(F)(F)F)c1 ZINC000572173025 947856463 /nfs/dbraw/zinc/85/64/63/947856463.db2.gz AVSIITLLKDMVJQ-WOJBJXKFSA-N 0 3 406.448 4.404 20 0 HIADHN COCCCN(C(=O)CCCc1cc(Cl)sc1Cl)C1CCN(C)CC1 ZINC000572177444 947857304 /nfs/dbraw/zinc/85/73/04/947857304.db2.gz TYPOTCWLFVAFLS-UHFFFAOYSA-N 0 3 407.407 4.337 20 0 HIADHN CCN(CC)[C@@H](CN[C@@H](c1nnc[nH]1)c1ccc(F)cc1)c1ccccc1Cl ZINC000572307653 947880458 /nfs/dbraw/zinc/88/04/58/947880458.db2.gz XQFHDBFXKNKERT-VQTJNVASSA-N 0 3 401.917 4.359 20 0 HIADHN COc1ccc2c(c1F)CC[C@@H]2N[C@@H](C)c1cc(F)ccc1N1CCN(C)CC1 ZINC000572439757 947905862 /nfs/dbraw/zinc/90/58/62/947905862.db2.gz FPNCDTAMDALSAH-YWZLYKJASA-N 0 3 401.501 4.063 20 0 HIADHN O=C(CCN1CCCC[C@H]1CNC(=O)Nc1ccccc1)Nc1cccc(Cl)c1 ZINC000572535034 947936783 /nfs/dbraw/zinc/93/67/83/947936783.db2.gz DHXSFFNOQJSTDP-FQEVSTJZSA-N 0 3 414.937 4.345 20 0 HIADHN Cc1cc(=O)[nH]c2cc(C(=O)N[C@@H](CN3CCc4ccccc4C3)C(C)(C)C)ccc12 ZINC000572637382 947963413 /nfs/dbraw/zinc/96/34/13/947963413.db2.gz DUXVEISJRJUZDS-QHCPKHFHSA-N 0 3 417.553 4.452 20 0 HIADHN O=C1NCCc2ccc(CN[C@@H]3CCCc4c5cc(Br)ccc5[nH]c43)cc21 ZINC000572756957 948001762 /nfs/dbraw/zinc/00/17/62/948001762.db2.gz IRUCNQXDRWMILL-HXUWFJFHSA-N 0 3 424.342 4.384 20 0 HIADHN CC(C)Cn1ncc(NC(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)c1C(F)F ZINC000572905176 948034262 /nfs/dbraw/zinc/03/42/62/948034262.db2.gz CIRYLFMRRQRYOV-RDJZCZTQSA-N 0 3 405.493 4.434 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)Cc1c[nH]c2cc(Br)ccc12 ZINC000573040819 948067576 /nfs/dbraw/zinc/06/75/76/948067576.db2.gz RSRVCLKTTZKAJP-OAHLLOKOSA-N 0 3 414.347 4.110 20 0 HIADHN O=C(CCNCc1ccccc1OC1CCCC1)Nc1ccc(N2CCCC2=O)cc1 ZINC000573050928 948072521 /nfs/dbraw/zinc/07/25/21/948072521.db2.gz UJJASMZMILZYEY-UHFFFAOYSA-N 0 3 421.541 4.253 20 0 HIADHN Cc1cc(NC(=O)c2cncc(C(F)(F)F)c2)cc(N2CCN(C(C)C)CC2)c1 ZINC000573132295 948083702 /nfs/dbraw/zinc/08/37/02/948083702.db2.gz QOJJQBPVWMCSDS-UHFFFAOYSA-N 0 3 406.452 4.192 20 0 HIADHN CN(C[C@@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)Cc1ccc2ccccc2c1 ZINC000573215855 948109250 /nfs/dbraw/zinc/10/92/50/948109250.db2.gz DTNAUICZWMPHOU-QFIPXVFZSA-N 0 3 408.567 4.124 20 0 HIADHN CCCN(CC)C[C@@H](C)N[C@@H](c1ccc(C)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000573254727 948125218 /nfs/dbraw/zinc/12/52/18/948125218.db2.gz VEFFMWLDSNOLPN-XXBNENTESA-N 0 3 402.604 4.198 20 0 HIADHN CCCn1ccnc1CCCN(C)Cc1cnc2c(C)cc(Br)cn12 ZINC000573330116 948155869 /nfs/dbraw/zinc/15/58/69/948155869.db2.gz GDSDUNKUHJJYIT-UHFFFAOYSA-N 0 3 404.356 4.076 20 0 HIADHN C[C@@H](C(=O)N(Cc1ccccc1Br)C1CCN(C)CC1)c1cccnc1 ZINC000573379214 948172681 /nfs/dbraw/zinc/17/26/81/948172681.db2.gz WQTPSCPPCXGYGF-MRXNPFEDSA-N 0 3 416.363 4.071 20 0 HIADHN C[C@H]1[C@H](NC(=O)N2CCC(C(F)(F)F)(C(F)(F)F)C2)CCN1Cc1ccccc1 ZINC000573474668 948212450 /nfs/dbraw/zinc/21/24/50/948212450.db2.gz CKPAFLBADICKEB-DZGCQCFKSA-N 0 3 423.401 4.176 20 0 HIADHN CN(CCCN(C)C(=O)c1ccccc1CCc1ccccc1)Cc1ccncc1 ZINC000573638209 948260531 /nfs/dbraw/zinc/26/05/31/948260531.db2.gz CEHQFNUVHYTMCM-UHFFFAOYSA-N 0 3 401.554 4.461 20 0 HIADHN COC(=O)c1cccc(CNCc2cn(Cc3ccccc3)nc2-c2cccnc2)c1 ZINC000573645921 948266152 /nfs/dbraw/zinc/26/61/52/948266152.db2.gz ZEYAJZILOZOMLN-UHFFFAOYSA-N 0 3 412.493 4.070 20 0 HIADHN Cc1nc(COc2cccc(C(=O)N[C@@H]3CCN(Cc4ccccc4)[C@H]3C)c2)cs1 ZINC000573716071 948280478 /nfs/dbraw/zinc/28/04/78/948280478.db2.gz VDEULHUWXQEFOY-GAJHUEQPSA-N 0 3 421.566 4.423 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)[C@H]2C[C@@H]2c2ccccc2OC(F)(F)F)cc1 ZINC000573737021 948285294 /nfs/dbraw/zinc/28/52/94/948285294.db2.gz XXZMAXHQECSWSL-QYZOEREBSA-N 0 3 422.447 4.116 20 0 HIADHN Cc1c2ccccc2oc1CNC(=O)N(CCN(C)C)Cc1ccc(F)cc1F ZINC000573736018 948285571 /nfs/dbraw/zinc/28/55/71/948285571.db2.gz SEBADCYWFKKUFX-UHFFFAOYSA-N 0 3 401.457 4.293 20 0 HIADHN O=C1CCc2cc(-c3noc([C@H]4CCCN(Cc5cccc(F)c5)C4)n3)ccc2N1 ZINC000573737696 948286550 /nfs/dbraw/zinc/28/65/50/948286550.db2.gz RJGPVPKGXZOSMP-SFHVURJKSA-N 0 3 406.461 4.140 20 0 HIADHN CCCN(CCN1CCCCCC1)C(=O)C(=O)Nc1ccc2oc(C(C)C)nc2c1 ZINC000573838173 948308171 /nfs/dbraw/zinc/30/81/71/948308171.db2.gz KCRQIDHGTIVORU-UHFFFAOYSA-N 0 3 414.550 4.004 20 0 HIADHN C[C@H](NC(=O)c1nc2ccccc2cc1Br)[C@H](c1ccccc1)N(C)C ZINC000574117928 948369045 /nfs/dbraw/zinc/36/90/45/948369045.db2.gz WRBDCBIJKRDVTK-VBKZILBWSA-N 0 3 412.331 4.419 20 0 HIADHN CN(C)Cc1cccc(NC(=O)C(=O)N[C@H](c2c(Cl)cccc2Cl)C2CC2)c1 ZINC000574206544 948386681 /nfs/dbraw/zinc/38/66/81/948386681.db2.gz GDCXXROTIQNEPF-IBGZPJMESA-N 0 3 420.340 4.261 20 0 HIADHN CC(=O)c1ccc(OCCCC(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)cc1 ZINC000574424187 948436402 /nfs/dbraw/zinc/43/64/02/948436402.db2.gz MXZLVGDLTYRHOC-OAQYLSRUSA-N 0 3 402.922 4.121 20 0 HIADHN C[C@@H]1CN(CCC(=O)Nc2ccccc2Oc2ccccc2)CC2(CCOCC2)O1 ZINC000574598382 948487777 /nfs/dbraw/zinc/48/77/77/948487777.db2.gz ARZAWJAVFSHXHQ-LJQANCHMSA-N 0 3 410.514 4.077 20 0 HIADHN CN1CC[C@H](NC(=O)NC[C@@H](Cc2ccccc2)C(F)(F)F)[C@@H]1c1ccccc1 ZINC000574614036 948492934 /nfs/dbraw/zinc/49/29/34/948492934.db2.gz BULLGHIEZTWMAB-AABGKKOBSA-N 0 3 405.464 4.152 20 0 HIADHN Cc1ccc(NC(=O)CSc2ccccc2C(=O)N2[C@@H]3CC[C@H]2CCN(C)C3)cc1 ZINC000574627571 948494827 /nfs/dbraw/zinc/49/48/27/948494827.db2.gz VBMOLGQCRBRMFW-VQTJNVASSA-N 0 3 423.582 4.035 20 0 HIADHN O=S1(=O)CC[C@@H](NCC2CC(c3ccccc3)C2)c2cc(Br)ccc21 ZINC000574707375 948507446 /nfs/dbraw/zinc/50/74/46/948507446.db2.gz UWSAVKLXLJLBHR-GSQSYGFSSA-N 0 3 420.372 4.451 20 0 HIADHN C/C=C/c1ccc(OC[C@@H](O)CNCc2cc(Br)cs2)c(OC)c1 ZINC000574772530 948522593 /nfs/dbraw/zinc/52/25/93/948522593.db2.gz QTXJMHGKDSTPCS-BWPKMQGJSA-N 0 3 412.349 4.082 20 0 HIADHN COc1cccc([C@H]2[C@@H](NCc3nc4cc(Cl)ccc4n3C)CCN2C2CC2)c1 ZINC000574827385 948537690 /nfs/dbraw/zinc/53/76/90/948537690.db2.gz YJXJFQHYULWPAI-CVDCTZTESA-N 0 3 410.949 4.303 20 0 HIADHN COC(=O)c1c(F)ccc(NC(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)c1C ZINC000574946909 948562901 /nfs/dbraw/zinc/56/29/01/948562901.db2.gz FFMBBGLWMAYAIG-HXUWFJFHSA-N 0 3 413.493 4.188 20 0 HIADHN CN(C)Cc1ccc(S(=O)(=O)N[C@@H](c2cccs2)c2ccc(F)cc2)cc1 ZINC000574954062 948563788 /nfs/dbraw/zinc/56/37/88/948563788.db2.gz WMAHBJXQLWVTRL-HXUWFJFHSA-N 0 3 404.532 4.017 20 0 HIADHN Cc1ccc(C[C@H](NC[C@H](O)COc2cccc3[nH]ccc32)c2ccccn2)cc1 ZINC000574961756 948566059 /nfs/dbraw/zinc/56/60/59/948566059.db2.gz QQOQLIHXEQVQAN-RDPSFJRHSA-N 0 3 401.510 4.185 20 0 HIADHN CC(C)c1ccc(CCNC(=O)CN[C@@H]2c3ccccc3CC23CCOCC3)cc1 ZINC000574964451 948566107 /nfs/dbraw/zinc/56/61/07/948566107.db2.gz IWSFJTFLGRPLBQ-RUZDIDTESA-N 0 3 406.570 4.153 20 0 HIADHN CN(CCCn1ccnc1)Cc1cc(Br)ccc1OCc1ccccn1 ZINC000574961166 948566407 /nfs/dbraw/zinc/56/64/07/948566407.db2.gz IKTWUYHQBNMVFS-UHFFFAOYSA-N 0 3 415.335 4.142 20 0 HIADHN O=C(Nc1c[nH]nc1[C@@H]1CCCN(C[C@@H]2CCC3(CCCC3)O2)C1)C1CCCC1 ZINC000575021525 948574974 /nfs/dbraw/zinc/57/49/74/948574974.db2.gz XHYUAZGODLIZGR-MOPGFXCFSA-N 0 3 400.567 4.210 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2CN2CCC[C@@H](c3ccnc(N)n3)C2)o1 ZINC000575094581 948591644 /nfs/dbraw/zinc/59/16/44/948591644.db2.gz FPPIOWXWXQBZCC-GOSISDBHSA-N 0 3 414.513 4.193 20 0 HIADHN CC[C@H](C)n1c(SCCCN2CCN(C(C)C)CC2)nnc1-c1ccccc1 ZINC000575131057 948600833 /nfs/dbraw/zinc/60/08/33/948600833.db2.gz RUDMCWDKFRTGNC-IBGZPJMESA-N 0 3 401.624 4.424 20 0 HIADHN CCOC(=O)c1cnn(C2CCN(CCCc3c(F)cccc3Cl)CC2)c1C ZINC000575163686 948614929 /nfs/dbraw/zinc/61/49/29/948614929.db2.gz HTLAVAILSUMJQQ-UHFFFAOYSA-N 0 3 407.917 4.430 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)N[C@H](C)CN(C)Cc2ccccc2)cc1OC ZINC000575810729 948720718 /nfs/dbraw/zinc/72/07/18/948720718.db2.gz VYQCUCWWKAZZCS-NQIIRXRSSA-N 0 3 411.546 4.071 20 0 HIADHN COc1ccc(C[C@@H](C)C(=O)NC[C@@H](c2ccc(SC)cc2)N(C)C)cc1OC ZINC000575831576 948728199 /nfs/dbraw/zinc/72/81/99/948728199.db2.gz RQKSXLSKNMMLGC-UZLBHIALSA-N 0 3 416.587 4.023 20 0 HIADHN C[C@@H]1CN(c2cccc3cnccc32)CCN1Cc1ccc(-c2cnn(C)c2)s1 ZINC000576011055 948809729 /nfs/dbraw/zinc/80/97/29/948809729.db2.gz CGRUWSOYFRWYSQ-QGZVFWFLSA-N 0 3 403.555 4.408 20 0 HIADHN FC(F)(c1c2c(nnc1Cl)CCC2)N1CCC[C@@H]2CN(Cc3ccccc3)C[C@@H]21 ZINC001164630101 719099347 /nfs/dbraw/zinc/09/93/47/719099347.db2.gz VGUQRFRBPPCVPK-APWZRJJASA-N 0 3 418.919 4.264 20 0 HIADHN C[C@@H]1CCc2c(sc3ncnc(N4CC[C@@H]5[C@H]4CCN5Cc4cccnc4)c23)C1 ZINC001164725074 720380491 /nfs/dbraw/zinc/38/04/91/720380491.db2.gz LPYPMRJFBOHDHA-ATZDWAIDSA-N 0 3 405.571 4.064 20 0 HIADHN c1ccc(Cc2nnc(N3CC[C@H]4[C@H]3CCN4Cc3cccnc3)c3ccccc23)cc1 ZINC001164727704 720432395 /nfs/dbraw/zinc/43/23/95/720432395.db2.gz DXBLZNFNSQVMNL-IZZNHLLZSA-N 0 3 421.548 4.469 20 0 HIADHN FC(F)(N1CCCn2cnc(CNC3CCC3)c2C1)C1(c2ccc(Cl)nc2)CC1 ZINC001164844389 720740764 /nfs/dbraw/zinc/74/07/64/720740764.db2.gz RCFDORMEVXJQLL-UHFFFAOYSA-N 0 3 421.923 4.104 20 0 HIADHN Cn1cc(CN2CC[C@@H]3CN(c4nc(Cl)ccc4-c4ccccc4)C[C@@H]3C2)cn1 ZINC001164765595 721126815 /nfs/dbraw/zinc/12/68/15/721126815.db2.gz JNMHETSSWNDTFK-UXHICEINSA-N 0 3 407.949 4.094 20 0 HIADHN Cn1cc(CN2CC[C@@H]3CN(c4cc(-c5ccccc5)cc(Cl)n4)C[C@@H]3C2)cn1 ZINC001164772254 721128256 /nfs/dbraw/zinc/12/82/56/721128256.db2.gz UUTKCVBAHINURE-CTNGQTDRSA-N 0 3 407.949 4.094 20 0 HIADHN Cc1nc(C(C)C)cc(N2CCC(F)(F)[C@]3(CCN(Cc4ccccn4)C3)C2)n1 ZINC001164907451 721585750 /nfs/dbraw/zinc/58/57/50/721585750.db2.gz SZNJXAUPJLNXFB-NRFANRHFSA-N 0 3 401.505 4.041 20 0 HIADHN Cc1cncc(COC[C@@]23CCC[C@H]2CN(c2ncccc2CN2CCCC2)C3)c1 ZINC001164803630 721601927 /nfs/dbraw/zinc/60/19/27/721601927.db2.gz WIUBTNXPTKOBGX-ZCYQVOJMSA-N 0 3 406.574 4.204 20 0 HIADHN Cc1cc2cccnc2c(N2CCC(F)(F)[C@]3(CCN(Cc4ccccn4)C3)C2)n1 ZINC001164912766 721731363 /nfs/dbraw/zinc/73/13/63/721731363.db2.gz PYVIHMKVVCEKNI-QFIPXVFZSA-N 0 3 409.484 4.071 20 0 HIADHN CCOC(=O)c1cc2ccnc(N3CCC[C@@]4(CCN4Cc4cccc(F)c4)C3)c2[nH]1 ZINC001164995195 722197642 /nfs/dbraw/zinc/19/76/42/722197642.db2.gz SKFJIUKFILRBPP-XMMPIXPASA-N 0 3 422.504 4.124 20 0 HIADHN CCOc1ccc2ncnc(N3CCC[C@]4(CCN4Cc4cccc(F)c4)C3)c2c1 ZINC001164995969 722200996 /nfs/dbraw/zinc/20/09/96/722200996.db2.gz QPANQJBPPXSSQL-DEOSSOPVSA-N 0 3 406.505 4.413 20 0 HIADHN COc1cc2c(cc1F)ncnc2N1CCC[C@@]2(CCN2Cc2cccc(F)c2)C1 ZINC001164994067 722204565 /nfs/dbraw/zinc/20/45/65/722204565.db2.gz FGEUBXHGYXIHPI-HSZRJFAPSA-N 0 3 410.468 4.162 20 0 HIADHN CCOC(=O)c1cnc2cc(N3CCC[C@@]4(CCN4Cc4cccc(F)c4)C3)[nH]cc1-2 ZINC001164993820 722207124 /nfs/dbraw/zinc/20/71/24/722207124.db2.gz BWRNZPUQFOFUCE-XMMPIXPASA-N 0 3 422.504 4.124 20 0 HIADHN Fc1cccc(OCc2noc([C@@]3(C(F)(F)F)CCN(Cc4ccccc4)C3)n2)c1 ZINC000435990394 861268758 /nfs/dbraw/zinc/26/87/58/861268758.db2.gz BVDQMDYUABJUHZ-HXUWFJFHSA-N 0 3 421.394 4.494 20 0 HIADHN O=C(Nc1ccc(F)cc1)[C@H](NCC1CCN(CC(F)(F)F)CC1)c1ccccc1 ZINC000435993588 861273009 /nfs/dbraw/zinc/27/30/09/861273009.db2.gz JDWRCEGCTCJGIZ-HXUWFJFHSA-N 0 3 423.454 4.369 20 0 HIADHN CC[C@@H](Nc1ccccc1)C(=O)Nc1cc(C)nn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000436007656 861295860 /nfs/dbraw/zinc/29/58/60/861295860.db2.gz YTAFDDPXCRCBLA-DHIUTWEWSA-N 0 3 417.557 4.468 20 0 HIADHN CCN1CCC[C@H](NC(=O)N[C@@H](CC(F)(F)F)c2ccc(C(F)(F)F)cc2)C1 ZINC000436034748 861326785 /nfs/dbraw/zinc/32/67/85/861326785.db2.gz OWZKFVNUALLRFF-GJZGRUSLSA-N 0 3 411.390 4.482 20 0 HIADHN Cc1cc(NC(=O)[C@@H](c2cccnc2)C(C)C)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000436151168 861448831 /nfs/dbraw/zinc/44/88/31/861448831.db2.gz KXNHSVUGDOMBBB-LADGPHEKSA-N 0 3 417.557 4.412 20 0 HIADHN C=CCn1c(SCC(=O)C(C#N)c2nc(C)cs2)nnc1-c1ccc(F)cc1 ZINC000007833923 845426303 /nfs/dbraw/zinc/42/63/03/845426303.db2.gz GSDIJOPMLSUIHS-OAHLLOKOSA-N 0 3 413.503 4.004 20 0 HIADHN Cc1c([C@@H](C)N[C@H]2CC[C@@H](C(=O)N3CCCCC3)C2)nnn1-c1cccc(Cl)c1 ZINC000436284620 861592103 /nfs/dbraw/zinc/59/21/03/861592103.db2.gz MOGVZHGIMZJTSQ-SUMDDJOVSA-N 0 3 415.969 4.061 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CC1 ZINC000011948295 845843035 /nfs/dbraw/zinc/84/30/35/845843035.db2.gz UECUSSWMJFHIEG-UHFFFAOYSA-N 0 3 410.499 4.204 20 0 HIADHN COc1cccc([C@@H](CNC(=O)Cc2cccc(C(F)(F)F)c2)N2CCCC2)c1 ZINC000014628581 845964765 /nfs/dbraw/zinc/96/47/65/845964765.db2.gz CYKKHQISENSDEC-HXUWFJFHSA-N 0 3 406.448 4.210 20 0 HIADHN CC(C)[C@H](NCC(=O)Nc1ccccc1C(=O)NCc1ccco1)c1ccccc1 ZINC000015550310 846062130 /nfs/dbraw/zinc/06/21/30/846062130.db2.gz AYOCFBJBESRADR-QHCPKHFHSA-N 0 3 405.498 4.135 20 0 HIADHN CC1CCN([C@H](CNC(=O)CCc2nnc(-c3ccccc3)o2)c2cccs2)CC1 ZINC000022680986 846602797 /nfs/dbraw/zinc/60/27/97/846602797.db2.gz HTUYMFNVSJSGFV-LJQANCHMSA-N 0 3 424.570 4.320 20 0 HIADHN COc1cc(C(C)=O)ccc1OC[C@H](O)CNC(c1ccccc1)c1ccccc1 ZINC000023387301 846693691 /nfs/dbraw/zinc/69/36/91/846693691.db2.gz BIWICPZQSZEMOA-JOCHJYFZSA-N 0 3 405.494 4.017 20 0 HIADHN COc1ccc(-c2nc(C(=O)NC[C@@H](c3ccccc3)N3CCCC3)cs2)cc1 ZINC000023740481 846744701 /nfs/dbraw/zinc/74/47/01/846744701.db2.gz ASYLVUFAEVXOOP-NRFANRHFSA-N 0 3 407.539 4.386 20 0 HIADHN COc1cc(CN[C@H](C)c2ccc(Cl)cc2)ccc1OCC(=O)N1CCCC1 ZINC000025360923 846966533 /nfs/dbraw/zinc/96/65/33/846966533.db2.gz LGDWISYUUOXUTP-MRXNPFEDSA-N 0 3 402.922 4.201 20 0 HIADHN CC(C)[C@@H](CNC(=O)Cc1coc(-c2ccccc2)n1)N1CCc2ccccc2C1 ZINC000025918592 847057234 /nfs/dbraw/zinc/05/72/34/847057234.db2.gz FBKZEOYKSJURFS-HSZRJFAPSA-N 0 3 403.526 4.083 20 0 HIADHN COc1ccc(OC)c([C@H](C)NC[C@H](O)COc2cc(Cl)ccc2Cl)c1 ZINC000026715389 847189799 /nfs/dbraw/zinc/18/97/99/847189799.db2.gz PBCMBMIDUUNUNR-JSGCOSHPSA-N 0 3 400.302 4.101 20 0 HIADHN CC(=O)c1ccc(OCCCC(=O)NC[C@@H](c2cccs2)N2CCCC2)cc1 ZINC000027608328 847327560 /nfs/dbraw/zinc/32/75/60/847327560.db2.gz XPUZLGBULUJJNK-FQEVSTJZSA-N 0 3 400.544 4.063 20 0 HIADHN O=C(CCN1CCN(Cc2ccccc2)CC1)N[C@H](c1cccs1)c1ccccc1 ZINC000028843077 847468163 /nfs/dbraw/zinc/46/81/63/847468163.db2.gz BTWDEAXXKYLAEK-VWLOTQADSA-N 0 3 419.594 4.162 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)N[C@H](c3cccs3)c3ccccc3)CC2)c1 ZINC000028892110 847473011 /nfs/dbraw/zinc/47/30/11/847473011.db2.gz KZLOIYHWHBYXFZ-VWLOTQADSA-N 0 3 419.594 4.474 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CNC(=O)CN[C@@H](c1ccc(F)cc1)C(C)C ZINC000029117409 847509069 /nfs/dbraw/zinc/50/90/69/847509069.db2.gz ZWEMHHWGYOYAGP-RUZDIDTESA-N 0 3 422.548 4.290 20 0 HIADHN C/C=C/c1ccc(OCC(=O)NCC(C)(C)N2CCc3ccccc3C2)c(OC)c1 ZINC000029161740 847517249 /nfs/dbraw/zinc/51/72/49/847517249.db2.gz QJMKIEMSRWVYAA-VMPITWQZSA-N 0 3 408.542 4.060 20 0 HIADHN O=C(/C=C/c1ccco1)NCCCCN1CCN(c2cccc(C(F)(F)F)c2)CC1 ZINC000029166136 847517813 /nfs/dbraw/zinc/51/78/13/847517813.db2.gz QLAZJOYBMBTZPH-CMDGGOBGSA-N 0 3 421.463 4.030 20 0 HIADHN CC(C)[C@H](CNC(=O)CSc1nc2ccccc2o1)N1CCc2ccccc2C1 ZINC000029174319 847520850 /nfs/dbraw/zinc/52/08/50/847520850.db2.gz CIGHHXFJGWZXNS-FQEVSTJZSA-N 0 3 409.555 4.119 20 0 HIADHN CC(C)[C@H](CNC(=O)c1cc(F)ccc1Br)N1CCc2ccccc2C1 ZINC000029174831 847520999 /nfs/dbraw/zinc/52/09/99/847520999.db2.gz LXKCMTRYJVHHMF-FQEVSTJZSA-N 0 3 419.338 4.401 20 0 HIADHN O=C(NCc1ccc(OCC(F)(F)F)cc1)N[C@H](CN1CCCC1)c1ccccc1 ZINC000029727205 847610061 /nfs/dbraw/zinc/61/00/61/847610061.db2.gz MUWRSUKGWXVVBX-HXUWFJFHSA-N 0 3 421.463 4.264 20 0 HIADHN Cc1ccc(-c2cnc(CCC(=O)NCCCN3CCc4ccccc4C3)o2)cc1 ZINC000029841274 847631039 /nfs/dbraw/zinc/63/10/39/847631039.db2.gz AWRJXSMQODZCIF-UHFFFAOYSA-N 0 3 403.526 4.147 20 0 HIADHN CC[C@@H](CNC(=O)c1ccc(OC)c(Br)c1)N1CCc2ccccc2C1 ZINC000029910230 847647952 /nfs/dbraw/zinc/64/79/52/847647952.db2.gz KIWZGPYDZDFHQN-SFHVURJKSA-N 0 3 417.347 4.024 20 0 HIADHN CN(C)[C@H](CNc1c([N+](=O)[O-])cc(C(F)(F)F)cc1[N+](=O)[O-])c1cccs1 ZINC000029915570 847649859 /nfs/dbraw/zinc/64/98/59/847649859.db2.gz HGRMWFWKBQQPBG-GFCCVEGCSA-N 0 3 404.370 4.298 20 0 HIADHN CC(C)(CNC(=O)c1ccc(OCc2ccncc2)cc1)N1CCc2ccccc2C1 ZINC000030112111 847678834 /nfs/dbraw/zinc/67/88/34/847678834.db2.gz BHMHJIHPRHWUEG-UHFFFAOYSA-N 0 3 415.537 4.227 20 0 HIADHN CC(C)[C@H](CNC(=O)c1ccc(NC(=O)[C@@H]2C[C@@H]2C)cc1)N1CCc2ccccc2C1 ZINC000030637568 847749629 /nfs/dbraw/zinc/74/96/29/847749629.db2.gz PKGLEKJPUXYWIC-GLYQVZKVSA-N 0 3 419.569 4.094 20 0 HIADHN c1cnn(-c2cc(CNCc3cn(-c4ccccc4)nc3-c3ccccc3)ccn2)c1 ZINC000030901127 847794563 /nfs/dbraw/zinc/79/45/63/847794563.db2.gz QLRDUBIFKNGYDA-UHFFFAOYSA-N 0 3 406.493 4.410 20 0 HIADHN Cc1ccc(-c2cnc(CCC(=O)N[C@H]3CCCN(Cc4ccccc4)C3)o2)cc1 ZINC000031544455 847905213 /nfs/dbraw/zinc/90/52/13/847905213.db2.gz RNGSVYIHPXGDML-QFIPXVFZSA-N 0 3 403.526 4.363 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)CCNC(=O)c1ccc2ccccc2c1)c1ccsc1 ZINC000031983972 847974806 /nfs/dbraw/zinc/97/48/06/847974806.db2.gz CRMRXULJUOHTRF-QFIPXVFZSA-N 0 3 423.582 4.221 20 0 HIADHN CCc1ccc([C@H](CNC(=O)c2ccc(SCc3nc(C)no3)cc2)N(C)C)cc1 ZINC000032246322 847994213 /nfs/dbraw/zinc/99/42/13/847994213.db2.gz RVDJVILRBZYCPC-NRFANRHFSA-N 0 3 424.570 4.265 20 0 HIADHN Cc1ccc(C(=O)NC[C@H](c2ccccc2)N(C)C)cc1NC(=O)c1ccccc1F ZINC000032480437 848036369 /nfs/dbraw/zinc/03/63/69/848036369.db2.gz AJNJJGUBTGWBHC-HSZRJFAPSA-N 0 3 419.500 4.419 20 0 HIADHN CC[C@H](CNC(=O)CCCc1nnc(-c2ccccc2)o1)N1CCc2ccccc2C1 ZINC000032650067 848059854 /nfs/dbraw/zinc/05/98/54/848059854.db2.gz VRNBVNQERRCEPN-JOCHJYFZSA-N 0 3 418.541 4.012 20 0 HIADHN CCc1ccc([C@H](CNC(=O)Cc2csc(-c3cccc(F)c3)n2)N(C)C)cc1 ZINC000032733805 848069479 /nfs/dbraw/zinc/06/94/79/848069479.db2.gz OOKLBFIWLHRMKZ-NRFANRHFSA-N 0 3 411.546 4.473 20 0 HIADHN O=C(c1cc(CCc2ccccc2)ccc1[O-])N1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000436599374 861864114 /nfs/dbraw/zinc/86/41/14/861864114.db2.gz AVGQPUIXBJVDFF-URXFXBBRSA-N 0 3 404.554 4.266 20 0 HIADHN O=C(c1cc(CCc2ccccc2)ccc1[O-])N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000436599374 861864118 /nfs/dbraw/zinc/86/41/18/861864118.db2.gz AVGQPUIXBJVDFF-URXFXBBRSA-N 0 3 404.554 4.266 20 0 HIADHN CN1CCN(CCCNC(=O)c2cc(Cl)ccc2Cl)[C@@H](c2ccccc2)C1 ZINC000033135267 848112460 /nfs/dbraw/zinc/11/24/60/848112460.db2.gz BZZSYUJVGLJYQF-HXUWFJFHSA-N 0 3 406.357 4.102 20 0 HIADHN Cc1cc(O)c(C(C)C)cc1C(=O)Nc1ccc(C(=O)N(C)[C@H]2CCCN(C)C2)cc1 ZINC000436607039 861867797 /nfs/dbraw/zinc/86/77/97/861867797.db2.gz RBCDBOPGKVEHEL-FQEVSTJZSA-N 0 3 423.557 4.243 20 0 HIADHN N#CC(C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)c1ccccn1 ZINC000041493765 848221527 /nfs/dbraw/zinc/22/15/27/848221527.db2.gz FSGJJRHTDBODHG-HNNXBMFYSA-N 0 3 418.375 4.101 20 0 HIADHN CCOc1ccccc1C(=O)N1CCC[C@@H]1C(=O)C(C#N)c1nc2ccccc2s1 ZINC000041498155 848222299 /nfs/dbraw/zinc/22/22/99/848222299.db2.gz ZYDPBNGTAGQHCA-SJLPKXTDSA-N 0 3 419.506 4.176 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)CCSc3ccccc3)CC2)c1 ZINC000041867612 848259889 /nfs/dbraw/zinc/25/98/89/848259889.db2.gz NBBHFXGGTBOBEA-UHFFFAOYSA-N 0 3 411.615 4.196 20 0 HIADHN O=C(c1ccc(CNCc2cccc(OCc3ccccn3)c2)cc1)N1CCCC1 ZINC000042187204 848298560 /nfs/dbraw/zinc/29/85/60/848298560.db2.gz XTNDXYMSVXGENH-UHFFFAOYSA-N 0 3 401.510 4.186 20 0 HIADHN COc1cc(CN[C@@H](C)c2ccc3c(c2)OCO3)ccc1OCc1c(C)noc1C ZINC000042203057 848300451 /nfs/dbraw/zinc/30/04/51/848300451.db2.gz IVOTUOOUUYVFAG-AWEZNQCLSA-N 0 3 410.470 4.459 20 0 HIADHN COc1ccc(-c2nn(-c3ccccc3)cc2CNCc2ccc(N(C)C)nc2)cc1 ZINC000042227626 848305967 /nfs/dbraw/zinc/30/59/67/848305967.db2.gz UMVQQVGZVLKWNU-UHFFFAOYSA-N 0 3 413.525 4.299 20 0 HIADHN O=C(C(=O)N(CC[NH+]1CCCC1)Cc1ccc(Cl)c(Cl)c1)c1ccc([O-])cc1 ZINC000436688614 861893964 /nfs/dbraw/zinc/89/39/64/861893964.db2.gz OXEWPRBDKMGZFQ-UHFFFAOYSA-N 0 3 421.324 4.006 20 0 HIADHN COc1cc(OC)c(NC(=O)NC[C@H](c2cccs2)N2CCCC2)cc1Cl ZINC000043413809 848421418 /nfs/dbraw/zinc/42/14/18/848421418.db2.gz HCJLFDVYRKZNQF-OAHLLOKOSA-N 0 3 409.939 4.377 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCCCn3ccc4ccccc43)c(C)c2)CC1 ZINC000043522211 848434406 /nfs/dbraw/zinc/43/44/06/848434406.db2.gz LUYGRAUTQHROPW-UHFFFAOYSA-N 0 3 419.573 4.303 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3CCC[C@@H]3Cc3ccccc3)c(C)c2)CC1 ZINC000043522440 848436179 /nfs/dbraw/zinc/43/61/79/848436179.db2.gz RJYSZBZNXTUCLA-HSZRJFAPSA-N 0 3 406.574 4.376 20 0 HIADHN CC[N@@H+]1CCC[C@@H]1CNC(=S)Nc1ccc([O-])c(-c2nc3ccccc3s2)c1 ZINC000043563170 848439548 /nfs/dbraw/zinc/43/95/48/848439548.db2.gz LMNQNWYMOBQIHW-OAHLLOKOSA-N 0 3 412.584 4.440 20 0 HIADHN CC[N@H+]1CCC[C@@H]1CNC(=S)Nc1ccc([O-])c(-c2nc3ccccc3s2)c1 ZINC000043563170 848439554 /nfs/dbraw/zinc/43/95/54/848439554.db2.gz LMNQNWYMOBQIHW-OAHLLOKOSA-N 0 3 412.584 4.440 20 0 HIADHN CC(C)C(=O)Nc1ccc(NC(=O)NCC(C)(C)N2CCc3ccccc3C2)cc1 ZINC000043673620 848447825 /nfs/dbraw/zinc/44/78/25/848447825.db2.gz JUXHBSJCAIAGTF-UHFFFAOYSA-N 0 3 408.546 4.240 20 0 HIADHN CSc1ccc(NC(=O)NCCCCN2CCN(c3cccc(C)c3)CC2)cc1 ZINC000043856428 848479968 /nfs/dbraw/zinc/47/99/68/848479968.db2.gz YSTCCRNKRIDZNC-UHFFFAOYSA-N 0 3 412.603 4.441 20 0 HIADHN Cc1ccc(-c2cnc(CCC(=O)N3c4ccccc4CC[C@@H]3CN(C)C)o2)cc1 ZINC000436727048 861911334 /nfs/dbraw/zinc/91/13/34/861911334.db2.gz XUKYSVQLMLKFBN-OAQYLSRUSA-N 0 3 403.526 4.492 20 0 HIADHN Cc1cccc(C)c1NC(=S)NCCCCN1CCN(Cc2ccccc2)CC1 ZINC000044238512 848535377 /nfs/dbraw/zinc/53/53/77/848535377.db2.gz WNOQRVLWSPDPTQ-UHFFFAOYSA-N 0 3 410.631 4.188 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)Nc1cc(N2CCCC2=O)ccc1Cl ZINC000044243423 848536676 /nfs/dbraw/zinc/53/66/76/848536676.db2.gz ILLRSJZFUUDDTH-UHFFFAOYSA-N 0 3 414.937 4.063 20 0 HIADHN COc1ccc([C@@H](C)NC(=O)Nc2cccc(CN(C)C)c2)cc1Br ZINC000044293185 848540565 /nfs/dbraw/zinc/54/05/65/848540565.db2.gz JTFPRVLZTPYYCL-CYBMUJFWSA-N 0 3 406.324 4.402 20 0 HIADHN CN(C)c1ccc(NC(=O)NC[C@H](Cc2ccccc2)N(C)C)c(C(F)(F)F)c1 ZINC000044368986 848552569 /nfs/dbraw/zinc/55/25/69/848552569.db2.gz XTFUCJYYUZFDCP-KRWDZBQOSA-N 0 3 408.468 4.066 20 0 HIADHN CC1CCN([C@H](CNC(=O)c2cccc(Cn3ccnc3)c2)c2cccs2)CC1 ZINC000044867795 848611058 /nfs/dbraw/zinc/61/10/58/848611058.db2.gz QZXJPNHHHYGGBF-OAQYLSRUSA-N 0 3 408.571 4.196 20 0 HIADHN C[C@H]([NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1)c1cc(Br)cs1 ZINC000436741191 861924918 /nfs/dbraw/zinc/92/49/18/861924918.db2.gz SCKDEWBIRSLIMP-LBPRGKRZSA-N 0 3 409.349 4.172 20 0 HIADHN Cc1nc(-c2ccc(CNC(=O)N3CCCN(Cc4ccccc4)CC3)o2)cs1 ZINC000045276515 848658120 /nfs/dbraw/zinc/65/81/20/848658120.db2.gz RLPUEGCFRZUXQP-UHFFFAOYSA-N 0 3 410.543 4.129 20 0 HIADHN CCN(Cc1ccccc1NC(=O)NC[C@@H](c1cccs1)N1CCCC1)C(C)=O ZINC000045686158 848713543 /nfs/dbraw/zinc/71/35/43/848713543.db2.gz QBJHYHRYBTXTDM-FQEVSTJZSA-N 0 3 414.575 4.075 20 0 HIADHN O=C(Nc1ccccc1C(=O)NCCCN1CCc2ccccc2C1)c1ccsc1 ZINC000046362567 848832489 /nfs/dbraw/zinc/83/24/89/848832489.db2.gz FGHHKUDMOTVNMK-UHFFFAOYSA-N 0 3 419.550 4.179 20 0 HIADHN CCCN(Cc1nnc(-c2ccccc2Cl)o1)C(=O)NCCN1CCC(C)CC1 ZINC000046369548 848834467 /nfs/dbraw/zinc/83/44/67/848834467.db2.gz HKURRNDPEKJZBZ-UHFFFAOYSA-N 0 3 419.957 4.044 20 0 HIADHN COc1cc([C@@H](C)NC(=O)N(CCN(C)C)Cc2ccccc2)ccc1OC(C)C ZINC000046670305 848903782 /nfs/dbraw/zinc/90/37/82/848903782.db2.gz NYYUMFCJUJSNDO-LJQANCHMSA-N 0 3 413.562 4.317 20 0 HIADHN CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)c1ccc(C2SCCS2)cc1 ZINC000047010729 848972415 /nfs/dbraw/zinc/97/24/15/848972415.db2.gz FWXFCSJXFPDSMN-UHFFFAOYSA-N 0 3 411.596 4.241 20 0 HIADHN C[C@@H]1CCCN(CCNC(=O)c2ccc(Cl)c(NC(=O)c3cccs3)c2)C1 ZINC000047145630 848993189 /nfs/dbraw/zinc/99/31/89/848993189.db2.gz BXQZJMRPBVANEQ-CQSZACIVSA-N 0 3 405.951 4.116 20 0 HIADHN C[C@H](c1ccc(F)cc1)N1CCC(C(=O)Nc2ccc(Br)cn2)CC1 ZINC000047261942 849016801 /nfs/dbraw/zinc/01/68/01/849016801.db2.gz IFMIITZQTDATNT-CYBMUJFWSA-N 0 3 406.299 4.395 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)Nc1ccccc1OC(F)F ZINC000047347418 849030121 /nfs/dbraw/zinc/03/01/21/849030121.db2.gz PITBBAVWCWKVBB-UHFFFAOYSA-N 0 3 418.488 4.012 20 0 HIADHN N#CC(C(=O)CCNC(=O)C12CC3CC(CC(C3)C1)C2)c1ccc2ccccc2n1 ZINC000047375143 849034624 /nfs/dbraw/zinc/03/46/24/849034624.db2.gz UKGGOZQOXIOZSA-JQZCCEMDSA-N 0 3 401.510 4.134 20 0 HIADHN COc1ccc(-c2nc(C)c(C(=O)Nc3cccc(CN(C)C)c3)s2)cc1OC ZINC000047453658 849050635 /nfs/dbraw/zinc/05/06/35/849050635.db2.gz AGWHOBVNBYUQNC-UHFFFAOYSA-N 0 3 411.527 4.450 20 0 HIADHN COc1ccc(-c2nc(CC(=O)Nc3cccc(CN(C)C)c3)cs2)cc1OC ZINC000047453287 849051031 /nfs/dbraw/zinc/05/10/31/849051031.db2.gz FQNGJNBCIFEDLP-UHFFFAOYSA-N 0 3 411.527 4.070 20 0 HIADHN CN(C)Cc1cccc(NC(=O)c2cccc(OCc3cn4ccccc4n3)c2)c1 ZINC000047460490 849051808 /nfs/dbraw/zinc/05/18/08/849051808.db2.gz PKMMVLGBJFXHSG-UHFFFAOYSA-N 0 3 400.482 4.227 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1cccc(NC(=O)OC)c1)c1cccc(OC)c1 ZINC000047711828 849096123 /nfs/dbraw/zinc/09/61/23/849096123.db2.gz KJCIHXAXVWKOCS-HXUWFJFHSA-N 0 3 414.506 4.078 20 0 HIADHN CCCC(=O)Nc1cccc(CNC(=O)NC[C@H](c2cccs2)N2CCCC2)c1 ZINC000047951922 849143617 /nfs/dbraw/zinc/14/36/17/849143617.db2.gz RDTSXVYWOUPQJE-LJQANCHMSA-N 0 3 414.575 4.123 20 0 HIADHN Cc1ccc(NC(=O)C(C)C)cc1NC(=O)N(CCN(C)C)Cc1ccc(F)cc1 ZINC000048081731 849161404 /nfs/dbraw/zinc/16/14/04/849161404.db2.gz ATKVWJPXEKTKFX-UHFFFAOYSA-N 0 3 414.525 4.324 20 0 HIADHN CCOc1ccc(NC(=O)NCCCCN2CCN(c3ccccc3)CC2)c(C)c1 ZINC000048144491 849179087 /nfs/dbraw/zinc/17/90/87/849179087.db2.gz XDPKPMFEZZTUNI-UHFFFAOYSA-N 0 3 410.562 4.118 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)[C@@H](C)Sc3ccc(OC)cc3)c(C)c2)CC1 ZINC000048359737 849210441 /nfs/dbraw/zinc/21/04/41/849210441.db2.gz ZITKBTSWHBTULY-GOSISDBHSA-N 0 3 413.587 4.265 20 0 HIADHN CC[C@@H](NCc1ccc(-n2cccn2)cc1)c1ccccc1OCC(=O)N1CCCC1 ZINC000048750549 849264184 /nfs/dbraw/zinc/26/41/84/849264184.db2.gz LBEVAJWZCCTVIN-HSZRJFAPSA-N 0 3 418.541 4.114 20 0 HIADHN C[C@@H](SCC(=O)Nc1ccc(F)cc1)C(=O)C(C#N)c1nc2ccccc2s1 ZINC000048823178 849271912 /nfs/dbraw/zinc/27/19/12/849271912.db2.gz GSWYRTALEXPYOU-IUODEOHRSA-N 0 3 413.499 4.372 20 0 HIADHN CCNC(=O)c1ccc(NC(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)cc1 ZINC000049790165 849330303 /nfs/dbraw/zinc/33/03/03/849330303.db2.gz NGFKPXJBQMMEFA-LJQANCHMSA-N 0 3 414.575 4.093 20 0 HIADHN COC(=O)Cc1ccc(NC(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)cc1 ZINC000049790144 849330394 /nfs/dbraw/zinc/33/03/94/849330394.db2.gz SGKHSFWDYZZOMH-IBGZPJMESA-N 0 3 415.559 4.058 20 0 HIADHN CCN(CCn1c(C)csc1=O)Cc1ccc(OCc2cccs2)c(OC)c1 ZINC000050275082 849365993 /nfs/dbraw/zinc/36/59/93/849365993.db2.gz NPIWRPFTPXLNFP-UHFFFAOYSA-N 0 3 418.584 4.389 20 0 HIADHN C[C@@H]([NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1)c1ccc(F)cc1Br ZINC000436833403 862011757 /nfs/dbraw/zinc/01/17/57/862011757.db2.gz YMJUPKHGRRVVIC-CYBMUJFWSA-N 0 3 421.310 4.249 20 0 HIADHN C[C@H]([NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1)c1ccc(-c2ccncc2)cc1 ZINC000436832374 862012567 /nfs/dbraw/zinc/01/25/67/862012567.db2.gz VDIJMGJXINYYPH-SFHVURJKSA-N 0 3 401.510 4.410 20 0 HIADHN N#CC(C(=O)CCN1c2ccccc2Sc2ccccc21)C(=O)NC1CCCC1 ZINC000051652331 849499350 /nfs/dbraw/zinc/49/93/50/849499350.db2.gz NIQQRUWLEYAKFL-QGZVFWFLSA-N 0 3 405.523 4.447 20 0 HIADHN CC(=O)N[C@H](C(=O)C(C#N)c1nc2cc(C(F)(F)F)ccc2s1)C1CCCC1 ZINC000051677669 849502723 /nfs/dbraw/zinc/50/27/23/849502723.db2.gz RUQPRASQFCYLDH-CJNGLKHVSA-N 0 3 409.433 4.186 20 0 HIADHN COc1ccccc1CN(CCC(=O)Nc1ccccc1Cl)C[C@H]1CCCO1 ZINC000051799713 849517358 /nfs/dbraw/zinc/51/73/58/849517358.db2.gz ATAZDJKBQGXPFQ-GOSISDBHSA-N 0 3 402.922 4.358 20 0 HIADHN FC(F)(F)c1cc(NC[C@H](c2cccc(Cl)c2)N2CCCC2)n2ncnc2n1 ZINC000052011595 849537964 /nfs/dbraw/zinc/53/79/64/849537964.db2.gz QOIMBFVVUSFMKW-CQSZACIVSA-N 0 3 410.831 4.046 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)c3ccccc3Oc3cccnc3)cc2)CC1 ZINC000052026647 849542922 /nfs/dbraw/zinc/54/29/22/849542922.db2.gz BWKFLLMMLQYVBN-UHFFFAOYSA-N 0 3 416.525 4.264 20 0 HIADHN O=C(CN[C@H](c1ccc(Cl)cc1)C1CC1)NCC1(c2ccccc2)CCOCC1 ZINC000052515406 849591123 /nfs/dbraw/zinc/59/11/23/849591123.db2.gz AHLSKFLSMJBJKG-QHCPKHFHSA-N 0 3 412.961 4.245 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)c3c(C)onc3-c3ccccc3)cc2)CC1 ZINC000052875681 849636981 /nfs/dbraw/zinc/63/69/81/849636981.db2.gz RWFRLCFENALPRZ-UHFFFAOYSA-N 0 3 404.514 4.040 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cccc(NC(=O)c2ccco2)c1)c1ccsc1 ZINC000052877950 849637505 /nfs/dbraw/zinc/63/75/05/849637505.db2.gz CGHPDNUPHRZRHC-LJQANCHMSA-N 0 3 411.527 4.406 20 0 HIADHN CCN(CC)[C@H](CNC(=O)[C@H](C)Sc1ccc(NC(C)=O)cc1)c1ccsc1 ZINC000052877960 849638480 /nfs/dbraw/zinc/63/84/80/849638480.db2.gz ZKDJWUGQVMSGHT-MGPUTAFESA-N 0 3 419.616 4.386 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1ccc(NC(=O)NC(C)C)cc1)c1ccsc1 ZINC000052877953 849638854 /nfs/dbraw/zinc/63/88/54/849638854.db2.gz MTSXTMFWXHRWKC-IBGZPJMESA-N 0 3 402.564 4.091 20 0 HIADHN CC(=O)Nc1cc(C(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)ccc1F ZINC000052959583 849650390 /nfs/dbraw/zinc/65/03/90/849650390.db2.gz QCTWPFYQIDSITC-LJQANCHMSA-N 0 3 403.523 4.049 20 0 HIADHN COc1cccc(CN2CCC(NC(=O)Cn3ccc4ccc(Cl)cc43)CC2)c1 ZINC000053120342 849668564 /nfs/dbraw/zinc/66/85/64/849668564.db2.gz YXJKRJJAGRKJLF-UHFFFAOYSA-N 0 3 411.933 4.084 20 0 HIADHN CN(C)Cc1cccc(NC(=O)[C@@H]2CCN(c3cc(Cl)ccc3Cl)C2=O)c1 ZINC000053477350 849718211 /nfs/dbraw/zinc/71/82/11/849718211.db2.gz OPWQHIKOYFLUGQ-INIZCTEOSA-N 0 3 406.313 4.047 20 0 HIADHN O=C(Nc1ccc(N2CCN(Cc3ccccc3)CC2)cc1)c1ccc2[nH]cnc2c1 ZINC000053523871 849726940 /nfs/dbraw/zinc/72/69/40/849726940.db2.gz IDFAITWQOPIAGR-UHFFFAOYSA-N 0 3 411.509 4.137 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N1CCN(c2ccccc2Cl)CC1 ZINC000053540824 849728578 /nfs/dbraw/zinc/72/85/78/849728578.db2.gz GYVGGMBINBQCOZ-LJQANCHMSA-N 0 3 418.994 4.070 20 0 HIADHN Cc1nc(-c2ccc(CNC(=O)NC[C@@H](c3cccs3)N3CCCC3)o2)cs1 ZINC000054044460 849804388 /nfs/dbraw/zinc/80/43/88/849804388.db2.gz DBGBBEPNSXOVBJ-KRWDZBQOSA-N 0 3 416.572 4.409 20 0 HIADHN COc1ccc(Br)c(C(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)c1 ZINC000054227212 849829999 /nfs/dbraw/zinc/82/99/99/849829999.db2.gz JGFGMWXLQNQENC-ZBFHGGJFSA-N 0 3 403.320 4.023 20 0 HIADHN Cc1cc(C(=O)NC(C)C)ccc1NC(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000054450345 849870448 /nfs/dbraw/zinc/87/04/48/849870448.db2.gz QHZQYZCCSWWOEA-GHTZIAJQSA-N 0 3 408.546 4.090 20 0 HIADHN CC[C@@H](C)NC(=O)c1ccc(NC(=O)NC[C@@H](c2ccccc2)N2CCCC2)cc1 ZINC000054478310 849875327 /nfs/dbraw/zinc/87/53/27/849875327.db2.gz PHKVCNXFIKOTET-GCJKJVERSA-N 0 3 408.546 4.174 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)N(Cc1ccccc1)C[C@@H]1CCCO1 ZINC000054541889 849886191 /nfs/dbraw/zinc/88/61/91/849886191.db2.gz YLDPXGWIYAFQOI-SFTDATJTSA-N 0 3 413.587 4.276 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)N(C)Cc2ccccc2N2CCCC2)C1 ZINC000054718919 849912510 /nfs/dbraw/zinc/91/25/10/849912510.db2.gz XUZXBJXUVMCALE-REWPJTCUSA-N 0 3 406.574 4.264 20 0 HIADHN COc1cc(-c2noc(-c3cc4ccccc4cc3[O-])n2)ccc1OCC[NH+](C)C ZINC000436900166 862076293 /nfs/dbraw/zinc/07/62/93/862076293.db2.gz HGRLAXXBRBYUDW-UHFFFAOYSA-N 0 3 405.454 4.211 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)CCc3ccc(OC)c(Cl)c3)c(C)c2)CC1 ZINC000055310764 849998139 /nfs/dbraw/zinc/99/81/39/849998139.db2.gz UJBLDVZDFBPESH-UHFFFAOYSA-N 0 3 415.965 4.370 20 0 HIADHN Cc1cc(NC(=O)c2ccccc2Cl)sc1C(=O)NCCN1CCC[C@@H](C)C1 ZINC000055377534 850009712 /nfs/dbraw/zinc/00/97/12/850009712.db2.gz UQGDPRYDRAKLLU-CQSZACIVSA-N 0 3 419.978 4.424 20 0 HIADHN C[C@@H](OC[C@@H](O)CN1CCC(C(=O)c2ccccc2)CC1)c1ccc(Cl)cc1 ZINC000055471978 850033168 /nfs/dbraw/zinc/03/31/68/850033168.db2.gz RXNQIBAVVPHASO-VGSWGCGISA-N 0 3 401.934 4.373 20 0 HIADHN CC(=O)Nc1ccc(CNCc2cn(Cc3ccccc3)nc2-c2cccnc2)cc1 ZINC000055472755 850034514 /nfs/dbraw/zinc/03/45/14/850034514.db2.gz KAYCBTMZRORMHL-UHFFFAOYSA-N 0 3 411.509 4.242 20 0 HIADHN CCN1CCN(c2ccc(N[C@H](C)C(=O)Nc3cccc(Cl)c3)c(C)c2)CC1 ZINC000056170175 850267794 /nfs/dbraw/zinc/26/77/94/850267794.db2.gz VMKHHHFXDXWZLK-QGZVFWFLSA-N 0 3 400.954 4.229 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(NC(=O)c2ccc(F)cc2)cc1)C(=O)N1CCC(C)CC1 ZINC000056207178 850284019 /nfs/dbraw/zinc/28/40/19/850284019.db2.gz UFADYNFGZMNUNX-ZWKOTPCHSA-N 0 3 411.521 4.376 20 0 HIADHN C[C@@H](C[NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1)c1ccc(C(F)(F)F)cc1 ZINC000436934419 862112959 /nfs/dbraw/zinc/11/29/59/862112959.db2.gz GNIKOEFWLXKVMB-HNNXBMFYSA-N 0 3 406.448 4.409 20 0 HIADHN CC(C)COC1CCN(C(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)CC1 ZINC000056360515 850333603 /nfs/dbraw/zinc/33/36/03/850333603.db2.gz UNNILQIKAGLBKC-HXUWFJFHSA-N 0 3 407.624 4.368 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N(Cc1ccco1)C[C@H]1CCCO1)c1ccsc1 ZINC000056623737 850418677 /nfs/dbraw/zinc/41/86/77/850418677.db2.gz KWVSLRFFEXBEFZ-WOJBJXKFSA-N 0 3 405.564 4.115 20 0 HIADHN CC(=O)Nc1ccc(Cl)c(NC(=O)NCC(C)(C)N2CCc3ccccc3C2)c1 ZINC000056692332 850442046 /nfs/dbraw/zinc/44/20/46/850442046.db2.gz WQDVJDMMZRFITD-UHFFFAOYSA-N 0 3 414.937 4.257 20 0 HIADHN CCOc1ccc([C@H](C)NC(=O)N(CCN(C)C)Cc2ccc(F)cc2)cc1OC ZINC000056881113 850508911 /nfs/dbraw/zinc/50/89/11/850508911.db2.gz PTYHHSXIYXYUGS-KRWDZBQOSA-N 0 3 417.525 4.067 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)[C@H](C)Cc1ccccc1 ZINC000436959528 862141192 /nfs/dbraw/zinc/14/11/92/862141192.db2.gz AGVFGVLEDDBJQE-AUSIDOKSSA-N 0 3 402.542 4.456 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)C1(c2ccc(Cl)cc2)CCOCC1 ZINC000057192567 850576002 /nfs/dbraw/zinc/57/60/02/850576002.db2.gz SQVNHMVPBQKWPO-QFIPXVFZSA-N 0 3 412.961 4.342 20 0 HIADHN CCN(CC)[C@H](CNC(=O)C1(c2ccccc2C)CCOCC1)c1ccsc1 ZINC000057432934 850636727 /nfs/dbraw/zinc/63/67/27/850636727.db2.gz PRMCQFCJTINNKC-OAQYLSRUSA-N 0 3 400.588 4.304 20 0 HIADHN CCC(=O)Nc1ccc(C)c(NC(=O)NC[C@@H](c2ccc(OC)cc2)N2CCCC2)c1 ZINC000057542472 850663909 /nfs/dbraw/zinc/66/39/09/850663909.db2.gz MMNFYFBLIDXCHD-QFIPXVFZSA-N 0 3 424.545 4.311 20 0 HIADHN Cc1ccc(NC(=O)C2CC2)cc1NC(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000057543444 850665016 /nfs/dbraw/zinc/66/50/16/850665016.db2.gz SJIVQVRYNZHTBA-LJQANCHMSA-N 0 3 412.559 4.364 20 0 HIADHN CCN(CC)C(=O)C1CC[NH+](Cc2c([O-])ccc3cc(Br)ccc32)CC1 ZINC000058539715 850849815 /nfs/dbraw/zinc/84/98/15/850849815.db2.gz CVEQWDAAFDCHKY-UHFFFAOYSA-N 0 3 419.363 4.388 20 0 HIADHN CCCOC(=O)c1ccc(NC(=O)NC[C@@H](c2cccs2)N2CCCC2)cc1 ZINC000059039238 850982186 /nfs/dbraw/zinc/98/21/86/850982186.db2.gz XQXKXMAYMVKNHS-SFHVURJKSA-N 0 3 401.532 4.274 20 0 HIADHN CCN(C[C@H]1COc2ccccc2O1)C(=O)NC[C@H](c1ccsc1)N(CC)CC ZINC000059308178 850995229 /nfs/dbraw/zinc/99/52/29/850995229.db2.gz GRKNMLYULJOUTE-RBUKOAKNSA-N 0 3 417.575 4.003 20 0 HIADHN Cc1ccc([C@H](CC(=O)OC(C)C)NC(=O)c2cccc(CN3CCCC3)c2)cc1 ZINC000059951459 851027576 /nfs/dbraw/zinc/02/75/76/851027576.db2.gz KQVQENLIWXOLRC-QHCPKHFHSA-N 0 3 408.542 4.404 20 0 HIADHN COc1ccc(-c2nc(C(=O)N[C@H]3CCN([C@H](C)c4ccccc4)C3)cs2)cc1 ZINC000059989738 851029728 /nfs/dbraw/zinc/02/97/28/851029728.db2.gz MLLPRZCUGFYJOB-APWZRJJASA-N 0 3 407.539 4.384 20 0 HIADHN CCOc1ccc(C(=O)CCC(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000060159699 851046746 /nfs/dbraw/zinc/04/67/46/851046746.db2.gz GAFRNTZLJSKNIP-OAQYLSRUSA-N 0 3 408.542 4.077 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)C2(c3cccc(Br)c3)CC2)N(C)C)cc1 ZINC000060155839 851047073 /nfs/dbraw/zinc/04/70/73/851047073.db2.gz RDKJPQKXEMQUKN-LJQANCHMSA-N 0 3 401.348 4.208 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)[C@H]1C[C@@H]1c1ccc(Br)cc1 ZINC000060300072 851060305 /nfs/dbraw/zinc/06/03/05/851060305.db2.gz LTWPIEPJZLGMPF-RTWAWAEBSA-N 0 3 413.359 4.117 20 0 HIADHN COc1cc(Br)ccc1CN[C@@H](CCn1cncn1)c1ccc(C)cc1 ZINC000437020408 862201838 /nfs/dbraw/zinc/20/18/38/862201838.db2.gz VTTYKZZVJFWIBE-IBGZPJMESA-N 0 3 415.335 4.279 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2cc(Br)cnc2Cl)N2CCCC2)cc1 ZINC000060359152 851077244 /nfs/dbraw/zinc/07/72/44/851077244.db2.gz FSOTVDSDTGTLGK-QGZVFWFLSA-N 0 3 422.754 4.373 20 0 HIADHN O=C(c1ccc(Cl)cc1)C1CCN(C[C@H](O)COCc2ccccc2Cl)CC1 ZINC000060523126 851132754 /nfs/dbraw/zinc/13/27/54/851132754.db2.gz NNOXQALOWKPAHC-FQEVSTJZSA-N 0 3 422.352 4.466 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N(C)Cc2ccc(SC)c(OC)c2)N(C)C)cc1 ZINC000060531896 851136502 /nfs/dbraw/zinc/13/65/02/851136502.db2.gz DLUGRNSANPXYDD-FQEVSTJZSA-N 0 3 415.603 4.424 20 0 HIADHN O=C(COc1ccccc1CNCCSc1ccc(Cl)cc1)N1CCCC1 ZINC000061016173 851274407 /nfs/dbraw/zinc/27/44/07/851274407.db2.gz UHWZPJCOHAHBEI-UHFFFAOYSA-N 0 3 404.963 4.223 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N[C@@H](c3ccccc3)c3ccncc3)cc2)CC1 ZINC000061133034 851300437 /nfs/dbraw/zinc/30/04/37/851300437.db2.gz MTJSLXXXZFKLOW-VWLOTQADSA-N 0 3 414.553 4.131 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)Nc3nnc(-c4ccsc4)s3)cc2)CC1 ZINC000061189368 851313531 /nfs/dbraw/zinc/31/35/31/851313531.db2.gz XCOABBYOBBSLFF-UHFFFAOYSA-N 0 3 413.572 4.049 20 0 HIADHN CC(C)Oc1ncccc1CNC(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1 ZINC000061191057 851313714 /nfs/dbraw/zinc/31/37/14/851313714.db2.gz PXLKYFWEKXVXBW-IBGZPJMESA-N 0 3 416.591 4.203 20 0 HIADHN CN(C)CCN(C(=O)CSCc1cc(-c2cccs2)on1)C1CCCCC1 ZINC000061198769 851316092 /nfs/dbraw/zinc/31/60/92/851316092.db2.gz XSYNHSGWBFYJOG-UHFFFAOYSA-N 0 3 407.605 4.359 20 0 HIADHN O=C(COc1ccccc1C(F)(F)F)Nc1ccc(CCN2CCSCC2)cc1 ZINC000061287961 851339888 /nfs/dbraw/zinc/33/98/88/851339888.db2.gz ZMZDQNNOIGOABM-UHFFFAOYSA-N 0 3 424.488 4.314 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)c1ccc(Br)cc1F ZINC000061288615 851340015 /nfs/dbraw/zinc/34/00/15/851340015.db2.gz VSJAHZMABFDQHF-UHFFFAOYSA-N 0 3 423.351 4.432 20 0 HIADHN CC(C)C(=O)Nc1ccc(C(=O)Nc2ccc(CCN3CCSCC3)cc2)cc1 ZINC000061287976 851340202 /nfs/dbraw/zinc/34/02/02/851340202.db2.gz LPHDYOPJMCPRDW-UHFFFAOYSA-N 0 3 411.571 4.125 20 0 HIADHN CCOC(=O)/C=C/c1ccc(NC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000061376008 851359872 /nfs/dbraw/zinc/35/98/72/851359872.db2.gz ARNSMZUQWFWHRW-GLBTYYSXSA-N 0 3 407.514 4.049 20 0 HIADHN CC[C@@H](CNC(=O)Cc1ccc(OC(F)(F)F)cc1)N1CCc2ccccc2C1 ZINC000061498568 851390442 /nfs/dbraw/zinc/39/04/42/851390442.db2.gz GEAYCUNOCDBRNM-IBGZPJMESA-N 0 3 406.448 4.081 20 0 HIADHN C[C@H](COc1cccc(F)c1)NC(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000061791198 851453742 /nfs/dbraw/zinc/45/37/42/851453742.db2.gz UAYQFYANBIMCQF-QGZVFWFLSA-N 0 3 417.550 4.006 20 0 HIADHN O=C(NCc1ccc(OC(F)F)cc1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000061793218 851455641 /nfs/dbraw/zinc/45/56/41/851455641.db2.gz IMBGFTRLZPPGRK-UHFFFAOYSA-N 0 3 421.513 4.201 20 0 HIADHN CCn1c2ccccc2c2cc(NC(=O)C(=O)NCC(C)(C)N3CCCCC3)ccc21 ZINC000061866005 851463265 /nfs/dbraw/zinc/46/32/65/851463265.db2.gz JJPNQJZESFPZLK-UHFFFAOYSA-N 0 3 420.557 4.134 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)N[C@H]1CCSc2c(F)cccc21 ZINC000062005642 851491654 /nfs/dbraw/zinc/49/16/54/851491654.db2.gz PQXUADXQIIHYKH-KRWDZBQOSA-N 0 3 409.596 4.023 20 0 HIADHN Cc1nn(-c2cccc(C(F)(F)F)c2)c(Cl)c1CNC[C@H](C)Cn1ccnc1 ZINC000062254420 851517648 /nfs/dbraw/zinc/51/76/48/851517648.db2.gz SJRRTTFTLLCNLV-ZDUSSCGKSA-N 0 3 411.859 4.475 20 0 HIADHN CC(C)n1ncc2cc(NC(=O)N(CCN(C)C)Cc3cccc(Cl)c3)cnc21 ZINC000062390592 851539465 /nfs/dbraw/zinc/53/94/65/851539465.db2.gz ZGMQNZLLOPHZEI-UHFFFAOYSA-N 0 3 414.941 4.261 20 0 HIADHN COC(=O)c1cc(NC(=O)N(CCN(C)C)Cc2cccc(Cl)c2)ccc1Cl ZINC000062391001 851539637 /nfs/dbraw/zinc/53/96/37/851539637.db2.gz SGYAZTWSHWALCT-UHFFFAOYSA-N 0 3 424.328 4.376 20 0 HIADHN COC(=O)Nc1cccc(NC(=O)N(CCN(C)C)Cc2cccc(Cl)c2)c1 ZINC000062400659 851542158 /nfs/dbraw/zinc/54/21/58/851542158.db2.gz ORQFZVQQRAXZSG-UHFFFAOYSA-N 0 3 404.898 4.114 20 0 HIADHN COc1cc(CN[C@H](C)c2cccc(NS(C)(=O)=O)c2)ccc1OCCC(C)C ZINC000062421290 851549524 /nfs/dbraw/zinc/54/95/24/851549524.db2.gz GPIHNVHLEUZEBU-QGZVFWFLSA-N 0 3 420.575 4.342 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)NCc1nc2ccccc2s1 ZINC000062473432 851558654 /nfs/dbraw/zinc/55/86/54/851558654.db2.gz UTJMQJUTFRGUQC-UHFFFAOYSA-N 0 3 402.951 4.223 20 0 HIADHN COc1ccccc1CCNC(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1 ZINC000062475063 851559103 /nfs/dbraw/zinc/55/91/03/851559103.db2.gz RTXAVSFVMQCLBY-UHFFFAOYSA-N 0 3 423.479 4.030 20 0 HIADHN CCOc1cccc(CNC(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)c1 ZINC000062484871 851562376 /nfs/dbraw/zinc/56/23/76/851562376.db2.gz OKJQIEYOBIQQGN-UHFFFAOYSA-N 0 3 423.479 4.378 20 0 HIADHN COc1ccc(CC[C@@H](C)NC(=O)N(CCN(C)C)Cc2ccc(F)cc2F)cc1 ZINC000062503233 851566405 /nfs/dbraw/zinc/56/64/05/851566405.db2.gz SSIANNMGCCTPGC-QGZVFWFLSA-N 0 3 419.516 4.068 20 0 HIADHN CC(C)COc1ccccc1CNC(=O)N(CCN(C)C)Cc1ccc(F)c(F)c1 ZINC000062499279 851566516 /nfs/dbraw/zinc/56/65/16/851566516.db2.gz HGYOMBYGXDRUGG-UHFFFAOYSA-N 0 3 419.516 4.273 20 0 HIADHN O=C(CCc1ccc(Br)cc1F)NCCCN1CCc2ccccc2C1 ZINC000062878672 851595464 /nfs/dbraw/zinc/59/54/64/851595464.db2.gz CIUPMUCAXOCYHI-UHFFFAOYSA-N 0 3 419.338 4.085 20 0 HIADHN Fc1ccccc1CSCCNC(=S)NC1CCN(Cc2ccccc2)CC1 ZINC000063145003 851619869 /nfs/dbraw/zinc/61/98/69/851619869.db2.gz JMURIDFBBPPRDT-UHFFFAOYSA-N 0 3 417.619 4.188 20 0 HIADHN Cc1ccc(CSCCNC(=S)NC2CCN(Cc3ccccc3)CC2)cc1 ZINC000063144991 851620259 /nfs/dbraw/zinc/62/02/59/851620259.db2.gz TWHMGGBQOLVWDT-UHFFFAOYSA-N 0 3 413.656 4.357 20 0 HIADHN CCOC(=O)c1sc(NC(=S)NC2CCN(Cc3ccccc3)CC2)cc1C ZINC000063143039 851620422 /nfs/dbraw/zinc/62/04/22/851620422.db2.gz TVSPPYSESGRFPV-UHFFFAOYSA-N 0 3 417.600 4.184 20 0 HIADHN COc1ccc(F)cc1[C@@H](C)NC(=S)NC1CCN(Cc2ccccc2)CC1 ZINC000063149574 851623653 /nfs/dbraw/zinc/62/36/53/851623653.db2.gz SZGZAEVEMUMRJD-MRXNPFEDSA-N 0 3 401.551 4.024 20 0 HIADHN CN(C(=O)c1ccc(NC(=S)NC2CCN(C)CC2)cc1Cl)C1CCCCC1 ZINC000063149865 851623777 /nfs/dbraw/zinc/62/37/77/851623777.db2.gz JANJOWBCKMNKHN-UHFFFAOYSA-N 0 3 423.026 4.125 20 0 HIADHN COc1cc(CNCc2cccc(Cl)c2)cc(I)c1OC ZINC000063312783 851657671 /nfs/dbraw/zinc/65/76/71/851657671.db2.gz KGDGBVZTZDKLEK-UHFFFAOYSA-N 0 3 417.674 4.252 20 0 HIADHN CC(=O)Nc1cccc(CNCc2ccc(OCc3cn4cccc(C)c4n3)cc2)c1 ZINC000063313248 851658796 /nfs/dbraw/zinc/65/87/96/851658796.db2.gz KKCAMQNVKIAUKK-UHFFFAOYSA-N 0 3 414.509 4.470 20 0 HIADHN Clc1ccccc1[C@H](CNCc1ccccc1OCC1CC1)N1CCOCC1 ZINC000063510583 851706611 /nfs/dbraw/zinc/70/66/11/851706611.db2.gz CPBUANSUIDHHNI-QFIPXVFZSA-N 0 3 400.950 4.292 20 0 HIADHN CC(C)N(C)S(=O)(=O)c1ccc(CNCc2ccc(C(F)(F)F)cc2)cc1 ZINC000063546359 851711725 /nfs/dbraw/zinc/71/17/25/851711725.db2.gz JYDNOGQYHFXPDL-UHFFFAOYSA-N 0 3 400.466 4.024 20 0 HIADHN Cc1ccc(-n2ncc(C(=O)N3CCCN(C(C)(C)C)CC3)c2C(F)(F)F)cc1 ZINC000063723282 851748703 /nfs/dbraw/zinc/74/87/03/851748703.db2.gz VNYHTVJMRIIJKX-UHFFFAOYSA-N 0 3 408.468 4.146 20 0 HIADHN C[C@@H](NC(=S)N(CCN(C)C)Cc1ccc(Br)cc1)c1ccccc1 ZINC000063790038 851764893 /nfs/dbraw/zinc/76/48/93/851764893.db2.gz YSKCYROPNQFMQH-MRXNPFEDSA-N 0 3 420.420 4.448 20 0 HIADHN CCCC(=O)Nc1ccc(CNC(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)cc1 ZINC000064237469 851855455 /nfs/dbraw/zinc/85/54/55/851855455.db2.gz YELWBLPRHUTCRL-QHCPKHFHSA-N 0 3 422.573 4.370 20 0 HIADHN Cc1ccc2c(c1)[C@@H]1CN(C)CC[C@H]1N2C(=O)c1cnn(-c2ccccc2Cl)c1 ZINC000064386521 851884799 /nfs/dbraw/zinc/88/47/99/851884799.db2.gz MQIYZLAUEQFJEJ-GHTZIAJQSA-N 0 3 406.917 4.282 20 0 HIADHN O=C(c1cccc(Cl)c1)N1CCCN(CCCOCCc2ccccc2)CC1 ZINC000064482330 851910408 /nfs/dbraw/zinc/91/04/08/851910408.db2.gz ZNECZYOKJKMDTQ-UHFFFAOYSA-N 0 3 400.950 4.137 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)[C@H]1C[C@H]1c1cccc(Cl)c1 ZINC000064489321 851912695 /nfs/dbraw/zinc/91/26/95/851912695.db2.gz GCRBBAVOMJDTOJ-GOTSBHOMSA-N 0 3 411.977 4.162 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)[C@H]1C[C@H]1c1cccc(Br)c1 ZINC000064497684 851913626 /nfs/dbraw/zinc/91/36/26/851913626.db2.gz NGIONQGHEWSGAQ-PMACEKPBSA-N 0 3 419.338 4.282 20 0 HIADHN C[C@H](c1ccc(OC(F)(F)F)cc1)N1CCN(CCCOCC(F)(F)F)CC1 ZINC000064517989 851917695 /nfs/dbraw/zinc/91/76/95/851917695.db2.gz OVLHHNNGHPHOAU-CQSZACIVSA-N 0 3 414.390 4.233 20 0 HIADHN CCOc1ccc(NC(=O)NC[C@@H](Cc2ccccc2)N(C)C)c(C(F)(F)F)c1 ZINC000064564591 851931821 /nfs/dbraw/zinc/93/18/21/851931821.db2.gz UYAMOVCAUPGPOZ-MRXNPFEDSA-N 0 3 409.452 4.399 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2ccc(N3C[C@H](C)O[C@@H](C)C3)cc2)N(C)C)cc1 ZINC000064716310 851965674 /nfs/dbraw/zinc/96/56/74/851965674.db2.gz MWJRWKOCTBJVLE-YDHSSHFGSA-N 0 3 410.562 4.033 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cnc2n[nH]c(C)c2c1)c1ccc(C(F)(F)F)cc1 ZINC000065121657 852071146 /nfs/dbraw/zinc/07/11/46/852071146.db2.gz JGMKLTRDGUWTLK-SFHVURJKSA-N 0 3 419.451 4.098 20 0 HIADHN CCOc1c(Cl)cc(C(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)cc1OC ZINC000065140981 852076137 /nfs/dbraw/zinc/07/61/37/852076137.db2.gz BFSYGCHIIZULRO-YJBOKZPZSA-N 0 3 402.922 4.313 20 0 HIADHN Cc1c2ccc(C(F)(F)F)nc2sc1C(=O)NCCN(C)Cc1ccccc1 ZINC000065418264 852125652 /nfs/dbraw/zinc/12/56/52/852125652.db2.gz BIVYAPMJZWVZEI-UHFFFAOYSA-N 0 3 407.461 4.485 20 0 HIADHN COc1cc(OC)cc(Oc2ccc(CNCc3ccc(-n4ccnc4)nc3)cc2)c1 ZINC000065428714 852128744 /nfs/dbraw/zinc/12/87/44/852128744.db2.gz PPBFKUGBZWKNNI-UHFFFAOYSA-N 0 3 416.481 4.367 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)Nc2ccccc2C(=O)N2CCCCC2)C1 ZINC000065438504 852133061 /nfs/dbraw/zinc/13/30/61/852133061.db2.gz GZMUNRKSDWKQCX-FPOVZHCZSA-N 0 3 420.557 4.270 20 0 HIADHN CCN(CC)C(=O)Cc1ccc(NC(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)cc1 ZINC000065443122 852135283 /nfs/dbraw/zinc/13/52/83/852135283.db2.gz NAMGBQXSSXZIEF-AUSIDOKSSA-N 0 3 422.573 4.055 20 0 HIADHN CCOC(=O)N(C)c1ccc(NC(=O)N2CCCN(Cc3ccccc3C)CC2)cc1 ZINC000065472259 852147648 /nfs/dbraw/zinc/14/76/48/852147648.db2.gz WPFJVWCFUGHDSW-UHFFFAOYSA-N 0 3 424.545 4.328 20 0 HIADHN COc1cccc(CN2CCC(NC(=O)CCSc3ccc(F)cc3)CC2)c1 ZINC000065506179 852160613 /nfs/dbraw/zinc/16/06/13/852160613.db2.gz ZSZBJRYUCHJNOF-UHFFFAOYSA-N 0 3 402.535 4.097 20 0 HIADHN COc1ccc2[nH]cc(C3=CCN(C(=O)NCCN(C)Cc4ccccc4)CC3)c2c1 ZINC000065542269 852171459 /nfs/dbraw/zinc/17/14/59/852171459.db2.gz MERXTZFRLKIRQA-UHFFFAOYSA-N 0 3 418.541 4.107 20 0 HIADHN O=C([C@H]1CCCN(Cc2cccc(F)c2)C1)N1CC=C(c2c[nH]c3ncccc23)CC1 ZINC000065609357 852198617 /nfs/dbraw/zinc/19/86/17/852198617.db2.gz PPDYXLMTUPPOJX-FQEVSTJZSA-N 0 3 418.516 4.230 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)NCCCO[C@H](C)c3ccccc3)cc2)CC1 ZINC000065742412 852240836 /nfs/dbraw/zinc/24/08/36/852240836.db2.gz HWGYRUCWHWCBBK-OAQYLSRUSA-N 0 3 409.574 4.115 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)CCOc2cccc(Br)c2)C1 ZINC000065826977 852270643 /nfs/dbraw/zinc/27/06/43/852270643.db2.gz IQWLOBRMSFGRCE-APWZRJJASA-N 0 3 417.347 4.170 20 0 HIADHN CN1CCN(c2ccc(CNCc3ccc(Oc4cc(F)cc(F)c4)cc3)cn2)CC1 ZINC000065890118 852304652 /nfs/dbraw/zinc/30/46/52/852304652.db2.gz RPJASCGLMBBCNR-UHFFFAOYSA-N 0 3 424.495 4.194 20 0 HIADHN COc1ccc(OCc2ccccn2)c(CNCCn2c(C)nc3ccccc32)c1 ZINC000065889087 852304730 /nfs/dbraw/zinc/30/47/30/852304730.db2.gz UNYZNFJMKAVESE-UHFFFAOYSA-N 0 3 402.498 4.117 20 0 HIADHN Cc1ccccc1C1(CNC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)CCOCC1 ZINC000065892806 852306547 /nfs/dbraw/zinc/30/65/47/852306547.db2.gz KUQJEJUIDYKUHV-QFIPXVFZSA-N 0 3 424.560 4.211 20 0 HIADHN O[C@@H](CNCc1ccc(Oc2ccccc2F)c(F)c1)COc1ccc(F)cc1 ZINC000065933300 852321641 /nfs/dbraw/zinc/32/16/41/852321641.db2.gz JRRXFCDQAZAFMU-KRWDZBQOSA-N 0 3 403.400 4.426 20 0 HIADHN Cc1ccc(-c2nc(C)c(C(=O)N(CCN(C)C)Cc3cccc(F)c3)s2)o1 ZINC000065939567 852327816 /nfs/dbraw/zinc/32/78/16/852327816.db2.gz DLDUNFSCOKYSRF-UHFFFAOYSA-N 0 3 401.507 4.363 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)Cc1c[nH]c2ccccc12 ZINC000065939071 852327868 /nfs/dbraw/zinc/32/78/68/852327868.db2.gz LNGYJNKZJNTYHJ-UHFFFAOYSA-N 0 3 403.448 4.320 20 0 HIADHN COc1ccc2oc(C)c(C(=O)N(CCN(C)C)Cc3ccc(F)c(F)c3)c2c1 ZINC000065938444 852328028 /nfs/dbraw/zinc/32/80/28/852328028.db2.gz FLFIXSPGYWFALG-UHFFFAOYSA-N 0 3 402.441 4.232 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)c1cn(C)c2ccccc12 ZINC000065939022 852328049 /nfs/dbraw/zinc/32/80/49/852328049.db2.gz OQUHOCCMFWBEOD-UHFFFAOYSA-N 0 3 403.448 4.401 20 0 HIADHN CC(C)c1nn(C)c(Cl)c1CNC[C@H](c1ccc(Cl)cc1)N1CCOCC1 ZINC000065981600 852339968 /nfs/dbraw/zinc/33/99/68/852339968.db2.gz IRQLLCSBYSEOQE-GOSISDBHSA-N 0 3 411.377 4.013 20 0 HIADHN COc1cc(CN(C)C[C@@H](O)CO[C@@H]2CCCc3ccccc32)ccc1OC(F)F ZINC000068845348 852373747 /nfs/dbraw/zinc/37/37/47/852373747.db2.gz LUNSAEXUYNIACC-UYAOXDASSA-N 0 3 421.484 4.184 20 0 HIADHN CN(C)[C@H](CNC(=O)c1ccc(-c2nc3ccccc3s2)o1)Cc1ccccc1 ZINC000069231005 852388923 /nfs/dbraw/zinc/38/89/23/852388923.db2.gz MHOSTSFPSCRVTO-KRWDZBQOSA-N 0 3 405.523 4.459 20 0 HIADHN O=C(NCc1ccc(OC2CCCC2)nc1)NC[C@@H](c1cccs1)N1CCCC1 ZINC000071923246 852432114 /nfs/dbraw/zinc/43/21/14/852432114.db2.gz UHGHOTHZSCDZAD-IBGZPJMESA-N 0 3 414.575 4.101 20 0 HIADHN CC1CCN(CCNC(=O)c2ccc(SCc3cn4ccccc4n3)cc2)CC1 ZINC000071941709 852439705 /nfs/dbraw/zinc/43/97/05/852439705.db2.gz RBMOCVNKXBEWAU-UHFFFAOYSA-N 0 3 408.571 4.088 20 0 HIADHN CCN(CC)[C@H](CNC(=O)COc1ccc(C(F)(F)F)cc1)c1ccsc1 ZINC000071956484 852444639 /nfs/dbraw/zinc/44/46/39/852444639.db2.gz SHEPUWBNRFZXAH-QGZVFWFLSA-N 0 3 400.466 4.345 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)COc1ccc(C(F)(F)F)cc1)c1ccsc1 ZINC000071956483 852444797 /nfs/dbraw/zinc/44/47/97/852444797.db2.gz SHEPUWBNRFZXAH-KRWDZBQOSA-N 0 3 400.466 4.345 20 0 HIADHN Cc1cccc([C@H]2CCCN2CC(=O)N2CCC[C@@H]2c2ccc3c(c2)OCCO3)c1 ZINC000071987799 852454503 /nfs/dbraw/zinc/45/45/03/852454503.db2.gz QOJSHELBWRHOTF-FGZHOGPDSA-N 0 3 406.526 4.267 20 0 HIADHN CCOc1ccccc1Oc1ccc(CNC(=O)N2CCN(C3CCCC3)CC2)cn1 ZINC000072002992 852458800 /nfs/dbraw/zinc/45/88/00/852458800.db2.gz RGVIVWMQGCITKU-UHFFFAOYSA-N 0 3 424.545 4.042 20 0 HIADHN CC1CCN([C@@H](CNC(=O)Cc2coc(-c3ccccc3)n2)c2ccccc2)CC1 ZINC000072006675 852462247 /nfs/dbraw/zinc/46/22/47/852462247.db2.gz UKGVWBSWOWYZMX-QHCPKHFHSA-N 0 3 403.526 4.474 20 0 HIADHN O=C(NCc1cccc(OCC(F)F)c1)NC[C@H](c1cccs1)N1CCCC1 ZINC000072083940 852501608 /nfs/dbraw/zinc/50/16/08/852501608.db2.gz AZVROTHPWDZOFU-QGZVFWFLSA-N 0 3 409.502 4.028 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1sc(C)cc1OC(F)F)c1cccc(OC)c1 ZINC000079309392 852541980 /nfs/dbraw/zinc/54/19/80/852541980.db2.gz RGNQDBDLLPKFOU-MRXNPFEDSA-N 0 3 412.502 4.479 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)c2c(C)nc(C(C)C)nc2SC)N(C)C)cc1 ZINC000097119530 852584154 /nfs/dbraw/zinc/58/41/54/852584154.db2.gz GGGPVSPBGACTKI-GOSISDBHSA-N 0 3 400.592 4.225 20 0 HIADHN O=C(N[C@H]1CCCN(Cc2ccccc2)C1)N1CCC[C@H](c2nc3ccccc3o2)C1 ZINC000097438554 852612745 /nfs/dbraw/zinc/61/27/45/852612745.db2.gz ZAVMLGCAMYBAFK-SFTDATJTSA-N 0 3 418.541 4.381 20 0 HIADHN COc1cc(CNC[C@@H](c2ccco2)N(C)C)cc(Br)c1OC(F)F ZINC000097465481 852614698 /nfs/dbraw/zinc/61/46/98/852614698.db2.gz WLFQFHACRHBLKE-ZDUSSCGKSA-N 0 3 419.266 4.045 20 0 HIADHN Cc1ccccc1C(=O)NC1CCN(CCOc2cccc(Br)c2)CC1 ZINC000097490418 852617361 /nfs/dbraw/zinc/61/73/61/852617361.db2.gz CZINMDRANQEFGI-UHFFFAOYSA-N 0 3 417.347 4.031 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)Nc3ccnn3-c3cccc(Cl)c3)cc2)CC1 ZINC000097548219 852627212 /nfs/dbraw/zinc/62/72/12/852627212.db2.gz VZYBMIRYLWEEBZ-UHFFFAOYSA-N 0 3 423.948 4.308 20 0 HIADHN CCOc1ccc(C(=O)NC2CCN(CCOc3ccc(Cl)cc3)CC2)cc1 ZINC000097577233 852637102 /nfs/dbraw/zinc/63/71/02/852637102.db2.gz PQOUSVDMBUNYKO-UHFFFAOYSA-N 0 3 402.922 4.012 20 0 HIADHN CCOc1cc2c(cc1/C=C/C(=O)N1CCCN(Cc3ccccc3)CC1)O[C@H](C)C2 ZINC000105307242 852697436 /nfs/dbraw/zinc/69/74/36/852697436.db2.gz GHGVAFRSBQKXRF-CTDFXDFQSA-N 0 3 420.553 4.156 20 0 HIADHN CCc1c(C(=O)NC[C@@H](c2ccsc2)N(CC)CC)cnn1-c1ccc(F)cc1 ZINC000106172624 852759632 /nfs/dbraw/zinc/75/96/32/852759632.db2.gz IJJQFMLZVBXLSH-NRFANRHFSA-N 0 3 414.550 4.448 20 0 HIADHN COc1cc(C(=O)NCCN2CCCCC2)ccc1OCc1ccc(Cl)cc1 ZINC000107632764 852783359 /nfs/dbraw/zinc/78/33/59/852783359.db2.gz MHUHEMWMZXOWDC-UHFFFAOYSA-N 0 3 402.922 4.143 20 0 HIADHN CC1CCN([C@@H](CNC(=O)Nc2cccnc2N2CCCC2)c2cccs2)CC1 ZINC000107705294 852788453 /nfs/dbraw/zinc/78/84/53/852788453.db2.gz KCNBEQFLLSRJDD-IBGZPJMESA-N 0 3 413.591 4.338 20 0 HIADHN C[C@H](NC(=O)N1CCCN(Cc2ccccc2)CC1)c1ccc(Br)cc1 ZINC000107834562 852801882 /nfs/dbraw/zinc/80/18/82/852801882.db2.gz NSORHAXOWARIND-KRWDZBQOSA-N 0 3 416.363 4.428 20 0 HIADHN CN(CC(=O)Nc1ccc(Cl)c(Cl)c1)C(=O)c1cccc(CN2CCCC2)c1 ZINC000108703682 852874353 /nfs/dbraw/zinc/87/43/53/852874353.db2.gz SHWSXODRPFTLTJ-UHFFFAOYSA-N 0 3 420.340 4.300 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)C2(c3ccc(Br)cc3)CC2)C1 ZINC000108817081 852882153 /nfs/dbraw/zinc/88/21/53/852882153.db2.gz ACQXNFPXKDMMIN-UZLBHIALSA-N 0 3 413.359 4.432 20 0 HIADHN COc1ccc2[nH]cc(C3CCN([C@@H](C(=O)NC4CC4)c4ccccc4)CC3)c2c1 ZINC000108971167 852902079 /nfs/dbraw/zinc/90/20/79/852902079.db2.gz FAPONAUDHNOFFO-XMMPIXPASA-N 0 3 403.526 4.376 20 0 HIADHN COc1cc(OC)c(NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)cc1Cl ZINC000109017454 852908777 /nfs/dbraw/zinc/90/87/77/852908777.db2.gz CAPBQHSWIAVARG-OAHLLOKOSA-N 0 3 406.885 4.347 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)Nc3ccccc3OC(F)(F)F)cc2)CC1 ZINC000109188628 852932957 /nfs/dbraw/zinc/93/29/57/852932957.db2.gz DMPLYHBXMDCGFY-UHFFFAOYSA-N 0 3 407.436 4.368 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N(C)CCOc3ccc(Cl)cc3)cc2)CC1 ZINC000109197624 852934195 /nfs/dbraw/zinc/93/41/95/852934195.db2.gz QIRRRFJXWBUQCS-UHFFFAOYSA-N 0 3 415.965 4.021 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)c1cc(Br)ccc1F ZINC000109499083 852978185 /nfs/dbraw/zinc/97/81/85/852978185.db2.gz FLPQNIRDXACBKS-UHFFFAOYSA-N 0 3 423.351 4.432 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)[C@@H]1COc2ccc(Cl)cc2C1 ZINC000109498924 852978694 /nfs/dbraw/zinc/97/86/94/852978694.db2.gz RDJKEZNHRDVWFM-SFHVURJKSA-N 0 3 416.974 4.121 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)c1ccc(Sc2ccccn2)cc1 ZINC000109707964 853002551 /nfs/dbraw/zinc/00/25/51/853002551.db2.gz QHEBQKUEHXNIQZ-UHFFFAOYSA-N 0 3 413.612 4.324 20 0 HIADHN Cc1c(NC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)cccc1C(=O)N1CCCC1 ZINC000109780135 853013481 /nfs/dbraw/zinc/01/34/81/853013481.db2.gz AEYBGMKRSMGTGP-FQEVSTJZSA-N 0 3 423.532 4.221 20 0 HIADHN Cc1ccc(SCCC(=O)N(C)C2CCN(CCc3ccccn3)CC2)cc1C ZINC000109795358 853016005 /nfs/dbraw/zinc/01/60/05/853016005.db2.gz AYBZIWBUZHAXGX-UHFFFAOYSA-N 0 3 411.615 4.346 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N3CCC[C@@H]3CCc3ccccc3)cc2)CC1 ZINC000109900206 853031153 /nfs/dbraw/zinc/03/11/53/853031153.db2.gz CUZAWEHGQJGLTH-RUZDIDTESA-N 0 3 405.586 4.454 20 0 HIADHN O=C(Nc1cccc(OCc2cscn2)c1)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000110007314 853045556 /nfs/dbraw/zinc/04/55/56/853045556.db2.gz JATRSFOWWUWHEQ-LJQANCHMSA-N 0 3 408.527 4.118 20 0 HIADHN O=C(Nc1ccn(-c2ccccc2)n1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000110124384 853062720 /nfs/dbraw/zinc/06/27/20/853062720.db2.gz UONGHUADORAESW-OAQYLSRUSA-N 0 3 414.431 4.265 20 0 HIADHN COc1ccc(CCCNC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)cc1 ZINC000110120449 853062776 /nfs/dbraw/zinc/06/27/76/853062776.db2.gz IGASVPAPTOAATB-QFIPXVFZSA-N 0 3 420.475 4.199 20 0 HIADHN Cc1c(C(=O)N2CCCN(CCCc3ccccc3)CC2)cnn1-c1ccccc1F ZINC000110201312 853073352 /nfs/dbraw/zinc/07/33/52/853073352.db2.gz IHBICEJPGCBXKQ-UHFFFAOYSA-N 0 3 420.532 4.101 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)[C@H](Oc3ccccc3)c3ccccc3)CC2)C[C@H](C)O1 ZINC000110408122 853096435 /nfs/dbraw/zinc/09/64/35/853096435.db2.gz JPKZLHJMNDQCPX-TYBLODHISA-N 0 3 422.569 4.155 20 0 HIADHN Cc1cccc(Nc2nnc(SC[C@@H](O)CN(C)Cc3ccccc3)s2)c1 ZINC000110427032 853099138 /nfs/dbraw/zinc/09/91/38/853099138.db2.gz XUNLKUJUXGQAIG-SFHVURJKSA-N 0 3 400.573 4.175 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)C3(c4ccc(Cl)cc4)CCCC3)CC2)C[C@H](C)O1 ZINC000110458205 853102409 /nfs/dbraw/zinc/10/24/09/853102409.db2.gz ZSWFFVCDWSOWCD-OALUTQOASA-N 0 3 419.009 4.500 20 0 HIADHN C[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000110460066 853103468 /nfs/dbraw/zinc/10/34/68/853103468.db2.gz AAJVVEUABAIFGX-VAMGGRTRSA-N 0 3 416.606 4.099 20 0 HIADHN Cc1nc(-c2cccs2)sc1C(=O)N1CCC(CN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000110459907 853103549 /nfs/dbraw/zinc/10/35/49/853103549.db2.gz BYAFDJPDEWPEME-GJZGRUSLSA-N 0 3 419.616 4.141 20 0 HIADHN Fc1cccc(-c2noc([C@H]3CCCN(CCOCCOc4ccccc4)C3)n2)c1 ZINC000110476598 853105501 /nfs/dbraw/zinc/10/55/01/853105501.db2.gz MYTUDPSNONIGDZ-IBGZPJMESA-N 0 3 411.477 4.151 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(CNCc3ccc(-n4cccn4)cc3)c2)cc1 ZINC000110576007 853120205 /nfs/dbraw/zinc/12/02/05/853120205.db2.gz ZQJMAZRGHHZBQD-UHFFFAOYSA-N 0 3 412.493 4.423 20 0 HIADHN COc1ccc(-c2csc(NC(=O)CN(C(C)C)C3CCCC3)n2)c(OC)c1 ZINC000110795571 853152864 /nfs/dbraw/zinc/15/28/64/853152864.db2.gz UZQCSKUDZRSEQR-UHFFFAOYSA-N 0 3 403.548 4.419 20 0 HIADHN O=C(Nc1ccc(Cl)cn1)C1CCN(Cc2ccc(OC(F)(F)F)cc2)CC1 ZINC000110983804 853179406 /nfs/dbraw/zinc/17/94/06/853179406.db2.gz ZLYMPXABLHSAER-UHFFFAOYSA-N 0 3 413.827 4.484 20 0 HIADHN COc1ccccc1[C@@H](CNc1nc(-c2ccccn2)nc(C)c1C)N1CCCC1 ZINC000111147100 853210130 /nfs/dbraw/zinc/21/01/30/853210130.db2.gz RHPOKIJVUVNHBF-OAQYLSRUSA-N 0 3 403.530 4.413 20 0 HIADHN CCCOc1ccc(CN[C@@H](C)c2ccc(S(=O)(=O)N(CC)CC)cc2)cc1 ZINC000115187712 853246700 /nfs/dbraw/zinc/24/67/00/853246700.db2.gz SZEHHVPEAPTDST-SFHVURJKSA-N 0 3 404.576 4.357 20 0 HIADHN Cc1nccc(-c2cccc(NC(=O)[C@H]3CCCN(Cc4cccc(F)c4)C3)c2)n1 ZINC000116060615 853280923 /nfs/dbraw/zinc/28/09/23/853280923.db2.gz AQWMXSFNYLPIGM-FQEVSTJZSA-N 0 3 404.489 4.442 20 0 HIADHN Cc1c(C(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)cnn1-c1cccc(C)c1 ZINC000116185012 853290943 /nfs/dbraw/zinc/29/09/43/853290943.db2.gz RDOCMUIYUXQUSI-XMMPIXPASA-N 0 3 402.542 4.364 20 0 HIADHN CCN(C(=O)c1cccc(NC(=O)C2CC2)c1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000116348897 853298638 /nfs/dbraw/zinc/29/86/38/853298638.db2.gz UYHRYBOSESUZRF-FDDCHVKYSA-N 0 3 405.542 4.333 20 0 HIADHN CCCN(C(=O)c1ccc(Cn2ccnc2)cc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000116590665 853318027 /nfs/dbraw/zinc/31/80/27/853318027.db2.gz PLKGNFCEVLCDQG-RUZDIDTESA-N 0 3 416.569 4.448 20 0 HIADHN CC(C)NC(=O)Nc1ccc(C(=O)NC[C@H](C(C)C)N2CCc3ccccc3C2)cc1 ZINC000117409709 853356543 /nfs/dbraw/zinc/35/65/43/853356543.db2.gz UUMAHSJANMFEIP-HSZRJFAPSA-N 0 3 422.573 4.029 20 0 HIADHN O=C(CSc1ccccc1Cl)NCCCCN1CCN(c2ccccc2)CC1 ZINC000117444489 853357417 /nfs/dbraw/zinc/35/74/17/853357417.db2.gz VJMIKEBCWKQGRW-UHFFFAOYSA-N 0 3 418.006 4.151 20 0 HIADHN CNC(=O)c1ccc(CN(Cc2ccc(OCc3ccncc3)cc2)C2CC2)cc1 ZINC000139219205 853405729 /nfs/dbraw/zinc/40/57/29/853405729.db2.gz LYDNWWOISCKDEF-UHFFFAOYSA-N 0 3 401.510 4.185 20 0 HIADHN Cn1ccnc1[C@@H](NC(=O)c1cccc(CN2CCCC2)c1)c1ccc(Cl)cc1 ZINC000139235696 853406565 /nfs/dbraw/zinc/40/65/65/853406565.db2.gz SVHZGOMDIWNXRP-NRFANRHFSA-N 0 3 408.933 4.189 20 0 HIADHN Cc1c([C@H](C)NC(=O)c2cccc(CN3CCCC3)c2)cnn1-c1ccc(F)cc1 ZINC000139294404 853407610 /nfs/dbraw/zinc/40/76/10/853407610.db2.gz OCTZPLCGLUZROL-KRWDZBQOSA-N 0 3 406.505 4.407 20 0 HIADHN Cc1oc(-c2cccs2)nc1C(=O)NC[C@@H]1CCCN(Cc2cccs2)C1 ZINC000140001090 853429703 /nfs/dbraw/zinc/42/97/03/853429703.db2.gz BTRBPOPYFQOFMH-HNNXBMFYSA-N 0 3 401.557 4.415 20 0 HIADHN Cc1ccc(Cl)cc1NC(=O)[C@H](C)N[C@@H](C)c1ccc(N2CCOCC2)cc1 ZINC000140194488 853437294 /nfs/dbraw/zinc/43/72/94/853437294.db2.gz ZACRFPJHXFZGEI-IRXDYDNUSA-N 0 3 401.938 4.163 20 0 HIADHN CCNC(=O)COc1ccc(CN[C@H](C)c2ccccc2C(F)(F)F)cc1OC ZINC000140456106 853444931 /nfs/dbraw/zinc/44/49/31/853444931.db2.gz VLNVLWYLHZBULN-CQSZACIVSA-N 0 3 410.436 4.080 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1NC(=O)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000195582084 853694664 /nfs/dbraw/zinc/69/46/64/853694664.db2.gz VGWCGVPKCNVCJR-QFIPXVFZSA-N 0 3 403.530 4.448 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)Nc3nc(C4CC4)cs3)CC2)c1 ZINC000195582754 853696132 /nfs/dbraw/zinc/69/61/32/853696132.db2.gz IZZSMSBQOMYALJ-UHFFFAOYSA-N 0 3 413.591 4.053 20 0 HIADHN O=C(/C=C/Sc1ccccc1)NCCCCN1CCN(Cc2ccccc2)CC1 ZINC000195586025 853698003 /nfs/dbraw/zinc/69/80/03/853698003.db2.gz JIOAQRYWXQZDQO-DEDYPNTBSA-N 0 3 409.599 4.007 20 0 HIADHN CN(c1ccccc1)c1ccc(C(=O)N(Cc2ccco2)C2CCN(C)CC2)cn1 ZINC000195610733 853713230 /nfs/dbraw/zinc/71/32/30/853713230.db2.gz LRZFZXNVUSCBCN-UHFFFAOYSA-N 0 3 404.514 4.179 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)N[C@H](CN2CCCC2)c2ccccc2)cc1 ZINC000195612959 853713805 /nfs/dbraw/zinc/71/38/05/853713805.db2.gz KFTZNROETGSZMY-PGRDOPGGSA-N 0 3 408.546 4.174 20 0 HIADHN CCOC(=O)N(C)c1ccc(NC(=O)N[C@@H](CN2CCCC2)c2ccccc2)cc1 ZINC000195613256 853714142 /nfs/dbraw/zinc/71/41/42/853714142.db2.gz LLSVMKXTGMPMIG-NRFANRHFSA-N 0 3 410.518 4.238 20 0 HIADHN CN(Cc1ccccc1Br)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000195648600 853737078 /nfs/dbraw/zinc/73/70/78/853737078.db2.gz VULBOPTXWDQRRK-LJQANCHMSA-N 0 3 416.363 4.255 20 0 HIADHN C[C@H](NC[C@@H](O)COc1ccccc1F)c1cccc(NC(=O)c2ccccc2)c1 ZINC000195662310 853744800 /nfs/dbraw/zinc/74/48/00/853744800.db2.gz KRJYGCVROKUEEF-LAUBAEHRSA-N 0 3 408.473 4.169 20 0 HIADHN C[C@@H](Cc1cccc(Br)c1)NC(=O)c1cccc(CN2CCCC2)c1 ZINC000195683342 853755743 /nfs/dbraw/zinc/75/57/43/853755743.db2.gz OKJNCHZSQNTSEU-INIZCTEOSA-N 0 3 401.348 4.406 20 0 HIADHN COCCOc1c(Cl)cccc1NC(=O)N[C@H](CN1CCCC1)c1ccccc1 ZINC000195713604 853774769 /nfs/dbraw/zinc/77/47/69/853774769.db2.gz BUZMCXCJDBKDPA-HXUWFJFHSA-N 0 3 417.937 4.324 20 0 HIADHN Cc1noc(C)c1COc1ccc(CC(=O)NC[C@@H](c2ccc(C)cc2)N(C)C)cc1 ZINC000195717723 853776299 /nfs/dbraw/zinc/77/62/99/853776299.db2.gz BDQVXNIMDTWWBW-DEOSSOPVSA-N 0 3 421.541 4.140 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)c1cc(-c2ccc(Cl)cc2)on1 ZINC000195724879 853779398 /nfs/dbraw/zinc/77/93/98/853779398.db2.gz SWEHVUDUVADANV-UHFFFAOYSA-N 0 3 401.869 4.338 20 0 HIADHN CCN1CCN(c2ccccc2CNc2ccc(C(=O)N3CCC(C)CC3)cc2)CC1 ZINC000437264574 862499442 /nfs/dbraw/zinc/49/94/42/862499442.db2.gz YYGQPKXYTQUWJC-UHFFFAOYSA-N 0 3 420.601 4.313 20 0 HIADHN Cc1ccc([C@H](CNC(=O)/C=C\c2ccc(OCc3cccnc3)cc2)N(C)C)cc1 ZINC000208032208 853805610 /nfs/dbraw/zinc/80/56/10/853805610.db2.gz XXVJLRFXZSEERX-AVWNRLRGSA-N 0 3 415.537 4.401 20 0 HIADHN Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)N[C@H](CN1CCCC1)c1ccccc1 ZINC000215958923 853841216 /nfs/dbraw/zinc/84/12/16/853841216.db2.gz OAINJBVIBDTLRZ-HSZRJFAPSA-N 0 3 422.573 4.339 20 0 HIADHN CCOc1cc(C(=O)NC2CC[NH+](Cc3ccc(Cl)cc3)CC2)cc(Cl)c1[O-] ZINC000216150168 853845301 /nfs/dbraw/zinc/84/53/01/853845301.db2.gz JCRMWYCJOLMBQV-UHFFFAOYSA-N 0 3 423.340 4.492 20 0 HIADHN C[C@H](NC[C@@H](c1cccs1)N1CCOCC1)C(=O)Nc1ccc(C(C)(C)C)cc1 ZINC000216379811 853850935 /nfs/dbraw/zinc/85/09/35/853850935.db2.gz ZEQZGGVZASHNHQ-PXNSSMCTSA-N 0 3 415.603 4.036 20 0 HIADHN CCC(CC)[C@@H](O)CNCc1cc(Br)cc(Br)c1OC ZINC000225818168 853880323 /nfs/dbraw/zinc/88/03/23/853880323.db2.gz IHNMHUVBFJZUDN-AWEZNQCLSA-N 0 3 409.162 4.107 20 0 HIADHN c1cn(-c2cc(CNCc3cn(-c4ccccc4)nc3-c3ccccc3)ccn2)cn1 ZINC000236582663 853899816 /nfs/dbraw/zinc/89/98/16/853899816.db2.gz NTBSAXYXJJGDSQ-UHFFFAOYSA-N 0 3 406.493 4.410 20 0 HIADHN CC(C)NS(=O)(=O)Cc1ccccc1CNCc1cccc(-c2ccccc2)c1 ZINC000236722515 853915568 /nfs/dbraw/zinc/91/55/68/853915568.db2.gz OAXZMZVMVQVECV-UHFFFAOYSA-N 0 3 408.567 4.471 20 0 HIADHN CCNC(=O)COc1ccc(CN[C@@H](c2ccc(Cl)cc2)C2CC2)cc1OC ZINC000236912444 853936244 /nfs/dbraw/zinc/93/62/44/853936244.db2.gz YCGRIINGSNGJEE-JOCHJYFZSA-N 0 3 402.922 4.104 20 0 HIADHN CCC[C@@H](NCc1ccc(-n2ccnc2)cc1)C(=O)Nc1cccc(N2CCCC2)c1 ZINC000236924863 853938517 /nfs/dbraw/zinc/93/85/17/853938517.db2.gz WMIJVVSMZLFGAI-XMMPIXPASA-N 0 3 417.557 4.370 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@@H](C)NCc2ccc(SC)c(OC)c2)cc1 ZINC000237009509 853950414 /nfs/dbraw/zinc/95/04/14/853950414.db2.gz PQSKAMKSNWABLV-MRXNPFEDSA-N 0 3 422.616 4.298 20 0 HIADHN COCCOc1cccc(CN[C@H](C)c2ccc(NC(=O)c3ccncc3)cc2)c1 ZINC000237068460 853959709 /nfs/dbraw/zinc/95/97/09/853959709.db2.gz UGHSSAIGKHPOGA-GOSISDBHSA-N 0 3 405.498 4.210 20 0 HIADHN COc1cc(CNCc2ccc(OCC(F)F)cc2)cc(Br)c1OC ZINC000237104408 853965306 /nfs/dbraw/zinc/96/53/06/853965306.db2.gz FVJXVKUVZNNSOI-UHFFFAOYSA-N 0 3 416.262 4.400 20 0 HIADHN CN(C)S(=O)(=O)c1ccc(CNCc2ccc(-c3cccc(F)c3)s2)cc1 ZINC000237121145 853967401 /nfs/dbraw/zinc/96/74/01/853967401.db2.gz VIXRFIAUERXVNH-UHFFFAOYSA-N 0 3 404.532 4.094 20 0 HIADHN Cc1nn(Cc2c(Cl)cccc2Cl)c(Cl)c1CNCCCC(=O)N(C)C ZINC000237139346 853971453 /nfs/dbraw/zinc/97/14/53/853971453.db2.gz VDAUKVWMDDOZJW-UHFFFAOYSA-N 0 3 417.768 4.158 20 0 HIADHN CN(Cc1ccccc1Br)C(=O)CCNCc1ccc(Cl)s1 ZINC000237143203 853971703 /nfs/dbraw/zinc/97/17/03/853971703.db2.gz QYWVTJBSNMZABG-UHFFFAOYSA-N 0 3 401.757 4.302 20 0 HIADHN COc1cc(CNCCn2cccn2)cc(Br)c1OCc1ccccc1 ZINC000237207661 853981868 /nfs/dbraw/zinc/98/18/68/853981868.db2.gz IEGGRPIPKWAEFB-UHFFFAOYSA-N 0 3 416.319 4.023 20 0 HIADHN COc1cc(Br)c(CNCCCc2nc3ccccc3n2C)cc1OC ZINC000237219485 853985797 /nfs/dbraw/zinc/98/57/97/853985797.db2.gz XPQNMGIRJRIJDU-UHFFFAOYSA-N 0 3 418.335 4.075 20 0 HIADHN COCCOc1ccc(CN[C@H](C)c2ccc(NC(=O)c3ccncc3)cc2)cc1 ZINC000237217600 853985821 /nfs/dbraw/zinc/98/58/21/853985821.db2.gz IHISNJNDANGUSJ-GOSISDBHSA-N 0 3 405.498 4.210 20 0 HIADHN COc1cccc([C@@H](O)CNCc2cccc(NC(=O)c3ccc(Cl)cc3)c2)c1 ZINC000237300272 854001390 /nfs/dbraw/zinc/00/13/90/854001390.db2.gz WZVRNHSGDBTEFO-QFIPXVFZSA-N 0 3 410.901 4.424 20 0 HIADHN C[C@@H](CC(=O)Nc1ccccc1C(F)(F)F)NCc1cnn(Cc2ccccc2)c1 ZINC000237335239 854008657 /nfs/dbraw/zinc/00/86/57/854008657.db2.gz QRQDSHIDCAFVEU-INIZCTEOSA-N 0 3 416.447 4.457 20 0 HIADHN COc1ccccc1-c1ccc(CNCc2cccc(OCC(=O)N(C)C)c2)cc1 ZINC000237341304 854009676 /nfs/dbraw/zinc/00/96/76/854009676.db2.gz ZDNQNAMGKCPUTL-UHFFFAOYSA-N 0 3 404.510 4.119 20 0 HIADHN CSC[C@](C)(O)CNCc1c(C)nn(Cc2ccc(Cl)cc2Cl)c1Cl ZINC000237370678 854016941 /nfs/dbraw/zinc/01/69/41/854016941.db2.gz RBYLZHFTIATLET-QGZVFWFLSA-N 0 3 422.809 4.404 20 0 HIADHN COc1ccc(OC)c(NC(=O)C[C@@H](C)N[C@@H]2CCOc3c(Cl)cccc32)c1 ZINC000237397310 854022365 /nfs/dbraw/zinc/02/23/65/854022365.db2.gz FWOQTBOABKGERA-CXAGYDPISA-N 0 3 404.894 4.188 20 0 HIADHN COc1ccc(CNCCc2nc(-c3cccc(Cl)c3)no2)c(Cl)c1OC ZINC000237396532 854022525 /nfs/dbraw/zinc/02/25/25/854022525.db2.gz JDDIMOQZZJIUOU-UHFFFAOYSA-N 0 3 408.285 4.393 20 0 HIADHN C[C@@H](NCc1ccc(OCc2ccccc2)cc1)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000237399459 854023484 /nfs/dbraw/zinc/02/34/84/854023484.db2.gz XRYIDKPRLHRWGN-LJQANCHMSA-N 0 3 424.566 4.367 20 0 HIADHN COc1ccc(OC)c(NC(=O)C[C@H](C)N[C@@H](c2nc3ccccc3[nH]2)C(C)C)c1 ZINC000237402882 854024736 /nfs/dbraw/zinc/02/47/36/854024736.db2.gz UMHWZTHBIQJIRT-OYHNWAKOSA-N 0 3 410.518 4.284 20 0 HIADHN COc1ccc(OCc2ccccn2)c(CNC[C@H](c2ccc(F)cc2)N(C)C)c1 ZINC000237435962 854032720 /nfs/dbraw/zinc/03/27/20/854032720.db2.gz FIAQWZYCVYUYNQ-HSZRJFAPSA-N 0 3 409.505 4.201 20 0 HIADHN COc1ccc(CNCc2ccccc2CN2C[C@@H](C)O[C@@H](C)C2)cc1OC(F)F ZINC000237441309 854033543 /nfs/dbraw/zinc/03/35/43/854033543.db2.gz BBQBUJPHUMUTCE-CALCHBBNSA-N 0 3 420.500 4.196 20 0 HIADHN COc1ccc(-c2ccc(CN[C@H](C)[C@H](O)c3ccc(F)cc3)o2)c([N+](=O)[O-])c1 ZINC000237439730 854033865 /nfs/dbraw/zinc/03/38/65/854033865.db2.gz VRMUOLOXURCWSN-ASSNKEHSSA-N 0 3 400.406 4.214 20 0 HIADHN C[C@@H](NCc1ccc(-n2ccc(C(F)(F)F)n2)cc1)c1ccc2c(c1)NC(=O)CO2 ZINC000237437130 854034033 /nfs/dbraw/zinc/03/40/33/854034033.db2.gz APDBKHPHPLLDHM-CYBMUJFWSA-N 0 3 416.403 4.073 20 0 HIADHN C[C@H]1CN(C(=O)c2ccc(CNCc3ccc(OC(F)(F)F)cc3)cc2)C[C@H](C)O1 ZINC000237547462 854053450 /nfs/dbraw/zinc/05/34/50/854053450.db2.gz UAHSKVGYQODQPI-HOTGVXAUSA-N 0 3 422.447 4.124 20 0 HIADHN Cc1cc(Br)ccc1NC(=O)CCNCc1cnn(-c2ccccc2)c1 ZINC000237566174 854055202 /nfs/dbraw/zinc/05/52/02/854055202.db2.gz ZUKNPKXSRVQDAG-UHFFFAOYSA-N 0 3 413.319 4.062 20 0 HIADHN Cc1nn(Cc2ccc(F)cc2)c(Cl)c1CNC[C@@H](CCO)c1ccccc1 ZINC000237612150 854061711 /nfs/dbraw/zinc/06/17/11/854061711.db2.gz CLFATRJGANHXTF-LJQANCHMSA-N 0 3 401.913 4.288 20 0 HIADHN Cc1ccc([C@H](CNCC2=Cc3cc(Cl)cc(Cl)c3OC2)N2CCOCC2)o1 ZINC000237646595 854068004 /nfs/dbraw/zinc/06/80/04/854068004.db2.gz ITRODBMWYYMOPW-IBGZPJMESA-N 0 3 423.340 4.334 20 0 HIADHN Cc1nn(Cc2ccccc2Cl)c(C)c1CNC[C@@H](O)c1c(F)cccc1F ZINC000237676441 854072808 /nfs/dbraw/zinc/07/28/08/854072808.db2.gz ONRVQIQQKCOFBB-HXUWFJFHSA-N 0 3 405.876 4.303 20 0 HIADHN Cc1nn(-c2ccc(Br)cc2)c(C)c1CNC[C@H](O)c1ccsc1 ZINC000237701143 854078769 /nfs/dbraw/zinc/07/87/69/854078769.db2.gz ONQNKGVDFZHVND-SFHVURJKSA-N 0 3 406.349 4.136 20 0 HIADHN Clc1ccc(OC[C@@H]2CCCO2)c(CN[C@@H]2CCN(c3ncccc3Cl)C2)c1 ZINC000237714147 854081916 /nfs/dbraw/zinc/08/19/16/854081916.db2.gz QTBSSOGWRBWZBJ-MSOLQXFVSA-N 0 3 422.356 4.315 20 0 HIADHN Clc1ccc(OC[C@@H]2CCCO2)c(CN[C@H]2CCN(c3ncccc3Cl)C2)c1 ZINC000237714282 854082002 /nfs/dbraw/zinc/08/20/02/854082002.db2.gz QTBSSOGWRBWZBJ-ROUUACIJSA-N 0 3 422.356 4.315 20 0 HIADHN Cc1nn(C)c(N2CCOCC2)c1CNC1(c2ccc(Cl)cc2)CCCCC1 ZINC000237802565 854099974 /nfs/dbraw/zinc/09/99/74/854099974.db2.gz YNJHQSVETLMQMG-UHFFFAOYSA-N 0 3 402.970 4.168 20 0 HIADHN Cc1nn(-c2cccc(Cl)c2)c(Cl)c1CNC[C@@H]1CCN(CC(F)(F)F)C1 ZINC000237815204 854102367 /nfs/dbraw/zinc/10/23/67/854102367.db2.gz WWZQMZYEBZTWEZ-ZDUSSCGKSA-N 0 3 421.294 4.461 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CNC[C@@H](O)COc1cccc(C(F)(F)F)c1 ZINC000237851898 854107283 /nfs/dbraw/zinc/10/72/83/854107283.db2.gz KFARPMYTUVLLQV-LJQANCHMSA-N 0 3 419.447 4.037 20 0 HIADHN Cc1ccoc1C(=O)NCCCNCc1c(C)nn(Cc2ccc(C)cc2)c1Cl ZINC000237855806 854108551 /nfs/dbraw/zinc/10/85/51/854108551.db2.gz HXURLPYAIHNXQV-UHFFFAOYSA-N 0 3 414.937 4.013 20 0 HIADHN Cc1nn(-c2cc(C)ccc2C)c(Cl)c1CNCCc1nnc2n1CCCCC2 ZINC000237859365 854109677 /nfs/dbraw/zinc/10/96/77/854109677.db2.gz ZABLTSCTEWOTQR-UHFFFAOYSA-N 0 3 412.969 4.101 20 0 HIADHN O[C@H](CNCc1cn(-c2ccccc2)nc1-c1ccncc1)c1c(F)cccc1F ZINC000237976311 854127506 /nfs/dbraw/zinc/12/75/06/854127506.db2.gz GXRJVFKINGGWBP-OAQYLSRUSA-N 0 3 406.436 4.036 20 0 HIADHN N#CCCCOc1cccc(C[NH2+][C@@H]2CCCN(Cc3cc(Cl)ccc3[O-])C2)c1 ZINC000238060306 854138710 /nfs/dbraw/zinc/13/87/10/854138710.db2.gz NFMAQCMFMNQPQL-OAQYLSRUSA-N 0 3 413.949 4.482 20 0 HIADHN COc1ccc(CNC(=O)[C@H](C)N[C@@H](Cc2ccccc2)c2ccccc2)cc1OC ZINC000248237740 854186742 /nfs/dbraw/zinc/18/67/42/854186742.db2.gz FJZGRDMRXZSKMB-CVDCTZTESA-N 0 3 418.537 4.282 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N[C@H](c1ccc(F)cc1)[C@H]1CCCO1 ZINC000250084771 854192808 /nfs/dbraw/zinc/19/28/08/854192808.db2.gz KVNGTLKPYGYVPA-SFHLNBCPSA-N 0 3 417.550 4.244 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3c(C)nn(-c4ccccc4)c3C)c(C)c2)CC1 ZINC000255946703 854226553 /nfs/dbraw/zinc/22/65/53/854226553.db2.gz IIZHBUIEIDUVIZ-UHFFFAOYSA-N 0 3 417.557 4.192 20 0 HIADHN O=C(CCc1cccc(Br)c1)NC[C@H](c1cccs1)N1CCCC1 ZINC000255952814 854229149 /nfs/dbraw/zinc/22/91/49/854229149.db2.gz YNXWODMXDHOPDM-QGZVFWFLSA-N 0 3 407.377 4.397 20 0 HIADHN O=C(NC[C@@H]1CCCO[C@@H]1c1ccccc1)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000255959248 854230856 /nfs/dbraw/zinc/23/08/56/854230856.db2.gz ICINIYZMJSUSRY-KMDXXIMOSA-N 0 3 407.558 4.118 20 0 HIADHN C[C@H](C(=O)Nc1ccc(N2CCCCC2)cc1)N1CCN(C2CCC(C)CC2)CC1 ZINC000261404989 854250853 /nfs/dbraw/zinc/25/08/53/854250853.db2.gz APUYROFSRYWREZ-WQMHRJNTSA-N 0 3 412.622 4.200 20 0 HIADHN CC(C)(C)n1ncc2c1ncnc2N1CCN(Cc2cccc3ccccc32)CC1 ZINC000301152884 854313364 /nfs/dbraw/zinc/31/33/64/854313364.db2.gz BJYWUYDSYOXEMT-UHFFFAOYSA-N 0 3 400.530 4.057 20 0 HIADHN CN(C)[C@H](CNc1cc(C(F)(F)F)nc(-c2cccnc2)n1)c1cccc(F)c1 ZINC000301312509 854354879 /nfs/dbraw/zinc/35/48/79/854354879.db2.gz IVQGCQSXPLJGSY-MRXNPFEDSA-N 0 3 405.399 4.411 20 0 HIADHN Cc1nc(-c2ccc(NC[C@H](C(C)C)[N@@H+]3CCc4ccccc4C3)nc2)[n-]c(=O)c1C ZINC000301330726 854362011 /nfs/dbraw/zinc/36/20/11/854362011.db2.gz BFZSAPINOXPLQF-JOCHJYFZSA-N 0 3 417.557 4.356 20 0 HIADHN Cc1nc(-c2ccc(NC[C@H](C(C)C)[N@H+]3CCc4ccccc4C3)nc2)[n-]c(=O)c1C ZINC000301330726 854362016 /nfs/dbraw/zinc/36/20/16/854362016.db2.gz BFZSAPINOXPLQF-JOCHJYFZSA-N 0 3 417.557 4.356 20 0 HIADHN COc1cccc([C@@H](CNC(=O)CCSc2ccc(F)cc2)N2CCCC2)c1 ZINC000301386518 854378470 /nfs/dbraw/zinc/37/84/70/854378470.db2.gz QFJHNRMXINQWQI-OAQYLSRUSA-N 0 3 402.535 4.270 20 0 HIADHN Fc1ccccc1-c1nnc2ccc(NC[C@H](c3cccs3)N3CCCC3)nn21 ZINC000301506130 854408836 /nfs/dbraw/zinc/40/88/36/854408836.db2.gz GYWQJYVVDBKWDF-QGZVFWFLSA-N 0 3 408.506 4.241 20 0 HIADHN COc1ccccc1[C@H](CNc1ccc(-c2nc(C)c(C)c(=O)[n-]2)cn1)[NH+]1CCCC1 ZINC000301547510 854417915 /nfs/dbraw/zinc/41/79/15/854417915.db2.gz UIPDEBOXRHRWNZ-FQEVSTJZSA-N 0 3 419.529 4.119 20 0 HIADHN COc1cc(CN2CC[C@@H](Nc3nc(C(F)F)nc4ccccc43)C2)cc(OC)c1 ZINC000301583786 854424354 /nfs/dbraw/zinc/42/43/54/854424354.db2.gz UZLZJNMPSYIXET-OAHLLOKOSA-N 0 3 414.456 4.271 20 0 HIADHN COCCC(=O)N1CCC(Nc2c(C)c(C)nc3ccc(Br)cc32)CC1 ZINC000301699423 854447756 /nfs/dbraw/zinc/44/77/56/854447756.db2.gz OXCZXWHJACUGSP-UHFFFAOYSA-N 0 3 420.351 4.054 20 0 HIADHN Cc1ccc([C@H](CNc2nn3cc(-c4cccnc4)nc3s2)N2CCCC2)cc1 ZINC000302073626 854526778 /nfs/dbraw/zinc/52/67/78/854526778.db2.gz GCASBRVCKSFKQJ-FQEVSTJZSA-N 0 3 404.543 4.410 20 0 HIADHN CN(c1cnc2cc(Cl)c(Cl)cc2n1)C1CCN(CCc2ccccn2)CC1 ZINC000302089881 854529282 /nfs/dbraw/zinc/52/92/82/854529282.db2.gz LTSSDHQVEWDUCG-UHFFFAOYSA-N 0 3 416.356 4.475 20 0 HIADHN Cc1nc2ccc(Br)cc2c(N2CCOCC3(CCOCC3)C2)c1C ZINC000302119295 854533313 /nfs/dbraw/zinc/53/33/13/854533313.db2.gz CXYPODYITMHENJ-UHFFFAOYSA-N 0 3 405.336 4.248 20 0 HIADHN CN1CCC[C@@H](CNc2nn3cc(-c4cccnc4)nc3s2)[C@H]1c1cccs1 ZINC000302153408 854538299 /nfs/dbraw/zinc/53/82/99/854538299.db2.gz IEFVDJZHXAUMDT-YJBOKZPZSA-N 0 3 410.572 4.409 20 0 HIADHN COc1ccc(C(=O)N2CCC(Nc3ccnc4ccc(C)cc43)CC2)cc1OC ZINC000302162308 854539713 /nfs/dbraw/zinc/53/97/13/854539713.db2.gz PVKXIGQXIOVGSN-UHFFFAOYSA-N 0 3 405.498 4.277 20 0 HIADHN COc1ccc(C(=O)N2CCC(Nc3ccnc4ccc(C)cc43)CC2)c(OC)c1 ZINC000302177884 854543436 /nfs/dbraw/zinc/54/34/36/854543436.db2.gz XVLBVFZFVQQEKU-UHFFFAOYSA-N 0 3 405.498 4.277 20 0 HIADHN Cc1nc2ccc(Br)cc2c(NCCC(=O)NCc2ccccn2)c1C ZINC000302454602 854572623 /nfs/dbraw/zinc/57/26/23/854572623.db2.gz UEVKQQNBWSVOFK-UHFFFAOYSA-N 0 3 413.319 4.128 20 0 HIADHN CN(C)[C@H](CNc1ncc(Cn2cc(Br)cn2)s1)c1ccc(F)cc1 ZINC000302472537 854574219 /nfs/dbraw/zinc/57/42/19/854574219.db2.gz UOTBITTWRCAEOX-MRXNPFEDSA-N 0 3 424.343 4.004 20 0 HIADHN COc1cc(C(=O)NCc2ccccc2CN(C)C)cc(Cl)c1OCC(C)C ZINC000302671599 854601971 /nfs/dbraw/zinc/60/19/71/854601971.db2.gz ZYNWYAQWBSHEDC-UHFFFAOYSA-N 0 3 404.938 4.375 20 0 HIADHN CN1CC[C@@H]2[C@H](CCCN2c2nnc(-c3cc(Br)ccc3F)s2)C1 ZINC000302759863 854623822 /nfs/dbraw/zinc/62/38/22/854623822.db2.gz WVOBSAVLKCVZGM-IAQYHMDHSA-N 0 3 411.344 4.027 20 0 HIADHN CN(C)[C@H](CNC(=O)c1ccc(NC(=O)Nc2ccccc2)cc1)c1ccccc1 ZINC000302811830 854642306 /nfs/dbraw/zinc/64/23/06/854642306.db2.gz DKVFKFQJLVFCNV-JOCHJYFZSA-N 0 3 402.498 4.363 20 0 HIADHN COc1ccc([C@@H](NCC(=O)Nc2ccccc2C(=O)NCC(C)C)C(C)C)cc1 ZINC000302845929 854654522 /nfs/dbraw/zinc/65/45/22/854654522.db2.gz GONZALWRTMKUJT-QHCPKHFHSA-N 0 3 411.546 4.006 20 0 HIADHN COc1ccc([C@@H](CNC(=O)NCCc2cccc(Cl)c2)N2CCCC2)cc1 ZINC000302853762 854657695 /nfs/dbraw/zinc/65/76/95/854657695.db2.gz ZPBITEOBXGUKSK-OAQYLSRUSA-N 0 3 401.938 4.027 20 0 HIADHN COc1ccc([C@H](NC(=O)NC[C@H](c2ccc(OC)cc2)N2CCCC2)C2CC2)cc1 ZINC000302896752 854670133 /nfs/dbraw/zinc/67/01/33/854670133.db2.gz LVZNWRFOFXVWIU-DNQXCXABSA-N 0 3 423.557 4.291 20 0 HIADHN CC1CCN([C@@H](CNC(=O)N(C)CCOc2ccccc2)c2cccs2)CC1 ZINC000302904321 854674345 /nfs/dbraw/zinc/67/43/45/854674345.db2.gz XHKQLBVEKZRUHH-FQEVSTJZSA-N 0 3 401.576 4.242 20 0 HIADHN COc1ccc(SCCC(=O)NC[C@@H](c2cccc(OC)c2)N2CCCC2)cc1 ZINC000302907333 854674945 /nfs/dbraw/zinc/67/49/45/854674945.db2.gz DEWNVYNDKUCUIA-QFIPXVFZSA-N 0 3 414.571 4.139 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)c1cc(-c2ccccc2Cl)n[nH]1 ZINC000302945563 854691858 /nfs/dbraw/zinc/69/18/58/854691858.db2.gz CBHAFHPNNZQIHJ-UHFFFAOYSA-N 0 3 418.875 4.212 20 0 HIADHN O=C(NCc1cccc(Br)c1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000302963985 854699584 /nfs/dbraw/zinc/69/95/84/854699584.db2.gz GQMNIZCHWXWTAT-QGZVFWFLSA-N 0 3 405.311 4.117 20 0 HIADHN C[C@H](CN1CCCCC1)NC(=O)c1oc2ccccc2c1CSc1ncccn1 ZINC000302980708 854707247 /nfs/dbraw/zinc/70/72/47/854707247.db2.gz CYZZGDGPMYGGFK-MRXNPFEDSA-N 0 3 410.543 4.119 20 0 HIADHN CC1CCN([C@@H](CNC(=O)c2cc([N+](=O)[O-])ccc2Cl)c2ccccc2)CC1 ZINC000303025632 854728862 /nfs/dbraw/zinc/72/88/62/854728862.db2.gz SBYQITQCDYANJC-FQEVSTJZSA-N 0 3 401.894 4.451 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)c1cc(-c2cccc(Cl)c2)no1 ZINC000303052572 854739217 /nfs/dbraw/zinc/73/92/17/854739217.db2.gz VTIRGTGVSHGJLR-UHFFFAOYSA-N 0 3 401.869 4.338 20 0 HIADHN Cc1ccc([C@H](CNC(=O)[C@@H]2C[C@@H]2c2ccc(Br)cc2)N(C)C)cc1 ZINC000303054712 854740691 /nfs/dbraw/zinc/74/06/91/854740691.db2.gz WIRZMEXXUYFCMI-AQNXPRMDSA-N 0 3 401.348 4.280 20 0 HIADHN CCOc1ccc(C2(CNC(=O)c3cccc(CN4CCCC4)c3)CCOCC2)cc1 ZINC000303056274 854741384 /nfs/dbraw/zinc/74/13/84/854741384.db2.gz WGWCHIYEIKZBHX-UHFFFAOYSA-N 0 3 422.569 4.159 20 0 HIADHN C[C@@H]1CCCC[N@@H+]1Cc1ccc(NC(=O)[C@@H]2CCCN2C(=O)c2ccccc2[O-])cc1 ZINC000303136722 854778347 /nfs/dbraw/zinc/77/83/47/854778347.db2.gz AJIXTENRAIRDPQ-GCJKJVERSA-N 0 3 421.541 4.010 20 0 HIADHN C[C@@H]1CCCC[N@H+]1Cc1ccc(NC(=O)[C@@H]2CCCN2C(=O)c2ccccc2[O-])cc1 ZINC000303136722 854778355 /nfs/dbraw/zinc/77/83/55/854778355.db2.gz AJIXTENRAIRDPQ-GCJKJVERSA-N 0 3 421.541 4.010 20 0 HIADHN COc1ccccc1[C@@H](C)NC(=O)CN(Cc1ccc2c(c1)CCO2)C1CCCC1 ZINC000303173685 854800125 /nfs/dbraw/zinc/80/01/25/854800125.db2.gz JQQJLBKDSLASMZ-GOSISDBHSA-N 0 3 408.542 4.252 20 0 HIADHN O=C(NCc1ccc(F)c(Cl)c1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000303191065 854809761 /nfs/dbraw/zinc/80/97/61/854809761.db2.gz ZGGIKINEBQFFDI-UHFFFAOYSA-N 0 3 407.942 4.392 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)Cc3ccc(OCC(C)C)cc3)cc2)CC1 ZINC000303249517 854835302 /nfs/dbraw/zinc/83/53/02/854835302.db2.gz AKTOFLPIGYXPOU-UHFFFAOYSA-N 0 3 409.574 4.040 20 0 HIADHN Cc1c(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)cnn1-c1ccccc1Cl ZINC000303450519 854949211 /nfs/dbraw/zinc/94/92/11/854949211.db2.gz KHSXOMBQDQFNSI-QFIPXVFZSA-N 0 3 408.933 4.401 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)[C@H]1C[C@H]1c1cccc(C(F)(F)F)c1 ZINC000303450931 854949670 /nfs/dbraw/zinc/94/96/70/854949670.db2.gz JMTIKUNWARTAPG-ROUUACIJSA-N 0 3 412.521 4.287 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)Nc1ccc(-c2cn3cccnc3n2)cc1 ZINC000303500783 854989745 /nfs/dbraw/zinc/98/97/45/854989745.db2.gz AJMICENXFZAYDK-UHFFFAOYSA-N 0 3 411.465 4.456 20 0 HIADHN O=C(CCC(=O)c1ccc2c(c1)CCC2)NC1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1 ZINC000303525911 855013263 /nfs/dbraw/zinc/01/32/63/855013263.db2.gz QSRIRVSPWJEEOW-QILAJZQNSA-N 0 3 416.565 4.450 20 0 HIADHN CSc1cccc(N(C(=O)CSCc2cscn2)C2CCN(C)CC2)c1 ZINC000437351680 862632427 /nfs/dbraw/zinc/63/24/27/862632427.db2.gz HXIFZMIDUVVZIF-UHFFFAOYSA-N 0 3 407.630 4.226 20 0 HIADHN Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)c1oc2ccccc2c1CN(C)C ZINC000303559103 855039590 /nfs/dbraw/zinc/03/95/90/855039590.db2.gz NAELMRMOZLEKNP-UHFFFAOYSA-N 0 3 407.514 4.441 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)Nc1cccc(C(=O)Nc2ccncc2)c1 ZINC000303563311 855042109 /nfs/dbraw/zinc/04/21/09/855042109.db2.gz NUXKRBCLDKPTOD-UHFFFAOYSA-N 0 3 414.465 4.394 20 0 HIADHN COc1cc([C@H](C)NC(=O)[C@@H](C)N2CCCCCC2)ccc1OCc1ccncc1 ZINC000303568952 855045059 /nfs/dbraw/zinc/04/50/59/855045059.db2.gz OLZKFZFAMWJTOR-RBUKOAKNSA-N 0 3 411.546 4.111 20 0 HIADHN COc1cc([C@@H](C)NC(=O)[C@@H](C)N2CCCCCC2)ccc1OCc1ccncc1 ZINC000303568953 855045380 /nfs/dbraw/zinc/04/53/80/855045380.db2.gz OLZKFZFAMWJTOR-RTBURBONSA-N 0 3 411.546 4.111 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)Nc1ccc(-n2cnc3ccccc32)nc1 ZINC000303606841 855074111 /nfs/dbraw/zinc/07/41/11/855074111.db2.gz YGAMYMSJUQXYRZ-UHFFFAOYSA-N 0 3 411.465 4.481 20 0 HIADHN Cc1ccc(NC(=O)c2csc(-c3ccc4c(c3)OCCO4)n2)c(CN(C)C)c1 ZINC000303635044 855091469 /nfs/dbraw/zinc/09/14/69/855091469.db2.gz RBSVZBMGQHGHQC-UHFFFAOYSA-N 0 3 409.511 4.204 20 0 HIADHN CC1CCC(N2CCN([C@@H]3CCN(c4ccc(C(F)(F)F)cc4)C3=O)CC2)CC1 ZINC000303638119 855094558 /nfs/dbraw/zinc/09/45/58/855094558.db2.gz GXEYZAUCHFFPSW-OUNSHVDWSA-N 0 3 409.496 4.007 20 0 HIADHN C/C(=C/C(=O)Nc1ccc(C(=O)N(C)[C@H]2CCCN(C)C2)cc1)c1cccc(F)c1 ZINC000303826171 855226644 /nfs/dbraw/zinc/22/66/44/855226644.db2.gz ATAVRBGERCAGQZ-XWPLZZTOSA-N 0 3 409.505 4.034 20 0 HIADHN C[C@H]1C[C@H](N(C)S(=O)(=O)C2=Cc3ccccc3CC2)CCN1Cc1ccccc1 ZINC000303834108 855232539 /nfs/dbraw/zinc/23/25/39/855232539.db2.gz RLEBFKWLFHCPNS-WMZHIEFXSA-N 0 3 410.583 4.288 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)CCN3c4ccccc4CC[C@H]3C)c(C)c2)CC1 ZINC000303837469 855235751 /nfs/dbraw/zinc/23/57/51/855235751.db2.gz IJIKKFBDRFTCGY-OAQYLSRUSA-N 0 3 420.601 4.307 20 0 HIADHN CC(C)c1nn(C)c(Cl)c1C(=O)NC[C@H](c1ccccc1)N1CCC(C)CC1 ZINC000303852956 855248729 /nfs/dbraw/zinc/24/87/29/855248729.db2.gz FXWAAJRSMDOILI-GOSISDBHSA-N 0 3 402.970 4.400 20 0 HIADHN Cc1ccc(S(=O)(=O)N(C)[C@H]2CCN(Cc3ccccc3)[C@H](C)C2)c(Cl)c1 ZINC000303860362 855255891 /nfs/dbraw/zinc/25/58/91/855255891.db2.gz WLRYTSFHQROIRE-MJGOQNOKSA-N 0 3 406.979 4.322 20 0 HIADHN CN(C(=O)[C@H]1C[C@H]1c1c(F)cccc1Cl)C1CCN(CCc2ccccn2)CC1 ZINC000303902357 855278250 /nfs/dbraw/zinc/27/82/50/855278250.db2.gz STVKWKIKUDVJGI-MOPGFXCFSA-N 0 3 415.940 4.143 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1cccc(NC(=O)C2CC2)c1 ZINC000303946646 855310719 /nfs/dbraw/zinc/31/07/19/855310719.db2.gz YEKCGQCURLUXCN-SFHVURJKSA-N 0 3 406.530 4.163 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)[C@]2(C)CCCc3ccccc32)cc1)[C@H]1CCCN(C)C1 ZINC000303960705 855322672 /nfs/dbraw/zinc/32/26/72/855322672.db2.gz WNHCGRDEVADICF-BKMJKUGQSA-N 0 3 419.569 4.086 20 0 HIADHN O=C(NC1CCN(Cc2ccccc2)CC1)c1c(F)cc(Br)cc1F ZINC000310533573 855366160 /nfs/dbraw/zinc/36/61/60/855366160.db2.gz FTKGVWLGFKSMJI-UHFFFAOYSA-N 0 3 409.274 4.122 20 0 HIADHN C[C@H](Cc1ccc(Br)cc1)N[C@H]1CCS(=O)(=O)c2ccc(F)cc21 ZINC000325113476 855401433 /nfs/dbraw/zinc/40/14/33/855401433.db2.gz JBPQGYNJRQNNIC-PXAZEXFGSA-N 0 3 412.324 4.028 20 0 HIADHN CC(C)(C)OC(=O)N1CCC[C@@H](NCc2cc(F)ccc2Br)CC1 ZINC000382710094 855433502 /nfs/dbraw/zinc/43/35/02/855433502.db2.gz ZYLCLVIIDSQTMQ-OAHLLOKOSA-N 0 3 401.320 4.467 20 0 HIADHN CC(C)(C)OC(=O)N1CC[C@H](CCNCc2cccc(F)c2Br)C1 ZINC000382770221 855434337 /nfs/dbraw/zinc/43/43/37/855434337.db2.gz URIAGQBKDZBPNA-ZDUSSCGKSA-N 0 3 401.320 4.325 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)c1cc(Br)ccc1F ZINC000383040563 855435916 /nfs/dbraw/zinc/43/59/16/855435916.db2.gz AQPNRWBSWBPIOE-OAHLLOKOSA-N 0 3 405.311 4.325 20 0 HIADHN C[C@@H]1[C@H](NC(=O)c2cc(Cl)ccc2Br)CCN1Cc1ccccc1 ZINC000383542407 855438017 /nfs/dbraw/zinc/43/80/17/855438017.db2.gz URLDEZQFNWFRKR-FZKQIMNGSA-N 0 3 407.739 4.495 20 0 HIADHN O=C(NC[C@H]1CCCN1Cc1ccccc1)c1cc(Br)ccc1Cl ZINC000390799265 855457300 /nfs/dbraw/zinc/45/73/00/855457300.db2.gz MXHOWERZWFHATO-MRXNPFEDSA-N 0 3 407.739 4.497 20 0 HIADHN CC(C)n1cc(Br)cc1C(=O)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000392774651 855466974 /nfs/dbraw/zinc/46/69/74/855466974.db2.gz YITCOLSXYXUMGZ-IBGZPJMESA-N 0 3 404.352 4.398 20 0 HIADHN CC(C)n1cc(Br)cc1C(=O)N[C@]1(C)CCN(Cc2ccccc2)C1 ZINC000405980836 855482546 /nfs/dbraw/zinc/48/25/46/855482546.db2.gz DKYLNMIIQWMPDP-HXUWFJFHSA-N 0 3 404.352 4.226 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)CCc2cc(Br)cs2)C1 ZINC000409851185 855688279 /nfs/dbraw/zinc/68/82/79/855688279.db2.gz YVKQQMJMWRQNKY-PBHICJAKSA-N 0 3 407.377 4.395 20 0 HIADHN CCOc1cc2c(cc1[C@@H]1C[C@@H]1C(=O)N(CCN(C)C)C1CCCCC1)O[C@@H](C)C2 ZINC000409882021 855704916 /nfs/dbraw/zinc/70/49/16/855704916.db2.gz GZIFDEVYWGAGQJ-XJABCFGWSA-N 0 3 414.590 4.235 20 0 HIADHN CCOc1cc2c(cc1[C@@H]1C[C@H]1C(=O)N(CCN(C)C)C1CCCCC1)O[C@@H](C)C2 ZINC000409882020 855705138 /nfs/dbraw/zinc/70/51/38/855705138.db2.gz GZIFDEVYWGAGQJ-RBDMOPTHSA-N 0 3 414.590 4.235 20 0 HIADHN C[C@H](NC(=O)Cc1c(F)ccc(Br)c1F)[C@@H](c1ccccc1)N(C)C ZINC000409946371 855739006 /nfs/dbraw/zinc/73/90/06/855739006.db2.gz HMCPZRSFKVEBGT-BUXKBTBVSA-N 0 3 411.290 4.077 20 0 HIADHN COc1ccc(-c2nc(C)c(C(=O)N(CCN(C)C)C3CCCC3)s2)c(F)c1 ZINC000409971606 855753271 /nfs/dbraw/zinc/75/32/71/855753271.db2.gz PCVLZWXSBNBTHM-UHFFFAOYSA-N 0 3 405.539 4.213 20 0 HIADHN CSc1ccccc1[C@@H](C)NC(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000410090499 855814761 /nfs/dbraw/zinc/81/47/61/855814761.db2.gz YRLHDDSDQOWAEH-KZNAEPCWSA-N 0 3 405.608 4.000 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)[C@H]1CCCC(F)(F)C1 ZINC000410092864 855815608 /nfs/dbraw/zinc/81/56/08/855815608.db2.gz CZVQBVAFWKMOIK-OALUTQOASA-N 0 3 402.489 4.403 20 0 HIADHN COc1cccc([C@H](CNC(=O)NCc2ccc(OC(C)C)cc2)N2CCCC2)c1 ZINC000410235381 855874178 /nfs/dbraw/zinc/87/41/78/855874178.db2.gz XECGNTVDLFZGED-QHCPKHFHSA-N 0 3 411.546 4.119 20 0 HIADHN C[C@H](CNC(=O)C(=O)Nc1ccccc1-c1ccc(-c2ccccc2)cc1)N(C)C ZINC000410320728 855926651 /nfs/dbraw/zinc/92/66/51/855926651.db2.gz GNTOZQWSCLIVKF-GOSISDBHSA-N 0 3 401.510 4.025 20 0 HIADHN Cc1cccc2oc(CCNCc3cnn(-c4ccc(Br)cc4)c3)nc21 ZINC000410333163 855934252 /nfs/dbraw/zinc/93/42/52/855934252.db2.gz MWVZOEBNEPCFAA-UHFFFAOYSA-N 0 3 411.303 4.417 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@H]2CCCC[C@H]2NCCc2nc3c(cccc3C)o2)cc1 ZINC000410358026 855947648 /nfs/dbraw/zinc/94/76/48/855947648.db2.gz HIKXBKFWEBSWJC-CTNGQTDRSA-N 0 3 412.555 4.362 20 0 HIADHN COc1cc(NC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)c(C)c(OC)c1 ZINC000410382030 855963276 /nfs/dbraw/zinc/96/32/76/855963276.db2.gz YIZZGIUWXFSZOC-OAQYLSRUSA-N 0 3 422.447 4.405 20 0 HIADHN CCNC(=O)COc1cccc(CN[C@@H](Cc2cccnc2)c2cccc(Cl)c2)c1 ZINC000425935477 856007890 /nfs/dbraw/zinc/00/78/90/856007890.db2.gz IOSZXHXDTULKPN-QHCPKHFHSA-N 0 3 423.944 4.324 20 0 HIADHN C[C@H](NC(=O)N1CCN(C2CCOCC2)C[C@@H]1C)c1ccc(Cl)c2ccccc21 ZINC000426200259 856171377 /nfs/dbraw/zinc/17/13/77/856171377.db2.gz GYXZLFUADVICRB-IRXDYDNUSA-N 0 3 415.965 4.449 20 0 HIADHN C[C@H](NC(=O)N1CCN(C2CCOCC2)C[C@H]1C)c1ccc(Cl)c2ccccc21 ZINC000426200260 856171640 /nfs/dbraw/zinc/17/16/40/856171640.db2.gz GYXZLFUADVICRB-SJORKVTESA-N 0 3 415.965 4.449 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)N[C@H](C)c1nc(C(F)(F)F)cs1 ZINC000426208105 856177004 /nfs/dbraw/zinc/17/70/04/856177004.db2.gz MMDLERVSTVJICD-CHWSQXEVSA-N 0 3 400.470 4.043 20 0 HIADHN Cc1ccccc1C(NC(=O)N1CCN(C2CCOCC2)C[C@H]1C)c1ccccc1C ZINC000426219426 856184026 /nfs/dbraw/zinc/18/40/26/856184026.db2.gz HYUDANQEBUTFGA-OAQYLSRUSA-N 0 3 421.585 4.288 20 0 HIADHN Cc1nc2ccc(CN(C)[C@H](C)c3cccc(N4CCCS4(=O)=O)c3)cc2s1 ZINC000426358032 856258254 /nfs/dbraw/zinc/25/82/54/856258254.db2.gz FNLUXADDPHAKCH-OAHLLOKOSA-N 0 3 415.584 4.338 20 0 HIADHN CN(C)CCN(C(=O)Cc1csc(Cc2cccc(Cl)c2)n1)C1CCCC1 ZINC000426409681 856279354 /nfs/dbraw/zinc/27/93/54/856279354.db2.gz HZVWZRSLQSAWLG-UHFFFAOYSA-N 0 3 405.995 4.263 20 0 HIADHN CC(C)(C)N1C[C@@H](c2nc(Cc3ccc(-n4cccn4)cc3)no2)[C@H](C(F)(F)F)C1 ZINC000426414336 856279804 /nfs/dbraw/zinc/27/98/04/856279804.db2.gz AVIZXBLWXQONRR-IAGOWNOFSA-N 0 3 419.451 4.222 20 0 HIADHN COc1cc(CN(C)C[C@H](O)COc2ccc(Oc3ccccc3)cc2)ccc1O ZINC000426418191 856281304 /nfs/dbraw/zinc/28/13/04/856281304.db2.gz FMIPEBVYEGPQEJ-IBGZPJMESA-N 0 3 409.482 4.065 20 0 HIADHN CC(C)CN(CCN(C)C)C(=O)Nc1cccc(C[S@@](=O)c2ccccc2)c1 ZINC000426542837 856340509 /nfs/dbraw/zinc/34/05/09/856340509.db2.gz FYSJGLXSLYLLHI-MUUNZHRXSA-N 0 3 401.576 4.046 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)Nc3nc4ccccc4s3)CC2)C[C@H](C)O1 ZINC000426633810 856385508 /nfs/dbraw/zinc/38/55/08/856385508.db2.gz JIWJMUVOXFRJHS-HOTGVXAUSA-N 0 3 402.564 4.040 20 0 HIADHN CN(C)Cc1cccc(NC(=O)N(C)[C@H](c2ccc(Cl)cc2)c2cnccn2)c1 ZINC000426644815 856391055 /nfs/dbraw/zinc/39/10/55/856391055.db2.gz XVUCCTSOKKBZRE-OAQYLSRUSA-N 0 3 409.921 4.445 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3c[nH]cc3-c3ccccc3F)CC2)C[C@@H](C)O1 ZINC000426667770 856403341 /nfs/dbraw/zinc/40/33/41/856403341.db2.gz ZTJWBSFCVKGDAR-QZTJIDSGSA-N 0 3 413.537 4.172 20 0 HIADHN COc1ccccc1[C@H](NC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1)c1ccco1 ZINC000426773746 856470533 /nfs/dbraw/zinc/47/05/33/856470533.db2.gz LIFCLLONGSTPSM-RDPSFJRHSA-N 0 3 419.525 4.294 20 0 HIADHN C[C@@H](NC(=O)N1CCCN(Cc2ccccc2)CC1)c1nc(C(F)(F)F)cs1 ZINC000426895463 856530906 /nfs/dbraw/zinc/53/09/06/856530906.db2.gz HYCLNQULYFWRTH-CQSZACIVSA-N 0 3 412.481 4.140 20 0 HIADHN Cc1nc(C)n(-c2ccccc2NC(=O)N(Cc2ccccc2)C2CCN(C)CC2)n1 ZINC000426952540 856560157 /nfs/dbraw/zinc/56/01/57/856560157.db2.gz XTKIOBSANJNBQV-UHFFFAOYSA-N 0 3 418.545 4.012 20 0 HIADHN CN1C[C@H](NC(=O)c2cc3ccccc3n2CC(F)(F)F)[C@@H](c2ccccc2)C1 ZINC000426986435 856580557 /nfs/dbraw/zinc/58/05/57/856580557.db2.gz KYVLZNUABCGNPF-MSOLQXFVSA-N 0 3 401.432 4.031 20 0 HIADHN CCc1oc(C(=O)OC)cc1CN1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1 ZINC000427013507 856595921 /nfs/dbraw/zinc/59/59/21/856595921.db2.gz DAAGGQPMXUBPLH-HNNXBMFYSA-N 0 3 413.449 4.197 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NC1CCC2(CCOCC2)CC1)c1cccc(OC)c1 ZINC000437461161 862824708 /nfs/dbraw/zinc/82/47/08/862824708.db2.gz SZIMNPXWKLTCRI-JOCHJYFZSA-N 0 3 417.594 4.117 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)C3(c4cccc(Cl)c4)CC3)CC2)C[C@H](C)O1 ZINC000427286535 856751392 /nfs/dbraw/zinc/75/13/92/856751392.db2.gz GHICCURAIYBKBV-HDICACEKSA-N 0 3 404.982 4.110 20 0 HIADHN Cc1ccc(-c2nc(C(=O)N3CCC(CCN4C[C@@H](C)O[C@@H](C)C4)CC3)cs2)o1 ZINC000427287400 856752437 /nfs/dbraw/zinc/75/24/37/856752437.db2.gz KJMOSYJSOXDSFT-CALCHBBNSA-N 0 3 417.575 4.063 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)C3(c4ccc(Cl)cc4)CC3)CC2)C[C@@H](C)O1 ZINC000427290313 856753493 /nfs/dbraw/zinc/75/34/93/856753493.db2.gz AITYUKNCYYYJNU-QZTJIDSGSA-N 0 3 404.982 4.110 20 0 HIADHN Cc1oc(-c2ccccc2)nc1C(=O)N1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000427288135 856754069 /nfs/dbraw/zinc/75/40/69/856754069.db2.gz OCRMSMHEDCSHGM-ROUUACIJSA-N 0 3 411.546 4.002 20 0 HIADHN Cc1ccc(CCCCC(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)cc1 ZINC000427292484 856754798 /nfs/dbraw/zinc/75/47/98/856754798.db2.gz QSBXNZOFRDROQA-VXKWHMMOSA-N 0 3 400.607 4.446 20 0 HIADHN COc1ccc(CCC(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)cc1Cl ZINC000427292514 856756429 /nfs/dbraw/zinc/75/64/29/856756429.db2.gz QWCQDQHLNMQVAD-ROUUACIJSA-N 0 3 422.997 4.019 20 0 HIADHN CCc1cccc2c(CC(=O)N3CCC(CCN4C[C@@H](C)O[C@H](C)C4)CC3)c[nH]c21 ZINC000427294726 856757430 /nfs/dbraw/zinc/75/74/30/856757430.db2.gz GQAKWZLGPVAXEP-RTBURBONSA-N 0 3 411.590 4.011 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)[C@@H]3CCCC[C@@H]3C(F)(F)F)CC2)C[C@@H](C)O1 ZINC000427298139 856758860 /nfs/dbraw/zinc/75/88/60/856758860.db2.gz ZUYGPSQZAVTIOG-RWQQGDIJSA-N 0 3 404.517 4.093 20 0 HIADHN Cc1sc(-c2ccco2)nc1C(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000427299391 856759973 /nfs/dbraw/zinc/75/99/73/856759973.db2.gz MIOJNJMGLMZHBV-IYBDPMFKSA-N 0 3 417.575 4.063 20 0 HIADHN Cc1ccc(Br)cc1C(=O)N1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000427303434 856761178 /nfs/dbraw/zinc/76/11/78/856761178.db2.gz ACSRAPXVKIQGFZ-IRXDYDNUSA-N 0 3 423.395 4.109 20 0 HIADHN Cc1ccc(C(C)(C)CC(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)cc1 ZINC000427307745 856763566 /nfs/dbraw/zinc/76/35/66/856763566.db2.gz JOWNJTJRUHLZFJ-OYRHEFFESA-N 0 3 400.607 4.401 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)CSc3ccc(Cl)cc3)CC2)C[C@H](C)O1 ZINC000427312009 856764375 /nfs/dbraw/zinc/76/43/75/856764375.db2.gz GUAXYJOTZWSDAN-CALCHBBNSA-N 0 3 411.011 4.170 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3ccc(Oc4cccnc4)cc3)CC2)C[C@@H](C)O1 ZINC000427321956 856770508 /nfs/dbraw/zinc/77/05/08/856770508.db2.gz RUBSMIUZVKUPCT-WOJBJXKFSA-N 0 3 423.557 4.225 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3cc(Cl)cc4cccnc43)CC2)C[C@@H](C)O1 ZINC000427322941 856771713 /nfs/dbraw/zinc/77/17/13/856771713.db2.gz VKSOBOLEIYTUMU-IAGOWNOFSA-N 0 3 415.965 4.240 20 0 HIADHN COc1ccc(CCCCC(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)cc1 ZINC000427323256 856771984 /nfs/dbraw/zinc/77/19/84/856771984.db2.gz WXJDHLYREIGTMI-OYRHEFFESA-N 0 3 416.606 4.146 20 0 HIADHN Cc1nc(-c2ccco2)ccc1C(=O)N1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000427323364 856772168 /nfs/dbraw/zinc/77/21/68/856772168.db2.gz XNKCGGRRPYIXTL-ROUUACIJSA-N 0 3 411.546 4.002 20 0 HIADHN CC(C)c1ccc(CCC(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)cc1 ZINC000427332136 856776739 /nfs/dbraw/zinc/77/67/39/856776739.db2.gz SAKZPBKKKRTGRE-SFTDATJTSA-N 0 3 400.607 4.481 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)[C@@H]3CCSc4ccccc43)CC2)C[C@@H](C)O1 ZINC000427346720 856784510 /nfs/dbraw/zinc/78/45/10/856784510.db2.gz KUSMRPHWMOWUPN-DBXWQHBBSA-N 0 3 402.604 4.004 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)CCCc3ccc(Cl)cc3)CC2)C[C@H](C)O1 ZINC000427356518 856789640 /nfs/dbraw/zinc/78/96/40/856789640.db2.gz FWTCSNYZVVIIGO-KDURUIRLSA-N 0 3 406.998 4.401 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)Cc1ccc(F)c(F)c1 ZINC000427359145 856791856 /nfs/dbraw/zinc/79/18/56/856791856.db2.gz UDUFQWCEHUPIEQ-UHFFFAOYSA-N 0 3 400.391 4.117 20 0 HIADHN CC1CCN(c2ccc(C(=O)N3CC[C@@H](C)N(Cc4ccccc4)CC3)cn2)CC1 ZINC000437476957 862837404 /nfs/dbraw/zinc/83/74/04/862837404.db2.gz SLMQJXJYWLGAOT-OAQYLSRUSA-N 0 3 406.574 4.055 20 0 HIADHN CCc1c(NC(=O)CCCN2CCN(c3ccccc3)CC2)cnn1CCC(C)C ZINC000427437622 856819904 /nfs/dbraw/zinc/81/99/04/856819904.db2.gz YDTSDUMJHPVPBU-UHFFFAOYSA-N 0 3 411.594 4.033 20 0 HIADHN COc1cccc([C@H](CN[C@H](C)c2ncc(Br)cc2F)N2CCCC2)c1 ZINC000427600512 856884401 /nfs/dbraw/zinc/88/44/01/856884401.db2.gz GWXTYGMOHFMJAU-KUHUBIRLSA-N 0 3 422.342 4.480 20 0 HIADHN C[C@@H](NCCC1CCN(CC(F)(F)F)CC1)c1ncc(Br)cc1F ZINC000427686033 856908302 /nfs/dbraw/zinc/90/83/02/856908302.db2.gz PHHOAZOVOURVTL-LLVKDONJSA-N 0 3 412.269 4.298 20 0 HIADHN CC(C)(C)n1ncc(C(=O)NC[C@]2(C)CCCN2Cc2ccccc2)c1C(F)(F)F ZINC000427979414 857030564 /nfs/dbraw/zinc/03/05/64/857030564.db2.gz ORYUEYHNNVALKL-NRFANRHFSA-N 0 3 422.495 4.441 20 0 HIADHN CC1CCN(Cc2csc(NC(=O)CN[C@H](c3cccs3)C3CC3)n2)CC1 ZINC000428291925 857143530 /nfs/dbraw/zinc/14/35/30/857143530.db2.gz VRKXMYGDOIBQDW-IBGZPJMESA-N 0 3 404.605 4.116 20 0 HIADHN COc1ccccc1/C=C/CNC1(C(=O)Nc2ccc(OC)c(OC)c2)CCCC1 ZINC000428368149 857177442 /nfs/dbraw/zinc/17/74/42/857177442.db2.gz BZGCIWWJEIOWEZ-CSKARUKUSA-N 0 3 410.514 4.267 20 0 HIADHN Cc1ccc(C)c(CN(C)C(=O)NCCCCN2CCN(c3ccccc3)CC2)c1 ZINC000428474977 857215756 /nfs/dbraw/zinc/21/57/56/857215756.db2.gz UYYQZIAMSJIVLZ-UHFFFAOYSA-N 0 3 408.590 4.047 20 0 HIADHN c1sc(COc2ccccc2)nc1CNC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000428541016 857252409 /nfs/dbraw/zinc/25/24/09/857252409.db2.gz ONWSKVPPXJKMKY-HSZRJFAPSA-N 0 3 423.582 4.103 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@@H](O)C2)c1)C1(c2c(Cl)cccc2Cl)CC1 ZINC000428542449 857254330 /nfs/dbraw/zinc/25/43/30/857254330.db2.gz RETYUWYXOAIOAU-MRXNPFEDSA-N 0 3 405.325 4.230 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@@H](O)C2)c1)c1cccc2[nH]c(-c3cccs3)nc21 ZINC000428548655 857258815 /nfs/dbraw/zinc/25/88/15/857258815.db2.gz OGCFLRSAJKCRLX-QGZVFWFLSA-N 0 3 418.522 4.110 20 0 HIADHN CCCOc1ccc(C(=O)Nc2cccc(CN3CC[C@@H](O)C3)c2)c(OC(C)C)c1 ZINC000428550394 857259936 /nfs/dbraw/zinc/25/99/36/857259936.db2.gz ISHXVZZWIAZOHD-HXUWFJFHSA-N 0 3 412.530 4.082 20 0 HIADHN C[C@H](CN1CCN(CCCc2nc(-c3cccs3)no2)CC1)c1ccc(F)cc1 ZINC000437575469 862894032 /nfs/dbraw/zinc/89/40/32/862894032.db2.gz FWUNXESBMNARES-QGZVFWFLSA-N 0 3 414.550 4.291 20 0 HIADHN O=C(c1ncc(F)cc1F)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000428734972 857313569 /nfs/dbraw/zinc/31/35/69/857313569.db2.gz OXUJXXJWCCDJGS-UHFFFAOYSA-N 0 3 414.283 4.405 20 0 HIADHN COC(=O)[C@@]1(c2ccccc2)CCN(Cc2cccc(C(=O)Nc3ccccc3)c2)C1 ZINC000428791449 857341842 /nfs/dbraw/zinc/34/18/42/857341842.db2.gz ZWYDJIYXSAFBMQ-SANMLTNESA-N 0 3 414.505 4.256 20 0 HIADHN CC(C)(C)n1ncnc1CN(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000428798029 857346890 /nfs/dbraw/zinc/34/68/90/857346890.db2.gz GGHPPYNNRHKNMM-HSZRJFAPSA-N 0 3 418.589 4.095 20 0 HIADHN c1ccc(CN2CCC[C@H](N(Cc3noc(C4CC4)n3)Cc3ccncc3)C2)cc1 ZINC000428802817 857349512 /nfs/dbraw/zinc/34/95/12/857349512.db2.gz KANGZPKXIWXDRL-QFIPXVFZSA-N 0 3 403.530 4.009 20 0 HIADHN COc1ncccc1CN(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000428813588 857357223 /nfs/dbraw/zinc/35/72/23/857357223.db2.gz QAUNGDUJROMXGU-XMMPIXPASA-N 0 3 402.542 4.152 20 0 HIADHN COc1cncc(CN(Cc2ccncc2)[C@@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000428814737 857357746 /nfs/dbraw/zinc/35/77/46/857357746.db2.gz SSCJJKATHASQIQ-XMMPIXPASA-N 0 3 402.542 4.152 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3ncc(C(C)(C)C)s3)CC2)C[C@H](C)O1 ZINC000428846293 857370418 /nfs/dbraw/zinc/37/04/18/857370418.db2.gz BTURKAKDQMDNJZ-IYBDPMFKSA-N 0 3 408.612 4.184 20 0 HIADHN CCc1cc(NC(=O)N(CCN(C)Cc2ccccc2)Cc2ccccc2)n(C)n1 ZINC000428886204 857390026 /nfs/dbraw/zinc/39/00/26/857390026.db2.gz LYFLIBLLVFSZDQ-UHFFFAOYSA-N 0 3 405.546 4.149 20 0 HIADHN C[C@H]1CCN(C(=O)Nc2ccccc2C(=O)N2CCCC2)CCN1Cc1ccccc1 ZINC000437597222 862910845 /nfs/dbraw/zinc/91/08/45/862910845.db2.gz BXUDWPCBGVTGSW-FQEVSTJZSA-N 0 3 420.557 4.051 20 0 HIADHN Cc1c2cc(Cl)ccc2oc1C(=O)N(C)C[C@]1(O)CCN(Cc2ccccc2)C1 ZINC000428974799 857441356 /nfs/dbraw/zinc/44/13/56/857441356.db2.gz DTXLFTDQNAOZAU-HSZRJFAPSA-N 0 3 412.917 4.104 20 0 HIADHN CCN(Cc1ccccc1Cl)C(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000428998066 857449627 /nfs/dbraw/zinc/44/96/27/857449627.db2.gz KAOGPHYTZUSIJM-NRFANRHFSA-N 0 3 415.965 4.163 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N1CCC(c2ncccc2Cl)CC1 ZINC000429013232 857458250 /nfs/dbraw/zinc/45/82/50/857458250.db2.gz WIILPWKAXSMCPU-UWJYYQICSA-N 0 3 412.965 4.145 20 0 HIADHN CC(C)N(Cc1ccc(F)cc1)C(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000429033861 857467221 /nfs/dbraw/zinc/46/72/21/857467221.db2.gz GOHVMWAVHVVAIO-HSZRJFAPSA-N 0 3 413.537 4.037 20 0 HIADHN O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)Nc1ccc(-c2nccs2)cc1 ZINC000429036920 857468568 /nfs/dbraw/zinc/46/85/68/857468568.db2.gz VOWRHQVJSTVBCG-OAQYLSRUSA-N 0 3 422.554 4.223 20 0 HIADHN CCN(C(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1)[C@@H](C)c1ccc(F)cc1 ZINC000429039844 857470039 /nfs/dbraw/zinc/47/00/39/857470039.db2.gz GCKPOEBJMRBULO-WMZHIEFXSA-N 0 3 413.537 4.209 20 0 HIADHN CO[C@H](C)c1cccc(NC(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)c1 ZINC000429060450 857485506 /nfs/dbraw/zinc/48/55/06/857485506.db2.gz PBJLHFJWPNBMKH-GBESFXJTSA-N 0 3 403.567 4.137 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3ccc4ncsc4c3)CC2)C[C@H](C)O1 ZINC000429076213 857496826 /nfs/dbraw/zinc/49/68/26/857496826.db2.gz MMCXMFIVUQZHRO-IYBDPMFKSA-N 0 3 402.564 4.040 20 0 HIADHN C[C@H](NCC[S@@](=O)c1cc(Cl)ccc1Cl)[C@H]1OCCc2sccc21 ZINC000429168790 857539318 /nfs/dbraw/zinc/53/93/18/857539318.db2.gz QUZPPTZKOCXELJ-ZCUMQKNUSA-N 0 3 404.384 4.455 20 0 HIADHN CN(C)[C@@H](CNC(=O)N(C)[C@@H](c1ccc(Cl)cc1)c1cnccn1)c1ccccc1 ZINC000429191380 857546724 /nfs/dbraw/zinc/54/67/24/857546724.db2.gz GOMWVMUYAPDNNY-VXKWHMMOSA-N 0 3 423.948 4.164 20 0 HIADHN CCCn1ccnc1CCCN(C)CC(=O)Nc1cc(C(F)(F)F)ccc1Cl ZINC000429244816 857571314 /nfs/dbraw/zinc/57/13/14/857571314.db2.gz HWFYKCJFAXGZOX-UHFFFAOYSA-N 0 3 416.875 4.468 20 0 HIADHN CCCn1ccnc1CCCN(C)CC[S@](=O)c1cc(Cl)ccc1Cl ZINC000429263269 857581716 /nfs/dbraw/zinc/58/17/16/857581716.db2.gz XSHJFJUGJKHYSG-VWLOTQADSA-N 0 3 402.391 4.272 20 0 HIADHN CCCN(C(=O)NCC1CCC(OC)CC1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000429318873 857602505 /nfs/dbraw/zinc/60/25/05/857602505.db2.gz PJGNRKFLYDTCLF-APKLWFBNSA-N 0 3 401.595 4.278 20 0 HIADHN O=C(NCC(F)(F)F)[C@H]1CCN(Cc2cccc3c(Br)cccc23)C1 ZINC000429344618 857611603 /nfs/dbraw/zinc/61/16/03/857611603.db2.gz KJBDPZYBCVURFU-ZDUSSCGKSA-N 0 3 415.253 4.103 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)NC[C@H](c1ccccc1)C(C)(C)CO ZINC000437614570 862932117 /nfs/dbraw/zinc/93/21/17/862932117.db2.gz ZVBNEIWZZIHTEL-ZJSXRUAMSA-N 0 3 423.601 4.095 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)NC[C@H](c1ccccc1)C(C)(C)CO ZINC000437614567 862932220 /nfs/dbraw/zinc/93/22/20/862932220.db2.gz ZVBNEIWZZIHTEL-XUZZJYLKSA-N 0 3 423.601 4.095 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)NC[C@@H](c1ccccc1)C(C)(C)CO ZINC000437614560 862932398 /nfs/dbraw/zinc/93/23/98/862932398.db2.gz ZVBNEIWZZIHTEL-QPPBQGQZSA-N 0 3 423.601 4.095 20 0 HIADHN C[C@@H](NC[C@@H](CO)Cc1ccccc1Br)c1nc2c(s1)CCCC2 ZINC000429415956 857654432 /nfs/dbraw/zinc/65/44/32/857654432.db2.gz JLVWTFPGXKXSSL-KGLIPLIRSA-N 0 3 409.393 4.286 20 0 HIADHN OC[C@@H](CN[C@H](c1ccccc1)c1ccccn1)Cc1cccc(Br)c1 ZINC000429418626 857655418 /nfs/dbraw/zinc/65/54/18/857655418.db2.gz OGKJIOXEJHWHRS-XMSQKQJNSA-N 0 3 411.343 4.374 20 0 HIADHN C[C@@H](NC(=O)Nc1ccnn1Cc1cccc(Cl)c1Cl)C1=CCN(C)CC1 ZINC000429539581 857731947 /nfs/dbraw/zinc/73/19/47/857731947.db2.gz QQGNNBBYWJODJO-CYBMUJFWSA-N 0 3 408.333 4.010 20 0 HIADHN C[C@H]1CCc2c(sc3nc(CCN4CCC(c5ccncc5)CC4)nc(N)c23)C1 ZINC000429573224 857759098 /nfs/dbraw/zinc/75/90/98/857759098.db2.gz YGODNQAOSWEXGZ-HNNXBMFYSA-N 0 3 407.587 4.215 20 0 HIADHN CSc1c(F)cc(NC(=O)NC[C@@H]2CN(Cc3ccccc3)CCCO2)cc1F ZINC000429627607 857806374 /nfs/dbraw/zinc/80/63/74/857806374.db2.gz JAWPAZFBHSLNJE-QGZVFWFLSA-N 0 3 421.513 4.099 20 0 HIADHN CCn1c2ccccc2nc1[C@@H]1CCCN1C[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000429677998 857831533 /nfs/dbraw/zinc/83/15/33/857831533.db2.gz MHUPCYWUXAJRRH-RDGATRHJSA-N 0 3 418.585 4.484 20 0 HIADHN CCn1c2ccccc2nc1[C@H]1CCCN1C[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000429677996 857831641 /nfs/dbraw/zinc/83/16/41/857831641.db2.gz MHUPCYWUXAJRRH-RCZVLFRGSA-N 0 3 418.585 4.484 20 0 HIADHN COc1cccc(-c2nc(CN[C@@H]3[C@H]4CCO[C@H]4C34CCCC4)cs2)c1OC ZINC000429711574 857846196 /nfs/dbraw/zinc/84/61/96/857846196.db2.gz FSIONRNNINZEPC-NSISKUIASA-N 0 3 400.544 4.265 20 0 HIADHN Cc1cccc(OC(F)F)c1NC(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000429748075 857868183 /nfs/dbraw/zinc/86/81/83/857868183.db2.gz ZDBWGEAHDWUJIA-GOSISDBHSA-N 0 3 419.472 4.009 20 0 HIADHN CC(C)(C)C(=O)c1ccc(NC(=O)NC[C@@H]2CN(Cc3ccccc3)CCCO2)cc1 ZINC000429767733 857878660 /nfs/dbraw/zinc/87/86/60/857878660.db2.gz BKLHDDDYAUWLJI-JOCHJYFZSA-N 0 3 423.557 4.328 20 0 HIADHN CC(C)N1CC[C@H](N[C@@H](C)C(=O)Nc2nccs2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000429791488 857886287 /nfs/dbraw/zinc/88/62/87/857886287.db2.gz VYBAAHQYDPOZNK-ZLIFDBKOSA-N 0 3 410.946 4.076 20 0 HIADHN C[C@H](C(=O)N(CCN(C)C)Cc1cccc(Cl)c1)[C@@H]1OCCc2sccc21 ZINC000429804527 857890536 /nfs/dbraw/zinc/89/05/36/857890536.db2.gz CZJSGNKRWLLUQW-YWZLYKJASA-N 0 3 406.979 4.242 20 0 HIADHN CC(F)(F)c1ccc(C(=O)NCCCCN2CCN(Cc3ccccc3)CC2)cc1 ZINC000429849461 857909650 /nfs/dbraw/zinc/90/96/50/857909650.db2.gz KWNUBDPKTZEUJC-UHFFFAOYSA-N 0 3 415.528 4.126 20 0 HIADHN C[C@H](C(=O)N(CCCc1ccccc1)CCN(C)C)[C@H]1OCCc2sccc21 ZINC000429887915 857928589 /nfs/dbraw/zinc/92/85/89/857928589.db2.gz MJSGCESTJYZADC-PGRDOPGGSA-N 0 3 400.588 4.021 20 0 HIADHN C[C@H](C(=O)N(CCCc1ccccc1)CCN(C)C)[C@@H]1OCCc2sccc21 ZINC000429887913 857929267 /nfs/dbraw/zinc/92/92/67/857929267.db2.gz MJSGCESTJYZADC-AVRDEDQJSA-N 0 3 400.588 4.021 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Cc1c(C)nn(CC)c1C)c1ccc(C(F)(F)F)cc1 ZINC000429891315 857931005 /nfs/dbraw/zinc/93/10/05/857931005.db2.gz ZPFIPWAIIAKDKV-HXUWFJFHSA-N 0 3 424.511 4.280 20 0 HIADHN COC(=O)[C@]1(c2ccccc2)CCN(Cc2cn(C)nc2-c2ccccc2Cl)C1 ZINC000430086745 858025021 /nfs/dbraw/zinc/02/50/21/858025021.db2.gz QITZJTWSJXSIQB-HSZRJFAPSA-N 0 3 409.917 4.057 20 0 HIADHN CN(CCSc1nnc(CN2CCCC2)n1-c1ccccc1)Cc1ccccc1 ZINC000430098867 858031825 /nfs/dbraw/zinc/03/18/25/858031825.db2.gz XBOUOEHWSGCROD-UHFFFAOYSA-N 0 3 407.587 4.087 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)CO[C@@H]3CCCc4ccccc43)c(C)c2)CC1 ZINC000430098868 858031954 /nfs/dbraw/zinc/03/19/54/858031954.db2.gz KHDPYFVRRJBXLH-XMMPIXPASA-N 0 3 407.558 4.170 20 0 HIADHN Cc1[nH]c2ccc(Cl)cc2c1C(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000430107205 858034131 /nfs/dbraw/zinc/03/41/31/858034131.db2.gz PPKOFGCTHLVBPM-IBGZPJMESA-N 0 3 411.933 4.151 20 0 HIADHN CCn1c(SC[C@@H]2CN(Cc3ccccc3)CCCO2)nnc1-c1ccccc1 ZINC000430120020 858040245 /nfs/dbraw/zinc/04/02/45/858040245.db2.gz GKASMJNVIOHCBM-NRFANRHFSA-N 0 3 408.571 4.348 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N[C@H]2C[C@@H]2c2ccccc2OC(F)F)C1 ZINC000437648571 862981370 /nfs/dbraw/zinc/98/13/70/862981370.db2.gz VPBLOTLDNPAJEN-QOJCHSLYSA-N 0 3 415.484 4.279 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCCC[C@@H]1c1nccn1CC)c1ccsc1 ZINC000430185521 858072233 /nfs/dbraw/zinc/07/22/33/858072233.db2.gz DYIBSYISHFPMJU-RTBURBONSA-N 0 3 403.596 4.284 20 0 HIADHN CCC[C@H](NC(=O)[C@H](C)N1CC[C@H](C(=O)N(C)c2ccccc2)C1)c1ccccc1 ZINC000430290348 858109960 /nfs/dbraw/zinc/10/99/60/858109960.db2.gz CCMQRJVIRZWZKX-RRPUWOKSSA-N 0 3 407.558 4.017 20 0 HIADHN COC(=O)c1sc2ccccc2c1CN1CC[C@@H](C(=O)N(C)c2ccccc2)C1 ZINC000430306636 858116713 /nfs/dbraw/zinc/11/67/13/858116713.db2.gz YRXNMFBXWYGACU-MRXNPFEDSA-N 0 3 408.523 4.173 20 0 HIADHN CN(C)Cc1cccc(NC(=O)N(Cc2cnn(C)c2)Cc2ccc(Cl)cc2)c1 ZINC000430365208 858134999 /nfs/dbraw/zinc/13/49/99/858134999.db2.gz ZHFXMMQIMONIFS-UHFFFAOYSA-N 0 3 411.937 4.369 20 0 HIADHN CCSc1nccnc1C(=O)N(c1cccc(SC)c1)C1CCN(C)CC1 ZINC000430550912 858216170 /nfs/dbraw/zinc/21/61/70/858216170.db2.gz OYSPJRQDOMYASB-UHFFFAOYSA-N 0 3 402.589 4.052 20 0 HIADHN Cc1ccc(SC2(C(=O)NC3CCN(CCOC(C)C)CC3)CCCC2)cc1 ZINC000430690113 858270830 /nfs/dbraw/zinc/27/08/30/858270830.db2.gz HEDXMZSMPXFCNZ-UHFFFAOYSA-N 0 3 404.620 4.406 20 0 HIADHN COc1ccc(CCC(=O)N2CCCN(CCSCc3ccccc3)CC2)cc1 ZINC000430726429 858279596 /nfs/dbraw/zinc/27/95/96/858279596.db2.gz DTLSXAMUGNYJAE-UHFFFAOYSA-N 0 3 412.599 4.096 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](NC[C@@H]2CCC(F)(F)C2)c2ccc(F)c(F)c2)c1 ZINC000430739842 858284090 /nfs/dbraw/zinc/28/40/90/858284090.db2.gz FLGLLIPBAPTGES-YJYMSZOUSA-N 0 3 415.452 4.483 20 0 HIADHN CNC(=O)[C@@]1(C)CCN(Cc2c(C)nn(-c3ccccc3)c2Oc2ccc(F)cc2)C1 ZINC000430777106 858301032 /nfs/dbraw/zinc/30/10/32/858301032.db2.gz SYHQNFKYFHLJAO-DEOSSOPVSA-N 0 3 422.504 4.070 20 0 HIADHN CN(C)Cc1ccccc1CNC(=O)CCc1cc(Cl)ccc1Br ZINC000430778186 858301335 /nfs/dbraw/zinc/30/13/35/858301335.db2.gz PKFJUYNVCDQBHF-UHFFFAOYSA-N 0 3 409.755 4.413 20 0 HIADHN CCOc1cc(CN2CC[C@@H](C(=O)N(C)c3ccccc3)C2)ccc1OC(F)F ZINC000430873862 858349978 /nfs/dbraw/zinc/34/99/78/858349978.db2.gz AFWHECOKOCXZOZ-QGZVFWFLSA-N 0 3 404.457 4.172 20 0 HIADHN COc1cc(CN2CC[C@H](C(=O)N(C)c3ccccc3)C2)ccc1OCC(F)(F)F ZINC000430877733 858351446 /nfs/dbraw/zinc/35/14/46/858351446.db2.gz JUOPVRSKJQUHPQ-KRWDZBQOSA-N 0 3 422.447 4.121 20 0 HIADHN Cc1cc([C@H]2CCCN2C(=O)N[C@@H](C)C2=CCN(C)CC2)ccc1Br ZINC000430886526 858354735 /nfs/dbraw/zinc/35/47/35/858354735.db2.gz UJHDJBOPFGGKKN-HNAYVOBHSA-N 0 3 406.368 4.254 20 0 HIADHN COc1ccc([C@@H](CNC(=O)Cc2c[nH]c3cccc(Cl)c23)N2CCCC2)cc1 ZINC000430900900 858360996 /nfs/dbraw/zinc/36/09/96/858360996.db2.gz RLAMJEBUDILGHG-OAQYLSRUSA-N 0 3 411.933 4.326 20 0 HIADHN CCN(C(=O)NCc1c(F)cc(F)c(F)c1F)[C@H]1CCN(Cc2ccccc2)C1 ZINC000430955260 858381551 /nfs/dbraw/zinc/38/15/51/858381551.db2.gz HWAHUNOGNTUWSV-HNNXBMFYSA-N 0 3 409.427 4.049 20 0 HIADHN CC[C@H](c1ccccc1)N1CC(=O)N(C[C@@H](c2cccc(OC)c2)N2CCCC2)C1=O ZINC000430955514 858382251 /nfs/dbraw/zinc/38/22/51/858382251.db2.gz AUGQIFWPFYXELL-PKTZIBPZSA-N 0 3 421.541 4.248 20 0 HIADHN O=C1N[C@@H](c2ccc(Cl)cc2Cl)C(=O)N1C[C@H](c1cccs1)N1CCCC1 ZINC000430976221 858389180 /nfs/dbraw/zinc/38/91/80/858389180.db2.gz RDHMOKVTIMWXJC-WBVHZDCISA-N 0 3 424.353 4.485 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)N[C@@H]3C[C@H]3c3cccc4ccccc43)CC2)C[C@H](C)O1 ZINC000431057828 858425196 /nfs/dbraw/zinc/42/51/96/858425196.db2.gz PLISXXOGTHBEMH-BWSHLYMBSA-N 0 3 421.585 4.227 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)NC[C@@H]1CCC(F)(F)C1 ZINC000431098023 858446316 /nfs/dbraw/zinc/44/63/16/858446316.db2.gz OHIBXVIKHURCCI-OAHLLOKOSA-N 0 3 407.427 4.214 20 0 HIADHN CC[C@H](c1ccccc1)N1CC(=O)N(C[C@@H]2CCCN(Cc3cccs3)C2)C1=O ZINC000431172478 858486296 /nfs/dbraw/zinc/48/62/96/858486296.db2.gz XKIZQJKLUKEHFH-WIYYLYMNSA-N 0 3 411.571 4.376 20 0 HIADHN C[C@@H](c1ccccc1)N1CCC(NS(=O)(=O)Cc2cc(Cl)ccc2F)CC1 ZINC000431276899 858543145 /nfs/dbraw/zinc/54/31/45/858543145.db2.gz SVYFSTKDCUDIAY-HNNXBMFYSA-N 0 3 410.942 4.124 20 0 HIADHN C[C@@H]1CN(Cc2cccc(CN[C@H]3CCCOc4cc5c(cc43)CCC5)c2)CCO1 ZINC000431328766 858567624 /nfs/dbraw/zinc/56/76/24/858567624.db2.gz OSYZCAPCDQSYPX-CLOONOSVSA-N 0 3 406.570 4.400 20 0 HIADHN CCc1ccc(C(C)(C)CNC(=O)N(C)C2CCN(CCc3ccccn3)CC2)cc1 ZINC000431648697 858712034 /nfs/dbraw/zinc/71/20/34/858712034.db2.gz RAXNTLFPYFKXBG-UHFFFAOYSA-N 0 3 422.617 4.270 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)c1cccc(-c2noc(C(F)(F)F)n2)c1 ZINC000431824006 858828743 /nfs/dbraw/zinc/82/87/43/858828743.db2.gz SHNIXXLOESSTKY-CQSZACIVSA-N 0 3 418.419 4.006 20 0 HIADHN COc1ccc(NC(=O)[C@@H]2CCCCN2C2CCCC2)cc1OCc1ccncc1 ZINC000431907048 858865330 /nfs/dbraw/zinc/86/53/30/858865330.db2.gz LCTUGCSIEDPTCI-NRFANRHFSA-N 0 3 409.530 4.405 20 0 HIADHN O=C(Nc1ccc(Oc2ccc(Cl)cn2)cc1)[C@@H]1CCCN1C1CCOCC1 ZINC000432195556 859041913 /nfs/dbraw/zinc/04/19/13/859041913.db2.gz LGCNDNZPSASOMF-IBGZPJMESA-N 0 3 401.894 4.109 20 0 HIADHN COc1cnccc1N1CCN(C(=O)Nc2ccc(N3CCCC[C@@H]3C)cc2C)CC1 ZINC000432213338 859051142 /nfs/dbraw/zinc/05/11/42/859051142.db2.gz OAPDUIUWXANDBI-IBGZPJMESA-N 0 3 423.561 4.132 20 0 HIADHN O=C(CN1CCC(NCc2ccc(F)c(Cl)c2Cl)CC1)Nc1ccccc1 ZINC000432256394 859070946 /nfs/dbraw/zinc/07/09/46/859070946.db2.gz CHEGRPZMOBFICX-UHFFFAOYSA-N 0 3 410.320 4.325 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)N1CCO[C@@H](c2cccc(Cl)c2)C1 ZINC000467561516 881384451 /nfs/dbraw/zinc/38/44/51/881384451.db2.gz CNMNZEGWZYXSTJ-RBUKOAKNSA-N 0 3 419.978 4.322 20 0 HIADHN O=C(CNC1CC(c2cccc(Br)c2)C1)Nc1ccc(F)c(F)c1F ZINC000432423921 859158682 /nfs/dbraw/zinc/15/86/82/859158682.db2.gz HMXOWQAPCKCYSF-UHFFFAOYSA-N 0 3 413.237 4.341 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)NCc1ccc2c(c1)COC2 ZINC000432495682 859192853 /nfs/dbraw/zinc/19/28/53/859192853.db2.gz JCORGUMVAPPPQU-UHFFFAOYSA-N 0 3 421.463 4.009 20 0 HIADHN FC(F)(F)c1ccc(CN2CCC[C@H](CN3CCN(c4ccccn4)CC3)C2)s1 ZINC000432737598 859327418 /nfs/dbraw/zinc/32/74/18/859327418.db2.gz LRLWUDHJWBRVEH-QGZVFWFLSA-N 0 3 424.536 4.196 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3cncc(-c4ccccc4)c3)CC2)C[C@H](C)O1 ZINC000467606886 881413024 /nfs/dbraw/zinc/41/30/24/881413024.db2.gz WURWOSSUCPWUJI-BGYRXZFFSA-N 0 3 407.558 4.100 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)c3cncc(-c4ccccc4)c3)CC2)C[C@H](C)O1 ZINC000467606887 881413319 /nfs/dbraw/zinc/41/33/19/881413319.db2.gz WURWOSSUCPWUJI-PMACEKPBSA-N 0 3 407.558 4.100 20 0 HIADHN Cc1[nH]c2ccccc2c1C1=CCN(S(=O)(=O)c2ccc(CN(C)C)cc2)CC1 ZINC000432873115 859400889 /nfs/dbraw/zinc/40/08/89/859400889.db2.gz PZRHQZKTEMFNEF-UHFFFAOYSA-N 0 3 409.555 4.016 20 0 HIADHN Cc1nc(-c2ccccc2)sc1[C@H](C)NS(=O)(=O)c1ccc(CN(C)C)cc1 ZINC000432877069 859402262 /nfs/dbraw/zinc/40/22/62/859402262.db2.gz CUSXWASUFAKHEL-INIZCTEOSA-N 0 3 415.584 4.220 20 0 HIADHN O=C(CN1CCC[C@H](c2ccccc2)C1)N1CCC[C@H]1c1ccc2c(c1)OCCO2 ZINC000433067560 859507113 /nfs/dbraw/zinc/50/71/13/859507113.db2.gz LEQDTJZJGGXTFJ-VXKWHMMOSA-N 0 3 406.526 4.001 20 0 HIADHN CCc1ccc([C@H](CNC(=O)Nc2cccc([S@](C)=O)c2)N(CC)CC)cc1 ZINC000433137472 859535311 /nfs/dbraw/zinc/53/53/11/859535311.db2.gz TZVNFYADJCKIAY-KMRXNPHXSA-N 0 3 401.576 4.191 20 0 HIADHN COC[C@H](NCc1ccc(OCc2ccc(Cl)cc2)c(OC)c1)[C@@H]1CCCO1 ZINC000433208397 859567022 /nfs/dbraw/zinc/56/70/22/859567022.db2.gz NSRPGMBNQCPCJI-PMACEKPBSA-N 0 3 405.922 4.211 20 0 HIADHN C[C@H](C(=O)Nc1cccc(Oc2ncc(Br)cn2)c1)N1[C@H](C)CC[C@H]1C ZINC000433271456 859607166 /nfs/dbraw/zinc/60/71/66/859607166.db2.gz TZPXGVKTHDQLPQ-MGPQQGTHSA-N 0 3 419.323 4.231 20 0 HIADHN Cc1cc(NC(=O)N(C)Cc2occc2C)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000433290480 859620477 /nfs/dbraw/zinc/62/04/77/859620477.db2.gz WTXUVSCWOLPVOV-FQEVSTJZSA-N 0 3 407.518 4.204 20 0 HIADHN Cc1cc(NC(=O)N(C)Cc2occc2C)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000433290481 859620876 /nfs/dbraw/zinc/62/08/76/859620876.db2.gz WTXUVSCWOLPVOV-HXUWFJFHSA-N 0 3 407.518 4.204 20 0 HIADHN C[C@H](NCc1ccc(NC(N)=O)cc1)c1ccc(OC[C@@H]2CCCCO2)c(F)c1 ZINC000433395544 859674097 /nfs/dbraw/zinc/67/40/97/859674097.db2.gz ABWDDLDSCDCIAW-KXBFYZLASA-N 0 3 401.482 4.115 20 0 HIADHN O=C(N[C@H]1CCN(C2CC2)C1)[C@@H](Oc1ccc(Cl)c(Cl)c1)c1ccccc1 ZINC000503233462 912212527 /nfs/dbraw/zinc/21/25/27/912212527.db2.gz QSIAYGALRSKCNL-YWZLYKJASA-N 0 3 405.325 4.466 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)N[C@H](c1cc(F)ccc1F)C(F)F ZINC000433604167 859805811 /nfs/dbraw/zinc/80/58/11/859805811.db2.gz MROKNFUTCCCEJK-GOSISDBHSA-N 0 3 415.406 4.184 20 0 HIADHN CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)N[C@H](c1cc(F)ccc1F)C(F)F ZINC000433607781 859807623 /nfs/dbraw/zinc/80/76/23/859807623.db2.gz KRQZADHIQNQMOE-KYNGSXCRSA-N 0 3 424.442 4.000 20 0 HIADHN C[C@H]1[C@H](NC(=O)Nc2ccc(Oc3ncc(Cl)cn3)c(Cl)c2)CCCN1C ZINC000433670226 859832986 /nfs/dbraw/zinc/83/29/86/859832986.db2.gz QBSARNPWSOLLQW-XHDPSFHLSA-N 0 3 410.305 4.180 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)Cc2cc(Br)ccc2F)C1 ZINC000433718490 859851629 /nfs/dbraw/zinc/85/16/29/859851629.db2.gz NCVLAKHLMZXZKL-RDTXWAMCSA-N 0 3 405.311 4.082 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)Nc2ccccc2CN(C)c2ccccc2)CC1 ZINC000433766551 859883949 /nfs/dbraw/zinc/88/39/49/859883949.db2.gz QPIKYQBPLFDRPW-UHFFFAOYSA-N 0 3 424.589 4.334 20 0 HIADHN Cn1cc(-c2cc(F)ccc2NC(=O)NC[C@H]2CCCN2Cc2ccccc2)cn1 ZINC000433789681 859893433 /nfs/dbraw/zinc/89/34/33/859893433.db2.gz PFECYWSXMQUNOM-HXUWFJFHSA-N 0 3 407.493 4.012 20 0 HIADHN Cn1cc(-c2cc(F)ccc2NC(=O)NC[C@@H](c2ccccc2)N2CCCC2)cn1 ZINC000433799147 859897824 /nfs/dbraw/zinc/89/78/24/859897824.db2.gz ONRMIDJCRSIEOH-QFIPXVFZSA-N 0 3 407.493 4.185 20 0 HIADHN Cc1cc(NC(=O)c2noc3c2C[C@H](C)CC3)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000433862283 859940094 /nfs/dbraw/zinc/94/00/94/859940094.db2.gz KENCYXFUQCVHIP-APWZRJJASA-N 0 3 419.529 4.004 20 0 HIADHN CC(C)n1nc(-c2ccco2)cc1NC(=O)N(CCN(C)C)Cc1ccc(F)cc1 ZINC000433921638 859972847 /nfs/dbraw/zinc/97/28/47/859972847.db2.gz JCEKSNLTWDBEKV-UHFFFAOYSA-N 0 3 413.497 4.459 20 0 HIADHN COc1ccc([C@H](NC(=O)NC[C@H]2CCCCN2C2CC2)c2ccccc2OC)cc1 ZINC000433942216 859990017 /nfs/dbraw/zinc/99/00/17/859990017.db2.gz PDUQXISEDSOFLN-YKSBVNFPSA-N 0 3 423.557 4.109 20 0 HIADHN O=C(NC[C@@H]1CCCCN1C1CC1)N[C@H](Cc1ccc(Cl)cc1)c1ccccn1 ZINC000433951730 859997726 /nfs/dbraw/zinc/99/77/26/859997726.db2.gz BPVNGRARWHPKLJ-RBBKRZOGSA-N 0 3 412.965 4.335 20 0 HIADHN COc1cccc(C(NC(=O)NC[C@H]2CCCCN2C2CC2)c2cccc(OC)c2)c1 ZINC000433955307 860000562 /nfs/dbraw/zinc/00/05/62/860000562.db2.gz MKCOHTXTPUVZCU-OAQYLSRUSA-N 0 3 423.557 4.109 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)c2cn(C)nc2-c2ccccc2Cl)CN1Cc1ccccc1 ZINC000467693698 881487839 /nfs/dbraw/zinc/48/78/39/881487839.db2.gz BQPCMKPWGWHIMI-AEFFLSMTSA-N 0 3 408.933 4.133 20 0 HIADHN C[C@H]1C[C@H](NC(=O)c2cc(NC(=O)C(C)(C)C)ccc2F)CN1Cc1ccccc1 ZINC000467694733 881489218 /nfs/dbraw/zinc/48/92/18/881489218.db2.gz BTQLTBHVSBJSTN-LPHOPBHVSA-N 0 3 411.521 4.203 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)c2cccc(NC(=O)c3cccs3)c2)CN1Cc1ccccc1 ZINC000467700855 881495245 /nfs/dbraw/zinc/49/52/45/881495245.db2.gz OFXINIOXJAFAEW-LAUBAEHRSA-N 0 3 419.550 4.393 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2ccc(-c3nc(C4CC4)no3)cc2)N2CCCC2)cc1 ZINC000434081621 860090491 /nfs/dbraw/zinc/09/04/91/860090491.db2.gz FJSIYJBWZRIRRH-JOCHJYFZSA-N 0 3 416.525 4.489 20 0 HIADHN CCC(=O)c1cccc(NC(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)c1 ZINC000434119908 860121223 /nfs/dbraw/zinc/12/12/23/860121223.db2.gz RDQUTTHNZPDPJT-HDICACEKSA-N 0 3 401.551 4.023 20 0 HIADHN O=C(Nc1cc(C(F)(F)F)ccn1)N1CCCN(CCCc2ccccc2)CC1 ZINC000434201388 860188046 /nfs/dbraw/zinc/18/80/46/860188046.db2.gz RRVIXIYEQIQRSB-UHFFFAOYSA-N 0 3 406.452 4.273 20 0 HIADHN C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)c1ccc(CSc2nc3ccccc3[nH]2)cc1 ZINC000467714205 881511040 /nfs/dbraw/zinc/51/10/40/881511040.db2.gz PCWXBLFITQUPGO-VFNWGFHPSA-N 0 3 406.555 4.068 20 0 HIADHN C[C@H]1CN(C2CC2)C[C@@H]1NC(=O)c1ccc(CSc2nc3ccccc3[nH]2)cc1 ZINC000467714203 881511811 /nfs/dbraw/zinc/51/18/11/881511811.db2.gz PCWXBLFITQUPGO-BTYIYWSLSA-N 0 3 406.555 4.068 20 0 HIADHN Cc1ccccc1-c1cc(C(=O)N[C@H]2CN(C3CC3)C[C@H]2C)c2cnn(C(C)C)c2n1 ZINC000467716571 881515194 /nfs/dbraw/zinc/51/51/94/881515194.db2.gz SXBNVAKYYLWWHN-HXOBKFHXSA-N 0 3 417.557 4.200 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)COc1cccc(Cl)c1 ZINC000434313335 860274895 /nfs/dbraw/zinc/27/48/95/860274895.db2.gz VVXJGFHISFOHBN-FQEVSTJZSA-N 0 3 424.932 4.309 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1cc2c(s1)CCOC2 ZINC000434319469 860279392 /nfs/dbraw/zinc/27/93/92/860279392.db2.gz XYEKBGGJVQSPEL-LJQANCHMSA-N 0 3 422.554 4.025 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)CSc1ccccc1 ZINC000434323015 860283132 /nfs/dbraw/zinc/28/31/32/860283132.db2.gz YNHZMWOHSMGJQC-HXUWFJFHSA-N 0 3 406.555 4.369 20 0 HIADHN COc1ccc(CCC(=O)Nc2c(C)cnn2[C@@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000434323500 860284471 /nfs/dbraw/zinc/28/44/71/860284471.db2.gz JOMDZWVOCFFHHB-JOCHJYFZSA-N 0 3 418.541 4.218 20 0 HIADHN COc1cc(CC(=O)Nc2c(C)cnn2[C@@H]2CCN(Cc3ccccc3)C2)ccc1C ZINC000434324675 860285762 /nfs/dbraw/zinc/28/57/62/860285762.db2.gz NYCSUMJZQKDVKE-JOCHJYFZSA-N 0 3 418.541 4.137 20 0 HIADHN COCc1cccc(C(=O)Nc2c(C)cnn2[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000434324331 860286158 /nfs/dbraw/zinc/28/61/58/860286158.db2.gz DOLSBUNKOQAOKV-JOCHJYFZSA-N 0 3 404.514 4.037 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)CCCOc1ccccc1 ZINC000434325024 860286453 /nfs/dbraw/zinc/28/64/53/860286453.db2.gz HFMDMQDYOZDIJQ-JOCHJYFZSA-N 0 3 418.541 4.436 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)[C@H]1Cc2ccccc2S1 ZINC000434327731 860288746 /nfs/dbraw/zinc/28/87/46/860288746.db2.gz RRIGRAFIHNIXQF-RBBKRZOGSA-N 0 3 418.566 4.294 20 0 HIADHN CC(=O)c1ccc(C(=O)Nc2c(C)cnn2[C@@H]2CCN(Cc3ccccc3)C2)s1 ZINC000434332126 860293890 /nfs/dbraw/zinc/29/38/90/860293890.db2.gz GSWUQAPXCNQKHQ-GOSISDBHSA-N 0 3 408.527 4.155 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1cccc2cnccc21 ZINC000434331693 860294400 /nfs/dbraw/zinc/29/44/00/860294400.db2.gz CDKSMZWDKOVQGP-OAQYLSRUSA-N 0 3 411.509 4.439 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1csc(C2CC2)n1 ZINC000434335026 860296080 /nfs/dbraw/zinc/29/60/80/860296080.db2.gz LVMRDRVCEUABEX-SFHVURJKSA-N 0 3 407.543 4.225 20 0 HIADHN CC(C)n1ncc2c1nc(-c1ccco1)cc2C(=O)NC[C@@H]1CCCCN1C1CC1 ZINC000434424565 860343907 /nfs/dbraw/zinc/34/39/07/860343907.db2.gz JMKHZKVELOFPCF-KRWDZBQOSA-N 0 3 407.518 4.019 20 0 HIADHN CC(C)(C)CC(=O)Nc1ccc(Cl)c(C(=O)NC[C@@H]2CCCCN2C2CC2)c1 ZINC000434437267 860351594 /nfs/dbraw/zinc/35/15/94/860351594.db2.gz CMDUOOZHCSTVFX-KRWDZBQOSA-N 0 3 405.970 4.461 20 0 HIADHN Cc1cc(-c2cc(C(=O)NC[C@H]3CCCCN3C3CC3)c3c(C)noc3n2)c(C)o1 ZINC000434445069 860354426 /nfs/dbraw/zinc/35/44/26/860354426.db2.gz MJMZAOGZOSTJGW-QGZVFWFLSA-N 0 3 408.502 4.155 20 0 HIADHN Cc1nc(CSc2ccccc2C(=O)NC[C@H]2CCCCN2C2CC2)cs1 ZINC000434445585 860355731 /nfs/dbraw/zinc/35/57/31/860355731.db2.gz OUNJBFKZPCTVAK-GOSISDBHSA-N 0 3 401.601 4.491 20 0 HIADHN CC[C@@H](Nc1ccccc1)C(=O)Nc1c(C)cnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000434552728 860397771 /nfs/dbraw/zinc/39/77/71/860397771.db2.gz YLCKBCJWFUTCNC-DHIUTWEWSA-N 0 3 417.557 4.468 20 0 HIADHN NC(=O)c1ccc(NC(=O)CCN2CCC[C@H]2c2ccccc2Cl)cc1Cl ZINC000434594851 860418804 /nfs/dbraw/zinc/41/88/04/860418804.db2.gz IJUYIVTVXJYDHG-SFHVURJKSA-N 0 3 406.313 4.258 20 0 HIADHN C[C@H](C(=O)Nc1ccc(OC(F)F)cc1)N1CCC(c2ncc3n2CCCC3)CC1 ZINC000434692423 860464861 /nfs/dbraw/zinc/46/48/61/860464861.db2.gz XSRQEPTYXNKWFR-OAHLLOKOSA-N 0 3 418.488 4.027 20 0 HIADHN C[C@H](CC(=O)NCCCCN1C[C@@H](C)O[C@H](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000434759196 860484365 /nfs/dbraw/zinc/48/43/65/860484365.db2.gz NINYYFWKZNFQEI-BRWVUGGUSA-N 0 3 400.485 4.205 20 0 HIADHN CCCNc1ccc(CNCc2cn(C)nc2-c2ccc3c(c2)OCCCO3)cc1 ZINC000434772754 860490000 /nfs/dbraw/zinc/49/00/00/860490000.db2.gz BNAZYKVHMQUBAU-UHFFFAOYSA-N 0 3 406.530 4.360 20 0 HIADHN Cc1nc(-c2cccc(Cl)c2)sc1C(=O)NCCCCN1C[C@@H](C)O[C@@H](C)C1 ZINC000434782521 860493792 /nfs/dbraw/zinc/49/37/92/860493792.db2.gz DMFUXFQFESYZQG-GASCZTMLSA-N 0 3 421.994 4.391 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)NCc2cc(F)c(Cl)cc2F)CC1 ZINC000434865266 860528375 /nfs/dbraw/zinc/52/83/75/860528375.db2.gz PEWROKZUWGVXPE-UHFFFAOYSA-N 0 3 407.892 4.424 20 0 HIADHN O[C@H](COc1c(Cl)cccc1Cl)CN1CCC(OCC2CCCC2)CC1 ZINC000434904441 860547903 /nfs/dbraw/zinc/54/79/03/860547903.db2.gz FCVHCVWIIARWBI-INIZCTEOSA-N 0 3 402.362 4.404 20 0 HIADHN COc1cc(CN2CCC[C@H](CO)C2)ccc1OCc1ccc(Br)cc1 ZINC000435245222 860702755 /nfs/dbraw/zinc/70/27/55/860702755.db2.gz LDORPBGTPODFCD-SFHVURJKSA-N 0 3 420.347 4.241 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1ccc(C(C)C)nc1 ZINC000435271251 860710774 /nfs/dbraw/zinc/71/07/74/860710774.db2.gz VMPVIHGBJJSUKL-NRFANRHFSA-N 0 3 403.530 4.409 20 0 HIADHN Cc1cc(NC(=O)c2cc(C)n(C(C)(C)C)n2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435272613 860711377 /nfs/dbraw/zinc/71/13/77/860711377.db2.gz SEQCLFUXXVGCNP-HXUWFJFHSA-N 0 3 420.561 4.151 20 0 HIADHN Cc1cc(NC(=O)[C@@H]2CCOc3ccccc32)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435277377 860714093 /nfs/dbraw/zinc/71/40/93/860714093.db2.gz IZDFEVDZLHHJQX-RBBKRZOGSA-N 0 3 416.525 4.143 20 0 HIADHN Cc1cc(NC(=O)c2cc(C(C)(C)C)on2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435280783 860715959 /nfs/dbraw/zinc/71/59/59/860715959.db2.gz NJJFTUZNWHKATL-SFHVURJKSA-N 0 3 407.518 4.176 20 0 HIADHN Cc1cc(NC(=O)C[C@@H](C)c2cccnc2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435285131 860719311 /nfs/dbraw/zinc/71/93/11/860719311.db2.gz NWCYIHHRJQEYAJ-GCJKJVERSA-N 0 3 403.530 4.166 20 0 HIADHN Cc1cc(NC(=O)[C@H]2CSc3ccccc32)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435290703 860720905 /nfs/dbraw/zinc/72/09/05/860720905.db2.gz LHJXQXVZJXMDBH-FPOVZHCZSA-N 0 3 418.566 4.467 20 0 HIADHN CC(C)Cc1nc(C(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)cs1 ZINC000435368252 860765891 /nfs/dbraw/zinc/76/58/91/860765891.db2.gz HIWNHNGXDXGKIR-SFHVURJKSA-N 0 3 409.559 4.237 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)c1coc(-c2ccccc2)n1 ZINC000435368746 860766331 /nfs/dbraw/zinc/76/63/31/860766331.db2.gz BXFSNCOZSTXZMI-HXUWFJFHSA-N 0 3 413.481 4.237 20 0 HIADHN Cc1ccc(OCCC(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)cc1C ZINC000435369059 860766839 /nfs/dbraw/zinc/76/68/39/860766839.db2.gz CPSBAMYTJLGBOK-QFIPXVFZSA-N 0 3 418.541 4.355 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(OCC2CC2)cc1 ZINC000435370038 860766883 /nfs/dbraw/zinc/76/68/83/860766883.db2.gz NOMHPWSAMLLUJP-JOCHJYFZSA-N 0 3 416.525 4.371 20 0 HIADHN O=C(CCc1cc(F)ccc1F)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435370319 860767828 /nfs/dbraw/zinc/76/78/28/860767828.db2.gz OJHQWOFJPIUJRE-HXUWFJFHSA-N 0 3 410.468 4.180 20 0 HIADHN C[C@@H](Oc1cccc(Cl)c1)C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435371724 860769788 /nfs/dbraw/zinc/76/97/88/860769788.db2.gz XBKHEQWLNBWPFN-XLIONFOSSA-N 0 3 424.932 4.390 20 0 HIADHN Cc1cccc2c(CC(=O)Nc3ccnn3[C@H]3CCN(Cc4ccccc4)C3)c[nH]c21 ZINC000435372876 860770306 /nfs/dbraw/zinc/77/03/06/860770306.db2.gz SVFZVPJWGBBBFO-NRFANRHFSA-N 0 3 413.525 4.301 20 0 HIADHN O=C(CCOc1ccc(Cl)cc1)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435372636 860770402 /nfs/dbraw/zinc/77/04/02/860770402.db2.gz KRPHMKRIBGTRGM-FQEVSTJZSA-N 0 3 424.932 4.391 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)C12CC3CC(CC(C3)C1)C2 ZINC000435374023 860771249 /nfs/dbraw/zinc/77/12/49/860771249.db2.gz PBZOATANXMBNTQ-APNVUFTPSA-N 0 3 404.558 4.485 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)[C@H]1C[C@H]1c1cc(F)ccc1F ZINC000435378133 860775258 /nfs/dbraw/zinc/77/52/58/860775258.db2.gz CDDKUFVRSCSMCF-DYXWJJEUSA-N 0 3 422.479 4.351 20 0 HIADHN O=C(C[C@H]1CCOc2ccccc21)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435378683 860776303 /nfs/dbraw/zinc/77/63/03/860776303.db2.gz FTEWYCJMWAKHHG-NHCUHLMSSA-N 0 3 416.525 4.225 20 0 HIADHN CC[C@@H](Oc1cccc(C)c1)C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435382037 860777701 /nfs/dbraw/zinc/77/77/01/860777701.db2.gz XETOEGXKUIXIOH-JTHBVZDNSA-N 0 3 418.541 4.435 20 0 HIADHN C[C@@H]1CC[C@H](C)N1[C@@H]1CCCN(S(=O)(=O)c2c(Cl)cc(F)cc2Cl)C1 ZINC000435423282 860795783 /nfs/dbraw/zinc/79/57/83/860795783.db2.gz SJBMWTKMQXQIDL-MBNYWOFBSA-N 0 3 409.354 4.158 20 0 HIADHN CSc1c(F)cccc1C(=O)NC1CCN(CCOc2ccc(Cl)cc2)CC1 ZINC000435458385 860805425 /nfs/dbraw/zinc/80/54/25/860805425.db2.gz PBAPKODLBXCIRP-UHFFFAOYSA-N 0 3 422.953 4.474 20 0 HIADHN Cc1cc(NC(=O)N(C)[C@@H](C)c2cccnc2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435511175 860829082 /nfs/dbraw/zinc/82/90/82/860829082.db2.gz LXKOWHHILFWEPL-UGKGYDQZSA-N 0 3 418.545 4.258 20 0 HIADHN Cc1cc(NC(=O)N[C@H]2CCCC(F)(F)C2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435518890 860836149 /nfs/dbraw/zinc/83/61/49/860836149.db2.gz WILYPLMATYMILW-RBUKOAKNSA-N 0 3 417.504 4.338 20 0 HIADHN Cc1cc(NC(=O)NCCc2ccc(C)cc2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435525553 860842027 /nfs/dbraw/zinc/84/20/27/860842027.db2.gz FAIVORQHHMCUEO-HSZRJFAPSA-N 0 3 417.557 4.311 20 0 HIADHN Cc1cc(NC(=O)NC(C)(C)c2nccs2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435526208 860842430 /nfs/dbraw/zinc/84/24/30/860842430.db2.gz HCTCKNOPLDNMKZ-SFHVURJKSA-N 0 3 424.574 4.152 20 0 HIADHN CC[C@@H](NC(=O)Nc1cc(C)nn1[C@@H]1CCN(Cc2ccccc2)C1)c1ccncc1 ZINC000435536874 860851005 /nfs/dbraw/zinc/85/10/05/860851005.db2.gz MOZLZOLYZTXKMC-FGZHOGPDSA-N 0 3 418.545 4.306 20 0 HIADHN Cc1c(NC(=O)NC[C@@H](c2ccccc2)N2CCCC2)cnn1-c1ccccc1F ZINC000435552112 860868442 /nfs/dbraw/zinc/86/84/42/860868442.db2.gz YRMDCHGYKVQFTQ-QFIPXVFZSA-N 0 3 407.493 4.278 20 0 HIADHN Cc1c(NC(=O)N(CCN(C)C)Cc2cccc(Cl)c2)cnn1-c1ccccc1 ZINC000435560603 860881229 /nfs/dbraw/zinc/88/12/29/860881229.db2.gz NRTNBTUYMLDSIC-UHFFFAOYSA-N 0 3 411.937 4.430 20 0 HIADHN Cc1c(NC(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)cnn1-c1ccccc1F ZINC000435564569 860885749 /nfs/dbraw/zinc/88/57/49/860885749.db2.gz PNMDBZMWDPXNLB-FQEVSTJZSA-N 0 3 421.520 4.448 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1cnn(-c2ccccc2)c1C)c1cccc(OC)c1 ZINC000435565673 860886885 /nfs/dbraw/zinc/88/68/85/860886885.db2.gz LKSAONVEGRFJBS-HSZRJFAPSA-N 0 3 421.545 4.394 20 0 HIADHN Cc1c(NC(=O)N(Cc2ccccc2)C2CCN(C)CC2)cnn1-c1ccccc1 ZINC000435565133 860886915 /nfs/dbraw/zinc/88/69/15/860886915.db2.gz JUYBQQXLNOTGAR-UHFFFAOYSA-N 0 3 403.530 4.309 20 0 HIADHN COC(=O)c1ccccc1-c1ccccc1C(=O)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435653706 860936169 /nfs/dbraw/zinc/93/61/69/860936169.db2.gz HDTHSTXFZAYNQB-HXUWFJFHSA-N 0 3 414.505 4.145 20 0 HIADHN NC(=O)[C@H](Cc1ccc(C(F)(F)F)cc1)N[C@@H]1C[C@H]1c1ccc(Cl)c(F)c1 ZINC000435671821 860952006 /nfs/dbraw/zinc/95/20/06/860952006.db2.gz FYDXBRGCLJWZRH-XKQJLSEDSA-N 0 3 400.803 4.040 20 0 HIADHN CN(c1ccccc1)c1ccc(CNc2cccc(CN3CCN(C)CC3)c2)cn1 ZINC000435783418 861058392 /nfs/dbraw/zinc/05/83/92/861058392.db2.gz VGPPDYKYWMRWOO-UHFFFAOYSA-N 0 3 401.558 4.209 20 0 HIADHN COc1ccc([C@H](CNC(=O)N[C@H]2C[C@H](c3cccc(F)c3)C2)N2CCCC2)cc1 ZINC000435871384 861132194 /nfs/dbraw/zinc/13/21/94/861132194.db2.gz SLFLWTYXZYKIDB-RRPUWOKSSA-N 0 3 411.521 4.217 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(Br)cc1)C(=O)N[C@H]1CCOc2ccccc21 ZINC000435881001 861139345 /nfs/dbraw/zinc/13/93/45/861139345.db2.gz MYTXNSTWHUBTOF-DEYYWGMASA-N 0 3 403.320 4.128 20 0 HIADHN Cc1cc(NC(=O)[C@H]2CCCc3cccnc32)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435911359 861173088 /nfs/dbraw/zinc/17/30/88/861173088.db2.gz LJBUCXZGTHBZFM-YADHBBJMSA-N 0 3 415.541 4.092 20 0 HIADHN O=C1c2ccccc2C(=O)N1C1CCC(N[C@@H](c2ccccc2)c2ccccn2)CC1 ZINC000437779544 863098565 /nfs/dbraw/zinc/09/85/65/863098565.db2.gz BOOSRLKEVGARGQ-IMQCZEGASA-N 0 3 411.505 4.368 20 0 HIADHN CC1CCN(CCNC(=O)c2cc(COc3c(Cl)cccc3Cl)on2)CC1 ZINC000467810189 881636512 /nfs/dbraw/zinc/63/65/12/881636512.db2.gz SMGLOHHHBCTSSZ-UHFFFAOYSA-N 0 3 412.317 4.022 20 0 HIADHN Cc1cc(C(=O)NC(C)C)ccc1NC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1 ZINC000437897222 863268622 /nfs/dbraw/zinc/26/86/22/863268622.db2.gz RRVCZGDCCFRBFC-FQEVSTJZSA-N 0 3 422.573 4.262 20 0 HIADHN C[C@H]1CCN(C(=O)Nc2cccc(OC[C@@H]3CCCO3)c2)CCN1Cc1ccccc1 ZINC000437911535 863287153 /nfs/dbraw/zinc/28/71/53/863287153.db2.gz OOTFYYADLHSTGV-RDPSFJRHSA-N 0 3 423.557 4.373 20 0 HIADHN O=C(Nc1ccc(Oc2ccc(C(F)(F)F)cc2)nc1)N1CC[C@@H](N2CC=CC2)C1 ZINC000437996679 863359038 /nfs/dbraw/zinc/35/90/38/863359038.db2.gz GNQOINWKVHFANJ-QGZVFWFLSA-N 0 3 418.419 4.371 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)N[C@H]2C[C@@H]2c2ccccc2OC(F)F)CN1Cc1ccccc1 ZINC000438016729 863376333 /nfs/dbraw/zinc/37/63/33/863376333.db2.gz WIGIUWRWVDKIHO-ZSXHRAQDSA-N 0 3 415.484 4.106 20 0 HIADHN Cc1cc(NC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)ccc1C(=O)NC(C)C ZINC000438055615 863424796 /nfs/dbraw/zinc/42/47/96/863424796.db2.gz YFUVOFRRLCLLBC-FQEVSTJZSA-N 0 3 422.573 4.262 20 0 HIADHN CCSc1ccc(Cl)cc1C(=O)N1CCC(CN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000438067863 863447700 /nfs/dbraw/zinc/44/77/00/863447700.db2.gz QPWBIQKNUSBUMQ-HOTGVXAUSA-N 0 3 411.011 4.413 20 0 HIADHN Cc1cccc2oc(CCNC(=O)Nc3ccc(CCN4CCSCC4)cc3)nc21 ZINC000438082550 863480315 /nfs/dbraw/zinc/48/03/15/863480315.db2.gz UBGJCOQSGDUGLH-UHFFFAOYSA-N 0 3 424.570 4.092 20 0 HIADHN C[C@@H](NCc1ccc(N2C[C@@H](C)O[C@@H](C)C2)nc1)c1cccc(Br)c1 ZINC000467837989 881672954 /nfs/dbraw/zinc/67/29/54/881672954.db2.gz DBSZYDKWXAZRLV-OWCLPIDISA-N 0 3 404.352 4.309 20 0 HIADHN CCCN(CC(F)(F)F)C(=O)[C@@H]1CCCN(Cc2c[nH]nc2-c2ccsc2)C1 ZINC000438104904 863515287 /nfs/dbraw/zinc/51/52/87/863515287.db2.gz OOBZOSRGFQCCMG-CQSZACIVSA-N 0 3 414.497 4.151 20 0 HIADHN CCOC(=O)Cn1nc(C)c(CN2CCC[C@H](COc3ccccc3Cl)C2)c1C ZINC000438120606 863539335 /nfs/dbraw/zinc/53/93/35/863539335.db2.gz RUJUKAXDDUGKKE-SFHVURJKSA-N 0 3 419.953 4.007 20 0 HIADHN Cc1cc(SC2CCCCC2)ccc1NC(=O)NC[C@H](C)CN1CCN(C)CC1 ZINC000438174852 863598592 /nfs/dbraw/zinc/59/85/92/863598592.db2.gz GETWPVMSQVRCNQ-SFHVURJKSA-N 0 3 418.651 4.425 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)Nc2cccc(Cl)c2SC(C)C)CC1 ZINC000438269653 863738559 /nfs/dbraw/zinc/73/85/59/863738559.db2.gz KZMJILCOKQXBNN-MRXNPFEDSA-N 0 3 413.031 4.236 20 0 HIADHN CCN1CCC[C@@H](CN(C)C(=O)c2ccc(-c3ccccc3F)o2)[C@@H]1c1cnn(C)c1 ZINC000438399766 863848228 /nfs/dbraw/zinc/84/82/28/863848228.db2.gz YDJALDQNSATZBT-GAJHUEQPSA-N 0 3 424.520 4.364 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)CCc1cc(Br)cs1 ZINC000438462376 863885352 /nfs/dbraw/zinc/88/53/52/863885352.db2.gz SXIJIPLPCUZTGO-UHFFFAOYSA-N 0 3 401.395 4.095 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)NC[C@@H]3CCC[C@H](C(F)(F)F)C3)cc2)CC1 ZINC000438531961 863957881 /nfs/dbraw/zinc/95/78/81/863957881.db2.gz JISDREWJRFUDTK-MJGOQNOKSA-N 0 3 411.512 4.316 20 0 HIADHN CC(=O)CCc1ccc(O[C@@H](C)C(=O)N(Cc2ccccc2)C2CCN(C)CC2)cc1 ZINC000438555022 863985649 /nfs/dbraw/zinc/98/56/49/863985649.db2.gz RLAWLKKTSXSNNP-NRFANRHFSA-N 0 3 422.569 4.099 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3ccc4ccc(Cl)cc4n3)CC2)C[C@@H](C)O1 ZINC000438571541 864003936 /nfs/dbraw/zinc/00/39/36/864003936.db2.gz VNYCQQIMRMKFRZ-IAGOWNOFSA-N 0 3 415.965 4.240 20 0 HIADHN CCOC(=O)c1sc(NC(=O)N(Cc2ccccc2)C2CCN(C)CC2)cc1C ZINC000438582166 864013142 /nfs/dbraw/zinc/01/31/42/864013142.db2.gz ICPGOPUIGXHSKH-UHFFFAOYSA-N 0 3 415.559 4.362 20 0 HIADHN CN(C)CCN(CC1CCCCC1)C(=O)C(=O)Nc1cccc(C(F)F)c1Cl ZINC000438644156 864081001 /nfs/dbraw/zinc/08/10/01/864081001.db2.gz HLBKVVWGGSHREP-UHFFFAOYSA-N 0 3 415.912 4.187 20 0 HIADHN CCCOc1ccc(NC(=O)C(=O)N(CC)[C@H]2CCN([C@@H](C)c3ccccc3)C2)cc1 ZINC000438658106 864103422 /nfs/dbraw/zinc/10/34/22/864103422.db2.gz YVLBLYDEPORHBZ-UGKGYDQZSA-N 0 3 423.557 4.098 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)Nc1cccc(Oc2ccccn2)c1 ZINC000438663824 864116927 /nfs/dbraw/zinc/11/69/27/864116927.db2.gz JVJADQPCROBAGR-UHFFFAOYSA-N 0 3 412.559 4.357 20 0 HIADHN CCN(C(=O)C(=O)Nc1ccc(OC(C)C)cc1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000438668625 864127315 /nfs/dbraw/zinc/12/73/15/864127315.db2.gz YSDPUSKYBOERDW-KNQAVFIVSA-N 0 3 423.557 4.096 20 0 HIADHN O[C@H](COc1ccccc1F)CN1CCC(c2nc3cc(Cl)ccc3o2)CC1 ZINC000438756753 864249079 /nfs/dbraw/zinc/24/90/79/864249079.db2.gz QIIGLTDNMYUDKY-INIZCTEOSA-N 0 3 404.869 4.240 20 0 HIADHN COC(=O)C(C)(C)c1ccc(NC(=O)N(Cc2ccccc2)C2CCN(C)CC2)cc1 ZINC000438882440 864368518 /nfs/dbraw/zinc/36/85/18/864368518.db2.gz JTOZOOJXRDLTHR-UHFFFAOYSA-N 0 3 423.557 4.266 20 0 HIADHN Cc1cc(NC(=O)N(CCN(C)C)Cc2cccs2)ccc1OC1CCOCC1 ZINC000438885976 864371552 /nfs/dbraw/zinc/37/15/52/864371552.db2.gz WGJPMVAQBQQCBI-UHFFFAOYSA-N 0 3 417.575 4.210 20 0 HIADHN Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)N(CCN(C)C)C1CCCC1 ZINC000467900390 881763547 /nfs/dbraw/zinc/76/35/47/881763547.db2.gz TWWKFQZGDRPZOC-UHFFFAOYSA-N 0 3 400.567 4.006 20 0 HIADHN COc1cc(NC(C)=O)ccc1[C@H](C)N[C@H]1CCN(c2ccccc2OC(F)F)C1 ZINC000438987664 864448663 /nfs/dbraw/zinc/44/86/63/864448663.db2.gz PTPRDGPVBPKIIW-YOEHRIQHSA-N 0 3 419.472 4.185 20 0 HIADHN C[C@@H]1CC[C@H](O)[C@@H]([C@@H]2CCCCN2CC(=O)Nc2ccc(Br)cc2)C1 ZINC000438993442 864451773 /nfs/dbraw/zinc/45/17/73/864451773.db2.gz KHLGGZFQBOVTPY-OAOYMFHYSA-N 0 3 409.368 4.039 20 0 HIADHN CC1CCN([C@@H](CNC(=O)N2CCC([C@H]3CCCO3)CC2)c2cccs2)CC1 ZINC000439112595 864549838 /nfs/dbraw/zinc/54/98/38/864549838.db2.gz BRGKDMQMJWCXHW-VQTJNVASSA-N 0 3 405.608 4.122 20 0 HIADHN CC(C)CN1CCCC[C@@H]1CNC(=O)N1CCC(C(=O)c2cc(F)ccc2F)CC1 ZINC000439200246 864624620 /nfs/dbraw/zinc/62/46/20/864624620.db2.gz OROSGLUXMPWLHZ-LJQANCHMSA-N 0 3 421.532 4.080 20 0 HIADHN O=C(NC[C@@H]1CCC[C@@H](C(F)(F)F)C1)NCC1(N2CCSCC2)CCCC1 ZINC000439243526 864661789 /nfs/dbraw/zinc/66/17/89/864661789.db2.gz CNFMYCSYWKVRFK-HZPDHXFCSA-N 0 3 407.546 4.016 20 0 HIADHN C[C@@H]1C[C@@H](c2ccccc2)CCN1CC(=O)N1CCC(OCc2ccccc2)CC1 ZINC000439315530 864750062 /nfs/dbraw/zinc/75/00/62/864750062.db2.gz JINCBQWGOPTWKY-QPPBQGQZSA-N 0 3 406.570 4.462 20 0 HIADHN CO[C@@H](c1ccc(Cl)cc1)[C@H](C)NC(=O)N(CCN(C)C)Cc1cccs1 ZINC000439355165 864797873 /nfs/dbraw/zinc/79/78/73/864797873.db2.gz ITUAWMLYGISYGU-HNAYVOBHSA-N 0 3 409.983 4.251 20 0 HIADHN C[C@H](C(=O)Nc1ccc(CCn2cc(Br)cn2)cc1)N1[C@H](C)CC[C@@H]1C ZINC000439480945 864846727 /nfs/dbraw/zinc/84/67/27/864846727.db2.gz WXFRHEZOIDQEAD-OWCLPIDISA-N 0 3 419.367 4.088 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)NC[C@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000439580786 864902360 /nfs/dbraw/zinc/90/23/60/864902360.db2.gz KBJFZLDOJOKPSV-GOEBONIOSA-N 0 3 421.454 4.407 20 0 HIADHN O=C(Nc1ccc(OCC(F)F)cc1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000467955740 881819913 /nfs/dbraw/zinc/81/99/13/881819913.db2.gz CMJSDQDIAHIBGO-UHFFFAOYSA-N 0 3 421.410 4.257 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)NC[C@@H]1CCC[C@H](C(F)(F)F)C1 ZINC000439633708 864958389 /nfs/dbraw/zinc/95/83/89/864958389.db2.gz MEBHGYNZPHHKJK-SJORKVTESA-N 0 3 403.464 4.268 20 0 HIADHN Cc1ccc(C(=O)NCC2CC2)cc1NC(=O)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000439678379 865013053 /nfs/dbraw/zinc/01/30/53/865013053.db2.gz CBPDBFZXEPJFPK-QHCPKHFHSA-N 0 3 420.557 4.093 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)c2ccc3[nH]c4c(c3c2)CCCC4)CC1 ZINC000439736833 865069483 /nfs/dbraw/zinc/06/94/83/865069483.db2.gz FODSSUXDOSXXLM-QGZVFWFLSA-N 0 3 402.542 4.397 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)CSCc2ccc(Cl)cc2)CC1 ZINC000439737039 865069795 /nfs/dbraw/zinc/06/97/95/865069795.db2.gz XBYHFIQYEYXLNR-INIZCTEOSA-N 0 3 403.979 4.310 20 0 HIADHN Cc1ccc(-c2nc(CC(=O)NC3CCN([C@H](C)c4ccncc4)CC3)cs2)cc1 ZINC000439749480 865079459 /nfs/dbraw/zinc/07/94/59/865079459.db2.gz FGUKRKAWUIOYEM-GOSISDBHSA-N 0 3 420.582 4.398 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)Cc2coc3cc4c(cc23)CCC4)CC1 ZINC000439765228 865090820 /nfs/dbraw/zinc/09/08/20/865090820.db2.gz JCFRZAKBFWGJBT-KRWDZBQOSA-N 0 3 403.526 4.201 20 0 HIADHN C[C@@H](Oc1ccc(Cl)c(Cl)c1)C(=O)NC1CCN([C@H](C)c2ccncc2)CC1 ZINC000439764207 865090994 /nfs/dbraw/zinc/09/09/94/865090994.db2.gz JPIHXLXXZPMQRE-HUUCEWRRSA-N 0 3 422.356 4.498 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)COc2ccc(Cl)c3cccnc23)CC1 ZINC000439766036 865092255 /nfs/dbraw/zinc/09/22/55/865092255.db2.gz MMBKVOHVSPSXNY-MRXNPFEDSA-N 0 3 424.932 4.004 20 0 HIADHN Cc1c(Br)cccc1C(=O)NC1CCN([C@H](C)c2ccncc2)CC1 ZINC000439770244 865096017 /nfs/dbraw/zinc/09/60/17/865096017.db2.gz QCPGMFWONUQCAZ-OAHLLOKOSA-N 0 3 402.336 4.108 20 0 HIADHN CCN(C(=O)c1ccc(-c2n[nH]c(C)n2)cc1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000467990299 881836929 /nfs/dbraw/zinc/83/69/29/881836929.db2.gz KJTHMNJUQGNGOI-JTSKRJEESA-N 0 3 403.530 4.078 20 0 HIADHN CN1CCC[C@@H](CNC(=O)c2cn3ccnc3s2)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000467999384 881842622 /nfs/dbraw/zinc/84/26/22/881842622.db2.gz AXJZOGJMSFRQDG-WMLDXEAASA-N 0 3 422.476 4.228 20 0 HIADHN Cc1cc(CCCC(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)c(C)s1 ZINC000439901344 865212223 /nfs/dbraw/zinc/21/22/23/865212223.db2.gz MADJRUZPCABCPP-QZTJIDSGSA-N 0 3 406.636 4.426 20 0 HIADHN Cc1ccc(-c2ccnn2C)cc1NC(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C ZINC000439947331 865242034 /nfs/dbraw/zinc/24/20/34/865242034.db2.gz DNMZKMZFJSRXOV-AVRDEDQJSA-N 0 3 403.530 4.038 20 0 HIADHN CC(C)(C)[C@H](CN1CCc2ccccc2C1)NC(=O)Nc1ccc(N2CCC2=O)cc1 ZINC000439954174 865248222 /nfs/dbraw/zinc/24/82/22/865248222.db2.gz ZMKFQLNJYDUQPU-QFIPXVFZSA-N 0 3 420.557 4.018 20 0 HIADHN COC(=O)CC1(CC(=O)N(c2cccc(SC)c2)C2CCN(C)CC2)CCCC1 ZINC000468018383 881854911 /nfs/dbraw/zinc/85/49/11/881854911.db2.gz ZAGVGCBBEJRNSF-UHFFFAOYSA-N 0 3 418.603 4.349 20 0 HIADHN CC(C)C1CCC(N2CCN(C(=O)CCCc3nnc(-c4ccccc4)o3)CC2)CC1 ZINC000440002626 865307070 /nfs/dbraw/zinc/30/70/70/865307070.db2.gz KFWRLWKDNQLBSX-UHFFFAOYSA-N 0 3 424.589 4.418 20 0 HIADHN COc1ccc([C@@H](Cc2ccc(F)cc2)NC(=O)N(CCN(C)C)C(C)C)cc1 ZINC000440069360 865336150 /nfs/dbraw/zinc/33/61/50/865336150.db2.gz HDKOTPNXQFGXDS-JOCHJYFZSA-N 0 3 401.526 4.100 20 0 HIADHN NC(=O)C1CCN(C[C@@H](N[C@H]2CCCc3sccc32)c2ccc(Cl)cc2)CC1 ZINC000468038425 881868372 /nfs/dbraw/zinc/86/83/72/881868372.db2.gz NJTYPGRWMSXXTH-VQTJNVASSA-N 0 3 418.006 4.307 20 0 HIADHN COc1ccc([C@@H](CNC(=O)N(CCN(C)C)C(C)C)c2c[nH]c3ccccc32)cc1 ZINC000440205645 865436302 /nfs/dbraw/zinc/43/63/02/865436302.db2.gz ZIPZONSPEPCOCJ-JOCHJYFZSA-N 0 3 422.573 4.290 20 0 HIADHN CC(C)C1CCC(N2CCN(C(=O)Nc3cccc(NC(=O)C4CC4)c3)CC2)CC1 ZINC000440236537 865473854 /nfs/dbraw/zinc/47/38/54/865473854.db2.gz DXSALAIUFIOWMP-UHFFFAOYSA-N 0 3 412.578 4.399 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)NCc1cccc(-c2ccccn2)c1 ZINC000440244419 865483473 /nfs/dbraw/zinc/48/34/73/865483473.db2.gz PBGFOZBQOMGPEH-UHFFFAOYSA-N 0 3 406.505 4.161 20 0 HIADHN C[C@]1(CN[C@H](c2ccc(F)cc2)c2cccc(S(C)(=O)=O)c2)CCO[C@@H]1C1CC1 ZINC000468050416 881876172 /nfs/dbraw/zinc/87/61/72/881876172.db2.gz YJCBPKFOIIYGJL-DNVJHFABSA-N 0 3 417.546 4.113 20 0 HIADHN CCN(Cc1c[nH]c2ccccc12)C(=O)CCCN1CCN(c2ccccc2)CC1 ZINC000468066582 881883871 /nfs/dbraw/zinc/88/38/71/881883871.db2.gz YAONMOYNJSREMS-UHFFFAOYSA-N 0 3 404.558 4.119 20 0 HIADHN CC(=O)N(C)c1cccc(NC(=O)N2CCN(C3CCC(C(C)C)CC3)CC2)c1 ZINC000440308131 865573781 /nfs/dbraw/zinc/57/37/81/865573781.db2.gz GVRBLYSFNQPHEN-UHFFFAOYSA-N 0 3 400.567 4.034 20 0 HIADHN O=C(Nc1ccc(CNCc2cnc(-c3ccncc3)s2)cc1)c1cccnc1 ZINC000440332389 865612599 /nfs/dbraw/zinc/61/25/99/865612599.db2.gz CYUBYFQJCRXFHQ-UHFFFAOYSA-N 0 3 401.495 4.142 20 0 HIADHN C[C@@H]1CN(Cc2ccc(CNCc3cnc(-c4ccncc4)s3)cc2)C[C@@H](C)O1 ZINC000440340414 865618090 /nfs/dbraw/zinc/61/80/90/865618090.db2.gz KYWDHRXOHXJQCE-QZTJIDSGSA-N 0 3 408.571 4.104 20 0 HIADHN C[C@H]1CN(Cc2ccc(CNCc3cnc(-c4ccncc4)s3)cc2)C[C@H](C)O1 ZINC000440340415 865619135 /nfs/dbraw/zinc/61/91/35/865619135.db2.gz KYWDHRXOHXJQCE-ROUUACIJSA-N 0 3 408.571 4.104 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N[C@H](CC(F)(F)F)c3ccccc3)cc2)CC1 ZINC000468079387 881890822 /nfs/dbraw/zinc/89/08/22/881890822.db2.gz MTTLXHPGSFWYFB-HXUWFJFHSA-N 0 3 405.464 4.252 20 0 HIADHN COc1ccc([C@H](NC[C@H](O)COCc2cccs2)c2ccc(F)cc2)cc1 ZINC000440413049 865708065 /nfs/dbraw/zinc/70/80/65/865708065.db2.gz IAAYXWNCTAJWEU-SIKLNZKXSA-N 0 3 401.503 4.153 20 0 HIADHN C[C@H](C(=O)N1[C@H](C)CCC[C@H]1C)N1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1 ZINC000440468937 865772488 /nfs/dbraw/zinc/77/24/88/865772488.db2.gz YFOQTHSXOPISOO-BZUAXINKSA-N 0 3 423.960 4.308 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)Nc1ncc(-c2ccccc2)s1 ZINC000440717555 865873120 /nfs/dbraw/zinc/87/31/20/865873120.db2.gz PJHORLGYOJGDFK-UHFFFAOYSA-N 0 3 422.554 4.089 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)c2cc(F)c(F)cc2Br)C1 ZINC000440793501 865916817 /nfs/dbraw/zinc/91/68/17/865916817.db2.gz CQTMAYXLOLOMQF-GXTWGEPZSA-N 0 3 409.274 4.293 20 0 HIADHN CC(C)n1ncc2c1nc(-c1ccccc1)cc2C(=O)N[C@@H]1C[C@@H](C)N(C2CC2)C1 ZINC000440916736 866012917 /nfs/dbraw/zinc/01/29/17/866012917.db2.gz YMJULXRHDBCQFU-SJLPKXTDSA-N 0 3 403.530 4.034 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)CSc2ncnc3scc(-c4ccccc4)c32)CN1C1CC1 ZINC000440922162 866017746 /nfs/dbraw/zinc/01/77/46/866017746.db2.gz NBLKTPQDKHOGGJ-GOEBONIOSA-N 0 3 424.595 4.192 20 0 HIADHN Cc1cccc(-c2nnc(-c3ccc(C(=O)N[C@@H]4C[C@@H](C)N(C5CC5)C4)cc3)o2)c1 ZINC000440925162 866020890 /nfs/dbraw/zinc/02/08/90/866020890.db2.gz LGIBKEGAKSXXDS-OXQOHEQNSA-N 0 3 402.498 4.067 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)c2ccc(CSc3nc4ccccc4[nH]3)cc2)CN1C1CC1 ZINC000440931033 866029011 /nfs/dbraw/zinc/02/90/11/866029011.db2.gz IIVZXVHYYPOUCP-MAUKXSAKSA-N 0 3 406.555 4.210 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)Cc2csc(-c3cccc(C(F)(F)F)c3)n2)CN1C1CC1 ZINC000440932687 866029474 /nfs/dbraw/zinc/02/94/74/866029474.db2.gz NIFJVZONDQCOMP-IUODEOHRSA-N 0 3 409.477 4.113 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)NCC[NH+]3CCC4(CCCCC4)CC3)cc2)cc(=O)[n-]1 ZINC000440932223 866029847 /nfs/dbraw/zinc/02/98/47/866029847.db2.gz LXRPKZLJWWWPDL-UHFFFAOYSA-N 0 3 423.561 4.325 20 0 HIADHN C[C@H]1C[C@H](NC(=O)c2ccccc2CSc2nc3ccccc3o2)CN1C1CC1 ZINC000440936023 866034675 /nfs/dbraw/zinc/03/46/75/866034675.db2.gz LYEKXQHFYLJDIN-RDJZCZTQSA-N 0 3 407.539 4.475 20 0 HIADHN Cc1c2cc(Cl)ccc2sc1CNC(=O)N1CCN(C2CCOCC2)C[C@@H]1C ZINC000441039138 866105147 /nfs/dbraw/zinc/10/51/47/866105147.db2.gz JQHXQFDMRRMOMD-AWEZNQCLSA-N 0 3 421.994 4.258 20 0 HIADHN COc1ccc2occ(C(=O)Nc3ccnn3[C@H]3CCN(Cc4ccccc4)C3)c2c1 ZINC000441071249 866162664 /nfs/dbraw/zinc/16/26/64/866162664.db2.gz HNJXUZRJOADYFJ-SFHVURJKSA-N 0 3 416.481 4.337 20 0 HIADHN CC1(C)CN(CC(=O)N2CCC(OCc3ccccc3)CC2)C[C@@H]1c1ccccc1 ZINC000441085152 866178179 /nfs/dbraw/zinc/17/81/79/866178179.db2.gz BDPNFHNSKOODBL-XMMPIXPASA-N 0 3 406.570 4.320 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)Nc2ccc(Oc3nccc(C)n3)cc2)c1 ZINC000441092394 866185290 /nfs/dbraw/zinc/18/52/90/866185290.db2.gz OJZFCFHIHOBKCJ-UHFFFAOYSA-N 0 3 419.529 4.481 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)Nc2cccc(CCC(F)(F)F)c2)CC1 ZINC000441101018 866196058 /nfs/dbraw/zinc/19/60/58/866196058.db2.gz YHSPLDKFAQCORL-UHFFFAOYSA-N 0 3 401.473 4.192 20 0 HIADHN O=C(CN1CCC[C@H]([C@H]2CCOC2)C1)N1CCC[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000441199768 866270507 /nfs/dbraw/zinc/27/05/07/866270507.db2.gz DRVAARHRIPHUCW-ZWOKBUDYSA-N 0 3 411.373 4.405 20 0 HIADHN O=C(CN1CCC[C@H]([C@@H]2CCOC2)C1)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 ZINC000441199766 866271011 /nfs/dbraw/zinc/27/10/11/866271011.db2.gz DRVAARHRIPHUCW-SQGPQFPESA-N 0 3 411.373 4.405 20 0 HIADHN CO[C@H]1CCCC[C@@H]1NCC(=O)N1N=C(c2ccc(Cl)cc2)C[C@H]1c1ccco1 ZINC000441273495 866347570 /nfs/dbraw/zinc/34/75/70/866347570.db2.gz CVFUNBLFFGKWOS-IHPCNDPISA-N 0 3 415.921 4.158 20 0 HIADHN O=C(CN1CCC[C@H]([C@H]2CCOC2)C1)N[C@H](c1ccccc1)c1ccc(Cl)cc1 ZINC000441279596 866355512 /nfs/dbraw/zinc/35/55/12/866355512.db2.gz CISBWSHZKGRRBJ-AWRGLXIESA-N 0 3 412.961 4.294 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)c1cc(F)c(F)cc1Br ZINC000441314153 866385383 /nfs/dbraw/zinc/38/53/83/866385383.db2.gz HVDWAONHEOVZHT-GOSISDBHSA-N 0 3 409.274 4.294 20 0 HIADHN C[C@@H](NC(=O)CN1CC[C@H](COCc2ccccc2)C1)c1ccc2c(c1)CCCC2 ZINC000441319806 866388781 /nfs/dbraw/zinc/38/87/81/866388781.db2.gz AMMREWXUOFDYSA-IRLDBZIGSA-N 0 3 406.570 4.281 20 0 HIADHN CCC(CC)(NC(=O)NC1CCN(CCOC)CC1)c1ccc(Cl)c(Cl)c1 ZINC000441321972 866392228 /nfs/dbraw/zinc/39/22/28/866392228.db2.gz IUKICLQBPYFDHO-UHFFFAOYSA-N 0 3 416.393 4.419 20 0 HIADHN Cc1ccc([C@H]2CCC[C@@H]2N(C)CC(=O)Nc2ccc(CN3CCOCC3)cc2)cc1 ZINC000441322607 866392330 /nfs/dbraw/zinc/39/23/30/866392330.db2.gz KBTDJLBTMHTIMH-RPBOFIJWSA-N 0 3 421.585 4.034 20 0 HIADHN COc1cc(CN[C@@]2(CO)CCCc3ccccc32)ccc1OCc1c(C)noc1C ZINC000441339571 866410316 /nfs/dbraw/zinc/41/03/16/866410316.db2.gz ZCBGDAFFNSOQLA-RUZDIDTESA-N 0 3 422.525 4.193 20 0 HIADHN COc1ccc(CN(C)C(=O)CN(C)[C@H]2CCC[C@@H]2c2ccc(C)cc2)cc1OC ZINC000441361468 866431302 /nfs/dbraw/zinc/43/13/02/866431302.db2.gz SVFILEOIATZZDE-YADHBBJMSA-N 0 3 410.558 4.239 20 0 HIADHN C[C@@H](C(=O)NCCc1c[nH]c2ccccc12)N1CCC[C@H]1c1cccc(N(C)C)c1 ZINC000441364927 866434505 /nfs/dbraw/zinc/43/45/05/866434505.db2.gz NUQJMHMYUNIHLM-UUOWRZLLSA-N 0 3 404.558 4.118 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)c2cc(F)c(F)cc2Br)CC1 ZINC000441447314 866523216 /nfs/dbraw/zinc/52/32/16/866523216.db2.gz MRWBTXOGQIOWRO-UHFFFAOYSA-N 0 3 423.301 4.464 20 0 HIADHN COc1ccc2c(c1)[C@H](N(CCC(=O)N1CCC[C@H]1C)Cc1ccccc1)CCO2 ZINC000441455080 866529128 /nfs/dbraw/zinc/52/91/28/866529128.db2.gz CUWLZOBCFDDUMU-AUSIDOKSSA-N 0 3 408.542 4.422 20 0 HIADHN CC(C)Sc1c(Cl)cccc1NC(=O)C(=O)NCC(C)(C)N1CCCCC1 ZINC000441559096 866634112 /nfs/dbraw/zinc/63/41/12/866634112.db2.gz PAOHIZNWAIVVPJ-UHFFFAOYSA-N 0 3 411.999 4.160 20 0 HIADHN CN1CCN(CCNC(=O)Nc2cccc(CSC3CCCC3)c2)CC1(C)C ZINC000441662618 866780394 /nfs/dbraw/zinc/78/03/94/866780394.db2.gz LEUWSVUDWISEOF-UHFFFAOYSA-N 0 3 404.624 4.010 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)N[C@@H](C)c2cccc(OC(F)(F)F)c2)o1 ZINC000441688527 866806360 /nfs/dbraw/zinc/80/63/60/866806360.db2.gz FBJHHVSWKWEGAM-HNNXBMFYSA-N 0 3 413.440 4.321 20 0 HIADHN CC(C)Sc1c(Cl)cccc1NC(=O)C(=O)NC[C@@H](C)N1CCCC[C@@H]1C ZINC000441767853 866844468 /nfs/dbraw/zinc/84/44/68/866844468.db2.gz SXYSOZBMXNTBKR-LSDHHAIUSA-N 0 3 411.999 4.158 20 0 HIADHN CC(C)Sc1c(Cl)cccc1NC(=O)C(=O)NC[C@H](C)N1CCC(C)CC1 ZINC000441792367 866862584 /nfs/dbraw/zinc/86/25/84/866862584.db2.gz FGABPQXAJMNUTC-HNNXBMFYSA-N 0 3 411.999 4.016 20 0 HIADHN CCc1cccc(Cc2cnc(NC(=O)N(CCN(C)C)Cc3ccccn3)s2)c1 ZINC000441849199 866910603 /nfs/dbraw/zinc/91/06/03/866910603.db2.gz WKJFSHUMOXQULA-UHFFFAOYSA-N 0 3 423.586 4.287 20 0 HIADHN CC(C)N(CCN(C)C)C(=O)N[C@H]1CCCc2sc(-c3ccc(F)cc3)nc21 ZINC000468164066 882036486 /nfs/dbraw/zinc/03/64/86/882036486.db2.gz JNKPSPBVFQYIFT-KRWDZBQOSA-N 0 3 404.555 4.308 20 0 HIADHN CN(C)Cc1cccc(NC(=O)C(=O)N(Cc2ccccc2)[C@@H]2CCCC2(C)C)c1 ZINC000441996912 867052020 /nfs/dbraw/zinc/05/20/20/867052020.db2.gz BBYVYYIWZNHSAX-JOCHJYFZSA-N 0 3 407.558 4.294 20 0 HIADHN Cc1nn(C(C)(C)C)cc1[C@H](C)NC(=O)N(CCCc1ccccc1)CCN(C)C ZINC000468171858 882050593 /nfs/dbraw/zinc/05/05/93/882050593.db2.gz YYQOXOXJLXOIJT-IBGZPJMESA-N 0 3 413.610 4.214 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N1CCCC[C@@H]1c1ccc(F)cc1F ZINC000442313020 867320722 /nfs/dbraw/zinc/32/07/22/867320722.db2.gz YBXNPBRHPLVDME-OAQYLSRUSA-N 0 3 415.484 4.027 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N[C@H]1c2ccccc2CC[C@H]1C(C)C ZINC000442549362 867524012 /nfs/dbraw/zinc/52/40/12/867524012.db2.gz YMIIGJYTSPYPON-NZQKXSOJSA-N 0 3 407.558 4.071 20 0 HIADHN C[C@H](c1ccc2ccccc2c1)N(C(=O)NCCN1CCN(C)C(C)(C)C1)C1CC1 ZINC000442618931 867563256 /nfs/dbraw/zinc/56/32/56/867563256.db2.gz HFFOGEQQKUMJIX-LJQANCHMSA-N 0 3 408.590 4.101 20 0 HIADHN Cc1sc(Br)c(C(=O)N(CCN(C)C)Cc2cccc(O)c2)c1C ZINC000442636415 867579269 /nfs/dbraw/zinc/57/92/69/867579269.db2.gz IJFCOIWOTQUKIY-UHFFFAOYSA-N 0 3 411.365 4.037 20 0 HIADHN CN(C)CCN(C[C@H]1CCCO1)C(=O)c1[nH]ccc1-c1c(Cl)cccc1Cl ZINC000442734624 867656004 /nfs/dbraw/zinc/65/60/04/867656004.db2.gz UVGFRYUVTRAVLI-CQSZACIVSA-N 0 3 410.345 4.171 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](N[C@@H]2Cc3[nH]c4ccccc4c3C2)c2ccccc2)c1 ZINC000442789499 867675816 /nfs/dbraw/zinc/67/58/16/867675816.db2.gz HIEXPCGNFQXPIG-DFBJGRDBSA-N 0 3 416.546 4.418 20 0 HIADHN C[C@@H](NCCc1ccc2[nH]ccc2c1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000442823843 867687767 /nfs/dbraw/zinc/68/77/67/867687767.db2.gz RUZDELVYPCWUJV-LLVKDONJSA-N 0 3 412.342 4.015 20 0 HIADHN FC(F)(F)c1cc(CN2CCCN(Cc3ccc(C(F)(F)F)cc3)CC2)[nH]n1 ZINC000442826287 867688278 /nfs/dbraw/zinc/68/82/78/867688278.db2.gz WWXSAFQUENZLIZ-UHFFFAOYSA-N 0 3 406.374 4.155 20 0 HIADHN COCc1nc(CNC2CCN(Cc3ccccn3)CC2)c(-c2ccccc2)s1 ZINC000442869305 867706943 /nfs/dbraw/zinc/70/69/43/867706943.db2.gz PILIYYXFNDHBBX-UHFFFAOYSA-N 0 3 408.571 4.106 20 0 HIADHN CN1CCN(CCN[C@H](c2ccccc2Cl)c2cc(F)ccc2F)CC1(C)C ZINC000442874814 867710006 /nfs/dbraw/zinc/71/00/06/867710006.db2.gz NYOUOMHUWCBPOY-OAQYLSRUSA-N 0 3 407.936 4.323 20 0 HIADHN CN(CC[C@@H]1CCCCO1)Cc1cccc(Br)c1OC[C@H]1CCCO1 ZINC000442890730 867722653 /nfs/dbraw/zinc/72/26/53/867722653.db2.gz KXMVOJCZLZDPAU-ZWKOTPCHSA-N 0 3 412.368 4.398 20 0 HIADHN CN1CCN(CCNC(=O)c2cc(Cl)ccc2Sc2ccccc2)CC1(C)C ZINC000442979455 867774356 /nfs/dbraw/zinc/77/43/56/867774356.db2.gz OSDJMXMBAWVJSZ-UHFFFAOYSA-N 0 3 418.006 4.247 20 0 HIADHN Cc1cc2c(o1)c(C(=O)NCCCCN1C[C@@H](C)O[C@@H](C)C1)ccc2Br ZINC000443287859 867892122 /nfs/dbraw/zinc/89/21/22/867892122.db2.gz KTQKREVVJBTHOP-GASCZTMLSA-N 0 3 423.351 4.123 20 0 HIADHN Cc1ccc(S(=O)(=O)CCCN[C@H](C)c2ccc(Br)s2)cc1 ZINC000443347231 867918789 /nfs/dbraw/zinc/91/87/89/867918789.db2.gz XHTYPGCUUHKFRL-CYBMUJFWSA-N 0 3 402.379 4.334 20 0 HIADHN CC1CCN([C@@H](CNC(=O)c2ccc(O[C@@H]3CCOC3)cc2)c2cccs2)CC1 ZINC000468246780 882148595 /nfs/dbraw/zinc/14/85/95/882148595.db2.gz KIGBSVXXDCXWLW-RTWAWAEBSA-N 0 3 414.571 4.119 20 0 HIADHN CCSCc1ccccc1C(=O)NCCCN1CCN(C)C[C@@H]1c1ccccc1 ZINC000468249015 882154113 /nfs/dbraw/zinc/15/41/13/882154113.db2.gz GRJIQJFSXXRRHR-HSZRJFAPSA-N 0 3 411.615 4.048 20 0 HIADHN CCCN(C(=O)c1cccs1)C1CCN(CCOc2cccc(OC)c2)CC1 ZINC000443618424 868185558 /nfs/dbraw/zinc/18/55/58/868185558.db2.gz ZZQKIPBKYFSZEE-UHFFFAOYSA-N 0 3 402.560 4.152 20 0 HIADHN O[C@H](Cc1ccccc1C(F)(F)F)CN1CCC[C@H]1c1cccc2c1OCCO2 ZINC000443624472 868195209 /nfs/dbraw/zinc/19/52/09/868195209.db2.gz FBZRSORYJUMJRV-APWZRJJASA-N 0 3 407.432 4.217 20 0 HIADHN O=C(CCN1CCC[C@H](Oc2ccccc2Cl)C1)N1CCc2sccc2C1 ZINC000443652043 868249570 /nfs/dbraw/zinc/24/95/70/868249570.db2.gz KRUZUSLDPSZEIM-KRWDZBQOSA-N 0 3 404.963 4.220 20 0 HIADHN CC1CCN([C@H](CNC(=O)NCc2cc(=O)[nH]c3ccccc23)c2cccs2)CC1 ZINC000443652600 868249643 /nfs/dbraw/zinc/24/96/43/868249643.db2.gz LNVZNBQLNHGZLR-HXUWFJFHSA-N 0 3 424.570 4.274 20 0 HIADHN C[C@@H]1C[C@H](C)CCN(CC(=O)N(Cc2nnc(-c3ccccc3Cl)o2)C2CC2)C1 ZINC000443654999 868253677 /nfs/dbraw/zinc/25/36/77/868253677.db2.gz NMPJSIDFYCASKQ-HZPDHXFCSA-N 0 3 416.953 4.249 20 0 HIADHN C[C@H](Cc1ccc(Cl)cc1Cl)C(=O)NCCCCN1C[C@@H](C)O[C@@H](C)C1 ZINC000443673517 868280618 /nfs/dbraw/zinc/28/06/18/868280618.db2.gz JOFNKUIMBJUFMM-OAGGEKHMSA-N 0 3 401.378 4.178 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)CCCOc2ccc(Cl)cc2Cl)C[C@H](C)O1 ZINC000443675549 868282515 /nfs/dbraw/zinc/28/25/15/868282515.db2.gz NRLWLYSLAYGRSM-IYBDPMFKSA-N 0 3 417.377 4.158 20 0 HIADHN Cc1ccccc1[C@@H]([C@@H](C)NC(=O)C(=O)Nc1ccc(Cl)c(Cl)c1)N(C)C ZINC000443841267 868372268 /nfs/dbraw/zinc/37/22/68/868372268.db2.gz JRRAYOOEZMPFMN-FZKQIMNGSA-N 0 3 408.329 4.048 20 0 HIADHN CCCn1ccc2ccc(NC(=O)C(=O)N[C@H](C)[C@H](c3ccccc3C)N(C)C)cc21 ZINC000443841291 868373075 /nfs/dbraw/zinc/37/30/75/868373075.db2.gz ZLOFWPTVYVZCIN-WZONZLPQSA-N 0 3 420.557 4.106 20 0 HIADHN FC(F)(F)c1ncc(CNC2CCN(c3ccc(C(F)(F)F)cn3)CC2)s1 ZINC000443977308 868504984 /nfs/dbraw/zinc/50/49/84/868504984.db2.gz HUNRKFCNKWAXDN-UHFFFAOYSA-N 0 3 410.387 4.334 20 0 HIADHN Cc1ccc(CNCC2=Cc3cc(Cl)cc(Cl)c3OC2)cc1S(C)(=O)=O ZINC000443992704 868514819 /nfs/dbraw/zinc/51/48/19/868514819.db2.gz ZUQPKJBYLLNYKB-UHFFFAOYSA-N 0 3 412.338 4.271 20 0 HIADHN Cc1cc(Br)cn2cc(CCNCc3cnc(C(F)(F)F)s3)nc12 ZINC000444002968 868523889 /nfs/dbraw/zinc/52/38/89/868523889.db2.gz QJWSGPANMGWVDJ-UHFFFAOYSA-N 0 3 419.270 4.213 20 0 HIADHN OC[C@H](CNCc1csc(-c2ccc(F)cc2)n1)Cc1cc(F)c(F)c(F)c1 ZINC000444006057 868528483 /nfs/dbraw/zinc/52/84/83/868528483.db2.gz UWNCOWIXICJWCS-ZDUSSCGKSA-N 0 3 410.436 4.307 20 0 HIADHN CSc1ccccc1S(=O)(=O)N(C)[C@H]1CCN(Cc2ccccc2)[C@H](C)C1 ZINC000444082664 868606772 /nfs/dbraw/zinc/60/67/72/868606772.db2.gz IIEAJWDGEHKYJE-MJGOQNOKSA-N 0 3 404.601 4.082 20 0 HIADHN CCOc1ccc([C@H]2CCCN2C(=O)CN(C[C@H]2CCCO2)C2CCCC2)cc1 ZINC000444209774 868668487 /nfs/dbraw/zinc/66/84/87/868668487.db2.gz DOBGAAQNCPIGMO-DHIUTWEWSA-N 0 3 400.563 4.172 20 0 HIADHN COc1cc(NC(=O)CN(C)[C@H]2CCC[C@@H]2c2ccc(C)cc2)cc(OC)c1OC ZINC000444237733 868687207 /nfs/dbraw/zinc/68/72/07/868687207.db2.gz JCDSFVLOTIOWOM-UXHICEINSA-N 0 3 412.530 4.227 20 0 HIADHN COc1cc(Cl)c(Cl)cc1C(=O)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000444449882 868833062 /nfs/dbraw/zinc/83/30/62/868833062.db2.gz NVJGMNHZHGNSBP-UHFFFAOYSA-N 0 3 409.313 4.211 20 0 HIADHN CCCOc1nc(C(=O)Nc2cccc(CN3CCC(O)CC3)c2)cc2ccccc21 ZINC000444453516 868834020 /nfs/dbraw/zinc/83/40/20/868834020.db2.gz IUUHNCBFJCLIER-UHFFFAOYSA-N 0 3 419.525 4.233 20 0 HIADHN O=C(COc1ccc(Cl)c2ccccc12)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000444458430 868836066 /nfs/dbraw/zinc/83/60/66/868836066.db2.gz FFEVNRXPSXETEP-UHFFFAOYSA-N 0 3 424.928 4.467 20 0 HIADHN CC(C)[C@@H]1CC[C@@H](C)C[C@H]1OCC(=O)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000444461105 868836472 /nfs/dbraw/zinc/83/64/72/868836472.db2.gz ONECUYXFJGOGCJ-YFXJRYMSSA-N 0 3 402.579 4.059 20 0 HIADHN Cc1cc(O[C@H](C)C(=O)Nc2cccc(CN3CCC(O)CC3)c2)ccc1Cl ZINC000444459917 868836968 /nfs/dbraw/zinc/83/69/68/868836968.db2.gz HUBIAPZBDVKUSM-MRXNPFEDSA-N 0 3 402.922 4.011 20 0 HIADHN Cc1ccccc1[C@@H](CC(F)(F)F)NC(=O)CCN1CCN(c2ccccc2)CC1 ZINC000444625139 868915892 /nfs/dbraw/zinc/91/58/92/868915892.db2.gz NPZPZWASTMGYPJ-OAQYLSRUSA-N 0 3 419.491 4.317 20 0 HIADHN CCOC(=O)c1c(C)oc2nc(CN[C@@H]3CCCC[C@@H]3c3ccccc3)nc(N)c21 ZINC000444648210 868929714 /nfs/dbraw/zinc/92/97/14/868929714.db2.gz XQEPPSUZVHLJJT-IAGOWNOFSA-N 0 3 408.502 4.106 20 0 HIADHN CO[C@H](C)c1noc(CN2CCCN(Cc3ccc(-c4ccsc4)cc3)CC2)n1 ZINC000444653266 868933173 /nfs/dbraw/zinc/93/31/73/868933173.db2.gz ZFWDPMCKWXZJIH-QGZVFWFLSA-N 0 3 412.559 4.213 20 0 HIADHN CCOc1ccc(OC[C@@H](O)CN2CCC(c3nc4cccc(C)c4o3)CC2)cc1 ZINC000444774700 868996496 /nfs/dbraw/zinc/99/64/96/868996496.db2.gz XPSJBJOWBRZLDR-IBGZPJMESA-N 0 3 410.514 4.154 20 0 HIADHN COc1ccc([C@@H](CNC(=O)CN2CCCC23CCC3)c2c[nH]c3ccccc32)cc1 ZINC000444780987 868999772 /nfs/dbraw/zinc/99/97/72/868999772.db2.gz OCXSIJIWDGGKDE-JOCHJYFZSA-N 0 3 417.553 4.443 20 0 HIADHN CN(C)CCN(C(=O)NCc1ccccc1COCc1ccccc1)C1CCCC1 ZINC000468332909 882266189 /nfs/dbraw/zinc/26/61/89/882266189.db2.gz UQSIEXHPSPQUHK-UHFFFAOYSA-N 0 3 409.574 4.419 20 0 HIADHN Cc1cc2cc[nH]c2cc1NC(=O)NCCCCN1CCN(Cc2ccccc2)CC1 ZINC000444969102 869133499 /nfs/dbraw/zinc/13/34/99/869133499.db2.gz RDAQITHEEFVCAW-UHFFFAOYSA-N 0 3 419.573 4.196 20 0 HIADHN CC1CCN([C@H](CNC(=O)Nc2cnn(C)c2C(F)(F)F)c2cccs2)CC1 ZINC000445027308 869176277 /nfs/dbraw/zinc/17/62/77/869176277.db2.gz FPYSBIIBEOEYBU-CQSZACIVSA-N 0 3 415.485 4.095 20 0 HIADHN Cc1ccc([C@H](Cn2ccnc2)NC(=O)N(C)Cc2cc(C(C)(C)C)[nH]n2)c(C)c1 ZINC000445219967 869283035 /nfs/dbraw/zinc/28/30/35/869283035.db2.gz GVCBRPZJVGUROU-FQEVSTJZSA-N 0 3 408.550 4.103 20 0 HIADHN C[C@H](NC(=O)Cc1noc([C@@H]2CCCN(Cc3cccc(F)c3)C2)n1)c1ccccc1 ZINC000445289879 869341788 /nfs/dbraw/zinc/34/17/88/869341788.db2.gz AKAYFAVDSKNLSX-FXAWDEMLSA-N 0 3 422.504 4.008 20 0 HIADHN C[C@@H](c1nc(-c2csc(I)c2)no1)N1[C@H](C)CC[C@H]1C ZINC000445301822 869354694 /nfs/dbraw/zinc/35/46/94/869354694.db2.gz VKLODUYLLCSZDG-BBBLOLIVSA-N 0 3 403.289 4.337 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)CCSc1ccccn1 ZINC000445801707 869830887 /nfs/dbraw/zinc/83/08/87/869830887.db2.gz HWFSISOIXHCXAI-UHFFFAOYSA-N 0 3 411.493 4.173 20 0 HIADHN CC(C)[C@@H](CC(F)(F)F)NCC(=O)N1CCC[C@H]1c1ccc2c(c1)OCCCO2 ZINC000445878693 869869835 /nfs/dbraw/zinc/86/98/35/869869835.db2.gz VMCUXXXDQLYQAO-SJORKVTESA-N 0 3 414.468 4.078 20 0 HIADHN CN(CCC(=O)Nc1ccccc1F)[C@@H]1CCOc2ccc(Br)cc21 ZINC000445881754 869870380 /nfs/dbraw/zinc/87/03/80/869870380.db2.gz VPWIQOUNFYCXBP-QGZVFWFLSA-N 0 3 407.283 4.372 20 0 HIADHN Cc1sc(C(=O)NC[C@]2(O)CCN(Cc3ccccc3)C2)cc1-c1ccc(F)cc1 ZINC000446252828 870195522 /nfs/dbraw/zinc/19/55/22/870195522.db2.gz LXKCYOPPUNWGIW-XMMPIXPASA-N 0 3 424.541 4.229 20 0 HIADHN COc1cc(C)c(NC(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)cc1C ZINC000446367851 870278160 /nfs/dbraw/zinc/27/81/60/870278160.db2.gz ADKOXBLLOPPENB-OALUTQOASA-N 0 3 403.567 4.055 20 0 HIADHN CN1CCCC(C)(C)[C@H]1CNC(=O)c1ccccc1SCc1cn2ccccc2n1 ZINC000468456743 882395262 /nfs/dbraw/zinc/39/52/62/882395262.db2.gz IQBCMBBBEYFXMI-OAQYLSRUSA-N 0 3 422.598 4.477 20 0 HIADHN CCN(CC)c1nc2sc(C(=O)N(CCN(C)C)Cc3ccco3)cc2s1 ZINC000446423405 870336633 /nfs/dbraw/zinc/33/66/33/870336633.db2.gz ULEPUTKORUSKPA-UHFFFAOYSA-N 0 3 406.577 4.001 20 0 HIADHN CCCc1noc2nc(-c3ccco3)cc(C(=O)N(CCN(C)C)Cc3ccco3)c12 ZINC000446426996 870342882 /nfs/dbraw/zinc/34/28/82/870342882.db2.gz YABRYLMLHMYYNH-UHFFFAOYSA-N 0 3 422.485 4.232 20 0 HIADHN Cc1cc(-c2ncccc2NC(=O)NC2CCN(CCOC(C)C)CC2)cs1 ZINC000446427771 870344156 /nfs/dbraw/zinc/34/41/56/870344156.db2.gz KEYNPJRWXFPWQF-UHFFFAOYSA-N 0 3 402.564 4.129 20 0 HIADHN Cc1ccc([C@@H](CN[C@H](C)c2ccc(Br)cc2F)N2CCOCC2)o1 ZINC000446759973 870672571 /nfs/dbraw/zinc/67/25/71/870672571.db2.gz RIYWXFITMCBZDO-RDTXWAMCSA-N 0 3 411.315 4.214 20 0 HIADHN CC(C)CC1(CNC(=O)N(C)C2CCN(CCc3ccccn3)CC2)CCCC1 ZINC000446773251 870687656 /nfs/dbraw/zinc/68/76/56/870687656.db2.gz BZSOYZUTNSELHL-UHFFFAOYSA-N 0 3 400.611 4.336 20 0 HIADHN CN1CCCC(C)(C)[C@@H]1CNC(=O)c1cc(NC(=O)NC(C)(C)C)ccc1Cl ZINC000468476911 882437146 /nfs/dbraw/zinc/43/71/46/882437146.db2.gz XUQXIFJFJUEYDA-KRWDZBQOSA-N 0 3 408.974 4.110 20 0 HIADHN COC(=O)COc1ccc(CNC2(c3cccc(C(F)(F)F)c3)CCOCC2)cc1 ZINC000446831751 870747821 /nfs/dbraw/zinc/74/78/21/870747821.db2.gz IGUZSYDIOBPVAU-UHFFFAOYSA-N 0 3 423.431 4.053 20 0 HIADHN CCc1nn(C)c(CC)c1CNC1(c2cccc(OC(F)(F)F)c2)CCOCC1 ZINC000446835383 870753122 /nfs/dbraw/zinc/75/31/22/870753122.db2.gz OJXZCUMRQKVQIN-UHFFFAOYSA-N 0 3 411.468 4.239 20 0 HIADHN Cc1ccccc1[C@@H](CC(F)(F)F)NC(=O)N(CCN(C)C)Cc1ccccn1 ZINC000446866277 870786628 /nfs/dbraw/zinc/78/66/28/870786628.db2.gz FPGSMDWLZZWDMP-LJQANCHMSA-N 0 3 408.468 4.157 20 0 HIADHN C[C@]1(c2ccccc2)CCN(C(=O)Nc2ccc(CCN3CCSCC3)cc2)C1 ZINC000446911246 870828524 /nfs/dbraw/zinc/82/85/24/870828524.db2.gz QHSWHLWORUSICQ-DEOSSOPVSA-N 0 3 409.599 4.473 20 0 HIADHN Cc1ccc([C@@H](CCn2cncn2)NCc2ccc(C)cc2OC[C@@H]2CCOC2)cc1 ZINC000446938271 870848056 /nfs/dbraw/zinc/84/80/56/870848056.db2.gz HXYFXJDGJCCLSM-ZJSXRUAMSA-N 0 3 420.557 4.231 20 0 HIADHN CCN(CC)C(=O)c1ccc(NC(=O)N(CCN(C)C)Cc2ccco2)cc1Cl ZINC000446952192 870859365 /nfs/dbraw/zinc/85/93/65/870859365.db2.gz LYNRXHFTXFCYMD-UHFFFAOYSA-N 0 3 420.941 4.011 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1cc(C(F)(F)F)ccc1-n1cccn1 ZINC000446952994 870859822 /nfs/dbraw/zinc/85/98/22/870859822.db2.gz WGZHHPNQXBHEIT-UHFFFAOYSA-N 0 3 421.423 4.080 20 0 HIADHN Cc1ccc(NC(=O)CCN[C@@H](C)c2cccc(NC(=O)c3ccccc3)c2)nc1 ZINC000447013216 870891460 /nfs/dbraw/zinc/89/14/60/870891460.db2.gz LCQXYTRJWNHDMG-SFHVURJKSA-N 0 3 402.498 4.322 20 0 HIADHN COC(=O)[C@](C)(CN[C@H](C)C(=O)Nc1c(C)cc(C)cc1Cl)c1ccc(F)cc1 ZINC000447033036 870909359 /nfs/dbraw/zinc/90/93/59/870909359.db2.gz CVBUEXDMXBZMPW-IVZQSRNASA-N 0 3 420.912 4.143 20 0 HIADHN CC[C@@H](CNC(=O)Nc1cc(-c2n[nH]c(C)n2)ccc1C)N1CCc2ccccc2C1 ZINC000447056748 870936716 /nfs/dbraw/zinc/93/67/16/870936716.db2.gz CIUFGRSZMVCYOK-NRFANRHFSA-N 0 3 418.545 4.047 20 0 HIADHN COc1ccccc1-c1csc([C@H]2CCCN(Cc3cnc4cnccn34)C2)n1 ZINC000447059526 870940184 /nfs/dbraw/zinc/94/01/84/870940184.db2.gz LGWXYJKTTCOZIU-INIZCTEOSA-N 0 3 405.527 4.241 20 0 HIADHN COCCO[C@H]1C[C@H](CO)CN(Cc2ccc(-c3ccc(Cl)c(Cl)c3)o2)C1 ZINC000447093682 870990670 /nfs/dbraw/zinc/99/06/70/870990670.db2.gz LUULPDDHZFSYEM-YOEHRIQHSA-N 0 3 414.329 4.099 20 0 HIADHN COC1(CO)CCN(Cc2cn(Cc3ccccc3)nc2-c2ccc(C)c(C)c2)CC1 ZINC000447095835 870993139 /nfs/dbraw/zinc/99/31/39/870993139.db2.gz ZVENNPXVNORUAT-UHFFFAOYSA-N 0 3 419.569 4.189 20 0 HIADHN Cc1sc([C@@H](C)NC(=O)N2CC[C@H](N3CC=CC3)C2)nc1-c1ccc(Cl)cc1 ZINC000447118966 871020906 /nfs/dbraw/zinc/02/09/06/871020906.db2.gz HXPYOEXKUIJXMI-KDOFPFPSSA-N 0 3 416.978 4.489 20 0 HIADHN CCN(C(=O)c1ccc(N2CCN(CC)CC2)cc1)c1ccc(Br)cc1 ZINC000468494845 882479559 /nfs/dbraw/zinc/47/95/59/882479559.db2.gz IMCLPCJQDYIWGQ-UHFFFAOYSA-N 0 3 416.363 4.258 20 0 HIADHN C[C@@H](CCc1ccc(Br)cc1)NC(=O)N(CCN(C)C)Cc1ccco1 ZINC000447319483 871209997 /nfs/dbraw/zinc/20/99/97/871209997.db2.gz YBSLGDWINRFFDH-INIZCTEOSA-N 0 3 422.367 4.137 20 0 HIADHN C[C@@H](NC(=O)N(CCN(C)C)Cc1ccco1)c1cccc(OCc2ccccn2)c1 ZINC000447320953 871211800 /nfs/dbraw/zinc/21/18/00/871211800.db2.gz ITHKUAKFFCEPEN-LJQANCHMSA-N 0 3 422.529 4.088 20 0 HIADHN CCC[C@H](NC(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1)c1ccc(F)cc1F ZINC000468499945 882490424 /nfs/dbraw/zinc/49/04/24/882490424.db2.gz BULPZEUYUDBDGM-JKSBSHDWSA-N 0 3 423.548 4.337 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)N[C@H](COc1ccccc1)c1ccccc1 ZINC000447389623 871299171 /nfs/dbraw/zinc/29/91/71/871299171.db2.gz ZSNJZATWQYUCKG-HSZRJFAPSA-N 0 3 407.514 4.173 20 0 HIADHN CCC[C@]1(COC)CCCN1Cc1nc(-c2ccc(OC(F)F)c(OC)c2)no1 ZINC000447400835 871310550 /nfs/dbraw/zinc/31/05/50/871310550.db2.gz SDIGPIZNJWJCBR-HXUWFJFHSA-N 0 3 411.449 4.128 20 0 HIADHN C[C@H](c1ccc(C(F)(F)F)cc1)N(C)C(=O)CCN1CCN(c2ccccc2)CC1 ZINC000468504936 882502441 /nfs/dbraw/zinc/50/24/41/882502441.db2.gz CKDIURRYEISIPU-GOSISDBHSA-N 0 3 419.491 4.437 20 0 HIADHN Cc1sc(CC(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)nc1C(C)C ZINC000447549246 871424599 /nfs/dbraw/zinc/42/45/99/871424599.db2.gz DOTVXYTZRCVVQJ-LJQANCHMSA-N 0 3 423.586 4.400 20 0 HIADHN CC1(C)COc2c1cccc2C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000447560602 871449919 /nfs/dbraw/zinc/44/99/19/871449919.db2.gz WTRCJXFVMCJJRC-LJQANCHMSA-N 0 3 416.525 4.252 20 0 HIADHN CCOC1CC(CN[C@@H](C)c2cc(F)c(Cl)cc2Cl)(N2CCOCC2)C1 ZINC000447580433 871482422 /nfs/dbraw/zinc/48/24/22/871482422.db2.gz QKLRYIMNOUJRSX-CDJWAVJASA-N 0 3 405.341 4.053 20 0 HIADHN CC1(C)CCN(C(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)CCS1 ZINC000447640001 871559856 /nfs/dbraw/zinc/55/98/56/871559856.db2.gz GPUJYUDXRNPUJC-LJQANCHMSA-N 0 3 400.510 4.185 20 0 HIADHN COc1cccc2sc(NC(=O)CN[C@H](C[C@@H]3CCOC3)c3ccccc3)nc21 ZINC000447889246 871803306 /nfs/dbraw/zinc/80/33/06/871803306.db2.gz GYKDGNBVSGPYFU-DOTOQJQBSA-N 0 3 411.527 4.001 20 0 HIADHN C[C@@H]1OCC[C@@]1(O)CN(Cc1ccccc1)Cc1ccccc1Oc1cccnc1 ZINC000447926752 871816098 /nfs/dbraw/zinc/81/60/98/871816098.db2.gz NFMNQMJRAVWLHV-NBGIEHNGSA-N 0 3 404.510 4.416 20 0 HIADHN CCOc1cc(CN[C@H](CO)[C@H]2CCCO2)ccc1OCc1c(F)cccc1Cl ZINC000447982002 871833966 /nfs/dbraw/zinc/83/39/66/871833966.db2.gz HUUQBMPIZXOBDC-WOJBJXKFSA-N 0 3 423.912 4.086 20 0 HIADHN CN1CCCC(C)(C)[C@@H]1CN[C@@H](c1ccc(F)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000448025210 871865162 /nfs/dbraw/zinc/86/51/62/871865162.db2.gz CFAVPAXMFVQGKN-VXKWHMMOSA-N 0 3 418.578 4.029 20 0 HIADHN CO[C@@H]1CCOc2c(NC(=O)NC[C@H](c3cccs3)N3CCCC3)cccc21 ZINC000448049935 871881039 /nfs/dbraw/zinc/88/10/39/871881039.db2.gz MKYUOJBVGWKUAV-QZTJIDSGSA-N 0 3 401.532 4.177 20 0 HIADHN COc1cc(NC(=O)N(C)C[C@@H]2CCN(C)[C@H]2c2cccnc2)ccc1C(F)(F)F ZINC000448072712 871895346 /nfs/dbraw/zinc/89/53/46/871895346.db2.gz VWIXLGGLOCNSAT-KXBFYZLASA-N 0 3 422.451 4.266 20 0 HIADHN CSc1nc(C2CC2)nc(C)c1C(=O)NC[C@H](C(C)C)N1CCc2ccccc2C1 ZINC000468532154 882558918 /nfs/dbraw/zinc/55/89/18/882558918.db2.gz WBNYQYFUMANMBG-HXUWFJFHSA-N 0 3 424.614 4.197 20 0 HIADHN COc1cc(NC(=O)N(CCN(C)C)Cc2cccs2)ccc1C(F)(F)F ZINC000448088421 871921220 /nfs/dbraw/zinc/92/12/20/871921220.db2.gz MTIZDTXYQMCQTL-UHFFFAOYSA-N 0 3 401.454 4.371 20 0 HIADHN C[C@@H](CSCc1ccccc1)C(=O)N(C)C1CCN(CCc2ccccn2)CC1 ZINC000448157990 872035240 /nfs/dbraw/zinc/03/52/40/872035240.db2.gz JTSNETOZZYMKPL-FQEVSTJZSA-N 0 3 411.615 4.116 20 0 HIADHN O=S(=O)(c1c(Cl)ccc2ccccc21)N1CC[C@@H]2[C@H](CCCN2C2CC2)C1 ZINC000448163629 872040036 /nfs/dbraw/zinc/04/00/36/872040036.db2.gz IETWPOPMOOSIPA-OXQOHEQNSA-N 0 3 404.963 4.131 20 0 HIADHN O=S(=O)(c1c(Cl)cc(Cl)cc1Cl)N1CC[C@@H]2[C@H](CCCN2C2CC2)C1 ZINC000448164130 872041557 /nfs/dbraw/zinc/04/15/57/872041557.db2.gz IETAESTWAIWYNQ-BDJLRTHQSA-N 0 3 423.793 4.284 20 0 HIADHN O=C(NC[C@@H]1CCSC1)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000448247456 872164361 /nfs/dbraw/zinc/16/43/61/872164361.db2.gz DZGGZDZAKGOXNW-INIZCTEOSA-N 0 3 416.418 4.354 20 0 HIADHN Cc1ccc2cc(C(=O)Nc3ccnn3[C@@H]3CCN(Cc4ccccc4)C3)ccc2n1 ZINC000448256563 872179699 /nfs/dbraw/zinc/17/96/99/872179699.db2.gz NLWYHJDVJXIGSO-JOCHJYFZSA-N 0 3 411.509 4.439 20 0 HIADHN CC(C)(COc1ncccc1C(F)(F)F)NC(=O)c1cccc(CN2CCCC2)c1 ZINC000448456004 872408149 /nfs/dbraw/zinc/40/81/49/872408149.db2.gz GRUKTVUCWUPRPW-UHFFFAOYSA-N 0 3 421.463 4.284 20 0 HIADHN CC[C@@H](NC(=O)N(Cc1ccccc1Br)C1CCN(C)CC1)C(C)C ZINC000460115471 872584655 /nfs/dbraw/zinc/58/46/55/872584655.db2.gz NDMXWMBZYFBPNE-LJQANCHMSA-N 0 3 410.400 4.490 20 0 HIADHN CCN(C(=O)Nc1cc(NC(=O)C2CC2)ccc1C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000460132900 872619447 /nfs/dbraw/zinc/61/94/47/872619447.db2.gz HIXPEHNUNMIWMJ-JOCHJYFZSA-N 0 3 420.557 4.472 20 0 HIADHN CC[C@@H](C)NC(=O)c1ccc(NC(=O)N(CC)[C@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000460136147 872628996 /nfs/dbraw/zinc/62/89/96/872628996.db2.gz UGOMOWIQHSFNOV-XXBNENTESA-N 0 3 422.573 4.343 20 0 HIADHN CN1CCC(N(Cc2ccccc2Br)C(=O)NC[C@H]2CC=CCC2)CC1 ZINC000460149176 872667560 /nfs/dbraw/zinc/66/75/60/872667560.db2.gz NMOQIQPIQLDVMX-KRWDZBQOSA-N 0 3 420.395 4.411 20 0 HIADHN Cc1cc(NC(=O)N(C)C2CCN(CCn3cccn3)CC2)ccc1-c1ccccc1 ZINC000460243560 872831976 /nfs/dbraw/zinc/83/19/76/872831976.db2.gz XJYUDMTZWHPUKJ-UHFFFAOYSA-N 0 3 417.557 4.487 20 0 HIADHN CCCN(CCN1CCN(CC)CC1)C(=O)N[C@@H](c1ccc(Cl)cc1)C1CCC1 ZINC000460268493 872857807 /nfs/dbraw/zinc/85/78/07/872857807.db2.gz IFBZLLZKCUINRH-JOCHJYFZSA-N 0 3 421.029 4.240 20 0 HIADHN CCCN(CCN1CCN(CC)CC1)C(=O)N[C@H](C)c1cc2ccccc2s1 ZINC000460277484 872866108 /nfs/dbraw/zinc/86/61/08/872866108.db2.gz RRABEXRDWPFYFP-GOSISDBHSA-N 0 3 402.608 4.021 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)N2CCCC[C@H]2c2nnc(C3CCC3)o2)CN1Cc1ccccc1 ZINC000460366429 873000798 /nfs/dbraw/zinc/00/07/98/873000798.db2.gz ZMNPZZQEQZYMGP-UIFIKXQLSA-N 0 3 423.561 4.237 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)Nc1ccccc1CC(F)(F)F ZINC000460398253 873048234 /nfs/dbraw/zinc/04/82/34/873048234.db2.gz DMXKSJYAYXPJHU-UHFFFAOYSA-N 0 3 405.464 4.332 20 0 HIADHN CC[C@@H](C)[C@@H](NC(=O)c1ccc(N2CCN(CC)CC2)cc1)c1nc2ccccc2[nH]1 ZINC000468593845 882682793 /nfs/dbraw/zinc/68/27/93/882682793.db2.gz CBAQZTWOXFVOHF-WZONZLPQSA-N 0 3 419.573 4.222 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)N3CCC(=Cc4cccc(F)c4)CC3)CC2)c1 ZINC000468596012 882688942 /nfs/dbraw/zinc/68/89/42/882688942.db2.gz AHHATOIWGKASGU-UHFFFAOYSA-N 0 3 421.560 4.352 20 0 HIADHN CCN1C[C@H](C)N(c2nnc(CSc3ccccc3OC)n2CC(C)C)C[C@@H]1C ZINC000460596171 873335783 /nfs/dbraw/zinc/33/57/83/873335783.db2.gz HOOXLOUFMYDWRT-ROUUACIJSA-N 0 3 417.623 4.154 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)N1CCCC[C@H]1c1nnc(C2CCC2)o1 ZINC000460648652 873389025 /nfs/dbraw/zinc/38/90/25/873389025.db2.gz MBJXPPMDQFGKLH-XLIONFOSSA-N 0 3 411.550 4.094 20 0 HIADHN C[C@H]1CCCN(CCNC(=O)c2ccc(Oc3cccc(Cl)c3Cl)nn2)C1 ZINC000460734660 873553614 /nfs/dbraw/zinc/55/36/14/873553614.db2.gz KMLJRGOUZSXZJV-ZDUSSCGKSA-N 0 3 409.317 4.037 20 0 HIADHN CC(C)(CNC(=O)c1ccc(OCc2ccccn2)cc1)N1CCc2ccccc2C1 ZINC000460778290 873631877 /nfs/dbraw/zinc/63/18/77/873631877.db2.gz PSKFJVSESBUSFE-UHFFFAOYSA-N 0 3 415.537 4.227 20 0 HIADHN CC(C)N1CCCN(C(=O)c2ccc(Oc3cccc(Cl)c3Cl)nn2)CC1 ZINC000460882600 873794265 /nfs/dbraw/zinc/79/42/65/873794265.db2.gz RYEBADWQEIQECS-UHFFFAOYSA-N 0 3 409.317 4.132 20 0 HIADHN CC(C)=CCOc1cccc(C(=O)N(C)C2CCN(CCc3ccccn3)CC2)c1 ZINC000460895948 873805841 /nfs/dbraw/zinc/80/58/41/873805841.db2.gz NZWKWKWXJDJDBS-UHFFFAOYSA-N 0 3 407.558 4.206 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)c2ccc(OCc3ccccn3)cc2)C1 ZINC000460977230 873870762 /nfs/dbraw/zinc/87/07/62/873870762.db2.gz LBZPHAVJHAWRBW-DENIHFKCSA-N 0 3 401.510 4.226 20 0 HIADHN CCSc1cc(Cl)ccc1C(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000460982021 873872837 /nfs/dbraw/zinc/87/28/37/873872837.db2.gz QATSDACDHPYWCR-IYBDPMFKSA-N 0 3 411.011 4.413 20 0 HIADHN O=C(CC1(N2CCOCC2)CCCC1)N(Cc1ccccc1)Cc1ccc(F)cc1 ZINC000468646001 882782633 /nfs/dbraw/zinc/78/26/33/882782633.db2.gz ASQROGGHKUKCHI-UHFFFAOYSA-N 0 3 410.533 4.390 20 0 HIADHN COc1ccc2oc([C@@H](C)NCc3ccc(N4CCCS4(=O)=O)cc3)c(C)c2c1 ZINC000461095095 874012386 /nfs/dbraw/zinc/01/23/86/874012386.db2.gz WPGUYFXWYFNFJQ-MRXNPFEDSA-N 0 3 414.527 4.141 20 0 HIADHN CCOc1cc(CN2CCCC[C@H](CCOC)C2)cc(Br)c1OC ZINC000468697694 882819066 /nfs/dbraw/zinc/81/90/66/882819066.db2.gz WSKOCQFWXQMYMD-OAHLLOKOSA-N 0 3 400.357 4.495 20 0 HIADHN O=C([C@H]1CCCN(Cc2cccc(F)c2)C1)N1CC[C@@H](COCc2ccccc2)C1 ZINC000461380189 874385480 /nfs/dbraw/zinc/38/54/80/874385480.db2.gz APSJLVHCTSWFNO-PKTZIBPZSA-N 0 3 410.533 4.103 20 0 HIADHN C[C@H](c1ccc(Cl)cc1)N1CCN(C(=O)c2cccc(CN3CCCC3)c2)CC1 ZINC000461388328 874394692 /nfs/dbraw/zinc/39/46/92/874394692.db2.gz PJBXHWIAUWEOFR-LJQANCHMSA-N 0 3 411.977 4.455 20 0 HIADHN CN(C)Cc1cccc(C(=O)NCc2nc3c(s2)C[C@@H](c2ccccc2)CC3)c1 ZINC000468723512 882829535 /nfs/dbraw/zinc/82/95/35/882829535.db2.gz GKZXLODUCJVUSL-IBGZPJMESA-N 0 3 405.567 4.407 20 0 HIADHN CCc1ccc(C(=O)CCC(=O)N2C[C@@H]3CCN(Cc4ccccc4)C[C@H]3C2)cc1 ZINC000461424140 874456607 /nfs/dbraw/zinc/45/66/07/874456607.db2.gz HHRJEKCWTFMYOU-ZEQRLZLVSA-N 0 3 404.554 4.192 20 0 HIADHN Cc1c(C(=O)N2C[C@H]3CN(Cc4ccccc4)CC[C@@H]3C2)[nH]c2c1C(=O)CC(C)(C)C2 ZINC000461439720 874493518 /nfs/dbraw/zinc/49/35/18/874493518.db2.gz UIXCWQGDVDDTDV-WOJBJXKFSA-N 0 3 419.569 4.072 20 0 HIADHN Cc1cc(C(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)nn1-c1c(F)cccc1F ZINC000468744884 882839583 /nfs/dbraw/zinc/83/95/83/882839583.db2.gz SLZUSWGUMHANRC-SJLPKXTDSA-N 0 3 410.468 4.024 20 0 HIADHN CCC(CC)CC(=O)NC1CCN(CCOc2ccc(Br)cc2)CC1 ZINC000468754041 882844339 /nfs/dbraw/zinc/84/43/39/882844339.db2.gz AFANYXOGHVDMSW-UHFFFAOYSA-N 0 3 411.384 4.235 20 0 HIADHN CC(C)c1nccn1CCC(=O)NCC1CCN(Cc2ccccc2Cl)CC1 ZINC000468775246 882854551 /nfs/dbraw/zinc/85/45/51/882854551.db2.gz BAUWLGUJMLFTSD-UHFFFAOYSA-N 0 3 402.970 4.078 20 0 HIADHN Cc1c2cc(C)ccc2sc1C(=O)Nc1ccccc1CN1CCC[C@H](C(N)=O)C1 ZINC000468804027 882866986 /nfs/dbraw/zinc/86/69/86/882866986.db2.gz CHAOYMIAGNGRDS-SFHVURJKSA-N 0 3 421.566 4.468 20 0 HIADHN C[C@H](CC(=O)N(C)C1CCN(CCc2ccccn2)CC1)c1c[nH]c2ccccc21 ZINC000468811489 882871063 /nfs/dbraw/zinc/87/10/63/882871063.db2.gz CJCUASZMBWKLQM-LJQANCHMSA-N 0 3 404.558 4.222 20 0 HIADHN CC(C)N(CCN(C)C)C(=O)N[C@@H]1CCCc2c3cc(Br)ccc3[nH]c21 ZINC000461733816 874879800 /nfs/dbraw/zinc/87/98/00/874879800.db2.gz YQJSDSPWWYYPSW-GOSISDBHSA-N 0 3 421.383 4.289 20 0 HIADHN C[C@@H](NC(=O)N(CCN(C)C)C1CCCC1)c1ccc(Br)cc1F ZINC000461796974 874912371 /nfs/dbraw/zinc/91/23/71/874912371.db2.gz PPDNDLOGJPDWBS-CYBMUJFWSA-N 0 3 400.336 4.165 20 0 HIADHN C[C@@H](C(=O)NCCCN1CCc2ccccc2C1)c1cccc(Br)c1 ZINC000461888337 875038689 /nfs/dbraw/zinc/03/86/89/875038689.db2.gz GXPBAGNAKDNRFL-MRXNPFEDSA-N 0 3 401.348 4.117 20 0 HIADHN COC(=O)[C@@](C)(CN[C@H](C)C(=O)Nc1cc(Cl)ccc1Cl)c1ccccc1 ZINC000468861376 882895045 /nfs/dbraw/zinc/89/50/45/882895045.db2.gz GDEZFOLURYKMIH-XCLFUZPHSA-N 0 3 409.313 4.041 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1cccc(C(=O)N(C)CC(C)(C)C)c1 ZINC000462161475 875257193 /nfs/dbraw/zinc/25/71/93/875257193.db2.gz DSFVALFRSUMSTO-AUSIDOKSSA-N 0 3 421.585 4.055 20 0 HIADHN CC(C)c1noc(-c2ccccc2C(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)n1 ZINC000462161469 875257486 /nfs/dbraw/zinc/25/74/86/875257486.db2.gz DQMSPDXXROVLFQ-UTKZUKDTSA-N 0 3 404.514 4.110 20 0 HIADHN CCOC(=O)c1csc(CCN[C@@H]2CCc3c2c(Br)ccc3F)n1 ZINC000468876750 882911668 /nfs/dbraw/zinc/91/16/68/882911668.db2.gz ILAVTZDHNODQCC-CYBMUJFWSA-N 0 3 413.312 4.041 20 0 HIADHN Cc1ccc(-c2cnc(CCC(=O)N[C@H]3CN(Cc4ccccc4)C[C@H]3C)o2)cc1 ZINC000462181320 875280241 /nfs/dbraw/zinc/28/02/41/875280241.db2.gz JVCWZFSSFDGIKX-KNQAVFIVSA-N 0 3 403.526 4.219 20 0 HIADHN Cc1nc(CCC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)oc1-c1ccccc1 ZINC000462180887 875280724 /nfs/dbraw/zinc/28/07/24/875280724.db2.gz OIVNXEALLPVGQP-PGRDOPGGSA-N 0 3 403.526 4.219 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)CCc1ncc(-c2ccccc2F)o1 ZINC000462189603 875294566 /nfs/dbraw/zinc/29/45/66/875294566.db2.gz OGEDUJPCUMMVBI-DYESRHJHSA-N 0 3 407.489 4.050 20 0 HIADHN CC(C)(C)n1cnc(C(=O)N(CCN2CCCC2)Cc2ccc(Cl)c(Cl)c2)n1 ZINC000462248649 875367960 /nfs/dbraw/zinc/36/79/60/875367960.db2.gz TZZZFNQOAPVPRN-UHFFFAOYSA-N 0 3 424.376 4.078 20 0 HIADHN C[C@H](C(=O)Nc1ccc(OC2CCN(C)CC2)nc1)c1cccc(Br)c1 ZINC000462277270 875404889 /nfs/dbraw/zinc/40/48/89/875404889.db2.gz YMAJYQLCMZJFSW-AWEZNQCLSA-N 0 3 418.335 4.059 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@H]1CCO[C@@H](c2ccccc2)C1)c1ccsc1 ZINC000462532314 875651598 /nfs/dbraw/zinc/65/15/98/875651598.db2.gz ZLVNPXUUYRTGAT-PWRODBHTSA-N 0 3 401.576 4.351 20 0 HIADHN Fc1ccccc1-c1ccc(CNCc2cnc(N3CCOCC3)c(F)c2)s1 ZINC000462536263 875656106 /nfs/dbraw/zinc/65/61/06/875656106.db2.gz IOXVUDOVELUCLF-UHFFFAOYSA-N 0 3 401.482 4.215 20 0 HIADHN Cc1nc(C(F)(F)F)sc1C(=O)Nc1cccc(N2CCN(C(C)C)CC2)c1 ZINC000462549287 875673234 /nfs/dbraw/zinc/67/32/34/875673234.db2.gz JGTNUNKELXVXLG-UHFFFAOYSA-N 0 3 412.481 4.253 20 0 HIADHN C[C@H](N[C@@H]1CCCN(Cc2ccc(F)cc2F)C1=O)c1ccc(OC(F)F)cc1 ZINC000468906636 882961272 /nfs/dbraw/zinc/96/12/72/882961272.db2.gz HVYNVKOXQKLXPQ-ORAYPTAESA-N 0 3 410.411 4.408 20 0 HIADHN COc1cccc(Cl)c1CNC[C@H](CO)Cc1ccccc1OC(F)(F)F ZINC000462740511 875811347 /nfs/dbraw/zinc/81/13/47/875811347.db2.gz RTCDVFNLFAHOLX-CYBMUJFWSA-N 0 3 403.828 4.188 20 0 HIADHN OC[C@H](CNCc1ccc(Br)cc1F)Cc1c(F)cccc1Cl ZINC000462740671 875811377 /nfs/dbraw/zinc/81/13/77/875811377.db2.gz SJCMBUWOVOQWBC-NSHDSACASA-N 0 3 404.682 4.322 20 0 HIADHN COc1cc(CN[C@@H]2CC(=O)N([C@@H]3C[C@H]3C)C2)ccc1OCc1ccc(Cl)cc1 ZINC000462755383 875819458 /nfs/dbraw/zinc/81/94/58/875819458.db2.gz KLVHKBNUMCPFGY-CDHQVMDDSA-N 0 3 414.933 4.027 20 0 HIADHN CC(C)(C)OC(=O)c1ccc(CN2CCC(C(=O)NC3CCCCC3)CC2)cc1 ZINC000462799520 875848898 /nfs/dbraw/zinc/84/88/98/875848898.db2.gz UOXUSXUFEDGZSW-UHFFFAOYSA-N 0 3 400.563 4.303 20 0 HIADHN CCCNC(=O)[C@@H]1CCCN(c2c(C)c(C)nc3ccc(Br)cc32)C1 ZINC000462807966 875854478 /nfs/dbraw/zinc/85/44/78/875854478.db2.gz UEXOVOJQDMAVCW-OAHLLOKOSA-N 0 3 404.352 4.357 20 0 HIADHN CNc1cc(N2CCC[C@H]2CN[C@@H](C)c2csc(-c3ccccc3F)n2)ncn1 ZINC000462817194 875859091 /nfs/dbraw/zinc/85/90/91/875859091.db2.gz NBICUBOAFPLIGE-GJZGRUSLSA-N 0 3 412.538 4.101 20 0 HIADHN Cc1ccc(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)cc1NC(=O)NC(C)(C)C ZINC000462821553 875860371 /nfs/dbraw/zinc/86/03/71/875860371.db2.gz ZPSLDIBUIQGYEZ-XMSQKQJNSA-N 0 3 422.573 4.165 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](N[C@@H]2CCO[C@@H](C3CC3)C2)c2ccc(F)c(F)c2)c1 ZINC000462840249 875875302 /nfs/dbraw/zinc/87/53/02/875875302.db2.gz QLHSNYYHBJKSQX-YHYVQYDKSA-N 0 3 421.509 4.005 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](N[C@H]2CCO[C@@H](C3CC3)C2)c2ccc(F)c(F)c2)c1 ZINC000462840248 875875477 /nfs/dbraw/zinc/87/54/77/875875477.db2.gz QLHSNYYHBJKSQX-WTOYTKOKSA-N 0 3 421.509 4.005 20 0 HIADHN NC(=O)C1CCN(C[C@@H](NCc2ccc(C(F)F)cc2)c2ccc(Cl)cc2)CC1 ZINC000462847101 875881921 /nfs/dbraw/zinc/88/19/21/875881921.db2.gz VLZGQXJXSGMXMI-HXUWFJFHSA-N 0 3 421.919 4.306 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N[C@@H](CC(F)(F)F)c1ccccc1 ZINC000463004011 876019327 /nfs/dbraw/zinc/01/93/27/876019327.db2.gz WDPSZOFHTPGLCR-LSTHTHJFSA-N 0 3 405.464 4.500 20 0 HIADHN COCCCCN(Cc1ccccc1)C(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C ZINC000463020082 876037563 /nfs/dbraw/zinc/03/75/63/876037563.db2.gz NWRQOZMKKMATBO-URXFXBBRSA-N 0 3 409.574 4.145 20 0 HIADHN C[C@@H](NCc1ccc(S(=O)(=O)N2CCCC2)cc1)c1ccc(OC(C)(C)C)cc1 ZINC000463028206 876048083 /nfs/dbraw/zinc/04/80/83/876048083.db2.gz LROTVTSZIWKPPH-GOSISDBHSA-N 0 3 416.587 4.499 20 0 HIADHN COc1cc(CN[C@H](C)c2ccc(OC(C)(C)C)cc2)ccc1OCC(=O)N(C)C ZINC000463031053 876051206 /nfs/dbraw/zinc/05/12/06/876051206.db2.gz URQGDVRQBWLWDM-QGZVFWFLSA-N 0 3 414.546 4.190 20 0 HIADHN CN(C)Cc1cccc(NC(=O)[C@@H](c2ccc(Cl)cc2Cl)N2CCOCC2)c1 ZINC000463089292 876121418 /nfs/dbraw/zinc/12/14/18/876121418.db2.gz DMQZBMIARAVZJY-HXUWFJFHSA-N 0 3 422.356 4.067 20 0 HIADHN Cc1cccc(NC[C@H]2CCN(Cc3nc4ccc(Br)cc4o3)C2)n1 ZINC000463090332 876122903 /nfs/dbraw/zinc/12/29/03/876122903.db2.gz GKQXKLQNAHJRJO-CQSZACIVSA-N 0 3 401.308 4.228 20 0 HIADHN CCc1nsc(N2CCCN(CCCCCn3c(C)nc4ccccc43)CC2)n1 ZINC000463110266 876148030 /nfs/dbraw/zinc/14/80/30/876148030.db2.gz VETWCIQGKXIASA-UHFFFAOYSA-N 0 3 412.607 4.141 20 0 HIADHN C[C@H](CCc1ccccc1F)C(=O)NCCCCN1CCN(c2ccccc2)CC1 ZINC000463127474 876172371 /nfs/dbraw/zinc/17/23/71/876172371.db2.gz NPRSTJSETGVFLT-OAQYLSRUSA-N 0 3 411.565 4.113 20 0 HIADHN COc1ccc([C@@H](NCCN2CCCOCC2)c2ccc(C(F)(F)F)cc2)cc1 ZINC000463156489 876209527 /nfs/dbraw/zinc/20/95/27/876209527.db2.gz NRAJTFTXGMVLQL-NRFANRHFSA-N 0 3 408.464 4.115 20 0 HIADHN Cn1c2cc(Br)ccc2nc1CN1CCCC[C@@H]1[C@@H]1CCCC[C@@H]1O ZINC000463198213 876258385 /nfs/dbraw/zinc/25/83/85/876258385.db2.gz LISODDAAMPLPAX-WDYCEAGBSA-N 0 3 406.368 4.241 20 0 HIADHN Cn1c2cc(Br)ccc2nc1CN1CCCC[C@@H]1[C@H]1CCCC[C@@H]1O ZINC000463198211 876258960 /nfs/dbraw/zinc/25/89/60/876258960.db2.gz LISODDAAMPLPAX-SUMDDJOVSA-N 0 3 406.368 4.241 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](NCCCC2CCOCC2)c2ccc(F)cc2)c1 ZINC000463248672 876306545 /nfs/dbraw/zinc/30/65/45/876306545.db2.gz VZTPZUKZSPOXLX-JOCHJYFZSA-N 0 3 405.535 4.115 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)N[C@H](C)c2ccc(Cl)c3ccccc32)CC1 ZINC000463263473 876321657 /nfs/dbraw/zinc/32/16/57/876321657.db2.gz SUACKXPOKPGSDT-QZTJIDSGSA-N 0 3 416.997 4.127 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)N[C@@H](C)c2ccc(Cl)c3ccccc32)CC1 ZINC000463263472 876321927 /nfs/dbraw/zinc/32/19/27/876321927.db2.gz SUACKXPOKPGSDT-MSOLQXFVSA-N 0 3 416.997 4.127 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)NCc1ccc(-c2cccnc2)cc1 ZINC000463266226 876325151 /nfs/dbraw/zinc/32/51/51/876325151.db2.gz LPGAZNBGSBBZKT-DVECYGJZSA-N 0 3 400.526 4.068 20 0 HIADHN Cn1c(CNC2CCN(C(=O)c3ccccc3Cl)CC2)nc2cc(Cl)ccc21 ZINC000463284666 876343246 /nfs/dbraw/zinc/34/32/46/876343246.db2.gz HMHWUZAPXWBSQC-UHFFFAOYSA-N 0 3 417.340 4.275 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)cc1C(=O)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000463296460 876356289 /nfs/dbraw/zinc/35/62/89/876356289.db2.gz UWXYPKOUBDOZFM-QFIPXVFZSA-N 0 3 408.933 4.401 20 0 HIADHN COCCN1CCC(NC(=O)c2c(F)cccc2Sc2ccc(Cl)cc2)CC1 ZINC000463313042 876372521 /nfs/dbraw/zinc/37/25/21/876372521.db2.gz FOCJZOBVGJWKIX-UHFFFAOYSA-N 0 3 422.953 4.471 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cccc(Br)c3C)c(C)c2)CC1 ZINC000463322259 876378641 /nfs/dbraw/zinc/37/86/41/876378641.db2.gz XTWASCBMGFUYEY-UHFFFAOYSA-N 0 3 416.363 4.460 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)[C@@H]1SCCc2sccc21)c1cccc(OC)c1 ZINC000463341136 876396770 /nfs/dbraw/zinc/39/67/70/876396770.db2.gz ULBOHOQZMSWFHN-AZUAARDMSA-N 0 3 404.601 4.286 20 0 HIADHN CCN(CC)[C@H](CNC(=O)[C@@H]1SCCc2sccc21)c1cccc(OC)c1 ZINC000463341139 876397670 /nfs/dbraw/zinc/39/76/70/876397670.db2.gz ULBOHOQZMSWFHN-UYAOXDASSA-N 0 3 404.601 4.286 20 0 HIADHN CN(CCc1cccc(Br)c1)C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000463401317 876456352 /nfs/dbraw/zinc/45/63/52/876456352.db2.gz CESRLUUZLQHXEY-WOJBJXKFSA-N 0 3 416.363 4.078 20 0 HIADHN CC(C)[C@H](CNC(=O)[C@@H]1SCCc2sccc21)N1CCc2ccccc2C1 ZINC000463408586 876462275 /nfs/dbraw/zinc/46/22/75/876462275.db2.gz ZXVOHVITSMXRBS-PZJWPPBQSA-N 0 3 400.613 4.278 20 0 HIADHN COc1cc(-c2noc(CN[C@H]3CCCCC34CCCC4)n2)cc(OC)c1OC ZINC000463429448 876483835 /nfs/dbraw/zinc/48/38/35/876483835.db2.gz JNLRXOXJJFIRKE-SFHVURJKSA-N 0 3 401.507 4.355 20 0 HIADHN CC(C)(C)C(=O)Nc1ccc(F)c(C(=O)NC[C@H](c2ccccc2)N2CCCC2)c1 ZINC000463430491 876486249 /nfs/dbraw/zinc/48/62/49/876486249.db2.gz NPRYEHPTTWNQPB-OAQYLSRUSA-N 0 3 411.521 4.377 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)c1ccc(F)c(Br)c1 ZINC000463510127 876572297 /nfs/dbraw/zinc/57/22/97/876572297.db2.gz AFDPTKQGNYUHSP-UHFFFAOYSA-N 0 3 407.327 4.225 20 0 HIADHN C[C@H](CC(=O)c1ccccc1F)C(=O)N1CCC(N2CCc3ccccc3C2)CC1 ZINC000463522262 876590064 /nfs/dbraw/zinc/59/00/64/876590064.db2.gz YCLDQHHLSFBQLQ-GOSISDBHSA-N 0 3 408.517 4.084 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)[C@H]1C[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000463526033 876596545 /nfs/dbraw/zinc/59/65/45/876596545.db2.gz DGIAWMQFESUOCT-CABCVRRESA-N 0 3 412.402 4.076 20 0 HIADHN Cc1nn(C)c(Sc2ccccc2)c1C(=O)NC[C@@H](c1ccc(C)cc1)N(C)C ZINC000463533390 876612117 /nfs/dbraw/zinc/61/21/17/876612117.db2.gz PVHKDCDNWASZIV-FQEVSTJZSA-N 0 3 408.571 4.221 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)[C@@H]2C[C@@H]2c2cc(F)c(F)c(F)c2)CC1 ZINC000463574071 876669237 /nfs/dbraw/zinc/66/92/37/876669237.db2.gz MFEOVZNXMUTIAI-RTBURBONSA-N 0 3 402.460 4.330 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)CCc2cccc(C(F)(F)F)c2)CC1 ZINC000463574772 876669447 /nfs/dbraw/zinc/66/94/47/876669447.db2.gz DFWFRBJZSQEPSU-INIZCTEOSA-N 0 3 405.464 4.375 20 0 HIADHN C[C@@H](CC(=O)c1ccccc1F)C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000463588646 876696134 /nfs/dbraw/zinc/69/61/34/876696134.db2.gz JJPKZQLWZMQAQH-KRWDZBQOSA-N 0 3 414.546 4.265 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)cc1C(=O)NC[C@@H]1CCCN1Cc1ccccc1 ZINC000463714252 876833454 /nfs/dbraw/zinc/83/34/54/876833454.db2.gz KCLJLRFVVPQCNZ-NRFANRHFSA-N 0 3 408.933 4.229 20 0 HIADHN C[C@@H]1CC[C@H](CC(=O)NC2CCN(CCOc3ccc(Br)cc3)CC2)C1 ZINC000469009405 883076658 /nfs/dbraw/zinc/07/66/58/883076658.db2.gz RNFCLHVMNHBHAZ-SJORKVTESA-N 0 3 423.395 4.235 20 0 HIADHN CSCc1cccnc1C(=O)N(c1cccc(SC)c1)C1CCN(C)CC1 ZINC000463810208 876926840 /nfs/dbraw/zinc/92/68/40/876926840.db2.gz OKDWBDUAVHNEFH-UHFFFAOYSA-N 0 3 401.601 4.408 20 0 HIADHN C[C@@H](C(=O)N(Cc1ccco1)C1CCN(C)CC1)c1ccc(Br)s1 ZINC000463824769 876939400 /nfs/dbraw/zinc/93/94/00/876939400.db2.gz GKMBCJTUJUSVNI-CYBMUJFWSA-N 0 3 411.365 4.330 20 0 HIADHN COc1ccc([C@@H](N[C@@H]2CCCN(Cc3ccc(F)cc3F)C2=O)C2CC2)cc1 ZINC000469011582 883080156 /nfs/dbraw/zinc/08/01/56/883080156.db2.gz ONLONMSVXSQKKV-YADHBBJMSA-N 0 3 400.469 4.205 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N(C)c3cccc(OC(F)(F)F)c3)cc2)CC1 ZINC000469013527 883081496 /nfs/dbraw/zinc/08/14/96/883081496.db2.gz QOQKVHHLMQSMCJ-UHFFFAOYSA-N 0 3 407.436 4.004 20 0 HIADHN CCN1CCCC[C@H]1CNC(=O)c1ccc(-c2noc(-c3ccc(F)cc3)n2)cc1 ZINC000463859504 876980864 /nfs/dbraw/zinc/98/08/64/876980864.db2.gz WHZXXBBFPPHCQH-FQEVSTJZSA-N 0 3 408.477 4.147 20 0 HIADHN Cc1csc(C(=O)Nc2cc(C)cc(CN(C)C)c2)c1I ZINC000469024737 883092550 /nfs/dbraw/zinc/09/25/50/883092550.db2.gz RZOGPLDUKQDPMC-UHFFFAOYSA-N 0 3 414.312 4.283 20 0 HIADHN C[C@H]1[C@@H](NC(=O)Nc2ccc(NC(=O)c3cccc(Cl)c3)c(F)c2)CCCN1C ZINC000463987668 877121378 /nfs/dbraw/zinc/12/13/78/877121378.db2.gz OVUFKEZCUZXDJW-UGSOOPFHSA-N 0 3 418.900 4.336 20 0 HIADHN C[C@@H]1[C@H](NC(=O)Nc2ccc(NC(=O)c3cccc(Cl)c3)c(F)c2)CCCN1C ZINC000463987666 877121541 /nfs/dbraw/zinc/12/15/41/877121541.db2.gz OVUFKEZCUZXDJW-FZKQIMNGSA-N 0 3 418.900 4.336 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)C1CCC(C(F)(F)F)CC1 ZINC000469032386 883101997 /nfs/dbraw/zinc/10/19/97/883101997.db2.gz SYVKKXKPJWIERX-UHFFFAOYSA-N 0 3 411.512 4.074 20 0 HIADHN Cc1ccc(-n2nc(C(=O)N(CC(C)C)C3CCN(C)CC3)c3c2CCC3)c(F)c1 ZINC000503238326 912219334 /nfs/dbraw/zinc/21/93/34/912219334.db2.gz IDNXYXDBDBLREU-UHFFFAOYSA-N 0 3 412.553 4.001 20 0 HIADHN O=C(CN(CCCOc1ccccc1)C1CCOCC1)N1CCC[C@H]2CCCC[C@@H]21 ZINC000464575293 877797624 /nfs/dbraw/zinc/79/76/24/877797624.db2.gz FVDMNFGSMNUNPQ-QPPBQGQZSA-N 0 3 414.590 4.118 20 0 HIADHN CCCN(CCc1cccs1)CC(=O)Nc1cccc(CN2CCSCC2)c1 ZINC000464579903 877802828 /nfs/dbraw/zinc/80/28/28/877802828.db2.gz XSNSPIFVTYURSE-UHFFFAOYSA-N 0 3 417.644 4.190 20 0 HIADHN Cc1nn(C(C)(C)C)cc1[C@@H](C)NC[C@@H](O)COc1c(Cl)cccc1Cl ZINC000464600983 877829300 /nfs/dbraw/zinc/82/93/00/877829300.db2.gz GMZCWFSSFIHWHS-TZMCWYRMSA-N 0 3 400.350 4.344 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@@H](C)N2CC[C@@H](CSc3ccccc3)C2)cc1F ZINC000464773393 878016848 /nfs/dbraw/zinc/01/68/48/878016848.db2.gz NJJJBKGJQYYXDK-IEBWSBKVSA-N 0 3 416.562 4.295 20 0 HIADHN Cc1nn(C)c(C)c1NC(=O)[C@@H](C)N[C@@H](COc1c(C)cccc1C)C(C)(C)C ZINC000464785827 878031315 /nfs/dbraw/zinc/03/13/15/878031315.db2.gz GWRUSARDCFITHA-MJGOQNOKSA-N 0 3 400.567 4.064 20 0 HIADHN COC(=O)c1ccc(CN2CCC[C@H](c3nc(-c4ccc(F)cc4)no3)C2)cc1F ZINC000464864172 878144546 /nfs/dbraw/zinc/14/45/46/878144546.db2.gz HQJCPCKQFIPRJZ-INIZCTEOSA-N 0 3 413.424 4.181 20 0 HIADHN CC(=O)CCc1ccc(O[C@@H](C)C(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)cc1 ZINC000464890063 878188852 /nfs/dbraw/zinc/18/88/52/878188852.db2.gz GYPMLWSWJHOCHA-UNMCSNQZSA-N 0 3 422.569 4.099 20 0 HIADHN O=C(NCc1ccco1)c1cccc(CN2CCC[C@@H](c3ncc4n3CCCC4)C2)c1 ZINC000503369299 912346670 /nfs/dbraw/zinc/34/66/70/912346670.db2.gz BVVXLEYDZNGIHL-OAQYLSRUSA-N 0 3 418.541 4.122 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(Cl)cc2)CC1)c1cccc2cnccc21 ZINC000465135496 878516167 /nfs/dbraw/zinc/51/61/67/878516167.db2.gz YOOMIZMTUAQDEP-UHFFFAOYSA-N 0 3 409.917 4.161 20 0 HIADHN CC(C)c1noc(-c2ccc(NC(=O)NC[C@@H](Cc3ccccc3)N(C)C)cc2)n1 ZINC000503375281 912356629 /nfs/dbraw/zinc/35/66/29/912356629.db2.gz RJPLNULHONTSDZ-HXUWFJFHSA-N 0 3 407.518 4.154 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)NCC(C)(C)Cc1cccc(Cl)c1 ZINC000465228766 878645038 /nfs/dbraw/zinc/64/50/38/878645038.db2.gz OPFCPSSIQXEABS-UHFFFAOYSA-N 0 3 402.970 4.077 20 0 HIADHN Cc1ccc(OC(F)F)c(CNC(=O)N(Cc2ccccc2)C2CCN(C)CC2)c1 ZINC000465230323 878646822 /nfs/dbraw/zinc/64/68/22/878646822.db2.gz IZFTWDJVJADTMU-UHFFFAOYSA-N 0 3 417.500 4.402 20 0 HIADHN Cn1cc(-c2cc(CN3CCC(c4ccc(Br)cc4)CC3)on2)cn1 ZINC000503391465 912375006 /nfs/dbraw/zinc/37/50/06/912375006.db2.gz LJVKIQQLWNSJPF-UHFFFAOYSA-N 0 3 401.308 4.217 20 0 HIADHN COc1ccc(C2CCN(C(=O)[C@@H]3CCCN(Cc4cccc(F)c4)C3)CC2)cc1 ZINC000465382270 878823530 /nfs/dbraw/zinc/82/35/30/878823530.db2.gz NOQUORQDTYKKGE-JOCHJYFZSA-N 0 3 410.533 4.453 20 0 HIADHN CC[C@H](NC(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1)c1c(C)nn(C)c1C ZINC000465427549 878857536 /nfs/dbraw/zinc/85/75/36/878857536.db2.gz YJDLLAXZYSIFHC-OALUTQOASA-N 0 3 417.623 4.322 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N2CC[C@H](COCc3ccccc3)C2)N(C)C)cc1 ZINC000465429599 878859655 /nfs/dbraw/zinc/85/96/55/878859655.db2.gz HVBSUKRJDGUJJT-UPVQGACJSA-N 0 3 409.574 4.100 20 0 HIADHN C[C@H]1CCN(C(=O)N[C@@H](c2ccccc2)c2ccccn2)CCN1Cc1ccccc1 ZINC000465429840 878861437 /nfs/dbraw/zinc/86/14/37/878861437.db2.gz GWXKWGRFGQZNTR-OFVILXPXSA-N 0 3 414.553 4.477 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N[C@H](C)c2nc(C3CCCCC3)no2)N(C)C)cc1 ZINC000465431222 878863485 /nfs/dbraw/zinc/86/34/85/878863485.db2.gz JYAXTHNUPRGFKC-UZLBHIALSA-N 0 3 413.566 4.343 20 0 HIADHN CCc1ccc([C@H](CNC(=O)NCc2ccc(-c3cccnc3)cc2)N(C)C)cc1 ZINC000465438495 878871551 /nfs/dbraw/zinc/87/15/51/878871551.db2.gz XSPIITBYBKGXGN-DEOSSOPVSA-N 0 3 402.542 4.413 20 0 HIADHN Cc1ccc(CCN(C[C@@H]2CCCO2)C(=O)NC[C@H](c2ccccc2)N(C)C)cc1 ZINC000465454147 878885361 /nfs/dbraw/zinc/88/53/61/878885361.db2.gz LYTCAXXKKXUOTK-BJKOFHAPSA-N 0 3 409.574 4.031 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@H](c1nc(C)cs1)C1CC1)c1cccc(OC)c1 ZINC000465507050 878946116 /nfs/dbraw/zinc/94/61/16/878946116.db2.gz AWDAMNLIDXBYFX-UXHICEINSA-N 0 3 416.591 4.294 20 0 HIADHN O[C@@H](COc1ccc(Cl)cc1Cl)CN1CCC[C@H](c2ncc3n2CCCC3)C1 ZINC000503416600 912402389 /nfs/dbraw/zinc/40/23/89/912402389.db2.gz RKTWALIPNSWAMA-MAUKXSAKSA-N 0 3 424.372 4.146 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N[C@@H](C)c1cccc(-n2cccn2)c1)c1ccsc1 ZINC000465520240 878968807 /nfs/dbraw/zinc/96/88/07/878968807.db2.gz ABFNKTOFCHPYCO-UWJYYQICSA-N 0 3 411.575 4.377 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@H](C)c1ccc(-n2cccn2)cc1)c1ccsc1 ZINC000465533811 878991771 /nfs/dbraw/zinc/99/17/71/878991771.db2.gz MIIRRBRJTFZAAL-DYESRHJHSA-N 0 3 411.575 4.377 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)N3CCC4(C3)CCCCC4)CC2)c1 ZINC000465540671 879002280 /nfs/dbraw/zinc/00/22/80/879002280.db2.gz GMZNNSUIDDBFQP-UHFFFAOYSA-N 0 3 412.622 4.263 20 0 HIADHN CCO[C@H](C)c1nc(CN(C)C(=O)N[C@H](CN2CCCC2)c2ccccc2)cs1 ZINC000465598908 879087332 /nfs/dbraw/zinc/08/73/32/879087332.db2.gz MGASHIQVZAQGOV-YLJYHZDGSA-N 0 3 416.591 4.219 20 0 HIADHN CCCOCc1ccccc1CNC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC000465673285 879211851 /nfs/dbraw/zinc/21/18/51/879211851.db2.gz YFIMNOMRMXTZPJ-OAQYLSRUSA-N 0 3 409.574 4.419 20 0 HIADHN CCCOCc1ccccc1CNC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1 ZINC000465673284 879212894 /nfs/dbraw/zinc/21/28/94/879212894.db2.gz YFIMNOMRMXTZPJ-NRFANRHFSA-N 0 3 409.574 4.419 20 0 HIADHN CC[C@H](NC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1)c1ccc2c(c1)OCCO2 ZINC000465708340 879274892 /nfs/dbraw/zinc/27/48/92/879274892.db2.gz MGMGPSZSRJOKDH-UGKGYDQZSA-N 0 3 423.557 4.215 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)NCc2c(F)cccc2OC(F)F)C1 ZINC000465759453 879353700 /nfs/dbraw/zinc/35/37/00/879353700.db2.gz PBCFPDUESOGLTB-ZBFHGGJFSA-N 0 3 407.436 4.062 20 0 HIADHN C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC000465792709 879401991 /nfs/dbraw/zinc/40/19/91/879401991.db2.gz YVEWLKKJXHIDIU-WOJBJXKFSA-N 0 3 423.557 4.042 20 0 HIADHN CC(C)COC[C@H](NC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1)c1ccco1 ZINC000465800494 879411341 /nfs/dbraw/zinc/41/13/41/879411341.db2.gz XKGZTTFYEMQWMQ-IRLDBZIGSA-N 0 3 413.562 4.299 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)NCc2coc(-c3ccccc3)n2)N2CCCC2)cc1 ZINC000465810444 879428763 /nfs/dbraw/zinc/42/87/63/879428763.db2.gz HXDQVUNOBOBKND-JOCHJYFZSA-N 0 3 404.514 4.286 20 0 HIADHN C[C@H]1CCN(C(=O)NCc2cccc(OCC(F)F)c2)CCN1Cc1ccccc1 ZINC000465825561 879455142 /nfs/dbraw/zinc/45/51/42/879455142.db2.gz GKSLKFCBCOJLNW-SFHVURJKSA-N 0 3 417.500 4.137 20 0 HIADHN CN(C)CCN(C[C@@H]1CCCO1)C(=O)NCC(C)(C)c1ccc(Cl)c(Cl)c1 ZINC000465826461 879457519 /nfs/dbraw/zinc/45/75/19/879457519.db2.gz OMKDFPHNWMXYDY-INIZCTEOSA-N 0 3 416.393 4.023 20 0 HIADHN CC(C)[C@@H](NC(=O)N(CCN(C)C)C[C@H]1CCCO1)c1cccc(C(F)(F)F)c1 ZINC000465830191 879462370 /nfs/dbraw/zinc/46/23/70/879462370.db2.gz HRTKUVKNRDRMDD-RTBURBONSA-N 0 3 415.500 4.155 20 0 HIADHN COc1cc(Cl)ccc1CNC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC000465907162 879568476 /nfs/dbraw/zinc/56/84/76/879568476.db2.gz JUPVQQYHABLPEM-QGZVFWFLSA-N 0 3 401.938 4.155 20 0 HIADHN CC(C)[C@H](CNC(=O)N1CC[C@@H](N2CC=CC2)C1)Cc1ccc(Cl)cc1Cl ZINC000465925128 879588318 /nfs/dbraw/zinc/58/83/18/879588318.db2.gz NZJAYNXUTJDSNV-PKOBYXMFSA-N 0 3 410.389 4.464 20 0 HIADHN COc1ccccc1C[C@H](C)N(Cc1ccccc1)C(=O)N[C@@H]1CCN(C2CC2)C1 ZINC000466021114 879707032 /nfs/dbraw/zinc/70/70/32/879707032.db2.gz WWOPGDGKHRTVMA-SIKLNZKXSA-N 0 3 407.558 4.075 20 0 HIADHN COc1cccc([C@H](Cc2cc(C)cc(C)c2)NC(=O)N(C)[C@H]2CCN(C3CC3)C2)c1 ZINC000466033188 879721044 /nfs/dbraw/zinc/72/10/44/879721044.db2.gz JRKREKYNVJEKQE-ZCYQVOJMSA-N 0 3 421.585 4.474 20 0 HIADHN COc1ccccc1[C@@]1(C)C[C@@H]1NC(=O)N(CCN(C)C)Cc1cccc(Cl)c1 ZINC000466047657 879736936 /nfs/dbraw/zinc/73/69/36/879736936.db2.gz GXAZRXJJEAIJMV-JTHBVZDNSA-N 0 3 415.965 4.152 20 0 HIADHN CCC[C@H](CCc1ccccc1)NC(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000466053101 879743390 /nfs/dbraw/zinc/74/33/90/879743390.db2.gz PMFDWGHOQDABSC-ZFGGDYGUSA-N 0 3 415.622 4.319 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)NCc1coc(-c2ccccc2)n1 ZINC000466061739 879756866 /nfs/dbraw/zinc/75/68/66/879756866.db2.gz IFCOHFQPXNSXSA-UHFFFAOYSA-N 0 3 406.530 4.048 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccc(O)cc1)C(=O)CCC(=O)c1cccc(F)c1 ZINC000503463241 912495620 /nfs/dbraw/zinc/49/56/20/912495620.db2.gz OWPCQRIFYJCDPD-NRFANRHFSA-N 0 3 412.505 4.007 20 0 HIADHN CCCN(C(=O)N[C@@H]1CCc2c1cccc2O)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000466095353 879813998 /nfs/dbraw/zinc/81/39/98/879813998.db2.gz OFCVGYIBTULJFK-NFBKMPQASA-N 0 3 407.558 4.466 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)N[C@@H]1CCc2c1cccc2O ZINC000466098226 879816570 /nfs/dbraw/zinc/81/65/70/879816570.db2.gz GOKCCJUAYGHTRI-LJQANCHMSA-N 0 3 421.463 4.172 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)N2CCCCC[C@@H]2c2ccc(Cl)cc2)CC1 ZINC000466132031 879844496 /nfs/dbraw/zinc/84/44/96/879844496.db2.gz MYZQQOXHXJITOM-SIKLNZKXSA-N 0 3 421.029 4.240 20 0 HIADHN Cc1cc(C)cc(Oc2ccc(NC(=O)NC[C@@H](C)CN3CCN(C)CC3)cc2)c1 ZINC000466134918 879846516 /nfs/dbraw/zinc/84/65/16/879846516.db2.gz HPBIUKURAPEYFG-HXUWFJFHSA-N 0 3 410.562 4.101 20 0 HIADHN C[C@@H](CNC(=O)N(Cc1cccc2ccccc21)C1CCCC1)CN1CCN(C)CC1 ZINC000466150523 879857041 /nfs/dbraw/zinc/85/70/41/879857041.db2.gz YTNPCPUOZWJRQH-NRFANRHFSA-N 0 3 422.617 4.178 20 0 HIADHN COc1ccc(CNC(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1OC1CCCC1 ZINC000503474467 912513144 /nfs/dbraw/zinc/51/31/44/912513144.db2.gz QOMLQMWQMPQUTF-NRFANRHFSA-N 0 3 423.557 4.090 20 0 HIADHN Cc1ccc(-c2nc(CCNC(=O)N[C@H]3C[C@@H](C)N(Cc4ccccc4)C3)co2)cc1 ZINC000466247068 879962102 /nfs/dbraw/zinc/96/21/02/879962102.db2.gz UTYZYHJNZFSNQC-XXBNENTESA-N 0 3 418.541 4.155 20 0 HIADHN COc1ccc([C@@H](CNC(=O)Nc2ccc(NC(=O)C(C)C)cc2)N2CCCC2)cc1 ZINC000503476874 912516051 /nfs/dbraw/zinc/51/60/51/912516051.db2.gz AABUWIIVLUTXSN-JOCHJYFZSA-N 0 3 424.545 4.248 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)NC[C@@H]2CCCO[C@@H]2c2ccccc2)CN1Cc1ccccc1 ZINC000466258241 879985081 /nfs/dbraw/zinc/98/50/81/879985081.db2.gz KMHAOMKSZVZHEM-QLBRKBSLSA-N 0 3 407.558 4.117 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NC[C@@H](C)Sc3ccccc3)c(C)c2)CC1 ZINC000466327446 880081505 /nfs/dbraw/zinc/08/15/05/880081505.db2.gz YHIMVJKXEJIOJD-LJQANCHMSA-N 0 3 412.603 4.439 20 0 HIADHN C[C@@H](NCc1cncc(Br)c1)[C@H](OC1CCOCC1)c1ccccc1 ZINC000466362208 880120006 /nfs/dbraw/zinc/12/00/06/880120006.db2.gz JQXFUKYKLOKQDH-QRWLVFNGSA-N 0 3 405.336 4.259 20 0 HIADHN C[C@H](CNC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1)c1ccc(F)cc1F ZINC000466430132 880205250 /nfs/dbraw/zinc/20/52/50/880205250.db2.gz CXFVEZKROMXBEX-QZTJIDSGSA-N 0 3 401.501 4.374 20 0 HIADHN O=C1C[C@@H](NCc2ccc(F)c3cccnc23)CN1Cc1ccccc1C(F)(F)F ZINC000466451015 880229714 /nfs/dbraw/zinc/22/97/14/880229714.db2.gz CMYXWEGXFAVSJM-MRXNPFEDSA-N 0 3 417.406 4.283 20 0 HIADHN O=C1C[C@H](NCc2c[nH]nc2-c2cccs2)CN1Cc1ccccc1C(F)(F)F ZINC000466473759 880255212 /nfs/dbraw/zinc/25/52/12/880255212.db2.gz LCGUSUGHUGYUPJ-HNNXBMFYSA-N 0 3 420.460 4.048 20 0 HIADHN C[C@H](NC(=O)N[C@H]1C[C@@H](C)N(Cc2ccccc2)C1)c1ncc(-c2ccccc2)o1 ZINC000466504683 880279258 /nfs/dbraw/zinc/27/92/58/880279258.db2.gz NJJWMOAWKJXJHB-LQWHRVPQSA-N 0 3 404.514 4.365 20 0 HIADHN COc1ccc(OC(F)F)c(NC(=O)N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)c1 ZINC000466513195 880287655 /nfs/dbraw/zinc/28/76/55/880287655.db2.gz HNVJAZFXBFLWOL-GDBMZVCRSA-N 0 3 405.445 4.081 20 0 HIADHN C[C@H]1C[C@H](NC(=O)NCc2csc(-c3ccccc3)n2)CN1Cc1ccccc1 ZINC000466517223 880290530 /nfs/dbraw/zinc/29/05/30/880290530.db2.gz ISBFZBPCLXTJAM-PXNSSMCTSA-N 0 3 406.555 4.272 20 0 HIADHN COc1ccc(NC(=O)N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)c(C(F)(F)F)c1 ZINC000466521205 880296432 /nfs/dbraw/zinc/29/64/32/880296432.db2.gz GRNDUOLMQBEVOF-GDBMZVCRSA-N 0 3 407.436 4.499 20 0 HIADHN Cc1cccc(C(=O)N2CCCC2)c1NC(=O)N[C@@H]1C[C@@H](C)N(Cc2ccccc2)C1 ZINC000466522204 880297823 /nfs/dbraw/zinc/29/78/23/880297823.db2.gz JTSAPKKVOOPEKM-TZIWHRDSSA-N 0 3 420.557 4.016 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1C[C@@H](C)N(Cc2ccccc2)C1)c1nc(C2CCCCC2)no1 ZINC000466533825 880307849 /nfs/dbraw/zinc/30/78/49/880307849.db2.gz KDQLTYUIDCBMOC-FUHIMQAGSA-N 0 3 411.550 4.141 20 0 HIADHN CCOc1cc(F)ccc1NC(=O)NC[C@H](c1ccc(OC)cc1)N1CCCC1 ZINC000503513062 912558898 /nfs/dbraw/zinc/55/88/98/912558898.db2.gz YHDUOFORHGSHOF-HXUWFJFHSA-N 0 3 401.482 4.192 20 0 HIADHN C[C@@H]1CCN(C)CCN1C(=O)NCc1ccc(OC(C)(C)C)cc1C(F)(F)F ZINC000466589051 880360574 /nfs/dbraw/zinc/36/05/74/880360574.db2.gz VMOUJRIDFVARBN-CQSZACIVSA-N 0 3 401.473 4.118 20 0 HIADHN C[C@H]1CCN(C)CCN1C(=O)NCc1ccc(OC(C)(C)C)cc1C(F)(F)F ZINC000466589050 880361266 /nfs/dbraw/zinc/36/12/66/880361266.db2.gz VMOUJRIDFVARBN-AWEZNQCLSA-N 0 3 401.473 4.118 20 0 HIADHN CCc1c(NC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)cnn1-c1ccccc1 ZINC000466664764 880446847 /nfs/dbraw/zinc/44/68/47/880446847.db2.gz LYEFTZWTEZCQDE-PGRDOPGGSA-N 0 3 403.530 4.077 20 0 HIADHN CCc1c(NC(=O)NC[C@H](c2cccs2)N2CCCC2)cnn1-c1ccccc1 ZINC000466678428 880465557 /nfs/dbraw/zinc/46/55/57/880465557.db2.gz SLRPMVMLWPGFOR-HXUWFJFHSA-N 0 3 409.559 4.455 20 0 HIADHN Cc1ccc(-c2nc(CNC(=O)N3CC[C@H](C)N(Cc4ccccc4)CC3)co2)cc1 ZINC000466755128 880535039 /nfs/dbraw/zinc/53/50/39/880535039.db2.gz XJXNOMHXBVLJEY-FQEVSTJZSA-N 0 3 418.541 4.456 20 0 HIADHN COCC[C@@H]1CCCCN(C(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)C1 ZINC000466847012 880616204 /nfs/dbraw/zinc/61/62/04/880616204.db2.gz SQXLXECHOKYDOZ-PZJWPPBQSA-N 0 3 412.496 4.106 20 0 HIADHN CSc1ccc([C@@H](C)NC(=O)N2CCC(CN3C[C@@H](C)O[C@H](C)C3)CC2)cc1 ZINC000466847241 880617587 /nfs/dbraw/zinc/61/75/87/880617587.db2.gz TWXKRSJRCFXVRJ-KZNAEPCWSA-N 0 3 405.608 4.000 20 0 HIADHN Cc1cc(C(F)(F)F)ccc1CNCc1c[nH]nc1-c1ccc2c(c1)OCCO2 ZINC000466911179 880679830 /nfs/dbraw/zinc/67/98/30/880679830.db2.gz OMQFDGHFSFHDJB-UHFFFAOYSA-N 0 3 403.404 4.465 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@H]2CNC(=O)N2CCN(C3CCC(C)CC3)CC2)cc1 ZINC000466937727 880705753 /nfs/dbraw/zinc/70/57/53/880705753.db2.gz HVFZDQAAZQRJSG-QFUKKKHRSA-N 0 3 413.606 4.369 20 0 HIADHN CN(CCN(Cc1nnc2n1CCCCC2)Cc1ccccc1)Cc1ccccc1 ZINC000466940807 880710449 /nfs/dbraw/zinc/71/04/49/880710449.db2.gz QXCVGXAMPCCICP-UHFFFAOYSA-N 0 3 403.574 4.139 20 0 HIADHN Cn1cccc1CNC(=O)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000466959779 880744728 /nfs/dbraw/zinc/74/47/28/880744728.db2.gz NKPFIPZLBROWQF-UHFFFAOYSA-N 0 3 409.361 4.140 20 0 HIADHN C[C@@H](NC(=O)N(CCCc1ccccc1)CCN(C)C)c1ccc(-n2cccn2)cc1 ZINC000466972054 880772998 /nfs/dbraw/zinc/77/29/98/880772998.db2.gz BKYAZPMNJKKVHA-OAQYLSRUSA-N 0 3 419.573 4.139 20 0 HIADHN CCS[C@@H]1CC[C@@H](N(C)C(=O)Nc2ccc(N3CCN(CC)CC3)cc2C)C1 ZINC000466978507 880783105 /nfs/dbraw/zinc/78/31/05/880783105.db2.gz ZELCRWSLJOMANE-UYAOXDASSA-N 0 3 404.624 4.275 20 0 HIADHN O=C([C@H]1CCCc2[nH]ncc21)N1CCN(Cc2ccc(-c3cccc(F)c3)s2)CC1 ZINC000466991126 880803261 /nfs/dbraw/zinc/80/32/61/880803261.db2.gz MLMJFUFHHLAGAN-IBGZPJMESA-N 0 3 424.545 4.042 20 0 HIADHN CC(C)c1ccc(C(=O)Nc2ccccc2CN2CCC[C@@H](C(N)=O)C2)cc1Cl ZINC000466998041 880808086 /nfs/dbraw/zinc/80/80/86/880808086.db2.gz MQYKNGWSENRWMB-GOSISDBHSA-N 0 3 413.949 4.413 20 0 HIADHN C[C@H](C(=O)N[C@@H]1C[C@H](C)N(Cc2ccccc2)C1)c1ccc(Br)s1 ZINC000467025073 880825981 /nfs/dbraw/zinc/82/59/81/880825981.db2.gz QYHCCNGYEZZGKJ-OFQRWUPVSA-N 0 3 407.377 4.393 20 0 HIADHN Cc1ccc(-c2cnc(CCC(=O)N[C@@H]3C[C@H](C)N(Cc4ccccc4)C3)o2)cc1 ZINC000467033930 880831849 /nfs/dbraw/zinc/83/18/49/880831849.db2.gz CYCDUZNTBGVQFB-SIKLNZKXSA-N 0 3 403.526 4.362 20 0 HIADHN Cc1nc(COc2cccc(C(=O)N[C@@H]3C[C@@H](C)N(Cc4ccccc4)C3)c2)cs1 ZINC000467034533 880832888 /nfs/dbraw/zinc/83/28/88/880832888.db2.gz PJIUYYOBNALTKS-DYESRHJHSA-N 0 3 421.566 4.423 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)c2cccc(C(=O)N(C)CC(C)(C)C)c2)CN1Cc1ccccc1 ZINC000467040185 880837425 /nfs/dbraw/zinc/83/74/25/880837425.db2.gz HLOVUCHJSXMJFC-AUSIDOKSSA-N 0 3 421.585 4.198 20 0 HIADHN C[C@@H](NC(=O)N(Cc1ccco1)C1CCN(C)CC1)c1nc(C2CCCCC2)no1 ZINC000467044636 880839839 /nfs/dbraw/zinc/83/98/39/880839839.db2.gz HRQHXXMMQOQWOU-MRXNPFEDSA-N 0 3 415.538 4.077 20 0 HIADHN Cc1noc(CSc2ccccc2C(=O)N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)n1 ZINC000467046188 880840292 /nfs/dbraw/zinc/84/02/92/880840292.db2.gz NHPCQELJWSPCEO-APWZRJJASA-N 0 3 422.554 4.063 20 0 HIADHN C[C@H]1CN(C2CC2)C[C@@H]1NC(=O)Cc1csc(-c2ccc(Cl)cc2Cl)n1 ZINC000467050093 880842455 /nfs/dbraw/zinc/84/24/55/880842455.db2.gz WTGHUOCNPVPRQU-GTNSWQLSSA-N 0 3 410.370 4.258 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)c2cccc(OCc3cscn3)c2)CN1Cc1ccccc1 ZINC000467052670 880843365 /nfs/dbraw/zinc/84/33/65/880843365.db2.gz AUXCEEPFELUATP-XLIONFOSSA-N 0 3 407.539 4.115 20 0 HIADHN COCCOc1c(Cl)cccc1NC(=O)N[C@H]1C[C@H](C)N(Cc2ccccc2)C1 ZINC000467113087 880871989 /nfs/dbraw/zinc/87/19/89/880871989.db2.gz OYFGHMQVOIJQIE-WMZOPIPTSA-N 0 3 417.937 4.150 20 0 HIADHN CC[C@H]1Oc2cc([C@H](C)NC(=O)c3oc4ccccc4c3CN(C)C)ccc2NC1=O ZINC000467125038 880879410 /nfs/dbraw/zinc/87/94/10/880879410.db2.gz GQBLONRNTLDLEV-IFXJQAMLSA-N 0 3 421.497 4.095 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)NCc1nc(-c2ccccc2F)cs1)c1ccco1 ZINC000503550772 912618203 /nfs/dbraw/zinc/61/82/03/912618203.db2.gz IMIBTIYRVHXFIE-WMLDXEAASA-N 0 3 416.522 4.471 20 0 HIADHN Cc1ccc(NC(=O)C2CCN(CCOc3ccc(OC(F)(F)F)cc3)CC2)nc1 ZINC000467192039 880921505 /nfs/dbraw/zinc/92/15/05/880921505.db2.gz RBMGCVSOALJBKF-UHFFFAOYSA-N 0 3 423.435 4.018 20 0 HIADHN Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)N1CCCN(C)CC1 ZINC000467279680 881025791 /nfs/dbraw/zinc/02/57/91/881025791.db2.gz TUGJODWQECBQLS-UHFFFAOYSA-N 0 3 400.910 4.070 20 0 HIADHN CCN1CCCN(C(=O)Nc2ccc(NC(=O)c3cccc(Cl)c3)cc2C)CC1 ZINC000467282942 881030032 /nfs/dbraw/zinc/03/00/32/881030032.db2.gz FNAUTMBKBMMUCQ-UHFFFAOYSA-N 0 3 414.937 4.460 20 0 HIADHN COC[C@@H]1CCCCN([C@@H](C)C(=O)Nc2ccc3c(c2)OC2(CCCCC2)O3)C1 ZINC000467298615 881047115 /nfs/dbraw/zinc/04/71/15/881047115.db2.gz FSENUTANRQIQCQ-ZWKOTPCHSA-N 0 3 402.535 4.194 20 0 HIADHN O=S(=O)(C[C@@H](O)CN[C@@H](c1ccc(Cl)cc1)C1CCCC1)c1cccs1 ZINC000467332732 881081564 /nfs/dbraw/zinc/08/15/64/881081564.db2.gz QOYULVWSAJGBNE-PKOBYXMFSA-N 0 3 413.992 4.057 20 0 HIADHN CCN1CCN([C@@H]2CCN(Cc3csc(-c4ccc(C(F)(F)F)cc4)n3)C2)CC1 ZINC000503565605 912643522 /nfs/dbraw/zinc/64/35/22/912643522.db2.gz RCDNWQYVAIPDMZ-LJQANCHMSA-N 0 3 424.536 4.041 20 0 HIADHN CCN1CCN([C@H]2CCN(Cc3csc(-c4ccc(C(F)(F)F)cc4)n3)C2)CC1 ZINC000503565604 912645025 /nfs/dbraw/zinc/64/50/25/912645025.db2.gz RCDNWQYVAIPDMZ-IBGZPJMESA-N 0 3 424.536 4.041 20 0 HIADHN COC(=O)c1ccc(COc2ccc(CNCc3cccc4cc[nH]c43)cc2OC)o1 ZINC000467382818 881162403 /nfs/dbraw/zinc/16/24/03/881162403.db2.gz QIMKLYCNTMPLMA-UHFFFAOYSA-N 0 3 420.465 4.425 20 0 HIADHN COc1ccc2c(c1)[C@H](NC[C@@H](O)COc1ccccc1Br)CCS2 ZINC000467391321 881174614 /nfs/dbraw/zinc/17/46/14/881174614.db2.gz BXMCELOYPAGIEG-CXAGYDPISA-N 0 3 424.360 4.024 20 0 HIADHN COc1cc(C(C)=O)ccc1OC[C@@H](O)CN(C1CC1)[C@H]1CCCc2ccccc21 ZINC000503572798 912652184 /nfs/dbraw/zinc/65/21/84/912652184.db2.gz HRKWFVJQLXBAPW-GMAHTHKFSA-N 0 3 409.526 4.180 20 0 HIADHN CC[C@@H](NCc1cc(Cl)ccc1N1CCOCC1)c1ccc(OC)c(OC)c1 ZINC000467414661 881201016 /nfs/dbraw/zinc/20/10/16/881201016.db2.gz AXLITJVAFMFRDY-LJQANCHMSA-N 0 3 404.938 4.435 20 0 HIADHN COc1ccc2c(c1)[C@@H](NCCNC(=O)c1cccc(Br)c1)CCS2 ZINC000467417259 881205268 /nfs/dbraw/zinc/20/52/68/881205268.db2.gz FXMYQGFDZVGLHN-KRWDZBQOSA-N 0 3 421.360 4.014 20 0 HIADHN COc1ccc2c(c1)[C@H](NC[C@@H](O)COc1cccc(C(F)(F)F)c1)CCS2 ZINC000467418422 881207918 /nfs/dbraw/zinc/20/79/18/881207918.db2.gz JYHJMUKBMABHGA-RDTXWAMCSA-N 0 3 413.461 4.280 20 0 HIADHN COc1ccc(CN[C@H](c2cccc(Br)c2)C2CCOCC2)cc1O ZINC000467425780 881215597 /nfs/dbraw/zinc/21/55/97/881215597.db2.gz SBHJUUOSJRIDGI-FQEVSTJZSA-N 0 3 406.320 4.421 20 0 HIADHN C[C@@H]1[C@H](N[C@H]2CCCc3ncc(C(F)(F)F)cc32)CC(=O)N1Cc1ccccc1 ZINC000467436707 881234243 /nfs/dbraw/zinc/23/42/43/881234243.db2.gz ZGEDREHQPBUKKZ-VOBQZIQPSA-N 0 3 403.448 4.257 20 0 HIADHN C[C@@H]1CC[N@H+](CCOc2ccc([N-]S(=O)(=O)c3ccc4ccccc4c3)cc2)C1 ZINC000467440040 881239814 /nfs/dbraw/zinc/23/98/14/881239814.db2.gz PPRAMECQNDOVCA-GOSISDBHSA-N 0 3 410.539 4.361 20 0 HIADHN C[C@@H]1CC[N@@H+](CCOc2ccc([N-]S(=O)(=O)c3ccc4ccccc4c3)cc2)C1 ZINC000467440040 881239830 /nfs/dbraw/zinc/23/98/30/881239830.db2.gz PPRAMECQNDOVCA-GOSISDBHSA-N 0 3 410.539 4.361 20 0 HIADHN Cc1nn(C(C)C)cc1CN1CCC[C@H](c2nnc3ccc(C(F)(F)F)cn32)C1 ZINC000467442337 881245106 /nfs/dbraw/zinc/24/51/06/881245106.db2.gz LIGNJOZLMMMXGZ-HNNXBMFYSA-N 0 3 406.456 4.214 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)c(Cl)c1 ZINC000467463605 881273306 /nfs/dbraw/zinc/27/33/06/881273306.db2.gz HBEXNYANKGTGAN-KDOFPFPSSA-N 0 3 400.910 4.083 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)Nc2ccc(OCC3CCOCC3)cc2)CN1Cc1ccccc1 ZINC000467476123 881294937 /nfs/dbraw/zinc/29/49/37/881294937.db2.gz NKPQOBCPBQARLC-AUSIDOKSSA-N 0 3 423.557 4.277 20 0 HIADHN COCCc1nc(C)c([C@@H](C)NCc2ccc(C)nc2-n2cc(Cl)cn2)s1 ZINC000469068325 883146251 /nfs/dbraw/zinc/14/62/51/883146251.db2.gz WREUNQKUUVNIFT-CYBMUJFWSA-N 0 3 405.955 4.034 20 0 HIADHN Cc1c(Br)ccc(C(=O)N(Cc2ccco2)C2CCN(C)CC2)c1F ZINC000469073216 883155562 /nfs/dbraw/zinc/15/55/62/883155562.db2.gz SNBMLRFXHDCXEM-UHFFFAOYSA-N 0 3 409.299 4.226 20 0 HIADHN C[C@H](C(=O)NC[C@@H](C[C@H](C)O)c1ccccc1)N1CCC(Cc2ccccc2)CC1 ZINC000469075723 883158834 /nfs/dbraw/zinc/15/88/34/883158834.db2.gz VUOAKVLNOZNONP-BPYKYCOYSA-N 0 3 408.586 4.001 20 0 HIADHN COC(=O)[C@@](C)(CN[C@@H](C)C(=O)Nc1c(C)cc(C)cc1Cl)c1ccccc1 ZINC000469188065 883287102 /nfs/dbraw/zinc/28/71/02/883287102.db2.gz CTACYSITGHZBAT-AOMKIAJQSA-N 0 3 402.922 4.004 20 0 HIADHN CC[C@@H]1C[C@H](CN[C@H](c2cccc(S(C)(=O)=O)c2)c2ccc(F)c(F)c2)CCO1 ZINC000503602016 912694157 /nfs/dbraw/zinc/69/41/57/912694157.db2.gz JRJIOERMAPRUEB-YBOAYWMSSA-N 0 3 423.525 4.253 20 0 HIADHN C[C@@H]1CN(Cc2cccc(NC(=O)c3ccc(Nc4ccncc4)cc3)c2)C[C@H](C)O1 ZINC000469253649 883350392 /nfs/dbraw/zinc/35/03/92/883350392.db2.gz RCIGQSYERFCGFM-KDURUIRLSA-N 0 3 416.525 4.109 20 0 HIADHN COc1ccc2cc([C@@H](C)NCc3cccc(C(=O)N4CCOCC4)c3)ccc2c1 ZINC000469279967 883378138 /nfs/dbraw/zinc/37/81/38/883378138.db2.gz VOFALMDNWZBMLU-GOSISDBHSA-N 0 3 404.510 4.172 20 0 HIADHN CC1CCN([C@@H](CNC(=O)c2ccc(O[C@@H]3CCOC3)cc2)c2ccccc2)CC1 ZINC000469335547 883446628 /nfs/dbraw/zinc/44/66/28/883446628.db2.gz KNKDCPBMTSGRRQ-RPWUZVMVSA-N 0 3 408.542 4.057 20 0 HIADHN C[C@H](C(=O)N1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1)N1CCCCCC1 ZINC000469394530 883551561 /nfs/dbraw/zinc/55/15/61/883551561.db2.gz AQSFLMWWMODNLC-AEFFLSMTSA-N 0 3 416.953 4.361 20 0 HIADHN COCc1ccc([C@H]2CCCN2C(=O)N[C@H](CN(C)Cc2ccccc2)C(C)C)o1 ZINC000469432570 883618575 /nfs/dbraw/zinc/61/85/75/883618575.db2.gz SVNDWNGXZMWXFA-FGZHOGPDSA-N 0 3 413.562 4.429 20 0 HIADHN COCc1ccc([C@@H]2CCCN2C(=O)N[C@@H](CN(C)Cc2ccccc2)C(C)C)o1 ZINC000469432571 883619482 /nfs/dbraw/zinc/61/94/82/883619482.db2.gz SVNDWNGXZMWXFA-VXKWHMMOSA-N 0 3 413.562 4.429 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)NCc1ccccc1-c1cnn(C)c1 ZINC000469434738 883622347 /nfs/dbraw/zinc/62/23/47/883622347.db2.gz SPTWHMVEMNDYQT-XMMPIXPASA-N 0 3 419.573 4.043 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)N[C@@H]1CCO[C@@H](c2ccccc2)C1 ZINC000469439552 883631031 /nfs/dbraw/zinc/63/10/31/883631031.db2.gz XXFULBWNZBBYCC-TZRRMPRUSA-N 0 3 409.574 4.363 20 0 HIADHN Cc1cc(N2CCOCC2)ccc1NC(=O)N[C@@H](CN(C)Cc1ccccc1)C(C)C ZINC000469451488 883652509 /nfs/dbraw/zinc/65/25/09/883652509.db2.gz BVJOQCPQQIZWFO-DEOSSOPVSA-N 0 3 424.589 4.110 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)Nc1ccc(NC(=O)C2CC2)cc1 ZINC000469472265 883698312 /nfs/dbraw/zinc/69/83/12/883698312.db2.gz JOJPLVFBJIXZRT-QFIPXVFZSA-N 0 3 408.546 4.313 20 0 HIADHN CC1CCN(Cc2ccccc2CNC(=O)CCC(=O)c2ccc(Cl)cn2)CC1 ZINC000469478608 883709540 /nfs/dbraw/zinc/70/95/40/883709540.db2.gz UYUPRHWNZFPRNQ-UHFFFAOYSA-N 0 3 413.949 4.246 20 0 HIADHN Cc1cccc2nc(CCC(=O)NC[C@@H](c3cccc(C(F)(F)F)c3)N(C)C)[nH]c21 ZINC000469488061 883724466 /nfs/dbraw/zinc/72/44/66/883724466.db2.gz OHZDDMJAZZLEDX-SFHVURJKSA-N 0 3 418.463 4.242 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)C3CCC(C(F)(F)F)CC3)CC2)C[C@H](C)O1 ZINC000469530929 883801876 /nfs/dbraw/zinc/80/18/76/883801876.db2.gz KJBJCAGYXYSBJH-CCZBSFLLSA-N 0 3 404.517 4.093 20 0 HIADHN C[C@@H](CC(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1)c1c[nH]c2ccccc21 ZINC000469531359 883801974 /nfs/dbraw/zinc/80/19/74/883801974.db2.gz PUJONBFEHLLGML-XUVXKRRUSA-N 0 3 411.590 4.399 20 0 HIADHN Cc1cc(NC[C@@H](c2cccc(C(F)(F)F)c2)N(C)C)nc(-c2ccncc2)n1 ZINC000469549117 883809801 /nfs/dbraw/zinc/80/98/01/883809801.db2.gz HDAJHGYVXQDVFD-SFHVURJKSA-N 0 3 401.436 4.003 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N3CCS[C@H](C)[C@H]3c3ccccc3)cc2)CC1 ZINC000469552299 883811532 /nfs/dbraw/zinc/81/15/32/883811532.db2.gz QKOAEWOFNZJKHF-XXBNENTESA-N 0 3 409.599 4.147 20 0 HIADHN CCO[C@@H](C)c1nc(CN(C)C(=O)c2oc3ccccc3c2CN(C)C)cs1 ZINC000469569620 883818462 /nfs/dbraw/zinc/81/84/62/883818462.db2.gz XXCBRTQCNDROMA-AWEZNQCLSA-N 0 3 401.532 4.321 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N3C[C@@H](c4cc(C)ccc4C)OC[C@@H]3C)cc2)CC1 ZINC000469636513 883843690 /nfs/dbraw/zinc/84/36/90/883843690.db2.gz ZTIFMDBPLFSAAK-OFVILXPXSA-N 0 3 421.585 4.048 20 0 HIADHN COC(=O)c1ccccc1-c1ccccc1C(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000469687814 883871638 /nfs/dbraw/zinc/87/16/38/883871638.db2.gz OMBGGKNLNAZEPM-BJKOFHAPSA-N 0 3 414.505 4.315 20 0 HIADHN Fc1ccc(-c2noc([C@H]3CCCN(CCOCC(F)(F)C(F)(F)F)C3)n2)cc1 ZINC000469718211 883884856 /nfs/dbraw/zinc/88/48/56/883884856.db2.gz QIKYWVABTZIIBD-ZDUSSCGKSA-N 0 3 423.357 4.269 20 0 HIADHN COc1ccc(C(=O)N2CCC(N[C@H](C)c3csc(C(C)C)n3)CC2)c(OC)c1 ZINC000469776685 883951933 /nfs/dbraw/zinc/95/19/33/883951933.db2.gz RZMSUXWDQOTBBW-OAHLLOKOSA-N 0 3 417.575 4.239 20 0 HIADHN COc1ccc([C@H](C)NCc2cccc(C(=O)N3CCOCC3)c2)c2ccccc12 ZINC000469810798 883986387 /nfs/dbraw/zinc/98/63/87/883986387.db2.gz YJMOLMFYVQLNJC-SFHVURJKSA-N 0 3 404.510 4.172 20 0 HIADHN C[C@@H](NCc1cccc(C(=O)N2CCOCC2)c1)c1ccc(-c2ccncc2)cc1 ZINC000469812329 883988153 /nfs/dbraw/zinc/98/81/53/883988153.db2.gz YQJXJCKNKQAMBW-LJQANCHMSA-N 0 3 401.510 4.072 20 0 HIADHN COc1ccc(NC(C)=O)cc1NC(=O)[C@@H](C)N1CCCC2(CCCCC2)CC1 ZINC000469861809 884047666 /nfs/dbraw/zinc/04/76/66/884047666.db2.gz BGOKHJHZNGTYJS-QGZVFWFLSA-N 0 3 401.551 4.417 20 0 HIADHN Cc1ccn(-c2ccccc2NC(=O)N(CCN(C)C)Cc2cccc(Cl)c2)n1 ZINC000469861933 884049557 /nfs/dbraw/zinc/04/95/57/884049557.db2.gz LUDYLMIFIFUDLW-UHFFFAOYSA-N 0 3 411.937 4.430 20 0 HIADHN O=C(CCCCCc1cccs1)NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000469865943 884056547 /nfs/dbraw/zinc/05/65/47/884056547.db2.gz ODDDJDBJUJQHNR-NRFANRHFSA-N 0 3 400.588 4.258 20 0 HIADHN Cc1nc(-c2ccccc2)sc1C(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000469871682 884061194 /nfs/dbraw/zinc/06/11/94/884061194.db2.gz NPLKZTAZFRNKKX-NRFANRHFSA-N 0 3 421.566 4.139 20 0 HIADHN O=C(C[C@@H](c1ccccc1)C(F)(F)F)NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000469873746 884063497 /nfs/dbraw/zinc/06/34/97/884063497.db2.gz SLPQGPQWWDASOY-SFTDATJTSA-N 0 3 420.475 4.130 20 0 HIADHN Cc1cc(N(C)C)cc(C)c1NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000469932166 884127255 /nfs/dbraw/zinc/12/72/55/884127255.db2.gz DUEXUBFFFPSZSM-UHFFFAOYSA-N 0 3 412.500 4.296 20 0 HIADHN CC(C)[C@@H](NC(=O)NC[C@H](c1ccccc1)N1CCCC1)c1nc2ccccc2[nH]1 ZINC000503687324 912792145 /nfs/dbraw/zinc/79/21/45/912792145.db2.gz ZTHBXECOYFAIBI-FGZHOGPDSA-N 0 3 405.546 4.396 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N[C@@H](C)c2ccccc2-n2cccn2)C1 ZINC000470034346 884268872 /nfs/dbraw/zinc/26/88/72/884268872.db2.gz PBGYOZFDAHCZLI-QKNQBKEWSA-N 0 3 403.530 4.068 20 0 HIADHN CC(C)[C@@H](NC(=O)N[C@H](CN(C)Cc1ccccc1)C(C)C)c1nc(C2CC2)no1 ZINC000470062170 884313386 /nfs/dbraw/zinc/31/33/86/884313386.db2.gz MVRGVUHJYUZQGT-WOJBJXKFSA-N 0 3 413.566 4.100 20 0 HIADHN Cc1cccc2[nH]cc(CCNC(=O)N(CCN(C)C)Cc3ccc(F)c(F)c3)c21 ZINC000503789215 912825579 /nfs/dbraw/zinc/82/55/79/912825579.db2.gz ASKUSUUOYVUQAR-UHFFFAOYSA-N 0 3 414.500 4.070 20 0 HIADHN CCCCCn1cc(CNC(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)c(C)n1 ZINC000503806279 912828301 /nfs/dbraw/zinc/82/83/01/912828301.db2.gz WWZCCECSVKILEI-HXUWFJFHSA-N 0 3 411.594 4.188 20 0 HIADHN C[C@@H](NC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1)c1ccccc1-n1cccn1 ZINC000470189824 884485704 /nfs/dbraw/zinc/48/57/04/884485704.db2.gz ZEAALIREOWFYPO-NHCUHLMSSA-N 0 3 417.557 4.239 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@@H]2NC(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)cc1 ZINC000470262594 884609593 /nfs/dbraw/zinc/60/95/93/884609593.db2.gz BNJSFKCXGAGBMH-DQEYMECFSA-N 0 3 421.585 4.176 20 0 HIADHN CC(C)[C@@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)Nc1cccc(CN(C)C)c1 ZINC000503860060 912844500 /nfs/dbraw/zinc/84/45/00/912844500.db2.gz SEPKNLHZHVYEGJ-JOCHJYFZSA-N 0 3 409.574 4.439 20 0 HIADHN COc1cccc([C@@H](CNC(=O)Nc2cccc(OCCF)c2)N2CCCC2)c1 ZINC000470294002 884670834 /nfs/dbraw/zinc/67/08/34/884670834.db2.gz XGLMVTIPQYERJV-OAQYLSRUSA-N 0 3 401.482 4.002 20 0 HIADHN C[C@@H](NCCc1cccc2[nH]ccc21)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000503885551 912851043 /nfs/dbraw/zinc/85/10/43/912851043.db2.gz LLCQNCVYJSIWKQ-LLVKDONJSA-N 0 3 412.342 4.015 20 0 HIADHN CCN(C[C@H]1CCN(Cc2ccccc2)C1)C(=O)C[C@@H](C)C(=O)c1cccc(F)c1 ZINC000470530556 884929122 /nfs/dbraw/zinc/92/91/22/884929122.db2.gz RDQMDKTYPKIVNZ-CTNGQTDRSA-N 0 3 410.533 4.405 20 0 HIADHN CN(C(=O)c1cccc(NC(=O)c2ccco2)c1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470658938 885082793 /nfs/dbraw/zinc/08/27/93/885082793.db2.gz SWRTYHVRTBGFCF-QFIPXVFZSA-N 0 3 417.509 4.269 20 0 HIADHN Cc1ccc(Nc2cccc(C(=O)N(C)[C@H]3CCCN(Cc4ccccc4)C3)c2)nn1 ZINC000470659657 885084772 /nfs/dbraw/zinc/08/47/72/885084772.db2.gz XCSMODNDFKVXOJ-QHCPKHFHSA-N 0 3 415.541 4.265 20 0 HIADHN CN(C(=O)c1ccnc(SCC(F)(F)F)c1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470664360 885090090 /nfs/dbraw/zinc/09/00/90/885090090.db2.gz XOJULBAMRRVBNB-GOSISDBHSA-N 0 3 423.504 4.473 20 0 HIADHN CN(C(=O)c1ccc(-c2ccccc2)[nH]c1=O)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470673553 885103420 /nfs/dbraw/zinc/10/34/20/885103420.db2.gz GKZQSCHIDVXLNZ-NRFANRHFSA-N 0 3 401.510 4.191 20 0 HIADHN CCc1cccc2c1OCC[C@H]2NC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470719904 885164237 /nfs/dbraw/zinc/16/42/37/885164237.db2.gz MWFGTPFTIJPMBT-JTHBVZDNSA-N 0 3 407.558 4.379 20 0 HIADHN C[C@@H](CCc1ccc2c(c1)OCO2)NC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470723211 885171015 /nfs/dbraw/zinc/17/10/15/885171015.db2.gz NWJJXIIHCUTYRA-SIKLNZKXSA-N 0 3 423.557 4.042 20 0 HIADHN COc1ccc(Cl)cc1CNC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470723080 885171548 /nfs/dbraw/zinc/17/15/48/885171548.db2.gz MXHXWTMYGYRBGZ-HXUWFJFHSA-N 0 3 401.938 4.155 20 0 HIADHN Cc1csc(CCCCNC(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)n1 ZINC000470724918 885173570 /nfs/dbraw/zinc/17/35/70/885173570.db2.gz XDKSUJXFPIWZRF-FQEVSTJZSA-N 0 3 400.592 4.080 20 0 HIADHN CC(C)COC[C@H](NC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1)c1ccco1 ZINC000470728857 885179762 /nfs/dbraw/zinc/17/97/62/885179762.db2.gz CAPRCCHLKZUTKU-VXKWHMMOSA-N 0 3 413.562 4.299 20 0 HIADHN CN(C(=O)NCc1cccc(Br)c1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470731947 885185771 /nfs/dbraw/zinc/18/57/71/885185771.db2.gz GARBZIAMDYWMGO-FQEVSTJZSA-N 0 3 416.363 4.255 20 0 HIADHN CN(C(=O)NC[C@H](c1ccco1)N1CCCCC1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470737112 885193597 /nfs/dbraw/zinc/19/35/97/885193597.db2.gz MVDOOOHUFUEYOI-DHIUTWEWSA-N 0 3 424.589 4.113 20 0 HIADHN Cc1nc2ccccc2n1CCCNC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470741107 885202399 /nfs/dbraw/zinc/20/23/99/885202399.db2.gz SYQQKAQXCLULMD-QFIPXVFZSA-N 0 3 419.573 4.041 20 0 HIADHN CCCC(=O)Nc1ccc(CNC(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000470748362 885213377 /nfs/dbraw/zinc/21/33/77/885213377.db2.gz VXAWXSMXLVDURD-HSZRJFAPSA-N 0 3 422.573 4.231 20 0 HIADHN CN(C(=O)N[C@H](c1ccccc1)c1ccccn1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470750180 885215409 /nfs/dbraw/zinc/21/54/09/885215409.db2.gz CFYGLSYNLJCMJP-UKILVPOCSA-N 0 3 414.553 4.477 20 0 HIADHN CN(Cc1ccc(Br)c(F)c1)C[C@@H]1C[C@H](F)CN1Cc1nccs1 ZINC000470822657 885310922 /nfs/dbraw/zinc/31/09/22/885310922.db2.gz UUYAORNWFPAFRT-KBPBESRZSA-N 0 3 416.335 4.089 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)c2cc3c(C(F)F)nn(C)c3s2)c1 ZINC000470877265 885367221 /nfs/dbraw/zinc/36/72/21/885367221.db2.gz HDBSUGFXDYLEMH-UHFFFAOYSA-N 0 3 406.502 4.085 20 0 HIADHN C[C@H](NC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1)c1cccc(-n2cccn2)c1 ZINC000470885140 885379520 /nfs/dbraw/zinc/37/95/20/885379520.db2.gz XOVUXBDTZHXLPP-GBXCKJPGSA-N 0 3 417.557 4.239 20 0 HIADHN CC(C)CN(C(=O)NCCN1CCN(C)C(C)(C)C1)[C@H](C)c1ccccc1Cl ZINC000504026758 912929332 /nfs/dbraw/zinc/92/93/32/912929332.db2.gz PWYGWWJJKSICBR-GOSISDBHSA-N 0 3 409.018 4.095 20 0 HIADHN CCN(C(=O)CCN1CCN(CC)CC1)[C@H](C)c1ccc(-c2cccc(OC)c2)cc1 ZINC000470893694 885391758 /nfs/dbraw/zinc/39/17/58/885391758.db2.gz WEBAASPZVRAXJF-OAQYLSRUSA-N 0 3 423.601 4.299 20 0 HIADHN COc1ccc([C@@H](NC(=O)NCC(C)(C)N2CCc3ccccc3C2)C2CC2)cc1 ZINC000504037413 912945593 /nfs/dbraw/zinc/94/55/93/912945593.db2.gz PPXGGMBJBNSXES-QHCPKHFHSA-N 0 3 407.558 4.282 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1ccc2nc(C)oc2c1 ZINC000471047452 885558465 /nfs/dbraw/zinc/55/84/65/885558465.db2.gz MRQBVLBWUABUPF-HXUWFJFHSA-N 0 3 415.497 4.340 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)NCc1nnc(-c2ccccc2)s1 ZINC000471070342 885589224 /nfs/dbraw/zinc/58/92/24/885589224.db2.gz UCXMZDRTLYZMSX-SFHVURJKSA-N 0 3 421.570 4.011 20 0 HIADHN C[C@@H](NC(=O)C1(c2cccc(Cl)c2)CCOCC1)[C@H](c1ccccc1)N(C)C ZINC000471129811 885668863 /nfs/dbraw/zinc/66/88/63/885668863.db2.gz QUIWWNDENPBMSG-DYESRHJHSA-N 0 3 400.950 4.196 20 0 HIADHN Cc1cccc(I)c1C(=O)N[C@H](C)[C@H](c1ccccc1)N(C)C ZINC000471139725 885683454 /nfs/dbraw/zinc/68/34/54/885683454.db2.gz KBROLAINIOASLR-RDTXWAMCSA-N 0 3 422.310 4.021 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3cc(F)ccc3F)c(OCC)c2)CC1 ZINC000471170634 885727459 /nfs/dbraw/zinc/72/74/59/885727459.db2.gz WNLBZZCXNRUEKI-UHFFFAOYSA-N 0 3 403.473 4.148 20 0 HIADHN O=C(Nc1cccc(OC(F)F)c1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000471185617 885754194 /nfs/dbraw/zinc/75/41/94/885754194.db2.gz JVBZXBWYXOEQJM-UHFFFAOYSA-N 0 3 407.383 4.215 20 0 HIADHN Cc1cc(C)c(CC(C(=O)Nc2ccc(C(=O)N(C)C)cn2)C(F)(F)F)c(C)c1 ZINC000471209921 885783269 /nfs/dbraw/zinc/78/32/69/885783269.db2.gz HONRZCZHAOXJFW-QGZVFWFLSA-N 0 3 407.436 4.068 20 0 HIADHN CN(CCCCOc1cccc(C(F)(F)F)c1)[C@H]1CCCC[C@H]1S(C)(=O)=O ZINC000471241287 885818573 /nfs/dbraw/zinc/81/85/73/885818573.db2.gz FHWLBRNVKHUURX-ZWKOTPCHSA-N 0 3 407.498 4.152 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)c1cc(C(F)(F)F)ccc1F ZINC000471263325 885842599 /nfs/dbraw/zinc/84/25/99/885842599.db2.gz RCZBQGUWCVUXEW-KRWDZBQOSA-N 0 3 409.427 4.366 20 0 HIADHN O=C(Nc1ccc(-c2cc[nH]n2)cc1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000471270484 885848468 /nfs/dbraw/zinc/84/84/68/885848468.db2.gz PGIXEZBRWBQTER-UHFFFAOYSA-N 0 3 407.440 4.004 20 0 HIADHN CC(=O)Nc1cc(C(=O)NC[C@H]2CCCN2Cc2ccccc2)cc(C(F)(F)F)c1 ZINC000471307699 885895964 /nfs/dbraw/zinc/89/59/64/885895964.db2.gz YCRZVKYBDAYHKL-HXUWFJFHSA-N 0 3 419.447 4.058 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3ccc(N4CCCCC4)cc3)c(C)c2)CC1 ZINC000471358528 885982946 /nfs/dbraw/zinc/98/29/46/885982946.db2.gz QQZRTQPFIMEIEJ-UHFFFAOYSA-N 0 3 406.574 4.380 20 0 HIADHN C[C@@H](NC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1)c1ccccc1-n1cccn1 ZINC000471487161 886185685 /nfs/dbraw/zinc/18/56/85/886185685.db2.gz GCWYRVSUPOSOHC-IRLDBZIGSA-N 0 3 417.557 4.239 20 0 HIADHN O=C(N[C@H](c1ccco1)c1ccccc1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000471527858 886231606 /nfs/dbraw/zinc/23/16/06/886231606.db2.gz KEFYPVWDEYYUIT-QLOJAFMTSA-N 0 3 421.463 4.474 20 0 HIADHN C[C@H](NC(=O)COc1ccc(Oc2ccccn2)cc1)[C@H](c1ccccc1)N(C)C ZINC000471538068 886243620 /nfs/dbraw/zinc/24/36/20/886243620.db2.gz OEIBGTWFLLXKDV-MHECFPHRSA-N 0 3 405.498 4.060 20 0 HIADHN C[C@H](NC(=O)CCc1ncc(-c2ccc(F)cc2F)o1)[C@H](c1ccccc1)N(C)C ZINC000471542060 886247484 /nfs/dbraw/zinc/24/74/84/886247484.db2.gz MJWZKEBKDXOJED-NPMXOYFQSA-N 0 3 413.468 4.360 20 0 HIADHN C[C@@H](NC(=O)CCc1ncc(-c2ccc(F)cc2F)o1)[C@@H](c1ccccc1)N(C)C ZINC000471541789 886248096 /nfs/dbraw/zinc/24/80/96/886248096.db2.gz MJWZKEBKDXOJED-CMJOXMDJSA-N 0 3 413.468 4.360 20 0 HIADHN C[C@H](NC(=O)c1ccc(CNC(=O)c2cccs2)cc1)[C@@H](c1ccccc1)N(C)C ZINC000471547548 886254248 /nfs/dbraw/zinc/25/42/48/886254248.db2.gz NXHPNUZZHMMUOL-JTSKRJEESA-N 0 3 421.566 4.099 20 0 HIADHN Cc1ccc(SCCNC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cc1 ZINC000471548528 886256320 /nfs/dbraw/zinc/25/63/20/886256320.db2.gz RJDQAMGRFVYVHA-UHFFFAOYSA-N 0 3 415.525 4.192 20 0 HIADHN C[C@H](NC(=O)CSCc1coc(-c2ccccc2)n1)[C@H](c1ccccc1)N(C)C ZINC000471557106 886266356 /nfs/dbraw/zinc/26/63/56/886266356.db2.gz WIRYSNJNARCRSG-HTAPYJJXSA-N 0 3 409.555 4.382 20 0 HIADHN CN(C)Cc1cccc(NC(=O)NCc2ccc(C(=O)Nc3ccc(F)cc3)cc2)c1 ZINC000471567761 886277484 /nfs/dbraw/zinc/27/74/84/886277484.db2.gz SJUYZPIVHOISIK-UHFFFAOYSA-N 0 3 420.488 4.461 20 0 HIADHN C[C@H](CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)N[C@H](CO)c1ccsc1 ZINC000471586546 886299006 /nfs/dbraw/zinc/29/90/06/886299006.db2.gz DHZSLVFRQRUTQE-MEBBXXQBSA-N 0 3 406.857 4.461 20 0 HIADHN CCc1ccc([C@@H](NC2CC(OC(C)C)C2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000471590685 886301704 /nfs/dbraw/zinc/30/17/04/886301704.db2.gz NSYSRVFLUIIXRA-YDPRHXJPSA-N 0 3 401.572 4.288 20 0 HIADHN COc1ccc([C@H](C)NC[C@@H](OC(C)C)c2ccccc2OC)cc1NC(C)=O ZINC000471608880 886323774 /nfs/dbraw/zinc/32/37/74/886323774.db2.gz GOKWTNMFFPRHOF-QMHKHESXSA-N 0 3 400.519 4.479 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)[C@H](C)c3ccc(Br)s3)c2)CC1 ZINC000471637133 886355320 /nfs/dbraw/zinc/35/53/20/886355320.db2.gz VKWLHQHZXQVNAO-CQSZACIVSA-N 0 3 422.392 4.395 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)CCOc3ccc(F)cc3Cl)c2)CC1 ZINC000471650840 886366715 /nfs/dbraw/zinc/36/67/15/886366715.db2.gz XIJNBFSRPBKAEL-UHFFFAOYSA-N 0 3 405.901 4.029 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)NCC2CCN(c3ccccc3)CC2)C1 ZINC000471730998 886448913 /nfs/dbraw/zinc/44/89/13/886448913.db2.gz GZOUDQBDQPCEGP-NZQKXSOJSA-N 0 3 406.574 4.038 20 0 HIADHN CCC(O)(CC)CCN[C@@H](c1cccc(S(C)(=O)=O)c1)c1ccc(C)cc1C ZINC000471778241 886511026 /nfs/dbraw/zinc/51/10/26/886511026.db2.gz DLTDZWLJMYECCN-QFIPXVFZSA-N 0 3 403.588 4.327 20 0 HIADHN COc1cc(Br)c(CNCCc2ccccc2OC(F)F)cc1O ZINC000471821082 886564398 /nfs/dbraw/zinc/56/43/98/886564398.db2.gz JSRUTSBMNAKXEB-UHFFFAOYSA-N 0 3 402.235 4.097 20 0 HIADHN Cc1cn([C@H](C)c2ccccc2)nc1NC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000471855266 886625856 /nfs/dbraw/zinc/62/58/56/886625856.db2.gz FUSFASSYKQAILF-QIJUGHKUSA-N 0 3 403.530 4.368 20 0 HIADHN Cc1cn([C@@H](C)c2ccccc2)nc1NC(=O)NC[C@@H](Cc1ccccc1)N(C)C ZINC000471915583 886703211 /nfs/dbraw/zinc/70/32/11/886703211.db2.gz RMWQVHFRFBCJDL-SIKLNZKXSA-N 0 3 405.546 4.095 20 0 HIADHN CCCc1c(NC(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)cnn1-c1cc(C)ccn1 ZINC000471955901 886770699 /nfs/dbraw/zinc/77/06/99/886770699.db2.gz SHTCWLXOGJSHQY-CVDCTZTESA-N 0 3 418.545 4.095 20 0 HIADHN COc1cccc([C@H](CNC(=O)NCc2cccc3ccccc32)N2CCCC2)c1 ZINC000504193820 913079156 /nfs/dbraw/zinc/07/91/56/913079156.db2.gz CZZJSUOBRNKQBY-DEOSSOPVSA-N 0 3 403.526 4.485 20 0 HIADHN C[C@@H](C(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1)c1ccc(Cl)c(Cl)c1 ZINC000471976290 886807153 /nfs/dbraw/zinc/80/71/53/886807153.db2.gz FBDJBWPBCWIZLI-OWCLPIDISA-N 0 3 413.389 4.445 20 0 HIADHN Cc1ccc(CC[C@@H](C)NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)o1 ZINC000472002190 886827499 /nfs/dbraw/zinc/82/74/99/886827499.db2.gz LSKDZBGKWGEAOE-NVPAJSRCSA-N 0 3 401.473 4.014 20 0 HIADHN CCc1noc(-c2ccc(C)c(NC(=O)N[C@H]3CCN(C)[C@H]3c3ccccc3)c2)n1 ZINC000472019197 886841774 /nfs/dbraw/zinc/84/17/74/886841774.db2.gz YPJKNEWGALHMHG-RXVVDRJESA-N 0 3 405.502 4.174 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)CSc3nccc4ccccc43)c2)CC1 ZINC000504208600 913085989 /nfs/dbraw/zinc/08/59/89/913085989.db2.gz XACJOPIFKAJBKY-UHFFFAOYSA-N 0 3 420.582 4.496 20 0 HIADHN CCn1nc(CN[C@H]2CCN(CC)[C@@H]2c2cc(F)c(F)c(F)c2)c2ccccc21 ZINC000472041993 886859250 /nfs/dbraw/zinc/85/92/50/886859250.db2.gz BFNIVUKZLKOVOQ-PGRDOPGGSA-N 0 3 402.464 4.399 20 0 HIADHN COc1cccc([C@@H](NC(=O)c2cccc(CN(C)C)c2)c2cc(F)ccc2OC)c1 ZINC000472055469 886867340 /nfs/dbraw/zinc/86/73/40/886867340.db2.gz OCKKLOUMLYXIQH-XMMPIXPASA-N 0 3 422.500 4.424 20 0 HIADHN CCOc1ccc(-c2nc(CC)c(C(=O)N3CCC[C@H](N4CCCC4)C3)s2)cc1 ZINC000472098791 886892024 /nfs/dbraw/zinc/89/20/24/886892024.db2.gz XBCGKLXHWVQNML-SFHVURJKSA-N 0 3 413.587 4.472 20 0 HIADHN CCCNc1ccc(CNC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cc1 ZINC000472219833 887022649 /nfs/dbraw/zinc/02/26/49/887022649.db2.gz JAUKPDFLOAVBQR-UHFFFAOYSA-N 0 3 412.500 4.113 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3cc(F)ccc3-c3ccoc3)CC2)C[C@H](C)O1 ZINC000472250432 887060037 /nfs/dbraw/zinc/06/00/37/887060037.db2.gz IPEKRTXUKLMULN-HDICACEKSA-N 0 3 414.521 4.437 20 0 HIADHN COCCOc1ccc(C(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)c(Cl)c1 ZINC000472311571 887139248 /nfs/dbraw/zinc/13/92/48/887139248.db2.gz NBRQKBOYVUWLBB-LJQANCHMSA-N 0 3 416.949 4.102 20 0 HIADHN COCc1c(Br)cccc1NC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000472314087 887143978 /nfs/dbraw/zinc/14/39/78/887143978.db2.gz LYVDFMMKNHOGFP-OALUTQOASA-N 0 3 418.335 4.162 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2ccnc(Sc3ccccn3)c2)[C@@H]1c1ccccc1 ZINC000472327929 887160612 /nfs/dbraw/zinc/16/06/12/887160612.db2.gz OZXOHBQAYOXAGR-RXVVDRJESA-N 0 3 405.527 4.195 20 0 HIADHN Cc1cc(Oc2ncccn2)ccc1NC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000472329495 887164440 /nfs/dbraw/zinc/16/44/40/887164440.db2.gz QOTNFRHOYIXVCJ-SFTDATJTSA-N 0 3 403.486 4.144 20 0 HIADHN COc1ccc(Br)c(NC(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)c1 ZINC000472333157 887167174 /nfs/dbraw/zinc/16/71/74/887167174.db2.gz BEEXTLMQFXSPID-SJLPKXTDSA-N 0 3 404.308 4.025 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)NCC2CCN(c3ccccc3)CC2)CC1 ZINC000472387689 887231688 /nfs/dbraw/zinc/23/16/88/887231688.db2.gz NGOZGLCEWWWTEY-UHFFFAOYSA-N 0 3 420.601 4.209 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)CCc2cnc3ccccc3c2)cc1 ZINC000472441333 887290673 /nfs/dbraw/zinc/29/06/73/887290673.db2.gz ZRCVUDZVWDQAFX-XMMPIXPASA-N 0 3 403.526 4.129 20 0 HIADHN CSc1ccccc1CN(C)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472447802 887300541 /nfs/dbraw/zinc/30/05/41/887300541.db2.gz NIKJJKYPAJRNLA-UHFFFAOYSA-N 0 3 415.525 4.355 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N1CCc2cc(Cl)ccc2C1 ZINC000472456697 887310514 /nfs/dbraw/zinc/31/05/14/887310514.db2.gz SHOKSAOZDOOWBI-UHFFFAOYSA-N 0 3 415.887 4.213 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N1CCc2[nH]c3ccccc3c2C1 ZINC000472458094 887314471 /nfs/dbraw/zinc/31/44/71/887314471.db2.gz UTWHGNPFBYMLFC-UHFFFAOYSA-N 0 3 420.479 4.041 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N1CC=C(c2ccccc2F)C1 ZINC000472458419 887314723 /nfs/dbraw/zinc/31/47/23/887314723.db2.gz XWLKVGFMUSIDRV-UHFFFAOYSA-N 0 3 411.443 4.040 20 0 HIADHN CCS[C@H]1CCCCN(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)C1 ZINC000472460231 887317830 /nfs/dbraw/zinc/31/78/30/887317830.db2.gz SPHCUOCHRKCBND-JCYILVPMSA-N 0 3 407.546 4.109 20 0 HIADHN CC[C@@H]1Cc2ccccc2CN1C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472465674 887325624 /nfs/dbraw/zinc/32/56/24/887325624.db2.gz MLJVRMULNDVGGS-IOJLRTSASA-N 0 3 409.496 4.338 20 0 HIADHN Cc1ccccc1C[C@H](C)N(C)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472468360 887327566 /nfs/dbraw/zinc/32/75/66/887327566.db2.gz SRZNTIHDEBPWFH-DZIBYMRMSA-N 0 3 411.512 4.373 20 0 HIADHN COCCCOc1ccccc1NC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000472690514 887544814 /nfs/dbraw/zinc/54/48/14/887544814.db2.gz LFMWAFXNTVRFFV-NRFANRHFSA-N 0 3 411.546 4.230 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000472700564 887553035 /nfs/dbraw/zinc/55/30/35/887553035.db2.gz DJKYCZJCUWOUEO-CVDCTZTESA-N 0 3 422.573 4.343 20 0 HIADHN CC(C)C(=O)Nc1cccc(NC(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000472765658 887611714 /nfs/dbraw/zinc/61/17/14/887611714.db2.gz RYKZGIOFIVZVLY-QFIPXVFZSA-N 0 3 408.546 4.409 20 0 HIADHN O=C(NCC1(CCOCc2ccccc2)CC1)N1CCCN(Cc2ccccc2)CC1 ZINC000472780854 887626716 /nfs/dbraw/zinc/62/67/16/887626716.db2.gz BFFPSUSMHCLQNW-UHFFFAOYSA-N 0 3 421.585 4.291 20 0 HIADHN COc1cc(NC(=O)NC[C@H](c2cccs2)N2CCCC2)ccc1Br ZINC000472824987 887670538 /nfs/dbraw/zinc/67/05/38/887670538.db2.gz GOJYHPDKVGXYFR-OAHLLOKOSA-N 0 3 424.364 4.478 20 0 HIADHN C[C@@H](CCN1CCN(C)CC1)NC(=O)N[C@@H](c1cccc(Cl)c1)C1CCCCC1 ZINC000472905785 887752067 /nfs/dbraw/zinc/75/20/67/887752067.db2.gz WPKDMUSJJBCHCW-PGRDOPGGSA-N 0 3 421.029 4.287 20 0 HIADHN CCC[C@H](NC(=O)N[C@H](C)CCN1CCN(C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000472909973 887756173 /nfs/dbraw/zinc/75/61/73/887756173.db2.gz YBHBWWOQFMVGEP-BEFAXECRSA-N 0 3 415.409 4.160 20 0 HIADHN CN(C)[C@H](CNC(=O)Nc1ccc(OCc2ccccn2)c(F)c1)Cc1ccccc1 ZINC000472923982 887770405 /nfs/dbraw/zinc/77/04/05/887770405.db2.gz KEWTWYNNVVVFBB-NRFANRHFSA-N 0 3 422.504 4.094 20 0 HIADHN CC1CCN([C@@H](CNC(=O)N2CC[C@@]3(C2)OCc2ccccc23)c2ccccc2)CC1 ZINC000472924823 887771812 /nfs/dbraw/zinc/77/18/12/887771812.db2.gz HOQSDGRUNCWTIC-AHWVRZQESA-N 0 3 419.569 4.301 20 0 HIADHN CC1CCN([C@@H](CNC(=O)N2CC[C@]3(C2)OCc2ccccc23)c2ccccc2)CC1 ZINC000472924825 887772384 /nfs/dbraw/zinc/77/23/84/887772384.db2.gz HOQSDGRUNCWTIC-AZGAKELHSA-N 0 3 419.569 4.301 20 0 HIADHN Cc1cc(NC(=O)[C@@H]2CCCN2C2CCCC2)nn1CCCOc1ccc(F)cc1 ZINC000504353449 913188069 /nfs/dbraw/zinc/18/80/69/913188069.db2.gz KWEPANYCFRQICZ-NRFANRHFSA-N 0 3 414.525 4.145 20 0 HIADHN CN(Cc1nnc(-c2ccc(Cl)cc2)n1C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000473039193 887861690 /nfs/dbraw/zinc/86/16/90/887861690.db2.gz ZZRKMUAFUJSCJQ-OAQYLSRUSA-N 0 3 409.965 4.232 20 0 HIADHN COC(=O)C(C)(C)c1ccc(NC(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000473046949 887870013 /nfs/dbraw/zinc/87/00/13/887870013.db2.gz FAFMYHHVSQCEPA-QFIPXVFZSA-N 0 3 423.557 4.266 20 0 HIADHN COc1ccc(Cn2nc(C)c(CN3CC[C@@]4(C3)OCc3ccccc34)c2C)cc1 ZINC000473056663 887877378 /nfs/dbraw/zinc/87/73/78/887877378.db2.gz XJXIFPFXYOETSR-VWLOTQADSA-N 0 3 403.526 4.188 20 0 HIADHN CCCc1cc(C(=O)NCc2ccccc2CN2CCC(O)CC2)ccc1Cl ZINC000473080876 887897465 /nfs/dbraw/zinc/89/74/65/887897465.db2.gz NTNVDRULULMNFH-UHFFFAOYSA-N 0 3 400.950 4.179 20 0 HIADHN Cc1c(F)c(C(F)(F)F)ccc1C(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000473185863 887965328 /nfs/dbraw/zinc/96/53/28/887965328.db2.gz YDBSNQKWHLZKGS-OKILXGFUSA-N 0 3 416.459 4.114 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)C3(c4ccc(C(F)(F)F)cc4)CC3)CC2)C[C@H](C)O1 ZINC000473185393 887965368 /nfs/dbraw/zinc/96/53/68/887965368.db2.gz XCKZSXILFZLWKT-CALCHBBNSA-N 0 3 424.507 4.085 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@H](C)C1NC(=O)CCC(=O)c1ccc(F)cc1F ZINC000473280119 888034856 /nfs/dbraw/zinc/03/48/56/888034856.db2.gz YNRJTVBGMCBHSV-IRXDYDNUSA-N 0 3 414.496 4.201 20 0 HIADHN CCC[C@@H]([NH2+]C(C)C)C(=O)Nc1ccc(C)c(S(=O)(=O)[N-]c2ccccc2F)c1 ZINC000473358403 888083013 /nfs/dbraw/zinc/08/30/13/888083013.db2.gz FQUMIDAMPMPMPT-LJQANCHMSA-N 0 3 421.538 4.040 20 0 HIADHN CCOc1ccc(CNC(=O)N(Cc2ccco2)C2CCN(C)CC2)cc1Cl ZINC000504389384 913214024 /nfs/dbraw/zinc/21/40/24/913214024.db2.gz SUGVZLCWBUYRDN-UHFFFAOYSA-N 0 3 405.926 4.138 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1scnc1C1CCCC1 ZINC000473517478 888248279 /nfs/dbraw/zinc/24/82/79/888248279.db2.gz APDCWBWZNKKDCZ-UHFFFAOYSA-N 0 3 401.498 4.336 20 0 HIADHN COc1cc(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)ccc1OC(C)C ZINC000473517351 888248668 /nfs/dbraw/zinc/24/86/68/888248668.db2.gz IGCQRIDTEOAUTM-UHFFFAOYSA-N 0 3 414.468 4.018 20 0 HIADHN CC(C)(C)O[C@@H](C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1ccccc1 ZINC000473518609 888250195 /nfs/dbraw/zinc/25/01/95/888250195.db2.gz MLAQLLAALGBTOG-CTWPCTMYSA-N 0 3 412.496 4.464 20 0 HIADHN Cc1ccc(OCCCC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cc1C ZINC000473520663 888255432 /nfs/dbraw/zinc/25/54/32/888255432.db2.gz ISTGCWANMICOLA-UHFFFAOYSA-N 0 3 412.496 4.384 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1c2c(nc3ccccc31)CCC2 ZINC000473523454 888258064 /nfs/dbraw/zinc/25/80/64/888258064.db2.gz IALCAERBZNRRII-UHFFFAOYSA-N 0 3 417.475 4.259 20 0 HIADHN C[C@H](CCc1cccc(F)c1)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473526793 888263049 /nfs/dbraw/zinc/26/30/49/888263049.db2.gz SGQCJAMNFLDSIB-FTXHTYHOSA-N 0 3 400.460 4.316 20 0 HIADHN Cc1cc(O[C@@H](C)C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)ccc1Cl ZINC000473526389 888264000 /nfs/dbraw/zinc/26/40/00/888264000.db2.gz QNHJDFVFNDWVSP-JEYLPNPQSA-N 0 3 418.887 4.337 20 0 HIADHN O=C(CCc1nc2ccccc2s1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473535354 888272843 /nfs/dbraw/zinc/27/28/43/888272843.db2.gz XQSYZRWVTOIADP-UHFFFAOYSA-N 0 3 411.493 4.150 20 0 HIADHN COCCC[C@@H](Cc1ccccc1)NC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000473537064 888276063 /nfs/dbraw/zinc/27/60/63/888276063.db2.gz YZENITPSZQOFES-UPVQGACJSA-N 0 3 412.549 4.192 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCc3oc4ccccc4c3OC)c(C)c2)CC1 ZINC000473697080 888471224 /nfs/dbraw/zinc/47/12/24/888471224.db2.gz LJIKCPLQQMNZRP-UHFFFAOYSA-N 0 3 422.529 4.213 20 0 HIADHN CCCc1ccc(-c2ccc(NC(=O)N[C@@H](C)CCN3CCN(C)CC3)cc2)cc1 ZINC000473710967 888487515 /nfs/dbraw/zinc/48/75/15/888487515.db2.gz RDSDALYKPUUWCX-FQEVSTJZSA-N 0 3 408.590 4.454 20 0 HIADHN Cc1cc(Br)cc2c(C(=O)N(CCN(C)C)Cc3ccccn3)coc21 ZINC000473711988 888488462 /nfs/dbraw/zinc/48/84/62/888488462.db2.gz CGAMPFMWBQFRSJ-UHFFFAOYSA-N 0 3 416.319 4.103 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)NCCc2cccc(-c3ccccc3)c2)CC1 ZINC000473744425 888527234 /nfs/dbraw/zinc/52/72/34/888527234.db2.gz ZJSVGRUDZRGUAG-UHFFFAOYSA-N 0 3 409.574 4.085 20 0 HIADHN CCOCCC1(CNC(=O)Nc2ccc(CCN3CCSCC3)cc2)CCCC1 ZINC000473792246 888607789 /nfs/dbraw/zinc/60/77/89/888607789.db2.gz MFIMOPJUVGKFRR-UHFFFAOYSA-N 0 3 419.635 4.386 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N(Cc3ccccc3)C[C@H]3CCCO3)c2)CC1 ZINC000473806943 888630870 /nfs/dbraw/zinc/63/08/70/888630870.db2.gz LSLJPHBFLJMYEX-XMMPIXPASA-N 0 3 422.573 4.042 20 0 HIADHN CC[C@@H](NC(=O)Nc1cccc(N2CCN(CC)CC2)c1)c1cc(F)ccc1F ZINC000473824348 888656885 /nfs/dbraw/zinc/65/68/85/888656885.db2.gz YOPBQTVIBKLITL-OAQYLSRUSA-N 0 3 402.489 4.380 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@@H](c3ccc(F)cc3)C(F)(F)F)c2)CC1 ZINC000473829558 888663531 /nfs/dbraw/zinc/66/35/31/888663531.db2.gz MISQUMZULFJSQC-IBGZPJMESA-N 0 3 424.442 4.393 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)NCCSCc3ccccc3F)c2)CC1 ZINC000473833282 888668815 /nfs/dbraw/zinc/66/88/15/888668815.db2.gz BTSNJMLDARMXMV-UHFFFAOYSA-N 0 3 416.566 4.023 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CCSC[C@H]3c3ccccc3)c2)CC1 ZINC000473835485 888672465 /nfs/dbraw/zinc/67/24/65/888672465.db2.gz DLCWUDJMBJHLDO-QFIPXVFZSA-N 0 3 410.587 4.151 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)NCc3ccc(OC(F)(F)F)cc3)c2)CC1 ZINC000473835226 888672582 /nfs/dbraw/zinc/67/25/82/888672582.db2.gz IEVFXDNENHYPAJ-UHFFFAOYSA-N 0 3 422.451 4.049 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CCC(Cc4ccc(F)cc4)CC3)c2)CC1 ZINC000473837807 888676449 /nfs/dbraw/zinc/67/64/49/888676449.db2.gz TVCGOJRWVUSRGP-UHFFFAOYSA-N 0 3 424.564 4.454 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CCC[C@@H](Cc4ccccc4)C3)c2)CC1 ZINC000473838761 888678625 /nfs/dbraw/zinc/67/86/25/888678625.db2.gz XCWZWPWZBKPNET-QFIPXVFZSA-N 0 3 406.574 4.315 20 0 HIADHN Cc1nc(CC(C)C)c(NC(=O)N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)s1 ZINC000473845504 888691136 /nfs/dbraw/zinc/69/11/36/888691136.db2.gz UYVAMRIVMWMHIB-IYBDPMFKSA-N 0 3 408.612 4.003 20 0 HIADHN C[C@H](NC(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1)c1cc2cccc(F)c2o1 ZINC000473863297 888717694 /nfs/dbraw/zinc/71/76/94/888717694.db2.gz ISOVHLLZKTZLLU-ZACQAIPSSA-N 0 3 417.525 4.164 20 0 HIADHN C[C@@H](NC(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1)c1cc2ccccc2s1 ZINC000504480545 913274211 /nfs/dbraw/zinc/27/42/11/913274211.db2.gz OVYZLSMXIQZDBR-KZNAEPCWSA-N 0 3 415.603 4.493 20 0 HIADHN O=C(Nc1ccc(Br)cc1)C1CCN(CCOc2ccccc2F)CC1 ZINC000504484896 913277801 /nfs/dbraw/zinc/27/78/01/913277801.db2.gz YSFRVIPCLSQWOG-UHFFFAOYSA-N 0 3 421.310 4.318 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N2CCSC[C@@H]2c2nccs2)N2CCCC2)cc1 ZINC000473942060 888819645 /nfs/dbraw/zinc/81/96/45/888819645.db2.gz DKOSDSGXMJRNBI-RTBURBONSA-N 0 3 416.616 4.088 20 0 HIADHN C[C@@H](NC(=O)NC[C@@H](c1cccs1)N1CCCC1)c1ccc(Br)cn1 ZINC000473984855 888846817 /nfs/dbraw/zinc/84/68/17/888846817.db2.gz YPLICKRKVOYJOY-CJNGLKHVSA-N 0 3 423.380 4.103 20 0 HIADHN O=C(Nc1ccccc1-c1ccccc1)N[C@H]1CCN(Cc2ccccc2)C[C@H]1CO ZINC000473993277 888854050 /nfs/dbraw/zinc/85/40/50/888854050.db2.gz SDELKPYIRSNAMW-UPVQGACJSA-N 0 3 415.537 4.358 20 0 HIADHN C[C@@H](NC(=O)N1CCSC[C@H]1c1cccc(C(F)(F)F)c1)C1=CCN(C)CC1 ZINC000473998862 888857832 /nfs/dbraw/zinc/85/78/32/888857832.db2.gz CEHPFIIRQFTOML-KDOFPFPSSA-N 0 3 413.509 4.155 20 0 HIADHN C[C@@H](NC(=O)NC(C)(C)CCN1CCN(C)CC1)c1ccc(Cl)c2ccccc21 ZINC000474000225 888859023 /nfs/dbraw/zinc/85/90/23/888859023.db2.gz IKIRKSZGWVODLS-QGZVFWFLSA-N 0 3 416.997 4.270 20 0 HIADHN CN1CCN(CCC(C)(C)NC(=O)N[C@@H]2C[C@@H]3CCC(C)(C)c4cccc2c43)CC1 ZINC000474004025 888862240 /nfs/dbraw/zinc/86/22/40/888862240.db2.gz ATHQFKIUPUKJLN-GHTZIAJQSA-N 0 3 412.622 4.002 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)Nc3cc(-c4ccccc4)ns3)CC2)C[C@H](C)O1 ZINC000474004387 888863640 /nfs/dbraw/zinc/86/36/40/888863640.db2.gz FXTOBNSRPSNDGO-IRXDYDNUSA-N 0 3 414.575 4.163 20 0 HIADHN CC(C)C[C@@H](NC(=O)NC(C)(C)CCN1CCN(C)CC1)c1ccc(Cl)cc1 ZINC000474030772 888879657 /nfs/dbraw/zinc/87/96/57/888879657.db2.gz FUXYSJYFOPUKCN-HXUWFJFHSA-N 0 3 409.018 4.143 20 0 HIADHN C[C@@H](NC(=O)N[C@@H](CN1CCCC1)c1ccccc1)c1ccc(Br)cn1 ZINC000474034481 888880377 /nfs/dbraw/zinc/88/03/77/888880377.db2.gz PPKSSNWMRHXPHB-BEFAXECRSA-N 0 3 417.351 4.041 20 0 HIADHN O=C(N[C@@H](CO)c1c(Cl)cccc1Cl)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000474037409 888882954 /nfs/dbraw/zinc/88/29/54/888882954.db2.gz VLTLNLLEYJURGR-OALUTQOASA-N 0 3 422.356 4.163 20 0 HIADHN COc1ccc2c(c1)C(C)(C)C[C@@H]2N[C@H](C)c1cccc(S(=O)(=O)N(C)C)c1 ZINC000474048478 888888234 /nfs/dbraw/zinc/88/82/34/888888234.db2.gz WZIXIHIFFITWOE-VFNWGFHPSA-N 0 3 402.560 4.019 20 0 HIADHN Cc1ccc(Cl)c(S(=O)(=O)[N-]C2CC[NH+](C3CCCCC3)CC2)c1Cl ZINC000474188792 889027446 /nfs/dbraw/zinc/02/74/46/889027446.db2.gz KBZZFAPNXRWFMX-UHFFFAOYSA-N 0 3 405.391 4.377 20 0 HIADHN CC(C)c1nc2c([nH]1)C[C@H](C(=O)N1CCN(Cc3cccc4ccccc43)CC1)CC2 ZINC000474285925 889152856 /nfs/dbraw/zinc/15/28/56/889152856.db2.gz SXXNQUIWKGEDAL-HXUWFJFHSA-N 0 3 416.569 4.136 20 0 HIADHN CC(C)c1nc2c([nH]1)CC[C@@H](C(=O)N1CCN(Cc3cccc4ccccc43)CC1)C2 ZINC000474285925 889152863 /nfs/dbraw/zinc/15/28/63/889152863.db2.gz SXXNQUIWKGEDAL-HXUWFJFHSA-N 0 3 416.569 4.136 20 0 HIADHN COc1cnccc1N1CCN(C(=O)N[C@@H](C)c2ccc(SC(C)C)cc2)CC1 ZINC000474328999 889201144 /nfs/dbraw/zinc/20/11/44/889201144.db2.gz HUAAHJSISIDSOV-KRWDZBQOSA-N 0 3 414.575 4.184 20 0 HIADHN COc1ccc2nc(CNC[C@H](c3cccc(Cl)c3)N3CCOCC3)sc2c1 ZINC000474350655 889228388 /nfs/dbraw/zinc/22/83/88/889228388.db2.gz ZMJHFEUGHQXZJA-LJQANCHMSA-N 0 3 417.962 4.121 20 0 HIADHN COc1ccc2nc(CNCc3ccc(CN4C[C@@H](C)O[C@H](C)C4)cc3)sc2c1 ZINC000474353207 889230564 /nfs/dbraw/zinc/23/05/64/889230564.db2.gz NMRFJRSKWIJUBR-IAGOWNOFSA-N 0 3 411.571 4.204 20 0 HIADHN CO[C@@]1(C)CCCN(C(=O)N[C@H](CN2CCc3ccccc3C2)C(C)(C)C)CC1 ZINC000474361912 889240562 /nfs/dbraw/zinc/24/05/62/889240562.db2.gz GLQHHOJHZRLDRL-QPPBQGQZSA-N 0 3 401.595 4.060 20 0 HIADHN CCOCc1ccc(CNCc2ccc(Br)cc2N2CCOCC2)cc1 ZINC000474365328 889244827 /nfs/dbraw/zinc/24/48/27/889244827.db2.gz IRONDKWVOVKWKR-UHFFFAOYSA-N 0 3 419.363 4.112 20 0 HIADHN Cc1nnc([C@H]2CCCN(Cc3ccc(OC(F)(F)F)c(Br)c3)C2)[nH]1 ZINC000474387529 889260495 /nfs/dbraw/zinc/26/04/95/889260495.db2.gz BVDSMUTUKDUHAC-LBPRGKRZSA-N 0 3 419.245 4.154 20 0 HIADHN CCN(CC)[C@H](CNC(=O)[C@@H]1CCc2nc(C(C)C)[nH]c2C1)c1ccccc1Cl ZINC000474416467 889281034 /nfs/dbraw/zinc/28/10/34/889281034.db2.gz UTZCJWQNUXFIMQ-IIBYNOLFSA-N 0 3 416.997 4.491 20 0 HIADHN CCN(CC)[C@H](CNC(=O)[C@@H]1CCc2[nH]c(C(C)C)nc2C1)c1ccccc1Cl ZINC000474416467 889281043 /nfs/dbraw/zinc/28/10/43/889281043.db2.gz UTZCJWQNUXFIMQ-IIBYNOLFSA-N 0 3 416.997 4.491 20 0 HIADHN Cc1cc(Br)cc2c(C(=O)NCCCCN3C[C@@H](C)O[C@H](C)C3)coc21 ZINC000474494441 889355185 /nfs/dbraw/zinc/35/51/85/889355185.db2.gz GPFWYQYESGEFGX-HUUCEWRRSA-N 0 3 423.351 4.123 20 0 HIADHN C[C@@H](CNC(=O)c1ccc(NC(=O)Nc2ccccc2)s1)N1CCC[C@H](C)C1 ZINC000474514402 889379787 /nfs/dbraw/zinc/37/97/87/889379787.db2.gz PZUGZIUMXGZHCO-HOTGVXAUSA-N 0 3 400.548 4.242 20 0 HIADHN Cc1cc(NC(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)ccc1OC1CCOCC1 ZINC000474590658 889460132 /nfs/dbraw/zinc/46/01/32/889460132.db2.gz XXRYXALOAVAOHQ-JOCHJYFZSA-N 0 3 423.557 4.291 20 0 HIADHN Cc1ccccc1-n1nccc1CN[C@H](C)CC(=O)Nc1cccc(N2CCCC2)c1 ZINC000474598416 889466345 /nfs/dbraw/zinc/46/63/45/889466345.db2.gz PFFRWWLADOZSFY-HXUWFJFHSA-N 0 3 417.557 4.288 20 0 HIADHN CC(=O)N(Cc1ccc(NC(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)cc1)C(C)C ZINC000474600657 889468031 /nfs/dbraw/zinc/46/80/31/889468031.db2.gz IJYJSGCHXWGLFZ-XMMPIXPASA-N 0 3 422.573 4.182 20 0 HIADHN C[C@@H]1CCC[C@H](C)N1CCNC(=O)c1ccc(NC(=O)Nc2ccccc2)s1 ZINC000474611244 889475559 /nfs/dbraw/zinc/47/55/59/889475559.db2.gz FORWYQNKJVPDHJ-IYBDPMFKSA-N 0 3 400.548 4.385 20 0 HIADHN CN(C(=O)Nc1ccccc1OC[C@@H]1CCCCO1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000474722222 889578209 /nfs/dbraw/zinc/57/82/09/889578209.db2.gz YUCKSXUNQGDDGN-YADHBBJMSA-N 0 3 423.557 4.373 20 0 HIADHN OCCOc1ccc(CNCc2ccc(OC(F)(F)F)c(Br)c2)cc1 ZINC000474729195 889584965 /nfs/dbraw/zinc/58/49/65/889584965.db2.gz OKZBSJNCRKUDBL-UHFFFAOYSA-N 0 3 420.225 4.009 20 0 HIADHN Cc1ccc(NC(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)c(OC[C@@H]2CCCO2)c1 ZINC000474740647 889596262 /nfs/dbraw/zinc/59/62/62/889596262.db2.gz ZHUPPQZRPTYJOZ-VXKWHMMOSA-N 0 3 423.557 4.291 20 0 HIADHN CN(C(=O)Nc1cccc(C(=O)N2CCCCC2)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000474742077 889597783 /nfs/dbraw/zinc/59/77/83/889597783.db2.gz IFUSTPAWDOPIHO-QHCPKHFHSA-N 0 3 420.557 4.051 20 0 HIADHN COCCOc1ccc(NC(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)cc1Cl ZINC000474748674 889605207 /nfs/dbraw/zinc/60/52/07/889605207.db2.gz KCDLRURQKHTSNG-LJQANCHMSA-N 0 3 417.937 4.103 20 0 HIADHN C[C@@H](NC(=O)CCN1CCN(c2ccccc2)CC1)c1ccc(-c2cccnc2)cc1 ZINC000474860795 889716140 /nfs/dbraw/zinc/71/61/40/889716140.db2.gz OHNRQDVUTNCZOF-OAQYLSRUSA-N 0 3 414.553 4.138 20 0 HIADHN CCc1onc(-c2ccccc2)c1C(=O)Nc1ccc(CN2CCN(CC)CC2)cc1 ZINC000474873647 889727374 /nfs/dbraw/zinc/72/73/74/889727374.db2.gz SNGYEVWAHLWQTF-UHFFFAOYSA-N 0 3 418.541 4.294 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)c2csc(-c3ccccc3Cl)n2)CC1 ZINC000474874673 889729363 /nfs/dbraw/zinc/72/93/63/889729363.db2.gz CKQYFNMRJRBSFN-UHFFFAOYSA-N 0 3 407.967 4.083 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)C[C@@H](C)c2ccccc2C(F)(F)F)CC1 ZINC000474877678 889731858 /nfs/dbraw/zinc/73/18/58/889731858.db2.gz KZNZNKFXEPFZBH-MRXNPFEDSA-N 0 3 400.485 4.205 20 0 HIADHN CC(C)COc1ccc(C(C)(C)C(=O)NC2CCN(CCOC(C)C)CC2)cc1 ZINC000474882421 889738901 /nfs/dbraw/zinc/73/89/01/889738901.db2.gz RGFQNHRAHRVBCI-UHFFFAOYSA-N 0 3 404.595 4.005 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)CCOc2ccccc2-c2ccccc2)CC1 ZINC000474887815 889743887 /nfs/dbraw/zinc/74/38/87/889743887.db2.gz NHOFSDRYTSQWRF-UHFFFAOYSA-N 0 3 410.558 4.128 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)[C@H](C)Oc2ccc(-c3ccccc3)cc2)CC1 ZINC000474889311 889747298 /nfs/dbraw/zinc/74/72/98/889747298.db2.gz GDZFIMHZLUPYGX-FQEVSTJZSA-N 0 3 410.558 4.127 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)c2csc(-c3ccc(Cl)s3)n2)CC1 ZINC000474890959 889748961 /nfs/dbraw/zinc/74/89/61/889748961.db2.gz CFIFYVLPSYVHHG-UHFFFAOYSA-N 0 3 413.996 4.144 20 0 HIADHN COc1ccc([C@H](C)[C@@H](C)NCc2nnc3ccc(C(F)(F)F)cn32)cc1OC ZINC000474893382 889750459 /nfs/dbraw/zinc/75/04/59/889750459.db2.gz NLBKWMAIPLVPHO-CHWSQXEVSA-N 0 3 408.424 4.047 20 0 HIADHN Cc1ccc(-c2nc(C(=O)NC3CCN(CCOC(C)C)CC3)cs2)c(C)c1 ZINC000474897931 889757438 /nfs/dbraw/zinc/75/74/38/889757438.db2.gz VUMGIIAOIGHNAR-UHFFFAOYSA-N 0 3 401.576 4.046 20 0 HIADHN CCN(C(=O)Nc1ccc2c(c1)CCCN2C(C)=O)[C@H]1CCN(Cc2ccccc2)C1 ZINC000474998760 889850383 /nfs/dbraw/zinc/85/03/83/889850383.db2.gz FBMWDMSUAWNMJS-QHCPKHFHSA-N 0 3 420.557 4.114 20 0 HIADHN CCN(C(=O)Nc1cccc(OCCCOC)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475005813 889857265 /nfs/dbraw/zinc/85/72/65/889857265.db2.gz ZMLAAZGGDFUFIA-QFIPXVFZSA-N 0 3 411.546 4.230 20 0 HIADHN CCN(C(=O)Nc1ccc(OC[C@@H]2CCCO2)cc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475008342 889862100 /nfs/dbraw/zinc/86/21/00/889862100.db2.gz FYPKTMUYBIWOFL-VWNXMTODSA-N 0 3 423.557 4.373 20 0 HIADHN CC(C)[C@H](NC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1)c1nc2ccccc2[nH]1 ZINC000475012270 889865465 /nfs/dbraw/zinc/86/54/65/889865465.db2.gz GMIUTQFYCFUARZ-UGKGYDQZSA-N 0 3 405.546 4.176 20 0 HIADHN CCN1CCN(c2cccc(NCc3ccccc3OCc3ccncc3)c2)CC1 ZINC000475089697 889937693 /nfs/dbraw/zinc/93/76/93/889937693.db2.gz OJKSQRAUZJNGFJ-UHFFFAOYSA-N 0 3 402.542 4.415 20 0 HIADHN CN(C(=O)N[C@H](c1ccc(F)cc1)C(F)(F)F)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475094143 889940879 /nfs/dbraw/zinc/94/08/79/889940879.db2.gz IEBMCMBRMPLTLW-RBUKOAKNSA-N 0 3 409.427 4.345 20 0 HIADHN CN(Cc1ccc(Cl)c(C(F)(F)F)c1)C[C@@H]1C[C@H](F)CN1Cc1ncccn1 ZINC000475098012 889944568 /nfs/dbraw/zinc/94/45/68/889944568.db2.gz ATIYBOPLPWGVDQ-GJZGRUSLSA-N 0 3 416.850 4.193 20 0 HIADHN C[C@@H](NC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1)c1ccccc1OC(F)F ZINC000475146377 890014469 /nfs/dbraw/zinc/01/44/69/890014469.db2.gz OBXUEXFUACJHSJ-AEFFLSMTSA-N 0 3 403.473 4.265 20 0 HIADHN CCS(=O)(=O)c1ccc(CNC2CC(c3cccc(Br)c3)C2)s1 ZINC000475225160 890094894 /nfs/dbraw/zinc/09/48/94/890094894.db2.gz TXCVGCFFYSCZSI-UHFFFAOYSA-N 0 3 414.390 4.340 20 0 HIADHN C[C@@H](NC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1)c1cccc(N2CCCC2)c1 ZINC000475289865 890191200 /nfs/dbraw/zinc/19/12/00/890191200.db2.gz CXLXGZGGNKMBLR-HYBUGGRVSA-N 0 3 406.574 4.264 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2ccccc2)cc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475309594 890223200 /nfs/dbraw/zinc/22/32/00/890223200.db2.gz XBGBFMVJAISEOI-XMMPIXPASA-N 0 3 413.521 4.285 20 0 HIADHN C[C@@H](SCC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1)c1nc2ccccc2[nH]1 ZINC000475313122 890226913 /nfs/dbraw/zinc/22/69/13/890226913.db2.gz OUKDKCCRZZXCJT-IEBWSBKVSA-N 0 3 408.571 4.090 20 0 HIADHN CN(C(=O)c1cc(NC(=O)C(C)(C)C)ccc1F)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475314143 890230287 /nfs/dbraw/zinc/23/02/87/890230287.db2.gz RSNURVDWFISLJX-IBGZPJMESA-N 0 3 411.521 4.157 20 0 HIADHN CN(C(=O)CSCc1coc(-c2ccccc2)n1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475315675 890231813 /nfs/dbraw/zinc/23/18/13/890231813.db2.gz AVYCGVTYBLKEBO-QFIPXVFZSA-N 0 3 421.566 4.308 20 0 HIADHN Cc1noc(CSc2ccc(C(=O)N(C)[C@H]3CCN(Cc4ccccc4)C3)cc2)n1 ZINC000475315465 890232343 /nfs/dbraw/zinc/23/23/43/890232343.db2.gz XLGGDRGTSPRXMW-FQEVSTJZSA-N 0 3 422.554 4.017 20 0 HIADHN CCCc1noc2nc(C3CC3)cc(C(=O)N(C)[C@@H]3CCN(Cc4ccccc4)C3)c12 ZINC000475317399 890233007 /nfs/dbraw/zinc/23/30/07/890233007.db2.gz CSLNSVISNGLJLY-LJQANCHMSA-N 0 3 418.541 4.399 20 0 HIADHN CN(C(=O)C1(c2ccccc2Cl)CCOCC1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475319980 890238792 /nfs/dbraw/zinc/23/87/92/890238792.db2.gz UKAXMGVKBMRAKG-HXUWFJFHSA-N 0 3 412.961 4.121 20 0 HIADHN COCCC[C@H](Cc1ccccc1)[NH2+]Cc1ccc(OC)c([O-])c1Br ZINC000475331216 890250718 /nfs/dbraw/zinc/25/07/18/890250718.db2.gz KPAKEEWCBHGDEH-QGZVFWFLSA-N 0 3 408.336 4.291 20 0 HIADHN COC(=O)[C@@H]1CCN(Cc2cn(-c3ccccc3)nc2-c2ccc(OC)cc2)C[C@@H]1C ZINC000475360871 890287806 /nfs/dbraw/zinc/28/78/06/890287806.db2.gz CRCTXRIWISCCFM-FDDCHVKYSA-N 0 3 419.525 4.179 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)c1csc(Br)c1C ZINC000475371981 890301947 /nfs/dbraw/zinc/30/19/47/890301947.db2.gz RAXHBEINDMYLFJ-INIZCTEOSA-N 0 3 422.392 4.341 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)c2cnc(Cc3ccccc3F)s2)CC1 ZINC000475385292 890313205 /nfs/dbraw/zinc/31/32/05/890313205.db2.gz FDBHXLUOZHHKAS-UHFFFAOYSA-N 0 3 413.518 4.203 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2CNCC2(S(C)(=O)=O)CCC2)cc1C ZINC000475422119 890344140 /nfs/dbraw/zinc/34/41/40/890344140.db2.gz CQQPBLLFJUIPFY-UHFFFAOYSA-N 0 3 423.582 4.213 20 0 HIADHN CCCN(C(=O)C1CCC(OCCOC)CC1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000475468370 890377916 /nfs/dbraw/zinc/37/79/16/890377916.db2.gz OJPBVAWTAXQAQZ-WLXPTCNVSA-N 0 3 416.606 4.111 20 0 HIADHN C[C@H](NC(=O)Nc1ccc(Br)cc1OC(F)(F)F)C1=CCN(C)CC1 ZINC000475553844 890479200 /nfs/dbraw/zinc/47/92/00/890479200.db2.gz WCAJJJSPORUEAD-JTQLQIEISA-N 0 3 422.245 4.120 20 0 HIADHN O=C(c1cc2sc(N3CCCC3)nc2s1)N1CCC[C@H]1CN1CCCCC1 ZINC000475590702 890518533 /nfs/dbraw/zinc/51/85/33/890518533.db2.gz NMMZFOMVERWONT-HNNXBMFYSA-N 0 3 404.605 4.049 20 0 HIADHN CCCOc1c(CN2CCC[C@H](N(C)Cc3noc(C)n3)CC2)cccc1OCC ZINC000475625230 890563545 /nfs/dbraw/zinc/56/35/45/890563545.db2.gz UVBRWFFIYHSNHG-FQEVSTJZSA-N 0 3 416.566 4.052 20 0 HIADHN CCCCOc1cc(CN2CCC[C@@H](N(C)Cc3noc(C)n3)CC2)ccc1OC ZINC000475627732 890565007 /nfs/dbraw/zinc/56/50/07/890565007.db2.gz YSCIOICVISILSA-HXUWFJFHSA-N 0 3 416.566 4.052 20 0 HIADHN COc1cccc([C@H](CNC(=O)Nc2cc(-n3cccn3)ccc2C)N2CCCC2)c1 ZINC000475644123 890585361 /nfs/dbraw/zinc/58/53/61/890585361.db2.gz YGHFRVOFJJAUSY-QHCPKHFHSA-N 0 3 419.529 4.148 20 0 HIADHN CCOc1ccc(C(F)(F)F)cc1NC(=O)NC1CCN(CCOC(C)C)CC1 ZINC000475645435 890588629 /nfs/dbraw/zinc/58/86/29/890588629.db2.gz CJNQRSXGNAZQPI-UHFFFAOYSA-N 0 3 417.472 4.115 20 0 HIADHN CCN(C(=O)c1ccn(-c2c(F)cccc2F)n1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000475656206 890601067 /nfs/dbraw/zinc/60/10/67/890601067.db2.gz MNWSFBAHDNVLEJ-IEBWSBKVSA-N 0 3 424.495 4.448 20 0 HIADHN C[C@@H](c1ccc([S@@](C)=O)cc1)N(C)CCc1nc(-c2ccc(Cl)cc2)no1 ZINC000475746134 890689463 /nfs/dbraw/zinc/68/94/63/890689463.db2.gz IHCFAZHMNIRYOA-PGGUUEOZSA-N 0 3 403.935 4.363 20 0 HIADHN CN(C)[C@@H]1Cc2ccccc2N(C(=O)c2cc3sc(N4CCCC4)nc3s2)C1 ZINC000475802422 890736780 /nfs/dbraw/zinc/73/67/80/890736780.db2.gz ZKNMCAZMHBFIMU-OAHLLOKOSA-N 0 3 412.584 4.091 20 0 HIADHN Cc1cc(NC(=O)c2oc(CC(C)C)nc2C)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000475908135 890837045 /nfs/dbraw/zinc/83/70/45/890837045.db2.gz YCVSJEQKOCZUBG-HXUWFJFHSA-N 0 3 421.545 4.386 20 0 HIADHN Cc1nc(CC(C)C)oc1C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475908779 890838035 /nfs/dbraw/zinc/83/80/35/890838035.db2.gz BDQDFPKFEQMUQT-LJQANCHMSA-N 0 3 407.518 4.077 20 0 HIADHN CN(C(=O)c1cn(C)nc1-c1ccc(Cl)s1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475918168 890844421 /nfs/dbraw/zinc/84/44/21/890844421.db2.gz KBHBTNMXQSEPNH-MRXNPFEDSA-N 0 3 414.962 4.149 20 0 HIADHN CN(C)[C@@H](CNC(=O)N1CCO[C@@H](c2cccc(C(F)(F)F)c2)C1)c1ccccc1 ZINC000475951923 890873118 /nfs/dbraw/zinc/87/31/18/890873118.db2.gz FLBHYSVSWAQJFN-VQTJNVASSA-N 0 3 421.463 4.091 20 0 HIADHN CN(C)[C@H](CNC(=O)N1CCO[C@H](c2cccc(C(F)(F)F)c2)C1)c1ccccc1 ZINC000475951922 890873526 /nfs/dbraw/zinc/87/35/26/890873526.db2.gz FLBHYSVSWAQJFN-UXHICEINSA-N 0 3 421.463 4.091 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N[C@H](C)c2ccc(SC(C)C)cc2)CC1 ZINC000476030272 890962898 /nfs/dbraw/zinc/96/28/98/890962898.db2.gz HUWVSAQYLANALN-GOSISDBHSA-N 0 3 407.624 4.437 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N[C@H](c2ccc(Cl)cc2)[C@H]2C[C@@H]2C)CC1 ZINC000476037602 890968863 /nfs/dbraw/zinc/96/88/63/890968863.db2.gz ZEVDPMPMWCKUGM-ORYQWCPZSA-N 0 3 407.986 4.226 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)NCC2CCC(c3ccccc3)CC2)CC1 ZINC000476047018 890978840 /nfs/dbraw/zinc/97/88/40/890978840.db2.gz TZMUKPKIWRBJID-UHFFFAOYSA-N 0 3 401.595 4.149 20 0 HIADHN O=C(N[C@@H]1CCc2ccccc2C1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000504792797 913516655 /nfs/dbraw/zinc/51/66/55/913516655.db2.gz IFKIIZGJBOXJDD-IFMALSPDSA-N 0 3 402.460 4.115 20 0 HIADHN CSc1cnn(-c2ccccc2)c1NC(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C ZINC000476131217 891053444 /nfs/dbraw/zinc/05/34/44/891053444.db2.gz CYTRKRMLKRFINL-JXFKEZNVSA-N 0 3 409.559 4.407 20 0 HIADHN COCCN1CCC[C@@H]1CNC(=O)N[C@H](C)c1ccc(Oc2ccccc2)c(F)c1 ZINC000476178968 891109719 /nfs/dbraw/zinc/10/97/19/891109719.db2.gz XQTNUDMHAOQSQL-IEBWSBKVSA-N 0 3 415.509 4.089 20 0 HIADHN O=C(N[C@@H]1CCCOc2ccccc21)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000504812703 913532008 /nfs/dbraw/zinc/53/20/08/913532008.db2.gz QDJKFWCDIHQPBE-DENIHFKCSA-N 0 3 418.459 4.471 20 0 HIADHN C[C@H]1C[C@H](NC(=O)c2cn(C)nc2-c2ccc(Cl)s2)CN1Cc1ccccc1 ZINC000476305009 891217156 /nfs/dbraw/zinc/21/71/56/891217156.db2.gz XDQYMPQJTJBRTR-HOCLYGCPSA-N 0 3 414.962 4.195 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Nc1c(F)cc(F)cc1Br ZINC000476361211 891266832 /nfs/dbraw/zinc/26/68/32/891266832.db2.gz FRERIFIVNMJRLR-UHFFFAOYSA-N 0 3 418.307 4.385 20 0 HIADHN CCOc1ccc([C@@H](NC(=O)N(C)[C@@H]2CCN(C3CC3)C2)C(C)C)cc1OCC ZINC000476372706 891285400 /nfs/dbraw/zinc/28/54/00/891285400.db2.gz BGJCYZLYEZKGRB-KNQAVFIVSA-N 0 3 403.567 4.059 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N(C)[C@@H](C)c2ccc(C(F)(F)F)cc2)CC1 ZINC000476428638 891340551 /nfs/dbraw/zinc/34/05/51/891340551.db2.gz AOMNQVWHYMRPGC-INIZCTEOSA-N 0 3 415.500 4.297 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N(C)[C@H](C)c2ccc(C(F)(F)F)cc2)CC1 ZINC000476428639 891341317 /nfs/dbraw/zinc/34/13/17/891341317.db2.gz AOMNQVWHYMRPGC-MRXNPFEDSA-N 0 3 415.500 4.297 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N(C)Cc2cccc(Cl)c2Cl)CC1 ZINC000476438852 891350826 /nfs/dbraw/zinc/35/08/26/891350826.db2.gz VIPHRWWZNKZFKY-UHFFFAOYSA-N 0 3 402.366 4.024 20 0 HIADHN CC[C@@H]1CN(C(=O)NC2CCN(CCOC(C)C)CC2)CC[C@@H]1c1ccccc1 ZINC000476446568 891358141 /nfs/dbraw/zinc/35/81/41/891358141.db2.gz IQFMUFBMGSAJRI-OFNKIYASSA-N 0 3 401.595 4.101 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N2CCC[C@H]2c2nc3ccccc3s2)CC1 ZINC000476451548 891363594 /nfs/dbraw/zinc/36/35/94/891363594.db2.gz JBWFWQMTFNFFJK-IBGZPJMESA-N 0 3 416.591 4.032 20 0 HIADHN CSc1cccc(N(C(=O)c2ccc(-n3cncn3)cc2C)C2CCN(C)CC2)c1 ZINC000476566680 891486285 /nfs/dbraw/zinc/48/62/85/891486285.db2.gz IOTTZXPJGCPJJO-UHFFFAOYSA-N 0 3 421.570 4.039 20 0 HIADHN C[C@H](c1ccc(F)c(F)c1)N(C)C(=O)CN1CC[C@@H](COCc2ccccc2)C1 ZINC000476586947 891514323 /nfs/dbraw/zinc/51/43/23/891514323.db2.gz GHVVWZRVMORVEL-IEBWSBKVSA-N 0 3 402.485 4.023 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)NCc1cccc(OC(C)(C)C)n1 ZINC000504845923 913571929 /nfs/dbraw/zinc/57/19/29/913571929.db2.gz LXEOVFJLRXRPBQ-UHFFFAOYSA-N 0 3 418.969 4.186 20 0 HIADHN CC(C)c1nc2c([nH]1)C[C@H](C(=O)NC[C@@H](c1cccc(C(F)(F)F)c1)N(C)C)CC2 ZINC000476725682 891690413 /nfs/dbraw/zinc/69/04/13/891690413.db2.gz MJGBOVJTBGAWHO-BEFAXECRSA-N 0 3 422.495 4.076 20 0 HIADHN CC(C)c1nc2c([nH]1)CC[C@@H](C(=O)NC[C@@H](c1cccc(C(F)(F)F)c1)N(C)C)C2 ZINC000476725682 891690434 /nfs/dbraw/zinc/69/04/34/891690434.db2.gz MJGBOVJTBGAWHO-BEFAXECRSA-N 0 3 422.495 4.076 20 0 HIADHN Cc1nc(-c2ccc(CNC(=O)N[C@@H]3CCN(Cc4ccccc4)[C@@H]3C)o2)cs1 ZINC000476736152 891703328 /nfs/dbraw/zinc/70/33/28/891703328.db2.gz KHPFKHFXLXWWOO-DNVCBOLYSA-N 0 3 410.543 4.174 20 0 HIADHN CC(C)[C@@H](CNC(=O)Nc1ccccc1N1CCCC1=O)N1CCc2ccccc2C1 ZINC000504863319 913592382 /nfs/dbraw/zinc/59/23/82/913592382.db2.gz JPGUEABURXFFNE-HSZRJFAPSA-N 0 3 420.557 4.018 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCC[C@]2(C1)OCc1ccccc12)c1ccsc1 ZINC000476864610 891829493 /nfs/dbraw/zinc/82/94/93/891829493.db2.gz UCQVQDRZMJDIPO-FYYLOGMGSA-N 0 3 413.587 4.362 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N2CCC[C@@]3(C2)OCc2ccccc23)C1 ZINC000476892660 891851211 /nfs/dbraw/zinc/85/12/11/891851211.db2.gz ZSMRGXHDRCPNFQ-WPWBMXPQSA-N 0 3 405.542 4.053 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)N[C@H](c1nccn1C)c1ccc(Cl)cc1 ZINC000476905368 891858474 /nfs/dbraw/zinc/85/84/74/891858474.db2.gz UKZXEUCQSHDJOL-FQEVSTJZSA-N 0 3 417.985 4.070 20 0 HIADHN COc1cc(OC)c(NC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)cc1Cl ZINC000504880624 913609424 /nfs/dbraw/zinc/60/94/24/913609424.db2.gz CRMAREZHKQEZRL-MRXNPFEDSA-N 0 3 403.910 4.143 20 0 HIADHN Cc1nc(-c2ccccc2C)sc1C(=O)NC1CCN(CCOC(C)C)CC1 ZINC000477016645 891943634 /nfs/dbraw/zinc/94/36/34/891943634.db2.gz DNJAJYWZHPJXBB-UHFFFAOYSA-N 0 3 401.576 4.046 20 0 HIADHN O=C(CN1CCC[C@@]2(CCCOC2)C1)N1Cc2ccccc2[C@@H](c2ccccc2)C1 ZINC000477049638 891979067 /nfs/dbraw/zinc/97/90/67/891979067.db2.gz OUUALPNTMNGWEX-AOYPEHQESA-N 0 3 404.554 4.053 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)c(OC)c1 ZINC000504887573 913619626 /nfs/dbraw/zinc/61/96/26/913619626.db2.gz CSOUZSSUQYBOKS-REWPJTCUSA-N 0 3 423.557 4.215 20 0 HIADHN COCCN1CCC[C@@H]1CNC(=O)N(Cc1ccccc1)[C@@H](C)c1cccs1 ZINC000477106109 892037828 /nfs/dbraw/zinc/03/78/28/892037828.db2.gz HRCYUMCUOPCKAE-AZUAARDMSA-N 0 3 401.576 4.132 20 0 HIADHN COCCN1CCC[C@@H]1CNC(=O)Nc1ccc(Cc2nc3ccccc3s2)cc1 ZINC000477130580 892060002 /nfs/dbraw/zinc/06/00/02/892060002.db2.gz AERWTOVWBZAWAY-LJQANCHMSA-N 0 3 424.570 4.119 20 0 HIADHN Brc1ccc(-c2noc(-c3ccc(CN4CCSCC4)cc3)n2)o1 ZINC000477168614 892089983 /nfs/dbraw/zinc/08/99/83/892089983.db2.gz ZZEYCEMTPKXRRL-UHFFFAOYSA-N 0 3 406.305 4.308 20 0 HIADHN Cc1cccc2c1[C@H](C)C[C@@H]2NCc1ccccc1OCC(=O)NC[C@H]1CCCO1 ZINC000504900229 913632228 /nfs/dbraw/zinc/63/22/28/913632228.db2.gz UFZWKUMKCKKYIK-UZKOGDIHSA-N 0 3 408.542 4.007 20 0 HIADHN CC[C@H](C)C(=O)Nc1cccc(CNC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000504904249 913636525 /nfs/dbraw/zinc/63/65/25/913636525.db2.gz VKZCACYRBUPLRY-CVDCTZTESA-N 0 3 422.573 4.135 20 0 HIADHN NC(=O)c1ccc(CNCc2ccc(OCCOc3ccc(Cl)cc3)cc2)cc1 ZINC000477295912 892257804 /nfs/dbraw/zinc/25/78/04/892257804.db2.gz MIFBZHJKAMCBMP-UHFFFAOYSA-N 0 3 410.901 4.187 20 0 HIADHN CC[C@H](NC(=O)NC[C@@H](C)N(C)Cc1ccccc1)c1nc(-c2ccccc2)c[nH]1 ZINC000477339572 892306682 /nfs/dbraw/zinc/30/66/82/892306682.db2.gz QPKCYAHBUDRTQN-NQIIRXRSSA-N 0 3 405.546 4.348 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)Cc2nc(-c3ccc(F)cc3)cs2)CN1Cc1ccccc1 ZINC000477348909 892316985 /nfs/dbraw/zinc/31/69/85/892316985.db2.gz GSNSBWHAHGNPAY-UZLBHIALSA-N 0 3 409.530 4.271 20 0 HIADHN C[C@@H]1CSc2ccc(Br)cc2[C@H]1NC(=O)N(C)[C@H]1CCN(C2CC2)C1 ZINC000477419846 892372933 /nfs/dbraw/zinc/37/29/33/892372933.db2.gz RQRIKQSVCMYGSQ-MRAWALMUSA-N 0 3 424.408 4.110 20 0 HIADHN Cc1nc2ccccc2n1C1CCN(C(=O)[C@H]2CCCN2Cc2ccccc2)CC1 ZINC000477423057 892377125 /nfs/dbraw/zinc/37/71/25/892377125.db2.gz GJQKOFYLSIUTFE-XMMPIXPASA-N 0 3 402.542 4.173 20 0 HIADHN CCn1ncc2ccc(NC(=O)NC[C@@H](C(C)C)N3CCc4ccccc4C3)cc21 ZINC000477441736 892393142 /nfs/dbraw/zinc/39/31/42/892393142.db2.gz HBCYLVPXTDUWAS-QHCPKHFHSA-N 0 3 405.546 4.261 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)c3cnc(-c4ccco4)s3)CC2)c1 ZINC000504930238 913670248 /nfs/dbraw/zinc/67/02/48/913670248.db2.gz OGQURLXXTOEECU-UHFFFAOYSA-N 0 3 424.570 4.044 20 0 HIADHN Cc1[nH]c2ccccc2c1C1CCN(S(=O)(=O)c2ccc(CN(C)C)cc2)CC1 ZINC000477507106 892518489 /nfs/dbraw/zinc/51/84/89/892518489.db2.gz KHHSZXVTMZYALF-UHFFFAOYSA-N 0 3 411.571 4.106 20 0 HIADHN O=S(=O)(CCCNC1(c2cccc(C(F)(F)F)c2)CC1)c1ccc(F)cc1 ZINC000477537444 892570778 /nfs/dbraw/zinc/57/07/78/892570778.db2.gz CKAPZEQFIWSWFN-UHFFFAOYSA-N 0 3 401.425 4.287 20 0 HIADHN CN(C)Cc1ccc(S(=O)(=O)N2CCC[C@@H]2c2ccc(Br)cc2)cc1 ZINC000477572834 892635306 /nfs/dbraw/zinc/63/53/06/892635306.db2.gz BEPBBRTWBKZZIA-LJQANCHMSA-N 0 3 423.376 4.037 20 0 HIADHN Cc1ccc(OCCCC(=O)Nc2cccc(CN3CCC(CO)CC3)c2)cc1C ZINC000477698939 892815535 /nfs/dbraw/zinc/81/55/35/892815535.db2.gz HNYXBAWVHVOTRK-UHFFFAOYSA-N 0 3 410.558 4.305 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1[nH]c2ccc(F)cc2c1Cl ZINC000477701183 892816911 /nfs/dbraw/zinc/81/69/11/892816911.db2.gz KGMAULZHOIUWGD-UHFFFAOYSA-N 0 3 415.896 4.417 20 0 HIADHN CCN(C[C@@H]1CCN([C@@H](C)C(=O)N(Cc2ccccc2)C(C)C)C1)CC(F)(F)F ZINC000477723494 892827472 /nfs/dbraw/zinc/82/74/72/892827472.db2.gz JQTQJMYWBGEGLJ-ICSRJNTNSA-N 0 3 413.528 4.018 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1cc(Cl)ccc1OC(F)F ZINC000477725898 892828181 /nfs/dbraw/zinc/82/81/81/892828181.db2.gz NWYWHEBVSACKAV-UHFFFAOYSA-N 0 3 424.875 4.398 20 0 HIADHN CC[C@H](O[C@@H]1CCC[C@H](C)C1)C(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000477752905 892844104 /nfs/dbraw/zinc/84/41/04/892844104.db2.gz YAYPEFZFNXKIET-NMNUPHIUSA-N 0 3 402.579 4.203 20 0 HIADHN O=C(CCOc1ccc(F)cc1Cl)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000477754959 892846146 /nfs/dbraw/zinc/84/61/46/892846146.db2.gz LSKGXZVPRVFKJV-UHFFFAOYSA-N 0 3 420.912 4.091 20 0 HIADHN CCN(C[C@@H]1CCN(Cc2cccc(C(=O)N3CCCCC3)c2)C1)CC(F)(F)F ZINC000477763920 892852843 /nfs/dbraw/zinc/85/28/43/892852843.db2.gz XYIJQGGZJVRMOG-IBGZPJMESA-N 0 3 411.512 4.019 20 0 HIADHN Cc1ccc(COc2ccc(C[C@H](C)NC(=O)N(C)[C@H]3CCN(C4CC4)C3)cc2)cc1 ZINC000477764679 892853025 /nfs/dbraw/zinc/85/30/25/892853025.db2.gz SYUKXVDSEVMUST-RDPSFJRHSA-N 0 3 421.585 4.383 20 0 HIADHN C[S@](=O)c1ccc(NC(=O)N[C@H](CN2CCc3ccccc3C2)C(C)(C)C)cc1 ZINC000477779490 892862927 /nfs/dbraw/zinc/86/29/27/892862927.db2.gz NZSVAVVIURPBAP-PBBNMVCDSA-N 0 3 413.587 4.019 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)Nc1ccccc1OC(F)(F)F ZINC000504971294 913710137 /nfs/dbraw/zinc/71/01/37/913710137.db2.gz POPRNQRKSQPYCT-UHFFFAOYSA-N 0 3 403.470 4.068 20 0 HIADHN C[C@@H](NC(=O)NCc1ccc(COCC(F)(F)F)cc1)[C@@H](c1ccccc1)N(C)C ZINC000477853922 892913435 /nfs/dbraw/zinc/91/34/35/892913435.db2.gz YNFIZEQZKDWEBZ-UZLBHIALSA-N 0 3 423.479 4.256 20 0 HIADHN COC(=O)c1csc(-c2cccc(CN[C@H](C)c3cccc(NC(C)=O)c3)c2)n1 ZINC000477869417 892929770 /nfs/dbraw/zinc/92/97/70/892929770.db2.gz ZCZFVDTYIIUPQM-CQSZACIVSA-N 0 3 409.511 4.406 20 0 HIADHN C[C@H](NC(=O)NCc1ccc(NC(=O)c2ccco2)cc1)[C@@H](c1ccccc1)N(C)C ZINC000477875764 892938304 /nfs/dbraw/zinc/93/83/04/892938304.db2.gz IHMSTYJGLWESRD-JTSKRJEESA-N 0 3 420.513 4.023 20 0 HIADHN Cc1ccc(CN2CC[C@H](N[C@H](C)CC(=O)Nc3ccc(C)cc3Cl)C2=O)cc1 ZINC000477917344 892999942 /nfs/dbraw/zinc/99/99/42/892999942.db2.gz NSLVMJXIURFTEM-UTKZUKDTSA-N 0 3 413.949 4.065 20 0 HIADHN CCN(CC)C(=O)Nc1ccc([C@H](C)N[C@@H]2CCN(Cc3ccc(C)cc3)C2=O)cc1 ZINC000477918229 893001607 /nfs/dbraw/zinc/00/16/07/893001607.db2.gz OYDLGMXVGISLDJ-WMZHIEFXSA-N 0 3 422.573 4.320 20 0 HIADHN C[C@@H](NCc1ccc(S(=O)(=O)CCO)cc1)c1ccc(-c2ccc(F)cc2)s1 ZINC000477929035 893016937 /nfs/dbraw/zinc/01/69/37/893016937.db2.gz QIQALZXMLCNMRT-OAHLLOKOSA-N 0 3 419.543 4.171 20 0 HIADHN CCCCn1ccnc1-c1cccc(NC(=O)N(CCN(C)C)Cc2ccccn2)c1 ZINC000477976154 893071127 /nfs/dbraw/zinc/07/11/27/893071127.db2.gz HKNYDPZCKPOWAY-UHFFFAOYSA-N 0 3 420.561 4.341 20 0 HIADHN COCCC1(CNC(=O)NC[C@@H](c2ccc(OC)cc2)N2CCCC2)CCCCC1 ZINC000478024648 893147220 /nfs/dbraw/zinc/14/72/20/893147220.db2.gz MHDYNHYOJGCMEL-QFIPXVFZSA-N 0 3 417.594 4.118 20 0 HIADHN CCCN(C(=O)c1cc2ccccc2[nH]c1=O)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000504994684 913738983 /nfs/dbraw/zinc/73/89/83/913738983.db2.gz RTXVKZDAKXEXST-OAQYLSRUSA-N 0 3 403.526 4.457 20 0 HIADHN CCCN(C(=O)[C@@H]1CC(=O)Nc2cc(F)ccc21)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000504994390 913739840 /nfs/dbraw/zinc/73/98/40/913739840.db2.gz OLGHYAJQUCOGNX-IFMALSPDSA-N 0 3 423.532 4.155 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)c1ccc(-c2cncnc2)cc1F ZINC000478066884 893227762 /nfs/dbraw/zinc/22/77/62/893227762.db2.gz XIHLWIDQFFYTJP-UHFFFAOYSA-N 0 3 422.529 4.126 20 0 HIADHN CC(C)[C@H](CNC(=O)c1ccc(-c2cncnc2)cc1F)N1CCc2ccccc2C1 ZINC000478069905 893231885 /nfs/dbraw/zinc/23/18/85/893231885.db2.gz XSSBMOUJKIBLHG-DEOSSOPVSA-N 0 3 418.516 4.095 20 0 HIADHN CCCN(C(=O)CCc1nc2ccccc2[nH]1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000505005969 913747511 /nfs/dbraw/zinc/74/75/11/913747511.db2.gz PAUUBIPVRJSNCS-OAQYLSRUSA-N 0 3 404.558 4.399 20 0 HIADHN C[C@@H](CC(=O)Nc1ccccc1)N[C@@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O ZINC000478273736 893472698 /nfs/dbraw/zinc/47/26/98/893472698.db2.gz KSXAISKAZHJVSD-SCLBCKFNSA-N 0 3 406.313 4.106 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)N[C@@H]2CCSc3ccc(F)cc32)c1 ZINC000478297663 893514065 /nfs/dbraw/zinc/51/40/65/893514065.db2.gz PQDDUCRHEWLRAU-HXUWFJFHSA-N 0 3 417.550 4.145 20 0 HIADHN CC[C@@H](C)n1ncc(C(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)c1C ZINC000478342020 893583373 /nfs/dbraw/zinc/58/33/73/893583373.db2.gz MRKNVKDNKANYSL-YLJYHZDGSA-N 0 3 406.534 4.058 20 0 HIADHN CN(Cc1ccc(F)cc1Br)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000478459753 893779446 /nfs/dbraw/zinc/77/94/46/893779446.db2.gz NZUDIVDUMKVJKH-GOSISDBHSA-N 0 3 420.326 4.004 20 0 HIADHN Cc1c(Br)cccc1CC(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000478477836 893802706 /nfs/dbraw/zinc/80/27/06/893802706.db2.gz GHGGAHOKAAJHRM-UHFFFAOYSA-N 0 3 415.375 4.423 20 0 HIADHN CCOc1c(Cl)cccc1CC(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000478483923 893806735 /nfs/dbraw/zinc/80/67/35/893806735.db2.gz VFJDCCXFWAQEMW-UHFFFAOYSA-N 0 3 400.950 4.404 20 0 HIADHN COc1ccc(-c2nc(C)c(C(=O)NC[C@H](C)N3CCCC[C@@H]3C)s2)cc1OC ZINC000478567013 893852283 /nfs/dbraw/zinc/85/22/83/893852283.db2.gz RFDUPIZONNIHMQ-GJZGRUSLSA-N 0 3 417.575 4.128 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Cc1nc(-c2ccc(F)cc2)cs1 ZINC000478584119 893860783 /nfs/dbraw/zinc/86/07/83/893860783.db2.gz KKDIXKKWIYVELK-OXQOHEQNSA-N 0 3 409.530 4.128 20 0 HIADHN Cc1csc(C(=O)NCCCCN2CCN(c3cccc(C)c3)CC2)c1Cl ZINC000478679726 893933877 /nfs/dbraw/zinc/93/38/77/893933877.db2.gz KFZIXJKVFSQKDM-UHFFFAOYSA-N 0 3 405.995 4.351 20 0 HIADHN Cc1csc(C(=O)NCCCCN2CCN(Cc3ccccc3)CC2)c1Cl ZINC000478703439 893965641 /nfs/dbraw/zinc/96/56/41/893965641.db2.gz KXWBAESPAOIEKM-UHFFFAOYSA-N 0 3 405.995 4.038 20 0 HIADHN CC(C)C(=O)Nc1ccc(NC(=O)[C@H]2CN(Cc3ccccc3)CCC2(F)F)cc1 ZINC000505121467 913827347 /nfs/dbraw/zinc/82/73/47/913827347.db2.gz VSNCDMBWLFOGNO-HXUWFJFHSA-N 0 3 415.484 4.377 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2ccccc2Br)c1 ZINC000478758599 894035895 /nfs/dbraw/zinc/03/58/95/894035895.db2.gz LCHSHGYSHRWEEW-UHFFFAOYSA-N 0 3 406.324 4.053 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2ccccc2N2CCCCC2)c1 ZINC000478779324 894055628 /nfs/dbraw/zinc/05/56/28/894055628.db2.gz IXGFJNWNICNTOU-UHFFFAOYSA-N 0 3 410.562 4.281 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)c1ccccc1NCc1cccnc1 ZINC000478788139 894063285 /nfs/dbraw/zinc/06/32/85/894063285.db2.gz RGQMBKKXRMGUOD-NRFANRHFSA-N 0 3 406.555 4.322 20 0 HIADHN Cc1cc(C(=O)N(Cc2ccccc2)C2CCN(C)CC2)nn1-c1cccc(F)c1 ZINC000478929379 894209775 /nfs/dbraw/zinc/20/97/75/894209775.db2.gz IUOXWZIBGTWVMZ-UHFFFAOYSA-N 0 3 406.505 4.056 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N2CC3(CCOCC3)c3ccccc32)N2CCCC2)cc1 ZINC000478951664 894233917 /nfs/dbraw/zinc/23/39/17/894233917.db2.gz JSGRYJPOYLZHCE-XMMPIXPASA-N 0 3 419.569 4.410 20 0 HIADHN COC(=O)CCSc1cccc(NC(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)c1 ZINC000478965460 894244872 /nfs/dbraw/zinc/24/48/72/894244872.db2.gz QFDRFQOPEJVHBA-IIBYNOLFSA-N 0 3 415.559 4.155 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1nnc(/C=C/c2ccco2)s1)c1ccco1 ZINC000479039722 894299827 /nfs/dbraw/zinc/29/98/27/894299827.db2.gz ASEKHQIJZNBMIH-JTMKOSTRSA-N 0 3 401.492 4.145 20 0 HIADHN Cc1c(NC(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)cnn1CC(C)C ZINC000479045993 894306587 /nfs/dbraw/zinc/30/65/87/894306587.db2.gz MSRHEPIKKYMYAE-OAQYLSRUSA-N 0 3 401.555 4.059 20 0 HIADHN C[C@H](CN[C@@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl)Cc1cccs1 ZINC000479064934 894326060 /nfs/dbraw/zinc/32/60/60/894326060.db2.gz HSUVXKHTYYFQLQ-QWRGUYRKSA-N 0 3 407.388 4.232 20 0 HIADHN C[C@@H](CN[C@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl)c1ccc(F)cc1 ZINC000479065898 894328791 /nfs/dbraw/zinc/32/87/91/894328791.db2.gz HTVSORIXQFNRKR-WDEREUQCSA-N 0 3 405.322 4.234 20 0 HIADHN CCC[C@@H](C)N1Cc2cccc(NS(=O)(=O)c3ccccc3Cn3ccnc3)c2C1 ZINC000479130968 894400018 /nfs/dbraw/zinc/40/00/18/894400018.db2.gz FUEDPMLBRXLHCK-GOSISDBHSA-N 0 3 424.570 4.236 20 0 HIADHN CCc1c(C(=O)Nc2cccc(CN3CCC(CO)CC3)c2)cnn1C(CC)CC ZINC000479156211 894425509 /nfs/dbraw/zinc/42/55/09/894425509.db2.gz CWEFCNSVSWWUQH-UHFFFAOYSA-N 0 3 412.578 4.263 20 0 HIADHN CC(C)c1ccccc1OCCNC(=O)N(CCN(C)C)Cc1ccccc1F ZINC000479171567 894441726 /nfs/dbraw/zinc/44/17/26/894441726.db2.gz XLEXDWVBCWXTSS-UHFFFAOYSA-N 0 3 401.526 4.101 20 0 HIADHN O=C(c1cccc(CN2CCCC2)c1)N1CCO[C@H](c2ccc(F)cc2Cl)C1 ZINC000479270387 894544288 /nfs/dbraw/zinc/54/42/88/894544288.db2.gz NGPFEWPRPJUYNQ-NRFANRHFSA-N 0 3 402.897 4.289 20 0 HIADHN CCCN(C(=O)CCCN1CCN(c2ccccc2)CC1)[C@@H]1CCCc2cccnc21 ZINC000479345627 894641829 /nfs/dbraw/zinc/64/18/29/894641829.db2.gz CNODWCAXNXBFSH-XMMPIXPASA-N 0 3 420.601 4.300 20 0 HIADHN CO[C@H](c1ccc(Cl)cc1)[C@@H](C)N[C@H](C)c1cc(S(N)(=O)=O)c(C)cc1C ZINC000479405185 894710527 /nfs/dbraw/zinc/71/05/27/894710527.db2.gz FPOOSFAKONBGHB-SXGZJXTBSA-N 0 3 410.967 4.031 20 0 HIADHN Cc1cc(C)c(S(N)(=O)=O)cc1[C@H](C)N[C@@H]1CCc2c1cccc2Br ZINC000479419556 894730768 /nfs/dbraw/zinc/73/07/68/894730768.db2.gz QBCBPZNSDSOBJU-SCLBCKFNSA-N 0 3 423.376 4.051 20 0 HIADHN CCC(CC)[C@@H](CCN[C@@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl)OC ZINC000479421841 894732657 /nfs/dbraw/zinc/73/26/57/894732657.db2.gz SJBPRXNUFCTXHO-MEDUHNTESA-N 0 3 411.395 4.133 20 0 HIADHN CCS(=O)(=O)c1c(Cl)cccc1CN[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000479458446 894779256 /nfs/dbraw/zinc/77/92/56/894779256.db2.gz XSBMWPFRJQLVMK-IEBWSBKVSA-N 0 3 411.926 4.283 20 0 HIADHN CC(=O)N1CCC[C@@H](CN[C@@H](c2ccccc2)c2ccccc2Br)C1 ZINC000479474486 894798082 /nfs/dbraw/zinc/79/80/82/894798082.db2.gz DFYKXHRKPBQIRA-UWJYYQICSA-N 0 3 401.348 4.387 20 0 HIADHN COCCCC[C@@H](N[C@@H](C)c1cccc(S(=O)(=O)N(C)C)c1)c1ccccc1 ZINC000479487737 894809641 /nfs/dbraw/zinc/80/96/41/894809641.db2.gz GQSTXAWTDJHVFY-PGRDOPGGSA-N 0 3 404.576 4.146 20 0 HIADHN CC[C@H](NCC1(S(C)(=O)=O)CC1)c1ccc(Br)cc1C(F)(F)F ZINC000479494868 894814318 /nfs/dbraw/zinc/81/43/18/894814318.db2.gz DSXJFPZCVGAQFI-ZDUSSCGKSA-N 0 3 414.287 4.086 20 0 HIADHN COc1ccc(-c2ccncc2)cc1CNc1ccc(N2CCN(C)CC2)cc1C ZINC000479571059 894864763 /nfs/dbraw/zinc/86/47/63/894864763.db2.gz QREDYACXTZOBAD-UHFFFAOYSA-N 0 3 402.542 4.430 20 0 HIADHN O=S1(=O)CCCN1c1ccc(CNCc2cccc(-c3ccccc3)c2)cc1F ZINC000479604623 894881540 /nfs/dbraw/zinc/88/15/40/894881540.db2.gz LVVRGTJAKUDBSE-UHFFFAOYSA-N 0 3 410.514 4.322 20 0 HIADHN Cc1nc(COc2ccc(CN[C@@H](Cc3ccccn3)c3ccccc3)cc2)no1 ZINC000479614852 894885294 /nfs/dbraw/zinc/88/52/94/894885294.db2.gz LXKLKUWJECIEHY-QHCPKHFHSA-N 0 3 400.482 4.426 20 0 HIADHN COc1cc([C@H](C)NC(=O)N2CCN(C3CCCC3)CC2)ccc1OCC(C)C ZINC000505261859 913918719 /nfs/dbraw/zinc/91/87/19/913918719.db2.gz NKSZKUAHCIEKIT-SFHVURJKSA-N 0 3 403.567 4.061 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)Nc3ccc(Br)cc3)CC2)C[C@H](C)O1 ZINC000479685067 894970044 /nfs/dbraw/zinc/97/00/44/894970044.db2.gz KYCSACPVRWFNSP-HOTGVXAUSA-N 0 3 424.383 4.192 20 0 HIADHN CCCC1CCC(N(C)C(=O)NCc2ccccc2CN2CCC(O)CC2)CC1 ZINC000479689171 894976666 /nfs/dbraw/zinc/97/66/66/894976666.db2.gz PUUZIOQXCWBMBG-UHFFFAOYSA-N 0 3 401.595 4.144 20 0 HIADHN C[C@@H](NC(=O)NC1(c2cc(C(F)(F)F)ccc2Cl)CC1)C1=CCN(C)CC1 ZINC000479738914 895037247 /nfs/dbraw/zinc/03/72/47/895037247.db2.gz FNVKBYMXNGMRJB-GFCCVEGCSA-N 0 3 401.860 4.298 20 0 HIADHN C[C@H](CN(C(=O)N[C@@H](CN1CCCC1)c1ccccc1)[C@@H](C)CO)c1ccccc1 ZINC000479758162 895057495 /nfs/dbraw/zinc/05/74/95/895057495.db2.gz RSHJDXVGXAMOND-DPLHUUCSSA-N 0 3 409.574 4.020 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)N1CC2(CCOCC2)c2ccccc21 ZINC000479778878 895081250 /nfs/dbraw/zinc/08/12/50/895081250.db2.gz RCAQDTVRFRIHST-QHCPKHFHSA-N 0 3 421.585 4.421 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N[C@@H](C)c1ccc(NC(=O)C2CC2)cc1)c1ccco1 ZINC000479789346 895093019 /nfs/dbraw/zinc/09/30/19/895093019.db2.gz QTQQTNBZYWFDMT-FTRWYGJKSA-N 0 3 412.534 4.118 20 0 HIADHN C[C@@H](NC[C@@H](c1cccs1)N1CCOCC1)c1ccc(F)cc1Br ZINC000479851052 895184391 /nfs/dbraw/zinc/18/43/91/895184391.db2.gz NAWSGZLWXOJXIW-DYVFJYSZSA-N 0 3 413.356 4.374 20 0 HIADHN Cc1c([C@H](C)NCc2ccc(CN3CCOCC3)cc2)cnn1-c1cc(C)ccc1C ZINC000479888989 895235427 /nfs/dbraw/zinc/23/54/27/895235427.db2.gz UXGLVZDCLPPOQV-NRFANRHFSA-N 0 3 418.585 4.481 20 0 HIADHN Cc1c([C@H](C)NCc2ccc(CN3CCOCC3)cc2)cnn1-c1ccc(F)cc1 ZINC000479900779 895247740 /nfs/dbraw/zinc/24/77/40/895247740.db2.gz LBIFAYMVNBKKNB-SFHVURJKSA-N 0 3 408.521 4.003 20 0 HIADHN CC(C)n1cc(CNCCOc2ccc(Br)cc2C(F)(F)F)cn1 ZINC000479947315 895301237 /nfs/dbraw/zinc/30/12/37/895301237.db2.gz FEVCOBXGIURAFL-UHFFFAOYSA-N 0 3 406.246 4.414 20 0 HIADHN C[C@]12CC3CC(C(=O)NCc4ccccc4CN4CCC(O)CC4)(C1)C[C@@](C)(C3)C2 ZINC000479987150 895340982 /nfs/dbraw/zinc/34/09/82/895340982.db2.gz NKBGLNCSSFARKP-JZHSQQRGSA-N 0 3 410.602 4.256 20 0 HIADHN CN(C)Cc1cccc(NC(=O)N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2)c1 ZINC000480018354 895368047 /nfs/dbraw/zinc/36/80/47/895368047.db2.gz LGYSVLBBIYKLCI-QGZVFWFLSA-N 0 3 406.452 4.167 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2ccc(C3CCC3)cc2)cc1)[C@@H]1CCCN(C)C1 ZINC000480025177 895374128 /nfs/dbraw/zinc/37/41/28/895374128.db2.gz XEFHRCVNSIGXTE-HSZRJFAPSA-N 0 3 405.542 4.373 20 0 HIADHN C[C@@H](NC(=O)Nc1cc(C(C)(C)C)nn1-c1ccccn1)[C@@H](c1ccccc1)N(C)C ZINC000480044683 895393744 /nfs/dbraw/zinc/39/37/44/895393744.db2.gz JPNMOCLOJBXBIZ-VGSWGCGISA-N 0 3 420.561 4.378 20 0 HIADHN CC[C@H](c1ccccc1)[C@@H]1CCCN1CC(=O)NCC(=O)Nc1c(C)cc(C)cc1C ZINC000480078689 895433484 /nfs/dbraw/zinc/43/34/84/895433484.db2.gz ZEYVLBCREXEFNN-PKTZIBPZSA-N 0 3 421.585 4.325 20 0 HIADHN CCC(CC)[C@@H](CCN[C@@H]1CCS(=O)(=O)c2ccc(Br)cc21)OC ZINC000480167563 895557909 /nfs/dbraw/zinc/55/79/09/895557909.db2.gz DHRGECLWEWXRAY-IAGOWNOFSA-N 0 3 418.397 4.099 20 0 HIADHN Cc1cc(C)cc(CCN[C@H]2CCS(=O)(=O)c3ccc(Br)cc32)c1 ZINC000480173034 895565455 /nfs/dbraw/zinc/56/54/55/895565455.db2.gz XRFOWVFKKIQTBZ-SFHVURJKSA-N 0 3 408.361 4.117 20 0 HIADHN C[C@H](NCc1ccc(CN2C[C@@H](C)O[C@@H](C)C2)cc1)c1cccc(N2CCCC2=O)c1 ZINC000480225429 895629833 /nfs/dbraw/zinc/62/98/33/895629833.db2.gz KMHXIVIXGVPQMC-HBMCJLEFSA-N 0 3 421.585 4.273 20 0 HIADHN COc1ccc([C@H](C)NC[C@H](c2ccccc2Cl)N2CCOCC2)c(OC)c1 ZINC000480276104 895683078 /nfs/dbraw/zinc/68/30/78/895683078.db2.gz RWHFSSNMJABHPS-HRAATJIYSA-N 0 3 404.938 4.081 20 0 HIADHN C[C@H](NCc1ccc(NC(N)=O)cc1)c1cccc(OCc2cn3ccccc3n2)c1 ZINC000480311138 895714320 /nfs/dbraw/zinc/71/43/20/895714320.db2.gz ZDYOHOSVGKVMIK-KRWDZBQOSA-N 0 3 415.497 4.255 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)[C@@H]1C[C@H]1c1ccc(OC(F)(F)F)cc1 ZINC000480328422 895730642 /nfs/dbraw/zinc/73/06/42/895730642.db2.gz RDHSRTRYKSXINU-ZWKOTPCHSA-N 0 3 412.477 4.341 20 0 HIADHN FC(F)(F)c1ccc(CN2CC[C@@H](NCc3nccn3-c3ccccc3)C2)cc1 ZINC000480339920 895745147 /nfs/dbraw/zinc/74/51/47/895745147.db2.gz WMGXWBKUIDOKFA-LJQANCHMSA-N 0 3 400.448 4.255 20 0 HIADHN Brc1ccc(CN[C@@H]2CCN(c3ccc(Br)cc3)C2)o1 ZINC000480362069 895768556 /nfs/dbraw/zinc/76/85/56/895768556.db2.gz XTVKGWVVTFRIQH-GFCCVEGCSA-N 0 3 400.114 4.173 20 0 HIADHN CC[C@H](C)[C@H](NCc1ccc(N(C)CC)nc1)C(=O)Nc1cccc(N2CCCC2)c1 ZINC000480386172 895792391 /nfs/dbraw/zinc/79/23/91/895792391.db2.gz KYFAMXIDVAKEHQ-CYFREDJKSA-N 0 3 423.605 4.281 20 0 HIADHN CCOc1ccc([C@@H](C)NC(=O)CCCNCc2ccc(Br)o2)cc1 ZINC000480392660 895797754 /nfs/dbraw/zinc/79/77/54/895797754.db2.gz ZXHNFAYJMBUGKZ-CQSZACIVSA-N 0 3 409.324 4.188 20 0 HIADHN CCc1ccc([C@H](CNC(=O)[C@@H](C)c2c(C)nn(CC(F)(F)F)c2C)N(C)C)cc1 ZINC000480399489 895803488 /nfs/dbraw/zinc/80/34/88/895803488.db2.gz XFQIZCQVRZPJLM-LIRRHRJNSA-N 0 3 424.511 4.147 20 0 HIADHN C[C@H](N[C@H](CN1CCOCC1)c1ccccc1)c1ccc(F)c(Br)c1 ZINC000480446628 895835560 /nfs/dbraw/zinc/83/55/60/895835560.db2.gz LEYGYVNROJBMTH-MGPUTAFESA-N 0 3 407.327 4.312 20 0 HIADHN COC(=O)c1csc(-c2cccc(CNCc3cccc(OC(F)F)c3)c2)n1 ZINC000480462726 895847363 /nfs/dbraw/zinc/84/73/63/895847363.db2.gz CZWMCLKLVGKPIJ-UHFFFAOYSA-N 0 3 404.438 4.488 20 0 HIADHN CSc1nc(-c2ccc(F)cc2)nc(C)c1C(=O)NCCN(C)Cc1ccccc1 ZINC000480484708 895860480 /nfs/dbraw/zinc/86/04/80/895860480.db2.gz QMELRFVSDJUXKG-UHFFFAOYSA-N 0 3 424.545 4.175 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)c3cnc(Nc4ccc(Cl)cc4)c(Cl)c3)[C@@H]2C1 ZINC000480577591 895937229 /nfs/dbraw/zinc/93/72/29/895937229.db2.gz IPGAWLUZZDPEFG-FZKQIMNGSA-N 0 3 405.329 4.298 20 0 HIADHN CN(C)CCN(C[C@H]1CCCO1)C(=O)c1csc(-c2cccc3ccccc32)n1 ZINC000480598557 895960539 /nfs/dbraw/zinc/96/05/39/895960539.db2.gz TZHCANAUWBLMAE-GOSISDBHSA-N 0 3 409.555 4.146 20 0 HIADHN CN1CCN(C(=O)c2ccc(CN[C@@H]3CCSc4c(Cl)cccc43)cc2)CC1 ZINC000480603304 895967693 /nfs/dbraw/zinc/96/76/93/895967693.db2.gz CAKIVIVKNQCSSS-HXUWFJFHSA-N 0 3 415.990 4.054 20 0 HIADHN CCCCCOc1ccc([C@H](C)NCc2ccc(C(=O)N3CCN(C)CC3)cc2)cc1 ZINC000480605625 895970083 /nfs/dbraw/zinc/97/00/83/895970083.db2.gz XHCKPWRSEKJGQX-NRFANRHFSA-N 0 3 423.601 4.494 20 0 HIADHN CC(C)n1cc([C@@H](C)NC[C@H](c2c(F)cccc2Cl)N2CCO[C@H](C)C2)cn1 ZINC000480611008 895976909 /nfs/dbraw/zinc/97/69/09/895976909.db2.gz KAXISKPJJWQCNE-JXXFODFXSA-N 0 3 408.949 4.369 20 0 HIADHN CCOc1ccc([C@H](CC)NCc2ccc(N3CCO[C@@H](C)C3)nc2)cc1OCC ZINC000480627715 895995727 /nfs/dbraw/zinc/99/57/27/895995727.db2.gz UQCHKQQWBJWEKS-RXVVDRJESA-N 0 3 413.562 4.345 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@H](C)NCc2ccc(OCC3CC3)cc2)cc1 ZINC000480639926 896009235 /nfs/dbraw/zinc/00/92/35/896009235.db2.gz UJIAKZRIBUAMEU-SFHVURJKSA-N 0 3 416.587 4.357 20 0 HIADHN COCCC1(CNC(=O)Nc2ccc(CCN3CCSCC3)cc2)CCCCC1 ZINC000480638782 896009463 /nfs/dbraw/zinc/00/94/63/896009463.db2.gz SJUQJHHWWRZCIL-UHFFFAOYSA-N 0 3 419.635 4.386 20 0 HIADHN Clc1sc(CNCc2ccc(CN3CCOCC3)cc2)cc1Br ZINC000480675786 896038845 /nfs/dbraw/zinc/03/88/45/896038845.db2.gz XYIIHAFWHGZAPY-UHFFFAOYSA-N 0 3 415.784 4.286 20 0 HIADHN C[C@@H](NCc1ccc(N2CCCS2(=O)=O)c(F)c1)c1cccc(C(F)(F)F)c1 ZINC000480690540 896052090 /nfs/dbraw/zinc/05/20/90/896052090.db2.gz ANPZVHYEDKKGSP-CYBMUJFWSA-N 0 3 416.440 4.235 20 0 HIADHN Cc1ccc(I)cc1NC1CCN(Cc2ccncc2)CC1 ZINC000480699167 896060589 /nfs/dbraw/zinc/06/05/89/896060589.db2.gz ODMOOOKOAIZIQW-UHFFFAOYSA-N 0 3 407.299 4.071 20 0 HIADHN COCCOc1ccc([C@H](C)N[C@@H](C)c2ccc3c(c2)C(C)(C)C(=O)N3)cc1OC ZINC000480719109 896079133 /nfs/dbraw/zinc/07/91/33/896079133.db2.gz PGURKSXQDGHLJX-HOTGVXAUSA-N 0 3 412.530 4.362 20 0 HIADHN CS(=O)(=O)CCCCCN[C@@H](c1ccc(F)cc1)c1cnc2ccccc2c1 ZINC000480742556 896105157 /nfs/dbraw/zinc/10/51/57/896105157.db2.gz CKFIUJKUNPPKCI-QFIPXVFZSA-N 0 3 400.519 4.268 20 0 HIADHN COCCOc1ccc(CN[C@@H]2CCCOc3cc(Br)ccc32)cc1 ZINC000480764830 896127179 /nfs/dbraw/zinc/12/71/79/896127179.db2.gz XOWPHXSCWWHOKI-LJQANCHMSA-N 0 3 406.320 4.478 20 0 HIADHN CCCNC(=O)CN1CCC(N[C@@H](C)c2ccc(Cl)c(Cl)c2Cl)CC1 ZINC000480765525 896128820 /nfs/dbraw/zinc/12/88/20/896128820.db2.gz AGUIGYIWVJFYMT-LBPRGKRZSA-N 0 3 406.785 4.288 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)N[C@H](c1cncc(Br)c1)C1CC1 ZINC000505372302 914036664 /nfs/dbraw/zinc/03/66/64/914036664.db2.gz IRBDIZMRWQATLC-IBGZPJMESA-N 0 3 423.399 4.203 20 0 HIADHN C[C@H](NC[C@@H](O)CN1CCc2ccccc2C1)c1cc(Cl)ccc1OC(F)F ZINC000480785511 896150257 /nfs/dbraw/zinc/15/02/57/896150257.db2.gz LFUJHHNKMUVVJW-KBXCAEBGSA-N 0 3 410.892 4.011 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)CSc3nccc4ccccc43)cc2)CC1 ZINC000480816319 896188363 /nfs/dbraw/zinc/18/83/63/896188363.db2.gz IMHMTTLBBUZRPE-UHFFFAOYSA-N 0 3 420.582 4.103 20 0 HIADHN COc1cc([C@@H](C)NCc2ccc(NC(=O)NC(C)C)cc2)cc(OC)c1OC ZINC000480885177 896240878 /nfs/dbraw/zinc/24/08/78/896240878.db2.gz VIAVBRGAPBQTPN-OAHLLOKOSA-N 0 3 401.507 4.093 20 0 HIADHN CC[C@H](NCc1cccc(NC(=O)c2ccccn2)c1)c1ccc2c(c1)OCCO2 ZINC000480887221 896243936 /nfs/dbraw/zinc/24/39/36/896243936.db2.gz DOOWOTSCZGOFFI-FQEVSTJZSA-N 0 3 403.482 4.346 20 0 HIADHN CC(C)Cc1ccc([C@@H](C)NCc2cccc(NC(=O)CCN3CCOCC3)c2)cc1 ZINC000480893548 896250564 /nfs/dbraw/zinc/25/05/64/896250564.db2.gz CMICVRNEPWIOKD-OAQYLSRUSA-N 0 3 423.601 4.397 20 0 HIADHN C[C@H](NCc1cccc(NC(=O)Cn2cccn2)c1)c1ccc(-c2ccncc2)cc1 ZINC000480896286 896252548 /nfs/dbraw/zinc/25/25/48/896252548.db2.gz IVFZPEVGSKFSAM-IBGZPJMESA-N 0 3 411.509 4.435 20 0 HIADHN C[C@H](NCc1cccc(COc2ccccc2)c1)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000480913783 896271507 /nfs/dbraw/zinc/27/15/07/896271507.db2.gz PJYITAQGFFAREQ-IBGZPJMESA-N 0 3 424.566 4.367 20 0 HIADHN Cc1nc(-c2cccnc2)sc1[C@@H](C)NCc1ccc(CN2CCCC2=O)cc1 ZINC000480913846 896272641 /nfs/dbraw/zinc/27/26/41/896272641.db2.gz VUCHZHLFSNNMDM-MRXNPFEDSA-N 0 3 406.555 4.487 20 0 HIADHN COc1ccc2oc([C@H](C)NCCCS(=O)(=O)Cc3ccccc3)c(C)c2c1 ZINC000480923351 896280604 /nfs/dbraw/zinc/28/06/04/896280604.db2.gz ZMWPIHZPUAVVGJ-KRWDZBQOSA-N 0 3 401.528 4.406 20 0 HIADHN CCS[C@H]1CCCCN(CC(=O)N2CCC[C@@H]2c2ccc3c(c2)OCCCO3)C1 ZINC000481078267 896397680 /nfs/dbraw/zinc/39/76/80/896397680.db2.gz QWIRCSBYUBPQQA-VQTJNVASSA-N 0 3 418.603 4.119 20 0 HIADHN CC(=O)N[C@H](C)C1CCN(Cc2ccc(-c3ccc(Br)cc3)o2)CC1 ZINC000481154555 896487475 /nfs/dbraw/zinc/48/74/75/896487475.db2.gz MMRMRMXLYBIZAX-CQSZACIVSA-N 0 3 405.336 4.446 20 0 HIADHN C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1NCc1nc2c3ccccc3oc2c(=O)[n-]1 ZINC000481189560 896537909 /nfs/dbraw/zinc/53/79/09/896537909.db2.gz KHFHDSNLVWYUDL-APWZRJJASA-N 0 3 402.498 4.082 20 0 HIADHN C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NCc1nc2c3ccccc3oc2c(=O)[n-]1 ZINC000481189560 896537928 /nfs/dbraw/zinc/53/79/28/896537928.db2.gz KHFHDSNLVWYUDL-APWZRJJASA-N 0 3 402.498 4.082 20 0 HIADHN C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1NCc1nc2c3ccccc3oc2c(=O)[n-]1 ZINC000481189562 896539541 /nfs/dbraw/zinc/53/95/41/896539541.db2.gz KHFHDSNLVWYUDL-QFBILLFUSA-N 0 3 402.498 4.082 20 0 HIADHN C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1NCc1nc2c3ccccc3oc2c(=O)[n-]1 ZINC000481189562 896539562 /nfs/dbraw/zinc/53/95/62/896539562.db2.gz KHFHDSNLVWYUDL-QFBILLFUSA-N 0 3 402.498 4.082 20 0 HIADHN COc1cc([C@H](C)N[C@H](C)c2ccc(Br)s2)ccc1OCCO ZINC000481191280 896540819 /nfs/dbraw/zinc/54/08/19/896540819.db2.gz QMDPYUZHYHNTFO-NWDGAFQWSA-N 0 3 400.338 4.302 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)NCc2cc(-c3ccccc3)no2)N(C)C)cc1 ZINC000481224251 896576834 /nfs/dbraw/zinc/57/68/34/896576834.db2.gz GWKIUWNRBUNLQM-QHCPKHFHSA-N 0 3 422.529 4.231 20 0 HIADHN Cc1nc(-c2cc([C@@H](C)NCc3cccnc3N3CCN(C)CC3)cs2)cs1 ZINC000481238476 896588799 /nfs/dbraw/zinc/58/87/99/896588799.db2.gz ZTEZNOKRLGOSFG-OAHLLOKOSA-N 0 3 413.616 4.178 20 0 HIADHN Cc1c([C@H](C)NCCCS(=O)(=O)c2ccccc2)cnn1-c1cc(C)ccc1C ZINC000481242678 896594328 /nfs/dbraw/zinc/59/43/28/896594328.db2.gz PXMYQWWFPHMDIQ-IBGZPJMESA-N 0 3 411.571 4.312 20 0 HIADHN COc1cccc([C@H](CNC(=O)Nc2ccc(OCC(F)F)cc2)N2CCCC2)c1 ZINC000481269624 896618267 /nfs/dbraw/zinc/61/82/67/896618267.db2.gz RXNLYVHWFYLCIS-FQEVSTJZSA-N 0 3 419.472 4.298 20 0 HIADHN COc1cc2c(cc1OC)CN(C(=O)CN[C@@H](CC1CCC1)c1ccccc1)CC2 ZINC000481284352 896631940 /nfs/dbraw/zinc/63/19/40/896631940.db2.gz LPKONKNUZCCYFK-QFIPXVFZSA-N 0 3 408.542 4.110 20 0 HIADHN CN(C)C[C@@H](NC(=O)N[C@H](c1cccc(F)c1F)C(F)(F)F)c1ccc(F)cc1 ZINC000481291480 896636839 /nfs/dbraw/zinc/63/68/39/896636839.db2.gz XYSJSBHBBRAOFG-NVXWUHKLSA-N 0 3 419.369 4.309 20 0 HIADHN CN(C)CCN(C(=O)NCc1cnc(-c2ccc(Cl)cc2)s1)C1CCCC1 ZINC000505420959 914085745 /nfs/dbraw/zinc/08/57/45/914085745.db2.gz JUBYMAJRLKDHRF-UHFFFAOYSA-N 0 3 406.983 4.479 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(OCC(=O)NC2CC2)cc1)c1cnn(Cc2ccccc2)c1 ZINC000481309311 896656980 /nfs/dbraw/zinc/65/69/80/896656980.db2.gz OOQDRZFFSBDPBF-OALUTQOASA-N 0 3 418.541 4.001 20 0 HIADHN Cc1cc(C)n(-c2ccc(CN[C@@H](C)c3ccc(NC(=O)NC(C)C)cc3)cn2)n1 ZINC000481310937 896658147 /nfs/dbraw/zinc/65/81/47/896658147.db2.gz RKTYIYLLEOOAEE-SFHVURJKSA-N 0 3 406.534 4.265 20 0 HIADHN COc1ccc([C@@H](C)NCc2cccc(CN3CCOCC3)c2)cc1Br ZINC000481312414 896660029 /nfs/dbraw/zinc/66/00/29/896660029.db2.gz IHFRNSAUXWGSIG-MRXNPFEDSA-N 0 3 419.363 4.141 20 0 HIADHN Fc1ccc(N2CCN(c3cc(CN[C@H]4CCc5c4cccc5F)ccn3)CC2)cc1 ZINC000481316462 896667103 /nfs/dbraw/zinc/66/71/03/896667103.db2.gz HHNHPSMSMBYSCF-DEOSSOPVSA-N 0 3 420.507 4.464 20 0 HIADHN C[C@@H](NCc1ccc(N2CCc3ccccc3C2)nc1)c1ccc(-n2cncn2)cc1 ZINC000481317385 896669489 /nfs/dbraw/zinc/66/94/89/896669489.db2.gz IONPQMRMYREPPB-LJQANCHMSA-N 0 3 410.525 4.076 20 0 HIADHN CC[C@@H](NCc1ccc(S(=O)(=O)N2CCC[C@H](C)C2)cc1)c1cccc(OC)c1 ZINC000481318828 896669570 /nfs/dbraw/zinc/66/95/70/896669570.db2.gz KMYIYZHFIBIRDX-FDDCHVKYSA-N 0 3 416.587 4.357 20 0 HIADHN C[C@H](NCc1ccc(N2CCc3ccccc3C2)nc1)c1ccc([S@@](C)=O)cc1 ZINC000481323649 896677433 /nfs/dbraw/zinc/67/74/33/896677433.db2.gz OUSVATZYVUYGKR-RBSBEOHCSA-N 0 3 405.567 4.233 20 0 HIADHN CC(C)CN(CCCOc1ccc(S(C)(=O)=O)cc1)[C@H]1CCCc2cccnc21 ZINC000481323899 896678322 /nfs/dbraw/zinc/67/83/22/896678322.db2.gz XIDHFOLWLDWAGQ-QFIPXVFZSA-N 0 3 416.587 4.290 20 0 HIADHN CC[C@H](N[C@H](C)c1ccc2c(c1)C(C)(C)C(=O)N2)c1ccccc1OCC(=O)N(C)C ZINC000481339737 896705216 /nfs/dbraw/zinc/70/52/16/896705216.db2.gz RFUSDUUWDBWMAR-UZLBHIALSA-N 0 3 423.557 4.185 20 0 HIADHN Cc1nc(NC(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)ccc1Br ZINC000481364423 896747591 /nfs/dbraw/zinc/74/75/91/896747591.db2.gz BXUBTCNECBPQPO-OAHLLOKOSA-N 0 3 417.351 4.281 20 0 HIADHN CC[C@H]1[C@H](C)CCN1CC(=O)N(Cc1nnc(-c2ccccc2Cl)o1)C1CC1 ZINC000481374774 896768589 /nfs/dbraw/zinc/76/85/89/896768589.db2.gz OKMKPONLITVNRV-KDOFPFPSSA-N 0 3 402.926 4.001 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)Nc2c3c(nn2C(C)C)CCC3)N(C)C)cc1 ZINC000481383105 896781339 /nfs/dbraw/zinc/78/13/39/896781339.db2.gz QLFLXJWLISVFGE-OAQYLSRUSA-N 0 3 413.566 4.164 20 0 HIADHN Clc1cccc2c1OCCC[C@@H]2NCc1cccc(OCCN2CCOCC2)c1 ZINC000481412711 896817302 /nfs/dbraw/zinc/81/73/02/896817302.db2.gz JZXADDVFVAUYEP-QFIPXVFZSA-N 0 3 416.949 4.055 20 0 HIADHN CC(C)C[C@H](C)n1nccc1NC(=O)N(CCN(C)C)Cc1ccc(F)cc1F ZINC000481500109 896873480 /nfs/dbraw/zinc/87/34/80/896873480.db2.gz FKTQKEVNOSBXTH-INIZCTEOSA-N 0 3 407.509 4.364 20 0 HIADHN CC(C)Oc1cncc(C(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)c1 ZINC000481498941 896873542 /nfs/dbraw/zinc/87/35/42/896873542.db2.gz BCYNIJCSDNSHRJ-UHFFFAOYSA-N 0 3 409.452 4.092 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)c1ccnn1C1CCCC1 ZINC000481504875 896876612 /nfs/dbraw/zinc/87/66/12/896876612.db2.gz XTIKGLHCIVWCIF-UHFFFAOYSA-N 0 3 408.468 4.221 20 0 HIADHN Cc1nc(Cc2ccccc2)sc1[C@H](C)NC[C@@H](O)COc1ccc(F)cc1 ZINC000481534765 896895754 /nfs/dbraw/zinc/89/57/54/896895754.db2.gz NQNARMIXRFGVTD-HNAYVOBHSA-N 0 3 400.519 4.272 20 0 HIADHN C[C@H](NCc1cccc(CN2CCO[C@H](C)C2)c1)c1cnn(Cc2ccccc2)c1 ZINC000481550042 896917066 /nfs/dbraw/zinc/91/70/66/896917066.db2.gz ULCJVTSOSUUJOI-RTWAWAEBSA-N 0 3 404.558 4.003 20 0 HIADHN O[C@@H](CN[C@@H]1CCSc2ccc(F)cc21)COc1ccc(C(F)(F)F)cc1 ZINC000481565780 896944791 /nfs/dbraw/zinc/94/47/91/896944791.db2.gz QXUUBHANSCWGAC-WMLDXEAASA-N 0 3 401.425 4.411 20 0 HIADHN Cc1cc2cc([C@@H](C)NC[C@@H](O)COc3ccc4c(c3)CCC(=O)N4)oc2cc1C ZINC000481571156 896950397 /nfs/dbraw/zinc/95/03/97/896950397.db2.gz LWOLKARBNRIWSS-VQIMIIECSA-N 0 3 408.498 4.025 20 0 HIADHN O=C(NCc1ccncc1)Nc1cccc(CN[C@H](c2cccnc2)C2CCC2)c1 ZINC000481654912 897039163 /nfs/dbraw/zinc/03/91/63/897039163.db2.gz DIZMCDQYPUHBHQ-QHCPKHFHSA-N 0 3 401.514 4.429 20 0 HIADHN COc1ccc2[nH]cc(CC(=O)Nc3cc(C)cc(N4CCN(C(C)C)CC4)c3)c2c1 ZINC000481674654 897056595 /nfs/dbraw/zinc/05/65/95/897056595.db2.gz WQLXRLFDWYXPKP-UHFFFAOYSA-N 0 3 420.557 4.197 20 0 HIADHN COc1ccccc1SCC(=O)Nc1cc(C)cc(N2CCN(C(C)C)CC2)c1 ZINC000481675290 897058881 /nfs/dbraw/zinc/05/88/81/897058881.db2.gz WNKZZRUGUFBFHR-UHFFFAOYSA-N 0 3 413.587 4.265 20 0 HIADHN CN(C(=O)NCCc1cccc(OCCCc2ccccc2)c1)[C@@H]1CCN(C2CC2)C1 ZINC000481717343 897109957 /nfs/dbraw/zinc/10/99/57/897109957.db2.gz WNMPXWDKIBIHOF-XMMPIXPASA-N 0 3 421.585 4.119 20 0 HIADHN O=C(CCN1Cc2ccccc2C2(CC2)C1)Nc1ccc(Br)cc1F ZINC000481731937 897125442 /nfs/dbraw/zinc/12/54/42/897125442.db2.gz RFPJXDQFTGKENJ-UHFFFAOYSA-N 0 3 403.295 4.464 20 0 HIADHN C[C@@H](N[C@H]1CCCc2cc(OC(F)F)ccc21)c1cccc(NS(C)(=O)=O)c1 ZINC000481733552 897127231 /nfs/dbraw/zinc/12/72/31/897127231.db2.gz HYDOMGWAAFXXLJ-YJYMSZOUSA-N 0 3 410.486 4.388 20 0 HIADHN C[C@@H](NCc1cccc2cccnc21)c1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000481737457 897131670 /nfs/dbraw/zinc/13/16/70/897131670.db2.gz OQYIILYQMXWFAO-GOSISDBHSA-N 0 3 409.555 4.260 20 0 HIADHN COc1ccc([C@@H](C)N[C@H](C)c2ccc(S(=O)(=O)NCc3ccco3)cc2)cc1 ZINC000481738582 897133347 /nfs/dbraw/zinc/13/33/47/897133347.db2.gz QVIMZPTWZGXKFE-IAGOWNOFSA-N 0 3 414.527 4.179 20 0 HIADHN NC(=O)[C@H](Cc1ccc(C(F)(F)F)cc1)NC1CC(F)(c2cccc(Cl)c2)C1 ZINC000481750605 897141943 /nfs/dbraw/zinc/14/19/43/897141943.db2.gz ZIRKINJLYGTOJZ-HFCFLWKCSA-N 0 3 414.830 4.372 20 0 HIADHN C[C@@H](NC(=O)Nc1ccc2c(c1)CCC(=O)N2CC1CC1)[C@@H](c1ccccc1)N(C)C ZINC000481755816 897146400 /nfs/dbraw/zinc/14/64/00/897146400.db2.gz PQGFPLPYSCFLNJ-OSPHWJPCSA-N 0 3 420.557 4.189 20 0 HIADHN CC(C)C[C@@H]1OCCC[C@@H]1NCC(=O)Nc1ccc(Br)cc1Cl ZINC000481760756 897148469 /nfs/dbraw/zinc/14/84/69/897148469.db2.gz KSPDBCUKMVKZGL-HOTGVXAUSA-N 0 3 403.748 4.224 20 0 HIADHN C[C@H](NC(=O)N(C)C1CCN(CCc2ccccn2)CC1)[C@@H](C)C1CCCCC1 ZINC000481783495 897165595 /nfs/dbraw/zinc/16/55/95/897165595.db2.gz GEZSHFJLJRWJAF-UXHICEINSA-N 0 3 400.611 4.335 20 0 HIADHN CC(C)[C@]1(C)C[C@H]1C(=O)NC1CCN(CCOc2ccc(Br)cc2)CC1 ZINC000481803109 897180821 /nfs/dbraw/zinc/18/08/21/897180821.db2.gz DYFOGQMLIDCRLK-FPOVZHCZSA-N 0 3 423.395 4.091 20 0 HIADHN O=C(COc1ccccc1CNC1CC(F)(c2cccc(Cl)c2)C1)N1CCCC1 ZINC000481816637 897189498 /nfs/dbraw/zinc/18/94/98/897189498.db2.gz PPZMOEIUTBYJSG-UHFFFAOYSA-N 0 3 416.924 4.458 20 0 HIADHN Cc1cc(C)c(S(=O)(=O)[N-]c2ccccc2N2CCC(C[NH+](C)C)CC2)c(C)c1 ZINC000481839373 897205742 /nfs/dbraw/zinc/20/57/42/897205742.db2.gz JRVIFYNCEBLUMA-UHFFFAOYSA-N 0 3 415.603 4.191 20 0 HIADHN O=C(Nc1ccccc1)c1ccc(CN2CCC(c3nnc4n3CCCC4)CC2)cc1 ZINC000481841854 897207600 /nfs/dbraw/zinc/20/76/00/897207600.db2.gz NWEOJOFFJIPDET-UHFFFAOYSA-N 0 3 415.541 4.246 20 0 HIADHN COc1ccc(-c2nnc(NC(=O)N[C@@H]3CCN([C@H](C)c4ccccc4)C3)s2)cc1 ZINC000481974492 897367883 /nfs/dbraw/zinc/36/78/83/897367883.db2.gz SUHPJYQSUQJRPK-CRAIPNDOSA-N 0 3 423.542 4.171 20 0 HIADHN COC(=O)c1ccccc1-c1ccc(CNc2ccccc2CN2CCC(O)CC2)o1 ZINC000481978885 897373093 /nfs/dbraw/zinc/37/30/93/897373093.db2.gz FQLYACQDHBQIOK-UHFFFAOYSA-N 0 3 420.509 4.302 20 0 HIADHN COC(=O)c1ccccc1-c1ccc(CN2CCC(C(=O)N[C@H](C)C(C)C)CC2)o1 ZINC000481983324 897376890 /nfs/dbraw/zinc/37/68/90/897376890.db2.gz KCASMIZNLPVIIA-QGZVFWFLSA-N 0 3 412.530 4.106 20 0 HIADHN Cc1cn(-c2ccccc2)nc1C(=O)Nc1cc(C)cc(N2CCN(C(C)C)CC2)c1 ZINC000482022941 897428786 /nfs/dbraw/zinc/42/87/86/897428786.db2.gz VVSIXYXPMISFGG-UHFFFAOYSA-N 0 3 417.557 4.272 20 0 HIADHN COc1ccc2cc([C@@H](C)NCc3ccccc3N3CCN(C(C)=O)CC3)ccc2c1 ZINC000482033055 897444991 /nfs/dbraw/zinc/44/49/91/897444991.db2.gz NGBNFKCPVINMFT-LJQANCHMSA-N 0 3 417.553 4.368 20 0 HIADHN COC(=O)c1ccc(-c2ccc(CN[C@H]3CCN(c4ncccc4Cl)C3)o2)cc1 ZINC000482053403 897479291 /nfs/dbraw/zinc/47/92/91/897479291.db2.gz GGDXZVAXHFAEKY-KRWDZBQOSA-N 0 3 411.889 4.150 20 0 HIADHN Cc1cc(NC(=O)c2ncccc2C(F)(F)F)cc(N2CCN(C(C)C)CC2)c1 ZINC000482061275 897491195 /nfs/dbraw/zinc/49/11/95/897491195.db2.gz MPUJMRHZJGROCG-UHFFFAOYSA-N 0 3 406.452 4.192 20 0 HIADHN Cc1ccc(OCc2nc(CC(=O)N3CCN(C4CCCCC4)CC3)cs2)cc1 ZINC000482062618 897494341 /nfs/dbraw/zinc/49/43/41/897494341.db2.gz RWLGAEIRMSVRRW-UHFFFAOYSA-N 0 3 413.587 4.050 20 0 HIADHN Cc1ccc([C@@H](Cc2ccccc2Br)NCC(=O)NCC(F)F)cc1 ZINC000482069583 897504264 /nfs/dbraw/zinc/50/42/64/897504264.db2.gz NJZFTNGHEDMBLD-QGZVFWFLSA-N 0 3 411.290 4.012 20 0 HIADHN O=C(CCc1ncc(-c2ccccc2Cl)o1)N1CCN(C2CCCCC2)CC1 ZINC000482075544 897513306 /nfs/dbraw/zinc/51/33/06/897513306.db2.gz BXMKSAOYMZVSDE-UHFFFAOYSA-N 0 3 401.938 4.405 20 0 HIADHN CC[C@@H](C)n1ncc(NC(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)c1C ZINC000482100703 897547909 /nfs/dbraw/zinc/54/79/09/897547909.db2.gz IRBYYLDCHQKPTP-IERDGZPVSA-N 0 3 401.555 4.374 20 0 HIADHN CCOc1ccc([C@@H](C)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)cc1OCC ZINC000482106368 897555796 /nfs/dbraw/zinc/55/57/96/897555796.db2.gz AXHHAHGHTHNEMS-KNQAVFIVSA-N 0 3 410.558 4.368 20 0 HIADHN C[C@H](NCCC(=O)N1CCCCCC1)c1ccc(OC(F)F)cc1OC(F)F ZINC000482126478 897583086 /nfs/dbraw/zinc/58/30/86/897583086.db2.gz MXYWAAFDLHRSKN-ZDUSSCGKSA-N 0 3 406.420 4.333 20 0 HIADHN C[C@@H]1Cc2ccccc2N1Cc1ccoc1C(=O)NC[C@@H](c1ccccc1)N(C)C ZINC000482189893 897661068 /nfs/dbraw/zinc/66/10/68/897661068.db2.gz ADYLLHZYPMHXGM-JPYJTQIMSA-N 0 3 403.526 4.264 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)N[C@H](c1ccc(F)cc1)C(F)(F)F)c1ccco1 ZINC000482207866 897686892 /nfs/dbraw/zinc/68/68/92/897686892.db2.gz IRTYYUAREQGWBX-SRCQZFHVSA-N 0 3 401.404 4.451 20 0 HIADHN Cc1cn([C@@H](C)c2ccccc2)nc1NC(=O)N[C@@H](CN(C)C)c1ccc(F)cc1 ZINC000482229588 897710070 /nfs/dbraw/zinc/71/00/70/897710070.db2.gz FWWMZCNWAKNVCK-UWJYYQICSA-N 0 3 409.509 4.364 20 0 HIADHN COC(=O)c1ccc(Cl)c(CNC2CCN(Cc3ccc(F)c(F)c3)CC2)c1 ZINC000482239202 897720130 /nfs/dbraw/zinc/72/01/30/897720130.db2.gz GRTMRWISMOMHME-UHFFFAOYSA-N 0 3 408.876 4.159 20 0 HIADHN Cc1ccccc1-n1cc(C(=O)Nc2ccc(CCN3CCSCC3)cc2)cn1 ZINC000482284355 897778226 /nfs/dbraw/zinc/77/82/26/897778226.db2.gz GUCRYTVZTWQFRN-UHFFFAOYSA-N 0 3 406.555 4.024 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)c2ccc(-c3ccsc3)nc2C)c1 ZINC000482357052 897871776 /nfs/dbraw/zinc/87/17/76/897871776.db2.gz WWZIXWKGMZQCAI-UHFFFAOYSA-N 0 3 409.555 4.331 20 0 HIADHN O=C(N[C@H](c1cccc(F)c1F)C(F)(F)F)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000482377877 897904145 /nfs/dbraw/zinc/90/41/45/897904145.db2.gz PTKMIZJNERQEEQ-KBXCAEBGSA-N 0 3 413.390 4.142 20 0 HIADHN COC[C@H](C)Oc1ccc(Cl)cc1NC(=O)N[C@@H](CN(C)C)c1ccc(F)cc1 ZINC000482393866 897927173 /nfs/dbraw/zinc/92/71/73/897927173.db2.gz PKYXSLMRQLVMFF-LIRRHRJNSA-N 0 3 423.916 4.317 20 0 HIADHN Cc1c([C@H](C)N[C@H](C)Cc2ccc(O)cc2)nnn1-c1cccc(Br)c1 ZINC000482502460 898084513 /nfs/dbraw/zinc/08/45/13/898084513.db2.gz COLPWRPWELMXRO-KGLIPLIRSA-N 0 3 415.335 4.326 20 0 HIADHN COc1cc(CN2CCC([C@H](C)NC(C)=O)CC2)ccc1OCc1cccs1 ZINC000482531042 898117616 /nfs/dbraw/zinc/11/76/16/898117616.db2.gz PWBBHFMOZJGSTC-INIZCTEOSA-N 0 3 402.560 4.072 20 0 HIADHN NC(=O)[C@@H]1CCCN(Cc2ccccc2NC(=O)c2ccc(Oc3ccccc3)o2)C1 ZINC000482531086 898118265 /nfs/dbraw/zinc/11/82/65/898118265.db2.gz JKKOWXKQNXCIMG-GOSISDBHSA-N 0 3 419.481 4.022 20 0 HIADHN CC[C@@H](N[C@@H](C)c1cc(F)ccc1N1CCN(C)CC1)c1ccc(OC)c(OC)c1 ZINC000482536914 898123901 /nfs/dbraw/zinc/12/39/01/898123901.db2.gz QNPXJAWBUYHZPY-LAUBAEHRSA-N 0 3 415.553 4.397 20 0 HIADHN C[C@@H](N[C@@H](C)c1cc(F)ccc1N1CCN(C)CC1)c1cccc(N2CCCC2=O)c1 ZINC000482537550 898125511 /nfs/dbraw/zinc/12/55/11/898125511.db2.gz NTSQOGMXXRDCBM-MOPGFXCFSA-N 0 3 424.564 4.116 20 0 HIADHN COc1ccc(OC)c([C@@H](C)N[C@@H](C)c2cc(F)ccc2N2CCN(C)CC2)c1 ZINC000482553191 898143504 /nfs/dbraw/zinc/14/35/04/898143504.db2.gz DJMXHLCCXTVDNV-DLBZAZTESA-N 0 3 401.526 4.007 20 0 HIADHN COCCOc1ccc([C@H](C)N[C@H](C)c2cc(F)ccc2N2CCN(C)CC2)cc1 ZINC000482564870 898157824 /nfs/dbraw/zinc/15/78/24/898157824.db2.gz LXHJNKWRSACURB-RBUKOAKNSA-N 0 3 415.553 4.015 20 0 HIADHN CC[C@H](C)C(=O)Nc1cccc(CNC(=O)N[C@@H]2CCN(Cc3ccccc3)[C@H]2C)c1 ZINC000482583830 898180602 /nfs/dbraw/zinc/18/06/02/898180602.db2.gz UYKKGDOYXMMBIT-SFYKDHMMSA-N 0 3 422.573 4.133 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)c1cc(F)ccc1I ZINC000482605910 898206146 /nfs/dbraw/zinc/20/61/46/898206146.db2.gz GKXZUMCYFICFOD-UHFFFAOYSA-N 0 3 412.246 4.053 20 0 HIADHN CCCOc1cn(-c2ccccc2)nc1C(=O)N[C@H](CN1CCCC1)c1ccccc1 ZINC000482607199 898207093 /nfs/dbraw/zinc/20/70/93/898207093.db2.gz RFEOWDXERBJGKP-JOCHJYFZSA-N 0 3 418.541 4.228 20 0 HIADHN Cc1nccn1CCNCc1cn(-c2ccc(Br)cc2)nc1C(C)C ZINC000482608531 898208473 /nfs/dbraw/zinc/20/84/73/898208473.db2.gz TWNQNXVRANYVOT-UHFFFAOYSA-N 0 3 402.340 4.053 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)c1cccc(CS(=O)(=O)c2ccccc2)c1 ZINC000482609720 898210868 /nfs/dbraw/zinc/21/08/68/898210868.db2.gz AANMXVXDUMBAAV-UHFFFAOYSA-N 0 3 422.550 4.283 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)[C@H](C)Oc1ccc(F)cc1Br ZINC000482620354 898222329 /nfs/dbraw/zinc/22/23/29/898222329.db2.gz SVGFBZFYLDHSQL-ZDUSSCGKSA-N 0 3 409.299 4.364 20 0 HIADHN CC[C@H](C)[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)Nc1cc(CN(C)C)ccc1C ZINC000482627291 898230068 /nfs/dbraw/zinc/23/00/68/898230068.db2.gz GFFVAMAJAWVQCN-YCRPNKLZSA-N 0 3 415.965 4.493 20 0 HIADHN CN1C(=O)C[C@@H](NCc2cc(Cl)cc3cccnc32)[C@H]1c1ccc(F)c(F)c1 ZINC000482702032 898302190 /nfs/dbraw/zinc/30/21/90/898302190.db2.gz AOXTZIUYMRTERB-WIYYLYMNSA-N 0 3 401.844 4.228 20 0 HIADHN CCCCn1ncc(NC(=O)CCCN2CCN(c3ccccc3)CC2)c1C(C)C ZINC000482728931 898330308 /nfs/dbraw/zinc/33/03/08/898330308.db2.gz RJMUNWJMCSCHBU-UHFFFAOYSA-N 0 3 411.594 4.348 20 0 HIADHN CC(C)C[C@@H](C)Oc1cc(CN[C@@H](C)c2ccc(NS(C)(=O)=O)cc2)ccn1 ZINC000482888974 898505979 /nfs/dbraw/zinc/50/59/79/898505979.db2.gz NQKZEOQAYHJSAV-SJORKVTESA-N 0 3 405.564 4.117 20 0 HIADHN COc1ccc([C@@H](C)NCCC(=O)N(C)Cc2ccccc2Br)c(F)c1 ZINC000482892872 898511594 /nfs/dbraw/zinc/51/15/94/898511594.db2.gz VGDLGHUDKKBPJS-CQSZACIVSA-N 0 3 423.326 4.296 20 0 HIADHN C[C@@H](NC(=O)c1ccc(-c2noc(C(F)(F)F)n2)cc1)[C@H](c1ccccc1)N(C)C ZINC000505575032 914281390 /nfs/dbraw/zinc/28/13/90/914281390.db2.gz NVOSOVYXJKSFBT-CXAGYDPISA-N 0 3 418.419 4.177 20 0 HIADHN COc1ccc([C@H](C)N[C@H](Cc2ccccc2)[C@@H](O)C(F)F)cc1Br ZINC000483125885 898810924 /nfs/dbraw/zinc/81/09/24/898810924.db2.gz JWKNFPPZKLAJGW-BJOOFOGMSA-N 0 3 414.290 4.346 20 0 HIADHN C[C@@H](N[C@@H](CO)Cc1c[nH]c2ccccc12)c1ccccc1I ZINC000483142736 898821846 /nfs/dbraw/zinc/82/18/46/898821846.db2.gz MVIALBMUQUOFBF-UKRRQHHQSA-N 0 3 420.294 4.027 20 0 HIADHN CC[C@H]1CN(CCC(=O)Nc2ccc(Oc3ccccc3)cc2)C[C@@]2(CCOC2)O1 ZINC000483147709 898825052 /nfs/dbraw/zinc/82/50/52/898825052.db2.gz BKBJAPOXBBLVGR-GBXCKJPGSA-N 0 3 410.514 4.077 20 0 HIADHN CC(C)(C)[S@](=O)Cc1cccc(NC(=O)N2CCN(C3CCCCC3)CC2)c1 ZINC000483172171 898840252 /nfs/dbraw/zinc/84/02/52/898840252.db2.gz XHBIHFDTPWZRCL-MUUNZHRXSA-N 0 3 405.608 4.216 20 0 HIADHN Cc1[nH]c2ccc(Cl)cc2c1C(=O)Nc1cccc(CN2CCC(C(N)=O)CC2)c1 ZINC000483183643 898845655 /nfs/dbraw/zinc/84/56/55/898845655.db2.gz PGONJINXZVWEJI-UHFFFAOYSA-N 0 3 424.932 4.079 20 0 HIADHN COc1cnccc1N1CCN(CC(=O)Nc2c(C(C)C)cccc2C(C)C)CC1 ZINC000483190760 898849262 /nfs/dbraw/zinc/84/92/62/898849262.db2.gz CJZOPLLNXBPSKD-UHFFFAOYSA-N 0 3 410.562 4.098 20 0 HIADHN Cc1c([C@H](C)NCCNc2nccc(C(F)(F)F)n2)cnn1-c1cccc(Cl)c1 ZINC000483228005 898872190 /nfs/dbraw/zinc/87/21/90/898872190.db2.gz CXPKDBCOCRNRPO-LBPRGKRZSA-N 0 3 424.858 4.406 20 0 HIADHN C[C@@H](NCCNc1nccc(C(F)(F)F)n1)c1cc(Br)ccc1F ZINC000483230921 898874369 /nfs/dbraw/zinc/87/43/69/898874369.db2.gz MOKNDLDSBRPGAZ-SECBINFHSA-N 0 3 407.209 4.160 20 0 HIADHN CC1CCC(O)(CN[C@@H](CO)c2ccc(Br)cc2C(F)(F)F)CC1 ZINC000483250035 898891379 /nfs/dbraw/zinc/89/13/79/898891379.db2.gz LWQUDBNYNAOSAG-AJQRCPHMSA-N 0 3 410.274 4.032 20 0 HIADHN C[C@@H](NC(=O)c1cn(C)nc1-c1ccc(Cl)s1)[C@H](c1ccccc1)N(C)C ZINC000505585640 914294044 /nfs/dbraw/zinc/29/40/44/914294044.db2.gz GBGMGRPQMZZVEZ-BFUOFWGJSA-N 0 3 402.951 4.223 20 0 HIADHN OC[C@@H](NCCOc1ccccc1F)c1ccc(Br)cc1C(F)(F)F ZINC000483261394 898901920 /nfs/dbraw/zinc/90/19/20/898901920.db2.gz SFTJDXWRSQMNFS-OAHLLOKOSA-N 0 3 422.216 4.309 20 0 HIADHN Cc1ccc(NC(=O)NC[C@@H]2CCCN(Cc3ccc(N(C)C(C)C)nc3)C2)cc1 ZINC000483281987 898918458 /nfs/dbraw/zinc/91/84/58/898918458.db2.gz OUJQGWWKVYJYFO-FQEVSTJZSA-N 0 3 409.578 4.268 20 0 HIADHN CCCOc1ccc(C(C)(C)NCC(=O)Nc2ccnn2Cc2cccs2)cc1 ZINC000483281286 898918975 /nfs/dbraw/zinc/91/89/75/898918975.db2.gz BNWLXCTZYPZQCQ-UHFFFAOYSA-N 0 3 412.559 4.245 20 0 HIADHN COc1ccc(C[C@H](N[C@H]2CCC(=O)N(C)C2)c2cc(Cl)ccc2Cl)cc1 ZINC000483293333 898927765 /nfs/dbraw/zinc/92/77/65/898927765.db2.gz GOJBDAANSORJES-JXFKEZNVSA-N 0 3 407.341 4.496 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)Nc3cc(C(F)(F)F)ccc3Br)[C@@H]2C1 ZINC000483330827 898960507 /nfs/dbraw/zinc/96/05/07/898960507.db2.gz CGPNTFDMDJOZDS-QMTHXVAHSA-N 0 3 406.246 4.026 20 0 HIADHN CC1(C)CN(CCC(=O)Nc2ccccc2Oc2ccccc2)C[C@@]2(CCCOC2)O1 ZINC000483336622 898967108 /nfs/dbraw/zinc/96/71/08/898967108.db2.gz FRQSGUWHXFWZMJ-RUZDIDTESA-N 0 3 424.541 4.468 20 0 HIADHN CS[C@@H]1CN(C(=O)c2sc(-c3ccc(C)cc3C)nc2C)C[C@H]1N1CCCC1 ZINC000483391140 899025450 /nfs/dbraw/zinc/02/54/50/899025450.db2.gz DNTWGYSHLJOBMC-RTBURBONSA-N 0 3 415.628 4.387 20 0 HIADHN CS[C@H]1CN(C(=O)c2occc2CSc2ccccc2)C[C@H]1N1CCCC1 ZINC000483392946 899028176 /nfs/dbraw/zinc/02/81/76/899028176.db2.gz IVZWJKGEOLWAJF-MOPGFXCFSA-N 0 3 402.585 4.224 20 0 HIADHN CO[C@H](c1ccccc1Cl)[C@H](C)NC(=O)N(CCN(C)C)Cc1cccs1 ZINC000483415375 899044603 /nfs/dbraw/zinc/04/46/03/899044603.db2.gz WIQKHCHIGXOQGM-KXBFYZLASA-N 0 3 409.983 4.251 20 0 HIADHN CC(C)(O)C(C)(C)NCC(=O)Nc1nc(-c2ccc(Cl)cc2Cl)cs1 ZINC000505606868 914309866 /nfs/dbraw/zinc/30/98/66/914309866.db2.gz GXLAJCVWRQPTAE-UHFFFAOYSA-N 0 3 402.347 4.195 20 0 HIADHN Cc1cccc(-c2nn(Cc3ccccc3)cc2CN2CC[C@@H](N3CCCC3=O)C2)c1 ZINC000483442774 899078061 /nfs/dbraw/zinc/07/80/61/899078061.db2.gz VTDPCRMXDJEXDT-XMMPIXPASA-N 0 3 414.553 4.104 20 0 HIADHN CC(=O)c1cc(C(=O)Nc2c(C)cnn2[C@@H]2CCN(Cc3ccccc3)C2)cs1 ZINC000483467044 899108761 /nfs/dbraw/zinc/10/87/61/899108761.db2.gz GXFGTEIZMULASR-LJQANCHMSA-N 0 3 408.527 4.155 20 0 HIADHN CCCc1nc(C)c(C(=O)Nc2c(C)cnn2[C@H]2CCN(Cc3ccccc3)C2)o1 ZINC000483469159 899112788 /nfs/dbraw/zinc/11/27/88/899112788.db2.gz MDBIFQFYXVLWKZ-IBGZPJMESA-N 0 3 407.518 4.140 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)Nc1ccc(OCC(F)F)cc1 ZINC000483540829 899202342 /nfs/dbraw/zinc/20/23/42/899202342.db2.gz RYBKTXGNJAOXFR-UHFFFAOYSA-N 0 3 413.415 4.204 20 0 HIADHN Cc1ccc(C(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)cc1NC(=O)NC(C)(C)C ZINC000505627137 914325947 /nfs/dbraw/zinc/32/59/47/914325947.db2.gz BDHAVRCICVVXLN-DYESRHJHSA-N 0 3 410.562 4.336 20 0 HIADHN CN(CCCc1cc(-c2ccc(F)cc2)n(C)n1)[C@H]1CCc2ccccc2NC1=O ZINC000483572338 899225532 /nfs/dbraw/zinc/22/55/32/899225532.db2.gz XKPQFTZFGOPGGK-QFIPXVFZSA-N 0 3 406.505 4.044 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1ccc(C)c(C(=O)N(C)C(C)C)c1)c1ccco1 ZINC000483571910 899225608 /nfs/dbraw/zinc/22/56/08/899225608.db2.gz DBPXZZSBTTYLAF-FXAWDEMLSA-N 0 3 414.550 4.319 20 0 HIADHN C[C@H](NC(=O)Nc1cc(-c2cc(F)cc(F)c2)nn1C)[C@H](c1ccccc1)N(C)C ZINC000483576942 899230070 /nfs/dbraw/zinc/23/00/70/899230070.db2.gz RYOPHTKVMAUGQM-LHSJRXKWSA-N 0 3 413.472 4.178 20 0 HIADHN O=C(NCc1nc(C2CC2)cs1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000483628284 899281996 /nfs/dbraw/zinc/28/19/96/899281996.db2.gz YGNTWFIZKLCDLW-LJQANCHMSA-N 0 3 409.477 4.091 20 0 HIADHN CC(C)C(=O)Nc1ccc(Cl)c(C(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)c1 ZINC000505633736 914332808 /nfs/dbraw/zinc/33/28/08/914332808.db2.gz LONZHJQOVDPHHC-YWZLYKJASA-N 0 3 401.938 4.356 20 0 HIADHN Cc1ccc(-c2nc3c(s2)[C@@H](NCc2cccc(OCC(N)=O)c2)CCC3)cc1 ZINC000483637561 899292092 /nfs/dbraw/zinc/29/20/92/899292092.db2.gz HUOYNKYAZZFWDY-IBGZPJMESA-N 0 3 407.539 4.150 20 0 HIADHN CC(C)[C@@H](CC(=O)Nc1ccccc1CN1CCC[C@@H](C(N)=O)C1)c1ccccc1 ZINC000483638397 899293014 /nfs/dbraw/zinc/29/30/14/899293014.db2.gz VZWMKQNDNIMCHJ-FGZHOGPDSA-N 0 3 407.558 4.152 20 0 HIADHN COCCN(C[C@H]1CC=CCC1)C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000483691298 899349975 /nfs/dbraw/zinc/34/99/75/899349975.db2.gz ZIXNACBQYCXVPF-NRFANRHFSA-N 0 3 417.619 4.115 20 0 HIADHN Cc1ccc(C(=O)CCCC(=O)N2CCC(N3CCc4ccccc4C3)CC2)cc1 ZINC000483705181 899360785 /nfs/dbraw/zinc/36/07/85/899360785.db2.gz KHYXMQWNNBXKLP-UHFFFAOYSA-N 0 3 404.554 4.397 20 0 HIADHN Cc1cncn1C1CCN(C(=O)c2cccc(CN(C)Cc3ccccc3)c2)CC1 ZINC000505654989 914353842 /nfs/dbraw/zinc/35/38/42/914353842.db2.gz IVYHTZXROBRUSA-UHFFFAOYSA-N 0 3 402.542 4.301 20 0 HIADHN CC[C@@H]1Oc2cc([C@H](C)N[C@@H](C)c3cccc(N4CCOCC4)c3)ccc2NC1=O ZINC000483858721 899542259 /nfs/dbraw/zinc/54/22/59/899542259.db2.gz MJQSDRMMFBBGKM-HOIFWPIMSA-N 0 3 409.530 4.045 20 0 HIADHN CC[C@@H](NCc1cc(N(C)C)nc2ccccc12)c1ccccc1OCC(=O)N(C)C ZINC000483864744 899546651 /nfs/dbraw/zinc/54/66/51/899546651.db2.gz DWUZKTVOZSUZQG-OAQYLSRUSA-N 0 3 420.557 4.009 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N[C@H]1CCc2c1ccc(Cl)c2Cl ZINC000483931401 899590436 /nfs/dbraw/zinc/59/04/36/899590436.db2.gz SFBFJRPFQGOBGE-KRWDZBQOSA-N 0 3 420.340 4.106 20 0 HIADHN COc1cccc(Cn2ccc3ccc(NC(=O)N4CC[C@@H](N5CC=CC5)C4)cc32)c1 ZINC000483987510 899629233 /nfs/dbraw/zinc/62/92/33/899629233.db2.gz YPBINYDXYQBGQW-JOCHJYFZSA-N 0 3 416.525 4.176 20 0 HIADHN COc1cccc([C@@H](CNC(=O)Nc2cccc(N3CCCC3)c2)N2CCCC2)c1 ZINC000505682628 914374061 /nfs/dbraw/zinc/37/40/61/914374061.db2.gz GLPGVDQJZPKLJB-HSZRJFAPSA-N 0 3 408.546 4.254 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)NC[C@@H]1CCCC[C@@H]1C(F)(F)F ZINC000484047680 899679687 /nfs/dbraw/zinc/67/96/87/899679687.db2.gz XAQQIZTVPRELOA-WMZOPIPTSA-N 0 3 403.464 4.268 20 0 HIADHN Cc1cccc(C(=O)N2CCN(C3CCCCC3)CC2)c1NC(=O)c1ccccc1F ZINC000484123489 899745654 /nfs/dbraw/zinc/74/56/54/899745654.db2.gz QKAFIRWIPTUCIL-UHFFFAOYSA-N 0 3 423.532 4.477 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N(C)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000484162258 899782216 /nfs/dbraw/zinc/78/22/16/899782216.db2.gz JXNHSFZTDYTKMQ-OAHLLOKOSA-N 0 3 421.463 4.234 20 0 HIADHN Cc1noc([C@@H]2CCCCN2C(=O)NC[C@@H](c2ccccc2)N2CCC(C)CC2)n1 ZINC000484165373 899785547 /nfs/dbraw/zinc/78/55/47/899785547.db2.gz SMPMVTZTWHGFCW-SFTDATJTSA-N 0 3 411.550 4.088 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)Nc2ccc(C(=O)N[C@@H](C)CC)cc2)N(C)C)cc1 ZINC000505689808 914379337 /nfs/dbraw/zinc/37/93/37/914379337.db2.gz JPGLSPSNYCDWLM-HTAPYJJXSA-N 0 3 410.562 4.202 20 0 HIADHN CCC(CC)[C@H](NC(=O)C(=O)Nc1cc(CN(C)C)ccc1C)c1cccs1 ZINC000484190765 899804903 /nfs/dbraw/zinc/80/49/03/899804903.db2.gz JUUBBKVLJAYIKP-FQEVSTJZSA-N 0 3 401.576 4.350 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N[C@H](c1ccc(Cl)cc1)C(C)C ZINC000484192149 899805839 /nfs/dbraw/zinc/80/58/39/899805839.db2.gz QRRMVZHMZWXEMO-FQEVSTJZSA-N 0 3 401.938 4.162 20 0 HIADHN CSc1cccc(N(C(=O)[C@@H]2Cc3cc(Cl)ccc3O2)C2CCN(C)CC2)c1 ZINC000484278607 899847185 /nfs/dbraw/zinc/84/71/85/899847185.db2.gz DVOUQSQPGCXRBA-NRFANRHFSA-N 0 3 416.974 4.493 20 0 HIADHN C[C@@H](NC(=O)NCc1cccc(NC(=O)C2CCCC2)c1)[C@H](c1ccccc1)N(C)C ZINC000484277861 899847426 /nfs/dbraw/zinc/84/74/26/899847426.db2.gz BYUSGOIOEMDHQR-WZONZLPQSA-N 0 3 422.573 4.306 20 0 HIADHN CSc1cccc(N(C(=O)[C@H](C)Oc2cccc(F)c2)C2CCN(C)CC2)c1 ZINC000484292192 899856434 /nfs/dbraw/zinc/85/64/34/899856434.db2.gz GLAOIEHDRRGMIR-INIZCTEOSA-N 0 3 402.535 4.442 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N[C@@H](c1ccc(F)cc1)[C@H]1CCCO1)c1ccco1 ZINC000484293494 899857472 /nfs/dbraw/zinc/85/74/72/899857472.db2.gz HRVVWPALZVJMLF-SKRQURTPSA-N 0 3 403.498 4.067 20 0 HIADHN Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)N[C@@H](C(=O)N1CCOCC1)C(C)C ZINC000484302180 899863986 /nfs/dbraw/zinc/86/39/86/899863986.db2.gz PCDZJMIMUKXETM-KBXCAEBGSA-N 0 3 421.994 4.306 20 0 HIADHN CC(C)[C@](C)(NCc1cc(=O)n2ccccc2n1)c1ccc(Br)cc1 ZINC000484329110 899882921 /nfs/dbraw/zinc/88/29/21/899882921.db2.gz KPMLWPUHFHWLKE-FQEVSTJZSA-N 0 3 400.320 4.118 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2c(C)noc2-c2ccccc2)c1 ZINC000484351707 899900540 /nfs/dbraw/zinc/90/05/40/899900540.db2.gz JQSFSSDFASJZEW-UHFFFAOYSA-N 0 3 408.502 4.254 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2ccnn2[C@H](C)CC(C)C)c1 ZINC000484356007 899904358 /nfs/dbraw/zinc/90/43/58/899904358.db2.gz BASWWFUMRZGYBT-GOSISDBHSA-N 0 3 401.555 4.095 20 0 HIADHN CCOc1ccccc1OCC(=O)N(c1cccc(SC)c1)C1CCN(C)CC1 ZINC000484405523 899928843 /nfs/dbraw/zinc/92/88/43/899928843.db2.gz OUGDSUIRJQZCAC-UHFFFAOYSA-N 0 3 414.571 4.313 20 0 HIADHN Cc1nn(-c2ccc(Br)cc2)cc1C(=O)Nc1cccc(CN(C)C)c1 ZINC000484413635 899933190 /nfs/dbraw/zinc/93/31/90/899933190.db2.gz FTHFHEVHXQDYPM-UHFFFAOYSA-N 0 3 413.319 4.257 20 0 HIADHN COc1ccc2c(c1)[C@H](NCCC(=O)Nc1cc(Cl)ccc1OC)CCCO2 ZINC000484483032 899975924 /nfs/dbraw/zinc/97/59/24/899975924.db2.gz LDJUTMIHKVDFGK-QGZVFWFLSA-N 0 3 404.894 4.189 20 0 HIADHN COC[C@H](N[C@H]1CCN(c2cc(OC)cc(OC)c2)C1)c1cccc(C(F)(F)F)c1 ZINC000484485108 899976884 /nfs/dbraw/zinc/97/68/84/899976884.db2.gz IVVJTZHEHPSOTR-UWJYYQICSA-N 0 3 424.463 4.279 20 0 HIADHN COc1ccc(OC)c([C@@H](C)NCCC(=O)Nc2cc(C)c(Cl)cc2OC)c1 ZINC000484485956 899978833 /nfs/dbraw/zinc/97/88/33/899978833.db2.gz QGFWZCLSKHIJDY-CQSZACIVSA-N 0 3 406.910 4.354 20 0 HIADHN Cc1ccc(OC(F)F)c([C@@H](C)N[C@@H]2CCN(C(=O)CCc3ccccc3)C2)c1 ZINC000484502095 899992179 /nfs/dbraw/zinc/99/21/79/899992179.db2.gz JXCHHPXZTZGFFA-IEBWSBKVSA-N 0 3 402.485 4.481 20 0 HIADHN C[C@H](O)C[C@@H](CN[C@@H](C)c1ccccc1I)c1ccccc1 ZINC000484502899 899993463 /nfs/dbraw/zinc/99/34/63/899993463.db2.gz QJBWTNRMYYSRSW-ZOBUZTSGSA-N 0 3 409.311 4.497 20 0 HIADHN OCC[C@@]1(CN[C@H](Cc2ccccc2F)c2ccccc2Br)CCOC1 ZINC000484510155 900001998 /nfs/dbraw/zinc/00/19/98/900001998.db2.gz VSQWVEPLCAEZTQ-RTWAWAEBSA-N 0 3 422.338 4.251 20 0 HIADHN CC(C)([C@@H](NCC[S@](=O)c1ccccc1)c1ccc(F)c(F)c1)N1CCCC1 ZINC000484528844 900016095 /nfs/dbraw/zinc/01/60/95/900016095.db2.gz CQUQVJLDHLDWDY-KMRXNPHXSA-N 0 3 406.542 4.278 20 0 HIADHN CN(C)C(=O)c1cccc(CN[C@H](c2ccc(F)c(F)c2)C(C)(C)N2CCCC2)c1 ZINC000484540014 900023759 /nfs/dbraw/zinc/02/37/59/900023759.db2.gz VSGFLSSYIZOSST-JOCHJYFZSA-N 0 3 415.528 4.372 20 0 HIADHN COc1cc([C@H](C)N[C@H](C)c2cccc(N3CCCC3)c2)ccc1S(C)(=O)=O ZINC000484598532 900059712 /nfs/dbraw/zinc/05/97/12/900059712.db2.gz LKPYBCRNIVOBFG-SJORKVTESA-N 0 3 402.560 4.111 20 0 HIADHN CCCOc1ccc(O[C@@H]2CCCC[C@H]2NCc2cc(=O)n3ccsc3n2)cc1 ZINC000484621542 900074915 /nfs/dbraw/zinc/07/49/15/900074915.db2.gz ACHNQGPORQBQMY-WOJBJXKFSA-N 0 3 413.543 4.025 20 0 HIADHN CCc1nnc(C2CCN([C@H](C(=O)Nc3ccc(F)cc3)c3ccccc3)CC2)[nH]1 ZINC000484717336 900148998 /nfs/dbraw/zinc/14/89/98/900148998.db2.gz SKGHHVYDIDNURQ-NRFANRHFSA-N 0 3 407.493 4.066 20 0 HIADHN C[C@H](NCC(=O)NC1CCOCC1)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 ZINC000484785686 900193301 /nfs/dbraw/zinc/19/33/01/900193301.db2.gz GDGLXHWWVJKKGL-ZDUSSCGKSA-N 0 3 412.477 4.380 20 0 HIADHN CCc1c(NC(=O)N2CC[C@H]3CCN(C)C[C@H]32)cnn1-c1ccc(C(F)(F)F)cc1 ZINC000484816879 900219366 /nfs/dbraw/zinc/21/93/66/900219366.db2.gz AKTGWWDYZVPGGY-AUUYWEPGSA-N 0 3 421.467 4.011 20 0 HIADHN CCOc1c(Cl)cc(CNC(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)cc1OC ZINC000484840127 900239860 /nfs/dbraw/zinc/23/98/60/900239860.db2.gz WDDBIOYZWQJOGR-MGPUTAFESA-N 0 3 419.953 4.238 20 0 HIADHN CCc1c(NC(=O)N2CCCN(CC)CC2)cnn1-c1ccc(C(F)(F)F)cc1 ZINC000484843403 900241799 /nfs/dbraw/zinc/24/17/99/900241799.db2.gz OKSQVEOXBCIIPY-UHFFFAOYSA-N 0 3 409.456 4.013 20 0 HIADHN COc1ccccc1[C@H](C)CC(=O)NCCCCN1CCN(c2cccc(C)c2)CC1 ZINC000484844530 900242549 /nfs/dbraw/zinc/24/25/49/900242549.db2.gz GAKGPLZXWRWHAZ-JOCHJYFZSA-N 0 3 423.601 4.216 20 0 HIADHN CCc1ccc(Cl)c(CC)c1NC(=O)CCCN[C@@](C)(C(N)=O)c1ccccc1 ZINC000485136214 900438632 /nfs/dbraw/zinc/43/86/32/900438632.db2.gz UUHDDBLRWGPGBM-HSZRJFAPSA-N 0 3 415.965 4.174 20 0 HIADHN Cc1ccccc1NC(=O)Cc1nc(CN2CCN(CCC(C)(C)C)CC2)cs1 ZINC000485216710 900504041 /nfs/dbraw/zinc/50/40/41/900504041.db2.gz IXKNIEHPCOZFQY-UHFFFAOYSA-N 0 3 414.619 4.187 20 0 HIADHN Cc1nc(-c2ccccc2Br)sc1[C@H](C)N[C@H]1CCCN(C)C1=O ZINC000485258799 900543872 /nfs/dbraw/zinc/54/38/72/900543872.db2.gz IWOBVSOLZRPIKS-NHYWBVRUSA-N 0 3 408.365 4.152 20 0 HIADHN COc1ccc(Oc2cc(CNC(=O)N3CCN(C4CCCCC4)CC3)ccn2)cc1 ZINC000485291977 900569383 /nfs/dbraw/zinc/56/93/83/900569383.db2.gz RKMZGQTZNATBGB-UHFFFAOYSA-N 0 3 424.545 4.042 20 0 HIADHN CCc1c(NC(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)cnn1-c1ccccc1C ZINC000485349190 900641701 /nfs/dbraw/zinc/64/17/01/900641701.db2.gz OOVSOAGTPCQUHE-WMZHIEFXSA-N 0 3 403.530 4.310 20 0 HIADHN C[C@H](c1ccc([S@](C)=O)cc1)N(C)CCC(=O)Nc1cccc(C(F)(F)F)c1 ZINC000485410340 900708403 /nfs/dbraw/zinc/70/84/03/900708403.db2.gz UWTHFTTUVGLJAS-SUMNFNSASA-N 0 3 412.477 4.464 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2ccc(N3CCCC3=O)c(F)c2)N2CCCC2)cc1 ZINC000485414292 900712829 /nfs/dbraw/zinc/71/28/29/900712829.db2.gz OKXXNDWGCIDJIY-JOCHJYFZSA-N 0 3 424.520 4.220 20 0 HIADHN CC[C@H](Sc1ccccc1)C(=O)Nc1ccc(C(=O)NCCN2CCCC2)cc1 ZINC000485568047 900838069 /nfs/dbraw/zinc/83/80/69/900838069.db2.gz INHRMWJCQDHMIY-NRFANRHFSA-N 0 3 411.571 4.022 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)NC[C@@H](c1ccccc1)C(F)(F)F ZINC000485590789 900853749 /nfs/dbraw/zinc/85/37/49/900853749.db2.gz MOKLDSGAVVCBMS-NRFANRHFSA-N 0 3 419.491 4.051 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2cccn2C2CCCC2)cc1)[C@H]1CCCN(C)C1 ZINC000485602863 900863037 /nfs/dbraw/zinc/86/30/37/900863037.db2.gz UYPCXSPGCUWDOU-NRFANRHFSA-N 0 3 408.546 4.022 20 0 HIADHN C[C@@H]1CN(C(=O)c2ccc(-c3ccc(Cl)cc3)s2)CC[C@H]1N1CCN(C)CC1 ZINC000485678327 900929556 /nfs/dbraw/zinc/92/95/56/900929556.db2.gz OQSNHIYKYCNVHR-VQIMIIECSA-N 0 3 418.006 4.167 20 0 HIADHN C[C@H]1CN(C(=O)c2ccc(-c3ccc(Cl)cc3)s2)CC[C@@H]1N1CCN(C)CC1 ZINC000485678325 900929930 /nfs/dbraw/zinc/92/99/30/900929930.db2.gz OQSNHIYKYCNVHR-LPHOPBHVSA-N 0 3 418.006 4.167 20 0 HIADHN CCOc1cc(CN2C[C@@H](c3ccc(F)cc3)C[C@H]2C)nc2nc(C(F)(F)F)nn21 ZINC000485685238 900935702 /nfs/dbraw/zinc/93/57/02/900935702.db2.gz OVRGGBJEXKKYHO-OCCSQVGLSA-N 0 3 423.414 4.059 20 0 HIADHN COCCO[C@@H]1COCC[C@@H]1NCc1ccc(-c2cccc(Cl)c2Cl)o1 ZINC000485697528 900947165 /nfs/dbraw/zinc/94/71/65/900947165.db2.gz PSKLFQVMELJFDG-FUHWJXTLSA-N 0 3 400.302 4.164 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)c1cccnc1OCc1ccccc1F ZINC000485753697 901009841 /nfs/dbraw/zinc/00/98/41/901009841.db2.gz PVKNJGXDEPSLPK-UHFFFAOYSA-N 0 3 413.518 4.065 20 0 HIADHN Cc1cccc2c1[C@@H](C)C[C@H]2CC(=O)Nc1ccc2oc(=O)n(CCN(C)C)c2c1 ZINC000485796980 901049383 /nfs/dbraw/zinc/04/93/83/901049383.db2.gz VSUMZNQLEPZPHO-IRXDYDNUSA-N 0 3 407.514 4.084 20 0 HIADHN CCN(C(=O)c1cnnc(-c2ccccc2)c1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000485882328 901117679 /nfs/dbraw/zinc/11/76/79/901117679.db2.gz JBDVANASAKCAIG-WMZHIEFXSA-N 0 3 400.526 4.441 20 0 HIADHN COCCN(C(C)=O)c1nc(CN2C[C@H](c3ccccc3)[C@H]3CCCC[C@H]32)cs1 ZINC000485903578 901132256 /nfs/dbraw/zinc/13/22/56/901132256.db2.gz DMYKHODSORTGIY-YPAWHYETSA-N 0 3 413.587 4.301 20 0 HIADHN C[C@@H]1C[C@H](C(=O)N2CCC(N(C)Cc3cccc(C(F)(F)F)c3)CC2)CCC1=O ZINC000485943065 901162677 /nfs/dbraw/zinc/16/26/77/901162677.db2.gz GXZZOZIIALIGSP-NVXWUHKLSA-N 0 3 410.480 4.134 20 0 HIADHN CN(C)Cc1ccccc1C(=O)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1 ZINC000485977778 901195342 /nfs/dbraw/zinc/19/53/42/901195342.db2.gz LZXGMIJNOCGASG-UHFFFAOYSA-N 0 3 419.491 4.161 20 0 HIADHN CCOc1cn(-c2ccccc2)nc1C(=O)NC[C@H](c1ccc(C)cc1)N1CCCC1 ZINC000486078942 901268440 /nfs/dbraw/zinc/26/84/40/901268440.db2.gz VYTQKOYXLMESCX-JOCHJYFZSA-N 0 3 418.541 4.146 20 0 HIADHN CC[C@@H](N[C@@H](C)c1ccc(S(N)(=O)=O)cc1)c1cc(F)cc(Br)c1 ZINC000486095471 901283102 /nfs/dbraw/zinc/28/31/02/901283102.db2.gz NHNJTRYJHFAYEB-APPDUMDISA-N 0 3 415.328 4.038 20 0 HIADHN CN(C(=O)C[C@H](c1ccccc1)C(F)(F)F)C1CCN(CCc2ccccn2)CC1 ZINC000486100154 901287441 /nfs/dbraw/zinc/28/74/41/901287441.db2.gz ZUFQZXDRVXTYLL-OAQYLSRUSA-N 0 3 419.491 4.283 20 0 HIADHN C[C@H]1CN(C(=O)c2ccc(-c3ccc(C(C)(C)C)cc3)o2)CC[C@@H]1N1CCN(C)CC1 ZINC000486154706 901341976 /nfs/dbraw/zinc/34/19/76/901341976.db2.gz SOKONRICHYUGDX-UGKGYDQZSA-N 0 3 423.601 4.342 20 0 HIADHN C[C@H](C(=O)NC(c1ccccc1)c1ccccc1)N1CCN(C2CCCCC2)CC1 ZINC000486227907 901410561 /nfs/dbraw/zinc/41/05/61/901410561.db2.gz DFNIUHTUXLDUMB-OAQYLSRUSA-N 0 3 405.586 4.231 20 0 HIADHN O=C(CN1CCN(C2CCCCC2)CC1)N1Cc2ccccc2[C@@H](c2ccccc2)C1 ZINC000486256983 901440860 /nfs/dbraw/zinc/44/08/60/901440860.db2.gz YQZPENQJVSKZIV-AREMUKBSSA-N 0 3 417.597 4.111 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)NCCc2csc(-c3ccccc3)n2)o1 ZINC000486270787 901452759 /nfs/dbraw/zinc/45/27/59/901452759.db2.gz YVIYDSDBBKGDHM-UHFFFAOYSA-N 0 3 412.559 4.027 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)c1cnc(-c2ccsc2)s1 ZINC000486757359 901832694 /nfs/dbraw/zinc/83/26/94/901832694.db2.gz IJAPUSIGAYYTLX-UHFFFAOYSA-N 0 3 407.511 4.354 20 0 HIADHN CC[C@H](Cc1ccccc1)N(CC)CC(=O)Nc1cc(C)ccc1-c1n[nH]c(C)n1 ZINC000486792378 901857808 /nfs/dbraw/zinc/85/78/08/901857808.db2.gz DWUTYRHRHLLLEH-HXUWFJFHSA-N 0 3 405.546 4.370 20 0 HIADHN O=C(CN1CCC[C@@H]1CCC1CCCC1)NC1CCN(C(=O)C2CCCCC2)CC1 ZINC000486801214 901862111 /nfs/dbraw/zinc/86/21/11/901862111.db2.gz QHYVRPMCJOEMNA-HSZRJFAPSA-N 0 3 417.638 4.109 20 0 HIADHN CNC(=O)[C@@H](NCc1cn(-c2ccccc2)nc1-c1cc2ccccc2o1)C(C)C ZINC000486805051 901864444 /nfs/dbraw/zinc/86/44/44/901864444.db2.gz VFEKBFICXMHIGB-QFIPXVFZSA-N 0 3 402.498 4.146 20 0 HIADHN C[C@@H](C(=O)N1[C@H](C)CCC[C@@H]1C)N1C[C@H]2CCC[C@@]2(c2nc(-c3ccccc3)no2)C1 ZINC000486829521 901881599 /nfs/dbraw/zinc/88/15/99/901881599.db2.gz XURAUWGKLOYZEP-TWHOPLDESA-N 0 3 422.573 4.268 20 0 HIADHN c1nc(CN2C[C@H]3CCC[C@@]3(c3nc(-c4cccnc4)no3)C2)oc1-c1ccccc1 ZINC000486829442 901881656 /nfs/dbraw/zinc/88/16/56/901881656.db2.gz XIZDXBVRQCFISM-NTKDMRAZSA-N 0 3 413.481 4.340 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cc(NC(C)=O)ccc1Cl)c1cccc(OC)c1 ZINC000486848634 901894138 /nfs/dbraw/zinc/89/41/38/901894138.db2.gz XRUZPKFPEIZXFB-OAQYLSRUSA-N 0 3 417.937 4.120 20 0 HIADHN Cc1cc(NC(=O)c2ccccc2CN(C)C)nn1CCCOc1ccc(F)cc1 ZINC000486903712 901949100 /nfs/dbraw/zinc/94/91/00/901949100.db2.gz KKGSUNRLGDZXQE-UHFFFAOYSA-N 0 3 410.493 4.114 20 0 HIADHN CSc1cc(O)ccc1NC(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000486970032 901995664 /nfs/dbraw/zinc/99/56/64/901995664.db2.gz QYDMHMGSXJWLOR-UHFFFAOYSA-N 0 3 403.573 4.349 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)Nc2cnn(-c3ccccc3)c2C(C)C)CC1 ZINC000487032011 902029394 /nfs/dbraw/zinc/02/93/94/902029394.db2.gz GTOVZCSHAQYJJO-UHFFFAOYSA-N 0 3 413.566 4.007 20 0 HIADHN CN(Cc1cccnc1)C[C@H]1CCN(C(=O)Nc2ccc(C(=O)C3CCC3)cc2)C1 ZINC000487041570 902034671 /nfs/dbraw/zinc/03/46/71/902034671.db2.gz OBAFPYBPQNKVJF-LJQANCHMSA-N 0 3 406.530 4.050 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)N[C@@H](c1ccc(F)cc1)C(F)(F)F ZINC000487172747 902085543 /nfs/dbraw/zinc/08/55/43/902085543.db2.gz OPRPXKREJXWIEI-SFHVURJKSA-N 0 3 415.406 4.342 20 0 HIADHN CCOc1ccc(CNCCC(=O)N(C)Cc2ccccc2Br)cc1F ZINC000487273919 902133618 /nfs/dbraw/zinc/13/36/18/902133618.db2.gz NVGLTSBTTVZCJB-UHFFFAOYSA-N 0 3 423.326 4.125 20 0 HIADHN Cc1nc(-c2ccc(C)cc2NC(=O)CN(C)[C@@H](Cc2ccc(F)cc2)C(C)C)n[nH]1 ZINC000487392313 902177256 /nfs/dbraw/zinc/17/72/56/902177256.db2.gz KCBHPNWFVBJOPA-QFIPXVFZSA-N 0 3 423.536 4.365 20 0 HIADHN CCCN(CC(=O)Nc1cc(C)ccc1-c1n[nH]c(C)n1)[C@H]1CCc2ccccc21 ZINC000487408160 902189870 /nfs/dbraw/zinc/18/98/70/902189870.db2.gz JABGLYIZENIYPE-QFIPXVFZSA-N 0 3 403.530 4.427 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)c2csc(-c3ccc4c(c3)OCO4)n2)c1 ZINC000487534448 902237979 /nfs/dbraw/zinc/23/79/79/902237979.db2.gz JLSLNONMEFUXPX-UHFFFAOYSA-N 0 3 423.538 4.051 20 0 HIADHN CN(CCN1CCCC1)C(=O)c1ccccc1OCc1ccc(Br)cc1 ZINC000487647943 902273447 /nfs/dbraw/zinc/27/34/47/902273447.db2.gz IMAMIHVJQIDGRY-UHFFFAOYSA-N 0 3 417.347 4.196 20 0 HIADHN CN(C)Cc1ccccc1C(=O)N[C@H]1C[C@H](c2ccc(F)c(Br)c2)C1 ZINC000487660871 902280236 /nfs/dbraw/zinc/28/02/36/902280236.db2.gz VMHORFWVAPFOJK-WKILWMFISA-N 0 3 405.311 4.326 20 0 HIADHN COc1cc(CNC(=O)N[C@H]2CCN(Cc3ccccc3)C2)ccc1OC1CCCC1 ZINC000505957607 914612982 /nfs/dbraw/zinc/61/29/82/914612982.db2.gz VXBGBEBAIZWHSY-NRFANRHFSA-N 0 3 423.557 4.090 20 0 HIADHN CC(=O)N(c1nc(CN2CCN(C)[C@@H](C(C)C)C2)cs1)c1cccc(C)c1C ZINC000487977536 902502812 /nfs/dbraw/zinc/50/28/12/902502812.db2.gz GGQMZWHSNZNYEX-OAQYLSRUSA-N 0 3 400.592 4.217 20 0 HIADHN C[C@@H](NC(=O)N1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1)c1ccccc1Cl ZINC000488262234 902733065 /nfs/dbraw/zinc/73/30/65/902733065.db2.gz HNYUEXVBMWWVOF-OKZBNKHCSA-N 0 3 407.986 4.322 20 0 HIADHN C[C@@H]1CN(C2CCOCC2)CCN1C(=O)Nc1ccc2oc(CC(C)(C)C)nc2c1 ZINC000488312571 902760025 /nfs/dbraw/zinc/76/00/25/902760025.db2.gz VFXIJCLZFKDZLQ-MRXNPFEDSA-N 0 3 414.550 4.133 20 0 HIADHN Cc1cccc(Oc2ncccc2NC(=O)N2CCN(C3CCOCC3)C[C@H]2C)c1C ZINC000488394355 902803898 /nfs/dbraw/zinc/80/38/98/902803898.db2.gz FJFXFSVHSFUAEN-GOSISDBHSA-N 0 3 424.545 4.208 20 0 HIADHN C[C@@H](CCc1ccc2c(c1)OCO2)NCc1csc(-c2ccc3c(c2)OCO3)n1 ZINC000488458271 902835082 /nfs/dbraw/zinc/83/50/82/902835082.db2.gz MAQFAZCBDMFIGR-AWEZNQCLSA-N 0 3 410.495 4.378 20 0 HIADHN CC(C)n1ncc(C(=O)NCC2(N3CCSCC3)CCCC2)c1-c1ccccc1 ZINC000488491282 902852926 /nfs/dbraw/zinc/85/29/26/902852926.db2.gz RTQFIFXGNKTLCM-UHFFFAOYSA-N 0 3 412.603 4.222 20 0 HIADHN Cc1ccc(Cl)c(O[C@H](C)C(=O)Nc2cccc(CN3CCC(O)CC3)c2)c1 ZINC000488652486 902920550 /nfs/dbraw/zinc/92/05/50/902920550.db2.gz CTGCQTALIVMXAG-MRXNPFEDSA-N 0 3 402.922 4.011 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)CCCc2nnc(-c3ccccc3)o2)CC1 ZINC000488673812 902935556 /nfs/dbraw/zinc/93/55/56/902935556.db2.gz GRIZXYIJOAVETK-UHFFFAOYSA-N 0 3 418.541 4.182 20 0 HIADHN Cc1c(C(=O)Nc2cccc(CN3CCC(O)CC3)c2)cnn1-c1ccccc1Cl ZINC000488678462 902939676 /nfs/dbraw/zinc/93/96/76/902939676.db2.gz RWQPAWRSGCBSGM-UHFFFAOYSA-N 0 3 424.932 4.043 20 0 HIADHN COc1ccc2ccccc2c1-c1cc(CN2CCN(C3CCOCC3)C[C@@H]2C)on1 ZINC000488711949 902962314 /nfs/dbraw/zinc/96/23/14/902962314.db2.gz PEQXROVCWPKBEY-SFHVURJKSA-N 0 3 421.541 4.189 20 0 HIADHN Cc1cc(N2CCCC[C@@H]2C)ccc1NC(=O)N1CCN(C2CCOCC2)C[C@H]1C ZINC000488904416 903068983 /nfs/dbraw/zinc/06/89/83/903068983.db2.gz BSTIYHUNYPQNCS-VQTJNVASSA-N 0 3 414.594 4.091 20 0 HIADHN CCOc1cc(CN(C)Cc2sccc2C)ccc1OCC(=O)N1CCCCC1 ZINC000506009819 914684755 /nfs/dbraw/zinc/68/47/55/914684755.db2.gz MOMKTVVQKWOZND-UHFFFAOYSA-N 0 3 416.587 4.479 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)N(Cc2ccccc2)C2CCN(C)CC2)c(Cl)c1 ZINC000489016969 903122728 /nfs/dbraw/zinc/12/27/28/903122728.db2.gz SOZWTRHYBAHBHW-UHFFFAOYSA-N 0 3 414.937 4.427 20 0 HIADHN CC(=O)c1cccc(NC(=O)[C@H](C)N[C@H](COc2ccccc2F)C(C)(C)C)c1 ZINC000489042740 903148378 /nfs/dbraw/zinc/14/83/78/903148378.db2.gz YCQWTSCPGJBYQK-YCRPNKLZSA-N 0 3 400.494 4.439 20 0 HIADHN Cc1cccc2c1[C@H](C)C[C@@H]2CC(=O)Nc1cccc(CN2CCC(C(N)=O)CC2)c1 ZINC000489069068 903171552 /nfs/dbraw/zinc/17/15/52/903171552.db2.gz GYVPGZCIBQHATC-WIYYLYMNSA-N 0 3 419.569 4.312 20 0 HIADHN Cc1cc(NC(=O)N(Cc2ccccc2)C2CCN(C)CC2)n(-c2cc(C)ccn2)n1 ZINC000489095266 903193663 /nfs/dbraw/zinc/19/36/63/903193663.db2.gz BLDABRDQCYLSQA-UHFFFAOYSA-N 0 3 418.545 4.012 20 0 HIADHN Cc1ccc(NC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)cc1C(=O)N(C)C(C)C ZINC000489124837 903214358 /nfs/dbraw/zinc/21/43/58/903214358.db2.gz QHZOCTDACRAZQR-WMZHIEFXSA-N 0 3 422.573 4.117 20 0 HIADHN Cc1ccc(NC(=O)N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)cc1C(=O)N(C)C(C)C ZINC000489126709 903216311 /nfs/dbraw/zinc/21/63/11/903216311.db2.gz IKHKQGVECFNSFK-DENIHFKCSA-N 0 3 422.573 4.260 20 0 HIADHN Cc1cccnc1CNC(=O)N(CCN(C)Cc1ccccc1)Cc1ccccc1 ZINC000489145658 903229620 /nfs/dbraw/zinc/22/96/20/903229620.db2.gz AUALBORYXCVPDW-UHFFFAOYSA-N 0 3 402.542 4.234 20 0 HIADHN Cc1ncc(CNC(=O)N(CCN(C)Cc2ccccc2)Cc2ccccc2)s1 ZINC000489386873 903358057 /nfs/dbraw/zinc/35/80/57/903358057.db2.gz GAIPGYNWCIMETO-UHFFFAOYSA-N 0 3 408.571 4.295 20 0 HIADHN Cc1ccc(-c2noc([C@H](C)N3CCC(CCCN4CCOCC4)CC3)n2)cc1F ZINC000506027558 914710566 /nfs/dbraw/zinc/71/05/66/914710566.db2.gz MPMWVDGPNGANRH-SFHVURJKSA-N 0 3 416.541 4.070 20 0 HIADHN C[C@@H](NC(=O)NCc1ccccc1CN1CCC(O)CC1)[C@@H](C)C1CCCCC1 ZINC000489492625 903420061 /nfs/dbraw/zinc/42/00/61/903420061.db2.gz QVBKJUPFWGBVLD-RTBURBONSA-N 0 3 401.595 4.047 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)Nc2ccc(C)c(C(=O)N(C)C(C)C)c2)c1 ZINC000489520921 903435987 /nfs/dbraw/zinc/43/59/87/903435987.db2.gz OSHIZWVGBAVTAS-UHFFFAOYSA-N 0 3 424.589 4.380 20 0 HIADHN C[C@H](NCc1ccc(CN2CCOCC2)cc1)c1ccc(Br)c(F)c1 ZINC000489565053 903468370 /nfs/dbraw/zinc/46/83/70/903468370.db2.gz TUCAPGRZJXGTLZ-HNNXBMFYSA-N 0 3 407.327 4.271 20 0 HIADHN O[C@H](COc1ccc(-c2ccccc2)cc1)CN1CCC(n2cc(Cl)cn2)CC1 ZINC000506035869 914723305 /nfs/dbraw/zinc/72/33/05/914723305.db2.gz KDHPBUNFLSXQCY-QFIPXVFZSA-N 0 3 411.933 4.280 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2ccc(-c3ccccc3)[nH]c2=O)N2CCCC2)cc1 ZINC000489656735 903521826 /nfs/dbraw/zinc/52/18/26/903521826.db2.gz VSRCVWGTKCYGMV-HSZRJFAPSA-N 0 3 401.510 4.330 20 0 HIADHN CC(C)n1ncc(C(=O)Nc2ccc(OC3CCN(C)CC3)nc2)c1-c1ccccc1 ZINC000489718296 903555941 /nfs/dbraw/zinc/55/59/41/903555941.db2.gz IOVKAFCYUXIHBF-UHFFFAOYSA-N 0 3 419.529 4.251 20 0 HIADHN Cc1ccccc1[C@@H](C(C)C)N(C)C(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000489763938 903588028 /nfs/dbraw/zinc/58/80/28/903588028.db2.gz VRVUQSNZVYYIRK-RUZDIDTESA-N 0 3 423.601 4.490 20 0 HIADHN Cc1ccccc1[C@H]1C[C@H](C)N(C(=O)NCc2ccccc2CN2CCC(O)CC2)C1 ZINC000489791349 903602162 /nfs/dbraw/zinc/60/21/62/903602162.db2.gz ZGUYYVAGLAMJHK-REWPJTCUSA-N 0 3 421.585 4.039 20 0 HIADHN Cc1nc(C(=O)NCc2ccccc2CN2CCC(O)CC2)c(-c2ccccc2)s1 ZINC000489882933 903649872 /nfs/dbraw/zinc/64/98/72/903649872.db2.gz IYNWVXPUFMHJFP-UHFFFAOYSA-N 0 3 421.566 4.005 20 0 HIADHN CCN(C)[C@@H](C(=O)Nc1cccc(NC(=O)CN2CCCCCC2)c1)c1ccccc1 ZINC000489901102 903661423 /nfs/dbraw/zinc/66/14/23/903661423.db2.gz QDKDSIYNZMLVAD-XMMPIXPASA-N 0 3 422.573 4.133 20 0 HIADHN C[C@@H](NC(=O)N[C@@H]1c2cc(Br)ccc2CC1(C)C)C1=CCN(C)CC1 ZINC000489998945 903717467 /nfs/dbraw/zinc/71/74/67/903717467.db2.gz QSDWPWHPQVSEQP-FZKQIMNGSA-N 0 3 406.368 4.022 20 0 HIADHN COc1cc(-c2noc(CN3C[C@@H](c4ccc(C)cc4)C[C@H]3C)n2)cc(OC)c1OC ZINC000490053649 903746197 /nfs/dbraw/zinc/74/61/97/903746197.db2.gz KWRKROATNWZABB-APWZRJJASA-N 0 3 423.513 4.449 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](NCCCOc2ccc(F)cc2)c2ccccc2)c1 ZINC000490128819 903782423 /nfs/dbraw/zinc/78/24/23/903782423.db2.gz AHWOXLWIFHMHOB-QHCPKHFHSA-N 0 3 413.514 4.377 20 0 HIADHN Cc1ccc(C)c([C@H](NCc2ccc([C@@]3(C)NC(=O)NC3=O)cc2)c2ccccc2)c1 ZINC000490137477 903786557 /nfs/dbraw/zinc/78/65/57/903786557.db2.gz RGMSDWKFQOWEGY-ZEQKJWHPSA-N 0 3 413.521 4.237 20 0 HIADHN Cc1ccc([C@H](NC[C@H](C)N2CCCC[C@H]2C)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000490184931 903814485 /nfs/dbraw/zinc/81/44/85/903814485.db2.gz PZGOSVLBMZGFJY-NMMYMHLASA-N 0 3 414.615 4.340 20 0 HIADHN Cc1ccc(-c2nnc([C@@H](C)N3CCC(CCCN4CCOCC4)CC3)o2)cc1C ZINC000506051911 914752272 /nfs/dbraw/zinc/75/22/72/914752272.db2.gz ORTIGSSLTAIDEJ-HXUWFJFHSA-N 0 3 412.578 4.239 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)CCc3ncc(-c4ccc(Cl)cc4Cl)o3)[C@H]2C1 ZINC000490273328 903867482 /nfs/dbraw/zinc/86/74/82/903867482.db2.gz MARZDLFWPHEFTC-GUYCJALGSA-N 0 3 408.329 4.134 20 0 HIADHN CC[C@@H](CNC(=O)N[C@@H](c1ccccc1)c1cccnc1)N1CCc2ccccc2C1 ZINC000490285443 903875027 /nfs/dbraw/zinc/87/50/27/903875027.db2.gz JTLZCFUUOHYSDT-DQEYMECFSA-N 0 3 414.553 4.307 20 0 HIADHN CC[C@@H](CNC(=O)N[C@H](c1ccccc1)c1cccnc1)N1CCc2ccccc2C1 ZINC000490285449 903875071 /nfs/dbraw/zinc/87/50/71/903875071.db2.gz JTLZCFUUOHYSDT-LOSJGSFVSA-N 0 3 414.553 4.307 20 0 HIADHN CC[C@H](CNC(=O)N[C@H](c1ccccc1)c1ccncc1)N1CCc2ccccc2C1 ZINC000490289954 903878377 /nfs/dbraw/zinc/87/83/77/903878377.db2.gz RHTLXEJFBSUTKU-JWQCQUIFSA-N 0 3 414.553 4.307 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)Nc3ccc(NC(=O)c4ccc(Cl)cc4)cc3)[C@@H]2C1 ZINC000490327969 903913248 /nfs/dbraw/zinc/91/32/48/903913248.db2.gz PLJWCSVPKWJGHC-FOIQADDNSA-N 0 3 412.921 4.150 20 0 HIADHN CCNC(=O)Nc1ccc(C)c(NC(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)c1 ZINC000490355477 903949039 /nfs/dbraw/zinc/94/90/39/903949039.db2.gz SOKLJCPCZWJFQX-FXAWDEMLSA-N 0 3 409.534 4.093 20 0 HIADHN CCN(CC)[C@H](CNC(=O)C(=O)Nc1ccc(C(=O)C(C)(C)C)cc1)c1ccccc1 ZINC000490482876 904036702 /nfs/dbraw/zinc/03/67/02/904036702.db2.gz COWFBHQWFLQGME-OAQYLSRUSA-N 0 3 423.557 4.053 20 0 HIADHN O=C(Nc1ccc(-c2ccco2)cc1F)N[C@H]1CCN(Cc2ccccc2)C[C@H]1CO ZINC000490496208 904047687 /nfs/dbraw/zinc/04/76/87/904047687.db2.gz PHEOCFPJEMEHKY-FPOVZHCZSA-N 0 3 423.488 4.090 20 0 HIADHN Cc1noc(-c2ccccc2C(=O)NC[C@H](c2ccc(CC(C)C)cc2)N(C)C)n1 ZINC000490498452 904051103 /nfs/dbraw/zinc/05/11/03/904051103.db2.gz JSKWRDPMUOWZQE-JOCHJYFZSA-N 0 3 406.530 4.276 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)Nc3ccc(Br)cc3C(F)(F)F)[C@@H]2C1 ZINC000490547390 904092574 /nfs/dbraw/zinc/09/25/74/904092574.db2.gz RHLSCLUZKPTYOO-QMTHXVAHSA-N 0 3 406.246 4.026 20 0 HIADHN CCc1ccc(NC(=O)NCc2ccccc2CN2CCC(O)CC2)cc1Cl ZINC000490787374 904234546 /nfs/dbraw/zinc/23/45/46/904234546.db2.gz ZVCGXGKQMKZBCQ-UHFFFAOYSA-N 0 3 401.938 4.181 20 0 HIADHN O=C(N[C@H](c1c[nH]c2ccccc21)C(F)(F)F)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000490794649 904241754 /nfs/dbraw/zinc/24/17/54/904241754.db2.gz JPPVLXJHAIFHEO-OXQOHEQNSA-N 0 3 416.447 4.345 20 0 HIADHN CCc1ccc(NC(=O)N(C)C2CCN(CCc3ccccn3)CC2)cc1Cl ZINC000490797410 904243530 /nfs/dbraw/zinc/24/35/30/904243530.db2.gz OFXZYQORMIIRBD-UHFFFAOYSA-N 0 3 400.954 4.468 20 0 HIADHN CCOc1c(Br)cc(Cl)cc1NC(=O)N1CC[C@@H]2CCN(C)C[C@H]21 ZINC000490808877 904255545 /nfs/dbraw/zinc/25/55/45/904255545.db2.gz VSZIXIRVUNVPKA-XHDPSFHLSA-N 0 3 416.747 4.059 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)N[C@@H](c1c[nH]c2ccccc21)C(F)(F)F ZINC000490847019 904283908 /nfs/dbraw/zinc/28/39/08/904283908.db2.gz BFHHNUFQTSFITN-SFHVURJKSA-N 0 3 408.424 4.138 20 0 HIADHN O=C(NCc1c(F)cccc1Cl)Nc1ccc(CCN2CCSCC2)cc1 ZINC000490946919 904331329 /nfs/dbraw/zinc/33/13/29/904331329.db2.gz DRXFMCWMCJUOJQ-UHFFFAOYSA-N 0 3 407.942 4.392 20 0 HIADHN Cc1cccc(-c2nn(Cc3ccccc3)cc2CN2CCC(C(=O)N(C)C)CC2)c1 ZINC000506111278 914807951 /nfs/dbraw/zinc/80/79/51/914807951.db2.gz AEISDAOCMWPZMW-UHFFFAOYSA-N 0 3 416.569 4.207 20 0 HIADHN CCc1ccc([C@H](NC[C@H](O)C2CCCCC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000491005395 904365488 /nfs/dbraw/zinc/36/54/88/904365488.db2.gz KQOJGSDLEITBNM-ZEQRLZLVSA-N 0 3 415.599 4.273 20 0 HIADHN CCN(CC)C[C@H](C)N[C@@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000491038960 904390618 /nfs/dbraw/zinc/39/06/18/904390618.db2.gz QKSDSBCJCKVRMR-KKSFZXQISA-N 0 3 408.995 4.153 20 0 HIADHN Cc1ccc([C@H](NCCN(C)C2CCCC2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000491042931 904392460 /nfs/dbraw/zinc/39/24/60/904392460.db2.gz YLTBNCBJYSOLJC-XMMPIXPASA-N 0 3 414.615 4.260 20 0 HIADHN C[C@@H](CN[C@H](c1ccccc1Cl)c1cc(F)ccc1F)CN1CCN(C)CC1 ZINC000491061569 904405492 /nfs/dbraw/zinc/40/54/92/904405492.db2.gz RQYOBUWMOZTAIS-KSFYIVLOSA-N 0 3 407.936 4.181 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CN1CCC(C(=O)Nc2ccccc2O)CC1 ZINC000506128381 914815270 /nfs/dbraw/zinc/81/52/70/914815270.db2.gz DWXOOJACTQSYML-UHFFFAOYSA-N 0 3 418.541 4.105 20 0 HIADHN C[C@@H]1CN(C[C@@H]2CCCN2Cc2ccc(Br)c3cccnc23)C[C@@H](C)O1 ZINC000491194936 904477164 /nfs/dbraw/zinc/47/71/64/904477164.db2.gz RDPWBSZLFJYSTO-NUJGCVRESA-N 0 3 418.379 4.071 20 0 HIADHN CCOc1cc(CN2CCC[C@H](c3nnc4ccccn43)C2)ccc1OC(F)F ZINC000506141111 914820642 /nfs/dbraw/zinc/82/06/42/914820642.db2.gz PIKWXEPTZZAGJY-INIZCTEOSA-N 0 3 402.445 4.109 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)cc1CN1CCC[C@@H](c2nnc3ccccn32)C1 ZINC000506141438 914821177 /nfs/dbraw/zinc/82/11/77/914821177.db2.gz WPBUXWFTDIUOSS-QGZVFWFLSA-N 0 3 406.921 4.256 20 0 HIADHN CCc1ccc([C@H](NCCN(C(C)C)C(C)C)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000491354465 904550664 /nfs/dbraw/zinc/55/06/64/904550664.db2.gz BSJXTXRORIVYAZ-DEOSSOPVSA-N 0 3 416.631 4.450 20 0 HIADHN Cc1ccc([C@H](NC[C@@H]2Cc3ccccc3O2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000491392587 904574060 /nfs/dbraw/zinc/57/40/60/904574060.db2.gz AUQMRKNSJLYSQR-SQJMNOBHSA-N 0 3 421.562 4.390 20 0 HIADHN COc1ccccc1-c1ncc(CNCCOc2ncc(Cl)cc2Cl)cn1 ZINC000491403577 904580819 /nfs/dbraw/zinc/58/08/19/904580819.db2.gz YPWIHNZURVYFFZ-UHFFFAOYSA-N 0 3 405.285 4.023 20 0 HIADHN C[C@@H]1C[C@H]1C(=O)Nc1cccc(C(=O)NC[C@H](c2ccccc2)N2CCC(C)CC2)c1 ZINC000491423950 904590138 /nfs/dbraw/zinc/59/01/38/904590138.db2.gz OOLGKKFVCATHGL-CTUHWIOQSA-N 0 3 419.569 4.484 20 0 HIADHN O=C(Nc1ccc(OC2CCCC2)cc1)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000491435235 904596000 /nfs/dbraw/zinc/59/60/00/904596000.db2.gz UJBMNLUBFQRDDE-UHFFFAOYSA-N 0 3 408.542 4.465 20 0 HIADHN Cc1nn(-c2ccc(C)c(Cl)c2)c(C)c1CC(=O)NC[C@@H](c1ccccc1)N(C)C ZINC000491835122 904707476 /nfs/dbraw/zinc/70/74/76/904707476.db2.gz MXLHZFDQTRZJAZ-QHCPKHFHSA-N 0 3 424.976 4.413 20 0 HIADHN O=C(Nc1cc(Br)ccc1F)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000492055058 904779076 /nfs/dbraw/zinc/77/90/76/904779076.db2.gz SBVLALBGNMOLJN-UHFFFAOYSA-N 0 3 421.310 4.045 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)Nc3ccc(Oc4ccc(C(F)(F)F)cc4)nc3)[C@@H]2C1 ZINC000492081057 904793379 /nfs/dbraw/zinc/79/33/79/904793379.db2.gz OQMVLIQSFGGTKG-KBXCAEBGSA-N 0 3 420.435 4.451 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1cc(F)c(Br)c(Cl)c1 ZINC000492144582 904805137 /nfs/dbraw/zinc/80/51/37/904805137.db2.gz QPXDRNYCOGWZQR-UHFFFAOYSA-N 0 3 418.694 4.430 20 0 HIADHN Cn1cc([C@@H](NCC2(N3CCOC(C)(C)C3)CCCCC2)c2cccc(F)c2)cn1 ZINC000492207137 904814970 /nfs/dbraw/zinc/81/49/70/904814970.db2.gz CXUQROYOVGMVRI-QFIPXVFZSA-N 0 3 414.569 4.052 20 0 HIADHN CN(C(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F)[C@H](c1ncc[nH]1)c1ccccc1 ZINC000492468816 904855924 /nfs/dbraw/zinc/85/59/24/904855924.db2.gz WIHZMDSZICHJLG-RTWAWAEBSA-N 0 3 424.495 4.115 20 0 HIADHN CC(C)CN(CCN(C)C)C(=O)Nc1cc(-c2cccc(C(F)(F)F)c2)nn1C ZINC000492506845 904860477 /nfs/dbraw/zinc/86/04/77/904860477.db2.gz DADLEHYKTHQPLR-UHFFFAOYSA-N 0 3 411.472 4.157 20 0 HIADHN CO[C@H](CN[C@H](c1cccc(S(C)(=O)=O)c1)c1ccc(C)cc1C)C(C)(C)C ZINC000493039467 905001366 /nfs/dbraw/zinc/00/13/66/905001366.db2.gz ZPXYYKXQHJBHPK-FGZHOGPDSA-N 0 3 403.588 4.447 20 0 HIADHN COc1ccc(SC)c(OC)c1C(=O)NC[C@]1(C)CCCN1Cc1ccccc1 ZINC000493084998 905017066 /nfs/dbraw/zinc/01/70/66/905017066.db2.gz ZSRRTESFJSYWRM-QHCPKHFHSA-N 0 3 414.571 4.210 20 0 HIADHN COc1ccc([C@H](NCCNc2nccc(C(F)(F)F)n2)c2ccc(F)cc2)cc1 ZINC000493126831 905024454 /nfs/dbraw/zinc/02/44/54/905024454.db2.gz HLYADTJJAJNSSD-LJQANCHMSA-N 0 3 420.410 4.434 20 0 HIADHN CCC(CC)(CCO)CN[C@@H](c1ccc(C)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000493134687 905029601 /nfs/dbraw/zinc/02/96/01/905029601.db2.gz ZZOHAFSJYZDFJQ-QFIPXVFZSA-N 0 3 403.588 4.266 20 0 HIADHN CCC[C@H](CCO)CN[C@@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000493177304 905040966 /nfs/dbraw/zinc/04/09/66/905040966.db2.gz PVDKJNLZMQVOGG-IERDGZPVSA-N 0 3 409.979 4.221 20 0 HIADHN CN(C(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1)[C@@H](c1ncc[nH]1)c1ccccc1 ZINC000493206365 905050169 /nfs/dbraw/zinc/05/01/69/905050169.db2.gz QRLZMFFERYNUMX-IFMALSPDSA-N 0 3 406.505 4.009 20 0 HIADHN Cc1nc(CCN[C@@H](c2cccc(S(C)(=O)=O)c2)c2ccc(C)cc2C)c(C)o1 ZINC000493222910 905053539 /nfs/dbraw/zinc/05/35/39/905053539.db2.gz BFZHEYBWDFHKCG-QHCPKHFHSA-N 0 3 412.555 4.233 20 0 HIADHN Fc1ccc(Br)cc1[C@@H](NCCCO[C@@H]1CCOC1)c1ccccc1 ZINC000493249575 905066958 /nfs/dbraw/zinc/06/69/58/905066958.db2.gz QJCLXDCUDUMARB-XLIONFOSSA-N 0 3 408.311 4.463 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](NCCC2CCOCC2)c2ccc(Cl)cc2)c1 ZINC000493278457 905075603 /nfs/dbraw/zinc/07/56/03/905075603.db2.gz UTVFGBRGBHAJNO-NRFANRHFSA-N 0 3 407.963 4.239 20 0 HIADHN O=C(C1CCN(Cc2cc3ccccc3nc2N2CCCCC2)CC1)N1CCCC1 ZINC000506269461 914873872 /nfs/dbraw/zinc/87/38/72/914873872.db2.gz NTFMNDYQYZKTKM-UHFFFAOYSA-N 0 3 406.574 4.060 20 0 HIADHN COc1cc(-c2nnc(CN[C@@H]3CCC[C@@H]3CCC(C)C)o2)cc(OC)c1OC ZINC000493604267 905172771 /nfs/dbraw/zinc/17/27/71/905172771.db2.gz LCLUBAIFSLWBAB-NVXWUHKLSA-N 0 3 403.523 4.457 20 0 HIADHN Fc1ccccc1OCCN1CCC[C@@H](c2nnc3ccc(C(F)(F)F)cn32)C1 ZINC000493607920 905173149 /nfs/dbraw/zinc/17/31/49/905173149.db2.gz YTGGRFYTKZGISQ-CQSZACIVSA-N 0 3 408.399 4.146 20 0 HIADHN C[C@H](NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)nc1)c1cc(Br)cs1 ZINC000493735438 905205638 /nfs/dbraw/zinc/20/56/38/905205638.db2.gz HURZLFFSFAVBOU-MCIONIFRSA-N 0 3 410.381 4.370 20 0 HIADHN CNS(=O)(=O)c1cccc([C@H](C)N[C@H]2CCc3cc(Br)cc(C)c32)c1 ZINC000493918513 905269363 /nfs/dbraw/zinc/26/93/63/905269363.db2.gz ZBOQRVWMYZIBFO-UGSOOPFHSA-N 0 3 423.376 4.004 20 0 HIADHN O=C(Nc1cccnc1)N(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000493926671 905279845 /nfs/dbraw/zinc/27/98/45/905279845.db2.gz PBACOFTTXQRRSQ-QHCPKHFHSA-N 0 3 401.514 4.175 20 0 HIADHN O=C(c1cccc(CN[C@@H]2CCO[C@H]2c2ccc(F)c(F)c2)c1)N1CCCCC1 ZINC000493960939 905309562 /nfs/dbraw/zinc/30/95/62/905309562.db2.gz NTYZRLKVUHFZBQ-YADHBBJMSA-N 0 3 400.469 4.211 20 0 HIADHN O=[S@](CCN[C@@H]1CCO[C@H]1c1ccc(F)c(F)c1)c1cc(Cl)ccc1Cl ZINC000493983363 905327064 /nfs/dbraw/zinc/32/70/64/905327064.db2.gz DIOAXRQCCBGCFL-NWJQHBQLSA-N 0 3 420.308 4.499 20 0 HIADHN CS(=O)(=O)C1CCC(N[C@@H](c2ccccc2)c2ccccc2Br)CC1 ZINC000493997414 905339657 /nfs/dbraw/zinc/33/96/57/905339657.db2.gz VYFAVRRDIBVTQE-UHYCVJNDSA-N 0 3 422.388 4.484 20 0 HIADHN C[C@@H]1[C@H](NC(=O)c2ccc(NC(=O)c3cccs3)cc2)CCN1Cc1ccccc1 ZINC000493999110 905341695 /nfs/dbraw/zinc/34/16/95/905341695.db2.gz HECZEJYLVFYJEW-DYESRHJHSA-N 0 3 419.550 4.393 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)Cc2nc(-c3ccc(F)cc3)cs2)CCN1Cc1ccccc1 ZINC000494007222 905348330 /nfs/dbraw/zinc/34/83/30/905348330.db2.gz PBXGGITYCKIBRJ-UZLBHIALSA-N 0 3 409.530 4.271 20 0 HIADHN C[C@H]1[C@@H](NC(=O)c2ccc(-c3noc(C(F)F)n3)cc2)CCN1Cc1ccccc1 ZINC000494007169 905348439 /nfs/dbraw/zinc/34/84/39/905348439.db2.gz OSZPKBULPWFYAS-KSSFIOAISA-N 0 3 412.440 4.067 20 0 HIADHN NC(=O)C1CCC(N[C@@H](c2ccccc2)c2cc(Br)ccc2F)CC1 ZINC000494038183 905380729 /nfs/dbraw/zinc/38/07/29/905380729.db2.gz JYENHWYMJCBCHS-KJXMEXGPSA-N 0 3 405.311 4.311 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](NCCC[C@H]2CCCC[C@@H]2O)c2ccc(F)cc2)c1 ZINC000494046364 905386078 /nfs/dbraw/zinc/38/60/78/905386078.db2.gz DBCVRCCRDKEHRX-MQNAVGNWSA-N 0 3 419.562 4.240 20 0 HIADHN COC[C@H](NC(=O)NC[C@@H](c1cccs1)N1CCCC1)c1ccc(Cl)cc1 ZINC000494219119 905549305 /nfs/dbraw/zinc/54/93/05/905549305.db2.gz HMKAFCHIZNRXLV-ROUUACIJSA-N 0 3 407.967 4.225 20 0 HIADHN O=C(CCN(CCO)Cc1cccc(F)c1)Nc1ccccc1Oc1ccccc1 ZINC000494228129 905557325 /nfs/dbraw/zinc/55/73/25/905557325.db2.gz TUADZIKDCHVVKS-UHFFFAOYSA-N 0 3 408.473 4.441 20 0 HIADHN Cc1ccnc(-c2n[n-]c([C@@H](C)N[C@H]3C[C@H]4CC[C@@H](C3)[N@H+]4Cc3ccccc3)n2)c1 ZINC000494421863 905707391 /nfs/dbraw/zinc/70/73/91/905707391.db2.gz AKFAQIAWSSAJOV-AYWYSENESA-N 0 3 402.546 4.021 20 0 HIADHN Cc1ccnc(-c2n[n-]c([C@@H](C)N[C@H]3C[C@H]4CC[C@@H](C3)[N@@H+]4Cc3ccccc3)n2)c1 ZINC000494421863 905707402 /nfs/dbraw/zinc/70/74/02/905707402.db2.gz AKFAQIAWSSAJOV-AYWYSENESA-N 0 3 402.546 4.021 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N[C@@H](C)c2nc(C(F)(F)F)cs2)C1 ZINC000494429908 905716900 /nfs/dbraw/zinc/71/69/00/905716900.db2.gz LKFUZORELJSBEB-GZBFAFLISA-N 0 3 412.481 4.358 20 0 HIADHN O[C@@H](CCc1ccccc1)CNCc1cnn(Cc2ccc(C(F)(F)F)cc2)c1 ZINC000494432165 905719381 /nfs/dbraw/zinc/71/93/81/905719381.db2.gz SGGNUWGGQASTRP-NRFANRHFSA-N 0 3 403.448 4.034 20 0 HIADHN CC(C)S(=O)(=O)c1ccc(CN[C@H]2CCO[C@@H]2c2ccc(Cl)c(F)c2)cc1 ZINC000494478076 905758372 /nfs/dbraw/zinc/75/83/72/905758372.db2.gz RWALYPPOGNPCJD-VQTJNVASSA-N 0 3 411.926 4.281 20 0 HIADHN CCS(=O)(=O)c1ccc(CN[C@@H]2CCc3cc(Br)cc(C)c32)cc1 ZINC000494481910 905762939 /nfs/dbraw/zinc/76/29/39/905762939.db2.gz CSKAXEUUHFPUEM-GOSISDBHSA-N 0 3 408.361 4.328 20 0 HIADHN C[C@H](Cn1cc(Br)cn1)N[C@@H]1CSc2ccc(Br)cc21 ZINC000494485421 905768437 /nfs/dbraw/zinc/76/84/37/905768437.db2.gz RPICQXZOMNRHLA-NOZJJQNGSA-N 0 3 417.170 4.233 20 0 HIADHN Fc1cc([C@@H]2OCC[C@@H]2NCc2ccc(OCC(F)(F)F)nc2)ccc1Cl ZINC000494505689 905797382 /nfs/dbraw/zinc/79/73/82/905797382.db2.gz KCACRZTZXIDBOD-RDJZCZTQSA-N 0 3 404.791 4.435 20 0 HIADHN C/C(=C/c1ccccc1)CN(C)C(=O)NCCCCN1CCN(c2ccccc2)CC1 ZINC000494521508 905810979 /nfs/dbraw/zinc/81/09/79/905810979.db2.gz DIFSRAGUIBPKAX-LNVKXUELSA-N 0 3 420.601 4.334 20 0 HIADHN Cc1ccc(-n2nc(C(=O)NC[C@@H](c3ccccc3)N3CCCC3)c3c2CCC3)cc1 ZINC000512468402 921181339 /nfs/dbraw/zinc/18/13/39/921181339.db2.gz MBSIDTQJJXEFQJ-DEOSSOPVSA-N 0 3 414.553 4.236 20 0 HIADHN CC(C)(C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1)c1ccccc1Cl ZINC000494545009 905826055 /nfs/dbraw/zinc/82/60/55/905826055.db2.gz PVINTHCTJMUDMQ-UHFFFAOYSA-N 0 3 418.940 4.416 20 0 HIADHN CC(C)(C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1)c1cccc(Cl)c1 ZINC000494548151 905828487 /nfs/dbraw/zinc/82/84/87/905828487.db2.gz XWDLGIUPQHYXJG-UHFFFAOYSA-N 0 3 418.940 4.416 20 0 HIADHN CC(C)Oc1cc(F)ccc1NC(=O)N(C)C1CCN(CCc2ccccn2)CC1 ZINC000494551676 905829843 /nfs/dbraw/zinc/82/98/43/905829843.db2.gz CWFPMWGRPRIMHH-UHFFFAOYSA-N 0 3 414.525 4.179 20 0 HIADHN CC(=O)N1CC[C@@H](NCc2cccc(COCC(F)(F)F)c2)c2ccccc2C1 ZINC000494572024 905842771 /nfs/dbraw/zinc/84/27/71/905842771.db2.gz VMQZPKYSFNSVGD-OAQYLSRUSA-N 0 3 406.448 4.349 20 0 HIADHN CCCC(=O)NC[C@H]1CCCN(Cc2ccc(OCc3cccs3)c(OC)c2)C1 ZINC000512475237 921185422 /nfs/dbraw/zinc/18/54/22/921185422.db2.gz QTRAUQDTOQTDEQ-LJQANCHMSA-N 0 3 416.587 4.464 20 0 HIADHN FC(F)(F)c1ccc(Cn2cc(CNCCOc3ncccc3Cl)cn2)cc1 ZINC000494621557 905868920 /nfs/dbraw/zinc/86/89/20/905868920.db2.gz SSRPBSDROYQFBW-UHFFFAOYSA-N 0 3 410.827 4.167 20 0 HIADHN Cc1cc(NC(=O)Nc2cc([C@@H]3C[C@@H]3C)[nH]n2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000494648149 905881259 /nfs/dbraw/zinc/88/12/59/905881259.db2.gz KKHGJRHGVMTDJA-ZYSHUDEJSA-N 0 3 419.533 4.129 20 0 HIADHN C[C@H](c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCN(C[C@H]2CCOC2)CC1 ZINC000494705412 905911235 /nfs/dbraw/zinc/91/12/35/905911235.db2.gz ZDKWOOAYJFHCTE-ZIAGYGMSSA-N 0 3 410.402 4.439 20 0 HIADHN CCOc1cc(CN2CCC[C@H](CNC(=O)Nc3cccc(F)c3)C2)ccc1OC ZINC000512480514 921190145 /nfs/dbraw/zinc/19/01/45/921190145.db2.gz OLUKRSWUSDXONR-GOSISDBHSA-N 0 3 415.509 4.267 20 0 HIADHN COc1ccc([C@H](NCC2CCS(=O)(=O)CC2)c2ccccc2Cl)c(C)c1 ZINC000494728507 905928732 /nfs/dbraw/zinc/92/87/32/905928732.db2.gz DLECUWJCJSNMHD-NRFANRHFSA-N 0 3 407.963 4.161 20 0 HIADHN CC(C)c1ccc(O[C@@H](C)CNC(=O)N(Cc2ccco2)C2CCN(C)CC2)cc1 ZINC000512482484 921191225 /nfs/dbraw/zinc/19/12/25/921191225.db2.gz FKGTWKFGOZJBOS-IBGZPJMESA-N 0 3 413.562 4.476 20 0 HIADHN COC[C@H](N[C@@H]1CCc2nnc(-c3ccc(F)cc3)n2C1)c1ccc(Cl)cc1 ZINC000494759632 905957520 /nfs/dbraw/zinc/95/75/20/905957520.db2.gz WMMJRRYWHBQINX-MOPGFXCFSA-N 0 3 400.885 4.030 20 0 HIADHN COc1ccc(Br)c(CC(=O)NC[C@H](c2cccs2)N2CCCC2)c1 ZINC000494770049 905966496 /nfs/dbraw/zinc/96/64/96/905966496.db2.gz MQKMQQZLOGBVSR-QGZVFWFLSA-N 0 3 423.376 4.015 20 0 HIADHN COc1ccc(Br)c(CC(=O)NC[C@@H](c2cccs2)N2CCCC2)c1 ZINC000494770046 905967533 /nfs/dbraw/zinc/96/75/33/905967533.db2.gz MQKMQQZLOGBVSR-KRWDZBQOSA-N 0 3 423.376 4.015 20 0 HIADHN CN(C)CCN(Cc1cccc(O)c1)C(=O)c1ccc(-c2nc3ccccc3s2)o1 ZINC000494781527 905980419 /nfs/dbraw/zinc/98/04/19/905980419.db2.gz WKFXFJNZWVZCIN-UHFFFAOYSA-N 0 3 421.522 4.466 20 0 HIADHN FC(F)(F)c1ccn(-c2ccc(CN[C@@H](c3nnc[nH]3)C3CCCCC3)cc2)n1 ZINC000494899476 906074626 /nfs/dbraw/zinc/07/46/26/906074626.db2.gz BJDUWNZDKXQBPI-GOSISDBHSA-N 0 3 404.440 4.420 20 0 HIADHN O=C(COc1ccccc1CNCCn1ccc2cc(Cl)ccc21)N1CCCC1 ZINC000512501634 921203446 /nfs/dbraw/zinc/20/34/46/921203446.db2.gz NCWZIPPMSKDDMX-UHFFFAOYSA-N 0 3 411.933 4.086 20 0 HIADHN CN1CCN(CC(=O)Nc2ccc3c(c2)OC2(CCCCC2)O3)C2(CCCCC2)C1 ZINC000494905270 906081712 /nfs/dbraw/zinc/08/17/12/906081712.db2.gz AMZBVSNAZUFDTA-UHFFFAOYSA-N 0 3 413.562 4.007 20 0 HIADHN C[C@@H]1CN(c2ccc(CN[C@H](C[C@H]3CCOC3)c3ccc(F)cc3)cn2)C[C@@H](C)O1 ZINC000494917411 906090335 /nfs/dbraw/zinc/09/03/35/906090335.db2.gz AYWHCEHPCYEPKJ-FZONSQQESA-N 0 3 413.537 4.092 20 0 HIADHN C[C@@H](CCO)C1(CN[C@@H](c2ccc(F)cc2)c2cccc(S(C)(=O)=O)c2)CCC1 ZINC000494959890 906130606 /nfs/dbraw/zinc/13/06/06/906130606.db2.gz YVZYVROPGGIQQR-JTSKRJEESA-N 0 3 419.562 4.097 20 0 HIADHN CCc1ccc([C@H](NCC2([C@H](O)C(C)C)CC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000494966968 906135639 /nfs/dbraw/zinc/13/56/39/906135639.db2.gz CUAQPIOZUSMMGY-XZOQPEGZSA-N 0 3 415.599 4.129 20 0 HIADHN Cc1cc(CN[C@H](c2nnc[nH]2)C2CCCCC2)ccc1I ZINC000494973185 906139531 /nfs/dbraw/zinc/13/95/31/906139531.db2.gz KJYXFIJVWONYTA-INIZCTEOSA-N 0 3 410.303 4.129 20 0 HIADHN O=S1(=O)CC[C@H](NC[C@@H]2CCCCC(F)(F)C2)c2cc(Br)ccc21 ZINC000494996435 906158224 /nfs/dbraw/zinc/15/82/24/906158224.db2.gz ILFXEFZMXDLDSW-DOMZBBRYSA-N 0 3 422.335 4.473 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N(Cc2ccc(F)cc2)C2CCOCC2)N(C)C)cc1 ZINC000494998847 906160926 /nfs/dbraw/zinc/16/09/26/906160926.db2.gz QPDFECYTWRDUNO-QHCPKHFHSA-N 0 3 413.537 4.128 20 0 HIADHN COc1cc(C)c(NC(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)c(C)c1C ZINC000495008550 906169556 /nfs/dbraw/zinc/16/95/56/906169556.db2.gz MHFUAUVSCPKFSX-ROUUACIJSA-N 0 3 417.594 4.364 20 0 HIADHN Fc1ccc(CN2CCC[C@H](N[C@@H](c3nc[nH]n3)C3CCCCC3)C2)c(Cl)c1 ZINC000495036483 906192361 /nfs/dbraw/zinc/19/23/61/906192361.db2.gz MZMQWSMXZBLYRX-AZUAARDMSA-N 0 3 405.949 4.473 20 0 HIADHN O=C(CN[C@H](C[C@H]1CCOC1)c1ccc(F)cc1)N1CCC(Cc2ccccc2)CC1 ZINC000495081081 906228223 /nfs/dbraw/zinc/22/82/23/906228223.db2.gz SNEJNJHUPNSHRM-RCZVLFRGSA-N 0 3 424.560 4.364 20 0 HIADHN Brc1ccc(N2CC[C@@H](N[C@H](c3nc[nH]n3)C3CCCCC3)C2)cc1 ZINC000495081638 906228309 /nfs/dbraw/zinc/22/83/09/906228309.db2.gz UHJGGSPORDTIRS-AEFFLSMTSA-N 0 3 404.356 4.057 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)NCc2nc(-c3ccccc3F)cs2)N(C)C)cc1 ZINC000495169177 906283608 /nfs/dbraw/zinc/28/36/08/906283608.db2.gz BDCFWKNUUOYXIL-HXUWFJFHSA-N 0 3 412.534 4.360 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)Nc1ccn(-c2ccccc2Cl)n1 ZINC000495232856 906325476 /nfs/dbraw/zinc/32/54/76/906325476.db2.gz NAFGWPQFPHHPAY-UHFFFAOYSA-N 0 3 415.900 4.261 20 0 HIADHN Cc1c2ccc(F)cc2sc1C(=O)N1CCC(CN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000495330837 906380610 /nfs/dbraw/zinc/38/06/10/906380610.db2.gz CTTIWMGHHYQMJH-GJZGRUSLSA-N 0 3 404.551 4.310 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)c2ccc(OC(F)F)c(F)c2)cc1 ZINC000495345044 906391162 /nfs/dbraw/zinc/39/11/62/906391162.db2.gz INRRNBCTKRPOCK-SFHVURJKSA-N 0 3 408.420 4.003 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)N[C@H](C)c2nc(-c3ccccc3)cs2)cc1 ZINC000495425452 906443209 /nfs/dbraw/zinc/44/32/09/906443209.db2.gz BEEOEECUYDURME-OXQOHEQNSA-N 0 3 424.570 4.482 20 0 HIADHN Cc1cc(OC[C@H](O)CN2CCC[C@](O)(C(F)(F)F)CC2)c(C(C)C)cc1Cl ZINC000512562586 921238162 /nfs/dbraw/zinc/23/81/62/921238162.db2.gz YSBKBLMNUWZVQZ-DNVCBOLYSA-N 0 3 423.903 4.291 20 0 HIADHN O=C(Nc1ccc(Oc2ccccn2)cc1)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000495493858 906483134 /nfs/dbraw/zinc/48/31/34/906483134.db2.gz MHBLKHZCUWFMEX-UHFFFAOYSA-N 0 3 417.509 4.331 20 0 HIADHN CCS(=O)(=O)c1ccc(N2CCC(N[C@@H](C)c3ccc(F)cc3F)CC2)cc1 ZINC000495682459 906524073 /nfs/dbraw/zinc/52/40/73/906524073.db2.gz IGGQHLZBDVNVJB-HNNXBMFYSA-N 0 3 408.514 4.078 20 0 HIADHN CCCN(C)[C@@H](CNCc1csc(N(C(C)=O)C2CC2)n1)c1ccc(Cl)cc1 ZINC000512570591 921242975 /nfs/dbraw/zinc/24/29/75/921242975.db2.gz WQKUYVGYMDHPPX-FQEVSTJZSA-N 0 3 421.010 4.485 20 0 HIADHN CCn1nc(C)c(CN2CCC(C(=O)Nc3ccc(Br)cc3)CC2)c1C ZINC000512575596 921246147 /nfs/dbraw/zinc/24/61/47/921246147.db2.gz ZTTKHLVHZGAAGD-UHFFFAOYSA-N 0 3 419.367 4.133 20 0 HIADHN COc1ccc(CN2CCC(C(=O)N[C@H](C)C(C)C)CC2)cc1OCCC(C)C ZINC000512588995 921251994 /nfs/dbraw/zinc/25/19/94/921251994.db2.gz ZZGPVYLIOJVLGX-LJQANCHMSA-N 0 3 404.595 4.493 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)c1cc(F)cc(Br)c1 ZINC000496259988 906640300 /nfs/dbraw/zinc/64/03/00/906640300.db2.gz CJHKJKXRWIHOMK-IBGZPJMESA-N 0 3 420.326 4.110 20 0 HIADHN CN(C(=O)c1cccc(Oc2ccncc2)c1)C1CCN(CCc2ccccn2)CC1 ZINC000496428684 906677752 /nfs/dbraw/zinc/67/77/52/906677752.db2.gz NCPXPYJVALLPCV-UHFFFAOYSA-N 0 3 416.525 4.048 20 0 HIADHN Cn1ncc(NC(=O)N2CCCN(CCCc3ccccc3)CC2)c1-c1ccccc1 ZINC000496725084 906744729 /nfs/dbraw/zinc/74/47/29/906744729.db2.gz UDJXGIKWKJWNNU-UHFFFAOYSA-N 0 3 417.557 4.260 20 0 HIADHN Cc1nc(COc2ccc(CN3CCC(C(=O)N[C@@H](C)C(C)C)CC3)cc2)cs1 ZINC000512627143 921266715 /nfs/dbraw/zinc/26/67/15/921266715.db2.gz AMBYFXUVVVDCDB-KRWDZBQOSA-N 0 3 415.603 4.403 20 0 HIADHN Cc1nn(Cc2ccc(C)cc2)c(C)c1CN1CCC(C(=O)N[C@H](C)C(C)C)CC1 ZINC000512634966 921269702 /nfs/dbraw/zinc/26/97/02/921269702.db2.gz VWLWRYVYKBRZRI-LJQANCHMSA-N 0 3 410.606 4.229 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)c2cc(Br)ccc2Cl)CC1 ZINC000497357331 906850513 /nfs/dbraw/zinc/85/05/13/906850513.db2.gz NVRQASCDADJYCM-UHFFFAOYSA-N 0 3 411.727 4.432 20 0 HIADHN Cc1ccc(CNC(=O)C2CCN(Cc3c[nH]nc3-c3ccc(C)cc3)CC2)cc1 ZINC000512652024 921275207 /nfs/dbraw/zinc/27/52/07/921275207.db2.gz HABWWLVAWABOCI-UHFFFAOYSA-N 0 3 402.542 4.222 20 0 HIADHN CCCNC(=O)[C@H]1CCCN(Cc2c(-c3ccc(Cl)cc3)nc3sccn23)C1 ZINC000497421260 906894300 /nfs/dbraw/zinc/89/43/00/906894300.db2.gz VLUFSSMNDMYLPU-INIZCTEOSA-N 0 3 416.978 4.454 20 0 HIADHN O=C1COc2ccc(CN3CCC(COc4ccccc4C(F)(F)F)CC3)cc2N1 ZINC000512657981 921277568 /nfs/dbraw/zinc/27/75/68/921277568.db2.gz MAPGFCQOEFHLBJ-UHFFFAOYSA-N 0 3 420.431 4.327 20 0 HIADHN CCC[C@H](C)NC(=O)[C@@H]1CCCN(Cc2cccc(C(=O)Nc3ccccc3)c2)C1 ZINC000497448288 906922961 /nfs/dbraw/zinc/92/29/61/906922961.db2.gz YJDWDRXVTLGUEI-SIKLNZKXSA-N 0 3 407.558 4.456 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)NC[C@@H]3CC4c5ccccc5C3c3ccccc34)[C@H]2C1 ZINC000497483042 906965192 /nfs/dbraw/zinc/96/51/92/906965192.db2.gz LTYYQIAIKNWPBT-MAGMKFGASA-N 0 3 401.554 4.019 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)NC[C@H]3CC4c5ccccc5C3c3ccccc34)[C@H]2C1 ZINC000497483031 906965803 /nfs/dbraw/zinc/96/58/03/906965803.db2.gz LTYYQIAIKNWPBT-DCDIZQDESA-N 0 3 401.554 4.019 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)N[C@@H](c3ccccc3Cl)c3cc(F)ccc3F)[C@@H]2C1 ZINC000497491233 906975048 /nfs/dbraw/zinc/97/50/48/906975048.db2.gz DDRRESJLNOAYRS-IFZYUDKTSA-N 0 3 419.903 4.443 20 0 HIADHN COc1cccc([C@H](NC(=O)N2CC[C@H]3CCN(C)C[C@@H]32)c2ccccc2Cl)c1 ZINC000497503596 906991192 /nfs/dbraw/zinc/99/11/92/906991192.db2.gz LGDOEDHLHHBJNV-XGRCMKMKSA-N 0 3 413.949 4.174 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)NCc3ccc(OC(C)(C)C)cc3C(F)(F)F)[C@@H]2C1 ZINC000497509623 906999695 /nfs/dbraw/zinc/99/96/95/906999695.db2.gz VDAQKJMBXFBYNR-KBXCAEBGSA-N 0 3 413.484 4.118 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1ccc(Cl)cc1OCC(F)F ZINC000497530208 907020568 /nfs/dbraw/zinc/02/05/68/907020568.db2.gz QJWUWTBJEPVGBX-UHFFFAOYSA-N 0 3 401.841 4.173 20 0 HIADHN COc1cc(C)c(CN(C)C[C@H](O)COc2ccc(Cl)cc2Cl)cc1OC ZINC000497586854 907068635 /nfs/dbraw/zinc/06/86/35/907068635.db2.gz BJJYIFCNNLORKJ-INIZCTEOSA-N 0 3 414.329 4.191 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)c1csc(Cc2ccccc2)n1 ZINC000512703985 921292599 /nfs/dbraw/zinc/29/25/99/921292599.db2.gz JWJJTJFNOFKNAD-OAQYLSRUSA-N 0 3 420.582 4.256 20 0 HIADHN COc1ccc(CNC(=O)C2CCN(Cc3ccc(-c4ccccc4)o3)CC2)cc1 ZINC000512705471 921292900 /nfs/dbraw/zinc/29/29/00/921292900.db2.gz KMEAFIQORBCQEZ-UHFFFAOYSA-N 0 3 404.510 4.484 20 0 HIADHN CC(C)(C)c1nn(-c2ccccc2Cl)cc1CN1CCC[C@H](CCC(N)=O)C1 ZINC000512706209 921293263 /nfs/dbraw/zinc/29/32/63/921293263.db2.gz WTSBRLYEHMLSFS-MRXNPFEDSA-N 0 3 402.970 4.301 20 0 HIADHN C[C@H](NC(=O)N1CC[C@@H]2CCN(C)C[C@@H]21)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000497628604 907109256 /nfs/dbraw/zinc/10/92/56/907109256.db2.gz PXZHHBMBWSZKAD-NYDSKATKSA-N 0 3 411.521 4.201 20 0 HIADHN CCc1nc(C(=O)NC[C@@H]2CCCN(C)[C@H]2c2ccc(C(F)(F)F)cc2)c(C)o1 ZINC000512734111 921299156 /nfs/dbraw/zinc/29/91/56/921299156.db2.gz IVDLZNNLVVEQLF-KXBFYZLASA-N 0 3 409.452 4.377 20 0 HIADHN COc1cc(C)c([C@@H](C)NC(=O)NC[C@@H]2CCCN2Cc2ccccc2)cc1OC ZINC000497668527 907167899 /nfs/dbraw/zinc/16/78/99/907167899.db2.gz LIAZCEPOKOLQRW-QUCCMNQESA-N 0 3 411.546 4.037 20 0 HIADHN CS[C@H]1CN(C(=O)Nc2ccc(Sc3nc(C)cs3)cc2)C[C@@H]1N(C)C ZINC000497674659 907177185 /nfs/dbraw/zinc/17/71/85/907177185.db2.gz AYAVZYNDBAAMNH-HOTGVXAUSA-N 0 3 408.618 4.112 20 0 HIADHN CC(C)Cn1ncc(NC(=O)NC[C@@H](c2cccs2)N2CCCC2)c1C1CC1 ZINC000497677130 907178732 /nfs/dbraw/zinc/17/87/32/907178732.db2.gz JVOOVCLHWZHSPT-SFHVURJKSA-N 0 3 401.580 4.437 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)c1ccnc(OCc2ccccc2)c1 ZINC000497728667 907227203 /nfs/dbraw/zinc/22/72/03/907227203.db2.gz XYPFKHNWNZDRIU-HSZRJFAPSA-N 0 3 401.510 4.228 20 0 HIADHN C[C@@H](NC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1)c1nccn1-c1ccccc1 ZINC000512780216 921310183 /nfs/dbraw/zinc/31/01/83/921310183.db2.gz YRXVCSBTNMFAAX-NFBKMPQASA-N 0 3 417.557 4.239 20 0 HIADHN CCc1ccc([C@H](CNC(=O)CCc2ncc(-c3ccc(OC)cc3)o2)N(C)C)cc1 ZINC000497805992 907291385 /nfs/dbraw/zinc/29/13/85/907291385.db2.gz VQDQBLZCTLQSPV-QFIPXVFZSA-N 0 3 421.541 4.264 20 0 HIADHN CC(C)c1noc2nc(C3CC3)cc(C(=O)N[C@@H]3CN(C)C[C@H]3c3ccccc3)c21 ZINC000497806023 907291589 /nfs/dbraw/zinc/29/15/89/907291589.db2.gz WMZUKYXDYGNOIP-AZUAARDMSA-N 0 3 404.514 4.051 20 0 HIADHN CC(C)(C)[C@H](NC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2)c1cc2ccccc2o1 ZINC000497811677 907295761 /nfs/dbraw/zinc/29/57/61/907295761.db2.gz FRSCRASOJBGQIJ-HOYKHHGWSA-N 0 3 422.525 4.434 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)N[C@@H](C)[C@H](OC)c2ccc(Cl)cc2)cc1 ZINC000497847805 907326339 /nfs/dbraw/zinc/32/63/39/907326339.db2.gz QEXMPQXLKVPPEE-JHVJFLLYSA-N 0 3 419.953 4.027 20 0 HIADHN CCCOc1cccc(CN[C@@H](C)c2ccc(S(=O)(=O)N(CC)CC)cc2)c1 ZINC000512817133 921321287 /nfs/dbraw/zinc/32/12/87/921321287.db2.gz UFCMXBVUUGIZNW-SFHVURJKSA-N 0 3 404.576 4.357 20 0 HIADHN CCCOc1cccc(CN[C@H](C)c2ccc(S(=O)(=O)N(CC)CC)cc2)c1 ZINC000512817127 921321441 /nfs/dbraw/zinc/32/14/41/921321441.db2.gz UFCMXBVUUGIZNW-GOSISDBHSA-N 0 3 404.576 4.357 20 0 HIADHN Cc1cccc([C@H](NC(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)c2ccccn2)c1 ZINC000497958591 907429394 /nfs/dbraw/zinc/42/93/94/907429394.db2.gz PXNZVRVEWKNZSX-SGNDLWITSA-N 0 3 400.526 4.224 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)c3cc4cccc(C)c4o3)CC2)c1 ZINC000497966014 907434867 /nfs/dbraw/zinc/43/48/67/907434867.db2.gz JIUAPINOKQMVFB-UHFFFAOYSA-N 0 3 405.542 4.382 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)CCc3ccc(C)cc3C)CC2)c1 ZINC000497970327 907440468 /nfs/dbraw/zinc/44/04/68/907440468.db2.gz ZUURQQROVBZCMP-UHFFFAOYSA-N 0 3 407.602 4.263 20 0 HIADHN Cc1ccc(NC(=O)[C@@H](C)N2CCN(CC3CCCCC3)CC2)c(Br)c1 ZINC000497994653 907475373 /nfs/dbraw/zinc/47/53/73/907475373.db2.gz AWJVDYYNUOYMII-QGZVFWFLSA-N 0 3 422.411 4.282 20 0 HIADHN Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)NC[C@H](c1ccccc1)N1CCCC1 ZINC000497998562 907482252 /nfs/dbraw/zinc/48/22/52/907482252.db2.gz VOPJVVUSHLRHMN-HSZRJFAPSA-N 0 3 422.573 4.339 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)N2CCC[C@H](C(F)(F)F)[C@@H]2C)N(C)C)cc1 ZINC000512825274 921329865 /nfs/dbraw/zinc/32/98/65/921329865.db2.gz DBSJGGNQTANIFP-SNRMKQJTSA-N 0 3 415.500 4.449 20 0 HIADHN CC(C)CCOC1CCN(C(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)CC1 ZINC000512826486 921331030 /nfs/dbraw/zinc/33/10/30/921331030.db2.gz JLDOVFUJNJUWRI-QHCPKHFHSA-N 0 3 419.610 4.313 20 0 HIADHN CC(C)CCOC1CCN(C(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)CC1 ZINC000512826484 921331619 /nfs/dbraw/zinc/33/16/19/921331619.db2.gz JLDOVFUJNJUWRI-HSZRJFAPSA-N 0 3 419.610 4.313 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)N2CCc3[nH]c4ccccc4c3C2)N(C)C)cc1 ZINC000512828030 921332401 /nfs/dbraw/zinc/33/24/01/921332401.db2.gz OSONMHPDIXUJBU-DEOSSOPVSA-N 0 3 420.557 4.326 20 0 HIADHN Cc1cnc([C@H](NC(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)C2CC2)s1 ZINC000498105594 907615643 /nfs/dbraw/zinc/61/56/43/907615643.db2.gz CEGKDPZUOVDXJI-WOJBJXKFSA-N 0 3 416.591 4.292 20 0 HIADHN CC1CCN([C@@H](CNC(=O)NCc2ncc(C(C)(C)C)o2)c2cccs2)CC1 ZINC000498125930 907643470 /nfs/dbraw/zinc/64/34/70/907643470.db2.gz IKJPQRVDOHDEDK-INIZCTEOSA-N 0 3 404.580 4.306 20 0 HIADHN CSc1ccsc1C(=O)N(CCN(C)C)Cc1ccc(Br)cc1 ZINC000498127047 907645396 /nfs/dbraw/zinc/64/53/96/907645396.db2.gz RFWWQUIGUUCVDX-UHFFFAOYSA-N 0 3 413.406 4.437 20 0 HIADHN CCCCCOc1ccc([C@H](C)NC(=O)N2CC[C@H]3CCN(C)C[C@@H]32)cc1OC ZINC000498155826 907681331 /nfs/dbraw/zinc/68/13/31/907681331.db2.gz FANOGXPPDGUONN-NSHGMRRFSA-N 0 3 403.567 4.061 20 0 HIADHN O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)[C@@H]1C[C@H]1c1cccc(Br)c1 ZINC000498168436 907695864 /nfs/dbraw/zinc/69/58/64/907695864.db2.gz CZQJOQMJBYCBCA-QHAWAJNXSA-N 0 3 413.359 4.333 20 0 HIADHN Cc1cccc([C@@H](NC(=O)NCCCN2CCc3ccccc3C2)c2ccccn2)c1 ZINC000498220712 907749682 /nfs/dbraw/zinc/74/96/82/907749682.db2.gz CBORYYCIMITUBL-RUZDIDTESA-N 0 3 414.553 4.227 20 0 HIADHN C[C@@H](CNC(=O)N[C@@H](c1cccc(F)c1)c1ccccn1)N(C)Cc1ccccc1 ZINC000498238329 907772016 /nfs/dbraw/zinc/77/20/16/907772016.db2.gz JZFREGSQOHKSFT-MBSDFSHPSA-N 0 3 406.505 4.130 20 0 HIADHN C[C@H](Cc1ccccc1)C(=O)NC1CCN(CCOc2ccc(Cl)cc2)CC1 ZINC000498256433 907793471 /nfs/dbraw/zinc/79/34/71/907793471.db2.gz XGIGWVCHBGUTTG-GOSISDBHSA-N 0 3 400.950 4.178 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)CCCCOc3cccc(C)c3)cc2)CC1 ZINC000498350036 907852377 /nfs/dbraw/zinc/85/23/77/907852377.db2.gz OZYZLOQVNRXIEM-UHFFFAOYSA-N 0 3 409.574 4.320 20 0 HIADHN CCC(CC)[C@H]1C[C@H](NC(=O)N(CCN(C)C)Cc2cccc(Cl)c2)CCO1 ZINC000498392398 907876668 /nfs/dbraw/zinc/87/66/68/907876668.db2.gz QJZYDIMTYSUKFF-NHCUHLMSSA-N 0 3 410.002 4.397 20 0 HIADHN Cc1ccc2nc(COc3ccc(C(=O)N(CCN(C)C)C4CCCC4)cc3)cn2c1 ZINC000498451754 907916218 /nfs/dbraw/zinc/91/62/18/907916218.db2.gz KEUJYAKNQNPFGL-UHFFFAOYSA-N 0 3 420.557 4.168 20 0 HIADHN CCN1CCN([C@@H](C)CNC(=O)c2cc(Cl)ccc2Oc2ccc(F)cc2)CC1 ZINC000498504399 907975282 /nfs/dbraw/zinc/97/52/82/907975282.db2.gz PSVJKDPBJVHFGO-INIZCTEOSA-N 0 3 419.928 4.027 20 0 HIADHN CCN1CCN([C@H](C)CNC(=O)c2cc3c(s2)-c2ccccc2C(C)(C)C3)CC1 ZINC000498515077 907986961 /nfs/dbraw/zinc/98/69/61/907986961.db2.gz RJKTZTCGARWJBT-QGZVFWFLSA-N 0 3 411.615 4.005 20 0 HIADHN CCN1CCN([C@@H](C)CNC(=O)c2cc3c(s2)-c2ccccc2C(C)(C)C3)CC1 ZINC000498515076 907987370 /nfs/dbraw/zinc/98/73/70/907987370.db2.gz RJKTZTCGARWJBT-KRWDZBQOSA-N 0 3 411.615 4.005 20 0 HIADHN C[C@@H](c1ccc(F)c(Cl)c1)N1CCC[C@@H](CN2CCN(c3ccccn3)CC2)C1 ZINC000498559974 908019490 /nfs/dbraw/zinc/01/94/90/908019490.db2.gz LIXXFPGDLXPGGZ-OALUTQOASA-N 0 3 416.972 4.469 20 0 HIADHN CCCCCC(=O)NC1CCN(CCC(=O)Nc2c(Cl)cccc2Cl)CC1 ZINC000498662841 908097998 /nfs/dbraw/zinc/09/79/98/908097998.db2.gz MPOBTEYNKIHDCV-UHFFFAOYSA-N 0 3 414.377 4.483 20 0 HIADHN C[C@@H](NCc1ccc(-c2ccccc2Br)cc1)C1(S(C)(=O)=O)CC1 ZINC000512885268 921379836 /nfs/dbraw/zinc/37/98/36/921379836.db2.gz NGYHAAPFJITIGE-CQSZACIVSA-N 0 3 408.361 4.171 20 0 HIADHN C[C@H]1CCN(C)CCN1C(=O)c1cccc(OCc2ccccc2Br)c1 ZINC000498708464 908134221 /nfs/dbraw/zinc/13/42/21/908134221.db2.gz UZTNUIGHTNBJFE-INIZCTEOSA-N 0 3 417.347 4.194 20 0 HIADHN Cc1ccc2[nH]c3c(c2c1)C[C@H](NC(=O)N(CCN(C)C)Cc1cccs1)CC3 ZINC000498710109 908136447 /nfs/dbraw/zinc/13/64/47/908136447.db2.gz NRBYUDPBTLTANG-QGZVFWFLSA-N 0 3 410.587 4.169 20 0 HIADHN Cc1ccc(-c2nc(CNC(=O)N[C@@H]3CCN(Cc4ccccc4)[C@@H]3C)co2)cc1 ZINC000498720502 908145444 /nfs/dbraw/zinc/14/54/44/908145444.db2.gz IENBCHXHOLGNDC-XMSQKQJNSA-N 0 3 404.514 4.112 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)c1csc(Br)c1 ZINC000498724330 908149596 /nfs/dbraw/zinc/14/95/96/908149596.db2.gz GEFXGYJDFJVOGU-MRXNPFEDSA-N 0 3 408.365 4.032 20 0 HIADHN Cc1nc(Cc2ccccc2)sc1C(=O)N(CCN(C)C)Cc1ccc(F)cc1 ZINC000498723782 908150415 /nfs/dbraw/zinc/15/04/15/908150415.db2.gz ATDKIUGESSIVOS-UHFFFAOYSA-N 0 3 411.546 4.385 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)[C@@H]1C[C@H]1c1cccc(Br)c1 ZINC000498724821 908152553 /nfs/dbraw/zinc/15/25/53/908152553.db2.gz NGIONQGHEWSGAQ-VQTJNVASSA-N 0 3 419.338 4.282 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)c1cc2c(cccc2Br)[nH]1 ZINC000498726675 908154295 /nfs/dbraw/zinc/15/42/95/908154295.db2.gz ADGIKBGPPBBRNR-UHFFFAOYSA-N 0 3 418.310 4.274 20 0 HIADHN C[C@H](NCc1ccc(Oc2cccc(Br)c2)cc1)C1(S(C)(=O)=O)CC1 ZINC000512892042 921385469 /nfs/dbraw/zinc/38/54/69/921385469.db2.gz UEKVRCCFGAOWIU-AWEZNQCLSA-N 0 3 424.360 4.297 20 0 HIADHN Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000498825201 908233470 /nfs/dbraw/zinc/23/34/70/908233470.db2.gz GEXSWDBVAWAVAT-QHCPKHFHSA-N 0 3 420.557 4.190 20 0 HIADHN O=C(N[C@H](c1cccc(F)c1)c1ccccn1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000498888434 908291207 /nfs/dbraw/zinc/29/12/07/908291207.db2.gz CXAPGSHXOYNNKF-GBXCKJPGSA-N 0 3 421.491 4.478 20 0 HIADHN CO[C@H](C)c1nc(CNC(=O)NC[C@H](c2ccc(CC(C)C)cc2)N(C)C)cs1 ZINC000498899329 908305904 /nfs/dbraw/zinc/30/59/04/908305904.db2.gz FNZJGTLIPIRMMJ-OXQOHEQNSA-N 0 3 418.607 4.151 20 0 HIADHN Cc1cc(CN2CCC[C@@H](c3nnc(C4CC4)[nH]3)C2)nc(-c2ccc(Cl)cc2)n1 ZINC000498916801 908325568 /nfs/dbraw/zinc/32/55/68/908325568.db2.gz IPWAMHTVNIEDNM-QGZVFWFLSA-N 0 3 408.937 4.481 20 0 HIADHN CC(C)[C@H](NCCC(=O)N(C)Cc1ccccc1Br)c1ccc(F)cn1 ZINC000498918825 908328552 /nfs/dbraw/zinc/32/85/52/908328552.db2.gz RZXKHJYONYUQAU-FQEVSTJZSA-N 0 3 422.342 4.319 20 0 HIADHN O=C(CN1CCC[C@@H](c2nc(C3CC3)n[nH]2)C1)N(Cc1ccccc1)c1ccccc1 ZINC000498928539 908337850 /nfs/dbraw/zinc/33/78/50/908337850.db2.gz YCMSOCBIPUQHKQ-OAQYLSRUSA-N 0 3 415.541 4.095 20 0 HIADHN O=C(CN1CCC[C@@H](c2n[nH]c(C3CC3)n2)C1)N(Cc1ccccc1)c1ccccc1 ZINC000498928539 908337865 /nfs/dbraw/zinc/33/78/65/908337865.db2.gz YCMSOCBIPUQHKQ-OAQYLSRUSA-N 0 3 415.541 4.095 20 0 HIADHN CCN1C[C@@H](C)N(Cc2csc(N(C(C)=O)c3ccc(C)c(C)c3)n2)C[C@@H]1C ZINC000498939566 908346647 /nfs/dbraw/zinc/34/66/47/908346647.db2.gz WATMLRRGRGXKHJ-ZWKOTPCHSA-N 0 3 400.592 4.359 20 0 HIADHN Cc1cccc([C@@H](NC(=O)N(CCN(C)C)Cc2ccccc2F)c2ccccn2)c1 ZINC000499012217 908388789 /nfs/dbraw/zinc/38/87/89/908388789.db2.gz HIZCLHXMNVJZIZ-XMMPIXPASA-N 0 3 420.532 4.392 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)N[C@@H](c2cccc(F)c2)c2ccccn2)CN1Cc1ccccc1 ZINC000499025391 908399596 /nfs/dbraw/zinc/39/95/96/908399596.db2.gz GTUSGFHACWELIB-XANCMCCPSA-N 0 3 418.516 4.272 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)c1ccc(Sc2ccccn2)cc1 ZINC000499052009 908422943 /nfs/dbraw/zinc/42/29/43/908422943.db2.gz HSXOICQLQKHZQF-UHFFFAOYSA-N 0 3 403.551 4.411 20 0 HIADHN C[C@@H](c1cccc(C(F)(F)F)c1)N(C)Cc1ccc(S(=O)(=O)N(C)C)cc1 ZINC000499070623 908436801 /nfs/dbraw/zinc/43/68/01/908436801.db2.gz QRWMRPJPWANWAA-AWEZNQCLSA-N 0 3 400.466 4.149 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)Nc1cccc(Cl)c1Cl)c1ccc(-n2cncn2)cc1 ZINC000499073462 908438738 /nfs/dbraw/zinc/43/87/38/908438738.db2.gz RKLAIOGFIOFBKS-OLZOCXBDSA-N 0 3 404.301 4.252 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)N2CC[C@H](C(F)(F)F)C2(C)C)N(C)C)cc1 ZINC000512918661 921412072 /nfs/dbraw/zinc/41/20/72/921412072.db2.gz ROJKXJJVRXHPIW-MSOLQXFVSA-N 0 3 415.500 4.449 20 0 HIADHN CC[C@H](NC(=O)N[C@H]1C[C@@H](C)N(Cc2ccccc2)C1)c1ccc(OC)c(OC)c1 ZINC000499186535 908541068 /nfs/dbraw/zinc/54/10/68/908541068.db2.gz HNBPCFFXBBOQHU-QMMLZNLJSA-N 0 3 411.546 4.117 20 0 HIADHN COc1ccc([C@H](C)NC(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)c(C)c1OC ZINC000499195977 908550711 /nfs/dbraw/zinc/55/07/11/908550711.db2.gz VAIYVXSBIVEAKE-XKGZKEIXSA-N 0 3 411.546 4.035 20 0 HIADHN O=C(c1ccc2oc(=O)[nH]c2c1)N1CCN(Cc2ccccc2)C2(CCCCC2)C1 ZINC000499242025 908608451 /nfs/dbraw/zinc/60/84/51/908608451.db2.gz DKCLULSCGUCBRT-UHFFFAOYSA-N 0 3 405.498 4.194 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N[C@@H](C)c1ccc(-n2ccnc2C)cc1)c1ccco1 ZINC000499326363 908701459 /nfs/dbraw/zinc/70/14/59/908701459.db2.gz FEZUECWNBRDAEO-FIKGOQFSSA-N 0 3 409.534 4.263 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N[C@@H](C)c1ccc(-n2ccnc2C)cc1)c1ccco1 ZINC000499326370 908701528 /nfs/dbraw/zinc/70/15/28/908701528.db2.gz FEZUECWNBRDAEO-XGHQBKJUSA-N 0 3 409.534 4.263 20 0 HIADHN CN(C(=O)NCCc1csc(C(C)(C)C)n1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000499332100 908705748 /nfs/dbraw/zinc/70/57/48/908705748.db2.gz UYPDIPGCLHIOAE-FQEVSTJZSA-N 0 3 414.619 4.289 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)NCCc1csc(-c2ccccc2)n1)c1ccco1 ZINC000499333573 908709504 /nfs/dbraw/zinc/70/95/04/908709504.db2.gz FPAZMUUYGSENSW-LPHOPBHVSA-N 0 3 412.559 4.374 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)c1cnn(-c2ccccc2)c1 ZINC000499382902 908746576 /nfs/dbraw/zinc/74/65/76/908746576.db2.gz JPQVLWMSSHQZCL-UHFFFAOYSA-N 0 3 416.447 4.095 20 0 HIADHN Cc1nn(-c2ccccc2)c(Oc2cccc(F)c2)c1CNCCCN1CCCC1=O ZINC000499665191 908870651 /nfs/dbraw/zinc/87/06/51/908870651.db2.gz VDXUIBXVTPZVCP-UHFFFAOYSA-N 0 3 422.504 4.214 20 0 HIADHN CCN(C(=O)Cc1cscc1Br)[C@H]1CCN(Cc2ccccc2)C1 ZINC000499734398 908894498 /nfs/dbraw/zinc/89/44/98/908894498.db2.gz XPRWTDNXXDPLTR-KRWDZBQOSA-N 0 3 407.377 4.176 20 0 HIADHN CN(C)CCN(C[C@H]1CCCO1)C(=O)c1cccc(OCc2cccc(Cl)c2)c1 ZINC000499895896 909018615 /nfs/dbraw/zinc/01/86/15/909018615.db2.gz PIRBENQTPCURAZ-JOCHJYFZSA-N 0 3 416.949 4.102 20 0 HIADHN CS(=O)(=O)C1(CNCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)CCCC1 ZINC000513002247 921468329 /nfs/dbraw/zinc/46/83/29/921468329.db2.gz WCLXYQSIWDDIMK-UHFFFAOYSA-N 0 3 403.388 4.171 20 0 HIADHN CCN(C(=O)c1cccc(NC(=O)NC2CC2)c1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000499998938 909450313 /nfs/dbraw/zinc/45/03/13/909450313.db2.gz HRNNKILQBOGLGG-MBSDFSHPSA-N 0 3 420.557 4.268 20 0 HIADHN CCN(C(=O)c1nnn(-c2cccc(C)c2)c1C)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000499997325 909451015 /nfs/dbraw/zinc/45/10/15/909451015.db2.gz FHQGWYVNEXJLFI-AUSIDOKSSA-N 0 3 417.557 4.182 20 0 HIADHN CCN(C(=O)c1nnn(-c2ccc(C)cc2)c1C)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000500011119 909465057 /nfs/dbraw/zinc/46/50/57/909465057.db2.gz YEUQYXKYIXVRNH-CVDCTZTESA-N 0 3 417.557 4.182 20 0 HIADHN CCN(C(=O)c1nnn(-c2ccc(C)cc2)c1C)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000500011117 909465310 /nfs/dbraw/zinc/46/53/10/909465310.db2.gz YEUQYXKYIXVRNH-AUSIDOKSSA-N 0 3 417.557 4.182 20 0 HIADHN CC(C)CCOc1ccc(C(=O)N(C)C2CCN(CCc3ccccn3)CC2)cc1 ZINC000500035342 909491645 /nfs/dbraw/zinc/49/16/45/909491645.db2.gz FHYUGNJRNPPDLU-UHFFFAOYSA-N 0 3 409.574 4.286 20 0 HIADHN CCc1nnc(NC(=O)[C@@H](C)[C@@H](C)NCc2ccc(-c3ccncc3)cc2F)s1 ZINC000513040995 921499706 /nfs/dbraw/zinc/49/97/06/921499706.db2.gz MJEXMWNLVVHLOE-UONOGXRCSA-N 0 3 413.522 4.055 20 0 HIADHN CCc1nnc(NC(=O)[C@@H](C)[C@H](C)NCc2ccc(Oc3ccccc3)o2)s1 ZINC000513041849 921501697 /nfs/dbraw/zinc/50/16/97/921501697.db2.gz SSLIGHMOYBTUME-KBPBESRZSA-N 0 3 400.504 4.239 20 0 HIADHN COCCN1CCC(NC(=O)[C@@H](Oc2cccc(C(C)C)c2)c2ccccc2)CC1 ZINC000500178297 909670224 /nfs/dbraw/zinc/67/02/24/909670224.db2.gz VWAVEYGEVKKYPR-DEOSSOPVSA-N 0 3 410.558 4.157 20 0 HIADHN Cc1ccc(C[C@@H]2CCCN2CC(=O)N2CCC(OCc3ccccc3)CC2)cc1 ZINC000500204810 909694313 /nfs/dbraw/zinc/69/43/13/909694313.db2.gz AEDJHDWOSUUABP-DEOSSOPVSA-N 0 3 406.570 4.210 20 0 HIADHN CNC(=O)[C@H]1CCC[C@H]1NCc1c(C)nn(-c2ccccc2)c1Oc1ccc(F)cc1 ZINC000500232477 909721252 /nfs/dbraw/zinc/72/12/52/909721252.db2.gz VZNLFSIUGRSFFL-RBBKRZOGSA-N 0 3 422.504 4.116 20 0 HIADHN CCc1nnc(NC(=O)[C@H](C)[C@@H](C)NCc2c(Cl)cccc2N2CCCC2)s1 ZINC000513064574 921520963 /nfs/dbraw/zinc/52/09/63/921520963.db2.gz QJFCSPZNCGCNOF-ZIAGYGMSSA-N 0 3 421.998 4.107 20 0 HIADHN O=C1[C@@H](N2CCN(CC3CCCCC3)CC2)CCN1c1ccc(C(F)(F)F)cc1 ZINC000500422472 909846422 /nfs/dbraw/zinc/84/64/22/909846422.db2.gz POJUQAZYSIWADU-FQEVSTJZSA-N 0 3 409.496 4.009 20 0 HIADHN CN(C)[C@@H](CNC(=O)CSc1ncc(C(F)(F)F)cc1Cl)c1ccccc1 ZINC000500566647 909933478 /nfs/dbraw/zinc/93/34/78/909933478.db2.gz CNKLFKRAIXKDSY-HNNXBMFYSA-N 0 3 417.884 4.265 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)[C@H](C)Cc1cnc2ccccc2n1 ZINC000500588512 909951159 /nfs/dbraw/zinc/95/11/59/909951159.db2.gz XYJXZNVODRGTNL-DVECYGJZSA-N 0 3 404.558 4.081 20 0 HIADHN CCc1nnc(NC(=O)[C@H](C)[C@@H](C)NCc2cc(Cl)cc(Cl)c2OC)s1 ZINC000513089852 921540054 /nfs/dbraw/zinc/54/00/54/921540054.db2.gz PTEOMOFPVDBZER-NXEZZACHSA-N 0 3 417.362 4.169 20 0 HIADHN CCN1CCN(Cc2ccc(CNC(=O)N(C)[C@@H](C)c3ccc(C)cc3)cc2)CC1 ZINC000500664424 910005013 /nfs/dbraw/zinc/00/50/13/910005013.db2.gz NXUADOBAVQLARL-NRFANRHFSA-N 0 3 408.590 4.035 20 0 HIADHN CCN1CCN(Cc2ccc(CNC(=O)N3CCC[C@@H]3c3ccc(C)cc3)cc2)CC1 ZINC000500668442 910008221 /nfs/dbraw/zinc/00/82/21/910008221.db2.gz WONMPAQTCROJIJ-RUZDIDTESA-N 0 3 420.601 4.179 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)N[C@@H](c2ccccc2)C(C)C)CC1 ZINC000500683255 910018711 /nfs/dbraw/zinc/01/87/11/910018711.db2.gz MUVDVIUJSKDCPE-XMMPIXPASA-N 0 3 408.590 4.021 20 0 HIADHN CC(C)CN(C(=O)CSCc1ccc(Br)cc1)C1CCN(C)CC1 ZINC000500695220 910028428 /nfs/dbraw/zinc/02/84/28/910028428.db2.gz NDOQLZIMLXTDFO-UHFFFAOYSA-N 0 3 413.425 4.261 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)CCCOc1cccc(Cl)c1Cl ZINC000500737557 910049405 /nfs/dbraw/zinc/04/94/05/910049405.db2.gz KUJGMVAJKQUSAH-UHFFFAOYSA-N 0 3 410.345 4.138 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCC1(C)CCOCC1)c1ccc(C(F)(F)F)cc1 ZINC000500768739 910069430 /nfs/dbraw/zinc/06/94/30/910069430.db2.gz HSQNPJUSJICAOU-SFHVURJKSA-N 0 3 415.500 4.204 20 0 HIADHN Cc1cc(C)n(Cc2cccc(C(=O)N[C@H]3CCN([C@H](C)c4ccccc4)C3)c2)n1 ZINC000500838114 910115400 /nfs/dbraw/zinc/11/54/00/910115400.db2.gz AIZGEHNJDLZKDF-YKSBVNFPSA-N 0 3 402.542 4.114 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)c2cccc(OCc3cccnc3)c2)C1 ZINC000500851987 910124737 /nfs/dbraw/zinc/12/47/37/910124737.db2.gz KXEUIAZRDQUGAP-AUSIDOKSSA-N 0 3 401.510 4.226 20 0 HIADHN Fc1ccc(-c2noc([C@@H]3CCCN(Cc4cccc5c4OCCCO5)C3)n2)cc1 ZINC000513107446 921554282 /nfs/dbraw/zinc/55/42/82/921554282.db2.gz VYGKBMJCFBLSLV-GOSISDBHSA-N 0 3 409.461 4.417 20 0 HIADHN C[C@@H](CC(=O)N[C@H]1CCN(Cc2ccccc2)CC1(C)C)C(=O)c1cccc(F)c1 ZINC000513110540 921557724 /nfs/dbraw/zinc/55/77/24/921557724.db2.gz QEYQQHXTKZQQDO-AVRDEDQJSA-N 0 3 410.533 4.452 20 0 HIADHN CN(C)Cc1cccc(NC(=O)NC[C@H](c2c(F)cccc2Cl)N2CCCC2)c1 ZINC000501033724 910249092 /nfs/dbraw/zinc/24/90/92/910249092.db2.gz VDQVEDNVJDGDGT-HXUWFJFHSA-N 0 3 418.944 4.499 20 0 HIADHN O=C(NCc1ccnc(N2CCCCCC2)c1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000501058580 910268929 /nfs/dbraw/zinc/26/89/29/910268929.db2.gz IUFHTIUUAWEIOQ-QFIPXVFZSA-N 0 3 424.564 4.130 20 0 HIADHN COc1cc(CN2CCC3(C[C@@H]3C(=O)N3CCCCC3)CC2)ccc1OC(C)C ZINC000501132838 910314232 /nfs/dbraw/zinc/31/42/32/910314232.db2.gz IITNISATTGDUGW-HXUWFJFHSA-N 0 3 400.563 4.097 20 0 HIADHN CC[C@@H](NCc1ccc2ncccc2c1)c1ccccc1OCC(=O)N1CCCC1 ZINC000513126382 921570500 /nfs/dbraw/zinc/57/05/00/921570500.db2.gz RVYRFKCDEPZPJB-JOCHJYFZSA-N 0 3 403.526 4.477 20 0 HIADHN COC(=O)c1cc(CN[C@@H](Cc2ccccc2)c2ccccc2)cc(C(=O)OC)c1 ZINC000501216075 910379010 /nfs/dbraw/zinc/37/90/10/910379010.db2.gz FJFVGIFKEMPMPO-QHCPKHFHSA-N 0 3 403.478 4.333 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(C)c1C(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000501233371 910391189 /nfs/dbraw/zinc/39/11/89/910391189.db2.gz ZYTMIKAQSDUGGJ-DYESRHJHSA-N 0 3 406.505 4.194 20 0 HIADHN Cc1[nH]nc2ncc(CN3CCC[C@H](c4nc(-c5ccc(Cl)cc5)no4)C3)cc12 ZINC000513129605 921573354 /nfs/dbraw/zinc/57/33/54/921573354.db2.gz ZVOQTIOUYONZQF-INIZCTEOSA-N 0 3 408.893 4.349 20 0 HIADHN O=C(NCc1ccccc1)C1CCN(CCOc2ccc(C(F)(F)F)cc2)CC1 ZINC000501273919 910434816 /nfs/dbraw/zinc/43/48/16/910434816.db2.gz KVOHMODQMAFADU-UHFFFAOYSA-N 0 3 406.448 4.113 20 0 HIADHN Cc1cc(C)n(-c2ccc(C(=O)NC[C@H](c3ccccc3)N3CCC(C)CC3)cn2)n1 ZINC000513137047 921578002 /nfs/dbraw/zinc/57/80/02/921578002.db2.gz GBJNBGXCIXZKEH-HSZRJFAPSA-N 0 3 417.557 4.087 20 0 HIADHN CCc1cc(OC)ccc1C[NH2+]Cc1nnc(-c2ccc(Br)cc2)[n-]1 ZINC000501385298 910514236 /nfs/dbraw/zinc/51/42/36/910514236.db2.gz GLVCTNIAMMKQFJ-UHFFFAOYSA-N 0 3 401.308 4.095 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)Nc3ccc(-c4ncco4)cc3)CC2)C[C@H](C)O1 ZINC000501397698 910526162 /nfs/dbraw/zinc/52/61/62/910526162.db2.gz KEYRGWXLTLXVOA-ROUUACIJSA-N 0 3 412.534 4.085 20 0 HIADHN CC(C)[C@H]1CN(C)CCN1C(=O)Nc1ccc2nc(C(F)(F)C(F)(F)F)[nH]c2c1 ZINC000501401419 910530515 /nfs/dbraw/zinc/53/05/15/910530515.db2.gz UDIRVZMMWGAOQN-CQSZACIVSA-N 0 3 419.398 4.021 20 0 HIADHN O=C(NCc1nc(CN[C@@H]2CCC[C@@H](c3cccnc3)C2)cs1)c1ccccc1 ZINC000501474629 910590507 /nfs/dbraw/zinc/59/05/07/910590507.db2.gz QVSKGDHRZGIIMS-UYAOXDASSA-N 0 3 406.555 4.284 20 0 HIADHN CC1CCN(CCNC(=O)Nc2ccc(Br)cc2Br)CC1 ZINC000501506108 910617187 /nfs/dbraw/zinc/61/71/87/910617187.db2.gz VHKZLDFYJRTDCP-UHFFFAOYSA-N 0 3 419.161 4.065 20 0 HIADHN Cc1nc2ccccc2nc1CN[C@]1(Cc2ccc(C(F)(F)F)cc2)CCOC1 ZINC000513173667 921600804 /nfs/dbraw/zinc/60/08/04/921600804.db2.gz LDVOJBREEOEYNC-NRFANRHFSA-N 0 3 401.432 4.448 20 0 HIADHN O=C(Nc1c[nH]nc1[C@@H]1CCCN(Cc2c[nH]nc2-c2ccccc2)C1)C1CCCC1 ZINC000501711813 910780274 /nfs/dbraw/zinc/78/02/74/910780274.db2.gz FLLMZQQCLPJOJX-LJQANCHMSA-N 0 3 418.545 4.308 20 0 HIADHN CCOc1ccc(CN2CCC[C@H](c3n[nH]cc3NC(=O)c3ccccc3)C2)cc1 ZINC000501731801 910794417 /nfs/dbraw/zinc/79/44/17/910794417.db2.gz MZHYLXQFMNMTAS-FQEVSTJZSA-N 0 3 404.514 4.440 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1CCCc2cn(C3CCCC3)nc21)[C@@H](c1ccccc1)N(C)C ZINC000501766718 910822326 /nfs/dbraw/zinc/82/23/26/910822326.db2.gz HJHONABRDFVFJZ-LXBDKUERSA-N 0 3 409.578 4.366 20 0 HIADHN CCOc1ccccc1NC(=O)CN[C@]1(Cc2ccc(C(F)(F)F)cc2)CCOC1 ZINC000513182616 921607550 /nfs/dbraw/zinc/60/75/50/921607550.db2.gz HNROOWOROLQQBA-NRFANRHFSA-N 0 3 422.447 4.034 20 0 HIADHN O=C(Nc1cc2c(cc1Cl)OCCO2)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000501807125 910858069 /nfs/dbraw/zinc/85/80/69/910858069.db2.gz ZZAQGIYUUNAGRV-SFHVURJKSA-N 0 3 401.894 4.070 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)N(Cc1cccs1)C[C@@H]1CCCO1 ZINC000501807096 910858405 /nfs/dbraw/zinc/85/84/05/910858405.db2.gz ZWSDGZXFCWTPQQ-UNMCSNQZSA-N 0 3 413.587 4.276 20 0 HIADHN Cc1cc(C)c(NC(=O)CN(C)C(=O)N[C@@H](CN2CCCC2)c2ccccc2)c(C)c1 ZINC000501809505 910859962 /nfs/dbraw/zinc/85/99/62/910859962.db2.gz JRPCDQWRQBYWBB-QFIPXVFZSA-N 0 3 422.573 4.029 20 0 HIADHN COC(=O)c1cc2cc(NC(=O)N[C@@H](CN3CCCC3)c3ccccc3)ccc2o1 ZINC000501836565 910877817 /nfs/dbraw/zinc/87/78/17/910877817.db2.gz KUVRZJBDIUZXSF-IBGZPJMESA-N 0 3 407.470 4.178 20 0 HIADHN CN(Cc1cc(Br)cs1)C(=O)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000501851186 910884443 /nfs/dbraw/zinc/88/44/43/910884443.db2.gz VOIRRWZSSZDWOK-SFHVURJKSA-N 0 3 422.392 4.489 20 0 HIADHN CCN(C(=O)c1cccc(N2CCCC2=O)c1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000501947360 910934493 /nfs/dbraw/zinc/93/44/93/910934493.db2.gz NYZZDESBUGYMPX-WMZHIEFXSA-N 0 3 405.542 4.111 20 0 HIADHN C[C@H](NC[C@H]1CN(C(=O)c2ccccc2)[C@H]2CCN1C2)c1cccc(Cl)c1Cl ZINC000502038358 910992208 /nfs/dbraw/zinc/99/22/08/910992208.db2.gz WWAVRKOCKXKQEI-SZMVWBNQSA-N 0 3 418.368 4.243 20 0 HIADHN O=C(Nc1ccc(F)cc1)[C@H](NC1CCN(c2nccs2)CC1)c1ccccc1 ZINC000502056606 911006633 /nfs/dbraw/zinc/00/66/33/911006633.db2.gz JKCHVCVESSBDLX-HXUWFJFHSA-N 0 3 410.518 4.221 20 0 HIADHN CC[C@H](C)n1ncc2c1nc(C)cc2C(=O)NC[C@@H]1CCCN1Cc1ccccc1 ZINC000513222954 921637192 /nfs/dbraw/zinc/63/71/92/921637192.db2.gz KJTFGSSUWSSHOL-ICSRJNTNSA-N 0 3 405.546 4.105 20 0 HIADHN O=C(CSCc1coc(-c2ccccc2)n1)NC[C@@H]1CCCN1Cc1ccccc1 ZINC000513221987 921637273 /nfs/dbraw/zinc/63/72/73/921637273.db2.gz FYWNRDIOBMRUDR-QFIPXVFZSA-N 0 3 421.566 4.356 20 0 HIADHN CCc1cccc(CC)c1NC(=O)NCCCN1CCN(C)C[C@@H]1c1ccccc1 ZINC000502330227 911308956 /nfs/dbraw/zinc/30/89/56/911308956.db2.gz CTKVRPVYWOHXFU-HSZRJFAPSA-N 0 3 408.590 4.312 20 0 HIADHN Cc1ccc([C@@H](C)N(C)C(=O)NCCCN2CCN(C)C[C@H]2c2ccccc2)cc1 ZINC000502347032 911327591 /nfs/dbraw/zinc/32/75/91/911327591.db2.gz STVOXOIAFMDASN-QPPBQGQZSA-N 0 3 408.590 4.076 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)c1cnn(Cc2ccccc2Cl)c1 ZINC000502355890 911338387 /nfs/dbraw/zinc/33/83/87/911338387.db2.gz CAXBNGJBQVGMRK-UHFFFAOYSA-N 0 3 424.976 4.221 20 0 HIADHN CCCN(CCN(C)C)C(=O)[C@H](C)SCc1ncc(-c2ccc(Cl)cc2)o1 ZINC000502404107 911388031 /nfs/dbraw/zinc/38/80/31/911388031.db2.gz XKYYOYJGUXIIKO-HNNXBMFYSA-N 0 3 409.983 4.417 20 0 HIADHN CCOc1ccccc1NC(=O)[C@H](NC1CCN(C(=O)C(C)C)CC1)c1ccccc1 ZINC000502416866 911397283 /nfs/dbraw/zinc/39/72/83/911397283.db2.gz QZSIAPAMHGWMDQ-HSZRJFAPSA-N 0 3 423.557 4.002 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCC[C@@H]1C[C@@H](C)O)c1ccc(C(F)(F)F)cc1 ZINC000502468936 911459415 /nfs/dbraw/zinc/45/94/15/911459415.db2.gz AISGNKHSORPQOD-ATZDWAIDSA-N 0 3 415.500 4.033 20 0 HIADHN COc1cc(C)c(NC(=O)Nc2ccc(CCN3CCSCC3)cc2)cc1OC ZINC000502473248 911465961 /nfs/dbraw/zinc/46/59/61/911465961.db2.gz OOAATWNPFVGHTK-UHFFFAOYSA-N 0 3 415.559 4.248 20 0 HIADHN O=C(CN[C@@H]1CCCC[C@H]1OC(F)F)N1N=C(c2cccs2)C[C@H]1c1ccco1 ZINC000502482044 911476604 /nfs/dbraw/zinc/47/66/04/911476604.db2.gz PBNSXRBLJVCCTR-VNQPRFMTSA-N 0 3 423.485 4.159 20 0 HIADHN COc1ccc(NC(C)=O)cc1NC(=O)[C@H](C)N[C@H](c1ccc(F)cc1)C(C)C ZINC000502489175 911486503 /nfs/dbraw/zinc/48/65/03/911486503.db2.gz ZLJQITCCHYYZLL-QKKBWIMNSA-N 0 3 401.482 4.107 20 0 HIADHN CCOC(=O)c1c2c(sc1NC(=O)[C@@H]1CCO[C@@H](CC)C1)C(C)(C)NC(C)(C)C2 ZINC000502519085 911523978 /nfs/dbraw/zinc/52/39/78/911523978.db2.gz MAODJOBHHUZJRS-KGLIPLIRSA-N 0 3 422.591 4.228 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1noc2c1CCCC2)c1ccc(C(F)(F)F)cc1 ZINC000502535233 911542034 /nfs/dbraw/zinc/54/20/34/911542034.db2.gz WXSVOTGGBQQVTN-KRWDZBQOSA-N 0 3 409.452 4.385 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)CN[C@@H](c2ccc(F)cc2)C(C)C)cc1OC ZINC000502563009 911568287 /nfs/dbraw/zinc/56/82/87/911568287.db2.gz JDZFXGUQQZMFOH-GBXCKJPGSA-N 0 3 414.521 4.493 20 0 HIADHN CCc1cccc(CC)c1NC(=O)CN[C@@]1(Cc2ccc(Cl)cc2)CCOC1 ZINC000502594025 911597279 /nfs/dbraw/zinc/59/72/79/911597279.db2.gz JMDYHSDOMDSYDR-HSZRJFAPSA-N 0 3 400.950 4.395 20 0 HIADHN CC[C@H]1c2ccsc2CCN1C(=O)CN[C@]1(Cc2ccc(Cl)cc2)CCOC1 ZINC000502597457 911600821 /nfs/dbraw/zinc/60/08/21/911600821.db2.gz USYGKGDTKGAZHD-UGKGYDQZSA-N 0 3 418.990 4.229 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)c1cccc(OCc2cscn2)c1 ZINC000513283853 921682857 /nfs/dbraw/zinc/68/28/57/921682857.db2.gz HFJSLVVZAZBUHV-NRFANRHFSA-N 0 3 407.539 4.117 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)N[C@@H](CC(F)(F)F)C(C)C)N(C)C)cc1 ZINC000502694511 911731154 /nfs/dbraw/zinc/73/11/54/911731154.db2.gz OFTNKNFSSFSCBO-ROUUACIJSA-N 0 3 403.489 4.353 20 0 HIADHN CCN1CC[C@H]2OCCN(C(=O)c3ccccc3-c3ccc(C(F)(F)F)cc3)[C@H]2C1 ZINC000502740822 911764866 /nfs/dbraw/zinc/76/48/66/911764866.db2.gz PQQSRFJKBRIUHM-LEWJYISDSA-N 0 3 418.459 4.308 20 0 HIADHN O=C(Nc1ccc(C(=O)NC[C@H]2CCCN2Cc2ccccc2)cc1)c1cccs1 ZINC000513296083 921692845 /nfs/dbraw/zinc/69/28/45/921692845.db2.gz ZZFUGBFLNJERIK-OAQYLSRUSA-N 0 3 419.550 4.395 20 0 HIADHN CCc1nc(C(=O)N(CCN(C)C)C2CCCC2)nn1-c1c(Cl)cccc1Cl ZINC000502816125 911831101 /nfs/dbraw/zinc/83/11/01/911831101.db2.gz HOCXWNWWHDSDOM-UHFFFAOYSA-N 0 3 424.376 4.083 20 0 HIADHN Cc1cc(OC(F)F)c(C(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)s1 ZINC000502867275 911872368 /nfs/dbraw/zinc/87/23/68/911872368.db2.gz WMICWPXQKLPYQD-UHFFFAOYSA-N 0 3 409.502 4.441 20 0 HIADHN Cc1nccn1CCCCN1CCC[C@H]1c1ccccc1I ZINC000502868079 911873763 /nfs/dbraw/zinc/87/37/63/911873763.db2.gz PWXDPWKGERPYGK-SFHVURJKSA-N 0 3 409.315 4.413 20 0 HIADHN COc1ccccc1Nc1ccccc1C(=O)NC1CCN(CCOC(C)C)CC1 ZINC000502985656 911963126 /nfs/dbraw/zinc/96/31/26/911963126.db2.gz VFMGLVURGZOZRU-UHFFFAOYSA-N 0 3 411.546 4.058 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3cnccc3Oc3ccccc3)CC2)C[C@H](C)O1 ZINC000503010438 911984155 /nfs/dbraw/zinc/98/41/55/911984155.db2.gz CALWMFCKLQZHLH-BGYRXZFFSA-N 0 3 423.557 4.225 20 0 HIADHN O=C(N[C@H](c1ccccc1)c1ccncc1)N[C@H](CN1CCCC1)c1ccccc1 ZINC000503014050 911986904 /nfs/dbraw/zinc/98/69/04/911986904.db2.gz GRUZXFSXDZCYAG-DNQXCXABSA-N 0 3 400.526 4.307 20 0 HIADHN C[C@H]1CN(CCCCNC(=O)C(C)(C)c2csc(-c3cccs3)n2)C[C@H](C)O1 ZINC000503022056 911993796 /nfs/dbraw/zinc/99/37/96/911993796.db2.gz JZZCJLUXGCVKIZ-HOTGVXAUSA-N 0 3 421.632 4.155 20 0 HIADHN Cc1nccn1CCCN(C)[C@@H](C)C(=O)Nc1ccc(OCc2ccccc2)cc1 ZINC000503060863 912026131 /nfs/dbraw/zinc/02/61/31/912026131.db2.gz CCKPGVHQNXSJHJ-IBGZPJMESA-N 0 3 406.530 4.120 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)N[C@H]2CCCc3c(O)cccc32)N(C)C)cc1 ZINC000503136447 912096788 /nfs/dbraw/zinc/09/67/88/912096788.db2.gz GSGJDAGGAUKKQK-VXKWHMMOSA-N 0 3 411.546 4.159 20 0 HIADHN COc1ccc([C@H](CNC(=O)N2CCN(C)CC[C@@H]2C)c2c[nH]c3ccccc32)cc1 ZINC000503151454 912115753 /nfs/dbraw/zinc/11/57/53/912115753.db2.gz KIMVYLDJBOCFGO-AVRDEDQJSA-N 0 3 420.557 4.044 20 0 HIADHN COc1ccc([C@H](CNC(=O)Nc2ccc(OCC3CC3)cc2)N2CCCC2)cc1 ZINC000503159108 912126575 /nfs/dbraw/zinc/12/65/75/912126575.db2.gz WBWFSZUJXJTILT-QHCPKHFHSA-N 0 3 409.530 4.443 20 0 HIADHN Cc1ccc(NC(=O)CCCN2CCN(c3ccccc3)CC2)cc1OC(F)F ZINC000513340217 921726016 /nfs/dbraw/zinc/72/60/16/921726016.db2.gz HTGRTQNAKSMAHZ-UHFFFAOYSA-N 0 3 403.473 4.137 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)N3CCC[C@@H]3c3ccccc3)CC2)c1 ZINC000503209394 912191129 /nfs/dbraw/zinc/19/11/29/912191129.db2.gz WLGCCPKUGIWXKC-RUZDIDTESA-N 0 3 420.601 4.444 20 0 HIADHN Cc1cccc(C(=O)N2CCCC2)c1NC(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000506294893 914889667 /nfs/dbraw/zinc/88/96/67/914889667.db2.gz LZMAJYHXFPOLCD-PZJWPPBQSA-N 0 3 420.557 4.188 20 0 HIADHN Cc1ncsc1CCN[C@@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000506294550 914889761 /nfs/dbraw/zinc/88/97/61/914889761.db2.gz LOSRXRBXXJYDLZ-FQEVSTJZSA-N 0 3 420.987 4.430 20 0 HIADHN Cc1cc(NC(=O)C2CCN(Cc3c(C)nn(Cc4ccc(C)cc4)c3C)CC2)no1 ZINC000506311473 914899857 /nfs/dbraw/zinc/89/98/57/914899857.db2.gz UEVWDIWBSLHYSO-UHFFFAOYSA-N 0 3 421.545 4.004 20 0 HIADHN C[C@@H](c1ccccc1Cl)N1CCN(C(=O)c2cccc(CN3CCCC3)c2)CC1 ZINC000513355523 921734058 /nfs/dbraw/zinc/73/40/58/921734058.db2.gz RZHCARHKDYOYCI-IBGZPJMESA-N 0 3 411.977 4.455 20 0 HIADHN CCN(CC)C(=O)c1ccc(NC(=O)CNC2(c3cccc(C)c3)CCCC2)cc1 ZINC000506473877 915071196 /nfs/dbraw/zinc/07/11/96/915071196.db2.gz JZKRPZDACIZZJZ-UHFFFAOYSA-N 0 3 407.558 4.475 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)Nc2cccc(CN3CCCCC3=O)c2)C1 ZINC000506488771 915094706 /nfs/dbraw/zinc/09/47/06/915094706.db2.gz SKZALVXOIQPASD-WMZHIEFXSA-N 0 3 420.557 4.156 20 0 HIADHN COc1ccc(Br)c(NC(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)c1 ZINC000506515317 915145307 /nfs/dbraw/zinc/14/53/07/915145307.db2.gz GUGWUVCXTQIUPQ-HOCLYGCPSA-N 0 3 418.335 4.415 20 0 HIADHN COc1ccc([C@H]2CCCN2Cc2ccc(OCc3nccn3C)cc2)cc1OC ZINC000506630359 915295590 /nfs/dbraw/zinc/29/55/90/915295590.db2.gz DBHCKPDRLCOFBC-OAQYLSRUSA-N 0 3 407.514 4.353 20 0 HIADHN CCOc1ccc([C@@H]2CCCN2Cc2ccccc2OCC(=O)NCC2CC2)cc1 ZINC000506707510 915386282 /nfs/dbraw/zinc/38/62/82/915386282.db2.gz MHGVRYXKZPSKGT-QHCPKHFHSA-N 0 3 408.542 4.327 20 0 HIADHN COc1ccccc1O[C@@H]1CCCN(CCC(=O)Nc2ccc(Cl)cc2F)C1 ZINC000513401379 921768824 /nfs/dbraw/zinc/76/88/24/921768824.db2.gz MCNSWFJUJBDVIJ-MRXNPFEDSA-N 0 3 406.885 4.360 20 0 HIADHN C[C@H](CNC(=O)N1CCC[C@@H](c2nc3ccc(F)cc3o2)C1)N(C)Cc1ccccc1 ZINC000506730418 915415471 /nfs/dbraw/zinc/41/54/71/915415471.db2.gz HIXFOHPNNFKNAQ-IEBWSBKVSA-N 0 3 424.520 4.376 20 0 HIADHN COC(=O)c1sc2nc(C)nc(NC[C@@H](c3ccc(C)o3)N3CCCC3)c2c1C ZINC000506750247 915441752 /nfs/dbraw/zinc/44/17/52/915441752.db2.gz LZPPLJYKHVIDLX-HNNXBMFYSA-N 0 3 414.531 4.245 20 0 HIADHN CN(Cc1c[nH]nc1-c1ccc2c(c1)OCO2)Cc1ccc(Br)cc1 ZINC000506787174 915511817 /nfs/dbraw/zinc/51/18/17/915511817.db2.gz AFGYNPROUQTRHX-UHFFFAOYSA-N 0 3 400.276 4.200 20 0 HIADHN C[C@@H](CNC(=O)N(CCN(C)C)Cc1ccc(C(F)(F)F)cc1)Oc1ccccc1 ZINC000506797451 915533197 /nfs/dbraw/zinc/53/31/97/915533197.db2.gz OZIHKLNESFGEST-KRWDZBQOSA-N 0 3 423.479 4.246 20 0 HIADHN CCCCCNC(=O)C1CCN(CC2=Cc3cc(Br)ccc3OC2)CC1 ZINC000506847793 915627563 /nfs/dbraw/zinc/62/75/63/915627563.db2.gz BELTXCMLMAIXSE-UHFFFAOYSA-N 0 3 421.379 4.243 20 0 HIADHN CC(C)OCCCNC(=O)C1CCN(Cc2ccc(-c3ccc(F)cc3)o2)CC1 ZINC000506864748 915653942 /nfs/dbraw/zinc/65/39/42/915653942.db2.gz BOODPUUNRWGCPI-UHFFFAOYSA-N 0 3 402.510 4.229 20 0 HIADHN COC(=O)c1ccc(Cl)cc1NC(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000506937043 915740177 /nfs/dbraw/zinc/74/01/77/915740177.db2.gz LMNNJGQRXPGZGQ-UHFFFAOYSA-N 0 3 415.921 4.255 20 0 HIADHN C[C@H](NCC(=O)Nc1cccc(CN2CCSCC2)c1)c1ccc(Cl)cc1 ZINC000506947683 915752979 /nfs/dbraw/zinc/75/29/79/915752979.db2.gz OUBYWSUYPBDLJT-INIZCTEOSA-N 0 3 403.979 4.178 20 0 HIADHN O=C(CN1CCN(CC(c2ccccc2)c2ccccc2)CC1)Nc1ccc(F)cc1 ZINC000507007084 915818011 /nfs/dbraw/zinc/81/80/11/915818011.db2.gz KYGDNEVJWQRJIE-UHFFFAOYSA-N 0 3 417.528 4.214 20 0 HIADHN CCCOc1ccc(CN2CCC(C(=O)NCc3ccc(F)cc3)CC2)cc1OC ZINC000507023698 915827907 /nfs/dbraw/zinc/82/79/07/915827907.db2.gz YUVBJWVKHSBGCW-UHFFFAOYSA-N 0 3 414.521 4.152 20 0 HIADHN CCCn1nccc1C1CCN(C(=O)NC[C@H](c2ccc(CC)cc2)N(C)C)CC1 ZINC000507036031 915834625 /nfs/dbraw/zinc/83/46/25/915834625.db2.gz HLSHLQBRHHQVOF-HSZRJFAPSA-N 0 3 411.594 4.047 20 0 HIADHN CC(C)(C)[C@H](NCC(=O)Nc1cc(Cl)ccc1-n1cncn1)c1ccc(F)cc1 ZINC000507040593 915836483 /nfs/dbraw/zinc/83/64/83/915836483.db2.gz TXNBLYIUWUSSGA-HXUWFJFHSA-N 0 3 415.900 4.375 20 0 HIADHN COc1ccc([C@@H](C)NC(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)c(C)c1OC ZINC000513432193 921801303 /nfs/dbraw/zinc/80/13/03/921801303.db2.gz OWEIGWOKBFDFMI-DNVCBOLYSA-N 0 3 419.953 4.329 20 0 HIADHN COc1cccc2c1OCC(C(=O)NC[C@H](c1cccs1)N1CCC(C)CC1)=C2 ZINC000513434225 921802212 /nfs/dbraw/zinc/80/22/12/921802212.db2.gz LSVYLACPKUIYPS-LJQANCHMSA-N 0 3 412.555 4.122 20 0 HIADHN CC(C)(C)n1nc(C(=O)N2CCCN(CCCc3ccccc3)CC2)cc1C1CC1 ZINC000507099334 915868613 /nfs/dbraw/zinc/86/86/13/915868613.db2.gz AVFWLNOEDXRTOI-UHFFFAOYSA-N 0 3 408.590 4.296 20 0 HIADHN O=C(NC[C@H]1CCCN(Cc2cccs2)C1)c1csc(-c2ncccc2F)n1 ZINC000507109337 915873191 /nfs/dbraw/zinc/87/31/91/915873191.db2.gz CNKXFVIHTWKTCE-CQSZACIVSA-N 0 3 416.547 4.048 20 0 HIADHN COc1ccc(C(=O)N2CCCN(CCCc3ccccc3)CC2)cc1OC(F)F ZINC000507129323 915881737 /nfs/dbraw/zinc/88/17/37/915881737.db2.gz XFDZQMMMMGFVKP-UHFFFAOYSA-N 0 3 418.484 4.077 20 0 HIADHN COCCOc1ccc(C(F)(F)F)cc1NC(=O)CNC(C)(C)c1ccccc1 ZINC000507313803 916074239 /nfs/dbraw/zinc/07/42/39/916074239.db2.gz FHWLDLJVBJALRC-UHFFFAOYSA-N 0 3 410.436 4.194 20 0 HIADHN C[C@@H]1CCCCN1CCNC(=O)c1cnn(-c2cccc(C(F)(F)F)c2)c1C1CC1 ZINC000507343072 916096487 /nfs/dbraw/zinc/09/64/87/916096487.db2.gz VWMQHDXXSQXTOU-OAHLLOKOSA-N 0 3 420.479 4.373 20 0 HIADHN CC(C)[C@@H](C)NC(=O)C1CCN(Cc2ccc(C(=O)Nc3ccccc3)cc2)CC1 ZINC000507353773 916106068 /nfs/dbraw/zinc/10/60/68/916106068.db2.gz BIQLDQTUWAMWNR-LJQANCHMSA-N 0 3 407.558 4.312 20 0 HIADHN Cc1cccc(-c2nnc(-c3ccc(C(=O)NCCN4CCCC[C@H]4C)cc3)o2)c1 ZINC000507352494 916106300 /nfs/dbraw/zinc/10/63/00/916106300.db2.gz KNHSOQXZHFHFFA-GOSISDBHSA-N 0 3 404.514 4.316 20 0 HIADHN Cc1nc(-c2ccccc2Br)sc1[C@@H](C)N[C@H]1CCCCNC1=O ZINC000507442415 916213064 /nfs/dbraw/zinc/21/30/64/916213064.db2.gz KICIRFIRPRIGLU-ABAIWWIYSA-N 0 3 408.365 4.200 20 0 HIADHN C[C@H](N[C@@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1)[C@@H]1CCCOC1 ZINC000507498334 916264844 /nfs/dbraw/zinc/26/48/44/916264844.db2.gz VFDYARJXYRYPQV-KLHJMIIUSA-N 0 3 407.963 4.238 20 0 HIADHN CN1CCC[C@H](CNC(=O)c2csc(-c3ncccc3F)n2)[C@@H]1c1cccs1 ZINC000507545359 916303020 /nfs/dbraw/zinc/30/30/20/916303020.db2.gz FJOIEQBBRSLKSG-FZKQIMNGSA-N 0 3 416.547 4.219 20 0 HIADHN CCOc1ccccc1NC(=O)[C@@H](C)N(C)CCCc1cc(-c2ccccc2)n[nH]1 ZINC000507562528 916317321 /nfs/dbraw/zinc/31/73/21/916317321.db2.gz FNGMMQIQBXMSSY-GOSISDBHSA-N 0 3 406.530 4.367 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)CO[C@H]3CCCC[C@H]3C)c(OCC)c2)CC1 ZINC000507605335 916360188 /nfs/dbraw/zinc/36/01/88/916360188.db2.gz JXIVYXVQADKLNK-KNQAVFIVSA-N 0 3 417.594 4.151 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)c2nn(-c3ccc(F)cc3)c3c2CCC3)C1 ZINC000507606401 916362998 /nfs/dbraw/zinc/36/29/98/916362998.db2.gz POMNNYZXUPNLCW-YLJYHZDGSA-N 0 3 418.516 4.065 20 0 HIADHN CCCN(CC(=O)Nc1c(C)cccc1C)C1CCN(C(=O)c2ccccc2)CC1 ZINC000507605639 916363283 /nfs/dbraw/zinc/36/32/83/916363283.db2.gz BHKFPNHXDSFPIA-UHFFFAOYSA-N 0 3 407.558 4.259 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3c[nH]c4cc(F)ccc34)c(OCC)c2)CC1 ZINC000507609161 916366631 /nfs/dbraw/zinc/36/66/31/916366631.db2.gz CLZNBFPMNNTGKQ-UHFFFAOYSA-N 0 3 424.520 4.490 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)CCCC3CCOCC3)c(OCC)c2)CC1 ZINC000507618055 916375520 /nfs/dbraw/zinc/37/55/20/916375520.db2.gz HWZKVUDHBSCXAS-UHFFFAOYSA-N 0 3 417.594 4.153 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)c2ccccc2OCc2cscn2)C1 ZINC000507618839 916376826 /nfs/dbraw/zinc/37/68/26/916376826.db2.gz DKLQZXWLDTVSGI-MJGOQNOKSA-N 0 3 407.539 4.287 20 0 HIADHN Cc1cc(C)n(-c2ccc(Cl)c(C(=O)N[C@@H]3CCN([C@@H](C)c4ccccc4)C3)n2)n1 ZINC000507627911 916386749 /nfs/dbraw/zinc/38/67/49/916386749.db2.gz BWYZWNJDWGIOPG-PKOBYXMFSA-N 0 3 423.948 4.103 20 0 HIADHN COc1ccc(OC)c([C@@H](C)NCCC(=O)Nc2ccc(Br)cc2)c1 ZINC000507726100 916521111 /nfs/dbraw/zinc/52/11/11/916521111.db2.gz NSKCWGHOYDIBRG-CYBMUJFWSA-N 0 3 407.308 4.146 20 0 HIADHN O=C(Nc1ccc(-c2csnn2)cc1)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000507749901 916539636 /nfs/dbraw/zinc/53/96/36/916539636.db2.gz SLKBRVABSPWIEQ-SFHVURJKSA-N 0 3 414.481 4.301 20 0 HIADHN COc1ccccc1CN(CCC(=O)Nc1ccc(Br)cc1)C1CC1 ZINC000507776211 916561422 /nfs/dbraw/zinc/56/14/22/916561422.db2.gz CDZBAUDLIUWDRH-UHFFFAOYSA-N 0 3 403.320 4.451 20 0 HIADHN CCN(CC)[C@@H](CN[C@@H](c1nccn1C)c1cccc(F)c1)c1cccc(OC)c1 ZINC000507808890 916599246 /nfs/dbraw/zinc/59/92/46/916599246.db2.gz XAHJYONSVQOTPD-XZOQPEGZSA-N 0 3 410.537 4.330 20 0 HIADHN COc1cc(CN[C@@H]2CC(=O)N(C)[C@H]2c2ccc(Cl)cc2)cc(Cl)c1OC ZINC000507848146 916668892 /nfs/dbraw/zinc/66/88/92/916668892.db2.gz SANMRTMRCUFYDL-APWZRJJASA-N 0 3 409.313 4.072 20 0 HIADHN CCCN(CC(=O)NC[C@H](c1c[nH]c2ccccc21)c1ccc(OC)cc1)C1CC1 ZINC000507859960 916689986 /nfs/dbraw/zinc/68/99/86/916689986.db2.gz LHONASSJUKFCHR-QFIPXVFZSA-N 0 3 405.542 4.299 20 0 HIADHN COc1cc(CN2CCC[C@H]2/C=C\c2ccccc2)ccc1OCC(=O)N1CCCC1 ZINC000507887081 916731909 /nfs/dbraw/zinc/73/19/09/916731909.db2.gz NPNCNUIJESXBOF-BLSBEMRDSA-N 0 3 420.553 4.374 20 0 HIADHN COc1cc(CN2CCC[C@@H]2/C=C/c2ccccc2)ccc1OCC(=O)N1CCCC1 ZINC000507887076 916732044 /nfs/dbraw/zinc/73/20/44/916732044.db2.gz NPNCNUIJESXBOF-ABSORMQESA-N 0 3 420.553 4.374 20 0 HIADHN CCOC(=O)C1CCN(C(=O)[C@@H](C)N[C@H](C)c2ccc(Oc3ccccc3)cc2)CC1 ZINC000507892553 916747349 /nfs/dbraw/zinc/74/73/49/916747349.db2.gz HCBYZZKXXBIMDT-RTBURBONSA-N 0 3 424.541 4.320 20 0 HIADHN Cc1sc(Br)c(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)c1C ZINC000507901418 916768766 /nfs/dbraw/zinc/76/87/66/916768766.db2.gz FUJFVCOGBREHOJ-MLGOLLRUSA-N 0 3 407.377 4.378 20 0 HIADHN CCN1CCN(c2ccccc2CN[C@H]2CCCc3cn(C4CCCC4)nc32)CC1 ZINC000507913906 916791095 /nfs/dbraw/zinc/79/10/95/916791095.db2.gz VBJHKCRVJQFUKG-QHCPKHFHSA-N 0 3 407.606 4.307 20 0 HIADHN Cc1ccc(NC(=O)C2CCN(Cc3ccccc3OCc3ccncc3)CC2)nc1 ZINC000507983815 916828433 /nfs/dbraw/zinc/82/84/33/916828433.db2.gz CRPGUKSEWIDNMN-UHFFFAOYSA-N 0 3 416.525 4.215 20 0 HIADHN COc1ccc(-c2noc([C@@H]3CN(Cc4ccccc4)CCC3(F)F)n2)cc1OC ZINC000507995747 916836805 /nfs/dbraw/zinc/83/68/05/916836805.db2.gz XFQUWSJVNDDAKH-KRWDZBQOSA-N 0 3 415.440 4.379 20 0 HIADHN Cc1ccc(NC(=O)[C@H]2CCCN(Cc3c[nH]nc3-c3cccc(Cl)c3)C2)nc1 ZINC000508007547 916847823 /nfs/dbraw/zinc/84/78/23/916847823.db2.gz DROLZXDRLRMMDP-KRWDZBQOSA-N 0 3 409.921 4.284 20 0 HIADHN CC(C)c1cc(C(=O)Nc2cccc(CN3CCC(CO)CC3)c2)nn1C(C)(C)C ZINC000508062490 916886177 /nfs/dbraw/zinc/88/61/77/916886177.db2.gz ZWZCYGVHICGJKQ-UHFFFAOYSA-N 0 3 412.578 4.218 20 0 HIADHN CC(C)c1cccc(O[C@H](C)C(=O)Nc2cccc(CN3CCC(CO)CC3)c2)c1 ZINC000508071993 916893679 /nfs/dbraw/zinc/89/36/79/916893679.db2.gz PTCYYBMEHLTLSW-LJQANCHMSA-N 0 3 410.558 4.420 20 0 HIADHN Cc1cc(Br)cc2cc(C(=O)N(CCN(C)C)Cc3ccco3)oc21 ZINC000508087822 916906257 /nfs/dbraw/zinc/90/62/57/916906257.db2.gz HSBNERGSTSGZPL-UHFFFAOYSA-N 0 3 405.292 4.301 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)Nc1ccc2oc(C(F)(F)F)nc2c1 ZINC000508138016 916958033 /nfs/dbraw/zinc/95/80/33/916958033.db2.gz SLYLVAXPBSNLAB-UHFFFAOYSA-N 0 3 406.408 4.442 20 0 HIADHN O=C1COc2ccc(CN3CCC[C@@H](c4nc(-c5ccc(Cl)cc5)no4)C3)cc2N1 ZINC000508157391 916978217 /nfs/dbraw/zinc/97/82/17/916978217.db2.gz DBPXSYYEEMMUBH-MRXNPFEDSA-N 0 3 424.888 4.101 20 0 HIADHN Cn1c2ccc(CN3CCC[C@H](c4nc(-c5ccc(Cl)cc5)no4)C3)cc2oc1=O ZINC000508160211 916982163 /nfs/dbraw/zinc/98/21/63/916982163.db2.gz JQWCXGITWZVNTH-INIZCTEOSA-N 0 3 424.888 4.215 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)C[C@H](c2cccs2)n2cccc2)c1 ZINC000508465401 917249599 /nfs/dbraw/zinc/24/95/99/917249599.db2.gz BWUIDCWKMIZASO-OAQYLSRUSA-N 0 3 411.571 4.128 20 0 HIADHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)[C@H]1CC[C@@H](C(F)(F)F)C1 ZINC000508535487 917316196 /nfs/dbraw/zinc/31/61/96/917316196.db2.gz SSJVTLPGYVTYLJ-LSDHHAIUSA-N 0 3 421.301 4.318 20 0 HIADHN CC[C@H](C)NC(=O)[C@@H]1C[C@H](C)N(CC(=O)Nc2cccc(C)c2C)[C@@H]2CCCC[C@@H]12 ZINC000508673611 917437995 /nfs/dbraw/zinc/43/79/95/917437995.db2.gz YLYQPOAWXGVVRP-DUZVJDNUSA-N 0 3 413.606 4.426 20 0 HIADHN CC[C@H](C)NC(=O)[C@@H]1C[C@H](C)N(Cc2nc(-c3ccco3)no2)[C@H]2CCCC[C@@H]12 ZINC000508679817 917443255 /nfs/dbraw/zinc/44/32/55/917443255.db2.gz SXRCENPCBKBVJZ-TXTZMMAHSA-N 0 3 400.523 4.014 20 0 HIADHN CC[C@H](C)NC(=O)[C@@H]1C[C@H](C)N(Cc2nc(-c3ccco3)no2)[C@@H]2CCCC[C@@H]12 ZINC000508679812 917444143 /nfs/dbraw/zinc/44/41/43/917444143.db2.gz SXRCENPCBKBVJZ-NNPSNHGLSA-N 0 3 400.523 4.014 20 0 HIADHN CC(C)S(=O)(=O)Cc1cccc(N[C@@H](C)[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000508693762 917454902 /nfs/dbraw/zinc/45/49/02/917454902.db2.gz DTKHJFSKXKIYTR-UGKGYDQZSA-N 0 3 400.588 4.332 20 0 HIADHN Cc1c([C@@H](C)NCc2ccccc2Cn2cncn2)cnn1-c1cccc(Cl)c1 ZINC000508728157 917489929 /nfs/dbraw/zinc/48/99/29/917489929.db2.gz CCWQKCHTLHMDHF-MRXNPFEDSA-N 0 3 406.921 4.325 20 0 HIADHN C[C@@H](NCc1ccccc1Cn1cncn1)c1ccc(OC[C@@H]2CCCCO2)c(F)c1 ZINC000508731251 917491826 /nfs/dbraw/zinc/49/18/26/917491826.db2.gz VUAATYDQNJWRTB-GCJKJVERSA-N 0 3 424.520 4.264 20 0 HIADHN COc1ccc([C@H](CNC(=O)c2ccc(Cl)c3cccnc23)N2CCCC2)cc1 ZINC000508796032 917552453 /nfs/dbraw/zinc/55/24/53/917552453.db2.gz OYXMVHMYPUSPHU-NRFANRHFSA-N 0 3 409.917 4.464 20 0 HIADHN CCO[C@H](C)c1noc(CN2CCN(CC(c3ccccc3)c3ccccc3)CC2)n1 ZINC000508827158 917580688 /nfs/dbraw/zinc/58/06/88/917580688.db2.gz JPWPWYMIQCAANV-HXUWFJFHSA-N 0 3 420.557 4.117 20 0 HIADHN C[C@H](NC(=O)Nc1ccccc1OC[C@@H]1CCCCO1)[C@@H](c1ccccc1)N(C)C ZINC000508853427 917606292 /nfs/dbraw/zinc/60/62/92/917606292.db2.gz RBTATUVYYUEMLH-LEDOBFOHSA-N 0 3 411.546 4.447 20 0 HIADHN CCO[C@H](C)c1nc(CN(C)C(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)cs1 ZINC000508871855 917624646 /nfs/dbraw/zinc/62/46/46/917624646.db2.gz QPJMAHBMSXVRJS-FCEWJHQRSA-N 0 3 404.580 4.073 20 0 HIADHN C[C@H](NC(=O)N1CCn2cccc2[C@H]1c1ccccc1)[C@H](c1ccccc1)N(C)C ZINC000508873665 917626686 /nfs/dbraw/zinc/62/66/86/917626686.db2.gz TUGYBERRIIEZAG-WUMKDDEVSA-N 0 3 402.542 4.294 20 0 HIADHN C[C@H](NC(=O)N1CCO[C@@H](c2cccc(Cl)c2)C1)[C@H](c1ccccc1)N(C)C ZINC000508878697 917632608 /nfs/dbraw/zinc/63/26/08/917632608.db2.gz IHNGJAICWGKSDX-ZLGUVYLKSA-N 0 3 401.938 4.114 20 0 HIADHN C[C@H](NC(=O)N(C)Cc1ccc(Br)cc1)[C@@H](c1ccccc1)N(C)C ZINC000508891282 917645756 /nfs/dbraw/zinc/64/57/56/917645756.db2.gz BHUIDQNVDUDZJI-KXBFYZLASA-N 0 3 404.352 4.282 20 0 HIADHN C[C@H](NC(=O)N(CCCO)[C@H]1CCCc2ccccc21)[C@@H](c1ccccc1)N(C)C ZINC000508894225 917649117 /nfs/dbraw/zinc/64/91/17/917649117.db2.gz FYLDZKTXYWSXBV-IGKWTDBASA-N 0 3 409.574 4.149 20 0 HIADHN C[C@H](NC(=O)N1CCOC[C@H]1c1nc2ccccc2s1)[C@@H](c1ccccc1)N(C)C ZINC000508898051 917652527 /nfs/dbraw/zinc/65/25/27/917652527.db2.gz ORENMOVVNDYGRX-LRQRDZAKSA-N 0 3 424.570 4.071 20 0 HIADHN C[C@H](NC(=O)N1CCC(OCCc2ccccc2)CC1)[C@@H](c1ccccc1)N(C)C ZINC000508902386 917658344 /nfs/dbraw/zinc/65/83/44/917658344.db2.gz DBNWMXRGAFFKIT-RDPSFJRHSA-N 0 3 409.574 4.111 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)c(OC)c1 ZINC000508905494 917662313 /nfs/dbraw/zinc/66/23/13/917662313.db2.gz LKAFTBCGHBCQDW-FRGLQRNOSA-N 0 3 411.546 4.242 20 0 HIADHN CN(C)Cc1cccc(NC(=O)C(=O)N(Cc2c(Cl)cccc2Cl)C2CC2)c1 ZINC000509002569 917756426 /nfs/dbraw/zinc/75/64/26/917756426.db2.gz ZQQDRYNKGVWZFN-UHFFFAOYSA-N 0 3 420.340 4.185 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)N(Cc1cccnc1)C1CC1)c1ccc(Cl)cc1 ZINC000509027388 917782313 /nfs/dbraw/zinc/78/23/13/917782313.db2.gz AHOZJOCIHDTVSN-NRFANRHFSA-N 0 3 400.954 4.492 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1nn(-c2ccc(F)cc2)cc1C)c1cccc(OC)c1 ZINC000509122631 917857118 /nfs/dbraw/zinc/85/71/18/917857118.db2.gz KIKWHPKFBMMBNE-JOCHJYFZSA-N 0 3 424.520 4.141 20 0 HIADHN CCOc1ccc(CN(C(=O)NCCCN2CCc3ccccc3C2)C(C)C)cc1 ZINC000509328185 917999063 /nfs/dbraw/zinc/99/90/63/917999063.db2.gz PYAZHFCYXBYKLB-UHFFFAOYSA-N 0 3 409.574 4.454 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(CN3CCC[C@H](c4nc(C)no4)C3)c2)cc1 ZINC000509343381 918007484 /nfs/dbraw/zinc/00/74/84/918007484.db2.gz KDCYVAGRCDWGDX-IBGZPJMESA-N 0 3 406.486 4.019 20 0 HIADHN O=C(Nc1ccc(Cl)cn1)C1CCN(Cc2c[nH]nc2-c2cccs2)CC1 ZINC000509347635 918012324 /nfs/dbraw/zinc/01/23/24/918012324.db2.gz BHKJGMQXUJGVLS-UHFFFAOYSA-N 0 3 401.923 4.037 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)N[C@@H](c1nccs1)c1ccccc1 ZINC000509346979 918012986 /nfs/dbraw/zinc/01/29/86/918012986.db2.gz ZWXJJSNXXLIOGQ-LEWJYISDSA-N 0 3 406.555 4.369 20 0 HIADHN COc1ccc(C(=O)CCN2CCC[C@@H](c3nc(-c4cccc(F)c4)no3)C2)cc1 ZINC000509349736 918014801 /nfs/dbraw/zinc/01/48/01/918014801.db2.gz ZUZZWUXNOXJUJM-GOSISDBHSA-N 0 3 409.461 4.337 20 0 HIADHN O=C(Nc1ccc(Cl)cn1)[C@@H]1CCCN(Cc2ccc(OCC(F)F)cc2)C1 ZINC000509367556 918032421 /nfs/dbraw/zinc/03/24/21/918032421.db2.gz UYCOCABWXMGCHP-OAHLLOKOSA-N 0 3 409.864 4.230 20 0 HIADHN Cc1cn(-c2ccc(F)cc2)nc1C(=O)N(C)C1CCN(Cc2ccccc2)CC1 ZINC000509457639 918109393 /nfs/dbraw/zinc/10/93/93/918109393.db2.gz ZQHMNAXYPMLBEK-UHFFFAOYSA-N 0 3 406.505 4.056 20 0 HIADHN COc1cccc(-c2c[nH]cc2C(=O)NC[C@@H](c2cccc(OC)c2)N2CCCC2)c1 ZINC000509484141 918129947 /nfs/dbraw/zinc/12/99/47/918129947.db2.gz OVCYRVGCODWAPX-DEOSSOPVSA-N 0 3 419.525 4.266 20 0 HIADHN O=C(NCc1ccccc1)[C@@H](NC[C@H]1CCO[C@@H]1c1ccccc1)c1ccccc1 ZINC000509509759 918156703 /nfs/dbraw/zinc/15/67/03/918156703.db2.gz HZSWBTWACOBCTJ-DSNGMDLFSA-N 0 3 400.522 4.412 20 0 HIADHN Cc1ccc(NC(=O)[C@H](C)N[C@@H]2CCc3ccccc3OC2)c(Br)c1 ZINC000509530194 918177977 /nfs/dbraw/zinc/17/79/77/918177977.db2.gz XUCQHBDMYHAOEK-GOEBONIOSA-N 0 3 403.320 4.068 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N1CCC[C@@H]1c1ccc(OC)cc1OC)c1ccco1 ZINC000509551220 918201004 /nfs/dbraw/zinc/20/10/04/918201004.db2.gz ALVTUEAWPBYTGW-FFZOFVMBSA-N 0 3 415.534 4.273 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N1CCC(n2c(C)nc3ccccc32)CC1)c1ccco1 ZINC000509565938 918215262 /nfs/dbraw/zinc/21/52/62/918215262.db2.gz BZAKKNBSFUEJBJ-UWJYYQICSA-N 0 3 423.561 4.414 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)N1CCC(c2c[nH]c3ncccc23)CC1)c1ccco1 ZINC000509568447 918218018 /nfs/dbraw/zinc/21/80/18/918218018.db2.gz LJYKROVZRDRMBY-UZLBHIALSA-N 0 3 409.534 4.174 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N[C@@H](C)c1ccc(OC)c(OC)c1C)c1ccco1 ZINC000509572285 918221999 /nfs/dbraw/zinc/22/19/99/918221999.db2.gz VBXUMOOBRJLHDY-ZVZYQTTQSA-N 0 3 403.523 4.095 20 0 HIADHN COc1ccc(C[C@H](NCc2cnn(CC(F)F)c2)c2ccc(OC)cc2)cc1 ZINC000509583564 918231593 /nfs/dbraw/zinc/23/15/93/918231593.db2.gz LAISRGQLNCPBPM-NRFANRHFSA-N 0 3 401.457 4.239 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N1CCC[C@@H]1c1nc2cc(C)ccc2[nH]1)c1ccco1 ZINC000509582955 918231929 /nfs/dbraw/zinc/23/19/29/918231929.db2.gz IYOMDPZQLLCLEN-PWIZWCRZSA-N 0 3 409.534 4.440 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N1CCC[C@@H]1c1nc2ccc(C)cc2[nH]1)c1ccco1 ZINC000509582955 918231933 /nfs/dbraw/zinc/23/19/33/918231933.db2.gz IYOMDPZQLLCLEN-PWIZWCRZSA-N 0 3 409.534 4.440 20 0 HIADHN Cc1ccc2c(c1)[nH]cc2C1=CCN(Cc2ccccc2OCC(=O)N(C)C)CC1 ZINC000509587412 918237257 /nfs/dbraw/zinc/23/72/57/918237257.db2.gz WBDJPYUISWVVSU-UHFFFAOYSA-N 0 3 403.526 4.233 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N(Cc1ccccc1)CC1CCOCC1)c1ccco1 ZINC000509595131 918244938 /nfs/dbraw/zinc/24/49/38/918244938.db2.gz GLQWMQPZMXMTOF-SIKLNZKXSA-N 0 3 413.562 4.347 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N1CC[C@H](Oc2ccccc2Cl)C1)c1ccco1 ZINC000509611979 918259269 /nfs/dbraw/zinc/25/92/69/918259269.db2.gz VZWPDGBIPAQVGH-BQFCYCMXSA-N 0 3 405.926 4.225 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)c3c[nH]cc3-c3cccc(OC)c3)cc2)CC1 ZINC000509702089 918333201 /nfs/dbraw/zinc/33/32/01/918333201.db2.gz NWHGDXJIKYCADH-UHFFFAOYSA-N 0 3 418.541 4.080 20 0 HIADHN CCN(C(=O)NC[C@H]1CCCN1C)[C@@H]1CCSc2ccc(Br)cc21 ZINC000509787137 918395851 /nfs/dbraw/zinc/39/58/51/918395851.db2.gz NITTUVPQJWKFAE-GDBMZVCRSA-N 0 3 412.397 4.112 20 0 HIADHN CC(C)c1nccn1Cc1cccc(NC(=O)NC[C@H](c2ccccc2)N(C)C)c1 ZINC000509919474 918519750 /nfs/dbraw/zinc/51/97/50/918519750.db2.gz LLTGBKCSSXPLPA-JOCHJYFZSA-N 0 3 405.546 4.479 20 0 HIADHN Cc1cccn2cc(COc3ccc(CN[C@H]4CCCc5nn(C)cc54)cc3)nc12 ZINC000509958187 918550835 /nfs/dbraw/zinc/55/08/35/918550835.db2.gz MMNWQQRNQTYRDQ-QFIPXVFZSA-N 0 3 401.514 4.122 20 0 HIADHN C[C@H]([N-]S(=O)(=O)c1cc(Cl)ccc1C(F)(F)F)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000509972089 918561314 /nfs/dbraw/zinc/56/13/14/918561314.db2.gz VUMOGJDPKWDZDC-QWHCGFSZSA-N 0 3 424.916 4.290 20 0 HIADHN C[C@H]([N-]S(=O)(=O)c1cc(Cl)ccc1C(F)(F)F)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000509972089 918561317 /nfs/dbraw/zinc/56/13/17/918561317.db2.gz VUMOGJDPKWDZDC-QWHCGFSZSA-N 0 3 424.916 4.290 20 0 HIADHN CCOc1cc(CN[C@@H]2CCN(C(=O)Nc3ccccc3)C2)cc(Cl)c1OC ZINC000509989763 918576969 /nfs/dbraw/zinc/57/69/69/918576969.db2.gz IAMYNBWFJUDCQF-QGZVFWFLSA-N 0 3 403.910 4.143 20 0 HIADHN CC(C)c1nn(-c2ccccc2)cc1CN[C@H]1CCN(C(=O)Nc2ccccc2)C1 ZINC000510022439 918598962 /nfs/dbraw/zinc/59/89/62/918598962.db2.gz DKNJBPULNDSHDR-NRFANRHFSA-N 0 3 403.530 4.392 20 0 HIADHN CC[C@H](CNC(=O)Cc1ccc(Br)s1)N1CCc2ccccc2C1 ZINC000510090944 918656401 /nfs/dbraw/zinc/65/64/01/918656401.db2.gz UCMHRYSSHOBSKW-MRXNPFEDSA-N 0 3 407.377 4.006 20 0 HIADHN CN(C)[C@@H](CNC(=O)c1ccc(Oc2ccncc2)c(Cl)c1)Cc1ccccc1 ZINC000510106415 918669233 /nfs/dbraw/zinc/66/92/33/918669233.db2.gz PNLLIAJWDYFBEZ-LJQANCHMSA-N 0 3 409.917 4.430 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)Nc1nc2cc3c(cc2s1)OCCO3 ZINC000510209853 918758136 /nfs/dbraw/zinc/75/81/36/918758136.db2.gz OXYITZTZRSUPIF-UHFFFAOYSA-N 0 3 409.467 4.128 20 0 HIADHN CN(Cc1ccc(F)c2cccnc12)C[C@H](O)COc1ccc(C(F)(F)F)cc1 ZINC000510226469 918768169 /nfs/dbraw/zinc/76/81/69/918768169.db2.gz ZTZVEKQUNUFSQI-INIZCTEOSA-N 0 3 408.395 4.264 20 0 HIADHN CC[C@@H](NCC(=O)N(C)[C@H](C)c1ccc(F)c(F)c1)c1ccc(OC)c(OC)c1 ZINC000510244665 918781523 /nfs/dbraw/zinc/78/15/23/918781523.db2.gz VEMINAMPGYHFFU-AUUYWEPGSA-N 0 3 406.473 4.242 20 0 HIADHN CCCN(Cc1nc(-c2cccc(C)c2)no1)C1CCN(c2cc(C)nc(C)n2)CC1 ZINC000510248470 918784873 /nfs/dbraw/zinc/78/48/73/918784873.db2.gz IDRWKNMDBHMWPT-UHFFFAOYSA-N 0 3 420.561 4.333 20 0 HIADHN COc1ccc([C@@H](Cc2ccc(F)cc2)NCc2ccc3c(c2)NC(=O)CO3)cc1 ZINC000510338560 918840524 /nfs/dbraw/zinc/84/05/24/918840524.db2.gz QZMSMWOCFVNTSU-OAQYLSRUSA-N 0 3 406.457 4.239 20 0 HIADHN Fc1cccc([C@@H](CNCc2ccc(Sc3ccccn3)o2)N2CCOCC2)c1 ZINC000510368637 918857383 /nfs/dbraw/zinc/85/73/83/918857383.db2.gz DPTDBNFIGJYNNM-HXUWFJFHSA-N 0 3 413.518 4.128 20 0 HIADHN CN(C)[C@H](CNC(=O)Nc1ccc(C(=O)NCc2ccccc2)cc1)c1ccccc1 ZINC000510387217 918866808 /nfs/dbraw/zinc/86/68/08/918866808.db2.gz VHZLDNQDFPPQCB-HSZRJFAPSA-N 0 3 416.525 4.041 20 0 HIADHN COc1cccc(OC)c1OC1CCN(Cc2c[nH]nc2-c2ccc(C)cc2)CC1 ZINC000510404417 918877228 /nfs/dbraw/zinc/87/72/28/918877228.db2.gz PMBXRIZSQYRSFV-UHFFFAOYSA-N 0 3 407.514 4.446 20 0 HIADHN O[C@@H](COc1c(Cl)cccc1Cl)CN1CC[C@@H](n2ncc3ccccc32)C1 ZINC000510419054 918885970 /nfs/dbraw/zinc/88/59/70/918885970.db2.gz CFQKOMMQSDKSJR-HZPDHXFCSA-N 0 3 406.313 4.030 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)NCc1cccc(NC(=O)N2CCCC2)c1 ZINC000510435053 918894858 /nfs/dbraw/zinc/89/48/58/918894858.db2.gz RGHYYZLFRNQVRO-UHFFFAOYSA-N 0 3 420.513 4.052 20 0 HIADHN CCOc1ccc(C(F)(F)F)cc1NC(=O)c1ccc(N2CCN(CC)CC2)cc1 ZINC000510435669 918895863 /nfs/dbraw/zinc/89/58/63/918895863.db2.gz VVNMBGKHAAMPLM-UHFFFAOYSA-N 0 3 421.463 4.498 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)Nc1cccc(-c2n[nH]c(C3CC3)n2)c1 ZINC000510438820 918897171 /nfs/dbraw/zinc/89/71/71/918897171.db2.gz WAKHFVJIXOCXKW-UHFFFAOYSA-N 0 3 401.470 4.409 20 0 HIADHN CN1CCN(Cc2ccc(CNC(=O)Nc3ccccc3OC3CCCC3)cc2)CC1 ZINC000510443465 918899646 /nfs/dbraw/zinc/89/96/46/918899646.db2.gz UARHHNKDIAQUNJ-UHFFFAOYSA-N 0 3 422.573 4.077 20 0 HIADHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)Nc1cc(F)cc(F)c1 ZINC000510463675 918920215 /nfs/dbraw/zinc/92/02/15/918920215.db2.gz WUBKRFQUZHPWBL-UHFFFAOYSA-N 0 3 412.278 4.323 20 0 HIADHN C[C@H](NC(=O)NC[C@@H](c1c[nH]c2ccccc21)c1ccccc1)C1=CCN(C)CC1 ZINC000510499165 918947607 /nfs/dbraw/zinc/94/76/07/918947607.db2.gz FIZSMRFKEXVGNK-PGRDOPGGSA-N 0 3 402.542 4.249 20 0 HIADHN Cc1n[nH]c(C)c1[C@@H]1CCCCCN1C(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000510546735 918991316 /nfs/dbraw/zinc/99/13/16/918991316.db2.gz NOKQPAAWECJZDQ-FCEUIQTBSA-N 0 3 409.578 4.489 20 0 HIADHN Cc1ccccc1C1(CNC(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)CCOCC1 ZINC000510549592 918993754 /nfs/dbraw/zinc/99/37/54/918993754.db2.gz MRSYGRFNDASPCI-JTHBVZDNSA-N 0 3 421.585 4.178 20 0 HIADHN CN(Cc1ccc(F)c2cccnc12)C[C@H](O)COc1ccccc1C(F)(F)F ZINC000510651917 919093759 /nfs/dbraw/zinc/09/37/59/919093759.db2.gz UBFIVNGGNLFUNI-HNNXBMFYSA-N 0 3 408.395 4.264 20 0 HIADHN O=C(Nc1cccc(CN[C@H]2CCc3ccc(Br)cc32)c1)[C@@H]1CCCO1 ZINC000510656073 919097348 /nfs/dbraw/zinc/09/73/48/919097348.db2.gz KNFOBDUPXWKNDG-PMACEKPBSA-N 0 3 415.331 4.344 20 0 HIADHN CC[C@H](CNC(=O)Nc1ccc(OC(F)F)c(F)c1)N1CCc2ccccc2C1 ZINC000510676339 919117269 /nfs/dbraw/zinc/11/72/69/919117269.db2.gz UJEPNIWNPNNAKN-QGZVFWFLSA-N 0 3 407.436 4.386 20 0 HIADHN COc1ccc(-c2nc3c(s2)[C@@H](NCc2ccc4c(c2)NC(=O)CO4)CCC3)cc1 ZINC000510718782 919160914 /nfs/dbraw/zinc/16/09/14/919160914.db2.gz NFSAIVCMRKKMJX-KRWDZBQOSA-N 0 3 421.522 4.317 20 0 HIADHN Cc1ccc(OCc2cccc(C(=O)N(CCN(C)C)Cc3cccc(F)c3)c2)cn1 ZINC000510743262 919190809 /nfs/dbraw/zinc/19/08/09/919190809.db2.gz QNSXXWHVOOCHTE-UHFFFAOYSA-N 0 3 421.516 4.312 20 0 HIADHN C[C@@H](NC(=O)[C@@H](Oc1ccc(F)cc1Cl)c1ccccc1)C1=CCN(C)CC1 ZINC000510787336 919253473 /nfs/dbraw/zinc/25/34/73/919253473.db2.gz KLLCTZBEZDCKDR-VFNWGFHPSA-N 0 3 402.897 4.366 20 0 HIADHN C[C@@H](NC(=O)CCc1ncc(-c2ccc(Cl)cc2Cl)o1)C1=CCN(C)CC1 ZINC000510795772 919264120 /nfs/dbraw/zinc/26/41/20/919264120.db2.gz SBALQJWVFMMPOR-CYBMUJFWSA-N 0 3 408.329 4.348 20 0 HIADHN C[C@H]1CSc2ccc(Br)cc2[C@@H]1NCc1ccc2c(c1)oc(=O)n2C ZINC000510798773 919269261 /nfs/dbraw/zinc/26/92/61/919269261.db2.gz TUJBGKYZYMUTGT-BBATYDOGSA-N 0 3 419.344 4.467 20 0 HIADHN Cc1cc(NC(=O)NCCc2ccsc2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000510823753 919302643 /nfs/dbraw/zinc/30/26/43/919302643.db2.gz GBCHRZNLAAVWRB-FQEVSTJZSA-N 0 3 409.559 4.064 20 0 HIADHN COc1cc(OC)c([C@H](C)N[C@H]2CCCN(C(=O)Cc3ccccc3)C2)cc1Cl ZINC000511008284 919570478 /nfs/dbraw/zinc/57/04/78/919570478.db2.gz ANPMAVFWZPWLKL-WMZOPIPTSA-N 0 3 416.949 4.242 20 0 HIADHN Cc1c(C(=O)N(CCN(C)C)Cc2ccc(F)cc2F)cnn1C1CCCCC1 ZINC000511016997 919585335 /nfs/dbraw/zinc/58/53/35/919585335.db2.gz QVXYZRAWXLAQIO-UHFFFAOYSA-N 0 3 404.505 4.179 20 0 HIADHN CC(C)CN(C(=O)c1cccc(-n2nccc2C(F)(F)F)c1)C1CCN(C)CC1 ZINC000511028525 919602078 /nfs/dbraw/zinc/60/20/78/919602078.db2.gz KQZFKHVIIAIVKW-UHFFFAOYSA-N 0 3 408.468 4.084 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)c1ccc2c(c1)[nH]c(=O)n2C1CCCC1 ZINC000511079106 919680613 /nfs/dbraw/zinc/68/06/13/919680613.db2.gz YXKLPAOPBKSFGU-HSZRJFAPSA-N 0 3 418.541 4.424 20 0 HIADHN C[C@H](C(=O)NC(c1ccccc1)c1ccccc1)N1CCN(CCC(C)(C)C)CC1 ZINC000511112750 919724182 /nfs/dbraw/zinc/72/41/82/919724182.db2.gz YKXKTURKQXSQPJ-OAQYLSRUSA-N 0 3 407.602 4.335 20 0 HIADHN O=C(Nc1cc(F)c(Br)cc1F)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000511126025 919740864 /nfs/dbraw/zinc/74/08/64/919740864.db2.gz NZNBTSPGYJCQNK-ZDUSSCGKSA-N 0 3 410.262 4.123 20 0 HIADHN Cc1cc(OC(F)F)c(C(=O)N2CCCN(CCCc3ccccc3)CC2)s1 ZINC000511133990 919750311 /nfs/dbraw/zinc/75/03/11/919750311.db2.gz GENFQRQVBCIOCM-UHFFFAOYSA-N 0 3 408.514 4.439 20 0 HIADHN Cc1cc(OC[C@@H](O)CN2CCC[C@H](c3ccnn3C)C2)c(C(C)C)cc1Cl ZINC000511137883 919753996 /nfs/dbraw/zinc/75/39/96/919753996.db2.gz QQEVVOCWGHTMSH-ROUUACIJSA-N 0 3 405.970 4.125 20 0 HIADHN O=C(Nc1ccc2c(c1)CCCC(=O)N2)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000511157790 919778702 /nfs/dbraw/zinc/77/87/02/919778702.db2.gz CVQNXWPHZCXUJO-IBGZPJMESA-N 0 3 413.468 4.057 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N[C@H](C)c3c(F)cccc3F)c(C)c2)CC1 ZINC000511193652 919811761 /nfs/dbraw/zinc/81/17/61/919811761.db2.gz VGYFIILLWUQAPI-MRXNPFEDSA-N 0 3 402.489 4.298 20 0 HIADHN C[C@@H]1CCCCN1C(=O)c1ccc(NC(=O)N(CCN(C)C)Cc2ccccc2)cc1 ZINC000511197749 919812949 /nfs/dbraw/zinc/81/29/49/919812949.db2.gz JBQLMRFQPRJSLZ-HXUWFJFHSA-N 0 3 422.573 4.297 20 0 HIADHN CC[C@H](C)n1ncc2c1nc(C)cc2C(=O)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000511207401 919819699 /nfs/dbraw/zinc/81/96/99/919819699.db2.gz NZOJXKWDZUFYIY-ICSRJNTNSA-N 0 3 405.546 4.105 20 0 HIADHN C[C@@H](NC(=O)N(C)[C@@H]1CCSc2ccc(Br)cc21)C1=CCN(C)CC1 ZINC000511254689 919857292 /nfs/dbraw/zinc/85/72/92/919857292.db2.gz ROUMRZCFEVJTMC-CXAGYDPISA-N 0 3 424.408 4.278 20 0 HIADHN COc1ccc2c(c1)CN(C(=O)N[C@H](C)C1=CCN(C)CC1)[C@H](c1ccccc1)C2 ZINC000511296768 919893584 /nfs/dbraw/zinc/89/35/84/919893584.db2.gz ZHPHMEVOQDRLLL-KOSHJBKYSA-N 0 3 405.542 4.155 20 0 HIADHN Cc1nn(C)c2nc(-c3ccccc3)cc(C(=O)N(CCN(C)C)C3CCCCC3)c12 ZINC000511331345 919922824 /nfs/dbraw/zinc/92/28/24/919922824.db2.gz DFCCPENRPOKUOT-UHFFFAOYSA-N 0 3 419.573 4.280 20 0 HIADHN Cc1ccc(-c2nnc(-c3ccc(C(=O)N[C@H](C)C4=CCN(C)CC4)cc3)o2)cc1 ZINC000511344237 919935457 /nfs/dbraw/zinc/93/54/57/919935457.db2.gz NLNAIELTUASQNF-QGZVFWFLSA-N 0 3 402.498 4.092 20 0 HIADHN C[C@@H](NC(=O)c1cc(-c2ccco2)n(-c2ccc(Cl)cc2)n1)C1=CCN(C)CC1 ZINC000511346278 919939312 /nfs/dbraw/zinc/93/93/12/919939312.db2.gz QXBCGDVOFXASOR-OAHLLOKOSA-N 0 3 410.905 4.166 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)c1ccc2c(c1)[nH]c(=O)n2C1CCCC1 ZINC000511356048 919950924 /nfs/dbraw/zinc/95/09/24/919950924.db2.gz UNBIECYYJIUJSF-QFIPXVFZSA-N 0 3 418.541 4.424 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N[C@@H](C[C@H]1CCOC1)c1ccccc1 ZINC000511366043 919959180 /nfs/dbraw/zinc/95/91/80/919959180.db2.gz SMWPTIPZPNUSIB-HLAWJBBLSA-N 0 3 413.587 4.352 20 0 HIADHN C[C@H](NC(=O)c1cccc(NC(=O)CCCc2cccs2)c1)C1=CCN(C)CC1 ZINC000511369827 919960690 /nfs/dbraw/zinc/96/06/90/919960690.db2.gz PDKHYCGMDGNVDL-KRWDZBQOSA-N 0 3 411.571 4.090 20 0 HIADHN CN(C(=O)N[C@H](C[C@@H]1CCOC1)c1ccccc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000511369238 919961504 /nfs/dbraw/zinc/96/15/04/919961504.db2.gz ADGQQKSYFGIEKM-ZKMPZPQNSA-N 0 3 421.585 4.460 20 0 HIADHN O=C(Cc1cn2cc(Cl)cc(Cl)c2n1)N[C@H](CN1CCCC1)c1ccccc1 ZINC000511391102 919999134 /nfs/dbraw/zinc/99/91/34/919999134.db2.gz NDDMZHLNDXIXLB-LJQANCHMSA-N 0 3 417.340 4.137 20 0 HIADHN CC[C@@H](C)n1ncc2c1nc(C)cc2C(=O)NC1CCN(Cc2ccccc2)CC1 ZINC000511493794 920103404 /nfs/dbraw/zinc/10/34/04/920103404.db2.gz SQJRWLOFUHUSOB-GOSISDBHSA-N 0 3 405.546 4.105 20 0 HIADHN Cc1cc(OC(F)F)c(C(=O)NC[C@H]2CCCN(Cc3cccs3)C2)s1 ZINC000511550242 920182804 /nfs/dbraw/zinc/18/28/04/920182804.db2.gz DBEXCVQOEOIVJJ-CYBMUJFWSA-N 0 3 400.516 4.361 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)N[C@@H](C)c2ccc3n[nH]cc3c2)N(C)C)cc1 ZINC000511642099 920308249 /nfs/dbraw/zinc/30/82/49/920308249.db2.gz VZCVPFUXSAMPHT-AOMKIAJQSA-N 0 3 409.534 4.013 20 0 HIADHN CC[C@H](C)n1ncc2c1nc(C)cc2C(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000511677501 920342675 /nfs/dbraw/zinc/34/26/75/920342675.db2.gz MHKJMONIJREQKG-CMKODMSKSA-N 0 3 405.546 4.276 20 0 HIADHN C[C@H](Sc1ccc(Br)cc1)C(=O)NC[C@H](c1ccccc1)N(C)C ZINC000511711506 920376531 /nfs/dbraw/zinc/37/65/31/920376531.db2.gz BNOOLBBIHIQFPM-KBXCAEBGSA-N 0 3 407.377 4.349 20 0 HIADHN O=C(CSC[C@@H]1CCCCO1)N[C@@H]1CN(Cc2ccccc2)C[C@H]1c1ccccc1 ZINC000511742864 920419088 /nfs/dbraw/zinc/41/90/88/920419088.db2.gz MWVCQUWBWMDSFF-KMDXXIMOSA-N 0 3 424.610 4.073 20 0 HIADHN O=C(CN1C[C@H](c2ccccc2)[C@H]2COCC[C@H]21)N(Cc1ccco1)c1ccccc1 ZINC000511764804 920449350 /nfs/dbraw/zinc/44/93/50/920449350.db2.gz ZILRIXNFGYHHNA-UBFVSLLYSA-N 0 3 416.521 4.317 20 0 HIADHN C[C@@H]1CCN(C(=O)CN2C[C@H](c3ccccc3)[C@H]3COCC[C@@H]32)c2ccccc2S1 ZINC000511794263 920488171 /nfs/dbraw/zinc/48/81/71/920488171.db2.gz SKFORIQOPRNVCM-NMIHRBCNSA-N 0 3 422.594 4.408 20 0 HIADHN Cc1ccc([C@H](NC(=O)CN2C[C@H](c3ccccc3)[C@H]3COCC[C@@H]32)C2CC2)cc1 ZINC000511795936 920489907 /nfs/dbraw/zinc/48/99/07/920489907.db2.gz JITNOSHCRSXKID-BIATYSSJSA-N 0 3 404.554 4.067 20 0 HIADHN COCc1ccccc1/C=C(\C)CN[C@@H]1CC(=O)N(C)[C@H]1c1ccc(F)c(F)c1 ZINC000511800099 920493950 /nfs/dbraw/zinc/49/39/50/920493950.db2.gz TZULGGUDGMZGRZ-YBUUMFMDSA-N 0 3 400.469 4.076 20 0 HIADHN CN(C)C(=O)Cc1nc(CN[C@@H]2CCC[C@@H]2c2cccc(C(F)(F)F)c2)cs1 ZINC000511804566 920499886 /nfs/dbraw/zinc/49/98/86/920499886.db2.gz DFDJIKRKFGCAAW-IAGOWNOFSA-N 0 3 411.493 4.219 20 0 HIADHN CCOc1cc(CNC(=O)[C@@H](C)N2CCC(Cc3ccccc3)CC2)ccc1OC ZINC000511865509 920593823 /nfs/dbraw/zinc/59/38/23/920593823.db2.gz YWUNWYHVUILFMZ-LJQANCHMSA-N 0 3 410.558 4.053 20 0 HIADHN C[C@@H](CNCc1ncc(CN(C)C)s1)Sc1ccc(Br)cc1 ZINC000512010607 920782368 /nfs/dbraw/zinc/78/23/68/920782368.db2.gz SQYIGYUCUSTSFG-LBPRGKRZSA-N 0 3 400.411 4.238 20 0 HIADHN O=C(NCc1ccncc1)Nc1cccc(CNC/C=C/c2ccc(F)c(F)c2)c1 ZINC000512047413 920818181 /nfs/dbraw/zinc/81/81/81/920818181.db2.gz ZXGSQQXQBKPCFH-DUXPYHPUSA-N 0 3 408.452 4.485 20 0 HIADHN CCc1nc([C@H](C)N[C@@H](C)CC(=O)Nc2cc(C(F)(F)F)ccc2Cl)n[nH]1 ZINC000512068362 920834979 /nfs/dbraw/zinc/83/49/79/920834979.db2.gz QZUCGWRWXNYJJD-UWVGGRQHSA-N 0 3 403.836 4.107 20 0 HIADHN Cc1ccc2nc([C@H]3CCCN3C(=O)c3ccc(CN4CCSCC4)cc3)[nH]c2c1 ZINC000512088976 920852656 /nfs/dbraw/zinc/85/26/56/920852656.db2.gz KYPQOIOFUZGXCI-JOCHJYFZSA-N 0 3 420.582 4.397 20 0 HIADHN C[C@@H]1CN(Cc2ccc(CNCc3cscc3Br)cc2)C[C@@H](C)O1 ZINC000512088948 920853136 /nfs/dbraw/zinc/85/31/36/920853136.db2.gz PXAKANIWIUSIJL-HUUCEWRRSA-N 0 3 409.393 4.410 20 0 HIADHN CC1=C(c2ccco2)CN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)CC1 ZINC000512119151 920871772 /nfs/dbraw/zinc/87/17/72/920871772.db2.gz BHMBFBHHGQMHPT-UHFFFAOYSA-N 0 3 422.573 4.071 20 0 HIADHN Cc1nn(-c2ccccc2Cl)c2sc(C(=O)N[C@@H](C)C3=CCN(C)CC3)cc12 ZINC000512123876 920874239 /nfs/dbraw/zinc/87/42/39/920874239.db2.gz OJDXDURKAWFXCA-ZDUSSCGKSA-N 0 3 414.962 4.429 20 0 HIADHN CC(C)C[C@H](Cc1cccc(Br)c1)C(=O)N[C@@H](C)C1=CCN(C)CC1 ZINC000512129101 920877416 /nfs/dbraw/zinc/87/74/16/920877416.db2.gz SYGUHOKKUVUSOC-QFBILLFUSA-N 0 3 407.396 4.421 20 0 HIADHN C[C@H](NC(=O)c1cccnc1Oc1ccc(Br)cc1)C1=CCN(C)CC1 ZINC000512144637 920888944 /nfs/dbraw/zinc/88/89/44/920888944.db2.gz VFXXKHQWUSMYLF-AWEZNQCLSA-N 0 3 416.319 4.017 20 0 HIADHN CCN1CCN(CCC(=O)Nc2ccc(N[C@H](C)c3ccccc3)c(Cl)c2)CC1 ZINC000512157623 920897086 /nfs/dbraw/zinc/89/70/86/920897086.db2.gz FPJWRSDDSSDOCM-GOSISDBHSA-N 0 3 414.981 4.479 20 0 HIADHN Cc1cccc(S(=O)(=O)CCCN[C@@H](CCO)c2ccc(Cl)c(Cl)c2)c1 ZINC000512165010 920900534 /nfs/dbraw/zinc/90/05/34/920900534.db2.gz KMCYUWPMRYKLAG-IBGZPJMESA-N 0 3 416.370 4.179 20 0 HIADHN C[C@@H](OC[C@@H](O)CN(C)CCc1nc(-c2ccccc2)no1)c1ccc(Cl)cc1 ZINC000512181263 920920410 /nfs/dbraw/zinc/92/04/10/920920410.db2.gz OVRVMVKSUHULCH-UZLBHIALSA-N 0 3 415.921 4.003 20 0 HIADHN O=C(NCCCCN1CCN(Cc2ccccc2)CC1)N1CCC[C@]2(CC=CCC2)C1 ZINC000512197261 920942927 /nfs/dbraw/zinc/94/29/27/920942927.db2.gz OXYGLVQKEMUWAZ-AREMUKBSSA-N 0 3 424.633 4.116 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N[C@H](C[C@H]3CCOC3)c3ccccc3)cc2)CC1 ZINC000512206678 920953830 /nfs/dbraw/zinc/95/38/30/920953830.db2.gz HZDUUDVYBRQUEJ-PXDATVDWSA-N 0 3 421.585 4.115 20 0 HIADHN O=C1[C@H](NCc2ccc(-n3ccc(C(F)(F)F)n3)cc2)CCCN1c1ccccc1 ZINC000512219759 920969304 /nfs/dbraw/zinc/96/93/04/920969304.db2.gz RUDPDXHMSSDKOU-LJQANCHMSA-N 0 3 414.431 4.176 20 0 HIADHN CCN(CC)C(=O)C1CCN(Cc2c(C)nn(Cc3ccc(Cl)cc3)c2C)CC1 ZINC000512226619 920977787 /nfs/dbraw/zinc/97/77/87/920977787.db2.gz JUEGXMDCOAFXEZ-UHFFFAOYSA-N 0 3 416.997 4.282 20 0 HIADHN CCC[C@]1(NCC(=O)N2N=C(c3cc4ccccc4o3)C[C@@H]2c2ccco2)CCOC1 ZINC000512292965 921049019 /nfs/dbraw/zinc/04/90/19/921049019.db2.gz RGWXXCDLPGUOLY-DVECYGJZSA-N 0 3 421.497 4.252 20 0 HIADHN COc1cc(C)c(Br)cc1C(=O)N(Cc1ccco1)C1CCN(C)CC1 ZINC000512311598 921063398 /nfs/dbraw/zinc/06/33/98/921063398.db2.gz CGAAISRLGGFABB-UHFFFAOYSA-N 0 3 421.335 4.096 20 0 HIADHN CN(CC(=O)NCc1cccc(COCc2ccco2)c1)[C@H]1CCc2ccccc2C1 ZINC000512318354 921068185 /nfs/dbraw/zinc/06/81/85/921068185.db2.gz OFZUKDIITFHDBM-DEOSSOPVSA-N 0 3 418.537 4.102 20 0 HIADHN CCc1ccc2occ(C(=O)Nc3ccc(C(=O)NCCN4CCCC4)cc3)c2c1 ZINC000512320334 921071218 /nfs/dbraw/zinc/07/12/18/921071218.db2.gz QIAAOGZEWAFENL-UHFFFAOYSA-N 0 3 405.498 4.073 20 0 HIADHN CN(CC(=O)N1CCC[C@@H]1c1ccc2c(c1)OCCCO2)[C@H]1CCc2ccccc2C1 ZINC000512323101 921074062 /nfs/dbraw/zinc/07/40/62/921074062.db2.gz LLNZIXHMLUNRPH-XZOQPEGZSA-N 0 3 420.553 4.001 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CN1CCC(C(=O)NCCc2cccs2)CC1 ZINC000512344879 921089706 /nfs/dbraw/zinc/08/97/06/921089706.db2.gz AODZAIJTTDVAGH-UHFFFAOYSA-N 0 3 422.598 4.122 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)c1csc(Cc2ccccc2)n1 ZINC000513495208 921845265 /nfs/dbraw/zinc/84/52/65/921845265.db2.gz MXDXRRVHPPWXND-UHFFFAOYSA-N 0 3 415.509 4.216 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)Cc1csc(-c2cccs2)n1 ZINC000513494068 921845316 /nfs/dbraw/zinc/84/53/16/921845316.db2.gz FGNGHHZRUHERQE-UHFFFAOYSA-N 0 3 421.538 4.283 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2CNCc2ccccc2OC(F)(F)F)C[C@H](C)O1 ZINC000513588048 921919935 /nfs/dbraw/zinc/91/99/35/921919935.db2.gz GVQCUSBGEKKPRL-CALCHBBNSA-N 0 3 408.464 4.484 20 0 HIADHN CCCCCOc1ccc(CN[C@H](C)c2ccc(S(=O)(=O)N(C)C)cc2)cc1 ZINC000513622107 921950958 /nfs/dbraw/zinc/95/09/58/921950958.db2.gz MIGIOJGKZSPCGQ-GOSISDBHSA-N 0 3 404.576 4.357 20 0 HIADHN COc1ccc([C@H](Cc2ccncc2)NCc2cccc(C(=O)NC3CC3)c2)cc1 ZINC000513654451 921976033 /nfs/dbraw/zinc/97/60/33/921976033.db2.gz INSRZYHUUMOVOY-DEOSSOPVSA-N 0 3 401.510 4.056 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3ccccc3Oc3ccncc3)CC2)C[C@H](C)O1 ZINC000513831638 922159221 /nfs/dbraw/zinc/15/92/21/922159221.db2.gz VMRXMRAWODAGIN-BGYRXZFFSA-N 0 3 423.557 4.225 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3ccccc3Oc3ccncc3)CC2)C[C@@H](C)O1 ZINC000513831640 922160127 /nfs/dbraw/zinc/16/01/27/922160127.db2.gz VMRXMRAWODAGIN-WOJBJXKFSA-N 0 3 423.557 4.225 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1ccc(Cl)c2ncccc12 ZINC000513840019 922167009 /nfs/dbraw/zinc/16/70/09/922167009.db2.gz VLCZJORWTVJZOG-UHFFFAOYSA-N 0 3 409.917 4.345 20 0 HIADHN Cc1noc(C)c1[C@@H](C)CC(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1 ZINC000513855749 922180744 /nfs/dbraw/zinc/18/07/44/922180744.db2.gz KEHAYMWLDRJTLP-AWEZNQCLSA-N 0 3 411.468 4.394 20 0 HIADHN C[C@@H]1CCCN(S(=O)(=O)c2ccc(CN[C@@H]3CCc4c3cccc4F)cc2)C1 ZINC000513858469 922186276 /nfs/dbraw/zinc/18/62/76/922186276.db2.gz ABURMMGIHYCLMI-OPAMFIHVSA-N 0 3 402.535 4.023 20 0 HIADHN Cc1n[nH]c(C)c1NC(=O)CN(Cc1ccc2c(c1)OCO2)[C@@H]1CCC[C@@H](C)[C@H]1C ZINC000513958404 922276570 /nfs/dbraw/zinc/27/65/70/922276570.db2.gz QCKDPFDIASNNDJ-SPYBWZPUSA-N 0 3 412.534 4.021 20 0 HIADHN CSc1cc2c(cc1NC(=O)N[C@@H]1CCN([C@@H](C)c3ccccc3)C1)OCCO2 ZINC000513972394 922291644 /nfs/dbraw/zinc/29/16/44/922291644.db2.gz BPEZZEXYKGSBQN-DOTOQJQBSA-N 0 3 413.543 4.137 20 0 HIADHN CCN(CCc1nccs1)C(=O)NC[C@@H](c1ccccc1)N1CCC(C)CC1 ZINC000513998117 922323521 /nfs/dbraw/zinc/32/35/21/922323521.db2.gz ZAKMLHZNAHBJQW-FQEVSTJZSA-N 0 3 400.592 4.190 20 0 HIADHN CCN(CCc1nccs1)C(=O)NC[C@H](c1cccs1)N1CCC(C)CC1 ZINC000514003072 922328935 /nfs/dbraw/zinc/32/89/35/922328935.db2.gz GSVYZADBOKKMOE-QGZVFWFLSA-N 0 3 406.621 4.252 20 0 HIADHN C[C@H](Cc1ccccc1Cl)C(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000514012012 922337240 /nfs/dbraw/zinc/33/72/40/922337240.db2.gz WKGZGTGOIXYOIA-QRVBRYPASA-N 0 3 406.998 4.257 20 0 HIADHN CCOc1cc2c(cc1CNC(=O)N[C@@H]1CCN([C@H](C)c3ccccc3)C1)O[C@@H](C)C2 ZINC000514027530 922350927 /nfs/dbraw/zinc/35/09/27/922350927.db2.gz SXYJIZYHNQOJCC-NJNPRVFISA-N 0 3 423.557 4.043 20 0 HIADHN Clc1ccccc1[C@H](CN[C@@H](c1ncc[nH]1)C1CCCCC1)N1CCOCC1 ZINC000514081924 922404080 /nfs/dbraw/zinc/40/40/80/922404080.db2.gz DVQAMTWYHCSJMC-LEWJYISDSA-N 0 3 402.970 4.348 20 0 HIADHN CO[C@H](CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1)c1ccc(Cl)cc1 ZINC000514080581 922404650 /nfs/dbraw/zinc/40/46/50/922404650.db2.gz UMMYTIHGZMBYEF-HXUWFJFHSA-N 0 3 405.901 4.453 20 0 HIADHN CC(=O)Nc1ccc(S(=O)(=O)CCCN(C)[C@@H](c2ccccc2C)C(C)C)cc1 ZINC000514095474 922419072 /nfs/dbraw/zinc/41/90/72/922419072.db2.gz OWUGTIIQKHFXRK-HSZRJFAPSA-N 0 3 416.587 4.446 20 0 HIADHN Cc1ccc2nc(CN(Cc3ccc(Br)cc3)C(C)C)cc(=O)n2c1 ZINC000514100227 922426851 /nfs/dbraw/zinc/42/68/51/922426851.db2.gz UIIQFCQPKRFSJH-UHFFFAOYSA-N 0 3 400.320 4.176 20 0 HIADHN COc1ccc([C@@H](C)N[C@H](C)c2ccc(OCC(=O)NC3CC3)cc2)c(C)c1OC ZINC000514105978 922434424 /nfs/dbraw/zinc/43/44/24/922434424.db2.gz VGDRMNOTQQBRBK-IAGOWNOFSA-N 0 3 412.530 4.081 20 0 HIADHN COCCN(CCc1nc2sc3c(c2c(N)n1)CC[C@@H](C)C3)Cc1cccs1 ZINC000514113682 922445875 /nfs/dbraw/zinc/44/58/75/922445875.db2.gz WZUGHWKQZCPBPS-CQSZACIVSA-N 0 3 416.616 4.151 20 0 HIADHN CCN(CC(=O)Nc1c(Br)cc(C)cc1Br)CC(C)C ZINC000514117291 922449477 /nfs/dbraw/zinc/44/94/77/922449477.db2.gz UHPHLTFNIGLSHO-UHFFFAOYSA-N 0 3 406.162 4.436 20 0 HIADHN CCn1c2ccccc2nc1[C@H]1CCCN1C(=O)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000514150013 922486328 /nfs/dbraw/zinc/48/63/28/922486328.db2.gz VVIPBNFXOHITQL-NFBKMPQASA-N 0 3 417.557 4.177 20 0 HIADHN CCc1ccc([C@H](CNC(=O)NCC2(c3ccccc3C)CCOCC2)N(C)C)cc1 ZINC000514166410 922505933 /nfs/dbraw/zinc/50/59/33/922505933.db2.gz CKIYZOZSFLPZQU-DEOSSOPVSA-N 0 3 423.601 4.208 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)NC[C@@H]1CCCO[C@H]1c1ccccc1 ZINC000514176690 922514447 /nfs/dbraw/zinc/51/44/47/922514447.db2.gz UIUPDMWAOHPKPG-ONTIZHBOSA-N 0 3 413.587 4.352 20 0 HIADHN CC[C@@H]1C[C@@H](CC(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)CCO1 ZINC000514190148 922530710 /nfs/dbraw/zinc/53/07/10/922530710.db2.gz PTOKLHAVQWAITC-PKOBYXMFSA-N 0 3 400.485 4.191 20 0 HIADHN CCCOc1ncccc1CNC(=O)NC[C@H](c1cccs1)N1CCC(C)CC1 ZINC000514201631 922539855 /nfs/dbraw/zinc/53/98/55/922539855.db2.gz JWLVNXQOEHSERB-LJQANCHMSA-N 0 3 416.591 4.204 20 0 HIADHN CN(Cc1cccc(Br)c1)C(=O)N[C@H](CN1CCCC1)c1ccccc1 ZINC000514215096 922549319 /nfs/dbraw/zinc/54/93/19/922549319.db2.gz RDSRYWOZZHULBP-HXUWFJFHSA-N 0 3 416.363 4.428 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NC[C@@H]1CCN(c2ccc(F)cc2)C1)c1ccsc1 ZINC000514221618 922554607 /nfs/dbraw/zinc/55/46/07/922554607.db2.gz ISRDHXCULJECPQ-UWJYYQICSA-N 0 3 418.582 4.096 20 0 HIADHN O=C(NCc1sccc1Br)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000514221619 922555391 /nfs/dbraw/zinc/55/53/91/922555391.db2.gz ISSGMDGWSVWORG-INIZCTEOSA-N 0 3 408.365 4.147 20 0 HIADHN COc1cc(C)c([C@H](C)NC(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)cc1OC ZINC000514225166 922560498 /nfs/dbraw/zinc/56/04/98/922560498.db2.gz MFJCPZONALRBJZ-NLWGTHIKSA-N 0 3 411.546 4.208 20 0 HIADHN CCC[C@H](NC(=O)NC[C@@H](c1ccsc1)N(CC)CC)c1nnc2ccccn21 ZINC000514242243 922581684 /nfs/dbraw/zinc/58/16/84/922581684.db2.gz QZQWKQVSDJZDDG-ROUUACIJSA-N 0 3 414.579 4.014 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)c1cc2c(cc(Br)cc2F)[nH]1 ZINC000514398317 922611917 /nfs/dbraw/zinc/61/19/17/922611917.db2.gz DDELQCNUWQOLEH-UHFFFAOYSA-N 0 3 420.282 4.392 20 0 HIADHN CC(=O)N1C[C@@H]2CCC[C@@H](NCc3csc(Cc4ccc(Cl)cc4)n3)[C@@H]2C1 ZINC000514411499 922614654 /nfs/dbraw/zinc/61/46/54/922614654.db2.gz FKXHNSLQLIRYHH-PWIZWCRZSA-N 0 3 403.979 4.124 20 0 HIADHN CC(C)(C)OC(=O)C[C@@H]1CCCN(C(=O)NC[C@H](c2cccs2)N2CCCC2)C1 ZINC000514425137 922621058 /nfs/dbraw/zinc/62/10/58/922621058.db2.gz GRSUCYSBMQHMDR-ZWKOTPCHSA-N 0 3 421.607 4.038 20 0 HIADHN COc1cc(CNCCCS(=O)(=O)c2ccc(Cl)cc2)ccc1OC(C)C ZINC000514616736 922723928 /nfs/dbraw/zinc/72/39/28/922723928.db2.gz FVYSBTXGHUGQMZ-UHFFFAOYSA-N 0 3 411.951 4.089 20 0 HIADHN COc1ccc(OC)c([C@@H]2CCCN2C[C@H](O)COCc2ccccc2Cl)c1 ZINC000514710878 922771025 /nfs/dbraw/zinc/77/10/25/922771025.db2.gz MHTQNGOEKSEIDG-UWJYYQICSA-N 0 3 405.922 4.072 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)c1ccc(C(=O)N(C)c2ccccc2)cc1)c1ccco1 ZINC000514750603 922781634 /nfs/dbraw/zinc/78/16/34/922781634.db2.gz XXWUPLTVHPNVEP-AVRDEDQJSA-N 0 3 419.525 4.415 20 0 HIADHN Cc1cc(C(=O)NC[C@@H](C(C)C)N2CCc3ccccc3C2)c(C)n1-c1nccs1 ZINC000514821360 922814925 /nfs/dbraw/zinc/81/49/25/922814925.db2.gz JMNWRCNGKMTWIL-QFIPXVFZSA-N 0 3 422.598 4.363 20 0 HIADHN COCCCN(C(=O)c1cc(-c2ccc(OC)cc2)c(C)s1)C1CCN(C)CC1 ZINC000514978648 922864355 /nfs/dbraw/zinc/86/43/55/922864355.db2.gz WLGKYPKCPGKVPM-UHFFFAOYSA-N 0 3 416.587 4.305 20 0 HIADHN CCn1c2ccccc2c2cc(NC(=O)C(=O)NC[C@@H](C)N3CCCC[C@@H]3C)ccc21 ZINC000515278516 923031562 /nfs/dbraw/zinc/03/15/62/923031562.db2.gz LBOBMDFXYZBNDO-ZWKOTPCHSA-N 0 3 420.557 4.132 20 0 HIADHN CCOc1ccc(-c2nc(CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)cs2)cc1 ZINC000515360160 923065559 /nfs/dbraw/zinc/06/55/59/923065559.db2.gz FWHYSRGUVKLUSI-HXUWFJFHSA-N 0 3 421.566 4.142 20 0 HIADHN COc1cc(NC(=O)CCNCc2ccccc2OC(F)F)c(OC)cc1Cl ZINC000515363064 923067233 /nfs/dbraw/zinc/06/72/33/923067233.db2.gz PFLCLGRQABGXAB-UHFFFAOYSA-N 0 3 414.836 4.077 20 0 HIADHN Cc1noc(-c2ccc(C)c(NC(=O)NC[C@H](c3ccccc3)N3CCCC3)c2)n1 ZINC000515467434 923120028 /nfs/dbraw/zinc/12/00/28/923120028.db2.gz KYLUNDWJYMVQBI-OAQYLSRUSA-N 0 3 405.502 4.312 20 0 HIADHN C[C@@H](NCCC(=O)N1CCOc2ccccc21)c1ccc(Br)cc1F ZINC000515476109 923124216 /nfs/dbraw/zinc/12/42/16/923124216.db2.gz GGNBUWYDVIMKGX-CYBMUJFWSA-N 0 3 407.283 4.055 20 0 HIADHN O=C(CN1CCCC2(CCOCC2)C1)N1Cc2ccccc2[C@H](c2ccccc2)C1 ZINC000515566090 923183109 /nfs/dbraw/zinc/18/31/09/923183109.db2.gz YZKFQHWKRQVTJH-DEOSSOPVSA-N 0 3 404.554 4.053 20 0 HIADHN CSc1ccc(NC(=O)[C@@H](C)N[C@H](C)c2ccc(NC(=O)NC3CC3)cc2)cc1 ZINC000515756243 923328824 /nfs/dbraw/zinc/32/88/24/923328824.db2.gz SNSVAFKDKZFROX-HUUCEWRRSA-N 0 3 412.559 4.370 20 0 HIADHN CCC(C)(C)NC(=O)c1ccc(NC(=O)N2CCN(CCC(C)(C)C)CC2)cc1 ZINC000515795466 923355604 /nfs/dbraw/zinc/35/56/04/923355604.db2.gz UJIMWVFSZGLCTQ-UHFFFAOYSA-N 0 3 402.583 4.191 20 0 HIADHN CC(C)Oc1ccccc1[C@@H](C)NC(=O)N(CCN(C)C)Cc1ccccc1F ZINC000515838561 923385625 /nfs/dbraw/zinc/38/56/25/923385625.db2.gz CEIBTZNMJQFINM-GOSISDBHSA-N 0 3 401.526 4.447 20 0 HIADHN C[C@H](NC(=O)NC[C@@H](c1ccccc1)N(C)C)c1cccc(OCc2ccccn2)c1 ZINC000515854700 923394408 /nfs/dbraw/zinc/39/44/08/923394408.db2.gz CDAPSBVLVDAABU-CYFREDJKSA-N 0 3 418.541 4.324 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)cc1OC ZINC000516164957 923583576 /nfs/dbraw/zinc/58/35/76/923583576.db2.gz IHPLPVNYHGNMLQ-QIJUGHKUSA-N 0 3 423.557 4.386 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)NCc2cc(F)cc(Br)c2)C1 ZINC000516165065 923584164 /nfs/dbraw/zinc/58/41/64/923584164.db2.gz LWOYMHXKGUFDKP-AUUYWEPGSA-N 0 3 420.326 4.223 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3ccc(-c4ccccn4)cc3)CC2)C[C@@H](C)O1 ZINC000516354236 923683592 /nfs/dbraw/zinc/68/35/92/923683592.db2.gz IXIBNNHWUVBARB-WOJBJXKFSA-N 0 3 422.573 4.492 20 0 HIADHN CC(=O)Nc1ccc(S[C@@H](C)C(=O)N[C@@H](CN2CCCC2)c2ccccc2)cc1 ZINC000516391968 923706975 /nfs/dbraw/zinc/70/69/75/923706975.db2.gz XYOFHADGCUITDP-JTSKRJEESA-N 0 3 411.571 4.079 20 0 HIADHN CN(C)Cc1ccc(S(=O)(=O)Nc2c(F)cc(Br)cc2Cl)cc1 ZINC000516497220 923760020 /nfs/dbraw/zinc/76/00/20/923760020.db2.gz KPUXWVGXLFTMIZ-UHFFFAOYSA-N 0 3 421.719 4.104 20 0 HIADHN Brc1ccc2c(c1)[C@H](NCc1ccc(Cn3cncn3)cc1)CCCO2 ZINC000516517419 923775776 /nfs/dbraw/zinc/77/57/76/923775776.db2.gz VTLDJBQKBMNEHH-LJQANCHMSA-N 0 3 413.319 4.092 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)NCc2ccc(Br)s2)C1 ZINC000516581478 923801926 /nfs/dbraw/zinc/80/19/26/923801926.db2.gz NFKJMJRCILTBLL-UKRRQHHQSA-N 0 3 408.365 4.145 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)Nc1cc(C)n(-c2ccc(F)cc2F)n1)c1ccco1 ZINC000516600594 923808845 /nfs/dbraw/zinc/80/88/45/923808845.db2.gz VMIQGQOUODZEHF-CXAGYDPISA-N 0 3 417.460 4.303 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3c(C)nn(-c4ccc(Br)cc4)c3C)C2)c1 ZINC000516609284 923815689 /nfs/dbraw/zinc/81/56/89/923815689.db2.gz DXOPVUDEPHFPAY-LJQANCHMSA-N 0 3 414.351 4.204 20 0 HIADHN CC1CCN([C@H](CNC(=O)N2CC(C)(C)[C@H]2[C@H]2CCCO2)c2cccs2)CC1 ZINC000516610660 923817449 /nfs/dbraw/zinc/81/74/49/923817449.db2.gz ZNUPCEHSLCFQRE-QWFCFKBJSA-N 0 3 405.608 4.120 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)c2ccccc2OCc2ccncc2)C1 ZINC000516623197 923820740 /nfs/dbraw/zinc/82/07/40/923820740.db2.gz XGTQWBCZICJQKG-UGKGYDQZSA-N 0 3 401.510 4.226 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCc3cccc(OCC(C)C)c3)c(C)c2)CC1 ZINC000516659382 923832267 /nfs/dbraw/zinc/83/22/67/923832267.db2.gz JBZBPXBEGMQPON-UHFFFAOYSA-N 0 3 424.589 4.493 20 0 HIADHN COCCCCN(Cc1ccccc1)C(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000516707833 923855827 /nfs/dbraw/zinc/85/58/27/923855827.db2.gz ALOFRYISLSNQFB-XUZZJYLKSA-N 0 3 409.574 4.460 20 0 HIADHN COc1ccc(COCc2noc([C@@H]3CN(C(C)(C)C)C[C@H]3C(F)(F)F)n2)cc1 ZINC000516836137 923912877 /nfs/dbraw/zinc/91/28/77/923912877.db2.gz OWXQNDCEVSLMAC-HZPDHXFCSA-N 0 3 413.440 4.171 20 0 HIADHN Cn1cc(NC(=O)[C@@H]2CN(Cc3ccccc3)CCC2(F)F)c(-c2ccccc2)n1 ZINC000516931171 923939681 /nfs/dbraw/zinc/93/96/81/923939681.db2.gz OXLJIXMGSQOYGC-IBGZPJMESA-N 0 3 410.468 4.183 20 0 HIADHN CCc1cccc(C)c1NC(=O)CN[C@H]1CCN(CC)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000516982847 923950733 /nfs/dbraw/zinc/95/07/33/923950733.db2.gz UBVMMZBSUIBMMN-WMZHIEFXSA-N 0 3 419.491 4.338 20 0 HIADHN C[C@@H](NCC(=O)NC[C@H]1CCN(c2ccccc2)C1)c1ccc(F)c2ccccc21 ZINC000517053296 923976500 /nfs/dbraw/zinc/97/65/00/923976500.db2.gz AKFPNIJJDQYNBB-RTBURBONSA-N 0 3 405.517 4.272 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCCc1nc(C(C)(C)C)cs1)c1ccsc1 ZINC000517090652 923991302 /nfs/dbraw/zinc/99/13/02/923991302.db2.gz OKTZLIBCTFMCQI-MRXNPFEDSA-N 0 3 408.637 4.427 20 0 HIADHN CC1CCN([C@H](CNC(=O)NCCCCNc2ccccn2)c2cccs2)CC1 ZINC000517103063 923999184 /nfs/dbraw/zinc/99/91/84/923999184.db2.gz APDKBXVCNZCYBR-LJQANCHMSA-N 0 3 415.607 4.108 20 0 HIADHN Cc1cc(C(=O)NC(C)C)ccc1NC(=O)N[C@H](CN1CCCC1)c1ccccc1 ZINC000517304192 924090063 /nfs/dbraw/zinc/09/00/63/924090063.db2.gz ZHGNWCTXIHXKGT-JOCHJYFZSA-N 0 3 408.546 4.092 20 0 HIADHN COc1cccc([C@@H]2C[C@@H]2C(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)c1 ZINC000517335817 924110245 /nfs/dbraw/zinc/11/02/45/924110245.db2.gz SCXYOERJIRLFFX-SFTDATJTSA-N 0 3 420.475 4.408 20 0 HIADHN Cc1cccc(-c2nnc(SC[C@@H]3CN(Cc4ccccc4)CCCO3)n2C)c1 ZINC000517402525 924159679 /nfs/dbraw/zinc/15/96/79/924159679.db2.gz ZAGZZVVMNUKBRG-NRFANRHFSA-N 0 3 408.571 4.174 20 0 HIADHN CN1CCN(Cc2ccc(CNC(=O)[C@H]3C[C@H]3c3cccc4ccccc43)cc2)CC1 ZINC000517406702 924160618 /nfs/dbraw/zinc/16/06/18/924160618.db2.gz FZEXZGHSQAKUKW-UIOOFZCWSA-N 0 3 413.565 4.007 20 0 HIADHN COC(=O)c1c(C)c(C)sc1NC(=O)N(CCN(C)C)Cc1cccc(C)c1 ZINC000517472151 924213696 /nfs/dbraw/zinc/21/36/96/924213696.db2.gz SASAOOHFHKWDEY-UHFFFAOYSA-N 0 3 403.548 4.056 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N[C@@H](c2ccc3c(c2)OCCO3)C2CC2)C1 ZINC000517543443 924256048 /nfs/dbraw/zinc/25/60/48/924256048.db2.gz RTJWECSLHRJQIF-NYQDVAGCSA-N 0 3 421.541 4.044 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@H](C)NCc2ccc(OC)cc2Cl)CC1 ZINC000517547431 924258581 /nfs/dbraw/zinc/25/85/81/924258581.db2.gz UNZBZQJHMKFNSM-INIZCTEOSA-N 0 3 405.945 4.480 20 0 HIADHN COc1cc(Br)c(CNC[C@H](C)N2CCc3ccccc32)cc1OC ZINC000517550023 924260202 /nfs/dbraw/zinc/26/02/02/924260202.db2.gz MIDYVZRFUBUUSI-AWEZNQCLSA-N 0 3 405.336 4.007 20 0 HIADHN COc1ccc(OCc2ccccn2)c(CNCCN2c3ccccc3C[C@H]2C)c1 ZINC000517552346 924261404 /nfs/dbraw/zinc/26/14/04/924261404.db2.gz IDOBIFUYHNSCJI-LJQANCHMSA-N 0 3 403.526 4.210 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)c1ccc(F)cc1Br ZINC000517600462 926709893 /nfs/dbraw/zinc/70/98/93/926709893.db2.gz YYCHVTSCQFDJOI-KRWDZBQOSA-N 0 3 420.326 4.110 20 0 HIADHN CC(C)Oc1ccccc1[C@H](C)NC(=O)CCCN1CCN(c2ccccc2)CC1 ZINC000517655715 926761981 /nfs/dbraw/zinc/76/19/81/926761981.db2.gz SBVKTMATFLIMQA-NRFANRHFSA-N 0 3 409.574 4.253 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCCCOc3c(C)cccc3C)c(C)c2)CC1 ZINC000517716223 926811081 /nfs/dbraw/zinc/81/10/81/926811081.db2.gz CLQMSVWMDZCHDL-UHFFFAOYSA-N 0 3 424.589 4.344 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)N1CCC(COc2ccccc2)CC1 ZINC000517715044 926811097 /nfs/dbraw/zinc/81/10/97/926811097.db2.gz ZOCLHLPQJRLMAC-NRFANRHFSA-N 0 3 413.587 4.386 20 0 HIADHN COCCCCN(Cc1ccccc1)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000517792834 926839055 /nfs/dbraw/zinc/83/90/55/926839055.db2.gz HETPRRZNILVSQS-XMMPIXPASA-N 0 3 409.574 4.289 20 0 HIADHN CN(C)CCN(C[C@@H]1CCCO1)C(=O)c1cc2ccccc2n1Cc1ccccc1F ZINC000517868389 926869576 /nfs/dbraw/zinc/86/95/76/926869576.db2.gz NNSTXFQXPMTJMM-NRFANRHFSA-N 0 3 423.532 4.012 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCCCc3c[nH]c4ccccc34)c(C)c2)CC1 ZINC000518096289 927018040 /nfs/dbraw/zinc/01/80/40/927018040.db2.gz WHOKSSUGAOEOJV-UHFFFAOYSA-N 0 3 419.573 4.373 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)c1ccc2c(C)nn(-c3ccccc3)c2n1 ZINC000518118965 927030986 /nfs/dbraw/zinc/03/09/86/927030986.db2.gz OLTFEBODTQTUII-UHFFFAOYSA-N 0 3 415.497 4.051 20 0 HIADHN CCN(C(=O)c1ccc(N2CCN(C(C)C)CC2)cc1)[C@@H](C)Cc1ccc(OC)cc1 ZINC000518233755 927095561 /nfs/dbraw/zinc/09/55/61/927095561.db2.gz NUUBHYPDGJLFOL-NRFANRHFSA-N 0 3 423.601 4.319 20 0 HIADHN Fc1cccc(N2CCCC2)c1CNC[C@H](c1ccc(Cl)cc1)N1CCOCC1 ZINC000518280583 927137499 /nfs/dbraw/zinc/13/74/99/927137499.db2.gz ZUFYFMNLAGFWAK-HSZRJFAPSA-N 0 3 417.956 4.242 20 0 HIADHN C[C@@H](CNC(=O)Cc1csc2nc(-c3ccccc3)cn12)N(C)Cc1ccccc1 ZINC000518378400 927229562 /nfs/dbraw/zinc/22/95/62/927229562.db2.gz ZDGKPMSVICRYQB-SFHVURJKSA-N 0 3 418.566 4.242 20 0 HIADHN CCCOc1ccc(CNC(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)cc1OC ZINC000518402987 927243082 /nfs/dbraw/zinc/24/30/82/927243082.db2.gz XRNFJDAWBZSOFR-NQIIRXRSSA-N 0 3 411.546 4.119 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N2CCC(OCc3ccccc3)CC2)C1 ZINC000518402641 927243574 /nfs/dbraw/zinc/24/35/74/927243574.db2.gz KBHABCHJQXDZBI-NFBKMPQASA-N 0 3 407.558 4.213 20 0 HIADHN COc1cccc(C[C@@H]2CCCN2C(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)c1 ZINC000518403128 927244852 /nfs/dbraw/zinc/24/48/52/927244852.db2.gz HYYJJFLFGFEUHD-VJBMBRPKSA-N 0 3 407.558 4.247 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N(Cc2cccs2)C[C@@H]2CCCO2)C1 ZINC000518410364 927250241 /nfs/dbraw/zinc/25/02/41/927250241.db2.gz OARMBNWXJQZMFL-NRSPTQNISA-N 0 3 413.587 4.274 20 0 HIADHN COc1ccc([C@H]2CCCN2C(=O)NC[C@@H](C)N(C)Cc2ccccc2)cc1OC ZINC000518441396 927274678 /nfs/dbraw/zinc/27/46/78/927274678.db2.gz IWUYJMJADIFFMX-WIYYLYMNSA-N 0 3 411.546 4.071 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)NC[C@H](C)N(C)Cc2ccccc2)cc1OC ZINC000518441395 927275022 /nfs/dbraw/zinc/27/50/22/927275022.db2.gz IWUYJMJADIFFMX-RXVVDRJESA-N 0 3 411.546 4.071 20 0 HIADHN OC[C@]1(CNCc2cc(Br)ccc2OC(F)F)C[C@H]1c1ccccc1 ZINC000518445218 927278403 /nfs/dbraw/zinc/27/84/03/927278403.db2.gz CRPXFHWCMYVYOF-QFBILLFUSA-N 0 3 412.274 4.306 20 0 HIADHN COc1ccc([C@H](Cc2ccccc2)NCc2ccc(C)c(S(C)(=O)=O)c2)cc1 ZINC000518447510 927279722 /nfs/dbraw/zinc/27/97/22/927279722.db2.gz YYUJTHGKBIQRHU-QHCPKHFHSA-N 0 3 409.551 4.481 20 0 HIADHN Cc1noc(-c2ccc(C)c(NC(=O)N[C@@H]3CCN([C@H](C)c4ccccc4)C3)c2)n1 ZINC000518474200 927296843 /nfs/dbraw/zinc/29/68/43/927296843.db2.gz ZVFBSKZPYUXPOO-OXQOHEQNSA-N 0 3 405.502 4.310 20 0 HIADHN CN(C(=O)Nc1cccc(OC(F)(F)F)c1)C1CCN(CCc2ccccn2)CC1 ZINC000518485521 927300812 /nfs/dbraw/zinc/30/08/12/927300812.db2.gz DHGMVJNBCWXUQB-UHFFFAOYSA-N 0 3 422.451 4.151 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)N(C)Cc2cccc(Br)c2)C1 ZINC000518499810 927310962 /nfs/dbraw/zinc/31/09/62/927310962.db2.gz MCJQWLPDOVMDON-OXJNMPFZSA-N 0 3 416.363 4.426 20 0 HIADHN CC1CCC(OC2CCN(C(=O)NCCCN3CCc4ccccc4C3)CC2)CC1 ZINC000518655281 927409455 /nfs/dbraw/zinc/40/94/55/927409455.db2.gz JHLYYYBXKKWVKS-UHFFFAOYSA-N 0 3 413.606 4.204 20 0 HIADHN C[C@@H]1CN(Cc2cccc(CNCc3ccccc3OCc3ccncc3)c2)CCO1 ZINC000518780324 927488498 /nfs/dbraw/zinc/48/84/98/927488498.db2.gz LDPLATMYUWVBSV-OAQYLSRUSA-N 0 3 417.553 4.171 20 0 HIADHN O=C(Nc1cccc(CNC[C@@H](O)COCC2CC2)c1)c1ccc(Cl)cc1Cl ZINC000518785115 927490144 /nfs/dbraw/zinc/49/01/44/927490144.db2.gz NXBDKLPVNWEBNZ-GOSISDBHSA-N 0 3 423.340 4.123 20 0 HIADHN C[C@H](CN1CCN(C)CC1)NCc1c(Cl)cccc1OCc1ccccc1Cl ZINC000518793998 927496562 /nfs/dbraw/zinc/49/65/62/927496562.db2.gz IWMDMXIQCRJCOB-QGZVFWFLSA-N 0 3 422.400 4.298 20 0 HIADHN O=C(c1ccc(Br)c(F)c1)N1CCN(c2ccnc3ccccc32)CC1 ZINC000518805084 927501576 /nfs/dbraw/zinc/50/15/76/927501576.db2.gz HVDRADIOVLWXDV-UHFFFAOYSA-N 0 3 414.278 4.099 20 0 HIADHN COc1cccc(CN(C[C@@H](O)COc2ccc3ccccc3c2)C[C@H]2CCCO2)c1 ZINC000518830488 927526881 /nfs/dbraw/zinc/52/68/81/927526881.db2.gz MBYQWNMBKGTHOK-ZEQKJWHPSA-N 0 3 421.537 4.269 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)c1oc2ccc(OC)cc2c1C ZINC000518843301 927545261 /nfs/dbraw/zinc/54/52/61/927545261.db2.gz AOJYGVJZLWWJRL-LJQANCHMSA-N 0 3 407.514 4.272 20 0 HIADHN C[C@H](C(=O)NC[C@@H](C)c1ccccc1)N(C)CCCc1cc(-c2cccc(F)c2)n[nH]1 ZINC000518862457 927567298 /nfs/dbraw/zinc/56/72/98/927567298.db2.gz SGBUXTFZWHJZPZ-RTBURBONSA-N 0 3 422.548 4.389 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)Nc1ccc(Br)cc1F ZINC000518887590 927598417 /nfs/dbraw/zinc/59/84/17/927598417.db2.gz HEPBYGBQAXQZTR-UHFFFAOYSA-N 0 3 420.326 4.129 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)NCC(C)(C)[NH+]3C[C@@H](C)C[C@H](C)C3)cc2)cc(=O)[n-]1 ZINC000518909582 927618603 /nfs/dbraw/zinc/61/86/03/927618603.db2.gz NHFKJVKTEOZWNN-HOTGVXAUSA-N 0 3 411.550 4.036 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)c1cccc(C(=O)N(C)c2ccccc2)c1 ZINC000519098297 927769586 /nfs/dbraw/zinc/76/95/86/927769586.db2.gz AIBHLQLQNJYQMG-UHFFFAOYSA-N 0 3 415.537 4.167 20 0 HIADHN C[C@@H](c1cccs1)N(Cc1ccccc1)C[C@@H](O)COc1ccc2c(c1)OCO2 ZINC000519195628 927821809 /nfs/dbraw/zinc/82/18/09/927821809.db2.gz KYIDWZYNODVFIS-PKOBYXMFSA-N 0 3 411.523 4.480 20 0 HIADHN Cc1ccc(C(=O)NC2CC2)cc1NC(=O)NC[C@@H]1CCCCN1Cc1ccccc1 ZINC000519260144 927852143 /nfs/dbraw/zinc/85/21/43/927852143.db2.gz RGYBLHSGECRSNY-QFIPXVFZSA-N 0 3 420.557 4.063 20 0 HIADHN CC1CCN([C@H](CNC(=O)N2CCCC[C@H]2c2ncc[nH]2)c2cccs2)CC1 ZINC000519293917 927866671 /nfs/dbraw/zinc/86/66/71/927866671.db2.gz XYDNPUWZRWCEEW-ZWKOTPCHSA-N 0 3 401.580 4.181 20 0 HIADHN Cc1nc(COc2ccc(F)cc2)sc1C(=O)NCCN1[C@H](C)CCC[C@H]1C ZINC000519360034 927896751 /nfs/dbraw/zinc/89/67/51/927896751.db2.gz IKGUPYCWXBAMRC-HUUCEWRRSA-N 0 3 405.539 4.162 20 0 HIADHN O=C(N[C@@H]1CCN(C2CC2)C1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000519364843 927897573 /nfs/dbraw/zinc/89/75/73/927897573.db2.gz GZMHCTXANLHEFT-OAHLLOKOSA-N 0 3 401.850 4.007 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)c1ccc(OCc2ccccc2C#N)cc1 ZINC000519414484 927932713 /nfs/dbraw/zinc/93/27/13/927932713.db2.gz NBVPAJZWRHGGNF-UHFFFAOYSA-N 0 3 413.521 4.341 20 0 HIADHN Cc1cc(C(=O)N(CCN(C)C)Cc2ccc(F)cc2F)c(C)n1-c1nccs1 ZINC000519416004 927933206 /nfs/dbraw/zinc/93/32/06/927933206.db2.gz UBWYMJIDVZCZJG-UHFFFAOYSA-N 0 3 418.513 4.033 20 0 HIADHN COc1ccccc1[C@H](NC(=O)N[C@H]1CCN(Cc2ccccc2)C1)c1ccccc1 ZINC000519440471 927950020 /nfs/dbraw/zinc/95/00/20/927950020.db2.gz IJYVZGNZFPDNRR-WIOPSUGQSA-N 0 3 415.537 4.358 20 0 HIADHN CCN(CC(=O)Nc1ccc2c(c1)OC1(CCCCC1)O2)[C@@H]1CCOC(C)(C)C1 ZINC000519481516 927978980 /nfs/dbraw/zinc/97/89/80/927978980.db2.gz MTVJWQWAYKSKIJ-GOSISDBHSA-N 0 3 402.535 4.336 20 0 HIADHN Cc1ccc(NC(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)cc1C(=O)NC(C)C ZINC000519498448 927993411 /nfs/dbraw/zinc/99/34/11/927993411.db2.gz JIQLEALPYNJSCF-RXVVDRJESA-N 0 3 408.546 4.090 20 0 HIADHN CC(C)c1nn(-c2ccccc2)cc1CN[C@@H]1CCCN(C(=O)CCC(F)(F)F)C1 ZINC000519563648 928016956 /nfs/dbraw/zinc/01/69/56/928016956.db2.gz YABWUTDHDSJTBD-GOSISDBHSA-N 0 3 422.495 4.419 20 0 HIADHN O=C(c1ccn(-c2ccc(Cl)cc2)n1)N1CCN(c2ccnc3ccccc32)CC1 ZINC000519720110 928054843 /nfs/dbraw/zinc/05/48/43/928054843.db2.gz DCXJBBAFWAEDIH-UHFFFAOYSA-N 0 3 417.900 4.036 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)Nc1nc(-c2ccc(OC)cc2)ns1)c1ccco1 ZINC000519717451 928054878 /nfs/dbraw/zinc/05/48/78/928054878.db2.gz AURGPGYBFQLVBB-CZUORRHYSA-N 0 3 415.519 4.058 20 0 HIADHN C[C@H](N[C@@H]1CCN(C)[C@@H]1c1ccc(Cl)cc1)C(=O)Nc1ccc(OC(F)F)cc1 ZINC000519725934 928060581 /nfs/dbraw/zinc/06/05/81/928060581.db2.gz QGZVQLJDDIKWMR-MJXNMMHHSA-N 0 3 423.891 4.303 20 0 HIADHN CCCN(C)[C@H](CNC(=O)N1CC[C@@H](n2cc(Cl)cn2)C1)c1ccc(Cl)cc1 ZINC000519758271 928068069 /nfs/dbraw/zinc/06/80/69/928068069.db2.gz YYGCHEDSIBFDFA-RTBURBONSA-N 0 3 424.376 4.229 20 0 HIADHN Brc1cnn(C2CCN(Cc3ccc(Oc4cnccn4)cc3)CC2)c1 ZINC000519813658 928083669 /nfs/dbraw/zinc/08/36/69/928083669.db2.gz HVDRQVRKMYYTGR-UHFFFAOYSA-N 0 3 414.307 4.065 20 0 HIADHN CN(C)[C@H](CNC(=O)N[C@H]1CCCc2cc(OC(F)F)ccc21)c1ccccc1 ZINC000519927884 928160977 /nfs/dbraw/zinc/16/09/77/928160977.db2.gz OKUXCKFCLNWJQI-VQTJNVASSA-N 0 3 403.473 4.268 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCc1cccc(C)n1)c1ccc(C(F)(F)F)cc1 ZINC000519951014 928182777 /nfs/dbraw/zinc/18/27/77/928182777.db2.gz WKBQWJWRKSBMQP-LJQANCHMSA-N 0 3 408.468 4.291 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)c(C)c1 ZINC000519989234 928215011 /nfs/dbraw/zinc/21/50/11/928215011.db2.gz JHDUUHIJKGCQDA-NNMXDRDESA-N 0 3 422.573 4.480 20 0 HIADHN Cc1cc(C(=O)N2CCCC[C@H]2C)ccc1NC(=O)NC[C@@H](c1ccccc1)N(C)C ZINC000520049641 928274071 /nfs/dbraw/zinc/27/40/71/928274071.db2.gz CFNZQPVTAGDSTM-XXBNENTESA-N 0 3 422.573 4.434 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)N[C@H](c1ccccc1)c1ccccn1 ZINC000520051708 928277298 /nfs/dbraw/zinc/27/72/98/928277298.db2.gz RZKUINUCHJLOJG-RUZDIDTESA-N 0 3 416.569 4.377 20 0 HIADHN CCCc1c(C(=O)NC[C@H](c2ccc(C)cc2)N(C)C)cnn1Cc1ccccc1 ZINC000520061335 928286365 /nfs/dbraw/zinc/28/63/65/928286365.db2.gz SXTBURJFRZYQOH-XMMPIXPASA-N 0 3 404.558 4.225 20 0 HIADHN CCOc1cccc([C@@H](C)NC(=O)NC[C@H](c2ccc(OC)cc2)N2CCCC2)c1 ZINC000520135745 928331152 /nfs/dbraw/zinc/33/11/52/928331152.db2.gz JGXFNOWMAXMAGF-WZONZLPQSA-N 0 3 411.546 4.291 20 0 HIADHN CCN(Cc1ccc(OC)cc1OC)C(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000520153799 928346345 /nfs/dbraw/zinc/34/63/45/928346345.db2.gz XVFNUDCCACLVCB-GHTZIAJQSA-N 0 3 411.546 4.071 20 0 HIADHN CN1CCN([C@H](CNCc2csc(-c3ccsc3)n2)c2cccs2)CC1 ZINC000520190169 928377151 /nfs/dbraw/zinc/37/71/51/928377151.db2.gz KXCHIYXVNZVVSZ-QGZVFWFLSA-N 0 3 404.630 4.011 20 0 HIADHN COc1ccc([C@@H](Cc2ccc(F)cc2)NCc2ccc(S(C)(=O)=O)cc2)cc1 ZINC000520218044 928395360 /nfs/dbraw/zinc/39/53/60/928395360.db2.gz YJOYZADORVZWQG-HSZRJFAPSA-N 0 3 413.514 4.311 20 0 HIADHN Brc1ccc(OCc2ccccn2)c(CNCCOC2CCCC2)c1 ZINC000520217339 928395654 /nfs/dbraw/zinc/39/56/54/928395654.db2.gz UVUQGOOEKJBLLR-UHFFFAOYSA-N 0 3 405.336 4.472 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)Nc1cccc(Cl)c1-n1cccn1 ZINC000520323432 928488147 /nfs/dbraw/zinc/48/81/47/928488147.db2.gz AMJRNHKJIJZXFA-UHFFFAOYSA-N 0 3 423.948 4.067 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)C1(c2ccc(C)cc2)CCOCC1)c1cccc(OC)c1 ZINC000520334809 928498686 /nfs/dbraw/zinc/49/86/86/928498686.db2.gz WECLWFVPCPJEQJ-DEOSSOPVSA-N 0 3 424.585 4.251 20 0 HIADHN COc1cc(C)c([C@@H](C)NC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)cc1OC ZINC000520348534 928511129 /nfs/dbraw/zinc/51/11/29/928511129.db2.gz ZLRIUPWPMNRBGN-MJGOQNOKSA-N 0 3 414.521 4.241 20 0 HIADHN O=C(c1cc(C2CC2)[nH]n1)N(CCCn1ccnc1)Cc1c(F)cccc1Cl ZINC000520359744 928519756 /nfs/dbraw/zinc/51/97/56/928519756.db2.gz WJOKSNJJZPVOKP-UHFFFAOYSA-N 0 3 401.873 4.009 20 0 HIADHN CN(C(=O)c1ccc(CSc2nc3ccccc3[nH]2)cc1)[C@H]1CN2CCC1CC2 ZINC000520370895 928526068 /nfs/dbraw/zinc/52/60/68/928526068.db2.gz DZKSYJPDGVYWIG-NRFANRHFSA-N 0 3 406.555 4.021 20 0 HIADHN Cc1noc(C2CCN(C[C@@H](O)CO[C@H](c3ccccc3)c3ccccc3C)CC2)n1 ZINC000520419347 928555977 /nfs/dbraw/zinc/55/59/77/928555977.db2.gz DRUFICYSTFAONU-ISKFKSNPSA-N 0 3 421.541 4.033 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)c1cncc(-c2ccc(N(C)C)cc2)c1)c1ccco1 ZINC000520448624 928570276 /nfs/dbraw/zinc/57/02/76/928570276.db2.gz MOXXEKOJEYNLDJ-HTAPYJJXSA-N 0 3 406.530 4.267 20 0 HIADHN CN(C)Cc1cccc(NC(=O)C(=O)N[C@@H](c2ccc(Cl)cc2)C2CCCC2)c1 ZINC000520668608 928712144 /nfs/dbraw/zinc/71/21/44/928712144.db2.gz BDEIWFZJCQCAFK-OAQYLSRUSA-N 0 3 413.949 4.388 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)Nc1cccc(N2CCCCC2=O)c1 ZINC000520780007 928814564 /nfs/dbraw/zinc/81/45/64/928814564.db2.gz YCHMUFXGEGDSMG-UHFFFAOYSA-N 0 3 422.573 4.232 20 0 HIADHN Cn1cc(C(=O)NC2CCN(Cc3ccccc3)CC2)c(-c2ccccc2Cl)n1 ZINC000520861872 928849156 /nfs/dbraw/zinc/84/91/56/928849156.db2.gz HVJNKCUMXDOSFS-UHFFFAOYSA-N 0 3 408.933 4.135 20 0 HIADHN COCCOc1c(Cl)cccc1NC(=O)N[C@@H]1CCN(Cc2ccccc2)[C@@H]1C ZINC000520882572 928857955 /nfs/dbraw/zinc/85/79/55/928857955.db2.gz AUSWUKRBHBGPKA-VQIMIIECSA-N 0 3 417.937 4.150 20 0 HIADHN CC[C@H](C)C(=O)Nc1cccc(CNC(=O)NC[C@H](c2ccc(C)cc2)N(C)C)c1 ZINC000520892745 928863033 /nfs/dbraw/zinc/86/30/33/928863033.db2.gz MYNXUWDCUVUEBU-PGRDOPGGSA-N 0 3 410.562 4.082 20 0 HIADHN O[C@@H](CNCc1cc(Br)ccc1OCc1ccccn1)C1CCCCC1 ZINC000520963408 928892115 /nfs/dbraw/zinc/89/21/15/928892115.db2.gz ISNXYGAEFDEKAX-FQEVSTJZSA-N 0 3 419.363 4.454 20 0 HIADHN O=C(N[C@H]1CCCOc2ccc(F)cc21)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000521001662 928918439 /nfs/dbraw/zinc/91/84/39/928918439.db2.gz IBOHKXMEODBYEY-UTKZUKDTSA-N 0 3 400.469 4.207 20 0 HIADHN CCN1CCCC[C@H]1CNC(=O)c1ccc(Cl)c(NC(=O)c2cccs2)c1 ZINC000521065593 928970931 /nfs/dbraw/zinc/97/09/31/928970931.db2.gz AJMXOZUWXOMUTC-HNNXBMFYSA-N 0 3 405.951 4.258 20 0 HIADHN CCCN(C)[C@H](CNC(=O)C(=O)Nc1cccc2ccncc21)c1ccc(Cl)cc1 ZINC000521094107 928988823 /nfs/dbraw/zinc/98/88/23/928988823.db2.gz QFTGZYXFOOLHTR-OAQYLSRUSA-N 0 3 424.932 4.026 20 0 HIADHN C[C@@H](CNC(=O)C1(c2cccc(Cl)c2)CCOCC1)N(C)Cc1ccccc1 ZINC000521095526 928990121 /nfs/dbraw/zinc/99/01/21/928990121.db2.gz CLDLLMKKIZSBIN-SFHVURJKSA-N 0 3 400.950 4.025 20 0 HIADHN CCN1CCCC[C@@H]1C(=O)N1CCc2c(cccc2NC(=O)Nc2ccccc2F)C1 ZINC000521181552 929048680 /nfs/dbraw/zinc/04/86/80/929048680.db2.gz HTNCNXCTBUSNPS-JOCHJYFZSA-N 0 3 424.520 4.229 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)Nc2ccc(C(=O)NC3CCCC3)cc2)N(C)C)cc1 ZINC000521185022 929049796 /nfs/dbraw/zinc/04/97/96/929049796.db2.gz YXELXTKQAPNHLM-HSZRJFAPSA-N 0 3 422.573 4.346 20 0 HIADHN CC(=O)Nc1ccc(OC[C@H](O)CN(Cc2ccccc2)Cc2ccccc2C)cc1 ZINC000521193466 929053119 /nfs/dbraw/zinc/05/31/19/929053119.db2.gz DIVIRJJLYPFWRO-RUZDIDTESA-N 0 3 418.537 4.396 20 0 HIADHN CC[C@@H](Cc1ccc(Cl)cc1Cl)NC(=O)N(CCN(C)C)Cc1ccccn1 ZINC000521300078 929109397 /nfs/dbraw/zinc/10/93/97/929109397.db2.gz OJFOFEZBOYFAFT-SFHVURJKSA-N 0 3 423.388 4.483 20 0 HIADHN COc1cccc(OC)c1OC1CCN(CCC(=O)Nc2cccc(Cl)c2)CC1 ZINC000521426134 929216620 /nfs/dbraw/zinc/21/66/20/929216620.db2.gz CVZJJZYQWWPWCJ-UHFFFAOYSA-N 0 3 418.921 4.229 20 0 HIADHN COc1ccc([C@@H](C)NC(=O)N(CCCc2ccccc2)CCN(C)C)cc1F ZINC000521437836 929220778 /nfs/dbraw/zinc/22/07/78/929220778.db2.gz XKRDWSYJUPFOID-GOSISDBHSA-N 0 3 401.526 4.101 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)NCc1cccc(C(F)(F)F)c1 ZINC000521451655 929226925 /nfs/dbraw/zinc/22/69/25/929226925.db2.gz BZBCUFXNEMDWHH-UHFFFAOYSA-N 0 3 407.480 4.411 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)Nc1nnc(-c2ccsc2)s1 ZINC000521456146 929229586 /nfs/dbraw/zinc/22/95/86/929229586.db2.gz KHWUIINKOPYMAG-UHFFFAOYSA-N 0 3 415.588 4.295 20 0 HIADHN CC(C)[C@@H](N[C@H]1CCCc2cc(S(N)(=O)=O)ccc21)c1ccc(Cl)cc1F ZINC000521471464 929236417 /nfs/dbraw/zinc/23/64/17/929236417.db2.gz FPNCUUPISIHMFU-VQTJNVASSA-N 0 3 410.942 4.491 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)N1CCn2cccc2[C@H]1c1ccccc1 ZINC000521524193 929274295 /nfs/dbraw/zinc/27/42/95/929274295.db2.gz JODNYCKYLSBHCM-UKILVPOCSA-N 0 3 414.553 4.440 20 0 HIADHN CCN(Cc1ccccc1NC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1)C(C)=O ZINC000521533105 929279349 /nfs/dbraw/zinc/27/93/49/929279349.db2.gz KWXCGXMQMSMILG-OAQYLSRUSA-N 0 3 411.521 4.045 20 0 HIADHN CC(C)NC(=O)Nc1ccccc1NC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000521602494 929323010 /nfs/dbraw/zinc/32/30/10/929323010.db2.gz FHEVUJJAWOFVGC-SFHVURJKSA-N 0 3 412.509 4.206 20 0 HIADHN COc1ccc(CC[C@@H](C)NC(=O)N(CCN(C)C)Cc2cccc(Cl)c2)cc1 ZINC000521603658 929324320 /nfs/dbraw/zinc/32/43/20/929324320.db2.gz RILZLWQUOXTIBL-GOSISDBHSA-N 0 3 417.981 4.443 20 0 HIADHN COc1ccc2oc([C@@H](C)NC(=O)N(CCN(C)C)Cc3ccc(C)o3)c(C)c2c1 ZINC000521609502 929326946 /nfs/dbraw/zinc/32/69/46/929326946.db2.gz VUDMAZQPUIYLML-QGZVFWFLSA-N 0 3 413.518 4.486 20 0 HIADHN COC1CCN(C(C)(C)CNC(=O)c2occc2CSc2ccccc2)CC1 ZINC000521683069 929364774 /nfs/dbraw/zinc/36/47/74/929364774.db2.gz NGCWSLXFTHMTLS-UHFFFAOYSA-N 0 3 402.560 4.191 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NCc2csc(-c3ccc4c(c3)OCO4)n2)C1 ZINC000521828136 929482550 /nfs/dbraw/zinc/48/25/50/929482550.db2.gz DEGRSXSMHGNWQH-VQIMIIECSA-N 0 3 407.539 4.464 20 0 HIADHN COc1ccccc1C[C@@H]1CCCN1C(=O)N[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000521832015 929483310 /nfs/dbraw/zinc/48/33/10/929483310.db2.gz OEEMVSKTEPBSNA-OIBXWCBGSA-N 0 3 407.558 4.247 20 0 HIADHN CC(=O)Nc1ccc(Cl)cc1NC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000521852286 929502789 /nfs/dbraw/zinc/50/27/89/929502789.db2.gz PLIVTXSHIAPCSU-INIZCTEOSA-N 0 3 403.885 4.288 20 0 HIADHN C[C@H](C(=O)N1[C@@H](C)CCC[C@@H]1C)N(C)CCCc1cc(-c2cccc(F)c2)n[nH]1 ZINC000521902622 929547579 /nfs/dbraw/zinc/54/75/79/929547579.db2.gz GCWPBCCRIDLULA-OKZBNKHCSA-N 0 3 400.542 4.258 20 0 HIADHN Cc1cc(NC(=O)C(C)(C)C)sc1C(=O)NC[C@H](C)N(C)Cc1ccccc1 ZINC000521957129 929592515 /nfs/dbraw/zinc/59/25/15/929592515.db2.gz RYEWXXDSLGPKHD-INIZCTEOSA-N 0 3 401.576 4.291 20 0 HIADHN CC(C)(C)c1noc2ncc(C(=O)Nc3ccc(CCN4CCSCC4)cc3)cc21 ZINC000521985395 929611715 /nfs/dbraw/zinc/61/17/15/929611715.db2.gz VXLPTLDJPYZCMN-UHFFFAOYSA-N 0 3 424.570 4.364 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)NCCc2cccc3cccnc32)N2CCCC2)cc1 ZINC000521991109 929615172 /nfs/dbraw/zinc/61/51/72/929615172.db2.gz LBJBLIWWICOVCE-HSZRJFAPSA-N 0 3 402.542 4.222 20 0 HIADHN CCCc1c(NC(=O)[C@H]2CCCN(Cc3cccnc3)C2)cnn1-c1ccc(F)cc1 ZINC000522057091 929625244 /nfs/dbraw/zinc/62/52/44/929625244.db2.gz IWRKUXCWTGDGHK-IBGZPJMESA-N 0 3 421.520 4.210 20 0 HIADHN Cc1ccc(NC(=O)C2CC2)cc1NC(=O)NC[C@H]1CCCN1Cc1ccccc1 ZINC000524481458 929630707 /nfs/dbraw/zinc/63/07/07/929630707.db2.gz XLHVXGGCOYDNJA-OAQYLSRUSA-N 0 3 406.530 4.130 20 0 HIADHN CCN(C(=O)N[C@H]1CCN(C2CC2)C1)[C@@H]1CCSc2ccc(Br)cc21 ZINC000524493566 929641430 /nfs/dbraw/zinc/64/14/30/929641430.db2.gz ZICOVQYZFSSCMN-WMLDXEAASA-N 0 3 424.408 4.254 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)N[C@H]2CCOc3c(Cl)cccc32)c1 ZINC000524516786 929661483 /nfs/dbraw/zinc/66/14/83/929661483.db2.gz KTFOUYBCOCHKSP-FQEVSTJZSA-N 0 3 401.938 4.245 20 0 HIADHN CC(C)c1nc(C(=O)N2C[C@H]3CCCN3Cc3ccccc32)nn1-c1cccc(F)c1 ZINC000524556053 929685871 /nfs/dbraw/zinc/68/58/71/929685871.db2.gz MJVVSXNXSYFYDW-HXUWFJFHSA-N 0 3 419.504 4.155 20 0 HIADHN COc1ccc2oc([C@H](C)NC(=O)[C@H]3CCCN(Cc4cccnc4)C3)c(C)c2c1 ZINC000524605856 929715010 /nfs/dbraw/zinc/71/50/10/929715010.db2.gz XPJYSUOXUAYBPV-HKUYNNGSSA-N 0 3 407.514 4.234 20 0 HIADHN CC(C)c1c(C(=O)N2CC[C@@H](N3CCCCC3)C2)cnn1-c1cccc(Cl)c1 ZINC000524610395 929719729 /nfs/dbraw/zinc/71/97/29/929719729.db2.gz OMKKSYRSAVWSMU-LJQANCHMSA-N 0 3 400.954 4.350 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1cccc(C(=O)NC(C)(C)C)c1 ZINC000524622538 929729334 /nfs/dbraw/zinc/72/93/34/929729334.db2.gz ANZGSDHQBFYSPW-IBGZPJMESA-N 0 3 422.573 4.343 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N3CCC(COc4ccccc4)CC3)cc2)CC1 ZINC000524710380 929807091 /nfs/dbraw/zinc/80/70/91/929807091.db2.gz VHWHBTCORIFVJD-UHFFFAOYSA-N 0 3 421.585 4.148 20 0 HIADHN Cc1cccc(NC(=O)NCCCCN2CCN(Cc3ccccc3)CC2)c1Cl ZINC000524723436 929811048 /nfs/dbraw/zinc/81/10/48/929811048.db2.gz TWPCSHKIVDJKBT-UHFFFAOYSA-N 0 3 414.981 4.368 20 0 HIADHN CC[C@H](Cc1ccccc1)N(C)CC(=O)N1CCC[C@@H]1c1ccc(OC)cc1OC ZINC000524758178 929820469 /nfs/dbraw/zinc/82/04/69/929820469.db2.gz DZUJLGCBBBIVAM-NFBKMPQASA-N 0 3 410.558 4.320 20 0 HIADHN CCN(Cc1ccc(I)cc1)Cc1ccc(C(=O)N(C)C)cc1 ZINC000524757736 929820833 /nfs/dbraw/zinc/82/08/33/929820833.db2.gz HYXZVBQBFLQKAV-UHFFFAOYSA-N 0 3 422.310 4.015 20 0 HIADHN CCCN(CCN(C)C)C(=O)c1cn(Cc2ccccc2)nc1-c1ccc(OC)cc1 ZINC000524824836 929846188 /nfs/dbraw/zinc/84/61/88/929846188.db2.gz XKUBBDQMTFKSIV-UHFFFAOYSA-N 0 3 420.557 4.021 20 0 HIADHN Cc1nc2c(cnn2C(C)C)cc1C(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C ZINC000524866118 929864593 /nfs/dbraw/zinc/86/45/93/929864593.db2.gz YJFVASFUMCFKBU-SFHVURJKSA-N 0 3 405.546 4.057 20 0 HIADHN COc1cc(CN[C@@H](c2ccc3c(c2)OCCO3)C2CC2)c(SC)cc1OC ZINC000524944216 929907130 /nfs/dbraw/zinc/90/71/30/929907130.db2.gz ANEYBWTWHSCLFI-JOCHJYFZSA-N 0 3 401.528 4.438 20 0 HIADHN CCOc1c(Cl)cc(CN[C@@H](C)[C@@H]2CN(Cc3ccccc3)CCO2)cc1OC ZINC000524947542 929910090 /nfs/dbraw/zinc/91/00/90/929910090.db2.gz USFAGVXIYQHFRW-JTSKRJEESA-N 0 3 418.965 4.126 20 0 HIADHN CN(C)Cc1cccc(C(=O)N2CCO[C@H](c3cc(F)c(Cl)cc3Cl)C2)c1 ZINC000524978073 929943300 /nfs/dbraw/zinc/94/33/00/929943300.db2.gz ZJGLNOVSKLBYPH-IBGZPJMESA-N 0 3 411.304 4.408 20 0 HIADHN C[C@H](O)CN(Cc1ccccc1)C(=O)NC[C@H](c1ccccc1)N1CCC(C)CC1 ZINC000524981302 929946294 /nfs/dbraw/zinc/94/62/94/929946294.db2.gz QCBWFDBAVBAJKZ-XUZZJYLKSA-N 0 3 409.574 4.052 20 0 HIADHN COc1ccc(C)cc1-n1ccc(C(=O)NC[C@@H]2CCCN(C)[C@H]2c2cccs2)n1 ZINC000525036013 929993083 /nfs/dbraw/zinc/99/30/83/929993083.db2.gz MRTQQGXLBXVKOX-HTAPYJJXSA-N 0 3 424.570 4.064 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)Cc2ccc3ccccc3c2)cc1)[C@H]1CCCN(C)C1 ZINC000525065441 930012660 /nfs/dbraw/zinc/01/26/60/930012660.db2.gz WWQLVHYMSWCVJW-DEOSSOPVSA-N 0 3 415.537 4.187 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1)[C@H]1CCCN(C)C1 ZINC000525066248 930013497 /nfs/dbraw/zinc/01/34/97/930013497.db2.gz MDADBBWSDDCAAT-IBGZPJMESA-N 0 3 419.447 4.124 20 0 HIADHN Cc1c2ccccc2oc1C(=O)Nc1ccc(C(=O)N(C)[C@@H]2CCCN(C)C2)cc1 ZINC000525065954 930013596 /nfs/dbraw/zinc/01/35/96/930013596.db2.gz DYBAUXMSIHUNJS-LJQANCHMSA-N 0 3 405.498 4.160 20 0 HIADHN CN(C(=O)c1cc(Br)ccc1OCc1ccccc1)[C@@H]1CCCN(C)C1 ZINC000525101605 930035981 /nfs/dbraw/zinc/03/59/81/930035981.db2.gz AHZXZAAQZHNZIO-GOSISDBHSA-N 0 3 417.347 4.194 20 0 HIADHN CC(C)CC(=O)Nc1ccc(C(=O)N[C@@H](CN2CCCC2)c2ccccc2)cc1F ZINC000525162039 930072405 /nfs/dbraw/zinc/07/24/05/930072405.db2.gz YVQILWBJXWJVKR-QFIPXVFZSA-N 0 3 411.521 4.377 20 0 HIADHN CC(C)(C)C(=O)NCCNCc1cn(-c2ccccc2)nc1-c1cccc(Cl)c1 ZINC000525181903 930079014 /nfs/dbraw/zinc/07/90/14/930079014.db2.gz DPXJEIDBDPBGQS-UHFFFAOYSA-N 0 3 410.949 4.445 20 0 HIADHN COC(=O)c1ccc(NC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)c(F)c1 ZINC000525310999 930150528 /nfs/dbraw/zinc/15/05/28/930150528.db2.gz GKUURJYBBKORIR-FQEVSTJZSA-N 0 3 424.394 4.005 20 0 HIADHN COc1ccc(SCCC(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)cc1OC ZINC000525338920 930175692 /nfs/dbraw/zinc/17/56/92/930175692.db2.gz JTUNQSSODBTIRR-MJGOQNOKSA-N 0 3 414.571 4.138 20 0 HIADHN CCOC(=O)CCc1ccc(NC(=O)NC[C@@H](c2ccccc2)N2CCCC2)cc1 ZINC000525342410 930179635 /nfs/dbraw/zinc/17/96/35/930179635.db2.gz AEZZHFGVFWHELE-QFIPXVFZSA-N 0 3 409.530 4.141 20 0 HIADHN COc1cccc([C@H](CNC(=O)NC2(c3cccc(Cl)c3)CC2)N2CCCC2)c1 ZINC000525451843 930248812 /nfs/dbraw/zinc/24/88/12/930248812.db2.gz ARHGLMGUSBQEIK-NRFANRHFSA-N 0 3 413.949 4.474 20 0 HIADHN CC(C)OCc1ccccc1CNC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C ZINC000525452273 930249053 /nfs/dbraw/zinc/24/90/53/930249053.db2.gz VMKXVXXTNRBZEW-NRFANRHFSA-N 0 3 409.574 4.418 20 0 HIADHN CCOc1cc(CN[C@@H](C)[C@@H]2CN(Cc3ccccc3)CCO2)cc(Cl)c1OC ZINC000525461660 930254919 /nfs/dbraw/zinc/25/49/19/930254919.db2.gz CUJYXSSSLVJYBI-JTSKRJEESA-N 0 3 418.965 4.126 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)[C@@H]1C[C@@H]1c1ccccc1OC(F)(F)F ZINC000525471535 930261959 /nfs/dbraw/zinc/26/19/59/930261959.db2.gz SLDFRBDHTSBZDD-HZPDHXFCSA-N 0 3 408.420 4.398 20 0 HIADHN O=C(N[C@@H]1CCN(Cc2ccccc2)C1)[C@H]1C[C@@H]1c1ccccc1OC(F)(F)F ZINC000525474508 930264881 /nfs/dbraw/zinc/26/48/81/930264881.db2.gz CLAWPHIQWVNYJF-QRQLOZEOSA-N 0 3 404.432 4.079 20 0 HIADHN CCc1cc(CNC(=O)NC[C@@H](c2ccc(C(F)(F)F)cc2)N(CC)CC)on1 ZINC000525498036 930284134 /nfs/dbraw/zinc/28/41/34/930284134.db2.gz KRYIYWKIECLIPY-SFHVURJKSA-N 0 3 412.456 4.138 20 0 HIADHN CC[C@H](CC(=O)Nc1ccc(C(=O)N(C)[C@H]2CCCN(C)C2)cc1)c1ccccc1 ZINC000525581098 930343497 /nfs/dbraw/zinc/34/34/97/930343497.db2.gz GQEBUWQKLCRMJA-XXBNENTESA-N 0 3 407.558 4.375 20 0 HIADHN CCn1cc(C(=O)Nc2ccc(C(=O)N(C)[C@@H]3CCCN(C)C3)cc2)c2ccccc21 ZINC000525615112 930363220 /nfs/dbraw/zinc/36/32/20/930363220.db2.gz ZGCSTLFMXQJMED-HXUWFJFHSA-N 0 3 418.541 4.080 20 0 HIADHN COc1ccccc1-c1ccc([C@H](C)N(C)CCN2C(=O)NC3(CCCC3)C2=O)cc1 ZINC000525639041 930377895 /nfs/dbraw/zinc/37/78/95/930377895.db2.gz QHQYZZZNGQGLKD-SFHVURJKSA-N 0 3 421.541 4.220 20 0 HIADHN CC(C)c1c(C(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)cnn1-c1ccccn1 ZINC000525774996 930440582 /nfs/dbraw/zinc/44/05/82/930440582.db2.gz VGELGBSENCIPPK-HXUWFJFHSA-N 0 3 417.557 4.127 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)CN2CC[C@H](c3ccccc3)[C@H](C)C2)c(OC)c1 ZINC000525787151 930444907 /nfs/dbraw/zinc/44/49/07/930444907.db2.gz RFHROJROZAKWQA-UCFCWBNQSA-N 0 3 422.569 4.493 20 0 HIADHN Cc1nnc(-c2cccc(C(=O)NC[C@H](c3cccs3)N3CCC(C)CC3)c2)o1 ZINC000525821830 930456751 /nfs/dbraw/zinc/45/67/51/930456751.db2.gz XMNLSOBZRWSUKV-LJQANCHMSA-N 0 3 410.543 4.310 20 0 HIADHN COc1cc(C)ccc1C(=O)Nc1c(C)cnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000525834015 930460124 /nfs/dbraw/zinc/46/01/24/930460124.db2.gz ILVXNVSRQRZRHY-FQEVSTJZSA-N 0 3 404.514 4.208 20 0 HIADHN Fc1cc(Br)cc(OCCN2CCC(OC[C@@H]3CCCCO3)CC2)c1 ZINC000525834133 930460150 /nfs/dbraw/zinc/46/01/50/930460150.db2.gz ZAHNDNSVXWUCTJ-SFHVURJKSA-N 0 3 416.331 4.017 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)N[C@@H](C)[C@H](c3ccccc3C)[NH+](C)C)cc2)cc(=O)[n-]1 ZINC000525955523 930494132 /nfs/dbraw/zinc/49/41/32/930494132.db2.gz ALBKLTAOOMJXSH-QMHKHESXSA-N 0 3 419.529 4.279 20 0 HIADHN COc1cc([C@H](C)NCc2ccc3c(c2)sc(=O)n3C)ccc1OCC(C)C ZINC000525980753 930502047 /nfs/dbraw/zinc/50/20/47/930502047.db2.gz QCLFFJILTAOHLO-HNNXBMFYSA-N 0 3 400.544 4.494 20 0 HIADHN C[C@@H](N[C@H](C)c1cc2ccccc2s1)C(=O)NCCc1ccc2c(c1)OCCO2 ZINC000526944758 930554205 /nfs/dbraw/zinc/55/42/05/930554205.db2.gz OTIWBFPRQWWUJP-HZPDHXFCSA-N 0 3 410.539 4.071 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)N[C@@H]2CCCN(Cc3ccc(F)cc3F)C2=O)cc1 ZINC000527039982 930574611 /nfs/dbraw/zinc/57/46/11/930574611.db2.gz RTRMGGOXWCUTEG-WAIKUNEKSA-N 0 3 424.495 4.301 20 0 HIADHN CCCCOc1ccc(CNC(=O)[C@@H]2CCCN(Cc3cccnc3)C2)cc1Cl ZINC000527053360 930575988 /nfs/dbraw/zinc/57/59/88/930575988.db2.gz FMILSDYMMDZOKI-HXUWFJFHSA-N 0 3 415.965 4.442 20 0 HIADHN COC(=O)c1cc(CN(Cc2cccc(Br)c2)C2CCOCC2)c(C)o1 ZINC000527214516 930614438 /nfs/dbraw/zinc/61/44/38/930614438.db2.gz DYUDAFDXQGYENK-UHFFFAOYSA-N 0 3 422.319 4.318 20 0 HIADHN CN(C)Cc1cccc(NC(=O)N2CCc3cc(Br)cc(F)c3C2)c1 ZINC000527280862 930625160 /nfs/dbraw/zinc/62/51/60/930625160.db2.gz SSRCABMGZYNDCE-UHFFFAOYSA-N 0 3 406.299 4.240 20 0 HIADHN C[C@@H](N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1)c1ccc2c(c1)CCC(=O)N2 ZINC000527487790 930666644 /nfs/dbraw/zinc/66/66/44/930666644.db2.gz BKTCROWAPQIMCH-HOYKHHGWSA-N 0 3 413.521 4.472 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)CO[C@H]3CCC[C@H](C)C3)c(OCC)c2)CC1 ZINC000530348027 930688890 /nfs/dbraw/zinc/68/88/90/930688890.db2.gz CFTWTPDKVBHEPY-FPOVZHCZSA-N 0 3 417.594 4.151 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2ccc(C(=O)N3CCCCCC3)cc2)[C@@H]1c1ccccc1 ZINC000530356917 930691445 /nfs/dbraw/zinc/69/14/45/930691445.db2.gz RJSHNVHDESKSLX-GOTSBHOMSA-N 0 3 420.557 4.270 20 0 HIADHN CC1CCN(C(=O)c2ccc(NC(=O)N[C@H]3CCN(C)[C@H]3c3ccccc3)cc2)CC1 ZINC000530356890 930691714 /nfs/dbraw/zinc/69/17/14/930691714.db2.gz ONECKZMPWXJEIL-GOTSBHOMSA-N 0 3 420.557 4.126 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)c(C(F)(F)F)c1 ZINC000530515301 930733771 /nfs/dbraw/zinc/73/37/71/930733771.db2.gz VLMGWAUDLOZQQM-OALUTQOASA-N 0 3 420.435 4.231 20 0 HIADHN O=C(CC1(N2CCOCC2)CCCC1)NCc1cccc(COCc2ccccc2)c1 ZINC000530572138 930754065 /nfs/dbraw/zinc/75/40/65/930754065.db2.gz ZNTPQDBVUNDLGE-UHFFFAOYSA-N 0 3 422.569 4.055 20 0 HIADHN O=C(CC1(N2CCOCC2)CCCC1)Nc1cc(Cl)ccc1N1CCCCC1 ZINC000530573774 930754955 /nfs/dbraw/zinc/75/49/55/930754955.db2.gz FPFJDYSSVKQEIU-UHFFFAOYSA-N 0 3 405.970 4.304 20 0 HIADHN C[C@@H](Sc1ccccc1)c1ccc(NC(=O)C(=O)N2CC[C@H](N3CCCC3)C2)cc1 ZINC000530747091 930815729 /nfs/dbraw/zinc/81/57/29/930815729.db2.gz VJZSLSMMKJKFAR-NQIIRXRSSA-N 0 3 423.582 4.175 20 0 HIADHN CCN1CCN(CCC(=O)Nc2ccc(OCc3cccc(Cl)c3)cc2C)CC1 ZINC000530815526 930830510 /nfs/dbraw/zinc/83/05/10/930830510.db2.gz WCNSWEVJBFYBIU-UHFFFAOYSA-N 0 3 415.965 4.194 20 0 HIADHN CCN1CCN(CCC(=O)N[C@@H](c2ccc(Cl)cc2)c2ccccc2Cl)CC1 ZINC000530822527 930832331 /nfs/dbraw/zinc/83/23/31/930832331.db2.gz RZYCTSAUGLFCHO-QFIPXVFZSA-N 0 3 420.384 4.227 20 0 HIADHN Cc1noc(-c2ccc(C)c(NC(=O)N(C)[C@H]3CCCN(Cc4ccccc4)C3)c2)n1 ZINC000530837815 930836418 /nfs/dbraw/zinc/83/64/18/930836418.db2.gz XEVCRXZRXRWUPR-NRFANRHFSA-N 0 3 419.529 4.482 20 0 HIADHN COc1ccc(-c2ccc(CNC(=O)[C@@H]3CCCN(Cc4cccnc4)C3)s2)cc1 ZINC000530843944 930838829 /nfs/dbraw/zinc/83/88/29/930838829.db2.gz YTRGCDZYJVJTKR-HXUWFJFHSA-N 0 3 421.566 4.347 20 0 HIADHN CN(C)Cc1ccc(-c2noc(Cc3csc(NC(=O)c4ccccc4)n3)n2)cc1 ZINC000530871574 930844988 /nfs/dbraw/zinc/84/49/88/930844988.db2.gz WEFQEQLHOMWKAZ-UHFFFAOYSA-N 0 3 419.510 4.098 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Nc1ccc(OCc2ccccc2)nc1 ZINC000530979405 930874752 /nfs/dbraw/zinc/87/47/52/930874752.db2.gz HUWWMEPTFKLFIP-UHFFFAOYSA-N 0 3 410.543 4.318 20 0 HIADHN C[C@H](CC(=O)Nc1cccc(N2CCCC2)c1)NCc1cnc(-c2ccccn2)s1 ZINC000531001188 930879818 /nfs/dbraw/zinc/87/98/18/930879818.db2.gz GLFUYNGKOXFIDR-QGZVFWFLSA-N 0 3 421.570 4.312 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)N(C)CCCCCc2cc(-c3ccccc3)n[nH]2)CN1C1CC1 ZINC000531006943 930882537 /nfs/dbraw/zinc/88/25/37/930882537.db2.gz QYLJPRVVTBKGLI-WIYYLYMNSA-N 0 3 409.578 4.056 20 0 HIADHN CC(C)COc1ccc(C(C)(C)NC(=O)CC2(N3CCOCC3)CCCC2)cc1 ZINC000531054340 930899282 /nfs/dbraw/zinc/89/92/82/930899282.db2.gz RUANPIYABJSIHG-UHFFFAOYSA-N 0 3 402.579 4.108 20 0 HIADHN CN(C)Cc1ccc(-c2noc(CNC(=O)c3ccc(Cl)c(Cl)c3)n2)cc1 ZINC000531110289 930923292 /nfs/dbraw/zinc/92/32/92/930923292.db2.gz MLGUNLFXDGQNMN-UHFFFAOYSA-N 0 3 405.285 4.035 20 0 HIADHN CN(C)Cc1ccc(-c2noc([C@H]3CCCN(C(=O)Nc4ccccc4)C3)n2)cc1 ZINC000531110402 930923516 /nfs/dbraw/zinc/92/35/16/930923516.db2.gz RRNGMOOFOOYFNZ-IBGZPJMESA-N 0 3 405.502 4.210 20 0 HIADHN Cc1ccc(NC(=O)c2cc(=O)[nH]c3c(Br)cccc23)c(CN(C)C)c1 ZINC000531172370 930952614 /nfs/dbraw/zinc/95/26/14/930952614.db2.gz RTEDIFKXKGIUFL-UHFFFAOYSA-N 0 3 414.303 4.325 20 0 HIADHN O=C(Nc1cccc(NC(=O)[C@H]2CCCN(Cc3cccnc3)C2)c1)C1CCCCC1 ZINC000531179536 930954598 /nfs/dbraw/zinc/95/45/98/930954598.db2.gz NWJDMCOZXQZCOP-NRFANRHFSA-N 0 3 420.557 4.451 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccnc2)C1)N1CCC[C@@H]1c1nc2cc(Cl)ccc2[nH]1 ZINC000531243698 930979854 /nfs/dbraw/zinc/97/98/54/930979854.db2.gz NGVQQYARMYJRKW-DYESRHJHSA-N 0 3 423.948 4.187 20 0 HIADHN CN1CCN(CCCCNC(=O)c2ccc(Oc3ccc(Cl)cc3)c(F)c2)CC1 ZINC000531288224 931002882 /nfs/dbraw/zinc/00/28/82/931002882.db2.gz HVBHRBJOJNPYOC-UHFFFAOYSA-N 0 3 419.928 4.029 20 0 HIADHN CC(C)c1ccc(OC2CCN(C(=O)CC3(N4CCOCC4)CCCC3)CC2)cc1 ZINC000531291062 931004094 /nfs/dbraw/zinc/00/40/94/931004094.db2.gz JOJZLWXPOIJFRN-UHFFFAOYSA-N 0 3 414.590 4.215 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)c1nccnc1-c1nc2ccccc2s1 ZINC000531374768 931036463 /nfs/dbraw/zinc/03/64/63/931036463.db2.gz JXMYANGUHIKIBU-UHFFFAOYSA-N 0 3 403.511 4.376 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)Nc2ccn(Cc3ccccc3)n2)CC1 ZINC000531396427 931042809 /nfs/dbraw/zinc/04/28/09/931042809.db2.gz PRFKBDNWUOHKJP-UHFFFAOYSA-N 0 3 403.530 4.060 20 0 HIADHN Cc1ccc2cccc(S(=O)(=O)NC3C[C@H]4CC[C@@H](C3)N4Cc3ccccc3)c2n1 ZINC000531486764 931075086 /nfs/dbraw/zinc/07/50/86/931075086.db2.gz SZUNXDQYGBBJGM-FRIKZZABSA-N 0 3 421.566 4.017 20 0 HIADHN CC1CCN([C@H](CNC(=O)Cc2ccn(-c3ccccc3)n2)c2cccs2)CC1 ZINC000531538489 931097141 /nfs/dbraw/zinc/09/71/41/931097141.db2.gz HVFIZEVXYMUYGA-OAQYLSRUSA-N 0 3 408.571 4.066 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc(CNCc2ccc(Cl)c3cccnc23)cc1 ZINC000531603142 931120119 /nfs/dbraw/zinc/12/01/19/931120119.db2.gz ALQKQLOQALJJBS-UHFFFAOYSA-N 0 3 417.962 4.209 20 0 HIADHN CC(C)(CNC(=O)N1CCC(Nc2ccc(F)cc2)CC1)N1CCc2ccccc2C1 ZINC000531680835 931149611 /nfs/dbraw/zinc/14/96/11/931149611.db2.gz QPXAJTVBSGWCSH-UHFFFAOYSA-N 0 3 424.564 4.249 20 0 HIADHN COc1ccc([C@H](C)NCc2ccc(CS(=O)(=O)NC(C)C)cc2)cc1Cl ZINC000531695696 931158067 /nfs/dbraw/zinc/15/80/67/931158067.db2.gz BETUYBYJRXQRCR-HNNXBMFYSA-N 0 3 410.967 4.027 20 0 HIADHN COc1ccc(CNCc2cn(C)nc2-c2ccc3c(c2)OCCCO3)cc1Cl ZINC000531698146 931160751 /nfs/dbraw/zinc/16/07/51/931160751.db2.gz BXFDHDKTVPUQJW-UHFFFAOYSA-N 0 3 413.905 4.200 20 0 HIADHN C[C@@H](N[C@@H](CN1CCN(C)CC1)c1ccccc1)c1cc(Br)ccc1F ZINC000531703584 931164720 /nfs/dbraw/zinc/16/47/20/931164720.db2.gz MAVXPXVMJKIETJ-IERDGZPVSA-N 0 3 420.370 4.228 20 0 HIADHN Cc1ccc(NC(=O)Cc2c[nH]c3cc(Br)ccc23)c(CN(C)C)c1 ZINC000531710390 931168951 /nfs/dbraw/zinc/16/89/51/931168951.db2.gz BLACQUHGTUHEJL-UHFFFAOYSA-N 0 3 400.320 4.482 20 0 HIADHN COc1ccc([C@@H](C)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2=O)cc1OC ZINC000531724078 931174031 /nfs/dbraw/zinc/17/40/31/931174031.db2.gz REVCEKZJTWRBHV-KDOFPFPSSA-N 0 3 420.456 4.151 20 0 HIADHN Clc1cc(CNC2(c3ccccc3)CCC2)ccc1OCCN1CCOCC1 ZINC000531835767 931213620 /nfs/dbraw/zinc/21/36/20/931213620.db2.gz FQPLBHGAZNDKGB-UHFFFAOYSA-N 0 3 400.950 4.220 20 0 HIADHN COc1cccc(-c2nn(C(C)(C)C)cc2CNCc2cccnc2-n2cccn2)c1 ZINC000531848220 931218625 /nfs/dbraw/zinc/21/86/25/931218625.db2.gz WZVGRTBRMPIMSR-UHFFFAOYSA-N 0 3 416.529 4.184 20 0 HIADHN O=C(NC1(c2c(Cl)cccc2Cl)CC1)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000531847582 931218899 /nfs/dbraw/zinc/21/88/99/931218899.db2.gz VRDREUDNBHDECH-INIZCTEOSA-N 0 3 404.341 4.406 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)N2CCC(Nc3ccc(F)cc3)CC2)C1 ZINC000531935584 931252637 /nfs/dbraw/zinc/25/26/37/931252637.db2.gz XUZXANJOTLVPOK-MBSDFSHPSA-N 0 3 410.537 4.247 20 0 HIADHN C[C@@H](NCc1cccc(NC(=O)c2ccncc2)c1)c1ccc2c(c1)CCC(=O)N2 ZINC000531938712 931253745 /nfs/dbraw/zinc/25/37/45/931253745.db2.gz XODNDDNMWVXEDD-MRXNPFEDSA-N 0 3 400.482 4.069 20 0 HIADHN C[C@@H](NCc1ccc(N2CCN(C)CC2)nc1)c1ccccc1OCc1ccccc1 ZINC000531941789 931255137 /nfs/dbraw/zinc/25/51/37/931255137.db2.gz XWYFLNGIYMBTOC-OAQYLSRUSA-N 0 3 416.569 4.263 20 0 HIADHN COc1cc([C@H](C)N[C@H](C)c2ccc(S(=O)(=O)N(C)C)cc2)ccc1OC(C)C ZINC000531944786 931256791 /nfs/dbraw/zinc/25/67/91/931256791.db2.gz KSVPPHSJJMRBPK-SJORKVTESA-N 0 3 420.575 4.145 20 0 HIADHN CN1CCN(C[C@H](N[C@H]2CCSc3c(Cl)cccc32)c2ccccc2)CC1 ZINC000531965153 931267423 /nfs/dbraw/zinc/26/74/23/931267423.db2.gz LXEDMQHQXITYLL-SFTDATJTSA-N 0 3 402.007 4.455 20 0 HIADHN C[C@H](N[C@@H](CN1CCN(C)CC1)c1ccccc1)c1sccc1Br ZINC000531965610 931268600 /nfs/dbraw/zinc/26/86/00/931268600.db2.gz FBBAZDYNXWETSN-YJBOKZPZSA-N 0 3 408.409 4.150 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@@H](C)N[C@H]2CCc3c2cccc3OC)cc1 ZINC000532187117 931341414 /nfs/dbraw/zinc/34/14/14/931341414.db2.gz KFGMMITTWHLXKB-IERDGZPVSA-N 0 3 402.560 4.064 20 0 HIADHN COc1cccc(C[C@@H](NCc2ccc(N3CCOCC3)nc2)c2ccccc2)c1 ZINC000532200950 931347316 /nfs/dbraw/zinc/34/73/16/931347316.db2.gz RRNSFXBTPOUCGN-XMMPIXPASA-N 0 3 403.526 4.000 20 0 HIADHN Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)NCCNS(=O)(=O)c1ccccc1 ZINC000532208603 931351916 /nfs/dbraw/zinc/35/19/16/931351916.db2.gz ASSDRVIGEAHKON-INIZCTEOSA-N 0 3 415.584 4.056 20 0 HIADHN Cc1nc(-c2ccccc2)sc1[C@H](C)NCc1ccc(C(=O)N2CCOCC2)cc1 ZINC000532209503 931352050 /nfs/dbraw/zinc/35/20/50/931352050.db2.gz LMTFBYSUKLPUPW-KRWDZBQOSA-N 0 3 421.566 4.442 20 0 HIADHN CSc1ccc([C@@H](C)NCc2cccc(OCCN3CCOCC3)c2)cc1F ZINC000532211955 931353949 /nfs/dbraw/zinc/35/39/49/931353949.db2.gz ILFFFTCTMGMCLY-QGZVFWFLSA-N 0 3 404.551 4.109 20 0 HIADHN C[C@H](NCc1ccc(NC(=O)c2ccncc2)cc1)c1ccc2c(c1)OCCCO2 ZINC000532219185 931358549 /nfs/dbraw/zinc/35/85/49/931358549.db2.gz GFOYGZCLJGMQRL-KRWDZBQOSA-N 0 3 403.482 4.346 20 0 HIADHN CCN(CC)C(=O)Nc1ccc([C@@H](C)N[C@H]2CCCN(c3ccccc3)C2=O)cc1 ZINC000532222610 931360926 /nfs/dbraw/zinc/36/09/26/931360926.db2.gz UNEUTXQYLUFJGR-GCJKJVERSA-N 0 3 408.546 4.407 20 0 HIADHN COc1ccc(OCc2ccccn2)c(CN[C@@H]2CCN(c3ncccc3Cl)C2)c1 ZINC000532321910 931396922 /nfs/dbraw/zinc/39/69/22/931396922.db2.gz WIWALLRLSWQSJA-GOSISDBHSA-N 0 3 424.932 4.086 20 0 HIADHN Cc1cccc(Oc2ccccc2NC(=O)N2CC[C@H](N3CCN(C(C)C)CC3)C2)c1 ZINC000532348240 931404797 /nfs/dbraw/zinc/40/47/97/931404797.db2.gz ANAPMQAYZFIENH-NRFANRHFSA-N 0 3 422.573 4.420 20 0 HIADHN COc1cccc(-c2nn(C(C)(C)C)cc2CNCc2ccc3c(c2)OCCO3)c1 ZINC000532361778 931409375 /nfs/dbraw/zinc/40/93/75/931409375.db2.gz BQECOBFKCNEQDZ-UHFFFAOYSA-N 0 3 407.514 4.375 20 0 HIADHN COCCOc1ccc(CNCc2ccc(C(=O)Nc3ccc(F)cc3)cc2)cc1 ZINC000532374224 931413897 /nfs/dbraw/zinc/41/38/97/931413897.db2.gz SJVOSXGNQLLYKJ-UHFFFAOYSA-N 0 3 408.473 4.393 20 0 HIADHN Cc1ccc(NC(=O)c2cc(I)ccc2F)c(CN(C)C)c1 ZINC000532398358 931422575 /nfs/dbraw/zinc/42/25/75/931422575.db2.gz WJYSBKOIQRKLPC-UHFFFAOYSA-N 0 3 412.246 4.053 20 0 HIADHN C[C@@H](CC(=O)N1CCCCCC1)NCc1cccc(NC(=O)c2ccc(F)cc2)c1 ZINC000532448791 931439861 /nfs/dbraw/zinc/43/98/61/931439861.db2.gz DCJKCBAHMBRKEI-SFHVURJKSA-N 0 3 411.521 4.349 20 0 HIADHN C[C@@H](NCCS(=O)(=O)c1ccccc1)[C@@H](C)Oc1ccc(Cl)cc1Cl ZINC000532465014 931446436 /nfs/dbraw/zinc/44/64/36/931446436.db2.gz CXQPPJPNJHBRLK-ZIAGYGMSSA-N 0 3 402.343 4.213 20 0 HIADHN Cc1nc(-c2ccc(CN[C@@H](C)c3ccc(S(=O)(=O)N(C)C)cc3)cc2)cs1 ZINC000532471259 931450301 /nfs/dbraw/zinc/45/03/01/931450301.db2.gz VJIFYRBWLJNMKD-HNNXBMFYSA-N 0 3 415.584 4.220 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc2c(c1)OCCCO2)c1cc(F)ccc1N1CCN(C)CC1 ZINC000532483202 931456277 /nfs/dbraw/zinc/45/62/77/931456277.db2.gz WGCNAPBBOBOUGX-ZWKOTPCHSA-N 0 3 413.537 4.151 20 0 HIADHN C[C@@H](N[C@@H](C)c1cc(F)ccc1N1CCN(C)CC1)c1ccc2c(c1)OCCCO2 ZINC000532483199 931456493 /nfs/dbraw/zinc/45/64/93/931456493.db2.gz WGCNAPBBOBOUGX-MSOLQXFVSA-N 0 3 413.537 4.151 20 0 HIADHN C[C@H](CC(=O)N(C)Cc1ccccc1Cl)NCc1ccc(OCC2CC2)nc1 ZINC000532494056 931461014 /nfs/dbraw/zinc/46/10/14/931461014.db2.gz IUXHPWIOTSHWFL-MRXNPFEDSA-N 0 3 401.938 4.051 20 0 HIADHN Cn1cc(CC(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)c2ccccc21 ZINC000532512533 931469926 /nfs/dbraw/zinc/46/99/26/931469926.db2.gz BBKUTZHJCXWQHD-OAQYLSRUSA-N 0 3 413.525 4.003 20 0 HIADHN C[C@H](Cc1ccsc1)NCc1cccnc1Oc1cccc(S(C)(=O)=O)c1 ZINC000532524220 931474365 /nfs/dbraw/zinc/47/43/65/931474365.db2.gz FGWKPTGYOOZMBU-OAHLLOKOSA-N 0 3 402.541 4.060 20 0 HIADHN COc1ccc([C@@H](N[C@@H](C)CCc2ccco2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000532531117 931512589 /nfs/dbraw/zinc/51/25/89/931512589.db2.gz OHUXYQNEKPSYKF-GAJHUEQPSA-N 0 3 413.539 4.392 20 0 HIADHN FC(F)(F)c1cccnc1OCCNCc1ccccc1OCc1ccccn1 ZINC000532615611 931555382 /nfs/dbraw/zinc/55/53/82/931555382.db2.gz OESAYVHYHQCLQW-UHFFFAOYSA-N 0 3 403.404 4.243 20 0 HIADHN C[C@H](CC(=O)Nc1cccc(N2CCCC2)c1)NCc1cc(-c2ccccc2)n[nH]1 ZINC000532618536 931555952 /nfs/dbraw/zinc/55/59/52/931555952.db2.gz KQZDEPBDQHZYRD-GOSISDBHSA-N 0 3 403.530 4.184 20 0 HIADHN O[C@H](COc1ccc(Cl)cc1Cl)CN1CC=C(c2c[nH]c3ncccc23)CC1 ZINC000532643884 931565224 /nfs/dbraw/zinc/56/52/24/931565224.db2.gz DHHWZFAIZOCONP-INIZCTEOSA-N 0 3 418.324 4.399 20 0 HIADHN CO[C@H](C)c1noc(CN2CCCN([C@H](C)c3ccc(C(C)(C)C)cc3)CC2)n1 ZINC000532645365 931566291 /nfs/dbraw/zinc/56/62/91/931566291.db2.gz SGPGRPONRZXBTE-QZTJIDSGSA-N 0 3 400.567 4.343 20 0 HIADHN C[C@H](NC[C@H](CO)Cc1ccco1)c1ccc(Br)cc1Br ZINC000532647946 931567288 /nfs/dbraw/zinc/56/72/88/931567288.db2.gz BSWVJRHRCICVIG-NWDGAFQWSA-N 0 3 417.141 4.306 20 0 HIADHN O=C(CN[C@@H](c1ccc(F)cc1)C1CCC1)N1CCC[C@H]1c1ccc2c(c1)OCCO2 ZINC000532687635 931584993 /nfs/dbraw/zinc/58/49/93/931584993.db2.gz GVOPAZBYIOVOMG-SQJMNOBHSA-N 0 3 424.516 4.391 20 0 HIADHN O=C1c2ccccc2C(=O)N1[C@@H]1CCCC[C@H](NCc2coc(-c3cccs3)n2)C1 ZINC000532765445 931626932 /nfs/dbraw/zinc/62/69/32/931626932.db2.gz XOWXUKKOLQYOJQ-DOTOQJQBSA-N 0 3 421.522 4.490 20 0 HIADHN CC(C)[C@H](NCC(=O)NCCc1cnn(-c2ccccc2)c1)c1ccc(Cl)cc1 ZINC000532769254 931627932 /nfs/dbraw/zinc/62/79/32/931627932.db2.gz BPTLIKBOFIYARR-QHCPKHFHSA-N 0 3 410.949 4.171 20 0 HIADHN C[C@@H](c1ccccc1Br)N(C)C(=O)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000532790004 931631965 /nfs/dbraw/zinc/63/19/65/931631965.db2.gz REHRIBWDXVXHHS-WMZOPIPTSA-N 0 3 416.363 4.276 20 0 HIADHN COc1cccc([C@H](CNC(=O)Nc2cccc(-c3ncco3)c2)N2CCCC2)c1 ZINC000532811746 931636142 /nfs/dbraw/zinc/63/61/42/931636142.db2.gz IPYCGHAADKWZNX-NRFANRHFSA-N 0 3 406.486 4.309 20 0 HIADHN COc1ccc(CNC[C@@H](CO)Cc2ccc(C(F)(F)F)cc2)c(Cl)c1OC ZINC000532866751 931672766 /nfs/dbraw/zinc/67/27/66/931672766.db2.gz VLFFBFXFHQZROR-AWEZNQCLSA-N 0 3 417.855 4.317 20 0 HIADHN CCCN(CC(=O)Nc1ccc(Br)cc1F)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000532970201 931719792 /nfs/dbraw/zinc/71/97/92/931719792.db2.gz ADGDLTPBEUTRKY-MORSLUCNSA-N 0 3 413.331 4.052 20 0 HIADHN Cc1cccc(COc2c(C)cc(CN(C)Cc3cc(=O)n4nccc4[nH]3)cc2C)c1 ZINC000532978531 931724133 /nfs/dbraw/zinc/72/41/33/931724133.db2.gz UTIRHUMFQYRXEB-UHFFFAOYSA-N 0 3 416.525 4.159 20 0 HIADHN O=c1cc(CN(Cc2ccc(F)cc2)CC2CC2)nc2ccc(Br)cn12 ZINC000532977782 931724338 /nfs/dbraw/zinc/72/43/38/931724338.db2.gz JIWHJZGYOAELMZ-UHFFFAOYSA-N 0 3 416.294 4.008 20 0 HIADHN C[C@H](NCc1cnn(-c2ccc(F)cc2)c1)[C@@H](OC1CCOCC1)c1ccccc1 ZINC000533007548 931733590 /nfs/dbraw/zinc/73/35/90/931733590.db2.gz HIJQBGLKKYHZLV-MHECFPHRSA-N 0 3 409.505 4.426 20 0 HIADHN COc1ccc(CN[C@H](C)[C@H](OC2CCOCC2)c2ccccc2)c(OC)c1OC ZINC000533007347 931733769 /nfs/dbraw/zinc/73/37/69/931733769.db2.gz MQCUJVNMTJSFED-VGSWGCGISA-N 0 3 415.530 4.127 20 0 HIADHN C[C@@H](NCc1cnn(-c2ccc(F)cc2)c1)[C@H](OC1CCOCC1)c1ccccc1 ZINC000533007547 931734147 /nfs/dbraw/zinc/73/41/47/931734147.db2.gz HIJQBGLKKYHZLV-KOSHJBKYSA-N 0 3 409.505 4.426 20 0 HIADHN CC(C)(O)CN(CC(=O)c1c2ccccc2[nH]c1-c1ccccc1)C1CCOCC1 ZINC000533022957 931742268 /nfs/dbraw/zinc/74/22/68/931742268.db2.gz BVCHSSZYGTUVIY-UHFFFAOYSA-N 0 3 406.526 4.270 20 0 HIADHN O=C(CN[C@@H](c1ccc(F)cc1)C1CCC1)NCC1(c2ccccc2)CCOCC1 ZINC000533055355 931756561 /nfs/dbraw/zinc/75/65/61/931756561.db2.gz YXDSLFBSEXPPJL-XMMPIXPASA-N 0 3 410.533 4.121 20 0 HIADHN C[C@H]([C@H](C)NCc1nc(-c2cc(Cl)ccc2Cl)cs1)N1CCOCC1 ZINC000533149637 931787654 /nfs/dbraw/zinc/78/76/54/931787654.db2.gz FQEWIUOAHQARGJ-QWHCGFSZSA-N 0 3 400.375 4.316 20 0 HIADHN Brc1cccc(-c2c[nH]c(CN[C@@H]3[C@@H]4CCO[C@H]4C34CCCC4)n2)c1 ZINC000533179460 931803169 /nfs/dbraw/zinc/80/31/69/931803169.db2.gz NPHTVDQGMXNEQC-KFKAGJAMSA-N 0 3 402.336 4.277 20 0 HIADHN O=C([C@H]1CCCN(Cc2cccnc2)C1)N1CCC[C@@H](c2nc3c(s2)CCCC3)C1 ZINC000533192544 931806035 /nfs/dbraw/zinc/80/60/35/931806035.db2.gz MJQSROWTJXCYNE-UXHICEINSA-N 0 3 424.614 4.035 20 0 HIADHN COc1cc(NC(=O)CCN(Cc2ccccc2F)C(C)C)cc(OC)c1OC ZINC000533250759 931819068 /nfs/dbraw/zinc/81/90/68/931819068.db2.gz NWHACJKEDQCGSM-UHFFFAOYSA-N 0 3 404.482 4.091 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)c1cnc(-c2ccccc2)nc1 ZINC000533260207 931821383 /nfs/dbraw/zinc/82/13/83/931821383.db2.gz WHFKKJNDZYOGDY-JOCHJYFZSA-N 0 3 424.508 4.039 20 0 HIADHN CC(C)N1CCN([C@@H]2CCN(C(=O)Nc3ccc(SC4CCCC4)cc3)C2)CC1 ZINC000533259023 931821689 /nfs/dbraw/zinc/82/16/89/931821689.db2.gz ZLOPCEPCETUROJ-HXUWFJFHSA-N 0 3 416.635 4.354 20 0 HIADHN O[C@H](COc1cccc2[nH]ccc21)CN1CCC[C@@H](c2nc3ccccc3s2)C1 ZINC000533334973 931841036 /nfs/dbraw/zinc/84/10/36/931841036.db2.gz ZEVAGKMMLDTYFJ-SJORKVTESA-N 0 3 407.539 4.397 20 0 HIADHN O[C@H](COc1cc(Cl)ccc1Cl)CN1CC=C(c2c[nH]c3ncccc23)CC1 ZINC000533344161 931843876 /nfs/dbraw/zinc/84/38/76/931843876.db2.gz LYQVRBDQFSWXIZ-INIZCTEOSA-N 0 3 418.324 4.399 20 0 HIADHN O=C(CNC1(c2ccccc2)CCOCC1)NCC1(c2ccc(F)cc2)CCCC1 ZINC000533382089 931854226 /nfs/dbraw/zinc/85/42/26/931854226.db2.gz ZFFSVZKKZHURLC-UHFFFAOYSA-N 0 3 410.533 4.049 20 0 HIADHN CCCN(Cc1nc(-c2ccc(C)cc2)no1)C1CCN(c2cc(C)nc(C)n2)CC1 ZINC000533381951 931854239 /nfs/dbraw/zinc/85/42/39/931854239.db2.gz NQFFHGIYUAAZPD-UHFFFAOYSA-N 0 3 420.561 4.333 20 0 HIADHN Cc1cc(C)n(-c2ccc(CN3CCC(NC(=O)c4cc(C)oc4C)CC3)cc2)n1 ZINC000533400662 931858602 /nfs/dbraw/zinc/85/86/02/931858602.db2.gz PDCBEYNUVSEEGE-UHFFFAOYSA-N 0 3 406.530 4.093 20 0 HIADHN COc1ccc(CCN(Cc2ccccc2)Cc2cc(=O)n3ccsc3n2)cc1 ZINC000533402288 931859445 /nfs/dbraw/zinc/85/94/45/931859445.db2.gz OUPZZJCLFIMHDJ-UHFFFAOYSA-N 0 3 405.523 4.010 20 0 HIADHN CC[C@@H]1CCCN(CC(=O)N(Cc2nnc(-c3ccccc3Cl)o2)C2CC2)CC1 ZINC000533436362 931868534 /nfs/dbraw/zinc/86/85/34/931868534.db2.gz NCYDKCWOBXKAAT-MRXNPFEDSA-N 0 3 416.953 4.393 20 0 HIADHN CCCCOc1ccc([C@@H](C)N[C@@H]2CCCN(CC(F)(F)F)C2=O)cc1OC ZINC000533449116 931872367 /nfs/dbraw/zinc/87/23/67/931872367.db2.gz MKDJZMGHSNWLSW-GDBMZVCRSA-N 0 3 402.457 4.078 20 0 HIADHN Cc1ccccc1O[C@@H]1CCCC[C@H]1NC(=O)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000533450499 931874071 /nfs/dbraw/zinc/87/40/71/931874071.db2.gz KSZAGNANMOSWOT-WMTXJRDZSA-N 0 3 407.558 4.108 20 0 HIADHN COc1ccc(CNC(C)(C)COc2ncccc2C(F)(F)F)c(OC)c1OC ZINC000533452572 931874140 /nfs/dbraw/zinc/87/41/40/931874140.db2.gz SCUZYMPTAZBGAY-UHFFFAOYSA-N 0 3 414.424 4.073 20 0 HIADHN CCc1ccc([C@@H](NCC(=O)N2CCC(C(=O)Nc3ccccc3)CC2)C(C)C)cc1 ZINC000533471968 931877872 /nfs/dbraw/zinc/87/78/72/931877872.db2.gz XECMFNXBYDCCGQ-VWLOTQADSA-N 0 3 421.585 4.413 20 0 HIADHN CN(CC1CCCCC1)C(=O)CNC1(c2cccc(Br)c2)CCOCC1 ZINC000533485240 931881631 /nfs/dbraw/zinc/88/16/31/931881631.db2.gz JEDYXVRYTBYFDH-UHFFFAOYSA-N 0 3 423.395 4.083 20 0 HIADHN CN(CCn1cncn1)[C@H](c1ccc(Cl)cc1)c1ccc(Br)cc1 ZINC000533484618 931881874 /nfs/dbraw/zinc/88/18/74/931881874.db2.gz MOWJNAAMBSJQRA-SFHVURJKSA-N 0 3 405.727 4.415 20 0 HIADHN CC(=O)Nc1ccc(OC[C@@H](O)CN(Cc2ccc(F)cc2F)C2CCCC2)cc1 ZINC000533486180 931882500 /nfs/dbraw/zinc/88/25/00/931882500.db2.gz RTPISOLPLUOPOP-NRFANRHFSA-N 0 3 418.484 4.108 20 0 HIADHN C[C@H](N[C@H](c1ccc(F)cc1)C1CCC1)C(=O)N[C@@H](C)c1ccc2c(c1)OCCO2 ZINC000533504089 931886639 /nfs/dbraw/zinc/88/66/39/931886639.db2.gz VHHHOSYLHYVTOD-KXNSMUHISA-N 0 3 412.505 4.294 20 0 HIADHN O=C(Nc1ccccc1)c1ccc(CN2CCC(CN3CCCCC3=O)CC2)cc1 ZINC000533516609 931891212 /nfs/dbraw/zinc/89/12/12/931891212.db2.gz VIXOOKFSGPAYIA-UHFFFAOYSA-N 0 3 405.542 4.163 20 0 HIADHN C[C@H](NC(=O)CNC1(c2ccc(Cl)cc2)CCOCC1)c1ccccc1Cl ZINC000533520235 931892238 /nfs/dbraw/zinc/89/22/38/931892238.db2.gz AQMMTZKYBCABFD-HNNXBMFYSA-N 0 3 407.341 4.466 20 0 HIADHN Cc1cccnc1[C@@H](NCC(=O)Nc1ccc2nc(C(F)(F)F)[nH]c2c1)C(C)C ZINC000533518657 931892367 /nfs/dbraw/zinc/89/23/67/931892367.db2.gz RWLCXWGPAWDGMP-KRWDZBQOSA-N 0 3 405.424 4.211 20 0 HIADHN CS(=O)(=O)c1ccc(Cl)c(NC(=O)CN[C@H](c2ccccc2)C2CCCC2)c1 ZINC000533521367 931892913 /nfs/dbraw/zinc/89/29/13/931892913.db2.gz BYHJEZBRMPRJCX-OAQYLSRUSA-N 0 3 420.962 4.203 20 0 HIADHN O=C1c2ccccc2C(=O)N1[C@H]1CCCC[C@H](NCc2csc(-c3ccco3)n2)C1 ZINC000533547942 931898125 /nfs/dbraw/zinc/89/81/25/931898125.db2.gz HGOHUCBIOSSNQK-RDJZCZTQSA-N 0 3 421.522 4.490 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)Nc3cccc(-c4ncco4)c3)CC2)C[C@H](C)O1 ZINC000533594110 931911393 /nfs/dbraw/zinc/91/13/93/931911393.db2.gz DMNROLDMNFFAKI-ROUUACIJSA-N 0 3 412.534 4.085 20 0 HIADHN CN(C)Cc1cccc(NC(=O)Nc2cnn(-c3ccccc3Br)c2)c1 ZINC000533678943 931965895 /nfs/dbraw/zinc/96/58/95/931965895.db2.gz UXIKMRMPTXAODP-UHFFFAOYSA-N 0 3 414.307 4.340 20 0 HIADHN CN1CC[C@H](NC(=O)c2cccc(CN3CCCC3)c2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000533682658 931968339 /nfs/dbraw/zinc/96/83/39/931968339.db2.gz KWDYLXYOKRWHNL-FCHUYYIVSA-N 0 3 415.940 4.250 20 0 HIADHN CC[C@@H](NCc1cnn(-c2ccc(F)cc2)c1)[C@@H](c1ccc(C)cc1)n1cncn1 ZINC000533739929 932001895 /nfs/dbraw/zinc/00/18/95/932001895.db2.gz MSMIEJIBVYFVIU-DHIUTWEWSA-N 0 3 404.493 4.069 20 0 HIADHN Cc1nc2ccccc2n1C[C@H]1CCCN1CC(=O)N(C)[C@@H](C)c1ccc(F)cc1 ZINC000533760786 932016107 /nfs/dbraw/zinc/01/61/07/932016107.db2.gz HDJKJDNTFXOEIM-LAUBAEHRSA-N 0 3 408.521 4.168 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)N1CCC[C@@H]1Cn1cnc2ccccc21 ZINC000533767209 932021175 /nfs/dbraw/zinc/02/11/75/932021175.db2.gz OHOIOXWSNOAJAZ-NQIIRXRSSA-N 0 3 423.586 4.109 20 0 HIADHN C[C@H](Oc1ccc(C(=O)NC[C@H](Cc2ccccc2)N(C)C)cn1)c1ccccc1 ZINC000533808971 932041077 /nfs/dbraw/zinc/04/10/77/932041077.db2.gz TWDXQJVJJFKEOE-CVDCTZTESA-N 0 3 403.526 4.124 20 0 HIADHN CN(C)[C@H](CNC(=O)N1CCC[C@H](c2nc3ccccc3s2)C1)Cc1ccccc1 ZINC000533809687 932042047 /nfs/dbraw/zinc/04/20/47/932042047.db2.gz UGHZAHMZNDYERL-PMACEKPBSA-N 0 3 422.598 4.358 20 0 HIADHN CN(C)[C@@H](CNC(=O)N[C@@H]1CCSc2ccc(Cl)cc21)Cc1ccccc1 ZINC000533810116 932042519 /nfs/dbraw/zinc/04/25/19/932042519.db2.gz BMWIEKFGOYSXGK-IEBWSBKVSA-N 0 3 403.979 4.349 20 0 HIADHN CN(C(=O)c1ccc(C(=O)N2CCN(CC3CCCCC3)CC2)cc1)c1ccccc1 ZINC000533838553 932053114 /nfs/dbraw/zinc/05/31/14/932053114.db2.gz YEPGRBREVLWMFY-UHFFFAOYSA-N 0 3 419.569 4.301 20 0 HIADHN CCCN(C(=O)c1ccc(C(=O)NC2CC2)cc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000533851097 932061017 /nfs/dbraw/zinc/06/10/17/932061017.db2.gz ZHJQLDJJHZEKFP-DEOSSOPVSA-N 0 3 419.569 4.096 20 0 HIADHN CN1CC[C@H](NC(=O)NCCc2nc3cc(Cl)ccc3s2)[C@H]1c1ccccc1 ZINC000533913785 932096319 /nfs/dbraw/zinc/09/63/19/932096319.db2.gz XLNXCOGDWRPYRO-OXJNMPFZSA-N 0 3 414.962 4.237 20 0 HIADHN CN1CC[C@H](NC(=O)N2CCO[C@@H](c3ccc(F)c(Cl)c3)C2)[C@@H]1c1ccccc1 ZINC000533948759 932122170 /nfs/dbraw/zinc/12/21/70/932122170.db2.gz IXEDDUDFPLAVTR-HBMCJLEFSA-N 0 3 417.912 4.007 20 0 HIADHN CN1CC[C@H](NC(=O)N2CCC[C@@H](c3nc4ccc(F)cc4o3)C2)[C@H]1c1ccccc1 ZINC000533949290 932123029 /nfs/dbraw/zinc/12/30/29/932123029.db2.gz OFOSIICHYDDYGV-PIPMEXSNSA-N 0 3 422.504 4.301 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)N[C@@H](c1cccnc1)C1CC1 ZINC000533966044 932143199 /nfs/dbraw/zinc/14/31/99/932143199.db2.gz GAFDMNLDLFNZHQ-HXUWFJFHSA-N 0 3 420.479 4.325 20 0 HIADHN COC(=O)[C@@H]1CCCC[C@@]1(C)NCC(=O)Nc1ccc(Cl)cc1C(F)(F)F ZINC000534022486 932203986 /nfs/dbraw/zinc/20/39/86/932203986.db2.gz AASVRONOZMCLAI-YVEFUNNKSA-N 0 3 406.832 4.009 20 0 HIADHN Clc1cc(Br)cc2c1CC[C@@H]2NCc1ccc(N2CCOCC2)nc1 ZINC000534058420 932236977 /nfs/dbraw/zinc/23/69/77/932236977.db2.gz AVOWHDIFNUQKIT-SFHVURJKSA-N 0 3 422.754 4.111 20 0 HIADHN CCN(C(=O)c1cccc(OCC(F)F)n1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000534077616 932255566 /nfs/dbraw/zinc/25/55/66/932255566.db2.gz LCMNGJULHUVXPC-AEFFLSMTSA-N 0 3 403.473 4.023 20 0 HIADHN COc1cccc(C(=O)Nc2c(C)cnn2[C@H]2CCN(Cc3ccccc3)C2)c1F ZINC000534153457 932305348 /nfs/dbraw/zinc/30/53/48/932305348.db2.gz MORJEXGRWAOORM-SFHVURJKSA-N 0 3 408.477 4.039 20 0 HIADHN CC(C)C(=O)NC1CCN(Cc2ccc(-c3ccc(Br)cc3)o2)CC1 ZINC000534338706 932386362 /nfs/dbraw/zinc/38/63/62/932386362.db2.gz QFYKDPDCVDHURA-UHFFFAOYSA-N 0 3 405.336 4.446 20 0 HIADHN O=C(CN[C@H](C[C@@H]1CCOC1)c1ccccc1)Nc1ccc(Br)cc1 ZINC000534351754 932389452 /nfs/dbraw/zinc/38/94/52/932389452.db2.gz DXZOAQYPHBZMJJ-HNAYVOBHSA-N 0 3 403.320 4.145 20 0 HIADHN C[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000534415792 932435650 /nfs/dbraw/zinc/43/56/50/932435650.db2.gz TXVHIUOOKMSAAZ-QRVBRYPASA-N 0 3 406.998 4.257 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccc(F)c2)C1)N1CCC[C@@H]1Cn1cnc2ccccc21 ZINC000534458590 932474752 /nfs/dbraw/zinc/47/47/52/932474752.db2.gz AQOCWRSRQMBOND-IFMALSPDSA-N 0 3 420.532 4.079 20 0 HIADHN Brc1ccccc1N1CC[C@H](NCc2cnc([C@@H]3CCCO3)s2)C1 ZINC000534464056 932481993 /nfs/dbraw/zinc/48/19/93/932481993.db2.gz AGHMNCOMSYLTHJ-GUYCJALGSA-N 0 3 408.365 4.126 20 0 HIADHN CC(=O)c1ccc2c(c1)CCN(C(=O)NC[C@@H](c1ccc(C)cc1)N1CCCC1)CC2 ZINC000534483043 932520367 /nfs/dbraw/zinc/52/03/67/932520367.db2.gz OZUNPPTUIDZXTP-VWLOTQADSA-N 0 3 419.569 4.145 20 0 HIADHN CN(C)[C@H](CNC(=O)N[C@H](c1cccs1)c1ccc(F)cc1)Cc1ccccc1 ZINC000534522529 932545026 /nfs/dbraw/zinc/54/50/26/932545026.db2.gz NBBOLBQZJUXCFJ-UNMCSNQZSA-N 0 3 411.546 4.449 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccc(O)cc1)C(=O)c1sccc1Br ZINC000534542168 932553261 /nfs/dbraw/zinc/55/32/61/932553261.db2.gz ZJDMRZMENOGOFJ-OAHLLOKOSA-N 0 3 423.376 4.343 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2ccc(C(=O)Nc3ccccc3)cc2)N(C)C)cc1 ZINC000534610577 932595595 /nfs/dbraw/zinc/59/55/95/932595595.db2.gz CJXRCKRWKNBXCI-QHCPKHFHSA-N 0 3 401.510 4.280 20 0 HIADHN Cc1cc(C(=O)NC[C@H](Cc2ccccc2)N(C)C)ccc1NC(=O)c1cccs1 ZINC000534649792 932622502 /nfs/dbraw/zinc/62/25/02/932622502.db2.gz ZGZWLULMZMDJDH-FQEVSTJZSA-N 0 3 421.566 4.212 20 0 HIADHN Cc1ccc(OCc2nc(CC(=O)N[C@@H]3CCN(C)[C@H]3c3ccccc3)cs2)cc1 ZINC000534756004 932733951 /nfs/dbraw/zinc/73/39/51/932733951.db2.gz GZQLKAUGXUJCBS-QPPBQGQZSA-N 0 3 421.566 4.135 20 0 HIADHN Cc1cc(NC(=O)N2CCc3ccsc3C2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000534824901 932795428 /nfs/dbraw/zinc/79/54/28/932795428.db2.gz NZJACAUCBBVMFS-HXUWFJFHSA-N 0 3 421.570 4.290 20 0 HIADHN C[C@@H](C(=O)N1CCC[C@H]1CN1CCCCC1)c1cccc(C(=O)c2ccccc2)c1 ZINC000534874476 932817988 /nfs/dbraw/zinc/81/79/88/932817988.db2.gz DVNCWVMIRCQOAS-YKSBVNFPSA-N 0 3 404.554 4.498 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)N(CCN(C)Cc2ccccc2)Cc2ccccc2)C[C@H](C)O1 ZINC000535064873 932896442 /nfs/dbraw/zinc/89/64/42/932896442.db2.gz AVGKMKRNUXWPCU-RUMRUAAYSA-N 0 3 409.574 4.286 20 0 HIADHN COC1CCN(C(C)(C)CNC(=O)c2cc(-c3ccccn3)ccc2Cl)CC1 ZINC000535120092 932937150 /nfs/dbraw/zinc/93/71/50/932937150.db2.gz HQEGNOUUWCVRFR-UHFFFAOYSA-N 0 3 401.938 4.021 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N(C)[C@@H]1CCSC1)c1ccc(C(F)(F)F)cc1 ZINC000535219202 933023320 /nfs/dbraw/zinc/02/33/20/933023320.db2.gz IIZDSYGGYKGEKZ-SJORKVTESA-N 0 3 403.514 4.235 20 0 HIADHN Cc1ccc(C(=O)NC[C@@H](Cc2ccccc2)N(C)C)cc1NC(=O)c1ccccc1 ZINC000535254829 933039109 /nfs/dbraw/zinc/03/91/09/933039109.db2.gz JZBWNRMOVBJYBF-HSZRJFAPSA-N 0 3 415.537 4.150 20 0 HIADHN COc1ccccc1[C@H](NC(=O)NC[C@@H](Cc1ccccc1)N(C)C)c1ccccc1 ZINC000535260912 933040178 /nfs/dbraw/zinc/04/01/78/933040178.db2.gz IEDDOYKDWMQNPV-RCZVLFRGSA-N 0 3 417.553 4.257 20 0 HIADHN COc1ccc2oc([C@@H](C)NC(=O)NC[C@@H](Cc3ccccc3)N(C)C)c(C)c2c1 ZINC000535261611 933040563 /nfs/dbraw/zinc/04/05/63/933040563.db2.gz KECXSYNCDVYZBE-IEBWSBKVSA-N 0 3 409.530 4.283 20 0 HIADHN COc1ccc2oc([C@@H](C)NC(=O)NC[C@H](Cc3ccccc3)N(C)C)c(C)c2c1 ZINC000535261612 933040698 /nfs/dbraw/zinc/04/06/98/933040698.db2.gz KECXSYNCDVYZBE-MJGOQNOKSA-N 0 3 409.530 4.283 20 0 HIADHN Cc1cccc(C(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)c1Br ZINC000535287601 933051376 /nfs/dbraw/zinc/05/13/76/933051376.db2.gz JDKFCFAGPXVMSF-IRXDYDNUSA-N 0 3 423.395 4.109 20 0 HIADHN CN1CC[C@@H](NC(=O)NCc2ccc(Oc3cccc(F)c3)nc2)[C@H]1c1ccccc1 ZINC000535338652 933081407 /nfs/dbraw/zinc/08/14/07/933081407.db2.gz BEFNNKUGWOXHFA-FYYLOGMGSA-N 0 3 420.488 4.258 20 0 HIADHN O=C(Nc1ccccc1O)C1CCN(Cc2ccc(OCc3cccnc3)cc2)CC1 ZINC000535376467 933101689 /nfs/dbraw/zinc/10/16/89/933101689.db2.gz LXLXCNRCVXANLL-UHFFFAOYSA-N 0 3 417.509 4.217 20 0 HIADHN Cc1ccc(-c2nc(C(=O)NC[C@@H]3CCCN(C)[C@H]3c3cccs3)cs2)n1C ZINC000535388185 933108519 /nfs/dbraw/zinc/10/85/19/933108519.db2.gz JQSGZXWSJMXRAD-HNAYVOBHSA-N 0 3 414.600 4.331 20 0 HIADHN CN(Cc1ccccc1OC(F)(F)F)C(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000535395080 933113133 /nfs/dbraw/zinc/11/31/33/933113133.db2.gz DKAOAODLNFSXGR-HKUYNNGSSA-N 0 3 407.436 4.172 20 0 HIADHN CC[C@H](NC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1)c1nc(C(F)(F)F)cs1 ZINC000535397935 933115863 /nfs/dbraw/zinc/11/58/63/933115863.db2.gz SHYOQUGXWOBHQQ-SQWLQELKSA-N 0 3 412.481 4.358 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)c2n[nH]c(-c3ccccc3)c2Br)c1 ZINC000535414454 933123980 /nfs/dbraw/zinc/12/39/80/933123980.db2.gz PPOSQYXRJBTJHT-UHFFFAOYSA-N 0 3 413.319 4.462 20 0 HIADHN Cc1cc([C@@H](NC(=O)N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)C2CC2)ccc1F ZINC000535414969 933124183 /nfs/dbraw/zinc/12/41/83/933124183.db2.gz KXUCJIAXDPBHLE-IXFSTUDKSA-N 0 3 417.569 4.116 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)c2cnn(-c3cccc(Br)c3)c2)c1 ZINC000535417041 933125812 /nfs/dbraw/zinc/12/58/12/933125812.db2.gz LOFKPLSIUSWAOC-UHFFFAOYSA-N 0 3 413.319 4.257 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)c2cccc(S(=O)(=O)Cc3ccccc3)c2)c1 ZINC000535418558 933126887 /nfs/dbraw/zinc/12/68/87/933126887.db2.gz LTBURKPTVWPXKU-UHFFFAOYSA-N 0 3 422.550 4.283 20 0 HIADHN CCCCCn1nc(C(=O)Nc2cc(C)cc(CN(C)C)c2)c2ccccc2c1=O ZINC000535421766 933127764 /nfs/dbraw/zinc/12/77/64/933127764.db2.gz NOOZUTJMJQWFGK-UHFFFAOYSA-N 0 3 406.530 4.209 20 0 HIADHN CN(CCc1ccc(Br)cc1)C(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000535437368 933135130 /nfs/dbraw/zinc/13/51/30/933135130.db2.gz QEZOIKFGTNLFCE-VQTJNVASSA-N 0 3 416.363 4.078 20 0 HIADHN CN(CCc1ccc(Br)cc1)C(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000535437366 933135155 /nfs/dbraw/zinc/13/51/55/933135155.db2.gz QEZOIKFGTNLFCE-UXHICEINSA-N 0 3 416.363 4.078 20 0 HIADHN CN1CC[C@@H](NC(=O)Cc2c[nH]c3cccc(Br)c23)[C@H]1c1ccccc1 ZINC000535468406 933157969 /nfs/dbraw/zinc/15/79/69/933157969.db2.gz JISQDXMDGHWAPJ-WIYYLYMNSA-N 0 3 412.331 4.035 20 0 HIADHN CN1CC[C@@H](NC(=O)Cc2c[nH]c3cccc(Br)c23)[C@@H]1c1ccccc1 ZINC000535468401 933158349 /nfs/dbraw/zinc/15/83/49/933158349.db2.gz JISQDXMDGHWAPJ-NQIIRXRSSA-N 0 3 412.331 4.035 20 0 HIADHN Cc1ccc(C(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)cc1NC(=O)c1ccco1 ZINC000535469140 933160976 /nfs/dbraw/zinc/16/09/76/933160976.db2.gz MLFNMBXULKCITB-UGKGYDQZSA-N 0 3 403.482 4.016 20 0 HIADHN O=C(NCCN1CCCC1)c1ccc(NC(=O)c2cccc(-c3ccoc3)c2)cc1 ZINC000535580614 933254361 /nfs/dbraw/zinc/25/43/61/933254361.db2.gz SWPCYEBXBATACM-UHFFFAOYSA-N 0 3 403.482 4.025 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)Nc1ccc(C(F)(F)F)nc1 ZINC000535616555 933270003 /nfs/dbraw/zinc/27/00/03/933270003.db2.gz KJZYBTLJPWBZAA-UHFFFAOYSA-N 0 3 400.832 4.350 20 0 HIADHN Cc1cc(NC(=O)[C@H]2CCCN(Cc3cccnc3)C2)ccc1C(=O)OC(C)(C)C ZINC000535658159 933302269 /nfs/dbraw/zinc/30/22/69/933302269.db2.gz LALRETAVQHZHIM-IBGZPJMESA-N 0 3 409.530 4.196 20 0 HIADHN COc1ccc(C(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)cc1-c1ccccn1 ZINC000535854207 933438113 /nfs/dbraw/zinc/43/81/13/933438113.db2.gz HATRPNSPSXEPNO-HXUWFJFHSA-N 0 3 415.537 4.494 20 0 HIADHN C[C@@H](C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)N1CC[C@H](C2CCOCC2)C1 ZINC000535870349 933452665 /nfs/dbraw/zinc/45/26/65/933452665.db2.gz LZLKHIGMPDVGFJ-JSGCOSHPSA-N 0 3 404.860 4.434 20 0 HIADHN C[C@@H](NCC1=Cc2cc(Br)ccc2OC1)c1ccc([S@](C)=O)cc1 ZINC000535946626 933512129 /nfs/dbraw/zinc/51/21/29/933512129.db2.gz RFKREYNTLJVUGV-OZAJXLCCSA-N 0 3 406.345 4.313 20 0 HIADHN Brc1ccc(N2CC[C@H](NCc3cnc([C@H]4CCCO4)s3)C2)cc1 ZINC000535959876 933524871 /nfs/dbraw/zinc/52/48/71/933524871.db2.gz WEXSJYWTIYVBTP-WMLDXEAASA-N 0 3 408.365 4.126 20 0 HIADHN Cc1nc(-c2cccc(C)c2)[nH]c1C(=O)Nc1ccc(N2CCN(C)CC2)cc1C ZINC000535990648 933553783 /nfs/dbraw/zinc/55/37/83/933553783.db2.gz IEYZZIDDQWMVRU-UHFFFAOYSA-N 0 3 403.530 4.006 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)c1ccc(C(=O)Nc2ccccc2)cc1 ZINC000536100326 933653092 /nfs/dbraw/zinc/65/30/92/933653092.db2.gz TXOFQGQGWMICIW-UHFFFAOYSA-N 0 3 419.500 4.282 20 0 HIADHN Cc1ccc(-c2nc(C(=O)NC[C@@H]3CCCN(Cc4cccs4)C3)cs2)n1C ZINC000536132255 933679812 /nfs/dbraw/zinc/67/98/12/933679812.db2.gz SNIFNMQKSQUXJI-INIZCTEOSA-N 0 3 414.600 4.161 20 0 HIADHN C[C@@H](N[C@H](c1ccc2c(c1)OCCO2)C1CC1)C(=O)Nc1cccc2ncccc21 ZINC000537289856 933699798 /nfs/dbraw/zinc/69/97/98/933699798.db2.gz FEWNBDDYZBZXNM-CMJOXMDJSA-N 0 3 403.482 4.074 20 0 HIADHN COC(=O)CCn1nc(C)c(CNCc2ccc(-c3ccc(OC)cc3)cc2)c1C ZINC000537297969 933703688 /nfs/dbraw/zinc/70/36/88/933703688.db2.gz QFOBIKGZKMGGCZ-UHFFFAOYSA-N 0 3 407.514 4.028 20 0 HIADHN C[C@@H](NCCNC(=O)c1ccccc1F)c1cc2cc(Br)ccc2o1 ZINC000537306034 933706470 /nfs/dbraw/zinc/70/64/70/933706470.db2.gz BQWJVVDVKAQOQP-GFCCVEGCSA-N 0 3 405.267 4.415 20 0 HIADHN COc1ccc([C@@H](C)Nc2ccc(N3CCOCC3)cn2)cc1CN1CCCCC1 ZINC000537393695 933754959 /nfs/dbraw/zinc/75/49/59/933754959.db2.gz FYWVBEHWRMXZQD-LJQANCHMSA-N 0 3 410.562 4.086 20 0 HIADHN CC1CCN([C@H](CNC(=O)N2CCC[C@H]2C2CCOCC2)c2cccs2)CC1 ZINC000537413300 933763660 /nfs/dbraw/zinc/76/36/60/933763660.db2.gz JXGSCEOMKUBFIM-VQTJNVASSA-N 0 3 405.608 4.122 20 0 HIADHN NC(=O)[C@H](CNCc1cc(Cl)ccc1OC(F)F)Cc1ccccc1Cl ZINC000537434487 933773669 /nfs/dbraw/zinc/77/36/69/933773669.db2.gz OKDUKYSCHWLNIW-ZDUSSCGKSA-N 0 3 403.256 4.029 20 0 HIADHN CC(C)CN(C(=O)CNC1(c2cccc(C(F)(F)F)c2)CCOCC1)C(C)C ZINC000562496222 945091224 /nfs/dbraw/zinc/09/12/24/945091224.db2.gz HIEIJZGPBDPLDZ-UHFFFAOYSA-N 0 3 400.485 4.194 20 0 HIADHN C[C@H]1CN(CCC(=O)Nc2ccc(Oc3ccccc3)cc2)CC2(CCOCC2)O1 ZINC000562615891 945107363 /nfs/dbraw/zinc/10/73/63/945107363.db2.gz YQDLLCACJQKATF-IBGZPJMESA-N 0 3 410.514 4.077 20 0 HIADHN Cc1ccc(C2=NN(C(=O)CN3CCC[C@@H]3C3CCOCC3)[C@@H](c3ccco3)C2)cc1 ZINC000537524666 938315917 /nfs/dbraw/zinc/31/59/17/938315917.db2.gz WTSWRINEITYQRJ-DHIUTWEWSA-N 0 3 421.541 4.157 20 0 HIADHN Cc1nc(C)c(CN2CCC(O)(Cc3ccc(OC(F)(F)F)cc3)CC2)s1 ZINC000537537984 938318421 /nfs/dbraw/zinc/31/84/21/938318421.db2.gz YZNPALIDWVGUSB-UHFFFAOYSA-N 0 3 400.466 4.228 20 0 HIADHN Cc1cc(NC(=O)NC/C=C\c2ccccc2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000537584943 938329164 /nfs/dbraw/zinc/32/91/64/938329164.db2.gz PIMAEIHTYFRDNQ-IYGUDBDMSA-N 0 3 415.541 4.473 20 0 HIADHN CCOc1cc(CN2CCC(O)(CC)CC2)ccc1OCCOc1ccc(F)cc1 ZINC000537615179 938333786 /nfs/dbraw/zinc/33/37/86/938333786.db2.gz MVIVBSZXJXYTTE-UHFFFAOYSA-N 0 3 417.521 4.419 20 0 HIADHN CCc1ccc(-c2nn(-c3ccccc3)cc2CN2CCC(CC(=O)NC)CC2)cc1 ZINC000537618308 938335258 /nfs/dbraw/zinc/33/52/58/938335258.db2.gz SZEPOKLMYZRCCB-UHFFFAOYSA-N 0 3 416.569 4.450 20 0 HIADHN Cc1nn(C)c(N2CCOCC2)c1CN1C[C@@H](C)C[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000537620861 938335840 /nfs/dbraw/zinc/33/58/40/938335840.db2.gz YWPHFWCQZUCOBN-MGPUTAFESA-N 0 3 422.495 4.167 20 0 HIADHN Cn1cc(CN2CCC[C@H](c3nc(C(F)(F)F)cs3)C2)c(-c2ccncc2)n1 ZINC000537622514 938337355 /nfs/dbraw/zinc/33/73/55/938337355.db2.gz AFJJGLKEHUOTFS-AWEZNQCLSA-N 0 3 407.465 4.337 20 0 HIADHN COc1ccc([C@@H](CO)N(C)Cc2ccc(-n3ccc(C(F)(F)F)n3)cc2)cc1 ZINC000537625949 938338721 /nfs/dbraw/zinc/33/87/21/938338721.db2.gz XXEYTODSYGSZOL-LJQANCHMSA-N 0 3 405.420 4.065 20 0 HIADHN COc1cc(CN2CCC(n3cc(Br)cn3)CC2)ccc1OC(C)C ZINC000537627372 938338896 /nfs/dbraw/zinc/33/88/96/938338896.db2.gz VAFAGPJTSUYQRA-UHFFFAOYSA-N 0 3 408.340 4.279 20 0 HIADHN COc1ccccc1COC1CCN(Cc2ccc(OCc3nccn3C)cc2)CC1 ZINC000537686190 938354058 /nfs/dbraw/zinc/35/40/58/938354058.db2.gz OVTSJFSPQIIANP-UHFFFAOYSA-N 0 3 421.541 4.189 20 0 HIADHN F[C@H](C(F)(F)F)C(F)(F)Oc1ccc(CN2CCS[C@H]3COCC[C@H]32)cc1 ZINC000537707598 938360207 /nfs/dbraw/zinc/36/02/07/938360207.db2.gz FECYGUGMDPGXPH-QLFBSQMISA-N 0 3 415.399 4.265 20 0 HIADHN CC[C@@H](NCc1c(Cl)cccc1N1CCN(C)CC1)c1ccc2c(c1)OCCO2 ZINC000537749532 938369154 /nfs/dbraw/zinc/36/91/54/938369154.db2.gz QSUWCSOKWQCCII-HXUWFJFHSA-N 0 3 415.965 4.104 20 0 HIADHN C[C@@H](NCc1ccccc1CN1CCN(c2ccccc2)CC1)c1ccc(F)cn1 ZINC000537763159 938371882 /nfs/dbraw/zinc/37/18/82/938371882.db2.gz GCMUHNQNFXOAQD-HXUWFJFHSA-N 0 3 404.533 4.394 20 0 HIADHN COc1ccc(C[C@@H](NCc2cccnc2-n2cccn2)c2ccc(OC)cc2)cc1 ZINC000537764104 938372237 /nfs/dbraw/zinc/37/22/37/938372237.db2.gz MKADVZYTOPFVPQ-XMMPIXPASA-N 0 3 414.509 4.358 20 0 HIADHN CC(C)(C)OC(=O)c1ccc(CN2CCC3(C[C@H]3C(=O)N3CCCCC3)CC2)cc1 ZINC000537802773 938380085 /nfs/dbraw/zinc/38/00/85/938380085.db2.gz PHCTYQUQSXOLOX-NRFANRHFSA-N 0 3 412.574 4.257 20 0 HIADHN COc1ccc([C@H](OC)[C@@H](C)[NH2+]Cc2cc(Br)c([O-])c(OC)c2)cc1 ZINC000537864333 938393913 /nfs/dbraw/zinc/39/39/13/938393913.db2.gz WBVIUSPNCMUTRM-CWTRNNRKSA-N 0 3 410.308 4.038 20 0 HIADHN COc1ccc([C@H](C)N[C@@H](C)c2ccc(-n3ccnn3)cc2)cc1Br ZINC000537937967 938423353 /nfs/dbraw/zinc/42/33/53/938423353.db2.gz HDVCRWQQKPWVTD-KBPBESRZSA-N 0 3 401.308 4.450 20 0 HIADHN COCCOc1ccc([C@H](C)NCc2cc(Br)c3c(c2)OCCO3)cc1 ZINC000537940237 938425103 /nfs/dbraw/zinc/42/51/03/938425103.db2.gz BIZDPRSWRUGZDQ-AWEZNQCLSA-N 0 3 422.319 4.096 20 0 HIADHN CC(C)CC[C@H](NC[C@H](O)CS(=O)(=O)c1cccs1)c1ccc(Cl)cc1 ZINC000537953942 938431339 /nfs/dbraw/zinc/43/13/39/938431339.db2.gz NUGINISTCNLCJH-ROUUACIJSA-N 0 3 416.008 4.303 20 0 HIADHN COc1ccc([C@H](OC)[C@@H](C)N[C@H](C)c2ccc(-n3cncn3)cc2Cl)cc1 ZINC000537964592 938437215 /nfs/dbraw/zinc/43/72/15/938437215.db2.gz WLBVWQOCKPSMMC-VTJXTGGHSA-N 0 3 400.910 4.356 20 0 HIADHN CNS(=O)(=O)c1cccc([C@@H](C)N[C@@H](Cc2ccccc2)c2cccs2)c1 ZINC000537970513 938440737 /nfs/dbraw/zinc/44/07/37/938440737.db2.gz XVQMVUKPAAXGTM-UZLBHIALSA-N 0 3 400.569 4.291 20 0 HIADHN C[C@@H](N[C@@H]1CCN(CC(F)(F)F)C1=O)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000537976755 938444699 /nfs/dbraw/zinc/44/46/99/938444699.db2.gz IGCPROZKJMISDX-AUUYWEPGSA-N 0 3 410.411 4.219 20 0 HIADHN COc1cc(F)c([C@@H](C)NC[C@@H](c2cccc(Cl)c2)N2CCOCC2)cc1OC ZINC000537976618 938444920 /nfs/dbraw/zinc/44/49/20/938444920.db2.gz DHECJTDGADISHC-QRWLVFNGSA-N 0 3 422.928 4.220 20 0 HIADHN COc1cc(F)c([C@@H](C)NC[C@H](c2cccc(Cl)c2)N2CCOCC2)cc1OC ZINC000537976616 938445082 /nfs/dbraw/zinc/44/50/82/938445082.db2.gz DHECJTDGADISHC-FOIQADDNSA-N 0 3 422.928 4.220 20 0 HIADHN COC(=O)COc1cccc(CN[C@@H]2CCSc3ccc(Br)cc32)c1 ZINC000537982032 938447349 /nfs/dbraw/zinc/44/73/49/938447349.db2.gz HQKSUNYCMWWMHO-QGZVFWFLSA-N 0 3 422.344 4.328 20 0 HIADHN CC(C)c1ccc([C@H](C)NCc2ccccc2OCC(=O)NC[C@@H]2CCCO2)cc1 ZINC000537988008 938450523 /nfs/dbraw/zinc/45/05/23/938450523.db2.gz TZJBYSOVJJJHFK-CVDCTZTESA-N 0 3 410.558 4.335 20 0 HIADHN CC(C)c1ccc([C@H](C)NCc2ccccc2OCC(=O)NC[C@H]2CCCO2)cc1 ZINC000537988010 938450954 /nfs/dbraw/zinc/45/09/54/938450954.db2.gz TZJBYSOVJJJHFK-WMZHIEFXSA-N 0 3 410.558 4.335 20 0 HIADHN Cc1cc(C)c2c(c1)[C@H](N[C@H](C)c1ccc(S(=O)(=O)N(C)C)cc1)CCCO2 ZINC000537990689 938452422 /nfs/dbraw/zinc/45/24/22/938452422.db2.gz KBAXKHAVXQDQFX-DYESRHJHSA-N 0 3 402.560 4.118 20 0 HIADHN CC[C@@H](NCc1ccc(S(=O)(=O)N(C)C)cc1)c1ccc2cc(OC)ccc2c1 ZINC000537992008 938453305 /nfs/dbraw/zinc/45/33/05/938453305.db2.gz WVDLBRVMUXISOI-HSZRJFAPSA-N 0 3 412.555 4.340 20 0 HIADHN COc1cc(CN[C@H](C)c2cccc(NS(C)(=O)=O)c2)ccc1OC1CCCC1 ZINC000537992111 938453692 /nfs/dbraw/zinc/45/36/92/938453692.db2.gz RWEJOBZLCLELTN-MRXNPFEDSA-N 0 3 418.559 4.239 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N[C@@H](COC)c1ccc(F)c(F)c1)c1ccsc1 ZINC000538036867 938476936 /nfs/dbraw/zinc/47/69/36/938476936.db2.gz CDMSEBPFSPFIJZ-OALUTQOASA-N 0 3 411.518 4.096 20 0 HIADHN Cc1cccc([C@@H](CN[C@@H](C)c2nc3ccc(Cl)cc3n2C)N2CCOCC2)c1 ZINC000538063432 938492323 /nfs/dbraw/zinc/49/23/23/938492323.db2.gz UBTIXXIDMPWKCL-HTAPYJJXSA-N 0 3 412.965 4.259 20 0 HIADHN CN1CCN(c2ncccc2CN[C@H](c2ccc(Cl)c(Cl)c2)C2CC2)CC1 ZINC000538099479 938501557 /nfs/dbraw/zinc/50/15/57/938501557.db2.gz VKUCYQGUEJAFCV-FQEVSTJZSA-N 0 3 405.373 4.381 20 0 HIADHN CN1CCN(c2ncccc2CN[C@@H](c2ccc(Cl)c(Cl)c2)C2CC2)CC1 ZINC000538099480 938501782 /nfs/dbraw/zinc/50/17/82/938501782.db2.gz VKUCYQGUEJAFCV-HXUWFJFHSA-N 0 3 405.373 4.381 20 0 HIADHN COc1cc([C@H](C)N[C@H]2CCc3c2cccc3Br)ccc1OCCO ZINC000538099832 938502046 /nfs/dbraw/zinc/50/20/46/938502046.db2.gz CTKSKBJNCDKQRX-UGSOOPFHSA-N 0 3 406.320 4.167 20 0 HIADHN C[C@@H](NC[C@H](c1cccc(F)c1)N1CCOCC1)c1nc2ccc(Cl)cc2n1C ZINC000538101624 938503186 /nfs/dbraw/zinc/50/31/86/938503186.db2.gz YUTKXSXNIGNNSH-QVKFZJNVSA-N 0 3 416.928 4.090 20 0 HIADHN c1ccc(-c2nc3ccccn3c2CN[C@H](CN2CCOCC2)c2ccccc2)cc1 ZINC000538141321 938517730 /nfs/dbraw/zinc/51/77/30/938517730.db2.gz MSOTUHMEFLDVFX-HSZRJFAPSA-N 0 3 412.537 4.164 20 0 HIADHN C[C@@H](NCC(=O)Nc1ccc(OC(F)F)c(Cl)c1)c1ccccc1-n1cccn1 ZINC000538160871 938530236 /nfs/dbraw/zinc/53/02/36/938530236.db2.gz FBTVKZJEHQIADC-CYBMUJFWSA-N 0 3 420.847 4.416 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(OCC(F)(F)F)cc1)C(=O)NCCc1cccs1 ZINC000538161363 938530582 /nfs/dbraw/zinc/53/05/82/938530582.db2.gz AICLVEDPCVGPTB-KBPBESRZSA-N 0 3 400.466 4.087 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(OCC(F)(F)F)cc1)C(=O)NCCc1ccc(F)cc1 ZINC000538164819 938532169 /nfs/dbraw/zinc/53/21/69/938532169.db2.gz XMMPOSOHFNBQKX-GJZGRUSLSA-N 0 3 412.427 4.165 20 0 HIADHN O=C(CCN[C@H](CC(F)(F)F)c1ccccc1)N1CCN(c2ccc(F)cc2)CC1 ZINC000538174395 938536198 /nfs/dbraw/zinc/53/61/98/938536198.db2.gz HHLWEIQYCJYHSV-HXUWFJFHSA-N 0 3 423.454 4.148 20 0 HIADHN Cc1nc(-c2ccc([C@@H](C)NCc3ccc(S(=O)(=O)N(C)C)cc3)cc2)cs1 ZINC000538181652 938541120 /nfs/dbraw/zinc/54/11/20/938541120.db2.gz WUKDOBXXPZBMMJ-OAHLLOKOSA-N 0 3 415.584 4.220 20 0 HIADHN COc1ccc([C@@H](Cc2ccc(F)cc2)NCC(=O)Nc2ccc3c(c2)OCO3)cc1 ZINC000538180315 938541180 /nfs/dbraw/zinc/54/11/80/938541180.db2.gz NDVAZULBLZYWAK-OAQYLSRUSA-N 0 3 422.456 4.075 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)Nc1nc2ccc(F)cc2s1)c1cccc(-n2cccn2)c1 ZINC000538187053 938543240 /nfs/dbraw/zinc/54/32/40/938543240.db2.gz FYBPBUCZSZTEDS-KGLIPLIRSA-N 0 3 409.490 4.299 20 0 HIADHN O=C(CN[C@@H](C[C@H]1CCOC1)c1ccccc1)NCc1ccccc1OC1CCCC1 ZINC000538233332 938568183 /nfs/dbraw/zinc/56/81/83/938568183.db2.gz QJVBDCNNYAZUKX-YKSBVNFPSA-N 0 3 422.569 4.382 20 0 HIADHN Cc1cccc([C@H](NCC(=O)NCC(=O)Nc2c(C)cc(C)cc2C)C(C)(C)C)c1 ZINC000538236000 938568752 /nfs/dbraw/zinc/56/87/52/938568752.db2.gz AFRXGTBEEGJNMG-DEOSSOPVSA-N 0 3 409.574 4.352 20 0 HIADHN C[C@@H](CCCc1ccccc1)C(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000538287808 938583631 /nfs/dbraw/zinc/58/36/31/938583631.db2.gz ROQVJVBZGNXHIH-BHDDXSALSA-N 0 3 400.607 4.383 20 0 HIADHN C[C@@H](CS(=O)(=O)c1ccccc1)NCc1ccccc1CN1CCCCCC1 ZINC000538294728 938585446 /nfs/dbraw/zinc/58/54/46/938585446.db2.gz XDOQWBCSPLZXJR-FQEVSTJZSA-N 0 3 400.588 4.015 20 0 HIADHN CC(=O)Nc1cccc(NC(=O)CN[C@H](COc2c(C)cccc2C)C(C)(C)C)c1 ZINC000538321176 938591708 /nfs/dbraw/zinc/59/17/08/938591708.db2.gz ZJZXNDIDOYFFNB-OAQYLSRUSA-N 0 3 411.546 4.284 20 0 HIADHN Cc1nc(-c2ccc(C)cc2NC(=O)CN[C@H](c2ccc(F)c(C)c2)C2CC2)n[nH]1 ZINC000538321296 938591748 /nfs/dbraw/zinc/59/17/48/938591748.db2.gz YVQVRUFUOZNUQG-QFIPXVFZSA-N 0 3 407.493 4.215 20 0 HIADHN CC[C@@H](NCc1csc(CC(=O)Nc2cc(C)ccc2C)n1)C1CCOCC1 ZINC000538321834 938591990 /nfs/dbraw/zinc/59/19/90/938591990.db2.gz CHHPVVPBSJYBLM-LJQANCHMSA-N 0 3 401.576 4.236 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@H](C)N[C@@H](c2ccc(F)c(C)c2)C2CC2)cc1OC ZINC000538323120 938592611 /nfs/dbraw/zinc/59/26/11/938592611.db2.gz JWHZKQSBSMUERC-QMHKHESXSA-N 0 3 414.521 4.239 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)N[C@H]2CCCOc3cc(Cl)ccc32)o1 ZINC000538373721 938606533 /nfs/dbraw/zinc/60/65/33/938606533.db2.gz YDXSTCOXDKZTMC-IBGZPJMESA-N 0 3 405.926 4.229 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CNC(=O)CN[C@H](c1ccccc1C)C1CC1 ZINC000538389992 938609146 /nfs/dbraw/zinc/60/91/46/938609146.db2.gz MVLTVURFBJHUSJ-VWLOTQADSA-N 0 3 402.542 4.155 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)CN[C@@H](c2ccccc2)C2CC2)c(C(F)(F)F)c1 ZINC000538391576 938609571 /nfs/dbraw/zinc/60/95/71/938609571.db2.gz KMBMMIRCTKVAMQ-FQEVSTJZSA-N 0 3 405.420 4.343 20 0 HIADHN C[C@H](NCCOCc1ccc(Cl)cc1Cl)c1ccc(S(C)(=O)=O)cc1 ZINC000538456345 938626299 /nfs/dbraw/zinc/62/62/99/938626299.db2.gz RFGQBBCQQVXMOI-ZDUSSCGKSA-N 0 3 402.343 4.264 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N[C@@H]1C[C@H]2CCC(C)(C)c3cccc1c32 ZINC000538483791 938632081 /nfs/dbraw/zinc/63/20/81/938632081.db2.gz COGLODPAINKRRV-XMSQKQJNSA-N 0 3 419.569 4.411 20 0 HIADHN Cc1cc(C(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)nn1[C@@H](C)C1CC1 ZINC000538565716 938650768 /nfs/dbraw/zinc/65/07/68/938650768.db2.gz CSXORDUNNYCUBL-GHTZIAJQSA-N 0 3 418.545 4.058 20 0 HIADHN Cc1cccc(C)c1CC(=O)NC1CCN(CCOc2ccc(Cl)cc2)CC1 ZINC000538572666 938652562 /nfs/dbraw/zinc/65/25/62/938652562.db2.gz FSZUAJHCRWYQRQ-UHFFFAOYSA-N 0 3 400.950 4.159 20 0 HIADHN CN(Cc1cc(F)c(F)c(F)c1)C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000538618554 938662871 /nfs/dbraw/zinc/66/28/71/938662871.db2.gz DUVSSQGPFJIEDI-UHFFFAOYSA-N 0 3 423.504 4.359 20 0 HIADHN COCCOc1cccc(CN2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)c1 ZINC000538725570 938692584 /nfs/dbraw/zinc/69/25/84/938692584.db2.gz FLIYQGYITZJRQW-UHFFFAOYSA-N 0 3 420.912 4.355 20 0 HIADHN COC(=O)[C@@H]1CC12CCN(Cc1ccc(OCc3cccs3)c(OC)c1)CC2 ZINC000538729217 938694685 /nfs/dbraw/zinc/69/46/85/938694685.db2.gz XZPQHZDWCHONGT-SFHVURJKSA-N 0 3 401.528 4.111 20 0 HIADHN Cc1nn(Cc2ccc(C)cc2)c(C)c1CN1CCC(CN2CCCCC2=O)CC1 ZINC000538736551 938697044 /nfs/dbraw/zinc/69/70/44/938697044.db2.gz MNKWTHNJTXYJMC-UHFFFAOYSA-N 0 3 408.590 4.081 20 0 HIADHN COc1ccc(CN(C(=O)N[C@H]2CN(C3CC3)C[C@H]2C)C2CCCCC2)cc1OC ZINC000538811843 938718927 /nfs/dbraw/zinc/71/89/27/938718927.db2.gz JPFHRQFVYROYBJ-UTKZUKDTSA-N 0 3 415.578 4.031 20 0 HIADHN Cc1nn(-c2ccc(Br)cc2)cc1CN1CC[C@@H](C)[C@@H](n2ccnc2)C1 ZINC000538827298 938720795 /nfs/dbraw/zinc/72/07/95/938720795.db2.gz UGMSSBDHZYRCGT-QRWLVFNGSA-N 0 3 414.351 4.223 20 0 HIADHN Cc1nn(-c2ccc(Br)cc2)cc1CN1CC[C@H](C)[C@H](n2ccnc2)C1 ZINC000538827297 938720861 /nfs/dbraw/zinc/72/08/61/938720861.db2.gz UGMSSBDHZYRCGT-MGPUTAFESA-N 0 3 414.351 4.223 20 0 HIADHN COc1cc(CNc2cc(C(N)=O)ccc2CN(C)C)c(-c2ccccc2)cc1OC ZINC000538832857 938722096 /nfs/dbraw/zinc/72/20/96/938722096.db2.gz QJPLDZMJFWYTPV-UHFFFAOYSA-N 0 3 419.525 4.143 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)c1ncccc1C(F)(F)F ZINC000538842623 938723919 /nfs/dbraw/zinc/72/39/19/938723919.db2.gz HGIPIZOYTKHSRV-UHFFFAOYSA-N 0 3 419.369 4.323 20 0 HIADHN O=C(CCc1ccco1)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1 ZINC000538923729 938738497 /nfs/dbraw/zinc/73/84/97/938738497.db2.gz MMHHNSIUAXDYFH-UHFFFAOYSA-N 0 3 403.526 4.216 20 0 HIADHN C[C@@H](NC[C@@H](CO)Cc1ccccc1OC(F)(F)F)c1nc2c(s1)CCCC2 ZINC000538985999 938759824 /nfs/dbraw/zinc/75/98/24/938759824.db2.gz ZSEHYJVLRRRBCS-KGLIPLIRSA-N 0 3 414.493 4.422 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@H](C)N[C@H](C)c2cnc3cc(C)nn3c2C)CC1 ZINC000538988038 938760844 /nfs/dbraw/zinc/76/08/44/938760844.db2.gz XGGCAVJZVZSPOM-ZWKOTPCHSA-N 0 3 424.568 4.039 20 0 HIADHN CC[C@H](NCc1ccc(S(=O)(=O)N2CCCCC2)cc1)c1cccc(OC)c1 ZINC000539019625 938770860 /nfs/dbraw/zinc/77/08/60/938770860.db2.gz LTILXHROEXLBPK-QFIPXVFZSA-N 0 3 402.560 4.111 20 0 HIADHN CCOc1ccc([C@H](C)N[C@@H](C)c2ccc(S(=O)(=O)N(C)C)cc2)cc1OCC ZINC000539021194 938771320 /nfs/dbraw/zinc/77/13/20/938771320.db2.gz VVUOZTNGCUKYMW-IRXDYDNUSA-N 0 3 420.575 4.146 20 0 HIADHN C[C@H](NCc1ccccc1-n1cccn1)c1ccc(S(=O)(=O)C2CCCC2)cc1 ZINC000539042494 938779015 /nfs/dbraw/zinc/77/90/15/938779015.db2.gz BWNPJUDCRBVRQN-SFHVURJKSA-N 0 3 409.555 4.439 20 0 HIADHN CC(=O)N1CC[C@H](N[C@H](C)c2ccc(I)cc2)c2ccccc21 ZINC000539050831 938783129 /nfs/dbraw/zinc/78/31/29/938783129.db2.gz QRCOWKVGWHTBKH-ACJLOTCBSA-N 0 3 420.294 4.440 20 0 HIADHN C[C@@H](CC(=O)Nc1ccccc1C(F)(F)F)NCc1nc(-c2ccc(F)cc2)n[nH]1 ZINC000539056260 938785513 /nfs/dbraw/zinc/78/55/13/938785513.db2.gz CYKBXLFUOSNABJ-LBPRGKRZSA-N 0 3 421.398 4.137 20 0 HIADHN CC[C@@H](NC[C@H](OC)c1cccc(Cl)c1)c1ccccc1OCC(=O)N(C)C ZINC000539086736 938799448 /nfs/dbraw/zinc/79/94/48/938799448.db2.gz KQZJTQLTCKEXGS-CTNGQTDRSA-N 0 3 404.938 4.235 20 0 HIADHN C[C@@H](N[C@H](C)c1ccccc1C(F)(F)F)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000539086412 938799754 /nfs/dbraw/zinc/79/97/54/938799754.db2.gz LKMRVQVBXWHQDJ-ZIAGYGMSSA-N 0 3 400.466 4.368 20 0 HIADHN CC[C@@H](N[C@H]1CCN(c2cc(OC)cc(OC)c2)C1=O)c1ccc(OC(F)F)cc1 ZINC000539088536 938800056 /nfs/dbraw/zinc/80/00/56/938800056.db2.gz VAYOMLHCEJABOS-UXHICEINSA-N 0 3 420.456 4.151 20 0 HIADHN C[C@H](CC(=O)Nc1ccccc1C(F)(F)F)N[C@@H]1C[C@@H](C)N(c2ccccc2)C1=O ZINC000539090440 938800843 /nfs/dbraw/zinc/80/08/43/938800843.db2.gz JHCQLBVLAWAKOG-SPYBWZPUSA-N 0 3 419.447 4.206 20 0 HIADHN C[C@@H](NCc1ccc(C(=O)N2CCCCC2)cc1)c1cccc(N2CCOCC2)c1 ZINC000539092210 938801428 /nfs/dbraw/zinc/80/14/28/938801428.db2.gz ZDXFYPWTKCTCBP-HXUWFJFHSA-N 0 3 407.558 4.000 20 0 HIADHN c1ccc(-c2nnn(CCCCCN3CC(c4nc5ccccc5s4)C3)n2)cc1 ZINC000539139777 938809926 /nfs/dbraw/zinc/80/99/26/938809926.db2.gz NVEYVTKRKFFROR-UHFFFAOYSA-N 0 3 404.543 4.220 20 0 HIADHN Cc1cc(NC(=O)NCCc2sccc2C)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000539155498 938813144 /nfs/dbraw/zinc/81/31/44/938813144.db2.gz XZPZXBQHEMCOQK-FQEVSTJZSA-N 0 3 423.586 4.373 20 0 HIADHN CN1CCN(c2ccc(CN[C@@H](c3ccc(Cl)c(Cl)c3)C3CC3)cn2)CC1 ZINC000539164694 938814715 /nfs/dbraw/zinc/81/47/15/938814715.db2.gz WAILHGCGCUBLKX-OAQYLSRUSA-N 0 3 405.373 4.381 20 0 HIADHN Brc1cccc2c1CC[C@H]2N[C@H](CN1CCOCC1)c1ccccc1 ZINC000539164751 938814727 /nfs/dbraw/zinc/81/47/27/938814727.db2.gz XXPKPEKFFVQCDL-NHCUHLMSSA-N 0 3 401.348 4.100 20 0 HIADHN CN1CCN(c2ccc(CN[C@H](c3ccc(Cl)c(Cl)c3)C3CC3)cn2)CC1 ZINC000539164692 938814799 /nfs/dbraw/zinc/81/47/99/938814799.db2.gz WAILHGCGCUBLKX-NRFANRHFSA-N 0 3 405.373 4.381 20 0 HIADHN Clc1ccc([C@H](NCc2ccccc2OCCN2CCOCC2)C2CC2)cc1 ZINC000539200659 938818498 /nfs/dbraw/zinc/81/84/98/938818498.db2.gz UMSQFRIFXUDAQH-HSZRJFAPSA-N 0 3 400.950 4.292 20 0 HIADHN CCOc1ccc([C@H](C)NC(=O)CCCN[C@@H](C)c2nc3ccccc3n2C)cc1 ZINC000539216256 938819931 /nfs/dbraw/zinc/81/99/31/938819931.db2.gz BIYFCKSKSDESQH-ROUUACIJSA-N 0 3 408.546 4.280 20 0 HIADHN CC(C)Oc1ccccc1[C@H](C)NCCC(=O)Nc1ccc(N2CCCC2=O)cc1 ZINC000539227271 938821723 /nfs/dbraw/zinc/82/17/23/938821723.db2.gz ZSFYJUCZPXFGJL-SFHVURJKSA-N 0 3 409.530 4.280 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccccc1-n1cccn1)C(=O)N(C)Cc1c(F)cccc1Cl ZINC000539259889 938828900 /nfs/dbraw/zinc/82/89/00/938828900.db2.gz BYWSOWTZZCNSNX-JKSUJKDBSA-N 0 3 414.912 4.363 20 0 HIADHN Cc1cccc([C@H](C)NCC(=O)N2c3ccccc3NC(=O)C[C@@H]2C(F)(F)F)c1C ZINC000539286123 938833665 /nfs/dbraw/zinc/83/36/65/938833665.db2.gz COERDFODNCQTKQ-HNAYVOBHSA-N 0 3 419.447 4.260 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)N[C@H]1CCO[C@@H]1c1ccc(Cl)cc1 ZINC000539292541 938835105 /nfs/dbraw/zinc/83/51/05/938835105.db2.gz FHZDBZJECGKUOX-LEWJYISDSA-N 0 3 419.928 4.083 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)N[C@H]1CCO[C@H]1c1ccc(Cl)cc1 ZINC000539299893 938836397 /nfs/dbraw/zinc/83/63/97/938836397.db2.gz VFXWIGQMXPUBRM-BDTNDASRSA-N 0 3 413.949 4.306 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@H](C)NCc2nc3ccccc3nc2C)CC1 ZINC000539312009 938839218 /nfs/dbraw/zinc/83/92/18/938839218.db2.gz FQMQJZFHBRFFFT-KRWDZBQOSA-N 0 3 407.537 4.070 20 0 HIADHN C[C@@H](NC[C@@H](O)COc1cccc2ccccc21)c1cccc(N2CCCC2=O)c1 ZINC000539314003 938839591 /nfs/dbraw/zinc/83/95/91/938839591.db2.gz STYJNENOHOIBHS-XMSQKQJNSA-N 0 3 404.510 4.057 20 0 HIADHN Cc1cc(NC(=O)CN[C@H](C[C@H]2CCOC2)c2ccccc2)ccc1Br ZINC000539324108 938841339 /nfs/dbraw/zinc/84/13/39/938841339.db2.gz CJRWAESSSIDUKP-OXQOHEQNSA-N 0 3 417.347 4.454 20 0 HIADHN O=C(CN[C@@H](C[C@@H]1CCOC1)c1ccccc1)Nc1ccc(Br)cc1F ZINC000539334712 938843434 /nfs/dbraw/zinc/84/34/34/938843434.db2.gz GQHDGCNNSLMAPP-LIRRHRJNSA-N 0 3 421.310 4.284 20 0 HIADHN O=C(CN[C@H](C[C@H]1CCOC1)c1ccccc1)Nc1ccc(OC(F)(F)F)cc1 ZINC000539334869 938843854 /nfs/dbraw/zinc/84/38/54/938843854.db2.gz NPVZPLUJGLHAKJ-DNVCBOLYSA-N 0 3 408.420 4.281 20 0 HIADHN Cc1cc(Br)ccc1NC(=O)CN[C@@H](C)c1ccc(-n2cccn2)cc1 ZINC000539338523 938844603 /nfs/dbraw/zinc/84/46/03/938844603.db2.gz DDKONCKLLKZFNB-HNNXBMFYSA-N 0 3 413.319 4.233 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)N[C@H](C)C(=O)Nc2nc3ccccc3s2)cc1 ZINC000539363610 938849144 /nfs/dbraw/zinc/84/91/44/938849144.db2.gz PYIPCZICRSAIQU-LSDHHAIUSA-N 0 3 405.527 4.468 20 0 HIADHN COc1ccc([C@H](NC(=O)CN[C@@H](C)c2cccc(N3CCCC3)c2)C(C)C)cc1 ZINC000539379247 938851812 /nfs/dbraw/zinc/85/18/12/938851812.db2.gz SSIJKTZZRXWIBG-UQBPGWFLSA-N 0 3 409.574 4.460 20 0 HIADHN CS(=O)(=O)C[C@H](NCC/C=C/c1ccc(Br)cc1)c1ccccc1 ZINC000539378989 938851915 /nfs/dbraw/zinc/85/19/15/938851915.db2.gz NFNBUIIPIRABCK-XZXOBPBMSA-N 0 3 408.361 4.228 20 0 HIADHN COc1ccc(SC)c(OC)c1C(=O)NC[C@H](c1ccc(C)cc1)N1CCCC1 ZINC000539403682 938855587 /nfs/dbraw/zinc/85/55/87/938855587.db2.gz MNCPRZPUONCZOH-GOSISDBHSA-N 0 3 414.571 4.301 20 0 HIADHN COc1ccc(SC)c(OC)c1C(=O)NC[C@@H](c1ccc(C)cc1)N1CCCC1 ZINC000539403687 938855723 /nfs/dbraw/zinc/85/57/23/938855723.db2.gz MNCPRZPUONCZOH-SFHVURJKSA-N 0 3 414.571 4.301 20 0 HIADHN Cc1cc([C@@H](NCC(=O)N2CCC[C@@H]2c2ccc3c(c2)OCCO3)C2CC2)ccc1F ZINC000539422756 938858217 /nfs/dbraw/zinc/85/82/17/938858217.db2.gz FJTGNMHHFIUKRY-BWKNWUBXSA-N 0 3 424.516 4.310 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CNC(=O)CN[C@@H](c1ccccc1C)C1CC1 ZINC000539492224 938867962 /nfs/dbraw/zinc/86/79/62/938867962.db2.gz LQAJWZPPHNZVKD-AREMUKBSSA-N 0 3 416.569 4.214 20 0 HIADHN COC(=O)c1cc(Cl)cc(Cl)c1NC(=O)CN[C@@H](c1ccccc1)C1CC1 ZINC000539492575 938868254 /nfs/dbraw/zinc/86/82/54/938868254.db2.gz CJVSDWZDARIZQU-SFHVURJKSA-N 0 3 407.297 4.459 20 0 HIADHN COCCNS(=O)(=O)c1cccc(CN[C@H](CC(C)(C)C)c2ccc(F)cc2)c1 ZINC000539497193 938868812 /nfs/dbraw/zinc/86/88/12/938868812.db2.gz RDELMUYLHOWWPD-OAQYLSRUSA-N 0 3 422.566 4.018 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cc(C)n(C4CCCCC4)n3)c(C)c2)CC1 ZINC000539548803 938878320 /nfs/dbraw/zinc/87/83/20/938878320.db2.gz CWHDPEXYQYDTJG-UHFFFAOYSA-N 0 3 409.578 4.399 20 0 HIADHN Cc1cc(C(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)nn1-c1ccccc1Cl ZINC000539564808 938880901 /nfs/dbraw/zinc/88/09/01/938880901.db2.gz WTOTUSPEDSYYBS-LJQANCHMSA-N 0 3 408.933 4.181 20 0 HIADHN CCN1CCN(Cc2ccc(N[C@@H](Cc3ccccn3)c3cccnc3)cc2)CC1 ZINC000539596261 938885574 /nfs/dbraw/zinc/88/55/74/938885574.db2.gz VVBDIGFUHXOWJQ-VWLOTQADSA-N 0 3 401.558 4.010 20 0 HIADHN COCc1ccc(CN[C@H]2CCCN(Cc3cccc(C(F)(F)F)c3)C2=O)cc1 ZINC000539634212 938891225 /nfs/dbraw/zinc/89/12/25/938891225.db2.gz RZNPBGDHWMBIQH-FQEVSTJZSA-N 0 3 406.448 4.133 20 0 HIADHN CCN1CCN(c2ccccc2NC2CCC3(CC2)c2ccccc2NC3=O)CC1 ZINC000539646899 938893308 /nfs/dbraw/zinc/89/33/08/938893308.db2.gz LSQVRJYSYCNSLY-UHFFFAOYSA-N 0 3 404.558 4.073 20 0 HIADHN C[C@@H]1CN(Cc2ccccn2)CC[C@H]1Nc1cccc(C(=O)NCc2ccccc2)c1 ZINC000539725729 938913788 /nfs/dbraw/zinc/91/37/88/938913788.db2.gz LYKNGULUSUDALP-CJFMBICVSA-N 0 3 414.553 4.334 20 0 HIADHN C[C@@H]1CN(Cc2ccccn2)CC[C@@H]1Nc1cccc(C(=O)NCc2ccccc2)c1 ZINC000539725732 938913835 /nfs/dbraw/zinc/91/38/35/938913835.db2.gz LYKNGULUSUDALP-NLFFAJNJSA-N 0 3 414.553 4.334 20 0 HIADHN Cc1nc([C@H]2CCCN([C@@H](c3nc(-c4ccccc4)no3)c3ccccc3)C2)n[nH]1 ZINC000539762789 938927639 /nfs/dbraw/zinc/92/76/39/938927639.db2.gz ABWDRUNRSYXJGS-VQTJNVASSA-N 0 3 400.486 4.132 20 0 HIADHN Cc1n[nH]c([C@H]2CCCN([C@@H](c3nc(-c4ccccc4)no3)c3ccccc3)C2)n1 ZINC000539762789 938927642 /nfs/dbraw/zinc/92/76/42/938927642.db2.gz ABWDRUNRSYXJGS-VQTJNVASSA-N 0 3 400.486 4.132 20 0 HIADHN Cc1nnc([C@H]2CCCN([C@@H](c3nc(-c4ccccc4)no3)c3ccccc3)C2)[nH]1 ZINC000539762789 938927645 /nfs/dbraw/zinc/92/76/45/938927645.db2.gz ABWDRUNRSYXJGS-VQTJNVASSA-N 0 3 400.486 4.132 20 0 HIADHN CC(=O)c1ccc(NC(=O)CCN2CCC[C@H](c3nnc(C4CCCCC4)[nH]3)C2)cc1 ZINC000539767378 938930697 /nfs/dbraw/zinc/93/06/97/938930697.db2.gz VUVHQQQSBTWGKV-FQEVSTJZSA-N 0 3 423.561 4.263 20 0 HIADHN CC(=O)N1C[C@@H]2CCC[C@H](N[C@@H](C)c3nc(-c4cccc(C(F)(F)F)c4)no3)[C@H]2C1 ZINC000563566195 945217516 /nfs/dbraw/zinc/21/75/16/945217516.db2.gz SRWJVFKBCQXRQM-FRJURHEUSA-N 0 3 422.451 4.053 20 0 HIADHN COC(=O)[C@@H]1CC12CCN(Cc1ccc(OCc3ccc(F)cc3)c(OC)c1)CC2 ZINC000539827439 938948383 /nfs/dbraw/zinc/94/83/83/938948383.db2.gz ANJDDWRGYNWCLA-FQEVSTJZSA-N 0 3 413.489 4.188 20 0 HIADHN COc1cc(N[C@H]2CCCN(Cc3ccc(OC)c(OC(F)F)c3)C2)cc(OC)c1 ZINC000539849752 938956953 /nfs/dbraw/zinc/95/69/53/938956953.db2.gz KZBIZGKWGRUILB-INIZCTEOSA-N 0 3 422.472 4.390 20 0 HIADHN CCOc1cc(CN(C)CCC(=O)OC(C)(C)C)cc(Br)c1OC ZINC000539851676 938958197 /nfs/dbraw/zinc/95/81/97/938958197.db2.gz YDWLJGFJZIODFE-UHFFFAOYSA-N 0 3 402.329 4.020 20 0 HIADHN COc1cc(OC)c(OC)cc1CN1CCC[C@H](c2nc3c(s2)CCCC3)C1 ZINC000539862603 938960465 /nfs/dbraw/zinc/96/04/65/938960465.db2.gz FCHLWETVBCQUIK-HNNXBMFYSA-N 0 3 402.560 4.427 20 0 HIADHN CCc1cccc(C(=O)N(C[C@@H]2CC[N@H+](Cc3ccccc3)C2)CC(F)(F)F)c1[O-] ZINC000539871260 938962846 /nfs/dbraw/zinc/96/28/46/938962846.db2.gz CQXHOGNXTNRMQN-GOSISDBHSA-N 0 3 420.475 4.481 20 0 HIADHN CCc1cccc(C(=O)N(C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)CC(F)(F)F)c1[O-] ZINC000539871260 938962849 /nfs/dbraw/zinc/96/28/49/938962849.db2.gz CQXHOGNXTNRMQN-GOSISDBHSA-N 0 3 420.475 4.481 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)CCn2c3ccccc3nc2C2CC2)CC1 ZINC000539876998 938963949 /nfs/dbraw/zinc/96/39/49/938963949.db2.gz XSSBYWIROQUZIC-UHFFFAOYSA-N 0 3 416.569 4.427 20 0 HIADHN CCCN(C(=O)c1cccs1)C1CCN(Cc2cccc(-n3cccn3)c2)CC1 ZINC000539898409 938971933 /nfs/dbraw/zinc/97/19/33/938971933.db2.gz QEOOTGWFKLFGFZ-UHFFFAOYSA-N 0 3 408.571 4.451 20 0 HIADHN O=C(Nc1cccc(CN2CCS[C@H]3COCC[C@H]32)c1)c1ccccc1Cl ZINC000539909608 938976196 /nfs/dbraw/zinc/97/61/96/938976196.db2.gz FNVWFAKRISDFTD-UXHICEINSA-N 0 3 402.947 4.299 20 0 HIADHN CN(Cc1cc(Br)ccc1OCc1ccccn1)C[C@H]1CCC[C@H]1O ZINC000539912636 938977314 /nfs/dbraw/zinc/97/73/14/938977314.db2.gz DRYQKXYNPKAYAH-DNVCBOLYSA-N 0 3 405.336 4.016 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)c2ccc(Br)cc2F)cc1 ZINC000539931242 938978763 /nfs/dbraw/zinc/97/87/63/938978763.db2.gz HYHVUCPBCNYJNU-IBGZPJMESA-N 0 3 421.310 4.164 20 0 HIADHN CC(C)(C)[C@@H](CN1CCc2ccccc2C1)NC(=O)c1ncccc1C(F)(F)F ZINC000539948188 938980466 /nfs/dbraw/zinc/98/04/66/938980466.db2.gz XOQDRBANZWBBSL-GOSISDBHSA-N 0 3 405.464 4.303 20 0 HIADHN COc1ccc(-c2ccccc2)cc1CN[C@@H](CN1CCN(C)CC1)c1ccccc1 ZINC000539963325 938981848 /nfs/dbraw/zinc/98/18/48/938981848.db2.gz SHNJRXUERBXWIC-SANMLTNESA-N 0 3 415.581 4.441 20 0 HIADHN CO[C@H](c1ccc(F)cc1)[C@H](C)NC(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000540015417 939040510 /nfs/dbraw/zinc/04/05/10/939040510.db2.gz DZFTXZJVWZGHEN-CVAIRZPRSA-N 0 3 405.539 4.100 20 0 HIADHN CC(C)(C)N1CCCN(C(=O)c2cc(OCC(F)(F)F)c3ccccc3n2)CC1 ZINC000540060864 939054988 /nfs/dbraw/zinc/05/49/88/939054988.db2.gz IORVGOAHENXYPK-UHFFFAOYSA-N 0 3 409.452 4.122 20 0 HIADHN Cc1cc2ncc([C@H](C)NCc3ccc(-n4ccc(C(F)(F)F)n4)cc3)c(C)n2n1 ZINC000540087075 939065650 /nfs/dbraw/zinc/06/56/50/939065650.db2.gz UWOQROGVRYOODP-AWEZNQCLSA-N 0 3 414.435 4.401 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)Nc1cccc(-c2ccc3c(c2)CCO3)c1 ZINC000540110938 939075747 /nfs/dbraw/zinc/07/57/47/939075747.db2.gz NALRHAUJNGVRQX-UHFFFAOYSA-N 0 3 416.525 4.279 20 0 HIADHN CC(C)Cn1cc(NC(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)c(C(F)F)n1 ZINC000540114043 939077737 /nfs/dbraw/zinc/07/77/37/939077737.db2.gz HTWSJGNGORFZMA-WBVHZDCISA-N 0 3 405.493 4.434 20 0 HIADHN CCOc1ccc([C@@H](C)NCc2ccc(S(=O)(=O)N3CCCCC3)cc2)cc1 ZINC000540119741 939079792 /nfs/dbraw/zinc/07/97/92/939079792.db2.gz QGGCEAOJYABYNN-GOSISDBHSA-N 0 3 402.560 4.111 20 0 HIADHN COc1ccc([C@H](C)N[C@H]2CC(=O)N(C)[C@H]2c2ccc(Cl)c(F)c2)cc1OC ZINC000540139075 939088107 /nfs/dbraw/zinc/08/81/07/939088107.db2.gz KEYXWLPKIYXPCG-LJOBPSPCSA-N 0 3 406.885 4.119 20 0 HIADHN C[C@@H](N[C@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000540144190 939089917 /nfs/dbraw/zinc/08/99/17/939089917.db2.gz LHTCAMJPAYFNQX-OCCSQVGLSA-N 0 3 415.896 4.165 20 0 HIADHN C[C@@H](N[C@@H]1CCCN(CC(F)(F)F)C1=O)c1ccc(OCc2ccccc2)cc1 ZINC000540152155 939092760 /nfs/dbraw/zinc/09/27/60/939092760.db2.gz VWEJIYGDRAAIGN-OXQOHEQNSA-N 0 3 406.448 4.470 20 0 HIADHN Cc1ccc(NC(=O)C[C@H](C)N[C@@H]2CC(=O)N(C)[C@@H]2c2ccc(Cl)cc2)c(C)c1 ZINC000540162243 939097565 /nfs/dbraw/zinc/09/75/65/939097565.db2.gz GUPNUVKYGZOXJJ-LERMDLETSA-N 0 3 413.949 4.236 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)C[C@H](C)NCc1cccc2c1OCCCO2 ZINC000540163416 939098154 /nfs/dbraw/zinc/09/81/54/939098154.db2.gz FIXUDGDZSZNYTC-AWEZNQCLSA-N 0 3 404.894 4.017 20 0 HIADHN CC(C)C[C@H](N[C@@H](C)c1ccc2c(c1)C(C)(C)C(=O)N2)C(=O)Nc1nccs1 ZINC000540165867 939098729 /nfs/dbraw/zinc/09/87/29/939098729.db2.gz ZHALOFHWFAKEED-GUYCJALGSA-N 0 3 400.548 4.077 20 0 HIADHN C[C@@H](N[C@@H]1CC(=O)N(c2ccccc2Cl)C1)c1ccc(NC(=O)NC2CC2)cc1 ZINC000540180465 939107940 /nfs/dbraw/zinc/10/79/40/939107940.db2.gz DTTVTTHGFQSCNJ-RDTXWAMCSA-N 0 3 412.921 4.080 20 0 HIADHN COc1ccc(CN2CC[C@H](N[C@H](C)c3ccc(OCC(F)(F)F)cc3)C2=O)cc1 ZINC000540183833 939109420 /nfs/dbraw/zinc/10/94/20/939109420.db2.gz ULDXPWJAYUTCEQ-QRWLVFNGSA-N 0 3 422.447 4.088 20 0 HIADHN CC[C@@H](NCc1cccc(C(=O)NCc2ccco2)c1)c1ccc2c(c1)OCCO2 ZINC000540187694 939111764 /nfs/dbraw/zinc/11/17/64/939111764.db2.gz BMMLUCNFMYRZEK-OAQYLSRUSA-N 0 3 406.482 4.222 20 0 HIADHN CC[C@@H](NCc1ccccc1OCC(=O)NC[C@@H]1CCCO1)c1cccc(Cl)c1 ZINC000540191541 939116314 /nfs/dbraw/zinc/11/63/14/939116314.db2.gz PXNZBQSXHSSGKY-LEWJYISDSA-N 0 3 416.949 4.255 20 0 HIADHN CCO[C@@H]1C[C@@H](NCc2ccc(OCc3cccs3)c(OC)c2)[C@H]1n1cccn1 ZINC000563637711 945229404 /nfs/dbraw/zinc/22/94/04/945229404.db2.gz XWJPNKMEKRZGNA-STZQEDGTSA-N 0 3 413.543 4.041 20 0 HIADHN Cc1nc2c(s1)[C@H]([NH2+]Cc1nnc(-c3ccc(Br)cc3)[n-]1)CCC2 ZINC000540222061 939137452 /nfs/dbraw/zinc/13/74/52/939137452.db2.gz ZKGQQNOHECPZSR-CYBMUJFWSA-N 0 3 404.337 4.166 20 0 HIADHN CS(=O)(=O)CC1(CN[C@@H](CCSc2ccccc2)c2ccc(F)cc2)CC1 ZINC000540223255 939138568 /nfs/dbraw/zinc/13/85/68/939138568.db2.gz ZSPLWMDXQUNITE-FQEVSTJZSA-N 0 3 407.576 4.464 20 0 HIADHN C[C@@H](NCc1ccc(-c2ccc3c(c2)CCCO3)cc1)c1ccc(S(N)(=O)=O)cc1 ZINC000540301754 939186997 /nfs/dbraw/zinc/18/69/97/939186997.db2.gz MGOCHUOHUPTNGO-QGZVFWFLSA-N 0 3 422.550 4.177 20 0 HIADHN O=C(c1ccc(CN[C@@H](c2cccc(C(F)(F)F)c2)C2CC2)cc1)N1CCOCC1 ZINC000540301631 939187298 /nfs/dbraw/zinc/18/72/98/939187298.db2.gz MMUYGAWIDNMGBQ-OAQYLSRUSA-N 0 3 418.459 4.419 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(OCc2cccnc2)cc1)C(=O)Nc1ccc2c(c1)OCO2 ZINC000540325424 939194922 /nfs/dbraw/zinc/19/49/22/939194922.db2.gz HHXXNSDKOKISPY-DLBZAZTESA-N 0 3 419.481 4.067 20 0 HIADHN CC[C@H](NCC(=O)NCC1(c2ccccc2)CCOCC1)c1cccc(Cl)c1 ZINC000540332348 939197641 /nfs/dbraw/zinc/19/76/41/939197641.db2.gz LVNOMYOAIPVUEI-NRFANRHFSA-N 0 3 400.950 4.245 20 0 HIADHN CC(C)[C@H](NCC(=O)N(C)[C@@H](C)c1ccc(F)c(F)c1)c1ccc2c(c1)OCCO2 ZINC000540341725 939200116 /nfs/dbraw/zinc/20/01/16/939200116.db2.gz RWKSACNVLHCZDZ-WNSKOXEYSA-N 0 3 418.484 4.242 20 0 HIADHN COc1ccccc1[C@H](C)N(C)C(=O)CNC1(c2ccc3c(c2)OCCO3)CCCC1 ZINC000540342915 939200725 /nfs/dbraw/zinc/20/07/25/939200725.db2.gz KUGREGWDPSVNCH-SFHVURJKSA-N 0 3 424.541 4.045 20 0 HIADHN CC[C@H](N[C@@H](C)C(=O)N[C@H](C)c1cc(OC)ccc1OC)c1ccc(OC)cc1 ZINC000540343370 939201077 /nfs/dbraw/zinc/20/10/77/939201077.db2.gz SGJGVPQBIPGDCP-XFQAVAEZSA-N 0 3 400.519 4.019 20 0 HIADHN COc1cc2c(cc1OC)CN(C(=O)CN[C@@H](CC(C)C)c1ccccc1C)CC2 ZINC000540359410 939208233 /nfs/dbraw/zinc/20/82/33/939208233.db2.gz BEVUMQQHAUYCRE-QFIPXVFZSA-N 0 3 410.558 4.274 20 0 HIADHN CC[C@H](NCCC(=O)NC)c1ccccc1OCc1ccccc1Br ZINC000540358470 939208519 /nfs/dbraw/zinc/20/85/19/939208519.db2.gz AOVPDJSGNLMYQR-SFHVURJKSA-N 0 3 405.336 4.205 20 0 HIADHN COc1ccc(CNC(=O)CN[C@H](c2cccc(C(F)(F)F)c2)C(C)C)cc1OC ZINC000540360308 939209614 /nfs/dbraw/zinc/20/96/14/939209614.db2.gz STWNDACTBZGSLI-NRFANRHFSA-N 0 3 424.463 4.326 20 0 HIADHN COc1cccc([C@H](NC2CCN(C(=O)N(C)C)CC2)c2ccccc2Cl)c1 ZINC000540361299 939210255 /nfs/dbraw/zinc/21/02/55/939210255.db2.gz WTDVOORZNYAHFA-NRFANRHFSA-N 0 3 401.938 4.174 20 0 HIADHN CN(C)C(=O)c1ccc(NC(=O)CN[C@H](CCc2ccccc2)c2ccccc2)cc1 ZINC000540377266 939217403 /nfs/dbraw/zinc/21/74/03/939217403.db2.gz XRQGEUUBTLLSMV-XMMPIXPASA-N 0 3 415.537 4.291 20 0 HIADHN Cc1cc2ncn(C[C@@H](O)CN[C@@H](CC(F)(F)F)c3ccc(F)cc3)c2cc1C ZINC000540377775 939218592 /nfs/dbraw/zinc/21/85/92/939218592.db2.gz WBVOTNDQWWAFOU-HKUYNNGSSA-N 0 3 409.427 4.436 20 0 HIADHN CCOc1ccc2nc(NC(=O)CN[C@@H](c3ccccc3)[C@@H]3CCOC3)sc2c1 ZINC000540388284 939225416 /nfs/dbraw/zinc/22/54/16/939225416.db2.gz PRLGZAAZJGIMNE-IERDGZPVSA-N 0 3 411.527 4.001 20 0 HIADHN C[C@H](NCC(=O)N(Cc1ccccc1)[C@@H](C)C1CC1)c1cccc(-n2cccn2)c1 ZINC000540388881 939226475 /nfs/dbraw/zinc/22/64/75/939226475.db2.gz ZBNMLGPBBSZDSZ-PMACEKPBSA-N 0 3 402.542 4.350 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)N[C@H]1CCO[C@H]1c1ccc(Cl)cc1 ZINC000540391002 939230411 /nfs/dbraw/zinc/23/04/11/939230411.db2.gz POZFUQCHZUCJII-SFTDATJTSA-N 0 3 419.928 4.083 20 0 HIADHN CN(C(=O)N[C@@H]1CCO[C@@H]1c1ccc(Cl)cc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000540393266 939232198 /nfs/dbraw/zinc/23/21/98/939232198.db2.gz ROVVPXGUIXFSTH-BHDDXSALSA-N 0 3 413.949 4.086 20 0 HIADHN COc1cccc(CN(C)C(=O)CN[C@@H](c2ccc(F)cc2)C2CCCC2)c1OC ZINC000540411064 939239080 /nfs/dbraw/zinc/23/90/80/939239080.db2.gz HIOYDQXULFEREM-HSZRJFAPSA-N 0 3 414.521 4.322 20 0 HIADHN CCN1CCN(Cc2ccc(CNC(=O)Nc3c(F)cc(Cl)cc3F)cc2)CC1 ZINC000540418045 939241197 /nfs/dbraw/zinc/24/11/97/939241197.db2.gz FNYNRDHTOPIWSN-UHFFFAOYSA-N 0 3 422.907 4.077 20 0 HIADHN Cc1ccccc1-n1nccc1NC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC000540418798 939241981 /nfs/dbraw/zinc/24/19/81/939241981.db2.gz NGOJZGPOARFFBQ-HXUWFJFHSA-N 0 3 403.530 4.309 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(-n2ccnn2)cc1)C(=O)Nc1ccc(Cl)c(Cl)c1 ZINC000540431857 939245959 /nfs/dbraw/zinc/24/59/59/939245959.db2.gz GWIRGWBXGLSQLW-QWHCGFSZSA-N 0 3 404.301 4.252 20 0 HIADHN Cc1cccc(OCCNC(=O)[C@H](C)N[C@@H](C)c2ccc(-c3cccnc3)cc2)c1 ZINC000540433049 939246641 /nfs/dbraw/zinc/24/66/41/939246641.db2.gz PRZWFSLODKEGAS-PMACEKPBSA-N 0 3 403.526 4.291 20 0 HIADHN C[C@@H](NCC(=O)N[C@H](c1cccs1)c1ccccc1)c1ccc(-n2cccn2)cc1 ZINC000540435299 939248068 /nfs/dbraw/zinc/24/80/68/939248068.db2.gz NWTJIXYMKVQONE-KOSHJBKYSA-N 0 3 416.550 4.490 20 0 HIADHN COc1cc(CNC(=O)CN[C@@H](c2ccccc2C)C(C)(C)C)cc(OC)c1OC ZINC000540455591 939257337 /nfs/dbraw/zinc/25/73/37/939257337.db2.gz LULYITLYNHKQBL-QHCPKHFHSA-N 0 3 414.546 4.014 20 0 HIADHN CC(C)Oc1ccc(CCNC(=O)CN[C@@H](C)c2cccc(N3CCCC3)c2)cc1 ZINC000540480723 939269362 /nfs/dbraw/zinc/26/93/62/939269362.db2.gz QWPNLMABZZXMQE-FQEVSTJZSA-N 0 3 409.574 4.084 20 0 HIADHN Cn1cc(CN2CCC([C@H]3C(=O)Nc4cc(Cl)ccc43)CC2)c(C(C)(C)C)n1 ZINC000540496088 939275604 /nfs/dbraw/zinc/27/56/04/939275604.db2.gz LFIWGEYVHAJMDZ-LJQANCHMSA-N 0 3 400.954 4.319 20 0 HIADHN C[C@H](CCCc1ccccc1)C(=O)Nc1ccc(C(=O)N(C)[C@@H]2CCCN(C)C2)cc1 ZINC000540499408 939278269 /nfs/dbraw/zinc/27/82/69/939278269.db2.gz HDXYDAPCFDZJIP-HYBUGGRVSA-N 0 3 421.585 4.450 20 0 HIADHN O=C(Nc1cccc(CNC[C@@H](O)COc2ccccc2)c1)c1ccc(Cl)cc1 ZINC000540513133 939283654 /nfs/dbraw/zinc/28/36/54/939283654.db2.gz UVDFJBNRZFNHPC-OAQYLSRUSA-N 0 3 410.901 4.122 20 0 HIADHN C[C@@H]1C[C@H]1[C@@H](NCC(=O)Nc1nc(CN2CCCC2)cs1)c1ccc(Cl)cc1 ZINC000540519134 939284936 /nfs/dbraw/zinc/28/49/36/939284936.db2.gz BDWUPODCHQNRFI-DJKXOVBDSA-N 0 3 418.994 4.318 20 0 HIADHN O=C(c1cccc(CN[C@H](c2ccc3c(c2)OCCO3)C2CC2)c1)N1CCCCC1 ZINC000540589347 939312216 /nfs/dbraw/zinc/31/22/16/939312216.db2.gz SVHXNAXGKATOBD-DEOSSOPVSA-N 0 3 406.526 4.325 20 0 HIADHN COc1cccc2cc([C@@H](C)NC[C@H](O)COc3ccccc3Br)oc21 ZINC000540605122 939317311 /nfs/dbraw/zinc/31/73/11/939317311.db2.gz CJQVHQRTQAVAGY-HIFRSBDPSA-N 0 3 420.303 4.294 20 0 HIADHN Cc1cc(NC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)nn1-c1cccc(F)c1 ZINC000540678756 939337242 /nfs/dbraw/zinc/33/72/42/939337242.db2.gz NZAGPLCPJBWUOA-GOSISDBHSA-N 0 3 421.520 4.448 20 0 HIADHN CSc1cccc(N(C(=O)c2ccc(C(C)=O)cc2F)C2CCN(C)CC2)c1 ZINC000540722498 939349398 /nfs/dbraw/zinc/34/93/98/939349398.db2.gz DVWHSZSFIVZUCI-UHFFFAOYSA-N 0 3 400.519 4.491 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)N[C@@H]1CCCOc2cc(F)ccc21 ZINC000540863544 939401120 /nfs/dbraw/zinc/40/11/20/939401120.db2.gz NTDBNJJCCFODQH-HXUWFJFHSA-N 0 3 421.463 4.091 20 0 HIADHN Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)C(=O)N[C@H](CN1CCCC1)c1ccccc1 ZINC000540895966 939413143 /nfs/dbraw/zinc/41/31/43/939413143.db2.gz OMBCNVNUQFFYHA-DNVCBOLYSA-N 0 3 422.495 4.119 20 0 HIADHN COc1ccc([C@H]2CCCN2C(=O)CN[C@@]2(C)CCCc3ccccc32)cc1OC ZINC000540906527 939415392 /nfs/dbraw/zinc/41/53/92/939415392.db2.gz FBGMONHRATTYAO-BWKNWUBXSA-N 0 3 408.542 4.209 20 0 HIADHN CSC[C@H](NCc1cccnc1N1CCN(C)CC1)c1ccc(C(F)(F)F)cc1 ZINC000540987615 939425701 /nfs/dbraw/zinc/42/57/01/939425701.db2.gz UXLAIHLONLPWRF-IBGZPJMESA-N 0 3 424.536 4.046 20 0 HIADHN C[C@H](NCCC(=O)N1CCCCC1)c1cccc(NC(=O)Cc2ccccc2F)c1 ZINC000541022448 939432625 /nfs/dbraw/zinc/43/26/25/939432625.db2.gz FJAXWEBXOITBAN-SFHVURJKSA-N 0 3 411.521 4.060 20 0 HIADHN CN(C)[C@H](CNC(=O)N1CCO[C@H](c2ccccc2C(F)(F)F)C1)c1ccccc1 ZINC000541034916 939437606 /nfs/dbraw/zinc/43/76/06/939437606.db2.gz OQXSJUBDFPMZTE-UXHICEINSA-N 0 3 421.463 4.091 20 0 HIADHN Cc1ccc(NC(=O)Nc2cccc3c2CCN(CCC(=O)N2CCCCC2)C3)cc1 ZINC000541057176 939444220 /nfs/dbraw/zinc/44/42/20/939444220.db2.gz WPJTVCDNRDZFHL-UHFFFAOYSA-N 0 3 420.557 4.400 20 0 HIADHN COc1cc(C(C)=O)ccc1OC[C@H](O)CN[C@H](c1ccc(Cl)cc1F)C(C)C ZINC000541059415 939445242 /nfs/dbraw/zinc/44/52/42/939445242.db2.gz IVHZBZLUJWLDPW-VGSWGCGISA-N 0 3 423.912 4.417 20 0 HIADHN COc1cccc2c1CCN(C(=O)[C@@]1(C(F)(F)F)CCN(Cc3ccccc3)C1)C2 ZINC000541086445 939455159 /nfs/dbraw/zinc/45/51/59/939455159.db2.gz DSDMPKDVDPDWNU-JOCHJYFZSA-N 0 3 418.459 4.035 20 0 HIADHN Cc1cc(C(C)(C)C)ccc1OC[C@H](O)CN[C@H](C)c1ccc([S@@](C)=O)cc1 ZINC000541117885 939466711 /nfs/dbraw/zinc/46/67/11/939466711.db2.gz RFDGMZKWUVZJRQ-ROERJRBBSA-N 0 3 403.588 4.120 20 0 HIADHN CCc1ccc([C@@H](C)NC(=O)[C@@H](C)N2CCC(CCC(=O)N(CC)CC)CC2)cc1 ZINC000541120644 939467690 /nfs/dbraw/zinc/46/76/90/939467690.db2.gz RTIDJKFFHVKEEM-WOJBJXKFSA-N 0 3 415.622 4.175 20 0 HIADHN CN(C(=O)NCCCCN1CCN(C)CC1)[C@@H](c1ccc(Cl)cc1)C1CCCC1 ZINC000541223894 939486478 /nfs/dbraw/zinc/48/64/78/939486478.db2.gz YSFWOPHIKOZALV-JOCHJYFZSA-N 0 3 421.029 4.240 20 0 HIADHN CCC[C@@H](N[C@H]1CCCN(Cc2nccn2C)C1=O)c1ccc(Cl)c(Cl)c1 ZINC000541228300 939486581 /nfs/dbraw/zinc/48/65/81/939486581.db2.gz IKENGHWGSVSFQI-MSOLQXFVSA-N 0 3 409.361 4.349 20 0 HIADHN O=C(CC1CCC(C(F)(F)F)CC1)NCc1ccccc1CN1CCC(O)CC1 ZINC000541243641 939487248 /nfs/dbraw/zinc/48/72/48/939487248.db2.gz UEKJXGCTNVWRTK-UHFFFAOYSA-N 0 3 412.496 4.018 20 0 HIADHN CSc1ccccc1C[C@H](C)NCc1ccccc1S(=O)(=O)NC(C)(C)C ZINC000541254696 939487890 /nfs/dbraw/zinc/48/78/90/939487890.db2.gz GUYWYWRDUUPXNP-INIZCTEOSA-N 0 3 406.617 4.206 20 0 HIADHN NC(=O)[C@H](Cc1ccc(C(F)(F)F)cc1)NCCSc1ccc(Cl)cc1 ZINC000541302073 939490160 /nfs/dbraw/zinc/49/01/60/939490160.db2.gz ITIOJVIABRJPLA-INIZCTEOSA-N 0 3 402.869 4.137 20 0 HIADHN COCCOc1ccc(C(F)(F)F)cc1NC(=O)[C@H](C)N(C)C[C@@H]1CC=CCC1 ZINC000541320358 939490822 /nfs/dbraw/zinc/49/08/22/939490822.db2.gz VFUAGOHLPKULQJ-JKSUJKDBSA-N 0 3 414.468 4.346 20 0 HIADHN O[C@H](COc1ccccc1C(F)(F)F)CN1CCC(OCC2CCCC2)CC1 ZINC000541351058 939495146 /nfs/dbraw/zinc/49/51/46/939495146.db2.gz HVJMAXTXAQNJOB-KRWDZBQOSA-N 0 3 401.469 4.116 20 0 HIADHN Clc1ccc(-n2cc(CNCCCc3nc4ccccc4[nH]3)nn2)cc1Cl ZINC000541392610 939503805 /nfs/dbraw/zinc/50/38/05/939503805.db2.gz IWFWSNRYIIEWQF-UHFFFAOYSA-N 0 3 401.301 4.173 20 0 HIADHN CN(C(=O)C(C)(C)Cc1nc2ccccc2[nH]1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000541539295 939547204 /nfs/dbraw/zinc/54/72/04/939547204.db2.gz FRFXFHDPQNYOAK-FQEVSTJZSA-N 0 3 404.558 4.255 20 0 HIADHN COc1cc(CN[C@H](CN2CCOCC2)c2ccccc2C)ccc1OC1CCCC1 ZINC000541542610 939548738 /nfs/dbraw/zinc/54/87/38/939548738.db2.gz PFKIFNSFHXKUPM-XMMPIXPASA-N 0 3 424.585 4.488 20 0 HIADHN Cc1cccc(N2CCN(CCCN[C@H](c3ccc(F)cc3)c3ccccn3)CC2)c1 ZINC000541547097 939551158 /nfs/dbraw/zinc/55/11/58/939551158.db2.gz PYFPQRSEFLMPRW-AREMUKBSSA-N 0 3 418.560 4.420 20 0 HIADHN COc1ccccc1CC(=O)N[C@H](c1ccc(F)c(F)c1)C(C)(C)N1CCCC1 ZINC000541552866 939553967 /nfs/dbraw/zinc/55/39/67/939553967.db2.gz SMQKFQDADVSHNS-JOCHJYFZSA-N 0 3 402.485 4.248 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)c2ccc(Sc3ccc(Cl)cc3)o2)CC1 ZINC000541575134 939558940 /nfs/dbraw/zinc/55/89/40/939558940.db2.gz UJFSUZSZGFXDLM-INIZCTEOSA-N 0 3 421.994 4.088 20 0 HIADHN Cc1ccsc1[C@@H](Cc1ccccc1)N[C@@H](C)C(=O)N1CC(=O)Nc2ccccc21 ZINC000541593708 939562334 /nfs/dbraw/zinc/56/23/34/939562334.db2.gz XIJNSBWWHOXQTR-FXAWDEMLSA-N 0 3 419.550 4.304 20 0 HIADHN COC[C@H](NCC(=O)N(Cc1ccccc1)c1nc2c(cccc2C)s1)C(C)C ZINC000541596018 939563029 /nfs/dbraw/zinc/56/30/29/939563029.db2.gz YOMOXJJRROZHLL-IBGZPJMESA-N 0 3 411.571 4.399 20 0 HIADHN c1ccc([C@H](NC2CCN(c3nc4ccccc4s3)CC2)c2cncnc2)cc1 ZINC000541740777 939618430 /nfs/dbraw/zinc/61/84/30/939618430.db2.gz CXNLPOARIVVFMM-QFIPXVFZSA-N 0 3 401.539 4.434 20 0 HIADHN C[C@@H](CC(=O)Nc1cccc(N2CCCC2)c1)NCc1cnc2ccc(Cl)cn12 ZINC000541772729 939626937 /nfs/dbraw/zinc/62/69/37/939626937.db2.gz KBQGKTONFYFYME-INIZCTEOSA-N 0 3 411.937 4.095 20 0 HIADHN O=C(NC[C@@]1(O)CCN(Cc2ccccc2)C1)Nc1cccc(C(F)F)c1Cl ZINC000541793025 939632739 /nfs/dbraw/zinc/63/27/39/939632739.db2.gz MBGDUSKCLMCOQI-FQEVSTJZSA-N 0 3 409.864 4.036 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N[C@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000541798038 939635457 /nfs/dbraw/zinc/63/54/57/939635457.db2.gz XVOIPJQNBCCYLW-ZCNNSNEGSA-N 0 3 417.550 4.244 20 0 HIADHN CCOc1cc(CNc2cccc(N(C)C)n2)ccc1OCC(=O)Nc1ccccc1 ZINC000541944662 939659612 /nfs/dbraw/zinc/65/96/12/939659612.db2.gz GKKNCNSUQQEIJD-UHFFFAOYSA-N 0 3 420.513 4.176 20 0 HIADHN COc1ccc([C@H](NC(=O)CN[C@@H](C)c2ccc(-n3ccnc3C)cc2)C(C)C)cc1 ZINC000541956675 939662815 /nfs/dbraw/zinc/66/28/15/939662815.db2.gz VXHHNRYGKDNOAU-AVRWGWEMSA-N 0 3 420.557 4.353 20 0 HIADHN OC[C@H]1CN(Cc2ccccc2)CC[C@H]1Nc1cnc2cc(Cl)c(Cl)cc2n1 ZINC000542042885 939697454 /nfs/dbraw/zinc/69/74/54/939697454.db2.gz PVBOUJRSUXWRLW-CRAIPNDOSA-N 0 3 417.340 4.232 20 0 HIADHN O[C@H](COc1ccc2ccccc2c1)CN1CCC[C@@H](n2ccc(C(F)(F)F)n2)C1 ZINC000542055070 939700701 /nfs/dbraw/zinc/70/07/01/939700701.db2.gz LTJZQRBERZJRBU-MOPGFXCFSA-N 0 3 419.447 4.132 20 0 HIADHN CC(C)(C)Oc1c(F)cc(NC(=O)[C@@H]2CCCN(Cc3cccnc3)C2)cc1F ZINC000542072117 939702797 /nfs/dbraw/zinc/70/27/97/939702797.db2.gz DIGWYOJOWZKZOZ-MRXNPFEDSA-N 0 3 403.473 4.388 20 0 HIADHN CC(C)(C)N1CC[C@H](NC(=O)c2[nH]nc3c2CCC3)[C@H]1c1ccc(Cl)c(F)c1 ZINC000542093664 939709023 /nfs/dbraw/zinc/70/90/23/939709023.db2.gz VGAAZYFNKWEAKU-PKOBYXMFSA-N 0 3 404.917 4.035 20 0 HIADHN Cc1[nH]c2c(cc(C)cc2CNC2CC(C(=O)OC(C)C)(C(=O)OC(C)C)C2)c1C ZINC000542146940 939730299 /nfs/dbraw/zinc/73/02/99/939730299.db2.gz HUTFLRCOVQKOEY-UHFFFAOYSA-N 0 3 414.546 4.235 20 0 HIADHN CCOC(=O)C1CCN(C(=O)C[C@H](C)N[C@@H](c2ccc(F)cc2F)C(C)(C)C)CC1 ZINC000542147725 939730732 /nfs/dbraw/zinc/73/07/32/939730732.db2.gz ITORYGNURSPOFT-BTYIYWSLSA-N 0 3 424.532 4.222 20 0 HIADHN CC(C)c1ccc([C@H](C)N2CCC(N(CC(F)(F)F)S(C)(=O)=O)CC2)cc1 ZINC000542279719 939783524 /nfs/dbraw/zinc/78/35/24/939783524.db2.gz BEWJAKMSAQGUJY-HNNXBMFYSA-N 0 3 406.514 4.159 20 0 HIADHN O=C(N[C@H]1CCCN(Cc2ccccc2)C1)[C@H]1CCn2c(cnc2C2CCCCC2)C1 ZINC000542328825 939801319 /nfs/dbraw/zinc/80/13/19/939801319.db2.gz MJIGJKPXGFDTGT-GOTSBHOMSA-N 0 3 420.601 4.274 20 0 HIADHN COc1cc(NC(C)=O)ccc1[C@@H](C)NCCOc1ccc(Br)cc1 ZINC000563737698 945273462 /nfs/dbraw/zinc/27/34/62/945273462.db2.gz FTLWHLLJOZOWGJ-CYBMUJFWSA-N 0 3 407.308 4.146 20 0 HIADHN Cc1ccnn1-c1ccccc1NC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C ZINC000542429397 939821203 /nfs/dbraw/zinc/82/12/03/939821203.db2.gz XSUMLMCUQYTIQO-FQEVSTJZSA-N 0 3 403.530 4.309 20 0 HIADHN Cc1ccccc1[C@@H](CN1CCOCC1)NCc1cccc(OCC(F)(F)F)c1 ZINC000542480236 939830591 /nfs/dbraw/zinc/83/05/91/939830591.db2.gz YTQWSJJRQCXIBM-OAQYLSRUSA-N 0 3 408.464 4.099 20 0 HIADHN Cc1nn(Cc2ccc(Cl)cc2)c(C)c1CN1CCC(OC[C@H]2CCOC2)CC1 ZINC000542485049 939831656 /nfs/dbraw/zinc/83/16/56/939831656.db2.gz GXQJRRSQXWVCFO-FQEVSTJZSA-N 0 3 417.981 4.219 20 0 HIADHN C[C@@H]1C[C@@H](CCN[C@@H](c2ccc(F)cc2)c2cccc(S(C)(=O)=O)c2)CCO1 ZINC000542486427 939831839 /nfs/dbraw/zinc/83/18/39/939831839.db2.gz IUJGBJLWCDHYPL-JLHGSKIFSA-N 0 3 405.535 4.113 20 0 HIADHN CCOc1ccc([C@H](CC)N[C@H]2CCCN(Cc3ccccn3)C2=O)cc1OCC ZINC000542498331 939832826 /nfs/dbraw/zinc/83/28/26/939832826.db2.gz JIUBGLDEUZGASA-SFTDATJTSA-N 0 3 411.546 4.111 20 0 HIADHN O=C1[C@@H](N[C@@H]2CCCc3ccc(Br)cc32)CCCN1Cc1ccccn1 ZINC000542499409 939833299 /nfs/dbraw/zinc/83/32/99/939833299.db2.gz PUFARURUSFSGDH-UXHICEINSA-N 0 3 414.347 4.002 20 0 HIADHN O=C(CN[C@H](c1cccs1)C1CC1)N1CCC[C@@H]1c1ccc2c(c1)OCCCO2 ZINC000542512040 939835160 /nfs/dbraw/zinc/83/51/60/939835160.db2.gz WSMBDHREMDXCOX-JPYJTQIMSA-N 0 3 412.555 4.314 20 0 HIADHN CC(C)[C@H]1OCCC[C@H]1CNCc1ncc(Br)cc1Br ZINC000542518206 939836296 /nfs/dbraw/zinc/83/62/96/939836296.db2.gz UCWLAEQFVAMIMZ-XHDPSFHLSA-N 0 3 406.162 4.147 20 0 HIADHN COc1ccc([C@H]2CCCN2C[C@@H](O)COc2cc(C)ccc2Cl)cc1OC ZINC000542520024 939836685 /nfs/dbraw/zinc/83/66/85/939836685.db2.gz GDZPERBMWYFKIC-IEBWSBKVSA-N 0 3 405.922 4.242 20 0 HIADHN O=C(CN[C@H](Cc1ccccc1)c1cccs1)Nc1ccc(Br)cn1 ZINC000542521382 939836960 /nfs/dbraw/zinc/83/69/60/939836960.db2.gz LSUNMDHMRZUCRR-MRXNPFEDSA-N 0 3 416.344 4.418 20 0 HIADHN Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)NC[C@H](O)COc1ccc2ccccc2c1 ZINC000542531953 939838614 /nfs/dbraw/zinc/83/86/14/939838614.db2.gz MMRPIQMVSVEFKP-LIRRHRJNSA-N 0 3 421.463 4.306 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@@H]1CCO[C@H](c2ccc(F)cc2)C1)c1ccsc1 ZINC000542537768 939839976 /nfs/dbraw/zinc/83/99/76/939839976.db2.gz NAZPTZVDCIDPED-NJYVYQBISA-N 0 3 419.566 4.490 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1)c1ccsc1 ZINC000542537765 939840003 /nfs/dbraw/zinc/84/00/03/939840003.db2.gz NAZPTZVDCIDPED-NJDAHSKKSA-N 0 3 419.566 4.490 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)N[C@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000542537868 939840071 /nfs/dbraw/zinc/84/00/71/939840071.db2.gz HQORVNFYMHRQTM-YTFSRNRJSA-N 0 3 411.521 4.182 20 0 HIADHN COCc1cccc(OCC2(CN[C@H](c3nnc4ccccn43)C(C)C)CCC2)c1 ZINC000542545769 939841655 /nfs/dbraw/zinc/84/16/55/939841655.db2.gz SRLVNHFAPVKYIX-QFIPXVFZSA-N 0 3 408.546 4.412 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)N[C@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000542547133 939841844 /nfs/dbraw/zinc/84/18/44/939841844.db2.gz WYFXNACKNIIGNL-RJGXRXQPSA-N 0 3 411.521 4.010 20 0 HIADHN COC[C@@H](NCC(=O)Nc1nc(-c2ccc(Cl)c(Cl)c2)cs1)C1CC1 ZINC000542548973 939842040 /nfs/dbraw/zinc/84/20/40/939842040.db2.gz WGQUCSRFBDPRSB-CQSZACIVSA-N 0 3 400.331 4.070 20 0 HIADHN Cc1cnc([C@H](C)CNC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)s1 ZINC000542572449 939845134 /nfs/dbraw/zinc/84/51/34/939845134.db2.gz GCAQYPIPSDETFJ-KUHUBIRLSA-N 0 3 411.493 4.126 20 0 HIADHN C[C@@H](NCC(=O)Nc1ccc(Br)cc1Cl)[C@@H]1COc2ccccc21 ZINC000542621074 939849476 /nfs/dbraw/zinc/84/94/76/939849476.db2.gz WNHFBQQUOVYTNJ-RISCZKNCSA-N 0 3 409.711 4.195 20 0 HIADHN CSc1ccc(CN(C)C(=O)CN(C)[C@H]2CCO[C@H](c3ccc(F)cc3)C2)cc1 ZINC000542626566 939850088 /nfs/dbraw/zinc/85/00/88/939850088.db2.gz IVXJXUAQJNEIQN-UNMCSNQZSA-N 0 3 416.562 4.358 20 0 HIADHN CC(C)(CNC(=O)Nc1csc(-c2ccccn2)n1)N1CCc2ccccc2C1 ZINC000542687954 939854254 /nfs/dbraw/zinc/85/42/54/939854254.db2.gz IPOYXPWWMNJUBX-UHFFFAOYSA-N 0 3 407.543 4.164 20 0 HIADHN CS[C@@H]1CN(C(=O)c2csc(-c3ccc(Cl)s3)n2)C[C@@H]1N1CCCC1 ZINC000542772625 939860026 /nfs/dbraw/zinc/86/00/26/939860026.db2.gz YCEASFWHYGHFDJ-GXTWGEPZSA-N 0 3 414.021 4.177 20 0 HIADHN CSC[C@H](NCCNC(=O)c1c(F)cccc1F)c1ccc(C(F)(F)F)cc1 ZINC000542844467 939862479 /nfs/dbraw/zinc/86/24/79/939862479.db2.gz SOXCFDKPTUDHJF-INIZCTEOSA-N 0 3 418.431 4.407 20 0 HIADHN CC(=O)Nc1ccc([C@@H](C)NCc2cc(Br)c3c(c2)OCCO3)cc1 ZINC000542848215 939862849 /nfs/dbraw/zinc/86/28/49/939862849.db2.gz YLCMNQZSGVXYAX-GFCCVEGCSA-N 0 3 405.292 4.030 20 0 HIADHN Cc1nn(-c2ccc(Br)cc2)c(NC(=O)N(CCN(C)C)C(C)C)c1C ZINC000542891456 939865569 /nfs/dbraw/zinc/86/55/69/939865569.db2.gz XXFNFCSKWQLFAR-UHFFFAOYSA-N 0 3 422.371 4.056 20 0 HIADHN C[C@@H]1[C@H](NC(=O)Nc2ccc(OC[C@H]3CCCO3)cc2)CCN1Cc1ccccc1 ZINC000563744672 945278817 /nfs/dbraw/zinc/27/88/17/945278817.db2.gz OTCHQNJUCMHEFR-SXSPYAJSSA-N 0 3 409.530 4.029 20 0 HIADHN Cc1ccc(C2CCN(C(=O)Nc3ccc(CCN4CCSCC4)cc3)CC2)cn1 ZINC000543037641 939900002 /nfs/dbraw/zinc/90/00/02/939900002.db2.gz VACAHHLMIWJTFQ-UHFFFAOYSA-N 0 3 424.614 4.393 20 0 HIADHN CCN(C(=O)CN1CCC(CCCn2ccnc2)CC1)[C@H](C)c1ccc(F)cc1 ZINC000543060850 939914327 /nfs/dbraw/zinc/91/43/27/939914327.db2.gz NIOUSMVAHLWBPD-LJQANCHMSA-N 0 3 400.542 4.124 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CNC(=O)CN[C@H](c1ccc(Cl)cc1)C1CC1 ZINC000543063751 939917225 /nfs/dbraw/zinc/91/72/25/939917225.db2.gz OOLIHIDTEDTYDD-DEOSSOPVSA-N 0 3 422.960 4.500 20 0 HIADHN C[C@@H](CC(=O)Nc1cccc(Cl)c1)N[C@H](CO)c1ccc(C(F)(F)F)cc1 ZINC000543072642 939924705 /nfs/dbraw/zinc/92/47/05/939924705.db2.gz MMMITJXMBDBTMR-YVEFUNNKSA-N 0 3 400.828 4.399 20 0 HIADHN Cc1ccc(CCCN2CCN(CCCc3nc(-c4cccs4)no3)CC2)cc1 ZINC000543137020 939965038 /nfs/dbraw/zinc/96/50/38/939965038.db2.gz IUGWDFYHUSDRTH-UHFFFAOYSA-N 0 3 410.587 4.290 20 0 HIADHN Cc1ccc(C[NH+]2CCCC2)cc1[N-]S(=O)(=O)c1ccc(OCC(F)F)cc1 ZINC000543146144 939971216 /nfs/dbraw/zinc/97/12/16/939971216.db2.gz BAORBILRCJAHHN-UHFFFAOYSA-N 0 3 410.486 4.036 20 0 HIADHN COc1cccc([C@@H]2C[C@H](C)CN2CC(=O)N2CCc3[nH]c4ccccc4c3C2)c1 ZINC000543181050 939987618 /nfs/dbraw/zinc/98/76/18/939987618.db2.gz IIDSSKUSTGHLNJ-XDHUDOTRSA-N 0 3 403.526 4.144 20 0 HIADHN Brc1cncc(CN2CCC[C@H](c3n[nH]c(C4CCCCC4)n3)C2)c1 ZINC000543182627 939988306 /nfs/dbraw/zinc/98/83/06/939988306.db2.gz WJNZYHNXECAZMA-INIZCTEOSA-N 0 3 404.356 4.390 20 0 HIADHN O=C1[C@@H](NCc2cccc(OCc3ccc(F)cc3)c2)CCCN1Cc1ccccn1 ZINC000543244542 940006701 /nfs/dbraw/zinc/00/67/01/940006701.db2.gz VLYFYVWKHSFQNH-DEOSSOPVSA-N 0 3 419.500 4.081 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)[C@@H]1CCn2c(cnc2C2CCCCC2)C1 ZINC000543268081 940013098 /nfs/dbraw/zinc/01/30/98/940013098.db2.gz MWNODGJRESGFAL-ISKFKSNPSA-N 0 3 420.601 4.447 20 0 HIADHN Cc1cc(NC(=O)N(CCN(C)C)Cc2cccc(Cl)c2)nn1[C@@H](C)C1CC1 ZINC000543319387 940028004 /nfs/dbraw/zinc/02/80/04/940028004.db2.gz KEFOQCRHDZPEBU-INIZCTEOSA-N 0 3 403.958 4.412 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3ccccc3-n3nccc3C)c(C)c2)CC1 ZINC000543350726 940038521 /nfs/dbraw/zinc/03/85/21/940038521.db2.gz BFMVGLFEWVYALS-UHFFFAOYSA-N 0 3 418.545 4.275 20 0 HIADHN CC[C@H]1CCC[C@@H](CN2CCN(CC(=O)Nc3ccccc3C(F)(F)F)CC2)C1 ZINC000543396790 940051031 /nfs/dbraw/zinc/05/10/31/940051031.db2.gz PYVFVFDEMYXLEW-ZWKOTPCHSA-N 0 3 411.512 4.478 20 0 HIADHN C[C@@H]1C[C@H](CCN[C@@H](c2cccc(S(C)(=O)=O)c2)c2ccc(F)c(F)c2)CCO1 ZINC000543419040 940058950 /nfs/dbraw/zinc/05/89/50/940058950.db2.gz NHKOWWREWMQRPZ-MCFFVMPBSA-N 0 3 423.525 4.253 20 0 HIADHN COC(=O)c1sccc1NC(=O)CN[C@H](Cc1ccccc1)c1cccs1 ZINC000543453795 940067695 /nfs/dbraw/zinc/06/76/95/940067695.db2.gz FJHLVRILHXPMHA-MRXNPFEDSA-N 0 3 400.525 4.108 20 0 HIADHN O=C(N[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000543464750 940072381 /nfs/dbraw/zinc/07/23/81/940072381.db2.gz MGPHSUKXTJMCME-DNVJHFABSA-N 0 3 411.521 4.010 20 0 HIADHN COc1ccc(C2(C(=O)N[C@H]3CCN([C@H](C)c4ccccc4)C3)CCC2)cc1OC ZINC000543470775 940074892 /nfs/dbraw/zinc/07/48/92/940074892.db2.gz LDZMDQSVLNEWJB-NQIIRXRSSA-N 0 3 408.542 4.077 20 0 HIADHN CC[C@H](NCC(=O)N1N=C(c2cc3ccccc3o2)C[C@H]1c1ccco1)[C@H]1CCCO1 ZINC000543494517 940083877 /nfs/dbraw/zinc/08/38/77/940083877.db2.gz KNZDDWLHQSBEKW-HFSMHLIXSA-N 0 3 421.497 4.251 20 0 HIADHN C[C@H](NCC(=O)Nc1ccc(Br)cc1F)[C@H]1Oc2ccccc2[C@H]1C ZINC000543545264 940102514 /nfs/dbraw/zinc/10/25/14/940102514.db2.gz SAKPFONVWCEGRH-UFYHVXEKSA-N 0 3 407.283 4.070 20 0 HIADHN C[C@@H](NCC(=O)Nc1nc(-c2ccc(F)c(F)c2)cs1)[C@@H]1COc2ccccc21 ZINC000543550515 940105551 /nfs/dbraw/zinc/10/55/51/940105551.db2.gz AFHSCOQQRZSYIL-DOMZBBRYSA-N 0 3 415.465 4.181 20 0 HIADHN CCCOc1ccc(CNC(=O)CN(C)[C@@H]2CCO[C@@H](c3ccc(F)cc3)C2)cc1 ZINC000543555803 940107009 /nfs/dbraw/zinc/10/70/09/940107009.db2.gz XIHHBYPHMDZYDR-FYYLOGMGSA-N 0 3 414.521 4.083 20 0 HIADHN Cc1ccccc1C1CCN(C(=O)NCc2ccccc2CN2CCC(O)CC2)CC1 ZINC000543668155 940155537 /nfs/dbraw/zinc/15/55/37/940155537.db2.gz NVLWMVHFCHVTJR-UHFFFAOYSA-N 0 3 421.585 4.041 20 0 HIADHN O=C(CN[C@@H](C[C@H]1CCOC1)c1ccccc1)Nc1cccc(Br)c1 ZINC000543704925 940166229 /nfs/dbraw/zinc/16/62/29/940166229.db2.gz SZUOPLGSGLPHCR-BEFAXECRSA-N 0 3 403.320 4.145 20 0 HIADHN COc1ccc(-c2nsc(NC(=O)N[C@H]3CCN([C@H](C)c4ccccc4)C3)n2)cc1 ZINC000563782577 945300810 /nfs/dbraw/zinc/30/08/10/945300810.db2.gz FMAWFJBUNGUTIS-QAPCUYQASA-N 0 3 423.542 4.171 20 0 HIADHN O=C(CCN1CCc2c(cccc2NC(=O)Nc2ccc(F)cc2)C1)N1CCCCC1 ZINC000543843086 940206269 /nfs/dbraw/zinc/20/62/69/940206269.db2.gz OOVCYUYFTQOOEF-UHFFFAOYSA-N 0 3 424.520 4.230 20 0 HIADHN CN1CC[C@@H](CNCc2ncc(Br)s2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000543848974 940207770 /nfs/dbraw/zinc/20/77/70/940207770.db2.gz DKPWVABTZKBDTH-MEDUHNTESA-N 0 3 418.763 4.481 20 0 HIADHN CN(C)c1ncc(CN[C@@H]2CCN(C(C)(C)C)[C@H]2c2ccc(Cl)c(F)c2)cn1 ZINC000543850668 940208572 /nfs/dbraw/zinc/20/85/72/940208572.db2.gz WGKWFWZKTZQPNN-MOPGFXCFSA-N 0 3 405.949 4.039 20 0 HIADHN Cn1nccc1[C@@H]1CCCCN1C(=O)N[C@H](CN1CCc2ccccc2C1)C(C)(C)C ZINC000543877254 940221692 /nfs/dbraw/zinc/22/16/92/940221692.db2.gz SLXOTRRVFAGZAS-XZOQPEGZSA-N 0 3 423.605 4.130 20 0 HIADHN COc1ccc(Cn2ccnc2SC[C@@H]2CN(Cc3ccccc3)CCCO2)cc1 ZINC000563800076 945304384 /nfs/dbraw/zinc/30/43/84/945304384.db2.gz HOZMLTBLSMRVNN-QHCPKHFHSA-N 0 3 423.582 4.323 20 0 HIADHN Cc1oc(-c2cccc(C(F)(F)F)c2)nc1C(=O)N1CC[C@H](N2CCCCC2)C1 ZINC000543938897 940255718 /nfs/dbraw/zinc/25/57/18/940255718.db2.gz NWYYVSUWQUWXQT-KRWDZBQOSA-N 0 3 407.436 4.369 20 0 HIADHN C[C@H](CC(=O)Nc1cccc(N2CCCC2)c1)NCc1cc(Cl)cc2c1OCC2 ZINC000543991399 940286541 /nfs/dbraw/zinc/28/65/41/940286541.db2.gz UJXBGHKHKCUUGT-MRXNPFEDSA-N 0 3 413.949 4.382 20 0 HIADHN C[C@@H]1CN(c2ccc(CN[C@H]3CCCc4c(Br)cccc43)cn2)CCO1 ZINC000544008402 940296136 /nfs/dbraw/zinc/29/61/36/940296136.db2.gz KUMLYLWUTZVTPU-QRWLVFNGSA-N 0 3 416.363 4.236 20 0 HIADHN C[C@@H]1CN(c2ccc(CN[C@@H]3CCCc4c(Br)cccc43)cn2)CCO1 ZINC000544008398 940296702 /nfs/dbraw/zinc/29/67/02/940296702.db2.gz KUMLYLWUTZVTPU-FOIQADDNSA-N 0 3 416.363 4.236 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)c2ccc(NC(=O)C(C)C)cc2)N(C)C)cc1 ZINC000563836062 945309608 /nfs/dbraw/zinc/30/96/08/945309608.db2.gz MTNHFQRSGUSSIK-QFIPXVFZSA-N 0 3 411.546 4.101 20 0 HIADHN COCC(=O)Nc1cccc(CN[C@@H]2CCCc3c(Br)cccc32)c1 ZINC000544009950 940297233 /nfs/dbraw/zinc/29/72/33/940297233.db2.gz OKSBZABEGICDON-LJQANCHMSA-N 0 3 403.320 4.201 20 0 HIADHN Cc1cccc(NC2CCN(C[C@@H](O)COc3ccccc3C(F)(F)F)CC2)c1 ZINC000544070721 940317319 /nfs/dbraw/zinc/31/73/19/940317319.db2.gz KLNJSJSOULTUFW-LJQANCHMSA-N 0 3 408.464 4.330 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)[C@@H]2CCn3c(cnc3C3CCCCC3)C2)CN1Cc1ccccc1 ZINC000544287533 940380097 /nfs/dbraw/zinc/38/00/97/940380097.db2.gz WKIIQAFJBMUQGV-PTUXOGIPSA-N 0 3 420.601 4.272 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(/C=C\c4ccc(F)c(Cl)c4)n3)cn2)CC1 ZINC000544396602 940411545 /nfs/dbraw/zinc/41/15/45/940411545.db2.gz LBOZVXLFEHZBRP-YWEYNIOJSA-N 0 3 413.884 4.236 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)N[C@@H]2CCO[C@H](c3ccc(F)cc3)C2)CN1Cc1ccccc1 ZINC000544427715 940425768 /nfs/dbraw/zinc/42/57/68/940425768.db2.gz UBQMCGXGYPTMCH-DZWOVHDNSA-N 0 3 411.521 4.008 20 0 HIADHN CCc1cnccc1[C@@H](C)NC[C@@H](NS(=O)(=O)c1ccc(C)cc1)c1ccccc1 ZINC000544451710 940436276 /nfs/dbraw/zinc/43/62/76/940436276.db2.gz QDAINYNQPVMNIE-NTKDMRAZSA-N 0 3 423.582 4.323 20 0 HIADHN Cc1ccc(SCCNC(=O)CN(C)[C@H]2CCO[C@@H](c3ccc(F)cc3)C2)cc1 ZINC000544525612 940471258 /nfs/dbraw/zinc/47/12/58/940471258.db2.gz KMSPAIBXJPQXKV-RBBKRZOGSA-N 0 3 416.562 4.195 20 0 HIADHN C[C@@H](NCC(=O)Nc1cccc(CSc2ccccn2)c1)[C@@H]1COc2ccccc21 ZINC000544523408 940471272 /nfs/dbraw/zinc/47/12/72/940471272.db2.gz ULCMGOXPCHREDN-UTKZUKDTSA-N 0 3 419.550 4.467 20 0 HIADHN COc1ccc(-c2csc(NC(=O)[C@H](C)N[C@H](C)[C@H]3COc4ccccc43)n2)cc1 ZINC000544526696 940471608 /nfs/dbraw/zinc/47/16/08/940471608.db2.gz BEMXBEOBQYLMEP-ZRGWGRIASA-N 0 3 423.538 4.300 20 0 HIADHN CC(C)(C)n1cc(CN2CC[C@@H](C(=O)N3CCCC3)C2)c(-c2ccccc2Cl)n1 ZINC000563916292 945324000 /nfs/dbraw/zinc/32/40/00/945324000.db2.gz SPNTUKNZYFMLCZ-QGZVFWFLSA-N 0 3 414.981 4.403 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1csc(-c2ccccn2)n1 ZINC000544599110 940487612 /nfs/dbraw/zinc/48/76/12/940487612.db2.gz SZKPNPWHAPEXKN-QGZVFWFLSA-N 0 3 407.543 4.333 20 0 HIADHN O=C(CCNCc1ccc(F)cc1C(F)(F)F)Nc1ccc(N2CCCC2=O)cc1 ZINC000563923902 945326965 /nfs/dbraw/zinc/32/69/65/945326965.db2.gz VTCKALJYKFHUIM-UHFFFAOYSA-N 0 3 423.410 4.090 20 0 HIADHN CN(C)Cc1cccc(C(=O)N2CCC(Oc3cccc(Br)c3)CC2)c1 ZINC000544779531 940513260 /nfs/dbraw/zinc/51/32/60/940513260.db2.gz UDSSOSJZLAOUEE-UHFFFAOYSA-N 0 3 417.347 4.194 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N[C@@H](C3CCCC3)C(F)(F)F)c(C)c2)CC1 ZINC000544786311 940514016 /nfs/dbraw/zinc/51/40/16/940514016.db2.gz XUFYDACOHQHCQG-IBGZPJMESA-N 0 3 412.500 4.380 20 0 HIADHN COC(=O)[C@H](C)Cc1ccc(NC(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)cc1 ZINC000544797968 940515082 /nfs/dbraw/zinc/51/50/82/940515082.db2.gz GXBXOAJEWCYWSE-WOJBJXKFSA-N 0 3 423.557 4.167 20 0 HIADHN COC(=O)[C@@H](C)Cc1ccc(NC(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000544802052 940515563 /nfs/dbraw/zinc/51/55/63/940515563.db2.gz XEUICUNSQNEAOX-CVDCTZTESA-N 0 3 423.557 4.167 20 0 HIADHN CCN(C(=O)c1ccc(NC(=O)[C@@H]2C[C@@H]2C)cc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000544871734 940520658 /nfs/dbraw/zinc/52/06/58/940520658.db2.gz LWNVWQICWVSSQS-CDNPAEQRSA-N 0 3 405.542 4.018 20 0 HIADHN Fc1cccc(CN2CCC[C@H](c3nc(-c4ccc(N5CCOCC5)cc4)no3)C2)c1 ZINC000544910014 940524293 /nfs/dbraw/zinc/52/42/93/940524293.db2.gz OIANUBWJTIQYIG-FQEVSTJZSA-N 0 3 422.504 4.092 20 0 HIADHN Fc1cccc(CN2CCC[C@H](c3nc(CCn4cnc5ccccc54)no3)C2)c1 ZINC000544923394 940525726 /nfs/dbraw/zinc/52/57/26/940525726.db2.gz QDJPDEYTOZROLP-SFHVURJKSA-N 0 3 405.477 4.181 20 0 HIADHN CS[C@H]1CN(C(=O)Nc2ccc(Oc3ccc(Cl)cn3)cc2)C[C@H]1N(C)C ZINC000545421958 940569106 /nfs/dbraw/zinc/56/91/06/940569106.db2.gz LZOAOVBAQLQDGO-SJORKVTESA-N 0 3 406.939 4.037 20 0 HIADHN COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)cc1 ZINC000545430223 940569490 /nfs/dbraw/zinc/56/94/90/940569490.db2.gz ZRANWUFTSULFMR-FXAWDEMLSA-N 0 3 412.505 4.028 20 0 HIADHN CCN(C(=O)c1ccc(OC)c(OC(F)F)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000545476181 940571396 /nfs/dbraw/zinc/57/13/96/940571396.db2.gz NGZARNVVSUIXQP-GOSISDBHSA-N 0 3 404.457 4.033 20 0 HIADHN CCCN1CCN(c2ccccc2CNCc2nc3ccccc3n2C2CC2)CC1 ZINC000545554260 940574555 /nfs/dbraw/zinc/57/45/55/940574555.db2.gz OIFBQGHXDYFVPK-UHFFFAOYSA-N 0 3 403.574 4.193 20 0 HIADHN c1cnn(-c2ccccc2-c2noc(-c3ccc(CN4CCSCC4)cc3)n2)c1 ZINC000545660281 940579335 /nfs/dbraw/zinc/57/93/35/940579335.db2.gz RJYWKOCEIVUBDB-UHFFFAOYSA-N 0 3 403.511 4.138 20 0 HIADHN c1cnn(-c2cccc(-c3noc(-c4ccc(CN5CCSCC5)cc4)n3)c2)c1 ZINC000545690930 940580967 /nfs/dbraw/zinc/58/09/67/940580967.db2.gz XAYMEIOMTPOVOH-UHFFFAOYSA-N 0 3 403.511 4.138 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)c1cc(C)n(-c2ccccc2Cl)n1)c1ccco1 ZINC000563986683 945337028 /nfs/dbraw/zinc/33/70/28/945337028.db2.gz YITRQORCMVQIBC-KBXCAEBGSA-N 0 3 400.910 4.286 20 0 HIADHN Cc1cc(C(=O)N(CCN(C)C)Cc2cccc(Cl)c2)c(C)n1Cc1ccncc1 ZINC000545869330 940644945 /nfs/dbraw/zinc/64/49/45/940644945.db2.gz GNVZHAPGICSXRR-UHFFFAOYSA-N 0 3 424.976 4.406 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)CCc1cc(Br)ccc1F)c1ccco1 ZINC000563989528 945337348 /nfs/dbraw/zinc/33/73/48/945337348.db2.gz VZUUUUQYZUYRGN-GUYCJALGSA-N 0 3 411.315 4.359 20 0 HIADHN Cc1ccc(C(=O)CCCCC(=O)N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)cc1 ZINC000546081868 940694258 /nfs/dbraw/zinc/69/42/58/940694258.db2.gz KGDJHJGKXLPNGB-OYRHEFFESA-N 0 3 414.590 4.086 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3scnc3C3CCCC3)CC2)C[C@@H](C)O1 ZINC000546146755 940712797 /nfs/dbraw/zinc/71/27/97/940712797.db2.gz VCQCYHWKJMUSCH-IAGOWNOFSA-N 0 3 405.608 4.152 20 0 HIADHN C[C@H]1CN(c2ccc(CN[C@H](Cc3cccnc3)c3ccc(Cl)cc3)cn2)CCO1 ZINC000546164280 940719379 /nfs/dbraw/zinc/71/93/79/940719379.db2.gz FWKLVXYWJMVNJD-FDDCHVKYSA-N 0 3 422.960 4.429 20 0 HIADHN CCN(C(=O)c1ccc(OC)c(Br)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000546184259 940724289 /nfs/dbraw/zinc/72/42/89/940724289.db2.gz JBBWCBRRVQWXNF-GOSISDBHSA-N 0 3 417.347 4.194 20 0 HIADHN CCN(C(=O)c1ccc(OCc2ccccn2)cc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000546199663 940727882 /nfs/dbraw/zinc/72/78/82/940727882.db2.gz WNSMYFFFRLEOKK-XMMPIXPASA-N 0 3 415.537 4.397 20 0 HIADHN CC[C@@H](Oc1ccccc1C)c1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1 ZINC000546357154 940800953 /nfs/dbraw/zinc/80/09/53/940800953.db2.gz UNNVZSXSYSPAHZ-LJQANCHMSA-N 0 3 407.518 4.112 20 0 HIADHN C[C@@H](CCc1ccccc1F)c1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1 ZINC000546362869 940802338 /nfs/dbraw/zinc/80/23/38/940802338.db2.gz KCAOHIPNGGYTSB-KRWDZBQOSA-N 0 3 409.509 4.149 20 0 HIADHN Cc1cc(C(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)c(C)n1Cc1ccncc1 ZINC000546562875 940854466 /nfs/dbraw/zinc/85/44/66/940854466.db2.gz NHDGOSAMOGTOSW-HXUWFJFHSA-N 0 3 416.569 4.285 20 0 HIADHN C[C@@](O)(C1CCN(CCC(=O)Nc2cccc(C(F)(F)F)c2)CC1)C(F)(F)F ZINC000546638886 940863852 /nfs/dbraw/zinc/86/38/52/940863852.db2.gz JQTKXICGRUIDFW-MRXNPFEDSA-N 0 3 412.374 4.059 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N3CCc4c3cccc4C(F)(F)F)cc2)CC1 ZINC000546858924 940896846 /nfs/dbraw/zinc/89/68/46/940896846.db2.gz SOPFKBMNBDFRHD-UHFFFAOYSA-N 0 3 403.448 4.050 20 0 HIADHN CC(C)Cc1ccc([C@H](CNC(=O)[C@@H]2CCc3nc(C(C)C)[nH]c3C2)N(C)C)cc1 ZINC000564030240 945358193 /nfs/dbraw/zinc/35/81/93/945358193.db2.gz VJCNIHBGHNAWDJ-OFNKIYASSA-N 0 3 410.606 4.256 20 0 HIADHN COc1ccc(C[C@@H](C)CN2CCCN(C(=O)c3ccccc3F)CC2)cc1F ZINC000547014065 940957199 /nfs/dbraw/zinc/95/71/99/940957199.db2.gz SIPRAYHYJJBCCP-QGZVFWFLSA-N 0 3 402.485 4.000 20 0 HIADHN COc1ccc2nc(-c3noc([C@@H]4CCCN(Cc5cccnc5)C4)n3)ccc2c1 ZINC000547043061 940971899 /nfs/dbraw/zinc/97/18/99/940971899.db2.gz HOVAUXSZOSAEJF-GOSISDBHSA-N 0 3 401.470 4.068 20 0 HIADHN CC[C@H](Cc1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1)c1ccc(OC)cc1 ZINC000547073842 940984820 /nfs/dbraw/zinc/98/48/20/940984820.db2.gz AQJFXPVMTGUMPZ-GOSISDBHSA-N 0 3 421.545 4.018 20 0 HIADHN COc1ccc(COCc2noc(-c3ccc(CN4CCSCC4)cc3)n2)cc1 ZINC000547094062 940992823 /nfs/dbraw/zinc/99/28/23/940992823.db2.gz QEMSPVBKPXLUOX-UHFFFAOYSA-N 0 3 411.527 4.011 20 0 HIADHN CC(C)NC(=O)Nc1ccc(-c2noc([C@H]3CCCN(Cc4cccnc4)C3)n2)cc1 ZINC000547108495 940999700 /nfs/dbraw/zinc/99/97/00/940999700.db2.gz DMNPCQSBGAIZIE-IBGZPJMESA-N 0 3 420.517 4.041 20 0 HIADHN Cn1ccc([C@@H](NC(=O)c2cccc(CN3CCCC3)c2)c2ccc(Cl)cc2)n1 ZINC000547257923 941045602 /nfs/dbraw/zinc/04/56/02/941045602.db2.gz BYJHNZOVCAZKBK-QFIPXVFZSA-N 0 3 408.933 4.189 20 0 HIADHN COC(=O)c1cn([C@H]2CCCN(Cc3ccc(-c4ccccc4Cl)s3)C2)nn1 ZINC000547283304 941051675 /nfs/dbraw/zinc/05/16/75/941051675.db2.gz KEUBTUHYRZYZNW-AWEZNQCLSA-N 0 3 416.934 4.284 20 0 HIADHN COc1ccc([C@H](CNC(=O)Nc2ccc(OC)c3cccnc23)N2CCCC2)cc1 ZINC000547453396 941063588 /nfs/dbraw/zinc/06/35/88/941063588.db2.gz RRDNIEJULWNOIW-NRFANRHFSA-N 0 3 420.513 4.211 20 0 HIADHN CC1(C)Cc2cccc(NC(=O)NC3CC(N4CCC(C(F)(F)F)CC4)C3)c2O1 ZINC000548090743 941086462 /nfs/dbraw/zinc/08/64/62/941086462.db2.gz KSPAGMXEVWDCBU-UHFFFAOYSA-N 0 3 411.468 4.327 20 0 HIADHN COc1cccc([C@H](CNC(=O)N[C@H](C(C)(C)C)C(F)(F)F)N2CCCC2)c1 ZINC000548181041 941091021 /nfs/dbraw/zinc/09/10/21/941091021.db2.gz MUPYJISAJBTCIF-DLBZAZTESA-N 0 3 401.473 4.108 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)N[C@@H]1CCOc2ccc(F)cc21 ZINC000548409036 941100890 /nfs/dbraw/zinc/10/08/90/941100890.db2.gz BXJCDWWCIXQFHQ-HXUWFJFHSA-N 0 3 415.534 4.062 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)N[C@H]1CCOc2ccc(F)cc21 ZINC000548409035 941100995 /nfs/dbraw/zinc/10/09/95/941100995.db2.gz BXJCDWWCIXQFHQ-FQEVSTJZSA-N 0 3 415.534 4.062 20 0 HIADHN COc1cccc(C2CCN(C(=O)NC[C@@H](c3cccs3)N3CCCC3)CC2)c1 ZINC000548683384 941119310 /nfs/dbraw/zinc/11/93/10/941119310.db2.gz IBRUZHSLVCDILA-NRFANRHFSA-N 0 3 413.587 4.483 20 0 HIADHN CC(=O)[C@@H]1C[C@H](C(=O)N(C[C@@H]2CCN(Cc3ccccc3)C2)CC(F)(F)F)C1(C)C ZINC000548695429 941119803 /nfs/dbraw/zinc/11/98/03/941119803.db2.gz PZWAQVJWUANLRN-HSALFYBXSA-N 0 3 424.507 4.151 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccnc2)C1)N1CC[C@H](C(F)(F)F)c2ccccc21 ZINC000548773545 941123197 /nfs/dbraw/zinc/12/31/97/941123197.db2.gz NYYCAKUHPGDZHI-MJGOQNOKSA-N 0 3 403.448 4.376 20 0 HIADHN O=C([C@H]1CCCN(Cc2cccnc2)C1)N1CC[C@H](C(F)(F)F)c2ccccc21 ZINC000548773543 941123256 /nfs/dbraw/zinc/12/32/56/941123256.db2.gz NYYCAKUHPGDZHI-HKUYNNGSSA-N 0 3 403.448 4.376 20 0 HIADHN CCN1CCN(Cc2ccc(CNC(=O)NCc3cc4ccccc4s3)cc2)CC1 ZINC000548921393 941129309 /nfs/dbraw/zinc/12/93/09/941129309.db2.gz CVWDSGQFRBUQJY-UHFFFAOYSA-N 0 3 422.598 4.038 20 0 HIADHN Nc1nccc([C@H]2CCCN(Cc3c(-c4ccc(Cl)cc4)nc4sccn34)C2)n1 ZINC000548936055 941130922 /nfs/dbraw/zinc/13/09/22/941130922.db2.gz IQRAPYDHHBDTOV-HNNXBMFYSA-N 0 3 424.961 4.468 20 0 HIADHN COc1cc2c(cc1F)CC[C@@H]2NC(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000549100867 941158898 /nfs/dbraw/zinc/15/88/98/941158898.db2.gz LKIPNEFPDAMUKI-ZWKOTPCHSA-N 0 3 403.523 4.019 20 0 HIADHN CC[C@H](C)C(=O)Nc1cccc(CNC[C@@H](O)CO[C@@H]2CCCc3ccccc32)c1 ZINC000549159589 941167151 /nfs/dbraw/zinc/16/71/51/941167151.db2.gz YWDLRMONGRRXQU-KUWBRRTOSA-N 0 3 410.558 4.216 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)cc1 ZINC000549231491 941172728 /nfs/dbraw/zinc/17/27/28/941172728.db2.gz OQYYLPLXGZWGOP-MGPUTAFESA-N 0 3 416.953 4.293 20 0 HIADHN CN(C)C[C@@H](NC(=O)Cc1coc(-c2ccc(F)cc2)n1)c1ccc(Cl)cc1 ZINC000549232617 941172743 /nfs/dbraw/zinc/17/27/43/941172743.db2.gz KETQCLODGJFEFQ-LJQANCHMSA-N 0 3 401.869 4.096 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@@H](N[C@@H](Cc2nc(C)no2)c2ccccc2)c2ccccc21 ZINC000549236914 941173034 /nfs/dbraw/zinc/17/30/34/941173034.db2.gz HSYILWCHZSGBAG-VSKRKVRLSA-N 0 3 405.498 4.433 20 0 HIADHN Cc1cc(C)n(-c2ccc(CC(=O)N[C@@H](CN(C)C)c3ccc(Cl)cc3)cc2)n1 ZINC000549246304 941173879 /nfs/dbraw/zinc/17/38/79/941173879.db2.gz YBENIWRNBTZGNK-QFIPXVFZSA-N 0 3 410.949 4.104 20 0 HIADHN CC(C)c1noc(Cc2ccc(NC(=O)N[C@H]3CCN(Cc4ccccc4)C3)cc2)n1 ZINC000549369045 941183336 /nfs/dbraw/zinc/18/33/36/941183336.db2.gz YWJBIMWIOKDHNH-NRFANRHFSA-N 0 3 419.529 4.180 20 0 HIADHN CC(C)c1noc(Cc2ccc(NC(=O)NC[C@H](c3ccccc3)N(C)C)cc2)n1 ZINC000549381318 941184518 /nfs/dbraw/zinc/18/45/18/941184518.db2.gz DXGWXOBWQSNLCW-HXUWFJFHSA-N 0 3 407.518 4.208 20 0 HIADHN Cc1nn(-c2ccccn2)c(C)c1CN1CCCN(Cc2ccc(Cl)cc2)CC1 ZINC000549385034 941184779 /nfs/dbraw/zinc/18/47/79/941184779.db2.gz IOEPFIWJWUDIMH-UHFFFAOYSA-N 0 3 409.965 4.245 20 0 HIADHN CCOC(=O)c1csc(C2CCN(Cc3ccc(C)cc3-c3ccnn3C)CC2)n1 ZINC000549406698 941186876 /nfs/dbraw/zinc/18/68/76/941186876.db2.gz MBZMORSWVLEPMS-UHFFFAOYSA-N 0 3 424.570 4.408 20 0 HIADHN CC(C)[C@H](NCC(=O)N1CCO[C@@H](c2ccc(F)cc2)C1)c1ccc(Cl)cc1 ZINC000549466636 941192762 /nfs/dbraw/zinc/19/27/62/941192762.db2.gz XOMTYKZCIIQXHY-IRLDBZIGSA-N 0 3 404.913 4.366 20 0 HIADHN COc1ccc(C)cc1NC(=O)CN[C@@H]1CCN(C(C)C)[C@@H]1c1ccc(F)c(F)c1 ZINC000549475049 941194217 /nfs/dbraw/zinc/19/42/17/941194217.db2.gz CBEMRTCSFFRRQH-AUSIDOKSSA-N 0 3 417.500 4.034 20 0 HIADHN CCN1CC[C@H](N[C@@H](C)C(=O)Nc2ccc(C)cc2C)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000549476058 941194279 /nfs/dbraw/zinc/19/42/79/941194279.db2.gz HPJMTZVLHARJHI-LVWPNOBMSA-N 0 3 419.491 4.473 20 0 HIADHN CCN1CC[C@H](NCC(=O)Nc2cc(C)ccc2C)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000549476154 941194418 /nfs/dbraw/zinc/19/44/18/941194418.db2.gz JLZKLLWHSLRJMH-AVRDEDQJSA-N 0 3 405.464 4.084 20 0 HIADHN CCN1CC[C@@H](NCC(=O)Nc2ccc(C)cc2C)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000549477106 941194487 /nfs/dbraw/zinc/19/44/87/941194487.db2.gz QUDRAZLZBUCPHT-DENIHFKCSA-N 0 3 405.464 4.084 20 0 HIADHN COc1ccc(NC(=O)[C@H](C)N[C@@H]2CCN(C(C)C)[C@@H]2c2ccc(F)c(F)c2)cc1 ZINC000549476918 941194604 /nfs/dbraw/zinc/19/46/04/941194604.db2.gz OPTDLALRZTWKSU-ITEAAPOESA-N 0 3 417.500 4.114 20 0 HIADHN CCN1CC[C@H](NCC(=O)Nc2ccc(C)cc2C)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000549477109 941194640 /nfs/dbraw/zinc/19/46/40/941194640.db2.gz QUDRAZLZBUCPHT-UGKGYDQZSA-N 0 3 405.464 4.084 20 0 HIADHN Cc1nn(C(C)(C)C)cc1[C@H](C)NC(=O)N[C@H](CN(C)C)c1ccc(Cl)cc1 ZINC000549493766 941196233 /nfs/dbraw/zinc/19/62/33/941196233.db2.gz VPUQAWSSVVRFBQ-IFXJQAMLSA-N 0 3 405.974 4.263 20 0 HIADHN CCC[C@@H]1CN(c2nnc(C3CCC3)n2C[C@@H]2CCOC2)CCN1Cc1ccccc1 ZINC000549594393 941200676 /nfs/dbraw/zinc/20/06/76/941200676.db2.gz GNKTVQJFOWRRKD-JTHBVZDNSA-N 0 3 423.605 4.073 20 0 HIADHN CN(C)C[C@@H](NC(=O)Cn1c2ccccc2nc1C(F)(F)F)c1ccc(Cl)cc1 ZINC000549615346 941201465 /nfs/dbraw/zinc/20/14/65/941201465.db2.gz DEQSRLNSRZNOKC-MRXNPFEDSA-N 0 3 424.854 4.128 20 0 HIADHN CN(C)C[C@@H](NC(=O)c1ccc(CNC(=O)C(C)(C)C)cc1)c1ccc(Cl)cc1 ZINC000549617613 941201545 /nfs/dbraw/zinc/20/15/45/941201545.db2.gz RTGYNHMTWMDMBS-HXUWFJFHSA-N 0 3 415.965 4.035 20 0 HIADHN CC[C@H](N[C@H]1CCN([C@@H](C)c2ccc(F)cc2)C1=O)c1ccc(OC)c(OC)c1 ZINC000549708901 941205335 /nfs/dbraw/zinc/20/53/35/941205335.db2.gz HADSLQKCQKRZKB-YSSFQJQWSA-N 0 3 400.494 4.246 20 0 HIADHN O=C(c1ccc(-c2ccc3c(c2)OCCO3)s1)N1CCCN(CC2CCC2)CC1 ZINC000549729231 941205838 /nfs/dbraw/zinc/20/58/38/941205838.db2.gz KRKLHRQRCBQFMV-UHFFFAOYSA-N 0 3 412.555 4.134 20 0 HIADHN Cc1nn(-c2ccccc2)c2sc(C(=O)N3CCCN(CC4CCC4)CC3)cc12 ZINC000549732417 941205921 /nfs/dbraw/zinc/20/59/21/941205921.db2.gz KJCQAKGIKAFKEX-UHFFFAOYSA-N 0 3 408.571 4.343 20 0 HIADHN Cc1nn(-c2ccccn2)c(C)c1CN1CCC(CN2CCc3ccccc32)CC1 ZINC000549802711 941207761 /nfs/dbraw/zinc/20/77/61/941207761.db2.gz XQDJEVAJLYDOLZ-UHFFFAOYSA-N 0 3 401.558 4.159 20 0 HIADHN Cc1ccc(CN(CCO)Cc2cc(Br)cs2)c(-c2ccnn2C)c1 ZINC000549809911 941208057 /nfs/dbraw/zinc/20/80/57/941208057.db2.gz SWBJFMYUJXBTBW-UHFFFAOYSA-N 0 3 420.376 4.214 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)[C@@H](C)Cc2cnc3ccccc3n2)N2CCCC2)cc1 ZINC000549886723 941228298 /nfs/dbraw/zinc/22/82/98/941228298.db2.gz XRFNVEJFRFCBNN-YADARESESA-N 0 3 402.542 4.070 20 0 HIADHN COCCc1ccc(OC[C@H](O)CN2CC=C(c3c[nH]c4cc(F)ccc43)CC2)cc1 ZINC000549899882 941233469 /nfs/dbraw/zinc/23/34/69/941233469.db2.gz WXVAFDRNVGOSNB-OAQYLSRUSA-N 0 3 424.516 4.025 20 0 HIADHN CCN(C(=O)c1ccc2c(c1)NC(=O)C2(C)C)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000549931222 941241774 /nfs/dbraw/zinc/24/17/74/941241774.db2.gz HYPCJTYAPBFYCY-XLIONFOSSA-N 0 3 405.542 4.214 20 0 HIADHN C[C@@H]1CCCCN1CCC(=O)Nc1cccc(CS(=O)(=O)Cc2ccccc2)c1 ZINC000550160191 941291733 /nfs/dbraw/zinc/29/17/33/941291733.db2.gz VVBLGSSFUGBHRC-LJQANCHMSA-N 0 3 414.571 4.005 20 0 HIADHN CN1CCN(C[C@@H](N[C@@H]2CCc3sc(Br)cc32)c2ccccc2)CC1 ZINC000550644659 941349083 /nfs/dbraw/zinc/34/90/83/941349083.db2.gz WPIABXQZWHDJTB-QZTJIDSGSA-N 0 3 420.420 4.076 20 0 HIADHN COC(=O)CCC[C@@H]1CCC[C@@H](N[C@H](c2nc(-c3ccncc3)no2)C(C)C)C1 ZINC000550643666 941349116 /nfs/dbraw/zinc/34/91/16/941349116.db2.gz CISNPYREXHZXQU-HQRMLTQVSA-N 0 3 400.523 4.320 20 0 HIADHN C[C@@H]1CN(c2ccccc2CNCc2ccc(OCc3ccccn3)cc2)CCO1 ZINC000550758807 941363837 /nfs/dbraw/zinc/36/38/37/941363837.db2.gz SXZOAONJWBDXHW-HXUWFJFHSA-N 0 3 403.526 4.176 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)N[C@H]1CCc2ccccc2C1 ZINC000550805593 941368975 /nfs/dbraw/zinc/36/89/75/941368975.db2.gz DOFJRCXSIUFKSY-NRFANRHFSA-N 0 3 419.491 4.336 20 0 HIADHN COc1ccc([C@@H](C)NCCCS(=O)(=O)c2ccc(Cl)cc2)c(C)c1OC ZINC000550938777 941383576 /nfs/dbraw/zinc/38/35/76/941383576.db2.gz HFCSHTXKTKVHPP-OAHLLOKOSA-N 0 3 411.951 4.180 20 0 HIADHN O[C@@H](CNCc1ccccc1OCC(F)(F)F)COc1cccc2ccccc21 ZINC000551000257 941392967 /nfs/dbraw/zinc/39/29/67/941392967.db2.gz KGEFSIRXFXLBJE-SFHVURJKSA-N 0 3 405.416 4.310 20 0 HIADHN O[C@H](CNCc1cc(F)cc(Br)c1)COc1ccc2ccccc2c1 ZINC000551007945 941394157 /nfs/dbraw/zinc/39/41/57/941394157.db2.gz QXUKMNIXUSVNDB-LJQANCHMSA-N 0 3 404.279 4.271 20 0 HIADHN C[C@H](c1ccccc1F)N1CCC[C@H](N[C@@H](C)c2ccc3c(c2)CCC(=O)N3)C1=O ZINC000551242886 941434595 /nfs/dbraw/zinc/43/45/95/941434595.db2.gz XYPCTHNARNXKSP-DMPWYTOCSA-N 0 3 409.505 4.113 20 0 HIADHN CC(C)(CN[C@H](c1c[nH]nn1)c1ccc(F)cc1)c1ccc(Br)cc1 ZINC000551264662 941438688 /nfs/dbraw/zinc/43/86/88/941438688.db2.gz CPCCDICIXAXMRV-SFHVURJKSA-N 0 3 403.299 4.363 20 0 HIADHN C[C@H](N[C@@H]1CCCN([C@@H](C)c2ccc(F)cc2)C1=O)c1ccc(-n2cccn2)cc1 ZINC000551274800 941441432 /nfs/dbraw/zinc/44/14/32/941441432.db2.gz NFTBDBWZAJZLQO-IUKKYPGJSA-N 0 3 406.505 4.414 20 0 HIADHN CCS(=O)(=O)Nc1ccc([C@H](C)N[C@@H](C)c2ccc(-n3cccn3)c(F)c2)cc1 ZINC000551274844 941441707 /nfs/dbraw/zinc/44/17/07/941441707.db2.gz WTNARBFUIGPODN-HOTGVXAUSA-N 0 3 416.522 4.185 20 0 HIADHN CCc1nc(C)c(C(=O)NC[C@@H]2CCCN(C)[C@H]2c2ccc(C(F)(F)F)cc2)o1 ZINC000551289676 941444453 /nfs/dbraw/zinc/44/44/53/941444453.db2.gz TZUFQZNEGYNXBW-YJBOKZPZSA-N 0 3 409.452 4.377 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)Cn1c2ccccc2nc1C1CCCCC1 ZINC000551323097 941452292 /nfs/dbraw/zinc/45/22/92/941452292.db2.gz SHKJDKVSSAQMPG-UHFFFAOYSA-N 0 3 419.573 4.069 20 0 HIADHN CCc1ccc(-c2noc([C@@H](C)NC[C@H]3CN(Cc4ccccc4)CCCO3)n2)cc1 ZINC000551394865 941469067 /nfs/dbraw/zinc/46/90/67/941469067.db2.gz IDGOENUPXZEDCW-XXBNENTESA-N 0 3 420.557 4.241 20 0 HIADHN Cc1c(Cl)cc(F)c(NC(=O)CCCN2CCN(c3ccccc3)CC2)c1F ZINC000551413862 941473909 /nfs/dbraw/zinc/47/39/09/941473909.db2.gz RFTGNXMXMXJHEY-UHFFFAOYSA-N 0 3 407.892 4.468 20 0 HIADHN Cc1n[nH]cc1C1CCN(CCC(=O)Nc2ccccc2C(=O)c2ccccc2)CC1 ZINC000551423024 941476144 /nfs/dbraw/zinc/47/61/44/941476144.db2.gz HSHRJWLIRSKCPN-UHFFFAOYSA-N 0 3 416.525 4.157 20 0 HIADHN O=C1CCN1c1cccc(-c2noc([C@@H]3CN(Cc4ccccc4)CCC3(F)F)n2)c1 ZINC000551439919 941479714 /nfs/dbraw/zinc/47/97/14/941479714.db2.gz QJEHCPOHMMRICP-IBGZPJMESA-N 0 3 424.451 4.098 20 0 HIADHN CN(C(=O)c1ccc(NCc2csc(C(C)(C)C)n2)cc1)[C@@H]1CCCN(C)C1 ZINC000551446593 941480609 /nfs/dbraw/zinc/48/06/09/941480609.db2.gz VIJWGSQXRUHSOX-LJQANCHMSA-N 0 3 400.592 4.219 20 0 HIADHN CN(C(=O)c1ccc(NCc2cccc(OC(F)(F)F)c2)cc1)[C@@H]1CCCN(C)C1 ZINC000551446572 941480867 /nfs/dbraw/zinc/48/08/67/941480867.db2.gz UPULMFUMJAIZDO-LJQANCHMSA-N 0 3 421.463 4.364 20 0 HIADHN COc1ccc([C@H](CN(C)C)N[C@@H](C)c2ccc(I)cc2)cc1 ZINC000551555404 941500381 /nfs/dbraw/zinc/50/03/81/941500381.db2.gz XHKOYOSHFWWOFQ-LIRRHRJNSA-N 0 3 424.326 4.253 20 0 HIADHN Cc1c(Br)cc(CNCc2ccc(CO)c(F)c2)cc1Br ZINC000551560906 941501585 /nfs/dbraw/zinc/50/15/85/941501585.db2.gz MVTFSIXXYHMQTQ-UHFFFAOYSA-N 0 3 417.116 4.441 20 0 HIADHN COC(=O)COc1ccc(CNCc2cnc(-c3ccc(Cl)cc3)s2)cc1 ZINC000551585991 941507284 /nfs/dbraw/zinc/50/72/84/941507284.db2.gz JJWWGNMLPHPVIQ-UHFFFAOYSA-N 0 3 402.903 4.305 20 0 HIADHN Cc1cc(NC(=O)[C@@H]2CCc3cccc(O)c32)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000551712617 941531306 /nfs/dbraw/zinc/53/13/06/941531306.db2.gz VKZVPHZCNVSEHO-NHCUHLMSSA-N 0 3 416.525 4.013 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)c2cc(Br)ccc2Cl)cc1 ZINC000551794243 941546030 /nfs/dbraw/zinc/54/60/30/941546030.db2.gz OIDSJERLXOSPDT-KRWDZBQOSA-N 0 3 411.727 4.144 20 0 HIADHN CCOC(=O)c1oc2c(c1C)[C@H](N[C@H](CN(C)C)c1ccc(OC)cc1)CCC2 ZINC000551804435 941548211 /nfs/dbraw/zinc/54/82/11/941548211.db2.gz ZSGIOOBJEINIEB-RTBURBONSA-N 0 3 400.519 4.043 20 0 HIADHN C[C@H](N[C@H](CO)C[C@H](O)C(C)(C)C)c1ccc(Br)cc1C(F)(F)F ZINC000551816290 941551401 /nfs/dbraw/zinc/55/14/01/941551401.db2.gz IOLPETMVGRVIII-WBIUFABUSA-N 0 3 412.290 4.277 20 0 HIADHN CC1(C)C[C@H](NCc2cccc(N3C(=O)N[C@@](C)(C4CC4)C3=O)c2)c2ccccc21 ZINC000551818093 941552079 /nfs/dbraw/zinc/55/20/79/941552079.db2.gz SYDQPQQAZQBMAQ-OFVILXPXSA-N 0 3 403.526 4.424 20 0 HIADHN COc1ccc([C@@H](Cc2ccncc2)NCc2ccc(-n3ccnc3)c(F)c2)cc1 ZINC000552047298 941573332 /nfs/dbraw/zinc/57/33/32/941573332.db2.gz HFBQVOVPGOGQHT-HSZRJFAPSA-N 0 3 402.473 4.489 20 0 HIADHN O=C([C@H]1CN(Cc2ccccc2)CCC1(F)F)N(CCC(F)(F)F)CC1CC1 ZINC000552077214 941580598 /nfs/dbraw/zinc/58/05/98/941580598.db2.gz AFAVMQRFPSGPRH-QGZVFWFLSA-N 0 3 404.423 4.335 20 0 HIADHN CC[C@@H](N[C@H](C)c1cccc(N2CCCS2(=O)=O)c1)c1ccc(OC)c(OC)c1 ZINC000552090436 941583018 /nfs/dbraw/zinc/58/30/18/941583018.db2.gz KCTRDZWQFPHCFB-OXQOHEQNSA-N 0 3 418.559 4.046 20 0 HIADHN CN(Cc1nc(-c2ccccc2)c[nH]1)C(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000552093939 941584006 /nfs/dbraw/zinc/58/40/06/941584006.db2.gz DLURDOBUFLQIAM-FQEVSTJZSA-N 0 3 424.495 4.193 20 0 HIADHN C[C@@H](NCC1(S(C)(=O)=O)CCCC1)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000552097484 941584723 /nfs/dbraw/zinc/58/47/23/941584723.db2.gz CZHRJCASLMBOLL-QGZVFWFLSA-N 0 3 405.535 4.413 20 0 HIADHN CN(CCCN(C)C(=O)c1cccc(NC(=O)C2CCCCC2)c1)Cc1ccncc1 ZINC000552112465 941587494 /nfs/dbraw/zinc/58/74/94/941587494.db2.gz CTLNGPCTIYTPLE-UHFFFAOYSA-N 0 3 422.573 4.195 20 0 HIADHN COc1cc(CN2CCC[C@@H](O)CC2)ccc1OCc1ccc(Br)cc1 ZINC000552147122 941593908 /nfs/dbraw/zinc/59/39/08/941593908.db2.gz MIJBNWBQIPHHMT-LJQANCHMSA-N 0 3 420.347 4.384 20 0 HIADHN Cn1c2ccc(C(=O)N3CCN(c4ccnc5ccccc54)CC3)cc2nc1C(F)F ZINC000552150291 941594142 /nfs/dbraw/zinc/59/41/42/941594142.db2.gz RZJJVUPKYIUOLF-UHFFFAOYSA-N 0 3 421.451 4.022 20 0 HIADHN O=C(CCCCc1nc2ccccc2s1)Nc1cccc(CN2CC[C@@H](O)C2)c1 ZINC000552200886 941600895 /nfs/dbraw/zinc/60/08/95/941600895.db2.gz UKGSMYXJNHKXOX-LJQANCHMSA-N 0 3 409.555 4.214 20 0 HIADHN O[C@@H](CN[C@@H]1CCOc2c(Cl)cccc21)COc1c(Cl)cccc1Cl ZINC000552226746 941608586 /nfs/dbraw/zinc/60/85/86/941608586.db2.gz OLZAUMDKFKOTSG-MEDUHNTESA-N 0 3 402.705 4.500 20 0 HIADHN CC[C@@H](N[C@H](C)c1cccc(S(=O)(=O)NC)c1)c1ccc(OC(F)(F)F)cc1 ZINC000552247636 941613524 /nfs/dbraw/zinc/61/35/24/941613524.db2.gz WBFFWFVVZPHMAP-FZKQIMNGSA-N 0 3 416.465 4.295 20 0 HIADHN COc1ccc(Cn2nc(C)c(CN3CCC(CO)(c4ccccc4)CC3)c2C)cc1 ZINC000552293334 941624041 /nfs/dbraw/zinc/62/40/41/941624041.db2.gz YOPHKFLROSDRFL-UHFFFAOYSA-N 0 3 419.569 4.083 20 0 HIADHN CNC(=O)COc1cccc(CN[C@H]2CCCOc3c(C)cc(C(C)(C)C)cc32)c1 ZINC000552296517 941626063 /nfs/dbraw/zinc/62/60/63/941626063.db2.gz KZBILCDJUGAZCA-QFIPXVFZSA-N 0 3 410.558 4.421 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)N1CC[C@H](c2cccc(F)c2)C1 ZINC000552310368 941629036 /nfs/dbraw/zinc/62/90/36/941629036.db2.gz UTDXNUNQZPKJNY-FQEVSTJZSA-N 0 3 413.562 4.438 20 0 HIADHN C[C@H](N[C@H](c1cccc(OC(F)(F)F)c1)C1CC1)c1cccc(S(N)(=O)=O)c1 ZINC000552317744 941630082 /nfs/dbraw/zinc/63/00/82/941630082.db2.gz HEPFZNXKSPFXOH-SGTLLEGYSA-N 0 3 414.449 4.035 20 0 HIADHN C[C@@H](N[C@H](c1cccc(OC(F)(F)F)c1)C1CC1)c1cccc(S(N)(=O)=O)c1 ZINC000552317745 941630315 /nfs/dbraw/zinc/63/03/15/941630315.db2.gz HEPFZNXKSPFXOH-XIKOKIGWSA-N 0 3 414.449 4.035 20 0 HIADHN Cc1ccc(-c2nc3c(s2)[C@@H](NCC2(S(C)(=O)=O)CCCC2)CCC3)cc1 ZINC000552335275 941635210 /nfs/dbraw/zinc/63/52/10/941635210.db2.gz NASWIFHPZKMNSZ-KRWDZBQOSA-N 0 3 404.601 4.443 20 0 HIADHN CC(C)[C@H](CNC(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F)c1cccnc1 ZINC000552341545 941638139 /nfs/dbraw/zinc/63/81/39/941638139.db2.gz MZFXLIZSJQSVCP-LEWJYISDSA-N 0 3 401.501 4.095 20 0 HIADHN Cc1nn(C(C)(C)C)cc1[C@@H](C)NC(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000552434137 941669926 /nfs/dbraw/zinc/66/99/26/941669926.db2.gz QLCTZRYIUNUUDV-UZLBHIALSA-N 0 3 418.532 4.281 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)c2ccc(OC(F)F)c(F)c2)N(C)C)cc1 ZINC000552461699 941677181 /nfs/dbraw/zinc/67/71/81/941677181.db2.gz XSPQMURLZOBWJC-SFHVURJKSA-N 0 3 410.436 4.247 20 0 HIADHN Cc1c(C(=O)Nc2ccccc2CN(C)C)cnn1-c1cccc(Br)c1 ZINC000552527078 941696632 /nfs/dbraw/zinc/69/66/32/941696632.db2.gz WNPDYUJTCWYQNQ-UHFFFAOYSA-N 0 3 413.319 4.257 20 0 HIADHN C[C@H](CC(=O)c1ccccc1F)C(=O)N1CC[C@@]2(CCN(Cc3ccccc3)C2)C1 ZINC000552678988 941735984 /nfs/dbraw/zinc/73/59/84/941735984.db2.gz LSUGHNZWNNGNRK-KBMIEXCESA-N 0 3 408.517 4.159 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)[C@@H]1CCCN(C(=O)C(C)(C)C)C1)c1ccc(Cl)cc1 ZINC000552681030 941736522 /nfs/dbraw/zinc/73/65/22/941736522.db2.gz NBUKUOUOJDCGOS-QUCCMNQESA-N 0 3 422.013 4.124 20 0 HIADHN CO[C@H]1CCC[C@H](C(=O)N(Cc2ccccc2Br)C2CCN(C)CC2)C1 ZINC000552748253 941751097 /nfs/dbraw/zinc/75/10/97/941751097.db2.gz ORHXLUSURWNWQQ-LPHOPBHVSA-N 0 3 423.395 4.077 20 0 HIADHN Cc1cc(C(=O)N(Cc2ccncc2)[C@@H]2CCCN(Cc3ccccc3)C2)c(C)n1C ZINC000552850226 941787682 /nfs/dbraw/zinc/78/76/82/941787682.db2.gz SWRGSQXEQFPTFG-XMMPIXPASA-N 0 3 416.569 4.344 20 0 HIADHN O=C(CCc1cncs1)N(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000552849856 941788178 /nfs/dbraw/zinc/78/81/78/941788178.db2.gz BZNFINHIGZHACB-QFIPXVFZSA-N 0 3 420.582 4.164 20 0 HIADHN C[C@@H](c1cc2ccccc2o1)N(C)C(=O)CNC1(c2ccc(F)cc2)CCOCC1 ZINC000552946277 941806478 /nfs/dbraw/zinc/80/64/78/941806478.db2.gz NUIKZQWPTOVCBT-KRWDZBQOSA-N 0 3 410.489 4.387 20 0 HIADHN CC(C)COc1ccc(CCNC(=O)N(Cc2ccco2)C2CCN(C)CC2)cc1 ZINC000553039879 941822316 /nfs/dbraw/zinc/82/23/16/941822316.db2.gz DGMJYLYGGFYVJJ-UHFFFAOYSA-N 0 3 413.562 4.163 20 0 HIADHN C[C@@H](N[C@H](C)c1cccc(N2CCCC2)c1)C(=O)Nc1ccc(N2CCCC2=O)cc1 ZINC000553076116 941829063 /nfs/dbraw/zinc/82/90/63/941829063.db2.gz DWODYYKXAYXSRH-RTBURBONSA-N 0 3 420.557 4.091 20 0 HIADHN O=C1c2ccccc2C(=O)N1[C@H]1CCCC[C@H](NCc2cc(-c3ccccc3)on2)C1 ZINC000553382262 941877337 /nfs/dbraw/zinc/87/73/37/941877337.db2.gz LCFBFAZNPBMIDA-ICSRJNTNSA-N 0 3 415.493 4.429 20 0 HIADHN CC(C)c1ccc2occ(C(=O)N[C@H]3CCN(Cc4ccccc4)C[C@@H]3CO)c2c1 ZINC000553434666 941884359 /nfs/dbraw/zinc/88/43/59/941884359.db2.gz MKTQSOYCDKGQJA-OFNKIYASSA-N 0 3 406.526 4.169 20 0 HIADHN CN1CCC[C@@H](CNc2nnc(-c3ccon3)s2)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000553440076 941885542 /nfs/dbraw/zinc/88/55/42/941885542.db2.gz YHKKLCIRYMLRNJ-XJKSGUPXSA-N 0 3 423.464 4.707 20 0 HIADHN Cc1ccc(S[C@H](C)C(=O)N2CCC[C@@H](c3n[nH]cc3CN3CCCC3)C2)cc1 ZINC000553512608 941899860 /nfs/dbraw/zinc/89/98/60/941899860.db2.gz GEFXELHGRFQDAK-RTBURBONSA-N 0 3 412.603 4.201 20 0 HIADHN Cc1nn(-c2ccccc2)cc1C(=O)NC[C@H](c1ccc(OC(C)C)cc1)N(C)C ZINC000553670776 941941236 /nfs/dbraw/zinc/94/12/36/941941236.db2.gz NFZHHFNSEBSAGC-HSZRJFAPSA-N 0 3 406.530 4.001 20 0 HIADHN CN1CC[C@@H](NC(=O)NCc2cc(F)c(C(F)(F)F)cc2F)[C@@H]1c1ccccc1 ZINC000553703892 941947307 /nfs/dbraw/zinc/94/73/07/941947307.db2.gz NCSCBGYXFMVPBH-MSOLQXFVSA-N 0 3 413.390 4.228 20 0 HIADHN C[C@@H]1CN(C(=O)c2ccccc2CN(C)C)C[C@@H](c2cccc(C(F)(F)F)c2)O1 ZINC000553722152 941952574 /nfs/dbraw/zinc/95/25/74/941952574.db2.gz GCIMFELXBBYLCU-QRWLVFNGSA-N 0 3 406.448 4.369 20 0 HIADHN OC[C@@H](NC[C@@H](O)Cc1cccc(Cl)c1)c1ccc(Cl)cc1C(F)(F)F ZINC000553893605 941991885 /nfs/dbraw/zinc/99/18/85/941991885.db2.gz AGCLUQPKPRSTKD-WMLDXEAASA-N 0 3 408.247 4.239 20 0 HIADHN CC(C)c1nn(-c2ccc(Br)cc2)cc1CN[C@@H](C)CO[C@H]1CCOC1 ZINC000553898981 941994009 /nfs/dbraw/zinc/99/40/09/941994009.db2.gz RDDJCQQSQJVYRW-KXBFYZLASA-N 0 3 422.367 4.042 20 0 HIADHN OCC[C@@H](NC[C@@H](O)COc1c(Cl)cccc1Cl)c1ccc(Cl)cc1 ZINC000553959564 942007178 /nfs/dbraw/zinc/00/71/78/942007178.db2.gz YPYRWFSLAWCNIZ-RHSMWYFYSA-N 0 3 404.721 4.100 20 0 HIADHN COc1cc(OC2CC2)ccc1C(=O)NC[C@@H](c1ccc(OC(C)C)cc1)N(C)C ZINC000554016095 942020057 /nfs/dbraw/zinc/02/00/57/942020057.db2.gz RYCUHKKUWOVZJZ-QFIPXVFZSA-N 0 3 412.530 4.056 20 0 HIADHN COc1ccc(Cl)cc1CC(=O)NC[C@H](c1ccc(OC(C)C)cc1)N(C)C ZINC000554039995 942024085 /nfs/dbraw/zinc/02/40/85/942024085.db2.gz ZJWCNBFCTLNUMK-HXUWFJFHSA-N 0 3 404.938 4.097 20 0 HIADHN C[C@H]1CCc2c(sc3nc(CCN4CC[C@@H](Nc5ccccc5)C4)nc(N)c23)C1 ZINC000554040782 942024100 /nfs/dbraw/zinc/02/41/00/942024100.db2.gz QFBWMQBQYGDTRS-DOTOQJQBSA-N 0 3 407.587 4.127 20 0 HIADHN C[C@@H](C(=O)Nc1ccc(Br)cc1Br)N(C)CC1CCC1 ZINC000554074801 942030633 /nfs/dbraw/zinc/03/06/33/942030633.db2.gz GVYRAFJQUVCADT-JTQLQIEISA-N 0 3 404.146 4.271 20 0 HIADHN C[C@@H](N[C@H]1CCN(c2ccc(Cl)cc2Cl)C1=O)c1cccc(-n2ccnn2)c1 ZINC000554090277 942034477 /nfs/dbraw/zinc/03/44/77/942034477.db2.gz PLMQHZBLMWFMIC-ACJLOTCBSA-N 0 3 416.312 4.030 20 0 HIADHN COc1cc(Br)ccc1[C@@H](C)N[C@H](C)c1cccc(-n2ccnn2)c1 ZINC000554094212 942035156 /nfs/dbraw/zinc/03/51/56/942035156.db2.gz BEWNVJNVKOZYGT-ZIAGYGMSSA-N 0 3 401.308 4.450 20 0 HIADHN C[C@@H](NC(=O)Nc1cc(N2CCCC2=O)ccc1Cl)[C@H](c1ccccc1)N(C)C ZINC000554107296 942037442 /nfs/dbraw/zinc/03/74/42/942037442.db2.gz DBFUDTRTRNGWOS-QVKFZJNVSA-N 0 3 414.937 4.280 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)Nc1ccc(C(=O)N(C)C)cc1)c1ccc(Cl)cc1 ZINC000554109382 942037960 /nfs/dbraw/zinc/03/79/60/942037960.db2.gz STUULWUHSSQMRH-FQEVSTJZSA-N 0 3 416.953 4.246 20 0 HIADHN C[C@H](NCc1ccc2c(c1)OCCO2)c1ccc(OC[C@H]2CCCCO2)c(F)c1 ZINC000554114831 942039970 /nfs/dbraw/zinc/03/99/70/942039970.db2.gz QMKIWABSVVADOP-QFBILLFUSA-N 0 3 401.478 4.396 20 0 HIADHN COc1cccc(Cl)c1-c1noc(C)c1C(=O)N1CCN([C@@H]2C[C@H]2C)C[C@H](C)C1 ZINC000554128437 942043784 /nfs/dbraw/zinc/04/37/84/942043784.db2.gz KGRDNNNEDXTBCY-JJRVBVJISA-N 0 3 417.937 4.114 20 0 HIADHN CCOc1ccc(Nc2ncccc2C(=O)N2CCN([C@@H]3C[C@@H]3C)C[C@@H](C)C2)cc1 ZINC000554132508 942044917 /nfs/dbraw/zinc/04/49/17/942044917.db2.gz VCHYUDKKYOHMJC-KGVIQGDOSA-N 0 3 408.546 4.026 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)Nc2cccc(NC(=O)C3CC3)c2)N(C)C)cc1 ZINC000554145745 942049481 /nfs/dbraw/zinc/04/94/81/942049481.db2.gz XNTHVHYVLRAVSJ-JOCHJYFZSA-N 0 3 424.545 4.247 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1ccccc1N1C[C@@H](C)O[C@@H](C)C1)c1ccco1 ZINC000554150051 942050929 /nfs/dbraw/zinc/05/09/29/942050929.db2.gz HFXGCRBVKBYPFW-PNYFIKQUSA-N 0 3 414.550 4.144 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)Nc1ccc(N2CCSCC2)cc1C ZINC000554175583 942057930 /nfs/dbraw/zinc/05/79/30/942057930.db2.gz VJQUORKEQSZTJA-UHFFFAOYSA-N 0 3 404.624 4.278 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)N(Cc1cscn1)c1ccccc1 ZINC000554216761 942070240 /nfs/dbraw/zinc/07/02/40/942070240.db2.gz CFOHSEXUFUUZMT-UHFFFAOYSA-N 0 3 420.582 4.279 20 0 HIADHN C[C@@H](NC(=O)NC[C@H](c1cccs1)N1CCCC1)c1nccn1-c1ccccc1 ZINC000554219613 942071057 /nfs/dbraw/zinc/07/10/57/942071057.db2.gz ZBXNNQAFBMXVAC-IEBWSBKVSA-N 0 3 409.559 4.131 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)Nc2cnn(Cc3ccccc3)c2)N(C)C)cc1 ZINC000554245800 942077058 /nfs/dbraw/zinc/07/70/58/942077058.db2.gz PYVWCZLOEGXUJD-HSZRJFAPSA-N 0 3 421.545 4.143 20 0 HIADHN CCOc1ccc([C@H](C)NC(=O)N[C@H](CN(C)C)c2ccc(F)cc2)cc1OCC ZINC000554254018 942080302 /nfs/dbraw/zinc/08/03/02/942080302.db2.gz WIUPYDHUIVCSPG-OXJNMPFZSA-N 0 3 417.525 4.286 20 0 HIADHN C[C@@H](NC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C)c1nccn1-c1ccccc1 ZINC000554333676 942106066 /nfs/dbraw/zinc/10/60/66/942106066.db2.gz UIBOCZBYRKKTOF-LEWJYISDSA-N 0 3 417.557 4.239 20 0 HIADHN COc1ccc(CN2CC[C@@H](N[C@H]3CCCc4ccc(Cl)cc43)C2=O)c(OC)c1 ZINC000554355773 942111675 /nfs/dbraw/zinc/11/16/75/942111675.db2.gz ZSXJCDBMNCLFAO-LEWJYISDSA-N 0 3 414.933 4.125 20 0 HIADHN CC[C@H](N[C@@H]1CCN(Cc2ccc(OC)cc2OC)C1=O)c1ccc(Cl)cc1 ZINC000554366153 942114907 /nfs/dbraw/zinc/11/49/07/942114907.db2.gz HFPCEZNCMZFDFY-VQTJNVASSA-N 0 3 402.922 4.199 20 0 HIADHN CN(C)C[C@@H](NC(=O)Nc1cccc(Cl)c1-n1cccn1)c1ccc(F)cc1 ZINC000554396660 942124891 /nfs/dbraw/zinc/12/48/91/942124891.db2.gz LDIAOFFIRDXEKG-GOSISDBHSA-N 0 3 401.873 4.089 20 0 HIADHN CCOC(=O)Cn1ccc2cc(NC(=O)N[C@H](C)[C@H](c3ccccc3)N(C)C)ccc21 ZINC000554440686 942143379 /nfs/dbraw/zinc/14/33/79/942143379.db2.gz CEBDGBLIDVLQIQ-UZUQRXQVSA-N 0 3 422.529 4.017 20 0 HIADHN CC(C)c1noc(-c2ccc(NC(=O)N[C@@H](CN(C)C)c3ccc(F)cc3)cc2)n1 ZINC000554460735 942151441 /nfs/dbraw/zinc/15/14/41/942151441.db2.gz AIWQHSSUKGMDMU-IBGZPJMESA-N 0 3 411.481 4.424 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)c1ccc2c(c1)[nH]c(=O)n2C1CCCC1)c1ccco1 ZINC000554633955 942180778 /nfs/dbraw/zinc/18/07/78/942180778.db2.gz HYIBRCXAFGGVTM-HNAYVOBHSA-N 0 3 410.518 4.309 20 0 HIADHN CC1=NN(c2ccc(C(=O)NC[C@H](c3ccc(OC(C)C)cc3)N(C)C)cc2)CC1 ZINC000554653105 942188312 /nfs/dbraw/zinc/18/83/12/942188312.db2.gz QXCKQJJSETURQO-HSZRJFAPSA-N 0 3 408.546 4.093 20 0 HIADHN CC1=NN(c2ccc(C(=O)NC[C@@H](c3ccc(OC(C)C)cc3)N(C)C)cc2)CC1 ZINC000554653106 942188491 /nfs/dbraw/zinc/18/84/91/942188491.db2.gz QXCKQJJSETURQO-QHCPKHFHSA-N 0 3 408.546 4.093 20 0 HIADHN COc1ccc(-c2ocnc2C(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)cc1 ZINC000554781271 942234652 /nfs/dbraw/zinc/23/46/52/942234652.db2.gz ROLYSHMGGUVMLI-OAQYLSRUSA-N 0 3 423.513 4.170 20 0 HIADHN CCCC(=O)NC[C@@H]1CCCN(CCCC(=O)c2ccc(Br)cc2)C1 ZINC000554853177 942289174 /nfs/dbraw/zinc/28/91/74/942289174.db2.gz MJLKZONQGFHMPX-INIZCTEOSA-N 0 3 409.368 4.040 20 0 HIADHN CC(C)C[C@@H]([NH2+]C[C@@H](C)c1ccc(C(F)(F)F)cc1)c1nc(-c2nc[n-]n2)no1 ZINC000554862746 942295709 /nfs/dbraw/zinc/29/57/09/942295709.db2.gz QNQFTDVGKVTPDM-IUODEOHRSA-N 0 3 408.428 4.354 20 0 HIADHN CC(C)C[C@@H](NC[C@@H](C)c1ccc(C(F)(F)F)cc1)c1nc(-c2nc[nH]n2)no1 ZINC000554862746 942295719 /nfs/dbraw/zinc/29/57/19/942295719.db2.gz QNQFTDVGKVTPDM-IUODEOHRSA-N 0 3 408.428 4.354 20 0 HIADHN CN(C)C[C@H](NC(=O)Nc1cccc(OC[C@@H]2CCCO2)c1)c1ccc(Cl)cc1 ZINC000554871296 942301919 /nfs/dbraw/zinc/30/19/19/942301919.db2.gz RIPDLLZTVDZXOM-SFTDATJTSA-N 0 3 417.937 4.322 20 0 HIADHN COCCCOc1ccccc1NC(=O)N[C@H](CN(C)C)c1ccc(Cl)cc1 ZINC000554905379 942313841 /nfs/dbraw/zinc/31/38/41/942313841.db2.gz HETDDQIHBWXIQG-LJQANCHMSA-N 0 3 405.926 4.180 20 0 HIADHN CSc1cccc(NC(=O)[C@H](C)N[C@@H]2CCN(C)[C@@H]2c2ccc(Cl)cc2)c1 ZINC000554950392 942330686 /nfs/dbraw/zinc/33/06/86/942330686.db2.gz YOAFWIFDLFFVRH-VHKYSDTDSA-N 0 3 403.979 4.424 20 0 HIADHN O=C(CCN1CC[C@@H](n2cc(Cl)cn2)C1)N[C@@H](c1cccs1)c1ccccc1 ZINC000554959115 942333901 /nfs/dbraw/zinc/33/39/01/942333901.db2.gz BIVZDISUYQRZAO-WIYYLYMNSA-N 0 3 414.962 4.141 20 0 HIADHN Cc1ccc(-c2ccnn2C)cc1NC(=O)N[C@H](CN(C)C)c1ccc(Cl)cc1 ZINC000554987187 942344445 /nfs/dbraw/zinc/34/44/45/942344445.db2.gz HDJBSFXCIOGQAM-HXUWFJFHSA-N 0 3 411.937 4.473 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)Nc3c4c(cc5c3CCC5)CCC4)CC2)C[C@H](C)O1 ZINC000555010371 942354694 /nfs/dbraw/zinc/35/46/94/942354694.db2.gz NKBLYLOMFBRHJG-ROUUACIJSA-N 0 3 411.590 4.017 20 0 HIADHN Fc1ccc(CN(Cc2ccc(-n3cncn3)cc2)C2CC2)cc1Br ZINC000555064632 942374395 /nfs/dbraw/zinc/37/43/95/942374395.db2.gz KDCHPTMYTYREDG-UHFFFAOYSA-N 0 3 401.283 4.334 20 0 HIADHN COc1ccc(OC)c(NC(=O)CN[C@@H](c2cccc(C(F)(F)F)c2)C2CC2)c1 ZINC000555073972 942377424 /nfs/dbraw/zinc/37/74/24/942377424.db2.gz JVKHXZUDJWGFPM-HXUWFJFHSA-N 0 3 408.420 4.402 20 0 HIADHN COc1cccc(CNC(=O)[C@@H](C)N[C@@H](c2cccc(C(F)(F)F)c2)C2CC2)c1 ZINC000555078297 942379291 /nfs/dbraw/zinc/37/92/91/942379291.db2.gz MCGRLYOWLCDCPS-JLTOFOAXSA-N 0 3 406.448 4.460 20 0 HIADHN CCN1CC[C@H](NCC(=O)Nc2ccc(F)cc2F)[C@H]1c1ccc(Cl)c(F)c1 ZINC000555124752 942391935 /nfs/dbraw/zinc/39/19/35/942391935.db2.gz AWROAQYGDSXGJG-AZUAARDMSA-N 0 3 411.855 4.121 20 0 HIADHN COc1cccc([C@@H]2[C@H](N[C@@H](C)C(=O)N[C@@H](C)c3ccccc3C)CCN2C2CC2)c1 ZINC000555125264 942392544 /nfs/dbraw/zinc/39/25/44/942392544.db2.gz GEMATNCGJXIHNQ-QKFIJCJASA-N 0 3 421.585 4.137 20 0 HIADHN COc1cccc([C@@H]2[C@H](N[C@H](C)C(=O)N[C@H](C)c3ccccc3C)CCN2C2CC2)c1 ZINC000555125263 942392558 /nfs/dbraw/zinc/39/25/58/942392558.db2.gz GEMATNCGJXIHNQ-PIYXRGFCSA-N 0 3 421.585 4.137 20 0 HIADHN CC(C)N1CC[C@@H](NCc2cnn(C)c2C(F)(F)F)[C@@H]1c1ccc(F)c(F)c1 ZINC000555128343 942394995 /nfs/dbraw/zinc/39/49/95/942394995.db2.gz GIVOYLVKGDPFOK-SJORKVTESA-N 0 3 402.411 4.031 20 0 HIADHN CCN1CC[C@@H](NCC(=O)N(CC(F)(F)F)C(C)C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000555133071 942397052 /nfs/dbraw/zinc/39/70/52/942397052.db2.gz YZAKXQFKFDMHIV-AEFFLSMTSA-N 0 3 423.882 4.003 20 0 HIADHN CCOc1ccc(NC(=O)CN[C@@H]2CCN(C(C)C)[C@H]2c2ccc(F)c(F)c2)cc1 ZINC000555133280 942397848 /nfs/dbraw/zinc/39/78/48/942397848.db2.gz QWVVZFOIHDFGJF-GGAORHGYSA-N 0 3 417.500 4.116 20 0 HIADHN CCN(C(=O)NCc1ccsc1Br)[C@H]1CCN(Cc2ccccc2)C1 ZINC000555198200 942428127 /nfs/dbraw/zinc/42/81/27/942428127.db2.gz NFVZMXFHBYSQQX-KRWDZBQOSA-N 0 3 422.392 4.317 20 0 HIADHN CC[C@H](N[C@H](CN(C)C)c1ccc(Cl)cc1)c1ccccc1OCC(=O)N(C)C ZINC000555226493 942436861 /nfs/dbraw/zinc/43/68/61/942436861.db2.gz SKJBHPBNECRSGV-LEWJYISDSA-N 0 3 417.981 4.151 20 0 HIADHN CN(C)C[C@@H](NC(=O)CCc1ncc(-c2ccccc2F)o1)c1ccc(Cl)cc1 ZINC000555230150 942437611 /nfs/dbraw/zinc/43/76/11/942437611.db2.gz VVMGQMVZPNLWHY-LJQANCHMSA-N 0 3 415.896 4.486 20 0 HIADHN Cn1cc(-c2ccc(CN3CCC(NC(=O)Nc4ccc(F)cc4)CC3)s2)cn1 ZINC000555336292 942481810 /nfs/dbraw/zinc/48/18/10/942481810.db2.gz OCBIYWJVBKYEGJ-UHFFFAOYSA-N 0 3 413.522 4.074 20 0 HIADHN O=C1NCCN1[C@@H]1CCCN(Cc2ccc(-c3ccccc3Br)cc2)C1 ZINC000555337709 942482678 /nfs/dbraw/zinc/48/26/78/942482678.db2.gz JBHBIJQMCCJSIW-GOSISDBHSA-N 0 3 414.347 4.106 20 0 HIADHN FC(F)(F)[C@H]1CCN(Cc2c[nH]nc2-c2ccc3c(c2)OCCO3)CC12CCC2 ZINC000555348801 942487735 /nfs/dbraw/zinc/48/77/35/942487735.db2.gz IPEMAWVOABKRLX-SFHVURJKSA-N 0 3 407.436 4.402 20 0 HIADHN O=C(NCCN1CCCC1)c1ccc(NCc2c(F)cccc2Br)cc1 ZINC000555506136 942609514 /nfs/dbraw/zinc/60/95/14/942609514.db2.gz FUWBRRNVMHFXES-UHFFFAOYSA-N 0 3 420.326 4.026 20 0 HIADHN Brc1ccccc1N1CC[C@@H](NCc2conc2Cc2ccccc2)C1 ZINC000555547040 942637242 /nfs/dbraw/zinc/63/72/42/942637242.db2.gz FUUOISOYGKXRAO-GOSISDBHSA-N 0 3 412.331 4.396 20 0 HIADHN OC[C@H](CNCc1conc1Cc1ccccc1)Cc1ccccc1C(F)(F)F ZINC000555564508 942644716 /nfs/dbraw/zinc/64/47/16/942644716.db2.gz OLKUPDJPXDFKPQ-KRWDZBQOSA-N 0 3 404.432 4.225 20 0 HIADHN O=C([C@H](NC1(Cc2cccc(F)c2)CCOCC1)c1ccccc1)N1CCCCC1 ZINC000555618050 942671080 /nfs/dbraw/zinc/67/10/80/942671080.db2.gz DYTYZWDRTZIEFW-HSZRJFAPSA-N 0 3 410.533 4.261 20 0 HIADHN O=C(CC[NH+]1CCCCC1)Nc1ccc(NC(=O)c2cc([O-])ccc2Cl)cc1 ZINC000555684927 942700552 /nfs/dbraw/zinc/70/05/52/942700552.db2.gz SGJLCJJZPVSNSU-UHFFFAOYSA-N 0 3 401.894 4.112 20 0 HIADHN C[C@H](NC1(Cc2ccc(F)cc2Cl)CCOCC1)C(=O)c1c[nH]c2ncccc12 ZINC000555696598 942702499 /nfs/dbraw/zinc/70/24/99/942702499.db2.gz IFXNPJWBRHWLBK-AWEZNQCLSA-N 0 3 415.896 4.308 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)c1cccc(F)c1Br ZINC000556028780 942788936 /nfs/dbraw/zinc/78/89/36/942788936.db2.gz NGCUVKBNLQVIRI-MRXNPFEDSA-N 0 3 420.326 4.110 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1cc(C(C)(C)C)nn1Cc1ccccc1 ZINC000556040724 942793330 /nfs/dbraw/zinc/79/33/30/942793330.db2.gz VBSVOTXABBLSFD-UHFFFAOYSA-N 0 3 423.561 4.418 20 0 HIADHN CC(C)(CN[C@@H](c1nnc[nH]1)c1ccc(F)cc1)c1ccc(Br)cc1 ZINC000556059738 942798969 /nfs/dbraw/zinc/79/89/69/942798969.db2.gz WVPJAHAHPJGIHX-QGZVFWFLSA-N 0 3 403.299 4.363 20 0 HIADHN C[C@H](N[C@H](C[C@@H]1CCOC1)c1ccccc1)C(=O)N(C)Cc1nc2ccccc2s1 ZINC000556094024 942804497 /nfs/dbraw/zinc/80/44/97/942804497.db2.gz VJEQXRBOLYFJKR-BBTUJRGHSA-N 0 3 423.582 4.401 20 0 HIADHN Clc1cccc(CN2CCCC[C@H]2CN[C@H](c2cccs2)c2nnc[nH]2)c1 ZINC000556094476 942804706 /nfs/dbraw/zinc/80/47/06/942804706.db2.gz XZDQGBPESBZIPG-PKOBYXMFSA-N 0 3 401.967 4.253 20 0 HIADHN C[C@H](N[C@H](C[C@H]1CCOC1)c1ccccc1)C(=O)N(C)Cc1nc2ccccc2s1 ZINC000556094032 942804770 /nfs/dbraw/zinc/80/47/70/942804770.db2.gz VJEQXRBOLYFJKR-WAOWUJCRSA-N 0 3 423.582 4.401 20 0 HIADHN O=C(Nc1ccccc1)N1CC[C@H](N[C@@H]2CCc3sc(Br)cc32)C1 ZINC000556177626 942814549 /nfs/dbraw/zinc/81/45/49/942814549.db2.gz FHJUVZRPJYZZOO-DZGCQCFKSA-N 0 3 406.349 4.394 20 0 HIADHN COc1ccc(C(=O)NC2CCN(CCOc3ccc(Cl)cc3)CC2)cc1Cl ZINC000556256155 942827417 /nfs/dbraw/zinc/82/74/17/942827417.db2.gz YTZNRPSTWQXKCW-UHFFFAOYSA-N 0 3 423.340 4.275 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)[C@@H]1CCCc2cccnc21 ZINC000556398122 942856288 /nfs/dbraw/zinc/85/62/88/942856288.db2.gz UQLIVGYBIYMAII-LJQANCHMSA-N 0 3 405.464 4.111 20 0 HIADHN CC(C)(C)c1ccc(CNCc2cccc(N3C(=O)N[C@](C)(C4CC4)C3=O)c2)cc1 ZINC000556414007 942860320 /nfs/dbraw/zinc/86/03/20/942860320.db2.gz ZSFMLFODPUEMHL-RUZDIDTESA-N 0 3 405.542 4.499 20 0 HIADHN CCOc1ccc(Br)cc1NC(=O)NC[C@H](c1ccccc1)N(C)C ZINC000556502836 942886360 /nfs/dbraw/zinc/88/63/60/942886360.db2.gz KKQJMUDDYHTYHZ-QGZVFWFLSA-N 0 3 406.324 4.272 20 0 HIADHN COC(=O)[C@H](Cc1ccccc1)[C@@H](C)N[C@@H](C)C(=O)Nc1cccc(Cl)c1Cl ZINC000556522603 942891560 /nfs/dbraw/zinc/89/15/60/942891560.db2.gz KFHNOSVEMCUKOV-IJEWVQPXSA-N 0 3 423.340 4.330 20 0 HIADHN CCOc1cc(NC(=O)C(=O)N(CC)[C@@H]2CCN([C@H](C)c3ccccc3)C2)ccc1C ZINC000556548867 942897258 /nfs/dbraw/zinc/89/72/58/942897258.db2.gz RKSBBFCESNJRCC-DENIHFKCSA-N 0 3 423.557 4.016 20 0 HIADHN COCCO[C@H]1CCN(Cc2cn(-c3ccc(C)cc3)nc2-c2ccc(F)cc2)C1 ZINC000556603920 942912086 /nfs/dbraw/zinc/91/20/86/942912086.db2.gz PCYHSKAPAANHBQ-QHCPKHFHSA-N 0 3 409.505 4.224 20 0 HIADHN CCOc1ccc([C@@H](C)NCc2cccc(N3C(=O)N[C@](C)(C4CC4)C3=O)c2)cc1 ZINC000556611397 942914986 /nfs/dbraw/zinc/91/49/86/942914986.db2.gz OESJSDCEYAKCOB-VOIUYBSRSA-N 0 3 407.514 4.161 20 0 HIADHN CN(CCCN(C)Cc1ccco1)CC(=O)Nc1ccc(Cl)cc1C(F)(F)F ZINC000556881160 942949095 /nfs/dbraw/zinc/94/90/95/942949095.db2.gz GCEKNIMXAFXJNV-UHFFFAOYSA-N 0 3 417.859 4.344 20 0 HIADHN COc1ccc(C[C@@H]2CCCN(Cc3c(C)nn(C)c3OCC(F)(F)F)C2)cc1 ZINC000556883693 942949621 /nfs/dbraw/zinc/94/96/21/942949621.db2.gz UJTSMIJULWIPQT-KRWDZBQOSA-N 0 3 411.468 4.133 20 0 HIADHN COc1ccc([C@H](Cc2ccncc2)NCc2ccc(C)cc2N2CCOCC2)cc1 ZINC000556886657 942950874 /nfs/dbraw/zinc/95/08/74/942950874.db2.gz ZRZLTDMSYNQTQH-VWLOTQADSA-N 0 3 417.553 4.309 20 0 HIADHN Cc1ccc(C(=O)Nc2cccc(CNC[C@@H](O)COc3cccc(C)c3)c2)cc1 ZINC000556896109 942957087 /nfs/dbraw/zinc/95/70/87/942957087.db2.gz CUZYSUIXUIISNC-HSZRJFAPSA-N 0 3 404.510 4.085 20 0 HIADHN COc1cc(CN(C)CCSC)ccc1OCC(=O)Nc1ccccc1Cl ZINC000556902013 942958532 /nfs/dbraw/zinc/95/85/32/942958532.db2.gz ZAORQZQYPJOKFL-UHFFFAOYSA-N 0 3 408.951 4.161 20 0 HIADHN CC1(C)C[C@H](NCC2(S(C)(=O)=O)CCCC2)c2cc(Br)ccc21 ZINC000556921170 942966202 /nfs/dbraw/zinc/96/62/02/942966202.db2.gz SSCDIJHMVBLYTG-INIZCTEOSA-N 0 3 400.382 4.119 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)[C@H]1CC[C@@H](C(F)(F)F)C1 ZINC000556937415 942973362 /nfs/dbraw/zinc/97/33/62/942973362.db2.gz NHVPHKNLEYCLRS-RCCFBDPRSA-N 0 3 406.452 4.247 20 0 HIADHN Cc1ccc(-n2cc(C(=O)N3[C@@H]4CC[C@H]3CCN(C)C4)c(-c3ccccc3)n2)cc1 ZINC000556964054 942981323 /nfs/dbraw/zinc/98/13/23/942981323.db2.gz CFEVLRGNSQYETA-FCHUYYIVSA-N 0 3 400.526 4.156 20 0 HIADHN O=C([C@@H]1CN(Cc2ccccc2)CCC1(F)F)N1CC[C@H](COc2ccccc2)C1 ZINC000556967260 942982956 /nfs/dbraw/zinc/98/29/56/942982956.db2.gz YZHTWXNZNFFESH-UNMCSNQZSA-N 0 3 414.496 4.071 20 0 HIADHN O[C@@H](CN[C@H]1CCSc2ccc(F)cc21)COc1ccc(Br)cc1 ZINC000557014777 942994882 /nfs/dbraw/zinc/99/48/82/942994882.db2.gz XBOYVKOYDMCKAF-YOEHRIQHSA-N 0 3 412.324 4.155 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)c1cc2c(s1)-c1ccccc1CC2 ZINC000557024538 942997266 /nfs/dbraw/zinc/99/72/66/942997266.db2.gz YYYBBLWCGUBIRJ-FQEVSTJZSA-N 0 3 404.535 4.333 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)Cc1c(C)nn(C(F)F)c1C)c1ccc(Cl)cc1 ZINC000557059414 943007954 /nfs/dbraw/zinc/00/79/54/943007954.db2.gz RDXZBIQIPATPTK-SFHVURJKSA-N 0 3 412.912 4.290 20 0 HIADHN CCOc1ccc(-c2nc(CC)c(C(=O)N3C[C@@H](N4CCCC4)C[C@H]3C)s2)cc1 ZINC000557128086 943026550 /nfs/dbraw/zinc/02/65/50/943026550.db2.gz VLIDSGMRMFGAES-AEFFLSMTSA-N 0 3 413.587 4.470 20 0 HIADHN CO[C@H]1CCCC[C@@H]1C(=O)N(Cc1ccccc1Br)C1CCN(C)CC1 ZINC000557160033 943034845 /nfs/dbraw/zinc/03/48/45/943034845.db2.gz HQGBEUILSFTRPD-ICSRJNTNSA-N 0 3 423.395 4.077 20 0 HIADHN CC(C)C[C@@H](NCc1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1)c1cccs1 ZINC000557271821 943063735 /nfs/dbraw/zinc/06/37/35/943063735.db2.gz FLQBIUPIMPASJY-UYAOXDASSA-N 0 3 422.616 4.082 20 0 HIADHN O=C(Nc1ccc(F)cc1OCC(F)F)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000557316737 943070168 /nfs/dbraw/zinc/07/01/68/943070168.db2.gz XQWSOHYWBMQINJ-OAHLLOKOSA-N 0 3 410.411 4.459 20 0 HIADHN COCCC[C@@H](C)C(=O)N(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000557449265 943134887 /nfs/dbraw/zinc/13/48/87/943134887.db2.gz SKKHIWVBFFMLHB-QPPBQGQZSA-N 0 3 409.574 4.138 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(C)c1C(=O)N[C@@H]1CCN(Cc2ccccc2)[C@@H]1C ZINC000557487785 943162953 /nfs/dbraw/zinc/16/29/53/943162953.db2.gz XXUNOSORZXYNBW-VGOFRKELSA-N 0 3 406.505 4.021 20 0 HIADHN O=C(N[C@@H](c1c[nH]c2ccccc21)C(F)(F)F)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000557629701 943238929 /nfs/dbraw/zinc/23/89/29/943238929.db2.gz CMJHDAWEPSKGOT-JXFKEZNVSA-N 0 3 416.447 4.195 20 0 HIADHN CNc1ccc(Cl)c(C(=O)Nc2cc(C)cc(N3CCN(C(C)C)CC3)c2)c1 ZINC000557669580 943254106 /nfs/dbraw/zinc/25/41/06/943254106.db2.gz IRKYNAAHSQBEJI-UHFFFAOYSA-N 0 3 400.954 4.473 20 0 HIADHN C/C=C/c1ccc(OC[C@H](O)CNCc2csc(Br)c2)c(OC)c1 ZINC000557888743 943321685 /nfs/dbraw/zinc/32/16/85/943321685.db2.gz HTDBNJRLSXGTSS-NHZBNJEXSA-N 0 3 412.349 4.082 20 0 HIADHN CCO[C@@H](C)c1ncc(C(=O)NC[C@H](c2ccc(CC(C)C)cc2)N(C)C)s1 ZINC000557985748 943347235 /nfs/dbraw/zinc/34/72/35/943347235.db2.gz PJZBVSDPUYGMNB-QFBILLFUSA-N 0 3 403.592 4.472 20 0 HIADHN CC1CCN([C@H](CNC(=O)N2CCCC[C@@H]2c2ccnn2C)c2cccs2)CC1 ZINC000558003574 943352223 /nfs/dbraw/zinc/35/22/23/943352223.db2.gz QSQPSRIDPCNPQM-WOJBJXKFSA-N 0 3 415.607 4.191 20 0 HIADHN C[C@H]1C[C@H]1N1CCN(C(=O)c2cc(C(F)(F)F)ccc2Br)C[C@@H](C)C1 ZINC000558026740 943359588 /nfs/dbraw/zinc/35/95/88/943359588.db2.gz YEWFUTZATWNHHX-MQIPJXDCSA-N 0 3 419.285 4.270 20 0 HIADHN CCc1c(NC(=O)N[C@H]2CCN(Cc3ccccc3)[C@@H]2C)cnn1-c1ccccc1 ZINC000558210596 943434255 /nfs/dbraw/zinc/43/42/55/943434255.db2.gz NQFJNJKGPQMGSC-NQIIRXRSSA-N 0 3 403.530 4.219 20 0 HIADHN CC(C)CCOC1CCN(CCc2nc3sc4c(c3c(N)n2)CC[C@H](C)C4)CC1 ZINC000558227114 943446027 /nfs/dbraw/zinc/44/60/27/943446027.db2.gz FKGNZNLCMYJQPM-INIZCTEOSA-N 0 3 416.635 4.468 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)Nc2nc(C(F)(F)F)cs2)N(C)C)cc1 ZINC000558241695 943453799 /nfs/dbraw/zinc/45/37/99/943453799.db2.gz RATOLBUCAKVOSU-CQSZACIVSA-N 0 3 416.469 4.374 20 0 HIADHN C[C@H](NC(=O)Nc1cc2c(cc1Cl)OCCCO2)[C@H](c1ccccc1)N(C)C ZINC000558244032 943455469 /nfs/dbraw/zinc/45/54/69/943455469.db2.gz NNBNOQOZSMRPDB-VBKZILBWSA-N 0 3 403.910 4.314 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)Nc1cccc(CS(=O)(=O)C(C)(C)C)c1 ZINC000558343668 943518049 /nfs/dbraw/zinc/51/80/49/943518049.db2.gz XHSBHPMYCHVNKW-UHFFFAOYSA-N 0 3 423.623 4.130 20 0 HIADHN COC(=O)COc1ccccc1[C@@H](C)N[C@@H]1CCc2c1cccc2Br ZINC000558342682 943518174 /nfs/dbraw/zinc/51/81/74/943518174.db2.gz QULHEXXUXCEWQQ-FZKQIMNGSA-N 0 3 404.304 4.339 20 0 HIADHN C[C@H](NC(=O)Nc1ccc(-c2noc(C(F)F)n2)cc1)[C@H](c1ccccc1)N(C)C ZINC000558352066 943520936 /nfs/dbraw/zinc/52/09/36/943520936.db2.gz LDCFBVGASCRNNZ-SUMWQHHRSA-N 0 3 415.444 4.487 20 0 HIADHN CC(=O)NCC[C@@H]1CCCN(Cc2cnc(-c3ccc(Br)cc3)s2)C1 ZINC000558426422 943556640 /nfs/dbraw/zinc/55/66/40/943556640.db2.gz JPZVNDIRBYZUFU-HNNXBMFYSA-N 0 3 422.392 4.311 20 0 HIADHN C[C@H](N[C@H]1CCN(C)[C@@H]1c1ccc(Cl)cc1)C(=O)Nc1ccc(F)cc1Cl ZINC000558467067 943567219 /nfs/dbraw/zinc/56/72/19/943567219.db2.gz NCJFQNFGLMNZSP-YXKWSERDSA-N 0 3 410.320 4.495 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1nc2ccccc2cc1Cl ZINC000558551075 943594528 /nfs/dbraw/zinc/59/45/28/943594528.db2.gz LIJGNSFKVYMVFA-UHFFFAOYSA-N 0 3 411.855 4.423 20 0 HIADHN C[C@H](C(=O)NC[C@@H]1CCO[C@@H]1c1ccccc1)N1CCC(Cc2ccccc2)CC1 ZINC000558597218 943613530 /nfs/dbraw/zinc/61/35/30/943613530.db2.gz QQTLCJJYLLREKJ-DCEDVJGZSA-N 0 3 406.570 4.224 20 0 HIADHN c1ccc(Cc2nc(CN[C@@H]3CN(Cc4ccccc4)C[C@H]3c3ccccc3)no2)cc1 ZINC000558737298 943635793 /nfs/dbraw/zinc/63/57/93/943635793.db2.gz BOLWCWMEJUIOJY-LOSJGSFVSA-N 0 3 424.548 4.418 20 0 HIADHN Cc1c(NC(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)cccc1NC(=O)N(C)C ZINC000558769035 943653247 /nfs/dbraw/zinc/65/32/47/943653247.db2.gz YBQJSYQHVTVEJG-IBGZPJMESA-N 0 3 417.941 4.166 20 0 HIADHN CCn1cnnc1-c1ccccc1NC(=O)N[C@@H](CN(C)C)c1ccc(Cl)cc1 ZINC000558773133 943656632 /nfs/dbraw/zinc/65/66/32/943656632.db2.gz PXSHTSJJVDJIJR-IBGZPJMESA-N 0 3 412.925 4.043 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)N1CC[C@@H](C(F)(F)F)C2(CCC2)C1 ZINC000558869057 943710546 /nfs/dbraw/zinc/71/05/46/943710546.db2.gz XRIBSOKTKSRVKE-MRXNPFEDSA-N 0 3 419.557 4.112 20 0 HIADHN COc1cccc([C@@H]2[C@H](N[C@H](C)C(=O)Nc3ccc(C)c(C)c3)CCN2C2CC2)c1 ZINC000558894682 943726229 /nfs/dbraw/zinc/72/62/29/943726229.db2.gz IWFMWDZIWNSXMP-DQMJNTIXSA-N 0 3 407.558 4.207 20 0 HIADHN CN(C)C[C@@H](NC(=O)N[C@@H](c1nccs1)c1ccccc1)c1ccc(Cl)cc1 ZINC000558895277 943729916 /nfs/dbraw/zinc/72/99/16/943729916.db2.gz MTFLZGKICMCJCC-RTBURBONSA-N 0 3 414.962 4.488 20 0 HIADHN COc1cccc([C@@H]2[C@H](N[C@@H](C)C(=O)Nc3cc(F)ccc3C)CCN2C2CC2)c1 ZINC000558897048 943730275 /nfs/dbraw/zinc/73/02/75/943730275.db2.gz NVCJALHCYBOFSZ-POCHDABASA-N 0 3 411.521 4.037 20 0 HIADHN CCN1CC[C@H](N[C@@H](C)c2cc(C)c(C(=O)OC)o2)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000558897421 943732558 /nfs/dbraw/zinc/73/25/58/943732558.db2.gz PTLORBUYMNGRAE-XGINMYPSSA-N 0 3 410.436 4.278 20 0 HIADHN COc1cccc([C@@H]2[C@H](NCC(=O)N[C@@H](c3ccccc3)C(C)C)CCN2C2CC2)c1 ZINC000558902665 943737460 /nfs/dbraw/zinc/73/74/60/943737460.db2.gz TXCBECYTSJEHSA-LGPLSSKUSA-N 0 3 421.585 4.076 20 0 HIADHN C[C@H](NCC1CC(c2ccccc2)C1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000558976790 943781125 /nfs/dbraw/zinc/78/11/25/943781125.db2.gz WNSMVEIUFOAMHI-OPFPJEHXSA-N 0 3 413.370 4.485 20 0 HIADHN Cc1ccc(CN(CCO)Cc2cc(Br)cs2)c(-c2cnn(C)c2)c1 ZINC000559072694 943825552 /nfs/dbraw/zinc/82/55/52/943825552.db2.gz JSISIBKBLAFSCL-UHFFFAOYSA-N 0 3 420.376 4.214 20 0 HIADHN C[C@H]1CCCCN1CCC(=O)Nc1cccc(CS(=O)(=O)C2CCCCC2)c1 ZINC000559279252 943889497 /nfs/dbraw/zinc/88/94/97/943889497.db2.gz QNECXZFBZBBMDT-SFHVURJKSA-N 0 3 406.592 4.137 20 0 HIADHN COc1cc(CNCc2ccc(C(C)(F)F)cc2)ccc1OCC(=O)N1CCCC1 ZINC000559311576 943894196 /nfs/dbraw/zinc/89/41/96/943894196.db2.gz JDFNDYOWYKYYAF-UHFFFAOYSA-N 0 3 418.484 4.098 20 0 HIADHN Cc1ccccc1C(C)(C)NCC(=O)N1CCC[C@@H]1c1ccc2c(c1)OCCCO2 ZINC000559326956 943897036 /nfs/dbraw/zinc/89/70/36/943897036.db2.gz UCAJXVZZJASIRX-OAQYLSRUSA-N 0 3 408.542 4.345 20 0 HIADHN CCO[C@@H]1C[C@H](NCc2cccc(NC(=O)c3ccccc3Cl)c2)[C@H]1n1cccn1 ZINC000559364274 943910631 /nfs/dbraw/zinc/91/06/31/943910631.db2.gz KZPQZVHCXADSLQ-BHDDXSALSA-N 0 3 424.932 4.297 20 0 HIADHN COc1ccc2ccc(C(=O)N(C)C3CCN(CCc4ccccn4)CC3)cc2c1 ZINC000559367872 943914267 /nfs/dbraw/zinc/91/42/67/943914267.db2.gz YDUNOTDBENWYIL-UHFFFAOYSA-N 0 3 403.526 4.023 20 0 HIADHN NS(=O)(=O)c1ccc2c(c1)CCC[C@H]2N[C@H]1CC2(CCCC2)Oc2ccccc21 ZINC000559785123 944050352 /nfs/dbraw/zinc/05/03/52/944050352.db2.gz MEIXMVBDKWFBER-RTWAWAEBSA-N 0 3 412.555 4.138 20 0 HIADHN COc1ccc2cc(CN(C)C(=O)[C@H](C)N3CCC(C4CCOCC4)CC3)ccc2c1 ZINC000559815588 944058995 /nfs/dbraw/zinc/05/89/95/944058995.db2.gz UJVLIIHSCGWHHG-IBGZPJMESA-N 0 3 424.585 4.334 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)[C@H](NC(=O)c2ccccc2)c2ccccc2)c1 ZINC000559814498 944059295 /nfs/dbraw/zinc/05/92/95/944059295.db2.gz NSQXCNTXVKCPGM-HSZRJFAPSA-N 0 3 401.510 4.166 20 0 HIADHN COc1ccc2ccccc2c1-c1cc(CN[C@@H]2CCCC[C@@H]2N2CCOCC2)on1 ZINC000559841405 944063933 /nfs/dbraw/zinc/06/39/33/944063933.db2.gz JQZBAMGYBLMZGK-GGAORHGYSA-N 0 3 421.541 4.236 20 0 HIADHN CCc1noc(C)c1-c1noc([C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)n1 ZINC000559915013 944083812 /nfs/dbraw/zinc/08/38/12/944083812.db2.gz IKUKVEKIXKTOOH-IBGZPJMESA-N 0 3 406.408 4.301 20 0 HIADHN CS(=O)(=O)c1ccc(OCCNC2(c3ccc(Cl)c(Cl)c3)CC2)cc1 ZINC000559981094 944109071 /nfs/dbraw/zinc/10/90/71/944109071.db2.gz DRSVLBSYXXLKQO-UHFFFAOYSA-N 0 3 400.327 4.055 20 0 HIADHN COCC1(c2noc(-c3cccc(CN(C)Cc4ccccc4)c3)n2)CCOCC1 ZINC000560044336 944137922 /nfs/dbraw/zinc/13/79/22/944137922.db2.gz TXMVRLWHYBZKJL-UHFFFAOYSA-N 0 3 407.514 4.063 20 0 HIADHN COC(=O)CC[C@H](NCc1cccc(I)c1)c1ccccc1 ZINC000560048592 944140581 /nfs/dbraw/zinc/14/05/81/944140581.db2.gz MWTZEKAXADAYHN-KRWDZBQOSA-N 0 3 409.267 4.075 20 0 HIADHN FC(F)(F)c1cccc([C@@H](NCc2cnc(N3CCCC3)nc2)C2CCOCC2)c1 ZINC000560094207 944156612 /nfs/dbraw/zinc/15/66/12/944156612.db2.gz LKTXMAPBCRPGFH-FQEVSTJZSA-N 0 3 420.479 4.353 20 0 HIADHN Cc1sc([C@@H](C)NC(=O)N2CCN3CCC2CC3)nc1-c1ccc(Cl)cc1 ZINC000560106770 944161937 /nfs/dbraw/zinc/16/19/37/944161937.db2.gz YVRZNIMEGFWTGI-CYBMUJFWSA-N 0 3 404.967 4.323 20 0 HIADHN CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)N[C@H]1CCN(C2CC2)C1 ZINC000560116598 944165733 /nfs/dbraw/zinc/16/57/33/944165733.db2.gz LUSCIKCURWGFAX-AWEZNQCLSA-N 0 3 409.374 4.102 20 0 HIADHN O=C(CNC[C@@H]1CCCO1)Nc1ccc(Sc2ccc(Br)cc2)cc1 ZINC000560137366 944174838 /nfs/dbraw/zinc/17/48/38/944174838.db2.gz ITZLWXLPZUMZHB-INIZCTEOSA-N 0 3 421.360 4.307 20 0 HIADHN CC(C)N(C(=O)CN[C@@H](c1cccc(C(F)(F)F)c1)C1CCOCC1)C(C)C ZINC000560179610 944188354 /nfs/dbraw/zinc/18/83/54/944188354.db2.gz RMTXKGSEHFZLPO-HXUWFJFHSA-N 0 3 400.485 4.408 20 0 HIADHN Cc1ccc(S(=O)(=O)CCCN[C@H](c2cncc(Br)c2)C2CC2)cc1 ZINC000560180141 944189549 /nfs/dbraw/zinc/18/95/49/944189549.db2.gz KXDDEABJNGKQEP-IBGZPJMESA-N 0 3 423.376 4.057 20 0 HIADHN Cc1cccc(CNC(=O)CN[C@H](c2cccc(C(F)(F)F)c2)C2CCOCC2)c1 ZINC000560180005 944189926 /nfs/dbraw/zinc/18/99/26/944189926.db2.gz JTQIFFSEWZYRQE-QFIPXVFZSA-N 0 3 420.475 4.388 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)c3cc(Cl)c(F)cc3Cl)CC2)C[C@H](C)O1 ZINC000560207511 944197381 /nfs/dbraw/zinc/19/73/81/944197381.db2.gz QLGGKEOKEHQNIT-KBPBESRZSA-N 0 3 417.352 4.484 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)[C@@H]2C[C@@H]2c2ccccc2C(F)(F)F)cc1 ZINC000560245936 944205793 /nfs/dbraw/zinc/20/57/93/944205793.db2.gz MXDMRYYEQUIKBI-GGPKGHCWSA-N 0 3 406.448 4.237 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)cc1 ZINC000560245938 944206240 /nfs/dbraw/zinc/20/62/40/944206240.db2.gz MXDMRYYEQUIKBI-NSHGMRRFSA-N 0 3 406.448 4.237 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)c2cnc(-c3ccc(F)c(F)c3)s2)cc1 ZINC000560248161 944206521 /nfs/dbraw/zinc/20/65/21/944206521.db2.gz CDTGRZXUYWCPGJ-GOSISDBHSA-N 0 3 417.481 4.130 20 0 HIADHN COc1ccc([C@@H](CN(C)C)N[C@H]2CCc3c2cc(Br)cc3F)cc1 ZINC000560261527 944210463 /nfs/dbraw/zinc/21/04/63/944210463.db2.gz ZJNSMXWPZGFDSP-VQTJNVASSA-N 0 3 407.327 4.477 20 0 HIADHN Cc1n[nH]cc1C1CCN(Cc2cn(Cc3ccccc3)nc2-c2cccnc2)CC1 ZINC000560266747 944212522 /nfs/dbraw/zinc/21/25/22/944212522.db2.gz QOTJYKNUDCVQOU-UHFFFAOYSA-N 0 3 412.541 4.405 20 0 HIADHN O=C(c1cnc(-c2ccccc2)s1)N1CCN(c2ccnc3ccccc32)CC1 ZINC000560489945 944237535 /nfs/dbraw/zinc/23/75/35/944237535.db2.gz RDIMUMPNMIXOQH-UHFFFAOYSA-N 0 3 400.507 4.321 20 0 HIADHN COc1ccc([C@@H](Cc2ccncc2)NCc2ccnc(OCC(F)(F)F)c2)cc1 ZINC000560514679 944240598 /nfs/dbraw/zinc/24/05/98/944240598.db2.gz QSZSHHRZELEJCG-HXUWFJFHSA-N 0 3 417.431 4.500 20 0 HIADHN CCOc1cc(C[NH2+]CC2(c3ccc(OC)cc3)CCOCC2)cc(Cl)c1[O-] ZINC000560554705 944252577 /nfs/dbraw/zinc/25/25/77/944252577.db2.gz OERIEVZLCNABMW-UHFFFAOYSA-N 0 3 405.922 4.291 20 0 HIADHN COc1cc(CN2CCC(CO)(c3ccccc3)CC2)ccc1OCC(F)(F)F ZINC000560557133 944253076 /nfs/dbraw/zinc/25/30/76/944253076.db2.gz WMMHNZMBIPIEMG-UHFFFAOYSA-N 0 3 409.448 4.162 20 0 HIADHN Brc1cccc(-c2ccc(CN3CCC(O[C@@H]4CCOC4)CC3)o2)c1 ZINC000560565244 944255855 /nfs/dbraw/zinc/25/58/55/944255855.db2.gz ZJMKDADVMUDYCV-LJQANCHMSA-N 0 3 406.320 4.479 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O[C@@H]3CCOC3)CC2)c1)c1ccc(Cl)cc1 ZINC000560562706 944256300 /nfs/dbraw/zinc/25/63/00/944256300.db2.gz SCXJQUKGYCNFDF-JOCHJYFZSA-N 0 3 414.933 4.362 20 0 HIADHN OCC1([C@H](NCc2cccc(I)c2)c2ccccc2)CCC1 ZINC000560569787 944258356 /nfs/dbraw/zinc/25/83/56/944258356.db2.gz RFUGJXHJYVRPND-GOSISDBHSA-N 0 3 407.295 4.285 20 0 HIADHN C[C@@H](Oc1ccc(-c2ccccc2)cc1)C(=O)Nc1cccc(CN2CC[C@H](O)C2)c1 ZINC000560675478 944290364 /nfs/dbraw/zinc/29/03/64/944290364.db2.gz LXYZFDDTQFQDKY-DVECYGJZSA-N 0 3 416.521 4.326 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000560676595 944291045 /nfs/dbraw/zinc/29/10/45/944291045.db2.gz PPRGKCQDBFRQDS-SLFFLAALSA-N 0 3 404.432 4.014 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCCCOc3ccccc3C)c(C)c2)CC1 ZINC000560690577 944296419 /nfs/dbraw/zinc/29/64/19/944296419.db2.gz QPTLTESMPZFTIS-UHFFFAOYSA-N 0 3 410.562 4.036 20 0 HIADHN CC(C)COc1cccc(NC(=O)N(C)C2CCN(CCc3ccccn3)CC2)c1 ZINC000560847892 944356662 /nfs/dbraw/zinc/35/66/62/944356662.db2.gz PFXSPXHOMAOHKH-UHFFFAOYSA-N 0 3 410.562 4.287 20 0 HIADHN C[C@H](N[C@@H](C)c1cccc(OC(F)(F)F)c1)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000560885482 944364657 /nfs/dbraw/zinc/36/46/57/944364657.db2.gz XBMYIXJELGUKCO-KBPBESRZSA-N 0 3 416.465 4.247 20 0 HIADHN CCc1cnccc1[C@@H](C)NC(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1 ZINC000561014514 944396584 /nfs/dbraw/zinc/39/65/84/944396584.db2.gz AYANBNFXJPXVDI-MRXNPFEDSA-N 0 3 422.495 4.497 20 0 HIADHN CO[C@@H]1CCC[C@@H](C(=O)N(Cc2ccncc2)[C@H]2CCCN(Cc3ccccc3)C2)C1 ZINC000561076775 944430846 /nfs/dbraw/zinc/43/08/46/944430846.db2.gz YIAZXBCGUUDNDV-DSNGMDLFSA-N 0 3 421.585 4.280 20 0 HIADHN C[C@@H](C(=O)N(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1)C1CCOCC1 ZINC000561077318 944432519 /nfs/dbraw/zinc/43/25/19/944432519.db2.gz SSPMOCXZGTWGFH-BWKNWUBXSA-N 0 3 421.585 4.138 20 0 HIADHN COc1ccccc1[C@@H]1CC[C@@H](C)CN1C(=O)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000561092376 944445580 /nfs/dbraw/zinc/44/55/80/944445580.db2.gz XWCNYYGBLUUQKF-NWSQWKLXSA-N 0 3 407.558 4.302 20 0 HIADHN C[C@H](NC(=O)N1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1)c1ccccc1Cl ZINC000561158726 944489252 /nfs/dbraw/zinc/48/92/52/944489252.db2.gz HNYUEXVBMWWVOF-BZSNNMDCSA-N 0 3 407.986 4.322 20 0 HIADHN COc1cc(NC(=O)N(CCCc2ccccc2)CCN(C)C)c(OC)cc1Cl ZINC000561329896 944552800 /nfs/dbraw/zinc/55/28/00/944552800.db2.gz VLBRCLHXOYKPQV-UHFFFAOYSA-N 0 3 419.953 4.386 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2[nH]c3ccccc3c2Br)N(C)C)cc1 ZINC000561377703 944568334 /nfs/dbraw/zinc/56/83/34/944568334.db2.gz AYCDDRSSJKVUPH-KRWDZBQOSA-N 0 3 400.320 4.272 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)NCc1nnc(C(C)(C)C)s1)c1ccc(Cl)cc1 ZINC000561600236 944698259 /nfs/dbraw/zinc/69/82/59/944698259.db2.gz FZLWMNWOJKJODF-INIZCTEOSA-N 0 3 424.014 4.371 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)CSc1ncnc2sc(C)c(C)c21)c1ccco1 ZINC000561610313 944706534 /nfs/dbraw/zinc/70/65/34/944706534.db2.gz KLSWZPPGSUMBPM-IUODEOHRSA-N 0 3 418.588 4.239 20 0 HIADHN COc1ccc(C2(C(=O)NC[C@H](c3ccc(OC(C)C)cc3)N(C)C)CCC2)cc1 ZINC000561615156 944709729 /nfs/dbraw/zinc/70/97/29/944709729.db2.gz NLSUZSNFNNPZLX-HSZRJFAPSA-N 0 3 410.558 4.323 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)c2ncoc2-c2ccc(F)cc2)N(C)C)cc1 ZINC000561614605 944709871 /nfs/dbraw/zinc/70/98/71/944709871.db2.gz HNGQGEXFCASYPZ-HXUWFJFHSA-N 0 3 411.477 4.301 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)C(C)(C)Cc2nc3ccccc3[nH]2)N(C)C)cc1 ZINC000561647855 944726417 /nfs/dbraw/zinc/72/64/17/944726417.db2.gz OAIZRCKQIOQQME-QFIPXVFZSA-N 0 3 422.573 4.338 20 0 HIADHN CN(CCCN(C)C(=O)C1(c2ccc(F)cc2F)CCCC1)Cc1ccncc1 ZINC000561709490 944756565 /nfs/dbraw/zinc/75/65/65/944756565.db2.gz OBJJTOAATWEVSP-UHFFFAOYSA-N 0 3 401.501 4.152 20 0 HIADHN COCCOCc1ccc(CN[C@@H](C)c2ccc(OC)c(Br)c2)cc1 ZINC000561738293 944773041 /nfs/dbraw/zinc/77/30/41/944773041.db2.gz DBBALVRWVMCRTP-HNNXBMFYSA-N 0 3 408.336 4.472 20 0 HIADHN Cc1nn(Cc2ccccc2)c2sc(C(=O)N3CC[C@H](N4CCCC4)[C@H]3C)cc12 ZINC000561749580 944777870 /nfs/dbraw/zinc/77/78/70/944777870.db2.gz VDOSQXBLUULQNM-XLIONFOSSA-N 0 3 408.571 4.153 20 0 HIADHN C[C@H]1C[C@@H]1N1CCN(C(=O)C(C)(C)c2csc(-c3ccccc3F)n2)C[C@@H](C)C1 ZINC000561761002 944783929 /nfs/dbraw/zinc/78/39/29/944783929.db2.gz KEUXCWMFVAVXEB-BXWFABGCSA-N 0 3 415.578 4.416 20 0 HIADHN Cc1nc(-c2cccc(C(F)(F)F)c2)[nH]c1C(=O)N1CCN([C@@H]2C[C@@H]2C)C[C@@H](C)C1 ZINC000561761327 944783974 /nfs/dbraw/zinc/78/39/74/944783974.db2.gz FVGCWTPRZKUPMU-QWQRMKEZSA-N 0 3 420.479 4.206 20 0 HIADHN C[C@H](NCC(=O)NCc1cnn(-c2ccccc2)c1)c1ccc(F)c2ccccc21 ZINC000561787730 944796593 /nfs/dbraw/zinc/79/65/93/944796593.db2.gz OWPPMKFFSMYPTM-KRWDZBQOSA-N 0 3 402.473 4.132 20 0 HIADHN COc1ccc(Br)c(NC(=O)N[C@H]2CCN(Cc3ccccc3)[C@@H]2C)c1 ZINC000561799518 944801414 /nfs/dbraw/zinc/80/14/14/944801414.db2.gz NSTNGYFTUZPTKV-KDOFPFPSSA-N 0 3 418.335 4.242 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)N[C@@H]2CCN(Cc3ccccc3)[C@@H]2C)c(C)c1 ZINC000561802978 944803770 /nfs/dbraw/zinc/80/37/70/944803770.db2.gz CJFPVBXGGUALHH-YCRNBWNJSA-N 0 3 422.573 4.308 20 0 HIADHN C[C@H](NC(=O)Cc1noc(C2CCN(C3CC3)CC2)n1)c1ccc(Cl)cc1Cl ZINC000561922531 944858616 /nfs/dbraw/zinc/85/86/16/944858616.db2.gz LVFYZJODOLTKIH-LBPRGKRZSA-N 0 3 423.344 4.138 20 0 HIADHN C[C@H]1CCc2c(sc3nc(CCN4CCC(OC5CCCC5)CC4)nc(N)c32)C1 ZINC000561998526 944890131 /nfs/dbraw/zinc/89/01/31/944890131.db2.gz KFLFUZWZHGJUFH-HNNXBMFYSA-N 0 3 414.619 4.364 20 0 HIADHN CN1CC[C@@H](NCc2cn3ccc(Br)cc3n2)[C@H]1c1ccc(Cl)cc1 ZINC000562067927 944920540 /nfs/dbraw/zinc/92/05/40/944920540.db2.gz AJVTYDVGFIFCOB-IEBWSBKVSA-N 0 3 419.754 4.285 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)Nc1cc(C(=O)NC)ccc1C)c1ccc(Cl)cc1 ZINC000562073415 944923496 /nfs/dbraw/zinc/92/34/96/944923496.db2.gz DVLANUVATQVKTA-FQEVSTJZSA-N 0 3 416.953 4.213 20 0 HIADHN COc1ccc([C@H](C)NCCC(=O)Nc2cc(Br)ccc2C)cc1O ZINC000562082728 944927996 /nfs/dbraw/zinc/92/79/96/944927996.db2.gz ZAFJOTWPZSIFTJ-ZDUSSCGKSA-N 0 3 407.308 4.151 20 0 HIADHN CC(C)Cc1ccc([C@@H](CNC(=O)Nc2ccc(Cl)c(C(N)=O)c2)N(C)C)cc1 ZINC000562089058 944932283 /nfs/dbraw/zinc/93/22/83/944932283.db2.gz NSPDBZZPXJTCHF-HXUWFJFHSA-N 0 3 416.953 4.062 20 0 HIADHN C[C@H](NC(=O)Nc1cc(F)ccc1OC[C@@H]1CCCO1)[C@H](c1ccccc1)N(C)C ZINC000562161879 944989290 /nfs/dbraw/zinc/98/92/90/944989290.db2.gz GEYZDGZZSRFOQE-XWFZLUIHSA-N 0 3 415.509 4.196 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1ccc(OC)c(Br)c1)c1ccco1 ZINC000562169186 944999599 /nfs/dbraw/zinc/99/95/99/944999599.db2.gz QNTJARXHEWBMQG-SWLSCSKDSA-N 0 3 410.312 4.302 20 0 HIADHN Cc1cc(C(=O)N(Cc2ccccc2Br)C2CCN(C)CC2)c(C)n1C ZINC000562249211 945042963 /nfs/dbraw/zinc/04/29/63/945042963.db2.gz PVTIBWNERAYWRF-UHFFFAOYSA-N 0 3 418.379 4.141 20 0 HIADHN CN1CCC(N(Cc2ccccc2Br)C(=O)NCCCC2CC2)CC1 ZINC000562259790 945047978 /nfs/dbraw/zinc/04/79/78/945047978.db2.gz INTWYHULXAHKON-UHFFFAOYSA-N 0 3 408.384 4.245 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1cc(Cl)c(F)c(C(=O)OC)c1)c1ccco1 ZINC000562265700 945050152 /nfs/dbraw/zinc/05/01/52/945050152.db2.gz LKMRQPYTYAVXMD-XHDPSFHLSA-N 0 3 411.861 4.110 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)Nc1cc(Cl)c(F)c(C(=O)OC)c1)c1ccco1 ZINC000562265698 945050576 /nfs/dbraw/zinc/05/05/76/945050576.db2.gz LKMRQPYTYAVXMD-IAQYHMDHSA-N 0 3 411.861 4.110 20 0 HIADHN COc1cc(CNCc2ccc3cnn(C)c3c2)cc(OC)c1OCc1ccccc1 ZINC000562281544 945052015 /nfs/dbraw/zinc/05/20/15/945052015.db2.gz ZYALWTHPHLNAGK-UHFFFAOYSA-N 0 3 417.509 4.459 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)Nc1cc(-c2ccc(F)cc2F)nn1C)c1ccco1 ZINC000562276380 945052240 /nfs/dbraw/zinc/05/22/40/945052240.db2.gz DMOMOYBCVIZVMI-ACJLOTCBSA-N 0 3 417.460 4.209 20 0 HIADHN CSc1ccc([C@H](CNC(=O)Cc2csc(-c3ccccc3)n2)N(C)C)cc1 ZINC000564092296 945375521 /nfs/dbraw/zinc/37/55/21/945375521.db2.gz GWGUBLUUWQSZCG-FQEVSTJZSA-N 0 3 411.596 4.494 20 0 HIADHN CNC(=O)c1cccc(CN[C@H]2CCCc3c4cc(Br)ccc4[nH]c32)c1 ZINC000564142897 945398588 /nfs/dbraw/zinc/39/85/88/945398588.db2.gz DUKXZVKFASGQQF-IBGZPJMESA-N 0 3 412.331 4.457 20 0 HIADHN COc1ccc(SCCC(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)cc1OC ZINC000564231214 945448035 /nfs/dbraw/zinc/44/80/35/945448035.db2.gz OEUTZLWJIDTZFG-GOSISDBHSA-N 0 3 422.978 4.259 20 0 HIADHN COc1ccc([C@@H](NCCCc2cnccc2C)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000564299794 945505876 /nfs/dbraw/zinc/50/58/76/945505876.db2.gz XUOXDCXHGTWMOC-XMMPIXPASA-N 0 3 424.566 4.114 20 0 HIADHN CCc1ccc([C@H](C)NC(=O)[C@@H](C)N[C@H]2c3ccccc3CC23CCOCC3)cc1 ZINC000564407376 945559192 /nfs/dbraw/zinc/55/91/92/945559192.db2.gz CRBVLYGRFBFCEM-GLDPYIMESA-N 0 3 406.570 4.499 20 0 HIADHN C[C@H](NCc1cc(O)cc(C(F)(F)F)c1)c1cc(F)ccc1N1CCN(C)CC1 ZINC000564407591 945560343 /nfs/dbraw/zinc/56/03/43/945560343.db2.gz IHKBYOGEAVBKQA-AWEZNQCLSA-N 0 3 411.443 4.153 20 0 HIADHN C[C@@H](N[C@H]1c2ccccc2CC12CCOCC2)C(=O)Nc1nc2ccccc2s1 ZINC000564410365 945562365 /nfs/dbraw/zinc/56/23/65/945562365.db2.gz VQXYQTZXCWANNL-QRWLVFNGSA-N 0 3 407.539 4.307 20 0 HIADHN COC(=O)[C@@H](C)Cc1ccc(NC(=O)NC[C@@H](c2cccs2)N2CCCC2)cc1 ZINC000564455792 945599936 /nfs/dbraw/zinc/59/99/36/945599936.db2.gz WCJLSHQCBHUPQG-LPHOPBHVSA-N 0 3 415.559 4.058 20 0 HIADHN COc1cccc(OC)c1OC[C@H](O)CN1CCCCC[C@@H]1/C=C\c1cccs1 ZINC000564605850 945702114 /nfs/dbraw/zinc/70/21/14/945702114.db2.gz SQNNJLTWDQQJJA-QKXOAMIZSA-N 0 3 417.571 4.463 20 0 HIADHN CN(C(=O)N[C@H](c1ccccc1)[C@@H]1CCOC1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000565093837 945772988 /nfs/dbraw/zinc/77/29/88/945772988.db2.gz RNWZTRFQFAPARH-WXFUMESZSA-N 0 3 407.558 4.070 20 0 HIADHN CCCN(C)[C@H](CNC(=O)C[C@@H](NC(C)=O)c1ccccc1)c1ccc(Cl)cc1 ZINC000565131736 945782573 /nfs/dbraw/zinc/78/25/73/945782573.db2.gz GQEVWKMPSCGICX-FGZHOGPDSA-N 0 3 415.965 4.107 20 0 HIADHN CSc1ccc([C@H](CNC(=O)Cc2csc(-c3ccoc3)n2)N(C)C)cc1 ZINC000565325279 945811234 /nfs/dbraw/zinc/81/12/34/945811234.db2.gz KDHOMWGJGXFLEF-SFHVURJKSA-N 0 3 401.557 4.087 20 0 HIADHN CC(C)(C)NS(=O)(=O)c1ccccc1CNC1CC(c2cc(F)cc(F)c2)C1 ZINC000565567562 945850352 /nfs/dbraw/zinc/85/03/52/945850352.db2.gz UGSWRGUQDYZFIZ-UHFFFAOYSA-N 0 3 408.514 4.077 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)cc1C(=O)N[C@H](CN(C)C)c1ccc(F)cc1 ZINC000565739284 945876461 /nfs/dbraw/zinc/87/64/61/945876461.db2.gz YLHBAXFCWKXQTA-HXUWFJFHSA-N 0 3 400.885 4.006 20 0 HIADHN CCN1CCN(c2ccc(N[C@@H](C)c3ccc(Br)cn3)c(C)c2)CC1 ZINC000565809412 945889958 /nfs/dbraw/zinc/88/99/58/945889958.db2.gz QLCJSSAGHUJZPL-INIZCTEOSA-N 0 3 403.368 4.468 20 0 HIADHN CC(C)c1nc(C(=O)N(CCN(C)C)CC2CCCCC2)nn1-c1cccc(F)c1 ZINC000565857052 945895112 /nfs/dbraw/zinc/89/51/12/945895112.db2.gz DSUDEOLGXWQVHH-UHFFFAOYSA-N 0 3 415.557 4.114 20 0 HIADHN CCCN(CC)C[C@H](C)N[C@@H](c1ccc(F)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000566767680 946095395 /nfs/dbraw/zinc/09/53/95/946095395.db2.gz MKFFQXYOCSOXST-JTSKRJEESA-N 0 3 406.567 4.029 20 0 HIADHN CSc1ccc([C@H](CNC(=O)c2cnc(Oc3ccccc3)cn2)N(C)C)cc1 ZINC000566937329 946176775 /nfs/dbraw/zinc/17/67/75/946176775.db2.gz VRSNEFBUDUJVII-FQEVSTJZSA-N 0 3 408.527 4.024 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)[C@@H](C)CN1c1nnc(-c2cccc3cccnc32)n1C ZINC000566942985 946180961 /nfs/dbraw/zinc/18/09/61/946180961.db2.gz VRBGMYRTQFMNNI-RBUKOAKNSA-N 0 3 412.541 4.130 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)c1ccc(C(=O)Nc2ccccc2)cc1)c1ccco1 ZINC000567016313 946218212 /nfs/dbraw/zinc/21/82/12/946218212.db2.gz UYNIKEMTPUANPD-DYESRHJHSA-N 0 3 405.498 4.391 20 0 HIADHN C/C(=C\c1ccccc1OC(F)F)CNCc1ccncc1OC[C@@H]1CCOC1 ZINC000567033941 946222853 /nfs/dbraw/zinc/22/28/53/946222853.db2.gz JBJRQZNSAIQIQR-BRVCPTFNSA-N 0 3 404.457 4.291 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)[C@H]1CCc2cccc(O)c21 ZINC000567058044 946228532 /nfs/dbraw/zinc/22/85/32/946228532.db2.gz NZHXRSFDZAPMFE-SFHVURJKSA-N 0 3 406.448 4.031 20 0 HIADHN COc1cccc(CN(C)C(=O)CN[C@@H](C)c2ccc(F)c3ccccc32)c1OC ZINC000567080182 946235415 /nfs/dbraw/zinc/23/54/15/946235415.db2.gz CGRZZQCVYMCLNF-INIZCTEOSA-N 0 3 410.489 4.305 20 0 HIADHN C[C@H](NCC(=O)Nc1ccccc1C(=O)c1ccccc1)[C@@H]1COc2ccccc21 ZINC000567147553 946252693 /nfs/dbraw/zinc/25/26/93/946252693.db2.gz QVILZGODXBWQPL-UWJYYQICSA-N 0 3 400.478 4.010 20 0 HIADHN Cc1cccnc1NC(=O)N(Cc1ccccc1Br)C1CCN(C)CC1 ZINC000567201678 946270729 /nfs/dbraw/zinc/27/07/29/946270729.db2.gz HOHLUZSYEPPYDY-UHFFFAOYSA-N 0 3 417.351 4.281 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)Nc1ccnc(Sc2ccccn2)c1)c1ccco1 ZINC000567301043 946301477 /nfs/dbraw/zinc/30/14/77/946301477.db2.gz KHAOLCKKBZHFPA-NVXWUHKLSA-N 0 3 411.531 4.472 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)c1nn(-c2ccccc2Cl)cc1C)c1ccco1 ZINC000567420790 946332653 /nfs/dbraw/zinc/33/26/53/946332653.db2.gz ZRJHQUSBGGSNQV-WBVHZDCISA-N 0 3 400.910 4.286 20 0 HIADHN Fc1ccc([C@H](NCCc2cccc(OCc3ccccc3)c2)c2c[nH]nn2)cc1 ZINC000568083028 946459367 /nfs/dbraw/zinc/45/93/67/946459367.db2.gz CSKMQOLKJGTVNH-DEOSSOPVSA-N 0 3 402.473 4.445 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccc(O)cc1)C(=O)c1cscc1Br ZINC000568119166 946467759 /nfs/dbraw/zinc/46/77/59/946467759.db2.gz JCFBAUOJDQGUPL-HNNXBMFYSA-N 0 3 423.376 4.343 20 0 HIADHN O=C(CN[C@@H]1c2ccccc2CC12CCOCC2)Nc1ccccc1Br ZINC000568143466 946480390 /nfs/dbraw/zinc/48/03/90/946480390.db2.gz TWVDQOVTVGYNFB-HXUWFJFHSA-N 0 3 415.331 4.071 20 0 HIADHN CC(C)Oc1ccc(Cl)cc1NC(=O)N1CCC(CN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000568518233 946574483 /nfs/dbraw/zinc/57/44/83/946574483.db2.gz VHRZQAKRWIPGDM-IRXDYDNUSA-N 0 3 423.985 4.480 20 0 HIADHN CCOc1ccc(C(C)=O)cc1CN[C@H]1CCN(C2CC2)[C@@H]1c1cccc(OC)c1 ZINC000568657529 946640557 /nfs/dbraw/zinc/64/05/57/946640557.db2.gz WQOLETGSENBFKJ-UKILVPOCSA-N 0 3 408.542 4.364 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccnc2)C1)N(CCC(F)(F)F)Cc1ccccc1 ZINC000568702904 946667890 /nfs/dbraw/zinc/66/78/90/946667890.db2.gz YAURHYPOUHDKMG-HXUWFJFHSA-N 0 3 405.464 4.275 20 0 HIADHN Cc1c(C(=O)N[C@H](CN(C)C)c2ccc(F)cc2)cnn1-c1ccccc1Cl ZINC000568802364 946702422 /nfs/dbraw/zinc/70/24/22/946702422.db2.gz VSUOXEIUTIUELD-LJQANCHMSA-N 0 3 400.885 4.006 20 0 HIADHN CSc1ccc([C@H](CNC(=O)c2cc(C)n(-c3nccs3)c2C)N(C)C)cc1 ZINC000568909693 946745820 /nfs/dbraw/zinc/74/58/20/946745820.db2.gz MTZHERRNSBPVNG-IBGZPJMESA-N 0 3 414.600 4.305 20 0 HIADHN CCN(CC(=O)N1N=C(c2ccco2)C[C@H]1c1cccs1)[C@@H]1CCOC(C)(C)C1 ZINC000568919522 946756345 /nfs/dbraw/zinc/75/63/45/946756345.db2.gz BBWWSENUZORRHD-AEFFLSMTSA-N 0 3 415.559 4.298 20 0 HIADHN CCN(CC(=O)N1N=C(c2ccco2)C[C@@H]1c1cccs1)[C@H]1CCOC(C)(C)C1 ZINC000568919523 946758222 /nfs/dbraw/zinc/75/82/22/946758222.db2.gz BBWWSENUZORRHD-FUHWJXTLSA-N 0 3 415.559 4.298 20 0 HIADHN Cc1cc(=O)[nH]c2cc(C(=O)NC[C@H](c3ccc(CC(C)C)cc3)N(C)C)ccc12 ZINC000569033227 946803215 /nfs/dbraw/zinc/80/32/15/946803215.db2.gz IGMSQASZZYRWKU-HSZRJFAPSA-N 0 3 405.542 4.480 20 0 HIADHN C/C(=C\c1cccc(C(F)(F)F)c1)CN1CCC(C(=O)Nc2nncs2)CC1 ZINC000569038882 946804751 /nfs/dbraw/zinc/80/47/51/946804751.db2.gz LECICEZNQJGXHV-UKTHLTGXSA-N 0 3 410.465 4.311 20 0 HIADHN O=C1NC2(CCCC2)C(=O)N1c1cccc(CN[C@@H]2CCCc3cc(F)ccc32)c1 ZINC000569055482 946812295 /nfs/dbraw/zinc/81/22/95/946812295.db2.gz HRUSUPYMIJRCFI-OAQYLSRUSA-N 0 3 407.489 4.362 20 0 HIADHN CC1(C)[C@H](C(F)(F)F)CCN1C(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000569108985 946816992 /nfs/dbraw/zinc/81/69/92/946816992.db2.gz UOUNQGGXPJKDNH-JKSUJKDBSA-N 0 3 404.423 4.333 20 0 HIADHN CC(C)Cc1ccc([C@H](CNC(=O)c2ccncc2Br)N(C)C)cc1 ZINC000569162126 946829083 /nfs/dbraw/zinc/82/90/83/946829083.db2.gz PLEDVDPXQIBDHO-IBGZPJMESA-N 0 3 404.352 4.075 20 0 HIADHN CSc1ccc(NC(=O)CN[C@@H]2CCN(C(C)C)[C@H]2c2ccc(F)c(F)c2)cc1 ZINC000569359497 946860598 /nfs/dbraw/zinc/86/05/98/946860598.db2.gz WJBJQUYGKGJGAY-IRLDBZIGSA-N 0 3 419.541 4.439 20 0 HIADHN CC(C)C[C@@H](NCC(=O)N1CCC(C(=O)Nc2ccccc2)CC1)c1cccs1 ZINC000569410110 946870675 /nfs/dbraw/zinc/87/06/75/946870675.db2.gz GKWGAGVFDMUTAN-HXUWFJFHSA-N 0 3 413.587 4.302 20 0 HIADHN Cc1cc(C(=O)NC(C)C)ccc1NC(=O)N[C@@H](CN(C)C)c1ccc(Cl)cc1 ZINC000569475148 946877672 /nfs/dbraw/zinc/87/76/72/946877672.db2.gz FBZRIKQRIIXWAJ-FQEVSTJZSA-N 0 3 416.953 4.211 20 0 HIADHN C[C@H](N[C@H]1CCN(C)[C@H]1c1ccccc1)C(=O)N(c1nccs1)C1CCCCC1 ZINC000569533596 946888183 /nfs/dbraw/zinc/88/81/83/946888183.db2.gz LXZYEORLGYNJIS-YYWHXJBOSA-N 0 3 412.603 4.232 20 0 HIADHN COc1cccc(C(=O)CCCC(=O)N2C[C@@H]3CCN(Cc4ccccc4)C[C@H]3C2)c1 ZINC000569636498 946911912 /nfs/dbraw/zinc/91/19/12/946911912.db2.gz KFTMXSSYUKAGTN-GOTSBHOMSA-N 0 3 420.553 4.029 20 0 HIADHN CCOc1cc(CN(CCO)[C@@H]2CCc3ccccc32)cc(Br)c1OC ZINC000569754383 946982664 /nfs/dbraw/zinc/98/26/64/946982664.db2.gz RYUPGTPDRVHCDC-LJQANCHMSA-N 0 3 420.347 4.338 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)c1cncc(-c2ccc(Cl)cc2)c1 ZINC000569754702 946987430 /nfs/dbraw/zinc/98/74/30/946987430.db2.gz LGGKQQALZZDTDA-QFIPXVFZSA-N 0 3 407.901 4.221 20 0 HIADHN CC(C)[C@H](O)C1(CNCc2cc(Br)ccc2OCc2ccccn2)CC1 ZINC000569836342 947015373 /nfs/dbraw/zinc/01/53/73/947015373.db2.gz JYNCVWJKLXPPEU-FQEVSTJZSA-N 0 3 419.363 4.310 20 0 HIADHN Cc1c(C(=O)NC2CCN(CCOc3ccc(Cl)cc3)CC2)ccn1C(C)C ZINC000569991483 947063399 /nfs/dbraw/zinc/06/33/99/947063399.db2.gz BDHSWILRWSXWTE-UHFFFAOYSA-N 0 3 403.954 4.304 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)c2csc(Br)c2)N(C)C)cc1 ZINC000570191816 947129390 /nfs/dbraw/zinc/12/93/90/947129390.db2.gz XTLPJBNCTCDQTQ-INIZCTEOSA-N 0 3 411.365 4.331 20 0 HIADHN CCOC(=O)c1c(C)c(C)sc1NC(=O)C[C@H](C)N[C@H](C)c1cnn(C(C)C)c1 ZINC000570195148 947134938 /nfs/dbraw/zinc/13/49/38/947134938.db2.gz WQPUVENMVKRGND-DZGCQCFKSA-N 0 3 420.579 4.387 20 0 HIADHN COC(=O)c1coc([C@@H](C)NC2CCN(Cc3coc(-c4ccccc4)n3)CC2)c1 ZINC000570359978 947216905 /nfs/dbraw/zinc/21/69/05/947216905.db2.gz OBPVPMFLZSAXSI-MRXNPFEDSA-N 0 3 409.486 4.036 20 0 HIADHN Cc1cccc(C)c1[C@H](C)NCC(=O)N1c2ccccc2NC(=O)C[C@H]1C(F)(F)F ZINC000570441366 947249900 /nfs/dbraw/zinc/24/99/00/947249900.db2.gz NKZJYIKFBBQXTM-YJBOKZPZSA-N 0 3 419.447 4.260 20 0 HIADHN CCOc1cc(CN(C)[C@@H]2CCCc3ccccc32)nc2nc(C(F)(F)F)nn21 ZINC000570453592 947251706 /nfs/dbraw/zinc/25/17/06/947251706.db2.gz CDYCOUYCEUGEHG-MRXNPFEDSA-N 0 3 405.424 4.051 20 0 HIADHN COc1ccc(C)cc1NC(=O)[C@H](C)N[C@@H]1CCN(C)[C@H]1c1ccc(Cl)cc1 ZINC000570731933 947340046 /nfs/dbraw/zinc/34/00/46/947340046.db2.gz MMLLVAXBVIVRSQ-KLHJMIIUSA-N 0 3 401.938 4.019 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)NCc2sccc2Br)C1 ZINC000570828442 947362658 /nfs/dbraw/zinc/36/26/58/947362658.db2.gz LSIBLPMHOCHYLQ-ZFWWWQNUSA-N 0 3 408.365 4.145 20 0 HIADHN CCc1oc(CNC[C@@H]2CCN(C)[C@H]2c2ccc(Cl)c(F)c2)cc1C(=O)OC ZINC000570869131 947376896 /nfs/dbraw/zinc/37/68/96/947376896.db2.gz BKBJJYIGCROGDC-XOBRGWDASA-N 0 3 408.901 4.204 20 0 HIADHN Cc1cc(C[C@@H](C)NCc2cn3ccc(Br)cc3n2)n(-c2ccccc2)n1 ZINC000570978019 947409158 /nfs/dbraw/zinc/40/91/58/947409158.db2.gz LEDKEYFBJKNUDJ-OAHLLOKOSA-N 0 3 424.346 4.312 20 0 HIADHN Cc1nn(C)c2sc([C@H](C)N[C@H]3CCCN([C@@H](C)c4ccccc4F)C3=O)cc12 ZINC000571067143 947465707 /nfs/dbraw/zinc/46/57/07/947465707.db2.gz MSKBSOOUPAJYNC-DOXZYTNZSA-N 0 3 414.550 4.485 20 0 HIADHN O=C(Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1)c1ocnc1C1CC1 ZINC000571090618 947487913 /nfs/dbraw/zinc/48/79/13/947487913.db2.gz HCIGOZWGZMXXQI-UHFFFAOYSA-N 0 3 416.525 4.169 20 0 HIADHN Cc1cc(N2CCSCC2)ccc1NC(=O)N[C@H](C)CN(C)Cc1ccccc1 ZINC000571201362 947543278 /nfs/dbraw/zinc/54/32/78/947543278.db2.gz OYLOKMOGRWJNFA-LJQANCHMSA-N 0 3 412.603 4.190 20 0 HIADHN CC(C)CN(C(=O)NCCCCN1CCN(C)CC1)[C@@H](C)c1ccccc1Cl ZINC000571353903 947615489 /nfs/dbraw/zinc/61/54/89/947615489.db2.gz WPWJAFXJUJEXKC-IBGZPJMESA-N 0 3 409.018 4.096 20 0 HIADHN CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)cc1)[C@H]1C[C@@H]1C ZINC000571356762 947617745 /nfs/dbraw/zinc/61/77/45/947617745.db2.gz UOAPKYIBDXXDJR-IQOKHDRSSA-N 0 3 423.532 4.438 20 0 HIADHN Cc1noc(-c2ccc(C)c(NC(=O)N[C@H]3CCN(Cc4ccccc4)[C@@H]3C)c2)n1 ZINC000571474335 947664069 /nfs/dbraw/zinc/66/40/69/947664069.db2.gz MUPFTXHGNSNBIY-UZLBHIALSA-N 0 3 405.502 4.138 20 0 HIADHN CO[C@@H]1C[C@H](c2ccccc2)CC[C@@H]1N[C@@H](C)C(=O)Nc1ccc(-c2c[nH]cn2)cc1 ZINC000571588824 947716956 /nfs/dbraw/zinc/71/69/56/947716956.db2.gz VIGBESNQBUQXOV-SQWJVJANSA-N 0 3 418.541 4.345 20 0 HIADHN COc1ccc([C@H](C)NCc2cccc(N3CCOCC3)c2)cc1Br ZINC000571660849 947738109 /nfs/dbraw/zinc/73/81/09/947738109.db2.gz YIMFPICWJZPIJC-HNNXBMFYSA-N 0 3 405.336 4.145 20 0 HIADHN COc1ccc(CN[C@H]2CCN(C)[C@@H]2c2ccccc2)c(Br)c1OC ZINC000571690536 947749157 /nfs/dbraw/zinc/74/91/57/947749157.db2.gz FJLJQGCNTGBGCN-QFBILLFUSA-N 0 3 405.336 4.001 20 0 HIADHN CC[C@H](C)Oc1ccc(NC(=O)N(C)C2CCN(CCc3ccccn3)CC2)cc1 ZINC000571708886 947756416 /nfs/dbraw/zinc/75/64/16/947756416.db2.gz AJCDMZBTUQSYMP-IBGZPJMESA-N 0 3 410.562 4.430 20 0 HIADHN Cc1cccc(S(=O)(=O)CCCN[C@H](c2cncc(Br)c2)C2CC2)c1 ZINC000571706367 947756594 /nfs/dbraw/zinc/75/65/94/947756594.db2.gz FQFGDXYUZQXPHD-IBGZPJMESA-N 0 3 423.376 4.057 20 0 HIADHN COc1cc(CN[C@H]2C[C@@H]2C(F)F)ccc1OCC(=O)Nc1ccccc1Cl ZINC000571717452 947760051 /nfs/dbraw/zinc/76/00/51/947760051.db2.gz CLRFXKWKBJAXTL-BBRMVZONSA-N 0 3 410.848 4.109 20 0 HIADHN COc1ccc(CNCc2cccc(-c3nc(CC(F)(F)F)no3)c2)c(C)c1OC ZINC000571725822 947767188 /nfs/dbraw/zinc/76/71/88/947767188.db2.gz RFIFZTBRNZKQGP-UHFFFAOYSA-N 0 3 421.419 4.457 20 0 HIADHN CCc1c(C(=O)NC[C@@H](c2ccc(SC)cc2)N(C)C)cnn1Cc1ccccc1 ZINC000571835451 947798902 /nfs/dbraw/zinc/79/89/02/947798902.db2.gz WQIBTNYOXOTWRW-QHCPKHFHSA-N 0 3 422.598 4.248 20 0 HIADHN C[C@@H](N[C@@H]1c2ccccc2CC12CCOCC2)C(=O)Nc1ccccc1OC(F)F ZINC000571931183 947814599 /nfs/dbraw/zinc/81/45/99/947814599.db2.gz UGPDFIDXELVCEH-FOIQADDNSA-N 0 3 416.468 4.299 20 0 HIADHN O=C(NCCNCc1cscc1C(F)(F)F)c1ccc(Br)cc1 ZINC000571964566 947824082 /nfs/dbraw/zinc/82/40/82/947824082.db2.gz JRQCGCPZCPZZNT-UHFFFAOYSA-N 0 3 407.255 4.049 20 0 HIADHN Cc1ccc(CNCc2cccc(NC(=O)c3ccncc3)c2)c(-c2cnn(C)c2)c1 ZINC000572061759 947835996 /nfs/dbraw/zinc/83/59/96/947835996.db2.gz AHIYUANMACDNLY-UHFFFAOYSA-N 0 3 411.509 4.333 20 0 HIADHN CN1CC[C@H](N[C@H]2CCN(c3ccccc3Cl)C2=O)[C@@H]1c1ccc(Cl)cc1 ZINC000572289705 947876790 /nfs/dbraw/zinc/87/67/90/947876790.db2.gz NAKPIYIKHXAESJ-BJLQDIEVSA-N 0 3 404.341 4.134 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000572309971 947880526 /nfs/dbraw/zinc/88/05/26/947880526.db2.gz LLJXHQAOWBJXNJ-OKZBNKHCSA-N 0 3 405.325 4.302 20 0 HIADHN C/C(=C\c1ccccc1OC(F)F)CNCc1cccc(S(=O)(=O)NC(C)C)c1 ZINC000572327183 947885909 /nfs/dbraw/zinc/88/59/09/947885909.db2.gz ZDAASWITXIRXNH-LFIBNONCSA-N 0 3 424.513 4.168 20 0 HIADHN CCc1ccc([C@H](CNC(=O)Nc2ccc([C@@H](C)N3CCOCC3)cc2)N(C)C)cc1 ZINC000572440933 947905900 /nfs/dbraw/zinc/90/59/00/947905900.db2.gz RWQAWNGNJCDUJZ-DVECYGJZSA-N 0 3 424.589 4.067 20 0 HIADHN COc1ccc(CN(C)C(=O)CN[C@@H](C)c2ccc(F)c3ccccc32)cc1OC ZINC000572558784 947945806 /nfs/dbraw/zinc/94/58/06/947945806.db2.gz NJSPRAONCHYIEI-INIZCTEOSA-N 0 3 410.489 4.305 20 0 HIADHN CN(C)CCn1nccc1NC(=O)c1ccc(-c2cccc(OC(F)(F)F)c2)s1 ZINC000572624985 947958797 /nfs/dbraw/zinc/95/87/97/947958797.db2.gz CXWKMXQBZKZXNS-UHFFFAOYSA-N 0 3 424.448 4.324 20 0 HIADHN COc1ccc([C@H](Cc2ccccc2)NCC(=O)Nc2ccc(OC)c(OC)c2)cc1 ZINC000572804526 948015709 /nfs/dbraw/zinc/01/57/09/948015709.db2.gz IOEIVNGDPLXYHD-QFIPXVFZSA-N 0 3 420.509 4.225 20 0 HIADHN Cc1c([C@@H](C)NCCn2cc(Br)cn2)cnn1-c1cccc(Cl)c1 ZINC000572827708 948020145 /nfs/dbraw/zinc/02/01/45/948020145.db2.gz FJHHYLAWHBWHQG-GFCCVEGCSA-N 0 3 408.731 4.144 20 0 HIADHN Cc1cnn(-c2ccc(NC(=O)NC[C@@H]3CCCN3Cc3ccccc3)cc2F)c1 ZINC000572886356 948030535 /nfs/dbraw/zinc/03/05/35/948030535.db2.gz KOAZCOMPKLNFDU-FQEVSTJZSA-N 0 3 407.493 4.106 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)CCNCc1cc(O)cc(C(F)(F)F)c1 ZINC000572891741 948031616 /nfs/dbraw/zinc/03/16/16/948031616.db2.gz QLFPUXLESNKNIY-UHFFFAOYSA-N 0 3 402.800 4.191 20 0 HIADHN Cc1nc(NC(=O)[C@H](C)N[C@H]2CCN(C(C)C)[C@H]2c2ccc(F)c(F)c2)sc1C ZINC000573011439 948057425 /nfs/dbraw/zinc/05/74/25/948057425.db2.gz YKULKCQGFCNELJ-AGRHKRQWSA-N 0 3 422.545 4.179 20 0 HIADHN C[C@@H](CN1CCCCC1)NC(=O)C(C)(C)c1csc(-c2cc(F)ccc2F)n1 ZINC000573253580 948123880 /nfs/dbraw/zinc/12/38/80/948123880.db2.gz USZRLORAXLNEQW-AWEZNQCLSA-N 0 3 407.530 4.357 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@@H]2NC[C@H](c2ccco2)N2CCCC2)cc1 ZINC000573289169 948146545 /nfs/dbraw/zinc/14/65/45/948146545.db2.gz SDQWDTLOOMKNHZ-QZNHQXDQSA-N 0 3 416.587 4.100 20 0 HIADHN COc1cc(CN2CCC[C@H](c3nc(N(C)C)no3)C2)ccc1OCc1ccccc1 ZINC000573432075 948204487 /nfs/dbraw/zinc/20/44/87/948204487.db2.gz PIGYFVWDEMPPDD-FQEVSTJZSA-N 0 3 422.529 4.103 20 0 HIADHN Cc1cccc(NC(=O)N[C@@H]2CCN(Cc3ccccc3)[C@@H]2C)c1C(=O)N1CCCC1 ZINC000573474734 948212638 /nfs/dbraw/zinc/21/26/38/948212638.db2.gz FRBXJIPVYWEMAT-TZIWHRDSSA-N 0 3 420.557 4.016 20 0 HIADHN C[C@H]1[C@H](NC(=O)CCc2nnc(-c3ccc(Cl)cc3)o2)CCN1Cc1ccccc1 ZINC000573552107 948238562 /nfs/dbraw/zinc/23/85/62/948238562.db2.gz VEGBTJAFDZVFLN-OXJNMPFZSA-N 0 3 424.932 4.102 20 0 HIADHN COc1ccc(C(=O)NC[C@H](c2ccc(SC)cc2)N(C)C)cc1OC(F)F ZINC000573596361 948246210 /nfs/dbraw/zinc/24/62/10/948246210.db2.gz PFWVNWXAMPMDMK-MRXNPFEDSA-N 0 3 410.486 4.051 20 0 HIADHN C[C@H](C(=O)N[C@@H]1CCN(Cc2ccccc2)[C@H]1C)c1ccc(Br)s1 ZINC000573716036 948280372 /nfs/dbraw/zinc/28/03/72/948280372.db2.gz UQCWWVQCAAVVLM-OFQRWUPVSA-N 0 3 407.377 4.393 20 0 HIADHN COC(=O)CCn1nc(C)c(CN2CCC([C@@H](F)c3ccccc3F)CC2)c1C ZINC000573883917 948319550 /nfs/dbraw/zinc/31/95/50/948319550.db2.gz PYKBZDLAUXVLJK-JOCHJYFZSA-N 0 3 405.489 4.125 20 0 HIADHN CN(CCn1cc(Br)cn1)Cc1cc(Br)cc2cccnc21 ZINC000573998235 948344283 /nfs/dbraw/zinc/34/42/83/948344283.db2.gz VMIKPMFGTUMUJY-UHFFFAOYSA-N 0 3 424.140 4.088 20 0 HIADHN COc1ccc(Br)c(NC(=O)N[C@@H](CN(C)C)c2ccc(F)cc2)c1 ZINC000574048209 948353225 /nfs/dbraw/zinc/35/32/25/948353225.db2.gz FBTZVHAXYHISTA-KRWDZBQOSA-N 0 3 410.287 4.021 20 0 HIADHN FC(F)(F)[C@]1(c2nc(COCc3ccccc3)no2)CCN(Cc2ccccc2)C1 ZINC000574209164 948387793 /nfs/dbraw/zinc/38/77/93/948387793.db2.gz WYAAVCFQUCJSNR-OAQYLSRUSA-N 0 3 417.431 4.492 20 0 HIADHN FC(F)(F)[C@@]1(c2nc(COCc3ccccc3)no2)CCN(Cc2ccccc2)C1 ZINC000574209163 948387992 /nfs/dbraw/zinc/38/79/92/948387992.db2.gz WYAAVCFQUCJSNR-NRFANRHFSA-N 0 3 417.431 4.492 20 0 HIADHN COCCCN(C(=O)c1oc2ccc(Br)cc2c1C)C1CCN(C)CC1 ZINC000574247614 948398438 /nfs/dbraw/zinc/39/84/38/948398438.db2.gz FBNLNLVOPSAKMP-UHFFFAOYSA-N 0 3 423.351 4.077 20 0 HIADHN Cc1cccc(Br)c1C(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000574435454 948441038 /nfs/dbraw/zinc/44/10/38/948441038.db2.gz GZKIYTWFEDADOK-IAGOWNOFSA-N 0 3 423.395 4.109 20 0 HIADHN CSc1ccc([C@H](CNC(=O)c2cn(C)nc2C2CCCCC2)N(C)C)cc1 ZINC000574549724 948468713 /nfs/dbraw/zinc/46/87/13/948468713.db2.gz GBTSHHXCJOBHCC-FQEVSTJZSA-N 0 3 400.592 4.222 20 0 HIADHN CN(C(=O)c1ccc(NCc2ccc(C(F)(F)F)cc2)cc1)[C@H]1CCCN(C)C1 ZINC000574931355 948554470 /nfs/dbraw/zinc/55/44/70/948554470.db2.gz NTDABEIZVRLBPN-FQEVSTJZSA-N 0 3 405.464 4.484 20 0 HIADHN COC(=O)c1ccc(COc2ccccc2CN2CC[C@@H](COC(F)F)C2)cc1 ZINC000574961039 948566157 /nfs/dbraw/zinc/56/61/57/948566157.db2.gz FQXXPUVKGOMDPX-QGZVFWFLSA-N 0 3 405.441 4.113 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)c1cn(-c2ccc(Cl)cc2)nc1C)c1ccco1 ZINC000575351700 948652707 /nfs/dbraw/zinc/65/27/07/948652707.db2.gz WQNHZBIJGMBQIE-IFXJQAMLSA-N 0 3 400.910 4.286 20 0 HIADHN COc1cc(CN[C@@H](c2ccc(Cl)c(Cl)c2)C(C)C)ccc1OCC(N)=O ZINC000575942626 948791469 /nfs/dbraw/zinc/79/14/69/948791469.db2.gz PXQMRHNJYNMUOR-HXUWFJFHSA-N 0 3 411.329 4.353 20 0 HIADHN C[C@H]1CN(c2cccc3cnccc32)CCN1Cc1ccc(-c2cnn(C)c2)s1 ZINC000576011054 948809535 /nfs/dbraw/zinc/80/95/35/948809535.db2.gz CGRUWSOYFRWYSQ-KRWDZBQOSA-N 0 3 403.555 4.408 20 0 HIADHN C[C@H](N[C@H]1CCN(c2ccc(Cl)cc2Cl)C1=O)c1ccccc1-n1ccnn1 ZINC000576017189 948810388 /nfs/dbraw/zinc/81/03/88/948810388.db2.gz ZMFHOABWNISAMG-GUYCJALGSA-N 0 3 416.312 4.030 20 0 HIADHN CN(C(=O)C(C)(C)C)c1ccc(OC[C@@H]2CN(Cc3ccccc3)CCCO2)cc1 ZINC000576031774 948813361 /nfs/dbraw/zinc/81/33/61/948813361.db2.gz NZKALQMLHZPXHK-QHCPKHFHSA-N 0 3 410.558 4.365 20 0 HIADHN C[C@@H]1CN(c2cc(-c3ccc(Cl)nc3)ccc2C2OCCCO2)[C@H](C)CN1C ZINC001164632858 719225207 /nfs/dbraw/zinc/22/52/07/719225207.db2.gz BXRHGZXKDZARLW-HZPDHXFCSA-N 0 3 401.938 4.366 20 0 HIADHN COc1ccc2c(ccnc2N2CCC3(CC2)CN(Cc2cccs2)CCO3)c1 ZINC001164694629 719889003 /nfs/dbraw/zinc/88/90/03/719889003.db2.gz BGPBBYVMAVESMM-UHFFFAOYSA-N 0 3 409.555 4.176 20 0 HIADHN COc1cc(N2CCC3(CC2)CN(Cc2cccs2)CCO3)nc2ccccc21 ZINC001164696956 719896387 /nfs/dbraw/zinc/89/63/87/719896387.db2.gz IPYMJOLNANNBFK-UHFFFAOYSA-N 0 3 409.555 4.176 20 0 HIADHN Clc1ccc2[nH]c3ncnc(N4CC[C@@H]5[C@@H]4CCN5Cc4cccnc4)c3c2c1 ZINC001164729376 720426587 /nfs/dbraw/zinc/42/65/87/720426587.db2.gz HIHXWNYAMUKPSU-MOPGFXCFSA-N 0 3 404.905 4.013 20 0 HIADHN c1ccc(Cc2nnc(N3CC[C@@H]4[C@H]3CCN4Cc3cccnc3)c3ccccc23)cc1 ZINC001164727692 720431907 /nfs/dbraw/zinc/43/19/07/720431907.db2.gz DXBLZNFNSQVMNL-CLJLJLNGSA-N 0 3 421.548 4.469 20 0 HIADHN Fc1ccc(-c2ccc(Cl)nn2)c(N2CC[C@@H]3[C@@H]2CCN3Cc2cccnc2)c1 ZINC001164727885 720456196 /nfs/dbraw/zinc/45/61/96/720456196.db2.gz FEBQGABTSORZJK-UXHICEINSA-N 0 3 409.896 4.184 20 0 HIADHN c1nc2n(c1CN1CCCC1)CCN(c1cc(SCc3ccccc3)ccn1)CC2 ZINC001164736985 720585627 /nfs/dbraw/zinc/58/56/27/720585627.db2.gz XNMKCFNWWXOUNN-UHFFFAOYSA-N 0 3 419.598 4.229 20 0 HIADHN c1ccc(-c2cc(N3CCN4C[C@@H](Oc5cncnc5)C[C@H]4C3)nc3ccccc32)cc1 ZINC001164737193 720756610 /nfs/dbraw/zinc/75/66/10/720756610.db2.gz AMWKNJRJMAQHJI-SFTDATJTSA-N 0 3 423.520 4.034 20 0 HIADHN Cn1cc(CN2CC[C@H]3CN(c4nc(Cl)ccc4-c4ccccc4)C[C@@H]3C2)cn1 ZINC001164765593 721127719 /nfs/dbraw/zinc/12/77/19/721127719.db2.gz JNMHETSSWNDTFK-PMACEKPBSA-N 0 3 407.949 4.094 20 0 HIADHN Cc1cc(-c2ccccc2F)nnc1N1CCN2C[C@H](Oc3cccc(F)c3)C[C@H]2C1 ZINC001164904667 721564681 /nfs/dbraw/zinc/56/46/81/721564681.db2.gz FDOJKWHRUGKMKI-AZUAARDMSA-N 0 3 422.479 4.072 20 0 HIADHN FC1(F)CCN(c2nc3[nH]ccc3cc2Cl)C[C@@]12CCN(Cc1ccccn1)C2 ZINC001164908752 721711664 /nfs/dbraw/zinc/71/16/64/721711664.db2.gz YVWDNELXVVPGLD-FQEVSTJZSA-N 0 3 417.891 4.301 20 0 HIADHN Cc1nnc(N2CCC(F)(F)[C@@]3(CCN(Cc4ccccn4)C3)C2)c2ccccc12 ZINC001164906666 721722818 /nfs/dbraw/zinc/72/28/18/721722818.db2.gz NQRYVNFWWONRBZ-JOCHJYFZSA-N 0 3 409.484 4.071 20 0 HIADHN CSCc1ccc(N2CCC(F)(F)[C@@]3(CCN(Cc4ccccn4)C3)C2)nc1 ZINC001164911159 721729620 /nfs/dbraw/zinc/72/96/20/721729620.db2.gz IIEJTXAIEAKJOD-HXUWFJFHSA-N 0 3 404.530 4.077 20 0 HIADHN CSCc1ccnc(N2CCC(F)(F)[C@@]3(CCN(Cc4ccccn4)C3)C2)c1 ZINC001164909696 721733421 /nfs/dbraw/zinc/73/34/21/721733421.db2.gz DCKDMAYVPRKUFC-HXUWFJFHSA-N 0 3 404.530 4.077 20 0 HIADHN Clc1ccc2nc(N3CCC4(CC3)COCCN(Cc3ccncc3)C4)ccc2c1 ZINC001164961166 722052898 /nfs/dbraw/zinc/05/28/98/722052898.db2.gz TWKLVAOFPNJPHY-UHFFFAOYSA-N 0 3 422.960 4.402 20 0 HIADHN Clc1cc(N2CC[C@@H]3CN(Cc4cccnc4)CCO[C@@H]3C2)c2sccc2n1 ZINC001164980539 722110148 /nfs/dbraw/zinc/11/01/48/722110148.db2.gz RSNLLAMHMLMGMN-VQIMIIECSA-N 0 3 414.962 4.072 20 0 HIADHN Clc1cc(N2CC[C@@H]3CN(Cc4cccnc4)CCO[C@H]3C2)c2sccc2n1 ZINC001164980532 722110306 /nfs/dbraw/zinc/11/03/06/722110306.db2.gz RSNLLAMHMLMGMN-APWZRJJASA-N 0 3 414.962 4.072 20 0 HIADHN COC(=O)c1ccc2cc(N3CCC[C@]4(CCN4Cc4cccc(F)c4)C3)ncc2c1 ZINC001164997206 722207031 /nfs/dbraw/zinc/20/70/31/722207031.db2.gz XBSJALZALFMMMB-VWLOTQADSA-N 0 3 419.500 4.405 20 0 HIADHN CC[C@@H](C)[C@@H](NC(=O)Nc1ccc(N2CCN(CC)CC2)cc1C)C(F)(F)F ZINC000436093034 861374671 /nfs/dbraw/zinc/37/46/71/861374671.db2.gz YENYMDWFKJGAKH-RDTXWAMCSA-N 0 3 400.489 4.235 20 0 HIADHN CCn1cc(C(=O)NC[C@H](c2ccccc2)N2CCC(C)CC2)c(C(F)(F)F)n1 ZINC000436130538 861419399 /nfs/dbraw/zinc/41/93/99/861419399.db2.gz XPJBCPYPWCURBO-GOSISDBHSA-N 0 3 408.468 4.125 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc2c(c1)CCCC2)C(=O)Nc1ccc(N2CCOCC2)cc1 ZINC000007370725 845318103 /nfs/dbraw/zinc/31/81/03/845318103.db2.gz UJYMAGOEOYMQLA-RBUKOAKNSA-N 0 3 407.558 4.080 20 0 HIADHN CC(C)c1ccc([C@H](NCC(=O)Nc2cccc(S(C)(=O)=O)c2)C(C)C)cc1 ZINC000007804710 845417473 /nfs/dbraw/zinc/41/74/73/845417473.db2.gz OXRQCMUNJPDICB-JOCHJYFZSA-N 0 3 402.560 4.139 20 0 HIADHN CCN1CCN(c2ccc(NC(=S)Nc3cccc(Br)c3)cc2)CC1 ZINC000008105225 845475956 /nfs/dbraw/zinc/47/59/56/845475956.db2.gz OHMJDWMROMWVMO-UHFFFAOYSA-N 0 3 419.392 4.400 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cc(C4CC4)nn3-c3ccccc3)cc2)CC1 ZINC000008193345 845489348 /nfs/dbraw/zinc/48/93/48/845489348.db2.gz JXQKXMSDDLDXHS-UHFFFAOYSA-N 0 3 415.541 4.144 20 0 HIADHN CSc1ccc(CCN[C@@H](C)c2cc(S(N)(=O)=O)c(Cl)cc2Cl)cc1 ZINC000436282943 861589951 /nfs/dbraw/zinc/58/99/51/861589951.db2.gz IIOCZABOZFKTEV-NSHDSACASA-N 0 3 419.399 4.256 20 0 HIADHN C[C@H](NCc1cnn(Cc2ccc(F)cc2)c1)[C@@H](OC1CCOCC1)c1ccccc1 ZINC000436294902 861599824 /nfs/dbraw/zinc/59/98/24/861599824.db2.gz PIRPOOFYTYXOEK-UQBPGWFLSA-N 0 3 423.532 4.486 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3csc(-c4ccc(OC)cc4)n3)cc2)CC1 ZINC000011950957 845842664 /nfs/dbraw/zinc/84/26/64/845842664.db2.gz DUUVCQNAZYOMQS-UHFFFAOYSA-N 0 3 422.554 4.213 20 0 HIADHN Cc1c([C@@H](C)NCC2([S@](C)=O)CCC2)cnn1-c1ccc(Cl)cc1Cl ZINC000436311601 861615956 /nfs/dbraw/zinc/61/59/56/861615956.db2.gz UDSKMAGUGCTDLJ-YDBLSZJJSA-N 0 3 400.375 4.439 20 0 HIADHN CCOC(=O)c1c(C)[nH]c(C(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)c1C ZINC000014071828 845922787 /nfs/dbraw/zinc/92/27/87/845922787.db2.gz XQBBMYPFQBVOBS-KRWDZBQOSA-N 0 3 417.575 4.073 20 0 HIADHN Cc1nn(-c2ccccc2)c2sc(C(=O)NC[C@H](c3ccccc3)N(C)C)cc12 ZINC000016599393 846189724 /nfs/dbraw/zinc/18/97/24/846189724.db2.gz NVTYCPKYGFEVHY-HXUWFJFHSA-N 0 3 404.539 4.428 20 0 HIADHN COc1cc(NC(=O)CN[C@H](Cc2ccccc2)c2ccccc2)cc(OC)c1OC ZINC000019538794 846367924 /nfs/dbraw/zinc/36/79/24/846367924.db2.gz ZXSAXFGGUUTYOH-OAQYLSRUSA-N 0 3 420.509 4.225 20 0 HIADHN CCCn1c(SCC(=O)C(C#N)c2nc(C)cs2)nnc1-c1cccc(C)c1 ZINC000020067518 846378280 /nfs/dbraw/zinc/37/82/80/846378280.db2.gz TYYPDDTUKIDUCF-INIZCTEOSA-N 0 3 411.556 4.397 20 0 HIADHN CCc1ccc([C@H](CNC(=O)c2ccc(OCc3cccnc3)cc2)N(C)C)cc1 ZINC000023114141 846660500 /nfs/dbraw/zinc/66/05/00/846660500.db2.gz BTDYTKOPMLAQDF-DEOSSOPVSA-N 0 3 403.526 4.256 20 0 HIADHN CCOC(=O)c1sc2ncnc(NC[C@@H](c3cccc(F)c3)N(C)C)c2c1C ZINC000024107883 846791379 /nfs/dbraw/zinc/79/13/79/846791379.db2.gz XTJGXEKVZJEVCD-HNNXBMFYSA-N 0 3 402.495 4.030 20 0 HIADHN CC(C)NC(=O)Nc1cccc(C(=O)NC[C@@H](C(C)C)N2CCc3ccccc3C2)c1 ZINC000024622187 846844607 /nfs/dbraw/zinc/84/46/07/846844607.db2.gz GYYGWZQKBGDXNP-QHCPKHFHSA-N 0 3 422.573 4.029 20 0 HIADHN O=C(CN[C@H](Cc1ccccc1)c1ccccc1)NCc1cnn(-c2ccccc2)c1 ZINC000024735024 846860105 /nfs/dbraw/zinc/86/01/05/846860105.db2.gz HNIDNNXJAFPECI-RUZDIDTESA-N 0 3 410.521 4.062 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@H](C)N2CCC(Cc3ccccc3)CC2)cc1OC ZINC000025507736 846989262 /nfs/dbraw/zinc/98/92/62/846989262.db2.gz CLJWFMNDHZPOGV-IBGZPJMESA-N 0 3 410.558 4.005 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1ccccc1Br)c1cccc(OC)c1 ZINC000025858547 847046714 /nfs/dbraw/zinc/04/67/14/847046714.db2.gz XBFRINQKQUMPHJ-LJQANCHMSA-N 0 3 405.336 4.271 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cc2cnn(C(C)C)c2nc1C)c1cccc(OC)c1 ZINC000025862718 847048665 /nfs/dbraw/zinc/04/86/65/847048665.db2.gz DSAHINHYTYYIOH-JOCHJYFZSA-N 0 3 423.561 4.142 20 0 HIADHN COc1ccc(CN(C)CCC(=O)NCc2ccccc2Cl)cc1OC(F)F ZINC000026453593 847151474 /nfs/dbraw/zinc/15/14/74/847151474.db2.gz UMJCQJLDGYXBOS-UHFFFAOYSA-N 0 3 412.864 4.088 20 0 HIADHN COc1ccc(CN(C)C(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)cc1 ZINC000026522153 847161979 /nfs/dbraw/zinc/16/19/79/847161979.db2.gz GFBUWVORFTUEFW-FQEVSTJZSA-N 0 3 401.576 4.371 20 0 HIADHN [O-]c1ccc2ccncc2c1C[NH+]1CCN(Cc2ccc(OC(F)(F)F)cc2)CC1 ZINC000026688047 847186282 /nfs/dbraw/zinc/18/62/82/847186282.db2.gz BGSYNPYGPWCYTR-UHFFFAOYSA-N 0 3 417.431 4.157 20 0 HIADHN COc1ccc(OC)c([C@H](C)NC[C@@H](O)COc2cc(Cl)ccc2Cl)c1 ZINC000026715381 847190123 /nfs/dbraw/zinc/19/01/23/847190123.db2.gz PBCMBMIDUUNUNR-GXTWGEPZSA-N 0 3 400.302 4.101 20 0 HIADHN COc1ccc(CNc2cccc(N3CCN(CCc4ccccc4)CC3)c2)cn1 ZINC000436416481 861770574 /nfs/dbraw/zinc/77/05/74/861770574.db2.gz SZEUEXHIJJEBEQ-UHFFFAOYSA-N 0 3 402.542 4.067 20 0 HIADHN CC1CCN([C@@H](CNC(=O)c2ccc(Cn3cccn3)cc2)c2cccs2)CC1 ZINC000027575138 847321963 /nfs/dbraw/zinc/32/19/63/847321963.db2.gz MNQSAWGWTJJMFW-NRFANRHFSA-N 0 3 408.571 4.196 20 0 HIADHN C[C@@H](CN1CCCCC1)NC(=O)c1ccccc1SCc1cn2ccccc2n1 ZINC000027763905 847348627 /nfs/dbraw/zinc/34/86/27/847348627.db2.gz HEGSANNIRDUJMC-SFHVURJKSA-N 0 3 408.571 4.231 20 0 HIADHN CCOc1c(Cl)cc(C(=O)N[C@@H](CN2CCCC2)c2ccccc2)cc1OC ZINC000029177998 847520300 /nfs/dbraw/zinc/52/03/00/847520300.db2.gz ZTSMYZPRNGXQBA-IBGZPJMESA-N 0 3 402.922 4.314 20 0 HIADHN Cc1nc(C(F)(F)F)ccc1C(=O)NC[C@@H](C(C)C)N1CCc2ccccc2C1 ZINC000029174991 847520390 /nfs/dbraw/zinc/52/03/90/847520390.db2.gz MBEZBTIRFIEIPA-IBGZPJMESA-N 0 3 405.464 4.222 20 0 HIADHN Cc1ccc(C(=O)N[C@H](CN2CCCC2)c2ccccc2)cc1NC(=O)c1ccco1 ZINC000029177591 847521123 /nfs/dbraw/zinc/52/11/23/847521123.db2.gz VNOYCINOCHCGTB-JOCHJYFZSA-N 0 3 417.509 4.407 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)c1nn(-c2ccc(F)cc2)c2c1CCC2 ZINC000029179177 847521733 /nfs/dbraw/zinc/52/17/33/847521733.db2.gz TVMUMEFXAIPYTG-QFIPXVFZSA-N 0 3 418.516 4.067 20 0 HIADHN O=C(COc1ccccc1-c1ccccc1)NCC1(N2CCSCC2)CCCC1 ZINC000029371195 847554142 /nfs/dbraw/zinc/55/41/42/847554142.db2.gz IXTBECUTPLUKSB-UHFFFAOYSA-N 0 3 410.583 4.210 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)CSCc3ccc(F)cc3)c(C)c2)CC1 ZINC000029373694 847554301 /nfs/dbraw/zinc/55/43/01/847554301.db2.gz NCYOKTQCKHUPCM-UHFFFAOYSA-N 0 3 401.551 4.148 20 0 HIADHN COc1ccccc1CCNC(=O)NC[C@H](c1cccs1)N1CCC(C)CC1 ZINC000029655202 847598421 /nfs/dbraw/zinc/59/84/21/847598421.db2.gz GFXUKVRVRRLZOA-LJQANCHMSA-N 0 3 401.576 4.072 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)c2ccc(OCc3ccncc3)cc2)N(C)C)cc1 ZINC000029754590 847613272 /nfs/dbraw/zinc/61/32/72/847613272.db2.gz XRILUFGFLYLUBD-XMMPIXPASA-N 0 3 403.526 4.256 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3ccc(OCc4cccnc4)cc3)cc2)CC1 ZINC000029799000 847621764 /nfs/dbraw/zinc/62/17/64/847621764.db2.gz LCJYZVVORKYKRN-UHFFFAOYSA-N 0 3 416.525 4.055 20 0 HIADHN N#Cc1c2[nH]c3ccccc3n2c(=O)cc1CN1CCC[C@H](c2nc3ccccc3o2)C1 ZINC000029833115 847628290 /nfs/dbraw/zinc/62/82/90/847628290.db2.gz YUBOMSSXOOCXAM-FUHWJXTLSA-N 0 3 423.476 4.244 20 0 HIADHN Cc1c(C(=O)NCCCN2CCc3ccccc3C2)cnn1-c1cccc(Cl)c1 ZINC000029842607 847630870 /nfs/dbraw/zinc/63/08/70/847630870.db2.gz LHEVGUUUKUTELM-UHFFFAOYSA-N 0 3 408.933 4.012 20 0 HIADHN CC[C@@H](CNC(=O)c1ccc(OCc2cccnc2)cc1)N1CCc2ccccc2C1 ZINC000029913018 847649959 /nfs/dbraw/zinc/64/99/59/847649959.db2.gz QGAGXFWSEYTRAK-DEOSSOPVSA-N 0 3 415.537 4.227 20 0 HIADHN Cc1nn(Cc2ccccc2Cl)c(C)c1CNCc1ccc(Cn2cncn2)cc1 ZINC000030634453 847748577 /nfs/dbraw/zinc/74/85/77/847748577.db2.gz LJVJTBFESVDXEF-UHFFFAOYSA-N 0 3 420.948 4.131 20 0 HIADHN COc1ccc(CNCc2ccnc(-n3cccn3)c2)cc1OCc1ccccc1 ZINC000030901016 847794388 /nfs/dbraw/zinc/79/43/88/847794388.db2.gz NDCUPVZCLXCJLD-UHFFFAOYSA-N 0 3 400.482 4.145 20 0 HIADHN COc1ccc(CNCc2cccc(Cn3ccnc3)c2)cc1OCc1cccnc1 ZINC000030901856 847795454 /nfs/dbraw/zinc/79/54/54/847795454.db2.gz KHFKTYCKBYMSIN-UHFFFAOYSA-N 0 3 414.509 4.204 20 0 HIADHN COc1cc(OC)c(OC)cc1CNC[C@@H](c1c(F)cccc1Cl)N1CCCC1 ZINC000030910895 847796883 /nfs/dbraw/zinc/79/68/83/847796883.db2.gz NFDVAWJUHMLPIE-SFHVURJKSA-N 0 3 422.928 4.432 20 0 HIADHN Cc1ccccc1CN1CCCN([C@H](C)C(=O)Nc2ccc(OC(F)F)cc2)CC1 ZINC000030970784 847802939 /nfs/dbraw/zinc/80/29/39/847802939.db2.gz CXGUDIIPZUGNER-GOSISDBHSA-N 0 3 417.500 4.131 20 0 HIADHN O=C(NCc1ccc(OC(F)(F)F)cc1)NC[C@H](c1ccccc1)N1CCCC1 ZINC000030989056 847805574 /nfs/dbraw/zinc/80/55/74/847805574.db2.gz ZFMAFJPDJSKJLF-LJQANCHMSA-N 0 3 407.436 4.222 20 0 HIADHN COc1ccc2cc(CNC(=O)NCC3(N4CCSCC4)CCCC3)ccc2c1 ZINC000031096542 847821902 /nfs/dbraw/zinc/82/19/02/847821902.db2.gz LXORVTJQUYYKGF-UHFFFAOYSA-N 0 3 413.587 4.009 20 0 HIADHN CC(C)(CNC(=O)c1cc2c(cccc2OC(F)F)[nH]1)N1CCc2ccccc2C1 ZINC000031287329 847856793 /nfs/dbraw/zinc/85/67/93/847856793.db2.gz ARMMYDCDBGLJMW-UHFFFAOYSA-N 0 3 413.468 4.336 20 0 HIADHN Cc1cccc(-c2nc(CC(=O)N[C@@H]3CCCN(Cc4ccccc4)C3)cs2)c1 ZINC000031565565 847908983 /nfs/dbraw/zinc/90/89/83/847908983.db2.gz XWLXEEJOWWJLKV-OAQYLSRUSA-N 0 3 405.567 4.442 20 0 HIADHN Cc1nc(Cc2ccccc2)sc1C(=O)NC1CCN(Cc2ccccc2)CC1 ZINC000031867954 847959470 /nfs/dbraw/zinc/95/94/70/847959470.db2.gz RLAAJOYFWTWGFF-UHFFFAOYSA-N 0 3 405.567 4.437 20 0 HIADHN O=C(c1ccccc1[O-])N1CCC([NH2+][C@H]2CCCOc3cc(Cl)ccc32)CC1 ZINC000436556313 861849805 /nfs/dbraw/zinc/84/98/05/861849805.db2.gz RSSAFHPJYJKOPU-IBGZPJMESA-N 0 3 400.906 4.154 20 0 HIADHN CCN(CC)[C@H](CNC(=O)CCNC(=O)c1ccc2ccccc2c1)c1ccsc1 ZINC000031983974 847975057 /nfs/dbraw/zinc/97/50/57/847975057.db2.gz CRMRXULJUOHTRF-JOCHJYFZSA-N 0 3 423.582 4.221 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1ccc(OC)c(Br)c1)c1ccsc1 ZINC000031986565 847975817 /nfs/dbraw/zinc/97/58/17/847975817.db2.gz WXURBQYVXYORAY-INIZCTEOSA-N 0 3 411.365 4.332 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1ccc(OC[C@H]2CCCO2)cc1)c1ccsc1 ZINC000031988941 847975912 /nfs/dbraw/zinc/97/59/12/847975912.db2.gz DQVNVDJIHHRCDB-NHCUHLMSSA-N 0 3 402.560 4.119 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)CCc3c[nH]c4ccccc34)CC2)c1 ZINC000032067789 847984708 /nfs/dbraw/zinc/98/47/08/847984708.db2.gz NUVUWQMXJNCJRO-UHFFFAOYSA-N 0 3 418.585 4.128 20 0 HIADHN Cc1nn(-c2ccccc2)c(Cl)c1C(=O)NCCCN1CCc2ccccc2C1 ZINC000032400120 848019129 /nfs/dbraw/zinc/01/91/29/848019129.db2.gz PWCONNCQVUHORY-UHFFFAOYSA-N 0 3 408.933 4.012 20 0 HIADHN Cc1cc(C(=O)NC[C@H](Cc2ccccc2)N(C)C)cc(C)c1OCc1cccnc1 ZINC000032483564 848038137 /nfs/dbraw/zinc/03/81/37/848038137.db2.gz HRTNRXWXNZWBAY-DEOSSOPVSA-N 0 3 417.553 4.180 20 0 HIADHN O=C(Cn1c2ccccc2nc1C(F)(F)F)NC[C@@H](c1cccs1)N1CCCC1 ZINC000032761288 848072380 /nfs/dbraw/zinc/07/23/80/848072380.db2.gz OYRKLCBKBUZUCT-INIZCTEOSA-N 0 3 422.476 4.070 20 0 HIADHN O=C(c1cc(CCc2ccccc2)ccc1[O-])N1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000436599378 861864440 /nfs/dbraw/zinc/86/44/40/861864440.db2.gz AVGQPUIXBJVDFF-ZJSXRUAMSA-N 0 3 404.554 4.266 20 0 HIADHN O=C(c1cc(CCc2ccccc2)ccc1[O-])N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000436599378 861864441 /nfs/dbraw/zinc/86/44/41/861864441.db2.gz AVGQPUIXBJVDFF-ZJSXRUAMSA-N 0 3 404.554 4.266 20 0 HIADHN Cc1ccc(C(=O)NCc2ccccc2CN(C)C)cc1NC(=O)c1ccccc1F ZINC000033221800 848127768 /nfs/dbraw/zinc/12/77/68/848127768.db2.gz JSFXFVBNEXHGAD-UHFFFAOYSA-N 0 3 419.500 4.378 20 0 HIADHN COc1cccc(NC(=O)[C@H](NCCc2ccc(OC)c(OC)c2)c2ccccc2)c1 ZINC000038431220 848178235 /nfs/dbraw/zinc/17/82/35/848178235.db2.gz VQNQQQANROOSKP-XMMPIXPASA-N 0 3 420.509 4.225 20 0 HIADHN C[C@H](NC(=O)c1ccccc1)C(=O)C(C#N)c1nc(-c2ccc(Cl)cc2)cs1 ZINC000041515041 848224297 /nfs/dbraw/zinc/22/42/97/848224297.db2.gz JEPPWZYELFRTHW-SUMWQHHRSA-N 0 3 409.898 4.458 20 0 HIADHN CN(CC(=O)C(C#N)c1nc(-c2ccc(Cl)cc2)cs1)C(=O)c1cccs1 ZINC000041513961 848224773 /nfs/dbraw/zinc/22/47/73/848224773.db2.gz IHQSSCRZHCUTSA-CQSZACIVSA-N 0 3 415.927 4.473 20 0 HIADHN N#CC(C(=O)CC[C@H]1Cc2ccccc2NC1=O)c1nc2ccccc2n1C(F)F ZINC000041557290 848231855 /nfs/dbraw/zinc/23/18/55/848231855.db2.gz TYBCBFCHPMJPAA-GJZGRUSLSA-N 0 3 408.408 4.199 20 0 HIADHN CCN1CCC[C@@H](CN(C)C(=O)c2cc(C(C)C)c(O)cc2C)[C@@H]1c1cnn(C)c1 ZINC000436651685 861882279 /nfs/dbraw/zinc/88/22/79/861882279.db2.gz XUQUYTQTRVUSDL-FDDCHVKYSA-N 0 3 412.578 4.103 20 0 HIADHN COc1cc(CN[C@@H](C)c2ccc3c(c2)OCCO3)ccc1OCc1ccncc1 ZINC000042186453 848298608 /nfs/dbraw/zinc/29/86/08/848298608.db2.gz NHOGIGWTBYFORN-KRWDZBQOSA-N 0 3 406.482 4.291 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCc1coc(-c2cccs2)n1)c1ccsc1 ZINC000042346045 848319814 /nfs/dbraw/zinc/31/98/14/848319814.db2.gz YSXTULYGWCJCOQ-MRXNPFEDSA-N 0 3 404.561 4.347 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N[C@H](C)c1cccc(NC(C)=O)c1)c1ccsc1 ZINC000042346519 848320257 /nfs/dbraw/zinc/32/02/57/848320257.db2.gz JNVWIQWSKNYQGJ-QRWLVFNGSA-N 0 3 402.564 4.150 20 0 HIADHN Cc1ccc(C)n1-c1nc(CC(=O)NC[C@H](c2ccccc2)N2CCCC2)cs1 ZINC000042378875 848322411 /nfs/dbraw/zinc/32/24/11/848322411.db2.gz KGTNVEAFQYJESJ-OAQYLSRUSA-N 0 3 408.571 4.046 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3CCc4[nH]c5ccccc5c4C3)c(C)c2)CC1 ZINC000043522618 848436220 /nfs/dbraw/zinc/43/62/20/848436220.db2.gz HTKBZBTVNISZIX-UHFFFAOYSA-N 0 3 417.557 4.208 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1ccc(NC(C)=O)c(C)c1)c1cccc(OC)c1 ZINC000044047815 848507740 /nfs/dbraw/zinc/50/77/40/848507740.db2.gz MXVYDCMWTMCZSA-QFIPXVFZSA-N 0 3 412.534 4.167 20 0 HIADHN CCOc1cc(CN(C)C(=O)Nc2cccc(CN(C)C)c2)ccc1OC(F)F ZINC000044277062 848539059 /nfs/dbraw/zinc/53/90/59/848539059.db2.gz VNOWNWWAZCBITN-UHFFFAOYSA-N 0 3 407.461 4.412 20 0 HIADHN CN(C)c1ccc(NC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)c(C(F)(F)F)c1 ZINC000044368897 848552353 /nfs/dbraw/zinc/55/23/53/848552353.db2.gz LREKMVQISMTQRI-MRXNPFEDSA-N 0 3 406.452 4.167 20 0 HIADHN C[C@H](C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)N1CCN(C2CCCC2)CC1 ZINC000045753822 848723043 /nfs/dbraw/zinc/72/30/43/848723043.db2.gz SBHKIIMRPRLRLL-CYBMUJFWSA-N 0 3 403.876 4.246 20 0 HIADHN C[C@H]1CCCN(C(=O)C2CCN(Cc3ccc(C(=O)Nc4ccccc4)cc3)CC2)C1 ZINC000045804753 848732018 /nfs/dbraw/zinc/73/20/18/848732018.db2.gz UFGGSAASYLFEBC-FQEVSTJZSA-N 0 3 419.569 4.409 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(NC(=O)C2CC2)cc1)C(=O)Nc1ccc(OC(F)F)cc1 ZINC000045812666 848734010 /nfs/dbraw/zinc/73/40/10/848734010.db2.gz NHDBZLLQZIIYNC-ZIAGYGMSSA-N 0 3 417.456 4.314 20 0 HIADHN Cc1cc(C)n(-c2ccc(CC(=O)NC[C@H](c3cccs3)N3CCCC3)cc2)n1 ZINC000046765707 848930318 /nfs/dbraw/zinc/93/03/18/848930318.db2.gz XRYLZTCLLYGHJX-OAQYLSRUSA-N 0 3 408.571 4.046 20 0 HIADHN C[C@@H](c1nc2ccccc2s1)N(C)C(=O)NCC1(N2CCSCC2)CCCC1 ZINC000047008903 848971836 /nfs/dbraw/zinc/97/18/36/848971836.db2.gz QGDJNIPBAWXNOP-INIZCTEOSA-N 0 3 418.632 4.360 20 0 HIADHN Cc1cc2oc(=O)cc(CN3CCC(c4nnc5n4CCC5)CC3)c2cc1C(C)C ZINC000047258450 849016230 /nfs/dbraw/zinc/01/62/30/849016230.db2.gz DWXDTKAMTQYRQR-UHFFFAOYSA-N 0 3 406.530 4.142 20 0 HIADHN N#CC(C(=O)C1CCN(C(=O)/C=C\c2ccccc2)CC1)c1ccc2ccccc2n1 ZINC000047376883 849035144 /nfs/dbraw/zinc/03/51/44/849035144.db2.gz OWHGHLSBMQTTCW-VPAPRSNLSA-N 0 3 409.489 4.363 20 0 HIADHN CN(C)Cc1cccc(NC(=O)CSc2nnc(-c3ccc(Cl)cc3)o2)c1 ZINC000047453108 849050791 /nfs/dbraw/zinc/05/07/91/849050791.db2.gz DHBSQHZBAWSEFT-UHFFFAOYSA-N 0 3 402.907 4.182 20 0 HIADHN Cc1ccccc1C(=O)NCCCCN1CCN(c2cccc(C(F)(F)F)c2)CC1 ZINC000047460949 849051687 /nfs/dbraw/zinc/05/16/87/849051687.db2.gz GQLLLGAERQQRPU-UHFFFAOYSA-N 0 3 419.491 4.346 20 0 HIADHN Cc1ccccc1CN1CCCN(C(=O)Nc2ccc(-n3cccn3)c(F)c2)CC1 ZINC000047768296 849108606 /nfs/dbraw/zinc/10/86/06/849108606.db2.gz IMCSIAXQUITWRH-UHFFFAOYSA-N 0 3 407.493 4.060 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)N[C@H](c2ccccc2)c2ccccn2)N(C)C)cc1 ZINC000047937420 849140627 /nfs/dbraw/zinc/14/06/27/849140627.db2.gz QNAPBNRLTZTHIT-DNQXCXABSA-N 0 3 402.542 4.336 20 0 HIADHN CCCC(=O)Nc1cccc(CNC(=O)NC[C@@H](c2cccs2)N2CCCC2)c1 ZINC000047951918 849144109 /nfs/dbraw/zinc/14/41/09/849144109.db2.gz RDTSXVYWOUPQJE-IBGZPJMESA-N 0 3 414.575 4.123 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1cc(NC(C)=O)ccc1C)c1cccc(OC)c1 ZINC000048274836 849202776 /nfs/dbraw/zinc/20/27/76/849202776.db2.gz ODCPUGNWBBCEAC-JOCHJYFZSA-N 0 3 412.534 4.167 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)CCCOCCc3ccccc3)c(C)c2)CC1 ZINC000048359733 849210532 /nfs/dbraw/zinc/21/05/32/849210532.db2.gz KOLNIJJGNCCNNL-UHFFFAOYSA-N 0 3 409.574 4.115 20 0 HIADHN CCN1CCC[C@@H]1CNC(=O)c1sc(NC(=O)c2ccccc2Cl)cc1C ZINC000048361264 849211581 /nfs/dbraw/zinc/21/15/81/849211581.db2.gz QFUAZJIZBFLEGK-CQSZACIVSA-N 0 3 405.951 4.176 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1ccc(C)c(NC(C)=O)c1)c1cccc(OC)c1 ZINC000048365234 849212034 /nfs/dbraw/zinc/21/20/34/849212034.db2.gz ZFHRGLRLPJHDEB-QFIPXVFZSA-N 0 3 412.534 4.167 20 0 HIADHN CC[C@H](NCc1ccc(-n2cccn2)cc1)c1ccccc1OCC(=O)N1CCCC1 ZINC000048750539 849264001 /nfs/dbraw/zinc/26/40/01/849264001.db2.gz LBEVAJWZCCTVIN-QHCPKHFHSA-N 0 3 418.541 4.114 20 0 HIADHN N#CC(C(=O)CCCCc1ccc(Br)cc1)C(=O)NCc1ccccc1 ZINC000049492304 849311548 /nfs/dbraw/zinc/31/15/48/849311548.db2.gz YDCMHBHSIWECNS-LJQANCHMSA-N 0 3 413.315 4.187 20 0 HIADHN CC(C)(C)c1ccc(/C=C/C(=O)Nc2cccc(CN3CCC(C(N)=O)CC3)c2)cc1 ZINC000049770845 849327558 /nfs/dbraw/zinc/32/75/58/849327558.db2.gz ARTVNDLMIVJTJO-FMIVXFBMSA-N 0 3 419.569 4.333 20 0 HIADHN C[C@H]([NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1)c1ccc(F)c(Br)c1 ZINC000436825631 862008361 /nfs/dbraw/zinc/00/83/61/862008361.db2.gz DXMRCKRXTOEXDQ-ZDUSSCGKSA-N 0 3 421.310 4.249 20 0 HIADHN CC[C@H]([NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1)c1ccccc1OC(F)F ZINC000436825604 862008573 /nfs/dbraw/zinc/00/85/73/862008573.db2.gz DTWDECDPADPDGC-SFHVURJKSA-N 0 3 404.457 4.339 20 0 HIADHN CCOc1ccc(Cl)cc1[C@@H](C)[NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1 ZINC000436828828 862009755 /nfs/dbraw/zinc/00/97/55/862009755.db2.gz NRZBZBTUIVGVGN-OAHLLOKOSA-N 0 3 402.922 4.400 20 0 HIADHN O=C(c1ccccc1[O-])N1CCC([NH2+][C@@H]2CCSc3ccc(Cl)cc32)CC1 ZINC000436833244 862011814 /nfs/dbraw/zinc/01/18/14/862011814.db2.gz XMIAQHPNLNSUTO-GOSISDBHSA-N 0 3 402.947 4.477 20 0 HIADHN Cc1ccc(CNC(=O)C2CCN(Cc3cccc(OC(F)F)c3)CC2)cc1F ZINC000050960320 849422543 /nfs/dbraw/zinc/42/25/43/849422543.db2.gz INNYCGUQZLDWNC-UHFFFAOYSA-N 0 3 406.448 4.264 20 0 HIADHN COc1c(Br)cc(Br)cc1CNCCc1nccs1 ZINC000051189626 849440869 /nfs/dbraw/zinc/44/08/69/849440869.db2.gz SUMWKIVTWMCEKM-UHFFFAOYSA-N 0 3 406.143 4.009 20 0 HIADHN COC(=O)Nc1ccc(CNC(=O)CN[C@H](Cc2ccccc2)c2ccccc2)cc1 ZINC000051797773 849516314 /nfs/dbraw/zinc/51/63/14/849516314.db2.gz ZPVZXFONDNPVAL-HSZRJFAPSA-N 0 3 417.509 4.055 20 0 HIADHN CCCCN(C)C(=O)C1CCN(C[C@H](O)COc2ccc(C(C)(C)C)cc2C)CC1 ZINC000052186502 849559371 /nfs/dbraw/zinc/55/93/71/849559371.db2.gz VSXGIOJDOBLLED-QFIPXVFZSA-N 0 3 418.622 4.003 20 0 HIADHN CC(C)Oc1ccc(NC(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)c(F)c1 ZINC000052263785 849566979 /nfs/dbraw/zinc/56/69/79/849566979.db2.gz VMVZKCGCQGJSLW-UHFFFAOYSA-N 0 3 409.452 4.487 20 0 HIADHN COc1ccc(CCCN(C)C(=O)NC[C@@H](c2cccs2)N2CCCC2)cc1 ZINC000052499671 849588770 /nfs/dbraw/zinc/58/87/70/849588770.db2.gz OQKUNDFFLIXPDA-FQEVSTJZSA-N 0 3 401.576 4.168 20 0 HIADHN COc1ccc([C@H](CNC(=O)N[C@@H](C)c2ccc(OC)c(F)c2)N2CCCC2)cc1 ZINC000052710646 849616004 /nfs/dbraw/zinc/61/60/04/849616004.db2.gz SENGZOLJMPSWRE-KKSFZXQISA-N 0 3 415.509 4.040 20 0 HIADHN Cc1ccccc1C(=O)NC1CCN(Cc2ccc(OCC(F)(F)F)cc2)CC1 ZINC000052828035 849631068 /nfs/dbraw/zinc/63/10/68/849631068.db2.gz VNHRYWPBNMOIDE-UHFFFAOYSA-N 0 3 406.448 4.331 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)Cn2c3ccccc3nc2C(F)(F)F)C1 ZINC000054227164 849829272 /nfs/dbraw/zinc/82/92/72/849829272.db2.gz DIWCJWGCHJEESW-RDJZCZTQSA-N 0 3 416.447 4.007 20 0 HIADHN Cc1ccc(C(=O)C2CCN(C[C@@H](O)CO[C@@H]3CCCc4ccccc43)CC2)cc1 ZINC000054421806 849864000 /nfs/dbraw/zinc/86/40/00/849864000.db2.gz WCWFDNRFPVANAG-ILBGXUMGSA-N 0 3 407.554 4.345 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)NC[C@H](c2ccccc2)N2CCCC2)cc1 ZINC000054478313 849875183 /nfs/dbraw/zinc/87/51/83/849875183.db2.gz PHKVCNXFIKOTET-PGRDOPGGSA-N 0 3 408.546 4.174 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)NC[C@H](c2cccs2)N2CCCC2)cc1 ZINC000054478317 849876243 /nfs/dbraw/zinc/87/62/43/849876243.db2.gz QHDTZAVLWYLVBK-QFBILLFUSA-N 0 3 414.575 4.235 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)cc1 ZINC000054478651 849876605 /nfs/dbraw/zinc/87/66/05/849876605.db2.gz PGNGASNAIHEFII-NPPFBWRTSA-N 0 3 408.546 4.172 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=S)Nc2ccc(OC(F)(F)F)cc2)o1 ZINC000054974489 849949364 /nfs/dbraw/zinc/94/93/64/849949364.db2.gz IPCCUERSCAZTLG-UHFFFAOYSA-N 0 3 401.454 4.247 20 0 HIADHN COc1ccc(NC(=O)[C@H](C)N[C@@H](C)c2ccc(OCc3cccnc3)cc2)cc1 ZINC000056144348 850253306 /nfs/dbraw/zinc/25/33/06/850253306.db2.gz WWKBVPSBORYLHE-ROUUACIJSA-N 0 3 405.498 4.347 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)Cc2csc(-c3cccc(F)c3)n2)C1 ZINC000056168450 850267881 /nfs/dbraw/zinc/26/78/81/850267881.db2.gz FOBPZHJTJOREHL-UZLBHIALSA-N 0 3 409.530 4.443 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1C(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000056168365 850268696 /nfs/dbraw/zinc/26/86/96/850268696.db2.gz ZNMBTTHPEQKMFC-WMZHIEFXSA-N 0 3 402.542 4.114 20 0 HIADHN Cc1cc(C(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)c(C)n1Cc1ccccn1 ZINC000056168646 850268771 /nfs/dbraw/zinc/26/87/71/850268771.db2.gz OAXMCYCHBYYULB-CVDCTZTESA-N 0 3 402.542 4.114 20 0 HIADHN CCCNC(=O)c1ccc(NC(=O)NC[C@H](c2ccsc2)N(CC)CC)cc1 ZINC000056641708 850429111 /nfs/dbraw/zinc/42/91/11/850429111.db2.gz KIFNPHYRRYYFQR-LJQANCHMSA-N 0 3 402.564 4.093 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)N[C@@H]1CCSc2ccc(F)cc21 ZINC000056815355 850491613 /nfs/dbraw/zinc/49/16/13/850491613.db2.gz OVBOMCQNWACZKZ-LJQANCHMSA-N 0 3 405.514 4.275 20 0 HIADHN CC[C@@H](NC(=O)N(CCN(C)C)Cc1ccc(C)o1)c1ccccc1OC(F)F ZINC000056867431 850506331 /nfs/dbraw/zinc/50/63/31/850506331.db2.gz NTFXDGISCUSOPU-GOSISDBHSA-N 0 3 409.477 4.414 20 0 HIADHN CSc1ccc(Cl)c(C(=O)NCCCCN2CCN(c3ccccc3)CC2)c1 ZINC000057113540 850549302 /nfs/dbraw/zinc/54/93/02/850549302.db2.gz VHKZVCUQGAITQY-UHFFFAOYSA-N 0 3 418.006 4.394 20 0 HIADHN CC[C@@H](CNC(=O)Nc1cc(NC(=O)C2CC2)ccc1C)N1CCc2ccccc2C1 ZINC000057543256 850664904 /nfs/dbraw/zinc/66/49/04/850664904.db2.gz OJMSJXUCGVMPQP-QFIPXVFZSA-N 0 3 420.557 4.302 20 0 HIADHN CC[C@@H](NC(=O)NC[C@H](c1ccc(OC)cc1)N1CCCC1)c1ccc(OC)cc1 ZINC000057769047 850711227 /nfs/dbraw/zinc/71/12/27/850711227.db2.gz LJYXDOKMMNRPBA-DHIUTWEWSA-N 0 3 411.546 4.291 20 0 HIADHN CC(C)(C(=O)NCCCCN1CCN(c2ccccc2)CC1)c1ccc(Cl)cc1 ZINC000058490404 850837455 /nfs/dbraw/zinc/83/74/55/850837455.db2.gz KRVTURCKYPLZDW-UHFFFAOYSA-N 0 3 413.993 4.336 20 0 HIADHN Cc1occc1C(=O)Nc1cc(NC(=O)NC[C@@H](c2ccccc2)N(C)C)ccc1F ZINC000058549501 850852784 /nfs/dbraw/zinc/85/27/84/850852784.db2.gz MCARDEIQZZNYNL-NRFANRHFSA-N 0 3 424.476 4.404 20 0 HIADHN CC(C)c1cc(C(=O)Nc2ccc3oc(=O)n(CCN(C)C)c3c2)c2ccccc2n1 ZINC000058738773 850907366 /nfs/dbraw/zinc/90/73/66/850907366.db2.gz IXMVOQOGKSUQMD-UHFFFAOYSA-N 0 3 418.497 4.080 20 0 HIADHN CN(C)CCn1c2cc(NC(=O)c3ccccc3Oc3ccccc3)ccc2oc1=O ZINC000058737586 850907492 /nfs/dbraw/zinc/90/74/92/850907492.db2.gz ARAKVILKAYDEDH-UHFFFAOYSA-N 0 3 417.465 4.201 20 0 HIADHN CN(C)CCn1c2cc(NC(=O)c3ccc(C4CCCCC4)cc3)ccc2oc1=O ZINC000058738777 850907669 /nfs/dbraw/zinc/90/76/69/850907669.db2.gz RJSLFDACSCXDRP-UHFFFAOYSA-N 0 3 407.514 4.456 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)COc3ccc(Cl)cc3Cl)cc2)CC1 ZINC000058776516 850923598 /nfs/dbraw/zinc/92/35/98/850923598.db2.gz YMLGWUDSEGNPMU-UHFFFAOYSA-N 0 3 422.356 4.148 20 0 HIADHN CCN1CCN(CCCNC(=O)c2ccccc2-c2ccc(C(F)(F)F)cc2)CC1 ZINC000058776174 850923759 /nfs/dbraw/zinc/92/37/59/850923759.db2.gz JWFVCMDOLUBWJG-UHFFFAOYSA-N 0 3 419.491 4.130 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)[C@@H](C)c1c(C)nn(C)c1C)c1ccc(C(F)(F)F)cc1 ZINC000058866992 850947571 /nfs/dbraw/zinc/94/75/71/850947571.db2.gz YIOQKWCCBJFVCS-LIRRHRJNSA-N 0 3 424.511 4.359 20 0 HIADHN Cc1cc(NC(=O)C(C)(C)C)sc1C(=O)N(CCN(C)C)Cc1ccc(F)cc1 ZINC000059001525 850976911 /nfs/dbraw/zinc/97/69/11/850976911.db2.gz BONYDEHPTJBHFK-UHFFFAOYSA-N 0 3 419.566 4.384 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N(Cc3ccccc3)c3ccccn3)cc2)CC1 ZINC000060219937 851053180 /nfs/dbraw/zinc/05/31/80/851053180.db2.gz KDVCIJPFVOGBEY-UHFFFAOYSA-N 0 3 414.553 4.459 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)[C@@H]1C[C@@H]1c1ccc(Br)cc1 ZINC000060300822 851060672 /nfs/dbraw/zinc/06/06/72/851060672.db2.gz UHOWWPCGVXRHMM-QZTJIDSGSA-N 0 3 423.420 4.030 20 0 HIADHN CCCN(C(=O)c1cccc(OCCOC)c1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000060351771 851073503 /nfs/dbraw/zinc/07/35/03/851073503.db2.gz IKFYMJWFHKGUJE-HSZRJFAPSA-N 0 3 410.558 4.229 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)CCC(=O)c3cc(C)sc3C)cc2)CC1 ZINC000060551849 851144409 /nfs/dbraw/zinc/14/44/09/851144409.db2.gz UFZZCVVQYFEOFH-UHFFFAOYSA-N 0 3 413.587 4.104 20 0 HIADHN CC1CCC(N(Cc2ccc3c(c2)OCO3)Cc2cc(=O)n3ccccc3n2)CC1 ZINC000060562199 851148421 /nfs/dbraw/zinc/14/84/21/851148421.db2.gz TXXHCQBALIKGFD-UHFFFAOYSA-N 0 3 405.498 4.004 20 0 HIADHN COc1ccc(CCCN(C)C(=O)NCC(C)(C)N2CCc3ccccc3C2)cc1 ZINC000060609580 851165212 /nfs/dbraw/zinc/16/52/12/851165212.db2.gz WVLAIZZSXZYLBZ-UHFFFAOYSA-N 0 3 409.574 4.106 20 0 HIADHN Cc1ccc(-c2cc(C(=O)NCCN3CCCCC3)c3cnn(C(C)C)c3n2)s1 ZINC000060665280 851182698 /nfs/dbraw/zinc/18/26/98/851182698.db2.gz FEUVIEUOFPJDKG-UHFFFAOYSA-N 0 3 411.575 4.265 20 0 HIADHN CC(C)(C)c1ccc(OCCNCc2ccccc2OCC(=O)N2CCCC2)cc1 ZINC000060842247 851228238 /nfs/dbraw/zinc/22/82/38/851228238.db2.gz KZSODAOKGYDWFM-UHFFFAOYSA-N 0 3 410.558 4.154 20 0 HIADHN c1c(CNCc2ccc3c(c2)OCCO3)c(-c2cccnc2)nn1Cc1ccccc1 ZINC000061013264 851273660 /nfs/dbraw/zinc/27/36/60/851273660.db2.gz LXGWDAOAZSNDOG-UHFFFAOYSA-N 0 3 412.493 4.054 20 0 HIADHN Cc1oc(-c2ccccc2)nc1CC(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000061288289 851339788 /nfs/dbraw/zinc/33/97/88/851339788.db2.gz DMXTXCZSUVVNGY-UHFFFAOYSA-N 0 3 421.566 4.423 20 0 HIADHN Cc1c(C(=O)Nc2ccc(CCN3CCSCC3)cc2)cnn1-c1ccc(F)cc1 ZINC000061288148 851339964 /nfs/dbraw/zinc/33/99/64/851339964.db2.gz HBTKBTSCWWJHSP-UHFFFAOYSA-N 0 3 424.545 4.163 20 0 HIADHN CCOC(=O)c1cc2cc(C(=O)NC[C@H](c3ccc(C)cc3)N3CCCC3)ccc2[nH]1 ZINC000061502893 851391371 /nfs/dbraw/zinc/39/13/71/851391371.db2.gz BCXWTZCRKORGBJ-HSZRJFAPSA-N 0 3 419.525 4.220 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)c1cccn1Cc1ccccc1 ZINC000061572259 851408524 /nfs/dbraw/zinc/40/85/24/851408524.db2.gz JEDBRINCNDSLBT-UHFFFAOYSA-N 0 3 405.567 4.380 20 0 HIADHN COc1ccc([C@H](NC(=O)NCC(C)(C)N2CCc3ccccc3C2)C2CC2)cc1 ZINC000061612709 851414386 /nfs/dbraw/zinc/41/43/86/851414386.db2.gz PPXGGMBJBNSXES-HSZRJFAPSA-N 0 3 407.558 4.282 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1ccc2c(c1)OC(C)(C)O2)c1cccc(OC)c1 ZINC000061723183 851425496 /nfs/dbraw/zinc/42/54/96/851425496.db2.gz RKCZMHLRMCCSHB-LJQANCHMSA-N 0 3 413.518 4.407 20 0 HIADHN O=C(NCCOc1ccc(Cl)cc1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000061791382 851453445 /nfs/dbraw/zinc/45/34/45/851453445.db2.gz ZEMVEGBWSXVYHB-UHFFFAOYSA-N 0 3 419.978 4.132 20 0 HIADHN Cc1ccccc1OCCN(C)C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000061792921 851455330 /nfs/dbraw/zinc/45/53/30/851455330.db2.gz OZMCLSFSOOUMGV-UHFFFAOYSA-N 0 3 413.587 4.129 20 0 HIADHN O=C(NCCSCc1ccccc1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000061793201 851455683 /nfs/dbraw/zinc/45/56/83/851455683.db2.gz OKOHHASTLHEHSE-UHFFFAOYSA-N 0 3 415.628 4.333 20 0 HIADHN CC[C@@H](CNC(=O)NCc1csc(Br)c1)N1CCc2ccccc2C1 ZINC000061953797 851478685 /nfs/dbraw/zinc/47/86/85/851478685.db2.gz ALALZFQVUCCRRU-KRWDZBQOSA-N 0 3 422.392 4.147 20 0 HIADHN CC(C)Oc1cccc([C@H](C)NC(=O)NCC2(N3CCSCC3)CCCC2)c1 ZINC000061971324 851484863 /nfs/dbraw/zinc/48/48/63/851484863.db2.gz KDQHCNVTNSAITG-SFHVURJKSA-N 0 3 405.608 4.196 20 0 HIADHN C[C@H]1CCCCN1CCNC(=O)C(=O)Nc1ccccc1Oc1ccccc1Cl ZINC000062122093 851503587 /nfs/dbraw/zinc/50/35/87/851503587.db2.gz ABHBEOFAFTULJK-INIZCTEOSA-N 0 3 415.921 4.061 20 0 HIADHN CCOC(=O)Nc1ccc(NC(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)cc1 ZINC000062389971 851539411 /nfs/dbraw/zinc/53/94/11/851539411.db2.gz SEKVBXDTZFCGOF-UHFFFAOYSA-N 0 3 420.460 4.129 20 0 HIADHN Cc1ccc(NC(=O)C2CC2)cc1NC(=O)N(CCN(C)C)Cc1cccc(F)c1 ZINC000062392387 851539584 /nfs/dbraw/zinc/53/95/84/851539584.db2.gz SIOLFVVBQAGBNR-UHFFFAOYSA-N 0 3 412.509 4.078 20 0 HIADHN CC(C)OCc1cccc(NC(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)c1 ZINC000062411488 851545837 /nfs/dbraw/zinc/54/58/37/851545837.db2.gz JGZKOKFBLJDWDA-UHFFFAOYSA-N 0 3 405.489 4.486 20 0 HIADHN Cc1nc(-c2cccc(NC(=O)N(CCN(C)C)Cc3cccc(Cl)c3)c2)no1 ZINC000062411536 851546378 /nfs/dbraw/zinc/54/63/78/851546378.db2.gz DNJROVFGAHHIGJ-UHFFFAOYSA-N 0 3 413.909 4.294 20 0 HIADHN COc1ccc(CNCc2ccccc2-n2cccn2)cc1OCc1cccnc1 ZINC000062425867 851549427 /nfs/dbraw/zinc/54/94/27/851549427.db2.gz RNQPDTUHXNFTCV-UHFFFAOYSA-N 0 3 400.482 4.145 20 0 HIADHN CC[C@@H](NC(=O)N(CCN(C)C)Cc1ccc(F)c(F)c1)c1ccc(OC)cc1 ZINC000062475352 851559076 /nfs/dbraw/zinc/55/90/76/851559076.db2.gz XZHDUTXRCBYIMW-OAQYLSRUSA-N 0 3 405.489 4.198 20 0 HIADHN COc1ccc([C@@H](NC(=O)N(CCN(C)C)Cc2cccc(F)c2)C(C)C)cc1 ZINC000062476210 851559223 /nfs/dbraw/zinc/55/92/23/851559223.db2.gz ULVMPHLEDBLRKI-QFIPXVFZSA-N 0 3 401.526 4.305 20 0 HIADHN CCOc1ccc(CNC(=O)N(CCN(C)C)Cc2cccc(Cl)c2)cc1OC ZINC000062484895 851562393 /nfs/dbraw/zinc/56/23/93/851562393.db2.gz PPIKFSPGZCWFEB-UHFFFAOYSA-N 0 3 419.953 4.021 20 0 HIADHN CC(C)Oc1cccc(CNC(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)c1 ZINC000062488835 851563851 /nfs/dbraw/zinc/56/38/51/851563851.db2.gz MKOSKRJYSXQUSW-UHFFFAOYSA-N 0 3 405.489 4.025 20 0 HIADHN CCOc1ccccc1CNC(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1 ZINC000062499683 851565691 /nfs/dbraw/zinc/56/56/91/851565691.db2.gz FDOWYQJAQHJDEK-UHFFFAOYSA-N 0 3 423.479 4.378 20 0 HIADHN CC(C)COc1ccccc1CNC(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000062641673 851584225 /nfs/dbraw/zinc/58/42/25/851584225.db2.gz PMFLYVLVVXTTSC-LJQANCHMSA-N 0 3 401.576 4.419 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N[C@@H](C)COc3ccc(C)cc3)c(C)c2)CC1 ZINC000062648332 851585057 /nfs/dbraw/zinc/58/50/57/851585057.db2.gz YZKXKDOEIGVEOE-FQEVSTJZSA-N 0 3 410.562 4.034 20 0 HIADHN CN(Cc1ccccc1N1CCCC1)C(=S)NC1CCN(Cc2ccccc2)CC1 ZINC000063145581 851620976 /nfs/dbraw/zinc/62/09/76/851620976.db2.gz YWEPJGAOXIREGY-UHFFFAOYSA-N 0 3 422.642 4.258 20 0 HIADHN CC(=O)CCc1ccc(O[C@H](C)C(=O)N2CCCN(Cc3ccccc3C)CC2)cc1 ZINC000063242210 851639096 /nfs/dbraw/zinc/63/90/96/851639096.db2.gz VNWIRDORXDKPER-JOCHJYFZSA-N 0 3 422.569 4.018 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)CCc2ccc(Br)cc2F)o1 ZINC000063342288 851667579 /nfs/dbraw/zinc/66/75/79/851667579.db2.gz VBDFMNSIEGOIAR-UHFFFAOYSA-N 0 3 411.315 4.013 20 0 HIADHN COc1cc(NC(=O)CN(CCc2ccccc2)C2CCCC2)cc(OC)c1OC ZINC000063754822 851755997 /nfs/dbraw/zinc/75/59/97/851755997.db2.gz YOQAWYLLOGRACO-UHFFFAOYSA-N 0 3 412.530 4.138 20 0 HIADHN COc1ccc(CCNCc2c(C)nn(-c3ccc(F)cc3)c2Cl)c(OC)c1 ZINC000063776371 851760703 /nfs/dbraw/zinc/76/07/03/851760703.db2.gz STKMGGXMDIKWBR-UHFFFAOYSA-N 0 3 403.885 4.323 20 0 HIADHN CN(C)CCN(C(=O)c1cc(-c2ccc(Br)cc2)[nH]n1)c1ccccc1 ZINC000063853391 851778390 /nfs/dbraw/zinc/77/83/90/851778390.db2.gz ZAYGXUMZJOXEAW-UHFFFAOYSA-N 0 3 413.319 4.048 20 0 HIADHN COC(=O)COc1c(C)cc(CNCc2cc(F)cc(Br)c2)cc1C ZINC000063915813 851793672 /nfs/dbraw/zinc/79/36/72/851793672.db2.gz LWGZNRAARNKBQR-UHFFFAOYSA-N 0 3 410.283 4.047 20 0 HIADHN O=C(N[C@H](C(=O)Nc1ccccc1)c1ccccc1)c1cccc(CN2CCCC2)c1 ZINC000064026263 851816949 /nfs/dbraw/zinc/81/69/49/851816949.db2.gz VUDXHOAZYWXDLY-DEOSSOPVSA-N 0 3 413.521 4.392 20 0 HIADHN COc1cc(Br)c(NC(=O)c2cccc(CN3CCCC3)c2)cc1OC ZINC000064027722 851817637 /nfs/dbraw/zinc/81/76/37/851817637.db2.gz OTEOPLGGPSMGNO-UHFFFAOYSA-N 0 3 419.319 4.314 20 0 HIADHN O=C(OCc1nc2ccccc2o1)C1CCN(c2cc(Cl)ccc2Cl)C1=O ZINC000064072159 851824347 /nfs/dbraw/zinc/82/43/47/851824347.db2.gz WSXSFEFLSKUGOH-LBPRGKRZSA-N 0 3 405.237 4.231 20 0 HIADHN CCN(CC)[C@@H](CNc1nc(C)nc2sc(C(=O)OC)c(C)c21)c1ccco1 ZINC000064114376 851829394 /nfs/dbraw/zinc/82/93/94/851829394.db2.gz UBLURUJJKZGVIH-AWEZNQCLSA-N 0 3 402.520 4.183 20 0 HIADHN CN(Cc1ccc(F)cc1)C[C@@H](O)COc1ccc(Cl)cc1Br ZINC000064137997 851833545 /nfs/dbraw/zinc/83/35/45/851833545.db2.gz IWQDVMYZDYPHKN-OAHLLOKOSA-N 0 3 402.691 4.113 20 0 HIADHN O=C(CN1CCN(CC2CCCCC2)CC1)Nc1cc(C(F)(F)F)ccc1Cl ZINC000064129929 851833600 /nfs/dbraw/zinc/83/36/00/851833600.db2.gz RAHPWMCKKJZKOD-UHFFFAOYSA-N 0 3 417.903 4.495 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)Nc1cccc(OCC#N)c1 ZINC000064530692 851922578 /nfs/dbraw/zinc/92/25/78/851922578.db2.gz FWBBHELQNHBPDM-UHFFFAOYSA-N 0 3 420.435 4.203 20 0 HIADHN Cc1nc(-c2cccc(NC(=O)N3CCCN(Cc4ccccc4C)CC3)c2)no1 ZINC000064545546 851926724 /nfs/dbraw/zinc/92/67/24/851926724.db2.gz BTYTYKGJUHMAGF-UHFFFAOYSA-N 0 3 405.502 4.093 20 0 HIADHN CN(C)Cc1ccccc1CNC(=O)CCSc1ccc(Br)cc1 ZINC000064698250 851961504 /nfs/dbraw/zinc/96/15/04/851961504.db2.gz NFRJOYKOYWFSDO-UHFFFAOYSA-N 0 3 407.377 4.309 20 0 HIADHN COc1ccc(CCN(Cc2ccccc2)Cc2cc(=O)n3cccc(C)c3n2)cc1 ZINC000064807316 851989558 /nfs/dbraw/zinc/98/95/58/851989558.db2.gz UPKRVNBBLQPBRX-UHFFFAOYSA-N 0 3 413.521 4.256 20 0 HIADHN CC(C)N(CCN1C(=O)NC(C)(C)C1=O)Cc1ccc(-c2ccccc2F)s1 ZINC000064988134 852035170 /nfs/dbraw/zinc/03/51/70/852035170.db2.gz QIKPVJXZGMTFAB-UHFFFAOYSA-N 0 3 403.523 4.095 20 0 HIADHN CCOC(=O)c1c2c(sc1NC(=O)c1cnc(CC)s1)C(C)(C)NC(C)(C)C2 ZINC000065048591 852046917 /nfs/dbraw/zinc/04/69/17/852046917.db2.gz POQPXLQJVKBGHP-UHFFFAOYSA-N 0 3 421.588 4.355 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)c2ccnc(OCc3ccccc3)c2)C1 ZINC000065141040 852076233 /nfs/dbraw/zinc/07/62/33/852076233.db2.gz QELGTXJDEMFQHF-WMZHIEFXSA-N 0 3 401.510 4.226 20 0 HIADHN COc1ccc(CN[C@@H](C)c2cccc(NS(C)(=O)=O)c2)cc1OCCC(C)C ZINC000065275215 852096926 /nfs/dbraw/zinc/09/69/26/852096926.db2.gz JSMUOCPIXPYANW-KRWDZBQOSA-N 0 3 420.575 4.342 20 0 HIADHN CCOC(=O)N(C)c1ccc(NC(=O)N2CCN(CC3CCCCC3)CC2)cc1 ZINC000065416506 852124152 /nfs/dbraw/zinc/12/41/52/852124152.db2.gz SUWYIYIBJHJAFV-UHFFFAOYSA-N 0 3 402.539 4.009 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N[C@H](C)COc3cccc(C)c3)c(C)c2)CC1 ZINC000065438614 852133042 /nfs/dbraw/zinc/13/30/42/852133042.db2.gz KCFSYUQQZNJFLU-HXUWFJFHSA-N 0 3 410.562 4.034 20 0 HIADHN CC[C@@H](CNC(=O)Nc1ccccc1OCCCOC)N1CCc2ccccc2C1 ZINC000065453003 852139310 /nfs/dbraw/zinc/13/93/10/852139310.db2.gz UIEXQUUSUZVIAK-NRFANRHFSA-N 0 3 411.546 4.060 20 0 HIADHN Cc1cc(Oc2ncccn2)ccc1NC(=O)N(CCN(C)C)Cc1ccc(F)cc1 ZINC000065481725 852153946 /nfs/dbraw/zinc/15/39/46/852153946.db2.gz RKJYWOQJRDLCGN-UHFFFAOYSA-N 0 3 423.492 4.312 20 0 HIADHN CCOc1ccccc1CNC(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1 ZINC000065484255 852154891 /nfs/dbraw/zinc/15/48/91/852154891.db2.gz GDMARSIBCIUOTB-IBGZPJMESA-N 0 3 401.576 4.419 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)NCCc1ccccc1C(F)(F)F ZINC000065513560 852163131 /nfs/dbraw/zinc/16/31/31/852163131.db2.gz GTTZUJUDBGFPPQ-UHFFFAOYSA-N 0 3 411.443 4.160 20 0 HIADHN O=C(NCCc1ccccc1C(F)(F)F)NC[C@H](c1cccs1)N1CCCC1 ZINC000065513961 852163208 /nfs/dbraw/zinc/16/32/08/852163208.db2.gz QNTMEVONZZPBIH-QGZVFWFLSA-N 0 3 411.493 4.446 20 0 HIADHN C[C@@H](NC(=O)OC(C)(C)C)C(=O)C(C#N)c1nc(-c2c(F)cccc2F)cs1 ZINC000065655691 852210653 /nfs/dbraw/zinc/21/06/53/852210653.db2.gz YHXBAXWJYARABC-MNOVXSKESA-N 0 3 407.442 4.178 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)c1cnc(-c2ccccc2F)s1 ZINC000065893572 852307587 /nfs/dbraw/zinc/30/75/87/852307587.db2.gz DYTMOCVOHBWAFV-UHFFFAOYSA-N 0 3 401.482 4.292 20 0 HIADHN COC(=O)c1ccc(C)c(NC(=O)N(CCN(C)C)Cc2cccc(Cl)c2)c1 ZINC000065983988 852339980 /nfs/dbraw/zinc/33/99/80/852339980.db2.gz OIKQPKNWLABSGJ-UHFFFAOYSA-N 0 3 403.910 4.031 20 0 HIADHN CC1CCN([C@H](CNC(=O)[C@@H]2CCCN2C(=O)OC(C)(C)C)c2cccs2)CC1 ZINC000069210725 852387798 /nfs/dbraw/zinc/38/77/98/852387798.db2.gz HSBWRDALYAMXEC-ZWKOTPCHSA-N 0 3 421.607 4.037 20 0 HIADHN Cc1noc(C)c1CSc1ccccc1C(=O)NC[C@@H](Cc1ccccc1)N(C)C ZINC000069230951 852388589 /nfs/dbraw/zinc/38/85/89/852388589.db2.gz PSXWJPXQCYYKGV-HXUWFJFHSA-N 0 3 423.582 4.486 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cnn(-c2ccc(Cl)cc2)c1)c1ccsc1 ZINC000071956473 852444731 /nfs/dbraw/zinc/44/47/31/852444731.db2.gz XAVRCPJBYBQDEI-IBGZPJMESA-N 0 3 402.951 4.400 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)c1cccc(OCc2cscn2)c1 ZINC000072013450 852465646 /nfs/dbraw/zinc/46/56/46/852465646.db2.gz XFDXXTZPSSUZLH-UHFFFAOYSA-N 0 3 413.518 4.065 20 0 HIADHN Cc1ccc2c(CN3CCC[C@H](CNC(=O)OC(C)(C)C)C3)cc(=O)oc2c1C ZINC000072037840 852480182 /nfs/dbraw/zinc/48/01/82/852480182.db2.gz WZNKUILVGBTVQB-QGZVFWFLSA-N 0 3 400.519 4.147 20 0 HIADHN O=C(CN1CCC[C@@H](c2ccccc2)CC1)N1CCC[C@@H]1c1ccc2c(c1)OCCO2 ZINC000072093077 852506254 /nfs/dbraw/zinc/50/62/54/852506254.db2.gz DVFHSUWGDVTCGA-FYYLOGMGSA-N 0 3 420.553 4.391 20 0 HIADHN O=C(Nc1nnc(Cc2cccc(F)c2)s1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000078654050 852523253 /nfs/dbraw/zinc/52/32/53/852523253.db2.gz SDSUGIWQDXMSPJ-GOSISDBHSA-N 0 3 410.518 4.119 20 0 HIADHN COc1cccc2cc(C(=O)NCCCCN3CCN(c4cccc(C)c4)CC3)oc21 ZINC000097261605 852594459 /nfs/dbraw/zinc/59/44/59/852594459.db2.gz BOJAXJBRRWGEFT-UHFFFAOYSA-N 0 3 421.541 4.082 20 0 HIADHN CC[C@H](C)[C@H](C(=O)Nc1cccc(CN2CCC(C(N)=O)CC2)c1)c1ccccc1 ZINC000097393398 852607073 /nfs/dbraw/zinc/60/70/73/852607073.db2.gz PEJLRFLWTYGKBK-MBSDFSHPSA-N 0 3 407.558 4.152 20 0 HIADHN CC(C)c1sc(NC(=O)CN2CCN(C3CCCC3)CC2)nc1-c1ccccc1 ZINC000097477891 852617092 /nfs/dbraw/zinc/61/70/92/852617092.db2.gz NNEIIEYCXCMBJZ-UHFFFAOYSA-N 0 3 412.603 4.432 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cc(C)n(-c2nccs2)c1C)c1ccsc1 ZINC000097491246 852618472 /nfs/dbraw/zinc/61/84/72/852618472.db2.gz HMSCZHGEKDKHTH-GOSISDBHSA-N 0 3 402.589 4.425 20 0 HIADHN Cc1ccc(N2CCCC2)c(C(=O)N2CCCN(CCCc3ccccc3)CC2)c1 ZINC000097574147 852635148 /nfs/dbraw/zinc/63/51/48/852635148.db2.gz OGMYMNKTBZBFES-UHFFFAOYSA-N 0 3 405.586 4.376 20 0 HIADHN C[C@@H](SCC(=O)NC[C@@H](c1ccccc1)N1CCCC1)c1nc2ccccc2[nH]1 ZINC000097656484 852645243 /nfs/dbraw/zinc/64/52/43/852645243.db2.gz CNONAFOFURRISD-UTKZUKDTSA-N 0 3 408.571 4.310 20 0 HIADHN C[N@H+](Cc1ccccc1[N-]S(=O)(=O)c1ccc2c(c1)CCO2)C1CCCCC1 ZINC000105648896 852719472 /nfs/dbraw/zinc/71/94/72/852719472.db2.gz VBRQQKPHLPVSAX-UHFFFAOYSA-N 0 3 400.544 4.187 20 0 HIADHN C[N@@H+](Cc1ccccc1[N-]S(=O)(=O)c1ccc2c(c1)CCO2)C1CCCCC1 ZINC000105648896 852719476 /nfs/dbraw/zinc/71/94/76/852719476.db2.gz VBRQQKPHLPVSAX-UHFFFAOYSA-N 0 3 400.544 4.187 20 0 HIADHN Cc1ccc(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1NC(=O)c1ccccc1 ZINC000106062334 852750223 /nfs/dbraw/zinc/75/02/23/852750223.db2.gz AIWUIDCNMWAUSM-HSZRJFAPSA-N 0 3 413.521 4.252 20 0 HIADHN CCOc1cccc2cc([C@@H](C)NC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)oc21 ZINC000107708921 852788199 /nfs/dbraw/zinc/78/81/99/852788199.db2.gz LXEDRLGZTFFJQL-YLJYHZDGSA-N 0 3 407.514 4.466 20 0 HIADHN CC[C@H](CNC(=O)c1cccc(OCc2cccnc2)c1)N1CCc2ccccc2C1 ZINC000107857461 852803796 /nfs/dbraw/zinc/80/37/96/852803796.db2.gz PQOLPYYHIFMJKZ-XMMPIXPASA-N 0 3 415.537 4.227 20 0 HIADHN CC[C@H](CNC(=O)N1CCC[C@@H]1c1cccc(OC)c1)N1CCc2ccccc2C1 ZINC000107967680 852813473 /nfs/dbraw/zinc/81/34/73/852813473.db2.gz FNTLDUCDMDVQHH-ISKFKSNPSA-N 0 3 407.558 4.379 20 0 HIADHN CC[C@@H](CNC(=O)N1CCC[C@H]1c1cccc(OC)c1)N1CCc2ccccc2C1 ZINC000107967683 852813723 /nfs/dbraw/zinc/81/37/23/852813723.db2.gz FNTLDUCDMDVQHH-UPVQGACJSA-N 0 3 407.558 4.379 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)[C@@H](C)Oc3cc(C)ccc3Cl)cc2)CC1 ZINC000108144248 852825903 /nfs/dbraw/zinc/82/59/03/852825903.db2.gz YPDVJJYNJBMFGJ-GOSISDBHSA-N 0 3 415.965 4.192 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)CCc2nc(-c3ccc(C)c(F)c3)no2)N(C)C)cc1 ZINC000108455851 852853547 /nfs/dbraw/zinc/85/35/47/852853547.db2.gz VBVWWACHHSZQRD-OAQYLSRUSA-N 0 3 424.520 4.098 20 0 HIADHN COc1cccc(CN2CCC(NC(=O)c3cc(Cl)cc4cccnc43)CC2)c1 ZINC000108532561 852856609 /nfs/dbraw/zinc/85/66/09/852856609.db2.gz HSDQSSIATCDBFH-UHFFFAOYSA-N 0 3 409.917 4.291 20 0 HIADHN COc1ccccc1[C@H](CNC(=O)[C@H]1CCCN1Cc1ccccc1)N1CCCCC1 ZINC000108934213 852895742 /nfs/dbraw/zinc/89/57/42/852895742.db2.gz DXTZVTYDYJYJJM-RPWUZVMVSA-N 0 3 421.585 4.003 20 0 HIADHN CN(Cc1ccc(OCc2ccccn2)cc1)Cc1ccccc1N1CCOCC1 ZINC000109014127 852908577 /nfs/dbraw/zinc/90/85/77/852908577.db2.gz OEIGVAXYUSWENH-UHFFFAOYSA-N 0 3 403.526 4.129 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)NCc3cccc(C(F)(F)F)c3)cc2)CC1 ZINC000109188148 852933388 /nfs/dbraw/zinc/93/33/88/852933388.db2.gz WUMOHOLJUBDMCE-UHFFFAOYSA-N 0 3 405.464 4.166 20 0 HIADHN CN(Cc1ccccc1Br)C(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000109340101 852955327 /nfs/dbraw/zinc/95/53/27/852955327.db2.gz DQALILSBTXHVJH-SFHVURJKSA-N 0 3 419.338 4.459 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)c1ccc(F)cc1Br ZINC000109500356 852978339 /nfs/dbraw/zinc/97/83/39/852978339.db2.gz HXSNKPNGMAUQKH-UHFFFAOYSA-N 0 3 423.351 4.432 20 0 HIADHN CC(C)(C)N1CCCN(C(=O)c2oc3ccccc3c2CSc2ncccn2)CC1 ZINC000109770316 853011723 /nfs/dbraw/zinc/01/17/23/853011723.db2.gz JJHFTGXIQWBFDR-UHFFFAOYSA-N 0 3 424.570 4.462 20 0 HIADHN CN(C(=O)c1csc(-c2cccs2)n1)C1CCN(CCc2ccccn2)CC1 ZINC000109795718 853015869 /nfs/dbraw/zinc/01/58/69/853015869.db2.gz HXYIBODTWWRBJV-UHFFFAOYSA-N 0 3 412.584 4.046 20 0 HIADHN COc1ccc2c(c1)CCC[C@H]2CC(=O)N(C)C1CCN(CCc2ccccn2)CC1 ZINC000109808806 853017665 /nfs/dbraw/zinc/01/76/65/853017665.db2.gz DOBKOLHOOKGONP-NRFANRHFSA-N 0 3 421.585 4.066 20 0 HIADHN C[C@@H](Cc1ccccc1F)NC(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000110121441 853062502 /nfs/dbraw/zinc/06/25/02/853062502.db2.gz JFDDBUGJCXLSBN-KKSFZXQISA-N 0 3 408.439 4.328 20 0 HIADHN O=C(Nc1ccn(-c2ccccc2)n1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000110124387 853063077 /nfs/dbraw/zinc/06/30/77/853063077.db2.gz UONGHUADORAESW-NRFANRHFSA-N 0 3 414.431 4.265 20 0 HIADHN Cc1oc(-c2ccccc2)nc1C(=O)N1CCCN(CCCc2ccccc2)CC1 ZINC000110203984 853072530 /nfs/dbraw/zinc/07/25/30/853072530.db2.gz MZIUQOYJQSAPMP-UHFFFAOYSA-N 0 3 403.526 4.431 20 0 HIADHN Cc1nc2c(cnn2C(C)C)cc1C(=O)N1CCCN(CCCc2ccccc2)CC1 ZINC000110200236 853072554 /nfs/dbraw/zinc/07/25/54/853072554.db2.gz MSAFCMUAVPJYLK-UHFFFAOYSA-N 0 3 419.573 4.101 20 0 HIADHN Cc1oc(-c2cccs2)nc1C(=O)N1CCCN(CCCc2ccccc2)CC1 ZINC000110202896 853073012 /nfs/dbraw/zinc/07/30/12/853073012.db2.gz DWRVDWMOGGSQCV-UHFFFAOYSA-N 0 3 409.555 4.492 20 0 HIADHN Cc1ccc(C(=O)NCCNCc2cc3ccccc3nc2N2CCCCC2)cc1F ZINC000110246785 853080434 /nfs/dbraw/zinc/08/04/34/853080434.db2.gz KFGKNCJMAKCKSV-UHFFFAOYSA-N 0 3 420.532 4.192 20 0 HIADHN CC(C)c1noc(-c2ccc(NC(=O)N[C@H]3CCN(Cc4ccccc4)C3)cc2)n1 ZINC000110313374 853086571 /nfs/dbraw/zinc/08/65/71/853086571.db2.gz IRJWPZQQNAYAST-FQEVSTJZSA-N 0 3 405.502 4.256 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c2sc(C(=O)N3CCC[C@@H]3CN3CCCC3)cc12 ZINC000110342241 853089439 /nfs/dbraw/zinc/08/94/39/853089439.db2.gz GSNIPLXRRVDQJY-GOSISDBHSA-N 0 3 412.534 4.235 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)C3(c4cccc(Cl)c4)CCCC3)CC2)C[C@@H](C)O1 ZINC000110407296 853096049 /nfs/dbraw/zinc/09/60/49/853096049.db2.gz CZPSETZMQSDTKM-RTBURBONSA-N 0 3 419.009 4.500 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)c3[nH]c4ccc(Cl)cc4c3Cl)CC2)C[C@@H](C)O1 ZINC000110405735 853096087 /nfs/dbraw/zinc/09/60/87/853096087.db2.gz ZYJZHMCYNAYNIP-ZIAGYGMSSA-N 0 3 424.372 4.436 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)c3[nH]c4ccc(Cl)cc4c3Cl)CC2)C[C@H](C)O1 ZINC000110405732 853096100 /nfs/dbraw/zinc/09/61/00/853096100.db2.gz ZYJZHMCYNAYNIP-KBPBESRZSA-N 0 3 424.372 4.436 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)C3(c4cccc(F)c4)CCCCC3)CC2)C[C@H](C)O1 ZINC000110412630 853096808 /nfs/dbraw/zinc/09/68/08/853096808.db2.gz QYDLPWAENWPNLV-BGYRXZFFSA-N 0 3 416.581 4.375 20 0 HIADHN Cc1ccc(-c2nc(C(=O)N3CCC(CN4C[C@@H](C)O[C@H](C)C4)CC3)cs2)cc1 ZINC000110456174 853102029 /nfs/dbraw/zinc/10/20/29/853102029.db2.gz RAMVRISFWQGXDC-QZTJIDSGSA-N 0 3 413.587 4.080 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)Nc3ccc(OC4CCCC4)cc3)CC2)C[C@H](C)O1 ZINC000110727310 853145191 /nfs/dbraw/zinc/14/51/91/853145191.db2.gz MMVWXUDRCRROST-OALUTQOASA-N 0 3 415.578 4.361 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3ccc(Cl)cc3Cl)CC2)C[C@H](C)O1 ZINC000110727238 853145295 /nfs/dbraw/zinc/14/52/95/853145295.db2.gz BJYVJGJSFWAFJL-OKILXGFUSA-N 0 3 400.350 4.347 20 0 HIADHN Cc1ccccc1CN1CCCN(C(=O)CNc2cccc(C(F)(F)F)c2)CC1 ZINC000111043755 853192113 /nfs/dbraw/zinc/19/21/13/853192113.db2.gz BMEXXYUQIODUSB-UHFFFAOYSA-N 0 3 405.464 4.160 20 0 HIADHN FC(F)c1nc2ccccc2c(NCCCN2CCN(Cc3ccccc3)CC2)n1 ZINC000111193465 853219568 /nfs/dbraw/zinc/21/95/68/853219568.db2.gz XMYHQRWARCOAHZ-UHFFFAOYSA-N 0 3 411.500 4.187 20 0 HIADHN O=C(N1CC[C@H](Nc2ccccc2)C1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000111209019 853222776 /nfs/dbraw/zinc/22/27/76/853222776.db2.gz SYGGGIYSEMYCQR-RBBKRZOGSA-N 0 3 417.475 4.154 20 0 HIADHN O=C1NC2(CCCC2)C(=O)N1CCN1CCCC[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000112692491 853240102 /nfs/dbraw/zinc/24/01/02/853240102.db2.gz GWFWMHFHYVMHAB-QGZVFWFLSA-N 0 3 409.452 4.097 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)CCCc1nc2ccccc2s1 ZINC000116072512 853281000 /nfs/dbraw/zinc/28/10/00/853281000.db2.gz GYDRSOWPLIZXHH-UHFFFAOYSA-N 0 3 417.525 4.488 20 0 HIADHN O=S(=O)([N-]C1CC[NH+](CC2CCCCC2)CC1)c1cccc(Cl)c1Cl ZINC000116077721 853281288 /nfs/dbraw/zinc/28/12/88/853281288.db2.gz JMWMVUPXVLMJAH-UHFFFAOYSA-N 0 3 405.391 4.316 20 0 HIADHN CC(C)[C@H](CNC(=O)c1ccc(NC(=O)[C@@H]2C[C@H]2C)cc1)N1CCc2ccccc2C1 ZINC000116959208 853339396 /nfs/dbraw/zinc/33/93/96/853339396.db2.gz PKGLEKJPUXYWIC-QFWMQHCXSA-N 0 3 419.569 4.094 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(N2CCOCC2)cc1)C(=O)Nc1cccc2ccccc21 ZINC000140206278 853437411 /nfs/dbraw/zinc/43/74/11/853437411.db2.gz ZBZLUVGZMJMSKA-OALUTQOASA-N 0 3 403.526 4.354 20 0 HIADHN CCCCc1oc2ccccc2c1CN(C)C(=O)NC1CCN(CCOC)CC1 ZINC000140240574 853439717 /nfs/dbraw/zinc/43/97/17/853439717.db2.gz XPHLHLBCNKQJCB-UHFFFAOYSA-N 0 3 401.551 4.028 20 0 HIADHN Cc1ccc(-c2cc(C(=O)N[C@H]3CCN(C4CC4)C3)c3cnn(C(C)C)c3n2)s1 ZINC000143963700 853526545 /nfs/dbraw/zinc/52/65/45/853526545.db2.gz HRMNBXBVVCDQKZ-HNNXBMFYSA-N 0 3 409.559 4.016 20 0 HIADHN COc1ccc([C@H](C)NC(=S)NC2CCN(Cc3ccccc3)CC2)cc1F ZINC000145500233 853552694 /nfs/dbraw/zinc/55/26/94/853552694.db2.gz RVSCZGZZTQEXQT-INIZCTEOSA-N 0 3 401.551 4.024 20 0 HIADHN COc1ccc(NC(=O)C(C#N)C(=O)c2cnc(-c3ccc(C)cc3C)s2)cc1 ZINC000147155051 853582808 /nfs/dbraw/zinc/58/28/08/853582808.db2.gz XCJIYCCFVLXVQS-SFHVURJKSA-N 0 3 405.479 4.397 20 0 HIADHN CCN(C(=O)c1ccc(N2CCN(C(C)C)CC2)cc1)c1nc2ccccc2s1 ZINC000148556389 853609616 /nfs/dbraw/zinc/60/96/16/853609616.db2.gz AFEBJTXOGWMCDG-UHFFFAOYSA-N 0 3 408.571 4.493 20 0 HIADHN COc1cc(Cl)c(C)cc1NC(=O)C(C#N)C(=O)CCc1cc(F)ccc1F ZINC000150086071 853638352 /nfs/dbraw/zinc/63/83/52/853638352.db2.gz DDOIUVRHYAYKDL-AWEZNQCLSA-N 0 3 406.816 4.215 20 0 HIADHN O[C@H](COc1ccccc1)CN1CCC(O)(c2ccc(-c3ccccc3)cc2)CC1 ZINC000164347160 853645929 /nfs/dbraw/zinc/64/59/29/853645929.db2.gz QXZLZACBEVKVOH-DEOSSOPVSA-N 0 3 403.522 4.077 20 0 HIADHN O=C(NCCN1CCCC1)c1ccc(NC(=O)c2ccc(-c3ccccc3)cc2)cc1 ZINC000164302119 853646505 /nfs/dbraw/zinc/64/65/05/853646505.db2.gz XFIDMNGICFQUOC-UHFFFAOYSA-N 0 3 413.521 4.432 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)N(Cc1ccccc1)C[C@@H]1CCCO1 ZINC000195613366 853715130 /nfs/dbraw/zinc/71/51/30/853715130.db2.gz BMAXPPBLEBYUDT-ZEQRLZLVSA-N 0 3 407.558 4.214 20 0 HIADHN COc1cccc([C@H](CNC(=O)N[C@@H]2CCc3c2cccc3Cl)N2CCCC2)c1 ZINC000195637239 853729727 /nfs/dbraw/zinc/72/97/27/853729727.db2.gz HCAINUJFNSCEEI-YADHBBJMSA-N 0 3 413.949 4.472 20 0 HIADHN O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)N(Cc1cccs1)C[C@@H]1CCCO1 ZINC000195648551 853737130 /nfs/dbraw/zinc/73/71/30/853737130.db2.gz FCUXBCRKTGTHNN-RTWAWAEBSA-N 0 3 413.587 4.103 20 0 HIADHN CC(C)(CNC(=O)NC[C@@H]1CCCO[C@@H]1c1ccccc1)N1CCc2ccccc2C1 ZINC000195660634 853742567 /nfs/dbraw/zinc/74/25/67/853742567.db2.gz JMXHTYHJVJKYRW-LADGPHEKSA-N 0 3 421.585 4.290 20 0 HIADHN CCOc1ccc([C@H]2CCCN2C(=O)CN[C@H](c2ccc(OC)cc2)C2CC2)cc1 ZINC000195667951 853747646 /nfs/dbraw/zinc/74/76/46/853747646.db2.gz QKOLFYPRNJOCCA-NOZRDPDXSA-N 0 3 408.542 4.498 20 0 HIADHN CC[C@@H](NCC(=O)N1CCC(C(=O)N2CCCCCC2)CC1)c1ccc(Cl)cc1 ZINC000195669375 853748419 /nfs/dbraw/zinc/74/84/19/853748419.db2.gz LVIODPLXXHJCFB-OAQYLSRUSA-N 0 3 419.997 4.022 20 0 HIADHN CCc1nc2cc(NC(=O)Nc3ccc(N4CCN(CC)CC4)cc3C)ccc2o1 ZINC000195701176 853767710 /nfs/dbraw/zinc/76/77/10/853767710.db2.gz ZBHHQAGYKSMYOS-UHFFFAOYSA-N 0 3 407.518 4.485 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(Br)cc1)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000195702204 853768626 /nfs/dbraw/zinc/76/86/26/853768626.db2.gz ONJDNQOHBCNBLD-UONOGXRCSA-N 0 3 411.365 4.111 20 0 HIADHN Cc1cc(C(=O)N(CCN(C)C)Cc2ccc(F)cc2F)c2c(n1)onc2C(C)C ZINC000195724772 853779430 /nfs/dbraw/zinc/77/94/30/853779430.db2.gz NNGHVFUFURMVPH-UHFFFAOYSA-N 0 3 416.472 4.137 20 0 HIADHN CCc1noc2ncc(C(=O)N(CCN(C)C)Cc3ccc(C(F)(F)F)cc3)cc12 ZINC000195724690 853779624 /nfs/dbraw/zinc/77/96/24/853779624.db2.gz HQWUXNYESWCXGS-UHFFFAOYSA-N 0 3 420.435 4.008 20 0 HIADHN Cc1ccc([C@H](CNC(=O)CSCc2cn3cc(C)ccc3n2)N2CCCC2)cc1 ZINC000195746232 853791814 /nfs/dbraw/zinc/79/18/14/853791814.db2.gz XDUOAXCQLRVLKQ-QFIPXVFZSA-N 0 3 422.598 4.138 20 0 HIADHN Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000216330350 853850099 /nfs/dbraw/zinc/85/00/99/853850099.db2.gz DFRWJQJHJZBMOD-NRFANRHFSA-N 0 3 423.532 4.221 20 0 HIADHN C[C@@H](NC[C@@H](c1cccs1)N1CCOCC1)C(=O)Nc1ccc(C(C)(C)C)cc1 ZINC000216379766 853851194 /nfs/dbraw/zinc/85/11/94/853851194.db2.gz ZEQZGGVZASHNHQ-XLIONFOSSA-N 0 3 415.603 4.036 20 0 HIADHN Cc1cc(NC(=O)CN[C@H](C)c2cccc3ccccc32)n(-c2nc(C)cc(C)n2)n1 ZINC000216624211 853857955 /nfs/dbraw/zinc/85/79/55/853857955.db2.gz ZBTOATALGCLHQY-GOSISDBHSA-N 0 3 414.513 4.030 20 0 HIADHN CCN(CC)C(=O)c1cccc(NC(=O)[C@H](C)N[C@@H](c2ccc(OC)cc2)C2CC2)c1 ZINC000218865672 853865006 /nfs/dbraw/zinc/86/50/06/853865006.db2.gz GHHMNRARKOGERZ-GAJHUEQPSA-N 0 3 423.557 4.245 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(NC(=O)C2CC2)cc1)C(=O)NC12CC3CC(CC(C3)C1)C2 ZINC000220348951 853875157 /nfs/dbraw/zinc/87/51/57/853875157.db2.gz ZZZDBEJCYNIYRC-AIIYXIPSSA-N 0 3 409.574 4.159 20 0 HIADHN COc1c(Br)cc(Br)cc1CNC[C@@H](O)CC(C)(C)C ZINC000227373825 853886318 /nfs/dbraw/zinc/88/63/18/853886318.db2.gz ACKPAHWIFAEPOZ-LBPRGKRZSA-N 0 3 409.162 4.107 20 0 HIADHN O=C(Nc1ccccc1OC[C@H]1CCCCO1)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000228233257 853888860 /nfs/dbraw/zinc/88/88/60/853888860.db2.gz DIUKCWVHVVRDKV-LEWJYISDSA-N 0 3 409.530 4.031 20 0 HIADHN Cc1ccc([C@@H](CNCc2cn(-c3ccccc3)nc2C(C)C)N2CCOCC2)o1 ZINC000236646829 853907080 /nfs/dbraw/zinc/90/70/80/853907080.db2.gz HIFQGCDNUIBLFL-JOCHJYFZSA-N 0 3 408.546 4.060 20 0 HIADHN c1cn(Cc2ccccc2)c(CCNCc2csc(-c3ccc4c(c3)OCO4)n2)n1 ZINC000236748754 853918539 /nfs/dbraw/zinc/91/85/39/853918539.db2.gz RSVWLBSQKWPJFE-UHFFFAOYSA-N 0 3 418.522 4.116 20 0 HIADHN CC(C)(C)OC(=O)NCCNCc1cccc(NC(=O)c2ccc(Cl)cc2)c1 ZINC000236788836 853923112 /nfs/dbraw/zinc/92/31/12/853923112.db2.gz GGBBFICWQFTYMP-UHFFFAOYSA-N 0 3 403.910 4.207 20 0 HIADHN CCOc1cc(CNCc2ccc(-n3ccnc3C)nc2)ccc1OCC(F)(F)F ZINC000236869935 853931070 /nfs/dbraw/zinc/93/10/70/853931070.db2.gz LPZKQWJDPNDLSP-UHFFFAOYSA-N 0 3 420.435 4.205 20 0 HIADHN CCOc1cc(CNCc2ccc3c(c2)OCCCO3)ccc1OCC(F)(F)F ZINC000236870884 853931407 /nfs/dbraw/zinc/93/14/07/853931407.db2.gz LOEDSJQCEDDPLN-UHFFFAOYSA-N 0 3 411.420 4.478 20 0 HIADHN CCOc1cc(CNC(C)(C)c2ccc(F)cc2)ccc1O[C@@H](C)C(=O)N(C)C ZINC000236909637 853936028 /nfs/dbraw/zinc/93/60/28/853936028.db2.gz VCZUPTQEMBULCN-INIZCTEOSA-N 0 3 402.510 4.105 20 0 HIADHN CCC(CC)C(=O)N1CCC(NCc2c(C)nn(Cc3ccccc3)c2Cl)CC1 ZINC000236934502 853939336 /nfs/dbraw/zinc/93/93/36/853939336.db2.gz PCONAGDNVPULFH-UHFFFAOYSA-N 0 3 416.997 4.410 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@H](C)NCc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000236984206 853947618 /nfs/dbraw/zinc/94/76/18/853947618.db2.gz ZEOIZOKJJSEVDL-HNNXBMFYSA-N 0 3 420.916 4.380 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc(CNCc2cccc(-c3ccncc3)c2)cc1 ZINC000237026389 853953727 /nfs/dbraw/zinc/95/37/27/853953727.db2.gz CKZMEHVCKWIMLN-UHFFFAOYSA-N 0 3 409.555 4.069 20 0 HIADHN CNC(=O)c1ccc(CN[C@@H]2c3cc(Br)ccc3SC[C@@H]2C)cc1 ZINC000237042113 853956652 /nfs/dbraw/zinc/95/66/52/853956652.db2.gz HJPREHHUGBATHE-SGTLLEGYSA-N 0 3 405.361 4.381 20 0 HIADHN Cc1ccc(OCc2nc(CNc3cccc(CN4CCN(C)CC4)c3)cs2)cc1 ZINC000237094604 853963005 /nfs/dbraw/zinc/96/30/05/853963005.db2.gz BXFHTBQYEHPFEK-UHFFFAOYSA-N 0 3 422.598 4.390 20 0 HIADHN CN(C(=O)c1ccncc1)c1ccc(CNCc2c[nH]nc2-c2ccc(F)cc2)cc1 ZINC000237095596 853964425 /nfs/dbraw/zinc/96/44/25/853964425.db2.gz NEIBKCBXSFSNIW-UHFFFAOYSA-N 0 3 415.472 4.177 20 0 HIADHN CN(Cc1ccccc1Br)C(=O)CCNCc1cnc(C(C)(C)C)s1 ZINC000237144481 853972713 /nfs/dbraw/zinc/97/27/13/853972713.db2.gz FIOKDHZVMCJHDR-UHFFFAOYSA-N 0 3 424.408 4.341 20 0 HIADHN COc1cc(Br)cc(C[NH2+]C[C@@H](O)c2c(Cl)cccc2Cl)c1[O-] ZINC000237211224 853982929 /nfs/dbraw/zinc/98/29/29/853982929.db2.gz RQPMTWKWSJEGDQ-CYBMUJFWSA-N 0 3 421.118 4.293 20 0 HIADHN COc1cc(CNCc2ccccc2CN2C[C@@H](C)O[C@@H](C)C2)ccc1OC(F)F ZINC000237216376 853984255 /nfs/dbraw/zinc/98/42/55/853984255.db2.gz BCUMESJZDUVYPD-CALCHBBNSA-N 0 3 420.500 4.196 20 0 HIADHN COc1cc(CNC[C@@H](O)c2cccc(C(F)(F)F)c2)c(SC)cc1OC ZINC000237235350 853987812 /nfs/dbraw/zinc/98/78/12/853987812.db2.gz ITHHGCSSQGHFNC-OAHLLOKOSA-N 0 3 401.450 4.268 20 0 HIADHN COc1cc(CNCc2ccc(-c3cccc(Cl)c3)s2)ccc1OCC(N)=O ZINC000237263373 853992989 /nfs/dbraw/zinc/99/29/89/853992989.db2.gz NFTYDSZZJQWOSV-UHFFFAOYSA-N 0 3 416.930 4.231 20 0 HIADHN COCc1nc2n(n1)C[C@H](NCc1ccc(-c3ccc(Cl)c(Cl)c3)o1)CC2 ZINC000237286983 853998496 /nfs/dbraw/zinc/99/84/96/853998496.db2.gz FDNILEJANQLBRY-CYBMUJFWSA-N 0 3 407.301 4.096 20 0 HIADHN COc1ccc(OCc2ccccn2)c(CNC[C@@H](c2ccco2)N2CCCC2)c1 ZINC000237292894 853999072 /nfs/dbraw/zinc/99/90/72/853999072.db2.gz VFBPGTNVYTZIBK-QFIPXVFZSA-N 0 3 407.514 4.189 20 0 HIADHN COc1ccc(NC(=O)C[C@@H](C)N[C@H]2CCSc3ccc(F)cc32)c(OC)c1 ZINC000237293119 853999196 /nfs/dbraw/zinc/99/91/96/853999196.db2.gz HISUYOJOQCKHCQ-DYVFJYSZSA-N 0 3 404.507 4.387 20 0 HIADHN COc1cccc([C@H](O)CNCc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)c1 ZINC000237324446 854006567 /nfs/dbraw/zinc/00/65/67/854006567.db2.gz QCFNMLBQTFUZBJ-OAQYLSRUSA-N 0 3 412.417 4.358 20 0 HIADHN COc1ccc([C@@H](Cc2ccc(F)cc2)NCc2cnc3c(c2)c(C)nn3C)cc1 ZINC000237330464 854007595 /nfs/dbraw/zinc/00/75/95/854007595.db2.gz MFBOHIMVKYCOLE-HSZRJFAPSA-N 0 3 404.489 4.498 20 0 HIADHN COc1ccc(-c2ccc(CNC[C@@](C)(O)c3cc(C)oc3C)o2)c([N+](=O)[O-])c1 ZINC000237429568 854031236 /nfs/dbraw/zinc/03/12/36/854031236.db2.gz SURZHBTYQGCPSP-OAQYLSRUSA-N 0 3 400.431 4.071 20 0 HIADHN Cc1cccn2cc(COc3ccc(CN[C@@H](C)C(=O)N4CCCC[C@@H]4C)cc3)nc12 ZINC000237486385 854043536 /nfs/dbraw/zinc/04/35/36/854043536.db2.gz LSJFPOUMVHRZHI-PMACEKPBSA-N 0 3 420.557 4.101 20 0 HIADHN C[C@H](NCc1ccc(Br)c([N+](=O)[O-])c1)c1ccc(-n2cccn2)cc1 ZINC000237583343 854058553 /nfs/dbraw/zinc/05/85/53/854058553.db2.gz RDHUXJIGWHJSIM-ZDUSSCGKSA-N 0 3 401.264 4.394 20 0 HIADHN C[C@H]1CN(Cc2ccccc2CNCc2cc(Br)ccc2F)C[C@H](C)O1 ZINC000237620389 854063961 /nfs/dbraw/zinc/06/39/61/854063961.db2.gz DJGAHCLLEYGUJV-HOTGVXAUSA-N 0 3 421.354 4.487 20 0 HIADHN C[C@](O)(CNCc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1)c1ccco1 ZINC000237737656 854086529 /nfs/dbraw/zinc/08/65/29/854086529.db2.gz QOZQEOIGQIPFTC-SFHVURJKSA-N 0 3 421.247 4.208 20 0 HIADHN Fc1ccc(CNC[C@@H](c2ccc(C(F)(F)F)cc2)N2CCOCC2)c(F)c1 ZINC000237777201 854096090 /nfs/dbraw/zinc/09/60/90/854096090.db2.gz RHQJZDHPSNRPTH-IBGZPJMESA-N 0 3 400.391 4.147 20 0 HIADHN Clc1nc2ccccn2c1CNC[C@@H]1CCN(c2ccc(Br)cc2)C1 ZINC000237805147 854100847 /nfs/dbraw/zinc/10/08/47/854100847.db2.gz QWNPKCLOCQXUEX-AWEZNQCLSA-N 0 3 419.754 4.366 20 0 HIADHN O=C(CCNCc1ccc(-c2ccc(Cl)c(Cl)c2)o1)NCc1cccnc1 ZINC000237807592 854101119 /nfs/dbraw/zinc/10/11/19/854101119.db2.gz VNFQRHWHCCOMGI-UHFFFAOYSA-N 0 3 404.297 4.445 20 0 HIADHN Cc1cc(CNCc2ccnc(N3CCN(c4ccc(F)cc4)CC3)c2)ccc1F ZINC000237805424 854101342 /nfs/dbraw/zinc/10/13/42/854101342.db2.gz QGPYGEQZTWCNOG-UHFFFAOYSA-N 0 3 408.496 4.285 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CNC[C@H](O)COc1cccc(C(F)(F)F)c1 ZINC000237852999 854108466 /nfs/dbraw/zinc/10/84/66/854108466.db2.gz KFARPMYTUVLLQV-IBGZPJMESA-N 0 3 419.447 4.037 20 0 HIADHN O=[N+]([O-])c1ccc(Cl)cc1CNC[C@H](c1cccc(Cl)c1)N1CCOCC1 ZINC000237875944 854112799 /nfs/dbraw/zinc/11/27/99/854112799.db2.gz QVQFOYLKNRYXFB-LJQANCHMSA-N 0 3 410.301 4.065 20 0 HIADHN O=c1ccccn1Cc1ccc(CNCc2ccc(OC(F)F)c(Cl)c2)cc1 ZINC000237883461 854114851 /nfs/dbraw/zinc/11/48/51/854114851.db2.gz NFYULQYVSRKSJN-UHFFFAOYSA-N 0 3 404.844 4.441 20 0 HIADHN O=S(=O)(c1ccc(CNCc2cccc(-c3ccncc3)c2)cc1)N1CCCCC1 ZINC000238033984 854136921 /nfs/dbraw/zinc/13/69/21/854136921.db2.gz DZIVIBFNQQUDBB-UHFFFAOYSA-N 0 3 421.566 4.213 20 0 HIADHN OC1CCN(Cc2ccccc2NCc2csc(-c3ccc4c(c3)OCO4)n2)CC1 ZINC000238167426 854149536 /nfs/dbraw/zinc/14/95/36/854149536.db2.gz WHRUDFYWKYIRNH-UHFFFAOYSA-N 0 3 423.538 4.108 20 0 HIADHN CCCN(CCN(C)C)C(=O)c1cc2c(C)nn(Cc3ccc(F)cc3)c2s1 ZINC000261449390 854266583 /nfs/dbraw/zinc/26/65/83/854266583.db2.gz VLHYFCHPIASIBJ-UHFFFAOYSA-N 0 3 402.539 4.007 20 0 HIADHN CC1CCN([C@H](CNc2nc3c(cnn3C(C)(C)C)c(=O)[nH]2)c2ccccc2)CC1 ZINC000301147823 854311611 /nfs/dbraw/zinc/31/16/11/854311611.db2.gz HTHFQJONPYYPHP-LJQANCHMSA-N 0 3 408.550 4.172 20 0 HIADHN CN(C)[C@@H](CNc1cc(C(F)(F)F)nc(-c2cccnc2)n1)c1ccc(F)cc1 ZINC000301262618 854341769 /nfs/dbraw/zinc/34/17/69/854341769.db2.gz BXMZOHQCBGHJLU-INIZCTEOSA-N 0 3 405.399 4.411 20 0 HIADHN Cc1nc2ccc(Br)cc2c(N2CCC(c3nncn3C)CC2)c1C ZINC000301372965 854374354 /nfs/dbraw/zinc/37/43/54/854374354.db2.gz QIDLNIGHCXSFJQ-UHFFFAOYSA-N 0 3 400.324 4.127 20 0 HIADHN Cc1nc(-c2ccc(NC3CC[NH+]([C@H](C)c4ccccc4)CC3)nc2)[n-]c(=O)c1C ZINC000301388993 854379915 /nfs/dbraw/zinc/37/99/15/854379915.db2.gz FHTCNOOBUSHKOP-GOSISDBHSA-N 0 3 403.530 4.499 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(NC[C@H]3CCC[N@H+](C)[C@@H]3c3cccs3)nc2)n1 ZINC000301421494 854390499 /nfs/dbraw/zinc/39/04/99/854390499.db2.gz NSQHXNCWYBWQKH-VFNWGFHPSA-N 0 3 409.559 4.363 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(NC[C@H]3CCC[N@@H+](C)[C@@H]3c3cccs3)nc2)n1 ZINC000301421494 854390507 /nfs/dbraw/zinc/39/05/07/854390507.db2.gz NSQHXNCWYBWQKH-VFNWGFHPSA-N 0 3 409.559 4.363 20 0 HIADHN Cc1nc(-c2ccc(NC[C@H]3CCC[N@@H+](C)[C@@H]3c3cccs3)nc2)[n-]c(=O)c1C ZINC000301448298 854397120 /nfs/dbraw/zinc/39/71/20/854397120.db2.gz WHCPVCIDWWKYIK-UZLBHIALSA-N 0 3 409.559 4.418 20 0 HIADHN Cc1nc(-c2ccc(NC[C@H]3CCC[N@H+](C)[C@@H]3c3cccs3)nc2)[n-]c(=O)c1C ZINC000301448298 854397124 /nfs/dbraw/zinc/39/71/24/854397124.db2.gz WHCPVCIDWWKYIK-UZLBHIALSA-N 0 3 409.559 4.418 20 0 HIADHN O=S(=O)(c1ccc(N2CC[C@H]3[C@H](CCCN3Cc3ccccc3)C2)cc1)C(F)F ZINC000301660364 854439062 /nfs/dbraw/zinc/43/90/62/854439062.db2.gz CLSBFJRUIUYFOQ-NQIIRXRSSA-N 0 3 420.525 4.174 20 0 HIADHN COCc1nc2scc(-c3ccccc3)c2c(NC2CCN([C@@H]3CCOC3)CC2)n1 ZINC000301720552 854451593 /nfs/dbraw/zinc/45/15/93/854451593.db2.gz MJOWBOBKVSKJCA-GOSISDBHSA-N 0 3 424.570 4.170 20 0 HIADHN Cc1nc2ccc(Br)cc2c(N2CCC(CC(=O)N(C)C)CC2)c1C ZINC000302027304 854517624 /nfs/dbraw/zinc/51/76/24/854517624.db2.gz AIDAWPWKGGHJLK-UHFFFAOYSA-N 0 3 404.352 4.309 20 0 HIADHN CC(C)[C@H](CNc1nn2cc(-c3cccnc3)nc2s1)N1CCc2ccccc2C1 ZINC000302076873 854527000 /nfs/dbraw/zinc/52/70/00/854527000.db2.gz HKIJEYSBTCXHAJ-NRFANRHFSA-N 0 3 418.570 4.348 20 0 HIADHN CC(C)(CNc1nn2cc(-c3cccnc3)nc2s1)N1CCc2ccccc2C1 ZINC000302099717 854530412 /nfs/dbraw/zinc/53/04/12/854530412.db2.gz PKHAABIKTRXACU-UHFFFAOYSA-N 0 3 404.543 4.102 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)Nc2nn3cc(-c4cccnc4)nc3s2)cc1 ZINC000302114467 854532422 /nfs/dbraw/zinc/53/24/22/854532422.db2.gz BYSFQFJLMXBAGK-LJQANCHMSA-N 0 3 420.542 4.110 20 0 HIADHN COc1cccc([C@@H](CNc2nn3cc(-c4cccnc4)nc3s2)N2CCCC2)c1 ZINC000302117759 854533220 /nfs/dbraw/zinc/53/32/20/854533220.db2.gz WSOIKHRMBPFYAA-HXUWFJFHSA-N 0 3 420.542 4.110 20 0 HIADHN C[C@H]1C[C@H](Nc2nn3cc(-c4cccnc4)nc3s2)CCN1Cc1ccccc1 ZINC000302200004 854549193 /nfs/dbraw/zinc/54/91/93/854549193.db2.gz UUDUZWVCEOHZNZ-QFBILLFUSA-N 0 3 404.543 4.318 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(NC[C@]3(C)CCC[N@@H+]3Cc3ccccc3)nc2)n1 ZINC000302410965 854569348 /nfs/dbraw/zinc/56/93/48/854569348.db2.gz LNKFHVTYMTXGNQ-DEOSSOPVSA-N 0 3 403.530 4.273 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(NC[C@]3(C)CCC[N@H+]3Cc3ccccc3)nc2)n1 ZINC000302410965 854569360 /nfs/dbraw/zinc/56/93/60/854569360.db2.gz LNKFHVTYMTXGNQ-DEOSSOPVSA-N 0 3 403.530 4.273 20 0 HIADHN COc1ccc([C@H](NCC(=O)Nc2ccccc2C(=O)NC2CCCC2)C(C)C)cc1 ZINC000302755938 854622519 /nfs/dbraw/zinc/62/25/19/854622519.db2.gz KQOZGAXKICDIEZ-XMMPIXPASA-N 0 3 423.557 4.293 20 0 HIADHN O=C(C1CCN(c2ccnc3ccc(Oc4ccccc4)cc32)CC1)N1CCOCC1 ZINC000302798810 854636675 /nfs/dbraw/zinc/63/66/75/854636675.db2.gz RPSVIHGCKNFTOS-UHFFFAOYSA-N 0 3 417.509 4.102 20 0 HIADHN COc1ccc([C@@H](CNc2ncc(Cl)cc2Br)N(C)C)cc1OC ZINC000302801077 854637587 /nfs/dbraw/zinc/63/75/87/854637587.db2.gz CJBJADJSYXSGAY-CQSZACIVSA-N 0 3 414.731 4.230 20 0 HIADHN COc1ccc([C@@H](CNC(=O)CCSc2ccccc2F)N2CCCC2)cc1 ZINC000302837812 854650743 /nfs/dbraw/zinc/65/07/43/854650743.db2.gz OKQFCDVAYFIDKB-HXUWFJFHSA-N 0 3 402.535 4.270 20 0 HIADHN COc1ccccc1C[C@H]1CCCN1C(=O)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000303003374 854718111 /nfs/dbraw/zinc/71/81/11/854718111.db2.gz OSTKKVIAIOETCF-PKTZIBPZSA-N 0 3 407.558 4.249 20 0 HIADHN O[C@@H](CSc1ncnc2sc3c(c21)CCCC3)CN1CCc2ccccc2C1 ZINC000303065178 854745179 /nfs/dbraw/zinc/74/51/79/854745179.db2.gz YNTYZFSGKVELNV-QGZVFWFLSA-N 0 3 411.596 4.081 20 0 HIADHN Cc1oc(-c2ccccc2)nc1CC(=O)N1CCCN(CCCc2ccccc2)CC1 ZINC000303084649 854753127 /nfs/dbraw/zinc/75/31/27/854753127.db2.gz ASKGFSNIBJVPAP-UHFFFAOYSA-N 0 3 417.553 4.360 20 0 HIADHN FC(F)(F)COc1cccc(CN2CCC(c3nc(-c4ccccn4)no3)CC2)c1 ZINC000303094801 854756920 /nfs/dbraw/zinc/75/69/20/854756920.db2.gz AEICNDGKJRELGK-UHFFFAOYSA-N 0 3 418.419 4.452 20 0 HIADHN CCOc1ccccc1CNC(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000303097496 854758125 /nfs/dbraw/zinc/75/81/25/854758125.db2.gz GFFPJHQJBHYVDJ-NRFANRHFSA-N 0 3 406.448 4.156 20 0 HIADHN COc1ccc(CCNC(=O)[C@@H](C)N2CCC[C@H](c3ccccc3)CC2)cc1OC ZINC000303195741 854812315 /nfs/dbraw/zinc/81/23/15/854812315.db2.gz NKMBSRJIOGVSPJ-KNQAVFIVSA-N 0 3 410.558 4.021 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)Nc1ccc(-n2cccn2)c(Cl)c1 ZINC000303228569 854826771 /nfs/dbraw/zinc/82/67/71/854826771.db2.gz XJIMCDOFOZILFN-UHFFFAOYSA-N 0 3 419.982 4.009 20 0 HIADHN O=S(=O)(NC1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1)c1ccc2c(c1)CCCC2 ZINC000303434853 854935748 /nfs/dbraw/zinc/93/57/48/854935748.db2.gz DFNLRMWHBUHXSA-NOTZXAQLSA-N 0 3 410.583 4.039 20 0 HIADHN CCN1CCCC[C@H]1CNC(=O)c1cnn(-c2ccc(Cl)cc2)c1C(F)(F)F ZINC000303481809 854974898 /nfs/dbraw/zinc/97/48/98/854974898.db2.gz OOVPDFYXXMJCSE-HNNXBMFYSA-N 0 3 414.859 4.149 20 0 HIADHN Cc1c(Cl)cccc1S(=O)(=O)NC1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1 ZINC000303489303 854980525 /nfs/dbraw/zinc/98/05/25/854980525.db2.gz RUQDWAJFOAHMHD-YQQQUEKLSA-N 0 3 404.963 4.122 20 0 HIADHN CCN1CCCC[C@H]1CNC(=O)c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1 ZINC000303558884 855039735 /nfs/dbraw/zinc/03/97/35/855039735.db2.gz XCIOCAKKDSUQAY-KRWDZBQOSA-N 0 3 407.436 4.497 20 0 HIADHN CCN(CC)C(=O)[C@H]1CCCN1CCC(=O)Nc1ccccc1Oc1ccccc1 ZINC000303577513 855052430 /nfs/dbraw/zinc/05/24/30/855052430.db2.gz LZWCQIHQURSVJU-OAQYLSRUSA-N 0 3 409.530 4.140 20 0 HIADHN c1ccc(-c2nc3c(c(Nc4cccc(CN5CCSCC5)c4)n2)CCC3)nc1 ZINC000303637821 855094873 /nfs/dbraw/zinc/09/48/73/855094873.db2.gz HCSADQUOYRIAID-UHFFFAOYSA-N 0 3 403.555 4.320 20 0 HIADHN O=C(Cc1csc(Cc2ccc(F)cc2)n1)O[C@@H]1CCN(Cc2ccccc2)C1 ZINC000303651904 855106068 /nfs/dbraw/zinc/10/60/68/855106068.db2.gz FBCQKXDHTKEIBO-OAQYLSRUSA-N 0 3 410.514 4.233 20 0 HIADHN CC1CCC(N2CCN(CC(=O)Nc3ccc(Cl)cc3C(F)(F)F)CC2)CC1 ZINC000303742782 855165926 /nfs/dbraw/zinc/16/59/26/855165926.db2.gz YVFHJVROTNZBIK-UHFFFAOYSA-N 0 3 417.903 4.494 20 0 HIADHN COc1ccc([C@H]2CCCN2CCOc2ccc3c(C)cc(=O)oc3c2)c(OC)c1 ZINC000303782638 855196047 /nfs/dbraw/zinc/19/60/47/855196047.db2.gz DBWOBTOMSVIGEA-OAQYLSRUSA-N 0 3 409.482 4.335 20 0 HIADHN Cc1cc(=O)oc2cc(OCCN3CCC[C@@H]3c3ccc4c(c3)OCCO4)ccc12 ZINC000303786680 855197690 /nfs/dbraw/zinc/19/76/90/855197690.db2.gz DRHSCDAFRAFHRN-HXUWFJFHSA-N 0 3 407.466 4.089 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)COc1ccc(Cl)c2cccnc12 ZINC000303789213 855199409 /nfs/dbraw/zinc/19/94/09/855199409.db2.gz FCIUPSFLSJMXDH-SFHVURJKSA-N 0 3 423.944 4.390 20 0 HIADHN O=C(Nc1ccccc1)c1cccc(CN2CCC[C@H](c3nnc4ccccn43)C2)c1 ZINC000303796808 855202594 /nfs/dbraw/zinc/20/25/94/855202594.db2.gz WAJHVBVDBBCTGY-NRFANRHFSA-N 0 3 411.509 4.361 20 0 HIADHN CCc1ccccc1NC(=O)CNC(=O)CN(CC1CCC1)[C@H](C)c1ccccc1 ZINC000303823363 855224841 /nfs/dbraw/zinc/22/48/41/855224841.db2.gz KLHMWQGKGKRORA-LJQANCHMSA-N 0 3 407.558 4.167 20 0 HIADHN CN(C)Cc1cccc(C(=O)NCC2(c3cccc(Br)c3)CCC2)c1 ZINC000303828991 855228347 /nfs/dbraw/zinc/22/83/47/855228347.db2.gz GWXMELLCPBWKMU-UHFFFAOYSA-N 0 3 401.348 4.362 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1cccc(-c2nccn2C)c1 ZINC000303856604 855251627 /nfs/dbraw/zinc/25/16/27/855251627.db2.gz LPPBVIPEGMHDEO-LJQANCHMSA-N 0 3 403.530 4.215 20 0 HIADHN COCCCOc1ccccc1NC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C ZINC000303863142 855257716 /nfs/dbraw/zinc/25/77/16/855257716.db2.gz MUFSPOBGMCUNBA-FQEVSTJZSA-N 0 3 411.546 4.230 20 0 HIADHN Cc1ccc(NC(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)cc1C(=O)NC(C)C ZINC000303923260 855293703 /nfs/dbraw/zinc/29/37/03/855293703.db2.gz ULHAEEOCMPTYIC-HXUWFJFHSA-N 0 3 422.573 4.262 20 0 HIADHN CC(C)Cc1ccc(CC(=O)Nc2ccc(C(=O)N(C)[C@H]3CCCN(C)C3)cc2)cc1 ZINC000303971251 855330849 /nfs/dbraw/zinc/33/08/49/855330849.db2.gz ZZIAPNSBNXHHBT-DEOSSOPVSA-N 0 3 421.585 4.233 20 0 HIADHN COc1ccc(CN[C@H]2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)c(Br)c1 ZINC000310950894 855369357 /nfs/dbraw/zinc/36/93/57/855369357.db2.gz RCBFMAPMZNOMCF-ZFWWWQNUSA-N 0 3 413.356 4.335 20 0 HIADHN O[C@@H](CNCc1cc(Br)cc2c1OCC2)c1cccc(C(F)(F)F)c1 ZINC000327953665 855422014 /nfs/dbraw/zinc/42/20/14/855422014.db2.gz KRRASVHIFRJXGC-INIZCTEOSA-N 0 3 416.237 4.226 20 0 HIADHN COc1cc(Br)ccc1C(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000388600345 855448047 /nfs/dbraw/zinc/44/80/47/855448047.db2.gz VMQMCJJNOWEUMU-GOSISDBHSA-N 0 3 417.347 4.194 20 0 HIADHN CN(C(=O)c1ccc(F)c(Br)c1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000388898860 855449118 /nfs/dbraw/zinc/44/91/18/855449118.db2.gz SGRYTJXKBCEEOU-QGZVFWFLSA-N 0 3 405.311 4.325 20 0 HIADHN CC(C)(C)OC(=O)N1CCC2(C[C@@H]2NCc2csc(Br)c2)CC1 ZINC000389922647 855452496 /nfs/dbraw/zinc/45/24/96/855452496.db2.gz TVSJNGIPZLJOTP-ZDUSSCGKSA-N 0 3 401.370 4.390 20 0 HIADHN CC(C)(C)OC(=O)N1CCC2(C[C@H]2NCc2csc(Br)c2)CC1 ZINC000389922645 855452728 /nfs/dbraw/zinc/45/27/28/855452728.db2.gz TVSJNGIPZLJOTP-CYBMUJFWSA-N 0 3 401.370 4.390 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)c1c(F)cc(Br)cc1F ZINC000393057754 855467992 /nfs/dbraw/zinc/46/79/92/855467992.db2.gz OOTGRZMJKQOHPP-KRWDZBQOSA-N 0 3 409.274 4.294 20 0 HIADHN COc1ccc(Br)cc1C(=O)NC[C@H](c1ccccc1)N1CCCC1 ZINC000393004655 855468049 /nfs/dbraw/zinc/46/80/49/855468049.db2.gz PRDVKOBFXOVMFM-GOSISDBHSA-N 0 3 403.320 4.025 20 0 HIADHN CC(C)(C)OC(=O)N1CCC[C@H](N[C@@H]2CCOc3ccc(Br)cc32)C1 ZINC000394130853 855469888 /nfs/dbraw/zinc/46/98/88/855469888.db2.gz VSGNRSDVSXZTLW-GOEBONIOSA-N 0 3 411.340 4.262 20 0 HIADHN CCOc1c(Br)cc(Br)cc1CNCCC1(O)CCC1 ZINC000397769033 855472963 /nfs/dbraw/zinc/47/29/63/855472963.db2.gz KOIYUSOWCUKDSK-UHFFFAOYSA-N 0 3 407.146 4.005 20 0 HIADHN C[C@@]1(CNC(=O)c2cc(Br)cnc2Cl)CCCN1Cc1ccccc1 ZINC000397927894 855473971 /nfs/dbraw/zinc/47/39/71/855473971.db2.gz CEMFMCBTILYWTQ-IBGZPJMESA-N 0 3 422.754 4.282 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)c1c(F)cccc1Br ZINC000398067063 855475168 /nfs/dbraw/zinc/47/51/68/855475168.db2.gz ICIDFRYIKNIEPA-GOSISDBHSA-N 0 3 407.327 4.475 20 0 HIADHN CCC(=O)c1ccc(OCCCCC(=O)N2C[C@H](N(C)C)Cc3ccccc32)cc1 ZINC000409540983 855533291 /nfs/dbraw/zinc/53/32/91/855533291.db2.gz LZXSWRMOCXIXDP-OAQYLSRUSA-N 0 3 408.542 4.348 20 0 HIADHN COc1ccccc1-n1ncc(C(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)c1C ZINC000409608296 855563111 /nfs/dbraw/zinc/56/31/11/855563111.db2.gz NJUFAVSOLRGJFD-QHCPKHFHSA-N 0 3 418.541 4.065 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3C[C@@H](C)O[C@@H](c4ccccc4)C3)c(C)c2)CC1 ZINC000409617224 855566560 /nfs/dbraw/zinc/56/65/60/855566560.db2.gz ROEONYDIYQYXQK-HYBUGGRVSA-N 0 3 422.573 4.131 20 0 HIADHN CCOc1cc2c(cc1[C@@H]1C[C@H]1C(=O)N(CCN(C)C)c1ccccc1)O[C@H](C)C2 ZINC000409753237 855636494 /nfs/dbraw/zinc/63/64/94/855636494.db2.gz QUTQDGDSAQRJLB-PIPMEXSNSA-N 0 3 408.542 4.107 20 0 HIADHN CCOc1cc2c(cc1[C@@H]1C[C@@H]1C(=O)N(CCN(C)C)c1ccccc1)O[C@H](C)C2 ZINC000409753232 855636776 /nfs/dbraw/zinc/63/67/76/855636776.db2.gz QUTQDGDSAQRJLB-AGHHOFFYSA-N 0 3 408.542 4.107 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)[C@@H]2CCO[C@H]2c2ccc(Cl)c(F)c2)CN1Cc1ccccc1 ZINC000409814202 855668315 /nfs/dbraw/zinc/66/83/15/855668315.db2.gz SQQNNMROVPBLJD-YHFKFMBFSA-N 0 3 416.924 4.336 20 0 HIADHN CN1CC[C@H](NC(=O)C(C)(C)c2ccccc2Br)[C@@H]1c1ccccc1 ZINC000409882347 855705097 /nfs/dbraw/zinc/70/50/97/855705097.db2.gz JMQRAWVONKRWFN-OALUTQOASA-N 0 3 401.348 4.288 20 0 HIADHN C[C@@H](CN(C)Cc1ccccc1)NC(=O)[C@@H]1CCO[C@H]1c1ccc(Cl)c(F)c1 ZINC000409892315 855709524 /nfs/dbraw/zinc/70/95/24/855709524.db2.gz MFHSOVQNNGYPOQ-KLHJMIIUSA-N 0 3 404.913 4.193 20 0 HIADHN C[C@H](C(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1)c1ccc(C(F)(F)F)cc1 ZINC000409994999 855768297 /nfs/dbraw/zinc/76/82/97/855768297.db2.gz XUEUVRZNTBGKFW-UWJYYQICSA-N 0 3 420.475 4.216 20 0 HIADHN COc1ccc([C@@H](CNC(=O)NCc2ccc(OC(C)C)cc2)N2CCCC2)cc1 ZINC000410213858 855864896 /nfs/dbraw/zinc/86/48/96/855864896.db2.gz HYKGJEXNZMYKGH-HSZRJFAPSA-N 0 3 411.546 4.119 20 0 HIADHN C[C@@H](NC(=O)NCc1ccc(CN2CCN(C)CC2)cc1)c1cccc2ccccc21 ZINC000410376692 855960752 /nfs/dbraw/zinc/96/07/52/855960752.db2.gz VWEUIJMOAYJSDG-HXUWFJFHSA-N 0 3 416.569 4.148 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Nc1ccc(Br)cc1F ZINC000426014221 856048449 /nfs/dbraw/zinc/04/84/49/856048449.db2.gz CFYVJKMHCKIXPV-UHFFFAOYSA-N 0 3 400.317 4.245 20 0 HIADHN CC[C@@H](C)[C@H](NC(=O)N1CCN(C2CCOCC2)C[C@H]1C)c1ccc(Cl)cc1 ZINC000426025261 856055117 /nfs/dbraw/zinc/05/51/17/856055117.db2.gz YSIGQGRLKYPCFO-LZJOCLMNSA-N 0 3 407.986 4.322 20 0 HIADHN CCOc1ccccc1[C@H](CC(C)C)NC(=O)N1CCN(C2CCOCC2)C[C@H]1C ZINC000426068643 856085275 /nfs/dbraw/zinc/08/52/75/856085275.db2.gz CSABJFSQAPDBPV-KNQAVFIVSA-N 0 3 417.594 4.067 20 0 HIADHN Cc1nc(CCCC(=O)N(CCN(C)C)Cc2ccc(Br)cc2)cs1 ZINC000426102331 856108882 /nfs/dbraw/zinc/10/88/82/856108882.db2.gz QUZCDOPKQYXJCF-UHFFFAOYSA-N 0 3 424.408 4.127 20 0 HIADHN O=C(Nc1c[nH]nc1[C@H]1CCCN(Cc2scnc2C2CC2)C1)c1ccccc1 ZINC000426144242 856137831 /nfs/dbraw/zinc/13/78/31/856137831.db2.gz CNPSXHBUGLNZFH-KRWDZBQOSA-N 0 3 407.543 4.376 20 0 HIADHN C[C@@H](NC(=O)N1CCN(C2CCOCC2)C[C@@H]1C)c1ccc(Cl)c2ccccc21 ZINC000426200257 856171485 /nfs/dbraw/zinc/17/14/85/856171485.db2.gz GYXZLFUADVICRB-DLBZAZTESA-N 0 3 415.965 4.449 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)N[C@@H](C)c1nc(C(F)(F)F)cs1 ZINC000426208107 856177292 /nfs/dbraw/zinc/17/72/92/856177292.db2.gz MMDLERVSTVJICD-OLZOCXBDSA-N 0 3 400.470 4.043 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@H]1CCOC2(CCCCC2)C1)c1cccc(OC)c1 ZINC000426231486 856191356 /nfs/dbraw/zinc/19/13/56/856191356.db2.gz ILPHJSAVQOHNMV-RBBKRZOGSA-N 0 3 417.594 4.259 20 0 HIADHN C[C@@H](N[C@H]1c2cc(Br)ccc2CC1(C)C)c1ccc(S(N)(=O)=O)cc1 ZINC000426333535 856249555 /nfs/dbraw/zinc/24/95/55/856249555.db2.gz IEURMXOWKLJQRZ-XIKOKIGWSA-N 0 3 423.376 4.071 20 0 HIADHN C[C@@H](N[C@H]1c2cccc(Br)c2CC1(C)C)c1cccc(S(N)(=O)=O)c1 ZINC000426330169 856250200 /nfs/dbraw/zinc/25/02/00/856250200.db2.gz JGMDCWCGLPBOFG-XIKOKIGWSA-N 0 3 423.376 4.071 20 0 HIADHN Cc1ccnc(-c2nnc([C@H](C)[NH2+]C[C@@H](C)c3cccc(Br)c3)[n-]2)c1 ZINC000426510437 856326324 /nfs/dbraw/zinc/32/63/24/856326324.db2.gz OIJSKHRVFKAHQE-KGLIPLIRSA-N 0 3 400.324 4.392 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3nc4c(s3)CCCCC4)CC2)C[C@@H](C)O1 ZINC000426635952 856386074 /nfs/dbraw/zinc/38/60/74/856386074.db2.gz YFPUNLLGIVBLQU-IAGOWNOFSA-N 0 3 420.623 4.155 20 0 HIADHN CCN(C(=O)c1cc(C)nc(C(F)(F)F)n1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000426640137 856389194 /nfs/dbraw/zinc/38/91/94/856389194.db2.gz QEVJGJRQQYGGCM-NVXWUHKLSA-N 0 3 406.452 4.101 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N[C@H](C)c1cc(Cl)ccc1Cl ZINC000426815865 856494215 /nfs/dbraw/zinc/49/42/15/856494215.db2.gz MQHHUFLFNKXPPS-CYBMUJFWSA-N 0 3 408.329 4.179 20 0 HIADHN CC[C@H](C)Oc1ccc(C(=O)Nc2ccc(C(=O)N(C)[C@H]3CCCN(C)C3)cc2)cc1 ZINC000426947154 856555851 /nfs/dbraw/zinc/55/58/51/856555851.db2.gz BPFRNVLNWSRPGR-AVRDEDQJSA-N 0 3 423.557 4.282 20 0 HIADHN C[C@@H](C(=O)Nc1cccc(-c2cn(Cc3ccccc3)nn2)c1)N1[C@H](C)CC[C@H]1C ZINC000426957088 856562292 /nfs/dbraw/zinc/56/22/92/856562292.db2.gz WQZWQCXZBHWDQA-QRVBRYPASA-N 0 3 403.530 4.193 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)N[C@@H]2CCC[C@H]2OCc2ccccc2)CC1 ZINC000426980076 856577141 /nfs/dbraw/zinc/57/71/41/856577141.db2.gz HUWCVMGCPQJLDU-JWQCQUIFSA-N 0 3 421.585 4.430 20 0 HIADHN CN1C[C@@H](NC(=O)c2cc3ccccc3n2CC(F)(F)F)[C@@H](c2ccccc2)C1 ZINC000426986436 856580726 /nfs/dbraw/zinc/58/07/26/856580726.db2.gz KYVLZNUABCGNPF-QZTJIDSGSA-N 0 3 401.432 4.031 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)c3cc(Cl)cc(C(F)(F)F)c3)CC2)C[C@@H](C)O1 ZINC000427128133 856656570 /nfs/dbraw/zinc/65/65/70/856656570.db2.gz YURNHJBDFAZKEY-ZIAGYGMSSA-N 0 3 418.887 4.320 20 0 HIADHN COc1cccc(-c2c[nH]cc2C(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)c1 ZINC000437468118 862829916 /nfs/dbraw/zinc/82/99/16/862829916.db2.gz BHIBDJYJFRHEAR-IBGZPJMESA-N 0 3 403.526 4.427 20 0 HIADHN CC[C@H](C)Oc1ccc(C(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)cc1 ZINC000427286056 856751018 /nfs/dbraw/zinc/75/10/18/856751018.db2.gz CCVONROMCAZJBF-UFYCRDLUSA-N 0 3 402.579 4.215 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Cc3ccc(Cl)c(Cl)c3)CC2)C[C@H](C)O1 ZINC000427285951 856751283 /nfs/dbraw/zinc/75/12/83/856751283.db2.gz BAYWFWQWZWCOHA-IYBDPMFKSA-N 0 3 413.389 4.274 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3cccc(OC4CCCC4)c3)CC2)C[C@H](C)O1 ZINC000427287745 856752269 /nfs/dbraw/zinc/75/22/69/856752269.db2.gz MGCOYWZXZZVTEW-BGYRXZFFSA-N 0 3 414.590 4.360 20 0 HIADHN Cc1ccc(-c2nc(C(=O)N3CCC(CCN4C[C@H](C)O[C@@H](C)C4)CC3)cs2)o1 ZINC000427287402 856752516 /nfs/dbraw/zinc/75/25/16/856752516.db2.gz KJMOSYJSOXDSFT-IRXDYDNUSA-N 0 3 417.575 4.063 20 0 HIADHN Cc1ccc2nc(C)c(C(=O)N3CCC(CCN4C[C@@H](C)O[C@H](C)C4)CC3)cc2c1 ZINC000427291617 856755194 /nfs/dbraw/zinc/75/51/94/856755194.db2.gz IFAAUDKXHWNMDM-RTBURBONSA-N 0 3 409.574 4.203 20 0 HIADHN CC(C)c1cc(C(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)nn1C(C)(C)C ZINC000427291887 856755616 /nfs/dbraw/zinc/75/56/16/856755616.db2.gz KYKZZMLUNPBLTM-OALUTQOASA-N 0 3 418.626 4.113 20 0 HIADHN Cc1ccc2nc(C)c(C(=O)N3CCC(CCN4C[C@H](C)O[C@@H](C)C4)CC3)cc2c1 ZINC000427291616 856755633 /nfs/dbraw/zinc/75/56/33/856755633.db2.gz IFAAUDKXHWNMDM-OALUTQOASA-N 0 3 409.574 4.203 20 0 HIADHN CCc1cccc2c(CC(=O)N3CCC(CCN4C[C@@H](C)O[C@@H](C)C4)CC3)c[nH]c21 ZINC000427294724 856757074 /nfs/dbraw/zinc/75/70/74/856757074.db2.gz GQAKWZLGPVAXEP-KDURUIRLSA-N 0 3 411.590 4.011 20 0 HIADHN C[C@H]1CCN(C(=O)Cc2csc(Cc3ccccc3)n2)CCN1Cc1ccccc1 ZINC000437471179 862832995 /nfs/dbraw/zinc/83/29/95/862832995.db2.gz JAXWFTHQTJFMML-FQEVSTJZSA-N 0 3 419.594 4.399 20 0 HIADHN Cc1nc2cc(F)ccc2cc1C(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000427298281 856758602 /nfs/dbraw/zinc/75/86/02/856758602.db2.gz AZJQYZWNBFRGFC-CALCHBBNSA-N 0 3 413.537 4.034 20 0 HIADHN Cc1cc(Br)ccc1C(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000427297757 856758921 /nfs/dbraw/zinc/75/89/21/856758921.db2.gz WPNSMJQWZGFFEV-IAGOWNOFSA-N 0 3 423.395 4.109 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3cc(Cl)sc3Cl)CC2)C[C@H](C)O1 ZINC000427298171 856758979 /nfs/dbraw/zinc/75/89/79/856758979.db2.gz ACAHIBHFKSYCNZ-BETUJISGSA-N 0 3 405.391 4.406 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3ccc(Cl)c4cccnc34)CC2)C[C@@H](C)O1 ZINC000427299575 856759347 /nfs/dbraw/zinc/75/93/47/856759347.db2.gz OHYHJXURYXKTHG-IAGOWNOFSA-N 0 3 415.965 4.240 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)c3[nH]c4ccccc4c3Cl)CC2)C[C@H](C)O1 ZINC000427299466 856759626 /nfs/dbraw/zinc/75/96/26/856759626.db2.gz NDXRFZXXFHCLPN-HOTGVXAUSA-N 0 3 403.954 4.173 20 0 HIADHN Cc1cc(OC(F)F)c(C(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)s1 ZINC000427313875 856765588 /nfs/dbraw/zinc/76/55/88/856765588.db2.gz OIDQNWGDZBVTBW-OKILXGFUSA-N 0 3 416.534 4.009 20 0 HIADHN C[C@@H]1C[C@H]1c1ccc([C@H]2C[C@H]2C(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)o1 ZINC000427319995 856768731 /nfs/dbraw/zinc/76/87/31/856768731.db2.gz JCZRMBNVMRZCAV-AMOFBSHKSA-N 0 3 414.590 4.244 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3cc(F)c(Cl)cc3Cl)CC2)C[C@@H](C)O1 ZINC000427333076 856776976 /nfs/dbraw/zinc/77/69/76/856776976.db2.gz XAWAEJMDNTZARS-ZIAGYGMSSA-N 0 3 417.352 4.484 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3c[nH]cc3-c3ccc(F)cc3)CC2)C[C@@H](C)O1 ZINC000427342132 856781301 /nfs/dbraw/zinc/78/13/01/856781301.db2.gz LKQPBAZDAISFHG-QZTJIDSGSA-N 0 3 413.537 4.172 20 0 HIADHN Cc1ccc(-c2ocnc2C(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)cc1 ZINC000427343358 856783023 /nfs/dbraw/zinc/78/30/23/856783023.db2.gz WINDGOCRIBSZLL-KDURUIRLSA-N 0 3 411.546 4.002 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)CCCc3c[nH]c4ccccc34)CC2)C[C@H](C)O1 ZINC000427352267 856788521 /nfs/dbraw/zinc/78/85/21/856788521.db2.gz MUXJCTJKWTUYCL-BGYRXZFFSA-N 0 3 411.590 4.229 20 0 HIADHN CCn1ncc(C(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)c1-c1ccccc1 ZINC000427356632 856790704 /nfs/dbraw/zinc/79/07/04/856790704.db2.gz HCDDBKFLJVQWDA-HXUWFJFHSA-N 0 3 402.542 4.307 20 0 HIADHN CCN1CCC[C@@H](CN(C)C(=O)C[C@@H](C)c2c[nH]c3ccccc32)[C@@H]1c1cnn(C)c1 ZINC000427490120 856839509 /nfs/dbraw/zinc/83/95/09/856839509.db2.gz HFIHAUDMNZBUHP-HHJKRLRDSA-N 0 3 421.589 4.327 20 0 HIADHN Cc1ccc([C@@H]2C[C@@H](C)CCN2C(=O)CCCN2CCN(c3ccccc3)CC2)o1 ZINC000437484042 862842340 /nfs/dbraw/zinc/84/23/40/862842340.db2.gz NPIIPFVZARMFSK-REWPJTCUSA-N 0 3 409.574 4.490 20 0 HIADHN C[C@@H](NC1CCN([C@H](C)c2ccncc2)CC1)c1ncc(Br)cc1F ZINC000427525422 856849580 /nfs/dbraw/zinc/84/95/80/856849580.db2.gz QZMWPARWPGSDGT-ZIAGYGMSSA-N 0 3 407.331 4.254 20 0 HIADHN FC(F)(F)c1cnc2c(c1)[C@H](NCc1ccccc1CN1CCOCC1)CCC2 ZINC000427565002 856867693 /nfs/dbraw/zinc/86/76/93/856867693.db2.gz LVWCCJFGQQNYSH-HXUWFJFHSA-N 0 3 405.464 4.100 20 0 HIADHN Cc1ccc(-c2cc(C(=O)NC3CCN([C@H](C)c4ccncc4)CC3)[nH]n2)c(C)c1 ZINC000427619905 856890325 /nfs/dbraw/zinc/89/03/25/856890325.db2.gz CHPNCRYLFFDKFC-GOSISDBHSA-N 0 3 403.530 4.044 20 0 HIADHN CCn1ncc(C(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)c1-c1ccccc1 ZINC000427640217 856895071 /nfs/dbraw/zinc/89/50/71/856895071.db2.gz VXFLBEHWUSWJCN-HXUWFJFHSA-N 0 3 402.542 4.307 20 0 HIADHN Cc1ccc(Br)cc1-c1nnc(N2CCC[C@@H]3CN(C)CC[C@H]32)s1 ZINC000428170499 857095513 /nfs/dbraw/zinc/09/55/13/857095513.db2.gz IWHNGELGCUSTPP-CZUORRHYSA-N 0 3 407.381 4.197 20 0 HIADHN CO[C@H](C)c1nc(CN2CCCN(CCOc3cc(C)ccc3C)CC2)cs1 ZINC000437540836 862874918 /nfs/dbraw/zinc/87/49/18/862874918.db2.gz WAFRXAIRYBZHDQ-LJQANCHMSA-N 0 3 403.592 4.054 20 0 HIADHN C[C@H]1CCN(Cc2cnn(Cc3ccc(C(F)(F)F)cc3)c2)C[C@@H]1n1ccnc1 ZINC000428265514 857133151 /nfs/dbraw/zinc/13/31/51/857133151.db2.gz OXIJXBGDDQBFRQ-JXFKEZNVSA-N 0 3 403.452 4.230 20 0 HIADHN O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)c1ccc(Oc2ccccc2)o1 ZINC000428272424 857136199 /nfs/dbraw/zinc/13/61/99/857136199.db2.gz UTNXDSZACIJTNJ-OAQYLSRUSA-N 0 3 406.482 4.093 20 0 HIADHN COc1ccc(CCC(=O)N2CCCN(C[C@@H](OC(C)C)c3ccccc3)CC2)cc1 ZINC000428405270 857193314 /nfs/dbraw/zinc/19/33/14/857193314.db2.gz XEIKFBMSLAFGTA-RUZDIDTESA-N 0 3 424.585 4.328 20 0 HIADHN CCOc1cc(CN2CC[C@@H](O)[C@@H](C)C2)ccc1OCCOc1cccc(Cl)c1 ZINC000428480105 857219772 /nfs/dbraw/zinc/21/97/72/857219772.db2.gz BJMDCFZSUGIXFD-LAUBAEHRSA-N 0 3 419.949 4.399 20 0 HIADHN CC1CCN([C@H](CNC(=O)N2CCC(c3ccncc3)CC2)c2ccccc2)CC1 ZINC000428485757 857222651 /nfs/dbraw/zinc/22/26/51/857222651.db2.gz UWRZGHZMXLXNOF-XMMPIXPASA-N 0 3 406.574 4.444 20 0 HIADHN OC[C@@H](CNCc1nc2ccc(F)cc2s1)Cc1ccc(Br)cc1 ZINC000428529690 857243154 /nfs/dbraw/zinc/24/31/54/857243154.db2.gz BKYHMHSMZXUDSO-CYBMUJFWSA-N 0 3 409.324 4.139 20 0 HIADHN COCCS(=O)(=O)c1ccc(CNCc2ccc(-c3ccccc3)s2)cc1 ZINC000428540327 857250433 /nfs/dbraw/zinc/25/04/33/857250433.db2.gz CPMBVRSEYQYVSA-UHFFFAOYSA-N 0 3 401.553 4.125 20 0 HIADHN CC(C)COc1ccc(C2(C(=O)Nc3cccc(CN4CC[C@H](O)C4)c3)CCC2)cc1 ZINC000428539636 857251617 /nfs/dbraw/zinc/25/16/17/857251617.db2.gz QKMOCHJWQFRLTB-QHCPKHFHSA-N 0 3 422.569 4.348 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@@H](O)C2)c1)c1cc2ccccc2cc1OC(F)F ZINC000428541504 857252830 /nfs/dbraw/zinc/25/28/30/857252830.db2.gz PKHHOZNZQOOLHX-LJQANCHMSA-N 0 3 412.436 4.260 20 0 HIADHN COc1ccc2nc(CNC[C@H](CO)Cc3ccc(Br)cc3)sc2c1 ZINC000428541534 857252861 /nfs/dbraw/zinc/25/28/61/857252861.db2.gz FBDDLTMGHOFMRL-CQSZACIVSA-N 0 3 421.360 4.008 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)c1[nH]c2ccc(Cl)cc2c1Cl ZINC000428548645 857258379 /nfs/dbraw/zinc/25/83/79/857258379.db2.gz QZJZUQKPIPGJMY-HNNXBMFYSA-N 0 3 404.297 4.294 20 0 HIADHN CC(C)(C)n1ncc(C(=O)Nc2cccc(CN3CC[C@@H](O)C3)c2)c1-c1ccccc1 ZINC000428546977 857258515 /nfs/dbraw/zinc/25/85/15/857258515.db2.gz NXHCLCNQKBAVFY-OAQYLSRUSA-N 0 3 418.541 4.124 20 0 HIADHN Cc1ccc(-n2ncc(C(=O)Nc3cccc(CN4CC[C@@H](O)C4)c3)c2C(C)C)cc1 ZINC000428553539 857261882 /nfs/dbraw/zinc/26/18/82/857261882.db2.gz PLXFSAVVDBXHRE-JOCHJYFZSA-N 0 3 418.541 4.123 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)c1cc2ccc(C(F)(F)F)cc2[nH]1 ZINC000428554248 857264458 /nfs/dbraw/zinc/26/44/58/857264458.db2.gz YUZYBYBFWKTFOH-KRWDZBQOSA-N 0 3 403.404 4.006 20 0 HIADHN Cc1ccccc1[C@@H](NC(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1)C1CC1 ZINC000428586493 857272802 /nfs/dbraw/zinc/27/28/02/857272802.db2.gz OHFXIVPWTXTQEU-UPVQGACJSA-N 0 3 407.558 4.036 20 0 HIADHN Cc1ccccc1[C@H](NC(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1)C1CC1 ZINC000428586491 857272958 /nfs/dbraw/zinc/27/29/58/857272958.db2.gz OHFXIVPWTXTQEU-ISKFKSNPSA-N 0 3 407.558 4.036 20 0 HIADHN O=C(Nc1cccc(CN[C@H](CO)CC(F)F)c1)c1ccc(Cl)cc1Cl ZINC000428641069 857286518 /nfs/dbraw/zinc/28/65/18/857286518.db2.gz LLJIXHCZOFXTES-AWEZNQCLSA-N 0 3 403.256 4.351 20 0 HIADHN CCN1CCCN(C(=O)N[C@H]2CCCc3nc(-c4ccc(F)cc4)sc32)CC1 ZINC000428692556 857298429 /nfs/dbraw/zinc/29/84/29/857298429.db2.gz QACWVMIHCORNEQ-SFHVURJKSA-N 0 3 402.539 4.064 20 0 HIADHN CCN1CCCN(C(=O)N[C@@H]2CCCc3nc(-c4ccc(F)cc4)sc32)CC1 ZINC000428692549 857298895 /nfs/dbraw/zinc/29/88/95/857298895.db2.gz QACWVMIHCORNEQ-GOSISDBHSA-N 0 3 402.539 4.064 20 0 HIADHN NC(=O)c1ccc(NC(=O)CCN2CCC(c3ccc(Cl)cc3Cl)CC2)cc1 ZINC000428749556 857317424 /nfs/dbraw/zinc/31/74/24/857317424.db2.gz NYESTARPFIJPBH-UHFFFAOYSA-N 0 3 420.340 4.301 20 0 HIADHN c1c(CN(Cc2ccncc2)[C@H]2CCCN(Cc3ccccc3)C2)nc2ccccn12 ZINC000428787580 857338965 /nfs/dbraw/zinc/33/89/65/857338965.db2.gz VBFNHEUYZYQBQY-VWLOTQADSA-N 0 3 411.553 4.396 20 0 HIADHN CC(C)(C)c1nc(CN(Cc2ccncc2)[C@H]2CCCN(Cc3ccccc3)C2)no1 ZINC000428792365 857341509 /nfs/dbraw/zinc/34/15/09/857341509.db2.gz GXQBZSMMLALQAT-QFIPXVFZSA-N 0 3 419.573 4.429 20 0 HIADHN CC(C)Cc1noc(CN(Cc2ccncc2)[C@H]2CCCN(Cc3ccccc3)C2)n1 ZINC000428803969 857350743 /nfs/dbraw/zinc/35/07/43/857350743.db2.gz SDQUMYQLIFUGCD-QHCPKHFHSA-N 0 3 419.573 4.330 20 0 HIADHN COc1cccc(CN(Cc2ccncc2)[C@H]2CCCN(Cc3ccccc3)C2)n1 ZINC000428812654 857356173 /nfs/dbraw/zinc/35/61/73/857356173.db2.gz BGBRCUUXDHIFDH-DEOSSOPVSA-N 0 3 402.542 4.152 20 0 HIADHN CC(C)(C(=O)Nc1cccc(CN2CC[C@H](O)C2)c1)c1cccc(C(F)(F)F)c1 ZINC000428828696 857363191 /nfs/dbraw/zinc/36/31/91/857363191.db2.gz XHOTXEJUJSJSJC-IBGZPJMESA-N 0 3 406.448 4.188 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)NCC(C)(C)c3ccccc3F)CC2)C[C@@H](C)O1 ZINC000428834808 857365350 /nfs/dbraw/zinc/36/53/50/857365350.db2.gz VWZBTQJRICWWAN-RTBURBONSA-N 0 3 419.585 4.024 20 0 HIADHN CC(C)N(CC(=O)NC1CCN(C(=O)C2CCCCC2)CC1)[C@@H](C)c1ccccc1 ZINC000428863849 857376770 /nfs/dbraw/zinc/37/67/70/857376770.db2.gz ZJLNNIMCPQROEP-FQEVSTJZSA-N 0 3 413.606 4.146 20 0 HIADHN CC(C)N(C)c1cccc(NC(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)c1 ZINC000428887825 857392429 /nfs/dbraw/zinc/39/24/29/857392429.db2.gz PPKSYZBMEPMLPT-BGYRXZFFSA-N 0 3 416.610 4.274 20 0 HIADHN CCCN(C(=O)c1cn(C)c(=O)c2ccccc12)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000428917828 857413152 /nfs/dbraw/zinc/41/31/52/857413152.db2.gz RZOJOYRUIGWNAI-OAQYLSRUSA-N 0 3 417.553 4.055 20 0 HIADHN Cc1c(C(=O)N(C)C[C@]2(O)CCN(Cc3ccccc3)C2)sc2cccc(F)c12 ZINC000428970040 857440439 /nfs/dbraw/zinc/44/04/39/857440439.db2.gz SKCWMOIDBMSUHL-HSZRJFAPSA-N 0 3 412.530 4.058 20 0 HIADHN C[C@@H](CNC(=O)N(Cc1ccccc1)C1CCN(C)CC1)Oc1ccc(Cl)cc1 ZINC000429026796 857464231 /nfs/dbraw/zinc/46/42/31/857464231.db2.gz DCUWXIHTJLMNFU-SFHVURJKSA-N 0 3 415.965 4.413 20 0 HIADHN CSc1ccc(OCCN[C@H](CO)c2ccc(Br)c(F)c2)cc1 ZINC000429038004 857468798 /nfs/dbraw/zinc/46/87/98/857468798.db2.gz VQSXLLWCFINMEP-QGZVFWFLSA-N 0 3 400.313 4.012 20 0 HIADHN CCN(C(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1)[C@H](C)c1ccc(F)cc1 ZINC000429039842 857470513 /nfs/dbraw/zinc/47/05/13/857470513.db2.gz GCKPOEBJMRBULO-AUSIDOKSSA-N 0 3 413.537 4.209 20 0 HIADHN CC(C)Oc1ccc(NC(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)c(F)c1 ZINC000429062421 857487131 /nfs/dbraw/zinc/48/71/31/857487131.db2.gz GVOKXPXPKIMBQX-HDICACEKSA-N 0 3 421.557 4.356 20 0 HIADHN CC(C)Oc1ccc(NC(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)c(F)c1 ZINC000429062423 857487208 /nfs/dbraw/zinc/48/72/08/857487208.db2.gz GVOKXPXPKIMBQX-QZTJIDSGSA-N 0 3 421.557 4.356 20 0 HIADHN Cc1ccc(C(=O)Nc2cccc(CNC(=O)NC[C@@H]3CCCCN3C3CC3)c2)cc1 ZINC000429091159 857505486 /nfs/dbraw/zinc/50/54/86/857505486.db2.gz DXXQSXZXJXCTNC-QHCPKHFHSA-N 0 3 420.557 4.063 20 0 HIADHN CC(=O)N1CCC(N(CCSc2ccc(C)c(C)c2)Cc2cncs2)CC1 ZINC000429161272 857536274 /nfs/dbraw/zinc/53/62/74/857536274.db2.gz VHIUFBXJFKSACI-UHFFFAOYSA-N 0 3 403.617 4.365 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)NC3CCC(C(F)(F)F)CC3)CC2)C[C@H](C)O1 ZINC000429192474 857547610 /nfs/dbraw/zinc/54/76/10/857547610.db2.gz HNOZTEAFRMFLSZ-XYCLOBBJSA-N 0 3 419.532 4.028 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)NC3CCC(C(F)(F)F)CC3)CC2)C[C@@H](C)O1 ZINC000429192472 857548013 /nfs/dbraw/zinc/54/80/13/857548013.db2.gz HNOZTEAFRMFLSZ-FDCMFXBMSA-N 0 3 419.532 4.028 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3ccccc3Br)CC2)C[C@@H](C)O1 ZINC000429209266 857556536 /nfs/dbraw/zinc/55/65/36/857556536.db2.gz CQTFOUKQWLDNBA-HZPDHXFCSA-N 0 3 424.383 4.192 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3ccc(OC(F)F)cc3)CC2)C[C@@H](C)O1 ZINC000429220907 857560506 /nfs/dbraw/zinc/56/05/06/857560506.db2.gz LFAOGYYDHHZRDW-HZPDHXFCSA-N 0 3 411.493 4.031 20 0 HIADHN Brc1ccc(-c2nccc(CN3CCOC[C@H](C4CCC4)C3)n2)cc1 ZINC000429255137 857577779 /nfs/dbraw/zinc/57/77/79/857577779.db2.gz MDTQVRIHIYVRJS-QGZVFWFLSA-N 0 3 402.336 4.155 20 0 HIADHN COc1ccc2cc(CN(C)C(=O)[C@@H](C)N3CCC[C@@H](CSC)C3)ccc2c1 ZINC000429272883 857584932 /nfs/dbraw/zinc/58/49/32/857584932.db2.gz LMRBRUUTTOXARZ-IEBWSBKVSA-N 0 3 400.588 4.270 20 0 HIADHN CSC[C@H]1CCCN(CC(=O)N2CCc3sccc3[C@@H]2c2ccccc2)C1 ZINC000429279974 857588689 /nfs/dbraw/zinc/58/86/89/857588689.db2.gz WMMXBVNEVSQSEJ-JTSKRJEESA-N 0 3 400.613 4.297 20 0 HIADHN CC(C)n1nccc1NC(=O)[C@H](C)N[C@@H]1c2cc(Br)ccc2CC1(C)C ZINC000429292099 857595012 /nfs/dbraw/zinc/59/50/12/857595012.db2.gz ICRYSAKQBQTXCV-SCLBCKFNSA-N 0 3 419.367 4.467 20 0 HIADHN O=C(Nc1ccc(OC(F)F)c(Cc2ccccc2)c1)N1CC[C@H](N2CC=CC2)C1 ZINC000437614095 862929210 /nfs/dbraw/zinc/92/92/10/862929210.db2.gz YSQJMVHDJPSFQL-FQEVSTJZSA-N 0 3 413.468 4.357 20 0 HIADHN C[C@H](C(=O)Nc1ccccc1C(=O)c1ccccc1)N1CCN(C2CCC2)C[C@H](C)C1 ZINC000429387790 857636848 /nfs/dbraw/zinc/63/68/48/857636848.db2.gz SONRILCXEJSLTL-WOJBJXKFSA-N 0 3 419.569 4.051 20 0 HIADHN Fc1ccc([C@@H](NC[C@@H]2CN(Cc3ccccc3)CCCO2)c2ccccc2)nc1 ZINC000429413957 857653106 /nfs/dbraw/zinc/65/31/06/857653106.db2.gz AQPHMVFXDNSUOQ-NOZRDPDXSA-N 0 3 405.517 4.191 20 0 HIADHN COC1(C[C@H](C)N[C@H](c2cccc(S(C)(=O)=O)c2)c2ccc(F)c(F)c2)CCC1 ZINC000429417158 857655478 /nfs/dbraw/zinc/65/54/78/857655478.db2.gz KJQZPSCNCJMRSG-YCRPNKLZSA-N 0 3 423.525 4.395 20 0 HIADHN CC[C@@H](NC(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1)c1cc(F)ccc1F ZINC000429449113 857675899 /nfs/dbraw/zinc/67/58/99/857675899.db2.gz RMIUQFDUMFCWGT-HYFFOGBASA-N 0 3 423.548 4.337 20 0 HIADHN Cc1noc(C[C@@H](NCCOc2cccc(Br)c2)c2ccccc2)n1 ZINC000429544059 857735509 /nfs/dbraw/zinc/73/55/09/857735509.db2.gz ZZISOVMVHJHYER-GOSISDBHSA-N 0 3 402.292 4.093 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)Nc1ccnn1Cc1ccc(F)cc1 ZINC000429569308 857754897 /nfs/dbraw/zinc/75/48/97/857754897.db2.gz LSJCEXVQZOTWKA-NRFANRHFSA-N 0 3 407.493 4.029 20 0 HIADHN CCN(C(=O)Nc1ccnn1Cc1ccc(F)cc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000429571556 857756062 /nfs/dbraw/zinc/75/60/62/857756062.db2.gz RSMIUWWWCHRVCT-JOCHJYFZSA-N 0 3 421.520 4.199 20 0 HIADHN C[C@@H]1CCN(C(=O)Nc2ccnn2Cc2ccc(F)cc2)CCN1Cc1ccccc1 ZINC000429589404 857772940 /nfs/dbraw/zinc/77/29/40/857772940.db2.gz IUBSJEWXSSGMAC-LJQANCHMSA-N 0 3 421.520 4.199 20 0 HIADHN C[C@H]1CCN(C(=O)Nc2cc3c(cc2Cl)OCCO3)CCN1Cc1ccccc1 ZINC000437627010 862949074 /nfs/dbraw/zinc/94/90/74/862949074.db2.gz GYKBKBDCQYDUAN-INIZCTEOSA-N 0 3 415.921 4.240 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)NC[C@H](c2ccccc2)C(C)(C)CO)N2CCCC2)cc1 ZINC000437629504 862953017 /nfs/dbraw/zinc/95/30/17/862953017.db2.gz PJASZCZYQRJGPU-DNQXCXABSA-N 0 3 423.601 4.233 20 0 HIADHN CSc1c(F)cc(NC(=O)NC[C@H]2CN(Cc3ccccc3)CCCO2)cc1F ZINC000429627605 857806444 /nfs/dbraw/zinc/80/64/44/857806444.db2.gz JAWPAZFBHSLNJE-KRWDZBQOSA-N 0 3 421.513 4.099 20 0 HIADHN CCCc1c(NC(=O)N(CCN(C)C)C2CCCC2)cnn1-c1ccc(F)cc1 ZINC000429635426 857810679 /nfs/dbraw/zinc/81/06/79/857810679.db2.gz ZDSRQJVGUWCBCL-UHFFFAOYSA-N 0 3 401.530 4.302 20 0 HIADHN CCOc1cc2c(cc1NC(=O)NC[C@@H](c1ccsc1)N(CC)CC)OCCO2 ZINC000429634236 857810818 /nfs/dbraw/zinc/81/08/18/857810818.db2.gz IQIRKPRZEJKCNQ-KRWDZBQOSA-N 0 3 419.547 4.123 20 0 HIADHN COc1cccc(-c2nc(CN[C@@H]3[C@@H]4CCO[C@@H]4C34CCCC4)cs2)c1OC ZINC000429711573 857846252 /nfs/dbraw/zinc/84/62/52/857846252.db2.gz FSIONRNNINZEPC-DBVUQKKJSA-N 0 3 400.544 4.265 20 0 HIADHN C[C@H](c1cc(Cl)ccc1Cl)n1nccc1NC(=O)N1CC[C@H]2CCN(C)C[C@H]21 ZINC000429718216 857848568 /nfs/dbraw/zinc/84/85/68/857848568.db2.gz JFPAMNJUIFZMLD-HBUWYVDXSA-N 0 3 422.360 4.357 20 0 HIADHN CCO[C@@H]1C[C@H](NCC(=O)Nc2cc(OC)c(Cl)cc2OC)C12CCCCC2 ZINC000429784404 857884051 /nfs/dbraw/zinc/88/40/51/857884051.db2.gz JCWBLCXHQBCWAB-RBUKOAKNSA-N 0 3 410.942 4.013 20 0 HIADHN Cc1c(C(=O)N(CCN2CCCC2)Cc2ccc(Cl)c(Cl)c2)nnn1C(C)C ZINC000429801525 857889598 /nfs/dbraw/zinc/88/95/98/857889598.db2.gz MFMSGLIELDVDHV-UHFFFAOYSA-N 0 3 424.376 4.212 20 0 HIADHN C[C@@H](C(=O)N(CCCc1ccccc1)CCN(C)C)[C@@H]1OCCc2sccc21 ZINC000429887914 857929375 /nfs/dbraw/zinc/92/93/75/857929375.db2.gz MJSGCESTJYZADC-GCJKJVERSA-N 0 3 400.588 4.021 20 0 HIADHN Cc1nn(C(C)C)c(C)c1CC(=O)N(CCN(C)C)Cc1ccc(C(F)(F)F)cc1 ZINC000429900812 857935578 /nfs/dbraw/zinc/93/55/78/857935578.db2.gz LEALMXAMCIZXEM-UHFFFAOYSA-N 0 3 424.511 4.233 20 0 HIADHN COc1ccc([C@H](NC(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)C(F)(F)F)cc1 ZINC000429983457 857984029 /nfs/dbraw/zinc/98/40/29/857984029.db2.gz WEJMQRZQTKBWJV-ZMYBRWDISA-N 0 3 409.452 4.289 20 0 HIADHN CN(CCSc1nnc(-c2ccncc2)n1CC(F)(F)F)Cc1ccccc1 ZINC000430103246 858033079 /nfs/dbraw/zinc/03/30/79/858033079.db2.gz RVHJIXNTJMTPNO-UHFFFAOYSA-N 0 3 407.465 4.127 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)N[C@@H]2C[C@H]2c2cc(F)c(F)c(F)c2)C1 ZINC000437648950 862980705 /nfs/dbraw/zinc/98/07/05/862980705.db2.gz WFHVYAXSJHGCDN-DGELGTTISA-N 0 3 403.448 4.095 20 0 HIADHN CN1CCN(CCC(C)(C)NC(=O)N[C@@H]2CCc3ccc(-c4ccccc4)cc32)CC1 ZINC000430175893 858066320 /nfs/dbraw/zinc/06/63/20/858066320.db2.gz DQBIPNZXDNBHIZ-XMMPIXPASA-N 0 3 420.601 4.056 20 0 HIADHN CCCCn1ncc(C(=O)Nc2cc(C)cc(N3CCN(C(C)C)CC3)c2)c1CC ZINC000430185480 858072353 /nfs/dbraw/zinc/07/23/53/858072353.db2.gz HRUZVHRVNZRJBI-UHFFFAOYSA-N 0 3 411.594 4.337 20 0 HIADHN CCC[C@H](NC(=O)[C@@H](C)N1CC[C@@H](C(=O)N(C)c2ccccc2)C1)c1ccccc1 ZINC000430290346 858109989 /nfs/dbraw/zinc/10/99/89/858109989.db2.gz CCMQRJVIRZWZKX-LSWJPFSZSA-N 0 3 407.558 4.017 20 0 HIADHN CCOC(=O)c1oc2ccccc2c1CN1CC[C@H](C(=O)N(C)c2ccccc2)C1 ZINC000430297695 858113679 /nfs/dbraw/zinc/11/36/79/858113679.db2.gz IPQUQGJPNLKXML-KRWDZBQOSA-N 0 3 406.482 4.094 20 0 HIADHN O=C(CCN(CCc1ccccn1)Cc1cccnc1)N[C@@H]1CCCc2ccccc21 ZINC000430310340 858118655 /nfs/dbraw/zinc/11/86/55/858118655.db2.gz AEGQXYHJCDOUCZ-RUZDIDTESA-N 0 3 414.553 4.105 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)CCN(CCc1ccccn1)Cc1cccnc1 ZINC000430342502 858128241 /nfs/dbraw/zinc/12/82/41/858128241.db2.gz HEYFNVXZMRTEBU-UHFFFAOYSA-N 0 3 424.932 4.212 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)NC[C@@]1(Cc2ccc(F)cc2)CCC[C@@H]1O ZINC000430481592 858190372 /nfs/dbraw/zinc/19/03/72/858190372.db2.gz GUNZKYUNFQNTIW-DHLKQENFSA-N 0 3 424.516 4.137 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)c3cccc(C(F)(F)F)c3F)CC2)C[C@H](C)O1 ZINC000430692198 858271123 /nfs/dbraw/zinc/27/11/23/858271123.db2.gz QSAAASWTOFNECF-GJZGRUSLSA-N 0 3 416.459 4.196 20 0 HIADHN CCC[C@@H](N[C@@H](C)c1ccc(Br)c(S(N)(=O)=O)c1)c1ccccc1 ZINC000430695574 858272339 /nfs/dbraw/zinc/27/23/39/858272339.db2.gz OCLYMYDZNNVBFC-SUMWQHHRSA-N 0 3 411.365 4.289 20 0 HIADHN Cc1cccc(C)c1[C@@H](C)N[C@H](C)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000430737362 858281686 /nfs/dbraw/zinc/28/16/86/858281686.db2.gz WRTLBJAJMHZXSE-ZIAGYGMSSA-N 0 3 411.365 4.125 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)CCC(=O)c2ccc3c(c2)CCC3)CCN1Cc1ccccc1 ZINC000430741510 858284003 /nfs/dbraw/zinc/28/40/03/858284003.db2.gz SYFOPTCMZISKGJ-NTKDMRAZSA-N 0 3 404.554 4.308 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)c1cccc(C(F)(F)F)c1F ZINC000430763390 858294414 /nfs/dbraw/zinc/29/44/14/858294414.db2.gz NZHQTAIPKFLDIA-INIZCTEOSA-N 0 3 409.427 4.366 20 0 HIADHN CCN(CC)[C@@H](CN1C(=O)N[C@@H](c2ccc(OC)c(Cl)c2)C1=O)c1ccsc1 ZINC000430870824 858348106 /nfs/dbraw/zinc/34/81/06/858348106.db2.gz VLZUVSNELKDXSF-WMZOPIPTSA-N 0 3 421.950 4.086 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cccc(F)c3Br)c(C)c2)CC1 ZINC000430904527 858362877 /nfs/dbraw/zinc/36/28/77/858362877.db2.gz SLZFOBMLFRNTAF-UHFFFAOYSA-N 0 3 420.326 4.291 20 0 HIADHN COc1ccc([C@@H](CNC(=O)N[C@@H](c2ccccc2)C(F)F)N2CCCC2)cc1 ZINC000430953111 858381288 /nfs/dbraw/zinc/38/12/88/858381288.db2.gz GBFGSRDSJZZXCX-UXHICEINSA-N 0 3 403.473 4.138 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)N[C@@H]3C[C@H]3c3cccc4ccccc43)CC2)C[C@H](C)O1 ZINC000431057829 858425090 /nfs/dbraw/zinc/42/50/90/858425090.db2.gz PLISXXOGTHBEMH-QXVOXHNYSA-N 0 3 421.585 4.227 20 0 HIADHN CN(C[C@H](O)COCC(F)(F)F)[C@@H](c1ccc(F)cc1)c1ccc(Cl)cc1 ZINC000431125958 858457922 /nfs/dbraw/zinc/45/79/22/858457922.db2.gz DRSNCQVBKBXFJB-ZWKOTPCHSA-N 0 3 405.819 4.440 20 0 HIADHN Cc1ccc([C@H](OC[C@H](O)CN2CC[C@@H](Oc3ccncc3)C2)c2ccccc2)cc1 ZINC000431129369 858459477 /nfs/dbraw/zinc/45/94/77/858459477.db2.gz PYFLXZOABLCDIG-LGPLSSKUSA-N 0 3 418.537 4.010 20 0 HIADHN COc1ccc([C@H](CNC(=O)NCCC2CC(OC(C)(C)C)C2)N2CCCC2)cc1 ZINC000431205345 858502841 /nfs/dbraw/zinc/50/28/41/858502841.db2.gz ACHCMKWBQVNADP-UDJZJCJKSA-N 0 3 417.594 4.115 20 0 HIADHN CCN(C[C@@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)Cc1cc(Cl)ccc1F ZINC000431312539 858558655 /nfs/dbraw/zinc/55/86/55/858558655.db2.gz JJIBQEGSFVHREH-GOSISDBHSA-N 0 3 424.969 4.153 20 0 HIADHN Cc1cc(Cl)cc2c1OCCC[C@H]2NCc1ccccc1CN1CCOCC1 ZINC000431352994 858575744 /nfs/dbraw/zinc/57/57/44/858575744.db2.gz UKYUXWJUTZTYHN-JOCHJYFZSA-N 0 3 400.950 4.484 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)Cc2cccc(OCC(F)(F)F)c2)C1 ZINC000431468009 858631538 /nfs/dbraw/zinc/63/15/38/858631538.db2.gz BGUKPVJKIWGFKZ-APWZRJJASA-N 0 3 406.448 4.122 20 0 HIADHN Cc1ccc(NC(=O)c2cccc(-c3noc(C(F)(F)F)n3)c2)c(CN(C)C)c1 ZINC000431775041 858806137 /nfs/dbraw/zinc/80/61/37/858806137.db2.gz VEKMOCKGQLPCIO-UHFFFAOYSA-N 0 3 404.392 4.378 20 0 HIADHN COc1cnccc1N1CCN(C(=O)Nc2ccc(SC3CCCC3)cc2)CC1 ZINC000431816721 858826367 /nfs/dbraw/zinc/82/63/67/858826367.db2.gz YUYQREZHHIIYCN-UHFFFAOYSA-N 0 3 412.559 4.479 20 0 HIADHN C[C@@H](NC(=O)[C@H]1CCCCN1C1CCCC1)c1noc(-c2ccc(Cl)cc2)n1 ZINC000431865369 858845817 /nfs/dbraw/zinc/84/58/17/858845817.db2.gz POQTZPRUHSOOSG-RDTXWAMCSA-N 0 3 402.926 4.364 20 0 HIADHN COc1cccc([C@@H](CNC(=O)Cc2cscc2Br)N2CCCC2)c1 ZINC000432057459 858956324 /nfs/dbraw/zinc/95/63/24/858956324.db2.gz MZQOWHAGBRYTAB-GOSISDBHSA-N 0 3 423.376 4.015 20 0 HIADHN CN1CC[C@H](NC(=O)NCC[C@@H](c2ccccc2)C(F)(F)F)[C@H]1c1ccccc1 ZINC000432079688 858974131 /nfs/dbraw/zinc/97/41/31/858974131.db2.gz NHSGKBPHIKANCE-SLFFLAALSA-N 0 3 405.464 4.467 20 0 HIADHN O=C(CCN1CCN(c2ccccc2)CC1)N1CCCC[C@H]1c1cc2ccccc2[nH]1 ZINC000467553146 881373931 /nfs/dbraw/zinc/37/39/31/881373931.db2.gz HMPISRIUAFBZKD-VWLOTQADSA-N 0 3 416.569 4.434 20 0 HIADHN CCOC(=O)Cn1nc(C)c(CN2CCC(F)(c3cccc(Cl)c3)CC2)c1C ZINC000467552946 881373974 /nfs/dbraw/zinc/37/39/74/881373974.db2.gz HGUAQFFAVRWMBT-UHFFFAOYSA-N 0 3 407.917 4.177 20 0 HIADHN O=S(=O)(c1ccccc1)N1CCC(CNCc2csc(Cl)c2Cl)CC1 ZINC000432251018 859068414 /nfs/dbraw/zinc/06/84/14/859068414.db2.gz PHNVKIMWSNHWLK-UHFFFAOYSA-N 0 3 419.399 4.245 20 0 HIADHN Cc1cc(NC(=O)NC[C@@H]2CCC(F)(F)C2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000432273785 859079753 /nfs/dbraw/zinc/07/97/53/859079753.db2.gz DFNWAZFXUYDRPD-RTBURBONSA-N 0 3 417.504 4.195 20 0 HIADHN CCOc1cc(CN2CCCO[C@@H](CC)C2)ccc1OCC(=O)N(C(C)C)C(C)C ZINC000467563607 881386494 /nfs/dbraw/zinc/38/64/94/881386494.db2.gz PTOZNYDQJVQOFP-NRFANRHFSA-N 0 3 420.594 4.110 20 0 HIADHN Cc1ccc(S(=O)(=O)C[C@H](C)NC2CC(c3cccc(Br)c3)C2)cc1 ZINC000432410745 859150763 /nfs/dbraw/zinc/15/07/63/859150763.db2.gz RFSMMIWNGIRFLA-DMKPSLHHSA-N 0 3 422.388 4.456 20 0 HIADHN COCC1(C)CN(C[C@@H](O)COC(c2ccc(Cl)cc2)c2ccc(Cl)cc2)C1 ZINC000432752528 859334581 /nfs/dbraw/zinc/33/45/81/859334581.db2.gz MNIKZNNECXJNJF-HXUWFJFHSA-N 0 3 424.368 4.429 20 0 HIADHN Cc1ccc(CN(Cc2ccco2)S(=O)(=O)c2ccc(CN(C)C)cc2)s1 ZINC000432854713 859390190 /nfs/dbraw/zinc/39/01/90/859390190.db2.gz SQRIVMASKASZAE-UHFFFAOYSA-N 0 3 404.557 4.102 20 0 HIADHN Cc1ccc(-c2ccc(C)c(NC(=O)N3CC[C@@H](N4CCN(C)CC4)[C@@H](C)C3)c2)o1 ZINC000432992953 859468068 /nfs/dbraw/zinc/46/80/68/859468068.db2.gz KXDGCBFOAWQTDR-PGRDOPGGSA-N 0 3 410.562 4.053 20 0 HIADHN COc1ccccc1-c1noc(C2CCN(Cc3cc(OC)c(OC)cc3C)CC2)n1 ZINC000433018570 859480799 /nfs/dbraw/zinc/48/07/99/859480799.db2.gz FBEDYHQBYNJWLB-UHFFFAOYSA-N 0 3 423.513 4.450 20 0 HIADHN C[C@H](SCCN(C)Cc1ccccc1)C(=O)Nc1ccc2c(c1)OCCCO2 ZINC000433032047 859491201 /nfs/dbraw/zinc/49/12/01/859491201.db2.gz KQSUBBRQRPJTBE-KRWDZBQOSA-N 0 3 400.544 4.040 20 0 HIADHN CN(CCSCC(=O)N[C@@H](c1nccs1)c1ccccc1)Cc1ccccc1 ZINC000433054530 859502969 /nfs/dbraw/zinc/50/29/69/859502969.db2.gz UXZJNJNLZIAWEX-OAQYLSRUSA-N 0 3 411.596 4.214 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)Nc2cccc([S@@](C)=O)c2)N(CC)CC)cc1 ZINC000433137473 859535578 /nfs/dbraw/zinc/53/55/78/859535578.db2.gz TZVNFYADJCKIAY-LYZGTLIUSA-N 0 3 401.576 4.191 20 0 HIADHN COCCN(Cc1ccnc(-c2ccc(Br)cc2)n1)[C@H]1CCCSC1 ZINC000433177698 859556623 /nfs/dbraw/zinc/55/66/23/859556623.db2.gz DQQLHJOYLBXMAV-SFHVURJKSA-N 0 3 422.392 4.250 20 0 HIADHN CCCN1CCN(c2ccccc2CNc2cccc(NC(=O)NCC)c2C)CC1 ZINC000433188348 859560905 /nfs/dbraw/zinc/56/09/05/859560905.db2.gz CLZPEJOVSPPSEB-UHFFFAOYSA-N 0 3 409.578 4.281 20 0 HIADHN CCn1cccc(CNCc2ccc(OC(F)(F)[C@@H](F)C(F)(F)F)cc2)c1=O ZINC000433192837 859561718 /nfs/dbraw/zinc/56/17/18/859561718.db2.gz NDTSPJBRXBUKFB-INIZCTEOSA-N 0 3 408.342 4.030 20 0 HIADHN C[C@H](C(=O)Nc1cccc(Oc2ncc(Br)cn2)c1)N1[C@H](C)CC[C@@H]1C ZINC000433271450 859606919 /nfs/dbraw/zinc/60/69/19/859606919.db2.gz TZPXGVKTHDQLPQ-HZSPNIEDSA-N 0 3 419.323 4.231 20 0 HIADHN C[C@H]1C[C@]2(CCN1Cc1ccccc1)Nc1ccc(Br)cc1C(=O)N2C ZINC000433373690 859663028 /nfs/dbraw/zinc/66/30/28/859663028.db2.gz KKJOMGYNFHGMSP-YCRPNKLZSA-N 0 3 414.347 4.327 20 0 HIADHN C[C@@H](NCc1cccc(-n2cncn2)c1)c1ccc(OC[C@@H]2CCCCO2)c(F)c1 ZINC000433385920 859668434 /nfs/dbraw/zinc/66/84/34/859668434.db2.gz GWGPAWMQRZPQIM-UTKZUKDTSA-N 0 3 410.493 4.205 20 0 HIADHN COc1ccc([C@@H](CNC(=O)Nc2ccc(Cl)c(OC)c2)N2CCCC2)cc1 ZINC000433641565 859821315 /nfs/dbraw/zinc/82/13/15/859821315.db2.gz ZOQQLBKMJDEWAD-LJQANCHMSA-N 0 3 403.910 4.316 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)Nc2ccc(Oc3ncc(Cl)cn3)c(Cl)c2)CCCN1C ZINC000433670223 859832598 /nfs/dbraw/zinc/83/25/98/859832598.db2.gz QBSARNPWSOLLQW-ABAIWWIYSA-N 0 3 410.305 4.180 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)Cc2cc(Br)ccc2F)C1 ZINC000433718487 859851549 /nfs/dbraw/zinc/85/15/49/859851549.db2.gz NCVLAKHLMZXZKL-KBXCAEBGSA-N 0 3 405.311 4.082 20 0 HIADHN CCNC(=O)Nc1cccc(NC(=O)NC[C@@H](c2cccs2)N2CCCC2)c1C ZINC000433728881 859859272 /nfs/dbraw/zinc/85/92/72/859859272.db2.gz NZPNQKGWBPZAEV-SFHVURJKSA-N 0 3 415.563 4.157 20 0 HIADHN COc1cc(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2F)ccc1OC(C)C ZINC000467677595 881470444 /nfs/dbraw/zinc/47/04/44/881470444.db2.gz IQMINXDOEBRXJD-UHFFFAOYSA-N 0 3 421.488 4.356 20 0 HIADHN O=C(N1CC[C@H](CC(F)(F)F)C1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000433738303 859866229 /nfs/dbraw/zinc/86/62/29/859866229.db2.gz CWPCHXNWNVMVEX-WBVHZDCISA-N 0 3 408.386 4.242 20 0 HIADHN CCNC(=O)Nc1cccc(NC(=O)N(CC)[C@@H]2CCN(Cc3ccccc3)C2)c1C ZINC000433758548 859879624 /nfs/dbraw/zinc/87/96/24/859879624.db2.gz RZVWCEZTMYHGKZ-HXUWFJFHSA-N 0 3 423.561 4.265 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)Nc2ccc(F)cc2-c2cnn(C)c2)c1 ZINC000433781016 859889858 /nfs/dbraw/zinc/88/98/58/859889858.db2.gz DTBXWYZFEUJWNR-UHFFFAOYSA-N 0 3 409.509 4.130 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1ccc(F)cc1-c1cnn(C)c1)c1ccsc1 ZINC000433791804 859894913 /nfs/dbraw/zinc/89/49/13/859894913.db2.gz KBMDZRDZIHACGJ-FQEVSTJZSA-N 0 3 415.538 4.492 20 0 HIADHN Cc1cc(NC(=O)c2noc3c2C[C@@H](C)CC3)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000433862284 859940105 /nfs/dbraw/zinc/94/01/05/859940105.db2.gz KENCYXFUQCVHIP-LPHOPBHVSA-N 0 3 419.529 4.004 20 0 HIADHN CCN([C@H](c1ccc(C)cc1)c1cccnc1)S(=O)(=O)c1ccc(CN(C)C)cc1 ZINC000433880656 859949591 /nfs/dbraw/zinc/94/95/91/859949591.db2.gz BHFOKWNCKMVUIS-XMMPIXPASA-N 0 3 423.582 4.252 20 0 HIADHN Cc1c(NC(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)noc1-c1ccccc1F ZINC000433921968 859973338 /nfs/dbraw/zinc/97/33/38/859973338.db2.gz KNKMHTXVAWOXBR-WMZOPIPTSA-N 0 3 408.477 4.746 20 0 HIADHN COc1ccc2[nH]cc(C3CCN(C(=O)NC[C@H]4CCCCN4C4CC4)CC3)c2c1 ZINC000433954724 860000503 /nfs/dbraw/zinc/00/05/03/860000503.db2.gz VSXHYJMWKDXDRD-LJQANCHMSA-N 0 3 410.562 4.082 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)Cc2csc(Cc3ccc(F)cc3)n2)CN1Cc1ccccc1 ZINC000467696718 881490583 /nfs/dbraw/zinc/49/05/83/881490583.db2.gz JLIOHPDRNQEMPI-LAUBAEHRSA-N 0 3 423.557 4.195 20 0 HIADHN C[C@H]1C[C@H](NC(=O)c2ccc(OCc3ccncc3)cc2)CN1Cc1ccccc1 ZINC000467701061 881497251 /nfs/dbraw/zinc/49/72/51/881497251.db2.gz QKRDRRRIESAKEL-CVDCTZTESA-N 0 3 401.510 4.053 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)N(CCCO)Cc1cccc(Cl)c1 ZINC000434076182 860085120 /nfs/dbraw/zinc/08/51/20/860085120.db2.gz GALSXZDHICCABI-IBGZPJMESA-N 0 3 421.994 4.133 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2ccc(-c3nc(C4CC4)no3)cc2)N2CCCC2)cc1 ZINC000434081622 860090095 /nfs/dbraw/zinc/09/00/95/860090095.db2.gz FJSIYJBWZRIRRH-QFIPXVFZSA-N 0 3 416.525 4.489 20 0 HIADHN C[C@H]1CN(C2CC2)C[C@@H]1NC(=O)CSc1ncnc2scc(-c3ccccc3)c21 ZINC000467714000 881511493 /nfs/dbraw/zinc/51/14/93/881511493.db2.gz KUJKNQJXZHCFJX-KSSFIOAISA-N 0 3 424.595 4.049 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)c2ccc(-c3nc(C4CC4)no3)cc2)N(C)C)cc1 ZINC000434221347 860205996 /nfs/dbraw/zinc/20/59/96/860205996.db2.gz WHPOGMKCXKBUDG-OAQYLSRUSA-N 0 3 404.514 4.209 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)Nc2cc(Cl)ccc2-c2ccc(C)o2)CC1 ZINC000434221994 860207236 /nfs/dbraw/zinc/20/72/36/860207236.db2.gz DEYJEOJNCAQVSE-MRXNPFEDSA-N 0 3 418.969 4.304 20 0 HIADHN Cc1ccc(-c2ccc(Cl)cc2NC(=O)NC(C)(C)CCN2CCN(C)CC2)o1 ZINC000434222791 860207267 /nfs/dbraw/zinc/20/72/67/860207267.db2.gz NCNIJRYMRMVBMO-UHFFFAOYSA-N 0 3 418.969 4.446 20 0 HIADHN COc1cc(C(=O)Nc2c(C)cnn2[C@H]2CCN(Cc3ccccc3)C2)ccc1C ZINC000434312154 860272944 /nfs/dbraw/zinc/27/29/44/860272944.db2.gz JYUGZFBIVHGNNC-NRFANRHFSA-N 0 3 404.514 4.208 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)COc1cc(C)ccc1C ZINC000434312594 860273087 /nfs/dbraw/zinc/27/30/87/860273087.db2.gz NTCWVXIOOIQTGW-QFIPXVFZSA-N 0 3 418.541 4.273 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)COc1ccc(C)c(C)c1 ZINC000434313831 860274586 /nfs/dbraw/zinc/27/45/86/860274586.db2.gz ZDUPJAKPMXMFNA-QFIPXVFZSA-N 0 3 418.541 4.273 20 0 HIADHN COCc1ccc(C(=O)Nc2c(C)cnn2[C@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000434314970 860275769 /nfs/dbraw/zinc/27/57/69/860275769.db2.gz IGHFHDYWTAKGQY-QFIPXVFZSA-N 0 3 404.514 4.037 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)Cc1ccc(F)cc1F ZINC000434321980 860282543 /nfs/dbraw/zinc/28/25/43/860282543.db2.gz AOZTXNOJZOBTLO-HXUWFJFHSA-N 0 3 410.468 4.098 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1ccc(F)c(F)c1F ZINC000434326055 860287673 /nfs/dbraw/zinc/28/76/73/860287673.db2.gz LHXKTIVMTOOCEJ-INIZCTEOSA-N 0 3 414.431 4.308 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)[C@@H](C)OCc1ccccc1 ZINC000434328710 860290840 /nfs/dbraw/zinc/29/08/40/860290840.db2.gz VXJKNAFQXZCEIY-NFBKMPQASA-N 0 3 418.541 4.182 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)CCc1cccc(F)c1F ZINC000434330963 860293072 /nfs/dbraw/zinc/29/30/72/860293072.db2.gz UJCYFUAYXOMGKT-HXUWFJFHSA-N 0 3 424.495 4.488 20 0 HIADHN CC(=O)c1cccc(C(=O)Nc2c(C)cnn2[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000434333560 860295192 /nfs/dbraw/zinc/29/51/92/860295192.db2.gz MSNUQNBMMUBWPK-QFIPXVFZSA-N 0 3 402.498 4.093 20 0 HIADHN C[C@@H]1CCN(C(=O)c2ccccc2NCc2cccnc2)CCN1Cc1ccccc1 ZINC000434395325 860331700 /nfs/dbraw/zinc/33/17/00/860331700.db2.gz HAKFORRCTQPEIN-OAQYLSRUSA-N 0 3 414.553 4.430 20 0 HIADHN Cc1cc(-c2cc(C(=O)NC[C@@H]3CCCCN3C3CC3)c3c(C)noc3n2)c(C)o1 ZINC000434445068 860355020 /nfs/dbraw/zinc/35/50/20/860355020.db2.gz MJMZAOGZOSTJGW-KRWDZBQOSA-N 0 3 408.502 4.155 20 0 HIADHN COc1ccc(CN2CC[C@H](CN(C)Cc3scnc3C)C2)cc1Br ZINC000434492508 860372251 /nfs/dbraw/zinc/37/22/51/860372251.db2.gz HQGJCGRDSCQXFR-MRXNPFEDSA-N 0 3 424.408 4.177 20 0 HIADHN CCOC(=O)CC1(NCC(=O)Nc2c(Cl)cc(Cl)cc2Cl)CCCC1 ZINC000434617843 860432329 /nfs/dbraw/zinc/43/23/29/860432329.db2.gz MVZSAOLZHCTBDQ-UHFFFAOYSA-N 0 3 407.725 4.441 20 0 HIADHN CN(CCCCCO)CC(=O)N(Cc1ccc(F)cc1)C12CC3CC(CC(C3)C1)C2 ZINC000434680742 860457381 /nfs/dbraw/zinc/45/73/81/860457381.db2.gz KPQLILULHAHFFQ-UHFFFAOYSA-N 0 3 416.581 4.218 20 0 HIADHN Cc1c2cc(Br)ccc2oc1C(=O)NCCCCN1C[C@H](C)O[C@@H](C)C1 ZINC000434753222 860482207 /nfs/dbraw/zinc/48/22/07/860482207.db2.gz BGQGLKFAVVXEQF-KBPBESRZSA-N 0 3 423.351 4.123 20 0 HIADHN CC[C@H](NC(=O)CN1CCC(c2ncc3n2CCCC3)CC1)c1ccc(Cl)cc1 ZINC000434755856 860483269 /nfs/dbraw/zinc/48/32/69/860483269.db2.gz XYXPOBYXAVEZPK-NRFANRHFSA-N 0 3 414.981 4.320 20 0 HIADHN Cc1noc(C2CCN(CCC(=O)Nc3ccc(Oc4ccccc4)cc3)CC2)n1 ZINC000434810900 860504204 /nfs/dbraw/zinc/50/42/04/860504204.db2.gz VFTVDCPAMMBJQZ-UHFFFAOYSA-N 0 3 406.486 4.379 20 0 HIADHN COc1cc(-c2nnc(CN3CC[C@H](c4ccccc4)[C@H]3C)o2)cc(OC)c1OC ZINC000434893720 860540536 /nfs/dbraw/zinc/54/05/36/860540536.db2.gz CSGBHOWCVDROEZ-QAPCUYQASA-N 0 3 409.486 4.140 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)CN2CC[C@@H](c3ccccc3)[C@@H]2C)cc1OC ZINC000434894732 860541229 /nfs/dbraw/zinc/54/12/29/860541229.db2.gz IJFCTVAMCJBJGO-BWAGFHJFSA-N 0 3 408.542 4.245 20 0 HIADHN CCOc1cc(CN2CCC[C@H](C(N)=O)C2)ccc1OCc1c(F)cccc1Cl ZINC000434983944 860585841 /nfs/dbraw/zinc/58/58/41/860585841.db2.gz XQESGWFYQYEDGU-INIZCTEOSA-N 0 3 420.912 4.154 20 0 HIADHN CN(C)C(=O)Nc1ccc(C(=O)N[C@H](CN2CCCC2)c2ccccc2)c(Cl)c1 ZINC000435042123 860612058 /nfs/dbraw/zinc/61/20/58/860612058.db2.gz LSUPMGVEOQOQOT-HXUWFJFHSA-N 0 3 414.937 4.000 20 0 HIADHN COc1c(Br)cccc1CN1CCC(c2ncc3n2CCCC3)CC1 ZINC000435059004 860620849 /nfs/dbraw/zinc/62/08/49/860620849.db2.gz GWUDHZRPDBJEBP-UHFFFAOYSA-N 0 3 404.352 4.370 20 0 HIADHN CN(Cc1cn(-c2ccccc2)nc1C(C)(C)C)C1CCN(c2cnccn2)CC1 ZINC000435062296 860622845 /nfs/dbraw/zinc/62/28/45/860622845.db2.gz YSTNDMBVSWRYCU-UHFFFAOYSA-N 0 3 404.562 4.061 20 0 HIADHN CC(C)c1cc(C(=O)NC2CCN(Cc3ccccc3)CC2)nn1-c1ccccc1 ZINC000435156369 860669211 /nfs/dbraw/zinc/66/92/11/860669211.db2.gz BLFCVDIOZWFFLO-UHFFFAOYSA-N 0 3 402.542 4.390 20 0 HIADHN CCc1cc(C)cc(CC)c1NC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1CO ZINC000435180128 860681998 /nfs/dbraw/zinc/68/19/98/860681998.db2.gz BWWLCDFUYOPMSY-DHIUTWEWSA-N 0 3 409.574 4.124 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)c2[nH]c3ccccc3c2Br)CN1Cc1ccccc1 ZINC000467757670 881572430 /nfs/dbraw/zinc/57/24/30/881572430.db2.gz ITCOFDWAJZYFGL-ZBFHGGJFSA-N 0 3 412.331 4.323 20 0 HIADHN Cc1nc2cc(Cl)c(NC(=O)N(CCN(C)C)Cc3ccccn3)cc2s1 ZINC000435193873 860690042 /nfs/dbraw/zinc/69/00/42/860690042.db2.gz XUCGWWGPMWQDPU-UHFFFAOYSA-N 0 3 403.939 4.249 20 0 HIADHN Cc1cc(NC(=O)c2cc(F)c(F)c(F)c2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435264525 860708647 /nfs/dbraw/zinc/70/86/47/860708647.db2.gz BWHSSDAOKHXGLV-KRWDZBQOSA-N 0 3 414.431 4.308 20 0 HIADHN Cc1cc(NC(=O)C2(c3ccc(F)cc3)CC2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435273347 860711422 /nfs/dbraw/zinc/71/14/22/860711422.db2.gz YRENLPICAFOVNC-JOCHJYFZSA-N 0 3 418.516 4.448 20 0 HIADHN CCCCn1ncc(C(=O)Nc2c(C)cnn2[C@H]2CCN(Cc3ccccc3)C2)c1C ZINC000435272631 860711584 /nfs/dbraw/zinc/71/15/84/860711584.db2.gz ZBKRCSPFVHITAV-NRFANRHFSA-N 0 3 420.561 4.196 20 0 HIADHN Cc1cc(NC(=O)c2cccc3ncccc32)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435274025 860712411 /nfs/dbraw/zinc/71/24/11/860712411.db2.gz FPPUYSIJIYTRCZ-HXUWFJFHSA-N 0 3 411.509 4.439 20 0 HIADHN COCCC1(C(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)CCCC1 ZINC000435276090 860713345 /nfs/dbraw/zinc/71/33/45/860713345.db2.gz CAOMDQUJUAPRSU-OAQYLSRUSA-N 0 3 410.562 4.174 20 0 HIADHN Cc1cc(NC(=O)[C@H](C)Oc2ccc(C)cc2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435278410 860715386 /nfs/dbraw/zinc/71/53/86/860715386.db2.gz FXGGLXSZMALAKQ-RBBKRZOGSA-N 0 3 418.541 4.353 20 0 HIADHN CC(=O)c1csc(C(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000435293398 860723405 /nfs/dbraw/zinc/72/34/05/860723405.db2.gz YIDJBDMIVKFAGB-LJQANCHMSA-N 0 3 408.527 4.155 20 0 HIADHN COc1ccc(C(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)cc1F ZINC000435294595 860724054 /nfs/dbraw/zinc/72/40/54/860724054.db2.gz KUUNTDUTDZGUII-IBGZPJMESA-N 0 3 408.477 4.039 20 0 HIADHN Cc1cc(NC(=O)c2cncc3ccccc32)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435295980 860724778 /nfs/dbraw/zinc/72/47/78/860724778.db2.gz QMUXPQWSJRHWED-OAQYLSRUSA-N 0 3 411.509 4.439 20 0 HIADHN CCSc1ccc(C(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)cn1 ZINC000435299310 860726990 /nfs/dbraw/zinc/72/69/90/860726990.db2.gz OOAUUOWHIKYWSV-HXUWFJFHSA-N 0 3 421.570 4.398 20 0 HIADHN Cc1cccc2[nH]cc(CC(=O)Nc3ccnn3[C@H]3CCN(Cc4ccccc4)C3)c21 ZINC000435366776 860765118 /nfs/dbraw/zinc/76/51/18/860765118.db2.gz OGISATNLJHNGKT-NRFANRHFSA-N 0 3 413.525 4.301 20 0 HIADHN CCO[C@H](CC(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)C1=CCCC1 ZINC000435368389 860765833 /nfs/dbraw/zinc/76/58/33/860765833.db2.gz HUWLRYRSTIBEAG-FCHUYYIVSA-N 0 3 408.546 4.174 20 0 HIADHN CCCN(C)c1ccc(C(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000435367510 860765924 /nfs/dbraw/zinc/76/59/24/860765924.db2.gz XBHUOCQUVOVTBA-HSZRJFAPSA-N 0 3 417.557 4.429 20 0 HIADHN O=C(CCc1c[nH]c2ccccc12)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435372761 860770698 /nfs/dbraw/zinc/77/06/98/860770698.db2.gz SJQFAKHYSAZBLX-OAQYLSRUSA-N 0 3 413.525 4.383 20 0 HIADHN Cc1ccc(O[C@@H](C)C(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000435373522 860771356 /nfs/dbraw/zinc/77/13/56/860771356.db2.gz DVXUAKUMJRXGFC-PZJWPPBQSA-N 0 3 404.514 4.045 20 0 HIADHN COc1cccc([C@@H]2C[C@H]2C(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000435373953 860771461 /nfs/dbraw/zinc/77/14/61/860771461.db2.gz ONQVIKGRMMBCPF-ACIOBRDBSA-N 0 3 416.525 4.081 20 0 HIADHN COc1ccc(Cl)cc1CC(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435374639 860773101 /nfs/dbraw/zinc/77/31/01/860773101.db2.gz RMJDIDUSRXOHDM-HXUWFJFHSA-N 0 3 424.932 4.173 20 0 HIADHN Cc1cc(C)cc(OCCC(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000435375345 860773255 /nfs/dbraw/zinc/77/32/55/860773255.db2.gz MGOGWEODSCTNEJ-QFIPXVFZSA-N 0 3 418.541 4.355 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)[C@@H]1C[C@H]1c1ccc(F)cc1F ZINC000435375805 860774139 /nfs/dbraw/zinc/77/41/39/860774139.db2.gz WTGGGYBXPSMIFN-HLAWJBBLSA-N 0 3 422.479 4.351 20 0 HIADHN Cc1cc(OCC(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)ccc1Cl ZINC000435380270 860776242 /nfs/dbraw/zinc/77/62/42/860776242.db2.gz MYQLICXLNXIKKP-IBGZPJMESA-N 0 3 424.932 4.309 20 0 HIADHN CCN(Cc1ccccn1)C(=O)Nc1cc(C)nn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435517410 860834911 /nfs/dbraw/zinc/83/49/11/860834911.db2.gz XDDUIVQZTLJNHR-JOCHJYFZSA-N 0 3 418.545 4.088 20 0 HIADHN Cc1cc(NC(=O)N2CCC[C@@H]3CCC[C@H]32)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435518205 860836431 /nfs/dbraw/zinc/83/64/31/860836431.db2.gz ZWGKZXVQBFJIKR-BHDDXSALSA-N 0 3 407.562 4.435 20 0 HIADHN COc1cccc(NC(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000435519994 860837311 /nfs/dbraw/zinc/83/73/11/860837311.db2.gz AJMXIEFSNYGFTN-FQEVSTJZSA-N 0 3 405.502 4.291 20 0 HIADHN Cc1cc(NC(=O)N[C@H](C)c2ncc(C)s2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435538880 860852310 /nfs/dbraw/zinc/85/23/10/860852310.db2.gz ZNGQHRWOYZHYEC-MJGOQNOKSA-N 0 3 424.574 4.286 20 0 HIADHN Cc1c(NC(=O)NC[C@@H]2CCCN2Cc2ccccc2)cnn1-c1ccccc1F ZINC000435552326 860868479 /nfs/dbraw/zinc/86/84/79/860868479.db2.gz QPVUATOERDDTTB-IBGZPJMESA-N 0 3 407.493 4.106 20 0 HIADHN Cc1cc(CN[C@H](C)c2cc(F)ccc2N2CCN(C)CC2)ccc1Br ZINC000467777409 881596904 /nfs/dbraw/zinc/59/69/04/881596904.db2.gz WGGYBILFTDADCS-MRXNPFEDSA-N 0 3 420.370 4.499 20 0 HIADHN Cc1cc(NC(=O)CNc2c(C)cccc2C)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435688118 860969477 /nfs/dbraw/zinc/96/94/77/860969477.db2.gz MDUXJLYWYRZDQK-QFIPXVFZSA-N 0 3 417.557 4.306 20 0 HIADHN CN(c1ccccc1)c1ccc(CNc2ccc(OC3CCN(C)CC3)nc2)cn1 ZINC000435713976 860998032 /nfs/dbraw/zinc/99/80/32/860998032.db2.gz OEBNPJPXHITJNF-UHFFFAOYSA-N 0 3 403.530 4.330 20 0 HIADHN CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)N[C@@H]1C[C@H]1c1ccc2ccccc2c1 ZINC000437810701 863137587 /nfs/dbraw/zinc/13/75/87/863137587.db2.gz MOEFNGRJTWXDAC-JBXUNAHCSA-N 0 3 414.553 4.425 20 0 HIADHN C[C@H]1CN(C2CC2)C[C@@H]1NC(=O)c1ccccc1CSc1nc2ccccc2[nH]1 ZINC000467806991 881630748 /nfs/dbraw/zinc/63/07/48/881630748.db2.gz VNWPCVWLSZUJKZ-BTYIYWSLSA-N 0 3 406.555 4.068 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)cc1 ZINC000437837634 863192033 /nfs/dbraw/zinc/19/20/33/863192033.db2.gz JTBJRRZANIUSKO-VQTJNVASSA-N 0 3 422.573 4.343 20 0 HIADHN COc1cc(Oc2ccccc2)ccc1NC(=O)N(CCN(C)C)C[C@@H]1CCCO1 ZINC000437875273 863235530 /nfs/dbraw/zinc/23/55/30/863235530.db2.gz VITAQDMAATVDSQ-FQEVSTJZSA-N 0 3 413.518 4.062 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)N[C@@H]3C[C@H]3c3ccc4ccccc4c3)CC2)C[C@H](C)O1 ZINC000437896819 863266427 /nfs/dbraw/zinc/26/64/27/863266427.db2.gz QSPKKPIAODQMLT-BWSHLYMBSA-N 0 3 421.585 4.227 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3ncsc3-c3ccccc3)CC2)C[C@@H](C)O1 ZINC000437899028 863271027 /nfs/dbraw/zinc/27/10/27/863271027.db2.gz RGWONQBGCJCFDI-QZTJIDSGSA-N 0 3 413.587 4.162 20 0 HIADHN Cc1ccc(NC(=O)N(C)C)cc1NC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000437917455 863293445 /nfs/dbraw/zinc/29/34/45/863293445.db2.gz HHHIIOCFADZFLB-SFHVURJKSA-N 0 3 412.509 4.078 20 0 HIADHN C[C@@H](c1ccc(Cl)cc1)N1CCN(C(=O)Nc2cccc(CN(C)C)c2)CC1 ZINC000437942178 863316890 /nfs/dbraw/zinc/31/68/90/863316890.db2.gz LZVOTSOZEGHDIR-KRWDZBQOSA-N 0 3 400.954 4.312 20 0 HIADHN C[NH+](C)CCc1ccccc1[N-]S(=O)(=O)c1ccc(OCc2ccccc2)cc1 ZINC000438241083 863696928 /nfs/dbraw/zinc/69/69/28/863696928.db2.gz QHKAJPXDVJZJSM-UHFFFAOYSA-N 0 3 410.539 4.171 20 0 HIADHN CC(C)CC(=O)Nc1ccc(NC(=O)N(CCN(C)C)Cc2cccs2)cc1 ZINC000438315937 863796334 /nfs/dbraw/zinc/79/63/34/863796334.db2.gz DRCBTDVWNLQHOG-UHFFFAOYSA-N 0 3 402.564 4.328 20 0 HIADHN COCCCN(CCO)Cc1cccc(NC(=O)c2ccc(Cl)cc2Cl)c1 ZINC000438342072 863813398 /nfs/dbraw/zinc/81/33/98/863813398.db2.gz WDBXBEACNZRULG-UHFFFAOYSA-N 0 3 411.329 4.077 20 0 HIADHN CSCc1cccc(CNCc2ccc(OCCN3CCOCC3)c(Cl)c2)c1 ZINC000438362938 863825848 /nfs/dbraw/zinc/82/58/48/863825848.db2.gz FROSPVJEVDTHBY-UHFFFAOYSA-N 0 3 421.006 4.204 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)N[C@H]1C[C@H](c2cc(F)cc(F)c2)C1 ZINC000438433363 863863861 /nfs/dbraw/zinc/86/38/61/863863861.db2.gz WTGQSWNNKHODMF-UKIBZPOASA-N 0 3 423.454 4.262 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1ccc(C(C)(C)C(=O)OC)cc1)c1ccsc1 ZINC000438465933 863887615 /nfs/dbraw/zinc/88/76/15/863887615.db2.gz CSEWOEQFBFFWCQ-LJQANCHMSA-N 0 3 417.575 4.403 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)c1ccnc(SCC(F)(F)F)c1 ZINC000438469383 863889438 /nfs/dbraw/zinc/88/94/38/863889438.db2.gz VWOOXSRPYSEYPJ-UHFFFAOYSA-N 0 3 403.495 4.002 20 0 HIADHN CC[C@@H]1CCN(CC(=O)NC[C@H](c2c[nH]c3ccccc32)c2ccc(OC)cc2)C1 ZINC000438508672 863931752 /nfs/dbraw/zinc/93/17/52/863931752.db2.gz MVHPGKGTNKOOSY-GCJKJVERSA-N 0 3 405.542 4.157 20 0 HIADHN CC(C)Cn1cc(NC(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)cn1 ZINC000438552722 863984756 /nfs/dbraw/zinc/98/47/56/863984756.db2.gz PGOVAVCRYCYVKS-UHFFFAOYSA-N 0 3 411.472 4.154 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)c3ccc4ccc(Cl)cc4n3)CC2)C[C@H](C)O1 ZINC000438571542 864005465 /nfs/dbraw/zinc/00/54/65/864005465.db2.gz VNYCQQIMRMKFRZ-IRXDYDNUSA-N 0 3 415.965 4.240 20 0 HIADHN CCN(C(=O)C(=O)Nc1cccc(Cl)c1F)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000438663306 864113042 /nfs/dbraw/zinc/11/30/42/864113042.db2.gz CZCFVFZYADMYEE-NVXWUHKLSA-N 0 3 417.912 4.102 20 0 HIADHN CCN(C(=O)C(=O)Nc1ccc(Cl)cc1F)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000438663962 864116201 /nfs/dbraw/zinc/11/62/01/864116201.db2.gz XZYQZEDXCHGVQR-YJBOKZPZSA-N 0 3 417.912 4.102 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)c2ccc(OCc3ccccn3)cc2)CC1 ZINC000438715920 864200608 /nfs/dbraw/zinc/20/06/08/864200608.db2.gz XXSLMZYMYJNJDB-UHFFFAOYSA-N 0 3 415.537 4.397 20 0 HIADHN COc1cc(CN(C)C[C@H](O)CO[C@H](c2ccccc2)c2ccc(C)cc2)ccc1O ZINC000438792050 864284903 /nfs/dbraw/zinc/28/49/03/864284903.db2.gz OFXAKWZVQUAJDK-JYFHCDHNSA-N 0 3 421.537 4.308 20 0 HIADHN Cc1ccsc1CCCC(=O)Nc1ccc(C(=O)N(C)[C@@H]2CCCN(C)C2)cc1 ZINC000438838746 864332777 /nfs/dbraw/zinc/33/27/77/864332777.db2.gz GDUSNYKUNPQPHB-HXUWFJFHSA-N 0 3 413.587 4.184 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Nc1ccc(Br)c(F)c1 ZINC000438890350 864372772 /nfs/dbraw/zinc/37/27/72/864372772.db2.gz MUDJFVNPFBKVPJ-UHFFFAOYSA-N 0 3 400.317 4.245 20 0 HIADHN O[C@@H]1CCCC[C@@H]1[C@@H]1CCCCN1Cc1nnc(-c2ccccc2Br)o1 ZINC000439013956 864465005 /nfs/dbraw/zinc/46/50/05/864465005.db2.gz FIZXHBJLHJLDFV-BPQIPLTHSA-N 0 3 420.351 4.405 20 0 HIADHN COc1ccc([C@H](NC(=O)CN(C)C2CCN(c3ccccc3)CC2)C(C)C)cc1 ZINC000439016629 864467682 /nfs/dbraw/zinc/46/76/82/864467682.db2.gz FBLVEKZEJQZZQW-RUZDIDTESA-N 0 3 409.574 4.109 20 0 HIADHN COc1cccc([C@H](CNC(=O)Cc2cccc(OC(F)(F)F)c2)N2CCCC2)c1 ZINC000439024755 864480056 /nfs/dbraw/zinc/48/00/56/864480056.db2.gz DPAODVUMBRYINB-FQEVSTJZSA-N 0 3 422.447 4.090 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)c1[nH]c2ccccc2c1Br ZINC000439030047 864485417 /nfs/dbraw/zinc/48/54/17/864485417.db2.gz SVJKYUYMYZZNKU-UHFFFAOYSA-N 0 3 406.349 4.196 20 0 HIADHN CSc1cccc(N(C(=O)c2cccc(C(=O)NC3CC3)c2)C2CCN(C)CC2)c1 ZINC000439098605 864539900 /nfs/dbraw/zinc/53/99/00/864539900.db2.gz HGRULKQVOSDAQW-UHFFFAOYSA-N 0 3 423.582 4.042 20 0 HIADHN CN(C)C(=O)COc1cccc(CN[C@@H](c2ccc(Br)s2)C2CC2)c1 ZINC000439129682 864564474 /nfs/dbraw/zinc/56/44/74/864564474.db2.gz KBZFJALAHHTVAI-LJQANCHMSA-N 0 3 423.376 4.219 20 0 HIADHN CS(=O)(=O)Cc1cccc(CN[C@@H](c2ccc(Br)s2)C2CC2)c1 ZINC000439135984 864568314 /nfs/dbraw/zinc/56/83/14/864568314.db2.gz QEKGANXHARBTMF-QGZVFWFLSA-N 0 3 414.390 4.296 20 0 HIADHN O=C1[C@@H](N2CCC([C@H]3CCCO3)CC2)CCCN1Cc1cccc(C(F)(F)F)c1 ZINC000439277782 864695170 /nfs/dbraw/zinc/69/51/70/864695170.db2.gz WWVGBSSDMPAPKE-VQTJNVASSA-N 0 3 410.480 4.087 20 0 HIADHN Cc1ncc(NC(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)c(C2CC2)n1 ZINC000439401169 864819770 /nfs/dbraw/zinc/81/97/70/864819770.db2.gz CHRXHDNUINHJMP-UHFFFAOYSA-N 0 3 421.467 4.277 20 0 HIADHN C[C@H](NCC1(c2ccc3c(c2)OCO3)CCOCC1)c1ncc(-c2ccccc2)o1 ZINC000439570742 864893792 /nfs/dbraw/zinc/89/37/92/864893792.db2.gz NBXJFLISJLEBIN-KRWDZBQOSA-N 0 3 406.482 4.469 20 0 HIADHN C[C@@H](NCc1ccccc1CN(C)Cc1ccco1)C(=O)Nc1ccc(F)c(F)c1 ZINC000439597337 864920662 /nfs/dbraw/zinc/92/06/62/864920662.db2.gz PVYLOMQOGPUHJQ-MRXNPFEDSA-N 0 3 413.468 4.307 20 0 HIADHN C[C@H](NC(=O)N(Cc1ccccc1)C1CCN(C)CC1)[C@@H]1Oc2ccccc2[C@H]1C ZINC000439635066 864960800 /nfs/dbraw/zinc/96/08/00/864960800.db2.gz RODHEKDKFPVPGX-YDIMBITNSA-N 0 3 407.558 4.246 20 0 HIADHN C[C@H](NCC(C)(C)c1c(F)cccc1Cl)C(=O)Nc1ccc2c(c1)OCCO2 ZINC000439636130 864963055 /nfs/dbraw/zinc/96/30/55/864963055.db2.gz BWSKTZWBKAWCEG-ZDUSSCGKSA-N 0 3 406.885 4.145 20 0 HIADHN CCOc1ccccc1NC(=O)[C@@H](NCC1(SC)CCOCC1)c1ccccc1 ZINC000439649695 864976656 /nfs/dbraw/zinc/97/66/56/864976656.db2.gz XPAKXPNOLRGTTB-NRFANRHFSA-N 0 3 414.571 4.267 20 0 HIADHN CC[C@](C)(O)CN(Cc1ccccc1)C(=O)N[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000439702997 865039560 /nfs/dbraw/zinc/03/95/60/865039560.db2.gz BOUOXSZVBADXRD-PBXXJUDPSA-N 0 3 409.574 4.195 20 0 HIADHN CC1CCN([C@H](CNC(=O)C(C)(C)NC(=O)Nc2ccccc2)c2ccccc2)CC1 ZINC000467973823 881829481 /nfs/dbraw/zinc/82/94/81/881829481.db2.gz FXRKOMWLCZMMNE-JOCHJYFZSA-N 0 3 422.573 4.176 20 0 HIADHN CC[C@@](C)(O)CN(Cc1ccccc1)C(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000439714934 865052568 /nfs/dbraw/zinc/05/25/68/865052568.db2.gz MIEYHASEDDDGEU-NZQKXSOJSA-N 0 3 415.603 4.258 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)c2ccc(OCc3ccncc3)cc2)CC1 ZINC000439729941 865063286 /nfs/dbraw/zinc/06/32/86/865063286.db2.gz DHDYGCNPJVLWMA-LJQANCHMSA-N 0 3 416.525 4.011 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)COc2ccc(Cl)cc2Cl)CC1 ZINC000439735800 865067584 /nfs/dbraw/zinc/06/75/84/865067584.db2.gz XZEQXNJYVXLBNC-CQSZACIVSA-N 0 3 408.329 4.109 20 0 HIADHN Cc1nc(CCC(=O)NC2CCN([C@@H](C)c3ccncc3)CC2)oc1-c1ccccc1 ZINC000439751075 865080293 /nfs/dbraw/zinc/08/02/93/865080293.db2.gz WFUJCSAYABENJB-IBGZPJMESA-N 0 3 418.541 4.319 20 0 HIADHN Cc1cc(O[C@@H](C)C(=O)NC2CCN([C@@H](C)c3ccncc3)CC2)ccc1Cl ZINC000439750791 865080971 /nfs/dbraw/zinc/08/09/71/865080971.db2.gz VNVRCCKWNSRKFD-IRXDYDNUSA-N 0 3 401.938 4.153 20 0 HIADHN Cc1nnc(-c2ccc(C(=O)NC[C@@H](c3ccccc3)N3CCC(C)CC3)cc2)o1 ZINC000467985499 881833981 /nfs/dbraw/zinc/83/39/81/881833981.db2.gz SJHOCXRWGSWUPQ-QFIPXVFZSA-N 0 3 404.514 4.248 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)[C@H](C)Oc2cc(Cl)cc(Cl)c2)CC1 ZINC000439764985 865090273 /nfs/dbraw/zinc/09/02/73/865090273.db2.gz FZWILRWVJNDTAY-CABCVRRESA-N 0 3 422.356 4.498 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)Cc2coc(-c3ccc(Cl)cc3)n2)CC1 ZINC000439765538 865090547 /nfs/dbraw/zinc/09/05/47/865090547.db2.gz LNIZBSBWSCVMPO-MRXNPFEDSA-N 0 3 424.932 4.274 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)CCc2ccc(OC(F)(F)F)cc2)CC1 ZINC000439771236 865095537 /nfs/dbraw/zinc/09/55/37/865095537.db2.gz RWMFJFCXBOIAPF-MRXNPFEDSA-N 0 3 421.463 4.255 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CC[C@H](c4ccc(C)cc4C)C3)c2)CC1 ZINC000468001704 881844354 /nfs/dbraw/zinc/84/43/54/881844354.db2.gz CYNFTYBAVYERTG-NRFANRHFSA-N 0 3 406.574 4.467 20 0 HIADHN Cc1ccc(-c2ccnn2C)cc1NC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000439978325 865276534 /nfs/dbraw/zinc/27/65/34/865276534.db2.gz LEGULIMVGXFIFY-OAQYLSRUSA-N 0 3 403.530 4.134 20 0 HIADHN O=C(Cc1ccc(NC(=O)[C@@H]2CCCN2C2CCCC2)cc1)N1CCc2ccccc21 ZINC000440144161 865378391 /nfs/dbraw/zinc/37/83/91/865378391.db2.gz KTZZUALPAHAQKH-DEOSSOPVSA-N 0 3 417.553 4.164 20 0 HIADHN Fc1ccc2c(c1)[C@H](NC1CCN(Cc3ccccc3Br)CC1)CO2 ZINC000468036380 881866548 /nfs/dbraw/zinc/86/65/48/881866548.db2.gz DKSNPXCNAKBJSC-LJQANCHMSA-N 0 3 405.311 4.276 20 0 HIADHN CC[C@@H](NC(=O)N1CCN(C2CCC(C(C)C)CC2)CC1)c1c(C)nn(C)c1C ZINC000440194752 865423187 /nfs/dbraw/zinc/42/31/87/865423187.db2.gz ZXQUFQIQYSKECQ-XVAXZDLZSA-N 0 3 403.615 4.030 20 0 HIADHN COc1cc(C)c(NC(=O)N2CCN(C3CCC(C(C)C)CC3)CC2)cc1OC ZINC000440249140 865489874 /nfs/dbraw/zinc/48/98/74/865489874.db2.gz YHNPHIDGJANFGM-UHFFFAOYSA-N 0 3 403.567 4.377 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)Nc2ccc(CCC(F)(F)F)cc2)CC1 ZINC000440286088 865537958 /nfs/dbraw/zinc/53/79/58/865537958.db2.gz QQHWLNFAKSFLFN-UHFFFAOYSA-N 0 3 401.473 4.192 20 0 HIADHN CC(C)n1cnnc1-c1ccccc1NC(=O)NC[C@@H](C)N(C)Cc1ccccc1 ZINC000440297671 865555757 /nfs/dbraw/zinc/55/57/57/865555757.db2.gz WHHONJFEMMUSIX-GOSISDBHSA-N 0 3 406.534 4.168 20 0 HIADHN Cc1ccccc1COc1cccc(NC(=O)C(=O)Nc2cccc(CN(C)C)c2)c1 ZINC000440324764 865596932 /nfs/dbraw/zinc/59/69/32/865596932.db2.gz IXYDCXXJIYOOMD-UHFFFAOYSA-N 0 3 417.509 4.213 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)N[C@H](CC(F)(F)F)c3ccccc3)CC2)c1 ZINC000468074114 881887995 /nfs/dbraw/zinc/88/79/95/881887995.db2.gz PHMVPPOKLDKUJS-OAQYLSRUSA-N 0 3 419.491 4.317 20 0 HIADHN CC(C)C1CCC(N2CCN(C(=O)Nc3cc(C(F)(F)F)c[nH]c3=O)CC2)CC1 ZINC000440364482 865642675 /nfs/dbraw/zinc/64/26/75/865642675.db2.gz LBIZQQKAJGRPOR-UHFFFAOYSA-N 0 3 414.472 4.170 20 0 HIADHN CCC(CC)(C(=O)Nc1cccc(CN2CCC(C(N)=O)CC2)c1)c1ccccc1 ZINC000440384996 865675838 /nfs/dbraw/zinc/67/58/38/865675838.db2.gz CWVRRYGYDKWDBA-UHFFFAOYSA-N 0 3 407.558 4.080 20 0 HIADHN COCc1nc(C(=O)NC2CCN(Cc3ccccc3)CC2)c(-c2ccccc2)s1 ZINC000440442881 865743985 /nfs/dbraw/zinc/74/39/85/865743985.db2.gz UTUPRIYFFNZATQ-UHFFFAOYSA-N 0 3 421.566 4.351 20 0 HIADHN Cn1cc(-c2cc(CN3CCC(C)(c4ccc(Br)cc4)CC3)on2)cn1 ZINC000440522919 865804048 /nfs/dbraw/zinc/80/40/48/865804048.db2.gz WXBIHNJOEISPQT-UHFFFAOYSA-N 0 3 415.335 4.391 20 0 HIADHN CCN(C[C@H]1CCN(Cc2ccccc2)C1)C(=O)c1[nH]c2c(c1C)C(=O)CC(C)(C)C2 ZINC000440543786 865812374 /nfs/dbraw/zinc/81/23/74/865812374.db2.gz OOELDNWVHTXXLP-FQEVSTJZSA-N 0 3 421.585 4.462 20 0 HIADHN Cn1ccnc1C[C@@H]1CCCN(CC(=O)N2c3ccccc3CCc3ccccc32)C1 ZINC000440781885 865906743 /nfs/dbraw/zinc/90/67/43/865906743.db2.gz BGDGSHMJLWTPEZ-FQEVSTJZSA-N 0 3 414.553 4.138 20 0 HIADHN FC(F)(F)c1cc(CNC[C@@H](c2ccccc2)N2CCc3sccc3C2)[nH]n1 ZINC000440832403 865947338 /nfs/dbraw/zinc/94/73/38/865947338.db2.gz PJSCXFXDSJQYCD-KRWDZBQOSA-N 0 3 406.477 4.379 20 0 HIADHN COc1ccc(NC(=O)C2(NCCOc3ccccc3Cl)CCCC2)cc1OC ZINC000440905523 866002314 /nfs/dbraw/zinc/00/23/14/866002314.db2.gz YHZSIAOBQQROFK-UHFFFAOYSA-N 0 3 418.921 4.277 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)CSc2ncnc3scc(-c4ccccc4)c32)CN1C1CC1 ZINC000440922167 866018965 /nfs/dbraw/zinc/01/89/65/866018965.db2.gz NBLKTPQDKHOGGJ-ZBFHGGJFSA-N 0 3 424.595 4.192 20 0 HIADHN CC(C)(c1ccccc1)c1ccc(OC[C@@H](O)CN2CCC(c3c[nH]cn3)CC2)cc1 ZINC000440968379 866054695 /nfs/dbraw/zinc/05/46/95/866054695.db2.gz VROJJPFARDKBAS-QHCPKHFHSA-N 0 3 419.569 4.355 20 0 HIADHN CSc1ccccc1[C@H](C)NC(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000441021209 866088106 /nfs/dbraw/zinc/08/81/06/866088106.db2.gz KCXXIBSNJYMZFR-ICSRJNTNSA-N 0 3 413.587 4.060 20 0 HIADHN Cc1cccc2sc(N(Cc3ccccc3)C(=O)CNC3(CO)CCCC3)nc21 ZINC000441054015 866129068 /nfs/dbraw/zinc/12/90/68/866129068.db2.gz VEFGICZGWLHFED-UHFFFAOYSA-N 0 3 409.555 4.033 20 0 HIADHN Cc1ccnc(Oc2ccc(NC(=O)NCCCN3CCc4ccccc4C3)cc2)n1 ZINC000441095001 866192221 /nfs/dbraw/zinc/19/22/21/866192221.db2.gz TUHJKSBZYVAJGB-UHFFFAOYSA-N 0 3 417.513 4.147 20 0 HIADHN Cc1ccc(CNC(=O)C2CCN(Cc3ccc(C(=O)OC(C)C)cc3)CC2)cc1 ZINC000441166593 866248218 /nfs/dbraw/zinc/24/82/18/866248218.db2.gz KGTYZTZOSPDQTF-UHFFFAOYSA-N 0 3 408.542 4.089 20 0 HIADHN CCOc1ccc(-c2nc(CN3CCC[C@H]([C@@H]4CCOC4)C3)cs2)cc1OC ZINC000441219205 866297576 /nfs/dbraw/zinc/29/75/76/866297576.db2.gz WGKZWLBLOUVEEK-ZWKOTPCHSA-N 0 3 402.560 4.466 20 0 HIADHN Cc1ccc([C@H]2CCC[C@H]2N(C)C(=O)C(=O)Nc2cc(CN(C)C)ccc2C)cc1 ZINC000441255963 866328575 /nfs/dbraw/zinc/32/85/75/866328575.db2.gz HZUSVRUPXOYNLJ-FYYLOGMGSA-N 0 3 407.558 4.098 20 0 HIADHN CO[C@H]1CCCC[C@@H]1NCC(=O)N(Cc1ccccc1)c1nc2c(s1)CCCC2 ZINC000441259131 866334960 /nfs/dbraw/zinc/33/49/60/866334960.db2.gz LDJGAXSMVHEHEW-ICSRJNTNSA-N 0 3 413.587 4.102 20 0 HIADHN CN(C(=O)CCN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1)c1ccccc1 ZINC000441269835 866343752 /nfs/dbraw/zinc/34/37/52/866343752.db2.gz SJNBZNKIIFDQON-QHCPKHFHSA-N 0 3 415.537 4.087 20 0 HIADHN C[C@H](C(=O)Nc1ccc(OCc2ccccc2)cc1)N1CCC[C@H]([C@H]2CCOC2)C1 ZINC000441284522 866360266 /nfs/dbraw/zinc/36/02/66/866360266.db2.gz XQVXNMRVHKIJTM-HJNYFJLDSA-N 0 3 408.542 4.341 20 0 HIADHN CCCOc1ccc(CN(CCC)C(=O)N[C@H]2C[C@H](C)N(C3CC3)C2)cc1OC ZINC000441287355 866362200 /nfs/dbraw/zinc/36/22/00/866362200.db2.gz PDZKAVIIBQMGQB-HKUYNNGSSA-N 0 3 403.567 4.031 20 0 HIADHN Cc1ccc(NC(=O)Nc2cccc3c2CCN(CCC(=O)N2CCC[C@H]2C)C3)cc1 ZINC000441330550 866401531 /nfs/dbraw/zinc/40/15/31/866401531.db2.gz ZYKOONIWUFRGSS-LJQANCHMSA-N 0 3 420.557 4.398 20 0 HIADHN C[C@H]1C[C@H](NC(=O)N2CCC(c3nc4cc(Cl)ccc4s3)CC2)CN1C1CC1 ZINC000441346527 866416949 /nfs/dbraw/zinc/41/69/49/866416949.db2.gz APPHRGFJUHEAKG-BBRMVZONSA-N 0 3 418.994 4.464 20 0 HIADHN Cc1ccc([C@H]2CCC[C@@H]2N(C)Cc2ccc(S(=O)(=O)N3CCCC3)o2)cc1 ZINC000441360043 866429642 /nfs/dbraw/zinc/42/96/42/866429642.db2.gz XKJBXGYYCMZRDD-RTWAWAEBSA-N 0 3 402.560 4.141 20 0 HIADHN COCc1nc(CNC2CCN(C(=O)CC(C)(C)C)CC2)c(-c2ccccc2)s1 ZINC000441389100 866460134 /nfs/dbraw/zinc/46/01/34/866460134.db2.gz UIXUDTFMXFYPAP-UHFFFAOYSA-N 0 3 415.603 4.473 20 0 HIADHN COCCN(C(=O)N[C@@H]1C[C@@H](C)N(C2CC2)C1)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000441397330 866469629 /nfs/dbraw/zinc/46/96/29/866469629.db2.gz QLKFEEXJEABSBB-IIDMSEBBSA-N 0 3 413.484 4.050 20 0 HIADHN COc1ccc2c(c1)[C@H](N(CCC(=O)N1CCC[C@@H]1C)Cc1ccccc1)CCO2 ZINC000441455082 866530195 /nfs/dbraw/zinc/53/01/95/866530195.db2.gz CUWLZOBCFDDUMU-WMZHIEFXSA-N 0 3 408.542 4.422 20 0 HIADHN CC(C)(O)CN1CCc2c(cccc2NC(=O)CC(C)(C)CC(=O)c2ccccc2)C1 ZINC000441611528 866708520 /nfs/dbraw/zinc/70/85/20/866708520.db2.gz KWBYQXBCBVAZEJ-UHFFFAOYSA-N 0 3 422.569 4.443 20 0 HIADHN CN1CCN(CCNC(=O)Nc2cccc(CSC3CCCCC3)c2)CC1(C)C ZINC000441643039 866751173 /nfs/dbraw/zinc/75/11/73/866751173.db2.gz AXKWZUNWHVHSFM-UHFFFAOYSA-N 0 3 418.651 4.400 20 0 HIADHN C[C@@H](NC(=O)C(=O)Nc1ccc(OC2CCCCC2)cc1)[C@H](c1ccccc1)N(C)C ZINC000441698059 866810512 /nfs/dbraw/zinc/81/05/12/866810512.db2.gz GEKVYRRBAAXVKE-WZONZLPQSA-N 0 3 423.557 4.144 20 0 HIADHN Cc1c(Cl)cc(NC(=O)C(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)cc1Cl ZINC000441707521 866814519 /nfs/dbraw/zinc/81/45/19/866814519.db2.gz MFOYTPZYBWFXRP-SCLBCKFNSA-N 0 3 408.329 4.048 20 0 HIADHN CN(C(=O)Nc1cc(Cl)cc(F)c1F)C1CCN(CCc2ccccn2)CC1 ZINC000442195539 867216632 /nfs/dbraw/zinc/21/66/32/867216632.db2.gz NENGSXMNRQISOE-UHFFFAOYSA-N 0 3 408.880 4.184 20 0 HIADHN CCN(C(=O)c1cc2cnn(CC)c2nc1C)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000442306752 867317399 /nfs/dbraw/zinc/31/73/99/867317399.db2.gz QNFPJLSGNYAUBC-GHTZIAJQSA-N 0 3 405.546 4.057 20 0 HIADHN CCN(C(=O)c1cc2cnn(CC)c2nc1C)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000442306760 867317492 /nfs/dbraw/zinc/31/74/92/867317492.db2.gz QNFPJLSGNYAUBC-WIYYLYMNSA-N 0 3 405.546 4.057 20 0 HIADHN COCc1nc(CNC2CCN(Cc3ccncc3)CC2)c(-c2ccccc2)s1 ZINC000442866147 867704359 /nfs/dbraw/zinc/70/43/59/867704359.db2.gz VQUJGJKIJIBEFJ-UHFFFAOYSA-N 0 3 408.571 4.106 20 0 HIADHN COc1cc(C[NH2+][C@@H](C)[C@H](c2ccccc2C)N(C)C)cc(Br)c1[O-] ZINC000442994941 867784104 /nfs/dbraw/zinc/78/41/04/867784104.db2.gz VHYKOKAVODZAJO-IFXJQAMLSA-N 0 3 407.352 4.253 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@H]1CCOc2c(F)cccc21)c1cccc(OC)c1 ZINC000443015024 867793042 /nfs/dbraw/zinc/79/30/42/867793042.db2.gz RFYXYDYDHGDBOH-LEWJYISDSA-N 0 3 415.509 4.040 20 0 HIADHN C[C@@H](CC(=O)N1CCCCCC1)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1 ZINC000443092097 867816560 /nfs/dbraw/zinc/81/65/60/867816560.db2.gz GDVRLWWHAFAILZ-NZQKXSOJSA-N 0 3 407.558 4.007 20 0 HIADHN C[C@@H](CC(=O)Nc1cccc(Br)c1)N[C@H]1CCOc2c(F)cccc21 ZINC000443207776 867875270 /nfs/dbraw/zinc/87/52/70/867875270.db2.gz KKQLJBARTOGPMC-SJCJKPOMSA-N 0 3 407.283 4.419 20 0 HIADHN Cc1nccn1CCCN1CCC[C@@H]1c1nc(-c2ccccc2Br)no1 ZINC000443329145 867905738 /nfs/dbraw/zinc/90/57/38/867905738.db2.gz HVDYECWPHYSYAM-QGZVFWFLSA-N 0 3 416.323 4.231 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Nc1cc(F)cc(F)c1Br ZINC000443533308 868092789 /nfs/dbraw/zinc/09/27/89/868092789.db2.gz POJSMAJJZMWXRE-UHFFFAOYSA-N 0 3 418.307 4.385 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)C2(c3cccc(C(F)(F)F)c3)CCC2)C[C@@H](C)O1 ZINC000443676594 868283627 /nfs/dbraw/zinc/28/36/27/868283627.db2.gz UWWIMFLIRLUDMJ-IAGOWNOFSA-N 0 3 412.496 4.133 20 0 HIADHN C[C@H](CC(=O)Nc1cccc(CN2CCC(CO)CC2)c1)c1ccc(F)cc1F ZINC000443803238 868340367 /nfs/dbraw/zinc/34/03/67/868340367.db2.gz PXANCJMFBLHQDL-MRXNPFEDSA-N 0 3 402.485 4.301 20 0 HIADHN CCCn1ccc2cc(NC(=O)C(=O)N[C@H](C)[C@@H](c3ccccc3C)N(C)C)ccc21 ZINC000443836191 868366533 /nfs/dbraw/zinc/36/65/33/868366533.db2.gz CCELSKSHAXDVNX-JPYJTQIMSA-N 0 3 420.557 4.106 20 0 HIADHN CSc1ccc(NC(=O)C(=O)N[C@@H](C)[C@@H](c2ccccc2C)N(C)C)cc1Cl ZINC000443847001 868377301 /nfs/dbraw/zinc/37/73/01/868377301.db2.gz ZAEZVBRSDKNVNC-LIRRHRJNSA-N 0 3 419.978 4.116 20 0 HIADHN FC(F)(F)Oc1cccc(N2CC[C@H](NCc3cnc(C(F)(F)F)s3)C2)c1 ZINC000443986963 868510726 /nfs/dbraw/zinc/51/07/26/868510726.db2.gz JCTZSIWKZPBQCJ-JTQLQIEISA-N 0 3 411.371 4.429 20 0 HIADHN C[C@@H](C(=O)Nc1cccc(C(=O)Nc2ccc(Cl)cn2)c1)N1[C@H](C)CC[C@H]1C ZINC000444002579 868523239 /nfs/dbraw/zinc/52/32/39/868523239.db2.gz JZRZFBBVNWZDTA-KFWWJZLASA-N 0 3 400.910 4.187 20 0 HIADHN CSc1ccccc1S(=O)(=O)N(C)[C@@H]1CCN(Cc2ccccc2)[C@@H](C)C1 ZINC000444082665 868607081 /nfs/dbraw/zinc/60/70/81/868607081.db2.gz IIEAJWDGEHKYJE-PKOBYXMFSA-N 0 3 404.601 4.082 20 0 HIADHN COc1cc(NC(=O)CCN2CCSC[C@@H]2c2ccccc2)c(OC)cc1Cl ZINC000444157796 868641226 /nfs/dbraw/zinc/64/12/26/868641226.db2.gz OROZLRKKMKHJRQ-GOSISDBHSA-N 0 3 420.962 4.476 20 0 HIADHN COc1cc2nc(CN(C)[C@@H]3CCC[C@@H]3c3ccc(C)cc3)[nH]c(=O)c2cc1OC ZINC000444239918 868688833 /nfs/dbraw/zinc/68/88/33/868688833.db2.gz MTFJQSUUJLYUDW-YLJYHZDGSA-N 0 3 407.514 4.429 20 0 HIADHN Cc1nc(-c2cccc(C(=O)Nc3cccc(CN4CCC(O)CC4)c3)c2)cs1 ZINC000444448750 868831923 /nfs/dbraw/zinc/83/19/23/868831923.db2.gz DBQMDBAHUPOTCD-UHFFFAOYSA-N 0 3 407.539 4.328 20 0 HIADHN O=C(COc1ccccc1-c1ccccc1)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000444463254 868839014 /nfs/dbraw/zinc/83/90/14/868839014.db2.gz XLVFGMZJKYORRW-UHFFFAOYSA-N 0 3 416.521 4.328 20 0 HIADHN O=C(NCc1ccc2c(n1)CCCC2)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000444540903 868874988 /nfs/dbraw/zinc/87/49/88/868874988.db2.gz GWNBNYVUCIRIOE-QFIPXVFZSA-N 0 3 417.475 4.031 20 0 HIADHN CC(C)(C(=O)Nc1cccc(CN2CCC(CO)CC2)c1)c1cccc(Cl)c1 ZINC000444560703 868882092 /nfs/dbraw/zinc/88/20/92/868882092.db2.gz XHZJAXGRFSJLPZ-UHFFFAOYSA-N 0 3 400.950 4.461 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)NC(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)cc1 ZINC000444577045 868888224 /nfs/dbraw/zinc/88/82/24/868888224.db2.gz WRHBGYOEJUVSES-YDHSSHFGSA-N 0 3 417.557 4.376 20 0 HIADHN COC(=O)c1ccc2[nH]cc(C(=O)CN(Cc3ccccc3)CC3CCOCC3)c2c1 ZINC000444626188 868917766 /nfs/dbraw/zinc/91/77/66/868917766.db2.gz RZTCQZPLMQBDTE-UHFFFAOYSA-N 0 3 420.509 4.066 20 0 HIADHN COc1ccc(-c2nc(NC(=O)CN[C@H]3CC(C)(C)OC3(C)C)sc2C)cc1 ZINC000444641383 868927412 /nfs/dbraw/zinc/92/74/12/868927412.db2.gz UQJQJHVGDJOVED-INIZCTEOSA-N 0 3 403.548 4.001 20 0 HIADHN O=C(c1cccc(CN2CCC(CO)(Cc3ccccc3)CC2)c1)N1CCCCC1 ZINC000444777234 868998232 /nfs/dbraw/zinc/99/82/32/868998232.db2.gz RNRHDWZADHZQOS-UHFFFAOYSA-N 0 3 406.570 4.130 20 0 HIADHN CC(C)(C)N(Cc1ccccc1)C(=O)CN1CCC(CO)(Cc2ccccc2)CC1 ZINC000444790245 869006249 /nfs/dbraw/zinc/00/62/49/869006249.db2.gz HSURZVXRCZRMAT-UHFFFAOYSA-N 0 3 408.586 4.131 20 0 HIADHN CCOC(=O)c1nnc(C2CC[NH+](Cc3c(OC(C)C)ccc4ccccc43)CC2)[n-]1 ZINC000444811666 869023647 /nfs/dbraw/zinc/02/36/47/869023647.db2.gz KGHNZKGZRGLEBD-UHFFFAOYSA-N 0 3 422.529 4.301 20 0 HIADHN Cc1ccccc1[C@@H](CC(F)(F)F)NC(=O)NC1CCN(CCOC(C)C)CC1 ZINC000445123664 869229852 /nfs/dbraw/zinc/22/98/52/869229852.db2.gz HNIDRQZJBGTTLO-LJQANCHMSA-N 0 3 415.500 4.177 20 0 HIADHN CC(C)N1CCC(N(C)C(=O)CCCC(=O)c2ccc(Br)cc2)CC1 ZINC000445252491 869307533 /nfs/dbraw/zinc/30/75/33/869307533.db2.gz LAWHDNJPQPUCSA-UHFFFAOYSA-N 0 3 409.368 4.133 20 0 HIADHN Fc1cccc(CN2CCC[C@@H](c3nc(CCc4ccc5c(c4)CCO5)no3)C2)c1 ZINC000445600546 869665955 /nfs/dbraw/zinc/66/59/55/869665955.db2.gz MHVPUSCLKFJYKK-HXUWFJFHSA-N 0 3 407.489 4.308 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3c[nH]nc3-c3ccccc3Cl)c(C)c2)CC1 ZINC000445647332 869718399 /nfs/dbraw/zinc/71/83/99/869718399.db2.gz LUTDBJDBPFBVCH-UHFFFAOYSA-N 0 3 423.948 4.433 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cnc(Cc4ccccc4)s3)c(C)c2)CC1 ZINC000445648465 869719034 /nfs/dbraw/zinc/71/90/34/869719034.db2.gz RVHPBDYDAREXAJ-UHFFFAOYSA-N 0 3 420.582 4.437 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)CCCc3ccc(F)c(F)c3)c(C)c2)CC1 ZINC000445649544 869720167 /nfs/dbraw/zinc/72/01/67/869720167.db2.gz YBTMWROJZATWAA-UHFFFAOYSA-N 0 3 401.501 4.377 20 0 HIADHN Cc1ccc(Oc2ccc(Cl)cc2NC(=O)CN[C@@H]2CCCC[C@@H]2C(N)=O)cc1 ZINC000445766788 869810967 /nfs/dbraw/zinc/81/09/67/869810967.db2.gz MECOMKRCCFXHGN-ZWKOTPCHSA-N 0 3 415.921 4.013 20 0 HIADHN CC(C)N(C)c1ccccc1CNCc1c(Cl)cccc1N1CCN(C)CC1 ZINC000445767795 869811696 /nfs/dbraw/zinc/81/16/96/869811696.db2.gz UAAGUPSFRQYMGW-UHFFFAOYSA-N 0 3 400.998 4.226 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@H](C)NCc2cncn2Cc2ccccc2)CC1 ZINC000445806825 869832946 /nfs/dbraw/zinc/83/29/46/869832946.db2.gz BHYMQAAMIGXURW-FQEVSTJZSA-N 0 3 421.564 4.063 20 0 HIADHN CN(CCc1nc2ccccc2c(=O)[nH]1)[C@H]1CCOc2ccc(Br)cc21 ZINC000445874261 869867079 /nfs/dbraw/zinc/86/70/79/869867079.db2.gz FTKCFRDBZQKWTG-KRWDZBQOSA-N 0 3 414.303 4.096 20 0 HIADHN CN(CCc1nc2ccccc2c(=O)[nH]1)[C@@H]1CCOc2ccc(Br)cc21 ZINC000445874262 869867229 /nfs/dbraw/zinc/86/72/29/869867229.db2.gz FTKCFRDBZQKWTG-QGZVFWFLSA-N 0 3 414.303 4.096 20 0 HIADHN CC(C)[C@H](CC(F)(F)F)NCC(=O)N1CCC[C@@H]1c1ccc2c(c1)OCCCO2 ZINC000445878690 869869772 /nfs/dbraw/zinc/86/97/72/869869772.db2.gz VMCUXXXDQLYQAO-DLBZAZTESA-N 0 3 414.468 4.078 20 0 HIADHN COc1cc(-c2noc(CN[C@@H]3CCC[C@@H]3c3ccccc3)n2)cc(OC)c1OC ZINC000445993715 869955789 /nfs/dbraw/zinc/95/57/89/869955789.db2.gz TYFNEMDZXLOECX-QZTJIDSGSA-N 0 3 409.486 4.188 20 0 HIADHN COc1cc(-c2nnc(CN[C@@H]3CCC[C@H]3c3ccccc3)o2)cc(OC)c1OC ZINC000446002492 869965844 /nfs/dbraw/zinc/96/58/44/869965844.db2.gz FYDGMZWCLDLXHC-ZWKOTPCHSA-N 0 3 409.486 4.188 20 0 HIADHN C[C@@H](CSc1ccc(F)cc1)C(=O)N(C)C1CCN(CCc2ccccn2)CC1 ZINC000446131392 870076293 /nfs/dbraw/zinc/07/62/93/870076293.db2.gz OVEAHVPEPMZEPG-SFHVURJKSA-N 0 3 415.578 4.114 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCC(Oc2ccncc2C)CC1)c1ccsc1 ZINC000446237806 870178570 /nfs/dbraw/zinc/17/85/70/870178570.db2.gz QDHBHBQDKDBQGO-HXUWFJFHSA-N 0 3 416.591 4.087 20 0 HIADHN C[C@H]1C[C@@H](N(C)C(=O)CCC(=O)c2ccc(F)c(F)c2)CCN1Cc1ccccc1 ZINC000446271144 870208175 /nfs/dbraw/zinc/20/81/75/870208175.db2.gz WPMYWMVRUJHKLS-PXNSSMCTSA-N 0 3 414.496 4.439 20 0 HIADHN CN(C)Cc1cccc(C(=O)NC2(c3cccc(OC(F)(F)F)c3)CCOCC2)c1 ZINC000446490544 870404226 /nfs/dbraw/zinc/40/42/26/870404226.db2.gz NMQMZLYOVZWPND-UHFFFAOYSA-N 0 3 422.447 4.083 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)CCc3c[nH]c4ccc(C)cc34)cc2)CC1 ZINC000468467544 882415448 /nfs/dbraw/zinc/41/54/48/882415448.db2.gz NVUNCMJXCWAPGW-UHFFFAOYSA-N 0 3 404.558 4.185 20 0 HIADHN C[C@H](NC[C@@H](c1cccs1)N1CCOCC1)c1ccc(Br)cc1F ZINC000446743904 870652109 /nfs/dbraw/zinc/65/21/09/870652109.db2.gz WRXGXKJNPPFUJP-GUYCJALGSA-N 0 3 413.356 4.374 20 0 HIADHN COc1ccc2c(c1)[C@H](N[C@H](C)c1ccc(S(=O)(=O)N(C)C)cc1)CCCS2 ZINC000446749902 870658199 /nfs/dbraw/zinc/65/81/99/870658199.db2.gz CTSMQNKYANKVFV-FOIQADDNSA-N 0 3 420.600 4.223 20 0 HIADHN Cc1cc(CN2CCSCC2)ccc1NS(=O)(=O)Cc1ccccc1Cl ZINC000446750583 870658682 /nfs/dbraw/zinc/65/86/82/870658682.db2.gz HVQALOPWLCASLG-UHFFFAOYSA-N 0 3 410.992 4.139 20 0 HIADHN Cc1ccc([C@H](CCn2cncn2)NCc2cccc(NC(=O)CC(C)C)c2)cc1 ZINC000446755560 870666414 /nfs/dbraw/zinc/66/64/14/870666414.db2.gz WMHONZJDVWTONC-QHCPKHFHSA-N 0 3 405.546 4.492 20 0 HIADHN COc1ccc(-c2ccc(CNC(=O)N(CCN(C)C)Cc3ccco3)s2)cc1 ZINC000446780028 870698647 /nfs/dbraw/zinc/69/86/47/870698647.db2.gz FUPITUXHYKXLRF-UHFFFAOYSA-N 0 3 413.543 4.290 20 0 HIADHN C[C@H](NCCNc1nccc(C(F)(F)F)n1)c1ccc(Br)cc1F ZINC000446838278 870756345 /nfs/dbraw/zinc/75/63/45/870756345.db2.gz GQTXLMBXXQDNER-VIFPVBQESA-N 0 3 407.209 4.160 20 0 HIADHN C[C@@H](NCCNc1nccc(C(F)(F)F)n1)c1ccc(Br)cc1F ZINC000446838277 870756562 /nfs/dbraw/zinc/75/65/62/870756562.db2.gz GQTXLMBXXQDNER-SECBINFHSA-N 0 3 407.209 4.160 20 0 HIADHN COc1ccc2c(c1)[C@@H]([NH2+]C1CCN(C(=O)c3ccccc3[O-])CC1)CCCS2 ZINC000446841153 870759856 /nfs/dbraw/zinc/75/98/56/870759856.db2.gz MOQBBKUJORAWHA-FQEVSTJZSA-N 0 3 412.555 4.222 20 0 HIADHN COc1ccc([C@@H](CCn2cncn2)NCc2ccc(OC)cc2C(F)(F)F)cc1 ZINC000446844067 870763811 /nfs/dbraw/zinc/76/38/11/870763811.db2.gz QZICKEQBKXSTAU-HXUWFJFHSA-N 0 3 420.435 4.235 20 0 HIADHN Cn1ccnc1[C@@H]1CCCN(Cc2cnn(Cc3ccc(C(F)(F)F)cc3)c2)C1 ZINC000446851802 870773312 /nfs/dbraw/zinc/77/33/12/870773312.db2.gz FNSCVVOCSTYZJW-GOSISDBHSA-N 0 3 403.452 4.063 20 0 HIADHN Cc1ccc([C@@H](CCn2cncn2)NCc2cc(Cl)c3c(c2)OCCCO3)cc1 ZINC000446925261 870837864 /nfs/dbraw/zinc/83/78/64/870837864.db2.gz NKTOEXKBANNWHP-HXUWFJFHSA-N 0 3 412.921 4.322 20 0 HIADHN Cc1ccc([C@@H](CCn2cncn2)NCc2ccc(C)cc2OC[C@H]2CCOC2)cc1 ZINC000446938270 870848460 /nfs/dbraw/zinc/84/84/60/870848460.db2.gz HXYFXJDGJCCLSM-XUZZJYLKSA-N 0 3 420.557 4.231 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1ncc(Cc2cccc(F)c2)s1 ZINC000446939484 870849721 /nfs/dbraw/zinc/84/97/21/870849721.db2.gz OKTWTNYVDGGOPO-UHFFFAOYSA-N 0 3 402.495 4.062 20 0 HIADHN CC[C@H](C)c1ccccc1NC(=O)[C@@H](C)NC[C@](C)(C(=O)OC)c1ccc(F)cc1 ZINC000447033545 870908834 /nfs/dbraw/zinc/90/88/34/870908834.db2.gz JBHHQFXZENLDTD-SRGWNRLKSA-N 0 3 414.521 4.387 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1cc(F)ccc1SCC(F)F ZINC000447074158 870956962 /nfs/dbraw/zinc/95/69/62/870956962.db2.gz COYASJYAUGVHMB-UHFFFAOYSA-N 0 3 401.454 4.372 20 0 HIADHN CCOc1cc(CN[C@]2(CCO)CCOC2)ccc1OCc1c(F)cccc1Cl ZINC000447073729 870957246 /nfs/dbraw/zinc/95/72/46/870957246.db2.gz YJMMBAQHGHUYHM-JOCHJYFZSA-N 0 3 423.912 4.088 20 0 HIADHN CCc1ccc(-c2nn(Cc3ccccc3)cc2CN2CCC(CO)(OC)CC2)cc1 ZINC000447092410 870988259 /nfs/dbraw/zinc/98/82/59/870988259.db2.gz ZNHQZEHSYSSLDX-UHFFFAOYSA-N 0 3 419.569 4.134 20 0 HIADHN COCCO[C@@H]1C[C@@H](CO)CN(Cc2ccc(-c3ccc(Cl)c(Cl)c3)o2)C1 ZINC000447093680 870990958 /nfs/dbraw/zinc/99/09/58/870990958.db2.gz LUULPDDHZFSYEM-RHSMWYFYSA-N 0 3 414.329 4.099 20 0 HIADHN CCOC(=O)c1c(NC(=O)c2ccc(C(C)=O)o2)sc2c1CC(C)(C)NC2(C)C ZINC000447175392 871067948 /nfs/dbraw/zinc/06/79/48/871067948.db2.gz JNPMVOMTMRIWCH-UHFFFAOYSA-N 0 3 418.515 4.132 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)Nc1cnn(-c2ccccc2F)c1 ZINC000447184441 871076209 /nfs/dbraw/zinc/07/62/09/871076209.db2.gz HIHZNRSPWSWQNA-UHFFFAOYSA-N 0 3 415.900 4.261 20 0 HIADHN CCC[C@H](NC(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1)c1ccc(F)cc1F ZINC000468499946 882491397 /nfs/dbraw/zinc/49/13/97/882491397.db2.gz BULPZEUYUDBDGM-YVHKJVDXSA-N 0 3 423.548 4.337 20 0 HIADHN O=C(CCN1CCC(Oc2ncccc2F)CC1)Nc1c(Cl)cccc1Cl ZINC000447362798 871269194 /nfs/dbraw/zinc/26/91/94/871269194.db2.gz HJHLLRLKBKERNO-UHFFFAOYSA-N 0 3 412.292 4.400 20 0 HIADHN COC(=O)c1coc([C@@H](C)NC2CCN(Cc3ccc(Br)cc3)CC2)c1 ZINC000447573125 871473194 /nfs/dbraw/zinc/47/31/94/871473194.db2.gz FYPUEGIISXQMAG-CQSZACIVSA-N 0 3 421.335 4.144 20 0 HIADHN Cc1ccc([C@H](NCCN2CCCC(C)(C)C2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000447574709 871475279 /nfs/dbraw/zinc/47/52/79/871475279.db2.gz WHMPQUKNTLICDD-QHCPKHFHSA-N 0 3 414.615 4.200 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)N1CCC(c2ncc3n2CCCC3)CC1 ZINC000447683791 871616144 /nfs/dbraw/zinc/61/61/44/871616144.db2.gz TZHIRPNHFMAQQL-UHFFFAOYSA-N 0 3 406.530 4.047 20 0 HIADHN C[C@@H](CC1CCOCC1)N[C@H](c1ccc(F)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000468519561 882530915 /nfs/dbraw/zinc/53/09/15/882530915.db2.gz WCILNQZSIUWOFK-KSFYIVLOSA-N 0 3 405.535 4.113 20 0 HIADHN Cc1nc2ccc(Br)cc2c(N2C[C@@H](C)OC3(CCOCC3)C2)c1C ZINC000447816365 871747470 /nfs/dbraw/zinc/74/74/70/871747470.db2.gz KDGBZTCTVWZEDJ-CYBMUJFWSA-N 0 3 405.336 4.388 20 0 HIADHN C[C@H](O)C[C@H]1CCCCN1CC(=O)NC[C@H](c1c[nH]c2ccccc21)c1ccccc1 ZINC000447831078 871759486 /nfs/dbraw/zinc/75/94/86/871759486.db2.gz KGCLCVRPEKVBIE-WPYKKVEZSA-N 0 3 419.569 4.041 20 0 HIADHN O=C1[C@H](N[C@@H](C[C@H]2CCOC2)c2ccccc2)CCN1c1ccc(Cl)c(F)c1 ZINC000447887862 871802110 /nfs/dbraw/zinc/80/21/10/871802110.db2.gz GXUKWWDWEQECNY-LPTQZCDUSA-N 0 3 402.897 4.342 20 0 HIADHN COc1cccc2sc(NC(=O)CN[C@@H](C[C@@H]3CCOC3)c3ccccc3)nc21 ZINC000447889251 871803453 /nfs/dbraw/zinc/80/34/53/871803453.db2.gz GYKDGNBVSGPYFU-RDJZCZTQSA-N 0 3 411.527 4.001 20 0 HIADHN C[C@H]1OCC[C@]1(O)CN(Cc1ccccc1)Cc1ccccc1OCC(F)(F)F ZINC000447929740 871817641 /nfs/dbraw/zinc/81/76/41/871817641.db2.gz UWFFRNREDZFHSN-UTKZUKDTSA-N 0 3 409.448 4.170 20 0 HIADHN CO[C@@H]1CCOc2c(NC(=O)N3CC[C@@H](C)N(Cc4ccccc4)CC3)cccc21 ZINC000448055052 871884974 /nfs/dbraw/zinc/88/49/74/871884974.db2.gz FDFQOANMOGMSDG-XMSQKQJNSA-N 0 3 409.530 4.285 20 0 HIADHN CC[C@H]1C[C@@H](C)CN1CC(=O)N(Cc1nnc(-c2ccccc2Cl)o1)C1CC1 ZINC000448093555 871931914 /nfs/dbraw/zinc/93/19/14/871931914.db2.gz AOHZKOWLNKFRCD-CABCVRRESA-N 0 3 402.926 4.001 20 0 HIADHN C[C@@H](c1cccc(C(F)(F)F)c1)N(C)C(=O)CCN1CCN(c2ccccc2)CC1 ZINC000468554381 882598499 /nfs/dbraw/zinc/59/84/99/882598499.db2.gz NAOBGBZUBVRWTD-SFHVURJKSA-N 0 3 419.491 4.437 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N2CCCC[C@@H]2c2nnc(C3CCC3)o2)C1 ZINC000460114998 872580096 /nfs/dbraw/zinc/58/00/96/872580096.db2.gz LWMYPMQMDQHHFX-DUXKGJEZSA-N 0 3 423.561 4.409 20 0 HIADHN CN1CCC(N(Cc2ccccc2Br)C(=O)NCCC(C)(C)C)CC1 ZINC000460122576 872596590 /nfs/dbraw/zinc/59/65/90/872596590.db2.gz CEVFWFJPSXLDJQ-UHFFFAOYSA-N 0 3 410.400 4.491 20 0 HIADHN CCN(C(=O)Nc1cccc(NC(=O)C2CC2)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000460124002 872599340 /nfs/dbraw/zinc/59/93/40/872599340.db2.gz HRKZGUNJFWALDO-JOCHJYFZSA-N 0 3 406.530 4.163 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)N1CCCC[C@H]1c1nnc(C2CCC2)o1 ZINC000460163062 872707862 /nfs/dbraw/zinc/70/78/62/872707862.db2.gz BEKDXBRYWNFDRH-SFTDATJTSA-N 0 3 423.561 4.411 20 0 HIADHN CCn1c([C@H](C)Oc2ccc3ccccc3c2)nnc1N(C)[C@@H]1CCN(C2CC2)C1 ZINC000460204355 872782845 /nfs/dbraw/zinc/78/28/45/872782845.db2.gz UVNKALPLLHLLCZ-LAUBAEHRSA-N 0 3 405.546 4.264 20 0 HIADHN C[C@@H]1CCC[C@@H]1NC(=O)N(Cc1ccccc1Br)C1CCN(C)CC1 ZINC000460270669 872859577 /nfs/dbraw/zinc/85/95/77/872859577.db2.gz OJDSQARRXRNQRA-BEFAXECRSA-N 0 3 408.384 4.244 20 0 HIADHN Cc1cc(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)nn1-c1c(F)cccc1F ZINC000468589654 882673574 /nfs/dbraw/zinc/67/35/74/882673574.db2.gz XKGVEVVRMCVLRZ-NRFANRHFSA-N 0 3 410.468 4.026 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)c2ccc(-c3ccc(C)c(C)c3)cc2F)CC1 ZINC000503236649 912216240 /nfs/dbraw/zinc/21/62/40/912216240.db2.gz YNFQSDZOKIFXPF-GOSISDBHSA-N 0 3 411.565 4.113 20 0 HIADHN CCOC(=O)c1csc(CCNCc2ccc(Cl)cc2Br)n1 ZINC000468596975 882692555 /nfs/dbraw/zinc/69/25/55/882692555.db2.gz OFKCIRWRZSONKT-UHFFFAOYSA-N 0 3 403.729 4.068 20 0 HIADHN O=C(CC1(N2CCOCC2)CCCC1)NC1(c2cccc(C(F)(F)F)c2)CCC1 ZINC000460529882 873223760 /nfs/dbraw/zinc/22/37/60/873223760.db2.gz UETDXZAKMKCMET-UHFFFAOYSA-N 0 3 410.480 4.236 20 0 HIADHN CC(C)Cn1c(Cc2ccccn2)nnc1N1C[C@H](C)N(Cc2ccccc2)C[C@H]1C ZINC000460604028 873346389 /nfs/dbraw/zinc/34/63/89/873346389.db2.gz TYTWXLGPFZCPRC-LEWJYISDSA-N 0 3 418.589 4.019 20 0 HIADHN C[C@H](Oc1cccc(Br)c1)C(=O)NC[C@H](c1ccccc1)N1CCCC1 ZINC000460804703 873678993 /nfs/dbraw/zinc/67/89/93/873678993.db2.gz JUYLAUDIVZVFQM-OXJNMPFZSA-N 0 3 417.347 4.170 20 0 HIADHN Cc1nc2ccccc2n1CCc1noc([C@H]2CCCN(Cc3cccc(F)c3)C2)n1 ZINC000460828279 873715293 /nfs/dbraw/zinc/71/52/93/873715293.db2.gz MXMAMLFGJRDPTG-IBGZPJMESA-N 0 3 419.504 4.489 20 0 HIADHN C[C@H]1CC[C@H](NC(=O)N(Cc2ccccc2Br)C2CCN(C)CC2)C1 ZINC000460840684 873729556 /nfs/dbraw/zinc/72/95/56/873729556.db2.gz PMCBNXTYCGCKOR-RDJZCZTQSA-N 0 3 408.384 4.244 20 0 HIADHN C[C@H](CNC(=O)c1ccc(Oc2cccc(Cl)c2Cl)nn1)N1CCC(C)CC1 ZINC000460925642 873829888 /nfs/dbraw/zinc/82/98/88/873829888.db2.gz OJVAVBOWZUKOFQ-CQSZACIVSA-N 0 3 423.344 4.426 20 0 HIADHN Cc1noc(-c2ccccc2C(=O)NC[C@@H](c2ccccc2)N2CCC(C)CC2)n1 ZINC000460965044 873861766 /nfs/dbraw/zinc/86/17/66/873861766.db2.gz BMMXYIOVPMEPBQ-QFIPXVFZSA-N 0 3 404.514 4.248 20 0 HIADHN O=C(N[C@@H]1c2ccccc2CC12CCOCC2)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000461035983 873897549 /nfs/dbraw/zinc/89/75/49/873897549.db2.gz DLJKXOXSQTZLSF-ZJSXRUAMSA-N 0 3 422.544 4.248 20 0 HIADHN Cc1cc(Cl)c2c(c1)[C@@H](NCc1ccc(N3CCCS3(=O)=O)cc1)CCCO2 ZINC000461081000 873987052 /nfs/dbraw/zinc/98/70/52/873987052.db2.gz FDSBNLMZRNKLMD-FQEVSTJZSA-N 0 3 420.962 4.192 20 0 HIADHN CC(C)c1cccc2c1OCCC[C@@H]2NCc1ccc(N2CCCS2(=O)=O)cc1 ZINC000461092111 874007137 /nfs/dbraw/zinc/00/71/37/874007137.db2.gz XDMADLSRQUWWGR-QFIPXVFZSA-N 0 3 414.571 4.353 20 0 HIADHN O=S1(=O)CCCN1c1ccc(CN[C@H]2CCc3c2ccc(Cl)c3Cl)cc1 ZINC000461095730 874011137 /nfs/dbraw/zinc/01/11/37/874011137.db2.gz XMOBJGVMVUBQOS-SFHVURJKSA-N 0 3 411.354 4.310 20 0 HIADHN CO[C@]1(CNCc2c(C)nn(-c3ccccc3)c2Oc2cccc(F)c2)CCOC1 ZINC000461407401 874418978 /nfs/dbraw/zinc/41/89/78/874418978.db2.gz OSKQSGUMINHBPN-QHCPKHFHSA-N 0 3 411.477 4.007 20 0 HIADHN CN1CCC(N(Cc2ccccc2Br)C(=O)N[C@@H]2CCC2(C)C)CC1 ZINC000461422882 874452835 /nfs/dbraw/zinc/45/28/35/874452835.db2.gz QLDFQFXDZSUGRY-GOSISDBHSA-N 0 3 408.384 4.244 20 0 HIADHN O=S1(=O)CCCN1c1ccc(CNCc2cccc(OCc3ccccc3)c2)cc1 ZINC000461429997 874469788 /nfs/dbraw/zinc/46/97/88/874469788.db2.gz KHDBUXKSEURLHS-UHFFFAOYSA-N 0 3 422.550 4.095 20 0 HIADHN Cc1ccc(C(=O)CCCC(=O)N2C[C@H]3CCN(Cc4ccccc4)C[C@H]3C2)cc1 ZINC000461446087 874502254 /nfs/dbraw/zinc/50/22/54/874502254.db2.gz OGMYCVIDDDQVJC-RPWUZVMVSA-N 0 3 404.554 4.329 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(F)cc2)CC1)c1cc(Cl)ccc1Cl ZINC000461449355 874507638 /nfs/dbraw/zinc/50/76/38/874507638.db2.gz SMLAJZSIGZDGPU-UHFFFAOYSA-N 0 3 411.304 4.406 20 0 HIADHN C[C@H](NC(=O)NCC1(c2cc(C(F)(F)F)ccc2Cl)CC1)C1=CCN(C)CC1 ZINC000468742091 882837817 /nfs/dbraw/zinc/83/78/17/882837817.db2.gz FLOPYJAWJUQFTR-ZDUSSCGKSA-N 0 3 415.887 4.340 20 0 HIADHN C[C@@H](NC(=O)N(C)C[C@H](C)Oc1ccc(Cl)c(Cl)c1)C1=CCN(C)CC1 ZINC000468746550 882840722 /nfs/dbraw/zinc/84/07/22/882840722.db2.gz ZDAHDUFKQNLMJG-UONOGXRCSA-N 0 3 400.350 4.053 20 0 HIADHN CCCN(CCN1CCN(CC)CC1)C(=O)N[C@H](C)c1ccc(F)c2ccccc21 ZINC000461510146 874587443 /nfs/dbraw/zinc/58/74/43/874587443.db2.gz AAHLJSPMQBCPCF-LJQANCHMSA-N 0 3 414.569 4.099 20 0 HIADHN O=C1[C@H](NCc2cccc(Br)c2)CCCN1Cc1ccc(F)cc1F ZINC000468758706 882846019 /nfs/dbraw/zinc/84/60/19/882846019.db2.gz AHAOVGOELBDJSP-GOSISDBHSA-N 0 3 409.274 4.008 20 0 HIADHN CCN1C[C@H](C)N(c2nnc(-c3cccc4ccccc43)n2C[C@H]2CCOC2)C[C@H]1C ZINC000461704896 874854282 /nfs/dbraw/zinc/85/42/82/874854282.db2.gz RRTXQOAOHRCUGH-HSALFYBXSA-N 0 3 419.573 4.054 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)N(CCc1ccccc1)Cc1cccnc1 ZINC000461713113 874862404 /nfs/dbraw/zinc/86/24/04/874862404.db2.gz BVNPYMLSNXVXJW-JOCHJYFZSA-N 0 3 416.569 4.356 20 0 HIADHN C[C@@H](CC(=O)N(C)C1CCN(CCc2ccccn2)CC1)c1c[nH]c2ccccc21 ZINC000468811391 882871015 /nfs/dbraw/zinc/87/10/15/882871015.db2.gz CJCUASZMBWKLQM-IBGZPJMESA-N 0 3 404.558 4.222 20 0 HIADHN CN(C)Cc1ccccc1CNC(=O)c1cc(-c2ccccc2C(F)(F)F)on1 ZINC000461749124 874889678 /nfs/dbraw/zinc/88/96/78/874889678.db2.gz SLDBIKUMIPXJIP-UHFFFAOYSA-N 0 3 403.404 4.352 20 0 HIADHN C[C@@H](NC(=O)N(CCN(C)C)Cc1ccco1)c1ccc(Br)cc1F ZINC000461804462 874916908 /nfs/dbraw/zinc/91/69/08/874916908.db2.gz WROBFUUEHNBFMU-CYBMUJFWSA-N 0 3 412.303 4.016 20 0 HIADHN Cc1c([C@@H](C)N[C@@H](C)c2cc(F)ccc2N2CCN(C)CC2)cnn1C(C)(C)C ZINC000468834097 882882450 /nfs/dbraw/zinc/88/24/50/882882450.db2.gz FVZXNUXIINEJGY-DLBZAZTESA-N 0 3 401.574 4.249 20 0 HIADHN Cc1c([C@H](C)NC[C@H](O)COc2cccc(Cl)c2Cl)cnn1C(C)(C)C ZINC000468847196 882887908 /nfs/dbraw/zinc/88/79/08/882887908.db2.gz GBTBZLSPNZWHCN-JSGCOSHPSA-N 0 3 400.350 4.344 20 0 HIADHN Cc1c(Cl)cccc1NC(=O)CCNC(=O)c1oc2ccccc2c1CN(C)C ZINC000461990557 875111395 /nfs/dbraw/zinc/11/13/95/875111395.db2.gz PBFJRQCWLNITNT-UHFFFAOYSA-N 0 3 413.905 4.215 20 0 HIADHN Cc1ccc([C@H](CNC(=O)NCc2ncc(-c3ccccc3)cn2)N2CCCC2)cc1 ZINC000462000327 875122069 /nfs/dbraw/zinc/12/20/69/875122069.db2.gz AHDXKFDMRLYRNC-QHCPKHFHSA-N 0 3 415.541 4.088 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)Nc3ccccc3N3CCCCC3)CC2)c1 ZINC000462046096 875158013 /nfs/dbraw/zinc/15/80/13/875158013.db2.gz RUJGDSQHVZFTFJ-UHFFFAOYSA-N 0 3 406.574 4.136 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)N(C)Cc1nccn1Cc1ccccc1 ZINC000468875788 882908613 /nfs/dbraw/zinc/90/86/13/882908613.db2.gz IGBGOEDQLDZYNG-UHFFFAOYSA-N 0 3 402.498 4.011 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)C1(c2ccccc2Cl)CCOCC1 ZINC000462174298 875272286 /nfs/dbraw/zinc/27/22/86/875272286.db2.gz GKTLBSSMOIGUPP-PGRDOPGGSA-N 0 3 412.961 4.025 20 0 HIADHN CC(C)C(=O)Nc1ccc(Cl)c(C(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)c1 ZINC000462181398 875280026 /nfs/dbraw/zinc/28/00/26/875280026.db2.gz KQQJPYAAVSDZRJ-KKSFZXQISA-N 0 3 413.949 4.185 20 0 HIADHN COc1ccc(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)cc1-c1ccccn1 ZINC000462190835 875295996 /nfs/dbraw/zinc/29/59/96/875295996.db2.gz OXHOIGRTZRJSOE-FDDCHVKYSA-N 0 3 401.510 4.008 20 0 HIADHN Cc1noc(C)c1COc1cccc(C(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)c1 ZINC000462194996 875302518 /nfs/dbraw/zinc/30/25/18/875302518.db2.gz YFXKTFYWFVGQHH-XDHUDOTRSA-N 0 3 419.525 4.121 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)NCc1csc(-c2ccccc2)n1 ZINC000462212658 875319756 /nfs/dbraw/zinc/31/97/56/875319756.db2.gz VFIVTNBDPDYLDT-LAUBAEHRSA-N 0 3 406.555 4.130 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)NC[C@H](Cc1ccccc1)C(F)(F)F ZINC000462223811 875334016 /nfs/dbraw/zinc/33/40/16/875334016.db2.gz QMUAIWYAZFVSEM-FQEVSTJZSA-N 0 3 407.480 4.181 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3cccc(OCC(F)(F)F)c3C)cc2)CC1 ZINC000468882067 882919557 /nfs/dbraw/zinc/91/95/57/882919557.db2.gz GYYDPCGBZJMTAW-UHFFFAOYSA-N 0 3 421.463 4.330 20 0 HIADHN CN(C)C[C@@H](NC(=O)NC[C@H](Cc1ccccc1)C(F)(F)F)c1ccc(F)cc1 ZINC000462236961 875350575 /nfs/dbraw/zinc/35/05/75/875350575.db2.gz RTCHZZVBJBDNOL-PKOBYXMFSA-N 0 3 411.443 4.149 20 0 HIADHN CCN(C(=O)c1ccc(COCCOC)cc1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000462242597 875358606 /nfs/dbraw/zinc/35/86/06/875358606.db2.gz BPUCERUFKGJDOB-YKSBVNFPSA-N 0 3 410.558 4.147 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1NC(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C ZINC000462252281 875373523 /nfs/dbraw/zinc/37/35/23/875373523.db2.gz BCRSYCYOEJMETH-HTAPYJJXSA-N 0 3 403.530 4.131 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Nc1cccc(OCc2cscn2)c1 ZINC000462252252 875373858 /nfs/dbraw/zinc/37/38/58/875373858.db2.gz ATJSGUUUKSMMMG-HTAPYJJXSA-N 0 3 422.554 4.364 20 0 HIADHN CCC(=O)Nc1ccc(Cl)c(NC(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)c1 ZINC000462254351 875377268 /nfs/dbraw/zinc/37/72/68/875377268.db2.gz JBVVRDHDIQQWCF-YWZLYKJASA-N 0 3 414.937 4.331 20 0 HIADHN CC(C)[C@@H](Oc1ccc(Cl)cc1)C(=O)NC1CCN([C@@H](C)c2ccncc2)CC1 ZINC000462256919 875380430 /nfs/dbraw/zinc/38/04/30/875380430.db2.gz UTRVDGNUKLUBLP-HTAPYJJXSA-N 0 3 415.965 4.480 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)Nc1ccc(C(=O)NC2CCCC2)cc1 ZINC000462263228 875388290 /nfs/dbraw/zinc/38/82/90/875388290.db2.gz NUUCDCYMSHMRIB-JPYJTQIMSA-N 0 3 420.557 4.001 20 0 HIADHN Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C ZINC000462264655 875390115 /nfs/dbraw/zinc/39/01/15/875390115.db2.gz ZGGMIFCIOGHACH-XXBNENTESA-N 0 3 422.573 4.023 20 0 HIADHN Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C ZINC000462264653 875390901 /nfs/dbraw/zinc/39/09/01/875390901.db2.gz ZGGMIFCIOGHACH-CVDCTZTESA-N 0 3 422.573 4.023 20 0 HIADHN CC(C)n1cnnc1-c1ccccc1NC(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C ZINC000462266579 875392539 /nfs/dbraw/zinc/39/25/39/875392539.db2.gz FWURUVDWGDMFNQ-GCJKJVERSA-N 0 3 418.545 4.168 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)Nc1cccc(-c2noc(C3CC3)n2)c1 ZINC000462271394 875399338 /nfs/dbraw/zinc/39/93/38/875399338.db2.gz SZITTYNDIGAJKI-KKSFZXQISA-N 0 3 417.513 4.256 20 0 HIADHN Cc1cc(S(=O)(=O)N(C)[C@H]2CCN(Cc3ccccc3)[C@@H](C)C2)cc(C)c1F ZINC000462339477 875454017 /nfs/dbraw/zinc/45/40/17/875454017.db2.gz IAMXRZUQTMZOBX-ICSRJNTNSA-N 0 3 404.551 4.116 20 0 HIADHN CCOC(=O)C1CCN(C(=O)[C@H](C)N[C@@H](C)c2ccc(Cl)c3ccccc32)CC1 ZINC000462358419 875472130 /nfs/dbraw/zinc/47/21/30/875472130.db2.gz OZBMTCPDRQRIPL-HOTGVXAUSA-N 0 3 416.949 4.334 20 0 HIADHN CCN(CC)[C@@H](CNc1ncccc1C(=O)N1CCc2ccccc21)c1ccco1 ZINC000462379831 875491550 /nfs/dbraw/zinc/49/15/50/875491550.db2.gz YUSCSZIMDILUCR-NRFANRHFSA-N 0 3 404.514 4.373 20 0 HIADHN COc1ccc(CNC(=O)CN[C@@H](C)c2ccc(Cl)c3ccccc32)cc1OC ZINC000462455328 875561853 /nfs/dbraw/zinc/56/18/53/875561853.db2.gz NGWYHEMXAKZEOQ-HNNXBMFYSA-N 0 3 412.917 4.477 20 0 HIADHN COC(=O)[C@](C)(CN[C@H](C)C(=O)Nc1cccc(Cl)c1Cl)c1ccccc1 ZINC000468899140 882950022 /nfs/dbraw/zinc/95/00/22/882950022.db2.gz HXXRJIVQYZTUTQ-ZUOKHONESA-N 0 3 409.313 4.041 20 0 HIADHN COc1ccc([C@H](CNC(=O)N[C@@H]2CCO[C@H](c3ccccc3)C2)N2CCCC2)cc1 ZINC000462523170 875640497 /nfs/dbraw/zinc/64/04/97/875640497.db2.gz SBNZCFPUYWEACZ-NHTMILBNSA-N 0 3 423.557 4.052 20 0 HIADHN CC(C)(C)c1ccccc1S(=O)(=O)N1CCC(N2CCc3ccccc3C2)CC1 ZINC000462528783 875647120 /nfs/dbraw/zinc/64/71/20/875647120.db2.gz OUXOAGWOPJHTJR-UHFFFAOYSA-N 0 3 412.599 4.196 20 0 HIADHN Fc1ccc(-c2nnc3n2C[C@@H](NCc2sccc2Br)CC3)cc1 ZINC000462533152 875651694 /nfs/dbraw/zinc/65/16/94/875651694.db2.gz HGMYPVJWUVWKLO-ZDUSSCGKSA-N 0 3 407.312 4.013 20 0 HIADHN CC(C)(C)c1nc2ccc(S(=O)(=O)NC3CCN(C(C)(C)C)CC3)cc2s1 ZINC000462549154 875673945 /nfs/dbraw/zinc/67/39/45/875673945.db2.gz JWWZJMMVCJVUKF-UHFFFAOYSA-N 0 3 409.621 4.135 20 0 HIADHN Cc1ccnc(-c2ccc(NC(=O)N[C@@H]3CN(Cc4ccccc4)C[C@@H]3C)cc2)n1 ZINC000462556944 875682473 /nfs/dbraw/zinc/68/24/73/875682473.db2.gz GJEHTSBRQNLCJB-HTAPYJJXSA-N 0 3 401.514 4.094 20 0 HIADHN Cc1ccnc(-c2ccc(NC(=O)N[C@H]3CN(Cc4ccccc4)C[C@H]3C)cc2)n1 ZINC000462556947 875682760 /nfs/dbraw/zinc/68/27/60/875682760.db2.gz GJEHTSBRQNLCJB-VGSWGCGISA-N 0 3 401.514 4.094 20 0 HIADHN CC(=O)N(Cc1ccc(NC(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)cc1)C(C)C ZINC000462561406 875688399 /nfs/dbraw/zinc/68/83/99/875688399.db2.gz USCYYXRPCDSSHQ-CYFREDJKSA-N 0 3 422.573 4.086 20 0 HIADHN COc1cccc(Oc2ccc(CN[C@H](C)Cn3cc(Br)cn3)cn2)c1 ZINC000468899873 882950213 /nfs/dbraw/zinc/95/02/13/882950213.db2.gz IFBZPZJHAGQQCH-CQSZACIVSA-N 0 3 417.307 4.020 20 0 HIADHN O=C(Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)c1cc(Cl)cc2c1OCC2 ZINC000462616781 875728021 /nfs/dbraw/zinc/72/80/21/875728021.db2.gz JJMJFKUZSFMHMA-IBGZPJMESA-N 0 3 422.916 4.171 20 0 HIADHN COc1cccc(Cl)c1CC(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000462624749 875736995 /nfs/dbraw/zinc/73/69/95/875736995.db2.gz URVZYLCEFWSKCR-GOSISDBHSA-N 0 3 424.932 4.173 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)Nc1ccccc1CC(=O)OC(C)(C)C ZINC000462665220 875766238 /nfs/dbraw/zinc/76/62/38/875766238.db2.gz VZEMCAGMPVHDQA-AVRDEDQJSA-N 0 3 423.557 4.213 20 0 HIADHN CN(C)CCN(C[C@H]1CCCO1)C(=O)c1ccc(Oc2ccc(Cl)cc2)c(F)c1 ZINC000468909134 882964166 /nfs/dbraw/zinc/96/41/66/882964166.db2.gz KQKDXHJCZRPBPI-LJQANCHMSA-N 0 3 420.912 4.454 20 0 HIADHN Cc1cc(CN[C@@H]2CC(=O)N([C@H]3C[C@@H]3c3ccccc3)C2)ccc1Oc1cccnc1 ZINC000462744386 875814370 /nfs/dbraw/zinc/81/43/70/875814370.db2.gz GHXGUOVDBLJRFI-JRFVFWCSSA-N 0 3 413.521 4.429 20 0 HIADHN COc1cccc(N2C[C@H](NCc3ccc(-c4ccccc4OC)cc3)CC2=O)c1 ZINC000462769059 875828593 /nfs/dbraw/zinc/82/85/93/875828593.db2.gz QREIXCFMRRFOGR-HXUWFJFHSA-N 0 3 402.494 4.266 20 0 HIADHN C[C@H]1CCCN(C(=O)C2CCN(Cc3ccc(C(=O)OC(C)(C)C)cc3)CC2)C1 ZINC000462795582 875844799 /nfs/dbraw/zinc/84/47/99/875844799.db2.gz CUNXEKCHIKGYSO-SFHVURJKSA-N 0 3 400.563 4.112 20 0 HIADHN CC[C@H](NCc1cccc(N2CCCS2(=O)=O)c1)c1ccc(OC(F)F)cc1 ZINC000462833024 875868968 /nfs/dbraw/zinc/86/89/68/875868968.db2.gz KQXFUGZCXPLRQR-IBGZPJMESA-N 0 3 410.486 4.069 20 0 HIADHN COc1ccc([C@@H](C)NCc2cccc(N3CCCS3(=O)=O)c2)c2ccccc12 ZINC000462842191 875878072 /nfs/dbraw/zinc/87/80/72/875878072.db2.gz XAJIMTXNJWSBNX-QGZVFWFLSA-N 0 3 410.539 4.239 20 0 HIADHN C[C@H](NCc1ccccc1OCCN1CCOCC1)c1ccc(OC(C)(C)C)cc1 ZINC000463006507 876022210 /nfs/dbraw/zinc/02/22/10/876022210.db2.gz DXXMKVGYYDVUEW-FQEVSTJZSA-N 0 3 412.574 4.426 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N[C@@H](c1cccc(F)c1)c1ccccn1 ZINC000463014476 876030965 /nfs/dbraw/zinc/03/09/65/876030965.db2.gz WKFHBYZDLDMKCQ-DKLXNKCPSA-N 0 3 418.516 4.130 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N[C@H](c1cccc(F)c1)c1ccccn1 ZINC000463014477 876031595 /nfs/dbraw/zinc/03/15/95/876031595.db2.gz WKFHBYZDLDMKCQ-DQMJNTIXSA-N 0 3 418.516 4.130 20 0 HIADHN OC[C@]1(Cc2ccccc2)CCCN(Cc2ccccc2OCc2cccnc2)C1 ZINC000463029626 876049871 /nfs/dbraw/zinc/04/98/71/876049871.db2.gz AOXROKJHECFWIC-SANMLTNESA-N 0 3 402.538 4.478 20 0 HIADHN COc1cc(CN[C@@H](C)c2ccc(OC(C)(C)C)cc2)ccc1OCC(=O)N(C)C ZINC000463031052 876050484 /nfs/dbraw/zinc/05/04/84/876050484.db2.gz URQGDVRQBWLWDM-KRWDZBQOSA-N 0 3 414.546 4.190 20 0 HIADHN CCOc1cc(CN2CCC(C)(OC)CC2)ccc1OCc1ccc(C(=O)OC)o1 ZINC000463032729 876052502 /nfs/dbraw/zinc/05/25/02/876052502.db2.gz JMMQZHLHVPBSJR-UHFFFAOYSA-N 0 3 417.502 4.045 20 0 HIADHN CCOC(=O)c1nn(-c2ccccc2)cc1CN[C@H]1CCO[C@@H](c2ccccc2)C1 ZINC000463056923 876084726 /nfs/dbraw/zinc/08/47/26/876084726.db2.gz NUJYTSBSNCHBIP-RBBKRZOGSA-N 0 3 405.498 4.059 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)c3ccc(OC4CCC4)cc3)CC2)c1 ZINC000463099921 876134653 /nfs/dbraw/zinc/13/46/53/876134653.db2.gz STQCCYYQNIBSGA-UHFFFAOYSA-N 0 3 421.585 4.259 20 0 HIADHN CC[C@H](O[C@@H]1CCC[C@H](C)C1)C(=O)Nc1ccc(CN2CCN(CC)CC2)cc1 ZINC000463106802 876145119 /nfs/dbraw/zinc/14/51/19/876145119.db2.gz BDUFKUDOBLVEBF-PMOQBDJRSA-N 0 3 401.595 4.137 20 0 HIADHN C[C@@H](C(=O)NCC1(N2CCSCC2)CCCC1)c1ccc(Br)s1 ZINC000463109527 876148178 /nfs/dbraw/zinc/14/81/78/876148178.db2.gz SEEAQDNUIDYXJM-CYBMUJFWSA-N 0 3 417.438 4.092 20 0 HIADHN Cn1ccnc1[C@H](NC1CCN(CCC(F)(F)F)CC1)c1ccc(Cl)cc1 ZINC000463138172 876188808 /nfs/dbraw/zinc/18/88/08/876188808.db2.gz VXUGKTIJIFNSDJ-QGZVFWFLSA-N 0 3 400.876 4.169 20 0 HIADHN Cc1ccc(CN[C@@H](C)c2ccc(NC(=O)NC3CC3)cc2)c(-n2cc(Cl)cn2)n1 ZINC000468940780 883005697 /nfs/dbraw/zinc/00/56/97/883005697.db2.gz MFXWLOUVEKMWSF-HNNXBMFYSA-N 0 3 424.936 4.364 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@H](C)NCc2cncc(C(F)(F)F)c2)CC1 ZINC000463154482 876207862 /nfs/dbraw/zinc/20/78/62/876207862.db2.gz DZQDZVRBAXSRBI-HNNXBMFYSA-N 0 3 410.459 4.232 20 0 HIADHN COc1cccc([C@H](CNC(=O)NCc2ccc(C(F)F)cc2)N2CCCC2)c1 ZINC000463155569 876208284 /nfs/dbraw/zinc/20/82/84/876208284.db2.gz OFCBKNZHAXAKFD-FQEVSTJZSA-N 0 3 403.473 4.269 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@@H](C)NCc2cncc(C(F)(F)F)c2)CC1 ZINC000463154483 876208492 /nfs/dbraw/zinc/20/84/92/876208492.db2.gz DZQDZVRBAXSRBI-OAHLLOKOSA-N 0 3 410.459 4.232 20 0 HIADHN CN(C)[C@@H]1Cc2ccccc2N(C(=O)c2ccc(Sc3ccccc3Cl)nn2)C1 ZINC000468944344 883009835 /nfs/dbraw/zinc/00/98/35/883009835.db2.gz LILQDJWTPSYKQG-MRXNPFEDSA-N 0 3 424.957 4.414 20 0 HIADHN O=C(CN1CCCC[C@@H]1[C@@H]1CCCC[C@@H]1O)NCc1ccccc1OC1CCCC1 ZINC000463201621 876262715 /nfs/dbraw/zinc/26/27/15/876262715.db2.gz MGKQOLYYBRIDEG-ZRBLBEILSA-N 0 3 414.590 4.030 20 0 HIADHN COC(=O)c1ccc(-c2nc(CN3CCCC[C@@H]3[C@@H]3C[C@@H](C)CC[C@H]3O)co2)cc1 ZINC000463208410 876268113 /nfs/dbraw/zinc/26/81/13/876268113.db2.gz XMPUXGVTHNZLAY-FBEWHJACSA-N 0 3 412.530 4.280 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)N[C@@H]2CCO[C@@H](c3ccccc3)C2)CC1 ZINC000463256823 876313850 /nfs/dbraw/zinc/31/38/50/876313850.db2.gz GDXAAAZEHSGDDR-ISKFKSNPSA-N 0 3 407.558 4.213 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N[C@H]1CCCc2cn(C3CCCC3)nc21 ZINC000463280942 876338354 /nfs/dbraw/zinc/33/83/54/876338354.db2.gz UMGJFPMBDVCZAZ-LEOXJPRUSA-N 0 3 421.589 4.195 20 0 HIADHN COC(=O)CCCN1CCC(Nc2cc(Br)ccc2OC(C)C)CC1 ZINC000463287972 876347805 /nfs/dbraw/zinc/34/78/05/876347805.db2.gz OLGQYHGPCFBHLD-UHFFFAOYSA-N 0 3 413.356 4.066 20 0 HIADHN CCCOc1ccc(CCC(=O)Nc2ccc(N3CCN(CC)CC3)cc2C)cc1 ZINC000463318279 876375697 /nfs/dbraw/zinc/37/56/97/876375697.db2.gz GCZUIRDNRQINKO-UHFFFAOYSA-N 0 3 409.574 4.497 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)[C@H]1SCCc2sccc21)c1cccc(OC)c1 ZINC000463341137 876397483 /nfs/dbraw/zinc/39/74/83/876397483.db2.gz ULBOHOQZMSWFHN-ICSRJNTNSA-N 0 3 404.601 4.286 20 0 HIADHN C[C@@H]1CCCCN1CCNC(=O)c1ccc(-c2noc(-c3ccc(F)cc3)n2)cc1 ZINC000463373309 876428540 /nfs/dbraw/zinc/42/85/40/876428540.db2.gz CKBMCAZJBXUUDP-MRXNPFEDSA-N 0 3 408.477 4.147 20 0 HIADHN CN(CCc1cccc(Br)c1)C(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000463401315 876456443 /nfs/dbraw/zinc/45/64/43/876456443.db2.gz CESRLUUZLQHXEY-UXHICEINSA-N 0 3 416.363 4.078 20 0 HIADHN Cc1cc(OC[C@@H](O)CN2CC[C@](CO)(c3ccccc3)C2)c(C(C)C)cc1Cl ZINC000463440518 876497502 /nfs/dbraw/zinc/49/75/02/876497502.db2.gz FUCDQSDSPDYSPO-RDPSFJRHSA-N 0 3 417.977 4.148 20 0 HIADHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)c1cccc2cc[nH]c21 ZINC000463529364 876602994 /nfs/dbraw/zinc/60/29/94/876602994.db2.gz YGDCEGGXMIATAJ-UHFFFAOYSA-N 0 3 400.320 4.134 20 0 HIADHN Cc1nn(C)c(Sc2ccccc2)c1C(=O)N[C@H]1C[C@@H](C)N(Cc2ccccc2)C1 ZINC000463576606 876674369 /nfs/dbraw/zinc/67/43/69/876674369.db2.gz ODMJIGUJEGOOSH-XLIONFOSSA-N 0 3 420.582 4.273 20 0 HIADHN CCOC(=O)c1csc(CCN[C@H](C)c2ccc(Br)cc2F)n1 ZINC000468985023 883052590 /nfs/dbraw/zinc/05/25/90/883052590.db2.gz PUKRXCHHRDCHPP-SNVBAGLBSA-N 0 3 401.301 4.115 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)[C@H]3C[C@H]3c3cc(F)c(F)c(F)c3)c2)CC1 ZINC000463595195 876706403 /nfs/dbraw/zinc/70/64/03/876706403.db2.gz LEVRZQKEILZTKP-OALUTQOASA-N 0 3 417.475 4.377 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N(C)[C@H]3CCCC[C@H]3C(F)(F)F)c2)CC1 ZINC000463673770 876797303 /nfs/dbraw/zinc/79/73/03/876797303.db2.gz RUXUICDDBPFLNT-MOPGFXCFSA-N 0 3 412.500 4.413 20 0 HIADHN CN(C)C[C@@H](NC(=O)Nc1cccc(-c2ncc3n2CCCC3)c1)c1ccc(F)cc1 ZINC000463708943 876828305 /nfs/dbraw/zinc/82/83/05/876828305.db2.gz CPURCDKWSAMITK-JOCHJYFZSA-N 0 3 421.520 4.450 20 0 HIADHN COc1ccc(Cn2nc(C)c(CNCc3ccccc3Cn3cccn3)c2C)cc1 ZINC000463740357 876860944 /nfs/dbraw/zinc/86/09/44/876860944.db2.gz CBIFJMXUPKKIEY-UHFFFAOYSA-N 0 3 415.541 4.091 20 0 HIADHN CN(C)[C@H]1Cc2ccccc2N(C(=O)c2cc3cc(C(F)(F)F)ccc3n2C)C1 ZINC000463745302 876867988 /nfs/dbraw/zinc/86/79/88/876867988.db2.gz KSDUFPVVNMZHAN-KRWDZBQOSA-N 0 3 401.432 4.330 20 0 HIADHN COc1ccc(Cn2nc(C)c(CNC[C@H](c3ccco3)N3CCCC3)c2C)cc1 ZINC000463745738 876868001 /nfs/dbraw/zinc/86/80/01/876868001.db2.gz OCTPHSBTESKTKG-HSZRJFAPSA-N 0 3 408.546 4.077 20 0 HIADHN CCOC(=O)c1ccc(C(=O)N(c2cccc(SC)c2)C2CCN(C)CC2)cc1 ZINC000463806913 876923337 /nfs/dbraw/zinc/92/33/37/876923337.db2.gz FSEOAIQEOMNHSK-UHFFFAOYSA-N 0 3 412.555 4.326 20 0 HIADHN Cc1cc2cc(C(=O)Nc3ccc(C(=O)NCCN4CCCC4)cc3)oc2cc1C ZINC000463834577 876953152 /nfs/dbraw/zinc/95/31/52/876953152.db2.gz FMOIWWYQWFEMMI-UHFFFAOYSA-N 0 3 405.498 4.128 20 0 HIADHN COc1c(Br)c(C)sc1C(=O)NC[C@@H](C)N(C)Cc1ccccc1 ZINC000463843556 876965750 /nfs/dbraw/zinc/96/57/50/876965750.db2.gz FKGGPXMJSHOFFN-GFCCVEGCSA-N 0 3 411.365 4.078 20 0 HIADHN Cn1ccc(N2CCC[C@H](N[C@H](Cc3ccc(Cl)cc3)c3ccccc3)C2=O)n1 ZINC000463895870 877017791 /nfs/dbraw/zinc/01/77/91/877017791.db2.gz LCOLRRPYORQQIC-LEWJYISDSA-N 0 3 408.933 4.143 20 0 HIADHN O=C(CCN1CCN(c2ccccc2)CC1)N1CCc2c(Cl)c(Cl)ccc2C1 ZINC000469020334 883087400 /nfs/dbraw/zinc/08/74/00/883087400.db2.gz PXKXJNFVPHJRBW-UHFFFAOYSA-N 0 3 418.368 4.090 20 0 HIADHN C[C@@H](CNC(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1)Oc1ccccc1F ZINC000463929487 877049408 /nfs/dbraw/zinc/04/94/08/877049408.db2.gz VUKGLXMXADUKSK-KKSFZXQISA-N 0 3 424.438 4.164 20 0 HIADHN Cc1cc2cc(C(=O)Nc3ccc(C(=O)N(C)[C@H]4CCCN(C)C4)cc3)oc2cc1C ZINC000464010420 877144729 /nfs/dbraw/zinc/14/47/29/877144729.db2.gz DWXKJDRPZRFODH-NRFANRHFSA-N 0 3 419.525 4.468 20 0 HIADHN CN(C(=O)NCC1(N2CCSCC2)CCCC1)[C@H]1CCCC[C@H]1C(F)(F)F ZINC000464029136 877165240 /nfs/dbraw/zinc/16/52/40/877165240.db2.gz LQIXDTLSWPSSIC-CVEARBPZSA-N 0 3 407.546 4.111 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1ccc2c(c1)nn(C)c2C)c1cccc(OC)c1 ZINC000464062126 877207800 /nfs/dbraw/zinc/20/78/00/877207800.db2.gz ALFIPXWYPKKIGP-QFIPXVFZSA-N 0 3 409.534 4.095 20 0 HIADHN Cc1nn(C(C)(C)C)cc1[C@H](C)NC(=O)NC[C@H](c1ccc(C)cc1)N1CCCC1 ZINC000464126214 877282022 /nfs/dbraw/zinc/28/20/22/877282022.db2.gz OLUGWTMBBUPRJH-PGRDOPGGSA-N 0 3 411.594 4.452 20 0 HIADHN CCOc1cc2c(cc1[C@@H]1C[C@H]1C(=O)N(CC(C)C)C1CCN(C)CC1)O[C@@H](C)C2 ZINC000503239905 912218182 /nfs/dbraw/zinc/21/81/82/912218182.db2.gz LIYYZDIOSIWMDG-RBDMOPTHSA-N 0 3 414.590 4.091 20 0 HIADHN CCOc1cc2c(cc1[C@@H]1C[C@@H]1C(=O)N(CC(C)C)C1CCN(C)CC1)O[C@H](C)C2 ZINC000503239903 912219067 /nfs/dbraw/zinc/21/90/67/912219067.db2.gz LIYYZDIOSIWMDG-AGHHOFFYSA-N 0 3 414.590 4.091 20 0 HIADHN CC(C)c1noc2nc(C3CC3)cc(C(=O)N(CCN(C)C)Cc3cccs3)c21 ZINC000464261002 877440986 /nfs/dbraw/zinc/44/09/86/877440986.db2.gz ABPPJNLSMQOAMO-UHFFFAOYSA-N 0 3 412.559 4.489 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)NCc2cccc(-c3cccnc3)c2)C1 ZINC000464351346 877543899 /nfs/dbraw/zinc/54/38/99/877543899.db2.gz GSPMLYLQKNFIGF-YADARESESA-N 0 3 400.526 4.383 20 0 HIADHN Cc1nc(C(=O)N2C[C@@H]3CCCN3Cc3ccccc32)nn1-c1ccccc1C(C)C ZINC000503285830 912266768 /nfs/dbraw/zinc/26/67/68/912266768.db2.gz SWFWVGOAKKOEJY-FQEVSTJZSA-N 0 3 415.541 4.324 20 0 HIADHN COc1ccccc1S(=O)(=O)CCCN[C@@H](C)c1ccc(OC(F)(F)F)cc1 ZINC000464492414 877710516 /nfs/dbraw/zinc/71/05/16/877710516.db2.gz CTUWPKFIGRPHLY-AWEZNQCLSA-N 0 3 417.449 4.108 20 0 HIADHN C[C@H]1CCCN(c2cc(C(=O)N(Cc3ccccc3)C3CCN(C)CC3)ccn2)C1 ZINC000464502330 877726451 /nfs/dbraw/zinc/72/64/51/877726451.db2.gz OMJZHWDGTXYOTN-FQEVSTJZSA-N 0 3 406.574 4.055 20 0 HIADHN CN(C(=O)N[C@@H]1CCOc2c(F)ccc(F)c21)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000464506251 877730617 /nfs/dbraw/zinc/73/06/17/877730617.db2.gz IAYJMXPVUMFYQM-YLJYHZDGSA-N 0 3 415.484 4.094 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)N[C@@H]2CCOc3c(F)ccc(F)c32)CC1 ZINC000464507060 877730690 /nfs/dbraw/zinc/73/06/90/877730690.db2.gz NEFUNWZPWOLEJQ-HXUWFJFHSA-N 0 3 415.484 4.094 20 0 HIADHN CCCN(CCc1cccs1)CC(=O)N1CCC[C@@H]1c1ccc2c(c1)OCCO2 ZINC000464580647 877804194 /nfs/dbraw/zinc/80/41/94/877804194.db2.gz BDFVJXKXKDMUDA-HXUWFJFHSA-N 0 3 414.571 4.138 20 0 HIADHN COC(=O)c1ccc(F)c(CN(CCCOc2ccccc2)C2CCOCC2)c1 ZINC000464591325 877816637 /nfs/dbraw/zinc/81/66/37/877816637.db2.gz DSXHZFFDWFGCDX-UHFFFAOYSA-N 0 3 401.478 4.062 20 0 HIADHN Cc1cccc(S(=O)(=O)CCCN(C)[C@@H]2CCN(Cc3ccccc3)[C@@H](C)C2)c1 ZINC000464680403 877896231 /nfs/dbraw/zinc/89/62/31/877896231.db2.gz ZKZDUYMAONFDBC-JTHBVZDNSA-N 0 3 414.615 4.144 20 0 HIADHN COCCCN(C(=O)c1ccc(Oc2ccncc2)c(Cl)c1)C1CCN(C)CC1 ZINC000464721441 877948991 /nfs/dbraw/zinc/94/89/91/877948991.db2.gz XGARKGQPOQCLBN-UHFFFAOYSA-N 0 3 417.937 4.100 20 0 HIADHN CN(Cc1ccc(OC(F)F)cc1)C(=O)CN1CC[C@H](CSc2ccccc2)C1 ZINC000464761898 878004765 /nfs/dbraw/zinc/00/47/65/878004765.db2.gz RIRQDMQYPYIWOE-SFHVURJKSA-N 0 3 420.525 4.361 20 0 HIADHN COc1cc2c(cc1OC)CN(C(=O)CN1CCCC3(C1)CCCCCC3)CC2 ZINC000464764601 878008224 /nfs/dbraw/zinc/00/82/24/878008224.db2.gz HRDJUGRYWJGDEN-UHFFFAOYSA-N 0 3 400.563 4.025 20 0 HIADHN COc1cc(C(C)=O)ccc1OC[C@H](O)CN1CCCC[C@@H]1c1cccc(C)c1C ZINC000464778466 878021100 /nfs/dbraw/zinc/02/11/00/878021100.db2.gz ONIMNPGIJORISW-FYYLOGMGSA-N 0 3 411.542 4.482 20 0 HIADHN COc1cc2c(cc1OC)CN(C(=O)CN1CCCC[C@@H]1c1cccc(C)c1C)CC2 ZINC000464782031 878027861 /nfs/dbraw/zinc/02/78/61/878027861.db2.gz VBFUDZUVFGUKQY-HSZRJFAPSA-N 0 3 422.569 4.433 20 0 HIADHN CCN(CC(=O)Nc1ccc(F)cc1Cl)CC1CCN(c2ccccn2)CC1 ZINC000464809206 878057980 /nfs/dbraw/zinc/05/79/80/878057980.db2.gz ZGLAYVVJOWNTHI-UHFFFAOYSA-N 0 3 404.917 4.051 20 0 HIADHN CC[C@H]1c2ccsc2CCN1C(=O)CN1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC000464849436 878123207 /nfs/dbraw/zinc/12/32/07/878123207.db2.gz ZERSHLBDXROLMI-KNQAVFIVSA-N 0 3 411.615 4.180 20 0 HIADHN CC[C@H](C)NC(=O)[C@@H]1C[C@H](C)N(Cc2cnn(C)c2C(F)(F)F)[C@@H]2CCCC[C@@H]12 ZINC000464868214 878152535 /nfs/dbraw/zinc/15/25/35/878152535.db2.gz XZNUCEIQUKVOSL-GCDKYVQMSA-N 0 3 414.516 4.123 20 0 HIADHN CCNC(=O)c1cccc(NC(=O)CN(CCc2cccc(F)c2)C2CCCC2)c1 ZINC000464901098 878212844 /nfs/dbraw/zinc/21/28/44/878212844.db2.gz WKRNEJQOLCPCSY-UHFFFAOYSA-N 0 3 411.521 4.001 20 0 HIADHN COc1ccc2nc(C)cc(C(=O)N3CC[C@H](C)N(Cc4ccccc4)CC3)c2c1 ZINC000464903548 878217729 /nfs/dbraw/zinc/21/77/29/878217729.db2.gz DWABPTYYWRRCCY-IBGZPJMESA-N 0 3 403.526 4.288 20 0 HIADHN C/C=C/c1ccc(OCC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)c(OC)c1 ZINC000464909489 878224535 /nfs/dbraw/zinc/22/45/35/878224535.db2.gz LRYOBVFNKZDJCX-BTZGUFSASA-N 0 3 408.542 4.230 20 0 HIADHN FC(F)(F)c1ccccc1-c1csc(N2CCN(CC3CCOCC3)CC2)n1 ZINC000465055274 878417281 /nfs/dbraw/zinc/41/72/81/878417281.db2.gz LJPDXUINYRGVFQ-UHFFFAOYSA-N 0 3 411.493 4.378 20 0 HIADHN COc1ccc(OC(F)F)c(CNC(=O)c2oc3ccccc3c2CN(C)C)c1 ZINC000465075791 878435576 /nfs/dbraw/zinc/43/55/76/878435576.db2.gz SRYYZQAUHZAVFQ-UHFFFAOYSA-N 0 3 404.413 4.034 20 0 HIADHN Cc1ccc([C@H](NC(=O)N[C@H]2CCN(Cc3ccccc3)[C@H]2C)c2ccccn2)cc1 ZINC000503373125 912352755 /nfs/dbraw/zinc/35/27/55/912352755.db2.gz RQSSSVQVEJXTHJ-OPHFCASCSA-N 0 3 414.553 4.442 20 0 HIADHN Cc1ccc([C@H](NC(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)c2ccccn2)cc1 ZINC000503372320 912353630 /nfs/dbraw/zinc/35/36/30/912353630.db2.gz JWIQCSBEAHIWRE-IGKWTDBASA-N 0 3 402.542 4.470 20 0 HIADHN Cc1ccc([C@H](NC(=O)N[C@@H]2CCN(Cc3ccccc3)[C@H]2C)c2ccccn2)cc1 ZINC000503373129 912354058 /nfs/dbraw/zinc/35/40/58/912354058.db2.gz RQSSSVQVEJXTHJ-ZWSUVBHBSA-N 0 3 414.553 4.442 20 0 HIADHN CC1CCN([C@H](CNC(=O)NCc2ccc(-n3cccn3)cc2)c2cccs2)CC1 ZINC000503374054 912355968 /nfs/dbraw/zinc/35/59/68/912355968.db2.gz GPXDNDFIGDITFZ-OAQYLSRUSA-N 0 3 423.586 4.206 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)c1cccc2cnccc21 ZINC000465178398 878566822 /nfs/dbraw/zinc/56/68/22/878566822.db2.gz WBMHDEKQGAKZBQ-UHFFFAOYSA-N 0 3 401.432 4.458 20 0 HIADHN CC(=O)N(C)c1cccc(NC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)c1 ZINC000465286567 878722779 /nfs/dbraw/zinc/72/27/79/878722779.db2.gz QIRWPIJCUGBIIM-OAQYLSRUSA-N 0 3 419.447 4.062 20 0 HIADHN COc1ccc(C2CCN(C(=O)CCCN3CCN(c4ccccc4)CC3)CC2)cc1 ZINC000465370813 878813739 /nfs/dbraw/zinc/81/37/39/878813739.db2.gz JUCUHYHBOOXXTK-UHFFFAOYSA-N 0 3 421.585 4.004 20 0 HIADHN C[C@H](CNC(=O)NC[C@@H](c1cccs1)N1CCCC1)Oc1ccccc1Cl ZINC000465424671 878854452 /nfs/dbraw/zinc/85/44/52/878854452.db2.gz PJUKRRFKGJWTKR-WBVHZDCISA-N 0 3 407.967 4.305 20 0 HIADHN O=C(NCc1c(F)cccc1OC(F)F)NC[C@@H](c1cccs1)N1CCCC1 ZINC000465424534 878854755 /nfs/dbraw/zinc/85/47/55/878854755.db2.gz UIEZOAYCZJLRTK-HNNXBMFYSA-N 0 3 413.465 4.125 20 0 HIADHN C[C@H](NC(=O)NC[C@@H](c1cccs1)N1CCCC1)c1cccc(-n2cccn2)c1 ZINC000465426139 878856083 /nfs/dbraw/zinc/85/60/83/878856083.db2.gz RLVPELTUZLOIIG-PXNSSMCTSA-N 0 3 409.559 4.131 20 0 HIADHN CCc1ccc([C@H](COC)NC(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)o1 ZINC000465426682 878856278 /nfs/dbraw/zinc/85/62/78/878856278.db2.gz DGWKNARDBRJTQE-RBUKOAKNSA-N 0 3 419.591 4.363 20 0 HIADHN Cc1c(NCC(C)(C)C)cccc1C(=O)Nc1ccc2oc(=O)n(CCN(C)C)c2c1 ZINC000465430613 878861768 /nfs/dbraw/zinc/86/17/68/878861768.db2.gz ZDLJHVYFYMDHOU-UHFFFAOYSA-N 0 3 424.545 4.175 20 0 HIADHN Cc1ccccc1[C@@H]1CN(C(=O)NC[C@H](c2ccccc2)N2CCCC2)[C@@H](C)CO1 ZINC000465446351 878877622 /nfs/dbraw/zinc/87/76/22/878877622.db2.gz VYRMQLKFUNPQDU-ZTCOLXNVSA-N 0 3 407.558 4.304 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N[C@@H](C)c1c(F)cccc1OC)c1cccc(OC)c1 ZINC000465465938 878900151 /nfs/dbraw/zinc/90/01/51/878900151.db2.gz ASFCWFUTDZERBM-JXFKEZNVSA-N 0 3 417.525 4.286 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1C[C@@H](C)O[C@@H](c2ccc(F)cc2)C1)c1ccsc1 ZINC000465534464 878993468 /nfs/dbraw/zinc/99/34/68/878993468.db2.gz QUIBLSJILREHKE-MAODMQOUSA-N 0 3 419.566 4.442 20 0 HIADHN CC[C@@H](CNC(=O)N[C@@H](C)c1cccc(-n2cccn2)c1)N1CCc2ccccc2C1 ZINC000465535350 878993692 /nfs/dbraw/zinc/99/36/92/878993692.db2.gz AWJAMPJDBGUFRA-CVDCTZTESA-N 0 3 417.557 4.069 20 0 HIADHN CCc1nc(C)c([C@H](C)N(C)C(=O)NCCCN2CCc3ccccc3C2)s1 ZINC000465545763 879007991 /nfs/dbraw/zinc/00/79/91/879007991.db2.gz RMJYMIAHNWMHFB-KRWDZBQOSA-N 0 3 400.592 4.165 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)N2CC[C@@H](C)C[C@@H]2c2ccco2)CC1 ZINC000465553857 879020869 /nfs/dbraw/zinc/02/08/69/879020869.db2.gz WYSJEGIXLWZUHA-NFBKMPQASA-N 0 3 424.589 4.100 20 0 HIADHN C[C@@H](NC(=O)N[C@@H](CN1CCCC1)c1ccccc1)c1ccc(-n2cccn2)cc1 ZINC000465588075 879069074 /nfs/dbraw/zinc/06/90/74/879069074.db2.gz BKIJGYMLEZPDBQ-XXBNENTESA-N 0 3 403.530 4.070 20 0 HIADHN C[C@@H]1CCN(C(=O)NCCCN2CCN(C)C[C@@H]2c2ccccc2)[C@@H](c2ccco2)C1 ZINC000465588807 879070816 /nfs/dbraw/zinc/07/08/16/879070816.db2.gz DPKFVLNCHBGOGL-YMPZKCBVSA-N 0 3 424.589 4.141 20 0 HIADHN CO[C@H](CNC(=O)N[C@@H](CN1CCCC1)c1ccccc1)c1ccc(Cl)cc1 ZINC000465613346 879111201 /nfs/dbraw/zinc/11/12/01/879111201.db2.gz ZRZHBWUKHKMCRT-LEWJYISDSA-N 0 3 401.938 4.164 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)N(Cc1ccoc1)C1CCCCC1 ZINC000465654748 879179128 /nfs/dbraw/zinc/17/91/28/879179128.db2.gz IBSORNBWFBVFTR-UHFFFAOYSA-N 0 3 405.608 4.486 20 0 HIADHN CCO[C@H](C)c1nc(CN(C)C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)cs1 ZINC000465688683 879239749 /nfs/dbraw/zinc/23/97/49/879239749.db2.gz JKHPWMMICOOEDD-IEBWSBKVSA-N 0 3 416.591 4.047 20 0 HIADHN CN(CCNC(=O)N(Cc1ccc2c(c1)CCO2)C1CCCC1)Cc1ccccc1 ZINC000465750930 879338484 /nfs/dbraw/zinc/33/84/84/879338484.db2.gz JORFGHNBCCLOPV-UHFFFAOYSA-N 0 3 407.558 4.208 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1)c1nc(-c2cccc(F)c2)no1 ZINC000465767074 879364974 /nfs/dbraw/zinc/36/49/74/879364974.db2.gz YRFPGIRANRCIML-TWOQFEAHSA-N 0 3 423.492 4.071 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)NC[C@H]2CCCO[C@H]2c2ccc(C)cc2)N(C)C)cc1 ZINC000465817516 879442443 /nfs/dbraw/zinc/44/24/43/879442443.db2.gz OWMCSELLPPDMPS-SMIHKQSGSA-N 0 3 409.574 4.373 20 0 HIADHN COc1ccccc1C[C@@H](C)N(C)C(=O)NC[C@@H](c1ccc(C)cc1)N1CCCC1 ZINC000465825673 879456296 /nfs/dbraw/zinc/45/62/96/879456296.db2.gz HLWYRLCJJDXXNT-OFNKIYASSA-N 0 3 409.574 4.413 20 0 HIADHN Cc1cccc2c(CCNC(=O)N(CCN(C)C)Cc3cccc(Cl)c3)c[nH]c21 ZINC000466000402 879677302 /nfs/dbraw/zinc/67/73/02/879677302.db2.gz HXOBQYVDBICDAS-UHFFFAOYSA-N 0 3 412.965 4.446 20 0 HIADHN COc1cccc([C@H](Cc2cc(C)cc(C)c2)NC(=O)N2CCN(C)CC[C@@H]2C)c1 ZINC000466036676 879725934 /nfs/dbraw/zinc/72/59/34/879725934.db2.gz OVLVCRURDXOFCX-RDPSFJRHSA-N 0 3 409.574 4.331 20 0 HIADHN COc1ccc([C@H](C)CCNC(=O)N(CCN(C)C)Cc2ccc(F)cc2)cc1 ZINC000466041428 879730353 /nfs/dbraw/zinc/73/03/53/879730353.db2.gz RNKVLJPONIJMDC-GOSISDBHSA-N 0 3 401.526 4.101 20 0 HIADHN COc1cccc([C@H](Cc2cc(C)cc(C)c2)NC(=O)N2CC[C@H](N3CC=CC3)C2)c1 ZINC000466049619 879738133 /nfs/dbraw/zinc/73/81/33/879738133.db2.gz LOMCYKXJARRPJR-ZCYQVOJMSA-N 0 3 419.569 4.252 20 0 HIADHN Cc1csc([C@H](NC(=O)N(CCN(C)C)Cc2cccc(Cl)c2)C2CC2)n1 ZINC000466081569 879800390 /nfs/dbraw/zinc/80/03/90/879800390.db2.gz ISPMFMXSYRPTQI-GOSISDBHSA-N 0 3 406.983 4.329 20 0 HIADHN Cc1cnc([C@@H](NC(=O)N(CCCc2ccccc2)CCN(C)C)C2CC2)s1 ZINC000466113448 879827013 /nfs/dbraw/zinc/82/70/13/879827013.db2.gz BMSUYKJKQSDRLT-FQEVSTJZSA-N 0 3 400.592 4.109 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)Nc2ccccc2Oc2cccc(C)c2)CC1 ZINC000466112542 879827079 /nfs/dbraw/zinc/82/70/79/879827079.db2.gz ADBXZOHHNBMQAV-HXUWFJFHSA-N 0 3 410.562 4.182 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)N2CCCCC[C@H]2c2ccc(Cl)cc2)CC1 ZINC000466132032 879844639 /nfs/dbraw/zinc/84/46/39/879844639.db2.gz MYZQQOXHXJITOM-UGKGYDQZSA-N 0 3 421.029 4.240 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)NCCc1c[nH]c2ccc(Cl)cc12 ZINC000466179587 879878370 /nfs/dbraw/zinc/87/83/70/879878370.db2.gz ULVHKYQDJIEPTK-UHFFFAOYSA-N 0 3 416.928 4.276 20 0 HIADHN Cc1ccc(-c2nc(CCNC(=O)N[C@H]3C[C@H](C)N(Cc4ccccc4)C3)co2)cc1 ZINC000466247062 879962238 /nfs/dbraw/zinc/96/22/38/879962238.db2.gz UTYZYHJNZFSNQC-CVDCTZTESA-N 0 3 418.541 4.155 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)N[C@H](c2ccccc2)c2ccncc2)CN1Cc1ccccc1 ZINC000466262630 879992446 /nfs/dbraw/zinc/99/24/46/879992446.db2.gz YKLBVHAZFQCSFI-VEXUSMLFSA-N 0 3 400.526 4.133 20 0 HIADHN Cc1cc(CNCc2c[nH]nc2-c2ccsc2)ccc1I ZINC000466365137 880124133 /nfs/dbraw/zinc/12/41/33/880124133.db2.gz UHJOKQRTZVPKRU-UHFFFAOYSA-N 0 3 409.296 4.341 20 0 HIADHN COc1ccc(-c2cncc(C(=O)N(Cc3ccco3)C3CCN(C)CC3)c2)cc1 ZINC000466412597 880180218 /nfs/dbraw/zinc/18/02/18/880180218.db2.gz TVKYHFUSMQXAQR-UHFFFAOYSA-N 0 3 405.498 4.087 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccc(O)cc1)C(=O)[C@@H]1SCCc2sccc21 ZINC000503498697 912544725 /nfs/dbraw/zinc/54/47/25/912544725.db2.gz ZKBNZEVPTWAUOL-LAUBAEHRSA-N 0 3 416.612 4.297 20 0 HIADHN CCOc1cc(CNCc2c(C)oc3ccccc32)ccc1O[C@@H](C)C(=O)N(C)C ZINC000466474422 880256599 /nfs/dbraw/zinc/25/65/99/880256599.db2.gz OTRBZQUGDTZZJH-KRWDZBQOSA-N 0 3 410.514 4.285 20 0 HIADHN CSc1ccc([C@H](C)NC(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)cc1 ZINC000466483161 880263934 /nfs/dbraw/zinc/26/39/34/880263934.db2.gz VNIWKGIWGBJOOK-FHWLQOOXSA-N 0 3 419.635 4.390 20 0 HIADHN CC(=O)Nc1ccc(Cl)c(NC(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)c1 ZINC000466516005 880289059 /nfs/dbraw/zinc/28/90/59/880289059.db2.gz DRHZQHNGWBSGAK-KBXCAEBGSA-N 0 3 400.910 4.083 20 0 HIADHN CCOCCOCc1cccc(NC(=O)N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)c1 ZINC000466531531 880306882 /nfs/dbraw/zinc/30/68/82/880306882.db2.gz YVVDFEGTUKUNJS-XXBNENTESA-N 0 3 411.546 4.024 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCC[C@H]1c1ccc(COC)o1)c1ccsc1 ZINC000466574295 880349730 /nfs/dbraw/zinc/34/97/30/880349730.db2.gz PCSVKLMSRYHJNY-RBUKOAKNSA-N 0 3 405.564 4.417 20 0 HIADHN CCc1c(NC(=O)N(CCN(C)C)Cc2cccc(C)c2)cnn1-c1ccccc1 ZINC000466675223 880462511 /nfs/dbraw/zinc/46/25/11/880462511.db2.gz FVVBCKHICOEXAT-UHFFFAOYSA-N 0 3 405.546 4.339 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCCc1c[nH]c2ccccc12)c1cccc(OC)c1 ZINC000503522869 912573608 /nfs/dbraw/zinc/57/36/08/912573608.db2.gz CFXWULPGLCYCQW-HSZRJFAPSA-N 0 3 408.546 4.101 20 0 HIADHN CC[C@H]1C[C@@H](C(=O)Nc2cccc(N3CCN(CCc4ccccc4)CC3)c2)CCO1 ZINC000503528916 912582353 /nfs/dbraw/zinc/58/23/53/912582353.db2.gz WVRMYIAAMLVOLX-DHLKQENFSA-N 0 3 421.585 4.195 20 0 HIADHN CSc1ccc(F)cc1CNC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1 ZINC000466812154 880587801 /nfs/dbraw/zinc/58/78/01/880587801.db2.gz BAIDLYBHJLZZFT-KRWDZBQOSA-N 0 3 401.551 4.354 20 0 HIADHN CN(Cc1cc(Cl)cn1C)C(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000466844647 880612667 /nfs/dbraw/zinc/61/26/67/880612667.db2.gz WXDAEXBERLPFIY-LJQANCHMSA-N 0 3 413.871 4.092 20 0 HIADHN CSc1ccc([C@@H](C)NC(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)cc1 ZINC000466847997 880617487 /nfs/dbraw/zinc/61/74/87/880617487.db2.gz VNIWKGIWGBJOOK-CEXWTWQISA-N 0 3 419.635 4.390 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)NCc2ccc(-c3cccnc3)cc2)c1 ZINC000466945823 880718762 /nfs/dbraw/zinc/71/87/62/880718762.db2.gz FZNGJJRKOUWSSA-UHFFFAOYSA-N 0 3 402.542 4.330 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@@H]2CNC(=O)N(CCN(C)C)Cc2ccccc2)cc1 ZINC000466949784 880725545 /nfs/dbraw/zinc/72/55/45/880725545.db2.gz FMWOTRCUPYFIEI-RPWUZVMVSA-N 0 3 409.574 4.236 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)N[C@@H](C)c2ccc(-n3cccn3)cc2)c1 ZINC000466970750 880769821 /nfs/dbraw/zinc/76/98/21/880769821.db2.gz HXTXLACWTFKUMI-FQEVSTJZSA-N 0 3 405.546 4.015 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(C)c1C(=O)N[C@H]1C[C@H](C)N(Cc2ccccc2)C1 ZINC000467035330 880833675 /nfs/dbraw/zinc/83/36/75/880833675.db2.gz UTYUDIAEBNGWMD-KKSFZXQISA-N 0 3 406.505 4.021 20 0 HIADHN O=C(NCc1ccccc1-c1ccc(Cn2ccnc2)cc1)[C@@H]1CCCc2[nH]ncc21 ZINC000467096970 880861152 /nfs/dbraw/zinc/86/11/52/880861152.db2.gz LZJBWXZUEYXYAF-JOCHJYFZSA-N 0 3 411.509 4.058 20 0 HIADHN COC[C@@H]1CCCCN([C@H](C)C(=O)Nc2ccc(NC(=O)c3cccs3)cc2)C1 ZINC000467120091 880876886 /nfs/dbraw/zinc/87/68/86/880876886.db2.gz DNBNBDBFGCVCTR-IAGOWNOFSA-N 0 3 415.559 4.076 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)NCc1nc(-c2ccccc2F)cs1)c1ccco1 ZINC000503550770 912619881 /nfs/dbraw/zinc/61/98/81/912619881.db2.gz IMIBTIYRVHXFIE-PBHICJAKSA-N 0 3 416.522 4.471 20 0 HIADHN COC(=O)COc1ccc([C@@H](C)N[C@H](C)C(=O)Nc2c(C)cccc2C(C)C)cc1 ZINC000467179755 880907910 /nfs/dbraw/zinc/90/79/10/880907910.db2.gz IXJDICZMBJNSKZ-QZTJIDSGSA-N 0 3 412.530 4.348 20 0 HIADHN COC(=O)COc1ccc([C@@H](C)NCc2ccc(C(=O)Nc3ccccc3)cc2)cc1 ZINC000467183127 880908836 /nfs/dbraw/zinc/90/88/36/880908836.db2.gz WITVHXANZWIEFZ-GOSISDBHSA-N 0 3 418.493 4.342 20 0 HIADHN C[C@@H](NC(=O)NCc1nc(-c2ccccc2F)cs1)[C@@H](c1ccccc1)N(C)C ZINC000503558622 912632253 /nfs/dbraw/zinc/63/22/53/912632253.db2.gz VLKZQPOASRASEN-VFNWGFHPSA-N 0 3 412.534 4.440 20 0 HIADHN COCC[C@H]1CCCCN(CC(=O)N[C@H](c2cccs2)c2ccc(C)cc2)C1 ZINC000467278455 881021931 /nfs/dbraw/zinc/02/19/31/881021931.db2.gz KSEWNLXNZHEDRD-XXBNENTESA-N 0 3 400.588 4.401 20 0 HIADHN C[C@H](Cc1cccc(C(F)(F)F)c1)NCc1nnc2ccc(C(F)(F)F)cn21 ZINC000467308312 881056603 /nfs/dbraw/zinc/05/66/03/881056603.db2.gz JLPFAUJVWFQALA-LLVKDONJSA-N 0 3 402.342 4.488 20 0 HIADHN C[C@H](NCc1ccc(CN2C[C@@H](C)O[C@@H](C)C2)cc1)c1ccnn1-c1ccccc1 ZINC000467313041 881060803 /nfs/dbraw/zinc/06/08/03/881060803.db2.gz KZSXTRHDMBWGFB-HBMCJLEFSA-N 0 3 404.558 4.332 20 0 HIADHN C[C@H](Cc1cccc(C(F)(F)F)c1)N[C@@H](C(N)=O)c1cccc(Br)c1 ZINC000467364141 881131063 /nfs/dbraw/zinc/13/10/63/881131063.db2.gz JFONTUGUSHMQKX-BDJLRTHQSA-N 0 3 415.253 4.215 20 0 HIADHN O=C(c1cc(COc2c(Cl)cccc2Cl)on1)N1CC[C@H](N2CCCCC2)C1 ZINC000467370551 881142760 /nfs/dbraw/zinc/14/27/60/881142760.db2.gz QEFACEMUIWJWKK-AWEZNQCLSA-N 0 3 424.328 4.261 20 0 HIADHN COc1cc2c(cc1F)CC[C@H]2NC[C@H](O)COc1cccc(Cl)c1Cl ZINC000467384882 881165642 /nfs/dbraw/zinc/16/56/42/881165642.db2.gz KPLGPYPROQCFSJ-BLLLJJGKSA-N 0 3 400.277 4.158 20 0 HIADHN CSC[C@H](NCCN1CCc2ccccc2C1=O)c1ccc(C(F)(F)F)cc1 ZINC000467398536 881181772 /nfs/dbraw/zinc/18/17/72/881181772.db2.gz JRJAQVXQVJYEOD-IBGZPJMESA-N 0 3 408.489 4.398 20 0 HIADHN CCS(=O)(=O)c1cccc(CN[C@H]2CCCc3ccc(Br)cc32)c1 ZINC000467412349 881199250 /nfs/dbraw/zinc/19/92/50/881199250.db2.gz RVNHVQZHPDXGOU-IBGZPJMESA-N 0 3 408.361 4.410 20 0 HIADHN COc1ccc2c(c1)[C@H](NC[C@H](O)COc1cccc(C(F)(F)F)c1)CCS2 ZINC000467418419 881207427 /nfs/dbraw/zinc/20/74/27/881207427.db2.gz JYHJMUKBMABHGA-KBXCAEBGSA-N 0 3 413.461 4.280 20 0 HIADHN CN(C)c1cccc(CN[C@@H](c2cccc(Br)c2)C2CCOCC2)n1 ZINC000467424338 881213418 /nfs/dbraw/zinc/21/34/18/881213418.db2.gz SDTHYSFJAUZBRR-HXUWFJFHSA-N 0 3 404.352 4.168 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)C(Cc2ccccc2)Cc2ccccc2)C[C@H](C)O1 ZINC000467427797 881218596 /nfs/dbraw/zinc/21/85/96/881218596.db2.gz HYJWIWJFMXTGIS-SZPZYZBQSA-N 0 3 408.586 4.094 20 0 HIADHN CNC(=O)c1cccc(CN[C@@H](c2cccc(Br)c2)C2CCOCC2)c1 ZINC000467427449 881219474 /nfs/dbraw/zinc/21/94/74/881219474.db2.gz GJJYWHRULLZYBQ-HXUWFJFHSA-N 0 3 417.347 4.066 20 0 HIADHN C[C@H]1CC[N@H+](CCOc2ccc([N-]S(=O)(=O)c3ccc4ccccc4c3)cc2)C1 ZINC000467440043 881240280 /nfs/dbraw/zinc/24/02/80/881240280.db2.gz PPRAMECQNDOVCA-SFHVURJKSA-N 0 3 410.539 4.361 20 0 HIADHN C[C@H]1CC[N@@H+](CCOc2ccc([N-]S(=O)(=O)c3ccc4ccccc4c3)cc2)C1 ZINC000467440043 881240292 /nfs/dbraw/zinc/24/02/92/881240292.db2.gz PPRAMECQNDOVCA-SFHVURJKSA-N 0 3 410.539 4.361 20 0 HIADHN CC(C)NC(=O)Nc1ccc([C@H](C)N[C@H]2CC(=O)N(Cc3ccccc3)[C@H]2C)cc1 ZINC000467440661 881241680 /nfs/dbraw/zinc/24/16/80/881241680.db2.gz WFJBBZWXKMOKCJ-SPEDKVCISA-N 0 3 408.546 4.057 20 0 HIADHN CCc1nnc(-c2ccc(NC(=O)N[C@H]3C[C@@H](C)N(Cc4ccccc4)C3)cc2)o1 ZINC000467470961 881286964 /nfs/dbraw/zinc/28/69/64/881286964.db2.gz BBVADMHKRVWZGG-UZLBHIALSA-N 0 3 405.502 4.084 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)c1sccc1-c1ccccc1 ZINC000467498634 881314728 /nfs/dbraw/zinc/31/47/28/881314728.db2.gz JWXXYBOKKNRQLX-UHFFFAOYSA-N 0 3 406.551 4.302 20 0 HIADHN Cc1nn(CC(=O)N2CCCN(CCCc3ccccc3)CC2)cc1-c1ccccc1 ZINC000469073365 883155849 /nfs/dbraw/zinc/15/58/49/883155849.db2.gz UCMXGPQFHKBOLI-UHFFFAOYSA-N 0 3 416.569 4.026 20 0 HIADHN COc1cc(Br)ccc1[C@@H](C)NCc1cn(-c2ccncc2)nc1C ZINC000469100613 883190902 /nfs/dbraw/zinc/19/09/02/883190902.db2.gz XFCOKNIHQPQDAS-CQSZACIVSA-N 0 3 401.308 4.198 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(Cl)cc2)CC1)[C@@H]1CCCC(F)(F)C1 ZINC000503593778 912680871 /nfs/dbraw/zinc/68/08/71/912680871.db2.gz DFGLEBDQYLKZAQ-OAHLLOKOSA-N 0 3 400.897 4.125 20 0 HIADHN COc1cc([C@H](C)NCc2ccc(C)nc2-n2cc(Cl)cn2)cc(OC)c1OC ZINC000469151382 883248238 /nfs/dbraw/zinc/24/82/38/883248238.db2.gz RXUPMHHESMXIHL-AWEZNQCLSA-N 0 3 416.909 4.106 20 0 HIADHN O=C(NCCCSc1ccc(F)cc1)N1CCCN(Cc2ccccc2)CC1 ZINC000503594436 912685167 /nfs/dbraw/zinc/68/51/67/912685167.db2.gz NSZZZVHDHMLWJE-UHFFFAOYSA-N 0 3 401.551 4.225 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)c1ccoc1Br ZINC000469172172 883270608 /nfs/dbraw/zinc/27/06/08/883270608.db2.gz ZUJGJOUQPGUXNV-UHFFFAOYSA-N 0 3 419.241 4.265 20 0 HIADHN O=C(CN1CCC(NCc2ccc(Oc3ccccc3)o2)CC1)Nc1ccccc1 ZINC000503598764 912688324 /nfs/dbraw/zinc/68/83/24/912688324.db2.gz YWOXTJHJKBLJAX-UHFFFAOYSA-N 0 3 405.498 4.265 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3cccc(OCc4cscn4)c3)cc2)CC1 ZINC000469211453 883311827 /nfs/dbraw/zinc/31/18/27/883311827.db2.gz UGGHKHKRHNPXIP-UHFFFAOYSA-N 0 3 422.554 4.116 20 0 HIADHN CS(=O)(=O)c1ccc(CNC(Cc2ccccc2F)Cc2ccccc2F)s1 ZINC000469225422 883325699 /nfs/dbraw/zinc/32/56/99/883325699.db2.gz KRUWVKYLDSYXFT-UHFFFAOYSA-N 0 3 421.534 4.373 20 0 HIADHN CCOC(=O)[C@@](C)(CN[C@@H](C)C(=O)Nc1ccc(C)cc1Cl)c1ccccc1 ZINC000469255877 883354084 /nfs/dbraw/zinc/35/40/84/883354084.db2.gz OGBLGAILLASSGX-AOMKIAJQSA-N 0 3 402.922 4.086 20 0 HIADHN COc1ccc([C@@H](NCCc2ccccc2F)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000469267579 883364293 /nfs/dbraw/zinc/36/42/93/883364293.db2.gz NSZPNOQNZPLDRS-HSZRJFAPSA-N 0 3 413.514 4.160 20 0 HIADHN CCOC(=O)[C@@](C)(CN[C@H](C)C(=O)Nc1ccc(Cl)cc1C)c1ccccc1 ZINC000469305902 883406088 /nfs/dbraw/zinc/40/60/88/883406088.db2.gz UTZCKMFEQGKFFN-ZHRRBRCNSA-N 0 3 402.922 4.086 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Cc3cccc(Cl)c3Cl)CC2)C[C@@H](C)O1 ZINC000469307869 883407801 /nfs/dbraw/zinc/40/78/01/883407801.db2.gz VTOJJIQILJDCNG-HZPDHXFCSA-N 0 3 413.389 4.274 20 0 HIADHN CCN(C(=O)c1ccc(O[C@@H]2CCOC2)cc1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000469320170 883425928 /nfs/dbraw/zinc/42/59/28/883425928.db2.gz SIYQTHLBYGTJMV-NGYIFUPDSA-N 0 3 408.542 4.152 20 0 HIADHN CN(C)CCN(C(=O)c1csc(-c2cnn(-c3ccccc3)c2)n1)c1ccccc1 ZINC000503619759 912718990 /nfs/dbraw/zinc/71/89/90/912718990.db2.gz QEERMUSKHOSDLT-UHFFFAOYSA-N 0 3 417.538 4.204 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)N[C@H](c1ccccc1)[C@H]1CCOC1 ZINC000469428907 883612411 /nfs/dbraw/zinc/61/24/11/883612411.db2.gz WZNHFIDEVOFEEK-KMDXXIMOSA-N 0 3 409.574 4.220 20 0 HIADHN Cc1cccc(C)c1NC(=O)CN(C)C(=O)N[C@@H](CN(C)Cc1ccccc1)C(C)C ZINC000469430752 883615971 /nfs/dbraw/zinc/61/59/71/883615971.db2.gz VWSLXHPNBRVRHE-QFIPXVFZSA-N 0 3 424.589 4.040 20 0 HIADHN COCc1ccc([C@H]2CCCN2C(=O)N[C@@H](CN(C)Cc2ccccc2)C(C)C)o1 ZINC000469432569 883618759 /nfs/dbraw/zinc/61/87/59/883618759.db2.gz SVNDWNGXZMWXFA-FCHUYYIVSA-N 0 3 413.562 4.429 20 0 HIADHN Cc1csc([C@@H](NC(=O)N[C@@H](CN(C)Cc2ccccc2)C(C)C)C2CC2)n1 ZINC000469439955 883629653 /nfs/dbraw/zinc/62/96/53/883629653.db2.gz CSLGHORKVONIJM-PMACEKPBSA-N 0 3 400.592 4.358 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)Nc1ccc2c(c1)NC(=O)CS2 ZINC000469457240 883666004 /nfs/dbraw/zinc/66/60/04/883666004.db2.gz PJNYEOBDZXDHMF-LJQANCHMSA-N 0 3 412.559 4.009 20 0 HIADHN COc1ccc(Cl)cc1C[C@H]1CCCN(Cc2cc(-c3cnn(C)c3)no2)C1 ZINC000469521866 883790519 /nfs/dbraw/zinc/79/05/19/883790519.db2.gz JXFJOWXSVGJPJJ-OAHLLOKOSA-N 0 3 400.910 4.192 20 0 HIADHN C[C@H](CC(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1)c1c[nH]c2ccccc21 ZINC000469531356 883802464 /nfs/dbraw/zinc/80/24/64/883802464.db2.gz PUJONBFEHLLGML-AQNXPRMDSA-N 0 3 411.590 4.399 20 0 HIADHN O=C(CCN1CC[C@@H](Oc2ccncc2)C1)Nc1ccccc1Oc1ccccc1 ZINC000469738890 883895063 /nfs/dbraw/zinc/89/50/63/883895063.db2.gz BBLAZBZBZDUCBU-OAQYLSRUSA-N 0 3 403.482 4.356 20 0 HIADHN CCS[C@H]1CCCC[C@@H]1NCC(=O)Nc1c(F)cc(F)cc1Br ZINC000469773676 883949677 /nfs/dbraw/zinc/94/96/77/883949677.db2.gz AFDJNEIUPPFUDL-KBPBESRZSA-N 0 3 407.324 4.320 20 0 HIADHN C[C@H](N[C@H]1CCN(c2ccc(C(F)(F)F)cc2)C1=O)c1cccc(-n2ccnc2)c1 ZINC000469778094 883953416 /nfs/dbraw/zinc/95/34/16/883953416.db2.gz YPPXUZQBBZMEII-YWZLYKJASA-N 0 3 414.431 4.347 20 0 HIADHN C[C@@H](N[C@H]1CCN(c2ccc(C(F)(F)F)cc2)C1=O)c1cccc(-n2ccnc2)c1 ZINC000469778093 883953622 /nfs/dbraw/zinc/95/36/22/883953622.db2.gz YPPXUZQBBZMEII-QRWLVFNGSA-N 0 3 414.431 4.347 20 0 HIADHN COc1ccc(C(=O)N2CCC(N[C@H](C)c3csc(C(C)C)n3)CC2)cc1OC ZINC000469786519 883960836 /nfs/dbraw/zinc/96/08/36/883960836.db2.gz OEMDJKSHXMQPME-OAHLLOKOSA-N 0 3 417.575 4.239 20 0 HIADHN C[C@H](NCc1cccc(C(=O)N2CCOCC2)c1)c1cccc(-c2ccncc2)c1 ZINC000469810155 883986245 /nfs/dbraw/zinc/98/62/45/883986245.db2.gz PSSOSZAYVPXSQG-IBGZPJMESA-N 0 3 401.510 4.072 20 0 HIADHN O=C(NC[C@H]1CN(Cc2ccccc2)CCCO1)c1ccc(CCC(F)(F)F)cc1 ZINC000469847098 884029614 /nfs/dbraw/zinc/02/96/14/884029614.db2.gz SKUHFBJGGRBJSD-NRFANRHFSA-N 0 3 420.475 4.202 20 0 HIADHN CN(C)CCN(C[C@H]1CCCO1)C(=O)Nc1ccccc1Oc1cc(F)cc(F)c1 ZINC000469854020 884037928 /nfs/dbraw/zinc/03/79/28/884037928.db2.gz DQKPCBUTYXZFEP-GOSISDBHSA-N 0 3 419.472 4.332 20 0 HIADHN O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)[C@@H]1C[C@@H]1c1ccc2ccccc2c1 ZINC000469862473 884049064 /nfs/dbraw/zinc/04/90/64/884049064.db2.gz MTAORYBFNGSDCH-TWJOJJKGSA-N 0 3 414.549 4.351 20 0 HIADHN CSc1ccc(Cl)c(C(=O)NC[C@H]2CN(Cc3ccccc3)CCCO2)c1 ZINC000469868337 884057981 /nfs/dbraw/zinc/05/79/81/884057981.db2.gz AHONPHCEMVACGK-KRWDZBQOSA-N 0 3 404.963 4.083 20 0 HIADHN Cc1nc(-c2ccccc2)c(C(=O)NC[C@@H]2CN(Cc3ccccc3)CCCO2)s1 ZINC000469870836 884061911 /nfs/dbraw/zinc/06/19/11/884061911.db2.gz KDWXXQKIVUBXMH-OAQYLSRUSA-N 0 3 421.566 4.139 20 0 HIADHN Cc1nc(-c2cccc(C(=O)NC[C@H]3CN(Cc4ccccc4)CCCO3)c2)cs1 ZINC000469873914 884065654 /nfs/dbraw/zinc/06/56/54/884065654.db2.gz VNJXPZVMLMECHM-QFIPXVFZSA-N 0 3 421.566 4.139 20 0 HIADHN CCC[C@@H]1C[C@H](C(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)CCO1 ZINC000503678462 912784220 /nfs/dbraw/zinc/78/42/20/912784220.db2.gz GEALXJNUWYQBFE-BHIFYINESA-N 0 3 410.562 4.172 20 0 HIADHN CSCc1ccccc1NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000469909820 884098196 /nfs/dbraw/zinc/09/81/96/884098196.db2.gz ULHWLXKNNFXTSI-UHFFFAOYSA-N 0 3 401.498 4.476 20 0 HIADHN Cc1cc2cccnc2c(NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)c1 ZINC000469927032 884118727 /nfs/dbraw/zinc/11/87/27/884118727.db2.gz HTTACHVOZXJOGA-UHFFFAOYSA-N 0 3 406.452 4.470 20 0 HIADHN C[C@@H](CO)N1CCCN(C(=O)Nc2cc(Cl)ccc2Sc2ccccc2)CC1 ZINC000469931342 884125620 /nfs/dbraw/zinc/12/56/20/884125620.db2.gz XMBGFLANYHEZRC-INIZCTEOSA-N 0 3 419.978 4.412 20 0 HIADHN CCCn1ccnc1CCCN(C)C(=O)[C@H](C)N1CCC(Cc2ccccc2)CC1 ZINC000469946993 884145443 /nfs/dbraw/zinc/14/54/43/884145443.db2.gz GXDJCDCPLSFRPZ-NRFANRHFSA-N 0 3 410.606 4.027 20 0 HIADHN COc1cc(OC)cc(N2CCCN(Cc3ccc4c(c3)COC(C)(C)O4)CC2)c1 ZINC000469958319 884163818 /nfs/dbraw/zinc/16/38/18/884163818.db2.gz VCFHMKTVDMRZKF-UHFFFAOYSA-N 0 3 412.530 4.061 20 0 HIADHN C[C@@H]1CN(Cc2ccccn2)CC[C@H]1NCc1csc(CCc2ccccc2)n1 ZINC000469979451 884192576 /nfs/dbraw/zinc/19/25/76/884192576.db2.gz XASYXLQWEHSWNH-AUSIDOKSSA-N 0 3 406.599 4.324 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@@H]2NC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000470026305 884248009 /nfs/dbraw/zinc/24/80/09/884248009.db2.gz DRFFXEWJLXEERP-SGNDLWITSA-N 0 3 407.558 4.179 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@@H]2NC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000470026304 884248876 /nfs/dbraw/zinc/24/88/76/884248876.db2.gz DRFFXEWJLXEERP-HJOGWXRNSA-N 0 3 407.558 4.179 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@@H](C)c1ccccc1-n1cccn1)c1ccsc1 ZINC000470040301 884279873 /nfs/dbraw/zinc/27/98/73/884279873.db2.gz BJKLJMBXVRSCGW-LAUBAEHRSA-N 0 3 411.575 4.377 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@@H]2NC(=O)N(CCN(C)C)Cc2cccc(F)c2)cc1 ZINC000470048710 884292041 /nfs/dbraw/zinc/29/20/41/884292041.db2.gz CZPKUDZXHBGBGM-GOTSBHOMSA-N 0 3 413.537 4.128 20 0 HIADHN CCOc1cc(CN2CC[C@@H](C(F)(F)F)C2(C)C)ccc1O[C@@H](C)C(=O)N(C)C ZINC000470130688 884392963 /nfs/dbraw/zinc/39/29/63/884392963.db2.gz DHOAEVPFLRSJAY-KBXCAEBGSA-N 0 3 416.484 4.104 20 0 HIADHN O=C(CCc1nc2cc(C(F)(F)F)ccc2s1)NC[C@@H]1CCCCN1C1CC1 ZINC000470172765 884454446 /nfs/dbraw/zinc/45/44/46/884454446.db2.gz BNLNPEUPCCJFMP-HNNXBMFYSA-N 0 3 411.493 4.381 20 0 HIADHN O=C(CCc1nc2cc(Br)ccc2s1)NC[C@H]1CCCCN1C1CC1 ZINC000470177536 884458610 /nfs/dbraw/zinc/45/86/10/884458610.db2.gz CWAAMBNQWODIKQ-OAHLLOKOSA-N 0 3 422.392 4.125 20 0 HIADHN C[C@H](NC(=O)NC[C@H](c1ccccc1)N1CCCC1)c1ccccc1-n1cccn1 ZINC000470183657 884474052 /nfs/dbraw/zinc/47/40/52/884474052.db2.gz RWLPQLKXVXTECO-WMZHIEFXSA-N 0 3 403.530 4.070 20 0 HIADHN Cc1ccccc1-c1cc(NC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)n(C)n1 ZINC000470186804 884478407 /nfs/dbraw/zinc/47/84/07/884478407.db2.gz CTNOLOQXIWQWAR-IBGZPJMESA-N 0 3 406.505 4.385 20 0 HIADHN C[C@@H](NC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1)c1ccccc1-n1cccn1 ZINC000470189823 884486018 /nfs/dbraw/zinc/48/60/18/884486018.db2.gz ZEAALIREOWFYPO-LEWJYISDSA-N 0 3 417.557 4.239 20 0 HIADHN C[C@H](NC(=O)CCN1CCN(c2ccccc2)CC1)c1ccc(-c2ccncc2)cc1 ZINC000470196133 884503191 /nfs/dbraw/zinc/50/31/91/884503191.db2.gz SFOKGXXNDZHLPW-NRFANRHFSA-N 0 3 414.553 4.138 20 0 HIADHN Cc1ccc([C@H]2OCCC[C@@H]2NC(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)cc1 ZINC000470262596 884608649 /nfs/dbraw/zinc/60/86/49/884608649.db2.gz BNJSFKCXGAGBMH-LOSJGSFVSA-N 0 3 421.585 4.176 20 0 HIADHN COc1ccc([C@H](CNC(=O)Nc2cccc(OCCF)c2)N2CCCC2)cc1 ZINC000470286353 884655731 /nfs/dbraw/zinc/65/57/31/884655731.db2.gz WGTIZUBGFABQSC-NRFANRHFSA-N 0 3 401.482 4.002 20 0 HIADHN O=S1(=O)CC[C@H](NCC2CCC(F)(F)CC2)c2cc(Br)ccc21 ZINC000503884304 912850536 /nfs/dbraw/zinc/85/05/36/912850536.db2.gz HIEUGDXRAPGZNE-AWEZNQCLSA-N 0 3 408.308 4.083 20 0 HIADHN CCN(C(=O)c1cc(OC)c(OC)cc1F)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000470341316 884727721 /nfs/dbraw/zinc/72/77/21/884727721.db2.gz ZOAHJVNUCRVMFA-FUHWJXTLSA-N 0 3 400.494 4.141 20 0 HIADHN Cc1cc(C(=O)NCCCCN2CCN(c3ccccc3)CC2)c(Cl)cc1F ZINC000470357811 884751107 /nfs/dbraw/zinc/75/11/07/884751107.db2.gz UESAUQIWRWYMHZ-UHFFFAOYSA-N 0 3 403.929 4.120 20 0 HIADHN C[C@@H](NCC(C)(C)S(=O)(=O)c1ccc(Br)cc1)c1ccc(F)cc1 ZINC000470438761 884836587 /nfs/dbraw/zinc/83/65/87/884836587.db2.gz OZNMTCSMPUUMCI-CYBMUJFWSA-N 0 3 414.340 4.491 20 0 HIADHN CCN(C[C@@H]1CCN(Cc2ccccc2)C1)C(=O)C[C@@H](C)C(=O)c1cccc(F)c1 ZINC000470530559 884928873 /nfs/dbraw/zinc/92/88/73/884928873.db2.gz RDQMDKTYPKIVNZ-TZIWHRDSSA-N 0 3 410.533 4.405 20 0 HIADHN C/C(=C\c1ccccc1C(F)(F)F)CN(C)[C@@H](C)c1ccc(S(N)(=O)=O)cc1 ZINC000503951233 912880167 /nfs/dbraw/zinc/88/01/67/912880167.db2.gz FGHJNIZLHRKRET-ZQHYZAEZSA-N 0 3 412.477 4.449 20 0 HIADHN Cc1cc(C(=O)N[C@H](CN(C)Cc2ccccc2)C(C)C)c(C)n1Cc1ccccn1 ZINC000470589928 885006980 /nfs/dbraw/zinc/00/69/80/885006980.db2.gz DESCTHGHVNBUEM-RUZDIDTESA-N 0 3 418.585 4.435 20 0 HIADHN COc1cccc2c1CC[C@@H]2NC(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000470594420 885015332 /nfs/dbraw/zinc/01/53/32/885015332.db2.gz KVJDHRNQQUMXFT-NRFANRHFSA-N 0 3 411.571 4.096 20 0 HIADHN COc1ccc(C(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)cc1OC(F)F ZINC000470654021 885074865 /nfs/dbraw/zinc/07/48/65/885074865.db2.gz NEHXNKPYFIHNRV-SFHVURJKSA-N 0 3 404.457 4.033 20 0 HIADHN CN(C(=O)Cc1ccccc1Br)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470658616 885082722 /nfs/dbraw/zinc/08/27/22/885082722.db2.gz JOGKTOICFDYFMI-LJQANCHMSA-N 0 3 401.348 4.115 20 0 HIADHN CC(C)c1n[nH]c(C(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)c1Br ZINC000470662650 885088077 /nfs/dbraw/zinc/08/80/77/885088077.db2.gz LMODIVIKFWWMGT-MRXNPFEDSA-N 0 3 419.367 4.032 20 0 HIADHN CN(C(=O)c1ccc(N2CCCCCC2)nc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470662872 885088885 /nfs/dbraw/zinc/08/88/85/885088885.db2.gz MMWQVJWQQOGEAK-QHCPKHFHSA-N 0 3 406.574 4.199 20 0 HIADHN COc1ccc2nc(C)cc(C(=O)N(C)[C@H]3CCCN(Cc4ccccc4)C3)c2c1 ZINC000470667793 885095902 /nfs/dbraw/zinc/09/59/02/885095902.db2.gz NBAUJOPBRDBLED-FQEVSTJZSA-N 0 3 403.526 4.288 20 0 HIADHN CN(C(=O)CN[C@H](c1ccccc1)C(F)(F)F)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470669711 885098478 /nfs/dbraw/zinc/09/84/78/885098478.db2.gz SFNONCAYUUPVCE-RBBKRZOGSA-N 0 3 419.491 4.003 20 0 HIADHN COc1ccc(CCC(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)cc1Cl ZINC000470676002 885106212 /nfs/dbraw/zinc/10/62/12/885106212.db2.gz WOHLRQIBIDWUIF-HXUWFJFHSA-N 0 3 400.950 4.404 20 0 HIADHN COc1ccc(CCC(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)cc1Cl ZINC000470676001 885106662 /nfs/dbraw/zinc/10/66/62/885106662.db2.gz WOHLRQIBIDWUIF-FQEVSTJZSA-N 0 3 400.950 4.404 20 0 HIADHN CC(C)N1CCC[C@H](NC(=O)c2ccc(Cl)c(NC(=O)c3cccs3)c2)C1 ZINC000470677934 885109040 /nfs/dbraw/zinc/10/90/40/885109040.db2.gz HPSRSWUNJMNTGM-HNNXBMFYSA-N 0 3 405.951 4.256 20 0 HIADHN CC(C)COC[C@@H](NC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1)c1ccco1 ZINC000470728856 885180369 /nfs/dbraw/zinc/18/03/69/885180369.db2.gz CAPRCCHLKZUTKU-FGZHOGPDSA-N 0 3 413.562 4.299 20 0 HIADHN CC(=O)Nc1cccc([C@H](C)NC(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000470736103 885191084 /nfs/dbraw/zinc/19/10/84/885191084.db2.gz GLHUUCORYMUZED-FDDCHVKYSA-N 0 3 408.546 4.012 20 0 HIADHN CN(C(=O)NCc1ccc(OC2CCCC2)nc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470750951 885216647 /nfs/dbraw/zinc/21/66/47/885216647.db2.gz HFHPXIZZCKDDAC-QFIPXVFZSA-N 0 3 422.573 4.209 20 0 HIADHN C[C@@H](NC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1)c1ccccc1-n1cccn1 ZINC000470771984 885238271 /nfs/dbraw/zinc/23/82/71/885238271.db2.gz IGNMVFZWXOJFDJ-QUCCMNQESA-N 0 3 406.505 4.101 20 0 HIADHN CN(C(=O)NC[C@@H]1CCCO[C@@H]1C(C)(C)C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470882250 885376400 /nfs/dbraw/zinc/37/64/00/885376400.db2.gz DCXOBQXHIFUWKA-FKBYEOEOSA-N 0 3 401.595 4.134 20 0 HIADHN COc1ccc([C@H](C)CCNC(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000470885546 885379244 /nfs/dbraw/zinc/37/92/44/885379244.db2.gz DDFUQVLAWUIMOX-NFBKMPQASA-N 0 3 409.574 4.495 20 0 HIADHN C[C@@H](NC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1)c1cccc(-n2cccn2)c1 ZINC000470885141 885380869 /nfs/dbraw/zinc/38/08/69/885380869.db2.gz XOVUXBDTZHXLPP-HYBUGGRVSA-N 0 3 417.557 4.239 20 0 HIADHN CN(C(=O)NCc1coc(-c2ccccc2)n1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470888189 885383204 /nfs/dbraw/zinc/38/32/04/885383204.db2.gz KCLFNFCKBMHNJJ-QFIPXVFZSA-N 0 3 404.514 4.148 20 0 HIADHN COc1cc(Cl)ccc1CNC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470890481 885386182 /nfs/dbraw/zinc/38/61/82/885386182.db2.gz WPSQLXLJPQPMBD-HXUWFJFHSA-N 0 3 401.938 4.155 20 0 HIADHN C[C@H](NC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1)c1ccc(-n2cccn2)cc1 ZINC000470892124 885388057 /nfs/dbraw/zinc/38/80/57/885388057.db2.gz KPIKKVFMIJGIDP-RDPSFJRHSA-N 0 3 417.557 4.239 20 0 HIADHN COc1cccc(CNC[C@@H](c2ccc(Cl)cc2)N2CCOC(C)(C)C2)c1OC ZINC000504029891 912932055 /nfs/dbraw/zinc/93/20/55/912932055.db2.gz DYGGGMNUUSHYNC-FQEVSTJZSA-N 0 3 418.965 4.299 20 0 HIADHN CCc1ccc(Cl)c(CC)c1NC(=O)CCCN1CCO[C@@]2(CCO[C@H]2C)C1 ZINC000470934225 885436137 /nfs/dbraw/zinc/43/61/37/885436137.db2.gz AFSDTUJHKYSETG-AOMKIAJQSA-N 0 3 408.970 4.063 20 0 HIADHN C[C@@H]1[C@H](C(F)(F)F)CCN1C[C@@H](O)COc1ccc(Cl)cc1Br ZINC000470962842 885461468 /nfs/dbraw/zinc/46/14/68/885461468.db2.gz YKLSTWSEAPWGNP-YUSALJHKSA-N 0 3 416.665 4.115 20 0 HIADHN COc1cc(-c2noc(CN3CC[C@@H](c4ccc(C)cc4C)C3)n2)cc(OC)c1OC ZINC000471000878 885500300 /nfs/dbraw/zinc/50/03/00/885500300.db2.gz KFNXTXJRZHWWRO-QGZVFWFLSA-N 0 3 423.513 4.369 20 0 HIADHN CN1CCN(CC(=O)N[C@@H](Cc2ccccc2)c2ccccc2)C2(CCCCC2)C1 ZINC000471040132 885550978 /nfs/dbraw/zinc/55/09/78/885550978.db2.gz YHTIDTXJKKIBIE-DEOSSOPVSA-N 0 3 405.586 4.037 20 0 HIADHN CN(C(=O)NCc1nnc(-c2ccccc2)s1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000471078576 885604043 /nfs/dbraw/zinc/60/40/43/885604043.db2.gz YBCFHPGGBKNDRA-FQEVSTJZSA-N 0 3 421.570 4.011 20 0 HIADHN CC1CCN([C@H](CNC(=O)CCc2nnc(C3CCCC3)o2)c2cccs2)CC1 ZINC000471084948 885612934 /nfs/dbraw/zinc/61/29/34/885612934.db2.gz JPBDGDFXAWBKGE-GOSISDBHSA-N 0 3 416.591 4.311 20 0 HIADHN Cc1noc(CSc2ccccc2C(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)n1 ZINC000471124531 885661293 /nfs/dbraw/zinc/66/12/93/885661293.db2.gz KXFIVFLBEXVSMV-BTYIYWSLSA-N 0 3 410.543 4.092 20 0 HIADHN C[C@@H](NC(=O)C1(c2ccc(Br)cc2)CC1)[C@H](c1ccccc1)N(C)C ZINC000471137140 885677304 /nfs/dbraw/zinc/67/73/04/885677304.db2.gz NQUBEQHBWBGQCF-DNVCBOLYSA-N 0 3 401.348 4.288 20 0 HIADHN CSc1nc(-c2ccco2)nc(C)c1C(=O)N[C@H](C)[C@@H](c1ccccc1)N(C)C ZINC000471136317 885677635 /nfs/dbraw/zinc/67/76/35/885677635.db2.gz JQMCRUUSAWYEKR-BEFAXECRSA-N 0 3 410.543 4.188 20 0 HIADHN Cc1cc(CSc2ncccc2C(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)no1 ZINC000471139428 885681144 /nfs/dbraw/zinc/68/11/44/885681144.db2.gz HDPZJWLLIBRQBU-UZLBHIALSA-N 0 3 410.543 4.092 20 0 HIADHN CSc1nc(C(C)(C)C)nc(C)c1C(=O)NC[C@@H](C)N(C)Cc1ccccc1 ZINC000471260922 885839711 /nfs/dbraw/zinc/83/97/11/885839711.db2.gz FOMOSBIMSVQXMX-OAHLLOKOSA-N 0 3 400.592 4.055 20 0 HIADHN Cc1ccc(F)cc1-c1nnc(NC(=O)N(CCN(C)C)Cc2cccs2)s1 ZINC000471370613 886008022 /nfs/dbraw/zinc/00/80/22/886008022.db2.gz NDLURJNYGXREFU-UHFFFAOYSA-N 0 3 419.551 4.310 20 0 HIADHN CC(C)Oc1ccc(NC(=O)N(CCN(C)C)Cc2ccccn2)c(C(F)(F)F)c1 ZINC000504093832 913004420 /nfs/dbraw/zinc/00/44/20/913004420.db2.gz HMQVJARBSAWAJJ-UHFFFAOYSA-N 0 3 424.467 4.483 20 0 HIADHN O=C(NCCCn1ccc2ccccc21)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000471484662 886181616 /nfs/dbraw/zinc/18/16/16/886181616.db2.gz LAZZYHJZGZUMPI-UHFFFAOYSA-N 0 3 422.495 4.136 20 0 HIADHN C[C@@H](NC(=O)CCc1nnc(-c2ccc(Cl)cc2)o1)[C@H](c1ccccc1)N(C)C ZINC000471541243 886247965 /nfs/dbraw/zinc/24/79/65/886247965.db2.gz KVRMTNRCIDKKGH-QVKFZJNVSA-N 0 3 412.921 4.130 20 0 HIADHN C[C@@H](NC(=O)c1nn(-c2ccc(F)c(F)c2)c2c1CCC2)[C@@H](c1ccccc1)N(C)C ZINC000471577402 886289223 /nfs/dbraw/zinc/28/92/23/886289223.db2.gz KAKLWBYMZXFOIG-CMJOXMDJSA-N 0 3 424.495 4.060 20 0 HIADHN C[C@H](NC(=O)c1nn(-c2ccc(F)c(F)c2)c2c1CCC2)[C@@H](c1ccccc1)N(C)C ZINC000471577405 886289579 /nfs/dbraw/zinc/28/95/79/886289579.db2.gz KAKLWBYMZXFOIG-WNSKOXEYSA-N 0 3 424.495 4.060 20 0 HIADHN COc1ccc([C@@H](C)NC[C@@H](OC(C)C)c2ccccc2OC)cc1NC(C)=O ZINC000471608881 886324834 /nfs/dbraw/zinc/32/48/34/886324834.db2.gz GOKWTNMFFPRHOF-WAIKUNEKSA-N 0 3 400.519 4.479 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)Cc3nc(-c4ccsc4)oc3C)c2)CC1 ZINC000471625226 886343021 /nfs/dbraw/zinc/34/30/21/886343021.db2.gz BEQOTDPHUILOOD-UHFFFAOYSA-N 0 3 410.543 4.035 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)c2cc3c(C(F)F)nn(C)c3s2)N(C)C)cc1 ZINC000471639505 886356792 /nfs/dbraw/zinc/35/67/92/886356792.db2.gz PCQXDKZROAMVDB-OAHLLOKOSA-N 0 3 406.502 4.168 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)COc3c(Cl)cccc3Cl)c2)CC1 ZINC000471644520 886361213 /nfs/dbraw/zinc/36/12/13/886361213.db2.gz VLHWBENAHCOGEH-UHFFFAOYSA-N 0 3 408.329 4.153 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)[C@H](C)c3ccc(Br)cc3)c2)CC1 ZINC000471662041 886375829 /nfs/dbraw/zinc/37/58/29/886375829.db2.gz ASXIMWHSTOKFOC-MRXNPFEDSA-N 0 3 416.363 4.333 20 0 HIADHN CC(C)Oc1ccccc1CNC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000471668052 886380386 /nfs/dbraw/zinc/38/03/86/886380386.db2.gz ORMANHVLDZWLLV-UHFFFAOYSA-N 0 3 413.484 4.078 20 0 HIADHN COc1ccc(CN(C)C(=O)CN[C@@H](c2ccc(Cl)cc2)C(C)C)cc1OC ZINC000471697283 886403940 /nfs/dbraw/zinc/40/39/40/886403940.db2.gz NEYIAKFFHJPOEA-JOCHJYFZSA-N 0 3 404.938 4.303 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1C[C@H]1c1ccc(OC(F)F)cc1)[C@@H](c1ccccc1)N(C)C ZINC000504146184 913044277 /nfs/dbraw/zinc/04/42/77/913044277.db2.gz UDCBMLRUNFOKDJ-GAZPGATBSA-N 0 3 403.473 4.135 20 0 HIADHN CC(=O)Nc1cc(C(=O)NC[C@H](c2ccc(C)cc2)N(C)C)cc(C(F)(F)F)c1 ZINC000471758755 886490253 /nfs/dbraw/zinc/49/02/53/886490253.db2.gz VPPRPQLIYPSJRB-LJQANCHMSA-N 0 3 407.436 4.005 20 0 HIADHN CC(C)CN(CCN(C)C)C(=O)NCc1ccc(-c2nc3ccccc3s2)o1 ZINC000504162586 913052486 /nfs/dbraw/zinc/05/24/86/913052486.db2.gz GSPSHEJTKJGZRT-UHFFFAOYSA-N 0 3 400.548 4.286 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3ccnc(-c4ccccc4)c3)CC2)C[C@H](C)O1 ZINC000504163963 913052690 /nfs/dbraw/zinc/05/26/90/913052690.db2.gz VAOQKDCRQOELLV-KDURUIRLSA-N 0 3 408.546 4.102 20 0 HIADHN Cc1c2ccccc2oc1CNC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000471922126 886711046 /nfs/dbraw/zinc/71/10/46/886711046.db2.gz FWPDXIAUXZQSPZ-UHFFFAOYSA-N 0 3 409.452 4.346 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2cc(C(C)(C)C)nn2-c2ccccn2)[C@H]1c1ccccc1 ZINC000471943944 886745412 /nfs/dbraw/zinc/74/54/12/886745412.db2.gz PBKQUCCNMJMPLX-XMSQKQJNSA-N 0 3 418.545 4.132 20 0 HIADHN C[C@@H](CNC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1)Cc1cccs1 ZINC000471973318 886805027 /nfs/dbraw/zinc/80/50/27/886805027.db2.gz OVCXRODPJSGPOW-IUDNXUCKSA-N 0 3 403.514 4.031 20 0 HIADHN COc1ccccc1[C@@H](CNCc1cc2c(cc1SC)OCCO2)OC(C)C ZINC000472038015 886856939 /nfs/dbraw/zinc/85/69/39/886856939.db2.gz LMWZZCUJGMMCHO-OAQYLSRUSA-N 0 3 403.544 4.444 20 0 HIADHN COc1ccccc1[C@H](CNCc1c(C(C)C)nc2sc(C)nn12)OC(C)C ZINC000472058335 886868480 /nfs/dbraw/zinc/86/84/80/886868480.db2.gz OPVNDKIDTZYDRP-IBGZPJMESA-N 0 3 402.564 4.487 20 0 HIADHN Cc1ccc([C@H](NC(=O)N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)c2ccccn2)cc1 ZINC000472069620 886875161 /nfs/dbraw/zinc/87/51/61/886875161.db2.gz KRXUFAZYNMNHAH-OPHFCASCSA-N 0 3 414.553 4.442 20 0 HIADHN CC(C)c1cccc(O[C@@H](C(=O)N[C@@H](C)CCN2CCN(C)CC2)c2ccccc2)c1 ZINC000472084363 886884603 /nfs/dbraw/zinc/88/46/03/886884603.db2.gz APHUWDPIQLXGKK-SQJMNOBHSA-N 0 3 423.601 4.072 20 0 HIADHN C[C@H](CCN1CCN(C)CC1)NC(=O)c1ccc(Oc2ccc(Cl)cc2)c(F)c1 ZINC000472096975 886890784 /nfs/dbraw/zinc/89/07/84/886890784.db2.gz VHMUEOFMSNHOCZ-MRXNPFEDSA-N 0 3 419.928 4.027 20 0 HIADHN CCN(CC)[C@H](CNC(=O)[C@H]1C[C@@H]1c1cc(OC)ccc1OC)c1ccsc1 ZINC000472120185 886907725 /nfs/dbraw/zinc/90/77/25/886907725.db2.gz NKZCVQDSYGBACO-YZGWKJHDSA-N 0 3 402.560 4.068 20 0 HIADHN C[C@@]1(CNC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)CCCc2ccccc21 ZINC000472129155 886921400 /nfs/dbraw/zinc/92/14/00/886921400.db2.gz YTHIOFOUCUZSFX-AJTFCVKESA-N 0 3 423.523 4.385 20 0 HIADHN C[C@@H](NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1cccc(F)c1F ZINC000472138170 886930997 /nfs/dbraw/zinc/93/09/97/886930997.db2.gz JZZLHNPPBIYYKF-LMWSTFAQSA-N 0 3 405.411 4.130 20 0 HIADHN CC1CCN([C@H](CNC(=O)N2CCO[C@@H](c3cccs3)C2)c2cccs2)CC1 ZINC000472149401 886946190 /nfs/dbraw/zinc/94/61/90/886946190.db2.gz CPEMWQVSOOOZTE-QZTJIDSGSA-N 0 3 419.616 4.366 20 0 HIADHN CC1CCN([C@H](CNC(=O)N2CCO[C@H](c3cccs3)C2)c2cccs2)CC1 ZINC000472149379 886946855 /nfs/dbraw/zinc/94/68/55/886946855.db2.gz CPEMWQVSOOOZTE-MSOLQXFVSA-N 0 3 419.616 4.366 20 0 HIADHN COc1ccc([C@@H](NC[C@@H](O)CCOC(C)C)c2ccccc2)cc1Br ZINC000472165010 886963254 /nfs/dbraw/zinc/96/32/54/886963254.db2.gz WOIMEINPADNOMK-RXVVDRJESA-N 0 3 422.363 4.313 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2ccc(-c3noc(C(F)F)n3)cc2)[C@@H]1c1ccccc1 ZINC000472315246 887145878 /nfs/dbraw/zinc/14/58/78/887145878.db2.gz SHGKNIRYULVGKV-SJORKVTESA-N 0 3 413.428 4.241 20 0 HIADHN COc1cc(-c2nnc(CN3CC[C@H](Cc4ccccc4)[C@@H]3C)o2)cc(OC)c1OC ZINC000472324818 887158584 /nfs/dbraw/zinc/15/85/84/887158584.db2.gz ILXCZHJRKZSWBA-FUHWJXTLSA-N 0 3 423.513 4.216 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2ccnc(Sc3ccccn3)c2)[C@@H]1c1ccccc1 ZINC000472327927 887160395 /nfs/dbraw/zinc/16/03/95/887160395.db2.gz OZXOHBQAYOXAGR-NQIIRXRSSA-N 0 3 405.527 4.195 20 0 HIADHN Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000472328853 887162893 /nfs/dbraw/zinc/16/28/93/887162893.db2.gz OXDUPPYNDNNDOM-XZOQPEGZSA-N 0 3 420.557 4.234 20 0 HIADHN COc1ccc(Br)c(NC(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)c1 ZINC000472333156 887166446 /nfs/dbraw/zinc/16/64/46/887166446.db2.gz BEEXTLMQFXSPID-FUHWJXTLSA-N 0 3 404.308 4.025 20 0 HIADHN Cc1cc(-c2noc([C@@H](C)NC(=O)c3oc4ccccc4c3CN(C)C)n2)ccc1F ZINC000472371807 887209726 /nfs/dbraw/zinc/20/97/26/887209726.db2.gz YFCLVNXZEOQKEW-CQSZACIVSA-N 0 3 422.460 4.483 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)CCc3cnc4ccccc4c3)c2)CC1 ZINC000472434061 887281416 /nfs/dbraw/zinc/28/14/16/887281416.db2.gz PCOBSEGUXMKVFW-UHFFFAOYSA-N 0 3 402.542 4.337 20 0 HIADHN Cc1[nH]c2ccccc2c1C1=CCN(C[C@@H](O)COc2cccc3[nH]ccc32)CC1 ZINC000472580348 887461496 /nfs/dbraw/zinc/46/14/96/887461496.db2.gz JTXIDYQATORLOH-LJQANCHMSA-N 0 3 401.510 4.487 20 0 HIADHN FC(F)n1ccnc1CN1CCN(CCCCc2cccc(C(F)(F)F)c2)CC1 ZINC000472588700 887464945 /nfs/dbraw/zinc/46/49/45/887464945.db2.gz KRVFLBNTHJLVNX-UHFFFAOYSA-N 0 3 416.438 4.438 20 0 HIADHN O=S(=O)(Cc1cc(Cl)ccc1F)NCc1ccccc1CN1CCCCC1 ZINC000472585219 887465265 /nfs/dbraw/zinc/46/52/65/887465265.db2.gz GAICQUJNLNXSNV-UHFFFAOYSA-N 0 3 410.942 4.085 20 0 HIADHN Cc1ccc(NC(=O)C2CC2)cc1NC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000472676566 887530987 /nfs/dbraw/zinc/53/09/87/887530987.db2.gz ILTOBRMGQLTGRG-JOCHJYFZSA-N 0 3 420.557 4.472 20 0 HIADHN CN(C(=O)Nc1cc2c(cc1Cl)OCCO2)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000472683712 887537583 /nfs/dbraw/zinc/53/75/83/887537583.db2.gz DFQARJFDHATMNP-KRWDZBQOSA-N 0 3 415.921 4.240 20 0 HIADHN O[C@@H](COc1cccc2[nH]ccc21)CN(CCc1ccccn1)Cc1ccc(F)cc1 ZINC000472689217 887543383 /nfs/dbraw/zinc/54/33/83/887543383.db2.gz SJBJGMKGNFKSDN-JOCHJYFZSA-N 0 3 419.500 4.187 20 0 HIADHN COCCOc1cc(C)ccc1NC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000472704084 887556393 /nfs/dbraw/zinc/55/63/93/887556393.db2.gz MYRQCMSSMASPGB-OAQYLSRUSA-N 0 3 411.546 4.149 20 0 HIADHN CC(C)CNC(=O)c1ccc(NC(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000472707972 887559639 /nfs/dbraw/zinc/55/96/39/887559639.db2.gz MBHMWYQVKRQOJL-QHCPKHFHSA-N 0 3 422.573 4.201 20 0 HIADHN COC[C@H](NC(=O)NC[C@H](c1cccs1)N1CCC(C)CC1)c1ccc(C)o1 ZINC000472819254 887663739 /nfs/dbraw/zinc/66/37/39/887663739.db2.gz ZRIXRVXYHOKNHS-ZWKOTPCHSA-N 0 3 405.564 4.109 20 0 HIADHN Cc1c(COc2ccccc2)cccc1NC(=O)N(CCN(C)C)C[C@H]1CCCO1 ZINC000472830468 887678263 /nfs/dbraw/zinc/67/82/63/887678263.db2.gz JGJQQMPQVANZGP-JOCHJYFZSA-N 0 3 411.546 4.149 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2ccc(F)cc2-c2nc(C3CC3)no2)N(C)C)cc1 ZINC000472861986 887717661 /nfs/dbraw/zinc/71/76/61/887717661.db2.gz XNDPIFHOLFWMIG-HXUWFJFHSA-N 0 3 423.492 4.486 20 0 HIADHN C[C@@H](CCN1CCN(C)CC1)NC(=O)N[C@H](CC1CCCCC1)c1ccccc1 ZINC000472904833 887750471 /nfs/dbraw/zinc/75/04/71/887750471.db2.gz MFYOEUKYVDSALS-NZQKXSOJSA-N 0 3 400.611 4.023 20 0 HIADHN CCN1CCC[C@@H](CN(C)C(=O)C2(c3ccccc3C)CCC2)[C@@H]1c1cnn(C)c1 ZINC000473028319 887851965 /nfs/dbraw/zinc/85/19/65/887851965.db2.gz ODLGOFCAWIZKMI-NZQKXSOJSA-N 0 3 408.590 4.082 20 0 HIADHN CCOC(=O)CCc1ccc(NC(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000473079937 887896060 /nfs/dbraw/zinc/89/60/60/887896060.db2.gz HUWROCKIRWQBQN-HSZRJFAPSA-N 0 3 423.557 4.311 20 0 HIADHN C[C@H]1CCc2c(sc3nc(CCN4CC[C@]5(C4)OCc4ccccc45)nc(N)c23)C1 ZINC000473178115 887958359 /nfs/dbraw/zinc/95/83/59/887958359.db2.gz WAAIWHFJKKOZST-IZHWHUGBSA-N 0 3 420.582 4.072 20 0 HIADHN C[C@@H](NC(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1)c1ccc(Cl)cn1 ZINC000473182920 887961952 /nfs/dbraw/zinc/96/19/52/887961952.db2.gz AKWXNBLFKRZCLC-AUUYWEPGSA-N 0 3 411.855 4.367 20 0 HIADHN O=C(NC[C@H]1CCN(Cc2ccccc2)C1)c1ccccc1C(=O)c1ccc(F)cc1 ZINC000473309953 888056688 /nfs/dbraw/zinc/05/66/88/888056688.db2.gz VVMWCQVRSHIDIJ-HXUWFJFHSA-N 0 3 416.496 4.309 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1c[nH]cc1-c1ccccc1F ZINC000473509234 888237504 /nfs/dbraw/zinc/23/75/04/888237504.db2.gz COVKNOCWKPGUKR-UHFFFAOYSA-N 0 3 409.427 4.356 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)[C@H]1CCCC[C@H]1C(F)(F)F ZINC000473512303 888242142 /nfs/dbraw/zinc/24/21/42/888242142.db2.gz JZKXVTRTQFJSQU-PFSRBDOWSA-N 0 3 400.407 4.277 20 0 HIADHN O=C(CSc1ccc2c(c1)CCC2)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473513644 888243350 /nfs/dbraw/zinc/24/33/50/888243350.db2.gz OQNXYLAHSKCTCN-UHFFFAOYSA-N 0 3 412.521 4.189 20 0 HIADHN O=C(Cn1ccc2ccc(Cl)cc21)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473522931 888258206 /nfs/dbraw/zinc/25/82/06/888258206.db2.gz MCRGSEZNXCLAKV-UHFFFAOYSA-N 0 3 413.871 4.216 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473523113 888258345 /nfs/dbraw/zinc/25/83/45/888258345.db2.gz GEXPCCWQQUWQLS-UHFFFAOYSA-N 0 3 420.479 4.024 20 0 HIADHN C[C@@H](Cc1ccccc1Cl)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473523358 888258382 /nfs/dbraw/zinc/25/83/82/888258382.db2.gz VLPIPMRPGUXHLS-IGEOTXOUSA-N 0 3 402.888 4.440 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)[C@H]1C[C@@H]1c1cccc(Cl)c1 ZINC000473527722 888265578 /nfs/dbraw/zinc/26/55/78/888265578.db2.gz RXEKGALQIZKUFF-HIEASXQVSA-N 0 3 400.872 4.365 20 0 HIADHN COCCC[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000473537062 888276652 /nfs/dbraw/zinc/27/66/52/888276652.db2.gz YZENITPSZQOFES-ISKFKSNPSA-N 0 3 412.549 4.192 20 0 HIADHN CCc1nc2cc(CNC(=O)N[C@H](CN(C)C)c3ccc(F)cc3)ccc2n1C1CC1 ZINC000504419660 913233463 /nfs/dbraw/zinc/23/34/63/913233463.db2.gz QCZNYGWPIJPCRC-OAQYLSRUSA-N 0 3 423.536 4.175 20 0 HIADHN CCOc1cccc2[nH]cc(CC(=O)Nc3ccc(CCN4CCSCC4)cc3)c21 ZINC000473614146 888354105 /nfs/dbraw/zinc/35/41/05/888354105.db2.gz KMRVIQJLAHAZLY-UHFFFAOYSA-N 0 3 423.582 4.339 20 0 HIADHN Cc1nc(CNC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)oc1-c1ccc(Cl)cc1 ZINC000473678470 888443480 /nfs/dbraw/zinc/44/34/80/888443480.db2.gz QPCSFWKGIYFZTP-HXUWFJFHSA-N 0 3 424.932 4.377 20 0 HIADHN Cc1ccc(Oc2ccccc2)c(NC(=O)NC(C)(C)CCN2CCN(C)CC2)c1 ZINC000473690566 888464434 /nfs/dbraw/zinc/46/44/34/888464434.db2.gz DMJMKDVLWMNDLO-UHFFFAOYSA-N 0 3 410.562 4.325 20 0 HIADHN CCN(C(=O)c1nn(-c2ccccc2)cc1C)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000473758591 888549891 /nfs/dbraw/zinc/54/98/91/888549891.db2.gz PYSHAAFHNBLDSI-OFNKIYASSA-N 0 3 402.542 4.478 20 0 HIADHN CN(C)[C@H](CNC(=O)Nc1cnn(-c2ccccc2)c1C(F)(F)F)c1ccccc1 ZINC000473784541 888592472 /nfs/dbraw/zinc/59/24/72/888592472.db2.gz VOWMOGUJARTMMJ-GOSISDBHSA-N 0 3 417.435 4.316 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3C[C@H](c4ccc(F)cc4)C[C@@H]3C)c2)CC1 ZINC000473803713 888624549 /nfs/dbraw/zinc/62/45/49/888624549.db2.gz DYSYWAIQDAQYSS-AZUAARDMSA-N 0 3 410.537 4.378 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3C[C@H](c4ccc(F)cc4)C[C@H]3C)c2)CC1 ZINC000473803716 888626125 /nfs/dbraw/zinc/62/61/25/888626125.db2.gz DYSYWAIQDAQYSS-UYAOXDASSA-N 0 3 410.537 4.378 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)NC[C@@H]3CCCO[C@H]3c3ccccc3)c2)CC1 ZINC000473818295 888647188 /nfs/dbraw/zinc/64/71/88/888647188.db2.gz CDOWGNYJPJAMQD-URXFXBBRSA-N 0 3 422.573 4.118 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)NC[C@H]3CCCO[C@@H]3c3ccccc3)c2)CC1 ZINC000473818297 888647341 /nfs/dbraw/zinc/64/73/41/888647341.db2.gz CDOWGNYJPJAMQD-ZJSXRUAMSA-N 0 3 422.573 4.118 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CC[C@@H](c4cc(C)cc(C)c4)C3)c2)CC1 ZINC000473823124 888654808 /nfs/dbraw/zinc/65/48/08/888654808.db2.gz QLPWOTVRPRVMME-OAQYLSRUSA-N 0 3 406.574 4.467 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CCCC[C@H]3Cc3ccccc3)c2)CC1 ZINC000473824779 888656341 /nfs/dbraw/zinc/65/63/41/888656341.db2.gz OWVCJIRSEWSESU-DEOSSOPVSA-N 0 3 406.574 4.458 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CC=C(c4cccc(C)c4)CC3)c2)CC1 ZINC000473833813 888670083 /nfs/dbraw/zinc/67/00/83/888670083.db2.gz ZKTHWSOKCLMHFW-UHFFFAOYSA-N 0 3 404.558 4.458 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@H](C)c3nc(C(C)(C)C)cs3)c2)CC1 ZINC000473836985 888673803 /nfs/dbraw/zinc/67/38/03/888673803.db2.gz PAENPFSWQKLHOI-MRXNPFEDSA-N 0 3 415.607 4.465 20 0 HIADHN CCOc1cccc2[nH]cc(CC(=O)N(C)[C@@H]3CCCN(Cc4ccccc4)C3)c21 ZINC000473900276 888775030 /nfs/dbraw/zinc/77/50/30/888775030.db2.gz GUOPFTCLKAVWGI-OAQYLSRUSA-N 0 3 405.542 4.232 20 0 HIADHN COc1ccc2c(c1)C(C)(C)C[C@@H]2NCc1ccc(C(=O)N2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000474026967 888877504 /nfs/dbraw/zinc/87/75/04/888877504.db2.gz BCTCRGCZURVBES-RHGYRFJNSA-N 0 3 422.569 4.457 20 0 HIADHN Cc1ccccc1NC(=O)C[C@H](C)N[C@H]1CCN(c2ccc(Cl)cc2Cl)C1=O ZINC000474099228 888922023 /nfs/dbraw/zinc/92/20/23/888922023.db2.gz RPRWSEALSCERKY-KSSFIOAISA-N 0 3 420.340 4.414 20 0 HIADHN CN(C(=O)NCC1(CCOCc2ccccc2)CC1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000474142237 888967911 /nfs/dbraw/zinc/96/79/11/888967911.db2.gz NNXABYYVZHOCAU-DEOSSOPVSA-N 0 3 421.585 4.289 20 0 HIADHN C[C@H](NC(=O)c1[nH]c2ccccc2c1Br)[C@@H](c1ccccc1)N(C)C ZINC000474172214 889011196 /nfs/dbraw/zinc/01/11/96/889011196.db2.gz RNTCAFZUAGURFE-DJJJIMSYSA-N 0 3 400.320 4.352 20 0 HIADHN CN(Cc1nc(=O)c2c(-c3ccco3)csc2[nH]1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000474235843 889080066 /nfs/dbraw/zinc/08/00/66/889080066.db2.gz SGEQZOBFSAMQQR-QGZVFWFLSA-N 0 3 420.538 4.363 20 0 HIADHN CN(Cc1nc(=O)c2c(-c3ccco3)csc2[nH]1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000474235842 889080413 /nfs/dbraw/zinc/08/04/13/889080413.db2.gz SGEQZOBFSAMQQR-KRWDZBQOSA-N 0 3 420.538 4.363 20 0 HIADHN Cc1ccc(CC(=O)NC2CCN([C@H](C)c3ccncc3)CC2)cc1Br ZINC000474245191 889094888 /nfs/dbraw/zinc/09/48/88/889094888.db2.gz BHNLLUORNBITAA-MRXNPFEDSA-N 0 3 416.363 4.037 20 0 HIADHN CCOc1ccc([C@@H]2CCCN2C(=O)CN2CC[C@@H](c3ccc(OC)cc3)C2)cc1 ZINC000504533930 913313314 /nfs/dbraw/zinc/31/33/14/913313314.db2.gz PFDNOHXGEYGQSJ-QPPBQGQZSA-N 0 3 408.542 4.247 20 0 HIADHN CCOC(=O)c1coc(CN(CC)C2CCN(c3cc(C)nc(C(C)C)n3)CC2)c1 ZINC000474265291 889127671 /nfs/dbraw/zinc/12/76/71/889127671.db2.gz GRQJYMDVAUNMLA-UHFFFAOYSA-N 0 3 414.550 4.169 20 0 HIADHN C[C@@H]1CCN(Cc2cnc(-c3cnn(C)c3)nc2)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000474270926 889132923 /nfs/dbraw/zinc/13/29/23/889132923.db2.gz PSMGDYZFNXNARM-KUHUBIRLSA-N 0 3 401.436 4.479 20 0 HIADHN COc1ccc2c(c1)CN(Cc1cnc(-c3cnn(C)c3)nc1)[C@H](C1CCCCC1)C2 ZINC000474282899 889147924 /nfs/dbraw/zinc/14/79/24/889147924.db2.gz LEOIBEBBZCRWLV-DEOSSOPVSA-N 0 3 417.557 4.393 20 0 HIADHN Cc1ccc(CCC[N@@H+](C)Cc2cccc([N-]S(=O)(=O)c3ccccc3)c2)cn1 ZINC000474283271 889148528 /nfs/dbraw/zinc/14/85/28/889148528.db2.gz MOVPEPRZOBIJNS-UHFFFAOYSA-N 0 3 409.555 4.255 20 0 HIADHN Cc1ccc(CCC[N@H+](C)Cc2cccc([N-]S(=O)(=O)c3ccccc3)c2)cn1 ZINC000474283271 889148532 /nfs/dbraw/zinc/14/85/32/889148532.db2.gz MOVPEPRZOBIJNS-UHFFFAOYSA-N 0 3 409.555 4.255 20 0 HIADHN C[C@@H](CS(=O)(=O)c1ccccc1)N[C@H]1CCN(c2ccc(Cl)cc2Cl)C1 ZINC000474423079 889286807 /nfs/dbraw/zinc/28/68/07/889286807.db2.gz ZFPPBQSRCUIJCP-HOCLYGCPSA-N 0 3 413.370 4.024 20 0 HIADHN CC(C)n1cnnc1-c1ccccc1NC(=O)N[C@H](C)[C@H](c1ccccc1)N(C)C ZINC000474440372 889305502 /nfs/dbraw/zinc/30/55/02/889305502.db2.gz SBEDNHPRTNUWJY-DYESRHJHSA-N 0 3 406.534 4.339 20 0 HIADHN Cc1ccnc(Oc2ccc(NC(=O)N(C)[C@@H]3CCN(Cc4ccccc4)C3)cc2)n1 ZINC000474595113 889463273 /nfs/dbraw/zinc/46/32/73/889463273.db2.gz XVMLLSZLEIUASV-OAQYLSRUSA-N 0 3 417.513 4.316 20 0 HIADHN Cc1ccc(NC(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)cc1OCC(F)F ZINC000474596840 889464758 /nfs/dbraw/zinc/46/47/58/889464758.db2.gz VQJUSKZKXBAXOQ-LJQANCHMSA-N 0 3 403.473 4.377 20 0 HIADHN Cc1c(Br)cccc1NC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000474599394 889466240 /nfs/dbraw/zinc/46/62/40/889466240.db2.gz LBEQSKMYFYWDKA-KRWDZBQOSA-N 0 3 402.336 4.496 20 0 HIADHN COc1ccc(Br)c(NC(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000474606665 889473510 /nfs/dbraw/zinc/47/35/10/889473510.db2.gz VCYGYMDHYAMEIK-INIZCTEOSA-N 0 3 418.335 4.196 20 0 HIADHN COc1cc(NC(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)ccc1Br ZINC000474625299 889487551 /nfs/dbraw/zinc/48/75/51/889487551.db2.gz ZCMYXLWJTGXZFU-QGZVFWFLSA-N 0 3 418.335 4.196 20 0 HIADHN Cc1noc(C)c1COc1ccccc1C(=O)N[C@H](C)[C@H](c1ccccc1)N(C)C ZINC000474670376 889533955 /nfs/dbraw/zinc/53/39/55/889533955.db2.gz SRJKKYAOMXKSKC-UZUQRXQVSA-N 0 3 407.514 4.292 20 0 HIADHN CSc1nnc(CCCNCc2c(F)cccc2Br)n1CC(C)C ZINC000474713510 889571376 /nfs/dbraw/zinc/57/13/76/889571376.db2.gz XSZADHBEFRMGMF-UHFFFAOYSA-N 0 3 415.376 4.280 20 0 HIADHN COc1ccc(Br)cc1NC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000474723908 889580565 /nfs/dbraw/zinc/58/05/65/889580565.db2.gz HPEMBUUDSVJNDE-KRWDZBQOSA-N 0 3 418.335 4.196 20 0 HIADHN COc1ccc(NC(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)c(C(F)(F)F)c1 ZINC000474740612 889595916 /nfs/dbraw/zinc/59/59/16/889595916.db2.gz YWEBHIVUYBGJIX-MRXNPFEDSA-N 0 3 407.436 4.452 20 0 HIADHN CC(=O)Nc1ccc(Cl)c(NC(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000474740618 889595960 /nfs/dbraw/zinc/59/59/60/889595960.db2.gz YYTPBCYILSNWQW-GOSISDBHSA-N 0 3 400.910 4.037 20 0 HIADHN Cn1cc(-c2ncc(CNCCOc3c(Cl)cc(Cl)cc3Cl)cn2)cn1 ZINC000474799007 889651654 /nfs/dbraw/zinc/65/16/54/889651654.db2.gz GBOILDJBJBQAPN-UHFFFAOYSA-N 0 3 412.708 4.006 20 0 HIADHN CN1CCN(CCC(C)(C)NC(=O)c2csc(-c3cccc4ccccc43)n2)CC1 ZINC000474806682 889660569 /nfs/dbraw/zinc/66/05/69/889660569.db2.gz GORKZIPOEPUMIZ-UHFFFAOYSA-N 0 3 422.598 4.109 20 0 HIADHN CC(C)(C)N(CC(=O)N1CCC(C(=O)Nc2ccccc2)CC1)Cc1ccccc1 ZINC000474828550 889684962 /nfs/dbraw/zinc/68/49/62/889684962.db2.gz FJOMOLIDYMUTMR-UHFFFAOYSA-N 0 3 407.558 4.164 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)Cc2csc(-c3ccc(Cl)cc3)n2)CC1 ZINC000474887985 889745720 /nfs/dbraw/zinc/74/57/20/889745720.db2.gz RRCJVHUXNLTJIX-UHFFFAOYSA-N 0 3 421.994 4.012 20 0 HIADHN Cn1cc(-c2ncc(CNC3(c4ccc(C(F)(F)F)cc4)CCCC3)cn2)cn1 ZINC000474944734 889801461 /nfs/dbraw/zinc/80/14/61/889801461.db2.gz UDMMFKAAIHYOLH-UHFFFAOYSA-N 0 3 401.436 4.455 20 0 HIADHN CC(C)(C)[C@@H](CN1CCc2ccccc2C1)NC(=O)c1ncccc1Br ZINC000474959819 889815022 /nfs/dbraw/zinc/81/50/22/889815022.db2.gz KVYWLNGHBFKNCE-GOSISDBHSA-N 0 3 416.363 4.047 20 0 HIADHN COCCN1CCC(NC(=O)Nc2ccc(-c3ccc(Cl)cc3Cl)nc2)CC1 ZINC000474966205 889821526 /nfs/dbraw/zinc/82/15/26/889821526.db2.gz IMZCBTSFWDWUFG-UHFFFAOYSA-N 0 3 423.344 4.288 20 0 HIADHN CCN1CCC[C@@H](CN(C)C(=O)NCC2(C)CCC(C)CC2)[C@@H]1c1cnn(C)c1 ZINC000474995914 889847738 /nfs/dbraw/zinc/84/77/38/889847738.db2.gz VNWREDKKCWYJQG-XPECPCTNSA-N 0 3 403.615 4.051 20 0 HIADHN CCN(C(=O)N[C@H](C)c1cc(OC)ccc1OC)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475005892 889857706 /nfs/dbraw/zinc/85/77/06/889857706.db2.gz CJYZUWDQTYKJNM-QUCCMNQESA-N 0 3 411.546 4.071 20 0 HIADHN CCN(C(=O)Nc1nnc(-c2ccsc2)s1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475007800 889860990 /nfs/dbraw/zinc/86/09/90/889860990.db2.gz RQYHXSKCDBTKRE-KRWDZBQOSA-N 0 3 413.572 4.395 20 0 HIADHN CC(C)[C@H](NC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1)c1ccc2c(c1)OCCO2 ZINC000475007956 889861082 /nfs/dbraw/zinc/86/10/82/889861082.db2.gz JZWJFYDZAPYXOT-URXFXBBRSA-N 0 3 423.557 4.071 20 0 HIADHN CCN(C(=O)Nc1cc(C(=O)NC2CC2)ccc1C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475009835 889863960 /nfs/dbraw/zinc/86/39/60/889863960.db2.gz MCHGSDBANNKLFM-JOCHJYFZSA-N 0 3 420.557 4.016 20 0 HIADHN CN(C(=O)N[C@H](c1ccc(F)cc1)C(F)(F)F)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475094144 889941105 /nfs/dbraw/zinc/94/11/05/889941105.db2.gz IEBMCMBRMPLTLW-RTBURBONSA-N 0 3 409.427 4.345 20 0 HIADHN CN(C(=O)N[C@@H](c1nccs1)c1ccccc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475105225 889954166 /nfs/dbraw/zinc/95/41/66/889954166.db2.gz BJVGBPLXDXZGJG-LEWJYISDSA-N 0 3 406.555 4.148 20 0 HIADHN CC1CCN([C@H](CNC(=O)c2ncccc2Br)c2ccccc2)CC1 ZINC000475122048 889978869 /nfs/dbraw/zinc/97/88/69/889978869.db2.gz SQPLFNBXYIMOBO-GOSISDBHSA-N 0 3 402.336 4.047 20 0 HIADHN CCN(C(=O)NCCc1nc(C(C)(C)C)cs1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475158585 890023395 /nfs/dbraw/zinc/02/33/95/890023395.db2.gz VRZZTHBLHJVVPC-IBGZPJMESA-N 0 3 414.619 4.289 20 0 HIADHN CCN(C(=O)N[C@H](c1ccccc1)[C@@H]1CCCO1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475161584 890027061 /nfs/dbraw/zinc/02/70/61/890027061.db2.gz JVUDZCZQKCSRTN-TZRRMPRUSA-N 0 3 407.558 4.213 20 0 HIADHN Fc1ccc(CNCCCCn2cc(Br)cn2)c(Br)c1 ZINC000475203714 890073248 /nfs/dbraw/zinc/07/32/48/890073248.db2.gz FBSNCDVXZQMJNC-UHFFFAOYSA-N 0 3 405.109 4.117 20 0 HIADHN CCOC(=O)c1nnc(C2CC[NH+](CCCCc3cccc(C(F)(F)F)c3)CC2)[n-]1 ZINC000475217279 890087390 /nfs/dbraw/zinc/08/73/90/890087390.db2.gz DEOYZQRLADJJCW-UHFFFAOYSA-N 0 3 424.467 4.203 20 0 HIADHN CCOC(=O)c1n[n-]c(C2CC[NH+](CCCCc3cccc(C(F)(F)F)c3)CC2)n1 ZINC000475217279 890087414 /nfs/dbraw/zinc/08/74/14/890087414.db2.gz DEOYZQRLADJJCW-UHFFFAOYSA-N 0 3 424.467 4.203 20 0 HIADHN CC1CCN([C@H](CNC(=O)Nc2cccc(-c3ncn(C)n3)c2)c2cccs2)CC1 ZINC000475237814 890111549 /nfs/dbraw/zinc/11/15/49/890111549.db2.gz SSMQGXBKHKAFRM-LJQANCHMSA-N 0 3 424.574 4.138 20 0 HIADHN Fc1ccccc1CO[C@H]1CCCN(Cc2c[nH]nc2-c2ccc3c(c2)OCCO3)C1 ZINC000475285468 890186299 /nfs/dbraw/zinc/18/62/99/890186299.db2.gz MIDTXVMAVIWXHH-FQEVSTJZSA-N 0 3 423.488 4.168 20 0 HIADHN Cc1nc(COc2cccc(C(=O)N(C)[C@@H]3CCN(Cc4ccccc4)C3)c2)cs1 ZINC000475300957 890208032 /nfs/dbraw/zinc/20/80/32/890208032.db2.gz HWOMEANPUWFDNT-JOCHJYFZSA-N 0 3 421.566 4.377 20 0 HIADHN Cc1cc(CSc2ncccc2C(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)no1 ZINC000475303235 890211784 /nfs/dbraw/zinc/21/17/84/890211784.db2.gz GZBZHBUFXDWNHA-FQEVSTJZSA-N 0 3 422.554 4.017 20 0 HIADHN Cc1cc(C(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)ccc1NC(=O)CC(C)C ZINC000475305705 890216961 /nfs/dbraw/zinc/21/69/61/890216961.db2.gz PDBZUAQUCSGLHE-QFIPXVFZSA-N 0 3 407.558 4.326 20 0 HIADHN O=C(NC1CCN(Cc2ccccc2)CC1)c1cnc(Cc2ccccc2F)s1 ZINC000475307797 890218847 /nfs/dbraw/zinc/21/88/47/890218847.db2.gz HIVFFOXXPTXIAJ-UHFFFAOYSA-N 0 3 409.530 4.267 20 0 HIADHN Cc1c(C(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)cnn1-c1cccc(Cl)c1 ZINC000475311799 890224356 /nfs/dbraw/zinc/22/43/56/890224356.db2.gz LCGFKPFOMBQXMB-NRFANRHFSA-N 0 3 408.933 4.181 20 0 HIADHN COc1cccc(Cl)c1-c1noc(C)c1C(=O)NC[C@@H](C)N1CCC(C)CC1 ZINC000475317860 890233352 /nfs/dbraw/zinc/23/33/52/890233352.db2.gz LVLIWCXRTVRVBJ-CQSZACIVSA-N 0 3 405.926 4.162 20 0 HIADHN Cc1ccc(-c2cnc(CCC(=O)N(C)[C@H]3CCN(Cc4ccccc4)C3)o2)cc1 ZINC000475320612 890238004 /nfs/dbraw/zinc/23/80/04/890238004.db2.gz LBLAQVUGUUDYQZ-QFIPXVFZSA-N 0 3 403.526 4.316 20 0 HIADHN CCOc1c(Cl)cc(C(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)cc1OC ZINC000475322796 890241335 /nfs/dbraw/zinc/24/13/35/890241335.db2.gz SIKWBLZTGUGMLG-SFHVURJKSA-N 0 3 402.922 4.094 20 0 HIADHN COC(=O)[C@H]1CCN(Cc2cn(-c3ccccc3)nc2-c2ccc(OC)cc2)C[C@H]1C ZINC000475360872 890288241 /nfs/dbraw/zinc/28/82/41/890288241.db2.gz CRCTXRIWISCCFM-JPYJTQIMSA-N 0 3 419.525 4.179 20 0 HIADHN COC(=O)[C@@H]1CCN(Cc2cccc(NC(=O)c3ccccc3Cl)c2)C[C@H]1C ZINC000475364676 890293950 /nfs/dbraw/zinc/29/39/50/890293950.db2.gz AGKYSGJBOGECBA-CRAIPNDOSA-N 0 3 400.906 4.223 20 0 HIADHN COC(=O)[C@@H]1CCN(Cc2cccc(NC(=O)c3ccc(Cl)cc3)c2)C[C@H]1C ZINC000475376144 890306494 /nfs/dbraw/zinc/30/64/94/890306494.db2.gz WBYXZOVLLJCCPW-FOIQADDNSA-N 0 3 400.906 4.223 20 0 HIADHN CC(C)n1cc2cc(NC(=O)N(C)C3CCN(CCc4ccccn4)CC3)ccc2n1 ZINC000475391694 890317976 /nfs/dbraw/zinc/31/79/76/890317976.db2.gz GGTLILVFXQCRNZ-UHFFFAOYSA-N 0 3 420.561 4.183 20 0 HIADHN CC(C)C(=O)Nc1ccc(Cl)c(C(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000475421361 890342653 /nfs/dbraw/zinc/34/26/53/890342653.db2.gz CJXMKQPQCNHDKL-LJQANCHMSA-N 0 3 413.949 4.281 20 0 HIADHN CC(C)(C)n1cc(CNCC2(S(C)(=O)=O)CCC2)c(-c2ccccc2Cl)n1 ZINC000475432695 890350993 /nfs/dbraw/zinc/35/09/93/890350993.db2.gz SXNFCVWIAFBTEX-UHFFFAOYSA-N 0 3 409.983 4.015 20 0 HIADHN COc1cccc(COc2cccc(Cl)c2CNC[C@H]2CCCN(C(C)=O)C2)c1 ZINC000475437631 890358155 /nfs/dbraw/zinc/35/81/55/890358155.db2.gz CHBDMWIVZRSZCC-LJQANCHMSA-N 0 3 416.949 4.276 20 0 HIADHN C[C@H](N[C@@H](C(N)=O)c1cccc(Br)c1)C1CCC(C(F)(F)F)CC1 ZINC000475442481 890360571 /nfs/dbraw/zinc/36/05/71/890360571.db2.gz QQFUQROAAIBOJR-NEGXKODNSA-N 0 3 407.274 4.322 20 0 HIADHN CN(C(=O)c1ccnc(OCc2ccccc2)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475541746 890466025 /nfs/dbraw/zinc/46/60/25/890466025.db2.gz HHPAFVIOWIRNLO-HSZRJFAPSA-N 0 3 401.510 4.007 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)Nc2ccc(-c3ncc(C(C)C)o3)cc2)CC1 ZINC000475606595 890534894 /nfs/dbraw/zinc/53/48/94/890534894.db2.gz JNRLRCFYSLLLQG-UHFFFAOYSA-N 0 3 414.550 4.476 20 0 HIADHN Cc1nc(CN(C)[C@@H]2CCCN(Cc3cc(C)c(C)cc3OC(F)F)CC2)no1 ZINC000475618877 890549991 /nfs/dbraw/zinc/54/99/91/890549991.db2.gz BQGXMZFXWBBPIG-GOSISDBHSA-N 0 3 408.493 4.083 20 0 HIADHN CCCOc1ccc(CN2CCC[C@H](N(C)Cc3noc(C)n3)CC2)cc1OCC ZINC000475628004 890566861 /nfs/dbraw/zinc/56/68/61/890566861.db2.gz VHMQOHCIXUJLHE-FQEVSTJZSA-N 0 3 416.566 4.052 20 0 HIADHN CC(C)(CNC(=O)N1CCC(OCc2ccccc2)CC1)N1CCc2ccccc2C1 ZINC000504729818 913465187 /nfs/dbraw/zinc/46/51/87/913465187.db2.gz GVVDLXZTRZWRPR-UHFFFAOYSA-N 0 3 421.585 4.214 20 0 HIADHN Cc1ccc(-n2cccn2)cc1NC(=O)N(CCN(C)C)Cc1ccc(F)cc1F ZINC000475650522 890594819 /nfs/dbraw/zinc/59/48/19/890594819.db2.gz ZUJOQSYGYVGNBQ-UHFFFAOYSA-N 0 3 413.472 4.055 20 0 HIADHN Cc1ccc(-n2cccn2)cc1NC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C ZINC000475656494 890601238 /nfs/dbraw/zinc/60/12/38/890601238.db2.gz PULNMKSJRSOVKG-HXUWFJFHSA-N 0 3 403.530 4.309 20 0 HIADHN CCCCOc1ccc(-c2nnc(CN3CCC[C@@]3(CO)Cc3ccccc3)o2)cc1 ZINC000475659101 890606074 /nfs/dbraw/zinc/60/60/74/890606074.db2.gz XBIHOCWVRQPTNP-VWLOTQADSA-N 0 3 421.541 4.485 20 0 HIADHN CCc1nnc(-c2ccc(NC(=O)NC[C@@H](c3cccs3)N3CCCC3)cc2)o1 ZINC000475705233 890643495 /nfs/dbraw/zinc/64/34/95/890643495.db2.gz JQFFZOQQEUWGOL-KRWDZBQOSA-N 0 3 411.531 4.319 20 0 HIADHN CCc1nnc(-c2ccc(NC(=O)N[C@@H]3CCN([C@@H](C)c4ccccc4)C3)cc2)o1 ZINC000475712918 890651508 /nfs/dbraw/zinc/65/15/08/890651508.db2.gz CMTMYDYLOWYIJD-OXJNMPFZSA-N 0 3 405.502 4.256 20 0 HIADHN CN(C(=O)CN1CCC[C@]2(CCCOC2)C1)[C@H](c1ccccc1)c1ccc(F)cc1 ZINC000475743229 890686402 /nfs/dbraw/zinc/68/64/02/890686402.db2.gz XMUFVXWVVLSJAC-RPBOFIJWSA-N 0 3 410.533 4.266 20 0 HIADHN CN(C)[C@H](CNC(=O)N1CCO[C@@H](c2cccc(C(F)(F)F)c2)C1)c1ccccc1 ZINC000475951924 890873203 /nfs/dbraw/zinc/87/32/03/890873203.db2.gz FLBHYSVSWAQJFN-WOJBJXKFSA-N 0 3 421.463 4.091 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2cccc3c2CN(CC(F)(F)F)C3)[C@@H]1c1ccccc1 ZINC000504768767 913500334 /nfs/dbraw/zinc/50/03/34/913500334.db2.gz AXMSIQBDURCPBX-PMACEKPBSA-N 0 3 418.463 4.131 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N[C@@H](C)c2cccc(Cl)c2Cl)CC1 ZINC000476006720 890933119 /nfs/dbraw/zinc/93/31/19/890933119.db2.gz CGPIGGSBYLQPFI-AWEZNQCLSA-N 0 3 402.366 4.243 20 0 HIADHN CC[C@H](NC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1CO)c1ccc(Cl)s1 ZINC000476026706 890958606 /nfs/dbraw/zinc/95/86/06/890958606.db2.gz CGPQOXWIVCBMJY-FGTMMUONSA-N 0 3 421.994 4.035 20 0 HIADHN CC[C@H](NC(=O)N[C@@H](CN1CCc2ccccc2C1)C(C)(C)C)c1nccs1 ZINC000476037218 890968536 /nfs/dbraw/zinc/96/85/36/890968536.db2.gz YXGQWBYRJMOVLT-OALUTQOASA-N 0 3 400.592 4.366 20 0 HIADHN Cc1cccc(NC(=O)Nc2cccc(CNC(=O)N(C)[C@@H]3CCN(C4CC4)C3)c2)c1 ZINC000476151412 891076368 /nfs/dbraw/zinc/07/63/68/891076368.db2.gz MGUJLQBXNZYETR-JOCHJYFZSA-N 0 3 421.545 4.017 20 0 HIADHN COc1cc([C@@H](C)NC(=O)N(C)[C@H]2CCN(C3CC3)C2)ccc1OCCC(C)C ZINC000476163678 891091262 /nfs/dbraw/zinc/09/12/62/891091262.db2.gz RWGZHSKDJYLNDC-XLIONFOSSA-N 0 3 403.567 4.059 20 0 HIADHN COc1ccc(Br)c(NC(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)c1 ZINC000476232139 891155426 /nfs/dbraw/zinc/15/54/26/891155426.db2.gz XJHFVYNPBOJKTF-UGSOOPFHSA-N 0 3 406.324 4.271 20 0 HIADHN Cc1cc(NC(=O)COC2CCC(C)CC2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000476413413 891326070 /nfs/dbraw/zinc/32/60/70/891326070.db2.gz UAAADFSWBYEBMZ-NFOQDIRWSA-N 0 3 410.562 4.172 20 0 HIADHN CO[C@@H]1CCC[C@@H](CC(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)C1 ZINC000476415727 891329034 /nfs/dbraw/zinc/32/90/34/891329034.db2.gz OCCGAPYHJKNAQN-YPAWHYETSA-N 0 3 410.562 4.172 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N2Cc3ccccc3[C@@H](c3ccccc3)C2)CC1 ZINC000476437729 891350190 /nfs/dbraw/zinc/35/01/90/891350190.db2.gz SLQIDTJJGALUIZ-RUZDIDTESA-N 0 3 421.585 4.233 20 0 HIADHN Cc1cccc(CN(Cc2ccco2)C(=O)NC2CCN(CCOC(C)C)CC2)c1 ZINC000476441239 891352216 /nfs/dbraw/zinc/35/22/16/891352216.db2.gz YRVZUEPRTLBPSS-UHFFFAOYSA-N 0 3 413.562 4.189 20 0 HIADHN COc1ccc(F)c2[nH]c(C(=O)Nc3cccc(N4CCN(C(C)C)CC4)c3)cc21 ZINC000476550730 891467812 /nfs/dbraw/zinc/46/78/12/891467812.db2.gz RGCIGMJWEPFQMS-UHFFFAOYSA-N 0 3 410.493 4.098 20 0 HIADHN O=C(CN1CCC[C@@]2(CCCOC2)C1)N(Cc1ccc(C(F)(F)F)cc1)C1CC1 ZINC000476562896 891482269 /nfs/dbraw/zinc/48/22/69/891482269.db2.gz PIZOUVKFBDZGLC-OAQYLSRUSA-N 0 3 410.480 4.089 20 0 HIADHN C[C@@H]1CO[C@@H](c2ccccc2Cl)CN1C(=O)NC[C@H](c1ccccc1)N(C)C ZINC000476596802 891528687 /nfs/dbraw/zinc/52/86/87/891528687.db2.gz MDEKVCJONQMBGJ-MAODMQOUSA-N 0 3 401.938 4.114 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CC[C@](F)(c4ccccc4C)C3)c2)CC1 ZINC000504850133 913576675 /nfs/dbraw/zinc/57/66/75/913576675.db2.gz BUWQNJSVTJPWFC-XMMPIXPASA-N 0 3 410.537 4.240 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCC[C@@H]1c1csc(C)n1)c1cccc(OC)c1 ZINC000476721448 891686141 /nfs/dbraw/zinc/68/61/41/891686141.db2.gz IWOWOTVIRNMTDC-NHCUHLMSSA-N 0 3 416.591 4.390 20 0 HIADHN COc1cc(C(=O)N(CCN(C)C)C2CC2)ccc1OCc1ccc(Cl)cc1 ZINC000476815908 891801595 /nfs/dbraw/zinc/80/15/95/891801595.db2.gz DRBZYSOUMHWZOA-UHFFFAOYSA-N 0 3 402.922 4.094 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)N(CCCO)[C@H]1CCCc2ccccc21 ZINC000476833869 891813386 /nfs/dbraw/zinc/81/33/86/891813386.db2.gz WKHNZXMIFFOUHX-DQEYMECFSA-N 0 3 421.585 4.295 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCc1nc2cccc(Cl)c2n1C)c1ccsc1 ZINC000476849492 891821431 /nfs/dbraw/zinc/82/14/31/891821431.db2.gz DCJGHNIRGGNYJS-QGZVFWFLSA-N 0 3 419.982 4.171 20 0 HIADHN O=C(CC1(N2CCOCC2)CCCC1)N1CCCC[C@@H]1c1nc(-c2ccccc2)c[nH]1 ZINC000476909289 891861913 /nfs/dbraw/zinc/86/19/13/891861913.db2.gz DAUZMKCTBQIDLL-JOCHJYFZSA-N 0 3 422.573 4.165 20 0 HIADHN C[C@@H](C(=O)Nc1cccc(CN2CCC(CO)CC2)c1)c1cn(C)c2ccccc12 ZINC000476921272 891870456 /nfs/dbraw/zinc/87/04/56/891870456.db2.gz IKAZXXUQYLEOQM-GOSISDBHSA-N 0 3 405.542 4.125 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)NCc1c(C)nn(Cc2ccccc2)c1C)c1ccco1 ZINC000476960755 891892024 /nfs/dbraw/zinc/89/20/24/891892024.db2.gz KKGBMQGHZSGJGC-VGOFRKELSA-N 0 3 423.561 4.070 20 0 HIADHN CCCCc1oc2ccccc2c1CN(C)C(=O)NC[C@@H]1CCCN1CCOC ZINC000477088125 892020960 /nfs/dbraw/zinc/02/09/60/892020960.db2.gz JOXUBYIZQJYLAX-SFHVURJKSA-N 0 3 401.551 4.028 20 0 HIADHN COc1ccc(OC(F)F)c(NC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000504896295 913628042 /nfs/dbraw/zinc/62/80/42/913628042.db2.gz SPZLCDMOALNNNI-MRXNPFEDSA-N 0 3 405.445 4.083 20 0 HIADHN CC[C@@H](C)C(=O)Nc1cccc(CNC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000504904251 913636889 /nfs/dbraw/zinc/63/68/89/913636889.db2.gz VKZCACYRBUPLRY-XXBNENTESA-N 0 3 422.573 4.135 20 0 HIADHN Cc1cccc2c1[C@H](C)C[C@@H]2NCc1ccccc1OCC(=O)NC[C@@H]1CCCO1 ZINC000504900226 913632411 /nfs/dbraw/zinc/63/24/11/913632411.db2.gz UFZWKUMKCKKYIK-CBQOVEMMSA-N 0 3 408.542 4.007 20 0 HIADHN CC(C)n1cnnc1-c1ccccc1NC(=O)N[C@H](CN(C)C)c1ccc(F)cc1 ZINC000477222284 892157913 /nfs/dbraw/zinc/15/79/13/892157913.db2.gz OKFVLFNDXXIBDL-HXUWFJFHSA-N 0 3 410.497 4.090 20 0 HIADHN CN(Cc1cc(Br)cs1)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000504917305 913651513 /nfs/dbraw/zinc/65/15/13/913651513.db2.gz CVPMIZXFSKMEKG-KRWDZBQOSA-N 0 3 422.392 4.317 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3CCOC4(C3)CCCCCC4)c(C)c2)CC1 ZINC000477424632 892378926 /nfs/dbraw/zinc/37/89/26/892378926.db2.gz ZKUPQSOWSDJNIO-UHFFFAOYSA-N 0 3 414.594 4.094 20 0 HIADHN CC(C)CC(=O)Nc1ccc(NC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000504922829 913657841 /nfs/dbraw/zinc/65/78/41/913657841.db2.gz DBTNHYYLIALULO-JOCHJYFZSA-N 0 3 408.546 4.457 20 0 HIADHN C/C=C\c1ccc(OC[C@H](O)CN2CCC[C@@H]2c2ccc3c(c2)OCO3)c(OC)c1 ZINC000477465035 892436646 /nfs/dbraw/zinc/43/66/46/892436646.db2.gz PFSCEEKDIWADTJ-NFYQCCHDSA-N 0 3 411.498 4.034 20 0 HIADHN CCC(CC)[C@@H]1C[C@H](NC(=O)Nc2ccc(CCN3CCSCC3)cc2)CCO1 ZINC000477537054 892572410 /nfs/dbraw/zinc/57/24/10/892572410.db2.gz YIRRQWNXEDQUGW-YADHBBJMSA-N 0 3 419.635 4.383 20 0 HIADHN OCCCCN1CCN(Cc2ccc(-c3cccc(Br)c3)s2)CC1 ZINC000477698222 892815207 /nfs/dbraw/zinc/81/52/07/892815207.db2.gz GJVGYXRPDQDUMG-UHFFFAOYSA-N 0 3 409.393 4.068 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1cccc(C(F)(F)F)c1F ZINC000477710939 892821386 /nfs/dbraw/zinc/82/13/86/892821386.db2.gz GVHZUSLTLUHATG-UHFFFAOYSA-N 0 3 410.411 4.301 20 0 HIADHN CC(C)=CCOc1cccc(C(=O)Nc2cccc(CN3CCC(CO)CC3)c2)c1 ZINC000477720983 892825550 /nfs/dbraw/zinc/82/55/50/892825550.db2.gz SELZIEVRLIGKEN-UHFFFAOYSA-N 0 3 408.542 4.488 20 0 HIADHN CCN(C(=O)NCC1(N2CCSCC2)CCCC1)[C@@H](C)c1cccc(OC)c1 ZINC000504965879 913702311 /nfs/dbraw/zinc/70/23/11/913702311.db2.gz RZVAFVDKAPBHCU-SFHVURJKSA-N 0 3 405.608 4.149 20 0 HIADHN CCN(C[C@@H]1CCN([C@@H](C)C(=O)N2CCC[C@H]2c2cccs2)C1)CC(F)(F)F ZINC000477724243 892827274 /nfs/dbraw/zinc/82/72/74/892827274.db2.gz LOLDCQMLKIMKRQ-ULQDDVLXSA-N 0 3 417.541 4.006 20 0 HIADHN O=C(Cc1ccccc1C(F)(F)F)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000477732561 892831269 /nfs/dbraw/zinc/83/12/69/892831269.db2.gz URNYDKRNYWMWDV-UHFFFAOYSA-N 0 3 406.448 4.091 20 0 HIADHN CN(C)C[C@@H](NC(=O)Nc1cc(F)c(Br)cc1F)c1ccc(F)cc1 ZINC000477733329 892832033 /nfs/dbraw/zinc/83/20/33/892832033.db2.gz CAWOJLQBTDCINW-MRXNPFEDSA-N 0 3 416.241 4.291 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1c[nH]nc1-c1ccc(Cl)cc1 ZINC000477740921 892836860 /nfs/dbraw/zinc/83/68/60/892836860.db2.gz CVGKXSKVCYJHBF-UHFFFAOYSA-N 0 3 424.932 4.187 20 0 HIADHN CCOC(=O)c1oc2ccccc2c1CN1CC[C@@H](CN(CC)CC(F)(F)F)C1 ZINC000477741585 892836959 /nfs/dbraw/zinc/83/69/59/892836959.db2.gz OZHUXNYEBBQWJX-HNNXBMFYSA-N 0 3 412.452 4.316 20 0 HIADHN CSCc1cc(C(=O)Nc2cccc(CN3CCC(CO)CC3)c2)ccc1F ZINC000477742650 892837461 /nfs/dbraw/zinc/83/74/61/892837461.db2.gz PWDHBROIACZPDC-UHFFFAOYSA-N 0 3 402.535 4.145 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)[C@@H]1C[C@@]12CCCc1ccccc12 ZINC000477751903 892844442 /nfs/dbraw/zinc/84/44/42/892844442.db2.gz UICIKTBIHQJNHC-AZGAKELHSA-N 0 3 404.554 4.124 20 0 HIADHN CCN(C[C@@H]1CCN([C@@H](C)C(=O)N[C@H](C)c2ccc(Cl)cc2)C1)CC(F)(F)F ZINC000477760717 892849821 /nfs/dbraw/zinc/84/98/21/892849821.db2.gz QAJDYSIEXZOKNW-PMPSAXMXSA-N 0 3 419.919 4.112 20 0 HIADHN COC(=O)c1csc(-c2cccc(CN[C@H](C)c3ccc([S@](C)=O)cc3)c2)n1 ZINC000477849243 892907309 /nfs/dbraw/zinc/90/73/09/892907309.db2.gz OYHALOCLDQXHCA-SUMNFNSASA-N 0 3 414.552 4.185 20 0 HIADHN C[C@@H](NCc1ccc(C2CC2)cc1)c1ccc(S(=O)(=O)NCc2ccco2)cc1 ZINC000477854353 892913055 /nfs/dbraw/zinc/91/30/55/892913055.db2.gz HLNPEWOJQJUEFD-QGZVFWFLSA-N 0 3 410.539 4.486 20 0 HIADHN C[C@H](NC(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C)c1nc2ccccc2n1C(F)F ZINC000477877582 892939127 /nfs/dbraw/zinc/93/91/27/892939127.db2.gz KQXMHFMPDNOMRK-YZVOILCLSA-N 0 3 415.488 4.483 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)N[C@H]1CCC[C@H]1c1ccccc1 ZINC000477903503 892975271 /nfs/dbraw/zinc/97/52/71/892975271.db2.gz CNSVQRBCWLUHMR-UGKGYDQZSA-N 0 3 401.501 4.374 20 0 HIADHN C[C@H](N[C@H]1CCN(Cc2ccc(F)cc2)C1=O)c1ccc(OCC(F)(F)F)cc1 ZINC000477924262 893012455 /nfs/dbraw/zinc/01/24/55/893012455.db2.gz YPCKPGGEKPAHFN-LIRRHRJNSA-N 0 3 410.411 4.219 20 0 HIADHN Cc1ccc(C[C@H](NCc2ccc(S(=O)(=O)CCO)cc2)c2ccc(C)cc2)cc1 ZINC000477943502 893034024 /nfs/dbraw/zinc/03/40/24/893034024.db2.gz LLELDLLTHKHXPN-VWLOTQADSA-N 0 3 423.578 4.143 20 0 HIADHN C[C@@H](c1cccc(NC(=O)c2ccccc2)c1)N1CCC(N2CCCCC2=O)CC1 ZINC000477991060 893092935 /nfs/dbraw/zinc/09/29/35/893092935.db2.gz LCXFNHWTGSRKAD-IBGZPJMESA-N 0 3 405.542 4.477 20 0 HIADHN CN(C)Cc1ccc(NC(=O)c2ccc(CN3CCSCC3)cc2)cc1Cl ZINC000478044389 893185034 /nfs/dbraw/zinc/18/50/34/893185034.db2.gz UUBNHYXUZHTPOP-UHFFFAOYSA-N 0 3 403.979 4.203 20 0 HIADHN COc1ccc(C(=O)N(Cc2ccco2)C2CCN(C)CC2)c(OCCC(C)C)c1 ZINC000478056800 893212147 /nfs/dbraw/zinc/21/21/47/893212147.db2.gz YDYGYQPABXXRGX-UHFFFAOYSA-N 0 3 414.546 4.450 20 0 HIADHN O=C(N[C@@H]1C[C@H]1c1ccc(OC(F)F)cc1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000478176569 893342510 /nfs/dbraw/zinc/34/25/10/893342510.db2.gz IHVSBCLIGSOSSZ-JRGCBEDISA-N 0 3 418.459 4.311 20 0 HIADHN CC[C@@H](C)n1ncc(C(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)c1C ZINC000478342018 893583296 /nfs/dbraw/zinc/58/32/96/893583296.db2.gz MRKNVKDNKANYSL-XLIONFOSSA-N 0 3 406.534 4.058 20 0 HIADHN CC[C@H](C)n1ncc(C(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)c1C ZINC000478341995 893583905 /nfs/dbraw/zinc/58/39/05/893583905.db2.gz MRKNVKDNKANYSL-FXAWDEMLSA-N 0 3 406.534 4.058 20 0 HIADHN CN(CCCN1CCN(C)CC1)C(=O)N[C@H]1CCCCC[C@H]1c1ccc(Cl)cc1 ZINC000505045140 913785939 /nfs/dbraw/zinc/78/59/39/913785939.db2.gz UIPUEXNLJHUYOA-VXKWHMMOSA-N 0 3 421.029 4.035 20 0 HIADHN CN(CCCN1CCN(C)CC1)C(=O)N[C@@H]1CCCCC[C@@H]1c1ccc(Cl)cc1 ZINC000505045139 913786491 /nfs/dbraw/zinc/78/64/91/913786491.db2.gz UIPUEXNLJHUYOA-FGZHOGPDSA-N 0 3 421.029 4.035 20 0 HIADHN CN1C[C@H](NC(=O)c2cccc(NC(=O)C3CCCCC3)c2)[C@H](c2ccccc2)C1 ZINC000478373896 893637630 /nfs/dbraw/zinc/63/76/30/893637630.db2.gz VPWOUXFRYZFVIX-GOTSBHOMSA-N 0 3 405.542 4.033 20 0 HIADHN C[C@@H](NC(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1)c1c(F)cccc1Cl ZINC000478378720 893645637 /nfs/dbraw/zinc/64/56/37/893645637.db2.gz HTFXQFUENMTUIN-OWCLPIDISA-N 0 3 411.949 4.071 20 0 HIADHN C[C@H](NC(=O)N(C)C1CCN(CCc2ccccn2)CC1)c1c(F)cccc1Cl ZINC000478382966 893655013 /nfs/dbraw/zinc/65/50/13/893655013.db2.gz BMBPMQDHSPFXIR-INIZCTEOSA-N 0 3 418.944 4.284 20 0 HIADHN CC(C)c1ccc(-c2noc(CCC(=O)N[C@H]3CN(C)C[C@@H]3c3ccccc3)n2)cc1 ZINC000478396124 893679476 /nfs/dbraw/zinc/67/94/76/893679476.db2.gz COGJPKCESILFIR-YADHBBJMSA-N 0 3 418.541 4.007 20 0 HIADHN COc1cnccc1N1CCN(C(=O)c2ccc(SCc3ccccc3)cc2)CC1 ZINC000478441574 893747463 /nfs/dbraw/zinc/74/74/63/893747463.db2.gz DSZSDPGJDOVHGT-UHFFFAOYSA-N 0 3 419.550 4.345 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)N[C@@H](c2ccco2)c2ccccc2)c1 ZINC000478471718 893800659 /nfs/dbraw/zinc/80/06/59/893800659.db2.gz XMXATCWTCGNHQV-HSZRJFAPSA-N 0 3 407.514 4.151 20 0 HIADHN O=C(NC[C@H]1CCCCN1Cc1ccccc1)N1CC2(CCOCC2)c2ccccc21 ZINC000478528854 893832730 /nfs/dbraw/zinc/83/27/30/893832730.db2.gz LOJLHSZPPSGAER-JOCHJYFZSA-N 0 3 419.569 4.319 20 0 HIADHN COC(=O)c1sc(NC(=O)c2cccc(CN3CCCC3)c2)nc1C(C)(C)C ZINC000478558345 893848744 /nfs/dbraw/zinc/84/87/44/893848744.db2.gz VSVNKRNMYWFUBS-UHFFFAOYSA-N 0 3 401.532 4.075 20 0 HIADHN CCN(CC(=O)N[C@H](c1ccccc1)c1ccc2nc(C(F)(F)F)[nH]c2c1)C1CC1 ZINC000505129301 913833101 /nfs/dbraw/zinc/83/31/01/913833101.db2.gz HZHWDYXLYXRKOZ-HXUWFJFHSA-N 0 3 416.447 4.272 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2ccc(N3CCCC3)cc2C)c1 ZINC000478980851 894257799 /nfs/dbraw/zinc/25/77/99/894257799.db2.gz BFLUEUJTICBFBA-UHFFFAOYSA-N 0 3 410.562 4.200 20 0 HIADHN CCOc1cc(CN(Cc2ccccc2)[C@@H](C)C2CC2)nc2nc(C(F)(F)F)nn21 ZINC000478980235 894257847 /nfs/dbraw/zinc/25/78/47/894257847.db2.gz KNBCQPJUPKKYDA-AWEZNQCLSA-N 0 3 419.451 4.343 20 0 HIADHN COCCSc1ccc([C@@H](C)N[C@H]2CCCN(c3ccccc3F)C2=O)cc1 ZINC000479043255 894305861 /nfs/dbraw/zinc/30/58/61/894305861.db2.gz WCNAPEZLOJHAKP-UZLBHIALSA-N 0 3 402.535 4.410 20 0 HIADHN COc1cc(CNCc2ccc(NC(=O)N(C)C)cc2)ccc1OCc1ccncc1 ZINC000479048252 894309387 /nfs/dbraw/zinc/30/93/87/894309387.db2.gz ZHQKRNMWZUFZEO-UHFFFAOYSA-N 0 3 420.513 4.053 20 0 HIADHN Cc1cc(C)c(S(N)(=O)=O)cc1[C@@H](C)N[C@H]1CCCc2cc(OC(F)F)ccc21 ZINC000479059549 894318508 /nfs/dbraw/zinc/31/85/08/894318508.db2.gz LEMBEEKUCZTFJN-KUHUBIRLSA-N 0 3 424.513 4.280 20 0 HIADHN O=C(CCc1ccccc1)N1CC[C@H](N[C@H]2CCCc3nn(-c4ccccc4)cc32)C1 ZINC000479062402 894322494 /nfs/dbraw/zinc/32/24/94/894322494.db2.gz BBFHRJDLFAMIFM-URXFXBBRSA-N 0 3 414.553 4.073 20 0 HIADHN COc1cc2c(cc1OC)[C@H](NCc1ccc(NC(=O)c3ccncc3)cc1)CC2 ZINC000479062294 894322774 /nfs/dbraw/zinc/32/27/74/894322774.db2.gz ORYLTWGIJDJRKB-OAQYLSRUSA-N 0 3 403.482 4.128 20 0 HIADHN CC[C@H](C)NC(=O)[C@@H]1C[C@H](C)N(CC(=O)Nc2ccc(C)cc2C)[C@@H]2CCCC[C@H]12 ZINC000479107714 894373478 /nfs/dbraw/zinc/37/34/78/894373478.db2.gz SYKYJQVIBYHHIW-IUHILOBXSA-N 0 3 413.606 4.426 20 0 HIADHN CC[C@H](C)n1nc(C(=O)Nc2c(C)cnn2[C@H]2CCN(Cc3ccccc3)C2)cc1C ZINC000479184272 894451436 /nfs/dbraw/zinc/45/14/36/894451436.db2.gz HZGPUDHFKIMHFW-RXVVDRJESA-N 0 3 420.561 4.367 20 0 HIADHN C[C@H](NCc1ccc(C(N)=O)cc1)c1ccc(Br)cc1C(F)(F)F ZINC000479253388 894519284 /nfs/dbraw/zinc/51/92/84/894519284.db2.gz CYFVZYKYVJDFJP-JTQLQIEISA-N 0 3 401.226 4.418 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)NCc2ccc(-c3cccnc3)cc2)c1 ZINC000479327699 894619119 /nfs/dbraw/zinc/61/91/19/894619119.db2.gz XBWYBVOWRDPNKI-UHFFFAOYSA-N 0 3 418.541 4.031 20 0 HIADHN CC(=O)Nc1cccc(NC(=O)[C@H]2CN(Cc3ccccc3)CCC2(F)F)c1C ZINC000505229145 913894477 /nfs/dbraw/zinc/89/44/77/913894477.db2.gz FPHCNRUNLOURQQ-GOSISDBHSA-N 0 3 401.457 4.049 20 0 HIADHN C[C@@H](N[C@@H]1CCOC2(CCCCC2)C1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479385877 894688250 /nfs/dbraw/zinc/68/82/50/894688250.db2.gz FZWYHPRYZUNHDZ-CHWSQXEVSA-N 0 3 421.390 4.173 20 0 HIADHN CC[C@@H]1CCCN(C(C)(C)CNCc2cccc(Cl)c2S(=O)(=O)CC)C1 ZINC000479387681 894690004 /nfs/dbraw/zinc/69/00/04/894690004.db2.gz RMFJVFYOERBLBD-MRXNPFEDSA-N 0 3 401.016 4.124 20 0 HIADHN CO[C@H](c1ccccc1Cl)[C@@H](C)N[C@H](C)c1cc(S(N)(=O)=O)c(C)cc1C ZINC000479448499 894767368 /nfs/dbraw/zinc/76/73/68/894767368.db2.gz DIPANBXFBOHSTA-SXGZJXTBSA-N 0 3 410.967 4.031 20 0 HIADHN C[C@H]1CCc2ccc(Br)cc2[C@H](NCC2(S(C)(=O)=O)CCC2)C1 ZINC000479488207 894809178 /nfs/dbraw/zinc/80/91/78/894809178.db2.gz IKDWVVKURBDVMR-SUMWQHHRSA-N 0 3 400.382 4.020 20 0 HIADHN C[C@@H]1CCc2ccc(Br)cc2[C@H](NCC2(S(C)(=O)=O)CCC2)C1 ZINC000479488202 894809895 /nfs/dbraw/zinc/80/98/95/894809895.db2.gz IKDWVVKURBDVMR-CXAGYDPISA-N 0 3 400.382 4.020 20 0 HIADHN C[C@H](NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1ncc(Br)cc1F ZINC000479492529 894811788 /nfs/dbraw/zinc/81/17/88/894811788.db2.gz WIJIDKVVEDTOFP-FNBIGBAISA-N 0 3 424.280 4.439 20 0 HIADHN C[C@@H](NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1ncc(Br)cc1F ZINC000479492530 894811834 /nfs/dbraw/zinc/81/18/34/894811834.db2.gz WIJIDKVVEDTOFP-GWMXKSKGSA-N 0 3 424.280 4.439 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)NCc2ncoc2-c2ccccc2)N2CCCC2)cc1 ZINC000479494359 894814147 /nfs/dbraw/zinc/81/41/47/894814147.db2.gz GKKAKGDYCSVFMK-JOCHJYFZSA-N 0 3 404.514 4.286 20 0 HIADHN Cc1c([C@@H](C)NC2CC(N3CCC(C(F)(F)F)CC3)C2)nnn1-c1ccccc1 ZINC000479495265 894814389 /nfs/dbraw/zinc/81/43/89/894814389.db2.gz GBKUEYCLZMZWJI-ZCGYKAAXSA-N 0 3 407.484 4.032 20 0 HIADHN CS(=O)(=O)C1(CN[C@@H](CCSc2ccc(F)cc2)c2ccc(F)cc2)CC1 ZINC000479500996 894818042 /nfs/dbraw/zinc/81/80/42/894818042.db2.gz IUCJTURLLYPJQW-IBGZPJMESA-N 0 3 411.539 4.355 20 0 HIADHN CCc1nc2c(s1)[C@@H](N(C)C(=O)NC[C@H](c1ccc(C)cc1)N(C)C)CCC2 ZINC000479510394 894824416 /nfs/dbraw/zinc/82/44/16/894824416.db2.gz DTVLYNFSDJAVMU-RBUKOAKNSA-N 0 3 400.592 4.336 20 0 HIADHN CCc1nc2c(s1)[C@H](N(C)C(=O)NC[C@@H](c1ccc(C)cc1)N(C)C)CCC2 ZINC000479510392 894824766 /nfs/dbraw/zinc/82/47/66/894824766.db2.gz DTVLYNFSDJAVMU-MOPGFXCFSA-N 0 3 400.592 4.336 20 0 HIADHN CCS(=O)(=O)c1c(Cl)cccc1CNC[C@H]1CCCO[C@H]1c1ccccc1 ZINC000479557020 894855391 /nfs/dbraw/zinc/85/53/91/894855391.db2.gz SBHMGBJGIUZWAO-XLIONFOSSA-N 0 3 407.963 4.391 20 0 HIADHN Fc1cc(Br)cc([C@H](NCc2ccc(-n3cncn3)cc2)C2CC2)c1 ZINC000479608955 894883364 /nfs/dbraw/zinc/88/33/64/894883364.db2.gz YDZWXVTXRWXBLT-LJQANCHMSA-N 0 3 401.283 4.410 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)NC[C@@H]2CCC[C@H](C(F)(F)F)C2)c1 ZINC000479680175 894963494 /nfs/dbraw/zinc/96/34/94/894963494.db2.gz VUSNSIQYHSJBOQ-AEFFLSMTSA-N 0 3 415.500 4.137 20 0 HIADHN COc1ccc(CN2CCCN(Cc3c[nH]nc3-c3c(F)cccc3F)CC2)cc1 ZINC000505265093 913921346 /nfs/dbraw/zinc/92/13/46/913921346.db2.gz IDLVNKIZXMNVHL-UHFFFAOYSA-N 0 3 412.484 4.071 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)N[C@H](C)c2cccc(N3CCCC3)c2)c1 ZINC000479698154 894990135 /nfs/dbraw/zinc/99/01/35/894990135.db2.gz BUFBZYZFAMBLSG-HXUWFJFHSA-N 0 3 424.589 4.130 20 0 HIADHN O=C(Cc1ccccc1)Nc1cc(NC(=O)[C@@H]2CCCN2C2CCCC2)ccc1F ZINC000479740248 895039376 /nfs/dbraw/zinc/03/93/76/895039376.db2.gz FDXBTPOAVQISOG-QFIPXVFZSA-N 0 3 409.505 4.352 20 0 HIADHN C[C@H]1CCN(C(=O)NCc2ncoc2-c2ccccc2)CCN1Cc1ccccc1 ZINC000479751476 895051482 /nfs/dbraw/zinc/05/14/82/895051482.db2.gz RHAPSLIGEQDPQZ-IBGZPJMESA-N 0 3 404.514 4.148 20 0 HIADHN COc1ccc(CCN[C@@H](C)c2nnn(-c3ccc(Cl)cc3)c2C)cc1OC ZINC000479752131 895051649 /nfs/dbraw/zinc/05/16/49/895051649.db2.gz JAWRODBEPQSYCP-AWEZNQCLSA-N 0 3 400.910 4.140 20 0 HIADHN CC[C@H](NC(=O)N[C@@H](CN(C)C)c1ccc(OC)cc1)c1ccccc1OC(F)F ZINC000479760641 895062584 /nfs/dbraw/zinc/06/25/84/895062584.db2.gz UBGWDTQPOJGTJU-OALUTQOASA-N 0 3 421.488 4.350 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)N[C@@H](C)c2cc3cccc(F)c3o2)c1 ZINC000479777883 895081641 /nfs/dbraw/zinc/08/16/41/895081641.db2.gz PJDQZENCZCWTAJ-INIZCTEOSA-N 0 3 413.493 4.415 20 0 HIADHN COc1cc(C)c([C@H](C)NC(=O)N[C@H]2CCN(Cc3ccccc3)[C@@H]2C)cc1OC ZINC000479817145 895129977 /nfs/dbraw/zinc/12/99/77/895129977.db2.gz OYWLWHDOLIQTBH-UEXGIBASSA-N 0 3 411.546 4.035 20 0 HIADHN C[C@@H](NC[C@H](c1cccs1)N1CCOCC1)c1ccc(F)cc1OC(F)F ZINC000479850349 895182550 /nfs/dbraw/zinc/18/25/50/895182550.db2.gz HIOFBSKZIFOMSA-CZUORRHYSA-N 0 3 400.466 4.213 20 0 HIADHN CS(=O)(=O)CCCCCNCc1nc(-c2cc(Cl)ccc2Cl)cs1 ZINC000479870448 895212124 /nfs/dbraw/zinc/21/21/24/895212124.db2.gz AFGBSSBDWYWOIS-UHFFFAOYSA-N 0 3 407.388 4.421 20 0 HIADHN COc1ccccc1[C@H](CN[C@H](C)c1nnn(-c2ccccc2)c1C)N1CCCC1 ZINC000479875097 895217071 /nfs/dbraw/zinc/21/70/71/895217071.db2.gz PPYFKCMYDWGANI-GCJKJVERSA-N 0 3 405.546 4.072 20 0 HIADHN COc1ccc([C@@H](CN[C@@H](C)c2ccc(F)cc2Cl)N2CCOCC2)cc1OC ZINC000479890603 895237726 /nfs/dbraw/zinc/23/77/26/895237726.db2.gz VRODHPJFTLYUDI-MGPUTAFESA-N 0 3 422.928 4.220 20 0 HIADHN O=C(c1ccc(C2CCC2)cc1)N1CCC[C@@H](CN2CCN(c3ccccn3)CC2)C1 ZINC000479945483 895300076 /nfs/dbraw/zinc/30/00/76/895300076.db2.gz ZBJWHHWWJOCKKR-NRFANRHFSA-N 0 3 418.585 4.024 20 0 HIADHN COc1cccc(Cl)c1CNC(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000479955715 895309869 /nfs/dbraw/zinc/30/98/69/895309869.db2.gz JNVTZBJZOQWPCM-UHFFFAOYSA-N 0 3 401.938 4.155 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)[C@@H]1C[C@@H]1c1cccc2ccccc21 ZINC000479966500 895319598 /nfs/dbraw/zinc/31/95/98/895319598.db2.gz QPKNZCXYFGXHKS-CLJLJLNGSA-N 0 3 414.549 4.216 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)[C@H]1C[C@@H]1c1ccc2ccccc2c1 ZINC000479965788 895319852 /nfs/dbraw/zinc/31/98/52/895319852.db2.gz POLJGRSTMXSRHU-FTJBHMTQSA-N 0 3 414.549 4.216 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)[C@@H]1C[C@H]1c1cccc2ccccc21 ZINC000479966502 895320333 /nfs/dbraw/zinc/32/03/33/895320333.db2.gz QPKNZCXYFGXHKS-IZZNHLLZSA-N 0 3 414.549 4.216 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)c1ccc(OC2CCCCC2)cc1 ZINC000479968240 895321006 /nfs/dbraw/zinc/32/10/06/895321006.db2.gz TXPIPNKUKBQBDR-UHFFFAOYSA-N 0 3 422.569 4.285 20 0 HIADHN CC[C@@H](Oc1ccccc1C(C)C)C(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000479977609 895330827 /nfs/dbraw/zinc/33/08/27/895330827.db2.gz CTBINSHPIGXYEO-XMMPIXPASA-N 0 3 424.585 4.241 20 0 HIADHN O=C(CCc1ccc(Cl)c(Cl)c1)NCc1ccccc1CN1CCC(O)CC1 ZINC000479979820 895332987 /nfs/dbraw/zinc/33/29/87/895332987.db2.gz LACNHXURDHOJBI-UHFFFAOYSA-N 0 3 421.368 4.199 20 0 HIADHN Cc1ccc(C(C)C)cc1O[C@@H](C)C(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000479998568 895352779 /nfs/dbraw/zinc/35/27/79/895352779.db2.gz WUXUCYHZRZIWCV-FQEVSTJZSA-N 0 3 424.585 4.159 20 0 HIADHN C[C@H](NC(=O)Nc1cc(C(C)(C)C)nn1-c1ccccn1)[C@@H](c1ccccc1)N(C)C ZINC000480044681 895393964 /nfs/dbraw/zinc/39/39/64/895393964.db2.gz JPNMOCLOJBXBIZ-JTSKRJEESA-N 0 3 420.561 4.378 20 0 HIADHN C[C@H](NC[C@H](c1ccc(F)cc1)N1CCOCC1)c1ccc(F)cc1OC(F)F ZINC000480082187 895438200 /nfs/dbraw/zinc/43/82/00/895438200.db2.gz PQHHAEUBAMNLNV-IFXJQAMLSA-N 0 3 412.427 4.290 20 0 HIADHN Cc1ccccc1C[C@H](C)N[C@@H]1CCS(=O)(=O)c2ccc(Br)cc21 ZINC000480190088 895588597 /nfs/dbraw/zinc/58/85/97/895588597.db2.gz CYHMTVDBIBBPLG-KBXCAEBGSA-N 0 3 408.361 4.197 20 0 HIADHN COc1cc(F)c([C@@H](C)NCc2ccc(CN3C[C@@H](C)O[C@@H](C)C3)cc2)cc1OC ZINC000480247234 895658048 /nfs/dbraw/zinc/65/80/48/895658048.db2.gz ZSQGOZCJWFTPQQ-FGTMMUONSA-N 0 3 416.537 4.303 20 0 HIADHN CCS(=O)(=O)Nc1ccc([C@@H](C)NCc2ccc(OC(F)(F)F)cc2)cc1 ZINC000480274143 895681016 /nfs/dbraw/zinc/68/10/16/895681016.db2.gz LJIBZDHXDDSQQX-CYBMUJFWSA-N 0 3 402.438 4.198 20 0 HIADHN CCn1ccnc1[C@H]1OCCC[C@@H]1NCc1cc(Br)c(Cl)s1 ZINC000480273834 895681040 /nfs/dbraw/zinc/68/10/40/895681040.db2.gz KCJDUOBXZPNYCR-STQMWFEESA-N 0 3 404.761 4.390 20 0 HIADHN COc1cccc(CNc2cccc(N3CCN(CCc4ccccc4)CC3)c2)n1 ZINC000480275740 895683038 /nfs/dbraw/zinc/68/30/38/895683038.db2.gz RANGDOOXVWLJDD-UHFFFAOYSA-N 0 3 402.542 4.067 20 0 HIADHN Cc1cc(NC(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)nn1[C@@H](C)C1CC1 ZINC000480320560 895722664 /nfs/dbraw/zinc/72/26/64/895722664.db2.gz RCTXDXBGENSPCE-LAUBAEHRSA-N 0 3 413.566 4.374 20 0 HIADHN O=S1(=O)CC[C@@H](NCCc2ccc(Cl)cc2)c2cc(Br)ccc21 ZINC000480327060 895729281 /nfs/dbraw/zinc/72/92/81/895729281.db2.gz CRSUMXSJIWMDDW-MRXNPFEDSA-N 0 3 414.752 4.153 20 0 HIADHN C[C@H](CCc1ccccc1)N[C@H]1CCS(=O)(=O)c2ccc(Br)cc21 ZINC000480327973 895730784 /nfs/dbraw/zinc/73/07/84/895730784.db2.gz MZHXVJVAYIKFFE-KDOFPFPSSA-N 0 3 408.361 4.279 20 0 HIADHN O=C(NCc1ccncc1)Nc1cccc(CNCc2ccc(OCC3CC3)cc2)c1 ZINC000480375787 895782671 /nfs/dbraw/zinc/78/26/71/895782671.db2.gz HODRNOAFSGOVJE-UHFFFAOYSA-N 0 3 416.525 4.482 20 0 HIADHN Cc1ccc([C@H](CN[C@@H](C)c2cc(Br)ccc2F)N2CCOCC2)o1 ZINC000480385223 895790292 /nfs/dbraw/zinc/79/02/92/895790292.db2.gz GJAFKSOJYLIDDK-KSSFIOAISA-N 0 3 411.315 4.214 20 0 HIADHN Cc1ccc2c(c1C)OC[C@H]2NC(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000480439770 895830363 /nfs/dbraw/zinc/83/03/63/895830363.db2.gz XJNPFPALMALHPJ-OAQYLSRUSA-N 0 3 411.571 4.150 20 0 HIADHN COc1cc(Br)c(CNC[C@](C)(Cc2ccccc2)[C@@H](C)O)cc1OC ZINC000480448042 895836649 /nfs/dbraw/zinc/83/66/49/895836649.db2.gz VEPONCFIYAPQKI-VFNWGFHPSA-N 0 3 422.363 4.186 20 0 HIADHN COc1cc(Br)c(CNC[C@](C)(Cc2ccccc2)[C@H](C)O)cc1OC ZINC000480448036 895836824 /nfs/dbraw/zinc/83/68/24/895836824.db2.gz VEPONCFIYAPQKI-BTYIYWSLSA-N 0 3 422.363 4.186 20 0 HIADHN Cc1nc(-c2cccnc2)sc1[C@H](C)N[C@@H](CN1CCOCC1)c1ccccc1 ZINC000480457053 895844014 /nfs/dbraw/zinc/84/40/14/895844014.db2.gz WCXFVHZJHILPLJ-UWJYYQICSA-N 0 3 408.571 4.238 20 0 HIADHN OC[C@@H](Cc1ccc(F)cc1)NCc1cc(Cl)ccc1OCc1cccnc1 ZINC000480482297 895858883 /nfs/dbraw/zinc/85/88/83/895858883.db2.gz KZPHKGCJZHTQIS-OAQYLSRUSA-N 0 3 400.881 4.146 20 0 HIADHN CC(C)n1ncc2c1C[C@H](NCc1nc(-c3cccc(Br)c3)c[nH]1)CC2 ZINC000480482501 895860437 /nfs/dbraw/zinc/86/04/37/895860437.db2.gz QGDUKZLXPRNTNX-QGZVFWFLSA-N 0 3 414.351 4.264 20 0 HIADHN COc1cccc(C[C@H](NCc2cccnc2N2CCOCC2)c2ccccc2)c1 ZINC000480524180 895887175 /nfs/dbraw/zinc/88/71/75/895887175.db2.gz IZBCJYMDEWLKOB-DEOSSOPVSA-N 0 3 403.526 4.000 20 0 HIADHN Cc1cc2cc([C@H](C)NCc3ccc(C(=O)N4CCN(C)CC4)cc3)oc2cc1C ZINC000480602818 895968408 /nfs/dbraw/zinc/96/84/08/895968408.db2.gz BXZWKFZCLOQYEN-IBGZPJMESA-N 0 3 405.542 4.288 20 0 HIADHN C[C@H](NCc1ccc(N2CCO[C@@H](C)C2)nc1)c1ccc(OCC(F)(F)F)cc1 ZINC000480614621 895981126 /nfs/dbraw/zinc/98/11/26/895981126.db2.gz NQXJFADOCXRLIL-HOTGVXAUSA-N 0 3 409.452 4.099 20 0 HIADHN C[C@H](NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)nc1)c1ccc(OC(F)(F)F)cc1 ZINC000480622695 895991517 /nfs/dbraw/zinc/99/15/17/895991517.db2.gz WAUUNWLFCWKWBR-OAGGEKHMSA-N 0 3 409.452 4.445 20 0 HIADHN C[C@@H]1CN(c2ccc(CN[C@@H]3CCc4ccc(OC(F)(F)F)cc43)cn2)C[C@H](C)O1 ZINC000480622661 895991816 /nfs/dbraw/zinc/99/18/16/895991816.db2.gz VXHRBWAMNCXNGJ-QEEYODRMSA-N 0 3 421.463 4.371 20 0 HIADHN Cc1nc(-c2ccc(F)c(F)c2)sc1C(=O)N1CCC[C@@H]1CN1CCCCC1 ZINC000480624873 895992893 /nfs/dbraw/zinc/99/28/93/895992893.db2.gz IVWHTQOIYSVVBM-MRXNPFEDSA-N 0 3 405.514 4.487 20 0 HIADHN C[C@@H](NCc1ccnc(OCC(F)(F)F)c1)c1ccc(NC(=O)NC2CC2)cc1 ZINC000480626596 895994246 /nfs/dbraw/zinc/99/42/46/895994246.db2.gz QFMHXSSGHKGIEU-CYBMUJFWSA-N 0 3 408.424 4.157 20 0 HIADHN C[C@H]1C[C@H](N(C)S(=O)(=O)Cc2ccc(Cl)c(F)c2)CCN1Cc1ccccc1 ZINC000480639124 896008695 /nfs/dbraw/zinc/00/86/95/896008695.db2.gz KZGXFGGJSPKLEH-QFBILLFUSA-N 0 3 424.969 4.294 20 0 HIADHN C[C@H](NCc1cccc(N2CCOCC2)n1)[C@H](C)Oc1ccc(Cl)cc1Cl ZINC000480704124 896066456 /nfs/dbraw/zinc/06/64/56/896066456.db2.gz COJANORULODTMA-GJZGRUSLSA-N 0 3 410.345 4.171 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1ccc(-c2n[nH]c(C3CC3)n2)cc1)c1ccsc1 ZINC000480725320 896086534 /nfs/dbraw/zinc/08/65/34/896086534.db2.gz FMDRHGZMPPZNCJ-IBGZPJMESA-N 0 3 409.559 4.224 20 0 HIADHN CCCOc1ccc([C@@H](C)N[C@@H](C)c2ccc(NS(C)(=O)=O)cc2)cc1OC ZINC000480737436 896096520 /nfs/dbraw/zinc/09/65/20/896096520.db2.gz ILFGBNFTFSREJX-JKSUJKDBSA-N 0 3 406.548 4.267 20 0 HIADHN Cc1nc(Cc2ccccc2)sc1[C@H](C)NCc1ccnc(N2CCN(C)CC2)c1 ZINC000480736042 896097343 /nfs/dbraw/zinc/09/73/43/896097343.db2.gz TYLPOCNPAVKGKY-SFHVURJKSA-N 0 3 421.614 4.040 20 0 HIADHN COc1ccc2ccccc2c1-c1cc(CN2CCC(N3CCO[C@@H](C)C3)CC2)on1 ZINC000480746248 896107232 /nfs/dbraw/zinc/10/72/32/896107232.db2.gz FXCVXJSUKDXLRU-SFHVURJKSA-N 0 3 421.541 4.189 20 0 HIADHN CC[C@H](C)n1nc(NC(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)cc1C ZINC000480751364 896113376 /nfs/dbraw/zinc/11/33/76/896113376.db2.gz UHOKSZKOVASDSE-OXJNMPFZSA-N 0 3 401.555 4.374 20 0 HIADHN CNS(=O)(=O)c1ccc([C@H](C)NCc2ccc(OCc3cccc(C)c3)cc2)cc1 ZINC000480764588 896126262 /nfs/dbraw/zinc/12/62/62/896126262.db2.gz XOVIYYTYFRREKE-IBGZPJMESA-N 0 3 424.566 4.333 20 0 HIADHN CC[C@H](N[C@H](C)c1ccc(S(=O)(=O)N2CCOCC2)cc1)c1cccc(Cl)c1 ZINC000480767306 896128407 /nfs/dbraw/zinc/12/84/07/896128407.db2.gz DWZMIUHEHMYJOC-IERDGZPVSA-N 0 3 422.978 4.163 20 0 HIADHN Cc1sc2nc(CN3CCN(CCCc4cccc(C)c4)CC3)[nH]c(=O)c2c1C ZINC000480768727 896130829 /nfs/dbraw/zinc/13/08/29/896130829.db2.gz XNGNMYNXHZJEPD-UHFFFAOYSA-N 0 3 410.587 4.073 20 0 HIADHN Fc1cccc(F)c1-c1csc(CN2CCC(CCN3CCOCC3)CC2)n1 ZINC000480771091 896134517 /nfs/dbraw/zinc/13/45/17/896134517.db2.gz ALZRYOAVKUAXEY-UHFFFAOYSA-N 0 3 407.530 4.023 20 0 HIADHN C[C@H](NC[C@H]1CCN(c2ccccc2)C1)c1ccccc1I ZINC000480774774 896138239 /nfs/dbraw/zinc/13/82/39/896138239.db2.gz VVKODHFEWAZNJR-JKSUJKDBSA-N 0 3 406.311 4.468 20 0 HIADHN O=C(Nc1cccc(Oc2cnccn2)c1)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000505374766 914037253 /nfs/dbraw/zinc/03/72/53/914037253.db2.gz IAVWENLEXKZZLW-FQEVSTJZSA-N 0 3 424.451 4.365 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Nc1ccc(C(=O)OC(C)(C)C)cc1F ZINC000480790812 896158124 /nfs/dbraw/zinc/15/81/24/896158124.db2.gz JNWARXGXMSYWJY-UHFFFAOYSA-N 0 3 421.538 4.438 20 0 HIADHN C[C@@H](NCc1ccc(N(C)C)nc1)c1cccc(OCc2cn3ccccc3n2)c1 ZINC000480791739 896160933 /nfs/dbraw/zinc/16/09/33/896160933.db2.gz APVFZJJAVFISCN-GOSISDBHSA-N 0 3 401.514 4.225 20 0 HIADHN O=C1CCCN1Cc1ccc(CN[C@H]2CCc3ccc(OC(F)(F)F)cc32)cc1 ZINC000480874212 896233007 /nfs/dbraw/zinc/23/30/07/896233007.db2.gz DQGYMCKXVPARJB-FQEVSTJZSA-N 0 3 404.432 4.485 20 0 HIADHN COc1cc([C@H](C)NCc2ccc(NC(=O)NC(C)C)cc2)cc(OC)c1OC ZINC000480885176 896239384 /nfs/dbraw/zinc/23/93/84/896239384.db2.gz VIAVBRGAPBQTPN-HNNXBMFYSA-N 0 3 401.507 4.093 20 0 HIADHN C[C@H](NCc1cccc(Cn2cccn2)c1)c1ccc(OCc2nccn2C)cc1 ZINC000480888203 896244273 /nfs/dbraw/zinc/24/42/73/896244273.db2.gz XDZYISSOCOGJIK-IBGZPJMESA-N 0 3 401.514 4.095 20 0 HIADHN COc1cc([C@@H](C)NCc2ccc(CN3CCCC3=O)cc2)ccc1OC(F)F ZINC000480894623 896250089 /nfs/dbraw/zinc/25/00/89/896250089.db2.gz FNNKBOCNPOWZBE-OAHLLOKOSA-N 0 3 404.457 4.270 20 0 HIADHN CC(C)COc1ccc([C@@H](C)NCc2cccc(NC(=O)Cn3cccn3)c2)cc1 ZINC000480896048 896253022 /nfs/dbraw/zinc/25/30/22/896253022.db2.gz BACWEUPBVKGEFG-LJQANCHMSA-N 0 3 406.530 4.407 20 0 HIADHN CCS[C@@H]1CCCCN(CC(=O)NCc2cccc(COCc3ccco3)c2)C1 ZINC000480895284 896253255 /nfs/dbraw/zinc/25/32/55/896253255.db2.gz SZOARRDRNDQYHL-JOCHJYFZSA-N 0 3 416.587 4.220 20 0 HIADHN O=C(NCCN[C@H]1CC2(CCC2)Oc2ccccc21)c1ccc(Br)cc1 ZINC000480910848 896268509 /nfs/dbraw/zinc/26/85/09/896268509.db2.gz PLEZSVSDSFNFNH-SFHVURJKSA-N 0 3 415.331 4.215 20 0 HIADHN C[C@H](NCc1cccc(NC(=O)Cn2cccn2)c1)c1cccc(C(F)(F)F)c1 ZINC000480913371 896271710 /nfs/dbraw/zinc/27/17/10/896271710.db2.gz XPYZRDJSPYOEMG-HNNXBMFYSA-N 0 3 402.420 4.391 20 0 HIADHN C[C@@H](NCc1cccc(COc2ccccc2)c1)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000480913785 896272260 /nfs/dbraw/zinc/27/22/60/896272260.db2.gz PJYITAQGFFAREQ-LJQANCHMSA-N 0 3 424.566 4.367 20 0 HIADHN CC(C)NC(=O)Nc1ccc(CN[C@H](C)c2ccc(OCc3nccn3C)cc2)cc1 ZINC000480920787 896278327 /nfs/dbraw/zinc/27/83/27/896278327.db2.gz NBVUONYSABAVQR-GOSISDBHSA-N 0 3 421.545 4.380 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)NCc1ccc(OC2CCCC2)cc1 ZINC000505387617 914052024 /nfs/dbraw/zinc/05/20/24/914052024.db2.gz NIYGLJVHRGJJPJ-UHFFFAOYSA-N 0 3 401.576 4.343 20 0 HIADHN CCc1onc(C)c1NC(=O)Nc1cc(C)nn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000481010488 896341585 /nfs/dbraw/zinc/34/15/85/896341585.db2.gz QQMCKZLZICKXNM-SFHVURJKSA-N 0 3 408.506 4.141 20 0 HIADHN COc1cc2nc(CN[C@H]3CCCC[C@H]3Cc3ccccc3)[nH]c(=O)c2cc1OC ZINC000481168970 896501976 /nfs/dbraw/zinc/50/19/76/896501976.db2.gz FGYVIULLEVCYRV-HKUYNNGSSA-N 0 3 407.514 4.244 20 0 HIADHN CC[C@@H](N[C@H](C)c1ccc(S(=O)(=O)NC)cc1)c1cccc(Br)c1 ZINC000481181321 896521664 /nfs/dbraw/zinc/52/16/64/896521664.db2.gz ZBXVTZZSJUPSKD-FZKQIMNGSA-N 0 3 411.365 4.159 20 0 HIADHN COc1cc([C@@H](C)N[C@@H](C)c2ccc(F)c(Br)c2)ccc1OCCO ZINC000481195913 896548838 /nfs/dbraw/zinc/54/88/38/896548838.db2.gz YJRBSZCXSPJCGU-QWHCGFSZSA-N 0 3 412.299 4.380 20 0 HIADHN C[C@@H](NCc1cccnc1N1CCN(C)CC1)c1ccccc1OCc1ccccc1 ZINC000481214145 896568804 /nfs/dbraw/zinc/56/88/04/896568804.db2.gz NIQSHSURZWNOKD-OAQYLSRUSA-N 0 3 416.569 4.263 20 0 HIADHN COc1ccc(Cl)cc1[C@@H](CC(C)C)NCc1cccnc1N1CCN(C)CC1 ZINC000481217072 896569765 /nfs/dbraw/zinc/56/97/65/896569765.db2.gz DIGLNXARFVTFSA-OAQYLSRUSA-N 0 3 416.997 4.372 20 0 HIADHN O=S(=O)(CCCN[C@@H]1CCCOc2ccc(Br)cc21)c1ccccc1 ZINC000481240637 896592590 /nfs/dbraw/zinc/59/25/90/896592590.db2.gz IHEKQMCRBJRANJ-GOSISDBHSA-N 0 3 424.360 4.116 20 0 HIADHN C[C@@H](N[C@@H]1CCSc2c(F)cccc21)c1ccc(OCC(=O)NC2CC2)cc1 ZINC000481313709 896662051 /nfs/dbraw/zinc/66/20/51/896662051.db2.gz SUIURCQRWIXYEL-JLTOFOAXSA-N 0 3 400.519 4.371 20 0 HIADHN CC[C@@H](NCc1ccc(S(=O)(=O)N2CCC[C@@H](C)C2)cc1)c1cccc(OC)c1 ZINC000481318834 896670616 /nfs/dbraw/zinc/67/06/16/896670616.db2.gz KMYIYZHFIBIRDX-WZONZLPQSA-N 0 3 416.587 4.357 20 0 HIADHN CC[C@H](N[C@H](C)c1ccc2c(c1)OCCO2)c1ccccc1OCC(=O)N1CCCC1 ZINC000481319979 896673550 /nfs/dbraw/zinc/67/35/50/896673550.db2.gz USZAFMYMQZKVRL-NQIIRXRSSA-N 0 3 424.541 4.261 20 0 HIADHN Fc1ccc(N2CCN(c3cc(CN[C@H]4CCc5ccc(F)cc54)ccn3)CC2)cc1 ZINC000481325675 896680640 /nfs/dbraw/zinc/68/06/40/896680640.db2.gz WMQZEMZAMPNBOU-DEOSSOPVSA-N 0 3 420.507 4.464 20 0 HIADHN CC[C@H](N[C@@H](C)c1ccc2c(c1)OCO2)c1ccccc1OCC(=O)N1CCCC1 ZINC000481327592 896685951 /nfs/dbraw/zinc/68/59/51/896685951.db2.gz JWCHEFYJBYTBLA-PXNSSMCTSA-N 0 3 410.514 4.218 20 0 HIADHN COc1ccc([C@H](NC(=O)N[C@@H](CN(C)C)c2ccc(F)cc2)C(F)(F)F)cc1 ZINC000481331104 896690953 /nfs/dbraw/zinc/69/09/53/896690953.db2.gz OJQYIXBZOBZFIC-ROUUACIJSA-N 0 3 413.415 4.040 20 0 HIADHN CN(C)C[C@H](NC(=O)N[C@@H](c1c(F)cccc1F)C(F)(F)F)c1ccc(F)cc1 ZINC000481357777 896734102 /nfs/dbraw/zinc/73/41/02/896734102.db2.gz GFXHXVLSCQVIOO-RDJZCZTQSA-N 0 3 419.369 4.309 20 0 HIADHN Cc1ccc(NC(=O)C(C)(C)C)cc1NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000481368880 896757822 /nfs/dbraw/zinc/75/78/22/896757822.db2.gz BPHMERJFEAANTB-HXUWFJFHSA-N 0 3 408.546 4.376 20 0 HIADHN Cc1nc(NC(=O)NC[C@@H](c2cccs2)N2CCCC2)ccc1Br ZINC000481370316 896759871 /nfs/dbraw/zinc/75/98/71/896759871.db2.gz IMQOULASPDXFSV-AWEZNQCLSA-N 0 3 409.353 4.173 20 0 HIADHN Clc1ccc2c(c1)[C@@H](NCc1cccc(OCCN3CCOCC3)c1)CCS2 ZINC000481407663 896813458 /nfs/dbraw/zinc/81/34/58/896813458.db2.gz SGEBWNZNQCYYNX-NRFANRHFSA-N 0 3 418.990 4.378 20 0 HIADHN CN(C)C[C@@H](NC(=O)Nc1cnn(-c2ccc(Cl)cc2)c1)c1ccc(F)cc1 ZINC000481440830 896839640 /nfs/dbraw/zinc/83/96/40/896839640.db2.gz LJQKJVNAGAETQH-LJQANCHMSA-N 0 3 401.873 4.089 20 0 HIADHN COc1cc(C(C)=O)ccc1OC[C@@H](O)CN1CCC[C@@H](c2ccc(F)cc2)CC1 ZINC000481496811 896872656 /nfs/dbraw/zinc/87/26/56/896872656.db2.gz PVYLOUWQZJAQSD-GCJKJVERSA-N 0 3 415.505 4.046 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)CCc3cc(Cl)cc(Cl)c3)CC2)C[C@@H](C)O1 ZINC000481520534 896886213 /nfs/dbraw/zinc/88/62/13/896886213.db2.gz MACFBUVYQPVGIP-HZPDHXFCSA-N 0 3 413.389 4.274 20 0 HIADHN COc1ccc(OC)c([C@H](C)NC[C@@H](O)COc2cccc(Cl)c2Cl)c1 ZINC000481539861 896898871 /nfs/dbraw/zinc/89/88/71/896898871.db2.gz ZBPDIJOPWLVYDW-QWHCGFSZSA-N 0 3 400.302 4.101 20 0 HIADHN C[C@@H](NCc1ccc(-n2ccnc2)c(F)c1)c1ccc(I)cc1 ZINC000481547730 896912756 /nfs/dbraw/zinc/91/27/56/896912756.db2.gz TYNDELRMEKKZIJ-CYBMUJFWSA-N 0 3 421.257 4.467 20 0 HIADHN COc1ccc([C@@H](C)NC[C@@H](O)COc2cccc(Cl)c2Cl)c(OC)c1 ZINC000481556009 896927508 /nfs/dbraw/zinc/92/75/08/896927508.db2.gz HVHDMAGMHLBMDA-CHWSQXEVSA-N 0 3 400.302 4.101 20 0 HIADHN CSc1ccc(CN[C@H](C)c2ccc(S(=O)(=O)N3CCCCC3)cc2)cc1 ZINC000481560666 896935488 /nfs/dbraw/zinc/93/54/88/896935488.db2.gz VSCYMEZGWYXBPJ-QGZVFWFLSA-N 0 3 404.601 4.434 20 0 HIADHN CC(C)N(C)S(=O)(=O)c1ccc(CN[C@H]2c3cccc(F)c3CC[C@H]2C)cc1 ZINC000481560856 896935569 /nfs/dbraw/zinc/93/55/69/896935569.db2.gz XQKUFLBFPALSIM-OPAMFIHVSA-N 0 3 404.551 4.268 20 0 HIADHN CC(C)N(C)S(=O)(=O)c1ccc(CN[C@H](C)c2cccc(OC(F)F)c2)cc1 ZINC000481579435 896959727 /nfs/dbraw/zinc/95/97/27/896959727.db2.gz VXWHFNAKNFZFEQ-OAHLLOKOSA-N 0 3 412.502 4.168 20 0 HIADHN COCCN1CCC(NC(=O)Nc2ccc(Sc3ccc(OC)cc3)cc2)CC1 ZINC000481619192 897003185 /nfs/dbraw/zinc/00/31/85/897003185.db2.gz BJKZEMVJLOMFDM-UHFFFAOYSA-N 0 3 415.559 4.079 20 0 HIADHN Cc1[nH]c2ccccc2c1CC(=O)Nc1cc(C)cc(N2CCN(C(C)C)CC2)c1 ZINC000481641890 897026358 /nfs/dbraw/zinc/02/63/58/897026358.db2.gz HGRQYBCPWVYCBR-UHFFFAOYSA-N 0 3 404.558 4.496 20 0 HIADHN CC[C@H](N[C@@H](c1ccccc1)[C@@H]1CCOC1)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000481659774 897043548 /nfs/dbraw/zinc/04/35/48/897043548.db2.gz JULHVBCZVKYQLL-LMNJBCLMSA-N 0 3 422.978 4.067 20 0 HIADHN Cc1cc(NC(=O)N(C)Cc2ccccc2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000481661951 897044921 /nfs/dbraw/zinc/04/49/21/897044921.db2.gz SWTXUBFLIVLTTI-JOCHJYFZSA-N 0 3 403.530 4.302 20 0 HIADHN CCC(CC)[C@@H]1C[C@@H](NC(=O)Nc2ccc(N3CCN(CC)CC3)cc2C)CCO1 ZINC000481672996 897057111 /nfs/dbraw/zinc/05/71/11/897057111.db2.gz PPZKHXIZGCQJPF-REWPJTCUSA-N 0 3 416.610 4.242 20 0 HIADHN CC(=O)N1CCC[C@@H](CN[C@@H](C(=O)Nc2ccc(C)c(Cl)c2)c2ccccc2)C1 ZINC000481682357 897066446 /nfs/dbraw/zinc/06/64/46/897066446.db2.gz BCRIXSZOSRXJMX-PGRDOPGGSA-N 0 3 413.949 4.176 20 0 HIADHN CCOCCOc1ccc(Cl)cc1NC(=O)NC[C@@H](c1ccccc1)N(C)C ZINC000481715468 897107768 /nfs/dbraw/zinc/10/77/68/897107768.db2.gz UGXKJMOBUCFMER-IBGZPJMESA-N 0 3 405.926 4.180 20 0 HIADHN Cc1nc(-c2ccc(C)cc2)c(CC(=O)N[C@@H]2CN(C)C[C@H]2c2ccccc2)s1 ZINC000481739306 897133196 /nfs/dbraw/zinc/13/31/96/897133196.db2.gz HQUUEJOPLLWGLU-LEWJYISDSA-N 0 3 405.567 4.183 20 0 HIADHN O=C1[C@H](N[C@@H](c2cc(F)cc(Br)c2)C2CC2)CCCN1CC(F)(F)F ZINC000481768588 897155034 /nfs/dbraw/zinc/15/50/34/897155034.db2.gz PZQSOMMMSTYFEZ-HUUCEWRRSA-N 0 3 423.248 4.182 20 0 HIADHN COc1ccc(-c2ccncc2)cc1CN1CCC(NC(=O)c2ccc(F)cc2)CC1 ZINC000481913084 897296341 /nfs/dbraw/zinc/29/63/41/897296341.db2.gz CUNGMBSNISKBDC-UHFFFAOYSA-N 0 3 419.500 4.291 20 0 HIADHN COc1cc(F)c([C@H](C)NC[C@@H](c2ccc(Cl)cc2)N2CCOCC2)cc1OC ZINC000481957341 897346746 /nfs/dbraw/zinc/34/67/46/897346746.db2.gz FZZVIBVORMHHPH-YWZLYKJASA-N 0 3 422.928 4.220 20 0 HIADHN CC(=O)N1CCN(c2ccccc2CN[C@H](C)c2ccc(OCC(C)C)cc2)CC1 ZINC000482015690 897415938 /nfs/dbraw/zinc/41/59/38/897415938.db2.gz JPOBECPYZDMSKI-HXUWFJFHSA-N 0 3 409.574 4.241 20 0 HIADHN Cc1cc(NC(=O)c2ccc(Cn3ccnc3)cc2)cc(N2CCN(C(C)C)CC2)c1 ZINC000482032901 897445229 /nfs/dbraw/zinc/44/52/29/897445229.db2.gz MTVUWRLAVRIMAY-UHFFFAOYSA-N 0 3 417.557 4.023 20 0 HIADHN CCC[C@H](N[C@H](C)c1ccc2c(c1)OCO2)C(=O)Nc1cccc(N2CCCC2)c1 ZINC000482047956 897470796 /nfs/dbraw/zinc/47/07/96/897470796.db2.gz WEGXYZQUIHTZHY-UTKZUKDTSA-N 0 3 409.530 4.474 20 0 HIADHN Cc1cc(NC(=O)c2c(F)c(F)cc(F)c2F)cc(N2CCN(C(C)C)CC2)c1 ZINC000482050255 897476217 /nfs/dbraw/zinc/47/62/17/897476217.db2.gz RRLHUJNYTZGKHE-UHFFFAOYSA-N 0 3 409.427 4.334 20 0 HIADHN O=C(Nc1cccc(C(=O)N2CCN(C3CCCCC3)CC2)c1)c1ccc(F)cc1 ZINC000482080449 897519687 /nfs/dbraw/zinc/51/96/87/897519687.db2.gz WSNYSDIBPBXGMD-UHFFFAOYSA-N 0 3 409.505 4.169 20 0 HIADHN Cc1nn(Cc2ccc(Cl)cc2)c(C)c1C(=O)NCc1ccccc1CN(C)C ZINC000482088229 897529115 /nfs/dbraw/zinc/52/91/15/897529115.db2.gz IOXSDASEAOJLQE-UHFFFAOYSA-N 0 3 410.949 4.193 20 0 HIADHN CCOc1ccc([C@@H](C)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)cc1OCC ZINC000482106367 897555535 /nfs/dbraw/zinc/55/55/35/897555535.db2.gz AXHHAHGHTHNEMS-DENIHFKCSA-N 0 3 410.558 4.368 20 0 HIADHN C[C@@H](NCc1ccc(OC2CCCCC2)cc1)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000482109471 897559632 /nfs/dbraw/zinc/55/96/32/897559632.db2.gz STFQLKAULVOOLY-GOSISDBHSA-N 0 3 416.587 4.499 20 0 HIADHN Cc1c([C@@H](C)NCCC(=O)N2CCc3sccc3C2)cnn1-c1ccc(F)cc1 ZINC000482115145 897566724 /nfs/dbraw/zinc/56/67/24/897566724.db2.gz QAHBUWPQIQBONW-OAHLLOKOSA-N 0 3 412.534 4.007 20 0 HIADHN C[C@@H](NCc1ccnc(OC2CCCCC2)c1)c1ccc(NS(C)(=O)=O)cc1 ZINC000482120010 897573155 /nfs/dbraw/zinc/57/31/55/897573155.db2.gz IHFNKRTVFGFYSR-MRXNPFEDSA-N 0 3 403.548 4.015 20 0 HIADHN COc1ccc([C@@H](C)NCc2ccc(NC(=O)c3ccncc3)cc2)cc1NC(C)=O ZINC000482131926 897588906 /nfs/dbraw/zinc/58/89/06/897588906.db2.gz YMFOGIODZQNXQP-MRXNPFEDSA-N 0 3 418.497 4.152 20 0 HIADHN Cc1nn(Cc2ccc(Cl)cc2)c(C)c1C(=O)NC[C@@H](Cc1ccccc1)N(C)C ZINC000482150844 897613945 /nfs/dbraw/zinc/61/39/45/897613945.db2.gz NCPYNLODRSFRAN-JOCHJYFZSA-N 0 3 424.976 4.104 20 0 HIADHN Cc1cn([C@H](C)c2ccccc2)nc1NC(=O)N[C@@H](CN(C)C)c1ccc(F)cc1 ZINC000482229587 897709215 /nfs/dbraw/zinc/70/92/15/897709215.db2.gz FWWMZCNWAKNVCK-UTKZUKDTSA-N 0 3 409.509 4.364 20 0 HIADHN CCC[C@H](N[C@@H](C)c1ccc(OCCOC)cc1)C(=O)N1CCc2sccc2C1 ZINC000482236652 897718565 /nfs/dbraw/zinc/71/85/65/897718565.db2.gz BADGKYVGDRYDFE-UWJYYQICSA-N 0 3 416.587 4.178 20 0 HIADHN CC(C)(C)[C@H](NCCCc1c(Cl)cccc1Cl)c1nc(-c2nc[nH]n2)no1 ZINC000482238491 897719780 /nfs/dbraw/zinc/71/97/80/897719780.db2.gz MHFFXSUFWBZHPP-CQSZACIVSA-N 0 3 409.321 4.471 20 0 HIADHN CCC[C@@H](N[C@@H]1CCCc2nc(CC)sc21)C(=O)N1CCc2sccc2C1 ZINC000482239547 897722105 /nfs/dbraw/zinc/72/21/05/897722105.db2.gz BGGWNUGUPBJMOQ-NVXWUHKLSA-N 0 3 403.617 4.488 20 0 HIADHN Cc1nn(CC(=O)OC(C)C)c(C)c1CN(CC(C)C)[C@@H]1CCCc2cccnc21 ZINC000482284425 897778602 /nfs/dbraw/zinc/77/86/02/897778602.db2.gz BDIVECNFJLXDRK-JOCHJYFZSA-N 0 3 412.578 4.382 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)c2cc(Br)cn2C(C)C)c1 ZINC000482381960 897909662 /nfs/dbraw/zinc/90/96/62/897909662.db2.gz GXRKSHIADKHBII-UHFFFAOYSA-N 0 3 422.367 4.044 20 0 HIADHN O=C(N[C@H](c1ccccc1OC(F)F)C(F)(F)F)N1CCN(C2CCCC2)CC1 ZINC000482435011 897994422 /nfs/dbraw/zinc/99/44/22/897994422.db2.gz HOSCSJTZZJHWNF-MRXNPFEDSA-N 0 3 421.410 4.161 20 0 HIADHN NC(=O)C1CCN(c2ncccc2CN[C@H]2CCCc3c4ccccc4sc32)CC1 ZINC000482436791 897996399 /nfs/dbraw/zinc/99/63/99/897996399.db2.gz CNKCKFYNJFARGA-FQEVSTJZSA-N 0 3 420.582 4.165 20 0 HIADHN CN(C)[C@@H](CNC(=O)N[C@H](c1cccc(F)c1F)C(F)(F)F)c1ccccc1 ZINC000482439818 898000485 /nfs/dbraw/zinc/00/04/85/898000485.db2.gz MVDMWEDNGAGSKI-DOTOQJQBSA-N 0 3 401.379 4.170 20 0 HIADHN COc1cccc(-c2nn(C(C)(C)C)cc2CN2CCC([C@@H](C)NC(C)=O)CC2)c1 ZINC000482526290 898113646 /nfs/dbraw/zinc/11/36/46/898113646.db2.gz JPJMHINZMAHDIL-QGZVFWFLSA-N 0 3 412.578 4.050 20 0 HIADHN CCc1nc2c(s1)[C@H](N[C@@H](C)c1cc(F)ccc1N1CCN(C)CC1)CCC2 ZINC000482529098 898116527 /nfs/dbraw/zinc/11/65/27/898116527.db2.gz APYLSIFSBQFYSS-MAUKXSAKSA-N 0 3 402.583 4.325 20 0 HIADHN C[C@@H](N[C@@H](C)c1cccc(N2CCCC2=O)c1)c1cc(F)ccc1N1CCN(C)CC1 ZINC000482537555 898125267 /nfs/dbraw/zinc/12/52/67/898125267.db2.gz NTSQOGMXXRDCBM-RBUKOAKNSA-N 0 3 424.564 4.116 20 0 HIADHN C[C@@H](N[C@H](C)c1cc(F)ccc1N1CCN(C)CC1)c1cccc(N2CCCC2=O)c1 ZINC000482537557 898125576 /nfs/dbraw/zinc/12/55/76/898125576.db2.gz NTSQOGMXXRDCBM-RTBURBONSA-N 0 3 424.564 4.116 20 0 HIADHN C[C@@H](N[C@@H](C)c1cc(F)ccc1N1CCN(C)CC1)c1cnn(Cc2ccccc2)c1 ZINC000482550211 898140048 /nfs/dbraw/zinc/14/00/48/898140048.db2.gz PNRHHNODOBAWEH-UXHICEINSA-N 0 3 421.564 4.234 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)c1cccc(C)c1I ZINC000482583947 898180804 /nfs/dbraw/zinc/18/08/04/898180804.db2.gz PCGBDCTWYRDLAL-UHFFFAOYSA-N 0 3 408.283 4.222 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)c1ccc(Oc2ccc(C(N)=O)cc2)cc1 ZINC000482594002 898194800 /nfs/dbraw/zinc/19/48/00/898194800.db2.gz QQPWTMHPCAJSHG-UHFFFAOYSA-N 0 3 403.482 4.200 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)[C@H]1CC(=O)N(c2cc(Cl)cc(Cl)c2)C1 ZINC000482598009 898200628 /nfs/dbraw/zinc/20/06/28/898200628.db2.gz QECZPACABPVACD-HNNXBMFYSA-N 0 3 420.340 4.355 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)c1ccc(I)c(F)c1 ZINC000482599164 898201973 /nfs/dbraw/zinc/20/19/73/898201973.db2.gz SGTZFZSTXRLMQT-UHFFFAOYSA-N 0 3 412.246 4.053 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)c1cnn(-c2cccc(Br)c2)c1 ZINC000482627493 898230378 /nfs/dbraw/zinc/23/03/78/898230378.db2.gz HHJVLLAQTOSDFH-UHFFFAOYSA-N 0 3 413.319 4.257 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)c1ccc(F)cc1I ZINC000482630133 898233373 /nfs/dbraw/zinc/23/33/73/898233373.db2.gz NDSMBHCXZOXPKR-UHFFFAOYSA-N 0 3 412.246 4.053 20 0 HIADHN C[C@@H](NCCCN1CCCCC1=O)c1ccc(Br)cc1Br ZINC000482634203 898239056 /nfs/dbraw/zinc/23/90/56/898239056.db2.gz RMQIDCYVRJDMOU-GFCCVEGCSA-N 0 3 418.173 4.265 20 0 HIADHN COCc1c2ccccc2oc1C(=O)NCC1(N2CCSCC2)CCCCC1 ZINC000482753544 898360504 /nfs/dbraw/zinc/36/05/04/898360504.db2.gz WOBMLVXFYWZIKB-UHFFFAOYSA-N 0 3 402.560 4.061 20 0 HIADHN O=C(CCCOc1ccc2c(c1)CCC2)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000482840964 898450982 /nfs/dbraw/zinc/45/09/82/898450982.db2.gz YJOGRXUPNHMTRM-UHFFFAOYSA-N 0 3 422.569 4.177 20 0 HIADHN Cc1nc2ccccc2n1C1CCN([C@H](C)C(=O)N(C)Cc2ccccc2C)CC1 ZINC000482870248 898483016 /nfs/dbraw/zinc/48/30/16/898483016.db2.gz OLKUDCXJNOCPIO-LJQANCHMSA-N 0 3 404.558 4.337 20 0 HIADHN COc1ccc([C@H](C)NCc2ccccc2CN2C(=O)NC3(CCCCC3)C2=O)cc1 ZINC000482976654 898612594 /nfs/dbraw/zinc/61/25/94/898612594.db2.gz XLKHRZRYCJPXEK-SFHVURJKSA-N 0 3 421.541 4.301 20 0 HIADHN CC(C)N1CCC[C@H](N2CCC(C(=O)Nc3ccc(Cl)c(Cl)c3)CC2)C1=O ZINC000483065401 898745579 /nfs/dbraw/zinc/74/55/79/898745579.db2.gz CXGNHGVCFJGEPZ-SFHVURJKSA-N 0 3 412.361 4.043 20 0 HIADHN C[C@@H](NC(=O)Cc1c[nH]c2cc(Br)ccc12)[C@H](c1ccccc1)N(C)C ZINC000505574453 914281171 /nfs/dbraw/zinc/28/11/71/914281171.db2.gz JGINVYHCMPBMQC-SPLOXXLWSA-N 0 3 414.347 4.281 20 0 HIADHN C[C@H](NCc1cccc(-n2ccnc2)c1)c1ccc(S(=O)(=O)C2CCCC2)cc1 ZINC000483121928 898808834 /nfs/dbraw/zinc/80/88/34/898808834.db2.gz BIKTXMSOSWGUEU-SFHVURJKSA-N 0 3 409.555 4.439 20 0 HIADHN CC(C)CN(C(=O)NC1CCN(CCOC(C)C)CC1)[C@@H]1CCCc2cccnc21 ZINC000483144628 898823677 /nfs/dbraw/zinc/82/36/77/898823677.db2.gz CDURHGYNCMVUFQ-JOCHJYFZSA-N 0 3 416.610 4.016 20 0 HIADHN Cc1c([C@@H](C)NC2CCN(c3cccc(C)n3)CC2)nnn1-c1cccc(Cl)c1 ZINC000483166982 898836976 /nfs/dbraw/zinc/83/69/76/898836976.db2.gz HGZQCPYTZOAEJY-MRXNPFEDSA-N 0 3 410.953 4.252 20 0 HIADHN Cc1cc(NC(=O)N2CCN(C3CCCCC3)CC2)ccc1OC1CCOCC1 ZINC000483173345 898840771 /nfs/dbraw/zinc/84/07/71/898840771.db2.gz NDINWLUBSKNOSI-UHFFFAOYSA-N 0 3 401.551 4.035 20 0 HIADHN CCOC(=O)C1(COC)CCN(CCSc2ccnc3cc(Cl)ccc32)CC1 ZINC000483211187 898860670 /nfs/dbraw/zinc/86/06/70/898860670.db2.gz NFCUBXBYTLSWKJ-UHFFFAOYSA-N 0 3 422.978 4.272 20 0 HIADHN C[C@@H](NC(=O)Cc1ccc(OCc2ccccn2)cc1)[C@@H](c1ccccc1)N(C)C ZINC000505588907 914295867 /nfs/dbraw/zinc/29/58/67/914295867.db2.gz WGKXELRDASBBST-CLOONOSVSA-N 0 3 403.526 4.011 20 0 HIADHN CC(C)N(C)c1ccc(CN2CCC[C@H](c3nc(-c4ccc(F)cc4)no3)C2)cn1 ZINC000483287418 898923725 /nfs/dbraw/zinc/92/37/25/898923725.db2.gz CCNZXSVQIHOMSK-IBGZPJMESA-N 0 3 409.509 4.495 20 0 HIADHN NC(=O)c1ccccc1Oc1ccc(NC(=O)N2CCN(C3CCCCC3)CC2)cc1 ZINC000483296382 898929617 /nfs/dbraw/zinc/92/96/17/898929617.db2.gz NFZUTHTVOSBTTD-UHFFFAOYSA-N 0 3 422.529 4.060 20 0 HIADHN C[C@H](NC(=O)C1CCN(c2nc3ccccc3s2)CC1)[C@@H](c1ccccc1)N(C)C ZINC000505602848 914307956 /nfs/dbraw/zinc/30/79/56/914307956.db2.gz AJQRGYZPHMWRPH-JTSKRJEESA-N 0 3 422.598 4.320 20 0 HIADHN C[C@@H](NC(=O)C1CCN(c2nc3ccccc3s2)CC1)[C@@H](c1ccccc1)N(C)C ZINC000505602850 914308976 /nfs/dbraw/zinc/30/89/76/914308976.db2.gz AJQRGYZPHMWRPH-VGSWGCGISA-N 0 3 422.598 4.320 20 0 HIADHN CCc1ccc(-c2nn(-c3ccccc3)cc2CN2CC[C@@H](N3CCCC3=O)C2)cc1 ZINC000483436100 899069751 /nfs/dbraw/zinc/06/97/51/899069751.db2.gz CQSCNTCWQJRZDW-XMMPIXPASA-N 0 3 414.553 4.298 20 0 HIADHN CCOc1ccc(Oc2c(CN3C[C@@H](C)[C@H](CO)C3)c(C)nn2-c2ccccc2)cc1 ZINC000483438762 899073013 /nfs/dbraw/zinc/07/30/13/899073013.db2.gz ZAECWDBXONPBKL-QUCCMNQESA-N 0 3 421.541 4.432 20 0 HIADHN CCc1ccc([C@@H](N[C@H](COC)CC(C)C)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000483453348 899089833 /nfs/dbraw/zinc/08/98/33/899089833.db2.gz GYRBLBCWWKWFBG-JTHBVZDNSA-N 0 3 403.588 4.393 20 0 HIADHN Cc1nc(COc2ccccc2C(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)cs1 ZINC000505614197 914318336 /nfs/dbraw/zinc/31/83/36/914318336.db2.gz TZDWGAFWLAYROO-AOMKIAJQSA-N 0 3 409.555 4.452 20 0 HIADHN CN(C(=O)CN1CCN(C2CCCCC2)CC1)C(c1ccccc1)c1ccccc1 ZINC000483493664 899150994 /nfs/dbraw/zinc/15/09/94/899150994.db2.gz SZFMRTWZCBTBBL-UHFFFAOYSA-N 0 3 405.586 4.185 20 0 HIADHN C[C@@H](NC(=O)c1cccc(CSc2nccn2C)c1)[C@@H](c1ccccc1)N(C)C ZINC000505616055 914319354 /nfs/dbraw/zinc/31/93/54/914319354.db2.gz ZWJNATWGLHHBGB-UTKZUKDTSA-N 0 3 408.571 4.134 20 0 HIADHN COc1ccc(-c2cnc(CCC(=O)N[C@H](C)[C@H](c3ccccc3)N(C)C)o2)cc1 ZINC000505615865 914319783 /nfs/dbraw/zinc/31/97/83/914319783.db2.gz YZKLSJXMKNMFLG-MZNJEOGPSA-N 0 3 407.514 4.090 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)Nc1ccc(OC2CCC2)c(F)c1 ZINC000483513481 899175894 /nfs/dbraw/zinc/17/58/94/899175894.db2.gz ORFSTIKOBCZIBC-UHFFFAOYSA-N 0 3 403.473 4.492 20 0 HIADHN Cc1ccc(C(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)cc1NC(=O)NC(C)(C)C ZINC000505627139 914326694 /nfs/dbraw/zinc/32/66/94/914326694.db2.gz BDHAVRCICVVXLN-UTKZUKDTSA-N 0 3 410.562 4.336 20 0 HIADHN CCOc1cc2c(cc1[C@@H]1C[C@@H]1C(=O)N[C@H](C)[C@@H](c1ccccc1)N(C)C)O[C@H](C)C2 ZINC000505629413 914328610 /nfs/dbraw/zinc/32/86/10/914328610.db2.gz IFMHSUONIRBVEC-STLAZHOQSA-N 0 3 422.569 4.320 20 0 HIADHN CCc1ccc(-c2noc([C@H](C)NCc3ccccc3N3CCN(CC)CC3)n2)cc1 ZINC000483646347 899302694 /nfs/dbraw/zinc/30/26/94/899302694.db2.gz CTSHUQPMMVZYHD-IBGZPJMESA-N 0 3 419.573 4.292 20 0 HIADHN CCCN(CCC)C(=O)c1cccc(C(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)c1 ZINC000505634003 914334568 /nfs/dbraw/zinc/33/45/68/914334568.db2.gz QGMXMXMTGQXMOW-CVDCTZTESA-N 0 3 409.574 4.370 20 0 HIADHN CN(C)CCN(C[C@H]1CCCO1)C(=O)Nc1c(F)cc(F)cc1-c1ccccc1 ZINC000483654727 899312417 /nfs/dbraw/zinc/31/24/17/899312417.db2.gz OPYJEUZHRLPUMK-GOSISDBHSA-N 0 3 403.473 4.206 20 0 HIADHN COc1cccc(-c2noc([C@@H](C)NC3CCC(C(=O)OC(C)(C)C)CC3)n2)c1 ZINC000483656905 899315973 /nfs/dbraw/zinc/31/59/73/899315973.db2.gz HEYRUHJHKROJKP-HPUBIQBYSA-N 0 3 401.507 4.296 20 0 HIADHN COc1ccccc1[C@@H](CC(C)C)N[C@H](C)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000483709464 899363786 /nfs/dbraw/zinc/36/37/86/899363786.db2.gz JTAWLJLDKDLMOZ-DYESRHJHSA-N 0 3 404.576 4.384 20 0 HIADHN C[C@@H](N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1=O)c1ccc2c(c1)COC2 ZINC000483709572 899364783 /nfs/dbraw/zinc/36/47/83/899364783.db2.gz FSSHANZCTUJAIP-VLIAUNLRSA-N 0 3 402.441 4.164 20 0 HIADHN CO[C@@H]1CCCC[C@@H]1NCC(=O)N1N=C(c2ccc(Cl)cc2)C[C@H]1c1ccco1 ZINC000483718080 899377693 /nfs/dbraw/zinc/37/76/93/899377693.db2.gz CVFUNBLFFGKWOS-YSIASYRMSA-N 0 3 415.921 4.158 20 0 HIADHN CNC(=O)[C@H](Cc1c[nH]c2ccccc12)N[C@H](C)c1ccc(F)c(Br)c1 ZINC000483729082 899389469 /nfs/dbraw/zinc/38/94/69/899389469.db2.gz PWNJRGIUUDAKQX-BLVKFPJESA-N 0 3 418.310 4.077 20 0 HIADHN C[C@H](N[C@H]1CCCN(c2ccccc2Cl)C1=O)c1cccc(N2CCOCC2)c1 ZINC000483735074 899396809 /nfs/dbraw/zinc/39/68/09/899396809.db2.gz XGRSFCJHIPTJSO-UWJYYQICSA-N 0 3 413.949 4.023 20 0 HIADHN CNC(=O)[C@H](Cc1c[nH]c2ccccc12)N[C@H](C)c1ccc(OCC(F)(F)F)cc1 ZINC000483748014 899411165 /nfs/dbraw/zinc/41/11/65/899411165.db2.gz QDGGBHQRZOLIIA-VLIAUNLRSA-N 0 3 419.447 4.117 20 0 HIADHN Cc1ccc(NC(=O)N(C)C2CCN(CCc3ccccn3)CC2)cc1-c1ncco1 ZINC000483795357 899466318 /nfs/dbraw/zinc/46/63/18/899466318.db2.gz AAVAURSXDKIPQH-UHFFFAOYSA-N 0 3 419.529 4.216 20 0 HIADHN Cc1ccc2nc(C(=O)Nc3ccnn3[C@@H]3CCN(Cc4ccccc4)C3)ccc2c1 ZINC000483795935 899467761 /nfs/dbraw/zinc/46/77/61/899467761.db2.gz FNBNAYUCPXDVOO-OAQYLSRUSA-N 0 3 411.509 4.439 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2ccc(F)cc2OC(F)F)c1 ZINC000483800239 899474928 /nfs/dbraw/zinc/47/49/28/899474928.db2.gz QECIFAXSOFSSPZ-UHFFFAOYSA-N 0 3 411.424 4.031 20 0 HIADHN Cc1ccc(F)cc1-c1nnc(NC(=O)N[C@@H](CN(C)C)c2ccc(F)cc2)s1 ZINC000483917540 899583872 /nfs/dbraw/zinc/58/38/72/899583872.db2.gz QTACKZGGUGNFMM-KRWDZBQOSA-N 0 3 417.485 4.216 20 0 HIADHN COc1ccc2c(c1)[C@@H](N(CCC(=O)Nc1cccnc1)Cc1ccccc1)CCO2 ZINC000483963933 899610555 /nfs/dbraw/zinc/61/05/55/899610555.db2.gz UMGJZLAXTIONKC-QHCPKHFHSA-N 0 3 417.509 4.445 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N[C@H](c1ccc(Cl)cc1)[C@@H]1C[C@H]1C ZINC000483978371 899621039 /nfs/dbraw/zinc/62/10/39/899621039.db2.gz KOFPPYQSIPQTII-QFIXIFRTSA-N 0 3 413.949 4.162 20 0 HIADHN CSc1cccc(N(C(=O)c2ccc(OC(F)F)cn2)C2CCN(C)CC2)c1 ZINC000484039731 899671886 /nfs/dbraw/zinc/67/18/86/899671886.db2.gz HONHQSYFXSVIIE-UHFFFAOYSA-N 0 3 407.486 4.146 20 0 HIADHN CN(C)[C@@H](CNC(=O)NC(C)(C)c1ccc(Br)cc1)c1ccccc1 ZINC000505677972 914370969 /nfs/dbraw/zinc/37/09/69/914370969.db2.gz NWUVZGMDJSTRDZ-SFHVURJKSA-N 0 3 404.352 4.286 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)Nc1nnc(/C=C\c2ccco2)s1 ZINC000484126568 899748824 /nfs/dbraw/zinc/74/88/24/899748824.db2.gz FRABEFAEXNLNRS-RXQFDZFGSA-N 0 3 409.515 4.260 20 0 HIADHN C[C@H](N[C@H](CCCO)c1ccccc1)c1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000484135436 899757110 /nfs/dbraw/zinc/75/71/10/899757110.db2.gz QJCDEINTPIXZRO-WMZHIEFXSA-N 0 3 416.587 4.026 20 0 HIADHN CCOc1cccc2cc([C@@H](C)NC(=O)C(=O)Nc3cc(CN(C)C)ccc3C)oc21 ZINC000484200228 899810430 /nfs/dbraw/zinc/81/04/30/899810430.db2.gz LAGGVQLYKUSVEO-MRXNPFEDSA-N 0 3 423.513 4.017 20 0 HIADHN CCN1CCC[C@@H](NC(=O)N2CCc3nc(-c4ccccc4Cl)sc3C2)C1 ZINC000484259357 899838279 /nfs/dbraw/zinc/83/82/79/899838279.db2.gz WLGRALQDJKCROL-CQSZACIVSA-N 0 3 404.967 4.016 20 0 HIADHN C[C@@H](NC(=O)NCc1cccc(NC(=O)C2CCCC2)c1)[C@@H](c1ccccc1)N(C)C ZINC000484277858 899847223 /nfs/dbraw/zinc/84/72/23/899847223.db2.gz BYUSGOIOEMDHQR-JPYJTQIMSA-N 0 3 422.573 4.306 20 0 HIADHN CSc1cccc(N(C(=O)c2cc(C)nc3c2c(C)nn3C)C2CCN(C)CC2)c1 ZINC000484295638 899858733 /nfs/dbraw/zinc/85/87/33/899858733.db2.gz LKMOZSKGUROEHJ-UHFFFAOYSA-N 0 3 423.586 4.048 20 0 HIADHN CSc1cccc(N(C(=O)c2cccc(N3CCCC3=O)c2)C2CCN(C)CC2)c1 ZINC000484300071 899862667 /nfs/dbraw/zinc/86/26/67/899862667.db2.gz ZNVGPCZWYGQBQJ-UHFFFAOYSA-N 0 3 423.582 4.276 20 0 HIADHN Cc1ccc(CN[C@@H]2CCc3cc(Br)ccc32)c(N2CCOCC2)c1 ZINC000484300366 899862714 /nfs/dbraw/zinc/86/27/14/899862714.db2.gz JBIWHWVSJHTJQL-HXUWFJFHSA-N 0 3 401.348 4.371 20 0 HIADHN Cc1ccc(OC(F)F)c([C@H](C)N[C@H]2CCN(C(=O)CCc3ccccc3)C2)c1 ZINC000484502091 899992465 /nfs/dbraw/zinc/99/24/65/899992465.db2.gz JXCHHPXZTZGFFA-HKUYNNGSSA-N 0 3 402.485 4.481 20 0 HIADHN C[C@@H](NC[C@H](C[C@H](C)O)c1ccccc1)c1ccccc1I ZINC000484502891 899994092 /nfs/dbraw/zinc/99/40/92/899994092.db2.gz QJBWTNRMYYSRSW-UXLLHSPISA-N 0 3 409.311 4.497 20 0 HIADHN Cc1c([C@@H](C)N[C@@H]2CCN(C(=O)CCc3ccccc3)C2)cnn1-c1ccc(F)cc1 ZINC000484508447 899999076 /nfs/dbraw/zinc/99/90/76/899999076.db2.gz PIHREVWRHYYRGK-XMSQKQJNSA-N 0 3 420.532 4.204 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2ccc3nc(C4CC4)oc3c2)c1 ZINC000484533312 900019479 /nfs/dbraw/zinc/01/94/79/900019479.db2.gz QFVKHWHIGNTPOP-UHFFFAOYSA-N 0 3 408.502 4.310 20 0 HIADHN O[C@H](CN[C@@H](Cn1cnc2ccccc21)c1ccc(F)cc1)COCc1ccccc1 ZINC000484533014 900020240 /nfs/dbraw/zinc/02/02/40/900020240.db2.gz IPEJDHKWHCVTGI-VWNXMTODSA-N 0 3 419.500 4.084 20 0 HIADHN CCCOc1ccc(O[C@@H]2CCCC[C@@H]2NCc2cc(-c3cnn(C)c3)no2)cc1 ZINC000484623878 900076253 /nfs/dbraw/zinc/07/62/53/900076253.db2.gz VFPCSSCPPQEBJM-JTHBVZDNSA-N 0 3 410.518 4.344 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)C[C@H](c3ccccc3)C(F)(F)F)cc2)CC1 ZINC000484694588 900130888 /nfs/dbraw/zinc/13/08/88/900130888.db2.gz IVCCHDKIIBXNSW-OAQYLSRUSA-N 0 3 419.491 4.499 20 0 HIADHN CCc1nnc(C2CCN([C@@H](C)C(=O)Nc3ccc(Oc4ccccc4)cc3)CC2)[nH]1 ZINC000484701536 900136967 /nfs/dbraw/zinc/13/69/67/900136967.db2.gz USQOBUGTKZRRKL-KRWDZBQOSA-N 0 3 419.529 4.366 20 0 HIADHN CCc1nnc(C2CCN([C@@H](C(=O)Nc3ccc(F)cc3)c3ccccc3)CC2)[nH]1 ZINC000484717338 900149077 /nfs/dbraw/zinc/14/90/77/900149077.db2.gz SKGHHVYDIDNURQ-OAQYLSRUSA-N 0 3 407.493 4.066 20 0 HIADHN CCc1nc(C2CCN(CC(=O)N3CCC[C@@H]3c3ccc(C(C)(C)C)cc3)CC2)n[nH]1 ZINC000484738155 900162347 /nfs/dbraw/zinc/16/23/47/900162347.db2.gz MNEPJJPQHDLZHM-OAQYLSRUSA-N 0 3 423.605 4.208 20 0 HIADHN CCc1n[nH]c(C2CCN(CC(=O)N3CCC[C@@H]3c3ccc(C(C)(C)C)cc3)CC2)n1 ZINC000484738155 900162353 /nfs/dbraw/zinc/16/23/53/900162353.db2.gz MNEPJJPQHDLZHM-OAQYLSRUSA-N 0 3 423.605 4.208 20 0 HIADHN CCc1nnc(C2CCN(CC(=O)N3CCC[C@@H]3c3ccc(C(C)(C)C)cc3)CC2)[nH]1 ZINC000484738155 900162363 /nfs/dbraw/zinc/16/23/63/900162363.db2.gz MNEPJJPQHDLZHM-OAQYLSRUSA-N 0 3 423.605 4.208 20 0 HIADHN C[C@@H](NC(=O)NCc1ccc(OCc2ccccn2)cc1)[C@H](c1ccccc1)N(C)C ZINC000484794424 900199999 /nfs/dbraw/zinc/19/99/99/900199999.db2.gz DJBXNOSESIVDRY-NTKDMRAZSA-N 0 3 418.541 4.151 20 0 HIADHN C[C@H](NCCCS(=O)(=O)c1ccc(F)cc1)c1ccc(OC(F)(F)F)cc1 ZINC000484861963 900252396 /nfs/dbraw/zinc/25/23/96/900252396.db2.gz LMZURGXJZHNTHF-ZDUSSCGKSA-N 0 3 405.413 4.239 20 0 HIADHN C[C@@H]1Cc2ccccc2N1Cc1ccoc1C(=O)NC[C@@H](Cc1ccccc1)N(C)C ZINC000484919442 900294989 /nfs/dbraw/zinc/29/49/89/900294989.db2.gz UKRYSTPGILHZNK-AUSIDOKSSA-N 0 3 417.553 4.134 20 0 HIADHN Cc1ccccc1C1(CNC(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)CCOCC1 ZINC000484932496 900304635 /nfs/dbraw/zinc/30/46/35/900304635.db2.gz DPBBTJJKOBPYDM-OFNKIYASSA-N 0 3 409.574 4.034 20 0 HIADHN Cc1cccnc1C(C)(C)CNC(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000484949243 900316582 /nfs/dbraw/zinc/31/65/82/900316582.db2.gz BJTVIUPMCZLSPO-QFIPXVFZSA-N 0 3 419.491 4.238 20 0 HIADHN CCOc1ccccc1NC(=O)CCN(C)[C@@H]1c2cc(Cl)cc(Cl)c2C[C@H]1O ZINC000484988973 900343292 /nfs/dbraw/zinc/34/32/92/900343292.db2.gz UADGIRRPIZNJID-WIYYLYMNSA-N 0 3 423.340 4.311 20 0 HIADHN CCOc1cc(Cl)ccc1C(=O)Nc1ccc(N2CCN(CC)CC2)cc1C ZINC000485068093 900390783 /nfs/dbraw/zinc/39/07/83/900390783.db2.gz NYDPKUKKFPBJEX-UHFFFAOYSA-N 0 3 401.938 4.441 20 0 HIADHN CCCN(Cc1cc(OCC)n2nc(C(F)(F)F)nc2n1)[C@H]1CCc2ccccc21 ZINC000485073312 900394144 /nfs/dbraw/zinc/39/41/44/900394144.db2.gz PIDUPTYKMZGPPE-KRWDZBQOSA-N 0 3 419.451 4.441 20 0 HIADHN C[C@@H](NC(=O)N1CCN(C2CCCCC2)CC1)c1nc2ccccc2n1C(F)F ZINC000485299758 900578839 /nfs/dbraw/zinc/57/88/39/900578839.db2.gz PZQQVVHBORCPPL-OAHLLOKOSA-N 0 3 405.493 4.152 20 0 HIADHN CC(C)CC(=O)Nc1cccc(CNC(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)c1 ZINC000485342122 900632577 /nfs/dbraw/zinc/63/25/77/900632577.db2.gz CZFOZNHGKDSQFA-FDDCHVKYSA-N 0 3 410.562 4.162 20 0 HIADHN CCc1c(NC(=O)N(CCN(C)C)Cc2ccco2)cnn1-c1ccccc1Cl ZINC000485356566 900651406 /nfs/dbraw/zinc/65/14/06/900651406.db2.gz YXVVNLISWHMACR-UHFFFAOYSA-N 0 3 415.925 4.277 20 0 HIADHN C[C@@H](NC(=O)NCc1nc2cc(Cl)ccc2s1)[C@H](c1ccccc1)N(C)C ZINC000485399541 900697457 /nfs/dbraw/zinc/69/74/57/900697457.db2.gz GQNWFPRWCDHAPT-BFUOFWGJSA-N 0 3 402.951 4.440 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)NCc1nc2cc(Cl)ccc2s1)c1ccco1 ZINC000485411455 900709800 /nfs/dbraw/zinc/70/98/00/900709800.db2.gz KPEMXLPSYOTXQW-WFASDCNBSA-N 0 3 406.939 4.471 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2ccc(N3CCCC3=O)c(F)c2)N2CCCC2)cc1 ZINC000485414296 900713001 /nfs/dbraw/zinc/71/30/01/900713001.db2.gz OKXXNDWGCIDJIY-QFIPXVFZSA-N 0 3 424.520 4.220 20 0 HIADHN COc1ccc2ccccc2c1-c1cc(CNC(=O)[C@H](C)N2[C@H](C)CC[C@H]2C)on1 ZINC000485433677 900730472 /nfs/dbraw/zinc/73/04/72/900730472.db2.gz RFOXEVFDJRJRDQ-ZACQAIPSSA-N 0 3 407.514 4.381 20 0 HIADHN O=C(Cc1ccc(F)cc1Br)NC[C@@H](c1cccs1)N1CCCC1 ZINC000485463053 900756911 /nfs/dbraw/zinc/75/69/11/900756911.db2.gz DAQRHGVCYZBARD-INIZCTEOSA-N 0 3 411.340 4.146 20 0 HIADHN O=C(Nc1ccc(C(=O)NCCN2CCCC2)cc1)c1sccc1-c1ccccc1 ZINC000485479276 900772503 /nfs/dbraw/zinc/77/25/03/900772503.db2.gz ITXXGTMZXYWUPS-UHFFFAOYSA-N 0 3 419.550 4.493 20 0 HIADHN O=C(NCCN1CCCC1)c1ccc(NC(=O)C2(c3cccc(F)c3)CCCC2)cc1 ZINC000485494121 900784637 /nfs/dbraw/zinc/78/46/37/900784637.db2.gz HCKJHUQXKJMZAU-UHFFFAOYSA-N 0 3 423.532 4.102 20 0 HIADHN O=C(Nc1ccc(C(=O)NCCN2CCCC2)cc1)c1ccc(-c2ccccc2F)o1 ZINC000485523493 900806049 /nfs/dbraw/zinc/80/60/49/900806049.db2.gz VNVQVLHGDVUOHJ-UHFFFAOYSA-N 0 3 421.472 4.164 20 0 HIADHN CCOc1cc(Cl)ccc1C(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000485548339 900823292 /nfs/dbraw/zinc/82/32/92/900823292.db2.gz HWURYHWBESGHNU-CALCHBBNSA-N 0 3 408.970 4.090 20 0 HIADHN O=C(NCCN1CCCC1)c1ccc(NC(=O)c2cccc(OC3CCCC3)c2)cc1 ZINC000485550072 900824518 /nfs/dbraw/zinc/82/45/18/900824518.db2.gz YDVUPAVFSKWQIR-UHFFFAOYSA-N 0 3 421.541 4.086 20 0 HIADHN CCOc1cc(CN(C)[C@@H](c2ccccc2)C(C)C)nc2nc(C(F)(F)F)nn21 ZINC000485666409 900917356 /nfs/dbraw/zinc/91/73/56/900917356.db2.gz HPUGLXVKQUYOFH-QGZVFWFLSA-N 0 3 407.440 4.371 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N[C@@H](C)c3ccc4ncsc4c3)cc2)CC1 ZINC000485669261 900919552 /nfs/dbraw/zinc/91/95/52/900919552.db2.gz DTLPOVGDWDFLNQ-KRWDZBQOSA-N 0 3 408.571 4.318 20 0 HIADHN COCCO[C@@H]1COCC[C@H]1NCc1ccc(-c2ccc(Cl)c(Cl)c2)o1 ZINC000485724183 900974024 /nfs/dbraw/zinc/97/40/24/900974024.db2.gz KSNBZBDFHMRYPJ-IEBWSBKVSA-N 0 3 400.302 4.164 20 0 HIADHN C[C@H](c1ccc(N2CCCS2(=O)=O)cc1)N(C)Cc1ccccc1OC(F)F ZINC000485823605 901071433 /nfs/dbraw/zinc/07/14/33/901071433.db2.gz QTDRHRFZEVVEOG-OAHLLOKOSA-N 0 3 410.486 4.021 20 0 HIADHN CN(C)Cc1ccccc1C(=O)NCC1(c2ccc(Br)cc2)CCC1 ZINC000485881136 901116328 /nfs/dbraw/zinc/11/63/28/901116328.db2.gz KYSGKAJDSLWOCJ-UHFFFAOYSA-N 0 3 401.348 4.362 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3CCc4c(C)cc(C)cc4C3)c(C)c2)CC1 ZINC000485971410 901189705 /nfs/dbraw/zinc/18/97/05/901189705.db2.gz ZIKXULLUQAOMDD-UHFFFAOYSA-N 0 3 406.574 4.344 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)NC[C@@H](c2ccccc2)C(F)(F)F)C1 ZINC000486141344 901329292 /nfs/dbraw/zinc/32/92/92/901329292.db2.gz CBGBTBWQWUGAEN-AHRSYUTCSA-N 0 3 405.464 4.467 20 0 HIADHN C[C@@H](NC(=O)NCC(C)(C)N1CCc2ccccc2C1)c1ccc2ncsc2c1 ZINC000486157731 901344923 /nfs/dbraw/zinc/34/49/23/901344923.db2.gz NNECCPUCXSDXAS-MRXNPFEDSA-N 0 3 408.571 4.493 20 0 HIADHN CN(C)Cc1ccccc1C(=O)Nc1ccc(CC(=O)Nc2ccccc2F)cc1 ZINC000486163328 901351689 /nfs/dbraw/zinc/35/16/89/901351689.db2.gz HZNYMIXJGMAOAT-UHFFFAOYSA-N 0 3 405.473 4.321 20 0 HIADHN CC(=O)c1cc(C(=O)N2CC[C@]3(C2)CCCN(Cc2ccccc2)C3)c(C)nc1C ZINC000486434684 901593226 /nfs/dbraw/zinc/59/32/26/901593226.db2.gz PORSGJGDAJMIRU-RUZDIDTESA-N 0 3 405.542 4.029 20 0 HIADHN CCOC(=O)c1ccc(CN2C[C@H]3CCC[C@@]3(c3nc(-c4ccccc4)no3)C2)o1 ZINC000486444297 901603275 /nfs/dbraw/zinc/60/32/75/901603275.db2.gz JTRNCCGNHRCKTF-UZUQRXQVSA-N 0 3 407.470 4.060 20 0 HIADHN Cc1ncc(CN2C[C@H]3CCC[C@@]3(c3nc(CC4CC4)no3)C2)n1-c1ccccc1 ZINC000486464298 901624127 /nfs/dbraw/zinc/62/41/27/901624127.db2.gz SZONGYCGVXDKRF-NTKDMRAZSA-N 0 3 403.530 4.070 20 0 HIADHN Cc1cc(C)n([C@H](C)CC(=O)N[C@H](c2ccc(F)c(F)c2)C(C)(C)N2CCCC2)n1 ZINC000486562112 901707031 /nfs/dbraw/zinc/70/70/31/901707031.db2.gz QFJOTCARBWRKIL-VGOFRKELSA-N 0 3 418.532 4.461 20 0 HIADHN Cc1nn(C)c(C)c1[C@H](C)C(=O)N[C@H](c1ccc(F)c(F)c1)C(C)(C)N1CCCC1 ZINC000486584703 901725363 /nfs/dbraw/zinc/72/53/63/901725363.db2.gz IBCNCDRXSHMUNE-LHSJRXKWSA-N 0 3 418.532 4.151 20 0 HIADHN CC(C)c1nnc(CCC(=O)N[C@H](c2ccc(F)c(F)c2)C(C)(C)N2CCCC2)o1 ZINC000486586338 901726483 /nfs/dbraw/zinc/72/64/83/901726483.db2.gz NTDVMKMQIMADNO-HXUWFJFHSA-N 0 3 420.504 4.136 20 0 HIADHN C[C@H]([N-]S(=O)(=O)c1c(Cl)cccc1Cl)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000486597779 901735666 /nfs/dbraw/zinc/73/56/66/901735666.db2.gz RNZNFHHQTUQLFB-HOCLYGCPSA-N 0 3 413.370 4.182 20 0 HIADHN C[C@H]([N-]S(=O)(=O)c1c(Cl)cccc1Cl)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000486597779 901735677 /nfs/dbraw/zinc/73/56/77/901735677.db2.gz RNZNFHHQTUQLFB-HOCLYGCPSA-N 0 3 413.370 4.182 20 0 HIADHN O=C(Nc1ccc(NC2CCOCC2)cc1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000486626027 901759893 /nfs/dbraw/zinc/75/98/93/901759893.db2.gz KGXOEWIFAVRHAE-LJQANCHMSA-N 0 3 411.521 4.267 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)Cc3ccc(F)cc3Cl)CC2)c1 ZINC000486826092 901878855 /nfs/dbraw/zinc/87/88/55/901878855.db2.gz PHFNGGCPZSKSSF-UHFFFAOYSA-N 0 3 417.956 4.049 20 0 HIADHN CCN1CC[C@H](NC(=O)c2ccccc2CN(C)C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000486829810 901881487 /nfs/dbraw/zinc/88/14/87/901881487.db2.gz YDLWPDWQOHIGSH-SFTDATJTSA-N 0 3 403.929 4.106 20 0 HIADHN CCCC(=O)Nc1ccc(Cl)c(NC(=O)NC[C@@H](Cc2ccccc2)N(C)C)c1 ZINC000486873228 901918639 /nfs/dbraw/zinc/91/86/39/901918639.db2.gz YBMKTPOJEKTALF-GOSISDBHSA-N 0 3 416.953 4.373 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)Nc3nc(-c4cccc(C(F)(F)F)c4)cs3)[C@@H]2C1 ZINC000486881428 901927262 /nfs/dbraw/zinc/92/72/62/901927262.db2.gz APNLAMHDXVBHQZ-BLLLJJGKSA-N 0 3 410.465 4.387 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)CCc3ccc4ccccc4n3)c2)CC1 ZINC000486886619 901933147 /nfs/dbraw/zinc/93/31/47/901933147.db2.gz MWCXKLHEGUPKAF-UHFFFAOYSA-N 0 3 402.542 4.337 20 0 HIADHN CCCC(=O)Nc1ccc(Cl)c(NC(=O)N(CCN(C)C)Cc2ccccn2)c1 ZINC000486904784 901950561 /nfs/dbraw/zinc/95/05/61/901950561.db2.gz WZJNQVCZLROSEP-UHFFFAOYSA-N 0 3 417.941 4.069 20 0 HIADHN C[C@@H]1CN([C@H](CNCc2scnc2C2CC2)c2c(F)cccc2Cl)CCO1 ZINC000486925303 901967337 /nfs/dbraw/zinc/96/73/37/901967337.db2.gz FDPGRWKBIPSQNO-CXAGYDPISA-N 0 3 409.958 4.365 20 0 HIADHN FC(F)(F)c1ccc(-c2n[nH]cc2CNCc2ccc(N3CCCC3)nc2)cc1 ZINC000486956066 901988084 /nfs/dbraw/zinc/98/80/84/901988084.db2.gz MXLPFKQJWSCNAH-UHFFFAOYSA-N 0 3 401.436 4.381 20 0 HIADHN CN(C(=O)NC[C@H](c1ccccc1)C(F)(F)F)[C@H]1CCN(Cc2ccccc2)C1 ZINC000486987284 902003734 /nfs/dbraw/zinc/00/37/34/902003734.db2.gz LXLXXVRPKSWQNN-VQTJNVASSA-N 0 3 405.464 4.248 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)Nc3ccc(C(=O)C4CCC4)cc3)CC2)C[C@H](C)O1 ZINC000487062727 902043192 /nfs/dbraw/zinc/04/31/92/902043192.db2.gz ZAPDHBIDJRSRTI-ROUUACIJSA-N 0 3 413.562 4.023 20 0 HIADHN CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)CCOc1ccc2ccccc2c1 ZINC000487260875 902124364 /nfs/dbraw/zinc/12/43/64/902124364.db2.gz IVXBYGIWQHVFBM-DHLKQENFSA-N 0 3 403.526 4.155 20 0 HIADHN COc1cc(-c2noc(CN[C@H]3CCCC[C@H]3C(C)(C)C)n2)cc(OC)c1OC ZINC000487391104 902175277 /nfs/dbraw/zinc/17/52/77/902175277.db2.gz KYTIVQRATKVHOM-CVEARBPZSA-N 0 3 403.523 4.457 20 0 HIADHN COc1cc(-c2noc(CN3CCC[C@H]3CCc3ccccc3)n2)cc(OC)c1OC ZINC000487414286 902196719 /nfs/dbraw/zinc/19/67/19/902196719.db2.gz PNSIAGLFRVSSTO-IBGZPJMESA-N 0 3 423.513 4.360 20 0 HIADHN COc1cc(-c2noc(CN3CCCC[C@@H]3Cc3ccccc3)n2)cc(OC)c1OC ZINC000487437175 902210877 /nfs/dbraw/zinc/21/08/77/902210877.db2.gz YQXTXNPWXZUANL-LJQANCHMSA-N 0 3 423.513 4.360 20 0 HIADHN Cc1nc(-c2ccc(C)cc2NC(=O)CN2CCC[C@H](c3ccccc3)CC2)n[nH]1 ZINC000487436800 902211297 /nfs/dbraw/zinc/21/12/97/902211297.db2.gz XKQMJTFBQKGTFQ-FQEVSTJZSA-N 0 3 403.530 4.297 20 0 HIADHN COc1ccc([C@H](NC(=O)CN(C)C(C)C)c2ccccc2)cc1Br ZINC000487468012 902220505 /nfs/dbraw/zinc/22/05/05/902220505.db2.gz DYXPLVXJSQBNBO-HXUWFJFHSA-N 0 3 405.336 4.004 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)Cc2csc(Cc3ccccc3)n2)c1 ZINC000487526659 902233825 /nfs/dbraw/zinc/23/38/25/902233825.db2.gz AKRUMRQUGLBIQH-UHFFFAOYSA-N 0 3 407.583 4.175 20 0 HIADHN CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)N[C@H]1CCC[C@H](c2ccccc2)C1 ZINC000487747079 902338118 /nfs/dbraw/zinc/33/81/18/902338118.db2.gz GLECXBYJXNIVSM-BIHRQFPBSA-N 0 3 406.574 4.442 20 0 HIADHN CN(CC(=O)Nc1c(Cl)cccc1Cl)C1CCN(CCC(F)(F)F)CC1 ZINC000487849038 902405008 /nfs/dbraw/zinc/40/50/08/902405008.db2.gz YLDMUONJLUCCOP-UHFFFAOYSA-N 0 3 412.283 4.281 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@@H](C)[C@@H]1OCCc2sccc21)c1ccsc1 ZINC000487858819 902410333 /nfs/dbraw/zinc/41/03/33/902410333.db2.gz NNTPRYXLINLWCH-YJLNNSPDSA-N 0 3 407.605 4.194 20 0 HIADHN Cc1ccccc1COc1cccc(NC(=O)N2CCN(C3CCOCC3)C[C@H]2C)c1 ZINC000488009877 902529692 /nfs/dbraw/zinc/52/96/92/902529692.db2.gz OLTPQGNSVUDYOP-HXUWFJFHSA-N 0 3 423.557 4.291 20 0 HIADHN Brc1ccccc1-c1noc(C2CCN(CCOCC3CC3)CC2)n1 ZINC000488245791 902719833 /nfs/dbraw/zinc/71/98/33/902719833.db2.gz SEMSTAPXXNHRBQ-UHFFFAOYSA-N 0 3 406.324 4.105 20 0 HIADHN C[C@@H]1CN(C2CCOCC2)CCN1C(=O)Nc1ccccc1N(C)Cc1ccccc1 ZINC000488380659 902790101 /nfs/dbraw/zinc/79/01/01/902790101.db2.gz QMAACPNQSJSVDM-HXUWFJFHSA-N 0 3 422.573 4.040 20 0 HIADHN CCn1cc([C@@H]2NC(=O)CC[C@H]2N[C@@H](C)c2cc3c(ccc4ccccc34)o2)cn1 ZINC000488488118 902850532 /nfs/dbraw/zinc/85/05/32/902850532.db2.gz QPLFVFUHOVHCTQ-VNJOCVIMSA-N 0 3 402.498 4.473 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)c3scc(C)c3Br)cc2)CC1 ZINC000488492628 902852825 /nfs/dbraw/zinc/85/28/25/902852825.db2.gz SRMCHRLCOKBQLB-UHFFFAOYSA-N 0 3 422.392 4.209 20 0 HIADHN C[C@H](NC(=O)N[C@H](CC1CC1)c1cc(F)cc(Br)c1)C1=CCN(C)CC1 ZINC000488508987 902862024 /nfs/dbraw/zinc/86/20/24/902862024.db2.gz CCUHXGKZMYYUHR-ORAYPTAESA-N 0 3 424.358 4.379 20 0 HIADHN CN(CCCc1cc(-c2ccc(F)cc2)n[nH]1)[C@@H]1CCN(c2ccccc2F)C1=O ZINC000488590554 902892639 /nfs/dbraw/zinc/89/26/39/902892639.db2.gz DVAJUSWHWJYDPT-JOCHJYFZSA-N 0 3 410.468 4.025 20 0 HIADHN C[C@@H]1CN(C2CCOCC2)CCN1C(=O)Nc1cc(Cl)cc(C(F)(F)F)c1 ZINC000488637541 902912932 /nfs/dbraw/zinc/91/29/32/902912932.db2.gz MIPXQMPALQRRSI-GFCCVEGCSA-N 0 3 405.848 4.076 20 0 HIADHN Cc1ccc(Cl)c(O[C@@H](C)C(=O)Nc2cccc(CN3CCC(O)CC3)c2)c1 ZINC000488652483 902919322 /nfs/dbraw/zinc/91/93/22/902919322.db2.gz CTGCQTALIVMXAG-INIZCTEOSA-N 0 3 402.922 4.011 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)COc2cccc(C(F)(F)F)c2)CC1 ZINC000488693861 902948649 /nfs/dbraw/zinc/94/86/49/902948649.db2.gz DMSMOMIAERDAAN-UHFFFAOYSA-N 0 3 406.448 4.207 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)c1ccc(Br)cc1Cl ZINC000488705478 902954778 /nfs/dbraw/zinc/95/47/78/902954778.db2.gz VVVAECWXWBNYQR-UHFFFAOYSA-N 0 3 423.738 4.312 20 0 HIADHN O=C(NC[C@@H](OCc1ccccc1)c1ccc(Cl)cc1)N[C@H]1CCN(C2CC2)C1 ZINC000489049393 903154317 /nfs/dbraw/zinc/15/43/17/903154317.db2.gz VGEMZFLSEWKZAW-RBBKRZOGSA-N 0 3 413.949 4.134 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1cc(C)nn1-c1cc(C)ccn1)c1ccsc1 ZINC000489129942 903218361 /nfs/dbraw/zinc/21/83/61/903218361.db2.gz JELWKUOIIJHVEQ-GOSISDBHSA-N 0 3 412.563 4.150 20 0 HIADHN COc1cc(CN(C)Cc2ccc(-n3cncn3)cc2)ccc1OCc1ccccc1 ZINC000506026778 914706626 /nfs/dbraw/zinc/70/66/26/914706626.db2.gz MPWNGFNDYPAANC-UHFFFAOYSA-N 0 3 414.509 4.487 20 0 HIADHN Cc1ccc(-c2noc([C@@H](C)N3CCC(CCCN4CCOCC4)CC3)n2)cc1F ZINC000506027557 914710162 /nfs/dbraw/zinc/71/01/62/914710162.db2.gz MPMWVDGPNGANRH-GOSISDBHSA-N 0 3 416.541 4.070 20 0 HIADHN C[C@H]1C[C@@H]1C(=O)Nc1ccc(C(=O)Nc2ccc(CCN3CCSCC3)cc2)cc1 ZINC000489418525 903375366 /nfs/dbraw/zinc/37/53/66/903375366.db2.gz MMRWBXGKARXEEG-JTSKRJEESA-N 0 3 423.582 4.125 20 0 HIADHN CCN(Cc1nc(=O)c2c(C)c(C(=O)Nc3ccc(C)cc3C)sc2[nH]1)CC1CC1 ZINC000489456871 903394794 /nfs/dbraw/zinc/39/47/94/903394794.db2.gz MTYYHJMWHIPRSD-UHFFFAOYSA-N 0 3 424.570 4.394 20 0 HIADHN COc1ccc([C@@H](C)CCNC(=O)N(Cc2ccccc2)C2CCN(C)CC2)cc1 ZINC000489564867 903467795 /nfs/dbraw/zinc/46/77/95/903467795.db2.gz YOXCVJZHTUDGQL-FQEVSTJZSA-N 0 3 409.574 4.495 20 0 HIADHN CC[C@@H](NC(=O)NCc1ccccc1CN1CCC(O)CC1)C(C)(C)c1ccccc1 ZINC000489587331 903480155 /nfs/dbraw/zinc/48/01/55/903480155.db2.gz QMPXJVAHMZJNQB-XMMPIXPASA-N 0 3 423.601 4.199 20 0 HIADHN Cc1ccccc1[C@H](NC(=O)NCCCCN1CCN(c2ccccc2)CC1)C1CC1 ZINC000489619247 903501272 /nfs/dbraw/zinc/50/12/72/903501272.db2.gz HABPDGDAOYHSAT-RUZDIDTESA-N 0 3 420.601 4.348 20 0 HIADHN Cn1nc(-c2ccsc2)cc1NC(=O)NCC(C)(C)N1CCc2ccccc2C1 ZINC000489700541 903547973 /nfs/dbraw/zinc/54/79/73/903547973.db2.gz MXOKTHPBPARAPF-UHFFFAOYSA-N 0 3 409.559 4.107 20 0 HIADHN CN(Cc1nc2ccccc2s1)C(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000506039778 914728123 /nfs/dbraw/zinc/72/81/23/914728123.db2.gz CGJYKLXDPBAMQZ-QGZVFWFLSA-N 0 3 415.509 4.412 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)N1CCCCC[C@H]1c1ccco1 ZINC000489812332 903609154 /nfs/dbraw/zinc/60/91/54/903609154.db2.gz SSWBCTSONOIFJL-QFIPXVFZSA-N 0 3 411.546 4.063 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)NCc2ccccc2OC(F)(F)F)CC1 ZINC000489865698 903637775 /nfs/dbraw/zinc/63/77/75/903637775.db2.gz OFIWVDVMKVYPSL-UHFFFAOYSA-N 0 3 421.463 4.391 20 0 HIADHN Cc1ccc(OCCCCNC(=O)N(Cc2ccccc2)C2CCN(C)CC2)cc1 ZINC000489909949 903667405 /nfs/dbraw/zinc/66/74/05/903667405.db2.gz ICCMGOGLNFBDBU-UHFFFAOYSA-N 0 3 409.574 4.460 20 0 HIADHN CNS(=O)(=O)c1ccc([C@H](C)N[C@H](C)c2ccc(Oc3cccnc3)cc2)cc1 ZINC000489955283 903696521 /nfs/dbraw/zinc/69/65/21/903696521.db2.gz JDSFWEOSJPPYEA-SJORKVTESA-N 0 3 411.527 4.194 20 0 HIADHN Cc1ccc(C2(C(=O)NC[C@H](c3ccc(OC(C)C)cc3)N(C)C)CCOCC2)cc1 ZINC000489964355 903700406 /nfs/dbraw/zinc/70/04/06/903700406.db2.gz KZANQSOVVZFXAG-XMMPIXPASA-N 0 3 424.585 4.250 20 0 HIADHN CN(c1ccccc1)C1CCN(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)CC1 ZINC000489985813 903712944 /nfs/dbraw/zinc/71/29/44/903712944.db2.gz AOVNAIBOQRYIFU-DEOSSOPVSA-N 0 3 406.574 4.134 20 0 HIADHN COc1cc(CN[C@H]2CCN(C(C)=O)Cc3ccccc32)ccc1OCC(F)(F)F ZINC000490129843 903781784 /nfs/dbraw/zinc/78/17/84/903781784.db2.gz HPOCNLIXKMHFHY-IBGZPJMESA-N 0 3 422.447 4.219 20 0 HIADHN COc1ccc(CN[C@H]2CCN(C(C)=O)Cc3ccccc32)cc1Br ZINC000490144893 903791116 /nfs/dbraw/zinc/79/11/16/903791116.db2.gz RBCSJFRPXZFWOV-IBGZPJMESA-N 0 3 403.320 4.041 20 0 HIADHN COc1cccc(CCN[C@@H](c2ccc(F)cc2)c2cccc(S(C)(=O)=O)c2)c1 ZINC000490190431 903817250 /nfs/dbraw/zinc/81/72/50/903817250.db2.gz IXOKFJOYPKFJOF-QHCPKHFHSA-N 0 3 413.514 4.160 20 0 HIADHN Cc1ccc(NC(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)cc1C(=O)N1CCCCC1 ZINC000490207631 903828959 /nfs/dbraw/zinc/82/89/59/903828959.db2.gz ZQJMUNLYQKSFJW-GOTSBHOMSA-N 0 3 420.557 4.188 20 0 HIADHN O=C(N[C@H](c1ccccc1)c1ccncc1)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000490238554 903846352 /nfs/dbraw/zinc/84/63/52/903846352.db2.gz FJKFVWNLMFBSEH-BJKOFHAPSA-N 0 3 400.526 4.135 20 0 HIADHN CN(C)Cc1ccc(-c2noc(C(C)(C)S(=O)(=O)c3ccc(Cl)cc3)n2)cc1 ZINC000490300990 903888892 /nfs/dbraw/zinc/88/88/92/903888892.db2.gz RAXDCTRZOFVSNU-UHFFFAOYSA-N 0 3 419.934 4.161 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)Nc3ccc(NC(=O)c4ccc(Cl)cc4)cc3)[C@@H]2C1 ZINC000490327970 903913130 /nfs/dbraw/zinc/91/31/30/903913130.db2.gz PLJWCSVPKWJGHC-MGPUTAFESA-N 0 3 412.921 4.150 20 0 HIADHN COc1cc(C)ccc1Oc1ccc(F)cc1NC(=O)N1CC[C@@H]2CCN(C)C[C@H]21 ZINC000490339315 903930392 /nfs/dbraw/zinc/93/03/92/903930392.db2.gz IEGHCBKSWCGUDN-QFBILLFUSA-N 0 3 413.493 4.493 20 0 HIADHN COc1cc(C)ccc1Oc1ccc(F)cc1NC(=O)N1CC[C@H]2CCN(C)C[C@@H]21 ZINC000490339312 903930538 /nfs/dbraw/zinc/93/05/38/903930538.db2.gz IEGHCBKSWCGUDN-APWZRJJASA-N 0 3 413.493 4.493 20 0 HIADHN COc1ccc(NC(=O)NC[C@H](c2ccc(C)cc2)N(C)C)cc1Br ZINC000490356466 903949244 /nfs/dbraw/zinc/94/92/44/903949244.db2.gz WGGYWBDEIODKQL-QGZVFWFLSA-N 0 3 406.324 4.191 20 0 HIADHN CN(C)[C@H](CNC(=O)N1CCCC[C@H]1c1nc(-c2ccccc2)no1)c1ccccc1 ZINC000490360148 903952910 /nfs/dbraw/zinc/95/29/10/903952910.db2.gz BVZLUJWKKHRAGS-LEWJYISDSA-N 0 3 419.529 4.276 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)Nc1cc(-c2ccc(Cl)s2)nn1C ZINC000490572432 904109838 /nfs/dbraw/zinc/10/98/38/904109838.db2.gz RIMGYLXJWKMLRB-UHFFFAOYSA-N 0 3 417.966 4.398 20 0 HIADHN O=C(CCN1CCN(c2ccccc2)CC1)NCC[C@@H](c1ccccc1)C(F)(F)F ZINC000490857839 904290000 /nfs/dbraw/zinc/29/00/00/904290000.db2.gz VVZSZLQOSALOFI-NRFANRHFSA-N 0 3 419.491 4.051 20 0 HIADHN O=C(Nc1ccccc1CN1CCSCC1)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000490962619 904339357 /nfs/dbraw/zinc/33/93/57/904339357.db2.gz NZNJEWKVXRENSJ-QFIPXVFZSA-N 0 3 424.614 4.022 20 0 HIADHN CCCc1nc(C)c(CNC(=O)NC[C@H](c2ccc(Cl)cc2)N(C)CCC)o1 ZINC000490986922 904352970 /nfs/dbraw/zinc/35/29/70/904352970.db2.gz IUCADBWMLUTDTQ-GOSISDBHSA-N 0 3 406.958 4.471 20 0 HIADHN Cc1cc(C)c(CC(C(=O)Nc2cc(OC(F)F)n(C)n2)C(F)(F)F)c(C)c1 ZINC000490987685 904353266 /nfs/dbraw/zinc/35/32/66/904353266.db2.gz KCEMXKRMOACTBL-ZDUSSCGKSA-N 0 3 405.367 4.306 20 0 HIADHN Cc1ccc([C@H](NC[C@H](O)C2CCCCC2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000491003905 904364154 /nfs/dbraw/zinc/36/41/54/904364154.db2.gz GPFLOMIUUOCYKD-BJKOFHAPSA-N 0 3 415.599 4.327 20 0 HIADHN CN(C)C(=O)C1CCN(Cc2ccc(OCc3c(F)cccc3Cl)cc2)CC1 ZINC000506101141 914804037 /nfs/dbraw/zinc/80/40/37/914804037.db2.gz NFYAXBMKUCQCCT-UHFFFAOYSA-N 0 3 404.913 4.358 20 0 HIADHN CCc1ccc([C@H](CNC(=O)NCc2cccc(NC(=O)[C@@H](C)CC)c2)N(C)C)cc1 ZINC000506103864 914805064 /nfs/dbraw/zinc/80/50/64/914805064.db2.gz CYYOLKVMOSQKJU-MBSDFSHPSA-N 0 3 424.589 4.336 20 0 HIADHN CCc1ccc([C@H](N[C@@H](C)CN(CC)CC)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000491035348 904387364 /nfs/dbraw/zinc/38/73/64/904387364.db2.gz JJMOXPKKQDEDOF-MBSDFSHPSA-N 0 3 402.604 4.062 20 0 HIADHN CC[C@H](C)N(C)CCN[C@H](c1cccc(S(C)(=O)=O)c1)c1ccc(C)cc1C ZINC000491050407 904395397 /nfs/dbraw/zinc/39/53/97/904395397.db2.gz HPJUCVGRTOTHFS-WMZHIEFXSA-N 0 3 402.604 4.116 20 0 HIADHN CCc1ccc([C@@H](NCCN(C)[C@@H](C)CC)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000491054137 904396842 /nfs/dbraw/zinc/39/68/42/904396842.db2.gz PXGSPNGPHXRZSM-FDDCHVKYSA-N 0 3 402.604 4.062 20 0 HIADHN CC(=O)N1CCC(CN[C@@H](c2ccc3c(c2)OCCO3)c2ccccc2Cl)CC1 ZINC000491054972 904398295 /nfs/dbraw/zinc/39/82/95/904398295.db2.gz RUOSTTYYEPJSLR-QHCPKHFHSA-N 0 3 414.933 4.049 20 0 HIADHN O=c1[nH]c(CN2CCCN(Cc3ccc(C(F)(F)F)cc3)CC2)nc2ccsc21 ZINC000506107668 914806340 /nfs/dbraw/zinc/80/63/40/914806340.db2.gz HEPDLALTNBBORI-UHFFFAOYSA-N 0 3 422.476 4.124 20 0 HIADHN CCOc1cc(CN2CCC[C@@H]2c2cccs2)ccc1O[C@H](C)C(=O)N(C)C ZINC000506115783 914809470 /nfs/dbraw/zinc/80/94/70/914809470.db2.gz JQTGYYDDWLCJOH-SJLPKXTDSA-N 0 3 402.560 4.339 20 0 HIADHN Brc1ccc(CN2CCC[C@H](c3nnc4ccccn43)C2)c2ncccc12 ZINC000491088572 904420179 /nfs/dbraw/zinc/42/01/79/904420179.db2.gz AZVMZJOQKRBTNV-INIZCTEOSA-N 0 3 422.330 4.420 20 0 HIADHN Cc1ccc(F)cc1CN1CCC(C(=O)Nc2ccc(Br)cn2)CC1 ZINC000491131808 904445979 /nfs/dbraw/zinc/44/59/79/904445979.db2.gz IGXGERNCYCWLTC-UHFFFAOYSA-N 0 3 406.299 4.142 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)NCc2cccc(COC(C)(C)C)c2)cc1 ZINC000491145180 904455195 /nfs/dbraw/zinc/45/51/95/904455195.db2.gz MIVFCWJRQLYLPA-QFIPXVFZSA-N 0 3 413.562 4.112 20 0 HIADHN CC(=O)N1CC[C@@H](NCc2c(C)nn(Cc3ccccc3)c2C)c2ccccc2C1 ZINC000491270671 904511723 /nfs/dbraw/zinc/51/17/23/904511723.db2.gz IZWBSEYRFGQHDL-RUZDIDTESA-N 0 3 402.542 4.131 20 0 HIADHN COc1ccc([C@@H](CNC(=O)CN2CC[C@H](C3CC3)C2)c2c[nH]c3ccccc32)cc1 ZINC000491277042 904515170 /nfs/dbraw/zinc/51/51/70/904515170.db2.gz HGEKVPNPVQBOQS-NZQKXSOJSA-N 0 3 417.553 4.157 20 0 HIADHN COc1ccc([C@H](CNC(=O)CN2CC[C@@H](C3CC3)C2)c2c[nH]c3ccccc32)cc1 ZINC000491277044 904515710 /nfs/dbraw/zinc/51/57/10/904515710.db2.gz HGEKVPNPVQBOQS-OFNKIYASSA-N 0 3 417.553 4.157 20 0 HIADHN CN(C)C1(CN[C@@H](c2ccc(Cl)cc2)c2cccc(S(C)(=O)=O)c2)CCCC1 ZINC000491318199 904534189 /nfs/dbraw/zinc/53/41/89/904534189.db2.gz ZMSZLTKCTXCYGB-NRFANRHFSA-N 0 3 421.006 4.297 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)Nc3ccc(Cc4nc5ccccc5s4)cc3)[C@H]2C1 ZINC000491316251 904534981 /nfs/dbraw/zinc/53/49/81/904534981.db2.gz LCJKAKWMFQDIIO-PXNSSMCTSA-N 0 3 406.555 4.445 20 0 HIADHN NS(=O)(=O)c1ccc(CCN[C@@H](c2ccc(F)cc2)c2ccccc2Cl)cc1 ZINC000491329003 904539044 /nfs/dbraw/zinc/53/90/44/904539044.db2.gz KOKIIYKVIQUVMB-NRFANRHFSA-N 0 3 418.921 4.048 20 0 HIADHN O=C1CCCN1CCCN[C@@H](c1cccc(F)c1)c1cccc(Br)c1 ZINC000491354499 904551272 /nfs/dbraw/zinc/55/12/72/904551272.db2.gz BXQLTGSLPYIYTM-HXUWFJFHSA-N 0 3 405.311 4.280 20 0 HIADHN O=C(Nc1cccc(OC2CCCC2)c1)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000491429595 904591586 /nfs/dbraw/zinc/59/15/86/904591586.db2.gz BCYYTFQBMLLLQC-UHFFFAOYSA-N 0 3 408.542 4.465 20 0 HIADHN c1csc(-c2noc(CCCN3CCN(Cc4cccc5[nH]ccc54)CC3)n2)c1 ZINC000506158946 914828240 /nfs/dbraw/zinc/82/82/40/914828240.db2.gz CUBRTFUTJSVDEZ-UHFFFAOYSA-N 0 3 407.543 4.030 20 0 HIADHN Cc1cccc2[nH]cc(CCNC(=O)Nc3ccc(CCN4CCSCC4)cc3)c21 ZINC000491501875 904625569 /nfs/dbraw/zinc/62/55/69/904625569.db2.gz DBDQDLVNOLGGIN-UHFFFAOYSA-N 0 3 422.598 4.432 20 0 HIADHN O=C(Nc1ccc(F)c(C(F)(F)F)c1)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000491523051 904635401 /nfs/dbraw/zinc/63/54/01/904635401.db2.gz CLMVYOSMFOGPOW-UHFFFAOYSA-N 0 3 410.411 4.301 20 0 HIADHN CCCCOc1ccc(CN2CCC(C(=O)Nc3ccccc3O)CC2)cc1OC ZINC000506164124 914829999 /nfs/dbraw/zinc/82/99/99/914829999.db2.gz OIPVJIBEJUNQIC-UHFFFAOYSA-N 0 3 412.530 4.430 20 0 HIADHN CN(Cc1ccc(OCc2cccnc2)cc1)Cc1ccccc1N1CCOCC1 ZINC000506165224 914830477 /nfs/dbraw/zinc/83/04/77/914830477.db2.gz ZWSZAKDTYPUGLP-UHFFFAOYSA-N 0 3 403.526 4.129 20 0 HIADHN C[C@@H](N[C@@H](C)c1cc(Br)cs1)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000491846011 904711378 /nfs/dbraw/zinc/71/13/78/904711378.db2.gz HNNJQZDFNIHUSH-NEPJUHHUSA-N 0 3 417.394 4.173 20 0 HIADHN Cc1noc(C)c1[C@H](C)CNC(=O)NC[C@H](c1cccs1)N1CCC(C)CC1 ZINC000506182370 914836760 /nfs/dbraw/zinc/83/67/60/914836760.db2.gz FWYMONBBMOIWSN-CRAIPNDOSA-N 0 3 404.580 4.229 20 0 HIADHN Cn1cc(CN[C@H](Cc2ccc(F)cc2)[C@@H]2COc3ccccc3O2)c(C(F)F)n1 ZINC000492004990 904758790 /nfs/dbraw/zinc/75/87/90/904758790.db2.gz XZGHJTZQRCEUEF-XLIONFOSSA-N 0 3 417.431 4.038 20 0 HIADHN CCN1CCCC[C@@H]1CN[C@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000492181559 904811017 /nfs/dbraw/zinc/81/10/17/904811017.db2.gz UGSJXFBQMNHGQS-IFMALSPDSA-N 0 3 421.006 4.297 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)Nc3ccc(Oc4cccc(C(F)(F)F)n4)cc3)[C@H]2C1 ZINC000492236521 904821136 /nfs/dbraw/zinc/82/11/36/904821136.db2.gz IBUKSLTUWZGLKD-PBHICJAKSA-N 0 3 420.435 4.451 20 0 HIADHN Cn1ccnc1COc1ccc(CN2CCC(n3ccc(C(F)(F)F)n3)CC2)cc1 ZINC000492370537 904839781 /nfs/dbraw/zinc/83/97/81/904839781.db2.gz ASFKWKRFHQYZKW-UHFFFAOYSA-N 0 3 419.451 4.052 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)C(=O)Nc1cccc2cnccc21)c1ccc(Cl)cc1 ZINC000506236403 914857586 /nfs/dbraw/zinc/85/75/86/914857586.db2.gz WCISNZKFCFVBOG-NRFANRHFSA-N 0 3 424.932 4.026 20 0 HIADHN CCCN(C)[C@H](CNC(=O)C(=O)Nc1cccc2cnccc21)c1ccc(Cl)cc1 ZINC000506236404 914857676 /nfs/dbraw/zinc/85/76/76/914857676.db2.gz WCISNZKFCFVBOG-OAQYLSRUSA-N 0 3 424.932 4.026 20 0 HIADHN Cc1ccc([C@@H](NC[C@@H](CO)c2ccccc2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000493128521 905025674 /nfs/dbraw/zinc/02/56/74/905025674.db2.gz JVFGEJZOXAEACQ-DHLKQENFSA-N 0 3 423.578 4.162 20 0 HIADHN CCc1ccc([C@H](NC[C@@H](CO)c2ccccc2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000493134347 905029668 /nfs/dbraw/zinc/02/96/68/905029668.db2.gz YYUKQBRNHQTFNQ-ZCYQVOJMSA-N 0 3 423.578 4.108 20 0 HIADHN Cc1ccc([C@@H](NC[C@@H](CCO)c2ccccc2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000493275956 905074393 /nfs/dbraw/zinc/07/43/93/905074393.db2.gz DPENNUSBMUFQHE-ILBGXUMGSA-N 0 3 423.578 4.244 20 0 HIADHN Cc1ccc([C@H](NCCCNc2ccccn2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000493278065 905076312 /nfs/dbraw/zinc/07/63/12/905076312.db2.gz SIZJDGHYOKUFBY-XMMPIXPASA-N 0 3 423.582 4.283 20 0 HIADHN CCO[C@H](CCN[C@@H](c1ccc(F)cc1)c1cccc(S(C)(=O)=O)c1)C(C)C ZINC000493308850 905084374 /nfs/dbraw/zinc/08/43/74/905084374.db2.gz ZXQYWZRSTADIQK-YADHBBJMSA-N 0 3 407.551 4.359 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N[C@H](Cc1ccccc1)c1cccs1 ZINC000493337552 905090169 /nfs/dbraw/zinc/09/01/69/905090169.db2.gz PCCNVNQIKHFEBC-OAQYLSRUSA-N 0 3 421.566 4.157 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N[C@@H](Cc1ccccc1)c1cccs1 ZINC000493337545 905090305 /nfs/dbraw/zinc/09/03/05/905090305.db2.gz PCCNVNQIKHFEBC-NRFANRHFSA-N 0 3 421.566 4.157 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)c3ccc(CSc4nc5ccccc5[nH]4)cc3)[C@H]2C1 ZINC000493436474 905118209 /nfs/dbraw/zinc/11/82/09/905118209.db2.gz CRUTXCSZWOLKHT-UTKZUKDTSA-N 0 3 406.555 4.021 20 0 HIADHN Cc1cc(-c2cc(C(=O)N3CC[C@@H]4CCN(C)C[C@@H]43)c3c(C)noc3n2)c(C)s1 ZINC000493467120 905130606 /nfs/dbraw/zinc/13/06/06/905130606.db2.gz RVIKMKVHOUXUJR-KXBFYZLASA-N 0 3 410.543 4.043 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)c3ccc(Oc4cccc(Br)c4)cc3)[C@H]2C1 ZINC000493537676 905152658 /nfs/dbraw/zinc/15/26/58/905152658.db2.gz XYPIKMCMMKJYHX-QRWLVFNGSA-N 0 3 415.331 4.408 20 0 HIADHN O=C(CN[C@H](Cc1ccccc1)c1ccccc1)NCCc1cccc2cccnc21 ZINC000493540879 905154840 /nfs/dbraw/zinc/15/48/40/905154840.db2.gz CHWLOIYQHPHWLY-RUZDIDTESA-N 0 3 409.533 4.467 20 0 HIADHN COc1cc(-c2nnc(CN[C@@H]3CCC[C@H]3CCC(C)C)o2)cc(OC)c1OC ZINC000493604266 905173260 /nfs/dbraw/zinc/17/32/60/905173260.db2.gz LCLUBAIFSLWBAB-DOTOQJQBSA-N 0 3 403.523 4.457 20 0 HIADHN O=C1[C@H](N[C@@H]2CCO[C@@H]2c2ccc(F)c(F)c2)CCCN1c1ccccc1Cl ZINC000493910113 905261638 /nfs/dbraw/zinc/26/16/38/905261638.db2.gz YTEFCHBDQYPJAU-QWFCFKBJSA-N 0 3 406.860 4.233 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3CC(C)(C)[C@H]3c3cccnc3)c(C)c2)CC1 ZINC000493934969 905288409 /nfs/dbraw/zinc/28/84/09/905288409.db2.gz HCIVPRHDZLUVEZ-JOCHJYFZSA-N 0 3 407.562 4.147 20 0 HIADHN O=C(NCc1ccco1)c1cccc(CN[C@@H]2CCO[C@@H]2c2ccc(F)c(F)c2)c1 ZINC000493937396 905289231 /nfs/dbraw/zinc/28/92/31/905289231.db2.gz PTJIRILBELFWIA-FGZHOGPDSA-N 0 3 412.436 4.108 20 0 HIADHN O=C(NCc1ccco1)c1cccc(CN[C@H]2CCO[C@H]2c2ccc(F)c(F)c2)c1 ZINC000493937397 905290554 /nfs/dbraw/zinc/29/05/54/905290554.db2.gz PTJIRILBELFWIA-VXKWHMMOSA-N 0 3 412.436 4.108 20 0 HIADHN Fc1ccc([C@@H]2OCC[C@H]2NCc2nc3ccc(Br)cc3[nH]2)cc1F ZINC000493952450 905301857 /nfs/dbraw/zinc/30/18/57/905301857.db2.gz KVOHSPAJQPLKRT-QAPCUYQASA-N 0 3 408.246 4.223 20 0 HIADHN COC[C@@H](N[C@@H](C)c1cc(F)ccc1N1CCN(C)CC1)c1ccc(Cl)cc1 ZINC000493961333 905311430 /nfs/dbraw/zinc/31/14/30/905311430.db2.gz PFNULPNVFXTRND-HRAATJIYSA-N 0 3 405.945 4.269 20 0 HIADHN CC(C)c1noc(-c2ccccc2C(=O)N[C@@H]2CCN(Cc3ccccc3)[C@H]2C)n1 ZINC000493997613 905340053 /nfs/dbraw/zinc/34/00/53/905340053.db2.gz ATVQAOMRCCFPJZ-LAUBAEHRSA-N 0 3 404.514 4.253 20 0 HIADHN C[C@H]1[C@H](NC(=O)C2(c3ccccc3Cl)CCOCC2)CCN1Cc1ccccc1 ZINC000494017694 905354514 /nfs/dbraw/zinc/35/45/14/905354514.db2.gz NNLFHDGWBQNMHO-PGRDOPGGSA-N 0 3 412.961 4.167 20 0 HIADHN Cc1ccc([C@@H](NCC(C)(C)C[C@@H](C)O)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000494019023 905356913 /nfs/dbraw/zinc/35/69/13/905356913.db2.gz GRBNSHBUBIXHAC-GCJKJVERSA-N 0 3 403.588 4.183 20 0 HIADHN CCN(CC(=O)Nc1ccccc1C(F)(F)F)C(=O)[C@@H](C(C)C)N1CCCCC1 ZINC000494040152 905383018 /nfs/dbraw/zinc/38/30/18/905383018.db2.gz APBBNBQULHTUAT-LJQANCHMSA-N 0 3 413.484 4.003 20 0 HIADHN COc1ccc(C(=O)N[C@@H]2CCN(Cc3ccccc3)[C@@H]2C)cc1-c1ccccn1 ZINC000494046620 905385437 /nfs/dbraw/zinc/38/54/37/905385437.db2.gz GXSDKJRNDSHPPA-XMSQKQJNSA-N 0 3 401.510 4.150 20 0 HIADHN O[C@@H](CN[C@H](c1cccc(F)c1)c1cccc(Br)c1)C1CCOCC1 ZINC000494047020 905386353 /nfs/dbraw/zinc/38/63/53/905386353.db2.gz FZIBKPZKJNTSKY-PMACEKPBSA-N 0 3 408.311 4.055 20 0 HIADHN CC(C)CC(=O)Nc1ccc(C(=O)N[C@@H]2CCN(Cc3ccccc3)[C@@H]2C)cc1F ZINC000494070294 905409524 /nfs/dbraw/zinc/40/95/24/905409524.db2.gz WISGXWMMGUYSHA-DYESRHJHSA-N 0 3 411.521 4.203 20 0 HIADHN C[C@@H]1[C@H](NC(=O)Cc2csc(Cc3ccc(F)cc3)n2)CCN1Cc1ccccc1 ZINC000494076640 905415251 /nfs/dbraw/zinc/41/52/51/905415251.db2.gz CQYNVZYGRCXRLT-VGOFRKELSA-N 0 3 423.557 4.195 20 0 HIADHN O=C(NC1CCN(Cc2ccccc2)CC1)c1ccnc(SCC(F)(F)F)c1 ZINC000494111673 905457629 /nfs/dbraw/zinc/45/76/29/905457629.db2.gz MABJKDBASGWPEN-UHFFFAOYSA-N 0 3 409.477 4.130 20 0 HIADHN C[C@H](NC(=O)NC[C@@H](c1cccs1)N1CCCC1)c1nc(C(F)(F)F)cs1 ZINC000494219164 905549345 /nfs/dbraw/zinc/54/93/45/905549345.db2.gz HVMVUHPSEFXVMQ-RYUDHWBXSA-N 0 3 418.510 4.421 20 0 HIADHN C[C@@H](NC(=O)N1CCN(C2CCOCC2)C[C@H]1C)c1cc(F)c(Cl)cc1Cl ZINC000494238578 905564066 /nfs/dbraw/zinc/56/40/66/905564066.db2.gz RSSBEGGRZOACLF-CHWSQXEVSA-N 0 3 418.340 4.088 20 0 HIADHN Clc1cc(CNCc2ccc(CN3CCOCC3)cc2)ccc1Br ZINC000494376756 905673390 /nfs/dbraw/zinc/67/33/90/905673390.db2.gz KSJJSXQXEWVOEU-UHFFFAOYSA-N 0 3 409.755 4.225 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N2CCC[C@H]2CCCc2ccccc2)CC1 ZINC000494396757 905690581 /nfs/dbraw/zinc/69/05/81/905690581.db2.gz KDHUIKILXCDGDP-HSZRJFAPSA-N 0 3 401.595 4.073 20 0 HIADHN COc1ccccc1[C@H](NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1)c1ccco1 ZINC000494424466 905711782 /nfs/dbraw/zinc/71/17/82/905711782.db2.gz ITGFCEIHVFFZCC-RDPSFJRHSA-N 0 3 419.525 4.341 20 0 HIADHN Cc1ccnc(-c2nnc([C@H](C)[NH2+][C@@H](C)CCc3ccc(OC(F)F)cc3)[n-]2)c1 ZINC000494429881 905717295 /nfs/dbraw/zinc/71/72/95/905717295.db2.gz YBVABVFOHWWZKX-GJZGRUSLSA-N 0 3 401.461 4.448 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](NCCCc2ccccn2)c2ccc(F)c(F)c2)c1 ZINC000494441301 905725097 /nfs/dbraw/zinc/72/50/97/905725097.db2.gz WYJBJEPKGRQGAJ-JOCHJYFZSA-N 0 3 416.493 4.075 20 0 HIADHN C[C@H](N[C@@H]1CCO[C@H]1c1ccc(Cl)cc1)C(=O)NC12CC3CC(CC(C3)C1)C2 ZINC000494466127 905748063 /nfs/dbraw/zinc/74/80/63/905748063.db2.gz OMPSBVRDDLYUSR-QFAHBSKLSA-N 0 3 402.966 4.233 20 0 HIADHN C[C@@H](Cn1cc(Br)cn1)N[C@@H]1CSc2ccc(Br)cc21 ZINC000494485426 905768563 /nfs/dbraw/zinc/76/85/63/905768563.db2.gz RPICQXZOMNRHLA-TVQRCGJNSA-N 0 3 417.170 4.233 20 0 HIADHN CCSc1cc(CNC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)ccn1 ZINC000494500769 905790630 /nfs/dbraw/zinc/79/06/30/905790630.db2.gz AXXZZGVBHRGVMF-FQEVSTJZSA-N 0 3 423.504 4.264 20 0 HIADHN Fc1cc([C@H]2OCC[C@@H]2NCc2ccc(OCC(F)(F)F)nc2)ccc1Cl ZINC000494505674 905797429 /nfs/dbraw/zinc/79/74/29/905797429.db2.gz KCACRZTZXIDBOD-DOTOQJQBSA-N 0 3 404.791 4.435 20 0 HIADHN CN(C)Cc1cc(CNCc2cnn(Cc3ccc(C(F)(F)F)cc3)c2)ccc1F ZINC000494581009 905847785 /nfs/dbraw/zinc/84/77/85/905847785.db2.gz SRUPEUJUBUDWKD-UHFFFAOYSA-N 0 3 420.454 4.441 20 0 HIADHN O=C(Nc1ccccc1CC(F)(F)F)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000494602347 905858159 /nfs/dbraw/zinc/85/81/59/905858159.db2.gz ZYBCPTGGKIPDBB-UHFFFAOYSA-N 0 3 406.448 4.248 20 0 HIADHN CCSc1cccc(CNC(=O)N(CCN(C)C)Cc2cccc(OC)c2)c1 ZINC000494605135 905859157 /nfs/dbraw/zinc/85/91/57/905859157.db2.gz RNIPFLXJKLDLDQ-UHFFFAOYSA-N 0 3 401.576 4.081 20 0 HIADHN O=C(Nc1ccc(Br)c(F)c1)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000494631323 905873075 /nfs/dbraw/zinc/87/30/75/905873075.db2.gz MFTAPOCDOVYLOE-UHFFFAOYSA-N 0 3 421.310 4.045 20 0 HIADHN O=C(Nc1cc(C(F)(F)F)ccc1F)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000494663706 905889369 /nfs/dbraw/zinc/88/93/69/905889369.db2.gz HBNYOXBBMZMWHN-UHFFFAOYSA-N 0 3 410.411 4.301 20 0 HIADHN COc1cc(C)c(CN2CCC[C@@H](CNC(=O)Nc3cccc(F)c3)C2)cc1OC ZINC000512481712 921190856 /nfs/dbraw/zinc/19/08/56/921190856.db2.gz XIUWXFHAFXXKEO-KRWDZBQOSA-N 0 3 415.509 4.185 20 0 HIADHN CN(C)CCN(Cc1cccc(O)c1)C(=O)c1csc(-c2cccc(Cl)c2)n1 ZINC000494769954 905967223 /nfs/dbraw/zinc/96/72/23/905967223.db2.gz LYPDENJBIKKBJS-UHFFFAOYSA-N 0 3 415.946 4.373 20 0 HIADHN Cc1nc(-c2ccc(F)cc2)sc1C(=O)N(CCN(C)C)Cc1cccc(O)c1 ZINC000494789696 905992537 /nfs/dbraw/zinc/99/25/37/905992537.db2.gz DNMRYMSKCUBIKB-UHFFFAOYSA-N 0 3 413.518 4.167 20 0 HIADHN COCc1c(C(=O)N(CCN(C)C)Cc2cccc(O)c2)sc2cccc(F)c21 ZINC000494794325 905996750 /nfs/dbraw/zinc/99/67/50/905996750.db2.gz YDLYHCMDKOZQOQ-UHFFFAOYSA-N 0 3 416.518 4.096 20 0 HIADHN C[C@H]1CN(C2CCOCC2)CCN1C(=O)N[C@H](c1ccc(Cl)cc1)C1CCCC1 ZINC000494857942 906042078 /nfs/dbraw/zinc/04/20/78/906042078.db2.gz HXULDQWWBJKZMP-JTSKRJEESA-N 0 3 419.997 4.466 20 0 HIADHN C[C@H]1CN(C2CCOCC2)CCN1C(=O)N[C@@H](c1ccc(Cl)cc1)C1CCCC1 ZINC000494857941 906042361 /nfs/dbraw/zinc/04/23/61/906042361.db2.gz HXULDQWWBJKZMP-HTAPYJJXSA-N 0 3 419.997 4.466 20 0 HIADHN COC(=O)c1csc(-c2cccc(CN[C@@H](c3nnc[nH]3)C3CCCCC3)c2)n1 ZINC000494928284 906101747 /nfs/dbraw/zinc/10/17/47/906101747.db2.gz DJLCEPJNRMFKTQ-GOSISDBHSA-N 0 3 411.531 4.126 20 0 HIADHN CC(C)C(=O)NC[C@H]1CCCN(Cc2c[nH]nc2-c2ccc(C(F)(F)F)cc2)C1 ZINC000494949501 906121790 /nfs/dbraw/zinc/12/17/90/906121790.db2.gz DQANVBYGMPWMME-OAHLLOKOSA-N 0 3 408.468 4.080 20 0 HIADHN CN(C)CCn1c2cc(NC(=O)C(C)(C)CCCc3ccccc3)ccc2oc1=O ZINC000494949999 906121839 /nfs/dbraw/zinc/12/18/39/906121839.db2.gz LGDAGBOMXMCLRD-UHFFFAOYSA-N 0 3 409.530 4.144 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)C(C)(C)CCCc3ccccc3)CC2)C[C@H](C)O1 ZINC000494955312 906127357 /nfs/dbraw/zinc/12/73/57/906127357.db2.gz SKNWOXJPFGHTLB-OYRHEFFESA-N 0 3 400.607 4.383 20 0 HIADHN C[C@@H](NCc1cc2cc(Br)ccc2[nH]1)c1ccc(C(=O)N(C)C)cc1 ZINC000494956182 906127383 /nfs/dbraw/zinc/12/73/83/906127383.db2.gz IPDRJHMZZDCXKK-CYBMUJFWSA-N 0 3 400.320 4.483 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)Nc2cccc3ccc(C)nc32)CC1 ZINC000512520414 921211158 /nfs/dbraw/zinc/21/11/58/921211158.db2.gz ZHIBEONBARXTSP-UHFFFAOYSA-N 0 3 417.557 4.002 20 0 HIADHN O=C1C[C@H](N[C@@H](C[C@@H]2CCOC2)c2ccc(F)cc2)CN1c1ccccc1Cl ZINC000495056117 906209721 /nfs/dbraw/zinc/20/97/21/906209721.db2.gz BMJQMKBGVLZZJA-QSFXBCCZSA-N 0 3 402.897 4.342 20 0 HIADHN CN(C(=O)c1ccc(CN2CCC(CO)CC2)cc1)c1cccc(OC(F)(F)F)c1 ZINC000495086744 906229931 /nfs/dbraw/zinc/22/99/31/906229931.db2.gz UEKWWVUERNVTJB-UHFFFAOYSA-N 0 3 422.447 4.066 20 0 HIADHN CCCCCOc1ccc(C(=O)CCC(=O)N2CCC[C@@H](N3CCCC3)C2)cc1 ZINC000495280388 906355021 /nfs/dbraw/zinc/35/50/21/906355021.db2.gz YWGXPWRMNNHDFL-OAQYLSRUSA-N 0 3 400.563 4.305 20 0 HIADHN CC(=O)NCCc1ccc([C@H](C)N[C@H](C)c2c(C)nn(CC(F)(F)F)c2C)cc1 ZINC000495421941 906443489 /nfs/dbraw/zinc/44/34/89/906443489.db2.gz WQPQFWYNNQLHOP-UONOGXRCSA-N 0 3 410.484 4.153 20 0 HIADHN COc1cc(NC(C)=O)ccc1[C@@H](C)NCCNc1cccc(Br)c1 ZINC000495428148 906446932 /nfs/dbraw/zinc/44/69/32/906446932.db2.gz VXKHNCJMSPWANJ-CYBMUJFWSA-N 0 3 406.324 4.179 20 0 HIADHN CCCNC(=O)[C@H]1CCCN(Cc2cnc(-c3ccc(Br)cc3)s2)C1 ZINC000512565552 921240618 /nfs/dbraw/zinc/24/06/18/921240618.db2.gz QWLJRWGPXYXREI-HNNXBMFYSA-N 0 3 422.392 4.311 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)c2ccccc2SCc2cccs2)CC1 ZINC000495682591 906524002 /nfs/dbraw/zinc/52/40/02/906524002.db2.gz RQUUHVLDIPTYFY-GOSISDBHSA-N 0 3 417.644 4.044 20 0 HIADHN c1nc(-c2ccncc2)sc1CN1CCC(c2nc(-c3ccccc3)n[nH]2)CC1 ZINC000512570164 921243009 /nfs/dbraw/zinc/24/30/09/921243009.db2.gz SLVBXECSDMZXIC-UHFFFAOYSA-N 0 3 402.527 4.370 20 0 HIADHN CCCN(CCN(C)C)C(=O)c1ccc(Oc2ccc(Br)cc2)nc1 ZINC000496223106 906632601 /nfs/dbraw/zinc/63/26/01/906632601.db2.gz AUFBIHCQPJSWLZ-UHFFFAOYSA-N 0 3 406.324 4.050 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)CCC(=O)c1cc(C)sc1C ZINC000496261339 906640629 /nfs/dbraw/zinc/64/06/29/906640629.db2.gz HYGJJNHVNVFVKR-FQEVSTJZSA-N 0 3 413.587 4.236 20 0 HIADHN Cc1c(C(=O)N(CCN(C)C)Cc2ccc(F)cc2)cnn1-c1ccc(Cl)cc1 ZINC000496266313 906642975 /nfs/dbraw/zinc/64/29/75/906642975.db2.gz YTXPDSBIXDKWOZ-UHFFFAOYSA-N 0 3 414.912 4.177 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)c1cc(C2CC2)n(C(C)(C)C)n1 ZINC000496272771 906644139 /nfs/dbraw/zinc/64/41/39/906644139.db2.gz PTVUITWWPAPWQQ-FQEVSTJZSA-N 0 3 409.578 4.037 20 0 HIADHN CCCN(CCN(C)C)C(=O)c1cccnc1Oc1ccc(F)cc1Br ZINC000496271426 906645086 /nfs/dbraw/zinc/64/50/86/906645086.db2.gz JOZSPZKRLDNWNY-UHFFFAOYSA-N 0 3 424.314 4.189 20 0 HIADHN CCN(C)C(=O)c1cccc(NC(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)c1 ZINC000496726299 906744927 /nfs/dbraw/zinc/74/49/27/906744927.db2.gz WXPKJJFXSQHVKS-QFIPXVFZSA-N 0 3 408.546 4.046 20 0 HIADHN CSc1cccc(NC(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)n1 ZINC000496785296 906756098 /nfs/dbraw/zinc/75/60/98/906756098.db2.gz GUEPTNQBQFMKHM-UHFFFAOYSA-N 0 3 412.481 4.418 20 0 HIADHN CCCS(=O)(=O)N1CCC(N[C@H](c2ccccc2)c2ccc3ccccc3n2)CC1 ZINC000512620223 921264230 /nfs/dbraw/zinc/26/42/30/921264230.db2.gz PGZMPOBYUBRJKT-XMMPIXPASA-N 0 3 423.582 4.118 20 0 HIADHN CCCS(=O)(=O)N1CCC(N[C@@H](c2ccccc2)c2ccc3ccccc3n2)CC1 ZINC000512620217 921264496 /nfs/dbraw/zinc/26/44/96/921264496.db2.gz PGZMPOBYUBRJKT-DEOSSOPVSA-N 0 3 423.582 4.118 20 0 HIADHN C[C@@H]1CCN(C(=O)Nc2cnn(C)c2-c2ccccc2)CCN1Cc1ccccc1 ZINC000496882169 906774144 /nfs/dbraw/zinc/77/41/44/906774144.db2.gz LWLKRRUJIVCCCS-LJQANCHMSA-N 0 3 403.530 4.215 20 0 HIADHN CN(Cc1cc(Br)ccc1OCc1ccccn1)C[C@H]1CCCC[C@H]1O ZINC000497095002 906803797 /nfs/dbraw/zinc/80/37/97/906803797.db2.gz FQRNOZFGMKFQOJ-OXQOHEQNSA-N 0 3 419.363 4.406 20 0 HIADHN COc1ccc([C@@H]2CCCN2C[C@H](O)CO[C@@H]2CCCc3ccccc32)cc1OC ZINC000497096228 906804824 /nfs/dbraw/zinc/80/48/24/906804824.db2.gz HXHVGNOXJJPUDE-ACIOBRDBSA-N 0 3 411.542 4.296 20 0 HIADHN CCOC(=O)c1sc(NC(=O)c2cccc(CN3CCCC3)c2)nc1C(C)C ZINC000497158984 906813728 /nfs/dbraw/zinc/81/37/28/906813728.db2.gz WDPKUAZQVDMGBU-UHFFFAOYSA-N 0 3 401.532 4.291 20 0 HIADHN COc1ccc(OC(F)F)c(CN[C@@H]2CCCN(Cc3c(F)cccc3F)C2)c1 ZINC000497319172 906833010 /nfs/dbraw/zinc/83/30/10/906833010.db2.gz FRKFLPYUWHTKCY-OAHLLOKOSA-N 0 3 412.427 4.329 20 0 HIADHN CC(C)[C@@H](c1ccccc1)N(C)CC(=O)NC1CCN(C(=O)C2CCCCC2)CC1 ZINC000497358638 906850350 /nfs/dbraw/zinc/85/03/50/906850350.db2.gz UPXNIGLHYGXRKB-DEOSSOPVSA-N 0 3 413.606 4.003 20 0 HIADHN C/C=C\c1ccc(OC[C@H](O)CN2CCC(OC3CCCCC3)CC2)c(OC)c1 ZINC000497377260 906865771 /nfs/dbraw/zinc/86/57/71/906865771.db2.gz TYGCPQZXMAACPI-CNMWDZGZSA-N 0 3 403.563 4.282 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)c2ccc(-n3nc(C)c(Cl)c3C)cc2)o1 ZINC000497378147 906865911 /nfs/dbraw/zinc/86/59/11/906865911.db2.gz FEMUJBWXBFADRT-UHFFFAOYSA-N 0 3 414.937 4.248 20 0 HIADHN CC(C)[C@H](c1ccccc1)N(C)CC(=O)N1CCC[C@H]1c1ccc2c(c1)OCCO2 ZINC000497384242 906870384 /nfs/dbraw/zinc/87/03/84/906870384.db2.gz GRDWRBVJJIKIDN-SQJMNOBHSA-N 0 3 408.542 4.450 20 0 HIADHN C/C=C\c1ccc(NC(=O)N2CCC[C@@H](CN3CCN(c4ccccn4)CC3)C2)cc1 ZINC000497383832 906870660 /nfs/dbraw/zinc/87/06/60/906870660.db2.gz GFUQFXWGGHQXKS-JUUSZVOTSA-N 0 3 419.573 4.181 20 0 HIADHN CCc1nc(C)c(C(=O)Nc2cccc(N3CCN(CCc4ccccc4)CC3)c2)o1 ZINC000497399365 906880161 /nfs/dbraw/zinc/88/01/61/906880161.db2.gz NFNJYWBRNWWJPK-UHFFFAOYSA-N 0 3 418.541 4.162 20 0 HIADHN Cc1ccccc1C(=O)NC1CCN(C(=O)CN(C)[C@@H](c2ccccc2)C(C)C)CC1 ZINC000497412653 906888304 /nfs/dbraw/zinc/88/83/04/906888304.db2.gz SPKPHNWMJUBTMK-RUZDIDTESA-N 0 3 421.585 4.045 20 0 HIADHN CN1C[C@@H](c2ccccc2)[C@H](NC(=O)Cc2csc(-c3ccc(Cl)s3)n2)C1 ZINC000497413279 906889961 /nfs/dbraw/zinc/88/99/61/906889961.db2.gz AQJIGMNNJGECKN-JKSUJKDBSA-N 0 3 417.987 4.282 20 0 HIADHN CN1C[C@H](NC(=O)c2ccc(Oc3ccncc3)c(Cl)c2)[C@@H](c2ccccc2)C1 ZINC000497415979 906890815 /nfs/dbraw/zinc/89/08/15/906890815.db2.gz IQTQGMYMFYALMI-CTNGQTDRSA-N 0 3 407.901 4.355 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)C2CCN(c3ccc4cccc(O)c4n3)CC2)c1 ZINC000497438228 906912046 /nfs/dbraw/zinc/91/20/46/906912046.db2.gz BHOJHSQRQMNNSW-UHFFFAOYSA-N 0 3 418.541 4.166 20 0 HIADHN Cc1cc(NC(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)c(F)cc1Br ZINC000497446595 906920967 /nfs/dbraw/zinc/92/09/67/906920967.db2.gz YUMMJZFFOXASIX-AEFFLSMTSA-N 0 3 406.299 4.464 20 0 HIADHN CN(CCCN1CCN(C)CC1)C(=O)N[C@@H](CCCc1ccccc1)c1ccccc1 ZINC000497480816 906960786 /nfs/dbraw/zinc/96/07/86/906960786.db2.gz FMRPROKIPLCYAD-VWLOTQADSA-N 0 3 422.617 4.030 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)NCc3ccccc3COc3ccccc3Cl)[C@H]2C1 ZINC000497506460 906997226 /nfs/dbraw/zinc/99/72/26/906997226.db2.gz IANFVEDQUZLJGI-UTKZUKDTSA-N 0 3 413.949 4.155 20 0 HIADHN O=C(c1ccco1)N1CCC(N[C@H](c2cc3ccccc3o2)c2cccnc2)CC1 ZINC000497519524 907009185 /nfs/dbraw/zinc/00/91/85/907009185.db2.gz NKXVZEOVNYJVPV-QHCPKHFHSA-N 0 3 401.466 4.405 20 0 HIADHN COc1cccc(C2=CCN(Cc3c[nH]nc3-c3ccc4c(c3)OCCO4)CC2)c1 ZINC000512682445 921285971 /nfs/dbraw/zinc/28/59/71/921285971.db2.gz GISZRMGHSCCXJD-UHFFFAOYSA-N 0 3 403.482 4.146 20 0 HIADHN Cc1ccc(CNC(=O)C2CCN(Cc3cccc(OCC(F)(F)F)c3)CC2)cc1 ZINC000512683211 921286436 /nfs/dbraw/zinc/28/64/36/921286436.db2.gz OCPROPUEMVHJKA-UHFFFAOYSA-N 0 3 420.475 4.465 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)NCc2ccc3ccccc3n2)N(C)C)cc1 ZINC000497606989 907085610 /nfs/dbraw/zinc/08/56/10/907085610.db2.gz BHLIJQRKLQRMEL-QHCPKHFHSA-N 0 3 406.530 4.124 20 0 HIADHN COc1cc(C)c([C@H](C)NC(=O)N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)cc1OC ZINC000497608900 907086292 /nfs/dbraw/zinc/08/62/92/907086292.db2.gz SJKDOLNUQNHHLI-WSTZPKSXSA-N 0 3 411.546 4.035 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)c2cc3ccc(Br)cc3[nH]2)C1 ZINC000512704252 921292792 /nfs/dbraw/zinc/29/27/92/921292792.db2.gz YFZUJRVENYVCDT-KBXCAEBGSA-N 0 3 412.331 4.496 20 0 HIADHN CC(C)(C)[C@@H](CN1CCc2ccccc2C1)NC(=O)N1CCCC[C@H]1c1cc[nH]n1 ZINC000497610025 907090143 /nfs/dbraw/zinc/09/01/43/907090143.db2.gz LXVVVENPXHQTPQ-FCHUYYIVSA-N 0 3 409.578 4.119 20 0 HIADHN Cc1ccc(CNC(=O)C2CCN(Cc3ccc(OC(F)F)cc3)CC2)cc1F ZINC000497615202 907093531 /nfs/dbraw/zinc/09/35/31/907093531.db2.gz IXICYQDYVLEGCT-UHFFFAOYSA-N 0 3 406.448 4.264 20 0 HIADHN Cc1cccc(COc2ccc([C@H](C)NC(=O)N3CC[C@H]4CCN(C)C[C@H]43)cc2)c1 ZINC000497627812 907108593 /nfs/dbraw/zinc/10/85/93/907108593.db2.gz NSCNFGGUDNHZKL-BPUDTRNYSA-N 0 3 407.558 4.371 20 0 HIADHN Cc1ccc(C[C@@H](NC(=O)N[C@H](CN(C)C)c2ccc(F)cc2)c2ccccn2)cc1 ZINC000497635200 907118185 /nfs/dbraw/zinc/11/81/85/907118185.db2.gz XYSAHUQKLDXZSO-DNQXCXABSA-N 0 3 420.532 4.415 20 0 HIADHN Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)NC(=O)N1CC[C@H]2CCN(C)C[C@H]21 ZINC000497635899 907120103 /nfs/dbraw/zinc/12/01/03/907120103.db2.gz CHTQXQIIAFWMJM-HDMKZQKVSA-N 0 3 402.539 4.054 20 0 HIADHN O=C(Nc1ccc(-c2cncnc2)cc1)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000512722234 921296484 /nfs/dbraw/zinc/29/64/84/921296484.db2.gz CKKJQUOBDNHZAS-OAQYLSRUSA-N 0 3 408.452 4.240 20 0 HIADHN Cc1ccccc1[C@H](NC(=O)N(C)CCCN1CCN(C)CC1)[C@H]1CCC[C@@H](C)C1 ZINC000497666832 907162495 /nfs/dbraw/zinc/16/24/95/907162495.db2.gz ABAWJVBVPIBCEP-JCTONOIOSA-N 0 3 414.638 4.141 20 0 HIADHN CS[C@@H]1CN(C(=O)Nc2ccc(Sc3nc(C)cs3)cc2)C[C@@H]1N(C)C ZINC000497674661 907177102 /nfs/dbraw/zinc/17/71/02/907177102.db2.gz AYAVZYNDBAAMNH-JKSUJKDBSA-N 0 3 408.618 4.112 20 0 HIADHN CCOc1cc(C[NH2+]CCCn2c(C)nc3ccccc32)cc(Br)c1[O-] ZINC000497693558 907199912 /nfs/dbraw/zinc/19/99/12/907199912.db2.gz DVPYQAVJFLQQCI-UHFFFAOYSA-N 0 3 418.335 4.391 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)N[C@@H](C)c2ncc(-c3ccccc3)o2)cc1 ZINC000497697518 907201258 /nfs/dbraw/zinc/20/12/58/907201258.db2.gz QPNHIFXKJFGSCQ-JXFKEZNVSA-N 0 3 408.502 4.013 20 0 HIADHN CCN(CC)[C@H](CNC(=O)C1(c2ccc(OC)cc2)CCC1)c1cccc(OC)c1 ZINC000497754205 907245121 /nfs/dbraw/zinc/24/51/21/907245121.db2.gz ZONDYWFQHFUDSH-HSZRJFAPSA-N 0 3 410.558 4.325 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cnn(-c2cccc(C)c2)c1C)c1cccc(OC)c1 ZINC000497757639 907250298 /nfs/dbraw/zinc/25/02/98/907250298.db2.gz QVNWUTIAYAAIQA-XMMPIXPASA-N 0 3 420.557 4.311 20 0 HIADHN C[C@H](NC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1)c1nccn1-c1ccccc1 ZINC000512780217 921310080 /nfs/dbraw/zinc/31/00/80/921310080.db2.gz YRXVCSBTNMFAAX-NZQKXSOJSA-N 0 3 417.557 4.239 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)N2CC[C@H](C(F)(F)F)[C@@H]2C)N(C)C)cc1 ZINC000512809810 921316764 /nfs/dbraw/zinc/31/67/64/921316764.db2.gz WGFIKCZTWMTPFE-WBAXXEDZSA-N 0 3 401.473 4.059 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)Cc3cccc(OC(C)C)c3)CC2)c1 ZINC000497935975 907400513 /nfs/dbraw/zinc/40/05/13/907400513.db2.gz CHDQSUTZHRLHOF-UHFFFAOYSA-N 0 3 423.601 4.043 20 0 HIADHN CC[C@H](C)[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)Nc1cccc(CN(C)C)c1 ZINC000497963465 907431996 /nfs/dbraw/zinc/43/19/96/907431996.db2.gz BKXJUQSPWKOLCR-YWZLYKJASA-N 0 3 401.938 4.185 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)C3(c4cccc(C)c4)CC3)CC2)c1 ZINC000497965203 907435013 /nfs/dbraw/zinc/43/50/13/907435013.db2.gz GEUOYSKKXNRNEJ-UHFFFAOYSA-N 0 3 405.586 4.054 20 0 HIADHN CCOC1CC2(C1)CCN(Cc1ccnc(-c3ccc(Br)cc3)n1)C2 ZINC000512824366 921328252 /nfs/dbraw/zinc/32/82/52/921328252.db2.gz RFAUOUXUCLEMMG-UHFFFAOYSA-N 0 3 402.336 4.297 20 0 HIADHN CCCCCN(C)c1ccc(F)cc1CN1CCC(c2ccnn2CCO)CC1 ZINC000512835377 921338233 /nfs/dbraw/zinc/33/82/33/921338233.db2.gz WQIXVNDOUVBZIE-UHFFFAOYSA-N 0 3 402.558 4.021 20 0 HIADHN CCn1nc(C(C)C)cc1C(=O)N(CCN(C)C)Cc1ccc(C(F)(F)F)cc1 ZINC000498123530 907637857 /nfs/dbraw/zinc/63/78/57/907637857.db2.gz DCNAQGMHDUAPJU-UHFFFAOYSA-N 0 3 410.484 4.249 20 0 HIADHN Cc1cc(-c2nc3cc(F)ccc3n2C)ccc1NC(=O)N[C@@H](C)C1=CCN(C)CC1 ZINC000512838471 921342425 /nfs/dbraw/zinc/34/24/25/921342425.db2.gz NLUORDYMTJUCQE-INIZCTEOSA-N 0 3 421.520 4.460 20 0 HIADHN Cc1nn(-c2ccc(Br)cc2)c(C)c1CNCCOc1ccccc1 ZINC000512839394 921342622 /nfs/dbraw/zinc/34/26/22/921342622.db2.gz JDOTXURMMLKOCR-UHFFFAOYSA-N 0 3 400.320 4.420 20 0 HIADHN O=C(NCCCCN1CCN(c2cccc(C(F)(F)F)c2)CC1)c1ccc(F)cc1 ZINC000498153552 907679518 /nfs/dbraw/zinc/67/95/18/907679518.db2.gz QEZDSUPAJVJFNU-UHFFFAOYSA-N 0 3 423.454 4.177 20 0 HIADHN O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)[C@H]1C[C@@H]1c1cccc(Br)c1 ZINC000498168435 907696280 /nfs/dbraw/zinc/69/62/80/907696280.db2.gz CZQJOQMJBYCBCA-NJYVYQBISA-N 0 3 413.359 4.333 20 0 HIADHN Cc1cccc([C@@H](NC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)c2ccccn2)c1 ZINC000498231858 907763973 /nfs/dbraw/zinc/76/39/73/907763973.db2.gz QGFWADLFZWJNDG-UKILVPOCSA-N 0 3 414.553 4.443 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)NCCc2csc(C(C)(C)C)n2)C1 ZINC000498240849 907775329 /nfs/dbraw/zinc/77/53/29/907775329.db2.gz WQIJLWFKFYUTJA-AEFFLSMTSA-N 0 3 400.592 4.118 20 0 HIADHN CN(CCCN1CCN(C)CC1)C(=O)N[C@H](c1cccc(Cl)c1)C1CCCCC1 ZINC000498290286 907821221 /nfs/dbraw/zinc/82/12/21/907821221.db2.gz ZDGNZPATBJTKKI-QFIPXVFZSA-N 0 3 421.029 4.240 20 0 HIADHN CCOc1ccc(C(=O)N2CCC(NCc3nc4c(s3)C[C@@H](C)CC4)CC2)cc1 ZINC000498362504 907858289 /nfs/dbraw/zinc/85/82/89/907858289.db2.gz GPTBWBBYOIXTTR-INIZCTEOSA-N 0 3 413.587 4.061 20 0 HIADHN CC(C)(C)[C@H](NCc1ccc([C@@]2(C)NC(=O)NC2=O)cc1)c1cc2ccccc2o1 ZINC000498433466 907899096 /nfs/dbraw/zinc/89/90/96/907899096.db2.gz DWDUTIARPFOSME-HYBUGGRVSA-N 0 3 405.498 4.364 20 0 HIADHN CN(C(=O)NCc1ccccc1N1CCCCC1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000498468079 907937165 /nfs/dbraw/zinc/93/71/65/907937165.db2.gz SRIAFXMBKUDCRF-QHCPKHFHSA-N 0 3 406.574 4.093 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N2CCC[C@](C)(c3ccccc3)CC2)CC1 ZINC000498586602 908039713 /nfs/dbraw/zinc/03/97/13/908039713.db2.gz FHYHRHLXHJOWHR-DEOSSOPVSA-N 0 3 401.595 4.029 20 0 HIADHN COc1ccccc1[C@H]1CC[C@@H](C)CN1C(=O)NC1CCN(CCOC(C)C)CC1 ZINC000498595726 908044894 /nfs/dbraw/zinc/04/48/94/908044894.db2.gz YHXAGWFGICNPRC-DENIHFKCSA-N 0 3 417.594 4.067 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)CCc1cccc(Br)c1 ZINC000498711410 908136748 /nfs/dbraw/zinc/13/67/48/908136748.db2.gz SKSSNNFATQXMCI-UHFFFAOYSA-N 0 3 407.327 4.111 20 0 HIADHN CC[C@H](NC(=O)N[C@@H](CN(C)C)c1ccc(F)cc1)c1nc(C(F)(F)F)cs1 ZINC000498713438 908138912 /nfs/dbraw/zinc/13/89/12/908138912.db2.gz IQYWTFWCXSRMAY-KBPBESRZSA-N 0 3 418.460 4.354 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)N[C@H]2CCc3[nH]c4ccc(C)cc4c3C2)o1 ZINC000498721089 908147064 /nfs/dbraw/zinc/14/70/64/908147064.db2.gz UAUUUTZVCZUJAF-SFHVURJKSA-N 0 3 408.546 4.008 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@@H]2CNC(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)cc1 ZINC000498726873 908153911 /nfs/dbraw/zinc/15/39/11/908153911.db2.gz GLZURFPKVDAIDE-QVGHQYEOSA-N 0 3 409.574 4.453 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)c1sc(C(C)(C)C)nc1C ZINC000498731573 908158571 /nfs/dbraw/zinc/15/85/71/908158571.db2.gz ZPSZRMQJVQDKKS-GOSISDBHSA-N 0 3 400.592 4.271 20 0 HIADHN CS(=O)(=O)Nc1cccc(CN[C@@H](c2cccc(OC(F)(F)F)c2)C2CC2)c1 ZINC000512894432 921387051 /nfs/dbraw/zinc/38/70/51/921387051.db2.gz JIBXUKFHQYIIKL-GOSISDBHSA-N 0 3 414.449 4.198 20 0 HIADHN Cc1cc(C)n(Cc2cccc(C(=O)NC[C@H]3CCCCN3Cc3ccccc3)c2)n1 ZINC000498897272 908303917 /nfs/dbraw/zinc/30/39/17/908303917.db2.gz WAHCJBUSPNVDJW-RUZDIDTESA-N 0 3 416.569 4.333 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)N[C@@H](C)c1noc(-c2ccc(Cl)cc2)n1 ZINC000498907693 908316875 /nfs/dbraw/zinc/31/68/75/908316875.db2.gz FWANYHWQKFXTJP-INIZCTEOSA-N 0 3 419.957 4.359 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)N(C)Cc2ccc(F)cc2F)N(C)C)cc1 ZINC000512906309 921399448 /nfs/dbraw/zinc/39/94/48/921399448.db2.gz CTTHWBLYGPEWAX-NRFANRHFSA-N 0 3 405.489 4.196 20 0 HIADHN CCN1C[C@H](C)N(CC(=O)Nc2nc(-c3c(C)cc(C)cc3C)cs2)C[C@@H]1C ZINC000498910055 908319812 /nfs/dbraw/zinc/31/98/12/908319812.db2.gz BRIGKSXMYFKJLY-ROUUACIJSA-N 0 3 400.592 4.088 20 0 HIADHN O=C(CN1CCC[C@H](c2n[nH]c(C3CC3)n2)C1)Nc1ccccc1-c1ccccc1 ZINC000498915303 908324593 /nfs/dbraw/zinc/32/45/93/908324593.db2.gz MKQKMZPCZXMEEA-IBGZPJMESA-N 0 3 401.514 4.167 20 0 HIADHN FC(F)(F)c1ccc(-c2noc(CN3CCC[C@@H](c4nc(C5CC5)n[nH]4)C3)n2)cc1 ZINC000498916433 908326601 /nfs/dbraw/zinc/32/66/01/908326601.db2.gz QYHCQASXRPCJMV-CQSZACIVSA-N 0 3 418.423 4.131 20 0 HIADHN FC(F)(F)c1ccc(-c2noc(CN3CCC[C@@H](c4n[nH]c(C5CC5)n4)C3)n2)cc1 ZINC000498916433 908326618 /nfs/dbraw/zinc/32/66/18/908326618.db2.gz QYHCQASXRPCJMV-CQSZACIVSA-N 0 3 418.423 4.131 20 0 HIADHN C[C@@H](NC(=O)CN1CCC[C@@H](c2n[nH]c(C3CC3)n2)C1)c1ccc(Cl)c(Cl)c1 ZINC000498918844 908327346 /nfs/dbraw/zinc/32/73/46/908327346.db2.gz PFWKSLUNAFSGGM-IUODEOHRSA-N 0 3 422.360 4.046 20 0 HIADHN COC(=O)c1sc2cccc(F)c2c1CN1CCC[C@@H](c2nc(C3CC3)n[nH]2)C1 ZINC000498922292 908331433 /nfs/dbraw/zinc/33/14/33/908331433.db2.gz KZHLQXVDRXTOLR-CYBMUJFWSA-N 0 3 414.506 4.202 20 0 HIADHN COC(=O)c1sc2cccc(F)c2c1CN1CCC[C@@H](c2n[nH]c(C3CC3)n2)C1 ZINC000498922292 908331452 /nfs/dbraw/zinc/33/14/52/908331452.db2.gz KZHLQXVDRXTOLR-CYBMUJFWSA-N 0 3 414.506 4.202 20 0 HIADHN CC(C)c1ccc(CN(C(=O)CN2CCC[C@@H](c3nc(C4CC4)n[nH]3)C2)C2CC2)cc1 ZINC000498928165 908336340 /nfs/dbraw/zinc/33/63/40/908336340.db2.gz WYFVXAXEVIAMAK-OAQYLSRUSA-N 0 3 421.589 4.176 20 0 HIADHN CC(C)c1ccc(CN(C(=O)CN2CCC[C@@H](c3n[nH]c(C4CC4)n3)C2)C2CC2)cc1 ZINC000498928165 908336353 /nfs/dbraw/zinc/33/63/53/908336353.db2.gz WYFVXAXEVIAMAK-OAQYLSRUSA-N 0 3 421.589 4.176 20 0 HIADHN CCN1C[C@H](C)N(Cc2csc(N(C(C)=O)c3ccc(C)c(C)c3)n2)C[C@@H]1C ZINC000498939564 908345243 /nfs/dbraw/zinc/34/52/43/908345243.db2.gz WATMLRRGRGXKHJ-ROUUACIJSA-N 0 3 400.592 4.359 20 0 HIADHN CC[C@H](C)Sc1ccc(NC(=O)C(=O)NC[C@@H](C)N2CCCC[C@@H]2C)c(C)c1 ZINC000498968423 908361134 /nfs/dbraw/zinc/36/11/34/908361134.db2.gz CJNCHOKCBWQUGL-KSZLIROESA-N 0 3 405.608 4.203 20 0 HIADHN Cc1cccc([C@H](NC(=O)N2CCCN(Cc3ccccc3)CC2)c2ccccn2)c1 ZINC000499024032 908398464 /nfs/dbraw/zinc/39/84/64/908398464.db2.gz RTXCELVYODUECV-VWLOTQADSA-N 0 3 414.553 4.397 20 0 HIADHN C[C@@H]1CC[C@H](c2ccccc2)N(C(=O)NCc2ccccc2CN2CCC(O)CC2)C1 ZINC000499110000 908468705 /nfs/dbraw/zinc/46/87/05/908468705.db2.gz ITIYPOFKDYWCCX-CJFMBICVSA-N 0 3 421.585 4.326 20 0 HIADHN COc1ccc(-c2cnc(CCC(=O)NC[C@H](c3ccc(C)cc3)N(C)C)o2)cc1 ZINC000499160340 908516405 /nfs/dbraw/zinc/51/64/05/908516405.db2.gz XCCNIGFXNYZULQ-OAQYLSRUSA-N 0 3 407.514 4.010 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)[C@@H](C)Oc2ccc(F)cc2Br)N(C)C)cc1 ZINC000499169056 908522304 /nfs/dbraw/zinc/52/23/04/908522304.db2.gz RNALEEABWGQNCO-RDTXWAMCSA-N 0 3 423.326 4.083 20 0 HIADHN COc1ccc([C@H](C)NC(=O)N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)c(C)c1OC ZINC000499195974 908550364 /nfs/dbraw/zinc/55/03/64/908550364.db2.gz VAIYVXSBIVEAKE-IMFGXOCKSA-N 0 3 411.546 4.035 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)Cc1csc(-c2cccc(F)c2)n1 ZINC000499382025 908747045 /nfs/dbraw/zinc/74/70/45/908747045.db2.gz GLASPOYZCKTYOK-UHFFFAOYSA-N 0 3 415.509 4.221 20 0 HIADHN CN(C)[C@@H](CNC(=O)Cc1csc(-c2ccc(Cl)s2)n1)c1ccccc1 ZINC000512966570 921442367 /nfs/dbraw/zinc/44/23/67/921442367.db2.gz JZPLUCVXETXIEN-HNNXBMFYSA-N 0 3 405.976 4.487 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)NCc2ncoc2-c2ccccc2)N(C)C)cc1 ZINC000499567466 908842943 /nfs/dbraw/zinc/84/29/43/908842943.db2.gz QZIXUCLEMDJPEX-JOCHJYFZSA-N 0 3 422.529 4.231 20 0 HIADHN CS(=O)(=O)Nc1ccc(CNCc2cccc(OCc3ccc(F)cc3)c2)cc1 ZINC000499681923 908876024 /nfs/dbraw/zinc/87/60/24/908876024.db2.gz HUPHBTWXTGVXQO-UHFFFAOYSA-N 0 3 414.502 4.066 20 0 HIADHN CN(C)Cc1ccc(C(N)=O)cc1NCc1cccc(OCc2ccc(F)cc2)c1 ZINC000499701517 908882137 /nfs/dbraw/zinc/88/21/37/908882137.db2.gz CNUJXPCTROPMNE-UHFFFAOYSA-N 0 3 407.489 4.177 20 0 HIADHN C[C@@H]1CCC[C@H](OCCCCCC(=O)N2CCC(CN3C[C@H](C)O[C@@H](C)C3)CC2)C1 ZINC000499930477 909038329 /nfs/dbraw/zinc/03/83/29/909038329.db2.gz MQLUMMSJZATFCH-VCHRRKICSA-N 0 3 422.654 4.490 20 0 HIADHN Cc1ccc(-c2noc(CCCN[C@@H](CO)c3cccc(Cl)c3F)n2)cc1F ZINC000499933774 909041534 /nfs/dbraw/zinc/04/15/34/909041534.db2.gz FGINMBRICIEELN-KRWDZBQOSA-N 0 3 407.848 4.232 20 0 HIADHN O=C1NC2(CCCCC2)C(=O)N1CCCNCc1cc(C(F)(F)F)ccc1Cl ZINC000512996544 921463381 /nfs/dbraw/zinc/46/33/81/921463381.db2.gz CUTCHKZVPUJXQV-UHFFFAOYSA-N 0 3 417.859 4.093 20 0 HIADHN COc1ccccc1C[C@H](C)CC(=O)N(CCN(C)C)Cc1ccc(F)c(F)c1 ZINC000499978599 909428452 /nfs/dbraw/zinc/42/84/52/909428452.db2.gz MVLJPDZYBWHORK-KRWDZBQOSA-N 0 3 404.501 4.133 20 0 HIADHN CCN(C(=O)c1ccn(-c2ccccc2F)n1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000500004182 909453542 /nfs/dbraw/zinc/45/35/42/909453542.db2.gz KKTNWSYIPCUUOQ-ICSRJNTNSA-N 0 3 406.505 4.309 20 0 HIADHN CN(C(=O)Cc1c(Cl)cccc1Cl)C1CCN(CCc2ccccn2)CC1 ZINC000500065770 909533659 /nfs/dbraw/zinc/53/36/59/909533659.db2.gz STTAFYOZQXLMBA-UHFFFAOYSA-N 0 3 406.357 4.096 20 0 HIADHN O=C(Nc1ccccc1)Nc1ccc(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000500152408 909626840 /nfs/dbraw/zinc/62/68/40/909626840.db2.gz PHXZGYPAMINTJX-QHCPKHFHSA-N 0 3 414.509 4.335 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N(C)CCCOCc3ccccc3)c(C)c2)CC1 ZINC000500219405 909710506 /nfs/dbraw/zinc/71/05/06/909710506.db2.gz PLXODYXBXACXES-UHFFFAOYSA-N 0 3 424.589 4.208 20 0 HIADHN CSc1ccc([C@H](C)NCC(=O)Nc2cccc(CN3CCSCC3)c2)cc1 ZINC000500225576 909717463 /nfs/dbraw/zinc/71/74/63/909717463.db2.gz LBCBGISRXNSSOP-KRWDZBQOSA-N 0 3 415.628 4.247 20 0 HIADHN COc1ccc(OC)c([C@H](C)NC(=O)[C@@H](C)N[C@@H](C)c2ccc(SC)cc2)c1 ZINC000500238482 909727170 /nfs/dbraw/zinc/72/71/70/909727170.db2.gz PUMVZRQSQCKMJW-HRCADAONSA-N 0 3 402.560 4.342 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)c2cc(-c3csc(C)n3)c[nH]2)cc1 ZINC000500392276 909831464 /nfs/dbraw/zinc/83/14/64/909831464.db2.gz IDYPMGJJVGKPPZ-FQEVSTJZSA-N 0 3 410.543 4.022 20 0 HIADHN C[C@@H](C(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1)c1cn(C)c2ccccc12 ZINC000500396948 909834447 /nfs/dbraw/zinc/83/44/47/909834447.db2.gz OXUQYEQAJHAWKT-HSALFYBXSA-N 0 3 411.590 4.020 20 0 HIADHN C[C@H](C(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1)c1cn(C)c2ccccc12 ZINC000500396950 909834660 /nfs/dbraw/zinc/83/46/60/909834660.db2.gz OXUQYEQAJHAWKT-ZCNNSNEGSA-N 0 3 411.590 4.020 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)c2cc(C)n(C3CCCCC3)n2)cc1 ZINC000500417095 909845454 /nfs/dbraw/zinc/84/54/54/909845454.db2.gz ZVODBSZQEMFHRC-HSZRJFAPSA-N 0 3 410.562 4.272 20 0 HIADHN COc1ccc(SCCC(=O)N[C@H](CN2CCCC2)c2ccc(OC)cc2)cc1 ZINC000500421825 909846538 /nfs/dbraw/zinc/84/65/38/909846538.db2.gz OWYSPJAITRMWKY-JOCHJYFZSA-N 0 3 414.571 4.139 20 0 HIADHN CCc1nnc(NC(=O)[C@@H](C)[C@@H](C)NCc2c(Cl)cccc2N2CCCC2)s1 ZINC000513064571 921521748 /nfs/dbraw/zinc/52/17/48/921521748.db2.gz QJFCSPZNCGCNOF-UONOGXRCSA-N 0 3 421.998 4.107 20 0 HIADHN C[C@@H](NC(=O)NC[C@@H](c1ccccc1)N1CCCC1)c1ccccc1OC(F)F ZINC000500426758 909849900 /nfs/dbraw/zinc/84/99/00/909849900.db2.gz GMLLEOJIVGODDG-APWZRJJASA-N 0 3 403.473 4.485 20 0 HIADHN O=C(NC[C@@H]1CCCN(Cc2ccccc2OCc2ccccn2)C1)c1ccccc1 ZINC000513077050 921530776 /nfs/dbraw/zinc/53/07/76/921530776.db2.gz RUYLMDJRVKDIAX-NRFANRHFSA-N 0 3 415.537 4.303 20 0 HIADHN COc1ccc([C@H]2C[C@H](NCc3ccc(OC)c(O)c3Br)C2)cc1F ZINC000500546951 909920257 /nfs/dbraw/zinc/92/02/57/909920257.db2.gz PZBWSNSBMSRBQV-HDJSIYSDSA-N 0 3 410.283 4.347 20 0 HIADHN CC(C)OCc1ccc(NC(=O)NCCCCN2CCN(c3ccccc3)CC2)cc1 ZINC000513082753 921534288 /nfs/dbraw/zinc/53/42/88/921534288.db2.gz KWTGXSGPHSCUMF-UHFFFAOYSA-N 0 3 424.589 4.336 20 0 HIADHN CCc1nnc(NC(=O)[C@H](C)[C@H](C)NCc2cc(Cl)ccc2OC(F)F)s1 ZINC000513081858 921534553 /nfs/dbraw/zinc/53/45/53/921534553.db2.gz HNIWSICLPSAJAW-ZJUUUORDSA-N 0 3 418.897 4.108 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)[C@@H](C)Cc1cnc2ccccc2n1 ZINC000500588517 909950391 /nfs/dbraw/zinc/95/03/91/909950391.db2.gz XYJXZNVODRGTNL-YADARESESA-N 0 3 404.558 4.081 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N[C@@H](C)c1cnn(Cc2ccccc2)c1)c1ccco1 ZINC000500601238 909958469 /nfs/dbraw/zinc/95/84/69/909958469.db2.gz KTTMSJHDOVEDBQ-WFXMLNOXSA-N 0 3 409.534 4.014 20 0 HIADHN Cc1ccccc1COc1cccc(CC(=O)N(CCN(C)C)Cc2ccccn2)c1 ZINC000500750653 910060013 /nfs/dbraw/zinc/06/00/13/910060013.db2.gz QFQYEZCXEZNRAS-UHFFFAOYSA-N 0 3 417.553 4.102 20 0 HIADHN CN(C(=O)c1[nH]c2ccc(F)cc2c1Cl)C1CCN(CCc2ccccn2)CC1 ZINC000500766612 910067662 /nfs/dbraw/zinc/06/76/62/910067662.db2.gz HOVMNVHISRBQRG-UHFFFAOYSA-N 0 3 414.912 4.135 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)c1csc(-c2ccccc2Cl)n1 ZINC000500775825 910070676 /nfs/dbraw/zinc/07/06/76/910070676.db2.gz SZKOXWVHUWHKGF-UHFFFAOYSA-N 0 3 400.935 4.063 20 0 HIADHN COc1cc(CNCc2ccc(C[S@@](C)=O)cc2)ccc1OCc1ccccc1 ZINC000513102541 921550135 /nfs/dbraw/zinc/55/01/35/921550135.db2.gz ZUEHVBAMSNUMKR-GDLZYMKVSA-N 0 3 409.551 4.443 20 0 HIADHN CN1CCN(CCC(C)(C)NC(=O)c2ccc(-c3ccc(C(F)(F)F)cc3)o2)CC1 ZINC000500907323 910177396 /nfs/dbraw/zinc/17/73/96/910177396.db2.gz TYKZMNXKBBKNMQ-UHFFFAOYSA-N 0 3 423.479 4.111 20 0 HIADHN CN(C)[C@H](CNC(=O)NC[C@@H](c1cccc(Cl)c1)N1CCCC1)c1cccs1 ZINC000501012218 910234312 /nfs/dbraw/zinc/23/43/12/910234312.db2.gz VHWHDKJRTAOJKV-RBUKOAKNSA-N 0 3 421.010 4.141 20 0 HIADHN CCOCc1cc(CN2CCC(C(=O)Nc3ccc(F)cc3)CC2)ccc1OC ZINC000513117932 921563152 /nfs/dbraw/zinc/56/31/52/921563152.db2.gz WVVZPXKVGYTIKA-UHFFFAOYSA-N 0 3 400.494 4.222 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1ccc(NC(=O)C2CC2)cc1)c1ccsc1 ZINC000501089465 910289929 /nfs/dbraw/zinc/28/99/29/910289929.db2.gz JMMVENHQMBGHID-LJQANCHMSA-N 0 3 400.548 4.301 20 0 HIADHN C[C@]1(c2ccccc2)CCCN(C(=O)CCCN2CCN(c3ccccc3)CC2)C1 ZINC000501134833 910315821 /nfs/dbraw/zinc/31/58/21/910315821.db2.gz OHDIUHPDCSSBJX-SANMLTNESA-N 0 3 405.586 4.169 20 0 HIADHN Cc1c(NC(=O)NC[C@@H](c2ccccc2)N2CCCC2)cccc1C(=O)N1CCCC1 ZINC000501172511 910342092 /nfs/dbraw/zinc/34/20/92/910342092.db2.gz YBZPWWYQQACGLP-QHCPKHFHSA-N 0 3 420.557 4.190 20 0 HIADHN Cc1cc(C(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)c(C)n1Cc1ccccn1 ZINC000501228574 910388257 /nfs/dbraw/zinc/38/82/57/910388257.db2.gz OAXMCYCHBYYULB-XXBNENTESA-N 0 3 402.542 4.114 20 0 HIADHN CC1CCN([C@@H](CNC(=O)[C@@H](c2ccccc2)n2cccn2)c2ccccc2)CC1 ZINC000513137295 921577967 /nfs/dbraw/zinc/57/79/67/921577967.db2.gz JIJOYLWJWIPLMP-BJKOFHAPSA-N 0 3 402.542 4.062 20 0 HIADHN CC[C@@H](CNC(=O)Nc1cc(Cl)c(OC)cc1OC)N1CCc2ccccc2C1 ZINC000501377828 910507229 /nfs/dbraw/zinc/50/72/29/910507229.db2.gz RYFDKAHDLPKINE-KRWDZBQOSA-N 0 3 417.937 4.316 20 0 HIADHN COC(=O)CCC[C@@H]1CCC[C@H](N[C@@H](C)c2nc(-c3ccccc3OC)no2)C1 ZINC000513157663 921591103 /nfs/dbraw/zinc/59/11/03/921591103.db2.gz CPZIPLHTNWCHBB-ULQDDVLXSA-N 0 3 401.507 4.298 20 0 HIADHN CNC(=O)CC[C@H]1CCCCN1CC(=O)N1CCC[C@@H]1c1ccc(C(C)(C)C)cc1 ZINC000513177703 921602743 /nfs/dbraw/zinc/60/27/43/921602743.db2.gz IMGKIGLHQMMKGG-FGZHOGPDSA-N 0 3 413.606 4.028 20 0 HIADHN COc1ccc(CC(=O)N(CCN2CCCC2)Cc2ccc(Cl)c(Cl)c2)nc1 ZINC000501755235 910813902 /nfs/dbraw/zinc/81/39/02/910813902.db2.gz VDONWSRBOGLIDR-UHFFFAOYSA-N 0 3 422.356 4.064 20 0 HIADHN Cc1oc(-c2ccco2)nc1CC(=O)N[C@@H](CN1CCc2ccccc2C1)C(C)(C)C ZINC000501764049 910818507 /nfs/dbraw/zinc/81/85/07/910818507.db2.gz FPOYYWWJRVWVTJ-QFIPXVFZSA-N 0 3 421.541 4.375 20 0 HIADHN COc1cc(OC)c(NC(=O)N[C@@H](CN2CCCC2)c2ccccc2)cc1Cl ZINC000501798929 910850452 /nfs/dbraw/zinc/85/04/52/910850452.db2.gz DPUIFAPCISZCTL-SFHVURJKSA-N 0 3 403.910 4.316 20 0 HIADHN CCOc1cc2c(cc1NC(=O)N[C@@H](CN1CCCC1)c1ccccc1)O[C@H](C)C2 ZINC000501806980 910858051 /nfs/dbraw/zinc/85/80/51/910858051.db2.gz YZHDUYBFFRCULV-UTKZUKDTSA-N 0 3 409.530 4.367 20 0 HIADHN CCOc1cc2c(cc1NC(=O)N[C@H](CN1CCCC1)c1ccccc1)O[C@H](C)C2 ZINC000501806975 910858171 /nfs/dbraw/zinc/85/81/71/910858171.db2.gz YZHDUYBFFRCULV-DYESRHJHSA-N 0 3 409.530 4.367 20 0 HIADHN CC(C)[C@H](CNC(=O)C1(c2ccc(F)cc2)CCOCC1)N1CCc2ccccc2C1 ZINC000501818917 910867467 /nfs/dbraw/zinc/86/74/67/910867467.db2.gz HMLNWYXKJKZQAH-DEOSSOPVSA-N 0 3 424.560 4.073 20 0 HIADHN COc1ccc2cc(CN(C)C(=O)CN[C@@H](C)c3ccc4n[nH]cc4c3)ccc2c1 ZINC000513193123 921613014 /nfs/dbraw/zinc/61/30/14/921613014.db2.gz YOHNUHCQQWAVEJ-INIZCTEOSA-N 0 3 402.498 4.034 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)N[C@@H](CN2CCCC2)c2ccccc2)cc1OC ZINC000501831862 910873702 /nfs/dbraw/zinc/87/37/02/910873702.db2.gz PFXQYBDDDYNIDF-VXKWHMMOSA-N 0 3 423.557 4.387 20 0 HIADHN CC[C@H](CC(=O)N1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1)c1ccc(OC)cc1 ZINC000501872153 910897771 /nfs/dbraw/zinc/89/77/71/910897771.db2.gz ISMACWGWXIVLHF-JAXLGGSGSA-N 0 3 416.606 4.317 20 0 HIADHN CCN(C(=O)c1ccc(CN2CCCC2=O)cc1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000501959142 910945537 /nfs/dbraw/zinc/94/55/37/910945537.db2.gz FYCKEUULHOOMQV-RDPSFJRHSA-N 0 3 419.569 4.107 20 0 HIADHN CCN(C(=O)[C@H](C)OCc1cccc(OC)c1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000501965287 910951270 /nfs/dbraw/zinc/95/12/70/910951270.db2.gz TWCVFWHRQQZTDO-SXWKCWPCSA-N 0 3 410.558 4.284 20 0 HIADHN COc1ccc(NC(=O)[C@@H](C)NCC2(c3c(F)cccc3F)CCCC2)cc1OC ZINC000501975846 910958445 /nfs/dbraw/zinc/95/84/45/910958445.db2.gz CMKVGTKQFKWOCV-OAHLLOKOSA-N 0 3 418.484 4.411 20 0 HIADHN CSc1cccc(NC(=O)CN[C@@]2(Cc3ccc(C(F)(F)F)cc3)CCOC2)c1 ZINC000513206253 921623120 /nfs/dbraw/zinc/62/31/20/921623120.db2.gz VBMUVWZGUMIAHP-HXUWFJFHSA-N 0 3 424.488 4.357 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)[C@@H](C)Cc2cncc3ccccc32)CC1 ZINC000502008529 910975175 /nfs/dbraw/zinc/97/51/75/910975175.db2.gz IMVBJKAOVFVBCP-RBUKOAKNSA-N 0 3 402.542 4.150 20 0 HIADHN COc1ccccc1CCC(=O)N(CCN(C)C)Cc1ccc(C(F)(F)F)cc1 ZINC000502028197 910986102 /nfs/dbraw/zinc/98/61/02/910986102.db2.gz BXFCQYCFVXHWLF-UHFFFAOYSA-N 0 3 408.464 4.237 20 0 HIADHN COc1ccccc1C[C@@H]1CCCN1C(=O)c1ccc(N2CCN(C(C)C)CC2)cc1 ZINC000502067679 911012343 /nfs/dbraw/zinc/01/23/43/911012343.db2.gz WVCGIYFANJTCDK-DEOSSOPVSA-N 0 3 421.585 4.073 20 0 HIADHN CCOc1ccc(NC(=O)CN[C@]2(Cc3ccc(C(F)(F)F)cc3)CCOC2)cc1 ZINC000513210934 921626321 /nfs/dbraw/zinc/62/63/21/921626321.db2.gz TWOQDDSIOXFPKY-NRFANRHFSA-N 0 3 422.447 4.034 20 0 HIADHN COc1ccccc1[C@H](CNC(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C)OC(C)C ZINC000502184502 911115256 /nfs/dbraw/zinc/11/52/56/911115256.db2.gz IDLHWVBEISYWMZ-OFAXGOBFSA-N 0 3 413.562 4.152 20 0 HIADHN CN(C)C(=O)Nc1ccc(Cl)c(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)c1 ZINC000502224035 911169112 /nfs/dbraw/zinc/16/91/12/911169112.db2.gz AILZIJMEKUEHLN-FQEVSTJZSA-N 0 3 414.937 4.000 20 0 HIADHN Cc1cccc(Cl)c1NC(=O)CNC(C)(C)COc1ccc(C(F)(F)F)cn1 ZINC000502232662 911181327 /nfs/dbraw/zinc/18/13/27/911181327.db2.gz PBAJRFFRPQIVDU-UHFFFAOYSA-N 0 3 415.843 4.448 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Cc1csc(-c2cccnc2)n1)c1ccsc1 ZINC000513225284 921640396 /nfs/dbraw/zinc/64/03/96/921640396.db2.gz CBYGVECKKJGHNI-GOSISDBHSA-N 0 3 400.573 4.008 20 0 HIADHN Cc1ccccc1OCCCN1CCC[C@H](c2n[nH]cc2NC(=O)C2CCCC2)C1 ZINC000502298067 911254873 /nfs/dbraw/zinc/25/48/73/911254873.db2.gz CZCBMBPKOFPKET-FQEVSTJZSA-N 0 3 410.562 4.495 20 0 HIADHN COc1cc(C)c([C@@H](C)NC(=O)NC[C@H](c2ccccc2)N2CCCC2)cc1OC ZINC000502308722 911275299 /nfs/dbraw/zinc/27/52/99/911275299.db2.gz ITYYXUNXYVQTCL-WIYYLYMNSA-N 0 3 411.546 4.210 20 0 HIADHN CCc1cccc(OCCN2CCC[C@@H](c3n[nH]cc3NC(=O)c3ccccc3)C2)c1 ZINC000502320530 911295299 /nfs/dbraw/zinc/29/52/99/911295299.db2.gz SRFVEYQIGNWCGD-OAQYLSRUSA-N 0 3 418.541 4.483 20 0 HIADHN COc1ccc(NC(=O)C[C@@H](C)N[C@@H]2CCOc3c(Br)cccc32)cc1 ZINC000502335223 911314627 /nfs/dbraw/zinc/31/46/27/911314627.db2.gz BDPOLRZDABBIMK-FZKQIMNGSA-N 0 3 419.319 4.288 20 0 HIADHN C[C@H](CC(=O)N(C)c1ccccc1)N[C@H]1CCOc2c(Br)cccc21 ZINC000502369807 911355510 /nfs/dbraw/zinc/35/55/10/911355510.db2.gz UJFJRAGWOARMFD-KDOFPFPSSA-N 0 3 403.320 4.304 20 0 HIADHN C[C@@H](NC(=O)N[C@@H](CN(C)C)c1ccc(F)cc1)c1ccc(Br)s1 ZINC000502415161 911394933 /nfs/dbraw/zinc/39/49/33/911394933.db2.gz JOYFHVXHQNOKCH-RISCZKNCSA-N 0 3 414.344 4.313 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)CN[C@@H](c2ccc(F)cc2)C(C)C)c(OC)c1 ZINC000502508406 911513807 /nfs/dbraw/zinc/51/38/07/911513807.db2.gz IGUOOGJLFJPGLO-XUZZJYLKSA-N 0 3 414.521 4.493 20 0 HIADHN O=C(CN[C@]1(Cc2ccc(Cl)cc2)CCOC1)Nc1ccccc1Br ZINC000502508313 911513964 /nfs/dbraw/zinc/51/39/64/911513964.db2.gz CYNZKNMEDPQCCQ-IBGZPJMESA-N 0 3 423.738 4.032 20 0 HIADHN CCc1ccc([C@@H](NCC2(COC)CCC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000502526106 911530500 /nfs/dbraw/zinc/53/05/00/911530500.db2.gz FBTZYFJUDVQEPT-JOCHJYFZSA-N 0 3 401.572 4.148 20 0 HIADHN COc1cc(Cl)c(C)cc1NC(=O)CN[C@]1(Cc2ccc(Cl)cc2)CCOC1 ZINC000502542074 911548067 /nfs/dbraw/zinc/54/80/67/911548067.db2.gz MKQVOVSDCKBJNE-NRFANRHFSA-N 0 3 423.340 4.240 20 0 HIADHN CC(C)Oc1cccc([C@@H](C)NC(=O)NCC2(N3CCSCC3)CCCC2)c1 ZINC000502550609 911556977 /nfs/dbraw/zinc/55/69/77/911556977.db2.gz KDQHCNVTNSAITG-GOSISDBHSA-N 0 3 405.608 4.196 20 0 HIADHN COc1ccc([C@H]2CCCN2C(=O)CN[C@@H](c2ccc(F)cc2)C(C)C)cc1OC ZINC000502563010 911568146 /nfs/dbraw/zinc/56/81/46/911568146.db2.gz JDZFXGUQQZMFOH-HYBUGGRVSA-N 0 3 414.521 4.493 20 0 HIADHN COc1ccc(CCC(=O)NCC(C)(C)N2CCc3ccccc3C2)cc1Cl ZINC000502565940 911570730 /nfs/dbraw/zinc/57/07/30/911570730.db2.gz LMBQXDMTIXGXAU-UHFFFAOYSA-N 0 3 400.950 4.234 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1ccc2c(c1)CCCN2C(C)=O)c1ccsc1 ZINC000502585220 911589839 /nfs/dbraw/zinc/58/98/39/911589839.db2.gz NHVFOGFQGFOULM-NRFANRHFSA-N 0 3 414.575 4.252 20 0 HIADHN O=C(CN[C@@H]1CCCC[C@H]1OC(F)F)Nc1cc(C(F)(F)F)ccc1Cl ZINC000502593628 911598898 /nfs/dbraw/zinc/59/88/98/911598898.db2.gz SUOHNYNJHSJHHM-DGCLKSJQSA-N 0 3 400.775 4.437 20 0 HIADHN Cc1nc2c(s1)[C@@H](N[C@H]1CCCN(c3ccc(OC(F)F)cc3)C1=O)CCC2 ZINC000502597876 911604149 /nfs/dbraw/zinc/60/41/49/911604149.db2.gz VHZDFPXZPRITJZ-IRXDYDNUSA-N 0 3 407.486 4.216 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)c2cnc(-c3ccc(F)c(F)c3)s2)CC1 ZINC000502659535 911701057 /nfs/dbraw/zinc/70/10/57/911701057.db2.gz DJDGIGOZSDGDBR-UHFFFAOYSA-N 0 3 417.481 4.418 20 0 HIADHN CCCOc1ccc([C@@H](C)NC(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1OC ZINC000502667446 911708694 /nfs/dbraw/zinc/70/86/94/911708694.db2.gz MDDCOQUMQQSJEN-NQIIRXRSSA-N 0 3 411.546 4.119 20 0 HIADHN C[C@H](NC(=O)N[C@@H](CN(C)C)c1ccc(F)cc1)c1ccc(Br)s1 ZINC000502679070 911720665 /nfs/dbraw/zinc/72/06/65/911720665.db2.gz JOYFHVXHQNOKCH-FZMZJTMJSA-N 0 3 414.344 4.313 20 0 HIADHN NC(=O)[C@H]1CCCN(Cc2ccccc2NC(=O)c2cc(F)c(Cl)cc2Cl)C1 ZINC000502714489 911747686 /nfs/dbraw/zinc/74/76/86/911747686.db2.gz WDLOMNHWASOVSW-ZDUSSCGKSA-N 0 3 424.303 4.082 20 0 HIADHN CN(C(=O)c1cc(Br)ccc1OCc1ccccc1)C1CCN(C)CC1 ZINC000502730086 911756504 /nfs/dbraw/zinc/75/65/04/911756504.db2.gz YMHMDBPQGLZQFM-UHFFFAOYSA-N 0 3 417.347 4.194 20 0 HIADHN C[C@H]1CCN(C)CCN1C(=O)N[C@H](c1ccccc1)c1ccc(Br)cc1 ZINC000502811064 911828205 /nfs/dbraw/zinc/82/82/05/911828205.db2.gz HQPZOECWPUSANX-OXJNMPFZSA-N 0 3 416.363 4.274 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)c1cccc(Br)c1Cl ZINC000502826838 911841329 /nfs/dbraw/zinc/84/13/29/911841329.db2.gz JCORPIHLZDWBRP-UHFFFAOYSA-N 0 3 407.739 4.281 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)NCCCC[NH+]3C[C@@H](C)C[C@H](C)C3)cc2)cc(=O)[n-]1 ZINC000502862492 911869725 /nfs/dbraw/zinc/86/97/25/911869725.db2.gz OGTCGGMZRQNZME-IRXDYDNUSA-N 0 3 411.550 4.037 20 0 HIADHN Cc1c(C(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)cnn1-c1ccccc1F ZINC000502887340 911885189 /nfs/dbraw/zinc/88/51/89/911885189.db2.gz DLJGAGJDWNGKKV-UHFFFAOYSA-N 0 3 421.520 4.103 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)[C@@H](C)CC(=O)c3ccccc3F)c2)CC1 ZINC000502887185 911885308 /nfs/dbraw/zinc/88/53/08/911885308.db2.gz ASOJOTORYOGYCM-SFHVURJKSA-N 0 3 411.521 4.204 20 0 HIADHN CC(C)n1ncc2c1nc(C1CC1)cc2C(=O)NC[C@H]1CCCN1Cc1ccccc1 ZINC000513302662 921698586 /nfs/dbraw/zinc/69/85/86/921698586.db2.gz XGKOAQDVNOGHHL-HXUWFJFHSA-N 0 3 417.557 4.284 20 0 HIADHN CCCN(CC(=O)Nc1cc(C)nn1C(C)(C)C)[C@@H](C)CC(=O)Nc1ccccc1 ZINC000502934704 911921465 /nfs/dbraw/zinc/92/14/65/911921465.db2.gz HSCWIGVOZREXAJ-SFHVURJKSA-N 0 3 413.566 4.014 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)N[C@@H](c1ccccc1)c1ccncc1 ZINC000503026351 911997144 /nfs/dbraw/zinc/99/71/44/911997144.db2.gz SOBARIHZASJVPQ-UNMCSNQZSA-N 0 3 406.555 4.369 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N[C@H](c1ccccc1)c1ccncc1 ZINC000503026345 911997323 /nfs/dbraw/zinc/99/73/23/911997323.db2.gz SOBARIHZASJVPQ-IFMALSPDSA-N 0 3 406.555 4.369 20 0 HIADHN CCC[C@H]1C[C@@H](C(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)CCO1 ZINC000503068469 912034317 /nfs/dbraw/zinc/03/43/17/912034317.db2.gz KESBTQBZKPWSLR-HKUYNNGSSA-N 0 3 400.485 4.191 20 0 HIADHN O[C@H](COc1ccc(Cl)cc1Br)CN1CCC[C@H]1c1ccncc1 ZINC000503168870 912141218 /nfs/dbraw/zinc/14/12/18/912141218.db2.gz ZFKJSTXLHHGIGZ-RDJZCZTQSA-N 0 3 411.727 4.074 20 0 HIADHN O[C@H](Cc1ccccc1C(F)(F)F)CN1CCC[C@H]1c1nnc(-c2ccccc2)[nH]1 ZINC000503186725 912162859 /nfs/dbraw/zinc/16/28/59/912162859.db2.gz MPIHLISMHOWZTH-MJGOQNOKSA-N 0 3 416.447 4.231 20 0 HIADHN CC(C)Cc1ccc([C@@H](CNC(=O)N2CCC3(CCOCC3)[C@@H]2C)N(C)C)cc1 ZINC000513340465 921725829 /nfs/dbraw/zinc/72/58/29/921725829.db2.gz KHMUOAFRNMYCBJ-SIKLNZKXSA-N 0 3 401.595 4.088 20 0 HIADHN CCOc1cc(CN2CCC(OC)CC2)ccc1OCCOc1ccc(F)cc1 ZINC000506278442 914879517 /nfs/dbraw/zinc/87/95/17/914879517.db2.gz DQIYPSSMVSFDBN-UHFFFAOYSA-N 0 3 403.494 4.293 20 0 HIADHN COc1cc(CN2CCC[C@@H](C(=O)Nc3ccccc3)C2)c(SC)cc1OC ZINC000506283571 914882989 /nfs/dbraw/zinc/88/29/89/914882989.db2.gz WSCCGYUQUSNOFR-MRXNPFEDSA-N 0 3 400.544 4.276 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)Nc2ccccc2C(=O)N2CCCCC2)C1 ZINC000506293576 914888692 /nfs/dbraw/zinc/88/86/92/914888692.db2.gz GZMUNRKSDWKQCX-TZIWHRDSSA-N 0 3 420.557 4.270 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)Nc2cccc(C(=O)N3CCCCC3)c2)C1 ZINC000506295182 914890629 /nfs/dbraw/zinc/89/06/29/914890629.db2.gz OGAZVHTWGDQWJY-WMZHIEFXSA-N 0 3 420.557 4.270 20 0 HIADHN CC(C)Cc1ccc([C@@H](CNC(=O)N2CCC[C@@H]2C2CCOCC2)N(C)C)cc1 ZINC000513357352 921735342 /nfs/dbraw/zinc/73/53/42/921735342.db2.gz MJUHQFDECBOCEA-DHIUTWEWSA-N 0 3 401.595 4.088 20 0 HIADHN CC(C)Cc1ccc([C@@H](CNC(=O)N(C)Cc2cnc(C(C)C)nc2)N(C)C)cc1 ZINC000513370303 921743692 /nfs/dbraw/zinc/74/36/92/921743692.db2.gz HDCXQEZWQBEHEF-JOCHJYFZSA-N 0 3 411.594 4.243 20 0 HIADHN CCCOc1c(Cl)cc(CN2CCC[C@H](CN3CCOCC3)C2)cc1OCC ZINC000513382418 921754943 /nfs/dbraw/zinc/75/49/43/921754943.db2.gz XLLUOIWOYNONRM-GOSISDBHSA-N 0 3 410.986 4.072 20 0 HIADHN COc1ccc(CN(CC2CC2)C(=O)c2cccc(CN3CCCC3)c2)c(OC)c1 ZINC000506616359 915272214 /nfs/dbraw/zinc/27/22/14/915272214.db2.gz SCKRMYLDPXFWLC-UHFFFAOYSA-N 0 3 408.542 4.352 20 0 HIADHN CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)C[C@@H](c1cccs1)n1cccc1 ZINC000506644319 915312960 /nfs/dbraw/zinc/31/29/60/915312960.db2.gz VPLOBADHCDIRKX-JTAQYXEDSA-N 0 3 408.571 4.076 20 0 HIADHN CN(C)C(=O)CC1CCN(Cc2cn(-c3ccccc3)nc2-c2cccs2)CC1 ZINC000513389247 921762036 /nfs/dbraw/zinc/76/20/36/921762036.db2.gz IHUJXABXAYOXHE-UHFFFAOYSA-N 0 3 408.571 4.291 20 0 HIADHN COc1ccc([C@H](NC(=O)N(CCN(C)C)CC(C)C)c2ccccc2OC)cc1 ZINC000506695251 915372864 /nfs/dbraw/zinc/37/28/64/915372864.db2.gz LYUUQVXJESHEQI-QHCPKHFHSA-N 0 3 413.562 4.022 20 0 HIADHN O=C(NCc1ccccc1)C1CCN(Cc2ccccc2OCc2cccnc2)CC1 ZINC000506718984 915396568 /nfs/dbraw/zinc/39/65/68/915396568.db2.gz KYRKRAMCYWODMW-UHFFFAOYSA-N 0 3 415.537 4.189 20 0 HIADHN COC(=O)c1sc2nc(C)nc(NC[C@H](c3ccc(C)o3)N3CCCC3)c2c1C ZINC000506750248 915442134 /nfs/dbraw/zinc/44/21/34/915442134.db2.gz LZPPLJYKHVIDLX-OAHLLOKOSA-N 0 3 414.531 4.245 20 0 HIADHN CN(C)C(=O)CC1CCN(Cc2cn(Cc3ccccc3)nc2-c2cccs2)CC1 ZINC000513409509 921778010 /nfs/dbraw/zinc/77/80/10/921778010.db2.gz WDEZWAOZTVQMNL-UHFFFAOYSA-N 0 3 422.598 4.350 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)Nc1ccc(Oc2ccccn2)cc1 ZINC000506876911 915667737 /nfs/dbraw/zinc/66/77/37/915667737.db2.gz QILLBKJWXYLVOQ-UHFFFAOYSA-N 0 3 412.559 4.357 20 0 HIADHN C[C@H](C(=O)Nc1cccc(CSc2ccccn2)c1)N1CCN(C2CCCC2)CC1 ZINC000506950766 915756081 /nfs/dbraw/zinc/75/60/81/915756081.db2.gz AULBVGLPADFNNK-LJQANCHMSA-N 0 3 424.614 4.261 20 0 HIADHN CCCCNC(=O)C1CCN(Cc2cc3ccccc3nc2N2CCCCC2)CC1 ZINC000507019268 915825690 /nfs/dbraw/zinc/82/56/90/915825690.db2.gz AUOCWMYWJZQBDD-UHFFFAOYSA-N 0 3 408.590 4.353 20 0 HIADHN CCCCNC(=O)C1CCN(Cc2c(C)nn(-c3ccc(Cl)cc3)c2C)CC1 ZINC000507022478 915827829 /nfs/dbraw/zinc/82/78/29/915827829.db2.gz RYOTWEQIAUOGGW-UHFFFAOYSA-N 0 3 402.970 4.271 20 0 HIADHN COCc1c2ccccc2oc1C(=O)N1CCCN(CCCc2ccccc2)CC1 ZINC000507106075 915872095 /nfs/dbraw/zinc/87/20/95/915872095.db2.gz VPHLHWFKOYUXTI-UHFFFAOYSA-N 0 3 406.526 4.360 20 0 HIADHN CCN(c1ccc(C(=O)N2CCCN(CCCc3ccccc3)CC2)cn1)C(C)C ZINC000507159902 915897969 /nfs/dbraw/zinc/89/79/69/915897969.db2.gz CVPUUFHQPSKVDD-UHFFFAOYSA-N 0 3 408.590 4.097 20 0 HIADHN COc1ccc(S[C@H](C)C(=O)N2CCCN(CCCc3ccccc3)CC2)cc1 ZINC000507164706 915903179 /nfs/dbraw/zinc/90/31/79/915903179.db2.gz ZRXWBPLJFOTREX-HXUWFJFHSA-N 0 3 412.599 4.343 20 0 HIADHN CC(C)C(=O)NC1CCN(Cc2cn(-c3ccccc3)nc2-c2ccc(F)cc2)CC1 ZINC000507187166 915937219 /nfs/dbraw/zinc/93/72/19/915937219.db2.gz JBCWMHAJHOHKDH-UHFFFAOYSA-N 0 3 420.532 4.415 20 0 HIADHN CCOc1ccc(CN2CCC(C(=O)NCc3ccc(C)c(F)c3)CC2)cc1OC ZINC000507189167 915938362 /nfs/dbraw/zinc/93/83/62/915938362.db2.gz UEPDLFQZTVIVKK-UHFFFAOYSA-N 0 3 414.521 4.070 20 0 HIADHN C[C@@H](CNC(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1)Oc1ccccc1 ZINC000507339999 916095394 /nfs/dbraw/zinc/09/53/94/916095394.db2.gz SRHFZWXFNANDNS-KRWDZBQOSA-N 0 3 423.479 4.246 20 0 HIADHN CN1CCC[C@@H](CNC(=O)c2cc(C3CC3)no2)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000507356669 916109767 /nfs/dbraw/zinc/10/97/67/916109767.db2.gz HOSDCVXERHDQCR-KXBFYZLASA-N 0 3 407.436 4.384 20 0 HIADHN Cc1[nH]c2ccc(Br)cc2c1CC(=O)NCCN(C)Cc1ccccc1 ZINC000507441451 916210014 /nfs/dbraw/zinc/21/00/14/916210014.db2.gz NPXOAQZQZGWABS-UHFFFAOYSA-N 0 3 414.347 4.030 20 0 HIADHN COc1ccc(NC(=O)[C@@H](NCCc2ccc(NC(C)=O)cc2)c2ccccc2)cc1 ZINC000507468637 916237650 /nfs/dbraw/zinc/23/76/50/916237650.db2.gz OHNNWMJDKGLUJA-DEOSSOPVSA-N 0 3 417.509 4.166 20 0 HIADHN Cc1nc(-c2ccc(Br)cc2)sc1[C@@H](C)N[C@@H]1CCCCNC1=O ZINC000507482354 916249394 /nfs/dbraw/zinc/24/93/94/916249394.db2.gz QSALJHKDWHHCFY-IAQYHMDHSA-N 0 3 408.365 4.200 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3cc4sccc4[nH]3)c(OCC)c2)CC1 ZINC000507591855 916345720 /nfs/dbraw/zinc/34/57/20/916345720.db2.gz BDILUCKGIMXMOM-UHFFFAOYSA-N 0 3 412.559 4.412 20 0 HIADHN CCCN(CC(=O)Nc1cc(C)cc(C)c1)C1CCN(C(=O)c2ccccc2)CC1 ZINC000507600874 916355119 /nfs/dbraw/zinc/35/51/19/916355119.db2.gz PEUNRCBMXWMGQW-UHFFFAOYSA-N 0 3 407.558 4.259 20 0 HIADHN COc1ccc(Cl)cc1[C@H](C)N[C@H]1CCc2nnc(-c3ccc(F)cc3)n2C1 ZINC000507609051 916366201 /nfs/dbraw/zinc/36/62/01/916366201.db2.gz BWXXMJMIMJCLDN-GUYCJALGSA-N 0 3 400.885 4.412 20 0 HIADHN C[C@H](N[C@H]1CCc2nnc(-c3ccc(F)cc3)n2C1)c1nc2ccc(Cl)cc2n1C ZINC000507610000 916369170 /nfs/dbraw/zinc/36/91/70/916369170.db2.gz GULZWSBQABEKEV-GUYCJALGSA-N 0 3 424.911 4.290 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)Cn3ccc4ccccc43)c(OCC)c2)CC1 ZINC000507611457 916370280 /nfs/dbraw/zinc/37/02/80/916370280.db2.gz PQJLJWAUQPPTDF-UHFFFAOYSA-N 0 3 420.557 4.211 20 0 HIADHN O=C(CCN1CCC[C@H]1c1cccc(Br)c1)Nc1ccc2c(c1)OCO2 ZINC000507727091 916520857 /nfs/dbraw/zinc/52/08/57/916520857.db2.gz RTZPKKGEXHAXNV-KRWDZBQOSA-N 0 3 417.303 4.344 20 0 HIADHN COCCOc1ccc(NC(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)cc1Cl ZINC000507746925 916538077 /nfs/dbraw/zinc/53/80/77/916538077.db2.gz JPLLVAFTPOETTP-LPHOPBHVSA-N 0 3 417.937 4.322 20 0 HIADHN CC[C@H]1C[C@@H](CN2CCN(Cc3csc(-c4ccc(F)cc4)n3)CC2)CCO1 ZINC000507802839 916587094 /nfs/dbraw/zinc/58/70/94/916587094.db2.gz IMBMEEKXOQOCMU-UWJYYQICSA-N 0 3 403.567 4.272 20 0 HIADHN C[C@@H](C(=O)N1CCC(n2cc(Cl)cn2)CC1)N1CCC(Cc2ccccc2)CC1 ZINC000507854061 916680524 /nfs/dbraw/zinc/68/05/24/916680524.db2.gz YBECDJFHLFFLJD-SFHVURJKSA-N 0 3 414.981 4.043 20 0 HIADHN CCc1nn(C)c(CC)c1CNCc1ccccc1-c1ccc(Cn2cncn2)cc1 ZINC000507855827 916682085 /nfs/dbraw/zinc/68/20/85/916682085.db2.gz PWBAOUUCORMNQK-UHFFFAOYSA-N 0 3 414.557 4.142 20 0 HIADHN Cc1nccn1CCCN(C)[C@H](C)C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 ZINC000507912928 916786945 /nfs/dbraw/zinc/78/69/45/916786945.db2.gz JHBSJLOONZVKGS-GFCCVEGCSA-N 0 3 402.848 4.213 20 0 HIADHN CCCCOc1cc(CN2CCC(C(=O)Nc3ccc(C)cn3)CC2)ccc1OC ZINC000507988101 916831073 /nfs/dbraw/zinc/83/10/73/916831073.db2.gz XDANFRGWKZKOCG-UHFFFAOYSA-N 0 3 411.546 4.428 20 0 HIADHN Cc1ccc(NC(=O)[C@H]2CCCN(Cc3ccccc3OCc3cccnc3)C2)nc1 ZINC000508011690 916850000 /nfs/dbraw/zinc/85/00/00/916850000.db2.gz BCOGTZSDNPSASL-QFIPXVFZSA-N 0 3 416.525 4.215 20 0 HIADHN Cc1cccc(NC(=O)[C@H]2CCCN(Cc3ccccc3OCc3cccnc3)C2)n1 ZINC000508021076 916857432 /nfs/dbraw/zinc/85/74/32/916857432.db2.gz KXZPDSNKEXHLJC-QFIPXVFZSA-N 0 3 416.525 4.215 20 0 HIADHN CCOc1cc(CN2CCC[C@@H](C(=O)Nc3cccc(C)n3)C2)ccc1OC(F)F ZINC000508024855 916860871 /nfs/dbraw/zinc/86/08/71/916860871.db2.gz HJRRJOSDAWMJBU-QGZVFWFLSA-N 0 3 419.472 4.241 20 0 HIADHN O=C(CCCc1c[nH]c2ccccc12)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000508051297 916877271 /nfs/dbraw/zinc/87/72/71/916877271.db2.gz DSTPUINDHDPHIN-UHFFFAOYSA-N 0 3 405.542 4.334 20 0 HIADHN Cn1c(COc2ccccc2-c2ccccc2)nnc1N1CCN(C2CCCC2)CC1 ZINC000508139726 916959603 /nfs/dbraw/zinc/95/96/03/916959603.db2.gz ZIUAMRKLOXKGSD-UHFFFAOYSA-N 0 3 417.557 4.126 20 0 HIADHN O=C(NCCN1CCC2(CCCCC2)CC1)[C@H](OC1CCOCC1)c1ccccc1 ZINC000508299857 917109540 /nfs/dbraw/zinc/10/95/40/917109540.db2.gz NBBFEQDKWICJEX-HSZRJFAPSA-N 0 3 414.590 4.086 20 0 HIADHN CN(C)Cc1cccc(C(=O)Nc2c(-c3ccc(Br)cc3)ncn2C)c1 ZINC000508401215 917192737 /nfs/dbraw/zinc/19/27/37/917192737.db2.gz SBLCYBLWRXHVKR-UHFFFAOYSA-N 0 3 413.319 4.164 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cnc(COC)s1)c1ccc(C(F)(F)F)cc1 ZINC000508410512 917199007 /nfs/dbraw/zinc/19/90/07/917199007.db2.gz HIALCKJQXFJPDZ-OAHLLOKOSA-N 0 3 415.481 4.121 20 0 HIADHN O=C(NCCc1ccc2ccccc2n1)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000508563413 917338273 /nfs/dbraw/zinc/33/82/73/917338273.db2.gz KLEPXFBAQQFRHK-NRFANRHFSA-N 0 3 409.480 4.051 20 0 HIADHN CC[C@H](C)NC(=O)[C@@H]1C[C@H](C)N(CC(=O)Nc2cc(C)ccc2C)[C@H]2CCCC[C@@H]12 ZINC000508651435 917417485 /nfs/dbraw/zinc/41/74/85/917417485.db2.gz AIPRYORVGIQEPS-XANJAXJYSA-N 0 3 413.606 4.426 20 0 HIADHN COc1ccc(-c2nn(Cc3ccccc3)cc2CN(C)CCc2cnccn2)cc1 ZINC000508651946 917418095 /nfs/dbraw/zinc/41/80/95/917418095.db2.gz BHLPQKLWQQXQRE-UHFFFAOYSA-N 0 3 413.525 4.072 20 0 HIADHN Brc1cccc2c1OCCC[C@H]2NCc1ccccc1Cn1cncn1 ZINC000508747581 917505229 /nfs/dbraw/zinc/50/52/29/917505229.db2.gz OIHCJHYHKYAMIS-LJQANCHMSA-N 0 3 413.319 4.092 20 0 HIADHN C[C@H](NC(=O)N(CCN(C)Cc1ccccc1)Cc1ccccc1)[C@H]1CCCOC1 ZINC000508756200 917511935 /nfs/dbraw/zinc/51/19/35/917511935.db2.gz SSKWUMCPTIJBSE-URXFXBBRSA-N 0 3 409.574 4.145 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)c2ccc([C@@H]3CCCOC3)cc2)cc1 ZINC000508827316 917580299 /nfs/dbraw/zinc/58/02/99/917580299.db2.gz JMSJBCVZOUCETG-VWNXMTODSA-N 0 3 408.542 4.156 20 0 HIADHN C[C@H](NC(=O)N(C)CCCc1cc(-c2ccccc2)n[nH]1)[C@H](c1ccccc1)N(C)C ZINC000508851813 917604188 /nfs/dbraw/zinc/60/41/88/917604188.db2.gz IBAWHCBLYBIEPH-YADARESESA-N 0 3 419.573 4.342 20 0 HIADHN C[C@H](NC(=O)N(Cc1ccccc1)CC1CCOCC1)[C@H](c1ccccc1)N(C)C ZINC000508852250 917605827 /nfs/dbraw/zinc/60/58/27/917605827.db2.gz JUDOEDWUMBCSQT-GBXCKJPGSA-N 0 3 409.574 4.316 20 0 HIADHN CCc1nc2c(s1)[C@H](N(C)C(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C)CCC2 ZINC000508852168 917606085 /nfs/dbraw/zinc/60/60/85/917606085.db2.gz JEPNRFZCMIPRHN-CVAIRZPRSA-N 0 3 400.592 4.416 20 0 HIADHN C[C@H](NC(=O)Nc1ccc(NC(=O)c2ccco2)cc1)[C@@H](c1ccccc1)N(C)C ZINC000508865073 917619959 /nfs/dbraw/zinc/61/99/59/917619959.db2.gz NVSFNTBNNPPTRO-KKSFZXQISA-N 0 3 406.486 4.345 20 0 HIADHN C[C@H](NC(=O)N(Cc1cccc(F)c1)C[C@@H]1CCCO1)[C@H](c1ccccc1)N(C)C ZINC000508888648 917644145 /nfs/dbraw/zinc/64/41/45/917644145.db2.gz CNWHCJWJQBBRQL-OFAXGOBFSA-N 0 3 413.537 4.208 20 0 HIADHN C[C@H](NC(=O)N(CCCO)[C@H]1CCCc2ccccc21)[C@H](c1ccccc1)N(C)C ZINC000508894226 917649390 /nfs/dbraw/zinc/64/93/90/917649390.db2.gz FYLDZKTXYWSXBV-WDJPJFJCSA-N 0 3 409.574 4.149 20 0 HIADHN C[C@H](NC(=O)N1CCO[C@H](c2ccc(Cl)cc2)C1)[C@H](c1ccccc1)N(C)C ZINC000508893127 917649640 /nfs/dbraw/zinc/64/96/40/917649640.db2.gz DSMRZXZHUOOAON-ORYQWCPZSA-N 0 3 401.938 4.114 20 0 HIADHN C[C@H](NC(=O)N(C)Cc1csc(Br)c1)[C@H](c1ccccc1)N(C)C ZINC000508896566 917651171 /nfs/dbraw/zinc/65/11/71/917651171.db2.gz IEERTWUQQJFQOT-SUMWQHHRSA-N 0 3 410.381 4.343 20 0 HIADHN O=C(C1CCN(Cc2ccc(OC[C@@H]3CCCO3)cc2)CC1)N1CCc2ccccc21 ZINC000508897387 917653227 /nfs/dbraw/zinc/65/32/27/917653227.db2.gz WXLFVXBICKBXFR-DEOSSOPVSA-N 0 3 420.553 4.046 20 0 HIADHN C[C@H](NC(=O)N(C)[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1)[C@@H](c1ccccc1)N(C)C ZINC000508901216 917656565 /nfs/dbraw/zinc/65/65/65/917656565.db2.gz BCXRYLWSAVWELP-VAFVZNMKSA-N 0 3 413.537 4.379 20 0 HIADHN Cc1nc2ccccc2n1C[C@@H]1CCCN1C(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C ZINC000508903799 917658300 /nfs/dbraw/zinc/65/83/00/917658300.db2.gz YDXLOFZHXYKRCR-XZOYJPPVSA-N 0 3 419.573 4.210 20 0 HIADHN C[C@@H](NC(=O)N1CCC(c2nc3ccccc3[nH]2)CC1)[C@H](c1ccccc1)N(C)C ZINC000508902445 917658492 /nfs/dbraw/zinc/65/84/92/917658492.db2.gz WKFDZGHZBNZIPJ-VGOFRKELSA-N 0 3 405.546 4.143 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)c(OC)c1 ZINC000508905496 917661712 /nfs/dbraw/zinc/66/17/12/917661712.db2.gz LKAFTBCGHBCQDW-JWNTYJGQSA-N 0 3 411.546 4.242 20 0 HIADHN COc1cccc([C@@H](C)NC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)c1 ZINC000509003360 917757935 /nfs/dbraw/zinc/75/79/35/917757935.db2.gz WWQJGGZYCUCEEG-IIBYNOLFSA-N 0 3 406.448 4.327 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)N1CCCC[C@@H]1c1ncc[nH]1)c1ccc(Cl)cc1 ZINC000509033310 917788924 /nfs/dbraw/zinc/78/89/24/917788924.db2.gz RAIPXOVTIYJLDZ-MOPGFXCFSA-N 0 3 403.958 4.383 20 0 HIADHN CCCN(C)[C@H](CNC(=O)N(C)Cc1ccc(OC)c(O)c1)c1ccc(Cl)cc1 ZINC000509042057 917795739 /nfs/dbraw/zinc/79/57/39/917795739.db2.gz YDLGRTGIFMLDSI-LJQANCHMSA-N 0 3 419.953 4.279 20 0 HIADHN CCN(C(=O)NCc1c(F)cccc1N1CCCC1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000509047126 917799214 /nfs/dbraw/zinc/79/92/14/917799214.db2.gz APZGJUGMVRTTBN-NRFANRHFSA-N 0 3 424.564 4.232 20 0 HIADHN O=C(c1cscc1Br)N1CCCN(CCCc2ccccc2)CC1 ZINC000509193716 917898764 /nfs/dbraw/zinc/89/87/64/917898764.db2.gz GSTDLXYEBNHIIY-UHFFFAOYSA-N 0 3 407.377 4.291 20 0 HIADHN Cc1cc(NC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)nc(C(C)C)n1 ZINC000509222541 917920968 /nfs/dbraw/zinc/92/09/68/917920968.db2.gz DBGOZCQWCNVSTK-HXUWFJFHSA-N 0 3 406.452 4.302 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)NCCn2ccc3cc(Cl)ccc32)CC1 ZINC000509359125 918024899 /nfs/dbraw/zinc/02/48/99/918024899.db2.gz MQERINLROALCKY-UHFFFAOYSA-N 0 3 414.937 4.194 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)N[C@H](c1nccs1)c1ccccc1 ZINC000509366695 918031273 /nfs/dbraw/zinc/03/12/73/918031273.db2.gz PQASZAYHEJFPCG-HKUYNNGSSA-N 0 3 412.584 4.430 20 0 HIADHN COc1ccccc1OCCN(C)Cc1cn(-c2ccccc2)nc1-c1ccncc1 ZINC000509423306 918083371 /nfs/dbraw/zinc/08/33/71/918083371.db2.gz WEJCMPUDWSXEGA-UHFFFAOYSA-N 0 3 414.509 4.454 20 0 HIADHN Cn1cc(-c2ccc(CN[C@H]3CCN(c4ccc(Cl)c(Cl)c4)C3=O)s2)cn1 ZINC000509488150 918133816 /nfs/dbraw/zinc/13/38/16/918133816.db2.gz VQWAFQITAZCBCI-KRWDZBQOSA-N 0 3 421.353 4.351 20 0 HIADHN C[C@@H]1CCCN(C(=O)C2CCN(Cc3ccccc3OCc3ccccn3)CC2)C1 ZINC000509518278 918166878 /nfs/dbraw/zinc/16/68/78/918166878.db2.gz FQPPKPXMQAZFBL-HXUWFJFHSA-N 0 3 407.558 4.131 20 0 HIADHN COc1ccccc1NC(=O)C1CCN(Cc2ccc(OC)c(OC(F)F)c2)CC1 ZINC000509524743 918173673 /nfs/dbraw/zinc/17/36/73/918173673.db2.gz IGKQTRVBXPKDCZ-UHFFFAOYSA-N 0 3 420.456 4.156 20 0 HIADHN CCCOc1cc(CN2CCC(C(=O)Nc3ccccc3OC)CC2)ccc1OC ZINC000509538907 918186659 /nfs/dbraw/zinc/18/66/59/918186659.db2.gz GKTPMIAWSRLYPY-UHFFFAOYSA-N 0 3 412.530 4.343 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N[C@@H]1c2ccccc2CC[C@H]1n1ccnc1)c1ccco1 ZINC000509569497 918220141 /nfs/dbraw/zinc/22/01/41/918220141.db2.gz NEHFWKYBBSQKIO-UOAUAQBLSA-N 0 3 421.545 4.133 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N1CCC[C@H]1c1ccc2c(c1)OCCO2)c1ccco1 ZINC000509571316 918222071 /nfs/dbraw/zinc/22/20/71/918222071.db2.gz RYSJCJBWEFKBDE-WDSOQIARSA-N 0 3 413.518 4.027 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N1CCC(Nc2cccc(OC)c2)CC1)c1ccco1 ZINC000509575073 918224566 /nfs/dbraw/zinc/22/45/66/918224566.db2.gz VDHRMKYTZAUGMM-LAUBAEHRSA-N 0 3 414.550 4.004 20 0 HIADHN Cc1nc(COc2ccc(CN3CCC(C(=O)N(C)C(C)C)CC3)cc2)cs1 ZINC000509583107 918231791 /nfs/dbraw/zinc/23/17/91/918231791.db2.gz KGNGQSVQJWMTSR-UHFFFAOYSA-N 0 3 401.576 4.109 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)N1CC=C(c2c(F)cccc2F)CC1)c1ccco1 ZINC000509594828 918244610 /nfs/dbraw/zinc/24/46/10/918244610.db2.gz FXXWEZFYEOCXJP-DNVCBOLYSA-N 0 3 403.473 4.486 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N1CCO[C@H](c2ccccc2Cl)C1)c1ccco1 ZINC000509597167 918245903 /nfs/dbraw/zinc/24/59/03/918245903.db2.gz YKAFIRPUCXJVQQ-CVAIRZPRSA-N 0 3 405.926 4.145 20 0 HIADHN COc1cc(CN[C@@H](C)c2ccc3c(c2)CCC(=O)N3)ccc1OCC(F)(F)F ZINC000509610674 918256739 /nfs/dbraw/zinc/25/67/39/918256739.db2.gz WYSVLNONIRECJG-ZDUSSCGKSA-N 0 3 408.420 4.372 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)N(Cc1ccccc1)CC1(O)CCCC1)c1ccco1 ZINC000509613070 918261327 /nfs/dbraw/zinc/26/13/27/918261327.db2.gz IAXYCDNGDQOJJI-TZIWHRDSSA-N 0 3 413.562 4.226 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N(C)[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1)c1ccco1 ZINC000509617366 918267091 /nfs/dbraw/zinc/26/70/91/918267091.db2.gz YNANZQSMTLMDKC-AQZFEABFSA-N 0 3 417.525 4.410 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)N[C@H](C[C@H]1CCOC1)c1ccccc1 ZINC000509778072 918388102 /nfs/dbraw/zinc/38/81/02/918388102.db2.gz SMEVLDLJLXADGU-YFNKSVMNSA-N 0 3 407.558 4.118 20 0 HIADHN COC(=O)[C@H](C)CN(C)Cc1cccc(NC(=O)c2ccc(Cl)cc2Cl)c1 ZINC000509788409 918395193 /nfs/dbraw/zinc/39/51/93/918395193.db2.gz RDZILPMGRCJRCH-CYBMUJFWSA-N 0 3 409.313 4.487 20 0 HIADHN COc1cc2c(cc1OC)[C@H](c1ccccc1)N(C(=O)[C@@H](C)N1CCCCCC1)CC2 ZINC000509812509 918415586 /nfs/dbraw/zinc/41/55/86/918415586.db2.gz YLWSFDSFJOCMAS-CLOONOSVSA-N 0 3 422.569 4.442 20 0 HIADHN CC(C)Cc1cccc([C@H](C)C(=O)Nc2ccc3oc(=O)n(CCN(C)C)c3c2)c1 ZINC000509814326 918416632 /nfs/dbraw/zinc/41/66/32/918416632.db2.gz KMPMTMFPQOUKAZ-KRWDZBQOSA-N 0 3 409.530 4.097 20 0 HIADHN CC[NH+](CC)Cc1ccc(CNC(=O)Nc2ccc(-c3cc(=O)[n-]c(C)n3)cc2)cc1 ZINC000509844852 918447881 /nfs/dbraw/zinc/44/78/81/918447881.db2.gz RRNNZBSIZSSJEB-UHFFFAOYSA-N 0 3 419.529 4.321 20 0 HIADHN CC(C)(C)c1cnc(CCC(=O)Nc2ccc(CCN3CCSCC3)cc2)o1 ZINC000509920187 918520452 /nfs/dbraw/zinc/52/04/52/918520452.db2.gz QNLDANIWOANUPS-UHFFFAOYSA-N 0 3 401.576 4.135 20 0 HIADHN CCC(=O)Nc1ccc(Cl)c(NC(=O)N(CCN(C)C)Cc2ccccc2)c1 ZINC000509949302 918543996 /nfs/dbraw/zinc/54/39/96/918543996.db2.gz PJSJQQNDHAUMRN-UHFFFAOYSA-N 0 3 402.926 4.284 20 0 HIADHN COc1ccc(-c2ccncc2)cc1CN[C@@H]1CCCN(C(=O)Cc2ccccc2)C1 ZINC000509950296 918546605 /nfs/dbraw/zinc/54/66/05/918546605.db2.gz WWOLRVIOUCMSMT-XMMPIXPASA-N 0 3 415.537 4.081 20 0 HIADHN O=C(CCCCc1ccc(Cl)c(Cl)c1)N1CCN(CC2CCOCC2)CC1 ZINC000510043988 918614840 /nfs/dbraw/zinc/61/48/40/918614840.db2.gz KUMUXVUPYQTNRV-UHFFFAOYSA-N 0 3 413.389 4.277 20 0 HIADHN O=C(N[C@H]1CCN(Cc2ccccc2)C1)c1cccc(COc2cccc(F)c2)c1 ZINC000510140538 918697491 /nfs/dbraw/zinc/69/74/91/918697491.db2.gz RFZIUANPMRVJJX-QHCPKHFHSA-N 0 3 404.485 4.409 20 0 HIADHN COc1ccc([C@@H](CNC(=O)Cc2ccc(Br)s2)N2CCCC2)cc1 ZINC000510184830 918733623 /nfs/dbraw/zinc/73/36/23/918733623.db2.gz JTLUJFCQDDPMAM-QGZVFWFLSA-N 0 3 423.376 4.015 20 0 HIADHN CC[C@@H](NCC(=O)N1CCc2sccc2[C@H]1CC)c1ccc(OC)c(OC)c1 ZINC000510236617 918776045 /nfs/dbraw/zinc/77/60/45/918776045.db2.gz FHULXZWRMXMBFR-QZTJIDSGSA-N 0 3 402.560 4.342 20 0 HIADHN CCCN(Cc1nc(-c2ccsc2)no1)C1CCN(c2cc(C)nc(C)n2)CC1 ZINC000510241827 918779216 /nfs/dbraw/zinc/77/92/16/918779216.db2.gz JXFJJDJTRHHLKF-UHFFFAOYSA-N 0 3 412.563 4.086 20 0 HIADHN CC[C@H](NCC(=O)N(CC)[C@H](C)c1ccc(F)cc1)c1ccc(OC)c(OC)c1 ZINC000510245071 918781713 /nfs/dbraw/zinc/78/17/13/918781713.db2.gz UEEXUVCAGXTCFU-UZLBHIALSA-N 0 3 402.510 4.493 20 0 HIADHN CC[C@H](NCC(=O)N(C)[C@@H](C)c1ccc(F)c(F)c1)c1ccc(OC)c(OC)c1 ZINC000510244670 918781850 /nfs/dbraw/zinc/78/18/50/918781850.db2.gz VEMINAMPGYHFFU-LIRRHRJNSA-N 0 3 406.473 4.242 20 0 HIADHN CC[C@H](NCc1cccc(C(=O)NCc2ccco2)c1)c1ccc(OC)c(OC)c1 ZINC000510266920 918796205 /nfs/dbraw/zinc/79/62/05/918796205.db2.gz JWGSJRXPXOVHPO-NRFANRHFSA-N 0 3 408.498 4.468 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)Nc1ccc(Sc2nncn2C)cc1 ZINC000510349073 918845492 /nfs/dbraw/zinc/84/54/92/918845492.db2.gz SGSHOYIRVNKIAK-UHFFFAOYSA-N 0 3 407.499 4.026 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N(Cc3ccc([C@@H]4C[C@@H]4C)o3)C3CC3)cc2)CC1 ZINC000510383146 918864520 /nfs/dbraw/zinc/86/45/20/918864520.db2.gz CCTHWLWNRFEVBL-FDDCHVKYSA-N 0 3 407.558 4.350 20 0 HIADHN CCOc1ccccc1NC(=O)N(CCN(C)C)Cc1ccc(Br)cc1 ZINC000510386709 918867017 /nfs/dbraw/zinc/86/70/17/918867017.db2.gz PEJYJSBWLITROB-UHFFFAOYSA-N 0 3 420.351 4.444 20 0 HIADHN CCN1CCN(c2ccc(C(=O)NC3(c4ccc(OC)cc4)CCCC3)cc2)CC1 ZINC000510406618 918878240 /nfs/dbraw/zinc/87/82/40/918878240.db2.gz MSPBYEXGRXPBNQ-UHFFFAOYSA-N 0 3 407.558 4.036 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3ccccc3NCC(F)(F)F)cc2)CC1 ZINC000510421281 918887652 /nfs/dbraw/zinc/88/76/52/918887652.db2.gz VJBOLFLQUPHOEC-UHFFFAOYSA-N 0 3 406.452 4.055 20 0 HIADHN O=C1COc2ccc(CNC3(c4ccc(Br)cc4)CCCC3)cc2N1 ZINC000510486110 918937686 /nfs/dbraw/zinc/93/76/86/918937686.db2.gz VBCZLLAEZJCIJD-UHFFFAOYSA-N 0 3 401.304 4.339 20 0 HIADHN CCOc1ccc([C@@H](NC(=O)N[C@H](C)C2=CCN(C)CC2)C(C)C)cc1OCC ZINC000510499595 918947288 /nfs/dbraw/zinc/94/72/88/918947288.db2.gz HCJYKOLYNMPJDQ-VGSWGCGISA-N 0 3 403.567 4.131 20 0 HIADHN CCCCCOc1ccc([C@@H](C)NC(=O)N[C@H](C)C2=CCN(C)CC2)cc1OC ZINC000510502501 918950148 /nfs/dbraw/zinc/95/01/48/918950148.db2.gz QQJKUDBJRFHQTO-QZTJIDSGSA-N 0 3 403.567 4.275 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)NCc1ccc(OCC(F)(F)F)cc1 ZINC000510503690 918951000 /nfs/dbraw/zinc/95/10/00/918951000.db2.gz VLNDGFTZQCMTDI-UHFFFAOYSA-N 0 3 406.404 4.366 20 0 HIADHN Cc1n[nH]c(C)c1[C@H]1CCCCCN1C(=O)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000510502664 918951310 /nfs/dbraw/zinc/95/13/10/918951310.db2.gz PRKTWLXWPUIXLO-FCHUYYIVSA-N 0 3 409.578 4.490 20 0 HIADHN CCCOc1c(Cl)cc(CN2CCC(N3CCO[C@@H](C)C3)CC2)cc1OCC ZINC000510524938 918971277 /nfs/dbraw/zinc/97/12/77/918971277.db2.gz ZJPZNEUATOOVGW-KRWDZBQOSA-N 0 3 410.986 4.213 20 0 HIADHN Cc1ccccc1C1(CNC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)CCOCC1 ZINC000510531481 918977354 /nfs/dbraw/zinc/97/73/54/918977354.db2.gz CNJJSNFUPCGNDS-QHCPKHFHSA-N 0 3 421.585 4.007 20 0 HIADHN CCOC(=O)c1cnn(C2CCN(Cc3cc(Cl)cc4cccnc43)CC2)c1C ZINC000510578370 919021292 /nfs/dbraw/zinc/02/12/92/919021292.db2.gz JWEKZBRLBOEFFN-UHFFFAOYSA-N 0 3 412.921 4.407 20 0 HIADHN C[C@H](NC(=O)NCCSCc1ccc(Cl)cc1Cl)C1=CCN(C)CC1 ZINC000510582050 919024531 /nfs/dbraw/zinc/02/45/31/919024531.db2.gz UVYHIBMAZNYXDY-ZDUSSCGKSA-N 0 3 402.391 4.176 20 0 HIADHN CN(C)Cc1cccc(NC(=O)N2CCC[C@@H](c3nc(-c4cccc(F)c4)no3)C2)c1 ZINC000510653390 919093690 /nfs/dbraw/zinc/09/36/90/919093690.db2.gz RWDHNCHNZBJUOF-GOSISDBHSA-N 0 3 423.492 4.349 20 0 HIADHN CCCOc1cccc(NC(=O)NCCCCN2CCN(c3ccccc3)CC2)c1 ZINC000510761567 919214733 /nfs/dbraw/zinc/21/47/33/919214733.db2.gz HHTYVXCZBMUDFO-UHFFFAOYSA-N 0 3 410.562 4.199 20 0 HIADHN COCCOc1cc(C)ccc1NC(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000510819456 919297537 /nfs/dbraw/zinc/29/75/37/919297537.db2.gz CSEFNHAKFHKNGQ-SFHVURJKSA-N 0 3 403.548 4.040 20 0 HIADHN Cc1cc(NC(=O)NCCc2ccsc2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000510823754 919302567 /nfs/dbraw/zinc/30/25/67/919302567.db2.gz GBCHRZNLAAVWRB-HXUWFJFHSA-N 0 3 409.559 4.064 20 0 HIADHN COc1ccc(C[C@@H](NC(=O)[C@@H](C)N2CCCCCC2)c2ccccc2)cc1OC ZINC000510860702 919351888 /nfs/dbraw/zinc/35/18/88/919351888.db2.gz CCCKQHNJTQSXGH-DENIHFKCSA-N 0 3 410.558 4.368 20 0 HIADHN O=C(CC(F)(F)F)NC[C@@H]1CCCN(CCOc2cc(Cl)cc(Cl)c2)C1 ZINC000510873299 919367409 /nfs/dbraw/zinc/36/74/09/919367409.db2.gz DQVHKJFXHMWOSH-LBPRGKRZSA-N 0 3 413.267 4.153 20 0 HIADHN O=C(CNC1(c2ccc(Br)cc2)CCOCC1)Nc1cccc(Cl)c1 ZINC000510877806 919372333 /nfs/dbraw/zinc/37/23/33/919372333.db2.gz LXSCEZSUJWQQHB-UHFFFAOYSA-N 0 3 423.738 4.337 20 0 HIADHN Fc1ccc(CCN(CCn2ccnc2)Cc2ccc(Br)o2)cc1F ZINC000510905807 919409660 /nfs/dbraw/zinc/40/96/60/919409660.db2.gz IZODTODOTNBMEB-UHFFFAOYSA-N 0 3 410.262 4.262 20 0 HIADHN Cc1c([C@@H](C)N[C@@H]2CCN(C(=O)Nc3ccccc3)C2)cnn1-c1ccc(F)cc1 ZINC000510946219 919475864 /nfs/dbraw/zinc/47/58/64/919475864.db2.gz VFYYGXGWIFFGAY-OXQOHEQNSA-N 0 3 407.493 4.277 20 0 HIADHN CCCN(C(=O)c1cc(-c2ccccc2)[nH]n1)C1CCN(c2cc(C)nc(C)n2)CC1 ZINC000510962776 919505995 /nfs/dbraw/zinc/50/59/95/919505995.db2.gz RFPWQEAZKSINRA-UHFFFAOYSA-N 0 3 418.545 4.005 20 0 HIADHN COc1cc(OC)c([C@@H](C)N[C@H]2CCCN(C(=O)Cc3ccccc3)C2)cc1Cl ZINC000511008279 919568700 /nfs/dbraw/zinc/56/87/00/919568700.db2.gz ANPMAVFWZPWLKL-AEFFLSMTSA-N 0 3 416.949 4.242 20 0 HIADHN CC(C)CN(C(=O)c1cccc(NC(=O)c2ccc(F)cc2)c1)C1CCN(C)CC1 ZINC000511036157 919618438 /nfs/dbraw/zinc/61/84/38/919618438.db2.gz XUFXUNSSOUKNQY-UHFFFAOYSA-N 0 3 411.521 4.270 20 0 HIADHN COC[C@H](N[C@H]1CCCN(C(=O)Cc2ccccc2)C1)c1cccc(C(F)(F)F)c1 ZINC000511052560 919647559 /nfs/dbraw/zinc/64/75/59/919647559.db2.gz BXXIQZMIXMCFEN-SFTDATJTSA-N 0 3 420.475 4.216 20 0 HIADHN CC[C@H](C)n1ncc2c1nc(C)cc2C(=O)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000511075768 919677555 /nfs/dbraw/zinc/67/75/55/919677555.db2.gz JAYTXOKZFSQRIE-AVRDEDQJSA-N 0 3 405.546 4.278 20 0 HIADHN O=C(N[C@@H](c1ccccc1)c1cccnc1)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000511146778 919766613 /nfs/dbraw/zinc/76/66/13/919766613.db2.gz QOAWMDWOJHWNGP-GOTSBHOMSA-N 0 3 421.491 4.445 20 0 HIADHN O=C(CCN(Cc1ccc(C(F)(F)F)cc1)C1CC1)NCC(=O)c1ccccc1 ZINC000511151091 919770811 /nfs/dbraw/zinc/77/08/11/919770811.db2.gz SGSIHRAEWITWQN-UHFFFAOYSA-N 0 3 404.432 4.059 20 0 HIADHN C[C@H](NC(=O)N1CCCC[C@@H]1c1nc(-c2cccc(F)c2)c[nH]1)C1=CCN(C)CC1 ZINC000511249865 919850390 /nfs/dbraw/zinc/85/03/90/919850390.db2.gz PYTCAOJGLKSKCY-HRAATJIYSA-N 0 3 411.525 4.103 20 0 HIADHN C[C@@H](NC(=O)NCC1(c2ccc(Br)cc2)CCCC1)C1=CCN(C)CC1 ZINC000511250742 919851858 /nfs/dbraw/zinc/85/18/58/919851858.db2.gz RGCSVSUZAWOXSJ-MRXNPFEDSA-N 0 3 420.395 4.211 20 0 HIADHN C[C@H](NC(=O)N(C)CCCCCc1cc(-c2ccccc2)n[nH]1)C1=CCN(C)CC1 ZINC000511250335 919852115 /nfs/dbraw/zinc/85/21/15/919852115.db2.gz QROXYPYJUFMPJY-IBGZPJMESA-N 0 3 409.578 4.081 20 0 HIADHN CC[C@H](CNC(=O)c1cc(C)nc2c1cnn2[C@@H](C)CC)N1CCc2ccccc2C1 ZINC000511269009 919867210 /nfs/dbraw/zinc/86/72/10/919867210.db2.gz UAWFXPOTKTYGNE-GHTZIAJQSA-N 0 3 419.573 4.277 20 0 HIADHN COc1ccccc1C[C@H](C)N(Cc1ccccc1)C(=O)N[C@@H](C)C1=CCN(C)CC1 ZINC000511287683 919883560 /nfs/dbraw/zinc/88/35/60/919883560.db2.gz OINQXXVPTWIVDC-SFTDATJTSA-N 0 3 421.585 4.488 20 0 HIADHN C[C@H](NC(=O)NCc1ccccc1COc1ccccc1Cl)C1=CCN(C)CC1 ZINC000511288748 919885470 /nfs/dbraw/zinc/88/54/70/919885470.db2.gz OYGGUALFQWCQGO-KRWDZBQOSA-N 0 3 413.949 4.369 20 0 HIADHN C[C@H](NC(=O)N[C@H]1c2cc(Br)ccc2SC[C@H]1C)C1=CCN(C)CC1 ZINC000511292008 919888881 /nfs/dbraw/zinc/88/88/81/919888881.db2.gz WOAWLDAOZAZXKJ-FHSNZYRGSA-N 0 3 424.408 4.182 20 0 HIADHN C[C@H](NC(=O)c1ccccc1Nc1ccc(OC(F)F)cc1)C1=CCN(C)CC1 ZINC000511308147 919899735 /nfs/dbraw/zinc/89/97/35/919899735.db2.gz MIINRIORXSAQFN-HNNXBMFYSA-N 0 3 401.457 4.412 20 0 HIADHN CC(C)n1ncc2c1nc(-c1ccccc1)cc2C(=O)N[C@H](C)C1=CCN(C)CC1 ZINC000511346925 919940365 /nfs/dbraw/zinc/94/03/65/919940365.db2.gz VBPUPNOHQBVSJA-QGZVFWFLSA-N 0 3 403.530 4.059 20 0 HIADHN C[C@H](NC(=O)c1ccccc1-c1nc(-c2cccc(Cl)c2)no1)C1=CCN(C)CC1 ZINC000511377993 919978808 /nfs/dbraw/zinc/97/88/08/919978808.db2.gz JGKKLOVXRVOQSS-HNNXBMFYSA-N 0 3 422.916 4.437 20 0 HIADHN O[C@H](CN[C@@H](Cc1ccc(Cl)cc1)c1ccccn1)COc1ccc(F)cc1 ZINC000511381224 919983785 /nfs/dbraw/zinc/98/37/85/919983785.db2.gz IHJDMLGHFOWRNC-KNQAVFIVSA-N 0 3 400.881 4.187 20 0 HIADHN CN(C)CCN(CC1CCCCC1)C(=O)N[C@@H](C[C@H]1CCOC1)c1ccccc1 ZINC000511390457 919997072 /nfs/dbraw/zinc/99/70/72/919997072.db2.gz IQGBWCHEUPOTMR-GGAORHGYSA-N 0 3 401.595 4.308 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)N[C@H](C[C@H]2CCOC2)c2ccccc2)CC1 ZINC000511397852 920010174 /nfs/dbraw/zinc/01/01/74/920010174.db2.gz LIWHKKQIWMWKAN-AUSIDOKSSA-N 0 3 411.546 4.053 20 0 HIADHN CC(=O)c1c(C)[nH]c(C(=O)N2CCC(N3CCc4ccccc4C3)CC2)c1C(C)C ZINC000511512606 920131129 /nfs/dbraw/zinc/13/11/29/920131129.db2.gz HKOABEDZAKUODE-UHFFFAOYSA-N 0 3 407.558 4.312 20 0 HIADHN CCc1cccc2c(C3CCN(Cc4cnc(N5CCOCC5)s4)CC3)c[nH]c21 ZINC000511523032 920141844 /nfs/dbraw/zinc/14/18/44/920141844.db2.gz FCRDDWNBJQRYGK-UHFFFAOYSA-N 0 3 410.587 4.403 20 0 HIADHN O=C(Nc1cccc(C(=O)N2CCCCC2)c1)N[C@H](CN1CCCC1)c1ccccc1 ZINC000511609091 920258821 /nfs/dbraw/zinc/25/88/21/920258821.db2.gz ILLUHKVJGUXHOX-HSZRJFAPSA-N 0 3 420.557 4.271 20 0 HIADHN C[C@@H](N[C@H](c1cccc(OC(F)(F)F)c1)C1CC1)C(=O)NCCc1cccs1 ZINC000511623845 920282632 /nfs/dbraw/zinc/28/26/32/920282632.db2.gz OJDRGGZDRBUBAB-ACJLOTCBSA-N 0 3 412.477 4.435 20 0 HIADHN CC(=O)NCC1CCN(Cc2cn(-c3ccccc3)nc2-c2ccc(F)cc2)CC1 ZINC000511645424 920311659 /nfs/dbraw/zinc/31/16/59/920311659.db2.gz FABANPIAXLMGAM-UHFFFAOYSA-N 0 3 406.505 4.027 20 0 HIADHN CC(=O)Nc1ccc2nc(NC(=O)[C@H]3CCCN(Cc4ccccc4)C3)sc2c1 ZINC000511646995 920313853 /nfs/dbraw/zinc/31/38/53/920313853.db2.gz IPRFFUZSLKJZAU-KRWDZBQOSA-N 0 3 408.527 4.105 20 0 HIADHN C[C@H](CNC(=O)c1cccc(C(=O)Nc2ccccc2)c1)N(C)Cc1ccccc1 ZINC000511655172 920321359 /nfs/dbraw/zinc/32/13/59/920321359.db2.gz HCCNBXVQXDYJFP-LJQANCHMSA-N 0 3 401.510 4.189 20 0 HIADHN O=C(CN1C[C@H](c2ccccc2)[C@H]2COCC[C@@H]21)Nc1ccccc1C(F)(F)F ZINC000511757474 920438854 /nfs/dbraw/zinc/43/88/54/920438854.db2.gz PBKHXXDQPQKIJB-HLIPFELVSA-N 0 3 404.432 4.148 20 0 HIADHN O=C(CN1C[C@H](c2ccccc2)[C@H]2COCC[C@@H]21)Nc1cccc(C(F)(F)F)c1 ZINC000511759062 920441028 /nfs/dbraw/zinc/44/10/28/920441028.db2.gz SSFYYKKIXAJRAZ-AQNXPRMDSA-N 0 3 404.432 4.148 20 0 HIADHN O=C1NCCN1C1CCN(Cc2ccc(-c3ccccc3Br)s2)CC1 ZINC000511768599 920455164 /nfs/dbraw/zinc/45/51/64/920455164.db2.gz FMAGLDSOJXJLME-UHFFFAOYSA-N 0 3 420.376 4.167 20 0 HIADHN C[C@H](c1cc2ccccc2o1)N(C)C(=O)CN1C[C@H](c2ccccc2)[C@@H]2COCC[C@H]21 ZINC000511781867 920472450 /nfs/dbraw/zinc/47/24/50/920472450.db2.gz UCRASNBDRBIWSK-TWHAJKEOSA-N 0 3 418.537 4.457 20 0 HIADHN Cc1cc(C(=O)CN2C[C@H](c3ccccc3)[C@H]3COCC[C@H]32)c(C)n1-c1nccs1 ZINC000511781879 920472625 /nfs/dbraw/zinc/47/26/25/920472625.db2.gz UFZRINMSDMARKK-YPAWHYETSA-N 0 3 421.566 4.238 20 0 HIADHN CCN(C(=O)CN1C[C@H](c2ccccc2)[C@@H]2COCC[C@@H]21)c1nc2ccccc2s1 ZINC000511795720 920490083 /nfs/dbraw/zinc/49/00/83/920490083.db2.gz XJJPAJOIAIKCLP-DYXWJJEUSA-N 0 3 421.566 4.154 20 0 HIADHN Fc1ccc(-n2cc(CN3C[C@H](c4ccccc4)[C@H]4COCC[C@H]43)nn2)cc1Cl ZINC000511798684 920492403 /nfs/dbraw/zinc/49/24/03/920492403.db2.gz XDXDSPATDHQSQE-WOIUINJBSA-N 0 3 412.896 4.064 20 0 HIADHN Fc1ccc(-n2cc(CN3C[C@H](c4ccccc4)[C@@H]4COCC[C@@H]43)nn2)cc1Cl ZINC000511798682 920492986 /nfs/dbraw/zinc/49/29/86/920492986.db2.gz XDXDSPATDHQSQE-DXIQSLLYSA-N 0 3 412.896 4.064 20 0 HIADHN O=C(CN1C[C@H](c2ccccc2)[C@H]2CCC[C@H]21)NCC1(c2ccccc2)CCOCC1 ZINC000511829574 920531666 /nfs/dbraw/zinc/53/16/66/920531666.db2.gz KKGSPYKAZXKYQW-UBFVSLLYSA-N 0 3 418.581 4.119 20 0 HIADHN CCN(CC)C(=O)c1ccc(NC(=O)CN2C[C@H](c3ccccc3)[C@H]3CCC[C@H]32)cc1 ZINC000511842616 920558435 /nfs/dbraw/zinc/55/84/35/920558435.db2.gz KLMBITYKAMHENQ-WXFUMESZSA-N 0 3 419.569 4.375 20 0 HIADHN CCN(CC)C(=O)c1cccc(NC(=O)CN2C[C@H](c3ccccc3)[C@@H]3CCC[C@@H]32)c1 ZINC000511897294 920634262 /nfs/dbraw/zinc/63/42/62/920634262.db2.gz RYOGNWMTBJQXIL-VXNXHJTFSA-N 0 3 419.569 4.375 20 0 HIADHN COc1ccc(CNc2ccccc2CN2CCC(O)CC2)c(Br)c1 ZINC000512012044 920784233 /nfs/dbraw/zinc/78/42/33/920784233.db2.gz YBLIOUFFLWTJTE-UHFFFAOYSA-N 0 3 405.336 4.027 20 0 HIADHN C[C@H](CC(=O)Nc1cc(C(F)(F)F)ccc1Cl)NCC(=O)NC1CCCCC1 ZINC000512027052 920801007 /nfs/dbraw/zinc/80/10/07/920801007.db2.gz SSOIPNJGTIMNQJ-GFCCVEGCSA-N 0 3 419.875 4.114 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Cc3ccccc3Br)c(C)c2)CC1 ZINC000512032547 920805537 /nfs/dbraw/zinc/80/55/37/920805537.db2.gz VHGNOTUDRZFJOP-UHFFFAOYSA-N 0 3 416.363 4.081 20 0 HIADHN Cn1nccc1-c1ccccc1CNCc1ccc(N2CCc3ccccc3C2)nc1 ZINC000512054539 920824203 /nfs/dbraw/zinc/82/42/03/920824203.db2.gz WHCRCDYGSLPZTR-UHFFFAOYSA-N 0 3 409.537 4.335 20 0 HIADHN CCN1CCCC[C@@H]1C(=O)N1CCC[C@@H](Cc2nc(C3CCCCCC3)no2)C1 ZINC000512055949 920825296 /nfs/dbraw/zinc/82/52/96/920825296.db2.gz HAQTXMWUTHJXGP-AZUAARDMSA-N 0 3 402.583 4.163 20 0 HIADHN COc1ccc(CNC2CCN(C(=O)NC3CCCCC3)CC2)c(Br)c1 ZINC000512075931 920841090 /nfs/dbraw/zinc/84/10/90/920841090.db2.gz ZEFMLOVWXSDKNN-UHFFFAOYSA-N 0 3 424.383 4.054 20 0 HIADHN CN(C)Cc1cnc(CNCC2(c3ccc(Cl)cc3Cl)CCOCC2)s1 ZINC000512083614 920848030 /nfs/dbraw/zinc/84/80/30/920848030.db2.gz RLLRUMLXIBPTSU-UHFFFAOYSA-N 0 3 414.402 4.350 20 0 HIADHN COc1cc2c(cc1OC)CN(C(=O)CN1C[C@@H](C)CC[C@@H]1c1ccccc1)CC2 ZINC000512144071 920887829 /nfs/dbraw/zinc/88/78/29/920887829.db2.gz ALMFUCXIBNJEGQ-PGRDOPGGSA-N 0 3 408.542 4.062 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Cc1c(C)noc1Cl)c1ccc(C(F)(F)F)cc1 ZINC000512145588 920888722 /nfs/dbraw/zinc/88/87/22/920888722.db2.gz CRUOONSTEKSNKT-MRXNPFEDSA-N 0 3 417.859 4.397 20 0 HIADHN C[C@H](OC[C@H](O)CN(C)CCc1nc(-c2ccccc2)no1)c1ccc(Cl)cc1 ZINC000512181261 920921189 /nfs/dbraw/zinc/92/11/89/920921189.db2.gz OVRVMVKSUHULCH-OXJNMPFZSA-N 0 3 415.921 4.003 20 0 HIADHN O=C(CN1CCC[C@]2(CC=CCC2)C1)N1CCC[C@@H]1c1ccc2c(c1)OCCCO2 ZINC000512208771 920955154 /nfs/dbraw/zinc/95/51/54/920955154.db2.gz HLJVUPJIECKFSC-PXDATVDWSA-N 0 3 410.558 4.334 20 0 HIADHN COc1ccc(C)cc1NC(=O)[C@@H](NCCc1ccc2c(c1)CCO2)c1ccccc1 ZINC000512233412 920988450 /nfs/dbraw/zinc/98/84/50/920988450.db2.gz IVDCEXDNQZLAHQ-VWLOTQADSA-N 0 3 416.521 4.451 20 0 HIADHN FC(F)(F)Oc1cccc(N2CC[C@H](NCc3cccc4c3OCCCO4)C2)c1 ZINC000512244125 921000269 /nfs/dbraw/zinc/00/02/69/921000269.db2.gz QUDCTMSRNZACHQ-INIZCTEOSA-N 0 3 408.420 4.115 20 0 HIADHN CCCN(CC(=O)Nc1cc(C)ccc1C)C1CCN(c2cc(C)nc(C)n2)CC1 ZINC000512279153 921035339 /nfs/dbraw/zinc/03/53/39/921035339.db2.gz LHVYILYXWSDRDQ-UHFFFAOYSA-N 0 3 409.578 4.030 20 0 HIADHN CC(C)CN(C(=O)c1cc(F)c(Br)c(Cl)c1)C1CCN(C)CC1 ZINC000512306245 921060206 /nfs/dbraw/zinc/06/02/06/921060206.db2.gz LAXFQDAADCYXPT-UHFFFAOYSA-N 0 3 405.739 4.434 20 0 HIADHN CNC(=O)c1cccc(CN(C)CCOc2ccc(OCc3ccccc3)cc2)c1 ZINC000512318055 921068024 /nfs/dbraw/zinc/06/80/24/921068024.db2.gz JMMBTDISDORPAO-UHFFFAOYSA-N 0 3 404.510 4.136 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)C[C@@H](C)NCc1cn(-c2ccccc2)nc1C ZINC000512323898 921073743 /nfs/dbraw/zinc/07/37/43/921073743.db2.gz ODHVUNIUCKXAJN-OAHLLOKOSA-N 0 3 412.921 4.350 20 0 HIADHN CCn1ccnc1[C@H]1OCC[C@@H]1NCc1cccc(NC(=O)c2ccccc2Cl)c1 ZINC000512338908 921084106 /nfs/dbraw/zinc/08/41/06/921084106.db2.gz OPLHPBXYLZFAIN-SFTDATJTSA-N 0 3 424.932 4.429 20 0 HIADHN COc1cc(CN[C@H]2CCO[C@@H]2c2cccnc2)cc(OC)c1OCc1ccccc1 ZINC000512360434 921102603 /nfs/dbraw/zinc/10/26/03/921102603.db2.gz YPLUDTOSJYVICQ-XUZZJYLKSA-N 0 3 420.509 4.298 20 0 HIADHN Cc1ccc(-c2nc(C(=O)N(CCN(C)C)Cc3ccc(F)c(F)c3)cs2)o1 ZINC000513494981 921845112 /nfs/dbraw/zinc/84/51/12/921845112.db2.gz KXPWZXFCEQEUIK-UHFFFAOYSA-N 0 3 405.470 4.194 20 0 HIADHN C[C@@H]1CN(Cc2ccc(CN[C@@H](Cc3ccccn3)c3cccnc3)cc2)C[C@@H](C)O1 ZINC000513500354 921849702 /nfs/dbraw/zinc/84/97/02/921849702.db2.gz MCNMPNBCFVRFCV-YPCDYVTLSA-N 0 3 416.569 4.159 20 0 HIADHN CCCN(C)[C@H](CNC(=O)Nc1ccc(Cl)c(C(N)=O)c1)c1ccc(Cl)cc1 ZINC000513606103 921937681 /nfs/dbraw/zinc/93/76/81/921937681.db2.gz IMILUTDFISHBNH-GOSISDBHSA-N 0 3 423.344 4.297 20 0 HIADHN Cc1ccc([C@@H](CNCc2cc(Br)ccc2F)N2CCOCC2)cc1 ZINC000513631743 921958347 /nfs/dbraw/zinc/95/83/47/921958347.db2.gz GRMIQOULLRDQSB-HXUWFJFHSA-N 0 3 407.327 4.060 20 0 HIADHN c1ccc2nc(N3CCCCC3)c(CN3CCC[C@H](c4nnc5n4CCC5)C3)cc2c1 ZINC000513697779 922019420 /nfs/dbraw/zinc/01/94/20/922019420.db2.gz RHSLZWPRRHSLHX-FQEVSTJZSA-N 0 3 416.573 4.142 20 0 HIADHN CC(C)N(C(=O)[C@@H](C)N(C)CCCc1cc(-c2ccc(F)cc2)n(C)n1)C(C)C ZINC000513707555 922027845 /nfs/dbraw/zinc/02/78/45/922027845.db2.gz FLBZKFRSYWQFIH-GOSISDBHSA-N 0 3 402.558 4.125 20 0 HIADHN COc1cc(CN(C)[C@H]2CCOC2)ccc1OCc1ccc(Br)cc1 ZINC000513746210 922067837 /nfs/dbraw/zinc/06/78/37/922067837.db2.gz QEJZUZTYWVZFMP-SFHVURJKSA-N 0 3 406.320 4.257 20 0 HIADHN CC(=O)c1ccc(NC(=O)[C@@H](C)N[C@H]2CCC[C@H]2Oc2cc(F)cc(F)c2)cc1 ZINC000513751173 922070270 /nfs/dbraw/zinc/07/02/70/922070270.db2.gz YHTWKSQFCJATGZ-HBUDHLSFSA-N 0 3 402.441 4.084 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)NC(C)(C)C[N@H+](C)Cc3ccccc3)cc2)cc(=O)[n-]1 ZINC000513871825 922201838 /nfs/dbraw/zinc/20/18/38/922201838.db2.gz XPRSZWFJLKCBOP-UHFFFAOYSA-N 0 3 419.529 4.190 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)NC(C)(C)C[N@@H+](C)Cc3ccccc3)cc2)cc(=O)[n-]1 ZINC000513871825 922201851 /nfs/dbraw/zinc/20/18/51/922201851.db2.gz XPRSZWFJLKCBOP-UHFFFAOYSA-N 0 3 419.529 4.190 20 0 HIADHN CCN(CCc1nccs1)C(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1 ZINC000514003071 922328536 /nfs/dbraw/zinc/32/85/36/922328536.db2.gz GSVYZADBOKKMOE-KRWDZBQOSA-N 0 3 406.621 4.252 20 0 HIADHN CC(C)[C@H](NC(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1)c1nc2ccccc2[nH]1 ZINC000514068685 922392235 /nfs/dbraw/zinc/39/22/35/922392235.db2.gz NWOQYQGQSYTPKH-KPLVRAHFSA-N 0 3 405.546 4.395 20 0 HIADHN COc1ccc(OC)c([C@@H](C)NC(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)c1 ZINC000514069337 922393061 /nfs/dbraw/zinc/39/30/61/922393061.db2.gz ANAWYSGJDSHGRV-XMSQKQJNSA-N 0 3 411.546 4.210 20 0 HIADHN CC[C@@H](C)N(Cc1nc2ccccc2c(=O)[nH]1)C[C@H]1CCN(C(=O)c2ccccc2)C1 ZINC000514118807 922452269 /nfs/dbraw/zinc/45/22/69/922452269.db2.gz NJUGHYIRXPMGTF-MOPGFXCFSA-N 0 3 418.541 4.098 20 0 HIADHN CC[C@H](C)N(Cc1nc2ccccc2c(=O)[nH]1)C[C@@H]1CCN(C(=O)c2ccccc2)C1 ZINC000514118809 922452427 /nfs/dbraw/zinc/45/24/27/922452427.db2.gz NJUGHYIRXPMGTF-RBUKOAKNSA-N 0 3 418.541 4.098 20 0 HIADHN COc1ccc([C@H]2CCCN2C(=O)CN2CCC[C@H]2Cc2ccccc2C)c(OC)c1 ZINC000514171181 922509810 /nfs/dbraw/zinc/50/98/10/922509810.db2.gz YVIDBJHISVXASC-XUZZJYLKSA-N 0 3 422.569 4.383 20 0 HIADHN CCCCN(CC(=O)N1CCC(C(=O)N2CCCC2)CC1)[C@@H](CC)c1ccccc1 ZINC000514175017 922512664 /nfs/dbraw/zinc/51/26/64/922512664.db2.gz UARZMGLWJMFDDV-QHCPKHFHSA-N 0 3 413.606 4.101 20 0 HIADHN CCN(Cc1ccc(OC)c(OC)c1)C(=O)CN1CCC[C@@H]1Cc1ccccc1C ZINC000514181001 922519661 /nfs/dbraw/zinc/51/96/61/922519661.db2.gz YNKVYZVYVMTRKC-JOCHJYFZSA-N 0 3 410.558 4.068 20 0 HIADHN O=C(NCc1nc2cc(Cl)ccc2s1)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000514182147 922521307 /nfs/dbraw/zinc/52/13/07/922521307.db2.gz JFXGHPSJHGZDBT-MRXNPFEDSA-N 0 3 400.935 4.023 20 0 HIADHN CC1CCN([C@H](CNC(=O)NCc2cccc(N(C)C)c2)c2cccs2)CC1 ZINC000514182144 922521566 /nfs/dbraw/zinc/52/15/66/922521566.db2.gz JDWWHJGRLXSXMU-HXUWFJFHSA-N 0 3 400.592 4.087 20 0 HIADHN C[C@@H](Cc1ccc(O)cc1)NC(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1 ZINC000514183117 922522053 /nfs/dbraw/zinc/52/20/53/922522053.db2.gz RVLDAWRJPJTYNY-PXNSSMCTSA-N 0 3 401.576 4.157 20 0 HIADHN CCc1ccc([C@H](CNC(=O)NC[C@H]2CCCO[C@@H]2c2ccccc2)N(C)C)cc1 ZINC000514197667 922535050 /nfs/dbraw/zinc/53/50/50/922535050.db2.gz RCNJZXPSZKHTDB-TZRRMPRUSA-N 0 3 409.574 4.319 20 0 HIADHN C[C@H](NC(=O)N[C@H](CN1CCCC1)c1ccccc1)c1cccc(N2CCCC2=O)c1 ZINC000514207002 922543798 /nfs/dbraw/zinc/54/37/98/922543798.db2.gz XWMBMYKGRDTMKK-WMZHIEFXSA-N 0 3 420.557 4.011 20 0 HIADHN CC1CCN(CCNC(=O)N(C)CCCCCc2cc(-c3ccccc3)no2)CC1 ZINC000514216099 922550690 /nfs/dbraw/zinc/55/06/90/922550690.db2.gz YUFFLMNJRJOFEL-UHFFFAOYSA-N 0 3 412.578 4.428 20 0 HIADHN C[C@@H](Oc1ccc(C(=O)Nc2cccc(CN3CC[C@@H](O)C3)c2)cn1)c1ccccc1 ZINC000562377989 945067061 /nfs/dbraw/zinc/06/70/61/945067061.db2.gz WHXAHEMTQKDOFS-WZONZLPQSA-N 0 3 417.509 4.041 20 0 HIADHN Cc1ccc(-c2ccc(C(=O)Nc3ccccc3CN3CCC[C@@H](C(N)=O)C3)s2)o1 ZINC000514226647 922562191 /nfs/dbraw/zinc/56/21/91/922562191.db2.gz KXPQZCIZUPBXOS-QGZVFWFLSA-N 0 3 423.538 4.266 20 0 HIADHN O=C(Nc1ccc(Br)cn1)[C@@H]1CCCN(C/C=C\c2ccccc2)C1 ZINC000514231361 922569299 /nfs/dbraw/zinc/56/92/99/922569299.db2.gz WUUCPMTUEJJOOS-RLXIPRIJSA-N 0 3 400.320 4.208 20 0 HIADHN Cc1ccc(-c2ccc(C(=O)Nc3ccc4oc(=O)n(CCN(C)C)c4c3)s2)o1 ZINC000514234290 922572580 /nfs/dbraw/zinc/57/25/80/922572580.db2.gz MKRTYADZDGSYET-UHFFFAOYSA-N 0 3 411.483 4.038 20 0 HIADHN CC(C)n1ncc2c1nc(C1CC1)cc2C(=O)NC[C@H](c1ccccc1)N1CCCC1 ZINC000514317695 922597293 /nfs/dbraw/zinc/59/72/93/922597293.db2.gz YALPGYKVXUJRET-HSZRJFAPSA-N 0 3 417.557 4.457 20 0 HIADHN CN(C)[C@@H](CNC(=O)NC[C@@H](c1ccccc1Cl)N1CCCC1)c1ccsc1 ZINC000514458361 922635755 /nfs/dbraw/zinc/63/57/55/922635755.db2.gz NQUNHZPMYNVVAS-PMACEKPBSA-N 0 3 421.010 4.141 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)c2ccc(NC(=O)c3cccs3)cc2)CC1 ZINC000514525584 922675864 /nfs/dbraw/zinc/67/58/64/922675864.db2.gz PCBDTMICHHVLLO-UHFFFAOYSA-N 0 3 423.538 4.330 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)N(Cc2cccs2)C[C@@H]2CCCO2)N(C)C)cc1 ZINC000514564149 922702130 /nfs/dbraw/zinc/70/21/30/922702130.db2.gz ADSRKPUHXDMTDJ-RBBKRZOGSA-N 0 3 415.603 4.304 20 0 HIADHN C[C@@H](c1ccc(F)cc1)N1CCC[C@H](NCc2ccc(OCC(F)F)cc2)C1=O ZINC000514680855 922750592 /nfs/dbraw/zinc/75/05/92/922750592.db2.gz KSZWAHCGDFOIPN-YWZLYKJASA-N 0 3 406.448 4.311 20 0 HIADHN CN1CC[C@H](NCC(=O)Nc2ccccc2Br)[C@@H]1c1ccc(Cl)cc1 ZINC000514693830 922759327 /nfs/dbraw/zinc/75/93/27/922759327.db2.gz ACZXLVHOIRIRCD-HKUYNNGSSA-N 0 3 422.754 4.076 20 0 HIADHN C[C@@H](N[C@H]1c2ccccc2CC12CCOCC2)C(=O)Nc1ccc(-c2c[nH]cn2)cc1 ZINC000514694651 922761394 /nfs/dbraw/zinc/76/13/94/922761394.db2.gz GQRLGTADPPOHEW-HXOBKFHXSA-N 0 3 416.525 4.088 20 0 HIADHN C[C@@H](NCC(=O)Nc1ccc(CN2CCOCC2)cc1)c1ccc(F)c2ccccc21 ZINC000514753655 922783347 /nfs/dbraw/zinc/78/33/47/922783347.db2.gz HUGRQPJSSCAMNE-GOSISDBHSA-N 0 3 421.516 4.100 20 0 HIADHN CC(C)CN1CCN(C[C@H](O)COc2ccc(C(C)(C)c3ccccc3)cc2)CC1 ZINC000514858373 922825355 /nfs/dbraw/zinc/82/53/55/922825355.db2.gz IDFOEJFUHNGCLM-DEOSSOPVSA-N 0 3 410.602 4.026 20 0 HIADHN CC(C)CN1CCN(C[C@@H](O)COc2ccc(C(C)(C)c3ccccc3)cc2)CC1 ZINC000514858378 922825757 /nfs/dbraw/zinc/82/57/57/922825757.db2.gz IDFOEJFUHNGCLM-XMMPIXPASA-N 0 3 410.602 4.026 20 0 HIADHN COc1ccc(OC)c([C@@H]2CCCN2C(=O)CN2CCC[C@H]2Cc2ccccc2)c1 ZINC000514944279 922849652 /nfs/dbraw/zinc/84/96/52/922849652.db2.gz OCFGRJWFQACGHL-REWPJTCUSA-N 0 3 408.542 4.074 20 0 HIADHN CCOc1c(OC)cc(CN2CCC[C@H](c3nc(-c4ccccc4)n[nH]3)C2)cc1OC ZINC000515009293 922875329 /nfs/dbraw/zinc/87/53/29/922875329.db2.gz VPGIQCXHURWWEW-IBGZPJMESA-N 0 3 422.529 4.267 20 0 HIADHN COC(=O)c1cc2cc(NC(=O)NC[C@H](c3ccccc3)N3CCCC3)ccc2o1 ZINC000515136901 922945619 /nfs/dbraw/zinc/94/56/19/922945619.db2.gz UWSRYYHLUDSECQ-LJQANCHMSA-N 0 3 407.470 4.178 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc(CN[C@@H]2CCCc3c4ccccc4[nH]c32)cc1 ZINC000515304671 923042347 /nfs/dbraw/zinc/04/23/47/923042347.db2.gz RPTZWCMASLMSGO-JOCHJYFZSA-N 0 3 411.571 4.366 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCCCO[C@@H](C)c3ccccc3)c(C)c2)CC1 ZINC000515385494 923074780 /nfs/dbraw/zinc/07/47/80/923074780.db2.gz VIOCJOZVFQNEPU-NRFANRHFSA-N 0 3 424.589 4.426 20 0 HIADHN CN(C(=O)NCCCN1CCN(C)C[C@H]1c1ccccc1)[C@@H]1CCCc2ccccc21 ZINC000515465592 923119950 /nfs/dbraw/zinc/11/99/50/923119950.db2.gz VGBQTQBRRLMEIY-RPBOFIJWSA-N 0 3 420.601 4.084 20 0 HIADHN CC(C)c1nc2cc(NC(=O)c3ccc(CN4CCC(CO)CC4)cc3)ccc2o1 ZINC000515475542 923123759 /nfs/dbraw/zinc/12/37/59/923123759.db2.gz QJTSNRYAVKVGNW-UHFFFAOYSA-N 0 3 407.514 4.408 20 0 HIADHN CCc1c(C(=O)NC[C@H](c2cccc(OC)c2)N(CC)CC)cnn1C(C)(C)C ZINC000515528408 923157134 /nfs/dbraw/zinc/15/71/34/923157134.db2.gz FQYGOQMTVSJGHS-OAQYLSRUSA-N 0 3 400.567 4.022 20 0 HIADHN C[C@H](N[C@@H](Cc1ccc(C(F)(F)F)cc1)C(N)=O)c1ccc(C(F)(F)F)cc1 ZINC000515559365 923177458 /nfs/dbraw/zinc/17/74/58/923177458.db2.gz OYKOBADCCLZFSW-ZBEGNZNMSA-N 0 3 404.354 4.471 20 0 HIADHN Cc1cc(Br)cn2c(CN[C@@H](c3ccccc3)C(C)(C)CO)cnc12 ZINC000515710710 923293980 /nfs/dbraw/zinc/29/39/80/923293980.db2.gz YFOJCZIWIXMEOF-SFHVURJKSA-N 0 3 402.336 4.255 20 0 HIADHN CN(C(=O)CN1CCN(CCC(C)(C)C)CC1)C(c1ccccc1)c1ccccc1 ZINC000515743869 923316533 /nfs/dbraw/zinc/31/65/33/923316533.db2.gz MOOBEJWPFYLIDM-UHFFFAOYSA-N 0 3 407.602 4.288 20 0 HIADHN CC(C)CNC(=O)c1ccc(NC(=O)N2CCN(CCC(C)(C)C)CC2)cc1Cl ZINC000515796843 923354694 /nfs/dbraw/zinc/35/46/94/923354694.db2.gz SRNMBPVCHJSYAA-UHFFFAOYSA-N 0 3 423.001 4.312 20 0 HIADHN Cc1ccc([C@H]2CCCN2C(=O)NCCCCN2CCN(c3ccccc3)CC2)cc1 ZINC000515903408 923421189 /nfs/dbraw/zinc/42/11/89/923421189.db2.gz JWCUKGKEZJFFJW-RUZDIDTESA-N 0 3 420.601 4.444 20 0 HIADHN CN(C)Cc1cccc(NC(=O)c2nc(-c3cccs3)n(-c3cccc(F)c3)n2)c1 ZINC000516071273 923527716 /nfs/dbraw/zinc/52/77/16/923527716.db2.gz DFSCDZWDKRZILD-UHFFFAOYSA-N 0 3 421.501 4.449 20 0 HIADHN COC(=O)c1ccc(CN[C@@H]2CCO[C@@H](c3ccc(F)cc3)C2)c(Br)c1 ZINC000516076572 923530690 /nfs/dbraw/zinc/53/06/90/923530690.db2.gz OFFLYBVWKWCWND-IEBWSBKVSA-N 0 3 422.294 4.385 20 0 HIADHN Cc1ccc2cc(CNc3ccc(C(=O)N(C)[C@H]4CCCN(C)C4)cc3)ccc2n1 ZINC000516098716 923541545 /nfs/dbraw/zinc/54/15/45/923541545.db2.gz XRKXMNBQAUQPSF-QHCPKHFHSA-N 0 3 402.542 4.322 20 0 HIADHN COCCN(Cc1cccs1)C(=O)NC[C@@H](c1ccccc1)N1CCC(C)CC1 ZINC000516154316 923579414 /nfs/dbraw/zinc/57/94/14/923579414.db2.gz YLZIANDFPMMNOB-QFIPXVFZSA-N 0 3 415.603 4.379 20 0 HIADHN O=C(N[C@H]1CCN(Cc2ccccc2)C1)N(CCc1ccccc1)Cc1cccnc1 ZINC000516159448 923580024 /nfs/dbraw/zinc/58/00/24/923580024.db2.gz XYOFPZLWVNSQKM-VWLOTQADSA-N 0 3 414.553 4.110 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)NCc2ccnc(OC3CCCC3)c2)C1 ZINC000516163825 923582676 /nfs/dbraw/zinc/58/26/76/923582676.db2.gz ZFMXPJQDNOGMIU-GHTZIAJQSA-N 0 3 408.546 4.038 20 0 HIADHN Cc1nc(-c2ccc(CNC(=O)NCCN(C)Cc3ccccc3)s2)cs1 ZINC000516182512 923589098 /nfs/dbraw/zinc/58/90/98/923589098.db2.gz GUIMZTKWNDANPR-UHFFFAOYSA-N 0 3 400.573 4.111 20 0 HIADHN O=C(Nc1ccc(Cl)cc1OCC(F)F)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000516231207 923618450 /nfs/dbraw/zinc/61/84/50/923618450.db2.gz OUEJOOIEUQRHBC-HNNXBMFYSA-N 0 3 409.864 4.230 20 0 HIADHN C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000516437367 923732468 /nfs/dbraw/zinc/73/24/68/923732468.db2.gz CNFLASWUIVBORU-PVAVHDDUSA-N 0 3 404.423 4.333 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3c(C)nn(-c4ccc(Br)cc4)c3C)C2)c1 ZINC000516609283 923815612 /nfs/dbraw/zinc/81/56/12/923815612.db2.gz DXOPVUDEPHFPAY-IBGZPJMESA-N 0 3 414.351 4.204 20 0 HIADHN COc1ccc([C@@H](NC(=O)N2CCN(C3CCCC3)CC2)c2ccc(C)cc2)cc1 ZINC000516704453 923854823 /nfs/dbraw/zinc/85/48/23/923854823.db2.gz JZJQPWDQGOZLMJ-DEOSSOPVSA-N 0 3 407.558 4.363 20 0 HIADHN CN(C)[C@H](CNC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1)c1ccccc1Cl ZINC000516767649 923881974 /nfs/dbraw/zinc/88/19/74/923881974.db2.gz XZSNSNPNKCFFLR-PGRDOPGGSA-N 0 3 417.956 4.110 20 0 HIADHN C[C@H]1[C@@H](NC(=O)N2CCC(Nc3ccc(F)cc3)CC2)CCN1Cc1ccccc1 ZINC000516989901 923954494 /nfs/dbraw/zinc/95/44/94/923954494.db2.gz SSPLUKXPRYTSOI-MBSDFSHPSA-N 0 3 410.537 4.075 20 0 HIADHN O=C(CN1CCC(C2CCOCC2)CC1)N(Cc1ccc(C(F)(F)F)cc1)C1CC1 ZINC000517069597 923984391 /nfs/dbraw/zinc/98/43/91/923984391.db2.gz CYUHRCXKQDDEJL-UHFFFAOYSA-N 0 3 424.507 4.335 20 0 HIADHN CN(C)CCN(C[C@H]1CCCO1)C(=O)c1ccc(Oc2cccc(Cl)c2)cc1 ZINC000517085208 923988107 /nfs/dbraw/zinc/98/81/07/923988107.db2.gz VXZXSOKMFSAGCC-OAQYLSRUSA-N 0 3 402.922 4.315 20 0 HIADHN C[C@H](CNC(=O)CSc1nnc(-c2ccc3ccccc3c2)o1)N1CCC[C@H](C)C1 ZINC000517090326 923991611 /nfs/dbraw/zinc/99/16/11/923991611.db2.gz LUNUKTACYPPYCR-DLBZAZTESA-N 0 3 424.570 4.219 20 0 HIADHN CN(C(=O)N[C@@H](c1ccccc1)C1CCC1)C1CCN(CCc2ccccn2)CC1 ZINC000517144569 924023270 /nfs/dbraw/zinc/02/32/70/924023270.db2.gz OHWFRGSYFDETMI-DEOSSOPVSA-N 0 3 406.574 4.271 20 0 HIADHN CC(C)c1noc(-c2ccccc2C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)n1 ZINC000517163301 924032621 /nfs/dbraw/zinc/03/26/21/924032621.db2.gz UODYWNPTRRCJJF-LJQANCHMSA-N 0 3 404.514 4.254 20 0 HIADHN CC(=O)Nc1ccc(F)c(NC(=O)NC[C@@H](c2ccccc2)N2CCC(C)CC2)c1 ZINC000517309637 924094224 /nfs/dbraw/zinc/09/42/24/924094224.db2.gz HUQBANPVRSUPKN-QFIPXVFZSA-N 0 3 412.509 4.379 20 0 HIADHN CC(=O)Nc1ccc(F)c(NC(=O)NC[C@H](c2ccccc2)N2CCC(C)CC2)c1 ZINC000517309634 924094374 /nfs/dbraw/zinc/09/43/74/924094374.db2.gz HUQBANPVRSUPKN-JOCHJYFZSA-N 0 3 412.509 4.379 20 0 HIADHN CCN(Cc1ccc(Cl)c(Cl)c1)C(=O)C(=O)Nc1cccc(CN(C)C)c1 ZINC000517321709 924100246 /nfs/dbraw/zinc/10/02/46/924100246.db2.gz CSZGZAFPNOYXBT-UHFFFAOYSA-N 0 3 408.329 4.042 20 0 HIADHN COC1CCN(C(C)(C)CNC(=O)c2ccc(-c3nc4ccccc4s3)o2)CC1 ZINC000517407391 924161265 /nfs/dbraw/zinc/16/12/65/924161265.db2.gz WFFOUZCREYIPQE-UHFFFAOYSA-N 0 3 413.543 4.176 20 0 HIADHN Cc1nc(C)c(CCNC(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)s1 ZINC000517450590 924197995 /nfs/dbraw/zinc/19/79/95/924197995.db2.gz IULBYPJCIGAKGH-QGZVFWFLSA-N 0 3 406.621 4.136 20 0 HIADHN Cc1noc(C[C@H](NC[C@@H](O)CO[C@@H](C)c2ccc(Cl)cc2)c2ccccc2)n1 ZINC000517476553 924218036 /nfs/dbraw/zinc/21/80/36/924218036.db2.gz DQNPCIHXQSBDNX-RVHYNSKXSA-N 0 3 415.921 4.044 20 0 HIADHN CN(C)CCn1c2cc(NC(=O)[C@H]3C[C@H]3c3ccc4ccccc4c3)ccc2oc1=O ZINC000517487053 924225278 /nfs/dbraw/zinc/22/52/78/924225278.db2.gz FWFWWNLTBMTLPI-SFTDATJTSA-N 0 3 415.493 4.052 20 0 HIADHN COCCN1CCC(NC(=O)Nc2ccc(Sc3nc(C)cs3)cc2C)CC1 ZINC000517504331 924234135 /nfs/dbraw/zinc/23/41/35/924234135.db2.gz REEWTFPDIIAJQA-UHFFFAOYSA-N 0 3 420.604 4.143 20 0 HIADHN COc1cc(CN[C@@H]2CCc3cc(C)ccc32)cc(I)c1OC ZINC000517549306 924259541 /nfs/dbraw/zinc/25/95/41/924259541.db2.gz FYJDHUOXWWESAF-QGZVFWFLSA-N 0 3 423.294 4.394 20 0 HIADHN CCN(C(=O)CCCN1CCN(c2ccccc2)CC1)[C@H](C)Cc1ccc(OC)cc1 ZINC000517646200 926754323 /nfs/dbraw/zinc/75/43/23/926754323.db2.gz SYEMDYIDQOVMKE-JOCHJYFZSA-N 0 3 423.601 4.077 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1C(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000517649823 926757981 /nfs/dbraw/zinc/75/79/81/926757981.db2.gz ZNMBTTHPEQKMFC-AUSIDOKSSA-N 0 3 402.542 4.114 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)c(C)c1CC(=O)NC[C@@H](C)N(C)Cc1ccccc1 ZINC000517659057 926766940 /nfs/dbraw/zinc/76/69/40/926766940.db2.gz URSPEPVGGJCAIO-QGZVFWFLSA-N 0 3 424.976 4.322 20 0 HIADHN CCN1CCCC[C@H]1CNC(=O)c1cnn(-c2cccc(C(F)(F)F)c2)c1C1CC1 ZINC000517675508 926780280 /nfs/dbraw/zinc/78/02/80/926780280.db2.gz RJIATXHAHUKSEB-SFHVURJKSA-N 0 3 420.479 4.373 20 0 HIADHN Cc1ccc(C)c(OC2CCN(C(=O)NCCCN3CCc4ccccc4C3)CC2)c1 ZINC000517679284 926785052 /nfs/dbraw/zinc/78/50/52/926785052.db2.gz SPUIJZVGWTUBKT-UHFFFAOYSA-N 0 3 421.585 4.305 20 0 HIADHN Cc1ccc(-c2cc(C(=O)N(C)[C@@H]3CCN(C4CC4)C3)c3cnn(C(C)C)c3n2)cc1 ZINC000517693624 926798182 /nfs/dbraw/zinc/79/81/82/926798182.db2.gz VDWYCOSMHJQOQF-HXUWFJFHSA-N 0 3 417.557 4.296 20 0 HIADHN CN(Cc1csc(Br)c1)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000517776673 926832109 /nfs/dbraw/zinc/83/21/09/926832109.db2.gz LXTQKMCOYGPVHB-KRWDZBQOSA-N 0 3 422.392 4.317 20 0 HIADHN CN(CCCCN1C(=O)c2ccccc2C1=O)Cc1csc(Br)c1 ZINC000517862435 926867793 /nfs/dbraw/zinc/86/77/93/926867793.db2.gz YGEAKEWHEFPCLB-UHFFFAOYSA-N 0 3 407.333 4.019 20 0 HIADHN Cc1ccc(CCC2CCN(C(=O)[C@@H]3CCCN(Cc4cccnc4)C3)CC2)cc1 ZINC000517896238 926880170 /nfs/dbraw/zinc/88/01/70/926880170.db2.gz DRWIJZSJRFYTGB-RUZDIDTESA-N 0 3 405.586 4.473 20 0 HIADHN O=C(Nc1ccc2c(c1)OC1(CCCCC1)O2)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000517897233 926880567 /nfs/dbraw/zinc/88/05/67/926880567.db2.gz WTWCUBWUFOFEJG-IBGZPJMESA-N 0 3 407.514 4.364 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)[C@@H]1CCO[C@H]1c1ccc(Cl)c(F)c1)c1ccco1 ZINC000517993028 926935009 /nfs/dbraw/zinc/93/50/09/926935009.db2.gz XNGACOMEWNCEKA-NZEZWHPISA-N 0 3 408.901 4.395 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)c1ccc(OC)c(OC2CCCC2)c1)c1ccco1 ZINC000517992891 926936251 /nfs/dbraw/zinc/93/62/51/926936251.db2.gz RNMCUSYSPZNNSJ-VQIMIIECSA-N 0 3 400.519 4.469 20 0 HIADHN COc1cccc([C@@H](CNC(=O)Cc2ccc(OCC(C)C)cc2)N2CCCC2)c1 ZINC000518040640 926978581 /nfs/dbraw/zinc/97/85/81/926978581.db2.gz LOESDRKVFSHYGW-XMMPIXPASA-N 0 3 410.558 4.226 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N[C@@H](C)c3nc(C(C)(C)C)cs3)cc2)CC1 ZINC000518043584 926982719 /nfs/dbraw/zinc/98/27/19/926982719.db2.gz FKNLOKLBRWACOR-KRWDZBQOSA-N 0 3 414.619 4.462 20 0 HIADHN Cc1ccc2oc(C(=O)NCCCCN3CCN(Cc4ccccc4)CC3)cc2c1 ZINC000518066492 927003463 /nfs/dbraw/zinc/00/34/63/927003463.db2.gz RSCXJSPGUXMMQR-UHFFFAOYSA-N 0 3 405.542 4.069 20 0 HIADHN CCOc1cc(-c2ccccc2)sc1C(=O)NCC(C)(C)N1CCC(OC)CC1 ZINC000518081786 927010813 /nfs/dbraw/zinc/01/08/13/927010813.db2.gz XKEXDFPOPYBXJH-UHFFFAOYSA-N 0 3 416.587 4.433 20 0 HIADHN CC[C@@H](CNC(=O)Nc1ccc(C(=O)NC(C)C)cc1C)N1CCc2ccccc2C1 ZINC000518172470 927061355 /nfs/dbraw/zinc/06/13/55/927061355.db2.gz MQHQJEVWYBIJSA-QFIPXVFZSA-N 0 3 422.573 4.092 20 0 HIADHN CC(C)N1CC[C@H](NCc2cc(F)cc3c2OCOC3)[C@H]1c1ccc(F)c(F)c1 ZINC000518221984 927087420 /nfs/dbraw/zinc/08/74/20/927087420.db2.gz LAXMCTFBYQEBSD-LEWJYISDSA-N 0 3 406.448 4.284 20 0 HIADHN Clc1cc(Cl)c2c(c1)C=C(CNCc1ccccc1N1CCOCC1)CO2 ZINC000518266404 927125047 /nfs/dbraw/zinc/12/50/47/927125047.db2.gz WMOZHRDUDNXHGG-UHFFFAOYSA-N 0 3 405.325 4.396 20 0 HIADHN Cc1ccc(COc2ccc(CN[C@H](Cc3ccccc3)C(=O)N(C)C)cc2)cc1 ZINC000518284367 927142024 /nfs/dbraw/zinc/14/20/24/927142024.db2.gz JLELPVPDDKADCU-RUZDIDTESA-N 0 3 402.538 4.363 20 0 HIADHN CCOc1ccc(NC(=O)N2CCC(CN3C[C@H](C)O[C@@H](C)C3)CC2)cc1Cl ZINC000518314399 927176663 /nfs/dbraw/zinc/17/66/63/927176663.db2.gz CCNJFCUELHYPAQ-HOTGVXAUSA-N 0 3 409.958 4.092 20 0 HIADHN CC(C)n1ncc2ccc(NC(=O)CCCN3CCN(c4ccccc4)CC3)cc21 ZINC000518378018 927229689 /nfs/dbraw/zinc/22/96/89/927229689.db2.gz SFRTWJYLNLEFBJ-UHFFFAOYSA-N 0 3 405.546 4.158 20 0 HIADHN CSc1ccc([C@@H](CNC(=O)c2ccc(-c3n[nH]c(C4CC4)n3)cc2)N(C)C)cc1 ZINC000518430477 927264439 /nfs/dbraw/zinc/26/44/39/927264439.db2.gz UXGFHNMVGWMKLV-HXUWFJFHSA-N 0 3 421.570 4.104 20 0 HIADHN C[C@H](c1cc(F)ccc1F)N(C)C(=O)CCCN1CCN(c2ccccc2)CC1 ZINC000518442971 927274907 /nfs/dbraw/zinc/27/49/07/927274907.db2.gz FWRWSYAIBDCXFR-GOSISDBHSA-N 0 3 401.501 4.087 20 0 HIADHN CCN(C)[C@@H](C(=O)NCC1CCN(Cc2ccccc2Cl)CC1)c1ccccc1 ZINC000518587753 927365110 /nfs/dbraw/zinc/36/51/10/927365110.db2.gz BMJDMSHVWXFGMZ-HSZRJFAPSA-N 0 3 413.993 4.361 20 0 HIADHN C[C@H](NC(=O)NC[C@H](c1ccccc1)N(C)C)c1ccc(OCC(F)(F)F)cc1 ZINC000518629247 927388808 /nfs/dbraw/zinc/38/88/08/927388808.db2.gz RPKPQGUIODIMDP-HNAYVOBHSA-N 0 3 409.452 4.291 20 0 HIADHN C[C@@H](NC(=O)NC[C@H](c1ccccc1)N(C)C)c1ccc(OCC(F)(F)F)cc1 ZINC000518629246 927389543 /nfs/dbraw/zinc/38/95/43/927389543.db2.gz RPKPQGUIODIMDP-DNVCBOLYSA-N 0 3 409.452 4.291 20 0 HIADHN COc1ccc([C@@H](CNC(=O)NCCCc2c[nH]c3ccccc23)N2CCCC2)cc1 ZINC000518630581 927390716 /nfs/dbraw/zinc/39/07/16/927390716.db2.gz QBDRDYNZFOYDID-XMMPIXPASA-N 0 3 420.557 4.245 20 0 HIADHN Cc1ccc2sc(C(=O)Nc3ccccc3CN3CCC[C@@H](C(N)=O)C3)cc2c1 ZINC000518699538 927440991 /nfs/dbraw/zinc/44/09/91/927440991.db2.gz YUIMJYQKLJCXLP-QGZVFWFLSA-N 0 3 407.539 4.159 20 0 HIADHN COc1ccc([C@@H](CNC(=O)CCOc2ccc(F)c(Cl)c2)N2CCCC2)cc1 ZINC000518731449 927461679 /nfs/dbraw/zinc/46/16/79/927461679.db2.gz ZCDJIOVHNWMZAV-OAQYLSRUSA-N 0 3 420.912 4.210 20 0 HIADHN C[C@@H]1CN([C@@H](CNCC2=Cc3ccccc3OC2)c2c(F)cccc2Cl)CCO1 ZINC000518765550 927483269 /nfs/dbraw/zinc/48/32/69/927483269.db2.gz LMRGWGGIUNWTSK-IERDGZPVSA-N 0 3 416.924 4.307 20 0 HIADHN CC(C)NS(=O)(=O)CCNCc1ccc(-c2ccc(Cl)c(Cl)c2)s1 ZINC000518774370 927486870 /nfs/dbraw/zinc/48/68/70/927486870.db2.gz COEQODBUZJUIOL-UHFFFAOYSA-N 0 3 407.388 4.139 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CNCCNc1ccc(-c2ccccc2)nn1 ZINC000518785243 927489916 /nfs/dbraw/zinc/48/99/16/927489916.db2.gz UHSCWMXECKPDRQ-UHFFFAOYSA-N 0 3 412.541 4.207 20 0 HIADHN NC(=O)C1CCN(Cc2cccc(NC(=O)CCCCCc3cccs3)c2)CC1 ZINC000518803807 927502139 /nfs/dbraw/zinc/50/21/39/927502139.db2.gz HWUIFCCXGZWLNV-UHFFFAOYSA-N 0 3 413.587 4.187 20 0 HIADHN Cc1cc(C)n(-c2cccc(NC(=O)CCCN3CCN(c4ccccc4)CC3)c2)n1 ZINC000518882166 927595570 /nfs/dbraw/zinc/59/55/70/927595570.db2.gz HVQOLJNFNYEXSG-UHFFFAOYSA-N 0 3 417.557 4.030 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1ccc(NC(N)=O)cc1)c1ccc(C(F)(F)F)cc1 ZINC000518890778 927602083 /nfs/dbraw/zinc/60/20/83/927602083.db2.gz GCTSEWPFVQLCIF-SFHVURJKSA-N 0 3 422.451 4.009 20 0 HIADHN CC(C)CCOC1CCN(C(=O)[C@H](C)N2CCC(Cc3ccccc3)CC2)CC1 ZINC000518920441 927628360 /nfs/dbraw/zinc/62/83/60/927628360.db2.gz YBJCZSZPRTZWGH-NRFANRHFSA-N 0 3 400.607 4.383 20 0 HIADHN CC(C)c1cccc(O[C@@H](C(=O)N(C)CCCN2CCN(C)CC2)c2ccccc2)c1 ZINC000518948487 927648999 /nfs/dbraw/zinc/64/89/99/927648999.db2.gz NGKZMKVDHNMRBZ-RUZDIDTESA-N 0 3 423.601 4.026 20 0 HIADHN CC[C@H](CNC(=O)NCc1ccccc1COC(C)C)N1CCc2ccccc2C1 ZINC000518985033 927676065 /nfs/dbraw/zinc/67/60/65/927676065.db2.gz XADOBPQOGNOPIY-XMMPIXPASA-N 0 3 409.574 4.248 20 0 HIADHN CSc1ccc([C@@H](CNC(=O)c2cnc3onc(C(C)(C)C)c3c2)N(C)C)cc1 ZINC000519024252 927699830 /nfs/dbraw/zinc/69/98/30/927699830.db2.gz HZOGLUDEUGCLLT-GOSISDBHSA-N 0 3 412.559 4.275 20 0 HIADHN O=C(c1ccc(-n2cccc2)c(F)c1)N1CCCN(CCCc2ccccc2)CC1 ZINC000519099383 927769501 /nfs/dbraw/zinc/76/95/01/927769501.db2.gz QQUBBXQVTLISHW-UHFFFAOYSA-N 0 3 405.517 4.397 20 0 HIADHN COCCN(CCN(C)C)C(=O)N[C@@H](c1cccc(C(F)(F)F)c1)C(C)(C)C ZINC000519206947 927828523 /nfs/dbraw/zinc/82/85/23/927828523.db2.gz GHEOLADPVSLGQB-KRWDZBQOSA-N 0 3 403.489 4.012 20 0 HIADHN CC(C)n1ncc2ccc(NC(=O)N(C)C3CCN(CCc4ccccn4)CC3)cc21 ZINC000519256783 927850535 /nfs/dbraw/zinc/85/05/35/927850535.db2.gz OPFHHYVLXWEVNV-UHFFFAOYSA-N 0 3 420.561 4.183 20 0 HIADHN Cc1sc2ncnc(SCC(=O)NC[C@H](c3ccc(C)cc3)N(C)C)c2c1C ZINC000519281176 927862492 /nfs/dbraw/zinc/86/24/92/927862492.db2.gz AHUXULQNYZMTMM-QGZVFWFLSA-N 0 3 414.600 4.128 20 0 HIADHN CC[C@H](CNC(=O)N(C)[C@H](C)c1sc(C)nc1C)N1CCc2ccccc2C1 ZINC000519293813 927866447 /nfs/dbraw/zinc/86/64/47/927866447.db2.gz RNGJDQKBSNSSPQ-OXQOHEQNSA-N 0 3 400.592 4.299 20 0 HIADHN COc1ccc2oc([C@H](C)NC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)c(C)c2c1 ZINC000519294731 927867390 /nfs/dbraw/zinc/86/73/90/927867390.db2.gz JVBOFMIZGSBWCC-PKOBYXMFSA-N 0 3 407.514 4.385 20 0 HIADHN Cc1c([C@H](C)NC(=O)NC[C@H](c2ccc(C)cc2)N(C)C)cnn1-c1ccc(F)cc1 ZINC000519342656 927889709 /nfs/dbraw/zinc/88/97/09/927889709.db2.gz GJAVGDRSUGUJJQ-GAJHUEQPSA-N 0 3 423.536 4.291 20 0 HIADHN COc1cccc([C@H](CNC(=O)NCCCc2c[nH]c3ccccc23)N2CCCC2)c1 ZINC000519379098 927904386 /nfs/dbraw/zinc/90/43/86/927904386.db2.gz MSEKCJAHHXAQES-DEOSSOPVSA-N 0 3 420.557 4.245 20 0 HIADHN C[C@@H]1CCC[C@H](C)N1CCNC(=O)N1CCC(C(=O)c2ccc(Cl)cc2)CC1 ZINC000519388542 927915828 /nfs/dbraw/zinc/91/58/28/927915828.db2.gz SAYNNOFDLRRQMA-CALCHBBNSA-N 0 3 405.970 4.207 20 0 HIADHN Cc1sccc1CNCC(C)(C)S(=O)(=O)c1ccc(Br)cc1 ZINC000519432415 927943999 /nfs/dbraw/zinc/94/39/99/927943999.db2.gz PAIGARCWRGZGRB-UHFFFAOYSA-N 0 3 402.379 4.161 20 0 HIADHN COc1ccc(C)cc1NC(=O)[C@H](C)N[C@@H]1CCN(C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000519481340 927979656 /nfs/dbraw/zinc/97/96/56/927979656.db2.gz IQROQBHCCJIEAU-FIKMYACPSA-N 0 3 419.928 4.158 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)Nc1ccc(Br)cc1F ZINC000519505574 927998257 /nfs/dbraw/zinc/99/82/57/927998257.db2.gz DGMLXEDCBRFMPW-UHFFFAOYSA-N 0 3 412.278 4.323 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1C(=O)NC[C@@H](c1ccc(OC(C)C)cc1)N(C)C ZINC000519562682 928017829 /nfs/dbraw/zinc/01/78/29/928017829.db2.gz LOHFMFJPRFYNAG-QHCPKHFHSA-N 0 3 420.557 4.309 20 0 HIADHN CN(C)C(=O)COc1cccc(CN[C@@H](c2cccc(OC(F)(F)F)c2)C2CC2)c1 ZINC000519634196 928034252 /nfs/dbraw/zinc/03/42/52/928034252.db2.gz JGJTURORQXAGHX-OAQYLSRUSA-N 0 3 422.447 4.293 20 0 HIADHN COc1cc(CN2CCC[C@@H](c3nc4c(s3)CCCC4)C2)cc(OC)c1OC ZINC000519663839 928039562 /nfs/dbraw/zinc/03/95/62/928039562.db2.gz QEONHYHTRRLBRT-MRXNPFEDSA-N 0 3 402.560 4.427 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@@H](O)C2)c1)c1ccccc1COc1ccccc1 ZINC000519821366 928085770 /nfs/dbraw/zinc/08/57/70/928085770.db2.gz DVJGYHZGQOOFPJ-JOCHJYFZSA-N 0 3 402.494 4.085 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3sc(C(C)(C)OC)nc3C)c(C)c2)CC1 ZINC000519858830 928100048 /nfs/dbraw/zinc/10/00/48/928100048.db2.gz NDUNFWBXPCKYEF-UHFFFAOYSA-N 0 3 416.591 4.036 20 0 HIADHN COc1ccccc1C[C@H]1CCCN1C(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000519924390 928156321 /nfs/dbraw/zinc/15/63/21/928156321.db2.gz LFPGADICZKIPHM-UXHICEINSA-N 0 3 413.587 4.310 20 0 HIADHN COc1ccccc1C[C@@H]1CCCN1C(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000519924391 928157249 /nfs/dbraw/zinc/15/72/49/928157249.db2.gz LFPGADICZKIPHM-VQTJNVASSA-N 0 3 413.587 4.310 20 0 HIADHN CCCCO[C@@H](C)C(=O)Nc1sc2c(c1C(=O)OCC)CC(C)(C)NC2(C)C ZINC000519956793 928187343 /nfs/dbraw/zinc/18/73/43/928187343.db2.gz AFWOEIGIEBFIGT-ZDUSSCGKSA-N 0 3 410.580 4.228 20 0 HIADHN CC[C@@H](C)NC(=O)c1ccc(NC(=O)NCCCN2CCc3ccccc3C2)c(C)c1 ZINC000519987495 928213181 /nfs/dbraw/zinc/21/31/81/928213181.db2.gz CAAYWRZCYSAXCQ-LJQANCHMSA-N 0 3 422.573 4.093 20 0 HIADHN CCOc1cc2c(cc1NC(=O)NC[C@@H](c1cccs1)N1CCCC1)O[C@@H](C)C2 ZINC000520048882 928274527 /nfs/dbraw/zinc/27/45/27/928274527.db2.gz XIMJKQHDZLRYDG-YJBOKZPZSA-N 0 3 415.559 4.429 20 0 HIADHN Cc1cc(C)n(-c2ccc(NC(=O)NC[C@@H](c3ccc(C)cc3)N(C)C)cc2F)n1 ZINC000520054192 928279601 /nfs/dbraw/zinc/27/96/01/928279601.db2.gz WAYNCIJAKMXPKX-QFIPXVFZSA-N 0 3 409.509 4.361 20 0 HIADHN CCC(=O)Nc1ccc(Cl)c(NC(=O)NC[C@@H](c2ccc(C)cc2)N(C)C)c1 ZINC000520054848 928280236 /nfs/dbraw/zinc/28/02/36/928280236.db2.gz STLFVLDQRZVPQB-IBGZPJMESA-N 0 3 402.926 4.421 20 0 HIADHN O=C(Nc1ccccc1OC[C@@H]1CCCCO1)N1CCN(CC2CCCCC2)CC1 ZINC000520055711 928280389 /nfs/dbraw/zinc/28/03/89/928280389.db2.gz RWTCIYAWBXGQPL-NRFANRHFSA-N 0 3 415.578 4.364 20 0 HIADHN CCOc1ccc([C@H](C)NC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)cc1OC ZINC000520093202 928305407 /nfs/dbraw/zinc/30/54/07/928305407.db2.gz ONIFYVXOHNWPIM-PXNSSMCTSA-N 0 3 414.521 4.322 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)N[C@H](c1ccccc1)c1ccccn1 ZINC000520127814 928325327 /nfs/dbraw/zinc/32/53/27/928325327.db2.gz DBEKXJSAXPIXSH-HSZRJFAPSA-N 0 3 406.505 4.084 20 0 HIADHN Cc1ccc(Cn2cc(C(=O)N[C@H]3CCN(C4CC4)C3)c(-c3ccc(C)cc3)n2)cc1 ZINC000520184922 928373736 /nfs/dbraw/zinc/37/37/36/928373736.db2.gz WEFLSABZRICBDW-QFIPXVFZSA-N 0 3 414.553 4.182 20 0 HIADHN O=C1C[C@@H](NCc2cccc(OCc3ccccn3)c2)CN1c1ccccc1Cl ZINC000520227192 928400290 /nfs/dbraw/zinc/40/02/90/928400290.db2.gz JZMALKXKBDZRIA-LJQANCHMSA-N 0 3 407.901 4.209 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)Cc2cn3cc(Cl)cc(Cl)c3n2)c1 ZINC000520352358 928514615 /nfs/dbraw/zinc/51/46/15/928514615.db2.gz WKVBCEJSCOOGRG-UHFFFAOYSA-N 0 3 419.356 4.082 20 0 HIADHN COc1ccc([C@H](Cc2ccccc2)NCc2ccc(S(=O)(=O)N(C)C)cc2)cc1 ZINC000520463050 928580037 /nfs/dbraw/zinc/58/00/37/928580037.db2.gz NWGFJFYVOKZQDF-DEOSSOPVSA-N 0 3 424.566 4.019 20 0 HIADHN CCCCCc1nnc(NC(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)s1 ZINC000520476116 928588522 /nfs/dbraw/zinc/58/85/22/928588522.db2.gz BPNNSZMKKSVRRY-UHFFFAOYSA-N 0 3 401.580 4.054 20 0 HIADHN COc1ccccc1COC[C@@H](O)CN1CCC[C@@H]1Cc1c(F)cccc1Cl ZINC000520523813 928617625 /nfs/dbraw/zinc/61/76/25/928617625.db2.gz JEUMWOPADVHHFU-MSOLQXFVSA-N 0 3 407.913 4.072 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCCSCC1)c1ccc(C(F)(F)F)cc1 ZINC000520541107 928628483 /nfs/dbraw/zinc/62/84/83/928628483.db2.gz QEIHDENOHZOMPW-QGZVFWFLSA-N 0 3 403.514 4.237 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)NCCOc2ccccc2-c2ccccc2)o1 ZINC000520548194 928634758 /nfs/dbraw/zinc/63/47/58/928634758.db2.gz YCYJCUQEZTWUHX-UHFFFAOYSA-N 0 3 421.541 4.407 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1ccc(Cn2cccn2)cc1)c1cccc(OC)c1 ZINC000520599022 928662661 /nfs/dbraw/zinc/66/26/61/928662661.db2.gz ADYCKVNWRCGYQR-QHCPKHFHSA-N 0 3 421.545 4.145 20 0 HIADHN COc1ccc2c(c1F)CC[C@@H]2N[C@H]1CCCN([C@@H](C)c2ccc(F)cc2)C1=O ZINC000520601742 928666492 /nfs/dbraw/zinc/66/64/92/928666492.db2.gz NWCSSBUIZDQIRW-GKCIPKSASA-N 0 3 400.469 4.303 20 0 HIADHN Cc1ccc([C@H](CNC(=O)NCc2nc(C(C)(C)C)cs2)N2CCCC2)cc1 ZINC000520622097 928681620 /nfs/dbraw/zinc/68/16/20/928681620.db2.gz WTWAOTITBYWEAX-SFHVURJKSA-N 0 3 400.592 4.385 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3ccc(N4CCCC4)c(F)c3)c(C)c2)CC1 ZINC000520726273 928776429 /nfs/dbraw/zinc/77/64/29/928776429.db2.gz KJUDBDYXLYHGME-UHFFFAOYSA-N 0 3 410.537 4.129 20 0 HIADHN Cc1nc(CCC(=O)N2CCCN(Cc3ccccc3)CC2)oc1-c1ccccc1 ZINC000520730257 928780211 /nfs/dbraw/zinc/78/02/11/928780211.db2.gz NMMRXPWMUWGPSW-UHFFFAOYSA-N 0 3 403.526 4.317 20 0 HIADHN COc1cc(OC)c(NC(=O)N(CCCc2ccccc2)CCN(C)C)cc1Cl ZINC000520785260 928816381 /nfs/dbraw/zinc/81/63/81/928816381.db2.gz GTJJGWPFIHSLDN-UHFFFAOYSA-N 0 3 419.953 4.386 20 0 HIADHN COc1cccc(C2(CNC(=O)N(CCN(C)C)Cc3ccc(C)o3)CCCC2)c1 ZINC000520838615 928839090 /nfs/dbraw/zinc/83/90/90/928839090.db2.gz DQJGEIPYVYUWGL-UHFFFAOYSA-N 0 3 413.562 4.182 20 0 HIADHN CCN(CC(=O)N(C)Cc1ccc(SC)cc1)[C@@H](C)Cc1ccc(OC)cc1 ZINC000520938846 928883314 /nfs/dbraw/zinc/88/33/14/928883314.db2.gz DYXRCCFJCBWXQV-SFHVURJKSA-N 0 3 400.588 4.329 20 0 HIADHN O=C(Nc1cccc(Oc2cnccn2)c1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000520952591 928887219 /nfs/dbraw/zinc/88/72/19/928887219.db2.gz XHUALSSRTURNBE-SFHVURJKSA-N 0 3 406.461 4.259 20 0 HIADHN Cc1ccc(NC(=O)C2CC2)cc1NC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000520952433 928887477 /nfs/dbraw/zinc/88/74/77/928887477.db2.gz QXRNARSXALTEHG-IBGZPJMESA-N 0 3 409.505 4.333 20 0 HIADHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)c1cncc2ccccc21 ZINC000520985491 928903834 /nfs/dbraw/zinc/90/38/34/928903834.db2.gz DAFRZFCSGMLAOH-UHFFFAOYSA-N 0 3 412.331 4.201 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)N[C@@H](CN2CCCC2)c2ccccc2)c(Cl)c1 ZINC000520985928 928905177 /nfs/dbraw/zinc/90/51/77/928905177.db2.gz CSIAXCLNFOPLDJ-FQEVSTJZSA-N 0 3 400.910 4.257 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)Nc1ccccc1N(C)C ZINC000521064667 928969056 /nfs/dbraw/zinc/96/90/56/928969056.db2.gz PWVVYBSEYVKICG-UHFFFAOYSA-N 0 3 408.468 4.367 20 0 HIADHN CN(C(=O)CCc1c2cc(F)ccc2[nH]c1-c1ccccc1)[C@@H]1CN2CCC1CC2 ZINC000521156482 929030808 /nfs/dbraw/zinc/03/08/08/929030808.db2.gz QNWBJHZJSWAUCG-HSZRJFAPSA-N 0 3 405.517 4.459 20 0 HIADHN C[C@@H](CNC(=O)N(C)Cc1cc(Br)ccc1F)N(C)Cc1ccccc1 ZINC000521162455 929036001 /nfs/dbraw/zinc/03/60/01/929036001.db2.gz PWXCFIJUNBHLOW-HNNXBMFYSA-N 0 3 422.342 4.250 20 0 HIADHN C[C@H](C1CC1)N(CC(=O)NCC1(c2ccccc2)CCOCC1)Cc1ccccc1 ZINC000521194306 929054620 /nfs/dbraw/zinc/05/46/20/929054620.db2.gz HFWVSZMJKGJGNF-OAQYLSRUSA-N 0 3 406.570 4.152 20 0 HIADHN COc1cccc([C@H](CNC(=O)Nc2ccc3c(c2)OC(C)(C)O3)N2CCCC2)c1 ZINC000521267831 929091683 /nfs/dbraw/zinc/09/16/83/929091683.db2.gz AKYYAVNYNUSMJL-IBGZPJMESA-N 0 3 411.502 4.161 20 0 HIADHN CN(C)Cc1ccccc1CNC(=O)CCCCOc1ccc(Br)cc1 ZINC000521311015 929120900 /nfs/dbraw/zinc/12/09/00/929120900.db2.gz ZZQHPZNWQCUTEV-UHFFFAOYSA-N 0 3 419.363 4.376 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)Nc3cccc(OC(F)(F)F)c3)cc2)CC1 ZINC000521316183 929128912 /nfs/dbraw/zinc/12/89/12/929128912.db2.gz MREZHXSSBMUXDR-UHFFFAOYSA-N 0 3 407.436 4.368 20 0 HIADHN COc1cc(CNCc2ccc3sccc3c2)ccc1OCC(=O)N1CCCC1 ZINC000521418872 929212701 /nfs/dbraw/zinc/21/27/01/929212701.db2.gz PKCDGWUJPARCIZ-UHFFFAOYSA-N 0 3 410.539 4.201 20 0 HIADHN COc1ccc(NC(=O)c2ccc(NC(=O)[C@H](C(C)C)N3CCCCC3)cc2)cc1 ZINC000521440539 929221779 /nfs/dbraw/zinc/22/17/79/929221779.db2.gz LMGCKNKKGBAASN-QFIPXVFZSA-N 0 3 409.530 4.397 20 0 HIADHN CN(CCCOc1ccc(F)cc1)C(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000521452085 929228099 /nfs/dbraw/zinc/22/80/99/929228099.db2.gz WTAYEBXUXOWBQO-IBGZPJMESA-N 0 3 405.539 4.135 20 0 HIADHN CC(C)[C@H](N[C@@H]1CCCc2cc(S(N)(=O)=O)ccc21)c1ccc(Cl)cc1F ZINC000521471463 929236238 /nfs/dbraw/zinc/23/62/38/929236238.db2.gz FPNCUUPISIHMFU-UXHICEINSA-N 0 3 410.942 4.491 20 0 HIADHN COCCN(CCN(C)C)C(=O)c1sc2cc(C(F)(F)F)ccc2c1Cl ZINC000521486536 929246356 /nfs/dbraw/zinc/24/63/56/929246356.db2.gz QYCQWQZECUFDRB-UHFFFAOYSA-N 0 3 408.873 4.224 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)CCc1nc2ccccc2[nH]1 ZINC000521573711 929305407 /nfs/dbraw/zinc/30/54/07/929305407.db2.gz GBFMBELDDLYRGY-UHFFFAOYSA-N 0 3 418.463 4.105 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)N[C@@H]1CCSc2ccc(F)cc21 ZINC000521677430 929360658 /nfs/dbraw/zinc/36/06/58/929360658.db2.gz AKUYGLVWMPHFST-LJQANCHMSA-N 0 3 423.504 4.414 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)N[C@H](c1ccccc1)c1ccccn1 ZINC000521680263 929363283 /nfs/dbraw/zinc/36/32/83/929363283.db2.gz YGRGLZUMDYPHNN-HSZRJFAPSA-N 0 3 424.495 4.223 20 0 HIADHN CCc1ccc(C(=O)Nc2sccc2C(=O)N2CC[C@@H](N3CCCCC3)C2)cc1 ZINC000521688745 929368094 /nfs/dbraw/zinc/36/80/94/929368094.db2.gz HWBFEZIWOJRRFE-LJQANCHMSA-N 0 3 411.571 4.263 20 0 HIADHN CC[C@@H](CNC(=O)c1cn(C)nc1-c1ccccc1Cl)N1CCc2ccccc2C1 ZINC000521748247 929408930 /nfs/dbraw/zinc/40/89/30/929408930.db2.gz BIOHWECPEYJAJT-IBGZPJMESA-N 0 3 422.960 4.307 20 0 HIADHN Cc1ccc(C(=O)N(CCN(C)C)c2ccccc2)cc1NC(=O)c1ccccc1 ZINC000521795403 929455824 /nfs/dbraw/zinc/45/58/24/929455824.db2.gz KUPNMFOPBWMKJD-UHFFFAOYSA-N 0 3 401.510 4.456 20 0 HIADHN COc1cc(CN(C)C(=O)CN(C)CC2CCCC2)ccc1OCc1ccccc1 ZINC000521817885 929475933 /nfs/dbraw/zinc/47/59/33/929475933.db2.gz ZRTBYBCNWSFDQD-UHFFFAOYSA-N 0 3 410.558 4.355 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NCc2csc(-c3ccc4c(c3)OCO4)n2)C1 ZINC000521828135 929482473 /nfs/dbraw/zinc/48/24/73/929482473.db2.gz DEGRSXSMHGNWQH-QFBILLFUSA-N 0 3 407.539 4.464 20 0 HIADHN COc1ccc(OC)c([C@H](C)NC(=O)[C@@H](C)N[C@H](C)c2ccc(OC(C)C)cc2)c1 ZINC000521862071 929513004 /nfs/dbraw/zinc/51/30/04/929513004.db2.gz KFCLWTYIKQPYOQ-FGTMMUONSA-N 0 3 414.546 4.408 20 0 HIADHN COc1ccccc1C[C@H]1CCCN1C(=O)NC[C@H](c1ccccc1)N1CCCC1 ZINC000521893238 929540241 /nfs/dbraw/zinc/54/02/41/929540241.db2.gz GBRZDMAIHLMOLI-DHIUTWEWSA-N 0 3 407.558 4.249 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)N[C@@H]2CCCc3cc(OC(F)F)ccc32)o1 ZINC000521912410 929556655 /nfs/dbraw/zinc/55/66/55/929556655.db2.gz HGISPQDXNVSPKE-HXUWFJFHSA-N 0 3 421.488 4.340 20 0 HIADHN Cc1ccc(NC(=O)C(C)C)cc1NC(=O)c1ccc(N2CCN(C(C)C)CC2)cc1 ZINC000521931394 929571078 /nfs/dbraw/zinc/57/10/78/929571078.db2.gz NPHGIZOZEWGHIK-UHFFFAOYSA-N 0 3 422.573 4.372 20 0 HIADHN O=C(Nc1ccc(Br)cn1)C1CCN(c2ccnc3ccccc32)CC1 ZINC000521952195 929588014 /nfs/dbraw/zinc/58/80/14/929588014.db2.gz JMXUSPADCJJMIO-UHFFFAOYSA-N 0 3 411.303 4.247 20 0 HIADHN CCc1ccc(-c2nc(CC(=O)N(CCN(C)C)Cc3ccc(C)o3)cs2)cc1 ZINC000521969404 929606245 /nfs/dbraw/zinc/60/62/45/929606245.db2.gz QBPHAAJDWOHYEY-UHFFFAOYSA-N 0 3 411.571 4.407 20 0 HIADHN Cc1cc(C(=O)N(C)CCCN2CCN(C)CC2)sc1-c1cccc(Cl)c1 ZINC000522011429 929618384 /nfs/dbraw/zinc/61/83/84/929618384.db2.gz MPLKSIAUUJZJMI-UHFFFAOYSA-N 0 3 405.995 4.086 20 0 HIADHN COC(=O)c1cc2cc(NC(=O)NC[C@H]3CCCN3Cc3ccccc3)ccc2o1 ZINC000524480954 929630686 /nfs/dbraw/zinc/63/06/86/929630686.db2.gz BFEXDUMKMNYRIN-LJQANCHMSA-N 0 3 407.470 4.006 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1ccc(Cn2cccn2)cc1 ZINC000524623734 929732441 /nfs/dbraw/zinc/73/24/41/929732441.db2.gz OAZDOTXWYZSZOA-HXUWFJFHSA-N 0 3 403.530 4.060 20 0 HIADHN COCc1cccc2sc(NC(=O)NCC(C)(C)N3CCc4ccccc4C3)nc21 ZINC000524664928 929780023 /nfs/dbraw/zinc/78/00/23/929780023.db2.gz ASWPLGXEEKXVTK-UHFFFAOYSA-N 0 3 424.570 4.401 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)CN2C[C@H](c3ccccc3)C[C@H]2C)c(OC)c1 ZINC000524755283 929819989 /nfs/dbraw/zinc/81/99/89/929819989.db2.gz MDAORBFWRJKKLA-XQFWAAQXSA-N 0 3 408.542 4.245 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)CN2C[C@@H](c3ccccc3)C[C@H]2C)c(OC)c1 ZINC000524755282 929820203 /nfs/dbraw/zinc/82/02/03/929820203.db2.gz MDAORBFWRJKKLA-RFWXGWTQSA-N 0 3 408.542 4.245 20 0 HIADHN COc1cccc(NC2CCN(C[C@H](O)COc3cccc(C(F)(F)F)c3)CC2)c1 ZINC000524791521 929830124 /nfs/dbraw/zinc/83/01/24/929830124.db2.gz AMGMRNGXVFZCFR-IBGZPJMESA-N 0 3 424.463 4.030 20 0 HIADHN COc1cccc(NC2CCN(C[C@@H](O)COc3cccc(C(F)(F)F)c3)CC2)c1 ZINC000524791522 929830260 /nfs/dbraw/zinc/83/02/60/929830260.db2.gz AMGMRNGXVFZCFR-LJQANCHMSA-N 0 3 424.463 4.030 20 0 HIADHN O=C(NCc1ccc(-c2ccncc2)cc1)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000524798587 929832820 /nfs/dbraw/zinc/83/28/20/929832820.db2.gz LFKKQFHMHWBEEO-DEOSSOPVSA-N 0 3 400.526 4.385 20 0 HIADHN Cc1nc(C(C)(C)C)sc1C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000524813550 929839962 /nfs/dbraw/zinc/83/99/62/929839962.db2.gz AOJONSXJGXGMSG-UHFFFAOYSA-N 0 3 419.566 4.161 20 0 HIADHN O=C(Cc1cccc(C(F)(F)F)c1)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000524817569 929842304 /nfs/dbraw/zinc/84/23/04/929842304.db2.gz KXLZAWBVJQLNHJ-UHFFFAOYSA-N 0 3 424.438 4.047 20 0 HIADHN O=C(NCCc1cc2ccccc2o1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000524830710 929850165 /nfs/dbraw/zinc/85/01/65/929850165.db2.gz IMJAHSLKUSWGQT-UHFFFAOYSA-N 0 3 409.555 4.388 20 0 HIADHN CCCN(Cc1nnc(-c2ccc(Br)o2)o1)[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000524893038 929875903 /nfs/dbraw/zinc/87/59/03/929875903.db2.gz XJRBPEGWEGDKFM-HFBAOOFYSA-N 0 3 410.312 4.118 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)NCCc1c[nH]c2cc(F)ccc12 ZINC000524929885 929895637 /nfs/dbraw/zinc/89/56/37/929895637.db2.gz BLHIWJPEGUCMBL-SFHVURJKSA-N 0 3 408.521 4.156 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)Nc1ccccc1OCC1CC1 ZINC000524934821 929897952 /nfs/dbraw/zinc/89/79/52/929897952.db2.gz HGRAAQINNTVIGI-UHFFFAOYSA-N 0 3 403.473 4.349 20 0 HIADHN CN(C)Cc1cccc(C(=O)NCc2cccc(NC(=O)c3ccc(F)cc3)c2)c1 ZINC000524976452 929942381 /nfs/dbraw/zinc/94/23/81/929942381.db2.gz AHKUHPIXPXILNS-UHFFFAOYSA-N 0 3 405.473 4.070 20 0 HIADHN CN(C)[C@H](CNC(=O)NCC1(c2ccccc2Br)CC1)c1ccccc1 ZINC000524992794 929958981 /nfs/dbraw/zinc/95/89/81/929958981.db2.gz UDDDCZQLMFAIPC-LJQANCHMSA-N 0 3 416.363 4.083 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cc(C)nc4ccc(OC)cc43)c(C)c2)CC1 ZINC000525006834 929969341 /nfs/dbraw/zinc/96/93/41/929969341.db2.gz RLAWFPHELARKNQ-UHFFFAOYSA-N 0 3 418.541 4.254 20 0 HIADHN CN(C)Cc1ccccc1CNC(=O)c1ccc(-c2noc(CC(C)(C)C)n2)cc1 ZINC000525061238 930010703 /nfs/dbraw/zinc/01/07/03/930010703.db2.gz AEPZUALICZVTSJ-UHFFFAOYSA-N 0 3 406.530 4.317 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2cccc(C(F)F)c2)cc1)[C@@H]1CCCN(C)C1 ZINC000525065050 930012687 /nfs/dbraw/zinc/01/26/87/930012687.db2.gz IMKVBLGJEFDKKI-LJQANCHMSA-N 0 3 401.457 4.043 20 0 HIADHN C[C@H](NC(=O)CCCN1CCN(c2ccccc2)CC1)c1ccccc1C(F)(F)F ZINC000525075696 930020487 /nfs/dbraw/zinc/02/04/87/930020487.db2.gz MUSLMHUQQAYVCQ-SFHVURJKSA-N 0 3 419.491 4.485 20 0 HIADHN Cc1ccc2[nH]c(C(=O)Nc3ccc(C(=O)N(C)[C@@H]4CCCN(C)C4)cc3)cc2c1C ZINC000525098975 930034025 /nfs/dbraw/zinc/03/40/25/930034025.db2.gz LERFBVBGPOQWTQ-HXUWFJFHSA-N 0 3 418.541 4.203 20 0 HIADHN CCN(CC)C(=O)c1cccc(NC(=O)[C@@H](C)N2CC[C@H](Cc3ccccc3)C2)c1 ZINC000525125914 930049874 /nfs/dbraw/zinc/04/98/74/930049874.db2.gz LBTZSFNDZXPWRB-TZIWHRDSSA-N 0 3 407.558 4.060 20 0 HIADHN COc1cccc(-c2ccc(CNC(=O)[C@H]3CCCN(Cc4cccnc4)C3)cc2)c1 ZINC000525164543 930073115 /nfs/dbraw/zinc/07/31/15/930073115.db2.gz QPLRPZBHPBCJQZ-DEOSSOPVSA-N 0 3 415.537 4.286 20 0 HIADHN CSc1ccc([C@H](CNCc2ccc(CO)o2)N2CCc3sccc3C2)cc1 ZINC000525180815 930077756 /nfs/dbraw/zinc/07/77/56/930077756.db2.gz QXXOTUQVJGITRN-NRFANRHFSA-N 0 3 414.596 4.445 20 0 HIADHN O=C(CC(F)(F)F)N1CCC(NCc2cc(Cl)ccc2Br)CC1 ZINC000525207561 930086717 /nfs/dbraw/zinc/08/67/17/930086717.db2.gz BSERQOPSKBNNMX-UHFFFAOYSA-N 0 3 413.665 4.136 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@H](C)N[C@@H](C)c2ccc(OC(C)C)cc2)cc1OC ZINC000525244400 930102977 /nfs/dbraw/zinc/10/29/77/930102977.db2.gz SQXZXIHZDSAAHF-ROUUACIJSA-N 0 3 414.546 4.189 20 0 HIADHN CCOC(=O)CCc1ccc(NC(=O)NC[C@H](c2ccccc2)N2CCCC2)cc1 ZINC000525342409 930179590 /nfs/dbraw/zinc/17/95/90/930179590.db2.gz AEZZHFGVFWHELE-JOCHJYFZSA-N 0 3 409.530 4.141 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(F)cc2)CC1)c1cc(F)c(F)cc1Cl ZINC000525353538 930191273 /nfs/dbraw/zinc/19/12/73/930191273.db2.gz XXURVAILWXVMMQ-UHFFFAOYSA-N 0 3 412.839 4.031 20 0 HIADHN CCc1c(C(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)cnn1-c1ccccc1 ZINC000525381136 930208375 /nfs/dbraw/zinc/20/83/75/930208375.db2.gz MNTRYFIGUQDEQZ-FQEVSTJZSA-N 0 3 402.542 4.171 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)NCCCCN(C)c1ccccc1 ZINC000525398735 930219140 /nfs/dbraw/zinc/21/91/40/930219140.db2.gz LELMZATUBRITTM-JOCHJYFZSA-N 0 3 408.590 4.209 20 0 HIADHN CCCN(C(=O)NC[C@H](CC)N1CCc2ccccc2C1)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000525418873 930230165 /nfs/dbraw/zinc/23/01/65/930230165.db2.gz BUFJZPZSVPPNJO-MYDTUXCISA-N 0 3 413.606 4.058 20 0 HIADHN CC1CCN([C@H](CNC(=O)Nc2cnn(CC(F)(F)F)c2)c2cccs2)CC1 ZINC000525421062 930231575 /nfs/dbraw/zinc/23/15/75/930231575.db2.gz BXPHLNSOKWVOJY-OAHLLOKOSA-N 0 3 415.485 4.102 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)NCCCc1c[nH]c2ccccc12 ZINC000525437389 930239841 /nfs/dbraw/zinc/23/98/41/930239841.db2.gz MBORRZCOJNEYTL-HXUWFJFHSA-N 0 3 404.558 4.407 20 0 HIADHN CC[C@@H](NC(=O)N(CCN(C)C)Cc1ccc(F)cc1F)c1cc(F)ccc1F ZINC000525441380 930241822 /nfs/dbraw/zinc/24/18/22/930241822.db2.gz KOPMNPBCTYVRLO-HXUWFJFHSA-N 0 3 411.443 4.468 20 0 HIADHN CC[C@@H](NC(=O)N(CCN(C)C)Cc1ccc(F)c(F)c1)c1cc(F)ccc1F ZINC000525442336 930242676 /nfs/dbraw/zinc/24/26/76/930242676.db2.gz OYMOELOOSFCXMC-HXUWFJFHSA-N 0 3 411.443 4.468 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)NCc1ccc(OC(F)F)cc1 ZINC000525448866 930246800 /nfs/dbraw/zinc/24/68/00/930246800.db2.gz ZPKBOYODZPSZRY-KRWDZBQOSA-N 0 3 403.473 4.094 20 0 HIADHN CC(C)(C)C[C@@H](NC(=O)NC[C@]1(O)CCN(Cc2ccccc2)C1)c1ccccc1 ZINC000525507340 930291462 /nfs/dbraw/zinc/29/14/62/930291462.db2.gz FVUCWRUDADKCRF-RCZVLFRGSA-N 0 3 409.574 4.100 20 0 HIADHN COc1cccc([C@@H](CNC(=O)CCc2c[nH]c3c2cccc3C)N2CCCC2)c1 ZINC000525526397 930302360 /nfs/dbraw/zinc/30/23/60/930302360.db2.gz FOQYXGFGFGVADJ-HSZRJFAPSA-N 0 3 405.542 4.371 20 0 HIADHN CN1CCC[C@@H](CNC(=O)c2csc(Nc3ccccn3)n2)[C@H]1c1cccs1 ZINC000525573553 930338343 /nfs/dbraw/zinc/33/83/43/930338343.db2.gz QFELUKXSKNNQEH-KSSFIOAISA-N 0 3 413.572 4.156 20 0 HIADHN CCCCc1ccc(CC(=O)Nc2ccc(C(=O)N(C)[C@H]3CCCN(C)C3)cc2)cc1 ZINC000525579397 930341519 /nfs/dbraw/zinc/34/15/19/930341519.db2.gz RCUIZKSWOKORSG-DEOSSOPVSA-N 0 3 421.585 4.377 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2ccc(Cl)c(Cl)c2)cc1)[C@H]1CCCN(C)C1 ZINC000525581246 930343225 /nfs/dbraw/zinc/34/32/25/930343225.db2.gz OXVCWOQSOBLUNS-KRWDZBQOSA-N 0 3 420.340 4.412 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2csc3ccccc23)cc1)[C@H]1CCCN(C)C1 ZINC000525580753 930343370 /nfs/dbraw/zinc/34/33/70/930343370.db2.gz MCPZDFAXGHKJHZ-SFHVURJKSA-N 0 3 407.539 4.320 20 0 HIADHN CN(C)[C@H](CNC(=O)c1ccc(Sc2ccccc2Cl)nn1)c1ccccc1 ZINC000525619198 930365688 /nfs/dbraw/zinc/36/56/88/930365688.db2.gz AYKLZZQVNVNAEE-GOSISDBHSA-N 0 3 412.946 4.314 20 0 HIADHN CCCN(CC(=O)Nc1cccc(NC(C)=O)c1)[C@H]1C[C@H](OCC)C12CCCCC2 ZINC000525640055 930378129 /nfs/dbraw/zinc/37/81/29/930378129.db2.gz NMKUPZLFHLRARD-VXKWHMMOSA-N 0 3 415.578 4.423 20 0 HIADHN COc1cc(CN[C@H](c2ccc(Cl)cc2)[C@@H]2C[C@H]2C)cc(Cl)c1OCC(N)=O ZINC000525695720 930407234 /nfs/dbraw/zinc/40/72/34/930407234.db2.gz LAEVGEXAVBCNRX-CBLJQSSYSA-N 0 3 423.340 4.353 20 0 HIADHN CC(C)Sc1c(Cl)cccc1NC(=O)C(=O)N1CCCN(C(C)(C)C)CC1 ZINC000525793694 930446504 /nfs/dbraw/zinc/44/65/04/930446504.db2.gz ACWCHBINAUOFKL-UHFFFAOYSA-N 0 3 411.999 4.112 20 0 HIADHN Cc1cnn([C@H]2CCCc3ccccc32)c1NC(=O)CC1(N2CCOCC2)CCCC1 ZINC000525824089 930458507 /nfs/dbraw/zinc/45/85/07/930458507.db2.gz FKFRKXQZPMUDGX-QFIPXVFZSA-N 0 3 422.573 4.091 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)N[C@H](C)[C@H](c3ccccc3C)[NH+](C)C)cc2)cc(=O)[n-]1 ZINC000525955524 930494210 /nfs/dbraw/zinc/49/42/10/930494210.db2.gz ALBKLTAOOMJXSH-WAIKUNEKSA-N 0 3 419.529 4.279 20 0 HIADHN Cc1ccc(C(C)C)cc1OCC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000525952743 930494283 /nfs/dbraw/zinc/49/42/83/930494283.db2.gz VJVKQDPGXCDSDZ-UHFFFAOYSA-N 0 3 412.496 4.419 20 0 HIADHN COc1ccc2c(c1)CCC[C@H]2N[C@@H]1CCCN(Cc2ccc(F)cc2F)C1=O ZINC000526047973 930514954 /nfs/dbraw/zinc/51/49/54/930514954.db2.gz DRGWIMKKULWLPX-FGZHOGPDSA-N 0 3 400.469 4.132 20 0 HIADHN C[C@H](NCC(=O)NCC1(c2ccccc2)CCOCC1)c1cc2ccccc2s1 ZINC000526945120 930554405 /nfs/dbraw/zinc/55/44/05/930554405.db2.gz UNEKIVKASKIVPK-SFHVURJKSA-N 0 3 408.567 4.417 20 0 HIADHN Cc1cc(NC(=O)CN[C@H](C)c2cc3ccccc3s2)n(-c2nc(C)cc(C)n2)n1 ZINC000526944629 930554693 /nfs/dbraw/zinc/55/46/93/930554693.db2.gz HSHFEOQWKZAVCH-MRXNPFEDSA-N 0 3 420.542 4.092 20 0 HIADHN C[C@@H](NCC(=O)NCC1(c2ccccc2)CCOCC1)c1cc2ccccc2s1 ZINC000526945119 930554946 /nfs/dbraw/zinc/55/49/46/930554946.db2.gz UNEKIVKASKIVPK-GOSISDBHSA-N 0 3 408.567 4.417 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)N[C@@H]2CCCN(Cc3ccc(F)cc3F)C2=O)cc1 ZINC000527039981 930574525 /nfs/dbraw/zinc/57/45/25/930574525.db2.gz RTRMGGOXWCUTEG-QMHKHESXSA-N 0 3 424.495 4.301 20 0 HIADHN C[C@@H]1CCCN(S(=O)(=O)c2ccc(CNCc3ccc(C(F)F)cc3)cc2)C1 ZINC000527228788 930616158 /nfs/dbraw/zinc/61/61/58/930616158.db2.gz ULOGRKCUKPKPMP-MRXNPFEDSA-N 0 3 408.514 4.335 20 0 HIADHN COc1ccc([C@@H](C)[C@@H](C)Nc2ccc3nc(CCN4CCOCC4)[nH]c3c2)cc1 ZINC000527233217 930617381 /nfs/dbraw/zinc/61/73/81/930617381.db2.gz VXMLBFFEAMDELB-ZWKOTPCHSA-N 0 3 408.546 4.050 20 0 HIADHN COc1ccc(CCNC(=O)[C@H](C)N[C@@H](C)c2cc3ccccc3s2)cc1OC ZINC000527484809 930666708 /nfs/dbraw/zinc/66/67/08/930666708.db2.gz HSTVDYRSESDQPE-HOTGVXAUSA-N 0 3 412.555 4.317 20 0 HIADHN CC[NH+](CC)Cc1ccc([N-]S(=O)(=O)c2ccc(NC(=O)C(C)(C)C)cc2)cc1 ZINC000530330281 930685477 /nfs/dbraw/zinc/68/54/77/930685477.db2.gz OLNSUUJPGWJSNJ-UHFFFAOYSA-N 0 3 417.575 4.314 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3ccc4ncccc4c3)c(OCC)c2)CC1 ZINC000530348159 930688840 /nfs/dbraw/zinc/68/88/40/930688840.db2.gz HSGVFJKRCGLHSQ-UHFFFAOYSA-N 0 3 418.541 4.418 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2cccc(CC(=O)OC(C)(C)C)c2)[C@H]1c1ccccc1 ZINC000530354184 930690476 /nfs/dbraw/zinc/69/04/76/930690476.db2.gz XFMGCGLEXIMKCN-RBBKRZOGSA-N 0 3 409.530 4.138 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2cc(C3CC3)nn2-c2ccccc2)[C@H]1c1ccccc1 ZINC000530461931 930715927 /nfs/dbraw/zinc/71/59/27/930715927.db2.gz CAKVYJMLCJEERU-NFBKMPQASA-N 0 3 401.514 4.317 20 0 HIADHN CC(C)N1CCN([C@@H]2CCN(C(=O)c3ccc(O[C@@H](C)c4ccccc4)cc3)C2)CC1 ZINC000530522847 930737483 /nfs/dbraw/zinc/73/74/83/930737483.db2.gz ICMGWFYJQSDQFP-XUZZJYLKSA-N 0 3 421.585 4.067 20 0 HIADHN CN(C(=O)c1ccccc1OCc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000530589059 930760332 /nfs/dbraw/zinc/76/03/32/930760332.db2.gz BXTSTYROTAQLLR-HSZRJFAPSA-N 0 3 415.537 4.397 20 0 HIADHN C[C@@H](NC(=O)[C@@H]1CCCN(Cc2cccnc2)C1)c1ccc(-c2cccnc2)cc1 ZINC000530619210 930774467 /nfs/dbraw/zinc/77/44/67/930774467.db2.gz NZTBNEOZPWKSGB-NTKDMRAZSA-N 0 3 400.526 4.233 20 0 HIADHN COc1cc(CNCc2ccn(C)c2)ccc1OCCOc1ccccc1Cl ZINC000530640367 930783890 /nfs/dbraw/zinc/78/38/90/930783890.db2.gz BEEWYWSUVGTMFK-UHFFFAOYSA-N 0 3 400.906 4.435 20 0 HIADHN CC[C@@H](C)[C@H](NCc1cnc2cccc(C)n12)C(=O)Nc1cccc(N2CCCC2)c1 ZINC000530665101 930792192 /nfs/dbraw/zinc/79/21/92/930792192.db2.gz WUADWRZEFBXCAP-KOSHJBKYSA-N 0 3 419.573 4.386 20 0 HIADHN C[C@@H](NC(=O)NCC1(N2CCSCC2)CCCC1)c1cccc(N2CCCC2)c1 ZINC000530789520 930823938 /nfs/dbraw/zinc/82/39/38/930823938.db2.gz GOIIDEKWFJXGPN-LJQANCHMSA-N 0 3 416.635 4.009 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Nc1cccc(CC(=O)OC(C)(C)C)c1 ZINC000530982799 930875312 /nfs/dbraw/zinc/87/53/12/930875312.db2.gz ARBOPXCPNHWUII-UHFFFAOYSA-N 0 3 417.575 4.228 20 0 HIADHN O=C(CCc1nnc(-c2ccc(Cl)cc2)o1)N(CCN1CCCC1)c1ccccc1 ZINC000531059672 930901708 /nfs/dbraw/zinc/90/17/08/930901708.db2.gz NGTXDUWMCONVDL-UHFFFAOYSA-N 0 3 424.932 4.452 20 0 HIADHN COC[C@@](C)(CCO)NCc1cccc(NC(=O)c2ccc(Cl)cc2Cl)c1 ZINC000531172115 930951954 /nfs/dbraw/zinc/95/19/54/930951954.db2.gz KLDLVMWHHWUUPT-HXUWFJFHSA-N 0 3 411.329 4.123 20 0 HIADHN Cc1cccc(NC(=O)C(=O)NC[C@@H](c2ccccc2)N2CCC(C)CC2)c1Cl ZINC000531286798 931001876 /nfs/dbraw/zinc/00/18/76/931001876.db2.gz SNNRZHIMWXUAIJ-FQEVSTJZSA-N 0 3 413.949 4.176 20 0 HIADHN Cc1cc(C)n(-c2ccc(CC(=O)N(C)[C@@H]3CCCN(Cc4ccccc4)C3)cc2)n1 ZINC000531301685 931007399 /nfs/dbraw/zinc/00/73/99/931007399.db2.gz WAQRYASCLRJGPP-RUZDIDTESA-N 0 3 416.569 4.155 20 0 HIADHN Cc1cc(C)cc(C(=O)N2CCC[C@@H](c3nc(-c4ccc(CN(C)C)cc4)no3)C2)c1 ZINC000531348542 931026767 /nfs/dbraw/zinc/02/67/67/931026767.db2.gz OAQHCIQWRRWFEO-OAQYLSRUSA-N 0 3 418.541 4.435 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)c2ccccc2OCc2ccncc2)CN1Cc1ccccc1 ZINC000531569390 931105534 /nfs/dbraw/zinc/10/55/34/931105534.db2.gz WDFAVJAGRNBUKY-KNQAVFIVSA-N 0 3 401.510 4.053 20 0 HIADHN Cc1ccc(-c2csc3ncnc(N4CC[C@H](N5CCN(C(C)C)CC5)C4)c23)cc1 ZINC000531582504 931109092 /nfs/dbraw/zinc/10/90/92/931109092.db2.gz OGJCOAZJMBTWIX-FQEVSTJZSA-N 0 3 421.614 4.271 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@@H](C)N[C@@H]2CCCc3nc(C)sc32)cc1 ZINC000531677060 931147704 /nfs/dbraw/zinc/14/77/04/931147704.db2.gz WHFMZPGSULSECV-RDTXWAMCSA-N 0 3 407.605 4.210 20 0 HIADHN CCCNC(=O)c1cccc(CN[C@@H](C)CC(=O)Nc2cccc(C(F)(F)F)c2)c1 ZINC000531682598 931150955 /nfs/dbraw/zinc/15/09/55/931150955.db2.gz YGDKTFOGCNAIIL-HNNXBMFYSA-N 0 3 421.463 4.352 20 0 HIADHN CC(C)NS(=O)(=O)Cc1ccc(CN[C@@H]2CCCOc3c(Cl)cccc32)cc1 ZINC000531694729 931157496 /nfs/dbraw/zinc/15/74/96/931157496.db2.gz FIBAOAYLXAXJCY-HXUWFJFHSA-N 0 3 422.978 4.171 20 0 HIADHN O=C(c1ccc(CN[C@H]2CCSc3c(Cl)cccc32)cc1)N1CCOCC1 ZINC000531697774 931160944 /nfs/dbraw/zinc/16/09/44/931160944.db2.gz CMSMFIAELUUAJL-IBGZPJMESA-N 0 3 402.947 4.139 20 0 HIADHN Cc1ccc2nc(CN[C@H](C)CC(=O)Nc3ccc(OC(F)(F)F)cc3)[nH]c2c1 ZINC000531728921 931175711 /nfs/dbraw/zinc/17/57/11/931175711.db2.gz XVYKAFCUDBDHPY-CYBMUJFWSA-N 0 3 406.408 4.277 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1C(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C ZINC000531802409 931204096 /nfs/dbraw/zinc/20/40/96/931204096.db2.gz QMWOCMAXXSPTJK-FQEVSTJZSA-N 0 3 416.569 4.285 20 0 HIADHN CCN(C(=O)Nc1ncn(Cc2ccccc2)n1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000531875215 931231472 /nfs/dbraw/zinc/23/14/72/931231472.db2.gz VJHVDOBSZADXCY-KNQAVFIVSA-N 0 3 418.545 4.016 20 0 HIADHN CCC(CC)(NCc1cnc(N2CCN(C)CC2)nc1)c1ccc(Cl)c(Cl)c1 ZINC000531883978 931234320 /nfs/dbraw/zinc/23/43/20/931234320.db2.gz CINQPCFVSOKLPK-UHFFFAOYSA-N 0 3 422.404 4.340 20 0 HIADHN CCC(=O)Nc1cccc(CN[C@H](C)CC(=O)N(C)Cc2cccc(Cl)c2)c1 ZINC000531937504 931253684 /nfs/dbraw/zinc/25/36/84/931253684.db2.gz GISKDKZIMXLECF-MRXNPFEDSA-N 0 3 401.938 4.215 20 0 HIADHN CCC(=O)Nc1cccc(CN[C@@H](C)CC(=O)Nc2ccc(Br)cc2)c1 ZINC000531937991 931253762 /nfs/dbraw/zinc/25/37/62/931253762.db2.gz XQKCZJGUNUFRKK-AWEZNQCLSA-N 0 3 418.335 4.305 20 0 HIADHN Fc1cccc(C[C@H](NCc2ccc(N3CCOCC3)nc2)c2cccc(F)c2)c1 ZINC000531944593 931256949 /nfs/dbraw/zinc/25/69/49/931256949.db2.gz HNDFYNVYQSOTFT-QHCPKHFHSA-N 0 3 409.480 4.270 20 0 HIADHN Cc1cc2c(cc1C)[C@H](NCc1ccc(CS(=O)(=O)NC(C)C)cc1)CCCO2 ZINC000531951785 931260362 /nfs/dbraw/zinc/26/03/62/931260362.db2.gz BMFFWQXPTMINGZ-JOCHJYFZSA-N 0 3 416.587 4.135 20 0 HIADHN CC(C)NS(=O)(=O)Cc1ccc(CN[C@H]2CC3(CCC3)Oc3ccccc32)cc1 ZINC000531950692 931260568 /nfs/dbraw/zinc/26/05/68/931260568.db2.gz VHYFSIVXNQSTGP-NRFANRHFSA-N 0 3 414.571 4.051 20 0 HIADHN CC(C)NS(=O)(=O)Cc1ccc(CN[C@@H]2CC3(CCC3)Oc3ccccc32)cc1 ZINC000531950694 931260870 /nfs/dbraw/zinc/26/08/70/931260870.db2.gz VHYFSIVXNQSTGP-OAQYLSRUSA-N 0 3 414.571 4.051 20 0 HIADHN CCCOc1ccc([C@@H](C)NCc2ccc(CS(=O)(=O)NC(C)C)cc2)cc1 ZINC000531950847 931260940 /nfs/dbraw/zinc/26/09/40/931260940.db2.gz RKBMYEITWUEKNZ-GOSISDBHSA-N 0 3 404.576 4.154 20 0 HIADHN CNS(=O)(=O)c1ccc([C@@H](C)N[C@H](C)c2sc(-c3ccccc3)nc2C)cc1 ZINC000531952601 931261411 /nfs/dbraw/zinc/26/14/11/931261411.db2.gz WNYWYMBPDSYYII-HUUCEWRRSA-N 0 3 415.584 4.438 20 0 HIADHN COc1c(Br)cc(Br)cc1CN[C@@H]1CCCc2cn[nH]c21 ZINC000531952356 931261728 /nfs/dbraw/zinc/26/17/28/931261728.db2.gz ULWAEMVFTBJOKJ-CYBMUJFWSA-N 0 3 415.129 4.111 20 0 HIADHN COc1ccc([C@@H](C)NCc2ccc(NC(=O)c3ccco3)cc2)cc1NC(C)=O ZINC000531953411 931262697 /nfs/dbraw/zinc/26/26/97/931262697.db2.gz NPJRFOCQECJBTG-OAHLLOKOSA-N 0 3 407.470 4.350 20 0 HIADHN COc1ccc(-c2nc3c(s2)[C@@H](NCc2ccc4c(c2)nnn4C)CCC3)cc1 ZINC000531957083 931264597 /nfs/dbraw/zinc/26/45/97/931264597.db2.gz DNBFNODERAVFCY-KRWDZBQOSA-N 0 3 405.527 4.268 20 0 HIADHN COc1ccc([C@H](C)NCc2ccccc2CS(=O)(=O)NC(C)C)cc1Cl ZINC000531958226 931264931 /nfs/dbraw/zinc/26/49/31/931264931.db2.gz UHRBDRWMROIFKO-HNNXBMFYSA-N 0 3 410.967 4.027 20 0 HIADHN CC(C)NS(=O)(=O)Cc1ccccc1CN[C@H](C)c1ccc(C(F)(F)F)cc1 ZINC000531958870 931265891 /nfs/dbraw/zinc/26/58/91/931265891.db2.gz RVGZATBAIGECIZ-OAHLLOKOSA-N 0 3 414.493 4.384 20 0 HIADHN Cc1c([C@@H](C)N[C@H](C)Cn2cc(Br)cn2)cnn1-c1ccc(F)cc1 ZINC000531962413 931266580 /nfs/dbraw/zinc/26/65/80/931266580.db2.gz KMCUUKFMDISMCC-CHWSQXEVSA-N 0 3 406.303 4.018 20 0 HIADHN COc1ccc(OC)c(NC(=O)C[C@H](C)N[C@@H](c2ccc(F)cc2)[C@H]2CCCO2)c1 ZINC000531962332 931266742 /nfs/dbraw/zinc/26/67/42/931266742.db2.gz DRVRLVIQOXTAGY-XFEAKLGESA-N 0 3 416.493 4.070 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3CCC[C@H]3c3cccc(C)n3)c(C)c2)CC1 ZINC000531975563 931272024 /nfs/dbraw/zinc/27/20/24/931272024.db2.gz WBYXNNDOTJCLMF-QHCPKHFHSA-N 0 3 407.562 4.209 20 0 HIADHN Cc1ccc2c(c1)CC[C@H]2NCc1ccc(OCCN2CCOCC2)c(Cl)c1 ZINC000532092299 931308356 /nfs/dbraw/zinc/30/83/56/931308356.db2.gz DLOCMRAAGCYYNN-JOCHJYFZSA-N 0 3 400.950 4.137 20 0 HIADHN CC(C)(C)OC(=O)C[C@@H]1CCCN(C[C@H](O)COc2c(Cl)cccc2Cl)C1 ZINC000532125175 931322626 /nfs/dbraw/zinc/32/26/26/931322626.db2.gz FXZHHMPVFJLAIX-GJZGRUSLSA-N 0 3 418.361 4.177 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@@H](C)N[C@H](C)c2ccc(OC)c(F)c2)cc1 ZINC000532186782 931341330 /nfs/dbraw/zinc/34/13/30/931341330.db2.gz UMCUDQBCYYBUKZ-HZPDHXFCSA-N 0 3 408.539 4.277 20 0 HIADHN C[C@H](NC[C@@H](c1ccc(F)cc1)N1CCOCC1)c1sccc1Br ZINC000532204373 931349612 /nfs/dbraw/zinc/34/96/12/931349612.db2.gz ZDXSDKFXAODORJ-GUYCJALGSA-N 0 3 413.356 4.374 20 0 HIADHN C[C@H](NC[C@H](O)COc1cccc(C(F)(F)F)c1)c1ccccc1OC(F)F ZINC000532207417 931350873 /nfs/dbraw/zinc/35/08/73/931350873.db2.gz JAXPIPLALKXKHT-JSGCOSHPSA-N 0 3 405.363 4.397 20 0 HIADHN CSc1ccc([C@H](C)NCc2cccc(OCCN3CCOCC3)c2)cc1F ZINC000532211954 931354168 /nfs/dbraw/zinc/35/41/68/931354168.db2.gz ILFFFTCTMGMCLY-KRWDZBQOSA-N 0 3 404.551 4.109 20 0 HIADHN CC[C@@H](N[C@H](C)c1ccc(-n2ccnc2)cc1)c1ccccc1OCC(=O)N(C)C ZINC000532212151 931355170 /nfs/dbraw/zinc/35/51/70/931355170.db2.gz WHPYQXUMVDPYKC-XMSQKQJNSA-N 0 3 406.530 4.141 20 0 HIADHN Cc1c([C@@H](C)N[C@@H](C)c2ccc(NS(C)(=O)=O)cc2)cnn1-c1ccc(F)cc1 ZINC000532217997 931358189 /nfs/dbraw/zinc/35/81/89/931358189.db2.gz KPTWKKSSUZVFTF-LSDHHAIUSA-N 0 3 416.522 4.103 20 0 HIADHN C[C@H](CC(=O)N(C)Cc1cccc(Cl)c1)NCc1ccc(OCC2CC2)nc1 ZINC000532219018 931358349 /nfs/dbraw/zinc/35/83/49/931358349.db2.gz UCDBLQYKWGSRAM-MRXNPFEDSA-N 0 3 401.938 4.051 20 0 HIADHN C[C@H](CC(=O)Nc1ccccc1C(F)(F)F)NCc1ccc(OCC2CC2)nc1 ZINC000532219755 931358587 /nfs/dbraw/zinc/35/85/87/931358587.db2.gz RUKTZJZVLQPLEI-CQSZACIVSA-N 0 3 407.436 4.396 20 0 HIADHN CC[C@H](N[C@@H](CN1CCN(C)CC1)c1ccccc1)c1cc(Cl)ccc1OC ZINC000532221227 931359619 /nfs/dbraw/zinc/35/96/19/931359619.db2.gz DOKGDEJRDQIBTN-VXKWHMMOSA-N 0 3 401.982 4.378 20 0 HIADHN CCN(CC)C(=O)Nc1ccc([C@@H](C)N[C@@H]2CCCN(c3ccccc3)C2=O)cc1 ZINC000532222612 931360158 /nfs/dbraw/zinc/36/01/58/931360158.db2.gz UNEUTXQYLUFJGR-XMSQKQJNSA-N 0 3 408.546 4.407 20 0 HIADHN Cc1cc(C(C)(C)C)cc2c1OCCC[C@@H]2NCc1ccc(N2CCN(C)CC2)nc1 ZINC000532270751 931378359 /nfs/dbraw/zinc/37/83/59/931378359.db2.gz KFRBSJADGKFOMB-QHCPKHFHSA-N 0 3 422.617 4.443 20 0 HIADHN C[C@@H](N[C@H](CN1CCN(C)CC1)c1ccccc1)c1ccc(Br)c(F)c1 ZINC000532270445 931378666 /nfs/dbraw/zinc/37/86/66/931378666.db2.gz FGXCOATVGQMWKQ-IIBYNOLFSA-N 0 3 420.370 4.228 20 0 HIADHN COc1ccccc1[C@H](NC(=O)N(CCN(C)C)Cc1ccco1)c1ccccc1 ZINC000532290882 931386641 /nfs/dbraw/zinc/38/66/41/931386641.db2.gz DVQKPFMSJKQNPF-HSZRJFAPSA-N 0 3 407.514 4.151 20 0 HIADHN CCNC(=O)c1ccc(CNCc2cn(C(C)(C)C)nc2-c2cccc(OC)c2)cc1 ZINC000532361612 931409288 /nfs/dbraw/zinc/40/92/88/931409288.db2.gz DLWWOJDOJJARPS-UHFFFAOYSA-N 0 3 420.557 4.353 20 0 HIADHN O=C(N[C@H]1CCCN(Cc2ccccc2)C1)N1CCC(Nc2ccc(F)cc2)CC1 ZINC000532444907 931437413 /nfs/dbraw/zinc/43/74/13/931437413.db2.gz VFFQFJVQOVXVFK-QHCPKHFHSA-N 0 3 410.537 4.076 20 0 HIADHN CCC(=O)Nc1cccc(CN[C@@H](C)CC(=O)Nc2cc(Cl)ccc2OC)c1 ZINC000532448018 931438543 /nfs/dbraw/zinc/43/85/43/931438543.db2.gz MCDHSMCMNYEHOA-AWEZNQCLSA-N 0 3 403.910 4.204 20 0 HIADHN C[C@H](NCc1ccc(N2CCN(C)CC2)nc1)c1ccc(OCc2ccccc2)cc1 ZINC000532451535 931439943 /nfs/dbraw/zinc/43/99/43/931439943.db2.gz DYDSHLBZTYLYBT-NRFANRHFSA-N 0 3 416.569 4.263 20 0 HIADHN C[C@@H](O)CN(CC(=O)Nc1ccc(Br)cc1Cl)C1CCCCC1 ZINC000532556819 931522270 /nfs/dbraw/zinc/52/22/70/931522270.db2.gz KJPRHYPEXDHNOR-GFCCVEGCSA-N 0 3 403.748 4.057 20 0 HIADHN CO[C@@H](C)CN(CC(=O)NC[C@@H](c1c[nH]c2ccccc21)c1ccccc1)C(C)C ZINC000532586910 931545251 /nfs/dbraw/zinc/54/52/51/931545251.db2.gz UBFPJUDYHWAAJW-SIKLNZKXSA-N 0 3 407.558 4.161 20 0 HIADHN COc1cc(CNCc2ccccc2-n2ccc(C)n2)ccc1OCC(F)(F)F ZINC000532628470 931559770 /nfs/dbraw/zinc/55/97/70/931559770.db2.gz WDJBCGZUIJFPRE-UHFFFAOYSA-N 0 3 405.420 4.420 20 0 HIADHN O=C(CN[C@H](Cc1ccccc1)c1ccccc1)NC[C@@H]1CCN(c2ccccc2)C1 ZINC000532642254 931564116 /nfs/dbraw/zinc/56/41/16/931564116.db2.gz PVPMWGANQSYMCV-JYFHCDHNSA-N 0 3 413.565 4.203 20 0 HIADHN COc1ccc([C@H]2CCCN2C(=O)CN[C@H](c2ccccc2)C2CCC2)cc1OC ZINC000532686233 931584469 /nfs/dbraw/zinc/58/44/69/931584469.db2.gz GBNORPLEWJHERT-PXDATVDWSA-N 0 3 408.542 4.498 20 0 HIADHN O=C(Nc1ccccc1Br)C1CCN(CCOc2cccc(F)c2)CC1 ZINC000532695528 931590777 /nfs/dbraw/zinc/59/07/77/931590777.db2.gz BNAALRMJPXNLFP-UHFFFAOYSA-N 0 3 421.310 4.318 20 0 HIADHN O=C(CN[C@@H](c1ccccc1)C1CCC1)N1CCC[C@H]1c1ccc2c(c1)OCCO2 ZINC000532701621 931594967 /nfs/dbraw/zinc/59/49/67/931594967.db2.gz MFPJOOITYZSATJ-OFVILXPXSA-N 0 3 406.526 4.252 20 0 HIADHN CC(C)[C@@H](NCC(=O)NCC1(c2ccccc2)CCOCC1)c1ccc(Cl)cc1 ZINC000532908799 931689136 /nfs/dbraw/zinc/68/91/36/931689136.db2.gz QVVZKPLOZGBYOC-HSZRJFAPSA-N 0 3 414.977 4.491 20 0 HIADHN CC(C)c1ccccc1OCC(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000532938960 931704435 /nfs/dbraw/zinc/70/44/35/931704435.db2.gz KFDZUZGLELOFRU-NRFANRHFSA-N 0 3 418.541 4.471 20 0 HIADHN COc1ccc(C)cc1NC(=O)[C@@H](C)N(C)CCCc1cc(-c2cccc(F)c2)n[nH]1 ZINC000532959172 931712742 /nfs/dbraw/zinc/71/27/42/931712742.db2.gz NNOQKSVZYAASKT-QGZVFWFLSA-N 0 3 424.520 4.424 20 0 HIADHN Brc1ccc(Cc2noc([C@@H]3CCCN3CCN3CCCCC3)n2)cc1 ZINC000532982638 931726081 /nfs/dbraw/zinc/72/60/81/931726081.db2.gz RHKMLJRDTJIZHN-SFHVURJKSA-N 0 3 419.367 4.046 20 0 HIADHN FC(F)Oc1ccc(Br)cc1CNCCc1nnc(-c2ccccc2)o1 ZINC000533039209 931748615 /nfs/dbraw/zinc/74/86/15/931748615.db2.gz NEXMGEQPOHPHPH-UHFFFAOYSA-N 0 3 424.245 4.433 20 0 HIADHN C[C@@H](N[C@H](c1ccc(F)cc1)C1CCC1)C(=O)Nc1ccc(N2CCCC2=O)cc1 ZINC000533054875 931755934 /nfs/dbraw/zinc/75/59/34/931755934.db2.gz YDYUVASEXNJOMX-MWTRTKDXSA-N 0 3 409.505 4.411 20 0 HIADHN COc1ccc(C2=NN(C(=O)CN(CC3CC3)CC3CC3)[C@H](c3ccco3)C2)cc1 ZINC000533060639 931758891 /nfs/dbraw/zinc/75/88/91/931758891.db2.gz DJHXMIGJUHHEOK-QFIPXVFZSA-N 0 3 407.514 4.088 20 0 HIADHN C[C@@H](c1ccc(F)cc1)N(C)C(=O)CNC1(c2ccc(Cl)cc2)CCOCC1 ZINC000533063132 931760176 /nfs/dbraw/zinc/76/01/76/931760176.db2.gz AKJURWZWOUZHHR-INIZCTEOSA-N 0 3 404.913 4.294 20 0 HIADHN C[C@@]1(c2ccc(CNCc3ccc(Sc4ccccc4)cc3)cc2)NC(=O)NC1=O ZINC000533125519 931776095 /nfs/dbraw/zinc/77/60/95/931776095.db2.gz MIGHHXVGMMRTQL-DEOSSOPVSA-N 0 3 417.534 4.182 20 0 HIADHN Cc1cnn(CCCCC[NH+]2CCC(C(=O)Nc3cc(Cl)ccc3[O-])CC2)c1 ZINC000533148765 931786684 /nfs/dbraw/zinc/78/66/84/931786684.db2.gz HCKXDVPVGREUDL-UHFFFAOYSA-N 0 3 404.942 4.072 20 0 HIADHN FC(F)(F)c1ccc(CNc2ccc3nc(CCN4CCOCC4)[nH]c3c2)cc1 ZINC000533211465 931810612 /nfs/dbraw/zinc/81/06/12/931810612.db2.gz VSHZJJYXMYTIKZ-UHFFFAOYSA-N 0 3 404.436 4.069 20 0 HIADHN COc1ccc(CNc2cc(C(N)=O)ccc2CN(C)C)cc1OCc1ccccc1 ZINC000533219607 931812970 /nfs/dbraw/zinc/81/29/70/931812970.db2.gz FFNVXHKBDNNHDY-UHFFFAOYSA-N 0 3 419.525 4.047 20 0 HIADHN Cc1cc(NC(=O)N(C)Cc2cccc(O)c2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000533258661 931821466 /nfs/dbraw/zinc/82/14/66/931821466.db2.gz ZBTHLUUDNKYFGA-OAQYLSRUSA-N 0 3 419.529 4.008 20 0 HIADHN O=C(CCOc1cccc(Cl)c1)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000533264223 931823146 /nfs/dbraw/zinc/82/31/46/931823146.db2.gz CPODJJCQXWTEIO-FQEVSTJZSA-N 0 3 424.932 4.391 20 0 HIADHN CCN1CCCN(CC(=O)Nc2ccc(-c3nc4ccc(C)cc4s3)cc2)CC1 ZINC000533264222 931823353 /nfs/dbraw/zinc/82/33/53/931823353.db2.gz CLZIXISUSOYVKN-UHFFFAOYSA-N 0 3 408.571 4.238 20 0 HIADHN O=C(CN(Cc1ccccc1)CC1CCOCC1)Nc1ccnn1CC1CCCCC1 ZINC000533286424 931828073 /nfs/dbraw/zinc/82/80/73/931828073.db2.gz UPSKTOLJOVWVMY-UHFFFAOYSA-N 0 3 424.589 4.331 20 0 HIADHN C[C@H](NCc1ccc(Br)cn1)[C@H](OC1CCOCC1)c1ccccc1 ZINC000533329132 931839781 /nfs/dbraw/zinc/83/97/81/931839781.db2.gz XBAUDINPSIGQJB-YWZLYKJASA-N 0 3 405.336 4.259 20 0 HIADHN COc1cc(OC)c(OC)cc1CN[C@@H](C)[C@H](OC1CCOCC1)c1ccccc1 ZINC000533329424 931839787 /nfs/dbraw/zinc/83/97/87/931839787.db2.gz GYJLVDNSHSTXEP-XDHUDOTRSA-N 0 3 415.530 4.127 20 0 HIADHN O=C(CNC1(c2ccccc2)CCC1)NCc1cccc(COCc2ccco2)c1 ZINC000533352006 931846906 /nfs/dbraw/zinc/84/69/06/931846906.db2.gz QXUYVYNCEJGXFI-UHFFFAOYSA-N 0 3 404.510 4.282 20 0 HIADHN Cc1nc(-c2cccc(NC(=O)CNC3(c4ccccc4)CCOCC3)c2)cs1 ZINC000533382503 931853885 /nfs/dbraw/zinc/85/38/85/931853885.db2.gz QOWNBVHKIWDCHL-UHFFFAOYSA-N 0 3 407.539 4.353 20 0 HIADHN CCN(C(=O)CN1CCC(c2c[nH]c3ncccc23)CC1)[C@@H](C)c1ccc(F)cc1 ZINC000533382375 931853951 /nfs/dbraw/zinc/85/39/51/931853951.db2.gz NGCONRJNFZHKRA-KRWDZBQOSA-N 0 3 408.521 4.491 20 0 HIADHN Cc1cc(NC(=O)CN[C@@H](c2ccccc2)C2CCCC2)n(-c2nc(C)cc(C)n2)n1 ZINC000533386818 931855136 /nfs/dbraw/zinc/85/51/36/931855136.db2.gz ZPALJCVZDNXLEK-QHCPKHFHSA-N 0 3 418.545 4.047 20 0 HIADHN Cc1nc(C(C)C)sc1C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000533397059 931857253 /nfs/dbraw/zinc/85/72/53/931857253.db2.gz DEVBGQSDJYITIN-SFHVURJKSA-N 0 3 409.559 4.471 20 0 HIADHN C[N@@H+](Cc1ccccc1)CC1CCN(Cc2nc3c4ccccc4oc3c(=O)[n-]2)CC1 ZINC000533417140 931861675 /nfs/dbraw/zinc/86/16/75/931861675.db2.gz WSFOSIXNABELHU-UHFFFAOYSA-N 0 3 416.525 4.426 20 0 HIADHN C[N@H+](Cc1ccccc1)CC1CCN(Cc2nc3c4ccccc4oc3c(=O)[n-]2)CC1 ZINC000533417140 931861678 /nfs/dbraw/zinc/86/16/78/931861678.db2.gz WSFOSIXNABELHU-UHFFFAOYSA-N 0 3 416.525 4.426 20 0 HIADHN CCCN(CC(=O)Nc1ccc(NC(C)=O)cc1)[C@@H]1C[C@H](OCC)C12CCCC2 ZINC000533428849 931865550 /nfs/dbraw/zinc/86/55/50/931865550.db2.gz FGSMCWPLBWSSQS-RTWAWAEBSA-N 0 3 401.551 4.033 20 0 HIADHN C[C@@H](c1ccccc1F)N1CCC(C(=O)Nc2ccc(Br)cn2)CC1 ZINC000533492042 931883677 /nfs/dbraw/zinc/88/36/77/931883677.db2.gz DDJQTFFSGCUNBY-ZDUSSCGKSA-N 0 3 406.299 4.395 20 0 HIADHN COc1ccc(CCNC(=O)[C@@H](C)N[C@H](c2ccc(F)cc2)C2CCC2)cc1OC ZINC000533505562 931887455 /nfs/dbraw/zinc/88/74/55/931887455.db2.gz QDZBMGYHHPXGAQ-MWTRTKDXSA-N 0 3 414.521 4.021 20 0 HIADHN O=C(CN[C@@H](c1ccccc1)C1CCCC1)N1CCC(C(=O)Nc2ccccc2)CC1 ZINC000533523096 931893611 /nfs/dbraw/zinc/89/36/11/931893611.db2.gz KHDZMEXBFYZLRA-VWLOTQADSA-N 0 3 419.569 4.385 20 0 HIADHN Cc1cccc(NC2CCN(C[C@@H](O)COc3ccc(Br)cc3)CC2)c1 ZINC000533531538 931895360 /nfs/dbraw/zinc/89/53/60/931895360.db2.gz LTUAWRALMDZJPR-HXUWFJFHSA-N 0 3 419.363 4.074 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)c1cccc(F)c1I ZINC000533535954 931896658 /nfs/dbraw/zinc/89/66/58/931896658.db2.gz IWOFXGWNUDFJLZ-UHFFFAOYSA-N 0 3 412.246 4.053 20 0 HIADHN CN1CCN([C@@H](CNCc2ccc(-c3ccncc3)cc2F)c2cccs2)CC1 ZINC000533565144 931902901 /nfs/dbraw/zinc/90/29/01/931902901.db2.gz OZDDBZHLPQBELK-QFIPXVFZSA-N 0 3 410.562 4.028 20 0 HIADHN COc1cccc(NC(=O)[C@H](N[C@@H]2[C@@H]3CCO[C@@H]3C23CCCC3)c2ccccc2)c1 ZINC000533635917 931938047 /nfs/dbraw/zinc/93/80/47/931938047.db2.gz QBABCULEWZLTCF-AFXVXQJMSA-N 0 3 406.526 4.312 20 0 HIADHN COc1ccc(C(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)cc1-c1ccccn1 ZINC000533643012 931940714 /nfs/dbraw/zinc/94/07/14/931940714.db2.gz GXVCYNNZBCXIEO-RXVVDRJESA-N 0 3 401.510 4.323 20 0 HIADHN CN1CC[C@@H](NC(=O)c2cccc(CN3CCCC3)c2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000533682662 931967964 /nfs/dbraw/zinc/96/79/64/931967964.db2.gz KWDYLXYOKRWHNL-YADHBBJMSA-N 0 3 415.940 4.250 20 0 HIADHN Cc1cc(C)c(CC(C(=O)Nc2cccc(S(C)(=O)=O)c2)C(F)(F)F)c(C)c1 ZINC000533702995 931978567 /nfs/dbraw/zinc/97/85/67/931978567.db2.gz ZAWYUNHRUYCSJF-SFHVURJKSA-N 0 3 413.461 4.375 20 0 HIADHN CC[C@@H](NCc1cnn(-c2ccc(F)cc2)c1)[C@H](c1ccc(C)cc1)n1cncn1 ZINC000533739931 932002062 /nfs/dbraw/zinc/00/20/62/932002062.db2.gz MSMIEJIBVYFVIU-PKTZIBPZSA-N 0 3 404.493 4.069 20 0 HIADHN FC(F)(F)Oc1cccc(N2CC[C@@H](NCc3cnc([C@H]4CCCO4)s3)C2)c1 ZINC000533742783 932003292 /nfs/dbraw/zinc/00/32/92/932003292.db2.gz GVAIMBUNICHBCJ-CXAGYDPISA-N 0 3 413.465 4.262 20 0 HIADHN COc1ccccc1[C@H](C)N(C)C(=O)CN1CCC[C@@H]1Cn1c(C)nc2ccccc21 ZINC000533758174 932014342 /nfs/dbraw/zinc/01/43/42/932014342.db2.gz BONZTNVHNRSRIW-AZUAARDMSA-N 0 3 420.557 4.037 20 0 HIADHN CC(=O)c1ccc2c(c1)CCN(CCC(=O)Nc1ccc(Br)cc1)CC2 ZINC000533762642 932017408 /nfs/dbraw/zinc/01/74/08/932017408.db2.gz DREZQQMTTDSMJJ-UHFFFAOYSA-N 0 3 415.331 4.081 20 0 HIADHN CN(C)[C@@H](CNC(=O)N1CCC(c2nc3ccccc3s2)CC1)Cc1ccccc1 ZINC000533809447 932042347 /nfs/dbraw/zinc/04/23/47/932042347.db2.gz NYOCNZSVDBOWSB-HXUWFJFHSA-N 0 3 422.598 4.358 20 0 HIADHN CN1CC[C@H](NC(=O)NCc2cccc(NC(=O)C3CCCC3)c2)[C@@H]1c1ccccc1 ZINC000533890787 932084057 /nfs/dbraw/zinc/08/40/57/932084057.db2.gz IORQJFWCWZZRQC-GOTSBHOMSA-N 0 3 420.557 4.060 20 0 HIADHN CN1CC[C@H](NC(=O)NCc2cccnc2Oc2cccc(F)c2)[C@@H]1c1ccccc1 ZINC000533929570 932106246 /nfs/dbraw/zinc/10/62/46/932106246.db2.gz ZPHROISRCQGAEJ-VXKWHMMOSA-N 0 3 420.488 4.258 20 0 HIADHN CN(Cc1ccccc1Br)C(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000533947318 932120216 /nfs/dbraw/zinc/12/02/16/932120216.db2.gz UEKMGNDGCKEEOH-MOPGFXCFSA-N 0 3 402.336 4.036 20 0 HIADHN Cc1c(C(=O)Nc2cc(C)cc(CN(C)C)c2)sc2nc3n(c(=O)c12)CCCCC3 ZINC000533973269 932151595 /nfs/dbraw/zinc/15/15/95/932151595.db2.gz AMJGMOXCMLVGEX-UHFFFAOYSA-N 0 3 424.570 4.115 20 0 HIADHN Cc1ccc(C(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)cc1NC(=O)NC(C)(C)C ZINC000534018846 932200689 /nfs/dbraw/zinc/20/06/89/932200689.db2.gz LNGOAEYLXYKLHU-PZJWPPBQSA-N 0 3 408.546 4.090 20 0 HIADHN COC(=O)[C@H]1CCCC[C@]1(C)NCC(=O)Nc1c(Cl)cc(Cl)cc1Cl ZINC000534019450 932200910 /nfs/dbraw/zinc/20/09/10/932200910.db2.gz QWFKWJUZRMDIDZ-DIFFPNOSSA-N 0 3 407.725 4.297 20 0 HIADHN CN1CC[C@@H](NC(=O)Cc2cc(Cl)ccc2Br)[C@@H]1c1ccccc1 ZINC000534019432 932201568 /nfs/dbraw/zinc/20/15/68/932201568.db2.gz QLQHAHZHINJAJI-MJGOQNOKSA-N 0 3 407.739 4.207 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccc(Cl)cc1 ZINC000534125764 932291906 /nfs/dbraw/zinc/29/19/06/932291906.db2.gz XCDUTMBOAMYVDT-TZIWHRDSSA-N 0 3 411.933 4.323 20 0 HIADHN Cc1c2cccc(Cl)c2oc1C(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1CO ZINC000534181799 932319189 /nfs/dbraw/zinc/31/91/89/932319189.db2.gz MAKJKMMYLZASSX-XLIONFOSSA-N 0 3 412.917 4.007 20 0 HIADHN Cc1cccc(-c2n[nH]cc2CN(Cc2ccc(C(=O)NC3CC3)cc2)C2CC2)c1 ZINC000534335837 932385477 /nfs/dbraw/zinc/38/54/77/932385477.db2.gz VWFNUPQRTISAKT-UHFFFAOYSA-N 0 3 400.526 4.442 20 0 HIADHN Cc1cnc(CCN(C)C[C@H](O)CO[C@H](c2ccccc2)c2ccccc2C)s1 ZINC000534379837 932407379 /nfs/dbraw/zinc/40/73/79/932407379.db2.gz YXENZILFTWBECZ-XUZZJYLKSA-N 0 3 410.583 4.401 20 0 HIADHN O=C(CN1CC[C@H](C2CCOCC2)C1)N[C@@H](c1ccccc1)c1cccc(Cl)c1 ZINC000534381673 932408767 /nfs/dbraw/zinc/40/87/67/932408767.db2.gz APTZJMRVILDEQB-URXFXBBRSA-N 0 3 412.961 4.294 20 0 HIADHN Cc1cc(C)c(CC(C(=O)Nc2cccc(-n3cnnn3)c2C)C(F)(F)F)c(C)c1 ZINC000534430792 932446973 /nfs/dbraw/zinc/44/69/73/932446973.db2.gz YGCSCNASUSVXSL-QGZVFWFLSA-N 0 3 417.435 4.256 20 0 HIADHN CN(C)[C@@H](CNC(=O)N[C@@H](c1cccs1)c1ccc(F)cc1)Cc1ccccc1 ZINC000534522527 932544874 /nfs/dbraw/zinc/54/48/74/932544874.db2.gz NBBOLBQZJUXCFJ-IFMALSPDSA-N 0 3 411.546 4.449 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)c1ccc(C(=O)Nc2ccccc2)cc1 ZINC000534633294 932610646 /nfs/dbraw/zinc/61/06/46/932610646.db2.gz OOPJNKSJYFHWEJ-UHFFFAOYSA-N 0 3 403.482 4.261 20 0 HIADHN Cc1ccc(CNC(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)c(OCC(F)(F)F)c1 ZINC000534642496 932614697 /nfs/dbraw/zinc/61/46/97/932614697.db2.gz KRDWCVLYSUGBPR-QUCCMNQESA-N 0 3 421.463 4.181 20 0 HIADHN CC(C)c1ccc([C@H]2CCCN2CC(=O)N2CCC(C(=O)N(C)C(C)C)CC2)cc1 ZINC000534666856 932636636 /nfs/dbraw/zinc/63/66/36/932636636.db2.gz ZORARVLXWWRVMV-HSZRJFAPSA-N 0 3 413.606 4.052 20 0 HIADHN Cc1cc([C@@H](NC(=O)N(C)C2CCN(CCc3ccccn3)CC2)C2CC2)ccc1F ZINC000534702497 932673732 /nfs/dbraw/zinc/67/37/32/932673732.db2.gz QJEPKFMMPOIZSW-DEOSSOPVSA-N 0 3 424.564 4.329 20 0 HIADHN Cc1cc(C)c(CC(C(=O)N2CC[C@@H](C(N)=O)c3ccccc32)C(F)(F)F)c(C)c1 ZINC000534781256 932762255 /nfs/dbraw/zinc/76/22/55/932762255.db2.gz SPXGQMDBGRYTMJ-MJGOQNOKSA-N 0 3 418.459 4.339 20 0 HIADHN CCOc1ccc(F)c(NC(=O)NCC2(N3CCSCC3)CCCCC2)c1F ZINC000534781851 932763575 /nfs/dbraw/zinc/76/35/75/932763575.db2.gz ZMRMMGTYPNEPDQ-UHFFFAOYSA-N 0 3 413.534 4.237 20 0 HIADHN Fc1ccc(Br)c2c1CC[C@@H]2NC1CCN(Cc2ccncc2)CC1 ZINC000534794149 932775040 /nfs/dbraw/zinc/77/50/40/932775040.db2.gz WWEXLFZVGGACPI-IBGZPJMESA-N 0 3 404.327 4.225 20 0 HIADHN CC(C)c1nn(-c2ccc(Br)cc2)cc1CNCCOC[C@H]1CCCO1 ZINC000535001414 932883196 /nfs/dbraw/zinc/88/31/96/932883196.db2.gz MYUBJSNCOCWUEK-LJQANCHMSA-N 0 3 422.367 4.043 20 0 HIADHN COc1ccc([C@H](CNCc2cnc([C@H]3CCCO3)s2)N2CCCCC2)cc1 ZINC000535140841 932959226 /nfs/dbraw/zinc/95/92/26/932959226.db2.gz FHOHWVQTAYIKQU-LEWJYISDSA-N 0 3 401.576 4.320 20 0 HIADHN Cc1cc(C)c(CC(C(=O)Nc2ccc3c(c2)N(C)C(=O)CO3)C(F)(F)F)c(C)c1 ZINC000535159085 932976954 /nfs/dbraw/zinc/97/69/54/932976954.db2.gz LTUULOANSZUPGL-QGZVFWFLSA-N 0 3 420.431 4.327 20 0 HIADHN FC(F)(F)c1nc2nc[nH]c2c(NC[C@H](c2cccc(Cl)c2)N2CCCC2)n1 ZINC000535254532 933037974 /nfs/dbraw/zinc/03/79/74/933037974.db2.gz CDBHCISLAXAHTN-CYBMUJFWSA-N 0 3 410.831 4.226 20 0 HIADHN CN(C)[C@@H](CNC(=O)N(CCc1ccccc1)Cc1ccncc1)Cc1ccccc1 ZINC000535256456 933039807 /nfs/dbraw/zinc/03/98/07/933039807.db2.gz BHYIBFSFYSOESK-RUZDIDTESA-N 0 3 416.569 4.009 20 0 HIADHN COc1ccc(CN(C(=O)NC[C@H](Cc2ccccc2)N(C)C)[C@@H](C)C2CC2)cc1 ZINC000535260739 933040827 /nfs/dbraw/zinc/04/08/27/933040827.db2.gz KEGOLGOGICNGDG-CVDCTZTESA-N 0 3 409.574 4.178 20 0 HIADHN Cc1ccc(C[C@H](NC(=O)NC[C@@H](Cc2ccccc2)N(C)C)c2ccccn2)cc1 ZINC000535263390 933041690 /nfs/dbraw/zinc/04/16/90/933041690.db2.gz YTOVBHIGCVFFBN-NOZRDPDXSA-N 0 3 416.569 4.146 20 0 HIADHN O=C(Nc1cccc2c1CN(c1ccccn1)C2)c1ccc(Nc2ccncc2)cc1 ZINC000535289313 933053114 /nfs/dbraw/zinc/05/31/14/933053114.db2.gz PBCBXVSJPAFNCV-UHFFFAOYSA-N 0 3 407.477 4.415 20 0 HIADHN CN1CC[C@H](NC(=O)NCc2cc(Cl)ccc2OC(F)F)[C@H]1c1ccccc1 ZINC000535358931 933090975 /nfs/dbraw/zinc/09/09/75/933090975.db2.gz WMRIPQUNUDWAQU-FUHWJXTLSA-N 0 3 409.864 4.186 20 0 HIADHN CN(Cc1cc(Br)cs1)C(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000535393362 933112405 /nfs/dbraw/zinc/11/24/05/933112405.db2.gz BYPIILPWNFXGHR-SJORKVTESA-N 0 3 408.365 4.097 20 0 HIADHN CCOc1cc2c(cc1[C@@H]1C[C@@H]1C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1)O[C@@H](C)C2 ZINC000535468022 933158289 /nfs/dbraw/zinc/15/82/89/933158289.db2.gz GWXVZHXOKRZWGX-LEBJRGPHSA-N 0 3 420.553 4.074 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)Nc2cc3c(cc2Cl)OCO3)CC1 ZINC000535471285 933161709 /nfs/dbraw/zinc/16/17/09/933161709.db2.gz CUIXWNSDUIVQIE-UHFFFAOYSA-N 0 3 401.894 4.197 20 0 HIADHN COc1ccc([C@H](CNC(=O)Nc2cc3c(cc2Cl)OCO3)N2CCCC2)cc1 ZINC000535474811 933166084 /nfs/dbraw/zinc/16/60/84/933166084.db2.gz JGSZHIKRPLLEAC-SFHVURJKSA-N 0 3 417.893 4.036 20 0 HIADHN C[C@H](CNC(=O)c1oc2ccccc2c1CN(C)C)c1nc(-c2ccccc2)no1 ZINC000535548458 933237401 /nfs/dbraw/zinc/23/74/01/933237401.db2.gz NYHJDKNUYIYCEW-OAHLLOKOSA-N 0 3 404.470 4.078 20 0 HIADHN CSc1nnc(CCCNCc2cc(F)ccc2Br)n1CC(C)C ZINC000535617710 933270612 /nfs/dbraw/zinc/27/06/12/933270612.db2.gz PZLSCHMLPPFCJD-UHFFFAOYSA-N 0 3 415.376 4.280 20 0 HIADHN CO[C@@H](C)c1noc(CN2CCCN(Cc3cccc(-c4ccccc4)c3)CC2)n1 ZINC000535802226 933398006 /nfs/dbraw/zinc/39/80/06/933398006.db2.gz RWPHQMLDGLEFCP-IBGZPJMESA-N 0 3 406.530 4.152 20 0 HIADHN CC(C)(C)n1cc(CN2CCC[C@@H](Cn3ccnn3)C2)c(-c2ccccc2Cl)n1 ZINC000535806021 933401257 /nfs/dbraw/zinc/40/12/57/933401257.db2.gz AOCBLDMVTKUZSP-QGZVFWFLSA-N 0 3 412.969 4.462 20 0 HIADHN COc1ccc(C(=O)N(CCCc2ccccc2)CCN(C)C)cc1-c1ccccn1 ZINC000535866118 933449115 /nfs/dbraw/zinc/44/91/15/933449115.db2.gz LWBKFJYTUTXBBP-UHFFFAOYSA-N 0 3 417.553 4.394 20 0 HIADHN Cc1cnc(CCN(C)C[C@H](O)CO[C@H](c2ccccc2)c2ccc(C)cc2)s1 ZINC000535869135 933450967 /nfs/dbraw/zinc/45/09/67/933450967.db2.gz DIQQZBAVUHXAHJ-LADGPHEKSA-N 0 3 410.583 4.401 20 0 HIADHN Cc1nc2ccccc2n1C[C@H]1CCCN1CC(=O)N[C@H]1CCCc2ccccc21 ZINC000535965812 933527863 /nfs/dbraw/zinc/52/78/63/933527863.db2.gz NDHHKRVCPFDQHW-IRLDBZIGSA-N 0 3 402.542 4.003 20 0 HIADHN Cc1nc2ccccc2n1C[C@@H]1CCCN1CC(=O)N[C@@H]1CCCc2ccccc21 ZINC000535965813 933528298 /nfs/dbraw/zinc/52/82/98/933528298.db2.gz NDHHKRVCPFDQHW-RBBKRZOGSA-N 0 3 402.542 4.003 20 0 HIADHN CCc1ccc(-c2nc(CC(=O)NC[C@@H](Cc3ccccc3)N(C)C)cs2)cc1 ZINC000536017454 933574421 /nfs/dbraw/zinc/57/44/21/933574421.db2.gz MIKSUIHVVKPOJP-JOCHJYFZSA-N 0 3 407.583 4.204 20 0 HIADHN CN1CC[C@@H](NC(=O)NCc2ccc(Oc3ccc(F)cc3)nc2)[C@@H]1c1ccccc1 ZINC000536094418 933644684 /nfs/dbraw/zinc/64/46/84/933644684.db2.gz FTCRQAUMYVKATN-GGAORHGYSA-N 0 3 420.488 4.258 20 0 HIADHN Cc1nc(-c2ccccc2)sc1CNC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000536095401 933645991 /nfs/dbraw/zinc/64/59/91/933645991.db2.gz LDWAUYRMMJTZQX-CTNGQTDRSA-N 0 3 406.555 4.363 20 0 HIADHN CN(C(=O)CN[C@H](c1ccc2c(c1)OCCO2)C1CC1)[C@H]1CCCc2ccccc21 ZINC000537288183 933698357 /nfs/dbraw/zinc/69/83/57/933698357.db2.gz MDWIGIUIFNXSIY-OFVILXPXSA-N 0 3 406.526 4.035 20 0 HIADHN COc1ccc([C@H](C)NC2CCN(C(=O)c3ccoc3)CC2)c(Br)c1 ZINC000537296054 933702319 /nfs/dbraw/zinc/70/23/19/933702319.db2.gz QYIOELFWNKVWTA-ZDUSSCGKSA-N 0 3 407.308 4.006 20 0 HIADHN CCC1(CC)[C@H](N[C@@H](c2ccccc2)c2cccc(S(C)(=O)=O)c2)C[C@H]1OC ZINC000537296953 933703210 /nfs/dbraw/zinc/70/32/10/933703210.db2.gz ZMPPGDASEHGAEG-VSKRKVRLSA-N 0 3 401.572 4.363 20 0 HIADHN C[C@@H](N[C@@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O)c1ccc2c(c1)OCO2 ZINC000537346660 933728793 /nfs/dbraw/zinc/72/87/93/933728793.db2.gz BYVDQLDLIQFVQO-RDTXWAMCSA-N 0 3 420.431 4.276 20 0 HIADHN CCC(CC)n1nc(C(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)cc1C ZINC000537356706 933733471 /nfs/dbraw/zinc/73/34/71/933733471.db2.gz KIJIWHGIIPOGRT-OAQYLSRUSA-N 0 3 420.561 4.448 20 0 HIADHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc(C)n(-c2ccc(Cl)cc2Cl)n1 ZINC000537358092 933734562 /nfs/dbraw/zinc/73/45/62/933734562.db2.gz OKQKMBVPPBFINY-CVEARBPZSA-N 0 3 407.345 4.186 20 0 HIADHN CCCCOC1CCN([C@H]2CCCN(Cc3cccc(C(F)(F)F)c3)C2=O)CC1 ZINC000537361887 933737735 /nfs/dbraw/zinc/73/77/35/933737735.db2.gz BVEOBMXRMOKMNP-FQEVSTJZSA-N 0 3 412.496 4.478 20 0 HIADHN C[C@@]1(CCCO)CCCN1CC(=O)N[C@@H](c1ccccc1)c1ccc(Cl)cc1 ZINC000537409806 933763008 /nfs/dbraw/zinc/76/30/08/933763008.db2.gz AKNJJCKWSVBFTG-GOTSBHOMSA-N 0 3 400.950 4.173 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)c1cc(C)n(C2CCCCC2)n1 ZINC000537421495 933769819 /nfs/dbraw/zinc/76/98/19/933769819.db2.gz NWGZFEBPLUNUSK-QFIPXVFZSA-N 0 3 409.578 4.218 20 0 HIADHN CC(C)N1CC[C@H](NC(=O)N[C@@H]2CCCc3cn[nH]c32)[C@H]1c1ccc(Cl)c(F)c1 ZINC000537453969 933779884 /nfs/dbraw/zinc/77/98/84/933779884.db2.gz HMTPPWVECDRUCJ-WSTZPKSXSA-N 0 3 419.932 4.103 20 0 HIADHN CSc1ccc([C@H](CNC(=O)CCCc2nnc(-c3ccccc3)o2)N(C)C)cc1 ZINC000562889905 945140939 /nfs/dbraw/zinc/14/09/39/945140939.db2.gz MXBPWXWDDUXLBX-FQEVSTJZSA-N 0 3 424.570 4.200 20 0 HIADHN CC(C)(CNC(=O)Nc1ccc(Oc2cccnc2)nc1)N1CCc2ccccc2C1 ZINC000563239183 945159809 /nfs/dbraw/zinc/15/98/09/945159809.db2.gz HQTMFNDDCXTTCW-UHFFFAOYSA-N 0 3 417.513 4.227 20 0 HIADHN COc1ccc([C@H](CO)N(C)Cc2ccc(-n3ccc(C(F)(F)F)n3)cc2)cc1 ZINC000537625948 938338526 /nfs/dbraw/zinc/33/85/26/938338526.db2.gz XXEYTODSYGSZOL-IBGZPJMESA-N 0 3 405.420 4.065 20 0 HIADHN CCOc1cc(CN2CCSC3(CCCCC3)C2)ccc1O[C@@H](C)C(=O)N(C)C ZINC000537649585 938346388 /nfs/dbraw/zinc/34/63/88/938346388.db2.gz PFHIDBFGPPOALS-SFHVURJKSA-N 0 3 420.619 4.193 20 0 HIADHN COCc1cccc(OCC2(CN(C)[C@H](C)c3ccc([S@@](C)=O)cc3)CC2)c1 ZINC000537677761 938351968 /nfs/dbraw/zinc/35/19/68/938351968.db2.gz NFHBPDQONPUVRH-KWMCUTETSA-N 0 3 401.572 4.422 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)Cc2c[nH]c3cc(Cl)ccc23)cc1 ZINC000537730941 938364943 /nfs/dbraw/zinc/36/49/43/938364943.db2.gz PXBCYKJLZDGIEO-QFIPXVFZSA-N 0 3 411.933 4.326 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)Nc2cn(CC(C)C)nc2C(F)F)N(C)C)cc1 ZINC000537914025 938411250 /nfs/dbraw/zinc/41/12/50/938411250.db2.gz MUPLEDOPMQWGBF-GOSISDBHSA-N 0 3 407.509 4.464 20 0 HIADHN COc1cc(NC(C)=O)ccc1[C@H](C)N[C@@H]1CCN(c2ccc(Cl)c(F)c2)C1 ZINC000537941646 938425273 /nfs/dbraw/zinc/42/52/73/938425273.db2.gz YPSUATVKKJDWDB-XJKSGUPXSA-N 0 3 405.901 4.376 20 0 HIADHN COc1cc([C@H](C)NCc2n[nH]c(-c3ccc(Br)cc3)n2)ccc1F ZINC000537946699 938427620 /nfs/dbraw/zinc/42/76/20/938427620.db2.gz QGMHZAACIXQHJL-NSHDSACASA-N 0 3 405.271 4.233 20 0 HIADHN COc1cc([C@H](C)NCc2nc(-c3ccc(Br)cc3)n[nH]2)ccc1F ZINC000537946699 938427625 /nfs/dbraw/zinc/42/76/25/938427625.db2.gz QGMHZAACIXQHJL-NSHDSACASA-N 0 3 405.271 4.233 20 0 HIADHN C[C@H]1Cc2ccccc2[C@@H]1NCc1ccc(Br)cc1N1CCOCC1 ZINC000537957343 938432523 /nfs/dbraw/zinc/43/25/23/938432523.db2.gz BHHCHDLMXAULIR-YCRPNKLZSA-N 0 3 401.348 4.309 20 0 HIADHN C[C@@H](NC[C@H](O)COc1ccccc1Br)c1ccc2ccccc2n1 ZINC000537959352 938434614 /nfs/dbraw/zinc/43/46/14/938434614.db2.gz CSUYDELJLAJUQW-ZBFHGGJFSA-N 0 3 401.304 4.088 20 0 HIADHN COc1ccc(C[C@H](NCCCS(C)(=O)=O)c2cc(Cl)ccc2Cl)cc1 ZINC000537971675 938442072 /nfs/dbraw/zinc/44/20/72/938442072.db2.gz BRPMQILMGZQAEA-IBGZPJMESA-N 0 3 416.370 4.310 20 0 HIADHN CC[C@H](N[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O)c1ccc(OC(F)F)cc1 ZINC000537982029 938447393 /nfs/dbraw/zinc/44/73/93/938447393.db2.gz HQBPYTCGLHHLST-VQTJNVASSA-N 0 3 404.457 4.138 20 0 HIADHN Cc1cccc(NC(=O)C[C@@H](C)NCc2cccc(C(=O)NCc3ccco3)c2)c1C ZINC000537986353 938449062 /nfs/dbraw/zinc/44/90/62/938449062.db2.gz IOFWJCYJFRIKBU-GOSISDBHSA-N 0 3 419.525 4.333 20 0 HIADHN CC[C@@H](N[C@@H](C)c1ccc(S(=O)(=O)N(C)C)cc1)c1ccc(OC(F)F)cc1 ZINC000537991279 938452178 /nfs/dbraw/zinc/45/21/78/938452178.db2.gz QSBLUVUJDQCJMC-IFXJQAMLSA-N 0 3 412.502 4.340 20 0 HIADHN CCC[C@H](NCc1ccc(S(=O)(=O)N2CCCC2)cc1)c1ccc(OC)cc1 ZINC000537990998 938452474 /nfs/dbraw/zinc/45/24/74/938452474.db2.gz PMSOAUZPWIHDDH-QFIPXVFZSA-N 0 3 402.560 4.111 20 0 HIADHN CCCN1c2ccc(NC(=O)NC[C@H](c3ccccc3)N3CCCC3)cc2CCC1=O ZINC000538031534 938472935 /nfs/dbraw/zinc/47/29/35/938472935.db2.gz MJDLBTWCAJWVJL-HSZRJFAPSA-N 0 3 420.557 4.334 20 0 HIADHN CN1CC[C@H](NC(=O)N[C@@H]2CCO[C@@H]2c2ccc(Cl)c(F)c2)[C@H]1c1ccccc1 ZINC000538043132 938479461 /nfs/dbraw/zinc/47/94/61/938479461.db2.gz BGOZXQGVQMEOCQ-DOIPELPJSA-N 0 3 417.912 4.054 20 0 HIADHN Cc1cc(Br)cc2c1CN(C(=O)Nc1cccc(CN(C)C)c1)CC2 ZINC000538139548 938517115 /nfs/dbraw/zinc/51/71/15/938517115.db2.gz SSXSORKCCBURGU-UHFFFAOYSA-N 0 3 402.336 4.409 20 0 HIADHN COc1ccccc1[C@@H](C)NC(=O)[C@H](C)N[C@H](C)c1ccc(Br)cc1 ZINC000538143015 938519120 /nfs/dbraw/zinc/51/91/20/938519120.db2.gz DECZLVFSEXKFGA-KFWWJZLASA-N 0 3 405.336 4.374 20 0 HIADHN CC[C@@H](NCC(=O)Nc1cc(C(F)(F)F)ccc1-n1cncn1)c1ccc(C)cc1 ZINC000538149611 938522488 /nfs/dbraw/zinc/52/24/88/938522488.db2.gz CZUBLLTVYQOBQL-QGZVFWFLSA-N 0 3 417.435 4.274 20 0 HIADHN CC[C@@H](NCC(=O)Nc1ccccc1I)c1ccc(C)cc1 ZINC000538156425 938527279 /nfs/dbraw/zinc/52/72/79/938527279.db2.gz YNRNHZNWUPGRAW-MRXNPFEDSA-N 0 3 408.283 4.279 20 0 HIADHN C[C@@H](NCC(=O)N(C)[C@@H](C)c1cc2ccccc2o1)c1ccccc1-n1cccn1 ZINC000538159321 938528721 /nfs/dbraw/zinc/52/87/21/938528721.db2.gz BCHCGSWMCAPKGA-MSOLQXFVSA-N 0 3 402.498 4.489 20 0 HIADHN Cc1cc(N2CCCC2)ccc1NC(=O)CN[C@H](C)c1ccccc1-n1cccn1 ZINC000538158488 938528865 /nfs/dbraw/zinc/52/88/65/938528865.db2.gz BWXMECKDJIRCIB-LJQANCHMSA-N 0 3 403.530 4.070 20 0 HIADHN COc1ccc(C[C@@H](NCC(=O)N[C@@H](C)c2ccccc2)c2ccccc2)cc1OC ZINC000538159513 938529494 /nfs/dbraw/zinc/52/94/94/938529494.db2.gz IFYBSYDYNYXLSP-WMZHIEFXSA-N 0 3 418.537 4.455 20 0 HIADHN C[C@H](N[C@@H](C)c1cccc(-n2cccn2)c1)C(=O)Nc1ccccc1Br ZINC000538189309 938544823 /nfs/dbraw/zinc/54/48/23/938544823.db2.gz YPKFIINDRGBDPJ-GJZGRUSLSA-N 0 3 413.319 4.313 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)N[C@H]1CCCC[C@H]1C)c1ccc(NC(=O)c2ccncc2)cc1 ZINC000538191681 938547346 /nfs/dbraw/zinc/54/73/46/938547346.db2.gz WNUMVLLZVSSRKC-QLDGJZPUSA-N 0 3 408.546 4.068 20 0 HIADHN C[C@@H](NCc1ccc(I)cc1)c1cccc(N2CCCC2=O)c1 ZINC000538208597 938556196 /nfs/dbraw/zinc/55/61/96/938556196.db2.gz RMOHHQJEHUITNK-CQSZACIVSA-N 0 3 420.294 4.269 20 0 HIADHN COC(=O)C1CCN(C(=O)CN[C@H](C)c2ccccc2-c2ccc(Cl)cc2)CC1 ZINC000538215192 938559122 /nfs/dbraw/zinc/55/91/22/938559122.db2.gz OJHGLEVUZHRUDH-MRXNPFEDSA-N 0 3 414.933 4.069 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(-c2cccnc2)cc1)C(=O)Nc1ccc2c(c1)OCCO2 ZINC000538223517 938563364 /nfs/dbraw/zinc/56/33/64/938563364.db2.gz PFOCNKFXURBSGB-IAGOWNOFSA-N 0 3 403.482 4.198 20 0 HIADHN COCCOc1ccc(CNC(=O)CNC2(c3cccc(Cl)c3)CCCC2)cc1 ZINC000538222879 938563692 /nfs/dbraw/zinc/56/36/92/938563692.db2.gz CYHPBBSPHZLDQW-UHFFFAOYSA-N 0 3 416.949 4.041 20 0 HIADHN O=C(CN[C@H](C[C@H]1CCOC1)c1ccccc1)NCC1(c2ccccc2)CCCC1 ZINC000538225883 938565128 /nfs/dbraw/zinc/56/51/28/938565128.db2.gz JMLAHBMRZMQACN-ZJSXRUAMSA-N 0 3 406.570 4.372 20 0 HIADHN O=C(CN[C@H](C[C@@H]1CCOC1)c1ccccc1)NCc1ccccc1OC1CCCC1 ZINC000538233325 938567049 /nfs/dbraw/zinc/56/70/49/938567049.db2.gz QJVBDCNNYAZUKX-GBXCKJPGSA-N 0 3 422.569 4.382 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)N[C@@H](C)C(=O)Nc2ccccc2OC(F)F)cc1 ZINC000538262285 938577903 /nfs/dbraw/zinc/57/79/03/938577903.db2.gz QXKRFOIGXNNREP-CABCVRRESA-N 0 3 414.456 4.460 20 0 HIADHN C[C@H](NCC(=O)Nc1ccnn1CC1CCCCC1)c1cccc(N2CCCC2)c1 ZINC000538277549 938581523 /nfs/dbraw/zinc/58/15/23/938581523.db2.gz VBKBMIVPKYJFLK-IBGZPJMESA-N 0 3 409.578 4.353 20 0 HIADHN CCOc1ccc([C@H](C)NC(=O)CN[C@H](c2ccc(F)c(C)c2)C2CC2)cc1OC ZINC000538320741 938591666 /nfs/dbraw/zinc/59/16/66/938591666.db2.gz NOPNOQHRWMNZAX-FYSMJZIKSA-N 0 3 414.521 4.460 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)c1ccc(-c2noc(C(F)F)n2)cc1 ZINC000538361705 938603913 /nfs/dbraw/zinc/60/39/13/938603913.db2.gz VJZLDXGWPHIYQE-UHFFFAOYSA-N 0 3 418.419 4.017 20 0 HIADHN CC[C@@H]1c2ccsc2CCN1C(=O)CN[C@H](c1ccc2c(c1)OCCO2)C1CC1 ZINC000538390181 938608763 /nfs/dbraw/zinc/60/87/63/938608763.db2.gz ODKNVKGCCBJTOP-JPYJTQIMSA-N 0 3 412.555 4.096 20 0 HIADHN Cc1c(Cl)cccc1NC(=O)[C@H](C)N[C@H](c1ccc2c(c1)OCCO2)C1CC1 ZINC000538389845 938608951 /nfs/dbraw/zinc/60/89/51/938608951.db2.gz JMIQNGAWHGQRTJ-QKKBWIMNSA-N 0 3 400.906 4.488 20 0 HIADHN Cc1nn(C(C)(C)C)c(C)c1CN[C@@H](C)CC(=O)Nc1cccc(N2CCCC2)c1 ZINC000538395691 938610734 /nfs/dbraw/zinc/61/07/34/938610734.db2.gz LAKJMDWYEIULGJ-KRWDZBQOSA-N 0 3 411.594 4.362 20 0 HIADHN COC(=O)c1cc(CNCCCOc2ncc(C(F)(F)F)cc2Cl)oc1C ZINC000538422167 938616748 /nfs/dbraw/zinc/61/67/48/938616748.db2.gz IFVLDLRVVGMJMT-UHFFFAOYSA-N 0 3 406.788 4.001 20 0 HIADHN O=C1[C@@H](N2CCC(OCC3CC3)CC2)CCCN1Cc1cccc(C(F)(F)F)c1 ZINC000538468877 938629332 /nfs/dbraw/zinc/62/93/32/938629332.db2.gz SRXQPIWHADNDLS-FQEVSTJZSA-N 0 3 410.480 4.087 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N[C@@H]1C[C@@H]2CCC(C)(C)c3cccc1c32 ZINC000538483790 938632201 /nfs/dbraw/zinc/63/22/01/938632201.db2.gz COGLODPAINKRRV-PGRDOPGGSA-N 0 3 419.569 4.411 20 0 HIADHN O=C(CCc1ccccc1)N1CC[C@H](N[C@H]2CCCOc3cc4c(cc32)CCC4)C1 ZINC000538560760 938649600 /nfs/dbraw/zinc/64/96/00/938649600.db2.gz VAKWTIYFWMKNKW-UPVQGACJSA-N 0 3 404.554 4.212 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)c1cnn(Cc2ccccc2Cl)c1)c1ccco1 ZINC000563472591 945194133 /nfs/dbraw/zinc/19/41/33/945194133.db2.gz QARCLKLFHKPZKP-DNVCBOLYSA-N 0 3 400.910 4.037 20 0 HIADHN Cc1ccc(NC(=O)CN[C@@H]2CCN(C(C)C)[C@H]2c2ccc(F)c(F)c2)c(C)c1 ZINC000563472881 945194602 /nfs/dbraw/zinc/19/46/02/945194602.db2.gz UEFVJMOWLHLGBB-GGAORHGYSA-N 0 3 401.501 4.334 20 0 HIADHN C[C@@]1(NCC(=O)NCc2cccc(COCc3ccco3)c2)CCCc2ccccc21 ZINC000538707739 938687682 /nfs/dbraw/zinc/68/76/82/938687682.db2.gz PLGLSVBGZVMGRZ-AREMUKBSSA-N 0 3 418.537 4.454 20 0 HIADHN CCC1(O)CCN(Cc2cn(Cc3ccccc3)nc2-c2ccc(OC)cc2)CC1 ZINC000538721026 938690649 /nfs/dbraw/zinc/69/06/49/938690649.db2.gz KLVSDBJFTJBMIW-UHFFFAOYSA-N 0 3 405.542 4.344 20 0 HIADHN CCOc1c(Br)cc(Br)cc1CN(C)C[C@@H]1CCOC1 ZINC000538763295 938705158 /nfs/dbraw/zinc/70/51/58/938705158.db2.gz SQPWWSLTQLCSGX-NSHDSACASA-N 0 3 407.146 4.079 20 0 HIADHN COc1ccccc1COC1CCN(C[C@H](O)COc2ccc3ccccc3c2)CC1 ZINC000538786784 938711357 /nfs/dbraw/zinc/71/13/57/938711357.db2.gz MWPPMXFBQCRGNS-QHCPKHFHSA-N 0 3 421.537 4.269 20 0 HIADHN Cc1cc(NC(=O)N[C@H]2CC23CCCCC3)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000538947557 938744939 /nfs/dbraw/zinc/74/49/39/938744939.db2.gz CUFMLBNMGKODET-RTWAWAEBSA-N 0 3 407.562 4.483 20 0 HIADHN Cc1cc2ncc([C@H](C)NCCNc3ncc(C(F)(F)F)cc3Cl)c(C)n2n1 ZINC000538985986 938760125 /nfs/dbraw/zinc/76/01/25/938760125.db2.gz YUMQZBOGZZWLMP-NSHDSACASA-N 0 3 412.847 4.176 20 0 HIADHN Nc1nc(CCN2CCC(Cc3cccnc3)CC2)nc2sc3c(c21)CCCC3 ZINC000538998746 938764554 /nfs/dbraw/zinc/76/45/54/938764554.db2.gz ZYTBZVLOORSICX-UHFFFAOYSA-N 0 3 407.587 4.045 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)Nc1cnn(C(C)(C)C)c1 ZINC000539009053 938767292 /nfs/dbraw/zinc/76/72/92/938767292.db2.gz LGVKYUIPOXSPLQ-UHFFFAOYSA-N 0 3 411.472 4.253 20 0 HIADHN CCc1ccc([C@@H](CO)N[C@@H](C)CC(=O)Nc2cccc(Br)c2)cc1 ZINC000539040083 938778087 /nfs/dbraw/zinc/77/80/87/938778087.db2.gz CDCYOPMFFAFGFG-IFXJQAMLSA-N 0 3 405.336 4.052 20 0 HIADHN COCCOc1ccc([C@H](C)N[C@H]2CC(=O)N(C)[C@H]2c2ccc(Cl)c(F)c2)cc1 ZINC000539042316 938779115 /nfs/dbraw/zinc/77/91/15/938779115.db2.gz FFLMZUXBIYYZHQ-FSJXIACGSA-N 0 3 420.912 4.127 20 0 HIADHN C[C@@H]1CCc2c(F)cccc2[C@H]1NCc1ccccc1CS(=O)(=O)N1CCCC1 ZINC000539043218 938779643 /nfs/dbraw/zinc/77/96/43/938779643.db2.gz GAVIHTSDXSLKIU-HXOBKFHXSA-N 0 3 416.562 4.165 20 0 HIADHN Cc1cccc(NC(=O)C[C@H](C)N[C@H]2CC(=O)N(C)[C@@H]2c2ccc(Cl)cc2)c1C ZINC000539051825 938783960 /nfs/dbraw/zinc/78/39/60/938783960.db2.gz BXXYTPKYDNDUGG-RWAHWCJQSA-N 0 3 413.949 4.236 20 0 HIADHN COc1cc(OC)c([C@@H](C)NC[C@@H](c2ccc(OC)c(OC)c2)N(C)C)cc1Cl ZINC000539072234 938793825 /nfs/dbraw/zinc/79/38/25/938793825.db2.gz OOHYPFJWBAQWNM-KDOFPFPSSA-N 0 3 422.953 4.328 20 0 HIADHN O=C1c2ccccc2C(=O)N1[C@@H]1CCCC[C@H](NCc2coc(-c3ccccc3)n2)C1 ZINC000539087080 938800092 /nfs/dbraw/zinc/80/00/92/938800092.db2.gz QWJMJFIZFCGKAI-AZUAARDMSA-N 0 3 415.493 4.429 20 0 HIADHN COC[C@@H](N[C@@H](C)CC(=O)Nc1ccc(Br)cc1)c1ccc(F)cc1 ZINC000539088557 938800259 /nfs/dbraw/zinc/80/02/59/938800259.db2.gz VTWQQAWLLJFRBT-SCLBCKFNSA-N 0 3 409.299 4.283 20 0 HIADHN COCCOc1ccc([C@@H](C)N[C@H](c2ccc3c(c2)OCCO3)C2CC2)cc1OC ZINC000539089750 938800358 /nfs/dbraw/zinc/80/03/58/938800358.db2.gz GIOPXHPZBPYTTA-GYCJOSAFSA-N 0 3 413.514 4.294 20 0 HIADHN C[C@H](NCc1ccc(-n2cncn2)cc1)c1cccc(OCc2cn3ccccc3n2)c1 ZINC000539088662 938800379 /nfs/dbraw/zinc/80/03/79/938800379.db2.gz XPYAJOANSBICPO-IBGZPJMESA-N 0 3 424.508 4.345 20 0 HIADHN CCCOc1ccc([C@@H](C)NCc2ccc(S(=O)(=O)N3CCCC3)cc2)cc1 ZINC000539090329 938800764 /nfs/dbraw/zinc/80/07/64/938800764.db2.gz OQPWGGBXPJDYLV-GOSISDBHSA-N 0 3 402.560 4.111 20 0 HIADHN Cc1nc(-c2ccccc2F)sc1[C@H](C)NCc1ccc(NS(C)(=O)=O)cc1 ZINC000539091766 938801378 /nfs/dbraw/zinc/80/13/78/938801378.db2.gz KNSPYDZPWXFKPM-ZDUSSCGKSA-N 0 3 419.547 4.480 20 0 HIADHN CCOc1ccc([C@H](C)N[C@@H](C)c2cccc(N3CCCS3(=O)=O)c2)cc1OC ZINC000539093981 938802061 /nfs/dbraw/zinc/80/20/61/938802061.db2.gz QPEYIKWTVWCQSU-IRXDYDNUSA-N 0 3 418.559 4.046 20 0 HIADHN C[C@@H](NCc1nc(-c2ccc(F)cc2)n[nH]1)c1ccc(I)cc1 ZINC000539119410 938805566 /nfs/dbraw/zinc/80/55/66/938805566.db2.gz BYMSDXGUEPJZLX-LLVKDONJSA-N 0 3 422.245 4.066 20 0 HIADHN C[C@@H]([NH2+]Cc1nnc(-c2ccc(F)cc2)[n-]1)c1ccc(I)cc1 ZINC000539119410 938805567 /nfs/dbraw/zinc/80/55/67/938805567.db2.gz BYMSDXGUEPJZLX-LLVKDONJSA-N 0 3 422.245 4.066 20 0 HIADHN CCN1CCCN(C(=O)Nc2ccc(OCC(F)(F)F)c(C(F)(F)F)c2)CC1 ZINC000539153185 938812415 /nfs/dbraw/zinc/81/24/15/938812415.db2.gz LYIZUSMRYAIUPL-UHFFFAOYSA-N 0 3 413.362 4.206 20 0 HIADHN Cc1cc(NC(=O)NCCc2sccc2C)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000539155520 938813109 /nfs/dbraw/zinc/81/31/09/938813109.db2.gz XZPZXBQHEMCOQK-HXUWFJFHSA-N 0 3 423.586 4.373 20 0 HIADHN C[C@H](N[C@@H](c1ccc(Br)cc1)C1CCC1)c1cccc(S(N)(=O)=O)c1 ZINC000539216834 938820287 /nfs/dbraw/zinc/82/02/87/938820287.db2.gz KLNSVWKKKQUCNM-ORAYPTAESA-N 0 3 423.376 4.289 20 0 HIADHN CN(CCN[C@H](CN1CCCC1=O)c1cccc(C(F)(F)F)c1)c1ccccc1 ZINC000539223312 938821063 /nfs/dbraw/zinc/82/10/63/938821063.db2.gz YPDDUMOCHJEFBA-HXUWFJFHSA-N 0 3 405.464 4.095 20 0 HIADHN Cc1ccccc1CCNC(=O)[C@@H](C)N[C@H](C)c1ccc(OCc2cccnc2)cc1 ZINC000539226456 938821738 /nfs/dbraw/zinc/82/17/38/938821738.db2.gz NYZYIALBJIZLRI-NHCUHLMSSA-N 0 3 417.553 4.367 20 0 HIADHN COc1ccc(NC(=O)[C@H](NC[C@@H]2CCC[C@@H]2OC)c2ccccc2)cc1Cl ZINC000539239472 938823581 /nfs/dbraw/zinc/82/35/81/938823581.db2.gz OLGZXQWTJIUWSA-NBHGPNQESA-N 0 3 402.922 4.433 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)CN[C@H](c1ccc2c(c1)OCCO2)C(C)C ZINC000539242256 938824222 /nfs/dbraw/zinc/82/42/22/938824222.db2.gz ZOARPMSUQHWQHZ-NRFANRHFSA-N 0 3 404.894 4.045 20 0 HIADHN COCc1ccccc1CNC(=O)CN[C@H](c1cccc(C(F)(F)F)c1)C(C)C ZINC000539257303 938828081 /nfs/dbraw/zinc/82/80/81/938828081.db2.gz RGZQKGJBRCTEHZ-NRFANRHFSA-N 0 3 408.464 4.455 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(OCC(F)(F)F)cc1)C(=O)N1CCc2ccccc2C1 ZINC000539264414 938829772 /nfs/dbraw/zinc/82/97/72/938829772.db2.gz DDXIZZKJINSQOO-JKSUJKDBSA-N 0 3 406.448 4.252 20 0 HIADHN Cc1cccc([C@H](C)NCC(=O)N2CCC[C@H]2c2ccc3c(c2)OCCCO3)c1C ZINC000539286328 938833485 /nfs/dbraw/zinc/83/34/85/938833485.db2.gz HYZLHXWONIQTLH-UGKGYDQZSA-N 0 3 408.542 4.479 20 0 HIADHN Cc1cccc([C@@H](C)NCC(=O)N2CCC[C@H]2c2ccc3c(c2)OCCCO3)c1C ZINC000539286322 938833489 /nfs/dbraw/zinc/83/34/89/938833489.db2.gz HYZLHXWONIQTLH-KNQAVFIVSA-N 0 3 408.542 4.479 20 0 HIADHN CN(Cc1cc(Cl)cc(Cl)c1)C(=O)CN[C@@H](c1ccccc1)[C@@H]1CCOC1 ZINC000539290058 938834500 /nfs/dbraw/zinc/83/45/00/938834500.db2.gz UNQIYTAOVAPCCC-UTKZUKDTSA-N 0 3 407.341 4.319 20 0 HIADHN Cc1ccc(-c2csc(NC(=O)CN[C@H](c3ccccc3)[C@H]3CCOC3)n2)cc1 ZINC000539298349 938836178 /nfs/dbraw/zinc/83/61/78/938836178.db2.gz PATIVFILENJFRC-SIKLNZKXSA-N 0 3 407.539 4.424 20 0 HIADHN CC(C)[C@@H](NCCC(=O)Nc1ccc(C(N)=O)c(Cl)c1)c1ccc(F)cc1F ZINC000539325876 938841880 /nfs/dbraw/zinc/84/18/80/938841880.db2.gz PMWUQLQOSXGYTC-LJQANCHMSA-N 0 3 409.864 4.033 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(-c2cccnc2)cc1)C(=O)N[C@H]1CCOc2ccccc21 ZINC000539332284 938843232 /nfs/dbraw/zinc/84/32/32/938843232.db2.gz OYMFYBPVIPPLTL-BSRJHKFKSA-N 0 3 401.510 4.428 20 0 HIADHN COc1cc(NC(=O)CN[C@H](C[C@H]2CCOC2)c2ccccc2)c(OC)cc1Cl ZINC000539334508 938843471 /nfs/dbraw/zinc/84/34/71/938843471.db2.gz ZMTVDHPFIFDOHW-CRAIPNDOSA-N 0 3 418.921 4.053 20 0 HIADHN C[C@@H](NCC(=O)N(Cc1ccccc1)[C@H](C)C1CC1)c1ccc(-n2cccn2)cc1 ZINC000539337347 938844391 /nfs/dbraw/zinc/84/43/91/938844391.db2.gz POBNEELEIANEES-WOJBJXKFSA-N 0 3 402.542 4.350 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)N[C@@H](C)C(=O)Nc2ccc(OC(F)F)cc2)cc1 ZINC000539368353 938849836 /nfs/dbraw/zinc/84/98/36/938849836.db2.gz OQSWPMRIGWMIJW-GJZGRUSLSA-N 0 3 414.456 4.460 20 0 HIADHN CCOC(=O)c1nn(-c2ccccc2)cc1CNC[C@@H](c1cccs1)N1CCCC1 ZINC000539383400 938852481 /nfs/dbraw/zinc/85/24/81/938852481.db2.gz KZCJVNRBBMNFAY-FQEVSTJZSA-N 0 3 424.570 4.037 20 0 HIADHN O=C(Nc1ccc(-n2ncc3ccccc32)cc1)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000539420475 938857949 /nfs/dbraw/zinc/85/79/49/938857949.db2.gz VVXPRAPYEXTLGW-OAQYLSRUSA-N 0 3 411.509 4.271 20 0 HIADHN CCOc1cccc2cc([C@@H](C)N[C@@H](CN3CCN(C)CC3)c3ccccc3)oc21 ZINC000539497797 938868943 /nfs/dbraw/zinc/86/89/43/938868943.db2.gz YETUQIJTBBWBEP-KNQAVFIVSA-N 0 3 407.558 4.471 20 0 HIADHN COc1ccc([C@@H](C)NCCCNC(=O)c2cccc(F)c2)c(Br)c1 ZINC000539507676 938870327 /nfs/dbraw/zinc/87/03/27/938870327.db2.gz XXBGCFGTTZFSEF-CYBMUJFWSA-N 0 3 409.299 4.068 20 0 HIADHN CC(C)(C)C[C@H](NC[C@H](O)CS(=O)(=O)c1cccs1)c1ccc(Cl)cc1 ZINC000539506853 938870421 /nfs/dbraw/zinc/87/04/21/938870421.db2.gz FONDONQXVAXPNJ-IRXDYDNUSA-N 0 3 416.008 4.303 20 0 HIADHN CC[C@@H](N[C@@H](C)Cn1ncc2ccccc2c1=O)c1cc(F)cc(Br)c1 ZINC000539507086 938870459 /nfs/dbraw/zinc/87/04/59/938870459.db2.gz CCPWATYMHLHNON-ORAYPTAESA-N 0 3 418.310 4.428 20 0 HIADHN C[C@H](NCCc1ccc(S(=O)(=O)N2CCCCC2)s1)c1cccc(F)c1F ZINC000539545573 938877430 /nfs/dbraw/zinc/87/74/30/938877430.db2.gz VJMXIABDBTUPGH-AWEZNQCLSA-N 0 3 414.543 4.094 20 0 HIADHN Cc1nc(CCNC(=O)N2CCN(Cc3ccccc3)C3(CCCCC3)C2)c(C)o1 ZINC000539575029 938882043 /nfs/dbraw/zinc/88/20/43/938882043.db2.gz FVGKBGUEOAHTEG-UHFFFAOYSA-N 0 3 410.562 4.064 20 0 HIADHN Cc1nc(CCNC(=O)N(CCN(C)Cc2ccccc2)Cc2ccccc2)c(C)o1 ZINC000539575211 938882084 /nfs/dbraw/zinc/88/20/84/938882084.db2.gz PXCKGEFMRYHPCK-UHFFFAOYSA-N 0 3 420.557 4.178 20 0 HIADHN CCN1CCN(c2ccccc2N[C@@H](C)c2ccc(OC)c(Cn3cccn3)c2)CC1 ZINC000539648435 938893701 /nfs/dbraw/zinc/89/37/01/938893701.db2.gz VAHBHRMEPVABCP-FQEVSTJZSA-N 0 3 419.573 4.255 20 0 HIADHN CC(=O)c1ccc(C(=O)Nc2c(C)cnn2[C@@H]2CCN(Cc3ccccc3)C2)c(F)c1 ZINC000539667022 938897373 /nfs/dbraw/zinc/89/73/73/938897373.db2.gz QEZGIVJVSDGQRL-HXUWFJFHSA-N 0 3 420.488 4.233 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](NCCCCC2CCOCC2)c2ccccc2)c1 ZINC000539710297 938908531 /nfs/dbraw/zinc/90/85/31/938908531.db2.gz QRGQKZHGDAEDKK-HSZRJFAPSA-N 0 3 401.572 4.366 20 0 HIADHN O=C(CN1CCC[C@@H]1C1CCOCC1)Nc1cc(C2CCCC2)nn1-c1ccccc1 ZINC000539727268 938914498 /nfs/dbraw/zinc/91/44/98/938914498.db2.gz RVPJKPFRLYTSCX-HSZRJFAPSA-N 0 3 422.573 4.359 20 0 HIADHN Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)C(=O)N(CCN(C)C)Cc1cccc(C)c1 ZINC000539790610 938935568 /nfs/dbraw/zinc/93/55/68/938935568.db2.gz PCGUJVNMPLEUNQ-INIZCTEOSA-N 0 3 424.511 4.065 20 0 HIADHN COCC1(O)CCN(Cc2cn(Cc3ccc(C)cc3)nc2-c2ccc(C)cc2)CC1 ZINC000539827431 938948028 /nfs/dbraw/zinc/94/80/28/938948028.db2.gz AFOMMZFGKXEIEI-UHFFFAOYSA-N 0 3 419.569 4.189 20 0 HIADHN C[C@@H](c1ccc(-c2ccccc2)cc1)N(C)Cc1cnc(N2CCN(C)CC2)nc1 ZINC000539836167 938953370 /nfs/dbraw/zinc/95/33/70/938953370.db2.gz XNNRDYNEADBSHJ-FQEVSTJZSA-N 0 3 401.558 4.088 20 0 HIADHN CCN(CC(F)(F)F)C(=O)[C@H]1CCCN(Cc2cccc(OC)c2OC(C)C)C1 ZINC000539850271 938957257 /nfs/dbraw/zinc/95/72/57/938957257.db2.gz DOECELZJAAINJK-KRWDZBQOSA-N 0 3 416.484 4.105 20 0 HIADHN CCCN(CC(F)(F)F)C(=O)[C@H]1CCCN(Cc2cnc(-c3ccccc3)[nH]2)C1 ZINC000539851288 938957818 /nfs/dbraw/zinc/95/78/18/938957818.db2.gz QGCPDAHRKXCSGN-KRWDZBQOSA-N 0 3 408.468 4.090 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@H](C)N[C@@H](C)c2ccccc2N(C)C)cc1 ZINC000539854860 938958959 /nfs/dbraw/zinc/95/89/59/938958959.db2.gz MWBGGNGZUXDFAD-ROUUACIJSA-N 0 3 403.592 4.195 20 0 HIADHN CN1CCN(c2ncc(CN[C@H](c3cccc(C(F)(F)F)c3)C(C)(C)C)cn2)CC1 ZINC000539858192 938959216 /nfs/dbraw/zinc/95/92/16/938959216.db2.gz CKXGRWHGNHWFRX-LJQANCHMSA-N 0 3 421.511 4.124 20 0 HIADHN COc1cc(NC(=O)CCN2[C@H](C)Cc3cc(F)ccc3[C@H]2C)cc(OC)c1OC ZINC000539887804 938966123 /nfs/dbraw/zinc/96/61/23/938966123.db2.gz YBGPMDPSAVIOLV-HUUCEWRRSA-N 0 3 416.493 4.188 20 0 HIADHN CC(C)N(CCN(C)C)C(=O)Nc1ccc(N(C)C(=O)c2ccc(Cl)cc2)cc1 ZINC000539903067 938974047 /nfs/dbraw/zinc/97/40/47/938974047.db2.gz HGFDADLYPUGZOJ-UHFFFAOYSA-N 0 3 416.953 4.421 20 0 HIADHN COc1cc(Cl)ccc1NC(=O)COc1ccc(CN2CCCCC2)cc1OC ZINC000539924042 938978064 /nfs/dbraw/zinc/97/80/64/938978064.db2.gz JFGGVULSRJAYLQ-UHFFFAOYSA-N 0 3 418.921 4.361 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)CCc2c[nH]c3c2cccc3C)cc1 ZINC000539930999 938978504 /nfs/dbraw/zinc/97/85/04/938978504.db2.gz HDVICTRJIABAFZ-HSZRJFAPSA-N 0 3 405.542 4.371 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)[C@H]2C[C@H]2c2cc(F)ccc2F)cc1 ZINC000539931133 938978877 /nfs/dbraw/zinc/97/88/77/938978877.db2.gz VDOSHLNXNRRJCL-VCOUNFBDSA-N 0 3 400.469 4.030 20 0 HIADHN CC(C)c1ccccc1NC(=O)C[C@H](C)N[C@H]1CC(=O)N(c2c(F)cccc2F)C1 ZINC000539967477 938982407 /nfs/dbraw/zinc/98/24/07/938982407.db2.gz SHHKVGVWAOPGNF-HOTGVXAUSA-N 0 3 415.484 4.200 20 0 HIADHN C[C@H](NCc1cccnc1-n1cccn1)c1cccc(OCc2cn3ccccc3n2)c1 ZINC000539969221 938982443 /nfs/dbraw/zinc/98/24/43/938982443.db2.gz JFSVFXMXLJSYPW-IBGZPJMESA-N 0 3 424.508 4.345 20 0 HIADHN CCc1nc2ccccc2n1C1CCN(Cc2cc(=O)n3cc(Cl)ccc3n2)CC1 ZINC000540055043 939052066 /nfs/dbraw/zinc/05/20/66/939052066.db2.gz BOTZDHHXABWZBO-UHFFFAOYSA-N 0 3 421.932 4.097 20 0 HIADHN Brc1cc(CN[C@@H](c2ccccc2)[C@H]2CCOC2)cc2c1OCCCO2 ZINC000540067905 939057374 /nfs/dbraw/zinc/05/73/74/939057374.db2.gz DNGMEVNZJSZDCM-PXNSSMCTSA-N 0 3 418.331 4.478 20 0 HIADHN CC(C)Cn1cc(NC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)c(C(F)F)n1 ZINC000540111278 939075546 /nfs/dbraw/zinc/07/55/46/939075546.db2.gz SCWVOHUYZLYMDV-KRWDZBQOSA-N 0 3 405.493 4.263 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)Nc2cn(CC(C)C)nc2C(F)F)c1 ZINC000540115230 939077857 /nfs/dbraw/zinc/07/78/57/939077857.db2.gz WUTLQANDAZMZBJ-UHFFFAOYSA-N 0 3 407.509 4.381 20 0 HIADHN CCOc1ccccc1-c1cccc(C(=O)NCCCCN2C[C@H](C)O[C@@H](C)C2)c1 ZINC000540133552 939085753 /nfs/dbraw/zinc/08/57/53/939085753.db2.gz UOWYGIBSGNQHKK-PMACEKPBSA-N 0 3 410.558 4.372 20 0 HIADHN CCN(CC)C(=O)Nc1ccc([C@H](C)NCc2ccc(C(=O)OC)c(OC)c2)cc1 ZINC000540140176 939087742 /nfs/dbraw/zinc/08/77/42/939087742.db2.gz IRRYDRHLUPGBEW-INIZCTEOSA-N 0 3 413.518 4.206 20 0 HIADHN c1ccc(C[C@@H](NCc2ccc(COC3CCOCC3)cc2)c2cccnc2)nc1 ZINC000540149277 939092192 /nfs/dbraw/zinc/09/21/92/939092192.db2.gz QXXCIYMODQMSKS-RUZDIDTESA-N 0 3 403.526 4.246 20 0 HIADHN C[C@@H](N[C@H]1CCCN(CC(F)(F)F)C1=O)c1ccc(OCc2ccccc2)cc1 ZINC000540152158 939092770 /nfs/dbraw/zinc/09/27/70/939092770.db2.gz VWEJIYGDRAAIGN-UZLBHIALSA-N 0 3 406.448 4.470 20 0 HIADHN C[C@H](N[C@@H]1CC(=O)N(C)[C@H]1c1ccc(Cl)cc1)c1cccc(N2CCCC2=O)c1 ZINC000540155815 939094091 /nfs/dbraw/zinc/09/40/91/939094091.db2.gz MOFXFGZXPXJKDA-NQKDMWHGSA-N 0 3 411.933 4.089 20 0 HIADHN Fc1cccc2c1CC[C@H]2NCc1ccc(Br)cc1N1CCOCC1 ZINC000540162707 939097749 /nfs/dbraw/zinc/09/77/49/939097749.db2.gz JUPPITCOGIPSAF-LJQANCHMSA-N 0 3 405.311 4.202 20 0 HIADHN CCOc1ccc([C@@H](CC)NCc2cccc(NS(C)(=O)=O)c2)cc1OCC ZINC000540176580 939105633 /nfs/dbraw/zinc/10/56/33/939105633.db2.gz WERRPDOTFNLOFT-LJQANCHMSA-N 0 3 406.548 4.096 20 0 HIADHN COCCOc1ccc([C@@H](C)NCc2cc(Br)c(OC)c(OC)c2)cc1 ZINC000540177694 939106652 /nfs/dbraw/zinc/10/66/52/939106652.db2.gz IWPBJRUSEHYSFV-CQSZACIVSA-N 0 3 424.335 4.342 20 0 HIADHN O=C(NCc1ccco1)c1cccc(CN[C@H](C[C@H]2CCOC2)c2ccccc2)c1 ZINC000540190239 939114725 /nfs/dbraw/zinc/11/47/25/939114725.db2.gz HUDGNVIVLHYMJG-HYBUGGRVSA-N 0 3 404.510 4.467 20 0 HIADHN Fc1ccc(-c2nc(CN[C@H]3CCCOc4c(Br)cccc43)n[nH]2)cc1 ZINC000540218946 939133891 /nfs/dbraw/zinc/13/38/91/939133891.db2.gz WFIVGMJMEVGWMP-INIZCTEOSA-N 0 3 417.282 4.377 20 0 HIADHN CN1CCN(C(=O)c2ccc(CN[C@@H](c3ccccc3F)C3CCCC3)cc2)CC1 ZINC000540266040 939177456 /nfs/dbraw/zinc/17/74/56/939177456.db2.gz WGMLNOHEWKLLOC-XMMPIXPASA-N 0 3 409.549 4.234 20 0 HIADHN CN(C)S(=O)(=O)c1ccc(CN[C@H](c2ccc(Cl)c(Cl)c2)C2CC2)cc1 ZINC000540313267 939190604 /nfs/dbraw/zinc/19/06/04/939190604.db2.gz FJVAQYUIPNTFCJ-IBGZPJMESA-N 0 3 413.370 4.485 20 0 HIADHN CC(C)C[C@@H](NCC(=O)N(C)CC(=O)Nc1ccccc1Cl)c1ccccc1 ZINC000540343133 939200589 /nfs/dbraw/zinc/20/05/89/939200589.db2.gz MOYVKABPCZYOAF-HXUWFJFHSA-N 0 3 401.938 4.114 20 0 HIADHN COc1ccccc1[C@@H](C)N(C)C(=O)CNC1(c2ccc3c(c2)OCCO3)CCCC1 ZINC000540342914 939201041 /nfs/dbraw/zinc/20/10/41/939201041.db2.gz KUGREGWDPSVNCH-GOSISDBHSA-N 0 3 424.541 4.045 20 0 HIADHN COc1ccc(C[C@@H](NCC(=O)NCc2ccc(F)cc2)c2ccccc2)cc1OC ZINC000540352303 939203668 /nfs/dbraw/zinc/20/36/68/939203668.db2.gz PYSIIXGSYIJEQI-JOCHJYFZSA-N 0 3 422.500 4.033 20 0 HIADHN CC(C)(C)C[C@H](NCC(=O)Nc1cc(-n2cnnn2)ccc1Cl)c1ccccc1 ZINC000540375289 939215210 /nfs/dbraw/zinc/21/52/10/939215210.db2.gz GGDUPZVUDGICSN-IBGZPJMESA-N 0 3 412.925 4.021 20 0 HIADHN COc1ccc([C@@H](Cc2ccc(F)cc2)NCC(=O)Nc2cccc(OC)c2)cc1 ZINC000540375171 939215519 /nfs/dbraw/zinc/21/55/19/939215519.db2.gz XBTBCUHITGOLMU-HSZRJFAPSA-N 0 3 408.473 4.355 20 0 HIADHN Cc1cc(Br)ccc1NC(=O)CN[C@H](c1ccccc1)[C@@H]1CCOC1 ZINC000540389788 939226841 /nfs/dbraw/zinc/22/68/41/939226841.db2.gz TTWMKIIYDKUTPA-OXQOHEQNSA-N 0 3 403.320 4.063 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(-c2cccnc2)cc1)C(=O)NC(=O)Nc1ccccc1F ZINC000540424739 939243601 /nfs/dbraw/zinc/24/36/01/939243601.db2.gz WSPAYYRTUWKEIJ-HOTGVXAUSA-N 0 3 406.461 4.275 20 0 HIADHN CC(C)N(C)C(=O)C1CCN(C(=O)CN[C@@H](CC2CCCC2)c2ccccc2)CC1 ZINC000540434452 939247228 /nfs/dbraw/zinc/24/72/28/939247228.db2.gz LZLWZTZIYCHHGB-QHCPKHFHSA-N 0 3 413.606 4.003 20 0 HIADHN C[C@H](NCC(=O)N[C@@H](c1cccs1)c1ccccc1)c1ccc(-n2cccn2)cc1 ZINC000540435300 939248105 /nfs/dbraw/zinc/24/81/05/939248105.db2.gz NWTJIXYMKVQONE-MHECFPHRSA-N 0 3 416.550 4.490 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(-c2ccncc2)cc1)C(=O)Nc1ccc2c(c1)OCCO2 ZINC000540437957 939249462 /nfs/dbraw/zinc/24/94/62/939249462.db2.gz QEJZQYYKMGHRHL-DLBZAZTESA-N 0 3 403.482 4.198 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(-c2ccncc2)cc1)C(=O)NC(=O)Nc1ccccc1F ZINC000540439725 939250338 /nfs/dbraw/zinc/25/03/38/939250338.db2.gz MXUBCZVHWDCKBC-HOTGVXAUSA-N 0 3 406.461 4.275 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(-c2ccncc2)cc1)C(=O)N1CCN(c2ccccc2)CC1 ZINC000540439896 939250662 /nfs/dbraw/zinc/25/06/62/939250662.db2.gz OHLDBODIAPJGPV-SFTDATJTSA-N 0 3 414.553 4.137 20 0 HIADHN CC[C@@H](NCCC(=O)Nc1ccc(N2CCCC2=O)cc1)c1cc(F)ccc1F ZINC000540459225 939260787 /nfs/dbraw/zinc/26/07/87/939260787.db2.gz PGTLJWJSOKEPMG-HXUWFJFHSA-N 0 3 401.457 4.161 20 0 HIADHN Cc1cc(NC(=O)CN[C@H](C)c2cccc(N3CCCC3)c2)n(-c2ccccc2F)n1 ZINC000540477020 939267885 /nfs/dbraw/zinc/26/78/85/939267885.db2.gz WWHFLIRUHCOJLH-GOSISDBHSA-N 0 3 421.520 4.209 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@@H](C)N[C@@H](C)c2cccc(N3CCCC3)c2)cc1F ZINC000540478873 939268836 /nfs/dbraw/zinc/26/88/36/939268836.db2.gz QBADKDGTQXTKOV-ZWKOTPCHSA-N 0 3 413.537 4.132 20 0 HIADHN CC1CCN([C@H](CNC(=O)c2cccc(Cn3ccnc3)c2)c2ccccc2)CC1 ZINC000540509645 939281844 /nfs/dbraw/zinc/28/18/44/939281844.db2.gz SFZWMVHGDVIMEL-XMMPIXPASA-N 0 3 402.542 4.134 20 0 HIADHN O=C(CCCc1ccc2ccccc2c1)N[C@H]1CCN(Cc2ccccc2)C[C@H]1CO ZINC000540508853 939281901 /nfs/dbraw/zinc/28/19/01/939281901.db2.gz JSSYCHVJSJGWBS-UIOOFZCWSA-N 0 3 416.565 4.162 20 0 HIADHN COc1ccc(CNC(=O)[C@H](C)N[C@H](c2ccc(Cl)cc2)[C@H]2C[C@@H]2C)cc1OC ZINC000540523168 939286769 /nfs/dbraw/zinc/28/67/69/939286769.db2.gz LWSIBLGFRFGBLI-OFFWNCNGSA-N 0 3 416.949 4.349 20 0 HIADHN COC(=O)c1cccc(NC2CCN(Cc3c[nH]nc3-c3ccc(C)cc3)CC2)c1 ZINC000563658826 945242156 /nfs/dbraw/zinc/24/21/56/945242156.db2.gz ZPRCUFQPHWURKY-UHFFFAOYSA-N 0 3 404.514 4.248 20 0 HIADHN COc1ccc([C@@H](NCCN2c3cccc4cccc(c34)S2(=O)=O)C2CC2)cc1 ZINC000540588771 939312436 /nfs/dbraw/zinc/31/24/36/939312436.db2.gz FXVGXEHCGORCEQ-QHCPKHFHSA-N 0 3 408.523 4.098 20 0 HIADHN COc1ccc(OC)c(NC(=O)C[C@H](C)N[C@@H]2CCCOc3cc(F)ccc32)c1 ZINC000540780124 939370051 /nfs/dbraw/zinc/37/00/51/939370051.db2.gz WHUAUHMYIHQFFD-KBXCAEBGSA-N 0 3 402.466 4.064 20 0 HIADHN COCCNC(=O)[C@H](CC(C)C)N[C@@H]1CCCc2nc(-c3ccccc3F)sc21 ZINC000540789092 939373048 /nfs/dbraw/zinc/37/30/48/939373048.db2.gz KXVXOWPKQPZXKO-MJGOQNOKSA-N 0 3 419.566 4.094 20 0 HIADHN c1ccc(N2CCOCC2)c(CNCc2ccc(-c3ccc4c(c3)CCO4)cc2)c1 ZINC000540809699 939379699 /nfs/dbraw/zinc/37/96/99/939379699.db2.gz UPFRYBNROKIKDR-UHFFFAOYSA-N 0 3 400.522 4.415 20 0 HIADHN C[C@H]1CN(Cc2ccccn2)CC[C@@H]1Nc1cnn(-c2ncc(Cl)cc2Cl)c1 ZINC000540825365 939385481 /nfs/dbraw/zinc/38/54/81/939385481.db2.gz XPLDUAGTPLNZNY-LIRRHRJNSA-N 0 3 417.344 4.292 20 0 HIADHN COC(=O)c1oc([C@@H](C)N2CCC[C@@H](c3nnc(C4CCCCC4)[nH]3)C2)cc1C ZINC000540865285 939402847 /nfs/dbraw/zinc/40/28/47/939402847.db2.gz MYAOQAOKHADUBI-NVXWUHKLSA-N 0 3 400.523 4.481 20 0 HIADHN CC(=O)Nc1ccc([C@H](C)N[C@H]2CC(=O)N(C)[C@@H]2c2ccc(Cl)c(F)c2)cc1 ZINC000540987096 939425172 /nfs/dbraw/zinc/42/51/72/939425172.db2.gz SFZLWIBVZNYZQQ-VTOVKPRRSA-N 0 3 403.885 4.060 20 0 HIADHN CSC[C@H](NC[C@@H](O)COc1ccc(F)cc1)c1ccc(C(F)(F)F)cc1 ZINC000540987880 939425715 /nfs/dbraw/zinc/42/57/15/939425715.db2.gz BJXSGOGJAIRMGB-AEFFLSMTSA-N 0 3 403.441 4.278 20 0 HIADHN CC(=O)Nc1ccc([C@@H](C)NCc2cccc(NC(=O)NCc3ccncc3)c2)cc1 ZINC000540988773 939425718 /nfs/dbraw/zinc/42/57/18/939425718.db2.gz OWTJDJOFUYIXOI-QGZVFWFLSA-N 0 3 417.513 4.213 20 0 HIADHN COc1cc(C(C)=O)ccc1OC[C@@H](O)CN[C@H](c1ccc(Cl)cc1F)C(C)C ZINC000541059413 939444920 /nfs/dbraw/zinc/44/49/20/939444920.db2.gz IVHZBZLUJWLDPW-JTSKRJEESA-N 0 3 423.912 4.417 20 0 HIADHN CCN(C[C@@H]1CCN(Cc2ccccc2)C1)c1nn2cc(-c3cccnc3)nc2s1 ZINC000541113260 939464429 /nfs/dbraw/zinc/46/44/29/939464429.db2.gz XEIUZHWWWCHZMX-LJQANCHMSA-N 0 3 418.570 4.201 20 0 HIADHN Cn1ccnc1COc1ccc(CN2CCC[C@H](n3ccc(C(F)(F)F)n3)C2)cc1 ZINC000541127738 939470716 /nfs/dbraw/zinc/47/07/16/939470716.db2.gz ORTAWPYBPFKZOI-KRWDZBQOSA-N 0 3 419.451 4.052 20 0 HIADHN CC(C)[C@H](CNC(=O)c1cc(-c2cnn(C)c2)ccc1F)N1CCc2ccccc2C1 ZINC000541151441 939477544 /nfs/dbraw/zinc/47/75/44/939477544.db2.gz WTZUVEDCFIVLQE-DEOSSOPVSA-N 0 3 420.532 4.039 20 0 HIADHN CC[C@@H](N[C@H]1CCCc2ccc(Br)cc21)c1cccc(S(N)(=O)=O)c1 ZINC000541202047 939485401 /nfs/dbraw/zinc/48/54/01/939485401.db2.gz ZTLGNIACRBFRTC-MOPGFXCFSA-N 0 3 423.376 4.215 20 0 HIADHN CN(C(=O)NCCCCN1CCN(C)CC1)[C@H](c1ccc(Cl)cc1)C1CCCC1 ZINC000541223895 939486453 /nfs/dbraw/zinc/48/64/53/939486453.db2.gz YSFWOPHIKOZALV-QFIPXVFZSA-N 0 3 421.029 4.240 20 0 HIADHN Brc1cccc2c1CCC[C@H]2NCc1ccccc1N1CCOCC1 ZINC000541223990 939486462 /nfs/dbraw/zinc/48/64/62/939486462.db2.gz WPWKIWQXHVIHSC-HXUWFJFHSA-N 0 3 401.348 4.453 20 0 HIADHN C[C@H](CNC(=O)N(C)[C@H](c1ccc(Cl)cc1)C1CCCC1)CN1CCN(C)CC1 ZINC000541248614 939487544 /nfs/dbraw/zinc/48/75/44/939487544.db2.gz DMOQJBRIASTFBN-GCJKJVERSA-N 0 3 421.029 4.096 20 0 HIADHN NC(=O)[C@H](Cc1ccc(C(F)(F)F)cc1)N[C@H]1C[C@@H]1c1ccccc1C(F)(F)F ZINC000541307689 939490427 /nfs/dbraw/zinc/49/04/27/939490427.db2.gz PKGAMXSOQSPRMV-PVAVHDDUSA-N 0 3 416.365 4.266 20 0 HIADHN C[C@H](N[C@@H](Cc1ccc(C(F)(F)F)cc1)C(N)=O)c1cccc(OC(F)F)c1 ZINC000541328272 939491062 /nfs/dbraw/zinc/49/10/62/939491062.db2.gz SDQNDQUZAQPXNF-ZBEGNZNMSA-N 0 3 402.363 4.054 20 0 HIADHN CC(C)(C)OC(=O)CCCN1CCC[C@H](c2nnc3ccc(C(F)(F)F)cn32)C1 ZINC000541351738 939495593 /nfs/dbraw/zinc/49/55/93/939495593.db2.gz VOTWNTJBUIPEBQ-AWEZNQCLSA-N 0 3 412.456 4.049 20 0 HIADHN CC(C)(C)OC(=O)CCCN1CCC[C@@H](c2nnc3ccc(C(F)(F)F)cn32)C1 ZINC000541351739 939495623 /nfs/dbraw/zinc/49/56/23/939495623.db2.gz VOTWNTJBUIPEBQ-CQSZACIVSA-N 0 3 412.456 4.049 20 0 HIADHN CCOc1cc(CN[C@H](C)C[S@](C)=O)ccc1OCc1c(F)cccc1Cl ZINC000541371279 939499556 /nfs/dbraw/zinc/49/95/56/939499556.db2.gz VERPWQUOICHRKT-ASHKIFAZSA-N 0 3 413.942 4.313 20 0 HIADHN COc1cc(OC)cc(Oc2ccc(CN3CCOCC4(CCOCC4)C3)cc2)c1 ZINC000541535702 939546655 /nfs/dbraw/zinc/54/66/55/939546655.db2.gz QDLGUSGNCBYXBP-UHFFFAOYSA-N 0 3 413.514 4.125 20 0 HIADHN CC(C)([C@H](NC(=O)Cc1c[nH]c2ncccc12)c1ccc(F)c(F)c1)N1CCCC1 ZINC000541545733 939550393 /nfs/dbraw/zinc/55/03/93/939550393.db2.gz OVNFJIKWJKPDTR-OAQYLSRUSA-N 0 3 412.484 4.116 20 0 HIADHN COc1cc(OC)c(CCN[C@@H](c2cccnc2)c2ccc(F)c(C)c2)c(OC)c1 ZINC000541546548 939550898 /nfs/dbraw/zinc/55/08/98/939550898.db2.gz WWZZUTYNKIQRAJ-XMMPIXPASA-N 0 3 410.489 4.477 20 0 HIADHN Cc1cc([C@H](NC[C@@H](c2ccc(F)cc2)N2CCOCC2)c2cccnc2)ccc1F ZINC000541550326 939552555 /nfs/dbraw/zinc/55/25/55/939552555.db2.gz RRAOVTPGKAMBND-DQEYMECFSA-N 0 3 423.507 4.421 20 0 HIADHN C[C@@H](NC(=O)N1CCC(F)(c2ccccc2C(F)(F)F)CC1)C1=CCN(C)CC1 ZINC000541551779 939553003 /nfs/dbraw/zinc/55/30/03/939553003.db2.gz HRKOYIWQFCHWSS-OAHLLOKOSA-N 0 3 413.459 4.326 20 0 HIADHN CCc1noc(CC)c1CC(=O)N[C@@H](c1ccc(F)c(F)c1)C(C)(C)N1CCCC1 ZINC000541552061 939553012 /nfs/dbraw/zinc/55/30/12/939553012.db2.gz COUIQYGVXBHOTC-QFIPXVFZSA-N 0 3 419.516 4.352 20 0 HIADHN CCN1CCN(Cc2ccc(CN[C@@H](c3ccccc3)c3ccc(F)cn3)cc2)CC1 ZINC000541552245 939553236 /nfs/dbraw/zinc/55/32/36/939553236.db2.gz YKXMSTCTJJLYFS-SANMLTNESA-N 0 3 418.560 4.237 20 0 HIADHN Cc1nn(-c2ccccc2)c(Oc2ccc(F)cc2)c1CN1C[C@@H]2CC[C@H](O)[C@@H]2C1 ZINC000541554427 939554228 /nfs/dbraw/zinc/55/42/28/939554228.db2.gz FTSNXYFOIJVDGI-IMRHEYAYSA-N 0 3 407.489 4.315 20 0 HIADHN O=C1[C@@H](NCc2cc(-n3ccnc3)cs2)CCN1c1ccc(Cl)c(Cl)c1 ZINC000541555065 939554654 /nfs/dbraw/zinc/55/46/54/939554654.db2.gz JYTNCCYZAFKDCP-KRWDZBQOSA-N 0 3 407.326 4.136 20 0 HIADHN CCOC(=O)c1ccc(N2CC(N[C@H](C)c3sc(-c4ccccc4)nc3C)C2)nc1 ZINC000541569816 939557420 /nfs/dbraw/zinc/55/74/20/939557420.db2.gz AHHFOUNVGVBGTQ-OAHLLOKOSA-N 0 3 422.554 4.230 20 0 HIADHN Brc1cnc(CNC[C@@H]2[C@@H]3Cc4ccccc4[C@H]23)c(Br)c1 ZINC000541587674 939561579 /nfs/dbraw/zinc/56/15/79/939561579.db2.gz RPSMZHMFQDOGQU-VBQJREDUSA-N 0 3 408.137 4.282 20 0 HIADHN COC[C@@H](NCC(=O)N(Cc1ccccc1)c1nc2c(cccc2C)s1)C(C)C ZINC000541596019 939562921 /nfs/dbraw/zinc/56/29/21/939562921.db2.gz YOMOXJJRROZHLL-LJQANCHMSA-N 0 3 411.571 4.399 20 0 HIADHN COc1cc(-c2nnc(CN[C@@H]3C[C@H](C)CC[C@@H]3C(C)C)o2)cc(OC)c1OC ZINC000541611060 939569759 /nfs/dbraw/zinc/56/97/59/939569759.db2.gz FNKZWDAJWMGBOP-DJIMGWMZSA-N 0 3 403.523 4.313 20 0 HIADHN Cc1cccc(C)c1NC(=O)CNC(=O)[C@@H](C)N[C@@H](CC(C)C)c1cccs1 ZINC000541626163 939574431 /nfs/dbraw/zinc/57/44/31/939574431.db2.gz GTZLCIARSHGLJY-MSOLQXFVSA-N 0 3 401.576 4.185 20 0 HIADHN CN(C)c1cc(C(=O)N(Cc2ccccc2)C2CCN(C)CC2)c2ccccc2n1 ZINC000541676805 939598081 /nfs/dbraw/zinc/59/80/81/939598081.db2.gz JDVLBTLAXUQOOH-UHFFFAOYSA-N 0 3 402.542 4.037 20 0 HIADHN C[C@@H](NCC(=O)NCc1ccc(-c2ccc(Cl)cc2)o1)[C@H]1COc2ccccc21 ZINC000541698322 939608084 /nfs/dbraw/zinc/60/80/84/939608084.db2.gz UWZQUAFPNABDQW-FOIQADDNSA-N 0 3 410.901 4.371 20 0 HIADHN C[C@H](NCC(=O)N1Cc2ccccc2[C@@H](c2ccccc2)C1)[C@H]1COc2ccccc21 ZINC000541704137 939609808 /nfs/dbraw/zinc/60/98/08/939609808.db2.gz ZJTHJQKBSIHTKM-QTLGCAHFSA-N 0 3 412.533 4.315 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@H]2CCCC[C@@H]2NCc2ccccc2-c2cnn(C)c2)cc1 ZINC000541767155 939625225 /nfs/dbraw/zinc/62/52/25/939625225.db2.gz SIDLCBRIBUITLH-ZEQRLZLVSA-N 0 3 423.582 4.270 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@H]2CCCC[C@@H]2NCc2ccccc2-n2cccn2)cc1 ZINC000541768374 939625868 /nfs/dbraw/zinc/62/58/68/939625868.db2.gz UEXMYQKCUCWFEP-GMAHTHKFSA-N 0 3 409.555 4.055 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(N[C@@H](c2ccn(C)n2)c2ccc(Cl)cc2)CC1 ZINC000541779546 939628569 /nfs/dbraw/zinc/62/85/69/939628569.db2.gz WOQRQGYYJNCEHC-UZUQRXQVSA-N 0 3 409.965 4.373 20 0 HIADHN COc1cc(-c2ccccc2)sc1C(=O)N1C[C@@H](SC)[C@@H](N2CCCC2)C1 ZINC000541842762 939646027 /nfs/dbraw/zinc/64/60/27/939646027.db2.gz LCKODKVTPWCITD-QFBILLFUSA-N 0 3 402.585 4.076 20 0 HIADHN CC(=O)Nc1ccc([C@H](C)[NH2+]Cc2nnc(-c3ccc(Br)cc3)[n-]2)cc1 ZINC000541912574 939651850 /nfs/dbraw/zinc/65/18/50/939651850.db2.gz BEZFTJISWUOPPB-LBPRGKRZSA-N 0 3 414.307 4.043 20 0 HIADHN CC1CCN([C@H](CNC(=O)c2cc(-c3cnn(C)c3)ccc2F)c2ccccc2)CC1 ZINC000542021528 939689232 /nfs/dbraw/zinc/68/92/32/939689232.db2.gz ALQVDCHREVXDRJ-XMMPIXPASA-N 0 3 420.532 4.429 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)[C@@H](C)c3cn(C)c4ccccc34)cc2)CC1 ZINC000542104018 939715079 /nfs/dbraw/zinc/71/50/79/939715079.db2.gz AROWKMOBMOLROT-IBGZPJMESA-N 0 3 404.558 4.058 20 0 HIADHN CC(C)n1ccc(C[C@@H](C)N[C@@H](c2ccccc2)c2cccc(S(C)(=O)=O)c2)n1 ZINC000542137178 939727222 /nfs/dbraw/zinc/72/72/22/939727222.db2.gz YYDMXGJDKLECBP-JPYJTQIMSA-N 0 3 411.571 4.178 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1ccnc(C2CC2)c1 ZINC000542149746 939730897 /nfs/dbraw/zinc/73/08/97/939730897.db2.gz JXNUQVXSZOYIEY-OAQYLSRUSA-N 0 3 401.514 4.163 20 0 HIADHN CNS(=O)(=O)c1ccc([C@H](C)N[C@@H]2CCCc3c(Br)cccc32)cc1 ZINC000542152792 939733396 /nfs/dbraw/zinc/73/33/96/939733396.db2.gz RDRJAUVOLQQQIT-ORAYPTAESA-N 0 3 423.376 4.085 20 0 HIADHN COc1ccc([C@@H](CNC(=O)Nc2ccccc2-n2nccc2C)N2CCCC2)cc1 ZINC000542422498 939819393 /nfs/dbraw/zinc/81/93/93/939819393.db2.gz SEHOVVDDTPPPID-HSZRJFAPSA-N 0 3 419.529 4.148 20 0 HIADHN O=C(NCC[C@H]1CCOC1)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000542449179 939824829 /nfs/dbraw/zinc/82/48/29/939824829.db2.gz FJPCZTOWKLTOJW-INIZCTEOSA-N 0 3 414.377 4.027 20 0 HIADHN Cc1nc(CN2CCC(CN[C@H](c3ccccc3)c3ccc(F)cn3)CC2)oc1C ZINC000542475508 939829571 /nfs/dbraw/zinc/82/95/71/939829571.db2.gz XWQGQJAHCQEEJF-XMMPIXPASA-N 0 3 408.521 4.417 20 0 HIADHN O=C1[C@@H](N[C@H]2CCCc3c(Br)cccc32)CCCN1Cc1ccccn1 ZINC000542497398 939832906 /nfs/dbraw/zinc/83/29/06/939832906.db2.gz BPAAWIMOBDEDCW-PMACEKPBSA-N 0 3 414.347 4.002 20 0 HIADHN C[C@@H](N[C@H]1CCCN(Cc2ccccn2)C1=O)c1ccc(SCC(F)F)cc1 ZINC000542501242 939833489 /nfs/dbraw/zinc/83/34/89/939833489.db2.gz RPZZKDDFCAWDCA-BEFAXECRSA-N 0 3 405.514 4.281 20 0 HIADHN O=S(=O)(CCN[C@H](c1cccs1)C1CC1)c1cccc(Br)c1 ZINC000542511063 939835045 /nfs/dbraw/zinc/83/50/45/939835045.db2.gz FRPBTQMYCRZPLP-INIZCTEOSA-N 0 3 400.363 4.025 20 0 HIADHN C[C@H](N[C@H](Cc1ccccc1)c1cccs1)C(=O)Nc1ccc2c(c1)OCCO2 ZINC000542525834 939837297 /nfs/dbraw/zinc/83/72/97/939837297.db2.gz MQBRJRPSLVTPQR-QFBILLFUSA-N 0 3 408.523 4.420 20 0 HIADHN C[C@H](NCc1ccc(S(=O)(=O)N2CCCC2)o1)C(c1ccccc1)c1ccccc1 ZINC000542557587 939843303 /nfs/dbraw/zinc/84/33/03/939843303.db2.gz ONEFYHYQYULXSK-IBGZPJMESA-N 0 3 424.566 4.374 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@@H](C)N[C@H](CC(C)C)c2cccs2)cc1OC ZINC000542557276 939843333 /nfs/dbraw/zinc/84/33/33/939843333.db2.gz OHVVALWZPFVILN-SJLPKXTDSA-N 0 3 404.576 4.489 20 0 HIADHN CC(C)(NCC(=O)NC[C@@H](c1ccccc1Cl)N1CCCC1)c1cccs1 ZINC000542567878 939844737 /nfs/dbraw/zinc/84/47/37/939844737.db2.gz BQDQETOJUUVUJR-SFHVURJKSA-N 0 3 405.995 4.180 20 0 HIADHN CCN(CC)[C@H](CNC(=O)CSc1nc(-c2ccccc2)no1)c1ccsc1 ZINC000542611395 939848241 /nfs/dbraw/zinc/84/82/41/939848241.db2.gz DNJMLDUVPHWZFH-QGZVFWFLSA-N 0 3 416.572 4.090 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)Nc1nc(-c2ccc(F)cc2)cs1)[C@H]1COc2ccccc21 ZINC000542618072 939849226 /nfs/dbraw/zinc/84/92/26/939849226.db2.gz BDZINHSCKQNKQD-QWQRMKEZSA-N 0 3 411.502 4.431 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@H]2CCCC[C@H]2NCc2ccccc2-n2ccnc2)cc1 ZINC000542664430 939852578 /nfs/dbraw/zinc/85/25/78/939852578.db2.gz KQIQDZMZIZLKOU-GGAORHGYSA-N 0 3 409.555 4.055 20 0 HIADHN Cc1ccc([C@@H](NC[C@@H](C)c2nccs2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000542696845 939854877 /nfs/dbraw/zinc/85/48/77/939854877.db2.gz DHVXJDCDBRZLPH-OXQOHEQNSA-N 0 3 400.569 4.338 20 0 HIADHN CNC(=O)C1CCC(N[C@@H](C(=O)Nc2ccc(C)c(Cl)c2)c2ccccc2)CC1 ZINC000542734053 939857882 /nfs/dbraw/zinc/85/78/82/939857882.db2.gz MUXRQXMNDJAFNN-WIXQSORDSA-N 0 3 413.949 4.223 20 0 HIADHN COc1cc(C)c(CNCc2ccccc2-c2ccc(Cn3cncn3)cc2)c(C)n1 ZINC000542850121 939863035 /nfs/dbraw/zinc/86/30/35/939863035.db2.gz HSHFSGYZXBAFEX-UHFFFAOYSA-N 0 3 413.525 4.304 20 0 HIADHN OCC[C@@H](NCCCc1nc(-c2ccccc2)no1)c1ccccc1Br ZINC000542879151 939864787 /nfs/dbraw/zinc/86/47/87/939864787.db2.gz KOASVYTVAWQWSS-GOSISDBHSA-N 0 3 416.319 4.145 20 0 HIADHN COc1cccc(OC)c1OC[C@@H](O)CN[C@@H](c1ccc(Cl)cc1F)C(C)C ZINC000542919178 939877775 /nfs/dbraw/zinc/87/77/75/939877775.db2.gz KZMKIGJRXJUHRU-MGPUTAFESA-N 0 3 411.901 4.223 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCc1cn(C)nc1-c1ccccc1)c1ccsc1 ZINC000542968755 939888176 /nfs/dbraw/zinc/88/81/76/939888176.db2.gz ASRWEPIGUGNQQB-HXUWFJFHSA-N 0 3 411.575 4.031 20 0 HIADHN C[C@@H](CCc1n[nH]c2ccccc21)NCc1nnc2c(Cl)cc(C(F)(F)F)cn12 ZINC000543015564 939895453 /nfs/dbraw/zinc/89/54/53/939895453.db2.gz KNFSBFOTIZUGCN-NSHDSACASA-N 0 3 422.842 4.389 20 0 HIADHN C[C@@H](CC(=O)Nc1ccc(NC(=O)C2CC2)cc1)NCc1ccc2ccccc2n1 ZINC000543081427 939931014 /nfs/dbraw/zinc/93/10/14/939931014.db2.gz DREYCFCURFABTL-INIZCTEOSA-N 0 3 402.498 4.090 20 0 HIADHN Brc1cncc(CN2CCC[C@@H](c3n[nH]c(C4CCCCC4)n3)C2)c1 ZINC000543182630 939988579 /nfs/dbraw/zinc/98/85/79/939988579.db2.gz WJNZYHNXECAZMA-MRXNPFEDSA-N 0 3 404.356 4.390 20 0 HIADHN Cc1cc(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2F)nn1[C@@H](C)C1CC1 ZINC000543319735 940028842 /nfs/dbraw/zinc/02/88/42/940028842.db2.gz WZZFCZGDSSFUFB-HNNXBMFYSA-N 0 3 405.493 4.036 20 0 HIADHN Brc1ccc(-c2ccc(CN3CCOCC4(CCOCC4)C3)o2)cc1 ZINC000543392897 940049733 /nfs/dbraw/zinc/04/97/33/940049733.db2.gz HORMFOOJSGCHFI-UHFFFAOYSA-N 0 3 406.320 4.338 20 0 HIADHN Cc1nn(-c2ccncc2)cc1CN(CCc1ccccn1)Cc1ccc(F)cc1 ZINC000543397131 940051276 /nfs/dbraw/zinc/05/12/76/940051276.db2.gz VRKKFTWKGJZAME-UHFFFAOYSA-N 0 3 401.489 4.355 20 0 HIADHN Cc1cc([C@H](NCc2ccc(CN3CCN(C)CC3)cc2)c2cccnc2)ccc1F ZINC000543405625 940054326 /nfs/dbraw/zinc/05/43/26/940054326.db2.gz AVGHUHNVWVMSJF-SANMLTNESA-N 0 3 418.560 4.156 20 0 HIADHN CCCC(=O)Nc1ccc(CN[C@H](CN2CCOCC2)c2ccc(CC)cc2)cc1 ZINC000543408398 940056026 /nfs/dbraw/zinc/05/60/26/940056026.db2.gz INCAMKOQAGMLTM-XMMPIXPASA-N 0 3 409.574 4.151 20 0 HIADHN CC[C@@H](N[C@@H]1CCCN(Cc2ccccn2)C1=O)c1cc(F)cc(Br)c1 ZINC000543426817 940060738 /nfs/dbraw/zinc/06/07/38/940060738.db2.gz KQQNEQIJWPPNFC-RTBURBONSA-N 0 3 420.326 4.215 20 0 HIADHN CCN(C[C@@H]1CCN(Cc2ccccc2)C1)C(=O)[C@H](C)CC(=O)c1ccc(OC)cc1 ZINC000543431410 940062366 /nfs/dbraw/zinc/06/23/66/940062366.db2.gz HKMGNHHSQPYVHE-IFMALSPDSA-N 0 3 422.569 4.275 20 0 HIADHN O=C(CN[C@H](c1cccs1)C1CC1)Nc1ccc(I)cc1 ZINC000543438182 940064189 /nfs/dbraw/zinc/06/41/89/940064189.db2.gz CHVNMCJSPOVABT-INIZCTEOSA-N 0 3 412.296 4.032 20 0 HIADHN C[C@H](Cc1ccccc1)CN1CCN(CC(=O)Nc2ccccc2C(F)(F)F)CC1 ZINC000543447378 940066107 /nfs/dbraw/zinc/06/61/07/940066107.db2.gz GXBKUHLKSQSKAW-GOSISDBHSA-N 0 3 419.491 4.140 20 0 HIADHN COC(=O)C[C@H](NCC(=O)Nc1ccc(Cl)cc1C(F)(F)F)C1CCCCC1 ZINC000543460786 940071012 /nfs/dbraw/zinc/07/10/12/940071012.db2.gz RUKMTISVGUYCIP-INIZCTEOSA-N 0 3 420.859 4.399 20 0 HIADHN COc1ccc(C2(C(=O)N[C@H]3CCN([C@@H](C)c4ccccc4)C3)CCC2)cc1OC ZINC000543470777 940074813 /nfs/dbraw/zinc/07/48/13/940074813.db2.gz LDZMDQSVLNEWJB-RXVVDRJESA-N 0 3 408.542 4.077 20 0 HIADHN COc1ccc(Br)cc1-c1nc(CN[C@@H](C)[C@H]2CCCOC2)cs1 ZINC000543507061 940088856 /nfs/dbraw/zinc/08/88/56/940088856.db2.gz NLGATRBQCLZGKS-STQMWFEESA-N 0 3 411.365 4.486 20 0 HIADHN CN1CCN(CCCCNC(=O)c2cc(Cl)ccc2SC2CCCC2)CC1 ZINC000543537544 940097976 /nfs/dbraw/zinc/09/79/76/940097976.db2.gz OKFQATHRZDKOTE-UHFFFAOYSA-N 0 3 410.027 4.132 20 0 HIADHN COc1ccc([C@@H]2CCCCCN2C(=O)CN[C@@H](C)[C@@H]2COc3ccccc32)cc1 ZINC000543556896 940107729 /nfs/dbraw/zinc/10/77/29/940107729.db2.gz YYTDBNAYHKUPHX-TZYHBYERSA-N 0 3 408.542 4.293 20 0 HIADHN C[C@@H](N[C@H]1CCN(c2cnn(C)c2)C1=O)c1ccc(-c2ccc(Cl)cc2F)s1 ZINC000543599893 940126208 /nfs/dbraw/zinc/12/62/08/940126208.db2.gz JUACIGQJWPJMQQ-PXAZEXFGSA-N 0 3 418.925 4.397 20 0 HIADHN CC[C@H](NCCc1ccc(OCC(=O)Nc2ccc(C)cc2)cc1)c1ccn(C)n1 ZINC000543603427 940127585 /nfs/dbraw/zinc/12/75/85/940127585.db2.gz PRXIVTBNXDFPNL-QFIPXVFZSA-N 0 3 406.530 4.029 20 0 HIADHN COc1cc(C[NH2+][C@@H]2CCO[C@@H](c3ccc(F)cc3)C2)cc(Br)c1[O-] ZINC000543641755 940146525 /nfs/dbraw/zinc/14/65/25/940146525.db2.gz JDKQYSDYYRNMCC-NVXWUHKLSA-N 0 3 410.283 4.312 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N[C@@H]2CCO[C@H](c3ccc(F)cc3)C2)N(C)C)cc1 ZINC000543654658 940151278 /nfs/dbraw/zinc/15/12/78/940151278.db2.gz YAQWPBOQMUEOSW-VJBWXMMDSA-N 0 3 413.537 4.210 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)NCC(=O)NCCCSc2ccccc2)cc1 ZINC000543811127 940194324 /nfs/dbraw/zinc/19/43/24/940194324.db2.gz MYEFFXHHNKHVNG-GOSISDBHSA-N 0 3 408.571 4.130 20 0 HIADHN O=C(CN[C@H](CO)C1CCCCC1)N1N=C(c2cccs2)C[C@H]1c1cccs1 ZINC000543839351 940205252 /nfs/dbraw/zinc/20/52/52/940205252.db2.gz JCTAQRTZULDMHF-MSOLQXFVSA-N 0 3 417.600 4.018 20 0 HIADHN C[C@H](NCC(=O)N1CCC(Cc2ccccc2)CC1)c1cccc(-n2ccnc2)c1 ZINC000543866088 940216535 /nfs/dbraw/zinc/21/65/35/940216535.db2.gz FDPUAANUFAHCLP-FQEVSTJZSA-N 0 3 402.542 4.004 20 0 HIADHN COC(=O)c1cccc(NC(=O)C[C@H](C)N[C@H](CC(F)(F)F)c2ccccc2)c1 ZINC000543996566 940288885 /nfs/dbraw/zinc/28/88/85/940288885.db2.gz JMGICOLJDDSCPC-KBXCAEBGSA-N 0 3 408.420 4.474 20 0 HIADHN Cc1cc(F)ccc1-n1ccc(C(=O)NC[C@H]2CCCN(Cc3cccs3)C2)n1 ZINC000543999363 940291345 /nfs/dbraw/zinc/29/13/45/940291345.db2.gz GRIAAUBYGHUZTR-QGZVFWFLSA-N 0 3 412.534 4.023 20 0 HIADHN C[C@H](N[C@H]1CCCN(Cc2nccn2C)C1=O)c1ccc(-c2ccc(F)cc2)s1 ZINC000544014062 940299112 /nfs/dbraw/zinc/29/91/12/940299112.db2.gz JNAAZCFSGQOMEN-YJBOKZPZSA-N 0 3 412.534 4.130 20 0 HIADHN COc1cc(Br)ccc1CCCN(C)Cc1ccc([S@@](C)=O)cc1 ZINC000544144993 940337280 /nfs/dbraw/zinc/33/72/80/940337280.db2.gz FTQCUQCNAFZWGE-XMMPIXPASA-N 0 3 410.377 4.260 20 0 HIADHN O=C([C@H]1CCn2c(cnc2C2CCCCC2)C1)N1CCN(CC2CCCCC2)CC1 ZINC000544197808 940351520 /nfs/dbraw/zinc/35/15/20/940351520.db2.gz NWSJZBCLHWGOBE-QFIPXVFZSA-N 0 3 412.622 4.218 20 0 HIADHN Cc1ccc([C@H](CNC(=O)[C@H]2CCn3c(cnc3C3CCCCC3)C2)N(C)C)cc1 ZINC000544198853 940352228 /nfs/dbraw/zinc/35/22/28/940352228.db2.gz FJWKAQIXVHVXHC-GMAHTHKFSA-N 0 3 408.590 4.221 20 0 HIADHN CC(C)([C@@H](NC(=O)[C@@H]1COc2ccccc21)c1ccc(F)c(F)c1)N1CCCC1 ZINC000544358575 940400643 /nfs/dbraw/zinc/40/06/43/940400643.db2.gz QWVPXSZUCRTYOA-UTKZUKDTSA-N 0 3 400.469 4.173 20 0 HIADHN O=C(CC[C@H]1CCCCO1)N(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000563877641 945318656 /nfs/dbraw/zinc/31/86/56/945318656.db2.gz UDMKETKYUSFAKM-JWQCQUIFSA-N 0 3 421.585 4.424 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)CN[C@H](c2cccs2)C2CC2)c(OC)c1 ZINC000544400086 940412480 /nfs/dbraw/zinc/41/24/80/940412480.db2.gz POSQVEACGRRYEH-AVRDEDQJSA-N 0 3 400.544 4.170 20 0 HIADHN O=C(CN[C@@H](Cc1ccccc1)c1cccs1)NCc1cnn(-c2ccccc2)c1 ZINC000544413765 940417229 /nfs/dbraw/zinc/41/72/29/940417229.db2.gz LHNWXCMMMLFJNW-QFIPXVFZSA-N 0 3 416.550 4.124 20 0 HIADHN Cc1ccsc1[C@@H](Cc1ccccc1)NCC(=O)Nc1ccc(C(=O)N(C)C)cc1 ZINC000544415399 940417306 /nfs/dbraw/zinc/41/73/06/940417306.db2.gz PTULXSOAIIWFFQ-OAQYLSRUSA-N 0 3 421.566 4.270 20 0 HIADHN CC[C@H](NC[C@@H](O)COc1ccc(Oc2ccccc2)cc1)c1c(C)nn(C)c1C ZINC000544417275 940417744 /nfs/dbraw/zinc/41/77/44/940417744.db2.gz SARSVQKURAKYRO-XXBNENTESA-N 0 3 409.530 4.310 20 0 HIADHN Cc1nn(-c2ccc(C)cc2)c(C)c1NC(=O)CN[C@H](C)[C@H]1Oc2ccccc2[C@H]1C ZINC000544519785 940470107 /nfs/dbraw/zinc/47/01/07/940470107.db2.gz QUOMNGZTDAMHTN-UAYVVIHISA-N 0 3 418.541 4.279 20 0 HIADHN Cc1nn(-c2ccc(C)cc2)c(C)c1NC(=O)CN[C@H](C)[C@@H]1Oc2ccccc2[C@@H]1C ZINC000544519782 940470110 /nfs/dbraw/zinc/47/01/10/940470110.db2.gz QUOMNGZTDAMHTN-LAVPKYONSA-N 0 3 418.541 4.279 20 0 HIADHN C[C@H](NCC(=O)Nc1cccc(CSc2ccccn2)c1)[C@@H]1COc2ccccc21 ZINC000544523409 940471450 /nfs/dbraw/zinc/47/14/50/940471450.db2.gz ULCMGOXPCHREDN-UWJYYQICSA-N 0 3 419.550 4.467 20 0 HIADHN C[C@H](Cc1c(F)cccc1F)NC(=O)CN(C)[C@@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000544527552 940472014 /nfs/dbraw/zinc/47/20/14/940472014.db2.gz AGZGEDMVKVPBDZ-LDJQZATESA-N 0 3 420.475 4.003 20 0 HIADHN C[C@H](Cc1c(F)cccc1F)NC(=O)CN(C)[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000544527554 940472262 /nfs/dbraw/zinc/47/22/62/940472262.db2.gz AGZGEDMVKVPBDZ-YBOAYWMSSA-N 0 3 420.475 4.003 20 0 HIADHN CC(C)c1ccc(CCNC(=O)CN(C)[C@H]2CCO[C@H](c3ccc(F)cc3)C2)cc1 ZINC000544530438 940472576 /nfs/dbraw/zinc/47/25/76/940472576.db2.gz UETUZFVYTXWGMX-ZEQRLZLVSA-N 0 3 412.549 4.460 20 0 HIADHN O=C(NCc1nc2ccccc2n1C1CC1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000544794403 940514720 /nfs/dbraw/zinc/51/47/20/940514720.db2.gz QNYRZISCEIBANS-SFHVURJKSA-N 0 3 406.505 4.039 20 0 HIADHN CCN(C(=O)Cc1c(C)nn(-c2ccccc2)c1C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000544848690 940518935 /nfs/dbraw/zinc/51/89/35/940518935.db2.gz HHWHITLIGMRNCA-XMMPIXPASA-N 0 3 416.569 4.155 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2ccc(F)c(Cl)c2F)cc1)[C@H]1CCCN(C)C1 ZINC000544852582 940519284 /nfs/dbraw/zinc/51/92/84/940519284.db2.gz WQADOIOQUIIWSH-HNNXBMFYSA-N 0 3 421.875 4.037 20 0 HIADHN Cc1cccc(C)c1[C@@H](C)NCC(=O)N1CCC[C@@H]1c1ccc2c(c1)OCCCO2 ZINC000544895020 940522670 /nfs/dbraw/zinc/52/26/70/940522670.db2.gz BORXEPZTFWQTKV-TZIWHRDSSA-N 0 3 408.542 4.479 20 0 HIADHN CC(C)N1CCN(c2ccc(-c3nc(Cc4cccc5cccnc54)no3)cc2)CC1 ZINC000545013014 940533530 /nfs/dbraw/zinc/53/35/30/940533530.db2.gz GOXIJEHEBWYXGR-UHFFFAOYSA-N 0 3 413.525 4.406 20 0 HIADHN C[C@H](CNC(=O)c1ccccc1)c1noc([C@H]2CCCN(Cc3cccc(F)c3)C2)n1 ZINC000545046313 940536648 /nfs/dbraw/zinc/53/66/48/940536648.db2.gz AFGKXNWWXOLDCY-XLIONFOSSA-N 0 3 422.504 4.122 20 0 HIADHN C(=C\c1ccc(OCc2ccccn2)cc1)\c1nc(CC2=N[C@@H]3CCCC[C@H]3N2)no1 ZINC000545125921 940545490 /nfs/dbraw/zinc/54/54/90/940545490.db2.gz DHOMHFFLCURYOA-LUUCIGQJSA-N 0 3 415.497 4.069 20 0 HIADHN CC1(C)OCc2cc(CN(Cc3ccc(C(=O)NC4CC4)cc3)C3CC3)ccc2O1 ZINC000545247135 940558349 /nfs/dbraw/zinc/55/83/49/940558349.db2.gz FXUOZPWTGSRHNW-UHFFFAOYSA-N 0 3 406.526 4.389 20 0 HIADHN O=C(c1cccc(CN[C@H](c2cccc(C(F)(F)F)c2)C2CC2)c1)N1CCOCC1 ZINC000545279203 940559997 /nfs/dbraw/zinc/55/99/97/940559997.db2.gz LDIGPEXHIYDWRM-NRFANRHFSA-N 0 3 418.459 4.419 20 0 HIADHN O=C([C@H]1CCCN(Cc2cccnc2)C1)N1CCC(=Cc2ccc(F)c(F)c2)CC1 ZINC000545306137 940561060 /nfs/dbraw/zinc/56/10/60/940561060.db2.gz SBLJRMFMCHOESH-NRFANRHFSA-N 0 3 411.496 4.278 20 0 HIADHN CCO[C@@H]1C[C@H](NCc2c(C)nn(Cc3ccc(Cl)cc3)c2C)[C@@]12CCCO2 ZINC000545349783 940563850 /nfs/dbraw/zinc/56/38/50/940563850.db2.gz GTMMWEDMUPOJHI-BDTNDASRSA-N 0 3 403.954 4.018 20 0 HIADHN C[C@@H](CC(=O)c1ccc(Cl)cc1)C(=O)NC1CCN(CCc2ccccc2)CC1 ZINC000545375324 940566879 /nfs/dbraw/zinc/56/68/79/940566879.db2.gz SZBQDARBXXJONL-SFHVURJKSA-N 0 3 412.961 4.372 20 0 HIADHN CN(C(=O)N[C@H](CC(C)(C)C)C(F)(F)F)C1CCN(CCc2ccccn2)CC1 ZINC000545405727 940568656 /nfs/dbraw/zinc/56/86/56/940568656.db2.gz KNVKFGXZHKVAOV-GOSISDBHSA-N 0 3 414.516 4.097 20 0 HIADHN CS[C@H]1CN(C(=O)Nc2ccc(Sc3nc(C)cs3)cc2C)C[C@@H]1N(C)C ZINC000545421109 940569137 /nfs/dbraw/zinc/56/91/37/940569137.db2.gz QQQBIVKSTLTJNI-IRXDYDNUSA-N 0 3 422.645 4.420 20 0 HIADHN CCN1C(=O)CCc2cc(NC(=O)N3CCCN(Cc4ccccc4)C[C@@H]3C)ccc21 ZINC000545430822 940569557 /nfs/dbraw/zinc/56/95/57/940569557.db2.gz DVYCQUNXBMMJHB-IBGZPJMESA-N 0 3 420.557 4.114 20 0 HIADHN CS[C@@H]1CN(C(=O)Nc2ccc(Br)cc2C(C)C)C[C@H]1N(C)C ZINC000545442851 940570070 /nfs/dbraw/zinc/57/00/70/940570070.db2.gz YYPUKHUTRGYJLS-HZPDHXFCSA-N 0 3 400.386 4.082 20 0 HIADHN COc1cc([C@H](C)N[C@@H](C)[C@H](OC)c2ccccc2Cl)ccc1S(C)(=O)=O ZINC000545460615 940570954 /nfs/dbraw/zinc/57/09/54/940570954.db2.gz RNJMFEAQFYPWTD-YRVVQQKDSA-N 0 3 411.951 4.179 20 0 HIADHN COc1ccc(C(=O)C(=O)N(C)[C@@H]2CCN(Cc3ccccc3)[C@H](C)C2)cc1Cl ZINC000545475271 940571262 /nfs/dbraw/zinc/57/12/62/940571262.db2.gz FLFOWEZBLBHDFK-VQIMIIECSA-N 0 3 414.933 4.043 20 0 HIADHN CCN(C(=O)[C@@H](C)Oc1ccc(CCC(C)=O)cc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000545474942 940571304 /nfs/dbraw/zinc/57/13/04/940571304.db2.gz IUUSPBQCMHPJAQ-ZJSXRUAMSA-N 0 3 422.569 4.099 20 0 HIADHN CCN(C(=O)c1cc(OC)c(OC)cc1Cl)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000545476559 940571474 /nfs/dbraw/zinc/57/14/74/940571474.db2.gz AAQJAYFHVVZVFR-QGZVFWFLSA-N 0 3 402.922 4.094 20 0 HIADHN CCN(C(=O)c1[nH]nc(C(C)C)c1Br)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000545492168 940571949 /nfs/dbraw/zinc/57/19/49/940571949.db2.gz YEDKSYCRCQWLOE-MRXNPFEDSA-N 0 3 419.367 4.032 20 0 HIADHN CCN(CC(=O)Nc1ccccc1C(F)(F)F)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000545518861 940572849 /nfs/dbraw/zinc/57/28/49/940572849.db2.gz BFUVYOOZMLQNIO-GOSISDBHSA-N 0 3 405.464 4.240 20 0 HIADHN CC(C)Oc1ccc(/C=C\c2nc(-c3ccc(N4CCCN(C)CC4)nc3)no2)cc1 ZINC000545652468 940579018 /nfs/dbraw/zinc/57/90/18/940579018.db2.gz DQEJXNZWOUXKQQ-GHXNOFRVSA-N 0 3 419.529 4.231 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)c1cc(C)n(-c2ccccc2Cl)n1)c1ccco1 ZINC000563986685 945336612 /nfs/dbraw/zinc/33/66/12/945336612.db2.gz YITRQORCMVQIBC-KSSFIOAISA-N 0 3 400.910 4.286 20 0 HIADHN CCN(Cc1ccccc1Br)C(=O)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000545994795 940671561 /nfs/dbraw/zinc/67/15/61/940671561.db2.gz HLEDLHGAJHEIBY-LJQANCHMSA-N 0 3 416.363 4.105 20 0 HIADHN Cc1cc(CN2CCSCC2)ccc1N[C@@H](C)Cn1cc(Br)cn1 ZINC000546007533 940673840 /nfs/dbraw/zinc/67/38/40/940673840.db2.gz FPLYXOOCASZVSG-HNNXBMFYSA-N 0 3 409.397 4.003 20 0 HIADHN Cc1cc(NC(=O)c2oc(C3CC3)nc2C)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000546050088 940682736 /nfs/dbraw/zinc/68/27/36/940682736.db2.gz RJJJZIMUUNACKC-LJQANCHMSA-N 0 3 405.502 4.065 20 0 HIADHN Cc1ccc(C(=O)NCCCN2CCN(C)CC2)c(Sc2ccc(Cl)cc2)c1 ZINC000546080230 940693301 /nfs/dbraw/zinc/69/33/01/940693301.db2.gz YGCLXTBQBPTLKL-UHFFFAOYSA-N 0 3 418.006 4.167 20 0 HIADHN CCN1CCN(CCCNC(=O)c2cc(Cl)ccc2Sc2ccccc2)CC1 ZINC000546082393 940693964 /nfs/dbraw/zinc/69/39/64/940693964.db2.gz IDVGBVQVZWGRCQ-UHFFFAOYSA-N 0 3 418.006 4.249 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)N[C@H](CC(C)(C)C)C(F)(F)F)CC2)C[C@H](C)O1 ZINC000546110713 940702106 /nfs/dbraw/zinc/70/21/06/940702106.db2.gz OFIRMRTVDZXLIL-SOLBZPMBSA-N 0 3 421.548 4.274 20 0 HIADHN Cc1ccc(C(C)(C)NC(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)cn1 ZINC000546120115 940704925 /nfs/dbraw/zinc/70/49/25/940704925.db2.gz AKFBVZSYMWWHEO-IBGZPJMESA-N 0 3 400.592 4.459 20 0 HIADHN Cc1ccc(C(C)(C)NC(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)cn1 ZINC000546120118 940705060 /nfs/dbraw/zinc/70/50/60/940705060.db2.gz AKFBVZSYMWWHEO-LJQANCHMSA-N 0 3 400.592 4.459 20 0 HIADHN CCN(C(=O)c1cc(C(C)C)nc2onc(C)c21)[C@H]1CCN(Cc2ccccc2)C1 ZINC000546184632 940724382 /nfs/dbraw/zinc/72/43/82/940724382.db2.gz KUTBBTRIACAGPB-IBGZPJMESA-N 0 3 406.530 4.391 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)NCCC[C@@H]1CCCCO1 ZINC000546193018 940725978 /nfs/dbraw/zinc/72/59/78/940725978.db2.gz SYFLAFOTLURQLZ-IBGZPJMESA-N 0 3 415.500 4.128 20 0 HIADHN Cc1nc(-c2cccc(-c3noc([C@H]4CCCN(Cc5cccc(F)c5)C4)n3)c2)n[nH]1 ZINC000546467603 940827750 /nfs/dbraw/zinc/82/77/50/940827750.db2.gz JMBDOSOGIHBFTE-IBGZPJMESA-N 0 3 418.476 4.349 20 0 HIADHN O=S(=O)(CCCN[C@@H](COc1ccccc1F)c1ccccc1)c1ccccc1 ZINC000546629208 940862744 /nfs/dbraw/zinc/86/27/44/940862744.db2.gz JBOPEBBTITZDDX-QFIPXVFZSA-N 0 3 413.514 4.399 20 0 HIADHN C[C@@H](NCCCS(=O)(=O)c1ccccc1)c1cccc(OCc2ccccn2)c1 ZINC000546629010 940862759 /nfs/dbraw/zinc/86/27/59/940862759.db2.gz YGPCWYCPHNFAPL-LJQANCHMSA-N 0 3 410.539 4.175 20 0 HIADHN CC[C@@H](N[C@@H](C)CCN1C(=O)c2ccccc2C1=O)c1nc(C(F)(F)F)cs1 ZINC000546660794 940866374 /nfs/dbraw/zinc/86/63/74/940866374.db2.gz KEXIYZHBXNPNQY-SMDDNHRTSA-N 0 3 411.449 4.277 20 0 HIADHN C[C@@H](CNC(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1)c1nccs1 ZINC000546746097 940875582 /nfs/dbraw/zinc/87/55/82/940875582.db2.gz FGSSMSQDHOXUHC-AWEZNQCLSA-N 0 3 414.497 4.039 20 0 HIADHN CCCN(C(=O)NC[C@@H](C)c1nccs1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000546747686 940875916 /nfs/dbraw/zinc/87/59/16/940875916.db2.gz YZMLLKYCVKDMPU-UYAOXDASSA-N 0 3 400.592 4.333 20 0 HIADHN COc1ccc(C(=O)CC(C)(C)CC(=O)Nc2cc(CN(C)C)ccc2OC)cc1 ZINC000546812153 940886781 /nfs/dbraw/zinc/88/67/81/940886781.db2.gz YLYIBJGOWPHNBR-UHFFFAOYSA-N 0 3 412.530 4.393 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1ccc2c(c1)CCC(=O)N2CC)c1ccsc1 ZINC000546843337 940893108 /nfs/dbraw/zinc/89/31/08/940893108.db2.gz YHJAGDKRGVXZIO-HXUWFJFHSA-N 0 3 414.575 4.252 20 0 HIADHN CCN(C(=O)Cc1ccc(Br)s1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000546889220 940902304 /nfs/dbraw/zinc/90/23/04/940902304.db2.gz IQBGGIZBEPQUIE-MRXNPFEDSA-N 0 3 407.377 4.176 20 0 HIADHN CCN(C(=O)c1ccc(N2CCC(C)CC2)nc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000546891009 940903809 /nfs/dbraw/zinc/90/38/09/940903809.db2.gz VWPUWCOEXBEEHK-QHCPKHFHSA-N 0 3 406.574 4.055 20 0 HIADHN CCC(=O)Nc1cccc(-c2noc(-c3ccc(N4CCN(C(C)C)CC4)cc3)n2)c1 ZINC000546974620 940932300 /nfs/dbraw/zinc/93/23/00/940932300.db2.gz LLGWZKZIUPHBTD-UHFFFAOYSA-N 0 3 419.529 4.283 20 0 HIADHN CC[C@@H](Cc1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1)c1ccc(C)cc1 ZINC000547071335 940983743 /nfs/dbraw/zinc/98/37/43/940983743.db2.gz YZUYADBWWCKHCD-IBGZPJMESA-N 0 3 405.546 4.318 20 0 HIADHN CCOc1cc(CN2CCC(C)(CO)CC2)ccc1OCCOc1ccc(F)cc1 ZINC000547284736 941052064 /nfs/dbraw/zinc/05/20/64/941052064.db2.gz ILOLGOWHNUWLMZ-UHFFFAOYSA-N 0 3 417.521 4.277 20 0 HIADHN COc1ccc(CNCc2cc(Br)cc(Br)c2N)c(C)c1 ZINC000547329906 941056306 /nfs/dbraw/zinc/05/63/06/941056306.db2.gz FTPPTKQECAAJJY-UHFFFAOYSA-N 0 3 414.141 4.401 20 0 HIADHN O=C(NCC1(c2ccc(C(F)(F)F)cc2)CC1)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000547738943 941074188 /nfs/dbraw/zinc/07/41/88/941074188.db2.gz RGWYDNBSXHZKRW-GOSISDBHSA-N 0 3 417.475 4.160 20 0 HIADHN CCc1nncn1CCNCc1cccc(NC(=O)c2ccc(Cl)cc2Cl)c1 ZINC000548117565 941087702 /nfs/dbraw/zinc/08/77/02/941087702.db2.gz AOLGFCLFNKUBTF-UHFFFAOYSA-N 0 3 418.328 4.189 20 0 HIADHN C[C@@H](NCc1ccc(N2CCCS2(=O)=O)c(F)c1)c1ccccc1C(F)(F)F ZINC000548159047 941090064 /nfs/dbraw/zinc/09/00/64/941090064.db2.gz BNFDEKNLTKIGCW-CYBMUJFWSA-N 0 3 416.440 4.235 20 0 HIADHN CCNc1cnc(-c2noc(-c3cccc(CN(C)Cc4ccccc4)c3)n2)cn1 ZINC000548384061 941099046 /nfs/dbraw/zinc/09/90/46/941099046.db2.gz RWNRAMBKVHHSFO-UHFFFAOYSA-N 0 3 400.486 4.257 20 0 HIADHN O=C(NCc1cccc(NC(=O)C23CCCN2CCC3)c1)Nc1ccccc1Cl ZINC000548419487 941102177 /nfs/dbraw/zinc/10/21/77/941102177.db2.gz VVDYVOCTVODEID-UHFFFAOYSA-N 0 3 412.921 4.229 20 0 HIADHN COc1ccc([C@@H](CNC(=O)N[C@H](C(C)(C)C)C(F)(F)F)N2CCCC2)cc1 ZINC000548510295 941111221 /nfs/dbraw/zinc/11/12/21/941111221.db2.gz DEDFTNAQQAFWOS-IAGOWNOFSA-N 0 3 401.473 4.108 20 0 HIADHN CC(=O)[C@@H]1C[C@H](C(=O)N(C[C@H]2CCN(Cc3ccccc3)C2)CC(F)(F)F)C1(C)C ZINC000548695430 941119817 /nfs/dbraw/zinc/11/98/17/941119817.db2.gz PZWAQVJWUANLRN-SLFFLAALSA-N 0 3 424.507 4.151 20 0 HIADHN C[C@H](C1CCCCC1)N(C)CC(=O)Nc1ccccc1I ZINC000548930666 941130206 /nfs/dbraw/zinc/13/02/06/941130206.db2.gz OWUZNJBOJYFMFL-CYBMUJFWSA-N 0 3 400.304 4.130 20 0 HIADHN CCc1nnc(-c2ccc(NC(=O)N[C@H](CN(C)C)c3ccc(Cl)cc3)cc2)o1 ZINC000548964152 941135008 /nfs/dbraw/zinc/13/50/08/941135008.db2.gz KFCSJQPAYUAJIX-GOSISDBHSA-N 0 3 413.909 4.377 20 0 HIADHN CC(C)C(=O)c1ccc([C@@H](C)C(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)cc1 ZINC000549008658 941142437 /nfs/dbraw/zinc/14/24/37/941142437.db2.gz BFQOOURPJGPZAE-QGZVFWFLSA-N 0 3 416.512 4.497 20 0 HIADHN CO[C@H](CN[C@@H](CN1CCCC1=O)c1cccc(C(F)(F)F)c1)c1ccccc1 ZINC000549066374 941151797 /nfs/dbraw/zinc/15/17/97/941151797.db2.gz VECPUIMSWQCKFD-VQTJNVASSA-N 0 3 406.448 4.346 20 0 HIADHN O=C(c1ccc(C[NH+]2CCCC2)cc1)N1CCC[C@H](c2nnc(C3CCCCC3)[n-]2)C1 ZINC000549086327 941155150 /nfs/dbraw/zinc/15/51/50/941155150.db2.gz KVYLUQRUZNUBNB-QFIPXVFZSA-N 0 3 421.589 4.468 20 0 HIADHN CC[C@@H](C)Oc1cc(CNC(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)ccn1 ZINC000549122076 941162294 /nfs/dbraw/zinc/16/22/94/941162294.db2.gz FAHBMPMTQVGMTF-DNVCBOLYSA-N 0 3 404.942 4.014 20 0 HIADHN CC(C)N1CC[C@H](N[C@@H](C)C(=O)Nc2ccc(Cl)cn2)[C@@H]1c1ccc(F)c(F)c1 ZINC000549468438 941193008 /nfs/dbraw/zinc/19/30/08/941193008.db2.gz KSADBWQZIKCSPG-GMVOTWDCSA-N 0 3 422.907 4.154 20 0 HIADHN CC(C)N1CC[C@@H](NCC(=O)NCc2ccc(Cl)cc2)[C@@H]1c1ccc(F)c(F)c1 ZINC000549472343 941193701 /nfs/dbraw/zinc/19/37/01/941193701.db2.gz MTTFFUWKVHRDSM-IRLDBZIGSA-N 0 3 421.919 4.048 20 0 HIADHN CCCCNC(=O)c1ccc(CN[C@@H]2CC[C@H](C(=O)OCC)c3ccccc32)cc1 ZINC000549525913 941198043 /nfs/dbraw/zinc/19/80/43/941198043.db2.gz BEFOBSNAZHPECE-XZOQPEGZSA-N 0 3 408.542 4.488 20 0 HIADHN O=C(NCCN1CCCC1)c1ccc(NCc2ccccc2OC(F)(F)F)cc1 ZINC000549682380 941204343 /nfs/dbraw/zinc/20/43/43/941204343.db2.gz QBOSREGCOCHMEH-UHFFFAOYSA-N 0 3 407.436 4.023 20 0 HIADHN COc1cccc(/C=C(/CC(=O)N2CCCN(C)CC2)c2nc3ccccc3s2)c1 ZINC000549803793 941207855 /nfs/dbraw/zinc/20/78/55/941207855.db2.gz LRSIVESIHQNSFE-CYVLTUHYSA-N 0 3 421.566 4.400 20 0 HIADHN c1csc(Cn2c(Cc3ccsc3)nnc2N2CCN(C3CCCC3)CC2)c1 ZINC000549865028 941219938 /nfs/dbraw/zinc/21/99/38/941219938.db2.gz OTXQECBXUVOHNJ-UHFFFAOYSA-N 0 3 413.616 4.105 20 0 HIADHN C[C@@H](c1ccc(F)cc1)N1CCC[C@H](NCc2ccc(-c3cnn(C)c3)s2)C1=O ZINC000549907513 941235635 /nfs/dbraw/zinc/23/56/35/941235635.db2.gz LXFXLZPUTKMRBT-YWZLYKJASA-N 0 3 412.534 4.130 20 0 HIADHN FC(F)(F)c1ccc(-c2nc(CN3CCC(CCN4CCOCC4)CC3)co2)cc1 ZINC000549930365 941241544 /nfs/dbraw/zinc/24/15/44/941241544.db2.gz AZBSIDDWCNMJTG-UHFFFAOYSA-N 0 3 423.479 4.295 20 0 HIADHN Cc1nnc2c3ccccc3c(N3CCN(Cc4cccc5ccccc54)CC3)nn12 ZINC000550730937 941360518 /nfs/dbraw/zinc/36/05/18/941360518.db2.gz UJSNQHOONLRZPB-UHFFFAOYSA-N 0 3 408.509 4.061 20 0 HIADHN O=C(CN1CCC[C@@H](c2ccccc2)CC1)NCC1(c2ccccc2)CCOCC1 ZINC000550992964 941391719 /nfs/dbraw/zinc/39/17/19/941391719.db2.gz NOJRVGCOBZZYNP-HSZRJFAPSA-N 0 3 406.570 4.121 20 0 HIADHN NS(=O)(=O)c1ccc2c(c1)CCC[C@@H]2N[C@H](c1ccccc1F)C1CCCC1 ZINC000551063521 941403298 /nfs/dbraw/zinc/40/32/98/941403298.db2.gz SLUJDQYRWHBKJE-VXKWHMMOSA-N 0 3 402.535 4.372 20 0 HIADHN NS(=O)(=O)c1ccc2c(c1)CCC[C@H]2N[C@@H](c1ccccc1F)C1CCCC1 ZINC000551063520 941403506 /nfs/dbraw/zinc/40/35/06/941403506.db2.gz SLUJDQYRWHBKJE-FGZHOGPDSA-N 0 3 402.535 4.372 20 0 HIADHN COc1cccc(-c2nc(CN[C@H]3CCN(C)[C@@H]3c3ccccc3)cs2)c1OC ZINC000551069870 941404298 /nfs/dbraw/zinc/40/42/98/941404298.db2.gz WMZDYNIYGSBCDX-PZJWPPBQSA-N 0 3 409.555 4.362 20 0 HIADHN CCCOc1ccccc1Oc1ncccc1CN[C@@H]1CCC[C@H](S(C)(=O)=O)C1 ZINC000551266099 941439290 /nfs/dbraw/zinc/43/92/90/941439290.db2.gz VZLRBCAPMIYZBZ-MOPGFXCFSA-N 0 3 418.559 4.108 20 0 HIADHN O=S1(=O)CC[C@@H](NC[C@@H]2C[C@H]2c2ccccc2)c2cc(Br)ccc21 ZINC000551272921 941440911 /nfs/dbraw/zinc/44/09/11/941440911.db2.gz RGMILWCHGWUQID-QILLFSRXSA-N 0 3 406.345 4.061 20 0 HIADHN CCc1nc(C)c(C(=O)NC[C@H]2CCCN(C)[C@H]2c2ccc(C(F)(F)F)cc2)o1 ZINC000551289675 941444409 /nfs/dbraw/zinc/44/44/09/941444409.db2.gz TZUFQZNEGYNXBW-QAPCUYQASA-N 0 3 409.452 4.377 20 0 HIADHN Cc1ccc2snc(C(=O)NC3CCN(CCOc4ccc(F)cc4)CC3)c2c1 ZINC000551326155 941452872 /nfs/dbraw/zinc/45/28/72/941452872.db2.gz UHPBHQQDBCZLCO-UHFFFAOYSA-N 0 3 413.518 4.017 20 0 HIADHN CNC(=O)COc1cccc(CN[C@H]2CCc3c2cc(Br)cc3Cl)c1 ZINC000551342628 941457390 /nfs/dbraw/zinc/45/73/90/941457390.db2.gz PPTKIGBLJQUNGF-SFHVURJKSA-N 0 3 423.738 4.004 20 0 HIADHN C[C@H]1CCN(C(=O)Nc2ccc(Oc3cccnc3)nc2)CCN1Cc1ccccc1 ZINC000551393061 941468453 /nfs/dbraw/zinc/46/84/53/941468453.db2.gz CJPZTNMTWWXNKJ-IBGZPJMESA-N 0 3 417.513 4.397 20 0 HIADHN CN(C(=O)Nc1ccc(Oc2cccnc2)nc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000551393522 941468511 /nfs/dbraw/zinc/46/85/11/941468511.db2.gz SBHDGSWIPXNYNI-FQEVSTJZSA-N 0 3 403.486 4.007 20 0 HIADHN COC(=O)[C@@H](Cc1ccccc1)[C@H](C)NCC(=O)Nc1ccccc1-c1ccccc1 ZINC000551421982 941475724 /nfs/dbraw/zinc/47/57/24/941475724.db2.gz MXCOWNAYSJSQEH-CVDCTZTESA-N 0 3 416.521 4.302 20 0 HIADHN CC(C)Cc1ncc(CNc2ccc(C(=O)N(C)[C@@H]3CCCN(C)C3)cc2)s1 ZINC000551446531 941480729 /nfs/dbraw/zinc/48/07/29/941480729.db2.gz RGNZTQBRZHDDIY-LJQANCHMSA-N 0 3 400.592 4.120 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)c2cc(C(C)C)nc3c2cnn3C(C)C)cc1 ZINC000551532299 941496636 /nfs/dbraw/zinc/49/66/36/941496636.db2.gz BCBMTYVIEVJXBK-QFIPXVFZSA-N 0 3 423.561 4.177 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NCC2=Cc3cc(Br)ccc3OC2)cc1 ZINC000551581739 941506167 /nfs/dbraw/zinc/50/61/67/941506167.db2.gz QLIGWOXEUSSOMQ-HXUWFJFHSA-N 0 3 417.347 4.126 20 0 HIADHN CCCN(CCC)C(=O)CN[C@@H](c1cccc(C(F)(F)F)c1)C1CCOCC1 ZINC000551721451 941533305 /nfs/dbraw/zinc/53/33/05/941533305.db2.gz VDFAIOQBRXGBEC-HXUWFJFHSA-N 0 3 400.485 4.411 20 0 HIADHN O=C(CN[C@H](c1cccc(C(F)(F)F)c1)C1CCOCC1)N1CCc2ccccc21 ZINC000551721812 941533389 /nfs/dbraw/zinc/53/33/89/941533389.db2.gz JBMNWKZEGSMJFC-QFIPXVFZSA-N 0 3 418.459 4.352 20 0 HIADHN CC(C)(NCC(=O)N1CCC(OCc2ccccc2)CC1)c1ccc(Cl)cc1 ZINC000551748881 941537992 /nfs/dbraw/zinc/53/79/92/941537992.db2.gz FMLMFXRJZGDJHH-UHFFFAOYSA-N 0 3 400.950 4.373 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@H](N[C@@H](C)c2ccc(S(=O)(=O)CC)cc2)c2ccccc21 ZINC000551812758 941550229 /nfs/dbraw/zinc/55/02/29/941550229.db2.gz NHKLBNUAQKLSAI-USCONSEESA-N 0 3 415.555 4.313 20 0 HIADHN CC[C@@H](NCc1ccc(C(=O)N2CCOCC2)cc1)c1ccc(OC(F)(F)F)cc1 ZINC000552040685 941571985 /nfs/dbraw/zinc/57/19/85/941571985.db2.gz LSEKMNNEPFOZJR-HXUWFJFHSA-N 0 3 422.447 4.299 20 0 HIADHN COc1ccc(CN(Cc2cnc(N3CCCC3)nc2)C2CCCCC2)cc1OC ZINC000552041085 941572183 /nfs/dbraw/zinc/57/21/83/941572183.db2.gz YFOHGMINZSNKIE-UHFFFAOYSA-N 0 3 410.562 4.429 20 0 HIADHN CO[C@@H]1C[C@H](c2ccccc2)CC[C@H]1NCC(=O)Nc1ccc(N2CCCC2)cc1C ZINC000552058701 941576374 /nfs/dbraw/zinc/57/63/74/941576374.db2.gz WSLYJBQKHKQELZ-NQHRYMMQSA-N 0 3 421.585 4.475 20 0 HIADHN CNC(=O)COc1cccc(CN[C@H](CSC)c2ccc(C(F)(F)F)cc2)c1 ZINC000552074233 941580038 /nfs/dbraw/zinc/58/00/38/941580038.db2.gz GUNMPSPTPWPKJK-GOSISDBHSA-N 0 3 412.477 4.024 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@H](C)N[C@H](C)c2ccc3n[nH]cc3c2)cc1 ZINC000552098607 941584916 /nfs/dbraw/zinc/58/49/16/941584916.db2.gz JOLLKKGOWCJXCR-JKSUJKDBSA-N 0 3 400.548 4.005 20 0 HIADHN OCc1cn([C@H]2CCCN(Cc3ccc(-c4ccc(C(F)(F)F)cc4)s3)C2)nn1 ZINC000552111334 941586925 /nfs/dbraw/zinc/58/69/25/941586925.db2.gz XRNUPGSNZCHWRR-KRWDZBQOSA-N 0 3 422.476 4.355 20 0 HIADHN CN(CCCN(C)C(=O)c1cc2cc(Br)ccc2o1)Cc1ccncc1 ZINC000552112030 941586944 /nfs/dbraw/zinc/58/69/44/941586944.db2.gz GWQXANFSVRIEQS-UHFFFAOYSA-N 0 3 416.319 4.184 20 0 HIADHN CN(CCCN(C)C(=O)[C@H]1C[C@@H]1c1cccc(C(F)(F)F)c1)Cc1ccncc1 ZINC000552112636 941587246 /nfs/dbraw/zinc/58/72/46/941587246.db2.gz NJFZCHORQCMQSM-UXHICEINSA-N 0 3 405.464 4.184 20 0 HIADHN COc1cc(C(=O)N(C)CCCN(C)Cc2ccncc2)ccc1OC1CCCC1 ZINC000552112600 941587366 /nfs/dbraw/zinc/58/73/66/941587366.db2.gz LINRQASFOCJNBP-UHFFFAOYSA-N 0 3 411.546 4.006 20 0 HIADHN COc1cc(CN2CCC[C@H](O)CC2)ccc1OCc1ccc(Br)cc1 ZINC000552147121 941593795 /nfs/dbraw/zinc/59/37/95/941593795.db2.gz MIJBNWBQIPHHMT-IBGZPJMESA-N 0 3 420.347 4.384 20 0 HIADHN Cc1ccc(OCc2ccc(C(=O)Nc3cccc(CN4CC[C@@H](O)C4)c3)o2)c(C)c1 ZINC000552199646 941600339 /nfs/dbraw/zinc/60/03/39/941600339.db2.gz CBHFYSDEVDYQTD-OAQYLSRUSA-N 0 3 420.509 4.294 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)c1cccc(NC(=O)C2CCCCC2)c1 ZINC000552198954 941600715 /nfs/dbraw/zinc/60/07/15/941600715.db2.gz KBCPPESAJQXFKU-QHCPKHFHSA-N 0 3 421.541 4.024 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)c1ccc(C)c(NC(C)=O)c1)c1ccc(Cl)cc1 ZINC000552242753 941612461 /nfs/dbraw/zinc/61/24/61/941612461.db2.gz HPJPJGZIVYBSBG-NRFANRHFSA-N 0 3 401.938 4.420 20 0 HIADHN CC[C@H](N[C@H](C)c1cccc(S(=O)(=O)NC)c1)c1ccc(OC(F)(F)F)cc1 ZINC000552247635 941613426 /nfs/dbraw/zinc/61/34/26/941613426.db2.gz WBFFWFVVZPHMAP-ACJLOTCBSA-N 0 3 416.465 4.295 20 0 HIADHN CC[C@@H](NCc1cccc(OCC(=O)N(C)C)c1)c1ccc(OC(F)(F)F)cc1 ZINC000552255396 941615291 /nfs/dbraw/zinc/61/52/91/941615291.db2.gz DRAOCCCWTVLXDU-LJQANCHMSA-N 0 3 410.436 4.293 20 0 HIADHN COc1ccc([C@@H](Cc2ccncc2)NCc2nc(-c3ccc(F)cc3)n[nH]2)cc1 ZINC000552275907 941620420 /nfs/dbraw/zinc/62/04/20/941620420.db2.gz DORFXGDNCXZAFW-OAQYLSRUSA-N 0 3 403.461 4.088 20 0 HIADHN COc1ccc([C@@H](Cc2ccncc2)[NH2+]Cc2nnc(-c3ccc(F)cc3)[n-]2)cc1 ZINC000552275907 941620422 /nfs/dbraw/zinc/62/04/22/941620422.db2.gz DORFXGDNCXZAFW-OAQYLSRUSA-N 0 3 403.461 4.088 20 0 HIADHN CCOc1ccc(OC)cc1NC(=O)NC[C@H](c1ccc(OC)cc1)N1CCCC1 ZINC000552281344 941621669 /nfs/dbraw/zinc/62/16/69/941621669.db2.gz RCBJFJCIENPFIH-OAQYLSRUSA-N 0 3 413.518 4.061 20 0 HIADHN Cc1ccc(C(=O)CCCC(=O)N2CC[C@]3(CCN(Cc4ccccc4)C3)C2)cc1 ZINC000552336320 941636438 /nfs/dbraw/zinc/63/64/38/941636438.db2.gz YUGZABILQICWBQ-SANMLTNESA-N 0 3 404.554 4.473 20 0 HIADHN C[C@@H](N[C@@H]1CCC(C)(C)c2ccc(Br)cc21)C1(S(C)(=O)=O)CC1 ZINC000552341149 941638244 /nfs/dbraw/zinc/63/82/44/941638244.db2.gz GRMPOVYUFKRWIW-MLGOLLRUSA-N 0 3 400.382 4.117 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)Nc3cccc(CC[NH+]4CCCC4)c3)cc2)cc(=O)[n-]1 ZINC000552369930 941646931 /nfs/dbraw/zinc/64/69/31/941646931.db2.gz LLAVIQLWVHCJFW-UHFFFAOYSA-N 0 3 417.513 4.440 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)c1ccc(OCc2ccncc2)cc1 ZINC000552540997 941701763 /nfs/dbraw/zinc/70/17/63/941701763.db2.gz AOWYFCQHYRWVDG-DEOSSOPVSA-N 0 3 401.510 4.228 20 0 HIADHN O=C([C@H]1CN(Cc2ccccc2)CCC1(F)F)N1CCC(F)(c2cccnc2)CC1 ZINC000552544729 941702897 /nfs/dbraw/zinc/70/28/97/941702897.db2.gz BZPKMHFSSRZTOK-HXUWFJFHSA-N 0 3 417.475 4.026 20 0 HIADHN O[C@@H](COc1cccc(C(F)(F)F)c1)CN1CCC(OC2CCCCC2)CC1 ZINC000552617409 941724927 /nfs/dbraw/zinc/72/49/27/941724927.db2.gz JXAAOTRSLGOXRY-QGZVFWFLSA-N 0 3 401.469 4.259 20 0 HIADHN COc1ccccc1CC(C)(C)NC(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000552651378 941730528 /nfs/dbraw/zinc/73/05/28/941730528.db2.gz MHCYMQTXJQFGBK-SFHVURJKSA-N 0 3 401.576 4.214 20 0 HIADHN O[C@@H](CN[C@@H]1CCSc2c(F)cccc21)COc1cccc(Br)c1 ZINC000552679917 941735865 /nfs/dbraw/zinc/73/58/65/941735865.db2.gz WTISINRMWRYJBE-SUMWQHHRSA-N 0 3 412.324 4.155 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c2sc(C(=O)N3C[C@@H](N4CCCC4)C[C@@H]3C)cc12 ZINC000552680318 941736526 /nfs/dbraw/zinc/73/65/26/941736526.db2.gz OMTBVUZWSLWDNV-KSSFIOAISA-N 0 3 412.534 4.233 20 0 HIADHN O=C(CCc1nccs1)N(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000552851050 941787892 /nfs/dbraw/zinc/78/78/92/941787892.db2.gz IKIRSPIRWSSCJV-JOCHJYFZSA-N 0 3 420.582 4.164 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)Nc1ccccc1OC(F)F)c1ccc(-n2cccn2)cc1 ZINC000553034429 941820934 /nfs/dbraw/zinc/82/09/34/941820934.db2.gz HDZAYHBEQIFTFE-CABCVRRESA-N 0 3 400.429 4.152 20 0 HIADHN CCCN(CCN1CCCC1)C(=O)c1oc2ccccc2c1CSc1ncccn1 ZINC000553066542 941827666 /nfs/dbraw/zinc/82/76/66/941827666.db2.gz JBOFOEOZYAPJJX-UHFFFAOYSA-N 0 3 424.570 4.463 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)c1scnc1C(F)(F)F ZINC000553073707 941828672 /nfs/dbraw/zinc/82/86/72/941828672.db2.gz WODOJGQEHDAKLQ-UHFFFAOYSA-N 0 3 401.479 4.006 20 0 HIADHN COC1(CC(=O)N(Cc2ccncc2)[C@@H]2CCCN(Cc3ccccc3)C2)CCC1 ZINC000553174458 941844873 /nfs/dbraw/zinc/84/48/73/941844873.db2.gz UOIRMVNFJNEORK-HSZRJFAPSA-N 0 3 407.558 4.034 20 0 HIADHN CC1CCN(C[C@H]2CCCN(c3ccc(S(C)(=O)=O)cc3C(F)(F)F)C2)CC1 ZINC000553328919 941868541 /nfs/dbraw/zinc/86/85/41/941868541.db2.gz NEQWZIQGNXRCTO-MRXNPFEDSA-N 0 3 418.525 4.057 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N[C@H](C)c1nccn1-c1ccccc1)c1ccsc1 ZINC000553412563 941881272 /nfs/dbraw/zinc/88/12/72/941881272.db2.gz SDMNTRMIGLMUPO-XLIONFOSSA-N 0 3 411.575 4.377 20 0 HIADHN Cc1noc([C@@H]2CC[C@H](CNc3ccnc4ccc(Oc5ccccc5)cc43)O2)n1 ZINC000553540888 941905216 /nfs/dbraw/zinc/90/52/16/941905216.db2.gz KWGQLLQAWWQTAK-GCJKJVERSA-N 0 3 402.454 4.473 20 0 HIADHN CCCN(C)[C@H](CNC(=O)NCc1nccn1CC(C)C)c1ccc(Cl)cc1 ZINC000553555401 941908311 /nfs/dbraw/zinc/90/83/11/941908311.db2.gz XHZCZHALZQSTQY-LJQANCHMSA-N 0 3 405.974 4.075 20 0 HIADHN C[C@@H]1C[C@@H]1[C@@H](NCC(=O)NC[C@H]1CCN(c2ccccc2)C1)c1ccc(Cl)cc1 ZINC000553622041 941922502 /nfs/dbraw/zinc/92/25/02/941922502.db2.gz QLTMMSBZXRTRJT-CIBKWALQSA-N 0 3 411.977 4.269 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)c2cnc(-c3ccncc3)s2)N(C)C)cc1 ZINC000553670515 941941163 /nfs/dbraw/zinc/94/11/63/941941163.db2.gz ANNBPCLAZDPVMJ-IBGZPJMESA-N 0 3 410.543 4.025 20 0 HIADHN Cc1c2cc(Br)ccc2oc1C(=O)N1CCN(C2CCC2)C[C@@H](C)C1 ZINC000553856413 941983977 /nfs/dbraw/zinc/98/39/77/941983977.db2.gz PGCKKQLPJPOQQU-CYBMUJFWSA-N 0 3 405.336 4.450 20 0 HIADHN COc1cc(CNC[C@H](O)C(F)F)ccc1OCc1cccc(C(F)(F)F)c1 ZINC000553866848 941987487 /nfs/dbraw/zinc/98/74/87/941987487.db2.gz KCMRSYWQRRAMJN-HNNXBMFYSA-N 0 3 405.363 4.009 20 0 HIADHN Cc1cc(C)c(CN2CCC[C@H](C(=O)N3CCCC3)C2)c(OCc2ccccc2)n1 ZINC000553884692 941990811 /nfs/dbraw/zinc/99/08/11/941990811.db2.gz MENSBMPBYJUBLT-QFIPXVFZSA-N 0 3 407.558 4.112 20 0 HIADHN Cc1ccc(NC(=O)c2nnc(CN(CCN3CCCCCC3)C(C)C)s2)cc1 ZINC000553936024 942002118 /nfs/dbraw/zinc/00/21/18/942002118.db2.gz OFKFXZMQHZQVQS-UHFFFAOYSA-N 0 3 415.607 4.185 20 0 HIADHN COc1ccc2c(c1)CCC[C@H]2N(C)C(=O)NCCCN1CCc2ccccc2C1 ZINC000553934799 942002248 /nfs/dbraw/zinc/00/22/48/942002248.db2.gz KRVQFQBIESPHJR-XMMPIXPASA-N 0 3 407.558 4.162 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)c2ccc(F)cc2Br)N(C)C)cc1 ZINC000554013572 942019176 /nfs/dbraw/zinc/01/91/76/942019176.db2.gz VYAAFKKZXRTRDG-LJQANCHMSA-N 0 3 423.326 4.408 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)c2ccc([C@H]3CCCOC3)cc2)N(C)C)cc1 ZINC000554040393 942024106 /nfs/dbraw/zinc/02/41/06/942024106.db2.gz NKCDPASYWCXWGF-LADGPHEKSA-N 0 3 410.558 4.401 20 0 HIADHN CCN(C)C(=O)c1cccc(C(=O)NC[C@@H](c2ccc(CC(C)C)cc2)N(C)C)c1 ZINC000554079614 942031624 /nfs/dbraw/zinc/03/16/24/942031624.db2.gz WXIPCZSKFVPBJK-QHCPKHFHSA-N 0 3 409.574 4.010 20 0 HIADHN C[C@@H](NC(=O)Nc1cc(N2CCCC2=O)ccc1Cl)[C@@H](c1ccccc1)N(C)C ZINC000554107297 942037381 /nfs/dbraw/zinc/03/73/81/942037381.db2.gz DBFUDTRTRNGWOS-VFNWGFHPSA-N 0 3 414.937 4.280 20 0 HIADHN COc1cccc(Cl)c1-c1noc(C)c1C(=O)N1CCN([C@@H]2C[C@@H]2C)C[C@@H](C)C1 ZINC000554128438 942043592 /nfs/dbraw/zinc/04/35/92/942043592.db2.gz KGRDNNNEDXTBCY-JKIFEVAISA-N 0 3 417.937 4.114 20 0 HIADHN CC(C)CC(=O)Nc1ccc(NC(=O)N[C@H](CN(C)C)c2ccc(F)cc2)cc1 ZINC000554140195 942047399 /nfs/dbraw/zinc/04/73/99/942047399.db2.gz XBXLGVKYLAJNKO-HXUWFJFHSA-N 0 3 400.498 4.235 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)Nc2cccc(NC(=O)C3CC3)c2)N(C)C)cc1 ZINC000554145746 942049601 /nfs/dbraw/zinc/04/96/01/942049601.db2.gz XNTHVHYVLRAVSJ-QFIPXVFZSA-N 0 3 424.545 4.247 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1ccccc1OC[C@@H]1CCCCO1)c1ccco1 ZINC000554192917 942063643 /nfs/dbraw/zinc/06/36/43/942063643.db2.gz NLHFGNQAMSUCSY-BJLQDIEVSA-N 0 3 415.534 4.478 20 0 HIADHN C[C@H](NC(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F)[C@@H]1OCCc2sccc21 ZINC000554208372 942067186 /nfs/dbraw/zinc/06/71/86/942067186.db2.gz HREFLFAEFSYOGS-QSFXBCCZSA-N 0 3 420.525 4.024 20 0 HIADHN Cc1cc(C(=O)N(Cc2ccccc2)C2CCN(C)CC2)nn1-c1ccc(F)cc1 ZINC000554289646 942092019 /nfs/dbraw/zinc/09/20/19/942092019.db2.gz FSVBYVYHPPOYHF-UHFFFAOYSA-N 0 3 406.505 4.056 20 0 HIADHN COc1ccc(CN2CC[C@H](N[C@H](C)c3cc4ccccc4s3)C2=O)c(OC)c1 ZINC000554355853 942111533 /nfs/dbraw/zinc/11/15/33/942111533.db2.gz JQHMIAYISZZLFG-BEFAXECRSA-N 0 3 410.539 4.370 20 0 HIADHN CC(C)Cc1ccc([C@@H](CNC(=O)Nc2ccc3c(c2)NC(=O)[C@H](C)O3)N(C)C)cc1 ZINC000554366282 942116303 /nfs/dbraw/zinc/11/63/03/942116303.db2.gz ZNHPOCMEJKCJAN-HRAATJIYSA-N 0 3 424.545 4.029 20 0 HIADHN C[C@H](N[C@@H]1CCCN(S(=O)(=O)c2cccs2)C1)c1ccc(Cl)c(F)c1 ZINC000554370464 942116977 /nfs/dbraw/zinc/11/69/77/942116977.db2.gz RCRPDYSWGJZUDS-GXTWGEPZSA-N 0 3 402.944 4.045 20 0 HIADHN O=C(CCCc1ccc([O-])c(F)c1)N1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000554411547 942132283 /nfs/dbraw/zinc/13/22/83/942132283.db2.gz JOCQCDJOWNBVNZ-UHFFFAOYSA-N 0 3 410.533 4.369 20 0 HIADHN Cc1ccc(-c2nnco2)cc1NC(=O)NC[C@@H](c1ccc(OC(C)C)cc1)N(C)C ZINC000554446435 942146538 /nfs/dbraw/zinc/14/65/38/942146538.db2.gz HPSPWVDYLDVMCE-NRFANRHFSA-N 0 3 423.517 4.257 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N2C[C@H](c3ccccc3)[C@@H]3COCC[C@@H]32)N(C)C)cc1 ZINC000554451521 942148548 /nfs/dbraw/zinc/14/85/48/942148548.db2.gz ZTAANGHWDCDAEC-ROHNOIKCSA-N 0 3 421.585 4.066 20 0 HIADHN COc1cccc([C@@H](CNC(=O)NCc2ccc(CSC)cc2)N2CCCC2)c1 ZINC000554466695 942153234 /nfs/dbraw/zinc/15/32/34/942153234.db2.gz KCIKZRGWVNBJHF-JOCHJYFZSA-N 0 3 413.587 4.195 20 0 HIADHN CC(=O)N(C)c1cccc(NC(=O)NC[C@H](c2ccc(CC(C)C)cc2)N(C)C)c1 ZINC000554479217 942156878 /nfs/dbraw/zinc/15/68/78/942156878.db2.gz FYBUOYHQHLXMEA-HSZRJFAPSA-N 0 3 410.562 4.292 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)c3ccc(Oc4ccccc4)cn3)CC2)C[C@H](C)O1 ZINC000554596287 942173662 /nfs/dbraw/zinc/17/36/62/942173662.db2.gz NZXFCKURSDKABP-PMACEKPBSA-N 0 3 423.557 4.225 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)c1ccc(-c2noc(C(F)F)n2)cc1)c1ccco1 ZINC000554633726 942181249 /nfs/dbraw/zinc/18/12/49/942181249.db2.gz ZENRCLXHDPGMPZ-WFASDCNBSA-N 0 3 404.417 4.126 20 0 HIADHN Cc1ccc(C(=O)N[C@@H](CN(C)C)c2ccc(F)cc2)cc1NC(=O)c1ccccc1 ZINC000554656393 942189604 /nfs/dbraw/zinc/18/96/04/942189604.db2.gz ZDIOEJYQEKEDLL-QHCPKHFHSA-N 0 3 419.500 4.419 20 0 HIADHN O=S(=O)([N-]c1ccc(CC[NH+]2CCSCC2)cc1)c1ccc(C(F)F)cc1 ZINC000554727429 942212409 /nfs/dbraw/zinc/21/24/09/942212409.db2.gz TYAIBZVTZFGDCV-UHFFFAOYSA-N 0 3 412.527 4.016 20 0 HIADHN COc1cc(Cl)c(NC(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)cc1C ZINC000554799124 942245392 /nfs/dbraw/zinc/24/53/92/942245392.db2.gz YZCOONRVSCNYAO-UHFFFAOYSA-N 0 3 401.938 4.440 20 0 HIADHN Cc1cc2ncn(C[C@@H](O)CNCc3ccccc3OCc3ccccc3)c2cc1C ZINC000554831422 942269337 /nfs/dbraw/zinc/26/93/37/942269337.db2.gz NEXVTEBBHVPZMH-QHCPKHFHSA-N 0 3 415.537 4.383 20 0 HIADHN FC1(F)CCN(Cc2ccccc2)C[C@H]1c1nc(-c2nnc(-c3ccccc3)o2)no1 ZINC000554832380 942269965 /nfs/dbraw/zinc/26/99/65/942269965.db2.gz PFHRFVUYGBVTQI-KRWDZBQOSA-N 0 3 423.423 4.411 20 0 HIADHN Cn1cc(C(F)(F)F)nc1[C@@H]1CCCN(Cc2cnc(-c3ccncc3)s2)C1 ZINC000554863235 942297356 /nfs/dbraw/zinc/29/73/56/942297356.db2.gz CLGBTKXCJUMLAR-CQSZACIVSA-N 0 3 407.465 4.337 20 0 HIADHN CC(C)c1nn(-c2ccccc2)cc1CN1CCC[C@@H](CNC(=O)CC(F)(F)F)C1 ZINC000554873043 942302887 /nfs/dbraw/zinc/30/28/87/942302887.db2.gz GCFFDLUNALKPHB-KRWDZBQOSA-N 0 3 422.495 4.276 20 0 HIADHN Cc1n[nH]c(C)c1[C@H]1CCCCCN1Cc1ccccc1OCC(=O)N1CCCC1 ZINC000554878653 942305606 /nfs/dbraw/zinc/30/56/06/942305606.db2.gz CPHQPAQUIFPWBM-OAQYLSRUSA-N 0 3 410.562 4.145 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)c(Cl)c1 ZINC000554905358 942313873 /nfs/dbraw/zinc/31/38/73/942313873.db2.gz GQVJUFIGBLQIQV-SFHVURJKSA-N 0 3 409.317 4.376 20 0 HIADHN O=C(CN[C@H]1c2ccccc2CC12CCOCC2)Nc1cccc(C(F)(F)F)c1 ZINC000554971763 942338533 /nfs/dbraw/zinc/33/85/33/942338533.db2.gz AHFITAQPVWHLEB-FQEVSTJZSA-N 0 3 404.432 4.328 20 0 HIADHN CCN1CC[C@@H](NC(=O)c2cccc3nc(C)[nH]c32)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000555011881 942355934 /nfs/dbraw/zinc/35/59/34/942355934.db2.gz UZWLPZRJICMVKD-QUCCMNQESA-N 0 3 400.885 4.229 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)NCc1cc(-c2ccccc2)on1 ZINC000555065045 942375054 /nfs/dbraw/zinc/37/50/54/942375054.db2.gz CQBBDCLCPXGCKL-IBGZPJMESA-N 0 3 404.514 4.148 20 0 HIADHN O=c1cc(CN[C@H](c2cccc(C(F)(F)F)c2)C2CCCCC2)[nH]c2ccnn21 ZINC000555069550 942375891 /nfs/dbraw/zinc/37/58/91/942375891.db2.gz HWEBCCSODUHSAU-FQEVSTJZSA-N 0 3 404.436 4.453 20 0 HIADHN CC(C)N1CC[C@H](NCc2cnn(C)c2C(F)(F)F)[C@H]1c1ccc(F)c(F)c1 ZINC000555128338 942393954 /nfs/dbraw/zinc/39/39/54/942393954.db2.gz GIVOYLVKGDPFOK-DLBZAZTESA-N 0 3 402.411 4.031 20 0 HIADHN COCCOc1ccc(CN[C@H]2CCCCc3cc(Br)ccc32)cn1 ZINC000555163497 942412326 /nfs/dbraw/zinc/41/23/26/942412326.db2.gz KSFUNQFHPSOPON-IBGZPJMESA-N 0 3 405.336 4.427 20 0 HIADHN CN(C)C[C@@H](NC(=O)N[C@H]1C[C@@H]1c1ccccc1OC(F)F)c1ccc(Cl)cc1 ZINC000555205663 942431871 /nfs/dbraw/zinc/43/18/71/942431871.db2.gz IQVSOBPRVOFEMV-FGTMMUONSA-N 0 3 423.891 4.399 20 0 HIADHN Fc1ccc(Cc2nnc(N3CC[C@]4(CCN(Cc5ccccc5)C4)C3)s2)cc1 ZINC000555206519 942431922 /nfs/dbraw/zinc/43/19/22/942431922.db2.gz HUHFHCJHQCTRFA-QHCPKHFHSA-N 0 3 408.546 4.370 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@@H](N[C@@H](CC)CS(=O)(=O)c2ccccc2)c2ccccc21 ZINC000555233666 942439689 /nfs/dbraw/zinc/43/96/89/942439689.db2.gz YWAHPWLHSUWOEW-MTNREXPMSA-N 0 3 415.555 4.010 20 0 HIADHN CC[C@H](N[C@H](C)c1ccc(Br)cn1)[C@@H](c1ccc(C)cc1)n1cncn1 ZINC000555378193 942503334 /nfs/dbraw/zinc/50/33/34/942503334.db2.gz VEFJHMLWDAGWBX-MOXGXCLJSA-N 0 3 414.351 4.463 20 0 HIADHN O=C(CCCNCc1c(Cl)cccc1N1CCOCC1)Nc1ccc(Cl)cc1 ZINC000555529918 942629325 /nfs/dbraw/zinc/62/93/25/942629325.db2.gz TYHBXIIKBOHYOG-UHFFFAOYSA-N 0 3 422.356 4.339 20 0 HIADHN CCOc1cc(CN[C@@H](C)c2cc[nH]c(=O)c2)cc(Br)c1OC(F)F ZINC000555608210 942667816 /nfs/dbraw/zinc/66/78/16/942667816.db2.gz ZDJDEVCKZRGFPR-JTQLQIEISA-N 0 3 417.250 4.401 20 0 HIADHN CCO[C@@H]1C[C@@H](NCc2cc(Br)cc(C(F)(F)F)c2)[C@@H]1n1cccn1 ZINC000555648457 942687018 /nfs/dbraw/zinc/68/70/18/942687018.db2.gz NDXNJDPOYRFWOI-OAGGEKHMSA-N 0 3 418.257 4.173 20 0 HIADHN Cc1cc(C(=O)N(C)C2CCN(CCc3ccccn3)CC2)c2nccc(C)c2c1 ZINC000555793736 942734563 /nfs/dbraw/zinc/73/45/63/942734563.db2.gz KBYRJSSNYXWANQ-UHFFFAOYSA-N 0 3 402.542 4.026 20 0 HIADHN COc1ccc2c(c1)CCN(Cc1ccc(OC)cc1OCc1cccnc1)CC2 ZINC000556040349 942793622 /nfs/dbraw/zinc/79/36/22/942793622.db2.gz YUUFTUFJXVQTQQ-UHFFFAOYSA-N 0 3 404.510 4.279 20 0 HIADHN COc1cc([C@@H](C)N[C@@H]2CCc3sc(Br)cc32)ccc1OCCO ZINC000556060477 942799246 /nfs/dbraw/zinc/79/92/46/942799246.db2.gz IFLCTTGMISIUFD-BXUZGUMPSA-N 0 3 412.349 4.228 20 0 HIADHN CCOc1ccccc1[C@@H](CC(C)C)N[C@@H]1CCCc2cc(S(N)(=O)=O)ccc21 ZINC000556078864 942802341 /nfs/dbraw/zinc/80/23/41/942802341.db2.gz ANLXTCVMANQFOD-FGZHOGPDSA-N 0 3 416.587 4.487 20 0 HIADHN COc1ccc([C@H](CNC(=O)Nc2ccc3nc(OC)ccc3c2)N2CCCC2)cc1 ZINC000556136531 942809674 /nfs/dbraw/zinc/80/96/74/942809674.db2.gz LHOUHCPPVPNLRV-QFIPXVFZSA-N 0 3 420.513 4.211 20 0 HIADHN C[C@H](NCCCN1CCN(c2cccc(C(F)(F)F)c2)CC1)c1ccncc1F ZINC000556232581 942823851 /nfs/dbraw/zinc/82/38/51/942823851.db2.gz ASQYJCOINNHHNX-INIZCTEOSA-N 0 3 410.459 4.102 20 0 HIADHN CCCOc1ccc(Oc2ncccc2CN[C@H]2CCC[C@H](S(C)(=O)=O)C2)cc1 ZINC000556236930 942824511 /nfs/dbraw/zinc/82/45/11/942824511.db2.gz XIRGEGKGPKUHQL-RXVVDRJESA-N 0 3 418.559 4.108 20 0 HIADHN C[C@@H](Cn1cc(Br)ccc1=O)N[C@H]1CCCOc2cc(Cl)ccc21 ZINC000556264879 942828589 /nfs/dbraw/zinc/82/85/89/942828589.db2.gz WURSSSYGTBRLJZ-LRDDRELGSA-N 0 3 411.727 4.156 20 0 HIADHN CN(C(=O)c1ccc(NCc2c(F)cccc2N2CCCC2)cc1)[C@H]1CCCN(C)C1 ZINC000556337378 942844614 /nfs/dbraw/zinc/84/46/14/942844614.db2.gz NTPKOHNGAHMEJB-NRFANRHFSA-N 0 3 424.564 4.204 20 0 HIADHN Ic1cccc(CN[C@H](c2ccc3c(c2)OCCO3)C2CC2)c1 ZINC000556387420 942854707 /nfs/dbraw/zinc/85/47/07/942854707.db2.gz MADWKHKEUSJZDJ-IBGZPJMESA-N 0 3 421.278 4.303 20 0 HIADHN Cc1cc(Cl)cc(C)c1CNCc1cccc(N2C(=O)N[C@](C)(C3CC3)C2=O)c1 ZINC000556410218 942858884 /nfs/dbraw/zinc/85/88/84/942858884.db2.gz IFCORTFLXYQQKR-HSZRJFAPSA-N 0 3 411.933 4.472 20 0 HIADHN O=C(COc1ccsc1Cl)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000556448220 942870082 /nfs/dbraw/zinc/87/00/82/942870082.db2.gz VLRWHXNSIGPIQD-MRXNPFEDSA-N 0 3 416.934 4.063 20 0 HIADHN C[C@H](NC[C@H]1CN(Cc2ccccc2)CCCO1)c1nc2ccccc2n1C(F)F ZINC000556532224 942892934 /nfs/dbraw/zinc/89/29/34/942892934.db2.gz OPCHLJBNVCBVGV-HKUYNNGSSA-N 0 3 414.500 4.373 20 0 HIADHN CC(C)[C@@H](NCc1ccc(S(=O)(=O)CCO)cc1)c1ccc(C(C)(C)C)cc1 ZINC000556579348 942905192 /nfs/dbraw/zinc/90/51/92/942905192.db2.gz XABPMQPDBLJEJH-JOCHJYFZSA-N 0 3 403.588 4.237 20 0 HIADHN Cc1ccccc1C[C@@H](NCc1csc(CNC(=O)c2ccccc2)n1)C1CC1 ZINC000556584930 942907087 /nfs/dbraw/zinc/90/70/87/942907087.db2.gz BAMLTBSGICRJFZ-JOCHJYFZSA-N 0 3 405.567 4.492 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)c2ccc(OC)c(OC3CCCC3)c2)cc1 ZINC000556588262 942908536 /nfs/dbraw/zinc/90/85/36/942908536.db2.gz ADHSGCQKFMFKHD-OAQYLSRUSA-N 0 3 412.530 4.058 20 0 HIADHN COC(=O)c1ccc(CN[C@H]2CCO[C@@H](c3ccccc3)C2)c(Br)c1 ZINC000556603366 942912226 /nfs/dbraw/zinc/91/22/26/942912226.db2.gz IWYXOIFCXKBKMZ-PKOBYXMFSA-N 0 3 404.304 4.246 20 0 HIADHN C[C@@H](NC[C@H](c1ccc(Cl)cc1)N1CCc2sccc2C1)c1ccc(=O)[nH]n1 ZINC000556857511 942940827 /nfs/dbraw/zinc/94/08/27/942940827.db2.gz BQGSMRXWSVNBLZ-AUUYWEPGSA-N 0 3 414.962 4.347 20 0 HIADHN CC[C@H](NCc1ccc(CS(C)(=O)=O)cc1)c1ccc(OC(F)(F)F)cc1 ZINC000556858388 942942174 /nfs/dbraw/zinc/94/21/74/942942174.db2.gz PWXPHXHXTCWDAT-SFHVURJKSA-N 0 3 401.450 4.371 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)C12CCC(C(=O)OC)(CC1)CC2)c1ccc(Cl)cc1 ZINC000556927078 942969300 /nfs/dbraw/zinc/96/93/00/942969300.db2.gz MIYZFGGHCQECAD-BVVFMGSASA-N 0 3 420.981 4.353 20 0 HIADHN CCCN(C)[C@H](CNC(=O)c1cc2cnn(CC)c2nc1C)c1ccc(Cl)cc1 ZINC000557059697 943008024 /nfs/dbraw/zinc/00/80/24/943008024.db2.gz BNVWXCMQHJPDGT-HXUWFJFHSA-N 0 3 413.953 4.226 20 0 HIADHN CCCN(C)[C@H](CNC(=O)c1ccc(OC)c(OC)c1OC)c1ccc(Cl)cc1 ZINC000557061265 943008616 /nfs/dbraw/zinc/00/86/16/943008616.db2.gz VYEYXHWFLWROSD-GOSISDBHSA-N 0 3 420.937 4.179 20 0 HIADHN CN(CCC(F)(F)F)[C@@H](CNC(=O)[C@@H]1CCCN1C1CC1)c1ccc(Cl)cc1 ZINC000557088151 943017817 /nfs/dbraw/zinc/01/78/17/943017817.db2.gz CVHAMXYYCWRCIV-ROUUACIJSA-N 0 3 417.903 4.008 20 0 HIADHN COc1ccc(CN2CC[C@H](N[C@@H](C)c3ccc4ccccc4c3)C2=O)c(OC)c1 ZINC000557447044 943131134 /nfs/dbraw/zinc/13/11/34/943131134.db2.gz XHUBJTYXRHUNBZ-SBUREZEXSA-N 0 3 404.510 4.309 20 0 HIADHN COC[C@@H](NC[C@H]1CCN(c2cc(OC)cc(OC)c2)C1)c1cccc(Cl)c1F ZINC000557451451 943135766 /nfs/dbraw/zinc/13/57/66/943135766.db2.gz JEAJCAAAMXMLKG-QVKFZJNVSA-N 0 3 422.928 4.300 20 0 HIADHN O=C(c1ccc(-c2cccs2)o1)N1CCC[C@H](c2n[nH]cc2CN2CCCC2)C1 ZINC000557646761 943247115 /nfs/dbraw/zinc/24/71/15/943247115.db2.gz LEEIGNZAYIRWGM-INIZCTEOSA-N 0 3 410.543 4.347 20 0 HIADHN COC(=O)c1ccc(CNC(=O)[C@H](C)N[C@H](c2ccc(Cl)cc2)C(C)C)cc1 ZINC000557655101 943249026 /nfs/dbraw/zinc/24/90/26/943249026.db2.gz XAXDWVMUYXLIRK-YWZLYKJASA-N 0 3 402.922 4.118 20 0 HIADHN O=C(NCc1ccc(-c2ccccc2)cc1F)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000557728031 943271702 /nfs/dbraw/zinc/27/17/02/943271702.db2.gz HHVCFKQEVIMRQM-HSZRJFAPSA-N 0 3 403.501 4.416 20 0 HIADHN C[C@@H](NC(=O)NCC(C)(C)N1CCc2ccccc2C1)c1nccn1-c1ccccc1 ZINC000557740303 943275879 /nfs/dbraw/zinc/27/58/79/943275879.db2.gz UVJGDKSRPNUZEH-LJQANCHMSA-N 0 3 417.557 4.069 20 0 HIADHN Cc1nc(N[C@H](C)c2ccc3n[nH]cc3c2)cc(N[C@@H](C)c2ccc3n[nH]cc3c2)n1 ZINC000557763052 943283470 /nfs/dbraw/zinc/28/34/70/943283470.db2.gz PATOOIKYIVZTMA-OKILXGFUSA-N 0 3 412.501 4.884 20 0 HIADHN Cc1onc(-c2c(F)cccc2Cl)c1C(=O)N1CCN([C@@H]2C[C@H]2C)C[C@H](C)C1 ZINC000558026660 943360068 /nfs/dbraw/zinc/36/00/68/943360068.db2.gz XRNKDNOYJCPDDH-OGHNNQOOSA-N 0 3 405.901 4.245 20 0 HIADHN C[C@H]1C[C@H]1N1CCN(C(=O)c2cc(Cl)cc(F)c2Br)C[C@@H](C)C1 ZINC000558027623 943360416 /nfs/dbraw/zinc/36/04/16/943360416.db2.gz QZHNGBNQHYNTFD-ZIBATOQPSA-N 0 3 403.723 4.044 20 0 HIADHN CCCN(C)[C@H](CNC(=O)N(C)Cc1nccn1C(F)F)c1ccc(Cl)cc1 ZINC000558110210 943382817 /nfs/dbraw/zinc/38/28/17/943382817.db2.gz ZSNPOQVLCGKQQP-MRXNPFEDSA-N 0 3 413.900 4.156 20 0 HIADHN CN(C)c1ccccc1CN(C)C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000558189559 943423152 /nfs/dbraw/zinc/42/31/52/943423152.db2.gz IQIMQMOVOYRHIK-UHFFFAOYSA-N 0 3 412.603 4.008 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1cccnc1C(F)(F)F)c1cccc(OC)c1 ZINC000558204957 943431417 /nfs/dbraw/zinc/43/14/17/943431417.db2.gz DZRVKQNBFROWIE-KRWDZBQOSA-N 0 3 410.440 4.314 20 0 HIADHN CCSc1ccc([C@@H](C)N[C@H]2CCN(Cc3ccc(OC)cc3OC)C2=O)cc1 ZINC000558231874 943448294 /nfs/dbraw/zinc/44/82/94/943448294.db2.gz OTRTWLNCTHCTPS-IERDGZPVSA-N 0 3 414.571 4.268 20 0 HIADHN C[C@H](CC(=O)Nc1ccc(NC(=O)C2CC2)cc1)N[C@H]1c2ccc(F)cc2O[C@H]1C ZINC000558256051 943462994 /nfs/dbraw/zinc/46/29/94/943462994.db2.gz HGNFNSWWJGTDGQ-ALLJEULLSA-N 0 3 411.477 4.003 20 0 HIADHN CCC(=O)Nc1ccc(NC(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)cc1 ZINC000558307630 943496346 /nfs/dbraw/zinc/49/63/46/943496346.db2.gz LTVQDXWDXYKSEW-OAQYLSRUSA-N 0 3 412.534 4.247 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)NC[C@@H](N[C@@H](C)CC)c2ccco2)cc1 ZINC000558332718 943510945 /nfs/dbraw/zinc/51/09/45/943510945.db2.gz VCJQFOODMZCJBK-TXPKVOOTSA-N 0 3 400.523 4.059 20 0 HIADHN COC(=O)COc1ccccc1[C@H](C)N[C@H]1CCc2c1cccc2Br ZINC000558342720 943518034 /nfs/dbraw/zinc/51/80/34/943518034.db2.gz QULHEXXUXCEWQQ-UGSOOPFHSA-N 0 3 404.304 4.339 20 0 HIADHN COc1ccc(NC(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)c(Br)c1 ZINC000558352310 943521733 /nfs/dbraw/zinc/52/17/33/943521733.db2.gz FIZDYFFJCODOTK-ACJLOTCBSA-N 0 3 406.324 4.271 20 0 HIADHN CCOC(=O)c1ccn(-c2cccc(CNCc3cn(C)nc3C3CCCCC3)c2)n1 ZINC000558419383 943554431 /nfs/dbraw/zinc/55/44/31/943554431.db2.gz VCHPDMGQWIGAIL-UHFFFAOYSA-N 0 3 421.545 4.120 20 0 HIADHN C[C@H](N[C@H]1CCN(C)[C@H]1c1ccc(Cl)cc1)C(=O)Nc1cccc2ncccc21 ZINC000558467560 943567722 /nfs/dbraw/zinc/56/77/22/943567722.db2.gz SGZKOYHQXYJKSR-RXYZOABWSA-N 0 3 408.933 4.250 20 0 HIADHN O=C1NC2(CCCC2)C(=O)N1c1cccc(CN[C@H](c2ccc(F)cc2)C2CC2)c1 ZINC000558507771 943579380 /nfs/dbraw/zinc/57/93/80/943579380.db2.gz PSDZDQUZSJYHNS-NRFANRHFSA-N 0 3 407.489 4.436 20 0 HIADHN C[C@@H]1CC[C@H](CCC(=O)N(Cc2ccccc2Br)C2CCN(C)CC2)O1 ZINC000558610456 943616788 /nfs/dbraw/zinc/61/67/88/943616788.db2.gz VFWDWYRIDRDYFG-VQIMIIECSA-N 0 3 423.395 4.220 20 0 HIADHN CC(C)c1cc(C(=O)N(Cc2ccccc2Br)C2CCN(C)CC2)on1 ZINC000558610597 943617577 /nfs/dbraw/zinc/61/75/77/943617577.db2.gz WXPZCPSBSUWLKI-UHFFFAOYSA-N 0 3 420.351 4.297 20 0 HIADHN C[C@H](N[C@@H]1CCCC[C@H]1OC(F)F)C(=O)N(c1nccs1)C1CCCCC1 ZINC000558619058 943619398 /nfs/dbraw/zinc/61/93/98/943619398.db2.gz KMIVXFSZGNRPFG-NUEKZKHPSA-N 0 3 401.523 4.337 20 0 HIADHN COc1cccc(Cl)c1CN1C[C@H]2CCC[C@@]2(c2nc(-c3cccnc3)no2)C1 ZINC000558737761 943636028 /nfs/dbraw/zinc/63/60/28/943636028.db2.gz HAWOCSMJPPGPSP-OPAMFIHVSA-N 0 3 410.905 4.347 20 0 HIADHN CCc1nc2cc(CNCc3ccc(Cl)cc3-n3cncn3)ccc2n1C1CC1 ZINC000558778296 943659496 /nfs/dbraw/zinc/65/94/96/943659496.db2.gz ATYNSFZZPSLMHA-UHFFFAOYSA-N 0 3 406.921 4.458 20 0 HIADHN CC(C)N1CC[C@@H](NCc2cc(-c3cnn(C)c3)no2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000558826855 943681274 /nfs/dbraw/zinc/68/12/74/943681274.db2.gz MQHSOVCXBWGARU-TZIWHRDSSA-N 0 3 417.916 4.181 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N(C)C[C@H]2OCCc3ccccc32)N2CCCC2)cc1 ZINC000558826121 943681309 /nfs/dbraw/zinc/68/13/09/943681309.db2.gz SCBGIGKWKJWKCA-BJKOFHAPSA-N 0 3 407.558 4.087 20 0 HIADHN CC(C)N1CC[C@H](NCc2cc(-c3cnn(C)c3)no2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000558826853 943681485 /nfs/dbraw/zinc/68/14/85/943681485.db2.gz MQHSOVCXBWGARU-FPOVZHCZSA-N 0 3 417.916 4.181 20 0 HIADHN COc1cc(NC(=O)CN[C@@H](c2cccc(C(F)(F)F)c2)C2CC2)cc(OC)c1 ZINC000558863081 943706506 /nfs/dbraw/zinc/70/65/06/943706506.db2.gz IUUQZMYRZGTHKK-HXUWFJFHSA-N 0 3 408.420 4.402 20 0 HIADHN C[C@H](NC(=O)N[C@@H](CN(C)C)c1ccc(Cl)cc1)c1ccc(-n2cccn2)cc1 ZINC000558887816 943720966 /nfs/dbraw/zinc/72/09/66/943720966.db2.gz JVGJLLGRYHYYMO-KKSFZXQISA-N 0 3 411.937 4.189 20 0 HIADHN CCN1CC[C@H](N[C@H](C)C(=O)NCCc2cccs2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000558898742 943732682 /nfs/dbraw/zinc/73/26/82/943732682.db2.gz QMBHPFCHQYDRDF-UAOJZALGSA-N 0 3 423.985 4.013 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@H](NCc2ccc(C)cc2O[C@@H]2CCOC2)c2ccccc21 ZINC000558976315 943780850 /nfs/dbraw/zinc/78/08/50/943780850.db2.gz NNAGWDAYDOWAMI-PTUXOGIPSA-N 0 3 409.526 4.434 20 0 HIADHN CCOCCCn1c(-c2ccoc2)nnc1N1CCN(Cc2ccccc2)[C@@H](CC)C1 ZINC000559058027 943818351 /nfs/dbraw/zinc/81/83/51/943818351.db2.gz CGHOAICHKCPWHT-QFIPXVFZSA-N 0 3 423.561 4.066 20 0 HIADHN CCOCCCn1c(-c2cc3ccccc3o2)nnc1N1CCN(C2CCCC2)CC1 ZINC000559063038 943820341 /nfs/dbraw/zinc/82/03/41/943820341.db2.gz JXQVTXYYOGIXBV-UHFFFAOYSA-N 0 3 423.561 4.183 20 0 HIADHN O=C(Nc1ccccc1)Nc1cccc2c1CCN(C[C@@H](O)Cc1ccc(F)cc1)C2 ZINC000559095322 943836817 /nfs/dbraw/zinc/83/68/17/943836817.db2.gz YDMRABKNSUCQCV-QFIPXVFZSA-N 0 3 419.500 4.431 20 0 HIADHN C[C@@H](Oc1ccccc1NC(=O)[C@H]1CCCN(Cc2cccnc2)C1)C(F)(F)F ZINC000559099081 943838341 /nfs/dbraw/zinc/83/83/41/943838341.db2.gz BZTLTRWPRLADLM-WBVHZDCISA-N 0 3 407.436 4.262 20 0 HIADHN C[C@H](c1ccc(F)cc1)N1CC[C@H](N[C@@H](C)c2ccc(NC(=O)NC3CC3)cc2)C1=O ZINC000559148529 943854015 /nfs/dbraw/zinc/85/40/15/943854015.db2.gz ZYJHIMPMKBFJTI-DMPWYTOCSA-N 0 3 424.520 4.122 20 0 HIADHN O=C(NCCN1CCCC1)c1ccc(NCc2ccc(F)cc2Br)cc1 ZINC000559230199 943881245 /nfs/dbraw/zinc/88/12/45/943881245.db2.gz ZKUWDLORAIINPH-UHFFFAOYSA-N 0 3 420.326 4.026 20 0 HIADHN COCCc1ccc(OC[C@H](O)CN2CC[C@H](C)C[C@@H]2c2ccccc2OC)cc1 ZINC000559247662 943885732 /nfs/dbraw/zinc/88/57/32/943885732.db2.gz DMZMXGNEFYATDY-XZDHIHRUSA-N 0 3 413.558 4.097 20 0 HIADHN CC1CCN(S(=O)(=O)Cc2ccccc2CN[C@H]2CCCc3ccccc32)CC1 ZINC000559304454 943893735 /nfs/dbraw/zinc/89/37/35/943893735.db2.gz HPHMAPXHMDFIDO-DEOSSOPVSA-N 0 3 412.599 4.416 20 0 HIADHN CCO[C@@H]1C[C@@H](NCc2cccc(NC(=O)c3ccccc3Cl)c2)[C@H]1n1cccn1 ZINC000559364276 943912468 /nfs/dbraw/zinc/91/24/68/943912468.db2.gz KZPQZVHCXADSLQ-YPAWHYETSA-N 0 3 424.932 4.297 20 0 HIADHN Cc1ccc(Br)c(C)c1C(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000559449285 943956851 /nfs/dbraw/zinc/95/68/51/943956851.db2.gz QGMHMKZPLHKBGG-IYBDPMFKSA-N 0 3 423.395 4.027 20 0 HIADHN CN(C)Cc1ccccc1NC(=O)c1cc(CNC(=O)C(C)(C)C)ccc1Cl ZINC000559517924 943991761 /nfs/dbraw/zinc/99/17/61/943991761.db2.gz PCUQWVUOGDKPJU-UHFFFAOYSA-N 0 3 401.938 4.316 20 0 HIADHN COc1cc(C(=O)N(Cc2ccccc2)C2CCN(C)CC2)sc1Br ZINC000559741004 944042989 /nfs/dbraw/zinc/04/29/89/944042989.db2.gz XMUMSPZTZLZPSB-UHFFFAOYSA-N 0 3 423.376 4.256 20 0 HIADHN COC(=O)CCC[C@@H]1CCC[C@@H](N[C@@H](c2nc(-c3cccnc3)no2)C(C)C)C1 ZINC000559752331 944043346 /nfs/dbraw/zinc/04/33/46/944043346.db2.gz RLQGFTCQOFVREO-ILZDJORESA-N 0 3 400.523 4.320 20 0 HIADHN CN(Cc1cccc(Br)c1)C[C@@H](O)CO[C@@H]1CCCc2ccccc21 ZINC000559958718 944099769 /nfs/dbraw/zinc/09/97/69/944099769.db2.gz IUJJAFHJCLFURI-TZIWHRDSSA-N 0 3 404.348 4.336 20 0 HIADHN O=C(Nc1ccc(Oc2cccnc2)nc1)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000559966660 944103845 /nfs/dbraw/zinc/10/38/45/944103845.db2.gz QIYGPOYDKGKCIE-FQEVSTJZSA-N 0 3 403.486 4.055 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)Nc3ccc(Oc4cccnc4)nc3)cc2)CC1 ZINC000559978086 944108128 /nfs/dbraw/zinc/10/81/28/944108128.db2.gz RJYSKRSBWBBEPN-UHFFFAOYSA-N 0 3 417.513 4.052 20 0 HIADHN C[C@@]1(C2CC2)NC(=O)N(c2cccc(CNCc3cc4ccccc4s3)c2)C1=O ZINC000560078682 944150983 /nfs/dbraw/zinc/15/09/83/944150983.db2.gz YHWQNTCHHCPTMB-QHCPKHFHSA-N 0 3 405.523 4.416 20 0 HIADHN COc1ccc(C[C@H](C)CN(C)CC(=O)N[C@@H](c2nccs2)c2ccccc2)cc1 ZINC000560112602 944163886 /nfs/dbraw/zinc/16/38/86/944163886.db2.gz QMEGRMWYPSYCEY-FDDCHVKYSA-N 0 3 423.582 4.168 20 0 HIADHN O=C(CNC[C@H]1CCCO1)Nc1ccc(Sc2ccc(Br)cc2)cc1 ZINC000560137367 944175014 /nfs/dbraw/zinc/17/50/14/944175014.db2.gz ITZLWXLPZUMZHB-MRXNPFEDSA-N 0 3 421.360 4.307 20 0 HIADHN COc1cccc2c1CCC[C@@H]2NCc1cccc(N2C(=O)N[C@@](C)(C3CC3)C2=O)c1 ZINC000560265194 944211133 /nfs/dbraw/zinc/21/11/33/944211133.db2.gz GHCJPFWNGXNTGW-OFVILXPXSA-N 0 3 419.525 4.087 20 0 HIADHN C[C@@H](N[C@H](c1cncc(Br)c1)C1CC1)c1cccc(NS(C)(=O)=O)c1 ZINC000560267070 944213430 /nfs/dbraw/zinc/21/34/30/944213430.db2.gz UVHPPCGGLILITP-XIKOKIGWSA-N 0 3 424.364 4.018 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)CN[C@@H]1CC[C@H](c2ccccc2)C[C@@H]1OC ZINC000560540850 944247353 /nfs/dbraw/zinc/24/73/53/944247353.db2.gz ZIGBEJRJDBNCIA-CDXJDZJCSA-N 0 3 402.922 4.228 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)CN[C@@H]1CC[C@H](c2ccccc2)C[C@H]1OC ZINC000560540852 944248245 /nfs/dbraw/zinc/24/82/45/944248245.db2.gz ZIGBEJRJDBNCIA-YRISNDGFSA-N 0 3 402.922 4.228 20 0 HIADHN CCc1nnc(NC(=O)[C@H](C)[C@H](C)N[C@H](C)c2sccc2Br)s1 ZINC000560557509 944253006 /nfs/dbraw/zinc/25/30/06/944253006.db2.gz KLGVQSCEJCBLQH-KXUCPTDWSA-N 0 3 417.398 4.238 20 0 HIADHN CNS(=O)(=O)c1cccc([C@@H](C)NC[C@@H](OCC2CC2)c2ccc(Cl)cc2)c1 ZINC000560570531 944257858 /nfs/dbraw/zinc/25/78/58/944257858.db2.gz RIKFMWWPVHZAGA-QVKFZJNVSA-N 0 3 422.978 4.067 20 0 HIADHN CCc1nnc(NC(=O)[C@H](C)[C@H](C)N[C@@H](c2ccccc2)c2ccc(OC)cc2)s1 ZINC000560571948 944258222 /nfs/dbraw/zinc/25/82/22/944258222.db2.gz OUEOFCSNMFBXLY-XFQAVAEZSA-N 0 3 424.570 4.451 20 0 HIADHN CCc1nnc(NC(=O)[C@H](C)[C@H](C)N[C@H](c2ccccc2)c2ccc(OC)cc2)s1 ZINC000560571946 944258268 /nfs/dbraw/zinc/25/82/68/944258268.db2.gz OUEOFCSNMFBXLY-VWKPWSFCSA-N 0 3 424.570 4.451 20 0 HIADHN COc1ccc(-c2nc(C)c([C@@H](C)NCC3(S(C)(=O)=O)CCCC3)s2)cc1 ZINC000560580703 944262544 /nfs/dbraw/zinc/26/25/44/944262544.db2.gz HZDWFIVXAYNCIL-CQSZACIVSA-N 0 3 408.589 4.135 20 0 HIADHN O=C([C@H]1CN(Cc2ccccc2)CCC1(F)F)N1CCc2c3ccccc3[nH]c2C1 ZINC000560611868 944274737 /nfs/dbraw/zinc/27/47/37/944274737.db2.gz MPGSOKCOJSRDDU-HXUWFJFHSA-N 0 3 409.480 4.210 20 0 HIADHN CCCN(C)[C@H](CNC(=O)[C@@H]1CC(=O)Nc2cc(F)ccc21)c1ccc(Cl)cc1 ZINC000560710828 944305059 /nfs/dbraw/zinc/30/50/59/944305059.db2.gz WYLJLTAMDUVYSR-UYAOXDASSA-N 0 3 417.912 4.104 20 0 HIADHN O[C@H](CNCc1cc(F)cc(Br)c1)COc1cccc(C(F)(F)F)c1 ZINC000560857949 944360363 /nfs/dbraw/zinc/36/03/63/944360363.db2.gz NHCPIFKPMICYGP-OAHLLOKOSA-N 0 3 422.216 4.137 20 0 HIADHN Cc1ccc([C@H](CNC(=O)C[C@H](c2ncc[nH]2)c2ccccc2)N2CCCC2)cc1 ZINC000561206890 944514603 /nfs/dbraw/zinc/51/46/03/944514603.db2.gz YMTYIHKHFYXQOU-GOTSBHOMSA-N 0 3 402.542 4.193 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)CCc1ccc(Br)cc1OC)c1ccco1 ZINC000561609988 944706276 /nfs/dbraw/zinc/70/62/76/944706276.db2.gz GNQLIZBRNCRUDY-RHSMWYFYSA-N 0 3 423.351 4.229 20 0 HIADHN CC(=O)Nc1ccc(Cl)c(C(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)c1 ZINC000561651765 944728793 /nfs/dbraw/zinc/72/87/93/944728793.db2.gz SXFQJBOILHPXCA-NRFANRHFSA-N 0 3 417.937 4.118 20 0 HIADHN Cc1nn(Cc2ccccc2)c2sc(C(=O)N3CC[C@@H](N4CCCC4)[C@H]3C)cc12 ZINC000561749582 944778530 /nfs/dbraw/zinc/77/85/30/944778530.db2.gz VDOSQXBLUULQNM-YLJYHZDGSA-N 0 3 408.571 4.153 20 0 HIADHN C[C@H]1[C@@H](N2CCCC2)CCN1C(=O)c1cc2sc(Nc3ccccc3)nc2s1 ZINC000561753390 944779629 /nfs/dbraw/zinc/77/96/29/944779629.db2.gz KBUFGKLIMFBUMZ-HOCLYGCPSA-N 0 3 412.584 4.800 20 0 HIADHN Cc1nc(-c2cccc(C(F)(F)F)c2)[nH]c1C(=O)N1CCN([C@@H]2C[C@@H]2C)C[C@H](C)C1 ZINC000561761328 944783490 /nfs/dbraw/zinc/78/34/90/944783490.db2.gz FVGCWTPRZKUPMU-SUNYJGFJSA-N 0 3 420.479 4.206 20 0 HIADHN C[C@@H]1C[C@H]1N1CCN(C(=O)c2occc2CN2c3ccccc3C[C@@H]2C)C[C@@H](C)C1 ZINC000561765950 944786629 /nfs/dbraw/zinc/78/66/29/944786629.db2.gz XUZOONLESOIWOG-QPXQOZNCSA-N 0 3 407.558 4.033 20 0 HIADHN CC[C@@H](N[C@H]1CCc2c1ccc(OC)c2F)c1ccccc1OCC(=O)N(C)C ZINC000561772128 944789496 /nfs/dbraw/zinc/78/94/96/944789496.db2.gz LQSINLAHWFDUED-MOPGFXCFSA-N 0 3 400.494 4.030 20 0 HIADHN COc1cc2c(cc1OC)CN(C(=O)CN[C@H](C)c1ccc(F)c3ccccc31)CC2 ZINC000561787133 944796436 /nfs/dbraw/zinc/79/64/36/944796436.db2.gz JMOUNRYXGKRBPU-MRXNPFEDSA-N 0 3 422.500 4.232 20 0 HIADHN COCCOc1c(Cl)cccc1NC(=O)N[C@H](C)CN(C)Cc1ccccc1 ZINC000561798509 944800978 /nfs/dbraw/zinc/80/09/78/944800978.db2.gz YZZRWUBNRXNXFS-MRXNPFEDSA-N 0 3 405.926 4.007 20 0 HIADHN COC(=O)c1cccc(CNCc2ccc(OCc3cn4cccc(C)c4n3)cc2)c1 ZINC000561970805 944880912 /nfs/dbraw/zinc/88/09/12/944880912.db2.gz SRGZUUBOLPVXQU-UHFFFAOYSA-N 0 3 415.493 4.298 20 0 HIADHN COC[C@@H](NCC1(c2ccc3c(c2)OCO3)CCOCC1)c1cccc(Cl)c1F ZINC000562013839 944894510 /nfs/dbraw/zinc/89/45/10/944894510.db2.gz YWIMBNQMGXVROU-GOSISDBHSA-N 0 3 421.896 4.233 20 0 HIADHN CC[C@@H]1CN(C(=O)Nc2ccccc2CN(C)C2CCCCC2)C[C@H](C)[S@@]1=O ZINC000562018644 944897280 /nfs/dbraw/zinc/89/72/80/944897280.db2.gz CCSDXSJKFVEMNR-MNUVWUGUSA-N 0 3 405.608 4.214 20 0 HIADHN Cc1ccc2nc(NC(=O)CN[C@H]3c4ccccc4CC34CCOCC4)sc2c1 ZINC000562070786 944921826 /nfs/dbraw/zinc/92/18/26/944921826.db2.gz VHUQCBWLBDFSGZ-NRFANRHFSA-N 0 3 407.539 4.227 20 0 HIADHN C[C@@H](N[C@@H]1CCCN(c2ccn(C)n2)C1=O)c1ccc(-c2c(F)cccc2F)cc1 ZINC000562089243 944932485 /nfs/dbraw/zinc/93/24/85/944932485.db2.gz RWICRZPATKYKNF-FOIQADDNSA-N 0 3 410.468 4.212 20 0 HIADHN COC[C@]1(CN[C@@H](C)c2cnn(-c3ccc(F)cc3)c2C)OCCc2ccccc21 ZINC000562091048 944934075 /nfs/dbraw/zinc/93/40/75/944934075.db2.gz LVFFNJPVDSLLBF-XDHUDOTRSA-N 0 3 409.505 4.085 20 0 HIADHN COC[C@@]1(CN[C@H](C)c2cnn(-c3ccc(F)cc3)c2C)OCCc2ccccc21 ZINC000562091046 944934153 /nfs/dbraw/zinc/93/41/53/944934153.db2.gz LVFFNJPVDSLLBF-MZNJEOGPSA-N 0 3 409.505 4.085 20 0 HIADHN C[C@@H]1C[C@@H]1[C@@H](N[C@@H]1CCCc2ccc(S(N)(=O)=O)cc21)c1ccc(Cl)cc1 ZINC000562089728 944934218 /nfs/dbraw/zinc/93/42/18/944934218.db2.gz FFBZIMFBPICROZ-WTXAKBKRSA-N 0 3 404.963 4.352 20 0 HIADHN C[C@@H](NC(=O)Nc1ccc(CCC(=O)N2CCCC2)cc1)[C@@H](c1ccccc1)N(C)C ZINC000562152939 944981980 /nfs/dbraw/zinc/98/19/80/944981980.db2.gz AQNUPUVCMXMAKT-DVECYGJZSA-N 0 3 422.573 4.055 20 0 HIADHN CN(C)C[C@H](NC(=O)Nc1cccc(CC(=O)OC(C)(C)C)c1)c1ccc(F)cc1 ZINC000562223882 945030336 /nfs/dbraw/zinc/03/03/36/945030336.db2.gz FFSQSRLNWDDBNV-FQEVSTJZSA-N 0 3 415.509 4.134 20 0 HIADHN COCCCN(C(=O)c1cc2c(s1)CC[C@@H](C(C)(C)C)C2)C1CCN(C)CC1 ZINC000562252796 945045131 /nfs/dbraw/zinc/04/51/31/945045131.db2.gz OCFBXKFCXDBEAJ-GOSISDBHSA-N 0 3 406.636 4.472 20 0 HIADHN CC[C@@H](C)n1ncc(C(=O)NC[C@@H](c2ccc(SC)cc2)N(C)C)c1C1CC1 ZINC000564092501 945375784 /nfs/dbraw/zinc/37/57/84/945375784.db2.gz FXKMUDFZELMIJX-QRWLVFNGSA-N 0 3 400.592 4.486 20 0 HIADHN CSc1ccc([C@@H](CNC(=O)Cc2coc(-c3ccc(F)cc3)n2)N(C)C)cc1 ZINC000564093915 945376590 /nfs/dbraw/zinc/37/65/90/945376590.db2.gz LBRATCJVIYLCNZ-HXUWFJFHSA-N 0 3 413.518 4.164 20 0 HIADHN CSc1ccc([C@H](CNC(=O)Cc2coc(-c3ccc(F)cc3)n2)N(C)C)cc1 ZINC000564093913 945377011 /nfs/dbraw/zinc/37/70/11/945377011.db2.gz LBRATCJVIYLCNZ-FQEVSTJZSA-N 0 3 413.518 4.164 20 0 HIADHN CSc1ccc([C@@H](CNC(=O)c2cccc(Br)c2F)N(C)C)cc1 ZINC000564095841 945377114 /nfs/dbraw/zinc/37/71/14/945377114.db2.gz ZOQUQZUJSUXPSQ-MRXNPFEDSA-N 0 3 411.340 4.343 20 0 HIADHN COc1c(C)cnc(CN2CCC(N(C)Cc3ncc(CSC)s3)CC2)c1C ZINC000564110015 945382469 /nfs/dbraw/zinc/38/24/69/945382469.db2.gz ZZAYGRDOUVSUBO-UHFFFAOYSA-N 0 3 420.648 4.123 20 0 HIADHN C[C@H]1OCC[C@@]1(O)CN(Cc1cnc(-c2ccsc2)s1)Cc1ccccc1 ZINC000564324848 945516084 /nfs/dbraw/zinc/51/60/84/945516084.db2.gz INGPXGGCCPZJIN-IIBYNOLFSA-N 0 3 400.569 4.414 20 0 HIADHN Cc1cccc2c1[C@@H](C)C[C@@H]2Cc1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1 ZINC000564372136 945538613 /nfs/dbraw/zinc/53/86/13/945538613.db2.gz UBSZWLKPWCGZLM-AZUAARDMSA-N 0 3 417.557 4.415 20 0 HIADHN Cc1cc(CNCc2ccc(-n3ccc(C(F)(F)F)n3)cc2)cc(N2CCCC2)n1 ZINC000564420236 945571308 /nfs/dbraw/zinc/57/13/08/945571308.db2.gz WRFZHIQCAZQPKL-UHFFFAOYSA-N 0 3 415.463 4.485 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@H]2NC[C@@]2(C)OCCc3sccc32)cc1 ZINC000564438469 945587975 /nfs/dbraw/zinc/58/79/75/945587975.db2.gz JUKBDSWNKGWJPV-CEMLEFRQSA-N 0 3 419.612 4.219 20 0 HIADHN CC(C)Cn1c(SCCCN2CCN(C(C)C)CC2)nnc1-c1ccccc1F ZINC000564475382 945607941 /nfs/dbraw/zinc/60/79/41/945607941.db2.gz VCLURSIKTFXXAU-UHFFFAOYSA-N 0 3 419.614 4.248 20 0 HIADHN COCCCN(C(=O)c1ccc(C(C)(C)C(F)(F)F)cc1)C1CCN(C)CC1 ZINC000564597886 945695509 /nfs/dbraw/zinc/69/55/09/945695509.db2.gz PYICOGLBYLADHI-UHFFFAOYSA-N 0 3 400.485 4.099 20 0 HIADHN COCCCN(C(=O)CCCc1ccc(Cl)c(Cl)c1)C1CCN(C)CC1 ZINC000564598606 945695620 /nfs/dbraw/zinc/69/56/20/945695620.db2.gz UKIJNJBXSAARAC-UHFFFAOYSA-N 0 3 401.378 4.275 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)[C@H]1CCn2c(cnc2C2CCCCC2)C1)c1ccco1 ZINC000564678467 945725589 /nfs/dbraw/zinc/72/55/89/945725589.db2.gz BMEZKXZRNIZRGN-HFSMHLIXSA-N 0 3 412.578 4.332 20 0 HIADHN C[C@@H](NC[C@H](CO)Cc1c(F)cccc1Cl)c1ccc(Br)cn1 ZINC000564766878 945754380 /nfs/dbraw/zinc/75/43/80/945754380.db2.gz RIWPGPUGZYNZKP-VXGBXAGGSA-N 0 3 401.707 4.138 20 0 HIADHN CN(C)C[C@H](NC(=O)COC(c1ccccc1)c1ccccc1)c1ccc(F)cc1 ZINC000565267420 945797707 /nfs/dbraw/zinc/79/77/07/945797707.db2.gz RSOOPLKBLGOOOL-QHCPKHFHSA-N 0 3 406.501 4.351 20 0 HIADHN COC[C@H](NC(=O)NC[C@@H](c1cccs1)N1CCCC1)c1cccc(Cl)c1 ZINC000565278621 945803632 /nfs/dbraw/zinc/80/36/32/945803632.db2.gz WRCCOBXJRNCSFR-ROUUACIJSA-N 0 3 407.967 4.225 20 0 HIADHN CSc1ccc([C@@H](CNC(=O)Cc2csc(-c3ccoc3)n2)N(C)C)cc1 ZINC000565325266 945810970 /nfs/dbraw/zinc/81/09/70/945810970.db2.gz KDHOMWGJGXFLEF-GOSISDBHSA-N 0 3 401.557 4.087 20 0 HIADHN CCOC(=O)c1ccn(-c2cccc(CNCc3cc(Br)cs3)c2)n1 ZINC000565389781 945823000 /nfs/dbraw/zinc/82/30/00/945823000.db2.gz GKCCUPMIPIGFLU-UHFFFAOYSA-N 0 3 420.332 4.163 20 0 HIADHN CN(C)C[C@H](NC(=O)[C@H]1C[C@H]1c1ccccc1OC(F)(F)F)c1ccc(F)cc1 ZINC000565441238 945830128 /nfs/dbraw/zinc/83/01/28/945830128.db2.gz FPQLWFZCLFDYGO-BZSNNMDCSA-N 0 3 410.411 4.247 20 0 HIADHN COC(=O)c1cc(CN[C@H](CC2CC2)c2cc(F)cc(Br)c2)cn1C ZINC000565565611 945850043 /nfs/dbraw/zinc/85/00/43/945850043.db2.gz GAAWWNUDXMLOIO-QGZVFWFLSA-N 0 3 409.299 4.344 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)Nc1cccc2c1OCO2 ZINC000565738123 945875723 /nfs/dbraw/zinc/87/57/23/945875723.db2.gz SFVCQQSUHQGLKP-UHFFFAOYSA-N 0 3 409.408 4.030 20 0 HIADHN Cc1nc(C(C)(C)C)sc1-c1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1 ZINC000565747927 945879702 /nfs/dbraw/zinc/87/97/02/945879702.db2.gz VGLKKUAWAZUDBB-UHFFFAOYSA-N 0 3 412.563 4.003 20 0 HIADHN C[C@H](NCc1ccnc(OC(F)F)c1)c1ccc(I)cc1 ZINC000565788973 945882657 /nfs/dbraw/zinc/88/26/57/945882657.db2.gz GQINUXVVOFVFRD-JTQLQIEISA-N 0 3 404.198 4.138 20 0 HIADHN CCN1CCCC[C@@H]1CNC(=O)C(C)(C)c1csc(-c2cc(F)ccc2F)n1 ZINC000565896343 945908591 /nfs/dbraw/zinc/90/85/91/945908591.db2.gz FNNDKYWFLCQIAG-OAHLLOKOSA-N 0 3 407.530 4.357 20 0 HIADHN CCN1CC[C@H](N[C@H](C)C(=O)Nc2ccccc2C)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000566347718 946007249 /nfs/dbraw/zinc/00/72/49/946007249.db2.gz WGWIPQYQMUNFMY-RFVSGWPVSA-N 0 3 405.464 4.164 20 0 HIADHN CCSc1cccc(F)c1NC(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000566532102 946035206 /nfs/dbraw/zinc/03/52/06/946035206.db2.gz LDACCISOOGLNPN-HZPDHXFCSA-N 0 3 409.571 4.291 20 0 HIADHN C[C@H]1[C@H](NC(=O)C2(c3cccc(Cl)c3)CCOCC2)CCN1Cc1ccccc1 ZINC000566580740 946044276 /nfs/dbraw/zinc/04/42/76/946044276.db2.gz CCZYGIMGAZVSQF-PGRDOPGGSA-N 0 3 412.961 4.167 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)c1ccc(C)c(NC(=O)c2ccco2)c1)c1ccco1 ZINC000566758015 946088240 /nfs/dbraw/zinc/08/82/40/946088240.db2.gz YXHDBIBBKIEQLK-APWZRJJASA-N 0 3 409.486 4.293 20 0 HIADHN CCOc1cccc(-c2cccc(NC(=O)[C@H]3CCCN(Cc4cccnc4)C3)n2)c1 ZINC000566832331 946124764 /nfs/dbraw/zinc/12/47/64/946124764.db2.gz BYCBINMPOWLMSG-NRFANRHFSA-N 0 3 416.525 4.393 20 0 HIADHN CC(=O)N1C[C@@H]2CCC[C@@H](NCc3csc(COc4ccc(Cl)cc4)n3)[C@@H]2C1 ZINC000566877792 946145750 /nfs/dbraw/zinc/14/57/50/946145750.db2.gz BGHIBDPZMWQUDR-CWFSZBLJSA-N 0 3 419.978 4.112 20 0 HIADHN CSc1ccc([C@H](CNC(=O)Cc2c(C)nn(-c3ccccc3)c2C)N(C)C)cc1 ZINC000566937277 946176463 /nfs/dbraw/zinc/17/64/63/946176463.db2.gz SQONPTXKXHIHNC-QHCPKHFHSA-N 0 3 422.598 4.173 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(Oc2cccnc2)cc1)C(=O)N1CCc2ccccc2C1 ZINC000567021479 946218966 /nfs/dbraw/zinc/21/89/66/946218966.db2.gz XEFADHOZFXAQOJ-RTBURBONSA-N 0 3 401.510 4.498 20 0 HIADHN O=C(Cc1nc(-c2ccc(F)cc2)cs1)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000567083256 946236668 /nfs/dbraw/zinc/23/66/68/946236668.db2.gz DKUGGDGFKLBEHU-FQEVSTJZSA-N 0 3 409.530 4.273 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)C(=O)Nc1cccc(Oc2ccccc2)c1 ZINC000567311767 946307411 /nfs/dbraw/zinc/30/74/11/946307411.db2.gz SFXHICWNXCTJKF-UHFFFAOYSA-N 0 3 417.509 4.008 20 0 HIADHN COC(=O)c1cc(NC(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)cc2[nH]ccc21 ZINC000567646778 946390314 /nfs/dbraw/zinc/39/03/14/946390314.db2.gz CIDMIWDLRALSEE-LJQANCHMSA-N 0 3 414.893 4.032 20 0 HIADHN C[C@H]1[C@@H](NC(=O)c2cnn(C(C)(C)C)c2C(F)(F)F)CCN1Cc1ccccc1 ZINC000568313916 946500943 /nfs/dbraw/zinc/50/09/43/946500943.db2.gz IAMGMSBXLRPKRJ-YOEHRIQHSA-N 0 3 408.468 4.050 20 0 HIADHN CCSc1cccc(Br)c1NC(=O)N1C[C@@H](N(C)C)[C@@H](SC)C1 ZINC000568333569 946514196 /nfs/dbraw/zinc/51/41/96/946514196.db2.gz DKKQSYZICJLDNF-OCCSQVGLSA-N 0 3 418.426 4.070 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)c1cc2sc(N3CCCC3)nc2s1)c1ccco1 ZINC000568551123 946590440 /nfs/dbraw/zinc/59/04/40/946590440.db2.gz PTCXEXWNVVDTMT-ZIAGYGMSSA-N 0 3 418.588 4.410 20 0 HIADHN O=C([C@@H]1C[C@H]1c1ccccc1Cl)N1CCC[C@@H](c2n[nH]cc2CN2CCCC2)C1 ZINC000568612345 946624025 /nfs/dbraw/zinc/62/40/25/946624025.db2.gz GZVZYXUQXHUECN-LSTHTHJFSA-N 0 3 412.965 4.169 20 0 HIADHN Cc1ccc(-n2cnnc2SC[C@@H]2CN(Cc3ccccc3)CCCO2)c(C)c1 ZINC000568656906 946638412 /nfs/dbraw/zinc/63/84/12/946638412.db2.gz RTRTXDGYEKYCJL-NRFANRHFSA-N 0 3 408.571 4.267 20 0 HIADHN CN(C)C[C@H](NC(=O)[C@H]1C[C@H]1c1ccc(Br)cc1)c1ccc(F)cc1 ZINC000568789291 946687017 /nfs/dbraw/zinc/68/70/17/946687017.db2.gz BESOGGJHNBAEAR-FHWLQOOXSA-N 0 3 405.311 4.111 20 0 HIADHN CN(C)C[C@H](NC(=O)[C@@H]1C[C@@H]1c1ccc(Br)cc1)c1ccc(F)cc1 ZINC000568789293 946688081 /nfs/dbraw/zinc/68/80/81/946688081.db2.gz BESOGGJHNBAEAR-QRVBRYPASA-N 0 3 405.311 4.111 20 0 HIADHN CS(=O)(=O)C1(CN[C@@H]2CCc3c2cc(Cl)cc3Br)CCCC1 ZINC000568895423 946739975 /nfs/dbraw/zinc/73/99/75/946739975.db2.gz DCDRIHVSBIBKDB-OAHLLOKOSA-N 0 3 406.773 4.037 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)N1CCC[C@H]1C1CCOCC1)c1ccc(Cl)cc1 ZINC000569033841 946803473 /nfs/dbraw/zinc/80/34/73/946803473.db2.gz HYHBEGHABDQRCU-SFTDATJTSA-N 0 3 407.986 4.324 20 0 HIADHN Cc1cnccc1OC1CCN(C[C@@H](O)CO[C@@H](C)c2ccc(Cl)cc2)CC1 ZINC000569055018 946811989 /nfs/dbraw/zinc/81/19/89/946811989.db2.gz WNIFSOSYGQJYNJ-FXAWDEMLSA-N 0 3 404.938 4.025 20 0 HIADHN Cc1ccc2c(c1)[C@@H](NCc1cccc(N3C(=O)NC4(CCCC4)C3=O)c1)[C@H](C)C2 ZINC000569055905 946812008 /nfs/dbraw/zinc/81/20/08/946812008.db2.gz PPXLLKCHKCFKAN-VGSWGCGISA-N 0 3 403.526 4.387 20 0 HIADHN O=C1NC2(CCCC2)C(=O)N1c1cccc(CN[C@H]2CCCc3cc(F)ccc32)c1 ZINC000569055481 946812128 /nfs/dbraw/zinc/81/21/28/946812128.db2.gz HRUSUPYMIJRCFI-NRFANRHFSA-N 0 3 407.489 4.362 20 0 HIADHN Cc1ccc2c(c1)[C@H](NCc1cccc(N3C(=O)NC4(CCCC4)C3=O)c1)[C@H](C)C2 ZINC000569055903 946812359 /nfs/dbraw/zinc/81/23/59/946812359.db2.gz PPXLLKCHKCFKAN-VGOFRKELSA-N 0 3 403.526 4.387 20 0 HIADHN CC1(C)[C@@H](C(F)(F)F)CCN1C(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000569108983 946817297 /nfs/dbraw/zinc/81/72/97/946817297.db2.gz UOUNQGGXPJKDNH-HOTGVXAUSA-N 0 3 404.423 4.333 20 0 HIADHN C[C@@H]1[C@H](NC(=O)Nc2cccc(OCc3cccnc3)c2)CCN1Cc1ccccc1 ZINC000569261045 946842143 /nfs/dbraw/zinc/84/21/43/946842143.db2.gz OXVGXEQNLLGIPX-NTKDMRAZSA-N 0 3 416.525 4.445 20 0 HIADHN CSc1ccc(NC(=O)CN[C@H]2CCN(C(C)C)[C@@H]2c2ccc(F)c(F)c2)cc1 ZINC000569359498 946860325 /nfs/dbraw/zinc/86/03/25/946860325.db2.gz WJBJQUYGKGJGAY-RBBKRZOGSA-N 0 3 419.541 4.439 20 0 HIADHN CN1CC[C@H](NCC(=O)Nc2ccccc2Oc2ccccc2)[C@@H]1c1ccccc1 ZINC000569386875 946863054 /nfs/dbraw/zinc/86/30/54/946863054.db2.gz POOLJSPQZCCDRV-DHLKQENFSA-N 0 3 401.510 4.452 20 0 HIADHN COc1ccc(C[C@](C)(O)CNCc2ccc(F)c(Cl)c2Cl)cc1OC ZINC000569395815 946866246 /nfs/dbraw/zinc/86/62/46/946866246.db2.gz LVVJTUIEYGYTNP-IBGZPJMESA-N 0 3 402.293 4.233 20 0 HIADHN COc1ccc([C@H](NC(=O)CN[C@H]2c3ccccc3CC23CCOCC3)C(C)C)cc1 ZINC000569427880 946874395 /nfs/dbraw/zinc/87/43/95/946874395.db2.gz RJMNJECQUXSXQQ-RPBOFIJWSA-N 0 3 422.569 4.192 20 0 HIADHN CCCN1CCC[C@H]1CN[C@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000569443295 946876269 /nfs/dbraw/zinc/87/62/69/946876269.db2.gz ICPMFOWGTVBVQX-RBBKRZOGSA-N 0 3 421.006 4.297 20 0 HIADHN C[C@@H](NCCNc1ccc2ccccc2n1)c1ccc(S(=O)(=O)C2CCCC2)cc1 ZINC000569636756 946913409 /nfs/dbraw/zinc/91/34/09/946913409.db2.gz SPVLPMHRTITLAU-GOSISDBHSA-N 0 3 423.582 4.714 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)COc2ccccc2C(F)(F)F)CC1 ZINC000569718323 946954658 /nfs/dbraw/zinc/95/46/58/946954658.db2.gz JKSRHEWJACKPGC-UHFFFAOYSA-N 0 3 406.448 4.207 20 0 HIADHN C[C@H]1C[C@H]1N1CCN(C(=O)c2ccc(-c3noc(CC(C)(C)C)n3)cc2)C[C@@H](C)C1 ZINC000569797336 947008525 /nfs/dbraw/zinc/00/85/25/947008525.db2.gz KNKKYJYOMFMKHD-ABSDTBQOSA-N 0 3 410.562 4.128 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)Nc1ccccc1CN1C[C@@H](C)O[C@@H](C)C1 ZINC000569837923 947016214 /nfs/dbraw/zinc/01/62/14/947016214.db2.gz MBPVAXRVFYYJMK-OYRHEFFESA-N 0 3 416.610 4.026 20 0 HIADHN COC(C)(C)c1nc(C)c(C(=O)NC[C@H]2CCCN(C)[C@H]2c2cccs2)s1 ZINC000569892879 947038530 /nfs/dbraw/zinc/03/85/30/947038530.db2.gz LVMKUWYBIJHYOE-GDBMZVCRSA-N 0 3 407.605 4.207 20 0 HIADHN CCO[C@H](C)c1nc(CN(C)C(=O)N[C@H]2CCN(Cc3ccccc3)[C@H]2C)cs1 ZINC000569956585 947052560 /nfs/dbraw/zinc/05/25/60/947052560.db2.gz UPOUPHGECJRMMF-QKLQHJQFSA-N 0 3 416.591 4.045 20 0 HIADHN O=C1NC2(CCCC2)C(=O)N1c1cccc(CNC/C=C\c2ccc(F)c(F)c2)c1 ZINC000569973876 947058957 /nfs/dbraw/zinc/05/89/57/947058957.db2.gz OVNWXSRNYRNNFF-XQRVVYSFSA-N 0 3 411.452 4.137 20 0 HIADHN Cc1nc(COc2ccc(Cl)cc2)sc1C(=O)N1CC[C@@H](N2CCCC2)[C@@H]1C ZINC000570116331 947099408 /nfs/dbraw/zinc/09/94/08/947099408.db2.gz SAOOMWXDPOLIFC-MAUKXSAKSA-N 0 3 419.978 4.383 20 0 HIADHN CCCN(C)[C@H](CNC(=O)c1cc(COC(C)(C)C)on1)c1ccc(Cl)cc1 ZINC000570184501 947124813 /nfs/dbraw/zinc/12/48/13/947124813.db2.gz HUBMBVFBHBXAEZ-LJQANCHMSA-N 0 3 407.942 4.456 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)[C@H](C)Cc2ccc(C(F)(F)F)cc2)cc1 ZINC000570309998 947189134 /nfs/dbraw/zinc/18/91/34/947189134.db2.gz URFGBAAAPLJLRE-QRWLVFNGSA-N 0 3 408.464 4.312 20 0 HIADHN Clc1ccccc1[C@@H](CNCc1conc1Cc1ccccc1)N1CCOCC1 ZINC000570414544 947233866 /nfs/dbraw/zinc/23/38/66/947233866.db2.gz PINAMVYLEDIMOS-HSZRJFAPSA-N 0 3 411.933 4.082 20 0 HIADHN O=C1[C@H](N[C@@H](C[C@@H]2CCOC2)c2ccccc2)CCN1c1ccc(F)c(Cl)c1 ZINC000570639248 947319968 /nfs/dbraw/zinc/31/99/68/947319968.db2.gz HGADORKXVHDNNC-RVHYNSKXSA-N 0 3 402.897 4.342 20 0 HIADHN CC(=O)Nc1cccc(NC(=O)[C@@H](C)N[C@H](C)c2ccc(-c3ccncc3)cc2)c1 ZINC000570700788 947329400 /nfs/dbraw/zinc/32/94/00/947329400.db2.gz VWOMBHZVHMNRME-IAGOWNOFSA-N 0 3 402.498 4.385 20 0 HIADHN NC(=O)[C@@H](Cc1ccc(C(F)(F)F)cc1)NC[C@H](Cc1ccccc1)C(F)(F)F ZINC000570737914 947340819 /nfs/dbraw/zinc/34/08/19/947340819.db2.gz PBLDDSBXPBRTFP-DLBZAZTESA-N 0 3 418.381 4.113 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)c2ccc3[nH]c(C(F)F)nc3c2)N(C)C)cc1 ZINC000570751798 947344738 /nfs/dbraw/zinc/34/47/38/947344738.db2.gz NYVJNVJUEKGLAU-IBGZPJMESA-N 0 3 416.472 4.320 20 0 HIADHN Cc1cc(NC(=O)[C@@H]2CCCN(Cc3cccnc3)C2)ccc1Oc1ccncc1 ZINC000570776306 947354826 /nfs/dbraw/zinc/35/48/26/947354826.db2.gz ZZKWANSWLAXZOP-HXUWFJFHSA-N 0 3 402.498 4.428 20 0 HIADHN F[C@@]1(c2ccccc2)CCN(CC2(CN3CC[C@@](F)(c4ccccc4)C3)COC2)C1 ZINC000571181602 947534058 /nfs/dbraw/zinc/53/40/58/947534058.db2.gz OYQDROLXMSIBAH-DQEYMECFSA-N 0 3 412.524 4.144 20 0 HIADHN CC(C)[C@]1(CO)CCCN(Cc2ccnc(-c3ccc(Br)cc3)n2)C1 ZINC000571173562 947534405 /nfs/dbraw/zinc/53/44/05/947534405.db2.gz WJZOGWHOAQLLSA-HXUWFJFHSA-N 0 3 404.352 4.137 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)c2ccc(Nc3nc(C)cs3)cc2)cc1 ZINC000571191644 947538634 /nfs/dbraw/zinc/53/86/34/947538634.db2.gz SKGOWUWYKWXLRV-FQEVSTJZSA-N 0 3 410.543 4.236 20 0 HIADHN CN(C)C[C@@H](NC(=O)c1c[nH]c2ncc(Br)cc12)c1ccc(Cl)cc1 ZINC000571302910 947581931 /nfs/dbraw/zinc/58/19/31/947581931.db2.gz ZTIKHDOQYCOYCI-MRXNPFEDSA-N 0 3 421.726 4.012 20 0 HIADHN O=C1CC[C@@H]2CN([C@H]3CCCc4ccc(Br)cc43)CC[C@@H]2N1C1CC1 ZINC000571389941 947633776 /nfs/dbraw/zinc/63/37/76/947633776.db2.gz BQZXEYVANISSPR-XPGWFJOJSA-N 0 3 403.364 4.302 20 0 HIADHN COc1cc(Br)ccc1CN1C[C@H](c2ccccc2)[C@@H]2COCC[C@H]21 ZINC000571412789 947636746 /nfs/dbraw/zinc/63/67/46/947636746.db2.gz AFNSEIZWSFNNTN-HSALFYBXSA-N 0 3 402.332 4.462 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)N1CCC(C(F)(F)F)(C(F)(F)F)C1 ZINC000571438096 947646232 /nfs/dbraw/zinc/64/62/32/947646232.db2.gz UPTCJDKOIRDQMY-CYBMUJFWSA-N 0 3 411.390 4.033 20 0 HIADHN COc1ccc(C(=O)NC[C@@H](c2ccc(SC)cc2)N(C)C)c(OC(C)C)c1 ZINC000571478589 947667027 /nfs/dbraw/zinc/66/70/27/947667027.db2.gz QLPFIQYCQLGMSU-FQEVSTJZSA-N 0 3 402.560 4.237 20 0 HIADHN Cc1nc2ccccn2c(=O)c1CCN1CCC[C@@H]1c1nc2ccccc2n1C(C)C ZINC000571723725 947763649 /nfs/dbraw/zinc/76/36/49/947763649.db2.gz CRSXLHDMWGKVED-JOCHJYFZSA-N 0 3 415.541 4.313 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2cc(C)c(OC)cc2Cl)c1 ZINC000571837374 947799826 /nfs/dbraw/zinc/79/98/26/947799826.db2.gz KGAWBKLKIPUSTC-UHFFFAOYSA-N 0 3 405.926 4.261 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N[C@@H](C)c1ccc2n[nH]cc2c1)c1cccc(OC)c1 ZINC000572025352 947829953 /nfs/dbraw/zinc/82/99/53/947829953.db2.gz BRELXEDVNGDVHI-AOMKIAJQSA-N 0 3 409.534 4.015 20 0 HIADHN CN1CCCN(c2ccc(-c3noc([C@H]4C[C@@H]4c4ccccc4Cl)n3)cn2)CC1 ZINC000572085611 947843754 /nfs/dbraw/zinc/84/37/54/947843754.db2.gz UMEDVDLYVXCUPH-MSOLQXFVSA-N 0 3 409.921 4.198 20 0 HIADHN CCN1CCN(Cc2ccc(CN[C@@H](COC)c3cccc(Cl)c3F)cc2)CC1 ZINC000572164851 947853692 /nfs/dbraw/zinc/85/36/92/947853692.db2.gz BSVAWYGDYFLVIJ-QFIPXVFZSA-N 0 3 419.972 4.094 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)[C@@H]1C[C@@H]1c1ccc(Cl)c(Cl)c1 ZINC000572309972 947880617 /nfs/dbraw/zinc/88/06/17/947880617.db2.gz LLJXHQAOWBJXNJ-RCCFBDPRSA-N 0 3 405.325 4.302 20 0 HIADHN COc1ccc([C@@H](C)NCc2cnc3ccc(Br)cn23)c(C)c1OC ZINC000572439302 947906182 /nfs/dbraw/zinc/90/61/82/947906182.db2.gz UJTPUYJREIGPLZ-CYBMUJFWSA-N 0 3 404.308 4.273 20 0 HIADHN C[C@H](NC[C@@H](CO)Cc1cc(F)c(F)c(F)c1)c1sccc1Br ZINC000572451690 947911671 /nfs/dbraw/zinc/91/16/71/947911671.db2.gz SVEPSYYMAXJPLE-ONGXEEELSA-N 0 3 408.283 4.430 20 0 HIADHN C[C@@H](CN1CCC[C@H](CNC(=O)CC(F)(F)F)C1)c1cccc(Br)c1 ZINC000572563897 947949154 /nfs/dbraw/zinc/94/91/54/947949154.db2.gz QJXIBFYFQZHNRG-UONOGXRCSA-N 0 3 421.301 4.333 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)N[C@@H]1C[C@H]1c1ccc(Br)s1 ZINC000572665643 947973138 /nfs/dbraw/zinc/97/31/38/947973138.db2.gz QPKAGVRINWDLIU-CHWSQXEVSA-N 0 3 424.364 4.258 20 0 HIADHN O=C(CN1CCCC2(CCOCC2)C1)N(CCc1ccccc1)Cc1ccccc1 ZINC000572775478 948007860 /nfs/dbraw/zinc/00/78/60/948007860.db2.gz LJFGTQUDVWALCW-UHFFFAOYSA-N 0 3 406.570 4.151 20 0 HIADHN COc1cccc([C@@H]2[C@@H](N[C@@H](C)C(=O)Nc3ccc(C)cc3C)CCN2C2CC2)c1 ZINC000572902582 948033668 /nfs/dbraw/zinc/03/36/68/948033668.db2.gz ITTLZGXVHIBZDZ-GKVQRAMASA-N 0 3 407.558 4.207 20 0 HIADHN CC(C)Cn1ncc(NC(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)c1C(F)F ZINC000572905175 948034428 /nfs/dbraw/zinc/03/44/28/948034428.db2.gz CIRYLFMRRQRYOV-NVXWUHKLSA-N 0 3 405.493 4.434 20 0 HIADHN Cc1cc(C)c(CC(C(=O)Nc2cccc3c2OCC(=O)N3)C(F)(F)F)c(C)c1 ZINC000573231477 948115980 /nfs/dbraw/zinc/11/59/80/948115980.db2.gz KSJMDWNQFGDBMW-HNNXBMFYSA-N 0 3 406.404 4.302 20 0 HIADHN Cc1cc(C)n(-c2ccc(CNCc3c[nH]c4nccnc34)c(C(F)(F)F)c2)n1 ZINC000573412157 948200117 /nfs/dbraw/zinc/20/01/17/948200117.db2.gz CBKPBMXFPPWVOD-UHFFFAOYSA-N 0 3 400.408 4.021 20 0 HIADHN O=C(Nc1ccc(-c2ncc3n2CCCC3)cc1)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000573712237 948280703 /nfs/dbraw/zinc/28/07/03/948280703.db2.gz WSGZUTGXOSYYRZ-OAQYLSRUSA-N 0 3 415.541 4.132 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)Nc2ccc(Oc3cccnc3)nc2)c1 ZINC000573809946 948301175 /nfs/dbraw/zinc/30/11/75/948301175.db2.gz WGBALGWBBKGZEK-UHFFFAOYSA-N 0 3 405.502 4.173 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)Nc1ccc(C(=O)NCC(C)C)c(Cl)c1 ZINC000574027527 948352357 /nfs/dbraw/zinc/35/23/57/948352357.db2.gz XJDUFCDBXGLTRM-UHFFFAOYSA-N 0 3 423.001 4.456 20 0 HIADHN CSc1ccc([C@H](CNC(=O)c2c(F)cccc2Br)N(C)C)cc1 ZINC000574113871 948368031 /nfs/dbraw/zinc/36/80/31/948368031.db2.gz ADAFTOCATNTXIP-INIZCTEOSA-N 0 3 411.340 4.343 20 0 HIADHN COc1ccc2c(c1)C1(CC1)CN(C(=O)NC[C@@H](c1cccs1)N1CCCC1)C2 ZINC000574247557 948399054 /nfs/dbraw/zinc/39/90/54/948399054.db2.gz BSFKFZZYMOWOGK-FQEVSTJZSA-N 0 3 411.571 4.151 20 0 HIADHN CC[C@H](C(=O)Nc1cc(CN2CCSCC2)ccc1C)N(C)Cc1ccccc1 ZINC000574305537 948407537 /nfs/dbraw/zinc/40/75/37/948407537.db2.gz QSMOSSWNQDRBKK-HSZRJFAPSA-N 0 3 411.615 4.393 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)[C@@H](C)N[C@@H]1c2ccccc2CC12CCOCC2 ZINC000574489758 948458000 /nfs/dbraw/zinc/45/80/00/948458000.db2.gz RJISIYGTQGPZMK-QVKFZJNVSA-N 0 3 414.933 4.359 20 0 HIADHN C[C@@H](NCc1coc(-c2ccc(F)c(F)c2)n1)C1CCN(CC(F)(F)F)CC1 ZINC000574579446 948479708 /nfs/dbraw/zinc/47/97/08/948479708.db2.gz JMDVDUWAYDORNE-GFCCVEGCSA-N 0 3 403.395 4.372 20 0 HIADHN O=C(CN[C@@H]1c2ccccc2CC12CCOCC2)Nc1nc(-c2ccccc2)cs1 ZINC000574679849 948504222 /nfs/dbraw/zinc/50/42/22/948504222.db2.gz NONVVANWGBIRPK-JOCHJYFZSA-N 0 3 419.550 4.432 20 0 HIADHN O=S1(=O)CC[C@H](NCC2CC(c3ccccc3)C2)c2cc(Br)ccc21 ZINC000574707379 948507120 /nfs/dbraw/zinc/50/71/20/948507120.db2.gz UWSAVKLXLJLBHR-KJXMEXGPSA-N 0 3 420.372 4.451 20 0 HIADHN CCOc1cc(CNCc2ccc(C(C)(F)F)cc2)ccc1O[C@H](C)C(=O)N(C)C ZINC000574706550 948507296 /nfs/dbraw/zinc/50/72/96/948507296.db2.gz AADWPSCZLISJOK-MRXNPFEDSA-N 0 3 420.500 4.342 20 0 HIADHN C/C=C\c1ccc(OC[C@H](O)CNCc2cc(Br)cs2)c(OC)c1 ZINC000574772529 948522565 /nfs/dbraw/zinc/52/25/65/948522565.db2.gz QTXJMHGKDSTPCS-ABCZVMIZSA-N 0 3 412.349 4.082 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)c1ccc(-n2cncn2)c(C)c1)c1ccc(Cl)cc1 ZINC000575080049 948586032 /nfs/dbraw/zinc/58/60/32/948586032.db2.gz ZRGRLFRAGFHBSA-NRFANRHFSA-N 0 3 411.937 4.042 20 0 HIADHN O[C@H](COc1ccccc1C(F)(F)F)CN1CCC(OC2CCCCC2)CC1 ZINC000575356828 948653589 /nfs/dbraw/zinc/65/35/89/948653589.db2.gz VGGFWPFYYMCGBP-INIZCTEOSA-N 0 3 401.469 4.259 20 0 HIADHN COCC(=O)Nc1cccc(CN[C@H](Cc2cccnc2)c2cccc(Cl)c2)c1 ZINC000575733963 948687824 /nfs/dbraw/zinc/68/78/24/948687824.db2.gz BQDFGDIQJVLFIU-JOCHJYFZSA-N 0 3 409.917 4.394 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)N[C@@H]2c3ccccc3CC23CCOCC3)N(C)C)cc1 ZINC000575794625 948716681 /nfs/dbraw/zinc/71/66/81/948716681.db2.gz CQQXUZAIMBTRID-DNQXCXABSA-N 0 3 421.585 4.245 20 0 HIADHN CC(=O)N1C[C@@H]2CCC[C@H](N[C@@H](C(=O)c3c[nH]c4ccccc34)c3ccccc3)[C@@H]2C1 ZINC000575903199 948765156 /nfs/dbraw/zinc/76/51/56/948765156.db2.gz SNTMZQMXJHXADS-ILJKJKDTSA-N 0 3 415.537 4.329 20 0 HIADHN COc1ccc([C@H](Cc2ccccc2)NCC(=O)N2CCc3sccc3C2)cc1 ZINC000576032378 948813539 /nfs/dbraw/zinc/81/35/39/948813539.db2.gz JJBHMWVJDOOPPY-QFIPXVFZSA-N 0 3 406.551 4.215 20 0 HIADHN CC(C)n1nc(CN(C)C)c2c1CN(c1nc(N3CCCC3)cc3ccccc31)CC2 ZINC001164652909 719316131 /nfs/dbraw/zinc/31/61/31/719316131.db2.gz UAUVWHAPSWQSPJ-UHFFFAOYSA-N 0 3 418.589 4.237 20 0 HIADHN CNC(=O)CN1CCCC12CCN(c1cc(-c3ccccc3)c3ccccc3n1)CC2 ZINC001164689383 719739527 /nfs/dbraw/zinc/73/95/27/719739527.db2.gz DMGVJYYFHGPWDS-UHFFFAOYSA-N 0 3 414.553 4.083 20 0 HIADHN Clc1ccc2nc(Cl)nc(N3CC[C@H]4[C@@H]3CCN4Cc3cccnc3)c2c1 ZINC001164728527 720330431 /nfs/dbraw/zinc/33/04/31/720330431.db2.gz WANUMUNZAOKVCA-ROUUACIJSA-N 0 3 400.313 4.185 20 0 HIADHN FC(F)(Sc1ccc(Cl)nc1)N1CCCn2cnc(CNC3CCC3)c2C1 ZINC001164845293 720740718 /nfs/dbraw/zinc/74/07/18/720740718.db2.gz ZANGVSDLMJNVED-UHFFFAOYSA-N 0 3 413.925 4.122 20 0 HIADHN Cn1cc(CN2CC[C@H]3CN(c4cc(-c5ccccc5)cc(Cl)n4)C[C@H]3C2)cn1 ZINC001164772256 721127024 /nfs/dbraw/zinc/12/70/24/721127024.db2.gz UUTKCVBAHINURE-PZJWPPBQSA-N 0 3 407.949 4.094 20 0 HIADHN Cc1ccc(C)c(-c2ccc(N3CCN4C[C@H](Oc5cccc(F)c5)C[C@H]4C3)nn2)c1 ZINC001164905322 721556737 /nfs/dbraw/zinc/55/67/37/721556737.db2.gz GSIKRIFFYXMXIN-RBBKRZOGSA-N 0 3 418.516 4.241 20 0 HIADHN Cc1csc2ncnc(N3CCC(F)(F)[C@@]4(CCN(Cc5ccccn5)C4)C3)c12 ZINC001164905756 721583371 /nfs/dbraw/zinc/58/33/71/721583371.db2.gz WAECUYFBGBZGRW-HXUWFJFHSA-N 0 3 415.513 4.132 20 0 HIADHN Cc1cc(N2CCC(F)(F)[C@]3(CCN(Cc4ccccn4)C3)C2)nc(C(C)(C)C)n1 ZINC001164913482 721728888 /nfs/dbraw/zinc/72/88/88/721728888.db2.gz WEHXUVYQWHXWEZ-QFIPXVFZSA-N 0 3 415.532 4.215 20 0 HIADHN CCSc1ccnc(N2CCC(F)(F)[C@]3(CCN(Cc4ccccn4)C3)C2)c1 ZINC001164911252 721732891 /nfs/dbraw/zinc/73/28/91/721732891.db2.gz JNTOCAOTPVZMEO-FQEVSTJZSA-N 0 3 404.530 4.326 20 0 HIADHN COc1ccc2cnc(N3CCC4(CC3)CN(Cc3ccc(C)cc3)CCO4)cc2c1 ZINC001164940701 721929007 /nfs/dbraw/zinc/92/90/07/721929007.db2.gz XPZODWNOSRANQM-UHFFFAOYSA-N 0 3 417.553 4.423 20 0 HIADHN Cc1cc2ccccc2nc1N1CCC2(CC1)COCCN(Cc1ccncc1)C2 ZINC001164961151 722054077 /nfs/dbraw/zinc/05/40/77/722054077.db2.gz SNALLURZSDAVNO-UHFFFAOYSA-N 0 3 402.542 4.057 20 0 HIADHN Clc1cccc2c1ccnc2N1CC[C@@H]2CN(Cc3cccnc3)CCO[C@H]2C1 ZINC001164974896 722114760 /nfs/dbraw/zinc/11/47/60/722114760.db2.gz IVHDKVDGEPXQRX-GCJKJVERSA-N 0 3 408.933 4.011 20 0 HIADHN Cc1ccc2c(c1)nc(Cl)cc2N1CC[C@@H]2CN(Cc3cccnc3)CCO[C@H]2C1 ZINC001164971456 722125770 /nfs/dbraw/zinc/12/57/70/722125770.db2.gz CLRIQJQOGYGQRD-XXBNENTESA-N 0 3 422.960 4.319 20 0 HIADHN Cc1ccc2cc(Cl)nc(N3CC[C@@H]4CN(Cc5cccnc5)CCO[C@@H]4C3)c2c1 ZINC001164973198 722130462 /nfs/dbraw/zinc/13/04/62/722130462.db2.gz BMGUUYCXCVCSOB-IFMALSPDSA-N 0 3 422.960 4.319 20 0 HIADHN Cc1ccc2cc(Cl)nc(N3CC[C@@H]4CN(Cc5cccnc5)CCO[C@H]4C3)c2c1 ZINC001164973200 722130993 /nfs/dbraw/zinc/13/09/93/722130993.db2.gz BMGUUYCXCVCSOB-IRLDBZIGSA-N 0 3 422.960 4.319 20 0 HIADHN COc1ccc(Nc2nc(C(=O)N(CCN(C)C)Cc3ccccc3)cs2)cc1 ZINC000006226431 845184308 /nfs/dbraw/zinc/18/43/08/845184308.db2.gz VDDLXQVIFJIHAC-UHFFFAOYSA-N 0 3 410.543 4.099 20 0 HIADHN COc1cc(CNC(=O)CN[C@@H](C)c2ccccc2)ccc1OCc1ccccc1 ZINC000007336290 845313519 /nfs/dbraw/zinc/31/35/19/845313519.db2.gz DNHFPZKWMLIPDU-IBGZPJMESA-N 0 3 404.510 4.241 20 0 HIADHN Cc1ccc(-c2nc(SCC(=O)Nc3ccc(C[NH+]4CCCC4)cc3)n[n-]2)cc1 ZINC000007485658 845343252 /nfs/dbraw/zinc/34/32/52/845343252.db2.gz LHAWYJSGMJYKLD-UHFFFAOYSA-N 0 3 407.543 4.107 20 0 HIADHN C[C@H](NCc1cc(=O)n2cc(Br)ccc2n1)c1cccc2ccccc21 ZINC000008268370 845503243 /nfs/dbraw/zinc/50/32/43/845503243.db2.gz ZKBTXJMNGWZTCF-AWEZNQCLSA-N 0 3 408.299 4.461 20 0 HIADHN COc1cc(NC(=O)CN[C@@H](c2ccc(Cl)cc2)C(C)C)cc(OC)c1OC ZINC000010137439 845623585 /nfs/dbraw/zinc/62/35/85/845623585.db2.gz MBELJANLBZMMHG-HXUWFJFHSA-N 0 3 406.910 4.291 20 0 HIADHN O=C1C[C@H](NCc2c[nH]nc2-c2ccsc2)CN1c1cccc(C(F)(F)F)c1 ZINC000436286907 861593978 /nfs/dbraw/zinc/59/39/78/861593978.db2.gz RPHKMHVSOPFOFY-HNNXBMFYSA-N 0 3 406.433 4.052 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)CS[C@@H](C)c3nc4ccccc4[nH]3)cc2)CC1 ZINC000011945157 845842850 /nfs/dbraw/zinc/84/28/50/845842850.db2.gz YWTRDBSQLIKBIE-KRWDZBQOSA-N 0 3 423.586 4.138 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3ccc(-c4ccccc4)nc3C)cc2)CC1 ZINC000011951595 845842975 /nfs/dbraw/zinc/84/29/75/845842975.db2.gz KWLRNNUUUXRTON-UHFFFAOYSA-N 0 3 400.526 4.451 20 0 HIADHN CCn1ncc2c1nc(-c1ccccc1)cc2C(=O)NC[C@@H](c1ccccc1)N(C)C ZINC000014061971 845922295 /nfs/dbraw/zinc/92/22/95/845922295.db2.gz PMDLZZNHGILXEY-QHCPKHFHSA-N 0 3 413.525 4.151 20 0 HIADHN O=C(Nc1ccccc1)C1CCN(C[C@@H](O)COc2c(Cl)cccc2Cl)CC1 ZINC000014074151 845922932 /nfs/dbraw/zinc/92/29/32/845922932.db2.gz PWOPYLGDUABLHK-QGZVFWFLSA-N 0 3 423.340 4.084 20 0 HIADHN COc1ccc([C@@H](CNC(=O)c2ccc(OC)c3ccccc23)N2CCCC2)cc1 ZINC000017911684 846277055 /nfs/dbraw/zinc/27/70/55/846277055.db2.gz OMTNIQXMERUMAY-HSZRJFAPSA-N 0 3 404.510 4.424 20 0 HIADHN O=C(CN[C@H](Cc1ccccc1)c1ccccc1)Nc1ccccc1C(=O)NC1CC1 ZINC000019538942 846367608 /nfs/dbraw/zinc/36/76/08/846367608.db2.gz MXPHEICNRILADO-XMMPIXPASA-N 0 3 413.521 4.091 20 0 HIADHN O=C(CN1CCN(CC2CCCCC2)CC1)Nc1ccc(Cl)c(C(F)(F)F)c1 ZINC000021580046 846465848 /nfs/dbraw/zinc/46/58/48/846465848.db2.gz LYEARGVRXCFWSO-UHFFFAOYSA-N 0 3 417.903 4.495 20 0 HIADHN O=C(CN1CCC[C@H]1c1ccccc1)N1CCC[C@@H]1c1ccc2c(c1)OCCCO2 ZINC000022549179 846585754 /nfs/dbraw/zinc/58/57/54/846585754.db2.gz WPOLVUYCWNXNPF-FCHUYYIVSA-N 0 3 406.526 4.349 20 0 HIADHN O=S(=O)(NCC1CCN(Cc2cccs2)CC1)c1cccc2ccccc21 ZINC000023000375 846646773 /nfs/dbraw/zinc/64/67/73/846646773.db2.gz NSQYQHXADJQVLJ-UHFFFAOYSA-N 0 3 400.569 4.092 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)C1CCN(c2nc3ccccc3o2)CC1 ZINC000023238278 846675530 /nfs/dbraw/zinc/67/55/30/846675530.db2.gz NLPDEMIDYUXKBI-LJQANCHMSA-N 0 3 424.570 4.059 20 0 HIADHN COc1cc(CN(C)C[C@H](O)COc2ccc3ccccc3c2)ccc1OC(F)F ZINC000023408740 846696248 /nfs/dbraw/zinc/69/62/48/846696248.db2.gz LYIHWQQPZDCCMG-IBGZPJMESA-N 0 3 417.452 4.322 20 0 HIADHN O=C(CN1CCC(Cc2ccccc2)CC1)N1CCC[C@H]1c1ccc2c(c1)OCCO2 ZINC000023697997 846741931 /nfs/dbraw/zinc/74/19/31/846741931.db2.gz FMTBSJGGRSPUNQ-QHCPKHFHSA-N 0 3 420.553 4.076 20 0 HIADHN CN(C)Cc1ccccc1CNC(=O)c1ccc(NC(=O)Nc2ccccc2)cc1 ZINC000024084619 846786758 /nfs/dbraw/zinc/78/67/58/846786758.db2.gz COPYJHFSMOKPAV-UHFFFAOYSA-N 0 3 402.498 4.322 20 0 HIADHN CC[C@@H](NCC(=O)Nc1cc(Cl)ccc1-n1cncn1)c1ccc(Cl)cc1 ZINC000024254185 846806810 /nfs/dbraw/zinc/80/68/10/846806810.db2.gz HOKOHCITKOWLBJ-MRXNPFEDSA-N 0 3 404.301 4.254 20 0 HIADHN O=C(CN[C@H](Cc1ccccc1)c1ccccc1)Nc1cccc(N2CCCC2=O)c1 ZINC000024734704 846860122 /nfs/dbraw/zinc/86/01/22/846860122.db2.gz AEXLRBAHYOIDJB-XMMPIXPASA-N 0 3 413.521 4.326 20 0 HIADHN CCN(Cc1ccc(OC)c(OC)c1)C[C@H](O)COc1cc(Cl)ccc1Cl ZINC000025234718 846945356 /nfs/dbraw/zinc/94/53/56/846945356.db2.gz AKCRQGZBPPKJDU-INIZCTEOSA-N 0 3 414.329 4.272 20 0 HIADHN COc1ccc(OC)c([C@H]2CCCN2C[C@@H](O)COCc2ccccc2Cl)c1 ZINC000025232788 846945401 /nfs/dbraw/zinc/94/54/01/846945401.db2.gz MHTQNGOEKSEIDG-DYESRHJHSA-N 0 3 405.922 4.072 20 0 HIADHN O=C(CCN1CCC[C@@H]1[C@@H](O)C(F)(F)F)Nc1ccc(Oc2ccccc2)cc1 ZINC000436393712 861737410 /nfs/dbraw/zinc/73/74/10/861737410.db2.gz UZVCNQPTMGLJGG-UYAOXDASSA-N 0 3 408.420 4.195 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)c1cnc2c(c1)c(C)nn2-c1ccccc1 ZINC000025855957 847047089 /nfs/dbraw/zinc/04/70/89/847047089.db2.gz RIYUCLVJGOOUIE-UHFFFAOYSA-N 0 3 415.497 4.051 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cc(Br)ccc1F)c1cccc(OC)c1 ZINC000025863367 847048595 /nfs/dbraw/zinc/04/85/95/847048595.db2.gz FBBWHQIIIBNWGJ-IBGZPJMESA-N 0 3 423.326 4.410 20 0 HIADHN CC(C)(CNC(=O)N1CCC(c2ccc(O)cc2)CC1)N1CCc2ccccc2C1 ZINC000026164091 847097419 /nfs/dbraw/zinc/09/74/19/847097419.db2.gz LWIMPGZTMOURLQ-UHFFFAOYSA-N 0 3 407.558 4.118 20 0 HIADHN COc1cc(CN[C@@H](C)c2ccc3c(c2)CCCC3)ccc1OCC(=O)N1CCCC1 ZINC000026313858 847122804 /nfs/dbraw/zinc/12/28/04/847122804.db2.gz WSOQXGPVMZOTOI-IBGZPJMESA-N 0 3 422.569 4.426 20 0 HIADHN O=C(CCc1nc(-c2ccc(Cl)cc2)no1)N1CCCN(Cc2ccccc2)CC1 ZINC000026357070 847132618 /nfs/dbraw/zinc/13/26/18/847132618.db2.gz BVGAAVMJCBOGLA-UHFFFAOYSA-N 0 3 424.932 4.057 20 0 HIADHN O=c1cc(CN2CCC[C@H]2COc2ccc(Cl)cc2)nc2ccc(Cl)cn12 ZINC000026723975 847190923 /nfs/dbraw/zinc/19/09/23/847190923.db2.gz UBHPRMSBXDUGDR-KRWDZBQOSA-N 0 3 404.297 4.045 20 0 HIADHN Cc1ccc2c(CC(=O)NCCCCN3CCN(c4cccc(C)c4)CC3)coc2c1 ZINC000026954840 847226507 /nfs/dbraw/zinc/22/65/07/847226507.db2.gz AJILQGWIZBGFIK-UHFFFAOYSA-N 0 3 419.569 4.311 20 0 HIADHN COc1cc2c(cc1NC(=O)CN1CCN(C3CCCC3)CC1)oc1ccccc12 ZINC000027118339 847250418 /nfs/dbraw/zinc/25/04/18/847250418.db2.gz AVOUHIJCXYBDCF-UHFFFAOYSA-N 0 3 407.514 4.093 20 0 HIADHN CCOc1cc(CN[C@H](C)c2cc(C)sc2C)ccc1O[C@@H](C)C(=O)N(C)C ZINC000027218271 847268536 /nfs/dbraw/zinc/26/85/36/847268536.db2.gz WPWVPVITTCKKNH-CVEARBPZSA-N 0 3 404.576 4.470 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1C(=O)N1CCCN(Cc2ccccc2C)CC1 ZINC000027388279 847294128 /nfs/dbraw/zinc/29/41/28/847294128.db2.gz WGVGUGRAAUNPCC-UHFFFAOYSA-N 0 3 416.569 4.205 20 0 HIADHN Cc1sc2nc(C)nc(SCC(=O)NCC(C)(C)N3CCCCC3)c2c1C ZINC000027455581 847305439 /nfs/dbraw/zinc/30/54/39/847305439.db2.gz MZFUIPFMCVEQMF-UHFFFAOYSA-N 0 3 406.621 4.089 20 0 HIADHN CN(C)[C@@H](CNC(=O)c1ccc(NC(=O)Nc2ccccc2)cc1)Cc1ccccc1 ZINC000027584068 847323475 /nfs/dbraw/zinc/32/34/75/847323475.db2.gz CNQNZEFXFLQJCO-HSZRJFAPSA-N 0 3 416.525 4.233 20 0 HIADHN Cc1cc(CSc2ncccc2C(=O)NC[C@@H](c2ccccc2)N2CCCC2)no1 ZINC000027602703 847325575 /nfs/dbraw/zinc/32/55/75/847325575.db2.gz WUEKAEPZRUMRNG-NRFANRHFSA-N 0 3 422.554 4.237 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)CCc3ccc(OC(F)F)cc3)c(C)c2)CC1 ZINC000028439409 847422134 /nfs/dbraw/zinc/42/21/34/847422134.db2.gz FRTMMCDCRBPZDN-UHFFFAOYSA-N 0 3 417.500 4.310 20 0 HIADHN Cc1cccc(CN2CCN(CCC(=O)Nc3c(Cl)cccc3Cl)CC2)c1 ZINC000028881603 847471741 /nfs/dbraw/zinc/47/17/41/847471741.db2.gz FUYRIUVTDYJFDB-UHFFFAOYSA-N 0 3 406.357 4.448 20 0 HIADHN COCCOc1ccc(C(F)(F)F)cc1NC(=O)CN(C)C1CCCCCC1 ZINC000029167063 847518192 /nfs/dbraw/zinc/51/81/92/847518192.db2.gz ONRBVEZHRUQLBJ-UHFFFAOYSA-N 0 3 402.457 4.324 20 0 HIADHN CC(C)[C@@H](CNC(=O)CSc1nc2ccccc2o1)N1CCc2ccccc2C1 ZINC000029174316 847520550 /nfs/dbraw/zinc/52/05/50/847520550.db2.gz CIGHHXFJGWZXNS-HXUWFJFHSA-N 0 3 409.555 4.119 20 0 HIADHN CC(C)[C@@H](CNC(=O)c1cc(F)ccc1Br)N1CCc2ccccc2C1 ZINC000029174829 847520574 /nfs/dbraw/zinc/52/05/74/847520574.db2.gz LXKCMTRYJVHHMF-HXUWFJFHSA-N 0 3 419.338 4.401 20 0 HIADHN CC(C)n1ncc2c1nc(C1CC1)cc2C(=O)N[C@H](CN1CCCC1)c1ccccc1 ZINC000029178882 847521076 /nfs/dbraw/zinc/52/10/76/847521076.db2.gz DBGMHRLBUGYLDH-HSZRJFAPSA-N 0 3 417.557 4.457 20 0 HIADHN Cc1c(C(=O)N[C@@H](CN2CCCC2)c2ccccc2)cnn1-c1ccc(Cl)cc1 ZINC000029179353 847522019 /nfs/dbraw/zinc/52/20/19/847522019.db2.gz BKJZDCFJKSPCPC-QFIPXVFZSA-N 0 3 408.933 4.401 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1c(C)nn(Cc2ccccc2)c1C)c1ccsc1 ZINC000029414928 847559966 /nfs/dbraw/zinc/55/99/66/847559966.db2.gz ZLTLQDPJDDAXHK-OAQYLSRUSA-N 0 3 410.587 4.423 20 0 HIADHN O=C(Nc1cccc(C(=O)NCCCN2CCc3ccccc3C2)c1)c1cccs1 ZINC000029839694 847629664 /nfs/dbraw/zinc/62/96/64/847629664.db2.gz JMYGTZCXKCREJV-UHFFFAOYSA-N 0 3 419.550 4.179 20 0 HIADHN Cc1nc(COc2ccccc2C(=O)NC2CCN(Cc3ccccc3)CC2)cs1 ZINC000030057298 847677809 /nfs/dbraw/zinc/67/78/09/847677809.db2.gz DDNVGXLFGSGIQD-UHFFFAOYSA-N 0 3 421.566 4.425 20 0 HIADHN Fc1cccc(COc2ccc(CNCc3ccc(Cn4cncn4)cc3)cc2)c1 ZINC000030634534 847748337 /nfs/dbraw/zinc/74/83/37/847748337.db2.gz LVVVXNIVOGMIPP-UHFFFAOYSA-N 0 3 402.473 4.334 20 0 HIADHN COc1ccc(CNCc2ccccc2Cn2cncn2)cc1OCc1ccccc1 ZINC000030900764 847794601 /nfs/dbraw/zinc/79/46/01/847794601.db2.gz ZCYQGOXQVIDLMF-UHFFFAOYSA-N 0 3 414.509 4.204 20 0 HIADHN c1cn(Cc2cccc(CNCc3cn(-c4ccccc4)nc3-c3cccnc3)c2)cn1 ZINC000030901955 847795598 /nfs/dbraw/zinc/79/55/98/847795598.db2.gz OJERRVOHBNUATP-UHFFFAOYSA-N 0 3 420.520 4.469 20 0 HIADHN COc1cc(Br)c(CNC[C@H]2CCN(c3ccccc3)C2)cc1OC ZINC000030907431 847795866 /nfs/dbraw/zinc/79/58/66/847795866.db2.gz PNFHYMBSRHZELY-OAHLLOKOSA-N 0 3 405.336 4.082 20 0 HIADHN O=C(NCc1ccc(OC(F)(F)F)cc1)NC[C@H](c1cccs1)N1CCCC1 ZINC000030989121 847805506 /nfs/dbraw/zinc/80/55/06/847805506.db2.gz ONOFDZKNCYBANT-MRXNPFEDSA-N 0 3 413.465 4.283 20 0 HIADHN COc1ccc2cc(CNC(=O)N3CCCN(Cc4ccccc4)CC3)ccc2c1 ZINC000031024107 847810470 /nfs/dbraw/zinc/81/04/70/847810470.db2.gz ZPQJUNHVEUBPPI-UHFFFAOYSA-N 0 3 403.526 4.266 20 0 HIADHN Cc1[nH]c2ccc(Br)cc2c1CC(=O)Nc1ccccc1CN(C)C ZINC000031230847 847848190 /nfs/dbraw/zinc/84/81/90/847848190.db2.gz YZLQAYYQSLHLRP-UHFFFAOYSA-N 0 3 400.320 4.482 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)c1cc2cc(Br)ccc2[nH]1 ZINC000031957963 847971078 /nfs/dbraw/zinc/97/10/78/847971078.db2.gz AKJNECHZTDRETF-UHFFFAOYSA-N 0 3 422.392 4.022 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1ccc(OC[C@@H]2CCCO2)cc1)c1ccsc1 ZINC000031988938 847976041 /nfs/dbraw/zinc/97/60/41/847976041.db2.gz DQVNVDJIHHRCDB-LEWJYISDSA-N 0 3 402.560 4.119 20 0 HIADHN CN(C)[C@@H](CNC(=O)CCc1ncc(-c2ccccc2Cl)o1)Cc1ccccc1 ZINC000032245841 847994365 /nfs/dbraw/zinc/99/43/65/847994365.db2.gz PXCHKWYLMWKFAL-GOSISDBHSA-N 0 3 411.933 4.217 20 0 HIADHN COc1ccc(-c2nc(C)c(C(=O)NCCCN3CCc4ccccc4C3)s2)cc1 ZINC000032400397 848018863 /nfs/dbraw/zinc/01/88/63/848018863.db2.gz YAVQWYSEGPTEPR-UHFFFAOYSA-N 0 3 421.566 4.305 20 0 HIADHN CCc1ccc([C@H](CNC(=O)CCCc2nc(-c3cccs3)no2)N(C)C)cc1 ZINC000032484018 848038034 /nfs/dbraw/zinc/03/80/34/848038034.db2.gz PEZCBMSUTSCXIZ-SFHVURJKSA-N 0 3 412.559 4.102 20 0 HIADHN CCc1ccc([C@H](CNC(=O)CCCc2nnc(-c3ccccc3)o2)N(C)C)cc1 ZINC000032484006 848038089 /nfs/dbraw/zinc/03/80/89/848038089.db2.gz FXCOCOCHDLWOIY-NRFANRHFSA-N 0 3 406.530 4.041 20 0 HIADHN Cc1ccccc1CN1CCCN(C(=O)CCCc2nnc(-c3ccccc3)o2)CC1 ZINC000032665015 848060428 /nfs/dbraw/zinc/06/04/28/848060428.db2.gz JAIPDLRZTAVDDT-UHFFFAOYSA-N 0 3 418.541 4.102 20 0 HIADHN O=C(CCc1ncc(-c2ccccc2F)o1)NC[C@@H](c1cccs1)N1CCCC1 ZINC000032762344 848073898 /nfs/dbraw/zinc/07/38/98/848073898.db2.gz PUTJADYWAVKBOO-SFHVURJKSA-N 0 3 413.518 4.428 20 0 HIADHN COC(=O)c1cn(CC(=O)C(C#N)c2nc(-c3ccccc3)cs2)c2ccccc12 ZINC000041534289 848227900 /nfs/dbraw/zinc/22/79/00/848227900.db2.gz KWDLKXZSASDXNE-QGZVFWFLSA-N 0 3 415.474 4.428 20 0 HIADHN N#CC(C(=O)CCc1cnn(-c2ccccc2)c1)c1nc2ccccc2n1C(F)F ZINC000041557832 848232347 /nfs/dbraw/zinc/23/23/47/848232347.db2.gz ABBZOGJLXXJHLO-KRWDZBQOSA-N 0 3 405.408 4.426 20 0 HIADHN CC(=O)Nc1ccc(NC(=S)NC[C@H](c2cccs2)N2CCC(C)CC2)cc1 ZINC000041726484 848240959 /nfs/dbraw/zinc/24/09/59/848240959.db2.gz RONGOAMPCFQVMJ-LJQANCHMSA-N 0 3 416.616 4.466 20 0 HIADHN CCN(CC)[C@@H](CNC(=S)Nc1ccc(NC(C)=O)cc1)c1cccc(OC)c1 ZINC000041729290 848241049 /nfs/dbraw/zinc/24/10/49/848241049.db2.gz XESUFEFUAZVMEQ-NRFANRHFSA-N 0 3 414.575 4.023 20 0 HIADHN C[C@H](NC(=O)C(=O)Nc1cccc(CN(C)C)c1)C(c1ccccc1)c1ccccc1 ZINC000042003228 848273225 /nfs/dbraw/zinc/27/32/25/848273225.db2.gz BLMXCAUHOCUBRF-IBGZPJMESA-N 0 3 415.537 4.024 20 0 HIADHN Brc1ccc(CNCc2cc(Br)c3c(c2)OCCO3)cc1 ZINC000042396509 848323772 /nfs/dbraw/zinc/32/37/72/848323772.db2.gz DTKSFMLIRGHKKC-UHFFFAOYSA-N 0 3 413.109 4.273 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)N(Cc1cccs1)C[C@@H]1CCCO1 ZINC000042813344 848356812 /nfs/dbraw/zinc/35/68/12/848356812.db2.gz FBJFVSQTLXIZHY-RBBKRZOGSA-N 0 3 413.587 4.276 20 0 HIADHN COc1ccc([C@H](CNC(=O)Nc2ccccc2Br)N2CCCC2)cc1 ZINC000043133658 848387550 /nfs/dbraw/zinc/38/75/50/848387550.db2.gz HSASZQLOSKGVNB-IBGZPJMESA-N 0 3 418.335 4.416 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N(Cc1cccs1)C[C@@H]1CCCO1 ZINC000043231143 848396280 /nfs/dbraw/zinc/39/62/80/848396280.db2.gz KGHJMKPYBWKANF-PKOBYXMFSA-N 0 3 419.616 4.337 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)Nc2cccc(C(=O)N(CC)CC)c2)N(C)C)cc1 ZINC000043499229 848431941 /nfs/dbraw/zinc/43/19/41/848431941.db2.gz XGKQAXGOLHJTPH-JOCHJYFZSA-N 0 3 410.562 4.155 20 0 HIADHN CCN(CC)C(=O)c1cccc(NC(=O)NC[C@@H](c2cccs2)N2CCCC2)c1 ZINC000043499210 848432238 /nfs/dbraw/zinc/43/22/38/848432238.db2.gz RNGJFDDPFLXBIX-IBGZPJMESA-N 0 3 414.575 4.189 20 0 HIADHN Cc1cc(O)c(C(C)C)cc1C(=O)N1CCC[C@H](c2n[nH]cc2CN2CCCC2)C1 ZINC000436732759 861916416 /nfs/dbraw/zinc/91/64/16/861916416.db2.gz ALNMSQMGKGNEGP-SFHVURJKSA-N 0 3 410.562 4.163 20 0 HIADHN CC(C)c1c(C(=O)NC2CCN(Cc3ccccc3)CC2)cnn1-c1ccccc1 ZINC000045054754 848627958 /nfs/dbraw/zinc/62/79/58/848627958.db2.gz RWXNRBUBUYRUIU-UHFFFAOYSA-N 0 3 402.542 4.390 20 0 HIADHN O=C(c1ccccc1[O-])N1CCC([NH2+]Cc2ccc(Br)c(Cl)c2)CC1 ZINC000436749301 861931472 /nfs/dbraw/zinc/93/14/72/861931472.db2.gz JKEKMEZMIHPWOB-UHFFFAOYSA-N 0 3 423.738 4.203 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@@H](C)c1nc2ccccc2[nH]1)c1cccc(OC)c1 ZINC000045595658 848698357 /nfs/dbraw/zinc/69/83/57/848698357.db2.gz GSDNTYPSMNGPOG-HRAATJIYSA-N 0 3 409.534 4.015 20 0 HIADHN CN(C)Cc1ccccc1NC(=O)[C@@H]1CCCN(c2ncccc2C(F)(F)F)C1 ZINC000046787853 848934024 /nfs/dbraw/zinc/93/40/24/848934024.db2.gz IZGRVEGPJASFDE-MRXNPFEDSA-N 0 3 406.452 4.017 20 0 HIADHN CCN(Cc1ccccc1)C(=O)NCCCCN1CCN(c2cccc(C)c2)CC1 ZINC000046867946 848950256 /nfs/dbraw/zinc/95/02/56/848950256.db2.gz LPBBSBJEXVFNDM-UHFFFAOYSA-N 0 3 408.590 4.129 20 0 HIADHN CN(C)Cc1cccc(NC(=O)C[C@H](NC(=O)c2ccccc2)c2ccccc2)c1 ZINC000047452964 849051040 /nfs/dbraw/zinc/05/10/40/849051040.db2.gz HTNDGRBMAQCALV-QHCPKHFHSA-N 0 3 401.510 4.248 20 0 HIADHN CC(C)(C)NC(=O)c1cccc(NC(=O)NC[C@H](c2cccs2)N2CCCC2)c1 ZINC000047586448 849078761 /nfs/dbraw/zinc/07/87/61/849078761.db2.gz TVDVRZRTSHAGGT-GOSISDBHSA-N 0 3 414.575 4.235 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1cccc(C(=O)NC(C)(C)C)c1)c1ccsc1 ZINC000047587279 849079916 /nfs/dbraw/zinc/07/99/16/849079916.db2.gz AEBWHTBKCBAJFG-IBGZPJMESA-N 0 3 416.591 4.481 20 0 HIADHN CN(C)S(=O)(=O)c1ccc(CNCc2ccc(-c3ccccc3F)s2)cc1 ZINC000047771025 849109744 /nfs/dbraw/zinc/10/97/44/849109744.db2.gz WUFITSWAPDIYIC-UHFFFAOYSA-N 0 3 404.532 4.094 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1cc(C(=O)NC2CC2)ccc1C)c1ccsc1 ZINC000047985405 849147518 /nfs/dbraw/zinc/14/75/18/849147518.db2.gz HMGDTDHVKGPSAX-FQEVSTJZSA-N 0 3 414.575 4.153 20 0 HIADHN Cc1ccccc1CN1CCCN(C(=O)Nc2cnc3c(cnn3C(C)C)c2)CC1 ZINC000048062939 849157661 /nfs/dbraw/zinc/15/76/61/849157661.db2.gz ONKSBLRMDRGIKE-UHFFFAOYSA-N 0 3 406.534 4.060 20 0 HIADHN CCOC(=O)/C=C/c1ccc(NC(=O)NC[C@@H](c2cccs2)N2CCCC2)cc1 ZINC000048064913 849158421 /nfs/dbraw/zinc/15/84/21/849158421.db2.gz KZMQEBUSJKDOKK-DLENHJPASA-N 0 3 413.543 4.283 20 0 HIADHN CCNC(=O)c1ccc(NC(=O)NC[C@@H](c2ccsc2)N(CC)CC)c(C)c1 ZINC000048116648 849169607 /nfs/dbraw/zinc/16/96/07/849169607.db2.gz HKIJGAIJWIFRAO-IBGZPJMESA-N 0 3 402.564 4.011 20 0 HIADHN CC[C@H](NCc1ccc(Br)cc1)c1ccccc1OCC(=O)N(C)C ZINC000048750571 849264108 /nfs/dbraw/zinc/26/41/08/849264108.db2.gz NFBCFIGJEZOXSO-SFHVURJKSA-N 0 3 405.336 4.157 20 0 HIADHN COc1cc(CNCC(=O)N(C)Cc2ccccc2)c(-c2ccccc2)cc1OC ZINC000048777337 849266398 /nfs/dbraw/zinc/26/63/98/849266398.db2.gz GSZCMPPPVMEAJN-UHFFFAOYSA-N 0 3 404.510 4.119 20 0 HIADHN O=C(CCCc1ccc2c(c1)-c1ccccc1C2)N1CCCN(C[C@H]2CCCO2)CC1 ZINC000049993123 849337786 /nfs/dbraw/zinc/33/77/86/849337786.db2.gz MYKLBOPVXRZELL-XMMPIXPASA-N 0 3 418.581 4.294 20 0 HIADHN O=C(CCCc1ccc2c(c1)-c1ccccc1C2)N1CCCN(C[C@@H]2CCCO2)CC1 ZINC000049993122 849338370 /nfs/dbraw/zinc/33/83/70/849338370.db2.gz MYKLBOPVXRZELL-DEOSSOPVSA-N 0 3 418.581 4.294 20 0 HIADHN C[C@@H]([NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1)c1ccc(F)c(Br)c1 ZINC000436825629 862007566 /nfs/dbraw/zinc/00/75/66/862007566.db2.gz DXMRCKRXTOEXDQ-CYBMUJFWSA-N 0 3 421.310 4.249 20 0 HIADHN C[C@@H]([NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1)c1ccc(F)cc1OC(F)F ZINC000436830356 862010070 /nfs/dbraw/zinc/01/00/70/862010070.db2.gz QNYKLVOMVFEOHV-CYBMUJFWSA-N 0 3 408.420 4.088 20 0 HIADHN N#CC(C(=O)CCC(=O)c1ccc(-c2ccccc2)cc1)C(=O)NC1CCCCC1 ZINC000050682042 849403300 /nfs/dbraw/zinc/40/33/00/849403300.db2.gz PETXSYNQVSXIPL-QFIPXVFZSA-N 0 3 402.494 4.474 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3cccc(OC(F)F)c3)c(C)c2)CC1 ZINC000051157394 849437521 /nfs/dbraw/zinc/43/75/21/849437521.db2.gz MWMSKDSQJUAZCO-UHFFFAOYSA-N 0 3 404.461 4.382 20 0 HIADHN CCCCCNC(=O)C1CCN(Cc2ccc(C(=O)Nc3ccccc3)cc2)CC1 ZINC000051801089 849516849 /nfs/dbraw/zinc/51/68/49/849516849.db2.gz MCVUBRIBXSIYHF-UHFFFAOYSA-N 0 3 407.558 4.457 20 0 HIADHN CC(C)(C)S(=O)(=O)Cc1ccc(NC(=O)c2cccc(CN3CCCC3)c2)cc1 ZINC000052079138 849548743 /nfs/dbraw/zinc/54/87/43/849548743.db2.gz JOEUICFZTUSKBP-UHFFFAOYSA-N 0 3 414.571 4.248 20 0 HIADHN C[C@@H](c1cccc(NC(=O)c2ccccc2)c1)N1CCC(C(=O)N2CCCC2)CC1 ZINC000052328013 849571505 /nfs/dbraw/zinc/57/15/05/849571505.db2.gz KSPOBZHOVRJBHT-IBGZPJMESA-N 0 3 405.542 4.334 20 0 HIADHN CCOC(=O)N[C@@H]1CCCN(CCC(=O)Nc2ccccc2Oc2ccccc2)C1 ZINC000052869858 849635747 /nfs/dbraw/zinc/63/57/47/849635747.db2.gz NWSAHNJTUYYLQF-GOSISDBHSA-N 0 3 411.502 4.018 20 0 HIADHN CCN(Cc1cc(=O)n2cc(Br)ccc2n1)[C@@H](C)c1ccc(F)cc1 ZINC000053087995 849663793 /nfs/dbraw/zinc/66/37/93/849663793.db2.gz IQGYFWXGQQURJI-ZDUSSCGKSA-N 0 3 404.283 4.179 20 0 HIADHN CC(C)CN(C(=O)CSCc1coc(-c2ccccc2)n1)C1CCN(C)CC1 ZINC000053232724 849682761 /nfs/dbraw/zinc/68/27/61/849682761.db2.gz MTUHVIUKMCPSLH-UHFFFAOYSA-N 0 3 401.576 4.154 20 0 HIADHN CN(Cc1nc2ccccc2s1)C(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000053548464 849730918 /nfs/dbraw/zinc/73/09/18/849730918.db2.gz HVNAFLLDQRAZGM-INIZCTEOSA-N 0 3 400.573 4.336 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N1CCN(c2cccc(Cl)c2)CC1 ZINC000053547816 849731100 /nfs/dbraw/zinc/73/11/00/849731100.db2.gz UQBOFDVGUMJIDX-LJQANCHMSA-N 0 3 418.994 4.070 20 0 HIADHN O=C(Cc1ccc(F)c(Br)c1)NC[C@H](c1cccs1)N1CCCC1 ZINC000054060907 849805437 /nfs/dbraw/zinc/80/54/37/849805437.db2.gz VRCLMAHIEYWBHC-MRXNPFEDSA-N 0 3 411.340 4.146 20 0 HIADHN Cc1nn(-c2ccccc2)c(Cl)c1C(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000054227123 849828573 /nfs/dbraw/zinc/82/85/73/849828573.db2.gz IHAJFQBDNCDUOC-HKUYNNGSSA-N 0 3 408.933 4.399 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)COc2ccc(Oc3ccccn3)cc2)C1 ZINC000054223755 849828862 /nfs/dbraw/zinc/82/88/62/849828862.db2.gz ACKMOYHAFQWKFC-FPOVZHCZSA-N 0 3 417.509 4.204 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)Nc2cccc(N3CCCCC3=O)c2)C1 ZINC000054408666 849861421 /nfs/dbraw/zinc/86/14/21/849861421.db2.gz ZAIOUQIKTPSOGT-NQIIRXRSSA-N 0 3 406.530 4.161 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N(C)Cc2ccc(Br)o2)C1 ZINC000054719810 849912081 /nfs/dbraw/zinc/91/20/81/849912081.db2.gz MCLGNTGGJIGZQD-ZBFHGGJFSA-N 0 3 406.324 4.019 20 0 HIADHN COc1cc(C)c([C@H](C)NC(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)cc1OC ZINC000054719480 849913083 /nfs/dbraw/zinc/91/30/83/849913083.db2.gz MFJCPZONALRBJZ-CMKODMSKSA-N 0 3 411.546 4.208 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)N[C@H]1CCCOc2ccc(F)cc21 ZINC000054784440 849922753 /nfs/dbraw/zinc/92/27/53/849922753.db2.gz COBBQONMORWART-ROUUACIJSA-N 0 3 403.523 4.237 20 0 HIADHN O=S(=O)(c1ccc(CNCc2cccc(OC3CCCC3)c2)cc1)N1CCCC1 ZINC000054808627 849926488 /nfs/dbraw/zinc/92/64/88/849926488.db2.gz RLEFYJGXCGBURC-UHFFFAOYSA-N 0 3 414.571 4.082 20 0 HIADHN C[C@@H](OC[C@H](O)CN1CCC(C(=O)c2ccccc2)CC1)c1ccc(Cl)cc1 ZINC000055471976 850033026 /nfs/dbraw/zinc/03/30/26/850033026.db2.gz RXNQIBAVVPHASO-VGOFRKELSA-N 0 3 401.934 4.373 20 0 HIADHN Cc1c([O-])ccc2c(CNCc3ccccc3C[N@H+]3CCCC[C@H]3C)cc(=O)oc12 ZINC000056156213 850261179 /nfs/dbraw/zinc/26/11/79/850261179.db2.gz ZGIFKVJMSNWJOU-QGZVFWFLSA-N 0 3 406.526 4.471 20 0 HIADHN Cc1c([O-])ccc2c(CNCc3ccccc3C[N@@H+]3CCCC[C@H]3C)cc(=O)oc12 ZINC000056156213 850261186 /nfs/dbraw/zinc/26/11/86/850261186.db2.gz ZGIFKVJMSNWJOU-QGZVFWFLSA-N 0 3 406.526 4.471 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)C2(c3cccc(Cl)c3)CCOCC2)C1 ZINC000056168874 850268232 /nfs/dbraw/zinc/26/82/32/850268232.db2.gz QWEKPFQERBXRLQ-GCJKJVERSA-N 0 3 412.961 4.340 20 0 HIADHN CCN1CCN(c2ccc(N[C@@H](C)C(=O)Nc3ccc(SC)cc3)c(C)c2)CC1 ZINC000056170398 850270312 /nfs/dbraw/zinc/27/03/12/850270312.db2.gz MTZDZHLDWILVDY-SFHVURJKSA-N 0 3 412.603 4.298 20 0 HIADHN CCN1CCN(c2ccc(N[C@@H](C)C(=O)N[C@H](C)c3ccccc3C)c(C)c2)CC1 ZINC000056170382 850270491 /nfs/dbraw/zinc/27/04/91/850270491.db2.gz FIVYMTMTKGNNSL-RTWAWAEBSA-N 0 3 408.590 4.123 20 0 HIADHN Cc1ccc(NC(=O)[C@@H](NC2CCN(Cc3ccccn3)CC2)c2ccccc2)cc1 ZINC000056182699 850274674 /nfs/dbraw/zinc/27/46/74/850274674.db2.gz KKNZAZZRENNZJB-VWLOTQADSA-N 0 3 414.553 4.324 20 0 HIADHN CC(C)[C@H](NC(=O)Cc1ccc2ccccc2c1)C(=O)Nc1cccc(CN(C)C)c1 ZINC000056395026 850347007 /nfs/dbraw/zinc/34/70/07/850347007.db2.gz IDBISHWKBGXZLY-VWLOTQADSA-N 0 3 417.553 4.223 20 0 HIADHN CC[C@H](CNC(=O)Nc1ccc(C)c(NC(C)=O)c1C)N1CCc2ccccc2C1 ZINC000056690938 850440153 /nfs/dbraw/zinc/44/01/53/850440153.db2.gz PRVHVWQXHOKREI-OAQYLSRUSA-N 0 3 408.546 4.220 20 0 HIADHN CCN(CC)C(=O)c1ccccc1NC(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000056754127 850468264 /nfs/dbraw/zinc/46/82/64/850468264.db2.gz AHZSHNZQAULNQV-AZUAARDMSA-N 0 3 408.546 4.126 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)Nc1ccccc1OC[C@@H]1CCCCO1 ZINC000056784590 850481166 /nfs/dbraw/zinc/48/11/66/850481166.db2.gz UFPWRBSOCMDKNM-NRFANRHFSA-N 0 3 411.546 4.230 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N[C@H]1CCOc2c(Cl)cccc21 ZINC000056804645 850488792 /nfs/dbraw/zinc/48/87/92/850488792.db2.gz WFHYACLGRHBOET-DLBZAZTESA-N 0 3 405.951 4.361 20 0 HIADHN O=C(NCCCCN1CCN(Cc2ccccc2)CC1)c1ccccc1C(F)(F)F ZINC000056993636 850531061 /nfs/dbraw/zinc/53/10/61/850531061.db2.gz NNFYNGPYAVTEGB-UHFFFAOYSA-N 0 3 419.491 4.033 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)N[C@H](c3ccccc3)C3CC3)CC2)c1 ZINC000057590779 850675846 /nfs/dbraw/zinc/67/58/46/850675846.db2.gz WCSYLXMSZKIXOZ-RUZDIDTESA-N 0 3 420.601 4.348 20 0 HIADHN COc1ccc(CN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)[C@H](C)C2CC2)cc1 ZINC000057601838 850677561 /nfs/dbraw/zinc/67/75/61/850677561.db2.gz BRTOZIIGIFXWIY-LJQANCHMSA-N 0 3 409.574 4.020 20 0 HIADHN CC[C@H](NC(=O)NC[C@@H](c1ccc(OC)cc1)N1CCCC1)c1ccc(OC)cc1 ZINC000057769036 850711594 /nfs/dbraw/zinc/71/15/94/850711594.db2.gz LJYXDOKMMNRPBA-GOTSBHOMSA-N 0 3 411.546 4.291 20 0 HIADHN COc1ccc([C@H](CNC(=O)N[C@H]2CCSc3ccccc32)N2CCCC2)cc1 ZINC000057769058 850711650 /nfs/dbraw/zinc/71/16/50/850711650.db2.gz KGWUPILNEPQJGG-SFTDATJTSA-N 0 3 411.571 4.368 20 0 HIADHN COc1cc(Br)c(CNCC(C)(C)c2ccc3c(c2)OCO3)cc1OC ZINC000058476369 850834774 /nfs/dbraw/zinc/83/47/74/850834774.db2.gz LDDYMOSQAPFECS-UHFFFAOYSA-N 0 3 422.319 4.262 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Cc1ccc(C(F)(F)F)cc1)c1cccc(OC)c1 ZINC000058582162 850861047 /nfs/dbraw/zinc/86/10/47/850861047.db2.gz FEAPHKFPXFXIIA-FQEVSTJZSA-N 0 3 408.464 4.456 20 0 HIADHN CC1CCN([C@@H](CNC(=O)N2CCC[C@@H]2c2cccn2C)c2cccs2)CC1 ZINC000059264375 850989463 /nfs/dbraw/zinc/98/94/63/850989463.db2.gz YNPBKQDMAPCHSF-UXHICEINSA-N 0 3 400.592 4.406 20 0 HIADHN CCN(C[C@@H]1COc2ccccc2O1)C(=O)NC[C@H](c1ccsc1)N(CC)CC ZINC000059308172 850995200 /nfs/dbraw/zinc/99/52/00/850995200.db2.gz GRKNMLYULJOUTE-RTBURBONSA-N 0 3 417.575 4.003 20 0 HIADHN O=C(CN(CC1CCCCC1)C1CC1)N1c2ccccc2NC(=O)C[C@H]1C(F)(F)F ZINC000059391131 851003028 /nfs/dbraw/zinc/00/30/28/851003028.db2.gz FORRHJPNQFNMLB-IBGZPJMESA-N 0 3 423.479 4.337 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)c1ccc(SC(F)F)cc1 ZINC000059580174 851007733 /nfs/dbraw/zinc/00/77/33/851007733.db2.gz CABFKUHCKSUTOA-UHFFFAOYSA-N 0 3 419.541 4.334 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)C2(c3ccc(Br)cc3)CC2)N(C)C)cc1 ZINC000060155889 851046575 /nfs/dbraw/zinc/04/65/75/851046575.db2.gz GQLQXRGLLWLRKG-LJQANCHMSA-N 0 3 401.348 4.208 20 0 HIADHN C[C@@H]1C[C@@H]1C(=O)Nc1cccc(C(=O)N2CCCN(CCCc3ccccc3)CC2)c1 ZINC000060355324 851075467 /nfs/dbraw/zinc/07/54/67/851075467.db2.gz VFGJVUHXNXKGLI-YKSBVNFPSA-N 0 3 419.569 4.062 20 0 HIADHN O=C(c1cc(-c2ccco2)n(-c2cccc(Cl)c2)n1)N1CC[C@H](N2CCCC2)C1 ZINC000060374172 851081914 /nfs/dbraw/zinc/08/19/14/851081914.db2.gz DMXQGERETKPWOW-SFHVURJKSA-N 0 3 410.905 4.096 20 0 HIADHN O=C(CCN1CCC(C(=O)c2ccc(Cl)cc2)CC1)N1CCc2sccc2C1 ZINC000060482006 851114830 /nfs/dbraw/zinc/11/48/30/851114830.db2.gz BWGFKFRWLWXKJZ-UHFFFAOYSA-N 0 3 416.974 4.271 20 0 HIADHN CNC(=O)c1ccc(CNCc2cn(-c3ccccc3)nc2-c2ccccc2C)cc1 ZINC000060523960 851133585 /nfs/dbraw/zinc/13/35/85/851133585.db2.gz IHZAYWPXMWFGHK-UHFFFAOYSA-N 0 3 410.521 4.497 20 0 HIADHN CC(C)(C)OC(=O)Nc1ccc(C(=O)N2CCN(CC3CCCCC3)CC2)cc1 ZINC000060579646 851154307 /nfs/dbraw/zinc/15/43/07/851154307.db2.gz LBISXIRSVXUJSG-UHFFFAOYSA-N 0 3 401.551 4.372 20 0 HIADHN O=C(Nc1cccc(C(=O)N2CCN(CC3CCCCC3)CC2)c1)c1cccs1 ZINC000060579572 851154920 /nfs/dbraw/zinc/15/49/20/851154920.db2.gz JIYVIEWMPFTVPD-UHFFFAOYSA-N 0 3 411.571 4.339 20 0 HIADHN CN1CCN(Cc2ccc(CNc3nc(-c4ccncc4)nc4ccccc43)cc2)CC1 ZINC000060741750 851201503 /nfs/dbraw/zinc/20/15/03/851201503.db2.gz UGUWYCINIPSZCY-UHFFFAOYSA-N 0 3 424.552 4.051 20 0 HIADHN COc1cc(CNCc2ccc(OC(F)F)cc2)cc(Br)c1OC ZINC000060832834 851226154 /nfs/dbraw/zinc/22/61/54/851226154.db2.gz ZYUMQWZQLRECFX-UHFFFAOYSA-N 0 3 402.235 4.358 20 0 HIADHN COc1ccc2cc(CNCc3ccc(S(=O)(=O)N4CCCCC4)cc3)ccc2c1 ZINC000061028967 851278524 /nfs/dbraw/zinc/27/85/24/851278524.db2.gz QWQCOFJGYVSVJE-UHFFFAOYSA-N 0 3 424.566 4.313 20 0 HIADHN Cc1ccc(Cn2nccc2NC(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)cc1 ZINC000061134465 851300887 /nfs/dbraw/zinc/30/08/87/851300887.db2.gz VYVRHNREYSMURM-UHFFFAOYSA-N 0 3 417.557 4.023 20 0 HIADHN CCc1ccc([C@H](CNC(=O)NCc2cccc(NC(=O)C3CCC3)c2)N(C)C)cc1 ZINC000061223356 851321730 /nfs/dbraw/zinc/32/17/30/851321730.db2.gz LKPANXYKSYQDTN-QHCPKHFHSA-N 0 3 422.573 4.090 20 0 HIADHN CC(=O)Nc1ccc(Cl)cc1NC(=O)c1ccc(N2CCN(C(C)C)CC2)cc1 ZINC000061228104 851323048 /nfs/dbraw/zinc/32/30/48/851323048.db2.gz BKBUWKBHLJEEJP-UHFFFAOYSA-N 0 3 414.937 4.081 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000061289474 851339176 /nfs/dbraw/zinc/33/91/76/851339176.db2.gz RKOCYKKXJRUTQF-UHFFFAOYSA-N 0 3 405.907 4.092 20 0 HIADHN O=C(/C=C/c1ccc2ccccc2n1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000061289205 851339205 /nfs/dbraw/zinc/33/92/05/851339205.db2.gz PHILHSVGOKHULU-VAWYXSNFSA-N 0 3 403.551 4.478 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2cccc(NC(=O)C3CC3)c2)N2CCCC2)cc1 ZINC000061749550 851438910 /nfs/dbraw/zinc/43/89/10/851438910.db2.gz HGIBEDGNCDOFDY-QFIPXVFZSA-N 0 3 406.530 4.302 20 0 HIADHN CCOc1ccc(CN(C)C(=O)Nc2ccc(CCN3CCSCC3)cc2)cc1 ZINC000061792414 851453940 /nfs/dbraw/zinc/45/39/40/851453940.db2.gz JDZMOJIVVSFPBB-UHFFFAOYSA-N 0 3 413.587 4.341 20 0 HIADHN CC[C@@H](CNC(=O)NCc1ccc(Br)s1)N1CCc2ccccc2C1 ZINC000061953693 851478535 /nfs/dbraw/zinc/47/85/35/851478535.db2.gz VUPGOHMQIIAWJB-INIZCTEOSA-N 0 3 422.392 4.147 20 0 HIADHN CCCC(=O)Nc1cccc(CNC(=O)NC[C@H](CC)N2CCc3ccccc3C2)c1 ZINC000061953526 851478790 /nfs/dbraw/zinc/47/87/90/851478790.db2.gz BEYMHPKDQCBDKF-QHCPKHFHSA-N 0 3 422.573 4.061 20 0 HIADHN Cc1cc([C@@H](C)NC(=O)NCCCN2CCN(C)C[C@H]2c2ccccc2)c(C)s1 ZINC000061965363 851482413 /nfs/dbraw/zinc/48/24/13/851482413.db2.gz YXCVALJTVPZTQB-GCJKJVERSA-N 0 3 414.619 4.104 20 0 HIADHN Cc1cc(Br)ccc1NC(=O)N(CCN(C)C)Cc1cccc(F)c1 ZINC000062376582 851534022 /nfs/dbraw/zinc/53/40/22/851534022.db2.gz MIXJYASVAVTKLN-UHFFFAOYSA-N 0 3 408.315 4.492 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)NCCc1ccccc1F ZINC000062475230 851558791 /nfs/dbraw/zinc/55/87/91/851558791.db2.gz HFIACLMZOFFBKW-UHFFFAOYSA-N 0 3 411.443 4.160 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)NCCCSc1ccccc1 ZINC000062474310 851559204 /nfs/dbraw/zinc/55/92/04/851559204.db2.gz ZNHAQVJCBIKHPV-UHFFFAOYSA-N 0 3 407.530 4.220 20 0 HIADHN CC(C)Oc1ccc(CNC(=O)N(CCN(C)C)Cc2ccc(F)cc2F)cc1 ZINC000062478716 851560339 /nfs/dbraw/zinc/56/03/39/851560339.db2.gz JHXLQTCQIXRGKY-UHFFFAOYSA-N 0 3 405.489 4.025 20 0 HIADHN CC(C)Oc1ccccc1CNC(=O)N(CCN(C)C)Cc1ccc(F)c(F)c1 ZINC000062498980 851566238 /nfs/dbraw/zinc/56/62/38/851566238.db2.gz LQOMKGOPSNYRDN-UHFFFAOYSA-N 0 3 405.489 4.025 20 0 HIADHN Cc1ccc([C@H](CNC(=O)NCc2ccc(COCC(F)(F)F)cc2)N(C)C)cc1 ZINC000062650862 851585141 /nfs/dbraw/zinc/58/51/41/851585141.db2.gz CRIHZIHZYARNGU-FQEVSTJZSA-N 0 3 423.479 4.176 20 0 HIADHN S=C(NC1CCN(Cc2ccccc2)CC1)N(Cc1ccco1)Cc1ccco1 ZINC000063144433 851620078 /nfs/dbraw/zinc/62/00/78/851620078.db2.gz LDBHLFMTFMFDSG-UHFFFAOYSA-N 0 3 409.555 4.414 20 0 HIADHN COC(=O)c1cc(NC(=S)NC2CCN(Cc3ccccc3)CC2)ccc1Cl ZINC000063147582 851621482 /nfs/dbraw/zinc/62/14/82/851621482.db2.gz IWVZGZVACOQAIO-UHFFFAOYSA-N 0 3 417.962 4.078 20 0 HIADHN Fc1ccc(CN(C(=S)NC2CCN(Cc3ccccc3)CC2)C2CC2)c(F)c1 ZINC000063149724 851623442 /nfs/dbraw/zinc/62/34/42/851623442.db2.gz ISMVOTJPVQEQSY-UHFFFAOYSA-N 0 3 415.553 4.468 20 0 HIADHN C=CCN(Cc1ccc(OC)cc1)C(=S)NC1CCN(Cc2ccccc2)CC1 ZINC000063150166 851623528 /nfs/dbraw/zinc/62/35/28/851623528.db2.gz PVNBOWOBLALTAH-UHFFFAOYSA-N 0 3 409.599 4.222 20 0 HIADHN Cc1cccn2cc(COc3ccc(CNCc4ccnc(-n5cccn5)c4)cc3)nc12 ZINC000063313175 851658569 /nfs/dbraw/zinc/65/85/69/851658569.db2.gz CPZIZCFJSCGRQD-UHFFFAOYSA-N 0 3 424.508 4.092 20 0 HIADHN Cc1cccn2cc(COc3ccc(CNCc4cccnc4-n4ccnc4)cc3)nc12 ZINC000063313181 851658658 /nfs/dbraw/zinc/65/86/58/851658658.db2.gz FPNIYHDMKVNBBE-UHFFFAOYSA-N 0 3 424.508 4.092 20 0 HIADHN COc1ccccc1C(C)(C)CNC(=O)N(CCN(C)C)Cc1ccc(F)c(F)c1 ZINC000063408306 851682104 /nfs/dbraw/zinc/68/21/04/851682104.db2.gz HTNNNMDJURVMMX-UHFFFAOYSA-N 0 3 419.516 4.024 20 0 HIADHN CC(C)(C)OC(=O)NC[C@@H]1CCCN(Cc2cc(=O)oc3cc4c(cc23)CCC4)C1 ZINC000063626485 851728637 /nfs/dbraw/zinc/72/86/37/851728637.db2.gz GTAHDMHWQXHLOT-INIZCTEOSA-N 0 3 412.530 4.018 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)c1ccc(Br)c(F)c1 ZINC000063704822 851744018 /nfs/dbraw/zinc/74/40/18/851744018.db2.gz KRBURLPAORNGOY-UHFFFAOYSA-N 0 3 407.327 4.225 20 0 HIADHN Cc1cc(NC(=O)c2cccc(F)c2)sc1C(=O)N1CCCN(C(C)(C)C)CC1 ZINC000063722522 851748307 /nfs/dbraw/zinc/74/83/07/851748307.db2.gz RJUVQTNJMNFBAO-UHFFFAOYSA-N 0 3 417.550 4.394 20 0 HIADHN CCOc1ccc(-c2nc(C)c(C(=O)N3CCCN(C(C)(C)C)CC3)s2)cc1 ZINC000063722997 851749251 /nfs/dbraw/zinc/74/92/51/851749251.db2.gz MWKOQIQTZQBLJF-UHFFFAOYSA-N 0 3 401.576 4.464 20 0 HIADHN C[C@@H](CC(=O)NCCCCN1CCN(c2cccc(C(F)(F)F)c2)CC1)C1CC1 ZINC000063733640 851750295 /nfs/dbraw/zinc/75/02/95/851750295.db2.gz JMIJRJOMQRVCIK-KRWDZBQOSA-N 0 3 411.512 4.160 20 0 HIADHN COc1ccc([C@H](CNC(=O)NCc2cccc3ccccc32)N2CCCC2)cc1 ZINC000063798417 851767673 /nfs/dbraw/zinc/76/76/73/851767673.db2.gz RRMMKNYYJAQVDS-DEOSSOPVSA-N 0 3 403.526 4.485 20 0 HIADHN COc1ccc(NC(=O)c2cccc(CN3CCCC3)c2)cc1N1CCCCC1=O ZINC000063915817 851793874 /nfs/dbraw/zinc/79/38/74/851793874.db2.gz KEMXWGZDHXANLS-UHFFFAOYSA-N 0 3 407.514 4.060 20 0 HIADHN C[C@H](C(=O)Nc1ccc(N2CCCCC2)cc1)N1CCN(CC2CCCCC2)CC1 ZINC000064129827 851833384 /nfs/dbraw/zinc/83/33/84/851833384.db2.gz PRODDSAAFRRATI-OAQYLSRUSA-N 0 3 412.622 4.202 20 0 HIADHN CCN(Cc1ccc2c(c1)OCO2)C(=O)NC[C@@H](c1ccc(C)cc1)N1CCCC1 ZINC000064237544 851855051 /nfs/dbraw/zinc/85/50/51/851855051.db2.gz HJWFWTHGPFIJEO-NRFANRHFSA-N 0 3 409.530 4.092 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2cnn(Cc3ccccc3)c2)N2CCCC2)cc1 ZINC000064237119 851855262 /nfs/dbraw/zinc/85/52/62/851855262.db2.gz PEVOFDVQSZOBGW-QHCPKHFHSA-N 0 3 403.530 4.198 20 0 HIADHN COCCOc1ccccc1NC(=O)NC[C@H](c1cccs1)N1CCC(C)CC1 ZINC000064240725 851856097 /nfs/dbraw/zinc/85/60/97/851856097.db2.gz ODOJCBJWISELBW-LJQANCHMSA-N 0 3 417.575 4.368 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=S)NCc1cccs1 ZINC000064371352 851880635 /nfs/dbraw/zinc/88/06/35/851880635.db2.gz OKEQTSOOSRRCHQ-UHFFFAOYSA-N 0 3 401.523 4.205 20 0 HIADHN COc1ccc(CNC(=O)CNCc2ccc(-c3cccc(Cl)c3)s2)cc1 ZINC000064410860 851891361 /nfs/dbraw/zinc/89/13/61/851891361.db2.gz RFEPJKXXPVYTFQ-UHFFFAOYSA-N 0 3 400.931 4.483 20 0 HIADHN COc1ccc(O[C@H](C)C(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)cc1 ZINC000064470555 851905830 /nfs/dbraw/zinc/90/58/30/851905830.db2.gz IXUVVURVMZAZAT-MRXNPFEDSA-N 0 3 424.463 4.072 20 0 HIADHN O=C(c1ccc(Cl)cc1)N1CCCN(CCCOCCc2ccccc2)CC1 ZINC000064481547 851910996 /nfs/dbraw/zinc/91/09/96/851910996.db2.gz VYQOSSKNNXKZFU-UHFFFAOYSA-N 0 3 400.950 4.137 20 0 HIADHN CN(C)c1nc2sc(C(=O)NC[C@H]3CCCN(Cc4cccs4)C3)cc2s1 ZINC000064521115 851918606 /nfs/dbraw/zinc/91/86/06/851918606.db2.gz PXSLVCYARMVODN-CYBMUJFWSA-N 0 3 420.629 4.127 20 0 HIADHN CSc1ccc(Cl)cc1NC(=O)NCc1ccc(CN2CCN(C)CC2)cc1 ZINC000064562816 851930403 /nfs/dbraw/zinc/93/04/03/851930403.db2.gz QMRHLQKINVLPBX-UHFFFAOYSA-N 0 3 418.994 4.131 20 0 HIADHN Cc1c2cc(F)ccc2sc1C(=O)NCc1ccc(CN2CCN(C)CC2)cc1 ZINC000064730495 851969823 /nfs/dbraw/zinc/96/98/23/851969823.db2.gz XTZSHLWZTHKGCW-UHFFFAOYSA-N 0 3 411.546 4.026 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)c1cc(-c2cccc(Cl)c2)on1 ZINC000064748098 851975670 /nfs/dbraw/zinc/97/56/70/851975670.db2.gz SXUUKFJFYYFENF-UHFFFAOYSA-N 0 3 401.869 4.338 20 0 HIADHN Cc1cccn2c(=O)cc(CN(Cc3ccc4c(c3)OCO4)C3CCCCC3)nc12 ZINC000064805586 851988459 /nfs/dbraw/zinc/98/84/59/851988459.db2.gz LRNRCQAKONWCAL-UHFFFAOYSA-N 0 3 405.498 4.067 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cnn(C(C)(C)C)c1)c1ccc(C(F)(F)F)cc1 ZINC000065121626 852070717 /nfs/dbraw/zinc/07/07/17/852070717.db2.gz JCOSMSVCTLFGNF-SFHVURJKSA-N 0 3 410.484 4.470 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2ccc(Oc3ncccn3)cc2C)N(C)C)cc1 ZINC000065419589 852127014 /nfs/dbraw/zinc/12/70/14/852127014.db2.gz BWSHGKKXYWYXDO-OAQYLSRUSA-N 0 3 405.502 4.310 20 0 HIADHN COc1cc(OC)cc(Oc2ccc(CNCc3ccnc(-n4cccn4)c3)cc2)c1 ZINC000065428824 852128921 /nfs/dbraw/zinc/12/89/21/852128921.db2.gz YYNHJLLBYJUJDE-UHFFFAOYSA-N 0 3 416.481 4.367 20 0 HIADHN COc1ccc(CN(C)C(=O)CN(Cc2ccccc2)C2CCCCC2)cc1OC ZINC000065432013 852130127 /nfs/dbraw/zinc/13/01/27/852130127.db2.gz DLKRQHCFNYVKIQ-UHFFFAOYSA-N 0 3 410.558 4.497 20 0 HIADHN CC[C@@H](C)C(=O)Nc1cccc(CNC(=O)NC[C@@H](c2ccc(C)cc2)N(C)C)c1 ZINC000065468249 852144639 /nfs/dbraw/zinc/14/46/39/852144639.db2.gz MYNXUWDCUVUEBU-GCJKJVERSA-N 0 3 410.562 4.082 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N[C@@H](c2ccc3c(c2)OCCO3)C(C)C)N(C)C)cc1 ZINC000065470366 852145409 /nfs/dbraw/zinc/14/54/09/852145409.db2.gz FNWVBVKCZKNTMU-NZQKXSOJSA-N 0 3 411.546 4.065 20 0 HIADHN Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)N1CCN(CCC(C)(C)C)CC1 ZINC000065479883 852151354 /nfs/dbraw/zinc/15/13/54/852151354.db2.gz RWWNACWQDCDTAK-UHFFFAOYSA-N 0 3 414.594 4.253 20 0 HIADHN COc1ccc([C@H](NC(=O)NCCN(C)Cc2ccccc2)c2ccccc2)cc1 ZINC000065541562 852171670 /nfs/dbraw/zinc/17/16/70/852171670.db2.gz WXWLLUBYZBOMAX-XMMPIXPASA-N 0 3 403.526 4.216 20 0 HIADHN CN(C)CCN(C(=O)c1ccc(CNC(=O)c2cccs2)cc1)C1CCCCC1 ZINC000065746499 852243572 /nfs/dbraw/zinc/24/35/72/852243572.db2.gz GSBXHBUVCKYRKY-UHFFFAOYSA-N 0 3 413.587 4.015 20 0 HIADHN COCCOc1cc(C)ccc1NC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000065873427 852296348 /nfs/dbraw/zinc/29/63/48/852296348.db2.gz ZACRFFJJRQHKOO-IBGZPJMESA-N 0 3 400.494 4.010 20 0 HIADHN O=C(Nc1cccc(C(=O)N2CCCCC2)c1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000065873733 852296438 /nfs/dbraw/zinc/29/64/38/852296438.db2.gz YCQGYDDIOUDUBD-NRFANRHFSA-N 0 3 423.532 4.303 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccc(F)c2)C1)N1CCC(c2c[nH]c3ncccc23)CC1 ZINC000065880287 852299598 /nfs/dbraw/zinc/29/95/98/852299598.db2.gz YPIGMOJXYAQBID-HXUWFJFHSA-N 0 3 420.532 4.320 20 0 HIADHN CN(CCCc1nc2ccccc2[nH]1)C(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000065899650 852308235 /nfs/dbraw/zinc/30/82/35/852308235.db2.gz AUOSTGSPIKTTNJ-LJQANCHMSA-N 0 3 408.521 4.005 20 0 HIADHN O=C(CCNCc1ccc(-c2ccc(C(F)(F)F)cc2)o1)NCc1cccnc1 ZINC000065935518 852323997 /nfs/dbraw/zinc/32/39/97/852323997.db2.gz FKIIHHQPBFYELB-UHFFFAOYSA-N 0 3 403.404 4.157 20 0 HIADHN CC(=O)Nc1cc(C(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)ccc1C ZINC000065936390 852324972 /nfs/dbraw/zinc/32/49/72/852324972.db2.gz ULWIWBFYQKAJDN-UHFFFAOYSA-N 0 3 421.463 4.176 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)CSc1nc2ccccc2o1 ZINC000065936928 852324988 /nfs/dbraw/zinc/32/49/88/852324988.db2.gz WFBGEQPBVOILLD-UHFFFAOYSA-N 0 3 403.935 4.164 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)CCc1ncc(-c2ccccc2)o1 ZINC000065937840 852325988 /nfs/dbraw/zinc/32/59/88/852325988.db2.gz UKPMCHOJCWFMDC-UHFFFAOYSA-N 0 3 413.468 4.143 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)CCc1ccc(-c2ccccc2)[nH]1 ZINC000065938397 852326062 /nfs/dbraw/zinc/32/60/62/852326062.db2.gz VYWJOKQBRMWAAV-UHFFFAOYSA-N 0 3 411.496 4.483 20 0 HIADHN COc1ccc2c(c1)CCC[C@@H]2CC(=O)N(CCN(C)C)Cc1ccc(F)c(F)c1 ZINC000065938353 852326445 /nfs/dbraw/zinc/32/64/45/852326445.db2.gz MLGQULGXGXIHEO-LJQANCHMSA-N 0 3 416.512 4.374 20 0 HIADHN COCc1c2ccccc2oc1C(=O)N(CCN(C)C)Cc1ccc(F)c(F)c1 ZINC000065938660 852327770 /nfs/dbraw/zinc/32/77/70/852327770.db2.gz BUUWVJGFSJLNQR-UHFFFAOYSA-N 0 3 402.441 4.061 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)Cc1csc(Cc2ccccc2)n1 ZINC000065939579 852327926 /nfs/dbraw/zinc/32/79/26/852327926.db2.gz VDNZFVUKUUHENF-UHFFFAOYSA-N 0 3 411.546 4.006 20 0 HIADHN CN1CCN(Cc2ccc(CNC(=O)c3sccc3-c3ccc(F)cc3)cc2)CC1 ZINC000066046132 852363405 /nfs/dbraw/zinc/36/34/05/852363405.db2.gz ILRFCGHTVWOEHS-UHFFFAOYSA-N 0 3 423.557 4.232 20 0 HIADHN O=C(CCc1nc2ccccc2n1-c1ccccc1)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000069274265 852391076 /nfs/dbraw/zinc/39/10/76/852391076.db2.gz JBFSIKVQDRDKQP-JOCHJYFZSA-N 0 3 424.548 4.349 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2C(=O)NC[C@@H](c2ccccc2)N(C)C)o1 ZINC000069344209 852393024 /nfs/dbraw/zinc/39/30/24/852393024.db2.gz NURWOORKRDAAMW-QFIPXVFZSA-N 0 3 414.509 4.473 20 0 HIADHN O=C(CSc1ccc(C(F)(F)F)cn1)N[C@H](CN1CCCC1)c1ccccc1 ZINC000071851440 852418906 /nfs/dbraw/zinc/41/89/06/852418906.db2.gz YLLQDYCVCGYKQY-QGZVFWFLSA-N 0 3 409.477 4.146 20 0 HIADHN CC1CCN([C@@H](CNC(=O)c2ccc(NC(=O)C3CC3)cc2)c2ccccc2)CC1 ZINC000072006487 852460916 /nfs/dbraw/zinc/46/09/16/852460916.db2.gz YXUCICXYHQCJDG-QHCPKHFHSA-N 0 3 405.542 4.238 20 0 HIADHN CCN(C(=O)c1cc(OC)c(OC)c(OC)c1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000072014721 852467186 /nfs/dbraw/zinc/46/71/86/852467186.db2.gz BKMJYGJFPWHXGR-FXAWDEMLSA-N 0 3 412.530 4.010 20 0 HIADHN Cc1nn(C)c2sc(C(=O)N(CCN(C)C)Cc3cccc(C(F)(F)F)c3)cc12 ZINC000072045821 852484874 /nfs/dbraw/zinc/48/48/74/852484874.db2.gz JIDIWUOFDKMYSP-UHFFFAOYSA-N 0 3 424.492 4.166 20 0 HIADHN O=C(Nc1cnn(-c2ccccc2)c1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000072068969 852493866 /nfs/dbraw/zinc/49/38/66/852493866.db2.gz JMNOVNKKIMZJPZ-OAQYLSRUSA-N 0 3 414.431 4.265 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)Cc1c[nH]c2cc(Cl)ccc12 ZINC000072094499 852507512 /nfs/dbraw/zinc/50/75/12/852507512.db2.gz YUGYSBAJEWZLPA-UHFFFAOYSA-N 0 3 405.876 4.232 20 0 HIADHN CN(C(=O)OC(C)(C)C)C1CCN(CCOc2cccc(Br)c2)CC1 ZINC000078656591 852523139 /nfs/dbraw/zinc/52/31/39/852523139.db2.gz MARONKKYSUJAFI-UHFFFAOYSA-N 0 3 413.356 4.159 20 0 HIADHN O=C(NCCCNc1ccccc1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000078779778 852530158 /nfs/dbraw/zinc/53/01/58/852530158.db2.gz RDMZMOXQWFNCNP-NRFANRHFSA-N 0 3 405.464 4.059 20 0 HIADHN CC[C@@H](CNC(=O)Nc1c(C)nn(-c2ccccc2)c1C)N1CCc2ccccc2C1 ZINC000097307374 852600544 /nfs/dbraw/zinc/60/05/44/852600544.db2.gz QJLFMZVAHNMKIJ-QFIPXVFZSA-N 0 3 417.557 4.448 20 0 HIADHN O=S(=O)(c1ccc(CN(CCc2ccc(Cl)cc2)CC2CC2)o1)N1CCCC1 ZINC000097574276 852635196 /nfs/dbraw/zinc/63/51/96/852635196.db2.gz FNXLGECPFBIEEU-UHFFFAOYSA-N 0 3 422.978 4.172 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)c3ccc(SC(F)F)cc3)cc2)CC1 ZINC000107592609 852779811 /nfs/dbraw/zinc/77/98/11/852779811.db2.gz QWQNSRZYJDKHKE-UHFFFAOYSA-N 0 3 405.514 4.391 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)[C@@H]1C[C@H]1c1ccccc1Cl ZINC000108470356 852854496 /nfs/dbraw/zinc/85/44/96/852854496.db2.gz ORURXKLFGCWFNJ-FCHUYYIVSA-N 0 3 411.977 4.162 20 0 HIADHN O=C(Cc1ccc2ccccc2c1)NCCCCN1CCN(Cc2ccccc2)CC1 ZINC000108485212 852855574 /nfs/dbraw/zinc/85/55/74/852855574.db2.gz WVXBFQVONFYLIS-UHFFFAOYSA-N 0 3 415.581 4.097 20 0 HIADHN Cc1c2cc(Br)ccc2oc1C(=O)NCCN(C)Cc1ccccc1 ZINC000108774971 852878204 /nfs/dbraw/zinc/87/82/04/852878204.db2.gz UWMJHSOJFFCKSX-UHFFFAOYSA-N 0 3 401.304 4.366 20 0 HIADHN Cc1ccc(C)c(OC2CCN(C(=O)N[C@@H]3CCN(Cc4ccccc4)C3)CC2)c1 ZINC000108921102 852892471 /nfs/dbraw/zinc/89/24/71/852892471.db2.gz YSPBJFKFRMCTHE-JOCHJYFZSA-N 0 3 407.558 4.131 20 0 HIADHN Cc1c([O-])ccc2c(C[NH2+]CC3(c4ccc(Cl)cc4)CCOCC3)cc(=O)oc12 ZINC000108967857 852900747 /nfs/dbraw/zinc/90/07/47/852900747.db2.gz FLBACGQSQACJGV-UHFFFAOYSA-N 0 3 413.901 4.298 20 0 HIADHN COc1ccc2[nH]cc(C3CCN([C@H](C)C(=O)NCCc4ccc(F)cc4)CC3)c2c1 ZINC000108971728 852901722 /nfs/dbraw/zinc/90/17/22/852901722.db2.gz JPESBZNXHPUHBW-QGZVFWFLSA-N 0 3 423.532 4.242 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)Nc3ccc(OC(F)(F)F)cc3)cc2)CC1 ZINC000109189186 852933063 /nfs/dbraw/zinc/93/30/63/852933063.db2.gz YZSHZONGBOAKLG-UHFFFAOYSA-N 0 3 407.436 4.368 20 0 HIADHN O=C(NCc1ccc(Br)cc1Cl)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000109258329 852944453 /nfs/dbraw/zinc/94/44/53/852944453.db2.gz FFXKLBHPXLZEJB-KRWDZBQOSA-N 0 3 422.754 4.176 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2ccc(CNC(=O)c3cccs3)cc2)N(C)C)cc1 ZINC000109289345 852947498 /nfs/dbraw/zinc/94/74/98/852947498.db2.gz WGFUHMGBPVPOED-OAQYLSRUSA-N 0 3 421.566 4.019 20 0 HIADHN Cc1nc2c(cnn2C(C)C)cc1C(=O)NC[C@@H]1CCCCN1Cc1ccccc1 ZINC000109303768 852949546 /nfs/dbraw/zinc/94/95/46/852949546.db2.gz UXKPHZZYUITXGP-NRFANRHFSA-N 0 3 405.546 4.105 20 0 HIADHN O=C(NCc1cc(Br)cs1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000109347442 852956346 /nfs/dbraw/zinc/95/63/46/852956346.db2.gz WRAWNMSXHKXKGW-CQSZACIVSA-N 0 3 411.340 4.178 20 0 HIADHN COc1ccc(-c2cnc(CCC(=O)N[C@H]3CCCN(Cc4ccccc4)C3)o2)cc1 ZINC000109423032 852969911 /nfs/dbraw/zinc/96/99/11/852969911.db2.gz KSFCWRHACZDJOX-NRFANRHFSA-N 0 3 419.525 4.064 20 0 HIADHN COc1ccccc1NC(=O)c1ccc(NC(=O)[C@H](C)N(C)CC2CCCC2)cc1 ZINC000109423163 852969989 /nfs/dbraw/zinc/96/99/89/852969989.db2.gz HLFCGBHPPDPCSR-KRWDZBQOSA-N 0 3 409.530 4.397 20 0 HIADHN Cc1nc2ccc(C(=O)Nc3ccc(CCN4CCSCC4)cc3)cc2nc1C ZINC000109500182 852978157 /nfs/dbraw/zinc/97/81/57/852978157.db2.gz DYFDEOPCXXUDCZ-UHFFFAOYSA-N 0 3 406.555 4.090 20 0 HIADHN Cc1c(C(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)cnn1-c1ccccc1F ZINC000109503467 852978238 /nfs/dbraw/zinc/97/82/38/852978238.db2.gz QXDLDDQAQBCPFQ-HSZRJFAPSA-N 0 3 406.505 4.195 20 0 HIADHN O=C(NCCCOC1CCCCC1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000109548006 852982924 /nfs/dbraw/zinc/98/29/24/852982924.db2.gz MWYOWCXROIBAIJ-OAQYLSRUSA-N 0 3 412.496 4.297 20 0 HIADHN O=C(NC[C@@H]1CCCN(Cc2cccs2)C1)c1csc(Cc2ccccc2)n1 ZINC000109564903 852986245 /nfs/dbraw/zinc/98/62/45/852986245.db2.gz BOWQRDCOCATIDN-SFHVURJKSA-N 0 3 411.596 4.437 20 0 HIADHN CCc1nc(CN(C)C(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)cs1 ZINC000110126199 853064194 /nfs/dbraw/zinc/06/41/94/853064194.db2.gz YGYZISXMJMDYAG-IBGZPJMESA-N 0 3 411.493 4.119 20 0 HIADHN O=C(c1cc(Br)ccc1F)N1CCCN(CCCc2ccccc2)CC1 ZINC000110202951 853072810 /nfs/dbraw/zinc/07/28/10/853072810.db2.gz IMHNDTDJFQYCSI-UHFFFAOYSA-N 0 3 419.338 4.369 20 0 HIADHN O=C(c1cnn(-c2ccccc2Cl)c1)N1CCCN(CCCc2ccccc2)CC1 ZINC000110203426 853073372 /nfs/dbraw/zinc/07/33/72/853073372.db2.gz IPZAJXMACKRRKY-UHFFFAOYSA-N 0 3 422.960 4.306 20 0 HIADHN CCC(CC)(NCC(=O)Nc1ccccc1SCC(N)=O)c1ccc(Cl)cc1 ZINC000110328072 853088107 /nfs/dbraw/zinc/08/81/07/853088107.db2.gz MCVNPSCZFUYHHV-UHFFFAOYSA-N 0 3 419.978 4.161 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)c3ccccc3N(C)c3ccccc3)CC2)C[C@@H](C)O1 ZINC000110406478 853096532 /nfs/dbraw/zinc/09/65/32/853096532.db2.gz YTSBZVDUQPFIPH-NHCUHLMSSA-N 0 3 421.585 4.416 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)c3ccccc3CCc3ccccc3)CC2)C[C@@H](C)O1 ZINC000110414420 853097321 /nfs/dbraw/zinc/09/73/21/853097321.db2.gz IXESRRFURUIGJF-FGZHOGPDSA-N 0 3 420.597 4.433 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)c3ccc(COc4ccccc4)cc3)CC2)C[C@H](C)O1 ZINC000110454983 853102270 /nfs/dbraw/zinc/10/22/70/853102270.db2.gz WUVLAOHNNLQXID-OYRHEFFESA-N 0 3 422.569 4.227 20 0 HIADHN Fc1ccc(-c2noc([C@H]3CCCN(Cn4cnc5cc(F)c(F)cc54)C3)n2)cc1 ZINC000110472860 853104280 /nfs/dbraw/zinc/10/42/80/853104280.db2.gz LLPIXBVDTQNENZ-AWEZNQCLSA-N 0 3 413.403 4.341 20 0 HIADHN Cc1cc(NC(=O)N2CCC(CN3C[C@H](C)O[C@@H](C)C3)CC2)ccc1Br ZINC000110717474 853143642 /nfs/dbraw/zinc/14/36/42/853143642.db2.gz GHOGHEULDQTRGZ-HOTGVXAUSA-N 0 3 424.383 4.111 20 0 HIADHN CCCN(Cc1csc(-c2ncccn2)n1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000110880086 853161555 /nfs/dbraw/zinc/16/15/55/853161555.db2.gz WFGWDUAGMTVCBG-NRFANRHFSA-N 0 3 407.587 4.477 20 0 HIADHN CN(C)C(=O)Sc1ccc(NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)cc1 ZINC000111012843 853186734 /nfs/dbraw/zinc/18/67/34/853186734.db2.gz NWDNPEJJWWTARU-QGZVFWFLSA-N 0 3 415.534 4.450 20 0 HIADHN COc1cccc([C@@H](CNC(=O)CNc2cccc(C(F)(F)F)c2)N2CCCC2)c1 ZINC000111088252 853199980 /nfs/dbraw/zinc/19/99/80/853199980.db2.gz AVKYOGIPHBUQQK-HXUWFJFHSA-N 0 3 421.463 4.079 20 0 HIADHN CC(C)(C)OC(=O)NCc1cccc(NC(=O)N[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000112592080 853233697 /nfs/dbraw/zinc/23/36/97/853233697.db2.gz GBCQOZKAYOPHPD-NRFANRHFSA-N 0 3 424.545 4.107 20 0 HIADHN Cc1ccc([C@H](CNC(=O)[C@H]2CCCN(c3nc4ccccc4s3)C2)N(C)C)cc1 ZINC000116026847 853280051 /nfs/dbraw/zinc/28/00/51/853280051.db2.gz YGWYTZZPYIAHSR-FPOVZHCZSA-N 0 3 422.598 4.240 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)c1cc(-c2ccccc2Cl)on1 ZINC000116072838 853281019 /nfs/dbraw/zinc/28/10/19/853281019.db2.gz UMUSZCPFJOCUCV-UHFFFAOYSA-N 0 3 419.859 4.477 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)c1cnn(-c2cccc(Cl)c2)c1 ZINC000116072668 853281048 /nfs/dbraw/zinc/28/10/48/853281048.db2.gz VUDNIWFHDRGDAV-UHFFFAOYSA-N 0 3 418.875 4.008 20 0 HIADHN Cc1nc2ccccc2c(C)c1CC(=O)N(CCN(C)C)Cc1ccc(F)c(F)c1 ZINC000116072646 853281301 /nfs/dbraw/zinc/28/13/01/853281301.db2.gz KQUIICDRBVWPSN-UHFFFAOYSA-N 0 3 411.496 4.263 20 0 HIADHN CC(C)Oc1ccc(CC[C@@H](C)NC(=O)[C@H]2CCCN(Cc3cccnc3)C2)cc1 ZINC000116394680 853301074 /nfs/dbraw/zinc/30/10/74/853301074.db2.gz JAWYTMKNIKHAQV-OFNKIYASSA-N 0 3 409.574 4.218 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)c2cccc(NC(=O)c3ccc(F)cc3)c2)o1 ZINC000116434810 853303185 /nfs/dbraw/zinc/30/31/85/853303185.db2.gz KAIQSWALIDDLHL-UHFFFAOYSA-N 0 3 423.488 4.183 20 0 HIADHN CCOC(=O)Nc1ccc(C(=O)Nc2ccc(CCN3CCSCC3)cc2)cc1 ZINC000138697041 853394211 /nfs/dbraw/zinc/39/42/11/853394211.db2.gz CJEDCFYCRLJXEB-UHFFFAOYSA-N 0 3 413.543 4.099 20 0 HIADHN CN(C)Cc1cccc(NC(=O)N(CCCO)Cc2ccc(Cl)c(Cl)c2)c1 ZINC000139236774 853406137 /nfs/dbraw/zinc/40/61/37/853406137.db2.gz DVGNUJMXFHXENC-UHFFFAOYSA-N 0 3 410.345 4.472 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2cccc(N3CCCC3=O)c2)N2CCCC2)cc1 ZINC000139272390 853407233 /nfs/dbraw/zinc/40/72/33/853407233.db2.gz PFKBBKQOQATUBL-JOCHJYFZSA-N 0 3 406.530 4.080 20 0 HIADHN Cc1nn(Cc2ccccc2)c(Cl)c1CNC1CCN(C(=O)C(C)(C)C)CC1 ZINC000139568742 853414247 /nfs/dbraw/zinc/41/42/47/853414247.db2.gz HBWJNGGDWKQMPH-UHFFFAOYSA-N 0 3 402.970 4.020 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2ccc(C(=O)NC(C)C)cc2)N2CCCC2)cc1 ZINC000139601844 853414504 /nfs/dbraw/zinc/41/45/04/853414504.db2.gz ZSACZUZRAQJBKW-JOCHJYFZSA-N 0 3 408.546 4.092 20 0 HIADHN CC(C)c1cc(C(=O)NC[C@H]2CCCN(Cc3cccs3)C2)nn1C(C)(C)C ZINC000139987297 853429681 /nfs/dbraw/zinc/42/96/81/853429681.db2.gz BHEKXIQHAFNREW-QGZVFWFLSA-N 0 3 402.608 4.465 20 0 HIADHN COc1ccccc1-c1cc(C(=O)NC[C@@H]2CCCN(Cc3cccs3)C2)no1 ZINC000140085336 853433476 /nfs/dbraw/zinc/43/34/76/853433476.db2.gz LVKKHGHCJCEGDA-INIZCTEOSA-N 0 3 411.527 4.054 20 0 HIADHN COc1ccc(-c2nn(Cc3ccccc3)cc2CNCc2ccccc2CO)cc1 ZINC000140271886 853440102 /nfs/dbraw/zinc/44/01/02/853440102.db2.gz BAOIBXZKKUVOHZ-UHFFFAOYSA-N 0 3 413.521 4.389 20 0 HIADHN CN(C)Cc1cccc(NC(=O)NCc2ccc(-n3ccc(C(F)(F)F)n3)cc2)c1 ZINC000141825212 853481447 /nfs/dbraw/zinc/48/14/47/853481447.db2.gz TWULRMYVPWHCGA-UHFFFAOYSA-N 0 3 417.435 4.274 20 0 HIADHN C[C@H](NCc1ccc(OCc2cccnc2)cc1)c1cccc(N2CCOC2=O)c1 ZINC000142692137 853497765 /nfs/dbraw/zinc/49/77/65/853497765.db2.gz CVJLGHUFWLGSPY-SFHVURJKSA-N 0 3 403.482 4.468 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2ccc(CN3CCCCC3=O)cc2)N2CCCC2)cc1 ZINC000143101910 853508612 /nfs/dbraw/zinc/50/86/12/853508612.db2.gz NQHWSYXOAKEUPM-XMMPIXPASA-N 0 3 419.569 4.074 20 0 HIADHN O=C(NC1CCN(Cc2ccc(OCc3ccncc3)cc2)CC1)c1ccsc1 ZINC000143496898 853516032 /nfs/dbraw/zinc/51/60/32/853516032.db2.gz ATKQMVZFLKHMDJ-UHFFFAOYSA-N 0 3 407.539 4.117 20 0 HIADHN COc1ccc(-c2[nH]c3ccccc3c2CCC(=O)N[C@@H]2CCN(C3CC3)C2)cc1 ZINC000143989572 853527255 /nfs/dbraw/zinc/52/72/55/853527255.db2.gz HPFVHXZPVLGSSC-GOSISDBHSA-N 0 3 403.526 4.129 20 0 HIADHN COCCc1ccc(OC(=O)C2CCN(c3cc(Cl)ccc3Cl)C2=O)cc1 ZINC000148092160 853600860 /nfs/dbraw/zinc/60/08/60/853600860.db2.gz BURNFOSZPOWNKC-MRXNPFEDSA-N 0 3 408.281 4.141 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1cc(C)nn1C(C)(C)C)c1cccc(OC)c1 ZINC000148416257 853606981 /nfs/dbraw/zinc/60/69/81/853606981.db2.gz AAIKIMJDFKXLOY-LJQANCHMSA-N 0 3 401.555 4.160 20 0 HIADHN CCCCc1ccc(NC(=O)C(C#N)C(=O)c2ccn(-c3ccc(OC)cc3)n2)cc1 ZINC000150210998 853640217 /nfs/dbraw/zinc/64/02/17/853640217.db2.gz QCTJKSDRQLFNBU-NRFANRHFSA-N 0 3 416.481 4.185 20 0 HIADHN COc1ccccc1CN(CCC(=O)Nc1c(C)nn(-c2ccccc2)c1C)C1CC1 ZINC000165411120 853651458 /nfs/dbraw/zinc/65/14/58/853651458.db2.gz YYRJLSDZLSFBCB-UHFFFAOYSA-N 0 3 418.541 4.491 20 0 HIADHN O=C(c1cccc(CNCc2ccc(-c3ccccc3F)s2)c1)N1CCOCC1 ZINC000166269280 853654199 /nfs/dbraw/zinc/65/41/99/853654199.db2.gz UKEXMYIRGMFCAF-UHFFFAOYSA-N 0 3 410.514 4.316 20 0 HIADHN CN(C)Cc1cccc(NC(=O)C[C@](O)(c2nc3ccccc3s2)C(F)(F)F)c1 ZINC000195547263 853677872 /nfs/dbraw/zinc/67/78/72/853677872.db2.gz UTAUTXOZUPLZSD-IBGZPJMESA-N 0 3 423.460 4.137 20 0 HIADHN Brc1ccc(C2(NCc3cnn(-c4ccccc4)c3)CCOCC2)cc1 ZINC000195600915 853706754 /nfs/dbraw/zinc/70/67/54/853706754.db2.gz PZNVIVJORBILCN-UHFFFAOYSA-N 0 3 412.331 4.430 20 0 HIADHN O=C(Nc1ccccc1O)C1CCN(Cc2ccc(OCC(F)(F)F)cc2)CC1 ZINC000195600721 853706887 /nfs/dbraw/zinc/70/68/87/853706887.db2.gz ZISKLGGSVWDTEE-UHFFFAOYSA-N 0 3 408.420 4.184 20 0 HIADHN O=C(NCc1ccc(OCC(F)(F)F)cc1)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000195605075 853708712 /nfs/dbraw/zinc/70/87/12/853708712.db2.gz ORTIBEIWPKDDNH-IBGZPJMESA-N 0 3 421.463 4.092 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(NC(N)=O)cc1)c1ccc(I)cc1 ZINC000195616687 853716301 /nfs/dbraw/zinc/71/63/01/853716301.db2.gz CVTUDELVNAKWNL-RYUDHWBXSA-N 0 3 409.271 4.194 20 0 HIADHN Cc1nc(COc2ccc(F)cc2)sc1C(=O)N[C@H](C)CN1CCC[C@@H](C)C1 ZINC000195621298 853720676 /nfs/dbraw/zinc/72/06/76/853720676.db2.gz HXRFGMLEEIZNFL-HUUCEWRRSA-N 0 3 405.539 4.020 20 0 HIADHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)Nc1nc(C2CC2)cs1 ZINC000195634422 853727745 /nfs/dbraw/zinc/72/77/45/853727745.db2.gz IPTBAUCBMIKNCN-UHFFFAOYSA-N 0 3 423.380 4.379 20 0 HIADHN COc1ccc2ccccc2c1CNC(=O)N1CCCN(Cc2ccccc2)CC1 ZINC000195634119 853727930 /nfs/dbraw/zinc/72/79/30/853727930.db2.gz ONEXJGLETYUNLC-UHFFFAOYSA-N 0 3 403.526 4.266 20 0 HIADHN Cc1ccccc1OC[C@H](O)CN[C@H](C)c1cccc(NC(=O)c2ccccc2)c1 ZINC000195662320 853744103 /nfs/dbraw/zinc/74/41/03/853744103.db2.gz IAKSDTANHGWULX-AUSIDOKSSA-N 0 3 404.510 4.338 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)c1ccc2c(c1)OCCCO2 ZINC000195686450 853758027 /nfs/dbraw/zinc/75/80/27/853758027.db2.gz GWHYRSZKEGZHCU-UHFFFAOYSA-N 0 3 422.447 4.071 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)c1cc(-c2ccc(Cl)cc2)on1 ZINC000195724828 853779318 /nfs/dbraw/zinc/77/93/18/853779318.db2.gz AOPIFEPOHJJZBA-UHFFFAOYSA-N 0 3 419.859 4.477 20 0 HIADHN Cc1cc(C(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)c(C)n1Cc1ccccn1 ZINC000195745091 853791150 /nfs/dbraw/zinc/79/11/50/853791150.db2.gz QSHZMISYTUAEQU-VWLOTQADSA-N 0 3 416.569 4.424 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)[C@@H]2C[C@@H]2c2cccc(Br)c2)CC1 ZINC000195747718 853791689 /nfs/dbraw/zinc/79/16/89/853791689.db2.gz LGGKLEFDYLZJDV-WOJBJXKFSA-N 0 3 417.347 4.269 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)/C=C\c1ccc2c(c1)OCO2 ZINC000208059072 853805703 /nfs/dbraw/zinc/80/57/03/853805703.db2.gz NDADRYJNNXWWCU-CLFYSBASSA-N 0 3 420.431 4.038 20 0 HIADHN CCOC(=O)/C=C\c1ccc(NC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)cc1 ZINC000214062062 853828901 /nfs/dbraw/zinc/82/89/01/853828901.db2.gz XCONMECMQUQWSG-IMTHGLKYSA-N 0 3 410.489 4.253 20 0 HIADHN CCOC(=O)/C=C\c1ccc(NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)cc1 ZINC000214062001 853828960 /nfs/dbraw/zinc/82/89/60/853828960.db2.gz XCONMECMQUQWSG-KTZABMDBSA-N 0 3 410.489 4.253 20 0 HIADHN C/C=C\c1ccc(OCC(=O)N2CCCN(Cc3ccccc3C)CC2)c(OC)c1 ZINC000215341120 853832785 /nfs/dbraw/zinc/83/27/85/853832785.db2.gz FDSFUESTOLOFFV-YWEYNIOJSA-N 0 3 408.542 4.150 20 0 HIADHN Cc1ccc(Cn2cc(C(=O)N(C)C3CCN(C)CC3)c(-c3ccc(C)cc3)n2)cc1 ZINC000215836601 853838450 /nfs/dbraw/zinc/83/84/50/853838450.db2.gz YFQTYDPXVQOTRY-UHFFFAOYSA-N 0 3 416.569 4.381 20 0 HIADHN O=C(Nc1ccccc1OC[C@H]1CCCCO1)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000228233240 853888901 /nfs/dbraw/zinc/88/89/01/853888901.db2.gz DIUKCWVHVVRDKV-NHCUHLMSSA-N 0 3 409.530 4.031 20 0 HIADHN c1cn(-c2ccccc2CNCc2cn(Cc3ccccc3)nc2-c2cccnc2)cn1 ZINC000236581311 853899922 /nfs/dbraw/zinc/89/99/22/853899922.db2.gz JOUCNIIXFOTSMR-UHFFFAOYSA-N 0 3 420.520 4.469 20 0 HIADHN c1cn(-c2ccccc2CNCc2cn(-c3ccccc3)nc2-c2ccncc2)cn1 ZINC000236584468 853900491 /nfs/dbraw/zinc/90/04/91/853900491.db2.gz NLWRNXXKEIXMDZ-UHFFFAOYSA-N 0 3 406.493 4.410 20 0 HIADHN CC(=O)Nc1ccc(CCNCc2nc(-c3cccc(Br)c3)c[nH]2)cc1 ZINC000236599115 853901441 /nfs/dbraw/zinc/90/14/41/853901441.db2.gz SVUNDRJRMYYOBT-UHFFFAOYSA-N 0 3 413.319 4.130 20 0 HIADHN O=C(CCNCc1ccc(Br)s1)Nc1ccc(Br)cc1 ZINC000236617158 853902394 /nfs/dbraw/zinc/90/23/94/853902394.db2.gz RSJAPHAHHZCLMQ-UHFFFAOYSA-N 0 3 418.154 4.392 20 0 HIADHN Brc1ccc(-c2c[nH]c(CNCCc3ccc(-n4cccn4)cc3)n2)cc1 ZINC000236621974 853903607 /nfs/dbraw/zinc/90/36/07/853903607.db2.gz XTTHMRGPALGUCG-UHFFFAOYSA-N 0 3 422.330 4.357 20 0 HIADHN c1c(CNCc2ccc(C3OCCO3)cc2)c(-c2cccnc2)nn1-c1ccccc1 ZINC000236626835 853905009 /nfs/dbraw/zinc/90/50/09/853905009.db2.gz FJARGRBNAWQKKA-UHFFFAOYSA-N 0 3 412.493 4.270 20 0 HIADHN Brc1ccc2ncc(CNC[C@@H](c3ccco3)N3CCCCC3)n2c1 ZINC000236643416 853905771 /nfs/dbraw/zinc/90/57/71/853905771.db2.gz IZGNCYHXGACAOT-KRWDZBQOSA-N 0 3 403.324 4.007 20 0 HIADHN CC(=O)N(c1nc(CNC[C@H](C)N2CCC(C)CC2)cs1)c1ccc(C)cc1 ZINC000236649723 853906837 /nfs/dbraw/zinc/90/68/37/853906837.db2.gz FIXQJFCOXZDZSG-SFHVURJKSA-N 0 3 400.592 4.346 20 0 HIADHN CC(=O)N(c1nc(CNC[C@@H](C)N2CCC(C)CC2)cs1)c1ccc(C)cc1 ZINC000236658728 853908417 /nfs/dbraw/zinc/90/84/17/853908417.db2.gz FIXQJFCOXZDZSG-GOSISDBHSA-N 0 3 400.592 4.346 20 0 HIADHN CC(C)(C)OC(=O)N1CCc2cccc(CNC[C@](C)(O)c3ccc(F)cc3F)c21 ZINC000236733931 853917283 /nfs/dbraw/zinc/91/72/83/853917283.db2.gz ZAWSQXNHJLYPBW-QHCPKHFHSA-N 0 3 418.484 4.260 20 0 HIADHN CCOc1c(OC)cc(CNC[C@H](O)c2ccc(Cl)cc2Cl)cc1OC ZINC000236864220 853930212 /nfs/dbraw/zinc/93/02/12/853930212.db2.gz LZTIDUAXZSQWPO-INIZCTEOSA-N 0 3 400.302 4.233 20 0 HIADHN CCOc1cc(CNCc2ccc3ccccc3c2)ccc1O[C@@H](C)C(=O)N(C)C ZINC000236871204 853931398 /nfs/dbraw/zinc/93/13/98/853931398.db2.gz GYCZMITZKJXJPV-SFHVURJKSA-N 0 3 406.526 4.384 20 0 HIADHN CC[C@H](C#N)Oc1cccc(CNCc2cc(Br)c(O)c(OC)c2)c1 ZINC000236894430 853932879 /nfs/dbraw/zinc/93/28/79/853932879.db2.gz CDEXNMTYAPKRIM-OAHLLOKOSA-N 0 3 405.292 4.134 20 0 HIADHN CCCOc1c(Br)cc(Br)cc1CNCC1(O)CCC1 ZINC000236903742 853934927 /nfs/dbraw/zinc/93/49/27/853934927.db2.gz PLCJOHDNRZUXHN-UHFFFAOYSA-N 0 3 407.146 4.005 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(Cl)c1CNCCc1cccc(C(=O)N(C)C)c1 ZINC000237073986 853960162 /nfs/dbraw/zinc/96/01/62/853960162.db2.gz ZPAQOTFJCLLDTJ-UHFFFAOYSA-N 0 3 414.912 4.007 20 0 HIADHN CC(=O)Nc1ccc(CN[C@@H](Cc2ccccc2)C(=O)N(C)c2ccccc2)cc1 ZINC000237076100 853960832 /nfs/dbraw/zinc/96/08/32/853960832.db2.gz CRGKRKRIYVUJMU-DEOSSOPVSA-N 0 3 401.510 4.009 20 0 HIADHN CN(C(=O)[C@H](Cc1ccccc1)NCc1ccc(-n2ccnc2)cc1)c1ccccc1 ZINC000237076864 853961006 /nfs/dbraw/zinc/96/10/06/853961006.db2.gz MFZVHQNLCJAAMA-VWLOTQADSA-N 0 3 410.521 4.236 20 0 HIADHN CC(=O)N(c1nc(CNC[C@H]2CCCN2C)cs1)c1ccc(C(F)(F)F)cc1 ZINC000237084718 853961761 /nfs/dbraw/zinc/96/17/61/853961761.db2.gz ATXWIFJBMCMPCF-QGZVFWFLSA-N 0 3 412.481 4.030 20 0 HIADHN COc1cc(CNCc2ccc(O[C@H](C)C#N)cc2)cc(Br)c1OC ZINC000237105499 853965435 /nfs/dbraw/zinc/96/54/35/853965435.db2.gz AFGYAYVLPBPRJJ-CYBMUJFWSA-N 0 3 405.292 4.047 20 0 HIADHN COc1cc(CNC/C=C/c2ccccc2)cc(I)c1OC ZINC000237102760 853965666 /nfs/dbraw/zinc/96/56/66/853965666.db2.gz LWEXLNZRFJLOLH-RMKNXTFCSA-N 0 3 409.267 4.111 20 0 HIADHN COc1ccc(Br)cc1CNCCc1nc(-c2ccccn2)cs1 ZINC000237132578 853969582 /nfs/dbraw/zinc/96/95/82/853969582.db2.gz XJKMXRGCIZDTKK-UHFFFAOYSA-N 0 3 404.333 4.309 20 0 HIADHN COc1cc(CN[C@@H](C)c2ccc(C)cc2)cc(I)c1OC ZINC000237162319 853974152 /nfs/dbraw/zinc/97/41/52/853974152.db2.gz CDNBSTJDZYHFDN-ZDUSSCGKSA-N 0 3 411.283 4.468 20 0 HIADHN CN(C)[C@@H](CNCc1nc(-c2cccc(Br)c2)c[nH]1)c1cccc(F)c1 ZINC000237179015 853976576 /nfs/dbraw/zinc/97/65/76/853976576.db2.gz PVXWNPNCSQUKDJ-IBGZPJMESA-N 0 3 417.326 4.371 20 0 HIADHN COC(=O)COc1cccc(CNCC2=Cc3cc(Cl)cc(Cl)c3OC2)c1 ZINC000237192836 853978384 /nfs/dbraw/zinc/97/83/84/853978384.db2.gz GILDIWIKFPJODR-UHFFFAOYSA-N 0 3 408.281 4.111 20 0 HIADHN CN1CCN(c2cccc(Cl)c2CNCc2cccc(Br)c2)CC1 ZINC000237236107 853987585 /nfs/dbraw/zinc/98/75/85/853987585.db2.gz KTZJIEFBBHSTIU-UHFFFAOYSA-N 0 3 408.771 4.144 20 0 HIADHN COc1cc(CN[C@H](c2ccc(F)cc2)C(C)(C)C)cc(Cl)c1OCC(N)=O ZINC000237233039 853987734 /nfs/dbraw/zinc/98/77/34/853987734.db2.gz FQXHOUWOHWCXKX-HXUWFJFHSA-N 0 3 408.901 4.229 20 0 HIADHN CN1CCN(c2ccc(C(F)(F)F)cc2CNCc2cc(F)c(F)c(F)c2)CC1 ZINC000237232820 853987934 /nfs/dbraw/zinc/98/79/34/853987934.db2.gz GQMVCNQEOYZMRX-UHFFFAOYSA-N 0 3 417.397 4.164 20 0 HIADHN COc1ccc(OC)c([C@@H](C)N[C@@H](C)CC(=O)Nc2cc(Cl)ccc2OC)c1 ZINC000237264901 853993315 /nfs/dbraw/zinc/99/33/15/853993315.db2.gz SHPBPPIUPYMUKL-UONOGXRCSA-N 0 3 406.910 4.434 20 0 HIADHN COc1ccc(CNCc2ccnc(-n3ccnc3)c2)cc1OCc1ccccc1 ZINC000237270144 853994345 /nfs/dbraw/zinc/99/43/45/853994345.db2.gz NFKAKGWFANJYOC-UHFFFAOYSA-N 0 3 400.482 4.145 20 0 HIADHN COc1ccc(CNCc2ccnc(N3CCCCC3)c2)cc1OCc1cccnc1 ZINC000237267349 853994495 /nfs/dbraw/zinc/99/44/95/853994495.db2.gz VYMVNDRWQBQEFT-UHFFFAOYSA-N 0 3 418.541 4.344 20 0 HIADHN COCc1nc2n(n1)C[C@H](NCc1ccc(-c3cccc(Cl)c3Cl)o1)CC2 ZINC000237287243 853998030 /nfs/dbraw/zinc/99/80/30/853998030.db2.gz HOFVWUDREMVITI-GFCCVEGCSA-N 0 3 407.301 4.096 20 0 HIADHN COc1ccc(NC(=O)C[C@@H](C)NCc2oc3ccc(F)cc3c2C)c(OC)c1 ZINC000237289980 853998135 /nfs/dbraw/zinc/99/81/35/853998135.db2.gz RNVIMMLAWOYOEA-CYBMUJFWSA-N 0 3 400.450 4.404 20 0 HIADHN COc1ccc(OCc2ccccn2)c(CNCCc2nc3c(cccc3F)n2C)c1 ZINC000237291603 853999406 /nfs/dbraw/zinc/99/94/06/853999406.db2.gz HKVOYUVDLACEIF-UHFFFAOYSA-N 0 3 420.488 4.027 20 0 HIADHN COc1ccc(NC(=O)C[C@@H](C)N[C@@H]2CCOc3c(Cl)cccc32)c(OC)c1 ZINC000237291470 853999422 /nfs/dbraw/zinc/99/94/22/853999422.db2.gz MCJAJJQWZCENKZ-CXAGYDPISA-N 0 3 404.894 4.188 20 0 HIADHN COc1ccc(NC(=O)C[C@H](C)NCc2c(C)nn(-c3ccccc3)c2C)c(OC)c1 ZINC000237303089 854003064 /nfs/dbraw/zinc/00/30/64/854003064.db2.gz IJYHUGDCNMXKGN-INIZCTEOSA-N 0 3 422.529 4.013 20 0 HIADHN COc1cc(C[NH2+]CCCOc2cccc3cccnc32)cc(Br)c1[O-] ZINC000237392360 854021239 /nfs/dbraw/zinc/02/12/39/854021239.db2.gz PTWQHZOCXMNDOY-UHFFFAOYSA-N 0 3 417.303 4.270 20 0 HIADHN C[C@@H](CC(=O)Nc1cccc(N2CCCC2)c1)NCc1cnn(-c2ccc(F)cc2)c1 ZINC000237394670 854021865 /nfs/dbraw/zinc/02/18/65/854021865.db2.gz MOAPJNVZSJWPRW-SFHVURJKSA-N 0 3 421.520 4.119 20 0 HIADHN COc1ccc(CNCCc2nc(-c3cccc(Cl)c3)no2)c(OC(F)F)c1 ZINC000237396614 854022852 /nfs/dbraw/zinc/02/28/52/854022852.db2.gz YKOUTUVMIFAPFB-UHFFFAOYSA-N 0 3 409.820 4.332 20 0 HIADHN COc1ccc(OC)c(NC(=O)C[C@@H](C)N[C@@H](c2ccccc2)c2ccncc2)c1 ZINC000237397171 854022863 /nfs/dbraw/zinc/02/28/63/854022863.db2.gz IWTJYUAKQXBCOJ-OSPHWJPCSA-N 0 3 405.498 4.195 20 0 HIADHN COc1cc(CN[C@@H](c2ccc(Cl)cc2)C2CCC2)cc(Cl)c1OCC(N)=O ZINC000237403936 854024577 /nfs/dbraw/zinc/02/45/77/854024577.db2.gz SJCJWSWILYVSJV-HXUWFJFHSA-N 0 3 423.340 4.497 20 0 HIADHN COc1cc(CNCCc2nc(-c3ccc(Cl)cc3)no2)c(SC)cc1OC ZINC000237416867 854027484 /nfs/dbraw/zinc/02/74/84/854027484.db2.gz NJQZMOFXOXEKRS-UHFFFAOYSA-N 0 3 419.934 4.461 20 0 HIADHN COc1cc(CNCc2ccnc(-n3cccn3)c2)c(-c2ccccc2)cc1OC ZINC000237415276 854027928 /nfs/dbraw/zinc/02/79/28/854027928.db2.gz REXLQUHSTJCYCT-UHFFFAOYSA-N 0 3 400.482 4.241 20 0 HIADHN COc1ccc(CN[C@H](c2ccc3c(c2)OCCO3)C2CC2)cc1Br ZINC000237547084 854053507 /nfs/dbraw/zinc/05/35/07/854053507.db2.gz UTWOMNWJDRHIRV-FQEVSTJZSA-N 0 3 404.304 4.470 20 0 HIADHN COc1ccc(C[C@H](NCc2cnc3c(c2)c(C)nn3C)c2ccccc2)cc1OC ZINC000237557772 854054300 /nfs/dbraw/zinc/05/43/00/854054300.db2.gz DBRNCKKNHRGYME-QFIPXVFZSA-N 0 3 416.525 4.368 20 0 HIADHN Cc1cc(Br)ccc1NC(=O)CCNCc1cc2ccccc2[nH]c1=O ZINC000237565119 854055142 /nfs/dbraw/zinc/05/51/42/854055142.db2.gz WZYRNQNEIZHARZ-UHFFFAOYSA-N 0 3 414.303 4.130 20 0 HIADHN Cc1nc(COc2ccc(CNC3(c4ccc(Cl)cc4)CCOCC3)cc2)no1 ZINC000237654615 854068730 /nfs/dbraw/zinc/06/87/30/854068730.db2.gz FIVKYWUTUGHAMP-UHFFFAOYSA-N 0 3 413.905 4.406 20 0 HIADHN Cc1nc(COc2ccc(CNC3(c4cccc(Br)c4)CC3)cc2)no1 ZINC000237654779 854069002 /nfs/dbraw/zinc/06/90/02/854069002.db2.gz YAWHEJJGVWYTON-UHFFFAOYSA-N 0 3 414.303 4.498 20 0 HIADHN Cc1nn(Cc2ccccc2)c(Cl)c1CNCCc1nc2c(cccc2F)n1C ZINC000237657719 854069960 /nfs/dbraw/zinc/06/99/60/854069960.db2.gz GZGISODPPPJNMV-UHFFFAOYSA-N 0 3 411.912 4.251 20 0 HIADHN Cc1nc(COc2ccc(CN[C@@H]3CCc4c3cccc4Br)cc2)no1 ZINC000237668670 854072090 /nfs/dbraw/zinc/07/20/90/854072090.db2.gz UKVSBQZBXBDXLN-LJQANCHMSA-N 0 3 414.303 4.497 20 0 HIADHN O=[N+]([O-])c1ccc(Cl)cc1CNC[C@@H](c1ccccc1Cl)N1CCOCC1 ZINC000237724603 854083759 /nfs/dbraw/zinc/08/37/59/854083759.db2.gz XODXIBSUGACIEF-IBGZPJMESA-N 0 3 410.301 4.065 20 0 HIADHN Fc1cccc(CNC[C@H](c2ccc(C(F)(F)F)cc2)N2CCOCC2)c1F ZINC000237753571 854089034 /nfs/dbraw/zinc/08/90/34/854089034.db2.gz BLPQEISKMSNZFR-GOSISDBHSA-N 0 3 400.391 4.147 20 0 HIADHN O=[N+]([O-])c1ccc(Cl)c(CNC[C@H](c2ccc(Cl)cc2)N2CCOCC2)c1 ZINC000237784839 854096808 /nfs/dbraw/zinc/09/68/08/854096808.db2.gz PSYFNAOGFQAEIF-LJQANCHMSA-N 0 3 410.301 4.065 20 0 HIADHN Fc1ccc(N2CCN(c3cc(CNCc4cccc5cc[nH]c54)ccn3)CC2)cc1 ZINC000237786187 854097323 /nfs/dbraw/zinc/09/73/23/854097323.db2.gz LHISCOMBMOQNTG-UHFFFAOYSA-N 0 3 415.516 4.318 20 0 HIADHN Cn1cc(N2CC[C@H](NCc3ccc(-c4ccc(Cl)c(Cl)c4)s3)C2=O)cn1 ZINC000237797014 854099186 /nfs/dbraw/zinc/09/91/86/854099186.db2.gz POJZWTPFMPBDQF-KRWDZBQOSA-N 0 3 421.353 4.351 20 0 HIADHN Cc1nn(-c2cccc(Cl)c2)c(Cl)c1CNCCCOCC1CCOCC1 ZINC000237813641 854102052 /nfs/dbraw/zinc/10/20/52/854102052.db2.gz MISKOKPJUUHYBF-UHFFFAOYSA-N 0 3 412.361 4.410 20 0 HIADHN O=C(CCNCc1cccc(NC(=O)c2ccc(Cl)cc2)c1)NCc1ccccc1 ZINC000237870729 854111887 /nfs/dbraw/zinc/11/18/87/854111887.db2.gz HGSYBLAFACGDHD-UHFFFAOYSA-N 0 3 421.928 4.388 20 0 HIADHN Cc1nn(Cc2ccc(Cl)cc2)c(C)c1CNC[C@@](C)(O)c1ccc(F)cc1F ZINC000237883068 854113966 /nfs/dbraw/zinc/11/39/66/854113966.db2.gz ONTUCBQGNINHGR-JOCHJYFZSA-N 0 3 419.903 4.477 20 0 HIADHN NC(=O)COc1cccc(CNCc2cccc(OCc3ccccc3Cl)c2)c1 ZINC000237885991 854114762 /nfs/dbraw/zinc/11/47/62/854114762.db2.gz UDBZFKJJZITZEL-UHFFFAOYSA-N 0 3 410.901 4.073 20 0 HIADHN FC(F)(F)COCCNCc1cc(Br)ccc1OCc1ccccn1 ZINC000237889196 854115635 /nfs/dbraw/zinc/11/56/35/854115635.db2.gz HAHLSOCIJJYLFD-UHFFFAOYSA-N 0 3 419.241 4.092 20 0 HIADHN Fc1cccc([C@@H](CNCc2ccc(CSC(F)F)o2)N2CCOCC2)c1 ZINC000237930643 854121001 /nfs/dbraw/zinc/12/10/01/854121001.db2.gz WDJFROSPAXUQBM-GOSISDBHSA-N 0 3 400.466 4.038 20 0 HIADHN O=C1NCCCC[C@H]1NCc1cn(-c2ccccc2)nc1-c1cc2ccccc2o1 ZINC000238089177 854142909 /nfs/dbraw/zinc/14/29/09/854142909.db2.gz SZAWOHFCONBXRE-HXUWFJFHSA-N 0 3 400.482 4.044 20 0 HIADHN O[C@H](CNCc1cc(Br)ccc1OCc1ccccn1)c1ccsc1 ZINC000238128950 854145370 /nfs/dbraw/zinc/14/53/70/854145370.db2.gz YCVAYVRFXZMEKB-GOSISDBHSA-N 0 3 419.344 4.308 20 0 HIADHN CCN(C(=O)c1cc(OC)c(OC)c(OC)c1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000249883545 854192620 /nfs/dbraw/zinc/19/26/20/854192620.db2.gz BKMJYGJFPWHXGR-XLIONFOSSA-N 0 3 412.530 4.010 20 0 HIADHN C[C@H](Sc1ccc(Cl)cc1)C(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000251708810 854199973 /nfs/dbraw/zinc/19/99/73/854199973.db2.gz OTPQADYYPKXQKG-ZACQAIPSSA-N 0 3 411.011 4.168 20 0 HIADHN C[C@H](Sc1ccccc1Cl)C(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000251788415 854201116 /nfs/dbraw/zinc/20/11/16/854201116.db2.gz WUTQPLYRQPSLPO-ZACQAIPSSA-N 0 3 411.011 4.168 20 0 HIADHN Cc1nc(COc2ccc(F)cc2)sc1C(=O)N[C@H](C)CN1C[C@@H](C)C[C@H](C)C1 ZINC000255958178 854230632 /nfs/dbraw/zinc/23/06/32/854230632.db2.gz CYMJHEAAKCXRTN-HRCADAONSA-N 0 3 419.566 4.266 20 0 HIADHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)c1cccc2cccnc21 ZINC000261412616 854252334 /nfs/dbraw/zinc/25/23/34/854252334.db2.gz RUTBYGXUQOBXSC-UHFFFAOYSA-N 0 3 412.331 4.201 20 0 HIADHN Cc1nc(-c2ccc(NC[C@@H]3CCC[N@@H+](C)[C@@H]3c3cccs3)nc2)[n-]c(=O)c1C ZINC000301448291 854397250 /nfs/dbraw/zinc/39/72/50/854397250.db2.gz WHCPVCIDWWKYIK-JXFKEZNVSA-N 0 3 409.559 4.418 20 0 HIADHN Cc1nc(-c2ccc(NC[C@@H]3CCC[N@H+](C)[C@@H]3c3cccs3)nc2)[n-]c(=O)c1C ZINC000301448291 854397258 /nfs/dbraw/zinc/39/72/58/854397258.db2.gz WHCPVCIDWWKYIK-JXFKEZNVSA-N 0 3 409.559 4.418 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(N3CCC(CC[N@@H+]4CCCC[C@H]4C)CC3)nc2)n1 ZINC000301658562 854439097 /nfs/dbraw/zinc/43/90/97/854439097.db2.gz JADHLQBSDRRSKQ-GOSISDBHSA-N 0 3 409.578 4.288 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(N3CCC(CC[N@H+]4CCCC[C@H]4C)CC3)nc2)n1 ZINC000301658562 854439100 /nfs/dbraw/zinc/43/91/00/854439100.db2.gz JADHLQBSDRRSKQ-GOSISDBHSA-N 0 3 409.578 4.288 20 0 HIADHN Cc1c2nnc(C(F)(F)F)n2nc(NC[C@H](c2ccc(Cl)cc2)N(C)C)c1C ZINC000301733719 854454464 /nfs/dbraw/zinc/45/44/64/854454464.db2.gz GFMKBUUYXTTWSH-CQSZACIVSA-N 0 3 412.847 4.128 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(Nc2ncnc3ccc(Br)cc32)CC1 ZINC000301797997 854466780 /nfs/dbraw/zinc/46/67/80/854466780.db2.gz RKUIQRCPWHMBKF-CQSZACIVSA-N 0 3 412.335 4.425 20 0 HIADHN CN1CCN(c2ccc(CNc3ccnc4cc(C(F)(F)F)ccc43)cn2)CC1 ZINC000301805451 854468446 /nfs/dbraw/zinc/46/84/46/854468446.db2.gz VLLXOCKGNBQULU-UHFFFAOYSA-N 0 3 401.436 4.013 20 0 HIADHN COc1ccc(Br)c(CN[C@@H]2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)c1 ZINC000302062872 854524360 /nfs/dbraw/zinc/52/43/60/854524360.db2.gz XDGIIPONRRYPPH-DZGCQCFKSA-N 0 3 413.356 4.335 20 0 HIADHN COc1ccc([C@H](CNc2nn3cc(-c4cccnc4)nc3s2)N2CCCC2)cc1 ZINC000302108532 854531788 /nfs/dbraw/zinc/53/17/88/854531788.db2.gz STCCPUAPCXZGJR-FQEVSTJZSA-N 0 3 420.542 4.110 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3ccc(F)cc3Br)c(C)c2)CC1 ZINC000302655566 854598839 /nfs/dbraw/zinc/59/88/39/854598839.db2.gz PFJKEEQZDYRGJL-UHFFFAOYSA-N 0 3 420.326 4.291 20 0 HIADHN CC(C)c1cccc(S(=O)(=O)[N-]c2ccc(CC[NH+]3CCSCC3)cc2)c1 ZINC000437320337 862586301 /nfs/dbraw/zinc/58/63/01/862586301.db2.gz UMRTYLFERCOSDD-UHFFFAOYSA-N 0 3 404.601 4.202 20 0 HIADHN COc1ccccc1Nc1ncccc1C(=O)NC1CCN(Cc2ccccc2)CC1 ZINC000302815907 854644302 /nfs/dbraw/zinc/64/43/02/854644302.db2.gz NVWQUFOWMKITIW-UHFFFAOYSA-N 0 3 416.525 4.228 20 0 HIADHN COc1ccc([C@H](C)NC(=O)NC[C@H](c2ccccc2)N(C)C)cc1Br ZINC000302896578 854669980 /nfs/dbraw/zinc/66/99/80/854669980.db2.gz LGBNSRNDIHUCSV-KBXCAEBGSA-N 0 3 420.351 4.121 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Cc2ccc(Br)cc2)N2CCCC2)cc1 ZINC000302977465 854705426 /nfs/dbraw/zinc/70/54/26/854705426.db2.gz CHIPAOULUIMPEN-FQEVSTJZSA-N 0 3 401.348 4.253 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Cc2ccc(OC(F)(F)F)cc2)N2CCCC2)cc1 ZINC000302987149 854710245 /nfs/dbraw/zinc/71/02/45/854710245.db2.gz FDQLJSFLQQATNV-HXUWFJFHSA-N 0 3 406.448 4.389 20 0 HIADHN COc1cc(C(=O)N(Cc2ccco2)C2CCN(C)CC2)ccc1OC1CCCC1 ZINC000302998690 854716262 /nfs/dbraw/zinc/71/62/62/854716262.db2.gz YYWLRYSJIRHBPX-UHFFFAOYSA-N 0 3 412.530 4.346 20 0 HIADHN CC1CCN([C@H](CNC(=O)c2cc([N+](=O)[O-])ccc2Cl)c2ccccc2)CC1 ZINC000303025634 854729140 /nfs/dbraw/zinc/72/91/40/854729140.db2.gz SBYQITQCDYANJC-HXUWFJFHSA-N 0 3 401.894 4.451 20 0 HIADHN Cc1c(C(=O)N(CCN(C)C)Cc2cccc(Cl)c2)cnn1-c1ccccc1F ZINC000303027077 854730084 /nfs/dbraw/zinc/73/00/84/854730084.db2.gz WEMZXADTONLXEF-UHFFFAOYSA-N 0 3 414.912 4.177 20 0 HIADHN CC(=O)NC[C@H]1CCCN(Cc2c(-c3ccc(Cl)cc3)nc3sccn23)C1 ZINC000303041982 854736059 /nfs/dbraw/zinc/73/60/59/854736059.db2.gz HBBTYKPPUDUSFK-OAHLLOKOSA-N 0 3 402.951 4.064 20 0 HIADHN CC1CCN([C@H](CNC(=O)[C@H]2CCCN2C(=O)CC(C)(C)C)c2ccccc2)CC1 ZINC000303066391 854746473 /nfs/dbraw/zinc/74/64/73/854746473.db2.gz VYYSPVUKVMLVCB-FGZHOGPDSA-N 0 3 413.606 4.003 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)c1cc2c(cc(Br)cc2F)[nH]1 ZINC000303079991 854751479 /nfs/dbraw/zinc/75/14/79/854751479.db2.gz ULVZDRILHPWWER-UHFFFAOYSA-N 0 3 418.310 4.274 20 0 HIADHN O=S(=O)(CCCNCC1=Cc2cc(Cl)cc(Cl)c2OC1)c1ccccc1 ZINC000303101450 854761065 /nfs/dbraw/zinc/76/10/65/854761065.db2.gz CHRFMNJMZLHFFY-UHFFFAOYSA-N 0 3 412.338 4.223 20 0 HIADHN CC(C)(O)CN1CCN(c2nc(C3CC3)nc3scc(-c4ccccc4)c32)CC1 ZINC000303127081 854773582 /nfs/dbraw/zinc/77/35/82/854773582.db2.gz HFZBOHPGUHJMBM-UHFFFAOYSA-N 0 3 408.571 4.129 20 0 HIADHN CC(C)CN(CCN(C)C)C(=O)c1ccc(Oc2ccc(Br)cc2)nc1 ZINC000303175944 854801043 /nfs/dbraw/zinc/80/10/43/854801043.db2.gz CDIMFJQHPAZGPI-UHFFFAOYSA-N 0 3 420.351 4.296 20 0 HIADHN c1sc(-c2ccc3c(c2)OCO3)nc1CNC[C@@H](c1ccccc1)N1CCCC1 ZINC000303176550 854801833 /nfs/dbraw/zinc/80/18/33/854801833.db2.gz JQTALKASXIZDAU-FQEVSTJZSA-N 0 3 407.539 4.466 20 0 HIADHN CC(C)c1nc(C(=O)N2CC[C@@H](N3CCCC3)C2)nn1-c1c(Cl)cccc1Cl ZINC000303228304 854826647 /nfs/dbraw/zinc/82/66/47/854826647.db2.gz UQUUDLARMBAACU-CQSZACIVSA-N 0 3 422.360 4.008 20 0 HIADHN CCN1CCN(C(=O)CC2CCN(Cc3sc4ccccc4c3Cl)CC2)CC1 ZINC000303290225 854855063 /nfs/dbraw/zinc/85/50/63/854855063.db2.gz AZNDVGGNLJKYMO-UHFFFAOYSA-N 0 3 420.022 4.321 20 0 HIADHN CCCO[C@H]1CCCN(CC(=O)N2CCCCC[C@@H]2c2ccc(OC)cc2)CC1 ZINC000303407722 854912637 /nfs/dbraw/zinc/91/26/37/854912637.db2.gz SYAPVRAEBBGNJC-XZOQPEGZSA-N 0 3 402.579 4.420 20 0 HIADHN Cc1ccc(C(=O)NC[C@@H](C)N(C)Cc2ccccc2)cc1NC(=O)c1ccccc1 ZINC000303514219 855002142 /nfs/dbraw/zinc/00/21/42/855002142.db2.gz UEHHASWGYOEHLF-HXUWFJFHSA-N 0 3 415.537 4.498 20 0 HIADHN CCN1CCCC[C@@H]1CNC(=O)c1ccc(COc2ccc(Br)cc2)o1 ZINC000303523367 855011004 /nfs/dbraw/zinc/01/10/04/855011004.db2.gz VKOHCVZEVGKVNE-MRXNPFEDSA-N 0 3 421.335 4.225 20 0 HIADHN CC1CCC(N2CCN(CC(=O)N(Cc3cccc(F)c3)C(C)(C)C)CC2)CC1 ZINC000303623539 855083768 /nfs/dbraw/zinc/08/37/68/855083768.db2.gz DLQCNBKPLOILTN-UHFFFAOYSA-N 0 3 403.586 4.149 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(Cl)cc2)CC1)c1ccc(Cl)cc1F ZINC000303677142 855126073 /nfs/dbraw/zinc/12/60/73/855126073.db2.gz IAGXBENLRJBBBP-UHFFFAOYSA-N 0 3 411.304 4.406 20 0 HIADHN Cc1cc(Cl)ccc1S(=O)(=O)N(C)[C@H]1CCN(Cc2ccccc2)[C@H](C)C1 ZINC000303803729 855208691 /nfs/dbraw/zinc/20/86/91/855208691.db2.gz MCEKWMVROVOLOL-XLIONFOSSA-N 0 3 406.979 4.322 20 0 HIADHN Cc1cc(C)n(Cc2ccc(C(=O)N3CCCN(Cc4ccccc4)C[C@H]3C)cc2)n1 ZINC000303834303 855233095 /nfs/dbraw/zinc/23/30/95/855233095.db2.gz LYWNSEPCIQLZCV-JOCHJYFZSA-N 0 3 416.569 4.285 20 0 HIADHN CN(C)Cc1cccc(C(=O)NCC2(c3cccc(C(F)(F)F)c3)CCOCC2)c1 ZINC000303856627 855252023 /nfs/dbraw/zinc/25/20/23/855252023.db2.gz LQUILOGENMYFIT-UHFFFAOYSA-N 0 3 420.475 4.245 20 0 HIADHN Cc1ccc(S(=O)(=O)N(C)[C@H]2CCN(Cc3ccccc3)[C@@H](C)C2)c(Cl)c1 ZINC000303860360 855255645 /nfs/dbraw/zinc/25/56/45/855255645.db2.gz WLRYTSFHQROIRE-HKUYNNGSSA-N 0 3 406.979 4.322 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)c2cc(NC(=O)CC(C)C)ccc2Cl)o1 ZINC000303865225 855258934 /nfs/dbraw/zinc/25/89/34/855258934.db2.gz HTJOBONMTUPOIM-UHFFFAOYSA-N 0 3 419.953 4.430 20 0 HIADHN CCc1ccc([C@@H]2COCCN2C(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)o1 ZINC000303880255 855266751 /nfs/dbraw/zinc/26/67/51/855266751.db2.gz QYIHWWCAENXXMJ-VXKWHMMOSA-N 0 3 411.546 4.070 20 0 HIADHN CN(C)Cc1cccc(C(=O)Nc2cccc(C[S@@](=O)Cc3ccccc3)c2)c1 ZINC000303893693 855274475 /nfs/dbraw/zinc/27/44/75/855274475.db2.gz PUAOHYCDDXLKRJ-LJAQVGFWSA-N 0 3 406.551 4.449 20 0 HIADHN Cc1ccc([C@H](CNC(=O)[C@@H]2C[C@H]2c2ccccc2OC(F)(F)F)N(C)C)cc1 ZINC000303906904 855281338 /nfs/dbraw/zinc/28/13/38/855281338.db2.gz RBYIWETYQHCLSH-OTWHNJEPSA-N 0 3 406.448 4.416 20 0 HIADHN CC(C)(C)OC(=O)N[C@@H]1CC[C@H](CNCc2ccc(F)cc2Br)C1 ZINC000310168058 855365494 /nfs/dbraw/zinc/36/54/94/855365494.db2.gz SINDAUWDGSZWLF-SWLSCSKDSA-N 0 3 401.320 4.371 20 0 HIADHN COc1cc(Br)ccc1C(=O)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000327378849 855416935 /nfs/dbraw/zinc/41/69/35/855416935.db2.gz NUWNMOWRBUNMGF-SFHVURJKSA-N 0 3 403.320 4.025 20 0 HIADHN C[C@@H](CNCc1cc(Br)ccc1OC(F)F)NC(=O)OC(C)(C)C ZINC000379786166 855427801 /nfs/dbraw/zinc/42/78/01/855427801.db2.gz IGADVGXRMCOUNR-JTQLQIEISA-N 0 3 409.271 4.053 20 0 HIADHN COCC1(CNCc2c(F)cccc2Cl)CCN(C(=O)OC(C)(C)C)CC1 ZINC000380427878 855429113 /nfs/dbraw/zinc/42/91/13/855429113.db2.gz LMPQWFJSRFKRHP-UHFFFAOYSA-N 0 3 400.922 4.232 20 0 HIADHN CC[C@H](C)[C@H](CNCc1cc(Br)cc(Br)c1OC)OC ZINC000381106561 855430242 /nfs/dbraw/zinc/43/02/42/855430242.db2.gz BEKMEDAWUXGJHM-HZMBPMFUSA-N 0 3 409.162 4.371 20 0 HIADHN CCn1cc(Br)cc1C(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1 ZINC000383052563 855435969 /nfs/dbraw/zinc/43/59/69/855435969.db2.gz KULNWBOLHGXARP-INIZCTEOSA-N 0 3 404.352 4.007 20 0 HIADHN CCOc1c(Br)cc(Br)cc1CN[C@@H]1C[C@H](C)O[C@H]1C ZINC000384964274 855440953 /nfs/dbraw/zinc/44/09/53/855440953.db2.gz XDKDVYPVWIIMQQ-PKFCDNJMSA-N 0 3 407.146 4.266 20 0 HIADHN COc1ccc(Br)cc1C(=O)N(C)C1CCN(Cc2ccccc2)CC1 ZINC000388974534 855449463 /nfs/dbraw/zinc/44/94/63/855449463.db2.gz PIVCVPFGLMEIQH-UHFFFAOYSA-N 0 3 417.347 4.194 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1cc(Cl)cc(Br)c1 ZINC000389850512 855452615 /nfs/dbraw/zinc/45/26/15/855452615.db2.gz URKRFMUNIBXRTG-ACJLOTCBSA-N 0 3 407.739 4.353 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1cc(Cl)cc(Br)c1 ZINC000389850514 855452843 /nfs/dbraw/zinc/45/28/43/855452843.db2.gz URKRFMUNIBXRTG-FZKQIMNGSA-N 0 3 407.739 4.353 20 0 HIADHN C[C@H](NC[C@H]1CN(Cc2ccccc2)CCCO1)c1sccc1Br ZINC000390846076 855457693 /nfs/dbraw/zinc/45/76/93/855457693.db2.gz FLHILXJUUCWOQJ-RDJZCZTQSA-N 0 3 409.393 4.452 20 0 HIADHN COc1ccc([C@H](C)NCc2cc(Br)c(OC)c(OC)c2)cc1OC ZINC000392326417 855464185 /nfs/dbraw/zinc/46/41/85/855464185.db2.gz ZGTMTBVKGVPXAS-LBPRGKRZSA-N 0 3 410.308 4.334 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)c1cc(Cl)ncc1Br ZINC000398038146 855475537 /nfs/dbraw/zinc/47/55/37/855475537.db2.gz OBYRGWHLNDIOHI-QGZVFWFLSA-N 0 3 424.770 4.384 20 0 HIADHN C[C@H]1C[C@H](NC(=O)c2ccc(Cl)cc2Br)CN1Cc1ccccc1 ZINC000398163062 855476547 /nfs/dbraw/zinc/47/65/47/855476547.db2.gz WLACXCIGRUHWDC-BBRMVZONSA-N 0 3 407.739 4.495 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cscc3Br)c(C)c2)CC1 ZINC000404762511 855481902 /nfs/dbraw/zinc/48/19/02/855481902.db2.gz JQLRLONUGKFYOV-UHFFFAOYSA-N 0 3 408.365 4.213 20 0 HIADHN CC(C)n1cc(Br)cc1C(=O)N[C@@]1(C)CCN(Cc2ccccc2)C1 ZINC000405980834 855482750 /nfs/dbraw/zinc/48/27/50/855482750.db2.gz DKYLNMIIQWMPDP-FQEVSTJZSA-N 0 3 404.352 4.226 20 0 HIADHN Cc1cc(-c2noc(CCC(=O)N[C@@H]3CCN([C@@H](C)c4ccccc4)C3)n2)ccc1F ZINC000409453692 855486535 /nfs/dbraw/zinc/48/65/35/855486535.db2.gz PYGLKGWEXONGLX-FXAWDEMLSA-N 0 3 422.504 4.068 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)c3sc(-c4ccc(C)o4)nc3C)cc2)CC1 ZINC000409658788 855588770 /nfs/dbraw/zinc/58/87/70/855588770.db2.gz ZDTGFURXPKDKQP-UHFFFAOYSA-N 0 3 424.570 4.410 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)Nc1ccccc1C(F)(F)F ZINC000409685591 855601641 /nfs/dbraw/zinc/60/16/41/855601641.db2.gz JDJWOJTVBYZBNW-UHFFFAOYSA-N 0 3 420.479 4.429 20 0 HIADHN COc1ccc(CN(CC2CC2)C(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)c(OC)c1 ZINC000409734782 855627193 /nfs/dbraw/zinc/62/71/93/855627193.db2.gz SAUGVHLOQFAQSF-ISKFKSNPSA-N 0 3 423.557 4.071 20 0 HIADHN C[C@@H]1CCN(C(=O)C(C)(C)Cc2nc3ccccc3[nH]2)CCN1Cc1ccccc1 ZINC000409755251 855637555 /nfs/dbraw/zinc/63/75/55/855637555.db2.gz QKGZKUBPEAPMIA-LJQANCHMSA-N 0 3 404.558 4.255 20 0 HIADHN C[C@H](NC(=O)Cc1c(F)ccc(Br)c1F)[C@H](c1ccccc1)N(C)C ZINC000409946376 855739102 /nfs/dbraw/zinc/73/91/02/855739102.db2.gz HMCPZRSFKVEBGT-HXPMCKFVSA-N 0 3 411.290 4.077 20 0 HIADHN CCC(=O)Nc1cccc(C(=O)N[C@@H](CN2CCc3ccccc3C2)C(C)(C)C)c1 ZINC000410050014 855800122 /nfs/dbraw/zinc/80/01/22/855800122.db2.gz AOOLLXFDSXAEHN-QFIPXVFZSA-N 0 3 407.558 4.238 20 0 HIADHN CC(C)(C)[C@@H](CN1CCc2ccccc2C1)NC(=O)c1ccc(NC(=O)C2CC2)cc1 ZINC000410055112 855803108 /nfs/dbraw/zinc/80/31/08/855803108.db2.gz UPKFBNSOFHNZCS-HSZRJFAPSA-N 0 3 419.569 4.238 20 0 HIADHN CC1CCN([C@@H](CNC(=O)N[C@@H]2CCCC23CCOCC3)c2cccs2)CC1 ZINC000410091244 855814824 /nfs/dbraw/zinc/81/48/24/855814824.db2.gz YTDDCQJLHHQWEE-AZUAARDMSA-N 0 3 405.608 4.170 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1C[C@H](C)O[C@@H](c2ccccc2)C1)c1ccsc1 ZINC000410120224 855828774 /nfs/dbraw/zinc/82/87/74/855828774.db2.gz TVAGGGGPHGORQY-IOMROCGXSA-N 0 3 401.576 4.303 20 0 HIADHN Fc1cccc(CN2CCC[C@H](c3nc(-c4ccnc(OC(F)F)c4)no3)C2)c1 ZINC000410165872 855846618 /nfs/dbraw/zinc/84/66/18/855846618.db2.gz KAHDBRDHASWUGR-HNNXBMFYSA-N 0 3 404.392 4.252 20 0 HIADHN C[C@@H](Oc1ccc(Cl)c(Cl)c1)C(=O)N(Cc1ccco1)C1CCN(C)CC1 ZINC000410179405 855851751 /nfs/dbraw/zinc/85/17/51/855851751.db2.gz ALRCEQRQHBZBGF-CQSZACIVSA-N 0 3 411.329 4.477 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)N1CCC[C@H](c2ncc3n2CCCC3)C1 ZINC000410253591 855882605 /nfs/dbraw/zinc/88/26/05/855882605.db2.gz CWEUAJHGXYGSNX-KRWDZBQOSA-N 0 3 406.530 4.047 20 0 HIADHN COc1cccc(CCNC(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)c1 ZINC000410331074 855933309 /nfs/dbraw/zinc/93/33/09/855933309.db2.gz SPMOZXYHAYSBTD-FQEVSTJZSA-N 0 3 401.576 4.072 20 0 HIADHN CN(C)C(=O)COc1cccc(CN[C@@H](Cc2cccnc2)c2cccc(Cl)c2)c1 ZINC000425937800 856009946 /nfs/dbraw/zinc/00/99/46/856009946.db2.gz TXOFLUBBSRGVRN-QHCPKHFHSA-N 0 3 423.944 4.276 20 0 HIADHN CN1CC[C@H](NC(=O)NCc2ccnc(Oc3ccccc3F)c2)[C@@H]1c1ccccc1 ZINC000425975948 856025933 /nfs/dbraw/zinc/02/59/33/856025933.db2.gz DJADZQMRWXVWDX-REWPJTCUSA-N 0 3 420.488 4.258 20 0 HIADHN CC[C@@H](C)[C@H](NC(=O)N1CCN(C2CCOCC2)C[C@@H]1C)c1ccc(Cl)cc1 ZINC000426025262 856055253 /nfs/dbraw/zinc/05/52/53/856055253.db2.gz YSIGQGRLKYPCFO-WWMYMODYSA-N 0 3 407.986 4.322 20 0 HIADHN COC(=O)C1CCC(N[C@H](c2cccc(OC)c2)c2cc(F)ccc2OC)CC1 ZINC000426077716 856090655 /nfs/dbraw/zinc/09/06/55/856090655.db2.gz MFFQGTIPMUTATL-IVMBPFOVSA-N 0 3 401.478 4.254 20 0 HIADHN CC(C)c1ccc(-c2ncc(CN3CC[C@@H](C(=O)NCC(F)(F)F)C3)s2)cc1 ZINC000426151403 856141403 /nfs/dbraw/zinc/14/14/03/856141403.db2.gz XHQSBJJGBXPXLC-MRXNPFEDSA-N 0 3 411.493 4.434 20 0 HIADHN C[C@@H]1CN(C2CCOCC2)CCN1C(=O)N[C@@H]1CCc2ccc(-c3ccccc3)cc21 ZINC000426188043 856164753 /nfs/dbraw/zinc/16/47/53/856164753.db2.gz SUDCADRGXWUQFS-KBMIEXCESA-N 0 3 419.569 4.236 20 0 HIADHN Cc1ccccc1C(NC(=O)N1CCN(C2CCOCC2)C[C@@H]1C)c1ccccc1C ZINC000426219425 856184145 /nfs/dbraw/zinc/18/41/45/856184145.db2.gz HYUDANQEBUTFGA-NRFANRHFSA-N 0 3 421.585 4.288 20 0 HIADHN C[C@H](NC(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C)c1nc(C(F)(F)F)cs1 ZINC000426238913 856196290 /nfs/dbraw/zinc/19/62/90/856196290.db2.gz MJZKBJMKFNHNRC-YDHLFZDLSA-N 0 3 412.481 4.043 20 0 HIADHN CC(C)[C@H](NC(=O)N1CCN(C2CCOCC2)C[C@H]1C)c1ccc(Cl)cc1F ZINC000426251602 856202763 /nfs/dbraw/zinc/20/27/63/856202763.db2.gz MAGFPCMUTUBIHK-QRWLVFNGSA-N 0 3 411.949 4.071 20 0 HIADHN C[C@@H](CC(=O)Nc1ccccc1C(F)(F)F)NCc1cc2ccccc2n(C)c1=O ZINC000426305814 856235204 /nfs/dbraw/zinc/23/52/04/856235204.db2.gz DOMYGYLULKHFPJ-AWEZNQCLSA-N 0 3 417.431 4.064 20 0 HIADHN Cc1ncc([C@H](C)N[C@H](Cc2ccc(F)cc2)[C@@H]2COc3ccccc3O2)c(C)n1 ZINC000426313699 856240022 /nfs/dbraw/zinc/24/00/22/856240022.db2.gz NSLAAWICTYJVKQ-FBOFTVOISA-N 0 3 407.489 4.334 20 0 HIADHN COc1ccccc1[C@@H](NC(=O)NC[C@H]1CCCN1Cc1ccccc1)c1ccco1 ZINC000426466548 856305691 /nfs/dbraw/zinc/30/56/91/856305691.db2.gz CPEHXKOTKFUMMB-HYBUGGRVSA-N 0 3 419.525 4.341 20 0 HIADHN Cc1cccc2[nH]c(CCC(=O)NCC3CCN(Cc4ccccc4Cl)CC3)nc21 ZINC000426710086 856426294 /nfs/dbraw/zinc/42/62/94/856426294.db2.gz HNZDNBUZYSMZOX-UHFFFAOYSA-N 0 3 424.976 4.486 20 0 HIADHN CC(C)Oc1cccc(CN(C)[C@@H](C)c2cccc(N3CCCS3(=O)=O)c2)c1 ZINC000426747860 856452704 /nfs/dbraw/zinc/45/27/04/856452704.db2.gz SIRNMVRRAYXZGD-SFHVURJKSA-N 0 3 402.560 4.207 20 0 HIADHN COCCOc1ccc(C(F)(F)F)cc1NC(=O)[C@H](C)N1C[C@@H]2CCCC[C@H]2C1 ZINC000426769040 856467827 /nfs/dbraw/zinc/46/78/27/856467827.db2.gz FKTBRIYPGHCXSE-JYJNAYRXSA-N 0 3 414.468 4.180 20 0 HIADHN Cc1ccc(NC(=O)[C@H](C)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)c(Cl)c1 ZINC000426789989 856479123 /nfs/dbraw/zinc/47/91/23/856479123.db2.gz ZJYMYRPGNQZVDD-OTWHNJEPSA-N 0 3 422.013 4.187 20 0 HIADHN COc1ccccc1[C@H](NC(=O)N(CCN(C)C)Cc1cccc(C)c1)c1ccco1 ZINC000426800146 856485754 /nfs/dbraw/zinc/48/57/54/856485754.db2.gz MYMLDYODPKWEFL-DEOSSOPVSA-N 0 3 421.541 4.459 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(F)cc2)CC1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000426881834 856525247 /nfs/dbraw/zinc/52/52/47/856525247.db2.gz GKLDWMZRZXSVLM-QZTJIDSGSA-N 0 3 422.953 4.304 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)N[C@@H](c3ccco3)c3ccccc3)CC2)c1 ZINC000426889197 856527679 /nfs/dbraw/zinc/52/76/79/856527679.db2.gz DJXKZXCARGAWSW-RUZDIDTESA-N 0 3 403.526 4.006 20 0 HIADHN C[C@H](C(=O)Nc1cccc(-c2cn(Cc3ccccc3)nn2)c1)N1[C@H](C)CC[C@H]1C ZINC000426957086 856562317 /nfs/dbraw/zinc/56/23/17/856562317.db2.gz WQZWQCXZBHWDQA-GUDVDZBRSA-N 0 3 403.530 4.193 20 0 HIADHN CN1C[C@H](NC(=O)c2cc3ccccc3n2CC(F)(F)F)[C@H](c2ccccc2)C1 ZINC000426986437 856581161 /nfs/dbraw/zinc/58/11/61/856581161.db2.gz KYVLZNUABCGNPF-ROUUACIJSA-N 0 3 401.432 4.031 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1ccc(NC(C)C)nc1 ZINC000427056475 856613872 /nfs/dbraw/zinc/61/38/72/856613872.db2.gz GGUHVBSLHWNRRN-NRFANRHFSA-N 0 3 418.545 4.106 20 0 HIADHN Cc1ccc(-c2c[nH]cc2C(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)s1 ZINC000427149774 856670902 /nfs/dbraw/zinc/67/09/02/856670902.db2.gz JROJXGDEEFLJSN-CALCHBBNSA-N 0 3 415.603 4.403 20 0 HIADHN C[C@H]1CCN(C(=O)c2ccc(N3CCCCCC3)nc2)CCN1Cc1ccccc1 ZINC000437467609 862829972 /nfs/dbraw/zinc/82/99/72/862829972.db2.gz AAULFRKIWUVBTK-NRFANRHFSA-N 0 3 406.574 4.199 20 0 HIADHN Cc1ccc(S[C@H](C)C(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)cc1 ZINC000427286477 856751370 /nfs/dbraw/zinc/75/13/70/856751370.db2.gz GADGKTDOXFFABA-VAMGGRTRSA-N 0 3 404.620 4.214 20 0 HIADHN Cc1cc(C(=O)CCC(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)c(C)s1 ZINC000427291388 856754736 /nfs/dbraw/zinc/75/47/36/856754736.db2.gz FUGJCUULRYYNRW-IRXDYDNUSA-N 0 3 420.619 4.066 20 0 HIADHN Cc1ccc(-c2cc(C(=O)N3CCC(CCN4C[C@H](C)O[C@@H](C)C4)CC3)on2)cc1 ZINC000427290362 856755374 /nfs/dbraw/zinc/75/53/74/856755374.db2.gz ZQSNWTKYAHRWIC-OALUTQOASA-N 0 3 411.546 4.002 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)c3csc(-c4ccccc4)n3)CC2)C[C@H](C)O1 ZINC000427292263 856755611 /nfs/dbraw/zinc/75/56/11/856755611.db2.gz OQQYCYJPYAZTLP-ROUUACIJSA-N 0 3 413.587 4.162 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)c3cccc(-c4cscn4)c3)CC2)C[C@H](C)O1 ZINC000427294386 856756371 /nfs/dbraw/zinc/75/63/71/856756371.db2.gz FATPHCFEQCKFQC-ROUUACIJSA-N 0 3 413.587 4.162 20 0 HIADHN C[C@@H]1CCN(C(=O)Cc2csc(Cc3ccccc3)n2)CCN1Cc1ccccc1 ZINC000437471180 862832919 /nfs/dbraw/zinc/83/29/19/862832919.db2.gz JAXWFTHQTJFMML-HXUWFJFHSA-N 0 3 419.594 4.399 20 0 HIADHN Cc1nc(C(C)(C)C)sc1C(=O)N1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000427298828 856758465 /nfs/dbraw/zinc/75/84/65/856758465.db2.gz GYLGLNQOVJOOIL-HOTGVXAUSA-N 0 3 407.624 4.101 20 0 HIADHN Cc1ccc(C(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)cc1Br ZINC000427298931 856759459 /nfs/dbraw/zinc/75/94/59/856759459.db2.gz HYVRLTBBQUZNPZ-IRXDYDNUSA-N 0 3 423.395 4.109 20 0 HIADHN Cc1sc(-c2ccco2)nc1C(=O)N1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000427299389 856759597 /nfs/dbraw/zinc/75/95/97/856759597.db2.gz MIOJNJMGLMZHBV-HOTGVXAUSA-N 0 3 417.575 4.063 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3cc(Oc4ccccc4)ccn3)CC2)C[C@@H](C)O1 ZINC000427299376 856760035 /nfs/dbraw/zinc/76/00/35/856760035.db2.gz MDIOQFWTWUSBSC-WOJBJXKFSA-N 0 3 423.557 4.225 20 0 HIADHN Cc1ccc(C(=O)CCC(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)cc1C ZINC000427303902 856760829 /nfs/dbraw/zinc/76/08/29/856760829.db2.gz FHKVPKLBGGWTCW-NHCUHLMSSA-N 0 3 414.590 4.004 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)CCc3ccc(-c4ccccc4)[nH]3)CC2)C[C@@H](C)O1 ZINC000427315073 856767253 /nfs/dbraw/zinc/76/72/53/856767253.db2.gz SVNVSCASMIBNJL-NHCUHLMSSA-N 0 3 423.601 4.352 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3cc(-c4ccccc4)ns3)CC2)C[C@@H](C)O1 ZINC000427319792 856767646 /nfs/dbraw/zinc/76/76/46/856767646.db2.gz JOGAJUAAOIRIDZ-QZTJIDSGSA-N 0 3 413.587 4.162 20 0 HIADHN CCCOc1ccc(CCC(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)cc1 ZINC000427321748 856769488 /nfs/dbraw/zinc/76/94/88/856769488.db2.gz QSXIWDHAUOEZOB-NHCUHLMSSA-N 0 3 416.606 4.146 20 0 HIADHN Cc1ccc2c(CCC(=O)N3CCC(CCN4C[C@@H](C)O[C@H](C)C4)CC3)c[nH]c2c1 ZINC000427321876 856769960 /nfs/dbraw/zinc/76/99/60/856769960.db2.gz QYLIHIQLXCYHCW-WOJBJXKFSA-N 0 3 411.590 4.147 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)Cc3c[nH]c4cc(Cl)ccc34)CC2)C[C@H](C)O1 ZINC000427320956 856770531 /nfs/dbraw/zinc/77/05/31/856770531.db2.gz NVTJDWIPFBGKJG-IRXDYDNUSA-N 0 3 417.981 4.102 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)Cc1cccc(F)c1F ZINC000427361894 856793923 /nfs/dbraw/zinc/79/39/23/856793923.db2.gz ZDUALTVPUXGBCL-UHFFFAOYSA-N 0 3 400.391 4.117 20 0 HIADHN Cc1nc(C2CCCC2)sc1C(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000427362043 856794083 /nfs/dbraw/zinc/79/40/83/856794083.db2.gz IDSDSKGROZJZLS-IAGOWNOFSA-N 0 3 419.635 4.461 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)c1ccc(-c2nc(C3CC3)no2)cc1 ZINC000427379987 856801864 /nfs/dbraw/zinc/80/18/64/856801864.db2.gz QAWQJRJVXMTSFV-UHFFFAOYSA-N 0 3 424.932 4.471 20 0 HIADHN CN(C)Cc1cccc(NC(=O)C(=O)N[C@H]2CCc3ccc(-c4ccccc4)cc32)c1 ZINC000427402410 856807490 /nfs/dbraw/zinc/80/74/90/856807490.db2.gz CLFGLVPDYRRTQF-DEOSSOPVSA-N 0 3 413.521 4.157 20 0 HIADHN O=C(Cc1csc(Cc2cccc(Cl)c2)n1)NC[C@H]1CCCCN1C1CC1 ZINC000427445235 856823491 /nfs/dbraw/zinc/82/34/91/856823491.db2.gz ZFPSRDWMSNFLHI-LJQANCHMSA-N 0 3 403.979 4.063 20 0 HIADHN CCCN(CC)C(=O)c1ccc(C(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)cc1 ZINC000437482982 862841260 /nfs/dbraw/zinc/84/12/60/862841260.db2.gz FPUSGSOGJCOINT-OAQYLSRUSA-N 0 3 421.585 4.295 20 0 HIADHN C[C@@]1(CNC(=O)C(=O)Nc2cccc3ccsc32)CCCN1Cc1ccccc1 ZINC000427505845 856844386 /nfs/dbraw/zinc/84/43/86/856844386.db2.gz PICFDBCXVYXIEP-QHCPKHFHSA-N 0 3 407.539 4.011 20 0 HIADHN CN(Cc1ccc(Br)c(F)c1)C(=O)c1cccc(CN2CCCC2)c1 ZINC000427568553 856870706 /nfs/dbraw/zinc/87/07/06/856870706.db2.gz HSXIHBNRMPKCII-UHFFFAOYSA-N 0 3 405.311 4.456 20 0 HIADHN O=C1CCCN1Cc1cccc(CN[C@@H]2CCCc3ncc(C(F)(F)F)cc32)c1 ZINC000427583879 856877961 /nfs/dbraw/zinc/87/79/61/856877961.db2.gz RSXPJBXSWUEGTG-LJQANCHMSA-N 0 3 403.448 4.390 20 0 HIADHN COc1cc([C@@H](C)N[C@@H]2CCCc3ncc(C(F)(F)F)cc32)ccc1OCCO ZINC000427583928 856877973 /nfs/dbraw/zinc/87/79/73/856877973.db2.gz SDZYQGFKGONXGG-FZKQIMNGSA-N 0 3 410.436 4.208 20 0 HIADHN CCn1ncc(C(=O)N(C)C2CCN(Cc3ccccc3)CC2)c1-c1ccccc1 ZINC000427608717 856887124 /nfs/dbraw/zinc/88/71/24/856887124.db2.gz HQIMNOJEFOIUIB-UHFFFAOYSA-N 0 3 402.542 4.307 20 0 HIADHN C[C@@H]1CN(Cc2cccc(CN[C@@H]3CCCc4ncc(C(F)(F)F)cc43)c2)CCO1 ZINC000427617931 856889673 /nfs/dbraw/zinc/88/96/73/856889673.db2.gz LNHRBVDECQTQBS-IIBYNOLFSA-N 0 3 419.491 4.488 20 0 HIADHN C[C@H]1CCN(C(=O)CCCc2nnc(-c3ccccc3)o2)CCN1Cc1ccccc1 ZINC000437494120 862851060 /nfs/dbraw/zinc/85/10/60/862851060.db2.gz JXRWMAMEADLVQK-FQEVSTJZSA-N 0 3 418.541 4.182 20 0 HIADHN O=C(CC1(N2CCOCC2)CCCC1)N[C@H]1C[C@H](c2cccc(C(F)(F)F)c2)C1 ZINC000437503186 862856693 /nfs/dbraw/zinc/85/66/93/862856693.db2.gz WSCIAPSBQNAQQB-UAPYVXQJSA-N 0 3 410.480 4.103 20 0 HIADHN C[C@H](CC(=O)Nc1ccc(NC(=O)C2CC2)cc1)NCc1ccc(Cl)cc1F ZINC000427847358 856980147 /nfs/dbraw/zinc/98/01/47/856980147.db2.gz CIUMUSADZFIBDE-CYBMUJFWSA-N 0 3 403.885 4.335 20 0 HIADHN Cc1sc(CNC(=O)[C@H]2CCCN2C2CCOCC2)nc1-c1ccc(Cl)cc1 ZINC000427928999 857012162 /nfs/dbraw/zinc/01/21/62/857012162.db2.gz NIJGNIYYMMCTIA-GOSISDBHSA-N 0 3 419.978 4.032 20 0 HIADHN C[C@@H](C(=O)NC[C@H](c1cccs1)N1CCC(C)CC1)c1ccc2c(c1)OCO2 ZINC000428006582 857039178 /nfs/dbraw/zinc/03/91/78/857039178.db2.gz PCAADJKLESDHNB-SJLPKXTDSA-N 0 3 400.544 4.170 20 0 HIADHN O=C(NCc1ccco1)c1cccc(CN(CCc2ccccc2)[C@@H]2CCOC2)c1 ZINC000437534531 862871101 /nfs/dbraw/zinc/87/11/01/862871101.db2.gz JMJNFOJSAIACHL-HSZRJFAPSA-N 0 3 404.510 4.043 20 0 HIADHN COc1ccc(NC(=O)C2(NCc3cccc(OC(F)F)c3)CCCC2)cc1OC ZINC000428401052 857191247 /nfs/dbraw/zinc/19/12/47/857191247.db2.gz OMVUBOFWQRFETL-UHFFFAOYSA-N 0 3 420.456 4.346 20 0 HIADHN CN(Cc1cc(Br)ccc1OCc1ccccn1)[C@@H]1CCCC[C@H]1O ZINC000428460725 857209654 /nfs/dbraw/zinc/20/96/54/857209654.db2.gz ORQHVEXOZHWEDR-RTBURBONSA-N 0 3 405.336 4.158 20 0 HIADHN CCCOc1cccc(CN(C)[C@H](C)c2cccc(N3CCCS3(=O)=O)c2)c1 ZINC000428474812 857213605 /nfs/dbraw/zinc/21/36/05/857213605.db2.gz LZGNXRDTQHIRSC-GOSISDBHSA-N 0 3 402.560 4.208 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)N2CCC(c3ncccc3Cl)CC2)C1 ZINC000428475714 857216306 /nfs/dbraw/zinc/21/63/06/857216306.db2.gz AJBCXBCLTITHCW-PXNSSMCTSA-N 0 3 412.965 4.460 20 0 HIADHN C[C@@H](c1cccc(N2CCCS2(=O)=O)c1)N(C)C/C=C\c1ccc(F)cc1F ZINC000428481411 857219170 /nfs/dbraw/zinc/21/91/70/857219170.db2.gz NJPIYOMPFDOJEQ-OUOZUETKSA-N 0 3 406.498 4.211 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)c1cc2ccccc2n1CC(F)(F)F ZINC000428528938 857242577 /nfs/dbraw/zinc/24/25/77/857242577.db2.gz FNXZUPMXZFIVBF-SFHVURJKSA-N 0 3 417.431 4.023 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)c1ccc(COc2ccccc2)cc1 ZINC000428527672 857242967 /nfs/dbraw/zinc/24/29/67/857242967.db2.gz BIJWRZNGHDTHLB-QHCPKHFHSA-N 0 3 402.494 4.085 20 0 HIADHN CCc1[nH]c(-c2ccc(Cl)cc2)nc1C(=O)Nc1cccc(CN2CC[C@H](O)C2)c1 ZINC000428535547 857247525 /nfs/dbraw/zinc/24/75/25/857247525.db2.gz HSWPGLNBGSFBMP-IBGZPJMESA-N 0 3 424.932 4.111 20 0 HIADHN Cc1ccc(C(=O)Nc2cccc(CN3CC[C@H](O)C3)c2)c(Sc2ccccc2)n1 ZINC000428533300 857247690 /nfs/dbraw/zinc/24/76/90/857247690.db2.gz DERKIEOAIZSONU-FQEVSTJZSA-N 0 3 419.550 4.360 20 0 HIADHN COc1cc(C2(C(=O)Nc3cccc(CN4CC[C@H](O)C4)c3)CCCC2)ccc1C ZINC000428540377 857251376 /nfs/dbraw/zinc/25/13/76/857251376.db2.gz RKNXSFUUSYNGAI-QFIPXVFZSA-N 0 3 408.542 4.021 20 0 HIADHN COCCS(=O)(=O)c1ccc(CNCc2cccc(-c3ccc(C)cc3)c2)cc1 ZINC000428543172 857254840 /nfs/dbraw/zinc/25/48/40/857254840.db2.gz HBQUDSHXPPFKRZ-UHFFFAOYSA-N 0 3 409.551 4.372 20 0 HIADHN COc1ccc(C2(C(=O)Nc3cccc(CN4CC[C@H](O)C4)c3)CCCCC2)cc1 ZINC000428551462 857259835 /nfs/dbraw/zinc/25/98/35/857259835.db2.gz KPQWVUBAYYCLAP-QFIPXVFZSA-N 0 3 408.542 4.102 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@@H](O)C2)c1)[C@@H](Oc1ccccc1)c1ccccc1 ZINC000428550287 857260127 /nfs/dbraw/zinc/26/01/27/857260127.db2.gz QRARRKOCCPFQMF-VWNXMTODSA-N 0 3 402.494 4.012 20 0 HIADHN COc1ccc(OCc2ccccn2)c(CNC[C@@]2(CO)C[C@H]2c2ccc(F)cc2)c1 ZINC000428557890 857265301 /nfs/dbraw/zinc/26/53/01/857265301.db2.gz JYOWAYWMMDRXMS-UKILVPOCSA-N 0 3 422.500 4.064 20 0 HIADHN CC(C)(c1ccc(C(=O)Nc2cccc(CN3CC[C@@H](O)C3)c2)cc1)C(F)(F)F ZINC000428555800 857265534 /nfs/dbraw/zinc/26/55/34/857265534.db2.gz ZRVZTLRBWOTDQA-LJQANCHMSA-N 0 3 406.448 4.345 20 0 HIADHN COc1ccc2nc(CNC[C@@]3(Cc4ccc(F)cc4)CCC[C@@H]3O)sc2c1 ZINC000428571144 857269173 /nfs/dbraw/zinc/26/91/73/857269173.db2.gz JFLTVWOMADCDLH-UNMCSNQZSA-N 0 3 400.519 4.308 20 0 HIADHN COc1cc(NC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)c(OC)cc1Cl ZINC000437574396 862894278 /nfs/dbraw/zinc/89/42/78/862894278.db2.gz FHUQFWNDZRUBKV-INIZCTEOSA-N 0 3 417.937 4.486 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)N1CCC(c2ncccc2Cl)CC1 ZINC000428692375 857298228 /nfs/dbraw/zinc/29/82/28/857298228.db2.gz JREKXSJXJAPFKM-UHFFFAOYSA-N 0 3 412.965 4.072 20 0 HIADHN CCN1CCCN(C(=O)N[C@@H](c2ccccc2)c2ccc(Br)cc2)CC1 ZINC000428691665 857298730 /nfs/dbraw/zinc/29/87/30/857298730.db2.gz NTHWNYRFYOJRIX-FQEVSTJZSA-N 0 3 416.363 4.276 20 0 HIADHN O=C(NC[C@H]1CN(Cc2ccccc2)CCCO1)Nc1ccc(Cl)cc1Cl ZINC000428689626 857298789 /nfs/dbraw/zinc/29/87/89/857298789.db2.gz CKQAACZHTMZTNW-KRWDZBQOSA-N 0 3 408.329 4.406 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CCC(c2ccncc2)CC1)c1cccc(OC)c1 ZINC000428693663 857299330 /nfs/dbraw/zinc/29/93/30/857299330.db2.gz QXRVTCVUNVLJHH-QHCPKHFHSA-N 0 3 410.562 4.062 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3CC[C@H](Cc4ccccc4)C3)c(C)c2)CC1 ZINC000437576625 862895182 /nfs/dbraw/zinc/89/51/82/862895182.db2.gz JTRJMUNLHZBELA-JOCHJYFZSA-N 0 3 406.574 4.233 20 0 HIADHN O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)Nc1cc(Cl)ccc1Cl ZINC000428701896 857302621 /nfs/dbraw/zinc/30/26/21/857302621.db2.gz QUUGFDPCQIHSPJ-QGZVFWFLSA-N 0 3 408.329 4.406 20 0 HIADHN CN(CCCCCN(C)Cc1nc2ccccc2n1C)Cc1nc2ccccc2n1C ZINC000428711599 857306546 /nfs/dbraw/zinc/30/65/46/857306546.db2.gz QRKDXPYYQQZBAZ-UHFFFAOYSA-N 0 3 418.589 4.194 20 0 HIADHN C[C@@]1(c2ccccc2)CC[C@@H](N2CCN(CC(=O)Nc3ccccc3Cl)CC2)C1 ZINC000437578155 862896151 /nfs/dbraw/zinc/89/61/51/862896151.db2.gz LASBFHOLTKBYCF-HYBUGGRVSA-N 0 3 411.977 4.407 20 0 HIADHN COC(=O)c1ccc(CN(Cc2ccncc2)[C@H]2CCCN(Cc3ccccc3)C2)o1 ZINC000428811035 857354980 /nfs/dbraw/zinc/35/49/80/857354980.db2.gz ZLQYTNNGTUTLSK-QFIPXVFZSA-N 0 3 419.525 4.128 20 0 HIADHN Cc1cccc(C)c1NC(=O)CN1CCN([C@@H]2CC[C@@](C)(c3ccccc3)C2)CC1 ZINC000437590499 862902560 /nfs/dbraw/zinc/90/25/60/862902560.db2.gz MMKOIYOKNSZCRL-ZEQKJWHPSA-N 0 3 405.586 4.370 20 0 HIADHN CCOc1cccc([C@@H](C)NC(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)c1 ZINC000428834580 857365422 /nfs/dbraw/zinc/36/54/22/857365422.db2.gz NKEUKCIEJWJCKA-HSALFYBXSA-N 0 3 417.594 4.067 20 0 HIADHN CC(C)N(CC(=O)N1CCC(C(=O)N2CCCCCC2)CC1)[C@H](C)c1ccccc1 ZINC000428870742 857379385 /nfs/dbraw/zinc/37/93/85/857379385.db2.gz GDTGGKBZAKRXDR-OAQYLSRUSA-N 0 3 413.606 4.099 20 0 HIADHN O=C(NCCCNCc1nc2ccc(F)cc2s1)c1ccc(Br)cc1 ZINC000428874520 857382689 /nfs/dbraw/zinc/38/26/89/857382689.db2.gz OELIOAZZRVTBIZ-UHFFFAOYSA-N 0 3 422.323 4.108 20 0 HIADHN CCn1cnnc1-c1ccccc1NC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000428899188 857399649 /nfs/dbraw/zinc/39/96/49/857399649.db2.gz CBGGBGKQTOSLQO-FQEVSTJZSA-N 0 3 418.545 4.093 20 0 HIADHN C[C@H](NC(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1)c1ccc(Cl)s1 ZINC000428912708 857410473 /nfs/dbraw/zinc/41/04/73/857410473.db2.gz KJJYVZBDYXDPKM-XHSDSOJGSA-N 0 3 414.015 4.383 20 0 HIADHN CN(Cc1cccc2ccccc21)C(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000429016249 857457401 /nfs/dbraw/zinc/45/74/01/857457401.db2.gz BJWRHMNKTNVVQK-XMMPIXPASA-N 0 3 417.553 4.272 20 0 HIADHN COc1ccc(Cl)c(NC(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)c1 ZINC000429046884 857474439 /nfs/dbraw/zinc/47/44/39/857474439.db2.gz ONJFNPROAZRTKE-IYBDPMFKSA-N 0 3 409.958 4.092 20 0 HIADHN Cc1ccc2cccc(NC(=O)N3CCC(CCN4C[C@@H](C)O[C@H](C)C4)CC3)c2n1 ZINC000429077192 857497145 /nfs/dbraw/zinc/49/71/45/857497145.db2.gz USOLLVYWHPXPDU-RTBURBONSA-N 0 3 410.562 4.286 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)Nc3ccc4scnc4c3)CC2)C[C@H](C)O1 ZINC000429080461 857499365 /nfs/dbraw/zinc/49/93/65/857499365.db2.gz QQCXCYKDOCKLAH-HOTGVXAUSA-N 0 3 402.564 4.040 20 0 HIADHN CC[C@@H](NC(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1)c1ccc(OC)cc1 ZINC000429208150 857555128 /nfs/dbraw/zinc/55/51/28/857555128.db2.gz ZNYBFSDPQKLPBD-SELNLUPBSA-N 0 3 417.594 4.067 20 0 HIADHN CCCn1ccnc1CCCN(C)Cc1nc2sc3c(c2c(N)n1)CC[C@H](C)C3 ZINC000429231984 857565833 /nfs/dbraw/zinc/56/58/33/857565833.db2.gz JBACIZQFFOBZIN-HNNXBMFYSA-N 0 3 412.607 4.069 20 0 HIADHN CCCn1ccnc1CCCN(C)[C@@H](C)C(=O)Nc1ccc(Br)c(C)c1 ZINC000429239802 857569516 /nfs/dbraw/zinc/56/95/16/857569516.db2.gz VEYAYWXJRDLXBE-INIZCTEOSA-N 0 3 421.383 4.256 20 0 HIADHN CCCOc1cccc(NC(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)c1 ZINC000429249552 857574256 /nfs/dbraw/zinc/57/42/56/857574256.db2.gz BVWCRBXUYTZQOJ-KDURUIRLSA-N 0 3 403.567 4.219 20 0 HIADHN CC(=O)N1CCC(N(CCCOc2c(C)cccc2C)Cc2cncs2)CC1 ZINC000429287644 857591906 /nfs/dbraw/zinc/59/19/06/857591906.db2.gz UMIZRYLWMKAHIW-UHFFFAOYSA-N 0 3 401.576 4.042 20 0 HIADHN O=C(NCC(F)(F)F)[C@@H]1CCN(Cc2cccc3c(Br)cccc23)C1 ZINC000429344614 857612057 /nfs/dbraw/zinc/61/20/57/857612057.db2.gz KJBDPZYBCVURFU-CYBMUJFWSA-N 0 3 415.253 4.103 20 0 HIADHN Cc1nc([C@H]2CCCN2C(=O)Nc2ccc(CCN3CCSCC3)cc2)cs1 ZINC000429354361 857617233 /nfs/dbraw/zinc/61/72/33/857617233.db2.gz MLWSTBFDEYVPIB-HXUWFJFHSA-N 0 3 416.616 4.412 20 0 HIADHN C[C@H](C(=O)Nc1ccccc1C(=O)c1ccccc1)N1CCN(C2CCC2)C[C@@H](C)C1 ZINC000429387789 857636801 /nfs/dbraw/zinc/63/68/01/857636801.db2.gz SONRILCXEJSLTL-VQTJNVASSA-N 0 3 419.569 4.051 20 0 HIADHN COCCS(=O)(=O)c1ccc(CN[C@H]2CCCc3c4ccccc4sc32)cc1 ZINC000429407602 857649711 /nfs/dbraw/zinc/64/97/11/857649711.db2.gz JWWMGLGURVQVEA-FQEVSTJZSA-N 0 3 415.580 4.489 20 0 HIADHN Fc1ccc([C@H](NC[C@H]2CN(Cc3ccccc3)CCCO2)c2ccccc2)nc1 ZINC000429413960 857653209 /nfs/dbraw/zinc/65/32/09/857653209.db2.gz AQPHMVFXDNSUOQ-UKILVPOCSA-N 0 3 405.517 4.191 20 0 HIADHN OC[C@@H](CN[C@@H](c1ccccc1)c1ccccn1)Cc1ccc(Br)cc1 ZINC000429417530 857655429 /nfs/dbraw/zinc/65/54/29/857655429.db2.gz GVCNJTIYJXPYDS-GCJKJVERSA-N 0 3 411.343 4.374 20 0 HIADHN COC1(C[C@H](C)N[C@@H](c2cccc(S(C)(=O)=O)c2)c2ccc(F)c(F)c2)CCC1 ZINC000429417152 857655474 /nfs/dbraw/zinc/65/54/74/857655474.db2.gz KJQZPSCNCJMRSG-BTYIYWSLSA-N 0 3 423.525 4.395 20 0 HIADHN COCCS(=O)(=O)c1ccc(CN[C@@H](Cc2ccccc2)c2ccccc2)cc1 ZINC000429424925 857659997 /nfs/dbraw/zinc/65/99/97/857659997.db2.gz DJQRTALDVVHROI-DEOSSOPVSA-N 0 3 409.551 4.180 20 0 HIADHN C[C@@H](CNC(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1)Sc1ccccc1 ZINC000429427147 857661126 /nfs/dbraw/zinc/66/11/26/857661126.db2.gz OOWYDBZIFSWGRJ-AQNXPRMDSA-N 0 3 419.635 4.088 20 0 HIADHN CC(C)(C)[C@@H](CN1CCc2ccccc2C1)NC(=O)N1CCC[C@H]1c1ccncc1 ZINC000429492729 857694603 /nfs/dbraw/zinc/69/46/03/857694603.db2.gz QLPWDHQRRNPXNC-XZOQPEGZSA-N 0 3 406.574 4.401 20 0 HIADHN CC(C)(C)[C@H](CN1CCc2ccccc2C1)NC(=O)N1CCC[C@@H]1c1ccncc1 ZINC000429492725 857694885 /nfs/dbraw/zinc/69/48/85/857694885.db2.gz QLPWDHQRRNPXNC-PKTZIBPZSA-N 0 3 406.574 4.401 20 0 HIADHN CC(C)(C)[C@@H](CN1CCc2ccccc2C1)NC(=O)N1CCC[C@@H]1c1cccnc1 ZINC000429495324 857697109 /nfs/dbraw/zinc/69/71/09/857697109.db2.gz VGLBGYOQKSEBKF-DHIUTWEWSA-N 0 3 406.574 4.401 20 0 HIADHN CO[C@@H]1CCCC[C@@H]1NCC(=O)N1N=C(c2cccs2)C[C@@H]1c1cccs1 ZINC000429530454 857723885 /nfs/dbraw/zinc/72/38/85/857723885.db2.gz SPKKDDPYYOHUFP-USXIJHARSA-N 0 3 403.573 4.035 20 0 HIADHN CN(C)CCN(C[C@H]1CCCO1)C(=O)Nc1ccc(C(C)(C)C(F)(F)F)cc1 ZINC000429691855 857836917 /nfs/dbraw/zinc/83/69/17/857836917.db2.gz PXMOXVCYNDYGMD-QGZVFWFLSA-N 0 3 401.473 4.101 20 0 HIADHN O=C(NC[C@H]1CN(Cc2ccccc2)CCCO1)Nc1ccc2nc(C3CC3)oc2c1 ZINC000429774185 857880735 /nfs/dbraw/zinc/88/07/35/857880735.db2.gz SOCIDLIFQNDFKL-FQEVSTJZSA-N 0 3 420.513 4.118 20 0 HIADHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)c1c[nH]c(C(F)(F)F)c1 ZINC000429822159 857898448 /nfs/dbraw/zinc/89/84/48/857898448.db2.gz GOOWQNWSOQUXRC-UHFFFAOYSA-N 0 3 418.257 4.000 20 0 HIADHN C[C@H]1CCCCN1CCNC(=O)C(C)(C)c1csc(-c2c(F)cccc2F)n1 ZINC000429834284 857902984 /nfs/dbraw/zinc/90/29/84/857902984.db2.gz YVOJJEAXILUZJI-AWEZNQCLSA-N 0 3 407.530 4.357 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)[C@H](C)[C@@H]3OCCc4sccc43)c(C)c2)CC1 ZINC000429845862 857908535 /nfs/dbraw/zinc/90/85/35/857908535.db2.gz KWOKVRDLRUTGNW-VGSWGCGISA-N 0 3 413.587 4.087 20 0 HIADHN CCN(CC)[C@H](CNC(=O)[C@@H](C)[C@H]1OCCc2sccc21)c1cccc(OC)c1 ZINC000429857705 857914148 /nfs/dbraw/zinc/91/41/48/857914148.db2.gz KPFAWPOGFSJZBF-SAWYMBPVSA-N 0 3 416.587 4.206 20 0 HIADHN COc1ccccc1-c1ncc(CN2CCC[C@@H](C(=O)Nc3ccccc3)C2)cn1 ZINC000430012095 857996682 /nfs/dbraw/zinc/99/66/82/857996682.db2.gz FAYHFFYVRRTZKY-LJQANCHMSA-N 0 3 402.498 4.003 20 0 HIADHN Clc1ccc(OCC2CC2)c(CNC[C@H]2CC[C@@H](c3nc(C4CC4)no3)O2)c1 ZINC000430038791 858007392 /nfs/dbraw/zinc/00/73/92/858007392.db2.gz YGRJAMKVKOWCAB-MJGOQNOKSA-N 0 3 403.910 4.399 20 0 HIADHN Cn1c(SC[C@H]2CN(Cc3ccccc3)CCCO2)nnc1-c1ccc(F)cc1 ZINC000430124361 858042052 /nfs/dbraw/zinc/04/20/52/858042052.db2.gz RBXTXSJQFQAFHR-HXUWFJFHSA-N 0 3 412.534 4.004 20 0 HIADHN CCn1c(SC[C@H]2CN(Cc3ccccc3)CCCO2)nnc1-c1cccs1 ZINC000430124961 858043150 /nfs/dbraw/zinc/04/31/50/858043150.db2.gz SVRFEHJDZPPVCR-GOSISDBHSA-N 0 3 414.600 4.410 20 0 HIADHN O=C(N[C@H]1C[C@@H]1c1ccccc1OC(F)F)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000437649226 862981331 /nfs/dbraw/zinc/98/13/31/862981331.db2.gz IYKTZQGIEMTAHF-SXLOBPIMSA-N 0 3 415.484 4.108 20 0 HIADHN COc1ccccc1-c1ncc(CN2C[C@@H](C)N(Cc3ccccc3)C[C@@H]2C)cn1 ZINC000430246627 858095342 /nfs/dbraw/zinc/09/53/42/858095342.db2.gz SDAOACDWTAUJAC-UXHICEINSA-N 0 3 402.542 4.247 20 0 HIADHN CNC(=O)[C@]1(C)CCN([C@@H](C)c2nc3cc(Cl)ccc3n2Cc2ccccc2)C1 ZINC000430251038 858096726 /nfs/dbraw/zinc/09/67/26/858096726.db2.gz BVUWZIDSNAPBPR-QMHKHESXSA-N 0 3 410.949 4.257 20 0 HIADHN COc1ccccc1-c1ncc(CN2CCC(CN3CCc4ccccc43)CC2)cn1 ZINC000430253410 858097171 /nfs/dbraw/zinc/09/71/71/858097171.db2.gz SWZNOKZOPRVCKL-UHFFFAOYSA-N 0 3 414.553 4.427 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)c2cccc(Br)c2F)cc1 ZINC000430271120 858103705 /nfs/dbraw/zinc/10/37/05/858103705.db2.gz WSXCHHZGEUFSBD-GOSISDBHSA-N 0 3 421.310 4.164 20 0 HIADHN C[C@@H]1C[C@]2(CCO1)CN(CCC(=O)Nc1ccccc1Oc1ccccc1)C[C@H](C)O2 ZINC000430270692 858104139 /nfs/dbraw/zinc/10/41/39/858104139.db2.gz SLRXNSNRFBKJHE-OHUGHZGNSA-N 0 3 424.541 4.466 20 0 HIADHN CN(C(=O)N[C@H](CC1CC1)c1cc(F)cc(Br)c1)[C@H]1CCN(C2CC2)C1 ZINC000430295538 858111628 /nfs/dbraw/zinc/11/16/28/858111628.db2.gz CYGILVIMKDYZCI-RBUKOAKNSA-N 0 3 424.358 4.308 20 0 HIADHN CN(C(=O)[C@@H]1CCN(CCc2cc(Cl)c3c(c2)OCCCO3)C1)c1ccccc1 ZINC000430296247 858112567 /nfs/dbraw/zinc/11/25/67/858112567.db2.gz INFPRHMUHBBWFX-GOSISDBHSA-N 0 3 414.933 4.029 20 0 HIADHN c1csc(-c2noc(CCCN(CCc3ccccn3)Cc3cccnc3)n2)c1 ZINC000430323227 858121184 /nfs/dbraw/zinc/12/11/84/858121184.db2.gz SFEGZCJNPPJXCP-UHFFFAOYSA-N 0 3 405.527 4.266 20 0 HIADHN CN(C(=O)[C@H]1CCN(Cc2cccc(C(=O)Nc3ccccc3)c2)C1)c1ccccc1 ZINC000430324516 858122281 /nfs/dbraw/zinc/12/22/81/858122281.db2.gz QUNBTTRNZDMJTL-QFIPXVFZSA-N 0 3 413.521 4.424 20 0 HIADHN Cc1cc(CN2CCSCC2)ccc1NS(=O)(=O)c1c(C)cc(F)cc1C ZINC000430390135 858143104 /nfs/dbraw/zinc/14/31/04/858143104.db2.gz WYPBKOYCRTYILG-UHFFFAOYSA-N 0 3 408.564 4.101 20 0 HIADHN CC[C@@H](N[C@H](C)c1ccc(Br)c(S(N)(=O)=O)c1)c1ccc(C)cc1 ZINC000430692907 858271741 /nfs/dbraw/zinc/27/17/41/858271741.db2.gz XFPWMNCOVHIMKP-CXAGYDPISA-N 0 3 411.365 4.207 20 0 HIADHN Cc1cccc(C)c1[C@H](C)N[C@@H](C)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000430737359 858281543 /nfs/dbraw/zinc/28/15/43/858281543.db2.gz WRTLBJAJMHZXSE-KBPBESRZSA-N 0 3 411.365 4.125 20 0 HIADHN C[C@@H]1C[C@]2(CCO1)CN(Cc1ccc(-n3ccc(C(F)(F)F)n3)cc1)C[C@H](C)O2 ZINC000430766177 858296117 /nfs/dbraw/zinc/29/61/17/858296117.db2.gz KQFBXWHEXORBMZ-GQIGUUNPSA-N 0 3 409.452 4.050 20 0 HIADHN CCN(CC)[C@H](CN1C(=O)N[C@H](c2ccc(OC)c(Cl)c2)C1=O)c1ccsc1 ZINC000430870822 858347682 /nfs/dbraw/zinc/34/76/82/858347682.db2.gz VLZUVSNELKDXSF-SJLPKXTDSA-N 0 3 421.950 4.086 20 0 HIADHN C[C@H](NC(=O)N1CCC[C@@H]1c1ccc(Br)c(F)c1)C1=CCN(C)CC1 ZINC000430892269 858357531 /nfs/dbraw/zinc/35/75/31/858357531.db2.gz CLTBPBUDDFCSDU-SCLBCKFNSA-N 0 3 410.331 4.085 20 0 HIADHN C[C@H]1C(=O)N(C[C@@H](c2cccs2)N2CCC(C)CC2)C(=O)N1Cc1ccccc1 ZINC000430946045 858378788 /nfs/dbraw/zinc/37/87/88/858378788.db2.gz USUQGERYVGWWPT-ICSRJNTNSA-N 0 3 411.571 4.374 20 0 HIADHN CN1C(=O)N([C@H]2CCN(Cc3ccccc3)C2)C(=O)[C@@H]1c1ccc(Cl)c(Cl)c1 ZINC000430981115 858391342 /nfs/dbraw/zinc/39/13/42/858391342.db2.gz WCODOKHNUSGTLD-LPHOPBHVSA-N 0 3 418.324 4.203 20 0 HIADHN CN(Cc1cccnc1)C[C@@H]1CCN(C(=O)N[C@H]2CC[C@@H](c3ccccc3F)C2)C1 ZINC000431056773 858423563 /nfs/dbraw/zinc/42/35/63/858423563.db2.gz LQXWYEGWVXNIHW-HBMCJLEFSA-N 0 3 410.537 4.020 20 0 HIADHN COCCCOc1cccc(NC(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000431119475 858454781 /nfs/dbraw/zinc/45/47/81/858454781.db2.gz JXFAQJNNUIQGSE-JOCHJYFZSA-N 0 3 411.546 4.230 20 0 HIADHN CCc1noc(-c2ccc(C)c(NC(=O)N(CCN(C)C)Cc3ccccc3)c2)n1 ZINC000431127241 858458455 /nfs/dbraw/zinc/45/84/55/858458455.db2.gz JHEXLDYIDHDMAJ-UHFFFAOYSA-N 0 3 407.518 4.203 20 0 HIADHN CCc1noc(-c2ccc(C)c(NC(=O)NC[C@H]3CCCN3Cc3ccccc3)c2)n1 ZINC000431130677 858460650 /nfs/dbraw/zinc/46/06/50/858460650.db2.gz YMPADOLHQSEISC-HXUWFJFHSA-N 0 3 419.529 4.394 20 0 HIADHN Cc1ccccc1[C@H](OC[C@@H](O)CN1CC[C@H](Oc2ccncc2)C1)c1ccccc1 ZINC000431166371 858481403 /nfs/dbraw/zinc/48/14/03/858481403.db2.gz IUTDIDXULRYOPB-LLZJGCNPSA-N 0 3 418.537 4.010 20 0 HIADHN O=C1N[C@H](c2ccc3ccccc3c2)C(=O)N1C[C@H]1CCCN(Cc2cccs2)C1 ZINC000431166955 858482593 /nfs/dbraw/zinc/48/25/93/858482593.db2.gz MJIFHJMPFNETSX-HTAPYJJXSA-N 0 3 419.550 4.406 20 0 HIADHN Cc1cc(Cl)cc2c1OCCC[C@@H]2NCc1ccc(CN2CCOCC2)cc1 ZINC000431349206 858574174 /nfs/dbraw/zinc/57/41/74/858574174.db2.gz KWTOLBNSCURMIA-QFIPXVFZSA-N 0 3 400.950 4.484 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)c2cccc(OCC(F)(F)F)c2)CC1 ZINC000431483176 858638772 /nfs/dbraw/zinc/63/87/72/858638772.db2.gz IQFFUIUAJDQKKK-UHFFFAOYSA-N 0 3 406.448 4.364 20 0 HIADHN NC(=O)C1CCN(Cc2cccc(NC(=O)c3c(Cl)cc(F)cc3Cl)c2)CC1 ZINC000431484136 858639003 /nfs/dbraw/zinc/63/90/03/858639003.db2.gz CCXMGAPEDIXOFB-UHFFFAOYSA-N 0 3 424.303 4.082 20 0 HIADHN COc1cnccc1N1CCN(C(=O)Nc2ccccc2SC2CCCC2)CC1 ZINC000431812935 858823772 /nfs/dbraw/zinc/82/37/72/858823772.db2.gz ONKFUZAVCFJITQ-UHFFFAOYSA-N 0 3 412.559 4.479 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)c2ccc3c(ccn3Cc3ccccc3)c2)C[C@H](C)O1 ZINC000431837979 858834323 /nfs/dbraw/zinc/83/43/23/858834323.db2.gz OLAOMPROJHTAFS-OYRHEFFESA-N 0 3 419.569 4.309 20 0 HIADHN COc1cnccc1N1CCN(C(=O)Nc2ccc3c(c2)oc2ccccc23)CC1 ZINC000431882367 858854658 /nfs/dbraw/zinc/85/46/58/858854658.db2.gz KCIYSDDXTNBLOH-UHFFFAOYSA-N 0 3 402.454 4.344 20 0 HIADHN CC[C@H](CNC(=O)C1(Cc2ccc(F)cc2)CCOCC1)N1CCc2ccccc2C1 ZINC000431956719 858886960 /nfs/dbraw/zinc/88/69/60/858886960.db2.gz VCMSLHWBMZDUSO-XMMPIXPASA-N 0 3 424.560 4.118 20 0 HIADHN CN1CC[C@H](NC(=O)NCC[C@@H](c2ccccc2)C(F)(F)F)[C@@H]1c1ccccc1 ZINC000432079689 858973896 /nfs/dbraw/zinc/97/38/96/858973896.db2.gz NHSGKBPHIKANCE-UFYCRDLUSA-N 0 3 405.464 4.467 20 0 HIADHN Cc1cc(NC(=O)NC[C@H]2CCC(F)(F)C2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000432273784 859079588 /nfs/dbraw/zinc/07/95/88/859079588.db2.gz DFNWAZFXUYDRPD-RBUKOAKNSA-N 0 3 417.504 4.195 20 0 HIADHN Cc1cc(NC(=O)N[C@@H]2C[C@H]2c2ccccc2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000432276915 859080393 /nfs/dbraw/zinc/08/03/93/859080393.db2.gz KRJFNYFDVWNDGU-RJGXRXQPSA-N 0 3 415.541 4.316 20 0 HIADHN CCOc1cc(CN2CCCO[C@H](CC)C2)ccc1OCC(=O)Nc1ccccc1 ZINC000467562737 881385735 /nfs/dbraw/zinc/38/57/35/881385735.db2.gz CQVAICNNOKNOHW-OAQYLSRUSA-N 0 3 412.530 4.104 20 0 HIADHN COc1ccc(-c2cncc(C(=O)N3CC[C@H](C)N(Cc4ccccc4)CC3)c2)cc1 ZINC000467580447 881395235 /nfs/dbraw/zinc/39/52/35/881395235.db2.gz VMVNRBJYHRWRQC-FQEVSTJZSA-N 0 3 415.537 4.494 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)NCCc2cccc(C(F)(F)F)n2)N2CCCC2)cc1 ZINC000432549074 859220751 /nfs/dbraw/zinc/22/07/51/859220751.db2.gz GXULHOOKAUYHLG-LJQANCHMSA-N 0 3 420.479 4.088 20 0 HIADHN CC[C@H](CNC(=O)NCCC1CC(OC(C)(C)C)C1)N1CCc2ccccc2C1 ZINC000432863821 859394889 /nfs/dbraw/zinc/39/48/89/859394889.db2.gz JSHURIVBFROBNP-NFOQDIRWSA-N 0 3 401.595 4.106 20 0 HIADHN Cc1cnc(C2CCN(Cc3cn(C)nc3-c3ccc4c(c3)OCCCO4)CC2)s1 ZINC000432942223 859440128 /nfs/dbraw/zinc/44/01/28/859440128.db2.gz DLVOWRMIEIUOLE-UHFFFAOYSA-N 0 3 424.570 4.393 20 0 HIADHN COc1ccccc1-c1noc(C2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1 ZINC000433020544 859482174 /nfs/dbraw/zinc/48/21/74/859482174.db2.gz NVIYGXZXTMBHJT-UHFFFAOYSA-N 0 3 406.486 4.083 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@@H](C)SCCN(C)Cc2ccccc2)cc1F ZINC000433033618 859490533 /nfs/dbraw/zinc/49/05/33/859490533.db2.gz VYFLPVOHWOTZBM-QGZVFWFLSA-N 0 3 404.551 4.046 20 0 HIADHN C[C@H](SCCN(C)Cc1ccccc1)C(=O)Nc1cccc(N2CCCC2=O)c1 ZINC000433047955 859498407 /nfs/dbraw/zinc/49/84/07/859498407.db2.gz VEURLVADSUIJOD-SFHVURJKSA-N 0 3 411.571 4.006 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)c2cncc(-c3ccc(Cl)cc3)c2)C[C@@H](C)O1 ZINC000467629983 881429687 /nfs/dbraw/zinc/42/96/87/881429687.db2.gz OHZNIUOONKRTJZ-IAGOWNOFSA-N 0 3 401.938 4.021 20 0 HIADHN COCCC[C@@H](NCc1ccc(NC(C)=O)nc1)c1ccc(Br)cc1 ZINC000433098597 859520769 /nfs/dbraw/zinc/52/07/69/859520769.db2.gz WBLHOBOINQOCKQ-GOSISDBHSA-N 0 3 406.324 4.060 20 0 HIADHN C/C=C\c1ccc(OC[C@H](O)CN2CCC(c3ncc(C)s3)CC2)c(OC)c1 ZINC000433146955 859539831 /nfs/dbraw/zinc/53/98/31/859539831.db2.gz BSDMWHWPXODWFR-PHWHVTFISA-N 0 3 402.560 4.113 20 0 HIADHN CCN1CC[C@H](N[C@H](C)c2cc(C(=O)OC)c(C)o2)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000433206554 859566150 /nfs/dbraw/zinc/56/61/50/859566150.db2.gz OBCLZNOZNOWFJE-MSIBFWPZSA-N 0 3 410.436 4.278 20 0 HIADHN COc1cccc([C@H](CNC(=O)NCCC2CC(OC(C)(C)C)C2)N2CCCC2)c1 ZINC000433289516 859619563 /nfs/dbraw/zinc/61/95/63/859619563.db2.gz QBESEZSVBGSSPU-UDJZJCJKSA-N 0 3 417.594 4.115 20 0 HIADHN O=C(Nc1ccc2c(c1)CCN2C(=O)c1cccnc1)[C@@H]1CCCCN1C1CCCC1 ZINC000433339576 859654308 /nfs/dbraw/zinc/65/43/08/859654308.db2.gz AYGJGNUACUEJOO-QHCPKHFHSA-N 0 3 418.541 4.020 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)NCCC1CC(OC(C)(C)C)C1 ZINC000433485666 859727093 /nfs/dbraw/zinc/72/70/93/859727093.db2.gz ANAUROFMACKYFW-UHFFFAOYSA-N 0 3 410.002 4.397 20 0 HIADHN C[C@H](NC(=O)NC[C@@H]1CCCCN1C1CC1)c1cccc(OCc2ccccn2)c1 ZINC000433553295 859772866 /nfs/dbraw/zinc/77/28/66/859772866.db2.gz DYNFYIQSMLXQDP-AVRDEDQJSA-N 0 3 408.546 4.038 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CC[C@H](CC(F)(F)F)C1)c1cccc(OC)c1 ZINC000433566531 859782471 /nfs/dbraw/zinc/78/24/71/859782471.db2.gz UFYPMLPYFOKXSM-CRAIPNDOSA-N 0 3 401.473 4.062 20 0 HIADHN COc1cc(NC(=O)N(CCN(C)C)Cc2cccc(F)c2)ccc1OC(C)C ZINC000467671428 881464484 /nfs/dbraw/zinc/46/44/84/881464484.db2.gz KNPOFBNWERCULX-UHFFFAOYSA-N 0 3 403.498 4.217 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)N[C@H](c1cc(F)ccc1F)C(F)F ZINC000433617763 859812560 /nfs/dbraw/zinc/81/25/60/859812560.db2.gz OOZVVADGEHJXOR-RBUKOAKNSA-N 0 3 409.427 4.407 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)N[C@@H](c1cc(F)ccc1F)C(F)F ZINC000433647215 859823180 /nfs/dbraw/zinc/82/31/80/859823180.db2.gz CDRXCIBZCJJURH-OALUTQOASA-N 0 3 409.427 4.407 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)Nc3ccc(Oc4ncc(Cl)cn4)c(Cl)c3)[C@@H]2C1 ZINC000433670866 859832619 /nfs/dbraw/zinc/83/26/19/859832619.db2.gz SZQCHENCLWTCFX-MLGOLLRUSA-N 0 3 422.316 4.134 20 0 HIADHN CCNC(=O)Nc1cccc(NC(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)c1C ZINC000433722678 859853889 /nfs/dbraw/zinc/85/38/89/859853889.db2.gz DKKLWMUGQRJAQA-HXUWFJFHSA-N 0 3 423.561 4.265 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CC[C@](C)(c4ccc(C)cc4)C3)c2)CC1 ZINC000433820063 859911492 /nfs/dbraw/zinc/91/14/92/859911492.db2.gz CLIGJVGTOUVAMC-VWLOTQADSA-N 0 3 406.574 4.332 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)c2ccccc2OCc2cscn2)CN1Cc1ccccc1 ZINC000467689598 881482160 /nfs/dbraw/zinc/48/21/60/881482160.db2.gz WGGQKMRTVHNLMS-IEBWSBKVSA-N 0 3 407.539 4.115 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Nc1cccc(-c2noc(C3CC3)n2)c1 ZINC000434074156 860083595 /nfs/dbraw/zinc/08/35/95/860083595.db2.gz AYFBWGMNLXQXHG-UHFFFAOYSA-N 0 3 411.531 4.271 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)c2ccccc2NCc2cccnc2)C1 ZINC000434086828 860093702 /nfs/dbraw/zinc/09/37/02/860093702.db2.gz ICYYARPPQWAVSP-UGKGYDQZSA-N 0 3 400.526 4.259 20 0 HIADHN COc1ccc(-c2cc(C(=O)Nc3ccc(-n4ccnc4)c(Cl)c3)[nH]n2)cc1OC ZINC000434103549 860107645 /nfs/dbraw/zinc/10/76/45/860107645.db2.gz ZCNQWGQUFILCSU-UHFFFAOYSA-N 0 3 423.860 4.185 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N(C)Cc3cc(F)cc(F)c3)c(C)c2)CC1 ZINC000434230449 860215671 /nfs/dbraw/zinc/21/56/71/860215671.db2.gz GUKNKSKTRSRFNX-UHFFFAOYSA-N 0 3 402.489 4.079 20 0 HIADHN Cc1nc(-c2ccccc2Br)sc1[C@@H](C)NC(=O)CN(C)C(C)C ZINC000467714722 881513009 /nfs/dbraw/zinc/51/30/09/881513009.db2.gz JJFOAUOCCDUKRX-GFCCVEGCSA-N 0 3 410.381 4.398 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)Cc1ccc2c(c1)CCC2 ZINC000434313204 860274419 /nfs/dbraw/zinc/27/44/19/860274419.db2.gz ULEUBKYOSBIMAY-XMMPIXPASA-N 0 3 414.553 4.308 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)Cc1cc(C)ccc1C ZINC000434313004 860274938 /nfs/dbraw/zinc/27/49/38/860274938.db2.gz RTVYDJSOXSTRQR-QHCPKHFHSA-N 0 3 402.542 4.437 20 0 HIADHN CCC(CC)n1nccc1C(=O)Nc1c(C)cnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000434315606 860275356 /nfs/dbraw/zinc/27/53/56/860275356.db2.gz JOEWFIFNZCSOCM-OAQYLSRUSA-N 0 3 420.561 4.448 20 0 HIADHN COc1ccc(C)cc1CC(=O)Nc1c(C)cnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000434315329 860275978 /nfs/dbraw/zinc/27/59/78/860275978.db2.gz BTQOBYCLRSZIOY-QFIPXVFZSA-N 0 3 418.541 4.137 20 0 HIADHN CC[C@H](C)c1cc(C(=O)Nc2c(C)cnn2[C@@H]2CCN(Cc3ccccc3)C2)on1 ZINC000434322714 860283024 /nfs/dbraw/zinc/28/30/24/860283024.db2.gz XJLUKHTXCVZHFA-QFBILLFUSA-N 0 3 407.518 4.392 20 0 HIADHN CC[C@H](C)c1cc(C(=O)Nc2c(C)cnn2[C@H]2CCN(Cc3ccccc3)C2)on1 ZINC000434322713 860283269 /nfs/dbraw/zinc/28/32/69/860283269.db2.gz XJLUKHTXCVZHFA-LPHOPBHVSA-N 0 3 407.518 4.392 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)COc1ccc(Cl)cc1 ZINC000434331749 860293849 /nfs/dbraw/zinc/29/38/49/860293849.db2.gz DGGKAUBYFACMFG-FQEVSTJZSA-N 0 3 424.932 4.309 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1ccn(C2CCCC2)n1 ZINC000434334153 860296813 /nfs/dbraw/zinc/29/68/13/860296813.db2.gz IMUCXNXLASWYIO-NRFANRHFSA-N 0 3 418.545 4.202 20 0 HIADHN CCOc1ccc(C(=O)Nc2c(C)cnn2[C@@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000434336305 860297395 /nfs/dbraw/zinc/29/73/95/860297395.db2.gz ZMHRPIKNGSKJGX-OAQYLSRUSA-N 0 3 404.514 4.290 20 0 HIADHN Cc1nn(C(C)(C)C)c2nc(C3CC3)cc(C(=O)NC[C@H]3CCCCN3C3CC3)c12 ZINC000434443809 860354649 /nfs/dbraw/zinc/35/46/49/860354649.db2.gz DCYPBXFXXHPYPS-GOSISDBHSA-N 0 3 409.578 4.119 20 0 HIADHN CCCNc1ccc(CNC(=O)N(CCN(C)C)Cc2ccc(F)cc2F)cc1 ZINC000434452985 860356710 /nfs/dbraw/zinc/35/67/10/860356710.db2.gz HSHIVDYUDINWAJ-UHFFFAOYSA-N 0 3 404.505 4.060 20 0 HIADHN Cc1c(F)cccc1NC(=O)CCN1CCC(C(=O)c2cc(F)ccc2F)CC1 ZINC000434570450 860408467 /nfs/dbraw/zinc/40/84/67/860408467.db2.gz AJCCJUYTOZVMQZ-UHFFFAOYSA-N 0 3 404.432 4.336 20 0 HIADHN COc1ccccc1CN(CCC(=O)Nc1cc(OC)c(Cl)cc1OC)C1CC1 ZINC000434608185 860426565 /nfs/dbraw/zinc/42/65/65/860426565.db2.gz OUCOWSNZVCKYLV-UHFFFAOYSA-N 0 3 418.921 4.359 20 0 HIADHN C[C@@H](N[C@@H]1CCCN(CC(F)(F)F)C1=O)c1cccc(OCc2ccccc2)c1 ZINC000434632659 860441679 /nfs/dbraw/zinc/44/16/79/860441679.db2.gz ZIOGBHXVYMDBPY-OXQOHEQNSA-N 0 3 406.448 4.470 20 0 HIADHN COc1ccc(CN2CCC(c3ncc4n3CCCC4)CC2)cc1Br ZINC000434676348 860454973 /nfs/dbraw/zinc/45/49/73/860454973.db2.gz QGIPVVYAWNAEIA-UHFFFAOYSA-N 0 3 404.352 4.370 20 0 HIADHN C[C@H](C(=O)Nc1ccc(C(F)(F)F)cc1)N1CCC(c2ncc3n2CCCC3)CC1 ZINC000434682877 860458518 /nfs/dbraw/zinc/45/85/18/860458518.db2.gz BIPXRBGOCWFYOG-OAHLLOKOSA-N 0 3 420.479 4.445 20 0 HIADHN C[C@@H](Oc1ccc(-c2ccccc2)cc1)C(=O)NCCCCN1C[C@@H](C)O[C@@H](C)C1 ZINC000434754615 860481836 /nfs/dbraw/zinc/48/18/36/860481836.db2.gz GKFYKKCJFXNHGW-QHAWAJNXSA-N 0 3 410.558 4.127 20 0 HIADHN Cc1onc(-c2c(F)cccc2Cl)c1C(=O)NCCCCN1C[C@@H](C)O[C@H](C)C1 ZINC000434789424 860494714 /nfs/dbraw/zinc/49/47/14/860494714.db2.gz MPEKKJXYYLBFPY-ZIAGYGMSSA-N 0 3 423.916 4.062 20 0 HIADHN CCc1ccc([C@H](CNC(=O)Nc2cc(OC)c(OC)c(C)c2OC)N(C)C)cc1 ZINC000434892675 860539184 /nfs/dbraw/zinc/53/91/84/860539184.db2.gz ULHAJCZMJBLUEB-IBGZPJMESA-N 0 3 415.534 4.008 20 0 HIADHN COc1cc(CN2CCC[C@H](C(N)=O)C2)ccc1OCc1ccc(Cl)cc1Cl ZINC000434976550 860582854 /nfs/dbraw/zinc/58/28/54/860582854.db2.gz COSAAKAWCOGZST-HNNXBMFYSA-N 0 3 423.340 4.278 20 0 HIADHN COc1cc(CN(Cc2ccc(F)cc2)C2CC2)ccc1OCC(=O)N1CCCC1 ZINC000434980539 860583716 /nfs/dbraw/zinc/58/37/16/860583716.db2.gz ACKIXMMGXZHIBJ-UHFFFAOYSA-N 0 3 412.505 4.000 20 0 HIADHN CCOc1cc(CN2CCC[C@@H](C(N)=O)C2)ccc1OCc1c(F)cccc1Cl ZINC000434983945 860586031 /nfs/dbraw/zinc/58/60/31/860586031.db2.gz XQESGWFYQYEDGU-MRXNPFEDSA-N 0 3 420.912 4.154 20 0 HIADHN CN(Cc1cn(Cc2ccccc2)nc1C(C)(C)C)C1CCN(c2cnccn2)CC1 ZINC000435059771 860621924 /nfs/dbraw/zinc/62/19/24/860621924.db2.gz IQZGNTFEYYKXCT-UHFFFAOYSA-N 0 3 418.589 4.120 20 0 HIADHN CC(C)[C@@H](CNC(=O)Nc1ccc(CCN2CCSCC2)cc1)c1cccnc1 ZINC000435128323 860653828 /nfs/dbraw/zinc/65/38/28/860653828.db2.gz CRWBFILMBUXYFZ-JOCHJYFZSA-N 0 3 412.603 4.234 20 0 HIADHN Cc1cc(NC(=O)CCOCc2ccccc2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435273402 860711761 /nfs/dbraw/zinc/71/17/61/860711761.db2.gz ZFZWSWFJFNVVDR-HSZRJFAPSA-N 0 3 418.541 4.184 20 0 HIADHN Cc1cc(NC(=O)[C@H](C)Oc2ccccc2F)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435275072 860712567 /nfs/dbraw/zinc/71/25/67/860712567.db2.gz OMPJEBXCHRXBFU-ICSRJNTNSA-N 0 3 422.504 4.184 20 0 HIADHN CCCc1ncc(C(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)s1 ZINC000435280990 860716395 /nfs/dbraw/zinc/71/63/95/860716395.db2.gz PCHCVJMIPXZXOE-GOSISDBHSA-N 0 3 409.559 4.300 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Cn1cc(-c2ccccc2)c(C)n1)c1cccc(OC)c1 ZINC000435327509 860739241 /nfs/dbraw/zinc/73/92/41/860739241.db2.gz NHFLKXHEUFJAPU-XMMPIXPASA-N 0 3 420.557 4.066 20 0 HIADHN COc1cccc([C@@H](C)C(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000435369006 860767025 /nfs/dbraw/zinc/76/70/25/860767025.db2.gz CMBMDJPHNRQXNB-WIYYLYMNSA-N 0 3 404.514 4.081 20 0 HIADHN C[C@@H](C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)c1ccc(F)c(F)c1 ZINC000435372951 860770771 /nfs/dbraw/zinc/77/07/71/860770771.db2.gz CFGAFNRCZMKPCX-APWZRJJASA-N 0 3 410.468 4.351 20 0 HIADHN CCOc1c(F)cccc1C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435377061 860773990 /nfs/dbraw/zinc/77/39/90/860773990.db2.gz XQVJKYKDIJEEHQ-SFHVURJKSA-N 0 3 408.477 4.120 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)c1cnc(-c2ccco2)s1 ZINC000435377153 860774108 /nfs/dbraw/zinc/77/41/08/860774108.db2.gz YMGFYAQJPFBQCP-QGZVFWFLSA-N 0 3 419.510 4.299 20 0 HIADHN CC[C@@H](Oc1ccccc1C)C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435378067 860774741 /nfs/dbraw/zinc/77/47/41/860774741.db2.gz GYBMIIWBUQYZNW-FCHUYYIVSA-N 0 3 418.541 4.435 20 0 HIADHN CC[C@H](Oc1ccccc1C)C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435378069 860774864 /nfs/dbraw/zinc/77/48/64/860774864.db2.gz GYBMIIWBUQYZNW-VXKWHMMOSA-N 0 3 418.541 4.435 20 0 HIADHN Cc1cc(NC(=O)N[C@H](C)Cc2cccs2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435518085 860836536 /nfs/dbraw/zinc/83/65/36/860836536.db2.gz SHDMCBCPMXBZPR-YLJYHZDGSA-N 0 3 423.586 4.453 20 0 HIADHN Cc1cc(NC(=O)NCc2cccc(C)c2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435526613 860842409 /nfs/dbraw/zinc/84/24/09/860842409.db2.gz ISWUAVIGKURYRS-QFIPXVFZSA-N 0 3 403.530 4.269 20 0 HIADHN C[C@@H]1CN(Cc2cccc(CNCc3ccc(N(C)c4ccccc4)nc3)c2)CCO1 ZINC000435777589 861053537 /nfs/dbraw/zinc/05/35/37/861053537.db2.gz DIYONBXWDGHKSQ-OAQYLSRUSA-N 0 3 416.569 4.360 20 0 HIADHN C[C@H](NC(=O)NC[C@@H](Cc1ccccc1)N(C)C)c1ccc(Br)s1 ZINC000435843826 861105680 /nfs/dbraw/zinc/10/56/80/861105680.db2.gz GZQISMABRQRERW-DZGCQCFKSA-N 0 3 410.381 4.044 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(Br)cc1)C(=O)N[C@@H]1CCOc2ccccc21 ZINC000435881003 861139532 /nfs/dbraw/zinc/13/95/32/861139532.db2.gz MYTXNSTWHUBTOF-PMUMKWKESA-N 0 3 403.320 4.128 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(Br)cc1)C(=O)Nc1ccc2c(c1)OCCCO2 ZINC000435887173 861144396 /nfs/dbraw/zinc/14/43/96/861144396.db2.gz AJDHSJNGAXLJFH-KBPBESRZSA-N 0 3 419.319 4.288 20 0 HIADHN CCOC(=O)Cn1nc(C)c(CNCc2ccc(-c3ccc(OC)cc3)s2)c1C ZINC000437781392 863099996 /nfs/dbraw/zinc/09/99/96/863099996.db2.gz ZKYZREJXPWVIQS-UHFFFAOYSA-N 0 3 413.543 4.090 20 0 HIADHN Cc1ccc2cc(C[NH2+]Cc3nnc(-c4ccc(Br)cc4)[n-]3)ccc2n1 ZINC000437792273 863110228 /nfs/dbraw/zinc/11/02/28/863110228.db2.gz KUTXNPVPLWWCRB-UHFFFAOYSA-N 0 3 408.303 4.381 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N[C@H]1C[C@H](c2cccc(F)c2)C1 ZINC000437868822 863228744 /nfs/dbraw/zinc/22/87/44/863228744.db2.gz PGKAQUJMQWWESD-OOFWROHXSA-N 0 3 413.459 4.176 20 0 HIADHN Cc1ccc(S(=O)(=O)N[C@@H](CCN(C)Cc2cccc(C)n2)c2ccccc2)cc1 ZINC000437902500 863277072 /nfs/dbraw/zinc/27/70/72/863277072.db2.gz ZXCVXPYKAOLWPC-DEOSSOPVSA-N 0 3 423.582 4.240 20 0 HIADHN CN(C)Cc1cccc(NC(=O)N(C)[C@H]2CCOc3ccc(Br)cc32)c1 ZINC000437919575 863295254 /nfs/dbraw/zinc/29/52/54/863295254.db2.gz DTPOIZUQNAHPCD-SFHVURJKSA-N 0 3 418.335 4.498 20 0 HIADHN C[C@@H]1CCN(C(=O)Nc2cccc(N3CCCCC3=O)c2)CCN1Cc1ccccc1 ZINC000437938665 863313519 /nfs/dbraw/zinc/31/35/19/863313519.db2.gz YMJLNZBRUUKZNR-HXUWFJFHSA-N 0 3 420.557 4.332 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)c(Cl)c1 ZINC000437956808 863329171 /nfs/dbraw/zinc/32/91/71/863329171.db2.gz TWNHVIWPSOYMBV-MRXNPFEDSA-N 0 3 414.937 4.427 20 0 HIADHN C[C@H]1C[C@H](NC(=O)N[C@H]2C[C@@H]2c2ccccc2OC(F)F)CN1Cc1ccccc1 ZINC000438016727 863375921 /nfs/dbraw/zinc/37/59/21/863375921.db2.gz WIGIUWRWVDKIHO-UUXHPUJUSA-N 0 3 415.484 4.106 20 0 HIADHN C[C@H](CNC(=O)Nc1ccc(CCN2CCSCC2)cc1)Oc1ccc(F)cc1 ZINC000438096516 863501524 /nfs/dbraw/zinc/50/15/24/863501524.db2.gz JKKISODMHWHYAB-QGZVFWFLSA-N 0 3 417.550 4.006 20 0 HIADHN COC(=O)c1ccc(COc2ccccc2CN2CC[C@@H](C)[C@@H](n3ccnc3)C2)cc1 ZINC000438104856 863514787 /nfs/dbraw/zinc/51/47/87/863514787.db2.gz MVIXOXWTLGMTMK-XXBNENTESA-N 0 3 419.525 4.332 20 0 HIADHN Cc1cccc(O[C@H](C)CNC(=O)Nc2ccc(CCN3CCSCC3)cc2)c1 ZINC000438104024 863516677 /nfs/dbraw/zinc/51/66/77/863516677.db2.gz MFIFKRORANUMTN-LJQANCHMSA-N 0 3 413.587 4.175 20 0 HIADHN COC(=O)c1ccc(COc2ccccc2CN2CC[C@H](C)[C@H](n3ccnc3)C2)cc1 ZINC000438104854 863517050 /nfs/dbraw/zinc/51/70/50/863517050.db2.gz MVIXOXWTLGMTMK-WMZHIEFXSA-N 0 3 419.525 4.332 20 0 HIADHN Cc1cnc([C@@H](NC(=O)Nc2ccc(CCN3CCSCC3)cc2)C2CC2)s1 ZINC000438108224 863522925 /nfs/dbraw/zinc/52/29/25/863522925.db2.gz YFCPQQIHXRNVJR-IBGZPJMESA-N 0 3 416.616 4.316 20 0 HIADHN C[C@@H]1CCN(C(=O)Nc2ccc(N3CCCC3=O)c(F)c2)CCN1Cc1ccccc1 ZINC000438154695 863575106 /nfs/dbraw/zinc/57/51/06/863575106.db2.gz PWOQCUQDLRRQJI-GOSISDBHSA-N 0 3 424.520 4.081 20 0 HIADHN CC(=O)N1CCCc2cc(NC(=O)N3CC[C@@H](C)N(Cc4ccccc4)CC3)ccc21 ZINC000438193692 863620980 /nfs/dbraw/zinc/62/09/80/863620980.db2.gz UQGJSWNJCLZMHS-LJQANCHMSA-N 0 3 420.557 4.114 20 0 HIADHN CSCc1cccc(CNCc2cn(C)nc2-c2ccc3c(c2)OCCCO3)c1 ZINC000438349960 863817567 /nfs/dbraw/zinc/81/75/67/863817567.db2.gz CSUHAUXDPGWCEJ-UHFFFAOYSA-N 0 3 409.555 4.401 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)N[C@@H]2C[C@H]2c2c(F)cccc2Cl)c1 ZINC000438354825 863821894 /nfs/dbraw/zinc/82/18/94/863821894.db2.gz LXSCHYFBAUHMJR-YLJYHZDGSA-N 0 3 419.928 4.117 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3ccc(OC(C)(C)C)cc3)CC2)C[C@H](C)O1 ZINC000438390078 863842525 /nfs/dbraw/zinc/84/25/25/863842525.db2.gz GRMCDVGPESBDGW-HDICACEKSA-N 0 3 403.567 4.217 20 0 HIADHN CCc1c(C(=O)CN(C)[C@@H]2CCN(Cc3ccccc3)[C@H](C)C2)[nH]c(C)c1C(C)=O ZINC000438454294 863878872 /nfs/dbraw/zinc/87/88/72/863878872.db2.gz JNKTZJJGDOVXEP-DYESRHJHSA-N 0 3 409.574 4.256 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Cc1coc(-c2ccc(Cl)cc2)n1 ZINC000438455556 863879899 /nfs/dbraw/zinc/87/98/99/863879899.db2.gz CKUSSWGMWDBYQQ-UHFFFAOYSA-N 0 3 403.935 4.189 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)[C@H]1C[C@@H]1c1cccc(Br)c1 ZINC000438462290 863885213 /nfs/dbraw/zinc/88/52/13/863885213.db2.gz SSYGYMBHWYEAOX-MSOLQXFVSA-N 0 3 407.377 4.205 20 0 HIADHN Cc1noc(C)c1COc1cccc(C(=O)N(CCN(C)C)Cc2cccs2)c1 ZINC000438463078 863885456 /nfs/dbraw/zinc/88/54/56/863885456.db2.gz UUKQNOCKUUKRBE-UHFFFAOYSA-N 0 3 413.543 4.136 20 0 HIADHN COc1ccc([C@@H](C)N[C@H](C)c2cc(F)ccc2N2CCN(C)CC2)cc1OC ZINC000467856983 881705875 /nfs/dbraw/zinc/70/58/75/881705875.db2.gz UCHSKQQZWPQGIG-IAGOWNOFSA-N 0 3 401.526 4.007 20 0 HIADHN Cc1nc(Cc2ccc(F)cc2)sc1C(=O)N(CCN(C)C)Cc1cccs1 ZINC000438477385 863895480 /nfs/dbraw/zinc/89/54/80/863895480.db2.gz RZTDMOJFFJBKQM-UHFFFAOYSA-N 0 3 417.575 4.447 20 0 HIADHN COC(=O)c1ccc(NC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)cc1Cl ZINC000438487454 863905290 /nfs/dbraw/zinc/90/52/90/863905290.db2.gz DZNFTUDGQJXGPR-MRXNPFEDSA-N 0 3 415.921 4.255 20 0 HIADHN CC[C@H]1CCN(CC(=O)NC[C@@H](c2c[nH]c3ccccc32)c2ccc(OC)cc2)C1 ZINC000438508674 863932719 /nfs/dbraw/zinc/93/27/19/863932719.db2.gz MVHPGKGTNKOOSY-PGRDOPGGSA-N 0 3 405.542 4.157 20 0 HIADHN CC(C)(C)c1cnc(NC(=O)NCCCCN2CCN(c3ccccc3)CC2)s1 ZINC000438539473 863965987 /nfs/dbraw/zinc/96/59/87/863965987.db2.gz IGBGBZJMYXQBCL-UHFFFAOYSA-N 0 3 415.607 4.165 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)c1ccc(NC(=O)c2cccs2)cc1 ZINC000438541034 863968200 /nfs/dbraw/zinc/96/82/00/863968200.db2.gz MTCMAAAVXZYQMP-UHFFFAOYSA-N 0 3 413.568 4.266 20 0 HIADHN Cc1c(Br)cccc1C(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000438554191 863984243 /nfs/dbraw/zinc/98/42/43/863984243.db2.gz UGUDIXULCYCOQD-UHFFFAOYSA-N 0 3 401.348 4.494 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)c2cccc(OCc3cscn3)c2)CC1 ZINC000438562631 863994733 /nfs/dbraw/zinc/99/47/33/863994733.db2.gz QKASPMWDQRWRFF-UHFFFAOYSA-N 0 3 421.566 4.459 20 0 HIADHN CN(C)CCN(C(=O)Nc1ccc(-c2noc(C(F)(F)F)n2)cc1)C1CCCC1 ZINC000467865931 881721418 /nfs/dbraw/zinc/72/14/18/881721418.db2.gz HBWKGJIKCOKAGS-UHFFFAOYSA-N 0 3 411.428 4.094 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Nc1cccc(OCc2cccnc2)c1 ZINC000438626266 864055128 /nfs/dbraw/zinc/05/51/28/864055128.db2.gz OCTRWVDEBRNHFR-UHFFFAOYSA-N 0 3 410.543 4.318 20 0 HIADHN COCCOc1ccc(NC(=O)N(CCN(C)C)Cc2cccs2)cc1Cl ZINC000438632042 864061216 /nfs/dbraw/zinc/06/12/16/864061216.db2.gz CCFGRJTUZGHBMN-UHFFFAOYSA-N 0 3 411.955 4.022 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Nc1ccc(F)cc1OCC(F)(F)F ZINC000438647720 864087992 /nfs/dbraw/zinc/08/79/92/864087992.db2.gz FPVBYTVAEVKYRC-UHFFFAOYSA-N 0 3 419.444 4.424 20 0 HIADHN CCN(C(=O)C(=O)Nc1ccc2[nH]c(C)cc2c1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000438663573 864113157 /nfs/dbraw/zinc/11/31/57/864113157.db2.gz DOMHVTMXBFUIDM-PGRDOPGGSA-N 0 3 418.541 4.099 20 0 HIADHN CCN(C(=O)C(=O)Nc1cccc(SC)c1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000438667417 864124180 /nfs/dbraw/zinc/12/41/80/864124180.db2.gz XIKVIMSTWNOBBD-PXNSSMCTSA-N 0 3 411.571 4.031 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Nc1ccccc1OC[C@H]1CCCCO1 ZINC000438683587 864147582 /nfs/dbraw/zinc/14/75/82/864147582.db2.gz VIHNKOOMNAISJA-GOSISDBHSA-N 0 3 417.575 4.292 20 0 HIADHN Cc1ccc(NC(=O)C(C)C)cc1NC(=O)N(CCN(C)C)Cc1cccs1 ZINC000438697909 864167635 /nfs/dbraw/zinc/16/76/35/864167635.db2.gz GLVZFZVJCPFERG-UHFFFAOYSA-N 0 3 402.564 4.247 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)Nc2ccc(N3CCCCC3)nc2)CC1 ZINC000438698815 864169913 /nfs/dbraw/zinc/16/99/13/864169913.db2.gz HTDBQFBBUJSTPI-UHFFFAOYSA-N 0 3 407.562 4.200 20 0 HIADHN Cc1ccc(C)n1-c1nc(CC(=O)N(Cc2ccccc2)C2CCN(C)CC2)cs1 ZINC000438709803 864188525 /nfs/dbraw/zinc/18/85/25/864188525.db2.gz BMPFUAHFHGTPIV-UHFFFAOYSA-N 0 3 422.598 4.216 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)CN[C@H](c2ccccc2)C(F)(F)F)CC1 ZINC000438712392 864193291 /nfs/dbraw/zinc/19/32/91/864193291.db2.gz POTROYYMMVXLRT-JOCHJYFZSA-N 0 3 419.491 4.003 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)C(=O)Nc1ccc2c(c1)oc1ccccc12 ZINC000438725472 864206761 /nfs/dbraw/zinc/20/67/61/864206761.db2.gz ROXFYBKYFQLEKE-UHFFFAOYSA-N 0 3 421.522 4.176 20 0 HIADHN O[C@@H](COc1cc(F)cc(Br)c1)CN1CCC[C@H]1c1ccsc1 ZINC000438845411 864340221 /nfs/dbraw/zinc/34/02/21/864340221.db2.gz BFPZZIOBSKLBPI-WBVHZDCISA-N 0 3 400.313 4.227 20 0 HIADHN CCc1nnc(-c2ccc(NC(=O)N(Cc3ccccc3)C3CCN(C)CC3)cc2)o1 ZINC000438887840 864371938 /nfs/dbraw/zinc/37/19/38/864371938.db2.gz QWQWPDPWGBDVCR-UHFFFAOYSA-N 0 3 419.529 4.427 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)[C@H]3C[C@@]34CCCc3ccccc34)c(C)c2)CC1 ZINC000438893562 864374089 /nfs/dbraw/zinc/37/40/89/864374089.db2.gz LFRUZPAPYTVLPZ-ZEQKJWHPSA-N 0 3 403.570 4.370 20 0 HIADHN O[C@@H]1CCCC[C@@H]1[C@H]1CCCCN1Cc1nnc(-c2ccccc2Br)o1 ZINC000439013958 864464880 /nfs/dbraw/zinc/46/48/80/864464880.db2.gz FIZXHBJLHJLDFV-KBAYOESNSA-N 0 3 420.351 4.405 20 0 HIADHN CC(C)CC(=O)Nc1cccc(CNC(=O)N(CCN(C)C)Cc2cccs2)c1 ZINC000439164083 864595401 /nfs/dbraw/zinc/59/54/01/864595401.db2.gz AFSRTSUXWLTMHZ-UHFFFAOYSA-N 0 3 416.591 4.006 20 0 HIADHN C[C@@H](NC(=O)N(CCN(C)C)Cc1cccs1)c1nc2ccccc2n1C(F)F ZINC000439205778 864629661 /nfs/dbraw/zinc/62/96/61/864629661.db2.gz ARCBCMLVTRTZED-CQSZACIVSA-N 0 3 421.517 4.327 20 0 HIADHN O=C(Nc1nc2ccsc2s1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000467922624 881796256 /nfs/dbraw/zinc/79/62/56/881796256.db2.gz XWKFPKCJCOGRHQ-UHFFFAOYSA-N 0 3 404.483 4.285 20 0 HIADHN C[C@H]1C[C@H](c2ccccc2)CCN1CC(=O)N1CCC(C(=O)Nc2ccccc2)CC1 ZINC000439312516 864745580 /nfs/dbraw/zinc/74/55/80/864745580.db2.gz FLQOPCNXHLBLGV-NZQKXSOJSA-N 0 3 419.569 4.132 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@@H]2CNC(=O)N(CCN(C)C)Cc2cccs2)cc1 ZINC000439330232 864768538 /nfs/dbraw/zinc/76/85/38/864768538.db2.gz YFDBDTKVGOIRPF-IRLDBZIGSA-N 0 3 415.603 4.298 20 0 HIADHN O=C(Nc1ccc(OCC2CC2)cc1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000467924784 881800120 /nfs/dbraw/zinc/80/01/20/881800120.db2.gz PZUMYLWBWMDFSU-UHFFFAOYSA-N 0 3 411.468 4.402 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)NCc1cccc(COC(C)(C)C)c1 ZINC000439333408 864770654 /nfs/dbraw/zinc/77/06/54/864770654.db2.gz TURRNGKJDGDSIH-UHFFFAOYSA-N 0 3 403.592 4.337 20 0 HIADHN COc1ccccc1C[C@H](NC(=O)N(CCN(C)C)Cc1cccs1)C(C)C ZINC000439487107 864849232 /nfs/dbraw/zinc/84/92/32/864849232.db2.gz QIRBZWMRBTXUIZ-FQEVSTJZSA-N 0 3 403.592 4.097 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(Cl)cc2)CC1)[C@H]1C[C@]12CCc1ccccc12 ZINC000439536506 864869382 /nfs/dbraw/zinc/86/93/82/864869382.db2.gz VQNKXVDRZYTRSV-NOZRDPDXSA-N 0 3 424.972 4.204 20 0 HIADHN CCc1ccccc1CC(=O)Nc1cc(C)nn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000467958375 881820779 /nfs/dbraw/zinc/82/07/79/881820779.db2.gz KMXDPLHGFOJXSF-HSZRJFAPSA-N 0 3 402.542 4.382 20 0 HIADHN CCc1cccc2c(C(=O)[C@H](NC3CCN(CCOC)CC3)c3ccccc3)c[nH]c21 ZINC000439639590 864966557 /nfs/dbraw/zinc/96/65/57/864966557.db2.gz BYOUHMWKWUMUKQ-RUZDIDTESA-N 0 3 419.569 4.355 20 0 HIADHN COc1ccc(NC(=O)N(CCN(C)C)Cc2ccco2)c(OCc2ccccc2)c1 ZINC000439675442 865009790 /nfs/dbraw/zinc/00/97/90/865009790.db2.gz SIUUTKBLEHYSIT-UHFFFAOYSA-N 0 3 423.513 4.463 20 0 HIADHN Cc1ccc(C(=O)NCC2CC2)cc1NC(=O)N[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000439683112 865018567 /nfs/dbraw/zinc/01/85/67/865018567.db2.gz GCPQKEJHDYOGRZ-GCJKJVERSA-N 0 3 420.557 4.092 20 0 HIADHN Cc1cc(OCC(=O)NC2CCN([C@@H](C)c3ccncc3)CC2)cc(C)c1Cl ZINC000439735519 865066928 /nfs/dbraw/zinc/06/69/28/865066928.db2.gz SFYPZJMKPSYLEX-KRWDZBQOSA-N 0 3 401.938 4.072 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)[C@H](C)Oc2ccc(C(C)(C)C)cc2)CC1 ZINC000439741088 865073067 /nfs/dbraw/zinc/07/30/67/865073067.db2.gz FGMUUARBWMWTFB-MOPGFXCFSA-N 0 3 409.574 4.488 20 0 HIADHN COc1ccc(C2(C(=O)NC3CCN([C@@H](C)c4ccncc4)CC3)CCCC2)cc1 ZINC000439742419 865073851 /nfs/dbraw/zinc/07/38/51/865073851.db2.gz USIHXNRLBHXAOT-IBGZPJMESA-N 0 3 407.558 4.244 20 0 HIADHN C[C@H](C(=O)NC1CCN([C@H](C)c2ccncc2)CC1)c1ccc(Br)s1 ZINC000439751352 865081123 /nfs/dbraw/zinc/08/11/23/865081123.db2.gz LRZLGDISHSCTGS-UONOGXRCSA-N 0 3 422.392 4.351 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)c2cc(-c3ccc(Cl)cc3)n[nH]2)CC1 ZINC000439756864 865083772 /nfs/dbraw/zinc/08/37/72/865083772.db2.gz DLILHVJBNCEBKV-OAHLLOKOSA-N 0 3 409.921 4.081 20 0 HIADHN COc1cc(C(=O)NC2CCN([C@@H](C)c3ccncc3)CC2)ccc1OC1CCCC1 ZINC000439765837 865092705 /nfs/dbraw/zinc/09/27/05/865092705.db2.gz GCTMSIWUPXUCQS-SFHVURJKSA-N 0 3 423.557 4.367 20 0 HIADHN CCN(C(=O)c1ccc(-c2nnc(C)o2)cc1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000467991462 881837518 /nfs/dbraw/zinc/83/75/18/881837518.db2.gz ZLCRHBQNNOVDKH-HTAPYJJXSA-N 0 3 404.514 4.343 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CC[C@@H](c4ccc(C)cc4C)C3)c2)CC1 ZINC000468001705 881844188 /nfs/dbraw/zinc/84/41/88/881844188.db2.gz CYNFTYBAVYERTG-OAQYLSRUSA-N 0 3 406.574 4.467 20 0 HIADHN C[C@H](C(=O)NCc1ccccc1CN1CCC(O)CC1)c1ccc2ccccc2c1 ZINC000439902648 865213555 /nfs/dbraw/zinc/21/35/55/865213555.db2.gz OCNFTUVYKBQSJI-IBGZPJMESA-N 0 3 402.538 4.216 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1cnn(CC)c1C(F)(F)F)c1ccsc1 ZINC000439905098 865215539 /nfs/dbraw/zinc/21/55/39/865215539.db2.gz SPCUAGXSBZMPHB-CQSZACIVSA-N 0 3 403.474 4.188 20 0 HIADHN CCn1ncc(NC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)c1C(F)(F)F ZINC000439910883 865219768 /nfs/dbraw/zinc/21/97/68/865219768.db2.gz RVKYVQYJDSKLEM-HNNXBMFYSA-N 0 3 409.456 4.050 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N[C@@H](c2ccc(F)cc2F)C(C)(C)C)CC1 ZINC000468010051 881849397 /nfs/dbraw/zinc/84/93/97/881849397.db2.gz STZQBFJGLZVUSI-FQEVSTJZSA-N 0 3 411.537 4.241 20 0 HIADHN Cc1ccc(-c2ccnn2C)cc1NC(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000439973226 865265887 /nfs/dbraw/zinc/26/58/87/865265887.db2.gz CBXBTKODYJEOGE-FQEVSTJZSA-N 0 3 409.559 4.416 20 0 HIADHN Cc1ccc(-c2ccnn2C)cc1NC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000439978324 865275855 /nfs/dbraw/zinc/27/58/55/865275855.db2.gz LEGULIMVGXFIFY-NRFANRHFSA-N 0 3 403.530 4.134 20 0 HIADHN COc1ccc2c(c1)[C@@H](N[C@@H](C)CC(=O)N(C)Cc1cccc(Cl)c1)CCO2 ZINC000468032876 881864274 /nfs/dbraw/zinc/86/42/74/881864274.db2.gz DEOMOLJJLIPONT-YWZLYKJASA-N 0 3 402.922 4.199 20 0 HIADHN CN(C(=O)Cc1ccc(NC(=O)[C@H]2CCCN2C2CCCC2)cc1)c1ccccc1 ZINC000440122086 865371615 /nfs/dbraw/zinc/37/16/15/865371615.db2.gz XDZUDQPNGWTUNB-HSZRJFAPSA-N 0 3 405.542 4.238 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)NCc2cccc(-c3ccccn3)c2)CC1 ZINC000440247330 865485416 /nfs/dbraw/zinc/48/54/16/865485416.db2.gz TZZZVLRJYIWMFF-UHFFFAOYSA-N 0 3 404.514 4.148 20 0 HIADHN CC(C)n1cnnc1-c1ccccc1NC(=O)NC[C@H](C)N(C)Cc1ccccc1 ZINC000440297673 865555143 /nfs/dbraw/zinc/55/51/43/865555143.db2.gz WHHONJFEMMUSIX-SFHVURJKSA-N 0 3 406.534 4.168 20 0 HIADHN Cc1ccc(-c2ccsc2C(=O)NC[C@@]2(O)CCN(Cc3ccccc3)C2)cc1 ZINC000440519574 865803090 /nfs/dbraw/zinc/80/30/90/865803090.db2.gz ZVYXESNWBWRAMI-DEOSSOPVSA-N 0 3 406.551 4.090 20 0 HIADHN COC(=O)c1cc2cc(CN3CCC(Nc4cc(OC)cc(OC)c4)CC3)ccc2o1 ZINC000440555454 865817679 /nfs/dbraw/zinc/81/76/79/865817679.db2.gz RARJOHYFDPHFRN-UHFFFAOYSA-N 0 3 424.497 4.313 20 0 HIADHN Cc1cccc(C)c1NC(=O)CNC(=O)[C@@H](C)N[C@H]1CC(C)(C)CCc2ccccc21 ZINC000440635885 865851318 /nfs/dbraw/zinc/85/13/18/865851318.db2.gz KTTXCTFAWLGMMP-KNQAVFIVSA-N 0 3 421.585 4.440 20 0 HIADHN Cc1ccccc1-c1nn(-c2ccccc2)cc1C(=O)N[C@@H]1C[C@@H](C)N(C2CC2)C1 ZINC000440915816 866011014 /nfs/dbraw/zinc/01/10/14/866011014.db2.gz MDIVNTUXLDBJAI-RTBURBONSA-N 0 3 400.526 4.203 20 0 HIADHN Cc1noc(C)c1COc1cc2ccccc2cc1C(=O)N[C@H]1C[C@H](C)N(C2CC2)C1 ZINC000440916302 866012588 /nfs/dbraw/zinc/01/25/88/866012588.db2.gz RSZLNUNADYQWQA-YWZLYKJASA-N 0 3 419.525 4.379 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)c2ccccc2CSc2nc3ccccc3[nH]2)CN1C1CC1 ZINC000440924157 866019248 /nfs/dbraw/zinc/01/92/48/866019248.db2.gz MJAHDVHQWWHSGM-DOTOQJQBSA-N 0 3 406.555 4.210 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)Cc2csc(-c3ccc(Cl)cc3Cl)n2)CN1C1CC1 ZINC000440930230 866026355 /nfs/dbraw/zinc/02/63/55/866026355.db2.gz GEETXYOWEJEMDM-DGCLKSJQSA-N 0 3 410.370 4.401 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)c2ccc(CSc3nc4ccccc4[nH]3)cc2)CN1C1CC1 ZINC000440931032 866028275 /nfs/dbraw/zinc/02/82/75/866028275.db2.gz IIVZXVHYYPOUCP-CRAIPNDOSA-N 0 3 406.555 4.210 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)Nc1ccc(COC2CCCC2)cc1 ZINC000440972919 866059039 /nfs/dbraw/zinc/05/90/39/866059039.db2.gz NWVIKRIOQCSSRL-UHFFFAOYSA-N 0 3 409.530 4.093 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)CCc2nnc(-c3ccc(Cl)cc3)o2)C1 ZINC000468115640 881939270 /nfs/dbraw/zinc/93/92/70/881939270.db2.gz RSVDZDQGPNNNMJ-JXFKEZNVSA-N 0 3 424.932 4.274 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)Nc2cc(C)ccc2Oc2ccccc2)CC1 ZINC000441125908 866219703 /nfs/dbraw/zinc/21/97/03/866219703.db2.gz YABFKIGCVVXRES-HXUWFJFHSA-N 0 3 410.562 4.182 20 0 HIADHN CCCOc1ccc(CN(CCC)C(=O)N[C@@H]2C[C@H](C)N(C3CC3)C2)cc1OC ZINC000441287358 866362105 /nfs/dbraw/zinc/36/21/05/866362105.db2.gz PDZKAVIIBQMGQB-PKOBYXMFSA-N 0 3 403.567 4.031 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)N(C)[C@@H]2CCSc3ccc(Br)cc32)CN1C1CC1 ZINC000441303697 866374972 /nfs/dbraw/zinc/37/49/72/866374972.db2.gz QBTJNKUCGFBKOS-SUYBPPKGSA-N 0 3 424.408 4.253 20 0 HIADHN COCc1nc(CNC(=O)Nc2cccc(CN(C)C)c2)c(-c2ccccc2)s1 ZINC000441316817 866387512 /nfs/dbraw/zinc/38/75/12/866387512.db2.gz VGRQSJUURUEIND-UHFFFAOYSA-N 0 3 410.543 4.340 20 0 HIADHN CCOc1cc(CN[C@@]2(CO)CCCc3ccccc32)ccc1OCC(F)(F)F ZINC000441344754 866414660 /nfs/dbraw/zinc/41/46/60/866414660.db2.gz FROHKHMNUMEISO-OAQYLSRUSA-N 0 3 409.448 4.340 20 0 HIADHN Cc1ccc([C@@H]2CCC[C@@H]2N(C)CC(=O)Nc2ccccc2N2CCCC2=O)cc1 ZINC000441355589 866425512 /nfs/dbraw/zinc/42/55/12/866425512.db2.gz KNONLBQUXVYERK-UNMCSNQZSA-N 0 3 405.542 4.328 20 0 HIADHN COc1cccc(CN(C)C(=O)CN(C)[C@H]2CCC[C@H]2c2ccc(C)cc2)c1OC ZINC000441376933 866446613 /nfs/dbraw/zinc/44/66/13/866446613.db2.gz LFOAFIYCNYOWKU-VXKWHMMOSA-N 0 3 410.558 4.239 20 0 HIADHN COc1ccc(CCN(Cc2ccccc2)C(=O)N[C@@H]2C[C@H](C)N(C3CC3)C2)cc1 ZINC000441382212 866454205 /nfs/dbraw/zinc/45/42/05/866454205.db2.gz KABOFSRYQKQLJY-SIKLNZKXSA-N 0 3 407.558 4.075 20 0 HIADHN COc1ccc(CN(C(=O)CN2CCC[C@H]2c2cccc(N(C)C)c2)C2CC2)cc1 ZINC000441434165 866511581 /nfs/dbraw/zinc/51/15/81/866511581.db2.gz KGZYOIFSDHYAMF-DEOSSOPVSA-N 0 3 407.558 4.089 20 0 HIADHN CC(C)(CC(=O)c1ccccc1)CC(=O)N1C[C@H]2CN(Cc3ccccc3)C[C@H]2C1 ZINC000441615129 866711733 /nfs/dbraw/zinc/71/17/33/866711733.db2.gz RDDZSOAHGDOPPU-ZRZAMGCNSA-N 0 3 404.554 4.266 20 0 HIADHN CC(C)c1nc2ccc(NC(=O)C(=O)N[C@@H](C)[C@@H](c3ccccc3)N(C)C)cc2s1 ZINC000441694858 866809043 /nfs/dbraw/zinc/80/90/43/866809043.db2.gz QBMWVKNRUBJRTR-YWZLYKJASA-N 0 3 424.570 4.166 20 0 HIADHN C[C@@H](NC(=O)C(=O)Nc1ccc(OC2CCCCC2)cc1)[C@@H](c1ccccc1)N(C)C ZINC000441698055 866810832 /nfs/dbraw/zinc/81/08/32/866810832.db2.gz GEKVYRRBAAXVKE-JPYJTQIMSA-N 0 3 423.557 4.144 20 0 HIADHN CC(C)Cn1ccc2cc(NC(=O)C(=O)N[C@H](C)[C@H](c3ccccc3)N(C)C)ccc21 ZINC000441698060 866810878 /nfs/dbraw/zinc/81/08/78/866810878.db2.gz GMRVQUMSPRBESW-WZONZLPQSA-N 0 3 420.557 4.043 20 0 HIADHN CC(C)Sc1c(Cl)cccc1NC(=O)C(=O)N[C@@H](C)CN1CCC[C@H](C)C1 ZINC000441739307 866828597 /nfs/dbraw/zinc/82/85/97/866828597.db2.gz QOGLHIGNGSXCGM-GJZGRUSLSA-N 0 3 411.999 4.016 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)Nc1ccc(N2CCCC[C@@H]2C)cc1C ZINC000441835229 866894355 /nfs/dbraw/zinc/89/43/55/866894355.db2.gz GVPOVHKSEPGUCW-IBGZPJMESA-N 0 3 422.573 4.321 20 0 HIADHN COc1cc(OC)cc(N(C)C(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)c1 ZINC000468159690 882026183 /nfs/dbraw/zinc/02/61/83/882026183.db2.gz ZMGVEAVZKSFRPR-NRFANRHFSA-N 0 3 422.447 4.121 20 0 HIADHN CN(C)Cc1cccc(C(=O)Nc2ccc(F)c(-c3nnc4n3CCCCC4)c2)c1 ZINC000468184774 882060104 /nfs/dbraw/zinc/06/01/04/882060104.db2.gz XWJRJQXBMFLXKL-UHFFFAOYSA-N 0 3 407.493 4.125 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N[C@@H](C)C1(c2ccccc2)CCCC1 ZINC000442545890 867520217 /nfs/dbraw/zinc/52/02/17/867520217.db2.gz WAZGEIZZWBXYQN-IBGZPJMESA-N 0 3 407.558 4.012 20 0 HIADHN COCCC[C@@H](NCc1ccc(N2C[C@@H](C)O[C@@H](C)C2)nc1)c1ccc(F)cc1 ZINC000442710199 867640102 /nfs/dbraw/zinc/64/01/02/867640102.db2.gz BXYBEFWUBJOTBI-KGVIQGDOSA-N 0 3 401.526 4.092 20 0 HIADHN COCCC[C@H](NCC(=O)Nc1ccc(Br)cc1)c1ccc(F)cc1 ZINC000442767469 867669135 /nfs/dbraw/zinc/66/91/35/867669135.db2.gz MXBPOXSNSBMWJE-SFHVURJKSA-N 0 3 409.299 4.284 20 0 HIADHN C[S@@](=O)C1(CN[C@H](Cc2ccccc2F)c2ccccc2Br)CC1 ZINC000442826690 867688023 /nfs/dbraw/zinc/68/80/23/867688023.db2.gz XQQRDIDGQIRYAY-HOYKHHGWSA-N 0 3 410.352 4.373 20 0 HIADHN CN(CCCc1ccncc1)Cc1cccc(Br)c1OC[C@@H]1CCCO1 ZINC000442882404 867715386 /nfs/dbraw/zinc/71/53/86/867715386.db2.gz DNVMFYSMLTVMCN-IBGZPJMESA-N 0 3 419.363 4.467 20 0 HIADHN Cc1cc(C(F)(F)F)ccc1CNCc1ccc(S(=O)(=O)N(C)C(C)C)cc1 ZINC000443005640 867789343 /nfs/dbraw/zinc/78/93/43/867789343.db2.gz VCZRYIVFKRRMIW-UHFFFAOYSA-N 0 3 414.493 4.333 20 0 HIADHN Cc1nc(COc2ccc(CN[C@H]3CCCN(C4CCCCC4)C3=O)cc2)cs1 ZINC000443017139 867794544 /nfs/dbraw/zinc/79/45/44/867794544.db2.gz YRGGHMOXLCLZMP-QFIPXVFZSA-N 0 3 413.587 4.444 20 0 HIADHN CCOc1cc(CN2CC[C@H](OC)C[C@H]2C)ccc1OCc1ccc(C(=O)OC)o1 ZINC000443065675 867808291 /nfs/dbraw/zinc/80/82/91/867808291.db2.gz IGAZMOSQCBVQQU-AEFFLSMTSA-N 0 3 417.502 4.043 20 0 HIADHN O=C(Cc1csc2ccccc12)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000443343749 867916789 /nfs/dbraw/zinc/91/67/89/867916789.db2.gz JMILEAJUKRBXNU-UHFFFAOYSA-N 0 3 412.530 4.243 20 0 HIADHN O[C@@H](COCc1cccs1)CN1CCN(C2c3ccccc3-c3ccccc32)CC1 ZINC000443405747 867986881 /nfs/dbraw/zinc/98/68/81/867986881.db2.gz KVXNUNWSGSYQSN-LJQANCHMSA-N 0 3 420.578 4.013 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3ccc4c(c3)nc3n4CCCCC3)cc2)CC1 ZINC000468246552 882148739 /nfs/dbraw/zinc/14/87/39/882148739.db2.gz YWNGHDZZXUMIFW-UHFFFAOYSA-N 0 3 417.557 4.157 20 0 HIADHN Cc1cc(NC(=O)Nc2ccc(O)cc2C)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000443594873 868148700 /nfs/dbraw/zinc/14/87/00/868148700.db2.gz RMCMZJGCAYWBDR-LJQANCHMSA-N 0 3 405.502 4.297 20 0 HIADHN CCN1CCC[C@@H](CN(C)C(=O)N[C@H](C)c2cc3ccccc3o2)[C@@H]1c1cnn(C)c1 ZINC000443635521 868215965 /nfs/dbraw/zinc/21/59/65/868215965.db2.gz XKOVKNSNIYZUNW-HFJQGTKSSA-N 0 3 423.561 4.342 20 0 HIADHN Cc1cccc(COc2cccc(CC(=O)NCCCCN3C[C@H](C)O[C@@H](C)C3)c2)c1 ZINC000443672817 868277810 /nfs/dbraw/zinc/27/78/10/868277810.db2.gz GXTJGWNPPQBGQJ-VXKWHMMOSA-N 0 3 424.585 4.122 20 0 HIADHN CCCn1ccc2cc(NC(=O)C(=O)N[C@@H](C)[C@@H](c3ccccc3C)N(C)C)ccc21 ZINC000443836193 868366413 /nfs/dbraw/zinc/36/64/13/868366413.db2.gz CCELSKSHAXDVNX-MBSDFSHPSA-N 0 3 420.557 4.106 20 0 HIADHN Cc1ccccc1[C@H]([C@H](C)NC(=O)C(=O)Nc1cc(Cl)cc(Cl)c1)N(C)C ZINC000443840923 868370765 /nfs/dbraw/zinc/37/07/65/868370765.db2.gz JLMOEJJBCMSNKO-UGSOOPFHSA-N 0 3 408.329 4.048 20 0 HIADHN Cc1ccccc1[C@@H]([C@H](C)NC(=O)C(=O)Nc1ccc(Cl)cc1Cl)N(C)C ZINC000443841489 868372877 /nfs/dbraw/zinc/37/28/77/868372877.db2.gz KLAPNZQBOFBQJT-SCLBCKFNSA-N 0 3 408.329 4.048 20 0 HIADHN O=C1[C@@H](NCc2ccc(Oc3cccc(F)c3)cc2)CCCN1Cc1ccccn1 ZINC000443986940 868510604 /nfs/dbraw/zinc/51/06/04/868510604.db2.gz IXMNMXFPWADPER-QHCPKHFHSA-N 0 3 405.473 4.294 20 0 HIADHN OC[C@@H](CNCc1cnc(C(F)(F)F)s1)Cc1ccc(OC(F)(F)F)cc1 ZINC000443996914 868518370 /nfs/dbraw/zinc/51/83/70/868518370.db2.gz LAEMEWNZURVSLT-LLVKDONJSA-N 0 3 414.371 4.001 20 0 HIADHN COc1ccc(C2(NCc3ccc(Oc4cnccn4)cc3)CCOCC2)cc1F ZINC000444009629 868532516 /nfs/dbraw/zinc/53/25/16/868532516.db2.gz KMEXGJUKJZVAHM-UHFFFAOYSA-N 0 3 409.461 4.212 20 0 HIADHN COc1ccc(C2(NCc3ccc(OC[C@@H]4CCCO4)cc3)CCOCC2)cc1F ZINC000444016094 868540086 /nfs/dbraw/zinc/54/00/86/868540086.db2.gz CNYIKKDMPWUWKW-NRFANRHFSA-N 0 3 415.505 4.188 20 0 HIADHN Cc1c(CN2CCSCC2)cccc1NS(=O)(=O)c1cccc2ccccc21 ZINC000444026947 868556225 /nfs/dbraw/zinc/55/62/25/868556225.db2.gz AIHIBNLMVLCQTG-UHFFFAOYSA-N 0 3 412.580 4.498 20 0 HIADHN CN(CCC(=O)Nc1cc(F)cc(F)c1)[C@@H]1c2cc(Cl)cc(Cl)c2C[C@@H]1O ZINC000444046983 868584160 /nfs/dbraw/zinc/58/41/60/868584160.db2.gz ZXGRAUKLNQOLJD-PKOBYXMFSA-N 0 3 415.267 4.190 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)C2(Cc3ccc(C(F)(F)F)cc3)CC2)C[C@@H](C)O1 ZINC000444180383 868651556 /nfs/dbraw/zinc/65/15/56/868651556.db2.gz GKKXPFXLBKPMAE-IAGOWNOFSA-N 0 3 412.496 4.034 20 0 HIADHN C[C@@H](Oc1cccc2ccccc21)C(=O)N(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1 ZINC000444377077 868801154 /nfs/dbraw/zinc/80/11/54/868801154.db2.gz RPOLHYJXDHMWMR-ZHRMCQFGSA-N 0 3 403.526 4.154 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000444448128 868831738 /nfs/dbraw/zinc/83/17/38/868831738.db2.gz BJFCWMSLSVGWSV-LEWJYISDSA-N 0 3 418.459 4.404 20 0 HIADHN Cc1ccc(C(C)C)c(O[C@H](C)C(=O)Nc2cccc(CN3CCC(O)CC3)c2)c1 ZINC000444448217 868831980 /nfs/dbraw/zinc/83/19/80/868831980.db2.gz BQIITHHMXIUSPL-LJQANCHMSA-N 0 3 410.558 4.481 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)c1[nH]c2ccc(F)cc2c1Cl ZINC000444455859 868835164 /nfs/dbraw/zinc/83/51/64/868835164.db2.gz UWLBWWOMKSSJHS-UHFFFAOYSA-N 0 3 401.869 4.169 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)c1ccc2[nH]c3c(c2c1)CCCC3 ZINC000444454635 868835193 /nfs/dbraw/zinc/83/51/93/868835193.db2.gz PEMVKSXFMCZDAU-UHFFFAOYSA-N 0 3 403.526 4.256 20 0 HIADHN C[C@@H](Oc1cccc(C(C)(C)C)c1)C(=O)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000444461139 868836803 /nfs/dbraw/zinc/83/68/03/868836803.db2.gz PBZAEKHTOIPFDO-GOSISDBHSA-N 0 3 410.558 4.347 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1cccc(OC2CCCC2)c1 ZINC000444553876 868879456 /nfs/dbraw/zinc/87/94/56/868879456.db2.gz WDIFRAJDSNAOQJ-UHFFFAOYSA-N 0 3 408.542 4.465 20 0 HIADHN COc1ccccc1C[C@@H](C)CC(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000444551834 868879474 /nfs/dbraw/zinc/87/94/74/868879474.db2.gz SJYOFBAKOHZTOR-LJQANCHMSA-N 0 3 410.558 4.107 20 0 HIADHN C[C@@H](N[C@H]1CC(C)(C)OC1(C)C)C(=O)Nc1ccc(NC(=O)c2cccs2)cc1 ZINC000444644631 868929060 /nfs/dbraw/zinc/92/90/60/868929060.db2.gz WMHDXYAYDUVZGI-KDOFPFPSSA-N 0 3 415.559 4.263 20 0 HIADHN CO[C@@H](C)c1noc(CN2CCCN(Cc3ccc(-c4cccs4)cc3)CC2)n1 ZINC000444650384 868930864 /nfs/dbraw/zinc/93/08/64/868930864.db2.gz SMXJWWCNDSJTMS-KRWDZBQOSA-N 0 3 412.559 4.213 20 0 HIADHN CCN1CCC[C@@H](CN(C)Cc2nc(-c3ccccc3)cs2)[C@@H]1c1cnn(C)c1 ZINC000444687303 868958147 /nfs/dbraw/zinc/95/81/47/868958147.db2.gz GFDCKCRDXMHTTH-WMZHIEFXSA-N 0 3 409.603 4.449 20 0 HIADHN C[C@H](NCCO[C@@H]1CCCCO1)c1cccc(NC(=O)Cc2ccccc2F)c1 ZINC000444689949 868959680 /nfs/dbraw/zinc/95/96/80/868959680.db2.gz PTHIQALNRLZEEX-GAJHUEQPSA-N 0 3 400.494 4.201 20 0 HIADHN C[C@H](NCc1ccc(S(=O)(=O)N(C)C)cc1)c1cccc(OCc2ccccc2)c1 ZINC000444719907 868974668 /nfs/dbraw/zinc/97/46/68/868974668.db2.gz NXKYLWVCKJIYOO-IBGZPJMESA-N 0 3 424.566 4.367 20 0 HIADHN CC(C)[C@@H]1CCCN(CC(=O)N(Cc2nnc(-c3ccccc3Cl)o2)C2CC2)C1 ZINC000444753923 868987186 /nfs/dbraw/zinc/98/71/86/868987186.db2.gz RJZREJFDMRPPLJ-MRXNPFEDSA-N 0 3 416.953 4.249 20 0 HIADHN CC(C)N(C)C(=O)c1ccc(Cl)c(NC(=O)NCCN2CCCC(C)(C)C2)c1 ZINC000444892506 869079365 /nfs/dbraw/zinc/07/93/65/869079365.db2.gz COGQSAWFIOQMMU-UHFFFAOYSA-N 0 3 408.974 4.064 20 0 HIADHN Cc1coc(-c2cccc(NC(=O)N(C)C3CCN(CCc4ccccn4)CC3)c2)n1 ZINC000468327572 882260050 /nfs/dbraw/zinc/26/00/50/882260050.db2.gz MZGYSRZYIKPNTE-UHFFFAOYSA-N 0 3 419.529 4.216 20 0 HIADHN Cn1ncc(NC(=O)N[C@H](CN2CCc3ccccc3C2)C(C)(C)C)c1C(F)(F)F ZINC000445031961 869180889 /nfs/dbraw/zinc/18/08/89/869180889.db2.gz LGRUEQZRKMFAPN-QGZVFWFLSA-N 0 3 423.483 4.033 20 0 HIADHN CN1CCCN(C(=O)Nc2ccc(Oc3nc(C(C)(C)C)ns3)c(Cl)c2)CC1 ZINC000445038031 869185897 /nfs/dbraw/zinc/18/58/97/869185897.db2.gz HOMHPPADYFTWJZ-UHFFFAOYSA-N 0 3 423.970 4.451 20 0 HIADHN Cc1ccc(F)c(CN(C)C(=O)Nc2ccc(CCN3CCSCC3)cc2)c1 ZINC000445233830 869290353 /nfs/dbraw/zinc/29/03/53/869290353.db2.gz AJDMCWXHVREZNT-UHFFFAOYSA-N 0 3 401.551 4.389 20 0 HIADHN CCN1CCN(c2ccc(N[C@@H](C)c3nc(Cc4ccc(F)cc4)no3)c(C)c2)CC1 ZINC000445583029 869642464 /nfs/dbraw/zinc/64/24/64/869642464.db2.gz LLWABPNGDGYKBF-SFHVURJKSA-N 0 3 423.536 4.423 20 0 HIADHN Fc1cccc(CN2CCC[C@H](c3nc(CCc4ccc5c(c4)CCO5)no3)C2)c1 ZINC000445600545 869665682 /nfs/dbraw/zinc/66/56/82/869665682.db2.gz MHVPUSCLKFJYKK-FQEVSTJZSA-N 0 3 407.489 4.308 20 0 HIADHN CC[C@H](NC(=O)Cc1noc(C2CCN(Cc3ccccc3)CC2)n1)c1ccccc1 ZINC000445720656 869779094 /nfs/dbraw/zinc/77/90/94/869779094.db2.gz DSYMQBZVCURMHB-QFIPXVFZSA-N 0 3 418.541 4.259 20 0 HIADHN Cc1ccc(S(=O)(=O)N[C@@H](CN[C@H](c2cccnc2)C2CC2)c2ccccc2)cc1 ZINC000445806415 869832989 /nfs/dbraw/zinc/83/29/89/869832989.db2.gz VOUMIUHHKLZQET-ZEQRLZLVSA-N 0 3 421.566 4.151 20 0 HIADHN CCCN(Cc1ccn(-c2ccccc2F)n1)C1CCN(c2cc(C)nc(C)n2)CC1 ZINC000445820740 869842731 /nfs/dbraw/zinc/84/27/31/869842731.db2.gz IFVSBDFFOOSMMA-UHFFFAOYSA-N 0 3 422.552 4.299 20 0 HIADHN Cn1c(CN[C@H]2CCC[C@@H]2c2ccccc2C(F)(F)F)nc2ccccc2c1=O ZINC000446005228 869970482 /nfs/dbraw/zinc/97/04/82/869970482.db2.gz XOXWQMJHRPQOHS-QAPCUYQASA-N 0 3 401.432 4.378 20 0 HIADHN C[C@H](NC(=O)CN1[C@@H](C)CC[C@@H]1C)c1cccc(NC(=O)Cc2ccccc2F)c1 ZINC000468414287 882358955 /nfs/dbraw/zinc/35/89/55/882358955.db2.gz HLYRZJKUUMVQKW-BZSNNMDCSA-N 0 3 411.521 4.057 20 0 HIADHN C[C@@H]1CN(c2cccc3cnccc32)CCN1C(=O)Nc1cccc(CN(C)C)c1 ZINC000446111808 870058067 /nfs/dbraw/zinc/05/80/67/870058067.db2.gz BUQNCKDQQBSLCW-GOSISDBHSA-N 0 3 403.530 4.039 20 0 HIADHN Cc1c(NC(=O)c2cccc(CN(C)C)c2)cccc1-c1nnc2n1CCCCC2 ZINC000468430493 882373701 /nfs/dbraw/zinc/37/37/01/882373701.db2.gz YHAJYDIIVWIPEZ-UHFFFAOYSA-N 0 3 403.530 4.294 20 0 HIADHN Cc1c2cc(C)ccc2sc1C(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1CO ZINC000446224212 870161251 /nfs/dbraw/zinc/16/12/51/870161251.db2.gz FEGRDQHXGJDSSO-TZIWHRDSSA-N 0 3 408.567 4.131 20 0 HIADHN COc1ccc([C@H](CNC(=O)Nc2ccc(SC)cc2OC)N2CCCC2)cc1 ZINC000446410894 870317671 /nfs/dbraw/zinc/31/76/71/870317671.db2.gz LSNILVDTMHZOCG-FQEVSTJZSA-N 0 3 415.559 4.384 20 0 HIADHN CCCc1c(NC(=O)N(CCN(C)C)Cc2ccccn2)cnn1-c1cccc(C)c1 ZINC000446414541 870321981 /nfs/dbraw/zinc/32/19/81/870321981.db2.gz XVCCPHDTVKWUFM-UHFFFAOYSA-N 0 3 420.561 4.124 20 0 HIADHN CC(C)n1c2ccc(C(=O)N(CCN(C)C)Cc3ccco3)cc2nc1C(F)(F)F ZINC000446420363 870332827 /nfs/dbraw/zinc/33/28/27/870332827.db2.gz SSNYBPSFSKTTMY-UHFFFAOYSA-N 0 3 422.451 4.433 20 0 HIADHN Cc1cc(C(=O)N(CCN(C)C)Cc2ccco2)c2ccc(Br)cc2n1 ZINC000446444992 870364483 /nfs/dbraw/zinc/36/44/83/870364483.db2.gz QMIDYHQCSNIHAQ-UHFFFAOYSA-N 0 3 416.319 4.103 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)N[C@H]3CCCc4sccc43)CC2)C[C@@H](C)O1 ZINC000468465744 882412840 /nfs/dbraw/zinc/41/28/40/882412840.db2.gz HVYRXUISVXQEDU-HLIPFELVSA-N 0 3 405.608 4.046 20 0 HIADHN CCCN(C(=O)N[C@H](C)c1ccncc1OC)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000446634740 870540848 /nfs/dbraw/zinc/54/08/48/870540848.db2.gz NZCJBPLCGPQWJP-TZIWHRDSSA-N 0 3 410.562 4.237 20 0 HIADHN C[C@@H](NC[C@@H](c1cccs1)N1CCOCC1)c1ccc(Br)cc1F ZINC000446743903 870652050 /nfs/dbraw/zinc/65/20/50/870652050.db2.gz WRXGXKJNPPFUJP-DYVFJYSZSA-N 0 3 413.356 4.374 20 0 HIADHN CN(C[C@H](O)COC1CCOCC1)[C@@H](c1ccc(F)cc1)c1ccc(Cl)cc1 ZINC000446777376 870693911 /nfs/dbraw/zinc/69/39/11/870693911.db2.gz OMLNYHRLWVQHSO-RBBKRZOGSA-N 0 3 407.913 4.057 20 0 HIADHN COc1cc(CN2CCC[C@H](c3nccn3C)C2)cc(OC)c1OCc1ccccc1 ZINC000446828851 870744274 /nfs/dbraw/zinc/74/42/74/870744274.db2.gz ABCDRYMMNHSYPX-NRFANRHFSA-N 0 3 421.541 4.396 20 0 HIADHN CC(=O)Nc1ccc(CNC2(c3cccc(OC(F)(F)F)c3)CCOCC2)cc1 ZINC000446837695 870754892 /nfs/dbraw/zinc/75/48/92/870754892.db2.gz ZMFKHBHNCLCCCG-UHFFFAOYSA-N 0 3 408.420 4.339 20 0 HIADHN C[C@@H](CC(=O)Nc1ccc(OC(F)(F)F)cc1)NCc1ccc2c(n1)CCCC2 ZINC000446901702 870819796 /nfs/dbraw/zinc/81/97/96/870819796.db2.gz FFLSBAOKFLXTQM-AWEZNQCLSA-N 0 3 407.436 4.366 20 0 HIADHN Cc1cc(NC(=O)N(CCN(C)C)Cc2ccco2)ccc1NC(=O)c1ccco1 ZINC000446905271 870824461 /nfs/dbraw/zinc/82/44/61/870824461.db2.gz GKTDUTGTHHLLIX-UHFFFAOYSA-N 0 3 410.474 4.029 20 0 HIADHN Cc1ccc([C@H](CCn2cncn2)NCc2ccc(C)cc2OC[C@@H]2CCCO2)cc1 ZINC000446935594 870845708 /nfs/dbraw/zinc/84/57/08/870845708.db2.gz GIANGWYXOOQNKB-ZEQRLZLVSA-N 0 3 420.557 4.374 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1cc(-c2n[nH]c(C)n2)ccc1C)c1ccsc1 ZINC000447050917 870929670 /nfs/dbraw/zinc/92/96/70/870929670.db2.gz QIOBJPCHFRAQBX-LJQANCHMSA-N 0 3 412.563 4.355 20 0 HIADHN COc1ccccc1-c1csc([C@H]2CCCN(Cc3cccc(C(N)=O)c3)C2)n1 ZINC000447060668 870939964 /nfs/dbraw/zinc/93/99/64/870939964.db2.gz PSVZBAJZDHJDSR-SFHVURJKSA-N 0 3 407.539 4.297 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1cnn(-c2cccc(C(F)(F)F)c2)c1 ZINC000447067175 870946262 /nfs/dbraw/zinc/94/62/62/870946262.db2.gz HFFAIIUROFDELS-UHFFFAOYSA-N 0 3 421.423 4.080 20 0 HIADHN COC1(CO)CCN(Cc2ccc(Oc3cccc(Br)c3)cc2)CC1 ZINC000447067973 870948603 /nfs/dbraw/zinc/94/86/03/870948603.db2.gz KEQZIGOGXKNPCJ-UHFFFAOYSA-N 0 3 406.320 4.215 20 0 HIADHN COCCO[C@H]1C[C@@H](CO)CN(Cc2ccc(-c3ccc(C(C)(C)C)cc3)o2)C1 ZINC000447076014 870960022 /nfs/dbraw/zinc/96/00/22/870960022.db2.gz IITTZBBKXWIXQW-GCJKJVERSA-N 0 3 401.547 4.090 20 0 HIADHN Cc1nc(-c2ccc(C)c(NC(=O)N[C@H]3CCN([C@H](C)c4ccccc4)C3)c2)n[nH]1 ZINC000447076290 870960105 /nfs/dbraw/zinc/96/01/05/870960105.db2.gz JMCQWEZNUFXVIK-UZLBHIALSA-N 0 3 404.518 4.046 20 0 HIADHN COCCO[C@H]1C[C@@H](CO)CN(Cc2ccc(-c3cccc(Cl)c3Cl)o2)C1 ZINC000447078515 870965993 /nfs/dbraw/zinc/96/59/93/870965993.db2.gz PSLASCPVKLQFND-ZBFHGGJFSA-N 0 3 414.329 4.099 20 0 HIADHN CCOc1cc(CN2CCC3(CCN(C)C3=O)CC2)ccc1OCc1ccccc1 ZINC000447102257 871002164 /nfs/dbraw/zinc/00/21/64/871002164.db2.gz ZWVMTJRKOVNDLK-UHFFFAOYSA-N 0 3 408.542 4.109 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)NCc1ccc(OCc2ccccc2)cc1 ZINC000447244833 871128211 /nfs/dbraw/zinc/12/82/11/871128211.db2.gz BIDCMWXLVJFMHF-UHFFFAOYSA-N 0 3 407.514 4.132 20 0 HIADHN CCC[C@H](NC(=O)N1CCC(CN2C[C@H](C)O[C@@H](C)C2)CC1)c1ccc(F)cc1F ZINC000468499943 882489497 /nfs/dbraw/zinc/48/94/97/882489497.db2.gz BULPZEUYUDBDGM-HOIFWPIMSA-N 0 3 423.548 4.337 20 0 HIADHN COc1ccccc1-c1csc([C@@H]2CCCN(C[C@@H](O)COc3ccccc3)C2)n1 ZINC000447388177 871298178 /nfs/dbraw/zinc/29/81/78/871298178.db2.gz WAFNPMNDHJLFFW-RTBURBONSA-N 0 3 424.566 4.438 20 0 HIADHN C[C@@H](C1CCCCC1)N(C)CC(=O)N(C)CC(=O)Nc1ccccc1C(F)(F)F ZINC000447390904 871301582 /nfs/dbraw/zinc/30/15/82/871301582.db2.gz CSVCTOFXNAUTRM-HNNXBMFYSA-N 0 3 413.484 4.003 20 0 HIADHN COc1ccccc1-c1csc([C@H]2CCCN([C@H]3CCCN(C(C)C)C3=O)C2)n1 ZINC000447401397 871311145 /nfs/dbraw/zinc/31/11/45/871311145.db2.gz YCFJJJFJWISIIM-PXNSSMCTSA-N 0 3 413.587 4.398 20 0 HIADHN COc1ccc([C@H](N[C@@H]2CCCN(c3cc(C)nn3C)C2)c2ccc(F)cc2)cc1 ZINC000447560249 871451545 /nfs/dbraw/zinc/45/15/45/871451545.db2.gz WEEYAJNSGRCHEZ-ZJSXRUAMSA-N 0 3 408.521 4.224 20 0 HIADHN CC(C)[C@H]1C[C@H](NCc2ccc(N3CCCS3(=O)=O)c(F)c2)c2ccccc21 ZINC000447608824 871516910 /nfs/dbraw/zinc/51/69/10/871516910.db2.gz WKKCUIQPOKIMFU-CTNGQTDRSA-N 0 3 402.535 4.340 20 0 HIADHN COc1ccc(CN2CCCN(c3ccccc3)CC2)c(OCc2cccnc2)c1 ZINC000447737514 871686353 /nfs/dbraw/zinc/68/63/53/871686353.db2.gz RTMLFEXHDMGAED-UHFFFAOYSA-N 0 3 403.526 4.382 20 0 HIADHN C[C@@H](c1ccc(S(N)(=O)=O)cc1)N(C)Cc1ccc(Oc2cccc(F)c2)cc1 ZINC000447797841 871734726 /nfs/dbraw/zinc/73/47/26/871734726.db2.gz OHAANOBQMSFMNO-INIZCTEOSA-N 0 3 414.502 4.458 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3cc(-c4ccco4)nn3C(C)C)cc2)CC1 ZINC000447858031 871776907 /nfs/dbraw/zinc/77/69/07/871776907.db2.gz HBJDLRSDALWDSE-UHFFFAOYSA-N 0 3 407.518 4.118 20 0 HIADHN O=C(N1CCOc2c(F)cccc2C1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000447866467 871790981 /nfs/dbraw/zinc/79/09/81/871790981.db2.gz RHQJLRZNKWCLJX-NRFANRHFSA-N 0 3 422.422 4.001 20 0 HIADHN C[C@H]1OCC[C@@]1(O)CN(Cc1ccccc1)Cc1ccccc1Oc1cccnc1 ZINC000447926750 871815442 /nfs/dbraw/zinc/81/54/42/871815442.db2.gz NFMNQMJRAVWLHV-CJFMBICVSA-N 0 3 404.510 4.416 20 0 HIADHN Cc1nn(C)c(CNCCCc2ccc(Br)cc2F)c1Br ZINC000447944072 871819171 /nfs/dbraw/zinc/81/91/71/871819171.db2.gz ZBNOVASFDPYDIY-UHFFFAOYSA-N 0 3 419.136 4.115 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1cccc2c1OCC[C@H]2OC)c1ccsc1 ZINC000448043851 871875973 /nfs/dbraw/zinc/87/59/73/871875973.db2.gz OWRSBZXPEJOBRD-RBUKOAKNSA-N 0 3 403.548 4.423 20 0 HIADHN CO[C@H]1CCOc2c(NC(=O)N(C)[C@H]3CCCN(Cc4ccccc4)C3)cccc21 ZINC000448051939 871882405 /nfs/dbraw/zinc/88/24/05/871882405.db2.gz UMEBDWRMPZCHAP-UGKGYDQZSA-N 0 3 409.530 4.285 20 0 HIADHN CC(C)[C@H]1C[C@@H](NC(=O)N2CC[C@@H](CN(C)Cc3cccnc3)C2)c2ccccc21 ZINC000448283601 872208239 /nfs/dbraw/zinc/20/82/39/872208239.db2.gz MPBXFBCADHZRBK-TUACAJSNSA-N 0 3 406.574 4.430 20 0 HIADHN CC(C)[C@H]1C[C@@H](NC(=O)N2CC[C@H](CN(C)Cc3cccnc3)C2)c2ccccc21 ZINC000448283600 872209035 /nfs/dbraw/zinc/20/90/35/872209035.db2.gz MPBXFBCADHZRBK-AGILITTLSA-N 0 3 406.574 4.430 20 0 HIADHN CC(=O)Nc1ccccc1CN1CCC[C@H](Nc2cccc(Br)c2)C1 ZINC000448375674 872324368 /nfs/dbraw/zinc/32/43/68/872324368.db2.gz NGSWQERKTYGZDB-IBGZPJMESA-N 0 3 402.336 4.484 20 0 HIADHN O=C(NC1CCN(CCc2cccc(OC(F)(F)F)c2)CC1)c1ccc(F)cc1 ZINC000448456844 872411071 /nfs/dbraw/zinc/41/10/71/872411071.db2.gz NJKISRQVHDIHOS-UHFFFAOYSA-N 0 3 410.411 4.161 20 0 HIADHN CCN(C(=O)Nc1cccc(NC(=O)C(C)C)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000460122873 872596869 /nfs/dbraw/zinc/59/68/69/872596869.db2.gz GMAGMDBHRCOFDL-JOCHJYFZSA-N 0 3 408.546 4.409 20 0 HIADHN CCC(=O)Nc1ccc(C)c(NC(=O)N(CC)[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000460132493 872618788 /nfs/dbraw/zinc/61/87/88/872618788.db2.gz JQENGNDRWJWAFJ-OAQYLSRUSA-N 0 3 408.546 4.472 20 0 HIADHN CN1CCC(N(Cc2ccccc2Br)C(=O)NC[C@@H]2CC=CCC2)CC1 ZINC000460149180 872665943 /nfs/dbraw/zinc/66/59/43/872665943.db2.gz NMOQIQPIQLDVMX-QGZVFWFLSA-N 0 3 420.395 4.411 20 0 HIADHN Cc1ccc(-c2cccc(CNC(=O)C(=O)Nc3cc(CN(C)C)ccc3C)c2)cc1 ZINC000468574629 882643719 /nfs/dbraw/zinc/64/37/19/882643719.db2.gz HRBXXVBRJWFQFA-UHFFFAOYSA-N 0 3 415.537 4.287 20 0 HIADHN CN1CCC(N(Cc2ccccc2Br)C(=O)NCc2ccsc2)CC1 ZINC000460174056 872730525 /nfs/dbraw/zinc/73/05/25/872730525.db2.gz NCNJGPNIHYMXCU-UHFFFAOYSA-N 0 3 422.392 4.317 20 0 HIADHN C[C@@H](C(=O)Nc1ccc(C(=O)N(C)[C@H]2CCCN(C)C2)cc1)c1cccc(Cl)c1 ZINC000460215267 872801545 /nfs/dbraw/zinc/80/15/45/872801545.db2.gz JMZMZTPRWCXABN-IERDGZPVSA-N 0 3 413.949 4.248 20 0 HIADHN CN1CCC(N(Cc2ccccc2Br)C(=O)NC[C@@H]2CC2(C)C)CC1 ZINC000460227455 872813467 /nfs/dbraw/zinc/81/34/67/872813467.db2.gz GPVDQICQOUPIST-INIZCTEOSA-N 0 3 408.384 4.101 20 0 HIADHN Cc1cn(-c2c(F)cccc2F)nc1C(=O)NC[C@H](c1ccccc1)N1CCCC1 ZINC000468583653 882664402 /nfs/dbraw/zinc/66/44/02/882664402.db2.gz FHBWJANTSVXWJO-HXUWFJFHSA-N 0 3 410.468 4.026 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)N1CCCC[C@H]1c1nnc(C2CCC2)o1 ZINC000460342215 872955459 /nfs/dbraw/zinc/95/54/59/872955459.db2.gz YLGCTVCXOQIADS-SFTDATJTSA-N 0 3 423.561 4.238 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)N1CCCC[C@@H]1c1nnc(C2CCC2)o1 ZINC000460342212 872955680 /nfs/dbraw/zinc/95/56/80/872955680.db2.gz YLGCTVCXOQIADS-LEWJYISDSA-N 0 3 423.561 4.238 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)N2CCCC[C@@H]2c2nnc(C3CCC3)o2)CN1Cc1ccccc1 ZINC000460366424 873000585 /nfs/dbraw/zinc/00/05/85/873000585.db2.gz ZMNPZZQEQZYMGP-DUXKGJEZSA-N 0 3 423.561 4.237 20 0 HIADHN CN(C)[C@H](CNC(=O)CN1CCCC[C@H]1c1cc2ccccc2[nH]1)c1ccccc1 ZINC000460388252 873032572 /nfs/dbraw/zinc/03/25/72/873032572.db2.gz PSZOLBJROMUGGE-BJKOFHAPSA-N 0 3 404.558 4.114 20 0 HIADHN CCCN(CCN1CCN(CC)CC1)C(=O)N[C@H](c1ccccc1F)C1CCCC1 ZINC000460489086 873175641 /nfs/dbraw/zinc/17/56/41/873175641.db2.gz KEWCVEXVBWXVGO-QHCPKHFHSA-N 0 3 418.601 4.116 20 0 HIADHN CCOc1ccc(CNCc2ccc(C)nc2-n2cc(Cl)cn2)cc1OCC ZINC000468602860 882701957 /nfs/dbraw/zinc/70/19/57/882701957.db2.gz QBSWSNDDUSKUQP-UHFFFAOYSA-N 0 3 400.910 4.316 20 0 HIADHN CCN1C[C@H](C)N(c2nnc([C@H]3CCO[C@@H]3c3ccccc3)n2CC(C)C)C[C@H]1C ZINC000460583884 873320685 /nfs/dbraw/zinc/32/06/85/873320685.db2.gz HAJURMLYBVEXGP-XMGTWHOFSA-N 0 3 411.594 4.098 20 0 HIADHN CCc1nc2ccccc2n1Cc1noc(-c2ccc(CN3CCSCC3)cc2)n1 ZINC000460747543 873582211 /nfs/dbraw/zinc/58/22/11/873582211.db2.gz IQKZVLDLZVYJBT-UHFFFAOYSA-N 0 3 419.554 4.246 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)c1ccc(OCc2ccccn2)cc1 ZINC000460755869 873595539 /nfs/dbraw/zinc/59/55/39/873595539.db2.gz FTIAJVWANDDFAG-DEOSSOPVSA-N 0 3 401.510 4.228 20 0 HIADHN CC[C@H](CNC(=O)c1ccc(OCc2ccccn2)cc1)N1CCc2ccccc2C1 ZINC000460772955 873621843 /nfs/dbraw/zinc/62/18/43/873621843.db2.gz YYGUJOUEWKOARY-XMMPIXPASA-N 0 3 415.537 4.227 20 0 HIADHN COCCN1CCC(NC(=O)C2(c3cccc(C(F)(F)F)c3)CCCCC2)CC1 ZINC000460856050 873757024 /nfs/dbraw/zinc/75/70/24/873757024.db2.gz JLKDPFKNTHQKSX-UHFFFAOYSA-N 0 3 412.496 4.134 20 0 HIADHN Cc1ccc(-c2ocnc2C(=O)N2CCCN(CCCc3ccccc3)CC2)cc1 ZINC000460868069 873774663 /nfs/dbraw/zinc/77/46/63/873774663.db2.gz ALERWBAAIMMWGG-UHFFFAOYSA-N 0 3 403.526 4.431 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2ccc(OC3CCOCC3)cc2)N2CCCC2)cc1 ZINC000460954711 873852653 /nfs/dbraw/zinc/85/26/53/873852653.db2.gz WGBYZRARZGRSQC-XMMPIXPASA-N 0 3 408.542 4.120 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)c2c[nH]cc2-c2ccc3c(c2)OCCO3)C1 ZINC000460973797 873868414 /nfs/dbraw/zinc/86/84/14/873868414.db2.gz OSSIVCWIKRKKQN-FXAWDEMLSA-N 0 3 417.509 4.018 20 0 HIADHN CCSc1cc(Cl)ccc1C(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000460982018 873873065 /nfs/dbraw/zinc/87/30/65/873873065.db2.gz QATSDACDHPYWCR-HZPDHXFCSA-N 0 3 411.011 4.413 20 0 HIADHN O=C(N[C@H]1c2ccccc2CC12CCOCC2)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000461035979 873897582 /nfs/dbraw/zinc/89/75/82/873897582.db2.gz DLJKXOXSQTZLSF-URXFXBBRSA-N 0 3 422.544 4.248 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)c1ccc(OCc2ccccn2)cc1 ZINC000461062458 873943272 /nfs/dbraw/zinc/94/32/72/873943272.db2.gz FKNVALAGBTVKEA-QHCPKHFHSA-N 0 3 401.510 4.055 20 0 HIADHN Cc1cc(Cl)c2c(c1)[C@H](NCc1ccc(N3CCCS3(=O)=O)cc1)CCCO2 ZINC000461081001 873988415 /nfs/dbraw/zinc/98/84/15/873988415.db2.gz FDSBNLMZRNKLMD-HXUWFJFHSA-N 0 3 420.962 4.192 20 0 HIADHN O=S1(=O)CCCN1c1ccc(CN[C@H]2CCSc3ccc(Cl)cc32)cc1 ZINC000461091312 874006142 /nfs/dbraw/zinc/00/61/42/874006142.db2.gz CMRXBAVXXNSEGG-SFHVURJKSA-N 0 3 408.976 4.207 20 0 HIADHN OCC[C@@H](NCc1csc(-c2ccc(C(F)(F)F)cc2)n1)C1CCOCC1 ZINC000461360164 874363107 /nfs/dbraw/zinc/36/31/07/874363107.db2.gz DENNDAFMELFCLI-QGZVFWFLSA-N 0 3 400.466 4.096 20 0 HIADHN CN(Cc1nnc(-c2cc3c(s2)CCCC3)o1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000461385104 874392250 /nfs/dbraw/zinc/39/22/50/874392250.db2.gz QQTWGBYRCCZYKE-IBGZPJMESA-N 0 3 408.571 4.383 20 0 HIADHN Cc1cc(CNCc2ccc(N3CCCS3(=O)=O)cc2)ccc1Oc1cccnc1 ZINC000461430054 874470116 /nfs/dbraw/zinc/47/01/16/874470116.db2.gz LCBLYXYXFXRJLD-UHFFFAOYSA-N 0 3 423.538 4.012 20 0 HIADHN CC(=O)c1c(C)[nH]c(C(=O)N2C[C@H]3CN(Cc4ccccc4)CC[C@@H]3C2)c1C(C)C ZINC000461434446 874484373 /nfs/dbraw/zinc/48/43/73/874484373.db2.gz SJMANPZQSBIOPP-NHCUHLMSSA-N 0 3 407.558 4.243 20 0 HIADHN CC(=O)c1c(C)[nH]c(C(=O)N2C[C@@H]3CCN(Cc4ccccc4)C[C@@H]3C2)c1C(C)C ZINC000461434445 874484550 /nfs/dbraw/zinc/48/45/50/874484550.db2.gz SJMANPZQSBIOPP-LEWJYISDSA-N 0 3 407.558 4.243 20 0 HIADHN CC(=O)c1c(C)[nH]c(C(=O)N2C[C@@H]3CCN(Cc4ccccc4)C[C@H]3C2)c1C(C)C ZINC000461434448 874484716 /nfs/dbraw/zinc/48/47/16/874484716.db2.gz SJMANPZQSBIOPP-SFTDATJTSA-N 0 3 407.558 4.243 20 0 HIADHN CCCc1c(C(=O)N2C[C@H]3CCN(Cc4ccccc4)C[C@H]3C2)[nH]c(C)c1C(C)=O ZINC000461443857 874498942 /nfs/dbraw/zinc/49/89/42/874498942.db2.gz CAICHQJOYZBBQB-RTWAWAEBSA-N 0 3 407.558 4.072 20 0 HIADHN Cc1ccc(C)c(C(=O)CCC(=O)N2C[C@H]3CCN(Cc4ccccc4)C[C@H]3C2)c1 ZINC000461445261 874500423 /nfs/dbraw/zinc/50/04/23/874500423.db2.gz MUFWGMOZEHATCV-PKTZIBPZSA-N 0 3 404.554 4.247 20 0 HIADHN Cc1ccc(C(=O)CCCC(=O)N2C[C@@H]3CCN(Cc4ccccc4)C[C@H]3C2)cc1 ZINC000461446088 874503094 /nfs/dbraw/zinc/50/30/94/874503094.db2.gz OGMYCVIDDDQVJC-ZEQRLZLVSA-N 0 3 404.554 4.329 20 0 HIADHN C[C@H](CC(=O)N1C[C@@H]2CCN(Cc3ccccc3)C[C@H]2C1)C(=O)c1cccc(F)c1 ZINC000461446983 874504082 /nfs/dbraw/zinc/50/40/82/874504082.db2.gz FXBCKXVCEUVYEM-COPCDDAFSA-N 0 3 408.517 4.015 20 0 HIADHN Cc1cc(C(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)nn1-c1c(F)cccc1F ZINC000468744885 882839847 /nfs/dbraw/zinc/83/98/47/882839847.db2.gz SLZUSWGUMHANRC-WMZOPIPTSA-N 0 3 410.468 4.024 20 0 HIADHN C[C@H](CN(C)C(=O)N[C@@H](C)C1=CCN(C)CC1)Oc1ccc(Cl)c(Cl)c1 ZINC000468746549 882840685 /nfs/dbraw/zinc/84/06/85/882840685.db2.gz ZDAHDUFKQNLMJG-KGLIPLIRSA-N 0 3 400.350 4.053 20 0 HIADHN CCN1CCN(c2ccc(C(=O)NCCCc3cccc(C(F)(F)F)c3)cc2)CC1 ZINC000468756392 882845271 /nfs/dbraw/zinc/84/52/71/882845271.db2.gz AGGRCHQIXORWDI-UHFFFAOYSA-N 0 3 419.491 4.210 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)N2CCCC[C@@H]2c2nnc(C3CCC3)o2)CCN1Cc1ccccc1 ZINC000461539400 874627151 /nfs/dbraw/zinc/62/71/51/874627151.db2.gz XJYWPQJCKXSSEQ-JRGCBEDISA-N 0 3 423.561 4.237 20 0 HIADHN CC(=O)Nc1ccc(CC(=O)N2CCN(Cc3ccccc3)C3(CCCCC3)C2)cc1 ZINC000461582664 874691090 /nfs/dbraw/zinc/69/10/90/874691090.db2.gz UZXPAHUTLPAWKO-UHFFFAOYSA-N 0 3 419.569 4.235 20 0 HIADHN CN(C)Cc1cccc(C(=O)N(Cc2ccc3c(c2)OCO3)c2ccc(F)cc2)c1 ZINC000468789714 882861021 /nfs/dbraw/zinc/86/10/21/882861021.db2.gz BTDJNVAYGJTEDA-UHFFFAOYSA-N 0 3 406.457 4.463 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)C(C)(C)Cc2ccc(C(F)(F)F)cc2)C[C@@H](C)O1 ZINC000468805888 882868975 /nfs/dbraw/zinc/86/89/75/882868975.db2.gz CRWMVGYUPLTOKQ-IAGOWNOFSA-N 0 3 414.512 4.280 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)N(C)[C@@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000461710864 874859554 /nfs/dbraw/zinc/85/95/54/874859554.db2.gz ULPSLFDULKVVDY-YSZBQJHXSA-N 0 3 413.537 4.208 20 0 HIADHN CCc1nc2c(s1)[C@H](N(C)C(=O)N[C@H](C)CN(C)Cc1ccccc1)CCC2 ZINC000461725310 874872251 /nfs/dbraw/zinc/87/22/51/874872251.db2.gz KUMIYUJLMOHXOD-VQIMIIECSA-N 0 3 400.592 4.245 20 0 HIADHN CC(C)c1nc(CN(C)[C@H]2CCN(CCOc3cccc(C(C)(C)C)c3)C2)no1 ZINC000461902733 875047823 /nfs/dbraw/zinc/04/78/23/875047823.db2.gz LBVUVKVRYNHHHQ-IBGZPJMESA-N 0 3 400.567 4.076 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)Nc3ccccc3NCC(F)(F)F)CC2)c1 ZINC000461953233 875084356 /nfs/dbraw/zinc/08/43/56/875084356.db2.gz AKPVPQVYIGYZMY-UHFFFAOYSA-N 0 3 420.479 4.120 20 0 HIADHN COC(=O)[C@@](C)(CN[C@@H](C)C(=O)Nc1cc(Cl)ccc1Cl)c1ccccc1 ZINC000468861242 882894790 /nfs/dbraw/zinc/89/47/90/882894790.db2.gz GDEZFOLURYKMIH-RBZFPXEDSA-N 0 3 409.313 4.041 20 0 HIADHN CCOC(=O)[C@](C)(CN[C@H](C)C(=O)Nc1cc(Cl)ccc1C)c1ccccc1 ZINC000468865365 882897294 /nfs/dbraw/zinc/89/72/94/882897294.db2.gz FFAWDPMZICWPJF-OPAMFIHVSA-N 0 3 402.922 4.086 20 0 HIADHN COc1ccc([C@H](CNC(=O)CN2[C@@H](C)CC[C@@H]2C)c2c[nH]c3ccccc32)cc1 ZINC000462042505 875154999 /nfs/dbraw/zinc/15/49/99/875154999.db2.gz ZYIBSHHTPBDOFX-SPEDKVCISA-N 0 3 405.542 4.297 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)N[C@H]1CCCc2cn(C3CCCC3)nc21 ZINC000462129507 875230777 /nfs/dbraw/zinc/23/07/77/875230777.db2.gz FWQCLAUYFBNBJU-QHCPKHFHSA-N 0 3 421.589 4.123 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)N[C@H]1CCCc2cn(C3CCCC3)nc21 ZINC000462150810 875247047 /nfs/dbraw/zinc/24/70/47/875247047.db2.gz NDFHLJFSDGTRKE-QFIPXVFZSA-N 0 3 409.578 4.149 20 0 HIADHN O=C(N[C@@H]1CCCc2cn(C3CCCC3)nc21)N1CCCN(Cc2ccccc2)CC1 ZINC000462152885 875248165 /nfs/dbraw/zinc/24/81/65/875248165.db2.gz VLOPHWJTRVJSFP-HSZRJFAPSA-N 0 3 421.589 4.293 20 0 HIADHN CN(C(=O)N[C@@H]1CCCc2cn(C3CCCC3)nc21)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000462154724 875251553 /nfs/dbraw/zinc/25/15/53/875251553.db2.gz JZHRMPIQJRIJJF-DHIUTWEWSA-N 0 3 421.589 4.292 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)Cc1csc(Cc2ccc(F)cc2)n1 ZINC000462165142 875261272 /nfs/dbraw/zinc/26/12/72/875261272.db2.gz ACYCFYDSMQLLQH-JTSKRJEESA-N 0 3 423.557 4.052 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Cc1csc(Cc2ccc(F)cc2)n1 ZINC000462165140 875262360 /nfs/dbraw/zinc/26/23/60/875262360.db2.gz ACYCFYDSMQLLQH-HTAPYJJXSA-N 0 3 423.557 4.052 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)C1(c2ccc(Cl)cc2)CCOCC1 ZINC000462195776 875304183 /nfs/dbraw/zinc/30/41/83/875304183.db2.gz MQGYETCWVSPWQX-PGRDOPGGSA-N 0 3 412.961 4.025 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Nc1cc2c(cc1Cl)OCCCO2 ZINC000462247367 875367269 /nfs/dbraw/zinc/36/72/69/875367269.db2.gz NTBMMPSFCNZLDH-HNAYVOBHSA-N 0 3 415.921 4.143 20 0 HIADHN O=C1NC2(CCCC2)C(=O)N1CCN[C@H](c1ccccc1)c1ccc2ccccc2c1 ZINC000462251096 875372296 /nfs/dbraw/zinc/37/22/96/875372296.db2.gz ZFDIXJXIPQHFOJ-HSZRJFAPSA-N 0 3 413.521 4.383 20 0 HIADHN C[C@H](CC(=O)N(CCN(C)C)Cc1ccccn1)c1ccc(F)c(Br)c1 ZINC000462254270 875377403 /nfs/dbraw/zinc/37/74/03/875377403.db2.gz PGMICWSTXJSTGU-OAHLLOKOSA-N 0 3 422.342 4.067 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Nc1ccc(C(=O)NC2CCCC2)cc1 ZINC000462263230 875389158 /nfs/dbraw/zinc/38/91/58/875389158.db2.gz NUUCDCYMSHMRIB-WZONZLPQSA-N 0 3 420.557 4.001 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Nc1cccc(-c2noc(C3CC3)n2)c1 ZINC000462271391 875400440 /nfs/dbraw/zinc/40/04/40/875400440.db2.gz SZITTYNDIGAJKI-HRAATJIYSA-N 0 3 417.513 4.256 20 0 HIADHN COc1ccc(NC(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)c(C(F)(F)F)c1 ZINC000462275239 875403111 /nfs/dbraw/zinc/40/31/11/875403111.db2.gz RWTHQIUVUKXGRY-LIRRHRJNSA-N 0 3 407.436 4.356 20 0 HIADHN C[C@H](CC(=O)N[C@H]1CN(C)C[C@@H]1c1ccccc1)c1ccc(F)c(Br)c1 ZINC000462282880 875409402 /nfs/dbraw/zinc/40/94/02/875409402.db2.gz XVDZBPHARYODOS-ZTQAJYAQSA-N 0 3 419.338 4.296 20 0 HIADHN C[C@H]1CN(C)CC[C@H]1N(C)S(=O)(=O)c1ccc(Oc2cccc(Cl)c2)cc1 ZINC000462353362 875466458 /nfs/dbraw/zinc/46/64/58/875466458.db2.gz APPRADSMWNJGEB-MGPUTAFESA-N 0 3 408.951 4.093 20 0 HIADHN C[C@H]1CN(C)CC[C@H]1N(C)S(=O)(=O)c1ccc(Oc2ccccc2Cl)cc1 ZINC000462358384 875471362 /nfs/dbraw/zinc/47/13/62/875471362.db2.gz LKQDWBAKUBUVBR-HNAYVOBHSA-N 0 3 408.951 4.093 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)CCc3cncc4ccccc43)c(C)c2)CC1 ZINC000462389466 875499488 /nfs/dbraw/zinc/49/94/88/875499488.db2.gz RUQWKXHWAHNKDG-UHFFFAOYSA-N 0 3 402.542 4.256 20 0 HIADHN C[C@@H](NCC(=O)N(CCC(N)=O)Cc1ccccc1)c1ccc(Cl)c2ccccc21 ZINC000462473399 875581386 /nfs/dbraw/zinc/58/13/86/875581386.db2.gz HPYNNIWMTQHMPL-QGZVFWFLSA-N 0 3 423.944 4.048 20 0 HIADHN C[C@@H](CN1CCOCC1)N(Cc1ccccc1)Cc1ccc2c(c1)COC(C)(C)O2 ZINC000468899641 882949966 /nfs/dbraw/zinc/94/99/66/882949966.db2.gz HNPCCFGRPDWZNW-FQEVSTJZSA-N 0 3 410.558 4.055 20 0 HIADHN COc1ccc([C@H](CNC(=O)N[C@H]2CCO[C@@H](c3ccccc3)C2)N2CCCC2)cc1 ZINC000462523171 875640871 /nfs/dbraw/zinc/64/08/71/875640871.db2.gz SBNZCFPUYWEACZ-OEMFJLHTSA-N 0 3 423.557 4.052 20 0 HIADHN CC[C@H](CNC(=O)N[C@H]1CCO[C@H](c2ccccc2)C1)N1CCc2ccccc2C1 ZINC000462529914 875649706 /nfs/dbraw/zinc/64/97/06/875649706.db2.gz RWSLNCVKRXCAPD-VXNXHJTFSA-N 0 3 407.558 4.043 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)Cc1csc(-c2cccnc2)n1 ZINC000468900981 882952691 /nfs/dbraw/zinc/95/26/91/882952691.db2.gz HVLOZHSORRBIMZ-OAQYLSRUSA-N 0 3 408.571 4.020 20 0 HIADHN FC(F)n1c(CCNCc2cc(Br)cc3c2OCC3)nc2ccccc21 ZINC000462555521 875681173 /nfs/dbraw/zinc/68/11/73/875681173.db2.gz VGQZSLDLHUNQFU-UHFFFAOYSA-N 0 3 422.273 4.461 20 0 HIADHN CC(=O)N(Cc1ccc(NC(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)cc1)C(C)C ZINC000462561407 875688950 /nfs/dbraw/zinc/68/89/50/875688950.db2.gz USCYYXRPCDSSHQ-DVECYGJZSA-N 0 3 422.573 4.086 20 0 HIADHN COc1cccc(Cl)c1CNC[C@H](CO)Cc1cccc(OC(F)(F)F)c1 ZINC000462739990 875811447 /nfs/dbraw/zinc/81/14/47/875811447.db2.gz QPLJFUZJEHGEPU-CQSZACIVSA-N 0 3 403.828 4.188 20 0 HIADHN Cc1ncn(-c2ccc(NC(=O)CCCN3CCN(c4ccccc4)CC3)cc2)c1C ZINC000462768426 875828547 /nfs/dbraw/zinc/82/85/47/875828547.db2.gz NGNIKORGLNDNFA-UHFFFAOYSA-N 0 3 417.557 4.030 20 0 HIADHN COC(=O)c1cc(CNCc2cn(-c3ccccc3)nc2-c2ccccc2)n(C)c1C ZINC000462795672 875845933 /nfs/dbraw/zinc/84/59/33/875845933.db2.gz VPPHYSZEDCNGRW-UHFFFAOYSA-N 0 3 414.509 4.263 20 0 HIADHN COC(=O)c1cc(CN[C@@H](Cc2ccc(OC)c(OC)c2)c2ccccc2)n(C)c1C ZINC000462798265 875847149 /nfs/dbraw/zinc/84/71/49/875847149.db2.gz MOYIRUFHCMGQQJ-QFIPXVFZSA-N 0 3 422.525 4.211 20 0 HIADHN Cc1ccc(NC(=O)C2CCN(Cc3ccc(C(=O)OC(C)(C)C)cc3)CC2)nc1 ZINC000462799987 875848977 /nfs/dbraw/zinc/84/89/77/875848977.db2.gz AHZJXVCMYACGHN-UHFFFAOYSA-N 0 3 409.530 4.196 20 0 HIADHN C[C@H](NC[C@H]1C[C@H](O)CN1Cc1ccccc1)c1csc(-c2ccccc2F)n1 ZINC000462822326 875860102 /nfs/dbraw/zinc/86/01/02/875860102.db2.gz OMQOARLTTOJHLU-UHOSZYNNSA-N 0 3 411.546 4.235 20 0 HIADHN Cc1ccc(C(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)cc1NC(=O)NC(C)(C)C ZINC000462821550 875860152 /nfs/dbraw/zinc/86/01/52/875860152.db2.gz ZPSLDIBUIQGYEZ-AVRDEDQJSA-N 0 3 422.573 4.165 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1[nH]c2ccccc2c1Br ZINC000462823019 875862198 /nfs/dbraw/zinc/86/21/98/875862198.db2.gz RJRIIEJHJCJDIX-KBXCAEBGSA-N 0 3 412.331 4.181 20 0 HIADHN Fc1cc(CN[C@@H]2CCCc3nc(-c4ccccc4)sc32)cnc1N1CCOCC1 ZINC000462833931 875868458 /nfs/dbraw/zinc/86/84/58/875868458.db2.gz NQSIVHHUNPHOJH-LJQANCHMSA-N 0 3 424.545 4.348 20 0 HIADHN COc1cccc(C[C@@H](NCc2cnc(N3CCOCC3)c(F)c2)c2ccccc2)c1 ZINC000462835954 875870024 /nfs/dbraw/zinc/87/00/24/875870024.db2.gz UHDKNDWZSOKUEA-XMMPIXPASA-N 0 3 421.516 4.140 20 0 HIADHN CC[C@H](NCc1cnc(N2CCOCC2)c(F)c1)c1cccc(Br)c1 ZINC000462842196 875878055 /nfs/dbraw/zinc/87/80/55/875878055.db2.gz XBKLMNGZQKZGJT-SFHVURJKSA-N 0 3 408.315 4.061 20 0 HIADHN Fc1cc(CN[C@@H](c2ccc(Br)cc2)C2CC2)cnc1N1CCOCC1 ZINC000462847208 875881938 /nfs/dbraw/zinc/88/19/38/875881938.db2.gz DPBZKIULIANRIX-LJQANCHMSA-N 0 3 420.326 4.061 20 0 HIADHN Cc1cc(Cl)c2ccccc2c1NC(=O)N1CC[C@@H](N2CCN(C)CC2)[C@@H](C)C1 ZINC000462853159 875886992 /nfs/dbraw/zinc/88/69/92/875886992.db2.gz ITPZHMCSGZNDNG-LAUBAEHRSA-N 0 3 414.981 4.291 20 0 HIADHN Cc1cc(Cl)c2ccccc2c1NC(=O)N1CCN(CC2CCOCC2)CC1 ZINC000462853813 875887254 /nfs/dbraw/zinc/88/72/54/875887254.db2.gz PUZHLVRNDVCFOH-UHFFFAOYSA-N 0 3 401.938 4.378 20 0 HIADHN CCCOC[C@H](Cc1cccc(Br)c1)NCc1cn(C)nc1C(F)F ZINC000462900684 875926633 /nfs/dbraw/zinc/92/66/33/875926633.db2.gz OULSNDXXZRZNHQ-INIZCTEOSA-N 0 3 416.310 4.248 20 0 HIADHN Fc1ccccc1N1CC[C@@H](CNCc2csc(-c3ccc4c(c3)OCO4)n2)C1 ZINC000462912025 875937122 /nfs/dbraw/zinc/93/71/22/875937122.db2.gz VQCYWVWHDCUIDP-HNNXBMFYSA-N 0 3 411.502 4.294 20 0 HIADHN Cc1nc2ccc(Br)cc2c(N2CCN(C(=O)C(C)(C)C)CC2)c1C ZINC000462917226 875944434 /nfs/dbraw/zinc/94/44/34/875944434.db2.gz PQJXTFUJKFPMIG-UHFFFAOYSA-N 0 3 404.352 4.309 20 0 HIADHN O=c1c(Cl)c(N[C@H]2CCN(CC3CCCC3)C2)cnn1-c1ccc(Cl)cc1 ZINC000462947432 875967306 /nfs/dbraw/zinc/96/73/06/875967306.db2.gz UICUZVYGEXSEOH-INIZCTEOSA-N 0 3 407.345 4.216 20 0 HIADHN CCc1nc(C)c([C@H](C)N(C)C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)s1 ZINC000463018269 876036271 /nfs/dbraw/zinc/03/62/71/876036271.db2.gz BYLAEPALYBXKJB-VDZJLULYSA-N 0 3 400.592 4.237 20 0 HIADHN COc1cc(CN(C)C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)ccc1SC ZINC000463023250 876042962 /nfs/dbraw/zinc/04/29/62/876042962.db2.gz UQNPYNRKGMENCL-YLJYHZDGSA-N 0 3 413.587 4.079 20 0 HIADHN CCN(Cc1cn(-c2ccccc2)nc1-c1cc(OC)ccc1OC)[C@H]1CCOC1 ZINC000463030107 876049779 /nfs/dbraw/zinc/04/97/79/876049779.db2.gz HANPTFLDFRDAOI-FQEVSTJZSA-N 0 3 407.514 4.167 20 0 HIADHN OC[C@@]1(Cc2ccccc2)CCCN(Cc2ccccc2OCc2ccccn2)C1 ZINC000463030444 876050395 /nfs/dbraw/zinc/05/03/95/876050395.db2.gz SNGNLFIJHVAVGY-AREMUKBSSA-N 0 3 402.538 4.478 20 0 HIADHN Cc1nc(-c2cccc(NC(=O)CN3CCCC[C@@H]3[C@H]3CCCC[C@H]3O)c2)cs1 ZINC000463195481 876254388 /nfs/dbraw/zinc/25/43/88/876254388.db2.gz XUMCFCUWMQAUMB-CEMLEFRQSA-N 0 3 413.587 4.463 20 0 HIADHN C[C@@H]1CC[C@H](O)[C@H]([C@@H]2CCCCN2CC(=O)N(Cc2ccco2)c2ccccc2)C1 ZINC000463203537 876263480 /nfs/dbraw/zinc/26/34/80/876263480.db2.gz KTRRSLZPFCTMIX-DLTYFMDKSA-N 0 3 410.558 4.464 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N(Cc1ccccc1)CC1CCOCC1 ZINC000463259814 876318154 /nfs/dbraw/zinc/31/81/54/876318154.db2.gz FHHANHCYYTYEOH-SQJMNOBHSA-N 0 3 421.585 4.145 20 0 HIADHN Cc1ccc(S(=O)(=O)C[C@@H](C)NC2CCN(Cc3ccccc3Cl)CC2)cc1 ZINC000463278433 876334129 /nfs/dbraw/zinc/33/41/29/876334129.db2.gz BYKKMVGAAOYIOF-GOSISDBHSA-N 0 3 421.006 4.065 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N[C@@H]1CCCc2cn(C3CCCC3)nc21 ZINC000463280945 876338163 /nfs/dbraw/zinc/33/81/63/876338163.db2.gz UMGJFPMBDVCZAZ-YSZBQJHXSA-N 0 3 421.589 4.195 20 0 HIADHN CO[C@H](CN[C@H](C)c1ccc(Br)cc1OCCCO)c1ccccc1 ZINC000463359509 876413055 /nfs/dbraw/zinc/41/30/55/876413055.db2.gz QQVBDGZQOBSAHD-FOIQADDNSA-N 0 3 408.336 4.249 20 0 HIADHN CC1CCN(CCNC(=O)c2ccc(-c3noc(-c4ccc(F)cc4)n3)cc2)CC1 ZINC000463389149 876445422 /nfs/dbraw/zinc/44/54/22/876445422.db2.gz FSNWXBRVPZYYQB-UHFFFAOYSA-N 0 3 408.477 4.004 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1NC(=O)CCN1Cc2ccc(O)cc2C2(CC2)C1 ZINC000463420742 876475959 /nfs/dbraw/zinc/47/59/59/876475959.db2.gz WDUMIHJPHMLINC-UHFFFAOYSA-N 0 3 416.525 4.071 20 0 HIADHN COc1ccc(-c2ncc(C(=O)N(CCN(C)C)Cc3cccc(C)c3)s2)cc1 ZINC000463496727 876556133 /nfs/dbraw/zinc/55/61/33/876556133.db2.gz SOGXSXFNSTWKCQ-UHFFFAOYSA-N 0 3 409.555 4.331 20 0 HIADHN CC(C)n1cc(Br)cc1C(=O)N(CCCc1ccccc1)CCN(C)C ZINC000463516885 876582638 /nfs/dbraw/zinc/58/26/38/876582638.db2.gz TTWOCADMOYTEDI-UHFFFAOYSA-N 0 3 420.395 4.468 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)[C@@H]1C[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000463526977 876598836 /nfs/dbraw/zinc/59/88/36/876598836.db2.gz IJHKGLDOAURMBF-HZPDHXFCSA-N 0 3 412.402 4.076 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)c1cccc(-c2cscn2)c1 ZINC000463535158 876613464 /nfs/dbraw/zinc/61/34/64/876613464.db2.gz YJWLMBFUSNFNNN-UHFFFAOYSA-N 0 3 401.482 4.292 20 0 HIADHN Cc1nc(C2CCCC2)sc1C(=O)N1CCC(CN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000463558669 876644883 /nfs/dbraw/zinc/64/48/83/876644883.db2.gz RGBXFVQQOQSUIR-HOTGVXAUSA-N 0 3 405.608 4.071 20 0 HIADHN CC(C)c1nn(C)c2sc(C(=O)NC[C@H]3CCCN(Cc4cccs4)C3)cc12 ZINC000463572649 876667093 /nfs/dbraw/zinc/66/70/93/876667093.db2.gz WUNGOXZXORKRAG-OAHLLOKOSA-N 0 3 416.616 4.462 20 0 HIADHN Cc1nn(C)c(Sc2ccccc2)c1C(=O)N[C@H]1C[C@H](C)N(Cc2ccccc2)C1 ZINC000463576604 876673835 /nfs/dbraw/zinc/67/38/35/876673835.db2.gz ODMJIGUJEGOOSH-PXNSSMCTSA-N 0 3 420.582 4.273 20 0 HIADHN CC(C)N(CC(=O)Nc1ccccc1C(F)(F)F)C(=O)c1cccc(CN(C)C)c1 ZINC000468994807 883060876 /nfs/dbraw/zinc/06/08/76/883060876.db2.gz PEHWZTGMTRYAMK-UHFFFAOYSA-N 0 3 421.463 4.256 20 0 HIADHN Cc1nn(C)c(Sc2ccccc2)c1C(=O)NC[C@@H]1CCCN1Cc1ccccc1 ZINC000463770859 876892624 /nfs/dbraw/zinc/89/26/24/876892624.db2.gz NYGAMKQZOWQCJX-FQEVSTJZSA-N 0 3 420.582 4.274 20 0 HIADHN C[C@H](C(=O)N(Cc1ccco1)C1CCN(C)CC1)c1ccc(Br)s1 ZINC000463824770 876939333 /nfs/dbraw/zinc/93/93/33/876939333.db2.gz GKMBCJTUJUSVNI-ZDUSSCGKSA-N 0 3 411.365 4.330 20 0 HIADHN Cn1ccc(N2CCC[C@@H](N[C@H](Cc3ccccc3Cl)c3ccccc3)C2=O)n1 ZINC000463889882 877012514 /nfs/dbraw/zinc/01/25/14/877012514.db2.gz BEMZYFDIFGIXNI-NHCUHLMSSA-N 0 3 408.933 4.143 20 0 HIADHN Cn1cc(N2CCC[C@@H](N[C@@H](CCCc3ccccc3)c3ccccc3)C2=O)cn1 ZINC000463900037 877022349 /nfs/dbraw/zinc/02/23/49/877022349.db2.gz ZAEFIWVHKDNYKR-BJKOFHAPSA-N 0 3 402.542 4.269 20 0 HIADHN Cc1cc(N2CC[C@@H](N[C@H](Cc3ccccc3Cl)c3ccccc3)C2=O)n(C)n1 ZINC000463906918 877028960 /nfs/dbraw/zinc/02/89/60/877028960.db2.gz VENHZXGPZYRYEI-NHCUHLMSSA-N 0 3 408.933 4.061 20 0 HIADHN C[C@H](c1ccccc1)N(Cc1ccccc1)C(=O)C(=O)Nc1cccc(CN(C)C)c1 ZINC000463933160 877053742 /nfs/dbraw/zinc/05/37/42/877053742.db2.gz GNUHRGBEDHOGLW-HXUWFJFHSA-N 0 3 415.537 4.477 20 0 HIADHN COc1cccc([C@@H](NC(=O)NCCN2CCCCC2)c2ccccc2Cl)c1 ZINC000463959085 877082705 /nfs/dbraw/zinc/08/27/05/877082705.db2.gz PXZWMICEVNSMNK-OAQYLSRUSA-N 0 3 401.938 4.223 20 0 HIADHN Cc1nn(C)c(Sc2ccccc2)c1C(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C ZINC000464168156 877334674 /nfs/dbraw/zinc/33/46/74/877334674.db2.gz NIBBEIRVCGZVDG-UWJYYQICSA-N 0 3 420.582 4.130 20 0 HIADHN COc1ccccc1S(=O)(=O)CCCN[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000464487556 877707017 /nfs/dbraw/zinc/70/70/17/877707017.db2.gz OVKQUZPHHHIYNI-CQSZACIVSA-N 0 3 401.450 4.229 20 0 HIADHN CCOc1ccc(Oc2ccc(Cl)cc2NC(=O)CN[C@H](CO)C(C)C)cc1 ZINC000464498116 877717990 /nfs/dbraw/zinc/71/79/90/877717990.db2.gz LFXWCBAQWOHVDX-LJQANCHMSA-N 0 3 406.910 4.076 20 0 HIADHN CN(C)C[C@@H](NC(=O)N[C@@H]1CCOc2c(F)ccc(F)c21)c1ccc(Cl)cc1 ZINC000464508227 877732554 /nfs/dbraw/zinc/73/25/54/877732554.db2.gz DWXOFTBOBRKHRC-IAGOWNOFSA-N 0 3 409.864 4.044 20 0 HIADHN CC(C)CN(C(=O)[C@H]1C[C@@]12CCc1cc(Br)ccc12)C1CCN(C)CC1 ZINC000464572667 877793054 /nfs/dbraw/zinc/79/30/54/877793054.db2.gz HOXZKWWYRZJZNT-IFMALSPDSA-N 0 3 419.407 4.232 20 0 HIADHN COCCOC[C@H]1CCN(Cc2c(-c3ccc(Cl)cc3)nc3sccn23)C1 ZINC000464742981 877976143 /nfs/dbraw/zinc/97/61/43/877976143.db2.gz VXYVQDYYRSTZNP-HNNXBMFYSA-N 0 3 405.951 4.201 20 0 HIADHN COc1ccc(CCNC(=O)CN2CCCC[C@H]2c2cccc(C)c2C)cc1OC ZINC000464780840 878025607 /nfs/dbraw/zinc/02/56/07/878025607.db2.gz XJBIUBOHSNNUJC-QFIPXVFZSA-N 0 3 410.558 4.207 20 0 HIADHN CC(C)[C@@H](Cc1ccc(F)cc1)N(C)CC(=O)Nc1ccccc1N1CCCC1=O ZINC000464784356 878032478 /nfs/dbraw/zinc/03/24/78/878032478.db2.gz DMFCETWNURMUQT-JOCHJYFZSA-N 0 3 411.521 4.090 20 0 HIADHN CCN(CC(=O)Nc1cccc2ccccc21)CC1CCN(c2ccccn2)CC1 ZINC000464801564 878043655 /nfs/dbraw/zinc/04/36/55/878043655.db2.gz HGTLUHDWZYRLBY-UHFFFAOYSA-N 0 3 402.542 4.412 20 0 HIADHN CCN(CC(=O)Nc1ccc(Cl)cc1C)CC1CCN(c2ccccn2)CC1 ZINC000464808009 878056506 /nfs/dbraw/zinc/05/65/06/878056506.db2.gz VGBIWGQZBMWVQR-UHFFFAOYSA-N 0 3 400.954 4.220 20 0 HIADHN CCN(Cc1ncc(-c2ccc(OC)cc2)o1)CC1CCN(c2ccccn2)CC1 ZINC000464809137 878057878 /nfs/dbraw/zinc/05/78/78/878057878.db2.gz ZFFFYUOGCKKPPX-UHFFFAOYSA-N 0 3 406.530 4.484 20 0 HIADHN CCCCOC1CCN(CCc2nc3sc4c(c3c(N)n2)CC[C@@H](C)C4)CC1 ZINC000464849531 878128182 /nfs/dbraw/zinc/12/81/82/878128182.db2.gz KNTAYRGYELBETE-OAHLLOKOSA-N 0 3 402.608 4.222 20 0 HIADHN C[C@@H]1CCN(C(=O)c2cccc(Oc3cnccn3)c2)CCN1Cc1ccccc1 ZINC000464891863 878191012 /nfs/dbraw/zinc/19/10/12/878191012.db2.gz ZYYVWYLGCIUPKK-LJQANCHMSA-N 0 3 402.498 4.006 20 0 HIADHN Cc1cc(C)n(Cc2ccc(C(=O)N3CC[C@@H](C)N(Cc4ccccc4)CC3)cc2)n1 ZINC000464891129 878191939 /nfs/dbraw/zinc/19/19/39/878191939.db2.gz IVTFRGXJNQEQAD-OAQYLSRUSA-N 0 3 416.569 4.285 20 0 HIADHN Cc1ccc(-c2nc(CC(=O)N3CC[C@H](C)N(Cc4ccccc4)CC3)cs2)o1 ZINC000464897089 878203194 /nfs/dbraw/zinc/20/31/94/878203194.db2.gz FIJTUMRWYCNSSR-KRWDZBQOSA-N 0 3 409.555 4.377 20 0 HIADHN Cc1cc(C(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)c2c(n1)onc2C(C)C ZINC000464906538 878221183 /nfs/dbraw/zinc/22/11/83/878221183.db2.gz WAZSLFCPLBJYJQ-SFHVURJKSA-N 0 3 406.530 4.391 20 0 HIADHN O[C@H](COc1cc(Cl)ccc1Cl)CN1CCC[C@@H](c2ncc3n2CCCC3)C1 ZINC000503402620 912381807 /nfs/dbraw/zinc/38/18/07/912381807.db2.gz BOLFEUFWIBPKMJ-QAPCUYQASA-N 0 3 424.372 4.146 20 0 HIADHN CSc1cc(C)ccc1CNC(=O)N(CCN(C)C)Cc1ccc(F)c(F)c1 ZINC000465374453 878816443 /nfs/dbraw/zinc/81/64/43/878816443.db2.gz VCHPONFFGJTDIA-UHFFFAOYSA-N 0 3 407.530 4.269 20 0 HIADHN CCc1cnc(CCNC(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)s1 ZINC000465421959 878851374 /nfs/dbraw/zinc/85/13/74/878851374.db2.gz MJLVBMUMXUSKNX-KRWDZBQOSA-N 0 3 406.621 4.082 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N1CC[C@@H](COCc2ccccc2)C1 ZINC000465419891 878851411 /nfs/dbraw/zinc/85/14/11/878851411.db2.gz CBIVMIAJDYEGJL-NHCUHLMSSA-N 0 3 413.587 4.133 20 0 HIADHN CC1CCN([C@H](CNC(=O)N[C@@H]2[C@@H]3CCCO[C@@H]3C2(C)C)c2cccs2)CC1 ZINC000465424361 878853969 /nfs/dbraw/zinc/85/39/69/878853969.db2.gz OYDQQBZDBGSDEP-CUDHKJQZSA-N 0 3 405.608 4.024 20 0 HIADHN CC1CCN([C@H](CNC(=O)N[C@@H]2[C@H]3CCCO[C@@H]3C2(C)C)c2cccs2)CC1 ZINC000465424365 878854397 /nfs/dbraw/zinc/85/43/97/878854397.db2.gz OYDQQBZDBGSDEP-LFGUQSLTSA-N 0 3 405.608 4.024 20 0 HIADHN C[C@@H](CCc1cccn1C)NC(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1 ZINC000465433756 878864444 /nfs/dbraw/zinc/86/44/44/878864444.db2.gz OFIXXLIXJAGEQH-ICSRJNTNSA-N 0 3 402.608 4.180 20 0 HIADHN Cc1ccc(-c2nc(CNC(=O)NC[C@@H](c3ccccc3)N3CCCC3)co2)cc1 ZINC000465438212 878869931 /nfs/dbraw/zinc/86/99/31/878869931.db2.gz HPARHHLJKOSUOD-QFIPXVFZSA-N 0 3 404.514 4.286 20 0 HIADHN Cc1ccccc1[C@@H]1CN(C(=O)NC[C@H](c2ccccc2)N2CCCC2)[C@H](C)CO1 ZINC000465446340 878877740 /nfs/dbraw/zinc/87/77/40/878877740.db2.gz VYRMQLKFUNPQDU-HUVFLSCGSA-N 0 3 407.558 4.304 20 0 HIADHN COc1cccc([C@H](CNC(=O)N[C@H](c2nc(C)cs2)C2CC2)N2CCCC2)c1 ZINC000465464580 878897758 /nfs/dbraw/zinc/89/77/58/878897758.db2.gz DJGVSNYHDHHIDJ-PMACEKPBSA-N 0 3 414.575 4.048 20 0 HIADHN CN(C)CCN(C[C@@H]1CCCO1)C(=O)N[C@H](c1cc2ccccc2o1)c1ccccc1 ZINC000465497421 878937150 /nfs/dbraw/zinc/93/71/50/878937150.db2.gz FLCHKCBZTNTWBC-URXFXBBRSA-N 0 3 421.541 4.274 20 0 HIADHN O[C@@H](COc1ccc(Cl)cc1Cl)CN1CCC[C@@H](c2ncc3n2CCCC3)C1 ZINC000503416599 912403055 /nfs/dbraw/zinc/40/30/55/912403055.db2.gz RKTWALIPNSWAMA-CRAIPNDOSA-N 0 3 424.372 4.146 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NC[C@H]1CCO[C@@H]1c1ccccc1)c1ccsc1 ZINC000465528793 878984836 /nfs/dbraw/zinc/98/48/36/878984836.db2.gz UNHDZNIVBLREPD-HMXCVIKNSA-N 0 3 401.576 4.208 20 0 HIADHN CC[C@@H](CNC(=O)NCc1coc(-c2ccc(C)cc2)n1)N1CCc2ccccc2C1 ZINC000465533433 878989710 /nfs/dbraw/zinc/98/97/10/878989710.db2.gz XWJQLIKHFWGNNQ-QHCPKHFHSA-N 0 3 418.541 4.286 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CC[C@H](COCc2ccccc2)C1)c1ccsc1 ZINC000465532878 878990371 /nfs/dbraw/zinc/99/03/71/878990371.db2.gz WBGROGDDXSCCIQ-UNMCSNQZSA-N 0 3 415.603 4.379 20 0 HIADHN COc1ccc(OC)c([C@H](C)NC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)c1 ZINC000465568094 879042296 /nfs/dbraw/zinc/04/22/96/879042296.db2.gz JHALTNIZOQDOJY-OALUTQOASA-N 0 3 411.546 4.071 20 0 HIADHN C[C@H]1CCN(C(=O)NCCCCOc2ccc(F)cc2)CCN1Cc1ccccc1 ZINC000465589215 879069840 /nfs/dbraw/zinc/06/98/40/879069840.db2.gz CIMZCSWROODXTA-FQEVSTJZSA-N 0 3 413.537 4.291 20 0 HIADHN Cc1ccccc1[C@@H]1CN(C(=O)N[C@@H](CN2CCCC2)c2ccccc2)[C@@H](C)CO1 ZINC000465594436 879079874 /nfs/dbraw/zinc/07/98/74/879079874.db2.gz HFWJLQNZHVXYSI-OYDLWJJNSA-N 0 3 407.558 4.304 20 0 HIADHN CC[C@H](C)c1ccc([C@@H](NC(=O)NC[C@H](C)CN2CCN(C)CC2)C(C)C)cc1 ZINC000465632517 879145031 /nfs/dbraw/zinc/14/50/31/879145031.db2.gz OSIOOJRMEHFBAE-JTAQYXEDSA-N 0 3 402.627 4.080 20 0 HIADHN C[C@@H]1CCN(C(=O)NCc2ccc(Br)s2)CCN1Cc1ccccc1 ZINC000465692980 879246687 /nfs/dbraw/zinc/24/66/87/879246687.db2.gz NSBVPIMQBBKADR-OAHLLOKOSA-N 0 3 422.392 4.317 20 0 HIADHN CC[C@@H](NC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1)c1ccc2c(c1)OCCO2 ZINC000465708337 879274957 /nfs/dbraw/zinc/27/49/57/879274957.db2.gz MGMGPSZSRJOKDH-DENIHFKCSA-N 0 3 423.557 4.215 20 0 HIADHN C[C@@H]1CCN(C(=O)NC[C@@H]2CCCO[C@H]2c2ccccc2)CCN1Cc1ccccc1 ZINC000465730795 879313265 /nfs/dbraw/zinc/31/32/65/879313265.db2.gz WEFKEPGYRCAFQP-ZODMCCGTSA-N 0 3 421.585 4.460 20 0 HIADHN C[C@H]1CCN(C(=O)N[C@H]2CCOc3c(Cl)cccc32)CCN1Cc1ccccc1 ZINC000465750486 879337023 /nfs/dbraw/zinc/33/70/23/879337023.db2.gz ICUSZOVJFLCWLH-UWJYYQICSA-N 0 3 413.949 4.470 20 0 HIADHN C[C@H](NC(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1)c1nc(C2CCCCC2)no1 ZINC000465753996 879344096 /nfs/dbraw/zinc/34/40/96/879344096.db2.gz LEISNVDMDMDCQZ-ZWOKBUDYSA-N 0 3 411.550 4.313 20 0 HIADHN Cc1ccc(-c2nc(CNC(=O)N[C@H]3CCN([C@@H](C)c4ccccc4)C3)co2)cc1 ZINC000465756532 879348461 /nfs/dbraw/zinc/34/84/61/879348461.db2.gz OAOKMNBLEVRFSS-RXVVDRJESA-N 0 3 404.514 4.285 20 0 HIADHN C[C@H]1CCN(C(=O)N[C@H]2CCCOc3ccc(F)cc32)CCN1Cc1ccccc1 ZINC000465760020 879355304 /nfs/dbraw/zinc/35/53/04/879355304.db2.gz QLOJRHFFLRMCHD-AVRDEDQJSA-N 0 3 411.521 4.345 20 0 HIADHN COc1ccc(C(C)(C)CNC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)cc1 ZINC000465814590 879437114 /nfs/dbraw/zinc/43/71/14/879437114.db2.gz PYCAJWPDAGONJJ-HXUWFJFHSA-N 0 3 409.574 4.279 20 0 HIADHN C[C@@H]1CCN(C(=O)NCc2cccc(OCC(F)F)c2)CCN1Cc1ccccc1 ZINC000465825560 879456045 /nfs/dbraw/zinc/45/60/45/879456045.db2.gz GKSLKFCBCOJLNW-GOSISDBHSA-N 0 3 417.500 4.137 20 0 HIADHN COc1ccccc1C[C@H](C)N(C)C(=O)NC[C@@H](c1ccc(C)cc1)N1CCCC1 ZINC000465825674 879456212 /nfs/dbraw/zinc/45/62/12/879456212.db2.gz HLWYRLCJJDXXNT-REWPJTCUSA-N 0 3 409.574 4.413 20 0 HIADHN O=C(NC1CCCCC1)C1CCN(Cc2cccc(OCc3ccccn3)c2)CC1 ZINC000512370435 921111681 /nfs/dbraw/zinc/11/16/81/921111681.db2.gz QZNNFCKBCAVALW-UHFFFAOYSA-N 0 3 407.558 4.322 20 0 HIADHN O=C(NCc1ccc(-c2cccnc2)cc1)NC[C@@H]1CCCN1Cc1ccccc1 ZINC000465926467 879590375 /nfs/dbraw/zinc/59/03/75/879590375.db2.gz IRKSCGQKYNDKPA-DEOSSOPVSA-N 0 3 400.526 4.212 20 0 HIADHN C[C@H](NC(=O)N1CC[C@H](N2CC=CC2)C1)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000465939463 879605906 /nfs/dbraw/zinc/60/59/06/879605906.db2.gz JARMLPXKEIMJRV-AVRDEDQJSA-N 0 3 409.505 4.121 20 0 HIADHN CC[C@@H](NC(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1)C(C)(C)c1ccccc1 ZINC000465965874 879634439 /nfs/dbraw/zinc/63/44/39/879634439.db2.gz FURKBVAZHFGHQA-ZRCGQRJVSA-N 0 3 415.622 4.274 20 0 HIADHN CC[C@H](NC(=O)N(C)C1CCN(CCc2ccccn2)CC1)C(C)(C)c1ccccc1 ZINC000465970081 879637958 /nfs/dbraw/zinc/63/79/58/879637958.db2.gz CMMRMAYRHSTRHX-DEOSSOPVSA-N 0 3 422.617 4.486 20 0 HIADHN COc1cccc([C@H](Cc2cc(C)cc(C)c2)NC(=O)N[C@@H]2CCN(C3CC3)C2)c1 ZINC000466010951 879690437 /nfs/dbraw/zinc/69/04/37/879690437.db2.gz CBZQWCYUPNCLOA-QPPBQGQZSA-N 0 3 407.558 4.132 20 0 HIADHN O=C(N[C@H](c1ccccc1Cl)c1cc(F)ccc1F)N[C@@H]1CCN(C2CC2)C1 ZINC000466015985 879697207 /nfs/dbraw/zinc/69/72/07/879697207.db2.gz KFOTUKKWYRWRPQ-JLTOFOAXSA-N 0 3 405.876 4.244 20 0 HIADHN Cc1cc([C@@H](NC(=O)N[C@H]2CCN(C3CC3)C2)c2ccccc2Cl)ccc1F ZINC000466014768 879697890 /nfs/dbraw/zinc/69/78/90/879697890.db2.gz JKENNBWTJJXEKG-HRAATJIYSA-N 0 3 401.913 4.413 20 0 HIADHN COc1ccc([C@H](NC(=O)N[C@@H]2CCN(C3CC3)C2)c2ccccc2Cl)c(C)c1 ZINC000466017433 879701274 /nfs/dbraw/zinc/70/12/74/879701274.db2.gz NGEDCQVPNWLYBV-ZHRRBRCNSA-N 0 3 413.949 4.282 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCC[C@@H](C)c3ccc(OC)cc3)c(C)c2)CC1 ZINC000466051558 879741248 /nfs/dbraw/zinc/74/12/48/879741248.db2.gz DENHJSMJDGGTFV-LJQANCHMSA-N 0 3 424.589 4.461 20 0 HIADHN COCCN(CCN(C)C)C(=O)N[C@H](c1ccc(F)c(C)c1)c1ccccc1Cl ZINC000466101412 879818999 /nfs/dbraw/zinc/81/89/99/879818999.db2.gz KPXKTJFTOVKACO-OAQYLSRUSA-N 0 3 421.944 4.097 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccc(O)cc1)C(=O)c1nc(-c2ccccc2)oc1C ZINC000503466211 912499266 /nfs/dbraw/zinc/49/92/66/912499266.db2.gz FOTLBSJJEHMEDS-OAQYLSRUSA-N 0 3 419.525 4.482 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)NC3CC(c4cccc(Cl)c4)C3)CC2)C[C@H](C)O1 ZINC000466106829 879823383 /nfs/dbraw/zinc/82/33/83/879823383.db2.gz KNNWPZJVOIUUBK-DCEJCQMCSA-N 0 3 419.997 4.117 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)Nc2ccccc2Oc2ccc(C)cc2)CC1 ZINC000466111425 879825783 /nfs/dbraw/zinc/82/57/83/879825783.db2.gz BAXMTWGKTLGUGT-FQEVSTJZSA-N 0 3 410.562 4.182 20 0 HIADHN C[C@H](CNC(=O)N(CCN(C)C)Cc1cccc(F)c1)Oc1ccccc1Cl ZINC000466167310 879869147 /nfs/dbraw/zinc/86/91/47/879869147.db2.gz OKDDKMMWAXCBSG-MRXNPFEDSA-N 0 3 407.917 4.020 20 0 HIADHN CC[C@H](C)C(=O)Nc1cccc(CNC(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)c1 ZINC000466214163 879905460 /nfs/dbraw/zinc/90/54/60/879905460.db2.gz APRDLLJRVMCCST-SFYKDHMMSA-N 0 3 422.573 4.133 20 0 HIADHN CCOc1ccc([C@H](C)NC(=O)N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)cc1OC ZINC000466217929 879913516 /nfs/dbraw/zinc/91/35/16/879913516.db2.gz METKDETXKAFYJT-WFXMLNOXSA-N 0 3 411.546 4.117 20 0 HIADHN CCN(c1ccccc1)c1ccc(CNC(=O)N(CCN(C)C)C[C@H]2CCCO2)cc1 ZINC000466235138 879939584 /nfs/dbraw/zinc/93/95/84/879939584.db2.gz JBAHSIASEUEGLS-XMMPIXPASA-N 0 3 424.589 4.097 20 0 HIADHN CC(C)CC(=O)Nc1cccc(CNC(=O)N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)c1 ZINC000466245766 879959790 /nfs/dbraw/zinc/95/97/90/879959790.db2.gz BRDDOOSLBPCHPZ-AUSIDOKSSA-N 0 3 422.573 4.133 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)C2(Cc3ccccc3)CCC2)cc1)[C@@H]1CCCN(C)C1 ZINC000466245963 879960062 /nfs/dbraw/zinc/96/00/62/879960062.db2.gz KZSOFEBBLHXDOG-HSZRJFAPSA-N 0 3 419.569 4.204 20 0 HIADHN CC(C)CC(=O)Nc1cccc(CNC(=O)N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)c1 ZINC000466245767 879960808 /nfs/dbraw/zinc/96/08/08/879960808.db2.gz BRDDOOSLBPCHPZ-CVDCTZTESA-N 0 3 422.573 4.133 20 0 HIADHN CSc1cccc([C@@H](NC(=O)N2CCCN(C)CC2)c2ccc(F)c(F)c2)c1 ZINC000466266626 880000094 /nfs/dbraw/zinc/00/00/94/880000094.db2.gz ILOLINKMMAYKFH-HXUWFJFHSA-N 0 3 405.514 4.123 20 0 HIADHN CO[C@H](C)[C@H](C)N[C@H](C)C(=O)N1N=C(c2ccc(Cl)cc2)C[C@H]1c1ccco1 ZINC000466429026 880204292 /nfs/dbraw/zinc/20/42/92/880204292.db2.gz UQKNZWADXORXEN-HRLGVUPISA-N 0 3 403.910 4.012 20 0 HIADHN COc1ccc(C(=O)Nc2ccc(C(=O)NC[C@@H](C)N3CCCC[C@H]3C)s2)cc1 ZINC000466457261 880237722 /nfs/dbraw/zinc/23/77/22/880237722.db2.gz RGMGRXBRDIVGJK-HZPDHXFCSA-N 0 3 415.559 4.002 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccc(O)cc1)C(=O)[C@H]1SCCc2sccc21 ZINC000503498701 912546362 /nfs/dbraw/zinc/54/63/62/912546362.db2.gz ZKBNZEVPTWAUOL-UWJYYQICSA-N 0 3 416.612 4.297 20 0 HIADHN O=C1C[C@@H](NCc2cc(F)cc3cccnc32)CN1Cc1ccccc1C(F)(F)F ZINC000466476066 880258147 /nfs/dbraw/zinc/25/81/47/880258147.db2.gz VZVCRNYHQMYCGJ-GOSISDBHSA-N 0 3 417.406 4.283 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)Nc2ccc(C(=O)NC3CCCC3)cc2)CN1Cc1ccccc1 ZINC000466518179 880293154 /nfs/dbraw/zinc/29/31/54/880293154.db2.gz LSIYTWNERYLCNT-WZONZLPQSA-N 0 3 420.557 4.144 20 0 HIADHN CC(C)CC(=O)Nc1ccc(NC(=O)N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)cc1 ZINC000466518146 880293483 /nfs/dbraw/zinc/29/34/83/880293483.db2.gz LKVMINTXVVFLIM-GCJKJVERSA-N 0 3 408.546 4.456 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)N2CCC(c3nc4ccccc4[nH]3)CC2)CN1Cc1ccccc1 ZINC000466521275 880298271 /nfs/dbraw/zinc/29/82/71/880298271.db2.gz WIQAYNZWGQYFAQ-WIYYLYMNSA-N 0 3 417.557 4.115 20 0 HIADHN CCOCCOCc1cccc(NC(=O)N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)c1 ZINC000466531527 880307023 /nfs/dbraw/zinc/30/70/23/880307023.db2.gz YVVDFEGTUKUNJS-CVDCTZTESA-N 0 3 411.546 4.024 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)NC(=O)N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)cc1 ZINC000466541340 880315550 /nfs/dbraw/zinc/31/55/50/880315550.db2.gz QWWQBELENCXAOH-SELNLUPBSA-N 0 3 417.557 4.204 20 0 HIADHN CC[C@H](CNC(=O)N1CCC[C@H]1c1ccc(COC)o1)N1CCc2ccccc2C1 ZINC000466564008 880339028 /nfs/dbraw/zinc/33/90/28/880339028.db2.gz QEHXTWIKIGBAIX-IRLDBZIGSA-N 0 3 411.546 4.109 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)N[C@@H]1CCCc2sccc21 ZINC000466567443 880343277 /nfs/dbraw/zinc/34/32/77/880343277.db2.gz QQFRJYCUKLJLKK-OAQYLSRUSA-N 0 3 412.603 4.027 20 0 HIADHN COCC[C@@H]1CCCCN(C(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)C1 ZINC000466847011 880616186 /nfs/dbraw/zinc/61/61/86/880616186.db2.gz SQXLXECHOKYDOZ-FPOVZHCZSA-N 0 3 412.496 4.106 20 0 HIADHN Cc1cc(C(F)(F)F)ccc1CNC(=O)N(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1 ZINC000466881366 880648994 /nfs/dbraw/zinc/64/89/94/880648994.db2.gz GFOIOSNXMLUDTB-ICSRJNTNSA-N 0 3 420.479 4.243 20 0 HIADHN C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)N(C)[C@@H]1CCSc2ccc(Br)cc21 ZINC000466921330 880689058 /nfs/dbraw/zinc/68/90/58/880689058.db2.gz KAIDXXCWQQDSNT-OAUYIBNBSA-N 0 3 424.408 4.110 20 0 HIADHN Cc1cccc(C[C@H](CO)NCc2cccc(Br)c2OC(F)F)c1 ZINC000466920617 880689269 /nfs/dbraw/zinc/68/92/69/880689269.db2.gz RBWRYXZYFNGFNS-OAHLLOKOSA-N 0 3 400.263 4.052 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@@H]2CNC(=O)N2CCN(C3CCC(C)CC3)CC2)cc1 ZINC000466937725 880706738 /nfs/dbraw/zinc/70/67/38/880706738.db2.gz HVFZDQAAZQRJSG-BVWUFBLMSA-N 0 3 413.606 4.369 20 0 HIADHN C[C@H](NC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1)c1ccc(-n2cccn2)cc1 ZINC000466964250 880757581 /nfs/dbraw/zinc/75/75/81/880757581.db2.gz JJRJRSCDILUYOJ-SFTDATJTSA-N 0 3 417.557 4.239 20 0 HIADHN CCS[C@@H]1CC[C@H](N(C)C(=O)Nc2ccc(N3CCN(CC)CC3)cc2C)C1 ZINC000466978504 880782082 /nfs/dbraw/zinc/78/20/82/880782082.db2.gz ZELCRWSLJOMANE-AZUAARDMSA-N 0 3 404.624 4.275 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1NC(=O)N[C@@H]1C[C@@H](C)N(Cc2ccccc2)C1 ZINC000466976485 880782320 /nfs/dbraw/zinc/78/23/20/880782320.db2.gz JSJNEHJULVVSOD-DYESRHJHSA-N 0 3 403.530 4.274 20 0 HIADHN Cc1nc(COc2cccc(C(=O)N[C@H]3C[C@H](C)N(Cc4ccccc4)C3)c2)cs1 ZINC000467034543 880832871 /nfs/dbraw/zinc/83/28/71/880832871.db2.gz PJIUYYOBNALTKS-UWJYYQICSA-N 0 3 421.566 4.423 20 0 HIADHN CCSCC[C@H](C)NC(=O)N(CCN(C)C)Cc1ccc(Br)cc1 ZINC000467035656 880833585 /nfs/dbraw/zinc/83/35/85/880833585.db2.gz UXZPESDNQSTYSC-HNNXBMFYSA-N 0 3 416.429 4.054 20 0 HIADHN C[C@H]1C[C@H](NC(=O)CCc2ncc(-c3ccccc3F)o2)CN1Cc1ccccc1 ZINC000467035447 880833832 /nfs/dbraw/zinc/83/38/32/880833832.db2.gz RUJVNALKJPHSCQ-HKUYNNGSSA-N 0 3 407.489 4.193 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(C)c1C(=O)N[C@H]1C[C@@H](C)N(Cc2ccccc2)C1 ZINC000467035328 880833880 /nfs/dbraw/zinc/83/38/80/880833880.db2.gz UTYUDIAEBNGWMD-IERDGZPVSA-N 0 3 406.505 4.021 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)c2ccc(-c3nc(C4CC4)no3)cc2)CN1Cc1ccccc1 ZINC000467039014 880836176 /nfs/dbraw/zinc/83/61/76/880836176.db2.gz TXYOSVRFDDINKT-IERDGZPVSA-N 0 3 402.498 4.007 20 0 HIADHN Cc1noc(C)c1COc1cccc(C(=O)N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)c1 ZINC000467054425 880844264 /nfs/dbraw/zinc/84/42/64/880844264.db2.gz STBGLAMFYWYWDD-VGSWGCGISA-N 0 3 419.525 4.263 20 0 HIADHN CCOC(=O)c1c2c(sc1NC(=O)c1ccncc1Cl)C(C)(C)NC(C)(C)C2 ZINC000467107764 880867469 /nfs/dbraw/zinc/86/74/69/880867469.db2.gz UTAUOBFDUKXLRR-UHFFFAOYSA-N 0 3 421.950 4.385 20 0 HIADHN COC[C@@H]1CCCCN(CC(=O)N[C@H](c2ccccc2)c2ccc(Cl)cc2)C1 ZINC000467117760 880874710 /nfs/dbraw/zinc/87/47/10/880874710.db2.gz GNKPUKDODFOFLU-WZONZLPQSA-N 0 3 400.950 4.294 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N[C@@H](C)c1nc(C(F)(F)F)cs1)c1ccco1 ZINC000503551466 912618772 /nfs/dbraw/zinc/61/87/72/912618772.db2.gz MYPWFEWBWDARCB-SRVKXCTJSA-N 0 3 404.458 4.245 20 0 HIADHN O=C(Nc1ncc(-c2ccccc2)s1)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000467237454 880964175 /nfs/dbraw/zinc/96/41/75/880964175.db2.gz WVCPIKNQQWISGS-UHFFFAOYSA-N 0 3 408.527 4.411 20 0 HIADHN COC[C@H]1CCCCN(CC(=O)N[C@@H](c2ccccc2)c2cccc(Cl)c2)C1 ZINC000467275441 881019103 /nfs/dbraw/zinc/01/91/03/881019103.db2.gz PVNHVLTVSPZZQP-MBSDFSHPSA-N 0 3 400.950 4.294 20 0 HIADHN CCN(Cc1ccccn1)C[C@@H](O)COC(c1ccc(F)cc1)c1ccc(F)cc1 ZINC000467279893 881024054 /nfs/dbraw/zinc/02/40/54/881024054.db2.gz UQTPDHYQMMNYOE-HSZRJFAPSA-N 0 3 412.480 4.349 20 0 HIADHN COCC[C@H]1CCCCN(CC(=O)Nc2ccc(NC(=O)c3cccs3)cc2)C1 ZINC000467281687 881029034 /nfs/dbraw/zinc/02/90/34/881029034.db2.gz XEAPIOSOSORVRG-QGZVFWFLSA-N 0 3 415.559 4.078 20 0 HIADHN O=[S@](CCN(Cc1cccc(Br)c1)C1CCOCC1)c1ccccc1 ZINC000467292418 881039179 /nfs/dbraw/zinc/03/91/79/881039179.db2.gz UDZGCIAYRSNNMO-RUZDIDTESA-N 0 3 422.388 4.238 20 0 HIADHN COc1cc2c(cc1F)CC[C@H]2N[C@H](C)c1cc(F)ccc1N1CCN(C)CC1 ZINC000467341313 881093236 /nfs/dbraw/zinc/09/32/36/881093236.db2.gz DLCNQOCWRSGXAZ-QVKFZJNVSA-N 0 3 401.501 4.063 20 0 HIADHN Cc1cc(CN[C@@H](C)c2ccc([S@@](C)=O)cc2)ccc1I ZINC000467380178 881158387 /nfs/dbraw/zinc/15/83/87/881158387.db2.gz CQCJPXZQOGYJAS-YEJXKQKISA-N 0 3 413.324 4.188 20 0 HIADHN CC(=O)Nc1cccc([C@H](C)NCc2ccc(I)c(C)c2)c1 ZINC000467382999 881163238 /nfs/dbraw/zinc/16/32/38/881163238.db2.gz COPKSJQOXSHSFQ-ZDUSSCGKSA-N 0 3 408.283 4.409 20 0 HIADHN COc1c(Br)cc(Br)cc1CN(C)CC[C@H]1CCCO1 ZINC000467387078 881167583 /nfs/dbraw/zinc/16/75/83/881167583.db2.gz DNWIVZPHITVECR-CYBMUJFWSA-N 0 3 407.146 4.221 20 0 HIADHN COc1ccc2c(c1)[C@H](N[C@H]1CC(=O)N(C)[C@H]1c1ccc(F)c(F)c1)CCS2 ZINC000467394019 881178240 /nfs/dbraw/zinc/17/82/40/881178240.db2.gz BGASBNATLWXEFH-LQWHRVPQSA-N 0 3 404.482 4.072 20 0 HIADHN COc1ccc2c(c1)[C@H](NCCNC(=O)c1ccc(Br)cc1)CCS2 ZINC000467401335 881185495 /nfs/dbraw/zinc/18/54/95/881185495.db2.gz OOSHXOPDZRNNNI-QGZVFWFLSA-N 0 3 421.360 4.014 20 0 HIADHN CCS(=O)(=O)c1cccc(CN[C@H](C)CC(=O)Nc2ccccc2C(C)C)c1 ZINC000467402511 881188422 /nfs/dbraw/zinc/18/84/22/881188422.db2.gz FGCQNLVQHKTHJX-QGZVFWFLSA-N 0 3 402.560 4.111 20 0 HIADHN COc1ccc(CN[C@@H](c2cccc(Br)c2)C2CCOCC2)cc1O ZINC000467425781 881214506 /nfs/dbraw/zinc/21/45/06/881214506.db2.gz SBHJUUOSJRIDGI-HXUWFJFHSA-N 0 3 406.320 4.421 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](NC[C@H](CO)CC2CCCC2)c2ccc(F)cc2)c1 ZINC000467444718 881245628 /nfs/dbraw/zinc/24/56/28/881245628.db2.gz PXNPTPKBBFEJTM-WZONZLPQSA-N 0 3 419.562 4.097 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)Nc2ccc(OCc3ccncc3)cc2)CN1Cc1ccccc1 ZINC000467464871 881277297 /nfs/dbraw/zinc/27/72/97/881277297.db2.gz QSPPASWLHLNZNM-WMZHIEFXSA-N 0 3 416.525 4.445 20 0 HIADHN Cc1ccnc(-c2cccc(NC(=O)N[C@@H]3C[C@H](C)N(Cc4ccccc4)C3)c2)n1 ZINC000467469553 881284554 /nfs/dbraw/zinc/28/45/54/881284554.db2.gz OSKPPHUVGYTBNN-PGRDOPGGSA-N 0 3 401.514 4.237 20 0 HIADHN CCCc1sc(C(=O)NCc2ccccc2CN2CCC(O)CC2)cc1CC ZINC000467497845 881314026 /nfs/dbraw/zinc/31/40/26/881314026.db2.gz YHJJAFZQCABUHE-UHFFFAOYSA-N 0 3 400.588 4.150 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)c1ccc2c(c1)Cc1ccccc1-2 ZINC000467502751 881318697 /nfs/dbraw/zinc/31/86/97/881318697.db2.gz NVSFJQDREJTUHH-UHFFFAOYSA-N 0 3 412.533 4.145 20 0 HIADHN c1ccc(C(OCCN2CCC[C@@H](c3nnc4n3CCC4)C2)c2ccccc2)cc1 ZINC000503588461 912674283 /nfs/dbraw/zinc/67/42/83/912674283.db2.gz IKNOVDDJUYRIMM-JOCHJYFZSA-N 0 3 402.542 4.210 20 0 HIADHN C[C@@H](CCCOc1ccccc1C(N)=O)N[C@H](c1cccc(F)c1)c1ccccn1 ZINC000469079661 883166290 /nfs/dbraw/zinc/16/62/90/883166290.db2.gz QCCHJFMSWGZYHS-GAJHUEQPSA-N 0 3 407.489 4.246 20 0 HIADHN COc1ccccc1[C@H](C)NC(=O)[C@@H](C)N(C)CCCc1cc(-c2ccccc2)n[nH]1 ZINC000503594279 912683925 /nfs/dbraw/zinc/68/39/25/912683925.db2.gz LTKWBSQQNJTAHZ-RBUKOAKNSA-N 0 3 420.557 4.216 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N3CCC(OC4CCC(C)CC4)CC3)cc2)CC1 ZINC000469147915 883245171 /nfs/dbraw/zinc/24/51/71/883245171.db2.gz CJQNKUKRCRDKOD-UHFFFAOYSA-N 0 3 413.606 4.028 20 0 HIADHN COC(=O)[C@](C)(CN[C@@H](C)C(=O)Nc1c(C)cc(C)cc1Cl)c1ccccc1 ZINC000469188163 883287723 /nfs/dbraw/zinc/28/77/23/883287723.db2.gz CTACYSITGHZBAT-KSFYIVLOSA-N 0 3 402.922 4.004 20 0 HIADHN CCc1n[nH]c(C(=O)N(CC)[C@@H]2CCN([C@H](C)c3ccccc3)C2)c1Br ZINC000469225218 883325395 /nfs/dbraw/zinc/32/53/95/883325395.db2.gz JEQCAXJFPHDNCX-GDBMZVCRSA-N 0 3 419.367 4.032 20 0 HIADHN CCOc1ccc([C@H](C)N[C@H]2CCCN(Cc3ccc(F)cc3F)C2=O)cc1OC ZINC000469230963 883329992 /nfs/dbraw/zinc/32/99/92/883329992.db2.gz KGQJXPBVVPJBLM-YWZLYKJASA-N 0 3 418.484 4.214 20 0 HIADHN COc1cccc([C@H](C)CCCC(=O)NC[C@H]2CN(Cc3ccccc3)CCCO2)c1 ZINC000469234517 883333455 /nfs/dbraw/zinc/33/34/55/883333455.db2.gz SVFRQDURCGBDCN-BWKNWUBXSA-N 0 3 424.585 4.376 20 0 HIADHN CCOC(=O)c1csc(CCN[C@@H](C)c2cnn(-c3cccc(Cl)c3)c2C)n1 ZINC000469239147 883338360 /nfs/dbraw/zinc/33/83/60/883338360.db2.gz MMKCPOIOCITTJP-ZDUSSCGKSA-N 0 3 418.950 4.361 20 0 HIADHN CCN(C(=O)c1ccc(OCC(F)(F)F)cn1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000469294471 883391265 /nfs/dbraw/zinc/39/12/65/883391265.db2.gz RFBJYIMAGUUYFS-AEFFLSMTSA-N 0 3 421.463 4.320 20 0 HIADHN C[C@@H](Cn1cc(Br)cn1)NCc1cccnc1Oc1cccc(F)c1 ZINC000469326823 883432859 /nfs/dbraw/zinc/43/28/59/883432859.db2.gz ZGZXXZKDDSZVHP-ZDUSSCGKSA-N 0 3 405.271 4.150 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)c1oc(-c2ccccc2)nc1C ZINC000469352441 883471642 /nfs/dbraw/zinc/47/16/42/883471642.db2.gz YEDRVFMWVUGQES-NRFANRHFSA-N 0 3 404.514 4.172 20 0 HIADHN CN(C)Cc1cccc(C(=O)Nc2ccnn2Cc2ccc(Br)cc2)c1 ZINC000469377280 883507488 /nfs/dbraw/zinc/50/74/88/883507488.db2.gz OVIURQPSTFULSW-UHFFFAOYSA-N 0 3 413.319 4.008 20 0 HIADHN CC(C)N(C)C(=O)C1CCN(C(=O)CN(Cc2ccccc2)[C@@H](C)C(C)(C)C)CC1 ZINC000469444032 883637880 /nfs/dbraw/zinc/63/78/80/883637880.db2.gz FYUFEEUQBBXVHQ-FQEVSTJZSA-N 0 3 415.622 4.029 20 0 HIADHN CCN(Cc1ccccc1NC(=O)N[C@@H](CN(C)Cc1ccccc1)C(C)C)C(C)=O ZINC000469464441 883677851 /nfs/dbraw/zinc/67/78/51/883677851.db2.gz JBQUNRXVVNPIBL-DEOSSOPVSA-N 0 3 424.589 4.333 20 0 HIADHN Cc1nc(-c2ccc(N[C@H](C[N@H+](C)Cc3ccccc3)C(C)C)nc2)[n-]c(=O)c1C ZINC000469548358 883809592 /nfs/dbraw/zinc/80/95/92/883809592.db2.gz ZCFSONXMDWOJIW-OAQYLSRUSA-N 0 3 405.546 4.430 20 0 HIADHN Cc1nc(-c2ccc(N[C@H](C[N@@H+](C)Cc3ccccc3)C(C)C)nc2)[n-]c(=O)c1C ZINC000469548358 883809593 /nfs/dbraw/zinc/80/95/93/883809593.db2.gz ZCFSONXMDWOJIW-OAQYLSRUSA-N 0 3 405.546 4.430 20 0 HIADHN CCN(C(=O)c1cc(C)n(-c2c(F)cccc2F)n1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000469564724 883816809 /nfs/dbraw/zinc/81/68/09/883816809.db2.gz DANUDSKNRIUKAC-LJQANCHMSA-N 0 3 424.495 4.196 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N3C[C@H](c4cc(C)ccc4C)OC[C@@H]3C)cc2)CC1 ZINC000469636515 883843478 /nfs/dbraw/zinc/84/34/78/883843478.db2.gz ZTIFMDBPLFSAAK-SQJMNOBHSA-N 0 3 421.585 4.048 20 0 HIADHN CC(=O)CC1(C(=O)N2CCC(N(C)Cc3cccc(C(F)(F)F)c3)CC2)CCC1 ZINC000469656042 883851712 /nfs/dbraw/zinc/85/17/12/883851712.db2.gz WADKQCBLBPFBFO-UHFFFAOYSA-N 0 3 410.480 4.278 20 0 HIADHN Cc1cccc(NC(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)c1Br ZINC000469664922 883858198 /nfs/dbraw/zinc/85/81/98/883858198.db2.gz KJOBOLZRVZKOTF-KRWDZBQOSA-N 0 3 402.336 4.496 20 0 HIADHN CCN(C(=O)c1ccc2nnc(C(C)(C)C)n2c1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000469710011 883882586 /nfs/dbraw/zinc/88/25/86/883882586.db2.gz NAQIRDDMHDTDCT-NQIIRXRSSA-N 0 3 419.573 4.324 20 0 HIADHN C[C@@H]1C[C@@H](N(C)C(=O)CCC(=O)c2ccc(Cl)cn2)CCN1Cc1ccccc1 ZINC000469808647 883983017 /nfs/dbraw/zinc/98/30/17/883983017.db2.gz KIOBLXGTKVMPKA-XLIONFOSSA-N 0 3 413.949 4.209 20 0 HIADHN C[C@H](NCc1cccc(C(=O)N2CCOCC2)c1)c1ccc(-c2ccncc2)cc1 ZINC000469812328 883987885 /nfs/dbraw/zinc/98/78/85/883987885.db2.gz YQJXJCKNKQAMBW-IBGZPJMESA-N 0 3 401.510 4.072 20 0 HIADHN O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)c1occc1-c1ccc(F)cc1 ZINC000469862137 884049181 /nfs/dbraw/zinc/04/91/81/884049181.db2.gz ZBUHONMPXBQXAD-OAQYLSRUSA-N 0 3 408.473 4.107 20 0 HIADHN CC(C)(C(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1)c1ccc(Cl)cc1F ZINC000469866849 884056826 /nfs/dbraw/zinc/05/68/26/884056826.db2.gz OSKJGLJHUMILEN-LJQANCHMSA-N 0 3 418.940 4.164 20 0 HIADHN Cc1c2cc(F)ccc2sc1C(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000469868460 884058144 /nfs/dbraw/zinc/05/81/44/884058144.db2.gz CIXNOVHVZLGWSC-LJQANCHMSA-N 0 3 412.530 4.370 20 0 HIADHN Cc1c(NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cnn1-c1ccccc1 ZINC000469906850 884096413 /nfs/dbraw/zinc/09/64/13/884096413.db2.gz FILVYJCENUKTLY-UHFFFAOYSA-N 0 3 421.467 4.108 20 0 HIADHN O=C(Nc1ccc(C(F)(F)F)nc1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000469927716 884121537 /nfs/dbraw/zinc/12/15/37/884121537.db2.gz LYYOPWSTYJELEQ-UHFFFAOYSA-N 0 3 410.362 4.027 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@H]2NC(=O)NC[C@H](c2cccs2)N2CCCC2)cc1 ZINC000470025434 884244423 /nfs/dbraw/zinc/24/44/23/884244423.db2.gz WSFKTBTTZUWXEH-SJBKTWHCSA-N 0 3 413.587 4.413 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@@H]2NC(=O)N(CCN(C)C)Cc2ccccc2F)cc1 ZINC000470029880 884260570 /nfs/dbraw/zinc/26/05/70/884260570.db2.gz NUYUVSNHGFUKPT-GOTSBHOMSA-N 0 3 413.537 4.128 20 0 HIADHN Cc1ccc([C@H]2OCCC[C@H]2NC(=O)N(Cc2ccco2)C2CCN(C)CC2)cc1 ZINC000470043245 884285649 /nfs/dbraw/zinc/28/56/49/884285649.db2.gz HEYYJSRDZJKFMT-DHIUTWEWSA-N 0 3 411.546 4.114 20 0 HIADHN COc1ccc([C@@H](CNC(=O)NCCCSc2ccccc2)N2CCCC2)cc1 ZINC000503720034 912809241 /nfs/dbraw/zinc/80/92/41/912809241.db2.gz XNWFSABEXNEXEF-JOCHJYFZSA-N 0 3 413.587 4.314 20 0 HIADHN COCCN1CCC(NC(=O)N2CCCC[C@@H]2c2cccc(C(F)(F)F)c2)CC1 ZINC000470064481 884318323 /nfs/dbraw/zinc/31/83/23/884318323.db2.gz DWTSQMVCNWXJTA-LJQANCHMSA-N 0 3 413.484 4.053 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)C1(c2ccc(F)cc2)CCOCC1 ZINC000470164784 884440391 /nfs/dbraw/zinc/44/03/91/884440391.db2.gz AJTDCYQJLMTCNF-HSZRJFAPSA-N 0 3 412.549 4.147 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)c1ccccc1COC1CCOCC1 ZINC000470165863 884441318 /nfs/dbraw/zinc/44/13/18/884441318.db2.gz PLNIXZDJAYXPOX-VWLOTQADSA-N 0 3 424.585 4.269 20 0 HIADHN CCO[C@@H](CCNC(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1)C(C)C ZINC000470190517 884488358 /nfs/dbraw/zinc/48/83/58/884488358.db2.gz NCDVXPAOGJVVKE-AZUAARDMSA-N 0 3 400.485 4.008 20 0 HIADHN O=C(CN[C@@H]1CCCc2cc(Br)ccc21)N[C@H]1CCOc2ccccc21 ZINC000503852909 912841291 /nfs/dbraw/zinc/84/12/91/912841291.db2.gz BBGXUQPDYSJOHL-MOPGFXCFSA-N 0 3 415.331 4.056 20 0 HIADHN COc1ccc([C@@H](CNC(=O)Nc2cccc(OCCF)c2)N2CCCC2)cc1 ZINC000470286354 884655648 /nfs/dbraw/zinc/65/56/48/884655648.db2.gz WGTIZUBGFABQSC-OAQYLSRUSA-N 0 3 401.482 4.002 20 0 HIADHN CCCCNC(=O)[C@H]1CCCN(Cc2cc(Br)cc3cccnc32)C1 ZINC000470360209 884754946 /nfs/dbraw/zinc/75/49/46/884754946.db2.gz YXGIDGFHPGLCGC-INIZCTEOSA-N 0 3 404.352 4.126 20 0 HIADHN CC[C@H](NCC(=O)N[C@H]1CCOc2ccccc21)c1cccc(Br)c1 ZINC000503918625 912864208 /nfs/dbraw/zinc/86/42/08/912864208.db2.gz ALJQEBBXXZGCFN-ROUUACIJSA-N 0 3 403.320 4.130 20 0 HIADHN Cc1c([C@@H](C)N[C@@H]2CCCC23CCOCC3)nnn1-c1cccc(Br)c1 ZINC000503911535 912861761 /nfs/dbraw/zinc/86/17/61/912861761.db2.gz PHEQZXNJIFQNCZ-RDTXWAMCSA-N 0 3 419.367 4.338 20 0 HIADHN CCCN1CCC[C@H]1C(=O)N1CCC[C@@H](c2nc(-c3ccccc3OC)cs2)C1 ZINC000470417761 884821121 /nfs/dbraw/zinc/82/11/21/884821121.db2.gz HUAFZZHTZSJGLE-XLIONFOSSA-N 0 3 413.587 4.399 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](NCCc2ccccc2)c2ccc(F)c(F)c2)c1 ZINC000503934485 912871700 /nfs/dbraw/zinc/87/17/00/912871700.db2.gz MXLWYUOZJBXPFP-JOCHJYFZSA-N 0 3 401.478 4.290 20 0 HIADHN CCCCOc1cc(OC)ccc1C(=O)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000470525143 884919159 /nfs/dbraw/zinc/91/91/59/884919159.db2.gz DTDSHGYPEPABEW-UHFFFAOYSA-N 0 3 412.530 4.083 20 0 HIADHN C/C(=C/c1ccccc1C(F)(F)F)CN(C)[C@H](C)c1cccc(S(N)(=O)=O)c1 ZINC000503957123 912883584 /nfs/dbraw/zinc/88/35/84/912883584.db2.gz DXWXZZGHMPUEJY-QKXCFHHRSA-N 0 3 412.477 4.449 20 0 HIADHN CN(C)Cc1cccc(NC(=O)N2CCC(C(=O)c3cc(F)ccc3F)CC2)c1 ZINC000503957475 912883971 /nfs/dbraw/zinc/88/39/71/912883971.db2.gz IPKQMPPZJWANNM-UHFFFAOYSA-N 0 3 401.457 4.153 20 0 HIADHN CC(=O)CCc1ccc(OCCC(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000470658001 885081134 /nfs/dbraw/zinc/08/11/34/885081134.db2.gz PJPMDFIEOKGBEZ-XMMPIXPASA-N 0 3 422.569 4.100 20 0 HIADHN Cc1ccc(Nc2cccc(C(=O)N(C)[C@@H]3CCCN(Cc4ccccc4)C3)c2)nn1 ZINC000470659656 885084196 /nfs/dbraw/zinc/08/41/96/885084196.db2.gz XCSMODNDFKVXOJ-HSZRJFAPSA-N 0 3 415.541 4.265 20 0 HIADHN Cc1cc(Br)ccc1C(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470659835 885085122 /nfs/dbraw/zinc/08/51/22/885085122.db2.gz GPEOOQMVBDKVNM-LJQANCHMSA-N 0 3 401.348 4.494 20 0 HIADHN Cc1oc(-c2ccccc2)nc1CC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470663028 885087867 /nfs/dbraw/zinc/08/78/67/885087867.db2.gz VFAKOSIKFHIDNS-QFIPXVFZSA-N 0 3 403.526 4.316 20 0 HIADHN Cc1oc(-c2ccsc2)nc1CC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470662548 885088491 /nfs/dbraw/zinc/08/84/91/885088491.db2.gz SDXRESYTQOLTKD-FQEVSTJZSA-N 0 3 409.555 4.377 20 0 HIADHN Cc1cc(C)n(-c2ccc(C(=O)N(C)[C@H]3CCCN(Cc4ccccc4)C3)cc2F)n1 ZINC000470666634 885094833 /nfs/dbraw/zinc/09/48/33/885094833.db2.gz HJEBBMDDHJGOMJ-QFIPXVFZSA-N 0 3 420.532 4.365 20 0 HIADHN CN(C(=O)c1ccc(-c2ccccc2)[nH]c1=O)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470673554 885103272 /nfs/dbraw/zinc/10/32/72/885103272.db2.gz GKZQSCHIDVXLNZ-OAQYLSRUSA-N 0 3 401.510 4.191 20 0 HIADHN CN(C(=O)c1ccc(OCc2ccccn2)cc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470676656 885108940 /nfs/dbraw/zinc/10/89/40/885108940.db2.gz AGRXFBUGHLJWHJ-DEOSSOPVSA-N 0 3 415.537 4.397 20 0 HIADHN CC(C)c1c(C(=O)N[C@@H]2CCCN(C(C)C)C2)cnn1-c1ccc(C(F)(F)F)cn1 ZINC000470695402 885132940 /nfs/dbraw/zinc/13/29/40/885132940.db2.gz XCNYJZAHIXNJBR-MRXNPFEDSA-N 0 3 423.483 4.012 20 0 HIADHN CC(C)N1CCC[C@H](NC(=O)c2ccccc2CSc2nc3ccccc3[nH]2)C1 ZINC000470695827 885133343 /nfs/dbraw/zinc/13/33/43/885133343.db2.gz ZFOJWLPMCWXJIY-SFHVURJKSA-N 0 3 408.571 4.458 20 0 HIADHN CN(C(=O)N[C@@H]1CCOc2c(Cl)cccc21)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470718864 885160668 /nfs/dbraw/zinc/16/06/68/885160668.db2.gz YMAGIXWUGYUQHX-GHTZIAJQSA-N 0 3 413.949 4.470 20 0 HIADHN CN(C(=O)NCc1coc(-c2cccs2)n1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470722340 885168581 /nfs/dbraw/zinc/16/85/81/885168581.db2.gz IZUOQVCKJYNPGU-LJQANCHMSA-N 0 3 410.543 4.209 20 0 HIADHN Cc1csc(CCCCNC(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)n1 ZINC000470724919 885173154 /nfs/dbraw/zinc/17/31/54/885173154.db2.gz XDKSUJXFPIWZRF-HXUWFJFHSA-N 0 3 400.592 4.080 20 0 HIADHN CCCCOc1ncccc1CNC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470725521 885175431 /nfs/dbraw/zinc/17/54/31/885175431.db2.gz ZDJYMCSOVABKLE-QFIPXVFZSA-N 0 3 410.562 4.067 20 0 HIADHN CN(C(=O)NC[C@H](c1ccco1)N1CCCCC1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470737115 885193712 /nfs/dbraw/zinc/19/37/12/885193712.db2.gz MVDOOOHUFUEYOI-XZOQPEGZSA-N 0 3 424.589 4.113 20 0 HIADHN O=C(c1cn(-c2ccccc2)nc1-c1ccc(Cl)cc1)N1CCN2CCC1CC2 ZINC000470843646 885338706 /nfs/dbraw/zinc/33/87/06/885338706.db2.gz DGSHWUWSSGZJNW-UHFFFAOYSA-N 0 3 406.917 4.113 20 0 HIADHN COc1ccc([C@H](C)CCNC(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000470885548 885379789 /nfs/dbraw/zinc/37/97/89/885379789.db2.gz DDFUQVLAWUIMOX-OFNKIYASSA-N 0 3 409.574 4.495 20 0 HIADHN COc1cc(CNC(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)c2ccccc2n1 ZINC000470895061 885393308 /nfs/dbraw/zinc/39/33/08/885393308.db2.gz QRZMLRRBKQHDQG-NRFANRHFSA-N 0 3 418.541 4.049 20 0 HIADHN CO[C@H](CNC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1)c1ccc(Cl)cc1 ZINC000470894995 885393526 /nfs/dbraw/zinc/39/35/26/885393526.db2.gz PRCLRYZXNIQARG-FGZHOGPDSA-N 0 3 415.965 4.334 20 0 HIADHN C[C@H](NC(=O)NC[C@H](c1cccs1)N1CCCC1)c1ccccc1-n1cccn1 ZINC000470898326 885397912 /nfs/dbraw/zinc/39/79/12/885397912.db2.gz RJRYOVBIPZZROA-FXAWDEMLSA-N 0 3 409.559 4.131 20 0 HIADHN C[C@@H](NC(=O)NC[C@H](c1cccs1)N1CCCC1)c1ccccc1-n1cccn1 ZINC000470898329 885399313 /nfs/dbraw/zinc/39/93/13/885399313.db2.gz RJRYOVBIPZZROA-YLJYHZDGSA-N 0 3 409.559 4.131 20 0 HIADHN CN1CCN(CC(=O)N[C@H](c2ccc(F)cc2)C2CCCC2)C2(CCCCC2)C1 ZINC000471036651 885544916 /nfs/dbraw/zinc/54/49/16/885544916.db2.gz CXEYBYKMPJSNOB-QHCPKHFHSA-N 0 3 401.570 4.124 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCc3ccc4ncccc4c3)c(C)c2)CC1 ZINC000471128729 885667073 /nfs/dbraw/zinc/66/70/73/885667073.db2.gz GHJQDROREDRUPP-UHFFFAOYSA-N 0 3 403.530 4.007 20 0 HIADHN C[C@@H](NC(=O)c1ccccc1-c1nc(C(C)(C)C)no1)[C@@H](c1ccccc1)N(C)C ZINC000471131991 885671272 /nfs/dbraw/zinc/67/12/72/885671272.db2.gz CLLASDNABNKMQA-UZLBHIALSA-N 0 3 406.530 4.455 20 0 HIADHN CN(CCCCOc1ccccc1C(F)(F)F)[C@H]1CCCC[C@@H]1S(C)(=O)=O ZINC000471241251 885818589 /nfs/dbraw/zinc/81/85/89/885818589.db2.gz DTBALQVFPNAQOG-WMZOPIPTSA-N 0 3 407.498 4.152 20 0 HIADHN CC[C@@H](CNC(=O)Nc1cccc(NC(=O)N(C)C)c1C)N1CCc2ccccc2C1 ZINC000471354268 885972363 /nfs/dbraw/zinc/97/23/63/885972363.db2.gz HIVUSBCOCZTOIV-FQEVSTJZSA-N 0 3 423.561 4.047 20 0 HIADHN Cc1c(NC(=O)N(C)C)cccc1NC(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000471358724 885982816 /nfs/dbraw/zinc/98/28/16/885982816.db2.gz WAXLALWKJUNOSB-UHFFFAOYSA-N 0 3 423.561 4.217 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3ccc(F)c(CSC)c3)c(C)c2)CC1 ZINC000471386947 886033649 /nfs/dbraw/zinc/03/36/49/886033649.db2.gz YSRJRQDTEWBLAW-UHFFFAOYSA-N 0 3 401.551 4.391 20 0 HIADHN C[C@H](CCN1CCN(C)CC1)NC(=O)Nc1cc(-c2ccccc2)ccc1Cl ZINC000471396681 886046305 /nfs/dbraw/zinc/04/63/05/886046305.db2.gz QEBMKQNNYFIEDX-QGZVFWFLSA-N 0 3 400.954 4.155 20 0 HIADHN C[C@@H]1[C@H](NC(=O)N[C@H]2C[C@@H]2c2ccccc2OC(F)F)CCN1Cc1ccccc1 ZINC000504103817 913013041 /nfs/dbraw/zinc/01/30/41/913013041.db2.gz MTPOLWAODZDSOX-XLNTUCKNSA-N 0 3 415.484 4.106 20 0 HIADHN COc1cc(NC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)cc(-n2cccn2)c1 ZINC000471486213 886183728 /nfs/dbraw/zinc/18/37/28/886183728.db2.gz WXKVSYVIAWYMHN-IBGZPJMESA-N 0 3 419.529 4.009 20 0 HIADHN CCCCCn1nc(C(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)c2ccccc2c1=O ZINC000471528009 886230499 /nfs/dbraw/zinc/23/04/99/886230499.db2.gz DRCSDAUAPNBPIW-FDDCHVKYSA-N 0 3 420.557 4.008 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CC[C@@H](C(F)(F)F)[C@@H]1C)c1cccc(OC)c1 ZINC000471546001 886253166 /nfs/dbraw/zinc/25/31/66/886253166.db2.gz HSCIEVWZSMYKOS-BMGDILEWSA-N 0 3 401.473 4.060 20 0 HIADHN C[C@H](NC(=O)c1ccc(NC(=O)c2cccs2)cc1)[C@@H](c1ccccc1)N(C)C ZINC000471548389 886255563 /nfs/dbraw/zinc/25/55/63/886255563.db2.gz RIFAHZCOZXGPSF-KKSFZXQISA-N 0 3 407.539 4.422 20 0 HIADHN C[C@@H](NC(=O)c1ccc(NC(=O)c2cccs2)cc1)[C@@H](c1ccccc1)N(C)C ZINC000471548387 886256207 /nfs/dbraw/zinc/25/62/07/886256207.db2.gz RIFAHZCOZXGPSF-IERDGZPVSA-N 0 3 407.539 4.422 20 0 HIADHN C[C@@H](NC(=O)CSCc1coc(-c2ccccc2)n1)[C@H](c1ccccc1)N(C)C ZINC000471557108 886266668 /nfs/dbraw/zinc/26/66/68/886266668.db2.gz WIRYSNJNARCRSG-VGOFRKELSA-N 0 3 409.555 4.382 20 0 HIADHN Cc1ccc(I)c(C(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)c1 ZINC000471569383 886279376 /nfs/dbraw/zinc/27/93/76/886279376.db2.gz GUYQRTCBQVBZBR-RDTXWAMCSA-N 0 3 422.310 4.021 20 0 HIADHN C[C@@H](NC(=O)c1ccc(NC(=O)c2ccccc2)cc1)[C@H](c1ccccc1)N(C)C ZINC000471575170 886286269 /nfs/dbraw/zinc/28/62/69/886286269.db2.gz VYSZUIKHIKHRII-WZONZLPQSA-N 0 3 401.510 4.360 20 0 HIADHN COc1ccccc1[C@@H](CN[C@@H](C)c1ccc(S(C)(=O)=O)c(F)c1)OC(C)C ZINC000471582675 886295629 /nfs/dbraw/zinc/29/56/29/886295629.db2.gz PWBXRTSZMBZREU-MGPUTAFESA-N 0 3 409.523 4.055 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)c3occc3COc3ccccc3)c2)CC1 ZINC000471624166 886342685 /nfs/dbraw/zinc/34/26/85/886342685.db2.gz GAEPREYCDVQHIE-UHFFFAOYSA-N 0 3 405.498 4.253 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)COc3ccc(Cl)c4cccnc34)c2)CC1 ZINC000471642939 886359064 /nfs/dbraw/zinc/35/90/64/886359064.db2.gz FLGFLDSBTOWTTR-UHFFFAOYSA-N 0 3 424.932 4.048 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCC[C@@](C)(O)CC1)c1ccc(C(F)(F)F)cc1 ZINC000471721588 886433496 /nfs/dbraw/zinc/43/34/96/886433496.db2.gz WBKWOFINEYRPRT-UYAOXDASSA-N 0 3 415.500 4.035 20 0 HIADHN COC(=O)c1cc(NC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)c(C)cc1C ZINC000471840842 886601953 /nfs/dbraw/zinc/60/19/53/886601953.db2.gz VKYWDOQHEPWUPT-LJQANCHMSA-N 0 3 409.530 4.218 20 0 HIADHN C[C@H](NC(=O)N(CCN(C)C)Cc1ccccc1)c1ccc(OCC(F)(F)F)cc1 ZINC000504186052 913069616 /nfs/dbraw/zinc/06/96/16/913069616.db2.gz UYLCIFNKDGBMED-KRWDZBQOSA-N 0 3 423.479 4.462 20 0 HIADHN CCCc1cccc(C(C)C)c1NC(=O)N1CC[C@H](N2CCN(C)CC2)[C@H](C)C1 ZINC000471922369 886713036 /nfs/dbraw/zinc/71/30/36/886713036.db2.gz YJGFQKZVGALEGL-KNQAVFIVSA-N 0 3 400.611 4.252 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2nnc(Cc3cccc(F)c3)s2)N(C)C)cc1 ZINC000504189620 913073327 /nfs/dbraw/zinc/07/33/27/913073327.db2.gz KLZABQIXOBWQHU-SFHVURJKSA-N 0 3 413.522 4.001 20 0 HIADHN CN1CC[C@H](NC(=O)N[C@H](c2c(F)cccc2F)C(F)(F)F)[C@@H]1c1ccccc1 ZINC000471933001 886726468 /nfs/dbraw/zinc/72/64/68/886726468.db2.gz ZELONHLPCXFVKZ-RYQLBKOJSA-N 0 3 413.390 4.313 20 0 HIADHN CN1CC[C@H](NC(=O)N[C@@H](c2cccc(F)c2F)C(F)(F)F)[C@@H]1c1ccccc1 ZINC000471935212 886732498 /nfs/dbraw/zinc/73/24/98/886732498.db2.gz ZZQKKWVPWHZNSV-SZMVWBNQSA-N 0 3 413.390 4.313 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2cccc3c2CN(c2ccccn2)C3)[C@H]1c1ccccc1 ZINC000471939711 886738717 /nfs/dbraw/zinc/73/87/17/886738717.db2.gz LLVKDODHTBBJHE-LADGPHEKSA-N 0 3 413.525 4.169 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3cc(C(F)(F)F)ccc3F)CC2)C[C@H](C)O1 ZINC000471945510 886746860 /nfs/dbraw/zinc/74/68/60/886746860.db2.gz WXZLWVOHUVTYIU-GASCZTMLSA-N 0 3 416.459 4.196 20 0 HIADHN Cc1ccnc(-n2nccc2NC(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)c1 ZINC000471945084 886747160 /nfs/dbraw/zinc/74/71/60/886747160.db2.gz VIFOTTRKOWUPKT-GOSISDBHSA-N 0 3 424.574 4.232 20 0 HIADHN COC[C@H](C)Oc1ccc(Cl)cc1NC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000471965427 886793193 /nfs/dbraw/zinc/79/31/93/886793193.db2.gz DNYQGCPWLRFSIT-KLHJMIIUSA-N 0 3 417.937 4.321 20 0 HIADHN CSc1nc(C(C)(C)C)nc(C)c1C(=O)N[C@H]1C[C@@H](C)N(Cc2ccccc2)C1 ZINC000471968387 886800420 /nfs/dbraw/zinc/80/04/20/886800420.db2.gz OMQWOKZZOQACHK-QAPCUYQASA-N 0 3 412.603 4.197 20 0 HIADHN C[C@H](C(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1)c1ccc(Cl)c(Cl)c1 ZINC000471976291 886806715 /nfs/dbraw/zinc/80/67/15/886806715.db2.gz FBDJBWPBCWIZLI-XHSDSOJGSA-N 0 3 413.389 4.445 20 0 HIADHN Cc1cc(NC(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)ccc1OC1CCOCC1 ZINC000471994637 886821091 /nfs/dbraw/zinc/82/10/91/886821091.db2.gz CLUNKUOGZKMLDN-GMAHTHKFSA-N 0 3 409.530 4.120 20 0 HIADHN C[C@@H](CNC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1)Sc1ccccc1 ZINC000472013123 886835593 /nfs/dbraw/zinc/83/55/93/886835593.db2.gz PRZNQMAWTADFAG-OOHWJJMZSA-N 0 3 415.525 4.272 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2ccc(OCC3CCOCC3)cc2)[C@H]1c1ccccc1 ZINC000472017437 886840018 /nfs/dbraw/zinc/84/00/18/886840018.db2.gz PALNNNCUIULFDL-XZOQPEGZSA-N 0 3 409.530 4.059 20 0 HIADHN Cc1nn(C)c(OCC(F)(F)F)c1CN[C@@H]1C[C@H](OCc2ccccc2)C1(C)C ZINC000472041877 886859135 /nfs/dbraw/zinc/85/91/35/886859135.db2.gz OQHBYNJPPCCBIV-MSOLQXFVSA-N 0 3 411.468 4.143 20 0 HIADHN CSc1cc(C)ccc1CNC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472080907 886882305 /nfs/dbraw/zinc/88/23/05/886882305.db2.gz VCHFZJGLAPLHMK-UHFFFAOYSA-N 0 3 415.525 4.321 20 0 HIADHN Cc1cc(C)n(-c2ccccc2CNC(=O)c2oc3ccccc3c2CN(C)C)n1 ZINC000472215789 887017915 /nfs/dbraw/zinc/01/79/15/887017915.db2.gz FQIIOFRNAIGJSA-UHFFFAOYSA-N 0 3 402.498 4.227 20 0 HIADHN C[C@@H]1CCN(C(=O)NCCCCCC(=O)OC(C)(C)C)CCN1Cc1ccccc1 ZINC000504239426 913108715 /nfs/dbraw/zinc/10/87/15/913108715.db2.gz NCADOUGDLCSOHJ-HXUWFJFHSA-N 0 3 417.594 4.195 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)CCSCc3ccccc3)CC2)C[C@H](C)O1 ZINC000472260913 887071849 /nfs/dbraw/zinc/07/18/49/887071849.db2.gz RPWVMVAMLOTKME-PMACEKPBSA-N 0 3 404.620 4.048 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)c1ccc2nc(C(F)(F)F)cn2c1 ZINC000472294736 887116592 /nfs/dbraw/zinc/11/65/92/887116592.db2.gz ICJWBGFYTZALKH-INIZCTEOSA-N 0 3 416.447 4.090 20 0 HIADHN Cc1cc(N2CCSCC2)ccc1NC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000472311031 887139262 /nfs/dbraw/zinc/13/92/62/887139262.db2.gz BYDULLRNFUJBIA-FGZHOGPDSA-N 0 3 410.587 4.115 20 0 HIADHN COCCOc1ccc(C(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)c(Cl)c1 ZINC000472311569 887139796 /nfs/dbraw/zinc/13/97/96/887139796.db2.gz NBRQKBOYVUWLBB-IBGZPJMESA-N 0 3 416.949 4.102 20 0 HIADHN COc1ccc(NC(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)c(Br)c1 ZINC000472319761 887151879 /nfs/dbraw/zinc/15/18/79/887151879.db2.gz VLAYPEOLHZRTEE-ROUUACIJSA-N 0 3 404.308 4.025 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)c(C)c1 ZINC000472333485 887168441 /nfs/dbraw/zinc/16/84/41/887168441.db2.gz CRDDPRYUISZCLG-BULFRSBZSA-N 0 3 408.546 4.090 20 0 HIADHN CO[C@H]1CC[C@H](NC(=O)N(CCN2CCCC2)Cc2ccc(Cl)c(Cl)c2)C1 ZINC000472346499 887180800 /nfs/dbraw/zinc/18/08/00/887180800.db2.gz JFGFOHXDQRSSNJ-IRXDYDNUSA-N 0 3 414.377 4.168 20 0 HIADHN Cc1cc(-c2noc([C@H](C)NC(=O)c3oc4ccccc4c3CN(C)C)n2)ccc1F ZINC000472371806 887210265 /nfs/dbraw/zinc/21/02/65/887210265.db2.gz YFCLVNXZEOQKEW-AWEZNQCLSA-N 0 3 422.460 4.483 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)NCC1(c2cccc(Cl)c2)CCCC1 ZINC000504266240 913127277 /nfs/dbraw/zinc/12/72/77/913127277.db2.gz RZOGOZFQBMQGGQ-UHFFFAOYSA-N 0 3 414.981 4.320 20 0 HIADHN C[C@@H](c1ccc(F)cc1)N(C)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472449456 887302493 /nfs/dbraw/zinc/30/24/93/887302493.db2.gz QWGPDZMKDORXPL-TZYSRNFLSA-N 0 3 401.448 4.333 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N(CCC(F)(F)F)CC1CC1 ZINC000472457976 887314097 /nfs/dbraw/zinc/31/40/97/887314097.db2.gz WROCGWLVTVUWAT-UHFFFAOYSA-N 0 3 415.422 4.166 20 0 HIADHN Cc1ccc([C@H](NC(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)c2ccccn2)cc1 ZINC000472490757 887356556 /nfs/dbraw/zinc/35/65/56/887356556.db2.gz ZSZWQCUTMDPSRO-NOZRDPDXSA-N 0 3 414.553 4.395 20 0 HIADHN C[C@@H](NC(=O)N(CCN(C)C)Cc1ccccn1)C(c1ccccc1)c1ccccc1 ZINC000504284949 913140397 /nfs/dbraw/zinc/14/03/97/913140397.db2.gz WDCNNKCUUPDHNE-OAQYLSRUSA-N 0 3 416.569 4.375 20 0 HIADHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc2c(c1)nc(C)n2Cc1ccsc1 ZINC000472571193 887456780 /nfs/dbraw/zinc/45/67/80/887456780.db2.gz YGGGCVXONBYCNO-UXHICEINSA-N 0 3 408.571 4.153 20 0 HIADHN Cc1nn(C)c(=O)c(-c2nc(CN[C@H]3CCC[C@H]3Cc3ccccc3)cs2)c1C ZINC000472630054 887495092 /nfs/dbraw/zinc/49/50/92/887495092.db2.gz MOXPNMXOIPXSEH-ICSRJNTNSA-N 0 3 408.571 4.022 20 0 HIADHN C[C@H](CNC(=O)N[C@@H](c1cccc(Cl)c1)C1CCCCC1)CN1CCN(C)CC1 ZINC000472636293 887500749 /nfs/dbraw/zinc/50/07/49/887500749.db2.gz FFKXGHYORDEWQA-XMSQKQJNSA-N 0 3 421.029 4.144 20 0 HIADHN CCC(=O)Nc1ccc(C)c(NC(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000472718245 887565826 /nfs/dbraw/zinc/56/58/26/887565826.db2.gz VOZYSULUQSHPJX-OAQYLSRUSA-N 0 3 408.546 4.472 20 0 HIADHN C[C@H](CCN1CCN(C)CC1)NC(=O)N[C@@H](CC(C)(C)C)c1ccc(Cl)cc1 ZINC000472903560 887750396 /nfs/dbraw/zinc/75/03/96/887750396.db2.gz KRIQBXCYJBJYGM-XLIONFOSSA-N 0 3 409.018 4.143 20 0 HIADHN C[C@@H](CCN1CCN(C)CC1)NC(=O)N[C@H](CCCc1ccccc1)c1ccccc1 ZINC000472905119 887751889 /nfs/dbraw/zinc/75/18/89/887751889.db2.gz ARADNPZZXQUARP-WIOPSUGQSA-N 0 3 422.617 4.076 20 0 HIADHN CC[C@H](C)c1ccc([C@@H](NC(=O)N[C@@H](C)CCN2CCN(C)CC2)C(C)C)cc1 ZINC000472943786 887792802 /nfs/dbraw/zinc/79/28/02/887792802.db2.gz XMPHQFNNJJQFAR-JTAQYXEDSA-N 0 3 402.627 4.222 20 0 HIADHN OC1(Cc2cccc(F)c2)CCN(Cc2ccc(OCc3ccncc3)cc2)CC1 ZINC000473053618 887875079 /nfs/dbraw/zinc/87/50/79/887875079.db2.gz BFGGVLWQEZZJTG-UHFFFAOYSA-N 0 3 406.501 4.369 20 0 HIADHN C[C@@H]1CCc2c(sc3nc(CCN4CC[C@@]5(C4)OCc4ccccc45)nc(N)c23)C1 ZINC000473178118 887958101 /nfs/dbraw/zinc/95/81/01/887958101.db2.gz WAAIWHFJKKOZST-MYYSRTQBSA-N 0 3 420.582 4.072 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)C3(c4ccc(C(F)(F)F)cc4)CC3)CC2)C[C@@H](C)O1 ZINC000473185396 887964949 /nfs/dbraw/zinc/96/49/49/887964949.db2.gz XCKZSXILFZLWKT-IAGOWNOFSA-N 0 3 424.507 4.085 20 0 HIADHN O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)c1ccccc1C(=O)c1cccs1 ZINC000473307789 888055282 /nfs/dbraw/zinc/05/52/82/888055282.db2.gz DERAHQOFGLUPQD-IBGZPJMESA-N 0 3 404.535 4.231 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)NCCSCc1cccc2ccccc21 ZINC000504399176 913218565 /nfs/dbraw/zinc/21/85/65/913218565.db2.gz NTHZKWZXWJCTGU-UHFFFAOYSA-N 0 3 422.598 4.241 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1ccc2ccc(Cl)cc2n1 ZINC000473512665 888241937 /nfs/dbraw/zinc/24/19/37/888241937.db2.gz KWQCEAQYHOXKFO-UHFFFAOYSA-N 0 3 411.855 4.423 20 0 HIADHN CC(C)[C@@H]1CC[C@@H](C)C[C@H]1OCC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473513513 888244252 /nfs/dbraw/zinc/24/42/52/888244252.db2.gz NYQIIADATVUGKL-RTNLJHFFSA-N 0 3 418.544 4.385 20 0 HIADHN C[C@@H](CSc1ccccc1)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473518314 888250492 /nfs/dbraw/zinc/25/04/92/888250492.db2.gz CYLWLTSVCRCBPB-OOHWJJMZSA-N 0 3 400.510 4.336 20 0 HIADHN C[C@@H](SCc1ccccc1)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473519972 888253831 /nfs/dbraw/zinc/25/38/31/888253831.db2.gz CCCHWICZGKQZTK-RWBZWWBESA-N 0 3 400.510 4.230 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1ccc(F)cc1Br ZINC000473522317 888256419 /nfs/dbraw/zinc/25/64/19/888256419.db2.gz FJXNOSXNLCTFMN-UHFFFAOYSA-N 0 3 423.248 4.123 20 0 HIADHN O=C(CCSc1ccccc1F)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473522856 888258593 /nfs/dbraw/zinc/25/85/93/888258593.db2.gz LXXBSLIGIJGKJL-UHFFFAOYSA-N 0 3 404.473 4.229 20 0 HIADHN Cc1cccc2c(CCC(=O)NC3CC(N4CCC(C(F)(F)F)CC4)C3)c[nH]c21 ZINC000473522617 888259114 /nfs/dbraw/zinc/25/91/14/888259114.db2.gz LIBLPAOLHMNRSP-UHFFFAOYSA-N 0 3 407.480 4.330 20 0 HIADHN C[C@@H]1C[C@@H]1c1ccc([C@H]2C[C@H]2C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)o1 ZINC000473523923 888259915 /nfs/dbraw/zinc/25/99/15/888259915.db2.gz HJJYCHBYBFTXHI-CGKSGNGSSA-N 0 3 410.480 4.428 20 0 HIADHN Cc1sc(CC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)nc1C(C)C ZINC000473525522 888261779 /nfs/dbraw/zinc/26/17/79/888261779.db2.gz QDJQDNIXXVRWGZ-UHFFFAOYSA-N 0 3 403.514 4.039 20 0 HIADHN Cc1noc2nc(C(C)C)cc(C(=O)NC3CC(N4CCC(C(F)(F)F)CC4)C3)c12 ZINC000473525496 888262388 /nfs/dbraw/zinc/26/23/88/888262388.db2.gz PYRIABPSRYIDNM-UHFFFAOYSA-N 0 3 424.467 4.190 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1cccc(OCC(F)(F)F)c1 ZINC000473536431 888275153 /nfs/dbraw/zinc/27/51/53/888275153.db2.gz VWLHADABJQCRIL-UHFFFAOYSA-N 0 3 424.385 4.163 20 0 HIADHN COc1cccc(C(=O)c2ccc(C(=O)N3CCC[C@H]3CN3CCCCC3)cc2)c1 ZINC000473617800 888358225 /nfs/dbraw/zinc/35/82/25/888358225.db2.gz LUCUTZBDVJUOJX-QFIPXVFZSA-N 0 3 406.526 4.017 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)NCCc2cccc3[nH]ccc32)N(C)C)cc1 ZINC000504426549 913240361 /nfs/dbraw/zinc/24/03/61/913240361.db2.gz KIBPFZNSENRPMS-QHCPKHFHSA-N 0 3 408.546 4.100 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)C(C)(C)c3ccc(Cl)cc3F)CC2)C[C@H](C)O1 ZINC000473703750 888480251 /nfs/dbraw/zinc/48/02/51/888480251.db2.gz ZWUWFEGVOAKRLR-HOTGVXAUSA-N 0 3 410.961 4.105 20 0 HIADHN C[C@@H](CCN1CCN(C)CC1)NC(=O)Nc1cccc(CSC2CCCC2)c1 ZINC000473707450 888483850 /nfs/dbraw/zinc/48/38/50/888483850.db2.gz VTPPUSABLGDQPI-SFHVURJKSA-N 0 3 404.624 4.010 20 0 HIADHN COCCOc1ccc(C(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)c(Cl)c1 ZINC000473725777 888503203 /nfs/dbraw/zinc/50/32/03/888503203.db2.gz VWQVLTYUXZERBQ-JOCHJYFZSA-N 0 3 416.949 4.241 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)N2CCCC[C@@H]2c2nc(-c3cccc(F)c3)c[nH]2)CN1C1CC1 ZINC000473737043 888516697 /nfs/dbraw/zinc/51/66/97/888516697.db2.gz APDRLGISGMSSAD-FQELHTAISA-N 0 3 411.525 4.078 20 0 HIADHN CCN(C(=O)c1nn(-c2ccccc2)cc1C)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000473758589 888550601 /nfs/dbraw/zinc/55/06/01/888550601.db2.gz PYSHAAFHNBLDSI-NFBKMPQASA-N 0 3 402.542 4.478 20 0 HIADHN O=C(Nc1cnn(-c2ccccc2)c1C(F)(F)F)N1CCN(C2CCCCC2)CC1 ZINC000473782041 888587783 /nfs/dbraw/zinc/58/77/83/888587783.db2.gz AEZVCLBJEVRLND-UHFFFAOYSA-N 0 3 421.467 4.373 20 0 HIADHN CN(C)[C@@H](CNC(=O)Nc1cnn(-c2ccccc2)c1C(F)(F)F)c1ccccc1 ZINC000473784542 888592658 /nfs/dbraw/zinc/59/26/58/888592658.db2.gz VOWMOGUJARTMMJ-SFHVURJKSA-N 0 3 417.435 4.316 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CC[C@H](CSc4ccccc4)C3)c2)CC1 ZINC000473819900 888650060 /nfs/dbraw/zinc/65/00/60/888650060.db2.gz UCQGYFLGILILJT-FQEVSTJZSA-N 0 3 424.614 4.475 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CC[C@H](Cc4ccc(F)cc4)C3)c2)CC1 ZINC000473821882 888653644 /nfs/dbraw/zinc/65/36/44/888653644.db2.gz ZBNZKTFRKGMCIM-HXUWFJFHSA-N 0 3 410.537 4.064 20 0 HIADHN CCc1nc(C)c([C@@H](C)N(C)C(=O)Nc2cccc(N3CCN(CC)CC3)c2)s1 ZINC000473825353 888658726 /nfs/dbraw/zinc/65/87/26/888658726.db2.gz BHHBPJFWDXFKFT-QGZVFWFLSA-N 0 3 415.607 4.381 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CC=C(c4ccc(F)cc4)CC3)c2)CC1 ZINC000473827524 888660329 /nfs/dbraw/zinc/66/03/29/888660329.db2.gz IHHDFLWMIMKAKK-UHFFFAOYSA-N 0 3 408.521 4.289 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CCC(C)(c4ccccc4)CC3)c2)CC1 ZINC000473827685 888660440 /nfs/dbraw/zinc/66/04/40/888660440.db2.gz IIBFWVWVJKAMOI-UHFFFAOYSA-N 0 3 406.574 4.414 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@H](c3nccs3)c3ccccc3)c2)CC1 ZINC000473833631 888668741 /nfs/dbraw/zinc/66/87/41/888668741.db2.gz XZWGYDJZDCRJNP-NRFANRHFSA-N 0 3 421.570 4.196 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N(C)Cc3ccc(Cl)c(F)c3)c2)CC1 ZINC000473835082 888672168 /nfs/dbraw/zinc/67/21/68/888672168.db2.gz HHXKYURITGEKNC-UHFFFAOYSA-N 0 3 404.917 4.285 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CCC[C@@H]3c3ccc(OC)cc3)c2)CC1 ZINC000473835179 888672623 /nfs/dbraw/zinc/67/26/23/888672623.db2.gz IFZMLNGPLJGMTM-HSZRJFAPSA-N 0 3 408.546 4.206 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N[C@H](C)c1noc(-c2ccccc2)n1)c1ccsc1 ZINC000473873277 888734666 /nfs/dbraw/zinc/73/46/66/888734666.db2.gz CQKWMXMZOMALKP-QAPCUYQASA-N 0 3 413.547 4.241 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N2CCSC[C@@H]2c2nccs2)N2CCCC2)cc1 ZINC000473942059 888819450 /nfs/dbraw/zinc/81/94/50/888819450.db2.gz DKOSDSGXMJRNBI-RBUKOAKNSA-N 0 3 416.616 4.088 20 0 HIADHN Cc1[nH]nc2ncc(CN[C@H](Cc3ccccn3)c3ccc(Br)cc3)cc12 ZINC000474010199 888867394 /nfs/dbraw/zinc/86/73/94/888867394.db2.gz PIYOIKDICVDTLJ-HXUWFJFHSA-N 0 3 422.330 4.497 20 0 HIADHN CN1CCN(CCC(C)(C)NC(=O)N[C@H](c2cccc(Cl)c2)C2CCCC2)CC1 ZINC000474018467 888872558 /nfs/dbraw/zinc/87/25/58/888872558.db2.gz FJQNEPUXNGFJQA-NRFANRHFSA-N 0 3 421.029 4.287 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)N1CCSC[C@@H]1c1nccs1 ZINC000474020208 888872642 /nfs/dbraw/zinc/87/26/42/888872642.db2.gz XFAPBQOUAMRURJ-RBUKOAKNSA-N 0 3 418.632 4.099 20 0 HIADHN Cc1ccccc1NC(=O)C[C@H](C)N[C@@H]1CCN(c2ccc(Cl)cc2Cl)C1=O ZINC000474099224 888923221 /nfs/dbraw/zinc/92/32/21/888923221.db2.gz RPRWSEALSCERKY-KBXCAEBGSA-N 0 3 420.340 4.414 20 0 HIADHN CCN(C)C(=O)[C@H](C)N[C@H]1CCCc2nc(-c3ccccc3Br)sc21 ZINC000474101790 888924966 /nfs/dbraw/zinc/92/49/66/888924966.db2.gz ZVKUJFQQFPAGJB-WFASDCNBSA-N 0 3 422.392 4.406 20 0 HIADHN C[C@@H](NC(=O)c1ccc2c(c1)[nH]c(=O)n2C1CCCC1)[C@@H](c1ccccc1)N(C)C ZINC000474178129 889016946 /nfs/dbraw/zinc/01/69/46/889016946.db2.gz QIOUVTZDKCRIBR-ZHRRBRCNSA-N 0 3 406.530 4.278 20 0 HIADHN C[C@@H](Oc1ccc(C(F)(F)F)cc1)C(=O)NC1CCN([C@H](C)c2ccncc2)CC1 ZINC000474245821 889094362 /nfs/dbraw/zinc/09/43/62/889094362.db2.gz DENLWHHDQFGCCL-HZPDHXFCSA-N 0 3 421.463 4.210 20 0 HIADHN COc1ccc(SCCCC(=O)NC2CCN([C@@H](C)c3ccncc3)CC2)cc1 ZINC000474254494 889109006 /nfs/dbraw/zinc/10/90/06/889109006.db2.gz WJGCNQZHCZASLD-SFHVURJKSA-N 0 3 413.587 4.304 20 0 HIADHN CN1CC[C@@H](NC(=O)C2(c3cc(F)cc(C(F)(F)F)c3)CC2)[C@H]1c1ccccc1 ZINC000474258478 889115279 /nfs/dbraw/zinc/11/52/79/889115279.db2.gz LDBPVSMMNZPKDC-RTBURBONSA-N 0 3 406.423 4.438 20 0 HIADHN C[C@@H]1C[C@H](c2ccc(C(F)(F)F)cc2)N(Cc2cnc(-c3cnn(C)c3)nc2)C1 ZINC000474260216 889118709 /nfs/dbraw/zinc/11/87/09/889118709.db2.gz QYIXZODQIKGDOE-AUUYWEPGSA-N 0 3 401.436 4.479 20 0 HIADHN CN(CCCCCc1cc(-c2ccccc2)no1)Cc1cnc(-c2cnn(C)c2)nc1 ZINC000474281389 889147181 /nfs/dbraw/zinc/14/71/81/889147181.db2.gz UIWWHGMJOQHEGV-UHFFFAOYSA-N 0 3 416.529 4.377 20 0 HIADHN CN(C(=O)Nc1cc(C2CC2)nn1-c1ccccc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000474338235 889210392 /nfs/dbraw/zinc/21/03/92/889210392.db2.gz RLAQPCFFGFYEIX-JOCHJYFZSA-N 0 3 415.541 4.488 20 0 HIADHN CCOCc1ccccc1CNCc1ccc(Br)cc1N1CCOCC1 ZINC000474340751 889214785 /nfs/dbraw/zinc/21/47/85/889214785.db2.gz GFKIAOMUJCOREX-UHFFFAOYSA-N 0 3 419.363 4.112 20 0 HIADHN COc1ccc2nc(CNC[C@H](c3ccc(Cl)cc3)N3CCOCC3)sc2c1 ZINC000474347791 889224103 /nfs/dbraw/zinc/22/41/03/889224103.db2.gz LIMRTQKPCIVMBE-LJQANCHMSA-N 0 3 417.962 4.121 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N[C@H]3COc4ccc(Cl)cc43)c(C)c2)CC1 ZINC000474353698 889232539 /nfs/dbraw/zinc/23/25/39/889232539.db2.gz VFWSBXUJDJKYGM-FQEVSTJZSA-N 0 3 414.937 4.046 20 0 HIADHN Cc1cc(CN2CCSCC2)ccc1NCc1ccc(Cl)cc1-n1cncn1 ZINC000474377460 889253321 /nfs/dbraw/zinc/25/33/21/889253321.db2.gz RJIGCBURHBSGQD-UHFFFAOYSA-N 0 3 413.978 4.390 20 0 HIADHN Cc1ccccc1-n1nccc1CNCc1ccc(CN2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000474468280 889332579 /nfs/dbraw/zinc/33/25/79/889332579.db2.gz JZPXLVQBIFSGMD-OYRHEFFESA-N 0 3 404.558 4.080 20 0 HIADHN C[C@@H](CNC(=O)c1ccc(NC(=O)Nc2ccccc2)s1)N1CCC[C@@H](C)C1 ZINC000474514400 889379484 /nfs/dbraw/zinc/37/94/84/889379484.db2.gz PZUGZIUMXGZHCO-CVEARBPZSA-N 0 3 400.548 4.242 20 0 HIADHN O=C(N1CCC(OC2CCCC2)CC1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000504574194 913341033 /nfs/dbraw/zinc/34/10/33/913341033.db2.gz AOMIBTFFUBJFAN-JOCHJYFZSA-N 0 3 424.507 4.391 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)N[C@@H]1COc2ccc(Cl)cc21 ZINC000474596698 889465073 /nfs/dbraw/zinc/46/50/73/889465073.db2.gz SNRXERNKYMKCGL-LJQANCHMSA-N 0 3 417.962 4.187 20 0 HIADHN Cn1cc(-c2ncc(CN[C@H](c3ccc(Br)cc3)C3CCC3)cn2)cn1 ZINC000474599418 889466199 /nfs/dbraw/zinc/46/61/99/889466199.db2.gz LNXWZNJKAQSJLC-IBGZPJMESA-N 0 3 412.335 4.271 20 0 HIADHN O=C(Nc1ccc(C(=O)N2CCC[C@@H]2CN2CCCCC2)s1)Nc1ccccc1 ZINC000474611131 889475346 /nfs/dbraw/zinc/47/53/46/889475346.db2.gz AMZJJFGGAHVBRS-GOSISDBHSA-N 0 3 412.559 4.483 20 0 HIADHN CN(C(=O)Nc1c(F)cc(Br)cc1F)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000474620999 889486503 /nfs/dbraw/zinc/48/65/03/889486503.db2.gz VOLATQOONUEOMH-OAHLLOKOSA-N 0 3 424.289 4.466 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)c(Cl)c1 ZINC000474624648 889488123 /nfs/dbraw/zinc/48/81/23/889488123.db2.gz UCOUWPBOHZGHFF-SFHVURJKSA-N 0 3 400.910 4.037 20 0 HIADHN COc1ccc(NC(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)cc1Br ZINC000474627154 889489471 /nfs/dbraw/zinc/48/94/71/889489471.db2.gz NPSVQYIBUBGWLP-QGZVFWFLSA-N 0 3 418.335 4.196 20 0 HIADHN COc1ccc(S(=O)(=O)[N-]c2cccc(C[NH2+][C@H](C)C3CCSCC3)c2)cc1 ZINC000474730789 889586779 /nfs/dbraw/zinc/58/67/79/889586779.db2.gz QVRLUGFFLYXXQQ-MRXNPFEDSA-N 0 3 420.600 4.117 20 0 HIADHN CCCC(=O)Nc1cccc(NC(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)c1C ZINC000474732691 889588498 /nfs/dbraw/zinc/58/84/98/889588498.db2.gz CPIIVHOWVLEWSP-HXUWFJFHSA-N 0 3 408.546 4.472 20 0 HIADHN CN1CCN(CCC(C)(C)NC(=O)c2ccc(Oc3cccc(Cl)c3)cc2)CC1 ZINC000474805283 889659017 /nfs/dbraw/zinc/65/90/17/889659017.db2.gz BUZRPYBUVNZGEY-UHFFFAOYSA-N 0 3 415.965 4.278 20 0 HIADHN Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)NC1CCN(CCOC(C)C)CC1 ZINC000474870780 889724845 /nfs/dbraw/zinc/72/48/45/889724845.db2.gz CKSMTPZDEOVTTI-UHFFFAOYSA-N 0 3 421.994 4.391 20 0 HIADHN Cc1cc2occ(CC(=O)NC3CCN(CCOC(C)C)CC3)c2cc1C(C)C ZINC000474886999 889744328 /nfs/dbraw/zinc/74/43/28/889744328.db2.gz KKQBCEGDWJLHPE-UHFFFAOYSA-N 0 3 400.563 4.413 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)CCCOc2ccc(Cl)cc2Cl)CC1 ZINC000474890253 889747814 /nfs/dbraw/zinc/74/78/14/889747814.db2.gz ZBFAXIXYTWLVFI-UHFFFAOYSA-N 0 3 417.377 4.158 20 0 HIADHN CCN(C(=O)Nc1nnc(/C=C/c2ccco2)s1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475006926 889858686 /nfs/dbraw/zinc/85/86/86/889858686.db2.gz BKACMQYPDLNPSI-DOJUMQAQSA-N 0 3 423.542 4.430 20 0 HIADHN CCN(Cc1ccccc1NC(=O)N(CC)[C@H]1CCN(Cc2ccccc2)C1)C(C)=O ZINC000475007078 889860603 /nfs/dbraw/zinc/86/06/03/889860603.db2.gz GZDVQSFTJKVREZ-QHCPKHFHSA-N 0 3 422.573 4.183 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)C/C=C/c2ccc(F)cc2)cc1)[C@H]1CCCN(C)C1 ZINC000475008237 889860797 /nfs/dbraw/zinc/86/07/97/889860797.db2.gz KQSJMBARSTUODJ-YXMLYAQVSA-N 0 3 409.505 4.034 20 0 HIADHN CCN(C(=O)Nc1ccc(C(=O)NC(C)C)c(C)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475011637 889865363 /nfs/dbraw/zinc/86/53/63/889865363.db2.gz ZDQCBNGYOLHUBO-QFIPXVFZSA-N 0 3 422.573 4.262 20 0 HIADHN CN(C(=O)Nc1ccccc1OCC(F)F)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000475026085 889878159 /nfs/dbraw/zinc/87/81/59/889878159.db2.gz WHBTZXMXEGHJBL-GOSISDBHSA-N 0 3 403.473 4.459 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1ccccc1OCC(F)F ZINC000475041726 889893598 /nfs/dbraw/zinc/89/35/98/889893598.db2.gz GKKFRVQAMMWJFG-QGZVFWFLSA-N 0 3 403.473 4.459 20 0 HIADHN CCN1CCC[C@@H](CN(C)Cc2c(F)cccc2Br)[C@@H]1c1cnn(C)c1 ZINC000475043066 889895112 /nfs/dbraw/zinc/89/51/12/889895112.db2.gz SUUFVXKELXMGIV-MGPUTAFESA-N 0 3 423.374 4.227 20 0 HIADHN CN(Cc1cc(Cl)cc(C(F)(F)F)c1)C[C@@H]1C[C@H](F)CN1Cc1ccnn1C ZINC000475090360 889937417 /nfs/dbraw/zinc/93/74/17/889937417.db2.gz PSNPSGUIXIVSCP-WMZOPIPTSA-N 0 3 418.866 4.137 20 0 HIADHN CCOc1cccc(CNc2cccc(N3CCN(CC)CC3)c2)c1OC(F)F ZINC000475089782 889938018 /nfs/dbraw/zinc/93/80/18/889938018.db2.gz OQQNZLIJWOKSEM-UHFFFAOYSA-N 0 3 405.489 4.441 20 0 HIADHN CN(C(=O)NCCCCCOC1CCCCC1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475098000 889943922 /nfs/dbraw/zinc/94/39/22/889943922.db2.gz AOWUAASWVQCHAM-QFIPXVFZSA-N 0 3 401.595 4.422 20 0 HIADHN CN(Cc1ccc(OC(F)F)c(Cl)c1)C[C@@H]1C[C@H](F)CN1Cc1nccs1 ZINC000475100184 889947372 /nfs/dbraw/zinc/94/73/72/889947372.db2.gz YQCZPIQJEZUYLH-KBPBESRZSA-N 0 3 419.900 4.442 20 0 HIADHN CN(C(=O)NCc1cccc(OCC(F)(F)F)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475132407 889996698 /nfs/dbraw/zinc/99/66/98/889996698.db2.gz AYKPHYNVNNSOHE-LJQANCHMSA-N 0 3 421.463 4.044 20 0 HIADHN C[C@@H](NC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(NC(=O)C2CC2)cc1 ZINC000475137531 890004505 /nfs/dbraw/zinc/00/45/05/890004505.db2.gz KIORNQLTIPIEAR-WZONZLPQSA-N 0 3 420.557 4.012 20 0 HIADHN C[C@@H](NC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1)c1cccc(OC(F)F)c1 ZINC000475144162 890012819 /nfs/dbraw/zinc/01/28/19/890012819.db2.gz SLNBZBUIFOMMCY-VQIMIIECSA-N 0 3 403.473 4.265 20 0 HIADHN CCCCCn1cc(CNC(=O)N(CC)[C@H]2CCN(Cc3ccccc3)C2)c(C)n1 ZINC000475162835 890027532 /nfs/dbraw/zinc/02/75/32/890027532.db2.gz LDJQPDNUIDVRAU-QHCPKHFHSA-N 0 3 411.594 4.188 20 0 HIADHN CCN(C(=O)NCCCCc1nc(C)cs1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475172509 890037631 /nfs/dbraw/zinc/03/76/31/890037631.db2.gz HIIGGNCVMOGLQR-FQEVSTJZSA-N 0 3 400.592 4.080 20 0 HIADHN CCN(C(=O)NCc1csc(-c2ccco2)n1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475174221 890041730 /nfs/dbraw/zinc/04/17/30/890041730.db2.gz UYQHDRPPLYDRKX-IBGZPJMESA-N 0 3 410.543 4.209 20 0 HIADHN CC1CCN([C@@H](CNC(=O)Nc2ccc(-c3ncn(C)n3)cc2)c2ccccc2)CC1 ZINC000475188141 890058156 /nfs/dbraw/zinc/05/81/56/890058156.db2.gz YDTDPOLMMQSJDY-QFIPXVFZSA-N 0 3 418.545 4.077 20 0 HIADHN Cc1nc(COc2ccc(CN3CCC[C@H](OCc4ccccc4F)C3)cc2)no1 ZINC000475288726 890187710 /nfs/dbraw/zinc/18/77/10/890187710.db2.gz UHXYMHHFUHTQDS-NRFANRHFSA-N 0 3 411.477 4.277 20 0 HIADHN Cc1ccccc1-n1nc(C(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)c2c1CCC2 ZINC000475297450 890203541 /nfs/dbraw/zinc/20/35/41/890203541.db2.gz NPQNQRAYRGSSAP-NRFANRHFSA-N 0 3 414.553 4.016 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)[C@H](C)c3cn(C)c4ccccc34)c(C)c2)CC1 ZINC000475302386 890210636 /nfs/dbraw/zinc/21/06/36/890210636.db2.gz LVQRZCIVMNFDRZ-LJQANCHMSA-N 0 3 404.558 4.371 20 0 HIADHN CN(C(=O)[C@@H]1C[C@H]1c1ccccc1OC(F)(F)F)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475306831 890218299 /nfs/dbraw/zinc/21/82/99/890218299.db2.gz VDHPWTKJQLUWCE-YSIASYRMSA-N 0 3 418.459 4.422 20 0 HIADHN Cc1c(C(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)cnn1-c1ccc(Cl)cc1 ZINC000475322077 890241947 /nfs/dbraw/zinc/24/19/47/890241947.db2.gz ZHBJOXLZUUFVFB-OAQYLSRUSA-N 0 3 408.933 4.181 20 0 HIADHN Cc1ccc([C@H](N[C@H](C)CCCOc2ccccc2C(N)=O)c2ccccn2)cc1 ZINC000475332501 890253080 /nfs/dbraw/zinc/25/30/80/890253080.db2.gz HKPMKPZYUBYXMZ-DVECYGJZSA-N 0 3 403.526 4.416 20 0 HIADHN C[C@H](C(=O)NCCCCN1CCN(c2ccccc2)CC1)c1cn(C)c2ccccc12 ZINC000475340526 890261465 /nfs/dbraw/zinc/26/14/65/890261465.db2.gz WISGQAYFVGVCAS-NRFANRHFSA-N 0 3 418.585 4.000 20 0 HIADHN CN(c1ccccc1)c1ccc(C(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)cn1 ZINC000475425862 890346382 /nfs/dbraw/zinc/34/63/82/890346382.db2.gz XQUNVALFOOFEMO-QHCPKHFHSA-N 0 3 400.526 4.196 20 0 HIADHN COc1cccc(COc2cccc(Cl)c2CNC[C@@H]2CCCN(C(C)=O)C2)c1 ZINC000475437630 890357310 /nfs/dbraw/zinc/35/73/10/890357310.db2.gz CHBDMWIVZRSZCC-IBGZPJMESA-N 0 3 416.949 4.276 20 0 HIADHN CN(C(=O)c1[nH]c2ccccc2c1Br)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475543804 890469006 /nfs/dbraw/zinc/46/90/06/890469006.db2.gz RJLPNRCBCKXEMH-MRXNPFEDSA-N 0 3 412.331 4.277 20 0 HIADHN COc1ccc(CN(CCc2ccccn2)Cc2cn(C)nc2-c2ccncc2)cc1 ZINC000475576280 890506468 /nfs/dbraw/zinc/50/64/68/890506468.db2.gz VSKVOIYZYCKTRU-UHFFFAOYSA-N 0 3 413.525 4.131 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)Nc2ccc(OCc3ccccc3)cc2)CC1 ZINC000475606097 890532329 /nfs/dbraw/zinc/53/23/29/890532329.db2.gz SHWZYQPHXTUGSW-UHFFFAOYSA-N 0 3 411.546 4.277 20 0 HIADHN COc1ccccc1-c1cccc(NC(=O)NC2CCN(CCOC(C)C)CC2)c1 ZINC000475613102 890541089 /nfs/dbraw/zinc/54/10/89/890541089.db2.gz RDAJZGSJTXCNSC-UHFFFAOYSA-N 0 3 411.546 4.373 20 0 HIADHN Cc1nc(CN(C)[C@@H]2CCCN(Cc3ccc(-c4ccncc4)cc3F)CC2)no1 ZINC000475631980 890572208 /nfs/dbraw/zinc/57/22/08/890572208.db2.gz CJEFAQPEWWEOCF-OAQYLSRUSA-N 0 3 409.509 4.066 20 0 HIADHN C[C@H](CC(=O)N(C)c1ccccc1)N[C@H](CO)c1ccc(Cl)cc1C(F)(F)F ZINC000475636323 890577607 /nfs/dbraw/zinc/57/76/07/890577607.db2.gz UXIKPKIXFGTDRS-FZKQIMNGSA-N 0 3 414.855 4.423 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)Nc2ccccc2N2CCCCCC2)CC1 ZINC000475652787 890597573 /nfs/dbraw/zinc/59/75/73/890597573.db2.gz GQDPAKQESOWYAH-UHFFFAOYSA-N 0 3 402.583 4.078 20 0 HIADHN Cc1ccc(-n2cccn2)cc1NC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C ZINC000475656493 890601096 /nfs/dbraw/zinc/60/10/96/890601096.db2.gz PULNMKSJRSOVKG-FQEVSTJZSA-N 0 3 403.530 4.309 20 0 HIADHN COc1ccc(-c2nc(CN3CCC[C@]3(CO)Cc3ccccc3)cs2)c(OC)c1 ZINC000475656801 890602724 /nfs/dbraw/zinc/60/27/24/890602724.db2.gz QCJFJXYZUIZWOJ-XMMPIXPASA-N 0 3 424.566 4.397 20 0 HIADHN CCc1nnc(-c2ccc(NC(=O)N3CCCN(Cc4ccccc4)C[C@@H]3C)cc2)o1 ZINC000475672246 890615351 /nfs/dbraw/zinc/61/53/51/890615351.db2.gz COVOPYCYSYEJOX-SFHVURJKSA-N 0 3 419.529 4.427 20 0 HIADHN CCc1nnc(-c2ccc(NC(=O)NC[C@@H](c3ccccc3)N3CCCC3)cc2)o1 ZINC000475720158 890658350 /nfs/dbraw/zinc/65/83/50/890658350.db2.gz XGRUQCOHPMEHHH-FQEVSTJZSA-N 0 3 405.502 4.258 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)CCN(C)[C@H](C)c1ccc([S@](C)=O)cc1 ZINC000475743714 890686374 /nfs/dbraw/zinc/68/63/74/890686374.db2.gz KJZCXSHWKZPXGH-ASHKIFAZSA-N 0 3 408.951 4.108 20 0 HIADHN COC1CCN(C(C)(C)CNC(=O)c2ccc3nc(-c4ccccc4)oc3c2)CC1 ZINC000475761113 890708987 /nfs/dbraw/zinc/70/89/87/890708987.db2.gz VDDBMVKHWBFZPL-UHFFFAOYSA-N 0 3 407.514 4.114 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N3CCCC[C@H]3c3nc4ccccc4o3)cc2)CC1 ZINC000475802979 890738477 /nfs/dbraw/zinc/73/84/77/890738477.db2.gz HNKPVGNBQLYOBE-QFIPXVFZSA-N 0 3 418.541 4.337 20 0 HIADHN COc1cc(NC(=O)NCC(C)(C)N2CCc3ccccc3C2)c(OC)cc1Cl ZINC000504744684 913484014 /nfs/dbraw/zinc/48/40/14/913484014.db2.gz DBVNAZFFBQKUIY-UHFFFAOYSA-N 0 3 417.937 4.316 20 0 HIADHN Cc1cc(NC(=O)c2oc(CC3CC3)nc2C)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000475902974 890832615 /nfs/dbraw/zinc/83/26/15/890832615.db2.gz DGRNWASTCQMBOA-FQEVSTJZSA-N 0 3 419.529 4.140 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1oc(CC2CC2)nc1C ZINC000475909645 890837781 /nfs/dbraw/zinc/83/77/81/890837781.db2.gz FFOLTZGGWGFORR-FQEVSTJZSA-N 0 3 419.529 4.140 20 0 HIADHN CN(C)CCN(C[C@H]1CCCO1)C(=O)Nc1ccccc1-c1cc(F)c(F)c(F)c1 ZINC000475975131 890891916 /nfs/dbraw/zinc/89/19/16/890891916.db2.gz UPSAWZSYMHIJNJ-MRXNPFEDSA-N 0 3 421.463 4.345 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N[C@@H](CC(C)(C)C)c2ccc(F)cc2)CC1 ZINC000476036717 890967004 /nfs/dbraw/zinc/96/70/04/890967004.db2.gz UXSFYKHFXFOBOT-NRFANRHFSA-N 0 3 407.574 4.492 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N[C@@H](c2ccc(Cl)cc2)C2CCC2)CC1 ZINC000476043917 890974457 /nfs/dbraw/zinc/97/44/57/890974457.db2.gz WIMUEATUSSBRGC-OAQYLSRUSA-N 0 3 407.986 4.370 20 0 HIADHN Cn1cc(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)c(-c2ccc(Cl)s2)n1 ZINC000476062518 890990770 /nfs/dbraw/zinc/99/07/70/890990770.db2.gz ONGLJADBMZXHBW-MRXNPFEDSA-N 0 3 414.962 4.196 20 0 HIADHN COc1cccc(C2=CCN(C(=O)[C@@H]3CCCN(Cc4cccc(F)c4)C3)CC2)c1 ZINC000476157499 891081704 /nfs/dbraw/zinc/08/17/04/891081704.db2.gz PJIAXPUAYDEMGQ-JOCHJYFZSA-N 0 3 408.517 4.362 20 0 HIADHN COc1ccc(Br)c(NC(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)c1 ZINC000476232136 891155768 /nfs/dbraw/zinc/15/57/68/891155768.db2.gz XJHFVYNPBOJKTF-FZKQIMNGSA-N 0 3 406.324 4.271 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)c1cc(F)c(Br)cc1Cl ZINC000476273283 891194104 /nfs/dbraw/zinc/19/41/04/891194104.db2.gz MGZVNODOLGCLTR-UHFFFAOYSA-N 0 3 403.679 4.039 20 0 HIADHN CCc1onc(-c2ccc(Br)cc2)c1C(=O)N[C@@H]1C[C@H](C)N(C2CC2)C1 ZINC000476297297 891210613 /nfs/dbraw/zinc/21/06/13/891210613.db2.gz DGBAFUDDMNTCHR-SWLSCSKDSA-N 0 3 418.335 4.022 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2cccc3c2CN(CC(F)(F)F)C3)N(C)C)cc1 ZINC000476338958 891244605 /nfs/dbraw/zinc/24/46/05/891244605.db2.gz FSUMCNOWSGNHSO-FQEVSTJZSA-N 0 3 420.479 4.297 20 0 HIADHN O=C(NCCCCCOC1CCCCC1)NCC1(N2CCSCC2)CCCC1 ZINC000476355353 891259083 /nfs/dbraw/zinc/25/90/83/891259083.db2.gz RRGFRFZMZFDAQQ-UHFFFAOYSA-N 0 3 411.656 4.167 20 0 HIADHN CCOc1ccc([C@H](NC(=O)N(C)[C@@H]2CCN(C3CC3)C2)C(C)C)cc1OCC ZINC000476372704 891284687 /nfs/dbraw/zinc/28/46/87/891284687.db2.gz BGJCYZLYEZKGRB-DENIHFKCSA-N 0 3 403.567 4.059 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N(Cc2ccccc2)C2CCCCC2)CC1 ZINC000476441946 891355109 /nfs/dbraw/zinc/35/51/09/891355109.db2.gz HFKQDCXBDQETKJ-UHFFFAOYSA-N 0 3 401.595 4.420 20 0 HIADHN CCCSc1nsc(NC(=O)Nc2ccc(N3CCN(CC)CC3)cc2C)n1 ZINC000476516129 891429392 /nfs/dbraw/zinc/42/93/92/891429392.db2.gz YWFGNOPPOJUXSF-UHFFFAOYSA-N 0 3 420.608 4.135 20 0 HIADHN C[C@@H]1CC[C@H](C)N1CC(=O)N[C@@H](Cc1ccccn1)c1ccc(Br)cc1 ZINC000476538121 891452645 /nfs/dbraw/zinc/45/26/45/891452645.db2.gz GVHARADHTATJPK-YRNRMSPPSA-N 0 3 416.363 4.117 20 0 HIADHN CCN1CC[C@@H](N(C)C(=O)c2cn(C3CC3)c3cc(Cl)c(F)cc3c2=O)C[C@H]1C ZINC000476546376 891462063 /nfs/dbraw/zinc/46/20/63/891462063.db2.gz NZRZOUWNNLMHTG-UKRRQHHQSA-N 0 3 419.928 4.074 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1c(SC)cnn1-c1ccccc1)c1ccco1 ZINC000476558650 891476706 /nfs/dbraw/zinc/47/67/06/891476706.db2.gz BDSWVZUAWLQKHN-RDJZCZTQSA-N 0 3 413.547 4.438 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)Nc1c(SC)cnn1-c1ccccc1)c1ccco1 ZINC000476558652 891476836 /nfs/dbraw/zinc/47/68/36/891476836.db2.gz BDSWVZUAWLQKHN-WBVHZDCISA-N 0 3 413.547 4.438 20 0 HIADHN C[C@H](c1ccc(F)c(F)c1)N(C)C(=O)CN1CC[C@H](COCc2ccccc2)C1 ZINC000476586948 891515646 /nfs/dbraw/zinc/51/56/46/891515646.db2.gz GHVVWZRVMORVEL-MJGOQNOKSA-N 0 3 402.485 4.023 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)Nc2cccc(OCCF)c2)N(C)C)cc1 ZINC000476634650 891573508 /nfs/dbraw/zinc/57/35/08/891573508.db2.gz XRHVDSIIHBZCDN-OAQYLSRUSA-N 0 3 403.498 4.247 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N[C@H]1CCCc2ccc(C(C)C)cc21 ZINC000476666219 891613265 /nfs/dbraw/zinc/61/32/65/891613265.db2.gz CRWPZFMUJFRFOQ-QFIPXVFZSA-N 0 3 407.558 4.312 20 0 HIADHN CN(C(=O)NC[C@H]1CC2c3ccccc3C1c1ccccc12)[C@H]1CCN(C2CC2)C1 ZINC000476680299 891631151 /nfs/dbraw/zinc/63/11/51/891631151.db2.gz ADBYCCNQJPLWPR-NJAGTKQXSA-N 0 3 401.554 4.162 20 0 HIADHN Cc1nc2c(s1)[C@H](N(C)C(=O)NC[C@H](c1cccs1)N1CCCC1)CCC2 ZINC000476687513 891638695 /nfs/dbraw/zinc/63/86/95/891638695.db2.gz VOVOIOSLGMLEIS-IAGOWNOFSA-N 0 3 404.605 4.369 20 0 HIADHN Cc1sc(CNC(=O)N(C)[C@H]2CCN(C3CC3)C2)nc1-c1ccc(Cl)cc1 ZINC000476708430 891668835 /nfs/dbraw/zinc/66/88/35/891668835.db2.gz HEGHYUUDKMZFII-KRWDZBQOSA-N 0 3 404.967 4.150 20 0 HIADHN CC(=O)Nc1ccc(C)c(NC(=O)NC[C@@H](C(C)C)N2CCc3ccccc3C2)c1 ZINC000504870504 913599456 /nfs/dbraw/zinc/59/94/56/913599456.db2.gz SEYRJUZRNXQLRE-QHCPKHFHSA-N 0 3 408.546 4.158 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CNC(=O)N[C@H](C)[C@@H](c1ccccc1)N(C)C ZINC000476950971 891887703 /nfs/dbraw/zinc/88/77/03/891887703.db2.gz IVQDCMSEDMEKCI-DVECYGJZSA-N 0 3 419.573 4.039 20 0 HIADHN C[C@@H](CNC(=O)Nc1cccc2c1CN(CC(F)(F)F)C2)N(C)Cc1ccccc1 ZINC000504882179 913612206 /nfs/dbraw/zinc/61/22/06/913612206.db2.gz MMKQUVPXKZKTGS-INIZCTEOSA-N 0 3 420.479 4.207 20 0 HIADHN C[C@H](CNC(=O)Nc1cccc2c1CN(CC(F)(F)F)C2)N(C)Cc1ccccc1 ZINC000504882180 913612392 /nfs/dbraw/zinc/61/23/92/913612392.db2.gz MMKQUVPXKZKTGS-MRXNPFEDSA-N 0 3 420.479 4.207 20 0 HIADHN O=C(CN1CCC[C@]2(CCCOC2)C1)N1Cc2ccccc2[C@@H](c2ccccc2)C1 ZINC000477049640 891978683 /nfs/dbraw/zinc/97/86/83/891978683.db2.gz OUUALPNTMNGWEX-RSXGOPAZSA-N 0 3 404.554 4.053 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)c1ccn(C2CCCC2)n1 ZINC000477064466 891996796 /nfs/dbraw/zinc/99/67/96/891996796.db2.gz HDYBMNYCHNMAHI-UHFFFAOYSA-N 0 3 408.468 4.221 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)c1ccn(C2CCCC2)n1 ZINC000477064721 891997717 /nfs/dbraw/zinc/99/77/17/891997717.db2.gz BQKOKAMFVDFDKK-UHFFFAOYSA-N 0 3 408.468 4.221 20 0 HIADHN COCCN1CCC[C@H]1CNC(=O)N(Cc1ccccc1)[C@H](C)c1cccs1 ZINC000477106115 892036977 /nfs/dbraw/zinc/03/69/77/892036977.db2.gz HRCYUMCUOPCKAE-QUCCMNQESA-N 0 3 401.576 4.132 20 0 HIADHN COCc1nnc(NC[C@H]2CCCN(C)[C@H]2c2ccc(C(F)(F)F)cc2)s1 ZINC000477117982 892048442 /nfs/dbraw/zinc/04/84/42/892048442.db2.gz GETCOYLQQXJBMK-CJNGLKHVSA-N 0 3 400.470 4.198 20 0 HIADHN O=C(Nc1ccc(NC(=O)c2ccco2)cc1)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000504897161 913627951 /nfs/dbraw/zinc/62/79/51/913627951.db2.gz XECSIMCWDHBHRC-OAQYLSRUSA-N 0 3 418.497 4.318 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)cc1OC ZINC000504895722 913628397 /nfs/dbraw/zinc/62/83/97/913628397.db2.gz QBQIBHYKMKMLRO-YADHBBJMSA-N 0 3 423.557 4.215 20 0 HIADHN O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)N1CCC(OCc2ccccc2)CC1 ZINC000504903498 913636672 /nfs/dbraw/zinc/63/66/72/913636672.db2.gz QYVVAFMEDZUDBG-HSZRJFAPSA-N 0 3 407.558 4.042 20 0 HIADHN CCN1CCN([C@@H]2CCN([C@@H](C)c3nc(C)c(-c4ccc(Cl)cc4)o3)C2)CC1 ZINC000477287475 892243847 /nfs/dbraw/zinc/24/38/47/892243847.db2.gz PRSCLSZNDFSRAV-FXAWDEMLSA-N 0 3 402.970 4.076 20 0 HIADHN CC[C@H](C)n1nc(C(=O)NC2CCN(CCOc3ccc(Cl)cc3)CC2)cc1C ZINC000477448216 892400735 /nfs/dbraw/zinc/40/07/35/892400735.db2.gz WQDUMCDFNLOBBI-INIZCTEOSA-N 0 3 418.969 4.089 20 0 HIADHN CCN(C(=O)c1cn(CC(F)(F)F)nc1C)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000477469576 892447036 /nfs/dbraw/zinc/44/70/36/892447036.db2.gz IAYFOLXDNWSABL-FUHWJXTLSA-N 0 3 408.468 4.051 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)[C@H](C)c2cn(C)c3ccccc23)cc1 ZINC000477621847 892726698 /nfs/dbraw/zinc/72/66/98/892726698.db2.gz NHOPOTHSAZRYOT-JPYJTQIMSA-N 0 3 405.542 4.244 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)[C@@H](C)c2cn(C)c3ccccc23)cc1 ZINC000477621848 892727385 /nfs/dbraw/zinc/72/73/85/892727385.db2.gz NHOPOTHSAZRYOT-MBSDFSHPSA-N 0 3 405.542 4.244 20 0 HIADHN CN1CCN(CCCNc2nc(C3CC3)nc3scc(-c4ccccc4)c32)CC1 ZINC000477661771 892800172 /nfs/dbraw/zinc/80/01/72/892800172.db2.gz DVBKFWHVSMVUMY-UHFFFAOYSA-N 0 3 407.587 4.285 20 0 HIADHN Cc1ccc(Br)c(C(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)c1 ZINC000477732861 892832050 /nfs/dbraw/zinc/83/20/50/892832050.db2.gz ZCDSVBANBXTDFP-CALCHBBNSA-N 0 3 423.395 4.109 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N2CCC[C@H]2c2ccc3c(c2)OCO3)C1 ZINC000477746114 892840516 /nfs/dbraw/zinc/84/05/16/892840516.db2.gz FMAJCEVQVRIBTH-UIFIKXQLSA-N 0 3 407.514 4.097 20 0 HIADHN CC(C)[C@H]1CC[C@@H](C)C[C@H]1OCC(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000477749511 892842379 /nfs/dbraw/zinc/84/23/79/892842379.db2.gz ZPGYQMNOGGDKQE-CTUHWIOQSA-N 0 3 416.606 4.307 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)[C@H]1C[C@H]1c1c(F)cccc1Cl ZINC000477758143 892849014 /nfs/dbraw/zinc/84/90/14/892849014.db2.gz ZHPLDOWUJQHTEM-MOPGFXCFSA-N 0 3 416.924 4.426 20 0 HIADHN C[C@H](N[C@H]1CCCc2nc(-c3ccccc3Br)sc21)C(=O)N(C)C ZINC000477917156 893000275 /nfs/dbraw/zinc/00/02/75/893000275.db2.gz STNVESJCCJOQKN-FZMZJTMJSA-N 0 3 408.365 4.016 20 0 HIADHN CCCCn1ncc(NC(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)c1C ZINC000477936482 893026683 /nfs/dbraw/zinc/02/66/83/893026683.db2.gz IALSCFBDIHEJHV-OAQYLSRUSA-N 0 3 401.555 4.203 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)Nc1ccn(-c2ccccc2Cl)n1)c1ccco1 ZINC000478020643 893139518 /nfs/dbraw/zinc/13/95/18/893139518.db2.gz OFSNUPKBQWFVRI-ZBFHGGJFSA-N 0 3 401.898 4.370 20 0 HIADHN COCCC1(CNC(=O)NC[C@H](c2ccc(OC)cc2)N2CCCC2)CCCCC1 ZINC000478024642 893147251 /nfs/dbraw/zinc/14/72/51/893147251.db2.gz MHDYNHYOJGCMEL-JOCHJYFZSA-N 0 3 417.594 4.118 20 0 HIADHN C[C@@H](CNC(=O)C(=O)Nc1ccccc1Oc1ccccc1)N(C)Cc1ccccc1 ZINC000478181540 893346247 /nfs/dbraw/zinc/34/62/47/893346247.db2.gz QYJSJZYYWOOGIG-IBGZPJMESA-N 0 3 417.509 4.054 20 0 HIADHN CN(CCC(=O)Nc1cccnc1)Cc1cn(-c2ccccc2)nc1-c1cccs1 ZINC000478224430 893386506 /nfs/dbraw/zinc/38/65/06/893386506.db2.gz GJMOCDRSCGTDJD-UHFFFAOYSA-N 0 3 417.538 4.456 20 0 HIADHN C[C@@H](CC(=O)Nc1ccccc1)N[C@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O ZINC000478273739 893471820 /nfs/dbraw/zinc/47/18/20/893471820.db2.gz KSXAISKAZHJVSD-UGSOOPFHSA-N 0 3 406.313 4.106 20 0 HIADHN c1cnc2c(c1)cccc2Cc1noc(-c2ccc(CN3CCSCC3)cc2)n1 ZINC000505051062 913792925 /nfs/dbraw/zinc/79/29/25/913792925.db2.gz NOEIVBMSYDUFQW-UHFFFAOYSA-N 0 3 402.523 4.424 20 0 HIADHN CC1CCN([C@@H](CNC(=O)c2ccc(-c3ccccn3)[nH]c2=O)c2cccs2)CC1 ZINC000478522521 893828415 /nfs/dbraw/zinc/82/84/15/893828415.db2.gz WIKMBTADKKAQOY-FQEVSTJZSA-N 0 3 422.554 4.114 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)Nc1ccc(Cl)cc1Br ZINC000478752508 894028332 /nfs/dbraw/zinc/02/83/32/894028332.db2.gz FNPNIWSVYCBRFS-UHFFFAOYSA-N 0 3 411.731 4.093 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)N1CC2(CCOCC2)c2ccccc21 ZINC000478784577 894060689 /nfs/dbraw/zinc/06/06/89/894060689.db2.gz NMFDTZKAPWPHBU-QFIPXVFZSA-N 0 3 405.542 4.102 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)c1ccccc1NCc1cccnc1 ZINC000478797526 894072333 /nfs/dbraw/zinc/07/23/33/894072333.db2.gz MJQPFAKDVVZUAN-DEOSSOPVSA-N 0 3 400.526 4.261 20 0 HIADHN C[C@H](Oc1cccc(C(C)(C)C)c1)C(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000478868585 894147755 /nfs/dbraw/zinc/14/77/55/894147755.db2.gz OXQRGKZMKINMRB-IBGZPJMESA-N 0 3 424.585 4.025 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1nnc(/C=C\c2ccco2)s1)c1ccco1 ZINC000479039723 894300789 /nfs/dbraw/zinc/30/07/89/894300789.db2.gz ASEKHQIJZNBMIH-KJOMZIQVSA-N 0 3 401.492 4.145 20 0 HIADHN COCCSc1ccc([C@H](C)N[C@H]2CCCN(c3ccccc3F)C2=O)cc1 ZINC000479043252 894304317 /nfs/dbraw/zinc/30/43/17/894304317.db2.gz WCNAPEZLOJHAKP-JXFKEZNVSA-N 0 3 402.535 4.410 20 0 HIADHN CCS[C@@H]1CCC[C@@H](N[C@@H](C)c2cc(S(N)(=O)=O)c(Cl)cc2Cl)C1 ZINC000479058982 894317795 /nfs/dbraw/zinc/31/77/95/894317795.db2.gz KWYNZFPBNXTBML-QJPTWQEYSA-N 0 3 411.420 4.356 20 0 HIADHN C[C@H](NC(=O)Nc1cccc2c1CN(c1ccccn1)C2)[C@H](c1ccccc1)N(C)C ZINC000479063002 894323175 /nfs/dbraw/zinc/32/31/75/894323175.db2.gz YYLVQGCCDQZHAU-MHECFPHRSA-N 0 3 415.541 4.415 20 0 HIADHN CC1CCN([C@@H](CNC(=O)[C@H](CO)c2ccc(Cl)cc2)c2cccs2)CC1 ZINC000505170047 913858550 /nfs/dbraw/zinc/85/85/50/913858550.db2.gz ZCYOJLVVCQKCDY-MOPGFXCFSA-N 0 3 406.979 4.067 20 0 HIADHN C[C@@H](CN[C@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl)c1ccc(F)cc1F ZINC000479066751 894330980 /nfs/dbraw/zinc/33/09/80/894330980.db2.gz VCHGHGAEMOHSAL-VHSXEESVSA-N 0 3 423.312 4.373 20 0 HIADHN CC(C)[C@@H](CN[C@@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl)c1cccnc1 ZINC000479070175 894333963 /nfs/dbraw/zinc/33/39/63/894333963.db2.gz ZSUQDBSHGYZALL-SWLSCSKDSA-N 0 3 416.374 4.126 20 0 HIADHN CS(=O)(=O)Cc1ccccc1CN[C@H]1CCCc2cc(Br)ccc21 ZINC000479074722 894340011 /nfs/dbraw/zinc/34/00/11/894340011.db2.gz AGIMQPOEEUQSIU-IBGZPJMESA-N 0 3 408.361 4.161 20 0 HIADHN Cc1cccc([C@@H](C)CN[C@H](C)c2cc(S(N)(=O)=O)c(Cl)cc2Cl)c1 ZINC000479084023 894350487 /nfs/dbraw/zinc/35/04/87/894350487.db2.gz WTLABRVINFWIRM-QWHCGFSZSA-N 0 3 401.359 4.404 20 0 HIADHN O=C(N[C@@H]1CCN(Cc2ccccc2)C1)[C@@H]1C[C@H]1c1ccc(OC(F)(F)F)cc1 ZINC000479158340 894427358 /nfs/dbraw/zinc/42/73/58/894427358.db2.gz HCZSQXHJLVOZDF-YZGWKJHDSA-N 0 3 404.432 4.079 20 0 HIADHN CC[C@H](C)n1nc(C(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)cc1C ZINC000479168932 894437268 /nfs/dbraw/zinc/43/72/68/894437268.db2.gz REQKRJFKNWZHRV-RXVVDRJESA-N 0 3 420.561 4.367 20 0 HIADHN C[C@@H](Cc1ccc(Br)cc1)Nc1ccccc1CN1CCC(O)CC1 ZINC000479282715 894561225 /nfs/dbraw/zinc/56/12/25/894561225.db2.gz GBLJCIMVKRAZLW-INIZCTEOSA-N 0 3 403.364 4.449 20 0 HIADHN CC[C@@H](NC(=O)N(CCN(C)C)Cc1cccc(OC)c1)c1ccc(F)cc1F ZINC000479315619 894603338 /nfs/dbraw/zinc/60/33/38/894603338.db2.gz JHBBOIOZSJAGED-OAQYLSRUSA-N 0 3 405.489 4.198 20 0 HIADHN C[C@H]1CN(c2ccc(CN[C@H]3CCCc4cc(Br)ccc43)cn2)CCO1 ZINC000479329954 894623519 /nfs/dbraw/zinc/62/35/19/894623519.db2.gz HZXUVMQBUAUZKU-YWZLYKJASA-N 0 3 416.363 4.236 20 0 HIADHN C[C@@H]1CN(c2ccc(CN[C@H]3CCCc4cc(Br)ccc43)cn2)CCO1 ZINC000479329953 894623782 /nfs/dbraw/zinc/62/37/82/894623782.db2.gz HZXUVMQBUAUZKU-QRWLVFNGSA-N 0 3 416.363 4.236 20 0 HIADHN CCCN(C(=O)c1ccc(N2CCN(CC)CC2)cc1)[C@@H]1CCCc2cccnc21 ZINC000479347550 894643243 /nfs/dbraw/zinc/64/32/43/894643243.db2.gz ISIHWHUJQZNKEA-HSZRJFAPSA-N 0 3 406.574 4.153 20 0 HIADHN COc1cc(CN[C@@H]2CC(C)(C)c3ccc(Br)cc32)ccc1OCCO ZINC000479365690 894664320 /nfs/dbraw/zinc/66/43/20/894664320.db2.gz UEJLOJZYDVTWKH-GOSISDBHSA-N 0 3 420.347 4.341 20 0 HIADHN COc1cc2c(cc1OC)[C@H](N[C@@H]1CC(=O)N(C)[C@@H]1c1ccc(Cl)c(F)c1)CC2 ZINC000479415397 894725122 /nfs/dbraw/zinc/72/51/22/894725122.db2.gz YHFGBZRRXVITLZ-JBYIUTFZSA-N 0 3 418.896 4.045 20 0 HIADHN C[C@H](NCCC1CC(OC(C)(C)C)C1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479427881 894741493 /nfs/dbraw/zinc/74/14/93/894741493.db2.gz FRDARGSFZKLEOM-HIFPTAJRSA-N 0 3 423.406 4.275 20 0 HIADHN C[C@H]1CCCN(S(=O)(=O)c2ccc(CN[C@H]3CCc4ccc(F)cc43)cc2)C1 ZINC000479433048 894746950 /nfs/dbraw/zinc/74/69/50/894746950.db2.gz XOIUUBJOSDUEKM-AOMKIAJQSA-N 0 3 402.535 4.023 20 0 HIADHN C[C@@H]1CCc2ccc(Br)cc2[C@H](NC[C@@H]2CCCCS2(=O)=O)C1 ZINC000479441382 894757461 /nfs/dbraw/zinc/75/74/61/894757461.db2.gz UDDJITUKAKBXRB-RPVQJOFSSA-N 0 3 400.382 4.020 20 0 HIADHN O=C1[C@@H](N[C@H]2CCCc3cc(Br)ccc32)CCCN1Cc1ccccn1 ZINC000479447134 894762974 /nfs/dbraw/zinc/76/29/74/894762974.db2.gz CGMYRLXUZCPLEZ-PMACEKPBSA-N 0 3 414.347 4.002 20 0 HIADHN CCS(=O)(=O)c1c(Cl)cccc1CN[C@@H]1CCN(Cc2ccccc2)[C@@H](C)C1 ZINC000479452097 894770934 /nfs/dbraw/zinc/77/09/34/894770934.db2.gz IGLNNIYDESFBFJ-FXAWDEMLSA-N 0 3 421.006 4.276 20 0 HIADHN CCc1ccc([C@@H](NCCc2cccc(C)n2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000479466508 894789894 /nfs/dbraw/zinc/78/98/94/894789894.db2.gz VHRUEIIXDSQARQ-XMMPIXPASA-N 0 3 408.567 4.278 20 0 HIADHN COc1ccc([C@@H](NC[C@@H]2CCCN(C(C)=O)C2)c2ccccc2Cl)cc1OC ZINC000479468704 894792171 /nfs/dbraw/zinc/79/21/71/894792171.db2.gz CNZNOOACEYAPGN-GAJHUEQPSA-N 0 3 416.949 4.295 20 0 HIADHN Cc1cc(Br)cc2cc([C@@H](NCC3(S(C)(=O)=O)CC3)C(C)C)oc21 ZINC000479504660 894820553 /nfs/dbraw/zinc/82/05/53/894820553.db2.gz SYNJWAMFCPUOML-INIZCTEOSA-N 0 3 414.365 4.368 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)Nc2cccc(-c3cc[nH]n3)c2)N(C)C)cc1 ZINC000479544094 894845409 /nfs/dbraw/zinc/84/54/09/894845409.db2.gz KDJNJEBQIFZBNW-JOCHJYFZSA-N 0 3 407.518 4.288 20 0 HIADHN CC[C@H](Oc1ccccc1F)C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000479555436 894853302 /nfs/dbraw/zinc/85/33/02/894853302.db2.gz DZVYTHJMQPVJRG-FQEVSTJZSA-N 0 3 402.535 4.213 20 0 HIADHN CN(CCN(Cc1ccccc1)C(=O)NCc1ccc(F)cn1)Cc1ccccc1 ZINC000479599701 894878637 /nfs/dbraw/zinc/87/86/37/894878637.db2.gz HSOOUTAWDWLBML-UHFFFAOYSA-N 0 3 406.505 4.065 20 0 HIADHN Cc1ccccc1[C@H](OC[C@@H](O)CN(C)[C@H](CO)c1ccccc1)c1ccccc1 ZINC000479667627 894944549 /nfs/dbraw/zinc/94/45/49/894944549.db2.gz ROPCTOZSMDGGDZ-SKBVVQJISA-N 0 3 405.538 4.127 20 0 HIADHN COc1ccc(CCN[C@H](C)c2nnn(-c3ccc(Cl)cc3)c2C)cc1OC ZINC000479752134 895050515 /nfs/dbraw/zinc/05/05/15/895050515.db2.gz JAWRODBEPQSYCP-CQSZACIVSA-N 0 3 400.910 4.140 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)N[C@@H](C)c2ccc(OC(F)(F)F)cc2)o1 ZINC000479773681 895075713 /nfs/dbraw/zinc/07/57/13/895075713.db2.gz DXTMQUUWKHTFGI-HNNXBMFYSA-N 0 3 413.440 4.321 20 0 HIADHN COc1ccc([C@H](C)NC(=O)N[C@H](CN2CCCC2)c2ccccc2)c(C)c1OC ZINC000479791677 895095356 /nfs/dbraw/zinc/09/53/56/895095356.db2.gz WOLJVVQLNZSZGO-GHTZIAJQSA-N 0 3 411.546 4.210 20 0 HIADHN CCCOc1ccc([C@H](C)NC(=O)N[C@H](CN(C)C)c2ccc(F)cc2)cc1OC ZINC000479809881 895117322 /nfs/dbraw/zinc/11/73/22/895117322.db2.gz DJVSPUDVYAZVMG-OXJNMPFZSA-N 0 3 417.525 4.286 20 0 HIADHN C[C@H](NC[C@H](c1cccs1)N1CCOCC1)c1ccc(F)cc1Br ZINC000479851056 895184207 /nfs/dbraw/zinc/18/42/07/895184207.db2.gz NAWSGZLWXOJXIW-SUMWQHHRSA-N 0 3 413.356 4.374 20 0 HIADHN COc1cccc([C@H](CN[C@@H](C)c2nnn(-c3cccc(Cl)c3)c2C)N(C)C)c1 ZINC000479866436 895206012 /nfs/dbraw/zinc/20/60/12/895206012.db2.gz ZYWNVIWRSIEYSH-BTYIYWSLSA-N 0 3 413.953 4.191 20 0 HIADHN COc1ccccc1[C@@H](CN[C@@H](C)c1nnn(-c2ccc(F)cc2)c1C)N1CCCC1 ZINC000479875484 895216688 /nfs/dbraw/zinc/21/66/88/895216688.db2.gz QSZDSZCCCYNMCA-HTAPYJJXSA-N 0 3 423.536 4.211 20 0 HIADHN Cc1nc(-c2cccnc2)sc1[C@@H](C)NCc1ccc(CN2CCOCC2)cc1 ZINC000479885597 895231015 /nfs/dbraw/zinc/23/10/15/895231015.db2.gz FTUHANYKLFRAJU-QGZVFWFLSA-N 0 3 408.571 4.197 20 0 HIADHN COc1ccc([C@@H](CN[C@H](C)c2nnn(-c3ccc(F)cc3)c2C)N2CCCC2)cc1 ZINC000480084468 895443349 /nfs/dbraw/zinc/44/33/49/895443349.db2.gz ROXOZFHQZHNZPX-UZUQRXQVSA-N 0 3 423.536 4.211 20 0 HIADHN C[C@@H](NC[C@@H](c1cccs1)N(C)C)c1ccccc1I ZINC000480099359 895465841 /nfs/dbraw/zinc/46/58/41/895465841.db2.gz ZCNXRTNKIPCXGB-DOMZBBRYSA-N 0 3 400.329 4.306 20 0 HIADHN O=C1NC2(CCCC2)C(=O)N1CCCN[C@H]1CCCc2c(Cl)sc(Cl)c21 ZINC000480138910 895519609 /nfs/dbraw/zinc/51/96/09/895519609.db2.gz HEJMFKSPLJDGFV-LBPRGKRZSA-N 0 3 416.374 4.277 20 0 HIADHN CCS[C@@H]1CCCC[C@H]1N[C@H]1CCS(=O)(=O)c2ccc(Br)cc21 ZINC000480198217 895594486 /nfs/dbraw/zinc/59/44/86/895594486.db2.gz ONOHNRBPDUZDQC-ARFHVFGLSA-N 0 3 418.422 4.322 20 0 HIADHN Cc1ccc(C[C@H](C)N[C@H]2CCS(=O)(=O)c3ccc(Br)cc32)s1 ZINC000480206932 895608724 /nfs/dbraw/zinc/60/87/24/895608724.db2.gz BXPLVCVBOSYMFU-ZBEGNZNMSA-N 0 3 414.390 4.258 20 0 HIADHN C[C@H](NCc1ccc(CN2C[C@@H](C)O[C@H](C)C2)cc1)c1cnn(Cc2ccccc2)c1 ZINC000480236642 895646513 /nfs/dbraw/zinc/64/65/13/895646513.db2.gz VQCRYCWIAPSFIP-VSKRKVRLSA-N 0 3 418.585 4.391 20 0 HIADHN COC[C@@H](NC[C@@H](c1ccccc1)N1CCOCC1)c1cccc(C(F)(F)F)c1 ZINC000480249891 895660286 /nfs/dbraw/zinc/66/02/86/895660286.db2.gz QNXNFWWQDNOQRQ-RTWAWAEBSA-N 0 3 408.464 4.056 20 0 HIADHN CCCc1c(NC(=O)N[C@@H](CN(C)C)c2ccc(F)cc2)cnn1-c1ccccc1 ZINC000480272694 895681161 /nfs/dbraw/zinc/68/11/61/895681161.db2.gz YHCRYVXIPHVYCH-NRFANRHFSA-N 0 3 409.509 4.388 20 0 HIADHN CC[C@H](N[C@H](C)c1ccc(S(=O)(=O)N2CCOCC2)cc1)c1ccc(Cl)cc1 ZINC000480283614 895688140 /nfs/dbraw/zinc/68/81/40/895688140.db2.gz OOPDTAAVOVZCSQ-IERDGZPVSA-N 0 3 422.978 4.163 20 0 HIADHN C[C@H](CCc1ccccc1)N[C@@H]1CCS(=O)(=O)c2ccc(Br)cc21 ZINC000480327975 895731322 /nfs/dbraw/zinc/73/13/22/895731322.db2.gz MZHXVJVAYIKFFE-RDTXWAMCSA-N 0 3 408.361 4.279 20 0 HIADHN CCN(Cc1cccc(Br)c1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000480367797 895775618 /nfs/dbraw/zinc/77/56/18/895775618.db2.gz PYNXQEXLEHKAHT-FQEVSTJZSA-N 0 3 416.363 4.255 20 0 HIADHN Cc1ccc(CN[C@@H](C)c2ccc(S(=O)(=O)NCc3ccco3)cc2)cc1F ZINC000480402322 895805808 /nfs/dbraw/zinc/80/58/08/895805808.db2.gz OLIIZEGBDMBWPH-INIZCTEOSA-N 0 3 402.491 4.056 20 0 HIADHN C[C@@H](O)[C@](C)(CNCc1csc(-c2ccc3c(c2)OCO3)n1)Cc1ccccc1 ZINC000480448638 895838038 /nfs/dbraw/zinc/83/80/38/895838038.db2.gz YHMPCHWPJZAJOZ-MWTRTKDXSA-N 0 3 410.539 4.258 20 0 HIADHN Cc1ccc([C@H](CN2CCOCC2)N[C@@H](C)c2ccc(NC(=O)NC3CC3)cc2)cc1 ZINC000480453959 895841168 /nfs/dbraw/zinc/84/11/68/895841168.db2.gz GAEAJHMVDCEPOT-CYFREDJKSA-N 0 3 422.573 4.003 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(NC[C@H](C3CC3)[N@H+](C)Cc3ccccc3)nc2)n1 ZINC000480500125 895869806 /nfs/dbraw/zinc/86/98/06/895869806.db2.gz KHWODHBECPGWIL-OAQYLSRUSA-N 0 3 403.530 4.129 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(NC[C@H](C3CC3)[N@@H+](C)Cc3ccccc3)nc2)n1 ZINC000480500125 895869807 /nfs/dbraw/zinc/86/98/07/895869807.db2.gz KHWODHBECPGWIL-OAQYLSRUSA-N 0 3 403.530 4.129 20 0 HIADHN COc1cccc(C[C@@H](NCc2cccnc2N2CCOCC2)c2ccccc2)c1 ZINC000480524181 895886842 /nfs/dbraw/zinc/88/68/42/895886842.db2.gz IZBCJYMDEWLKOB-XMMPIXPASA-N 0 3 403.526 4.000 20 0 HIADHN CC(C)(C)C(=O)N1CCC(CN[C@@H](C(=O)Nc2ccccc2)c2ccccc2)CC1 ZINC000480564102 895923237 /nfs/dbraw/zinc/92/32/37/895923237.db2.gz PPKDRRMQBHAFLE-JOCHJYFZSA-N 0 3 407.558 4.241 20 0 HIADHN CC(C)CCOc1ccc([C@H](C)NCc2ccc(C(=O)N3CCN(C)CC3)cc2)cc1 ZINC000480605680 895970019 /nfs/dbraw/zinc/97/00/19/895970019.db2.gz FWNDDDCXUHRUPU-NRFANRHFSA-N 0 3 423.601 4.350 20 0 HIADHN CN1CCN(C(=O)c2ccc(CN[C@@H]3CCc4c3ccc(Cl)c4Cl)cc2)CC1 ZINC000480612201 895979033 /nfs/dbraw/zinc/97/90/33/895979033.db2.gz QDEKTXITSMAQBF-HXUWFJFHSA-N 0 3 418.368 4.158 20 0 HIADHN Cc1cc(C)n(-c2ccc(CCN[C@H](C)c3nnn(-c4ccccc4)c3C)cc2)n1 ZINC000480615018 895980912 /nfs/dbraw/zinc/98/09/12/895980912.db2.gz UMSUKHXABWNRDL-LJQANCHMSA-N 0 3 400.530 4.272 20 0 HIADHN C[C@@H](NCc1cccc(N2CCCC2=O)c1)c1ccc(I)cc1 ZINC000480616430 895982336 /nfs/dbraw/zinc/98/23/36/895982336.db2.gz XDIZVLIQBQOQQD-CQSZACIVSA-N 0 3 420.294 4.269 20 0 HIADHN COc1ccc(CCNC(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)cc1F ZINC000480641632 896010411 /nfs/dbraw/zinc/01/04/11/896010411.db2.gz BRRNEUPERONHFX-LJQANCHMSA-N 0 3 419.566 4.211 20 0 HIADHN CS[C@H](CN[C@H]1CCS(=O)(=O)c2ccc(Br)cc21)C(C)(C)C ZINC000480657765 896026268 /nfs/dbraw/zinc/02/62/68/896026268.db2.gz AYNSCMPLFMFOGE-DZGCQCFKSA-N 0 3 406.411 4.035 20 0 HIADHN C[C@H](NCCc1nn(C)c2ccccc12)c1ccccc1I ZINC000480665764 896030926 /nfs/dbraw/zinc/03/09/26/896030926.db2.gz QVZUYIQMYVTUDR-ZDUSSCGKSA-N 0 3 405.283 4.071 20 0 HIADHN CCCOc1ccc([C@H](C)NCc2ccc(N3CCCS3(=O)=O)c(F)c2)cc1 ZINC000480665085 896031315 /nfs/dbraw/zinc/03/13/15/896031315.db2.gz PXHUIKJNBQUCRE-INIZCTEOSA-N 0 3 406.523 4.005 20 0 HIADHN CC(C)c1cccc(CN[C@@H](CN2CCC(C(N)=O)CC2)c2ccc(Cl)cc2)c1 ZINC000480666729 896031571 /nfs/dbraw/zinc/03/15/71/896031571.db2.gz IFJKVCDVNPBAEC-QHCPKHFHSA-N 0 3 413.993 4.492 20 0 HIADHN C[C@@H]1CN(Cc2ccccn2)CC[C@@H]1Nc1ccc2c(c1)CCC(=O)N2CC1CC1 ZINC000480684654 896047913 /nfs/dbraw/zinc/04/79/13/896047913.db2.gz UNTRHNPDRBYYNW-JPYJTQIMSA-N 0 3 404.558 4.093 20 0 HIADHN Cc1onc(-c2ccncc2)c1C(=O)NC[C@H](c1ccccc1)N1CCC(C)CC1 ZINC000480689170 896051287 /nfs/dbraw/zinc/05/12/87/896051287.db2.gz MBAOAWPRUFWAQJ-OAQYLSRUSA-N 0 3 404.514 4.248 20 0 HIADHN COC1(CN[C@H](c2ccc(C)cc2)c2cccc(S(C)(=O)=O)c2)CCCCC1 ZINC000480695048 896058839 /nfs/dbraw/zinc/05/88/39/896058839.db2.gz IWWBBSRJJWLKOP-JOCHJYFZSA-N 0 3 401.572 4.427 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)c1ccc(-c2n[nH]c(C3CC3)n2)cc1 ZINC000480704157 896067161 /nfs/dbraw/zinc/06/71/61/896067161.db2.gz CJFSCXLYUOBYDJ-SFHVURJKSA-N 0 3 415.541 4.086 20 0 HIADHN O=C(Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1)[C@@H]1CCC(F)(F)C1 ZINC000480711818 896073874 /nfs/dbraw/zinc/07/38/74/896073874.db2.gz RLRLWCJQNKHCMN-HXUWFJFHSA-N 0 3 413.512 4.425 20 0 HIADHN COCCOc1ccc(CN[C@@H](C)c2ccc(I)cc2)cc1 ZINC000480773414 896137942 /nfs/dbraw/zinc/13/79/42/896137942.db2.gz YXMMJPCESRZASF-AWEZNQCLSA-N 0 3 411.283 4.167 20 0 HIADHN CCOCc1ccc(CN[C@@H](C)c2ccc(S(=O)(=O)N(CC)CC)cc2)cc1 ZINC000480781806 896148670 /nfs/dbraw/zinc/14/86/70/896148670.db2.gz SMZOYPRBUJRADX-SFHVURJKSA-N 0 3 404.576 4.104 20 0 HIADHN COC(=O)c1ccccc1CCN1CCC([C@@H]2C(=O)Nc3cc(Cl)ccc32)CC1 ZINC000480784310 896150014 /nfs/dbraw/zinc/15/00/14/896150014.db2.gz BRLSSEQQQSANQM-NRFANRHFSA-N 0 3 412.917 4.117 20 0 HIADHN C[C@H](NCCC(=O)NC1CCCCC1)c1ccc(OC(F)F)cc1OC(F)F ZINC000480910315 896266362 /nfs/dbraw/zinc/26/63/62/896266362.db2.gz JWXUABGIGXKONZ-LBPRGKRZSA-N 0 3 406.420 4.379 20 0 HIADHN C[C@@H](NCc1cccc(NC(=O)Cn2cccn2)c1)c1cccc(C(F)(F)F)c1 ZINC000480913373 896272598 /nfs/dbraw/zinc/27/25/98/896272598.db2.gz XPYZRDJSPYOEMG-OAHLLOKOSA-N 0 3 402.420 4.391 20 0 HIADHN C[C@H](NCc1cccc(NC(=O)CCN2CCOCC2)c1)c1ccc2c(c1)CCCC2 ZINC000480921215 896278489 /nfs/dbraw/zinc/27/84/89/896278489.db2.gz PFRIVUSDHNPWDJ-FQEVSTJZSA-N 0 3 421.585 4.077 20 0 HIADHN COc1cc(CN[C@@H](C)c2csc(-c3csc(C)n3)c2)ccc1OCCO ZINC000480920530 896278952 /nfs/dbraw/zinc/27/89/52/896278952.db2.gz LQXUFMYBDWLICP-ZDUSSCGKSA-N 0 3 404.557 4.411 20 0 HIADHN O=S(=O)(CCO)c1ccc(CNCc2ccc(-c3ccc(Cl)cc3)s2)cc1 ZINC000480941865 896289414 /nfs/dbraw/zinc/28/94/14/896289414.db2.gz ZDEFAXKOPPIOAY-UHFFFAOYSA-N 0 3 421.971 4.124 20 0 HIADHN COc1cnccc1N1CCN(c2ncnc3scc(-c4ccccc4)c32)CC1 ZINC000481044007 896368439 /nfs/dbraw/zinc/36/84/39/896368439.db2.gz FMXVEUGNMGKPPV-UHFFFAOYSA-N 0 3 403.511 4.089 20 0 HIADHN CCN1CCC[C@@H](CN(C)C(=O)c2ccc(F)c3ccccc23)[C@@H]1c1cnn(C)c1 ZINC000481072544 896391789 /nfs/dbraw/zinc/39/17/89/896391789.db2.gz OERYWFUMJDIHNU-GAJHUEQPSA-N 0 3 408.521 4.258 20 0 HIADHN Cc1cccc2c1CC[C@@H]2NCc1cccc(S(=O)(=O)NCc2cccc(F)c2)c1 ZINC000481181322 896522355 /nfs/dbraw/zinc/52/23/55/896522355.db2.gz VRDKYZWITPDROT-DEOSSOPVSA-N 0 3 424.541 4.390 20 0 HIADHN COc1ccc([C@H](C)N[C@@H](C)c2ccc(OCCO)c(OC)c2)cc1Br ZINC000481187121 896535001 /nfs/dbraw/zinc/53/50/01/896535001.db2.gz WWIQOGJDSQQNKJ-KBPBESRZSA-N 0 3 424.335 4.249 20 0 HIADHN COc1ccc([C@@H](C)N[C@H](C)c2ccc(OCCO)c(OC)c2)cc1Br ZINC000481187124 896536521 /nfs/dbraw/zinc/53/65/21/896536521.db2.gz WWIQOGJDSQQNKJ-ZIAGYGMSSA-N 0 3 424.335 4.249 20 0 HIADHN C[C@H]1Cc2ccccc2[C@@H]1NCc1cccc(S(=O)(=O)NCc2cccc(F)c2)c1 ZINC000481189368 896538676 /nfs/dbraw/zinc/53/86/76/896538676.db2.gz MRVJZOFGYIQOPL-BXKMTCNYSA-N 0 3 424.541 4.327 20 0 HIADHN C[C@H](NCc1ccccc1OCCN1CCOCC1)c1ccc(-c2ccncc2)cc1 ZINC000481196477 896550582 /nfs/dbraw/zinc/55/05/82/896550582.db2.gz ZGGZMSLXIIYQHG-NRFANRHFSA-N 0 3 417.553 4.310 20 0 HIADHN COc1ccc2cc([C@@H](C)NCc3ccccc3OCCN3CCOCC3)ccc2c1 ZINC000481202618 896556145 /nfs/dbraw/zinc/55/61/45/896556145.db2.gz LUGIOSZBTBAOIU-HXUWFJFHSA-N 0 3 420.553 4.410 20 0 HIADHN O=C(NC[C@H]1CCO[C@@H]1c1ccccc1)NC[C@H]1CCCCN1Cc1ccccc1 ZINC000481216722 896569900 /nfs/dbraw/zinc/56/99/00/896569900.db2.gz YYNXTVHCMOSBNS-WXFUMESZSA-N 0 3 407.558 4.118 20 0 HIADHN O=C(CN[C@@H](CC1CCC1)c1ccccc1)NCc1ccccc1Cn1cccn1 ZINC000481223639 896574373 /nfs/dbraw/zinc/57/43/73/896574373.db2.gz FXGGNRBIRNUASQ-DEOSSOPVSA-N 0 3 402.542 4.069 20 0 HIADHN C[C@H](NCc1cccnc1N1CCN(C)CC1)c1ccc(SCC(F)(F)F)cc1 ZINC000481247662 896598472 /nfs/dbraw/zinc/59/84/72/896598472.db2.gz UHNJHNHLLKVSFO-INIZCTEOSA-N 0 3 424.536 4.339 20 0 HIADHN Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)NCc1cccnc1N1CCN(C)CC1 ZINC000481246425 896598993 /nfs/dbraw/zinc/59/89/93/896598993.db2.gz MEYRJNSFDBZOFR-GOSISDBHSA-N 0 3 421.614 4.425 20 0 HIADHN C[C@H](NCc1cccc(CN2CCOCC2)c1)c1ccc(F)c(Br)c1 ZINC000481319574 896672963 /nfs/dbraw/zinc/67/29/63/896672963.db2.gz LMVVBIRJFUUJSG-HNNXBMFYSA-N 0 3 407.327 4.271 20 0 HIADHN CCOc1cc(CN[C@@H](C)c2cccc(N3CCOCC3)c2)ccc1OC(F)F ZINC000481325136 896680979 /nfs/dbraw/zinc/68/09/79/896680979.db2.gz TXYRCCYZDCTZNT-INIZCTEOSA-N 0 3 406.473 4.374 20 0 HIADHN Cc1nc(NC(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)ccc1Br ZINC000481343274 896711219 /nfs/dbraw/zinc/71/12/19/896711219.db2.gz QHVXKOGXTOUGQY-HOCLYGCPSA-N 0 3 403.324 4.110 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)N[C@@H](C1CCCC1)C(F)(F)F ZINC000481350380 896722709 /nfs/dbraw/zinc/72/27/09/896722709.db2.gz UFUSUCPUZGZMTQ-KRWDZBQOSA-N 0 3 407.427 4.159 20 0 HIADHN C[C@H](NCc1cccc(OCCN2CCOCC2)c1)c1ccc(-c2ccncc2)cc1 ZINC000481401313 896808506 /nfs/dbraw/zinc/80/85/06/896808506.db2.gz INVLEMMYPMTPQH-NRFANRHFSA-N 0 3 417.553 4.310 20 0 HIADHN COc1ccc2oc([C@H](C)NCc3cccc(OCCN4CCOCC4)c3)c(C)c2c1 ZINC000481422737 896825236 /nfs/dbraw/zinc/82/52/36/896825236.db2.gz LLCXHBIBPLMYNF-IBGZPJMESA-N 0 3 424.541 4.312 20 0 HIADHN CC(C)C[C@@H](C)n1nccc1NC(=O)N(CCN(C)C)Cc1ccc(F)c(F)c1 ZINC000481490363 896870057 /nfs/dbraw/zinc/87/00/57/896870057.db2.gz JSOKKBUAOQBRIK-MRXNPFEDSA-N 0 3 407.509 4.364 20 0 HIADHN CCCN1Cc2cccc(NC(=O)CSc3nc(-c4ccc(C)cc4)n[nH]3)c2C1 ZINC000481512865 896880888 /nfs/dbraw/zinc/88/08/88/896880888.db2.gz XGHOPQYEGRPZDB-UHFFFAOYSA-N 0 3 407.543 4.237 20 0 HIADHN C[C@H](NC[C@H](O)COc1ccc(C(F)(F)F)cc1)c1cnn(Cc2ccccc2)c1 ZINC000481533827 896895512 /nfs/dbraw/zinc/89/55/12/896895512.db2.gz LXWOIJADHVRALY-JXFKEZNVSA-N 0 3 419.447 4.041 20 0 HIADHN COc1ccc(OC)c([C@@H](C)NC[C@H](O)COc2cccc(Cl)c2Cl)c1 ZINC000481539859 896898904 /nfs/dbraw/zinc/89/89/04/896898904.db2.gz ZBPDIJOPWLVYDW-OLZOCXBDSA-N 0 3 400.302 4.101 20 0 HIADHN COc1ccc(OC)c([C@@H](C)NC[C@@H](O)COc2cccc(Cl)c2Cl)c1 ZINC000481539856 896899254 /nfs/dbraw/zinc/89/92/54/896899254.db2.gz ZBPDIJOPWLVYDW-CHWSQXEVSA-N 0 3 400.302 4.101 20 0 HIADHN C[C@@H](NC[C@H](O)COc1cccc(Cl)c1Cl)c1cnn(Cc2ccccc2)c1 ZINC000481546050 896907771 /nfs/dbraw/zinc/90/77/71/896907771.db2.gz KSEKAZAVBOEUGF-QAPCUYQASA-N 0 3 420.340 4.329 20 0 HIADHN Cc1nccn1-c1ccc(CN[C@@H](C)c2ccc(NC(=O)NC3CC3)cc2)cc1F ZINC000481554375 896924939 /nfs/dbraw/zinc/92/49/39/896924939.db2.gz BAYRWFMZUWLRLS-HNNXBMFYSA-N 0 3 407.493 4.455 20 0 HIADHN Cc1c([C@@H](C)NC[C@H](O)COc2ccc(F)cc2)cnn1-c1cccc(Cl)c1 ZINC000481555315 896925924 /nfs/dbraw/zinc/92/59/24/896925924.db2.gz DRKMKAWDAUPNKN-KUHUBIRLSA-N 0 3 403.885 4.064 20 0 HIADHN COc1ccc2ccccc2c1-c1cc(CN2CCC([C@H](C)NC(C)=O)CC2)on1 ZINC000481577461 896956802 /nfs/dbraw/zinc/95/68/02/896956802.db2.gz AZHBFQXNXAFDCN-INIZCTEOSA-N 0 3 407.514 4.240 20 0 HIADHN CC[C@H](NCc1ccc(-n2ccnc2C)c(F)c1)c1ccccc1OCC(=O)N(C)C ZINC000481579236 896958880 /nfs/dbraw/zinc/95/88/80/896958880.db2.gz HWRXSUIXKIJCQF-NRFANRHFSA-N 0 3 424.520 4.028 20 0 HIADHN CC(C)N(C)S(=O)(=O)c1ccc(CN[C@@H](C)c2cccc(OC(F)F)c2)cc1 ZINC000481579434 896958949 /nfs/dbraw/zinc/95/89/49/896958949.db2.gz VXWHFNAKNFZFEQ-HNNXBMFYSA-N 0 3 412.502 4.168 20 0 HIADHN C[C@H](NC[C@H](O)COc1ccc(C(F)(F)F)cc1)c1ccccc1OC(F)F ZINC000481580363 896961042 /nfs/dbraw/zinc/96/10/42/896961042.db2.gz XWBXCVYMDJMHDU-JSGCOSHPSA-N 0 3 405.363 4.397 20 0 HIADHN COc1ccccc1NC(=O)CNC1(c2ccc(Br)cc2)CCCC1 ZINC000505450181 914117290 /nfs/dbraw/zinc/11/72/90/914117290.db2.gz ZBFQJALYVUSXGN-UHFFFAOYSA-N 0 3 403.320 4.455 20 0 HIADHN Cc1oc2ccc(NC(=O)N[C@H]3CCN(Cc4ccccc4)C[C@H]3CO)cc2c1C ZINC000481641959 897027118 /nfs/dbraw/zinc/02/71/18/897027118.db2.gz NQIFJCXFKITHDT-UGKGYDQZSA-N 0 3 407.514 4.054 20 0 HIADHN CC1(C)CC[C@H](NCc2cccc(OCC(N)=O)c2)c2cc(Br)ccc21 ZINC000481666470 897050511 /nfs/dbraw/zinc/05/05/11/897050511.db2.gz FMWSCLIJTQXSBP-IBGZPJMESA-N 0 3 417.347 4.216 20 0 HIADHN COc1cccc([C@H](CNC(=O)Nc2cc(F)c(OC)cc2C)N2CCCC2)c1 ZINC000481681429 897063935 /nfs/dbraw/zinc/06/39/35/897063935.db2.gz DBQGFNAICJLBTM-FQEVSTJZSA-N 0 3 401.482 4.110 20 0 HIADHN COc1cccc([C@@H](CNC(=O)Nc2cc(F)c(OC)cc2C)N2CCCC2)c1 ZINC000481681432 897064174 /nfs/dbraw/zinc/06/41/74/897064174.db2.gz DBQGFNAICJLBTM-HXUWFJFHSA-N 0 3 401.482 4.110 20 0 HIADHN c1ccc2c(c1)CO[C@@]21CCCN(CCN2CCC[C@]3(C2)OCc2ccccc23)C1 ZINC000481692871 897079793 /nfs/dbraw/zinc/07/97/93/897079793.db2.gz HLIHWAKISSOEMW-CLJLJLNGSA-N 0 3 404.554 4.029 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1NC(=O)CCN1Cc2ccccc2C2(CC2)C1 ZINC000481743016 897137321 /nfs/dbraw/zinc/13/73/21/897137321.db2.gz POAMVPUPJOLQPM-UHFFFAOYSA-N 0 3 400.526 4.365 20 0 HIADHN Cc1nn(-c2ccccc2C)c2sc(C(=O)N3CCC[C@H](N4CCCC4)C3)cc12 ZINC000481751034 897142521 /nfs/dbraw/zinc/14/25/21/897142521.db2.gz RGZFVOONOZJQSM-SFHVURJKSA-N 0 3 408.571 4.404 20 0 HIADHN Cc1nc(-c2ccccc2C)sc1C(=O)NCCCCN1C[C@@H](C)O[C@@H](C)C1 ZINC000481780237 897162408 /nfs/dbraw/zinc/16/24/08/897162408.db2.gz NOIMJHNIXYTGDW-CALCHBBNSA-N 0 3 401.576 4.046 20 0 HIADHN COc1cccc(C(NC(=O)N2CCN(C3CCCC3)CC2)c2cccc(OC)c2)c1 ZINC000481791137 897172807 /nfs/dbraw/zinc/17/28/07/897172807.db2.gz BWSQTZLOBTXJEP-UHFFFAOYSA-N 0 3 423.557 4.063 20 0 HIADHN CC(C)[C@@]1(C)C[C@H]1C(=O)NC1CCN(CCOc2ccc(Br)cc2)CC1 ZINC000481803110 897180767 /nfs/dbraw/zinc/18/07/67/897180767.db2.gz DYFOGQMLIDCRLK-PZJWPPBQSA-N 0 3 423.395 4.091 20 0 HIADHN CC(C)(C(=O)NCCCCN1CCN(c2cccc(C(F)(F)F)c2)CC1)C1CC1 ZINC000481880292 897252713 /nfs/dbraw/zinc/25/27/13/897252713.db2.gz ZHCLZUDWISYDDH-UHFFFAOYSA-N 0 3 411.512 4.160 20 0 HIADHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)Nc1nnc(-c2c(F)cccc2Cl)s1 ZINC000481917456 897300423 /nfs/dbraw/zinc/30/04/23/897300423.db2.gz HLVFENKIHIUTRN-NEPJUHHUSA-N 0 3 409.918 4.088 20 0 HIADHN CC1(C)CC[C@@H](NCc2cccc(NC(=O)CCN3CCOCC3)c2)c2ccccc21 ZINC000481917112 897300533 /nfs/dbraw/zinc/30/05/33/897300533.db2.gz PHGZKOAAVVBXPW-XMMPIXPASA-N 0 3 421.585 4.250 20 0 HIADHN COc1cc(F)c([C@H](C)NC[C@H](c2ccc(Cl)cc2)N2CCOCC2)cc1OC ZINC000481957338 897347095 /nfs/dbraw/zinc/34/70/95/897347095.db2.gz FZZVIBVORMHHPH-MGPUTAFESA-N 0 3 422.928 4.220 20 0 HIADHN COC(=O)c1ccc(-c2ccc(CN3CCC(C(=O)N[C@@H](C)C(C)C)CC3)o2)cc1 ZINC000481981486 897375237 /nfs/dbraw/zinc/37/52/37/897375237.db2.gz CMRUICZVDWMKAJ-KRWDZBQOSA-N 0 3 412.530 4.106 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)Nc2ncc(C(F)(F)F)s2)N(C)C)cc1 ZINC000482052647 897478608 /nfs/dbraw/zinc/47/86/08/897478608.db2.gz SZIIUWHVCIDSMC-CQSZACIVSA-N 0 3 416.469 4.374 20 0 HIADHN COC(=O)c1ccc(-c2ccc(CN[C@@H]3CCN(c4ncccc4Cl)C3)o2)cc1 ZINC000482053404 897479336 /nfs/dbraw/zinc/47/93/36/897479336.db2.gz GGDXZVAXHFAEKY-QGZVFWFLSA-N 0 3 411.889 4.150 20 0 HIADHN O=C(NCc1ccc(F)cc1)C1CCN(Cc2ccc(OCC(F)(F)F)cc2)CC1 ZINC000505485343 914167230 /nfs/dbraw/zinc/16/72/30/914167230.db2.gz AKKJMKLFFRYOSH-UHFFFAOYSA-N 0 3 424.438 4.295 20 0 HIADHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)Nc1ccc(Cl)cn1 ZINC000482089680 897532549 /nfs/dbraw/zinc/53/25/49/897532549.db2.gz DPXOLQYCGZVNPG-UHFFFAOYSA-N 0 3 411.731 4.093 20 0 HIADHN C[C@@H](NCc1cccc(COC(C)(C)C)c1)c1cccc(N2CCCS2(=O)=O)c1 ZINC000482092516 897535716 /nfs/dbraw/zinc/53/57/16/897535716.db2.gz YZWHFDMOJZENGQ-GOSISDBHSA-N 0 3 416.587 4.392 20 0 HIADHN COc1ccc([C@@H](C)N[C@@H](C)CC(=O)Nc2cccc(N3CCCC3)c2)c(OC)c1 ZINC000482100173 897547250 /nfs/dbraw/zinc/54/72/50/897547250.db2.gz NSMDKBWFNJHSSZ-ZWKOTPCHSA-N 0 3 411.546 4.372 20 0 HIADHN C[C@]1(c2ccc(CN[C@@H]3CCCSc4ccc(Cl)cc43)cc2)NC(=O)NC1=O ZINC000482108578 897558315 /nfs/dbraw/zinc/55/83/15/897558315.db2.gz PMXAPMZPRJKWIY-DYESRHJHSA-N 0 3 415.946 4.111 20 0 HIADHN C[C@H](NCc1ccc(NC(=O)c2ccncc2)cc1)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000482114036 897564365 /nfs/dbraw/zinc/56/43/65/897564365.db2.gz KNZQOJKHKXBYQB-INIZCTEOSA-N 0 3 414.509 4.414 20 0 HIADHN CCN(CC)C(=O)Nc1ccc([C@@H](C)NCc2ccc(OC)c(NC(C)=O)c2)cc1 ZINC000482118299 897570770 /nfs/dbraw/zinc/57/07/70/897570770.db2.gz DSJYNCNXSVCAKC-MRXNPFEDSA-N 0 3 412.534 4.378 20 0 HIADHN CC[C@@H](NCc1ccc(NC(=O)c2ccncc2)cc1)c1ccc2c(c1)OCCO2 ZINC000482118519 897571334 /nfs/dbraw/zinc/57/13/34/897571334.db2.gz IOVAXCCBEVBZBB-OAQYLSRUSA-N 0 3 403.482 4.346 20 0 HIADHN FC(F)(F)c1cc(Cl)c2nnc(CNCCCc3ccc4c(c3)CCO4)n2c1 ZINC000482161336 897624491 /nfs/dbraw/zinc/62/44/91/897624491.db2.gz DPTASTNEUYCNFP-UHFFFAOYSA-N 0 3 410.827 4.059 20 0 HIADHN COC(=O)c1ccccc1-c1ccc(CN[C@H](Cc2ccccc2)[C@@H](O)C(F)F)o1 ZINC000482210682 897689901 /nfs/dbraw/zinc/68/99/01/897689901.db2.gz IXVFXLVUNXIVEN-TZIWHRDSSA-N 0 3 415.436 4.060 20 0 HIADHN COC(=O)c1ccccc1-c1ccc(CN[C@@H](Cc2ccccc2)[C@@H](O)C(F)F)o1 ZINC000482210679 897690180 /nfs/dbraw/zinc/69/01/80/897690180.db2.gz IXVFXLVUNXIVEN-PZJWPPBQSA-N 0 3 415.436 4.060 20 0 HIADHN C[C@H](NCc1ccc2c(c1)OCCCO2)c1ccc(I)cc1 ZINC000482246143 897728268 /nfs/dbraw/zinc/72/82/68/897728268.db2.gz KJJNZPYWAPWACG-ZDUSSCGKSA-N 0 3 409.267 4.303 20 0 HIADHN COc1ccc(-c2ccncc2)cc1CN1CCC(O)(Cc2ccc(F)cc2)CC1 ZINC000482271907 897758126 /nfs/dbraw/zinc/75/81/26/897758126.db2.gz GPMJHUUWIWGTDW-UHFFFAOYSA-N 0 3 406.501 4.466 20 0 HIADHN CCCN(Cc1ccccc1OCC(=O)NCC1CC1)[C@@H]1CCCc2cccnc21 ZINC000482290734 897786518 /nfs/dbraw/zinc/78/65/18/897786518.db2.gz XHRPNYJQLJKJGF-JOCHJYFZSA-N 0 3 407.558 4.276 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)[C@H](C)c2ccc(Br)cc2)c1 ZINC000482361893 897879868 /nfs/dbraw/zinc/87/98/68/897879868.db2.gz MQQYMDFTYUDNIZ-MRXNPFEDSA-N 0 3 419.363 4.152 20 0 HIADHN COC[C@@H](C)Oc1ccc(Cl)cc1NC(=O)N[C@H](CN(C)C)c1ccc(F)cc1 ZINC000482393861 897927093 /nfs/dbraw/zinc/92/70/93/897927093.db2.gz PKYXSLMRQLVMFF-AUUYWEPGSA-N 0 3 423.916 4.317 20 0 HIADHN CN(C)CCN(C(=O)N[C@@H](c1ccc(OC(F)F)cc1)C(F)(F)F)C1CCCC1 ZINC000482452554 898018775 /nfs/dbraw/zinc/01/87/75/898018775.db2.gz VRRLUKATMNASDK-INIZCTEOSA-N 0 3 423.426 4.407 20 0 HIADHN CCOc1cc(CN2CCC([C@H](C)NC(C)=O)CC2)ccc1OCc1ccccc1 ZINC000482534953 898122482 /nfs/dbraw/zinc/12/24/82/898122482.db2.gz VKGDOFIBTWBSIY-IBGZPJMESA-N 0 3 410.558 4.401 20 0 HIADHN CCN1CCN(c2ccccc2NCc2csc(-c3ccc4c(c3)OCO4)n2)CC1 ZINC000482557075 898149268 /nfs/dbraw/zinc/14/92/68/898149268.db2.gz XRGQTOCKRUSIGP-UHFFFAOYSA-N 0 3 422.554 4.293 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)c1ccc(S(=O)(=O)Cc2ccccc2)cc1 ZINC000482579920 898175870 /nfs/dbraw/zinc/17/58/70/898175870.db2.gz KYFRXXLWFCVBFB-UHFFFAOYSA-N 0 3 422.550 4.283 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)[C@H]1CC(=O)N(c2cccc3ccccc32)C1 ZINC000482624346 898228392 /nfs/dbraw/zinc/22/83/92/898228392.db2.gz VLGHSHDZSBLVDR-FQEVSTJZSA-N 0 3 401.510 4.201 20 0 HIADHN COCCC1(CNC(=O)NC[C@H](c2cccc(OC)c2)N2CCCC2)CCCCC1 ZINC000482636516 898240735 /nfs/dbraw/zinc/24/07/35/898240735.db2.gz VWYZGRSWSCEMKF-JOCHJYFZSA-N 0 3 417.594 4.118 20 0 HIADHN C[C@H](NC(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C)c1ccc(NC(=O)NC2CC2)cc1 ZINC000482637173 898242455 /nfs/dbraw/zinc/24/24/55/898242455.db2.gz JYXZYVFHNXTEED-PNLZDCPESA-N 0 3 423.561 4.022 20 0 HIADHN Cc1c([C@H](C)NC(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)cnn1-c1ccc(F)cc1 ZINC000482667057 898269954 /nfs/dbraw/zinc/26/99/54/898269954.db2.gz BDXPSWFLSKZFIS-MFEFFIJZSA-N 0 3 423.536 4.371 20 0 HIADHN C[C@H](Cn1ncc2ccccc2c1=O)NCC1=Cc2cc(Cl)cc(Cl)c2OC1 ZINC000482675277 898277477 /nfs/dbraw/zinc/27/74/77/898277477.db2.gz CRSXMPQFCBOBDV-CYBMUJFWSA-N 0 3 416.308 4.157 20 0 HIADHN CN1C(=O)C[C@@H](NCc2cccc(OCc3ccccn3)c2)[C@H]1c1ccc(F)c(F)c1 ZINC000482719580 898321620 /nfs/dbraw/zinc/32/16/20/898321620.db2.gz CIYIBDXTVFCJRL-ISKFKSNPSA-N 0 3 423.463 4.000 20 0 HIADHN O=C(N[C@H](c1nccs1)c1ccccc1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000505546012 914246186 /nfs/dbraw/zinc/24/61/86/914246186.db2.gz ATCLAFAISRWZHS-CTNGQTDRSA-N 0 3 409.530 4.400 20 0 HIADHN CC(C)(C)c1nn(Cc2ccccc2)cc1CN[C@H]1CCN(C(=O)C2CCCCC2)C1 ZINC000482788098 898397094 /nfs/dbraw/zinc/39/70/94/898397094.db2.gz LLHJDFBGUNBBOI-QHCPKHFHSA-N 0 3 422.617 4.500 20 0 HIADHN C[C@H](CNC(=O)c1cccc(CN2CCCC2)c1)Oc1ccccc1Br ZINC000482812292 898423181 /nfs/dbraw/zinc/42/31/81/898423181.db2.gz XLIRIDFHAVXZSO-MRXNPFEDSA-N 0 3 417.347 4.242 20 0 HIADHN C[C@H](NCCOc1c(Br)cccc1Br)c1ccccn1 ZINC000482825049 898433476 /nfs/dbraw/zinc/43/34/76/898433476.db2.gz KNBUGTQCMLSELS-NSHDSACASA-N 0 3 400.114 4.336 20 0 HIADHN O=C(CSc1nccc2ccccc21)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000482839271 898448720 /nfs/dbraw/zinc/44/87/20/898448720.db2.gz VGSSPEMUEHMVCV-UHFFFAOYSA-N 0 3 421.566 4.170 20 0 HIADHN O=C(NCc1cc(-c2ccccc2)no1)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000505553744 914256629 /nfs/dbraw/zinc/25/66/29/914256629.db2.gz PWQROOCOOJQDTF-HXUWFJFHSA-N 0 3 411.452 4.115 20 0 HIADHN COc1cc(NC(=O)CCN2CCCC[C@@H]2c2ccc(F)cc2)cc(OC)c1OC ZINC000482919149 898536968 /nfs/dbraw/zinc/53/69/68/898536968.db2.gz UNPRMYDXOPILEM-LJQANCHMSA-N 0 3 416.493 4.407 20 0 HIADHN CN(C)Cc1ccc(C(=O)Nc2cccc(CS(=O)(=O)C3CCCCC3)c2)cc1 ZINC000482969742 898602123 /nfs/dbraw/zinc/60/21/23/898602123.db2.gz DKJQEGAOFDSTCR-UHFFFAOYSA-N 0 3 414.571 4.248 20 0 HIADHN Brc1ccc2c(c1)CC[C@H]2NCc1ccnc(OC2CCOCC2)c1 ZINC000482982567 898620826 /nfs/dbraw/zinc/62/08/26/898620826.db2.gz MGEBHLMQRNQTIN-LJQANCHMSA-N 0 3 403.320 4.179 20 0 HIADHN CO[C@@]1(C)CCCN([C@H](C)C(=O)Nc2ccc(NC(=O)c3cccs3)cc2)CC1 ZINC000483014533 898670296 /nfs/dbraw/zinc/67/02/96/898670296.db2.gz IKJJIBQAUOXYNW-ZHRRBRCNSA-N 0 3 415.559 4.218 20 0 HIADHN CC(C)c1ccc(NC(=O)N2CC[C@H](N3CCN(C)CC3)[C@@H](C)C2)c(C(C)C)c1 ZINC000483040011 898707482 /nfs/dbraw/zinc/70/74/82/898707482.db2.gz KMHBJQLPYULGCR-CVDCTZTESA-N 0 3 400.611 4.423 20 0 HIADHN COc1ccccc1-c1csc(C2CCN(C(=O)[C@@H](C(C)C)N(C)C)CC2)n1 ZINC000483054214 898728275 /nfs/dbraw/zinc/72/82/75/898728275.db2.gz JMUOCWSAEUYDQO-HXUWFJFHSA-N 0 3 401.576 4.111 20 0 HIADHN C[C@@H]1CN(C(=O)Nc2ccccc2SC2CCCC2)CC[C@H]1N1CCN(C)CC1 ZINC000483056629 898729742 /nfs/dbraw/zinc/72/97/42/898729742.db2.gz HCHHJVBAFHEYDY-WIYYLYMNSA-N 0 3 416.635 4.211 20 0 HIADHN CCCC[C@](C)(NCC(=O)Nc1c(C)n[nH]c1C)c1cccc(Br)c1 ZINC000483073778 898757521 /nfs/dbraw/zinc/75/75/21/898757521.db2.gz UWPRXKBIUMCNSM-IBGZPJMESA-N 0 3 407.356 4.423 20 0 HIADHN CCCC[C@@](C)(NCC(=O)Nc1c(C)nn(C)c1C)c1cccc(Br)c1 ZINC000483092107 898781630 /nfs/dbraw/zinc/78/16/30/898781630.db2.gz SSBQFINHPMNGKG-HXUWFJFHSA-N 0 3 421.383 4.433 20 0 HIADHN C[C@H](NC(=O)c1c[nH]c2cccc(Br)c12)[C@@H](c1ccccc1)N(C)C ZINC000505580675 914286196 /nfs/dbraw/zinc/28/61/96/914286196.db2.gz HPXALCGQAIGFJV-DJJJIMSYSA-N 0 3 400.320 4.352 20 0 HIADHN CN(C(=O)c1ccc(-c2n[nH]c(C3CC3)n2)cc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000483140524 898820609 /nfs/dbraw/zinc/82/06/09/898820609.db2.gz HRKYVASGRUSUJI-QFIPXVFZSA-N 0 3 415.541 4.086 20 0 HIADHN C[C@H](CN1CCN(c2ccccn2)CC1)N[C@@H](C)c1nc(-c2ccccc2)cs1 ZINC000483160101 898831279 /nfs/dbraw/zinc/83/12/79/898831279.db2.gz PZOSXLVKVNCZNY-MOPGFXCFSA-N 0 3 407.587 4.066 20 0 HIADHN Cc1ccc(CNC(=O)C2CCN(Cc3ccc(OCC4CC4)cc3)CC2)cc1F ZINC000483169993 898837866 /nfs/dbraw/zinc/83/78/66/898837866.db2.gz QGHSPRJMGWFTNF-UHFFFAOYSA-N 0 3 410.533 4.451 20 0 HIADHN CCc1ccc(Cl)c(CC)c1NC(=O)CCCN1C[C@@H](C)O[C@@]2(CCOC2)C1 ZINC000483172888 898840279 /nfs/dbraw/zinc/84/02/79/898840279.db2.gz LVJXYKZXLQWOJZ-ZHRRBRCNSA-N 0 3 408.970 4.063 20 0 HIADHN C[C@H](NC(=O)Cc1c[nH]c2cccc(Br)c12)[C@@H](c1ccccc1)N(C)C ZINC000505582945 914289207 /nfs/dbraw/zinc/28/92/07/914289207.db2.gz XIUDWMCMOHQPBE-QKKBWIMNSA-N 0 3 414.347 4.281 20 0 HIADHN Cc1c([C@H](C)NC2CCN(c3cccc(C)n3)CC2)nnn1-c1ccc(Cl)cc1 ZINC000483187481 898848118 /nfs/dbraw/zinc/84/81/18/898848118.db2.gz UXXMCOMPUOGXGA-INIZCTEOSA-N 0 3 410.953 4.252 20 0 HIADHN COc1cnccc1N1CCN(Cc2coc(-c3ccc(C(F)(F)F)cc3)n2)CC1 ZINC000483215017 898862868 /nfs/dbraw/zinc/86/28/68/898862868.db2.gz ZZHFWOVPZVMFPX-UHFFFAOYSA-N 0 3 418.419 4.086 20 0 HIADHN OC[C@H](NCCOc1ccccc1F)c1ccc(Br)cc1C(F)(F)F ZINC000483261392 898902310 /nfs/dbraw/zinc/90/23/10/898902310.db2.gz SFTJDXWRSQMNFS-HNNXBMFYSA-N 0 3 422.216 4.309 20 0 HIADHN CCCOc1ccc(C(C)(C)NCC(=O)NCCc2cccc3cccnc32)cc1 ZINC000483271409 898910643 /nfs/dbraw/zinc/91/06/43/898910643.db2.gz XSOZMFJRBGRJNN-UHFFFAOYSA-N 0 3 405.542 4.207 20 0 HIADHN C[C@H](c1cccc(N2CCCS2(=O)=O)c1)N(C)Cc1ccc(OCC2CC2)cc1 ZINC000483330435 898958019 /nfs/dbraw/zinc/95/80/19/898958019.db2.gz KXYPAJNYBLOYKZ-GOSISDBHSA-N 0 3 414.571 4.208 20 0 HIADHN COCc1nc(C(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)c(-c2ccccc2)s1 ZINC000505602527 914305902 /nfs/dbraw/zinc/30/59/02/914305902.db2.gz NCKYSIKLRORINP-HRAATJIYSA-N 0 3 409.555 4.378 20 0 HIADHN CS[C@@H]1CN(C(=O)c2csc(-c3ccccc3Cl)n2)C[C@@H]1N1CCCC1 ZINC000483392184 899027759 /nfs/dbraw/zinc/02/77/59/899027759.db2.gz HKFBFLAOKOVZME-DLBZAZTESA-N 0 3 407.992 4.115 20 0 HIADHN CS[C@@H]1CN(C(=O)CCC(=O)c2cc(Cl)sc2Cl)C[C@@H]1N1CCCC1 ZINC000483394629 899028686 /nfs/dbraw/zinc/02/86/86/899028686.db2.gz NURUZNRCVQNAOF-GXTWGEPZSA-N 0 3 421.415 4.056 20 0 HIADHN CS[C@H]1CN(C(=O)c2cc3cc(C)cc(Br)c3o2)C[C@H]1N1CCCC1 ZINC000483400074 899032523 /nfs/dbraw/zinc/03/25/23/899032523.db2.gz CNMXWAFWMLGSLF-WBVHZDCISA-N 0 3 423.376 4.156 20 0 HIADHN CS[C@@H]1CN(C(=O)c2sc(-c3ccccc3C)nc2C)C[C@@H]1N1CCCC1 ZINC000483409098 899040836 /nfs/dbraw/zinc/04/08/36/899040836.db2.gz OYHUFTBDJPTDSL-ZWKOTPCHSA-N 0 3 401.601 4.079 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2CN2CC[C@H](N3CCCC3=O)C2)c(C)c1 ZINC000483428470 899059499 /nfs/dbraw/zinc/05/94/99/899059499.db2.gz ODGBFPRTTIOHAD-QHCPKHFHSA-N 0 3 414.553 4.353 20 0 HIADHN COCCOc1ccccc1CN1CCC(c2noc(-c3ccccc3OC)n2)CC1 ZINC000483429154 899059536 /nfs/dbraw/zinc/05/95/36/899059536.db2.gz QDQASBMGDVWULT-UHFFFAOYSA-N 0 3 423.513 4.150 20 0 HIADHN CCCn1nc(C)c(CN2CCC(c3noc(-c4ccccc4OC)n3)CC2)c1C ZINC000483430467 899062027 /nfs/dbraw/zinc/06/20/27/899062027.db2.gz WOPZOYGMQGKPBA-UHFFFAOYSA-N 0 3 409.534 4.348 20 0 HIADHN C[C@@H](NC(=O)CCCc1nc(-c2ccc(F)cc2)no1)[C@H](c1ccccc1)N(C)C ZINC000505606418 914310523 /nfs/dbraw/zinc/31/05/23/914310523.db2.gz HIHRXNVGMOORLH-OPAMFIHVSA-N 0 3 410.493 4.006 20 0 HIADHN CO[C@@H](c1ccccc1Cl)[C@H](C)NC(=O)N(CCN(C)C)Cc1ccc(C)o1 ZINC000483436173 899069153 /nfs/dbraw/zinc/06/91/53/899069153.db2.gz ZCQZOCWTOMNHGP-OXJNMPFZSA-N 0 3 407.942 4.091 20 0 HIADHN O=C1CCCN1[C@@H]1CCN(Cc2ccc(-c3ccc(Br)cc3)s2)C1 ZINC000483440800 899074210 /nfs/dbraw/zinc/07/42/10/899074210.db2.gz RGSDTQKGEVZMKD-MRXNPFEDSA-N 0 3 405.361 4.374 20 0 HIADHN Cc1ccc(-c2nn(Cc3ccccc3)cc2CN2CC[C@@H](N3CCCC3=O)C2)cc1 ZINC000483440568 899074883 /nfs/dbraw/zinc/07/48/83/899074883.db2.gz OJOMQWSNVOATJP-XMMPIXPASA-N 0 3 414.553 4.104 20 0 HIADHN Cc1cccc(-c2nn(Cc3ccccc3)cc2CN2CC[C@H](N3CCCC3=O)C2)c1 ZINC000483442773 899077945 /nfs/dbraw/zinc/07/79/45/899077945.db2.gz VTDPCRMXDJEXDT-DEOSSOPVSA-N 0 3 414.553 4.104 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1c[nH]c(C(F)(F)F)c1 ZINC000483465896 899107060 /nfs/dbraw/zinc/10/70/60/899107060.db2.gz DOJBYDPDPSVRPP-QGZVFWFLSA-N 0 3 417.435 4.238 20 0 HIADHN Cc1ccc(C(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)cc1NC(=O)NC(C)(C)C ZINC000505627140 914327254 /nfs/dbraw/zinc/32/72/54/914327254.db2.gz BDHAVRCICVVXLN-UWJYYQICSA-N 0 3 410.562 4.336 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1ccc(OCC(F)F)cc1 ZINC000483595393 899245828 /nfs/dbraw/zinc/24/58/28/899245828.db2.gz AYFRNUXSPWMBSC-QGZVFWFLSA-N 0 3 403.473 4.459 20 0 HIADHN Fc1cc(OCCN2CCC(c3nc(-c4ccccn4)no3)CC2)ccc1Cl ZINC000483596665 899247171 /nfs/dbraw/zinc/24/71/71/899247171.db2.gz CTPZDCPUSXKIAV-UHFFFAOYSA-N 0 3 402.857 4.183 20 0 HIADHN Cc1ccc(NC(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)cc1C(=O)N1CCCCC1 ZINC000483633695 899287641 /nfs/dbraw/zinc/28/76/41/899287641.db2.gz OXCPJRKDNKYAAH-XXBNENTESA-N 0 3 422.573 4.434 20 0 HIADHN C[C@H](NC(=O)Cc1ccc(NC(=O)CC(C)(C)C)cc1)[C@@H](c1ccccc1)N(C)C ZINC000505634840 914334062 /nfs/dbraw/zinc/33/40/62/914334062.db2.gz RGECJWNBWNAJEA-UUOWRZLLSA-N 0 3 409.574 4.411 20 0 HIADHN CC[C@@H](C)n1ncc(NC(=O)Nc2ccc(CCN3CCSCC3)cc2)c1C ZINC000483690685 899349322 /nfs/dbraw/zinc/34/93/22/899349322.db2.gz YCEVNSLDPOCBSZ-MRXNPFEDSA-N 0 3 401.580 4.398 20 0 HIADHN Cc1ccc(NC(=O)CSc2nnc(-c3ccc(Cl)cc3)o2)c(CN(C)C)c1 ZINC000505640074 914341210 /nfs/dbraw/zinc/34/12/10/914341210.db2.gz VRDPBPIIGDNCNE-UHFFFAOYSA-N 0 3 416.934 4.491 20 0 HIADHN CN1CCN(c2ccc(C(F)(F)F)cc2CN[C@H]2CCCOc3ccccc32)CC1 ZINC000483724975 899384175 /nfs/dbraw/zinc/38/41/75/899384175.db2.gz CZDSQXQRTYNTSE-FQEVSTJZSA-N 0 3 419.491 4.461 20 0 HIADHN COc1cc(C(=O)Nc2ccc(C)cc2CN(C)C)ccc1OCc1cscn1 ZINC000505656569 914355017 /nfs/dbraw/zinc/35/50/17/914355017.db2.gz LFBUZVLQMUOBRW-UHFFFAOYSA-N 0 3 411.527 4.353 20 0 HIADHN Cc1cccc(Oc2cc(CN[C@H](C)c3ccc(-n4cnnn4)cc3)ccn2)c1C ZINC000483851743 899532694 /nfs/dbraw/zinc/53/26/94/899532694.db2.gz QLTQYYOEYKGKFA-GOSISDBHSA-N 0 3 400.486 4.317 20 0 HIADHN Cc1c([C@H](C)NC[C@@H](CCO)CC(C)C)nnn1-c1cccc(Br)c1 ZINC000483852341 899534533 /nfs/dbraw/zinc/53/45/33/899534533.db2.gz RGRKEUCDBXVTRB-HOCLYGCPSA-N 0 3 409.372 4.034 20 0 HIADHN Cc1c([C@@H](C)NC[C@H](CCO)CC(C)C)nnn1-c1cccc(Br)c1 ZINC000483852339 899534862 /nfs/dbraw/zinc/53/48/62/899534862.db2.gz RGRKEUCDBXVTRB-GDBMZVCRSA-N 0 3 409.372 4.034 20 0 HIADHN COCCOc1ccc([C@@H](C)NCc2cc(N(C)C)nc3ccccc23)cc1OC ZINC000483855496 899539399 /nfs/dbraw/zinc/53/93/99/899539399.db2.gz DZDAFDYYIPLNHZ-QGZVFWFLSA-N 0 3 409.530 4.185 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1nnc(/C=C\c2ccco2)s1 ZINC000484004498 899642207 /nfs/dbraw/zinc/64/22/07/899642207.db2.gz JFWGQNNDQOSWQH-QXPKXGMISA-N 0 3 423.542 4.430 20 0 HIADHN C[C@H](NCCC(=O)Nc1cccnc1)c1cccc(NC(=O)Cc2ccccc2F)c1 ZINC000484073197 899705944 /nfs/dbraw/zinc/70/59/44/899705944.db2.gz PGZWOWZZJWJYIC-KRWDZBQOSA-N 0 3 420.488 4.081 20 0 HIADHN COc1cccc([C@H](CNC(=O)Nc2cccc(N3CCCC3)c2)N2CCCC2)c1 ZINC000505682629 914374779 /nfs/dbraw/zinc/37/47/79/914374779.db2.gz GLPGVDQJZPKLJB-QHCPKHFHSA-N 0 3 408.546 4.254 20 0 HIADHN Cc1nn(C)c2nc(-c3cccs3)cc(C(=O)N3CCN(C4CCCCC4)CC3)c12 ZINC000484122114 899743432 /nfs/dbraw/zinc/74/34/32/899743432.db2.gz AUPDEMAFOIVEOT-UHFFFAOYSA-N 0 3 423.586 4.096 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N(C)[C@H](C)c1ccc(C(F)(F)F)cc1 ZINC000484166134 899785074 /nfs/dbraw/zinc/78/50/74/899785074.db2.gz QVNBXCDTDAPTFJ-OAHLLOKOSA-N 0 3 421.463 4.234 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N1CCCC[C@H]1c1cc2ccccc2[nH]1 ZINC000484184072 899800382 /nfs/dbraw/zinc/80/03/82/899800382.db2.gz BENZGWPIFKUEMS-QHCPKHFHSA-N 0 3 418.541 4.230 20 0 HIADHN CCC(CC)[C@@H](NC(=O)C(=O)Nc1cc(CN(C)C)ccc1C)c1cccs1 ZINC000484190766 899805006 /nfs/dbraw/zinc/80/50/06/899805006.db2.gz JUUBBKVLJAYIKP-HXUWFJFHSA-N 0 3 401.576 4.350 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N[C@@H](c1ccccc1)c1ccc(F)cc1 ZINC000484207829 899813750 /nfs/dbraw/zinc/81/37/50/899813750.db2.gz MOJYEPVBCFBMMX-QHCPKHFHSA-N 0 3 419.500 4.040 20 0 HIADHN Cc1cc(NC(=O)C(=O)Nc2ccc(C(C)C)cc2)cc(N2CCN(C(C)C)CC2)c1 ZINC000484212623 899815905 /nfs/dbraw/zinc/81/59/05/899815905.db2.gz XXLHAUPSSZDKFH-UHFFFAOYSA-N 0 3 422.573 4.226 20 0 HIADHN CSc1cccc(N(C(=O)[C@H]2Cc3cc(Cl)ccc3O2)C2CCN(C)CC2)c1 ZINC000484278609 899847304 /nfs/dbraw/zinc/84/73/04/899847304.db2.gz DVOUQSQPGCXRBA-OAQYLSRUSA-N 0 3 416.974 4.493 20 0 HIADHN CSc1cccc(N(C(=O)[C@H](C)Oc2ccc(F)cc2)C2CCN(C)CC2)c1 ZINC000484278640 899847615 /nfs/dbraw/zinc/84/76/15/899847615.db2.gz FBXJKCUNPRFYKB-INIZCTEOSA-N 0 3 402.535 4.442 20 0 HIADHN Cc1cc(N2CCC(N[C@H](C)c3ccc(F)cc3Br)CC2)nc(C)n1 ZINC000484280574 899849825 /nfs/dbraw/zinc/84/98/25/899849825.db2.gz YLCPKBDYCXIQKH-CYBMUJFWSA-N 0 3 407.331 4.315 20 0 HIADHN CSc1cccc(N(C(=O)Cc2ccc(NC(C)=O)cc2)C2CCN(C)CC2)c1 ZINC000484286556 899852918 /nfs/dbraw/zinc/85/29/18/899852918.db2.gz SXXMEENAKKJZDO-UHFFFAOYSA-N 0 3 411.571 4.037 20 0 HIADHN CC(C)(NC(=O)N[C@H]1CCN(Cc2ccccc2)C1)c1ccc(Br)cc1 ZINC000505698262 914386739 /nfs/dbraw/zinc/38/67/39/914386739.db2.gz UHQKLGZZJNCTSI-IBGZPJMESA-N 0 3 416.363 4.258 20 0 HIADHN COc1cc([C@H](C)N[C@H](C)c2ccc(-n3ccnc3C)cc2)ccc1S(C)(=O)=O ZINC000484306535 899866428 /nfs/dbraw/zinc/86/64/28/899866428.db2.gz XBKAJWCQGRQCKL-CVEARBPZSA-N 0 3 413.543 4.005 20 0 HIADHN Cc1cccn2c(=O)cc(CN[C@@](C)(c3ccc(Br)cc3)C(C)C)nc12 ZINC000484326449 899880901 /nfs/dbraw/zinc/88/09/01/899880901.db2.gz DJPMCXKXDKUEOS-OAQYLSRUSA-N 0 3 414.347 4.426 20 0 HIADHN Cc1cccc2nc(CN[C@](C)(c3ccc(Br)cc3)C(C)C)cc(=O)n12 ZINC000484340385 899891155 /nfs/dbraw/zinc/89/11/55/899891155.db2.gz MCDJGCNNPICXDC-NRFANRHFSA-N 0 3 414.347 4.426 20 0 HIADHN CCOc1ccc(OCC(=O)N(c2cccc(SC)c2)C2CCN(C)CC2)cc1 ZINC000484411409 899933261 /nfs/dbraw/zinc/93/32/61/899933261.db2.gz ZSUZJTNINIPBSA-UHFFFAOYSA-N 0 3 414.571 4.313 20 0 HIADHN COc1cccc([C@@H](CN2C(=O)[C@@H]3CC[C@@H](c4ccccc4)N3C2=O)N2CCCC2)c1 ZINC000484437642 899945287 /nfs/dbraw/zinc/94/52/87/899945287.db2.gz GZPRRCUEKAOENM-RJGXRXQPSA-N 0 3 419.525 4.000 20 0 HIADHN COCCC1(CN[C@H](C)c2nnn(-c3cccc(Br)c3)c2C)CCC1 ZINC000484522214 900010604 /nfs/dbraw/zinc/01/06/04/900010604.db2.gz RHWVKTAWLDDMLS-CQSZACIVSA-N 0 3 407.356 4.196 20 0 HIADHN O[C@H](CN[C@H](Cn1cnc2ccccc21)c1ccc(F)cc1)COc1ccccc1F ZINC000484549441 900029128 /nfs/dbraw/zinc/02/91/28/900029128.db2.gz VHEYWTZOBWCZAG-DENIHFKCSA-N 0 3 423.463 4.085 20 0 HIADHN COc1ccccc1NC(=O)CN[C@@H](c1ccc(F)c(F)c1)C(C)(C)N1CCCC1 ZINC000484549557 900030018 /nfs/dbraw/zinc/03/00/18/900030018.db2.gz XGDFQBICODLDKB-QFIPXVFZSA-N 0 3 417.500 4.117 20 0 HIADHN CCc1nnc(C2CCN(Cc3ncc(-c4ccc(Br)cc4)o3)CC2)[nH]1 ZINC000484740007 900163717 /nfs/dbraw/zinc/16/37/17/900163717.db2.gz UDMXDBSCOYFMPT-UHFFFAOYSA-N 0 3 416.323 4.164 20 0 HIADHN COc1ccc(-c2nc(CN[C@@]3(CO)C[C@@H](C)CC(C)(C)C3)cs2)c(OC)c1 ZINC000485066073 900390538 /nfs/dbraw/zinc/39/05/38/900390538.db2.gz FSXBEFLSXZZYSV-NYHFZMIOSA-N 0 3 404.576 4.494 20 0 HIADHN Cc1nc(-c2ccccc2Br)sc1[C@@H](C)N[C@H]1CCCN(C)C1=O ZINC000485258797 900543746 /nfs/dbraw/zinc/54/37/46/900543746.db2.gz IWOBVSOLZRPIKS-ABAIWWIYSA-N 0 3 408.365 4.152 20 0 HIADHN CCCCc1ccc(CC(=O)Nc2ccc(C(=O)NCCN3CCCC3)cc2)cc1 ZINC000485477761 900771040 /nfs/dbraw/zinc/77/10/40/900771040.db2.gz SPDHAAUZCORDOB-UHFFFAOYSA-N 0 3 407.558 4.036 20 0 HIADHN CC(C)Sc1ccc(C(=O)Nc2ccc(C(=O)NCCN3CCCC3)cc2)cc1 ZINC000485478693 900772723 /nfs/dbraw/zinc/77/27/23/900772723.db2.gz HPROXQJCHQMQSE-UHFFFAOYSA-N 0 3 411.571 4.265 20 0 HIADHN CSc1ccc(Cl)c(C(=O)Nc2ccc(C(=O)NCCN3CCCC3)cc2)c1 ZINC000485504675 900793910 /nfs/dbraw/zinc/79/39/10/900793910.db2.gz MLWJSHAZSOVZNJ-UHFFFAOYSA-N 0 3 417.962 4.140 20 0 HIADHN CC[C@H](C)[C@H](C(=O)Nc1ccc(C(=O)NCCN2CCCC2)cc1)c1ccccc1 ZINC000485521826 900805104 /nfs/dbraw/zinc/80/51/04/900805104.db2.gz RWYMJRRQDSIRHY-CVDCTZTESA-N 0 3 407.558 4.281 20 0 HIADHN CC(C)c1cccc(O[C@H](C)C(=O)Nc2ccc(C(=O)NCCN3CCCC3)cc2)c1 ZINC000485526534 900808320 /nfs/dbraw/zinc/80/83/20/900808320.db2.gz JZZNCTJSMZMZJM-LJQANCHMSA-N 0 3 423.557 4.042 20 0 HIADHN COc1cc(CNC(=O)c2ccccc2CN(C)C)ccc1OCc1ccccc1 ZINC000485538412 900815013 /nfs/dbraw/zinc/81/50/13/900815013.db2.gz ANOSNRZGRXMUPA-UHFFFAOYSA-N 0 3 404.510 4.266 20 0 HIADHN O=C(Cc1c(Cl)cccc1Cl)Nc1ccc(C(=O)NCCN2CCCC2)cc1 ZINC000485551160 900825906 /nfs/dbraw/zinc/82/59/06/900825906.db2.gz ZYZFYJXKUACHCP-UHFFFAOYSA-N 0 3 420.340 4.000 20 0 HIADHN CCOC(=O)c1cc(NC(=O)NC[C@@H](N[C@H](C)CC)c2ccco2)c(F)cc1C ZINC000485572291 900840248 /nfs/dbraw/zinc/84/02/48/900840248.db2.gz CJJVSGSGXVTJJJ-RDTXWAMCSA-N 0 3 405.470 4.155 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N3CCC(c4c(F)cccc4F)CC3)cc2)CC1 ZINC000485616986 900873535 /nfs/dbraw/zinc/87/35/35/900873535.db2.gz CHULUALLXDSFCX-UHFFFAOYSA-N 0 3 413.512 4.127 20 0 HIADHN O=C(COc1ccccc1CNC[C@@H](c1ccccc1)C(F)(F)F)N1CCCC1 ZINC000485726831 900978763 /nfs/dbraw/zinc/97/87/63/900978763.db2.gz TUYKXBOFNVGXHT-IBGZPJMESA-N 0 3 406.448 4.124 20 0 HIADHN C[C@@H]1C[C@@H](c2ccc(C(F)(F)F)cc2)N(CCn2cnc3ccccc3c2=O)C1 ZINC000485968638 901185821 /nfs/dbraw/zinc/18/58/21/901185821.db2.gz WCBWTNOKGXTGTL-QRWLVFNGSA-N 0 3 401.432 4.498 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(NC[C@@H](Cc3ccccc3)[NH+](CC)CC)nc2)n1 ZINC000486123951 901311115 /nfs/dbraw/zinc/31/11/15/901311115.db2.gz SMCPNBZBEZMAHY-OAQYLSRUSA-N 0 3 405.546 4.172 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)NC[C@H](c1ccccc1)C(F)(F)F ZINC000486140369 901327970 /nfs/dbraw/zinc/32/79/70/901327970.db2.gz WGVXXEJTARXRFQ-HXUWFJFHSA-N 0 3 405.464 4.080 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](NCCc2cccs2)c2ccc(F)c(F)c2)c1 ZINC000486149162 901337341 /nfs/dbraw/zinc/33/73/41/901337341.db2.gz QPNKLUFUJNTPOU-HXUWFJFHSA-N 0 3 407.507 4.352 20 0 HIADHN COc1ccc(NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)cc1Br ZINC000486154462 901342183 /nfs/dbraw/zinc/34/21/83/901342183.db2.gz ZVBQBPPPCIZNPP-OAHLLOKOSA-N 0 3 421.310 4.448 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)c1cc2c(s1)CCOC2 ZINC000486155239 901343700 /nfs/dbraw/zinc/34/37/00/901343700.db2.gz TZIYGWKKVKFSPK-UHFFFAOYSA-N 0 3 412.477 4.044 20 0 HIADHN Cc1ccc(-c2csc(NC(=O)[C@@H](C)N3CCN(C4CCCCC4)CC3)n2)cc1 ZINC000486253339 901436098 /nfs/dbraw/zinc/43/60/98/901436098.db2.gz PZTZKUSOMPVJOH-GOSISDBHSA-N 0 3 412.603 4.396 20 0 HIADHN O=C([C@H]1CCCN(Cc2cccc(F)c2)C1)N1CCC(Nc2ccc(F)cc2)CC1 ZINC000486274258 901458194 /nfs/dbraw/zinc/45/81/94/901458194.db2.gz XMMPDTGIBVWLTD-IBGZPJMESA-N 0 3 413.512 4.280 20 0 HIADHN Cc1nc2c(s1)CCC[C@H]2C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000486302671 901482224 /nfs/dbraw/zinc/48/22/24/901482224.db2.gz FJLOQFJSQRKCKL-RTBURBONSA-N 0 3 421.570 4.154 20 0 HIADHN CCOC(=O)c1sc2ccsc2c1CNC(=O)c1ccccc1CN(C)C ZINC000486304145 901483958 /nfs/dbraw/zinc/48/39/58/901483958.db2.gz IWURDCYQKSANTR-UHFFFAOYSA-N 0 3 402.541 4.131 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)NCc1csc(-c2ccccc2)n1 ZINC000486326567 901503129 /nfs/dbraw/zinc/50/31/29/901503129.db2.gz WSLAWFFFFUXGSK-UHFFFAOYSA-N 0 3 400.573 4.145 20 0 HIADHN Cc1nn(-c2ccccc2)cc1CN1C[C@H]2CCC[C@@]2(c2nc(CC3CC3)no2)C1 ZINC000486434486 901592836 /nfs/dbraw/zinc/59/28/36/901592836.db2.gz WWPULNHLRFDZMX-HYBUGGRVSA-N 0 3 403.530 4.070 20 0 HIADHN Fc1ccccc1-c1n[nH]cc1CN1C[C@H]2CCC[C@@]2(c2nc(CC3CC3)no2)C1 ZINC000486460262 901620294 /nfs/dbraw/zinc/62/02/94/901620294.db2.gz MEIIADIPMADPRI-UZUQRXQVSA-N 0 3 407.493 4.105 20 0 HIADHN CCCOc1cc(CN2C[C@H]3CCC[C@@]3(c3nc(CC4CC4)no3)C2)ccc1OC ZINC000486465650 901625904 /nfs/dbraw/zinc/62/59/04/901625904.db2.gz WCOKSUTYSWMCOO-NTKDMRAZSA-N 0 3 411.546 4.373 20 0 HIADHN c1[nH]c(-c2ccccc2)nc1CN1C[C@H]2CCC[C@@]2(c2nc(-c3cccnc3)no2)C1 ZINC000486464775 901626206 /nfs/dbraw/zinc/62/62/06/901626206.db2.gz UDYGGQMAFJSRFK-NTKDMRAZSA-N 0 3 412.497 4.075 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)N[C@@H](c2ccccc2)c2ccccn2)CC1 ZINC000486493351 901646154 /nfs/dbraw/zinc/64/61/54/901646154.db2.gz ZSMIXEKXJLVQRJ-VWLOTQADSA-N 0 3 414.553 4.477 20 0 HIADHN C[C@H](C(=O)Nc1cccc(CN2CCC(O)CC2)c1)c1cccc(Br)c1 ZINC000486565586 901711465 /nfs/dbraw/zinc/71/14/65/901711465.db2.gz MWAIOLHZTXZZOA-HNNXBMFYSA-N 0 3 417.347 4.148 20 0 HIADHN C[C@@H]1CN(C2CCOCC2)CCN1C(=O)Nc1cccc(OCCc2ccccc2)c1 ZINC000505920393 914566122 /nfs/dbraw/zinc/56/61/22/914566122.db2.gz BLIGBWVILYYUDA-HXUWFJFHSA-N 0 3 423.557 4.025 20 0 HIADHN Cc1nc(-c2ccc(C)cc2NC(=O)CN2CCC[C@H]2c2cc(C)ccc2C)n[nH]1 ZINC000486779090 901848488 /nfs/dbraw/zinc/84/84/88/901848488.db2.gz YSECLJNFYVCOHW-QFIPXVFZSA-N 0 3 403.530 4.481 20 0 HIADHN COCCSCCCN1CCc2cc(OC)c(OC)cc2[C@@H]1c1cccs1 ZINC000486811322 901868831 /nfs/dbraw/zinc/86/88/31/901868831.db2.gz LNPLFGIFILHLKY-OAQYLSRUSA-N 0 3 407.601 4.483 20 0 HIADHN COc1cc(-c2noc(CN3CC[C@@H](c4ccccc4)[C@@H]3C)n2)cc(OC)c1OC ZINC000486812243 901869967 /nfs/dbraw/zinc/86/99/67/901869967.db2.gz YMGPRPBWXXAICY-MAUKXSAKSA-N 0 3 409.486 4.140 20 0 HIADHN Cc1cc(C)c(C(=O)NCCCCN2CCN(c3cccc(C(F)(F)F)c3)CC2)o1 ZINC000486819447 901872829 /nfs/dbraw/zinc/87/28/29/901872829.db2.gz IYCXXQMOSMNXRN-UHFFFAOYSA-N 0 3 423.479 4.247 20 0 HIADHN Fc1cc(CN2C[C@H]3CCC[C@@]3(c3nc(-c4ccccc4)no3)C2)c2c(c1)COCO2 ZINC000486823469 901876215 /nfs/dbraw/zinc/87/62/15/901876215.db2.gz JUKCGANCYHMFCF-NTKDMRAZSA-N 0 3 421.472 4.296 20 0 HIADHN c1ccc(-c2noc([C@@]34CCC[C@@H]3CN(Cc3nc5cccnc5s3)C4)n2)cc1 ZINC000486827890 901879898 /nfs/dbraw/zinc/87/98/98/901879898.db2.gz ZJNAWMUQIWIQFY-OPAMFIHVSA-N 0 3 403.511 4.295 20 0 HIADHN CCN1CC[C@H](NC(=O)c2ccccc2CN(C)C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000486829807 901881186 /nfs/dbraw/zinc/88/11/86/901881186.db2.gz YDLWPDWQOHIGSH-LEWJYISDSA-N 0 3 403.929 4.106 20 0 HIADHN FC(F)C(F)(F)COCCN1C[C@H]2CCC[C@@]2(c2nc(-c3ccccc3)no2)C1 ZINC000486851953 901898372 /nfs/dbraw/zinc/89/83/72/901898372.db2.gz WPHSCPDFDWEQCA-DNVCBOLYSA-N 0 3 413.415 4.007 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)c1ccc(F)cc1OC(F)F ZINC000486875043 901920729 /nfs/dbraw/zinc/92/07/29/901920729.db2.gz PSCVHUXOXQMXLC-UHFFFAOYSA-N 0 3 410.461 4.271 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)c1ccc(-c2n[nH]c(C3CC3)n2)cc1 ZINC000486878173 901923419 /nfs/dbraw/zinc/92/34/19/901923419.db2.gz IDMMSFVTQDBEST-UHFFFAOYSA-N 0 3 423.948 4.207 20 0 HIADHN Cc1cc(F)ccc1CN(C)C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000486970813 901995553 /nfs/dbraw/zinc/99/55/53/901995553.db2.gz SJYHZQOFOHLOIT-UHFFFAOYSA-N 0 3 401.551 4.389 20 0 HIADHN CC(C)([C@@H](NC(=O)Cn1cc2ccccc2n1)c1ccc(F)c(F)c1)N1CCCC1 ZINC000487123613 902067347 /nfs/dbraw/zinc/06/73/47/902067347.db2.gz WIAJPNFDKQORCS-QFIPXVFZSA-N 0 3 412.484 4.046 20 0 HIADHN CCN1CCN(c2ccccc2CNc2ccc(C)c(C(=O)N(C)C(C)C)c2)CC1 ZINC000487187786 902092508 /nfs/dbraw/zinc/09/25/08/902092508.db2.gz NDMGSLBLTXRJJP-UHFFFAOYSA-N 0 3 408.590 4.229 20 0 HIADHN Cc1cccc(-c2nn(Cc3ccccc3)cc2CNCc2ccc(C)n(C)c2=O)c1 ZINC000487192309 902096110 /nfs/dbraw/zinc/09/61/10/902096110.db2.gz UBLRSBUXKQFNSS-UHFFFAOYSA-N 0 3 412.537 4.204 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2c(F)cc(F)cc2Br)[C@H]1c1ccccc1 ZINC000487193584 902096486 /nfs/dbraw/zinc/09/64/86/902096486.db2.gz HEEVNRBIBWUMBH-NVXWUHKLSA-N 0 3 410.262 4.294 20 0 HIADHN C[C@H](NCc1cnc(-c2ccco2)s1)c1cc(F)ccc1N1CCN(C)CC1 ZINC000487293322 902138707 /nfs/dbraw/zinc/13/87/07/902138707.db2.gz ZHJLZAVBGIQXLO-HNNXBMFYSA-N 0 3 400.523 4.145 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)[C@H]2CCO[C@@H]2c2ccnn2Cc2ccccc2)c1 ZINC000487307987 902145356 /nfs/dbraw/zinc/14/53/56/902145356.db2.gz HGAWXJUSHZCUMO-UPVQGACJSA-N 0 3 418.541 4.018 20 0 HIADHN Cc1nc(-c2ccc(C)cc2NC(=O)CN(C)[C@H](Cc2ccc(F)cc2)C(C)C)n[nH]1 ZINC000487392308 902177898 /nfs/dbraw/zinc/17/78/98/902177898.db2.gz KCBHPNWFVBJOPA-JOCHJYFZSA-N 0 3 423.536 4.365 20 0 HIADHN O=C(c1ccc(F)cc1OC(F)F)N1CCCN(CCCc2ccccc2)CC1 ZINC000487709248 902305446 /nfs/dbraw/zinc/30/54/46/902305446.db2.gz NXFFPHRIJKCCGD-UHFFFAOYSA-N 0 3 406.448 4.208 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@H](C)[C@H]1OCCc2sccc21)c1ccsc1 ZINC000487858817 902410478 /nfs/dbraw/zinc/41/04/78/902410478.db2.gz NNTPRYXLINLWCH-LSBZLQRGSA-N 0 3 407.605 4.194 20 0 HIADHN C[C@@H]1CN(C2CCOCC2)CCN1C(=O)Nc1ccccc1SC1CCCC1 ZINC000487875920 902421314 /nfs/dbraw/zinc/42/13/14/902421314.db2.gz MWXFUNBNFOVMHI-QGZVFWFLSA-N 0 3 403.592 4.438 20 0 HIADHN COc1cc(OC)cc(Oc2cccc(CNC(=O)c3ccccc3CN(C)C)c2)c1 ZINC000487943664 902474014 /nfs/dbraw/zinc/47/40/14/902474014.db2.gz ITLYOCFQHILAGT-UHFFFAOYSA-N 0 3 420.509 4.488 20 0 HIADHN Cc1cc(CN2CC[C@H]3[C@@H](CCC(=O)N3C3CC3)C2)nc(-c2ccc(Cl)cc2)n1 ZINC000487975854 902500474 /nfs/dbraw/zinc/50/04/74/902500474.db2.gz FNXNXRCZXBUNDK-UWJYYQICSA-N 0 3 410.949 4.081 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(Oc2cccnc2)cc1)C(=O)NC(=O)NC1CCCCC1 ZINC000487995799 902517731 /nfs/dbraw/zinc/51/77/31/902517731.db2.gz SBRKNXHQWCZZJY-IRXDYDNUSA-N 0 3 410.518 4.072 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)NCC(C)(C)N2CCc3ccccc3C2)cc1 ZINC000505970549 914633122 /nfs/dbraw/zinc/63/31/22/914633122.db2.gz JEFYVXKIWSGZNY-SFHVURJKSA-N 0 3 422.573 4.173 20 0 HIADHN COc1cc(OC)cc(Oc2ccc(CNC(=O)c3ccccc3CN(C)C)cc2)c1 ZINC000488340612 902775299 /nfs/dbraw/zinc/77/52/99/902775299.db2.gz SEMUXFRCGNTJPG-UHFFFAOYSA-N 0 3 420.509 4.488 20 0 HIADHN Cc1ccc(NC(=O)N2CCN(C3CCOCC3)C[C@H]2C)c(OCc2ccccc2)c1 ZINC000488372296 902785918 /nfs/dbraw/zinc/78/59/18/902785918.db2.gz TZWUZFPNPDAKFW-HXUWFJFHSA-N 0 3 423.557 4.291 20 0 HIADHN C[C@@H]1CN(C2CCOCC2)CCN1C(=O)Nc1ccc(OCC2CCCCC2)cc1 ZINC000488381847 902791387 /nfs/dbraw/zinc/79/13/87/902791387.db2.gz UBFRWKRONOIJLD-LJQANCHMSA-N 0 3 415.578 4.363 20 0 HIADHN O=C(NCCN1CCCC1)c1ccc(NC(=O)c2ccc3c4c(cccc42)CC3)cc1 ZINC000488465160 902838419 /nfs/dbraw/zinc/83/84/19/902838419.db2.gz XRZABVAJZAZPCK-UHFFFAOYSA-N 0 3 413.521 4.016 20 0 HIADHN C[C@H]1CN(C2CCOCC2)CCN1C(=O)Nc1ccc2nc(C(C)(C)C)sc2c1 ZINC000488524808 902869162 /nfs/dbraw/zinc/86/91/62/902869162.db2.gz XFXUMCKWPIYPAZ-HNNXBMFYSA-N 0 3 416.591 4.311 20 0 HIADHN CN(CCCc1cc(-c2cccc(F)c2)n[nH]1)[C@@H]1CCN(c2ccccc2F)C1=O ZINC000488659623 902924457 /nfs/dbraw/zinc/92/44/57/902924457.db2.gz ZMZRNTLZSWFOSP-JOCHJYFZSA-N 0 3 410.468 4.025 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)c2ccc(Br)c(F)c2)CC1 ZINC000488661574 902925777 /nfs/dbraw/zinc/92/57/77/902925777.db2.gz AGIXLACFOSOADL-UHFFFAOYSA-N 0 3 405.311 4.325 20 0 HIADHN O=C(Cc1coc2cc3c(cc12)CCC3)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000488674979 902935057 /nfs/dbraw/zinc/93/50/57/902935057.db2.gz IJHSNWRNLTVGPU-UHFFFAOYSA-N 0 3 404.510 4.059 20 0 HIADHN Cc1nc(-c2ccsc2)ccc1C(=O)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000488675268 902936027 /nfs/dbraw/zinc/93/60/27/902936027.db2.gz KVCYDAQVWRLRKY-UHFFFAOYSA-N 0 3 407.539 4.328 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)c2cnn(-c3cccc(Cl)c3)c2)CC1 ZINC000488681255 902941817 /nfs/dbraw/zinc/94/18/17/902941817.db2.gz TZSJJCFQZOBISS-UHFFFAOYSA-N 0 3 408.933 4.262 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)c1cccnc1Nc1ccccc1F ZINC000488699813 902950905 /nfs/dbraw/zinc/95/09/05/902950905.db2.gz IQUSGLCZIDOMQD-UHFFFAOYSA-N 0 3 420.488 4.173 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)Nc1ccc(F)cc1OC1CCOCC1)c1ccco1 ZINC000488711482 902959951 /nfs/dbraw/zinc/95/99/51/902959951.db2.gz WQPDLVPVBTZSRW-BEFAXECRSA-N 0 3 419.497 4.227 20 0 HIADHN O=C(CN1CCC(CCCN2CCOCC2)CC1)Nc1ccccc1-c1ccccc1 ZINC000506009103 914681712 /nfs/dbraw/zinc/68/17/12/914681712.db2.gz TUMDWLBPKGBKFW-UHFFFAOYSA-N 0 3 421.585 4.117 20 0 HIADHN CCN(CC)CCN(Cc1cccs1)S(=O)(=O)c1cc(F)ccc1Cl ZINC000488938597 903087337 /nfs/dbraw/zinc/08/73/37/903087337.db2.gz FYLMPGYVYRIHHR-UHFFFAOYSA-N 0 3 404.960 4.073 20 0 HIADHN CC(C)(C)OC1CC(CC(=O)NC2CCN(CCOc3ccc(Cl)cc3)CC2)C1 ZINC000488945207 903092992 /nfs/dbraw/zinc/09/29/92/903092992.db2.gz BVIYAQMQDFNCGK-UHFFFAOYSA-N 0 3 422.997 4.283 20 0 HIADHN COc1cc(NC(=O)N(Cc2ccccc2)C2CCN(C)CC2)c(OC)cc1Cl ZINC000489010328 903120706 /nfs/dbraw/zinc/12/07/06/903120706.db2.gz JJHMKSUJBBGJRX-UHFFFAOYSA-N 0 3 417.937 4.486 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)Nc1ccc(Cl)c(Cl)c1 ZINC000489049450 903153954 /nfs/dbraw/zinc/15/39/54/903153954.db2.gz VUMSBJWOANPXOO-UHFFFAOYSA-N 0 3 408.329 4.272 20 0 HIADHN FC(F)(F)c1ccc2oc(CN3CCC(CCCN4CCOCC4)CC3)nc2c1 ZINC000506017432 914693063 /nfs/dbraw/zinc/69/30/63/914693063.db2.gz LIURNGUARAALCM-UHFFFAOYSA-N 0 3 411.468 4.171 20 0 HIADHN O[C@@H](COc1cccc2[nH]ccc21)CN1CCC[C@H](c2nc3c(s2)CCCC3)C1 ZINC000489108091 903202016 /nfs/dbraw/zinc/20/20/16/903202016.db2.gz ZBWXDZBRWHWCFT-DLBZAZTESA-N 0 3 411.571 4.123 20 0 HIADHN Cc1ccc(NC(=O)N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)cc1C(=O)N(C)C(C)C ZINC000489126711 903216948 /nfs/dbraw/zinc/21/69/48/903216948.db2.gz IKHKQGVECFNSFK-KNQAVFIVSA-N 0 3 422.573 4.260 20 0 HIADHN COC(=O)c1c(CN2CC[C@](O)(C3CC3)C2)nc2ccccc2c1-c1ccccc1 ZINC000489162621 903238426 /nfs/dbraw/zinc/23/84/26/903238426.db2.gz SIVSFUZJKJYHSA-RUZDIDTESA-N 0 3 402.494 4.035 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1ccc(Oc2cccc(F)c2F)nc1 ZINC000489255568 903292225 /nfs/dbraw/zinc/29/22/25/903292225.db2.gz RBDXHBXJWFENTO-UHFFFAOYSA-N 0 3 416.428 4.341 20 0 HIADHN COc1ccc(OC)c([C@H](C)NC(=O)N(Cc2ccccc2)C2CCN(C)CC2)c1 ZINC000489321378 903329698 /nfs/dbraw/zinc/32/96/98/903329698.db2.gz FHEZURONBQSZFK-SFHVURJKSA-N 0 3 411.546 4.071 20 0 HIADHN COc1ccc(CC[C@H](C)NC(=O)N(Cc2ccccc2)C2CCN(C)CC2)cc1 ZINC000489368219 903348894 /nfs/dbraw/zinc/34/88/94/903348894.db2.gz ZCHPHCRPOQKZJX-FQEVSTJZSA-N 0 3 409.574 4.322 20 0 HIADHN Cc1cc(-c2noc([C@H](C)N3CCC(CCCN4CCOCC4)CC3)n2)ccc1F ZINC000506027518 914710201 /nfs/dbraw/zinc/71/02/01/914710201.db2.gz MAQNWFHQPOIEOX-SFHVURJKSA-N 0 3 416.541 4.070 20 0 HIADHN Cc1cccc(C(C)C)c1NC(=O)[C@H](C)N1CCC(CCCN2CCOCC2)CC1 ZINC000506028527 914710944 /nfs/dbraw/zinc/71/09/44/914710944.db2.gz VETMOBLGSQPGKG-NRFANRHFSA-N 0 3 415.622 4.270 20 0 HIADHN CC[C@@H](CNC(=O)N(Cc1ccccc1)C1CCN(C)CC1)Oc1ccccc1F ZINC000489440725 903385146 /nfs/dbraw/zinc/38/51/46/903385146.db2.gz CGZPHAGVFGOAJD-NRFANRHFSA-N 0 3 413.537 4.289 20 0 HIADHN Cc1nc(C(F)(F)F)ccc1C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000489475736 903406796 /nfs/dbraw/zinc/40/67/96/903406796.db2.gz DALMTLIKCAAYKE-UHFFFAOYSA-N 0 3 409.477 4.252 20 0 HIADHN C[C@H](N[C@@H](Cc1ccccc1)[C@@H](O)C(F)F)c1ccc(Br)c(F)c1 ZINC000489543417 903454263 /nfs/dbraw/zinc/45/42/63/903454263.db2.gz GUQAQHRVLNYKPV-MZPVMMEZSA-N 0 3 402.254 4.476 20 0 HIADHN Cc1cc(Cl)c2c(c1)[C@@H](NCc1ccc(CN3CCOCC3)cc1)CCCO2 ZINC000489560108 903463841 /nfs/dbraw/zinc/46/38/41/903463841.db2.gz LUJPASZBZVMEPG-QFIPXVFZSA-N 0 3 400.950 4.484 20 0 HIADHN Cc1cc(Cl)c2c(c1)[C@H](NCCCS(=O)(=O)Cc1ccccc1)CCCO2 ZINC000489632388 903508120 /nfs/dbraw/zinc/50/81/20/903508120.db2.gz QAUINUACCFIVSS-HXUWFJFHSA-N 0 3 407.963 4.457 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)Nc1cc(-c2ccsc2)nn1C ZINC000489699004 903546612 /nfs/dbraw/zinc/54/66/12/903546612.db2.gz LOCYJPZDYUDACN-UHFFFAOYSA-N 0 3 419.501 4.023 20 0 HIADHN CC(C)[C@@H](c1ccccc1)N(C)C(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000489719625 903557587 /nfs/dbraw/zinc/55/75/87/903557587.db2.gz RNCJRQOQPZQRQV-DEOSSOPVSA-N 0 3 409.574 4.182 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)CCCc2nc(-c3cccs3)no2)N2CCCC2)cc1 ZINC000489720439 903559134 /nfs/dbraw/zinc/55/91/34/903559134.db2.gz XILDWPRESUVPEN-LJQANCHMSA-N 0 3 424.570 4.383 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)N1CCC[C@H]1CC1CCCCC1 ZINC000489788331 903598598 /nfs/dbraw/zinc/59/85/98/903598598.db2.gz HIWJHCNZLPOBQA-QHCPKHFHSA-N 0 3 413.606 4.288 20 0 HIADHN Cc1ccccc1[C@@H]1C[C@@H](C)N(C(=O)NCc2ccccc2CN2CCC(O)CC2)C1 ZINC000489791346 903601187 /nfs/dbraw/zinc/60/11/87/903601187.db2.gz ZGUYYVAGLAMJHK-NFBKMPQASA-N 0 3 421.585 4.039 20 0 HIADHN CC(C)(C)[C@H]1CCCN(C(=O)NCc2ccccc2CN2CCC(O)CC2)CC1 ZINC000489807988 903607588 /nfs/dbraw/zinc/60/75/88/903607588.db2.gz MSJMFVQEYBVLGL-NRFANRHFSA-N 0 3 401.595 4.001 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)NCc2ccnc(OC3CCCC3)c2)CC1 ZINC000489917603 903673860 /nfs/dbraw/zinc/67/38/60/903673860.db2.gz XTHXUAYEXKAFAB-UHFFFAOYSA-N 0 3 422.573 4.209 20 0 HIADHN Cc1csc(C(=O)Nc2cccc(CN3CCC(O)CC3)c2)c1Br ZINC000490005552 903721727 /nfs/dbraw/zinc/72/17/27/903721727.db2.gz KQIWAMAOUWLRSP-UHFFFAOYSA-N 0 3 409.349 4.028 20 0 HIADHN COc1cc(-c2noc(CN3C[C@@H](c4ccc(C)cc4)C[C@@H]3C)n2)cc(OC)c1OC ZINC000490053650 903746133 /nfs/dbraw/zinc/74/61/33/903746133.db2.gz KWRKROATNWZABB-LPHOPBHVSA-N 0 3 423.513 4.449 20 0 HIADHN Cc1ccc([C@H]2C[C@H](C)N(CC(=O)NCC3(c4ccccc4)CCOCC3)C2)cc1 ZINC000490060839 903749814 /nfs/dbraw/zinc/74/98/14/903749814.db2.gz JHTYRWDTZKWTML-GMAHTHKFSA-N 0 3 406.570 4.037 20 0 HIADHN Cc1nc(-c2ccc(C)cc2NC(=O)CN2C[C@H](c3ccc(C)cc3)C[C@H]2C)n[nH]1 ZINC000490063431 903753736 /nfs/dbraw/zinc/75/37/36/903753736.db2.gz ZQSMLUZIEKTVSP-YLJYHZDGSA-N 0 3 403.530 4.213 20 0 HIADHN Cc1ccc([C@H](NCCN2CCCC[C@H]2C)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000490168376 903806757 /nfs/dbraw/zinc/80/67/57/903806757.db2.gz UVUVFDRDPMREGO-HYBUGGRVSA-N 0 3 414.615 4.260 20 0 HIADHN Cc1ccc(NC(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)cc1C(=O)N1CCCCC1 ZINC000490207632 903828831 /nfs/dbraw/zinc/82/88/31/903828831.db2.gz ZQJMUNLYQKSFJW-PKTZIBPZSA-N 0 3 420.557 4.188 20 0 HIADHN O=C(N[C@@H](c1ccccc1)c1ccncc1)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000490238591 903846412 /nfs/dbraw/zinc/84/64/12/903846412.db2.gz FJKFVWNLMFBSEH-ZEQRLZLVSA-N 0 3 400.526 4.135 20 0 HIADHN CCNC(=O)Nc1ccc(C)c(NC(=O)NC[C@@H](c2ccsc2)N(CC)CC)c1 ZINC000490336387 903927117 /nfs/dbraw/zinc/92/71/17/903927117.db2.gz KJJOJODEALARIQ-IBGZPJMESA-N 0 3 417.579 4.403 20 0 HIADHN CN(C)[C@H](CNC(=O)N1CCCC[C@@H]1c1nc(-c2ccccc2)no1)c1ccccc1 ZINC000490360153 903952301 /nfs/dbraw/zinc/95/23/01/903952301.db2.gz BVZLUJWKKHRAGS-NHCUHLMSSA-N 0 3 419.529 4.276 20 0 HIADHN O=C(Nc1cc(F)cc(Br)c1F)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000490473436 904028849 /nfs/dbraw/zinc/02/88/49/904028849.db2.gz WIJSBZFEJWIXRC-AWEZNQCLSA-N 0 3 410.262 4.123 20 0 HIADHN C[C@@]1(CNC(=O)CCC(=O)c2ccc(F)cc2F)CCCN1Cc1ccccc1 ZINC000490515340 904064214 /nfs/dbraw/zinc/06/42/14/904064214.db2.gz VNEAQCRXZFFAMQ-QHCPKHFHSA-N 0 3 400.469 4.099 20 0 HIADHN COc1ccccc1-c1ncc(CN[C@H]2CCN(c3cc(Cl)ccc3OC)C2)cn1 ZINC000490750635 904207542 /nfs/dbraw/zinc/20/75/42/904207542.db2.gz JQTJYDJAMZJPGP-SFHVURJKSA-N 0 3 424.932 4.183 20 0 HIADHN CN(C)C[C@@H](NC(=O)N[C@H](c1c[nH]c2ccccc21)C(F)(F)F)c1ccccc1 ZINC000490787538 904233585 /nfs/dbraw/zinc/23/35/85/904233585.db2.gz AHKUWWDVYVDAOP-RTBURBONSA-N 0 3 404.436 4.373 20 0 HIADHN O=C(N[C@H](c1c[nH]c2ccccc21)C(F)(F)F)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000490794646 904242747 /nfs/dbraw/zinc/24/27/47/904242747.db2.gz JPPVLXJHAIFHEO-OXJNMPFZSA-N 0 3 416.447 4.345 20 0 HIADHN COc1ccccc1-c1ncc(CNCCOc2ccccc2C(F)(F)F)cn1 ZINC000490896715 904306960 /nfs/dbraw/zinc/30/69/60/904306960.db2.gz BWJUSDHSNWWKMP-UHFFFAOYSA-N 0 3 403.404 4.340 20 0 HIADHN CCOc1cc(CN2CCC(C(=O)N3CCCCC3)CC2)ccc1OCC(C)C ZINC000506101133 914804172 /nfs/dbraw/zinc/80/41/72/914804172.db2.gz NCMRCAQCKNDAOX-UHFFFAOYSA-N 0 3 402.579 4.345 20 0 HIADHN CCOc1ccc([C@H](N[C@@H](C)CN2CCN(C)CC2)c2ccccc2Cl)cc1 ZINC000491024570 904375630 /nfs/dbraw/zinc/37/56/30/904375630.db2.gz UEFHSIQMLYSHPN-MBSDFSHPSA-N 0 3 401.982 4.054 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)NCc2cccc(NC(=O)[C@@H](C)CC)c2)N(C)C)cc1 ZINC000506103862 914804785 /nfs/dbraw/zinc/80/47/85/914804785.db2.gz CYYOLKVMOSQKJU-FDDCHVKYSA-N 0 3 424.589 4.336 20 0 HIADHN COc1cccc([C@@H](CNC(=O)NCCc2ccc(Cl)s2)N2CCCC2)c1 ZINC000506109082 914806858 /nfs/dbraw/zinc/80/68/58/914806858.db2.gz XSAICKRKRXWHDC-GOSISDBHSA-N 0 3 407.967 4.089 20 0 HIADHN Cc1ccc(NC(=O)c2ccc(CN(C)C)cc2)cc1S(=O)(=O)C1CCCC1 ZINC000491114194 904437405 /nfs/dbraw/zinc/43/74/05/904437405.db2.gz VETAMYUNBHSYKU-UHFFFAOYSA-N 0 3 400.544 4.025 20 0 HIADHN COc1ccccc1NC(=O)c1ccc(NC(=O)[C@@H](C)N2CC[C@@H](C3CC3)C2)cc1 ZINC000491218184 904487982 /nfs/dbraw/zinc/48/79/82/904487982.db2.gz ONDLQVKOGBASAP-VQIMIIECSA-N 0 3 407.514 4.006 20 0 HIADHN Cc1ccc([C@H](NC2CCN(C3CC3)CC2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000491270913 904513297 /nfs/dbraw/zinc/51/32/97/904513297.db2.gz LCRNNEQRVNAOFU-XMMPIXPASA-N 0 3 412.599 4.013 20 0 HIADHN CC[C@H](C)[C@H](NC(=O)N1CC[C@@H](N2CCN(C)CC2)[C@@H](C)C1)c1ccc(Cl)cc1 ZINC000491313027 904531209 /nfs/dbraw/zinc/53/12/09/904531209.db2.gz RROISDKEDITUEV-HXHBTQRASA-N 0 3 421.029 4.095 20 0 HIADHN CC(C)Oc1ccc([C@H](CN2C(=O)CN([C@@H](C)c3ccccc3)C2=O)N(C)C)cc1 ZINC000491313678 904532970 /nfs/dbraw/zinc/53/29/70/904532970.db2.gz BBEZBOCSPWWHTK-AVRDEDQJSA-N 0 3 409.530 4.102 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)Nc1cc(F)c(OC(F)F)cc1F ZINC000491319477 904535024 /nfs/dbraw/zinc/53/50/24/904535024.db2.gz DLIDOXRVSSTAJK-UHFFFAOYSA-N 0 3 417.378 4.301 20 0 HIADHN Cc1ccc([C@H](NCCN2CCCCCC2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000491399890 904579734 /nfs/dbraw/zinc/57/97/34/904579734.db2.gz YJJKFABPOSFZKZ-XMMPIXPASA-N 0 3 414.615 4.262 20 0 HIADHN CCCn1nc(C)c(CN2CCC[C@H](c3nnc4ccc(C(F)(F)F)cn43)C2)c1C ZINC000506147500 914824717 /nfs/dbraw/zinc/82/47/17/914824717.db2.gz JNEGUHXTCLSPHD-INIZCTEOSA-N 0 3 420.483 4.351 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Nc1cc(F)c(OC(F)F)cc1F ZINC000491421661 904586212 /nfs/dbraw/zinc/58/62/12/904586212.db2.gz ZBTPQHAUHCQWDB-SJKOYZFVSA-N 0 3 411.399 4.208 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)Nc2ccc(C(=O)NC3CCCC3)cc2)c1 ZINC000491551272 904645185 /nfs/dbraw/zinc/64/51/85/904645185.db2.gz OCJKNSXTELTHFL-UHFFFAOYSA-N 0 3 422.573 4.263 20 0 HIADHN COc1ccc(NC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)cc1OC ZINC000491551769 904645304 /nfs/dbraw/zinc/64/53/04/904645304.db2.gz AVZOJDGKVXDVRY-FQEVSTJZSA-N 0 3 408.420 4.097 20 0 HIADHN O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCC[C@H](c2nc3ccc(F)cc3o2)C1 ZINC000506166773 914830685 /nfs/dbraw/zinc/83/06/85/914830685.db2.gz QDLGFTWSENALSW-ICSRJNTNSA-N 0 3 422.504 4.130 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(S(=O)(=O)N(C)C)cc1)c1cc(Br)cs1 ZINC000491846014 904710883 /nfs/dbraw/zinc/71/08/83/904710883.db2.gz HNNJQZDFNIHUSH-RYUDHWBXSA-N 0 3 417.394 4.173 20 0 HIADHN Cc1nn(-c2ccc(Cl)c(Cl)c2)c(NC(=O)N2CC[C@@H]3CCN(C)C[C@@H]32)c1C ZINC000492019233 904758906 /nfs/dbraw/zinc/75/89/06/904758906.db2.gz GYHGOSOMKHVXBW-KSSFIOAISA-N 0 3 422.360 4.354 20 0 HIADHN Cn1cc([C@H](NCC2(N3CCOC(C)(C)C3)CCCCC2)c2cccc(F)c2)cn1 ZINC000492207135 904815247 /nfs/dbraw/zinc/81/52/47/904815247.db2.gz CXUQROYOVGMVRI-JOCHJYFZSA-N 0 3 414.569 4.052 20 0 HIADHN COC(=O)c1scc(-c2ccc(C)cc2)c1NC(=O)N1CCN(C)CC[C@H]1C ZINC000492287413 904828932 /nfs/dbraw/zinc/82/89/32/904828932.db2.gz DEXQEIBQNJECBE-OAHLLOKOSA-N 0 3 401.532 4.068 20 0 HIADHN FC(F)(F)Cn1ccnc1CNCC1(c2ccccc2Br)CCC1 ZINC000492490671 904859514 /nfs/dbraw/zinc/85/95/14/904859514.db2.gz ZGPBIVRLYWHGRY-UHFFFAOYSA-N 0 3 402.258 4.419 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)C(=O)Nc1cnc2ccccc2c1)c1ccc(Cl)cc1 ZINC000506223609 914850979 /nfs/dbraw/zinc/85/09/79/914850979.db2.gz MQUJTEMHPZBIJZ-NRFANRHFSA-N 0 3 424.932 4.026 20 0 HIADHN C[C@H](CCCC(F)(F)F)N[C@@H](C(=O)NCc1ccc2c(c1)OCO2)c1ccccc1 ZINC000492630410 904879835 /nfs/dbraw/zinc/87/98/35/904879835.db2.gz MSAKUKMYJOKALO-FOIQADDNSA-N 0 3 422.447 4.484 20 0 HIADHN CO[C@@H]1C[C@H](N[C@@H](c2cccc(S(C)(=O)=O)c2)c2ccc(C)cc2C)C1(C)C ZINC000493009053 904986500 /nfs/dbraw/zinc/98/65/00/904986500.db2.gz MBKJKAAOQUXQIZ-BDTNDASRSA-N 0 3 401.572 4.199 20 0 HIADHN Cc1ccc([C@@H](NCC2(O)CCCCCC2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000493081624 905013932 /nfs/dbraw/zinc/01/39/32/905013932.db2.gz RSRAZERCPVCMCF-QHCPKHFHSA-N 0 3 415.599 4.471 20 0 HIADHN CC(C)N1CCC(N[C@H](c2ccc(Cl)cc2)c2cccc(S(C)(=O)=O)c2)CC1 ZINC000493130006 905026788 /nfs/dbraw/zinc/02/67/88/905026788.db2.gz MYIRYFUVGLTDRI-JOCHJYFZSA-N 0 3 421.006 4.295 20 0 HIADHN CCc1ccc([C@@H](NC[C@H](CO)c2ccccc2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000493134343 905028534 /nfs/dbraw/zinc/02/85/34/905028534.db2.gz YYUKQBRNHQTFNQ-ILBGXUMGSA-N 0 3 423.578 4.108 20 0 HIADHN Cc1ccc(F)c(C(=O)NC[C@H](c2ccccc2)N2CCCC2)c1Br ZINC000493147421 905031328 /nfs/dbraw/zinc/03/13/28/905031328.db2.gz CBVFCYOQDZYGET-QGZVFWFLSA-N 0 3 405.311 4.464 20 0 HIADHN Cc1ccc(F)c(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)c1Br ZINC000493147420 905032029 /nfs/dbraw/zinc/03/20/29/905032029.db2.gz CBVFCYOQDZYGET-KRWDZBQOSA-N 0 3 405.311 4.464 20 0 HIADHN Fc1ccc(Br)cc1[C@H](NCCCO[C@@H]1CCOC1)c1ccccc1 ZINC000493249576 905067528 /nfs/dbraw/zinc/06/75/28/905067528.db2.gz QJCLXDCUDUMARB-YLJYHZDGSA-N 0 3 408.311 4.463 20 0 HIADHN CCO[C@H](CCN[C@H](c1ccc(F)cc1)c1cccc(S(C)(=O)=O)c1)C(C)C ZINC000493308848 905083698 /nfs/dbraw/zinc/08/36/98/905083698.db2.gz ZXQYWZRSTADIQK-FGZHOGPDSA-N 0 3 407.551 4.359 20 0 HIADHN COC(=O)c1cc(NC(=O)N(Cc2ccccc2)C2CCN(C)CC2)cc(C)c1C ZINC000493320526 905085078 /nfs/dbraw/zinc/08/50/78/905085078.db2.gz LUKLZWDPNIJMLK-UHFFFAOYSA-N 0 3 409.530 4.218 20 0 HIADHN Cc1ccc(NC(=O)[C@H](C)N[C@@H]2CCO[C@H]2c2ccccc2)c(Br)c1 ZINC000493341543 905090751 /nfs/dbraw/zinc/09/07/51/905090751.db2.gz YVZBANQZVXWCKV-KYNGSXCRSA-N 0 3 403.320 4.204 20 0 HIADHN COc1cc(-c2nnc(CN[C@H]3CCC[C@H]3Cc3ccccc3)o2)cc(OC)c1OC ZINC000493525513 905149622 /nfs/dbraw/zinc/14/96/22/905149622.db2.gz LZTJEWIGSHPRBV-HKUYNNGSSA-N 0 3 423.513 4.263 20 0 HIADHN COc1cc(-c2nnc(CN[C@H]3CCC[C@@H]3Cc3ccccc3)o2)cc(OC)c1OC ZINC000493525529 905150446 /nfs/dbraw/zinc/15/04/46/905150446.db2.gz LZTJEWIGSHPRBV-MJGOQNOKSA-N 0 3 423.513 4.263 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)c3cc(-c4ccc(F)cc4)nc4onc(C5CC5)c43)[C@@H]2C1 ZINC000493559365 905160710 /nfs/dbraw/zinc/16/07/10/905160710.db2.gz VWKKUUYJALJHLI-MGPUTAFESA-N 0 3 420.488 4.073 20 0 HIADHN COc1ccc([C@H](CNC(=O)CCOc2ccc(F)cc2Cl)N2CCCC2)cc1 ZINC000493638316 905179890 /nfs/dbraw/zinc/17/98/90/905179890.db2.gz RNPWDFIHZODXSY-FQEVSTJZSA-N 0 3 420.912 4.210 20 0 HIADHN O=C(Nc1ccc(Br)cn1)C1CCN(CCc2ccc(F)c(F)c2)CC1 ZINC000493733390 905206842 /nfs/dbraw/zinc/20/68/42/905206842.db2.gz BGOAGEUCWRTZAW-UHFFFAOYSA-N 0 3 424.289 4.016 20 0 HIADHN COc1ccccc1OCCN1CCC[C@H](c2nnc3ccc(C(F)(F)F)cn32)C1 ZINC000493765884 905213784 /nfs/dbraw/zinc/21/37/84/905213784.db2.gz IELKLRVNUPAUNE-HNNXBMFYSA-N 0 3 420.435 4.015 20 0 HIADHN COc1cc([C@@H](C)N[C@H]2CCc3cc(Br)cc(C)c32)ccc1OCCO ZINC000493819884 905226650 /nfs/dbraw/zinc/22/66/50/905226650.db2.gz NVRFLFLZOLTKNH-KDOFPFPSSA-N 0 3 420.347 4.475 20 0 HIADHN Cc1ccc([C@@H](N[C@H]2CCc3ccccc3OC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000493891074 905248574 /nfs/dbraw/zinc/24/85/74/905248574.db2.gz JVOZOAYIZPJABM-WIOPSUGQSA-N 0 3 421.562 4.471 20 0 HIADHN Fc1ccc([C@H]2OCC[C@@H]2NCc2nc3ccc(Br)cc3[nH]2)cc1F ZINC000493952449 905301752 /nfs/dbraw/zinc/30/17/52/905301752.db2.gz KVOHSPAJQPLKRT-MAUKXSAKSA-N 0 3 408.246 4.223 20 0 HIADHN Cc1cc(NC(=O)N2CC[C@@H]3CCN(C)C[C@H]32)nn1-c1ccc(Cl)cc1Cl ZINC000493982252 905326396 /nfs/dbraw/zinc/32/63/96/905326396.db2.gz IVWYISRGFNNYBG-SUMWQHHRSA-N 0 3 408.333 4.045 20 0 HIADHN CC1(CN[C@H](c2ccc(Cl)cc2)c2cccc(S(C)(=O)=O)c2)CCOCC1 ZINC000493983430 905327475 /nfs/dbraw/zinc/32/74/75/905327475.db2.gz NMSMEXQJOOSQHS-HXUWFJFHSA-N 0 3 407.963 4.239 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](N[C@H]2CCOC3(CCC3)C2)c2ccc(F)cc2)c1 ZINC000494003656 905343696 /nfs/dbraw/zinc/34/36/96/905343696.db2.gz KRVXOMFXHMODIY-FPOVZHCZSA-N 0 3 403.519 4.010 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](N[C@H]2CCOC3(CCCC3)C2)c2ccc(F)cc2)c1 ZINC000494003756 905343983 /nfs/dbraw/zinc/34/39/83/905343983.db2.gz LYDNDUWGXSQNFN-UNMCSNQZSA-N 0 3 417.546 4.400 20 0 HIADHN CC(C)C(=O)Nc1ccc(Cl)c(C(=O)N[C@@H]2CCN(Cc3ccccc3)[C@@H]2C)c1 ZINC000494007146 905347607 /nfs/dbraw/zinc/34/76/07/905347607.db2.gz OPIBEEFYFZQLMJ-IIBYNOLFSA-N 0 3 413.949 4.327 20 0 HIADHN CC(C)[C@@H]1OCCC[C@H]1CN[C@@H](c1ccc(F)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000494021428 905363651 /nfs/dbraw/zinc/36/36/51/905363651.db2.gz WLIKQYFZTRKKMD-VJBMBRPKSA-N 0 3 419.562 4.359 20 0 HIADHN C[C@H]1[C@H](NC(=O)c2ccc(OCc3ccncc3)cc2)CCN1Cc1ccccc1 ZINC000494027407 905369939 /nfs/dbraw/zinc/36/99/39/905369939.db2.gz MLECDKPOFNZKNH-YADARESESA-N 0 3 401.510 4.053 20 0 HIADHN C[C@H](SCC(=O)N[C@@H]1CCN(Cc2ccccc2)[C@@H]1C)c1nc2ccccc2[nH]1 ZINC000494036307 905375555 /nfs/dbraw/zinc/37/55/55/905375555.db2.gz DJZDQMDXPZYMIZ-ZIFCJYIRSA-N 0 3 408.571 4.136 20 0 HIADHN O[C@H](CN[C@@H](c1ccc(Cl)cc1)c1ccc(OC(F)F)cc1)C1CCOCC1 ZINC000494050803 905389068 /nfs/dbraw/zinc/38/90/68/905389068.db2.gz TWFSPTAKDYJCMW-UXHICEINSA-N 0 3 411.876 4.408 20 0 HIADHN Cc1ccc(-c2nc(CC(=O)N[C@@H]3CCN(Cc4ccccc4)[C@@H]3C)cs2)cc1 ZINC000494078066 905415271 /nfs/dbraw/zinc/41/52/71/905415271.db2.gz JIUXMBXENWHNSR-XMSQKQJNSA-N 0 3 405.567 4.440 20 0 HIADHN O=C(CCc1ccccc1)N1CC[C@H](NCc2ccc(Br)c(Cl)c2)C1 ZINC000494166241 905501399 /nfs/dbraw/zinc/50/13/99/905501399.db2.gz YADWYTXESDJLED-KRWDZBQOSA-N 0 3 421.766 4.426 20 0 HIADHN CSc1ccc(NC(=O)N[C@H]2CCN(Cc3ccccc3)C[C@@H]2CO)cc1Cl ZINC000494188659 905523109 /nfs/dbraw/zinc/52/31/09/905523109.db2.gz LKEHCJGEUDZDNZ-APWZRJJASA-N 0 3 419.978 4.066 20 0 HIADHN Cc1ccnc(-c2n[nH]c([C@@H](C)N[C@H](C)Cc3ccc(Br)cc3F)n2)c1 ZINC000494327667 905638507 /nfs/dbraw/zinc/63/85/07/905638507.db2.gz IHENMWYFEXUVNH-CHWSQXEVSA-N 0 3 418.314 4.359 20 0 HIADHN Cc1ccnc(-c2n[nH]c([C@@H](C)N[C@H](C)Cc3ccc(Br)c(F)c3)n2)c1 ZINC000494374215 905672322 /nfs/dbraw/zinc/67/23/22/905672322.db2.gz IXRZTYUKFKXPRI-CHWSQXEVSA-N 0 3 418.314 4.359 20 0 HIADHN COc1cc(CN2CCC[C@@H](CNC(=O)C(C)C)C2)ccc1OCc1cccs1 ZINC000512444487 921166639 /nfs/dbraw/zinc/16/66/39/921166639.db2.gz PNKHXMFOSIDWSR-IBGZPJMESA-N 0 3 416.587 4.320 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](NCCCc2ccccn2)c2ccc(Cl)cc2)c1 ZINC000494404909 905696521 /nfs/dbraw/zinc/69/65/21/905696521.db2.gz RPRPOAQPYKZYQU-JOCHJYFZSA-N 0 3 414.958 4.450 20 0 HIADHN Cc1ccnc(-c2nnc([C@H](C)[NH2+][C@H](C)CCc3ccc(OC(F)F)cc3)[n-]2)c1 ZINC000494429869 905716651 /nfs/dbraw/zinc/71/66/51/905716651.db2.gz YBVABVFOHWWZKX-CABCVRRESA-N 0 3 401.461 4.448 20 0 HIADHN COc1ccccc1[C@H](C)NC(=O)[C@H](C)N[C@H]1CCO[C@H]1c1ccc(Cl)cc1 ZINC000494462730 905744302 /nfs/dbraw/zinc/74/43/02/905744302.db2.gz HDSFDLGZLCYUBI-XBKQCJCOSA-N 0 3 402.922 4.034 20 0 HIADHN COC(=O)COc1cccc(CN[C@H]2CCc3cc(Br)cc(C)c32)c1 ZINC000494609870 905861842 /nfs/dbraw/zinc/86/18/42/905861842.db2.gz UXCVYHMMCBAAEQ-SFHVURJKSA-N 0 3 404.304 4.086 20 0 HIADHN O=C(Nc1ccc(F)c(Br)c1)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000494645250 905879563 /nfs/dbraw/zinc/87/95/63/905879563.db2.gz BJRBEHDSSCMBQZ-UHFFFAOYSA-N 0 3 421.310 4.045 20 0 HIADHN O=C(NC[C@H]1CCCN(Cc2ccc(OC(F)F)cc2)C1)Nc1cccc(F)c1 ZINC000512478255 921188498 /nfs/dbraw/zinc/18/84/98/921188498.db2.gz BUUZQNWVCDUIDN-MRXNPFEDSA-N 0 3 407.436 4.461 20 0 HIADHN CSc1cccc([C@@H](NCC2CCS(=O)(=O)CC2)c2cc(F)ccc2F)c1 ZINC000494716451 905920751 /nfs/dbraw/zinc/92/07/51/905920751.db2.gz XMOSDJZLVNGGSD-HXUWFJFHSA-N 0 3 411.539 4.191 20 0 HIADHN CN(C)CCN(Cc1cccc(O)c1)C(=O)[C@@H]1C[C@@H]1c1ccc(Cl)c(Cl)c1 ZINC000494794730 905997172 /nfs/dbraw/zinc/99/71/72/905997172.db2.gz YYXSWFXHPTYKNL-QZTJIDSGSA-N 0 3 407.341 4.393 20 0 HIADHN COc1cc(CNCc2ccc(C3CCC3)cc2)ccc1OCC(=O)N1CCCC1 ZINC000494835502 906026772 /nfs/dbraw/zinc/02/67/72/906026772.db2.gz GZRVCYIJNKLGQY-UHFFFAOYSA-N 0 3 408.542 4.254 20 0 HIADHN CN(Cc1ccc(Br)c(F)c1)C(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000494839476 906030010 /nfs/dbraw/zinc/03/00/10/906030010.db2.gz XSTFMLGBWMMAML-MOPGFXCFSA-N 0 3 420.326 4.175 20 0 HIADHN C[C@@H]1CN(C2CCOCC2)CCN1C(=O)N[C@@H](c1ccc(Cl)cc1)C1CCC1 ZINC000494857027 906039641 /nfs/dbraw/zinc/03/96/41/906039641.db2.gz DJRTWGROEGQQGK-IIBYNOLFSA-N 0 3 405.970 4.076 20 0 HIADHN C[C@@H](NCc1ccc(N2CCc3ccccc3C2)nc1)c1ccc(C(=O)N(C)C)cc1 ZINC000494886054 906063861 /nfs/dbraw/zinc/06/38/61/906063861.db2.gz LXHMDYHJEWOCKL-LJQANCHMSA-N 0 3 414.553 4.197 20 0 HIADHN CN1CCN(CC(=O)NCCC(c2ccccc2)c2ccccc2)C2(CCCCC2)C1 ZINC000494898961 906073590 /nfs/dbraw/zinc/07/35/90/906073590.db2.gz WYKOKXXNUODBMX-UHFFFAOYSA-N 0 3 419.613 4.275 20 0 HIADHN C[C@@H](NCc1ccc(-n2ccc(C(F)(F)F)n2)cc1)c1ccc(C(=O)N(C)C)cc1 ZINC000494901586 906076682 /nfs/dbraw/zinc/07/66/82/906076682.db2.gz NEUWEIQWFKKDHE-OAHLLOKOSA-N 0 3 416.447 4.444 20 0 HIADHN CCc1c(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2F)cnn1CCC(C)C ZINC000494913252 906085955 /nfs/dbraw/zinc/08/59/55/906085955.db2.gz WPNYNLOWYHMDAR-UHFFFAOYSA-N 0 3 421.536 4.366 20 0 HIADHN C[C@H](NC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1)[C@@H]1OCCc2sccc21 ZINC000494938659 906109417 /nfs/dbraw/zinc/10/94/17/906109417.db2.gz PMJZWCZIHJRFKO-SPEDKVCISA-N 0 3 413.587 4.056 20 0 HIADHN CO[C@@H]1CCC[C@H]1CN[C@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000494966800 906135345 /nfs/dbraw/zinc/13/53/45/906135345.db2.gz BHSGMXRFXDCTGC-IOMROCGXSA-N 0 3 407.963 4.238 20 0 HIADHN O=C(Nc1ccccc1Br)C1CCN(C/C=C/c2ccncc2)CC1 ZINC000494982528 906146399 /nfs/dbraw/zinc/14/63/99/906146399.db2.gz YACVFBKGJXMYMW-ONEGZZNKSA-N 0 3 400.320 4.208 20 0 HIADHN COc1ccc([C@H](NCCC2CCS(=O)(=O)CC2)c2ccccc2Cl)cc1 ZINC000494986076 906150282 /nfs/dbraw/zinc/15/02/82/906150282.db2.gz ASBPVYYONDEROU-NRFANRHFSA-N 0 3 407.963 4.243 20 0 HIADHN O=S1(=O)CC[C@@H](NC[C@@H]2CCCCC(F)(F)C2)c2cc(Br)ccc21 ZINC000494996436 906158678 /nfs/dbraw/zinc/15/86/78/906158678.db2.gz ILFXEFZMXDLDSW-IUODEOHRSA-N 0 3 422.335 4.473 20 0 HIADHN COc1ccccc1[C@H](NC(=O)N[C@H]1C[C@@H](C)N(Cc2ccccc2)C1)c1ccco1 ZINC000495009101 906169300 /nfs/dbraw/zinc/16/93/00/906169300.db2.gz TUBNSMBYBQYSMY-WWEVIYMKSA-N 0 3 419.525 4.340 20 0 HIADHN COc1cc(C)c(NC(=O)N(C)C2CCN(CCc3ccccn3)CC2)c(C)c1C ZINC000495045662 906202352 /nfs/dbraw/zinc/20/23/52/906202352.db2.gz IKKDAJJUUODTOG-UHFFFAOYSA-N 0 3 410.562 4.186 20 0 HIADHN Clc1ccccc1[C@H](N[C@@H]1CCO[C@@]2(CCOC2)C1)c1ccc2c(c1)OCCO2 ZINC000495061003 906213504 /nfs/dbraw/zinc/21/35/04/906213504.db2.gz BWKHKEHQLIENKQ-ZQMYSKGWSA-N 0 3 415.917 4.128 20 0 HIADHN Cc1cccc2nc(CCC(=O)Nc3cc(CN4CCSCC4)ccc3C)[nH]c21 ZINC000495091153 906233461 /nfs/dbraw/zinc/23/34/61/906233461.db2.gz BZXOODWJBAVVNG-UHFFFAOYSA-N 0 3 408.571 4.300 20 0 HIADHN CC1(C)CC[C@H](CNCc2cc(Br)ccc2OCc2ccccn2)O1 ZINC000495169875 906285028 /nfs/dbraw/zinc/28/50/28/906285028.db2.gz VBXNNMULSFSTAW-GOSISDBHSA-N 0 3 405.336 4.470 20 0 HIADHN CCN(CC(=O)Nc1cccc(CN2CCSCC2)c1)[C@@H](C)Cc1ccsc1 ZINC000495250753 906338422 /nfs/dbraw/zinc/33/84/22/906338422.db2.gz QWGQBVPOEIMMLQ-SFHVURJKSA-N 0 3 417.644 4.189 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)Cc2cscc2Br)cc1 ZINC000495345267 906390379 /nfs/dbraw/zinc/39/03/79/906390379.db2.gz NCVDYYMKINGJBT-GOSISDBHSA-N 0 3 423.376 4.015 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)c2ccc(OC(F)F)c(F)c2)cc1 ZINC000495345043 906391273 /nfs/dbraw/zinc/39/12/73/906391273.db2.gz INRRNBCTKRPOCK-GOSISDBHSA-N 0 3 408.420 4.003 20 0 HIADHN Cc1nc([C@@H]2CCCOC2)sc1C(=O)NCCN1CCC2(CCCCC2)CC1 ZINC000512556899 921234223 /nfs/dbraw/zinc/23/42/23/921234223.db2.gz IHTKXSCPTFBIES-GOSISDBHSA-N 0 3 405.608 4.122 20 0 HIADHN O=C(CCCC(=O)N1CCC[C@@H]1CN1CCCCC1)c1ccc(Br)cc1 ZINC000495402404 906428533 /nfs/dbraw/zinc/42/85/33/906428533.db2.gz QMDLZTFYZFZAKL-LJQANCHMSA-N 0 3 421.379 4.279 20 0 HIADHN COc1cccc([C@@H]2[C@H](N[C@H](C)c3cc(OC)c(OC)cc3F)CCN2C2CC2)c1 ZINC000495407942 906432530 /nfs/dbraw/zinc/43/25/30/906432530.db2.gz KFVULJABNFLJID-YFMCZXFPSA-N 0 3 414.521 4.480 20 0 HIADHN Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)N[C@@H](C)c1cccc(N2CCOCC2)c1 ZINC000495415416 906437422 /nfs/dbraw/zinc/43/74/22/906437422.db2.gz PSVDWYKRXFHNBL-LSDHHAIUSA-N 0 3 410.484 4.311 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)N[C@@H](C)c2nc(-c3ccccc3)cs2)cc1 ZINC000495425450 906443301 /nfs/dbraw/zinc/44/33/01/906443301.db2.gz BEEOEECUYDURME-JXFKEZNVSA-N 0 3 424.570 4.482 20 0 HIADHN Cc1nc(C)c(CN2CCC(C(=O)Nc3ccc(Br)cc3)CC2)s1 ZINC000512559973 921236738 /nfs/dbraw/zinc/23/67/38/921236738.db2.gz BEPBVQGWOLNDDJ-UHFFFAOYSA-N 0 3 408.365 4.373 20 0 HIADHN CCN(CC)[C@@H](CNc1ccc(C(=O)N2CCc3ccccc32)cn1)c1ccco1 ZINC000495490748 906480955 /nfs/dbraw/zinc/48/09/55/906480955.db2.gz MDYZKMPOLLEYKB-NRFANRHFSA-N 0 3 404.514 4.373 20 0 HIADHN Cc1ccc(NC(=O)c2ccc(CN3CCC(CO)CC3)cc2)cc1OC(F)F ZINC000495505327 906492781 /nfs/dbraw/zinc/49/27/81/906492781.db2.gz DJRJUVZIIMKIPT-UHFFFAOYSA-N 0 3 404.457 4.053 20 0 HIADHN Cc1nc(C)c(CN2CCC(C(=O)Nc3cccc(Br)c3)CC2)s1 ZINC000512565342 921240269 /nfs/dbraw/zinc/24/02/69/921240269.db2.gz PNYDIEXFRQRIFC-UHFFFAOYSA-N 0 3 408.365 4.373 20 0 HIADHN COc1cc(CN2CCC(c3nc(-c4ccccc4)n[nH]3)CC2)ccc1OC(F)F ZINC000512574038 921245410 /nfs/dbraw/zinc/24/54/10/921245410.db2.gz PRYAYZQGIWAOAY-UHFFFAOYSA-N 0 3 414.456 4.461 20 0 HIADHN O=C(CC1(N2CCOCC2)CCCC1)N1CCc2ccccc2[C@@H]1c1ccccc1 ZINC000512577154 921246485 /nfs/dbraw/zinc/24/64/85/921246485.db2.gz KDGFCRCNNYWFQS-VWLOTQADSA-N 0 3 404.554 4.196 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)[C@@H]1C[C@@H]1c1cccc(Br)c1 ZINC000495999879 906594675 /nfs/dbraw/zinc/59/46/75/906594675.db2.gz MIGUFUQJQNKFNB-WOJBJXKFSA-N 0 3 401.348 4.143 20 0 HIADHN CCc1nc([C@@H](C)NC(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)cs1 ZINC000496165504 906618803 /nfs/dbraw/zinc/61/88/03/906618803.db2.gz HAFZICNFATULRD-BEFAXECRSA-N 0 3 404.580 4.156 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)CSCc1cccc(Cl)c1 ZINC000496242167 906636122 /nfs/dbraw/zinc/63/61/22/906636122.db2.gz DNYJUZSIKFYGOD-OAQYLSRUSA-N 0 3 418.006 4.481 20 0 HIADHN CCCN(CCN(C)C)C(=O)CCc1nc(C)c(-c2ccc(Br)cc2)o1 ZINC000496262375 906640368 /nfs/dbraw/zinc/64/03/68/906640368.db2.gz KSHKXXHQUNWNCZ-UHFFFAOYSA-N 0 3 422.367 4.145 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)CSc1ccc(Cl)cc1 ZINC000496262814 906642555 /nfs/dbraw/zinc/64/25/55/906642555.db2.gz LYUDVPNAZDJCAR-LJQANCHMSA-N 0 3 403.979 4.340 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)c1nc(-c2ccco2)sc1C ZINC000496262974 906642910 /nfs/dbraw/zinc/64/29/10/906642910.db2.gz NDOSOYFWYMKREQ-GOSISDBHSA-N 0 3 410.543 4.233 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)c1cc2ccc(OC(F)(F)F)cc2[nH]1 ZINC000496337980 906661236 /nfs/dbraw/zinc/66/12/36/906661236.db2.gz HKGKHPNUPHQBBV-UHFFFAOYSA-N 0 3 423.410 4.410 20 0 HIADHN CCCN(CCN(C)C)C(=O)c1cccnc1Oc1ccc(Br)cc1 ZINC000496358741 906666858 /nfs/dbraw/zinc/66/68/58/906666858.db2.gz REDSMJXTDWJWGC-UHFFFAOYSA-N 0 3 406.324 4.050 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1cnn(C)c1-c1ccccc1 ZINC000496705148 906737802 /nfs/dbraw/zinc/73/78/02/906737802.db2.gz BDSRABLYAHQSAU-IBGZPJMESA-N 0 3 403.530 4.215 20 0 HIADHN CCN(C(=O)Nc1cnn(C)c1-c1ccccc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000496706672 906740025 /nfs/dbraw/zinc/74/00/25/906740025.db2.gz KIPMKBGCDUSEDZ-OAQYLSRUSA-N 0 3 403.530 4.215 20 0 HIADHN CN1CCC(NC(=O)c2nn(-c3ccc(Cl)cc3Cl)c3c2CCCCC3)CC1 ZINC000497035678 906794674 /nfs/dbraw/zinc/79/46/74/906794674.db2.gz PGGJNCZWRFSREE-UHFFFAOYSA-N 0 3 421.372 4.272 20 0 HIADHN CCN1CCN(c2ccccc2CNc2ccc(C(=O)N3CCCC[C@@H]3C)cc2)CC1 ZINC000512634658 921268982 /nfs/dbraw/zinc/26/89/82/921268982.db2.gz TXMGTSGLLSLGFB-NRFANRHFSA-N 0 3 420.601 4.455 20 0 HIADHN CCCc1noc2nc(C3CC3)cc(C(=O)N(Cc3ccco3)C3CCN(C)CC3)c12 ZINC000497364937 906855037 /nfs/dbraw/zinc/85/50/37/906855037.db2.gz PMMCSYIFLBOBQL-UHFFFAOYSA-N 0 3 422.529 4.382 20 0 HIADHN Cc1cccc(-n2ncc(C(=O)NC[C@@H](c3ccccc3)N(C)C)c2C(F)(F)F)c1 ZINC000497385293 906872067 /nfs/dbraw/zinc/87/20/67/906872067.db2.gz LXYZWOIHNIGLON-IBGZPJMESA-N 0 3 416.447 4.232 20 0 HIADHN CO[C@@H]1CCC[C@H](C(=O)Nc2cccc(N3CCN(CCc4ccccc4)CC3)c2)C1 ZINC000497398553 906880743 /nfs/dbraw/zinc/88/07/43/906880743.db2.gz FQHKIIGKHKHSIG-WIOPSUGQSA-N 0 3 421.585 4.195 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)CNC(=O)c2sc3ccccc3c2Cl)c1 ZINC000497429309 906899820 /nfs/dbraw/zinc/89/98/20/906899820.db2.gz BGZRIOYKNJGPCF-UHFFFAOYSA-N 0 3 415.946 4.293 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)N[C@@H](C)c2cc(OC)c(OC)cc2F)N(C)C)cc1 ZINC000512667477 921281787 /nfs/dbraw/zinc/28/17/87/921281787.db2.gz PTFYKGICHLJJSH-MGPUTAFESA-N 0 3 417.525 4.068 20 0 HIADHN COc1ccc(CNC(=O)C2CCN(Cc3cccc(OC(F)(F)F)c3)CC2)cc1 ZINC000512701922 921292355 /nfs/dbraw/zinc/29/23/55/921292355.db2.gz XMRJMXWGRVCWSC-UHFFFAOYSA-N 0 3 422.447 4.122 20 0 HIADHN COc1cc(CN2CCC(C(=O)NCc3ccc(C)cc3)CC2)ccc1OC(F)F ZINC000512710339 921293761 /nfs/dbraw/zinc/29/37/61/921293761.db2.gz QUUZHUKNOWOSTF-UHFFFAOYSA-N 0 3 418.484 4.133 20 0 HIADHN Cc1cccnc1[C@@H](NC(=O)NC[C@H](c1ccc(OC(C)C)cc1)N(C)C)C(C)C ZINC000497630055 907111462 /nfs/dbraw/zinc/11/14/62/907111462.db2.gz UQINSEWDZTZNKN-YADHBBJMSA-N 0 3 412.578 4.476 20 0 HIADHN CC(C)Cn1ncc(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2)c1C1CC1 ZINC000497639777 907125202 /nfs/dbraw/zinc/12/52/02/907125202.db2.gz QVIKZPCXSMUYOZ-UHFFFAOYSA-N 0 3 401.530 4.151 20 0 HIADHN Cc1c(C(=O)NC[C@@H](C(C)C)N2CCc3ccccc3C2)cnn1Cc1ccccc1 ZINC000512731637 921298464 /nfs/dbraw/zinc/29/84/64/921298464.db2.gz ZOCXQVVGVYVTOR-VWLOTQADSA-N 0 3 416.569 4.053 20 0 HIADHN CCc1nc(C(=O)NC[C@H]2CCCN(C)[C@@H]2c2ccc(C(F)(F)F)cc2)c(C)o1 ZINC000512734109 921299119 /nfs/dbraw/zinc/29/91/19/921299119.db2.gz IVDLZNNLVVEQLF-DNVCBOLYSA-N 0 3 409.452 4.377 20 0 HIADHN CCOc1cc(CN[C@@H](C)c2ccc3c(c2)OCCO3)cc(Br)c1O ZINC000497676909 907180079 /nfs/dbraw/zinc/18/00/79/907180079.db2.gz PCKLNEYHCOBAHD-LBPRGKRZSA-N 0 3 408.292 4.175 20 0 HIADHN CCN(C(=O)N[C@H](C)c1nccn1-c1ccccc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000512778478 921309833 /nfs/dbraw/zinc/30/98/33/921309833.db2.gz NKJNPIBPSNQKHB-NFBKMPQASA-N 0 3 417.557 4.239 20 0 HIADHN C[C@H](NC(=O)c1oc2ccccc2c1CN(C)C)c1ccc(NC(=O)NC2CC2)cc1 ZINC000497808537 907294433 /nfs/dbraw/zinc/29/44/33/907294433.db2.gz PEHFVBCXARWZLP-HNNXBMFYSA-N 0 3 420.513 4.269 20 0 HIADHN C[C@H](NC(=O)Nc1ccc(Cl)c(C(=O)Nc2ccccc2)c1)C1=CCN(C)CC1 ZINC000512820535 921324412 /nfs/dbraw/zinc/32/44/12/921324412.db2.gz MHIZENSIGUDKPM-HNNXBMFYSA-N 0 3 412.921 4.364 20 0 HIADHN COc1ccc([C@@H](CNC(=O)Cc2cc(Cl)ccc2Cl)N2CCCC2)cc1 ZINC000497987424 907466502 /nfs/dbraw/zinc/46/65/02/907466502.db2.gz XIUVCDVABLBDBW-HXUWFJFHSA-N 0 3 407.341 4.498 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)N2CCC[C@H](C(F)(F)F)[C@H]2C)N(C)C)cc1 ZINC000512825273 921330125 /nfs/dbraw/zinc/33/01/25/921330125.db2.gz DBSJGGNQTANIFP-MNEFBYGVSA-N 0 3 415.500 4.449 20 0 HIADHN C[C@@H](Oc1ccc(F)cc1Cl)C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000498088287 907596348 /nfs/dbraw/zinc/59/63/48/907596348.db2.gz JMEQHUJUXXTXOI-OAHLLOKOSA-N 0 3 422.953 4.476 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)c3cc(NCc4ccccc4)nc4ccccc43)[C@@H]2C1 ZINC000498105421 907612602 /nfs/dbraw/zinc/61/26/02/907612602.db2.gz KLIUAGIIKXEYLK-WMZHIEFXSA-N 0 3 400.526 4.013 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)c1cc(-c2cccc(Cl)c2)no1 ZINC000498121372 907633463 /nfs/dbraw/zinc/63/34/63/907633463.db2.gz PUFKQWNYURXMFO-UHFFFAOYSA-N 0 3 401.869 4.338 20 0 HIADHN CCCCc1ccc([C@H](NC(=O)N(C)CCCN2CCN(C)CC2)C(C)C)cc1 ZINC000498126613 907643380 /nfs/dbraw/zinc/64/33/80/907643380.db2.gz KZBWJXHUQZLQNU-HSZRJFAPSA-N 0 3 402.627 4.005 20 0 HIADHN Brc1ccc(-c2ccc(CN[C@H]3CCCN(c4ncccn4)C3)o2)cc1 ZINC000512840778 921343854 /nfs/dbraw/zinc/34/38/54/921343854.db2.gz PDIJRQILLVUSBE-KRWDZBQOSA-N 0 3 413.319 4.258 20 0 HIADHN Cc1cccc([C@H](NC(=O)NCCCN2CCc3ccccc3C2)c2ccccn2)c1 ZINC000498220713 907749212 /nfs/dbraw/zinc/74/92/12/907749212.db2.gz CBORYYCIMITUBL-VWLOTQADSA-N 0 3 414.553 4.227 20 0 HIADHN Cc1cccc([C@H](NC(=O)NC[C@@H](C)N(C)Cc2ccccc2)c2ccccn2)c1 ZINC000498237961 907771236 /nfs/dbraw/zinc/77/12/36/907771236.db2.gz HHLPZPNKPVAJBD-YKSBVNFPSA-N 0 3 402.542 4.299 20 0 HIADHN COc1cc(CNCc2c[nH]nc2-c2ccc3c(c2)OCO3)ccc1OC1CCCC1 ZINC000512848318 921353620 /nfs/dbraw/zinc/35/36/20/921353620.db2.gz CXICFRLTWDDOKV-UHFFFAOYSA-N 0 3 421.497 4.425 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)COc1cccc(C(F)(F)F)c1)c1ccsc1 ZINC000498350002 907852072 /nfs/dbraw/zinc/85/20/72/907852072.db2.gz OAJFSWJSBUIXFE-KRWDZBQOSA-N 0 3 400.466 4.345 20 0 HIADHN CCc1nc(C(=O)N2C[C@H]3CCCN3Cc3ccccc32)nn1-c1ccccc1Cl ZINC000498391362 907876085 /nfs/dbraw/zinc/87/60/85/907876085.db2.gz XIPDMXJNJSHRBR-QGZVFWFLSA-N 0 3 421.932 4.108 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)c2ccccc2Nc2cccc(C)c2C)CC1 ZINC000498436373 907901580 /nfs/dbraw/zinc/90/15/80/907901580.db2.gz PAENQGNBTVBJPB-LJQANCHMSA-N 0 3 408.590 4.050 20 0 HIADHN CC(C)n1ncc2c1nc(C1CC1)cc2C(=O)N(Cc1ccco1)C1CCN(C)CC1 ZINC000498453689 907917643 /nfs/dbraw/zinc/91/76/43/907917643.db2.gz OCTLVTBWKWSFIR-UHFFFAOYSA-N 0 3 421.545 4.219 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)c2[nH]c3ccccc3c2Br)CC1 ZINC000498469195 907939608 /nfs/dbraw/zinc/93/96/08/907939608.db2.gz JWWXBPJFPPIKRE-UHFFFAOYSA-N 0 3 416.319 4.260 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N2CCC([C@@H](F)c3ccccc3F)CC2)CC1 ZINC000498589640 908041063 /nfs/dbraw/zinc/04/10/63/908041063.db2.gz SEILPQFXOIRVRT-JOCHJYFZSA-N 0 3 423.548 4.147 20 0 HIADHN C[C@H]1CC[C@H](C)N1CC(=O)NCc1cn(Cc2ccccc2)nc1-c1ccccc1 ZINC000498606914 908055377 /nfs/dbraw/zinc/05/53/77/908055377.db2.gz OYTLWJSWYFEFQS-PMACEKPBSA-N 0 3 402.542 4.087 20 0 HIADHN C[C@H](NCc1ccc(-c2ccccc2Br)cc1)C1(S(C)(=O)=O)CC1 ZINC000512885267 921379273 /nfs/dbraw/zinc/37/92/73/921379273.db2.gz NGYHAAPFJITIGE-AWEZNQCLSA-N 0 3 408.361 4.171 20 0 HIADHN C[C@H]1CCN(C)CCN1C(=O)c1cc(-c2ccc(F)cc2)nc2onc(C3CC3)c21 ZINC000498709464 908134291 /nfs/dbraw/zinc/13/42/91/908134291.db2.gz JMEKIIBBCOKWCQ-AWEZNQCLSA-N 0 3 408.477 4.073 20 0 HIADHN CC[C@H](C)n1ncc2c1nc(C)cc2C(=O)N(CCN(C)C)Cc1ccccc1F ZINC000498709795 908136856 /nfs/dbraw/zinc/13/68/56/908136856.db2.gz BLERWIGQFQTJRO-KRWDZBQOSA-N 0 3 411.525 4.054 20 0 HIADHN Cc1ccc2[nH]c3c(c2c1)C[C@@H](NC(=O)N(Cc1ccco1)C1CCN(C)CC1)CC3 ZINC000498710830 908136886 /nfs/dbraw/zinc/13/68/86/908136886.db2.gz RKQDBMPILFYZNF-SFHVURJKSA-N 0 3 420.557 4.233 20 0 HIADHN CC[C@@H](NC(=O)N[C@@H](CN(C)C)c1ccc(F)cc1)c1nc(C(F)(F)F)cs1 ZINC000498713439 908138743 /nfs/dbraw/zinc/13/87/43/908138743.db2.gz IQYWTFWCXSRMAY-KGLIPLIRSA-N 0 3 418.460 4.354 20 0 HIADHN Cc1ccc(-c2nc(CNC(=O)N[C@@H]3CCN(Cc4ccccc4)[C@H]3C)co2)cc1 ZINC000498720501 908145770 /nfs/dbraw/zinc/14/57/70/908145770.db2.gz IENBCHXHOLGNDC-PGRDOPGGSA-N 0 3 404.514 4.112 20 0 HIADHN Cc1cccc2oc(CCNC(=O)NC[C@H](c3ccc(OC(C)C)cc3)N(C)C)nc21 ZINC000498733121 908160431 /nfs/dbraw/zinc/16/04/31/908160431.db2.gz CHOKWHPKWDDPFT-HXUWFJFHSA-N 0 3 424.545 4.068 20 0 HIADHN COc1ccc(NC(=O)c2cccc(CN3CCCC3)c2)cc1Oc1ccc(C)nn1 ZINC000498801926 908211218 /nfs/dbraw/zinc/21/12/18/908211218.db2.gz FBVOIPHEDUCSAG-UHFFFAOYSA-N 0 3 418.497 4.434 20 0 HIADHN CCCc1ccccc1NC(=O)N1CCC[C@@H](CN2CCN(c3ccccn3)CC2)C1 ZINC000498817493 908224873 /nfs/dbraw/zinc/22/48/73/908224873.db2.gz AUHBNGJQFDITIO-NRFANRHFSA-N 0 3 421.589 4.100 20 0 HIADHN Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000498851292 908256483 /nfs/dbraw/zinc/25/64/83/908256483.db2.gz DLLFJUVAOWJRSM-QFIPXVFZSA-N 0 3 420.557 4.017 20 0 HIADHN O=C(N[C@@H](c1cccc(F)c1)c1ccccn1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000498888438 908290446 /nfs/dbraw/zinc/29/04/46/908290446.db2.gz CXAPGSHXOYNNKF-RDPSFJRHSA-N 0 3 421.491 4.478 20 0 HIADHN C[C@H](C(=O)Nc1ccc(Cl)c(Cl)c1)N1CCC[C@@H](c2n[nH]c(C3CC3)n2)C1 ZINC000498904943 908313586 /nfs/dbraw/zinc/31/35/86/908313586.db2.gz LZCKCQUTIMWHMK-DGCLKSJQSA-N 0 3 408.333 4.196 20 0 HIADHN C[C@H](C(=O)Nc1ccc(Cl)c(Cl)c1)N1CCC[C@H](c2n[nH]c(C3CC3)n2)C1 ZINC000498904945 908315515 /nfs/dbraw/zinc/31/55/15/908315515.db2.gz LZCKCQUTIMWHMK-YPMHNXCESA-N 0 3 408.333 4.196 20 0 HIADHN C[C@@H](NC(=O)CN1CCC[C@@H](c2n[nH]c(C3CC3)n2)C1)c1ccc(Cl)cc1Cl ZINC000498915519 908325250 /nfs/dbraw/zinc/32/52/50/908325250.db2.gz FFYIROFXIWXXPE-TZMCWYRMSA-N 0 3 422.360 4.046 20 0 HIADHN CC(C)[C@H](NCc1cc(C(F)(F)F)ccc1N1CCN(C)CC1)c1ccc(F)cn1 ZINC000498916516 908326975 /nfs/dbraw/zinc/32/69/75/908326975.db2.gz DJJTXIMULQLHKD-NRFANRHFSA-N 0 3 424.486 4.478 20 0 HIADHN O=C(CN1CCC[C@@H](c2nc(C3CC3)n[nH]2)C1)N(c1ccccc1)C1CCCCC1 ZINC000498928070 908335791 /nfs/dbraw/zinc/33/57/91/908335791.db2.gz HZBGHLYOAIOHLW-LJQANCHMSA-N 0 3 407.562 4.227 20 0 HIADHN O=C(CN1CCC[C@@H](c2n[nH]c(C3CC3)n2)C1)N(c1ccccc1)C1CCCCC1 ZINC000498928070 908335802 /nfs/dbraw/zinc/33/58/02/908335802.db2.gz HZBGHLYOAIOHLW-LJQANCHMSA-N 0 3 407.562 4.227 20 0 HIADHN O=C(Nc1ccccc1)[C@H](c1ccccc1)N1CCC[C@@H](c2nc(C3CC3)n[nH]2)C1 ZINC000498935725 908343839 /nfs/dbraw/zinc/34/38/39/908343839.db2.gz AEBYMIKUOKZMAB-CTNGQTDRSA-N 0 3 401.514 4.242 20 0 HIADHN CC[C@H](C)Sc1ccc(NC(=O)C(=O)NC[C@H](C)N2CCCC[C@@H]2C)c(C)c1 ZINC000498968422 908361697 /nfs/dbraw/zinc/36/16/97/908361697.db2.gz CJNCHOKCBWQUGL-BZSNNMDCSA-N 0 3 405.608 4.203 20 0 HIADHN CC[C@@H](C)Sc1ccc(NC(=O)C(=O)NC[C@@H](C)N2CCC(C)CC2)c(C)c1 ZINC000499000880 908379118 /nfs/dbraw/zinc/37/91/18/908379118.db2.gz OFASRZRXJRPNMF-QZTJIDSGSA-N 0 3 405.608 4.061 20 0 HIADHN Cc1cccc([C@H](NC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)c2ccccn2)c1 ZINC000499013374 908388744 /nfs/dbraw/zinc/38/87/44/908388744.db2.gz LSRXPOUVIKVBDD-VWNXMTODSA-N 0 3 400.526 4.053 20 0 HIADHN C[C@H]1CC[C@@H](c2ccccc2)N(C(=O)NCc2ccccc2CN2CCC(O)CC2)C1 ZINC000499110002 908469306 /nfs/dbraw/zinc/46/93/06/908469306.db2.gz ITIYPOFKDYWCCX-CPJSRVTESA-N 0 3 421.585 4.326 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)N(CCc2nccs2)C(C)C)N(C)C)cc1 ZINC000512918875 921413541 /nfs/dbraw/zinc/41/35/41/921413541.db2.gz UVAIJZCFTFUINS-FQEVSTJZSA-N 0 3 418.607 4.196 20 0 HIADHN O=C(COc1ccccc1CN1CC=C(c2c[nH]c3ccccc32)CC1)NCC1CC1 ZINC000499255715 908631832 /nfs/dbraw/zinc/63/18/32/908631832.db2.gz ZBTOSZDSCYGVAU-UHFFFAOYSA-N 0 3 415.537 4.362 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)c1cccc(OC[C@@H]2CCCO2)c1 ZINC000499258337 908634725 /nfs/dbraw/zinc/63/47/25/908634725.db2.gz ZWQYKGTVLZKMIK-QFIPXVFZSA-N 0 3 416.949 4.102 20 0 HIADHN O=C(N[C@@H](c1cccc(F)c1)c1ccccn1)N1CCCN(Cc2ccccc2)CC1 ZINC000499323702 908698251 /nfs/dbraw/zinc/69/82/51/908698251.db2.gz LZYHXGIVPWTGSO-DEOSSOPVSA-N 0 3 418.516 4.228 20 0 HIADHN C[C@H](C(=O)Nc1ccc(OC2CCN(C)CC2)nc1)c1ccc(Br)cc1 ZINC000499340981 908715916 /nfs/dbraw/zinc/71/59/16/908715916.db2.gz CMABHWIPRGEWSA-AWEZNQCLSA-N 0 3 418.335 4.059 20 0 HIADHN COc1cc(C(=O)N(CCN(C)C)Cc2ccc(F)cc2F)ccc1OCC(C)C ZINC000499373824 908742026 /nfs/dbraw/zinc/74/20/26/908742026.db2.gz CROGSUBGLYPLLD-UHFFFAOYSA-N 0 3 420.500 4.212 20 0 HIADHN CC(C)[C@H](CNC(=O)Cc1coc(-c2ccc(F)cc2)n1)N1CCc2ccccc2C1 ZINC000499389821 908751659 /nfs/dbraw/zinc/75/16/59/908751659.db2.gz QZYRCJCXQABBGJ-QHCPKHFHSA-N 0 3 421.516 4.222 20 0 HIADHN CC(=O)CCc1ccc(O[C@@H](C)C(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)cc1 ZINC000499401035 908762470 /nfs/dbraw/zinc/76/24/70/908762470.db2.gz RYYDEELEQYAUJL-SQJMNOBHSA-N 0 3 422.569 4.237 20 0 HIADHN O=C(NCc1cccc(OCC(F)(F)F)c1)N[C@H](CN1CCCC1)c1ccccc1 ZINC000499491463 908815694 /nfs/dbraw/zinc/81/56/94/908815694.db2.gz IUIXPYVZLKQAOX-HXUWFJFHSA-N 0 3 421.463 4.264 20 0 HIADHN CS(=O)(=O)Cc1cccc(CNCc2cccc(OCc3ccc(F)cc3)c2)c1 ZINC000499670132 908871911 /nfs/dbraw/zinc/87/19/11/908871911.db2.gz KRKOYSFOWBWMLA-UHFFFAOYSA-N 0 3 413.514 4.239 20 0 HIADHN Cc1ccccc1-c1nn(-c2ccccc2)cc1CNCC1(S(C)(=O)=O)CCCC1 ZINC000512976950 921449027 /nfs/dbraw/zinc/44/90/27/921449027.db2.gz DCGPYOIWWITYFO-UHFFFAOYSA-N 0 3 423.582 4.295 20 0 HIADHN O=C(c1cc(Cl)c[nH]1)N1CCC(NCc2csc(-c3ccccc3)n2)CC1 ZINC000512995808 921462035 /nfs/dbraw/zinc/46/20/35/921462035.db2.gz JCNOQBQKLDHCEB-UHFFFAOYSA-N 0 3 400.935 4.186 20 0 HIADHN FC(F)(F)c1ccccc1C1(F)CCN(CCc2nnnn2-c2ccccc2)CC1 ZINC000499939293 909046510 /nfs/dbraw/zinc/04/65/10/909046510.db2.gz KUBSZOCEADZBTD-UHFFFAOYSA-N 0 3 419.426 4.184 20 0 HIADHN O=C(c1cc(Cl)c[nH]1)N1CCC(NCc2c(Cl)cccc2N2CCCC2)CC1 ZINC000513001557 921466719 /nfs/dbraw/zinc/46/67/19/921466719.db2.gz JMOFIELVYDTKRT-UHFFFAOYSA-N 0 3 421.372 4.316 20 0 HIADHN FC(F)(F)c1ccc(C[C@]2(NCc3cncc(Br)c3)CCOC2)cc1 ZINC000513011766 921476544 /nfs/dbraw/zinc/47/65/44/921476544.db2.gz JIMWKOPRNGASEU-QGZVFWFLSA-N 0 3 415.253 4.354 20 0 HIADHN CCOc1cc(CN2CCC[C@H](CNC(=O)c3ccccc3)C2)ccc1OC(F)F ZINC000513028194 921488918 /nfs/dbraw/zinc/48/89/18/921488918.db2.gz WOMJYDQXBXGELI-GOSISDBHSA-N 0 3 418.484 4.329 20 0 HIADHN O=C(NC[C@@H]1CCCN(Cc2cccc(OCc3ccccn3)c2)C1)c1ccccc1 ZINC000513036314 921495187 /nfs/dbraw/zinc/49/51/87/921495187.db2.gz LQHJMBMCSBOCOT-QFIPXVFZSA-N 0 3 415.537 4.303 20 0 HIADHN CN(C)[C@@H](CNC(=O)C(C)(C)c1csc(-c2cccs2)n1)Cc1ccccc1 ZINC000499987337 909433952 /nfs/dbraw/zinc/43/39/52/909433952.db2.gz FPLVRFJSGQGWHE-QGZVFWFLSA-N 0 3 413.612 4.438 20 0 HIADHN O=C(NC[C@H]1CCCN(Cc2cccc(OCc3ccccn3)c2)C1)c1ccccc1 ZINC000513036312 921495556 /nfs/dbraw/zinc/49/55/56/921495556.db2.gz LQHJMBMCSBOCOT-JOCHJYFZSA-N 0 3 415.537 4.303 20 0 HIADHN C[S@@](=O)Cc1ccc(CNCc2ccc(-n3ccc(C(F)(F)F)n3)cc2)cc1 ZINC000513040294 921500353 /nfs/dbraw/zinc/50/03/53/921500353.db2.gz HHEVGOVMRPIBRH-MUUNZHRXSA-N 0 3 407.461 4.059 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)Nc3ccc(F)cc3OC(C)(C)C)CC2)C[C@H](C)O1 ZINC000500091153 909570430 /nfs/dbraw/zinc/57/04/30/909570430.db2.gz MOCCYRQLQFONQN-IRXDYDNUSA-N 0 3 421.557 4.356 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)N[C@@H]2CCOC3(CCCCC3)C2)N(C)C)cc1 ZINC000500147996 909624829 /nfs/dbraw/zinc/62/48/29/909624829.db2.gz OJYXGTRDNWEGAT-IFMALSPDSA-N 0 3 417.594 4.258 20 0 HIADHN COCCOc1ccccc1NC(=O)NC[C@H](c1ccccc1)N1CCC(C)CC1 ZINC000513056174 921512333 /nfs/dbraw/zinc/51/23/33/921512333.db2.gz HSBYAGSNAVIODC-JOCHJYFZSA-N 0 3 411.546 4.307 20 0 HIADHN COc1ccccc1[C@H](NC(=O)N[C@H](C)[C@H](c1ccccc1)N(C)C)c1ccco1 ZINC000500178420 909672720 /nfs/dbraw/zinc/67/27/20/909672720.db2.gz JNSKWAOFQNIUST-MQNAVGNWSA-N 0 3 407.514 4.368 20 0 HIADHN C[C@H](Cn1ncc2ccccc2c1=O)NCc1cccc(OCc2ccc(F)cc2)c1 ZINC000500248011 909736554 /nfs/dbraw/zinc/73/65/54/909736554.db2.gz DGJPWFZPAZSPHU-GOSISDBHSA-N 0 3 417.484 4.293 20 0 HIADHN CCc1nnc(NC(=O)[C@H](C)[C@@H](C)NCc2cc(Cl)c(OC)cc2Cl)s1 ZINC000513066046 921521582 /nfs/dbraw/zinc/52/15/82/921521582.db2.gz ZJJITHUILNPHLI-NXEZZACHSA-N 0 3 417.362 4.169 20 0 HIADHN COc1ccccc1CCNC(=O)CNC/C(C)=C/c1ccccc1C(F)(F)F ZINC000500362447 909812420 /nfs/dbraw/zinc/81/24/20/909812420.db2.gz DAOSALGUMBPMRX-DTQAZKPQSA-N 0 3 406.448 4.066 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)c2ccc(C)cc2Br)cc1 ZINC000500404646 909837548 /nfs/dbraw/zinc/83/75/48/909837548.db2.gz AOSFTVHXORWGHK-FQEVSTJZSA-N 0 3 417.347 4.333 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)Cc2c[nH]c3ccc(Cl)cc23)cc1 ZINC000500433919 909854226 /nfs/dbraw/zinc/85/42/26/909854226.db2.gz VFQKBMLSEHOPKB-QFIPXVFZSA-N 0 3 411.933 4.326 20 0 HIADHN Clc1cc(CNCc2ccc3c(c2)OCCO3)ccc1I ZINC000500441738 909861092 /nfs/dbraw/zinc/86/10/92/909861092.db2.gz RFHSQMVQIVHQBZ-UHFFFAOYSA-N 0 3 415.658 4.006 20 0 HIADHN COCc1cccc(CNCc2ccc(I)c(Cl)c2)c1 ZINC000500442625 909861284 /nfs/dbraw/zinc/86/12/84/909861284.db2.gz VUMDCCAUPQENQJ-UHFFFAOYSA-N 0 3 401.675 4.381 20 0 HIADHN COc1ccccc1[C@H](NC(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C)c1ccccn1 ZINC000500525023 909906082 /nfs/dbraw/zinc/90/60/82/909906082.db2.gz IVQGYGHVZPSOAB-GKVQRAMASA-N 0 3 418.541 4.170 20 0 HIADHN CCN1CCN(Cc2ccc(CNC(=O)N[C@@H](C)c3ccc(Cl)s3)cc2)CC1 ZINC000500649693 909991923 /nfs/dbraw/zinc/99/19/23/909991923.db2.gz VJEZXJIPLGASCK-INIZCTEOSA-N 0 3 421.010 4.099 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)c1csc(-c2ccc(Cl)s2)n1 ZINC000500761338 910065457 /nfs/dbraw/zinc/06/54/57/910065457.db2.gz GMVAIPBDUXVWQW-UHFFFAOYSA-N 0 3 406.964 4.124 20 0 HIADHN COc1ccc(-c2n[nH]cc2CN2CCC(OCc3ccccc3OC)CC2)cc1 ZINC000500765909 910067545 /nfs/dbraw/zinc/06/75/45/910067545.db2.gz OYZRFNHVBVMKGP-UHFFFAOYSA-N 0 3 407.514 4.275 20 0 HIADHN CCN(c1ccc(C(=O)N(C)C2CCN(CCc3ccccn3)CC2)cc1)C(C)C ZINC000500766618 910067708 /nfs/dbraw/zinc/06/77/08/910067708.db2.gz HPIRFFIWBBCITJ-UHFFFAOYSA-N 0 3 408.590 4.095 20 0 HIADHN O=C(NC[C@@H]1CCCN(Cc2ccccc2OCc2cccnc2)C1)c1ccccc1 ZINC000513100061 921548398 /nfs/dbraw/zinc/54/83/98/921548398.db2.gz FYLFRXLEPQEJOK-NRFANRHFSA-N 0 3 415.537 4.303 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)CCc2ccccc2Br)C1 ZINC000500862573 910136300 /nfs/dbraw/zinc/13/63/00/910136300.db2.gz ZLKPMWZXSBFYEW-VQIMIIECSA-N 0 3 401.348 4.333 20 0 HIADHN Cc1cc(C)n(Cc2ccc(C(=O)N[C@@H]3CCN([C@H](C)c4ccccc4)C3)cc2)n1 ZINC000500876844 910150588 /nfs/dbraw/zinc/15/05/88/910150588.db2.gz SQUGHITUBINRMK-HYBUGGRVSA-N 0 3 402.542 4.114 20 0 HIADHN C[C@@H](NC(=O)N(CCN(C)C)Cc1ccccn1)[C@@H](C)c1ccccc1C(F)(F)F ZINC000500892438 910163762 /nfs/dbraw/zinc/16/37/62/910163762.db2.gz KBUZTLRXMPKRDJ-IAGOWNOFSA-N 0 3 422.495 4.366 20 0 HIADHN CCOc1ccc(CN2CCC(C(=O)Nc3ccc(F)cc3)CC2)cc1OCC ZINC000513111597 921558607 /nfs/dbraw/zinc/55/86/07/921558607.db2.gz IGRZUGCXGGTNTC-UHFFFAOYSA-N 0 3 400.494 4.474 20 0 HIADHN Cc1cc(NC(=O)NCCN(C)Cc2ccccc2)ccc1NC(=O)c1ccco1 ZINC000501135239 910315926 /nfs/dbraw/zinc/31/59/26/910315926.db2.gz RITYEVUMAVCNTQ-UHFFFAOYSA-N 0 3 406.486 4.094 20 0 HIADHN COCc1ccccc1/C=C(\C)CN[C@H]1CCCN(Cc2ccc(F)cc2F)C1=O ZINC000513122969 921567936 /nfs/dbraw/zinc/56/79/36/921567936.db2.gz RENZCNNPZOLKMP-LVJXIGIWSA-N 0 3 414.496 4.295 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)CCc2nc(-c3ccc(Cl)cc3)no2)C1 ZINC000501236921 910394466 /nfs/dbraw/zinc/39/44/66/910394466.db2.gz VINCCCNEJFFXLR-JXFKEZNVSA-N 0 3 424.932 4.274 20 0 HIADHN Cc1ccc(-c2noc(CCC(=O)N(CCN(C)C)CC3CCCCC3)n2)cc1F ZINC000501245769 910404144 /nfs/dbraw/zinc/40/41/44/910404144.db2.gz YRLZIHWFFADAGX-UHFFFAOYSA-N 0 3 416.541 4.087 20 0 HIADHN CN(C)c1ncc(CN2CCC[C@@H](c3nc(-c4ccc(Cl)cc4)no3)C2)s1 ZINC000513133002 921575323 /nfs/dbraw/zinc/57/53/23/921575323.db2.gz AYOGIUZKHFMHJD-CQSZACIVSA-N 0 3 403.939 4.292 20 0 HIADHN CCOCCOc1ccccc1C(=O)NC[C@H](c1ccccc1)N1CCC(C)CC1 ZINC000501345556 910481306 /nfs/dbraw/zinc/48/13/06/910481306.db2.gz WLPBTXCYEZMRQQ-HSZRJFAPSA-N 0 3 410.558 4.305 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)CCOc2ccc(C)cc2Br)o1 ZINC000501368753 910497136 /nfs/dbraw/zinc/49/71/36/910497136.db2.gz BEYZKCDNGAUCBU-UHFFFAOYSA-N 0 3 423.351 4.018 20 0 HIADHN Cc1ccc(S(=O)(=O)NC[C@@H]2CCCN(Cc3cc(C)nc4ccccc34)C2)cc1 ZINC000513145298 921582918 /nfs/dbraw/zinc/58/29/18/921582918.db2.gz QQSDYTQTNQQTPQ-FQEVSTJZSA-N 0 3 423.582 4.042 20 0 HIADHN CC[C@H](CNC(=O)Nc1cc(OC)c(Cl)cc1OC)N1CCc2ccccc2C1 ZINC000501403994 910536542 /nfs/dbraw/zinc/53/65/42/910536542.db2.gz FAFFMZLVJZAESK-QGZVFWFLSA-N 0 3 417.937 4.316 20 0 HIADHN Cc1ccc(NC(=O)CN[C@]2(Cc3ccc(C(F)(F)F)cc3)CCOC2)c(F)c1 ZINC000513173455 921600347 /nfs/dbraw/zinc/60/03/47/921600347.db2.gz KEIHMGFCUPOHPW-FQEVSTJZSA-N 0 3 410.411 4.083 20 0 HIADHN CN(Cc1ccccc1Br)C(=O)NCCCN1CCc2ccccc2C1 ZINC000501710611 910778270 /nfs/dbraw/zinc/77/82/70/910778270.db2.gz TWVMCHNXAMGTLC-UHFFFAOYSA-N 0 3 416.363 4.039 20 0 HIADHN CC(=O)Nc1c[nH]nc1[C@H]1CCCN(Cc2cccc(OCc3ccc(F)cc3)c2)C1 ZINC000501726571 910790917 /nfs/dbraw/zinc/79/09/17/910790917.db2.gz VUDWRAPTFCOXCC-FQEVSTJZSA-N 0 3 422.504 4.466 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)c3cnc(-c4ccccc4)s3)cc2)CC1 ZINC000513186212 921609888 /nfs/dbraw/zinc/60/98/88/921609888.db2.gz DJDZNDJLIJIIAV-UHFFFAOYSA-N 0 3 406.555 4.200 20 0 HIADHN C[C@H](c1ccccc1)N(C)C(=O)CN[C@@]1(Cc2ccc(C(F)(F)F)cc2)CCOC1 ZINC000513181424 921606459 /nfs/dbraw/zinc/60/64/59/921606459.db2.gz AMRUGGVWMMSPPN-VGOFRKELSA-N 0 3 420.475 4.216 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)c3occc3-c3ccc(F)cc3)cc2)CC1 ZINC000501779379 910834711 /nfs/dbraw/zinc/83/47/11/910834711.db2.gz AZCNVSCEFSGLBR-UHFFFAOYSA-N 0 3 407.489 4.476 20 0 HIADHN CN(CCOc1ccccc1Cl)C(=O)N[C@H](CN1CCCC1)c1ccccc1 ZINC000501781134 910835901 /nfs/dbraw/zinc/83/59/01/910835901.db2.gz JAASJMRHBVHFIK-HXUWFJFHSA-N 0 3 401.938 4.197 20 0 HIADHN COc1cc(OC)c(NC(=O)N[C@H](CN2CCCC2)c2ccccc2)cc1Cl ZINC000501798927 910850424 /nfs/dbraw/zinc/85/04/24/910850424.db2.gz DPUIFAPCISZCTL-GOSISDBHSA-N 0 3 403.910 4.316 20 0 HIADHN COc1cc(NC(=O)N[C@@H](CN2CCCC2)c2ccccc2)c(OC)cc1Cl ZINC000501802778 910853612 /nfs/dbraw/zinc/85/36/12/910853612.db2.gz OKQHZXXZHMYXII-SFHVURJKSA-N 0 3 403.910 4.316 20 0 HIADHN CCOc1cc2c(cc1NC(=O)N[C@@H](CN1CCCC1)c1ccccc1)O[C@@H](C)C2 ZINC000501806982 910858110 /nfs/dbraw/zinc/85/81/10/910858110.db2.gz YZHDUYBFFRCULV-UWJYYQICSA-N 0 3 409.530 4.367 20 0 HIADHN CCOc1ccc([C@@H](C)NC(=O)N[C@@H](CN2CCCC2)c2ccccc2)cc1OC ZINC000501852190 910884499 /nfs/dbraw/zinc/88/44/99/910884499.db2.gz UPVJQKHHJRQTKP-NQIIRXRSSA-N 0 3 411.546 4.291 20 0 HIADHN CN(Cc1ccccc1N1CCCC1)C(=O)N[C@H](CN1CCCC1)c1ccccc1 ZINC000501851080 910884669 /nfs/dbraw/zinc/88/46/69/910884669.db2.gz MYBOGKYBCKMZNS-HSZRJFAPSA-N 0 3 406.574 4.265 20 0 HIADHN Cc1ccc(C(C)C)c(OCCC(=O)N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)c1 ZINC000501852860 910885833 /nfs/dbraw/zinc/88/58/33/910885833.db2.gz SBGICMUWMCQUCK-OYRHEFFESA-N 0 3 416.606 4.235 20 0 HIADHN CCN(C(=O)c1cc(Br)cn1C)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000501952532 910939438 /nfs/dbraw/zinc/93/94/38/910939438.db2.gz FTQJLMMWAZLFOS-YJBOKZPZSA-N 0 3 404.352 4.085 20 0 HIADHN CCN(C(=O)[C@H](C)OCc1cccc(OC)c1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000501965285 910952219 /nfs/dbraw/zinc/95/22/19/910952219.db2.gz TWCVFWHRQQZTDO-JTAQYXEDSA-N 0 3 410.558 4.284 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3CC[C@@H](c4ccccc4F)C3)c(C)c2)CC1 ZINC000502050732 911002806 /nfs/dbraw/zinc/00/28/06/911002806.db2.gz OZMKJYZSUXEQNZ-LJQANCHMSA-N 0 3 410.537 4.297 20 0 HIADHN Cc1ccc(NC(=O)CN[C@@]2(Cc3ccc(C(F)(F)F)cc3)CCOC2)c(C)c1 ZINC000513210439 921625913 /nfs/dbraw/zinc/62/59/13/921625913.db2.gz PRJUMZNUZVKGDE-OAQYLSRUSA-N 0 3 406.448 4.252 20 0 HIADHN CCCN(CCC)C(=O)c1cccc(C(=O)NC[C@@H]2CCCN2Cc2ccccc2)c1 ZINC000513216468 921631628 /nfs/dbraw/zinc/63/16/28/921631628.db2.gz CQITYKRSENAKJD-DEOSSOPVSA-N 0 3 421.585 4.343 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CC[C@H](c2ccccc2F)C1)c1cccc(OC)c1 ZINC000502176275 911098746 /nfs/dbraw/zinc/09/87/46/911098746.db2.gz YGVVMSCLBYMJFP-CVDCTZTESA-N 0 3 413.537 4.416 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)c3ccccc3Oc3ccncc3)cc2)CC1 ZINC000513222747 921637217 /nfs/dbraw/zinc/63/72/17/921637217.db2.gz PMEVQVTXWQZHNA-UHFFFAOYSA-N 0 3 416.525 4.264 20 0 HIADHN C[C@@H](c1ccccc1)N(C)C(=O)CNC(C)(C)COc1ncccc1C(F)(F)F ZINC000502236971 911189003 /nfs/dbraw/zinc/18/90/03/911189003.db2.gz AMBCXUNVGFYNLR-HNNXBMFYSA-N 0 3 409.452 4.067 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)CCc1cc2ccccc2[nH]c1=O)c1cccc(OC)c1 ZINC000502256457 911210007 /nfs/dbraw/zinc/21/00/07/911210007.db2.gz HWHXUJYFTWAXAC-QHCPKHFHSA-N 0 3 421.541 4.081 20 0 HIADHN C[C@@H](c1ccccc1)N(C)C(=O)CNC(C)(C)COc1ccc(C(F)(F)F)cn1 ZINC000502267337 911215501 /nfs/dbraw/zinc/21/55/01/911215501.db2.gz IVISRODEUASUFV-HNNXBMFYSA-N 0 3 409.452 4.067 20 0 HIADHN Cc1cc(C)c(NC(=O)CNC(C)(C)COc2ccc(C(F)(F)F)cn2)c(C)c1 ZINC000502294393 911253271 /nfs/dbraw/zinc/25/32/71/911253271.db2.gz VIFDLIXLYRXRIO-UHFFFAOYSA-N 0 3 409.452 4.411 20 0 HIADHN C[C@@H](NC(=O)NCC(C)(C)N1CCc2ccccc2C1)c1ccc(OC(F)F)cc1 ZINC000502308715 911271620 /nfs/dbraw/zinc/27/16/20/911271620.db2.gz ITWYUMLABAVIPI-MRXNPFEDSA-N 0 3 417.500 4.485 20 0 HIADHN CCCn1nccc1C1CCN(Cc2ccc(OC)c3oc(C(=O)OC)cc32)CC1 ZINC000502316566 911289672 /nfs/dbraw/zinc/28/96/72/911289672.db2.gz YKWJOERRRHVSCX-UHFFFAOYSA-N 0 3 411.502 4.214 20 0 HIADHN C[C@@H](CC(=O)N(C)c1ccccc1)N[C@@H]1CCOc2c(Br)cccc21 ZINC000502369806 911356532 /nfs/dbraw/zinc/35/65/32/911356532.db2.gz UJFJRAGWOARMFD-KBXCAEBGSA-N 0 3 403.320 4.304 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)c2cccc(-c3noc(C(F)(F)F)n3)c2)c1 ZINC000502488914 911485709 /nfs/dbraw/zinc/48/57/09/911485709.db2.gz QWSHHNUPOOQVJE-UHFFFAOYSA-N 0 3 404.392 4.378 20 0 HIADHN O=C(NC[C@H]1CCCN1Cc1ccccc1)c1ccc(Br)cc1Cl ZINC000513265928 921669632 /nfs/dbraw/zinc/66/96/32/921669632.db2.gz FIPRYUHGWHEQLN-MRXNPFEDSA-N 0 3 407.739 4.497 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Cc1ccc2c(c1)OCO2)c1ccc(C(F)(F)F)cc1 ZINC000502538893 911544718 /nfs/dbraw/zinc/54/47/18/911544718.db2.gz DVQLZEHDDFYCNH-SFHVURJKSA-N 0 3 422.447 4.176 20 0 HIADHN CCN(Cc1ccc(OC)c(OC)c1)C(=O)CN[C@H](c1ccc(F)cc1)C(C)C ZINC000502591996 911594890 /nfs/dbraw/zinc/59/48/90/911594890.db2.gz OMITXDADAVRQTO-QHCPKHFHSA-N 0 3 402.510 4.178 20 0 HIADHN O=C(CN[C@]1(Cc2ccc(Cl)cc2)CCOC1)Nc1ccccc1C(F)(F)F ZINC000502601884 911608271 /nfs/dbraw/zinc/60/82/71/911608271.db2.gz RIPDQTYQDLZDJX-IBGZPJMESA-N 0 3 412.839 4.289 20 0 HIADHN COc1ccccc1OCc1ccc(C(=O)NC[C@H]2CCCN2Cc2ccccc2)o1 ZINC000513274780 921675451 /nfs/dbraw/zinc/67/54/51/921675451.db2.gz XCNZYMYKLIGTML-HXUWFJFHSA-N 0 3 420.509 4.262 20 0 HIADHN CC1CCN([C@@H](CNC(=O)[C@@H](c2ccccc2)n2cccn2)c2cccs2)CC1 ZINC000513286272 921684331 /nfs/dbraw/zinc/68/43/31/921684331.db2.gz DCKGEBQMPAFCMT-RBBKRZOGSA-N 0 3 408.571 4.123 20 0 HIADHN CCCOc1ccc([C@@H](C)NC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1OC ZINC000502667448 911708806 /nfs/dbraw/zinc/70/88/06/911708806.db2.gz MDDCOQUMQQSJEN-WIYYLYMNSA-N 0 3 411.546 4.119 20 0 HIADHN CSc1ccc(O[C@@H](C)C(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)cc1 ZINC000502881400 911882661 /nfs/dbraw/zinc/88/26/61/911882661.db2.gz RBOCDOKZNUBLHQ-SFHVURJKSA-N 0 3 413.587 4.345 20 0 HIADHN CCN(CC)c1nc2sc(C(=O)N3CCCC[C@@H](N4CCCC4)C3)cc2s1 ZINC000502935321 911921983 /nfs/dbraw/zinc/92/19/83/911921983.db2.gz LKBJVVOWRIVHAC-OAHLLOKOSA-N 0 3 406.621 4.295 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)c1cnccc1Oc1ccccc1 ZINC000502996297 911972324 /nfs/dbraw/zinc/97/23/24/911972324.db2.gz ZQUGNLIVDIMNPL-UHFFFAOYSA-N 0 3 403.482 4.083 20 0 HIADHN CCOc1ccccc1NC(=O)[C@@H](c1ccccc1)N(C)CCCn1ccnc1C ZINC000503070337 912039211 /nfs/dbraw/zinc/03/92/11/912039211.db2.gz CCDVCEFQDPXZAL-HSZRJFAPSA-N 0 3 406.530 4.292 20 0 HIADHN COc1cc(CN2CCC[C@H](C(=O)Nc3ccccc3)C2)c(SC)cc1OC ZINC000506283569 914882792 /nfs/dbraw/zinc/88/27/92/914882792.db2.gz WSCCGYUQUSNOFR-INIZCTEOSA-N 0 3 400.544 4.276 20 0 HIADHN CCOc1cc(CN(C)[C@H](C)c2ccc(OC)cc2)ccc1O[C@@H](C)C(=O)N(C)C ZINC000506326670 914933831 /nfs/dbraw/zinc/93/38/31/914933831.db2.gz QEHAEIRHBYSJEA-MSOLQXFVSA-N 0 3 414.546 4.142 20 0 HIADHN COc1ccc(NC(=O)c2cccc(CN3CCCC3)c2)cc1OCC(F)(F)F ZINC000513355090 921733685 /nfs/dbraw/zinc/73/36/85/921733685.db2.gz HOAGUFVMKLYBPK-UHFFFAOYSA-N 0 3 408.420 4.484 20 0 HIADHN Cc1ccc(-c2nnco2)cc1NC(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000506337553 914953492 /nfs/dbraw/zinc/95/34/92/914953492.db2.gz BNWMWFVBZNYGNJ-GOSISDBHSA-N 0 3 412.440 4.141 20 0 HIADHN CCCNC(=O)C1CCN(Cc2ccc(-c3ccc(Br)cc3)o2)CC1 ZINC000506354140 914972554 /nfs/dbraw/zinc/97/25/54/914972554.db2.gz AJWSIVKUYQROLN-UHFFFAOYSA-N 0 3 405.336 4.447 20 0 HIADHN COc1cc(CN2CCC(CO)CC2)ccc1OCCOc1ccccc1Cl ZINC000506371458 914995425 /nfs/dbraw/zinc/99/54/25/914995425.db2.gz SXGOOPTXCLXQTE-UHFFFAOYSA-N 0 3 405.922 4.011 20 0 HIADHN COc1ccccc1O[C@@H]1CCCN(Cc2ccc(OCc3nccn3C)cc2)C1 ZINC000513368314 921742410 /nfs/dbraw/zinc/74/24/10/921742410.db2.gz VELLTUPKOCCHPX-OAQYLSRUSA-N 0 3 407.514 4.051 20 0 HIADHN CNC(=O)c1cccc(CN2CCC[C@H](c3nc(-c4ccc(Cl)cc4)no3)C2)c1 ZINC000506470972 915068274 /nfs/dbraw/zinc/06/82/74/915068274.db2.gz OGZIVTUOFSUYBH-SFHVURJKSA-N 0 3 410.905 4.129 20 0 HIADHN CC[C@H](N[C@H](C)C(=O)NC(=O)Nc1ccc(C)cc1C)c1ccc(OC)c(OC)c1 ZINC000506600795 915250801 /nfs/dbraw/zinc/25/08/01/915250801.db2.gz HJZJBCHNZOLPIX-AEFFLSMTSA-N 0 3 413.518 4.098 20 0 HIADHN NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC[C@@H](OCC1CC1)c1ccc(Cl)cc1 ZINC000506617043 915272373 /nfs/dbraw/zinc/27/23/73/915272373.db2.gz NDXNCNGVPVRNCJ-WOJBJXKFSA-N 0 3 407.341 4.147 20 0 HIADHN COc1ccc([C@H]2CCCN2Cc2ccc(OCc3noc(C)n3)cc2)cc1OC ZINC000506631464 915298305 /nfs/dbraw/zinc/29/83/05/915298305.db2.gz JJJUDQITWMTVIE-HXUWFJFHSA-N 0 3 409.486 4.311 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)CCN1CCCN(c2ccccc2F)CC1 ZINC000513392862 921763879 /nfs/dbraw/zinc/76/38/79/921763879.db2.gz YXLKQTRRMNBSNW-UHFFFAOYSA-N 0 3 405.901 4.029 20 0 HIADHN O=C(N[C@@H]1COc2cc(F)c(Br)cc21)c1cccc(CN2CCCC2)c1 ZINC000506675101 915352139 /nfs/dbraw/zinc/35/21/39/915352139.db2.gz ZRNGZDIFFJHFEG-GOSISDBHSA-N 0 3 419.294 4.048 20 0 HIADHN FC(F)(F)c1ccn(-c2ccc(CN3CCCN(Cc4cscn4)CC3)cc2)n1 ZINC000513396678 921767494 /nfs/dbraw/zinc/76/74/94/921767494.db2.gz FSDNOISRGHFVTC-UHFFFAOYSA-N 0 3 421.492 4.056 20 0 HIADHN CCCCOc1cc(CN2CCC(C(=O)NCc3ccccc3)CC2)ccc1OC ZINC000506744604 915434548 /nfs/dbraw/zinc/43/45/48/915434548.db2.gz SDAOSSDGCNCZJN-UHFFFAOYSA-N 0 3 410.558 4.403 20 0 HIADHN c1nc(N2CCOCC2)sc1CN(Cc1ccc2c(c1)OCO2)C1CCCCC1 ZINC000513418882 921786702 /nfs/dbraw/zinc/78/67/02/921786702.db2.gz DGSHQWVGZBKSPC-UHFFFAOYSA-N 0 3 415.559 4.043 20 0 HIADHN CCSc1cccc(NC(=O)NCc2ccc(CN3CCN(CC)CC3)cc2)c1 ZINC000506877085 915667627 /nfs/dbraw/zinc/66/76/27/915667627.db2.gz QRQVZDDURZFDKT-UHFFFAOYSA-N 0 3 412.603 4.258 20 0 HIADHN O=C(NCCc1cc(F)c(F)c(F)c1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000506898314 915693472 /nfs/dbraw/zinc/69/34/72/915693472.db2.gz MTKCPNXJRYQKGV-UHFFFAOYSA-N 0 3 423.504 4.059 20 0 HIADHN C[C@@H](C(=O)Nc1cccc(CSc2ccccn2)c1)N1CCN(C2CCCC2)CC1 ZINC000506950765 915756337 /nfs/dbraw/zinc/75/63/37/915756337.db2.gz AULBVGLPADFNNK-IBGZPJMESA-N 0 3 424.614 4.261 20 0 HIADHN COc1cc(CN2CCC[C@@H](C(=O)NCC3CC3)C2)ccc1OCc1cccs1 ZINC000507069390 915851766 /nfs/dbraw/zinc/85/17/66/915851766.db2.gz FOSDBLDSASLIEY-LJQANCHMSA-N 0 3 414.571 4.074 20 0 HIADHN COc1cc(CN2CCC[C@@H](C(=O)NCC3CC3)C2)ccc1OCc1ccccc1 ZINC000507075883 915855303 /nfs/dbraw/zinc/85/53/03/915855303.db2.gz DOMKSKARZAOUBM-JOCHJYFZSA-N 0 3 408.542 4.012 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)N1CCC(N2CCc3ccccc32)CC1 ZINC000507097561 915868240 /nfs/dbraw/zinc/86/82/40/915868240.db2.gz PUANPTHIGKTMRH-DEOSSOPVSA-N 0 3 418.585 4.060 20 0 HIADHN COc1cc(OC)cc(Oc2ccc(CN3CCC(NC(=O)C(C)C)CC3)cc2)c1 ZINC000507114812 915875246 /nfs/dbraw/zinc/87/52/46/915875246.db2.gz CCFJRZKSALJWBZ-UHFFFAOYSA-N 0 3 412.530 4.233 20 0 HIADHN CCCn1nccc1C1CCN(C(=O)NC[C@H](CC)N2CCc3ccccc3C2)CC1 ZINC000507118311 915876317 /nfs/dbraw/zinc/87/63/17/915876317.db2.gz MODGEALZLAFOJS-QHCPKHFHSA-N 0 3 423.605 4.019 20 0 HIADHN CCOc1cc(CN2CCC(C(=O)NCc3ccc(C)c(F)c3)CC2)ccc1OC ZINC000507144276 915888503 /nfs/dbraw/zinc/88/85/03/915888503.db2.gz PBMBNPHGKFKZFW-UHFFFAOYSA-N 0 3 414.521 4.070 20 0 HIADHN CCOc1cc(CN(C)Cc2ccc(C)s2)ccc1OCC(=O)N1CCCCC1 ZINC000513437962 921806598 /nfs/dbraw/zinc/80/65/98/921806598.db2.gz HNGATCBGAVFDEN-UHFFFAOYSA-N 0 3 416.587 4.479 20 0 HIADHN Cc1nc2cc(F)cc(C(=O)N3CCCN(CCCc4ccccc4)CC3)c2nc1C ZINC000507162467 915901560 /nfs/dbraw/zinc/90/15/60/915901560.db2.gz NUYNJPVUCBCLLH-UHFFFAOYSA-N 0 3 420.532 4.166 20 0 HIADHN CCOc1cc(CN(Cc2ccco2)C2CCCC2)ccc1O[C@H](C)C(=O)N(C)C ZINC000507217092 915967789 /nfs/dbraw/zinc/96/77/89/915967789.db2.gz ZZVQYSDQUNUJJY-GOSISDBHSA-N 0 3 414.546 4.479 20 0 HIADHN CN(CCC(=O)Nc1ccc(Br)cc1F)C[C@H]1OCCc2ccccc21 ZINC000507263933 916027257 /nfs/dbraw/zinc/02/72/57/916027257.db2.gz QETXGROCDNPTCB-LJQANCHMSA-N 0 3 421.310 4.163 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N[C@@H](c2nccs2)c2ccccc2)C1 ZINC000507334670 916091653 /nfs/dbraw/zinc/09/16/53/916091653.db2.gz RGPVMCUYKSNHGF-JRGCBEDISA-N 0 3 406.555 4.367 20 0 HIADHN O=C1NCCCC[C@@H]1N[C@H]1CCCc2nc(-c3ccccc3Br)sc21 ZINC000507441562 916210740 /nfs/dbraw/zinc/21/07/40/916210740.db2.gz ICPNBVFRSXCLPI-HOCLYGCPSA-N 0 3 420.376 4.208 20 0 HIADHN CC[C@H]1C[C@]1(NC(=O)NCc1ccccc1CN1CCC(O)CC1)c1cccc(C)c1 ZINC000507581701 916337143 /nfs/dbraw/zinc/33/71/43/916337143.db2.gz CWXZJKCZSKYAQS-BKMJKUGQSA-N 0 3 421.585 4.076 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)C[C@@H]3CCO[C@@H](CC)C3)c(OCC)c2)CC1 ZINC000507605553 916363494 /nfs/dbraw/zinc/36/34/94/916363494.db2.gz YKXXDLXHTYGKAS-CTNGQTDRSA-N 0 3 417.594 4.151 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)c2ccc(OCc3ccncc3)cc2)C1 ZINC000507615684 916374267 /nfs/dbraw/zinc/37/42/67/916374267.db2.gz ZLXAGYVHDVWAPT-WMZHIEFXSA-N 0 3 401.510 4.226 20 0 HIADHN CCOc1cc(NC(=O)[C@@H]2CN(Cc3ccccc3)CCC2(F)F)ccc1OC ZINC000507674533 916442875 /nfs/dbraw/zinc/44/28/75/916442875.db2.gz UAVVUFYQTZOXIG-SFHVURJKSA-N 0 3 404.457 4.190 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)c1ccccc1N1CCCCC1 ZINC000507688531 916462446 /nfs/dbraw/zinc/46/24/46/916462446.db2.gz RFDBXFXMHSUKRO-UHFFFAOYSA-N 0 3 420.601 4.009 20 0 HIADHN CC(C)c1ccccc1OC[C@@H](O)CN1CCC(C(=O)Nc2cccc(F)c2)CC1 ZINC000507773172 916558560 /nfs/dbraw/zinc/55/85/60/916558560.db2.gz RJSMTCDBTIENNB-NRFANRHFSA-N 0 3 414.521 4.040 20 0 HIADHN COc1cc(CN[C@@H]2CCc3c2cc(Cl)cc3Cl)ccc1OCC(=O)N(C)C ZINC000507796613 916579455 /nfs/dbraw/zinc/57/94/55/916579455.db2.gz WJUVHCOFLJOOEH-GOSISDBHSA-N 0 3 423.340 4.246 20 0 HIADHN COc1cc(CN[C@H]2CC(=O)N(C)[C@H]2c2ccc(Cl)cc2)cc(Cl)c1OC ZINC000507848148 916668468 /nfs/dbraw/zinc/66/84/68/916668468.db2.gz SANMRTMRCUFYDL-LPHOPBHVSA-N 0 3 409.313 4.072 20 0 HIADHN CC(=O)Nc1ccccc1CNCc1ccccc1-c1ccc(Cn2cncn2)cc1 ZINC000507866126 916701346 /nfs/dbraw/zinc/70/13/46/916701346.db2.gz XWWPVYAXZOGPNL-UHFFFAOYSA-N 0 3 411.509 4.242 20 0 HIADHN COc1ccc(CCN[C@@H](C(=O)N2CCCCC2)c2ccccc2)cc1OC(F)F ZINC000507880708 916722523 /nfs/dbraw/zinc/72/25/23/916722523.db2.gz QNEMAKLAUHXECY-OAQYLSRUSA-N 0 3 418.484 4.183 20 0 HIADHN CCOC(=O)C1CCN(C(=O)[C@@H](C)N[C@@H](C)c2ccc(Oc3ccccc3)cc2)CC1 ZINC000507892552 916745570 /nfs/dbraw/zinc/74/55/70/916745570.db2.gz HCBYZZKXXBIMDT-RBUKOAKNSA-N 0 3 424.541 4.320 20 0 HIADHN Cc1ccc(NC(=O)[C@@H]2CCCN(Cc3cccc(OCC(F)(F)F)c3)C2)nc1 ZINC000507995792 916837186 /nfs/dbraw/zinc/83/71/86/916837186.db2.gz YPDIHLAACPCULT-QGZVFWFLSA-N 0 3 407.436 4.182 20 0 HIADHN Cc1ccc(NC(=O)[C@H]2CCCN(Cc3ccc(OCc4ccccn4)cc3)C2)nc1 ZINC000507997112 916838561 /nfs/dbraw/zinc/83/85/61/916838561.db2.gz FRVKYKUTVYFPMM-NRFANRHFSA-N 0 3 416.525 4.215 20 0 HIADHN Cc1ccc(NC(=O)C2CCN(Cc3cccc(OCc4ccccn4)c3)CC2)nc1 ZINC000508007244 916846050 /nfs/dbraw/zinc/84/60/50/916846050.db2.gz CDFAGVMZLQVETG-UHFFFAOYSA-N 0 3 416.525 4.215 20 0 HIADHN O=C(CCCC(=O)N1CCCN(CC2CCC2)CC1)c1ccc(Br)cc1 ZINC000508020404 916857533 /nfs/dbraw/zinc/85/75/33/916857533.db2.gz GKOQVBRQDVUWJN-UHFFFAOYSA-N 0 3 421.379 4.137 20 0 HIADHN O=C(CSCc1cccc(Cl)c1)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000508060278 916884598 /nfs/dbraw/zinc/88/45/98/916884598.db2.gz SUYBYUJZNRAUNO-UHFFFAOYSA-N 0 3 418.990 4.416 20 0 HIADHN Cc1ccc2[nH]c([C@@H]3CCCN(C(=O)c4cccc(CN5CCCC5)c4)C3)nc2c1 ZINC000508237531 917056116 /nfs/dbraw/zinc/05/61/16/917056116.db2.gz PEMZZILYBXBTQD-OAQYLSRUSA-N 0 3 402.542 4.487 20 0 HIADHN COCCN(Cc1ccc(-n2cncn2)cc1)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000508540256 917321149 /nfs/dbraw/zinc/32/11/49/917321149.db2.gz BSPFNMUQHXJQAD-INIZCTEOSA-N 0 3 404.436 4.496 20 0 HIADHN COCCN(Cc1cn(C)nc1-c1ccc2c(c1)OCCCO2)[C@@H](C)c1ccccc1 ZINC000508542388 917321946 /nfs/dbraw/zinc/32/19/46/917321946.db2.gz FIBGYJVPDMKPOQ-IBGZPJMESA-N 0 3 421.541 4.458 20 0 HIADHN COCCSc1ccc([C@@H](C)NC(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000508562755 917338049 /nfs/dbraw/zinc/33/80/49/917338049.db2.gz WYWOFCJUVFUNIS-NQIIRXRSSA-N 0 3 413.587 4.060 20 0 HIADHN COc1ccc2c(c1)CN(C(=O)[C@@]1(C(F)(F)F)CCN(Cc3ccccc3)C1)CC2 ZINC000508602654 917373579 /nfs/dbraw/zinc/37/35/79/917373579.db2.gz FGCUIZSALBCRHJ-JOCHJYFZSA-N 0 3 418.459 4.035 20 0 HIADHN CC(C)S(=O)(=O)Cc1cccc(N[C@H](C)[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000508693757 917454963 /nfs/dbraw/zinc/45/49/63/917454963.db2.gz DTKHJFSKXKIYTR-KNQAVFIVSA-N 0 3 400.588 4.332 20 0 HIADHN Brc1ccc([C@@H](NCc2ccccc2Cn2cncn2)C2CC2)s1 ZINC000508734787 917494890 /nfs/dbraw/zinc/49/48/90/917494890.db2.gz SQOXPDSBUHUZPH-SFHVURJKSA-N 0 3 403.349 4.391 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)c2ccc([C@H]3CCCOC3)cc2)cc1 ZINC000508827313 917580656 /nfs/dbraw/zinc/58/06/56/917580656.db2.gz JMSJBCVZOUCETG-LADGPHEKSA-N 0 3 408.542 4.156 20 0 HIADHN C[C@@H](NC(=O)N(Cc1ccc(F)cc1)C1CCOCC1)[C@H](c1ccccc1)N(C)C ZINC000508852267 917606423 /nfs/dbraw/zinc/60/64/23/917606423.db2.gz JWMUPDYCQHOOFR-WZONZLPQSA-N 0 3 413.537 4.208 20 0 HIADHN COC[C@H](c1ccc(Cl)cc1)N(C)C(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C ZINC000508899776 917655160 /nfs/dbraw/zinc/65/51/60/917655160.db2.gz QMDLKCKCYXTGRN-ZLGUVYLKSA-N 0 3 403.954 4.360 20 0 HIADHN C[C@H](NC(=O)N[C@H](CO)c1c(Cl)cccc1Cl)[C@@H](c1ccccc1)N(C)C ZINC000508898873 917655189 /nfs/dbraw/zinc/65/51/89/917655189.db2.gz RXBPXHBKHJGOTQ-IRWQIABSSA-N 0 3 410.345 4.017 20 0 HIADHN C[C@H](NC(=O)N1CCO[C@@H](c2ccccc2Cl)C1)[C@H](c1ccccc1)N(C)C ZINC000508907754 917663671 /nfs/dbraw/zinc/66/36/71/917663671.db2.gz QWXBSPNDDBMGFX-ZLGUVYLKSA-N 0 3 401.938 4.114 20 0 HIADHN O=C(Nc1ccc(-n2cccn2)cc1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000508916396 917673592 /nfs/dbraw/zinc/67/35/92/917673592.db2.gz ATHVJRCJZLPHCB-NRFANRHFSA-N 0 3 414.431 4.265 20 0 HIADHN C[C@H](NC(=O)N1CCO[C@H](c2ccc(F)c(Cl)c2)C1)[C@@H](c1ccccc1)N(C)C ZINC000508925980 917684922 /nfs/dbraw/zinc/68/49/22/917684922.db2.gz UPVUOCAKJAFJAI-JHVJFLLYSA-N 0 3 419.928 4.253 20 0 HIADHN COCCOc1cccc(NC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)c1 ZINC000508942519 917700475 /nfs/dbraw/zinc/70/04/75/917700475.db2.gz RAWDEIQUTNKFNQ-OAQYLSRUSA-N 0 3 422.447 4.105 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)c2cn3cc(Cl)cc(Cl)c3n2)CC1 ZINC000508988991 917743712 /nfs/dbraw/zinc/74/37/12/917743712.db2.gz XVRHNVHGSRRNNO-UHFFFAOYSA-N 0 3 417.340 4.378 20 0 HIADHN CN(C)C[C@H](NC(=O)NCc1c(F)cccc1N1CCCC1)c1ccc(Cl)cc1 ZINC000509015461 917768972 /nfs/dbraw/zinc/76/89/72/917768972.db2.gz IKYJTYVDMFYEDR-FQEVSTJZSA-N 0 3 418.944 4.181 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1ccc([C@H]2CCCOC2)cc1 ZINC000509023660 917776746 /nfs/dbraw/zinc/77/67/46/917776746.db2.gz OKPOLBKOCYVJIH-QHCPKHFHSA-N 0 3 408.542 4.037 20 0 HIADHN CCCN(C(=O)c1cc2ccccc2c(=O)n1C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000509093129 917834371 /nfs/dbraw/zinc/83/43/71/917834371.db2.gz HSYIIUJTPHPLOT-JOCHJYFZSA-N 0 3 417.553 4.055 20 0 HIADHN CC(C)(C)c1cnc(CCC(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)o1 ZINC000509185733 917895077 /nfs/dbraw/zinc/89/50/77/917895077.db2.gz LCQWEVUBOXYYTJ-IBGZPJMESA-N 0 3 421.545 4.187 20 0 HIADHN CCN(CCc1c(C)nc2sccn2c1=O)Cc1cc(Br)ccc1F ZINC000509263967 917954018 /nfs/dbraw/zinc/95/40/18/917954018.db2.gz OLGSXQQMGWJHIM-UHFFFAOYSA-N 0 3 424.339 4.031 20 0 HIADHN COc1ccccc1SC[C@H](C)CNC(=O)NC[C@@H](c1ccccc1)N(C)C ZINC000509360375 918026939 /nfs/dbraw/zinc/02/69/39/918026939.db2.gz VZWCHUVDPSNGTI-MJGOQNOKSA-N 0 3 401.576 4.026 20 0 HIADHN O=C(Nc1ccc(Cl)cn1)[C@@H]1CCCN(Cc2c[nH]nc2-c2ccc(F)cc2)C1 ZINC000509378468 918043903 /nfs/dbraw/zinc/04/39/03/918043903.db2.gz KALWVNQKFFWJQL-OAHLLOKOSA-N 0 3 413.884 4.115 20 0 HIADHN COC(=O)CCn1nc(C)c(CN2CCC[C@H]2Cc2c(F)cccc2Cl)c1C ZINC000509381126 918048553 /nfs/dbraw/zinc/04/85/53/918048553.db2.gz WTTRRHJSSMTEAB-INIZCTEOSA-N 0 3 407.917 4.063 20 0 HIADHN Cc1cc(CNCc2ccc(-c3cnn(C)c3)s2)ccc1I ZINC000509428560 918087703 /nfs/dbraw/zinc/08/77/03/918087703.db2.gz GUCAWNKAZYVTHN-UHFFFAOYSA-N 0 3 423.323 4.351 20 0 HIADHN O=C1c2ccccc2C(=O)N1C1CCC(NCc2ccsc2Br)CC1 ZINC000509430072 918087971 /nfs/dbraw/zinc/08/79/71/918087971.db2.gz OGFJBVOKDSWTCI-UHFFFAOYSA-N 0 3 419.344 4.208 20 0 HIADHN CCC[C@@H](NCc1ccc(-c2cnn(C)c2)s1)C(=O)N1CCc2sccc2C1 ZINC000509462117 918112436 /nfs/dbraw/zinc/11/24/36/918112436.db2.gz GAKDSDKOSLNLTK-GOSISDBHSA-N 0 3 414.600 4.053 20 0 HIADHN Cn1cc(-c2ccc(CN[C@H]3CC(=O)N(c4cccc(C(F)(F)F)c4)C3)s2)cn1 ZINC000509474496 918121331 /nfs/dbraw/zinc/12/13/31/918121331.db2.gz ZQBNKZPNYJMGMT-HNNXBMFYSA-N 0 3 420.460 4.063 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCCC1)c1ccccc1Oc1ccncc1 ZINC000509473941 918121607 /nfs/dbraw/zinc/12/16/07/918121607.db2.gz XONFCOHPNZZHHS-UHFFFAOYSA-N 0 3 411.571 4.355 20 0 HIADHN Cn1cc(-c2ccc(CNCc3ccc(N4CCc5ccccc5C4)nc3)s2)cn1 ZINC000509532281 918179718 /nfs/dbraw/zinc/17/97/18/918179718.db2.gz JHGOHOJLDIEUPV-UHFFFAOYSA-N 0 3 415.566 4.396 20 0 HIADHN Cn1cc(-c2ccc(CNCc3cccc(NC(=O)c4ccccn4)c3)s2)cn1 ZINC000509544914 918194204 /nfs/dbraw/zinc/19/42/04/918194204.db2.gz WQHNJWFQXDFKMC-UHFFFAOYSA-N 0 3 403.511 4.086 20 0 HIADHN CC(C)Cc1cccc([C@@H](C)C(=O)Nc2ccccc2CN2CCC[C@H](C(N)=O)C2)c1 ZINC000509563442 918213047 /nfs/dbraw/zinc/21/30/47/918213047.db2.gz GQPIULACWCSWBN-XXBNENTESA-N 0 3 421.585 4.325 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N1CCCc2c([nH]c3c2cccc3F)C1)c1ccco1 ZINC000509567289 918217384 /nfs/dbraw/zinc/21/73/84/918217384.db2.gz IOGBNQZCHOTVKA-KXBFYZLASA-N 0 3 412.509 4.487 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N(C)[C@@H](COC)c1ccc(Cl)cc1)c1ccco1 ZINC000509571025 918220781 /nfs/dbraw/zinc/22/07/81/918220781.db2.gz RNKMQYFZMLGGSM-SNRMKQJTSA-N 0 3 407.942 4.391 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)N(C)Cc1ccc(Br)cc1)c1ccco1 ZINC000509576067 918224602 /nfs/dbraw/zinc/22/46/02/918224602.db2.gz CPTRVPIZJRITGD-RHSMWYFYSA-N 0 3 408.340 4.313 20 0 HIADHN CC(C)N(C)C(=O)C1CCN(Cc2cn(-c3ccccc3)nc2-c2cccnc2)CC1 ZINC000509585712 918235598 /nfs/dbraw/zinc/23/55/98/918235598.db2.gz QCLKTVUGXAZSEN-UHFFFAOYSA-N 0 3 417.557 4.013 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)N1CCC2(CC1)OCCc1ccsc12)c1ccco1 ZINC000509595988 918246977 /nfs/dbraw/zinc/24/69/77/918246977.db2.gz LYMKJMZTEIYGEY-SJLPKXTDSA-N 0 3 417.575 4.044 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N1CCO[C@H](c2ccccc2Cl)C1)c1ccco1 ZINC000509597169 918247721 /nfs/dbraw/zinc/24/77/21/918247721.db2.gz YKAFIRPUCXJVQQ-QSFXBCCZSA-N 0 3 405.926 4.145 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N1CC[C@](F)(c2cc(F)cc(F)c2)C1)c1ccco1 ZINC000509601662 918252536 /nfs/dbraw/zinc/25/25/36/918252536.db2.gz LLVXLRYHOYDVOE-FIKMYACPSA-N 0 3 409.452 4.267 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)N(Cc1ccccc1)CC1(O)CCCC1)c1ccco1 ZINC000509613067 918261471 /nfs/dbraw/zinc/26/14/71/918261471.db2.gz IAXYCDNGDQOJJI-CTNGQTDRSA-N 0 3 413.562 4.226 20 0 HIADHN Cc1cc(Br)cc2c1[C@H](NCc1nnc(-c3ccc(F)cc3)[nH]1)CC2 ZINC000562363287 945064105 /nfs/dbraw/zinc/06/41/05/945064105.db2.gz VWJQUSCREULVBE-MRXNPFEDSA-N 0 3 401.283 4.459 20 0 HIADHN Cc1cc(Br)cc2c1[C@H]([NH2+]Cc1nnc(-c3ccc(F)cc3)[n-]1)CC2 ZINC000562363287 945064117 /nfs/dbraw/zinc/06/41/17/945064117.db2.gz VWJQUSCREULVBE-MRXNPFEDSA-N 0 3 401.283 4.459 20 0 HIADHN CCC(C)(C)c1ccc(C(=O)Nc2cccc(CN3CCC(C(N)=O)CC3)c2)cc1 ZINC000509696573 918327566 /nfs/dbraw/zinc/32/75/66/918327566.db2.gz HDMGTEGEHBZKOO-UHFFFAOYSA-N 0 3 407.558 4.324 20 0 HIADHN CCOC[C@@H]1CCCN([C@H]2CCCN(c3c(C)cc(Br)cc3C)C2=O)C1 ZINC000509701117 918331601 /nfs/dbraw/zinc/33/16/01/918331601.db2.gz UULIGQCJXFWWCF-MJGOQNOKSA-N 0 3 423.395 4.310 20 0 HIADHN COc1ccc(-c2n[nH]cc2CN2CCC(NC(=O)Nc3ccc(F)cc3)CC2)cc1 ZINC000509747293 918366145 /nfs/dbraw/zinc/36/61/45/918366145.db2.gz PRDUYPZMICPIPG-UHFFFAOYSA-N 0 3 423.492 4.011 20 0 HIADHN O=C(Nc1ccc(F)cc1)NC1CCN(Cc2ccc(Oc3cnccn3)cc2)CC1 ZINC000509762900 918377739 /nfs/dbraw/zinc/37/77/39/918377739.db2.gz OZAIUDKJWALYTP-UHFFFAOYSA-N 0 3 421.476 4.194 20 0 HIADHN CCN(C(=O)NC[C@@H]1CCCN1C)[C@H]1CCSc2ccc(Br)cc21 ZINC000509787143 918395563 /nfs/dbraw/zinc/39/55/63/918395563.db2.gz NITTUVPQJWKFAE-HOCLYGCPSA-N 0 3 412.397 4.112 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)Nc3cccc4[nH]ccc43)CC2)c1 ZINC000509984119 918572394 /nfs/dbraw/zinc/57/23/94/918572394.db2.gz SFQKYRVWHVJFKQ-UHFFFAOYSA-N 0 3 405.546 4.200 20 0 HIADHN COc1ccc(NC(C)=O)cc1NC(=O)[C@H](C)N1CCC[C@](C)(c2ccccc2)CC1 ZINC000510138717 918695354 /nfs/dbraw/zinc/69/53/54/918695354.db2.gz DHCPSJZGFFGVMJ-BVZFJXPGSA-N 0 3 423.557 4.424 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)NCC(=O)Nc1cc(Cl)ccc1Cl ZINC000510179271 918729573 /nfs/dbraw/zinc/72/95/73/918729573.db2.gz FAMMLJDXPXPEJE-UHFFFAOYSA-N 0 3 420.296 4.170 20 0 HIADHN CN(Cc1c[nH]nc1-c1cccs1)C[C@H](O)COc1ccc(C(F)(F)F)cc1 ZINC000510191948 918740541 /nfs/dbraw/zinc/74/05/41/918740541.db2.gz JIEUIACVALLZMO-HNNXBMFYSA-N 0 3 411.449 4.029 20 0 HIADHN CCn1c2ccc(Br)cc2nc1NC(=O)c1ccc(CN(C)C)cc1 ZINC000510229700 918771420 /nfs/dbraw/zinc/77/14/20/918771420.db2.gz QKLXDAPMGQAYLV-UHFFFAOYSA-N 0 3 401.308 4.133 20 0 HIADHN CC[C@@H](NCC(=O)N(CC)[C@@H](C)c1ccc(F)cc1)c1ccc(OC)c(OC)c1 ZINC000510245067 918781637 /nfs/dbraw/zinc/78/16/37/918781637.db2.gz UEEXUVCAGXTCFU-OXJNMPFZSA-N 0 3 402.510 4.493 20 0 HIADHN Fc1cccc([C@H](CNCc2ccc(Sc3ccccn3)o2)N2CCOCC2)c1 ZINC000510368636 918857598 /nfs/dbraw/zinc/85/75/98/918857598.db2.gz DPTDBNFIGJYNNM-FQEVSTJZSA-N 0 3 413.518 4.128 20 0 HIADHN CCCCN(C)C(=O)C1CCN(Cc2ccc(OCC(F)(F)F)c(OC)c2)CC1 ZINC000510385734 918865691 /nfs/dbraw/zinc/86/56/91/918865691.db2.gz CLQUDSLKOJLUFU-UHFFFAOYSA-N 0 3 416.484 4.107 20 0 HIADHN CCCCOc1cc(CN2CCC(C(=O)N3CCC(C)CC3)CC2)ccc1OC ZINC000510422985 918888503 /nfs/dbraw/zinc/88/85/03/918888503.db2.gz ZCOUBGOGAYJDOX-UHFFFAOYSA-N 0 3 402.579 4.345 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N3CCC(Cc4cccc(F)c4)CC3)cc2)CC1 ZINC000510437742 918897390 /nfs/dbraw/zinc/89/73/90/918897390.db2.gz HXNDSDDXGMNMNI-UHFFFAOYSA-N 0 3 409.549 4.063 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3ccc(Oc4ccncc4)cc3)cc2)CC1 ZINC000510447495 918904301 /nfs/dbraw/zinc/90/43/01/918904301.db2.gz WFLHSKJUVKGLOD-UHFFFAOYSA-N 0 3 402.498 4.268 20 0 HIADHN CC(C)CC(=O)Nc1cccc(CNC(=O)c2oc3ccccc3c2CN(C)C)c1 ZINC000510459211 918914388 /nfs/dbraw/zinc/91/43/88/918914388.db2.gz ITTQKWBPHQQGPJ-UHFFFAOYSA-N 0 3 407.514 4.409 20 0 HIADHN C[C@@H](NC(=O)NC[C@@H]1CC2c3ccccc3C1c1ccccc12)C1=CCN(C)CC1 ZINC000510485053 918936057 /nfs/dbraw/zinc/93/60/57/918936057.db2.gz YLQCNIONUXYFKC-NJAGTKQXSA-N 0 3 401.554 4.233 20 0 HIADHN CC(C)(C)NC(=O)c1cccc(NC(=O)N[C@@H](CN2CCCC2)c2ccccc2)c1 ZINC000510498410 918945493 /nfs/dbraw/zinc/94/54/93/918945493.db2.gz ZHYQMGDNNSSKER-NRFANRHFSA-N 0 3 408.546 4.174 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)NCCc1ccc(OC(F)(F)F)cc1 ZINC000510505186 918952851 /nfs/dbraw/zinc/95/28/51/918952851.db2.gz WNGJLTKGBYAXNI-UHFFFAOYSA-N 0 3 406.404 4.366 20 0 HIADHN C[C@H]1CN(C2CCN(Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)CC2)CCO1 ZINC000510507875 918954275 /nfs/dbraw/zinc/95/42/75/918954275.db2.gz MEJCYZCJFHYAKN-ZDUSSCGKSA-N 0 3 410.402 4.409 20 0 HIADHN C[C@@H]1CN(C2CCN(Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)CC2)CCO1 ZINC000510507874 918954718 /nfs/dbraw/zinc/95/47/18/918954718.db2.gz MEJCYZCJFHYAKN-CYBMUJFWSA-N 0 3 410.402 4.409 20 0 HIADHN CCCOc1c(Cl)cc(CN2CCC(N3CCO[C@H](C)C3)CC2)cc1OCC ZINC000510524939 918971692 /nfs/dbraw/zinc/97/16/92/918971692.db2.gz ZJPZNEUATOOVGW-QGZVFWFLSA-N 0 3 410.986 4.213 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)Nc1ccc(OC[C@@H]2CCCO2)cc1 ZINC000510566981 919008451 /nfs/dbraw/zinc/00/84/51/919008451.db2.gz XOERDDZPUOJJJP-XZOQPEGZSA-N 0 3 409.530 4.203 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)Nc1ccc(OC[C@@H]2CCCO2)cc1 ZINC000510566979 919009289 /nfs/dbraw/zinc/00/92/89/919009289.db2.gz XOERDDZPUOJJJP-GOTSBHOMSA-N 0 3 409.530 4.203 20 0 HIADHN CCCN(C(=O)Nc1ccc2c(c1)OCCO2)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000510635631 919076511 /nfs/dbraw/zinc/07/65/11/919076511.db2.gz UFTYDXLDHXKIFL-OAQYLSRUSA-N 0 3 409.530 4.366 20 0 HIADHN CN(Cc1cc(F)cc2cccnc21)C[C@H](O)COc1ccccc1C(F)(F)F ZINC000510645464 919086129 /nfs/dbraw/zinc/08/61/29/919086129.db2.gz DTZCWYOELIAYOB-KRWDZBQOSA-N 0 3 408.395 4.264 20 0 HIADHN CC(C)n1c2ccccc2nc1[C@H]1CCCN(Cc2cc(=O)n3ccccc3n2)C1 ZINC000510659006 919099204 /nfs/dbraw/zinc/09/92/04/919099204.db2.gz PDGHNQMCDOPLPF-SFHVURJKSA-N 0 3 401.514 4.005 20 0 HIADHN Cc1cc(OCCC[C@@H](C)[NH2+][C@@H](c2nc(-c3nc[n-]n3)no2)C(C)C)ccc1Cl ZINC000510677227 919117239 /nfs/dbraw/zinc/11/72/39/919117239.db2.gz AGADUUDQEMDOMI-RHSMWYFYSA-N 0 3 418.929 4.351 20 0 HIADHN Brc1ccc2c(c1)[C@@H](N[C@H](CN1CCOCC1)c1ccccc1)CC2 ZINC000510689134 919128160 /nfs/dbraw/zinc/12/81/60/919128160.db2.gz UVPMQJMQHGYFPR-LEWJYISDSA-N 0 3 401.348 4.100 20 0 HIADHN C[C@@H](NC(=O)c1csc(-c2ccc(Br)s2)n1)C1=CCN(C)CC1 ZINC000510742470 919190559 /nfs/dbraw/zinc/19/05/59/919190559.db2.gz CLEWEDKPLNVQKD-SNVBAGLBSA-N 0 3 412.378 4.014 20 0 HIADHN CNC(=O)c1ccc(CN2CCC[C@H](Cc3nc(C4CCCCCC4)no3)C2)cc1 ZINC000510765083 919220427 /nfs/dbraw/zinc/22/04/27/919220427.db2.gz DYQHPLIZXKSUCD-LJQANCHMSA-N 0 3 410.562 4.322 20 0 HIADHN C[C@H](NC(=O)c1csc(-c2cc(Br)cs2)n1)C1=CCN(C)CC1 ZINC000510773657 919232452 /nfs/dbraw/zinc/23/24/52/919232452.db2.gz UXWMQYYRTIIGNH-JTQLQIEISA-N 0 3 412.378 4.014 20 0 HIADHN C[C@H](NC(=O)c1nn(-c2ccc(Cl)cc2)c2c1CCCCC2)C1=CCN(C)CC1 ZINC000510788445 919254971 /nfs/dbraw/zinc/25/49/71/919254971.db2.gz RIITZJBTHRBMFD-INIZCTEOSA-N 0 3 412.965 4.175 20 0 HIADHN C[C@@H](NC(=O)c1oc2ccccc2c1CN(C)C)c1cccc(N2CCCC2=O)c1 ZINC000510816188 919291418 /nfs/dbraw/zinc/29/14/18/919291418.db2.gz SGMODLSBJUPXEM-MRXNPFEDSA-N 0 3 405.498 4.112 20 0 HIADHN COc1ccc(C[C@H](NCC(=O)NCc2ccccc2F)c2ccc(OC)cc2)cc1 ZINC000510817392 919295490 /nfs/dbraw/zinc/29/54/90/919295490.db2.gz XFUHYFHSMFHTEL-DEOSSOPVSA-N 0 3 422.500 4.033 20 0 HIADHN COc1ccc(C[C@H](C)C(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)cc1OC ZINC000510885900 919382911 /nfs/dbraw/zinc/38/29/11/919382911.db2.gz YKUKXUPTVGYTIY-UGKGYDQZSA-N 0 3 410.558 4.005 20 0 HIADHN Cc1nc(C(C)(C)C)sc1[C@H](C)N[C@H]1CCN(C(=O)COc2ccccc2)C1 ZINC000510958847 919496985 /nfs/dbraw/zinc/49/69/85/919496985.db2.gz DOSXQJNOJCWUGE-RDJZCZTQSA-N 0 3 401.576 4.080 20 0 HIADHN Cc1ccc(NC(=O)N(CCN(C)C)Cc2ccccc2)c(OC[C@H]2CCCO2)c1 ZINC000510995597 919551683 /nfs/dbraw/zinc/55/16/83/919551683.db2.gz GVLHRTKODCFATE-OAQYLSRUSA-N 0 3 411.546 4.149 20 0 HIADHN C[C@H](N[C@H]1CCCc2nn(C)cc21)c1cccc(OCc2cn3ccccc3n2)c1 ZINC000511009424 919570305 /nfs/dbraw/zinc/57/03/05/919570305.db2.gz FPSGYQJWHWCXSD-JTSKRJEESA-N 0 3 401.514 4.375 20 0 HIADHN Fc1ccc([C@H](NCCc2nnnn2-c2ccccc2)c2ccc(Cl)cc2)cc1 ZINC000511009567 919571783 /nfs/dbraw/zinc/57/17/83/919571783.db2.gz GTISOSXAOFOOLQ-JOCHJYFZSA-N 0 3 407.880 4.377 20 0 HIADHN CC(C)CN(C(=O)CCCc1nc(-c2ccc(Cl)cc2)no1)C1CCN(C)CC1 ZINC000511055553 919652532 /nfs/dbraw/zinc/65/25/32/919652532.db2.gz ANFWLTUUGMFWBA-UHFFFAOYSA-N 0 3 418.969 4.292 20 0 HIADHN C[C@@H]1CN(c2ccccc2NC(=O)NC[C@H](c2ccccc2)N2CCCC2)C[C@H](C)O1 ZINC000511086940 919688189 /nfs/dbraw/zinc/68/81/89/919688189.db2.gz VULLMWKKUSDHML-JXALWOEJSA-N 0 3 422.573 4.259 20 0 HIADHN C[C@@H]1CN(c2ccccc2NC(=O)N[C@H](CN2CCCC2)c2ccccc2)C[C@@H](C)O1 ZINC000511111954 919721865 /nfs/dbraw/zinc/72/18/65/919721865.db2.gz ZKKDKHSIROPTLM-TXTKFYIRSA-N 0 3 422.573 4.259 20 0 HIADHN O=C(CCN[C@H](Cc1ccccc1)c1ccccc1F)NCC(=O)c1ccccc1 ZINC000511165272 919785689 /nfs/dbraw/zinc/78/56/89/919785689.db2.gz NPXBZIOSKXNEMI-HSZRJFAPSA-N 0 3 404.485 4.088 20 0 HIADHN C[C@@H](NC(=O)N(C)[C@H]1CCSc2ccc(Br)cc21)C1=CCN(C)CC1 ZINC000511254690 919857369 /nfs/dbraw/zinc/85/73/69/919857369.db2.gz ROUMRZCFEVJTMC-DYVFJYSZSA-N 0 3 424.408 4.278 20 0 HIADHN CCOc1ccc(-c2nc(CC(=O)N(CCN(C)C)C3CCCCC3)cs2)cc1 ZINC000511314679 919906590 /nfs/dbraw/zinc/90/65/90/919906590.db2.gz KOIWMZVWYWAORW-UHFFFAOYSA-N 0 3 415.603 4.474 20 0 HIADHN C[C@H](NC(=O)c1cc(-c2ccc(F)cc2)nc2onc(C3CC3)c21)C1=CCN(C)CC1 ZINC000511344734 919937342 /nfs/dbraw/zinc/93/73/42/919937342.db2.gz OUATYCPDBKJQCZ-AWEZNQCLSA-N 0 3 420.488 4.287 20 0 HIADHN COC[C@@H](NC1CCC(NC(=O)COc2ccc(Cl)cc2)CC1)c1ccc(C)o1 ZINC000511507666 920123476 /nfs/dbraw/zinc/12/34/76/920123476.db2.gz QQYNGFQEMAVQHT-AFMYVXGZSA-N 0 3 420.937 4.025 20 0 HIADHN COc1ccc(NC(=O)CN[C@@H](c2cccc(OC(F)(F)F)c2)C2CC2)c(OC)c1 ZINC000511580602 920225227 /nfs/dbraw/zinc/22/52/27/920225227.db2.gz XTXDVCZNEHCXAB-HXUWFJFHSA-N 0 3 424.419 4.282 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)N[C@H](C)c2ccc3n[nH]cc3c2)N(C)C)cc1 ZINC000511642101 920307260 /nfs/dbraw/zinc/30/72/60/920307260.db2.gz VZCVPFUXSAMPHT-OPAMFIHVSA-N 0 3 409.534 4.013 20 0 HIADHN Fc1ccccc1-c1nnc2ccc(N[C@@H]3CCCN(Cc4ccccc4)C3)nn21 ZINC000511679959 920343413 /nfs/dbraw/zinc/34/34/13/920343413.db2.gz GITXHMPSKRNKLJ-GOSISDBHSA-N 0 3 402.477 4.007 20 0 HIADHN Cc1cc2c(cc1NC(=O)[C@@]1(C(F)(F)F)CCN(Cc3ccccc3)C1)OCO2 ZINC000511692724 920356387 /nfs/dbraw/zinc/35/63/87/920356387.db2.gz RSUSTBBMKKIGJL-HXUWFJFHSA-N 0 3 406.404 4.117 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N[C@@H](C)c1ccc(F)c2ccccc21 ZINC000511736258 920406215 /nfs/dbraw/zinc/40/62/15/920406215.db2.gz BNWLWKNWRBWNTO-INIZCTEOSA-N 0 3 407.489 4.165 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)c1cscc1Br ZINC000511741840 920417417 /nfs/dbraw/zinc/41/74/17/920417417.db2.gz XCYWZTMQNLCCRS-OAHLLOKOSA-N 0 3 408.365 4.032 20 0 HIADHN O=C(CSCc1ccccn1)N[C@@H]1CN(Cc2ccccc2)C[C@H]1c1ccccc1 ZINC000511751206 920429838 /nfs/dbraw/zinc/42/98/38/920429838.db2.gz DDYRSDOVNXRGND-BJKOFHAPSA-N 0 3 417.578 4.099 20 0 HIADHN O=C(CN1C[C@H](c2ccccc2)[C@@H]2COCC[C@H]21)Nc1ccccc1C(F)(F)F ZINC000511757469 920438987 /nfs/dbraw/zinc/43/89/87/920438987.db2.gz PBKHXXDQPQKIJB-FUHIMQAGSA-N 0 3 404.432 4.148 20 0 HIADHN Fc1ccc([C@@H]2CC[C@@H](NCc3ncc(I)s3)C2)cc1 ZINC000511760180 920441601 /nfs/dbraw/zinc/44/16/01/920441601.db2.gz WBRZKMIHICOAOM-DGCLKSJQSA-N 0 3 402.276 4.313 20 0 HIADHN Fc1cccc([C@H]2CC[C@@H](NCc3ncc(I)s3)C2)c1 ZINC000511763796 920446431 /nfs/dbraw/zinc/44/64/31/920446431.db2.gz VDWVTIZWPJWXFE-WCQYABFASA-N 0 3 402.276 4.313 20 0 HIADHN O=C(CN1C[C@H](c2ccccc2)[C@H]2COCC[C@@H]21)N(Cc1ccco1)c1ccccc1 ZINC000511764803 920449552 /nfs/dbraw/zinc/44/95/52/920449552.db2.gz ZILRIXNFGYHHNA-SDHSZQHLSA-N 0 3 416.521 4.317 20 0 HIADHN O=C(NC1CCCCC1)NC1CCN(Cc2ccc(OCc3ccncc3)cc2)CC1 ZINC000511780002 920470831 /nfs/dbraw/zinc/47/08/31/920470831.db2.gz HIGUPASAFXLDPS-UHFFFAOYSA-N 0 3 422.573 4.257 20 0 HIADHN CC(=O)c1c(C)[nH]c(C(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)c1C(C)C ZINC000511783478 920474560 /nfs/dbraw/zinc/47/45/60/920474560.db2.gz GTEIVXXSDOZMBY-CALCHBBNSA-N 0 3 417.594 4.001 20 0 HIADHN O=C(NC1CCN(Cc2ccc(OCc3ccccn3)cc2)CC1)c1ccsc1 ZINC000511792417 920486048 /nfs/dbraw/zinc/48/60/48/920486048.db2.gz NPRBFUZSOCGHIG-UHFFFAOYSA-N 0 3 407.539 4.117 20 0 HIADHN O=C(NC1CCN(Cc2ccc(-n3cnc4ccccc43)cc2)CC1)c1ccsc1 ZINC000511844672 920563679 /nfs/dbraw/zinc/56/36/79/920563679.db2.gz MSWHJHUZRNQIRR-UHFFFAOYSA-N 0 3 416.550 4.481 20 0 HIADHN CN(C)Cc1cnc(CNC2CCN(Cc3cc(Cl)cc(Cl)c3)CC2)s1 ZINC000511911385 920651981 /nfs/dbraw/zinc/65/19/81/920651981.db2.gz OPTFJXUNQQVYDI-UHFFFAOYSA-N 0 3 413.418 4.266 20 0 HIADHN C[C@@H](CC(=O)Nc1cc(C(F)(F)F)ccc1Cl)N[C@H](CO)c1ccsc1 ZINC000511921640 920665935 /nfs/dbraw/zinc/66/59/35/920665935.db2.gz IJOHMBCMDZKKPU-ZUZCIYMTSA-N 0 3 406.857 4.461 20 0 HIADHN COc1cc(CN[C@H](C)CC(=O)Nc2cc(C(F)(F)F)ccc2Cl)ccn1 ZINC000512100074 920860296 /nfs/dbraw/zinc/86/02/96/920860296.db2.gz OFWYBIZGKISSSG-LLVKDONJSA-N 0 3 401.816 4.269 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)NCc3coc4ccccc34)CC2)c1 ZINC000512127137 920876884 /nfs/dbraw/zinc/87/68/84/920876884.db2.gz LTSJPLLLSDLIPU-UHFFFAOYSA-N 0 3 420.557 4.143 20 0 HIADHN Cc1cc([C@@H](C)NCc2ccc(N3CCO[C@@H](C)C3)nc2)sc1Br ZINC000512135230 920882531 /nfs/dbraw/zinc/88/25/31/920882531.db2.gz HAIPLCXVWASXJY-UONOGXRCSA-N 0 3 410.381 4.290 20 0 HIADHN C[C@@H]1CSC[C@H]1NCC(=O)N1N=C(c2cc3ccccc3o2)C[C@@H]1c1ccco1 ZINC000512171845 920909010 /nfs/dbraw/zinc/90/90/10/920909010.db2.gz ZFFGVTHHSSGJAB-ZTFGCOKTSA-N 0 3 409.511 4.045 20 0 HIADHN C[C@H](OC[C@@H](O)CN(C)CCc1nc(-c2ccccc2)no1)c1ccc(Cl)cc1 ZINC000512181260 920919881 /nfs/dbraw/zinc/91/98/81/920919881.db2.gz OVRVMVKSUHULCH-JXFKEZNVSA-N 0 3 415.921 4.003 20 0 HIADHN COc1cc(C(=O)Nc2cccc(CN3CCC(O)CC3)c2)cc(OC)c1C(C)C ZINC000512190849 920933302 /nfs/dbraw/zinc/93/33/02/920933302.db2.gz CFYKFLQBVJLFQE-UHFFFAOYSA-N 0 3 412.530 4.036 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)N3CCC[C@]4(CC=CCC4)C3)CC2)c1 ZINC000512191514 920934859 /nfs/dbraw/zinc/93/48/59/920934859.db2.gz MKNXGSJYJFQCQO-AREMUKBSSA-N 0 3 424.633 4.429 20 0 HIADHN COc1cc(F)c([C@H](C)NC(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)cc1OC ZINC000512197215 920943337 /nfs/dbraw/zinc/94/33/37/920943337.db2.gz ATBSUVBONSAUTK-XYJFISCASA-N 0 3 415.509 4.039 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N(C)[C@H]3CCc4ccccc4C3)c(C)c2)CC1 ZINC000512220075 920968774 /nfs/dbraw/zinc/96/87/74/920968774.db2.gz UTFYOSHBZQOEOB-QFIPXVFZSA-N 0 3 406.574 4.158 20 0 HIADHN CCN(CC)C(=O)C1CCN(Cc2ccc(OCc3csc(C)n3)cc2)CC1 ZINC000512228050 920979245 /nfs/dbraw/zinc/97/92/45/920979245.db2.gz NFDWAUKGOATFKL-UHFFFAOYSA-N 0 3 401.576 4.111 20 0 HIADHN FC(F)(F)Oc1cccc(N2CC[C@@H](NCc3cnn(-c4ccccc4)c3)C2)c1 ZINC000512232987 920985616 /nfs/dbraw/zinc/98/56/16/920985616.db2.gz FXGUSRKADDDVKN-QGZVFWFLSA-N 0 3 402.420 4.139 20 0 HIADHN COc1cc(CN2CCC(C(=O)N3CCc4ccccc43)CC2)ccc1OC(C)C ZINC000512253181 921011036 /nfs/dbraw/zinc/01/10/36/921011036.db2.gz ODKYBRDQOUFDFB-UHFFFAOYSA-N 0 3 408.542 4.284 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CN1CCC(C(=O)N2CCc3ccccc32)CC1 ZINC000512260619 921017861 /nfs/dbraw/zinc/01/78/61/921017861.db2.gz NUUINAFFMVXAKD-UHFFFAOYSA-N 0 3 414.553 4.290 20 0 HIADHN CC(=O)N(C)C1CCN(Cc2cn(-c3ccc(F)cc3)nc2-c2cccc(C)c2)CC1 ZINC000512292050 921046835 /nfs/dbraw/zinc/04/68/35/921046835.db2.gz FOJSKFMYOKYEJV-UHFFFAOYSA-N 0 3 420.532 4.430 20 0 HIADHN C[C@@H](NC(=O)CN(C)[C@@H]1CCc2ccccc2C1)c1ccc(Br)cc1 ZINC000512317900 921068317 /nfs/dbraw/zinc/06/83/17/921068317.db2.gz HBUWIJMPBWWXMH-FOIQADDNSA-N 0 3 401.348 4.116 20 0 HIADHN O=C(N1CCc2cc(F)ccc2C1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000512334279 921081376 /nfs/dbraw/zinc/08/13/76/921081376.db2.gz OVSFCCJGKLJBEU-OAQYLSRUSA-N 0 3 406.423 4.165 20 0 HIADHN COc1ccc([C@H](CN(C)C)NCc2cnn(-c3ccc(C(F)(F)F)cc3)c2)cc1 ZINC000512344579 921089950 /nfs/dbraw/zinc/08/99/50/921089950.db2.gz YTCBLKLZLSZRAS-NRFANRHFSA-N 0 3 418.463 4.292 20 0 HIADHN CCCOc1c(Cl)cc(CN[C@H]2CCO[C@@H]2c2nccn2CC)cc1OCC ZINC000512348366 921092839 /nfs/dbraw/zinc/09/28/39/921092839.db2.gz ZJFHHZPWQMTZHF-PXNSSMCTSA-N 0 3 407.942 4.364 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CN1CCC(C(=O)NC2CCCCC2)CC1 ZINC000512347688 921092886 /nfs/dbraw/zinc/09/28/86/921092886.db2.gz UWHNJKMHZQPZSJ-UHFFFAOYSA-N 0 3 408.590 4.209 20 0 HIADHN Cc1ccc(-c2n[nH]cc2CN2CCC(C(=O)NCCc3cccs3)CC2)cc1 ZINC000512349800 921095061 /nfs/dbraw/zinc/09/50/61/921095061.db2.gz ANNBPVSFAZXTFP-UHFFFAOYSA-N 0 3 408.571 4.018 20 0 HIADHN Cc1ccc(-c2nn(-c3ccc(F)cc3)cc2CN2CCC(n3cncn3)CC2)cc1 ZINC000512350026 921096504 /nfs/dbraw/zinc/09/65/04/921096504.db2.gz FORUOXWGROWELP-UHFFFAOYSA-N 0 3 416.504 4.415 20 0 HIADHN CCOc1cc(CN2CC[C@@H](c3cccc(F)c3)C2)ccc1O[C@H](C)C(=O)N(C)C ZINC000513460269 921824605 /nfs/dbraw/zinc/82/46/05/921824605.db2.gz DGDVAPCQNARUSQ-YLJYHZDGSA-N 0 3 414.521 4.069 20 0 HIADHN CCCOc1nc(C(=O)N(Cc2ccco2)C2CCN(C)CC2)cc2ccccc21 ZINC000513468369 921830365 /nfs/dbraw/zinc/83/03/65/921830365.db2.gz GRMBOOPYPUVBAU-UHFFFAOYSA-N 0 3 407.514 4.353 20 0 HIADHN Cc1ccsc1CN(C)C[C@@H](O)COc1ccc(Cl)cc1Br ZINC000513473507 921832600 /nfs/dbraw/zinc/83/26/00/921832600.db2.gz YUPANFRDQFJMKS-CYBMUJFWSA-N 0 3 404.757 4.344 20 0 HIADHN O[C@H](Cn1c2ccccc2nc1NCc1ccccc1)CN1CCc2ccccc2C1 ZINC000513479105 921835700 /nfs/dbraw/zinc/83/57/00/921835700.db2.gz IHNMCHODYUREQC-QHCPKHFHSA-N 0 3 412.537 4.068 20 0 HIADHN COC(=O)c1ccc(CNCc2cc(OC)c(OC)cc2-c2ccccc2)cc1OC ZINC000513510680 921857695 /nfs/dbraw/zinc/85/76/95/921857695.db2.gz FESCRWVACANANO-UHFFFAOYSA-N 0 3 421.493 4.456 20 0 HIADHN Cc1noc(C)c1COc1ccccc1C(=O)NC[C@H]1CCCN1Cc1ccccc1 ZINC000513564786 921898779 /nfs/dbraw/zinc/89/87/79/921898779.db2.gz AQFQGADEQVHWIJ-OAQYLSRUSA-N 0 3 419.525 4.265 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)Nc1ccc(Cl)c(C(N)=O)c1)c1ccc(Cl)cc1 ZINC000513606104 921937925 /nfs/dbraw/zinc/93/79/25/921937925.db2.gz IMILUTDFISHBNH-SFHVURJKSA-N 0 3 423.344 4.297 20 0 HIADHN CCCN(C(=O)NCc1nccc(C(F)F)n1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000513668588 921991496 /nfs/dbraw/zinc/99/14/96/921991496.db2.gz ANDNAKLWNDKJHZ-SFHVURJKSA-N 0 3 417.504 4.000 20 0 HIADHN Brc1cccc(-c2ccc(CN3CCCN(c4cccnn4)CC3)o2)c1 ZINC000513702760 922022454 /nfs/dbraw/zinc/02/24/54/922022454.db2.gz MQKMASHEUUSYIW-UHFFFAOYSA-N 0 3 413.319 4.211 20 0 HIADHN CC(=O)Nc1ccc(OC[C@H](O)CN(Cc2ccc([C@H]3C[C@@H]3C)o2)C(C)C)cc1 ZINC000513703512 922023221 /nfs/dbraw/zinc/02/32/21/922023221.db2.gz WQZGRKYSFXCQPA-NBCNXNJRSA-N 0 3 400.519 4.012 20 0 HIADHN COc1ccc([C@H](Cc2ccncc2)N[C@H]2CC(=O)N(c3ccccc3Cl)C2)cc1 ZINC000513707379 922027275 /nfs/dbraw/zinc/02/72/75/922027275.db2.gz BXGAIRXLYLUPEJ-UGKGYDQZSA-N 0 3 421.928 4.423 20 0 HIADHN COc1ccc([C@@H](Cc2ccncc2)N[C@@H]2CC(=O)N(c3ccccc3Cl)C2)cc1 ZINC000513707376 922027746 /nfs/dbraw/zinc/02/77/46/922027746.db2.gz BXGAIRXLYLUPEJ-DENIHFKCSA-N 0 3 421.928 4.423 20 0 HIADHN O=c1c(Cl)c(NC[C@@H]2CCCN2Cc2ccccc2)cnn1Cc1ccccc1 ZINC000513759139 922077713 /nfs/dbraw/zinc/07/77/13/922077713.db2.gz IWWHDGONWKHGOY-FQEVSTJZSA-N 0 3 408.933 4.022 20 0 HIADHN COCCOc1ccccc1CN1CCC([C@H]2C(=O)Nc3cc(Cl)ccc32)CC1 ZINC000513762666 922081238 /nfs/dbraw/zinc/08/12/38/922081238.db2.gz RZWACDIQHLWMMB-JOCHJYFZSA-N 0 3 414.933 4.313 20 0 HIADHN C[C@@H](CNC(=O)Cc1c[nH]c2cccc(Br)c12)N(C)Cc1ccccc1 ZINC000513775666 922096348 /nfs/dbraw/zinc/09/63/48/922096348.db2.gz TWTJKRSQSKNHJV-HNNXBMFYSA-N 0 3 414.347 4.110 20 0 HIADHN CN1CCN(c2ccc(CN[C@@H]3CC4(CCCCC4)Oc4ccccc43)cn2)CC1 ZINC000513788424 922114196 /nfs/dbraw/zinc/11/41/96/922114196.db2.gz QQRPJYXHRDMLRU-JOCHJYFZSA-N 0 3 406.574 4.150 20 0 HIADHN CN1CCN(c2cc(CN[C@@H]3CC4(CCCCC4)Oc4ccccc43)ccn2)CC1 ZINC000513787948 922115074 /nfs/dbraw/zinc/11/50/74/922115074.db2.gz HZGGGAWGAJDMDD-JOCHJYFZSA-N 0 3 406.574 4.150 20 0 HIADHN O=C(NCc1ccccc1Br)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000513929006 922251169 /nfs/dbraw/zinc/25/11/69/922251169.db2.gz APGRJMQTIVVWNV-IBGZPJMESA-N 0 3 402.336 4.085 20 0 HIADHN Cc1cc(NC(=O)C[C@H](C)c2c(C)noc2C)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000513932736 922253999 /nfs/dbraw/zinc/25/39/99/922253999.db2.gz AJFDSDRYYLUHLF-HRAATJIYSA-N 0 3 421.545 4.376 20 0 HIADHN COc1ccc(CCCC(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)c(OC)c1 ZINC000513946935 922264632 /nfs/dbraw/zinc/26/46/32/922264632.db2.gz RKPQQQGTDHRFDO-HXUWFJFHSA-N 0 3 410.558 4.150 20 0 HIADHN CSc1cc2c(cc1NC(=O)NC[C@@H](c1cccs1)N1CCCC1)OCCO2 ZINC000513974779 922294624 /nfs/dbraw/zinc/29/46/24/922294624.db2.gz SKLLRHKAIOWDRK-HNNXBMFYSA-N 0 3 419.572 4.200 20 0 HIADHN CCOc1cc2c(cc1CNC(=O)N[C@@H]1CCN([C@@H](C)c3ccccc3)C1)O[C@@H](C)C2 ZINC000514027531 922350287 /nfs/dbraw/zinc/35/02/87/922350287.db2.gz SXYJIZYHNQOJCC-NPPFBWRTSA-N 0 3 423.557 4.043 20 0 HIADHN O=C(CCCOc1ccccc1)Nc1ccc(CN[C@H]2CCCc3n[nH]cc32)cc1 ZINC000514094427 922416754 /nfs/dbraw/zinc/41/67/54/922416754.db2.gz NCDSQFQPEVSGDG-QFIPXVFZSA-N 0 3 404.514 4.375 20 0 HIADHN C[C@@H]1Oc2ccc(C(=O)C3CCN(Cc4coc5ccccc45)CC3)cc2NC1=O ZINC000514104668 922432714 /nfs/dbraw/zinc/43/27/14/922432714.db2.gz LWLUOSLTLYJGBB-HNNXBMFYSA-N 0 3 404.466 4.247 20 0 HIADHN COc1ccc([C@@H](Cc2ccncc2)NCc2ccc(-n3nc(C)cc3C)nc2)cc1 ZINC000514104076 922433209 /nfs/dbraw/zinc/43/32/09/922433209.db2.gz HGPSDPVPAWONLL-XMMPIXPASA-N 0 3 413.525 4.361 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)NC[C@@H](c2ccccc2Cl)N(C)C)C1 ZINC000514146197 922481207 /nfs/dbraw/zinc/48/12/07/922481207.db2.gz VBVFBVNOGYMDFL-JUXOCIIHSA-N 0 3 414.981 4.077 20 0 HIADHN COc1cccc([C@@H](CNC(=O)NCc2c(F)cccc2Cl)N2CCCC2)c1 ZINC000514162778 922502467 /nfs/dbraw/zinc/50/24/67/922502467.db2.gz PKKGIOCUFKMTTJ-HXUWFJFHSA-N 0 3 405.901 4.124 20 0 HIADHN CCOc1ccccc1CNC(=O)NC[C@H](c1cccs1)N1CCC(C)CC1 ZINC000514181885 922519683 /nfs/dbraw/zinc/51/96/83/922519683.db2.gz GDMARSIBCIUOTB-LJQANCHMSA-N 0 3 401.576 4.419 20 0 HIADHN O=C(NCc1nc2cc(Cl)ccc2s1)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000514182146 922522082 /nfs/dbraw/zinc/52/20/82/922522082.db2.gz JFXGHPSJHGZDBT-INIZCTEOSA-N 0 3 400.935 4.023 20 0 HIADHN CN(Cc1cccc(Br)c1)C(=O)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000514215095 922549089 /nfs/dbraw/zinc/54/90/89/922549089.db2.gz RDSRYWOZZHULBP-FQEVSTJZSA-N 0 3 416.363 4.428 20 0 HIADHN Cc1ccc([C@H]2CCCN2CC(=O)N2CCC[C@@H]2c2ccc3c(c2)OCCO3)cc1 ZINC000514235949 922574146 /nfs/dbraw/zinc/57/41/46/922574146.db2.gz LJMJIRACZXEETJ-FGZHOGPDSA-N 0 3 406.526 4.267 20 0 HIADHN CN(C)Cc1cccc(NC(=O)Cn2c(COc3ccccc3)nc3ccccc32)c1 ZINC000514398426 922612914 /nfs/dbraw/zinc/61/29/14/922612914.db2.gz ZBUSBPSHCQVJHA-UHFFFAOYSA-N 0 3 414.509 4.316 20 0 HIADHN C[C@H](Oc1ccc(C(=O)Nc2cccc(CN3CC[C@@H](O)C3)c2)cn1)c1ccccc1 ZINC000562377986 945067332 /nfs/dbraw/zinc/06/73/32/945067332.db2.gz WHXAHEMTQKDOFS-FDDCHVKYSA-N 0 3 417.509 4.041 20 0 HIADHN COc1cc(NC(=O)NC[C@@H](c2ccccc2)N2CCCC2)c(OC)cc1Cl ZINC000514508868 922660238 /nfs/dbraw/zinc/66/02/38/922660238.db2.gz MZZLYQPAPRJXOK-SFHVURJKSA-N 0 3 403.910 4.316 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@H](C)c1ccc(OC)c(F)c1)c1cccc(OC)c1 ZINC000514535919 922682702 /nfs/dbraw/zinc/68/27/02/922682702.db2.gz KOVRSPUWBXIGBJ-IIBYNOLFSA-N 0 3 417.525 4.286 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)N(Cc2cccs2)C[C@H]2CCCO2)N(C)C)cc1 ZINC000514564147 922701610 /nfs/dbraw/zinc/70/16/10/922701610.db2.gz ADSRKPUHXDMTDJ-IFMALSPDSA-N 0 3 415.603 4.304 20 0 HIADHN O=C(NCCN1CCCC1)c1ccc(NCc2csc(-c3ccsc3)n2)cc1 ZINC000514617127 922723336 /nfs/dbraw/zinc/72/33/36/922723336.db2.gz IKBALOWEGPVSAW-UHFFFAOYSA-N 0 3 412.584 4.309 20 0 HIADHN C[C@H](N[C@H]1CCCc2cc(S(N)(=O)=O)ccc21)c1ccc(-c2cccnc2)cc1 ZINC000514619437 922725273 /nfs/dbraw/zinc/72/52/73/922725273.db2.gz YYLDWZIMLCVCBL-HJPURHCSSA-N 0 3 407.539 4.124 20 0 HIADHN Cc1onc(-c2cccnc2)c1C(=O)Nc1cc(C)cc(N2CCN(C(C)C)CC2)c1 ZINC000514621029 922728014 /nfs/dbraw/zinc/72/80/14/922728014.db2.gz FOLDQVRHWHJZKD-UHFFFAOYSA-N 0 3 419.529 4.136 20 0 HIADHN COc1cccc2c1CCC[C@H]2N[C@H]1CCCN(Cc2ccc(F)cc2F)C1=O ZINC000514650631 922746270 /nfs/dbraw/zinc/74/62/70/922746270.db2.gz KPDMHBOOXHAEDV-RTWAWAEBSA-N 0 3 400.469 4.132 20 0 HIADHN O=C(CC(F)(F)F)NC[C@H]1CCCN(Cc2c[nH]nc2-c2cccc(Cl)c2)C1 ZINC000514694275 922759660 /nfs/dbraw/zinc/75/96/60/922759660.db2.gz YQQVILHUVSDVIA-CYBMUJFWSA-N 0 3 414.859 4.011 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)CCc1ccc(Br)c(C)c1 ZINC000514706542 922769014 /nfs/dbraw/zinc/76/90/14/922769014.db2.gz XNIADGYPSVDMNO-UHFFFAOYSA-N 0 3 405.336 4.399 20 0 HIADHN O=C(NCc1ccccc1Cn1ccnc1)c1cccc2nc(-c3cccs3)[nH]c21 ZINC000514723439 922772478 /nfs/dbraw/zinc/77/24/78/922772478.db2.gz GXKJPVMLPMBDIM-UHFFFAOYSA-N 0 3 413.506 4.466 20 0 HIADHN CCOC(=O)C1CCC(N(CC)Cc2nc3ccc(Br)cc3n2C)CC1 ZINC000514741828 922776462 /nfs/dbraw/zinc/77/64/62/922776462.db2.gz VFOXNWOMFSNFLH-UHFFFAOYSA-N 0 3 422.367 4.280 20 0 HIADHN CN(Cc1ccc(OC(F)F)cc1)C[C@H](O)COc1cc(Cl)ccc1Cl ZINC000514855702 922825518 /nfs/dbraw/zinc/82/55/18/922825518.db2.gz GVJUMEHAVTURBO-AWEZNQCLSA-N 0 3 406.256 4.467 20 0 HIADHN COc1cc(CN2CCC[C@@H](CCNC(C)=O)C2)ccc1OCc1cccs1 ZINC000514891258 922834639 /nfs/dbraw/zinc/83/46/39/922834639.db2.gz RAYUAMYTUMIOLQ-SFHVURJKSA-N 0 3 402.560 4.074 20 0 HIADHN COc1ccc(OC)c([C@@H]2CCCN2C(=O)CN2CCC[C@@H]2Cc2ccccc2)c1 ZINC000514944277 922849448 /nfs/dbraw/zinc/84/94/48/922849448.db2.gz OCFGRJWFQACGHL-OFNKIYASSA-N 0 3 408.542 4.074 20 0 HIADHN COc1ccc(OC(F)F)c(NC(=O)N[C@@H]2CCN(Cc3ccccc3)[C@@H]2C)c1 ZINC000514962147 922855185 /nfs/dbraw/zinc/85/51/85/922855185.db2.gz CQQACEIFFJSWBT-RHSMWYFYSA-N 0 3 405.445 4.081 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)Nc1ccc(OCc2ccccn2)c(F)c1 ZINC000514970308 922860646 /nfs/dbraw/zinc/86/06/46/922860646.db2.gz UUGNXJPMQLAODI-GOSISDBHSA-N 0 3 422.504 4.442 20 0 HIADHN COc1cccc([C@@H](CNC(=O)Nc2cccc(NC(=O)C3CC3)c2)N2CCCC2)c1 ZINC000515120872 922932964 /nfs/dbraw/zinc/93/29/64/922932964.db2.gz NSIQTZGUTUHQPX-JOCHJYFZSA-N 0 3 422.529 4.002 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)Cc2ccc(-n3nc(C)cc3C)cc2)N(C)C)cc1 ZINC000515125768 922938857 /nfs/dbraw/zinc/93/88/57/922938857.db2.gz QNNRRRJVCJNDBO-XMMPIXPASA-N 0 3 404.558 4.013 20 0 HIADHN C[C@@H](NC(=O)NC[C@H](c1ccccc1)N(C)C)c1nc2ccccc2n1C(F)F ZINC000515296150 923041452 /nfs/dbraw/zinc/04/14/52/923041452.db2.gz XJBZNLUYENXXJJ-RDTXWAMCSA-N 0 3 401.461 4.095 20 0 HIADHN CN(C)[C@H](CNC(=O)NCc1cccc(COc2ccccc2)c1)c1ccccc1 ZINC000515456268 923115214 /nfs/dbraw/zinc/11/52/14/923115214.db2.gz ZBYRSHNULNHLTI-XMMPIXPASA-N 0 3 403.526 4.368 20 0 HIADHN CCc1noc(-c2ccc(C)c(NC(=O)N[C@@H]3CCN(Cc4ccccc4)[C@H]3C)c2)n1 ZINC000515461086 923118071 /nfs/dbraw/zinc/11/80/71/923118071.db2.gz FBEDBKKNMZAFOL-FXAWDEMLSA-N 0 3 419.529 4.392 20 0 HIADHN Cc1ccc(NC(=O)[C@@H](N[C@H](Cc2ccccc2)CN(C)C)c2ccccc2)cc1 ZINC000515737744 923312459 /nfs/dbraw/zinc/31/24/59/923312459.db2.gz HIYFRRAHNAICOS-RPBOFIJWSA-N 0 3 401.554 4.437 20 0 HIADHN Cc1cc(-c2noc([C@H](C)NCC3(N4CCSCC4)CCCC3)n2)ccc1F ZINC000515756822 923329823 /nfs/dbraw/zinc/32/98/23/923329823.db2.gz DRJICGJTIMLRFZ-INIZCTEOSA-N 0 3 404.555 4.196 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)NCc3ccc([C@@H]4C[C@@H]4C)o3)CC2)c1 ZINC000515794317 923353187 /nfs/dbraw/zinc/35/31/87/923353187.db2.gz KRLXLABMNPNYCD-NZQKXSOJSA-N 0 3 424.589 4.113 20 0 HIADHN COc1ccc([C@H](CNC(=O)N[C@@H](C)c2c(F)cccc2F)N2CCCC2)cc1 ZINC000515825741 923376755 /nfs/dbraw/zinc/37/67/55/923376755.db2.gz YCBVHYQMVVCQHZ-YWZLYKJASA-N 0 3 403.473 4.171 20 0 HIADHN O=C(CSCc1coc(-c2ccccc2)n1)NCCCN1CCc2ccccc2C1 ZINC000515833391 923381877 /nfs/dbraw/zinc/38/18/77/923381877.db2.gz YZANJGWIXMKWSZ-UHFFFAOYSA-N 0 3 421.566 4.139 20 0 HIADHN Cc1ccc([C@@H]2CCCN2C(=O)NCCCCN2CCN(c3ccccc3)CC2)cc1 ZINC000515903411 923421113 /nfs/dbraw/zinc/42/11/13/923421113.db2.gz JWCUKGKEZJFFJW-VWLOTQADSA-N 0 3 420.601 4.444 20 0 HIADHN COC(=O)c1c(F)ccc(NC(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)c1C ZINC000515925274 923439568 /nfs/dbraw/zinc/43/95/68/923439568.db2.gz QZQRRJXCYZSFCA-GOSISDBHSA-N 0 3 413.493 4.049 20 0 HIADHN COC(=O)c1ccc(CN[C@H]2CCO[C@@H](c3ccc(F)cc3)C2)c(Br)c1 ZINC000516076575 923530445 /nfs/dbraw/zinc/53/04/45/923530445.db2.gz OFFLYBVWKWCWND-PKOBYXMFSA-N 0 3 422.294 4.385 20 0 HIADHN CN1C(=O)NC2(CCN(Cc3ccc(-c4ccc(Cl)c(Cl)c4)s3)CC2)C1=O ZINC000516117361 923553715 /nfs/dbraw/zinc/55/37/15/923553715.db2.gz BTQRUDIZQACNNO-UHFFFAOYSA-N 0 3 424.353 4.238 20 0 HIADHN O=C1[C@@H](NC2(c3ccc(F)cc3)CCOCC2)CCN1c1ccc(Cl)c(F)c1 ZINC000516145720 923574269 /nfs/dbraw/zinc/57/42/69/923574269.db2.gz KLTDICYDBVUYAL-IBGZPJMESA-N 0 3 406.860 4.019 20 0 HIADHN Cc1cc(Sc2ccccc2)ccc1NC(=O)C(=O)NCCN1CCCC[C@@H]1C ZINC000516305795 923655109 /nfs/dbraw/zinc/65/51/09/923655109.db2.gz XSMBQEVWUAQUDT-SFHVURJKSA-N 0 3 411.571 4.075 20 0 HIADHN Cc1cc(Sc2ccccc2)ccc1NC(=O)C(=O)NCCN1CCCC[C@H]1C ZINC000516305794 923655615 /nfs/dbraw/zinc/65/56/15/923655615.db2.gz XSMBQEVWUAQUDT-GOSISDBHSA-N 0 3 411.571 4.075 20 0 HIADHN CCN(CC)C(=O)c1cccc(NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)c1 ZINC000516329252 923668904 /nfs/dbraw/zinc/66/89/04/923668904.db2.gz VLGAJJZRVCKLSH-HXUWFJFHSA-N 0 3 411.521 4.158 20 0 HIADHN O=C(N[C@H]1CCN(C2CC2)C1)c1cn(Cc2ccccc2)nc1-c1ccc(Cl)cc1 ZINC000516336048 923673641 /nfs/dbraw/zinc/67/36/41/923673641.db2.gz DBCSTAJRGGYEPA-FQEVSTJZSA-N 0 3 420.944 4.218 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCc3ccccc3OCC(C)C)c(C)c2)CC1 ZINC000516468530 923747838 /nfs/dbraw/zinc/74/78/38/923747838.db2.gz SJGIURJRDUXBBY-UHFFFAOYSA-N 0 3 424.589 4.493 20 0 HIADHN CC[C@H](C)C(=O)Nc1cccc(CNC(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)c1 ZINC000516578864 923800441 /nfs/dbraw/zinc/80/04/41/923800441.db2.gz UZGMCZQOLHIUGI-YYDVJCTNSA-N 0 3 422.573 4.306 20 0 HIADHN C[C@H](NC(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1)c1cccc(OC(F)F)c1 ZINC000516578218 923800869 /nfs/dbraw/zinc/80/08/69/923800869.db2.gz WTFCDPYHFWRUOD-BXWFABGCSA-N 0 3 403.473 4.484 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2CN2CC[C@@H](N3CCCC3=O)C2)cc1C ZINC000516579494 923800899 /nfs/dbraw/zinc/80/08/99/923800899.db2.gz GPLLDCBJYHKIMK-XMMPIXPASA-N 0 3 414.553 4.353 20 0 HIADHN C[C@@H](CN1C[C@H](C)C[C@@H](C)C1)NC(=O)N1CCC(C(=O)c2ccc(Cl)cc2)CC1 ZINC000516683804 923844027 /nfs/dbraw/zinc/84/40/27/923844027.db2.gz SNYZKHWEIXKWJG-KURKYZTESA-N 0 3 419.997 4.311 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)N(C)Cc2csc(Br)c2)C1 ZINC000516709002 923856999 /nfs/dbraw/zinc/85/69/99/923856999.db2.gz RTOZJLDHSGXSKB-YOEHRIQHSA-N 0 3 422.392 4.488 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)NC[C@H]2CCCO[C@@H]2c2ccccc2)CC1 ZINC000516715985 923859889 /nfs/dbraw/zinc/85/98/89/923859889.db2.gz VCDQPOAMGQRDIQ-NFBKMPQASA-N 0 3 411.546 4.053 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2ccc(OCc3ccncc3)cc2)N(C)C)cc1 ZINC000517125074 924012117 /nfs/dbraw/zinc/01/21/17/924012117.db2.gz FJNVEXDWPPVOJQ-HSZRJFAPSA-N 0 3 404.514 4.393 20 0 HIADHN CC(C)CNC(=O)c1ccc(NC(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)cc1 ZINC000517181777 924040631 /nfs/dbraw/zinc/04/06/31/924040631.db2.gz OHHFXMCLZJKRCG-FQEVSTJZSA-N 0 3 416.953 4.150 20 0 HIADHN CC(C)CNC(=O)c1ccc(NC(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)cc1 ZINC000517181778 924040853 /nfs/dbraw/zinc/04/08/53/924040853.db2.gz OHHFXMCLZJKRCG-HXUWFJFHSA-N 0 3 416.953 4.150 20 0 HIADHN Cc1nc(CCC(=O)N(CCN(C)C)Cc2ccccc2F)oc1-c1ccccc1 ZINC000517336316 924111684 /nfs/dbraw/zinc/11/16/84/924111684.db2.gz NRTKQGVJFSUXCL-UHFFFAOYSA-N 0 3 409.505 4.312 20 0 HIADHN Cc1cc(NC(=O)c2cccc(F)c2)sc1C(=O)N1CC[C@@H](N2CCCCC2)C1 ZINC000517411813 924164376 /nfs/dbraw/zinc/16/43/76/924164376.db2.gz YSPHPOLBHTWYNM-GOSISDBHSA-N 0 3 415.534 4.148 20 0 HIADHN CCCN(C(=O)NCc1csc(CC)n1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000517425964 924175833 /nfs/dbraw/zinc/17/58/33/924175833.db2.gz FHVBSGZDWSILFQ-HXUWFJFHSA-N 0 3 400.592 4.292 20 0 HIADHN Brc1ccc2c(c1)C=C(CNCc1cccc(Cn3cccn3)c1)CO2 ZINC000517537329 924252548 /nfs/dbraw/zinc/25/25/48/924252548.db2.gz QHZSTWIBUSXGRF-UHFFFAOYSA-N 0 3 410.315 4.260 20 0 HIADHN COc1cc(CNCCNC(=O)c2ccc(C)cc2)ccc1OCc1ccc(F)cc1 ZINC000517575668 926689342 /nfs/dbraw/zinc/68/93/42/926689342.db2.gz CBQDWJDYLVOKCC-UHFFFAOYSA-N 0 3 422.500 4.241 20 0 HIADHN C[C@@H]1CCCCN1C(=O)CN(C)CCCCCc1cc(-c2cccc(F)c2)n[nH]1 ZINC000517600162 926710093 /nfs/dbraw/zinc/71/00/93/926710093.db2.gz PJYQEQDTUFGLGI-GOSISDBHSA-N 0 3 400.542 4.261 20 0 HIADHN CCN1CCCC[C@@H]1CNC(=O)c1ccc(-c2nnc(-c3cccc(C)c3)o2)cc1 ZINC000517642771 926750604 /nfs/dbraw/zinc/75/06/04/926750604.db2.gz IWOLVMRJWAEDCJ-OAQYLSRUSA-N 0 3 404.514 4.316 20 0 HIADHN CCN1CCCN(C(=O)c2cc3ccccc3cc2OCc2c(C)noc2C)CC1 ZINC000517680410 926785735 /nfs/dbraw/zinc/78/57/35/926785735.db2.gz XIHYAGWIGGRODQ-UHFFFAOYSA-N 0 3 407.514 4.191 20 0 HIADHN Cc1cc(-c2cc(C(=O)N(C)[C@@H]3CN4CCC3CC4)c3cnn(C(C)C)c3n2)c(C)o1 ZINC000517697478 926800534 /nfs/dbraw/zinc/80/05/34/926800534.db2.gz QWWKQXSMRZRURW-JOCHJYFZSA-N 0 3 421.545 4.055 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)N1CCC[C@H]1Cc1ccc(F)cc1 ZINC000517724087 926814985 /nfs/dbraw/zinc/81/49/85/926814985.db2.gz GMSVGEPRDLENAK-PMACEKPBSA-N 0 3 401.551 4.441 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1c(C)cccc1C(=O)N1CCCC1)c1ccco1 ZINC000517768830 926828332 /nfs/dbraw/zinc/82/83/32/926828332.db2.gz PKSLBOYHMLYRIZ-HKUYNNGSSA-N 0 3 412.534 4.075 20 0 HIADHN CC(C)(C)NC(=O)c1ccc(NC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)cc1 ZINC000517897162 926880369 /nfs/dbraw/zinc/88/03/69/926880369.db2.gz QXQMQHUURDGDTQ-IBGZPJMESA-N 0 3 411.521 4.205 20 0 HIADHN O=C(NCCCc1cccc(F)c1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000518314008 927176977 /nfs/dbraw/zinc/17/69/77/927176977.db2.gz VFONDIAFZZASQX-UHFFFAOYSA-N 0 3 401.551 4.171 20 0 HIADHN CC(C)COc1cccc(NC(=O)N2CCC(CN3C[C@H](C)O[C@@H](C)C3)CC2)c1 ZINC000518316069 927178269 /nfs/dbraw/zinc/17/82/69/927178269.db2.gz PBMSZCWVOVEZHT-OALUTQOASA-N 0 3 403.567 4.075 20 0 HIADHN Cc1ccccc1CCNC(=O)[C@@H](C)N(C)CCCc1cc(-c2cccc(F)c2)n[nH]1 ZINC000518316748 927180223 /nfs/dbraw/zinc/18/02/23/927180223.db2.gz TUHLKZNRHICREZ-LJQANCHMSA-N 0 3 422.548 4.136 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)c1cc2ccc(F)cc2nc1C ZINC000518316852 927180827 /nfs/dbraw/zinc/18/08/27/927180827.db2.gz YWGPJIADPUGXJG-NRFANRHFSA-N 0 3 406.505 4.204 20 0 HIADHN CN(Cc1cccc(Br)c1)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000518357034 927218240 /nfs/dbraw/zinc/21/82/40/927218240.db2.gz SVLPKOWGGLLECQ-HXUWFJFHSA-N 0 3 416.363 4.255 20 0 HIADHN CCOc1ccc([C@@H]2CCCN2C(=O)CCCN2CCN(c3ccccc3)CC2)cc1 ZINC000518356895 927218417 /nfs/dbraw/zinc/21/84/17/927218417.db2.gz DDCGRJIARNZLSI-VWLOTQADSA-N 0 3 421.585 4.351 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)C2(c3ccc(C)cc3)CCOCC2)N2CCCC2)cc1 ZINC000518399065 927240171 /nfs/dbraw/zinc/24/01/71/927240171.db2.gz PQICQEWOCISCFZ-XMMPIXPASA-N 0 3 406.570 4.305 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)N(C)Cc2ccccc2Br)C1 ZINC000518403356 927244536 /nfs/dbraw/zinc/24/45/36/927244536.db2.gz KAWZDYUXOGBMSJ-LPHOPBHVSA-N 0 3 416.363 4.426 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N(Cc2ccccc2)C[C@@H]2CCCO2)C1 ZINC000518406785 927248222 /nfs/dbraw/zinc/24/82/22/927248222.db2.gz CMFIVKBFOGCWRW-HUVFLSCGSA-N 0 3 407.558 4.213 20 0 HIADHN COc1ccc([C@@H](Cc2ccccc2)NCc2ccc(C)c(S(C)(=O)=O)c2)cc1 ZINC000518447504 927279570 /nfs/dbraw/zinc/27/95/70/927279570.db2.gz YYUJTHGKBIQRHU-HSZRJFAPSA-N 0 3 409.551 4.481 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)C(=O)N1CCCCC[C@@H]1c1cccc(C)c1 ZINC000518611071 927377008 /nfs/dbraw/zinc/37/70/08/927377008.db2.gz MAWLFSQQYKSOHV-JOCHJYFZSA-N 0 3 423.557 4.148 20 0 HIADHN Cc1c(Cl)cccc1-n1ccnc1SCC(=O)N1CC[C@@H](N2CCCCC2)C1 ZINC000518615830 927380921 /nfs/dbraw/zinc/38/09/21/927380921.db2.gz AAXXTCKPPDAQSW-QGZVFWFLSA-N 0 3 418.994 4.013 20 0 HIADHN CS(=O)(=O)c1ccc(CN[C@H](c2ccc(Br)cc2)C2CCC2)cc1 ZINC000518764570 927481878 /nfs/dbraw/zinc/48/18/78/927481878.db2.gz TUAVWEDCXWXGRX-IBGZPJMESA-N 0 3 408.361 4.484 20 0 HIADHN Fc1ccc(-c2nc(CNCCCN3CCN(c4ccccc4)CC3)cs2)cc1 ZINC000518766224 927483075 /nfs/dbraw/zinc/48/30/75/927483075.db2.gz LRIRFVZOMISGDX-UHFFFAOYSA-N 0 3 410.562 4.251 20 0 HIADHN CCc1c(C(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)nnn1-c1cccc(Cl)c1 ZINC000518788220 927493027 /nfs/dbraw/zinc/49/30/27/927493027.db2.gz VMYRGEDRQFVHSE-VQIMIIECSA-N 0 3 423.948 4.048 20 0 HIADHN COc1cccc(CN(C[C@H](O)COc2ccc3ccccc3c2)C[C@@H]2CCCO2)c1 ZINC000518830487 927528081 /nfs/dbraw/zinc/52/80/81/927528081.db2.gz MBYQWNMBKGTHOK-OZXSUGGESA-N 0 3 421.537 4.269 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)NCC1(Sc2ccccc2)CC1 ZINC000518894425 927604348 /nfs/dbraw/zinc/60/43/48/927604348.db2.gz CSGQPRORAKEKSM-UHFFFAOYSA-N 0 3 409.599 4.030 20 0 HIADHN C[C@@H](C(=O)N(C)CCCc1nc2ccccc2[nH]1)N1CCC(Cc2ccccc2)CC1 ZINC000518917237 927624370 /nfs/dbraw/zinc/62/43/70/927624370.db2.gz JAEBJCRGEQYPCL-FQEVSTJZSA-N 0 3 418.585 4.297 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)[C@@H](C)N1CCC(Cc2ccccc2)CC1 ZINC000518923902 927631792 /nfs/dbraw/zinc/63/17/92/927631792.db2.gz AZRONABZXCWVCS-LJQANCHMSA-N 0 3 409.574 4.039 20 0 HIADHN COc1cc(CN(C)C(=O)N[C@@H]2CCN(Cc3ccccc3)[C@H]2C)ccc1SC ZINC000519020275 927698035 /nfs/dbraw/zinc/69/80/35/927698035.db2.gz AFWOGNNVUDMITE-FXAWDEMLSA-N 0 3 413.587 4.222 20 0 HIADHN COc1ccc(OCc2nc(CN[C@@H]3CCN(Cc4ccccc4)[C@H]3C)cs2)cc1 ZINC000519025440 927701739 /nfs/dbraw/zinc/70/17/39/927701739.db2.gz RXBINAYUTHTOJV-FDDCHVKYSA-N 0 3 423.582 4.483 20 0 HIADHN COc1ccc2c(c1)CCCN(C(=O)NC[C@@H](c1ccc(C)cc1)N1CCCC1)C2 ZINC000519031302 927708021 /nfs/dbraw/zinc/70/80/21/927708021.db2.gz XIKMHKHJIZWLNY-DEOSSOPVSA-N 0 3 407.558 4.299 20 0 HIADHN CN(C)[C@@H](CNC(=O)c1ccccc1C(=O)c1ccc(Cl)c(Cl)c1)C1CC1 ZINC000519236704 927840625 /nfs/dbraw/zinc/84/06/25/927840625.db2.gz QBUOKDWBFXIVSM-IBGZPJMESA-N 0 3 405.325 4.294 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N[C@H](c2ccc(F)cc2)[C@H]2CCCO2)N(C)C)cc1 ZINC000519250876 927847278 /nfs/dbraw/zinc/84/72/78/927847278.db2.gz OALAAJDCAZDPDT-YTFSRNRJSA-N 0 3 413.537 4.210 20 0 HIADHN Cc1cc(C(=O)NC(C)C)ccc1NC(=O)N(CCCc1ccccc1)CCN(C)C ZINC000519256432 927849668 /nfs/dbraw/zinc/84/96/68/927849668.db2.gz VQFPFTJMKIWQOZ-UHFFFAOYSA-N 0 3 424.589 4.162 20 0 HIADHN Cc1c([C@@H](C)NC(=O)N2CCN(CCC(C)(C)C)CC2)cnn1-c1ccc(F)cc1 ZINC000519265789 927855771 /nfs/dbraw/zinc/85/57/71/927855771.db2.gz RXJVSBFUERSETI-QGZVFWFLSA-N 0 3 415.557 4.144 20 0 HIADHN COc1ccc2oc([C@@H](C)NC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)c(C)c2c1 ZINC000519294729 927867658 /nfs/dbraw/zinc/86/76/58/927867658.db2.gz JVBOFMIZGSBWCC-IEBWSBKVSA-N 0 3 407.514 4.385 20 0 HIADHN O=C(NCc1ccccc1OCC(F)(F)F)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000519442044 927949428 /nfs/dbraw/zinc/94/94/28/927949428.db2.gz RDYPLTWAPNDJLX-GOSISDBHSA-N 0 3 424.438 4.295 20 0 HIADHN COCCOc1cc(C)ccc1NC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000519445059 927953329 /nfs/dbraw/zinc/95/33/29/927953329.db2.gz ZACRFFJJRQHKOO-LJQANCHMSA-N 0 3 400.494 4.010 20 0 HIADHN Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)N[C@H]1CCN(Cc2ccccc2)[C@H]1C ZINC000519468519 927969460 /nfs/dbraw/zinc/96/94/60/927969460.db2.gz NZEMIJFDSUGNNG-CVDCTZTESA-N 0 3 422.573 4.165 20 0 HIADHN Cc1ccc(NC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)cc1C(=O)NC(C)C ZINC000519487852 927984717 /nfs/dbraw/zinc/98/47/17/927984717.db2.gz GPJZLTRZVZBNAR-IBGZPJMESA-N 0 3 411.521 4.123 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)N[C@H](c1ccccc1)c1ccccn1 ZINC000519501091 927995740 /nfs/dbraw/zinc/99/57/40/927995740.db2.gz GITJUMPJKIOJFE-HSZRJFAPSA-N 0 3 424.495 4.223 20 0 HIADHN C[C@@H](NC(=O)N(CCN(C)C)Cc1cccc(F)c1)c1cccc(OC(F)F)c1 ZINC000519504729 927998449 /nfs/dbraw/zinc/99/84/49/927998449.db2.gz HNNYFEVEHWXMNI-OAHLLOKOSA-N 0 3 409.452 4.262 20 0 HIADHN CN(C)Cc1ccccc1CNC(=O)C1(Cc2ccccc2Br)CC1 ZINC000519535141 928009935 /nfs/dbraw/zinc/00/99/35/928009935.db2.gz AIBXXXQKBSKOEH-UHFFFAOYSA-N 0 3 401.348 4.150 20 0 HIADHN CN(C)C[C@@H](NC(=O)CCNC(=O)c1ccc2ccccc2c1)c1ccc(Cl)cc1 ZINC000519710330 928053466 /nfs/dbraw/zinc/05/34/66/928053466.db2.gz LKMZUPCATXNTBE-JOCHJYFZSA-N 0 3 423.944 4.032 20 0 HIADHN COc1ccc(OC)c(CN(C(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)C2CC2)c1 ZINC000519810951 928084360 /nfs/dbraw/zinc/08/43/60/928084360.db2.gz GABZLBJKWVHXFQ-GHTZIAJQSA-N 0 3 423.557 4.213 20 0 HIADHN O[C@@H](COC(c1ccc(Cl)cc1)c1ccc(Cl)cc1)CN1CCCOCC1 ZINC000519906268 928140503 /nfs/dbraw/zinc/14/05/03/928140503.db2.gz UJEUJVBUHCGICT-HXUWFJFHSA-N 0 3 410.341 4.183 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)[C@@H](c2ccccc2)N2CCSCC2)N2CCCC2)cc1 ZINC000519936791 928171824 /nfs/dbraw/zinc/17/18/24/928171824.db2.gz RGRKXCLJSMIGQY-DNQXCXABSA-N 0 3 423.626 4.038 20 0 HIADHN COc1cccc(CN(CCC(=O)Nc2ccc(Cl)cc2F)C[C@H]2CCCO2)c1 ZINC000519941307 928176214 /nfs/dbraw/zinc/17/62/14/928176214.db2.gz OJCVVNQZGPQSAW-LJQANCHMSA-N 0 3 420.912 4.498 20 0 HIADHN CC(C)NC(=O)Nc1ccc(NC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)cc1 ZINC000520093341 928304897 /nfs/dbraw/zinc/30/48/97/928304897.db2.gz CVVCFCPXLJOXDP-SFHVURJKSA-N 0 3 412.509 4.206 20 0 HIADHN CCCC(=O)Nc1cccc(CNC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)c1 ZINC000520113309 928319275 /nfs/dbraw/zinc/31/92/75/928319275.db2.gz VSYQHAITGUEMAE-FQEVSTJZSA-N 0 3 411.521 4.093 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)N[C@@H]1CCOc2c(Cl)cccc21 ZINC000520130277 928328667 /nfs/dbraw/zinc/32/86/67/928328667.db2.gz NWURJRDJKMKVNK-LJQANCHMSA-N 0 3 405.901 4.076 20 0 HIADHN COCCN1CCC(NC(=O)Nc2cccc(CO[C@H]3CCC[C@H](C)C3)c2)CC1 ZINC000520132689 928329693 /nfs/dbraw/zinc/32/96/93/928329693.db2.gz PZTYJYLMOWETCE-AVRDEDQJSA-N 0 3 403.567 4.014 20 0 HIADHN CCCN(CC(=O)N1CCc2cc(OC)c(OC)cc2C1)[C@@H](CC)c1ccccc1 ZINC000520172734 928363393 /nfs/dbraw/zinc/36/33/93/928363393.db2.gz WSXJOLHXAPWUQH-QFIPXVFZSA-N 0 3 410.558 4.452 20 0 HIADHN CC(C)[C@H](C(=O)Nc1cccc(C(=O)Nc2ccc(Cl)cn2)c1)N1CCCCC1 ZINC000520243856 928412765 /nfs/dbraw/zinc/41/27/65/928412765.db2.gz PNGWVEXEOJQJJK-HXUWFJFHSA-N 0 3 414.937 4.436 20 0 HIADHN CN(C(=O)c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1)[C@@H]1CCN(C2CC2)C1 ZINC000520318021 928478675 /nfs/dbraw/zinc/47/86/75/928478675.db2.gz YSIILHALXHURIN-QGZVFWFLSA-N 0 3 405.420 4.201 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)Nc1cccc(COCC2CC2)c1 ZINC000520325538 928489555 /nfs/dbraw/zinc/48/95/55/928489555.db2.gz VRGHFTOMIZJMNE-UHFFFAOYSA-N 0 3 407.558 4.154 20 0 HIADHN CCN(CC)[C@H](CNC(=O)C1(c2ccc(C)cc2)CCOCC1)c1cccc(OC)c1 ZINC000520334810 928498597 /nfs/dbraw/zinc/49/85/97/928498597.db2.gz WECLWFVPCPJEQJ-XMMPIXPASA-N 0 3 424.585 4.251 20 0 HIADHN COc1cc(C)c([C@H](C)NC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)cc1OC ZINC000520348532 928509607 /nfs/dbraw/zinc/50/96/07/928509607.db2.gz ZLRIUPWPMNRBGN-HKUYNNGSSA-N 0 3 414.521 4.241 20 0 HIADHN CN(C)CCN(C(=O)c1cccc(CSc2nccn2C)c1)C1CCCCC1 ZINC000520366988 928523394 /nfs/dbraw/zinc/52/33/94/928523394.db2.gz AQTXKPGQUVRJLZ-UHFFFAOYSA-N 0 3 400.592 4.049 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(OCCNCc3ccc(F)cc3F)c2)cc1 ZINC000520390463 928542983 /nfs/dbraw/zinc/54/29/83/928542983.db2.gz YGTUBAHVNNOWAK-UHFFFAOYSA-N 0 3 412.436 4.394 20 0 HIADHN Cc1nc(-c2cccc(NC(=O)NC[C@@H](C(C)C)N3CCc4ccccc4C3)c2)no1 ZINC000520435496 928564276 /nfs/dbraw/zinc/56/42/76/928564276.db2.gz YKNJFZDKLZZEAX-QFIPXVFZSA-N 0 3 419.529 4.249 20 0 HIADHN Cc1nc(-c2cccc(NC(=O)NC[C@H](C(C)C)N3CCc4ccccc4C3)c2)no1 ZINC000520435495 928564453 /nfs/dbraw/zinc/56/44/53/928564453.db2.gz YKNJFZDKLZZEAX-JOCHJYFZSA-N 0 3 419.529 4.249 20 0 HIADHN CCN(CC(=O)N1N=C(c2cccs2)C[C@H]1c1ccco1)[C@H]1CCOC(C)(C)C1 ZINC000520664805 928709383 /nfs/dbraw/zinc/70/93/83/928709383.db2.gz AFTZVASAOVWSEZ-WMZOPIPTSA-N 0 3 415.559 4.298 20 0 HIADHN CC(C)C[C@@H](CNc1nc2c(cnn2C(C)(C)C)c(=O)[nH]1)N[C@@H](C)c1ccccc1 ZINC000520673780 928720190 /nfs/dbraw/zinc/72/01/90/928720190.db2.gz PBGMXBGRCCMYOR-WMZOPIPTSA-N 0 3 410.566 4.464 20 0 HIADHN COC1CCN(C(C)(C)CNC(=O)c2cc(C)c(-c3ccc(F)cc3)s2)CC1 ZINC000520769691 928808996 /nfs/dbraw/zinc/80/89/96/928808996.db2.gz HIKQPWDMYWZRQU-UHFFFAOYSA-N 0 3 404.551 4.482 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2cccc(OCc3cccnc3)c2)N(C)C)cc1 ZINC000520831237 928835836 /nfs/dbraw/zinc/83/58/36/928835836.db2.gz YZXFPGFALIWYRI-QHCPKHFHSA-N 0 3 404.514 4.393 20 0 HIADHN O=S(=O)(NC1CCN(CC2CC2)CC1)c1ccc(Oc2cccc(Cl)c2)cc1 ZINC000520881702 928857993 /nfs/dbraw/zinc/85/79/93/928857993.db2.gz BQODLRFPUTZCCT-UHFFFAOYSA-N 0 3 420.962 4.285 20 0 HIADHN CC[C@H](C)[C@@H](NCc1ccc2[nH]cnc2c1)C(=O)Nc1cccc(N2CCCC2)c1 ZINC000520964026 928892040 /nfs/dbraw/zinc/89/20/40/928892040.db2.gz ABDPAJLEMRUMDO-GAJHUEQPSA-N 0 3 405.546 4.306 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3cc(Cl)cc4cccnc43)CC2)C[C@H](C)O1 ZINC000521006324 928921988 /nfs/dbraw/zinc/92/19/88/928921988.db2.gz JWGXFFAVXFKGOF-IYBDPMFKSA-N 0 3 416.953 4.241 20 0 HIADHN CCCOc1ccc(Cl)cc1NC(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000521007499 928923419 /nfs/dbraw/zinc/92/34/19/928923419.db2.gz LATVQHPGCBHSEH-CALCHBBNSA-N 0 3 423.985 4.482 20 0 HIADHN O=C(N[C@H](c1ccc2c(c1)OCCO2)C1CC1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000521011955 928927585 /nfs/dbraw/zinc/92/75/85/928927585.db2.gz RBJSRRQXUIXEOL-RDPSFJRHSA-N 0 3 424.516 4.076 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)NCc1cccc(C(F)(F)F)c1 ZINC000521062246 928969550 /nfs/dbraw/zinc/96/95/50/928969550.db2.gz AXYOCMVCNPKCSU-UHFFFAOYSA-N 0 3 415.406 4.257 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)NCc1ccc(F)cc1C(F)(F)F ZINC000521067334 928971148 /nfs/dbraw/zinc/97/11/48/928971148.db2.gz MRFBUKSNNXODGP-UHFFFAOYSA-N 0 3 415.406 4.257 20 0 HIADHN Cc1sc2ncnc(SCC(=O)NC[C@@H](C)N(C)Cc3ccccc3)c2c1C ZINC000521159439 929033455 /nfs/dbraw/zinc/03/34/55/929033455.db2.gz WQGKHXLYKSYFIV-CQSZACIVSA-N 0 3 414.600 4.037 20 0 HIADHN C[C@@H](NC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1)c1nc(-c2ccncc2)cs1 ZINC000521357943 929178577 /nfs/dbraw/zinc/17/85/77/929178577.db2.gz DRWDLXIJKICGAV-VQIMIIECSA-N 0 3 424.545 4.434 20 0 HIADHN Cc1ncc(CN2CCC[C@@H](c3nc(C(F)(F)F)cn3C)C2)n1-c1ccccc1 ZINC000521511806 929266200 /nfs/dbraw/zinc/26/62/00/929266200.db2.gz CPEPTWPTXOLCOQ-MRXNPFEDSA-N 0 3 403.452 4.313 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)c1cncc2ccccc21 ZINC000521571755 929304047 /nfs/dbraw/zinc/30/40/47/929304047.db2.gz LWWRPBNJMAFWIV-UHFFFAOYSA-N 0 3 401.432 4.458 20 0 HIADHN O=C(NCC1CCN(Cc2ccccc2Cl)CC1)N1CCCC[C@@H]1c1ncc[nH]1 ZINC000521622214 929333375 /nfs/dbraw/zinc/33/33/75/929333375.db2.gz ODIQPYCXZDWATC-HXUWFJFHSA-N 0 3 415.969 4.212 20 0 HIADHN CCOc1ccc(-c2nc(CC(=O)N(CCN(C)C)c3ccccc3)cs2)cc1 ZINC000521795229 929455623 /nfs/dbraw/zinc/45/56/23/929455623.db2.gz WELQLPXBGAXVRU-UHFFFAOYSA-N 0 3 409.555 4.346 20 0 HIADHN CC(C)OCc1ccccc1CNCc1cn(C)nc1-c1ccc2c(c1)OCCCO2 ZINC000521831263 929484194 /nfs/dbraw/zinc/48/41/94/929484194.db2.gz CLVNYMMHQSLPTB-UHFFFAOYSA-N 0 3 421.541 4.463 20 0 HIADHN CN1CCN(CCCNc2nc(C3CCCCC3)nc3sc4c(c32)CCC4)CC1 ZINC000521857959 929509588 /nfs/dbraw/zinc/50/95/88/929509588.db2.gz KEGOXQAIVMJPLK-UHFFFAOYSA-N 0 3 413.635 4.277 20 0 HIADHN COc1cc(CN(C)C(=O)N[C@H](CN2CCCC2)c2ccccc2)ccc1SC ZINC000521895112 929541782 /nfs/dbraw/zinc/54/17/82/929541782.db2.gz BXJXVGHUOMNQOO-HXUWFJFHSA-N 0 3 413.587 4.396 20 0 HIADHN C[C@H](c1c(F)cccc1F)N(C)C(=O)CCCN1CCN(c2ccccc2)CC1 ZINC000521954226 929588583 /nfs/dbraw/zinc/58/85/83/929588583.db2.gz GKKCYSAYAWXFQW-GOSISDBHSA-N 0 3 401.501 4.087 20 0 HIADHN CCOC(=O)c1c2c(sc1NC(=O)CC[C@H]1CCCCO1)C(C)(C)NC(C)(C)C2 ZINC000521955620 929591378 /nfs/dbraw/zinc/59/13/78/929591378.db2.gz QPOYCYOAKZMAFZ-CQSZACIVSA-N 0 3 422.591 4.372 20 0 HIADHN C[C@H](CNC(=O)CCc1nnc(-c2cc3ccccc3o2)o1)N(C)Cc1ccccc1 ZINC000521956784 929592650 /nfs/dbraw/zinc/59/26/50/929592650.db2.gz CMEFELGHIHAMKC-QGZVFWFLSA-N 0 3 418.497 4.052 20 0 HIADHN CN(C)[C@@H](CNC(=O)c1n[nH]c2ccc(Br)cc21)c1ccccc1Cl ZINC000521963153 929599673 /nfs/dbraw/zinc/59/96/73/929599673.db2.gz JBJHWMDTAOHKLK-INIZCTEOSA-N 0 3 421.726 4.012 20 0 HIADHN COc1cccc(NC(=O)[C@H](NC[C@@H](C)N(C)Cc2ccccc2)c2ccccc2)c1 ZINC000522057016 929625299 /nfs/dbraw/zinc/62/52/99/929625299.db2.gz XUVBNUJFHLASIB-CJFMBICVSA-N 0 3 417.553 4.485 20 0 HIADHN CN(C)Cc1cccc(NC(=O)NCc2cccc(NC(=O)c3ccc(F)cc3)c2)c1 ZINC000524539452 929672014 /nfs/dbraw/zinc/67/20/14/929672014.db2.gz DBJXYFIHBPIAMZ-UHFFFAOYSA-N 0 3 420.488 4.461 20 0 HIADHN Cc1noc(CSc2ccc(C(=O)N3CCN(C4CCC(C)CC4)CC3)cc2)n1 ZINC000524545652 929676198 /nfs/dbraw/zinc/67/61/98/929676198.db2.gz DBYHPHQTWSUBSJ-UHFFFAOYSA-N 0 3 414.575 4.007 20 0 HIADHN CC[C@H](NC(=O)NC[C@@H](c1cccc(OC)c1)N(CC)CC)c1nc(C)cs1 ZINC000524555346 929683823 /nfs/dbraw/zinc/68/38/23/929683823.db2.gz OFJFJJVFHUXTFT-OALUTQOASA-N 0 3 404.580 4.294 20 0 HIADHN COc1ccc2oc([C@@H](C)NC(=O)[C@@H]3CCCN(Cc4cccnc4)C3)c(C)c2c1 ZINC000524605857 929716087 /nfs/dbraw/zinc/71/60/87/929716087.db2.gz XPJYSUOXUAYBPV-IEBWSBKVSA-N 0 3 407.514 4.234 20 0 HIADHN COc1ccc2oc([C@H](C)NC(=O)[C@@H]3CCCN(Cc4cccnc4)C3)c(C)c2c1 ZINC000524605859 929716155 /nfs/dbraw/zinc/71/61/55/929716155.db2.gz XPJYSUOXUAYBPV-PKOBYXMFSA-N 0 3 407.514 4.234 20 0 HIADHN COc1cc2c(cc1OC)CN(C(=O)CN(CC1CCC1)[C@@H](C)c1ccccc1)CC2 ZINC000524620577 929727620 /nfs/dbraw/zinc/72/76/20/929727620.db2.gz FBTFXXXMEMQMAY-IBGZPJMESA-N 0 3 422.569 4.452 20 0 HIADHN CCCN(C(=O)NC[C@H](c1cccs1)N1CCCC1)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000524630446 929738709 /nfs/dbraw/zinc/73/87/09/929738709.db2.gz GJDAZPHPLBUBBS-ONCXSQPRSA-N 0 3 405.608 4.120 20 0 HIADHN CC(C)Sc1ccccc1C(=O)N1CCN(CCN(C)Cc2ccccc2)CC1 ZINC000524710618 929807230 /nfs/dbraw/zinc/80/72/30/929807230.db2.gz CRMXUUIYVWNFBO-UHFFFAOYSA-N 0 3 411.615 4.077 20 0 HIADHN CC(C)N(Cc1cccc(Br)c1)C(=O)CC1(N2CCOCC2)CCCC1 ZINC000524723569 929810983 /nfs/dbraw/zinc/81/09/83/929810983.db2.gz TYQFDTFYNSMZTE-UHFFFAOYSA-N 0 3 423.395 4.221 20 0 HIADHN COc1cc(-c2nnc(CN3CC[C@H](C)[C@H]4CCCC[C@@H]43)o2)cc(OC)c1OC ZINC000524758835 929820916 /nfs/dbraw/zinc/82/09/16/929820916.db2.gz FYKAJZRENIJWKY-UAGQMJEPSA-N 0 3 401.507 4.163 20 0 HIADHN COCCN1CCC(NC(=O)N[C@H](C)c2ccccc2-c2ccc(Cl)cc2)CC1 ZINC000524801718 929834975 /nfs/dbraw/zinc/83/49/75/929834975.db2.gz LFHCHOCNDCMUSQ-QGZVFWFLSA-N 0 3 415.965 4.478 20 0 HIADHN C[C@@H](NC(=O)NCC1(N2CCSCC2)CCCC1)c1ncc(-c2ccccc2)o1 ZINC000524802540 929835715 /nfs/dbraw/zinc/83/57/15/929835715.db2.gz APJFBUKGEJCQNT-QGZVFWFLSA-N 0 3 414.575 4.063 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)CCc1ccc(OC(F)F)cc1 ZINC000524864279 929864032 /nfs/dbraw/zinc/86/40/32/929864032.db2.gz JSMHODXKNKYRBK-GOSISDBHSA-N 0 3 402.485 4.344 20 0 HIADHN Cc1cc(C)n(-c2ccc(C(=O)N3CCCN(Cc4ccccc4)C[C@H]3C)cc2)n1 ZINC000524865499 929864499 /nfs/dbraw/zinc/86/44/99/929864499.db2.gz STJOAXYNOYUDTO-OAQYLSRUSA-N 0 3 402.542 4.226 20 0 HIADHN CCCN(Cc1ccc(OC)c(OC)c1Br)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000524908109 929883745 /nfs/dbraw/zinc/88/37/45/929883745.db2.gz NHPDEAQZCHJPKN-ZMYBRWDISA-N 0 3 412.368 4.492 20 0 HIADHN COc1ccc([C@@H](CNC(=O)CCc2c[nH]c3c2cccc3C)N2CCCC2)cc1 ZINC000525007372 929970017 /nfs/dbraw/zinc/97/00/17/929970017.db2.gz CQGREBWKLQFYPK-HSZRJFAPSA-N 0 3 405.542 4.371 20 0 HIADHN COc1ccc(C[C@@H](C)NC(=O)[C@H](C)N2CCC(Cc3ccccc3)CC2)cc1OC ZINC000525088165 930027146 /nfs/dbraw/zinc/02/71/46/930027146.db2.gz IADAMCZERDFQBJ-UXHICEINSA-N 0 3 424.585 4.094 20 0 HIADHN COC(=O)C(C)(C)c1ccc(NC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)cc1 ZINC000525090723 930028574 /nfs/dbraw/zinc/02/85/74/930028574.db2.gz HHYNEGMMHLMTSE-SFHVURJKSA-N 0 3 412.505 4.127 20 0 HIADHN Cc1noc(-c2ccccc2C(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)n1 ZINC000525111708 930044302 /nfs/dbraw/zinc/04/43/02/930044302.db2.gz WHOBVPXVMPTQCY-LJQANCHMSA-N 0 3 410.543 4.310 20 0 HIADHN CCN(CC)C(=O)c1cccc(NC(=O)[C@@H](C)N2CC[C@@H](Cc3ccccc3)C2)c1 ZINC000525125911 930050179 /nfs/dbraw/zinc/05/01/79/930050179.db2.gz LBTZSFNDZXPWRB-CTNGQTDRSA-N 0 3 407.558 4.060 20 0 HIADHN CCCN(CCN(C)C)C(=O)c1ccc(COc2ccccc2Br)cc1 ZINC000525130006 930052645 /nfs/dbraw/zinc/05/26/45/930052645.db2.gz DDPGSSCLHODGRC-UHFFFAOYSA-N 0 3 419.363 4.442 20 0 HIADHN CSc1cccc(N(C(=O)[C@@H](C)Cc2c(C)nn(C)c2C)C2CCN(C)CC2)c1 ZINC000525136691 930056047 /nfs/dbraw/zinc/05/60/47/930056047.db2.gz AKIXYDCMIITZRA-INIZCTEOSA-N 0 3 414.619 4.065 20 0 HIADHN CC(C)CC(=O)Nc1ccc(C(=O)N[C@H](CN2CCCC2)c2ccccc2)cc1F ZINC000525162038 930072638 /nfs/dbraw/zinc/07/26/38/930072638.db2.gz YVQILWBJXWJVKR-JOCHJYFZSA-N 0 3 411.521 4.377 20 0 HIADHN CC[C@H](C)[C@@H](NCc1cnc2c(C)cccn12)C(=O)Nc1cccc(N2CCCC2)c1 ZINC000525192946 930081759 /nfs/dbraw/zinc/08/17/59/930081759.db2.gz GZGGCFDNJIFWTA-FDDCHVKYSA-N 0 3 419.573 4.386 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)NCCc1ccc(Br)cc1 ZINC000525249676 930105779 /nfs/dbraw/zinc/10/57/79/930105779.db2.gz GMJXOHCLVKKJPQ-UHFFFAOYSA-N 0 3 401.304 4.229 20 0 HIADHN CN1CCN(CCCCNC(=O)N[C@@H](CC(C)(C)C)c2ccc(Cl)cc2)CC1 ZINC000525249055 930106229 /nfs/dbraw/zinc/10/62/29/930106229.db2.gz VMJNNRCWBIICOZ-FQEVSTJZSA-N 0 3 409.018 4.144 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N3CCC(Oc4ccc(C)c(C)c4)CC3)cc2)CC1 ZINC000525333357 930169197 /nfs/dbraw/zinc/16/91/97/930169197.db2.gz OWGPYHSENWTGFT-UHFFFAOYSA-N 0 3 421.585 4.129 20 0 HIADHN CCCN(CCN(C)C)C(=O)Cc1c(C)nn(-c2ccc(Cl)c(Cl)c2)c1C ZINC000525341358 930178667 /nfs/dbraw/zinc/17/86/67/930178667.db2.gz PUSKBUHYHABMBA-UHFFFAOYSA-N 0 3 411.377 4.139 20 0 HIADHN Cc1ccc(C(=O)N(CC(C)C)C2CCN(C)CC2)cc1NC(=O)NC(C)(C)C ZINC000525375403 930204715 /nfs/dbraw/zinc/20/47/15/930204715.db2.gz RZKWCFUDCFPBTC-UHFFFAOYSA-N 0 3 402.583 4.107 20 0 HIADHN Cc1oc(-c2cccs2)nc1CC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C ZINC000525384294 930210886 /nfs/dbraw/zinc/21/08/86/930210886.db2.gz BSEYFFIZIVJZLO-QGZVFWFLSA-N 0 3 409.555 4.377 20 0 HIADHN COCCc1ccc(OCCCC(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)cc1 ZINC000525384277 930211008 /nfs/dbraw/zinc/21/10/08/930211008.db2.gz WNNYUUJDOIEUQA-JOCHJYFZSA-N 0 3 424.585 4.158 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)N[C@@H]1CCCOc2ccc(F)cc21 ZINC000525394278 930215704 /nfs/dbraw/zinc/21/57/04/930215704.db2.gz LSGQKQZUWHKIQX-XMSQKQJNSA-N 0 3 411.521 4.345 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1ccc(OC[C@H]2CCCO2)cc1 ZINC000525412464 930225760 /nfs/dbraw/zinc/22/57/60/930225760.db2.gz AQJKYHFSJTWIRS-HYBUGGRVSA-N 0 3 423.557 4.373 20 0 HIADHN CC(C)(C)C[C@@H](NC(=O)NC[C@@]1(O)CCN(Cc2ccccc2)C1)c1ccccc1 ZINC000525507341 930291849 /nfs/dbraw/zinc/29/18/49/930291849.db2.gz FVUCWRUDADKCRF-RDGATRHJSA-N 0 3 409.574 4.100 20 0 HIADHN COc1cccc([C@H](CNC(=O)CCc2c[nH]c3c2cccc3C)N2CCCC2)c1 ZINC000525526398 930302823 /nfs/dbraw/zinc/30/28/23/930302823.db2.gz FOQYXGFGFGVADJ-QHCPKHFHSA-N 0 3 405.542 4.371 20 0 HIADHN Cc1cccc2cc(C(=O)Nc3ccc(C(=O)N(C)[C@@H]4CCCN(C)C4)cc3)oc21 ZINC000525579176 930341773 /nfs/dbraw/zinc/34/17/73/930341773.db2.gz DYNWGVIWPNGVLD-HXUWFJFHSA-N 0 3 405.498 4.160 20 0 HIADHN CC[C@H](Cc1ccccc1)N(C)CC(=O)NCc1c(C)nn(Cc2ccccc2)c1C ZINC000525636061 930375682 /nfs/dbraw/zinc/37/56/82/930375682.db2.gz CXKSHSJOOCCXLR-XMMPIXPASA-N 0 3 418.585 4.118 20 0 HIADHN c1ccc(Oc2ccc(OCCN3CCC[C@H](c4nnc5n4CCC5)C3)cc2)cc1 ZINC000525635637 930375897 /nfs/dbraw/zinc/37/58/97/930375897.db2.gz JGCCIEFXYPARMY-IBGZPJMESA-N 0 3 404.514 4.275 20 0 HIADHN C[C@@H]1C[C@@H](c2ccccc2)[C@@H](C)N1C(=O)CCCN1CCN(c2ccccc2)CC1 ZINC000525645404 930380493 /nfs/dbraw/zinc/38/04/93/930380493.db2.gz LIUJZBNVMJWANI-TZBSWOFLSA-N 0 3 405.586 4.382 20 0 HIADHN FC(F)Oc1cc2c(cc1CNCCc1nc3ccccc3n1C(F)F)OCO2 ZINC000525696019 930407299 /nfs/dbraw/zinc/40/72/99/930407299.db2.gz BTJSRPSELFHQIC-UHFFFAOYSA-N 0 3 411.355 4.094 20 0 HIADHN FC(F)COc1ccc(CNCc2cc(Br)c3c(c2)OCCO3)cc1 ZINC000525708521 930412305 /nfs/dbraw/zinc/41/23/05/930412305.db2.gz WPOVHFQQXWFZQE-UHFFFAOYSA-N 0 3 414.246 4.154 20 0 HIADHN Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)N[C@H]1CCCN(c2cnn(C)c2)C1=O ZINC000525756836 930432631 /nfs/dbraw/zinc/43/26/31/930432631.db2.gz KISDGSKARMITDO-BEFAXECRSA-N 0 3 409.559 4.007 20 0 HIADHN CC(C)OCc1ccccc1CNC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC000525811054 930453025 /nfs/dbraw/zinc/45/30/25/930453025.db2.gz ZHNGTLFOHSFVSF-OAQYLSRUSA-N 0 3 409.574 4.418 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)Nc1cccc(Oc2ccccc2)c1 ZINC000525843997 930463699 /nfs/dbraw/zinc/46/36/99/930463699.db2.gz MVVYFCFTTAUDKV-UHFFFAOYSA-N 0 3 403.482 4.426 20 0 HIADHN Cc1cccc([C@H]2CCCN2C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)n1 ZINC000525928126 930485503 /nfs/dbraw/zinc/48/55/03/930485503.db2.gz FKLHHNZYXYNHLZ-FAFZWHIHSA-N 0 3 410.484 4.042 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)N[C@H](C)[C@@H](c3ccccc3C)[NH+](C)C)cc2)cc(=O)[n-]1 ZINC000525955522 930493642 /nfs/dbraw/zinc/49/36/42/930493642.db2.gz ALBKLTAOOMJXSH-MWTRTKDXSA-N 0 3 419.529 4.279 20 0 HIADHN COc1cc(CN[C@@H](CCn2cncn2)c2ccc(C)cc2)ccc1OC(F)F ZINC000526107271 930536390 /nfs/dbraw/zinc/53/63/90/930536390.db2.gz GTYOXPRNYMMOOH-SFHVURJKSA-N 0 3 402.445 4.118 20 0 HIADHN CCCOc1ccc(NC(=O)C(=O)Nc2cc(CN(C)C)ccc2C)cc1Cl ZINC000526109125 930536969 /nfs/dbraw/zinc/53/69/69/930536969.db2.gz QNBQBLASYAJGMN-UHFFFAOYSA-N 0 3 403.910 4.076 20 0 HIADHN O=C(Nc1cc(F)cc(NCC(F)(F)F)c1)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000526934759 930552295 /nfs/dbraw/zinc/55/22/95/930552295.db2.gz BQOUXANSMQSDEE-OAHLLOKOSA-N 0 3 410.415 4.046 20 0 HIADHN C[C@@H](NCC(=O)NCCc1cnn(-c2ccccc2)c1)c1cc2ccccc2s1 ZINC000526944639 930555010 /nfs/dbraw/zinc/55/50/10/930555010.db2.gz IFOMPZPRCNCXKU-QGZVFWFLSA-N 0 3 404.539 4.097 20 0 HIADHN CC(C)(Cc1ccc(C(F)(F)F)cc1)NC(=O)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000526951868 930556785 /nfs/dbraw/zinc/55/67/85/930556785.db2.gz XXTNWQXPAKNOEE-IBGZPJMESA-N 0 3 419.491 4.450 20 0 HIADHN Cc1ccccc1[C@@H]([C@@H](C)NC(=O)C(=O)Nc1ccc2oc(C(C)C)nc2c1)N(C)C ZINC000526957890 930558174 /nfs/dbraw/zinc/55/81/74/930558174.db2.gz VXJKDDJCEIZZAW-IIBYNOLFSA-N 0 3 422.529 4.006 20 0 HIADHN CS(=O)(=O)[C@@H]1CCC[C@@H](N[C@@H](c2ccc(Br)cc2Cl)C2CC2)C1 ZINC000527109281 930592631 /nfs/dbraw/zinc/59/26/31/930592631.db2.gz IKSLMHNZSDSKCE-CKEIUWERSA-N 0 3 420.800 4.499 20 0 HIADHN Cc1cc(N2CCC[C@H](N[C@@H](c3cccnc3)C3CC3)C2=O)ccc1Br ZINC000527326329 930634473 /nfs/dbraw/zinc/63/44/73/930634473.db2.gz YOYACJKIEVNLGX-VQTJNVASSA-N 0 3 414.347 4.389 20 0 HIADHN CN1CCN(CCCCNC(=O)Nc2cc(-c3ccccc3)ccc2Cl)CC1 ZINC000527440626 930656253 /nfs/dbraw/zinc/65/62/53/930656253.db2.gz HTAJUEZQVTUSTN-UHFFFAOYSA-N 0 3 400.954 4.156 20 0 HIADHN Cn1c(=O)sc2cc(CNCc3ccc(-n4ccc(C(F)(F)F)n4)cc3)ccc21 ZINC000527520018 930673233 /nfs/dbraw/zinc/67/32/33/930673233.db2.gz DXIKHAWALNKQOM-UHFFFAOYSA-N 0 3 418.444 4.094 20 0 HIADHN Cn1c2ccc(CNC3(c4cccc(C(F)(F)F)c4)CCOCC3)cc2sc1=O ZINC000530281030 930675469 /nfs/dbraw/zinc/67/54/69/930675469.db2.gz IBNQRXRSLLLRGN-UHFFFAOYSA-N 0 3 422.472 4.414 20 0 HIADHN CC1CCN(C(=O)c2ccc(NC(=O)N[C@@H]3CCN(C)[C@H]3c3ccccc3)cc2)CC1 ZINC000530356891 930692262 /nfs/dbraw/zinc/69/22/62/930692262.db2.gz ONECKZMPWXJEIL-PKTZIBPZSA-N 0 3 420.557 4.126 20 0 HIADHN CCC(C)(C)NC(=O)c1ccc(NC(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)cc1 ZINC000530409369 930703819 /nfs/dbraw/zinc/70/38/19/930703819.db2.gz XDGXEZMKEGEUAY-RTWAWAEBSA-N 0 3 408.546 4.172 20 0 HIADHN O=C([C@H]1CCCCN1Cc1ccccc1)N1CC=C(c2c[nH]c3ncccc23)CC1 ZINC000530565511 930750624 /nfs/dbraw/zinc/75/06/24/930750624.db2.gz ROWBONMFQPQTQO-HSZRJFAPSA-N 0 3 400.526 4.233 20 0 HIADHN CN(C)Cc1cccc(C(=O)NCC2(c3ccc(Br)cc3)CCC2)c1 ZINC000530569234 930753023 /nfs/dbraw/zinc/75/30/23/930753023.db2.gz JTJDHPZTULCZLO-UHFFFAOYSA-N 0 3 401.348 4.362 20 0 HIADHN COc1cc(C)c(CN[C@@H](Cc2ccccc2)C(=O)NCc2ccccc2)cc1OC ZINC000530722979 930808051 /nfs/dbraw/zinc/80/80/51/930808051.db2.gz DURIIIAIRNCWKQ-QHCPKHFHSA-N 0 3 418.537 4.030 20 0 HIADHN COc1c(Br)cc(Cl)cc1NC(=O)N(CCN(C)C)CC(C)C ZINC000530776295 930821237 /nfs/dbraw/zinc/82/12/37/930821237.db2.gz XIEYJCXRFLGQHC-UHFFFAOYSA-N 0 3 406.752 4.163 20 0 HIADHN COc1ccccc1CN(CCCc1nc(-c2ccccc2)no1)C[C@@H]1CCCO1 ZINC000530866033 930843547 /nfs/dbraw/zinc/84/35/47/930843547.db2.gz AYNDWFNHAMEQOK-NRFANRHFSA-N 0 3 407.514 4.359 20 0 HIADHN COc1ccccc1-c1noc([C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)n1 ZINC000530879240 930847066 /nfs/dbraw/zinc/84/70/66/930847066.db2.gz IFAWCJUIXLRZDA-FQEVSTJZSA-N 0 3 403.404 4.451 20 0 HIADHN O=C([C@@H]1CC12CCOCC2)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000530906797 930855238 /nfs/dbraw/zinc/85/52/38/930855238.db2.gz FIVLYZCROAAKLR-KRWDZBQOSA-N 0 3 411.373 4.235 20 0 HIADHN O=C(Nc1cc(CCc2ccccc2)ccn1)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000530991554 930878466 /nfs/dbraw/zinc/87/84/66/930878466.db2.gz WCEMPOUKGRKNAO-HSZRJFAPSA-N 0 3 400.526 4.113 20 0 HIADHN C[C@@H](CC(=O)Nc1cccc(N2CCCC2)c1)NCc1cnc(-c2ccccn2)s1 ZINC000531001186 930879972 /nfs/dbraw/zinc/87/99/72/930879972.db2.gz GLFUYNGKOXFIDR-KRWDZBQOSA-N 0 3 421.570 4.312 20 0 HIADHN COC(=O)CCC1CCN([C@@H](C)C(=O)N[C@@H](C)c2ccc(Cl)cc2Cl)CC1 ZINC000531001636 930880629 /nfs/dbraw/zinc/88/06/29/930880629.db2.gz UBPHYPIMOBSRNQ-KBPBESRZSA-N 0 3 415.361 4.224 20 0 HIADHN CC(C)CN(CCN(C)C)C(=O)Nc1nnc(SCc2ccc(F)cc2)s1 ZINC000531015472 930885105 /nfs/dbraw/zinc/88/51/05/930885105.db2.gz XNVTYBZYIDMFOO-UHFFFAOYSA-N 0 3 411.572 4.021 20 0 HIADHN CCN(C(=O)CC1(N2CCOCC2)CCCC1)[C@@H](c1ccc(C)cc1)c1cccnc1 ZINC000531055629 930900380 /nfs/dbraw/zinc/90/03/80/930900380.db2.gz PUHVVEDEZYRGLS-VWLOTQADSA-N 0 3 421.585 4.363 20 0 HIADHN COC(=O)c1cc2c(o1)c(OC)ccc2CNCc1cccc(NC(=O)C2CCC2)c1 ZINC000531142631 930943044 /nfs/dbraw/zinc/94/30/44/930943044.db2.gz PJHIZWKJHUJNHX-UHFFFAOYSA-N 0 3 422.481 4.256 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)CCC(=O)c3ccc(Cl)cc3)CC2)C[C@@H](C)O1 ZINC000531178950 930954476 /nfs/dbraw/zinc/95/44/76/930954476.db2.gz AMKLPBLHAFKEGS-QZTJIDSGSA-N 0 3 420.981 4.041 20 0 HIADHN Cc1cc([C@H](C)NC(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)c(C)s1 ZINC000531183490 930956146 /nfs/dbraw/zinc/95/61/46/930956146.db2.gz FAGJWWZQYATDBZ-BQFCYCMXSA-N 0 3 407.624 4.347 20 0 HIADHN CO[C@@H](C)c1nc(CN2CCCN(Cc3cc(C)nc4ccccc34)CC2)cs1 ZINC000531231065 930975682 /nfs/dbraw/zinc/97/56/82/930975682.db2.gz CFZGAWRGIIOYAF-SFHVURJKSA-N 0 3 410.587 4.415 20 0 HIADHN Cc1c(NC(=O)CC2(N3CCOCC3)CCCC2)cccc1NC(=O)c1ccccc1 ZINC000531285522 931000977 /nfs/dbraw/zinc/00/09/77/931000977.db2.gz FTJNNFPVSDHEFT-UHFFFAOYSA-N 0 3 421.541 4.221 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2cccc(Nc3cnn(C)c3)c2)N2CCCC2)cc1 ZINC000531355433 931029999 /nfs/dbraw/zinc/02/99/99/931029999.db2.gz JWALTWOZJKZORC-QHCPKHFHSA-N 0 3 403.530 4.039 20 0 HIADHN O=C(NC[C@H](Cc1ccccc1)c1ccccc1)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000531389274 931040807 /nfs/dbraw/zinc/04/08/07/931040807.db2.gz KQHJTTNDPGTSJK-UIOOFZCWSA-N 0 3 413.565 4.436 20 0 HIADHN Fc1ccccc1-c1n[nH]cc1CNCc1cc(Br)c2c(c1)OCCO2 ZINC000531532249 931094685 /nfs/dbraw/zinc/09/46/85/931094685.db2.gz RDTAKIVUPAGYJI-UHFFFAOYSA-N 0 3 418.266 4.039 20 0 HIADHN CCCc1ccc([C@@H](NC(=O)N2CC[C@@H](N3CCN(C(C)C)CC3)C2)C(C)C)cc1 ZINC000531584866 931110053 /nfs/dbraw/zinc/11/00/53/931110053.db2.gz OTQSYHPLTNQLJJ-RPWUZVMVSA-N 0 3 414.638 4.146 20 0 HIADHN CCCc1ccc([C@@H](NC(=O)N2CC[C@H](N3CCN(C(C)C)CC3)C2)C(C)C)cc1 ZINC000531584867 931110499 /nfs/dbraw/zinc/11/04/99/931110499.db2.gz OTQSYHPLTNQLJJ-ZEQRLZLVSA-N 0 3 414.638 4.146 20 0 HIADHN COc1ccc(Nc2nc(C(=O)N(CCN(C)C)Cc3ccc(C)o3)cs2)cc1 ZINC000531594081 931113407 /nfs/dbraw/zinc/11/34/07/931113407.db2.gz SVPPEOGOBUGFGG-UHFFFAOYSA-N 0 3 414.531 4.001 20 0 HIADHN C[C@@H](NC[C@H](c1cccs1)N1CCN(C)CC1)c1sccc1Br ZINC000531677411 931147610 /nfs/dbraw/zinc/14/76/10/931147610.db2.gz VXSWTDGBJNVTLI-UKRRQHHQSA-N 0 3 414.438 4.211 20 0 HIADHN C[C@H](CC(=O)N(C)Cc1ccccc1Cl)NCc1cnn(Cc2ccccc2)c1 ZINC000531685816 931152275 /nfs/dbraw/zinc/15/22/75/931152275.db2.gz KIZGURRUGULCCX-GOSISDBHSA-N 0 3 410.949 4.112 20 0 HIADHN C[C@H](NC[C@H](O)COc1cccc(C(F)(F)F)c1)c1cnn(Cc2ccccc2)c1 ZINC000531695691 931157912 /nfs/dbraw/zinc/15/79/12/931157912.db2.gz QJLHVJJAQGDIPG-JXFKEZNVSA-N 0 3 419.447 4.041 20 0 HIADHN C[C@@H]1C[C@H](NCc2cccc(CS(C)(=O)=O)c2)c2cccc(Br)c21 ZINC000531707567 931167909 /nfs/dbraw/zinc/16/79/09/931167909.db2.gz FKIXJMUSFPJXLG-ACJLOTCBSA-N 0 3 408.361 4.332 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)NCC(=O)N2CCC(Cc3ccccc3)CC2)cc1 ZINC000531737704 931179373 /nfs/dbraw/zinc/17/93/73/931179373.db2.gz PUJNHWRGPAMNIB-FQEVSTJZSA-N 0 3 416.569 4.313 20 0 HIADHN Cc1ccc(SC2(C(=O)N3CC[C@H](N4CCN(C(C)C)CC4)C3)CCCC2)cc1 ZINC000531832715 931212572 /nfs/dbraw/zinc/21/25/72/931212572.db2.gz UHOCGJHARRWGGV-NRFANRHFSA-N 0 3 415.647 4.027 20 0 HIADHN C[C@@H](c1ccccc1)N(CC(=O)NCc1cccc(C(=O)NC2CC2)c1)CC1CCC1 ZINC000531905307 931243007 /nfs/dbraw/zinc/24/30/07/931243007.db2.gz LKIKCRCOHNEHPX-IBGZPJMESA-N 0 3 419.569 4.058 20 0 HIADHN C[C@H](NC[C@H](c1cccs1)N1CCOCC1)c1sccc1Br ZINC000531931952 931250756 /nfs/dbraw/zinc/25/07/56/931250756.db2.gz XMSXZRWQPWVMPB-GXTWGEPZSA-N 0 3 401.395 4.296 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N2CCC(Nc3ccc(F)cc3)CC2)C1 ZINC000531935583 931252611 /nfs/dbraw/zinc/25/26/11/931252611.db2.gz XUZXANJOTLVPOK-JPYJTQIMSA-N 0 3 410.537 4.247 20 0 HIADHN C[C@H](CC(=O)Nc1cccc(Br)c1)NCc1cnn(-c2ccccc2)c1 ZINC000531943759 931256805 /nfs/dbraw/zinc/25/68/05/931256805.db2.gz LFJHXGLHDAWMBM-OAHLLOKOSA-N 0 3 413.319 4.142 20 0 HIADHN COc1cc([C@@H](C)N[C@@H](C)c2ccc(S(=O)(=O)N(C)C)cc2)ccc1OC(C)C ZINC000531944783 931256898 /nfs/dbraw/zinc/25/68/98/931256898.db2.gz KSVPPHSJJMRBPK-DLBZAZTESA-N 0 3 420.575 4.145 20 0 HIADHN C[C@H](NCc1ccc(N2CCOCC2)nc1)c1ccc(SCC(F)(F)F)cc1 ZINC000531944594 931256905 /nfs/dbraw/zinc/25/69/05/931256905.db2.gz ICQVTBPEVOFPSZ-HNNXBMFYSA-N 0 3 411.493 4.423 20 0 HIADHN C[C@H](NCc1ccc(-n2ccc(C(F)(F)F)n2)cc1)c1ccc([S@](C)=O)cc1 ZINC000531948706 931259429 /nfs/dbraw/zinc/25/94/29/931259429.db2.gz FYIJDGMXKRNBQQ-POXGOYDTSA-N 0 3 407.461 4.479 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(OCC(F)(F)F)cc1)c1cccc(NS(C)(=O)=O)c1 ZINC000531950759 931260416 /nfs/dbraw/zinc/26/04/16/931260416.db2.gz ZBYZTIZDMDTAPJ-UONOGXRCSA-N 0 3 416.465 4.411 20 0 HIADHN C[C@H](NC[C@@H](c1cccc(F)c1)N1CCOCC1)c1sccc1Br ZINC000531952721 931261746 /nfs/dbraw/zinc/26/17/46/931261746.db2.gz POSIFPUCEAFIIM-GUYCJALGSA-N 0 3 413.356 4.374 20 0 HIADHN Cn1nnc2cc(CNCc3cn(-c4ccccc4)nc3-c3ccc(F)cc3)ccc21 ZINC000531957512 931264525 /nfs/dbraw/zinc/26/45/25/931264525.db2.gz PMXHVWSZIWZXBZ-UHFFFAOYSA-N 0 3 412.472 4.250 20 0 HIADHN CN1CCN(C[C@H](N[C@@H]2CCSc3c(Cl)cccc32)c2ccccc2)CC1 ZINC000531965152 931267843 /nfs/dbraw/zinc/26/78/43/931267843.db2.gz LXEDMQHQXITYLL-RTWAWAEBSA-N 0 3 402.007 4.455 20 0 HIADHN C[C@H](N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1)c1ccc2c(c1)CCC(=O)N2 ZINC000531970649 931270704 /nfs/dbraw/zinc/27/07/04/931270704.db2.gz BKTCROWAPQIMCH-UUOWRZLLSA-N 0 3 413.521 4.472 20 0 HIADHN Cc1ccc(NC(=O)C[C@H](C)NCc2ccnc(OC3CCOCC3)c2)cc1Cl ZINC000531973349 931271890 /nfs/dbraw/zinc/27/18/90/931271890.db2.gz APDYRDVRDSYUAH-INIZCTEOSA-N 0 3 417.937 4.108 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(S(=O)(=O)N(C)C)cc1)c1ccc(-c2ccncc2)cc1 ZINC000531984719 931275515 /nfs/dbraw/zinc/27/55/15/931275515.db2.gz TYJNVYPBPJYSNS-QZTJIDSGSA-N 0 3 409.555 4.411 20 0 HIADHN CSCc1cc(F)ccc1CNC(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000532033455 931292010 /nfs/dbraw/zinc/29/20/10/931292010.db2.gz VGWSCTRHUVAEON-GOSISDBHSA-N 0 3 407.580 4.387 20 0 HIADHN COc1cccc(-c2ccc(CNC(=O)N(CCN(C)C)Cc3ccco3)cc2)c1 ZINC000532036640 931293118 /nfs/dbraw/zinc/29/31/18/931293118.db2.gz YRYCBSLWNYCUTA-UHFFFAOYSA-N 0 3 407.514 4.229 20 0 HIADHN CC(C)N1CCN([C@@H]2CCN(C(=O)N[C@H](CC3CCCCC3)C(C)(C)C)C2)CC1 ZINC000532094946 931309410 /nfs/dbraw/zinc/30/94/10/931309410.db2.gz XSQVPXBFQJYALB-FGZHOGPDSA-N 0 3 406.659 4.181 20 0 HIADHN Clc1cc(CN[C@H]2CCCOc3ccccc32)ccc1OCCN1CCOCC1 ZINC000532094305 931309802 /nfs/dbraw/zinc/30/98/02/931309802.db2.gz YATICRGYXMXUBT-NRFANRHFSA-N 0 3 416.949 4.055 20 0 HIADHN C[C@@H](NC[C@@H](c1c(F)cccc1Cl)N1CCCC1)c1ccc(S(C)(=O)=O)cc1 ZINC000532196084 931345513 /nfs/dbraw/zinc/34/55/13/931345513.db2.gz YGQSUITTWXPSNW-QRWLVFNGSA-N 0 3 424.969 4.370 20 0 HIADHN CC(C)COc1ccc([C@@H](C)NCc2ccc(CS(=O)(=O)NC(C)C)cc2)cc1 ZINC000532207533 931351255 /nfs/dbraw/zinc/35/12/55/931351255.db2.gz WEGLFTNITMPGPN-LJQANCHMSA-N 0 3 418.603 4.400 20 0 HIADHN COc1cccc(C(=O)NCCN[C@H](C)c2sc(-c3ccccc3F)nc2C)c1 ZINC000532208383 931352331 /nfs/dbraw/zinc/35/23/31/931352331.db2.gz SQACWTNNNRGZJC-CQSZACIVSA-N 0 3 413.518 4.347 20 0 HIADHN COc1cccc(COc2cccc(Cl)c2CN[C@@H]2CCC[C@@H](C(N)=O)C2)c1 ZINC000532210319 931352892 /nfs/dbraw/zinc/35/28/92/931352892.db2.gz VADFEPRBZVYIOS-IAGOWNOFSA-N 0 3 402.922 4.061 20 0 HIADHN CC[C@@H](C(=O)N[C@@H](C)c1sc(-c2ccccc2Br)nc1C)N(C)C ZINC000532226262 931361479 /nfs/dbraw/zinc/36/14/79/931361479.db2.gz RKCPGXQVVXZUJO-NHYWBVRUSA-N 0 3 410.381 4.398 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(S(C)(=O)=O)cc1)c1ccc(NC(=O)c2ccncc2)cc1 ZINC000532229187 931363841 /nfs/dbraw/zinc/36/38/41/931363841.db2.gz XRDHXCFOYRPUIF-IAGOWNOFSA-N 0 3 423.538 4.149 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@H](C)NCc2cc(-c3ccccc3)n[nH]2)CC1 ZINC000532265236 931375393 /nfs/dbraw/zinc/37/53/93/931375393.db2.gz KPNZCHGAXBLPPD-SFHVURJKSA-N 0 3 407.537 4.209 20 0 HIADHN C[C@H](N[C@@H](CN1CCN(C)CC1)c1ccccc1)c1ccc(Br)c(F)c1 ZINC000532270446 931378432 /nfs/dbraw/zinc/37/84/32/931378432.db2.gz FGXCOATVGQMWKQ-KKSFZXQISA-N 0 3 420.370 4.228 20 0 HIADHN CC(C)c1ccc(C2(C(=O)N3CC[C@H](N4CCN(C(C)C)CC4)C3)CCCC2)cc1 ZINC000532347732 931403283 /nfs/dbraw/zinc/40/32/83/931403283.db2.gz JPTIBSFKLLOUFN-DEOSSOPVSA-N 0 3 411.634 4.249 20 0 HIADHN CCC(=O)N1CC[C@@H](NCc2cc(Br)ccc2OCc2ccccc2)C1 ZINC000532393863 931420646 /nfs/dbraw/zinc/42/06/46/931420646.db2.gz HJEYYLAHCZBDIX-LJQANCHMSA-N 0 3 417.347 4.129 20 0 HIADHN Fc1cccc(Cl)c1[C@@H](CNCc1cnn(CC(F)(F)F)c1)N1CCCC1 ZINC000532422371 931429647 /nfs/dbraw/zinc/42/96/47/931429647.db2.gz NBQUSHYSGSOLME-MRXNPFEDSA-N 0 3 404.839 4.165 20 0 HIADHN C[C@H](NCc1ccc2c(c1)OCO2)c1cccc(OCc2cn3ccccc3n2)c1 ZINC000532442056 931435719 /nfs/dbraw/zinc/43/57/19/931435719.db2.gz XGAAIPANCDLOFJ-KRWDZBQOSA-N 0 3 401.466 4.493 20 0 HIADHN CCC(=O)Nc1cccc(CN[C@H](C)CC(=O)Nc2cccc(Br)c2)c1 ZINC000532447564 931438413 /nfs/dbraw/zinc/43/84/13/931438413.db2.gz JVTQCZJNQHNOTJ-CQSZACIVSA-N 0 3 418.335 4.305 20 0 HIADHN C[C@@H](NCCc1csc(-c2ccccc2)n1)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000532454301 931442804 /nfs/dbraw/zinc/44/28/04/931442804.db2.gz HVHJTJBLDJBKTF-CQSZACIVSA-N 0 3 404.532 4.246 20 0 HIADHN COc1cc(CN[C@@H](C)c2ccc(S(=O)(=O)N3CCCCC3)cc2)ccc1C ZINC000532468147 931448336 /nfs/dbraw/zinc/44/83/36/931448336.db2.gz GOLXIGCGDSDBJL-SFHVURJKSA-N 0 3 402.560 4.029 20 0 HIADHN CC[C@H](C(=O)N[C@H](C)c1sc(-c2ccc(Br)cc2)nc1C)N(C)C ZINC000532494185 931461446 /nfs/dbraw/zinc/46/14/46/931461446.db2.gz AFSVCJVIHOIYQX-IAQYHMDHSA-N 0 3 410.381 4.398 20 0 HIADHN C[C@@H](N[C@H](CN1CCN(C)CC1)c1ccccc1)c1ccc(F)c(Br)c1 ZINC000532497604 931463046 /nfs/dbraw/zinc/46/30/46/931463046.db2.gz AMQWCFNYKLLXAB-IIBYNOLFSA-N 0 3 420.370 4.228 20 0 HIADHN C[C@H](N[C@@H](CN1CCN(C)CC1)c1ccccc1)c1ccc(F)c(Br)c1 ZINC000532497605 931463185 /nfs/dbraw/zinc/46/31/85/931463185.db2.gz AMQWCFNYKLLXAB-KKSFZXQISA-N 0 3 420.370 4.228 20 0 HIADHN COc1ccc(S(=O)(=O)[N-]c2cccc(C[NH2+][C@H](C)Cc3ccsc3)c2)cc1 ZINC000532501241 931465058 /nfs/dbraw/zinc/46/50/58/931465058.db2.gz LEQQSMWOERZABG-MRXNPFEDSA-N 0 3 416.568 4.278 20 0 HIADHN Cc1cccc(O[C@@H]2CCCC[C@@H]2NC(=O)[C@@H]2CCCN(Cc3cccnc3)C2)c1 ZINC000532516151 931470583 /nfs/dbraw/zinc/47/05/83/931470583.db2.gz ZTCQFEUXZQDFAO-YFNKSVMNSA-N 0 3 407.558 4.108 20 0 HIADHN COc1ccc(NC(=O)C[C@@H](C)NCc2ccc(C)cc2OC(C)C)c(OC)c1 ZINC000532544090 931517203 /nfs/dbraw/zinc/51/72/03/931517203.db2.gz LYGKOGUWQCZHBF-QGZVFWFLSA-N 0 3 400.519 4.306 20 0 HIADHN COc1cc(OC)cc(N2CC[C@H](N[C@@H](C)c3sccc3Br)C2)c1 ZINC000532549726 931518851 /nfs/dbraw/zinc/51/88/51/931518851.db2.gz QNIJCJMSOKATNJ-STQMWFEESA-N 0 3 411.365 4.457 20 0 HIADHN CCN(Cc1csc(-c2ccc(C(N)=O)cc2)n1)[C@@H](C)Cc1ccc(OC)cc1 ZINC000532561173 931525140 /nfs/dbraw/zinc/52/51/40/931525140.db2.gz PKQHWFUSUMNLRO-INIZCTEOSA-N 0 3 409.555 4.371 20 0 HIADHN CC1(C)CN(Cc2nc3c4ccccc4oc3c(=O)[nH]2)CCN1Cc1ccccc1 ZINC000532571064 931533591 /nfs/dbraw/zinc/53/35/91/931533591.db2.gz QNAUNYSSJPMAJW-UHFFFAOYSA-N 0 3 402.498 4.178 20 0 HIADHN COc1ccc([C@@H](Cc2ccc(F)cc2)N[C@H]2CCCN(CC(F)(F)F)C2=O)cc1 ZINC000532588289 931544214 /nfs/dbraw/zinc/54/42/14/931544214.db2.gz RLTPNRQBUCHHSK-VQTJNVASSA-N 0 3 424.438 4.261 20 0 HIADHN COc1ccc(OC)c(NC(=O)CN(CCc2ccc(F)cc2)C2CCCC2)c1 ZINC000532646685 931565809 /nfs/dbraw/zinc/56/58/09/931565809.db2.gz YCHBBXMLEZVWTM-UHFFFAOYSA-N 0 3 400.494 4.269 20 0 HIADHN CN(C)C(=O)c1cccc(CN2CCC[C@H](c3nc(-c4ccc(Cl)cc4)no3)C2)c1 ZINC000532684152 931582937 /nfs/dbraw/zinc/58/29/37/931582937.db2.gz XEJZLJYYWUQXJX-IBGZPJMESA-N 0 3 424.932 4.471 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)CN[C@H](c2ccccc2)C2CCC2)cc1OC ZINC000532686234 931584380 /nfs/dbraw/zinc/58/43/80/931584380.db2.gz GBNORPLEWJHERT-SQJMNOBHSA-N 0 3 408.542 4.498 20 0 HIADHN C[C@H](N[C@@H](c1ccc(F)cc1)C1CCC1)C(=O)Nc1cccc(N2CCCC2=O)c1 ZINC000532701531 931595047 /nfs/dbraw/zinc/59/50/47/931595047.db2.gz DPRKOTKBVDNWIC-QMHKHESXSA-N 0 3 409.505 4.411 20 0 HIADHN CC(C)c1cccc2c1OCCC[C@H]2NCc1ccc(C(=O)N2CCOCC2)cc1 ZINC000532704855 931597015 /nfs/dbraw/zinc/59/70/15/931597015.db2.gz BLHQOWZESGAEPD-HSZRJFAPSA-N 0 3 408.542 4.286 20 0 HIADHN CCN(CC(=O)Nc1cc(C)ccc1C)C1CCN(c2cc(C)nc(C(C)C)n2)CC1 ZINC000532733101 931616024 /nfs/dbraw/zinc/61/60/24/931616024.db2.gz FPWXNPSGQFOBNI-UHFFFAOYSA-N 0 3 423.605 4.455 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)c1cncc(-c2ccc3c(c2)CCO3)c1 ZINC000532745704 931619943 /nfs/dbraw/zinc/61/99/43/931619943.db2.gz BDMUXOHCMXSPAD-UHFFFAOYSA-N 0 3 403.482 4.006 20 0 HIADHN C[C@@H](Cc1cc(Br)ccc1F)NC(=O)Nc1cccc(CN(C)C)c1 ZINC000532843389 931654379 /nfs/dbraw/zinc/65/43/79/931654379.db2.gz GQBMBUBOEGHCMN-ZDUSSCGKSA-N 0 3 408.315 4.403 20 0 HIADHN O=S(=O)(Cc1ccccc1CNCc1csc2ccccc12)N1CCCC1 ZINC000532859313 931669470 /nfs/dbraw/zinc/66/94/70/931669470.db2.gz FXWXLHIKUROMQR-UHFFFAOYSA-N 0 3 400.569 4.117 20 0 HIADHN CC(C)[C@H](NCC(=O)NCC1(c2ccccc2)CCOCC1)c1ccc(Cl)cc1 ZINC000532908800 931688926 /nfs/dbraw/zinc/68/89/26/931688926.db2.gz QVVZKPLOZGBYOC-QHCPKHFHSA-N 0 3 414.977 4.491 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)Cc1ccc(C)c(C)c1 ZINC000532911321 931690203 /nfs/dbraw/zinc/69/02/03/931690203.db2.gz OPGUKLILUCRDFZ-HSZRJFAPSA-N 0 3 402.542 4.437 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)Cc1cc(Cl)ccc1Br ZINC000532913384 931690326 /nfs/dbraw/zinc/69/03/26/931690326.db2.gz ALPLIRSHFAPUPM-UHFFFAOYSA-N 0 3 411.727 4.354 20 0 HIADHN C[C@H]1C[C@@H](c2ccccc2)CN1CC(=O)Nc1cccc(CN2CCSCC2)c1 ZINC000532977952 931724118 /nfs/dbraw/zinc/72/41/18/931724118.db2.gz XXSDKFSZELPPDC-SIKLNZKXSA-N 0 3 409.599 4.052 20 0 HIADHN C[C@@H]1CN(C(=O)c2ccc(CNCc3cccc(-c4ccccn4)c3)cc2)C[C@@H](C)O1 ZINC000533038829 931748326 /nfs/dbraw/zinc/74/83/26/931748326.db2.gz UYPCHAMJZYYCAZ-WOJBJXKFSA-N 0 3 415.537 4.288 20 0 HIADHN COc1ccc(OC)c([C@H]2CCCN2C(=O)CN[C@@H](c2ccccc2)C2CCC2)c1 ZINC000533046367 931750934 /nfs/dbraw/zinc/75/09/34/931750934.db2.gz RIABDCOMWWYCLH-RDGATRHJSA-N 0 3 408.542 4.498 20 0 HIADHN CCN(CC)C(=O)c1cccc(NC(=O)CNC2(c3cccc(C)c3)CCCC2)c1 ZINC000533051261 931755212 /nfs/dbraw/zinc/75/52/12/931755212.db2.gz QAXHKJTUSNXKLH-UHFFFAOYSA-N 0 3 407.558 4.475 20 0 HIADHN COc1ccc(C2=NN(C(=O)CN(CC3CC3)CC3CC3)[C@@H](c3ccco3)C2)cc1 ZINC000533060635 931758395 /nfs/dbraw/zinc/75/83/95/931758395.db2.gz DJHXMIGJUHHEOK-JOCHJYFZSA-N 0 3 407.514 4.088 20 0 HIADHN Cc1ccc(CN(C(=O)CNC2(c3ccc(Cl)cc3)CCOCC2)C2CC2)o1 ZINC000533063709 931759644 /nfs/dbraw/zinc/75/96/44/931759644.db2.gz OFRZJKYJCWAUSL-UHFFFAOYSA-N 0 3 402.922 4.028 20 0 HIADHN C[C@H](NCc1nc(-c2cc(Cl)ccc2Cl)cs1)[C@H](C)N1CCOCC1 ZINC000533149638 931787541 /nfs/dbraw/zinc/78/75/41/931787541.db2.gz FQEWIUOAHQARGJ-STQMWFEESA-N 0 3 400.375 4.316 20 0 HIADHN Cc1cnc(CCN(C)C(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)s1 ZINC000533179841 931803001 /nfs/dbraw/zinc/80/30/01/931803001.db2.gz INBZRCDGSAUNBP-QGZVFWFLSA-N 0 3 406.621 4.170 20 0 HIADHN COc1ccc(NC(C)=O)cc1NC(=O)[C@@H](C)N[C@H](c1ccc(F)cc1)C1CCC1 ZINC000533368217 931850170 /nfs/dbraw/zinc/85/01/70/931850170.db2.gz WBSBCIHOTJXRGW-PEBXRYMYSA-N 0 3 413.493 4.251 20 0 HIADHN COc1cc(NC(=O)CNC2(c3ccc(F)cc3)CCCC2)c(OC)cc1Cl ZINC000533374625 931852138 /nfs/dbraw/zinc/85/21/38/931852138.db2.gz AMENQNSFNSQVRK-UHFFFAOYSA-N 0 3 406.885 4.494 20 0 HIADHN CCCN(CC(=O)Nc1ccc(NC(C)=O)cc1)[C@@H]1C[C@@H](OCC)C12CCCC2 ZINC000533428848 931865927 /nfs/dbraw/zinc/86/59/27/931865927.db2.gz FGSMCWPLBWSSQS-NHCUHLMSSA-N 0 3 401.551 4.033 20 0 HIADHN CC(=O)Nc1ccc(OC[C@H](O)CN2CCCC[C@@H]2c2cc3ccccc3[nH]2)cc1 ZINC000533521386 931893301 /nfs/dbraw/zinc/89/33/01/931893301.db2.gz CSSLRKOCCQNPML-HYBUGGRVSA-N 0 3 407.514 4.093 20 0 HIADHN Cc1nc2c(s1)[C@@H](N(C)C[C@H](O)COc1cccc(C(F)(F)F)c1)CCC2 ZINC000533522980 931893821 /nfs/dbraw/zinc/89/38/21/931893821.db2.gz FYPLJWGVRNIGOI-YOEHRIQHSA-N 0 3 400.466 4.219 20 0 HIADHN COc1ccc(NC(=O)C2(NCc3cccc4cccnc43)CCCC2)cc1OC ZINC000533527092 931894946 /nfs/dbraw/zinc/89/49/46/931894946.db2.gz WPMCHSGLVFJBFO-UHFFFAOYSA-N 0 3 405.498 4.293 20 0 HIADHN O=c1cc(CNC2(c3ccccc3)CCCCC2)nc2ccc(Br)cn12 ZINC000533527268 931895026 /nfs/dbraw/zinc/89/50/26/931895026.db2.gz SKOXKXSMGZCCHP-UHFFFAOYSA-N 0 3 412.331 4.406 20 0 HIADHN Cc1nc(CN[C@@H]2CCCC[C@@H](N3C(=O)c4ccccc4C3=O)C2)nc2ccccc12 ZINC000533548205 931898263 /nfs/dbraw/zinc/89/82/63/931898263.db2.gz GEKQBAIYODMUEP-QZTJIDSGSA-N 0 3 414.509 4.025 20 0 HIADHN CSc1ccccc1NC(=O)CN(C)C(=O)CN[C@@H](c1ccccc1)C(C)(C)C ZINC000533641638 931940078 /nfs/dbraw/zinc/94/00/78/931940078.db2.gz AYGSRGPWQSDLAU-QFIPXVFZSA-N 0 3 413.587 4.182 20 0 HIADHN Cc1ccc(C(=O)N(Cc2ccccc2)C2CCN(C)CC2)c(Br)c1 ZINC000533651440 931947604 /nfs/dbraw/zinc/94/76/04/931947604.db2.gz ZWGKPBGJICFMAA-UHFFFAOYSA-N 0 3 401.348 4.494 20 0 HIADHN O=C(c1csc([C@@H]2CCCO2)n1)N(CCN1CCCC1)Cc1ccc(Cl)cc1 ZINC000533705484 931980497 /nfs/dbraw/zinc/98/04/97/931980497.db2.gz NMPUAMQVZIDDIG-IBGZPJMESA-N 0 3 419.978 4.386 20 0 HIADHN Cc1cc(C)c(CC(C(=O)Nc2cncc(-c3nncn3C)c2)C(F)(F)F)c(C)c1 ZINC000533753599 932010875 /nfs/dbraw/zinc/01/08/75/932010875.db2.gz IKDMOJBFMYVRES-SFHVURJKSA-N 0 3 417.435 4.162 20 0 HIADHN CN(C)[C@@H](CNC(=O)N[C@H]1CCSc2ccc(Cl)cc21)Cc1ccccc1 ZINC000533810119 932041955 /nfs/dbraw/zinc/04/19/55/932041955.db2.gz BMWIEKFGOYSXGK-MJGOQNOKSA-N 0 3 403.979 4.349 20 0 HIADHN CN1Cc2ccccc2[C@H](NCc2cn(Cc3ccccc3)nc2-c2cccnc2)C1 ZINC000533820050 932045456 /nfs/dbraw/zinc/04/54/56/932045456.db2.gz RJPWSYHDXRMMPG-RUZDIDTESA-N 0 3 409.537 4.270 20 0 HIADHN CCCN(C(=O)c1ccc(C(=O)NC2CC2)cc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000533851098 932060605 /nfs/dbraw/zinc/06/06/05/932060605.db2.gz ZHJQLDJJHZEKFP-XMMPIXPASA-N 0 3 419.569 4.096 20 0 HIADHN Cc1nc(-c2ccc(CNC(=O)N[C@@H]3CCN(C)[C@H]3c3ccccc3)cc2)cs1 ZINC000533945622 932119132 /nfs/dbraw/zinc/11/91/32/932119132.db2.gz SBSNOAOLUMUBPO-IRLDBZIGSA-N 0 3 406.555 4.363 20 0 HIADHN Cc1ccc(OCc2cccc(C(=O)N[C@@H]3CCN(C)[C@@H]3c3ccccc3)c2)cn1 ZINC000534016538 932198525 /nfs/dbraw/zinc/19/85/25/932198525.db2.gz FUIKRXRRJLWLAX-DNQXCXABSA-N 0 3 401.510 4.144 20 0 HIADHN Cc1ccc(C(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)cc1NC(=O)NC(C)(C)C ZINC000534018842 932201210 /nfs/dbraw/zinc/20/12/10/932201210.db2.gz LNGOAEYLXYKLHU-FPOVZHCZSA-N 0 3 408.546 4.090 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)c(C)c1CC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000534018906 932201629 /nfs/dbraw/zinc/20/16/29/932201629.db2.gz LYEVZNRUVZZLHP-UPVQGACJSA-N 0 3 422.960 4.247 20 0 HIADHN CS[C@@H]1CN(C(=O)c2c(C)onc2-c2c(Cl)cccc2Cl)C[C@H]1N(C)C ZINC000534094881 932274760 /nfs/dbraw/zinc/27/47/60/932274760.db2.gz HORMNLCHXXIQCH-ZIAGYGMSSA-N 0 3 414.358 4.074 20 0 HIADHN CCN(C(=O)c1ccc(OCC(F)F)nc1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000534175122 932316228 /nfs/dbraw/zinc/31/62/28/932316228.db2.gz DDWGKUXSWZCUBS-APWZRJJASA-N 0 3 403.473 4.023 20 0 HIADHN O=C(N[C@H]1CCN(Cc2ccccc2)C[C@@H]1CO)c1ccc(OC2CCCCC2)cc1 ZINC000534182680 932319595 /nfs/dbraw/zinc/31/95/95/932319595.db2.gz WMMMPURGOFINJD-RDGATRHJSA-N 0 3 422.569 4.011 20 0 HIADHN COc1ccc(-c2nnc(NC(=O)[C@H]3CCCN(Cc4ccccc4)C3)s2)cc1 ZINC000534238038 932357160 /nfs/dbraw/zinc/35/71/60/932357160.db2.gz AXTVKOCLXGWPMU-SFHVURJKSA-N 0 3 408.527 4.064 20 0 HIADHN COc1ccnc2c(NC(=O)N(Cc3ccccc3)C3CCN(C)CC3)cccc12 ZINC000534319171 932381736 /nfs/dbraw/zinc/38/17/36/932381736.db2.gz FNZNEDJXPZRZMP-UHFFFAOYSA-N 0 3 404.514 4.372 20 0 HIADHN COc1ccc(C(=O)NC2CCN([C@H](C)c3ccncc3)CC2)cc1-c1ccccn1 ZINC000534396269 932422171 /nfs/dbraw/zinc/42/21/71/932422171.db2.gz CFQJNZOJLGIYLT-GOSISDBHSA-N 0 3 416.525 4.108 20 0 HIADHN COC(=O)CCSc1cccc(NC(=O)c2oc3ccccc3c2CN(C)C)c1 ZINC000534455272 932470864 /nfs/dbraw/zinc/47/08/64/932470864.db2.gz LKZYOYHGHYCZIC-UHFFFAOYSA-N 0 3 412.511 4.402 20 0 HIADHN Cc1cc(C)c(CC(C(=O)N2CCCc3c(C(N)=O)cccc32)C(F)(F)F)c(C)c1 ZINC000534490129 932528722 /nfs/dbraw/zinc/52/87/22/932528722.db2.gz YKHTVPQQCCQVKM-IBGZPJMESA-N 0 3 418.459 4.411 20 0 HIADHN Cc1ccc(NC(=O)NC[C@H](Cc2ccccc2)N(C)C)cc1NC(=O)C(C)(C)C ZINC000534525326 932545961 /nfs/dbraw/zinc/54/59/61/932545961.db2.gz LGMMNYMJVYAXEG-FQEVSTJZSA-N 0 3 410.562 4.274 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccc(O)cc1)C(=O)c1sccc1Br ZINC000534542165 932553558 /nfs/dbraw/zinc/55/35/58/932553558.db2.gz ZJDMRZMENOGOFJ-HNNXBMFYSA-N 0 3 423.376 4.343 20 0 HIADHN CC(C)n1cnnc1[C@H]1CCCN(Cc2cccc(C(=O)Nc3ccccc3)c2)C1 ZINC000534542880 932554635 /nfs/dbraw/zinc/55/46/35/932554635.db2.gz VORXYUBKKLHXGG-NRFANRHFSA-N 0 3 403.530 4.491 20 0 HIADHN Cc1cc(Cl)cc(C)c1CNCc1ccc(C(=O)N2C[C@@H](C)O[C@H](C)C2)cc1 ZINC000534560854 932564598 /nfs/dbraw/zinc/56/45/98/932564598.db2.gz KSFHTUIIMYLCCP-QZTJIDSGSA-N 0 3 400.950 4.496 20 0 HIADHN CCOc1ccc([C@H](C)NC(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)cc1OCC ZINC000534658296 932627131 /nfs/dbraw/zinc/62/71/31/932627131.db2.gz BVEAPMLENPLLMF-KPDCDPCYSA-N 0 3 411.546 4.290 20 0 HIADHN Cc1nc(C)n(-c2ccccc2NC(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)n1 ZINC000534751273 932726243 /nfs/dbraw/zinc/72/62/43/932726243.db2.gz DYFHYKIHWUGSTE-HSZRJFAPSA-N 0 3 418.545 4.151 20 0 HIADHN CCOC(=O)c1c2c(sc1NC(=O)[C@H](C)C1CCOCC1)C(C)(C)NC(C)(C)C2 ZINC000535169192 932984749 /nfs/dbraw/zinc/98/47/49/932984749.db2.gz XFQJMXOZNVXRSN-CYBMUJFWSA-N 0 3 422.591 4.085 20 0 HIADHN FC(F)(F)c1nc2nc[nH]c2c(NC[C@@H](c2cccc(Cl)c2)N2CCCC2)n1 ZINC000535254539 933038292 /nfs/dbraw/zinc/03/82/92/933038292.db2.gz CDBHCISLAXAHTN-ZDUSSCGKSA-N 0 3 410.831 4.226 20 0 HIADHN Cc1ccc(C(=O)NC[C@H](Cc2ccccc2)N(C)C)cc1NC(=O)c1ccccc1 ZINC000535254836 933038775 /nfs/dbraw/zinc/03/87/75/933038775.db2.gz JZBWNRMOVBJYBF-QHCPKHFHSA-N 0 3 415.537 4.150 20 0 HIADHN Cc1cccc(C(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)c1Br ZINC000535287599 933050999 /nfs/dbraw/zinc/05/09/99/933050999.db2.gz JDKFCFAGPXVMSF-CALCHBBNSA-N 0 3 423.395 4.109 20 0 HIADHN CC(C)Cn1ncc(C(=O)NC[C@@H]2CCCN(Cc3cccs3)C2)c1C(F)F ZINC000535349915 933086859 /nfs/dbraw/zinc/08/68/59/933086859.db2.gz MUQVDGNSPWOACR-HNNXBMFYSA-N 0 3 410.534 4.180 20 0 HIADHN FC(F)(F)c1cccc(OCCNCc2ccccc2OCc2ccncc2)n1 ZINC000535368810 933096282 /nfs/dbraw/zinc/09/62/82/933096282.db2.gz JHEVOFLWBFGBOU-UHFFFAOYSA-N 0 3 403.404 4.243 20 0 HIADHN CN(Cc1cc(Br)cs1)C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000535393360 933112024 /nfs/dbraw/zinc/11/20/24/933112024.db2.gz BYPIILPWNFXGHR-IAGOWNOFSA-N 0 3 408.365 4.097 20 0 HIADHN Cc1nc(-c2ccc(CNC(=O)N[C@@H]3CCN(C)[C@@H]3c3ccccc3)s2)cs1 ZINC000535398519 933115833 /nfs/dbraw/zinc/11/58/33/933115833.db2.gz VGKLVPIYFOYICN-YLJYHZDGSA-N 0 3 412.584 4.425 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)C2CCN(C(=O)c3ccc(Cl)s3)CC2)c1 ZINC000535418491 933126616 /nfs/dbraw/zinc/12/66/16/933126616.db2.gz IIJGXGZWJNXLBN-UHFFFAOYSA-N 0 3 419.978 4.262 20 0 HIADHN O=C(Nc1cccc2c1CN(c1nccs1)C2)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000535473421 933165266 /nfs/dbraw/zinc/16/52/66/933165266.db2.gz BFZDMVGQPZJWDF-LJQANCHMSA-N 0 3 419.554 4.059 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)C3(c4ccc(F)cc4F)CCCC3)CC2)C[C@@H](C)O1 ZINC000535520055 933211159 /nfs/dbraw/zinc/21/11/59/933211159.db2.gz QFSUVUCLBWRVNS-QZTJIDSGSA-N 0 3 420.544 4.124 20 0 HIADHN COc1cc(CN(C[C@H](O)COc2c(Cl)cccc2Cl)C2CC2)ccc1O ZINC000535578500 933251713 /nfs/dbraw/zinc/25/17/13/933251713.db2.gz FQQKDXQFTMEKGO-HNNXBMFYSA-N 0 3 412.313 4.112 20 0 HIADHN COc1cccc(C(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)c1F ZINC000535606690 933264553 /nfs/dbraw/zinc/26/45/53/933264553.db2.gz NEMCFPFNSIRFJN-GOSISDBHSA-N 0 3 408.477 4.039 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)CCCc3cc(F)ccc3F)CC2)C[C@H](C)O1 ZINC000535608854 933265419 /nfs/dbraw/zinc/26/54/19/933265419.db2.gz GPMJISDIMTUFAJ-ROUUACIJSA-N 0 3 408.533 4.025 20 0 HIADHN COc1ccc(C[C@H](C)CN(C)C(=O)NC[C@@H](c2cccs2)N2CCCC2)cc1 ZINC000535625905 933273437 /nfs/dbraw/zinc/27/34/37/933273437.db2.gz JYOSJCCPWHXYOE-RXVVDRJESA-N 0 3 415.603 4.414 20 0 HIADHN O=C(CCCc1csc2ccccc12)N[C@H]1CCN(Cc2ccccc2)C[C@H]1CO ZINC000535632366 933275333 /nfs/dbraw/zinc/27/53/33/933275333.db2.gz QCEMFBXWTGNQAG-GMAHTHKFSA-N 0 3 422.594 4.223 20 0 HIADHN Cc1ccc2[nH]c([C@@H]3CCCN([C@H](C)C(=O)N(C)Cc4cccc(F)c4)C3)nc2c1 ZINC000535666574 933311906 /nfs/dbraw/zinc/31/19/06/933311906.db2.gz VVWBNTIGKLLOBB-IEBWSBKVSA-N 0 3 408.521 4.237 20 0 HIADHN Cc1ccc2nc([C@@H]3CCCN([C@H](C)C(=O)N(C)Cc4cccc(F)c4)C3)[nH]c2c1 ZINC000535666574 933311918 /nfs/dbraw/zinc/31/19/18/933311918.db2.gz VVWBNTIGKLLOBB-IEBWSBKVSA-N 0 3 408.521 4.237 20 0 HIADHN O=C1[C@@H](NCc2cccc(COCc3ccco3)c2)CCCN1c1ccccc1F ZINC000535709223 933363670 /nfs/dbraw/zinc/36/36/70/933363670.db2.gz HXQZGYKQUCHXTP-QFIPXVFZSA-N 0 3 408.473 4.421 20 0 HIADHN CCOCCO[C@H]1CCN(Cc2cn(-c3ccccc3)nc2-c2ccc(F)cc2)C1 ZINC000535809759 933406116 /nfs/dbraw/zinc/40/61/16/933406116.db2.gz GPZSCTULWYWCRU-QHCPKHFHSA-N 0 3 409.505 4.306 20 0 HIADHN Cc1cc(C)c(CC(C(=O)Nc2ccnn2C[C@@H]2CCOC2)C(F)(F)F)c(C)c1 ZINC000535879860 933461172 /nfs/dbraw/zinc/46/11/72/933461172.db2.gz NNVVUXUZNPWHKH-WMZOPIPTSA-N 0 3 409.452 4.205 20 0 HIADHN COc1cc(CN[C@H](C)c2ccc([S@@](C)=O)cc2)ccc1OCc1ccncc1 ZINC000535946843 933513508 /nfs/dbraw/zinc/51/35/08/933513508.db2.gz XSGQGBQHNDHVPH-CQGGRAHPSA-N 0 3 410.539 4.257 20 0 HIADHN Cn1c2ccccc2nc1CCCNCc1cn(-c2ccc(Cl)cc2Cl)nn1 ZINC000535961218 933525743 /nfs/dbraw/zinc/52/57/43/933525743.db2.gz WLDODICEVCWXOF-UHFFFAOYSA-N 0 3 415.328 4.183 20 0 HIADHN Clc1ccc(-n2cc(CNCCCc3nc4ccccc4[nH]3)nn2)c(Cl)c1 ZINC000535961277 933526013 /nfs/dbraw/zinc/52/60/13/933526013.db2.gz YONLWZGIJWVTQL-UHFFFAOYSA-N 0 3 401.301 4.173 20 0 HIADHN Cc1nc2ccccc2n1C[C@@H]1CCCN1CC(=O)N[C@H](c1ccccc1)C1CC1 ZINC000535966174 933528082 /nfs/dbraw/zinc/52/80/82/933528082.db2.gz XZDSFRYVAIIPRO-SQJMNOBHSA-N 0 3 402.542 4.077 20 0 HIADHN Cc1cc(C)c(CC(C(=O)Nc2sccc2S(C)(=O)=O)C(F)(F)F)c(C)c1 ZINC000535966232 933528129 /nfs/dbraw/zinc/52/81/29/933528129.db2.gz LHDCYEGMMCLLMP-CQSZACIVSA-N 0 3 419.490 4.437 20 0 HIADHN CCSc1ccc([C@@H](C)NCc2cccc(OCCN3CCOCC3)c2)cc1 ZINC000535987669 933547139 /nfs/dbraw/zinc/54/71/39/933547139.db2.gz WYQDFEWUPQRKFC-LJQANCHMSA-N 0 3 400.588 4.360 20 0 HIADHN Cc1cc(C(=O)NC2CCN([C@@H](C)c3ccncc3)CC2)ccc1Br ZINC000536008673 933566050 /nfs/dbraw/zinc/56/60/50/933566050.db2.gz XVPGOASGPIAEOL-HNNXBMFYSA-N 0 3 402.336 4.108 20 0 HIADHN Cc1ccc(OC2CCN(C(=O)NC[C@@H](Cc3ccccc3)N(C)C)CC2)cc1C ZINC000536014263 933571368 /nfs/dbraw/zinc/57/13/68/933571368.db2.gz DKXFWRCQIILBGZ-JOCHJYFZSA-N 0 3 409.574 4.029 20 0 HIADHN CC(C)OC(=O)c1ccc(Cl)c(NC(=O)NC[C@H](Cc2ccccc2)N(C)C)c1 ZINC000536015270 933573249 /nfs/dbraw/zinc/57/32/49/933573249.db2.gz GRQNOABAWOTUSX-SFHVURJKSA-N 0 3 417.937 4.200 20 0 HIADHN O=C(NC[C@@H]1CCCCN1Cc1ccccc1)[C@H](OC1CCOCC1)c1ccccc1 ZINC000536093695 933642246 /nfs/dbraw/zinc/64/22/46/933642246.db2.gz AYBWNPCQXBUEIA-UKILVPOCSA-N 0 3 422.569 4.094 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)c2cc(F)ccc2Br)cc1 ZINC000536093948 933642837 /nfs/dbraw/zinc/64/28/37/933642837.db2.gz BSJBVOCTIWTDJZ-IBGZPJMESA-N 0 3 421.310 4.164 20 0 HIADHN Cc1nc(-c2ccccc2)sc1CNC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000536095412 933646130 /nfs/dbraw/zinc/64/61/30/933646130.db2.gz LDWAUYRMMJTZQX-PZJWPPBQSA-N 0 3 406.555 4.363 20 0 HIADHN Cc1nc(-c2ccccc2)sc1CNC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000536095410 933646166 /nfs/dbraw/zinc/64/61/66/933646166.db2.gz LDWAUYRMMJTZQX-FPOVZHCZSA-N 0 3 406.555 4.363 20 0 HIADHN CCO[C@@H]1C[C@H](N[C@@H](c2ccc(C)cc2)c2cccc(S(C)(=O)=O)c2)C1(C)C ZINC000537289925 933699566 /nfs/dbraw/zinc/69/95/66/933699566.db2.gz ZGRZREAQLJPZKO-BDTNDASRSA-N 0 3 401.572 4.281 20 0 HIADHN CCOc1cccc2cc([C@@H](C)NCCCS(=O)(=O)Cc3ccccc3)oc21 ZINC000537296031 933702018 /nfs/dbraw/zinc/70/20/18/933702018.db2.gz RTKWLNGUMLVWOA-QGZVFWFLSA-N 0 3 401.528 4.487 20 0 HIADHN Cc1cc(NC(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)nn1-c1cccc(F)c1 ZINC000537378849 933745243 /nfs/dbraw/zinc/74/52/43/933745243.db2.gz XTXNANWSKVMVRD-NRFANRHFSA-N 0 3 407.493 4.058 20 0 HIADHN CCN1CCN(c2ccc(N[C@@H](C)c3cccc(N4CCOCC4)c3)c(C)c2)CC1 ZINC000537406992 933761535 /nfs/dbraw/zinc/76/15/35/933761535.db2.gz IPKBVJKMKXRINA-NRFANRHFSA-N 0 3 408.590 4.147 20 0 HIADHN Cc1ccc(N[C@@H]2CCN(Cc3ccccn3)C[C@H]2C)cc1I ZINC000537406515 933762066 /nfs/dbraw/zinc/76/20/66/933762066.db2.gz KEMIHDWWEVXCFF-DNVCBOLYSA-N 0 3 421.326 4.317 20 0 HIADHN CC1CCN([C@@H](CNC(=O)N2CCC[C@H]2C2CCOCC2)c2cccs2)CC1 ZINC000537413298 933763966 /nfs/dbraw/zinc/76/39/66/933763966.db2.gz JXGSCEOMKUBFIM-PMACEKPBSA-N 0 3 405.608 4.122 20 0 HIADHN C[C@H](NC1(c2ccc3c(c2)OCO3)CC1)c1ccc(I)cc1 ZINC000537449241 933777922 /nfs/dbraw/zinc/77/79/22/933777922.db2.gz XEUPEGOCFGWRRQ-LBPRGKRZSA-N 0 3 407.251 4.360 20 0 HIADHN Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)C(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000537551896 938321553 /nfs/dbraw/zinc/32/15/53/938321553.db2.gz RRCWPJZOZVETOQ-URLQWDBASA-N 0 3 422.495 4.117 20 0 HIADHN CCO[C@@H]1C[C@H](O)C12CCN(Cc1cn(-c3ccccc3)nc1-c1cccs1)CC2 ZINC000537615002 938333387 /nfs/dbraw/zinc/33/33/87/938333387.db2.gz IAALKGOPZCVGSF-FCHUYYIVSA-N 0 3 423.582 4.353 20 0 HIADHN COc1ccc(Cl)cc1C[C@H]1CCCN(Cc2cnc(N3CCOCC3)s2)C1 ZINC000537615625 938334116 /nfs/dbraw/zinc/33/41/16/938334116.db2.gz ZRDQXAVKEYSHKU-MRXNPFEDSA-N 0 3 421.994 4.096 20 0 HIADHN CCO[C@H]1C[C@H](O)C12CCN(Cc1ccc(-c3ccc(Br)cc3)o1)CC2 ZINC000537617126 938334612 /nfs/dbraw/zinc/33/46/12/938334612.db2.gz QIZSJUHYHYIKIK-PMACEKPBSA-N 0 3 420.347 4.461 20 0 HIADHN c1[nH]nc(-c2ccc3c(c2)OCCO3)c1CN1CC[C@H](OCCCc2ccccc2)C1 ZINC000537623028 938337179 /nfs/dbraw/zinc/33/71/79/938337179.db2.gz UOCHEUVIRFQLBV-QFIPXVFZSA-N 0 3 419.525 4.072 20 0 HIADHN CC1CCC(OC2CCN(Cc3ccccc3OCC(=O)NCC3CC3)CC2)CC1 ZINC000537630397 938340906 /nfs/dbraw/zinc/34/09/06/938340906.db2.gz SOKSCSBGRDIEIP-UHFFFAOYSA-N 0 3 414.590 4.151 20 0 HIADHN CCOc1cc(CN2CCC(C(=O)N(Cc3ccccc3)C3CC3)CC2)ccc1OC ZINC000537635815 938342255 /nfs/dbraw/zinc/34/22/55/938342255.db2.gz YHTKFTWOMBQJEA-UHFFFAOYSA-N 0 3 422.569 4.497 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)C3(Cc4ccc(Cl)cc4)CC3)CC2)C[C@@H](C)O1 ZINC000537762492 938371740 /nfs/dbraw/zinc/37/17/40/938371740.db2.gz JKUCENFBAPWXNW-RTBURBONSA-N 0 3 419.009 4.401 20 0 HIADHN COc1ccc(NC(=O)[C@H](NC[C@H]2CCO[C@H](C)C2)c2ccccc2)cc1Cl ZINC000537775786 938374224 /nfs/dbraw/zinc/37/42/24/938374224.db2.gz RAMJADYSSJJGCE-VWKPWSFCSA-N 0 3 402.922 4.433 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)N[C@@H](c2ccccc2)[C@H]2CCOC2)CC1 ZINC000537895079 938403027 /nfs/dbraw/zinc/40/30/27/938403027.db2.gz SFNLYDPGMQEXML-UPVQGACJSA-N 0 3 407.558 4.070 20 0 HIADHN CC(C)Cn1cc(NC(=O)NCC(C)(C)N2CCc3ccccc3C2)c(C(F)F)n1 ZINC000537911307 938409739 /nfs/dbraw/zinc/40/97/39/938409739.db2.gz PWWKAYMSXULHHK-UHFFFAOYSA-N 0 3 419.520 4.435 20 0 HIADHN C[C@H](NCc1ccc(S(=O)(=O)N2CCCCC2)cc1)c1ccc(OC(F)F)cc1 ZINC000537918742 938413388 /nfs/dbraw/zinc/41/33/88/938413388.db2.gz IQWFNVDQDYYIOR-INIZCTEOSA-N 0 3 424.513 4.313 20 0 HIADHN C[C@H](N[C@H]1CCc2cc(F)ccc21)c1ccc(S(=O)(=O)NCc2ccco2)cc1 ZINC000537937424 938422334 /nfs/dbraw/zinc/42/23/34/938422334.db2.gz KMONHKAIQQQCLM-NYHFZMIOSA-N 0 3 414.502 4.235 20 0 HIADHN COc1cc(CN[C@H](C)c2ccc(-c3ccccc3F)s2)ccc1OCC(N)=O ZINC000537938212 938423222 /nfs/dbraw/zinc/42/32/22/938423222.db2.gz QNFPKONSSAJWII-CQSZACIVSA-N 0 3 414.502 4.278 20 0 HIADHN COc1cc(NC(C)=O)ccc1[C@H](C)N[C@H]1CCN(c2ccc(Cl)c(F)c2)C1 ZINC000537941643 938425486 /nfs/dbraw/zinc/42/54/86/938425486.db2.gz YPSUATVKKJDWDB-BBRMVZONSA-N 0 3 405.901 4.376 20 0 HIADHN Cc1nc(-c2ccccc2)sc1[C@@H](C)NCCNS(=O)(=O)c1ccc(C)cc1 ZINC000537945094 938428069 /nfs/dbraw/zinc/42/80/69/938428069.db2.gz AKLHNXZFTOKKTB-MRXNPFEDSA-N 0 3 415.584 4.056 20 0 HIADHN Cc1c([C@H](C)NCCC[C@@H]2CCCC[C@H]2O)nnn1-c1cccc(Br)c1 ZINC000537957924 938433435 /nfs/dbraw/zinc/43/34/35/938433435.db2.gz YYWWSTXTLILCHW-URLQWDBASA-N 0 3 421.383 4.320 20 0 HIADHN CN(C)S(=O)(=O)c1ccc(CN[C@@H]2CCCSc3ccc(Cl)cc32)cc1 ZINC000537989784 938451541 /nfs/dbraw/zinc/45/15/41/938451541.db2.gz DYPMVOIKHZPCFG-GOSISDBHSA-N 0 3 410.992 4.307 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)N[C@@H]2CCN(CCCc3ccccc3)C2=O)cc1 ZINC000538018789 938464094 /nfs/dbraw/zinc/46/40/94/938464094.db2.gz XDNBJRGZYQNQQS-NTKDMRAZSA-N 0 3 402.542 4.065 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)c1cnc(Oc2ccccc2)cn1 ZINC000538035333 938475494 /nfs/dbraw/zinc/47/54/94/938475494.db2.gz ZHFJOZOUICLOPY-UHFFFAOYSA-N 0 3 410.905 4.126 20 0 HIADHN CN1CCC[C@@H](CNC(=O)c2cnc(Oc3ccccc3)cn2)[C@H]1c1cccs1 ZINC000538036005 938476107 /nfs/dbraw/zinc/47/61/07/938476107.db2.gz WJWXNMDYMUHWEF-KKSFZXQISA-N 0 3 408.527 4.143 20 0 HIADHN C[C@H](NC[C@@H](c1cccc(F)c1)N1CCOCC1)c1nc2ccc(Cl)cc2n1C ZINC000538101623 938503066 /nfs/dbraw/zinc/50/30/66/938503066.db2.gz YUTKXSXNIGNNSH-BTYIYWSLSA-N 0 3 416.928 4.090 20 0 HIADHN C[C@H](NCc1ccc(-c2ccc3c(c2)C[C@H](C)O3)cc1)c1ccc(S(N)(=O)=O)cc1 ZINC000538116042 938506248 /nfs/dbraw/zinc/50/62/48/938506248.db2.gz HTBGVFNLQRIMSA-IRXDYDNUSA-N 0 3 422.550 4.175 20 0 HIADHN CCCCn1cc(CN[C@@H](C)CC(=O)Nc2ccc(Br)cc2)c(C)n1 ZINC000538116830 938506848 /nfs/dbraw/zinc/50/68/48/938506848.db2.gz ONBMRCGQOVOXQG-AWEZNQCLSA-N 0 3 407.356 4.261 20 0 HIADHN COc1cc([C@@H](C)N[C@H](C)c2ccc(S(N)(=O)=O)cc2)ccc1OCCC(C)C ZINC000538116471 938506889 /nfs/dbraw/zinc/50/68/89/938506889.db2.gz LFTCSQMWBLFRTO-IAGOWNOFSA-N 0 3 420.575 4.179 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)N1CCc2ccccc21)c1ccc(OCc2cccnc2)cc1 ZINC000538126794 938512249 /nfs/dbraw/zinc/51/22/49/938512249.db2.gz ZJGVEYIKDMKWEX-MOPGFXCFSA-N 0 3 401.510 4.289 20 0 HIADHN CC[C@H](N[C@H](C)C(=O)N(C)Cc1ccc(OC)c(OC)c1)c1ccc(Cl)cc1 ZINC000538129046 938514385 /nfs/dbraw/zinc/51/43/85/938514385.db2.gz DABKHVXRWDCDSU-BEFAXECRSA-N 0 3 404.938 4.445 20 0 HIADHN COc1cc2c(cc1F)CC[C@@H]2N[C@H]1CCCN([C@H](C)c2ccccc2F)C1=O ZINC000563325406 945182036 /nfs/dbraw/zinc/18/20/36/945182036.db2.gz HUIPFOQMEWPRPT-OREJSRFESA-N 0 3 400.469 4.303 20 0 HIADHN COc1cc([C@H](C)NCC[S@@](=O)c2ccccc2)ccc1OCc1ccncc1 ZINC000538154272 938525721 /nfs/dbraw/zinc/52/57/21/938525721.db2.gz BKSCPIPEYCAFIF-RBSBEOHCSA-N 0 3 410.539 4.128 20 0 HIADHN COc1ccc(C[C@@H](NCC(=O)Nc2ccc(F)cc2)c2ccccc2)cc1OC ZINC000538160050 938529173 /nfs/dbraw/zinc/52/91/73/938529173.db2.gz PKMMYIRPOJXLMY-OAQYLSRUSA-N 0 3 408.473 4.355 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(OCC(F)(F)F)cc1)C(=O)NCCc1ccc(F)cc1 ZINC000538164821 938532248 /nfs/dbraw/zinc/53/22/48/938532248.db2.gz XMMPOSOHFNBQKX-LSDHHAIUSA-N 0 3 412.427 4.165 20 0 HIADHN O=C(CCN[C@@H](CC(F)(F)F)c1ccccc1)N1CCN(c2ccc(F)cc2)CC1 ZINC000538174394 938535750 /nfs/dbraw/zinc/53/57/50/938535750.db2.gz HHLWEIQYCJYHSV-FQEVSTJZSA-N 0 3 423.454 4.148 20 0 HIADHN O=C(CN[C@H](c1ccc(F)cc1)C1CCCC1)Nc1cccc(C(=O)NC2CC2)c1 ZINC000538210827 938557318 /nfs/dbraw/zinc/55/73/18/938557318.db2.gz LWGXIJIMUVWZNO-QHCPKHFHSA-N 0 3 409.505 4.178 20 0 HIADHN C[C@@H](NC[C@H](O)COc1c(Cl)cccc1Cl)c1cccc(N2CCCC2=O)c1 ZINC000538211329 938557460 /nfs/dbraw/zinc/55/74/60/938557460.db2.gz TZSIOUBJRUHOGU-PBHICJAKSA-N 0 3 423.340 4.211 20 0 HIADHN COc1ccc(CCNC(=O)CN[C@@H](c2ccc(F)cc2)C2CCCC2)cc1OC ZINC000538212137 938558486 /nfs/dbraw/zinc/55/84/86/938558486.db2.gz CUGCPICJXNLUJH-XMMPIXPASA-N 0 3 414.521 4.023 20 0 HIADHN Cc1ccc(S(=O)(=O)CCCN[C@@H](C)c2ccc(OCC3CC3)c(F)c2)cc1 ZINC000538223975 938563958 /nfs/dbraw/zinc/56/39/58/938563958.db2.gz FTPODZHKMHNRIB-KRWDZBQOSA-N 0 3 405.535 4.438 20 0 HIADHN C[C@@H](NC(=O)CN[C@@H](C)c1ccc(-n2ccnn2)cc1)c1ccc(Cl)cc1Cl ZINC000538233613 938567683 /nfs/dbraw/zinc/56/76/83/938567683.db2.gz UXJDDDTVABRHJY-UONOGXRCSA-N 0 3 418.328 4.102 20 0 HIADHN Cc1cccc([C@@H](NCC(=O)N2CCC(C(=O)NCCC(C)C)CC2)C(C)(C)C)c1 ZINC000538235537 938568815 /nfs/dbraw/zinc/56/88/15/938568815.db2.gz YJIUTFIKMZRKPL-HSZRJFAPSA-N 0 3 415.622 4.073 20 0 HIADHN Cc1cccc([C@H](NCC(=O)Nc2cc(S(C)(=O)=O)ccc2Cl)C(C)(C)C)c1 ZINC000538236523 938569062 /nfs/dbraw/zinc/56/90/62/938569062.db2.gz RJICCNMMFNQEAQ-FQEVSTJZSA-N 0 3 422.978 4.367 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(-n2cccn2)cc1)C(=O)Nc1ccc(OC(F)(F)F)cc1 ZINC000538236153 938569398 /nfs/dbraw/zinc/56/93/98/938569398.db2.gz YJXPHJCUGMUCFJ-GJZGRUSLSA-N 0 3 418.419 4.449 20 0 HIADHN CCOc1ccc(NC(=O)CN[C@@H](C)c2cccc(N3CCCC3)c2)cc1OCC ZINC000538279404 938582159 /nfs/dbraw/zinc/58/21/59/938582159.db2.gz JJHKLPQYFXISHE-SFHVURJKSA-N 0 3 411.546 4.374 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)Nc1ccc2c(c1)N(C)CC2 ZINC000538320250 938591679 /nfs/dbraw/zinc/59/16/79/938591679.db2.gz KCYQVAHAAZQKOX-UHFFFAOYSA-N 0 3 420.479 4.293 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)N[C@@H]2CCCOc3c(Cl)cccc32)o1 ZINC000538366461 938604702 /nfs/dbraw/zinc/60/47/02/938604702.db2.gz KOSOTWOOINMBRT-LJQANCHMSA-N 0 3 405.926 4.229 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)N[C@@H]2CCCOc3cc(Cl)ccc32)o1 ZINC000538373722 938606434 /nfs/dbraw/zinc/60/64/34/938606434.db2.gz YDXSTCOXDKZTMC-LJQANCHMSA-N 0 3 405.926 4.229 20 0 HIADHN COc1ccc([C@H](C)NCCc2nc3c(cccc3F)n2C)c(Br)c1 ZINC000538408781 938613487 /nfs/dbraw/zinc/61/34/87/938613487.db2.gz QPIIWNBMXZYKEV-LBPRGKRZSA-N 0 3 406.299 4.377 20 0 HIADHN COc1cc(CN[C@H](c2cc3ccccc3o2)C(C)C)ccc1OCC(=O)N(C)C ZINC000538458598 938627046 /nfs/dbraw/zinc/62/70/46/938627046.db2.gz KRQJPRKRKREDIB-DEOSSOPVSA-N 0 3 410.514 4.395 20 0 HIADHN Cc1cc(NC(=O)N(Cc2ccccc2)C2CCN(C)CC2)nn1-c1cccc(F)c1 ZINC000538490829 938633665 /nfs/dbraw/zinc/63/36/65/938633665.db2.gz UTDWMDWFUIPALY-UHFFFAOYSA-N 0 3 421.520 4.448 20 0 HIADHN CCN1CCN(Cc2ccc(N[C@@H](C)c3ccc(-n4ccnc4C)cc3)cc2)CC1 ZINC000538539806 938644660 /nfs/dbraw/zinc/64/46/60/938644660.db2.gz ZIWBOSNJOUVUPO-FQEVSTJZSA-N 0 3 403.574 4.491 20 0 HIADHN CCN1CCN(c2ccccc2N[C@H](C)c2nnn(-c3ccc(F)cc3)c2C)CC1 ZINC000538545576 938645594 /nfs/dbraw/zinc/64/55/94/938645594.db2.gz FHWLKSWEZWYUDD-QGZVFWFLSA-N 0 3 408.525 4.030 20 0 HIADHN CC(=O)c1ccc(C(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)c(F)c1 ZINC000538544493 938645750 /nfs/dbraw/zinc/64/57/50/938645750.db2.gz NRDMRSVPTKYZFW-FQEVSTJZSA-N 0 3 420.488 4.233 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)c1cc(C)n(-c2ccc(C)cc2)n1 ZINC000538572684 938652709 /nfs/dbraw/zinc/65/27/09/938652709.db2.gz IDTGRXNOZKQWDC-HSZRJFAPSA-N 0 3 417.557 4.011 20 0 HIADHN COc1sc(CNCCNc2ccc(-c3ccccc3)nn2)cc1Br ZINC000538612275 938661468 /nfs/dbraw/zinc/66/14/68/938661468.db2.gz ZRTOGGJZILWRMP-UHFFFAOYSA-N 0 3 419.348 4.178 20 0 HIADHN COc1ccc([C@@H](C)Nc2ccc(N3CCOCC3)nc2C)cc1CN1CCCCC1 ZINC000538639280 938670243 /nfs/dbraw/zinc/67/02/43/938670243.db2.gz UBUYUQOWTAPJEC-LJQANCHMSA-N 0 3 424.589 4.394 20 0 HIADHN CCOc1ccc(-c2nc(CN3CCC[C@H](c4nnc(C)[nH]4)C3)cs2)cc1OC ZINC000538661263 938676603 /nfs/dbraw/zinc/67/66/03/938676603.db2.gz DRWWQPCKZKHDED-INIZCTEOSA-N 0 3 413.547 4.024 20 0 HIADHN C[C@H](C(=O)c1c[nH]c2ncccc12)N1CCC[C@H](c2nc(C3CCCCC3)n[nH]2)C1 ZINC000538664598 938678719 /nfs/dbraw/zinc/67/87/19/938678719.db2.gz RLPQFZVPRKVYCU-WBVHZDCISA-N 0 3 406.534 4.180 20 0 HIADHN C[C@@H](c1cn(-c2ccccc2)nn1)N1CCC[C@@H](c2nc(C3CCCCC3)n[nH]2)C1 ZINC000538664625 938678979 /nfs/dbraw/zinc/67/89/79/938678979.db2.gz SIFVJVRCSCFQBW-PKOBYXMFSA-N 0 3 405.550 4.374 20 0 HIADHN C[C@@H](c1cn(-c2ccccc2)nn1)N1CCC[C@@H](c2n[nH]c(C3CCCCC3)n2)C1 ZINC000538664625 938678981 /nfs/dbraw/zinc/67/89/81/938678981.db2.gz SIFVJVRCSCFQBW-PKOBYXMFSA-N 0 3 405.550 4.374 20 0 HIADHN COc1cc(Cl)ccc1NC(=O)COc1ccc(CN2CCC2(C)C)cc1OC ZINC000538735992 938697094 /nfs/dbraw/zinc/69/70/94/938697094.db2.gz RVPJOMPWZPBNSV-UHFFFAOYSA-N 0 3 418.921 4.359 20 0 HIADHN CN(CCCC(=O)OC(C)(C)C)Cc1cn(-c2ccccc2)nc1-c1ccncc1 ZINC000538739165 938697496 /nfs/dbraw/zinc/69/74/96/938697496.db2.gz SJZBCAIOJDBHDO-UHFFFAOYSA-N 0 3 406.530 4.488 20 0 HIADHN COc1cc(N[C@H]2CCCN(Cc3cc(OC)c(OC)cc3C)C2)cc(OC)c1 ZINC000538750825 938701397 /nfs/dbraw/zinc/70/13/97/938701397.db2.gz APNUTTZCMWUZQK-SFHVURJKSA-N 0 3 400.519 4.106 20 0 HIADHN CCCN(CC(F)(F)F)C(=O)[C@@H]1CCCN(Cc2cnc(C)n2-c2ccccc2)C1 ZINC000538752201 938702532 /nfs/dbraw/zinc/70/25/32/938702532.db2.gz PTRYLEDJTKWLMX-GOSISDBHSA-N 0 3 422.495 4.194 20 0 HIADHN CCCOc1cc(CN2CCc3cc(OC)c(OC)c(OC)c3CC2)ccc1OC ZINC000538763084 938704868 /nfs/dbraw/zinc/70/48/68/938704868.db2.gz DVPQBVCBAPAFOM-UHFFFAOYSA-N 0 3 415.530 4.111 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)NC2CCC(C(=O)OC(C)(C)C)CC2)C1 ZINC000538781399 938708504 /nfs/dbraw/zinc/70/85/04/938708504.db2.gz ZPVLJIJWZMGINJ-GHOZHQTGSA-N 0 3 415.578 4.022 20 0 HIADHN c1csc(-c2nn(Cc3ccccc3)cc2CN2CCC[C@H](Cn3ccnn3)C2)c1 ZINC000538795814 938713872 /nfs/dbraw/zinc/71/38/72/938713872.db2.gz YBSVAWOVABLVBX-FQEVSTJZSA-N 0 3 418.570 4.164 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)[C@@H]2C[C@@H]2c2cccc(F)c2F)cc1 ZINC000538830401 938721175 /nfs/dbraw/zinc/72/11/75/938721175.db2.gz MJTFNFALJDBQQY-SBHAEUEKSA-N 0 3 400.469 4.030 20 0 HIADHN Cc1ccc(NC(=O)[C@H](N[C@H]2CCO[C@]3(CCOC3)C2)c2ccccc2)cc1Cl ZINC000538877078 938729737 /nfs/dbraw/zinc/72/97/37/938729737.db2.gz JRYLRSVTEATFRB-XKCSPQBFSA-N 0 3 414.933 4.256 20 0 HIADHN Cc1ccc(CC(=O)Nc2cccc(N3CCN(CCc4ccccc4)CC3)c2)o1 ZINC000538935550 938741172 /nfs/dbraw/zinc/74/11/72/938741172.db2.gz YPHMNAXWUZNMPU-UHFFFAOYSA-N 0 3 403.526 4.134 20 0 HIADHN CCc1nc2ccccc2n1C1CCN([C@@H](C)C(=O)N2CCc3ccccc3C2)CC1 ZINC000538956166 938748484 /nfs/dbraw/zinc/74/84/84/938748484.db2.gz TXNBPMLHLKYCEE-IBGZPJMESA-N 0 3 416.569 4.209 20 0 HIADHN CCc1nc2ccccc2n1C1CCN([C@H](C)C(=O)N2CCc3ccccc3C2)CC1 ZINC000538956167 938748698 /nfs/dbraw/zinc/74/86/98/938748698.db2.gz TXNBPMLHLKYCEE-LJQANCHMSA-N 0 3 416.569 4.209 20 0 HIADHN FC(F)(F)c1ccc(O[C@H]2CCN(CCCc3nc(-c4cccs4)no3)C2)nc1 ZINC000538958809 938750386 /nfs/dbraw/zinc/75/03/86/938750386.db2.gz XXACOWXYHIFROP-AWEZNQCLSA-N 0 3 424.448 4.298 20 0 HIADHN O=C(NC[C@@H](c1ccco1)N1CCCCC1)Nc1ccc2nc(C(F)F)[nH]c2c1 ZINC000538983136 938759343 /nfs/dbraw/zinc/75/93/43/938759343.db2.gz IEBWFMFLTRLRQQ-INIZCTEOSA-N 0 3 403.433 4.442 20 0 HIADHN C[C@@H](NC[C@H](CO)Cc1ccccc1OC(F)(F)F)c1nc2c(s1)CCCC2 ZINC000538986001 938759969 /nfs/dbraw/zinc/75/99/69/938759969.db2.gz ZSEHYJVLRRRBCS-ZIAGYGMSSA-N 0 3 414.493 4.422 20 0 HIADHN COc1ccc(CN(C(=O)N[C@@H]2CCN(C3CC3)C2)[C@H]2CCCC[C@H]2C)cc1OC ZINC000539017013 938770127 /nfs/dbraw/zinc/77/01/27/938770127.db2.gz XWRZEBNORXTSBZ-QFUCXCTJSA-N 0 3 415.578 4.031 20 0 HIADHN CCCCOc1ccc([C@@H](C)N[C@@H](C)Cn2ncc3ccccc3c2=O)cc1OC ZINC000539041708 938778579 /nfs/dbraw/zinc/77/85/79/938778579.db2.gz OHZXPCHSYSYKKC-ZWKOTPCHSA-N 0 3 409.530 4.323 20 0 HIADHN COCC[C@H](NCc1cc(Br)c2c(c1)OCCO2)c1ccc(F)cc1 ZINC000539041487 938778956 /nfs/dbraw/zinc/77/89/56/938778956.db2.gz LGSILOYWVKZXTN-KRWDZBQOSA-N 0 3 410.283 4.227 20 0 HIADHN CCOc1ccc([C@H](CC)N[C@H]2CCCN(CC(F)(F)F)C2=O)cc1OCC ZINC000539052564 938784023 /nfs/dbraw/zinc/78/40/23/938784023.db2.gz MHIZICRIYQQOLZ-HOTGVXAUSA-N 0 3 402.457 4.078 20 0 HIADHN Cc1ccc2c(c1)[C@H](NCc1ccccc1CS(=O)(=O)N1CCC(C)CC1)CC2 ZINC000539054904 938785480 /nfs/dbraw/zinc/78/54/80/938785480.db2.gz WLOCESLTZQFPMP-XMMPIXPASA-N 0 3 412.599 4.334 20 0 HIADHN C[C@@H](CC(=O)Nc1ccc(OC(F)(F)F)cc1)NCc1cccc2c1OCCCO2 ZINC000539066584 938790683 /nfs/dbraw/zinc/79/06/83/938790683.db2.gz ONSANASNOKUUQF-AWEZNQCLSA-N 0 3 424.419 4.253 20 0 HIADHN COc1cccc2c1CC[C@@H]2NCc1ccc(Br)cc1N1CCOCC1 ZINC000539067075 938791099 /nfs/dbraw/zinc/79/10/99/938791099.db2.gz SNKKYBCSBHWQJV-IBGZPJMESA-N 0 3 417.347 4.071 20 0 HIADHN COc1cc(OC)c([C@@H](C)NC[C@H](c2ccc(OC)c(OC)c2)N(C)C)cc1Cl ZINC000539072238 938794131 /nfs/dbraw/zinc/79/41/31/938794131.db2.gz OOHYPFJWBAQWNM-RDTXWAMCSA-N 0 3 422.953 4.328 20 0 HIADHN COCCSc1ccc([C@H](C)N[C@@H](C)c2ccc(S(=O)(=O)N(C)C)cc2)cc1 ZINC000539076572 938795977 /nfs/dbraw/zinc/79/59/77/938795977.db2.gz GXPWEPDMCIBHCU-IRXDYDNUSA-N 0 3 422.616 4.087 20 0 HIADHN COc1ccc([C@H](C)NCCC(=O)Nc2cc(Br)ccc2C)c(OC)c1 ZINC000539077799 938796552 /nfs/dbraw/zinc/79/65/52/938796552.db2.gz BGUUWEFEZNNEEX-AWEZNQCLSA-N 0 3 421.335 4.454 20 0 HIADHN C[C@H](N[C@@H]1CCN(CC(F)(F)F)C1=O)c1ccc(SCC(F)(F)F)cc1 ZINC000539080598 938798172 /nfs/dbraw/zinc/79/81/72/938798172.db2.gz VOWWTLIPRAWOID-GXFFZTMASA-N 0 3 400.388 4.155 20 0 HIADHN C[C@H](N[C@H]1CCN(CC(F)(F)F)C1=O)c1ccc(SCC(F)(F)F)cc1 ZINC000539080590 938798391 /nfs/dbraw/zinc/79/83/91/938798391.db2.gz VOWWTLIPRAWOID-GWCFXTLKSA-N 0 3 400.388 4.155 20 0 HIADHN COC[C@H](N[C@H](C)CC(=O)Nc1ccc(Br)cc1)c1ccc(F)cc1 ZINC000539088555 938800036 /nfs/dbraw/zinc/80/00/36/938800036.db2.gz VTWQQAWLLJFRBT-ACJLOTCBSA-N 0 3 409.299 4.283 20 0 HIADHN C[C@@H](NCc1ccc(Cn2ccccc2=O)cc1)c1ccc(NC(=O)NC2CC2)cc1 ZINC000539093117 938801714 /nfs/dbraw/zinc/80/17/14/938801714.db2.gz LBZCMFYOIZGDFI-GOSISDBHSA-N 0 3 416.525 4.031 20 0 HIADHN C[C@H](NCCCNC(=O)C1CCC1)c1ccc(Br)cc1Br ZINC000539122676 938806282 /nfs/dbraw/zinc/80/62/82/938806282.db2.gz SVWNKJXDOIPMQY-NSHDSACASA-N 0 3 418.173 4.169 20 0 HIADHN CCN1CC[C@H](NC(=O)c2cccc(CN(C)C)c2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000539128279 938807721 /nfs/dbraw/zinc/80/77/21/938807721.db2.gz QMBAIBWYYYCRJB-SFTDATJTSA-N 0 3 403.929 4.106 20 0 HIADHN COc1cc(OC)cc(N2CC[C@H](N[C@H](C)c3nc4ccc(Cl)cc4n3C)C2)c1 ZINC000539214101 938819562 /nfs/dbraw/zinc/81/95/62/938819562.db2.gz YHKPFPLHJYCOHP-ZBFHGGJFSA-N 0 3 414.937 4.173 20 0 HIADHN COc1cc(CN[C@H](c2ccc(Cl)cc2)C2CC2)ccc1OCC(=O)N(C)C ZINC000539214863 938819903 /nfs/dbraw/zinc/81/99/03/938819903.db2.gz XVVKFFLJCZHTRY-QFIPXVFZSA-N 0 3 402.922 4.057 20 0 HIADHN COc1ccc([C@@H](NCc2nnc(-c3ccc(Br)cc3)[nH]2)C2CC2)cc1 ZINC000539216352 938820095 /nfs/dbraw/zinc/82/00/95/938820095.db2.gz UTJAIQOZELGSKC-IBGZPJMESA-N 0 3 413.319 4.484 20 0 HIADHN O=C(Nc1ccccc1)c1ccc(CN2CCC[C@@H](c3nncn3C3CC3)C2)cc1 ZINC000539239968 938823645 /nfs/dbraw/zinc/82/36/45/938823645.db2.gz UQOMJFFNOMYMFL-HXUWFJFHSA-N 0 3 401.514 4.245 20 0 HIADHN CC[C@@H]1c2ccsc2CCN1C(=O)CN[C@@H](c1ccc2c(c1)OCCO2)C(C)C ZINC000539241018 938824026 /nfs/dbraw/zinc/82/40/26/938824026.db2.gz MZVVDVOKUJGIRI-WZONZLPQSA-N 0 3 414.571 4.342 20 0 HIADHN CC[C@H](NCC(=O)N(C)Cc1cc(Br)cs1)c1ccc(OC)cc1 ZINC000539242474 938824483 /nfs/dbraw/zinc/82/44/83/938824483.db2.gz AIUUMWURAXEJDG-KRWDZBQOSA-N 0 3 411.365 4.219 20 0 HIADHN CC(C)[C@H](NCC(=O)Nc1ccccc1Br)c1ccc2c(c1)OCCO2 ZINC000539242824 938824486 /nfs/dbraw/zinc/82/44/86/938824486.db2.gz AIDHSZZLPHUBRL-FQEVSTJZSA-N 0 3 419.319 4.146 20 0 HIADHN C[C@H](NCCC(=O)Nc1ccc(N2CCCC2=O)cc1)c1ccccc1OC(F)F ZINC000539246855 938825222 /nfs/dbraw/zinc/82/52/22/938825222.db2.gz RUGULNJQEDJNMG-HNNXBMFYSA-N 0 3 417.456 4.094 20 0 HIADHN Cc1cccc([C@H](C)NCC(=O)N2CCC[C@@H]2c2ccc3c(c2)OCCCO3)c1C ZINC000539286325 938833478 /nfs/dbraw/zinc/83/34/78/938833478.db2.gz HYZLHXWONIQTLH-SIKLNZKXSA-N 0 3 408.542 4.479 20 0 HIADHN COc1ccc(-c2csc(NC(=O)CN[C@H](c3ccccc3)[C@H]3CCOC3)n2)cc1 ZINC000539289388 938834139 /nfs/dbraw/zinc/83/41/39/938834139.db2.gz MWUYXUUTPZGUJU-PGRDOPGGSA-N 0 3 423.538 4.125 20 0 HIADHN Cc1nn(-c2ccc(C)cc2)c(C)c1NC(=O)CN[C@@H](c1ccccc1)[C@H]1CCOC1 ZINC000539289396 938834173 /nfs/dbraw/zinc/83/41/73/938834173.db2.gz MPCHOAYPPMSNFS-OFVILXPXSA-N 0 3 418.541 4.103 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)CNC2(c3ccccc3)CCCC2)cc1OC ZINC000539290837 938834735 /nfs/dbraw/zinc/83/47/35/938834735.db2.gz LWEPYUNRQAUNGU-NRFANRHFSA-N 0 3 408.542 4.426 20 0 HIADHN C[C@@H](NC[C@@H](O)COc1ccc2ccccc2c1)c1cccc(N2CCCC2=O)c1 ZINC000539308746 938838193 /nfs/dbraw/zinc/83/81/93/938838193.db2.gz KDHQSUWPPFQYHK-WZONZLPQSA-N 0 3 404.510 4.057 20 0 HIADHN COCc1cccc(CNC(=O)CN[C@H](c2ccc(C(F)(F)F)cc2)C(C)C)c1 ZINC000539326124 938841908 /nfs/dbraw/zinc/84/19/08/938841908.db2.gz NPILDRFXYODPLB-NRFANRHFSA-N 0 3 408.464 4.455 20 0 HIADHN CC(C)[C@H](NCC(=O)Nc1ccc(C(=O)N(C)C)cc1)c1ccc(C(F)(F)F)cc1 ZINC000539326286 938841914 /nfs/dbraw/zinc/84/19/14/938841914.db2.gz SOXTXWPWCXJWOU-FQEVSTJZSA-N 0 3 421.463 4.333 20 0 HIADHN CC(=O)Nc1cccc(NC(=O)[C@@H](C)N[C@H](C)c2ccc(-c3cccnc3)cc2)c1 ZINC000539327490 938842178 /nfs/dbraw/zinc/84/21/78/938842178.db2.gz YXVIXKIHVGNSDP-IAGOWNOFSA-N 0 3 402.498 4.385 20 0 HIADHN O=C(CN[C@H](c1cccc(Cl)c1)C1CCCC1)Nc1nnc(-c2ccco2)o1 ZINC000539333407 938843164 /nfs/dbraw/zinc/84/31/64/938843164.db2.gz ZNPSSXALXWIBJT-SFHVURJKSA-N 0 3 400.866 4.443 20 0 HIADHN COc1ccc(CN(C)C(=O)CN[C@@H](c2cccc(F)c2)C(C)(C)C)cc1OC ZINC000539335355 938843886 /nfs/dbraw/zinc/84/38/86/938843886.db2.gz AISFNSJZJFXPPY-QFIPXVFZSA-N 0 3 402.510 4.178 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)N[C@H](C)C(=O)NC23CC4CC(CC(C4)C2)C3)cc1 ZINC000539363198 938848819 /nfs/dbraw/zinc/84/88/19/938848819.db2.gz QXNHYMJBNLANDI-GXMBWNFDSA-N 0 3 406.574 4.305 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)N[C@H](C)C(=O)Nc2ccc(OC(F)F)cc2)cc1 ZINC000539368355 938849936 /nfs/dbraw/zinc/84/99/36/938849936.db2.gz OQSWPMRIGWMIJW-LSDHHAIUSA-N 0 3 414.456 4.460 20 0 HIADHN CCOC(=O)c1nn(-c2ccccc2)cc1CNC[C@H](c1cccs1)N1CCCC1 ZINC000539383401 938852415 /nfs/dbraw/zinc/85/24/15/938852415.db2.gz KZCJVNRBBMNFAY-HXUWFJFHSA-N 0 3 424.570 4.037 20 0 HIADHN Cc1ccc(NC(=O)NC[C@H]2CCCN(Cc3cn(C)nc3-c3cccs3)C2)cc1 ZINC000539408519 938856556 /nfs/dbraw/zinc/85/65/56/938856556.db2.gz LBZCEQXNOZTFIU-GOSISDBHSA-N 0 3 423.586 4.491 20 0 HIADHN CCOC(=O)COc1ccc(CNC2(c3ccc(Br)cc3)CC2)cc1 ZINC000539416256 938857394 /nfs/dbraw/zinc/85/73/94/938857394.db2.gz ZCFXYOPZWXWYGV-UHFFFAOYSA-N 0 3 404.304 4.170 20 0 HIADHN Cc1cc([C@@H](N[C@H](C)C(=O)Nc2ccc(N3CCCC3=O)cc2)C2CC2)ccc1F ZINC000539425014 938858726 /nfs/dbraw/zinc/85/87/26/938858726.db2.gz QXZISKBCXJJENB-MWTRTKDXSA-N 0 3 409.505 4.329 20 0 HIADHN COc1cccc(OC)c1Oc1ccc(CNCC2=Cc3ccccc3OC2)cn1 ZINC000539456338 938863268 /nfs/dbraw/zinc/86/32/68/938863268.db2.gz JTGNHNXKDVHRKD-UHFFFAOYSA-N 0 3 404.466 4.457 20 0 HIADHN Cn1c2nnc(CN[C@H](CC3CCCCC3)C(C)(C)C)n2c2ccsc2c1=O ZINC000539492565 938868295 /nfs/dbraw/zinc/86/82/95/938868295.db2.gz CDULWKHFCQYKPH-MRXNPFEDSA-N 0 3 401.580 4.117 20 0 HIADHN CCc1cc(N2CCC[C@@H](N[C@@H](C)c3ccc(OC)cc3Br)C2)ncn1 ZINC000539509061 938870845 /nfs/dbraw/zinc/87/08/45/938870845.db2.gz SLQVJLREVCOYLD-GOEBONIOSA-N 0 3 419.367 4.130 20 0 HIADHN C[C@]1(CCCO)CCCN1CC(=O)N[C@@H](c1ccccc1)c1cccc(Cl)c1 ZINC000539613642 938888104 /nfs/dbraw/zinc/88/81/04/938888104.db2.gz FOELGONGJJCKMT-XZOQPEGZSA-N 0 3 400.950 4.173 20 0 HIADHN CC1CCN([C@H](CNC(=O)N2CCCC[C@@H]2c2ccnn2C)c2ccccc2)CC1 ZINC000539712706 938909468 /nfs/dbraw/zinc/90/94/68/938909468.db2.gz MJUJVOKJRCQXDJ-DHIUTWEWSA-N 0 3 409.578 4.130 20 0 HIADHN Cc1nc([C@@H]2CCCN([C@@H](c3nc(-c4ccccc4)no3)c3ccccc3)C2)n[nH]1 ZINC000539762790 938927578 /nfs/dbraw/zinc/92/75/78/938927578.db2.gz ABWDRUNRSYXJGS-WOJBJXKFSA-N 0 3 400.486 4.132 20 0 HIADHN Cc1n[nH]c([C@@H]2CCCN([C@@H](c3nc(-c4ccccc4)no3)c3ccccc3)C2)n1 ZINC000539762790 938927581 /nfs/dbraw/zinc/92/75/81/938927581.db2.gz ABWDRUNRSYXJGS-WOJBJXKFSA-N 0 3 400.486 4.132 20 0 HIADHN Cc1nnc([C@@H]2CCCN([C@@H](c3nc(-c4ccccc4)no3)c3ccccc3)C2)[nH]1 ZINC000539762790 938927589 /nfs/dbraw/zinc/92/75/89/938927589.db2.gz ABWDRUNRSYXJGS-WOJBJXKFSA-N 0 3 400.486 4.132 20 0 HIADHN Cc1nc2ccccn2c1CN1CCC(C(=O)N(Cc2ccccc2)C2CC2)CC1 ZINC000539817527 938941379 /nfs/dbraw/zinc/94/13/79/938941379.db2.gz JUKINICZUKZSJU-UHFFFAOYSA-N 0 3 402.542 4.046 20 0 HIADHN Cc1nn(Cc2ccc(Cl)cc2)c(C)c1CN1CCC[C@@H](C(=O)N2CCCC2)C1 ZINC000539831120 938950469 /nfs/dbraw/zinc/95/04/69/938950469.db2.gz TXFRPLLMFSDGDI-HXUWFJFHSA-N 0 3 414.981 4.036 20 0 HIADHN COc1cc(CN2CCC[C@@H](CNC(=O)C(C)(C)C)C2)ccc1OCC(F)(F)F ZINC000539832919 938951609 /nfs/dbraw/zinc/95/16/09/938951609.db2.gz CODLLFDFDKQOQI-INIZCTEOSA-N 0 3 416.484 4.011 20 0 HIADHN O=C1CCCCN1CC1CCN(Cc2cc3ccccc3nc2N2CCCCC2)CC1 ZINC000539838029 938953763 /nfs/dbraw/zinc/95/37/63/938953763.db2.gz MXIMBDWBFVJFHV-UHFFFAOYSA-N 0 3 420.601 4.450 20 0 HIADHN COc1cc(N[C@H]2CCCN(Cc3c[nH]nc3-c3ccc(F)cc3)C2)cc(OC)c1 ZINC000539849776 938957127 /nfs/dbraw/zinc/95/71/27/938957127.db2.gz LYWVENOPCIFQNY-IBGZPJMESA-N 0 3 410.493 4.310 20 0 HIADHN CCN(CC(F)(F)F)C(=O)[C@@H]1CCCN(Cc2cnc(-c3ccsc3)s2)C1 ZINC000539852304 938958234 /nfs/dbraw/zinc/95/82/34/938958234.db2.gz UETIFNLMAZJJMK-CYBMUJFWSA-N 0 3 417.522 4.494 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)[C@H]2C[C@@H]2c2cc(F)ccc2F)cc1 ZINC000539931123 938978836 /nfs/dbraw/zinc/97/88/36/938978836.db2.gz VDOSHLNXNRRJCL-CBQOVEMMSA-N 0 3 400.469 4.030 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CCC(Cc2cccnc2)CC1)c1cccc(OC)c1 ZINC000539946904 938980434 /nfs/dbraw/zinc/98/04/34/938980434.db2.gz ROVPQZFUQKJCSB-DEOSSOPVSA-N 0 3 424.589 4.137 20 0 HIADHN CC(C)(C)[C@H](CN1CCc2ccccc2C1)NC(=O)c1ncccc1C(F)(F)F ZINC000539948189 938980488 /nfs/dbraw/zinc/98/04/88/938980488.db2.gz XOQDRBANZWBBSL-SFHVURJKSA-N 0 3 405.464 4.303 20 0 HIADHN Brc1cccc(-c2nc(CN[C@@H]3CCO[C@@]4(CCOC4)C3)cs2)c1 ZINC000539976973 939028629 /nfs/dbraw/zinc/02/86/29/939028629.db2.gz JXFYQZUXKUYHIG-QAPCUYQASA-N 0 3 409.349 4.000 20 0 HIADHN COCCn1ccc2ccc(NC(=O)NC[C@@H]3CCCN3Cc3ccccc3)cc21 ZINC000540001928 939035051 /nfs/dbraw/zinc/03/50/51/939035051.db2.gz QAJASBUZHGLQFS-QFIPXVFZSA-N 0 3 406.530 4.074 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)NCc1cc(Cl)sc1Cl ZINC000540011108 939038797 /nfs/dbraw/zinc/03/87/97/939038797.db2.gz WMOQREZGKUAMJV-UHFFFAOYSA-N 0 3 404.338 4.467 20 0 HIADHN CN(C)CCN(C(=O)c1cc(OCC(F)(F)F)c2ccccc2n1)C1CCCC1 ZINC000540098478 939070641 /nfs/dbraw/zinc/07/06/41/939070641.db2.gz FFSQHEQGHAMNDK-UHFFFAOYSA-N 0 3 409.452 4.122 20 0 HIADHN CCSc1ccccc1[C@H](C)NCc1ccc(OCC(=O)N(C)C)c(OC)c1 ZINC000540117820 939079282 /nfs/dbraw/zinc/07/92/82/939079282.db2.gz NVNMEJZPQUIBCC-INIZCTEOSA-N 0 3 402.560 4.125 20 0 HIADHN C[C@H](N[C@@H]1CCc2cc(F)ccc21)c1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000540139335 939087765 /nfs/dbraw/zinc/08/77/65/939087765.db2.gz QYULZVXPMFBQTH-KSFYIVLOSA-N 0 3 402.535 4.338 20 0 HIADHN COc1ccc([C@H](C)NCc2ccccc2CS(=O)(=O)N2CCCC2)cc1Cl ZINC000540143297 939089370 /nfs/dbraw/zinc/08/93/70/939089370.db2.gz CIOVGSKQXATRDL-INIZCTEOSA-N 0 3 422.978 4.125 20 0 HIADHN Cc1cc(S(=O)(=O)NCCN[C@H](C)c2cccc(-c3ccncc3)c2)c(C)s1 ZINC000540149158 939092277 /nfs/dbraw/zinc/09/22/77/939092277.db2.gz JJGQBWYMXOKJCZ-MRXNPFEDSA-N 0 3 415.584 4.056 20 0 HIADHN C[C@H](NCc1ccc(CO)c(F)c1)c1cccc(OCc2cn3ccccc3n2)c1 ZINC000540157042 939094644 /nfs/dbraw/zinc/09/46/44/939094644.db2.gz YUQNPBVEHOXAAF-KRWDZBQOSA-N 0 3 405.473 4.396 20 0 HIADHN Fc1cccc2c1CC[C@@H]2NCc1ccc(Br)cc1N1CCOCC1 ZINC000540162706 939097435 /nfs/dbraw/zinc/09/74/35/939097435.db2.gz JUPPITCOGIPSAF-IBGZPJMESA-N 0 3 405.311 4.202 20 0 HIADHN C[C@H]1C[C@H](NC[C@H](O)COc2ccccc2Br)c2ccsc2S1 ZINC000540165922 939098761 /nfs/dbraw/zinc/09/87/61/939098761.db2.gz YYGCKKZRPLKHKW-HUBLWGQQSA-N 0 3 414.390 4.466 20 0 HIADHN COc1ccc(OC)c([C@H](C)NC[C@H](c2cccc(Cl)c2)N2CCOCC2)c1 ZINC000540173431 939103601 /nfs/dbraw/zinc/10/36/01/939103601.db2.gz FBCTXCGODWYBOR-HRAATJIYSA-N 0 3 404.938 4.081 20 0 HIADHN COc1ccc([C@@H](CN[C@@H](C)c2ccccc2Br)N(C)C)cc1OC ZINC000540175535 939104756 /nfs/dbraw/zinc/10/47/56/939104756.db2.gz JXDLANMIOPPBBX-KBXCAEBGSA-N 0 3 407.352 4.420 20 0 HIADHN C[C@H]1C[C@@H](NCc2cccc(NS(C)(=O)=O)c2)c2cccc(Br)c21 ZINC000540176394 939105338 /nfs/dbraw/zinc/10/53/38/939105338.db2.gz PCQMKPBTIVAUGJ-YVEFUNNKSA-N 0 3 409.349 4.159 20 0 HIADHN Clc1ccc(-c2noc(CCN[C@H](Cc3ccccn3)c3cccnc3)n2)cc1 ZINC000540178335 939106939 /nfs/dbraw/zinc/10/69/39/939106939.db2.gz ZPXLADALUKFGTP-HXUWFJFHSA-N 0 3 405.889 4.296 20 0 HIADHN CCSc1ccc([C@H](C)NCc2ccc(OCC(=O)N(C)C)c(OC)c2)cc1 ZINC000540187747 939111875 /nfs/dbraw/zinc/11/18/75/939111875.db2.gz DAAGIAIYBQZAJA-INIZCTEOSA-N 0 3 402.560 4.125 20 0 HIADHN Cc1cc2c(cc1C)[C@H](N[C@H](C)c1ccc(S(=O)(=O)N(C)C)cc1)CCCO2 ZINC000540191463 939116201 /nfs/dbraw/zinc/11/62/01/939116201.db2.gz PKAREXMEQVTPME-DYESRHJHSA-N 0 3 402.560 4.118 20 0 HIADHN CCN1CC[C@@H](NCc2cc(OC)c(OC)cc2OC)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000540203535 939125863 /nfs/dbraw/zinc/12/58/63/939125863.db2.gz JAIKSUDODIVCHR-GCJKJVERSA-N 0 3 422.928 4.430 20 0 HIADHN CCN1CC[C@H](N[C@H]2CC(=O)N(C)c3ccccc32)[C@H]1c1ccc(Cl)c(F)c1 ZINC000540297421 939185853 /nfs/dbraw/zinc/18/58/53/939185853.db2.gz LCUAOCQPGXGGGG-CNNODRBYSA-N 0 3 401.913 4.312 20 0 HIADHN Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)N[C@H](C)c1ccc(S(N)(=O)=O)cc1 ZINC000540300003 939186988 /nfs/dbraw/zinc/18/69/88/939186988.db2.gz GIXHOZJLTMTWMB-CHWSQXEVSA-N 0 3 419.547 4.317 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@H](C)NCc2cc(F)cc3cccnc32)cc1 ZINC000540343679 939200824 /nfs/dbraw/zinc/20/08/24/939200824.db2.gz DUDXGRHIODGHCS-INIZCTEOSA-N 0 3 415.534 4.255 20 0 HIADHN C[C@H](NCc1ccc(I)cc1)c1ccc(NC(=O)C2CC2)cc1 ZINC000540352033 939203861 /nfs/dbraw/zinc/20/38/61/939203861.db2.gz MHDVAURMNCSYQE-ZDUSSCGKSA-N 0 3 420.294 4.491 20 0 HIADHN CC[C@@H](NCCC(=O)Nc1ccccc1C)c1ccccc1OCC(=O)N1CCCC1 ZINC000540354475 939206179 /nfs/dbraw/zinc/20/61/79/939206179.db2.gz MNXJGWGOCKQQMR-OAQYLSRUSA-N 0 3 423.557 4.066 20 0 HIADHN C[C@@H](NCC(=O)Nc1ccc(OC(F)(F)F)cc1)c1ccccc1-n1cccn1 ZINC000540358482 939208646 /nfs/dbraw/zinc/20/86/46/939208646.db2.gz BDHBPRTUWKJUQW-CQSZACIVSA-N 0 3 404.392 4.060 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccccc1-n1cccn1)C(=O)Nc1ccc(Br)cc1 ZINC000540361961 939210165 /nfs/dbraw/zinc/21/01/65/939210165.db2.gz CGDKWAGZLJRPFH-LSDHHAIUSA-N 0 3 413.319 4.313 20 0 HIADHN COc1cc2c(cc1OC)CN(C(=O)CN[C@@H](CC(C)(C)C)c1ccccc1)CC2 ZINC000540379898 939219156 /nfs/dbraw/zinc/21/91/56/939219156.db2.gz QSESUFAAKCZJPO-NRFANRHFSA-N 0 3 410.558 4.356 20 0 HIADHN Cc1n[nH]c(C)c1[C@H]1CCCN1C(=O)NC[C@H](c1ccccc1)N1CCC(C)CC1 ZINC000540387376 939224003 /nfs/dbraw/zinc/22/40/03/939224003.db2.gz YOVYGLQBLNMVTL-FGZHOGPDSA-N 0 3 409.578 4.346 20 0 HIADHN O=C(CNC1(c2ccccc2)CCCC1)N1CCC[C@H]1c1ccc2c(c1)OCCO2 ZINC000540389140 939226206 /nfs/dbraw/zinc/22/62/06/939226206.db2.gz AWDBFZPPOOOQMS-NRFANRHFSA-N 0 3 406.526 4.180 20 0 HIADHN COc1cc(C(C)=O)ccc1OC[C@H](O)CN[C@H](c1ccccc1Cl)C(C)C ZINC000540390389 939228589 /nfs/dbraw/zinc/22/85/89/939228589.db2.gz QDPNYZNLWSTFLW-VGSWGCGISA-N 0 3 405.922 4.278 20 0 HIADHN Cc1ccc(NC(=O)CN[C@H](c2ccccc2)[C@@H]2CCOC2)c(Br)c1 ZINC000540390349 939228884 /nfs/dbraw/zinc/22/88/84/939228884.db2.gz OMCAUUMOVBPAQW-OXQOHEQNSA-N 0 3 403.320 4.063 20 0 HIADHN CCN(C(=O)[C@@H](C)N[C@H](C)c1ccc(NC(=O)c2ccncc2)cc1)c1ccccc1 ZINC000540396988 939233727 /nfs/dbraw/zinc/23/37/27/939233727.db2.gz MHZDVNYTBOKQHC-RTBURBONSA-N 0 3 416.525 4.426 20 0 HIADHN CS(=O)(=O)c1ccc(NC(=O)CN[C@H](c2ccc(Cl)cc2)C2CCCC2)cc1 ZINC000540405918 939237133 /nfs/dbraw/zinc/23/71/33/939237133.db2.gz JHDRWIIOPUJARN-NRFANRHFSA-N 0 3 420.962 4.203 20 0 HIADHN COc1cc(NC(=O)CNC2(c3cccc(Cl)c3)CCCC2)cc(OC)c1OC ZINC000540423347 939243065 /nfs/dbraw/zinc/24/30/65/939243065.db2.gz HOKDFDRUGQIXNQ-UHFFFAOYSA-N 0 3 418.921 4.363 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(-c2cccnc2)cc1)C(=O)N1CCN(c2ccccc2)CC1 ZINC000540431029 939245941 /nfs/dbraw/zinc/24/59/41/939245941.db2.gz WSNSTVYRZXICTB-NHCUHLMSSA-N 0 3 414.553 4.137 20 0 HIADHN Cc1cccc(OCCNC(=O)[C@@H](C)N[C@H](C)c2ccc(-c3ccncc3)cc2)c1 ZINC000540436425 939248625 /nfs/dbraw/zinc/24/86/25/939248625.db2.gz VOQYOBKQGDHYNA-WOJBJXKFSA-N 0 3 403.526 4.291 20 0 HIADHN Cc1cccc(OCCNC(=O)[C@H](C)N[C@H](C)c2ccc(-c3ccncc3)cc2)c1 ZINC000540436423 939248881 /nfs/dbraw/zinc/24/88/81/939248881.db2.gz VOQYOBKQGDHYNA-UXHICEINSA-N 0 3 403.526 4.291 20 0 HIADHN COc1cc(C(C)=O)ccc1OC[C@@H](O)CN[C@@H](C)c1ccccc1C(F)(F)F ZINC000540443031 939251873 /nfs/dbraw/zinc/25/18/73/939251873.db2.gz GPWYFIAQUMSKNV-BBRMVZONSA-N 0 3 411.420 4.007 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@@H](C)N[C@H](C)c2cccc(N3CCCC3)c2)cc1F ZINC000540478870 939268942 /nfs/dbraw/zinc/26/89/42/939268942.db2.gz QBADKDGTQXTKOV-QZTJIDSGSA-N 0 3 413.537 4.132 20 0 HIADHN Cc1cccc(S(=O)(=O)NC2C[C@H]3CC[C@@H](C2)N3Cc2ccccc2)c1Cl ZINC000540482653 939270182 /nfs/dbraw/zinc/27/01/82/939270182.db2.gz OXNNSXKAHNZQNU-YQQQUEKLSA-N 0 3 404.963 4.122 20 0 HIADHN Cc1cc([C@H](N[C@H](C)C(=O)Nc2cccc(N3CCCC3=O)c2)C2CC2)ccc1F ZINC000540521776 939286606 /nfs/dbraw/zinc/28/66/06/939286606.db2.gz VJEDJZNKBRLNLK-WAIKUNEKSA-N 0 3 409.505 4.329 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N(Cc1ccccc1)CC(C)(C)O)c1ccsc1 ZINC000540529956 939291234 /nfs/dbraw/zinc/29/12/34/939291234.db2.gz DFSJULGVUOXCAZ-HXUWFJFHSA-N 0 3 403.592 4.114 20 0 HIADHN C[C@@H]1CN([C@@H](CNCc2cn(C)nc2C(C)(C)C)c2c(F)cccc2Cl)CCO1 ZINC000540530623 939292066 /nfs/dbraw/zinc/29/20/66/939292066.db2.gz GNUBAPAFXJPWFS-BEFAXECRSA-N 0 3 422.976 4.062 20 0 HIADHN C[C@@H](c1ccc(Cl)cc1)N(C)C(=O)CN[C@H](c1ccc2c(c1)OCCO2)C1CC1 ZINC000540591209 939312671 /nfs/dbraw/zinc/31/26/71/939312671.db2.gz GFTNJOAFRJLCHO-WNSKOXEYSA-N 0 3 414.933 4.372 20 0 HIADHN CCc1ccccc1NC(=O)CN(C)C(=O)[C@H](C)N[C@@H](c1ccccc1C)C1CC1 ZINC000540591738 939313027 /nfs/dbraw/zinc/31/30/27/939313027.db2.gz YECYYXYELQBBBR-MHECFPHRSA-N 0 3 407.558 4.084 20 0 HIADHN Cc1c([C@H](C)NCC2([C@H](C)CCO)CCC2)nnn1-c1cccc(Br)c1 ZINC000540607774 939317876 /nfs/dbraw/zinc/31/78/76/939317876.db2.gz MMEGLOXMCSGEDJ-CABCVRRESA-N 0 3 421.383 4.178 20 0 HIADHN CC(C)[C@@H]1C[C@@H](N[C@H](c2cccc(S(C)(=O)=O)c2)c2ccc(F)c(F)c2)CCO1 ZINC000540705194 939344134 /nfs/dbraw/zinc/34/41/34/939344134.db2.gz CQZLFUIPSRKGHV-BULFRSBZSA-N 0 3 423.525 4.251 20 0 HIADHN CC(C)[C@@H]1C[C@H](N[C@H](c2cccc(S(C)(=O)=O)c2)c2ccc(F)c(F)c2)CCO1 ZINC000540705196 939344144 /nfs/dbraw/zinc/34/41/44/939344144.db2.gz CQZLFUIPSRKGHV-VOQZNFBZSA-N 0 3 423.525 4.251 20 0 HIADHN C[C@H](N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1)c1ccc2c(c1)COC2 ZINC000540751604 939359508 /nfs/dbraw/zinc/35/95/08/939359508.db2.gz IJWSOQSRQADSPM-DFBJGRDBSA-N 0 3 400.522 4.295 20 0 HIADHN CSc1ccccc1CC(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000540766221 939365013 /nfs/dbraw/zinc/36/50/13/939365013.db2.gz ZMLJTCJHPVDDSL-FQEVSTJZSA-N 0 3 406.555 4.233 20 0 HIADHN CCOCCOc1ccc(Br)cc1CN1CCC[C@H]1C1CCOCC1 ZINC000540769409 939366059 /nfs/dbraw/zinc/36/60/59/939366059.db2.gz JRLWTVXUQWEYDX-IBGZPJMESA-N 0 3 412.368 4.255 20 0 HIADHN CC(C)CS(=O)(=O)N1CCC(N[C@@H](C)c2cc(F)c(Cl)cc2Cl)CC1 ZINC000540779669 939369382 /nfs/dbraw/zinc/36/93/82/939369382.db2.gz WTKKSATVRWMGPY-LBPRGKRZSA-N 0 3 411.370 4.233 20 0 HIADHN Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)c1nc(-c2ccc(CN(C)C)cc2)no1 ZINC000540856771 939397005 /nfs/dbraw/zinc/39/70/05/939397005.db2.gz IOCIWJJJNXCQOC-GFCCVEGCSA-N 0 3 407.440 4.326 20 0 HIADHN C[C@@H](C(=O)N1CCc2ccccc2C1)N1CCC[C@@H](c2nc(C3CCCCC3)n[nH]2)C1 ZINC000540866490 939403662 /nfs/dbraw/zinc/40/36/62/939403662.db2.gz VHQOERYZLVJPTQ-PGRDOPGGSA-N 0 3 421.589 4.005 20 0 HIADHN Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)C(=O)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000540895964 939413217 /nfs/dbraw/zinc/41/32/17/939413217.db2.gz OMBCNVNUQFFYHA-BEFAXECRSA-N 0 3 422.495 4.119 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)CN[C@@]2(C)CCCc3ccccc32)cc1OC ZINC000540906528 939415029 /nfs/dbraw/zinc/41/50/29/939415029.db2.gz FBGMONHRATTYAO-OFVILXPXSA-N 0 3 408.542 4.209 20 0 HIADHN COc1ccc([C@H]2CCCN2C(=O)CN[C@]2(C)CCCc3ccccc32)cc1OC ZINC000540906529 939415247 /nfs/dbraw/zinc/41/52/47/939415247.db2.gz FBGMONHRATTYAO-PXDATVDWSA-N 0 3 408.542 4.209 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)CN[C@]2(C)CCCc3ccccc32)cc1OC ZINC000540906530 939415340 /nfs/dbraw/zinc/41/53/40/939415340.db2.gz FBGMONHRATTYAO-SQJMNOBHSA-N 0 3 408.542 4.209 20 0 HIADHN CSC[C@@H](NC[C@H](O)COc1ccc(F)cc1)c1ccc(C(F)(F)F)cc1 ZINC000540987881 939425882 /nfs/dbraw/zinc/42/58/82/939425882.db2.gz BJXSGOGJAIRMGB-FUHWJXTLSA-N 0 3 403.441 4.278 20 0 HIADHN COC(=O)c1ccc(CNCc2ccccc2-c2ccc(Cn3ccnc3)cc2)[nH]1 ZINC000540995898 939427873 /nfs/dbraw/zinc/42/78/73/939427873.db2.gz IXGJSVSXMNDWGW-UHFFFAOYSA-N 0 3 400.482 4.003 20 0 HIADHN COc1ccc([C@H](NC(=O)CN[C@H](C)c2ccc(-n3ccnc3C)cc2)C2CC2)cc1 ZINC000541027273 939435036 /nfs/dbraw/zinc/43/50/36/939435036.db2.gz YMZVSIYUSKMKGY-CRICUBBOSA-N 0 3 418.541 4.107 20 0 HIADHN CC[C@H](N[C@@H]1CCCc2ccc(Br)cc21)c1cccc(S(N)(=O)=O)c1 ZINC000541202049 939485345 /nfs/dbraw/zinc/48/53/45/939485345.db2.gz ZTLGNIACRBFRTC-RBUKOAKNSA-N 0 3 423.376 4.215 20 0 HIADHN COc1ccc(F)cc1[C@H](C)N[C@@H](C)CC(=O)Nc1ccc(NC(=O)C2CC2)cc1 ZINC000541212649 939485905 /nfs/dbraw/zinc/48/59/05/939485905.db2.gz VDACXGJELRAWRY-GJZGRUSLSA-N 0 3 413.493 4.251 20 0 HIADHN CC(C)(C)[C@H](CN1CCc2ccccc2C1)NC(=O)c1cnn(CCC(F)(F)F)c1 ZINC000541297155 939489906 /nfs/dbraw/zinc/48/99/06/939489906.db2.gz ZBRUVWMUPWVRHN-IBGZPJMESA-N 0 3 422.495 4.038 20 0 HIADHN FC(F)(F)c1cccc(C2(CNCc3cn(Cc4cccnc4)nn3)CCCC2)c1 ZINC000541389626 939503610 /nfs/dbraw/zinc/50/36/10/939503610.db2.gz RSCDUEDRMPNYAH-UHFFFAOYSA-N 0 3 415.463 4.342 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3cc(C)n([C@H](C)C4CC4)n3)c(C)c2)CC1 ZINC000541461467 939524344 /nfs/dbraw/zinc/52/43/44/939524344.db2.gz OFSWNZPWFHYRAZ-GOSISDBHSA-N 0 3 410.566 4.257 20 0 HIADHN CCc1ccc([C@H](CN2CCOCC2)NCc2ccc(-c3ccncc3)cc2)cc1 ZINC000541541797 939548683 /nfs/dbraw/zinc/54/86/83/939548683.db2.gz IJJLCKJYUWHYGA-SANMLTNESA-N 0 3 401.554 4.474 20 0 HIADHN O=C(c1ccccc1)N1CCC(CN[C@H](c2ccc(F)cc2)c2ccccn2)CC1 ZINC000541544067 939549621 /nfs/dbraw/zinc/54/96/21/939549621.db2.gz OYZHNYOWXBWLPN-XMMPIXPASA-N 0 3 403.501 4.452 20 0 HIADHN COc1ccc(CC(=O)N[C@H](c2ccc(F)c(F)c2)C(C)(C)N2CCCC2)cc1 ZINC000541545752 939549849 /nfs/dbraw/zinc/54/98/49/939549849.db2.gz PGPIYOCNWBGPND-JOCHJYFZSA-N 0 3 402.485 4.248 20 0 HIADHN Cc1nn(-c2ccccc2)c(Oc2ccc(F)cc2)c1CN1C[C@@H]2CC[C@@H](O)[C@@H]2C1 ZINC000541554428 939554698 /nfs/dbraw/zinc/55/46/98/939554698.db2.gz FTSNXYFOIJVDGI-JJEOQYAHSA-N 0 3 407.489 4.315 20 0 HIADHN COc1cc(-c2noc(CN[C@@H](C)[C@H](C)C3CCCCC3)n2)cc(OC)c1OC ZINC000541600313 939564417 /nfs/dbraw/zinc/56/44/17/939564417.db2.gz CTHXUHDLLADASD-GJZGRUSLSA-N 0 3 403.523 4.457 20 0 HIADHN C[C@H](N[C@H](CC(N)=O)C1CCCCC1)C(=O)Nc1ccc(Cl)cc1C(F)(F)F ZINC000541637371 939579305 /nfs/dbraw/zinc/57/93/05/939579305.db2.gz WULAIIICUOXERM-MEDUHNTESA-N 0 3 419.875 4.100 20 0 HIADHN C[C@H](NCC(=O)Nc1ccc(NC(=O)c2cccs2)cc1)[C@H]1COc2ccccc21 ZINC000541694994 939606704 /nfs/dbraw/zinc/60/67/04/939606704.db2.gz GNVCHFMTOQESMS-HNAYVOBHSA-N 0 3 421.522 4.093 20 0 HIADHN COc1ccc(-c2nc(NC(=O)CN[C@H](C)[C@@H]3COc4ccccc43)sc2C)cc1 ZINC000541697921 939608050 /nfs/dbraw/zinc/60/80/50/939608050.db2.gz QJJPFTWQWVXPTJ-KUHUBIRLSA-N 0 3 423.538 4.220 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)C[C@H](C)NCc1cc(Cl)cc2c1OCC2 ZINC000541742144 939618413 /nfs/dbraw/zinc/61/84/13/939618413.db2.gz ZWFHAHLKUABFBP-LBPRGKRZSA-N 0 3 409.313 4.444 20 0 HIADHN C[C@@H](CS(=O)(=O)c1ccccc1)N[C@H]1CCN(c2ccc(Cl)c(Cl)c2)C1 ZINC000541740561 939618530 /nfs/dbraw/zinc/61/85/30/939618530.db2.gz KCTZLNFHFFEQNK-GJZGRUSLSA-N 0 3 413.370 4.024 20 0 HIADHN Cc1nc(-c2ccc(CCN[C@@H](C)CS(=O)(=O)c3ccccc3)s2)cs1 ZINC000541744928 939619291 /nfs/dbraw/zinc/61/92/91/939619291.db2.gz SAPIWGAXVRBLGL-AWEZNQCLSA-N 0 3 406.598 4.175 20 0 HIADHN Cc1cc(Br)ccc1NC(=O)CCNCc1cnc2ccc(Cl)cn12 ZINC000541763370 939624213 /nfs/dbraw/zinc/62/42/13/939624213.db2.gz MPDLAOJJCXZMQG-UHFFFAOYSA-N 0 3 421.726 4.177 20 0 HIADHN Fc1cc(CN2CCC[C@H](c3nnc4ccccn43)C2)ccc1OCC(F)(F)F ZINC000541773718 939626789 /nfs/dbraw/zinc/62/67/89/939626789.db2.gz KOLHVSWLUYNYAA-HNNXBMFYSA-N 0 3 408.399 4.189 20 0 HIADHN CN(C(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1)[C@@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000541825991 939643374 /nfs/dbraw/zinc/64/33/74/939643374.db2.gz PMBQZQPIOQAYOS-LDVJMBRRSA-N 0 3 411.521 4.133 20 0 HIADHN CCC(CC)[C@@H]1C[C@@H](NC(=O)NC[C@@H](c2ccc(OC)cc2)N2CCCC2)CCO1 ZINC000541851032 939647170 /nfs/dbraw/zinc/64/71/70/939647170.db2.gz YQSAWIJWEPTQNB-PMVMPFDFSA-N 0 3 417.594 4.115 20 0 HIADHN CC(C)Sc1cc(Br)ccc1CNCCC(=O)Nc1ccccn1 ZINC000541869275 939648263 /nfs/dbraw/zinc/64/82/63/939648263.db2.gz JCWAEGJRPHJVBL-UHFFFAOYSA-N 0 3 408.365 4.463 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)NCC(=O)N(C)Cc2ccc(Cl)s2)cc1 ZINC000541954989 939661350 /nfs/dbraw/zinc/66/13/50/939661350.db2.gz FNDANQYCXFUXLV-AWEZNQCLSA-N 0 3 402.951 4.205 20 0 HIADHN CC(C)S(=O)(=O)c1ccc(CNC2(c3ccc4c(c3)OCCO4)CCCC2)cc1 ZINC000541987567 939670701 /nfs/dbraw/zinc/67/07/01/939670701.db2.gz JUEWTCNPIWMQSP-UHFFFAOYSA-N 0 3 415.555 4.199 20 0 HIADHN CN(C)Cc1cccc(NC(=O)N2CCO[C@H](c3ccc(C(F)(F)F)cc3)C2)c1 ZINC000542008917 939683689 /nfs/dbraw/zinc/68/36/89/939683689.db2.gz XGVIUUGUVYUPER-IBGZPJMESA-N 0 3 407.436 4.372 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)N1CCC[C@@H](n2ccc(C(F)(F)F)n2)C1 ZINC000542093953 939709101 /nfs/dbraw/zinc/70/91/01/939709101.db2.gz MYWLNNIJTCRNED-CQSZACIVSA-N 0 3 420.435 4.187 20 0 HIADHN CC[C@@H](NCc1ccc(OCc2ccccc2)cc1)c1cccc(S(N)(=O)=O)c1 ZINC000542134838 939725489 /nfs/dbraw/zinc/72/54/89/939725489.db2.gz JVZYBTZFAJGTIW-HSZRJFAPSA-N 0 3 410.539 4.154 20 0 HIADHN CC(C)OC(=O)C1(C(=O)OC(C)C)CC(N[C@H](c2ccc(Cl)cc2)C2CC2)C1 ZINC000542138412 939727570 /nfs/dbraw/zinc/72/75/70/939727570.db2.gz GFUPAOJWMYUBRA-IBGZPJMESA-N 0 3 407.938 4.433 20 0 HIADHN C[C@@H](N[C@@H](Cc1ccc(C(F)(F)F)cc1)C(N)=O)c1cccc(N2CCCC2)c1 ZINC000542231891 939766076 /nfs/dbraw/zinc/76/60/76/939766076.db2.gz AYPTWAYIPSULQS-QRWLVFNGSA-N 0 3 405.464 4.053 20 0 HIADHN C[C@@H](N[C@@H](Cc1ccc(C(F)(F)F)cc1)C(N)=O)c1ccc(Br)cc1 ZINC000542256502 939774133 /nfs/dbraw/zinc/77/41/33/939774133.db2.gz PGEDNWNBFRBHRY-BZNIZROVSA-N 0 3 415.253 4.215 20 0 HIADHN COc1cc(CN[C@H](C)C[S@@](C)=O)ccc1OCc1cccc(C(F)(F)F)c1 ZINC000542298906 939790024 /nfs/dbraw/zinc/79/00/24/939790024.db2.gz RHMXFCJHUOBPMR-GMYLUUGSSA-N 0 3 415.477 4.150 20 0 HIADHN O[C@H](CCc1ccccc1)CNCc1cccc(Br)c1OC(F)F ZINC000542313420 939796465 /nfs/dbraw/zinc/79/64/65/939796465.db2.gz QRPVSCIOXXETMD-OAHLLOKOSA-N 0 3 400.263 4.134 20 0 HIADHN COc1ccccc1-c1ccc(CN[C@@H]2CCCN(Cc3ccccn3)C2=O)cc1 ZINC000542314202 939797346 /nfs/dbraw/zinc/79/73/46/939797346.db2.gz MKNOBHNWCQNLGC-HSZRJFAPSA-N 0 3 401.510 4.038 20 0 HIADHN COc1cccc(OC)c1Oc1ccc(CNCc2cc(-n3ccnc3)cs2)cn1 ZINC000542317576 939798593 /nfs/dbraw/zinc/79/85/93/939798593.db2.gz BNLUESNIQSFHCA-UHFFFAOYSA-N 0 3 422.510 4.428 20 0 HIADHN CCOc1cc(CN2CC[C@H](c3cc(C)cc(C)c3)C2)nc2nc(C(F)(F)F)nn21 ZINC000542317131 939798639 /nfs/dbraw/zinc/79/86/39/939798639.db2.gz ASTFZAHSKOICRO-HNNXBMFYSA-N 0 3 419.451 4.148 20 0 HIADHN CCN(CC)[C@H](CNCc1cnc2c(C)cc(Br)cn12)c1ccco1 ZINC000542318896 939798699 /nfs/dbraw/zinc/79/86/99/939798699.db2.gz AXTGTCZDXAUNGK-QGZVFWFLSA-N 0 3 405.340 4.171 20 0 HIADHN O=C(N[C@H]1CCCN(Cc2ccccc2)C1)[C@@H]1CCn2c(cnc2C2CCCCC2)C1 ZINC000542328826 939801405 /nfs/dbraw/zinc/80/14/05/939801405.db2.gz MJIGJKPXGFDTGT-PKTZIBPZSA-N 0 3 420.601 4.274 20 0 HIADHN O=C([C@H]1CCn2c(cnc2C2CCCCC2)C1)N1CCCN(Cc2ccccc2)CC1 ZINC000542336200 939802734 /nfs/dbraw/zinc/80/27/34/939802734.db2.gz PFAFMPHYBUDUQG-QHCPKHFHSA-N 0 3 420.601 4.228 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)[C@H]1CCn2c(cnc2C2CCCCC2)C1 ZINC000542335713 939802820 /nfs/dbraw/zinc/80/28/20/939802820.db2.gz CQXUVKGMWGQIFE-UPVQGACJSA-N 0 3 420.601 4.447 20 0 HIADHN CC(C)CN(C(=O)[C@H]1CCn2c(cnc2C2CCCCC2)C1)C1CCN(C)CC1 ZINC000542356426 939806781 /nfs/dbraw/zinc/80/67/81/939806781.db2.gz PERMBLUDXIGVRT-FQEVSTJZSA-N 0 3 400.611 4.072 20 0 HIADHN CCCc1c(C(=O)Nc2cccc(CN3CCC(CO)CC3)c2)cnn1C1CCCC1 ZINC000542404321 939815717 /nfs/dbraw/zinc/81/57/17/939815717.db2.gz NPVBAAYFICVWJM-UHFFFAOYSA-N 0 3 424.589 4.407 20 0 HIADHN COc1ccc(CN[C@@H](CN2CCOCC2)c2ccccc2C)cc1OC1CCCC1 ZINC000542471271 939828750 /nfs/dbraw/zinc/82/87/50/939828750.db2.gz PHXHIOTVENCULA-DEOSSOPVSA-N 0 3 424.585 4.488 20 0 HIADHN COc1cc(CN2CC[C@@H](N[C@H](c3ccc(F)cc3)c3cccnc3)C2)cc(OC)c1 ZINC000542474030 939829145 /nfs/dbraw/zinc/82/91/45/939829145.db2.gz YZLYJFPRWVEEFG-RCZVLFRGSA-N 0 3 421.516 4.191 20 0 HIADHN CC(C)(C)c1nn(Cc2ccccc2)cc1CN1CCC(OC[C@@H]2CCOC2)CC1 ZINC000542484942 939831498 /nfs/dbraw/zinc/83/14/98/939831498.db2.gz BBSGKZRCTDMUPX-OAQYLSRUSA-N 0 3 411.590 4.246 20 0 HIADHN O=C(CN[C@@H](c1cccs1)C1CC1)N1CCC[C@@H]1c1ccc2c(c1)OCCCO2 ZINC000542512044 939835126 /nfs/dbraw/zinc/83/51/26/939835126.db2.gz WSMBDHREMDXCOX-WZONZLPQSA-N 0 3 412.555 4.314 20 0 HIADHN O=C(CN[C@@H](c1cccs1)C1CC1)N1CCC[C@H]1c1ccc2c(c1)OCCCO2 ZINC000542512029 939835195 /nfs/dbraw/zinc/83/51/95/939835195.db2.gz WSMBDHREMDXCOX-FDDCHVKYSA-N 0 3 412.555 4.314 20 0 HIADHN COC(=O)C[C@@H](N[C@@H](C)C(=O)Nc1ccccc1C(F)(F)F)C1CCCCC1 ZINC000542534180 939839121 /nfs/dbraw/zinc/83/91/21/939839121.db2.gz YGHLDNWSNSLCLP-SUMWQHHRSA-N 0 3 400.441 4.134 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)N[C@@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000542545361 939841660 /nfs/dbraw/zinc/84/16/60/939841660.db2.gz UFUKJOPGKOJONV-ZLNRFVROSA-N 0 3 411.521 4.182 20 0 HIADHN CSc1ccc(CN(C)C(=O)CN(C)[C@@H]2CCO[C@@H](c3ccc(F)cc3)C2)cc1 ZINC000542626559 939850102 /nfs/dbraw/zinc/85/01/02/939850102.db2.gz IVXJXUAQJNEIQN-IFMALSPDSA-N 0 3 416.562 4.358 20 0 HIADHN CN(Cc1c(F)cccc1Cl)C(=O)CN(C)[C@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000542629051 939850328 /nfs/dbraw/zinc/85/03/28/939850328.db2.gz WUKMAXOJQDDMBP-LAUBAEHRSA-N 0 3 422.903 4.429 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@@H]2NCc2ccc(-n3cccn3)cc2)cc1 ZINC000542672230 939853164 /nfs/dbraw/zinc/85/31/64/939853164.db2.gz XCEVTQWCSORHGZ-XZOQPEGZSA-N 0 3 409.555 4.055 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@@H]2NC[C@@H](c2cccs2)N(C)C)cc1 ZINC000542671907 939853198 /nfs/dbraw/zinc/85/31/98/939853198.db2.gz VIEDUWASICFOML-IRFCIJBXSA-N 0 3 406.617 4.034 20 0 HIADHN Cc1cnc([C@H](C)CN[C@@H](c2ccc(F)cc2)c2cccc(S(C)(=O)=O)c2)s1 ZINC000542698030 939855068 /nfs/dbraw/zinc/85/50/68/939855068.db2.gz ZLHCYGHZBWGDLI-VLIAUNLRSA-N 0 3 418.559 4.477 20 0 HIADHN CCN1CCN(Cc2ccc(N[C@@H](c3ccn(C)n3)c3ccc(Cl)cc3)cc2)CC1 ZINC000542707286 939855759 /nfs/dbraw/zinc/85/57/59/939855759.db2.gz IRNBCAUNYMVKQR-XMMPIXPASA-N 0 3 423.992 4.413 20 0 HIADHN CC(=O)Nc1ccc([C@H](C)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2=O)cc1 ZINC000542848874 939862815 /nfs/dbraw/zinc/86/28/15/939862815.db2.gz IAZGGPYWULVTSA-VBKZILBWSA-N 0 3 417.456 4.093 20 0 HIADHN CC(=O)Nc1ccc([C@@H](C)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2=O)cc1 ZINC000542848873 939862835 /nfs/dbraw/zinc/86/28/35/939862835.db2.gz IAZGGPYWULVTSA-JLTOFOAXSA-N 0 3 417.456 4.093 20 0 HIADHN COCC[C@H](Cc1cccc(F)c1)N[C@H](CCO)c1ccccc1Br ZINC000542852204 939863158 /nfs/dbraw/zinc/86/31/58/939863158.db2.gz VPFBFERTOQNVQU-YLJYHZDGSA-N 0 3 410.327 4.249 20 0 HIADHN COC(=O)c1ccc(CNCCOc2c(Cl)cc(Br)cc2Cl)[nH]1 ZINC000542854791 939863385 /nfs/dbraw/zinc/86/33/85/939863385.db2.gz UZZNHVZNZHJVNE-UHFFFAOYSA-N 0 3 422.106 4.039 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)NCc2cn(C)nc2-c2ccccc2)N2CCCC2)cc1 ZINC000542968225 939888135 /nfs/dbraw/zinc/88/81/35/939888135.db2.gz JUIPTEWIXZULPU-HSZRJFAPSA-N 0 3 417.557 4.032 20 0 HIADHN C[C@H](CC(=O)Nc1ccc(NC(=O)C2CC2)cc1)NCc1ccc(OC(C)(C)C)nc1 ZINC000543112972 939951819 /nfs/dbraw/zinc/95/18/19/939951819.db2.gz LEJOIYLFWCUUQS-MRXNPFEDSA-N 0 3 424.545 4.114 20 0 HIADHN CCCc1c(C(=O)NC2CCN(Cc3ccccc3)CC2)cnn1-c1cccc(F)c1 ZINC000543121298 939956007 /nfs/dbraw/zinc/95/60/07/939956007.db2.gz IYIVAWXGEYNLRC-UHFFFAOYSA-N 0 3 420.532 4.358 20 0 HIADHN CC(C)(C)OC(=O)CCCCN1CCCN(C(=O)Nc2cccc(Cl)c2)CC1 ZINC000543138078 939965975 /nfs/dbraw/zinc/96/59/75/939965975.db2.gz FNZBQDNOKRLEPJ-UHFFFAOYSA-N 0 3 409.958 4.392 20 0 HIADHN C[C@H](CN(C)C(=O)NC[C@H](c1ccccc1)N1CCC(C)CC1)c1nccs1 ZINC000543201517 939993754 /nfs/dbraw/zinc/99/37/54/939993754.db2.gz ZDJHPRJHEBUDGW-UYAOXDASSA-N 0 3 400.592 4.361 20 0 HIADHN FC(F)(F)c1ccc([C@H]2CCC[C@H]2NCc2cn(Cc3cccnc3)nn2)cc1 ZINC000543240397 940005449 /nfs/dbraw/zinc/00/54/49/940005449.db2.gz XOGQLMIEUZCBDY-WOJBJXKFSA-N 0 3 401.436 4.166 20 0 HIADHN Clc1ccc(-n2cc(CN[C@@H]3CCOC4(CCSCC4)C3)nn2)cc1Cl ZINC000543241999 940005721 /nfs/dbraw/zinc/00/57/21/940005721.db2.gz UPCCDDZSYULUSB-CYBMUJFWSA-N 0 3 413.374 4.109 20 0 HIADHN CCOc1ccc(Oc2cc(CNCc3cn(-c4ccncc4)nc3C)ccn2)cc1 ZINC000543247363 940007389 /nfs/dbraw/zinc/00/73/89/940007389.db2.gz PBYCHEYSYPGNQB-UHFFFAOYSA-N 0 3 415.497 4.452 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)[C@H]1CCn2c(cnc2C2CCCCC2)C1 ZINC000543268084 940013431 /nfs/dbraw/zinc/01/34/31/940013431.db2.gz MWNODGJRESGFAL-UPVQGACJSA-N 0 3 420.601 4.447 20 0 HIADHN CN1CC[C@H](NC(=O)CCc2cc(F)ccc2Br)[C@H]1c1ccccc1 ZINC000543313157 940025879 /nfs/dbraw/zinc/02/58/79/940025879.db2.gz YZGWEGYBLUBLHK-AZUAARDMSA-N 0 3 405.311 4.082 20 0 HIADHN COCCOCc1ccc(CNc2cc(CN3CCSCC3)ccc2C)cc1 ZINC000563766221 945291055 /nfs/dbraw/zinc/29/10/55/945291055.db2.gz KVJLNYABFFAZOE-UHFFFAOYSA-N 0 3 400.588 4.319 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)c2cnc(OCC3CC3)c(Cl)c2)CC1 ZINC000543331817 940033055 /nfs/dbraw/zinc/03/30/55/940033055.db2.gz APIZOKSZVGSGPQ-UHFFFAOYSA-N 0 3 413.949 4.260 20 0 HIADHN Cc1cc([C@@H](NC[C@H](c2cccs2)N2CCOCC2)c2cccnc2)ccc1F ZINC000543404437 940053244 /nfs/dbraw/zinc/05/32/44/940053244.db2.gz KSOWCHPXESEADU-FYYLOGMGSA-N 0 3 411.546 4.343 20 0 HIADHN O=C(c1ccccc1)N1CCC(CN[C@@H](c2ccc(F)cc2)c2cccnc2)CC1 ZINC000543405524 940054137 /nfs/dbraw/zinc/05/41/37/940054137.db2.gz ZFUPNLFPIKVTDP-DEOSSOPVSA-N 0 3 403.501 4.452 20 0 HIADHN O=C(c1ccccc1)N1CCC(CN[C@H](c2ccc(F)cc2)c2cccnc2)CC1 ZINC000543405525 940054476 /nfs/dbraw/zinc/05/44/76/940054476.db2.gz ZFUPNLFPIKVTDP-XMMPIXPASA-N 0 3 403.501 4.452 20 0 HIADHN Cc1ccccc1[C@@H](CN1CCOCC1)NCc1ccc(OCc2ccccn2)cc1 ZINC000543408252 940055515 /nfs/dbraw/zinc/05/55/15/940055515.db2.gz BHHXYRBZKGYULK-AREMUKBSSA-N 0 3 417.553 4.132 20 0 HIADHN COCCN1CC[C@@H](N[C@H](c2ccc(OC)cc2)c2ccc(C(F)(F)F)cc2)C1 ZINC000543414356 940058064 /nfs/dbraw/zinc/05/80/64/940058064.db2.gz SDZFSRKQUYHSLX-CTNGQTDRSA-N 0 3 408.464 4.114 20 0 HIADHN O=C(Cc1nc(-c2ccc(F)cc2)cs1)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000543416673 940058295 /nfs/dbraw/zinc/05/82/95/940058295.db2.gz ABIIDZWFXFCXMJ-NRFANRHFSA-N 0 3 409.530 4.445 20 0 HIADHN CC[C@H](N[C@@H]1CCCN(Cc2ccccn2)C1=O)c1cccc(Br)c1 ZINC000543427044 940061201 /nfs/dbraw/zinc/06/12/01/940061201.db2.gz QNXSPPWLUOLMQT-RBUKOAKNSA-N 0 3 402.336 4.076 20 0 HIADHN COC(=O)c1ccccc1N(C)C(=O)CN[C@H](Cc1ccccc1)c1cccs1 ZINC000543455767 940068294 /nfs/dbraw/zinc/06/82/94/940068294.db2.gz ZVHWOQNYYHMOPW-LJQANCHMSA-N 0 3 408.523 4.071 20 0 HIADHN O=C(N[C@@H]1CCO[C@H](c2ccc(F)cc2)C1)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000543464753 940072434 /nfs/dbraw/zinc/07/24/34/940072434.db2.gz MGPHSUKXTJMCME-ZLNRFVROSA-N 0 3 411.521 4.010 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cccc(CNc2ccnc(C)n2)c1)c1ccsc1 ZINC000543537200 940097670 /nfs/dbraw/zinc/09/76/70/940097670.db2.gz IMPXYTPFCNYTCQ-NRFANRHFSA-N 0 3 423.586 4.272 20 0 HIADHN CC(C)CN(CC(F)(F)F)C(=O)CN(C)[C@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000543560660 940109516 /nfs/dbraw/zinc/10/95/16/940109516.db2.gz MWTOPCWMCIETDH-ROUUACIJSA-N 0 3 404.448 4.025 20 0 HIADHN Cc1sc(CCN[C@H](C)CS(=O)(=O)c2ccc(C)cc2)nc1-c1ccccc1 ZINC000543601354 940127012 /nfs/dbraw/zinc/12/70/12/940127012.db2.gz FIHFUWLDLYJTFV-QGZVFWFLSA-N 0 3 414.596 4.421 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N[C@H]2CCO[C@@H](c3ccc(F)cc3)C2)N(C)C)cc1 ZINC000543654656 940151292 /nfs/dbraw/zinc/15/12/92/940151292.db2.gz YAQWPBOQMUEOSW-RJGXRXQPSA-N 0 3 413.537 4.210 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CCC[C@H]1C(C)(C)O)c1ccc(C(F)(F)F)cc1 ZINC000543691670 940161062 /nfs/dbraw/zinc/16/10/62/940161062.db2.gz WVEWTTLQQJLYNV-ROUUACIJSA-N 0 3 415.500 4.033 20 0 HIADHN COc1ccc2c(c1)C[C@H](C)N(C(=O)CCCN1CCN(c3ccccc3)CC1)[C@@H]2C ZINC000543789187 940187136 /nfs/dbraw/zinc/18/71/36/940187136.db2.gz YYWWCAVFMJRUSR-LEWJYISDSA-N 0 3 421.585 4.132 20 0 HIADHN CC1(C)CC[C@@H](C(=O)NC2CCN(CCOc3ccc(Br)cc3)CC2)C1 ZINC000543835846 940204310 /nfs/dbraw/zinc/20/43/10/940204310.db2.gz IRLLMRAECXISGU-MRXNPFEDSA-N 0 3 423.395 4.235 20 0 HIADHN CN(C)C(=O)c1ccc(CN[C@H]2CCN(C(C)(C)C)[C@H]2c2ccc(Cl)c(F)c2)[nH]1 ZINC000543850111 940208281 /nfs/dbraw/zinc/20/82/81/940208281.db2.gz IZGPFLQOLISEJQ-ICSRJNTNSA-N 0 3 420.960 4.213 20 0 HIADHN COc1ccc2c(c1)C1(CC1)CN(C(=O)N[C@@H](CN1CCCC1)c1ccccc1)C2 ZINC000563791559 945303290 /nfs/dbraw/zinc/30/32/90/945303290.db2.gz VWPGWHLLGXNXNQ-QHCPKHFHSA-N 0 3 405.542 4.089 20 0 HIADHN Cc1cc(Br)ccc1NC(=O)CN[C@H](C)c1cccc(-n2ccnc2)c1 ZINC000543869345 940217463 /nfs/dbraw/zinc/21/74/63/940217463.db2.gz KRNKGFQPKQSKAQ-OAHLLOKOSA-N 0 3 413.319 4.233 20 0 HIADHN Cc1cc(Br)ccc1NC(=O)CN[C@@H](C)c1cccc(-n2ccnc2)c1 ZINC000543869344 940217656 /nfs/dbraw/zinc/21/76/56/940217656.db2.gz KRNKGFQPKQSKAQ-HNNXBMFYSA-N 0 3 413.319 4.233 20 0 HIADHN Cc1c2cccc(Br)c2oc1C(=O)NCCCCN1C[C@@H](C)O[C@@H](C)C1 ZINC000543880094 940222805 /nfs/dbraw/zinc/22/28/05/940222805.db2.gz IOHBIVJRNOCHRV-OKILXGFUSA-N 0 3 423.351 4.123 20 0 HIADHN O=C(CN[C@@H](c1ccc(Cl)cc1)C1CC1)N1CCO[C@H](c2ccc(F)cc2)C1 ZINC000543989713 940286733 /nfs/dbraw/zinc/28/67/33/940286733.db2.gz XAXOXWMTGNRIKO-RBBKRZOGSA-N 0 3 402.897 4.120 20 0 HIADHN C[C@H](N[C@@H]1CCCN(Cc2nccn2C)C1=O)c1ccc(Oc2ccccc2)cc1 ZINC000544017004 940300466 /nfs/dbraw/zinc/30/04/66/940300466.db2.gz RYQVZBMUMIZZMJ-PGRDOPGGSA-N 0 3 404.514 4.054 20 0 HIADHN CCN(CC)C(=O)CCC1CCN(Cc2cc(OC)c(OC)cc2SC)CC1 ZINC000544042805 940308405 /nfs/dbraw/zinc/30/84/05/940308405.db2.gz CCCASDLNOVMXOP-UHFFFAOYSA-N 0 3 408.608 4.286 20 0 HIADHN O=C([C@@H]1CC12CCN(CCCc1ccccc1Br)CC2)N1CCCCC1 ZINC000544119850 940331445 /nfs/dbraw/zinc/33/14/45/940331445.db2.gz DUBRHLCDZKIMON-IBGZPJMESA-N 0 3 419.407 4.496 20 0 HIADHN CC(C)Oc1ccc(-c2nn(-c3ccccc3)cc2CN[C@@H](C)C[S@@](C)=O)cc1 ZINC000544169169 940342833 /nfs/dbraw/zinc/34/28/33/940342833.db2.gz MGGDKENEUHGNAK-RBSBEOHCSA-N 0 3 411.571 4.183 20 0 HIADHN O=S1(=O)CCCC[C@@H]1CNCc1ccc(-c2ccccc2Br)s1 ZINC000544178034 940344898 /nfs/dbraw/zinc/34/48/98/940344898.db2.gz BRWJDEPQSPFXBU-CQSZACIVSA-N 0 3 414.390 4.235 20 0 HIADHN O=C(NCCCCN1CCN(c2cccc(C(F)(F)F)c2)CC1)C12CCC(CC1)C2 ZINC000544197710 940351648 /nfs/dbraw/zinc/35/16/48/940351648.db2.gz LWVUYCMBAZZNRJ-UHFFFAOYSA-N 0 3 423.523 4.304 20 0 HIADHN CN1CCCN(c2ccc(-c3noc([C@H]4C[C@H]4c4cccc(Cl)c4)n3)cn2)CC1 ZINC000544346422 940396209 /nfs/dbraw/zinc/39/62/09/940396209.db2.gz QEAOVMBDDHCVFL-OALUTQOASA-N 0 3 409.921 4.198 20 0 HIADHN Cc1cc([C@H](NC[C@@H](c2ccccc2)N2CCOCC2)c2cccnc2)ccc1F ZINC000544359395 940400989 /nfs/dbraw/zinc/40/09/89/940400989.db2.gz ADJYWMLPASXLPK-DQEYMECFSA-N 0 3 405.517 4.282 20 0 HIADHN COc1ccc(CCN[C@H](c2cccnc2)c2ccc(F)c(C)c2)c(OC)c1OC ZINC000544360824 940401517 /nfs/dbraw/zinc/40/15/17/940401517.db2.gz RQGMAMRWAQMYQU-QFIPXVFZSA-N 0 3 410.489 4.477 20 0 HIADHN c1ccc2nc(N3CCCCC3)c(CN3CCC(OC[C@@H]4CCOC4)CC3)cc2c1 ZINC000544372169 940404362 /nfs/dbraw/zinc/40/43/62/940404362.db2.gz XIPFHNOISBAQGL-HXUWFJFHSA-N 0 3 409.574 4.243 20 0 HIADHN O=C(CN[C@H](Cc1ccccc1)c1cccs1)NCc1cnn(-c2ccccc2)c1 ZINC000544413764 940417456 /nfs/dbraw/zinc/41/74/56/940417456.db2.gz LHNWXCMMMLFJNW-JOCHJYFZSA-N 0 3 416.550 4.124 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(Cc4ccc(Cl)cc4Cl)n3)cn2)CC1 ZINC000544424090 940423610 /nfs/dbraw/zinc/42/36/10/940423610.db2.gz FGRWVBPOWCOANV-UHFFFAOYSA-N 0 3 418.328 4.171 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)N[C@H]2CCO[C@@H](c3ccc(F)cc3)C2)CN1Cc1ccccc1 ZINC000544427716 940425930 /nfs/dbraw/zinc/42/59/30/940425930.db2.gz UBQMCGXGYPTMCH-LMDOGRNLSA-N 0 3 411.521 4.008 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1C[C@@H](C)C[C@H]1c1cccnc1)c1cccc(OC)c1 ZINC000544437589 940430783 /nfs/dbraw/zinc/43/07/83/940430783.db2.gz KCFYLDLLWMZLTO-OFAXGOBFSA-N 0 3 410.562 4.266 20 0 HIADHN C[C@@H](N[C@H](CC(N)=O)C1CCCCC1)C(=O)Nc1ccc(OCc2ccccc2)cc1 ZINC000544460619 940440404 /nfs/dbraw/zinc/44/04/04/940440404.db2.gz ROVWSMXLOHTTNX-WZONZLPQSA-N 0 3 423.557 4.007 20 0 HIADHN Cc1nn(-c2ccc(C)cc2)c(C)c1NC(=O)CN[C@H](C)[C@H]1Oc2ccccc2[C@@H]1C ZINC000544519787 940470010 /nfs/dbraw/zinc/47/00/10/940470010.db2.gz QUOMNGZTDAMHTN-UVNWJPITSA-N 0 3 418.541 4.279 20 0 HIADHN C[C@@H](NCC(=O)NC(=O)NCC(F)(F)F)c1ccc(-c2ccc(Cl)cc2)s1 ZINC000544523731 940471357 /nfs/dbraw/zinc/47/13/57/940471357.db2.gz AFPFERPWVUEEPU-SNVBAGLBSA-N 0 3 419.856 4.107 20 0 HIADHN Cc1ccc(S(=O)(=O)C[C@H](C)NCCc2nc(C3CCCCC3)cs2)cc1 ZINC000544575451 940482977 /nfs/dbraw/zinc/48/29/77/940482977.db2.gz JQUPNYHTXVCOJS-KRWDZBQOSA-N 0 3 406.617 4.494 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)N1CCO[C@@H](C2CCCCC2)C1 ZINC000544578970 940483803 /nfs/dbraw/zinc/48/38/03/940483803.db2.gz KXFDLMSORJNYFS-JOCHJYFZSA-N 0 3 417.619 4.091 20 0 HIADHN COc1cc(CN[C@H]2CCO[C@@H](c3ccc(F)cc3)C2)c(Br)cc1O ZINC000544618364 940491555 /nfs/dbraw/zinc/49/15/55/940491555.db2.gz NJUSHOWCXUNXLC-MAUKXSAKSA-N 0 3 410.283 4.312 20 0 HIADHN Cc1noc(-c2ccccc2)c1NC(=O)c1ccc(N2CCN(C(C)C)CC2)cc1 ZINC000544685429 940502247 /nfs/dbraw/zinc/50/22/47/940502247.db2.gz RTFNMGZMWLZOSB-UHFFFAOYSA-N 0 3 404.514 4.433 20 0 HIADHN COC(=O)[C@H](C)Cc1ccc(NC(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)cc1 ZINC000544797966 940515107 /nfs/dbraw/zinc/51/51/07/940515107.db2.gz GXBXOAJEWCYWSE-UXHICEINSA-N 0 3 423.557 4.167 20 0 HIADHN CCN(C(=O)c1cnc2onc(C(C)(C)C)c2c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000544850140 940519233 /nfs/dbraw/zinc/51/92/33/940519233.db2.gz YADFEXRTXSWPIZ-LJQANCHMSA-N 0 3 406.530 4.257 20 0 HIADHN CCN(C(=O)c1cc(C)n(Cc2ccccn2)c1C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000544865257 940520303 /nfs/dbraw/zinc/52/03/03/940520303.db2.gz FLVXQCSGCJLMBI-XMMPIXPASA-N 0 3 416.569 4.285 20 0 HIADHN Cc1ccccc1C(NC(=O)N1CCN(CC2CCOCC2)CC1)c1ccccc1C ZINC000544872825 940520923 /nfs/dbraw/zinc/52/09/23/940520923.db2.gz FICWCCCAAHYBSQ-UHFFFAOYSA-N 0 3 421.585 4.147 20 0 HIADHN CCN1CC[C@@H](NCc2cncc(Br)c2)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000545218949 940556606 /nfs/dbraw/zinc/55/66/06/940556606.db2.gz STSYYKRRDPTABD-SJLPKXTDSA-N 0 3 414.269 4.187 20 0 HIADHN Cc1cc(C)c(NC(=O)CCCN2CCC([C@@](C)(O)C(F)(F)F)CC2)c(C)c1 ZINC000545224163 940556907 /nfs/dbraw/zinc/55/69/07/940556907.db2.gz ACTGILXZGIIGHC-HXUWFJFHSA-N 0 3 400.485 4.356 20 0 HIADHN CN(C)CCN(CC1CCCCC1)C(=O)N[C@@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000545340294 940562961 /nfs/dbraw/zinc/56/29/61/940562961.db2.gz DTHGDCFTOWHFFR-YADHBBJMSA-N 0 3 405.558 4.199 20 0 HIADHN CS[C@H]1CN(C(=O)Nc2ccc(Oc3ccc(Cl)cn3)cc2)C[C@@H]1N(C)C ZINC000545421957 940569081 /nfs/dbraw/zinc/56/90/81/940569081.db2.gz LZOAOVBAQLQDGO-IRXDYDNUSA-N 0 3 406.939 4.037 20 0 HIADHN CCN(C(=O)c1cccc(Cn2nc(C)cc2C)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000545476883 940571442 /nfs/dbraw/zinc/57/14/42/940571442.db2.gz WYDBPCDJDSMJAN-RUZDIDTESA-N 0 3 416.569 4.285 20 0 HIADHN CCc1ccc(/C(C)=C/c2nc(-c3ccc(N4CCCN(C)CC4)nc3)no2)cc1 ZINC000545650971 940578967 /nfs/dbraw/zinc/57/89/67/940578967.db2.gz JNJJEGNXHMUDQH-FBMGVBCBSA-N 0 3 403.530 4.396 20 0 HIADHN Cc1ccc(C)c(SCc2nc(-c3ccc(N4CCCN(C)CC4)nc3)no2)c1 ZINC000545656428 940579177 /nfs/dbraw/zinc/57/91/77/940579177.db2.gz MNRDKWYTAHMUDA-UHFFFAOYSA-N 0 3 409.559 4.183 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(CCc4ccc5ccccc5c4)n3)cn2)CC1 ZINC000545660589 940579356 /nfs/dbraw/zinc/57/93/56/940579356.db2.gz SYJPLEINEKLXMH-UHFFFAOYSA-N 0 3 413.525 4.212 20 0 HIADHN COc1cc(-c2noc([C@@H]3CCCN(Cc4cccnc4)C3)n2)c2ccccc2n1 ZINC000545740065 940583155 /nfs/dbraw/zinc/58/31/55/940583155.db2.gz FQJAQSISKYXXEP-QGZVFWFLSA-N 0 3 401.470 4.068 20 0 HIADHN COCc1cccc(OCC2(CN3CCC([C@@](C)(O)C(F)(F)F)CC3)CCC2)c1 ZINC000545931517 940660634 /nfs/dbraw/zinc/66/06/34/940660634.db2.gz ODNTWARBUVUMRQ-HXUWFJFHSA-N 0 3 415.496 4.407 20 0 HIADHN CN(C)C[C@H](NC(=O)c1cc(OC(F)F)cc(OC(F)F)c1)c1ccc(F)cc1 ZINC000563991507 945338740 /nfs/dbraw/zinc/33/87/40/945338740.db2.gz WPKDSXJKUXNREE-INIZCTEOSA-N 0 3 418.362 4.061 20 0 HIADHN CS[C@@H]1CN(C(=O)Nc2cccc(Cl)c2SCC(F)F)C[C@@H]1N(C)C ZINC000546130050 940707799 /nfs/dbraw/zinc/70/77/99/940707799.db2.gz JIDJZLDIBFZXCQ-QWHCGFSZSA-N 0 3 409.955 4.207 20 0 HIADHN C[C@@H]1CN(c2ccc(CN[C@@H](Cc3cccnc3)c3ccc(Cl)cc3)cn2)CCO1 ZINC000546164281 940719010 /nfs/dbraw/zinc/71/90/10/940719010.db2.gz FWKLVXYWJMVNJD-JPYJTQIMSA-N 0 3 422.960 4.429 20 0 HIADHN CCN(C(=O)c1cc(C(C)C)nc2onc(C)c21)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000546184634 940723976 /nfs/dbraw/zinc/72/39/76/940723976.db2.gz KUTBBTRIACAGPB-LJQANCHMSA-N 0 3 406.530 4.391 20 0 HIADHN CCN(C(=O)c1cccc(COC2CCOCC2)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000546185139 940724337 /nfs/dbraw/zinc/72/43/37/940724337.db2.gz ZTTBOPIUZUGJFY-XMMPIXPASA-N 0 3 422.569 4.119 20 0 HIADHN CCN(C(=O)c1ccc(OCc2ccccn2)cc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000546199662 940727657 /nfs/dbraw/zinc/72/76/57/940727657.db2.gz WNSMYFFFRLEOKK-DEOSSOPVSA-N 0 3 415.537 4.397 20 0 HIADHN COCCn1cc2c(n1)[C@H](N[C@H](C)Cc1ccc(Br)c(F)c1)CCC2 ZINC000546227791 940735468 /nfs/dbraw/zinc/73/54/68/940735468.db2.gz QBKOYCSVUHTUGF-FZKQIMNGSA-N 0 3 410.331 4.029 20 0 HIADHN COc1cccc(Cc2noc([C@@]3(C(F)(F)F)CCN(Cc4ccccc4)C3)n2)c1 ZINC000546286889 940765109 /nfs/dbraw/zinc/76/51/09/940765109.db2.gz CAVHLUZTCNIFHU-OAQYLSRUSA-N 0 3 417.431 4.375 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(-c4csc(-c5ccccc5)n4)n3)cn2)CC1 ZINC000546356062 940800431 /nfs/dbraw/zinc/80/04/31/940800431.db2.gz KIBYWEMOSVCJRV-UHFFFAOYSA-N 0 3 418.526 4.064 20 0 HIADHN C[C@@H]1C[C@@H]1c1ccc(/C=C\c2nc(-c3ccc(N4CCCN(C)CC4)nc3)no2)o1 ZINC000546368699 940803502 /nfs/dbraw/zinc/80/35/02/940803502.db2.gz HRDHAVFVBNNARW-NSKUMVKISA-N 0 3 405.502 4.160 20 0 HIADHN CO[C@@H](C)c1nc(Cc2noc([C@@H]3CCCN(Cc4cccc(F)c4)C3)n2)cs1 ZINC000546533461 940846075 /nfs/dbraw/zinc/84/60/75/940846075.db2.gz QPBWTQZPLBQLCF-GOEBONIOSA-N 0 3 416.522 4.343 20 0 HIADHN Nc1ccc(F)c(NC(=O)CCN2CC=C(c3cccc(Br)c3)CC2)c1 ZINC000546588427 940858531 /nfs/dbraw/zinc/85/85/31/940858531.db2.gz BRZAXTZOFZMTOL-UHFFFAOYSA-N 0 3 418.310 4.288 20 0 HIADHN Cc1noc(C)c1CO[C@@H]1CCN(CCCc2nc(-c3ccc(C)c(F)c3)no2)C1 ZINC000546588249 940858678 /nfs/dbraw/zinc/85/86/78/940858678.db2.gz MARABIDGBICAFA-GOSISDBHSA-N 0 3 414.481 4.013 20 0 HIADHN O=C([C@H]1CCCN(Cc2cccnc2)C1)N1CCC(F)(c2cccc(Cl)c2)CC1 ZINC000546713462 940871915 /nfs/dbraw/zinc/87/19/15/940871915.db2.gz GKMPQJOATQTVHL-IBGZPJMESA-N 0 3 415.940 4.434 20 0 HIADHN CC(C)c1c(C(=O)N[C@H](CN(C)Cc2ccccc2)C(C)C)cnn1-c1ccccn1 ZINC000546719782 940872662 /nfs/dbraw/zinc/87/26/62/940872662.db2.gz ABKIGFOOLCTDCK-JOCHJYFZSA-N 0 3 419.573 4.277 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)N[C@@H](CCc1ccccc1)C(F)(F)F ZINC000546821140 940888243 /nfs/dbraw/zinc/88/82/43/940888243.db2.gz WZVFDEKBWXSKHI-SFHVURJKSA-N 0 3 413.509 4.385 20 0 HIADHN C[C@H](N[C@@H](Cc1ccc(Cl)cc1)C(N)=O)c1cccc(OCc2ccccn2)c1 ZINC000546886094 940901496 /nfs/dbraw/zinc/90/14/96/940901496.db2.gz AJTJLKLIRGTRLQ-AOMKIAJQSA-N 0 3 409.917 4.061 20 0 HIADHN C[C@@H](N[C@H](Cc1ccc(Cl)cc1)C(N)=O)c1cccc(OCc2ccccn2)c1 ZINC000546886096 940901681 /nfs/dbraw/zinc/90/16/81/940901681.db2.gz AJTJLKLIRGTRLQ-OPAMFIHVSA-N 0 3 409.917 4.061 20 0 HIADHN C[C@@H](NC(=O)N(C)C1CCN(CCc2ccccn2)CC1)c1ccc2c(c1)CCCC2 ZINC000546902418 940907441 /nfs/dbraw/zinc/90/74/41/940907441.db2.gz HNIYUJVSFVFYFP-HXUWFJFHSA-N 0 3 420.601 4.370 20 0 HIADHN CCN(C(=O)CCc1ncc(-c2ccccc2)o1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000546904956 940908174 /nfs/dbraw/zinc/90/81/74/940908174.db2.gz HMIQCIHGWCCJFC-QFIPXVFZSA-N 0 3 403.526 4.397 20 0 HIADHN COc1cccc(OC)c1OC[C@@H](O)CNC(c1ccccc1C)c1ccccc1C ZINC000546932728 940917708 /nfs/dbraw/zinc/91/77/08/940917708.db2.gz CNYOYKLKNSDWHG-FQEVSTJZSA-N 0 3 421.537 4.440 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(-c4cnc(-c5ccsc5)s4)n3)cn2)CC1 ZINC000547062195 940978879 /nfs/dbraw/zinc/97/88/79/940978879.db2.gz JSVSXOTUGBNQBD-UHFFFAOYSA-N 0 3 424.555 4.126 20 0 HIADHN C[C@@H](Cc1ccccc1Cl)c1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1 ZINC000547063610 940979767 /nfs/dbraw/zinc/97/97/67/940979767.db2.gz QOHZXAPPTRYRHX-INIZCTEOSA-N 0 3 411.937 4.273 20 0 HIADHN C[C@H](CSc1ccccc1)c1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1 ZINC000547066155 940981290 /nfs/dbraw/zinc/98/12/90/940981290.db2.gz GUYQZBIQVJLCHR-QGZVFWFLSA-N 0 3 409.559 4.169 20 0 HIADHN CC(C)Sc1ccc(-c2nc(-c3ccc(N4CCCN(C)CC4)nc3)no2)cc1 ZINC000547068170 940981759 /nfs/dbraw/zinc/98/17/59/940981759.db2.gz VTTJXNRBRBILGK-UHFFFAOYSA-N 0 3 409.559 4.441 20 0 HIADHN C[C@@H](Oc1ccccc1Cl)c1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1 ZINC000547069966 940982657 /nfs/dbraw/zinc/98/26/57/940982657.db2.gz YGZAZLASIUAWGT-OAHLLOKOSA-N 0 3 413.909 4.067 20 0 HIADHN Cc1cc(Cl)c2ccccc2c1NC(=O)N1CC[C@@H](N2CCN(C(C)C)CC2)C1 ZINC000547321793 941056066 /nfs/dbraw/zinc/05/60/66/941056066.db2.gz YOSDFODIXCEKMS-GOSISDBHSA-N 0 3 414.981 4.434 20 0 HIADHN Cc1cc(CN[C@H](C)c2ccc3c(c2)CCC(=O)N3)ccc1I ZINC000547397245 941060357 /nfs/dbraw/zinc/06/03/57/941060357.db2.gz WOSOMBHEBGTSRH-CYBMUJFWSA-N 0 3 420.294 4.335 20 0 HIADHN FC(F)(F)C1CCC(CN2CCN(Cc3nc(-c4ccccc4)no3)CC2)CC1 ZINC000547441712 941063001 /nfs/dbraw/zinc/06/30/01/941063001.db2.gz ASZLLYRCNZUKKY-UHFFFAOYSA-N 0 3 408.468 4.223 20 0 HIADHN CCCC(=O)Nc1cccc(CNC(=O)N(CC)[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000547788284 941075928 /nfs/dbraw/zinc/07/59/28/941075928.db2.gz OZBHTJGIEJNOAQ-HSZRJFAPSA-N 0 3 422.573 4.231 20 0 HIADHN C[C@H](N[C@H]1CCCc2ncc(C(F)(F)F)cc21)[C@H]1CN(Cc2ccccc2)CCO1 ZINC000548306527 941094998 /nfs/dbraw/zinc/09/49/98/941094998.db2.gz POAAPJKDDMSATB-WQTXXOFMSA-N 0 3 419.491 4.357 20 0 HIADHN C[C@@H](NCCCCN1C(=O)c2ccccc2C1=O)c1nc2ccccc2n1C(F)F ZINC000548403650 941100021 /nfs/dbraw/zinc/10/00/21/941100021.db2.gz YZBKSMVTTCPHAU-CQSZACIVSA-N 0 3 412.440 4.158 20 0 HIADHN COc1cccc(C(=O)c2ccc(C(=O)Nc3cc(CN(C)C)ccc3OC)cc2)c1 ZINC000548689362 941119630 /nfs/dbraw/zinc/11/96/30/941119630.db2.gz XQIBSQAXPHCDGG-UHFFFAOYSA-N 0 3 418.493 4.249 20 0 HIADHN O=C(CN1CCN(CC2CCC(c3ccccc3)CC2)CC1)Nc1ccccc1F ZINC000548728100 941121879 /nfs/dbraw/zinc/12/18/79/941121879.db2.gz FDWVRWINKDEGDX-UHFFFAOYSA-N 0 3 409.549 4.356 20 0 HIADHN CCNC(=O)Nc1ccc(C)c(NC(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)c1 ZINC000548971615 941136272 /nfs/dbraw/zinc/13/62/72/941136272.db2.gz YYFIQFLRBVDIPE-LJQANCHMSA-N 0 3 417.941 4.214 20 0 HIADHN COc1ccc([C@@H](NC(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)C2CC2)cc1 ZINC000549104308 941159375 /nfs/dbraw/zinc/15/93/75/941159375.db2.gz RGZHAEUSJHRUNU-RTWAWAEBSA-N 0 3 401.938 4.402 20 0 HIADHN CC(C)(C)N1CC[C@H](NCc2cn3cccnc3n2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000549112773 941160989 /nfs/dbraw/zinc/16/09/89/941160989.db2.gz GMVWVVRGYWANIC-RBUKOAKNSA-N 0 3 401.917 4.226 20 0 HIADHN COc1cccc([C@@H]2[C@H](N[C@@H](C)C(=O)Nc3cc(C)ccc3C)CCN2C2CC2)c1 ZINC000549112195 941161047 /nfs/dbraw/zinc/16/10/47/941161047.db2.gz GOGPLBCMSBJCJW-KUWBRRTOSA-N 0 3 407.558 4.207 20 0 HIADHN Cc1cccc(NC(=O)CN[C@H]2CCN(C(C)C)[C@@H]2c2ccc(F)c(F)c2)c1C ZINC000549113892 941161212 /nfs/dbraw/zinc/16/12/12/941161212.db2.gz UBUCFWONJHCGMR-JTHBVZDNSA-N 0 3 401.501 4.334 20 0 HIADHN CC[C@H](C)Oc1cc(CNC(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)ccn1 ZINC000549122077 941162223 /nfs/dbraw/zinc/16/22/23/941162223.db2.gz FAHBMPMTQVGMTF-HNAYVOBHSA-N 0 3 404.942 4.014 20 0 HIADHN CC[C@H](C)C(=O)Nc1cccc(CNC[C@@H](O)COc2ccc3ccccc3c2)c1 ZINC000549159484 941167149 /nfs/dbraw/zinc/16/71/49/941167149.db2.gz VDWQSEYFUUQPOX-FDDCHVKYSA-N 0 3 406.526 4.354 20 0 HIADHN CCN1CC[C@H](N[C@H](C)C(=O)Nc2ccccc2OC)[C@H]1c1ccc(Cl)c(F)c1 ZINC000549475164 941194129 /nfs/dbraw/zinc/19/41/29/941194129.db2.gz CNWFHGZGOJKUDD-XWRIVVANSA-N 0 3 419.928 4.240 20 0 HIADHN CCN1CC[C@@H](NCc2cc(F)cc3c2OCOC3)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000549478595 941194756 /nfs/dbraw/zinc/19/47/56/941194756.db2.gz XGKNIAUBPUGTMU-UXHICEINSA-N 0 3 408.876 4.410 20 0 HIADHN CCN1CC[C@H](N[C@H](C)C(=O)N(C)C2CCCCC2)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000549482087 941195091 /nfs/dbraw/zinc/19/50/91/941195091.db2.gz KWOFZBCGQLELQP-RFVSGWPVSA-N 0 3 411.512 4.008 20 0 HIADHN Cc1nn(C(C)(C)C)cc1[C@H](C)NC(=O)N[C@@H](CN(C)C)c1ccc(Cl)cc1 ZINC000549493768 941196254 /nfs/dbraw/zinc/19/62/54/941196254.db2.gz VPUQAWSSVVRFBQ-LIRRHRJNSA-N 0 3 405.974 4.263 20 0 HIADHN COCCc1ccc(OC[C@@H](O)CN2CC=C(c3c[nH]c4cc(C)ccc43)CC2)cc1 ZINC000549509511 941197570 /nfs/dbraw/zinc/19/75/70/941197570.db2.gz SYWGDGZLZIEHDK-QFIPXVFZSA-N 0 3 420.553 4.194 20 0 HIADHN CCC[C@H]1CN(c2nnc(C3CCC3)n2C[C@H]2CCOC2)CCN1Cc1ccccc1 ZINC000549594391 941200686 /nfs/dbraw/zinc/20/06/86/941200686.db2.gz GNKTVQJFOWRRKD-GGAORHGYSA-N 0 3 423.605 4.073 20 0 HIADHN Cc1cc(NC(=O)c2ncsc2C(F)(F)F)cc(N2CCN(C(C)C)CC2)c1 ZINC000549757512 941206605 /nfs/dbraw/zinc/20/66/05/941206605.db2.gz AGVYIIWBOVKIIB-UHFFFAOYSA-N 0 3 412.481 4.253 20 0 HIADHN COc1ccc(C(=O)C2CCN(Cc3ccc(C)cc3-c3ccnn3C)CC2)cc1 ZINC000549787548 941207462 /nfs/dbraw/zinc/20/74/62/941207462.db2.gz RHRZOISBJUNSDY-UHFFFAOYSA-N 0 3 403.526 4.499 20 0 HIADHN CSc1ccc([C@@H](CNCc2cn3ccc(Br)cc3n2)N(C)C)cc1 ZINC000549935356 941242345 /nfs/dbraw/zinc/24/23/45/941242345.db2.gz AYFUBLLXJJFXGH-GOSISDBHSA-N 0 3 419.392 4.211 20 0 HIADHN CSc1ccc([C@H](CNCc2cn3ccc(Br)cc3n2)N(C)C)cc1 ZINC000549935357 941242581 /nfs/dbraw/zinc/24/25/81/941242581.db2.gz AYFUBLLXJJFXGH-SFHVURJKSA-N 0 3 419.392 4.211 20 0 HIADHN COc1ccc(-c2noc([C@H](C)N[C@H](C)C3CCN(CC(F)(F)F)CC3)n2)cc1 ZINC000550024224 941267522 /nfs/dbraw/zinc/26/75/22/941267522.db2.gz FKUJUYOVSSPFCG-KGLIPLIRSA-N 0 3 412.456 4.059 20 0 HIADHN CC(F)(F)c1ccc(CNCc2ccc(OCCN3CCOCC3)c(Cl)c2)cc1 ZINC000550227936 941301640 /nfs/dbraw/zinc/30/16/40/941301640.db2.gz MRVGVPNMUJHMSC-UHFFFAOYSA-N 0 3 424.919 4.453 20 0 HIADHN CCCOc1c(Cl)cc(CNCc2cccc(N3CCOCC3)c2)cc1OC ZINC000550226405 941301678 /nfs/dbraw/zinc/30/16/78/941301678.db2.gz NHTIIKLVYFLBKB-UHFFFAOYSA-N 0 3 404.938 4.264 20 0 HIADHN Fc1cccc(CC2(NCc3ccn(-c4c(F)cccc4F)n3)CCOCC2)c1 ZINC000550273837 941307750 /nfs/dbraw/zinc/30/77/50/941307750.db2.gz ODCJUHDHHIPXKO-UHFFFAOYSA-N 0 3 401.432 4.171 20 0 HIADHN CC[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)N(CCN(C)C)Cc1ccccn1 ZINC000550311250 941312990 /nfs/dbraw/zinc/31/29/90/941312990.db2.gz ONYSJLDQHRPUEH-SFHVURJKSA-N 0 3 407.480 4.260 20 0 HIADHN CC(=O)Nc1ccc(OC[C@H](O)CN2CCc3ccccc3[C@H]2c2ccccc2)cc1 ZINC000550344286 941317167 /nfs/dbraw/zinc/31/71/67/941317167.db2.gz BAPNEETZPAROET-ZEQKJWHPSA-N 0 3 416.521 4.032 20 0 HIADHN CC(C)[C@@]1(CO)CCCN([C@@H](C)C(=O)N[C@@H](C)c2ccc(Cl)cc2Cl)C1 ZINC000550433750 941326962 /nfs/dbraw/zinc/32/69/62/941326962.db2.gz UHACBEVSMMLGJY-AVYPCKFXSA-N 0 3 401.378 4.290 20 0 HIADHN CC[C@H](NCc1cc(Br)c2c(c1)OCCO2)c1ccc(C(=O)OC)cc1 ZINC000550629362 941347488 /nfs/dbraw/zinc/34/74/88/941347488.db2.gz QVKZSQJXGIBRJY-KRWDZBQOSA-N 0 3 420.303 4.248 20 0 HIADHN CN(C)[C@@H](CNC(=O)NC1(c2cccc(C(F)(F)F)c2)CC1)Cc1ccccc1 ZINC000550774298 941365611 /nfs/dbraw/zinc/36/56/11/941365611.db2.gz BZWFJOIJHXAIES-LJQANCHMSA-N 0 3 405.464 4.167 20 0 HIADHN CS(=O)(=O)C[C@H](NC[C@@H](OCc1ccccc1)c1ccc(Cl)cc1)C1CC1 ZINC000550822173 941371392 /nfs/dbraw/zinc/37/13/92/941371392.db2.gz FNZOFPJNWBTYIM-LEWJYISDSA-N 0 3 407.963 4.011 20 0 HIADHN Brc1ccc2c(c1)OCCC[C@H]2NCc1cccc(N2CCOCC2)c1 ZINC000550857113 941375033 /nfs/dbraw/zinc/37/50/33/941375033.db2.gz OAKGKRQNGFFIQP-HXUWFJFHSA-N 0 3 417.347 4.289 20 0 HIADHN NS(=O)(=O)c1ccc2c(c1)CCC[C@@H]2N[C@H]1CCSc2ccc(Cl)cc21 ZINC000551015035 941395228 /nfs/dbraw/zinc/39/52/28/941395228.db2.gz TWMYEMGVXZUZFO-ROUUACIJSA-N 0 3 408.976 4.192 20 0 HIADHN NS(=O)(=O)c1ccc2c(c1)CCC[C@H]2N[C@@H]1CCSc2ccc(Cl)cc21 ZINC000551015034 941395411 /nfs/dbraw/zinc/39/54/11/941395411.db2.gz TWMYEMGVXZUZFO-QZTJIDSGSA-N 0 3 408.976 4.192 20 0 HIADHN CC(C)(CN[C@H](c1nnc[nH]1)c1ccc(F)cc1)c1ccccc1Br ZINC000551085680 941406925 /nfs/dbraw/zinc/40/69/25/941406925.db2.gz FRUDEJMHWOFQHB-KRWDZBQOSA-N 0 3 403.299 4.363 20 0 HIADHN CN(C(=O)c1ccc(NCc2cc(Cl)cc3c2OCC3)cc1)[C@H]1CCCN(C)C1 ZINC000551089382 941407902 /nfs/dbraw/zinc/40/79/02/941407902.db2.gz FGZSYMPFKSVDMU-NRFANRHFSA-N 0 3 413.949 4.053 20 0 HIADHN CN(C)CCN(C(=O)C1CCN(c2noc3ccc(Cl)cc32)CC1)C1CCCC1 ZINC000551099236 941409266 /nfs/dbraw/zinc/40/92/66/941409266.db2.gz GXDZVAFKQLTBHX-UHFFFAOYSA-N 0 3 418.969 4.030 20 0 HIADHN CN1CC[C@H](NCC(=O)Nc2ccc(Br)cc2Cl)[C@@H]1c1ccccc1 ZINC000551098009 941409292 /nfs/dbraw/zinc/40/92/92/941409292.db2.gz UYBNMNARSSSTFX-HKUYNNGSSA-N 0 3 422.754 4.076 20 0 HIADHN CC[C@H](Cn1cncn1)N[C@H](c1ccc(OC)cc1)c1ccc(C(F)(F)F)cc1 ZINC000551293218 941445088 /nfs/dbraw/zinc/44/50/88/941445088.db2.gz AXLSLZSUFXVEDE-QUCCMNQESA-N 0 3 404.436 4.463 20 0 HIADHN C[C@H](N[C@@H]1CCC(=O)N[C@@H]1C1CC1)c1nc2cc(Cl)ccc2n1Cc1ccccc1 ZINC000551368805 941463161 /nfs/dbraw/zinc/46/31/61/941463161.db2.gz RBIWTSPXVSBADE-FCORRRHLSA-N 0 3 422.960 4.446 20 0 HIADHN OC1(Cc2ccc(F)cc2F)C[C@H]2CC[C@@H](C1)N2Cc1ccc(C(F)(F)F)cn1 ZINC000551396347 941468982 /nfs/dbraw/zinc/46/89/82/941468982.db2.gz ZXLASCZDHZGANR-UFRUDQCGSA-N 0 3 412.402 4.479 20 0 HIADHN COC(=O)[C@H](Cc1ccccc1)[C@@H](C)N[C@H](C)C(=O)Nc1c(C)cccc1C(C)C ZINC000551420398 941475365 /nfs/dbraw/zinc/47/53/65/941475365.db2.gz ZDVUCKTZOPYDFC-WOIUINJBSA-N 0 3 410.558 4.455 20 0 HIADHN COc1ncc([C@@H](C)N[C@H](C)c2cc(F)ccc2N2CCN(C)CC2)cc1Cl ZINC000551530207 941496025 /nfs/dbraw/zinc/49/60/25/941496025.db2.gz OZEOGWWUDOGIOW-HUUCEWRRSA-N 0 3 406.933 4.046 20 0 HIADHN CC(C)Oc1ccc([C@@H](C)NCc2ccc([C@@]3(C)NC(=O)NC3=O)cc2)cc1Cl ZINC000551533275 941496438 /nfs/dbraw/zinc/49/64/38/941496438.db2.gz JUQZTEFOWNWNHB-JLCFBVMHSA-N 0 3 415.921 4.033 20 0 HIADHN CC[C@H](N[C@@H](C)c1cnc(OC)c(Cl)c1)[C@H]1CN(Cc2ccccc2)CCO1 ZINC000551533696 941496669 /nfs/dbraw/zinc/49/66/69/941496669.db2.gz NBALLTAVYLZHRO-ORYQWCPZSA-N 0 3 403.954 4.074 20 0 HIADHN COc1ccc(CCNCc2c(F)cccc2OC(F)(F)F)c(OC)c1OC ZINC000551536731 941497104 /nfs/dbraw/zinc/49/71/04/941497104.db2.gz RTAVABFMSCQIER-UHFFFAOYSA-N 0 3 403.372 4.082 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)[C@H](C)c2ccc(Br)s2)cc1 ZINC000551540204 941498209 /nfs/dbraw/zinc/49/82/09/941498209.db2.gz CUQNEFLHGQNDHO-IUODEOHRSA-N 0 3 411.365 4.042 20 0 HIADHN C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000551641371 941517061 /nfs/dbraw/zinc/51/70/61/941517061.db2.gz YBFKUUWSPOZXSZ-BDJLRTHQSA-N 0 3 423.401 4.348 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)[C@H]1CCCc2cccnc21 ZINC000551646388 941517943 /nfs/dbraw/zinc/51/79/43/941517943.db2.gz NKTJLRXAQHGUOF-VXKWHMMOSA-N 0 3 415.541 4.092 20 0 HIADHN CN(C)Cc1ccccc1NC(=O)c1cc(C(=O)OC(C)(C)C)n(-c2ccccc2)n1 ZINC000551715795 941532193 /nfs/dbraw/zinc/53/21/93/941532193.db2.gz NQBSSCRKVMLBTB-UHFFFAOYSA-N 0 3 420.513 4.142 20 0 HIADHN Cc1ccc(-n2cc(CN3CCC[C@]4(CNC(=O)C4)C3)c(-c3ccc(F)cc3)n2)cc1 ZINC000551802307 941548162 /nfs/dbraw/zinc/54/81/62/941548162.db2.gz CSTIICLRYVYSIK-VWLOTQADSA-N 0 3 418.516 4.089 20 0 HIADHN CCc1cc(OC)ccc1CN1CCC(OC)(c2nc(Cc3ccccc3)no2)CC1 ZINC000551814497 941550830 /nfs/dbraw/zinc/55/08/30/941550830.db2.gz QSHDXDQNLVAXEB-UHFFFAOYSA-N 0 3 421.541 4.369 20 0 HIADHN CC1(C)C[C@H](NCc2cccc(N3C(=O)N[C@](C)(C4CC4)C3=O)c2)c2ccccc21 ZINC000551818095 941552202 /nfs/dbraw/zinc/55/22/02/941552202.db2.gz SYDQPQQAZQBMAQ-SQJMNOBHSA-N 0 3 403.526 4.424 20 0 HIADHN Brc1cnn(CCN[C@@H]2CCSc3ccc(Br)cc32)c1 ZINC000552098697 941584854 /nfs/dbraw/zinc/58/48/54/941584854.db2.gz LTSAPXUJDAOAAD-CYBMUJFWSA-N 0 3 417.170 4.235 20 0 HIADHN OCc1cn([C@@H]2CCCN(Cc3ccc(-c4ccc(C(F)(F)F)cc4)s3)C2)nn1 ZINC000552111335 941586690 /nfs/dbraw/zinc/58/66/90/941586690.db2.gz XRNUPGSNZCHWRR-QGZVFWFLSA-N 0 3 422.476 4.355 20 0 HIADHN CN(CCCN(C)C(=O)CCc1ccc(-c2ccccc2F)o1)Cc1ccncc1 ZINC000552112348 941587422 /nfs/dbraw/zinc/58/74/22/941587422.db2.gz ZUBCYPOLPJPIPM-UHFFFAOYSA-N 0 3 409.505 4.394 20 0 HIADHN O=C(CCCOc1ccc(Cl)cc1Cl)Nc1cccc(CN2CC[C@@H](O)C2)c1 ZINC000552199642 941600567 /nfs/dbraw/zinc/60/05/67/941600567.db2.gz CAIMXZDWHXPBMW-GOSISDBHSA-N 0 3 423.340 4.358 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)c1csc(-c2ccc(Cl)cc2)n1 ZINC000552200479 941601041 /nfs/dbraw/zinc/60/10/41/941601041.db2.gz FUCKKNQBBCUADB-SFHVURJKSA-N 0 3 413.930 4.282 20 0 HIADHN CC[C@H](N[C@@H](C)c1ccc(S(=O)(=O)NC)cc1)c1ccc(OC(F)(F)F)cc1 ZINC000552250104 941614206 /nfs/dbraw/zinc/61/42/06/941614206.db2.gz VCPOFDPEEODDLP-UGSOOPFHSA-N 0 3 416.465 4.295 20 0 HIADHN CO[C@@H]1C[C@@H](c2ccccc2)CC[C@H]1NCC(=O)Nc1ccc(OC(F)F)cc1 ZINC000552268237 941618418 /nfs/dbraw/zinc/61/84/18/941618418.db2.gz BJLVYVMTGSXGEB-PWIZWCRZSA-N 0 3 404.457 4.167 20 0 HIADHN COc1cc([C@H](C)NCCn2ccc3cc(Cl)ccc32)ccc1S(C)(=O)=O ZINC000552317373 941630063 /nfs/dbraw/zinc/63/00/63/941630063.db2.gz ABGOCHCPVKVQIY-AWEZNQCLSA-N 0 3 406.935 4.058 20 0 HIADHN COc1ccc(NC(=O)C[C@H](C)N[C@H](CCO)c2ccc(Cl)c(Cl)c2)cc1 ZINC000552342615 941638827 /nfs/dbraw/zinc/63/88/27/941638827.db2.gz PTWRPPDAUUYKQT-ORAYPTAESA-N 0 3 411.329 4.432 20 0 HIADHN CCC(C)(C)C1CCC2(C[C@H]2C(=O)N2CC[C@@H](N3CCN(C(C)C)CC3)C2)CC1 ZINC000552354569 941642620 /nfs/dbraw/zinc/64/26/20/941642620.db2.gz JNJNIWLZWTXRKW-LQDNNDEMSA-N 0 3 403.655 4.246 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)Nc1cnn(C(C)(C)C)c1 ZINC000552508813 941691060 /nfs/dbraw/zinc/69/10/60/941691060.db2.gz HNFGXMISQLVHOF-UHFFFAOYSA-N 0 3 411.472 4.253 20 0 HIADHN Cc1cc(C(=O)CCC(=O)N2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)c(C)s1 ZINC000552678893 941735765 /nfs/dbraw/zinc/73/57/65/941735765.db2.gz HPSQHDSIGVMKFR-XMMPIXPASA-N 0 3 410.583 4.452 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c2sc(C(=O)N3C[C@@H](N4CCCC4)C[C@H]3C)cc12 ZINC000552680317 941736390 /nfs/dbraw/zinc/73/63/90/941736390.db2.gz OMTBVUZWSLWDNV-KDOFPFPSSA-N 0 3 412.534 4.233 20 0 HIADHN Cc1ccc(C)c(C(=O)CCC(=O)N2CC[C@]3(CCN(Cc4ccccc4)C3)C2)c1 ZINC000552684853 941737333 /nfs/dbraw/zinc/73/73/33/941737333.db2.gz WCYAGYLTEDTMSG-SANMLTNESA-N 0 3 404.554 4.391 20 0 HIADHN Cc1cc2ncc([C@H](C)N[C@@H](C)c3ccc(NC(=O)c4ccncc4)cc3)c(C)n2n1 ZINC000552866356 941792945 /nfs/dbraw/zinc/79/29/45/941792945.db2.gz ZGUUOTULACDHGK-IRXDYDNUSA-N 0 3 414.513 4.405 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccc(F)c2)C1)N1C[C@H](c2ccccc2)[C@H]2COCC[C@@H]21 ZINC000553040810 941822861 /nfs/dbraw/zinc/82/28/61/941822861.db2.gz OOGLYGKMTHLDMA-DFXJHMEVSA-N 0 3 422.544 4.069 20 0 HIADHN O=C(CCN[C@@H]1CCSc2c(F)cccc21)Nc1ccc(N2CCCC2=O)cc1 ZINC000553061059 941826540 /nfs/dbraw/zinc/82/65/40/941826540.db2.gz RPWJIJFYCMKSCZ-LJQANCHMSA-N 0 3 413.518 4.108 20 0 HIADHN C[C@@H](Cc1ccc(Cl)cc1)C(=O)N1CCC[C@@H](c2n[nH]cc2CN2CCCC2)C1 ZINC000553180638 941845128 /nfs/dbraw/zinc/84/51/28/941845128.db2.gz CRKJNBUYLOOPQS-PKOBYXMFSA-N 0 3 414.981 4.244 20 0 HIADHN CO[C@@H]1CCCC[C@@H]1C(=O)N(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000553196239 941847526 /nfs/dbraw/zinc/84/75/26/941847526.db2.gz GWMAEPOTRHNFKA-CCDWMCETSA-N 0 3 421.585 4.280 20 0 HIADHN O=C(c1cccc(O)c1)N(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000553197278 941847744 /nfs/dbraw/zinc/84/77/44/941847744.db2.gz CPTWKYHLIAOQBA-QHCPKHFHSA-N 0 3 401.510 4.094 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)Nc2cccc(Cl)c2OCCOC)N(C)C)cc1 ZINC000553238340 941854796 /nfs/dbraw/zinc/85/47/96/941854796.db2.gz BTTPJMXYCYZLON-HXUWFJFHSA-N 0 3 419.953 4.352 20 0 HIADHN Cc1cc(Cl)ccc1NC(=O)[C@@H](C)N[C@@H](c1ccc2c(c1)OCCO2)C1CC1 ZINC000553315089 941866440 /nfs/dbraw/zinc/86/64/40/941866440.db2.gz PAZCEMRBSIYJJB-SPLOXXLWSA-N 0 3 400.906 4.488 20 0 HIADHN CC[C@H](NC(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1)c1ccc(OC)c(OC)c1 ZINC000553485008 941893842 /nfs/dbraw/zinc/89/38/42/941893842.db2.gz REXXDQZRQFCRBT-YYWHXJBOSA-N 0 3 411.546 4.290 20 0 HIADHN Cc1cc2cc(C(=O)N3CCN(C4CCC4)C[C@H](C)C3)oc2c(Br)c1 ZINC000553524372 941902609 /nfs/dbraw/zinc/90/26/09/941902609.db2.gz INCOYAIAJLUNLL-AWEZNQCLSA-N 0 3 405.336 4.450 20 0 HIADHN C[C@H](Sc1ccc(Br)cc1)C(=O)N1CCN(C2CCC2)C[C@@H](C)C1 ZINC000553525743 941902922 /nfs/dbraw/zinc/90/29/22/941902922.db2.gz IKGIWYOPLGVXNM-CABCVRRESA-N 0 3 411.409 4.263 20 0 HIADHN C[C@@H](Sc1ccc(Br)cc1)C(=O)N1CCN(C2CCC2)C[C@@H](C)C1 ZINC000553525746 941903218 /nfs/dbraw/zinc/90/32/18/941903218.db2.gz IKGIWYOPLGVXNM-HUUCEWRRSA-N 0 3 411.409 4.263 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)N[C@H](C)Cc1c(C)noc1C)c1ccc(Cl)cc1 ZINC000553582457 941914370 /nfs/dbraw/zinc/91/43/70/941914370.db2.gz VQYPOBHYZJISEO-VLIAUNLRSA-N 0 3 406.958 4.258 20 0 HIADHN Cc1nn(-c2ccccc2)cc1C(=O)NC[C@@H](c1ccc(OC(C)C)cc1)N(C)C ZINC000553670777 941941298 /nfs/dbraw/zinc/94/12/98/941941298.db2.gz NFZHHFNSEBSAGC-QHCPKHFHSA-N 0 3 406.530 4.001 20 0 HIADHN C[C@H]1C[C@@H]1N1CCN(C(=O)c2cc(NC(=O)NC(C)(C)C)ccc2Cl)C[C@@H](C)C1 ZINC000553767778 941963388 /nfs/dbraw/zinc/96/33/88/941963388.db2.gz JYARFPZWTDGSRN-DOXZYTNZSA-N 0 3 420.985 4.062 20 0 HIADHN CCN1CCN(CCC(=O)N[C@@H](c2ccccc2)c2ccc3ccccc3c2)CC1 ZINC000553786491 941968209 /nfs/dbraw/zinc/96/82/09/941968209.db2.gz JKBCGHYYXUPYKX-SANMLTNESA-N 0 3 401.554 4.073 20 0 HIADHN CN(Cc1ccc(OCC(F)(F)F)cc1)C(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000553990304 942014093 /nfs/dbraw/zinc/01/40/93/942014093.db2.gz XCQYAWMYJZMITF-PMACEKPBSA-N 0 3 421.463 4.215 20 0 HIADHN COC1(CN[C@H](C)CS(=O)(=O)c2ccccc2)CCC(c2ccccc2)CC1 ZINC000554087025 942033933 /nfs/dbraw/zinc/03/39/33/942033933.db2.gz SSYUXVNEVVBVRI-VWRAKTAISA-N 0 3 401.572 4.181 20 0 HIADHN CCc1nc(-c2ccc(Cl)cc2)[nH]c1C(=O)N1CCN([C@@H]2C[C@@H]2C)C[C@H](C)C1 ZINC000554113346 942039452 /nfs/dbraw/zinc/03/94/52/942039452.db2.gz MMESCRWTMJPGGS-YZVOILCLSA-N 0 3 400.954 4.095 20 0 HIADHN C[C@@H](NCc1ccc2c(c1)OCCO2)c1ccc(OC[C@H]2CCCCO2)c(F)c1 ZINC000554114833 942040270 /nfs/dbraw/zinc/04/02/70/942040270.db2.gz QMKIWABSVVADOP-VQIMIIECSA-N 0 3 401.478 4.396 20 0 HIADHN CCCOc1ccc(-c2nc(C(=O)N3CCN([C@@H]4C[C@@H]4C)C[C@H](C)C3)cs2)cc1 ZINC000554128230 942043461 /nfs/dbraw/zinc/04/34/61/942043461.db2.gz FRSMEMJDLLYLDR-XGHQBKJUSA-N 0 3 413.587 4.401 20 0 HIADHN CN(CCCN(C)C(=O)Nc1cccc(OCc2cccnc2)c1)Cc1ccco1 ZINC000554131426 942045085 /nfs/dbraw/zinc/04/50/85/942045085.db2.gz GDERANPTUJJWIJ-UHFFFAOYSA-N 0 3 408.502 4.239 20 0 HIADHN C[C@@H](NC(=O)Nc1cccc(OCc2cccnc2)c1)[C@H](c1ccccc1)N(C)C ZINC000554138131 942046877 /nfs/dbraw/zinc/04/68/77/942046877.db2.gz JNBWCPULSPOHNK-WZONZLPQSA-N 0 3 404.514 4.474 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1ccccc1N1C[C@@H](C)O[C@@H](C)C1)c1ccco1 ZINC000554150048 942050957 /nfs/dbraw/zinc/05/09/57/942050957.db2.gz HFXGCRBVKBYPFW-GNBUJSLZSA-N 0 3 414.550 4.144 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)Nc2cccc(-c3nccn3C)c2)N(C)C)cc1 ZINC000554181667 942059590 /nfs/dbraw/zinc/05/95/90/942059590.db2.gz BULXPBIDJLXCMI-JOCHJYFZSA-N 0 3 421.545 4.299 20 0 HIADHN C[C@@H]1Oc2cc(F)ccc2[C@H]1NC(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000554183500 942061040 /nfs/dbraw/zinc/06/10/40/942061040.db2.gz YBZBLUYUSMHUFD-BTYIYWSLSA-N 0 3 415.534 4.061 20 0 HIADHN CCCN(C)[C@H](CNC(=O)N1CCC([C@@H]2CCCO2)CC1)c1ccc(Cl)cc1 ZINC000554248978 942078292 /nfs/dbraw/zinc/07/82/92/942078292.db2.gz AORSBMXBIKZFGT-RTWAWAEBSA-N 0 3 407.986 4.324 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)Nc2ccc(OC(F)F)cc2)N(C)C)cc1 ZINC000554349565 942109663 /nfs/dbraw/zinc/10/96/63/942109663.db2.gz WIHFOLRPNDGCEU-LJQANCHMSA-N 0 3 407.461 4.500 20 0 HIADHN O=C(CCC(F)(F)F)N1CCC[C@@H](N[C@@H]2CCCOc3c(Cl)cccc32)C1 ZINC000554376077 942117674 /nfs/dbraw/zinc/11/76/74/942117674.db2.gz DWDWZZMNVFFHLD-CZUORRHYSA-N 0 3 404.860 4.477 20 0 HIADHN C[C@@H](NC(=O)Nc1nc(CN2CCC[C@@H](C)C2)cs1)[C@H](c1ccccc1)N(C)C ZINC000554385605 942121653 /nfs/dbraw/zinc/12/16/53/942121653.db2.gz FNQJGNQRNCBJIP-MBOZVWFJSA-N 0 3 415.607 4.188 20 0 HIADHN CCCC(=O)Nc1cccc(NC(=O)N[C@H](CN(C)C)c2ccc(F)cc2)c1C ZINC000554411920 942132431 /nfs/dbraw/zinc/13/24/31/942132431.db2.gz DUHGRWWBQXNRKT-HXUWFJFHSA-N 0 3 400.498 4.297 20 0 HIADHN Cc1cc(Oc2ncccn2)ccc1NC(=O)N[C@@H](CN(C)C)c1ccc(F)cc1 ZINC000554415515 942133899 /nfs/dbraw/zinc/13/38/99/942133899.db2.gz PPNQWURLDFAREU-FQEVSTJZSA-N 0 3 409.465 4.141 20 0 HIADHN C[C@H](NC(=O)Nc1cccc(C(=O)N2CCCCC2)c1)[C@@H](c1ccccc1)N(C)C ZINC000554418784 942134461 /nfs/dbraw/zinc/13/44/61/942134461.db2.gz FZWPQXITOWBLOU-AVRDEDQJSA-N 0 3 408.546 4.126 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)Nc1ccccc1OC[C@H]1CCCCO1 ZINC000554426159 942138545 /nfs/dbraw/zinc/13/85/45/942138545.db2.gz GYFNYLIADPFARE-HXUWFJFHSA-N 0 3 403.567 4.364 20 0 HIADHN Cc1c(NC(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)cccc1C(=O)N1CCCC1 ZINC000554427968 942140466 /nfs/dbraw/zinc/14/04/66/942140466.db2.gz GEXMQGDKVZTTMB-PGRDOPGGSA-N 0 3 408.546 4.044 20 0 HIADHN CN(CCCN(C)C(=O)Nc1c(F)cc(Br)cc1F)Cc1ccco1 ZINC000554479579 942157220 /nfs/dbraw/zinc/15/72/20/942157220.db2.gz OYCRKTBBIRWVGQ-UHFFFAOYSA-N 0 3 416.266 4.306 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)c1ccc2c(c1)[nH]c(=O)n2C1CCCC1)c1ccco1 ZINC000554633954 942181185 /nfs/dbraw/zinc/18/11/85/942181185.db2.gz HYIBRCXAFGGVTM-DNVCBOLYSA-N 0 3 410.518 4.309 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)c1ccc2c(c1)[nH]c(=O)n2C1CCCC1)c1ccco1 ZINC000554633953 942181198 /nfs/dbraw/zinc/18/11/98/942181198.db2.gz HYIBRCXAFGGVTM-BEFAXECRSA-N 0 3 410.518 4.309 20 0 HIADHN Cn1cc(C(F)(F)F)nc1[C@H]1CCCN(Cc2cnc(-c3ccncc3)s2)C1 ZINC000554863230 942298268 /nfs/dbraw/zinc/29/82/68/942298268.db2.gz CLGBTKXCJUMLAR-AWEZNQCLSA-N 0 3 407.465 4.337 20 0 HIADHN CC(C)CCOc1ccc(CN2CCC[C@H](CNC(=O)CC(F)(F)F)C2)cc1 ZINC000554871886 942302767 /nfs/dbraw/zinc/30/27/67/942302767.db2.gz NVTGFOAGEOHMDT-GOSISDBHSA-N 0 3 400.485 4.392 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1ncc(C(F)(F)F)s1)c1cccc(OC)c1 ZINC000554942570 942327358 /nfs/dbraw/zinc/32/73/58/942327358.db2.gz ISZAGHDDPHFLBO-AWEZNQCLSA-N 0 3 416.469 4.375 20 0 HIADHN CCN(Cc1nc(-c2ccc(OC(F)F)c(OC)c2)no1)[C@@H]1CCOC(C)(C)C1 ZINC000554951938 942330467 /nfs/dbraw/zinc/33/04/67/942330467.db2.gz DWSAALPUCKSWKR-CQSZACIVSA-N 0 3 411.449 4.126 20 0 HIADHN CSc1ccc(NC(=O)CN[C@@H]2CCN(C)[C@@H]2c2ccc(Cl)c(F)c2)cc1 ZINC000554954275 942332154 /nfs/dbraw/zinc/33/21/54/942332154.db2.gz MLVUJESELJDHMC-UYAOXDASSA-N 0 3 407.942 4.175 20 0 HIADHN O=C(CCN1CC[C@H](n2cc(Cl)cn2)C1)N[C@@H](c1cccs1)c1ccccc1 ZINC000554959106 942333979 /nfs/dbraw/zinc/33/39/79/942333979.db2.gz BIVZDISUYQRZAO-GHTZIAJQSA-N 0 3 414.962 4.141 20 0 HIADHN CC(C)[C@@H](NC(=O)CN[C@@H]1c2ccccc2CC12CCOCC2)c1ccc(F)cc1 ZINC000554972578 942338383 /nfs/dbraw/zinc/33/83/83/942338383.db2.gz LHEDFBKIFXQTCJ-DNQXCXABSA-N 0 3 410.533 4.323 20 0 HIADHN COc1ccc(C[C@@](C)(O)CNCc2cc(Cl)cc(Cl)c2OC)cc1OC ZINC000554980509 942341892 /nfs/dbraw/zinc/34/18/92/942341892.db2.gz FEMVBUWMCVHDFI-HXUWFJFHSA-N 0 3 414.329 4.103 20 0 HIADHN C[C@H](NC[C@@H](Cc1ccccc1)C(F)(F)F)c1cccc(NS(C)(=O)=O)c1 ZINC000555002975 942351041 /nfs/dbraw/zinc/35/10/41/942351041.db2.gz LNDGUPGNPNHOFN-WMLDXEAASA-N 0 3 400.466 4.130 20 0 HIADHN CC(C)N1CC[C@@H](NCc2cn(C)nc2C(F)F)[C@H]1c1ccc(Cl)c(F)c1 ZINC000555004678 942352064 /nfs/dbraw/zinc/35/20/64/942352064.db2.gz QKFZVILWVMQCEG-SJLPKXTDSA-N 0 3 400.876 4.464 20 0 HIADHN Cc1nc(C(F)(F)F)ccc1NC(=O)N[C@H](CN(C)C)c1ccc(Cl)cc1 ZINC000555027218 942361911 /nfs/dbraw/zinc/36/19/11/942361911.db2.gz UIJHYWZPCXXUCE-OAHLLOKOSA-N 0 3 400.832 4.487 20 0 HIADHN COc1cccc([C@@H]2[C@H](N[C@@H](C)C(=O)N[C@H](C)c3ccccc3C)CCN2C2CC2)c1 ZINC000555125261 942392950 /nfs/dbraw/zinc/39/29/50/942392950.db2.gz GEMATNCGJXIHNQ-APTYZTEPSA-N 0 3 421.585 4.137 20 0 HIADHN COc1cccc([C@@H]2[C@@H](N[C@@H](C)C(=O)Nc3ccc(C)c(F)c3)CCN2C2CC2)c1 ZINC000555126509 942393587 /nfs/dbraw/zinc/39/35/87/942393587.db2.gz WZYLKWKZPQFZNH-IRBZQWRBSA-N 0 3 411.521 4.037 20 0 HIADHN COc1cccc([C@H]2[C@H](NCc3nc4cc(Cl)ccc4c(=O)[nH]3)CCN2C2CC2)c1 ZINC000555130430 942395672 /nfs/dbraw/zinc/39/56/72/942395672.db2.gz TVDVLGBXTRCNLR-KNQAVFIVSA-N 0 3 424.932 4.065 20 0 HIADHN COc1cccc([C@@H]2[C@H](NCC(=O)Nc3cc(Cl)ccc3C)CCN2C2CC2)c1 ZINC000555133532 942397310 /nfs/dbraw/zinc/39/73/10/942397310.db2.gz UJMIIZZRPYSOSV-NFBKMPQASA-N 0 3 413.949 4.163 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@@H](N[C@@H](CN2CCCC2=O)c2ccccc2)c2ccccc21 ZINC000555170242 942414248 /nfs/dbraw/zinc/41/42/48/942414248.db2.gz SOTORMKPMJRZIA-ZLNRFVROSA-N 0 3 406.526 4.122 20 0 HIADHN CN(C)C[C@H](NC(=O)c1cc(N2CCCC2=O)ccc1Cl)c1ccc(Cl)cc1 ZINC000555229900 942437761 /nfs/dbraw/zinc/43/77/61/942437761.db2.gz QIRIWHRNDZHWFQ-IBGZPJMESA-N 0 3 420.340 4.153 20 0 HIADHN CN(C)C[C@@H](NC(=O)c1ccc(NC(=O)N(C)C)cc1Cl)c1ccc(Cl)cc1 ZINC000555231132 942438660 /nfs/dbraw/zinc/43/86/60/942438660.db2.gz VCXKXKMRAUMANZ-GOSISDBHSA-N 0 3 423.344 4.120 20 0 HIADHN Cc1cccc(C)c1CS(=O)(=O)N(C)[C@H]1CCN(Cc2ccccc2)[C@@H](C)C1 ZINC000555317090 942474021 /nfs/dbraw/zinc/47/40/21/942474021.db2.gz MXLQRSWPOFVWSR-UNMCSNQZSA-N 0 3 400.588 4.118 20 0 HIADHN FC(F)(F)[C@@H]1CCN(Cc2c[nH]nc2-c2ccc3c(c2)OCCO3)CC12CCC2 ZINC000555348800 942487381 /nfs/dbraw/zinc/48/73/81/942487381.db2.gz IPEMAWVOABKRLX-GOSISDBHSA-N 0 3 407.436 4.402 20 0 HIADHN CC(C)Cn1c(Cn2ccc3ccccc32)nnc1N1CCN(C2CCCC2)CC1 ZINC000555356085 942491758 /nfs/dbraw/zinc/49/17/58/942491758.db2.gz CTORZPPAMUZVAX-UHFFFAOYSA-N 0 3 406.578 4.002 20 0 HIADHN CC(C)C1CCC(N2CCN([C@H]3CCN([C@@H](C)c4ccc(F)cc4)C3=O)CC2)CC1 ZINC000555379621 942504358 /nfs/dbraw/zinc/50/43/58/942504358.db2.gz BEHCLAIHUFWORZ-IGTSAWRXSA-N 0 3 415.597 4.320 20 0 HIADHN CC1CCN([C@@H](CNC(=O)c2ccc3c(c2)NC(=O)C3(C)C)c2ccccc2)CC1 ZINC000555422420 942525904 /nfs/dbraw/zinc/52/59/04/942525904.db2.gz ZMLUDVIMXBEHJC-QFIPXVFZSA-N 0 3 405.542 4.119 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)NCc1cccc(C(F)(F)F)c1 ZINC000555589258 942658184 /nfs/dbraw/zinc/65/81/84/942658184.db2.gz VQSAMPISXMGBGJ-UHFFFAOYSA-N 0 3 415.406 4.257 20 0 HIADHN C[C@H](c1ccccc1F)N1CCC[C@H](NCc2ccc(Oc3cnccn3)cc2)C1=O ZINC000555607168 942667588 /nfs/dbraw/zinc/66/75/88/942667588.db2.gz WTRSPRYFRHBOOY-VGSWGCGISA-N 0 3 420.488 4.250 20 0 HIADHN O=C([C@@H](NC1(Cc2cccc(F)c2)CCOCC1)c1ccccc1)N1CCCCC1 ZINC000555618051 942672105 /nfs/dbraw/zinc/67/21/05/942672105.db2.gz DYTYZWDRTZIEFW-QHCPKHFHSA-N 0 3 410.533 4.261 20 0 HIADHN C[C@H](Cc1cnc2ccccc2n1)C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000555618848 942674622 /nfs/dbraw/zinc/67/46/22/942674622.db2.gz ZIMURATWJIMRGK-GOSISDBHSA-N 0 3 420.582 4.038 20 0 HIADHN COc1ccccc1NC(=O)c1ccc(NC(=O)[C@@H](C)N2CC[C@H](CC3CC3)C2)cc1 ZINC000555704397 942705907 /nfs/dbraw/zinc/70/59/07/942705907.db2.gz BAEFPHIMDKNARK-IEBWSBKVSA-N 0 3 421.541 4.397 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)[C@H]1CCc2cccc(O)c21 ZINC000555789390 942733790 /nfs/dbraw/zinc/73/37/90/942733790.db2.gz NJYPALBBLQKBMQ-SFHVURJKSA-N 0 3 406.448 4.031 20 0 HIADHN COC[C@H](NC(=O)N(CCN(C)C)Cc1ccc(C(F)(F)F)cc1)c1ccccc1 ZINC000555802794 942737973 /nfs/dbraw/zinc/73/79/73/942737973.db2.gz SJENBROWUOXQSS-FQEVSTJZSA-N 0 3 423.479 4.166 20 0 HIADHN CCN1CCCC[C@@H]1CNC(=O)C(C)(C)c1csc(-c2c(F)cccc2F)n1 ZINC000556026502 942788086 /nfs/dbraw/zinc/78/80/86/942788086.db2.gz DVRFBFHKTYZKAU-CQSZACIVSA-N 0 3 407.530 4.357 20 0 HIADHN Cc1ccc(Cl)cc1NC(=O)[C@H](C)N[C@H]1CCN(C)[C@@H]1c1ccc(F)c(F)c1 ZINC000556103331 942805812 /nfs/dbraw/zinc/80/58/12/942805812.db2.gz MREODEGKMNJTRZ-YHJVDBJQSA-N 0 3 407.892 4.289 20 0 HIADHN Cc1ccc(Cl)cc1NC(=O)[C@H](C)N[C@@H]1CCN(C)[C@H]1c1ccc(F)c(F)c1 ZINC000556103330 942805928 /nfs/dbraw/zinc/80/59/28/942805928.db2.gz MREODEGKMNJTRZ-VIZZQPHQSA-N 0 3 407.892 4.289 20 0 HIADHN CN1CC[C@H](CN[C@H](c2cccs2)c2nc[nH]n2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000556118949 942807413 /nfs/dbraw/zinc/80/74/13/942807413.db2.gz NRDMIHCFUCFRAJ-XWIAVFTESA-N 0 3 405.930 4.031 20 0 HIADHN CCCN(Cc1cccc(C(=O)NCc2ccco2)c1)C[C@H]1COc2ccccc2O1 ZINC000556207308 942819125 /nfs/dbraw/zinc/81/91/25/942819125.db2.gz RHDGMKSQMGGUQL-QFIPXVFZSA-N 0 3 420.509 4.262 20 0 HIADHN CS(=O)(=O)[C@@H]1CCC[C@H](N[C@@H](c2ccccc2)c2ccc(Br)cc2)C1 ZINC000556263952 942828020 /nfs/dbraw/zinc/82/80/20/942828020.db2.gz IGXXNIFUKUGDNC-ZCNNSNEGSA-N 0 3 422.388 4.484 20 0 HIADHN Cc1cccc(C)c1OC[C@H](N[C@H]1CCC[C@@H](S(C)(=O)=O)C1)c1ccccc1 ZINC000556263039 942828132 /nfs/dbraw/zinc/82/81/32/942828132.db2.gz XAUAYFMMBZVNCN-BDTNDASRSA-N 0 3 401.572 4.369 20 0 HIADHN Cc1sc(C2(NC3CCN(C(=O)N(C)C)CC3)CCC2)nc1-c1ccccc1F ZINC000556269872 942830024 /nfs/dbraw/zinc/83/00/24/942830024.db2.gz ZSMRTVNWCDZNQN-UHFFFAOYSA-N 0 3 416.566 4.372 20 0 HIADHN CS[C@@H]1CN(C(=O)c2ccccc2-c2ncc(-c3ccccc3)o2)C[C@@H]1N(C)C ZINC000556279538 942831741 /nfs/dbraw/zinc/83/17/41/942831741.db2.gz OJRZZWYDKGAPJE-PZJWPPBQSA-N 0 3 407.539 4.126 20 0 HIADHN C[C@H](c1ccccc1)n1cnnc1SC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000556324693 942841144 /nfs/dbraw/zinc/84/11/44/942841144.db2.gz QELQAPNOPRESLF-DENIHFKCSA-N 0 3 408.571 4.271 20 0 HIADHN COc1ccc(CNc2ccc(C(=O)N(C)[C@H]3CCCN(C)C3)cc2)cc1Cl ZINC000556337622 942844711 /nfs/dbraw/zinc/84/47/11/942844711.db2.gz ZFVFVTKKNZVIEJ-IBGZPJMESA-N 0 3 401.938 4.127 20 0 HIADHN O=C1CCCN1[C@H]1CCN(Cc2cn(-c3ccccc3)nc2-c2ccc(Cl)cc2)C1 ZINC000556379675 942852497 /nfs/dbraw/zinc/85/24/97/942852497.db2.gz OEXKTXABQOWIBK-QFIPXVFZSA-N 0 3 420.944 4.389 20 0 HIADHN CCOc1ccc(Br)cc1NC(=O)NC[C@@H](c1ccccc1)N(C)C ZINC000556502835 942886252 /nfs/dbraw/zinc/88/62/52/942886252.db2.gz KKQJMUDDYHTYHZ-KRWDZBQOSA-N 0 3 406.324 4.272 20 0 HIADHN C[C@@H]1CCCC[C@@H]1NC(=O)CN[C@H](c1cccc(C(F)(F)F)c1)C1CCOCC1 ZINC000556515427 942889639 /nfs/dbraw/zinc/88/96/39/942889639.db2.gz VJSPCWRWDURWQU-JJXUHFIVSA-N 0 3 412.496 4.458 20 0 HIADHN Cc1ccc(C)c(Sc2ccc(NC(=O)CN[C@@H]3CCC(=O)N[C@@H]3C3CC3)cc2)c1 ZINC000556523045 942891193 /nfs/dbraw/zinc/89/11/93/942891193.db2.gz SZKSBJSVDOBQGN-HYBUGGRVSA-N 0 3 423.582 4.040 20 0 HIADHN CC(C)Oc1ccc([C@@H](C)N[C@H]2CCCN(Cc3ccccn3)C2=O)cc1Cl ZINC000556572892 942902697 /nfs/dbraw/zinc/90/26/97/942902697.db2.gz ITCLTFGKGRUBBM-UZLBHIALSA-N 0 3 401.938 4.364 20 0 HIADHN CC(C)(C)N1C[C@@H](C(=O)N2CCC[C@H]2CC(=O)c2ccccc2)[C@H](C(F)(F)F)C1 ZINC000556593913 942909521 /nfs/dbraw/zinc/90/95/21/942909521.db2.gz VZRQZONGCDEPJJ-RCCFBDPRSA-N 0 3 410.480 4.159 20 0 HIADHN Cc1ccc2c(c1)[C@H](NCc1cccc(N3C(=O)N[C@@](C)(C4CC4)C3=O)c1)CCC2 ZINC000556609888 942914293 /nfs/dbraw/zinc/91/42/93/942914293.db2.gz BUCLPTNYQCIKQQ-RDGATRHJSA-N 0 3 403.526 4.387 20 0 HIADHN COCCC1(CNc2ccc(C(=O)N(C)[C@H]3CCCN(C)C3)cc2)CCCCC1 ZINC000556618256 942918493 /nfs/dbraw/zinc/91/84/93/942918493.db2.gz JSAQBBLBUPCWFP-QFIPXVFZSA-N 0 3 401.595 4.252 20 0 HIADHN COc1ccc(C(=O)CCC(=O)N(C)C[C@@H]2CCN(Cc3ccc(C)s3)C2)cc1 ZINC000556827998 942936390 /nfs/dbraw/zinc/93/63/90/942936390.db2.gz AAIDDISJUDTOSA-SFHVURJKSA-N 0 3 414.571 4.009 20 0 HIADHN Cc1cc(C(=O)CCC(=O)N2CCN(c3ccnc4ccccc43)CC2)c(C)s1 ZINC000556832396 942937349 /nfs/dbraw/zinc/93/73/49/942937349.db2.gz GVLUWBNDMUDCBZ-UHFFFAOYSA-N 0 3 407.539 4.225 20 0 HIADHN Cc1c(C(=O)NC[C@H](CN(C)C)c2ccc(Cl)cc2)[nH]c2c1C(=O)CC(C)(C)C2 ZINC000556851903 942939622 /nfs/dbraw/zinc/93/96/22/942939622.db2.gz SHQRPYBMMGPWNC-MRXNPFEDSA-N 0 3 415.965 4.207 20 0 HIADHN CC[C@@H](NCc1cccc(C(=O)N2CCOCC2)c1)c1ccc(OC(F)(F)F)cc1 ZINC000556870991 942945713 /nfs/dbraw/zinc/94/57/13/942945713.db2.gz HUSKDSCBACDFOI-HXUWFJFHSA-N 0 3 422.447 4.299 20 0 HIADHN OC[C@@H](CN[C@H](c1ncc[nH]1)C1CCCCC1)Cc1ccc(Br)cc1 ZINC000556881582 942949040 /nfs/dbraw/zinc/94/90/40/942949040.db2.gz XCWBLWKPDGSQSM-APWZRJJASA-N 0 3 406.368 4.234 20 0 HIADHN CN(CCCN(C)C(=O)C1(c2cccc(C(F)(F)F)c2)CC1)Cc1ccncc1 ZINC000556933286 942971550 /nfs/dbraw/zinc/97/15/50/942971550.db2.gz IQKOQMYCDWILHV-UHFFFAOYSA-N 0 3 405.464 4.113 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)[C@@H](C)[C@@H]2OCCc3sccc32)N(C)C)cc1 ZINC000556990277 942988645 /nfs/dbraw/zinc/98/86/45/942988645.db2.gz KXFDFQJJIZFQGD-BUKVSMQUSA-N 0 3 416.587 4.204 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3cc(F)ccc3OC)c(OCC)c2)CC1 ZINC000557005142 942992386 /nfs/dbraw/zinc/99/23/86/942992386.db2.gz JFYGHWVKIRTTPN-UHFFFAOYSA-N 0 3 415.509 4.017 20 0 HIADHN CCOc1ccc(-c2nc(C(=O)Nc3cccc(CN4CC[C@H](O)C4)c3)cs2)cc1 ZINC000557024042 942997423 /nfs/dbraw/zinc/99/74/23/942997423.db2.gz VCAIXZLWCKRENV-IBGZPJMESA-N 0 3 423.538 4.028 20 0 HIADHN O=C(CCc1cccc(OC2CCCC2)c1)Nc1cccc(CN2CC[C@H](O)C2)c1 ZINC000557023969 942997447 /nfs/dbraw/zinc/99/74/47/942997447.db2.gz YTPGRRCPNJLHQU-QFIPXVFZSA-N 0 3 408.542 4.146 20 0 HIADHN O=C(NCc1c(F)cc(F)c(F)c1F)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000557036858 943000536 /nfs/dbraw/zinc/00/05/36/943000536.db2.gz XYELXWJTCOVHDM-AWEZNQCLSA-N 0 3 416.365 4.017 20 0 HIADHN CCCN(C)[C@H](CNC(=O)c1c(C)nn(CC(F)F)c1C)c1ccc(Cl)cc1 ZINC000557340939 943078480 /nfs/dbraw/zinc/07/84/80/943078480.db2.gz HMDLNBBNXWVRRW-QGZVFWFLSA-N 0 3 412.912 4.231 20 0 HIADHN O=C(N1CCC=C(c2ccco2)C1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000557345430 943079977 /nfs/dbraw/zinc/07/99/77/943079977.db2.gz DPPIWUDYKULSKP-NRFANRHFSA-N 0 3 404.432 4.350 20 0 HIADHN COc1ccc(CN2CC[C@@H](N[C@H](C)c3ccc4ccccc4c3)C2=O)c(OC)c1 ZINC000557447045 943130650 /nfs/dbraw/zinc/13/06/50/943130650.db2.gz XHUBJTYXRHUNBZ-UZUQRXQVSA-N 0 3 404.510 4.309 20 0 HIADHN COc1ccc(CN2CC[C@@H](N[C@@H](C)c3ccc4ccccc4c3)C2=O)c(OC)c1 ZINC000557447042 943130768 /nfs/dbraw/zinc/13/07/68/943130768.db2.gz XHUBJTYXRHUNBZ-GAJHUEQPSA-N 0 3 404.510 4.309 20 0 HIADHN O=C(COC1CCCC1)N(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000557448989 943132530 /nfs/dbraw/zinc/13/25/30/943132530.db2.gz NDJOABNLGUFCNE-QHCPKHFHSA-N 0 3 407.558 4.034 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(C)c1C(=O)N[C@H]1CCN(Cc2ccccc2)[C@@H]1C ZINC000557487789 943163389 /nfs/dbraw/zinc/16/33/89/943163389.db2.gz XXUNOSORZXYNBW-VGSWGCGISA-N 0 3 406.505 4.021 20 0 HIADHN COCCOc1ccc(C(F)(F)F)cc1NC(=O)[C@@H](C)N[C@H](C)c1ccccc1 ZINC000557521742 943188273 /nfs/dbraw/zinc/18/82/73/943188273.db2.gz LPZXYYOTKYENOP-HUUCEWRRSA-N 0 3 410.436 4.408 20 0 HIADHN C[C@@H](NC(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1)c1ccc2n[nH]cc2c1 ZINC000557720188 943269136 /nfs/dbraw/zinc/26/91/36/943269136.db2.gz ODMFXASQXIVHSE-VFNWGFHPSA-N 0 3 416.447 4.195 20 0 HIADHN Cc1nc(N[C@H](C)c2ccc3n[nH]cc3c2)cc(N[C@H](C)c2ccc3n[nH]cc3c2)n1 ZINC000557763057 943283892 /nfs/dbraw/zinc/28/38/92/943283892.db2.gz PATOOIKYIVZTMA-ZIAGYGMSSA-N 0 3 412.501 4.884 20 0 HIADHN CCN(Cc1ccc(OC)cc1OC)C(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000557801117 943295869 /nfs/dbraw/zinc/29/58/69/943295869.db2.gz BCUFYSMCOSCAHW-HXUWFJFHSA-N 0 3 414.521 4.104 20 0 HIADHN O=C1NC(=O)C2(CCC(N[C@@H](c3ccc(Cl)cc3)c3ccccc3Cl)CC2)N1 ZINC000557831168 943306619 /nfs/dbraw/zinc/30/66/19/943306619.db2.gz PLFLDSMFBVLARQ-GFBDMGBSSA-N 0 3 418.324 4.193 20 0 HIADHN CC1CCC(N2CCN(C(=O)Nc3ccc(-c4noc(C(F)F)n4)cc3)CC2)CC1 ZINC000558011908 943355084 /nfs/dbraw/zinc/35/50/84/943355084.db2.gz HIPXMJULKBANJP-UHFFFAOYSA-N 0 3 419.476 4.402 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c2sc(C(=O)N3CC[C@H](N4CCCC4)[C@@H]3C)cc12 ZINC000558017053 943356248 /nfs/dbraw/zinc/35/62/48/943356248.db2.gz XHIPVTOYHXBQGG-KXBFYZLASA-N 0 3 412.534 4.233 20 0 HIADHN C[C@H]1C[C@@H]1N1CCN(C(=O)c2cc(C(F)(F)F)ccc2Br)C[C@@H](C)C1 ZINC000558026738 943359830 /nfs/dbraw/zinc/35/98/30/943359830.db2.gz YEWFUTZATWNHHX-MKBNYLNASA-N 0 3 419.285 4.270 20 0 HIADHN Cc1cc(CN[C@@H]2CCCN(C(=O)CCC(F)(F)F)C2)c(OC(F)F)cc1C ZINC000558132161 943390676 /nfs/dbraw/zinc/39/06/76/943390676.db2.gz NQKVTYAIKJDSDQ-OAHLLOKOSA-N 0 3 408.411 4.328 20 0 HIADHN COC[C@@H](N[C@H](C)CC(=O)Nc1ccc(OC)cc1OC)c1cccc(Cl)c1 ZINC000558166546 943405336 /nfs/dbraw/zinc/40/53/36/943405336.db2.gz SEIDNSUOGLTCNR-AUUYWEPGSA-N 0 3 406.910 4.052 20 0 HIADHN COC[C@@H](N[C@@H](C)CC(=O)Nc1ccc(OC)cc1OC)c1cccc(Cl)c1 ZINC000558166549 943406088 /nfs/dbraw/zinc/40/60/88/943406088.db2.gz SEIDNSUOGLTCNR-IFXJQAMLSA-N 0 3 406.910 4.052 20 0 HIADHN CN(C)C[C@@H](NC(=O)Nc1cc(C2CC2)nn1-c1ccccc1)c1ccc(F)cc1 ZINC000558238601 943452186 /nfs/dbraw/zinc/45/21/86/943452186.db2.gz SRNQBCNSWVPCTK-OAQYLSRUSA-N 0 3 407.493 4.313 20 0 HIADHN C[C@H](NC(=O)Nc1cc2c(cc1Cl)OCCCO2)[C@@H](c1ccccc1)N(C)C ZINC000558244034 943454956 /nfs/dbraw/zinc/45/49/56/943454956.db2.gz NNBNOQOZSMRPDB-XOBRGWDASA-N 0 3 403.910 4.314 20 0 HIADHN C[C@H](N[C@@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O)c1cccc(-n2ccnn2)c1 ZINC000558260069 943464028 /nfs/dbraw/zinc/46/40/28/943464028.db2.gz XEMOOASYUANYKI-ORAYPTAESA-N 0 3 416.312 4.030 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)Nc2cccc(OC(F)F)c2)N(C)C)cc1 ZINC000558277083 943476806 /nfs/dbraw/zinc/47/68/06/943476806.db2.gz PZYAUXSHDSHHOA-IBGZPJMESA-N 0 3 407.461 4.500 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)Nc1ccc(C(=O)NCC)cc1)c1ccc(Cl)cc1 ZINC000558291611 943487292 /nfs/dbraw/zinc/48/72/92/943487292.db2.gz KARXOWIUNYWYDX-FQEVSTJZSA-N 0 3 416.953 4.294 20 0 HIADHN C[C@H](NC(=O)Nc1cccc(NC(=O)c2ccoc2)c1)[C@@H](c1ccccc1)N(C)C ZINC000558315792 943502327 /nfs/dbraw/zinc/50/23/27/943502327.db2.gz MPECWLOJVPQKDE-KKSFZXQISA-N 0 3 406.486 4.345 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)Nc1ccc(C(=O)N[C@@H](C)CC)cc1)c1ccco1 ZINC000558332717 943511443 /nfs/dbraw/zinc/51/14/43/943511443.db2.gz VCJQFOODMZCJBK-JTDSTZFVSA-N 0 3 400.523 4.059 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1ccc(OC)cc1Br)c1ccco1 ZINC000558361630 943525673 /nfs/dbraw/zinc/52/56/73/943525673.db2.gz PHTFOMOATCAALG-BLLLJJGKSA-N 0 3 410.312 4.302 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)Nc1ccc(OC)cc1Br)c1ccco1 ZINC000558361632 943526015 /nfs/dbraw/zinc/52/60/15/943526015.db2.gz PHTFOMOATCAALG-MLGOLLRUSA-N 0 3 410.312 4.302 20 0 HIADHN CN(C)C[C@H](NC(=O)Nc1ccccc1CC(=O)OC(C)(C)C)c1ccc(F)cc1 ZINC000558378516 943534687 /nfs/dbraw/zinc/53/46/87/943534687.db2.gz BFTNZJFNUQVBOP-FQEVSTJZSA-N 0 3 415.509 4.134 20 0 HIADHN CC(=O)N(Cc1ccc(NC(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)cc1)C1CC1 ZINC000558389925 943542070 /nfs/dbraw/zinc/54/20/70/943542070.db2.gz CICSNCKAIQKBJT-SBUREZEXSA-N 0 3 408.546 4.010 20 0 HIADHN Cc1ccc(-n2cc(CN3CCC[C@@H](c4ccnc(N)n4)C3)c(C(C)(C)C)n2)cc1 ZINC000558407600 943551559 /nfs/dbraw/zinc/55/15/59/943551559.db2.gz SXBVOCWOPTUHJS-GOSISDBHSA-N 0 3 404.562 4.230 20 0 HIADHN CCOC(=O)c1nnc(-c2cccc(C[NH2+]C3CC(c4cccc(Cl)c4)C3)c2)[n-]1 ZINC000558420141 943554612 /nfs/dbraw/zinc/55/46/12/943554612.db2.gz LCLIZGPNNRGGBI-UHFFFAOYSA-N 0 3 410.905 4.338 20 0 HIADHN CCOC(=O)c1nc(-c2cccc(C[NH2+]C3CC(c4cccc(Cl)c4)C3)c2)n[n-]1 ZINC000558420141 943554614 /nfs/dbraw/zinc/55/46/14/943554614.db2.gz LCLIZGPNNRGGBI-UHFFFAOYSA-N 0 3 410.905 4.338 20 0 HIADHN CN(c1ccccc1)c1ccc(CN2CC[C@](CO)(Cc3ccc(F)cc3)C2)cn1 ZINC000558428075 943558208 /nfs/dbraw/zinc/55/82/08/943558208.db2.gz ZSZSBRZJTOQBCU-VWLOTQADSA-N 0 3 405.517 4.416 20 0 HIADHN C[C@H](N[C@@H]1CCN(C)[C@@H]1c1ccc(Cl)cc1)C(=O)Nc1ccc(F)cc1Cl ZINC000558467064 943567371 /nfs/dbraw/zinc/56/73/71/943567371.db2.gz NCJFQNFGLMNZSP-GESALYCCSA-N 0 3 410.320 4.495 20 0 HIADHN O=C(N1CCC(C2CCOCC2)CC1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000558636798 943622081 /nfs/dbraw/zinc/62/20/81/943622081.db2.gz ADRYQJFULBWXPX-QFIPXVFZSA-N 0 3 424.507 4.106 20 0 HIADHN O=C(CN1[C@@H]2CC[C@H]1C[C@@H](c1ccccc1)C2)NC[C@@H]1CCN(c2ccccc2)C1 ZINC000558734794 943635063 /nfs/dbraw/zinc/63/50/63/943635063.db2.gz TXNRVHRTGMOEFC-INWJIATQSA-N 0 3 403.570 4.040 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1ccc2nnc(C3CCC3)n2c1)c1ccsc1 ZINC000558799756 943668137 /nfs/dbraw/zinc/66/81/37/943668137.db2.gz ZKDXWBMNUVUMCE-SFHVURJKSA-N 0 3 412.563 4.263 20 0 HIADHN CCOC(=O)C1CCC(N(CC)C(=O)NC[C@@H](c2ccc(CC)cc2)N(C)C)CC1 ZINC000558883339 943718083 /nfs/dbraw/zinc/71/80/83/943718083.db2.gz TZLXUYFGFSXAAN-HRTMPFAESA-N 0 3 417.594 4.005 20 0 HIADHN CC(C)N1CC[C@@H](N[C@@H](C)C(=O)Nc2cc(F)ccc2F)[C@H]1c1ccc(F)c(F)c1 ZINC000558890971 943723175 /nfs/dbraw/zinc/72/31/75/943723175.db2.gz BNVAYLHLZPDUKJ-DRWCTHJISA-N 0 3 423.454 4.384 20 0 HIADHN COc1cccc([C@@H]2[C@@H](NCC(=O)Nc3cccc4ccccc43)CCN2C2CC2)c1 ZINC000558894287 943726142 /nfs/dbraw/zinc/72/61/42/943726142.db2.gz GLNIHMNURPXOKB-AZGAKELHSA-N 0 3 415.537 4.355 20 0 HIADHN COc1cccc([C@@H]2[C@H](N[C@H](C)C(=O)Nc3cc(F)ccc3C)CCN2C2CC2)c1 ZINC000558897043 943731176 /nfs/dbraw/zinc/73/11/76/943731176.db2.gz NVCJALHCYBOFSZ-FQQGMQMYSA-N 0 3 411.521 4.037 20 0 HIADHN CCN1CC[C@H](N[C@@H](C)C(=O)NCCc2cccs2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000558898740 943732307 /nfs/dbraw/zinc/73/23/07/943732307.db2.gz QMBHPFCHQYDRDF-GKCIPKSASA-N 0 3 423.985 4.013 20 0 HIADHN C[C@H](NC(=O)N[C@@H](CN(C)C)c1ccc(Cl)cc1)c1noc(-c2ccccc2)n1 ZINC000558910518 943742453 /nfs/dbraw/zinc/74/24/53/943742453.db2.gz NIJCKJTYUQFKAP-KSSFIOAISA-N 0 3 413.909 4.053 20 0 HIADHN CN(C)C[C@@H](NC(=O)c1ccc(OCc2ccccn2)cc1)c1ccc(Cl)cc1 ZINC000558973406 943777351 /nfs/dbraw/zinc/77/73/51/943777351.db2.gz ROTSEMYFRGYAMU-JOCHJYFZSA-N 0 3 409.917 4.347 20 0 HIADHN C[C@H](N[C@@H](CN1CCN(C)CC1)c1ccccc1)c1cc(Br)cs1 ZINC000559087066 943832205 /nfs/dbraw/zinc/83/22/05/943832205.db2.gz OAOGSVBDAPQNIB-YJBOKZPZSA-N 0 3 408.409 4.150 20 0 HIADHN C[C@H](N[C@H]1CCN([C@@H](C)c2ccc(F)cc2)C1=O)c1ccc(NC(=O)C2CC2)cc1 ZINC000559147386 943854091 /nfs/dbraw/zinc/85/40/91/943854091.db2.gz WHYNRFHHXSUQEI-WCJKSRRJSA-N 0 3 409.505 4.187 20 0 HIADHN C[C@@H](Cc1cnc2ccccc2n1)C(=O)NC[C@H](c1ccccc1)N1CCC(C)CC1 ZINC000559149912 943854229 /nfs/dbraw/zinc/85/42/29/943854229.db2.gz PXGBBUMDFVFKLK-NBGIEHNGSA-N 0 3 416.569 4.398 20 0 HIADHN COC1(CCN(C)Cc2cccc(Br)c2OC[C@@H]2CCCO2)CCC1 ZINC000559187924 943865672 /nfs/dbraw/zinc/86/56/72/943865672.db2.gz QBXZYIMUYLXENH-KRWDZBQOSA-N 0 3 412.368 4.398 20 0 HIADHN Cc1nc(N2CCC(c3ccncc3)CC2)cc(N2CCC(c3ccncc3)CC2)n1 ZINC000559254057 943886429 /nfs/dbraw/zinc/88/64/29/943886429.db2.gz HJIKROKQQPIWKM-UHFFFAOYSA-N 0 3 414.557 4.343 20 0 HIADHN C[C@@H]1CCCCN1CCC(=O)Nc1cccc(CS(=O)(=O)C2CCCCC2)c1 ZINC000559279251 943889593 /nfs/dbraw/zinc/88/95/93/943889593.db2.gz QNECXZFBZBBMDT-GOSISDBHSA-N 0 3 406.592 4.137 20 0 HIADHN Cc1nc(COc2ccc(CN[C@H](C)c3ccc(-n4cccn4)c(F)c3)cc2)no1 ZINC000559321620 943896636 /nfs/dbraw/zinc/89/66/36/943896636.db2.gz IQOBPGLHQPYNQK-OAHLLOKOSA-N 0 3 407.449 4.133 20 0 HIADHN Cc1ccccc1C(C)(C)NCC(=O)N1CCC[C@H]1c1ccc2c(c1)OCCCO2 ZINC000559326955 943897211 /nfs/dbraw/zinc/89/72/11/943897211.db2.gz UCAJXVZZJASIRX-NRFANRHFSA-N 0 3 408.542 4.345 20 0 HIADHN O=S(=O)(CCCNCc1cccc(Br)c1)c1ccc(Cl)cc1 ZINC000559357836 943908493 /nfs/dbraw/zinc/90/84/93/943908493.db2.gz FIHVYCXYYKMUBB-UHFFFAOYSA-N 0 3 402.741 4.056 20 0 HIADHN CCO[C@@H]1C[C@@H](NCc2cn(-c3ccccc3)nc2-c2ccc(C)o2)[C@@H]1n1cccn1 ZINC000559360745 943909868 /nfs/dbraw/zinc/90/98/68/943909868.db2.gz QUPXKPYBDHJVFG-BKULYWANSA-N 0 3 417.513 4.146 20 0 HIADHN CN1CC[C@H](NCC(=O)N[C@H](c2cccs2)c2ccc(F)cc2)[C@@H]1c1ccccc1 ZINC000559777709 944049248 /nfs/dbraw/zinc/04/92/48/944049248.db2.gz TXCYHYGOLZIOEH-OYDLWJJNSA-N 0 3 423.557 4.128 20 0 HIADHN C[C@@H](NCc1nnc(-c2ccccc2Cl)o1)C1CCN(CC(F)(F)F)CC1 ZINC000559778532 944049629 /nfs/dbraw/zinc/04/96/29/944049629.db2.gz VUQSDHODANQZAT-GFCCVEGCSA-N 0 3 402.848 4.142 20 0 HIADHN COCCOc1ccc([C@H](C)N[C@H](C)c2ccc(-n3cccn3)c(F)c2)cc1OC ZINC000559877059 944072280 /nfs/dbraw/zinc/07/22/80/944072280.db2.gz FAENORYDCUGGBB-SJORKVTESA-N 0 3 413.493 4.457 20 0 HIADHN COc1ccc2oc([C@@H](C)N[C@H](C)Cn3cc(Br)ccc3=O)c(C)c2c1 ZINC000559892783 944078251 /nfs/dbraw/zinc/07/82/51/944078251.db2.gz FODBBUFDYUSRAE-TZMCWYRMSA-N 0 3 419.319 4.413 20 0 HIADHN C[C@H](c1ccc(F)cc1)N1CCC[C@H](N[C@@H](C)c2ccc3c(c2)C(C)(C)C(=O)N3)C1=O ZINC000559897862 944078988 /nfs/dbraw/zinc/07/89/88/944078988.db2.gz SNASPPGDZPWJPX-DMPWYTOCSA-N 0 3 423.532 4.458 20 0 HIADHN CC[C@H](Cn1cncn1)N[C@H](c1cccc(F)c1)c1cccc(Br)c1 ZINC000559913399 944083781 /nfs/dbraw/zinc/08/37/81/944083781.db2.gz KMYOUEPRLATKHU-MOPGFXCFSA-N 0 3 403.299 4.338 20 0 HIADHN Cc1ccc2snc(C(=O)Nc3ccc(C(=O)N(C)[C@@H]4CCCN(C)C4)cc3)c2c1 ZINC000559982092 944109275 /nfs/dbraw/zinc/10/92/75/944109275.db2.gz ZJTLIGZCEWQRIN-GOSISDBHSA-N 0 3 422.554 4.023 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)c2cccc(F)c2Br)CC1 ZINC000560197702 944193958 /nfs/dbraw/zinc/19/39/58/944193958.db2.gz SQTRRHLUMPYEDW-UHFFFAOYSA-N 0 3 405.311 4.325 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3cc(Cl)c(F)cc3Cl)CC2)C[C@H](C)O1 ZINC000560207513 944196822 /nfs/dbraw/zinc/19/68/22/944196822.db2.gz QLGGKEOKEHQNIT-OKILXGFUSA-N 0 3 417.352 4.484 20 0 HIADHN Cc1occc1C(=O)Nc1cc(Cl)ccc1C(=O)N1CCCN(C(C)C)CC1 ZINC000560260710 944209965 /nfs/dbraw/zinc/20/99/65/944209965.db2.gz YGTQKXPEJWVMBH-UHFFFAOYSA-N 0 3 403.910 4.050 20 0 HIADHN C[C@@]1(C2CC2)NC(=O)N(c2cccc(CN[C@H]3CCCc4cc(F)ccc43)c2)C1=O ZINC000560267790 944213152 /nfs/dbraw/zinc/21/31/52/944213152.db2.gz GRLVRAVQFZWNMK-URXFXBBRSA-N 0 3 407.489 4.218 20 0 HIADHN C[C@]1(C2CC2)NC(=O)N(c2cccc(CN[C@H]3CCCc4cc(F)ccc43)c2)C1=O ZINC000560267792 944213446 /nfs/dbraw/zinc/21/34/46/944213446.db2.gz GRLVRAVQFZWNMK-XUZZJYLKSA-N 0 3 407.489 4.218 20 0 HIADHN CCc1ccccc1NC(=O)C[C@@H](C)N[C@H](C)c1ccc(S(=O)(=O)CC)cc1 ZINC000560270334 944214299 /nfs/dbraw/zinc/21/42/99/944214299.db2.gz METTZPIKTSSHPL-IAGOWNOFSA-N 0 3 402.560 4.111 20 0 HIADHN CC(C)Cc1cccc([C@@H](C)NCc2ccc(N3CCCS3(=O)=O)c(F)c2)c1 ZINC000560549401 944249968 /nfs/dbraw/zinc/24/99/68/944249968.db2.gz FNUUFQJLKLEZKW-QGZVFWFLSA-N 0 3 404.551 4.415 20 0 HIADHN CC[C@@H](N[C@H]1CCCN(Cc2ccccn2)C1=O)c1ccc(OC(F)(F)F)cc1 ZINC000560549797 944250399 /nfs/dbraw/zinc/25/03/99/944250399.db2.gz ZECZOVVDFOPAAL-MOPGFXCFSA-N 0 3 407.436 4.212 20 0 HIADHN Fc1ccc(-c2nn(-c3ccccc3)cc2CN2CCC(O[C@@H]3CCOC3)CC2)cc1 ZINC000560567316 944257044 /nfs/dbraw/zinc/25/70/44/944257044.db2.gz SNSDNCJMZMRLDJ-XMMPIXPASA-N 0 3 421.516 4.448 20 0 HIADHN O=C([C@@H]1CCCN1Cc1ccccc1)N1CCC(Cc2nc3ccccc3[nH]2)CC1 ZINC000560599744 944269129 /nfs/dbraw/zinc/26/91/29/944269129.db2.gz AWNKKESYUOOVPL-QHCPKHFHSA-N 0 3 402.542 4.009 20 0 HIADHN O=C(CCNCc1cnc([C@@H]2CCCO2)s1)Nc1cc(Cl)cc(Cl)c1 ZINC000560612149 944274821 /nfs/dbraw/zinc/27/48/21/944274821.db2.gz SINFIUXXQWHMIV-HNNXBMFYSA-N 0 3 400.331 4.420 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)[C@H]1C[C@H]1c1ccccc1C(F)(F)F ZINC000560676228 944290445 /nfs/dbraw/zinc/29/04/45/944290445.db2.gz POSLXQYCWYROPR-WDSOQIARSA-N 0 3 404.432 4.014 20 0 HIADHN Brc1ccc2c(c1)C=C(CN1CCC[C@@H](c3nnc(C4CC4)[nH]3)C1)CO2 ZINC000560680885 944292455 /nfs/dbraw/zinc/29/24/55/944292455.db2.gz ZEJQBAGOTUMECQ-OAHLLOKOSA-N 0 3 415.335 4.100 20 0 HIADHN CCOc1cc(CNCc2ccc(-n3ccnc3)c(F)c2)cc(Br)c1O ZINC000560852414 944358483 /nfs/dbraw/zinc/35/84/83/944358483.db2.gz HSLPCERKMURUSJ-UHFFFAOYSA-N 0 3 420.282 4.168 20 0 HIADHN CC(C)COCCC(=O)N(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000561074104 944429162 /nfs/dbraw/zinc/42/91/62/944429162.db2.gz FWWOYEWEMZTKKE-XMMPIXPASA-N 0 3 409.574 4.138 20 0 HIADHN COc1ccccc1[C@@H]1CC[C@H](C)CN1C(=O)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000561092378 944444739 /nfs/dbraw/zinc/44/47/39/944444739.db2.gz XWCNYYGBLUUQKF-WPYKKVEZSA-N 0 3 407.558 4.302 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)N[C@@H]1CCC[C@H](C)[C@H]1C)c1ccc(NC(=O)c2ccncc2)cc1 ZINC000561157400 944487244 /nfs/dbraw/zinc/48/72/44/944487244.db2.gz NSXPPDBCIGIJSI-FWXJUILDSA-N 0 3 422.573 4.314 20 0 HIADHN Cn1cc(CN2CCC[C@H](C(=O)Nc3ccc(Cl)cn3)C2)c(-c2cccs2)n1 ZINC000561250786 944528396 /nfs/dbraw/zinc/52/83/96/944528396.db2.gz URZVLRHNSUIXCX-AWEZNQCLSA-N 0 3 415.950 4.048 20 0 HIADHN O=C(c1ccc(SC2CC2)cc1)N1CCC[C@@H](c2n[nH]cc2CN2CCCC2)C1 ZINC000561305595 944544894 /nfs/dbraw/zinc/54/48/94/944544894.db2.gz ZCFURNQHHYOOSX-GOSISDBHSA-N 0 3 410.587 4.280 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)Nc1cccc(Cl)c1N(C)C ZINC000561310509 944546244 /nfs/dbraw/zinc/54/62/44/944546244.db2.gz GNMKYSSWXCCIDC-UHFFFAOYSA-N 0 3 402.970 4.434 20 0 HIADHN Cc1cccc(-c2cccc(CN[C@H]3CCCc4ccc(S(N)(=O)=O)cc43)c2)c1 ZINC000561402453 944581661 /nfs/dbraw/zinc/58/16/61/944581661.db2.gz DIFYUVDDUBWVOV-DEOSSOPVSA-N 0 3 406.551 4.477 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N(C)Cc2ccc(OCC(F)(F)F)cc2)N(C)C)cc1 ZINC000561540379 944663429 /nfs/dbraw/zinc/66/34/29/944663429.db2.gz GDCZWFLPYXJYQS-HXUWFJFHSA-N 0 3 423.479 4.380 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)c2ncoc2-c2ccc(F)cc2)N(C)C)cc1 ZINC000561614604 944709422 /nfs/dbraw/zinc/70/94/22/944709422.db2.gz HNGQGEXFCASYPZ-FQEVSTJZSA-N 0 3 411.477 4.301 20 0 HIADHN FC(F)(F)c1ccn([C@@H]2CCCN(Cc3ccc(OC[C@H]4CCCO4)cc3)C2)n1 ZINC000561625186 944714194 /nfs/dbraw/zinc/71/41/94/944714194.db2.gz CQJFFGOFLQSCQQ-IEBWSBKVSA-N 0 3 409.452 4.297 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)c2sccc2Br)N(C)C)cc1 ZINC000561651475 944728700 /nfs/dbraw/zinc/72/87/00/944728700.db2.gz BJSPTKVCBFCKIS-MRXNPFEDSA-N 0 3 411.365 4.331 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)[C@@H]2C[C@H]2c2cc(F)c(F)c(F)c2)N(C)C)cc1 ZINC000561650631 944729299 /nfs/dbraw/zinc/72/92/99/944729299.db2.gz JNXKCVSBDVRYLV-UEXGIBASSA-N 0 3 420.475 4.414 20 0 HIADHN CCOc1cn(-c2ccccc2)nc1C(=O)NC[C@H](c1ccc(SC)cc1)N(C)C ZINC000561727485 944767539 /nfs/dbraw/zinc/76/75/39/944767539.db2.gz XULMDXJZYFQFPV-HXUWFJFHSA-N 0 3 424.570 4.026 20 0 HIADHN C[C@H]1C[C@H]1N1CCN(C(=O)c2cc(F)c(Br)c(Cl)c2)C[C@@H](C)C1 ZINC000561761572 944785246 /nfs/dbraw/zinc/78/52/46/944785246.db2.gz MTEODRYMCCGORL-ZIBATOQPSA-N 0 3 403.723 4.044 20 0 HIADHN Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)N[C@@H]1CCN(Cc2ccccc2)[C@@H]1C ZINC000561798789 944801232 /nfs/dbraw/zinc/80/12/32/944801232.db2.gz HGGCIDZAJQRIKB-AUSIDOKSSA-N 0 3 420.557 4.016 20 0 HIADHN C[C@H](C(=O)NCCc1nc2c(s1)CCCC2)N1CCC(Cc2ccccc2)CC1 ZINC000561887760 944838562 /nfs/dbraw/zinc/83/85/62/944838562.db2.gz FEGHKNXULDDMFP-GOSISDBHSA-N 0 3 411.615 4.024 20 0 HIADHN C[C@H](OC[C@H](O)CN(Cc1cccs1)[C@@H]1C=C[C@H](CO)C1)c1ccc(Cl)cc1 ZINC000561910994 944851395 /nfs/dbraw/zinc/85/13/95/944851395.db2.gz LPEZEYXCYXIUDI-ZCLUNYJNSA-N 0 3 421.990 4.279 20 0 HIADHN C[C@H](OC[C@@H](O)CN(Cc1cccs1)[C@@H]1C=C[C@H](CO)C1)c1ccc(Cl)cc1 ZINC000561910992 944851646 /nfs/dbraw/zinc/85/16/46/944851646.db2.gz LPEZEYXCYXIUDI-PZBISTMVSA-N 0 3 421.990 4.279 20 0 HIADHN Cc1nc2ccccn2c(=O)c1CCN1CCc2sccc2[C@H]1c1cccs1 ZINC000562033913 944904482 /nfs/dbraw/zinc/90/44/82/944904482.db2.gz LWTPZALWFFDDSY-NRFANRHFSA-N 0 3 407.564 4.316 20 0 HIADHN COc1ccc(CN2CC[C@@H](N[C@@H](C)c3cccc4ccccc43)C2=O)c(OC)c1 ZINC000562047560 944909194 /nfs/dbraw/zinc/90/91/94/944909194.db2.gz LFPROPZAGMTDSL-GAJHUEQPSA-N 0 3 404.510 4.309 20 0 HIADHN COc1ccc([C@@H](Cc2ccccc2)NCC(=O)Nc2cc(OC)ccc2OC)cc1 ZINC000562073541 944922863 /nfs/dbraw/zinc/92/28/63/944922863.db2.gz JSMWLNIIBCYAJJ-JOCHJYFZSA-N 0 3 420.509 4.225 20 0 HIADHN CN(C)C[C@H](NC(=O)Nc1ccc(OCC2CCOCC2)cc1)c1ccc(F)cc1 ZINC000562216865 945025037 /nfs/dbraw/zinc/02/50/37/945025037.db2.gz GKGZAUXLFOKGCM-QFIPXVFZSA-N 0 3 415.509 4.056 20 0 HIADHN CSc1ccc([C@H](CNC(=O)c2cccc(OCC(F)(F)F)c2)N(C)C)cc1 ZINC000564094126 945377061 /nfs/dbraw/zinc/37/70/61/945377061.db2.gz MCGLRYIJNXDBAD-SFHVURJKSA-N 0 3 412.477 4.382 20 0 HIADHN O=S(=O)(c1ccc(CN[C@H]2CCCc3c4ccccc4[nH]c32)cc1)N1CCCC1 ZINC000564145470 945399801 /nfs/dbraw/zinc/39/98/01/945399801.db2.gz WMAAVIDZBSVJQB-QFIPXVFZSA-N 0 3 409.555 4.120 20 0 HIADHN CCCCO[C@@H]1C[C@H](N[C@H](C)C(=O)Nc2c(C)nn(-c3ccccc3)c2C)C1(C)C ZINC000564293216 945503967 /nfs/dbraw/zinc/50/39/67/945503967.db2.gz BGBLWOGYJNONSW-JRGCBEDISA-N 0 3 412.578 4.390 20 0 HIADHN CN(CCCN(C)C(=O)C(C)(C)c1cccc(Br)c1)Cc1ccncc1 ZINC000564315067 945512846 /nfs/dbraw/zinc/51/28/46/945512846.db2.gz NZGONENCYUTRRY-UHFFFAOYSA-N 0 3 418.379 4.102 20 0 HIADHN C[C@@H]1OCC[C@]1(O)CN(Cc1cnc(-c2ccsc2)s1)Cc1ccccc1 ZINC000564324849 945516912 /nfs/dbraw/zinc/51/69/12/945516912.db2.gz INGPXGGCCPZJIN-KKSFZXQISA-N 0 3 400.569 4.414 20 0 HIADHN COC(=O)c1ccc(-c2nc(CN[C@H]3CCN(C)[C@H]3c3ccccc3)cs2)cc1 ZINC000564393482 945552859 /nfs/dbraw/zinc/55/28/59/945552859.db2.gz NFXXDCPPGPPHHG-SFTDATJTSA-N 0 3 407.539 4.132 20 0 HIADHN O=C(NCc1nc2cc(F)ccc2o1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000564396854 945554466 /nfs/dbraw/zinc/55/44/66/945554466.db2.gz XTDJAXLSCGDWRI-FQEVSTJZSA-N 0 3 421.394 4.038 20 0 HIADHN O=C(c1ccc(OCc2ccncc2)cc1)N(CCN1CCCC1)c1ccccc1 ZINC000564402528 945557053 /nfs/dbraw/zinc/55/70/53/945557053.db2.gz BDVBYFJTNWOJGL-UHFFFAOYSA-N 0 3 401.510 4.403 20 0 HIADHN Cc1c([C@H](C)NCc2ccc(Cn3cncn3)cc2)cnn1-c1cccc(Cl)c1 ZINC000564438001 945587289 /nfs/dbraw/zinc/58/72/89/945587289.db2.gz GXGHXWDZCJPZLR-INIZCTEOSA-N 0 3 406.921 4.325 20 0 HIADHN CCO[C@@H]1C[C@H](NCC(=O)Nc2c(C)nn(-c3ccc(C)cc3)c2C)C12CCCC2 ZINC000564496764 945625525 /nfs/dbraw/zinc/62/55/25/945625525.db2.gz NEQSJXNIPRDZEJ-LEWJYISDSA-N 0 3 410.562 4.063 20 0 HIADHN C[C@@H]1C[C@H](Nc2ccc(-n3ncc(Cl)c(Cl)c3=O)cc2Cl)CN1C1CC1 ZINC000564568001 945681867 /nfs/dbraw/zinc/68/18/67/945681867.db2.gz NGRGGPPONPNLHR-MNOVXSKESA-N 0 3 413.736 4.230 20 0 HIADHN O=C(NC[C@H]1CCCN1Cc1ccccc1)N[C@H]1c2ccccc2CC12CCOCC2 ZINC000564575936 945683755 /nfs/dbraw/zinc/68/37/55/945683755.db2.gz SQEBUKOYRZONEN-VWNXMTODSA-N 0 3 419.569 4.044 20 0 HIADHN CC[C@H]1C[C@H](C(=O)N(Cc2ccccc2Br)C2CCN(C)CC2)CCO1 ZINC000564590971 945691651 /nfs/dbraw/zinc/69/16/51/945691651.db2.gz QRZGZROGCILIHV-APWZRJJASA-N 0 3 423.395 4.077 20 0 HIADHN COCCCN(C(=O)c1ccc(Br)c2cc(C)oc21)C1CCN(C)CC1 ZINC000564596644 945694173 /nfs/dbraw/zinc/69/41/73/945694173.db2.gz HJEOFDBXATZGIO-UHFFFAOYSA-N 0 3 423.351 4.077 20 0 HIADHN CC[C@@H](N[C@H](C)c1ccc(-n2cccn2)c(F)c1)c1ccccc1OCC(=O)N(C)C ZINC000564743625 945745077 /nfs/dbraw/zinc/74/50/77/945745077.db2.gz XTMKADAEGYUQSQ-DYESRHJHSA-N 0 3 424.520 4.280 20 0 HIADHN CCn1ncc(C(=O)NC[C@@H](c2ccc(SC)cc2)N(C)C)c1-c1ccccc1 ZINC000565324288 945810356 /nfs/dbraw/zinc/81/03/56/945810356.db2.gz FHBOAYKIBLLHQD-NRFANRHFSA-N 0 3 408.571 4.325 20 0 HIADHN CSc1ccc([C@@H](CNC(=O)c2c(C)nn(-c3ccccc3)c2C)N(C)C)cc1 ZINC000565356476 945817559 /nfs/dbraw/zinc/81/75/59/945817559.db2.gz MCRROHJUPNIJMH-OAQYLSRUSA-N 0 3 408.571 4.244 20 0 HIADHN CN1CCC(N(Cc2ccccc2Br)C(=O)[C@H]2CC23CCCC3)CC1 ZINC000565395003 945824580 /nfs/dbraw/zinc/82/45/80/945824580.db2.gz FASUBJYPOWXLOI-GOSISDBHSA-N 0 3 405.380 4.452 20 0 HIADHN COc1ccc(NC(=O)[C@H](c2ccccc2)N2[C@@H]3CC[C@H]2CCN(C)C3)cc1Cl ZINC000565459820 945835343 /nfs/dbraw/zinc/83/53/43/945835343.db2.gz GAICIIPNDWKSDS-JQVVWYNYSA-N 0 3 413.949 4.197 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)Nc2ccc(F)cc2-c2cnn(C)c2)CCN1Cc1ccccc1 ZINC000565563568 945849108 /nfs/dbraw/zinc/84/91/08/945849108.db2.gz PWDMDWJAKKKDMF-IERDGZPVSA-N 0 3 407.493 4.011 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)Nc2ccc(-c3ccccc3)c(C)n2)cc1 ZINC000565568773 945850458 /nfs/dbraw/zinc/85/04/58/945850458.db2.gz MLYJCXHQEIWZEN-JOCHJYFZSA-N 0 3 404.514 4.490 20 0 HIADHN COc1ccccc1O[C@H]1CCCN(Cc2ccc(OCc3noc(C)n3)cc2)C1 ZINC000565799931 945886315 /nfs/dbraw/zinc/88/63/15/945886315.db2.gz CKYIYOSXQGAABD-FQEVSTJZSA-N 0 3 409.486 4.009 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Cc1coc(-c2ccc(Cl)cc2)n1)c1ccco1 ZINC000565826843 945891477 /nfs/dbraw/zinc/89/14/77/945891477.db2.gz TVYGVEKHGQGCEC-KSSFIOAISA-N 0 3 401.894 4.376 20 0 HIADHN Cc1ccc(C(=O)N[C@H]2CCN(Cc3ccccc3)[C@H]2C)cc1NC(=O)c1ccco1 ZINC000565971075 945949257 /nfs/dbraw/zinc/94/92/57/945949257.db2.gz FQIUEQZTKUSPFI-RXVVDRJESA-N 0 3 417.509 4.233 20 0 HIADHN CNS(=O)(=O)c1ccc([C@@H](C)N[C@@H](c2cccc(C(F)(F)F)c2)C2CC2)cc1 ZINC000566346190 946006858 /nfs/dbraw/zinc/00/68/58/946006858.db2.gz ODFSAFPFISTWJN-BFUOFWGJSA-N 0 3 412.477 4.415 20 0 HIADHN CCOc1cccc(-c2cccc(NC(=O)[C@@H]3CCCN(Cc4cccnc4)C3)n2)c1 ZINC000566832332 946124425 /nfs/dbraw/zinc/12/44/25/946124425.db2.gz BYCBINMPOWLMSG-OAQYLSRUSA-N 0 3 416.525 4.393 20 0 HIADHN C[C@H](C(=O)N(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1)c1cccnc1 ZINC000566847874 946131599 /nfs/dbraw/zinc/13/15/99/946131599.db2.gz YWBNURWRRKHLKH-OFVILXPXSA-N 0 3 414.553 4.274 20 0 HIADHN CSc1ccc([C@@H](CNC(=O)CCc2ncc(-c3ccccc3)o2)N(C)C)cc1 ZINC000566937254 946173940 /nfs/dbraw/zinc/17/39/40/946173940.db2.gz SHJTZCRUJULANT-HXUWFJFHSA-N 0 3 409.555 4.415 20 0 HIADHN Cc1c(NC(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)cnn1-c1ccc(Cl)cc1 ZINC000566937960 946176092 /nfs/dbraw/zinc/17/60/92/946176092.db2.gz ITZDIIFICYKMRR-TZIWHRDSSA-N 0 3 409.921 4.401 20 0 HIADHN C[C@@H]1CN(c2nnc(-c3cccc4cccnc43)n2C)[C@@H](C)CN1Cc1ccccc1 ZINC000566942983 946181421 /nfs/dbraw/zinc/18/14/21/946181421.db2.gz VRBGMYRTQFMNNI-MOPGFXCFSA-N 0 3 412.541 4.130 20 0 HIADHN CCC[C@@H]1CN(c2nnc(C3CC3)n2C[C@@H]2CCCCO2)CCN1Cc1ccccc1 ZINC000567065284 946229919 /nfs/dbraw/zinc/22/99/19/946229919.db2.gz WIXRXHHRATWTNV-PKTZIBPZSA-N 0 3 423.605 4.216 20 0 HIADHN CN1CC[C@@H](NCC(=O)Nc2ccc(Cl)cc2Cl)[C@@H]1c1ccc(F)c(F)c1 ZINC000567373744 946318906 /nfs/dbraw/zinc/31/89/06/946318906.db2.gz ZPIUGHHNPWYNDE-MJGOQNOKSA-N 0 3 414.283 4.245 20 0 HIADHN CC(C)C[C@H](NC(=O)N1CC[C@@H](N2CCN(C(C)C)CC2)C1)c1ccc(Cl)cc1 ZINC000567438540 946341837 /nfs/dbraw/zinc/34/18/37/946341837.db2.gz FHSUWOPAPOYNOX-YADHBBJMSA-N 0 3 421.029 4.237 20 0 HIADHN O=C(Nc1ccc(OC[C@H]2CN(Cc3ccccc3)CCCO2)cc1)c1ccco1 ZINC000567523856 946359709 /nfs/dbraw/zinc/35/97/09/946359709.db2.gz SBFVEQGBSMFRKU-JOCHJYFZSA-N 0 3 406.482 4.202 20 0 HIADHN C[C@@H](c1ccccc1)N(CC(=O)Nc1ccccc1SCC(N)=O)CC1CCC1 ZINC000567550487 946373353 /nfs/dbraw/zinc/37/33/53/946373353.db2.gz HBGXFUGTFVSRHX-KRWDZBQOSA-N 0 3 411.571 4.066 20 0 HIADHN CC[C@@H](C)NC(=O)c1ccc(NC(=O)N[C@H](C)CN(C)Cc2ccccc2)c(C)c1 ZINC000567646301 946390864 /nfs/dbraw/zinc/39/08/64/946390864.db2.gz KQJCZIJUJOJLNZ-RTBURBONSA-N 0 3 410.562 4.165 20 0 HIADHN C[C@@H](N[C@@H](C)Cn1cc(Br)cn1)c1ccc(Br)cc1F ZINC000567646632 946391002 /nfs/dbraw/zinc/39/10/02/946391002.db2.gz XJMKHWNIGYROCI-VHSXEESVSA-N 0 3 405.109 4.287 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@@H](O)C2)c1)c1cc(Cl)ccc1OC1CCCC1 ZINC000568006202 946439823 /nfs/dbraw/zinc/43/98/23/946439823.db2.gz YXEUXXJSAIUSFR-LJQANCHMSA-N 0 3 414.933 4.480 20 0 HIADHN O=C(Nc1cccc(Oc2cccnn2)c1)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000568095160 946459554 /nfs/dbraw/zinc/45/95/54/946459554.db2.gz VDBKPFLZNDCCHD-FQEVSTJZSA-N 0 3 424.451 4.365 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1ccc(C(=O)N2CCCC2)cc1C)c1ccco1 ZINC000568128607 946472562 /nfs/dbraw/zinc/47/25/62/946472562.db2.gz BXVQGEVEIRCOCF-FXAWDEMLSA-N 0 3 412.534 4.075 20 0 HIADHN CCSc1cccc(Br)c1NC(=O)N1C[C@H](SC)[C@@H](N(C)C)C1 ZINC000568333568 946514427 /nfs/dbraw/zinc/51/44/27/946514427.db2.gz DKKQSYZICJLDNF-JSGCOSHPSA-N 0 3 418.426 4.070 20 0 HIADHN COc1c(F)cc(NC(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)cc1F ZINC000568429168 946540964 /nfs/dbraw/zinc/54/09/64/946540964.db2.gz FWEROIWHUCEPEY-LJQANCHMSA-N 0 3 407.461 4.185 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)c1cccc(-n2cccn2)c1 ZINC000568556549 946594462 /nfs/dbraw/zinc/59/44/62/946594462.db2.gz IJFCLBXALVZDHT-UHFFFAOYSA-N 0 3 416.447 4.095 20 0 HIADHN CC(C)[C@H]1OCCC[C@@H]1CNCc1c(Br)cncc1Br ZINC000568692180 946659542 /nfs/dbraw/zinc/65/95/42/946659542.db2.gz XNAHIPJUTIITBZ-IAQYHMDHSA-N 0 3 406.162 4.147 20 0 HIADHN C[C@@H](NC[C@@H](Cc1ccccc1)C(F)(F)F)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000568805863 946704843 /nfs/dbraw/zinc/70/48/43/946704843.db2.gz CAQCXRXJGCAPDI-CZUORRHYSA-N 0 3 403.441 4.301 20 0 HIADHN C[C@H](N[C@@H]1CCN(C)[C@H]1c1ccc(Cl)c(F)c1)C(=O)N[C@@H](C)c1ccc(F)cc1 ZINC000568871314 946728462 /nfs/dbraw/zinc/72/84/62/946728462.db2.gz QSEMBKKTFKZDHC-FWSJURHISA-N 0 3 421.919 4.219 20 0 HIADHN CCN1CC[C@H](N[C@H](C)C(=O)N2[C@H](C)CCC[C@@H]2C)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000568991783 946791836 /nfs/dbraw/zinc/79/18/36/946791836.db2.gz WOLDMPFIPVZFRZ-BDMISDERSA-N 0 3 411.512 4.007 20 0 HIADHN Cc1ccsc1CNC(=O)CN[C@@H]1CCN(C(C)C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000569005832 946792820 /nfs/dbraw/zinc/79/28/20/946792820.db2.gz BVIHEJUWEQITKP-WIYYLYMNSA-N 0 3 423.985 4.279 20 0 HIADHN CCN1CC[C@H](N[C@H](C)C(=O)N2[C@H](C)CCC[C@H]2C)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000568991785 946793012 /nfs/dbraw/zinc/79/30/12/946793012.db2.gz WOLDMPFIPVZFRZ-LMOOMBEQSA-N 0 3 411.512 4.007 20 0 HIADHN CN1CC[C@H](NCCS(=O)(=O)c2ccc(C(C)(C)C)cc2)C[C@@H]1c1ccccc1 ZINC000569146931 946822631 /nfs/dbraw/zinc/82/26/31/946822631.db2.gz SKQNOPYAFGHOSL-JTHBVZDNSA-N 0 3 414.615 4.183 20 0 HIADHN O[C@H](CN[C@@H]1CCOc2c(Cl)cccc21)COc1ccccc1C(F)(F)F ZINC000569166057 946829531 /nfs/dbraw/zinc/82/95/31/946829531.db2.gz AOMJFXYZBYAORA-MLGOLLRUSA-N 0 3 401.812 4.212 20 0 HIADHN Cc1cc(C)c(NC(=O)CN[C@@H]2CCN(C)[C@H]2c2ccc(Cl)c(F)c2)c(C)c1 ZINC000569293296 946853511 /nfs/dbraw/zinc/85/35/11/946853511.db2.gz YOVQRECRDHUKHV-KNQAVFIVSA-N 0 3 403.929 4.378 20 0 HIADHN CC[C@@H](NCc1cccc(N2C(=O)N[C@@](C)(C3CC3)C2=O)c1)c1cccc(OC)c1 ZINC000569389122 946864479 /nfs/dbraw/zinc/86/44/79/946864479.db2.gz QVWPHJVBHJAKFM-QPPBQGQZSA-N 0 3 407.514 4.161 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)C(C)(C)c2csc(-c3cc(F)ccc3F)n2)CN1C1CC1 ZINC000569631248 946904357 /nfs/dbraw/zinc/90/43/57/946904357.db2.gz FFVMBJOGASDXON-OCCSQVGLSA-N 0 3 405.514 4.107 20 0 HIADHN CN1CC[C@H](NCc2nc3cc(Br)ccc3[nH]2)[C@@H]1c1ccc(F)c(F)c1 ZINC000569970781 947057394 /nfs/dbraw/zinc/05/73/94/947057394.db2.gz XTOQNSCZCUIIEY-LPHOPBHVSA-N 0 3 421.289 4.139 20 0 HIADHN O=C(c1ccc(CN[C@H](Cc2ccccc2F)c2ccccc2)cc1)N1CCOCC1 ZINC000569997328 947065879 /nfs/dbraw/zinc/06/58/79/947065879.db2.gz XAAMBHCQIIGCRE-RUZDIDTESA-N 0 3 418.512 4.372 20 0 HIADHN CCCOc1c(CN2CC[C@@](CO)(Cc3ccc(F)cc3)C2)cccc1OCC ZINC000570128409 947107968 /nfs/dbraw/zinc/10/79/68/947107968.db2.gz INYITNWOOYJVDK-XMMPIXPASA-N 0 3 401.522 4.440 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1ccc(CN(C(C)=O)C(C)C)cc1)c1ccco1 ZINC000570268183 947178384 /nfs/dbraw/zinc/17/83/84/947178384.db2.gz YODUIIOSQQTSSV-UWJYYQICSA-N 0 3 414.550 4.287 20 0 HIADHN CN1CCC(N(Cc2ccccc2Br)C(=O)C2CCSCC2)CC1 ZINC000570374317 947226344 /nfs/dbraw/zinc/22/63/44/947226344.db2.gz TYWJALJPFSTUBY-UHFFFAOYSA-N 0 3 411.409 4.015 20 0 HIADHN CN(C)C[C@H](NC(=O)N[C@H]1CCO[C@H]1c1ccc(F)c(F)c1)c1ccc(Cl)cc1 ZINC000570380189 947227754 /nfs/dbraw/zinc/22/77/54/947227754.db2.gz JLNIHPPPQOCCJQ-UFYCRDLUSA-N 0 3 423.891 4.050 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)c1ccc(COc2ccc(F)cc2)o1)c1ccco1 ZINC000570476516 947259919 /nfs/dbraw/zinc/25/99/19/947259919.db2.gz JTCZNHLLEMCTIQ-DNVCBOLYSA-N 0 3 400.450 4.450 20 0 HIADHN CC(C)c1nc2cc(NC(=O)NC[C@@H]3CN(Cc4ccccc4)CCCO3)ccc2o1 ZINC000570503905 947270357 /nfs/dbraw/zinc/27/03/57/947270357.db2.gz VLXQZBPCFOOOLG-HXUWFJFHSA-N 0 3 422.529 4.364 20 0 HIADHN CCOCCC1(CNC(=O)[C@@H]2CN(Cc3ccccc3)CCC2(F)F)CCCC1 ZINC000570832924 947364760 /nfs/dbraw/zinc/36/47/60/947364760.db2.gz DAZZEZDXGBKQMF-FQEVSTJZSA-N 0 3 408.533 4.247 20 0 HIADHN Cc1cc(NC(=O)CN(C)[C@H]2CC[C@@H](C(F)(F)F)CC2)n(-c2ccccc2F)n1 ZINC000570847854 947367327 /nfs/dbraw/zinc/36/73/27/947367327.db2.gz BZULXNREYCKABQ-GASCZTMLSA-N 0 3 412.431 4.311 20 0 HIADHN CC(C)Cc1ccc([C@@H](CNC(=O)c2cc(=O)[nH]c3cc(F)ccc32)N(C)C)cc1 ZINC000570879612 947379693 /nfs/dbraw/zinc/37/96/93/947379693.db2.gz GDEAPWVERNNOID-JOCHJYFZSA-N 0 3 409.505 4.311 20 0 HIADHN Cc1nn(C)c2sc([C@H](C)N[C@@H]3CCCN([C@H](C)c4ccccc4F)C3=O)cc12 ZINC000571067147 947467586 /nfs/dbraw/zinc/46/75/86/947467586.db2.gz MSKBSOOUPAJYNC-QMTMVMCOSA-N 0 3 414.550 4.485 20 0 HIADHN COc1ccc(CN(CCCn2c3ccccc3[nH]c2=O)CCc2ccccn2)cc1 ZINC000571138033 947526353 /nfs/dbraw/zinc/52/63/53/947526353.db2.gz VGZLEAFWRUJIKH-UHFFFAOYSA-N 0 3 416.525 4.281 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)Nc1ccc(C(=O)N2CCCC[C@@H]2C)cc1 ZINC000571307800 947586294 /nfs/dbraw/zinc/58/62/94/947586294.db2.gz VMWQATDLSQSBGY-FQEVSTJZSA-N 0 3 414.594 4.431 20 0 HIADHN COc1ccc(-c2nn(Cc3ccccc3)cc2CN(C)C[C@H](C)OC)cc1OC ZINC000571364517 947622835 /nfs/dbraw/zinc/62/28/35/947622835.db2.gz ADZKQWCLGHLNDJ-SFHVURJKSA-N 0 3 409.530 4.082 20 0 HIADHN C[C@@H](c1ccccc1)N1CCC(NC(=O)C2(c3cccc(Cl)c3)CC(=O)C2)CC1 ZINC000571574051 947709147 /nfs/dbraw/zinc/70/91/47/947709147.db2.gz GTWGKPGIOHLDBN-KRWDZBQOSA-N 0 3 410.945 4.283 20 0 HIADHN CCN1CC[C@H](NCC(=O)Nc2ccc(SC)cc2)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000571584466 947714800 /nfs/dbraw/zinc/71/48/00/947714800.db2.gz XBLNODVMUQKTBO-RXVVDRJESA-N 0 3 423.504 4.189 20 0 HIADHN C[C@@H]1CN(c2ccc(CN[C@@H]3CCc4c3cccc4Br)cn2)C[C@H](C)O1 ZINC000571666433 947741424 /nfs/dbraw/zinc/74/14/24/947741424.db2.gz CRVZQDPUOGUTLT-QEEYODRMSA-N 0 3 416.363 4.235 20 0 HIADHN NS(=O)(=O)c1ccc2c(c1)[C@H](N[C@H](Cc1ccccc1)c1ccccc1)CCC2 ZINC000571725234 947765060 /nfs/dbraw/zinc/76/50/60/947765060.db2.gz WEKSIONBWLFICB-DNQXCXABSA-N 0 3 406.551 4.285 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)c1ccc(F)c(NC(C)=O)c1)c1ccc(Cl)cc1 ZINC000571781613 947779300 /nfs/dbraw/zinc/77/93/00/947779300.db2.gz ZBKWGLWTMSTPSF-FQEVSTJZSA-N 0 3 405.901 4.250 20 0 HIADHN COc1ccc(CN2CCC[C@H](CNC(=O)Nc3cccc(F)c3)C2)c(C)c1OC ZINC000571961205 947822458 /nfs/dbraw/zinc/82/24/58/947822458.db2.gz WJSYXJCNMYBNNO-QGZVFWFLSA-N 0 3 415.509 4.185 20 0 HIADHN CCc1c(NC(=O)[C@H]2CCCN(Cc3cccnc3)C2)cnn1-c1ccc(Cl)cc1 ZINC000571971719 947825557 /nfs/dbraw/zinc/82/55/57/947825557.db2.gz JVGZITHRBQDXML-SFHVURJKSA-N 0 3 423.948 4.334 20 0 HIADHN CC(C)NS(=O)(=O)Cc1ccccc1CN[C@H]1CCCc2c3ccccc3[nH]c21 ZINC000572039670 947831905 /nfs/dbraw/zinc/83/19/05/947831905.db2.gz RCPRZDQROZDOOR-QFIPXVFZSA-N 0 3 411.571 4.163 20 0 HIADHN CN1CCCN(c2ccc(-c3noc([C@H]4C[C@H]4c4ccccc4Cl)n3)cn2)CC1 ZINC000572085613 947843625 /nfs/dbraw/zinc/84/36/25/947843625.db2.gz UMEDVDLYVXCUPH-ROUUACIJSA-N 0 3 409.921 4.198 20 0 HIADHN COc1cc(CNCc2ccc(OCc3cn4cccc(C)c4n3)cc2)ccc1C#N ZINC000572290763 947877399 /nfs/dbraw/zinc/87/73/99/947877399.db2.gz JRBLQWOBFCAVLX-UHFFFAOYSA-N 0 3 412.493 4.392 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)[C@H]1C[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000572309969 947880206 /nfs/dbraw/zinc/88/02/06/947880206.db2.gz LLJXHQAOWBJXNJ-BZSNNMDCSA-N 0 3 405.325 4.302 20 0 HIADHN CCN(CC)[C@H](CN[C@@H](c1nnc[nH]1)c1ccc(F)cc1)c1ccccc1Cl ZINC000572307654 947880495 /nfs/dbraw/zinc/88/04/95/947880495.db2.gz XQFHDBFXKNKERT-WOJBJXKFSA-N 0 3 401.917 4.359 20 0 HIADHN CCOc1c(Br)cc(CN(C)[C@@H]2CCCOC2)cc1Br ZINC000572407817 947896496 /nfs/dbraw/zinc/89/64/96/947896496.db2.gz GCLUZIWIEVKYRN-GFCCVEGCSA-N 0 3 407.146 4.221 20 0 HIADHN COCC(=O)Nc1cccc(CN[C@@H](Cc2ccccc2)c2ccc(OC)cc2)c1 ZINC000572414125 947897808 /nfs/dbraw/zinc/89/78/08/947897808.db2.gz IVIXJVKCAWACBA-DEOSSOPVSA-N 0 3 404.510 4.354 20 0 HIADHN Fc1ccc([C@H](NCCc2ccc(OCc3ccccc3)cc2)c2nnc[nH]2)cc1 ZINC000572427952 947899860 /nfs/dbraw/zinc/89/98/60/947899860.db2.gz HENPIUUBOGIHSG-QHCPKHFHSA-N 0 3 402.473 4.445 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)Nc2ccc([C@H](C)N3CCOCC3)cc2)N(C)C)cc1 ZINC000572440935 947906255 /nfs/dbraw/zinc/90/62/55/947906255.db2.gz RWQAWNGNJCDUJZ-YADARESESA-N 0 3 424.589 4.067 20 0 HIADHN CC(C)Cc1ccc([C@H](CNC(=O)c2ccc(CN3CCCC3=O)cc2)N(C)C)cc1 ZINC000572624591 947959361 /nfs/dbraw/zinc/95/93/61/947959361.db2.gz RHTFXIFNGMTWGF-DEOSSOPVSA-N 0 3 421.585 4.040 20 0 HIADHN Cc1nn(-c2ccc(Br)cc2)cc1CN1CCC[C@@](CO)(C(C)C)C1 ZINC000572669367 947975553 /nfs/dbraw/zinc/97/55/53/947975553.db2.gz VLIAHKPUVRWCAN-HXUWFJFHSA-N 0 3 406.368 4.174 20 0 HIADHN C[C@H]1C[C@@H]1N1CCN(C(=O)c2ccc(Br)c(C(F)(F)F)c2)C[C@@H](C)C1 ZINC000572670965 947975832 /nfs/dbraw/zinc/97/58/32/947975832.db2.gz JSNWBQPHRCXOAF-MKBNYLNASA-N 0 3 419.285 4.270 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3CC[C@H](c4cccc(F)c4)C3)c(C)c2)CC1 ZINC000572669230 947976123 /nfs/dbraw/zinc/97/61/23/947976123.db2.gz OYUKPALZLPKPQB-FQEVSTJZSA-N 0 3 410.537 4.297 20 0 HIADHN CN(C)C[C@@H](NC(=O)Nc1ccc(NC(=O)c2ccco2)cc1)c1ccc(F)cc1 ZINC000572862418 948023888 /nfs/dbraw/zinc/02/38/88/948023888.db2.gz DMSOBPQBRZQZJQ-LJQANCHMSA-N 0 3 410.449 4.095 20 0 HIADHN Cc1cc(-c2cc(C(=O)N3[C@@H]4CC[C@H]3CCN(C)C4)c3cnn(C(C)C)c3n2)c(C)o1 ZINC000573168315 948099071 /nfs/dbraw/zinc/09/90/71/948099071.db2.gz PSIGLJQHQFBPCM-ZWKOTPCHSA-N 0 3 421.545 4.198 20 0 HIADHN C/C(=C/c1ccccc1OC(F)F)CN1CCC(C(=O)NCC(F)(F)F)CC1 ZINC000573495577 948218902 /nfs/dbraw/zinc/21/89/02/948218902.db2.gz MTHFUUOKNDQMQH-RAXLEYEMSA-N 0 3 406.395 4.082 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)N1CCC[C@H](c2nc3ccc(F)cc3o2)C1 ZINC000573520344 948228955 /nfs/dbraw/zinc/22/89/55/948228955.db2.gz PLSJJGONXVCEQF-MJGOQNOKSA-N 0 3 424.520 4.376 20 0 HIADHN CS(=O)(=O)Nc1cccc(CNCc2ccc(Oc3ccc(F)cc3)cc2)c1 ZINC000573630392 948257631 /nfs/dbraw/zinc/25/76/31/948257631.db2.gz SRUNBBAPSJCFIE-UHFFFAOYSA-N 0 3 400.475 4.279 20 0 HIADHN CN(C)C[C@@H](NC(=O)NCCc1csc(C(C)(C)C)n1)c1ccc(Cl)cc1 ZINC000573865903 948314320 /nfs/dbraw/zinc/31/43/20/948314320.db2.gz VQXOXZQOHYLWNW-QGZVFWFLSA-N 0 3 408.999 4.239 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)c1cccc(-c2noc(C(F)(F)F)n2)c1 ZINC000573871200 948315282 /nfs/dbraw/zinc/31/52/82/948315282.db2.gz UHCDWLGSJBCMPZ-UHFFFAOYSA-N 0 3 410.440 4.094 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)[C@H](C)Oc1ccc(Br)cc1)c1ccco1 ZINC000573875608 948316857 /nfs/dbraw/zinc/31/68/57/948316857.db2.gz VGKMCDHDCKPPKX-JKIFEVAISA-N 0 3 409.324 4.055 20 0 HIADHN C[C@@H](NC1CCN(Cc2ccc(Br)cc2)CC1)c1cn2ccccc2n1 ZINC000574025932 948351267 /nfs/dbraw/zinc/35/12/67/948351267.db2.gz JNNLDJYYVJBKLJ-MRXNPFEDSA-N 0 3 413.363 4.412 20 0 HIADHN Cc1ccc2[nH]c3c(c2c1)CCC[C@H]3NCc1ccc(S(=O)(=O)N2CCCC2)cc1 ZINC000574311751 948408737 /nfs/dbraw/zinc/40/87/37/948408737.db2.gz ASXLMVVJULZXFH-HSZRJFAPSA-N 0 3 423.582 4.428 20 0 HIADHN CC(=O)c1ccc(OCCCC(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)cc1 ZINC000574424186 948435869 /nfs/dbraw/zinc/43/58/69/948435869.db2.gz MXZLVGDLTYRHOC-NRFANRHFSA-N 0 3 402.922 4.121 20 0 HIADHN Cc1ccc(C[C@@H](NC[C@H](O)COc2cccc3[nH]ccc32)c2ccccn2)cc1 ZINC000574961745 948566090 /nfs/dbraw/zinc/56/60/90/948566090.db2.gz QQOQLIHXEQVQAN-GBXCKJPGSA-N 0 3 401.510 4.185 20 0 HIADHN CC(C)c1ccc(CCNC(=O)CN[C@H]2c3ccccc3CC23CCOCC3)cc1 ZINC000574964452 948566317 /nfs/dbraw/zinc/56/63/17/948566317.db2.gz IWSFJTFLGRPLBQ-VWLOTQADSA-N 0 3 406.570 4.153 20 0 HIADHN O=C(CNC1(c2ccccc2)CCOCC1)Nc1ccc(OC(F)F)c(Cl)c1 ZINC000575015906 948573552 /nfs/dbraw/zinc/57/35/52/948573552.db2.gz WEBFWBYZQLFTNJ-UHFFFAOYSA-N 0 3 410.848 4.175 20 0 HIADHN COc1cc(CNCc2ccc3cnn(C)c3c2)ccc1OCc1c(C)noc1C ZINC000575104339 948596172 /nfs/dbraw/zinc/59/61/72/948596172.db2.gz CUVUVIQCIMGDCA-UHFFFAOYSA-N 0 3 406.486 4.056 20 0 HIADHN C[C@H](NC(=O)CNC1(c2ccccc2)CCOCC1)c1ccc(Cl)c(Cl)c1 ZINC000575151571 948605599 /nfs/dbraw/zinc/60/55/99/948605599.db2.gz XGEDZCOKQHGROJ-HNNXBMFYSA-N 0 3 407.341 4.466 20 0 HIADHN CCc1ccccc1NC(=O)[C@H](C)N[C@H]1CCN(CC)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000575198480 948626976 /nfs/dbraw/zinc/62/69/76/948626976.db2.gz LEKYNPODYAFVNR-FSJXIACGSA-N 0 3 419.491 4.418 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)c2cccc(Br)c2Cl)cc1 ZINC000575204878 948630234 /nfs/dbraw/zinc/63/02/34/948630234.db2.gz TVGBCAMQAPSZLL-MRXNPFEDSA-N 0 3 411.727 4.144 20 0 HIADHN CC[C@]1(c2ccc(Cl)cc2)NC(=O)N(C2CCN(Cc3ccccc3)CC2)C1=O ZINC000575344741 948649578 /nfs/dbraw/zinc/64/95/78/948649578.db2.gz OLVFFIYQMWHPCT-HSZRJFAPSA-N 0 3 411.933 4.162 20 0 HIADHN NS(=O)(=O)c1ccc2c(c1)[C@H](NCc1cccc(COc3ccccc3)c1)CCC2 ZINC000575371664 948661605 /nfs/dbraw/zinc/66/16/05/948661605.db2.gz UYMZSYKTSDCNRQ-XMMPIXPASA-N 0 3 422.550 4.080 20 0 HIADHN COc1ccc(CN2CC[C@](CO)(Cc3ccc(F)cc3)C2)cc1OCC(C)C ZINC000575787303 948710062 /nfs/dbraw/zinc/71/00/62/948710062.db2.gz CGYYAVPRMBIFPS-DEOSSOPVSA-N 0 3 401.522 4.296 20 0 HIADHN Fc1ccc([C@@H](NCC2(c3cccc(Cl)c3)CCOCC2)c2nnc[nH]2)cc1 ZINC000575886853 948754439 /nfs/dbraw/zinc/75/44/39/948754439.db2.gz CPTSNXKSRSUGLE-LJQANCHMSA-N 0 3 400.885 4.025 20 0 HIADHN CC(=O)N1C[C@@H]2CCC[C@H](N[C@@H](C(=O)c3c[nH]c4ccccc34)c3ccccc3)[C@H]2C1 ZINC000575903200 948765887 /nfs/dbraw/zinc/76/58/87/948765887.db2.gz SNTMZQMXJHXADS-JFTIDPPCSA-N 0 3 415.537 4.329 20 0 HIADHN FC(F)(c1cnc(Cl)nc1Cl)N1CCC[C@@H]2CN(Cc3ccccc3)C[C@H]21 ZINC001164626444 719054805 /nfs/dbraw/zinc/05/48/05/719054805.db2.gz RFBZCFCRSAVZTF-GDBMZVCRSA-N 0 3 413.299 4.429 20 0 HIADHN Clc1cccc2nc(Cl)nc(N3CC[C@@H]4[C@@H]3CCN4Cc3cccnc3)c12 ZINC001164722129 720384046 /nfs/dbraw/zinc/38/40/46/720384046.db2.gz CCGQCVJPESUEEE-SJORKVTESA-N 0 3 400.313 4.185 20 0 HIADHN c1cc2c(nc(-c3ccncc3)nc2N2CC[C@@H]3[C@@H]2CCN3Cc2cccnc2)s1 ZINC001164723936 720469125 /nfs/dbraw/zinc/46/91/25/720469125.db2.gz DKHGFSNKRMEZQZ-UXHICEINSA-N 0 3 414.538 4.002 20 0 HIADHN FC(F)(c1ccc(Cl)c(Cl)n1)N1CCCn2cnc(CNC3CCC3)c2C1 ZINC001164836295 720738552 /nfs/dbraw/zinc/73/85/52/720738552.db2.gz CXPKVOKGKYTJHS-UHFFFAOYSA-N 0 3 416.303 4.182 20 0 HIADHN Cc1csc2c1nc(Cl)cc2N1CCN2C[C@@H](OCc3cccnc3)C[C@H]2C1 ZINC001164865672 721116837 /nfs/dbraw/zinc/11/68/37/721116837.db2.gz OFQYSRISGPKJNF-IRXDYDNUSA-N 0 3 414.962 4.133 20 0 HIADHN Cn1cc(CN2CC[C@@H]3CN(c4nc(Cl)ccc4-c4ccccc4)C[C@H]3C2)cn1 ZINC001164765599 721127737 /nfs/dbraw/zinc/12/77/37/721127737.db2.gz JNMHETSSWNDTFK-WOJBJXKFSA-N 0 3 407.949 4.094 20 0 HIADHN Cn1cc(CN2CC[C@@H]3CN(c4c(Cl)ccc5ccc(Cl)nc54)C[C@H]3C2)cn1 ZINC001164768941 721235741 /nfs/dbraw/zinc/23/57/41/721235741.db2.gz YXGUHAWHZRUYJM-IAGOWNOFSA-N 0 3 416.356 4.233 20 0 HIADHN Cc1ccc(C)c(-c2ccc(N3CCN4C[C@@H](Oc5cccc(F)c5)C[C@H]4C3)nn2)c1 ZINC001164905323 721557056 /nfs/dbraw/zinc/55/70/56/721557056.db2.gz GSIKRIFFYXMXIN-UNMCSNQZSA-N 0 3 418.516 4.241 20 0 HIADHN Cc1cncc(COC[C@]23CCC[C@@H]2CN(c2ncccc2CN2CCCC2)C3)c1 ZINC001164803615 721601697 /nfs/dbraw/zinc/60/16/97/721601697.db2.gz WIUBTNXPTKOBGX-ILBGXUMGSA-N 0 3 406.574 4.204 20 0 HIADHN COc1ccc2cnc(N3CCC(F)(F)[C@]4(CCN(Cc5ccccn5)C4)C3)cc2c1 ZINC001164906560 721715528 /nfs/dbraw/zinc/71/55/28/721715528.db2.gz MUKXILQJCRLRKR-QHCPKHFHSA-N 0 3 424.495 4.376 20 0 HIADHN FC1(F)CCN(c2ccc(-c3ccncc3)cn2)C[C@]12CCN(Cc1ccccn1)C2 ZINC001164908349 721722054 /nfs/dbraw/zinc/72/20/54/721722054.db2.gz XFYLDKXVKNHLMA-HSZRJFAPSA-N 0 3 421.495 4.276 20 0 HIADHN COc1ccc2c(ccnc2N(C)C2CCN(Cc3c(OC)cccc3OC)CC2)c1 ZINC001165023424 721839488 /nfs/dbraw/zinc/83/94/88/721839488.db2.gz WZWOMEJMHZCEJE-UHFFFAOYSA-N 0 3 421.541 4.361 20 0 HIADHN Clc1cc(N2CC[C@@H]3CN(Cc4cccnc4)CCO[C@H]3C2)c2ccsc2n1 ZINC001164982518 722110106 /nfs/dbraw/zinc/11/01/06/722110106.db2.gz WWCCPSJSZHOQPM-APWZRJJASA-N 0 3 414.962 4.072 20 0 HIADHN Cc1cc(N2CC[C@H]3CN(Cc4cccnc4)CCO[C@@H]3C2)nc2c(Cl)cccc12 ZINC001164984657 722133631 /nfs/dbraw/zinc/13/36/31/722133631.db2.gz YGGYPQNWHBOKRV-SIKLNZKXSA-N 0 3 422.960 4.319 20 0 HIADHN CCn1ccnc1[C@@H]1CCCCN1C(=O)[C@@H](C)N1CCC(Cc2ccccc2)CC1 ZINC000435991576 861269615 /nfs/dbraw/zinc/26/96/15/861269615.db2.gz JJDSZAWOEXMCNZ-OFNKIYASSA-N 0 3 408.590 4.300 20 0 HIADHN Cc1cc(C(=O)N2CCC(C)CC2)ccc1NC(=O)N(CCN(C)C)C1CCCC1 ZINC000436011997 861303292 /nfs/dbraw/zinc/30/32/92/861303292.db2.gz SCSNMOCHWFFBRW-UHFFFAOYSA-N 0 3 414.594 4.205 20 0 HIADHN S=C(Nc1cccc(Br)c1)NC1CCN(Cc2ccccc2)CC1 ZINC000008104616 845475743 /nfs/dbraw/zinc/47/57/43/845475743.db2.gz JUEWQRXELBWHPI-UHFFFAOYSA-N 0 3 404.377 4.400 20 0 HIADHN COc1ccc(CNC(=O)[C@@H](C)N[C@@H](c2ccc(Cl)cc2)C(C)C)cc1OC ZINC000011103634 845754292 /nfs/dbraw/zinc/75/42/92/845754292.db2.gz GJXJBXMLBBVALQ-QVKFZJNVSA-N 0 3 404.938 4.349 20 0 HIADHN CCOC(=O)Nc1ccc2c(CN(C)CCOc3cccc(C)c3)cc(=O)oc2c1 ZINC000015100481 846009788 /nfs/dbraw/zinc/00/97/88/846009788.db2.gz XEVXEMCDZMLIRH-UHFFFAOYSA-N 0 3 410.470 4.181 20 0 HIADHN COc1ccc(CNC(=S)NC[C@H](c2cccs2)N2CCC(C)CC2)cc1 ZINC000016241516 846141658 /nfs/dbraw/zinc/14/16/58/846141658.db2.gz RPFRXUASSANMKI-LJQANCHMSA-N 0 3 403.617 4.194 20 0 HIADHN FC(F)(F)Oc1ccc(NC(=S)N2CCCN(Cc3ccccc3)CC2)cc1 ZINC000017517741 846255368 /nfs/dbraw/zinc/25/53/68/846255368.db2.gz NEVWRQAUHNIIHZ-UHFFFAOYSA-N 0 3 409.477 4.490 20 0 HIADHN CCC(=O)c1ccc(OCC(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)cc1 ZINC000018011655 846283452 /nfs/dbraw/zinc/28/34/52/846283452.db2.gz OGGCSEWHJVIWSZ-FQEVSTJZSA-N 0 3 414.571 4.309 20 0 HIADHN [O-]c1ccc2cc(Br)ccc2c1C[NH+]1CCN(Cc2ccncc2)CC1 ZINC000020637700 846386285 /nfs/dbraw/zinc/38/62/85/846386285.db2.gz CMICLALQCMWIEQ-UHFFFAOYSA-N 0 3 412.331 4.021 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cc(-c2csc(C)n2)c[nH]1)c1cccc(OC)c1 ZINC000021071888 846402828 /nfs/dbraw/zinc/40/28/28/846402828.db2.gz OXLYASRPIDLYEA-OAQYLSRUSA-N 0 3 412.559 4.268 20 0 HIADHN COc1cccc(Nc2nnc(SCC(=O)C(C#N)c3nc(C)cs3)s2)c1 ZINC000022723361 846609277 /nfs/dbraw/zinc/60/92/77/846609277.db2.gz VELHZUVIZKTGEJ-CYBMUJFWSA-N 0 3 417.541 4.024 20 0 HIADHN COc1cccc(Nc2nnc(SCC(=O)C(C#N)c3nc(C)cs3)s2)c1 ZINC000022723363 846609773 /nfs/dbraw/zinc/60/97/73/846609773.db2.gz VELHZUVIZKTGEJ-ZDUSSCGKSA-N 0 3 417.541 4.024 20 0 HIADHN COc1cc(CNCc2ccc(C(F)(F)F)cc2)ccc1OCC(=O)N1CCCC1 ZINC000022744418 846613836 /nfs/dbraw/zinc/61/38/36/846613836.db2.gz ONHMBROVTOBHCS-UHFFFAOYSA-N 0 3 422.447 4.005 20 0 HIADHN CC(C)(C)OC(=O)NCc1ccc(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)cc1 ZINC000023740815 846744233 /nfs/dbraw/zinc/74/42/33/846744233.db2.gz SXTHKMCTLSTKRP-QFIPXVFZSA-N 0 3 423.557 4.278 20 0 HIADHN CN(C)Cc1ccccc1NC(=O)c1ccc2c(c1)C[C@H](c1ccccc1)OC2=O ZINC000024808991 846870622 /nfs/dbraw/zinc/87/06/22/846870622.db2.gz FZKAKTQVBNWJTJ-HSZRJFAPSA-N 0 3 400.478 4.455 20 0 HIADHN CN(C)Cc1ccccc1NC(=O)c1ccc2c(c1)C[C@@H](c1ccccc1)OC2=O ZINC000024808995 846870728 /nfs/dbraw/zinc/87/07/28/846870728.db2.gz FZKAKTQVBNWJTJ-QHCPKHFHSA-N 0 3 400.478 4.455 20 0 HIADHN COc1ccc(C(=O)C2CCN(CCCc3nc(-c4cccs4)no3)CC2)cc1 ZINC000025060911 846915314 /nfs/dbraw/zinc/91/53/14/846915314.db2.gz HQDFEHWNENSVGH-UHFFFAOYSA-N 0 3 411.527 4.334 20 0 HIADHN CN(C)CCn1c(=O)oc2ccc(NC(=O)Nc3cc(Cl)cc(Cl)c3)cc21 ZINC000436389716 861733523 /nfs/dbraw/zinc/73/35/23/861733523.db2.gz NVOFDKPEPBAOQC-UHFFFAOYSA-N 0 3 409.273 4.107 20 0 HIADHN CCCCc1ccc([C@@H](NCC(=O)Nc2oc(C)c3c2c(=O)[nH]nc3C)C(C)C)cc1 ZINC000025817303 847041606 /nfs/dbraw/zinc/04/16/06/847041606.db2.gz CRVYFOZVAPNDCI-QFIPXVFZSA-N 0 3 424.545 4.401 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cc(C)nc2c1cnn2C(C)C)c1cccc(OC)c1 ZINC000025862511 847048411 /nfs/dbraw/zinc/04/84/11/847048411.db2.gz GCZJWXOGUKKHQS-JOCHJYFZSA-N 0 3 423.561 4.142 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1C(=O)NC[C@H](C(C)C)N1CCc2ccccc2C1 ZINC000025918143 847057104 /nfs/dbraw/zinc/05/71/04/847057104.db2.gz CPJUQCLPYDPZQW-XMMPIXPASA-N 0 3 416.569 4.302 20 0 HIADHN COCCn1c(SCC(=O)C(C#N)c2nc(C)cs2)nc2cc(Cl)ccc21 ZINC000026100475 847084161 /nfs/dbraw/zinc/08/41/61/847084161.db2.gz ILOAYTSXHSHGGC-CYBMUJFWSA-N 0 3 420.947 4.070 20 0 HIADHN COc1cc2c(cc1OC)[C@H](c1cccs1)N(C[C@@H](O)Cc1ccccc1)CC2 ZINC000026353519 847130979 /nfs/dbraw/zinc/13/09/79/847130979.db2.gz JRUCEUSQJRONEO-YADARESESA-N 0 3 409.551 4.316 20 0 HIADHN COc1ccc(OC)c([C@@H](C)NC[C@@H](O)COc2c(Cl)cccc2Cl)c1 ZINC000026714797 847188711 /nfs/dbraw/zinc/18/87/11/847188711.db2.gz MYEMXWSYKQWLHQ-CHWSQXEVSA-N 0 3 400.302 4.101 20 0 HIADHN COc1ccc(OC)c([C@@H](C)NC[C@H](O)COc2cc(Cl)ccc2Cl)c1 ZINC000026715385 847189970 /nfs/dbraw/zinc/18/99/70/847189970.db2.gz PBCMBMIDUUNUNR-OCCSQVGLSA-N 0 3 400.302 4.101 20 0 HIADHN Cc1ccc(C(=O)C2CCN(C[C@@H](O)COCc3ccccc3Cl)CC2)c(C)c1 ZINC000027211640 847267465 /nfs/dbraw/zinc/26/74/65/847267465.db2.gz RBEDRGMOAURTAA-OAQYLSRUSA-N 0 3 415.961 4.429 20 0 HIADHN COc1cccc([C@H](CNC(=O)Cc2c(C)nc3ccccc3c2C)N2CCCC2)c1 ZINC000027340446 847285978 /nfs/dbraw/zinc/28/59/78/847285978.db2.gz JJIHGTMQXNRTFG-VWLOTQADSA-N 0 3 417.553 4.356 20 0 HIADHN CC1CCN([C@H](CNC(=O)Cc2cnn(-c3ccccc3)c2)c2cccs2)CC1 ZINC000027575407 847323531 /nfs/dbraw/zinc/32/35/31/847323531.db2.gz RSRUXAIHVOAMIO-OAQYLSRUSA-N 0 3 408.571 4.066 20 0 HIADHN O=C(NC1CCN(CCc2ccccc2)CC1)c1ccccc1C(=O)c1cccs1 ZINC000027931102 847365416 /nfs/dbraw/zinc/36/54/16/847365416.db2.gz DUYRREGKKZJPDF-UHFFFAOYSA-N 0 3 418.562 4.416 20 0 HIADHN COc1ccc(NC(=O)[C@@H](C)N[C@H](C)c2ccc(Br)cc2)cc1OC ZINC000028893865 847474634 /nfs/dbraw/zinc/47/46/34/847474634.db2.gz FAIVWXWBTKIXFJ-CHWSQXEVSA-N 0 3 407.308 4.144 20 0 HIADHN O=C(NCCCCN1CCN(c2cccc(C(F)(F)F)c2)CC1)c1ccccc1F ZINC000029166122 847517924 /nfs/dbraw/zinc/51/79/24/847517924.db2.gz VVFPZNXFTDIKTR-UHFFFAOYSA-N 0 3 423.454 4.177 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)c1ccc(Cl)c(N2CCCC2=O)c1 ZINC000029178531 847521108 /nfs/dbraw/zinc/52/11/08/847521108.db2.gz HPCAOSKZGDJXSJ-HXUWFJFHSA-N 0 3 411.933 4.034 20 0 HIADHN Cc1noc(CSc2ccc(C(=O)N[C@@H](CN3CCCC3)c3ccccc3)cc2)n1 ZINC000029179501 847521929 /nfs/dbraw/zinc/52/19/29/847521929.db2.gz CLPDCJATNPSDHZ-NRFANRHFSA-N 0 3 422.554 4.237 20 0 HIADHN Cc1ccc(C(=O)NC[C@H](c2ccccc2)N(C)C)cc1NC(=O)c1ccccc1 ZINC000029256394 847531904 /nfs/dbraw/zinc/53/19/04/847531904.db2.gz ZRSSOYNFRYDIAF-HSZRJFAPSA-N 0 3 401.510 4.280 20 0 HIADHN Cc1cnc2c(cccc2S(=O)(=O)NCc2ccccc2CN2CCCCC2)c1 ZINC000029349932 847550119 /nfs/dbraw/zinc/55/01/19/847550119.db2.gz KHUOESNNQRIQOR-UHFFFAOYSA-N 0 3 409.555 4.008 20 0 HIADHN CCOc1cc(CNCc2ccc(F)c(C)c2)ccc1OCC(=O)N1CCCCC1 ZINC000029656740 847597743 /nfs/dbraw/zinc/59/77/43/847597743.db2.gz AXSCDRIGJXHODH-UHFFFAOYSA-N 0 3 414.521 4.214 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cc(Cl)ccc3Br)cc2)CC1 ZINC000029798973 847621805 /nfs/dbraw/zinc/62/18/05/847621805.db2.gz OHJIITINWBWMPC-UHFFFAOYSA-N 0 3 422.754 4.497 20 0 HIADHN CCN(CC)C(=O)c1ccc(NC(=O)CN(Cc2ccccc2)[C@@H](C)C2CC2)cc1 ZINC000029842368 847630933 /nfs/dbraw/zinc/63/09/33/847630933.db2.gz PTQDYMIJUWNJDD-IBGZPJMESA-N 0 3 407.558 4.408 20 0 HIADHN O=C(CC1(N2CCOCC2)CCCC1)N[C@@H](c1ccc(F)c(Cl)c1)C(F)(F)F ZINC000436463828 861813724 /nfs/dbraw/zinc/81/37/24/861813724.db2.gz APNDTAZCRVERCC-KRWDZBQOSA-N 0 3 422.850 4.234 20 0 HIADHN CC[C@@H](C)c1ccc(S(=O)(=O)NC2CCN(CCc3ccccc3)CC2)cc1 ZINC000030380696 847708763 /nfs/dbraw/zinc/70/87/63/847708763.db2.gz NBVGCTHOEUPWTK-LJQANCHMSA-N 0 3 400.588 4.186 20 0 HIADHN c1cn(-c2ccc(CNCc3cn(-c4ccccc4)nc3-c3ccccc3)cn2)cn1 ZINC000030655199 847753087 /nfs/dbraw/zinc/75/30/87/847753087.db2.gz JFIFICMVERGOCO-UHFFFAOYSA-N 0 3 406.493 4.410 20 0 HIADHN CCc1ccc([C@H](CNC(=O)c2c(C)nn(Cc3ccccc3)c2C)N(C)C)cc1 ZINC000030936942 847801091 /nfs/dbraw/zinc/80/10/91/847801091.db2.gz ZWBZEQIQMZARNX-QHCPKHFHSA-N 0 3 404.558 4.143 20 0 HIADHN O=C(NCc1ccc(OC(F)(F)F)cc1)N1CCCN(Cc2ccccc2)CC1 ZINC000031024097 847810329 /nfs/dbraw/zinc/81/03/29/847810329.db2.gz AYECEJLQNVFTOU-UHFFFAOYSA-N 0 3 407.436 4.003 20 0 HIADHN CN(C)Cc1ccccc1NC(=O)C[C@H](NC(=O)c1ccccc1)c1ccccc1 ZINC000031233418 847847732 /nfs/dbraw/zinc/84/77/32/847847732.db2.gz QKQKADKEXLXOOE-QHCPKHFHSA-N 0 3 401.510 4.248 20 0 HIADHN C[C@@H]1C[N@@H+](CC2CCN(C(=O)c3cc(Oc4ccccc4)ccc3[O-])CC2)C[C@H](C)O1 ZINC000436547425 861845785 /nfs/dbraw/zinc/84/57/85/861845785.db2.gz XMZKYJTYWFKNDN-KDURUIRLSA-N 0 3 424.541 4.146 20 0 HIADHN C[C@@H]1C[N@H+](CC2CCN(C(=O)c3cc(Oc4ccccc4)ccc3[O-])CC2)C[C@H](C)O1 ZINC000436547425 861845787 /nfs/dbraw/zinc/84/57/87/861845787.db2.gz XMZKYJTYWFKNDN-KDURUIRLSA-N 0 3 424.541 4.146 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cnn(-c2ccccc2F)c1C)c1ccsc1 ZINC000031984369 847975100 /nfs/dbraw/zinc/97/51/00/847975100.db2.gz NAUPSAIOOAPMCC-FQEVSTJZSA-N 0 3 400.523 4.194 20 0 HIADHN O=C(NC1CCN(Cc2ccccc2)CC1)c1ccccc1OCc1ccncc1 ZINC000032062771 847983821 /nfs/dbraw/zinc/98/38/21/847983821.db2.gz OXYOBRTYWWVREP-UHFFFAOYSA-N 0 3 401.510 4.055 20 0 HIADHN O=C(COc1ccccc1-c1ccccc1)NCCCN1CCc2ccccc2C1 ZINC000032399086 848019276 /nfs/dbraw/zinc/01/92/76/848019276.db2.gz NTVXTBRYDJSAAL-UHFFFAOYSA-N 0 3 400.522 4.297 20 0 HIADHN CC[C@H](CNC(=O)/C=C/c1ccc(Br)o1)N1CCc2ccccc2C1 ZINC000032445842 848028719 /nfs/dbraw/zinc/02/87/19/848028719.db2.gz XYQUGYGGCFLSEU-SYJIQKIWSA-N 0 3 403.320 4.008 20 0 HIADHN Cc1cc(C(=O)NC[C@H](c2ccccc2)N(C)C)cc(C)c1OCc1cccnc1 ZINC000032480544 848036649 /nfs/dbraw/zinc/03/66/49/848036649.db2.gz JKMZDEVYASGZGF-HSZRJFAPSA-N 0 3 403.526 4.310 20 0 HIADHN O=C(CCCc1nc(-c2cccs2)no1)NC[C@@H](c1cccs1)N1CCCC1 ZINC000032485359 848038079 /nfs/dbraw/zinc/03/80/79/848038079.db2.gz VNFHPVUKJWFYCY-HNNXBMFYSA-N 0 3 416.572 4.136 20 0 HIADHN Cc1nn(Cc2ccccc2Cl)c(Cl)c1C(=O)N[C@@H](C)CN1CCCCC1 ZINC000032662588 848060663 /nfs/dbraw/zinc/06/06/63/848060663.db2.gz DYIHVHZKZFQCCE-AWEZNQCLSA-N 0 3 409.361 4.151 20 0 HIADHN O=C(Nc1ccc([O-])c(-c2nc3ccccc3s2)c1)[C@@H]1CCC[N@@H+]1C1CCOCC1 ZINC000436605635 861866978 /nfs/dbraw/zinc/86/69/78/861866978.db2.gz PLXGTDYUEHFOMO-IBGZPJMESA-N 0 3 423.538 4.251 20 0 HIADHN O=C(Nc1ccc([O-])c(-c2nc3ccccc3s2)c1)[C@@H]1CCC[N@H+]1C1CCOCC1 ZINC000436605635 861866982 /nfs/dbraw/zinc/86/69/82/861866982.db2.gz PLXGTDYUEHFOMO-IBGZPJMESA-N 0 3 423.538 4.251 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cc(C(C)C)n(C(C)(C)C)n3)c(C)c2)CC1 ZINC000040549780 848197525 /nfs/dbraw/zinc/19/75/25/848197525.db2.gz AVXNFILSSQFFFB-UHFFFAOYSA-N 0 3 411.594 4.464 20 0 HIADHN Cc1ccc(-c2cnc(CCC(=O)NC[C@H](c3ccc(N(C)C)cc3)N(C)C)o2)cc1 ZINC000041021168 848200441 /nfs/dbraw/zinc/20/04/41/848200441.db2.gz QRAULPAMFCSRFT-JOCHJYFZSA-N 0 3 420.557 4.068 20 0 HIADHN CCN(Cc1ccc2c(c1)OCO2)C(=O)NC[C@@H](c1ccsc1)N(CC)CC ZINC000042346202 848320369 /nfs/dbraw/zinc/32/03/69/848320369.db2.gz SKFKYFJWCYNPCL-SFHVURJKSA-N 0 3 403.548 4.091 20 0 HIADHN CCOc1c(Br)cc(Br)cc1CNC[C@@H]1CCCCO1 ZINC000042816278 848356684 /nfs/dbraw/zinc/35/66/84/848356684.db2.gz BPIFUXYJDGFUJP-ZDUSSCGKSA-N 0 3 407.146 4.269 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)N1CCc2[nH]c3ccc(F)cc3c2C1 ZINC000043231460 848397445 /nfs/dbraw/zinc/39/74/45/848397445.db2.gz BXHRFGDDLZCVIN-FQEVSTJZSA-N 0 3 412.534 4.273 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)Nc1ccc(N2CCOCC2)cc1)c1cccc2ccccc21 ZINC000043303462 848406262 /nfs/dbraw/zinc/40/62/62/848406262.db2.gz XWUOELHCXASQKJ-MOPGFXCFSA-N 0 3 403.526 4.354 20 0 HIADHN CC[C@H](NC(=O)Nc1ccc(N2CCN(CC)CC2)cc1C)c1ccccc1OC ZINC000043521975 848434379 /nfs/dbraw/zinc/43/43/79/848434379.db2.gz SUQCAQFJUKIHBZ-NRFANRHFSA-N 0 3 410.562 4.418 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)cc1 ZINC000043653780 848446863 /nfs/dbraw/zinc/44/68/63/848446863.db2.gz RNMTZNXLSRELIP-LJQANCHMSA-N 0 3 400.548 4.301 20 0 HIADHN CC[C@@H](CNC(=O)Nc1ccc(NC(=O)C(C)C)cc1)N1CCc2ccccc2C1 ZINC000043674224 848447983 /nfs/dbraw/zinc/44/79/83/848447983.db2.gz VOCIKUPVSOHLPN-QFIPXVFZSA-N 0 3 408.546 4.240 20 0 HIADHN CCOc1cccc2cc([C@H](C)[NH2+]C3CCN(C(=O)c4ccccc4[O-])CC3)oc21 ZINC000436717834 861905299 /nfs/dbraw/zinc/90/52/99/861905299.db2.gz XYEIHFWFJKLNHJ-INIZCTEOSA-N 0 3 408.498 4.493 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1ccccc1C(=O)N1CCCC1)c1ccsc1 ZINC000043797157 848469195 /nfs/dbraw/zinc/46/91/95/848469195.db2.gz IPCBVVCULUNWLI-FQEVSTJZSA-N 0 3 414.575 4.189 20 0 HIADHN CC(C)(C)NC(=O)c1ccc(NC(=O)NC[C@H](c2ccccc2)N2CCCC2)cc1 ZINC000044017453 848501440 /nfs/dbraw/zinc/50/14/40/848501440.db2.gz XXXRCJVCKMOBRC-OAQYLSRUSA-N 0 3 408.546 4.174 20 0 HIADHN COc1cccc([C@@H](CNc2cc(C)nc(N)n2)c2c[nH]c3ccccc32)c1OC ZINC000045723955 848717851 /nfs/dbraw/zinc/71/78/51/848717851.db2.gz KLIRGQJQDAFZBV-GOSISDBHSA-N 0 3 403.486 4.110 20 0 HIADHN Cc1nn(CC(C)C)c(C)c1CC(=O)NC[C@H](c1cccs1)N1CCC(C)CC1 ZINC000045820294 848734741 /nfs/dbraw/zinc/73/47/41/848734741.db2.gz GHCAJMFTPIMWGR-OAQYLSRUSA-N 0 3 416.635 4.349 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N[C@@H](C)c1ccc2c(c1)CCC(=O)N2)c1ccsc1 ZINC000046253827 848812034 /nfs/dbraw/zinc/81/20/34/848812034.db2.gz HWRPPERRXCODTL-YWZLYKJASA-N 0 3 414.575 4.076 20 0 HIADHN Cc1noc(CSc2ccccc2C(=O)NC[C@H](c2ccccc2)N2CCCC2)n1 ZINC000046729426 848920594 /nfs/dbraw/zinc/92/05/94/848920594.db2.gz VHAGRIVOONWPCM-HXUWFJFHSA-N 0 3 422.554 4.237 20 0 HIADHN CCN(Cc1ccc(OC)cc1)C(=O)Nc1ccc(N2CCN(CC)CC2)cc1C ZINC000047373284 849034022 /nfs/dbraw/zinc/03/40/22/849034022.db2.gz TWDXKFHGDLLXIJ-UHFFFAOYSA-N 0 3 410.562 4.200 20 0 HIADHN N#CC(C(=O)CCNC(=O)NC12CC3CC(CC(C3)C1)C2)c1ccc2ccccc2n1 ZINC000047376461 849035153 /nfs/dbraw/zinc/03/51/53/849035153.db2.gz CQDWYECWOQCBRT-YZOPDKEQSA-N 0 3 416.525 4.069 20 0 HIADHN O=C(NCCCCN1CCN(c2cccc(C(F)(F)F)c2)CC1)c1ccsc1 ZINC000047460953 849051857 /nfs/dbraw/zinc/05/18/57/849051857.db2.gz XRTXVIFXOPXLEB-UHFFFAOYSA-N 0 3 411.493 4.099 20 0 HIADHN CC(C)CNC(=O)c1ccc(NC(=O)NC[C@H](c2ccccc2)N2CCCC2)cc1 ZINC000047729789 849099937 /nfs/dbraw/zinc/09/99/37/849099937.db2.gz MRHCXCBQBFGUMN-JOCHJYFZSA-N 0 3 408.546 4.031 20 0 HIADHN CCC(C)(C)NC(=O)c1ccc(NC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000047811258 849120570 /nfs/dbraw/zinc/12/05/70/849120570.db2.gz ZAWBKVJXHAYRSF-OAQYLSRUSA-N 0 3 408.546 4.001 20 0 HIADHN CCC(C)(C)NC(=O)c1ccc(NC(=O)N(CCN(C)C)Cc2ccccc2)cc1 ZINC000047811402 849120593 /nfs/dbraw/zinc/12/05/93/849120593.db2.gz CYKILCBDTMKTAA-UHFFFAOYSA-N 0 3 410.562 4.201 20 0 HIADHN CCCC(=O)Nc1ccc(CNC(=O)NC[C@H](c2cccs2)N2CCCC2)cc1 ZINC000047951930 849144051 /nfs/dbraw/zinc/14/40/51/849144051.db2.gz FGTZSQQCPBKUFQ-LJQANCHMSA-N 0 3 414.575 4.123 20 0 HIADHN CCCCCCn1nc(C(=O)Nc2ccccc2CN(C)C)c2ccccc2c1=O ZINC000048174250 849185623 /nfs/dbraw/zinc/18/56/23/849185623.db2.gz ABMYFZAAZGVAEB-UHFFFAOYSA-N 0 3 406.530 4.291 20 0 HIADHN CC(=O)Nc1ccc(S[C@@H](C)C(=O)NC[C@@H](c2ccccc2)N2CCCC2)cc1 ZINC000048185616 849187415 /nfs/dbraw/zinc/18/74/15/849187415.db2.gz JODSBDFBUHCQKX-JTSKRJEESA-N 0 3 411.571 4.079 20 0 HIADHN Fc1ccc(N2CCN(c3cc(CNCc4cccc(Cl)c4)ccn3)CC2)cc1 ZINC000048744987 849261812 /nfs/dbraw/zinc/26/18/12/849261812.db2.gz YBUPMXRWPMUVLE-UHFFFAOYSA-N 0 3 410.924 4.491 20 0 HIADHN COc1cc([C@@H](C)NCc2ccc(NC(C)=O)cc2)ccc1OCc1ccncc1 ZINC000048746816 849262848 /nfs/dbraw/zinc/26/28/48/849262848.db2.gz YQBOPHAGNLOYOF-QGZVFWFLSA-N 0 3 405.498 4.478 20 0 HIADHN N#CC(C(=O)[C@H]1CCCN(C(=O)c2ccc(F)cc2)C1)c1ccc2ccccc2n1 ZINC000048855301 849274760 /nfs/dbraw/zinc/27/47/60/849274760.db2.gz FTSZWTOUBNBPKT-AZUAARDMSA-N 0 3 401.441 4.103 20 0 HIADHN CCCCCCNC(=O)C(C#N)C(=O)Cc1c(C)nn(-c2ccc(Cl)cc2)c1C ZINC000049229474 849298274 /nfs/dbraw/zinc/29/82/74/849298274.db2.gz AEUIPYAXGMGNAJ-HXUWFJFHSA-N 0 3 414.937 4.090 20 0 HIADHN Cc1cc([C@@H]2CCCN2C(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)no1 ZINC000049790417 849330337 /nfs/dbraw/zinc/33/03/37/849330337.db2.gz NNEUMGNOCLCOKU-RBUKOAKNSA-N 0 3 402.564 4.364 20 0 HIADHN Cc1cc(Cl)cc2c1OCCC[C@H]2[NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1 ZINC000436825020 862006342 /nfs/dbraw/zinc/00/63/42/862006342.db2.gz BYEBMVGEFXCBQY-HXUWFJFHSA-N 0 3 414.933 4.462 20 0 HIADHN COc1ccc(NC(=O)[C@H](C)N(C)C[C@@H]2CCCO[C@@H]2c2ccccc2)c(OC)c1 ZINC000051132477 849434932 /nfs/dbraw/zinc/43/49/32/849434932.db2.gz SIMFYELLWHYEOY-WCAVRKLYSA-N 0 3 412.530 4.131 20 0 HIADHN O=C(CCN1CC=C(c2ccc(O)cc2)CC1)Nc1ccccc1Br ZINC000052306327 849568779 /nfs/dbraw/zinc/56/87/79/849568779.db2.gz MSDDRRINNFZCGH-UHFFFAOYSA-N 0 3 401.304 4.273 20 0 HIADHN O=C(CCNCc1cc(Cl)ccc1OCc1cccnc1)NC1CCCCC1 ZINC000054203363 849826387 /nfs/dbraw/zinc/82/63/87/849826387.db2.gz DLSZJUFVCYOTBH-UHFFFAOYSA-N 0 3 401.938 4.243 20 0 HIADHN Cc1ccc(NC(=O)CNC2(c3ccc(Br)cc3)CCOCC2)cc1C ZINC000054394266 849858792 /nfs/dbraw/zinc/85/87/92/849858792.db2.gz VCYNXNAIBDYTFI-UHFFFAOYSA-N 0 3 417.347 4.300 20 0 HIADHN Cc1cccc(NC(=O)CNC2(c3ccc(Br)cc3)CCOCC2)c1C ZINC000054394264 849859508 /nfs/dbraw/zinc/85/95/08/849859508.db2.gz XJLUKVKLCFRUIA-UHFFFAOYSA-N 0 3 417.347 4.300 20 0 HIADHN COc1ccc(OC(F)F)c(NC(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)c1 ZINC000054410550 849862777 /nfs/dbraw/zinc/86/27/77/849862777.db2.gz OMEWQTHDURRHNU-HOCLYGCPSA-N 0 3 405.445 4.254 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N[C@@H](c2ccccc2)c2ccccn2)C1 ZINC000054718273 849912241 /nfs/dbraw/zinc/91/22/41/849912241.db2.gz XOGFMKCSUVXSBB-UCFCWBNQSA-N 0 3 400.526 4.306 20 0 HIADHN COc1ccc(N2CCCN(Cc3cccc(C(=O)N4CCCCC4)c3)CC2)cc1 ZINC000054809738 849925633 /nfs/dbraw/zinc/92/56/33/849925633.db2.gz YUGJJTUAKIOPPF-UHFFFAOYSA-N 0 3 407.558 4.034 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)N1CCC[C@H](c2nc3ccccc3[nH]2)C1 ZINC000054920995 849942792 /nfs/dbraw/zinc/94/27/92/849942792.db2.gz IDYJDIFVHYSFFH-NZQKXSOJSA-N 0 3 417.557 4.289 20 0 HIADHN COc1ccc(NC(=O)[C@@H](C)N[C@H](C)c2ccc(OCc3cccnc3)cc2)cc1 ZINC000056144351 850253283 /nfs/dbraw/zinc/25/32/83/850253283.db2.gz WWKBVPSBORYLHE-QZTJIDSGSA-N 0 3 405.498 4.347 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)Cc2csc(-c3cccc(F)c3)n2)C1 ZINC000056168449 850267768 /nfs/dbraw/zinc/26/77/68/850267768.db2.gz FOBPZHJTJOREHL-JXFKEZNVSA-N 0 3 409.530 4.443 20 0 HIADHN CCN1CCN(c2ccc(N[C@@H](C)C(=O)Nc3ccc(Cl)cc3)c(C)c2)CC1 ZINC000056170230 850268197 /nfs/dbraw/zinc/26/81/97/850268197.db2.gz KTPSUWAUJKESKF-KRWDZBQOSA-N 0 3 400.954 4.229 20 0 HIADHN O=C(Nc1ccc(F)cc1)[C@@H](NC1CCN(Cc2ccccn2)CC1)c1ccccc1 ZINC000056182700 850274617 /nfs/dbraw/zinc/27/46/17/850274617.db2.gz DUPGPJXRGNHWKY-DEOSSOPVSA-N 0 3 418.516 4.155 20 0 HIADHN CC(C)[C@@H](NC(=O)Cc1ccc2ccccc2c1)C(=O)Nc1cccc(CN(C)C)c1 ZINC000056395028 850346808 /nfs/dbraw/zinc/34/68/08/850346808.db2.gz IDBISHWKBGXZLY-RUZDIDTESA-N 0 3 417.553 4.223 20 0 HIADHN Cc1ccccc1CN1CCCN(C(=O)Nc2ccc(-c3csnn3)cc2)CC1 ZINC000056787568 850482125 /nfs/dbraw/zinc/48/21/25/850482125.db2.gz NUXZMWPLDGUDRL-UHFFFAOYSA-N 0 3 407.543 4.253 20 0 HIADHN CN(C)Cc1cccc(NC(=O)N[C@H](C(=O)Nc2ccccc2)c2ccccc2)c1 ZINC000057089261 850546014 /nfs/dbraw/zinc/54/60/14/850546014.db2.gz LGOMFAFXRRZGDQ-QFIPXVFZSA-N 0 3 402.498 4.250 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)C2(c3ccc(Cl)cc3)CCOCC2)C1 ZINC000057263711 850594193 /nfs/dbraw/zinc/59/41/93/850594193.db2.gz MRUXLPMBNDEYNL-GCJKJVERSA-N 0 3 412.961 4.340 20 0 HIADHN CO[C@H](C(=O)Nc1ccc(N2CCN(Cc3ccccc3)CC2)cc1)c1ccccc1 ZINC000057350830 850612916 /nfs/dbraw/zinc/61/29/16/850612916.db2.gz JRTGIZQUBYUHNO-VWLOTQADSA-N 0 3 415.537 4.335 20 0 HIADHN O=C(Cc1csc(-c2ccc(Cl)s2)n1)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000057383351 850621258 /nfs/dbraw/zinc/62/12/58/850621258.db2.gz MLDCQPXNNVWUDY-HNNXBMFYSA-N 0 3 417.987 4.458 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)Nc1ccc(F)cc1Br ZINC000057758394 850709912 /nfs/dbraw/zinc/70/99/12/850709912.db2.gz SCTHEAVXFSAZSP-UHFFFAOYSA-N 0 3 416.360 4.071 20 0 HIADHN Cc1cc(NC(=O)NC[C@H](Cc2ccccc2)N(C)C)ccc1NC(=O)c1ccco1 ZINC000057793689 850719717 /nfs/dbraw/zinc/71/97/17/850719717.db2.gz ZZBGNEPGZSVJRT-FQEVSTJZSA-N 0 3 420.513 4.135 20 0 HIADHN CC[C@H](CNC(=O)Nc1ccccc1CN(CC)C(C)=O)N1CCc2ccccc2C1 ZINC000058154744 850775280 /nfs/dbraw/zinc/77/52/80/850775280.db2.gz AFCWXDPASWKKIF-HSZRJFAPSA-N 0 3 422.573 4.013 20 0 HIADHN C[C@H]1CCCCN1CCNC(=O)c1cccc(NC(=O)CCCc2cccs2)c1 ZINC000058458914 850830528 /nfs/dbraw/zinc/83/05/28/850830528.db2.gz FYRIYWUHXKWZDO-SFHVURJKSA-N 0 3 413.587 4.314 20 0 HIADHN CCCCOc1ccc(C(=O)NC2CC([NH+]3CCC(C(F)(F)F)CC3)C2)c([O-])c1 ZINC000437006374 862179137 /nfs/dbraw/zinc/17/91/37/862179137.db2.gz XLWYZHUEHCORID-UHFFFAOYSA-N 0 3 414.468 4.106 20 0 HIADHN CN(C)CCn1c(=O)oc2ccc(NC(=O)c3cc4c(s3)CCCCCC4)cc21 ZINC000058738172 850907394 /nfs/dbraw/zinc/90/73/94/850907394.db2.gz BKQWKTKIOAVVAD-UHFFFAOYSA-N 0 3 413.543 4.129 20 0 HIADHN Cc1c(C(=O)Nc2ccc3oc(=O)n(CCN(C)C)c3c2)oc2c1c(C)ccc2C ZINC000058740528 850908793 /nfs/dbraw/zinc/90/87/93/850908793.db2.gz IIXDTCOLAIPGGY-UHFFFAOYSA-N 0 3 407.470 4.080 20 0 HIADHN Cc1cccc(C2(C(=O)Nc3ccc4oc(=O)n(CCN(C)C)c4c3)CCCCC2)c1 ZINC000058740252 850909047 /nfs/dbraw/zinc/90/90/47/850909047.db2.gz DWJAEURLIDYSDM-UHFFFAOYSA-N 0 3 421.541 4.305 20 0 HIADHN Cc1ccccc1CN1CCCN([C@@H](C)C(=O)Nc2ccccc2OC(F)F)CC1 ZINC000058773543 850921210 /nfs/dbraw/zinc/92/12/10/850921210.db2.gz DLVYGCKJTRBUKK-SFHVURJKSA-N 0 3 417.500 4.131 20 0 HIADHN COC(=O)c1cc(NC(=O)NC[C@@H](c2ccccc2)N2CCCC2)ccc1Cl ZINC000059041038 850982615 /nfs/dbraw/zinc/98/26/15/850982615.db2.gz PTZGAOMLDOXFDE-IBGZPJMESA-N 0 3 401.894 4.085 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)Nc1ccc(C(=O)NC2CCCC2)cc1 ZINC000059351038 850999892 /nfs/dbraw/zinc/99/98/92/850999892.db2.gz UNVOJDGZPXMKOJ-HSZRJFAPSA-N 0 3 420.557 4.318 20 0 HIADHN Cc1cc(NC(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)n(Cc2ccccc2)n1 ZINC000060107796 851043286 /nfs/dbraw/zinc/04/32/86/851043286.db2.gz RTBNHXRKZQIJTG-UHFFFAOYSA-N 0 3 417.557 4.023 20 0 HIADHN CCCN(C(=O)c1cccc(OCCOC)c1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000060351772 851073386 /nfs/dbraw/zinc/07/33/86/851073386.db2.gz IKFYMJWFHKGUJE-QHCPKHFHSA-N 0 3 410.558 4.229 20 0 HIADHN C[C@H]1C[C@H]1C(=O)Nc1cccc(C(=O)N2CCCN(CCCc3ccccc3)CC2)c1 ZINC000060355327 851075181 /nfs/dbraw/zinc/07/51/81/851075181.db2.gz VFGJVUHXNXKGLI-GBXCKJPGSA-N 0 3 419.569 4.062 20 0 HIADHN COc1cc(CN(C)C(=O)NC[C@H](c2cccs2)N2CCCC2)ccc1SC ZINC000060532090 851136260 /nfs/dbraw/zinc/13/62/60/851136260.db2.gz ZXNNJRRLZFJLTL-QGZVFWFLSA-N 0 3 419.616 4.457 20 0 HIADHN CCCc1ccc(C(=O)CCC(=O)Nc2ccc(CN3CCN(CC)CC3)cc2)cc1 ZINC000060551747 851143939 /nfs/dbraw/zinc/14/39/39/851143939.db2.gz DKTARLBFUSHOJU-UHFFFAOYSA-N 0 3 421.585 4.378 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)CCSc3ccccc3F)cc2)CC1 ZINC000060551578 851144135 /nfs/dbraw/zinc/14/41/35/851144135.db2.gz NMVIOQUENHWLLB-UHFFFAOYSA-N 0 3 401.551 4.084 20 0 HIADHN O=C(NCc1sccc1Br)NC[C@H](c1ccccc1)N1CCCC1 ZINC000060591055 851158897 /nfs/dbraw/zinc/15/88/97/851158897.db2.gz CBBBSVUOPLZALC-MRXNPFEDSA-N 0 3 408.365 4.147 20 0 HIADHN CN(C)CCN(CCc1ccccc1)C(=O)c1ccc(NC(=O)OC(C)(C)C)cc1 ZINC000060713622 851196267 /nfs/dbraw/zinc/19/62/67/851196267.db2.gz NXTNFLWMPOFUJR-UHFFFAOYSA-N 0 3 411.546 4.280 20 0 HIADHN CN(C)Cc1cccc(NC(=O)C(=O)N2CCC(c3cccc4ccccc43)CC2)c1 ZINC000060729757 851199561 /nfs/dbraw/zinc/19/95/61/851199561.db2.gz LYOZGGOWTYGINN-UHFFFAOYSA-N 0 3 415.537 4.246 20 0 HIADHN O=C(CSc1nccs1)Nc1ccc(N2CCN(Cc3ccccc3)CC2)cc1 ZINC000060738023 851200666 /nfs/dbraw/zinc/20/06/66/851200666.db2.gz PMBFEWIFBITLPU-UHFFFAOYSA-N 0 3 424.595 4.196 20 0 HIADHN Cc1nn(Cc2ccccc2Cl)c(Cl)c1CNC1CCN(CC(F)F)CC1 ZINC000060953620 851257700 /nfs/dbraw/zinc/25/77/00/851257700.db2.gz ZPLUGJNXNXTSHC-UHFFFAOYSA-N 0 3 417.331 4.366 20 0 HIADHN Cc1nn(-c2cccc(Cl)c2)c(Cl)c1CNCCCN1CCCCCC1=O ZINC000061014525 851274054 /nfs/dbraw/zinc/27/40/54/851274054.db2.gz RWXFMSNBADRZEW-UHFFFAOYSA-N 0 3 409.361 4.370 20 0 HIADHN CCCCCOc1ccc(CNCc2ccc(S(=O)(=O)N3CCCC3)cc2)cc1 ZINC000061108639 851295332 /nfs/dbraw/zinc/29/53/32/851295332.db2.gz FWAQYWPRWJOPRR-UHFFFAOYSA-N 0 3 416.587 4.330 20 0 HIADHN CC(C)[C@@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)NCc1ccccc1CN(C)C ZINC000061231895 851324138 /nfs/dbraw/zinc/32/41/38/851324138.db2.gz GCOYFOCKQASPSU-HSZRJFAPSA-N 0 3 423.601 4.117 20 0 HIADHN COc1ccc(SCCC(=O)Nc2ccc(CCN3CCSCC3)cc2)cc1 ZINC000061288474 851339273 /nfs/dbraw/zinc/33/92/73/851339273.db2.gz DEOLPSWCDIUNFK-UHFFFAOYSA-N 0 3 416.612 4.407 20 0 HIADHN O=C(COc1cccc(C(F)(F)F)c1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000061289425 851339340 /nfs/dbraw/zinc/33/93/40/851339340.db2.gz YBHVITPMBKYPIT-UHFFFAOYSA-N 0 3 424.488 4.314 20 0 HIADHN Cc1nc(C(C)(C)C)sc1C(=O)NCCCCN1CCN(c2ccccc2)CC1 ZINC000061406997 851367738 /nfs/dbraw/zinc/36/77/38/851367738.db2.gz CZAZCBGLCSSDDP-UHFFFAOYSA-N 0 3 414.619 4.081 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1C(=O)NC[C@H](c1ccc(C)cc1)N1CCCC1 ZINC000061503133 851391140 /nfs/dbraw/zinc/39/11/40/851391140.db2.gz MRAPLMFUTNPLPH-XMMPIXPASA-N 0 3 416.569 4.424 20 0 HIADHN Cc1nc(-c2c[nH]c(C(=O)Nc3ccc(CCN4CCSCC4)cc3)c2)cs1 ZINC000061572791 851409019 /nfs/dbraw/zinc/40/90/19/851409019.db2.gz QEPZKAUYNGFUHK-UHFFFAOYSA-N 0 3 412.584 4.290 20 0 HIADHN Cc1ccc(SCc2cccc(C(=O)NC[C@H]3CN4CCC[C@H]4CO3)c2)c(C)c1 ZINC000061650489 851419727 /nfs/dbraw/zinc/41/97/27/851419727.db2.gz OSBSFFFHCOYRLU-VXKWHMMOSA-N 0 3 410.583 4.189 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2cnc3c(cnn3C(C)C)c2)N2CCCC2)cc1 ZINC000061751440 851440391 /nfs/dbraw/zinc/44/03/91/851440391.db2.gz UBXAVGMBDBUVGU-NRFANRHFSA-N 0 3 406.534 4.279 20 0 HIADHN Cc1ccc(OC[C@H](C)NC(=O)Nc2ccc(CCN3CCSCC3)cc2)cc1 ZINC000061791784 851454100 /nfs/dbraw/zinc/45/41/00/851454100.db2.gz GDIITPIJYMAPQB-IBGZPJMESA-N 0 3 413.587 4.175 20 0 HIADHN CCCOc1ccc(CNC(=O)Nc2ccc(CCN3CCSCC3)cc2)cc1 ZINC000061791967 851454287 /nfs/dbraw/zinc/45/42/87/851454287.db2.gz SJRSMNSAHJKKTH-UHFFFAOYSA-N 0 3 413.587 4.388 20 0 HIADHN C[C@H](Cc1ccccc1F)NC(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000061791084 851454357 /nfs/dbraw/zinc/45/43/57/851454357.db2.gz GQSUWEHCBXXOPD-QGZVFWFLSA-N 0 3 401.551 4.170 20 0 HIADHN O=C(NCc1ccc(N2CCCC2)cc1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000061793041 851455462 /nfs/dbraw/zinc/45/54/62/851455462.db2.gz MPSMOSVBSLVQNB-UHFFFAOYSA-N 0 3 424.614 4.200 20 0 HIADHN CCN1CCN(Cc2ccc(CNC(=O)c3sccc3-c3ccccc3)cc2)CC1 ZINC000061870092 851465813 /nfs/dbraw/zinc/46/58/13/851465813.db2.gz ABGYWCFFXNDOQV-UHFFFAOYSA-N 0 3 419.594 4.483 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)C(=O)Nc1ccc(OC2CCCC2)cc1)c1ccccc1 ZINC000061878869 851467200 /nfs/dbraw/zinc/46/72/00/851467200.db2.gz BMHYBFZENZNARA-QHCPKHFHSA-N 0 3 423.557 4.146 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)C(=O)Nc1ccc(Cl)cc1Cl)c1ccccc1 ZINC000061878766 851467237 /nfs/dbraw/zinc/46/72/37/851467237.db2.gz WBFWMJGPTNPLGU-SFHVURJKSA-N 0 3 408.329 4.131 20 0 HIADHN CCC(CC)c1nnc(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2F)s1 ZINC000062378752 851535009 /nfs/dbraw/zinc/53/50/09/851535009.db2.gz ZMQYHUGLSKAFDA-UHFFFAOYSA-N 0 3 411.522 4.316 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)Nc1ccc(N2CCCC2=O)cc1 ZINC000062378073 851535385 /nfs/dbraw/zinc/53/53/85/851535385.db2.gz IGKYEPZEKLMHQE-UHFFFAOYSA-N 0 3 414.937 4.063 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)Nc1cccc(OCC(F)(F)F)c1 ZINC000062388676 851538419 /nfs/dbraw/zinc/53/84/19/851538419.db2.gz HHKYLKGUMXLMKZ-UHFFFAOYSA-N 0 3 413.415 4.363 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)Nc1ccc(N2CCCC2)c(F)c1 ZINC000062403183 851542586 /nfs/dbraw/zinc/54/25/86/851542586.db2.gz ZIHKUKPYTRKVBP-UHFFFAOYSA-N 0 3 420.479 4.300 20 0 HIADHN COCCOc1ccc(NC(=O)N(CCN(C)C)Cc2cccc(F)c2)cc1Cl ZINC000062406282 851543682 /nfs/dbraw/zinc/54/36/82/851543682.db2.gz ZXCZNBTUFHTECW-UHFFFAOYSA-N 0 3 423.916 4.100 20 0 HIADHN Cc1c(C(=O)N(C)C[C@H]2CCN(Cc3ccccc3)C2)[nH]c2c1C(=O)CC(C)(C)C2 ZINC000437058896 862254993 /nfs/dbraw/zinc/25/49/93/862254993.db2.gz XZOVIIKIVKWHSK-LJQANCHMSA-N 0 3 407.558 4.072 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)Nc1ccc2c(c1)CCCN2C ZINC000062411652 851546184 /nfs/dbraw/zinc/54/61/84/851546184.db2.gz XQWGQFWSSKRXGO-UHFFFAOYSA-N 0 3 400.954 4.318 20 0 HIADHN Cc1c([C@@H](C)NCC2CCN(CC(F)(F)F)CC2)nnn1-c1ccc(Cl)cc1 ZINC000437058267 862255727 /nfs/dbraw/zinc/25/57/27/862255727.db2.gz NOIDKXUDCBEARH-CYBMUJFWSA-N 0 3 415.891 4.154 20 0 HIADHN COc1ccc([C@H](NC(=O)N(CCN(C)C)Cc2ccc(F)cc2F)C2CC2)cc1 ZINC000062476919 851559886 /nfs/dbraw/zinc/55/98/86/851559886.db2.gz BHHYGADHVIDZBZ-JOCHJYFZSA-N 0 3 417.500 4.198 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)NCCCOc1ccccc1F ZINC000062487147 851563670 /nfs/dbraw/zinc/56/36/70/851563670.db2.gz SMCLNLYXVROHKE-UHFFFAOYSA-N 0 3 407.917 4.021 20 0 HIADHN CC(C)OCc1ccccc1CNC(=O)N(CCN(C)C)Cc1ccc(F)cc1F ZINC000062487017 851564167 /nfs/dbraw/zinc/56/41/67/851564167.db2.gz DTJPERKFFQWZMQ-UHFFFAOYSA-N 0 3 419.516 4.163 20 0 HIADHN COc1cc(CNC(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)ccc1C ZINC000062500129 851566316 /nfs/dbraw/zinc/56/63/16/851566316.db2.gz LMULNCQOWBAXME-UHFFFAOYSA-N 0 3 423.479 4.296 20 0 HIADHN C=CCN(Cc1cccc(C#N)c1)C(=S)NC1CCN(Cc2ccccc2)CC1 ZINC000062699279 851591888 /nfs/dbraw/zinc/59/18/88/851591888.db2.gz DUVUJKOHVYPZMZ-UHFFFAOYSA-N 0 3 404.583 4.085 20 0 HIADHN CC(=O)CCc1ccc(O[C@@H](C)C(=O)N2c3ccc(C)cc3[C@H]3CN(C)CC[C@@H]32)cc1 ZINC000062866520 851594458 /nfs/dbraw/zinc/59/44/58/851594458.db2.gz VLFXFGCMGMXKDI-CYSDGLOUSA-N 0 3 420.553 4.118 20 0 HIADHN S=C(NNc1ccc(Cl)c(Cl)c1)NC1CCN(Cc2ccccc2)CC1 ZINC000063142455 851620393 /nfs/dbraw/zinc/62/03/93/851620393.db2.gz MTHWOKJCUNDYOR-UHFFFAOYSA-N 0 3 409.386 4.449 20 0 HIADHN COc1ccc2cc(CNC(=S)NC3CCN(Cc4ccccc4)CC3)ccc2c1 ZINC000063146281 851621785 /nfs/dbraw/zinc/62/17/85/851621785.db2.gz UQTKVGCKYNTSFQ-UHFFFAOYSA-N 0 3 419.594 4.477 20 0 HIADHN S=C(NCCOc1cccc2ccccc21)NC1CCN(Cc2ccccc2)CC1 ZINC000063150006 851623305 /nfs/dbraw/zinc/62/33/05/851623305.db2.gz RLYYPHBTGOSNHU-UHFFFAOYSA-N 0 3 419.594 4.347 20 0 HIADHN CC[C@@H](C)NC(=O)c1ccc(NC(=S)NC2CCN(Cc3ccccc3)CC2)cc1 ZINC000063150759 851623817 /nfs/dbraw/zinc/62/38/17/851623817.db2.gz FYYSPTCHBNCVQJ-GOSISDBHSA-N 0 3 424.614 4.166 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cccc(Cn2nc(C)cc2C)c1)c1ccsc1 ZINC000063505194 851705060 /nfs/dbraw/zinc/70/50/60/851705060.db2.gz JNCPYNIBIQZTAV-QFIPXVFZSA-N 0 3 410.587 4.423 20 0 HIADHN CC(C)N(C)CC(=O)NCCc1cn(-c2ccccc2)nc1-c1ccc(Cl)cc1 ZINC000063700345 851742628 /nfs/dbraw/zinc/74/26/28/851742628.db2.gz HABUECKZNYKIID-UHFFFAOYSA-N 0 3 410.949 4.192 20 0 HIADHN CCOc1c(Br)cc(Br)cc1CNCC(O)(CC)CC ZINC000063918201 851793729 /nfs/dbraw/zinc/79/37/29/851793729.db2.gz QRNIDFNENIBVQS-UHFFFAOYSA-N 0 3 409.162 4.251 20 0 HIADHN C[C@@H](OC(=O)C1CCN(c2ccc(Cl)cc2)C1=O)c1nnc(-c2ccccc2)o1 ZINC000064003282 851812831 /nfs/dbraw/zinc/81/28/31/851812831.db2.gz PJWWRAHHMRDGGS-DYVFJYSZSA-N 0 3 411.845 4.047 20 0 HIADHN Cc1ccc(-c2nc(COC(=O)C3CCN(c4ccc(F)c(F)c4)C3=O)co2)cc1 ZINC000064040855 851819809 /nfs/dbraw/zinc/81/98/09/851819809.db2.gz MYUWBTLQSYGVCB-QGZVFWFLSA-N 0 3 412.392 4.025 20 0 HIADHN Cc1nc(-c2cccc(NC(=O)CN3CCN(CC4CCCCC4)CC3)c2)cs1 ZINC000064129758 851833519 /nfs/dbraw/zinc/83/35/19/851833519.db2.gz LMAVAGRAVNMXQJ-UHFFFAOYSA-N 0 3 412.603 4.255 20 0 HIADHN CN(Cc1csc(Br)c1)C(=O)NC[C@H](c1ccccc1)N1CCCC1 ZINC000064239069 851855562 /nfs/dbraw/zinc/85/55/62/851855562.db2.gz XJSLALWOHHYRBH-QGZVFWFLSA-N 0 3 422.392 4.489 20 0 HIADHN COc1cc(C)c(NC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)cc1OC ZINC000064316923 851869568 /nfs/dbraw/zinc/86/95/68/851869568.db2.gz MLSBQUQCYQBQCS-OAQYLSRUSA-N 0 3 422.447 4.405 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cnn(-c4ccccc4Cl)c3)c(C)c2)CC1 ZINC000064383303 851883693 /nfs/dbraw/zinc/88/36/93/851883693.db2.gz FETVSWYOEHRVHH-UHFFFAOYSA-N 0 3 423.948 4.228 20 0 HIADHN CC(=O)Nc1cccc(NC(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)c1 ZINC000064520556 851918646 /nfs/dbraw/zinc/91/86/46/851918646.db2.gz ORDOEYABTHUZCD-UHFFFAOYSA-N 0 3 422.451 4.260 20 0 HIADHN COc1ccc(NC(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)cc1F ZINC000064530611 851922398 /nfs/dbraw/zinc/92/23/98/851922398.db2.gz MRJWZSXDFPFDCG-UHFFFAOYSA-N 0 3 413.415 4.449 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1ccc2c(c1)CCCN2C)c1cccc(OC)c1 ZINC000064562038 851930638 /nfs/dbraw/zinc/93/06/38/851930638.db2.gz NCNPPPVDOFCHNF-QHCPKHFHSA-N 0 3 410.562 4.282 20 0 HIADHN CCc1ccc([C@H](CNC(=O)Nc2ccc(N3C[C@H](C)O[C@@H](C)C3)cc2)N(C)C)cc1 ZINC000064716751 851965922 /nfs/dbraw/zinc/96/59/22/851965922.db2.gz KVGQIOUJVSDZJP-JXQFQVJHSA-N 0 3 424.589 4.287 20 0 HIADHN COc1ccc(CCNC(=O)CN2CCC[C@@H]2c2cccc3ccccc32)cc1OC ZINC000064791671 851985568 /nfs/dbraw/zinc/98/55/68/851985568.db2.gz UZKSUGCCXXFRSQ-HSZRJFAPSA-N 0 3 418.537 4.353 20 0 HIADHN COc1cccc(C[C@@H]2CCCN2Cc2csc(-c3ccc(C(N)=O)cc3)n2)c1 ZINC000064932198 852024197 /nfs/dbraw/zinc/02/41/97/852024197.db2.gz UEPLQIOLVMEQDM-FQEVSTJZSA-N 0 3 407.539 4.125 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cnc2onc(C)c2c1)c1ccc(C(F)(F)F)cc1 ZINC000065121759 852072175 /nfs/dbraw/zinc/07/21/75/852072175.db2.gz HHJPIKQXUOFMPU-GOSISDBHSA-N 0 3 420.435 4.363 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Cc1n[nH]c2ccccc21)c1ccc(C(F)(F)F)cc1 ZINC000065125938 852073850 /nfs/dbraw/zinc/07/38/50/852073850.db2.gz JCBCJKNYONSMSZ-FQEVSTJZSA-N 0 3 418.463 4.324 20 0 HIADHN CCCc1c(C(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)cnn1Cc1ccccc1 ZINC000065140368 852076246 /nfs/dbraw/zinc/07/62/46/852076246.db2.gz YAZUIOVFHTVKDS-NZQKXSOJSA-N 0 3 416.569 4.449 20 0 HIADHN Cc1cc(Cl)ccc1NC(=O)[C@@H](C)N[C@@H](C)c1ccc(N2CCOCC2)cc1 ZINC000065278351 852097885 /nfs/dbraw/zinc/09/78/85/852097885.db2.gz LQPUXPFCHUQBNK-DLBZAZTESA-N 0 3 401.938 4.163 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(N2CCOCC2)cc1)C(=O)Nc1cccc2ccccc21 ZINC000065278436 852098041 /nfs/dbraw/zinc/09/80/41/852098041.db2.gz ZBZLUVGZMJMSKA-RTBURBONSA-N 0 3 403.526 4.354 20 0 HIADHN COc1c(C)cnc(CNC(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)c1C ZINC000065388389 852120177 /nfs/dbraw/zinc/12/01/77/852120177.db2.gz RUPAUMAWLGLBCT-IBGZPJMESA-N 0 3 416.591 4.041 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2cccc(C(=O)N3CCCCC3)c2)N(C)C)cc1 ZINC000065413861 852123552 /nfs/dbraw/zinc/12/35/52/852123552.db2.gz QPYOSSVMPVWXBR-QFIPXVFZSA-N 0 3 408.546 4.046 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2ccccc2N2C[C@@H](C)O[C@@H](C)C2)N(C)C)cc1 ZINC000065413465 852123762 /nfs/dbraw/zinc/12/37/62/852123762.db2.gz KLTABFPQMQARRK-SELNLUPBSA-N 0 3 410.562 4.033 20 0 HIADHN CN(CCNC(=O)Nc1nnc(SCc2ccccc2)s1)Cc1ccccc1 ZINC000065437914 852132812 /nfs/dbraw/zinc/13/28/12/852132812.db2.gz DVKVOQOFZOPKBB-UHFFFAOYSA-N 0 3 413.572 4.084 20 0 HIADHN CC(C)CNC(=O)c1ccc(NC(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)cc1 ZINC000065449887 852137693 /nfs/dbraw/zinc/13/76/93/852137693.db2.gz CWAMKEXQMIVQHO-XMSQKQJNSA-N 0 3 408.546 4.029 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)Nc2cccc(C(=O)N3CCCCC3)c2)C1 ZINC000065450349 852138466 /nfs/dbraw/zinc/13/84/66/852138466.db2.gz OGAZVHTWGDQWJY-CVDCTZTESA-N 0 3 420.557 4.270 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1ccc(C(N)=O)cc1)c1ccc(C(F)(F)F)cc1 ZINC000065451594 852139664 /nfs/dbraw/zinc/13/96/64/852139664.db2.gz GFEGWQQKCGPTCC-SFHVURJKSA-N 0 3 422.451 4.009 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N(C)Cc2cc(Br)cs2)N(C)C)cc1 ZINC000065468786 852145325 /nfs/dbraw/zinc/14/53/25/852145325.db2.gz QOXPPMSWAKYZCP-KRWDZBQOSA-N 0 3 410.381 4.263 20 0 HIADHN COc1cccc(CN2CCC(NC(=O)C3(c4ccc(F)cc4)CCCC3)CC2)c1 ZINC000065506456 852161020 /nfs/dbraw/zinc/16/10/20/852161020.db2.gz QCSNPWNXJDEJRV-UHFFFAOYSA-N 0 3 410.533 4.427 20 0 HIADHN O=C(NCCc1cc(Br)ccc1F)c1cccc(CN2CCCC2)c1 ZINC000065604918 852197428 /nfs/dbraw/zinc/19/74/28/852197428.db2.gz CEUVIOAHIVIZOU-UHFFFAOYSA-N 0 3 405.311 4.157 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)Nc3ccc(N4CCCCC4)cc3)cc2)CC1 ZINC000065727828 852236210 /nfs/dbraw/zinc/23/62/10/852236210.db2.gz XLSVGVMHBILFJB-UHFFFAOYSA-N 0 3 406.574 4.460 20 0 HIADHN CCCOc1ccc(CNC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)cc1OC ZINC000065866464 852291427 /nfs/dbraw/zinc/29/14/27/852291427.db2.gz UVRIPDAFEPBZSZ-HXUWFJFHSA-N 0 3 414.521 4.152 20 0 HIADHN CCCC(=O)Nc1ccc(CNC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)cc1 ZINC000065868093 852293106 /nfs/dbraw/zinc/29/31/06/852293106.db2.gz HLRIKRAZQBWAPD-FQEVSTJZSA-N 0 3 411.521 4.093 20 0 HIADHN O=C(Nc1ccc(OC[C@H]2CCCO2)cc1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000065872158 852295058 /nfs/dbraw/zinc/29/50/58/852295058.db2.gz HEECASVLBXLGSX-AUSIDOKSSA-N 0 3 412.505 4.234 20 0 HIADHN COc1c(Cl)cc(Cl)cc1CNC[C@H](c1ccc(F)cc1)N1CCOCC1 ZINC000065888546 852303116 /nfs/dbraw/zinc/30/31/16/852303116.db2.gz FEMTYAHATSNJMO-LJQANCHMSA-N 0 3 413.320 4.304 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)c1ccc(NC(=O)OC(C)(C)C)cc1 ZINC000065931753 852321665 /nfs/dbraw/zinc/32/16/65/852321665.db2.gz UXAVAXXANVEEPA-UHFFFAOYSA-N 0 3 415.509 4.377 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)CCCc1ncc(-c2ccccc2)o1 ZINC000065931577 852322370 /nfs/dbraw/zinc/32/23/70/852322370.db2.gz NLIBCAGENZGTJY-UHFFFAOYSA-N 0 3 409.505 4.394 20 0 HIADHN CN(C)CCN(Cc1cccc(C#N)c1)C(=O)c1ccc(SC(F)(F)F)cc1 ZINC000065930988 852322539 /nfs/dbraw/zinc/32/25/39/852322539.db2.gz ONSHFCZLPMNSEM-UHFFFAOYSA-N 0 3 407.461 4.374 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)c1cc(-c2cccc(Cl)c2)on1 ZINC000065937818 852326228 /nfs/dbraw/zinc/32/62/28/852326228.db2.gz BFJFELADDGUVEL-UHFFFAOYSA-N 0 3 419.859 4.477 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)c1ccn(-c2cccc(Cl)c2)n1 ZINC000065937442 852326243 /nfs/dbraw/zinc/32/62/43/852326243.db2.gz CUUHWFOCIQMKME-UHFFFAOYSA-N 0 3 418.875 4.008 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)c1cnn(-c2ccc(Cl)cc2)c1 ZINC000065937580 852326296 /nfs/dbraw/zinc/32/62/96/852326296.db2.gz DBMJFZASHQNAOT-UHFFFAOYSA-N 0 3 418.875 4.008 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)c1csc(-c2cccs2)n1 ZINC000065938607 852327953 /nfs/dbraw/zinc/32/79/53/852327953.db2.gz ZEXJKBKFVYXNLG-UHFFFAOYSA-N 0 3 407.511 4.354 20 0 HIADHN Cc1ccccc1-n1nc(C(=O)N(CCN(C)C)Cc2cccc(F)c2)c2c1CCC2 ZINC000065939213 852328264 /nfs/dbraw/zinc/32/82/64/852328264.db2.gz NOGOFSBKTUSTJV-UHFFFAOYSA-N 0 3 420.532 4.013 20 0 HIADHN COc1cc(C(=O)N(CCN(C)C)Cc2cccc(F)c2)ccc1OC1CCCC1 ZINC000065939454 852328281 /nfs/dbraw/zinc/32/82/81/852328281.db2.gz VTMIVISZHURLJQ-UHFFFAOYSA-N 0 3 414.521 4.360 20 0 HIADHN COc1cc(CC(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)ccc1C ZINC000065939000 852328370 /nfs/dbraw/zinc/32/83/70/852328370.db2.gz FYXMYOLAJJRIGL-UHFFFAOYSA-N 0 3 408.464 4.155 20 0 HIADHN CCc1nc(CNCCc2ccc(OCC(=O)Nc3ccc(C)cc3)cc2)cs1 ZINC000065976693 852337300 /nfs/dbraw/zinc/33/73/00/852337300.db2.gz CSDPIVQYHLPBNY-UHFFFAOYSA-N 0 3 409.555 4.364 20 0 HIADHN O=C(NCCNCc1cn(-c2ccccc2)nc1-c1cccs1)c1ccccc1 ZINC000065979424 852338266 /nfs/dbraw/zinc/33/82/66/852338266.db2.gz SIDHQIRSBYSJQE-UHFFFAOYSA-N 0 3 402.523 4.120 20 0 HIADHN Cc1nnc(NC(=O)N(CCN2CCCC2)Cc2ccc(Cl)c(Cl)c2)s1 ZINC000065984672 852341326 /nfs/dbraw/zinc/34/13/26/852341326.db2.gz MTMRDACNERJCOL-UHFFFAOYSA-N 0 3 414.362 4.283 20 0 HIADHN O=C(CSc1ccc(C(F)(F)F)cn1)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000071851441 852418564 /nfs/dbraw/zinc/41/85/64/852418564.db2.gz YLLQDYCVCGYKQY-KRWDZBQOSA-N 0 3 409.477 4.146 20 0 HIADHN COc1ccc(CCNC(=O)CN(Cc2ccccc2)C2CCCCC2)cc1OC ZINC000071941650 852439537 /nfs/dbraw/zinc/43/95/37/852439537.db2.gz ODHZDPXODFFFJB-UHFFFAOYSA-N 0 3 410.558 4.197 20 0 HIADHN CC1CCN([C@@H](CNC(=O)Cc2csc(-c3ccccn3)n2)c2ccccc2)CC1 ZINC000072006547 852462325 /nfs/dbraw/zinc/46/23/25/852462325.db2.gz YXVRUAGYARAUQZ-QFIPXVFZSA-N 0 3 420.582 4.337 20 0 HIADHN COCCOc1c(Cl)cccc1NC(=O)NC[C@H](c1ccccc1)N1CCCC1 ZINC000072041853 852482464 /nfs/dbraw/zinc/48/24/64/852482464.db2.gz BHZMVKQIAQOFLW-HXUWFJFHSA-N 0 3 417.937 4.324 20 0 HIADHN O=C([C@H]1CCCN(Cc2cccc(F)c2)C1)N1CCN(c2cccc(Cl)c2)CC1 ZINC000096626728 852552805 /nfs/dbraw/zinc/55/28/05/852552805.db2.gz FVVGIBZHQXENGH-IBGZPJMESA-N 0 3 415.940 4.040 20 0 HIADHN CN(C)[C@H](CNC(=O)c1ccc(NC(=O)Nc2ccccc2)s1)c1ccccc1 ZINC000097133629 852584441 /nfs/dbraw/zinc/58/44/41/852584441.db2.gz UQBUWGPSFCIKJA-GOSISDBHSA-N 0 3 408.527 4.425 20 0 HIADHN O=C(CN1CCN(C2CCCC2)CC1)N[C@H](c1ccccc1)c1cccc(Cl)c1 ZINC000097477884 852617371 /nfs/dbraw/zinc/61/73/71/852617371.db2.gz LXFVUYJKZOZTAU-XMMPIXPASA-N 0 3 411.977 4.106 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N[C@H](C)[C@@H]3Oc4ccccc4[C@H]3C)c(C)c2)CC1 ZINC000437183748 862376719 /nfs/dbraw/zinc/37/67/19/862376719.db2.gz WPWOKAZJINFBLX-KHCICDEESA-N 0 3 422.573 4.212 20 0 HIADHN C[C@H](NC(=O)N[C@H]1CCN(Cc2ccccc2)C1)c1ccc(Br)cc1 ZINC000105292546 852696829 /nfs/dbraw/zinc/69/68/29/852696829.db2.gz QSKKFSSOCIBXPU-KXBFYZLASA-N 0 3 402.336 4.084 20 0 HIADHN O=S(=O)(NCc1ccccc1CN1CCCC1)c1ccccc1-c1ccccc1 ZINC000105765823 852727518 /nfs/dbraw/zinc/72/75/18/852727518.db2.gz ANBMYFPWKLJZLN-UHFFFAOYSA-N 0 3 406.551 4.428 20 0 HIADHN O=C(CCCc1nc(-c2ccc(Cl)cc2)no1)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000106118109 852755051 /nfs/dbraw/zinc/75/50/51/852755051.db2.gz HGGXQQXQXMUCDG-HXUWFJFHSA-N 0 3 424.932 4.103 20 0 HIADHN Cc1nc(Cc2ccc(F)cc2)sc1C(=O)NC[C@H](Cc1ccccc1)N(C)C ZINC000106118551 852755527 /nfs/dbraw/zinc/75/55/27/852755527.db2.gz NTPKOVMVEZUCPC-FQEVSTJZSA-N 0 3 411.546 4.084 20 0 HIADHN CCN1CCN(Cc2ccc(CNC(=O)c3cc(Cl)ccc3Cl)cc2)CC1 ZINC000107659123 852784052 /nfs/dbraw/zinc/78/40/52/852784052.db2.gz QMMCTPZNNGCWRZ-UHFFFAOYSA-N 0 3 406.357 4.061 20 0 HIADHN Cc1nn(-c2ccc(C)c(Cl)c2)c(C)c1CC(=O)N1CCN(C2CCCC2)CC1 ZINC000107794467 852797670 /nfs/dbraw/zinc/79/76/70/852797670.db2.gz WGTZNBRTEJJLGR-UHFFFAOYSA-N 0 3 414.981 4.080 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cc(F)cc2nc(C)c(C)nc21)c1cccc(OC)c1 ZINC000108064563 852820298 /nfs/dbraw/zinc/82/02/98/852820298.db2.gz FDIBMHYVWSPPRF-JOCHJYFZSA-N 0 3 424.520 4.207 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)c1cc2cc(Cl)ccc2[nH]1 ZINC000108476386 852854626 /nfs/dbraw/zinc/85/46/26/852854626.db2.gz INUJIPUKSGRCNN-UHFFFAOYSA-N 0 3 410.949 4.154 20 0 HIADHN COc1ccc(-c2nc(C(=O)N(CCN(C)C)Cc3ccc(F)cc3)cs2)cc1 ZINC000108685667 852871998 /nfs/dbraw/zinc/87/19/98/852871998.db2.gz CHQHXVFCKMVKQE-UHFFFAOYSA-N 0 3 413.518 4.162 20 0 HIADHN O=C(CCSc1ccc(Br)cc1)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000108751343 852877306 /nfs/dbraw/zinc/87/73/06/852877306.db2.gz DSLYNVMITVVOPA-GOSISDBHSA-N 0 3 419.388 4.322 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)c1ccnc(OCc2ccccc2)c1 ZINC000108756803 852877468 /nfs/dbraw/zinc/87/74/68/852877468.db2.gz IEFYDIQBLFURCF-HSZRJFAPSA-N 0 3 401.510 4.228 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)Nc3ccccc3Br)cc2)CC1 ZINC000109188264 852933217 /nfs/dbraw/zinc/93/32/17/852933217.db2.gz QJZMOUQIERNQGG-UHFFFAOYSA-N 0 3 402.336 4.232 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N(C)Cc3nc4ccccc4s3)cc2)CC1 ZINC000109198424 852934472 /nfs/dbraw/zinc/93/44/72/852934472.db2.gz UKUCEDLZHJFWCI-UHFFFAOYSA-N 0 3 408.571 4.099 20 0 HIADHN Cc1cc(C)n(-c2cccc(NC(=O)[C@@H]3CCCN(Cc4cccc(F)c4)C3)c2)n1 ZINC000109339348 852955302 /nfs/dbraw/zinc/95/53/02/852955302.db2.gz IPPVKVLATIHSBP-HXUWFJFHSA-N 0 3 406.505 4.479 20 0 HIADHN Cc1cc(C)n(-c2cccc(NC(=O)c3ccc(N4CCN(C(C)C)CC4)cc3)c2)n1 ZINC000109490355 852975919 /nfs/dbraw/zinc/97/59/19/852975919.db2.gz UHDGGVKTBDPGMY-UHFFFAOYSA-N 0 3 417.557 4.272 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2cc3cnn(C(C)C)c3nc2C)N2CCCC2)cc1 ZINC000109504530 852978465 /nfs/dbraw/zinc/97/84/65/852978465.db2.gz YMMVVWUUDGRFAR-JOCHJYFZSA-N 0 3 405.546 4.196 20 0 HIADHN COCCOc1ccc(NC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)cc1 ZINC000109547884 852982852 /nfs/dbraw/zinc/98/28/52/852982852.db2.gz BHUVQMWYRYIWTB-NRFANRHFSA-N 0 3 422.447 4.105 20 0 HIADHN Cc1cc(N2CCSCC2)ccc1NC(=O)N1CCCN(Cc2ccccc2)CC1 ZINC000109625297 852992554 /nfs/dbraw/zinc/99/25/54/852992554.db2.gz GJPYUVFOJMQFHU-UHFFFAOYSA-N 0 3 424.614 4.288 20 0 HIADHN CN(C(=O)CSCc1cccc(Cl)c1)C1CCN(CCc2ccccn2)CC1 ZINC000109795571 853015733 /nfs/dbraw/zinc/01/57/33/853015733.db2.gz WJEIANXHCWMHEM-UHFFFAOYSA-N 0 3 418.006 4.134 20 0 HIADHN CN(C(=O)c1cc(F)c(Cl)cc1Cl)C1CCN(CCc2ccccn2)CC1 ZINC000109796024 853016306 /nfs/dbraw/zinc/01/63/06/853016306.db2.gz DGIYVIPRSLNYQF-UHFFFAOYSA-N 0 3 410.320 4.307 20 0 HIADHN CN(C(=O)c1c(Cl)c2ccccc2n1C)C1CCN(CCc2ccccn2)CC1 ZINC000109809429 853016902 /nfs/dbraw/zinc/01/69/02/853016902.db2.gz JLTQQVLZULNHKX-UHFFFAOYSA-N 0 3 410.949 4.006 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CC[C@@H](c2ccc(OC)cc2)C1)c1ccsc1 ZINC000110066728 853055207 /nfs/dbraw/zinc/05/52/07/853055207.db2.gz MOXHYZHWBPPNSY-NQIIRXRSSA-N 0 3 401.576 4.339 20 0 HIADHN C[C@H](Cc1ccccc1F)NC(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000110121443 853062972 /nfs/dbraw/zinc/06/29/72/853062972.db2.gz JFDDBUGJCXLSBN-IERDGZPVSA-N 0 3 408.439 4.328 20 0 HIADHN O=C(Nc1ccc2oc(=O)ccc2c1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000110126664 853064484 /nfs/dbraw/zinc/06/44/84/853064484.db2.gz QPTJIIKTTFMOMR-NRFANRHFSA-N 0 3 416.399 4.186 20 0 HIADHN CCCN(CC(=O)Nc1cccc(Cl)c1)C1CCN(C(=O)c2ccccc2)CC1 ZINC000110285814 853084057 /nfs/dbraw/zinc/08/40/57/853084057.db2.gz NEJLHWBWFSGPNA-UHFFFAOYSA-N 0 3 413.949 4.295 20 0 HIADHN CC(C)c1noc(-c2ccc(NC(=O)N(CCN(C)C)Cc3ccccc3)cc2)n1 ZINC000110311518 853085159 /nfs/dbraw/zinc/08/51/59/853085159.db2.gz HRWNWELTYVHLRM-UHFFFAOYSA-N 0 3 407.518 4.456 20 0 HIADHN Cc1cccc(Nc2nnc(SC[C@H](O)CN(C)Cc3ccccc3)s2)c1 ZINC000110427029 853098812 /nfs/dbraw/zinc/09/88/12/853098812.db2.gz XUNLKUJUXGQAIG-GOSISDBHSA-N 0 3 400.573 4.175 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)CSc3ccc4ccccc4c3)CC2)C[C@H](C)O1 ZINC000110456268 853102474 /nfs/dbraw/zinc/10/24/74/853102474.db2.gz ISQRXWZNGYQITI-KDURUIRLSA-N 0 3 412.599 4.280 20 0 HIADHN C[C@H]1CN(c2ccc(CNCC3=Cc4cc(Cl)cc(Cl)c4OC3)cn2)CCO1 ZINC000110468614 853104315 /nfs/dbraw/zinc/10/43/15/853104315.db2.gz HZRBJSBRIVLEPI-AWEZNQCLSA-N 0 3 420.340 4.179 20 0 HIADHN CCN(CC)[C@H](CNC(=O)[C@H](c1ccccc1)N1CCCCC1=O)c1ccsc1 ZINC000110934611 853170580 /nfs/dbraw/zinc/17/05/80/853170580.db2.gz BKPKKQJVXSCFTK-IRLDBZIGSA-N 0 3 413.587 4.001 20 0 HIADHN COc1ccc(NC(=O)[C@@H](C)N(C)CCCc2cc(-c3ccc(F)cc3)n[nH]2)cc1 ZINC000111039973 853192154 /nfs/dbraw/zinc/19/21/54/853192154.db2.gz GHUDCTUFPRNVHG-MRXNPFEDSA-N 0 3 410.493 4.116 20 0 HIADHN C[C@@H]1Cc2ccccc2N1Cc1occc1C(=O)NCCN(C)Cc1ccccc1 ZINC000111144380 853208872 /nfs/dbraw/zinc/20/88/72/853208872.db2.gz XFHGWUQBSQLMQG-LJQANCHMSA-N 0 3 403.526 4.093 20 0 HIADHN O=C(CCN1CCC[C@H]1c1ccc(Cl)cc1)Nc1ccc(N2CCOCC2)cc1 ZINC000115888843 853270543 /nfs/dbraw/zinc/27/05/43/853270543.db2.gz ILFZGWWGBCXVLS-QFIPXVFZSA-N 0 3 413.949 4.342 20 0 HIADHN COc1ccc(CCC(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)cc1 ZINC000115926499 853273238 /nfs/dbraw/zinc/27/32/38/853273238.db2.gz OXQRURSLZIVFLH-UHFFFAOYSA-N 0 3 408.464 4.237 20 0 HIADHN Cc1nc2c3ccccc3nn2c(C)c1CCC(=O)N(CCN(C)C)c1ccccc1 ZINC000116123640 853284347 /nfs/dbraw/zinc/28/43/47/853284347.db2.gz PKCZLHYPYLTARG-UHFFFAOYSA-N 0 3 415.541 4.027 20 0 HIADHN C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CCCCN1Cc1ccc(C(=O)N2CCCC2)cc1 ZINC000116498348 853308709 /nfs/dbraw/zinc/30/87/09/853308709.db2.gz WGACGBHUMDXMOG-NQIIRXRSSA-N 0 3 415.578 4.190 20 0 HIADHN COc1ccc(CN(C)Cc2ccc(OCc3nccn3C)cc2)cc1OC(F)F ZINC000117475729 853358822 /nfs/dbraw/zinc/35/88/22/853358822.db2.gz WGMADTPIMMMQGP-UHFFFAOYSA-N 0 3 417.456 4.241 20 0 HIADHN O=C(NCC1(c2ccc(Cl)cc2)CCOCC1)c1cccc(CN2CCCC2)c1 ZINC000139371162 853408881 /nfs/dbraw/zinc/40/88/81/853408881.db2.gz HTEKFWPCQPSMGF-UHFFFAOYSA-N 0 3 412.961 4.414 20 0 HIADHN Fc1ccccc1COc1cccc(CNCc2ccc(Cn3cncn3)cc2)c1 ZINC000139411445 853409808 /nfs/dbraw/zinc/40/98/08/853409808.db2.gz UMSOSBYHIGTVCT-UHFFFAOYSA-N 0 3 402.473 4.334 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N(C)Cc1ccccn1)c1ccc(C(F)(F)F)cc1 ZINC000139682321 853417747 /nfs/dbraw/zinc/41/77/47/853417747.db2.gz WNAPYWWBMBHUDN-LJQANCHMSA-N 0 3 408.468 4.325 20 0 HIADHN O=C([C@H](NCC1(c2ccc(F)cc2)CCOCC1)c1ccccc1)N1CCCCC1 ZINC000140279716 853441106 /nfs/dbraw/zinc/44/11/06/853441106.db2.gz VXCHKAGQGKVYDX-HSZRJFAPSA-N 0 3 410.533 4.217 20 0 HIADHN CCOc1c(Cl)cc(CNCc2ccc(Cn3ccccc3=O)cc2)cc1OC ZINC000140421563 853444247 /nfs/dbraw/zinc/44/42/47/853444247.db2.gz RORLCXJZUUQRCB-UHFFFAOYSA-N 0 3 412.917 4.247 20 0 HIADHN C[C@H](NCc1ccc(OCc2ccccn2)cc1)c1ccc(N2CCOC2=O)cc1 ZINC000142725695 853498884 /nfs/dbraw/zinc/49/88/84/853498884.db2.gz HZHWFGYPARKYRC-SFHVURJKSA-N 0 3 403.482 4.468 20 0 HIADHN Cc1oc(-c2ccccc2)nc1CC(=O)NC[C@H](c1ccc(C)cc1)N1CCCC1 ZINC000143157050 853509582 /nfs/dbraw/zinc/50/95/82/853509582.db2.gz IJPRMAVGZCSGEM-HSZRJFAPSA-N 0 3 403.526 4.454 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)Nc1ccccc1N(C)C ZINC000143839610 853522983 /nfs/dbraw/zinc/52/29/83/853522983.db2.gz JNLFHBYGKGKJTK-UHFFFAOYSA-N 0 3 408.468 4.367 20 0 HIADHN O=C(NC1CCCCC1)C1CCN(Cc2ccc(OCc3ccncc3)cc2)CC1 ZINC000143868748 853524337 /nfs/dbraw/zinc/52/43/37/853524337.db2.gz MRFSPJHWBJFYOK-UHFFFAOYSA-N 0 3 407.558 4.322 20 0 HIADHN O=C(CN(Cc1ccccc1)CC1CCC1)N1CCC(C(=O)Nc2ccccc2)CC1 ZINC000144854998 853541150 /nfs/dbraw/zinc/54/11/50/853541150.db2.gz YMCVACLZSBTKAY-UHFFFAOYSA-N 0 3 419.569 4.166 20 0 HIADHN CN(C)Cc1cccc(NC(=O)N2CCO[C@@H](c3ccc(Br)cc3)C2)c1 ZINC000147095754 853582107 /nfs/dbraw/zinc/58/21/07/853582107.db2.gz ZJJKSHXRVJUQRY-LJQANCHMSA-N 0 3 418.335 4.116 20 0 HIADHN Cc1ccc2c(c1)[nH]cc2C1=CCN(C[C@@H](O)COc2cccc3[nH]ccc32)CC1 ZINC000147339357 853587051 /nfs/dbraw/zinc/58/70/51/853587051.db2.gz JIZFSRRYEZFOJK-LJQANCHMSA-N 0 3 401.510 4.487 20 0 HIADHN C[C@H]1CN(C(=O)c2ccc(CNCc3cccc(C(F)(F)F)c3)cc2)C[C@H](C)O1 ZINC000165973188 853653999 /nfs/dbraw/zinc/65/39/99/853653999.db2.gz PZDNODFQCDQHBC-HOTGVXAUSA-N 0 3 406.448 4.245 20 0 HIADHN C[C@H](SCC(=O)N(Cc1ccco1)C1CCN(C)CC1)c1nc2ccccc2[nH]1 ZINC000195540903 853674629 /nfs/dbraw/zinc/67/46/29/853674629.db2.gz QDKUHAUSFVFPJT-INIZCTEOSA-N 0 3 412.559 4.073 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)c1cc(-c2ccc(Cl)cc2)on1 ZINC000195593013 853702873 /nfs/dbraw/zinc/70/28/73/853702873.db2.gz LBZIEXRFJRZPSC-UHFFFAOYSA-N 0 3 401.869 4.338 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)N1CCC(COc2ccccc2)CC1 ZINC000195635132 853728851 /nfs/dbraw/zinc/72/88/51/853728851.db2.gz AOXYQDWPALQDLF-DEOSSOPVSA-N 0 3 407.558 4.324 20 0 HIADHN Cc1ccc(-c2cc(C(=O)N(CCN(C)C)Cc3ccc(C(F)(F)F)cc3)[nH]n2)o1 ZINC000195686392 853757773 /nfs/dbraw/zinc/75/77/73/853757773.db2.gz GQXJHYOJEQEPPS-UHFFFAOYSA-N 0 3 420.435 4.201 20 0 HIADHN COCCN1CCC(NC(=O)c2cccnc2Oc2ccc(Cl)cc2Cl)CC1 ZINC000195698325 853765730 /nfs/dbraw/zinc/76/57/30/853765730.db2.gz CFACSMCLKHYSCL-UHFFFAOYSA-N 0 3 424.328 4.021 20 0 HIADHN COc1cc(C)c(CN(C)C(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)cc1OC ZINC000195722566 853778735 /nfs/dbraw/zinc/77/87/35/853778735.db2.gz HHTCURWXTVDZLS-LJQANCHMSA-N 0 3 414.521 4.022 20 0 HIADHN CN(C)Cc1ccccc1NC(=O)c1cc(Cl)ccc1I ZINC000221988808 853876877 /nfs/dbraw/zinc/87/68/77/853876877.db2.gz BZPALIVTXCBWLV-UHFFFAOYSA-N 0 3 414.674 4.259 20 0 HIADHN Brc1ccc(-c2c[nH]c(CNCCCn3cnc4ccccc43)n2)cc1 ZINC000236621706 853903703 /nfs/dbraw/zinc/90/37/03/853903703.db2.gz QSSGCSMYLHLLSK-UHFFFAOYSA-N 0 3 410.319 4.369 20 0 HIADHN CC(C)NS(=O)(=O)Cc1ccccc1CNCc1cccc(OC2CCCC2)c1 ZINC000236722388 853915293 /nfs/dbraw/zinc/91/52/93/853915293.db2.gz FZNSMZVWSXGPBI-UHFFFAOYSA-N 0 3 416.587 4.126 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(Cl)c1CNC1CCN(C(=O)OC(C)C)CC1 ZINC000236775222 853921298 /nfs/dbraw/zinc/92/12/98/853921298.db2.gz QIFBZYUCIIBPMD-UHFFFAOYSA-N 0 3 408.905 4.072 20 0 HIADHN CCOc1cc(CN[C@@H]2CCc3c2cccc3Cl)ccc1O[C@H](C)C(=O)N(C)C ZINC000236893222 853932930 /nfs/dbraw/zinc/93/29/30/853932930.db2.gz SNDIVTSSMFQBFI-FOIQADDNSA-N 0 3 416.949 4.371 20 0 HIADHN CCOc1cc(CNCc2ccc(Cl)cc2)ccc1OCC(=O)N1CCCCC1 ZINC000236965380 853943607 /nfs/dbraw/zinc/94/36/07/853943607.db2.gz GPFFXBFBMUHVNF-UHFFFAOYSA-N 0 3 416.949 4.420 20 0 HIADHN CCN(CC)c1ccc(CNCc2ccc(-n3ccc(C(F)(F)F)n3)cc2)cn1 ZINC000236967514 853944152 /nfs/dbraw/zinc/94/41/52/853944152.db2.gz PHKAWSCGDAMBFG-UHFFFAOYSA-N 0 3 403.452 4.422 20 0 HIADHN CCNC(=O)c1ccc(CNCc2ccc(OCc3ccc(F)cc3)c(OC)c2)cc1 ZINC000236978964 853946061 /nfs/dbraw/zinc/94/60/61/853946061.db2.gz UDNAHFUFKYRCTR-UHFFFAOYSA-N 0 3 422.500 4.453 20 0 HIADHN CCS(=O)(=O)C[C@@H](C)NCc1ccc(-c2cccc(Br)c2)s1 ZINC000237006927 853950254 /nfs/dbraw/zinc/95/02/54/853950254.db2.gz RIUVKNMCOCTTQU-GFCCVEGCSA-N 0 3 402.379 4.090 20 0 HIADHN CCS(=O)(=O)C[C@@H](C)NCc1ccc(-c2ccc(Br)cc2)s1 ZINC000237006712 853950321 /nfs/dbraw/zinc/95/03/21/853950321.db2.gz SBBMGHZEDQTUAT-GFCCVEGCSA-N 0 3 402.379 4.090 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@H](C)NC/C=C/c2ccccc2OC)cc1 ZINC000237011881 853951662 /nfs/dbraw/zinc/95/16/62/853951662.db2.gz BOMFWDNWWGNKCO-CKDFRHGISA-N 0 3 402.560 4.090 20 0 HIADHN CC(=O)N(c1nc(CNC[C@H](Cc2ccccc2)N(C)C)cs1)c1ccc(C)cc1 ZINC000237037522 853954319 /nfs/dbraw/zinc/95/43/19/853954319.db2.gz WRIPYTURGJCMGS-QHCPKHFHSA-N 0 3 422.598 4.399 20 0 HIADHN COC(=O)c1cc(CNC2CCN(Cc3cccc(C(F)(F)F)c3)CC2)oc1C ZINC000237064451 853958854 /nfs/dbraw/zinc/95/88/54/853958854.db2.gz CCECXWMQKMHPFY-UHFFFAOYSA-N 0 3 410.436 4.148 20 0 HIADHN CCc1nn(C)c(Cl)c1CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1 ZINC000237066187 853959638 /nfs/dbraw/zinc/95/96/38/853959638.db2.gz USSYLQIGIXBMOO-HNNXBMFYSA-N 0 3 400.876 4.019 20 0 HIADHN CC[C@H]1Oc2cc([C@@H](C)NCc3ccc(OC(F)F)c(OC)c3)ccc2NC1=O ZINC000237081657 853961863 /nfs/dbraw/zinc/96/18/63/853961863.db2.gz NUVOHMXIFYWGHR-MLGOLLRUSA-N 0 3 406.429 4.257 20 0 HIADHN COc1ccccc1CC(=O)N1CCC(NCc2nc(-c3ccccc3)cs2)CC1 ZINC000237130791 853969609 /nfs/dbraw/zinc/96/96/09/853969609.db2.gz QKZDLKQNHCPWSO-UHFFFAOYSA-N 0 3 421.566 4.142 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)C[C@H](C)NCc1cc2c(cc1OC)C[C@@H](C)O2 ZINC000237146522 853972344 /nfs/dbraw/zinc/97/23/44/853972344.db2.gz ILYONWNHYRUHAC-UONOGXRCSA-N 0 3 418.921 4.188 20 0 HIADHN COc1cc(CN[C@@H](C)c2ccc(NC(N)=O)cc2)ccc1OCc1ccncc1 ZINC000237164876 853974648 /nfs/dbraw/zinc/97/46/48/853974648.db2.gz GKBQOHJXKYMZQC-INIZCTEOSA-N 0 3 406.486 4.011 20 0 HIADHN COc1ccc(CNCc2ccc(S(=O)(=O)N3CCCCC3)cc2)c2ccccc12 ZINC000237244221 853990163 /nfs/dbraw/zinc/99/01/63/853990163.db2.gz YBRFMRXNAAGAGX-UHFFFAOYSA-N 0 3 424.566 4.313 20 0 HIADHN COc1ccc(CCNCc2nc(-c3cccc(Br)c3)c[nH]2)cc1OC ZINC000237263826 853993035 /nfs/dbraw/zinc/99/30/35/853993035.db2.gz OCWKVSZTDMATPP-UHFFFAOYSA-N 0 3 416.319 4.189 20 0 HIADHN COc1cc(CNCc2ccc(-n3ccnc3)cc2)ccc1OCc1c(C)noc1C ZINC000237268072 853994108 /nfs/dbraw/zinc/99/41/08/853994108.db2.gz YKDJXDYQFOSNFV-UHFFFAOYSA-N 0 3 418.497 4.355 20 0 HIADHN COc1ccc(OCc2ccccn2)c(CNC[C@H](c2ccc(C)o2)N2CCCC2)c1 ZINC000237291826 853998972 /nfs/dbraw/zinc/99/89/72/853998972.db2.gz OFCHMYGZHFDUDI-HSZRJFAPSA-N 0 3 421.541 4.497 20 0 HIADHN C[C@@H](NCc1cccc(OC(F)(F)F)c1)c1ccc(OCC(=O)NC2CC2)cc1 ZINC000237329501 854007619 /nfs/dbraw/zinc/00/76/19/854007619.db2.gz ABFJGLRPVWFFMI-CQSZACIVSA-N 0 3 408.420 4.093 20 0 HIADHN COc1ccc(OC)c(NC(=O)C[C@H](C)N[C@H](c2ccccc2)c2ccncc2)c1 ZINC000237403219 854024439 /nfs/dbraw/zinc/02/44/39/854024439.db2.gz IWTJYUAKQXBCOJ-BXKMTCNYSA-N 0 3 405.498 4.195 20 0 HIADHN COc1ccc(OC)c(NC(=O)C[C@H](C)N[C@@H]2CCSc3c(F)cccc32)c1 ZINC000237402742 854024713 /nfs/dbraw/zinc/02/47/13/854024713.db2.gz YPZIEFUYAKCYSC-SUMWQHHRSA-N 0 3 404.507 4.387 20 0 HIADHN COc1cc(CN[C@@H](c2ccc(F)cc2)C2CCCC2)cc(Cl)c1OCC(N)=O ZINC000237404864 854025875 /nfs/dbraw/zinc/02/58/75/854025875.db2.gz DYNUZRKQXFHLRC-OAQYLSRUSA-N 0 3 420.912 4.373 20 0 HIADHN COc1cc2c(c(CN[C@H](C)CC(=O)Nc3cccc(N4CCCC4)c3)c1)O[C@@H](C)C2 ZINC000237429315 854031710 /nfs/dbraw/zinc/03/17/10/854031710.db2.gz HGBWPWXNCUPEON-MSOLQXFVSA-N 0 3 423.557 4.126 20 0 HIADHN COc1ccc(CNCc2ccccc2CN2C[C@@H](C)O[C@H](C)C2)cc1OC(F)F ZINC000237440595 854033319 /nfs/dbraw/zinc/03/33/19/854033319.db2.gz BBQBUJPHUMUTCE-IAGOWNOFSA-N 0 3 420.500 4.196 20 0 HIADHN COc1ccc(CNCc2ccccc2CN2C[C@@H](C)O[C@H](C)C2)c(Cl)c1OC ZINC000237440327 854033701 /nfs/dbraw/zinc/03/37/01/854033701.db2.gz UZTGHOONSDUUBM-IAGOWNOFSA-N 0 3 418.965 4.256 20 0 HIADHN COc1cc(OC)cc([C@H](O)CNCc2ccc(-c3nc4ccccc4s3)o2)c1 ZINC000237468189 854038966 /nfs/dbraw/zinc/03/89/66/854038966.db2.gz ULJPEVIIFDETOJ-LJQANCHMSA-N 0 3 410.495 4.397 20 0 HIADHN COc1ccc(CNCc2cn(Cc3ccccc3)nc2-c2cccnc2)cc1F ZINC000237541675 854052345 /nfs/dbraw/zinc/05/23/45/854052345.db2.gz NOZGTWJWSHSVDQ-UHFFFAOYSA-N 0 3 402.473 4.431 20 0 HIADHN Cc1nn(-c2ccc(Br)cc2)c(C)c1CNC[C@](C)(O)c1ccsc1 ZINC000237701424 854078978 /nfs/dbraw/zinc/07/89/78/854078978.db2.gz LCYRIZUQMPNYNS-IBGZPJMESA-N 0 3 420.376 4.310 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)c(C)c1CNCCNc1nccc(C(F)(F)F)n1 ZINC000237721539 854083113 /nfs/dbraw/zinc/08/31/13/854083113.db2.gz JTDHGQXAFJFXOV-UHFFFAOYSA-N 0 3 424.858 4.153 20 0 HIADHN O=[N+]([O-])c1ccc(Cl)cc1CNC[C@H](c1ccccc1Cl)N1CCOCC1 ZINC000237724407 854083771 /nfs/dbraw/zinc/08/37/71/854083771.db2.gz XODXIBSUGACIEF-LJQANCHMSA-N 0 3 410.301 4.065 20 0 HIADHN O=S(=O)(NCc1cccc(F)c1)c1cccc(CNCc2cccc3[nH]ccc32)c1 ZINC000237754629 854089180 /nfs/dbraw/zinc/08/91/80/854089180.db2.gz BMWPHAYTJNAJRD-UHFFFAOYSA-N 0 3 423.513 4.075 20 0 HIADHN Cc1nn(-c2ccc(F)cc2F)c(C)c1CNC[C@@](C)(O)c1ccc(F)cc1F ZINC000237790750 854098205 /nfs/dbraw/zinc/09/82/05/854098205.db2.gz CMELRMAZLWWWIX-OAQYLSRUSA-N 0 3 407.411 4.043 20 0 HIADHN Cc1cc(CNCc2cn(-c3ccccc3)nc2-c2ccncc2)ccc1-n1cncn1 ZINC000237805068 854100955 /nfs/dbraw/zinc/10/09/55/854100955.db2.gz WJZBRAYWBSQJQY-UHFFFAOYSA-N 0 3 421.508 4.113 20 0 HIADHN Cc1nn(-c2cccc(Cl)c2)c(Cl)c1CNC[C@H]1CCN(CC(F)(F)F)C1 ZINC000237815590 854102128 /nfs/dbraw/zinc/10/21/28/854102128.db2.gz WWZQMZYEBZTWEZ-CYBMUJFWSA-N 0 3 421.294 4.461 20 0 HIADHN O=C(Nc1ccc(CNCc2c[nH]nc2-c2cccnc2)cc1)c1ccc(F)cc1 ZINC000237818514 854102967 /nfs/dbraw/zinc/10/29/67/854102967.db2.gz KVWPIQUVYTYQJQ-UHFFFAOYSA-N 0 3 401.445 4.153 20 0 HIADHN Cc1cccc(CNCc2ccnc(N3CCN(c4ccc(F)cc4)CC3)c2)c1C ZINC000237845012 854107409 /nfs/dbraw/zinc/10/74/09/854107409.db2.gz XBXLNUHPICSBMW-UHFFFAOYSA-N 0 3 404.533 4.454 20 0 HIADHN Cc1ccc(CNCc2ccnc(N3CCN(c4ccc(F)cc4)CC3)c2)cc1C ZINC000237882929 854113920 /nfs/dbraw/zinc/11/39/20/854113920.db2.gz VEWMQONXBDENEH-UHFFFAOYSA-N 0 3 404.533 4.454 20 0 HIADHN NC(=O)Nc1ccc(CNCc2cn(-c3ccccc3)nc2-c2ccc(F)cc2)cc1 ZINC000237904435 854118308 /nfs/dbraw/zinc/11/83/08/854118308.db2.gz CRZSPIKCNNDYKW-UHFFFAOYSA-N 0 3 415.472 4.459 20 0 HIADHN O=C(Nc1ccccc1)[C@H](NC1CCN(Cc2ccncc2)CC1)c1ccccc1 ZINC000237918055 854118981 /nfs/dbraw/zinc/11/89/81/854118981.db2.gz AANFSKJNKPCXIW-XMMPIXPASA-N 0 3 400.526 4.016 20 0 HIADHN O[C@H](CNCc1cn(-c2ccccc2)nc1-c1cccnc1)c1c(F)cccc1F ZINC000237975483 854127359 /nfs/dbraw/zinc/12/73/59/854127359.db2.gz FKIRRONDNIZAGB-OAQYLSRUSA-N 0 3 406.436 4.036 20 0 HIADHN OCC[C@H](CNCc1nc(-c2ccc(Br)cc2)c[nH]1)c1ccccc1 ZINC000238196236 854152652 /nfs/dbraw/zinc/15/26/52/854152652.db2.gz CIIHFJWORCHEKK-QGZVFWFLSA-N 0 3 400.320 4.095 20 0 HIADHN Cc1cc(CN2CCN(c3c(C)c(C)nc4ccc(Br)cc43)CC2)no1 ZINC000301367395 854372794 /nfs/dbraw/zinc/37/27/94/854372794.db2.gz QTNXGLSABTVENL-UHFFFAOYSA-N 0 3 415.335 4.233 20 0 HIADHN COc1cccc([C@H](CNC(=O)CCSc2ccc(F)cc2)N2CCCC2)c1 ZINC000301386516 854378676 /nfs/dbraw/zinc/37/86/76/854378676.db2.gz QFJHNRMXINQWQI-NRFANRHFSA-N 0 3 402.535 4.270 20 0 HIADHN Cc1nc2ccc(Br)cc2c(N2CCC(N3CCCC3=O)CC2)c1C ZINC000301390552 854380578 /nfs/dbraw/zinc/38/05/78/854380578.db2.gz AHXSFENABDDOAL-UHFFFAOYSA-N 0 3 402.336 4.205 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(N[C@H]3CC[N@H+](Cc4ccccc4)C[C@@H]3C)nc2)n1 ZINC000301588459 854425497 /nfs/dbraw/zinc/42/54/97/854425497.db2.gz PWTJWQKSBPCYJR-UWJYYQICSA-N 0 3 403.530 4.129 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(N[C@H]3CC[N@@H+](Cc4ccccc4)C[C@@H]3C)nc2)n1 ZINC000301588459 854425505 /nfs/dbraw/zinc/42/55/05/854425505.db2.gz PWTJWQKSBPCYJR-UWJYYQICSA-N 0 3 403.530 4.129 20 0 HIADHN Cc1nc2ccc(Br)cc2c(NCc2cccc(OCC(N)=O)c2)c1C ZINC000301976197 854507973 /nfs/dbraw/zinc/50/79/73/854507973.db2.gz CIDCRPALFRPKKP-UHFFFAOYSA-N 0 3 414.303 4.090 20 0 HIADHN COc1cccc([C@@H]2[C@@H](Nc3cc(C)nc(-c4cccnc4)n3)CCN2C2CC2)c1 ZINC000302016130 854516189 /nfs/dbraw/zinc/51/61/89/854516189.db2.gz CCBWFAPKFPIRBZ-JTHBVZDNSA-N 0 3 401.514 4.246 20 0 HIADHN Clc1cc(Br)cc2ccc(NC3CCN([C@@H]4CCOC4)CC3)nc12 ZINC000302026420 854518045 /nfs/dbraw/zinc/51/80/45/854518045.db2.gz QIIDFTKOIHDUQA-OAHLLOKOSA-N 0 3 410.743 4.316 20 0 HIADHN c1c(-c2cccnc2)nc2sc(NCC3(N4CCSCC4)CCCCC3)nn12 ZINC000302068916 854526222 /nfs/dbraw/zinc/52/62/22/854526222.db2.gz DOVYARAABHWPPH-UHFFFAOYSA-N 0 3 414.604 4.016 20 0 HIADHN COc1ccc([C@H](CNc2ccnc3ccc(C)cc32)N2CCOCC2)cc1OC ZINC000302179722 854544048 /nfs/dbraw/zinc/54/40/48/854544048.db2.gz YUQNPOMPLVEACS-QFIPXVFZSA-N 0 3 407.514 4.046 20 0 HIADHN Cc1cc(C)n(-c2ccc(NC[C@H](c3cccc(C(F)(F)F)c3)N(C)C)nn2)n1 ZINC000302207736 854549643 /nfs/dbraw/zinc/54/96/43/854549643.db2.gz APGIJVXZOBKEDB-QGZVFWFLSA-N 0 3 404.440 4.013 20 0 HIADHN Cc1cc(C)n(-c2ccc(NC[C@@H](c3cccc(C(F)(F)F)c3)N(C)C)nn2)n1 ZINC000302207735 854549879 /nfs/dbraw/zinc/54/98/79/854549879.db2.gz APGIJVXZOBKEDB-KRWDZBQOSA-N 0 3 404.440 4.013 20 0 HIADHN COc1cccc([C@H](CNC(=O)c2ccc(OC)c3ccccc23)N2CCCC2)c1 ZINC000302803315 854638277 /nfs/dbraw/zinc/63/82/77/854638277.db2.gz PCIVNZCWIJRQJM-QHCPKHFHSA-N 0 3 404.510 4.424 20 0 HIADHN COc1ccc(SCCC(=O)NC[C@H](c2cccc(OC)c2)N2CCCC2)cc1 ZINC000302907328 854675601 /nfs/dbraw/zinc/67/56/01/854675601.db2.gz DEWNVYNDKUCUIA-JOCHJYFZSA-N 0 3 414.571 4.139 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)NC[C@H](c2ccc(C)cc2)N(C)C)c(C(F)(F)F)c1 ZINC000302941725 854689696 /nfs/dbraw/zinc/68/96/96/854689696.db2.gz ATGSEGMMHYDDEW-LJQANCHMSA-N 0 3 422.451 4.397 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2ccc(C(=O)N3CCCCCC3)cc2)N(C)C)cc1 ZINC000302961444 854697654 /nfs/dbraw/zinc/69/76/54/854697654.db2.gz GDVJZWOISDURPR-HSZRJFAPSA-N 0 3 422.573 4.436 20 0 HIADHN O=C(NCc1ccc(Br)c(F)c1)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000302963431 854698263 /nfs/dbraw/zinc/69/82/63/854698263.db2.gz GZZDBMNGGRIPQK-KRWDZBQOSA-N 0 3 420.326 4.052 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1ccccc1CN1CCSCC1)c1ccco1 ZINC000303076025 854749323 /nfs/dbraw/zinc/74/93/23/854749323.db2.gz ZERZDLUKHQYQKF-FQEVSTJZSA-N 0 3 416.591 4.033 20 0 HIADHN O=C(NCc1ccc(OCC(F)(F)F)cc1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000303077588 854750791 /nfs/dbraw/zinc/75/07/91/854750791.db2.gz SAMUOVGJMKAWAN-GOSISDBHSA-N 0 3 424.438 4.295 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N3CCCCC[C@H]3c3cccn3C)cc2)CC1 ZINC000303126948 854773962 /nfs/dbraw/zinc/77/39/62/854773962.db2.gz RASIVWLIMIPGOO-DEOSSOPVSA-N 0 3 408.590 4.313 20 0 HIADHN COc1ccc(CNC[C@@H](c2c(F)cccc2Cl)N2CCO[C@@H](C)C2)c(OC)c1 ZINC000303228647 854826557 /nfs/dbraw/zinc/82/65/57/854826557.db2.gz XMXZAONGPBEPQQ-YWZLYKJASA-N 0 3 422.928 4.048 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N(C)CCc2ccc(Br)cc2)N(C)C)cc1 ZINC000303325054 854872641 /nfs/dbraw/zinc/87/26/41/854872641.db2.gz SCAIMSJNVVLGIA-FQEVSTJZSA-N 0 3 418.379 4.244 20 0 HIADHN O=C(Nc1nnc(Cc2ccccc2F)s1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000303336130 854878689 /nfs/dbraw/zinc/87/86/89/854878689.db2.gz XNUYZKIXFNYZFZ-GOSISDBHSA-N 0 3 410.518 4.119 20 0 HIADHN O=C(NC1CCN(Cc2ccccc2)CC1)c1ccc(Cl)cc1Br ZINC000303335199 854879140 /nfs/dbraw/zinc/87/91/40/854879140.db2.gz IRXQYONCIWMOOG-UHFFFAOYSA-N 0 3 407.739 4.497 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)C2(c3ccccc3Cl)CCOCC2)N(C)C)cc1 ZINC000303352383 854887993 /nfs/dbraw/zinc/88/79/93/854887993.db2.gz XVXZWDXWSHSSQT-JOCHJYFZSA-N 0 3 414.977 4.370 20 0 HIADHN Cc1cc(C)n(-c2ccc(C(=O)N(CCCc3ccccc3)CCN(C)C)cc2F)n1 ZINC000303469719 854966988 /nfs/dbraw/zinc/96/69/88/854966988.db2.gz QGFZXRKERSCBFV-UHFFFAOYSA-N 0 3 422.548 4.265 20 0 HIADHN Clc1ccc2nccc(N3CCC[C@H](CN4CCN(c5ccccn5)CC4)C3)c2c1 ZINC000303503071 854992063 /nfs/dbraw/zinc/99/20/63/854992063.db2.gz ABPCGRNRAYYYGB-LJQANCHMSA-N 0 3 421.976 4.322 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)Nc1cccc(I)c1 ZINC000303519029 855006203 /nfs/dbraw/zinc/00/62/03/855006203.db2.gz DSXMDGINHSSWIJ-UHFFFAOYSA-N 0 3 420.250 4.351 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)[C@@H]3C[C@H]3c3cccc(C(F)(F)F)c3)CC2)C[C@@H](C)O1 ZINC000303541704 855027699 /nfs/dbraw/zinc/02/76/99/855027699.db2.gz UOSFIYPXGRQHLX-WWEWDKITSA-N 0 3 424.507 4.157 20 0 HIADHN CC(C)(CNC(=O)Nc1ccc(CCN2CCSCC2)cc1)c1cccs1 ZINC000303571735 855047031 /nfs/dbraw/zinc/04/70/31/855047031.db2.gz MWSQSGCYMGUQRK-UHFFFAOYSA-N 0 3 403.617 4.439 20 0 HIADHN CCN(C(=O)Cc1ccc(NC(=O)[C@@H](C)N2CCCCCC2)cc1)c1ccccc1 ZINC000303612839 855077425 /nfs/dbraw/zinc/07/74/25/855077425.db2.gz ZECGSOBQSFTPFZ-HXUWFJFHSA-N 0 3 407.558 4.485 20 0 HIADHN O=C(N[C@H]1CCCN(Cc2ccccc2)C1)N1CCC(C(F)(F)F)(C(F)(F)F)C1 ZINC000303661237 855114411 /nfs/dbraw/zinc/11/44/11/855114411.db2.gz HMTHNRIQCWUWCO-HNNXBMFYSA-N 0 3 423.401 4.177 20 0 HIADHN CC(C)(C(=O)NC1CCN(CCOc2ccc(Cl)cc2)CC1)c1ccccc1F ZINC000303684535 855131455 /nfs/dbraw/zinc/13/14/55/855131455.db2.gz JZZUVYHMUQWOBS-UHFFFAOYSA-N 0 3 418.940 4.416 20 0 HIADHN CCN(Cc1ccc(OC)c(OC)c1)C(=O)CN1C[C@H](c2ccc(F)cc2)C[C@H]1C ZINC000303694698 855138306 /nfs/dbraw/zinc/13/83/06/855138306.db2.gz ABDONOTUMQRBLB-YLJYHZDGSA-N 0 3 414.521 4.069 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3ccccc3OC(C)(C)C)CC2)C[C@@H](C)O1 ZINC000303701136 855141058 /nfs/dbraw/zinc/14/10/58/855141058.db2.gz OGQJICNHTGVFMY-QZTJIDSGSA-N 0 3 403.567 4.217 20 0 HIADHN COc1ccc([C@H](CNC(=O)[C@H]2C[C@@H]2c2cc(F)ccc2F)N2CCCC2)cc1 ZINC000303838836 855236530 /nfs/dbraw/zinc/23/65/30/855236530.db2.gz HYVDWSUAGQYHOG-CBQOVEMMSA-N 0 3 400.469 4.030 20 0 HIADHN CCC[C@@H](C(=O)Nc1ccc(C(=O)N(C)[C@@H]2CCCN(C)C2)cc1)c1ccccc1 ZINC000303848323 855245270 /nfs/dbraw/zinc/24/52/70/855245270.db2.gz FDRXXESXRFSGPC-DHIUTWEWSA-N 0 3 407.558 4.375 20 0 HIADHN CC(C)COC[C@H](NC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C)c1ccco1 ZINC000303858931 855254868 /nfs/dbraw/zinc/25/48/68/855254868.db2.gz PGPVPCYBOFFNJM-UNMCSNQZSA-N 0 3 413.562 4.299 20 0 HIADHN Cc1cc(=O)oc2cc(OCCN3CCC[C@@H]3c3cccc4c3OCCO4)ccc12 ZINC000303913747 855285991 /nfs/dbraw/zinc/28/59/91/855285991.db2.gz UTOXKKRHYAALJT-HXUWFJFHSA-N 0 3 407.466 4.089 20 0 HIADHN CC(C)(C)OC(=O)NC[C@@](C)(NCc1ccc(Br)cc1F)C1CC1 ZINC000310054698 855365370 /nfs/dbraw/zinc/36/53/70/855365370.db2.gz WJIXFVJGRZAUHR-GOSISDBHSA-N 0 3 401.320 4.371 20 0 HIADHN COc1ccc(CNCC2=CCN(C(=O)OC(C)(C)C)CC2)cc1Br ZINC000310832294 855367207 /nfs/dbraw/zinc/36/72/07/855367207.db2.gz KHABANYOBJNMIK-UHFFFAOYSA-N 0 3 411.340 4.115 20 0 HIADHN O=C(c1ccc(Br)cc1C(F)(F)F)N1CC[C@@H](N2CCCCC2)C1 ZINC000326369583 855409694 /nfs/dbraw/zinc/40/96/94/855409694.db2.gz YXPVLFLPCMWEGK-CYBMUJFWSA-N 0 3 405.258 4.168 20 0 HIADHN CC[C@H](C)[C@@H](CNCc1cc(Br)cc(Br)c1OC)OC ZINC000381106563 855430510 /nfs/dbraw/zinc/43/05/10/855430510.db2.gz BEKMEDAWUXGJHM-IINYFYTJSA-N 0 3 409.162 4.371 20 0 HIADHN Cc1c(Br)cccc1C(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1 ZINC000383048229 855435619 /nfs/dbraw/zinc/43/56/19/855435619.db2.gz FXPKLWWCCXDCLV-INIZCTEOSA-N 0 3 401.348 4.494 20 0 HIADHN C[C@H]1CCN(C(=O)c2ccc(F)c(Br)c2)CCN1Cc1ccccc1 ZINC000383049970 855435994 /nfs/dbraw/zinc/43/59/94/855435994.db2.gz IFBYGKHIQYFULY-HNNXBMFYSA-N 0 3 405.311 4.325 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)c1cccc(Br)c1F ZINC000383042780 855436001 /nfs/dbraw/zinc/43/60/01/855436001.db2.gz COYZINKKRUGZRL-OAHLLOKOSA-N 0 3 405.311 4.325 20 0 HIADHN CN(CCNC(=O)c1ccc(Br)cc1C(F)(F)F)Cc1ccccc1 ZINC000386615410 855443993 /nfs/dbraw/zinc/44/39/93/855443993.db2.gz CKRPQPVXNRKQBL-UHFFFAOYSA-N 0 3 415.253 4.330 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1ccc(Cl)cc1Br ZINC000389849651 855452457 /nfs/dbraw/zinc/45/24/57/855452457.db2.gz SSSKOQLJYDFQTJ-ACJLOTCBSA-N 0 3 407.739 4.353 20 0 HIADHN O=C(NC[C@H]1CCCN1Cc1ccccc1)c1cc(Cl)ccc1Br ZINC000390738836 855456032 /nfs/dbraw/zinc/45/60/32/855456032.db2.gz AKRZUERPIRXXOZ-MRXNPFEDSA-N 0 3 407.739 4.497 20 0 HIADHN COc1cc(CN[C@@H](C)c2ccc3c(c2)OCCO3)cc(Br)c1OC ZINC000392740166 855466909 /nfs/dbraw/zinc/46/69/09/855466909.db2.gz UWOIVBOXNPSOKJ-LBPRGKRZSA-N 0 3 408.292 4.088 20 0 HIADHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc(C(F)(F)F)ccc1Br ZINC000394365427 855469821 /nfs/dbraw/zinc/46/98/21/855469821.db2.gz MBNFFEXICPAREP-OLZOCXBDSA-N 0 3 405.258 4.167 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)c2cc(Cl)ccc2Br)CN1Cc1ccccc1 ZINC000398058956 855475436 /nfs/dbraw/zinc/47/54/36/855475436.db2.gz BFMMTUXGDDRDGN-CZUORRHYSA-N 0 3 407.739 4.495 20 0 HIADHN O=C(CC1CC(c2ccccc2)C1)NCCCCN1CCN(c2ccccc2)CC1 ZINC000409471604 855497509 /nfs/dbraw/zinc/49/75/09/855497509.db2.gz YMWGXUSZYJVNHJ-UHFFFAOYSA-N 0 3 405.586 4.289 20 0 HIADHN CN(C)[C@H](CNC(=O)N(C)Cc1cc(Br)ccc1F)c1ccccc1 ZINC000409480148 855502134 /nfs/dbraw/zinc/50/21/34/855502134.db2.gz PXBIQAWFCBKMPE-GOSISDBHSA-N 0 3 408.315 4.033 20 0 HIADHN CCN(CC)[C@H](CNC(=O)[C@@H]1CCCc2nn(C)cc21)c1ccc(C(F)(F)F)cc1 ZINC000409572087 855545806 /nfs/dbraw/zinc/54/58/06/855545806.db2.gz AVQKHEFSZZVZLB-YLJYHZDGSA-N 0 3 422.495 4.058 20 0 HIADHN CSc1ccccc1[C@@H](C)NC(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000409630098 855572757 /nfs/dbraw/zinc/57/27/57/855572757.db2.gz KCXXIBSNJYMZFR-UYAOXDASSA-N 0 3 413.587 4.060 20 0 HIADHN C[C@H](C(=O)NCc1ccccc1CN1CCC(O)CC1)c1ccc(C(F)(F)F)cc1 ZINC000409772764 855646010 /nfs/dbraw/zinc/64/60/10/855646010.db2.gz ZBKHULUCYYHJCQ-INIZCTEOSA-N 0 3 420.475 4.082 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)[C@@H]2CCO[C@H]2c2ccc(Cl)c(F)c2)CN1Cc1ccccc1 ZINC000409814197 855668167 /nfs/dbraw/zinc/66/81/67/855668167.db2.gz SQQNNMROVPBLJD-LRYKZCBQSA-N 0 3 416.924 4.336 20 0 HIADHN O=C(NCc1ccc2c(c1)OCO2)[C@@H](NCC1CCC(F)(F)CC1)c1ccccc1 ZINC000409858338 855691888 /nfs/dbraw/zinc/69/18/88/855691888.db2.gz PCOPNUGSIISNBK-NRFANRHFSA-N 0 3 416.468 4.188 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)CCCC1CCOCC1 ZINC000409900115 855714278 /nfs/dbraw/zinc/71/42/78/855714278.db2.gz QQPPVIKZVKAFLA-UHFFFAOYSA-N 0 3 400.485 4.193 20 0 HIADHN CC(C)n1ncc2cc(C(=O)N[C@@H](CN3CCc4ccccc4C3)C(C)(C)C)cnc21 ZINC000410052843 855802292 /nfs/dbraw/zinc/80/22/92/855802292.db2.gz KNHDTFYOSNIFHL-QFIPXVFZSA-N 0 3 419.573 4.215 20 0 HIADHN CC(C)(C)[C@@H](CN1CCc2ccccc2C1)NC(=O)c1ccc(N2CCCC2=O)cc1 ZINC000410055064 855803310 /nfs/dbraw/zinc/80/33/10/855803310.db2.gz UBRWONAQMJBALA-HSZRJFAPSA-N 0 3 419.569 4.016 20 0 HIADHN CC(C)(C)[C@H](CN1CCc2ccccc2C1)NC(=O)c1ccc(NC(=O)C2CC2)cc1 ZINC000410055113 855803386 /nfs/dbraw/zinc/80/33/86/855803386.db2.gz UPKFBNSOFHNZCS-QHCPKHFHSA-N 0 3 419.569 4.238 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1C[C@@H](C)O[C@@H](c2ccccc2)C1)c1ccsc1 ZINC000410120222 855828633 /nfs/dbraw/zinc/82/86/33/855828633.db2.gz TVAGGGGPHGORQY-DUXKGJEZSA-N 0 3 401.576 4.303 20 0 HIADHN O=C(NCc1ccc(F)cc1C(F)(F)F)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000410172427 855849628 /nfs/dbraw/zinc/84/96/28/855849628.db2.gz QJBCXHKBUMQDQW-IBGZPJMESA-N 0 3 409.427 4.481 20 0 HIADHN C[C@H](NC(=O)N1CCN(C2CCCC2)CC1)c1cccc(NC(=O)c2ccccc2)c1 ZINC000410285356 855902879 /nfs/dbraw/zinc/90/28/79/855902879.db2.gz DIJMUSIVRQWEGE-IBGZPJMESA-N 0 3 420.557 4.270 20 0 HIADHN COc1cc(C(=O)NCC2(N3CCSCC3)CCCC2)ccc1OC1CCCC1 ZINC000410319546 855926830 /nfs/dbraw/zinc/92/68/30/855926830.db2.gz NRATUKJCQZEMFG-UHFFFAOYSA-N 0 3 418.603 4.108 20 0 HIADHN Cc1cc(C)cc(CS(=O)(=O)Nc2ccc(CN3CCSCC3)cc2C)c1 ZINC000410343968 855939263 /nfs/dbraw/zinc/93/92/63/855939263.db2.gz UQENPSLLRVMAKL-UHFFFAOYSA-N 0 3 404.601 4.103 20 0 HIADHN CC[C@H](NC(=O)NCc1ccc(CN2CCN(C)CC2)cc1)c1ccc(Cl)cc1 ZINC000410370048 855955862 /nfs/dbraw/zinc/95/58/62/855955862.db2.gz WZFVNKIZAOAUSA-QFIPXVFZSA-N 0 3 414.981 4.038 20 0 HIADHN CS(=O)(=O)Nc1cccc(CN[C@@H](Cc2cccnc2)c2cccc(Cl)c2)c1 ZINC000425912395 855994868 /nfs/dbraw/zinc/99/48/68/855994868.db2.gz DOLZMPVKNJZMJD-NRFANRHFSA-N 0 3 415.946 4.180 20 0 HIADHN CCCN(C(=O)c1ccc(N(C)C(C)=O)cc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000425953538 856015666 /nfs/dbraw/zinc/01/56/66/856015666.db2.gz KLPAUKSCSASXMP-XMMPIXPASA-N 0 3 407.558 4.186 20 0 HIADHN COc1cc(NC(=O)N2CCN(C3CCC(C(C)C)CC3)CC2)cc(OC)c1OC ZINC000426024559 856053913 /nfs/dbraw/zinc/05/39/13/856053913.db2.gz UFXKSGIQFJRTAX-UHFFFAOYSA-N 0 3 419.566 4.077 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCc3ccc(Cl)cc3F)c(C)c2)CC1 ZINC000426043529 856068336 /nfs/dbraw/zinc/06/83/36/856068336.db2.gz HYYFFBSOBULUSZ-UHFFFAOYSA-N 0 3 404.917 4.251 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1C[C@H](C)N(Cc2ccccc2)C1)c1nc(C(F)(F)F)cs1 ZINC000426053203 856075597 /nfs/dbraw/zinc/07/55/97/856075597.db2.gz AWUJJYCHEVGUEQ-KCQAQPDRSA-N 0 3 412.481 4.185 20 0 HIADHN C[C@H](NC1CCN(S(=O)(=O)C(C)(C)C)CC1)c1cc(F)c(Cl)cc1Cl ZINC000426056470 856077408 /nfs/dbraw/zinc/07/74/08/856077408.db2.gz AUHGOQAEIDDAKS-NSHDSACASA-N 0 3 411.370 4.376 20 0 HIADHN C[C@H](CCCC(F)(F)F)N[C@H]1CCS(=O)(=O)c2ccc(Br)cc21 ZINC000426065375 856083147 /nfs/dbraw/zinc/08/31/47/856083147.db2.gz AVFLUXGWXUUPKM-MFKMUULPSA-N 0 3 414.287 4.378 20 0 HIADHN O=C(NCC(F)(F)F)[C@@H]1CCN(Cc2ccc(Oc3ccccc3F)c(F)c2)C1 ZINC000426105019 856110369 /nfs/dbraw/zinc/11/03/69/856110369.db2.gz SLIVQJKZTYFJCT-CQSZACIVSA-N 0 3 414.374 4.258 20 0 HIADHN C[C@H]1CN(C2CCOCC2)CCN1C(=O)N[C@@H]1C[C@H]2CCC(C)(C)c3cccc1c32 ZINC000426217220 856183111 /nfs/dbraw/zinc/18/31/11/856183111.db2.gz XMMOQMIOJROZQB-NJNPRVFISA-N 0 3 411.590 4.181 20 0 HIADHN O=C(NC1CCN(Cc2ccccc2)CC1)c1c[nH]nc1-c1ccc(Cl)s1 ZINC000426574235 856355292 /nfs/dbraw/zinc/35/52/92/856355292.db2.gz VMEOXSINXBRICX-UHFFFAOYSA-N 0 3 400.935 4.186 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3ccc(C(F)(F)F)cc3)CC2)C[C@H](C)O1 ZINC000426640075 856389224 /nfs/dbraw/zinc/38/92/24/856389224.db2.gz ZQJGHECAUUQIMX-IYBDPMFKSA-N 0 3 413.484 4.449 20 0 HIADHN COc1cccc(/C=C(\CC(=O)N2CCNC(C)(C)C2)c2nc3ccccc3s2)c1 ZINC000426691872 856415682 /nfs/dbraw/zinc/41/56/82/856415682.db2.gz MEVMYBSUISETKA-QGOAFFKASA-N 0 3 421.566 4.446 20 0 HIADHN COc1ccccc1NC(=O)c1ccc(NC(=O)[C@H](C)N2C[C@H]3CCCC[C@@H]3C2)cc1 ZINC000426817964 856495052 /nfs/dbraw/zinc/49/50/52/856495052.db2.gz QNMHAVWEBXFURR-DFQSSKMNSA-N 0 3 421.541 4.397 20 0 HIADHN COc1ccccc1[C@@H](NC(=O)N(CCN(C)C)Cc1ccccc1)c1ccco1 ZINC000426817074 856495062 /nfs/dbraw/zinc/49/50/62/856495062.db2.gz RTIIFOFDEMMYTQ-HSZRJFAPSA-N 0 3 407.514 4.151 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)c1cc(=O)[nH]c2c(Br)cccc12 ZINC000426951556 856560513 /nfs/dbraw/zinc/56/05/13/856560513.db2.gz ORXRXZKKSZPHMX-UHFFFAOYSA-N 0 3 414.303 4.325 20 0 HIADHN COC1CCN(C2(CNC(=O)CCCCC(=O)c3ccc(F)cc3)CCCC2)CC1 ZINC000427000798 856588470 /nfs/dbraw/zinc/58/84/70/856588470.db2.gz FUZDUOWOIHOLTE-UHFFFAOYSA-N 0 3 418.553 4.109 20 0 HIADHN Cc1ccc(-c2cc(C(=O)N3CCC(CCN4C[C@H](C)O[C@@H](C)C4)CC3)[nH]n2)c(C)c1 ZINC000427156310 856675825 /nfs/dbraw/zinc/67/58/25/856675825.db2.gz XWFTXFOESMADOE-PMACEKPBSA-N 0 3 424.589 4.045 20 0 HIADHN Cc1ccc(C)n1-c1nc(CC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)cs1 ZINC000437469752 862832268 /nfs/dbraw/zinc/83/22/68/862832268.db2.gz RSHXHNXTNPGGBG-SFHVURJKSA-N 0 3 422.598 4.216 20 0 HIADHN C[C@H]1CCN(C(=O)c2ccc(OCc3ccccn3)cc2)CCN1Cc1ccccc1 ZINC000437471986 862833339 /nfs/dbraw/zinc/83/33/39/862833339.db2.gz LMWMAUJYCCNCQH-NRFANRHFSA-N 0 3 415.537 4.397 20 0 HIADHN C[C@H](SCc1ccccc1)C(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000427306143 856762256 /nfs/dbraw/zinc/76/22/56/856762256.db2.gz ZRCWIQCDPCBIKW-AQNXPRMDSA-N 0 3 404.620 4.046 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)[C@@H]3C[C@]34CCCc3ccccc34)CC2)C[C@@H](C)O1 ZINC000427308548 856762736 /nfs/dbraw/zinc/76/27/36/856762736.db2.gz OGFUULZWMOAIKP-WQDYTSBFSA-N 0 3 410.602 4.019 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)CCc3ccc(-c4ccccc4)[nH]3)CC2)C[C@H](C)O1 ZINC000427315074 856767137 /nfs/dbraw/zinc/76/71/37/856767137.db2.gz SVNVSCASMIBNJL-OYRHEFFESA-N 0 3 423.601 4.352 20 0 HIADHN CC[C@H](Sc1ccccc1)C(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000427323293 856772050 /nfs/dbraw/zinc/77/20/50/856772050.db2.gz XBPHCENFGXOUTB-KNKQGSTJSA-N 0 3 404.620 4.295 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)CCCCC(=O)c3ccccc3)CC2)C[C@H](C)O1 ZINC000427342121 856781118 /nfs/dbraw/zinc/78/11/18/856781118.db2.gz LHFOKMDMWXCUBU-OYRHEFFESA-N 0 3 414.590 4.168 20 0 HIADHN Cc1c2cc(F)ccc2oc1C(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000427361656 856794141 /nfs/dbraw/zinc/79/41/41/856794141.db2.gz GKJXUQRMZGNTIP-HZPDHXFCSA-N 0 3 402.510 4.232 20 0 HIADHN Cc1ccccc1[C@H]([C@@H](C)NC(=O)C(=O)Nc1ccc(-c2ccco2)cc1F)N(C)C ZINC000427373653 856800260 /nfs/dbraw/zinc/80/02/60/856800260.db2.gz BOZCIQZVSSFHNU-ZHRRBRCNSA-N 0 3 423.488 4.140 20 0 HIADHN COc1ccc([C@H](CN[C@@H](C)c2ncc(Br)cc2F)N2CCCC2)cc1 ZINC000427573547 856872591 /nfs/dbraw/zinc/87/25/91/856872591.db2.gz KEWSCWZAJJIDSC-LIRRHRJNSA-N 0 3 422.342 4.480 20 0 HIADHN O=C1CCCN1Cc1cccc(CN[C@H]2CCCc3ncc(C(F)(F)F)cc32)c1 ZINC000427583878 856877752 /nfs/dbraw/zinc/87/77/52/856877752.db2.gz RSXPJBXSWUEGTG-IBGZPJMESA-N 0 3 403.448 4.390 20 0 HIADHN Cc1cc2c(cc1C)[C@@H](N[C@H](C)c1ccc(S(=O)(=O)N(C)C)cc1)CCS2 ZINC000427602908 856884927 /nfs/dbraw/zinc/88/49/27/856884927.db2.gz SCNHEWIKDUNOHO-UZLBHIALSA-N 0 3 404.601 4.441 20 0 HIADHN C[C@H](CS(=O)(=O)N(C)[C@H]1CCN(Cc2ccccc2)[C@@H](C)C1)c1ccccc1 ZINC000427847601 856980187 /nfs/dbraw/zinc/98/01/87/856980187.db2.gz AMPSPOLDHMHRSC-QTEQDKRBSA-N 0 3 400.588 4.105 20 0 HIADHN Cc1ncc(C(=O)NCCCCN2CCN(c3ccccc3)CC2)c(Cl)c1Cl ZINC000427919814 857007594 /nfs/dbraw/zinc/00/75/94/857007594.db2.gz BBUIWGXRRLHSDM-UHFFFAOYSA-N 0 3 421.372 4.029 20 0 HIADHN CO[C@H](C)c1nc(CN2CCCN(CCCOc3c(C)cccc3C)CC2)cs1 ZINC000437535158 862871242 /nfs/dbraw/zinc/87/12/42/862871242.db2.gz KRXMSKOYZPQIMU-HXUWFJFHSA-N 0 3 417.619 4.444 20 0 HIADHN Cc1cccc(C(C)(C)NCC(=O)Nc2nc(CN3CCC(C)CC3)cs2)c1 ZINC000428327622 857155909 /nfs/dbraw/zinc/15/59/09/857155909.db2.gz UOKWRWZURMKDDW-UHFFFAOYSA-N 0 3 400.592 4.147 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N2CCC(c3ncccc3Cl)CC2)C1 ZINC000428475716 857216005 /nfs/dbraw/zinc/21/60/05/857216005.db2.gz AJBCXBCLTITHCW-XLIONFOSSA-N 0 3 412.965 4.460 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@@H](O)C2)c1)c1cc2ccccc2n1CC(F)(F)F ZINC000428528936 857242233 /nfs/dbraw/zinc/24/22/33/857242233.db2.gz FNXZUPMXZFIVBF-GOSISDBHSA-N 0 3 417.431 4.023 20 0 HIADHN OC[C@H](CNCc1nc2ccc(F)cc2s1)Cc1ccccc1Br ZINC000428530452 857244373 /nfs/dbraw/zinc/24/43/73/857244373.db2.gz BFWFSIORWDNOHQ-LBPRGKRZSA-N 0 3 409.324 4.139 20 0 HIADHN C[C@H](Oc1ccc(-c2ccccc2)cc1)C(=O)Nc1cccc(CN2CC[C@@H](O)C2)c1 ZINC000428537490 857249950 /nfs/dbraw/zinc/24/99/50/857249950.db2.gz LXYZFDDTQFQDKY-YADARESESA-N 0 3 416.521 4.326 20 0 HIADHN COc1cccc(CC2(C(=O)Nc3cccc(CN4CC[C@@H](O)C4)c3)CCCCC2)c1 ZINC000428543513 857254684 /nfs/dbraw/zinc/25/46/84/857254684.db2.gz GFVQHKOVKSWZGS-HSZRJFAPSA-N 0 3 422.569 4.394 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@@H](O)C2)c1)c1cc2c(cc(Cl)cc2Cl)[nH]1 ZINC000428545642 857255730 /nfs/dbraw/zinc/25/57/30/857255730.db2.gz JJZUQOBNPCTZQP-OAHLLOKOSA-N 0 3 404.297 4.294 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@@H](O)C2)c1)[C@H](Oc1ccccc1)c1ccccc1 ZINC000428550281 857260840 /nfs/dbraw/zinc/26/08/40/857260840.db2.gz QRARRKOCCPFQMF-ISKFKSNPSA-N 0 3 402.494 4.012 20 0 HIADHN C[C@H](Cc1ccccc1)n1cccc1C(=O)Nc1cccc(CN2CC[C@@H](O)C2)c1 ZINC000428553907 857261709 /nfs/dbraw/zinc/26/17/09/857261709.db2.gz YHNZUGHFKLBPAN-AUSIDOKSSA-N 0 3 403.526 4.111 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@@H](O)C2)c1)c1ccccc1CCc1ccccc1 ZINC000428551823 857262247 /nfs/dbraw/zinc/26/22/47/857262247.db2.gz UPRVDHRLHKPLRO-XMMPIXPASA-N 0 3 400.522 4.291 20 0 HIADHN CC(C)(c1ccc(C(=O)Nc2cccc(CN3CC[C@H](O)C3)c2)cc1)C(F)(F)F ZINC000428555799 857263672 /nfs/dbraw/zinc/26/36/72/857263672.db2.gz ZRVZTLRBWOTDQA-IBGZPJMESA-N 0 3 406.448 4.345 20 0 HIADHN CCSc1ccc(Cl)cc1C(=O)Nc1ccc2oc(=O)n(CCN(C)C)c2c1 ZINC000437569175 862891129 /nfs/dbraw/zinc/89/11/29/862891129.db2.gz OSPKACPQIKFUQO-UHFFFAOYSA-N 0 3 419.934 4.174 20 0 HIADHN COc1ccc(CNC[C@@]2(Cc3ccc(F)cc3)CCC[C@H]2O)c(Cl)c1OC ZINC000428574219 857270125 /nfs/dbraw/zinc/27/01/25/857270125.db2.gz QZGBWOOOXCYERE-KNQAVFIVSA-N 0 3 407.913 4.360 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)N1CCC(c2ncccc2Cl)CC1 ZINC000428696977 857300581 /nfs/dbraw/zinc/30/05/81/857300581.db2.gz XHLPKFHPMPMYAF-OAQYLSRUSA-N 0 3 412.965 4.461 20 0 HIADHN CCOc1nc(C(F)(F)F)ccc1C(=O)N(C)C1CCN(Cc2ccccc2)CC1 ZINC000428739612 857314373 /nfs/dbraw/zinc/31/43/73/857314373.db2.gz DWAQVKHYKNZYMZ-UHFFFAOYSA-N 0 3 421.463 4.236 20 0 HIADHN Cc1cccc(NC(=O)CN2CCN([C@H]3CC[C@@](C)(c4ccccc4)C3)CC2)c1C ZINC000437580064 862896992 /nfs/dbraw/zinc/89/69/92/862896992.db2.gz OXEIAXWZHBYNAD-JYFHCDHNSA-N 0 3 405.586 4.370 20 0 HIADHN Cc1cccc(NC(=O)CN2CCN([C@@H]3CC[C@@](C)(c4ccccc4)C3)CC2)c1C ZINC000437580066 862897416 /nfs/dbraw/zinc/89/74/16/862897416.db2.gz OXEIAXWZHBYNAD-ZEQKJWHPSA-N 0 3 405.586 4.370 20 0 HIADHN COc1ccc(CN(Cc2ccncc2)[C@H]2CCCN(Cc3ccccc3)C2)cn1 ZINC000428775590 857332105 /nfs/dbraw/zinc/33/21/05/857332105.db2.gz BSDAVBFZAWDHRY-DEOSSOPVSA-N 0 3 402.542 4.152 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3ccc4c(c3)C(=O)CCC4)c(C)c2)CC1 ZINC000428800751 857348605 /nfs/dbraw/zinc/34/86/05/857348605.db2.gz MJLMUBZBSZMSFB-UHFFFAOYSA-N 0 3 406.530 4.300 20 0 HIADHN COC(=O)c1coc(CN(Cc2ccncc2)[C@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000428801035 857349013 /nfs/dbraw/zinc/34/90/13/857349013.db2.gz HKVLEAOVJPYGPJ-QHCPKHFHSA-N 0 3 419.525 4.128 20 0 HIADHN CCCn1c(C)nnc1CN(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000428807203 857353248 /nfs/dbraw/zinc/35/32/48/857353248.db2.gz CJHFWTZZHLARMQ-XMMPIXPASA-N 0 3 418.589 4.058 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)N2CCC(c3ncccc3Cl)CC2)CN1Cc1ccccc1 ZINC000428809628 857353648 /nfs/dbraw/zinc/35/36/48/857353648.db2.gz VZVYNURRNOWJNT-YLJYHZDGSA-N 0 3 412.965 4.287 20 0 HIADHN C[C@@H](NC(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1)C(C)(C)c1ccccc1 ZINC000428814036 857357252 /nfs/dbraw/zinc/35/72/52/857357252.db2.gz CAVCXARYLUHITM-NJDAHSKKSA-N 0 3 415.622 4.274 20 0 HIADHN C[C@H](C(=O)Nc1cccc(F)c1)N1CCN([C@@H]2CC[C@@](C)(c3ccccc3)C2)CC1 ZINC000437590453 862904002 /nfs/dbraw/zinc/90/40/02/862904002.db2.gz MIZPCMDXPVWMDY-RZPHLTDDSA-N 0 3 409.549 4.281 20 0 HIADHN CCn1cnnc1-c1ccccc1NC(=O)NC[C@H](c1ccc(C)cc1)N1CCCC1 ZINC000428885136 857388593 /nfs/dbraw/zinc/38/85/93/857388593.db2.gz TYGKMXLWAIXYMS-JOCHJYFZSA-N 0 3 418.545 4.232 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)N[C@H]3CCSc4ccccc43)CC2)C[C@H](C)O1 ZINC000428917972 857413494 /nfs/dbraw/zinc/41/34/94/857413494.db2.gz SLKMIZZJKFQYFW-UEXGIBASSA-N 0 3 417.619 4.144 20 0 HIADHN CO[C@@H](CN[C@H](CO)c1ccc(Br)c(F)c1)c1ccc(Cl)cc1 ZINC000428992637 857447036 /nfs/dbraw/zinc/44/70/36/857447036.db2.gz KLRHICJKYBPNQO-SJORKVTESA-N 0 3 402.691 4.252 20 0 HIADHN Cc1ccc([C@@H](C)N(C)C(=O)NC[C@@H]2CN(Cc3ccccc3)CCCO2)c(C)c1 ZINC000429017749 857459606 /nfs/dbraw/zinc/45/96/06/857459606.db2.gz GMBHNDMVBUZCFW-FYYLOGMGSA-N 0 3 409.574 4.297 20 0 HIADHN Cc1ccc([C@H]2CCCN2C(=O)NC[C@H]2CN(Cc3ccccc3)CCCO2)s1 ZINC000429020280 857460919 /nfs/dbraw/zinc/46/09/19/857460919.db2.gz LEMNPHHRMVYKPW-LEWJYISDSA-N 0 3 413.587 4.194 20 0 HIADHN O=C(NC[C@H]1CN(Cc2ccccc2)CCCO1)Nc1ccc2oc(C3CC3)nc2c1 ZINC000429040048 857469970 /nfs/dbraw/zinc/46/99/70/857469970.db2.gz GYCHVVLABBWHBY-FQEVSTJZSA-N 0 3 420.513 4.118 20 0 HIADHN COc1ccc(Cl)c(NC(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)c1 ZINC000429046875 857474770 /nfs/dbraw/zinc/47/47/70/857474770.db2.gz ONJFNPROAZRTKE-HOTGVXAUSA-N 0 3 409.958 4.092 20 0 HIADHN Cc1cc(-c2cc(C(=O)N[C@@H]3C[C@H](C)N(C4CC4)C3)c3c(C)noc3n2)c(C)s1 ZINC000429047165 857475731 /nfs/dbraw/zinc/47/57/31/857475731.db2.gz OVCOXLSJVMGIPM-XHDPSFHLSA-N 0 3 410.543 4.232 20 0 HIADHN CCOc1ccc(NC(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)c(C)c1 ZINC000429049993 857477083 /nfs/dbraw/zinc/47/70/83/857477083.db2.gz WLSBWFDLARPTRP-RTBURBONSA-N 0 3 403.567 4.137 20 0 HIADHN C[C@@H](C1CC1)N(Cc1ccccc1)C(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000429054203 857480423 /nfs/dbraw/zinc/48/04/23/857480423.db2.gz PKXMWNIDQGHOFP-SQJMNOBHSA-N 0 3 421.585 4.288 20 0 HIADHN CSCc1ccc(NC(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)cc1 ZINC000429059954 857486299 /nfs/dbraw/zinc/48/62/99/857486299.db2.gz BRRVLYHLDOIZJE-ROUUACIJSA-N 0 3 405.608 4.293 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)Nc1cccc(NC(=O)C2CCCCC2)c1 ZINC000429192275 857547403 /nfs/dbraw/zinc/54/74/03/857547403.db2.gz GYDOJEZXIPMARW-UHFFFAOYSA-N 0 3 423.561 4.196 20 0 HIADHN CCCn1ccnc1CCCN(C)CC(=O)Nc1nc(-c2ccc(C)cc2)cs1 ZINC000429236874 857567865 /nfs/dbraw/zinc/56/78/65/857567865.db2.gz MYEKXVHSOBOEEP-UHFFFAOYSA-N 0 3 411.575 4.228 20 0 HIADHN CCCn1ccnc1CCCN(C)Cc1nc(-c2cc(Br)cs2)no1 ZINC000429246589 857571414 /nfs/dbraw/zinc/57/14/14/857571414.db2.gz GZHDHIOVFOLSIS-UHFFFAOYSA-N 0 3 424.368 4.232 20 0 HIADHN COc1c(C)ccc(NC(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)c1C ZINC000429253338 857575253 /nfs/dbraw/zinc/57/52/53/857575253.db2.gz HYSOJOTUZLTCMK-QZTJIDSGSA-N 0 3 403.567 4.055 20 0 HIADHN CSc1cccc(N(C(=O)Cc2cc(F)c(F)cc2F)C2CCN(C)CC2)c1 ZINC000429282533 857590471 /nfs/dbraw/zinc/59/04/71/857590471.db2.gz FKDCNAFMECAZCV-UHFFFAOYSA-N 0 3 408.489 4.496 20 0 HIADHN CC(C)n1nccc1NC(=O)[C@@H](C)N[C@H]1c2cc(Br)ccc2CC1(C)C ZINC000429292097 857595098 /nfs/dbraw/zinc/59/50/98/857595098.db2.gz ICRYSAKQBQTXCV-ACJLOTCBSA-N 0 3 419.367 4.467 20 0 HIADHN CCC1(CC)[C@@H](NCC(=O)Nc2ccc(NC(=O)c3cccs3)cc2)C[C@@H]1OC ZINC000429303457 857597484 /nfs/dbraw/zinc/59/74/84/857597484.db2.gz WIBNXFBVSWJLTH-OALUTQOASA-N 0 3 415.559 4.122 20 0 HIADHN CCC1(CC)[C@H](NCC(=O)Nc2c(F)cc(F)cc2Br)[C@H](C)[C@H]1OC ZINC000429316802 857601248 /nfs/dbraw/zinc/60/12/48/857601248.db2.gz WYWLUNQURXKFHE-LZVXQISVSA-N 0 3 419.310 4.095 20 0 HIADHN Cc1nc(C(=O)NC[C@@H]2CN(Cc3ccccc3)CCCO2)c(-c2ccccc2)s1 ZINC000429342529 857610612 /nfs/dbraw/zinc/61/06/12/857610612.db2.gz ZQVQVYMIKMWGRG-OAQYLSRUSA-N 0 3 421.566 4.139 20 0 HIADHN C[C@@H](C(=O)Nc1ccccc1C(=O)c1ccccc1)N1CCN(C2CCC2)C[C@@H](C)C1 ZINC000429387787 857636915 /nfs/dbraw/zinc/63/69/15/857636915.db2.gz SONRILCXEJSLTL-PMACEKPBSA-N 0 3 419.569 4.051 20 0 HIADHN CS(=O)(=O)C[C@@H]1CCN(CCCC(c2ccc(F)cc2)c2ccc(F)cc2)C1 ZINC000429404035 857646960 /nfs/dbraw/zinc/64/69/60/857646960.db2.gz JIUPDYHWTRIKHM-QGZVFWFLSA-N 0 3 407.526 4.243 20 0 HIADHN O=S1(=O)CCCN1c1cccc(CN[C@@H](Cc2ccccc2F)c2ccccc2)c1 ZINC000429414638 857653142 /nfs/dbraw/zinc/65/31/42/857653142.db2.gz CAQQKFFLATWOQG-DEOSSOPVSA-N 0 3 424.541 4.439 20 0 HIADHN C[C@@H](NC[C@H](CO)Cc1ccc(Br)cc1)c1nc2c(s1)CCCC2 ZINC000429412955 857653235 /nfs/dbraw/zinc/65/32/35/857653235.db2.gz RDSUFEOQPSKYIQ-UKRRQHHQSA-N 0 3 409.393 4.286 20 0 HIADHN C[C@@H](CNC(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1)Sc1ccccc1 ZINC000429427153 857661095 /nfs/dbraw/zinc/66/10/95/857661095.db2.gz OOWYDBZIFSWGRJ-ZCNNSNEGSA-N 0 3 419.635 4.088 20 0 HIADHN C[C@H](NC[C@H]1CN(Cc2ccccc2)CCCO1)c1nc2ccc(Cl)cc2n1C ZINC000429430455 857663767 /nfs/dbraw/zinc/66/37/67/857663767.db2.gz LVPBLSNOOGEMCX-PXNSSMCTSA-N 0 3 412.965 4.168 20 0 HIADHN Cc1cc([C@@H](NC[C@H]2CN(Cc3ccccc3)CCCO2)c2cccnc2)ccc1F ZINC000429439081 857668756 /nfs/dbraw/zinc/66/87/56/857668756.db2.gz ARFVGESDZPPRBC-AZGAKELHSA-N 0 3 419.544 4.499 20 0 HIADHN CC[C@H](NC(=O)N1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1)c1cc(F)ccc1F ZINC000429449110 857676135 /nfs/dbraw/zinc/67/61/35/857676135.db2.gz RMIUQFDUMFCWGT-HOIFWPIMSA-N 0 3 423.548 4.337 20 0 HIADHN COc1cccc(CN(Cc2cnn(Cc3ccc(F)cc3)c2)C2CCC(O)CC2)c1 ZINC000437625442 862944289 /nfs/dbraw/zinc/94/42/89/862944289.db2.gz DBHQOFYENUMGRJ-UHFFFAOYSA-N 0 3 423.532 4.385 20 0 HIADHN O=C(Nc1ccnn1Cc1ccc(F)cc1)N[C@H](CN1CCCC1)c1ccccc1 ZINC000429573930 857759125 /nfs/dbraw/zinc/75/91/25/857759125.db2.gz OHZVMGUYCNTESL-OAQYLSRUSA-N 0 3 407.493 4.029 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1ccnn1Cc1ccc(F)cc1)c1ccsc1 ZINC000429573997 857759777 /nfs/dbraw/zinc/75/97/77/857759777.db2.gz DGGBTJNREITURI-IBGZPJMESA-N 0 3 415.538 4.337 20 0 HIADHN CC[C@@H](NC[C@H]1CN(Cc2ccccc2)CCCO1)c1nc(C(F)(F)F)cs1 ZINC000429683067 857833454 /nfs/dbraw/zinc/83/34/54/857833454.db2.gz PLOJAGZZYGGJAB-DLBZAZTESA-N 0 3 413.509 4.494 20 0 HIADHN C[C@H](c1cc(Cl)ccc1Cl)n1nccc1NC(=O)N1CC[C@@H]2CCN(C)C[C@H]21 ZINC000429718218 857848323 /nfs/dbraw/zinc/84/83/23/857848323.db2.gz JFPAMNJUIFZMLD-QWQRMKEZSA-N 0 3 422.360 4.357 20 0 HIADHN c1csc(CN(C[C@H]2CCCO2)C[C@H]2CN(Cc3ccccc3)CCCO2)c1 ZINC000429732842 857856339 /nfs/dbraw/zinc/85/63/39/857856339.db2.gz YYOJJKFBZNXLHL-FGZHOGPDSA-N 0 3 400.588 4.020 20 0 HIADHN Cc1ccc([C@H](NCCC(=O)Nc2ccc(C(N)=O)c(Cl)c2)c2ccccc2)cc1 ZINC000437633941 862960657 /nfs/dbraw/zinc/96/06/57/862960657.db2.gz KFPQCEFDNJNULA-HSZRJFAPSA-N 0 3 421.928 4.455 20 0 HIADHN CCSCc1cccc(NC(=O)NC[C@H]2CN(Cc3ccccc3)CCCO2)c1 ZINC000429771412 857879435 /nfs/dbraw/zinc/87/94/35/857879435.db2.gz VWHXYVCUUPLUIH-QFIPXVFZSA-N 0 3 413.587 4.352 20 0 HIADHN CCO[C@@H]1C[C@@H](NCC(=O)Nc2cc(OC)c(Cl)cc2OC)C12CCCCC2 ZINC000429784405 857883797 /nfs/dbraw/zinc/88/37/97/857883797.db2.gz JCWBLCXHQBCWAB-RTBURBONSA-N 0 3 410.942 4.013 20 0 HIADHN C[C@H](C(=O)Nc1ccc(CCN2CCSCC2)cc1)[C@H]1OCCc2sccc21 ZINC000429890921 857929226 /nfs/dbraw/zinc/92/92/26/857929226.db2.gz PZXYEMSTIVPJAJ-HRAATJIYSA-N 0 3 416.612 4.228 20 0 HIADHN COc1ccccc1-c1ncc(CN2CCC[C@@H](c3ncc4n3CCCC4)C2)cn1 ZINC000430055613 858013917 /nfs/dbraw/zinc/01/39/17/858013917.db2.gz DOYJCFCAEDOOAJ-LJQANCHMSA-N 0 3 403.530 4.065 20 0 HIADHN CC(C)n1c(=O)c2ccccc2nc1SC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000430090286 858027132 /nfs/dbraw/zinc/02/71/32/858027132.db2.gz QJRPVRMOGAOJMG-FQEVSTJZSA-N 0 3 423.582 4.361 20 0 HIADHN COC(=O)[C@@H]1CCO[C@H]1C1CCN(CCCc2c(Cl)cccc2Cl)CC1 ZINC000430094787 858029824 /nfs/dbraw/zinc/02/98/24/858029824.db2.gz LCYDIEKCCJATAJ-APWZRJJASA-N 0 3 400.346 4.216 20 0 HIADHN COC(=O)c1ccccc1CC1CCN(Cc2cnc(-c3ccncc3)s2)CC1 ZINC000430176528 858067682 /nfs/dbraw/zinc/06/76/82/858067682.db2.gz IAFASIMCDHURQU-UHFFFAOYSA-N 0 3 407.539 4.446 20 0 HIADHN C[C@@H]1CN(CCC(=O)Nc2ccccc2-c2ccccc2)C[C@]2(CCO[C@H](C)C2)O1 ZINC000430278486 858106733 /nfs/dbraw/zinc/10/67/33/858106733.db2.gz QDQRXESXMACRHG-UMEGOILYSA-N 0 3 408.542 4.341 20 0 HIADHN CCOC(=O)c1oc2ccccc2c1CN1CC[C@@H](C(=O)N(C)c2ccccc2)C1 ZINC000430297699 858113815 /nfs/dbraw/zinc/11/38/15/858113815.db2.gz IPQUQGJPNLKXML-QGZVFWFLSA-N 0 3 406.482 4.094 20 0 HIADHN Clc1ccc(-c2noc(CCN(CCc3ccccn3)Cc3cccnc3)n2)cc1 ZINC000430338705 858126325 /nfs/dbraw/zinc/12/63/25/858126325.db2.gz BYAFOULLTXVIBH-UHFFFAOYSA-N 0 3 419.916 4.467 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)c1ccc2noc(-c3ccc(F)cc3)c2c1 ZINC000437657323 862994916 /nfs/dbraw/zinc/99/49/16/862994916.db2.gz LIASDRCHLJPTOA-UHFFFAOYSA-N 0 3 418.472 4.233 20 0 HIADHN C[C@H]1C[C@H](NC(=O)CCC(=O)c2ccc(F)cc2F)CCN1Cc1ccccc1 ZINC000430685688 858269731 /nfs/dbraw/zinc/26/97/31/858269731.db2.gz RZYORTWKPNMRSF-QFBILLFUSA-N 0 3 400.469 4.097 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3cccc(C(F)(F)F)c3F)CC2)C[C@H](C)O1 ZINC000430692197 858271717 /nfs/dbraw/zinc/27/17/17/858271717.db2.gz QSAAASWTOFNECF-GASCZTMLSA-N 0 3 416.459 4.196 20 0 HIADHN C[C@H]1[C@@H](c2ccccc2)[C@H]1C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000430828479 858319864 /nfs/dbraw/zinc/31/98/64/858319864.db2.gz TXNYMBFBNJOTQD-OPEMAFOOSA-N 0 3 400.526 4.318 20 0 HIADHN CCn1ccnc1[C@H]1CCCCN1C(=O)N[C@H](CN(C)Cc1ccccc1)C(C)C ZINC000430895348 858358716 /nfs/dbraw/zinc/35/87/16/858358716.db2.gz UBOIKWLLZUJCHR-FGZHOGPDSA-N 0 3 411.594 4.296 20 0 HIADHN CN(C(=O)NCc1c(F)cc(F)c(F)c1F)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000430945386 858378345 /nfs/dbraw/zinc/37/83/45/858378345.db2.gz WXYSMQJWZNHURE-HNNXBMFYSA-N 0 3 409.427 4.049 20 0 HIADHN CN(C(=O)NCc1c(F)cc(F)c(F)c1F)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000430945387 858378697 /nfs/dbraw/zinc/37/86/97/858378697.db2.gz WXYSMQJWZNHURE-OAHLLOKOSA-N 0 3 409.427 4.049 20 0 HIADHN COc1ccc([C@@H](CN2C(=O)CN([C@@H](C)c3ccccc3)C2=O)N2CCCCC2)cc1 ZINC000430953528 858381204 /nfs/dbraw/zinc/38/12/04/858381204.db2.gz HHZHACUYSVLLAJ-WMZHIEFXSA-N 0 3 421.541 4.248 20 0 HIADHN O=C1CN(Cc2ccc(Cl)cc2)C(=O)N1C[C@@H](c1cccs1)N1CCCC1 ZINC000430969515 858386196 /nfs/dbraw/zinc/38/61/96/858386196.db2.gz DGKJJWMMGXIWFL-KRWDZBQOSA-N 0 3 403.935 4.003 20 0 HIADHN CN1C(=O)N([C@@H]2CCN(Cc3ccccc3)C2)C(=O)[C@@H]1c1ccc(Cl)c(Cl)c1 ZINC000430981114 858391195 /nfs/dbraw/zinc/39/11/95/858391195.db2.gz WCODOKHNUSGTLD-APWZRJJASA-N 0 3 418.324 4.203 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3CCSC4(CCCCC4)C3)c(C)c2)CC1 ZINC000431056651 858423728 /nfs/dbraw/zinc/42/37/28/858423728.db2.gz DRAASTOKMIWCRP-UHFFFAOYSA-N 0 3 416.635 4.421 20 0 HIADHN CN(C(=O)N[C@H]1CC[C@@H](c2ccccc2F)C1)C1CCN(CCc2ccccn2)CC1 ZINC000431058879 858425116 /nfs/dbraw/zinc/42/51/16/858425116.db2.gz AHGVYKPGAOETIC-CTNGQTDRSA-N 0 3 424.564 4.205 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NC(C)(C)c3ccc(F)c(F)c3)c(C)c2)CC1 ZINC000431058658 858425133 /nfs/dbraw/zinc/42/51/33/858425133.db2.gz NKEXOEIOVJJINS-UHFFFAOYSA-N 0 3 416.516 4.472 20 0 HIADHN CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)N[C@@H]1CC[C@H](c2ccccc2F)C1 ZINC000431060560 858427742 /nfs/dbraw/zinc/42/77/42/858427742.db2.gz SQIPQKJLTTYLKQ-YPIYEQTHSA-N 0 3 410.537 4.191 20 0 HIADHN CCc1noc(-c2ccc(C)c(NC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)c2)n1 ZINC000431129585 858459640 /nfs/dbraw/zinc/45/96/40/858459640.db2.gz VDTIISXAWWOIQX-LJQANCHMSA-N 0 3 405.502 4.003 20 0 HIADHN CCc1noc(-c2ccc(C)c(NC(=O)NC[C@@H]3CCCN3Cc3ccccc3)c2)n1 ZINC000431130676 858460291 /nfs/dbraw/zinc/46/02/91/858460291.db2.gz YMPADOLHQSEISC-FQEVSTJZSA-N 0 3 419.529 4.394 20 0 HIADHN COCCCOc1cccc(NC(=O)NCC(C)(C)N2CCc3ccccc3C2)c1 ZINC000431139558 858465901 /nfs/dbraw/zinc/46/59/01/858465901.db2.gz OGFQCVHDCQLHDB-UHFFFAOYSA-N 0 3 411.546 4.060 20 0 HIADHN Cc1ccccc1[C@H](OC[C@@H](O)CN1CC[C@@H](Oc2ccncc2)C1)c1ccccc1 ZINC000431166369 858481801 /nfs/dbraw/zinc/48/18/01/858481801.db2.gz IUTDIDXULRYOPB-GGBSJPMNSA-N 0 3 418.537 4.010 20 0 HIADHN C[C@@H]1C[C@H](N(C)S(=O)(=O)Cc2cc(Cl)ccc2F)CCN1Cc1ccccc1 ZINC000431284759 858546133 /nfs/dbraw/zinc/54/61/33/858546133.db2.gz WIXXLHYUNLDLEG-OXQOHEQNSA-N 0 3 424.969 4.294 20 0 HIADHN C[C@H]1CCN(C(=O)c2cccc(OCC(F)(F)F)c2)CCN1Cc1ccccc1 ZINC000431501349 858646239 /nfs/dbraw/zinc/64/62/39/858646239.db2.gz XELIDNXZBOCJSV-KRWDZBQOSA-N 0 3 406.448 4.364 20 0 HIADHN CCN(C)C(=O)CCN[C@H](c1ccccc1)c1ccc(OC)c(Br)c1 ZINC000431595214 858681149 /nfs/dbraw/zinc/68/11/49/858681149.db2.gz JIDMUOWKKQGGLT-HXUWFJFHSA-N 0 3 405.336 4.005 20 0 HIADHN CC(=O)NC[C@@H]1CCCN(Cc2cn(-c3ccccc3)nc2-c2ccc(F)cc2)C1 ZINC000431738192 858776337 /nfs/dbraw/zinc/77/63/37/858776337.db2.gz BJGNRYKFKRTNAM-IBGZPJMESA-N 0 3 406.505 4.027 20 0 HIADHN O=C(Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)c1ccc(-c2cc[nH]n2)s1 ZINC000431926066 858873139 /nfs/dbraw/zinc/87/31/39/858873139.db2.gz NYLVMCOBPONBMX-KRWDZBQOSA-N 0 3 418.526 4.034 20 0 HIADHN COc1cnccc1N1CCN(C(=O)Nc2ccc(N3CCCC[C@H]3C)cc2C)CC1 ZINC000432213339 859050605 /nfs/dbraw/zinc/05/06/05/859050605.db2.gz OAPDUIUWXANDBI-LJQANCHMSA-N 0 3 423.561 4.132 20 0 HIADHN Cn1cc(-c2ncc(CN3CCC(c4cccc(Br)c4)CC3)cn2)cn1 ZINC000467557366 881379606 /nfs/dbraw/zinc/37/96/06/881379606.db2.gz JDPIBQGHRLXQEM-UHFFFAOYSA-N 0 3 412.335 4.019 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)NC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)cc1 ZINC000432329354 859105687 /nfs/dbraw/zinc/10/56/87/859105687.db2.gz OSWSOABNXOQXSU-AVRDEDQJSA-N 0 3 420.532 4.409 20 0 HIADHN COc1cnccc1N1CCN(C(=O)Nc2ccc(COc3ccccc3)cc2)CC1 ZINC000432359753 859120348 /nfs/dbraw/zinc/12/03/48/859120348.db2.gz UMYHQCKIWHTGMZ-UHFFFAOYSA-N 0 3 418.497 4.023 20 0 HIADHN COCCn1cc2c(n1)[C@H](NC1CC(c3cccc(Br)c3)C1)CCC2 ZINC000432441864 859166088 /nfs/dbraw/zinc/16/60/88/859166088.db2.gz KYSHTHBZFGNGKI-NKELODKYSA-N 0 3 404.352 4.205 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)NCc1ccc2c(c1)COC2 ZINC000432489125 859189692 /nfs/dbraw/zinc/18/96/92/859189692.db2.gz NMQHFOSLRWCOAM-UHFFFAOYSA-N 0 3 421.463 4.009 20 0 HIADHN CC(C)(CNC(=O)C1(Cc2cccc(F)c2)CCOCC1)N1CCc2ccccc2C1 ZINC000432494024 859193199 /nfs/dbraw/zinc/19/31/99/859193199.db2.gz XZHKSWDFWAWRHX-UHFFFAOYSA-N 0 3 424.560 4.118 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)c1cncc(-c2ccc3c(c2)CCO3)c1 ZINC000432653434 859275336 /nfs/dbraw/zinc/27/53/36/859275336.db2.gz FBDOILMTSTYOJI-UHFFFAOYSA-N 0 3 419.500 4.027 20 0 HIADHN CN(CCC1CCOCC1)Cc1cccc(Br)c1OC[C@@H]1CCCO1 ZINC000432795660 859363733 /nfs/dbraw/zinc/36/37/33/859363733.db2.gz XLTUSJCJXKYHFE-SFHVURJKSA-N 0 3 412.368 4.255 20 0 HIADHN COC(=O)c1cc([C@H](C)N2CCC[C@H](c3nnc(C4CCCCC4)[nH]3)C2)oc1C ZINC000432850369 859388792 /nfs/dbraw/zinc/38/87/92/859388792.db2.gz JKFWQSGZTJEHSX-YOEHRIQHSA-N 0 3 400.523 4.481 20 0 HIADHN CN(C)Cc1ccc(S(=O)(=O)N(Cc2ccc(C(F)(F)F)cc2)C2CC2)cc1 ZINC000432863014 859394687 /nfs/dbraw/zinc/39/46/87/859394687.db2.gz HKPULQJCICCYEL-UHFFFAOYSA-N 0 3 412.477 4.120 20 0 HIADHN CC[C@H](CNC(=O)N1CCC(c2ncc(C)s2)CC1)N1CCc2ccccc2C1 ZINC000432865001 859396747 /nfs/dbraw/zinc/39/67/47/859396747.db2.gz NJZFCFOOLXITIT-OAQYLSRUSA-N 0 3 412.603 4.177 20 0 HIADHN COCCC[C@H](NCc1ccc(NC(C)=O)nc1)c1ccc(Br)cc1 ZINC000433098598 859520629 /nfs/dbraw/zinc/52/06/29/859520629.db2.gz WBLHOBOINQOCKQ-SFHVURJKSA-N 0 3 406.324 4.060 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CCC(c4ncc(C)s4)CC3)c2)CC1 ZINC000433104269 859522938 /nfs/dbraw/zinc/52/29/38/859522938.db2.gz LKRVXRRRFQDEIE-UHFFFAOYSA-N 0 3 413.591 4.005 20 0 HIADHN O=C(CCc1cccc(C(F)(F)F)c1)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000467633448 881432370 /nfs/dbraw/zinc/43/23/70/881432370.db2.gz PDMFQHXPJQFXHP-UHFFFAOYSA-N 0 3 420.475 4.481 20 0 HIADHN CCN1CC[C@H](N[C@H](C)c2cc(C(=O)OC)c(C)o2)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000433206552 859565878 /nfs/dbraw/zinc/56/58/78/859565878.db2.gz OBCLZNOZNOWFJE-CGQHOMIXSA-N 0 3 410.436 4.278 20 0 HIADHN O=C(COc1cccc(NC(=O)[C@H]2CCCCN2C2CCCC2)c1)Nc1ccccc1 ZINC000433306080 859629638 /nfs/dbraw/zinc/62/96/38/859629638.db2.gz RBIXUZUDTFUZCO-HSZRJFAPSA-N 0 3 421.541 4.440 20 0 HIADHN C[C@H]1CN([C@H](CNCc2ccc(-c3cc[nH]n3)o2)c2c(F)cccc2Cl)CCO1 ZINC000433328399 859645469 /nfs/dbraw/zinc/64/54/69/859645469.db2.gz RYGRMEMAMMHMLN-IFXJQAMLSA-N 0 3 418.900 4.014 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)c2ccc(-c3nc(C4CC4)no3)cc2)C1 ZINC000433421122 859691374 /nfs/dbraw/zinc/69/13/74/859691374.db2.gz NLYSZUHGYHSFAO-HRAATJIYSA-N 0 3 402.498 4.179 20 0 HIADHN Cc1cc(NC(=O)N2CC3(CCC3)C[C@@H]2C)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000433496359 859734171 /nfs/dbraw/zinc/73/41/71/859734171.db2.gz FAGICGPEMHIPFW-FPOVZHCZSA-N 0 3 407.562 4.435 20 0 HIADHN CC(C)(C)OC1CC(CCNC(=O)Nc2ccc(CCN3CCSCC3)cc2)C1 ZINC000433522975 859754104 /nfs/dbraw/zinc/75/41/04/859754104.db2.gz YFROLJULVZTLBD-UHFFFAOYSA-N 0 3 419.635 4.383 20 0 HIADHN CCN1CCC[C@@H](CN(C)C(=O)Nc2ccc(Cl)c(OC)c2)[C@@H]1c1cnn(C)c1 ZINC000433607481 859807497 /nfs/dbraw/zinc/80/74/97/859807497.db2.gz JNWYCMZGIULBCC-MGPUTAFESA-N 0 3 419.957 4.019 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)N[C@@H](c1cc(F)ccc1F)C(F)F ZINC000433646685 859823013 /nfs/dbraw/zinc/82/30/13/859823013.db2.gz AKKZURAHBJXDSA-IBGZPJMESA-N 0 3 409.427 4.019 20 0 HIADHN O=C(NCCN1CCCCC1)Nc1ccc(Oc2ncc(Cl)cn2)c(Cl)c1 ZINC000433664033 859829116 /nfs/dbraw/zinc/82/91/16/859829116.db2.gz LZEPCXOQIOJYFQ-UHFFFAOYSA-N 0 3 410.305 4.183 20 0 HIADHN C[C@H]1CN(CCCCNC(=O)c2ccc(C(C)(C)C(F)(F)F)cc2)C[C@H](C)O1 ZINC000433708485 859846739 /nfs/dbraw/zinc/84/67/39/859846739.db2.gz ISCUVCAKIKWYNO-HOTGVXAUSA-N 0 3 400.485 4.146 20 0 HIADHN CCNC(=O)Nc1cccc(NC(=O)NC[C@H](c2ccsc2)N(CC)CC)c1C ZINC000433748063 859872819 /nfs/dbraw/zinc/87/28/19/859872819.db2.gz JAWYILHIHFIYGT-LJQANCHMSA-N 0 3 417.579 4.403 20 0 HIADHN CNC(=O)CCOC1CCN(c2ccnc3ccc(Oc4ccccc4)cc32)CC1 ZINC000433780720 859889987 /nfs/dbraw/zinc/88/99/87/859889987.db2.gz CUVCTOWBQRJSJH-UHFFFAOYSA-N 0 3 405.498 4.149 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1ccc(F)cc1-c1cnn(C)c1 ZINC000433788412 859893212 /nfs/dbraw/zinc/89/32/12/859893212.db2.gz FRIFJPJVLIARPC-SFHVURJKSA-N 0 3 421.520 4.355 20 0 HIADHN Cn1cc(-c2cc(F)ccc2NC(=O)N(Cc2ccccc2)C2CCN(C)CC2)cn1 ZINC000433792650 859894990 /nfs/dbraw/zinc/89/49/90/859894990.db2.gz JBXUJKWMQVXCEX-UHFFFAOYSA-N 0 3 421.520 4.355 20 0 HIADHN C[C@H]1C[C@H](NC(=O)c2cccc(CSc3nccn3C)c2)CN1Cc1ccccc1 ZINC000467684609 881477585 /nfs/dbraw/zinc/47/75/85/881477585.db2.gz CXOMCOQUWKZDKJ-AVRDEDQJSA-N 0 3 420.582 4.105 20 0 HIADHN O=C(Cc1cc(F)ccc1Br)NC[C@H](c1cccs1)N1CCCC1 ZINC000433867503 859943223 /nfs/dbraw/zinc/94/32/23/859943223.db2.gz IMDAMUROOZZZFN-MRXNPFEDSA-N 0 3 411.340 4.146 20 0 HIADHN CN(C)Cc1ccc(S(=O)(=O)NC2(c3cccc(C(F)(F)F)c3)CCC2)cc1 ZINC000433868805 859943477 /nfs/dbraw/zinc/94/34/77/859943477.db2.gz JEESRKVKQGOAJH-UHFFFAOYSA-N 0 3 412.477 4.125 20 0 HIADHN CC(C)C(=O)Nc1ccc(Cl)c(C(=O)N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)c1 ZINC000467689630 881482249 /nfs/dbraw/zinc/48/22/49/881482249.db2.gz WLBJTVSZKYZERL-LPHOPBHVSA-N 0 3 413.949 4.327 20 0 HIADHN Cc1c(NC(=O)N[C@@H](CN2CCCC2)c2ccccc2)noc1-c1ccccc1F ZINC000433917886 859969712 /nfs/dbraw/zinc/96/97/12/859969712.db2.gz HBCQIAMQNFEXTH-FQEVSTJZSA-N 0 3 408.477 4.748 20 0 HIADHN CC(C)n1nc(-c2ccco2)cc1NC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000433924511 859975245 /nfs/dbraw/zinc/97/52/45/859975245.db2.gz CWAOXYDZGLHIEN-IBGZPJMESA-N 0 3 407.518 4.462 20 0 HIADHN O=C(NC[C@H]1CCCN(c2ccccc2)C1)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000433936107 859984230 /nfs/dbraw/zinc/98/42/30/859984230.db2.gz GWZFJFDDCGHKMW-QPPBQGQZSA-N 0 3 406.574 4.039 20 0 HIADHN CC[C@H](CNC(=O)c1ccccc1NCc1cccnc1)N1CCc2ccccc2C1 ZINC000433947667 859994737 /nfs/dbraw/zinc/99/47/37/859994737.db2.gz APKCLQWMKYUXIZ-HSZRJFAPSA-N 0 3 414.553 4.260 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N(CCCO)Cc1cccc(Cl)c1 ZINC000434076183 860084653 /nfs/dbraw/zinc/08/46/53/860084653.db2.gz GALSXZDHICCABI-LJQANCHMSA-N 0 3 421.994 4.133 20 0 HIADHN CCCN(C)CC(=O)N[C@H](C)c1sc(-c2ccccc2Br)nc1C ZINC000467713713 881511451 /nfs/dbraw/zinc/51/14/51/881511451.db2.gz JIYBPLBRBREFJH-GFCCVEGCSA-N 0 3 410.381 4.400 20 0 HIADHN C[C@H]1CN(C2CC2)C[C@@H]1NC(=O)c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1 ZINC000467713348 881511715 /nfs/dbraw/zinc/51/17/15/881511715.db2.gz LUVSNIBUTYKLCN-UGSOOPFHSA-N 0 3 405.420 4.105 20 0 HIADHN C[C@@H]1CCCN1C(=O)CCN(C)Cc1cn(-c2ccccc2)nc1-c1cccs1 ZINC000434290207 860255222 /nfs/dbraw/zinc/25/52/22/860255222.db2.gz XQRVZUKQWKEARX-GOSISDBHSA-N 0 3 408.571 4.434 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)Cc1c[nH]c2ccccc12 ZINC000434313944 860274290 /nfs/dbraw/zinc/27/42/90/860274290.db2.gz CEAJXTRZPDPNKQ-NRFANRHFSA-N 0 3 413.525 4.301 20 0 HIADHN CCc1nc(C)c(C(=O)Nc2c(C)cnn2[C@@H]2CCN(Cc3ccccc3)C2)s1 ZINC000434320280 860280919 /nfs/dbraw/zinc/28/09/19/860280919.db2.gz AUHGNILBWLHFHT-GOSISDBHSA-N 0 3 409.559 4.218 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)CCOCc1ccccc1 ZINC000434322285 860283246 /nfs/dbraw/zinc/28/32/46/860283246.db2.gz URFNIYJLPGBYNT-QHCPKHFHSA-N 0 3 418.541 4.184 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)[C@@H](C)COc1ccccc1 ZINC000434333173 860295234 /nfs/dbraw/zinc/29/52/34/860295234.db2.gz DOKIQNXMJPJTJS-RBBKRZOGSA-N 0 3 418.541 4.292 20 0 HIADHN O=C(NC[C@@H]1CCCCN1C1CC1)N1CCC[C@H]1c1nc2cc(Cl)ccc2[nH]1 ZINC000434349223 860305279 /nfs/dbraw/zinc/30/52/79/860305279.db2.gz GTRNGFKCAAEEEH-LPHOPBHVSA-N 0 3 401.942 4.080 20 0 HIADHN CN(C)CCN(Cc1cccc(O)c1)C(=O)c1ccc(C(C)(C)C(F)(F)F)cc1 ZINC000434357462 860308870 /nfs/dbraw/zinc/30/88/70/860308870.db2.gz BGIYYRAQIWWRNY-UHFFFAOYSA-N 0 3 408.464 4.436 20 0 HIADHN Cc1nc(CNC(=O)NC[C@@H]2CCCCN2C2CC2)oc1-c1ccc(Cl)cc1 ZINC000434357163 860309172 /nfs/dbraw/zinc/30/91/72/860309172.db2.gz JZGLMQFTQFFBCS-SFHVURJKSA-N 0 3 402.926 4.120 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)[C@@H](C)Sc1ccccn1 ZINC000434412078 860338890 /nfs/dbraw/zinc/33/88/90/860338890.db2.gz OONHHLMIFSOYSR-UYAOXDASSA-N 0 3 421.570 4.153 20 0 HIADHN O=C(NC[C@@H]1CCCCN1C1CC1)c1ccc(SCc2cn3ccccc3n2)cc1 ZINC000434418993 860341964 /nfs/dbraw/zinc/34/19/64/860341964.db2.gz HSYRKCSVNIALPT-NRFANRHFSA-N 0 3 420.582 4.373 20 0 HIADHN O=C(NC[C@H]1CCCCN1C1CC1)c1ccc(Oc2cccc(Cl)c2Cl)nn1 ZINC000434421121 860343272 /nfs/dbraw/zinc/34/32/72/860343272.db2.gz KFGWTASVDMDKTB-CQSZACIVSA-N 0 3 421.328 4.322 20 0 HIADHN C[C@H](NCC1(c2ccc3c(c2)OCO3)CCOCC1)c1nc(C(F)(F)F)cs1 ZINC000467732006 881532768 /nfs/dbraw/zinc/53/27/68/881532768.db2.gz DWAVAKFCTTVPDL-LBPRGKRZSA-N 0 3 414.449 4.290 20 0 HIADHN Cc1ccc(Cl)cc1NC(=O)[C@@H](C)N1CCC(c2ncc3n2CCCC3)CC1 ZINC000434673348 860453746 /nfs/dbraw/zinc/45/37/46/860453746.db2.gz CNHXCIUVIKOXJV-MRXNPFEDSA-N 0 3 400.954 4.388 20 0 HIADHN Cc1sc2nc([C@@H](C)N3CCC(c4ncc5n4CCCC5)CC3)nc(N)c2c1C ZINC000434677347 860456036 /nfs/dbraw/zinc/45/60/36/860456036.db2.gz XFNZRXJSHPBZII-CQSZACIVSA-N 0 3 410.591 4.364 20 0 HIADHN O=C([C@H](c1ccccc1)N1CCC(c2ncc3n2CCCC3)CC1)N1CCCCC1 ZINC000434684701 860459791 /nfs/dbraw/zinc/45/97/91/860459791.db2.gz KBRDINSVXSIMFX-QHCPKHFHSA-N 0 3 406.574 4.153 20 0 HIADHN Cc1cc(Cl)ccc1NC(=O)[C@H](C)N1CCC(c2ncc3n2CCCC3)CC1 ZINC000434687774 860461696 /nfs/dbraw/zinc/46/16/96/860461696.db2.gz FYEKPLJXPQZHMJ-INIZCTEOSA-N 0 3 400.954 4.388 20 0 HIADHN O=C(CCN1CCC(C(=O)c2ccc(F)cc2)CC1)NCc1ccccc1Cl ZINC000434687555 860461762 /nfs/dbraw/zinc/46/17/62/860461762.db2.gz DQIDZWOYVTYOHU-UHFFFAOYSA-N 0 3 402.897 4.080 20 0 HIADHN C[C@@H](c1cc2ccccc2o1)N(C)C(=O)CN1CCC(c2ncc3n2CCCC3)CC1 ZINC000434687854 860461796 /nfs/dbraw/zinc/46/17/96/860461796.db2.gz ZREKROWQPZSDNI-SFHVURJKSA-N 0 3 420.557 4.365 20 0 HIADHN C[C@H](Oc1ccc(-c2ccccc2)cc1)C(=O)NCCCCN1C[C@@H](C)O[C@@H](C)C1 ZINC000434754612 860482073 /nfs/dbraw/zinc/48/20/73/860482073.db2.gz GKFYKKCJFXNHGW-HBMCJLEFSA-N 0 3 410.558 4.127 20 0 HIADHN C[C@H]1CN(CCCCNC(=O)c2cccc(COc3cccc(F)c3)c2)C[C@H](C)O1 ZINC000434783164 860493464 /nfs/dbraw/zinc/49/34/64/860493464.db2.gz KMIUUBACESOBLB-OALUTQOASA-N 0 3 414.521 4.024 20 0 HIADHN Cc1c(F)cccc1NC(=O)CCN(C)[C@H]1c2cc(Cl)cc(Cl)c2C[C@H]1O ZINC000434782250 860493860 /nfs/dbraw/zinc/49/38/60/860493860.db2.gz HXYYVPBPOKLSOD-QUCCMNQESA-N 0 3 411.304 4.360 20 0 HIADHN C/C=C/c1ccc(OC[C@@H](O)CN2CCC(OCC3CCCC3)CC2)c(OC)c1 ZINC000434909719 860550718 /nfs/dbraw/zinc/55/07/18/860550718.db2.gz PMWHVHSFXQIXJL-FHOSRQNYSA-N 0 3 403.563 4.139 20 0 HIADHN COc1cc(NC(=O)NC[C@@H](c2cccs2)N2CCCC2)c(OC)c(C)c1OC ZINC000434968429 860579550 /nfs/dbraw/zinc/57/95/50/860579550.db2.gz MGEWJCQQSZUOSD-INIZCTEOSA-N 0 3 419.547 4.041 20 0 HIADHN CCn1nccc1C1CCN(Cc2ccc(OCc3ccncc3)c(OC)c2)CC1 ZINC000435032529 860607761 /nfs/dbraw/zinc/60/77/61/860607761.db2.gz GIOXZRKRYVZXLX-UHFFFAOYSA-N 0 3 406.530 4.265 20 0 HIADHN Cc1cccc(N2CCN(CCCN[C@H](C)c3nc(C(F)(F)F)cs3)CC2)c1 ZINC000467755297 881568255 /nfs/dbraw/zinc/56/82/55/881568255.db2.gz YHHWARRJHHHMPQ-MRXNPFEDSA-N 0 3 412.525 4.333 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)c2ccccc2-c2nc(C(C)(C)C)no2)CN1Cc1ccccc1 ZINC000467756511 881570202 /nfs/dbraw/zinc/57/02/02/881570202.db2.gz VGNKTISRMDGRIG-PKOBYXMFSA-N 0 3 418.541 4.427 20 0 HIADHN Cc1cc(C)n([C@H](C)CC(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435269409 860709286 /nfs/dbraw/zinc/70/92/86/860709286.db2.gz IHCPFTBHYATNLH-IRLDBZIGSA-N 0 3 420.561 4.042 20 0 HIADHN Cc1cc(NC(=O)[C@@H](C)Oc2ccc(C)cc2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435278408 860714413 /nfs/dbraw/zinc/71/44/13/860714413.db2.gz FXGGLXSZMALAKQ-IFMALSPDSA-N 0 3 418.541 4.353 20 0 HIADHN Cc1cc(NC(=O)c2cccc3cccnc32)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435279026 860714966 /nfs/dbraw/zinc/71/49/66/860714966.db2.gz ILZQTOQGFRVVGP-NRFANRHFSA-N 0 3 411.509 4.439 20 0 HIADHN Cc1cc(NC(=O)Cc2cc(F)ccc2F)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435279103 860715231 /nfs/dbraw/zinc/71/52/31/860715231.db2.gz IMJSGVNDHZURMS-FQEVSTJZSA-N 0 3 410.468 4.098 20 0 HIADHN CCc1ccc(CC(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000435280220 860715975 /nfs/dbraw/zinc/71/59/75/860715975.db2.gz MXGCOIJIGDKWNZ-HSZRJFAPSA-N 0 3 402.542 4.382 20 0 HIADHN Cc1cc(NC(=O)CCc2ccc(F)cc2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435280966 860716102 /nfs/dbraw/zinc/71/61/02/860716102.db2.gz OYZBEGNCWGVJSB-QFIPXVFZSA-N 0 3 406.505 4.349 20 0 HIADHN COc1ccc(C(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)c(C)c1 ZINC000435283499 860717789 /nfs/dbraw/zinc/71/77/89/860717789.db2.gz YGTUVJLQZVAPRK-FQEVSTJZSA-N 0 3 404.514 4.208 20 0 HIADHN CC[C@@H](C(=O)Nc1cc(C)nn1[C@H]1CCN(Cc2ccccc2)C1)c1c(C)noc1C ZINC000435286383 860719103 /nfs/dbraw/zinc/71/91/03/860719103.db2.gz CXJYABMHKHAPIB-LEWJYISDSA-N 0 3 421.545 4.376 20 0 HIADHN CCCCS[C@H](C)C(=O)Nc1cc(C)nn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435286332 860719244 /nfs/dbraw/zinc/71/92/44/860719244.db2.gz WDYXMMQSTKYKNW-QUCCMNQESA-N 0 3 400.592 4.499 20 0 HIADHN Cc1cc(NC(=O)CCOc2ccc(F)cc2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435287363 860719897 /nfs/dbraw/zinc/71/98/97/860719897.db2.gz GPMFBHAEXYJTOQ-OAQYLSRUSA-N 0 3 422.504 4.185 20 0 HIADHN Cc1cc(NC(=O)c2cc(C)c(F)cc2F)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435297292 860726017 /nfs/dbraw/zinc/72/60/17/860726017.db2.gz JMIVQIJJJQXBPY-SFHVURJKSA-N 0 3 410.468 4.477 20 0 HIADHN Cc1cc(NC(=O)Cc2ccc3c(c2)CCC3)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435298696 860726056 /nfs/dbraw/zinc/72/60/56/860726056.db2.gz ZATQHFUQOLXIAP-DEOSSOPVSA-N 0 3 414.553 4.308 20 0 HIADHN CCC(CC)n1ccc(C(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435368004 860766086 /nfs/dbraw/zinc/76/60/86/860766086.db2.gz DGDYJLPCTGTUTR-FQEVSTJZSA-N 0 3 406.534 4.140 20 0 HIADHN CC(C)(Oc1ccc(F)cc1)C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435370699 860768433 /nfs/dbraw/zinc/76/84/33/860768433.db2.gz QHJDWRIUZVHVFJ-FQEVSTJZSA-N 0 3 422.504 4.265 20 0 HIADHN O=C(CSc1ccc(F)cc1)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435372869 860770613 /nfs/dbraw/zinc/77/06/13/860770613.db2.gz SUXXPXLKOIFUFB-LJQANCHMSA-N 0 3 410.518 4.200 20 0 HIADHN O=C(Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)[C@H]1SCCc2ccccc21 ZINC000435380351 860777060 /nfs/dbraw/zinc/77/70/60/860777060.db2.gz NTEKATOGOBPJND-REWPJTCUSA-N 0 3 418.566 4.299 20 0 HIADHN Cc1[nH]c2ccccc2c1CC(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435381010 860777170 /nfs/dbraw/zinc/77/71/70/860777170.db2.gz UMIRMXKEHDVBKU-FQEVSTJZSA-N 0 3 413.525 4.301 20 0 HIADHN CC[C@@H](Oc1ccccc1F)C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435381747 860778037 /nfs/dbraw/zinc/77/80/37/860778037.db2.gz XRNGXRCEVDLMLD-TZIWHRDSSA-N 0 3 422.504 4.265 20 0 HIADHN Cc1cc(NC(=O)N2CCC(C(F)F)CC2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435512240 860830158 /nfs/dbraw/zinc/83/01/58/860830158.db2.gz VPFRXSIDSPFOAI-LJQANCHMSA-N 0 3 417.504 4.148 20 0 HIADHN CC[C@H](NC(=O)Nc1cc(C)nn1[C@H]1CCN(Cc2ccccc2)C1)c1nccs1 ZINC000435520897 860838908 /nfs/dbraw/zinc/83/89/08/860838908.db2.gz FFDHICDQZBUWTP-OALUTQOASA-N 0 3 424.574 4.368 20 0 HIADHN Cc1cc(NC(=O)N2CCc3ccccc32)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435522569 860839950 /nfs/dbraw/zinc/83/99/50/860839950.db2.gz NWESJTRLNMDFMW-OAQYLSRUSA-N 0 3 401.514 4.233 20 0 HIADHN Cc1cc(NC(=O)NCCCc2ccccc2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435525017 860841427 /nfs/dbraw/zinc/84/14/27/860841427.db2.gz CBQAWJDWRWKCJG-HSZRJFAPSA-N 0 3 417.557 4.393 20 0 HIADHN Cc1cc(NC(=O)NCCc2ccccc2F)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435525749 860841845 /nfs/dbraw/zinc/84/18/45/860841845.db2.gz FVIXZWAQCJNAHA-OAQYLSRUSA-N 0 3 421.520 4.142 20 0 HIADHN CSCC[C@@H](C)N(C)C(=O)Nc1cc(C)nn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435527801 860843746 /nfs/dbraw/zinc/84/37/46/860843746.db2.gz NOBAGJXEPQQBCG-QUCCMNQESA-N 0 3 415.607 4.244 20 0 HIADHN Cc1cc(NC(=O)NC[C@]2(C)CCCS2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435528832 860844952 /nfs/dbraw/zinc/84/49/52/860844952.db2.gz WKNRWGRTKSYVGM-KNQAVFIVSA-N 0 3 413.591 4.046 20 0 HIADHN Cc1cc(NC(=O)NCCc2ccc(F)cc2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435533794 860849426 /nfs/dbraw/zinc/84/94/26/860849426.db2.gz KPLLOSSUTUORTO-JOCHJYFZSA-N 0 3 421.520 4.142 20 0 HIADHN Cc1c(NC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)cnn1-c1ccccc1F ZINC000435546976 860861305 /nfs/dbraw/zinc/86/13/05/860861305.db2.gz ZPRCYZSVCWWYPX-GOSISDBHSA-N 0 3 421.520 4.448 20 0 HIADHN Cc1c(NC(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)cnn1-c1ccccc1F ZINC000435547259 860863259 /nfs/dbraw/zinc/86/32/59/860863259.db2.gz CWNCNDFJLSYTMO-APWZRJJASA-N 0 3 407.493 4.277 20 0 HIADHN CC[C@@H](CNC(=O)Nc1cnn(-c2ccccc2)c1C)N1CCc2ccccc2C1 ZINC000435549628 860865924 /nfs/dbraw/zinc/86/59/24/860865924.db2.gz LEKUOXFMKXNHFT-NRFANRHFSA-N 0 3 403.530 4.139 20 0 HIADHN O=C(Cc1cccc2cccnc21)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435633690 860927048 /nfs/dbraw/zinc/92/70/48/860927048.db2.gz APZMPAUJEBLZBL-JOCHJYFZSA-N 0 3 411.509 4.060 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)c1cc(-c2cccs2)[nH]n1 ZINC000435639578 860931382 /nfs/dbraw/zinc/93/13/82/860931382.db2.gz VHPTYBBNUJTTLX-QGZVFWFLSA-N 0 3 418.526 4.034 20 0 HIADHN CCOC(=O)c1c2c(sc1NC(=O)c1cc(C)sn1)C(C)(C)NC(C)(C)C2 ZINC000435648595 860932754 /nfs/dbraw/zinc/93/27/54/860932754.db2.gz WIEUVMJPNOMDOR-UHFFFAOYSA-N 0 3 407.561 4.101 20 0 HIADHN O=C(CCn1ccc2ccccc21)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435649731 860934319 /nfs/dbraw/zinc/93/43/19/860934319.db2.gz YTNYSDYNQMOSNG-QFIPXVFZSA-N 0 3 413.525 4.314 20 0 HIADHN CCn1c(C)cc(C(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)c1C ZINC000435696415 860978931 /nfs/dbraw/zinc/97/89/31/860978931.db2.gz JPLWOCJDOZONMV-NRFANRHFSA-N 0 3 405.546 4.329 20 0 HIADHN Cc1c(C)c(C)c(CNC(=O)NCc2ccccc2CN2CCC(O)CC2)c(C)c1C ZINC000435757620 861036805 /nfs/dbraw/zinc/03/68/05/861036805.db2.gz BVZZHSUMTGMVBN-UHFFFAOYSA-N 0 3 423.601 4.185 20 0 HIADHN CS[C@@H]1CN(C(=O)c2c(C)onc2-c2cccc(Cl)c2Cl)C[C@@H]1N(C)C ZINC000435800615 861069500 /nfs/dbraw/zinc/06/95/00/861069500.db2.gz TWWNHVKPSHBPPD-UONOGXRCSA-N 0 3 414.358 4.074 20 0 HIADHN CC1CCN([C@H](CNC(=O)c2c[nH]nc2-c2ccsc2)c2cccs2)CC1 ZINC000435814671 861080372 /nfs/dbraw/zinc/08/03/72/861080372.db2.gz YLXQVUHLZZHVTJ-QGZVFWFLSA-N 0 3 400.573 4.403 20 0 HIADHN O=C(NCCN1CCCCC1)N[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 ZINC000435840874 861103353 /nfs/dbraw/zinc/10/33/53/861103353.db2.gz UJGRASJPHBXWEF-OAHLLOKOSA-N 0 3 411.390 4.484 20 0 HIADHN Cc1cccc2nc(C3CCN(C(=O)NC[C@@H](Cc4ccccc4)N(C)C)CC3)oc21 ZINC000435843814 861105764 /nfs/dbraw/zinc/10/57/64/861105764.db2.gz GUDJSRHMHZMPTK-OAQYLSRUSA-N 0 3 420.557 4.198 20 0 HIADHN COc1ccc([C@@H](CNC(=O)N[C@H]2C[C@H](c3cccc(F)c3)C2)N2CCCC2)cc1 ZINC000435871381 861131531 /nfs/dbraw/zinc/13/15/31/861131531.db2.gz SLFLWTYXZYKIDB-KJXAQDMKSA-N 0 3 411.521 4.217 20 0 HIADHN Cc1ccc([C@@H](NCCCC(=O)Nc2c(C)cccc2C)[C@H](C)S(C)(=O)=O)cc1 ZINC000435903112 861161691 /nfs/dbraw/zinc/16/16/91/861161691.db2.gz PMWBHRYWZPCCMD-CVDCTZTESA-N 0 3 416.587 4.095 20 0 HIADHN COc1ccc(C(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)cc1C1CC1 ZINC000435911739 861174183 /nfs/dbraw/zinc/17/41/83/861174183.db2.gz PDJJIGLXQABUJC-OAQYLSRUSA-N 0 3 416.525 4.468 20 0 HIADHN CN(C)Cc1cccc(NC(=O)N(C)[C@H]2c3cc(Cl)cc(Cl)c3C[C@H]2O)c1 ZINC000435919481 861178827 /nfs/dbraw/zinc/17/88/27/861178827.db2.gz YGFBHOQEEDISHU-MOPGFXCFSA-N 0 3 408.329 4.177 20 0 HIADHN COC(=O)c1cc2cc(NC(=O)N3CC[C@H](C)N(Cc4ccccc4)CC3)ccc2o1 ZINC000437773105 863092035 /nfs/dbraw/zinc/09/20/35/863092035.db2.gz LKUBXACTTLGWHV-KRWDZBQOSA-N 0 3 421.497 4.348 20 0 HIADHN CCN(CC)CCN(Cc1nc(=O)c2c(-c3ccco3)csc2[nH]1)CC(C)C ZINC000437829678 863178423 /nfs/dbraw/zinc/17/84/23/863178423.db2.gz QUHMGWSQKLRJEE-UHFFFAOYSA-N 0 3 402.564 4.457 20 0 HIADHN CN(CC/C=C/c1ccc(Br)cc1)[C@@H]1CCCC[C@@H]1S(C)(=O)=O ZINC000437879313 863240742 /nfs/dbraw/zinc/24/07/42/863240742.db2.gz BBJALIHZYDSLSG-MJMQLPLLSA-N 0 3 400.382 4.140 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1ncsc1-c1ccccc1 ZINC000437905250 863280165 /nfs/dbraw/zinc/28/01/65/863280165.db2.gz DKPONNOLFIBRQB-UHFFFAOYSA-N 0 3 407.539 4.267 20 0 HIADHN C[C@@H]1CCN(C(=O)Nc2cccc(OC[C@H]3CCCO3)c2)CCN1Cc1ccccc1 ZINC000437911531 863287247 /nfs/dbraw/zinc/28/72/47/863287247.db2.gz OOTFYYADLHSTGV-HYBUGGRVSA-N 0 3 423.557 4.373 20 0 HIADHN CCN(Cc1ccccc1NC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1)C(C)=O ZINC000437920426 863296716 /nfs/dbraw/zinc/29/67/16/863296716.db2.gz YRDVYMSJHDGRMO-HXUWFJFHSA-N 0 3 422.573 4.183 20 0 HIADHN COc1ccc(NC(=O)C2(NCc3cc4c(cccc4F)[nH]3)CCCC2)cc1OC ZINC000437975048 863343328 /nfs/dbraw/zinc/34/33/28/863343328.db2.gz MNURGQHCZZXGMD-UHFFFAOYSA-N 0 3 411.477 4.365 20 0 HIADHN C[C@@H]1CCN(C(=O)Nc2cc(F)ccc2-n2cccn2)CCN1Cc1ccccc1 ZINC000438034548 863394538 /nfs/dbraw/zinc/39/45/38/863394538.db2.gz VMIQTCYZCJFOIY-GOSISDBHSA-N 0 3 407.493 4.140 20 0 HIADHN COCCc1ccc(Oc2ccc(NC(=O)N3CC[C@@H](N4CC=CC4)C3)cc2)cc1 ZINC000438037625 863398015 /nfs/dbraw/zinc/39/80/15/863398015.db2.gz LPVSAPJRSLOXMR-OAQYLSRUSA-N 0 3 407.514 4.146 20 0 HIADHN Cc1ccccc1O[C@@H](C)CNC(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000438081617 863478242 /nfs/dbraw/zinc/47/82/42/863478242.db2.gz PBJLYYWVXSPYNE-IBGZPJMESA-N 0 3 413.587 4.175 20 0 HIADHN Cc1ccc(CC[C@H](C)NC(=O)Nc2ccc(CCN3CCSCC3)cc2)o1 ZINC000438092795 863494737 /nfs/dbraw/zinc/49/47/37/863494737.db2.gz AYHOATAEPQTXAY-KRWDZBQOSA-N 0 3 401.576 4.322 20 0 HIADHN Cc1nc2ccccc2n1C[C@H]1CCCN1Cc1cnn(Cc2ccc(F)cc2)c1 ZINC000438105608 863519382 /nfs/dbraw/zinc/51/93/82/863519382.db2.gz QDPUSNQRIORJRI-JOCHJYFZSA-N 0 3 403.505 4.393 20 0 HIADHN C[C@@H](N[C@H]1CCCc2cc(OC(F)F)ccc21)c1cccc(S(=O)(=O)N(C)C)c1 ZINC000467839445 881676507 /nfs/dbraw/zinc/67/65/07/881676507.db2.gz PAVYATUPXFPKMH-VLIAUNLRSA-N 0 3 424.513 4.267 20 0 HIADHN COc1cccc([C@H](CNC(=O)N[C@H]2C[C@H](c3cccc(F)c3)C2)N2CCCC2)c1 ZINC000438195748 863622855 /nfs/dbraw/zinc/62/28/55/863622855.db2.gz DQKYBLHKTFWGPL-RRPUWOKSSA-N 0 3 411.521 4.217 20 0 HIADHN COc1cccc([C@@H](CNC(=O)N[C@H]2C[C@H](c3ccccc3F)C2)N2CCCC2)c1 ZINC000438198303 863626820 /nfs/dbraw/zinc/62/68/20/863626820.db2.gz JFYOGEGOPPRQDD-DNVFCKCGSA-N 0 3 411.521 4.217 20 0 HIADHN C[C@H](CNC(=O)Nc1ccccc1Oc1ccc(Cl)cc1)CN1CCN(C)CC1 ZINC000438225594 863661437 /nfs/dbraw/zinc/66/14/37/863661437.db2.gz NRCGEZLBPJHHPN-QGZVFWFLSA-N 0 3 416.953 4.137 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Nc1cc2c(cc1Cl)OCCCO2 ZINC000438346665 863816358 /nfs/dbraw/zinc/81/63/58/863816358.db2.gz PVWHKAFVKPDTMW-UHFFFAOYSA-N 0 3 409.939 4.159 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)Nc1c(F)cccc1Br ZINC000438421029 863858512 /nfs/dbraw/zinc/85/85/12/863858512.db2.gz NTWBWRHKPRDSFJ-UHFFFAOYSA-N 0 3 420.326 4.129 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)N[C@H]1C[C@H](c2cc(F)cc(F)c2)C1 ZINC000438435910 863864381 /nfs/dbraw/zinc/86/43/81/863864381.db2.gz ARJBIGJGKHSPHY-CYWCHRQTSA-N 0 3 405.464 4.123 20 0 HIADHN COC(=O)C(C)(C)c1ccc(NC(=O)NC[C@@H]2CCCCN2Cc2ccccc2)cc1 ZINC000438457135 863880803 /nfs/dbraw/zinc/88/08/03/863880803.db2.gz FDBGLLCXYMUCKS-QFIPXVFZSA-N 0 3 423.557 4.313 20 0 HIADHN Cc1cc(NC(=O)c2ccco2)sc1C(=O)N(CCN(C)C)Cc1cccs1 ZINC000438471554 863891035 /nfs/dbraw/zinc/89/10/35/863891035.db2.gz MACUTWOLELEWOX-UHFFFAOYSA-N 0 3 417.556 4.167 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)CCc1ccccc1OC(F)(F)F ZINC000438475607 863893129 /nfs/dbraw/zinc/89/31/29/863893129.db2.gz MSCYNRFHTUDATO-UHFFFAOYSA-N 0 3 400.466 4.170 20 0 HIADHN Cc1ccc(Br)cc1C(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000438550012 863979705 /nfs/dbraw/zinc/97/97/05/863979705.db2.gz HNFGIIBURGPMSS-UHFFFAOYSA-N 0 3 401.348 4.494 20 0 HIADHN CCc1csc(NC(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)n1 ZINC000438590605 864018794 /nfs/dbraw/zinc/01/87/94/864018794.db2.gz SDXRLNURDDLBGU-UHFFFAOYSA-N 0 3 400.470 4.320 20 0 HIADHN C[C@H](CNC(=O)Nc1c(F)cc(Br)cc1F)N(C)Cc1ccccc1 ZINC000438637840 864072078 /nfs/dbraw/zinc/07/20/78/864072078.db2.gz PYJTZOKQBWOORV-GFCCVEGCSA-N 0 3 412.278 4.369 20 0 HIADHN CCN(C(=O)C(=O)Nc1ccc(F)cc1Cl)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000438645045 864082592 /nfs/dbraw/zinc/08/25/92/864082592.db2.gz BYAAWEFIECJLDS-CRAIPNDOSA-N 0 3 417.912 4.102 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2c(F)cc(Br)cc2F)N(C)C)cc1 ZINC000438648166 864087663 /nfs/dbraw/zinc/08/76/63/864087663.db2.gz GFMJQXGGXMFASW-MRXNPFEDSA-N 0 3 412.278 4.460 20 0 HIADHN Cc1ccc(-c2nnco2)cc1NC(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000438651044 864091291 /nfs/dbraw/zinc/09/12/91/864091291.db2.gz MCRGZXHXVUIJGW-UHFFFAOYSA-N 0 3 405.502 4.173 20 0 HIADHN CCN(C(=O)C(=O)Nc1cccc([C@H](C)OC)c1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000438652857 864094398 /nfs/dbraw/zinc/09/43/98/864094398.db2.gz BTLHVUKMPWNANY-MSYCTHLASA-N 0 3 423.557 4.017 20 0 HIADHN CCCOc1ccccc1NC(=O)C(=O)N(CC)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000438656531 864099334 /nfs/dbraw/zinc/09/93/34/864099334.db2.gz OMHIBVSUOOOOPZ-TZIWHRDSSA-N 0 3 423.557 4.098 20 0 HIADHN CN(C)Cc1cccc(NC(=O)C(=O)Nc2ccc(OC3CCCC3)c(Cl)c2)c1 ZINC000438660595 864109253 /nfs/dbraw/zinc/10/92/53/864109253.db2.gz JSZGYTHERRIHAG-UHFFFAOYSA-N 0 3 415.921 4.300 20 0 HIADHN COCc1cccc2sc(NC(=O)N(CCN(C)C)Cc3cccs3)nc21 ZINC000438663743 864116056 /nfs/dbraw/zinc/11/60/56/864116056.db2.gz XVSULIQJOLCZRS-UHFFFAOYSA-N 0 3 404.561 4.100 20 0 HIADHN CCN(C(=O)C(=O)Nc1ccc(Cl)cc1F)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000438663961 864116606 /nfs/dbraw/zinc/11/66/06/864116606.db2.gz XZYQZEDXCHGVQR-QAPCUYQASA-N 0 3 417.912 4.102 20 0 HIADHN CCOc1ccc(NC(=O)C(=O)N(CC)[C@@H]2CCN([C@H](C)c3ccccc3)C2)c(C)c1 ZINC000438666753 864120876 /nfs/dbraw/zinc/12/08/76/864120876.db2.gz RVCIWUIXFGPIJK-TZIWHRDSSA-N 0 3 423.557 4.016 20 0 HIADHN CCCC(=O)Nc1cccc(NC(=O)N(CCN(C)C)Cc2cccs2)c1C ZINC000438685149 864150051 /nfs/dbraw/zinc/15/00/51/864150051.db2.gz AHOFLTJJHONCFI-UHFFFAOYSA-N 0 3 402.564 4.391 20 0 HIADHN COc1cc(NC(=O)CCNC(c2ccccc2)c2ccccc2)cc(OC)c1OC ZINC000438784001 864278591 /nfs/dbraw/zinc/27/85/91/864278591.db2.gz RBARVQIAMKGHAH-UHFFFAOYSA-N 0 3 420.509 4.420 20 0 HIADHN C[C@H](CCN1C(=O)c2ccccc2C1=O)NCc1nc(-c2ccccc2F)cs1 ZINC000438846673 864341835 /nfs/dbraw/zinc/34/18/35/864341835.db2.gz ASTOEXKXHISNKC-CQSZACIVSA-N 0 3 409.486 4.114 20 0 HIADHN Cc1ccc(Br)cc1CNCc1cnc2ccc(Br)cn12 ZINC000438907574 864386382 /nfs/dbraw/zinc/38/63/82/864386382.db2.gz AEPLQRDRKRWMQW-UHFFFAOYSA-N 0 3 409.125 4.458 20 0 HIADHN CC(C)(O)CN1CCc2c(cccc2NC(=O)c2ccc(C(F)(F)F)c(F)c2)C1 ZINC000438928854 864408064 /nfs/dbraw/zinc/40/80/64/864408064.db2.gz JFBIMOAYWCIIKB-UHFFFAOYSA-N 0 3 410.411 4.226 20 0 HIADHN COc1ccc(Cl)cc1N1CC[C@H](N[C@H](C)c2ccc(NC(C)=O)cc2OC)C1 ZINC000438978346 864442076 /nfs/dbraw/zinc/44/20/76/864442076.db2.gz MIFLQFMPVHBDKQ-KDOFPFPSSA-N 0 3 417.937 4.245 20 0 HIADHN Cc1ccc(Br)cc1CNC(=O)c1oc2ccccc2c1CN(C)C ZINC000438991428 864450261 /nfs/dbraw/zinc/45/02/61/864450261.db2.gz CLLAFLIOFDNFJQ-UHFFFAOYSA-N 0 3 401.304 4.495 20 0 HIADHN COc1cc(NC(C)=O)ccc1[C@@H](C)NCCC(=O)Nc1cccc(Cl)c1C ZINC000439005281 864458695 /nfs/dbraw/zinc/45/86/95/864458695.db2.gz VOPDIXMGIYQUGD-CQSZACIVSA-N 0 3 403.910 4.295 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1ccccc1-c1ncc2n1CCCC2 ZINC000439049642 864502414 /nfs/dbraw/zinc/50/24/14/864502414.db2.gz WLTCALCCFBZEAS-UHFFFAOYSA-N 0 3 407.518 4.075 20 0 HIADHN C[C@H]1CN(c2ccc(CN[C@H](c3ccc(Br)s3)C3CC3)cn2)CCO1 ZINC000439141572 864574076 /nfs/dbraw/zinc/57/40/76/864574076.db2.gz OEOIOPRQVOJOTO-DJJJIMSYSA-N 0 3 422.392 4.372 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)NCc1ccc(F)cc1C(F)(F)F ZINC000439209183 864631158 /nfs/dbraw/zinc/63/11/58/864631158.db2.gz ZLSLIVQLWYVEOB-UHFFFAOYSA-N 0 3 403.445 4.179 20 0 HIADHN CCN(C[C@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)c1ccc(Cl)cc1C ZINC000439222159 864639259 /nfs/dbraw/zinc/63/92/59/864639259.db2.gz JJQSEKGOJDMRAP-IBGZPJMESA-N 0 3 406.979 4.181 20 0 HIADHN C[C@H](Sc1ccccc1)c1ccc(NC(=O)C(=O)N(C)CCN2CCCC2)cc1 ZINC000439224540 864642052 /nfs/dbraw/zinc/64/20/52/864642052.db2.gz QCLRVKQAOIDEQN-SFHVURJKSA-N 0 3 411.571 4.033 20 0 HIADHN CN(C)Cc1ccccc1CNC(=O)C1(Cc2ccc(OC(F)(F)F)cc2)CC1 ZINC000439242291 864658854 /nfs/dbraw/zinc/65/88/54/864658854.db2.gz AOBANLKJRYIRRV-UHFFFAOYSA-N 0 3 406.448 4.286 20 0 HIADHN COc1ccc2cc(CN(C)C(=O)[C@@H](C)N3CCC([C@H]4CCCO4)CC3)ccc2c1 ZINC000439302726 864729448 /nfs/dbraw/zinc/72/94/48/864729448.db2.gz VOSOJSOQMBZSCJ-HOYKHHGWSA-N 0 3 410.558 4.086 20 0 HIADHN O=C(Nc1ccccc1OCC1CC1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000467931029 881804355 /nfs/dbraw/zinc/80/43/55/881804355.db2.gz JJUVHADMUWELJX-UHFFFAOYSA-N 0 3 411.468 4.402 20 0 HIADHN CC(C)Oc1ccc([C@@H](C)N[C@@H](C)C(=O)N2CCN(c3ccc(F)cc3)CC2)cc1 ZINC000439565850 864890152 /nfs/dbraw/zinc/89/01/52/864890152.db2.gz CCMMCGMCWLHVGF-MOPGFXCFSA-N 0 3 413.537 4.001 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3ccc(Cc4ccncc4)cc3)cc2)CC1 ZINC000467946011 881815192 /nfs/dbraw/zinc/81/51/92/881815192.db2.gz PVDAEZWYIYVQTB-UHFFFAOYSA-N 0 3 400.526 4.067 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)NC[C@@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000439627331 864953343 /nfs/dbraw/zinc/95/33/43/864953343.db2.gz DTKOKQWDTCEBFI-NVXWUHKLSA-N 0 3 403.464 4.268 20 0 HIADHN COc1ccc(NC(=O)[C@@H](C)NCC(C)(C)c2c(F)cccc2Cl)c(OC)c1 ZINC000439642823 864969314 /nfs/dbraw/zinc/96/93/14/864969314.db2.gz OXNWAVAXCQVBAF-CYBMUJFWSA-N 0 3 408.901 4.391 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)COc2ccccc2-c2ccccc2)CC1 ZINC000439728363 865059799 /nfs/dbraw/zinc/05/97/99/865059799.db2.gz CVVYYIRGKNWXJZ-HXUWFJFHSA-N 0 3 415.537 4.469 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)CCc2cccc(Br)c2)CC1 ZINC000439730714 865063113 /nfs/dbraw/zinc/06/31/13/865063113.db2.gz LAPUUZZUPZLVCI-MRXNPFEDSA-N 0 3 416.363 4.119 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)CCc2cccc(Br)c2)CC1 ZINC000439730713 865063446 /nfs/dbraw/zinc/06/34/46/865063446.db2.gz LAPUUZZUPZLVCI-INIZCTEOSA-N 0 3 416.363 4.119 20 0 HIADHN Cc1ccc(Cl)c(O[C@H](C)C(=O)NC2CCN([C@@H](C)c3ccncc3)CC2)c1 ZINC000439733085 865065803 /nfs/dbraw/zinc/06/58/03/865065803.db2.gz MVENCHCCWHYOIP-DLBZAZTESA-N 0 3 401.938 4.153 20 0 HIADHN Cc1ccc(Cl)c(O[C@H](C)C(=O)NC2CCN([C@H](C)c3ccncc3)CC2)c1 ZINC000439733087 865066028 /nfs/dbraw/zinc/06/60/28/865066028.db2.gz MVENCHCCWHYOIP-IAGOWNOFSA-N 0 3 401.938 4.153 20 0 HIADHN COc1cc(C(=O)NC2CCN([C@H](C)c3ccncc3)CC2)ccc1OCC(C)C ZINC000439748128 865079071 /nfs/dbraw/zinc/07/90/71/865079071.db2.gz TUICHPGNRBEABQ-GOSISDBHSA-N 0 3 411.546 4.080 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)[C@H](C)Oc2cccc(Cl)c2Cl)CC1 ZINC000439762778 865089171 /nfs/dbraw/zinc/08/91/71/865089171.db2.gz CLNQIJKBSFUQKL-CABCVRRESA-N 0 3 422.356 4.498 20 0 HIADHN Cc1ccc(C(=O)NC2CCN([C@@H](C)c3ccncc3)CC2)cc1Br ZINC000439765157 865090291 /nfs/dbraw/zinc/09/02/91/865090291.db2.gz LCJKDBGVQJLXQE-HNNXBMFYSA-N 0 3 402.336 4.108 20 0 HIADHN CC(C)(C)Nc1ccccc1NC(=O)C(=O)NC[C@@]1(C)CCCN1Cc1ccccc1 ZINC000439859113 865165685 /nfs/dbraw/zinc/16/56/85/865165685.db2.gz RCOWSJRWRFOFCC-RUZDIDTESA-N 0 3 422.573 4.006 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1cnn(CC)c1C(F)(F)F)c1ccsc1 ZINC000439905096 865216012 /nfs/dbraw/zinc/21/60/12/865216012.db2.gz SPCUAGXSBZMPHB-AWEZNQCLSA-N 0 3 403.474 4.188 20 0 HIADHN COc1ccc2c(c1)[C@@H](N[C@@H](C)CC(=O)Nc1cc(Cl)ccc1OC)CCO2 ZINC000468025601 881859589 /nfs/dbraw/zinc/85/95/89/881859589.db2.gz JLMOFNIEDOCVLW-GUYCJALGSA-N 0 3 404.894 4.188 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)NCc2cccc(-c3ccccn3)c2)C1 ZINC000440071979 865338485 /nfs/dbraw/zinc/33/84/85/865338485.db2.gz CHZYCLOXZGYLQQ-AUSIDOKSSA-N 0 3 400.526 4.383 20 0 HIADHN CC(C)N(CCN(C)C)C(=O)N[C@@H](C)c1ccc(NC(=O)c2ccc(F)cc2)cc1 ZINC000440086052 865349135 /nfs/dbraw/zinc/34/91/35/865349135.db2.gz DEZZSDDJGBZREZ-KRWDZBQOSA-N 0 3 414.525 4.121 20 0 HIADHN NC(=O)C1CCN(C[C@@H](N[C@@H]2CCCc3sccc32)c2ccc(Cl)cc2)CC1 ZINC000468038426 881868140 /nfs/dbraw/zinc/86/81/40/881868140.db2.gz NJTYPGRWMSXXTH-WOJBJXKFSA-N 0 3 418.006 4.307 20 0 HIADHN COc1ccc(NC(=O)C[C@@H](C)N[C@H](C)c2cn(C(C)(C)C)nc2C)c(OC)c1 ZINC000468040159 881869433 /nfs/dbraw/zinc/86/94/33/881869433.db2.gz DZIYAQLVOZLQMJ-HUUCEWRRSA-N 0 3 402.539 4.032 20 0 HIADHN COc1ccc(-c2nc3c(s2)[C@@H](NC(=O)N(CCN(C)C)C(C)C)CCC3)cc1 ZINC000440211442 865442660 /nfs/dbraw/zinc/44/26/60/865442660.db2.gz CHLRWRROZLWZBS-IBGZPJMESA-N 0 3 416.591 4.178 20 0 HIADHN CCN1CCN(CCC(=O)N(Cc2ccc(-c3cccc(F)c3)s2)C(C)C)CC1 ZINC000468042490 881871496 /nfs/dbraw/zinc/87/14/96/881871496.db2.gz LVNWAXQMKNITFI-UHFFFAOYSA-N 0 3 417.594 4.319 20 0 HIADHN COc1ccccc1[C@@H](NC(=O)N(CCN(C)C)C(C)C)c1ccccc1Cl ZINC000440249072 865489846 /nfs/dbraw/zinc/48/98/46/865489846.db2.gz OUUIZDJEBKGCHR-NRFANRHFSA-N 0 3 403.954 4.420 20 0 HIADHN COc1cc(NC(=O)N2CCN(C3CCC(C(C)C)CC3)CC2)ccc1NC(C)=O ZINC000440255864 865502226 /nfs/dbraw/zinc/50/22/26/865502226.db2.gz NXGQXAHJBZKHPU-UHFFFAOYSA-N 0 3 416.566 4.018 20 0 HIADHN CCCC(=O)Nc1cccc(NC(=O)CCN2CCN(c3cccc(C)c3)CC2)c1C ZINC000468058911 881880081 /nfs/dbraw/zinc/88/00/81/881880081.db2.gz APHSNQGUVKSKOQ-UHFFFAOYSA-N 0 3 422.573 4.193 20 0 HIADHN CC(C)n1cnnc1-c1ccccc1NC(=O)N1CCN(C2CCC(C)CC2)CC1 ZINC000440281885 865533509 /nfs/dbraw/zinc/53/35/09/865533509.db2.gz HYEAVROTEDABFA-UHFFFAOYSA-N 0 3 410.566 4.254 20 0 HIADHN COc1cc(C(C)=O)ccc1OC[C@@H](O)CN1CCC[C@@]2(CCCc3ccccc32)C1 ZINC000440327263 865602665 /nfs/dbraw/zinc/60/26/65/865602665.db2.gz QJDXERZDANAXOF-NVQXNPDNSA-N 0 3 423.553 4.008 20 0 HIADHN COc1ccc([C@H](NC[C@@H](O)COCc2cccs2)c2ccc(F)cc2)cc1 ZINC000440413044 865708244 /nfs/dbraw/zinc/70/82/44/865708244.db2.gz IAAYXWNCTAJWEU-DENIHFKCSA-N 0 3 401.503 4.153 20 0 HIADHN Cc1cc(C(=O)NC[C@@]2(O)CCN(Cc3ccccc3)C2)sc1-c1ccc(F)cc1 ZINC000440514588 865801440 /nfs/dbraw/zinc/80/14/40/865801440.db2.gz QGVWSBWXBUUCDD-DEOSSOPVSA-N 0 3 424.541 4.229 20 0 HIADHN COCc1ccc([C@H]2CCCN2C(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)o1 ZINC000468101666 881911034 /nfs/dbraw/zinc/91/10/34/881911034.db2.gz KQNWGAIRFSWGOL-YADHBBJMSA-N 0 3 411.546 4.418 20 0 HIADHN Cc1cccc(C)c1NC(=O)CNC(=O)[C@H](C)N[C@H]1CC(C)(C)CCc2ccccc21 ZINC000440635890 865851490 /nfs/dbraw/zinc/85/14/90/865851490.db2.gz KTTXCTFAWLGMMP-UGKGYDQZSA-N 0 3 421.585 4.440 20 0 HIADHN COCc1nc(C(=O)NCCCN2CCc3ccccc3C2)c(-c2ccccc2)s1 ZINC000440754704 865892235 /nfs/dbraw/zinc/89/22/35/865892235.db2.gz RLCFLHUUAJHELO-UHFFFAOYSA-N 0 3 421.566 4.135 20 0 HIADHN Cc1nc(-c2ccc(C(=O)NC[C@H]3CN(Cc4ccccc4)CCCO3)cc2)cs1 ZINC000440887167 865982425 /nfs/dbraw/zinc/98/24/25/865982425.db2.gz LEZNKXZEHBJGFZ-QFIPXVFZSA-N 0 3 421.566 4.139 20 0 HIADHN Cc1ccccc1-c1cc(C(=O)N[C@H]2C[C@@H](C)N(C3CC3)C2)c2cnn(C(C)C)c2n1 ZINC000440913896 866009349 /nfs/dbraw/zinc/00/93/49/866009349.db2.gz MHOXIOKDWKXJMI-MSOLQXFVSA-N 0 3 417.557 4.343 20 0 HIADHN O=C(COc1cccc(NC(=O)[C@@H]2CCCN2C2CCCC2)c1)Nc1ccccc1 ZINC000440919696 866015033 /nfs/dbraw/zinc/01/50/33/866015033.db2.gz FRSATIUCYAVOIP-QFIPXVFZSA-N 0 3 407.514 4.050 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)c2ccccc2-c2nc(-c3cccc(Cl)c3)no2)CN1C1CC1 ZINC000440928340 866025543 /nfs/dbraw/zinc/02/55/43/866025543.db2.gz XYBJOVHTCJFVIR-PBHICJAKSA-N 0 3 422.916 4.412 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)c2ccccc2CSc2nc3ccccc3o2)CN1C1CC1 ZINC000440936026 866035723 /nfs/dbraw/zinc/03/57/23/866035723.db2.gz LYEKXQHFYLJDIN-WBVHZDCISA-N 0 3 407.539 4.475 20 0 HIADHN CCc1nc2c(s1)[C@H](N(C)C[C@H](O)CO[C@H]1CCCc3ccccc31)CCC2 ZINC000441023370 866089262 /nfs/dbraw/zinc/08/92/62/866089262.db2.gz OHBJLDIXKUYSMC-WMQCIHAUSA-N 0 3 400.588 4.470 20 0 HIADHN CCc1nc2c(s1)[C@H](N(C)C[C@@H](O)CO[C@@H]1CCCc3ccccc31)CCC2 ZINC000441023361 866089502 /nfs/dbraw/zinc/08/95/02/866089502.db2.gz OHBJLDIXKUYSMC-DUXKGJEZSA-N 0 3 400.588 4.470 20 0 HIADHN COCc1nc(CNC(=O)NC[C@H](c2ccccc2)N(C)C)c(-c2ccccc2)s1 ZINC000441036448 866099907 /nfs/dbraw/zinc/09/99/07/866099907.db2.gz SHLOJZHDMWDZBP-HXUWFJFHSA-N 0 3 424.570 4.059 20 0 HIADHN C[C@@H](NC(=O)CCN1CCN(c2ccccc2)CC1)c1ccccc1C(F)(F)F ZINC000468116300 881941583 /nfs/dbraw/zinc/94/15/83/881941583.db2.gz DSAPEUIRRUDDCP-QGZVFWFLSA-N 0 3 405.464 4.095 20 0 HIADHN Cc1ccc2sc(N(Cc3ccccc3)C(=O)CNC3(CO)CCCC3)nc2c1C ZINC000441058866 866138917 /nfs/dbraw/zinc/13/89/17/866138917.db2.gz SQSLELSBRMLNGA-UHFFFAOYSA-N 0 3 423.582 4.341 20 0 HIADHN Cc1ccnc(Oc2ccc(NC(=O)N3CCN(CC4CCCCC4)CC3)cc2)n1 ZINC000441108661 866205526 /nfs/dbraw/zinc/20/55/26/866205526.db2.gz DWJMDPAXEBZMAY-UHFFFAOYSA-N 0 3 409.534 4.307 20 0 HIADHN COc1ccccc1NC(=O)C1CCN(Cc2ccc(C(=O)OC(C)C)cc2)CC1 ZINC000441153427 866243779 /nfs/dbraw/zinc/24/37/79/866243779.db2.gz FXUFHFGAROGSOY-UHFFFAOYSA-N 0 3 410.514 4.111 20 0 HIADHN COc1cc(-c2nnc(CN3CCC[C@H]3CCc3ccccc3)o2)cc(OC)c1OC ZINC000441200682 866270604 /nfs/dbraw/zinc/27/06/04/866270604.db2.gz JLEAYGGQQXNWIH-IBGZPJMESA-N 0 3 423.513 4.360 20 0 HIADHN O=C(CN1CCC[C@H]([C@@H]2CCOC2)C1)N[C@H](c1ccccc1)c1ccc(Cl)cc1 ZINC000441279599 866354478 /nfs/dbraw/zinc/35/44/78/866354478.db2.gz CISBWSHZKGRRBJ-YZUZCNPQSA-N 0 3 412.961 4.294 20 0 HIADHN CN(C(=O)CN1CCC[C@H]([C@@H]2CCOC2)C1)[C@H](c1ccccc1)c1ccc(F)cc1 ZINC000441292606 866366032 /nfs/dbraw/zinc/36/60/32/866366032.db2.gz JWLDRGUDCXHVNY-SGIRGMQISA-N 0 3 410.533 4.122 20 0 HIADHN CCOc1cc(CN[C@@H]2C(=O)NCC[C@H]2C)ccc1OCc1c(F)cccc1Cl ZINC000441325137 866396640 /nfs/dbraw/zinc/39/66/40/866396640.db2.gz BMFKQFQWYIASBD-SZNDQCEHSA-N 0 3 420.912 4.071 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3ccccc3OC[C@H]3CCCCO3)cc2)CC1 ZINC000468130219 881971999 /nfs/dbraw/zinc/97/19/99/881971999.db2.gz FLMWBKRAUVPQLO-JOCHJYFZSA-N 0 3 423.557 4.029 20 0 HIADHN Cc1ccc(NC(=O)Nc2cccc3c2CCN(CCC(=O)N2CCC[C@@H]2C)C3)cc1 ZINC000441330547 866401340 /nfs/dbraw/zinc/40/13/40/866401340.db2.gz ZYKOONIWUFRGSS-IBGZPJMESA-N 0 3 420.557 4.398 20 0 HIADHN COc1cc2c(cc1OC)CN(C(=O)CN(C)[C@@H]1CCC[C@H]1c1ccc(C)cc1)CC2 ZINC000441352047 866422014 /nfs/dbraw/zinc/42/20/14/866422014.db2.gz JUKISXPFSAMNTG-XZOQPEGZSA-N 0 3 422.569 4.165 20 0 HIADHN CC[C@H](Cc1ccccc1)N(C)Cc1nnc(-c2cc(OC)c(OC)c(OC)c2)o1 ZINC000441434687 866511779 /nfs/dbraw/zinc/51/17/79/866511779.db2.gz KNUUZFUKJWSCIH-GOSISDBHSA-N 0 3 411.502 4.216 20 0 HIADHN COc1ccc2c(c1)[C@@H](N(CCC(=O)N1CCC[C@H]1C)Cc1ccccc1)CCO2 ZINC000441455083 866529494 /nfs/dbraw/zinc/52/94/94/866529494.db2.gz CUWLZOBCFDDUMU-XXBNENTESA-N 0 3 408.542 4.422 20 0 HIADHN CCN(CC)[C@H](CNC(=O)C(=O)Nc1ccc(C(F)(F)F)c(C)c1)c1ccccc1 ZINC000441597987 866689322 /nfs/dbraw/zinc/68/93/22/866689322.db2.gz MGNOPSHXMVNFHL-LJQANCHMSA-N 0 3 421.463 4.152 20 0 HIADHN CC1CCN([C@@H](CNC(=O)N2CCO[C@H](c3ccsc3)C2)c2cccs2)CC1 ZINC000468161044 882030037 /nfs/dbraw/zinc/03/00/37/882030037.db2.gz USBPQNAPZBPSFT-OALUTQOASA-N 0 3 419.616 4.366 20 0 HIADHN CCC[C@@H]1CCc2nc(NC(=O)N(CCN(C)C)Cc3ccccn3)sc2C1 ZINC000441924660 866988924 /nfs/dbraw/zinc/98/89/24/866988924.db2.gz FMAOHPFXPBBXSL-MRXNPFEDSA-N 0 3 401.580 4.039 20 0 HIADHN CC[C@H]1CCc2nc(NC(=O)N3CCC(CN4C[C@@H](C)O[C@@H](C)C4)CC3)sc2C1 ZINC000441940336 867006006 /nfs/dbraw/zinc/00/60/06/867006006.db2.gz FHFVQODCGHLENK-BBWFWOEESA-N 0 3 420.623 4.011 20 0 HIADHN CC(C)c1ncc(CN(C)C(=O)N[C@@H](CN2CCc3ccccc3C2)C(C)(C)C)cn1 ZINC000442143581 867165702 /nfs/dbraw/zinc/16/57/02/867165702.db2.gz XDHHTRTWSPKENP-QFIPXVFZSA-N 0 3 423.605 4.214 20 0 HIADHN Cc1ccc(Sc2ccc(NC(=O)C(=O)N[C@@H](C)C3=CCN(C)CC3)cc2)c(C)c1 ZINC000442338793 867333991 /nfs/dbraw/zinc/33/39/91/867333991.db2.gz AMNPDLHIAOOHJJ-SFHVURJKSA-N 0 3 423.582 4.160 20 0 HIADHN Cc1ccc(OCc2ccccc2)c(NC(=O)N(CCN(C)C)C[C@@H]2CCCO2)c1 ZINC000442446797 867421377 /nfs/dbraw/zinc/42/13/77/867421377.db2.gz WEYXZIXGFOJKQW-NRFANRHFSA-N 0 3 411.546 4.149 20 0 HIADHN Cc1ccc(OCc2ccccc2)c(NC(=O)NC(C)(C)CCN2CCN(C)CC2)c1 ZINC000442476536 867458842 /nfs/dbraw/zinc/45/88/42/867458842.db2.gz NFMVTVXPICOTDM-UHFFFAOYSA-N 0 3 424.589 4.112 20 0 HIADHN CN(C(=O)N[C@@H]1CC(C)(C)CCc2ccccc21)C1CCN(CCn2cccn2)CC1 ZINC000442608584 867556937 /nfs/dbraw/zinc/55/69/37/867556937.db2.gz KGEUEWHPQHCTDT-HSZRJFAPSA-N 0 3 423.605 4.093 20 0 HIADHN O=C(c1[nH]ccc1-c1c(Cl)cccc1Cl)N1CCN(CC2CCOCC2)CC1 ZINC000442722899 867648188 /nfs/dbraw/zinc/64/81/88/867648188.db2.gz OCXMWNYQNDQMCC-UHFFFAOYSA-N 0 3 422.356 4.173 20 0 HIADHN CC(C)[C@H]([NH2+][C@@H]1CC[C@@H](c2ccc(C(F)(F)F)cc2)C1)c1nc(-c2nc[n-]n2)no1 ZINC000442850427 867696857 /nfs/dbraw/zinc/69/68/57/867696857.db2.gz PKMGLHDLEXKHPL-BMFZPTHFSA-N 0 3 420.439 4.497 20 0 HIADHN Cc1nc(COc2ccc(CN[C@@H]3CCCN(C4CCCCC4)C3=O)cc2)cs1 ZINC000443017137 867794793 /nfs/dbraw/zinc/79/47/93/867794793.db2.gz YRGGHMOXLCLZMP-JOCHJYFZSA-N 0 3 413.587 4.444 20 0 HIADHN CC(C)NC(=O)Nc1ccc([C@H](C)N[C@@H]2CCCN(C3CCCCC3)C2=O)cc1 ZINC000443102708 867819540 /nfs/dbraw/zinc/81/95/40/867819540.db2.gz MRYCQEYOVSGQCD-LAUBAEHRSA-N 0 3 400.567 4.191 20 0 HIADHN COc1cc(NC(C)=O)ccc1[C@@H](C)NCCN1CCc2c(Cl)cccc2C1 ZINC000443109937 867823135 /nfs/dbraw/zinc/82/31/35/867823135.db2.gz QPDKFGMZFHZUGU-OAHLLOKOSA-N 0 3 401.938 4.016 20 0 HIADHN C[C@H](CS(=O)(=O)c1ccccc1)NCC1(c2cc(F)cc(C(F)(F)F)c2)CC1 ZINC000443109218 867823280 /nfs/dbraw/zinc/82/32/80/867823280.db2.gz YDFHEYCNIWERFV-CQSZACIVSA-N 0 3 415.452 4.328 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3CC4(CCCC4)OC(C)(C)C3)c(C)c2)CC1 ZINC000443154704 867846636 /nfs/dbraw/zinc/84/66/36/867846636.db2.gz HCAYEKIUYYWWHZ-UHFFFAOYSA-N 0 3 414.594 4.092 20 0 HIADHN Cc1c(F)c(C(F)(F)F)ccc1C(=O)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000443282905 867890421 /nfs/dbraw/zinc/89/04/21/867890421.db2.gz IWAXVJPQJICSCF-UHFFFAOYSA-N 0 3 410.411 4.362 20 0 HIADHN C[C@@H](NC(=O)N[C@H]1CCN(Cc2ccccc2)C1)c1ccc(Br)s1 ZINC000443294689 867893054 /nfs/dbraw/zinc/89/30/54/867893054.db2.gz HZURJGWHIUCIHX-HIFRSBDPSA-N 0 3 408.365 4.145 20 0 HIADHN CC[C@@]1(C)Oc2ccc(NC(=O)N(CCN(C)C)Cc3cccc(F)c3)cc2O1 ZINC000443377163 867940371 /nfs/dbraw/zinc/94/03/71/867940371.db2.gz ZUFZFFZPVKOFTH-QFIPXVFZSA-N 0 3 401.482 4.319 20 0 HIADHN C[C@H](CCN1CCN(C)CC1)NC(=O)Nc1ccc(Cl)cc1-c1ccccc1 ZINC000443522337 868081287 /nfs/dbraw/zinc/08/12/87/868081287.db2.gz PJOQXLYLEHSHKZ-QGZVFWFLSA-N 0 3 400.954 4.155 20 0 HIADHN CC[C@@]1(C)Oc2ccc(NC(=O)c3ccc(CN4CCC(CO)CC4)cc3)cc2O1 ZINC000443564842 868119292 /nfs/dbraw/zinc/11/92/92/868119292.db2.gz CRJCBAMFJMAWJJ-DEOSSOPVSA-N 0 3 410.514 4.041 20 0 HIADHN Cc1cc(CN2CCC[C@@H](c3nnc4n3CCC4)C2)nc(-c2ccc(Cl)cc2)n1 ZINC000443609365 868172816 /nfs/dbraw/zinc/17/28/16/868172816.db2.gz LVUHKIWGQWVIGM-QGZVFWFLSA-N 0 3 408.937 4.023 20 0 HIADHN COc1cccc(OCCN2CCC([C@@H]3C(=O)Nc4cc(Cl)ccc43)CC2)c1 ZINC000443621850 868193186 /nfs/dbraw/zinc/19/31/86/868193186.db2.gz AONRJXAYJDJDHB-NRFANRHFSA-N 0 3 400.906 4.175 20 0 HIADHN O[C@@H](Cc1ccccc1C(F)(F)F)CN1CCC[C@H]1c1cccc2c1OCCO2 ZINC000443624475 868195749 /nfs/dbraw/zinc/19/57/49/868195749.db2.gz FBZRSORYJUMJRV-LPHOPBHVSA-N 0 3 407.432 4.217 20 0 HIADHN CC(=O)c1ccc(NC(=O)CCN2CCC[C@@H](c3nc4ccc(F)cc4o3)C2)cc1 ZINC000443645585 868235055 /nfs/dbraw/zinc/23/50/55/868235055.db2.gz BHDYNIWUOIONTP-QGZVFWFLSA-N 0 3 409.461 4.378 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)c2occc2CSc2ccccc2)C[C@H](C)O1 ZINC000443659148 868264441 /nfs/dbraw/zinc/26/44/41/868264441.db2.gz WWDQALFJYYOACB-HDICACEKSA-N 0 3 402.560 4.191 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)c2ccc(Oc3ccncc3)c(Cl)c2)C[C@H](C)O1 ZINC000443665076 868270686 /nfs/dbraw/zinc/27/06/86/868270686.db2.gz GTZORLBPCITGFO-CALCHBBNSA-N 0 3 417.937 4.147 20 0 HIADHN C[C@H]1CN(CCCCNC(=O)CCOc2ccccc2-c2ccccc2)C[C@H](C)O1 ZINC000443670774 868276362 /nfs/dbraw/zinc/27/63/62/868276362.db2.gz ALPQFHIUOPJXND-SFTDATJTSA-N 0 3 410.558 4.128 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)CCCOc2cccc(Cl)c2Cl)C[C@@H](C)O1 ZINC000443672602 868277919 /nfs/dbraw/zinc/27/79/19/868277919.db2.gz FXYCRUUEYDEZOR-HZPDHXFCSA-N 0 3 417.377 4.158 20 0 HIADHN Cc1cccc(COc2cccc(CC(=O)NCCCCN3C[C@@H](C)O[C@H](C)C3)c2)c1 ZINC000443672815 868279199 /nfs/dbraw/zinc/27/91/99/868279199.db2.gz GXTJGWNPPQBGQJ-FGZHOGPDSA-N 0 3 424.585 4.122 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)c1ccc(CCC(F)(F)F)cc1 ZINC000443803291 868340183 /nfs/dbraw/zinc/34/01/83/868340183.db2.gz QEWUAHBXUOSQIA-UHFFFAOYSA-N 0 3 406.448 4.391 20 0 HIADHN CCCn1ccc2cc(NC(=O)C(=O)N[C@H](C)[C@H](c3ccccc3C)N(C)C)ccc21 ZINC000443836196 868366666 /nfs/dbraw/zinc/36/66/66/868366666.db2.gz CCELSKSHAXDVNX-WZONZLPQSA-N 0 3 420.557 4.106 20 0 HIADHN Cc1ccccc1[C@@H]([C@@H](C)NC(=O)C(=O)Nc1cccc(C(F)F)c1Cl)N(C)C ZINC000443836580 868367483 /nfs/dbraw/zinc/36/74/83/868367483.db2.gz GUNQSTMNMMZBMH-FZKQIMNGSA-N 0 3 423.891 4.332 20 0 HIADHN Cc1ccccc1[C@H]([C@H](C)NC(=O)C(=O)Nc1cccc(C(F)F)c1Cl)N(C)C ZINC000443836584 868367867 /nfs/dbraw/zinc/36/78/67/868367867.db2.gz GUNQSTMNMMZBMH-UGSOOPFHSA-N 0 3 423.891 4.332 20 0 HIADHN Cc1ccccc1[C@H]([C@@H](C)NC(=O)C(=O)Nc1ccc(Cl)c(Cl)c1)N(C)C ZINC000443841266 868373183 /nfs/dbraw/zinc/37/31/83/868373183.db2.gz JRRAYOOEZMPFMN-ACJLOTCBSA-N 0 3 408.329 4.048 20 0 HIADHN COc1ccc(-c2ncc(C(=O)N3C[C@@H]4CCCN4Cc4ccccc43)s2)cc1 ZINC000443857567 868389462 /nfs/dbraw/zinc/38/94/62/868389462.db2.gz TWWKBSRTEUCVFY-SFHVURJKSA-N 0 3 405.523 4.444 20 0 HIADHN CCOc1c(F)cccc1C(=O)N(CCN(C)C)Cc1ccc(Br)cc1 ZINC000443877413 868410297 /nfs/dbraw/zinc/41/02/97/868410297.db2.gz BMDXGDRKDMRUDV-UHFFFAOYSA-N 0 3 423.326 4.191 20 0 HIADHN CS(=O)(=O)Nc1cccc(CNCc2ccc(Oc3cccc(F)c3)cc2)c1 ZINC000443965943 868497938 /nfs/dbraw/zinc/49/79/38/868497938.db2.gz MYSNFFHFKBWDOL-UHFFFAOYSA-N 0 3 400.475 4.279 20 0 HIADHN CNS(=O)(=O)c1ccc([C@@H](C)NCc2ccc(Oc3cccc(F)c3)cc2)cc1 ZINC000443968097 868499175 /nfs/dbraw/zinc/49/91/75/868499175.db2.gz NHEBXFQUCOTCQE-MRXNPFEDSA-N 0 3 414.502 4.377 20 0 HIADHN COc1ccc(CNC[C@H](c2cccc(F)c2)N(C)C)c(OCc2cccnc2)c1 ZINC000443982635 868507640 /nfs/dbraw/zinc/50/76/40/868507640.db2.gz GVJCFGMZUPBCGB-HSZRJFAPSA-N 0 3 409.505 4.201 20 0 HIADHN FC(F)(F)c1ncc(CNCCCN2CCN(c3ccccc3Cl)CC2)s1 ZINC000443988887 868512131 /nfs/dbraw/zinc/51/21/31/868512131.db2.gz PMJPHSMDKYHVLW-UHFFFAOYSA-N 0 3 418.916 4.117 20 0 HIADHN Cc1cc(C(=O)CN(C)C2CCN(CCc3ccccn3)CC2)c(C)n1CCC(C)C ZINC000444280444 868712026 /nfs/dbraw/zinc/71/20/26/868712026.db2.gz JIHJITWGQNRGDB-UHFFFAOYSA-N 0 3 424.633 4.368 20 0 HIADHN CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)C1(c2ccc(C(F)(F)F)cc2)CC1 ZINC000444343233 868772603 /nfs/dbraw/zinc/77/26/03/868772603.db2.gz PZAOFAYGBWCCOO-PXNSSMCTSA-N 0 3 417.475 4.283 20 0 HIADHN CCCOc1ccc(Cl)cc1C(=O)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000444456698 868834766 /nfs/dbraw/zinc/83/47/66/868834766.db2.gz XDXHFEAWFWBSFZ-UHFFFAOYSA-N 0 3 402.922 4.338 20 0 HIADHN C[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000444456165 868835175 /nfs/dbraw/zinc/83/51/75/868835175.db2.gz VRYSWQOIEUSVGQ-INIZCTEOSA-N 0 3 420.475 4.479 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)[C@@H]1C[C@@H]1c1c(F)cccc1Cl ZINC000444462758 868838039 /nfs/dbraw/zinc/83/80/39/868838039.db2.gz VVAXCTUBWRAFTM-ZWKOTPCHSA-N 0 3 402.897 4.178 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)NC(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)cc1 ZINC000444577048 868888310 /nfs/dbraw/zinc/88/83/10/868888310.db2.gz WRHBGYOEJUVSES-YYDVJCTNSA-N 0 3 417.557 4.376 20 0 HIADHN CCN1CCN(c2ccc(C(=O)NCCCCOc3ccc(Cl)cc3)cc2)CC1 ZINC000468312699 882238903 /nfs/dbraw/zinc/23/89/03/882238903.db2.gz WCJLOGRTVLJUSB-UHFFFAOYSA-N 0 3 415.965 4.071 20 0 HIADHN CC1(C)CCCN(CCNC(=O)CSc2nnc(-c3ccc4ccccc4c3)o2)C1 ZINC000444613863 868906431 /nfs/dbraw/zinc/90/64/31/868906431.db2.gz YEOXZAALGDURBP-UHFFFAOYSA-N 0 3 424.570 4.220 20 0 HIADHN C[C@H](c1ccco1)N(C(=O)NCCCCN1CCN(Cc2ccccc2)CC1)C1CC1 ZINC000444717281 868973368 /nfs/dbraw/zinc/97/33/68/868973368.db2.gz RVXCJQYTYCMYGO-OAQYLSRUSA-N 0 3 424.589 4.113 20 0 HIADHN Cc1cccc2nc(C3CCN(CCCN4C(=O)c5ccccc5C4=O)CC3)oc21 ZINC000444754024 868987106 /nfs/dbraw/zinc/98/71/06/868987106.db2.gz BBZJRKDMENHTKY-UHFFFAOYSA-N 0 3 403.482 4.002 20 0 HIADHN Cc1ccccc1[C@@H](CC(F)(F)F)NCCOc1ccc(S(C)(=O)=O)cc1 ZINC000444788346 869005910 /nfs/dbraw/zinc/00/59/10/869005910.db2.gz UOENQJUVLDVBDQ-GOSISDBHSA-N 0 3 401.450 4.061 20 0 HIADHN CCN1CCN(Cc2ccc(CNC(=O)Nc3cccc(C(C)(F)F)c3)cc2)CC1 ZINC000444931324 869114727 /nfs/dbraw/zinc/11/47/27/869114727.db2.gz HEAGQSXRAFPFMO-UHFFFAOYSA-N 0 3 416.516 4.258 20 0 HIADHN CC1CCN([C@@H](CNC(=O)N(C)Cc2cc(C(C)(C)C)n[nH]2)c2ccccc2)CC1 ZINC000445077773 869204220 /nfs/dbraw/zinc/20/42/20/869204220.db2.gz HORAOEHWTUVWRS-NRFANRHFSA-N 0 3 411.594 4.322 20 0 HIADHN CCc1ccc(NC(=O)Cc2noc([C@@H]3CCCN(Cc4cccc(F)c4)C3)n2)cc1 ZINC000445326177 869385349 /nfs/dbraw/zinc/38/53/49/869385349.db2.gz YQRZNZMCLMIOKU-LJQANCHMSA-N 0 3 422.504 4.332 20 0 HIADHN CC(C)N1CCN(c2ccc(-c3nc(Cc4nccc5ccccc54)no3)cc2)CC1 ZINC000445510299 869574505 /nfs/dbraw/zinc/57/45/05/869574505.db2.gz FHQQJZDHYPEINQ-UHFFFAOYSA-N 0 3 413.525 4.406 20 0 HIADHN COc1ccc([C@@H](CNC(=O)c2c[nH]nc2-c2ccccc2Cl)N2CCCC2)cc1 ZINC000445644853 869715434 /nfs/dbraw/zinc/71/54/34/869715434.db2.gz KKCVTZFRRAIAQJ-OAQYLSRUSA-N 0 3 424.932 4.306 20 0 HIADHN CCN(C(=O)Cc1noc([C@@H]2CCCN(Cc3cccc(F)c3)C2)n1)c1ccccc1 ZINC000445673115 869742653 /nfs/dbraw/zinc/74/26/53/869742653.db2.gz DAZICYLHHMELKS-LJQANCHMSA-N 0 3 422.504 4.184 20 0 HIADHN CCO[C@@H](c1noc(-c2ccc(N3CCN(C(C)C)CC3)cc2)n1)c1ccccc1 ZINC000445776819 869817919 /nfs/dbraw/zinc/81/79/19/869817919.db2.gz NICINBRRQYETPY-JOCHJYFZSA-N 0 3 406.530 4.393 20 0 HIADHN Cc1ccc(S(=O)(=O)N[C@H](CN[C@@H](c2cccnc2)C2CC2)c2ccccc2)cc1 ZINC000445806413 869832779 /nfs/dbraw/zinc/83/27/79/869832779.db2.gz VOUMIUHHKLZQET-DNQXCXABSA-N 0 3 421.566 4.151 20 0 HIADHN COc1cccc(Cn2ccc3ccc(N4C(=O)NC(CC(F)(F)F)C4=O)cc32)c1 ZINC000445925278 869891739 /nfs/dbraw/zinc/89/17/39/869891739.db2.gz RSJLMVOTOSIRSD-KRWDZBQOSA-N 0 3 417.387 4.075 20 0 HIADHN Cc1sc(C(=O)NC2CCN(CCOC(C)C)CC2)cc1-c1ccc(F)cc1 ZINC000445927481 869892930 /nfs/dbraw/zinc/89/29/30/869892930.db2.gz KSKNCFMRWRDECA-UHFFFAOYSA-N 0 3 404.551 4.482 20 0 HIADHN CCOCCOc1cc(C)ccc1CNC(=O)c1oc2ccccc2c1CN(C)C ZINC000445948338 869912764 /nfs/dbraw/zinc/91/27/64/869912764.db2.gz YSFYLSSVLUPLFV-UHFFFAOYSA-N 0 3 410.514 4.148 20 0 HIADHN CN(C)C(=O)Cc1nc(CN[C@@H]2CCC[C@H]2c2ccccc2C(F)(F)F)cs1 ZINC000446002191 869965436 /nfs/dbraw/zinc/96/54/36/869965436.db2.gz NPXWWKCYALNTKK-DOTOQJQBSA-N 0 3 411.493 4.219 20 0 HIADHN CCN(CC)CCN(C(=O)c1ccc(C(C)=O)o1)c1cccc(Br)c1 ZINC000446079732 870029101 /nfs/dbraw/zinc/02/91/01/870029101.db2.gz QDUVUIHKWVWKCY-UHFFFAOYSA-N 0 3 407.308 4.233 20 0 HIADHN CCN(C[C@H]1CCN(Cc2ccccc2)C1)C(=O)CCC(=O)c1ccc(F)c(F)c1 ZINC000446235227 870173716 /nfs/dbraw/zinc/17/37/16/870173716.db2.gz RJWZUTIRPMLJBY-IBGZPJMESA-N 0 3 414.496 4.298 20 0 HIADHN C[C@H]1C[C@H](N(C)C(=O)CCC(=O)c2ccc(F)c(F)c2)CCN1Cc1ccccc1 ZINC000446271143 870207935 /nfs/dbraw/zinc/20/79/35/870207935.db2.gz WPMYWMVRUJHKLS-FXAWDEMLSA-N 0 3 414.496 4.439 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N(Cc1ccccc1)Cc1ccccc1 ZINC000446294792 870222380 /nfs/dbraw/zinc/22/23/80/870222380.db2.gz DYPCETOSKGRTDG-UHFFFAOYSA-N 0 3 415.537 4.224 20 0 HIADHN Cc1c2cc(C)ccc2sc1C(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000446311059 870235867 /nfs/dbraw/zinc/23/58/67/870235867.db2.gz HQJAIMAZDXWPEN-UHFFFAOYSA-N 0 3 408.567 4.405 20 0 HIADHN C[C@@H](CSc1ccc(F)cc1)C(=O)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000446416012 870325094 /nfs/dbraw/zinc/32/50/94/870325094.db2.gz LSPCTCYVTYLBLA-INIZCTEOSA-N 0 3 402.535 4.149 20 0 HIADHN COc1cc(C(=O)N(CCN(C)C)Cc2ccco2)cc(Cl)c1OCC(C)C ZINC000446424896 870338160 /nfs/dbraw/zinc/33/81/60/870338160.db2.gz NRWSEANACVBHEZ-UHFFFAOYSA-N 0 3 408.926 4.180 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)CCc1ncc(-c2ccc(Cl)cc2)o1 ZINC000446424389 870338495 /nfs/dbraw/zinc/33/84/95/870338495.db2.gz CPABYDORMBUVLD-UHFFFAOYSA-N 0 3 401.894 4.111 20 0 HIADHN C[C@H]1CN(c2cccc3cnccc32)CCN1C(=O)c1cccc(CN2CCCC2)c1 ZINC000446603840 870509240 /nfs/dbraw/zinc/50/92/40/870509240.db2.gz GJWYTHAJCKIIBE-FQEVSTJZSA-N 0 3 414.553 4.182 20 0 HIADHN Cc1ccc(C(=O)NC[C@@H]2N(C)CCCC2(C)C)cc1NC(=O)c1ccccc1F ZINC000468472623 882427716 /nfs/dbraw/zinc/42/77/16/882427716.db2.gz LRSOQIFUPFRNCW-NRFANRHFSA-N 0 3 411.521 4.237 20 0 HIADHN COc1ccc2c(c1)[C@@H](N[C@@H](C)c1ccc(S(=O)(=O)N(C)C)cc1)CCCS2 ZINC000446749905 870658322 /nfs/dbraw/zinc/65/83/22/870658322.db2.gz CTSMQNKYANKVFV-YWZLYKJASA-N 0 3 420.600 4.223 20 0 HIADHN Cc1ccc([C@@H](CCn2cncn2)NCc2cc(F)cc(Br)c2)cc1 ZINC000446752857 870660667 /nfs/dbraw/zinc/66/06/67/870660667.db2.gz JECRDUFJTGWELT-LJQANCHMSA-N 0 3 403.299 4.409 20 0 HIADHN COc1ccc(-c2csc(CNC(=O)N(CCN(C)C)Cc3ccco3)c2)cc1 ZINC000446780259 870697432 /nfs/dbraw/zinc/69/74/32/870697432.db2.gz IGRBFKHUGVDSBP-UHFFFAOYSA-N 0 3 413.543 4.290 20 0 HIADHN Cn1cnc2cc(CNC3(c4cccc(OC(F)(F)F)c4)CCOCC3)ccc21 ZINC000446834143 870751242 /nfs/dbraw/zinc/75/12/42/870751242.db2.gz WFOBIWHUFLLZLX-UHFFFAOYSA-N 0 3 405.420 4.267 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1ccc(OC(F)F)cc1OC(F)F ZINC000446842598 870761613 /nfs/dbraw/zinc/76/16/13/870761613.db2.gz XKXJIJREWBLDQF-UHFFFAOYSA-N 0 3 419.375 4.078 20 0 HIADHN Cc1ccc([C@@H](CCn2cncn2)Nc2cccc(CN3CCSCC3)c2)cc1 ZINC000446938409 870848261 /nfs/dbraw/zinc/84/82/61/870848261.db2.gz IINVLLSTRQMPBE-HSZRJFAPSA-N 0 3 407.587 4.379 20 0 HIADHN O[C@@H]([C@@H]1CCCN(Cc2ccc(-n3ccc(C(F)(F)F)n3)cc2)C1)C(F)(F)F ZINC000446976218 870874029 /nfs/dbraw/zinc/87/40/29/870874029.db2.gz VUKIZPVBDPMFHS-CJNGLKHVSA-N 0 3 407.358 4.026 20 0 HIADHN Cc1nc(-c2ccc(C)c(NC(=O)NC[C@H](c3ccccc3)N3CCCC3)c2)n[nH]1 ZINC000447051269 870929373 /nfs/dbraw/zinc/92/93/73/870929373.db2.gz SEQCUKYNYWKGPP-OAQYLSRUSA-N 0 3 404.518 4.047 20 0 HIADHN Cc1nc(-c2ccc(C)c(NC(=O)N3CC[C@@H](C)N(Cc4ccccc4)CC3)c2)n[nH]1 ZINC000447054122 870932980 /nfs/dbraw/zinc/93/29/80/870932980.db2.gz KMMBSRABVGJEOH-GOSISDBHSA-N 0 3 418.545 4.217 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1cc(F)c(OC)cc1OC)c1cccc(OC)c1 ZINC000447062167 870941541 /nfs/dbraw/zinc/94/15/41/870941541.db2.gz XOPRNXBFYDYYFT-LJQANCHMSA-N 0 3 419.497 4.056 20 0 HIADHN COCCO[C@@H]1C[C@@H](CO)CN(Cc2ccc(-c3cccc(Cl)c3Cl)o2)C1 ZINC000447078512 870965890 /nfs/dbraw/zinc/96/58/90/870965890.db2.gz PSLASCPVKLQFND-GDBMZVCRSA-N 0 3 414.329 4.099 20 0 HIADHN COC(=O)[C@](C)(CNCc1ccccc1OCc1cccnc1)c1ccc(F)cc1 ZINC000447083977 870976012 /nfs/dbraw/zinc/97/60/12/870976012.db2.gz CJRZCQSRXOFOFT-XMMPIXPASA-N 0 3 408.473 4.020 20 0 HIADHN C[C@H](NC(=O)N(CCN(C)C)Cc1cccc(F)c1)c1cccc(N2CCCC2)c1 ZINC000447232409 871118377 /nfs/dbraw/zinc/11/83/77/871118377.db2.gz RXTYBBWVCSHSIU-IBGZPJMESA-N 0 3 412.553 4.260 20 0 HIADHN C[C@@H](NC(=O)N(CCN(C)C)Cc1cccc(F)c1)c1cccc(N2CCCC2)c1 ZINC000447232410 871118451 /nfs/dbraw/zinc/11/84/51/871118451.db2.gz RXTYBBWVCSHSIU-LJQANCHMSA-N 0 3 412.553 4.260 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)Nc1ccc(C(=O)Nc2cccnc2)cc1 ZINC000468495930 882484517 /nfs/dbraw/zinc/48/45/17/882484517.db2.gz PKGGTHCTBAFLLB-UHFFFAOYSA-N 0 3 414.465 4.394 20 0 HIADHN COc1ccc(COC[C@H](O)CN[C@@H](C)c2ccc(Cl)cc2Cl)cc1OC ZINC000447327731 871219943 /nfs/dbraw/zinc/21/99/43/871219943.db2.gz WGUWXIREWHMCNK-XJKSGUPXSA-N 0 3 414.329 4.239 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)N[C@@H](COc1ccccc1)c1ccccc1 ZINC000447389624 871298349 /nfs/dbraw/zinc/29/83/49/871298349.db2.gz ZSNJZATWQYUCKG-QHCPKHFHSA-N 0 3 407.514 4.173 20 0 HIADHN COc1ccccc1Oc1ccc(CNC(=O)N(CCN(C)C)Cc2ccco2)cc1 ZINC000447413616 871320747 /nfs/dbraw/zinc/32/07/47/871320747.db2.gz NMEIQWGYHRUSOJ-UHFFFAOYSA-N 0 3 423.513 4.354 20 0 HIADHN FC(F)C(F)(F)COCCN[C@H]1CCCOc2c(Br)cccc21 ZINC000447595246 871501147 /nfs/dbraw/zinc/50/11/47/871501147.db2.gz MDSOEDFLASMMMF-LBPRGKRZSA-N 0 3 400.210 4.169 20 0 HIADHN O=S1(=O)CCCN1c1cccc(CN[C@H](Cc2ccc(F)cc2)c2ccccc2)c1 ZINC000447600249 871505936 /nfs/dbraw/zinc/50/59/36/871505936.db2.gz LKXCEOQFYKKDJA-XMMPIXPASA-N 0 3 424.541 4.439 20 0 HIADHN Fc1ccc(C[C@H](NCc2cnc(N3CCOCC3)c(F)c2)c2ccccc2)cc1 ZINC000447602313 871510016 /nfs/dbraw/zinc/51/00/16/871510016.db2.gz SBXNIVKWOWAFIH-QHCPKHFHSA-N 0 3 409.480 4.270 20 0 HIADHN CCN1CCC[C@@H](CN(C)C(=O)Cc2cccc(Cl)c2Cl)[C@@H]1c1cnn(C)c1 ZINC000447605451 871512785 /nfs/dbraw/zinc/51/27/85/871512785.db2.gz IVNTXQAFOCOHBT-HRAATJIYSA-N 0 3 423.388 4.201 20 0 HIADHN C[C@@H](NC[C@H](CO)Cc1cc(F)c(F)c(F)c1)c1nc2ccc(Cl)cc2n1C ZINC000447604366 871513205 /nfs/dbraw/zinc/51/32/05/871513205.db2.gz AFNMWXOBVPQDBM-DGCLKSJQSA-N 0 3 411.855 4.146 20 0 HIADHN CC(C)[C@@H]1CN(C(=O)NCc2ccccc2CN2CCC(O)CC2)c2ccccc21 ZINC000447767708 871700904 /nfs/dbraw/zinc/70/09/04/871700904.db2.gz JSYBVPLNBNCXNF-QHCPKHFHSA-N 0 3 407.558 4.113 20 0 HIADHN C[C@H](N[C@H](C[C@H]1CCOC1)c1ccccc1)C(=O)Nc1ccc(OC(F)F)cc1 ZINC000447885921 871800788 /nfs/dbraw/zinc/80/07/88/871800788.db2.gz LQRLWXZXGZLILI-RZQQEMMASA-N 0 3 404.457 4.373 20 0 HIADHN CC(=O)N(c1nc(CNC[C@@H]2N(C)CCCC2(C)C)cs1)c1ccc(F)cc1 ZINC000447895196 871807083 /nfs/dbraw/zinc/80/70/83/871807083.db2.gz ANZWUQMCLXPBMM-IBGZPJMESA-N 0 3 404.555 4.177 20 0 HIADHN Cc1nn(C)c(CNCC2(c3cccc(C(F)(F)F)c3)CC2)c1Br ZINC000447940909 871818578 /nfs/dbraw/zinc/81/85/78/871818578.db2.gz JFBJCVYIOORZIJ-UHFFFAOYSA-N 0 3 402.258 4.331 20 0 HIADHN Cc1ccc(Br)cc1NC(=O)CCNCc1ccnn1-c1ccccc1 ZINC000447939113 871818933 /nfs/dbraw/zinc/81/89/33/871818933.db2.gz ITXWZBCHBPYQGJ-UHFFFAOYSA-N 0 3 413.319 4.062 20 0 HIADHN CC(C)N(C)C(=O)c1ccc(Cl)c(NC(=O)NC[C@@H]2N(C)CCCC2(C)C)c1 ZINC000447972349 871829106 /nfs/dbraw/zinc/82/91/06/871829106.db2.gz QDJDKDOWWVEDEH-SFHVURJKSA-N 0 3 408.974 4.062 20 0 HIADHN O=C(CN1CCC[C@@H]2CCC[C@@H]21)N(Cc1nnc(-c2ccccc2Cl)o1)C1CC1 ZINC000448023835 871865259 /nfs/dbraw/zinc/86/52/59/871865259.db2.gz VFZWIPIVHGGBKB-KXBFYZLASA-N 0 3 414.937 4.146 20 0 HIADHN CN1CCCC(C)(C)[C@@H]1CNC(=O)N1CCC[C@H](c2nc(C(F)(F)F)cs2)C1 ZINC000448028225 871867282 /nfs/dbraw/zinc/86/72/82/871867282.db2.gz CNKJUVKWCFITJA-ZFWWWQNUSA-N 0 3 418.529 4.171 20 0 HIADHN O=S(=O)(c1c(Cl)ccc2ccccc21)N1CC[C@H]2[C@@H](CCCN2C2CC2)C1 ZINC000448163627 872040673 /nfs/dbraw/zinc/04/06/73/872040673.db2.gz IETWPOPMOOSIPA-JXFKEZNVSA-N 0 3 404.963 4.131 20 0 HIADHN CCOc1cc(CN2CCSC(CC)(CC)C2)ccc1O[C@@H](C)C(=O)N(C)C ZINC000468541134 882577088 /nfs/dbraw/zinc/57/70/88/882577088.db2.gz JWWUVSSYATZTSI-KRWDZBQOSA-N 0 3 408.608 4.048 20 0 HIADHN Fc1ccc(-c2noc([C@H]3CCCN(Cc4ccnn4-c4ccccc4)C3)n2)cc1 ZINC000448345783 872292419 /nfs/dbraw/zinc/29/24/19/872292419.db2.gz VBVSTCICAISNJN-SFHVURJKSA-N 0 3 403.461 4.441 20 0 HIADHN CCOc1cc(CN(CCOC)[C@@H]2CCCSC2)cc(Br)c1OC ZINC000448364336 872314910 /nfs/dbraw/zinc/31/49/10/872314910.db2.gz FUFPAHWPFILADQ-OAHLLOKOSA-N 0 3 418.397 4.200 20 0 HIADHN CCOc1cc(CN(CCOC)[C@H]2CCCSC2)cc(Br)c1OC ZINC000448364335 872315476 /nfs/dbraw/zinc/31/54/76/872315476.db2.gz FUFPAHWPFILADQ-HNNXBMFYSA-N 0 3 418.397 4.200 20 0 HIADHN Cc1nn(C(C)(C)C)cc1[C@H](C)NC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000468566549 882626030 /nfs/dbraw/zinc/62/60/30/882626030.db2.gz OZWWRYQWEYXKTQ-QFBILLFUSA-N 0 3 400.542 4.175 20 0 HIADHN Cc1nn(C(C)(C)C)cc1[C@@H](C)NC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000468566550 882626153 /nfs/dbraw/zinc/62/61/53/882626153.db2.gz OZWWRYQWEYXKTQ-VQIMIIECSA-N 0 3 400.542 4.175 20 0 HIADHN CCN(C(=O)Nc1cnn(-c2ccccc2F)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000460123484 872599484 /nfs/dbraw/zinc/59/94/84/872599484.db2.gz DRPWDXMNTFYJDS-FQEVSTJZSA-N 0 3 407.493 4.140 20 0 HIADHN O=C(CCN1CCN(c2ccccc2)CC1)N1CCC(=Cc2cccc(F)c2)CC1 ZINC000468571963 882635419 /nfs/dbraw/zinc/63/54/19/882635419.db2.gz PGEHVPBWHYERHY-UHFFFAOYSA-N 0 3 407.533 4.044 20 0 HIADHN C[C@H]1CCC[C@H]1NC(=O)N(Cc1ccccc1Br)C1CCN(C)CC1 ZINC000460270672 872859476 /nfs/dbraw/zinc/85/94/76/872859476.db2.gz OJDSQARRXRNQRA-HNAYVOBHSA-N 0 3 408.384 4.244 20 0 HIADHN Cc1ccccc1[C@H]1CN(C(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)[C@@H](C)CO1 ZINC000460380080 873020662 /nfs/dbraw/zinc/02/06/62/873020662.db2.gz LAVGWTJXENSMRI-SQJMNOBHSA-N 0 3 421.585 4.128 20 0 HIADHN COc1cc(CNCc2ccc(C)nc2-n2cc(Cl)cn2)ccc1OC(F)F ZINC000468591971 882678335 /nfs/dbraw/zinc/67/83/35/882678335.db2.gz SEISWNCJVMTABH-UHFFFAOYSA-N 0 3 408.836 4.129 20 0 HIADHN CN(C)[C@@H](CNC(=O)CN1CCCC[C@@H]1c1cc2ccccc2[nH]1)c1ccccc1 ZINC000460388254 873033333 /nfs/dbraw/zinc/03/33/33/873033333.db2.gz PSZOLBJROMUGGE-RPWUZVMVSA-N 0 3 404.558 4.114 20 0 HIADHN CCCOc1cc(CNCc2ccc(C)nc2-n2cc(Cl)cn2)ccc1OC ZINC000468592765 882679868 /nfs/dbraw/zinc/67/98/68/882679868.db2.gz VYDWFGRGOJOXPU-UHFFFAOYSA-N 0 3 400.910 4.316 20 0 HIADHN CCCN(CCN1CCN(CC)CC1)C(=O)N[C@H](C)c1ccc(Cl)cc1Cl ZINC000460682148 873431478 /nfs/dbraw/zinc/43/14/78/873431478.db2.gz VDKDILHMSQPMFE-MRXNPFEDSA-N 0 3 415.409 4.114 20 0 HIADHN CCOCCCn1c([C@H](CC)c2ccccc2)nnc1N1C[C@H](C)N(CC)C[C@@H]1C ZINC000460765523 873608193 /nfs/dbraw/zinc/60/81/93/873608193.db2.gz ALOHMGVCNDLUCR-JAXLGGSGSA-N 0 3 413.610 4.166 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)c1ccc(OCc2ccccn2)cc1 ZINC000460805723 873680644 /nfs/dbraw/zinc/68/06/44/873680644.db2.gz NHJOEHIGBPADSX-DEOSSOPVSA-N 0 3 401.510 4.228 20 0 HIADHN Cc1noc(-c2ccccc2C(=O)NC[C@H](c2ccccc2)N2CCC(C)CC2)n1 ZINC000460965043 873861686 /nfs/dbraw/zinc/86/16/86/873861686.db2.gz BMMXYIOVPMEPBQ-JOCHJYFZSA-N 0 3 404.514 4.248 20 0 HIADHN C[C@@H](C(=O)NC1CCN(CCOc2ccc(Cl)cc2)CC1)c1cccc(F)c1 ZINC000461052890 873926813 /nfs/dbraw/zinc/92/68/13/873926813.db2.gz GXTSCKIGOZXKJE-MRXNPFEDSA-N 0 3 404.913 4.242 20 0 HIADHN Cc1cc(Cl)cc2c1OCCC[C@@H]2NCc1ccc(N2CCCS2(=O)=O)cc1 ZINC000461081825 873988894 /nfs/dbraw/zinc/98/88/94/873988894.db2.gz BRMQJLIKBUDPGA-FQEVSTJZSA-N 0 3 420.962 4.192 20 0 HIADHN CC(C)c1cccc2c1OCCC[C@H]2NCc1ccc(N2CCCS2(=O)=O)cc1 ZINC000461092109 874006698 /nfs/dbraw/zinc/00/66/98/874006698.db2.gz XDMADLSRQUWWGR-JOCHJYFZSA-N 0 3 414.571 4.353 20 0 HIADHN O=S1(=O)CCCN1c1ccc(CN[C@H]2CCSc3c(Cl)cccc32)cc1 ZINC000461093260 874009284 /nfs/dbraw/zinc/00/92/84/874009284.db2.gz RQCNDBVVJYGVTL-SFHVURJKSA-N 0 3 408.976 4.207 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@@H](O)C2)c1)Nc1ccc(Br)cc1Cl ZINC000461108409 874029089 /nfs/dbraw/zinc/02/90/89/874029089.db2.gz AASMORYGJVIIII-OAHLLOKOSA-N 0 3 424.726 4.313 20 0 HIADHN CCOC(=O)COc1ccc(CNCc2cc3cc(Br)ccc3[nH]2)cc1 ZINC000468686742 882811549 /nfs/dbraw/zinc/81/15/49/882811549.db2.gz WZJPPBXIRMMUGZ-UHFFFAOYSA-N 0 3 417.303 4.162 20 0 HIADHN O=C(Nc1ccc2nc([C@@H]3CCCO3)[nH]c2c1)[C@H]1CCCCN1Cc1ccccc1 ZINC000468706953 882823077 /nfs/dbraw/zinc/82/30/77/882823077.db2.gz NTAXPZCKYUEZSA-YADHBBJMSA-N 0 3 404.514 4.408 20 0 HIADHN O=C(Nc1ccc2nc([C@H]3CCCO3)[nH]c2c1)[C@H]1CCCCN1Cc1ccccc1 ZINC000468706951 882823481 /nfs/dbraw/zinc/82/34/81/882823481.db2.gz NTAXPZCKYUEZSA-FGZHOGPDSA-N 0 3 404.514 4.408 20 0 HIADHN C[C@@H](CC(=O)N1CCC(N2CCc3ccccc3C2)CC1)C(=O)c1cccc(F)c1 ZINC000468717456 882827453 /nfs/dbraw/zinc/82/74/53/882827453.db2.gz NOXIQDJBRTYRGM-SFHVURJKSA-N 0 3 408.517 4.084 20 0 HIADHN Cc1c(C(=O)N2C[C@@H]3CCN(Cc4ccccc4)C[C@@H]3C2)[nH]c2c1C(=O)CC(C)(C)C2 ZINC000461439719 874494341 /nfs/dbraw/zinc/49/43/41/874494341.db2.gz UIXCWQGDVDDTDV-VQTJNVASSA-N 0 3 419.569 4.072 20 0 HIADHN CCOC(=O)[C@](C)(CN[C@H](C)C(=O)Nc1ccccc1C(F)(F)F)c1ccccc1 ZINC000468773984 882853739 /nfs/dbraw/zinc/85/37/39/882853739.db2.gz ASJYCMLXWFZJIP-QVKFZJNVSA-N 0 3 422.447 4.143 20 0 HIADHN CCOC(=O)[C@@](C)(CN[C@H](C)C(=O)Nc1ccccc1C(F)(F)F)c1ccccc1 ZINC000468773999 882853897 /nfs/dbraw/zinc/85/38/97/882853897.db2.gz ASJYCMLXWFZJIP-VFNWGFHPSA-N 0 3 422.447 4.143 20 0 HIADHN CC1CCN([C@H](CNC(=O)Cc2cncn2Cc2ccccc2)c2cccs2)CC1 ZINC000468788781 882860416 /nfs/dbraw/zinc/86/04/16/882860416.db2.gz CAUXPYDPGXDSAL-JOCHJYFZSA-N 0 3 422.598 4.125 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)C(C)(C)Cc2ccc(C(F)(F)F)cc2)C[C@H](C)O1 ZINC000468805671 882868684 /nfs/dbraw/zinc/86/86/84/882868684.db2.gz CRWMVGYUPLTOKQ-CALCHBBNSA-N 0 3 414.512 4.280 20 0 HIADHN CCSc1cc(Cl)ccc1C(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000461760274 874895558 /nfs/dbraw/zinc/89/55/58/874895558.db2.gz VNUSLSYKLTUNAF-UHFFFAOYSA-N 0 3 418.990 4.339 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3sc(C(F)(F)F)nc3C)c(C)c2)CC1 ZINC000461799767 874914095 /nfs/dbraw/zinc/91/40/95/874914095.db2.gz YXYAWGCMZZUKGG-UHFFFAOYSA-N 0 3 412.481 4.173 20 0 HIADHN Cc1c([C@@H](C)NC[C@H](O)COc2cccc(Cl)c2Cl)cnn1C(C)(C)C ZINC000468847243 882887923 /nfs/dbraw/zinc/88/79/23/882887923.db2.gz GBTBZLSPNZWHCN-OCCSQVGLSA-N 0 3 400.350 4.344 20 0 HIADHN C[C@H](CNC(=O)N[C@H]1CCCc2cn(C3CCCC3)nc21)N(C)Cc1ccccc1 ZINC000461957788 875085609 /nfs/dbraw/zinc/08/56/09/875085609.db2.gz PSFGJEYXPGOVHH-GCJKJVERSA-N 0 3 409.578 4.195 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)N[C@@H]2CCCc3cn(C4CCCC4)nc32)CN1Cc1ccccc1 ZINC000461965261 875090562 /nfs/dbraw/zinc/09/05/62/875090562.db2.gz MYKSSXFBMJIPGO-JMUQELJHSA-N 0 3 421.589 4.338 20 0 HIADHN CC[C@H](NC(=O)CCN1CCN(c2ccccc2)CC1)c1ccccc1OC(F)F ZINC000462021298 875137419 /nfs/dbraw/zinc/13/74/19/875137419.db2.gz CVARSRHJHROFCY-FQEVSTJZSA-N 0 3 417.500 4.068 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)N[C@H]1CCc2sc(Cl)cc21 ZINC000462045602 875158741 /nfs/dbraw/zinc/15/87/41/875158741.db2.gz FKNDTMKNYAKEIW-INIZCTEOSA-N 0 3 413.921 4.440 20 0 HIADHN Cc1nc2ccc(Br)cc2c(N2CCC(NC(=O)C(C)C)CC2)c1C ZINC000462083514 875191418 /nfs/dbraw/zinc/19/14/18/875191418.db2.gz HWAICVGONVPAPI-UHFFFAOYSA-N 0 3 404.352 4.355 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)Nc3cccc(Oc4ccncc4)c3)CC2)c1 ZINC000462101875 875210260 /nfs/dbraw/zinc/21/02/60/875210260.db2.gz ZUYRANNNCPWIPZ-UHFFFAOYSA-N 0 3 416.525 4.333 20 0 HIADHN C[C@H](C(=O)Nc1ccc(OC2CCN(C)CC2)nc1)c1ccc(C(F)(F)F)cc1 ZINC000462124098 875225951 /nfs/dbraw/zinc/22/59/51/875225951.db2.gz YSYOBXOFMXBGRM-AWEZNQCLSA-N 0 3 407.436 4.316 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)N[C@@H]1CCCc2cn(C3CCCC3)nc21 ZINC000462150809 875247111 /nfs/dbraw/zinc/24/71/11/875247111.db2.gz NDFHLJFSDGTRKE-JOCHJYFZSA-N 0 3 409.578 4.149 20 0 HIADHN Cc1ncsc1CN(C)C[C@H]1CCN(C(=O)NCc2ccc3sccc3c2)C1 ZINC000462157330 875252665 /nfs/dbraw/zinc/25/26/65/875252665.db2.gz KSOMTKIJGDNTQS-QGZVFWFLSA-N 0 3 414.600 4.330 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)[C@@H]1C[C@@H]1c1ccccc1OC(F)F ZINC000462156381 875253045 /nfs/dbraw/zinc/25/30/45/875253045.db2.gz CPLCKQKQHUPHKT-XLNTUCKNSA-N 0 3 400.469 4.028 20 0 HIADHN CC(=O)c1ccc(-c2ccc(C(=O)N[C@H]3CN(Cc4ccccc4)C[C@H]3C)o2)cc1 ZINC000462160576 875256159 /nfs/dbraw/zinc/25/61/59/875256159.db2.gz VZUFHHWBXPQDSO-VGSWGCGISA-N 0 3 402.494 4.400 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)CCc1cc(Br)cs1 ZINC000462180934 875279846 /nfs/dbraw/zinc/27/98/46/875279846.db2.gz WFBOLJJGCNEDSW-RDTXWAMCSA-N 0 3 407.377 4.080 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1ccccc1-c1nc(C(C)(C)C)no1 ZINC000462182545 875282689 /nfs/dbraw/zinc/28/26/89/875282689.db2.gz PPXUJUQJOSTYRW-UWJYYQICSA-N 0 3 418.541 4.284 20 0 HIADHN CSc1nc(-c2ccco2)nc(C)c1C(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C ZINC000462185715 875287311 /nfs/dbraw/zinc/28/73/11/875287311.db2.gz YWYIHEBBBHIUFD-YJBOKZPZSA-N 0 3 422.554 4.017 20 0 HIADHN CC(C)CC(=O)Nc1ccc(C(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)cc1F ZINC000462188572 875292143 /nfs/dbraw/zinc/29/21/43/875292143.db2.gz NSDNFUJKKCXMCR-VGSWGCGISA-N 0 3 411.521 4.061 20 0 HIADHN Cc1nc(COc2ccccc2C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)cs1 ZINC000462195762 875303376 /nfs/dbraw/zinc/30/33/76/875303376.db2.gz MNEZCQBFIDVVOO-HTAPYJJXSA-N 0 3 421.566 4.281 20 0 HIADHN Cc1ccc(NC(=O)C(C)C)cc1NC(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C ZINC000462239440 875354377 /nfs/dbraw/zinc/35/43/77/875354377.db2.gz FYRRFVQUEAPSED-GCJKJVERSA-N 0 3 408.546 4.232 20 0 HIADHN C[C@H](C(=O)NC1CCN([C@@H](C)c2ccncc2)CC1)c1cccc(Br)c1 ZINC000462247278 875365421 /nfs/dbraw/zinc/36/54/21/875365421.db2.gz OMIJNKUVPROOHP-HOTGVXAUSA-N 0 3 416.363 4.289 20 0 HIADHN C[C@@H]1CC[C@@H](C)N1CC(=O)Nc1ccc(CC(=O)N2CCCc3ccccc32)cc1 ZINC000468884367 882924553 /nfs/dbraw/zinc/92/45/53/882924553.db2.gz FXVROIDRROHUHZ-RTBURBONSA-N 0 3 405.542 4.020 20 0 HIADHN COc1ccc(NC(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)c(Br)c1 ZINC000462263144 875389203 /nfs/dbraw/zinc/38/92/03/875389203.db2.gz WGWQUOZBCDEQAC-LIRRHRJNSA-N 0 3 418.335 4.100 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Nc1ccc(NC(=O)c2ccco2)cc1 ZINC000462267081 875394330 /nfs/dbraw/zinc/39/43/30/875394330.db2.gz HCGFHRQAWWUCFP-LAUBAEHRSA-N 0 3 418.497 4.174 20 0 HIADHN CCCN1c2ccc(NC(=O)N[C@H]3CN(Cc4ccccc4)C[C@@H]3C)cc2CCC1=O ZINC000462287324 875411650 /nfs/dbraw/zinc/41/16/50/875411650.db2.gz CVNDGHPVHGPQDZ-AVRDEDQJSA-N 0 3 420.557 4.018 20 0 HIADHN C[C@@H]1CN(C)CC[C@@H]1N(C)S(=O)(=O)c1ccc(Oc2ccccc2Cl)cc1 ZINC000462358382 875471978 /nfs/dbraw/zinc/47/19/78/875471978.db2.gz LKQDWBAKUBUVBR-BEFAXECRSA-N 0 3 408.951 4.093 20 0 HIADHN CCN(CC)[C@H](CNc1cc(C(F)(F)F)nc(-c2ccncc2)n1)c1ccco1 ZINC000462376428 875488209 /nfs/dbraw/zinc/48/82/09/875488209.db2.gz JKPMIQFEHWYILZ-OAHLLOKOSA-N 0 3 405.424 4.067 20 0 HIADHN Cc1c(NC(=O)[C@@H](C)N2CC[C@@H](C)C3(CCCCC3)C2)c(=O)n(-c2ccccc2)n1C ZINC000462467708 875576430 /nfs/dbraw/zinc/57/64/30/875576430.db2.gz VEYXFNCSBZQJKH-UYAOXDASSA-N 0 3 424.589 4.104 20 0 HIADHN O=C(CCc1cncc2ccccc21)Nc1ccc(CCN2CCSCC2)cc1 ZINC000462488925 875597345 /nfs/dbraw/zinc/59/73/45/875597345.db2.gz JHDQIYPQVOTOHS-UHFFFAOYSA-N 0 3 405.567 4.397 20 0 HIADHN Clc1cc(Br)ccc1CNC[C@H](c1ccccc1)N1CCOCC1 ZINC000462680663 875774880 /nfs/dbraw/zinc/77/48/80/875774880.db2.gz JEELBJQFBIQVCC-LJQANCHMSA-N 0 3 409.755 4.266 20 0 HIADHN O=C1[C@H](NCc2ccc(OC(F)F)cc2)CCCN1c1ccc(OC(F)F)cc1 ZINC000462730040 875806258 /nfs/dbraw/zinc/80/62/58/875806258.db2.gz FJJOMUYEIWXJJT-QGZVFWFLSA-N 0 3 412.383 4.175 20 0 HIADHN C[C@H](COCc1ccccc1)NCc1cnn(-c2ccc(Br)cc2)c1 ZINC000462735236 875808789 /nfs/dbraw/zinc/80/87/89/875808789.db2.gz HIRXSURWAOAIMM-MRXNPFEDSA-N 0 3 400.320 4.330 20 0 HIADHN O=C1C[C@H](NCc2ccc(OC(F)F)c(Cl)c2)CN1[C@H]1C[C@@H]1c1ccccc1 ZINC000462752252 875818182 /nfs/dbraw/zinc/81/81/82/875818182.db2.gz BGVTUWRYJSKJSJ-JZXOWHBKSA-N 0 3 406.860 4.188 20 0 HIADHN COc1cccc(Cl)c1CC(=O)Nc1cccc(N2CCN(C(C)C)CC2)c1 ZINC000462777719 875834937 /nfs/dbraw/zinc/83/49/37/875834937.db2.gz USHIFOPDQCWFRN-UHFFFAOYSA-N 0 3 401.938 4.060 20 0 HIADHN CC(C)(C)OC(=O)c1ccc(CN2CCC(C(=O)N3CCc4ccccc43)CC2)cc1 ZINC000462784049 875837657 /nfs/dbraw/zinc/83/76/57/875837657.db2.gz AQKNFDJYWSDQNL-UHFFFAOYSA-N 0 3 420.553 4.443 20 0 HIADHN CC1CCN(C(=O)C2CCN(Cc3ccc(C(=O)OC(C)(C)C)cc3)CC2)CC1 ZINC000462793808 875844199 /nfs/dbraw/zinc/84/41/99/875844199.db2.gz RVMWZCBHSSCBHH-UHFFFAOYSA-N 0 3 400.563 4.112 20 0 HIADHN CC(C)(C)OC(=O)c1ccc(CN2CCC(NC(=O)Nc3ccccc3)CC2)cc1 ZINC000462796905 875845595 /nfs/dbraw/zinc/84/55/95/875845595.db2.gz YRSSFTDBWJOTDF-UHFFFAOYSA-N 0 3 409.530 4.428 20 0 HIADHN O=S1(=O)CCCN1c1cccc(CN[C@H](c2ccc(F)cc2)C2CCCC2)c1 ZINC000462830905 875866168 /nfs/dbraw/zinc/86/61/68/875866168.db2.gz BVOAKBASARCWCA-QFIPXVFZSA-N 0 3 402.535 4.387 20 0 HIADHN Cn1nc2c(cc1=O)CN(CCCC(c1ccc(F)cc1)c1ccc(F)cc1)CC2 ZINC000462977610 875989681 /nfs/dbraw/zinc/98/96/81/875989681.db2.gz MYQVBJYEYJVSFR-UHFFFAOYSA-N 0 3 409.480 4.029 20 0 HIADHN C[C@@H]1CCN(C(=O)N[C@@H]2CCO[C@@H](c3ccccc3)C2)CCN1Cc1ccccc1 ZINC000463015037 876031772 /nfs/dbraw/zinc/03/17/72/876031772.db2.gz WWOUSPZNQRSMFM-AGILITTLSA-N 0 3 407.558 4.213 20 0 HIADHN CCOC(=O)c1nn(-c2ccccc2)cc1CN[C@H]1CCO[C@H](c2ccccc2)C1 ZINC000463056924 876084804 /nfs/dbraw/zinc/08/48/04/876084804.db2.gz NUJYTSBSNCHBIP-UNMCSNQZSA-N 0 3 405.498 4.059 20 0 HIADHN CN(C)[C@H]1Cc2ccccc2N(C(=O)c2ccc(Sc3ccccc3Cl)nn2)C1 ZINC000468944031 883009274 /nfs/dbraw/zinc/00/92/74/883009274.db2.gz LILQDJWTPSYKQG-INIZCTEOSA-N 0 3 424.957 4.414 20 0 HIADHN O=C(CN1CCCC[C@@H]1[C@@H]1CCCC[C@H]1O)N[C@H](c1cccs1)c1ccccc1 ZINC000463200220 876259890 /nfs/dbraw/zinc/25/98/90/876259890.db2.gz AWOXEZXUMKTBMP-BLRYILKCSA-N 0 3 412.599 4.359 20 0 HIADHN Cc1n[nH]c(C)c1[C@@H]1CCCCCN1C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C ZINC000463270328 876328392 /nfs/dbraw/zinc/32/83/92/876328392.db2.gz GFCVCVRDVIVVRV-WTOYTKOKSA-N 0 3 409.578 4.174 20 0 HIADHN CCc1nc2c(s1)[C@H](N(C)C(=O)N[C@H]1CN(Cc3ccccc3)C[C@H]1C)CCC2 ZINC000463280080 876335573 /nfs/dbraw/zinc/33/55/73/876335573.db2.gz RANYBNIVJIEUIS-LSTHTHJFSA-N 0 3 412.603 4.245 20 0 HIADHN CCN(CCc1nccs1)Cc1cc(Br)cc(Br)c1N ZINC000463294833 876354991 /nfs/dbraw/zinc/35/49/91/876354991.db2.gz WJGIEXAGKXMDAB-UHFFFAOYSA-N 0 3 419.186 4.315 20 0 HIADHN Cc1ccc(C(=O)CCN[C@H](C)c2ccc(Br)cc2OCCCO)cc1 ZINC000463374554 876429675 /nfs/dbraw/zinc/42/96/75/876429675.db2.gz ICQOFXDQUXJTGC-MRXNPFEDSA-N 0 3 420.347 4.442 20 0 HIADHN C[C@@H](C(=O)NCCCN1CCc2ccccc2C1)c1ccc(Br)s1 ZINC000463414496 876468094 /nfs/dbraw/zinc/46/80/94/876468094.db2.gz FVSOZOZLGBCBMP-CQSZACIVSA-N 0 3 407.377 4.179 20 0 HIADHN O=C(CCN1Cc2ccc(O)cc2C2(CC2)C1)Nc1cccc(Br)c1 ZINC000463423472 876479184 /nfs/dbraw/zinc/47/91/84/876479184.db2.gz IZNADEDRXYLBMZ-UHFFFAOYSA-N 0 3 401.304 4.031 20 0 HIADHN O=C(NCc1ccco1)c1cccc(CN2CCC[C@@](CO)(Cc3ccccc3)C2)c1 ZINC000463440497 876496956 /nfs/dbraw/zinc/49/69/56/876496956.db2.gz FNRHFUSKCUSKGR-AREMUKBSSA-N 0 3 418.537 4.027 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)c2cccc(-c3noc(C4CC4)n3)c2)c1 ZINC000463491488 876550155 /nfs/dbraw/zinc/55/01/55/876550155.db2.gz GKACGWREAFTWNU-UHFFFAOYSA-N 0 3 404.514 4.126 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)c1ccoc1Br ZINC000468975936 883042242 /nfs/dbraw/zinc/04/22/42/883042242.db2.gz ONTYUOFOEMLLJR-UHFFFAOYSA-N 0 3 419.241 4.265 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)[C@H]1SCCc2sccc21 ZINC000463588608 876694290 /nfs/dbraw/zinc/69/42/90/876694290.db2.gz IUCOSAJZVFLSNY-IBGZPJMESA-N 0 3 404.626 4.309 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)N3C[C@H](C)C[C@@H]3c3ccccc3F)CC2)c1 ZINC000469000236 883067072 /nfs/dbraw/zinc/06/70/72/883067072.db2.gz QTUKVEBSLNUVQL-HYBUGGRVSA-N 0 3 409.549 4.256 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3CCSC(CC)(CC)C3)c(C)c2)CC1 ZINC000463729430 876850617 /nfs/dbraw/zinc/85/06/17/876850617.db2.gz NWDQEMKNIBFGDD-UHFFFAOYSA-N 0 3 404.624 4.276 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)c1ccnc(Oc2ccc(F)cc2F)c1 ZINC000469003609 883071862 /nfs/dbraw/zinc/07/18/62/883071862.db2.gz LTMVGUHQTSCLDW-UHFFFAOYSA-N 0 3 417.481 4.418 20 0 HIADHN COc1ccc(Cn2nc(C)c(CNCc3cccc(-c4cnn(C)c4)c3)c2C)cc1 ZINC000463743415 876864802 /nfs/dbraw/zinc/86/48/02/876864802.db2.gz DEKRWANOANQYNS-UHFFFAOYSA-N 0 3 415.541 4.247 20 0 HIADHN COc1ccc(Cn2nc(C)c(CNC[C@H](c3ccc(C)o3)N3CCCC3)c2C)cc1 ZINC000463747781 876869637 /nfs/dbraw/zinc/86/96/37/876869637.db2.gz IRNJHPKWNJXHAA-XMMPIXPASA-N 0 3 422.573 4.385 20 0 HIADHN O=C(NCCN1CCCC1)c1ccc(NC(=O)c2ccc(C3=CCCC3)cc2)cc1 ZINC000463822633 876937435 /nfs/dbraw/zinc/93/74/35/876937435.db2.gz WQZLIKGJEJBPPJ-UHFFFAOYSA-N 0 3 403.526 4.332 20 0 HIADHN Cn1cc(N2CCC[C@@H](N[C@@H](Cc3ccc(Cl)cc3)c3ccccc3)C2=O)cn1 ZINC000463885305 877006275 /nfs/dbraw/zinc/00/62/75/877006275.db2.gz AIPULCAOEVULOL-YADHBBJMSA-N 0 3 408.933 4.143 20 0 HIADHN Cn1ccc(N2CCC[C@H](N[C@@H](CCCc3ccccc3)c3ccccc3)C2=O)n1 ZINC000463885986 877007349 /nfs/dbraw/zinc/00/73/49/877007349.db2.gz CNBOTZXCFWOIOI-GOTSBHOMSA-N 0 3 402.542 4.269 20 0 HIADHN CCOC(=O)C1CCN(C(=O)[C@@H](C)N[C@@H](CC(C)(C)C)c2ccc(F)cc2)CC1 ZINC000463910214 877030502 /nfs/dbraw/zinc/03/05/02/877030502.db2.gz ISWWRVJHUABQQA-UZLBHIALSA-N 0 3 406.542 4.083 20 0 HIADHN Cn1cc(N2CCC[C@H](N[C@@H](Cc3ccccc3Cl)c3ccccc3)C2=O)cn1 ZINC000463908913 877031352 /nfs/dbraw/zinc/03/13/52/877031352.db2.gz ZAYMYMKHUOCBTC-VXKWHMMOSA-N 0 3 408.933 4.143 20 0 HIADHN CCO[C@@H](C)c1nc(CN(C)C(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)cs1 ZINC000463977084 877105172 /nfs/dbraw/zinc/10/51/72/877105172.db2.gz WSVNZLPJPYTXDX-FUHWJXTLSA-N 0 3 419.566 4.250 20 0 HIADHN CC(C)c1cccc(C(C)C)c1NC(=O)C(=O)Nc1cccc(CN2CC[C@@H](O)C2)c1 ZINC000463977835 877107567 /nfs/dbraw/zinc/10/75/67/877107567.db2.gz QEQWPWLXINCODK-HXUWFJFHSA-N 0 3 423.557 4.077 20 0 HIADHN O=C(NCCN1CCCCC1)Nc1ccc(NC(=O)c2cccc(Cl)c2)c(F)c1 ZINC000463979607 877109096 /nfs/dbraw/zinc/10/90/96/877109096.db2.gz FPFRWXHIZXUVGX-UHFFFAOYSA-N 0 3 418.900 4.339 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2ccc(OC3CCC3)cc2)cc1)[C@@H]1CCCN(C)C1 ZINC000464015296 877149926 /nfs/dbraw/zinc/14/99/26/877149926.db2.gz MLGFXNRJRKEVNX-OAQYLSRUSA-N 0 3 421.541 4.036 20 0 HIADHN Cc1nn(C(C)(C)C)cc1[C@@H](C)NC(=O)NC[C@H](c1ccc(C)cc1)N1CCCC1 ZINC000464126216 877280646 /nfs/dbraw/zinc/28/06/46/877280646.db2.gz OLUGWTMBBUPRJH-XMSQKQJNSA-N 0 3 411.594 4.452 20 0 HIADHN CC(C)(O)CN1CCc2c(cccc2NC(=O)CCc2cccc(C(F)(F)F)c2)C1 ZINC000464136587 877298654 /nfs/dbraw/zinc/29/86/54/877298654.db2.gz UEDWFEINKNWQJI-UHFFFAOYSA-N 0 3 420.475 4.406 20 0 HIADHN CN1CCC(Oc2ccc(NC(=O)c3c(F)cc(C(F)(F)F)cc3F)cn2)CC1 ZINC000464185623 877357538 /nfs/dbraw/zinc/35/75/38/877357538.db2.gz JCTSNDSAIJIWJH-UHFFFAOYSA-N 0 3 415.362 4.104 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)NCc2cccc(-c3cccnc3)c2)CN1Cc1ccccc1 ZINC000464303766 877494431 /nfs/dbraw/zinc/49/44/31/877494431.db2.gz DAHVEFHXTQMJDX-YADARESESA-N 0 3 400.526 4.211 20 0 HIADHN Cc1ccc(-c2noc(CCCN3CCC[C@H](CC(=O)OC(C)C)C3)n2)cc1F ZINC000464494006 877712100 /nfs/dbraw/zinc/71/21/00/877712100.db2.gz IIXYCUYHKAUNGO-QGZVFWFLSA-N 0 3 403.498 4.170 20 0 HIADHN COC(=O)c1ccc(CN(CCCOc2ccccc2)C2CCOCC2)c(F)c1 ZINC000464590046 877815062 /nfs/dbraw/zinc/81/50/62/877815062.db2.gz DPLVHVWHJQSSKM-UHFFFAOYSA-N 0 3 401.478 4.062 20 0 HIADHN C[C@@H](NC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1)c1nc(C2CCCCC2)no1 ZINC000464721759 877950386 /nfs/dbraw/zinc/95/03/86/877950386.db2.gz YFJIYOIVGWCDPL-APWZRJJASA-N 0 3 414.525 4.346 20 0 HIADHN Cc1nsc(N2CCCN(CCCCOc3ccccc3C(F)(F)F)CC2)n1 ZINC000464763919 878008452 /nfs/dbraw/zinc/00/84/52/878008452.db2.gz SPORPNKRWNWPSV-UHFFFAOYSA-N 0 3 414.497 4.237 20 0 HIADHN CC(C)[C@H](c1ccccc1Cl)N(C)C(=O)C(=O)Nc1cccc(CN(C)C)c1 ZINC000503323953 912302697 /nfs/dbraw/zinc/30/26/97/912302697.db2.gz GDWAYVHGXBMEOY-HXUWFJFHSA-N 0 3 401.938 4.196 20 0 HIADHN CCN(Cc1coc(-c2ccc(OC)cc2)n1)CC1CCN(c2ccccn2)CC1 ZINC000464807168 878055081 /nfs/dbraw/zinc/05/50/81/878055081.db2.gz SLRLGKJVQWSQQK-UHFFFAOYSA-N 0 3 406.530 4.484 20 0 HIADHN COC(=O)[C@H](C)[C@H](NCC[S@](=O)c1cc(Cl)ccc1Cl)c1ccccc1 ZINC000464876579 878166111 /nfs/dbraw/zinc/16/61/11/878166111.db2.gz OASAMTKCZHIDQN-NEVLMKBDSA-N 0 3 414.354 4.241 20 0 HIADHN C[C@H]1CCN(C(=O)Cc2cccc(Br)c2)CCN1Cc1ccccc1 ZINC000464888516 878186440 /nfs/dbraw/zinc/18/64/40/878186440.db2.gz DPIOAEMPMAKPQH-KRWDZBQOSA-N 0 3 401.348 4.115 20 0 HIADHN C[C@H]1CCN(C(=O)c2ccc(OCC(F)(F)F)cc2)CCN1Cc1ccccc1 ZINC000464896146 878202106 /nfs/dbraw/zinc/20/21/06/878202106.db2.gz NKRIVZMSPSHCAQ-KRWDZBQOSA-N 0 3 406.448 4.364 20 0 HIADHN Cc1cc(C)n(-c2ccc(C(=O)N3CC[C@H](C)N(Cc4ccccc4)CC3)cc2)n1 ZINC000464906085 878218161 /nfs/dbraw/zinc/21/81/61/878218161.db2.gz MFCDQEKEMGYFTB-FQEVSTJZSA-N 0 3 402.542 4.226 20 0 HIADHN Cc1cc(C)n(Cc2cccc(C(=O)N3CC[C@H](C)N(Cc4ccccc4)CC3)c2)n1 ZINC000464905561 878219942 /nfs/dbraw/zinc/21/99/42/878219942.db2.gz RGJSNLUCQVRQPV-NRFANRHFSA-N 0 3 416.569 4.285 20 0 HIADHN CCC1(C(=O)NC2CCN(CCOc3ccc(Br)cc3)CC2)CCCC1 ZINC000464965966 878306584 /nfs/dbraw/zinc/30/65/84/878306584.db2.gz BTFLDXPXKVEURM-UHFFFAOYSA-N 0 3 423.395 4.379 20 0 HIADHN C[C@@H](NC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1)c1cccc(-n2cccn2)c1 ZINC000465206234 878613767 /nfs/dbraw/zinc/61/37/67/878613767.db2.gz NGHNPKUQIBEWLA-WIYYLYMNSA-N 0 3 406.505 4.101 20 0 HIADHN Cc1ccc(OC(F)F)c(CNC(=O)NC[C@H](c2cccs2)N2CCCC2)c1 ZINC000465212278 878624877 /nfs/dbraw/zinc/62/48/77/878624877.db2.gz BDTKHMBOCFQUKL-MRXNPFEDSA-N 0 3 409.502 4.294 20 0 HIADHN O[C@@H](COc1cc(Cl)ccc1Cl)CN1CCC[C@H](c2ncc3n2CCCC3)C1 ZINC000503402619 912383014 /nfs/dbraw/zinc/38/30/14/912383014.db2.gz BOLFEUFWIBPKMJ-MAUKXSAKSA-N 0 3 424.372 4.146 20 0 HIADHN COc1ccc(C2CCN(C(=O)c3ccc(N4CCN(C(C)C)CC4)cc3)CC2)cc1 ZINC000465365140 878805097 /nfs/dbraw/zinc/80/50/97/878805097.db2.gz AOXMWUOPSABHIH-UHFFFAOYSA-N 0 3 421.585 4.245 20 0 HIADHN CO[C@]1(C)C[C@H](N[C@H](C)C(=O)Nc2cccc(CSc3ccccn3)c2)C1(C)C ZINC000465405457 878841908 /nfs/dbraw/zinc/84/19/08/878841908.db2.gz JIICHGODKPDCJM-BVZALQNUSA-N 0 3 413.587 4.494 20 0 HIADHN COc1ccc(C2CCN(C(=O)NC[C@@H](c3cccs3)N3CCCC3)CC2)cc1 ZINC000465426513 878855862 /nfs/dbraw/zinc/85/58/62/878855862.db2.gz SDNQCISCRUJLLR-NRFANRHFSA-N 0 3 413.587 4.483 20 0 HIADHN C[C@@H](NC(=O)NC[C@H](c1ccccc1)N1CCCC1)c1nc(-c2cccc(F)c2)no1 ZINC000465426668 878856301 /nfs/dbraw/zinc/85/63/01/878856301.db2.gz HPRCMBONDWXQGO-OXQOHEQNSA-N 0 3 423.492 4.073 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)N(Cc1cc[nH]n1)Cc1ccccc1 ZINC000465427582 878857959 /nfs/dbraw/zinc/85/79/59/878857959.db2.gz YKCPKEHTQCRBNC-FQEVSTJZSA-N 0 3 409.559 4.020 20 0 HIADHN C[C@H](NC(=O)NC[C@H](c1ccccc1)N1CCCC1)c1ccc(-n2cccn2)cc1 ZINC000465433029 878864700 /nfs/dbraw/zinc/86/47/00/878864700.db2.gz ZWHXYAFTTQRBRC-WMZHIEFXSA-N 0 3 403.530 4.070 20 0 HIADHN CO[C@@H](CNC(=O)NC[C@@H](c1cccs1)N1CCCC1)c1ccc(Cl)cc1 ZINC000465440033 878871631 /nfs/dbraw/zinc/87/16/31/878871631.db2.gz ZJRZFBLPOQQRID-ROUUACIJSA-N 0 3 407.967 4.225 20 0 HIADHN C[C@H](NC(=O)NC[C@@H](c1ccccc1)N1CCCC1)c1cccc(-n2cccn2)c1 ZINC000465447656 878879601 /nfs/dbraw/zinc/87/96/01/878879601.db2.gz ZECCVAABYXIHBL-CVDCTZTESA-N 0 3 403.530 4.070 20 0 HIADHN COc1ccc([C@H](NC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)C2CC2)cc1 ZINC000465475064 878912164 /nfs/dbraw/zinc/91/21/64/878912164.db2.gz VAQRNOWYDXQVJM-YADARESESA-N 0 3 407.558 4.452 20 0 HIADHN C[C@H]1CCN(C(=O)NCc2ccccc2OC(F)F)CCN1Cc1ccccc1 ZINC000465497297 878936265 /nfs/dbraw/zinc/93/62/65/878936265.db2.gz UHVZHPVEZJIFMV-KRWDZBQOSA-N 0 3 403.473 4.094 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N3CC(c4nc5ccccc5s4)C3)cc2)CC1 ZINC000465518159 878966947 /nfs/dbraw/zinc/96/69/47/878966947.db2.gz QILVXOLXVPZVOS-UHFFFAOYSA-N 0 3 420.582 4.066 20 0 HIADHN CCN1CCN(Cc2ccc(CNC(=O)N3CC[C@@H](C)C[C@H]3c3ccco3)cc2)CC1 ZINC000465518464 878966985 /nfs/dbraw/zinc/96/69/85/878966985.db2.gz DWOKSBMBIFIQGD-OFNKIYASSA-N 0 3 424.589 4.100 20 0 HIADHN CC[C@@H](CNC(=O)N[C@H](C)c1ccc(-n2cccn2)cc1)N1CCc2ccccc2C1 ZINC000465538139 878997986 /nfs/dbraw/zinc/99/79/86/878997986.db2.gz GAQDKZFDRVBXIS-XXBNENTESA-N 0 3 417.557 4.069 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)N3C[C@H](C)[C@@H]3c3ccccc3)CC2)c1 ZINC000465538193 878998718 /nfs/dbraw/zinc/99/87/18/878998718.db2.gz ASSWTERIWUMETG-WIOPSUGQSA-N 0 3 420.601 4.300 20 0 HIADHN CCc1nc(C)c([C@@H](C)N(C)C(=O)NCCCN2CCc3ccccc3C2)s1 ZINC000465545764 879008220 /nfs/dbraw/zinc/00/82/20/879008220.db2.gz RMJYMIAHNWMHFB-QGZVFWFLSA-N 0 3 400.592 4.165 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)N3Cc4ccccc4C[C@@H]3C)CC2)c1 ZINC000465553087 879019044 /nfs/dbraw/zinc/01/90/44/879019044.db2.gz YPSHRQYOHHTXRS-QFIPXVFZSA-N 0 3 420.601 4.054 20 0 HIADHN Cc1ccccc1[C@@H]1CN(C(=O)N[C@@H](CN2CCCC2)c2ccccc2)[C@H](C)CO1 ZINC000465594437 879080234 /nfs/dbraw/zinc/08/02/34/879080234.db2.gz HFWJLQNZHVXYSI-QDSKXPNFSA-N 0 3 407.558 4.304 20 0 HIADHN C[C@@H](NC(=O)N[C@H](CN1CCCC1)c1ccccc1)c1cccc(-n2cccn2)c1 ZINC000465598989 879086732 /nfs/dbraw/zinc/08/67/32/879086732.db2.gz MTBXJHIMGUVJIC-AUSIDOKSSA-N 0 3 403.530 4.070 20 0 HIADHN CO[C@@H](CNC(=O)N[C@@H](CN1CCCC1)c1ccccc1)c1cccc(Cl)c1 ZINC000465609354 879103896 /nfs/dbraw/zinc/10/38/96/879103896.db2.gz UCRXTRMWMOCXRE-SFTDATJTSA-N 0 3 401.938 4.164 20 0 HIADHN C[C@@H](OCCCNC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1)c1ccccc1 ZINC000465609781 879105843 /nfs/dbraw/zinc/10/58/43/879105843.db2.gz VIVDPJBZWXBHEM-FGZHOGPDSA-N 0 3 409.574 4.460 20 0 HIADHN C[C@H]1CCN(C(=O)NCc2ccc(OC(F)F)cc2)CCN1Cc1ccccc1 ZINC000465643505 879161247 /nfs/dbraw/zinc/16/12/47/879161247.db2.gz XMYGLFRWPHIMPA-KRWDZBQOSA-N 0 3 403.473 4.094 20 0 HIADHN CC(C)CC[C@H](NC(=O)NC[C@@H](C)CN1CCN(C)CC1)c1ccc(Cl)cc1 ZINC000465664141 879196911 /nfs/dbraw/zinc/19/69/11/879196911.db2.gz PTCKYSDTCVOMFV-NQIIRXRSSA-N 0 3 409.018 4.000 20 0 HIADHN COc1ccccc1C[C@@H](C)N(C)C(=O)NCC(C)(C)N1CCc2ccccc2C1 ZINC000465687651 879235980 /nfs/dbraw/zinc/23/59/80/879235980.db2.gz HJGVBJDYNHRGKH-LJQANCHMSA-N 0 3 409.574 4.105 20 0 HIADHN C[C@@H](NC(=O)NCC(C)(C)N1CCc2ccccc2C1)c1cccc(-n2cccn2)c1 ZINC000465688888 879241599 /nfs/dbraw/zinc/24/15/99/879241599.db2.gz JNXIRNHVKDLWRC-LJQANCHMSA-N 0 3 417.557 4.069 20 0 HIADHN CC(C)(CNC(=O)N(Cc1ccc(O)cc1)CC1CC1)N1CCc2ccccc2C1 ZINC000465699532 879261394 /nfs/dbraw/zinc/26/13/94/879261394.db2.gz VNSOTYLHZPYFSV-UHFFFAOYSA-N 0 3 407.558 4.151 20 0 HIADHN CC[C@H](NC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1)c1ccc2c(c1)OCCO2 ZINC000465708338 879273688 /nfs/dbraw/zinc/27/36/88/879273688.db2.gz MGMGPSZSRJOKDH-KNQAVFIVSA-N 0 3 423.557 4.215 20 0 HIADHN CCCCOC1CCN(C(=O)NC[C@H](c2ccccc2)N2CCC(C)CC2)CC1 ZINC000465724669 879301574 /nfs/dbraw/zinc/30/15/74/879301574.db2.gz NLLQVINVFJWHJR-HSZRJFAPSA-N 0 3 401.595 4.450 20 0 HIADHN CCO[C@H](C)c1nc(CN(C)C(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)cs1 ZINC000465760003 879354999 /nfs/dbraw/zinc/35/49/99/879354999.db2.gz QJEBPJOSVUMEDB-SCTDSRPQSA-N 0 3 416.591 4.218 20 0 HIADHN CN(C)CCN(C[C@@H]1CCCO1)C(=O)N[C@H](c1ccsc1)c1ccc(Cl)cc1 ZINC000465763251 879359244 /nfs/dbraw/zinc/35/92/44/879359244.db2.gz WFIIMOCKLOIPLA-PMACEKPBSA-N 0 3 421.994 4.243 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)NCCc2c[nH]c3ccc(Cl)cc23)C1 ZINC000465765092 879363716 /nfs/dbraw/zinc/36/37/16/879363716.db2.gz VAWQIESTARWBES-OXQOHEQNSA-N 0 3 410.949 4.499 20 0 HIADHN CC(C)COC[C@H](NC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1)c1ccco1 ZINC000465800496 879411507 /nfs/dbraw/zinc/41/15/07/879411507.db2.gz XKGZTTFYEMQWMQ-UNMCSNQZSA-N 0 3 413.562 4.299 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N(Cc2cc[nH]n2)Cc2ccccc2)N2CCCC2)cc1 ZINC000465806822 879421114 /nfs/dbraw/zinc/42/11/14/879421114.db2.gz HIKVAYXWFGFXLE-DEOSSOPVSA-N 0 3 417.557 4.267 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)NCc2cccc(N3CC=CC3)c2)N2CCCC2)cc1 ZINC000465823199 879451936 /nfs/dbraw/zinc/45/19/36/879451936.db2.gz VTAPAYSWMJYEIA-XMMPIXPASA-N 0 3 404.558 4.008 20 0 HIADHN Cc1sc(CNC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)nc1C(C)C ZINC000465899881 879560370 /nfs/dbraw/zinc/56/03/70/879560370.db2.gz ZRLQVBUPUXWNSD-QGZVFWFLSA-N 0 3 400.592 4.381 20 0 HIADHN Cc1ccccc1[C@H](NC(=O)NC[C@H](C)CN1CCN(C)CC1)[C@H]1CCC[C@H](C)C1 ZINC000465935178 879600422 /nfs/dbraw/zinc/60/04/22/879600422.db2.gz UPLKTJDAZPVPGW-CGCKEFBRSA-N 0 3 414.638 4.045 20 0 HIADHN C[C@H](NC(=O)N1CC[C@@H](N2CC=CC2)C1)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000465939465 879606239 /nfs/dbraw/zinc/60/62/39/879606239.db2.gz JARMLPXKEIMJRV-PGRDOPGGSA-N 0 3 409.505 4.121 20 0 HIADHN Cc1ccsc1[C@H](Cc1ccccc1)NC(=O)N(CCN(C)C)C[C@@H]1CCCO1 ZINC000465955256 879621827 /nfs/dbraw/zinc/62/18/27/879621827.db2.gz VXEMEEYFHJGLSB-SFTDATJTSA-N 0 3 415.603 4.093 20 0 HIADHN CSc1cccc([C@H](NC(=O)N[C@@H]2CCN(C3CC3)C2)c2ccc(F)c(F)c2)c1 ZINC000466023453 879709871 /nfs/dbraw/zinc/70/98/71/879709871.db2.gz SVNSCDYMRBXBNE-IERDGZPVSA-N 0 3 417.525 4.312 20 0 HIADHN COc1ccc([C@@H](C)CCNC(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)cc1 ZINC000466030052 879716353 /nfs/dbraw/zinc/71/63/53/879716353.db2.gz AQRVZXIZVUPFNP-SFTDATJTSA-N 0 3 409.574 4.495 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccc(O)cc1)C(=O)c1cc(Br)cs1 ZINC000503461581 912492096 /nfs/dbraw/zinc/49/20/96/912492096.db2.gz LTZMWIVENKWPJT-MRXNPFEDSA-N 0 3 423.376 4.343 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N[C@H](c3nc(C)cs3)C3CC3)c(C)c2)CC1 ZINC000466081880 879800059 /nfs/dbraw/zinc/80/00/59/879800059.db2.gz JAEOJJKEMFMWJR-FQEVSTJZSA-N 0 3 413.591 4.175 20 0 HIADHN CCCN(C(=O)NC[C@H](C)CN1CCN(CC)CC1)[C@@H](C)c1cc2ccccc2o1 ZINC000466108139 879822870 /nfs/dbraw/zinc/82/28/70/879822870.db2.gz GGXDMUUIRGZOIU-PMACEKPBSA-N 0 3 414.594 4.189 20 0 HIADHN Cc1cnc([C@@H](NC(=O)N(CCN(C)C)Cc2cccc(Cl)c2)C2CC2)s1 ZINC000466114085 879827894 /nfs/dbraw/zinc/82/78/94/879827894.db2.gz HGCXYIKLPUNKQV-SFHVURJKSA-N 0 3 406.983 4.329 20 0 HIADHN C[C@@H]1C[C@@H]1[C@@H](NC(=O)N(CCN(C)C)Cc1ccccn1)c1ccc(Cl)cc1 ZINC000466152642 879858630 /nfs/dbraw/zinc/85/86/30/879858630.db2.gz PARAPDWFIIWOBK-CZAAIQMYSA-N 0 3 400.954 4.206 20 0 HIADHN C[C@@H](CNC(=O)N(CCN(C)C)Cc1ccc(F)cc1)Oc1ccccc1Cl ZINC000466164749 879866964 /nfs/dbraw/zinc/86/69/64/879866964.db2.gz MPSMHUKJNKKPLC-INIZCTEOSA-N 0 3 407.917 4.020 20 0 HIADHN C[C@@H](CNC(=O)N1CCCN(Cc2ccccc2)CC1)Oc1ccccc1Cl ZINC000466168872 879870791 /nfs/dbraw/zinc/87/07/91/879870791.db2.gz QVCQUQBQLPBJLC-SFHVURJKSA-N 0 3 401.938 4.025 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)NCC(C)(C)c2c(F)cccc2Cl)o1 ZINC000466213810 879906230 /nfs/dbraw/zinc/90/62/30/879906230.db2.gz DXNUXKTUVRJVGX-UHFFFAOYSA-N 0 3 409.933 4.432 20 0 HIADHN Cc1ccccc1C1(CNC(=O)N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)CCOCC1 ZINC000466225315 879925404 /nfs/dbraw/zinc/92/54/04/879925404.db2.gz KZZKTEDMCITAGB-GGAORHGYSA-N 0 3 421.585 4.005 20 0 HIADHN Cc1ccc(-c2nc(CCNC(=O)N[C@@H]3C[C@@H](C)N(Cc4ccccc4)C3)co2)cc1 ZINC000466247059 879962701 /nfs/dbraw/zinc/96/27/01/879962701.db2.gz UTYZYHJNZFSNQC-AUSIDOKSSA-N 0 3 418.541 4.155 20 0 HIADHN C[C@H](NCc1cncc(Br)c1)[C@@H](OC1CCOCC1)c1ccccc1 ZINC000466362207 880120796 /nfs/dbraw/zinc/12/07/96/880120796.db2.gz JQXFUKYKLOKQDH-MGPUTAFESA-N 0 3 405.336 4.259 20 0 HIADHN C[C@@H](CNC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1)c1ccc(F)cc1F ZINC000466430133 880205652 /nfs/dbraw/zinc/20/56/52/880205652.db2.gz CXFVEZKROMXBEX-ROUUACIJSA-N 0 3 401.501 4.374 20 0 HIADHN CCOc1cc(CN[C@H]2CC(=O)N(Cc3ccccc3C(F)(F)F)C2)ccc1OC ZINC000466453716 880233076 /nfs/dbraw/zinc/23/30/76/880233076.db2.gz ITBDJBFNGNQXMP-KRWDZBQOSA-N 0 3 422.447 4.003 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)N2CCC(OCCc3ccccc3)CC2)CN1Cc1ccccc1 ZINC000466517887 880294115 /nfs/dbraw/zinc/29/41/15/880294115.db2.gz WZCVEQZNPWGVQL-QPPBQGQZSA-N 0 3 421.585 4.083 20 0 HIADHN Cc1cccc(C(=O)N2CCCC2)c1NC(=O)N[C@@H]1C[C@H](C)N(Cc2ccccc2)C1 ZINC000466522203 880297742 /nfs/dbraw/zinc/29/77/42/880297742.db2.gz JTSAPKKVOOPEKM-PZJWPPBQSA-N 0 3 420.557 4.016 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)NC(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)cc1 ZINC000466541341 880315093 /nfs/dbraw/zinc/31/50/93/880315093.db2.gz QWWQBELENCXAOH-SFYKDHMMSA-N 0 3 417.557 4.204 20 0 HIADHN C[C@H](NC(=O)N(CCCc1ccccc1)CCN(C)C)c1cccc(-n2cccn2)c1 ZINC000466657007 880435436 /nfs/dbraw/zinc/43/54/36/880435436.db2.gz BTFFLYVSGKKGIY-NRFANRHFSA-N 0 3 419.573 4.139 20 0 HIADHN CCCN1CCC[C@H]1C(=O)N[C@@H](C)c1cccc(NC(=O)Cc2ccccc2F)c1 ZINC000503521566 912569358 /nfs/dbraw/zinc/56/93/58/912569358.db2.gz OWJPGDJQJNYNIT-JTSKRJEESA-N 0 3 411.521 4.059 20 0 HIADHN CC[C@@H](NC(=O)N(CCN(C)C)Cc1ccc(C)o1)c1nc(C(F)(F)F)cs1 ZINC000466705375 880496039 /nfs/dbraw/zinc/49/60/39/880496039.db2.gz UGSWSNZKIJBXHS-CQSZACIVSA-N 0 3 418.485 4.288 20 0 HIADHN Cc1ccc(-c2nc(CNC(=O)N3CCCN(Cc4ccccc4)C[C@@H]3C)co2)cc1 ZINC000466776385 880556351 /nfs/dbraw/zinc/55/63/51/880556351.db2.gz MFHLKGKQUDRCIQ-FQEVSTJZSA-N 0 3 418.541 4.456 20 0 HIADHN CSc1ccc(F)cc1CNC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C ZINC000466799578 880577489 /nfs/dbraw/zinc/57/74/89/880577489.db2.gz FGJXJQAQGLXZMB-QGZVFWFLSA-N 0 3 401.551 4.354 20 0 HIADHN COc1cc(CCC2CCN(Cc3cc(-c4cnn(C)c4C)no3)CC2)cc(OC)c1 ZINC000466831247 880600763 /nfs/dbraw/zinc/60/07/63/880600763.db2.gz LOOMWPYIPHBBGN-UHFFFAOYSA-N 0 3 424.545 4.246 20 0 HIADHN COc1ccc(N(C)C(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)cc1F ZINC000466906731 880673075 /nfs/dbraw/zinc/67/30/75/880673075.db2.gz ROIHMPWWAJTYIE-FQEVSTJZSA-N 0 3 410.411 4.252 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3cccc(-c4cc[nH]n4)c3)c(C)c2)CC1 ZINC000466917569 880686075 /nfs/dbraw/zinc/68/60/75/880686075.db2.gz QXRNFIFYMUACSY-UHFFFAOYSA-N 0 3 404.518 4.171 20 0 HIADHN C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)N(C)[C@H]1CCSc2ccc(Br)cc21 ZINC000466921328 880689404 /nfs/dbraw/zinc/68/94/04/880689404.db2.gz KAIDXXCWQQDSNT-DQYPLSBCSA-N 0 3 424.408 4.110 20 0 HIADHN CC1CCN([C@H](CNC(=O)Nc2cccnc2-c2cnn(C)c2)c2ccccc2)CC1 ZINC000466946543 880720694 /nfs/dbraw/zinc/72/06/94/880720694.db2.gz LJTSGUIRXQQDPW-JOCHJYFZSA-N 0 3 418.545 4.077 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)NC[C@@H]2CCCO[C@@H]2c2ccc(C)cc2)o1 ZINC000466952764 880733163 /nfs/dbraw/zinc/73/31/63/880733163.db2.gz GVDJTBVKFWHSLT-JTHBVZDNSA-N 0 3 413.562 4.138 20 0 HIADHN O=C([C@@H]1CCCc2[nH]ncc21)N1CCN(Cc2ccc(-c3cccc(F)c3)s2)CC1 ZINC000466991127 880803751 /nfs/dbraw/zinc/80/37/51/880803751.db2.gz MLMJFUFHHLAGAN-LJQANCHMSA-N 0 3 424.545 4.042 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1CCN(Cc2ccccc2)[C@@H]1C)c1nc(C(F)(F)F)cs1 ZINC000503546114 912609390 /nfs/dbraw/zinc/60/93/90/912609390.db2.gz FEFRZAUNXCKDAO-GZBFAFLISA-N 0 3 412.481 4.185 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)[C@H]2C[C@@H]2c2ccccc2OC(F)F)CN1Cc1ccccc1 ZINC000467044487 880839874 /nfs/dbraw/zinc/83/98/74/880839874.db2.gz JFVFIRAXHDOUCR-VUBSUSDNSA-N 0 3 400.469 4.171 20 0 HIADHN Cc1noc(CSc2ccccc2C(=O)N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)n1 ZINC000467046191 880840251 /nfs/dbraw/zinc/84/02/51/880840251.db2.gz NHPCQELJWSPCEO-VQIMIIECSA-N 0 3 422.554 4.063 20 0 HIADHN Cc1cc(CSc2ncccc2C(=O)N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)no1 ZINC000467048957 880841178 /nfs/dbraw/zinc/84/11/78/880841178.db2.gz UXCDLPKYVWCRRL-APWZRJJASA-N 0 3 422.554 4.063 20 0 HIADHN C[C@H](NC(=O)N(CCN(C)C)Cc1ccccc1F)c1nc(C2CCCCC2)no1 ZINC000467053862 880844415 /nfs/dbraw/zinc/84/44/15/880844415.db2.gz NGDHAWBOAWWAJQ-INIZCTEOSA-N 0 3 417.529 4.091 20 0 HIADHN CC[C@H]1CCCCN1CCNC(=O)c1ccc(NC(=O)c2ccc(OC)cc2)s1 ZINC000467108317 880867516 /nfs/dbraw/zinc/86/75/16/880867516.db2.gz BCRMVDXIYZFDMH-KRWDZBQOSA-N 0 3 415.559 4.003 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)c(C)c1 ZINC000467108463 880867651 /nfs/dbraw/zinc/86/76/51/880867651.db2.gz BVPUWUGUDRAURM-NNMXDRDESA-N 0 3 422.573 4.308 20 0 HIADHN COC[C@H]1CCCCN(CC(=O)NC[C@H](c2c[nH]c3ccccc32)c2ccccc2)C1 ZINC000467121182 880876998 /nfs/dbraw/zinc/87/69/98/880876998.db2.gz VCDGSWOHXSVGSZ-REWPJTCUSA-N 0 3 419.569 4.165 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)N2CCC[C@H]2c2cc(F)cc(Br)c2)CN1C1CC1 ZINC000467228490 880958011 /nfs/dbraw/zinc/95/80/11/880958011.db2.gz IPWXLEUONCDCGT-PUECVXPYSA-N 0 3 410.331 4.060 20 0 HIADHN Cc1cc(F)cc2c1CN(C(=O)Nc1ccc(CCN3CCSCC3)cc1)CC2 ZINC000503560159 912634970 /nfs/dbraw/zinc/63/49/70/912634970.db2.gz RJKYSXYZPRWPKH-UHFFFAOYSA-N 0 3 413.562 4.316 20 0 HIADHN CC(=O)Nc1ccc([C@@H](C)NCc2ccc(I)c(C)c2)cc1 ZINC000467379802 881157298 /nfs/dbraw/zinc/15/72/98/881157298.db2.gz BTSRKUZNLPDJOE-CYBMUJFWSA-N 0 3 408.283 4.409 20 0 HIADHN COc1cc2c(cc1F)CC[C@@H]2NC[C@H](O)COc1cccc(Cl)c1Cl ZINC000467384883 881165049 /nfs/dbraw/zinc/16/50/49/881165049.db2.gz KPLGPYPROQCFSJ-LRDDRELGSA-N 0 3 400.277 4.158 20 0 HIADHN O=C1c2ccccc2CCN1CCN[C@@H]1CCSc2ccc(Br)cc21 ZINC000467402021 881185149 /nfs/dbraw/zinc/18/51/49/881185149.db2.gz PZOMZFNGZAJAGS-GOSISDBHSA-N 0 3 417.372 4.274 20 0 HIADHN CCS(=O)(=O)c1cccc(CN[C@@H](C)CC(=O)Nc2ccccc2C(C)C)c1 ZINC000467402510 881187758 /nfs/dbraw/zinc/18/77/58/881187758.db2.gz FGCQNLVQHKTHJX-KRWDZBQOSA-N 0 3 402.560 4.111 20 0 HIADHN C[C@H](CCN[C@@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl)c1ccccc1 ZINC000467406037 881191826 /nfs/dbraw/zinc/19/18/26/881191826.db2.gz OQQXCHJQXVNETQ-OLZOCXBDSA-N 0 3 401.359 4.485 20 0 HIADHN COc1cc(C(C)=O)ccc1OC[C@@H](O)CN(C1CC1)[C@@H]1CCCc2ccccc21 ZINC000503572799 912653877 /nfs/dbraw/zinc/65/38/77/912653877.db2.gz HRKWFVJQLXBAPW-JTHBVZDNSA-N 0 3 409.526 4.180 20 0 HIADHN CCS(=O)(=O)c1cccc(CN[C@H](c2ccc(Br)cc2)C2CC2)c1 ZINC000467418845 881206630 /nfs/dbraw/zinc/20/66/30/881206630.db2.gz PIRDSRXSEIAHBD-IBGZPJMESA-N 0 3 408.361 4.484 20 0 HIADHN Cc1nc(Cc2ccccc2)sc1[C@H](C)NCCN1CCc2ccccc2C1=O ZINC000467426321 881216345 /nfs/dbraw/zinc/21/63/45/881216345.db2.gz BAZWSHDZXFTZHR-KRWDZBQOSA-N 0 3 405.567 4.391 20 0 HIADHN C[C@@H](C(=O)Nc1cccc(CN2CCC(O)CC2)c1)c1ccc(C(F)(F)F)cc1 ZINC000467428514 881220717 /nfs/dbraw/zinc/22/07/17/881220717.db2.gz QKETYHCWQYKDDI-OAHLLOKOSA-N 0 3 406.448 4.404 20 0 HIADHN C[C@@H](CNC(=O)Nc1ccccc1CC(=O)OC(C)(C)C)N(C)Cc1ccccc1 ZINC000467428287 881221697 /nfs/dbraw/zinc/22/16/97/881221697.db2.gz PHEWLIIBJKKNQI-SFHVURJKSA-N 0 3 411.546 4.213 20 0 HIADHN CC(=O)N(C)c1cccc(NC(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)c1 ZINC000467434705 881232621 /nfs/dbraw/zinc/23/26/21/881232621.db2.gz VZZLPHYYZQTNTN-FQEVSTJZSA-N 0 3 414.575 4.326 20 0 HIADHN CC(C)NC(=O)Nc1ccc([C@H](C)N[C@H]2CC(=O)N(Cc3ccccc3)[C@@H]2C)cc1 ZINC000467440662 881241104 /nfs/dbraw/zinc/24/11/04/881241104.db2.gz WFJBBZWXKMOKCJ-SVMVAKDDSA-N 0 3 408.546 4.057 20 0 HIADHN CC(C)NC(=O)Nc1ccc([C@H](C)N[C@@H]2CC(=O)N(Cc3ccccc3)[C@H]2C)cc1 ZINC000467440660 881242720 /nfs/dbraw/zinc/24/27/20/881242720.db2.gz WFJBBZWXKMOKCJ-NPPFBWRTSA-N 0 3 408.546 4.057 20 0 HIADHN C[C@H]1C[C@H](NC(=O)Nc2cccc(-c3noc(C4CC4)n3)c2)CN1Cc1ccccc1 ZINC000467455682 881261185 /nfs/dbraw/zinc/26/11/85/881261185.db2.gz DALKRHCMWOFILB-KKSFZXQISA-N 0 3 417.513 4.399 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)Nc2cccc(-c3noc(C4CC4)n3)c2)CN1Cc1ccccc1 ZINC000467455681 881261561 /nfs/dbraw/zinc/26/15/61/881261561.db2.gz DALKRHCMWOFILB-IIBYNOLFSA-N 0 3 417.513 4.399 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)Nc2ccccc2CC(=O)OC(C)(C)C)CN1Cc1ccccc1 ZINC000467462414 881272243 /nfs/dbraw/zinc/27/22/43/881272243.db2.gz YUMCPDVJJPSCOS-WIYYLYMNSA-N 0 3 423.557 4.355 20 0 HIADHN Cc1cc(NC(=O)N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)ccc1OC1CCOCC1 ZINC000467466191 881280741 /nfs/dbraw/zinc/28/07/41/881280741.db2.gz BZLNHDQDEHSVBK-DENIHFKCSA-N 0 3 423.557 4.337 20 0 HIADHN COc1ccc(NC(=O)N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)c(Br)c1 ZINC000467471271 881287671 /nfs/dbraw/zinc/28/76/71/881287671.db2.gz GLZIQRIODOTGTR-ZBFHGGJFSA-N 0 3 418.335 4.242 20 0 HIADHN Cc1nn(C(C)C)cc1CNCc1ccccc1-c1ccc(Cn2cncn2)cc1 ZINC000467482782 881303919 /nfs/dbraw/zinc/30/39/19/881303919.db2.gz ZFSGKWIFOPDMTF-UHFFFAOYSA-N 0 3 400.530 4.369 20 0 HIADHN Cc1cccc(C2(C(=O)NCc3ccccc3CN3CCC(O)CC3)CCCC2)c1 ZINC000467504980 881320388 /nfs/dbraw/zinc/32/03/88/881320388.db2.gz MQZXNFVVENRJHR-UHFFFAOYSA-N 0 3 406.570 4.080 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)CCc2cccc(OC(C)(C)C)n2)CC1 ZINC000467518421 881333584 /nfs/dbraw/zinc/33/35/84/881333584.db2.gz DPZHSTZLDMLVKO-UHFFFAOYSA-N 0 3 409.574 4.315 20 0 HIADHN Cc1c2cc(C)ccc2sc1C(=O)N1CCC(CN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000469073650 883156077 /nfs/dbraw/zinc/15/60/77/883156077.db2.gz SFJRFYWMQBYMKZ-IRXDYDNUSA-N 0 3 400.588 4.480 20 0 HIADHN C[C@H](CCCOc1ccccc1C(N)=O)N[C@@H](c1cccc(F)c1)c1ccccn1 ZINC000469079765 883166479 /nfs/dbraw/zinc/16/64/79/883166479.db2.gz QCCHJFMSWGZYHS-HXOBKFHXSA-N 0 3 407.489 4.246 20 0 HIADHN COc1cc(C)c([C@@H](C)N[C@H]2CCCN(Cc3ccc(F)cc3F)C2=O)cc1OC ZINC000469103791 883195160 /nfs/dbraw/zinc/19/51/60/883195160.db2.gz VGRCKUCOBXZWHS-QRWLVFNGSA-N 0 3 418.484 4.132 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)c3cc(-c4ccc(Cl)cc4)c[nH]3)CC2)C[C@H](C)O1 ZINC000469114531 883205355 /nfs/dbraw/zinc/20/53/55/883205355.db2.gz WFFKAWJVBQSQLK-IRXDYDNUSA-N 0 3 415.965 4.297 20 0 HIADHN CCCC[C@@H](C)C(=O)NC1CCN(CCOc2ccc(Br)cc2)CC1 ZINC000503594390 912683829 /nfs/dbraw/zinc/68/38/29/912683829.db2.gz NDNQSUUCUOKVSG-MRXNPFEDSA-N 0 3 411.384 4.235 20 0 HIADHN COc1ccccc1[C@@H](C)NC(=O)[C@@H](C)N(C)CCCc1cc(-c2ccccc2)n[nH]1 ZINC000503594280 912684316 /nfs/dbraw/zinc/68/43/16/912684316.db2.gz LTKWBSQQNJTAHZ-RTBURBONSA-N 0 3 420.557 4.216 20 0 HIADHN Cc1cccc(C)c1NC(=O)CN(C)C(=O)N[C@H](CN(C)Cc1ccccc1)C(C)C ZINC000469430751 883615230 /nfs/dbraw/zinc/61/52/30/883615230.db2.gz VWSLXHPNBRVRHE-JOCHJYFZSA-N 0 3 424.589 4.040 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)Nc1ccccc1C(=O)N1CCCC1 ZINC000469458610 883667085 /nfs/dbraw/zinc/66/70/85/883667085.db2.gz HTPUXURAWAFTAN-HSZRJFAPSA-N 0 3 422.573 4.201 20 0 HIADHN COc1cc(Cl)c(C(=O)N[C@@H](CN(C)Cc2ccccc2)C(C)C)cc1OC ZINC000469505302 883755747 /nfs/dbraw/zinc/75/57/47/883755747.db2.gz RCQDMBCRAXQNQM-IBGZPJMESA-N 0 3 404.938 4.244 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N3CCS[C@@H](C)[C@@H]3c3ccccc3)cc2)CC1 ZINC000469552298 883811317 /nfs/dbraw/zinc/81/13/17/883811317.db2.gz QKOAEWOFNZJKHF-WMZHIEFXSA-N 0 3 409.599 4.147 20 0 HIADHN CCOc1cc(Cl)ccc1NC(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000469612959 883834779 /nfs/dbraw/zinc/83/47/79/883834779.db2.gz GXPVCUOEYBWABT-HZPDHXFCSA-N 0 3 409.958 4.092 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)Nc1ccc(O[C@@H]2CCOC2)cc1 ZINC000469648677 883848296 /nfs/dbraw/zinc/84/82/96/883848296.db2.gz CRKFPDQQTQBFHC-PKTZIBPZSA-N 0 3 411.546 4.132 20 0 HIADHN Cc1cc(C(=O)NC(C)C)ccc1NC(=O)N[C@H](CN(C)Cc1ccccc1)C(C)C ZINC000469656275 883852218 /nfs/dbraw/zinc/85/22/18/883852218.db2.gz OWAKQAPDTVPQJV-HSZRJFAPSA-N 0 3 424.589 4.411 20 0 HIADHN O=C(NCc1ccccc1-c1ccc(Cn2ccnc2)cc1)[C@@H]1CCCc2[nH]cnc21 ZINC000469663224 883857343 /nfs/dbraw/zinc/85/73/43/883857343.db2.gz VNKSZTUZVXILSI-JOCHJYFZSA-N 0 3 411.509 4.058 20 0 HIADHN O=C(CCN1CCN(c2ccccc2)CC1)Nc1ccc(COC2CCCC2)cc1 ZINC000469672478 883862654 /nfs/dbraw/zinc/86/26/54/883862654.db2.gz VBZAYTYFQFECOL-UHFFFAOYSA-N 0 3 407.558 4.297 20 0 HIADHN C[C@H](Oc1cccc2ccccc21)C(=O)NC1CCN([C@@H](C)c2ccncc2)CC1 ZINC000469692513 883873871 /nfs/dbraw/zinc/87/38/71/883873871.db2.gz ISURDYMSZCGNHQ-OALUTQOASA-N 0 3 403.526 4.344 20 0 HIADHN O=C1[C@@H](N2CCC(c3c[nH]c4ncccc34)CC2)CCCN1Cc1ccc(F)cc1F ZINC000469726475 883887811 /nfs/dbraw/zinc/88/78/11/883887811.db2.gz UHPDGSXDTZXXIG-QFIPXVFZSA-N 0 3 424.495 4.212 20 0 HIADHN Cc1cc(C(=O)Nc2cccc(N3CCN(CCc4ccccc4)CC3)c2)ns1 ZINC000469733997 883891937 /nfs/dbraw/zinc/89/19/37/883891937.db2.gz NPJWMJVPZQTKKQ-UHFFFAOYSA-N 0 3 406.555 4.069 20 0 HIADHN C[C@@H]1CCCCN1CCNC(=O)C(=O)Nc1ccc(F)cc1-c1ccc(Cl)cc1 ZINC000503660579 912765508 /nfs/dbraw/zinc/76/55/08/912765508.db2.gz XADQOULAOHDFKB-OAHLLOKOSA-N 0 3 417.912 4.075 20 0 HIADHN C[C@@H](CN1CCCCC1)NC(=O)C(=O)Nc1ccc(F)cc1-c1ccc(Cl)cc1 ZINC000503659873 912766433 /nfs/dbraw/zinc/76/64/33/912766433.db2.gz PJJGUMXPXFFLEJ-HNNXBMFYSA-N 0 3 417.912 4.075 20 0 HIADHN COc1ccc(NC(=O)N(CCN(C)C)Cc2ccccn2)cc1Cc1ccccc1 ZINC000503668420 912775270 /nfs/dbraw/zinc/77/52/70/912775270.db2.gz ATGQTCOFHAOOKX-UHFFFAOYSA-N 0 3 418.541 4.277 20 0 HIADHN CC(C)(C)OCc1ccccc1C(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000469840088 884021381 /nfs/dbraw/zinc/02/13/81/884021381.db2.gz GBWNJLBERRJMEN-JOCHJYFZSA-N 0 3 410.558 4.023 20 0 HIADHN Cc1c2cccc(Cl)c2oc1C(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000469853705 884038606 /nfs/dbraw/zinc/03/86/06/884038606.db2.gz KSDFRLSWWSKULG-SFHVURJKSA-N 0 3 412.917 4.416 20 0 HIADHN CCCN(C(=O)NCCC(=O)Nc1ccccc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000503679542 912786686 /nfs/dbraw/zinc/78/66/86/912786686.db2.gz KBKNGQHVEHGPFP-QHCPKHFHSA-N 0 3 422.573 4.101 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@H]2NC(=O)NC[C@@H]2CCCN2Cc2ccccc2)cc1 ZINC000470023864 884242988 /nfs/dbraw/zinc/24/29/88/884242988.db2.gz GINLYTNDHUOEKC-VXNXHJTFSA-N 0 3 407.558 4.179 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@H]2NC(=O)N(CCN(C)C)Cc2ccccc2F)cc1 ZINC000470029881 884260782 /nfs/dbraw/zinc/26/07/82/884260782.db2.gz NUYUVSNHGFUKPT-PKTZIBPZSA-N 0 3 413.537 4.128 20 0 HIADHN CC[C@H](CNC(=O)N1C[C@@H](C)O[C@@H](c2ccsc2)C1)N1CCc2ccccc2C1 ZINC000470038129 884276836 /nfs/dbraw/zinc/27/68/36/884276836.db2.gz ILGHEMDKUHUHLA-ZPMCFJSWSA-N 0 3 413.587 4.056 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@H](C)c1ccccc1-n1cccn1)c1ccsc1 ZINC000470040300 884280751 /nfs/dbraw/zinc/28/07/51/884280751.db2.gz BJKLJMBXVRSCGW-DYESRHJHSA-N 0 3 411.575 4.377 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)N1CC[C@H](c2c(F)cccc2F)C1 ZINC000470042082 884283923 /nfs/dbraw/zinc/28/39/23/884283923.db2.gz BOOICWTZHPAZFO-YJBOKZPZSA-N 0 3 405.514 4.362 20 0 HIADHN Cc1ccc([C@H]2OCCC[C@@H]2NC(=O)N(Cc2ccco2)C2CCN(C)CC2)cc1 ZINC000470043248 884285457 /nfs/dbraw/zinc/28/54/57/884285457.db2.gz HEYYJSRDZJKFMT-XZOQPEGZSA-N 0 3 411.546 4.114 20 0 HIADHN CC[C@@H](C)[C@H](NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1)C(F)(F)F ZINC000470122379 884383439 /nfs/dbraw/zinc/38/34/39/884383439.db2.gz NQYLQRXJYHTSHO-OFVDZJKFSA-N 0 3 403.411 4.068 20 0 HIADHN CCOc1cc(CN2CC[C@@H](C(F)(F)F)C2(C)C)ccc1O[C@H](C)C(=O)N(C)C ZINC000470130694 884394766 /nfs/dbraw/zinc/39/47/66/884394766.db2.gz DHOAEVPFLRSJAY-RDTXWAMCSA-N 0 3 416.484 4.104 20 0 HIADHN CCCCCn1cc(CNC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)c(C)n1 ZINC000503789246 912825108 /nfs/dbraw/zinc/82/51/08/912825108.db2.gz AUSBWDULRLITJA-FQEVSTJZSA-N 0 3 411.594 4.188 20 0 HIADHN COCC1(O)CCN(Cc2ccc(Oc3cccc(Br)c3)cc2)CC1 ZINC000470169754 884448550 /nfs/dbraw/zinc/44/85/50/884448550.db2.gz JEHNISXZOVOHBW-UHFFFAOYSA-N 0 3 406.320 4.215 20 0 HIADHN CC(C)(C)NC(=O)Nc1ccc(Cl)c(C(=O)NC[C@H]2CCCCN2C2CC2)c1 ZINC000470174105 884456569 /nfs/dbraw/zinc/45/65/69/884456569.db2.gz QKDRESYSDQDOGV-MRXNPFEDSA-N 0 3 406.958 4.007 20 0 HIADHN Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)N1CCCN([C@@H](C)CO)CC1 ZINC000470349025 884740713 /nfs/dbraw/zinc/74/07/13/884740713.db2.gz CWKDGRZHGDSRQT-VQTJNVASSA-N 0 3 411.546 4.055 20 0 HIADHN Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)N1CCCN([C@H](C)CO)CC1 ZINC000470349026 884741075 /nfs/dbraw/zinc/74/10/75/884741075.db2.gz CWKDGRZHGDSRQT-WOJBJXKFSA-N 0 3 411.546 4.055 20 0 HIADHN Cc1cc(-c2cccc(Cl)c2)ccc1NC(=O)N1CCCN([C@H](C)CO)CC1 ZINC000470352204 884745159 /nfs/dbraw/zinc/74/51/59/884745159.db2.gz OWDIKDQXCYGRMF-QGZVFWFLSA-N 0 3 401.938 4.236 20 0 HIADHN C[C@H](NCC(C)(C)S(=O)(=O)c1ccc(Br)cc1)c1ccc(F)cc1 ZINC000470438762 884836459 /nfs/dbraw/zinc/83/64/59/884836459.db2.gz OZNMTCSMPUUMCI-ZDUSSCGKSA-N 0 3 414.340 4.491 20 0 HIADHN Cc1ccc(NC(=O)C[C@H](C)N[C@@H](Cn2ccccc2=O)c2ccccc2)c(C)c1 ZINC000503927416 912868310 /nfs/dbraw/zinc/86/83/10/912868310.db2.gz PQUDFDJTWNRUSF-REWPJTCUSA-N 0 3 403.526 4.213 20 0 HIADHN C[C@H]1CN(C2CCOCC2)CCN1C(=O)CCCc1ccc2c(c1)-c1ccccc1C2 ZINC000470487127 884874792 /nfs/dbraw/zinc/87/47/92/884874792.db2.gz OZRLLWSNHXRHLK-FQEVSTJZSA-N 0 3 418.581 4.292 20 0 HIADHN COc1cc(C(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)ccc1OC(F)F ZINC000470654316 885075936 /nfs/dbraw/zinc/07/59/36/885075936.db2.gz QAVHMKRNQRXQSD-GOSISDBHSA-N 0 3 404.457 4.033 20 0 HIADHN CC(=O)CCc1ccc(OCCC(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000470658000 885080048 /nfs/dbraw/zinc/08/00/48/885080048.db2.gz PJPMDFIEOKGBEZ-DEOSSOPVSA-N 0 3 422.569 4.100 20 0 HIADHN Cc1oc(-c2ccccc2)nc1CC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470663027 885088690 /nfs/dbraw/zinc/08/86/90/885088690.db2.gz VFAKOSIKFHIDNS-JOCHJYFZSA-N 0 3 403.526 4.316 20 0 HIADHN Cc1cc(C(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)c(C)n1-c1nccs1 ZINC000470664596 885089924 /nfs/dbraw/zinc/08/99/24/885089924.db2.gz ZPBTYVVJBJPEEF-HXUWFJFHSA-N 0 3 408.571 4.287 20 0 HIADHN CN(C(=O)CCc1ncc(-c2ccccc2)o1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470665855 885094640 /nfs/dbraw/zinc/09/46/40/885094640.db2.gz DENPOBDKWCLCBE-QFIPXVFZSA-N 0 3 403.526 4.397 20 0 HIADHN CN(C(=O)NCc1cccc(OCC(F)F)c1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470720007 885164272 /nfs/dbraw/zinc/16/42/72/885164272.db2.gz NXNUHAWSJKNAEG-FQEVSTJZSA-N 0 3 417.500 4.137 20 0 HIADHN CCCCOc1ncccc1CNC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470725520 885175255 /nfs/dbraw/zinc/17/52/55/885175255.db2.gz ZDJYMCSOVABKLE-JOCHJYFZSA-N 0 3 410.562 4.067 20 0 HIADHN CN(C(=O)NCc1ccnc(OC2CCCC2)c1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470751733 885216116 /nfs/dbraw/zinc/21/61/16/885216116.db2.gz PJCSMDIQRUOLQG-QFIPXVFZSA-N 0 3 422.573 4.209 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)Cc2csc(-c3ccc(Cl)cc3)n2)o1 ZINC000504009906 912916137 /nfs/dbraw/zinc/91/61/37/912916137.db2.gz LWYYMCCVHLKOSQ-UHFFFAOYSA-N 0 3 417.962 4.498 20 0 HIADHN CN(C(=O)c1cnn(-c2ccccc2)c1C1CC1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470812357 885298591 /nfs/dbraw/zinc/29/85/91/885298591.db2.gz QPNGCARUPMIKRY-QHCPKHFHSA-N 0 3 414.553 4.486 20 0 HIADHN CCc1c(C(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)cnn1Cc1ccccc1 ZINC000470814301 885301871 /nfs/dbraw/zinc/30/18/71/885301871.db2.gz YRPJSWAKTRUGRZ-QHCPKHFHSA-N 0 3 416.569 4.230 20 0 HIADHN CN(Cc1cccc(Oc2ccccc2)c1)C[C@@H]1C[C@H](F)CN1Cc1ncccn1 ZINC000470812496 885303110 /nfs/dbraw/zinc/30/31/10/885303110.db2.gz PJALTQYKAIWDAQ-SFTDATJTSA-N 0 3 406.505 4.313 20 0 HIADHN COc1cccc(C(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)c1OC(F)F ZINC000470820979 885309545 /nfs/dbraw/zinc/30/95/45/885309545.db2.gz LIKJATNOOZKDTP-KRWDZBQOSA-N 0 3 404.457 4.033 20 0 HIADHN CC[C@@H]1CN(C[C@@H](O)COc2ccc(C(C)=O)cc2OC)CC[C@@H]1c1ccccc1 ZINC000470872747 885362790 /nfs/dbraw/zinc/36/27/90/885362790.db2.gz KPUHZAAOYUBLOS-PTUXOGIPSA-N 0 3 411.542 4.153 20 0 HIADHN C[C@@H]1CN(C(=O)NC[C@H](c2cccs2)N2CCCC2)C[C@H](c2ccsc2)O1 ZINC000470897080 885395236 /nfs/dbraw/zinc/39/52/36/885395236.db2.gz KCJFGQHGVMHJSP-KBAYOESNSA-N 0 3 405.589 4.118 20 0 HIADHN O=C1[C@@H](N2CCCCC[C@@H]2c2ccc(C(F)(F)F)cc2)CCN1C1CCOCC1 ZINC000471005108 885505559 /nfs/dbraw/zinc/50/55/59/885505559.db2.gz JSXIMUIFCLRQIS-UXHICEINSA-N 0 3 410.480 4.402 20 0 HIADHN COc1cc(-c2nnc(CN3CC[C@H](c4ccc(C)cc4C)C3)o2)cc(OC)c1OC ZINC000471009511 885513184 /nfs/dbraw/zinc/51/31/84/885513184.db2.gz VUHZJWPIVUAJAM-KRWDZBQOSA-N 0 3 423.513 4.369 20 0 HIADHN Cc1nc2cc(C(=O)Nc3ccnn3[C@@H]3CCN(Cc4ccccc4)C3)ccc2o1 ZINC000471052216 885566134 /nfs/dbraw/zinc/56/61/34/885566134.db2.gz JEESFAMNBRYHDP-LJQANCHMSA-N 0 3 401.470 4.032 20 0 HIADHN O=C(NCCCCOc1ccc(F)cc1)NC[C@@H](c1cccs1)N1CCCC1 ZINC000504049981 912958080 /nfs/dbraw/zinc/95/80/80/912958080.db2.gz FAKYCTILELHIOL-IBGZPJMESA-N 0 3 405.539 4.183 20 0 HIADHN Cc1noc(CSc2ccccc2C(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)n1 ZINC000471124533 885660929 /nfs/dbraw/zinc/66/09/29/885660929.db2.gz KXFIVFLBEXVSMV-VFNWGFHPSA-N 0 3 410.543 4.092 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3cc(C)c(F)cc3F)c(OCC)c2)CC1 ZINC000471172392 885731676 /nfs/dbraw/zinc/73/16/76/885731676.db2.gz INPFGWZIKNLJHI-UHFFFAOYSA-N 0 3 417.500 4.456 20 0 HIADHN CCN(CC)CCN(Cc1ccccc1)Cc1nc(=O)c2c3c(sc2[nH]1)CCC3 ZINC000471179185 885744714 /nfs/dbraw/zinc/74/47/14/885744714.db2.gz ROMPFPKZOHQWOP-UHFFFAOYSA-N 0 3 410.587 4.230 20 0 HIADHN CC(=O)Nc1cc(C(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)cc(C(F)(F)F)c1 ZINC000471333793 885936269 /nfs/dbraw/zinc/93/62/69/885936269.db2.gz ZLVJCEVHQAMRPY-KUHUBIRLSA-N 0 3 419.447 4.229 20 0 HIADHN C[C@@H](NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1ccc(F)cc1F ZINC000471492641 886192978 /nfs/dbraw/zinc/19/29/78/886192978.db2.gz UQQDJFHJCVIJNT-VCANKDNSSA-N 0 3 405.411 4.130 20 0 HIADHN Cc1cc(NC(=O)C(C)(C)C)sc1C(=O)N[C@H](C)[C@@H](c1ccccc1)N(C)C ZINC000471528071 886231540 /nfs/dbraw/zinc/23/15/40/886231540.db2.gz DEXNSGNJDANQOM-QAPCUYQASA-N 0 3 401.576 4.462 20 0 HIADHN Cc1cccc(NC(=O)N2CCC[C@H](C(=O)N[C@@H](C)[C@@H](c3ccccc3)N(C)C)C2)c1 ZINC000471530682 886234683 /nfs/dbraw/zinc/23/46/83/886234683.db2.gz LWLKDLWKYSXLTJ-RRPUWOKSSA-N 0 3 422.573 4.047 20 0 HIADHN O=C(NCc1ccc2ncccc2c1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000471533252 886238231 /nfs/dbraw/zinc/23/82/31/886238231.db2.gz UZZLPVNHFXMAHY-JOCHJYFZSA-N 0 3 413.443 4.306 20 0 HIADHN C[C@@H](NC(=O)c1cccc(NC(=O)c2ccc(F)cc2)c1)[C@@H](c1ccccc1)N(C)C ZINC000471538213 886242596 /nfs/dbraw/zinc/24/25/96/886242596.db2.gz HYRMSORBHIHBLN-HXOBKFHXSA-N 0 3 419.500 4.499 20 0 HIADHN COc1ccc([C@@H](NC(=O)N2CCN(C3CCCC3)CC2)c2ccc(F)cc2)cc1 ZINC000504117160 913023529 /nfs/dbraw/zinc/02/35/29/913023529.db2.gz FBCQUSMKIRWUDN-QHCPKHFHSA-N 0 3 411.521 4.194 20 0 HIADHN C[C@@H](NC(=O)CCSc1ccc2c(c1)OCCCO2)[C@H](c1ccccc1)N(C)C ZINC000471564610 886274220 /nfs/dbraw/zinc/27/42/20/886274220.db2.gz UFIKUQXUISCQNL-UZUQRXQVSA-N 0 3 414.571 4.138 20 0 HIADHN CCCOc1ccc(CNC(=O)Nc2cccc(CN(C)C)c2)c(OC(F)F)c1 ZINC000471568256 886278442 /nfs/dbraw/zinc/27/84/42/886278442.db2.gz XDVQIDURSANPDH-UHFFFAOYSA-N 0 3 407.461 4.460 20 0 HIADHN C[C@H](Oc1ccccc1Br)C(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C ZINC000471569495 886279497 /nfs/dbraw/zinc/27/94/97/886279497.db2.gz HOJNGFTZORDMAN-YZVOILCLSA-N 0 3 405.336 4.024 20 0 HIADHN C[C@@H](CCCCN1C(=O)c2ccccc2C1=O)NCc1ncoc1-c1ccccc1 ZINC000471599287 886313535 /nfs/dbraw/zinc/31/35/35/886313535.db2.gz QFEFOTLSAMXSLX-KRWDZBQOSA-N 0 3 403.482 4.286 20 0 HIADHN C[C@@H](NC(=O)N[C@H]1C[C@@H]1c1ccccc1OC(F)F)[C@@H](c1ccccc1)N(C)C ZINC000504126323 913030773 /nfs/dbraw/zinc/03/07/73/913030773.db2.gz WOJWAEURQHVEBJ-QKUWSGOFSA-N 0 3 403.473 4.135 20 0 HIADHN CCOc1ccc(C(F)(F)F)cc1NC(=O)N(CCN(C)C)Cc1ccccn1 ZINC000504127066 913031064 /nfs/dbraw/zinc/03/10/64/913031064.db2.gz VCXAQBZGLSYHAT-UHFFFAOYSA-N 0 3 410.440 4.095 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)CCCc3ncc(-c4ccccc4)o3)c2)CC1 ZINC000471622105 886339361 /nfs/dbraw/zinc/33/93/61/886339361.db2.gz QYMWGYUURBYRPG-UHFFFAOYSA-N 0 3 418.541 4.445 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)[C@@H](C)c3ccc(Br)cc3)c2)CC1 ZINC000471662040 886374837 /nfs/dbraw/zinc/37/48/37/886374837.db2.gz ASXIMWHSTOKFOC-INIZCTEOSA-N 0 3 416.363 4.333 20 0 HIADHN Cc1ccc([C@@H](NC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)c2ccccn2)cc1 ZINC000471677965 886388488 /nfs/dbraw/zinc/38/84/88/886388488.db2.gz JKNQASRXSDKBPA-UKILVPOCSA-N 0 3 414.553 4.443 20 0 HIADHN CCOc1cccc([C@@H](C)NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)c1 ZINC000471759529 886491411 /nfs/dbraw/zinc/49/14/11/886491411.db2.gz NKODRTQBIDACPK-RWBZWWBESA-N 0 3 413.484 4.251 20 0 HIADHN Cc1cnccc1NC(=O)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000504162797 913053193 /nfs/dbraw/zinc/05/31/93/913053193.db2.gz NLVDNSKEJPVWTB-UHFFFAOYSA-N 0 3 407.345 4.249 20 0 HIADHN COc1ccccc1C(C)(C)NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000471805407 886542528 /nfs/dbraw/zinc/54/25/28/886542528.db2.gz RFXCQBUGOUTETO-UHFFFAOYSA-N 0 3 413.484 4.035 20 0 HIADHN O=C(c1cccc(CN2CCCC2)c1)N1CCOC[C@H]1c1nc2ccccc2s1 ZINC000504175545 913059510 /nfs/dbraw/zinc/05/95/10/913059510.db2.gz COPRNAHVJZOVER-FQEVSTJZSA-N 0 3 407.539 4.106 20 0 HIADHN Cc1ccc([C@H](NC(=O)NC[C@H](C)N(C)Cc2ccccc2)c2ccccn2)cc1 ZINC000471852332 886620702 /nfs/dbraw/zinc/62/07/02/886620702.db2.gz VIOFKVIJDBCCPN-RDPSFJRHSA-N 0 3 402.542 4.299 20 0 HIADHN Cc1sc(CNC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)nc1C(C)C ZINC000471852393 886620853 /nfs/dbraw/zinc/62/08/53/886620853.db2.gz VXORYHYYDDKBTG-UHFFFAOYSA-N 0 3 418.529 4.179 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2nnc(Cc3cccc(F)c3)s2)N(C)C)cc1 ZINC000504189612 913073387 /nfs/dbraw/zinc/07/33/87/913073387.db2.gz KLZABQIXOBWQHU-GOSISDBHSA-N 0 3 413.522 4.001 20 0 HIADHN CCCc1cccc(C(C)C)c1NC(=O)N1CC[C@@H](N2CCN(C)CC2)[C@@H](C)C1 ZINC000471922370 886712938 /nfs/dbraw/zinc/71/29/38/886712938.db2.gz YJGFQKZVGALEGL-SIKLNZKXSA-N 0 3 400.611 4.252 20 0 HIADHN Cc1cc(Br)c(F)cc1NC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000471942557 886743090 /nfs/dbraw/zinc/74/30/90/886743090.db2.gz GAILAZCMBVRANX-FUHWJXTLSA-N 0 3 406.299 4.464 20 0 HIADHN Cc1ccnc(-n2nccc2NC(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)c1 ZINC000471945085 886746497 /nfs/dbraw/zinc/74/64/97/886746497.db2.gz VIFOTTRKOWUPKT-SFHVURJKSA-N 0 3 424.574 4.232 20 0 HIADHN Cc1cc(C)n(-c2ccccc2CNC(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)n1 ZINC000471976232 886806845 /nfs/dbraw/zinc/80/68/45/886806845.db2.gz HUOSQHWZHBACNP-REWPJTCUSA-N 0 3 417.557 4.124 20 0 HIADHN COc1cc(NC(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)ccc1Br ZINC000471983306 886810973 /nfs/dbraw/zinc/81/09/73/886810973.db2.gz HXHBVZCSJVEGEN-SJLPKXTDSA-N 0 3 404.308 4.025 20 0 HIADHN CCn1nc(CN[C@H]2CCN(CC)[C@H]2c2cc(F)c(F)c(F)c2)c2ccccc21 ZINC000472041990 886859372 /nfs/dbraw/zinc/85/93/72/886859372.db2.gz BFNIVUKZLKOVOQ-AVRDEDQJSA-N 0 3 402.464 4.399 20 0 HIADHN CC(C)c1cccc(O[C@H](C(=O)N[C@H](C)CCN2CCN(C)CC2)c2ccccc2)c1 ZINC000472084360 886884443 /nfs/dbraw/zinc/88/44/43/886884443.db2.gz APHUWDPIQLXGKK-BWKNWUBXSA-N 0 3 423.601 4.072 20 0 HIADHN CCC(CC)[C@H]1C[C@H](NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)CCO1 ZINC000472131712 886922913 /nfs/dbraw/zinc/92/29/13/886922913.db2.gz CDZKJZMTJNWCNH-LWSMDNFKSA-N 0 3 419.532 4.075 20 0 HIADHN CC1CCN([C@@H](CNC(=O)N2CCO[C@@H](c3cccs3)C2)c2cccs2)CC1 ZINC000472149405 886949267 /nfs/dbraw/zinc/94/92/67/886949267.db2.gz CPEMWQVSOOOZTE-ZWKOTPCHSA-N 0 3 419.616 4.366 20 0 HIADHN Cn1nc(C(F)F)c2cc(C(=O)N(Cc3ccccc3)C3CCN(C)CC3)sc21 ZINC000472264739 887078386 /nfs/dbraw/zinc/07/83/86/887078386.db2.gz YIZXWJOVGZCSRA-UHFFFAOYSA-N 0 3 418.513 4.309 20 0 HIADHN O=C(NC[C@H]1CCCCN1CCCc1nc(-c2cccs2)no1)c1ccccc1 ZINC000472268432 887083598 /nfs/dbraw/zinc/08/35/98/887083598.db2.gz GZCDYHWFOVYGEX-GOSISDBHSA-N 0 3 410.543 4.015 20 0 HIADHN Cc1cccc(-c2cccc(CNC(=O)N(CCN(C)C)Cc3ccccn3)c2)c1 ZINC000504247353 913114379 /nfs/dbraw/zinc/11/43/79/913114379.db2.gz NWNFMCGPMIVWPW-UHFFFAOYSA-N 0 3 402.542 4.330 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2cccc(OCc3cscn3)c2)[C@@H]1c1ccccc1 ZINC000472304258 887127895 /nfs/dbraw/zinc/12/78/95/887127895.db2.gz HCXXQAOGVQFRDL-SFTDATJTSA-N 0 3 408.527 4.289 20 0 HIADHN CC(C)c1noc(-c2ccc(NC(=O)N[C@H]3CCN(C)[C@@H]3c3ccccc3)cc2)n1 ZINC000472307578 887133466 /nfs/dbraw/zinc/13/34/66/887133466.db2.gz XXTHIZKISWOOIC-VQTJNVASSA-N 0 3 405.502 4.427 20 0 HIADHN Cc1c2cc(F)ccc2oc1S(=O)(=O)N(C)C[C@@H]1CCN(Cc2ccccc2)C1 ZINC000472312447 887141934 /nfs/dbraw/zinc/14/19/34/887141934.db2.gz JZWVRJRWILZFRS-SFHVURJKSA-N 0 3 416.518 4.023 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)c(C)c1 ZINC000472333487 887169235 /nfs/dbraw/zinc/16/92/35/887169235.db2.gz CRDDPRYUISZCLG-MTNREXPMSA-N 0 3 408.546 4.090 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2cccc(NC(=O)c3ccoc3)c2)[C@@H]1c1ccccc1 ZINC000472334406 887171167 /nfs/dbraw/zinc/17/11/67/887171167.db2.gz IILLSCOJBBIMCV-RTWAWAEBSA-N 0 3 404.470 4.099 20 0 HIADHN Cc1cc(-c2noc([C@@H](C)NC(=O)c3cccc(CN4CCCC4)c3)n2)ccc1F ZINC000472393862 887239783 /nfs/dbraw/zinc/23/97/83/887239783.db2.gz IQNXRUMPMROLMZ-MRXNPFEDSA-N 0 3 408.477 4.271 20 0 HIADHN CCC1(CC)[C@@H](OC)C[C@@H]1N(C)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472454470 887307097 /nfs/dbraw/zinc/30/70/97/887307097.db2.gz HMMIPDKKUHAQQV-FOIPXRHGSA-N 0 3 419.532 4.027 20 0 HIADHN C[C@@H]1c2ccsc2CCN1C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472470224 887330933 /nfs/dbraw/zinc/33/09/33/887330933.db2.gz ZVEWSSYHBHRKPD-LRVUVFPRSA-N 0 3 401.498 4.182 20 0 HIADHN Cc1ccc([C@@H](NC(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)c2ccccn2)cc1 ZINC000472490756 887357672 /nfs/dbraw/zinc/35/76/72/887357672.db2.gz ZSZWQCUTMDPSRO-ILBGXUMGSA-N 0 3 414.553 4.395 20 0 HIADHN CN(C(=O)N[C@H]1CC[C@@H](c2ccc(F)cc2)C1)C1CCN(CCc2ccccn2)CC1 ZINC000472544673 887423633 /nfs/dbraw/zinc/42/36/33/887423633.db2.gz FZICIGVMQJPULL-OFNKIYASSA-N 0 3 424.564 4.205 20 0 HIADHN CCN1CCC[C@@H](CN(C)C(=O)c2cc(F)ccc2-c2ccoc2)[C@@H]1c1cnn(C)c1 ZINC000472573663 887458417 /nfs/dbraw/zinc/45/84/17/887458417.db2.gz IZIJYHAHWVHWOK-GAJHUEQPSA-N 0 3 424.520 4.364 20 0 HIADHN CN(C(=O)Nc1cccc(OC[C@H]2CCCO2)c1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000472687351 887541438 /nfs/dbraw/zinc/54/14/38/887541438.db2.gz YULVJTJQWKSZFS-ISKFKSNPSA-N 0 3 423.557 4.373 20 0 HIADHN CN(C(=O)Nc1ccc(-c2csnn2)cc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000472688485 887543666 /nfs/dbraw/zinc/54/36/66/887543666.db2.gz QATVTJBCGJKTJR-HXUWFJFHSA-N 0 3 407.543 4.333 20 0 HIADHN Cc1cc(NC(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)ccc1C(=O)NC(C)C ZINC000472740897 887586055 /nfs/dbraw/zinc/58/60/55/887586055.db2.gz YXLBZPQNZZJHLO-JOCHJYFZSA-N 0 3 422.573 4.262 20 0 HIADHN COC[C@H](NC(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1)c1ccc(C)o1 ZINC000472819253 887663838 /nfs/dbraw/zinc/66/38/38/887663838.db2.gz ZRIXRVXYHOKNHS-ROUUACIJSA-N 0 3 405.564 4.109 20 0 HIADHN c1csc([C@H]2CN(CCCCCN3CCO[C@H](c4cccs4)C3)CCO2)c1 ZINC000472826050 887672218 /nfs/dbraw/zinc/67/22/18/887672218.db2.gz GCYOHLSJTDEIFB-KDURUIRLSA-N 0 3 406.617 4.427 20 0 HIADHN C[C@@H](NC(=O)N(CCN(C)C)Cc1ccc(Br)cc1)c1ccccc1 ZINC000504331467 913173880 /nfs/dbraw/zinc/17/38/80/913173880.db2.gz HHMPPLIYFQZBAF-MRXNPFEDSA-N 0 3 404.352 4.284 20 0 HIADHN C[C@@H](CNC(=O)Nc1ccc(F)cc1-c1nc(C2CC2)no1)N(C)Cc1ccccc1 ZINC000472904142 887750695 /nfs/dbraw/zinc/75/06/95/887750695.db2.gz LSIIRWQJZSJQOM-HNNXBMFYSA-N 0 3 423.492 4.395 20 0 HIADHN O=C(N[C@H]1CCOc2c(Br)cccc21)c1cccc(CN2CCCC2)c1 ZINC000504332149 913175529 /nfs/dbraw/zinc/17/55/29/913175529.db2.gz OCEFMPWNZHOTGV-IBGZPJMESA-N 0 3 415.331 4.299 20 0 HIADHN O=C(N1CCO[C@@H](c2cccs2)C1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000473181730 887961579 /nfs/dbraw/zinc/96/15/79/887961579.db2.gz JQYXVHOZZMKBBT-XLIONFOSSA-N 0 3 424.488 4.103 20 0 HIADHN O=C(N1CCO[C@@H](c2cccs2)C1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000473181732 887962168 /nfs/dbraw/zinc/96/21/68/887962168.db2.gz JQYXVHOZZMKBBT-YLJYHZDGSA-N 0 3 424.488 4.103 20 0 HIADHN Cc1c(F)c(C(F)(F)F)ccc1C(=O)N1CCC(CN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000473185758 887965042 /nfs/dbraw/zinc/96/50/42/887965042.db2.gz YDBSNQKWHLZKGS-KBPBESRZSA-N 0 3 416.459 4.114 20 0 HIADHN C[C@H](CC(=O)c1ccccc1F)C(=O)NC1[C@H](C)CN(Cc2ccccc2)C[C@H]1C ZINC000473277004 888033124 /nfs/dbraw/zinc/03/31/24/888033124.db2.gz NAPGGLRUAOLGLY-GUDVDZBRSA-N 0 3 410.533 4.307 20 0 HIADHN CCOc1ccc(C(=O)CCC(=O)N[C@H]2[C@H](C)CN(Cc3ccccc3)C[C@@H]2C)cc1 ZINC000473284321 888040017 /nfs/dbraw/zinc/04/00/17/888040017.db2.gz QOMHMLJGODSHJA-WAQNLRHXSA-N 0 3 422.569 4.321 20 0 HIADHN Cc1cc(C(=O)NCCCCN2CCN(c3cccc(C)c3)CC2)c(C(F)(F)F)o1 ZINC000473502800 888230253 /nfs/dbraw/zinc/23/02/53/888230253.db2.gz CEFSLRUWMWZOOS-UHFFFAOYSA-N 0 3 423.479 4.247 20 0 HIADHN CCOc1ccc2cc(C(=O)NC3CC(N4CCC(C(F)(F)F)CC4)C3)[nH]c2c1 ZINC000473509834 888239339 /nfs/dbraw/zinc/23/93/39/888239339.db2.gz DIWLJSHSHDGZRX-UHFFFAOYSA-N 0 3 409.452 4.102 20 0 HIADHN C[C@@H](Cc1ccc(Cl)cc1)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473516306 888247043 /nfs/dbraw/zinc/24/70/43/888247043.db2.gz AGHXCHZTTNYZGZ-TZYSRNFLSA-N 0 3 402.888 4.440 20 0 HIADHN CC[C@H](Sc1ccccc1)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473522690 888258849 /nfs/dbraw/zinc/25/88/49/888258849.db2.gz LNXJXWHHDMFBQY-HTWSVDAQSA-N 0 3 400.510 4.479 20 0 HIADHN Cc1ccc(S[C@H](C)C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cc1 ZINC000473530842 888268129 /nfs/dbraw/zinc/26/81/29/888268129.db2.gz XSNAXOBKEWSVHB-ODIFPOPNSA-N 0 3 400.510 4.397 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1cccc(Oc2ccncc2)c1 ZINC000473536471 888274347 /nfs/dbraw/zinc/27/43/47/888274347.db2.gz WKFLHWDOBOITMF-UHFFFAOYSA-N 0 3 419.447 4.409 20 0 HIADHN CCc1nc2cc(CNC(=O)NC[C@H](N[C@@H](C)CC)c3ccco3)ccc2n1C1CC1 ZINC000504417824 913234355 /nfs/dbraw/zinc/23/43/55/913234355.db2.gz FNEOBVQISFNCGB-JXFKEZNVSA-N 0 3 423.561 4.455 20 0 HIADHN Cc1nc(CC2CC2)sc1C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000473604976 888349052 /nfs/dbraw/zinc/34/90/52/888349052.db2.gz AFASSHPJCAONON-UHFFFAOYSA-N 0 3 401.601 4.248 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)NCc1cccc(Oc2ccccc2)c1 ZINC000504429068 913242110 /nfs/dbraw/zinc/24/21/10/913242110.db2.gz JDTDDCBMLYDRFS-UHFFFAOYSA-N 0 3 404.514 4.147 20 0 HIADHN Cc1cc(C)cc(Oc2ccc(NC(=O)N[C@H](C)CCN3CCN(C)CC3)cc2)c1 ZINC000473662716 888416033 /nfs/dbraw/zinc/41/60/33/888416033.db2.gz IPJDTLQOFQCAPH-HXUWFJFHSA-N 0 3 410.562 4.243 20 0 HIADHN Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)N[C@@H](C)CCN1CCN(C)CC1 ZINC000473668184 888425225 /nfs/dbraw/zinc/42/52/25/888425225.db2.gz ZQOBNFVDALLTKF-SFTDATJTSA-N 0 3 424.589 4.283 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N[C@H]1C[C@H](c2ccc(OC)c(F)c2)C1)c1ccco1 ZINC000504433446 913245610 /nfs/dbraw/zinc/24/56/10/913245610.db2.gz IIQYNOXYHVSTMY-PCODUJHASA-N 0 3 403.498 4.102 20 0 HIADHN CCSc1nnc(NC(=O)N(CC)[C@@H]2CCN([C@@H](C)c3ccccc3)C2)s1 ZINC000473683169 888453206 /nfs/dbraw/zinc/45/32/06/888453206.db2.gz QEWZIWXXTWIWQR-GOEBONIOSA-N 0 3 405.593 4.339 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cc(=O)[nH]c(C2CC2)c1)c1ccc(C(F)(F)F)cc1 ZINC000473768869 888565158 /nfs/dbraw/zinc/56/51/58/888565158.db2.gz XMCVDINUKUENMC-IBGZPJMESA-N 0 3 421.463 4.496 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CCC(Oc4ccc(C)cc4)CC3)c2)CC1 ZINC000473819385 888648694 /nfs/dbraw/zinc/64/86/94/888648694.db2.gz NKYMLYHXGQUJHS-UHFFFAOYSA-N 0 3 422.573 4.212 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@@H]3CCSc4ccc(F)cc43)c2)CC1 ZINC000473823864 888657036 /nfs/dbraw/zinc/65/70/36/888657036.db2.gz XUPIGMPEBYOWHD-HXUWFJFHSA-N 0 3 414.550 4.326 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)NCc3cc(F)ccc3SC)c2)CC1 ZINC000473828602 888661573 /nfs/dbraw/zinc/66/15/73/888661573.db2.gz XTRCXZUTLZQPMR-UHFFFAOYSA-N 0 3 402.539 4.011 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CC[C@@H](c4ccccc4)[C@@H](C)C3)c2)CC1 ZINC000473832770 888668839 /nfs/dbraw/zinc/66/88/39/888668839.db2.gz AFDVTMGMLXDLOC-GBXCKJPGSA-N 0 3 406.574 4.486 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N(C)Cc3ccccc3N3CCCC3)c2)CC1 ZINC000473833957 888670486 /nfs/dbraw/zinc/67/04/86/888670486.db2.gz YSBVKQJTBWHKPK-UHFFFAOYSA-N 0 3 421.589 4.093 20 0 HIADHN C[C@H](NC(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1)c1cc2cccc(F)c2o1 ZINC000473863294 888717881 /nfs/dbraw/zinc/71/78/81/888717881.db2.gz ISOVHLLZKTZLLU-BBWFWOEESA-N 0 3 417.525 4.164 20 0 HIADHN O=C(N[C@@H](c1cccc(Cl)c1)c1ccccn1)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000473880792 888748357 /nfs/dbraw/zinc/74/83/57/888748357.db2.gz BQRUWGSAFSIBJZ-GGAORHGYSA-N 0 3 420.944 4.398 20 0 HIADHN CCCc1ccc([C@@H](NC(=O)NC(C)(C)CCN2CCN(C)CC2)C(C)C)cc1 ZINC000473900817 888776449 /nfs/dbraw/zinc/77/64/49/888776449.db2.gz ILFTZHZKQMVCKA-QFIPXVFZSA-N 0 3 402.627 4.052 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3ccc(C(F)(F)F)c(F)c3)CC2)C[C@@H](C)O1 ZINC000473923162 888803821 /nfs/dbraw/zinc/80/38/21/888803821.db2.gz YDFYUTMDGFJCCW-HUUCEWRRSA-N 0 3 416.459 4.196 20 0 HIADHN C[C@@H](NC(=O)NC[C@H](c1ccccc1)N1CCCC1)c1ccc(Br)cn1 ZINC000473967425 888835202 /nfs/dbraw/zinc/83/52/02/888835202.db2.gz YLULORIHDIVEMF-DNVCBOLYSA-N 0 3 417.351 4.041 20 0 HIADHN C[C@H](NC(=O)NC[C@H](c1ccccc1)N1CCCC1)c1ccc(Br)cn1 ZINC000473967426 888835333 /nfs/dbraw/zinc/83/53/33/888835333.db2.gz YLULORIHDIVEMF-HNAYVOBHSA-N 0 3 417.351 4.041 20 0 HIADHN O=C(Nc1ccc(OC2CCCC2)cc1)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1CO ZINC000473975285 888840746 /nfs/dbraw/zinc/84/07/46/888840746.db2.gz NSKIMMAXIKQNCL-GBXCKJPGSA-N 0 3 423.557 4.013 20 0 HIADHN COc1ccc(CN[C@H]2CCN(c3ccc(Cl)cc3Cl)C2)c(OC)c1OC ZINC000473989720 888851639 /nfs/dbraw/zinc/85/16/39/888851639.db2.gz MDNUXUUALPZNID-HNNXBMFYSA-N 0 3 411.329 4.388 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1)c1ccc(Br)cn1 ZINC000474180836 889020760 /nfs/dbraw/zinc/02/07/60/889020760.db2.gz FWLKVUACIOQRAC-RLFYNMQTSA-N 0 3 417.351 4.040 20 0 HIADHN CCOC(=O)c1nc(-c2ccccc2)oc1CN(C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000474241931 889089568 /nfs/dbraw/zinc/08/95/68/889089568.db2.gz YBHUKVPSFOZVMX-NRFANRHFSA-N 0 3 419.525 4.225 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)C2(c3ccc(C(F)(F)F)cc3)CC2)CC1 ZINC000474249720 889099264 /nfs/dbraw/zinc/09/92/64/889099264.db2.gz MWHMXNOUKBEILM-INIZCTEOSA-N 0 3 417.475 4.474 20 0 HIADHN Cn1cc(-c2ncc(CN3CCC(c4ccccc4C(F)(F)F)CC3)cn2)cn1 ZINC000474257246 889113711 /nfs/dbraw/zinc/11/37/11/889113711.db2.gz COUKSBXMFJDHFJ-UHFFFAOYSA-N 0 3 401.436 4.276 20 0 HIADHN Cn1c2ccc(CN3CCC[C@@H](c4nc(-c5cccc(F)c5)no4)C3)cc2sc1=O ZINC000474274221 889138279 /nfs/dbraw/zinc/13/82/79/889138279.db2.gz SHFDFCJSZTUOPF-MRXNPFEDSA-N 0 3 424.501 4.169 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cc(O)ccc3C(F)(F)F)c(C)c2)CC1 ZINC000474287284 889152728 /nfs/dbraw/zinc/15/27/28/889152728.db2.gz GKNKGEXLXISGOB-UHFFFAOYSA-N 0 3 407.436 4.114 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cc4c([nH]3)c(F)ccc4OC)c(C)c2)CC1 ZINC000474289017 889155250 /nfs/dbraw/zinc/15/52/50/889155250.db2.gz LXLFTRBTKNYMBI-UHFFFAOYSA-N 0 3 410.493 4.018 20 0 HIADHN CN(C(=O)Nc1cc(C2CC2)nn1-c1ccccc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000474338236 889210786 /nfs/dbraw/zinc/21/07/86/889210786.db2.gz RLAQPCFFGFYEIX-QFIPXVFZSA-N 0 3 415.541 4.488 20 0 HIADHN COc1ccc2nc(CNC[C@@H](CO)Cc3ccccc3C(F)(F)F)sc2c1 ZINC000474366976 889245825 /nfs/dbraw/zinc/24/58/25/889245825.db2.gz GMZIXTNAJNBWFN-ZDUSSCGKSA-N 0 3 410.461 4.265 20 0 HIADHN CCCCc1oc2ccccc2c1CN1CCC(S(=O)(=O)N2CCCC2)CC1 ZINC000504552137 913326892 /nfs/dbraw/zinc/32/68/92/913326892.db2.gz ACEBPOJTDIKLSQ-UHFFFAOYSA-N 0 3 404.576 4.165 20 0 HIADHN CCN(CC)[C@H](CNC(=O)[C@H]1CCc2nc(C(C)C)[nH]c2C1)c1ccccc1Cl ZINC000474416463 889280612 /nfs/dbraw/zinc/28/06/12/889280612.db2.gz UTZCJWQNUXFIMQ-HRAATJIYSA-N 0 3 416.997 4.491 20 0 HIADHN CCN(CC)[C@H](CNC(=O)[C@H]1CCc2[nH]c(C(C)C)nc2C1)c1ccccc1Cl ZINC000474416463 889280616 /nfs/dbraw/zinc/28/06/16/889280616.db2.gz UTZCJWQNUXFIMQ-HRAATJIYSA-N 0 3 416.997 4.491 20 0 HIADHN Cc1cc(Oc2ncccn2)ccc1NC(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C ZINC000474427372 889291938 /nfs/dbraw/zinc/29/19/38/889291938.db2.gz AJSIGEJADDEZKR-LAUBAEHRSA-N 0 3 405.502 4.390 20 0 HIADHN CC(C)c1nc2c([nH]1)CC[C@H](C(=O)N[C@@H](c1ccccc1)c1ccc3nc[nH]c3c1)C2 ZINC000474428540 889292338 /nfs/dbraw/zinc/29/23/38/889292338.db2.gz UUQWUBIJTAITLY-MBSDFSHPSA-N 0 3 413.525 4.420 20 0 HIADHN COc1ccc([C@H](C)N[C@H]2CCN([C@@H](C(=O)OC(C)(C)C)c3ccccc3)C2=O)cc1 ZINC000474433816 889299494 /nfs/dbraw/zinc/29/94/94/889299494.db2.gz QQFMTPFDENZAGC-BULFRSBZSA-N 0 3 424.541 4.030 20 0 HIADHN CCN(C(=O)c1cccc(-c2n[nH]c(C)n2)c1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000474521105 889389045 /nfs/dbraw/zinc/38/90/45/889389045.db2.gz OXHYWTXVESMBEQ-VGSWGCGISA-N 0 3 403.530 4.078 20 0 HIADHN C[C@H](NC(=O)N(CCCc1ccccc1)CCN(C)C)c1noc(-c2ccccc2)n1 ZINC000474524001 889394533 /nfs/dbraw/zinc/39/45/33/889394533.db2.gz QWYXTERKLHBIQA-IBGZPJMESA-N 0 3 421.545 4.004 20 0 HIADHN C[C@@H](NC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1)c1noc(-c2ccccc2)n1 ZINC000474527165 889398807 /nfs/dbraw/zinc/39/88/07/889398807.db2.gz VBAHHWUFXVZJIH-WIYYLYMNSA-N 0 3 419.529 4.104 20 0 HIADHN C[C@@H](NC(=O)N(Cc1ccccc1)C1CCN(C)CC1)c1noc(-c2ccccc2)n1 ZINC000474528705 889400518 /nfs/dbraw/zinc/40/05/18/889400518.db2.gz RMOJTLMFUKWUTN-GOSISDBHSA-N 0 3 419.529 4.104 20 0 HIADHN C[C@H]1CCN(C(=O)c2ccc3nc(C(F)(F)F)cn3c2)CCN1Cc1ccccc1 ZINC000474559383 889435781 /nfs/dbraw/zinc/43/57/81/889435781.db2.gz QKSMSVNLGZIQFY-INIZCTEOSA-N 0 3 416.447 4.090 20 0 HIADHN Cn1cc(-c2ncc(CNC3(c4ccc(Br)cc4)CCCC3)cn2)cn1 ZINC000474601925 889470615 /nfs/dbraw/zinc/47/06/15/889470615.db2.gz SADDCEVZEORHNG-UHFFFAOYSA-N 0 3 412.335 4.199 20 0 HIADHN CCOC(=O)c1coc(CNC2CCN(Cc3cccc(C(F)(F)F)c3)CC2)c1 ZINC000474605627 889473419 /nfs/dbraw/zinc/47/34/19/889473419.db2.gz ZYBQOGIXSAGRFI-UHFFFAOYSA-N 0 3 410.436 4.229 20 0 HIADHN Cc1cc(N2CCSCC2)ccc1NC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000474616701 889480425 /nfs/dbraw/zinc/48/04/25/889480425.db2.gz NWVZUUDKRVGSBL-JOCHJYFZSA-N 0 3 424.614 4.286 20 0 HIADHN CN(C(=O)Nc1c(F)cc(Br)cc1F)[C@H]1CCN(Cc2ccccc2)C1 ZINC000474620998 889484520 /nfs/dbraw/zinc/48/45/20/889484520.db2.gz VOLATQOONUEOMH-HNNXBMFYSA-N 0 3 424.289 4.466 20 0 HIADHN CC(C)n1cnnc1-c1ccccc1NC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000474621396 889485729 /nfs/dbraw/zinc/48/57/29/889485729.db2.gz QOACMCSCOLVADW-HXUWFJFHSA-N 0 3 418.545 4.264 20 0 HIADHN COc1ccc(NC(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)c(Br)c1 ZINC000474628233 889491209 /nfs/dbraw/zinc/49/12/09/889491209.db2.gz IZLXZZYVKWDFJS-INIZCTEOSA-N 0 3 418.335 4.196 20 0 HIADHN CC[C@@H](C)NC(=O)c1ccc(NC(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)c(C)c1 ZINC000474729372 889584794 /nfs/dbraw/zinc/58/47/94/889584794.db2.gz GJGHJUAXVREISJ-DENIHFKCSA-N 0 3 422.573 4.262 20 0 HIADHN CN(C)[C@H](CNC(=O)c1ccc(NC(=O)Nc2ccccc2)s1)Cc1ccccc1 ZINC000474768432 889625385 /nfs/dbraw/zinc/62/53/85/889625385.db2.gz RCIXHCZUXUOUKU-IBGZPJMESA-N 0 3 422.554 4.295 20 0 HIADHN COc1cc(C)c(NC(=O)[C@H]2CN(Cc3ccccc3)CCC2(F)F)cc1OC ZINC000504618578 913372916 /nfs/dbraw/zinc/37/29/16/913372916.db2.gz DEIYNKXGVOFYCL-QGZVFWFLSA-N 0 3 404.457 4.108 20 0 HIADHN COc1ccc([C@@H](C)[C@H](C)NCc2nnc3ccc(C(F)(F)F)cn32)cc1OC ZINC000474893391 889750498 /nfs/dbraw/zinc/75/04/98/889750498.db2.gz NLBKWMAIPLVPHO-STQMWFEESA-N 0 3 408.424 4.047 20 0 HIADHN O=C(Nc1ccc(-c2ncc[nH]2)cc1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000504628309 913381431 /nfs/dbraw/zinc/38/14/31/913381431.db2.gz KAJWPXRVAVSHAA-NRFANRHFSA-N 0 3 414.431 4.470 20 0 HIADHN CN(C)Cc1ccnc(NCc2ccc(OC(F)(F)F)c(Br)c2)c1 ZINC000474937106 889794223 /nfs/dbraw/zinc/79/42/23/889794223.db2.gz PNFPGAWTQUPBCB-UHFFFAOYSA-N 0 3 404.230 4.416 20 0 HIADHN C[C@H](O)CCCN(Cc1ccco1)C[C@@H](O)Cn1c2ccccc2c2ccccc21 ZINC000474954170 889809878 /nfs/dbraw/zinc/80/98/78/889809878.db2.gz JOZMRQYQUQXQSW-VQTJNVASSA-N 0 3 406.526 4.412 20 0 HIADHN CCN(C(=O)Nc1cc2c(cc1Cl)OCO2)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475003991 889855978 /nfs/dbraw/zinc/85/59/78/889855978.db2.gz SWYLNWUXZRZCHV-MRXNPFEDSA-N 0 3 401.894 4.197 20 0 HIADHN CCN(C(=O)N[C@@H](c1ccc(OC)cc1)C1CC1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475006883 889858891 /nfs/dbraw/zinc/85/88/91/889858891.db2.gz AOTRUTDZZMCOPC-ISKFKSNPSA-N 0 3 407.558 4.452 20 0 HIADHN CCN(C(=O)Nc1nnc(/C=C\c2ccco2)s1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475006927 889859233 /nfs/dbraw/zinc/85/92/33/889859233.db2.gz BKACMQYPDLNPSI-LENZSSGSSA-N 0 3 423.542 4.430 20 0 HIADHN CCN(C(=O)N[C@@H](c1ccccc1)c1ccccn1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475008477 889862468 /nfs/dbraw/zinc/86/24/68/889862468.db2.gz NZWRJDSOUIRZNS-NOZRDPDXSA-N 0 3 414.553 4.477 20 0 HIADHN CCN(C(=O)Nc1ccccc1-n1nc(C)nc1C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475010133 889864163 /nfs/dbraw/zinc/86/41/63/889864163.db2.gz NOSFRIXSSQLDJX-NRFANRHFSA-N 0 3 418.545 4.012 20 0 HIADHN Cc1cc(CN2C[C@@H](F)C[C@H]2CN(C)Cc2cc(C)c(Br)s2)on1 ZINC000475085819 889933193 /nfs/dbraw/zinc/93/31/93/889933193.db2.gz FXIGFMNSWILMJN-KBPBESRZSA-N 0 3 416.360 4.160 20 0 HIADHN C[C@@H](NC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(OC(F)F)cc1 ZINC000475145430 890012353 /nfs/dbraw/zinc/01/23/53/890012353.db2.gz XIPCDQUECHIXBE-VQIMIIECSA-N 0 3 403.473 4.265 20 0 HIADHN CC1CCN([C@H](CNC(=O)N2CCC[C@]3(CCCOC3)C2)c2cccs2)CC1 ZINC000475148691 890016004 /nfs/dbraw/zinc/01/60/04/890016004.db2.gz ZLSHCEAHJDHYGE-KNQAVFIVSA-N 0 3 405.608 4.123 20 0 HIADHN CCN(C(=O)NCCc1nc(C(C)(C)C)cs1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475158586 890023024 /nfs/dbraw/zinc/02/30/24/890023024.db2.gz VRZZTHBLHJVVPC-LJQANCHMSA-N 0 3 414.619 4.289 20 0 HIADHN CCN(C(=O)NCc1ncoc1-c1ccccc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475165601 890030728 /nfs/dbraw/zinc/03/07/28/890030728.db2.gz SIAPXHILORKOKF-OAQYLSRUSA-N 0 3 404.514 4.148 20 0 HIADHN CCN(C(=O)NCCc1cccc2cccnc21)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475165837 890031389 /nfs/dbraw/zinc/03/13/89/890031389.db2.gz LZRIGRMYTOMUJT-HSZRJFAPSA-N 0 3 402.542 4.083 20 0 HIADHN CCN(C(=O)N[C@@H](C)c1ccc(-n2cccn2)cc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475176671 890045176 /nfs/dbraw/zinc/04/51/76/890045176.db2.gz OIAZHGBBADAZOV-RDPSFJRHSA-N 0 3 417.557 4.239 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Cc1ccc2n[nH]cc2c1)c1ccc(C(F)(F)F)cc1 ZINC000475184012 890053831 /nfs/dbraw/zinc/05/38/31/890053831.db2.gz SCGLOHQVVCCSEH-FQEVSTJZSA-N 0 3 418.463 4.324 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)c2cn(C)nc2-c2ccc(Cl)s2)C1 ZINC000475242145 890121375 /nfs/dbraw/zinc/12/13/75/890121375.db2.gz AOJNKTSVQCMPQW-HOCLYGCPSA-N 0 3 414.962 4.367 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2cccs2)cc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475302655 890210684 /nfs/dbraw/zinc/21/06/84/890210684.db2.gz MMFAERHKPXORAD-NRFANRHFSA-N 0 3 419.550 4.347 20 0 HIADHN Cc1cc(C(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)ccc1NC(=O)CC(C)C ZINC000475305704 890215755 /nfs/dbraw/zinc/21/57/55/890215755.db2.gz PDBZUAQUCSGLHE-JOCHJYFZSA-N 0 3 407.558 4.326 20 0 HIADHN CN(C(=O)c1ccnc(SCC(F)(F)F)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475310464 890223959 /nfs/dbraw/zinc/22/39/59/890223959.db2.gz CKVRDZYRDLCHOF-KRWDZBQOSA-N 0 3 409.477 4.083 20 0 HIADHN CC(C)CC(=O)Nc1ccc(C(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)cc1F ZINC000475317678 890233130 /nfs/dbraw/zinc/23/31/30/890233130.db2.gz ORBOGTANJSLMGC-HXUWFJFHSA-N 0 3 411.521 4.157 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)c1cnc(Cc2ccccc2F)s1 ZINC000475365896 890295792 /nfs/dbraw/zinc/29/57/92/890295792.db2.gz FSYPSVQVDYOZSX-UHFFFAOYSA-N 0 3 415.509 4.216 20 0 HIADHN COC(=O)[C@H]1CCN(Cc2cn(Cc3ccccc3)nc2-c2ccccc2)C[C@H]1C ZINC000475370551 890300168 /nfs/dbraw/zinc/30/01/68/890300168.db2.gz NTDWOCRAJDTXBA-XXBNENTESA-N 0 3 403.526 4.229 20 0 HIADHN C[C@H](NC(=O)N(CCN(C)Cc1ccccc1)Cc1ccccc1)C1CCOCC1 ZINC000475374505 890304906 /nfs/dbraw/zinc/30/49/06/890304906.db2.gz ZFFLRRJMAGPLSA-NRFANRHFSA-N 0 3 409.574 4.145 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)N[C@H]3C[C@H](c4ccc(Cl)cc4)C3)CC2)C[C@H](C)O1 ZINC000475407241 890334927 /nfs/dbraw/zinc/33/49/27/890334927.db2.gz FGZUDGBQUQYOCE-WSYLDTRHSA-N 0 3 419.997 4.117 20 0 HIADHN CS(=O)(=O)C1(CNCc2ccc(-c3ccc(C(F)(F)F)cc3)s2)CCC1 ZINC000475435187 890354247 /nfs/dbraw/zinc/35/42/47/890354247.db2.gz RRXAOWNKNAICGY-UHFFFAOYSA-N 0 3 403.491 4.491 20 0 HIADHN OCCN(Cc1cnc(-c2ccc(Br)cc2)s1)[C@H]1CCCSC1 ZINC000475501026 890412927 /nfs/dbraw/zinc/41/29/27/890412927.db2.gz HUAFGOBMAKSFFF-HNNXBMFYSA-N 0 3 413.406 4.263 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)N[C@@H]1C[C@H]1c1ccc(OC(F)F)cc1 ZINC000475521359 890442111 /nfs/dbraw/zinc/44/21/11/890442111.db2.gz VNMSLEGYTOAGMY-AZUAARDMSA-N 0 3 421.463 4.056 20 0 HIADHN CN(C(=O)c1ccc(OCc2ccccn2)cc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475542971 890465972 /nfs/dbraw/zinc/46/59/72/890465972.db2.gz BGGUXYDDUIIDKK-HSZRJFAPSA-N 0 3 401.510 4.007 20 0 HIADHN O=C(c1cc2sc(N3CCCC3)nc2s1)N1CCC[C@@H]1CN1CCCCC1 ZINC000475590703 890518244 /nfs/dbraw/zinc/51/82/44/890518244.db2.gz NMMZFOMVERWONT-OAHLLOKOSA-N 0 3 404.605 4.049 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)Nc2ccc(C(F)(F)F)cc2Cl)CC1 ZINC000475603731 890529694 /nfs/dbraw/zinc/52/96/94/890529694.db2.gz OHRVNIQWVCNRKD-UHFFFAOYSA-N 0 3 407.864 4.370 20 0 HIADHN CCc1nnc(-c2ccc(NC(=O)N3CC[C@H](C)N(Cc4ccccc4)CC3)cc2)o1 ZINC000475683752 890625204 /nfs/dbraw/zinc/62/52/04/890625204.db2.gz GWPCKLUMWQOEIP-SFHVURJKSA-N 0 3 419.529 4.427 20 0 HIADHN CCc1nnc(-c2ccc(NC(=O)N[C@H](CN3CCCC3)c3ccccc3)cc2)o1 ZINC000475684791 890625749 /nfs/dbraw/zinc/62/57/49/890625749.db2.gz LHTQWWVIKBMCTN-HXUWFJFHSA-N 0 3 405.502 4.258 20 0 HIADHN CN(Cc1c(F)cccc1Cl)C(=O)NCC(C)(C)N1CCc2ccccc2C1 ZINC000504737176 913474942 /nfs/dbraw/zinc/47/49/42/913474942.db2.gz ISLZRXBWUXURAD-UHFFFAOYSA-N 0 3 403.929 4.457 20 0 HIADHN Cn1cc(-c2cc(CN(Cc3cccc(Br)c3)CC3CC3)on2)cn1 ZINC000475736635 890676357 /nfs/dbraw/zinc/67/63/57/890676357.db2.gz ASQVQBRJDXRQOF-UHFFFAOYSA-N 0 3 401.308 4.250 20 0 HIADHN COc1ccc(CNC(=O)CN(C)[C@H](C)[C@H](C)c2ccc(Cl)cc2)cc1OC ZINC000475739850 890682236 /nfs/dbraw/zinc/68/22/36/890682236.db2.gz PNIYBLDSAZFASU-JKSUJKDBSA-N 0 3 404.938 4.097 20 0 HIADHN C[C@@H](c1ccc([S@](C)=O)cc1)N(C)CCc1nc(-c2ccc(Cl)cc2)no1 ZINC000475746135 890689153 /nfs/dbraw/zinc/68/91/53/890689153.db2.gz IHCFAZHMNIRYOA-PWFNWSNSSA-N 0 3 403.935 4.363 20 0 HIADHN O=C(c1ncccc1Br)N(CCN1CCCC1)Cc1ccc(Cl)cc1 ZINC000475752152 890698286 /nfs/dbraw/zinc/69/82/86/890698286.db2.gz DEVIPQXCLBNCNM-UHFFFAOYSA-N 0 3 422.754 4.236 20 0 HIADHN Cc1nc(CC2CC2)sc1C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000475913420 890841117 /nfs/dbraw/zinc/84/11/17/890841117.db2.gz YBXNNYTZPBCIKU-IBGZPJMESA-N 0 3 421.570 4.300 20 0 HIADHN COc1ccc(C(=O)Nc2ccc(C)cc2CN(C)C)c(OCCOC(C)C)c1 ZINC000475936510 890861065 /nfs/dbraw/zinc/86/10/65/890861065.db2.gz WSDLWZCANWNDSI-UHFFFAOYSA-N 0 3 400.519 4.121 20 0 HIADHN Cc1ccc([C@H](NC(=O)NC2CCN(CCOC(C)C)CC2)c2ccccc2)cc1 ZINC000475954410 890875455 /nfs/dbraw/zinc/87/54/55/890875455.db2.gz KURUQOSXXNGPHD-XMMPIXPASA-N 0 3 409.574 4.273 20 0 HIADHN CCOc1cccc2cc([C@@H](C)NC(=O)NC3CCN(CCOC(C)C)CC3)oc21 ZINC000475958929 890879605 /nfs/dbraw/zinc/87/96/05/890879605.db2.gz PAJRSBHFNJNYRJ-QGZVFWFLSA-N 0 3 417.550 4.081 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)NC(C)(C)c2ccc(Cl)c(Cl)c2)CC1 ZINC000476046603 890976251 /nfs/dbraw/zinc/97/62/51/890976251.db2.gz ZRTSHAOMVDCDEF-UHFFFAOYSA-N 0 3 416.393 4.417 20 0 HIADHN CN(C(=O)N[C@@H](c1ccc(F)cc1)c1ccccc1Cl)[C@H]1CCN(C2CC2)C1 ZINC000476127585 891050238 /nfs/dbraw/zinc/05/02/38/891050238.db2.gz AYECRBUDUDJAPE-RXVVDRJESA-N 0 3 401.913 4.447 20 0 HIADHN Cc1cccc(NC(=O)Nc2cccc(CNC(=O)N(C)[C@H]3CCN(C4CC4)C3)c2)c1 ZINC000476151422 891076291 /nfs/dbraw/zinc/07/62/91/891076291.db2.gz MGUJLQBXNZYETR-QFIPXVFZSA-N 0 3 421.545 4.017 20 0 HIADHN Cc1nc2c(s1)[C@H](N(C)C(=O)NCC(C)(C)N1CCc3ccccc3C1)CCC2 ZINC000476236354 891158840 /nfs/dbraw/zinc/15/88/40/891158840.db2.gz VFRLALOHIVIAIW-HXUWFJFHSA-N 0 3 412.603 4.307 20 0 HIADHN O=C(N[C@H]1CCCN(Cc2ccccc2)C1)N(Cc1ccccc1)CC1CCOCC1 ZINC000476269248 891190933 /nfs/dbraw/zinc/19/09/33/891190933.db2.gz RGLKMULPHFFHKB-VWLOTQADSA-N 0 3 421.585 4.289 20 0 HIADHN CCc1onc(-c2ccccc2Cl)c1C(=O)NCCCCN1C[C@H](C)O[C@@H](C)C1 ZINC000476302421 891215800 /nfs/dbraw/zinc/21/58/00/891215800.db2.gz CNBRNGPEDAFRIX-HOTGVXAUSA-N 0 3 419.953 4.177 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N2Cc3ccccc3-c3ccccc3C2)CC1 ZINC000476432180 891344148 /nfs/dbraw/zinc/34/41/48/891344148.db2.gz DQVSVBFHTJPDDA-UHFFFAOYSA-N 0 3 407.558 4.268 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N(CCc2ccccc2)Cc2ccccc2)CC1 ZINC000476445570 891358677 /nfs/dbraw/zinc/35/86/77/891358677.db2.gz DRXBCRMLNVKGSO-UHFFFAOYSA-N 0 3 423.601 4.330 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N(CCc2ccccc2)C2CCCC2)CC1 ZINC000476448196 891359935 /nfs/dbraw/zinc/35/99/35/891359935.db2.gz JRYNFIVQVISIPV-UHFFFAOYSA-N 0 3 401.595 4.073 20 0 HIADHN CCN(C(=O)NC1CCN(CCOC(C)C)CC1)[C@@H](C)c1cc2ccccc2o1 ZINC000476451065 891363099 /nfs/dbraw/zinc/36/30/99/891363099.db2.gz XBIZZDMUGDEHOE-SFHVURJKSA-N 0 3 401.551 4.415 20 0 HIADHN Cc1ccc([C@@H]2[C@H](C)CCCN2C(=O)NC2CCN(CCOC(C)C)CC2)cc1 ZINC000476455775 891368509 /nfs/dbraw/zinc/36/85/09/891368509.db2.gz XRHSFQJZZOCSOB-OFNKIYASSA-N 0 3 401.595 4.367 20 0 HIADHN Cc1onc(-c2ccccc2C)c1C(=O)Nc1ccc(OC2CCN(C)CC2)nc1 ZINC000476472726 891383948 /nfs/dbraw/zinc/38/39/48/891383948.db2.gz QLLWYVNDEYINIA-UHFFFAOYSA-N 0 3 406.486 4.079 20 0 HIADHN O=C(CN1CCC[C@]2(CCCOC2)C1)N(Cc1ccc(C(F)(F)F)cc1)C1CC1 ZINC000476562895 891482112 /nfs/dbraw/zinc/48/21/12/891482112.db2.gz PIZOUVKFBDZGLC-NRFANRHFSA-N 0 3 410.480 4.089 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)C3(Cc4cccc(F)c4)CCC3)CC2)C[C@@H](C)O1 ZINC000476649997 891591138 /nfs/dbraw/zinc/59/11/38/891591138.db2.gz VMZIZYVJALDXEG-WOJBJXKFSA-N 0 3 416.581 4.276 20 0 HIADHN COc1ccc(COc2cccc(F)c2)cc1NC(=O)NCCN1CCCCC1 ZINC000476788625 891770020 /nfs/dbraw/zinc/77/00/20/891770020.db2.gz KKCMQPFQYLRUCQ-UHFFFAOYSA-N 0 3 401.482 4.021 20 0 HIADHN Cc1nc(C(=O)N(CCN(C)C)C2CCCCC2)nn1-c1c(Cl)cccc1Cl ZINC000476802905 891787669 /nfs/dbraw/zinc/78/76/69/891787669.db2.gz IFPMNOQATTXOKB-UHFFFAOYSA-N 0 3 424.376 4.219 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)N(Cc2ccccc2)CC2CCOCC2)C1 ZINC000476816885 891802812 /nfs/dbraw/zinc/80/28/12/891802812.db2.gz OKJGPEHAYZSTNC-OFVILXPXSA-N 0 3 421.585 4.460 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCC[C@@]2(C1)OCc1ccccc12)c1ccsc1 ZINC000476864611 891829773 /nfs/dbraw/zinc/82/97/73/891829773.db2.gz UCQVQDRZMJDIPO-GGAORHGYSA-N 0 3 413.587 4.362 20 0 HIADHN CN(C)Cc1ccsc1C(=O)NC[C@H]1CCN(C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000476984692 891909829 /nfs/dbraw/zinc/90/98/29/891909829.db2.gz YOBQVFXYBBFNJH-RDTXWAMCSA-N 0 3 409.958 4.025 20 0 HIADHN CC[C@@H](Cc1ccccc1Br)N(C)C(=O)N[C@@H](C)C1=CCN(C)CC1 ZINC000477182108 892101020 /nfs/dbraw/zinc/10/10/20/892101020.db2.gz NCFPGIFVFNMRFD-YJBOKZPZSA-N 0 3 408.384 4.062 20 0 HIADHN CC[C@H](Cc1ccccc1Br)N(C)C(=O)N[C@@H](C)C1=CCN(C)CC1 ZINC000477182106 892101060 /nfs/dbraw/zinc/10/10/60/892101060.db2.gz NCFPGIFVFNMRFD-MAUKXSAKSA-N 0 3 408.384 4.062 20 0 HIADHN COc1ccc([C@H]2CCCN2C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)cc1OC ZINC000504895719 913628665 /nfs/dbraw/zinc/62/86/65/913628665.db2.gz QBQIBHYKMKMLRO-FCHUYYIVSA-N 0 3 423.557 4.215 20 0 HIADHN CCOCCC1(C(=O)NC2CCN(CCOc3ccc(Cl)cc3)CC2)CCCC1 ZINC000477221208 892153765 /nfs/dbraw/zinc/15/37/65/892153765.db2.gz KBZLECPXFGUNIP-UHFFFAOYSA-N 0 3 422.997 4.286 20 0 HIADHN CC[C@H](c1ccccc1)[C@H]1CCCN1CC(=O)Nc1ccccc1N1CCCC1=O ZINC000477225343 892160284 /nfs/dbraw/zinc/16/02/84/892160284.db2.gz WTKBDSXAZMHORI-IFMALSPDSA-N 0 3 405.542 4.410 20 0 HIADHN O=C(NC1CCN(Cc2ccccc2)CC1)c1ccnc(-c2ccc(Cl)cc2)n1 ZINC000477264158 892215497 /nfs/dbraw/zinc/21/54/97/892215497.db2.gz DZIDKOKUMKGDPX-UHFFFAOYSA-N 0 3 406.917 4.191 20 0 HIADHN Cc1cc(C)n(-c2ccccc2NC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)n1 ZINC000504912996 913647634 /nfs/dbraw/zinc/64/76/34/913647634.db2.gz BBRGCUXSIHVMQB-OAQYLSRUSA-N 0 3 403.530 4.275 20 0 HIADHN CC[C@@H](NC(=O)NC[C@H](C)N(C)Cc1ccccc1)c1nc(-c2ccccc2)c[nH]1 ZINC000477339570 892308402 /nfs/dbraw/zinc/30/84/02/892308402.db2.gz QPKCYAHBUDRTQN-GHTZIAJQSA-N 0 3 405.546 4.348 20 0 HIADHN C[C@@H]1CSc2ccc(Br)cc2[C@@H]1NC(=O)N(C)[C@H]1CCN(C2CC2)C1 ZINC000477419841 892373098 /nfs/dbraw/zinc/37/30/98/892373098.db2.gz RQRIKQSVCMYGSQ-HNJNHCNJSA-N 0 3 424.408 4.110 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N[C@H](C)C2(c3ccccc3)CCCC2)CC1 ZINC000477436141 892387538 /nfs/dbraw/zinc/38/75/38/892387538.db2.gz OJURNXQPPBPACF-HXUWFJFHSA-N 0 3 401.595 4.076 20 0 HIADHN O=C(Nc1cccc(OC[C@H]2CCCO2)c1)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000504925913 913662704 /nfs/dbraw/zinc/66/27/04/913662704.db2.gz SQLNTOZQEVBDMG-FYYLOGMGSA-N 0 3 409.530 4.031 20 0 HIADHN CCN(C(=O)c1cn(CC(F)(F)F)nc1C)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000477469578 892446808 /nfs/dbraw/zinc/44/68/08/892446808.db2.gz IAYFOLXDNWSABL-WMZOPIPTSA-N 0 3 408.468 4.051 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@@H](C)N[C@H](C)c2ccc(F)c(OC)c2)cc1 ZINC000504926832 913666149 /nfs/dbraw/zinc/66/61/49/913666149.db2.gz KRYNWKAQMOEQCU-HZPDHXFCSA-N 0 3 408.539 4.277 20 0 HIADHN CN(C(=O)N[C@@H]1CCCc2nc(-c3ccc(F)cc3)sc21)[C@H]1CCN(C2CC2)C1 ZINC000477496934 892499547 /nfs/dbraw/zinc/49/95/47/892499547.db2.gz IANUNLUIMZLOJV-PKOBYXMFSA-N 0 3 414.550 4.205 20 0 HIADHN CCOc1ccc([C@@H](NS(=O)(=O)c2ccc(CN(C)C)cc2)c2ccccc2)cc1 ZINC000477522005 892543629 /nfs/dbraw/zinc/54/36/29/892543629.db2.gz HSJLZXCLQHKZCW-DEOSSOPVSA-N 0 3 424.566 4.215 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)Nc1cccn(Cc2ccc(C)cc2)c1=O)c1ccco1 ZINC000477584392 892650348 /nfs/dbraw/zinc/65/03/48/892650348.db2.gz CQKPGZFMLGHXRV-WIYYLYMNSA-N 0 3 422.529 4.049 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)Nc1ccc2c(c1)OC1(CCCC1)O2 ZINC000504960589 913700764 /nfs/dbraw/zinc/70/07/64/913700764.db2.gz ZPUVTNKIMCOFFK-UHFFFAOYSA-N 0 3 417.575 4.211 20 0 HIADHN O=C(CCCc1ccc(F)c(F)c1)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000477712518 892822039 /nfs/dbraw/zinc/82/20/39/892822039.db2.gz MZJJXZOAKNNDBO-UHFFFAOYSA-N 0 3 402.485 4.131 20 0 HIADHN COc1cc(Cl)c(Cl)cc1C(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000477721379 892826595 /nfs/dbraw/zinc/82/65/95/892826595.db2.gz FUKZHOLSLRGFQM-UHFFFAOYSA-N 0 3 423.340 4.459 20 0 HIADHN CCN(C[C@@H]1CCN([C@@H](C)C(=O)N2CCC[C@@H]2c2cccs2)C1)CC(F)(F)F ZINC000477724247 892827444 /nfs/dbraw/zinc/82/74/44/892827444.db2.gz LOLDCQMLKIMKRQ-YESZJQIVSA-N 0 3 417.541 4.006 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1cnc(Cc2ccccc2)s1 ZINC000477724778 892827844 /nfs/dbraw/zinc/82/78/44/892827844.db2.gz PXCPBLFAHLNXTQ-UHFFFAOYSA-N 0 3 421.566 4.191 20 0 HIADHN CC[C@@H](CNC(=O)N1CCC[C@H]1c1ccc2c(c1)OCO2)N1CCc2ccccc2C1 ZINC000477725812 892828226 /nfs/dbraw/zinc/82/82/26/892828226.db2.gz XPMGLQHDQRWEHX-VXKWHMMOSA-N 0 3 421.541 4.099 20 0 HIADHN CCc1ccc([C@H](C)NC(=O)[C@@H](C)N2CC[C@H](CN(CC)CC(F)(F)F)C2)cc1 ZINC000477729576 892830317 /nfs/dbraw/zinc/83/03/17/892830317.db2.gz YZWPKOZOEMGZRB-YQVWRLOYSA-N 0 3 413.528 4.021 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1c2c(nc3ccccc31)CCC2 ZINC000477738460 892835229 /nfs/dbraw/zinc/83/52/29/892835229.db2.gz HWDJYAMLZBCWAS-UHFFFAOYSA-N 0 3 415.537 4.180 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N(C)Cc1nc(-c2ccccc2)c[nH]1)c1ccsc1 ZINC000477831168 892893535 /nfs/dbraw/zinc/89/35/35/892893535.db2.gz ZIFVKVBUYMPXJH-HXUWFJFHSA-N 0 3 411.575 4.363 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)N[C@@H](C)c1nc2ccccc2n1C(F)F ZINC000477854122 892913341 /nfs/dbraw/zinc/91/33/41/892913341.db2.gz PKXSFOFENBALSM-INIZCTEOSA-N 0 3 407.509 4.400 20 0 HIADHN C[C@@H](NC(=O)NCc1ccc(OCC(F)(F)F)cc1)[C@H](c1ccccc1)N(C)C ZINC000477902777 892974805 /nfs/dbraw/zinc/97/48/05/892974805.db2.gz BFEUHIJQISJBEC-DNVCBOLYSA-N 0 3 409.452 4.118 20 0 HIADHN C[C@H](NCc1ccc(S(=O)(=O)CCO)cc1)c1ccc(-c2ccccc2F)s1 ZINC000477918803 893004643 /nfs/dbraw/zinc/00/46/43/893004643.db2.gz PNXVDTCTQVKODP-HNNXBMFYSA-N 0 3 419.543 4.171 20 0 HIADHN CC(C)(C)C[C@H](NCc1ccc(S(=O)(=O)CCO)cc1)c1ccc(Cl)cc1 ZINC000477923429 893010629 /nfs/dbraw/zinc/01/06/29/893010629.db2.gz AJVFLWSAADQCFA-FQEVSTJZSA-N 0 3 409.979 4.373 20 0 HIADHN CCOc1ccc([C@@H](CC)N[C@H]2CCN(Cc3ccc(F)cc3)C2=O)cc1OCC ZINC000477925447 893013499 /nfs/dbraw/zinc/01/34/99/893013499.db2.gz IQVIWLVBEGWHRW-RTWAWAEBSA-N 0 3 414.521 4.465 20 0 HIADHN Cc1ccc(CN2CC[C@@H](N[C@@H](C)CC(=O)Nc3cc(Cl)ccc3C)C2=O)cc1 ZINC000477937520 893027408 /nfs/dbraw/zinc/02/74/08/893027408.db2.gz ZTJARGBQBCZHBN-FXAWDEMLSA-N 0 3 413.949 4.065 20 0 HIADHN Cc1c(NC(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)cnn1-c1ccccc1 ZINC000477939759 893030035 /nfs/dbraw/zinc/03/00/35/893030035.db2.gz NBMUZWKQTQWIIB-QHCPKHFHSA-N 0 3 421.545 4.392 20 0 HIADHN Cc1ccc([C@@H](NCc2ccc(S(=O)(=O)CCO)cc2)C2CCCCC2)cc1 ZINC000477946752 893038129 /nfs/dbraw/zinc/03/81/29/893038129.db2.gz LXXJGWUADVARPH-QHCPKHFHSA-N 0 3 401.572 4.172 20 0 HIADHN O=C(c1ccc(C(F)(F)F)nc1)N(CCN1CCCC1)Cc1ccc(Cl)cc1 ZINC000477960603 893050904 /nfs/dbraw/zinc/05/09/04/893050904.db2.gz UVDUWOQYUGOPMY-UHFFFAOYSA-N 0 3 411.855 4.492 20 0 HIADHN CCc1cc(Br)ccc1NC(=O)NC1CCN(CCOC(C)C)CC1 ZINC000477978493 893075976 /nfs/dbraw/zinc/07/59/76/893075976.db2.gz ZXAUFSIZNKGLJF-UHFFFAOYSA-N 0 3 412.372 4.022 20 0 HIADHN COc1ccc(CN(CCc2ccccn2)C(=O)c2cccc(CN(C)C)c2)cc1 ZINC000478167550 893335375 /nfs/dbraw/zinc/33/53/75/893335375.db2.gz NONDOKWINZLYJT-UHFFFAOYSA-N 0 3 403.526 4.037 20 0 HIADHN C[C@@H](CNC(=O)C(=O)Nc1ccc2c(c1)oc1ccccc12)N(C)Cc1ccccc1 ZINC000478277826 893478963 /nfs/dbraw/zinc/47/89/63/893478963.db2.gz QCZHHBUXHPHOGH-KRWDZBQOSA-N 0 3 415.493 4.161 20 0 HIADHN CCOc1c(Cl)cccc1CC(=O)NC[C@@H](c1cccc(OC)c1)N1CCCC1 ZINC000478287254 893493867 /nfs/dbraw/zinc/49/38/67/893493867.db2.gz FOKTVFBPAIAAQV-NRFANRHFSA-N 0 3 416.949 4.243 20 0 HIADHN CCCN(C(=O)C[C@@H](NC(C)=O)c1ccccc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000505036596 913777007 /nfs/dbraw/zinc/77/70/07/913777007.db2.gz YBHKFTODUCBEEE-JWQCQUIFSA-N 0 3 421.585 4.157 20 0 HIADHN CCOc1c(Cl)cccc1CC(=O)NC1CCN([C@@H](C)c2ccncc2)CC1 ZINC000478322661 893552410 /nfs/dbraw/zinc/55/24/10/893552410.db2.gz BXMHMFBOHYQLSQ-INIZCTEOSA-N 0 3 401.938 4.018 20 0 HIADHN CC[C@H](C)n1ncc(C(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)c1C ZINC000478342016 893584356 /nfs/dbraw/zinc/58/43/56/893584356.db2.gz MRKNVKDNKANYSL-PXNSSMCTSA-N 0 3 406.534 4.058 20 0 HIADHN CN1C[C@@H](c2ccccc2)[C@H](NC(=O)c2cccc(NC(=O)C3CCCCC3)c2)C1 ZINC000478373901 893637102 /nfs/dbraw/zinc/63/71/02/893637102.db2.gz VPWOUXFRYZFVIX-XZOQPEGZSA-N 0 3 405.542 4.033 20 0 HIADHN CN1C[C@@H](NC(=O)CCc2ncc(-c3ccc(Cl)cc3)o2)[C@@H](c2ccccc2)C1 ZINC000478377315 893642495 /nfs/dbraw/zinc/64/24/95/893642495.db2.gz YRRCGFKCWMSMLX-WOJBJXKFSA-N 0 3 409.917 4.142 20 0 HIADHN CN(C)[C@@H](CNC(=O)N(CCC(F)(F)F)Cc1ccccc1)Cc1ccccc1 ZINC000478455312 893774976 /nfs/dbraw/zinc/77/49/76/893774976.db2.gz AVPXADHRKHKMSC-HXUWFJFHSA-N 0 3 407.480 4.324 20 0 HIADHN COc1cnccc1N1CCN(C(=O)c2oc3c(ccc4ccccc34)c2C)CC1 ZINC000478485757 893807179 /nfs/dbraw/zinc/80/71/79/893807179.db2.gz ZHCFAGCGIQDIGV-UHFFFAOYSA-N 0 3 401.466 4.260 20 0 HIADHN CCOc1c(Cl)cccc1CC(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000478500148 893815568 /nfs/dbraw/zinc/81/55/68/893815568.db2.gz YZBOIESOGCLHEY-QZTJIDSGSA-N 0 3 422.997 4.019 20 0 HIADHN COc1ccc(-c2ccncc2)cc1CNc1ccc(OC2CCN(C)CC2)nc1 ZINC000478614968 893877618 /nfs/dbraw/zinc/87/76/18/893877618.db2.gz JYQNRTLNQWCIOD-UHFFFAOYSA-N 0 3 404.514 4.237 20 0 HIADHN CCO[C@@H]1C[C@@H](N(C)C(=O)Nc2ccc(CCN3CCSCC3)cc2)C12CCC2 ZINC000478668743 893917306 /nfs/dbraw/zinc/91/73/06/893917306.db2.gz VYCPUIGEAIVYJE-NHCUHLMSSA-N 0 3 417.619 4.089 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)N1CC2(CCOCC2)c2ccccc21 ZINC000478784576 894060210 /nfs/dbraw/zinc/06/02/10/894060210.db2.gz NMFDTZKAPWPHBU-JOCHJYFZSA-N 0 3 405.542 4.102 20 0 HIADHN C[C@@H](NC(=O)NCc1cccc(OCC(F)(F)F)c1)[C@H](c1ccccc1)N(C)C ZINC000478803896 894078357 /nfs/dbraw/zinc/07/83/57/894078357.db2.gz WJMDYZZYQZZBQV-DNVCBOLYSA-N 0 3 409.452 4.118 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)N[C@@H]2CCc3c2cccc3Cl)c1 ZINC000478809554 894082979 /nfs/dbraw/zinc/08/29/79/894082979.db2.gz BNNFWHIJPOWJCC-OAQYLSRUSA-N 0 3 401.938 4.109 20 0 HIADHN CCOc1ccc(NC(=O)[C@@H]2CN(Cc3ccccc3)CCC2(F)F)cc1OC ZINC000505160125 913850779 /nfs/dbraw/zinc/85/07/79/913850779.db2.gz MMFTZBQWVZLLPR-SFHVURJKSA-N 0 3 404.457 4.190 20 0 HIADHN CC(C)NC(=O)Nc1ccc([C@H](C)N[C@H]2CCCN(c3ccccc3F)C2=O)cc1 ZINC000478980312 894258454 /nfs/dbraw/zinc/25/84/54/894258454.db2.gz YLYRFFIQWLMVSY-JXFKEZNVSA-N 0 3 412.509 4.202 20 0 HIADHN C[C@@H](N[C@@H](C)CCc1ccc(O)cc1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479058165 894318051 /nfs/dbraw/zinc/31/80/51/894318051.db2.gz JUKMQZZDPUHJFV-NWDGAFQWSA-N 0 3 417.358 4.018 20 0 HIADHN Cc1cc(C)c(S(N)(=O)=O)cc1[C@H](C)N[C@@H](C)c1ccc(Br)cc1 ZINC000479066182 894329050 /nfs/dbraw/zinc/32/90/50/894329050.db2.gz KIKQEUYAOYGRQQ-KBPBESRZSA-N 0 3 411.365 4.125 20 0 HIADHN C[C@@H](NC[C@@H](C)c1ccc(F)cc1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479065895 894329160 /nfs/dbraw/zinc/32/91/60/894329160.db2.gz HTVSORIXQFNRKR-GHMZBOCLSA-N 0 3 405.322 4.234 20 0 HIADHN C[C@H](CN[C@@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl)c1ccc(F)cc1 ZINC000479065896 894329529 /nfs/dbraw/zinc/32/95/29/894329529.db2.gz HTVSORIXQFNRKR-MNOVXSKESA-N 0 3 405.322 4.234 20 0 HIADHN Cc1cccc([C@H](C)CN[C@H](C)c2cc(S(N)(=O)=O)c(Cl)cc2Cl)c1 ZINC000479084021 894350655 /nfs/dbraw/zinc/35/06/55/894350655.db2.gz WTLABRVINFWIRM-CHWSQXEVSA-N 0 3 401.359 4.404 20 0 HIADHN CC[C@H](C)NC(=O)[C@@H]1C[C@H](C)N(Cc2nnc(-c3ccco3)o2)[C@@H]2CCCC[C@H]12 ZINC000479106959 894372341 /nfs/dbraw/zinc/37/23/41/894372341.db2.gz KAFYMHDDXRVBIC-QXDIGNSFSA-N 0 3 400.523 4.014 20 0 HIADHN CC[C@H](C)NC(=O)[C@@H]1C[C@H](C)N(Cc2nc(-c3ccoc3)no2)[C@@H]2CCCC[C@@H]12 ZINC000479116407 894386530 /nfs/dbraw/zinc/38/65/30/894386530.db2.gz QZGFTWYBCSBKTF-WAARBJQMSA-N 0 3 400.523 4.014 20 0 HIADHN Cc1c2ccccc2oc1[C@@H](C)NC(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000479250356 894514470 /nfs/dbraw/zinc/51/44/70/894514470.db2.gz RBQZSDMVVHJKIQ-GOSISDBHSA-N 0 3 421.541 4.258 20 0 HIADHN O=C([C@H]1CN(Cc2ccccc2)CCC1(F)F)N1CC=C(c2ccc(O)cc2)CC1 ZINC000505207001 913882867 /nfs/dbraw/zinc/88/28/67/913882867.db2.gz IYDTZCZXFAKJPT-JOCHJYFZSA-N 0 3 412.480 4.165 20 0 HIADHN O=C([C@@H]1CN(Cc2ccccc2)CCC1(F)F)N1CC=C(c2ccc(O)cc2)CC1 ZINC000505207002 913883000 /nfs/dbraw/zinc/88/30/00/913883000.db2.gz IYDTZCZXFAKJPT-QFIPXVFZSA-N 0 3 412.480 4.165 20 0 HIADHN C[C@H](NCC1(c2ccc(F)cc2)CC1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479334518 894628051 /nfs/dbraw/zinc/62/80/51/894628051.db2.gz ZFULAGLATDLVFP-NSHDSACASA-N 0 3 417.333 4.162 20 0 HIADHN C[C@H](NCCCSc1ccccc1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479350919 894646830 /nfs/dbraw/zinc/64/68/30/894646830.db2.gz UUKZJSHFDABXFD-LBPRGKRZSA-N 0 3 419.399 4.474 20 0 HIADHN Cc1cccc(C)c1CCN[C@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479416645 894727495 /nfs/dbraw/zinc/72/74/95/894727495.db2.gz NTXRRWFTYILBBC-CYBMUJFWSA-N 0 3 401.359 4.151 20 0 HIADHN CCc1nc2c(s1)[C@@H](N(C)C(=O)NCC1(N3CCSCC3)CCCC1)CCC2 ZINC000479436814 894752782 /nfs/dbraw/zinc/75/27/82/894752782.db2.gz KXPIZDUZZHEMSU-KRWDZBQOSA-N 0 3 422.664 4.086 20 0 HIADHN O=C1[C@H](N[C@@H]2CCCc3cc(Br)ccc32)CCCN1Cc1ccccn1 ZINC000479447140 894765084 /nfs/dbraw/zinc/76/50/84/894765084.db2.gz CGMYRLXUZCPLEZ-WOJBJXKFSA-N 0 3 414.347 4.002 20 0 HIADHN CO[C@H](c1ccccc1Cl)[C@@H](C)N[C@@H](C)c1cc(S(N)(=O)=O)c(C)cc1C ZINC000479448496 894767061 /nfs/dbraw/zinc/76/70/61/894767061.db2.gz DIPANBXFBOHSTA-MDOVXXIYSA-N 0 3 410.967 4.031 20 0 HIADHN CCS(=O)(=O)c1c(Cl)cccc1CN[C@H]1CCN(Cc2ccccc2)[C@H](C)C1 ZINC000479452100 894771362 /nfs/dbraw/zinc/77/13/62/894771362.db2.gz IGLNNIYDESFBFJ-XLIONFOSSA-N 0 3 421.006 4.276 20 0 HIADHN OC[C@H](CC(F)F)N[C@H]1CCCc2c(Br)cc(Br)cc21 ZINC000479452206 894771872 /nfs/dbraw/zinc/77/18/72/894771872.db2.gz IJBHEBBARZBQND-ZANVPECISA-N 0 3 413.100 4.195 20 0 HIADHN C[C@H](NCCCCn1cc(Br)cn1)c1ncc(Br)cc1F ZINC000479468585 894791663 /nfs/dbraw/zinc/79/16/63/894791663.db2.gz YNWMAZWUERBNCL-JTQLQIEISA-N 0 3 420.124 4.073 20 0 HIADHN Cc1ccc([C@@H](Cc2ccccc2Br)NCC2(S(C)(=O)=O)CC2)cc1 ZINC000479479125 894803190 /nfs/dbraw/zinc/80/31/90/894803190.db2.gz XYVNCCTTXGTARF-LJQANCHMSA-N 0 3 422.388 4.208 20 0 HIADHN CCc1ccc([C@@H](NC[C@@H](C)N(CC)CC)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000479484248 894806877 /nfs/dbraw/zinc/80/68/77/894806877.db2.gz AIUYMBPOXYXHAD-WZONZLPQSA-N 0 3 402.604 4.062 20 0 HIADHN COc1ccc(NC(=O)[C@H](N[C@H]2CCc3cnn(C(C)C)c3C2)c2ccccc2)cc1 ZINC000479490155 894810863 /nfs/dbraw/zinc/81/08/63/894810863.db2.gz SAHACDKKQNNHHJ-XUZZJYLKSA-N 0 3 418.541 4.300 20 0 HIADHN CCc1nc2c(s1)[C@H](N(C)C(=O)NC[C@H](C)N(C)Cc1ccccc1)CCC2 ZINC000479525113 894833761 /nfs/dbraw/zinc/83/37/61/894833761.db2.gz DIWQBCOCYKLWBY-QFBILLFUSA-N 0 3 400.592 4.245 20 0 HIADHN CN(C(=O)NCc1csc(-c2ccco2)n1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000479579862 894870068 /nfs/dbraw/zinc/87/00/68/894870068.db2.gz NTNFCVDAXJHAJU-IBGZPJMESA-N 0 3 410.543 4.209 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)NCc1csc(-c2ccco2)n1 ZINC000479583250 894872381 /nfs/dbraw/zinc/87/23/81/894872381.db2.gz FKQVKELSUMGSND-KRWDZBQOSA-N 0 3 410.543 4.209 20 0 HIADHN Cc1cc(C)n2c(CN[C@H](c3cc(F)cc(Br)c3)C3CC3)cnc2n1 ZINC000479598660 894878515 /nfs/dbraw/zinc/87/85/15/894878515.db2.gz BZVCXMGBOWPYCX-SFHVURJKSA-N 0 3 403.299 4.489 20 0 HIADHN Cc1ccc(I)cc1NC(=O)Nc1cccc(CN(C)C)c1 ZINC000479666382 894941996 /nfs/dbraw/zinc/94/19/96/894941996.db2.gz QBDGGRTWMVEUTR-UHFFFAOYSA-N 0 3 409.271 4.305 20 0 HIADHN Cc1ccc(-c2nnc(-c3ccc(C(=O)NCCN4CCCC[C@@H]4C)cc3)o2)cc1 ZINC000479755564 895055037 /nfs/dbraw/zinc/05/50/37/895055037.db2.gz XOWOQEGPKQQCEY-SFHVURJKSA-N 0 3 404.514 4.316 20 0 HIADHN CC[C@@H](NC(=O)N[C@H](CN(C)C)c1ccc(F)cc1)c1ccccc1OC(F)F ZINC000479760199 895060816 /nfs/dbraw/zinc/06/08/16/895060816.db2.gz QWUXOODKTCDKMG-QZTJIDSGSA-N 0 3 409.452 4.480 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)N1CCCn2c(cc3ccccc32)C1 ZINC000479811406 895120965 /nfs/dbraw/zinc/12/09/65/895120965.db2.gz HMHPJJNWYBSCIS-HSZRJFAPSA-N 0 3 402.542 4.394 20 0 HIADHN COc1cccc([C@@H](CN[C@@H](C)c2nnn(-c3ccc(Cl)cc3)c2C)N(C)C)c1 ZINC000479870725 895212256 /nfs/dbraw/zinc/21/22/56/895212256.db2.gz FBESLVHJHCEJQJ-YCRPNKLZSA-N 0 3 413.953 4.191 20 0 HIADHN Cc1nc(-c2cccnc2)sc1[C@H](C)NCc1ccc(CN2CCOCC2)cc1 ZINC000479885589 895230556 /nfs/dbraw/zinc/23/05/56/895230556.db2.gz FTUHANYKLFRAJU-KRWDZBQOSA-N 0 3 408.571 4.197 20 0 HIADHN CC[C@H](C)n1ncc(C(=O)N(CCN(C)C)Cc2ccc(Br)cc2)c1C ZINC000479941060 895291865 /nfs/dbraw/zinc/29/18/65/895291865.db2.gz NPJKPUXRZYUNAP-HNNXBMFYSA-N 0 3 421.383 4.129 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)c1cccc(Nc2ccccc2)c1 ZINC000479979756 895333150 /nfs/dbraw/zinc/33/31/50/895333150.db2.gz JXUWVOHGERHMRN-UHFFFAOYSA-N 0 3 415.537 4.317 20 0 HIADHN CCS(=O)(=O)Nc1ccc([C@H](C)NCc2c(C)nn(-c3ccccc3)c2C)cc1 ZINC000480016801 895366769 /nfs/dbraw/zinc/36/67/69/895366769.db2.gz OQSPBJLMLRPHOI-INIZCTEOSA-N 0 3 412.559 4.102 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)c3cc4c(cc(Cl)cc4Cl)[nH]3)CC2)C[C@H](C)O1 ZINC000480028065 895377267 /nfs/dbraw/zinc/37/72/67/895377267.db2.gz CSQJFCDQSXKYSP-OKILXGFUSA-N 0 3 424.372 4.436 20 0 HIADHN CCOC(=O)c1cc(NC2CCN(CCOc3ccc(F)cc3)CC2)ncc1Cl ZINC000480053123 895399605 /nfs/dbraw/zinc/39/96/05/895399605.db2.gz COAXLOLWWAZQFU-UHFFFAOYSA-N 0 3 421.900 4.006 20 0 HIADHN COc1ccc([C@H](CN[C@H](C)c2ccc(F)cc2OC(F)F)N2CCOCC2)cc1 ZINC000480082993 895441571 /nfs/dbraw/zinc/44/15/71/895441571.db2.gz FWVPXWZVGBSEKP-QRWLVFNGSA-N 0 3 424.463 4.160 20 0 HIADHN CC[C@@H](c1ccccc1)[C@@H]1CCCN1CC(=O)Nc1cc(OC)c(OC)c(OC)c1 ZINC000480103137 895470662 /nfs/dbraw/zinc/47/06/62/895470662.db2.gz LOOPJUVRZNETLH-PMACEKPBSA-N 0 3 412.530 4.309 20 0 HIADHN O=C1NC2(CCCC2)C(=O)N1CCCN[C@@H]1CCCc2c(Cl)sc(Cl)c21 ZINC000480138909 895519523 /nfs/dbraw/zinc/51/95/23/895519523.db2.gz HEJMFKSPLJDGFV-GFCCVEGCSA-N 0 3 416.374 4.277 20 0 HIADHN Cc1ccc([C@H](C)CN[C@@H]2CCS(=O)(=O)c3ccc(Br)cc32)cc1 ZINC000480147781 895529897 /nfs/dbraw/zinc/52/98/97/895529897.db2.gz LCLPGAJPTOIQBQ-RDTXWAMCSA-N 0 3 408.361 4.369 20 0 HIADHN CCCc1c(NC(=O)N(CCC)CCN2CCCCC2)cnn1-c1cc(C)ccn1 ZINC000480155245 895540373 /nfs/dbraw/zinc/54/03/73/895540373.db2.gz UYXBTNWNFPXKQP-UHFFFAOYSA-N 0 3 412.582 4.258 20 0 HIADHN CCC(CC)[C@H](CCN[C@@H]1CCS(=O)(=O)c2ccc(Br)cc21)OC ZINC000480167565 895558485 /nfs/dbraw/zinc/55/84/85/895558485.db2.gz DHRGECLWEWXRAY-SJORKVTESA-N 0 3 418.397 4.099 20 0 HIADHN COc1ccc(CN[C@H](C)c2ccc(OCc3nccn3C)cc2)cc1OC(F)F ZINC000480187141 895581771 /nfs/dbraw/zinc/58/17/71/895581771.db2.gz WTPYHXXUFAGQBU-OAHLLOKOSA-N 0 3 417.456 4.460 20 0 HIADHN CCS[C@@H]1CCC[C@@H](N[C@H]2CCS(=O)(=O)c3ccc(Br)cc32)C1 ZINC000480194631 895589996 /nfs/dbraw/zinc/58/99/96/895589996.db2.gz AVIQLOVKUJICAD-FMKPAKJESA-N 0 3 418.422 4.322 20 0 HIADHN C[C@@H](NCc1ccc(CN2C[C@@H](C)O[C@H](C)C2)cc1)c1cnn(Cc2ccccc2)c1 ZINC000480236644 895645546 /nfs/dbraw/zinc/64/55/46/895645546.db2.gz VQCRYCWIAPSFIP-YPAWHYETSA-N 0 3 418.585 4.391 20 0 HIADHN C[C@@H](NCc1ccc(CN2C[C@@H](C)O[C@@H](C)C2)cc1)c1cnn(Cc2ccccc2)c1 ZINC000480236640 895646366 /nfs/dbraw/zinc/64/63/66/895646366.db2.gz VQCRYCWIAPSFIP-BHIFYINESA-N 0 3 418.585 4.391 20 0 HIADHN CCS(=O)(=O)Nc1ccc([C@H](C)NCc2cccc(NC(=O)C3CCC3)c2)cc1 ZINC000480245799 895655884 /nfs/dbraw/zinc/65/58/84/895655884.db2.gz XOFSRBXCDLOQNX-INIZCTEOSA-N 0 3 415.559 4.038 20 0 HIADHN COCCN(C)c1ccc(CN[C@@H](c2cc(F)cc(Br)c2)C2CC2)cn1 ZINC000480291232 895696124 /nfs/dbraw/zinc/69/61/24/895696124.db2.gz XRZGQAVURSAHOV-HXUWFJFHSA-N 0 3 422.342 4.307 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)Nc3ccc(OCC(F)F)cc3)cc2)CC1 ZINC000480357386 895762819 /nfs/dbraw/zinc/76/28/19/895762819.db2.gz OQLZAZXTFAJTQJ-UHFFFAOYSA-N 0 3 403.473 4.113 20 0 HIADHN CC(C)N(C)c1ccc(CN[C@H](C)c2ccc(NC(=O)c3ccncc3)cc2)cn1 ZINC000480363717 895770205 /nfs/dbraw/zinc/77/02/05/895770205.db2.gz LAKGYZAESNNANR-GOSISDBHSA-N 0 3 403.530 4.424 20 0 HIADHN CC(C)c1cccc(C(C)C)c1NC(=O)N1CC[C@@H](N2CCN(C)CC2)[C@@H](C)C1 ZINC000480403906 895806940 /nfs/dbraw/zinc/80/69/40/895806940.db2.gz JVDGVLCZDAUTQH-SIKLNZKXSA-N 0 3 400.611 4.423 20 0 HIADHN FC(F)(F)Oc1ccc2c(c1)[C@@H](N[C@H](CN1CCOCC1)c1ccccc1)CC2 ZINC000480415083 895813989 /nfs/dbraw/zinc/81/39/89/895813989.db2.gz JVCLGNIEQPSTFG-LEWJYISDSA-N 0 3 406.448 4.236 20 0 HIADHN C[C@@H](O)[C@](C)(CNCc1nc2cc(C(F)(F)F)ccc2n1C)Cc1ccccc1 ZINC000480449351 895837683 /nfs/dbraw/zinc/83/76/83/895837683.db2.gz YHNGHZWFXRNTNB-VFNWGFHPSA-N 0 3 405.464 4.312 20 0 HIADHN COc1cc([C@H](C)N[C@@H](CN2CCOCC2)c2ccc(C)cc2)ccc1OC(F)F ZINC000480453666 895841098 /nfs/dbraw/zinc/84/10/98/895841098.db2.gz FDFCKZJUGUESEB-PXNSSMCTSA-N 0 3 420.500 4.329 20 0 HIADHN COC(=O)c1csc(-c2cccc(CNCc3cc(-c4ccccc4)n[nH]3)c2)n1 ZINC000480476340 895856712 /nfs/dbraw/zinc/85/67/12/895856712.db2.gz ZFCMNDXKYHVNJA-UHFFFAOYSA-N 0 3 404.495 4.277 20 0 HIADHN CC(C)n1ncc2c1C[C@@H](NCc1nc(-c3cccc(Br)c3)c[nH]1)CC2 ZINC000480482499 895860123 /nfs/dbraw/zinc/86/01/23/895860123.db2.gz QGDUKZLXPRNTNX-KRWDZBQOSA-N 0 3 414.351 4.264 20 0 HIADHN COC(=O)c1csc(-c2cccc(CNCc3c(C4CC4)nc4sccn34)c2)n1 ZINC000480496493 895867415 /nfs/dbraw/zinc/86/74/15/895867415.db2.gz JDAOOCLWNQGYJZ-UHFFFAOYSA-N 0 3 424.551 4.473 20 0 HIADHN FC(F)(F)C1CCN(C2CC(Nc3ccc4nnc(-c5ccccc5)n4n3)C2)CC1 ZINC000480554136 895915656 /nfs/dbraw/zinc/91/56/56/895915656.db2.gz KUONAIFOEFWQQZ-UHFFFAOYSA-N 0 3 416.451 4.009 20 0 HIADHN CN1CC[C@@H](NC(=O)[C@@H]2C[C@H]2c2ccc(OC(F)(F)F)cc2)[C@H]1c1ccccc1 ZINC000480578079 895937107 /nfs/dbraw/zinc/93/71/07/895937107.db2.gz MWLJRRTZLAWZKL-MTQWCTHYSA-N 0 3 404.432 4.250 20 0 HIADHN C[C@@H]1CN(c2ccc(CN[C@@H]3CCc4ccc(OC(F)(F)F)cc43)cn2)C[C@@H](C)O1 ZINC000480622664 895990959 /nfs/dbraw/zinc/99/09/59/895990959.db2.gz VXHRBWAMNCXNGJ-STXHMFSFSA-N 0 3 421.463 4.371 20 0 HIADHN CCOc1ccc([C@H](C)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)nc2)cc1OCC ZINC000480622729 895991794 /nfs/dbraw/zinc/99/17/94/895991794.db2.gz WCVUSYDEXYDYFH-FHWLQOOXSA-N 0 3 413.562 4.343 20 0 HIADHN C[C@@H]1CN(c2ccc(CN[C@H]3CCc4ccc(OC(F)(F)F)cc43)cn2)C[C@H](C)O1 ZINC000480622659 895991808 /nfs/dbraw/zinc/99/18/08/895991808.db2.gz VXHRBWAMNCXNGJ-MDOVXXIYSA-N 0 3 421.463 4.371 20 0 HIADHN COc1cc([C@H](C)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)nc2)ccc1OC(F)F ZINC000480627095 895993677 /nfs/dbraw/zinc/99/36/77/895993677.db2.gz RCQIXQLZEUQYKP-OAGGEKHMSA-N 0 3 421.488 4.156 20 0 HIADHN CCCN(C[C@@H]1CCCCO1)C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000480634760 896004753 /nfs/dbraw/zinc/00/47/53/896004753.db2.gz JLRCTNBAUPCLTH-NRFANRHFSA-N 0 3 405.608 4.091 20 0 HIADHN C[C@H]1[C@H](C(F)(F)F)CCCN1C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000480638139 896007048 /nfs/dbraw/zinc/00/70/48/896007048.db2.gz QWLWNUGOHLFSAT-MAUKXSAKSA-N 0 3 415.525 4.473 20 0 HIADHN C[C@H]1CN(Cc2ccccn2)CC[C@@H]1Nc1ccc2c(c1)CCC(=O)N2CC1CC1 ZINC000480684655 896047174 /nfs/dbraw/zinc/04/71/74/896047174.db2.gz UNTRHNPDRBYYNW-MBSDFSHPSA-N 0 3 404.558 4.093 20 0 HIADHN CCNC(=O)COc1ccc(CN[C@@H](C)c2sc(C(C)(C)C)nc2C)cc1OC ZINC000480743353 896105584 /nfs/dbraw/zinc/10/55/84/896105584.db2.gz ZOWOCINEINZIRW-AWEZNQCLSA-N 0 3 419.591 4.123 20 0 HIADHN CC[C@H](C)N(Cc1nc2ccccc2c(=O)[nH]1)CC1CCN(C(=O)C(C)(C)C)CC1 ZINC000480759847 896122794 /nfs/dbraw/zinc/12/27/94/896122794.db2.gz VWUZHWBXQNHLPF-KRWDZBQOSA-N 0 3 412.578 4.221 20 0 HIADHN CC(C)N(CCN(C)C)C(=O)N[C@H](c1cccc(C(F)(F)F)c1)C1CCOCC1 ZINC000505373027 914036735 /nfs/dbraw/zinc/03/67/35/914036735.db2.gz PEZCHDSCJWKXPT-IBGZPJMESA-N 0 3 415.500 4.155 20 0 HIADHN C[C@@H](N[C@H](c1ccccc1)C(C)(C)C)c1cccc(S(=O)(=O)N2CCOCC2)c1 ZINC000480770419 896134574 /nfs/dbraw/zinc/13/45/74/896134574.db2.gz RSTUUZAWRZHICB-XMSQKQJNSA-N 0 3 416.587 4.146 20 0 HIADHN Fc1ccccc1COc1ccc(CN(C[C@H]2CCCO2)[C@H]2CCSC2)cn1 ZINC000480902982 896260410 /nfs/dbraw/zinc/26/04/10/896260410.db2.gz VUEQEANCWXSSGM-VQTJNVASSA-N 0 3 402.535 4.286 20 0 HIADHN C[C@@H]1C[C@H](NCc2ccc(CS(C)(=O)=O)cc2)c2cccc(Br)c21 ZINC000480910288 896265925 /nfs/dbraw/zinc/26/59/25/896265925.db2.gz ORUSEJSHDKEVAP-ACJLOTCBSA-N 0 3 408.361 4.332 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCc1nccc2ccccc21)c1cccc(OC)c1 ZINC000505391934 914055971 /nfs/dbraw/zinc/05/59/71/914055971.db2.gz MSVWGJNFLGDXEV-HSZRJFAPSA-N 0 3 406.530 4.126 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCc1nccc2ccccc21)c1cccc(OC)c1 ZINC000505391935 914056755 /nfs/dbraw/zinc/05/67/55/914056755.db2.gz MSVWGJNFLGDXEV-QHCPKHFHSA-N 0 3 406.530 4.126 20 0 HIADHN CNS(=O)(=O)c1cccc(CN[C@@H](CCCc2ccccc2)c2ccccc2)c1 ZINC000481040743 896365665 /nfs/dbraw/zinc/36/56/65/896365665.db2.gz RHIHDLJEKGPOPQ-DEOSSOPVSA-N 0 3 408.567 4.449 20 0 HIADHN Brc1ccc2nc(CN3CCC(CCCn4ccnc4)CC3)[nH]c2c1 ZINC000481040855 896366754 /nfs/dbraw/zinc/36/67/54/896366754.db2.gz RKWCPOXAUGQKOS-UHFFFAOYSA-N 0 3 402.340 4.214 20 0 HIADHN CNS(=O)(=O)c1ccc([C@H](C)N[C@H](C)c2ccc(OCCC(C)C)cc2)cc1 ZINC000481166326 896498196 /nfs/dbraw/zinc/49/81/96/896498196.db2.gz CVCURENLPGIGCN-MSOLQXFVSA-N 0 3 404.576 4.431 20 0 HIADHN COc1cc([C@H](C)N[C@@H]2CCc3cc(Br)ccc32)ccc1OCCO ZINC000481173801 896508998 /nfs/dbraw/zinc/50/89/98/896508998.db2.gz GXUQWHPWGHAGFT-SCLBCKFNSA-N 0 3 406.320 4.167 20 0 HIADHN COc1cc([C@@H](C)N[C@H](C)c2ccc(NC(=O)NC(C)C)cc2)ccc1OCCO ZINC000481185420 896530661 /nfs/dbraw/zinc/53/06/61/896530661.db2.gz GRCNEZHDMHXETB-IAGOWNOFSA-N 0 3 415.534 4.008 20 0 HIADHN COCCC[C@H](NCC(=O)N(C)Cc1ccccc1)c1ccc(Br)cc1 ZINC000481184675 896531207 /nfs/dbraw/zinc/53/12/07/896531207.db2.gz VKBPWBUQFLCNLQ-FQEVSTJZSA-N 0 3 419.363 4.165 20 0 HIADHN Cc1ccc2c(c1)[C@H](NCc1cccc(S(=O)(=O)NCc3cccc(F)c3)c1)CC2 ZINC000481185893 896532163 /nfs/dbraw/zinc/53/21/63/896532163.db2.gz VGLZQGNTIHBHMN-XMMPIXPASA-N 0 3 424.541 4.390 20 0 HIADHN COc1cc([C@@H](C)N[C@H]2CCc3c2cc(Br)cc3F)ccc1OCCO ZINC000481185877 896532203 /nfs/dbraw/zinc/53/22/03/896532203.db2.gz VEAANCVWVGRXLH-XIKOKIGWSA-N 0 3 424.310 4.306 20 0 HIADHN COc1cc(OC)c([C@H](C)NC[C@H](c2cccc(F)c2)N2CCOCC2)cc1Cl ZINC000481239174 896588968 /nfs/dbraw/zinc/58/89/68/896588968.db2.gz FVHZOVKSIQKMSQ-MGPUTAFESA-N 0 3 422.928 4.220 20 0 HIADHN COc1cc(OC)c([C@H](C)NC[C@@H](c2cccc(F)c2)N2CCOCC2)cc1Cl ZINC000481239177 896589172 /nfs/dbraw/zinc/58/91/72/896589172.db2.gz FVHZOVKSIQKMSQ-YWZLYKJASA-N 0 3 422.928 4.220 20 0 HIADHN O=S(=O)(CCCN[C@@H]1CCCOc2c(Br)cccc21)c1ccccc1 ZINC000481246798 896598495 /nfs/dbraw/zinc/59/84/95/896598495.db2.gz OCBOQXGSRAXGRJ-GOSISDBHSA-N 0 3 424.360 4.116 20 0 HIADHN CN(C)CCN(C(=O)Cc1c[nH]c2cc(Br)ccc12)c1ccccc1 ZINC000481253345 896604601 /nfs/dbraw/zinc/60/46/01/896604601.db2.gz GRUOVQGULPXHBC-UHFFFAOYSA-N 0 3 400.320 4.068 20 0 HIADHN CN(C)C[C@@H](NC(=O)N[C@@H](c1cccc(F)c1F)C(F)(F)F)c1ccc(F)cc1 ZINC000481291483 896636997 /nfs/dbraw/zinc/63/69/97/896636997.db2.gz XYSJSBHBBRAOFG-WBVHZDCISA-N 0 3 419.369 4.309 20 0 HIADHN Cc1nc(-c2cccnc2)sc1[C@@H](C)NCc1cccc(CN2CCOCC2)c1 ZINC000481306900 896652818 /nfs/dbraw/zinc/65/28/18/896652818.db2.gz BXFQYQIBBMTREV-QGZVFWFLSA-N 0 3 408.571 4.197 20 0 HIADHN C[C@H]1CCCN(S(=O)(=O)c2ccc(CN[C@@H]3CCSc4ccccc43)cc2)C1 ZINC000481321687 896675603 /nfs/dbraw/zinc/67/56/03/896675603.db2.gz LHYSGBFZFZJSFK-LAUBAEHRSA-N 0 3 416.612 4.434 20 0 HIADHN COc1cc(C)c([C@@H](C)N[C@@H](C)c2ccc(OCC(=O)NC3CC3)cc2)cc1OC ZINC000481327746 896686533 /nfs/dbraw/zinc/68/65/33/896686533.db2.gz MBHRCYRYIXZIOX-DLBZAZTESA-N 0 3 412.530 4.081 20 0 HIADHN COc1ccc([C@@H](C)NCc2ccc(OCc3ccccn3)cc2)cc1NC(C)=O ZINC000481332317 896694324 /nfs/dbraw/zinc/69/43/24/896694324.db2.gz MXCULMQMIYLETJ-QGZVFWFLSA-N 0 3 405.498 4.478 20 0 HIADHN Cc1nc(NC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)ccc1Br ZINC000481362307 896743853 /nfs/dbraw/zinc/74/38/53/896743853.db2.gz FECPLNSODNFZIF-HNNXBMFYSA-N 0 3 417.351 4.281 20 0 HIADHN CC[C@@H]1[C@@H](C)CCN1CC(=O)N(Cc1nnc(-c2ccccc2Cl)o1)C1CC1 ZINC000481374773 896768719 /nfs/dbraw/zinc/76/87/19/896768719.db2.gz OKMKPONLITVNRV-KBXCAEBGSA-N 0 3 402.926 4.001 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N[C@H](c1ccc(F)cc1)C(F)(F)F)c1ccco1 ZINC000481390156 896792945 /nfs/dbraw/zinc/79/29/45/896792945.db2.gz IRTYYUAREQGWBX-YLQAJVPDSA-N 0 3 401.404 4.451 20 0 HIADHN Clc1ccc2c(c1)[C@@H](NCc1cccc(OCCN3CCOCC3)c1)CCCO2 ZINC000481415393 896818263 /nfs/dbraw/zinc/81/82/63/896818263.db2.gz OAQXKTNARYKHTD-QFIPXVFZSA-N 0 3 416.949 4.055 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1cnn(-c2ccc(Cl)cc2)c1)c1ccco1 ZINC000481431100 896832194 /nfs/dbraw/zinc/83/21/94/896832194.db2.gz ZWMHJGZUOGDZFQ-KSSFIOAISA-N 0 3 401.898 4.370 20 0 HIADHN CC1CCN([C@H](CNC(=O)c2ccc(-c3cncnc3)cc2F)c2ccccc2)CC1 ZINC000481512921 896881203 /nfs/dbraw/zinc/88/12/03/896881203.db2.gz XPGZPWVZNUCHBN-XMMPIXPASA-N 0 3 418.516 4.486 20 0 HIADHN Cc1ccc(OCCCC(=O)N2CCC(CN3C[C@H](C)O[C@@H](C)C3)CC2)c(Cl)c1 ZINC000481519333 896885426 /nfs/dbraw/zinc/88/54/26/896885426.db2.gz NDLLSJFFWQJVFB-OALUTQOASA-N 0 3 422.997 4.155 20 0 HIADHN C[C@H](NC[C@@H](O)COc1ccc(C(F)(F)F)cc1)c1cnn(Cc2ccccc2)c1 ZINC000481533829 896895297 /nfs/dbraw/zinc/89/52/97/896895297.db2.gz LXWOIJADHVRALY-OXJNMPFZSA-N 0 3 419.447 4.041 20 0 HIADHN COc1ccc2c(c1)[C@H](NC[C@H](O)COc1cccc(Cl)c1Cl)CCCO2 ZINC000481538974 896897587 /nfs/dbraw/zinc/89/75/87/896897587.db2.gz XLKPLIYUBGFZQV-SUMWQHHRSA-N 0 3 412.313 4.245 20 0 HIADHN COc1ccc2c(c1)[C@@H](NC[C@H](O)COc1cccc(Cl)c1Cl)CCCO2 ZINC000481538971 896898074 /nfs/dbraw/zinc/89/80/74/896898074.db2.gz XLKPLIYUBGFZQV-GUYCJALGSA-N 0 3 412.313 4.245 20 0 HIADHN C[C@H](NCc1ccc(-n2ccnc2)c(F)c1)c1ccc(I)cc1 ZINC000481547732 896912614 /nfs/dbraw/zinc/91/26/14/896912614.db2.gz TYNDELRMEKKZIJ-ZDUSSCGKSA-N 0 3 421.257 4.467 20 0 HIADHN COc1cc([C@@H](C)NCc2cccc(CN3CCO[C@H](C)C3)c2)ccc1SC ZINC000481553268 896922661 /nfs/dbraw/zinc/92/26/61/896922661.db2.gz RXJASSLCOUEPLO-QZTJIDSGSA-N 0 3 400.588 4.489 20 0 HIADHN C[C@H](NCc1cccc(CN2CCO[C@H](C)C2)c1)c1ccc(F)cc1OC(F)F ZINC000481561481 896937867 /nfs/dbraw/zinc/93/78/67/896937867.db2.gz ZRNZUEANHYRMNL-CVEARBPZSA-N 0 3 408.464 4.499 20 0 HIADHN O[C@@H](CN[C@@H]1CCSc2c(F)cccc21)COc1ccc(C(F)(F)F)cc1 ZINC000481567953 896946691 /nfs/dbraw/zinc/94/66/91/896946691.db2.gz BNABYPJWJHRIIW-SUMWQHHRSA-N 0 3 401.425 4.411 20 0 HIADHN O=C(Nc1cccc(CN[C@@H]2CCc3cc(Br)ccc32)c1)[C@H]1CCCO1 ZINC000481569935 896948944 /nfs/dbraw/zinc/94/89/44/896948944.db2.gz KMCGVMAFLUNGEU-WOJBJXKFSA-N 0 3 415.331 4.344 20 0 HIADHN CC[C@H](N[C@@H](c1ccc(OC)cc1)C1CC1)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000481640503 897024973 /nfs/dbraw/zinc/02/49/73/897024973.db2.gz KOWQNRJDJMZSLU-PZJWPPBQSA-N 0 3 422.978 4.449 20 0 HIADHN C[C@H](OC[C@@H](O)CN1CCC[C@]2(C1)OCc1ccccc12)c1ccc(Cl)cc1 ZINC000481699423 897086653 /nfs/dbraw/zinc/08/66/53/897086653.db2.gz BEERZZPKWMAPKJ-JWNTYJGQSA-N 0 3 401.934 4.300 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)Nc1ccc2c(c1)CCC(=O)N2CC1CC1)c1ccco1 ZINC000481717002 897109898 /nfs/dbraw/zinc/10/98/98/897109898.db2.gz UWPOTKSSSUTFMO-OXQOHEQNSA-N 0 3 424.545 4.220 20 0 HIADHN Cc1nc(-c2ccccc2C)sc1C(=O)NCCCCN1C[C@H](C)O[C@@H](C)C1 ZINC000481780239 897162561 /nfs/dbraw/zinc/16/25/61/897162561.db2.gz NOIMJHNIXYTGDW-IRXDYDNUSA-N 0 3 401.576 4.046 20 0 HIADHN Cc1csc2nc(CNC3(c4ccc(Br)cc4)CCCC3)cc(=O)n12 ZINC000505462661 914133083 /nfs/dbraw/zinc/13/30/83/914133083.db2.gz SRZGBUUIEXXBJF-UHFFFAOYSA-N 0 3 418.360 4.386 20 0 HIADHN C[C@@H](NC(=O)N(C)C1CCN(CCc2ccccn2)CC1)[C@@H](C)C1CCCCC1 ZINC000481783497 897165570 /nfs/dbraw/zinc/16/55/70/897165570.db2.gz GEZSHFJLJRWJAF-WOJBJXKFSA-N 0 3 400.611 4.335 20 0 HIADHN COc1cccc(N2CC[C@H](CN[C@H](C)c3nnn(-c4ccc(C)cc4)c3C)C2)c1 ZINC000481934424 897319837 /nfs/dbraw/zinc/31/98/37/897319837.db2.gz RUICWHOGHREACI-UYAOXDASSA-N 0 3 405.546 4.070 20 0 HIADHN Cc1ccc(I)cc1NC(=O)NC[C@H](c1ccccc1)N(C)C ZINC000481962308 897352250 /nfs/dbraw/zinc/35/22/50/897352250.db2.gz WTYRSWRWZCFUCV-QGZVFWFLSA-N 0 3 423.298 4.024 20 0 HIADHN CCO[C@H](CN[C@@H](CC)c1ccc(Cl)c(S(=O)(=O)NC)c1)c1ccccc1 ZINC000481989360 897383927 /nfs/dbraw/zinc/38/39/27/897383927.db2.gz ALDMFVIRVJOISO-RBUKOAKNSA-N 0 3 410.967 4.067 20 0 HIADHN COC(=O)c1ccccc1-c1ccc(CN2CCC(OC[C@@H]3CCCCO3)CC2)o1 ZINC000481988343 897384865 /nfs/dbraw/zinc/38/48/65/897384865.db2.gz DYSLOEGUWRIAOD-FQEVSTJZSA-N 0 3 413.514 4.283 20 0 HIADHN COc1ccc2[nH]c(C(=O)Nc3cc(C)cc(N4CCN(C(C)C)CC4)c3)cc2c1 ZINC000482009989 897409087 /nfs/dbraw/zinc/40/90/87/897409087.db2.gz AKAYGNOBZCBUCK-UHFFFAOYSA-N 0 3 406.530 4.268 20 0 HIADHN CC1=NN(c2ccc(C(=O)Nc3cc(C)cc(N4CCN(C(C)C)CC4)c3)cc2)CC1 ZINC000482025525 897432555 /nfs/dbraw/zinc/43/25/55/897432555.db2.gz KBBQBRJCHUNFEP-UHFFFAOYSA-N 0 3 419.573 4.364 20 0 HIADHN C[C@@H](c1ccc(F)cc1F)N1CCN(C(=O)c2cccc(CN3CCCC3)c2)CC1 ZINC000505481897 914163089 /nfs/dbraw/zinc/16/30/89/914163089.db2.gz UQPXDWLNHHQCQV-SFHVURJKSA-N 0 3 413.512 4.080 20 0 HIADHN Cc1nc(-c2ccccc2)sc1[C@H](C)NCc1ccc([C@]2(C)NC(=O)NC2=O)cc1 ZINC000482073194 897509633 /nfs/dbraw/zinc/50/96/33/897509633.db2.gz JRVPAZWZHIVYSY-PSLXWICFSA-N 0 3 420.538 4.024 20 0 HIADHN Cc1ccc(-n2cccn2)cc1NC(=O)NC[C@@H](c1ccc(OC(C)C)cc1)N(C)C ZINC000482078929 897517935 /nfs/dbraw/zinc/51/79/35/897517935.db2.gz RBGSAIOCZHKRSG-QHCPKHFHSA-N 0 3 421.545 4.392 20 0 HIADHN CC[C@@H](C)n1ncc(NC(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)c1C ZINC000482100704 897547883 /nfs/dbraw/zinc/54/78/83/897547883.db2.gz IRBYYLDCHQKPTP-IIBYNOLFSA-N 0 3 401.555 4.374 20 0 HIADHN C[C@@]1(c2ccc(CN[C@H]3CCCSc4ccc(Cl)cc43)cc2)NC(=O)NC1=O ZINC000482108583 897558776 /nfs/dbraw/zinc/55/87/76/897558776.db2.gz PMXAPMZPRJKWIY-UWJYYQICSA-N 0 3 415.946 4.111 20 0 HIADHN COc1cc([C@H](C)NCc2ccc(NC(=O)c3cccnc3)cc2)cc(OC)c1OC ZINC000482113034 897563314 /nfs/dbraw/zinc/56/33/14/897563314.db2.gz WXKPEBRTMHCZHA-INIZCTEOSA-N 0 3 421.497 4.211 20 0 HIADHN CCS(=O)(=O)Nc1ccc([C@@H](C)NCc2ccc(Oc3ccccc3)nc2)cc1 ZINC000482115157 897565982 /nfs/dbraw/zinc/56/59/82/897565982.db2.gz QCUSFWHZDBSNIV-QGZVFWFLSA-N 0 3 411.527 4.486 20 0 HIADHN CC[C@H](NCc1ccc(NC(=O)c2ccncc2)cc1)c1ccc2c(c1)OCCO2 ZINC000482118518 897570519 /nfs/dbraw/zinc/57/05/19/897570519.db2.gz IOVAXCCBEVBZBB-NRFANRHFSA-N 0 3 403.482 4.346 20 0 HIADHN C[C@@H](NCCC(=O)N1CCCCCC1)c1ccc(OC(F)F)cc1OC(F)F ZINC000482126477 897582320 /nfs/dbraw/zinc/58/23/20/897582320.db2.gz MXYWAAFDLHRSKN-CYBMUJFWSA-N 0 3 406.420 4.333 20 0 HIADHN CCO[C@@H]1C[C@@H](NCC(=O)Nc2c(C)nn(-c3ccc(C)cc3)c2C)C1(CC)CC ZINC000482148403 897610599 /nfs/dbraw/zinc/61/05/99/897610599.db2.gz LAHMHHZJERRENS-NHCUHLMSSA-N 0 3 412.578 4.309 20 0 HIADHN COC(=O)c1ccccc1-c1ccc(CN[C@@H]2CCN(C(=O)C3CCCCC3)C2)o1 ZINC000482209950 897689973 /nfs/dbraw/zinc/68/99/73/897689973.db2.gz MNGMSDYXIOSVPW-GOSISDBHSA-N 0 3 410.514 4.004 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)NC[C@H]1CCCC[C@@H]1C(F)(F)F ZINC000482218575 897697797 /nfs/dbraw/zinc/69/77/97/897697797.db2.gz UTMOVGBPAHFMSH-QUCCMNQESA-N 0 3 411.512 4.074 20 0 HIADHN CCC[C@H](N[C@H](CC)c1ccc2c(c1)OCCO2)C(=O)N1CCc2sccc2C1 ZINC000482241248 897721670 /nfs/dbraw/zinc/72/16/70/897721670.db2.gz IFDACBIDTFPWEK-MOPGFXCFSA-N 0 3 414.571 4.314 20 0 HIADHN CC(C)c1c(C(=O)NCCCN2CCc3ccccc3C2)cnn1-c1ccc(F)cc1 ZINC000482248394 897729258 /nfs/dbraw/zinc/72/92/58/897729258.db2.gz YISUFGRCPLIJNF-UHFFFAOYSA-N 0 3 420.532 4.313 20 0 HIADHN CCCN(Cc1ccccc1OCC(=O)N1CCCC1)[C@@H]1CCCc2cccnc21 ZINC000482279175 897769174 /nfs/dbraw/zinc/76/91/74/897769174.db2.gz ZPKPMQRIIQJVAY-JOCHJYFZSA-N 0 3 407.558 4.372 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CN1CCC(O)(Cc2ccc(F)cc2)CC1 ZINC000482280332 897773193 /nfs/dbraw/zinc/77/31/93/897773193.db2.gz HAIOTYNFINKJPC-UHFFFAOYSA-N 0 3 407.533 4.257 20 0 HIADHN CN(C)CCN(C[C@@H]1CCCO1)C(=O)N[C@H](c1cccc2ccccc21)C(F)(F)F ZINC000482401969 897941849 /nfs/dbraw/zinc/94/18/49/897941849.db2.gz GMNMPMFTORZVTN-FXAWDEMLSA-N 0 3 423.479 4.195 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)N[C@@H](c1c(F)cccc1F)C(F)(F)F ZINC000482419811 897970482 /nfs/dbraw/zinc/97/04/82/897970482.db2.gz WHNPPRQPNNWRPP-INIZCTEOSA-N 0 3 421.435 4.403 20 0 HIADHN O=C(N[C@@H](c1c(F)cccc1F)C(F)(F)F)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000482421845 897973785 /nfs/dbraw/zinc/97/37/85/897973785.db2.gz CLIGHADNDRIKIJ-KSSFIOAISA-N 0 3 413.390 4.142 20 0 HIADHN Cc1cc(CN2CC(C)(C)O[C@]3(CCCOC3)C2)cc(C)c1OCc1ccccn1 ZINC000482435553 897994780 /nfs/dbraw/zinc/99/47/80/897994780.db2.gz ATZUDGLCPOYQQL-RUZDIDTESA-N 0 3 410.558 4.437 20 0 HIADHN CCO[C@@H]1C[C@H](NCc2ccccc2OCc2ccccn2)[C@@H]1Oc1ccccc1 ZINC000482494816 898074013 /nfs/dbraw/zinc/07/40/13/898074013.db2.gz GJPTVPYMWJUZJZ-CAOCKLPOSA-N 0 3 404.510 4.375 20 0 HIADHN COc1cc(CN2CCC([C@H](C)NC(C)=O)CC2)ccc1OCc1ccc(F)cc1 ZINC000482501235 898082367 /nfs/dbraw/zinc/08/23/67/898082367.db2.gz IYVHAHLURDFYEQ-KRWDZBQOSA-N 0 3 414.521 4.150 20 0 HIADHN O=C(N[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1)c1cccc(CN2CCCC2)c1 ZINC000482527267 898114983 /nfs/dbraw/zinc/11/49/83/898114983.db2.gz DBAIYTQQISPQMX-GOSISDBHSA-N 0 3 401.913 4.084 20 0 HIADHN C[C@H](N[C@@H](C)c1cc(F)ccc1N1CCN(C)CC1)c1ccc(-n2cccn2)cc1 ZINC000482542727 898131506 /nfs/dbraw/zinc/13/15/06/898131506.db2.gz YQQFFRUBAAGWQU-OALUTQOASA-N 0 3 407.537 4.175 20 0 HIADHN C[C@@H](N[C@@H](C)c1cnn(Cc2ccccc2)c1)c1cc(F)ccc1N1CCN(C)CC1 ZINC000482550216 898140112 /nfs/dbraw/zinc/14/01/12/898140112.db2.gz PNRHHNODOBAWEH-VQTJNVASSA-N 0 3 421.564 4.234 20 0 HIADHN COc1ccc(OC)c([C@H](C)N[C@H](C)c2cc(F)ccc2N2CCN(C)CC2)c1 ZINC000482553198 898143743 /nfs/dbraw/zinc/14/37/43/898143743.db2.gz DJMXHLCCXTVDNV-SJORKVTESA-N 0 3 401.526 4.007 20 0 HIADHN COc1cc(C)c([C@@H](C)N[C@H](C)c2cc(F)ccc2N2CCN(C)CC2)cc1OC ZINC000482567954 898161821 /nfs/dbraw/zinc/16/18/21/898161821.db2.gz UODLPAZRUVAURR-QZTJIDSGSA-N 0 3 415.553 4.315 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)c1cccc(S(=O)(=O)Cc2ccccc2)c1 ZINC000482584831 898182380 /nfs/dbraw/zinc/18/23/80/898182380.db2.gz JMPQNFVUJVQVCK-UHFFFAOYSA-N 0 3 422.550 4.283 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)c1cc(=O)[nH]c2ccc(Br)cc21 ZINC000482590139 898189034 /nfs/dbraw/zinc/18/90/34/898189034.db2.gz VQFHZRJXERMPKE-UHFFFAOYSA-N 0 3 414.303 4.325 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)c1cnn(-c2ccc(Br)cc2)c1 ZINC000482607579 898207617 /nfs/dbraw/zinc/20/76/17/898207617.db2.gz IREDUPKMVMXLGY-UHFFFAOYSA-N 0 3 413.319 4.257 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2ccc3c(c2)CCC(=O)N3CC2CC2)N(C)C)cc1 ZINC000482610804 898212164 /nfs/dbraw/zinc/21/21/64/898212164.db2.gz DGNIIIROMKMYSX-HSZRJFAPSA-N 0 3 420.557 4.109 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)CCc1nnc(-c2cc3ccccc3o2)o1 ZINC000482615315 898216469 /nfs/dbraw/zinc/21/64/69/898216469.db2.gz ISZHGLXKOFTWSK-UHFFFAOYSA-N 0 3 404.470 4.424 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)c1nnn(-c2ccccc2F)c1C(F)(F)F ZINC000482629705 898233167 /nfs/dbraw/zinc/23/31/67/898233167.db2.gz MGBQZXIFHCEKPN-UHFFFAOYSA-N 0 3 421.398 4.048 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)[C@@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O ZINC000482629517 898234130 /nfs/dbraw/zinc/23/41/30/898234130.db2.gz LIMRHEKOIYATDE-INIZCTEOSA-N 0 3 420.340 4.355 20 0 HIADHN Cc1noc(C)c1CCN[C@H](C)c1cccc(S(=O)(=O)NC2CCCCCC2)c1 ZINC000482651930 898254920 /nfs/dbraw/zinc/25/49/20/898254920.db2.gz PFCNXYCEECTLBB-MRXNPFEDSA-N 0 3 419.591 4.186 20 0 HIADHN CN(Cc1ccc(F)cc1Br)C(=O)c1cccc(CN2CCCC2)c1 ZINC000482770517 898378598 /nfs/dbraw/zinc/37/85/98/898378598.db2.gz VFNAUVYLGZFBJH-UHFFFAOYSA-N 0 3 405.311 4.456 20 0 HIADHN CC(C)c1nn(-c2ccc(Br)cc2)cc1CNCC[C@H](C)[S@](C)=O ZINC000482787010 898395107 /nfs/dbraw/zinc/39/51/07/898395107.db2.gz IXFWJTNMWAMEKZ-BSEYFRJRSA-N 0 3 412.397 4.005 20 0 HIADHN CCOc1ccc([C@H](NC(=O)N2CCN(C3CCCC3)CC2)c2ccccc2)cc1 ZINC000505565202 914268877 /nfs/dbraw/zinc/26/88/77/914268877.db2.gz ICVHINMXFOBKBW-XMMPIXPASA-N 0 3 407.558 4.445 20 0 HIADHN CO[C@]1(C)CCCN([C@H](C)C(=O)Nc2ccc(NC(=O)c3cccs3)cc2)CC1 ZINC000483014532 898671052 /nfs/dbraw/zinc/67/10/52/898671052.db2.gz IKJJIBQAUOXYNW-OPAMFIHVSA-N 0 3 415.559 4.218 20 0 HIADHN COc1ccc(NC(=O)N2CCN(C3CCCCC3)CC2)cc1OCC(F)(F)F ZINC000483029299 898693037 /nfs/dbraw/zinc/69/30/37/898693037.db2.gz NXIMRXXIQNOLBG-UHFFFAOYSA-N 0 3 415.456 4.119 20 0 HIADHN CC(C)C[C@@](C)(NCC(=O)N(C)c1nccs1)c1cccc(Br)c1 ZINC000483048329 898719010 /nfs/dbraw/zinc/71/90/10/898719010.db2.gz HQOCKAMYURSIII-GOSISDBHSA-N 0 3 410.381 4.420 20 0 HIADHN CC(C)C[C@](C)(NCC(=O)NCc1cccnc1)c1cccc(Br)c1 ZINC000483047534 898719561 /nfs/dbraw/zinc/71/95/61/898719561.db2.gz RTBTYWQXOFQXPD-FQEVSTJZSA-N 0 3 404.352 4.011 20 0 HIADHN CC(C)C[C@](C)(N[C@@H]1CCN(C2CCOCC2)C1=O)c1cccc(Br)c1 ZINC000483060194 898736665 /nfs/dbraw/zinc/73/66/65/898736665.db2.gz VMAFCRUWSPJTKJ-CTNGQTDRSA-N 0 3 423.395 4.080 20 0 HIADHN CCCC[C@](C)(NCC(=O)NCc1cccnc1)c1cccc(Br)c1 ZINC000483087758 898774894 /nfs/dbraw/zinc/77/48/94/898774894.db2.gz KDQNFZWFLBUKIO-FQEVSTJZSA-N 0 3 404.352 4.156 20 0 HIADHN C[C@H](N[C@@H](Cc1ccccc1)[C@@H](O)C(F)F)c1ccc(F)c(Br)c1 ZINC000483133543 898815290 /nfs/dbraw/zinc/81/52/90/898815290.db2.gz ZYWOKVJXMOJCHL-MZPVMMEZSA-N 0 3 402.254 4.476 20 0 HIADHN Cc1ccc(C[C@H](N[C@H](C)c2ccc(NS(C)(=O)=O)cc2)c2ccccn2)cc1 ZINC000483134884 898816103 /nfs/dbraw/zinc/81/61/03/898816103.db2.gz NJVCIOXFULJTNB-JPYJTQIMSA-N 0 3 409.555 4.396 20 0 HIADHN COc1ccc(S(=O)(=O)[N-]c2cccc(C[NH2+][C@H](C)c3cccs3)c2)cc1 ZINC000483144452 898823502 /nfs/dbraw/zinc/82/35/02/898823502.db2.gz ZFJNWRPWOKGICY-OAHLLOKOSA-N 0 3 402.541 4.408 20 0 HIADHN C[C@@H]1CCN(C(=O)c2ccc(-c3n[nH]c(C4CC4)n3)cc2)CCN1Cc1ccccc1 ZINC000483154022 898828070 /nfs/dbraw/zinc/82/80/70/898828070.db2.gz KCUJORIQGXVJCL-GOSISDBHSA-N 0 3 415.541 4.086 20 0 HIADHN Cc1cc(C)n(-c2ccc(C(=O)NC[C@@H](c3ccccc3)N3CCCC3)cc2F)n1 ZINC000483160971 898832427 /nfs/dbraw/zinc/83/24/27/898832427.db2.gz BAIUYQZOHWZTLS-QHCPKHFHSA-N 0 3 406.505 4.195 20 0 HIADHN Cc1c([C@H](C)NC2CCN(c3cccc(C)n3)CC2)nnn1-c1cccc(Cl)c1 ZINC000483166978 898837023 /nfs/dbraw/zinc/83/70/23/898837023.db2.gz HGZQCPYTZOAEJY-INIZCTEOSA-N 0 3 410.953 4.252 20 0 HIADHN C[C@H](NCCNc1nccc(C(F)(F)F)n1)c1cc(Br)ccc1F ZINC000483230923 898874548 /nfs/dbraw/zinc/87/45/48/898874548.db2.gz MOKNDLDSBRPGAZ-VIFPVBQESA-N 0 3 407.209 4.160 20 0 HIADHN Cc1nn(C)c(Sc2ccccc2)c1C(=O)N[C@H](C)[C@@H](c1ccccc1)N(C)C ZINC000505592047 914299920 /nfs/dbraw/zinc/29/99/20/914299920.db2.gz QRIPKPFTYZMIFB-UTKZUKDTSA-N 0 3 408.571 4.301 20 0 HIADHN C[C@H](NC(=O)C1(c2ccccc2Br)CC1)[C@@H](c1ccccc1)N(C)C ZINC000505597207 914302687 /nfs/dbraw/zinc/30/26/87/914302687.db2.gz QTZOTKHHXCLTOX-KXBFYZLASA-N 0 3 401.348 4.288 20 0 HIADHN CCCN1CCN(c2ccccc2CN[C@H](C)c2nc(-c3cccc(F)c3)no2)CC1 ZINC000483361780 898999548 /nfs/dbraw/zinc/99/95/48/898999548.db2.gz VLRPUQHVLWBNRY-GOSISDBHSA-N 0 3 423.536 4.259 20 0 HIADHN C[C@H](NC(=O)Nc1cc(C(F)(F)F)ccc1Br)C1=CCN(C)CC1 ZINC000483365001 899002739 /nfs/dbraw/zinc/00/27/39/899002739.db2.gz MIDOTCHHUUMNRE-JTQLQIEISA-N 0 3 406.246 4.240 20 0 HIADHN CS[C@H]1CN(C(=O)CCC(=O)c2cc(Cl)sc2Cl)C[C@H]1N1CCCC1 ZINC000483394632 899029573 /nfs/dbraw/zinc/02/95/73/899029573.db2.gz NURUZNRCVQNAOF-OCCSQVGLSA-N 0 3 421.415 4.056 20 0 HIADHN CS[C@@H]1CN(C(=O)[C@@H](C)c2cccc(C(=O)c3ccccc3)c2)C[C@@H]1N1CCCC1 ZINC000483398335 899032828 /nfs/dbraw/zinc/03/28/28/899032828.db2.gz XQHREEINDAUHLX-OFAXGOBFSA-N 0 3 422.594 4.059 20 0 HIADHN C[C@H](NC(=O)C1(c2cccc(Br)c2)CC1)[C@H](c1ccccc1)N(C)C ZINC000505606032 914310875 /nfs/dbraw/zinc/31/08/75/914310875.db2.gz JMIVBPXQHXMTSZ-HNAYVOBHSA-N 0 3 401.348 4.288 20 0 HIADHN COc1ccccc1OCc1ccc(C(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)o1 ZINC000505610885 914314758 /nfs/dbraw/zinc/31/47/58/914314758.db2.gz NBJVRJDRUJGVLG-GAJHUEQPSA-N 0 3 408.498 4.288 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1oc(C(C)C)nc1C ZINC000483469066 899112734 /nfs/dbraw/zinc/11/27/34/899112734.db2.gz LKALXMYTTULOOE-LJQANCHMSA-N 0 3 407.518 4.311 20 0 HIADHN C[C@H](NC(=O)c1cnn(-c2ccccc2)c1C(F)(F)F)[C@H](c1ccccc1)N(C)C ZINC000505615407 914317638 /nfs/dbraw/zinc/31/76/38/914317638.db2.gz XNZRRLVSLMULGY-HNAYVOBHSA-N 0 3 416.447 4.312 20 0 HIADHN O=C(CN1CCN(C2CCCCC2)CC1)N[C@@H](c1ccc(F)cc1)C1CCCC1 ZINC000483493998 899150481 /nfs/dbraw/zinc/15/04/81/899150481.db2.gz SWXVRANGYFJHKB-XMMPIXPASA-N 0 3 401.570 4.124 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3ccc(OC4CCC4)c(F)c3)CC2)C[C@@H](C)O1 ZINC000483513422 899174919 /nfs/dbraw/zinc/17/49/19/899174919.db2.gz OHCGWPKHEWJVJW-IAGOWNOFSA-N 0 3 419.541 4.110 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)Nc1ccc(OCC(F)F)cc1 ZINC000483548591 899209057 /nfs/dbraw/zinc/20/90/57/899209057.db2.gz WLYULXSMVOXYIU-UHFFFAOYSA-N 0 3 413.415 4.204 20 0 HIADHN Cc1nn(-c2ccccc2Cl)c2sc(C(=O)N(CCN(C)C)C3CC3)cc12 ZINC000505628067 914327166 /nfs/dbraw/zinc/32/71/66/914327166.db2.gz APSIFAVZLYWCKM-UHFFFAOYSA-N 0 3 402.951 4.215 20 0 HIADHN CC(C)C(=O)Nc1cccc(NC(=O)[C@@H]2CN(Cc3ccccc3)CCC2(F)F)c1 ZINC000505632434 914332026 /nfs/dbraw/zinc/33/20/26/914332026.db2.gz JRRIZOFCFSQFBN-FQEVSTJZSA-N 0 3 415.484 4.377 20 0 HIADHN CC(C)C(=O)Nc1ccc(Cl)c(C(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)c1 ZINC000505633735 914333031 /nfs/dbraw/zinc/33/30/31/914333031.db2.gz LONZHJQOVDPHHC-QRWLVFNGSA-N 0 3 401.938 4.356 20 0 HIADHN COc1cccc(-c2noc([C@H](C)NC3CCC(C(=O)OC(C)(C)C)CC3)n2)c1 ZINC000483656906 899315613 /nfs/dbraw/zinc/31/56/13/899315613.db2.gz HEYRUHJHKROJKP-UQPPLGOBSA-N 0 3 401.507 4.296 20 0 HIADHN C[C@H](NC(=O)c1cccc(C(=O)N(C)c2ccccc2)c1)[C@H](c1ccccc1)N(C)C ZINC000505635299 914335916 /nfs/dbraw/zinc/33/59/16/914335916.db2.gz SEOJJVBOIFXTDK-YADARESESA-N 0 3 415.537 4.384 20 0 HIADHN CCOc1ccccc1[C@@H](CC(C)C)N[C@@H](C)c1ccc(S(=O)(=O)NC)cc1 ZINC000483706629 899361592 /nfs/dbraw/zinc/36/15/92/899361592.db2.gz CUPGXASGZWMDDV-LAUBAEHRSA-N 0 3 404.576 4.431 20 0 HIADHN Cn1ccc(C(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)c1C1CCC1 ZINC000483806466 899482600 /nfs/dbraw/zinc/48/26/00/899482600.db2.gz SVRJLSFNYLPPHY-FQEVSTJZSA-N 0 3 403.530 4.188 20 0 HIADHN CC[C@H](N[C@H](C)c1cccc(-n2ccnc2)c1)c1ccccc1OCC(=O)N(C)C ZINC000483816106 899493588 /nfs/dbraw/zinc/49/35/88/899493588.db2.gz DMBSNGYKMYTMJZ-GCJKJVERSA-N 0 3 406.530 4.141 20 0 HIADHN C[C@@H](SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)N(CCN(C)C)C1CC1 ZINC000505656949 914354939 /nfs/dbraw/zinc/35/49/39/914354939.db2.gz GNTMEHKRFMKLLA-CQSZACIVSA-N 0 3 407.967 4.169 20 0 HIADHN CC[C@@H]1Oc2cc([C@H](C)N[C@H](C)c3ccc4c(c3)C(C)(C)C(=O)N4)ccc2NC1=O ZINC000483857130 899541052 /nfs/dbraw/zinc/54/10/52/899541052.db2.gz JZZYGRDMNOTLQQ-CKNLXJGOSA-N 0 3 407.514 4.438 20 0 HIADHN CCCN(C)[C@H](CNC(=O)Nc1cc([C@H]2CCCO2)nn1C)c1ccc(Cl)cc1 ZINC000483862464 899544964 /nfs/dbraw/zinc/54/49/64/899544964.db2.gz ZXAIYCCLJBTXSB-RTBURBONSA-N 0 3 419.957 4.130 20 0 HIADHN O=C(NCc1ccc(F)cc1)C1CCN(CCOc2ccc(Cl)c(F)c2)CC1 ZINC000483930752 899590740 /nfs/dbraw/zinc/59/07/40/899590740.db2.gz IDSVOORYZILRND-UHFFFAOYSA-N 0 3 408.876 4.025 20 0 HIADHN CC[C@H](CNC(=O)Nc1ccccc1OCCCOC)N1CCc2ccccc2C1 ZINC000505666584 914364181 /nfs/dbraw/zinc/36/41/81/914364181.db2.gz UIEXQUUSUZVIAK-OAQYLSRUSA-N 0 3 411.546 4.060 20 0 HIADHN C[C@@H]1CCN(C(=O)Nc2ccc3oc(N(C)C)nc3c2)CCN1Cc1ccccc1 ZINC000484036138 899668340 /nfs/dbraw/zinc/66/83/40/899668340.db2.gz HHQNTZAIPUDKBS-QGZVFWFLSA-N 0 3 407.518 4.022 20 0 HIADHN CCCCCOc1ccc(C(=O)CCC(=O)N2CC[C@]3(C2)CCCN(C)C3)cc1 ZINC000505688017 914377858 /nfs/dbraw/zinc/37/78/58/914377858.db2.gz LYOZUNOODYZNHI-XMMPIXPASA-N 0 3 400.563 4.163 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)N[C@H](CC(F)(F)F)c2ccccc2)cc1 ZINC000484284472 899850957 /nfs/dbraw/zinc/85/09/57/899850957.db2.gz PDQOXQWFLUNJTF-MOPGFXCFSA-N 0 3 409.452 4.291 20 0 HIADHN CSc1cccc(N(C(=O)[C@@H]2Oc3ccccc3O[C@H]2C)C2CCN(C)CC2)c1 ZINC000484290806 899855217 /nfs/dbraw/zinc/85/52/17/899855217.db2.gz CZCQGXJHDRBVCG-KSFYIVLOSA-N 0 3 412.555 4.064 20 0 HIADHN CC(C)[C@@](C)(N[C@H]1CCN(CC(F)(F)F)C1=O)c1ccc(Br)cc1 ZINC000484343356 899893187 /nfs/dbraw/zinc/89/31/87/899893187.db2.gz RLCNOAHPQKXCNP-GOEBONIOSA-N 0 3 407.274 4.073 20 0 HIADHN O[C@@]1(CN[C@@H](Cc2ccccc2F)c2ccccc2Br)CCSC1 ZINC000484473199 899966274 /nfs/dbraw/zinc/96/62/74/899966274.db2.gz MBGHRBUFRJCXHB-RBUKOAKNSA-N 0 3 410.352 4.330 20 0 HIADHN COc1cc(C[C@@H](CO)CN[C@@H](C)c2nc(-c3ccccc3)cs2)cc(OC)c1 ZINC000484477012 899969275 /nfs/dbraw/zinc/96/92/75/899969275.db2.gz PWSADAIFKGSLQH-FUHWJXTLSA-N 0 3 412.555 4.329 20 0 HIADHN C[C@@H](N[C@@H]1CCN(C(=O)CCc2ccccc2)C1)c1ccc(F)cc1OC(F)F ZINC000484501918 899992349 /nfs/dbraw/zinc/99/23/49/899992349.db2.gz MVBLTGHRCKHRRJ-CRAIPNDOSA-N 0 3 406.448 4.311 20 0 HIADHN CN1CCC[C@@H](N[C@@H]2CCCc3nc(-c4ccccc4Br)sc32)C1=O ZINC000484506072 899996181 /nfs/dbraw/zinc/99/61/81/899996181.db2.gz UGVBROXSFFWYIU-GDBMZVCRSA-N 0 3 420.376 4.160 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2cccc(Oc3ccccn3)c2)c1 ZINC000484517759 900006402 /nfs/dbraw/zinc/00/64/02/900006402.db2.gz GRPCUVAHVLSSNQ-UHFFFAOYSA-N 0 3 420.513 4.478 20 0 HIADHN CCOc1cc(Cl)ccc1NC(=O)N(CCN(C)C)Cc1cccc(OC)c1 ZINC000484531679 900018710 /nfs/dbraw/zinc/01/87/10/900018710.db2.gz UTUOEONECKPMNI-UHFFFAOYSA-N 0 3 405.926 4.343 20 0 HIADHN CNC(=O)c1cccc(CN[C@H](c2ccc(F)c(F)c2)C(C)(C)N2CCCC2)c1 ZINC000484546186 900027658 /nfs/dbraw/zinc/02/76/58/900027658.db2.gz XGJVLTVGFTXFHZ-OAQYLSRUSA-N 0 3 401.501 4.030 20 0 HIADHN CCCOc1ccc(O[C@H]2CCCC[C@@H]2NCc2cc(=O)n3ccsc3n2)cc1 ZINC000484621536 900075172 /nfs/dbraw/zinc/07/51/72/900075172.db2.gz ACHNQGPORQBQMY-PMACEKPBSA-N 0 3 413.543 4.025 20 0 HIADHN Cc1nn(C)c(=O)c(-c2nc(CN[C@@H]3CCCC[C@@H]3c3ccccc3)cs2)c1C ZINC000484640920 900088140 /nfs/dbraw/zinc/08/81/40/900088140.db2.gz AANMJHHTMIZJOJ-WOJBJXKFSA-N 0 3 408.571 4.337 20 0 HIADHN Cc1nnccc1NC(=O)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000484668430 900111574 /nfs/dbraw/zinc/11/15/74/900111574.db2.gz ZURSZPUBWNPGCY-UHFFFAOYSA-N 0 3 408.333 4.222 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)NCc1ccc(F)cc1Br)c1ccco1 ZINC000484721019 900152104 /nfs/dbraw/zinc/15/21/04/900152104.db2.gz WQXJSSOCDPCQBZ-MLGOLLRUSA-N 0 3 412.303 4.110 20 0 HIADHN Cc1ccc(-n2ncc(NC(=O)N(CCN(C)C)Cc3ccco3)c2C(C)C)cc1 ZINC000484806988 900211168 /nfs/dbraw/zinc/21/11/68/900211168.db2.gz AFJOJFFELVARSB-UHFFFAOYSA-N 0 3 409.534 4.493 20 0 HIADHN COc1ccc2c(c1NC(=O)N(CCN(C)C)Cc1ccc(F)cc1F)CCC2 ZINC000485001841 900353428 /nfs/dbraw/zinc/35/34/28/900353428.db2.gz LCPXNYCLJBPBTP-UHFFFAOYSA-N 0 3 403.473 4.058 20 0 HIADHN Cc1cc(Br)ccc1CC(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000485079845 900396720 /nfs/dbraw/zinc/39/67/20/900396720.db2.gz PRGMIBWQADVZCU-KRWDZBQOSA-N 0 3 407.377 4.315 20 0 HIADHN COCCN(CC(=O)N1CC=C(c2c[nH]c3ccccc32)CC1)C[C@H]1CC=CCC1 ZINC000485106251 900414513 /nfs/dbraw/zinc/41/45/13/900414513.db2.gz JOIYALNKKZKYGK-FQEVSTJZSA-N 0 3 407.558 4.088 20 0 HIADHN COc1ccccc1-c1csc(C2CCN(C[C@H](O)COc3ccccc3)CC2)n1 ZINC000485130387 900433284 /nfs/dbraw/zinc/43/32/84/900433284.db2.gz SQDWMZFJCAJYIZ-IBGZPJMESA-N 0 3 424.566 4.438 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(N[C@@H](C)[C@@H]3CC[N@H+](Cc4ccccc4)C3)nc2)n1 ZINC000485191005 900485341 /nfs/dbraw/zinc/48/53/41/900485341.db2.gz VFBXBJQTKDRZSV-FXAWDEMLSA-N 0 3 403.530 4.129 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(N[C@@H](C)[C@@H]3CC[N@@H+](Cc4ccccc4)C3)nc2)n1 ZINC000485191005 900485348 /nfs/dbraw/zinc/48/53/48/900485348.db2.gz VFBXBJQTKDRZSV-FXAWDEMLSA-N 0 3 403.530 4.129 20 0 HIADHN CCc1c(NC(=O)N(CCN(C)C)Cc2cccs2)cnn1-c1ccccc1C ZINC000485366604 900663260 /nfs/dbraw/zinc/66/32/60/900663260.db2.gz YFXAOIKZAFZYOE-UHFFFAOYSA-N 0 3 411.575 4.400 20 0 HIADHN CC(C)CC(=O)Nc1cccc(CNC(=O)N[C@@H]2CCN(Cc3ccccc3)[C@@H]2C)c1 ZINC000485408805 900706677 /nfs/dbraw/zinc/70/66/77/900706677.db2.gz VNHRLZJIUFCEDG-AUSIDOKSSA-N 0 3 422.573 4.133 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1ccc(N2CCCC2=O)c(F)c1)c1ccsc1 ZINC000485415550 900713785 /nfs/dbraw/zinc/71/37/85/900713785.db2.gz RAINQRNXAOMOFP-IBGZPJMESA-N 0 3 418.538 4.219 20 0 HIADHN O=C(NCCN1CCCC1)c1ccc(NC(=O)C2(c3ccccc3F)CCCC2)cc1 ZINC000485472613 900767349 /nfs/dbraw/zinc/76/73/49/900767349.db2.gz GINXJRHRPDWEIM-UHFFFAOYSA-N 0 3 423.532 4.102 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N(C)c3cccc(OC(F)(F)F)c3)cc2)CC1 ZINC000485498741 900788316 /nfs/dbraw/zinc/78/83/16/900788316.db2.gz CQKWOJMHZXFZLX-UHFFFAOYSA-N 0 3 421.463 4.392 20 0 HIADHN CN(C)Cc1cccc(NC(=O)N[C@H]2CSc3ccc(Br)cc32)c1 ZINC000485534668 900813838 /nfs/dbraw/zinc/81/38/38/900813838.db2.gz ZWPFALUGDIMMFQ-INIZCTEOSA-N 0 3 406.349 4.479 20 0 HIADHN CN(C(=O)c1c(F)ccc(Br)c1F)C1CCN(Cc2ccccc2)CC1 ZINC000485553884 900828383 /nfs/dbraw/zinc/82/83/83/900828383.db2.gz ASSZIYSXKVMUPU-UHFFFAOYSA-N 0 3 423.301 4.464 20 0 HIADHN O=C(NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)N[C@H]1CCCc2cn[nH]c21 ZINC000485598496 900858486 /nfs/dbraw/zinc/85/84/86/900858486.db2.gz GTHLVHJAXVCVTJ-SFHVURJKSA-N 0 3 422.360 4.058 20 0 HIADHN C[C@@H]1Cc2ccccc2N1C(=O)[C@@H]1CCCC[C@@H]1C(=O)Nc1cccc(CN(C)C)c1 ZINC000485768176 901024639 /nfs/dbraw/zinc/02/46/39/901024639.db2.gz VEELIDJHOOCQOR-YFXJRYMSSA-N 0 3 419.569 4.471 20 0 HIADHN COc1cc([C@@H](C)NC(=O)c2ccccc2CN(C)C)ccc1OCc1ccncc1 ZINC000485801252 901052246 /nfs/dbraw/zinc/05/22/46/901052246.db2.gz IUKUQBFNQDGHLT-GOSISDBHSA-N 0 3 419.525 4.222 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)cc1C ZINC000485868726 901108002 /nfs/dbraw/zinc/10/80/02/901108002.db2.gz IHPWLTSQZVDYQL-JOCHJYFZSA-N 0 3 420.475 4.417 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)cc1C ZINC000485868736 901108204 /nfs/dbraw/zinc/10/82/04/901108204.db2.gz IHPWLTSQZVDYQL-QFIPXVFZSA-N 0 3 420.475 4.417 20 0 HIADHN C[C@@H]1C[C@H](c2ccc(C(F)(F)F)cc2)N(CCn2cnc3ccccc3c2=O)C1 ZINC000485968633 901185384 /nfs/dbraw/zinc/18/53/84/901185384.db2.gz WCBWTNOKGXTGTL-FOIQADDNSA-N 0 3 401.432 4.498 20 0 HIADHN CCCN(C(=O)c1ccc2c(c1)SCC(=O)N2)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000486032082 901236628 /nfs/dbraw/zinc/23/66/28/901236628.db2.gz WBFPYUHDJJKEDN-FQEVSTJZSA-N 0 3 423.582 4.248 20 0 HIADHN C[C@H](NC[C@@H](c1ccccc1)C(F)(F)F)c1cccc(N2CCCS2(=O)=O)c1 ZINC000486069833 901262621 /nfs/dbraw/zinc/26/26/21/901262621.db2.gz OCWTUWPYBUNJSS-KXBFYZLASA-N 0 3 412.477 4.223 20 0 HIADHN C[C@H](NC(=O)NCC(C)(C)N1CCc2ccccc2C1)c1ccc2ncsc2c1 ZINC000486157730 901345375 /nfs/dbraw/zinc/34/53/75/901345375.db2.gz NNECCPUCXSDXAS-INIZCTEOSA-N 0 3 408.571 4.493 20 0 HIADHN C[C@H](NC(=O)N1CCN(C2CCCCC2)CC1)c1noc(-c2ccc(Cl)cc2)n1 ZINC000486210904 901394921 /nfs/dbraw/zinc/39/49/21/901394921.db2.gz CUPJJDUFWLUHNO-HNNXBMFYSA-N 0 3 417.941 4.111 20 0 HIADHN O=C(CN1CCN(C2CCCCC2)CC1)Nc1ccc(OCc2ccccc2)cc1 ZINC000486237740 901419125 /nfs/dbraw/zinc/41/91/25/901419125.db2.gz YSVGEGOPDDTGKM-UHFFFAOYSA-N 0 3 407.558 4.154 20 0 HIADHN COc1ccc([C@H](CNC(=O)[C@@H]2C[C@H]2c2ccc(Cl)s2)N2CCCC2)cc1 ZINC000486358479 901528304 /nfs/dbraw/zinc/52/83/04/901528304.db2.gz DITLMSNEVWJWOM-KURKYZTESA-N 0 3 404.963 4.467 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(Cl)cc2)CC1)c1cc[nH]c1C1CCC1 ZINC000486390369 901553185 /nfs/dbraw/zinc/55/31/85/901553185.db2.gz ZOKZZUINXLLDOV-UHFFFAOYSA-N 0 3 401.938 4.209 20 0 HIADHN CN(C)Cc1ccccc1C(=O)Nc1ccc(Oc2cccc(S(C)(=O)=O)c2)cc1 ZINC000486435191 901593004 /nfs/dbraw/zinc/59/30/04/901593004.db2.gz YGSNZAHLVNQJML-UHFFFAOYSA-N 0 3 424.522 4.196 20 0 HIADHN c1nc(C2CCCC2)sc1CN1C[C@H]2CCC[C@@]2(c2nc(-c3cnccn3)no2)C1 ZINC000486439931 901598833 /nfs/dbraw/zinc/59/88/33/901598833.db2.gz SSSRMQZZAZOSFI-OPAMFIHVSA-N 0 3 422.558 4.194 20 0 HIADHN c1cn2c(CN3C[C@H]4CCC[C@@]4(c4nc(CC5CC5)no4)C3)c(C3CC3)nc2s1 ZINC000486464510 901625288 /nfs/dbraw/zinc/62/52/88/901625288.db2.gz VKRHWOZDCGJQNC-OPAMFIHVSA-N 0 3 409.559 4.162 20 0 HIADHN Cc1nc2ccc(Br)cc2c(N(C)Cc2ncnn2CC(F)F)c1C ZINC000486479520 901640003 /nfs/dbraw/zinc/64/00/03/901640003.db2.gz DJQUGSJXXLTEET-UHFFFAOYSA-N 0 3 410.266 4.107 20 0 HIADHN Cc1nn(C)c(C)c1[C@@H](C)C(=O)N[C@@H](c1ccc(F)c(F)c1)C(C)(C)N1CCCC1 ZINC000486584708 901724895 /nfs/dbraw/zinc/72/48/95/901724895.db2.gz IBCNCDRXSHMUNE-SZNDQCEHSA-N 0 3 418.532 4.151 20 0 HIADHN C[C@@H]1CCCN(S(=O)(=O)c2ccc(CNCc3cc4ccc(F)cc4[nH]3)cc2)C1 ZINC000486717054 901810300 /nfs/dbraw/zinc/81/03/00/901810300.db2.gz MJFRRWQRPQISKS-MRXNPFEDSA-N 0 3 415.534 4.017 20 0 HIADHN C[C@@H]1CN(C2CCOCC2)CCN1C(=O)Nc1cc(C(F)(F)F)ccc1Cl ZINC000486762273 901837475 /nfs/dbraw/zinc/83/74/75/901837475.db2.gz NVZGQKYZRFPGAV-GFCCVEGCSA-N 0 3 405.848 4.076 20 0 HIADHN c1ccc2sc(CN3C[C@H]4CCC[C@@]4(c4nc(-c5cccnc5)no4)C3)nc2c1 ZINC000486823166 901876179 /nfs/dbraw/zinc/87/61/79/901876179.db2.gz LIUAXFRAJPJTNP-OPAMFIHVSA-N 0 3 403.511 4.295 20 0 HIADHN CC(C)[C@@H](C(=O)N1C[C@H]2CCC[C@@]2(c2nc(-c3ccccc3)no2)C1)N1CCCCC1 ZINC000486827312 901879020 /nfs/dbraw/zinc/87/90/20/901879020.db2.gz YBEYXZDDBSYRNJ-TYBLODHISA-N 0 3 422.573 4.127 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1ccccc1COC1CCOCC1)c1ccsc1 ZINC000486844254 901891543 /nfs/dbraw/zinc/89/15/43/901891543.db2.gz UCLPBFRTHKCFBK-JOCHJYFZSA-N 0 3 416.587 4.257 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cc(NC(C)=O)ccc3Cl)c(C)c2)CC1 ZINC000486861555 901906930 /nfs/dbraw/zinc/90/69/30/901906930.db2.gz ZOYQMMFYMCMWCG-UHFFFAOYSA-N 0 3 414.937 4.001 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)Nc3nc(-c4cccc(C(F)(F)F)c4)cs3)[C@@H]2C1 ZINC000486881430 901927622 /nfs/dbraw/zinc/92/76/22/901927622.db2.gz APNLAMHDXVBHQZ-MLGOLLRUSA-N 0 3 410.465 4.387 20 0 HIADHN CCCC(=O)Nc1ccc(Cl)c(NC(=O)NCCN(C)Cc2ccccc2)c1 ZINC000486897214 901941263 /nfs/dbraw/zinc/94/12/63/901941263.db2.gz AXNMTUOTONUJKR-UHFFFAOYSA-N 0 3 402.926 4.332 20 0 HIADHN CN(C(=O)Nc1nnc(/C=C\c2ccco2)s1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000486898912 901943009 /nfs/dbraw/zinc/94/30/09/901943009.db2.gz HJNSZFIHZJEUPU-DOOKAGJSSA-N 0 3 409.515 4.040 20 0 HIADHN Cc1c2cc(F)ccc2oc1C(=O)NCCCCN1CCN(c2ccccc2)CC1 ZINC000486924948 901966876 /nfs/dbraw/zinc/96/68/76/901966876.db2.gz JSRHWOPOKXGISN-UHFFFAOYSA-N 0 3 409.505 4.213 20 0 HIADHN C[C@@H](CCc1ccc(Br)cc1)NCc1c(Br)cnn1C ZINC000486937936 901977199 /nfs/dbraw/zinc/97/71/99/901977199.db2.gz MHDWGEQPAYKHMY-NSHDSACASA-N 0 3 401.146 4.056 20 0 HIADHN Cc1c(Cl)cc(F)c(NC(=O)N(C)C[C@@H]2CCN(C)[C@H]2c2cccnc2)c1F ZINC000486975110 902000475 /nfs/dbraw/zinc/00/04/75/902000475.db2.gz YAXQNQBPAKZYCP-LIRRHRJNSA-N 0 3 408.880 4.478 20 0 HIADHN C[C@@H]1CN(C2CCOCC2)CCN1C(=O)c1cn(Cc2ccccc2)c2ccccc12 ZINC000487121380 902066277 /nfs/dbraw/zinc/06/62/77/902066277.db2.gz PAHNQHFHGHPRHO-HXUWFJFHSA-N 0 3 417.553 4.015 20 0 HIADHN C[C@@H]1CN(C2CCOCC2)CCN1C(=O)c1ccc(N2CCCc3ccccc32)cc1 ZINC000487162426 902079834 /nfs/dbraw/zinc/07/98/34/902079834.db2.gz VGSQTEUMLZCNLX-HXUWFJFHSA-N 0 3 419.569 4.096 20 0 HIADHN CN(C)[C@@H](CNC(=O)Nc1c(F)cc(F)cc1Br)Cc1ccccc1 ZINC000487186450 902091245 /nfs/dbraw/zinc/09/12/45/902091245.db2.gz KQYLWUJDADCUEH-CQSZACIVSA-N 0 3 412.278 4.022 20 0 HIADHN Brc1ccc(CN[C@@H]2CCN(c3cccc(Br)c3)C2)o1 ZINC000487191617 902094268 /nfs/dbraw/zinc/09/42/68/902094268.db2.gz LASBGKLERKEWLH-GFCCVEGCSA-N 0 3 400.114 4.173 20 0 HIADHN CN(C(=O)Nc1c(F)cc(F)cc1Br)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000487245047 902115973 /nfs/dbraw/zinc/11/59/73/902115973.db2.gz YNGKHRSHBRXLAW-OAHLLOKOSA-N 0 3 424.289 4.466 20 0 HIADHN Cc1nc(-c2ccc(C)cc2NC(=O)CNC2(c3cccc(C)c3)CCCC2)n[nH]1 ZINC000487407207 902189413 /nfs/dbraw/zinc/18/94/13/902189413.db2.gz LEHSVJIXFYUEJK-UHFFFAOYSA-N 0 3 403.530 4.395 20 0 HIADHN CCCOc1ccc(Cl)cc1C(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000487739530 902332730 /nfs/dbraw/zinc/33/27/30/902332730.db2.gz MWHVZUTWIXUVPE-CALCHBBNSA-N 0 3 408.970 4.090 20 0 HIADHN COc1ccc(CNC(=O)[C@H](C)N[C@H](C)c2ccc(F)c3ccccc32)cc1OC ZINC000487861413 902411493 /nfs/dbraw/zinc/41/14/93/902411493.db2.gz WWHCHPPKOXBJQR-CVEARBPZSA-N 0 3 410.489 4.352 20 0 HIADHN CCCc1ccc([C@H](NC(=O)N2CC[C@@H](N3CCN(C)CC3)[C@@H](C)C2)C(C)C)cc1 ZINC000487869044 902414526 /nfs/dbraw/zinc/41/45/26/902414526.db2.gz FIOPNRBZJCTNSU-TUACAJSNSA-N 0 3 414.638 4.004 20 0 HIADHN C[C@@H](NCC(=O)Nc1cccc(CN2CCSCC2)c1)c1ccccc1Cl ZINC000487941555 902471466 /nfs/dbraw/zinc/47/14/66/902471466.db2.gz FHYZLVAHNDTTEF-MRXNPFEDSA-N 0 3 403.979 4.178 20 0 HIADHN CC[C@@H]1C[C@H](C(=O)NC[C@@H](c2ccc(C(F)(F)F)cc2)N(CC)CC)CCO1 ZINC000505969043 914631531 /nfs/dbraw/zinc/63/15/31/914631531.db2.gz AGOOGSMTDGQWLJ-QRQLOZEOSA-N 0 3 400.485 4.410 20 0 HIADHN Cc1ccc2nc(-c3ccc(NC(=O)CN4CCN(C)[C@@H](C(C)C)C4)cc3)sc2c1 ZINC000488051967 902565115 /nfs/dbraw/zinc/56/51/15/902565115.db2.gz MGDAVSDXFNGYGO-OAQYLSRUSA-N 0 3 422.598 4.482 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCC1CC(F)(F)C1)c1ccc(C(F)(F)F)cc1 ZINC000488096445 902599677 /nfs/dbraw/zinc/59/96/77/902599677.db2.gz STXQUXMFDXBOPS-INIZCTEOSA-N 0 3 407.427 4.433 20 0 HIADHN Brc1ccccc1-c1noc(C2CCN(C[C@@H]3CCCCO3)CC2)n1 ZINC000488169948 902661215 /nfs/dbraw/zinc/66/12/15/902661215.db2.gz OEGWNTCZMCTMOZ-HNNXBMFYSA-N 0 3 406.324 4.248 20 0 HIADHN OCCN(Cc1ccc(OC[C@H]2CCCO2)cc1)Cc1cccc(Br)c1 ZINC000488181949 902670018 /nfs/dbraw/zinc/67/00/18/902670018.db2.gz KLRKIHOEHZCCSP-OAQYLSRUSA-N 0 3 420.347 4.001 20 0 HIADHN Cc1ccc(NC(=O)N2CCN(C3CCOCC3)C[C@@H]2C)cc1OCCC(C)C ZINC000488503867 902860225 /nfs/dbraw/zinc/86/02/25/902860225.db2.gz OWMXFEBUARKODL-IBGZPJMESA-N 0 3 403.567 4.137 20 0 HIADHN CC(=O)Nc1ccc(Cl)c(NC(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)c1 ZINC000488615595 902899971 /nfs/dbraw/zinc/89/99/71/902899971.db2.gz ULMAAQQLNZNLCP-UHFFFAOYSA-N 0 3 414.937 4.081 20 0 HIADHN CC[C@@H](C)N(CC(=O)Nc1ccccc1C(F)(F)F)C[C@@H](O)Cc1ccccc1 ZINC000488616464 902902876 /nfs/dbraw/zinc/90/28/76/902902876.db2.gz HXPUVYDGUYAAOB-AEFFLSMTSA-N 0 3 408.464 4.348 20 0 HIADHN Cc1nc(-c2cccs2)sc1C(=O)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000488660163 902924638 /nfs/dbraw/zinc/92/46/38/902924638.db2.gz OAPXTEYRGIZAAK-UHFFFAOYSA-N 0 3 413.568 4.389 20 0 HIADHN CC(C)(Oc1ccc(Cl)cc1)C(=O)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000488679329 902939907 /nfs/dbraw/zinc/93/99/07/902939907.db2.gz XJUORSUGSZLSTM-UHFFFAOYSA-N 0 3 402.922 4.093 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)c2cc(-c3ccc(Cl)cc3)n[nH]2)CC1 ZINC000488693189 902946153 /nfs/dbraw/zinc/94/61/53/902946153.db2.gz VHMIVOMTARQBNM-UHFFFAOYSA-N 0 3 408.933 4.467 20 0 HIADHN C[C@@H]1CN(C2CCOCC2)CCN1[C@@H](c1nc(-c2ccccc2)no1)c1ccccc1 ZINC000488705377 902954857 /nfs/dbraw/zinc/95/48/57/902954857.db2.gz PFAITKMRTZKQMF-AUSIDOKSSA-N 0 3 418.541 4.011 20 0 HIADHN Cc1ccc(NC(=O)CNC(=O)c2sc3ccccc3c2Cl)c(CN(C)C)c1 ZINC000506001181 914672712 /nfs/dbraw/zinc/67/27/12/914672712.db2.gz FXWDLGYCSHCYKH-UHFFFAOYSA-N 0 3 415.946 4.293 20 0 HIADHN Cc1ccccc1[C@@H](C(C)C)N(C)CC(=O)NCc1ccccc1CN1CCCC1=O ZINC000488802346 903006968 /nfs/dbraw/zinc/00/69/68/903006968.db2.gz XDMFHYCLJWFLNU-AREMUKBSSA-N 0 3 421.585 4.063 20 0 HIADHN Cc1ccccc1[C@H](C(C)C)N(C)CC(=O)N1CCC(NC(=O)c2ccccc2)CC1 ZINC000488829975 903028528 /nfs/dbraw/zinc/02/85/28/903028528.db2.gz OAEPSTUSTHISDW-VWLOTQADSA-N 0 3 421.585 4.045 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)Nc1ccc(OC2CCCC2)cc1 ZINC000489006983 903117533 /nfs/dbraw/zinc/11/75/33/903117533.db2.gz FOFCQWDNKGAVBB-UHFFFAOYSA-N 0 3 423.557 4.286 20 0 HIADHN CC(=O)c1cccc(NC(=O)[C@@H](C)N[C@H](COc2ccccc2F)C(C)(C)C)c1 ZINC000489042046 903148601 /nfs/dbraw/zinc/14/86/01/903148601.db2.gz YCQWTSCPGJBYQK-QVKFZJNVSA-N 0 3 400.494 4.439 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)NCCCCCc3ccc(F)cc3)CC2)C[C@@H](C)O1 ZINC000489080350 903181366 /nfs/dbraw/zinc/18/13/66/903181366.db2.gz RHBLORFHDVEJAW-WOJBJXKFSA-N 0 3 419.585 4.069 20 0 HIADHN Cc1ccc(NC(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)cc1C(=O)N(C)C(C)C ZINC000489126713 903216620 /nfs/dbraw/zinc/21/66/20/903216620.db2.gz IKHKQGVECFNSFK-SIKLNZKXSA-N 0 3 422.573 4.260 20 0 HIADHN Cc1[nH]c2ccccc2c1CCNC(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000489202582 903261102 /nfs/dbraw/zinc/26/11/02/903261102.db2.gz HNKAQQYLRAXUOG-UHFFFAOYSA-N 0 3 404.558 4.325 20 0 HIADHN CC(C)[C@H](CNc1nc(C2CC2)nc2sc3c(c21)CCCC3)N1CCN(C)CC1 ZINC000489334425 903336605 /nfs/dbraw/zinc/33/66/05/903336605.db2.gz QZWJICVAASEBOF-SFHVURJKSA-N 0 3 413.635 4.131 20 0 HIADHN C[C@@H](c1ccc(S(N)(=O)=O)cc1)N(C)Cc1ccc(-c2ccc(F)cc2)s1 ZINC000506035765 914720131 /nfs/dbraw/zinc/72/01/31/914720131.db2.gz SNGBLEMRCWYRBH-AWEZNQCLSA-N 0 3 404.532 4.395 20 0 HIADHN COc1ccc([C@H](C)CCNC(=O)N(Cc2ccccc2)C2CCN(C)CC2)cc1 ZINC000489564869 903468070 /nfs/dbraw/zinc/46/80/70/903468070.db2.gz YOXCVJZHTUDGQL-HXUWFJFHSA-N 0 3 409.574 4.495 20 0 HIADHN COCc1ccsc1C(=O)Nc1c(C)cnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000489626510 903504837 /nfs/dbraw/zinc/50/48/37/903504837.db2.gz RXSUXWCNZYCKPE-LJQANCHMSA-N 0 3 410.543 4.099 20 0 HIADHN CC[C@H](C)Oc1ccc(NC(=O)NCc2ccccc2CN2CCC(O)CC2)cc1 ZINC000489789263 903599941 /nfs/dbraw/zinc/59/99/41/903599941.db2.gz JITVTUYZMWQMBA-SFHVURJKSA-N 0 3 411.546 4.142 20 0 HIADHN Cc1ccccc1[C@@H]1C[C@H](C)N(C(=O)NCc2ccccc2CN2CCC(O)CC2)C1 ZINC000489791347 903601955 /nfs/dbraw/zinc/60/19/55/903601955.db2.gz ZGUYYVAGLAMJHK-NZQKXSOJSA-N 0 3 421.585 4.039 20 0 HIADHN Cc1csc(CNC(=O)N(CCN(C)Cc2ccccc2)Cc2ccccc2)n1 ZINC000489886118 903653225 /nfs/dbraw/zinc/65/32/25/903653225.db2.gz OLHNDQVDGIHXRF-UHFFFAOYSA-N 0 3 408.571 4.295 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)CCc2ccc3ccccc3n2)N(C)C)cc1 ZINC000489944977 903690417 /nfs/dbraw/zinc/69/04/17/903690417.db2.gz HLXVKQRICMVYQX-DEOSSOPVSA-N 0 3 405.542 4.374 20 0 HIADHN Cc1occc1-c1cc(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2F)no1 ZINC000490170123 903807819 /nfs/dbraw/zinc/80/78/19/903807819.db2.gz PIHOHYUEXIOIOA-UHFFFAOYSA-N 0 3 404.417 4.117 20 0 HIADHN CCc1ccc([C@H](NCCN2CCC[C@@H](C)C2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000490173488 903810167 /nfs/dbraw/zinc/81/01/67/903810167.db2.gz VUBAJTQQGRCTGV-DVECYGJZSA-N 0 3 414.615 4.063 20 0 HIADHN CC[C@H](CN[C@@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1)N1CCCC1 ZINC000490173519 903810694 /nfs/dbraw/zinc/81/06/94/903810694.db2.gz WAMNKSGSUHKOEZ-IRLDBZIGSA-N 0 3 421.006 4.297 20 0 HIADHN Cc1ccc([C@H](NC[C@H](C)N2CCCC[C@@H]2C)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000490184934 903814971 /nfs/dbraw/zinc/81/49/71/903814971.db2.gz PZGOSVLBMZGFJY-SKPFHBQLSA-N 0 3 414.615 4.340 20 0 HIADHN COc1ccc(CCN[C@@H](c2cnn(C)c2)c2cccc(F)c2)cc1OC(F)F ZINC000490190663 903817291 /nfs/dbraw/zinc/81/72/91/903817291.db2.gz KXBLXHFFWYUOFV-HXUWFJFHSA-N 0 3 405.420 4.091 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N[C@H](c2ccccc2)c2cccnc2)C1 ZINC000490249567 903854387 /nfs/dbraw/zinc/85/43/87/903854387.db2.gz PXELHNOABFLXHX-VEXUSMLFSA-N 0 3 400.526 4.306 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)CCc3ncc(-c4ccc(Cl)cc4Cl)o3)[C@H]2C1 ZINC000490273327 903867953 /nfs/dbraw/zinc/86/79/53/903867953.db2.gz MARZDLFWPHEFTC-DYVFJYSZSA-N 0 3 408.329 4.134 20 0 HIADHN CCN(Cc1ccc2c(c1)OCO2)Cc1ccc(OCc2ccncc2)c(OC)c1 ZINC000506060474 914764352 /nfs/dbraw/zinc/76/43/52/914764352.db2.gz SUUIFCQSNSSTOK-UHFFFAOYSA-N 0 3 406.482 4.420 20 0 HIADHN O=C(NC[C@@H]1CCCCC(F)(F)C1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000490355410 903948840 /nfs/dbraw/zinc/94/88/40/903948840.db2.gz SBLUUCNUJCRBLX-IUDNXUCKSA-N 0 3 411.459 4.307 20 0 HIADHN CN(C)[C@@H](CNC(=O)N1CCCC[C@@H]1c1nc(-c2ccccc2)no1)c1ccccc1 ZINC000490360155 903952808 /nfs/dbraw/zinc/95/28/08/903952808.db2.gz BVZLUJWKKHRAGS-RTWAWAEBSA-N 0 3 419.529 4.276 20 0 HIADHN Cc1noc(-c2ccccc2C(=O)NC[C@@H](c2ccc(CC(C)C)cc2)N(C)C)n1 ZINC000490498453 904050793 /nfs/dbraw/zinc/05/07/93/904050793.db2.gz JSKWRDPMUOWZQE-QFIPXVFZSA-N 0 3 406.530 4.276 20 0 HIADHN CC[C@H](CNC(=O)N(Cc1ccccc1)C1CCN(C)CC1)Oc1cccc(C)c1 ZINC000490511465 904061452 /nfs/dbraw/zinc/06/14/52/904061452.db2.gz FHOHOSBXKLXRJK-HSZRJFAPSA-N 0 3 409.574 4.458 20 0 HIADHN CCN(Cc1ccccc1NC(=O)NC[C@H](c1ccc(C)cc1)N1CCCC1)C(C)=O ZINC000490648912 904154966 /nfs/dbraw/zinc/15/49/66/904154966.db2.gz UDBRJXSYXOAISA-XMMPIXPASA-N 0 3 422.573 4.322 20 0 HIADHN CCNc1ccc(Cl)cc1NC(=O)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000490728600 904196449 /nfs/dbraw/zinc/19/64/49/904196449.db2.gz AGNPSAQYQXHHOD-UHFFFAOYSA-N 0 3 401.938 4.228 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)NCCc1coc(-c2ccc(F)cc2)n1)c1ccco1 ZINC000490754321 904210862 /nfs/dbraw/zinc/21/08/62/904210862.db2.gz DMEZDOBGZCCRAM-HNAYVOBHSA-N 0 3 414.481 4.045 20 0 HIADHN Cc1[nH]nc2ncc(CN(C[C@@H](O)COc3cccc4ccccc43)C(C)C)cc12 ZINC000506086671 914792488 /nfs/dbraw/zinc/79/24/88/914792488.db2.gz QNQCMDPUJQJMHG-HXUWFJFHSA-N 0 3 404.514 4.070 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)N1CCc2ccc(Br)cc21 ZINC000490888290 904303885 /nfs/dbraw/zinc/30/38/85/904303885.db2.gz LYVCCRLBCYYHKZ-KRWDZBQOSA-N 0 3 420.376 4.420 20 0 HIADHN CCc1ccc([C@H](NC[C@@H](O)C2CCCCC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000491005394 904366387 /nfs/dbraw/zinc/36/63/87/904366387.db2.gz KQOJGSDLEITBNM-RPWUZVMVSA-N 0 3 415.599 4.273 20 0 HIADHN CSc1cccc([C@@H](N[C@H](C)CN2CCN(C)CC2)c2cc(F)ccc2F)c1 ZINC000491019384 904371767 /nfs/dbraw/zinc/37/17/67/904371767.db2.gz KTKQEQUOIKZYCP-OPAMFIHVSA-N 0 3 405.558 4.002 20 0 HIADHN O=C([C@@H]1CN(Cc2ccccc2)CCC1(F)F)N1CCc2[nH]c3ccccc3c2C1 ZINC000506101139 914804179 /nfs/dbraw/zinc/80/41/79/914804179.db2.gz NFQFEGWHKJPPCX-FQEVSTJZSA-N 0 3 409.480 4.210 20 0 HIADHN COc1ccc([C@H](NCC2CCN(C(C)=O)CC2)c2ccccc2Cl)cc1OC ZINC000491034513 904387878 /nfs/dbraw/zinc/38/78/78/904387878.db2.gz GZXHAJLCSZITAT-QHCPKHFHSA-N 0 3 416.949 4.295 20 0 HIADHN CCN(CC)C[C@@H](C)N[C@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000491038959 904391264 /nfs/dbraw/zinc/39/12/64/904391264.db2.gz QKSDSBCJCKVRMR-IIBYNOLFSA-N 0 3 408.995 4.153 20 0 HIADHN CCc1ccc([C@@H](NCCN(C)[C@H](C)CC)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000491054140 904396775 /nfs/dbraw/zinc/39/67/75/904396775.db2.gz PXGSPNGPHXRZSM-WZONZLPQSA-N 0 3 402.604 4.062 20 0 HIADHN O=C(NCCCN[C@H](c1ccccc1)c1ccccn1)c1ccc(Br)cc1 ZINC000491058373 904401075 /nfs/dbraw/zinc/40/10/75/904401075.db2.gz XUVTVBWQWSPRLU-OAQYLSRUSA-N 0 3 424.342 4.343 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)N2CC(C)(C)[C@@H]2c2cccnc2)N(C)C)cc1 ZINC000491082972 904418262 /nfs/dbraw/zinc/41/82/62/904418262.db2.gz XBVPJEGUFMXGHA-YADHBBJMSA-N 0 3 410.562 4.264 20 0 HIADHN C[C@@H]1CN(C[C@H]2CCCN2Cc2ccc(Br)c3cccnc23)C[C@@H](C)O1 ZINC000491194934 904477444 /nfs/dbraw/zinc/47/74/44/904477444.db2.gz RDPWBSZLFJYSTO-JFIYKMOQSA-N 0 3 418.379 4.071 20 0 HIADHN COc1cccc(CN2CCC[C@@H](c3nnc4ccc(C(F)(F)F)cn43)C2)c1OC ZINC000506135666 914818318 /nfs/dbraw/zinc/81/83/18/914818318.db2.gz IBYHTCCXZCZJDB-OAHLLOKOSA-N 0 3 420.435 4.145 20 0 HIADHN O=C(Nc1ccccc1O)C1CCN(Cc2ccc(-c3ccncc3)cc2F)CC1 ZINC000506135472 914818548 /nfs/dbraw/zinc/81/85/48/914818548.db2.gz DIJCIBZWUDEHLH-UHFFFAOYSA-N 0 3 405.473 4.444 20 0 HIADHN CC1CCC(N2CCN(C(=O)Nc3cc(F)c(OC(F)F)cc3F)CC2)CC1 ZINC000491297539 904524399 /nfs/dbraw/zinc/52/43/99/904524399.db2.gz ORNCABYXATTZIN-UHFFFAOYSA-N 0 3 403.420 4.294 20 0 HIADHN CC(C)(C)N1CCC(NS(=O)(=O)c2cc(Cl)ccc2OCCC2CC2)CC1 ZINC000491305647 904527073 /nfs/dbraw/zinc/52/70/73/904527073.db2.gz CFFZWYLSDFBQJO-UHFFFAOYSA-N 0 3 414.999 4.060 20 0 HIADHN COc1ccccc1-c1ncc(CNCCc2nc(-c3cccc(Cl)c3)no2)cn1 ZINC000491309990 904528642 /nfs/dbraw/zinc/52/86/42/904528642.db2.gz MUKTUMCEIXSRLU-UHFFFAOYSA-N 0 3 421.888 4.188 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](N[C@H]2CCc3ccccc3C2)c2ccc(F)cc2)c1 ZINC000491344117 904548149 /nfs/dbraw/zinc/54/81/49/904548149.db2.gz WQGVNRNDZWZAAH-LADGPHEKSA-N 0 3 409.526 4.466 20 0 HIADHN CC(C)N(CCN[C@@H](c1cccc(S(C)(=O)=O)c1)c1cc(F)ccc1F)C(C)C ZINC000491356457 904552924 /nfs/dbraw/zinc/55/29/24/904552924.db2.gz NFKAZBRVKRJBDA-QFIPXVFZSA-N 0 3 424.557 4.166 20 0 HIADHN Cc1nc(COc2ccc(CNCc3cc4ccccc4n(C)c3=O)cc2)cs1 ZINC000491403808 904580986 /nfs/dbraw/zinc/58/09/86/904580986.db2.gz ZYAFHQILTGDURL-UHFFFAOYSA-N 0 3 405.523 4.172 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)N2CCCC[C@H]2c2ccc(C(C)C)cc2)CC1 ZINC000491425102 904589817 /nfs/dbraw/zinc/58/98/17/904589817.db2.gz VWEVRVUONWJGFD-QPPBQGQZSA-N 0 3 414.638 4.320 20 0 HIADHN O=C(Nc1cc(F)c(OC(F)F)cc1F)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000491437026 904597507 /nfs/dbraw/zinc/59/75/07/904597507.db2.gz YAAJNIVPROINLM-CQSZACIVSA-N 0 3 411.399 4.352 20 0 HIADHN CCN(CC(=O)Nc1c(Cl)cccc1Cl)C(=O)[C@H](C(C)C)N1CCCCC1 ZINC000491502290 904627966 /nfs/dbraw/zinc/62/79/66/904627966.db2.gz LKOKSQYFHCVZNE-IBGZPJMESA-N 0 3 414.377 4.291 20 0 HIADHN CCN1CC[C@H](N(C)S(=O)(=O)c2cc(Cl)ccc2OCCC2CC2)C[C@H]1C ZINC000491587332 904663281 /nfs/dbraw/zinc/66/32/81/904663281.db2.gz WYSVYPIVESZHCL-QAPCUYQASA-N 0 3 414.999 4.012 20 0 HIADHN CC[C@H](Cc1ccc(Cl)cc1Cl)NC(=O)C(=O)Nc1cccc(CN(C)C)c1 ZINC000491608191 904673909 /nfs/dbraw/zinc/67/39/09/904673909.db2.gz VLZLPOXUKUZFRP-QGZVFWFLSA-N 0 3 422.356 4.131 20 0 HIADHN Cc1nc(C)c(CCN[C@@H](c2ccc(F)cc2)c2cccc(S(C)(=O)=O)c2)s1 ZINC000492195713 904812982 /nfs/dbraw/zinc/81/29/82/904812982.db2.gz KWIIJBCGYHQLMF-NRFANRHFSA-N 0 3 418.559 4.224 20 0 HIADHN CCN(C(=O)Nc1nc(C2CCOCC2)cs1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000492464591 904853982 /nfs/dbraw/zinc/85/39/82/904853982.db2.gz LXVHQVDNYARKKI-LJQANCHMSA-N 0 3 414.575 4.165 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)C(=O)Nc1ncc(C(C)C)s1)c1ccc(Cl)cc1 ZINC000506234343 914855733 /nfs/dbraw/zinc/85/57/33/914855733.db2.gz QIKDGEZUJJRGGR-INIZCTEOSA-N 0 3 422.982 4.058 20 0 HIADHN CO[C@@H](CN[C@H](c1cccc(S(C)(=O)=O)c1)c1ccc(C)cc1C)C(C)(C)C ZINC000493039466 905002324 /nfs/dbraw/zinc/00/23/24/905002324.db2.gz ZPXYYKXQHJBHPK-FCHUYYIVSA-N 0 3 403.588 4.447 20 0 HIADHN Cc1nc(-c2cccc(NC(=O)c3ccc(CN4CCC(CO)CC4)cc3)c2)oc1C ZINC000493070878 905007594 /nfs/dbraw/zinc/00/75/94/905007594.db2.gz JCEIJGWOGNUMDY-UHFFFAOYSA-N 0 3 419.525 4.415 20 0 HIADHN Cc1ccc([C@H](NC[C@@H](CCO)CC(C)C)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000493254136 905070245 /nfs/dbraw/zinc/07/02/45/905070245.db2.gz ZZRGYMYQDVOGOJ-CVDCTZTESA-N 0 3 403.588 4.122 20 0 HIADHN Cc1ccc([C@@H](NCCCNc2ccccn2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000493278064 905075079 /nfs/dbraw/zinc/07/50/79/905075079.db2.gz SIZJDGHYOKUFBY-DEOSSOPVSA-N 0 3 423.582 4.283 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)c2ccnc(SCC(F)(F)F)c2)C1 ZINC000493387817 905101775 /nfs/dbraw/zinc/10/17/75/905101775.db2.gz RKJCUPMMTABYKO-RHSMWYFYSA-N 0 3 409.477 4.301 20 0 HIADHN C[C@@]1(CO)CCC[C@@H]1NCC(=O)Nc1nc(-c2ccc(Cl)cc2Cl)cs1 ZINC000493388900 905103015 /nfs/dbraw/zinc/10/30/15/905103015.db2.gz SJRAJPCMRYROQN-YJBOKZPZSA-N 0 3 414.358 4.196 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)CCc3c4cc(F)ccc4[nH]c3-c3ccccc3)[C@H]2C1 ZINC000493462429 905126941 /nfs/dbraw/zinc/12/69/41/905126941.db2.gz JFILEJBZTRKXGB-HXOBKFHXSA-N 0 3 405.517 4.459 20 0 HIADHN Cc1cc(NC(=O)C2CCN(Cc3ccccc3OCc3ccccc3)CC2)no1 ZINC000506273002 914876398 /nfs/dbraw/zinc/87/63/98/914876398.db2.gz OXKPVNKWMLDFHW-UHFFFAOYSA-N 0 3 405.498 4.413 20 0 HIADHN COc1cc([C@H](C)N[C@H](C)c2cc(Br)cs2)ccc1OCCO ZINC000493810594 905225993 /nfs/dbraw/zinc/22/59/93/905225993.db2.gz AWUVCYSLXBJCCQ-NWDGAFQWSA-N 0 3 400.338 4.302 20 0 HIADHN O=C1CCCN1C[C@H](N[C@H]1CCc2ccccc2OC1)c1cccc(C(F)(F)F)c1 ZINC000493821975 905227976 /nfs/dbraw/zinc/22/79/76/905227976.db2.gz PPWXJYZYLFBQEB-PMACEKPBSA-N 0 3 418.459 4.352 20 0 HIADHN COc1cc([C@H](C)N[C@@H]2CCc3cc(Br)cc(C)c32)ccc1OCCO ZINC000493819881 905228035 /nfs/dbraw/zinc/22/80/35/905228035.db2.gz NVRFLFLZOLTKNH-KBXCAEBGSA-N 0 3 420.347 4.475 20 0 HIADHN CC(C)Cc1noc(-c2cc(Cl)ccc2NC(=O)N2CC[C@@H]3CCN(C)C[C@@H]32)n1 ZINC000493835887 905230070 /nfs/dbraw/zinc/23/00/70/905230070.db2.gz NUALEXCUJOZNRE-KSSFIOAISA-N 0 3 417.941 4.146 20 0 HIADHN Cc1cc(Br)cc2c1[C@@H](NCc1ccc(N3CCO[C@H](C)C3)nc1)CC2 ZINC000493882182 905242745 /nfs/dbraw/zinc/24/27/45/905242745.db2.gz HVXYSUJLLVXPKS-BEFAXECRSA-N 0 3 416.363 4.155 20 0 HIADHN Cc1nn(-c2ccc(Br)cc2)c(C)c1CN1CCC(n2ccnc2)CC1 ZINC000512395637 921131916 /nfs/dbraw/zinc/13/19/16/921131916.db2.gz YLOLJORREGHSBJ-UHFFFAOYSA-N 0 3 414.351 4.285 20 0 HIADHN COc1ccccc1COc1cccc(NC(=O)N2CC[C@H]3CCN(C)C[C@@H]32)c1C ZINC000493920069 905271055 /nfs/dbraw/zinc/27/10/55/905271055.db2.gz MXIBVVRCAYDKML-NQIIRXRSSA-N 0 3 409.530 4.141 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)Nc3ccc(C(F)(F)F)cc3Br)[C@@H]2C1 ZINC000493936265 905287170 /nfs/dbraw/zinc/28/71/70/905287170.db2.gz XSSZCONWOKQJJR-QMTHXVAHSA-N 0 3 406.246 4.026 20 0 HIADHN O=C(NCc1ccco1)c1cccc(CN[C@@H]2CCO[C@H]2c2ccc(F)c(F)c2)c1 ZINC000493937398 905289928 /nfs/dbraw/zinc/28/99/28/905289928.db2.gz PTJIRILBELFWIA-YADHBBJMSA-N 0 3 412.436 4.108 20 0 HIADHN Cc1cc(Br)cc2c1[C@H](NCc1cccc(OCC(=O)N(C)C)c1)CC2 ZINC000493945926 905296978 /nfs/dbraw/zinc/29/69/78/905296978.db2.gz VXOXLAJWHZMQPC-LJQANCHMSA-N 0 3 417.347 4.002 20 0 HIADHN Cc1cc(NC(=O)N2CC[C@H]3CCN(C)C[C@@H]32)nn1-c1ccc(Cl)cc1Cl ZINC000493982250 905325168 /nfs/dbraw/zinc/32/51/68/905325168.db2.gz IVWYISRGFNNYBG-DYVFJYSZSA-N 0 3 408.333 4.045 20 0 HIADHN C[C@@H]1[C@H](NC(=O)CCCc2ncc(-c3ccccc3)o2)CCN1Cc1ccccc1 ZINC000493999412 905342042 /nfs/dbraw/zinc/34/20/42/905342042.db2.gz IVHOOMRQDRZODT-DENIHFKCSA-N 0 3 403.526 4.444 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](N[C@@H]2CCOC3(CCCC3)C2)c2ccc(F)cc2)c1 ZINC000494003754 905344028 /nfs/dbraw/zinc/34/40/28/905344028.db2.gz LYDNDUWGXSQNFN-IRLDBZIGSA-N 0 3 417.546 4.400 20 0 HIADHN C[C@@H]1[C@H](NC(=O)c2cn(C)nc2-c2ccc(Cl)s2)CCN1Cc1ccccc1 ZINC000494006412 905348010 /nfs/dbraw/zinc/34/80/10/905348010.db2.gz IRUYGDJFCMOXSD-RHSMWYFYSA-N 0 3 414.962 4.195 20 0 HIADHN C[C@H]1[C@@H](NC(=O)Cc2csc(Cc3ccccc3)n2)CCN1Cc1ccccc1 ZINC000494019971 905358485 /nfs/dbraw/zinc/35/84/85/905358485.db2.gz WQGWVABRKKBHAX-AVRDEDQJSA-N 0 3 405.567 4.056 20 0 HIADHN C[C@@H]1[C@H](NC(=O)[C@@H]2CCn3c(cnc3C3CCCCC3)C2)CCN1Cc1ccccc1 ZINC000494039994 905381734 /nfs/dbraw/zinc/38/17/34/905381734.db2.gz WEZBRWFRHUXUEY-ZFJSRUIDSA-N 0 3 420.601 4.272 20 0 HIADHN C[C@H]1CN(C(=O)c2csc(-c3ccc(Cl)cc3)c2)CC[C@H]1N1CCN(C)CC1 ZINC000494131089 905476074 /nfs/dbraw/zinc/47/60/74/905476074.db2.gz PENFYEQJBOOHQM-OXJNMPFZSA-N 0 3 418.006 4.167 20 0 HIADHN O=C(CCc1ccccc1)N1CC[C@@H](NCc2ccc(Br)c(Cl)c2)C1 ZINC000494166242 905503779 /nfs/dbraw/zinc/50/37/79/905503779.db2.gz YADWYTXESDJLED-QGZVFWFLSA-N 0 3 421.766 4.426 20 0 HIADHN CSc1ccc(NC(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@H]2CO)cc1Cl ZINC000494188661 905523157 /nfs/dbraw/zinc/52/31/57/905523157.db2.gz LKEHCJGEUDZDNZ-QFBILLFUSA-N 0 3 419.978 4.066 20 0 HIADHN Cc1ccc(-c2n[nH]cc2CN2CCC[C@H](CNC(=O)Nc3cccc(F)c3)C2)o1 ZINC000512428032 921155214 /nfs/dbraw/zinc/15/52/14/921155214.db2.gz ONVNUEUAQWKCLH-MRXNPFEDSA-N 0 3 411.481 4.151 20 0 HIADHN Cc1ccc(-c2n[nH]cc2CN2CCC[C@@H](CNC(=O)Nc3cccc(F)c3)C2)o1 ZINC000512428031 921155434 /nfs/dbraw/zinc/15/54/34/921155434.db2.gz ONVNUEUAQWKCLH-INIZCTEOSA-N 0 3 411.481 4.151 20 0 HIADHN C[C@H](N[C@]1(C)CCO[C@H]1C)C(=O)N1N=C(c2ccc(Cl)cc2)C[C@H]1c1ccco1 ZINC000494266632 905589454 /nfs/dbraw/zinc/58/94/54/905589454.db2.gz ZPADVPSDYAQWFL-OFFWNCNGSA-N 0 3 415.921 4.156 20 0 HIADHN CCN1CCN(Cc2ccc(CNC(=O)C[C@@H](C)c3c[nH]c4ccccc43)cc2)CC1 ZINC000494335660 905645187 /nfs/dbraw/zinc/64/51/87/905645187.db2.gz XHNRLNHZTWJTNL-HXUWFJFHSA-N 0 3 418.585 4.115 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)Nc3ccc(OC(F)F)cc3F)cc2)CC1 ZINC000512446961 921167484 /nfs/dbraw/zinc/16/74/84/921167484.db2.gz PLEOUTCLNDYWHP-UHFFFAOYSA-N 0 3 407.436 4.210 20 0 HIADHN Cc1cccc2sc(N(Cc3ccccc3)C(=O)CN[C@H]3CCO[C@H]3C3CC3)nc21 ZINC000494475806 905757259 /nfs/dbraw/zinc/75/72/59/905757259.db2.gz MXBIFEHHNKTKSQ-CVDCTZTESA-N 0 3 421.566 4.295 20 0 HIADHN Cc1cc(Br)cc2c1[C@@H](NCc1ccc(C)c(S(C)(=O)=O)c1)CC2 ZINC000494496477 905784196 /nfs/dbraw/zinc/78/41/96/905784196.db2.gz PLPSNMXQMAEQMO-KRWDZBQOSA-N 0 3 408.361 4.247 20 0 HIADHN O=C(NCc1ccco1)c1cccc(CN[C@@H]2CCO[C@@H]2c2ccc(Cl)cc2)c1 ZINC000494499165 905788061 /nfs/dbraw/zinc/78/80/61/905788061.db2.gz XXCVXHGZPHYIRC-FGZHOGPDSA-N 0 3 410.901 4.483 20 0 HIADHN CCOc1cc(CN2CCC[C@@H](CNC(=O)Nc3ccc(C)cc3)C2)ccc1OC ZINC000512461651 921177663 /nfs/dbraw/zinc/17/76/63/921177663.db2.gz FCBJSTFAJCAOJB-FQEVSTJZSA-N 0 3 411.546 4.436 20 0 HIADHN CC(C)c1ccc(O[C@H](C)CNC(=O)N(C)C[C@@H]2CCN(C)[C@H]2c2cccnc2)cc1 ZINC000512472293 921183728 /nfs/dbraw/zinc/18/37/28/921183728.db2.gz UABHPRRWXBCGHO-UCFCWBNQSA-N 0 3 424.589 4.307 20 0 HIADHN COC(=O)c1ccc(CN[C@H]2CCc3cc(Br)cc(C)c32)cc1OC ZINC000494606889 905860321 /nfs/dbraw/zinc/86/03/21/905860321.db2.gz YAASIASIQGUAKW-KRWDZBQOSA-N 0 3 404.304 4.330 20 0 HIADHN CO[C@@H](c1ccccc1)[C@@H](C)NCc1nnc(-c2ccc(Br)cc2)[nH]1 ZINC000494621178 905867597 /nfs/dbraw/zinc/86/75/97/905867597.db2.gz NQWZHSVZUFTFQR-FZKQIMNGSA-N 0 3 401.308 4.100 20 0 HIADHN CCCC(=O)NC[C@H]1CCCN(Cc2cn(-c3ccccc3)nc2-c2ccncc2)C1 ZINC000512474797 921185625 /nfs/dbraw/zinc/18/56/25/921185625.db2.gz NMJNEEMITJGWPM-HXUWFJFHSA-N 0 3 417.557 4.063 20 0 HIADHN C[C@H](NC(=O)N1CCN(C2CCOCC2)C[C@H]1C)C(c1ccccc1)c1ccccc1 ZINC000494683362 905898062 /nfs/dbraw/zinc/89/80/62/905898062.db2.gz VTROLJWJVPSIDO-RTWAWAEBSA-N 0 3 421.585 4.102 20 0 HIADHN CC(C)[C@@H](NCCC=Cc1ccc(Br)cc1)c1nc(-c2nc[nH]n2)no1 ZINC000494690120 905901068 /nfs/dbraw/zinc/90/10/68/905901068.db2.gz ZIRFSPYYGKJBCJ-SJDLMVEWSA-N 0 3 417.311 4.007 20 0 HIADHN COc1ccc([C@@H](NCC2CCS(=O)(=O)CC2)c2ccccc2Cl)c(C)c1 ZINC000494728508 905929982 /nfs/dbraw/zinc/92/99/82/905929982.db2.gz DLECUWJCJSNMHD-OAQYLSRUSA-N 0 3 407.963 4.161 20 0 HIADHN C[C@H](CC(=O)N(CCN(C)C)Cc1cccc(O)c1)c1cccc(C(F)(F)F)c1 ZINC000494777814 905975041 /nfs/dbraw/zinc/97/50/41/905975041.db2.gz DDSTXRJBMBNSSQ-MRXNPFEDSA-N 0 3 408.464 4.495 20 0 HIADHN CC(C)c1noc2nc(C3CC3)cc(C(=O)N(CCN(C)C)Cc3cccc(O)c3)c21 ZINC000494781467 905980742 /nfs/dbraw/zinc/98/07/42/905980742.db2.gz HJQIDZTZCSJRHM-UHFFFAOYSA-N 0 3 422.529 4.133 20 0 HIADHN CN(C)CCN(Cc1cccc(O)c1)C(=O)[C@@H]1C[C@H]1c1cccc(Cl)c1Cl ZINC000494781763 905982300 /nfs/dbraw/zinc/98/23/00/905982300.db2.gz XNKYUJKVPOENNB-ZWKOTPCHSA-N 0 3 407.341 4.393 20 0 HIADHN CSC[C@H](O)CN[C@@H](COc1cccc(F)c1)c1cccc(C(F)(F)F)c1 ZINC000494793548 905995130 /nfs/dbraw/zinc/99/51/30/905995130.db2.gz VHLIHYOEJDTEIC-AEFFLSMTSA-N 0 3 403.441 4.278 20 0 HIADHN CSCC[C@@H](NCCCC(=O)Nc1c(C)cccc1C)c1nnc2ccccn21 ZINC000494804957 906005421 /nfs/dbraw/zinc/00/54/21/906005421.db2.gz OKIHNXGKSBVNHA-GOSISDBHSA-N 0 3 411.575 4.149 20 0 HIADHN Cc1nc2ccc(CN[C@H]3CCCN(Cc4ccc(F)cc4F)C3=O)cc2s1 ZINC000494845014 906033480 /nfs/dbraw/zinc/03/34/80/906033480.db2.gz FFGHWADLZWJGCH-IBGZPJMESA-N 0 3 401.482 4.164 20 0 HIADHN CCN(CC)C(=O)C1CCN(Cc2c[nH]nc2-c2ccc(C(F)(F)F)cc2)CC1 ZINC000494929699 906101370 /nfs/dbraw/zinc/10/13/70/906101370.db2.gz JOYAVKXGVZVNQG-UHFFFAOYSA-N 0 3 408.468 4.176 20 0 HIADHN C[C@H](NC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1)[C@H]1OCCc2sccc21 ZINC000494938657 906109084 /nfs/dbraw/zinc/10/90/84/906109084.db2.gz PMJZWCZIHJRFKO-KGVIQGDOSA-N 0 3 413.587 4.056 20 0 HIADHN O=C(CN[C@H](C[C@@H]1CCOC1)c1ccc(F)cc1)Nc1cccc(Br)c1 ZINC000494956027 906127229 /nfs/dbraw/zinc/12/72/29/906127229.db2.gz IIDJZQGAGVJWLN-IFXJQAMLSA-N 0 3 421.310 4.284 20 0 HIADHN CCCN(CC(F)(F)F)C(=O)[C@H]1CCCN(Cc2cnc(-c3ccco3)s2)C1 ZINC000494955381 906127338 /nfs/dbraw/zinc/12/73/38/906127338.db2.gz BZYSGMACCBRKRI-AWEZNQCLSA-N 0 3 415.481 4.416 20 0 HIADHN CCN(CC(F)(F)F)C(=O)[C@@H]1CCCN(Cc2cnc(-c3ccco3)s2)C1 ZINC000494970297 906139587 /nfs/dbraw/zinc/13/95/87/906139587.db2.gz GZTUVLXUHZICCN-CYBMUJFWSA-N 0 3 401.454 4.026 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCCc1cscn1)c1ccc(C(F)(F)F)cc1 ZINC000494976577 906143036 /nfs/dbraw/zinc/14/30/36/906143036.db2.gz MMULNBISYILUKH-QGZVFWFLSA-N 0 3 414.497 4.087 20 0 HIADHN Cc1ccccc1[C@@H](NCc1cccnc1N1CCC(C(N)=O)CC1)C1CCCC1 ZINC000495039632 906196535 /nfs/dbraw/zinc/19/65/35/906196535.db2.gz CRYAUJDABKKKJR-QHCPKHFHSA-N 0 3 406.574 4.113 20 0 HIADHN COc1ccc([C@H](N[C@@H]2CCO[C@@]3(CCOC3)C2)c2ccccc2Cl)cc1OC ZINC000495045529 906202638 /nfs/dbraw/zinc/20/26/38/906202638.db2.gz HQSPWWDNXGBHOY-VSDWSMLSSA-N 0 3 417.933 4.374 20 0 HIADHN CC(C)C(=O)NCCCN[C@H](c1ccccc1)c1ccc(Br)cc1F ZINC000495052635 906206666 /nfs/dbraw/zinc/20/66/66/906206666.db2.gz WAPIZQFYBIALNZ-LJQANCHMSA-N 0 3 407.327 4.430 20 0 HIADHN CCOc1c(OC)cc(CN[C@H](C[C@H]2CCOC2)c2ccc(F)cc2)cc1OC ZINC000495054664 906208955 /nfs/dbraw/zinc/20/89/55/906208955.db2.gz VVJCUFUXEVHGSK-OXQOHEQNSA-N 0 3 403.494 4.499 20 0 HIADHN O=C(Nc1cccc(Br)c1)C1CCN(Cc2ccc3c(c2)CCO3)CC1 ZINC000512547345 921228613 /nfs/dbraw/zinc/22/86/13/921228613.db2.gz MGEBKNVRDOMEFW-UHFFFAOYSA-N 0 3 415.331 4.235 20 0 HIADHN CN(C(=O)Nc1ccc(CCN2CCSCC2)cc1)[C@@H]1CCc2ccccc2C1 ZINC000512549639 921230108 /nfs/dbraw/zinc/23/01/08/921230108.db2.gz URXAOUQHBHWPPG-HSZRJFAPSA-N 0 3 409.599 4.299 20 0 HIADHN C[C@@H]1CCCCN1CCNC(=O)c1ccc(COc2cccc(Br)c2)o1 ZINC000495329290 906379310 /nfs/dbraw/zinc/37/93/10/906379310.db2.gz IQJWNQQNEAZFQK-OAHLLOKOSA-N 0 3 421.335 4.225 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)c2cnc3c(F)ccc(F)c3c2)cc1 ZINC000495345848 906390934 /nfs/dbraw/zinc/39/09/34/906390934.db2.gz ZAENOIRYWKGTGQ-NRFANRHFSA-N 0 3 411.452 4.089 20 0 HIADHN CCCNC(=O)[C@H]1CCCN(Cc2ccc(OCc3ccc(F)cc3)c(OC)c2)C1 ZINC000512557079 921234571 /nfs/dbraw/zinc/23/45/71/921234571.db2.gz KZXISWFGLOJLHR-FQEVSTJZSA-N 0 3 414.521 4.152 20 0 HIADHN Cc1cccc(-c2n[nH]cc2CN2CCC(c3nc(-c4ccccn4)no3)CC2)c1 ZINC000512562676 921238399 /nfs/dbraw/zinc/23/83/99/921238399.db2.gz ZYAXWQSHUMBLOL-UHFFFAOYSA-N 0 3 400.486 4.210 20 0 HIADHN COc1cc(-c2noc(CN[C@@H](Cc3ccccc3)C3CC3)n2)ccc1OC(F)F ZINC000495491524 906483048 /nfs/dbraw/zinc/48/30/48/906483048.db2.gz YRVWGXPJCQUVNL-KRWDZBQOSA-N 0 3 415.440 4.458 20 0 HIADHN CCCC[C@H](NCCc1cc(Br)ccc1F)C(=O)Nc1cc(C)on1 ZINC000495560962 906503022 /nfs/dbraw/zinc/50/30/22/906503022.db2.gz GMKYCYPIGCHDOH-INIZCTEOSA-N 0 3 412.303 4.214 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)c2ccccc2SCc2cccs2)CC1 ZINC000495682592 906524383 /nfs/dbraw/zinc/52/43/83/906524383.db2.gz RQUUHVLDIPTYFY-SFHVURJKSA-N 0 3 417.644 4.044 20 0 HIADHN Cc1cc(NC(=O)c2ccccc2Cl)sc1C(=O)N(CCN(C)C)C(C)C ZINC000495938138 906582572 /nfs/dbraw/zinc/58/25/72/906582572.db2.gz XKVGPLDAVDBIAX-UHFFFAOYSA-N 0 3 407.967 4.374 20 0 HIADHN CCOc1ccc(-c2nc(C(=O)N(CCN(C)C)Cc3ccccc3)cs2)cc1 ZINC000496029643 906600273 /nfs/dbraw/zinc/60/02/73/906600273.db2.gz RNYGCPOONQRWNZ-UHFFFAOYSA-N 0 3 409.555 4.413 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)CSc1ccc2c(c1)CCC2 ZINC000496210601 906628003 /nfs/dbraw/zinc/62/80/03/906628003.db2.gz LAWNLBXAIVKLIR-QFIPXVFZSA-N 0 3 409.599 4.176 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)c1cc(Br)ccc1F ZINC000496224153 906632576 /nfs/dbraw/zinc/63/25/76/906632576.db2.gz FWXZNPBIFGWTGI-KRWDZBQOSA-N 0 3 420.326 4.110 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)c1cnn(-c2cccc(C)c2)c1C ZINC000496263425 906642335 /nfs/dbraw/zinc/64/23/35/906642335.db2.gz OEYPRAPBEHFMIS-QHCPKHFHSA-N 0 3 417.557 4.011 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)c1cnn(-c2ccc(Cl)cc2)c1 ZINC000496270101 906644816 /nfs/dbraw/zinc/64/48/16/906644816.db2.gz CLWAPSGZCYTBIV-JOCHJYFZSA-N 0 3 423.948 4.047 20 0 HIADHN CC(=O)c1c(C)[nH]c(C(=O)Nc2cccc(CN3CCC(CO)CC3)c2)c1C(C)C ZINC000512608834 921258683 /nfs/dbraw/zinc/25/86/83/921258683.db2.gz ZLNFPRLCQKJDGN-UHFFFAOYSA-N 0 3 411.546 4.106 20 0 HIADHN CCOc1cc(CNC(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)ccc1OC ZINC000512619751 921264149 /nfs/dbraw/zinc/26/41/49/921264149.db2.gz NAIMQEAAVHXVRG-OAQYLSRUSA-N 0 3 411.546 4.039 20 0 HIADHN C/C=C\c1ccc(OC[C@@H](O)CN2CCC(OC3CCCCC3)CC2)c(OC)c1 ZINC000497377261 906865556 /nfs/dbraw/zinc/86/55/56/906865556.db2.gz TYGCPQZXMAACPI-CTKIROQKSA-N 0 3 403.563 4.282 20 0 HIADHN C/C=C/c1ccc(OC[C@H](O)CN2CCC(OC3CCCCC3)CC2)c(OC)c1 ZINC000497377262 906865691 /nfs/dbraw/zinc/86/56/91/906865691.db2.gz TYGCPQZXMAACPI-WRSLSUIGSA-N 0 3 403.563 4.282 20 0 HIADHN CC(C)[C@H](c1ccccc1)N(C)CC(=O)N1CCC[C@@H]1c1ccc2c(c1)OCCO2 ZINC000497384241 906870600 /nfs/dbraw/zinc/87/06/00/906870600.db2.gz GRDWRBVJJIKIDN-PXDATVDWSA-N 0 3 408.542 4.450 20 0 HIADHN CN1C[C@H](NC(=O)CCCc2ccc(Br)s2)[C@@H](c2ccccc2)C1 ZINC000497415659 906891237 /nfs/dbraw/zinc/89/12/37/906891237.db2.gz HWXYRSOIHDTASZ-SJORKVTESA-N 0 3 407.377 4.047 20 0 HIADHN COc1ccccc1[C@H](NC(=O)N1CC[C@H]2CCN(C)C[C@@H]21)c1ccccc1Cl ZINC000497498664 906983895 /nfs/dbraw/zinc/98/38/95/906983895.db2.gz AEQLMKCPUSDJIE-QGCDCVKKSA-N 0 3 413.949 4.174 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1cccc(Cl)c1OCC(F)F ZINC000497540569 907031872 /nfs/dbraw/zinc/03/18/72/907031872.db2.gz MUUIOUPMUNDJED-UHFFFAOYSA-N 0 3 401.841 4.173 20 0 HIADHN CCCOc1ccc(CN2CCC(C(=O)NCc3ccc(C)cc3)CC2)cc1OC ZINC000512693574 921289637 /nfs/dbraw/zinc/28/96/37/921289637.db2.gz NVMZKBALYQOFSD-UHFFFAOYSA-N 0 3 410.558 4.321 20 0 HIADHN O[C@H](COc1cc(Cl)ccc1Cl)CN(Cc1cccs1)C[C@H]1CCCO1 ZINC000497593372 907074502 /nfs/dbraw/zinc/07/45/02/907074502.db2.gz AQGWGJDUQTVZFY-JKSUJKDBSA-N 0 3 416.370 4.476 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)N[C@@H](c3cccc(F)c3)c3cccc(Cl)c3)[C@@H]2C1 ZINC000497619045 907099658 /nfs/dbraw/zinc/09/96/58/907099658.db2.gz WGWATWJUHJEZCO-IPHXSNPTSA-N 0 3 401.913 4.304 20 0 HIADHN Cc1cccc(COc2ccc([C@H](C)NC(=O)N3CC[C@@H]4CCN(C)C[C@H]43)cc2)c1 ZINC000497627817 907109030 /nfs/dbraw/zinc/10/90/30/907109030.db2.gz NSCNFGGUDNHZKL-NGYIFUPDSA-N 0 3 407.558 4.371 20 0 HIADHN CCOc1cc(C[NH2+]C[C@@H](c2cccc(OC)c2)N2CCCC2)cc(Cl)c1[O-] ZINC000497670993 907170473 /nfs/dbraw/zinc/17/04/73/907170473.db2.gz OWQIIGSFVLKAQV-FQEVSTJZSA-N 0 3 404.938 4.380 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)Nc2ccc(COC(C)C)cc2)CC1 ZINC000512763826 921303739 /nfs/dbraw/zinc/30/37/39/921303739.db2.gz VQETXYFTSFLITE-UHFFFAOYSA-N 0 3 424.589 4.071 20 0 HIADHN CN(CCNC(=O)Cc1csc(-c2ccc(Cl)s2)n1)Cc1ccccc1 ZINC000512787191 921311412 /nfs/dbraw/zinc/31/14/12/921311412.db2.gz HGXUKPZLQONXSW-UHFFFAOYSA-N 0 3 405.976 4.316 20 0 HIADHN CC(C)c1noc2nc(C3CC3)cc(C(=O)N[C@H]3CN(C)C[C@H]3c3ccccc3)c21 ZINC000497806024 907291493 /nfs/dbraw/zinc/29/14/93/907291493.db2.gz WMZUKYXDYGNOIP-ICSRJNTNSA-N 0 3 404.514 4.051 20 0 HIADHN CC(C)(C)[C@@H](NC[C@H](O)COc1ccc2c(c1)CCC(=O)N2)c1cc2ccccc2o1 ZINC000497811680 907295885 /nfs/dbraw/zinc/29/58/85/907295885.db2.gz FRSCRASOJBGQIJ-UUOWRZLLSA-N 0 3 422.525 4.434 20 0 HIADHN CC[C@H](C)CCC(=O)NC1CCN(CCOc2ccc(Br)cc2)CC1 ZINC000512794179 921312774 /nfs/dbraw/zinc/31/27/74/921312774.db2.gz XSXYOYKUDXYQEK-INIZCTEOSA-N 0 3 411.384 4.235 20 0 HIADHN CCN(Cc1ccc(OC)cc1)C(=O)NC[C@@H](c1ccc(OC(C)C)cc1)N(C)C ZINC000512806573 921314990 /nfs/dbraw/zinc/31/49/90/921314990.db2.gz AJCSXNZEEFXTLF-QHCPKHFHSA-N 0 3 413.562 4.317 20 0 HIADHN C[C@H](CCn1cccn1)N[C@@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000497851958 907332621 /nfs/dbraw/zinc/33/26/21/907332621.db2.gz GXYDKXGNOBGHCL-IERDGZPVSA-N 0 3 417.962 4.098 20 0 HIADHN CCN(C(=O)c1cnn(Cc2ccccc2)c1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000497950108 907417860 /nfs/dbraw/zinc/41/78/60/907417860.db2.gz HCPYFSINQHXHAD-GBXCKJPGSA-N 0 3 402.542 4.229 20 0 HIADHN C[C@@H]1CCN(C(=O)NCCc2csc(C(C)(C)C)n2)CCN1Cc1ccccc1 ZINC000497969722 907439634 /nfs/dbraw/zinc/43/96/34/907439634.db2.gz TWAPVZWLDJTROA-GOSISDBHSA-N 0 3 414.619 4.289 20 0 HIADHN O=C(NC[C@H]1CCCN1Cc1ccccc1)c1ccc(-c2noc(C(F)F)n2)cc1 ZINC000498002078 907486461 /nfs/dbraw/zinc/48/64/61/907486461.db2.gz UAXOLHAEPZJBRW-GOSISDBHSA-N 0 3 412.440 4.069 20 0 HIADHN CCN(C(=O)c1cccc(CN2CCCC2=O)c1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000498021275 907517117 /nfs/dbraw/zinc/51/71/17/907517117.db2.gz CLWFYANBVLUHMX-YKSBVNFPSA-N 0 3 419.569 4.107 20 0 HIADHN CN(C)Cc1cccc(C(=O)N2CC[C@@H](Cc3ccc(Br)cc3)C2)c1 ZINC000498040493 907546118 /nfs/dbraw/zinc/54/61/18/907546118.db2.gz DHPCUKAXQXBVTC-SFHVURJKSA-N 0 3 401.348 4.216 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)N(C)Cc2cccc3[nH]ccc32)N(C)C)cc1 ZINC000512828105 921332461 /nfs/dbraw/zinc/33/24/61/921332461.db2.gz PFKOIFJWUFCFDC-QHCPKHFHSA-N 0 3 408.546 4.399 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000498060817 907572345 /nfs/dbraw/zinc/57/23/45/907572345.db2.gz FDQYAHOIIRCAQX-LEWJYISDSA-N 0 3 402.460 4.374 20 0 HIADHN CN1CCN(CCCNC(=O)c2ccc(Cl)cc2Cl)[C@H](c2ccccc2)C1 ZINC000498120116 907633309 /nfs/dbraw/zinc/63/33/09/907633309.db2.gz YQBIXIGBDIJCOF-FQEVSTJZSA-N 0 3 406.357 4.102 20 0 HIADHN Cc1cc(-c2nc3cc(F)ccc3n2C)ccc1NC(=O)N[C@H](C)C1=CCN(C)CC1 ZINC000512838472 921343090 /nfs/dbraw/zinc/34/30/90/921343090.db2.gz NLUORDYMTJUCQE-MRXNPFEDSA-N 0 3 421.520 4.460 20 0 HIADHN Cc1cccc2[nH]c(CNC(=O)NC[C@@H](c3cccs3)N3CCC(C)CC3)nc21 ZINC000498255324 907792255 /nfs/dbraw/zinc/79/22/55/907792255.db2.gz VTZLNMGJTUAJMI-SFHVURJKSA-N 0 3 411.575 4.205 20 0 HIADHN C[C@@H](NC(=O)Nc1cc(Cl)ccc1-c1nc(C2CC2)no1)C1=CCN(C)CC1 ZINC000512852173 921357217 /nfs/dbraw/zinc/35/72/17/921357217.db2.gz MUUHHGYIYCFKQX-GFCCVEGCSA-N 0 3 401.898 4.039 20 0 HIADHN Cc1nn(-c2ccc(C)c(Cl)c2)c(C)c1CC(=O)N(CCN(C)C)C1CCCC1 ZINC000498456349 907920863 /nfs/dbraw/zinc/92/08/63/907920863.db2.gz CVGRJPRPJLGGAU-UHFFFAOYSA-N 0 3 416.997 4.326 20 0 HIADHN CN(C)CCN(C(=O)CC1(CC(=O)Nc2nccs2)CCCCC1)C1CCCC1 ZINC000498457471 907922754 /nfs/dbraw/zinc/92/27/54/907922754.db2.gz MXADZMLAQIBHIN-UHFFFAOYSA-N 0 3 420.623 4.145 20 0 HIADHN CCn1ncc2c1nc(-c1ccccc1)cc2C(=O)N(CCN(C)C)C1CCCC1 ZINC000498465470 907932662 /nfs/dbraw/zinc/93/26/62/907932662.db2.gz LLYYCECFVPOWSU-UHFFFAOYSA-N 0 3 405.546 4.065 20 0 HIADHN CCN1CCN([C@H](C)CNC(=O)c2cc(Cl)ccc2Oc2ccc(F)cc2)CC1 ZINC000498504400 907976400 /nfs/dbraw/zinc/97/64/00/907976400.db2.gz PSVJKDPBJVHFGO-MRXNPFEDSA-N 0 3 419.928 4.027 20 0 HIADHN CCN1CCN([C@H](C)CNC(=O)c2ccccc2-c2ccc(C(F)(F)F)cc2)CC1 ZINC000498527527 907995671 /nfs/dbraw/zinc/99/56/71/907995671.db2.gz QZAQEQFJCNBTHU-QGZVFWFLSA-N 0 3 419.491 4.128 20 0 HIADHN O=C(N1CCCC1)N1CCC[C@H](NCc2cnc(-c3ccc(Cl)cc3)s2)C1 ZINC000512873732 921371393 /nfs/dbraw/zinc/37/13/93/921371393.db2.gz DZLGZKIDCOZKRF-KRWDZBQOSA-N 0 3 404.967 4.233 20 0 HIADHN O=C(NC1CCN(Cc2ccc(Cl)cc2)CC1)[C@@H]1CCCN1Cc1ccccc1 ZINC000498600778 908049413 /nfs/dbraw/zinc/04/94/13/908049413.db2.gz OHPONMZMAZSFPZ-QHCPKHFHSA-N 0 3 411.977 4.085 20 0 HIADHN C[C@H]1CC[C@H](C)N1CC(=O)NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1 ZINC000498622622 908068500 /nfs/dbraw/zinc/06/85/00/908068500.db2.gz ZNHGNGGROBIRPB-ROUUACIJSA-N 0 3 406.505 4.167 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)c2ccc(-c3ccc(Cl)cc3)s2)CC1 ZINC000498632385 908073532 /nfs/dbraw/zinc/07/35/32/908073532.db2.gz STTPLZUYOWPOPM-INIZCTEOSA-N 0 3 405.995 4.072 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)c2ccc(-c3ccc(Cl)cc3)s2)CC1 ZINC000498632387 908074316 /nfs/dbraw/zinc/07/43/16/908074316.db2.gz STTPLZUYOWPOPM-MRXNPFEDSA-N 0 3 405.995 4.072 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)c1cc2c(cccc2Br)[nH]1 ZINC000498713664 908139740 /nfs/dbraw/zinc/13/97/40/908139740.db2.gz VZTYNVLLGVTCFQ-UHFFFAOYSA-N 0 3 418.310 4.274 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)N2CCCC[C@H]2c2cccn2C)N(C)C)cc1 ZINC000512902680 921394794 /nfs/dbraw/zinc/39/47/94/921394794.db2.gz QUMQSDGSBNUQKS-GOTSBHOMSA-N 0 3 412.578 4.352 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)N(C)Cc2ccc(F)cc2F)N(C)C)cc1 ZINC000512906310 921399540 /nfs/dbraw/zinc/39/95/40/921399540.db2.gz CTTHWBLYGPEWAX-OAQYLSRUSA-N 0 3 405.489 4.196 20 0 HIADHN CCN(Cc1ccc(OCc2ccccc2)cc1)C(=O)CN1C[C@@H](C)N(CC)C[C@@H]1C ZINC000498927051 908336473 /nfs/dbraw/zinc/33/64/73/908336473.db2.gz TYZBKZLXYVTIIJ-YADHBBJMSA-N 0 3 423.601 4.029 20 0 HIADHN Cc1cccc([C@H](NC(=O)NCC2(N3CCSCC3)CCCC2)c2ccccn2)c1 ZINC000499001026 908379403 /nfs/dbraw/zinc/37/94/03/908379403.db2.gz BUDRPVAGDMWONW-QFIPXVFZSA-N 0 3 424.614 4.140 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)N(C)CCc2ccc(F)cc2)N(C)C)cc1 ZINC000512916083 921410467 /nfs/dbraw/zinc/41/04/67/921410467.db2.gz ARUIMIZDBFREBK-JOCHJYFZSA-N 0 3 401.526 4.100 20 0 HIADHN CN1CCC(CCO)(NC(=O)c2cccc(Oc3cccc(C(F)(F)F)c3)c2)CC1 ZINC000499132304 908489035 /nfs/dbraw/zinc/48/90/35/908489035.db2.gz XWGPQZDILWFCGD-UHFFFAOYSA-N 0 3 422.447 4.074 20 0 HIADHN COc1ccc([C@H](C)NC(=O)N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)c(C)c1OC ZINC000499195975 908551087 /nfs/dbraw/zinc/55/10/87/908551087.db2.gz VAIYVXSBIVEAKE-KPFFTGBYSA-N 0 3 411.546 4.035 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)N[C@H](c1cccc(F)c1)c1ccccn1 ZINC000499307632 908679792 /nfs/dbraw/zinc/67/97/92/908679792.db2.gz NMKMTJPENBFAHF-HSZRJFAPSA-N 0 3 424.495 4.223 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)N[C@@H](c1cccc(F)c1)c1ccccn1 ZINC000499310222 908685114 /nfs/dbraw/zinc/68/51/14/908685114.db2.gz VWRREEVZRBKCSJ-QHCPKHFHSA-N 0 3 424.495 4.223 20 0 HIADHN CN(C)C[C@@H](NC(=O)NCCc1csc(-c2ccccc2)n1)c1ccc(F)cc1 ZINC000499327014 908702101 /nfs/dbraw/zinc/70/21/01/908702101.db2.gz NRFMIRBUPCIAEI-HXUWFJFHSA-N 0 3 412.534 4.094 20 0 HIADHN Cc1cc(C)n([C@H](C)C(=O)N(CCN2CCCC2)Cc2ccc(Cl)c(Cl)c2)n1 ZINC000499349482 908722247 /nfs/dbraw/zinc/72/22/47/908722247.db2.gz XXBYCYNHLIZSMW-QGZVFWFLSA-N 0 3 423.388 4.492 20 0 HIADHN CC(C)Cc1ccc([C@@H](CNC(=O)NCc2nnc(C(C)(C)C)s2)N(C)C)cc1 ZINC000499357390 908723698 /nfs/dbraw/zinc/72/36/98/908723698.db2.gz IGCLCKDWUGVUIB-GOSISDBHSA-N 0 3 417.623 4.136 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)[C@@H]1C[C@H]1c1cccc(Br)c1 ZINC000499365040 908731423 /nfs/dbraw/zinc/73/14/23/908731423.db2.gz SAWKVKLBRCOZQN-VQTJNVASSA-N 0 3 419.338 4.282 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)c1cc2c(cccc2Br)[nH]1 ZINC000499367862 908736163 /nfs/dbraw/zinc/73/61/63/908736163.db2.gz ZGEJRASPBJZFEW-UHFFFAOYSA-N 0 3 418.310 4.274 20 0 HIADHN COc1ccc([C@@H](CNC(=O)N[C@@H](C)c2cccc(F)c2F)N2CCCC2)cc1 ZINC000499477557 908810882 /nfs/dbraw/zinc/81/08/82/908810882.db2.gz BYSHRTHXGNGLMU-MGPUTAFESA-N 0 3 403.473 4.171 20 0 HIADHN O=C(NC[C@H]1CCCC(F)(F)C1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000499558948 908840327 /nfs/dbraw/zinc/84/03/27/908840327.db2.gz MGMCPHCDFAQMHA-WMZOPIPTSA-N 0 3 404.423 4.383 20 0 HIADHN Cc1nc(CCN(C)Cc2ccc(OCc3ccccc3)c(Br)c2)no1 ZINC000512968585 921444717 /nfs/dbraw/zinc/44/47/17/921444717.db2.gz YPUNCIMAWZKKCQ-UHFFFAOYSA-N 0 3 416.319 4.394 20 0 HIADHN CCCOc1ccc(CNC(=O)NC[C@H](c2ccc(OC)cc2)N2CCCC2)cc1 ZINC000499672623 908872656 /nfs/dbraw/zinc/87/26/56/908872656.db2.gz DNJHTXMGJDDAGH-HSZRJFAPSA-N 0 3 411.546 4.120 20 0 HIADHN C[C@@H](CN1CCC[C@@H](C)C1)NC(=O)c1oc2ccccc2c1CSc1ncccn1 ZINC000499725472 908891824 /nfs/dbraw/zinc/89/18/24/908891824.db2.gz AGGPKKKRTDWFDH-SJORKVTESA-N 0 3 424.570 4.365 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)N[C@H](C)c1nc(-c2ccc(F)c(C)c2)no1 ZINC000499741242 908895676 /nfs/dbraw/zinc/89/56/76/908895676.db2.gz LUTRPNLDCIALFL-QGZVFWFLSA-N 0 3 417.529 4.153 20 0 HIADHN O=C(c1cc(Cl)c[nH]1)N1CCC(NCc2ncc(-c3ccccc3)s2)CC1 ZINC000512983418 921451900 /nfs/dbraw/zinc/45/19/00/921451900.db2.gz QRUIDEIDCKXRHM-UHFFFAOYSA-N 0 3 400.935 4.186 20 0 HIADHN CN(C)[C@@H](CNC(=O)Cc1csc(-c2ccc(Cl)s2)n1)Cc1ccccc1 ZINC000513001609 921468711 /nfs/dbraw/zinc/46/87/11/921468711.db2.gz KGOYXCKBNUUBNL-MRXNPFEDSA-N 0 3 420.003 4.357 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CN1CCC[C@H](CNC(=O)c2ccccc2)C1 ZINC000513034761 921492892 /nfs/dbraw/zinc/49/28/92/921492892.db2.gz CLRPTMSWOJIPAK-HSZRJFAPSA-N 0 3 416.569 4.190 20 0 HIADHN CCc1nnc(NC(=O)[C@@H](C)[C@@H](C)NCc2ccccc2OC2CCCC2)s1 ZINC000513039997 921499671 /nfs/dbraw/zinc/49/96/71/921499671.db2.gz FFWVUZPBSPQXFJ-LSDHHAIUSA-N 0 3 402.564 4.175 20 0 HIADHN Fc1cccc(-c2noc([C@@H]3CCCN(Cc4cccc5c4OCCCO5)C3)n2)c1 ZINC000513045537 921505014 /nfs/dbraw/zinc/50/50/14/921505014.db2.gz FSRFWSNSKJTIII-GOSISDBHSA-N 0 3 409.461 4.417 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)c1csc(CCc2ccccc2)n1 ZINC000500190806 909684179 /nfs/dbraw/zinc/68/41/79/909684179.db2.gz PTGSZRCXRGMOLD-UHFFFAOYSA-N 0 3 411.546 4.271 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Cn1ncc2ccccc21)c1ccc(C(F)(F)F)cc1 ZINC000500195938 909686598 /nfs/dbraw/zinc/68/65/98/909686598.db2.gz YZVFYWUWDIYBFW-HXUWFJFHSA-N 0 3 418.463 4.254 20 0 HIADHN Fc1cccc(-c2noc([C@H]3CCCN(Cc4ccc(N5CCCC5)nc4)C3)n2)c1 ZINC000513059681 921515131 /nfs/dbraw/zinc/51/51/31/921515131.db2.gz XCELLWOSEZEJAI-IBGZPJMESA-N 0 3 407.493 4.251 20 0 HIADHN CCc1nnc(NC(=O)[C@H](C)[C@@H](C)NCc2ccc(F)c(Cl)c2Cl)s1 ZINC000513068303 921522870 /nfs/dbraw/zinc/52/28/70/921522870.db2.gz JAWWICZMGYHKRY-RKDXNWHRSA-N 0 3 405.326 4.299 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)CCc2ccnc3ccccc23)cc1 ZINC000500378958 909825464 /nfs/dbraw/zinc/82/54/64/909825464.db2.gz LYSUWXBVUBRAOF-XMMPIXPASA-N 0 3 403.526 4.129 20 0 HIADHN O=C(NC[C@@H]1CCCN(Cc2ccccc2OCC(F)(F)F)C1)c1ccccc1 ZINC000513072022 921526091 /nfs/dbraw/zinc/52/60/91/921526091.db2.gz ZNOXIKAYNQYZNG-KRWDZBQOSA-N 0 3 406.448 4.270 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)CCc2cn(C)c3ccccc23)cc1 ZINC000500388309 909828645 /nfs/dbraw/zinc/82/86/45/909828645.db2.gz IDBKOYMYLMTLMB-QHCPKHFHSA-N 0 3 405.542 4.073 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)c2cccc([C@H]3CCCOC3)c2)cc1 ZINC000500387398 909828785 /nfs/dbraw/zinc/82/87/85/909828785.db2.gz GWPPPQIXGPRPPL-UPVQGACJSA-N 0 3 408.542 4.156 20 0 HIADHN O=C(NC[C@H]1CCCN(Cc2cccc(OCC(F)(F)F)c2)C1)c1ccccc1 ZINC000513073081 921526290 /nfs/dbraw/zinc/52/62/90/921526290.db2.gz AZYXLILLKTUZSF-GOSISDBHSA-N 0 3 406.448 4.270 20 0 HIADHN COc1ccc(CN2CCC(C(=O)Nc3cccc(F)c3)CC2)cc1OC(F)F ZINC000513073043 921526416 /nfs/dbraw/zinc/52/64/16/921526416.db2.gz ATZFDXAVIHYNSD-UHFFFAOYSA-N 0 3 408.420 4.286 20 0 HIADHN C[C@H](NC(=O)NCC1(N2CCSCC2)CCCC1)c1ccccc1OC(F)F ZINC000500400550 909836497 /nfs/dbraw/zinc/83/64/97/909836497.db2.gz TVVYCBYYFJECHF-HNNXBMFYSA-N 0 3 413.534 4.010 20 0 HIADHN Cc1ccc(C(=O)CCCC(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)cc1 ZINC000500506409 909894930 /nfs/dbraw/zinc/89/49/30/909894930.db2.gz WWRXXUQZOUAFKL-SFTDATJTSA-N 0 3 414.590 4.086 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)N[C@@H](c1ccccn1)c1ccccc1OC ZINC000500551727 909923177 /nfs/dbraw/zinc/92/31/77/909923177.db2.gz RPOABAMVSVGVRD-HSZRJFAPSA-N 0 3 410.562 4.087 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)C1CCC(OC[C@H]2CCCO2)CC1 ZINC000500583234 909945441 /nfs/dbraw/zinc/94/54/41/909945441.db2.gz OUADTLSTFHKQCS-SNDHGLFQSA-N 0 3 416.606 4.014 20 0 HIADHN CN(C)Cc1ccc(-c2noc([C@@H]3CC(=O)N(c4ccc(Cl)c(F)c4)C3)n2)cc1 ZINC000500617707 909968395 /nfs/dbraw/zinc/96/83/95/909968395.db2.gz MDGFAQVMTJGBJB-OAHLLOKOSA-N 0 3 414.868 4.111 20 0 HIADHN CCN1CCN(Cc2ccc(CNC(=O)N3CCC[C@@H]3c3ccc(F)cc3)cc2)CC1 ZINC000500623022 909972758 /nfs/dbraw/zinc/97/27/58/909972758.db2.gz XMOFCCAREVDXEA-XMMPIXPASA-N 0 3 424.564 4.010 20 0 HIADHN C[C@H](NC(=O)C(=O)Nc1cc(C(F)F)ccc1Cl)[C@H](c1ccccc1)N(C)C ZINC000500689514 910024716 /nfs/dbraw/zinc/02/47/16/910024716.db2.gz WYOLEVOFLHNRAJ-YVEFUNNKSA-N 0 3 409.864 4.024 20 0 HIADHN CC[C@@H](C)c1ccccc1N1C[C@@H](C(=O)N(CC(C)C)C2CCN(C)CC2)CC1=O ZINC000500720044 910040069 /nfs/dbraw/zinc/04/00/69/910040069.db2.gz KKILNOKAXRRPFK-UXHICEINSA-N 0 3 413.606 4.132 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)c1cn(Cc2ccccc2)c2ccccc12 ZINC000500775999 910070976 /nfs/dbraw/zinc/07/09/76/910070976.db2.gz CRXBBDHATWYSLG-UHFFFAOYSA-N 0 3 412.537 4.289 20 0 HIADHN Cc1cc(C(=O)Nc2ccc(CCN3CCSCC3)cc2)c2c(n1)onc2C(C)C ZINC000500828956 910108774 /nfs/dbraw/zinc/10/87/74/910108774.db2.gz AEKXRTHRQUMOGL-UHFFFAOYSA-N 0 3 424.570 4.498 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)CCc2ccccc2Br)C1 ZINC000500862572 910135976 /nfs/dbraw/zinc/13/59/76/910135976.db2.gz ZLKPMWZXSBFYEW-QFBILLFUSA-N 0 3 401.348 4.333 20 0 HIADHN C[C@H](c1ccccc1C(F)(F)F)[C@H](C)NC(=O)N(CCN(C)C)Cc1ccccn1 ZINC000500892440 910163215 /nfs/dbraw/zinc/16/32/15/910163215.db2.gz KBUZTLRXMPKRDJ-IRXDYDNUSA-N 0 3 422.495 4.366 20 0 HIADHN CC(C)(COCc1ccccc1)NCC(=O)Nc1ccc(Br)cc1F ZINC000500960526 910207946 /nfs/dbraw/zinc/20/79/46/910207946.db2.gz YGEJFQUPVXTZAC-UHFFFAOYSA-N 0 3 409.299 4.112 20 0 HIADHN CN(C)[C@@H](CNC(=O)NC[C@@H](c1cccc(Cl)c1)N1CCCC1)c1ccccc1 ZINC000501023034 910241390 /nfs/dbraw/zinc/24/13/90/910241390.db2.gz LTSFZAAVJNLJDQ-VXKWHMMOSA-N 0 3 414.981 4.079 20 0 HIADHN C[C@H]1Oc2ccc(C(=O)C3CCN(CCSC4CCCCC4)CC3)cc2NC1=O ZINC000501053578 910265147 /nfs/dbraw/zinc/26/51/47/910265147.db2.gz LNTOSXUHGJUOEA-MRXNPFEDSA-N 0 3 416.587 4.367 20 0 HIADHN CC(C)(C)OC(=O)c1cccc(CN2CCC[C@H](c3nnc4n3CCCCC4)C2)c1 ZINC000501119795 910303186 /nfs/dbraw/zinc/30/31/86/910303186.db2.gz XGLXROOXBVFOSD-FQEVSTJZSA-N 0 3 410.562 4.339 20 0 HIADHN Cc1cc(N(C)C)cc(C)c1NC(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000501253783 910414963 /nfs/dbraw/zinc/41/49/63/910414963.db2.gz NJJUKOSJPBYHSV-BGYRXZFFSA-N 0 3 416.610 4.113 20 0 HIADHN CC(=O)c1cccc(O[C@H](C)C(=O)NC[C@@H](c2ccccc2)N2CCC(C)CC2)c1 ZINC000501341970 910479985 /nfs/dbraw/zinc/47/99/85/910479985.db2.gz FZBQKMKLCFCDSS-YKSBVNFPSA-N 0 3 408.542 4.246 20 0 HIADHN CC1CCN([C@@H](CNC(=O)C2(c3cccc(F)c3)CCOCC2)c2ccccc2)CC1 ZINC000501344811 910481866 /nfs/dbraw/zinc/48/18/66/910481866.db2.gz SGHRLRSQGCRTFZ-DEOSSOPVSA-N 0 3 424.560 4.463 20 0 HIADHN Cc1c(NC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)cnn1CC(C)C ZINC000501349083 910486276 /nfs/dbraw/zinc/48/62/76/910486276.db2.gz AECXDIUJWMNOLV-FQEVSTJZSA-N 0 3 408.468 4.241 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)CCc2ncc(-c3ccc(F)cc3F)o2)o1 ZINC000501368370 910497081 /nfs/dbraw/zinc/49/70/81/910497081.db2.gz UDKCREMOCYCMIC-UHFFFAOYSA-N 0 3 417.456 4.044 20 0 HIADHN CCC(CC)[C@@H]1C[C@H](NC(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)CCO1 ZINC000501403790 910535899 /nfs/dbraw/zinc/53/58/99/910535899.db2.gz DOTAGTJPSDTZAS-MZYLBHOOSA-N 0 3 419.610 4.360 20 0 HIADHN Cc1cc(C(=O)Nc2ccc(CCN3CCSCC3)cc2)c2cnn(C(C)C)c2n1 ZINC000501417510 910550497 /nfs/dbraw/zinc/55/04/97/910550497.db2.gz KRYDOGJVASZHOE-UHFFFAOYSA-N 0 3 423.586 4.164 20 0 HIADHN O=C(N1CC=C(c2ccccc2)C1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000501615953 910717091 /nfs/dbraw/zinc/71/70/91/910717091.db2.gz WKZCLFWHLZYDAO-JOCHJYFZSA-N 0 3 400.444 4.367 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)Nc1ccc(OCC(F)(F)F)cc1 ZINC000501689555 910759387 /nfs/dbraw/zinc/75/93/87/910759387.db2.gz LGWMCPOZAAFOAW-UHFFFAOYSA-N 0 3 407.436 4.198 20 0 HIADHN C[C@@H](CC(=O)N(C)C1CCN(CCc2ccccn2)CC1)c1ccc(F)cc1F ZINC000501735755 910797692 /nfs/dbraw/zinc/79/76/92/910797692.db2.gz SZRFKGQTFURBDZ-KRWDZBQOSA-N 0 3 401.501 4.019 20 0 HIADHN CCOc1ccc([C@H]2CCCN2C(=O)NCCCN2CCc3ccccc3C2)cc1 ZINC000501755077 910814057 /nfs/dbraw/zinc/81/40/57/910814057.db2.gz OPHXIMVBSBTRED-XMMPIXPASA-N 0 3 407.558 4.380 20 0 HIADHN CN(CCOc1ccccc1Cl)C(=O)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000501781133 910835775 /nfs/dbraw/zinc/83/57/75/910835775.db2.gz JAASJMRHBVHFIK-FQEVSTJZSA-N 0 3 401.938 4.197 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N[C@H]1CCCc2cn(C3CCCC3)nc21)c1ccco1 ZINC000501799317 910850813 /nfs/dbraw/zinc/85/08/13/910850813.db2.gz SAPKIAJDMLMNLD-FFZOFVMBSA-N 0 3 413.566 4.397 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)c2occc2-c2ccc(F)cc2)CC1 ZINC000501800790 910851574 /nfs/dbraw/zinc/85/15/74/910851574.db2.gz JVDLRVCWRFNGEB-UHFFFAOYSA-N 0 3 421.516 4.153 20 0 HIADHN O=C(Nc1cccc(N2CCCCC2=O)c1)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000501823669 910869392 /nfs/dbraw/zinc/86/93/92/910869392.db2.gz GEIVTYDHFRLWJX-QFIPXVFZSA-N 0 3 406.530 4.162 20 0 HIADHN CCN(C(=O)c1nc(C)n(-c2ccc(F)cc2)n1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000501948596 910933619 /nfs/dbraw/zinc/93/36/19/910933619.db2.gz PZQXUBJJYUANEI-JTSKRJEESA-N 0 3 421.520 4.012 20 0 HIADHN C[C@@H]1[C@H](NC(=O)N[C@@H]2CCO[C@@H](c3ccc(F)cc3)C2)CCN1Cc1ccccc1 ZINC000501949093 910936025 /nfs/dbraw/zinc/93/60/25/910936025.db2.gz NHZMAGHNNDVAGZ-ULLYJBBUSA-N 0 3 411.521 4.008 20 0 HIADHN CCN(C(=O)c1cc(Br)cn1C)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000501952530 910940091 /nfs/dbraw/zinc/94/00/91/910940091.db2.gz FTQJLMMWAZLFOS-QAPCUYQASA-N 0 3 404.352 4.085 20 0 HIADHN C[C@H](C[NH2+][C@@H](c1nc(-c2nc[n-]n2)no1)C(C)(C)C)c1ccc(C(F)(F)F)cc1 ZINC000502020898 910981160 /nfs/dbraw/zinc/98/11/60/910981160.db2.gz FNYQYQAVIKUFQQ-RISCZKNCSA-N 0 3 408.428 4.354 20 0 HIADHN C[C@H](CN[C@@H](c1nc(-c2nc[nH]n2)no1)C(C)(C)C)c1ccc(C(F)(F)F)cc1 ZINC000502020898 910981168 /nfs/dbraw/zinc/98/11/68/910981168.db2.gz FNYQYQAVIKUFQQ-RISCZKNCSA-N 0 3 408.428 4.354 20 0 HIADHN CCN1CCCC[C@@H]1CNC(=O)c1c(C)onc1-c1cccc(Br)c1 ZINC000502059769 911007768 /nfs/dbraw/zinc/00/77/68/911007768.db2.gz ADYLXHJENDHLTB-MRXNPFEDSA-N 0 3 406.324 4.017 20 0 HIADHN C[C@@H](CCc1ccc(Br)cc1)N[C@@H](C(=O)NC1CC1)c1ccccc1 ZINC000513209988 921626058 /nfs/dbraw/zinc/62/60/58/921626058.db2.gz MSYFFUSZSGNQLK-MGPUTAFESA-N 0 3 401.348 4.380 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)N[C@@H](C)[C@@H](OC)c2ccccc2Cl)cc1 ZINC000502105919 911041969 /nfs/dbraw/zinc/04/19/69/911041969.db2.gz PBXXRYGLIZZNCN-ONGXBYRLSA-N 0 3 419.953 4.027 20 0 HIADHN COc1cc(C(=O)NC[C@H]2CCCN2Cc2ccccc2)ccc1OC1CCCC1 ZINC000513217311 921631490 /nfs/dbraw/zinc/63/14/90/921631490.db2.gz KMKDRUJNMXRMKM-OAQYLSRUSA-N 0 3 408.542 4.411 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CC[C@@H](c2ccccc2F)C1)c1cccc(OC)c1 ZINC000502176274 911099708 /nfs/dbraw/zinc/09/97/08/911099708.db2.gz YGVVMSCLBYMJFP-AUSIDOKSSA-N 0 3 413.537 4.416 20 0 HIADHN Cc1cc(C)c(-c2csc(NC(=O)CN3CCN(C4CCCC4)CC3)n2)cc1C ZINC000502183096 911113281 /nfs/dbraw/zinc/11/32/81/911113281.db2.gz DOZNLUVYRPLRJQ-UHFFFAOYSA-N 0 3 412.603 4.234 20 0 HIADHN C[C@H](NC(=O)N(Cc1ccco1)C1CCN(C)CC1)c1cccc(OC(F)F)c1 ZINC000502217904 911160224 /nfs/dbraw/zinc/16/02/24/911160224.db2.gz WWJLOMVGBHAFLV-HNNXBMFYSA-N 0 3 407.461 4.248 20 0 HIADHN CC(=O)Nc1cccc(CN2CCC[C@H](c3n[nH]cc3NC(=O)c3ccccc3)C2)c1 ZINC000502298544 911259365 /nfs/dbraw/zinc/25/93/65/911259365.db2.gz FUASDJZWMSCQJO-FQEVSTJZSA-N 0 3 417.513 4.000 20 0 HIADHN COc1cc(C)c([C@@H](C)NC(=O)NC[C@@H](c2ccccc2)N2CCCC2)cc1OC ZINC000502308719 911273047 /nfs/dbraw/zinc/27/30/47/911273047.db2.gz ITYYXUNXYVQTCL-NQIIRXRSSA-N 0 3 411.546 4.210 20 0 HIADHN C[C@@H]1CCCC[C@H]1OCCN1CCC[C@H](c2n[nH]cc2NC(=O)c2ccccc2)C1 ZINC000502350140 911330856 /nfs/dbraw/zinc/33/08/56/911330856.db2.gz CEIJNDLURSUNLK-KAGYGMCKSA-N 0 3 410.562 4.437 20 0 HIADHN CCc1cccc(OCCN2CCC[C@@H](c3n[nH]cc3NC(=O)C3CCCC3)C2)c1 ZINC000502363196 911348682 /nfs/dbraw/zinc/34/86/82/911348682.db2.gz VLXDSNDUGIYFMI-HXUWFJFHSA-N 0 3 410.562 4.359 20 0 HIADHN COc1cc(C)c(C[C@@H](C)N[C@@H](CO)c2ccccc2OC(F)(F)F)cc1OC ZINC000502373853 911358191 /nfs/dbraw/zinc/35/81/91/911358191.db2.gz NOULOUCWEOZZBU-PBHICJAKSA-N 0 3 413.436 4.165 20 0 HIADHN COc1ccc(C(=O)N(CCCc2ccccc2)CCN(C)C)cc1Br ZINC000502376741 911361236 /nfs/dbraw/zinc/36/12/36/911361236.db2.gz VMAWUZBTSGPYBU-UHFFFAOYSA-N 0 3 419.363 4.094 20 0 HIADHN Cc1c(C(=O)N(CCCc2ccccc2)CCN(C)C)cnn1-c1cccc(C)c1 ZINC000502381861 911368832 /nfs/dbraw/zinc/36/88/32/911368832.db2.gz VSFYINXQZPGKKS-UHFFFAOYSA-N 0 3 404.558 4.126 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)c1cccc(NC(=O)c2ccco2)c1 ZINC000502394019 911377748 /nfs/dbraw/zinc/37/77/48/911377748.db2.gz XWWCQZAHTLRSJQ-UHFFFAOYSA-N 0 3 419.525 4.169 20 0 HIADHN O=C(c1cc2ccccc2c(=O)o1)N(CCN1CCCC1)Cc1ccc(Cl)cc1 ZINC000502402584 911388234 /nfs/dbraw/zinc/38/82/34/911388234.db2.gz HCNKUSWRUKVCQY-UHFFFAOYSA-N 0 3 410.901 4.185 20 0 HIADHN O=C(CN[C@@]1(Cc2ccc(Cl)cc2)CCOC1)Nc1ccccc1Br ZINC000502508315 911514637 /nfs/dbraw/zinc/51/46/37/911514637.db2.gz CYNZKNMEDPQCCQ-LJQANCHMSA-N 0 3 423.738 4.032 20 0 HIADHN CCc1ccc([C@H](NCC2(COC)CCC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000502526107 911530035 /nfs/dbraw/zinc/53/00/35/911530035.db2.gz FBTZYFJUDVQEPT-QFIPXVFZSA-N 0 3 401.572 4.148 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)c1ccc(Br)cc1Cl ZINC000513265925 921669603 /nfs/dbraw/zinc/66/96/03/921669603.db2.gz FIPRYUHGWHEQLN-INIZCTEOSA-N 0 3 407.739 4.497 20 0 HIADHN CC[C@H](NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1)c1ccccc1OC(F)F ZINC000502646233 911683015 /nfs/dbraw/zinc/68/30/15/911683015.db2.gz BHQVCRPEQRZFMD-MJGOQNOKSA-N 0 3 403.473 4.313 20 0 HIADHN CCSc1cc(CNC(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)ccn1 ZINC000502683477 911723902 /nfs/dbraw/zinc/72/39/02/911723902.db2.gz WICGILXPVWHMHN-FQEVSTJZSA-N 0 3 416.591 4.083 20 0 HIADHN CCN(CC1CCS(=O)(=O)CC1)[C@H]1CCSc2ccc(Br)cc21 ZINC000502693097 911729397 /nfs/dbraw/zinc/72/93/97/911729397.db2.gz HEORCTZCIJOKMX-INIZCTEOSA-N 0 3 418.422 4.133 20 0 HIADHN C[C@H]1CCN(C)CCN1C(=O)N[C@@H](c1ccccc1)c1ccc(Br)cc1 ZINC000502811062 911827829 /nfs/dbraw/zinc/82/78/29/911827829.db2.gz HQPZOECWPUSANX-JXFKEZNVSA-N 0 3 416.363 4.274 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)CSc3nc4ccccc4o3)c2)CC1 ZINC000502859772 911867997 /nfs/dbraw/zinc/86/79/97/911867997.db2.gz VVFXBZXFMHADEW-UHFFFAOYSA-N 0 3 410.543 4.089 20 0 HIADHN COc1ccc(SCCC(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)cc1 ZINC000502880250 911881039 /nfs/dbraw/zinc/88/10/39/911881039.db2.gz NKZQPYHXHUTSJI-UHFFFAOYSA-N 0 3 413.587 4.347 20 0 HIADHN CC(C)n1ncc2c1nc(C1CC1)cc2C(=O)NC[C@@H]1CCCN1Cc1ccccc1 ZINC000513302661 921698254 /nfs/dbraw/zinc/69/82/54/921698254.db2.gz XGKOAQDVNOGHHL-FQEVSTJZSA-N 0 3 417.557 4.284 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)Cc3cccc(Br)c3)c2)CC1 ZINC000502907085 911894435 /nfs/dbraw/zinc/89/44/35/911894435.db2.gz WLODULNSWDKBOJ-UHFFFAOYSA-N 0 3 416.363 4.161 20 0 HIADHN CC1(C)CN(C(=O)NC[C@H]2CN(Cc3ccccc3)CCCO2)[C@H]1c1cccs1 ZINC000502910235 911897173 /nfs/dbraw/zinc/89/71/73/911897173.db2.gz KKJFHISILIPQEZ-FPOVZHCZSA-N 0 3 413.587 4.132 20 0 HIADHN CC1(C)CN(C(=O)NC[C@@H]2CN(Cc3ccccc3)CCCO2)[C@@H]1c1cccs1 ZINC000502910237 911897599 /nfs/dbraw/zinc/89/75/99/911897599.db2.gz KKJFHISILIPQEZ-TZIWHRDSSA-N 0 3 413.587 4.132 20 0 HIADHN COc1ccc(C(=O)CCC(=O)NCc2ccccc2CN(C)C(C)C)c(Cl)c1 ZINC000502947671 911932315 /nfs/dbraw/zinc/93/23/15/911932315.db2.gz GLVJTRBBCBIJAJ-UHFFFAOYSA-N 0 3 416.949 4.468 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)NCC(C)(C)c1ccc(F)cc1 ZINC000502982000 911961346 /nfs/dbraw/zinc/96/13/46/911961346.db2.gz QELSMVMRYCNBJC-UHFFFAOYSA-N 0 3 407.480 4.155 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)N[C@@H](c1ccccc1)c1ccncc1 ZINC000503014051 911987331 /nfs/dbraw/zinc/98/73/31/911987331.db2.gz GRUZXFSXDZCYAG-RPWUZVMVSA-N 0 3 400.526 4.307 20 0 HIADHN CCOc1ccccc1NC(=O)[C@H](c1ccccc1)N(C)CCCn1ccnc1C ZINC000503070338 912037581 /nfs/dbraw/zinc/03/75/81/912037581.db2.gz CCDVCEFQDPXZAL-QHCPKHFHSA-N 0 3 406.530 4.292 20 0 HIADHN Cc1nccn1CCCN(C)CC(=O)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 ZINC000503076825 912049156 /nfs/dbraw/zinc/04/91/56/912049156.db2.gz RCIJJNRTHANYEA-LJQANCHMSA-N 0 3 409.361 4.184 20 0 HIADHN CN(C)Cc1cccc(NC(=O)N[C@]2(Cc3ccc(C(F)(F)F)cc3)CCOC2)c1 ZINC000513329308 921717592 /nfs/dbraw/zinc/71/75/92/921717592.db2.gz MBXNKXZNTZWCLZ-NRFANRHFSA-N 0 3 421.463 4.290 20 0 HIADHN CC(C)CNC(=O)c1ccc(NC(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)cc1 ZINC000506278934 914880047 /nfs/dbraw/zinc/88/00/47/914880047.db2.gz CWAMKEXQMIVQHO-GCJKJVERSA-N 0 3 408.546 4.029 20 0 HIADHN COc1ccc(Br)cc1NC(=O)N[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000506279818 914880052 /nfs/dbraw/zinc/88/00/52/914880052.db2.gz GPEBVWYYFAFIDJ-PBHICJAKSA-N 0 3 418.335 4.415 20 0 HIADHN CCc1ccc(-c2nn(Cc3ccccc3)cc2CN2CCC(C(=O)NC)CC2)cc1 ZINC000506298039 914892461 /nfs/dbraw/zinc/89/24/61/914892461.db2.gz OBUQVPGHAMJVQN-UHFFFAOYSA-N 0 3 416.569 4.119 20 0 HIADHN COc1ccc(-c2nn(Cc3ccccc3)cc2CN2CCC(OC)CC2)cc1OC ZINC000506307958 914898097 /nfs/dbraw/zinc/89/80/97/914898097.db2.gz GBIRCDVSNRRVDC-UHFFFAOYSA-N 0 3 421.541 4.226 20 0 HIADHN Cc1cc(C)n(-c2ccccc2NC(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)n1 ZINC000506312959 914904435 /nfs/dbraw/zinc/90/44/35/914904435.db2.gz RTZDDBNPUTXYSU-PZJWPPBQSA-N 0 3 403.530 4.446 20 0 HIADHN CC(=O)Nc1cc(NC(=O)[C@@H]2CN(Cc3ccccc3)CCC2(F)F)ccc1C ZINC000506342252 914960329 /nfs/dbraw/zinc/96/03/29/914960329.db2.gz MXTKJEGJDXINLZ-IBGZPJMESA-N 0 3 401.457 4.049 20 0 HIADHN CC(=O)N(c1nc(CN2CCN(C3CCCC3)CC2)cs1)c1ccc(F)cc1 ZINC000506344116 914962162 /nfs/dbraw/zinc/96/21/62/914962162.db2.gz YGOUPRYHYKLMAX-UHFFFAOYSA-N 0 3 402.539 4.027 20 0 HIADHN CC[C@H](C)[C@H](C)C(=O)NC1CCN(CCOc2ccc(Br)cc2)CC1 ZINC000506470642 915068404 /nfs/dbraw/zinc/06/84/04/915068404.db2.gz MTVHTUJIFCCROX-HOTGVXAUSA-N 0 3 411.384 4.091 20 0 HIADHN COc1ccc(Br)c(NC(=O)NC[C@@H](c2ccccc2)N2CCCC2)c1 ZINC000506512911 915139459 /nfs/dbraw/zinc/13/94/59/915139459.db2.gz PFJROEOOEZNVJL-IBGZPJMESA-N 0 3 418.335 4.416 20 0 HIADHN COc1ccc(Br)c(NC(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)c1 ZINC000506515315 915145828 /nfs/dbraw/zinc/14/58/28/915145828.db2.gz GUGWUVCXTQIUPQ-GDBMZVCRSA-N 0 3 418.335 4.415 20 0 HIADHN CCc1c(C(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)cnn1Cc1ccccc1 ZINC000513375363 921750061 /nfs/dbraw/zinc/75/00/61/921750061.db2.gz BJBPIBSBCJRDMD-UGKGYDQZSA-N 0 3 402.542 4.059 20 0 HIADHN CCc1ccc([C@H]2CCCN(C[C@@H](O)COc3ccc(C(C)=O)cc3OC)C2)cc1 ZINC000513406917 921774835 /nfs/dbraw/zinc/77/48/35/921774835.db2.gz ZEOYVBNXZHQZPY-XZOQPEGZSA-N 0 3 411.542 4.080 20 0 HIADHN CN(C)Cc1cccc(NC(=O)[C@H]2CCCN2C(=O)c2cc(Cl)cc(Cl)c2)c1 ZINC000506774006 915489857 /nfs/dbraw/zinc/48/98/57/915489857.db2.gz GSZSJHBRISTCNV-LJQANCHMSA-N 0 3 420.340 4.298 20 0 HIADHN C[C@H](CNC(=O)Nc1ccc(F)cc1OCC(F)(F)F)N(C)Cc1ccccc1 ZINC000506863652 915651403 /nfs/dbraw/zinc/65/14/03/915651403.db2.gz LZWVYWLFTOJRHX-CQSZACIVSA-N 0 3 413.415 4.409 20 0 HIADHN COC(=O)c1cc2c(o1)c(OC)ccc2CN1CC[C@H](n2ncc3ccccc32)C1 ZINC000513419559 921787354 /nfs/dbraw/zinc/78/73/54/921787354.db2.gz FWCYMYXQPORDSM-KRWDZBQOSA-N 0 3 405.454 4.025 20 0 HIADHN FC(F)(F)c1cc(Br)cc(CN2CCC(CN3CCOCC3)CC2)c1 ZINC000506882049 915674394 /nfs/dbraw/zinc/67/43/94/915674394.db2.gz SSPALTBJQFFVBF-UHFFFAOYSA-N 0 3 421.301 4.012 20 0 HIADHN COc1ccc([C@H]2CCCCCN2C(=O)CN[C@H](C)c2ccc3n[nH]cc3c2)cc1 ZINC000513421060 921789341 /nfs/dbraw/zinc/78/93/41/921789341.db2.gz SRANKAMHFXMPRW-UZUQRXQVSA-N 0 3 406.530 4.366 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1csc(-c2ncccc2F)n1)c1ccsc1 ZINC000506994368 915807957 /nfs/dbraw/zinc/80/79/57/915807957.db2.gz GKBGSRSOPCQONP-MRXNPFEDSA-N 0 3 404.536 4.219 20 0 HIADHN O=C(c1csc(Br)c1)N1CCCN(CCCc2ccccc2)CC1 ZINC000507099821 915869846 /nfs/dbraw/zinc/86/98/46/915869846.db2.gz CMOVXVLCMQQRRL-UHFFFAOYSA-N 0 3 407.377 4.291 20 0 HIADHN Cc1noc2nc(C3CC3)cc(C(=O)N3CCCN(CCCc4ccccc4)CC3)c12 ZINC000507161285 915899416 /nfs/dbraw/zinc/89/94/16/915899416.db2.gz JCOJITOABJFKDZ-UHFFFAOYSA-N 0 3 418.541 4.189 20 0 HIADHN COc1ccc(OC)c([C@H]2CCCN2C(=O)CN2CC[C@@H](c3ccccc3C)C2)c1 ZINC000507218584 915970594 /nfs/dbraw/zinc/97/05/94/915970594.db2.gz LLJALXUZHNZUDL-AUSIDOKSSA-N 0 3 408.542 4.165 20 0 HIADHN Cc1cc(NC(=O)[C@@H](C)N[C@@H](C)c2ccc3n[nH]cc3c2)ccc1Br ZINC000507243683 916003578 /nfs/dbraw/zinc/00/35/78/916003578.db2.gz NOZJDGXQRVKXEF-QWHCGFSZSA-N 0 3 401.308 4.312 20 0 HIADHN COc1ccc(CN2CCC(C(=O)Nc3cccc(Br)c3)CC2)cc1 ZINC000507293644 916060781 /nfs/dbraw/zinc/06/07/81/916060781.db2.gz SKJPGXSTIHJEOG-UHFFFAOYSA-N 0 3 403.320 4.308 20 0 HIADHN O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)N1CCO[C@H](c2ccccc2Cl)C1 ZINC000507317407 916078782 /nfs/dbraw/zinc/07/87/82/916078782.db2.gz JVDRSSYPXXNYSX-KNQAVFIVSA-N 0 3 413.949 4.088 20 0 HIADHN O=C(N[C@@H](c1nccs1)c1ccccc1)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000507322032 916083964 /nfs/dbraw/zinc/08/39/64/916083964.db2.gz ZBPOLQFLXJUVOW-NHCUHLMSSA-N 0 3 406.555 4.196 20 0 HIADHN CCOC(=O)CC1CCN(Cc2cn(-c3ccccc3)nc2-c2ccncc2)CC1 ZINC000507347938 916099945 /nfs/dbraw/zinc/09/99/45/916099945.db2.gz IEZFBCUPURXPGX-UHFFFAOYSA-N 0 3 404.514 4.100 20 0 HIADHN Cc1nc(-c2ccccc2Br)sc1[C@H](C)N[C@H]1CCCCNC1=O ZINC000507442417 916212838 /nfs/dbraw/zinc/21/28/38/916212838.db2.gz KICIRFIRPRIGLU-NHYWBVRUSA-N 0 3 408.365 4.200 20 0 HIADHN Cc1nn(C(C)(C)C)c2nc(C3CC3)cc(C(=O)NCCN(C)Cc3ccccc3)c12 ZINC000507460173 916227638 /nfs/dbraw/zinc/22/76/38/916227638.db2.gz MCVADKLYKGUDDK-UHFFFAOYSA-N 0 3 419.573 4.234 20 0 HIADHN COCCSc1ccc([C@H](C)N[C@@H](C)C(=O)NCc2ccccc2Cl)cc1 ZINC000507464276 916229808 /nfs/dbraw/zinc/22/98/08/916229808.db2.gz MQRPSUFFEBTNCT-HOTGVXAUSA-N 0 3 406.979 4.434 20 0 HIADHN COCCSc1ccc([C@@H](C)N[C@@H](C)C(=O)NCc2ccccc2Cl)cc1 ZINC000507464275 916230418 /nfs/dbraw/zinc/23/04/18/916230418.db2.gz MQRPSUFFEBTNCT-CVEARBPZSA-N 0 3 406.979 4.434 20 0 HIADHN COc1ccc(OC)c([C@@H](C)NC(=O)[C@H](C)N[C@H](C)c2ccc(SC)cc2)c1 ZINC000507486847 916255128 /nfs/dbraw/zinc/25/51/28/916255128.db2.gz PUMVZRQSQCKMJW-OAGGEKHMSA-N 0 3 402.560 4.342 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)Cc2csc(Cc3ccccc3)n2)C1 ZINC000507578557 916332870 /nfs/dbraw/zinc/33/28/70/916332870.db2.gz GFOPGTYNMRGCFE-WIYYLYMNSA-N 0 3 405.567 4.228 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3ccc(C)c(C(C)=O)c3)c(OCC)c2)CC1 ZINC000507604698 916359772 /nfs/dbraw/zinc/35/97/72/916359772.db2.gz VXDZAFSLQCMYRY-UHFFFAOYSA-N 0 3 423.557 4.381 20 0 HIADHN O=C(Nc1ccc(N2CCCC2)cn1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000507659742 916420816 /nfs/dbraw/zinc/42/08/16/916420816.db2.gz VNSQDIDCLVONFL-OAQYLSRUSA-N 0 3 418.463 4.075 20 0 HIADHN CC(C)N(CC(=O)Nc1cccc(CN2CCSCC2)c1)Cc1ccc(F)cc1 ZINC000507658286 916421081 /nfs/dbraw/zinc/42/10/81/916421081.db2.gz MCUFSKJMWOTBKC-UHFFFAOYSA-N 0 3 415.578 4.224 20 0 HIADHN COC(=O)[C@@H](C)Oc1ccc(CN2CCC(Oc3ccccc3Cl)CC2)cc1 ZINC000507665163 916429476 /nfs/dbraw/zinc/42/94/76/916429476.db2.gz IEHFOVZLSYSYFQ-MRXNPFEDSA-N 0 3 403.906 4.324 20 0 HIADHN Cc1noc([C@H]2CCCN(C[C@@H](O)CO[C@H](c3ccccc3)c3ccc(C)cc3)C2)n1 ZINC000507687120 916459940 /nfs/dbraw/zinc/45/99/40/916459940.db2.gz JEZWJMUWYXNIGM-RBZQAINGSA-N 0 3 421.541 4.033 20 0 HIADHN CC(C)(C(=O)NC[C@H]1CCCCN1C1CC1)c1csc(-c2ccccc2F)n1 ZINC000507759856 916546888 /nfs/dbraw/zinc/54/68/88/916546888.db2.gz RJHHRENXFGRLOI-MRXNPFEDSA-N 0 3 401.551 4.360 20 0 HIADHN CCOc1ccccc1NC(=O)[C@H](NCCc1c[nH]c2ncccc12)c1ccccc1 ZINC000507856332 916683672 /nfs/dbraw/zinc/68/36/72/916683672.db2.gz NFLUQQLDZUFQED-HSZRJFAPSA-N 0 3 414.509 4.474 20 0 HIADHN FC(F)Oc1ccc(CNCc2ccnc(N3CCCC3)c2)cc1Br ZINC000507874810 916714949 /nfs/dbraw/zinc/71/49/49/916714949.db2.gz DSTKAJJKEMXWOG-UHFFFAOYSA-N 0 3 412.278 4.336 20 0 HIADHN Cn1nccc1-c1ccccc1CN1CCCN(C(=O)Nc2cccc(Cl)c2)CC1 ZINC000507948667 916811383 /nfs/dbraw/zinc/81/13/83/916811383.db2.gz JULDKWLUISRLDC-UHFFFAOYSA-N 0 3 423.948 4.480 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CN1CCC[C@@H](C(=O)Nc2ccc(C)cn2)C1 ZINC000507983263 916828066 /nfs/dbraw/zinc/82/80/66/916828066.db2.gz AONCLYRPIUTQEF-JOCHJYFZSA-N 0 3 417.557 4.102 20 0 HIADHN Cc1cc(C)n2ncc(-c3noc([C@@H]4CN(Cc5ccccc5)CCC4(F)F)n3)c2n1 ZINC000508039234 916869462 /nfs/dbraw/zinc/86/94/62/916869462.db2.gz QBOIIWSKOKGOOJ-SFHVURJKSA-N 0 3 424.455 4.021 20 0 HIADHN CC(C)Cn1ncc(C(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)c1C1CC1 ZINC000508075455 916896359 /nfs/dbraw/zinc/89/63/59/916896359.db2.gz ZHMIYSGHUVYKDA-UHFFFAOYSA-N 0 3 409.578 4.199 20 0 HIADHN O=C(Nc1ccc2oc(C(F)(F)F)nc2c1)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000508130172 916949956 /nfs/dbraw/zinc/94/99/56/916949956.db2.gz AFQMHKKJGVNNST-HNNXBMFYSA-N 0 3 404.392 4.243 20 0 HIADHN CS(=O)(=O)c1ccc(NC(=O)CNC2(c3ccc(Cl)cc3)CCCCC2)cc1 ZINC000508139084 916958820 /nfs/dbraw/zinc/95/88/20/916958820.db2.gz YYMKAPLMVVTELB-UHFFFAOYSA-N 0 3 420.962 4.131 20 0 HIADHN O=C(CCc1ccc(F)cc1F)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000508329550 917131386 /nfs/dbraw/zinc/13/13/86/917131386.db2.gz CQURXRRAOVWDNC-HXUWFJFHSA-N 0 3 410.468 4.180 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N2CCO[C@H](c3ccccc3Cl)C2)N(C)C)cc1 ZINC000508391265 917186394 /nfs/dbraw/zinc/18/63/94/917186394.db2.gz JSCVDABFUTYRDG-SFTDATJTSA-N 0 3 401.938 4.034 20 0 HIADHN CCCN(C(=O)c1ccc2c(c1)OCCCO2)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000508460688 917245137 /nfs/dbraw/zinc/24/51/37/917245137.db2.gz ZVTFTZZMBQRYLK-QFIPXVFZSA-N 0 3 408.542 4.365 20 0 HIADHN COCCN(Cc1ccc(-n2cncn2)cc1)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000508540258 917320559 /nfs/dbraw/zinc/32/05/59/917320559.db2.gz BSPFNMUQHXJQAD-MRXNPFEDSA-N 0 3 404.436 4.496 20 0 HIADHN Cn1ccnc1C[C@H]1CCCN(Cc2cc(Cl)ccc2OC[C@@H]2CCCO2)C1 ZINC000508638979 917403750 /nfs/dbraw/zinc/40/37/50/917403750.db2.gz PRHKQWSAKDMESI-XLIONFOSSA-N 0 3 403.954 4.086 20 0 HIADHN CC[C@H](C)NC(=O)[C@@H]1C[C@H](C)N(CC(=O)Nc2cc(C)ccc2C)[C@@H]2CCCC[C@H]12 ZINC000508651431 917417784 /nfs/dbraw/zinc/41/77/84/917417784.db2.gz AIPRYORVGIQEPS-IUHILOBXSA-N 0 3 413.606 4.426 20 0 HIADHN CC[C@H](C)NC(=O)[C@@H]1C[C@H](C)N(CC(=O)Nc2cccc(C)c2C)[C@H]2CCCC[C@H]12 ZINC000508673608 917437910 /nfs/dbraw/zinc/43/79/10/917437910.db2.gz YLYQPOAWXGVVRP-BDIVZWSOSA-N 0 3 413.606 4.426 20 0 HIADHN CC[C@H](C)NC(=O)[C@@H]1C[C@H](C)N(CC(=O)Nc2c(C)cccc2C)[C@@H]2CCCC[C@@H]12 ZINC000508673165 917438079 /nfs/dbraw/zinc/43/80/79/917438079.db2.gz XJXCPXMZZYHWJC-RTOMLYRKSA-N 0 3 413.606 4.426 20 0 HIADHN O=C(Nc1ccc(-c2nnco2)cc1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000508814870 917568491 /nfs/dbraw/zinc/56/84/91/917568491.db2.gz YFHRAZKEPHLCBM-FQEVSTJZSA-N 0 3 416.403 4.130 20 0 HIADHN COc1cccc(C2(F)CCN(C(=O)N[C@H](C)[C@@H](c3ccccc3)N(C)C)CC2)c1 ZINC000508842551 917594366 /nfs/dbraw/zinc/59/43/66/917594366.db2.gz BZBGKFQFTNOSJM-GCJKJVERSA-N 0 3 413.537 4.357 20 0 HIADHN C[C@@H](NC(=O)N(Cc1ccccc1)CC1CCOCC1)[C@H](c1ccccc1)N(C)C ZINC000508852251 917606158 /nfs/dbraw/zinc/60/61/58/917606158.db2.gz JUDOEDWUMBCSQT-HYBUGGRVSA-N 0 3 409.574 4.316 20 0 HIADHN C[C@H](NC(=O)Nc1ccccc1OC[C@H]1CCCCO1)[C@@H](c1ccccc1)N(C)C ZINC000508853430 917606350 /nfs/dbraw/zinc/60/63/50/917606350.db2.gz RBTATUVYYUEMLH-NOXFTYBFSA-N 0 3 411.546 4.447 20 0 HIADHN CCN(CC1CCN(c2ccccn2)CC1)C(=O)N[C@H](C)[C@H](c1ccccc1)N(C)C ZINC000508857338 917611171 /nfs/dbraw/zinc/61/11/71/917611171.db2.gz WWYCTJWVOGNULM-HYBUGGRVSA-N 0 3 423.605 4.021 20 0 HIADHN C[C@@H](NC(=O)N(C)Cc1cc(Br)cs1)[C@H](c1ccccc1)N(C)C ZINC000508875256 917628800 /nfs/dbraw/zinc/62/88/00/917628800.db2.gz BUVNMISVPXDXIL-CXAGYDPISA-N 0 3 410.381 4.343 20 0 HIADHN Cc1cccc(NC(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)c1C(=O)N1CCCC1 ZINC000508889926 917643981 /nfs/dbraw/zinc/64/39/81/917643981.db2.gz DXBANKRTIPTNEP-GCJKJVERSA-N 0 3 408.546 4.044 20 0 HIADHN COCCOc1ccc(NC(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)cc1Cl ZINC000508893026 917647910 /nfs/dbraw/zinc/64/79/10/917647910.db2.gz DLOZARSFGLWYEJ-FOIQADDNSA-N 0 3 405.926 4.178 20 0 HIADHN Brc1cnn(C2CCN(Cc3ccc(OC[C@H]4CCCO4)cc3)CC2)c1 ZINC000508896398 917650847 /nfs/dbraw/zinc/65/08/47/917650847.db2.gz YYNBPXBIQRBMMX-HXUWFJFHSA-N 0 3 420.351 4.041 20 0 HIADHN C[C@@H](NC(=O)N1CCC(c2nc3ccccc3[nH]2)CC1)[C@@H](c1ccccc1)N(C)C ZINC000508902450 917658857 /nfs/dbraw/zinc/65/88/57/917658857.db2.gz WKFDZGHZBNZIPJ-VGSWGCGISA-N 0 3 405.546 4.143 20 0 HIADHN COc1cc(NC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)cc(OC)c1 ZINC000508914627 917671896 /nfs/dbraw/zinc/67/18/96/917671896.db2.gz DNEBJBRLFOOBTE-FQEVSTJZSA-N 0 3 408.420 4.097 20 0 HIADHN Cc1nc2sccn2c(=O)c1CCN1CCC[C@H]1c1nc2ccccc2n1C(C)C ZINC000509027524 917782082 /nfs/dbraw/zinc/78/20/82/917782082.db2.gz FKUZMWGIEVJKTO-FQEVSTJZSA-N 0 3 421.570 4.375 20 0 HIADHN O=C([C@H]1CN(Cc2ccccc2)CCC1(F)F)N1CCC(OC2CCCC2)CC1 ZINC000509036055 917790009 /nfs/dbraw/zinc/79/00/09/917790009.db2.gz DLRHBSBADXRAQJ-OAQYLSRUSA-N 0 3 406.517 4.094 20 0 HIADHN CCn1ncc2ccc(NC(=O)[C@]3(C(F)(F)F)CCN(Cc4ccccc4)C3)cc21 ZINC000509126864 917859704 /nfs/dbraw/zinc/85/97/04/917859704.db2.gz WHIMWKJLJXRONB-NRFANRHFSA-N 0 3 416.447 4.449 20 0 HIADHN C[C@H](c1cccc(N2CCCS2(=O)=O)c1)N(C)Cc1ccccc1C(F)(F)F ZINC000509150080 917872070 /nfs/dbraw/zinc/87/20/70/917872070.db2.gz FKWVICCJAKAWEC-OAHLLOKOSA-N 0 3 412.477 4.438 20 0 HIADHN Fc1ccc([C@H]2CN(CCCN3CCN(c4ccccc4)CC3)CCO2)c(Cl)c1 ZINC000509158681 917876843 /nfs/dbraw/zinc/87/68/43/917876843.db2.gz WZKNWWLMKHAQNV-HSZRJFAPSA-N 0 3 417.956 4.065 20 0 HIADHN Cc1nc2sccn2c(=O)c1CCN1CCC[C@@H]1c1ccc(Br)cc1 ZINC000509261445 917950512 /nfs/dbraw/zinc/95/05/12/917950512.db2.gz BXRYQPAUZNBYNB-QGZVFWFLSA-N 0 3 418.360 4.207 20 0 HIADHN Cc1noc([C@@H]2CCCN(Cc3cn(-c4ccccc4)nc3-c3cccnc3)C2)n1 ZINC000509346563 918011556 /nfs/dbraw/zinc/01/15/56/918011556.db2.gz WZFXXJVMGGGDLZ-LJQANCHMSA-N 0 3 400.486 4.005 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)N[C@H](c1nccs1)c1ccccc1 ZINC000509346981 918012763 /nfs/dbraw/zinc/01/27/63/918012763.db2.gz ZWXJJSNXXLIOGQ-RTWAWAEBSA-N 0 3 406.555 4.369 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)N[C@H](c1nccs1)c1ccccc1 ZINC000509365001 918030777 /nfs/dbraw/zinc/03/07/77/918030777.db2.gz ILWLKNAFZFCZJN-RTWAWAEBSA-N 0 3 406.555 4.369 20 0 HIADHN O=C(Nc1ccc(Br)cn1)C1CCN(C/C=C/c2ccc(F)cc2)CC1 ZINC000509393909 918060332 /nfs/dbraw/zinc/06/03/32/918060332.db2.gz TVRBKBVNRYEQQK-OWOJBTEDSA-N 0 3 418.310 4.347 20 0 HIADHN CCCN1CCN(c2ccccc2CNCc2ccsc2Br)CC1 ZINC000509439277 918095298 /nfs/dbraw/zinc/09/52/98/918095298.db2.gz NTBDCFRUYGYZKW-UHFFFAOYSA-N 0 3 408.409 4.332 20 0 HIADHN CC(C)N(C)C(=O)C1CCN(Cc2cn(Cc3ccccc3)nc2C(C)(C)C)CC1 ZINC000509521734 918170707 /nfs/dbraw/zinc/17/07/07/918170707.db2.gz ARQCHZJBAIPWGQ-UHFFFAOYSA-N 0 3 410.606 4.308 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N1CCC[C@H]1Cn1c(C)nc2ccccc21)c1ccco1 ZINC000509556914 918207416 /nfs/dbraw/zinc/20/74/16/918207416.db2.gz NYOCWNBEHHKVQX-HFSMHLIXSA-N 0 3 423.561 4.241 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N1CCC(C(F)(F)F)(C(F)(F)F)C1)c1ccco1 ZINC000509567829 918217835 /nfs/dbraw/zinc/21/78/35/918217835.db2.gz KUZKDLSVMSCNAR-RYUDHWBXSA-N 0 3 415.378 4.235 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)N1CCC(F)(c2cccc(OC)c2)CC1)c1ccco1 ZINC000509568135 918217929 /nfs/dbraw/zinc/21/79/29/918217929.db2.gz LGKUUECTZJDYJY-YLJYHZDGSA-N 0 3 417.525 4.388 20 0 HIADHN CC[C@H](NC(=O)N(CCN(C)C)Cc1ccc(F)cc1)c1ccc(OC)c(OC)c1 ZINC000509569557 918219274 /nfs/dbraw/zinc/21/92/74/918219274.db2.gz OHXCULRYDQABKL-FQEVSTJZSA-N 0 3 417.525 4.067 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)N(C)Cc1nc(C(F)(F)F)cs1)c1ccco1 ZINC000509569126 918219375 /nfs/dbraw/zinc/21/93/75/918219375.db2.gz NBHPLSLOHYJXKR-NEPJUHHUSA-N 0 3 404.458 4.026 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)NC(C)(C)c1nc(C(F)(F)F)cs1)c1ccco1 ZINC000509579826 918228402 /nfs/dbraw/zinc/22/84/02/918228402.db2.gz XARBQFUNUFXMNX-RYUDHWBXSA-N 0 3 418.485 4.419 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N(CCCO)[C@H]1CCCc2ccccc21)c1ccco1 ZINC000509587092 918236816 /nfs/dbraw/zinc/23/68/16/918236816.db2.gz JFLCPPNZHHGVAL-NYVOZVTQSA-N 0 3 413.562 4.180 20 0 HIADHN CCN1CCC[C@@H](CN(C)c2cc(C)nc3c(F)c(F)ccc23)[C@@H]1c1cnn(C)c1 ZINC000509594208 918243086 /nfs/dbraw/zinc/24/30/86/918243086.db2.gz SRLDYTRWLZLXGT-QMHKHESXSA-N 0 3 413.516 4.464 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)N1CCC2(CC1)OCCc1ccsc12)c1ccco1 ZINC000509595986 918246948 /nfs/dbraw/zinc/24/69/48/918246948.db2.gz LYMKJMZTEIYGEY-AEFFLSMTSA-N 0 3 417.575 4.044 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)N1CCC[C@H](OCc2ccccc2F)C1)c1ccco1 ZINC000509596162 918247142 /nfs/dbraw/zinc/24/71/42/918247142.db2.gz NPJONCVZNPSMPR-SLYNCCJLSA-N 0 3 417.525 4.239 20 0 HIADHN CCN1CCC[C@@H](CN(C)c2ncccc2OCc2ccccc2)[C@@H]1c1cnn(C)c1 ZINC000509602976 918251190 /nfs/dbraw/zinc/25/11/90/918251190.db2.gz QEIXYFSBHLXJSR-XUZZJYLKSA-N 0 3 419.573 4.304 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)N1CC=C(c2c[nH]c3ncccc23)CC1)c1ccco1 ZINC000509611103 918258968 /nfs/dbraw/zinc/25/89/68/918258968.db2.gz MWDVLRHBNZYAAJ-OXQOHEQNSA-N 0 3 407.518 4.084 20 0 HIADHN c1csc([C@@H](CNCc2ccc(Sc3ccccn3)o2)N2CCOCC2)c1 ZINC000509638024 918280248 /nfs/dbraw/zinc/28/02/48/918280248.db2.gz BATOYCUCENZLGQ-QGZVFWFLSA-N 0 3 401.557 4.050 20 0 HIADHN CCOC[C@@H]1CCCN([C@@H]2CCCN(c3c(C)cc(Br)cc3C)C2=O)C1 ZINC000509701116 918330754 /nfs/dbraw/zinc/33/07/54/918330754.db2.gz UULIGQCJXFWWCF-IEBWSBKVSA-N 0 3 423.395 4.310 20 0 HIADHN CC[C@H](NC(=O)N(CCN(C)C)Cc1cccc(F)c1)c1ccc(OC)c(OC)c1 ZINC000509702772 918333046 /nfs/dbraw/zinc/33/30/46/918333046.db2.gz QVJVGWBNQUSIAC-FQEVSTJZSA-N 0 3 417.525 4.067 20 0 HIADHN Cc1nc2sccn2c(=O)c1CCN1CCc2sccc2[C@@H]1c1cccs1 ZINC000509819744 918422584 /nfs/dbraw/zinc/42/25/84/918422584.db2.gz MXWQZRBUFMPRBO-GOSISDBHSA-N 0 3 413.593 4.378 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)NC[C@H](c3ccccc3)[NH+]3CCCC3)cc2)cc(=O)[n-]1 ZINC000509880581 918482240 /nfs/dbraw/zinc/48/22/40/918482240.db2.gz MRPNMWRVIKHQJA-JOCHJYFZSA-N 0 3 417.513 4.116 20 0 HIADHN CC(C)c1nccn1Cc1cccc(NC(=O)N[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000509901869 918503826 /nfs/dbraw/zinc/50/38/26/918503826.db2.gz XIVQHLNURIQHRQ-QHCPKHFHSA-N 0 3 417.557 4.451 20 0 HIADHN CC(C)c1nccn1Cc1cccc(NC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000509901868 918504324 /nfs/dbraw/zinc/50/43/24/918504324.db2.gz XIVQHLNURIQHRQ-HSZRJFAPSA-N 0 3 417.557 4.451 20 0 HIADHN Cn1cc2c(n1)CCC[C@H]2NCc1ccc(OC(F)(F)[C@H](F)C(F)(F)F)cc1 ZINC000509956789 918549604 /nfs/dbraw/zinc/54/96/04/918549604.db2.gz IUYJEIBWEQOAKB-GDBMZVCRSA-N 0 3 407.358 4.459 20 0 HIADHN C[C@H]([N-]S(=O)(=O)c1cc(Cl)ccc1C(F)(F)F)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000509972090 918561387 /nfs/dbraw/zinc/56/13/87/918561387.db2.gz VUMOGJDPKWDZDC-STQMWFEESA-N 0 3 424.916 4.290 20 0 HIADHN C[C@H]([N-]S(=O)(=O)c1cc(Cl)ccc1C(F)(F)F)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000509972090 918561394 /nfs/dbraw/zinc/56/13/94/918561394.db2.gz VUMOGJDPKWDZDC-STQMWFEESA-N 0 3 424.916 4.290 20 0 HIADHN Cc1cc(C(=O)N(CCCc2ccccc2)CCN(C)C)c(C)n1-c1nccs1 ZINC000509982881 918570570 /nfs/dbraw/zinc/57/05/70/918570570.db2.gz PBYUYZPNJBGNRU-UHFFFAOYSA-N 0 3 410.587 4.187 20 0 HIADHN O=C(Nc1nc(C(F)(F)F)cs1)N1CCCN(CCCc2ccccc2)CC1 ZINC000510025442 918601627 /nfs/dbraw/zinc/60/16/27/918601627.db2.gz DZNXACSXURZFJD-UHFFFAOYSA-N 0 3 412.481 4.334 20 0 HIADHN O=C(N[C@@H]1CCN(Cc2ccccc2)C1)c1cccc(COc2cccc(F)c2)c1 ZINC000510140537 918697158 /nfs/dbraw/zinc/69/71/58/918697158.db2.gz RFZIUANPMRVJJX-HSZRJFAPSA-N 0 3 404.485 4.409 20 0 HIADHN CC[C@H](NCC(=O)N1CCc2sccc2[C@H]1CC)c1ccc(OC)c(OC)c1 ZINC000510236620 918776244 /nfs/dbraw/zinc/77/62/44/918776244.db2.gz FHULXZWRMXMBFR-ZWKOTPCHSA-N 0 3 402.560 4.342 20 0 HIADHN CC[C@H](N[C@H](C)C(=O)Nc1ccc(-c2c[nH]cn2)cc1)c1ccc(OC)c(OC)c1 ZINC000510272010 918798437 /nfs/dbraw/zinc/79/84/37/918798437.db2.gz WSWJIPNZLPDVSS-BEFAXECRSA-N 0 3 408.502 4.162 20 0 HIADHN CN(C)[C@@H](CNC(=O)N[C@H](CC(F)(F)F)c1ccc(F)cc1)Cc1ccccc1 ZINC000510350025 918846675 /nfs/dbraw/zinc/84/66/75/918846675.db2.gz FQBNGDMPWVUQQT-RTBURBONSA-N 0 3 411.443 4.291 20 0 HIADHN COc1ccc([C@@H](CNC(=O)NCc2ccc(F)c(Cl)c2)N2CCCC2)cc1 ZINC000510356616 918849989 /nfs/dbraw/zinc/84/99/89/918849989.db2.gz FHXSPPONQDCUAY-HXUWFJFHSA-N 0 3 405.901 4.124 20 0 HIADHN COc1ccc([C@H](CNC(=O)NCc2ccc(F)c(Cl)c2)N2CCCC2)cc1 ZINC000510356615 918850126 /nfs/dbraw/zinc/85/01/26/918850126.db2.gz FHXSPPONQDCUAY-FQEVSTJZSA-N 0 3 405.901 4.124 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)N1CCN(Cc2ccc(Cl)s2)CC1 ZINC000510367949 918856494 /nfs/dbraw/zinc/85/64/94/918856494.db2.gz VWHFTMMKXRBZBU-UHFFFAOYSA-N 0 3 417.962 4.167 20 0 HIADHN COc1ccc(C)cc1NC(=O)N(CCN(C)C)Cc1ccc(Br)cc1 ZINC000510374773 918860632 /nfs/dbraw/zinc/86/06/32/918860632.db2.gz IKBXJYODYHBNLS-UHFFFAOYSA-N 0 3 420.351 4.362 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N[C@@H](C)c3ccc(C(F)(F)F)cc3)cc2)CC1 ZINC000510375779 918860669 /nfs/dbraw/zinc/86/06/69/918860669.db2.gz HBHJZBFJDJJBLK-INIZCTEOSA-N 0 3 405.464 4.338 20 0 HIADHN CC1CCN(c2ccc(CNC(=O)c3oc4ccccc4c3CN(C)C)cn2)CC1 ZINC000510390686 918869015 /nfs/dbraw/zinc/86/90/15/918869015.db2.gz ZSMYRCQITBBZNT-UHFFFAOYSA-N 0 3 406.530 4.056 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)c1ccc(Cl)c(Br)c1 ZINC000510443442 918899378 /nfs/dbraw/zinc/89/93/78/918899378.db2.gz STWLDRJJRDNXNJ-UHFFFAOYSA-N 0 3 401.757 4.368 20 0 HIADHN O=C(C1CCC(NCc2ccc(Sc3ccccn3)o2)CC1)N1CCSCC1 ZINC000510533695 918978526 /nfs/dbraw/zinc/97/85/26/918978526.db2.gz LQGDXKYKSYHBHP-UHFFFAOYSA-N 0 3 417.600 4.050 20 0 HIADHN Cc1ccc(NC(=O)NC[C@@H](Cc2ccccc2)N(C)C)c(OCC(F)(F)F)c1 ZINC000510536966 918982337 /nfs/dbraw/zinc/98/23/37/918982337.db2.gz ZPNZRCAJARQEFL-QGZVFWFLSA-N 0 3 409.452 4.231 20 0 HIADHN COc1cc(CN2CCC[C@@H](c3ncc[nH]3)C2)cc(OC)c1OCc1ccccc1 ZINC000510540880 918985507 /nfs/dbraw/zinc/98/55/07/918985507.db2.gz XCFFLIHCDUHPSQ-HXUWFJFHSA-N 0 3 407.514 4.386 20 0 HIADHN Cc1sc(CNC(=O)N[C@H](C)C2=CCN(C)CC2)nc1-c1ccc(Cl)cc1 ZINC000510544599 918989592 /nfs/dbraw/zinc/98/95/92/918989592.db2.gz DRRYCWISHDPFHC-CYBMUJFWSA-N 0 3 404.967 4.222 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)N[C@@H](c2nccs2)c2ccccc2)CC1 ZINC000510577359 919019853 /nfs/dbraw/zinc/01/98/53/919019853.db2.gz HEQWHTBWSUVSBH-HXUWFJFHSA-N 0 3 410.543 4.132 20 0 HIADHN C[C@H](NC(=O)NC(Cc1ccccc1F)Cc1ccccc1F)C1=CCN(C)CC1 ZINC000510602128 919043551 /nfs/dbraw/zinc/04/35/51/919043551.db2.gz VTVCZIRHPZVZQP-KRWDZBQOSA-N 0 3 413.512 4.068 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)Nc2ccc(C(=O)NCC(C)C)cc2)N(C)C)cc1 ZINC000510665901 919108005 /nfs/dbraw/zinc/10/80/05/919108005.db2.gz OCSATBZPEDDPJI-JOCHJYFZSA-N 0 3 410.562 4.059 20 0 HIADHN CC[C@@H](CNC(=O)Nc1ccc(OC(F)F)c(F)c1)N1CCc2ccccc2C1 ZINC000510676338 919115415 /nfs/dbraw/zinc/11/54/15/919115415.db2.gz UJEPNIWNPNNAKN-KRWDZBQOSA-N 0 3 407.436 4.386 20 0 HIADHN CC(=O)CCc1ccc(OCc2cccc(C(=O)N[C@@H](C)C3=CCN(C)CC3)c2)cc1 ZINC000510741719 919188649 /nfs/dbraw/zinc/18/86/49/919188649.db2.gz OZTKZMVYDQZPEW-FQEVSTJZSA-N 0 3 420.553 4.167 20 0 HIADHN CCCc1ccccc1NC(=O)NCCCCN1CCN(Cc2ccccc2)CC1 ZINC000510761060 919209820 /nfs/dbraw/zinc/20/98/20/919209820.db2.gz GAIZYPPKQXLOLI-UHFFFAOYSA-N 0 3 408.590 4.359 20 0 HIADHN C[C@H](CC1CCCCC1)C(=O)N1CCC[C@@H](CN2CCN(c3ccccn3)CC2)C1 ZINC000510783707 919245967 /nfs/dbraw/zinc/24/59/67/919245967.db2.gz STGKSCWNFZNIOV-GGAORHGYSA-N 0 3 412.622 4.049 20 0 HIADHN CC[C@@H](CC1CCCC1)C(=O)N1CCC[C@H](CN2CCN(c3ccccn3)CC2)C1 ZINC000510785184 919248591 /nfs/dbraw/zinc/24/85/91/919248591.db2.gz ZDUHJEXLUYFXGU-PKTZIBPZSA-N 0 3 412.622 4.049 20 0 HIADHN COc1ccc(NC(=O)N(CCN(C)C)Cc2ccc(Br)cc2)cc1F ZINC000510795541 919265564 /nfs/dbraw/zinc/26/55/64/919265564.db2.gz HLOUXCLDFDPCOI-UHFFFAOYSA-N 0 3 424.314 4.193 20 0 HIADHN O=C([C@@H]1CN(Cc2ccccc2)CCC1(F)F)N1CCC[C@@H](c2nccs2)C1 ZINC000510824589 919304383 /nfs/dbraw/zinc/30/43/83/919304383.db2.gz FHSRCMVRELNNCB-MSOLQXFVSA-N 0 3 405.514 4.007 20 0 HIADHN O=C([C@H]1CN(Cc2ccccc2)CCC1(F)F)N(Cc1cc[nH]n1)Cc1ccccc1 ZINC000510857219 919348238 /nfs/dbraw/zinc/34/82/38/919348238.db2.gz MENAADCADPYTTN-JOCHJYFZSA-N 0 3 424.495 4.096 20 0 HIADHN Cc1cc(C)n(-c2ccc(NC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)cc2F)n1 ZINC000510867534 919359649 /nfs/dbraw/zinc/35/96/49/919359649.db2.gz ITXGSJKIOLYSGJ-HXUWFJFHSA-N 0 3 407.493 4.024 20 0 HIADHN C[C@H]1CN(Cc2ccccn2)CC[C@@H]1Nc1ccc(NC(=O)CC(F)(F)F)cc1 ZINC000510974527 919521931 /nfs/dbraw/zinc/52/19/31/919521931.db2.gz GMSDNROYZSNHPG-KXBFYZLASA-N 0 3 406.452 4.295 20 0 HIADHN Cc1c([C@@H](C)N[C@H]2CCCN(C(=O)Cc3ccccc3)C2)cnn1-c1ccc(F)cc1 ZINC000510991471 919547668 /nfs/dbraw/zinc/54/76/68/919547668.db2.gz ITMSCOKELYMOHK-GCJKJVERSA-N 0 3 420.532 4.204 20 0 HIADHN CC[C@H](N[C@@H]1CCN(C(=O)COc2ccccc2)C1)c1ccccc1OC(F)F ZINC000511016408 919585670 /nfs/dbraw/zinc/58/56/70/919585670.db2.gz PCWDIGFCUTWQAM-APWZRJJASA-N 0 3 404.457 4.009 20 0 HIADHN O=C(COc1ccccc1)N1CC[C@@H](N[C@@H]2CCSc3ccc(Cl)cc32)C1 ZINC000511045964 919634733 /nfs/dbraw/zinc/63/47/33/919634733.db2.gz JOODZRCPUMRFEF-VQIMIIECSA-N 0 3 402.947 4.146 20 0 HIADHN C[C@H]1CN(c2ccccc2NC(=O)N2CCCN(Cc3ccccc3)CC2)C[C@H](C)O1 ZINC000511054692 919649634 /nfs/dbraw/zinc/64/96/34/919649634.db2.gz PKLXLIIQIPVXBD-SFTDATJTSA-N 0 3 422.573 4.040 20 0 HIADHN CC[C@H](C)c1ccc([C@@H](NC(=O)CCN2CCN(CC)CC2)c2cccs2)cc1 ZINC000511107860 919715616 /nfs/dbraw/zinc/71/56/16/919715616.db2.gz SROHKPWMRBKBNA-YADARESESA-N 0 3 413.631 4.495 20 0 HIADHN CCCN(Cc1cc(C(=O)OC)ccc1F)C1CCN(C(=O)c2ccccc2)CC1 ZINC000511121021 919732727 /nfs/dbraw/zinc/73/27/27/919732727.db2.gz MCNCEUDKZJRSMY-UHFFFAOYSA-N 0 3 412.505 4.129 20 0 HIADHN CC(C)Sc1ccc(CN2CCC(OCCN3C[C@H](C)O[C@@H](C)C3)CC2)cc1 ZINC000511206051 919818427 /nfs/dbraw/zinc/81/84/27/919818427.db2.gz YCDGRAMHZNZNHO-PMACEKPBSA-N 0 3 406.636 4.277 20 0 HIADHN CC[C@H](NC1CCC(NC(=O)COc2ccc(Cl)cc2)CC1)c1nccs1 ZINC000511218461 919828742 /nfs/dbraw/zinc/82/87/42/919828742.db2.gz UVXBUPORVKCHDA-HTWSVDAQSA-N 0 3 407.967 4.344 20 0 HIADHN CN(Cc1ccccc1)Cc1cccc(C(=O)NCc2cccc(Cn3ccnc3)c2)c1 ZINC000511219981 919828891 /nfs/dbraw/zinc/82/88/91/919828891.db2.gz DKMPBHYQVZCQEB-UHFFFAOYSA-N 0 3 424.548 4.493 20 0 HIADHN C[C@H](NC(=O)Nc1cccc(COCCOc2ccccc2)c1)C1=CCN(C)CC1 ZINC000511245524 919845106 /nfs/dbraw/zinc/84/51/06/919845106.db2.gz BNWRJMGKTQAACD-IBGZPJMESA-N 0 3 409.530 4.054 20 0 HIADHN COc1ccc2c(c1)CN(C(=O)N[C@H](C)C1=CCN(C)CC1)[C@@H](C1CCCCC1)C2 ZINC000511249821 919849832 /nfs/dbraw/zinc/84/98/32/919849832.db2.gz PLMXLFFHVFLQDH-HOYKHHGWSA-N 0 3 411.590 4.362 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)Nc1ncc(Cc2ccccc2)s1 ZINC000511259156 919859603 /nfs/dbraw/zinc/85/96/03/919859603.db2.gz QMUHBJYHLSQUOB-UHFFFAOYSA-N 0 3 412.534 4.469 20 0 HIADHN Cc1cc(CN(C)C(=O)N[C@@H](C)C2=CCN(C)CC2)cc(C)c1OCC(F)(F)F ZINC000511294456 919890020 /nfs/dbraw/zinc/89/00/20/919890020.db2.gz RFTTZKHTLDTOKR-INIZCTEOSA-N 0 3 413.484 4.036 20 0 HIADHN COCCN(C(=O)N[C@H](C)C1=CCN(C)CC1)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000511295339 919891864 /nfs/dbraw/zinc/89/18/64/919891864.db2.gz UYEDVQBVMKXYBR-HZPDHXFCSA-N 0 3 413.484 4.075 20 0 HIADHN C[C@@H]1CCCCN1C(=O)c1ccc(NC(=O)NC[C@H](c2ccccc2)N(C)C)cc1 ZINC000511297250 919892949 /nfs/dbraw/zinc/89/29/49/919892949.db2.gz NMRNAIDTPGSWSS-XMSQKQJNSA-N 0 3 408.546 4.126 20 0 HIADHN COc1ccc([C@@H](NC(=O)N[C@@H](C)C2=CCN(C)CC2)c2ccccc2Cl)cc1 ZINC000511304704 919897266 /nfs/dbraw/zinc/89/72/66/919897266.db2.gz FPERBQILRGRVDT-KSFYIVLOSA-N 0 3 413.949 4.388 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)c1ccc(OCc2ccccc2)nc1 ZINC000511353849 919948951 /nfs/dbraw/zinc/94/89/51/919948951.db2.gz RMEBYOMQNSFTSF-QHCPKHFHSA-N 0 3 401.510 4.228 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)c1ccc2c(c1)[nH]c(=O)n2C1CCCC1 ZINC000511356047 919950702 /nfs/dbraw/zinc/95/07/02/919950702.db2.gz UNBIECYYJIUJSF-JOCHJYFZSA-N 0 3 418.541 4.424 20 0 HIADHN CN(C)CCN(C(=O)CCc1nc(-c2ccc(Cl)cc2)no1)C1CCCCC1 ZINC000511361016 919954195 /nfs/dbraw/zinc/95/41/95/919954195.db2.gz HPBXJHCHFIKWTN-UHFFFAOYSA-N 0 3 404.942 4.046 20 0 HIADHN CC(C)[C@@H](CNC(=O)N(CCN(C)C)Cc1ccccn1)c1ccc(Cl)cc1 ZINC000511388776 919991747 /nfs/dbraw/zinc/99/17/47/919991747.db2.gz WIDJRICMUWHWBX-OAQYLSRUSA-N 0 3 402.970 4.248 20 0 HIADHN Cc1nn(-c2ccc(C(=O)N(CCN(C)C)C3CCCCC3)cc2)c(C)c1Cl ZINC000511389978 919996609 /nfs/dbraw/zinc/99/66/09/919996609.db2.gz GQSYUUTYGBBSSF-UHFFFAOYSA-N 0 3 402.970 4.479 20 0 HIADHN COc1cc(OC)cc(N2CC[C@H](NCc3ccc(Sc4ccccn4)o3)C2)c1 ZINC000511503424 920117808 /nfs/dbraw/zinc/11/78/08/920117808.db2.gz GMBHARYGCONLSO-INIZCTEOSA-N 0 3 411.527 4.212 20 0 HIADHN O=C(CN[C@@H](c1cccc(OC(F)(F)F)c1)C1CC1)N1CCC[C@@H](C(F)(F)F)C1 ZINC000511589223 920236645 /nfs/dbraw/zinc/23/66/45/920236645.db2.gz WUHGNPHJELWLSP-RHSMWYFYSA-N 0 3 424.385 4.427 20 0 HIADHN CC(C)n1nccc1NC(=O)[C@H](C)N[C@H](c1cccc(OC(F)(F)F)c1)C1CC1 ZINC000511623243 920281292 /nfs/dbraw/zinc/28/12/92/920281292.db2.gz NDLLJNVNMMLZSK-UGSOOPFHSA-N 0 3 410.440 4.431 20 0 HIADHN COc1ccc(CN(C)C[C@@H]2OCCc3ccccc32)cc1OCc1cccnc1 ZINC000511638616 920303567 /nfs/dbraw/zinc/30/35/67/920303567.db2.gz BBPOAOPOJCGFBY-VWLOTQADSA-N 0 3 404.510 4.415 20 0 HIADHN C[C@@H]1CCCN(Cc2csc(NC(=O)[C@@H]3CCCN(Cc4ccccc4)C3)n2)C1 ZINC000511646293 920312865 /nfs/dbraw/zinc/31/28/65/920312865.db2.gz JQXBBYZMXGUYDH-UYAOXDASSA-N 0 3 412.603 4.226 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)c2cc3c(cccc3Br)[nH]2)C1 ZINC000511677281 920341351 /nfs/dbraw/zinc/34/13/51/920341351.db2.gz JEMAVJKLPQTEID-GDBMZVCRSA-N 0 3 412.331 4.496 20 0 HIADHN CC[C@H](C)n1ncc2c1nc(C)cc2C(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000511677500 920341617 /nfs/dbraw/zinc/34/16/17/920341617.db2.gz MHKJMONIJREQKG-BJLQDIEVSA-N 0 3 405.546 4.276 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)c2ccc3c(c2)[nH]c(=O)n3C2CCCC2)C1 ZINC000511677058 920342816 /nfs/dbraw/zinc/34/28/16/920342816.db2.gz FJWOBVTZQWQLIA-XLIONFOSSA-N 0 3 418.541 4.422 20 0 HIADHN Cc1cc(Br)cc2c1[C@@H](NCc1nnc(-c3ccc(F)cc3)[nH]1)CC2 ZINC000562363247 945065178 /nfs/dbraw/zinc/06/51/78/945065178.db2.gz VWJQUSCREULVBE-INIZCTEOSA-N 0 3 401.283 4.459 20 0 HIADHN Cc1cc(Br)cc2c1[C@@H]([NH2+]Cc1nnc(-c3ccc(F)cc3)[n-]1)CC2 ZINC000562363247 945065189 /nfs/dbraw/zinc/06/51/89/945065189.db2.gz VWJQUSCREULVBE-INIZCTEOSA-N 0 3 401.283 4.459 20 0 HIADHN Fc1ccc([C@H]2CC[C@@H](NCc3ncc(I)s3)C2)cc1 ZINC000511760181 920441191 /nfs/dbraw/zinc/44/11/91/920441191.db2.gz WBRZKMIHICOAOM-WCQYABFASA-N 0 3 402.276 4.313 20 0 HIADHN Fc1ccccc1[C@@H]1CC[C@@H](NCc2ncc(I)s2)C1 ZINC000511764346 920446224 /nfs/dbraw/zinc/44/62/24/920446224.db2.gz DULUCOTVRZBJDX-GHMZBOCLSA-N 0 3 402.276 4.313 20 0 HIADHN C[C@H](CC(=O)Nc1cc(C(F)(F)F)ccc1Cl)N[C@H]1c2ccccc2C[C@H]1O ZINC000511765307 920449954 /nfs/dbraw/zinc/44/99/54/920449954.db2.gz OZXZGCIWIGPMRB-JPJOULJCSA-N 0 3 412.839 4.324 20 0 HIADHN O=C(CN1C[C@H](c2ccccc2)[C@H]2COCC[C@H]21)Nc1ccc(OC(F)(F)F)cc1 ZINC000511766918 920451677 /nfs/dbraw/zinc/45/16/77/920451677.db2.gz ASKVGEAOKSACNN-VAMGGRTRSA-N 0 3 420.431 4.028 20 0 HIADHN Cc1cc(C(=O)CN2C[C@H](c3ccccc3)[C@H]3COCC[C@@H]32)c(C)n1-c1nccs1 ZINC000511781878 920473010 /nfs/dbraw/zinc/47/30/10/920473010.db2.gz UFZRINMSDMARKK-VSKRKVRLSA-N 0 3 421.566 4.238 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)c(C)c1CC(=O)NC[C@H](c1ccccc1)N(C)C ZINC000511802354 920496740 /nfs/dbraw/zinc/49/67/40/920496740.db2.gz OCEPEWCBFICDDH-JOCHJYFZSA-N 0 3 410.949 4.104 20 0 HIADHN CCOC(=O)c1c(C)oc2nc(CN3C[C@H](c4ccccc4)[C@@H]4CCC[C@@H]43)nc(N)c21 ZINC000511821780 920519347 /nfs/dbraw/zinc/51/93/47/920519347.db2.gz FTLUPCJGTAVHBA-KSZLIROESA-N 0 3 420.513 4.058 20 0 HIADHN Cc1cc([C@@H](C)N[C@@H](C)Cn2ncc3ccccc3c2=O)sc1Br ZINC000511924530 920669474 /nfs/dbraw/zinc/66/94/74/920669474.db2.gz AALXEULQPQGGTH-QWHCGFSZSA-N 0 3 406.349 4.268 20 0 HIADHN CC(C)N1CC[C@H](NCc2ncc(CN(C)C)s2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000511925349 920672895 /nfs/dbraw/zinc/67/28/95/920672895.db2.gz YBGXKVDRYLDDNY-AZUAARDMSA-N 0 3 410.990 4.311 20 0 HIADHN CN(C)Cc1cnc(CN[C@@H](Cc2cccc(Br)c2)CC2CC2)s1 ZINC000511959736 920721242 /nfs/dbraw/zinc/72/12/42/920721242.db2.gz GRUCOFPEZQCOTA-QGZVFWFLSA-N 0 3 408.409 4.468 20 0 HIADHN COc1ccc(CNCCc2nc(-c3ccccn3)cs2)c(Br)c1 ZINC000511990857 920759494 /nfs/dbraw/zinc/75/94/94/920759494.db2.gz PGMIVOFBTQOBJD-UHFFFAOYSA-N 0 3 404.333 4.309 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)c2cnn(C3CCCCC3)c2C)cc1 ZINC000512003091 920771218 /nfs/dbraw/zinc/77/12/18/920771218.db2.gz VIEIUANQKPMIDQ-HSZRJFAPSA-N 0 3 410.562 4.272 20 0 HIADHN C[C@H](CC(=O)Nc1cc(C(F)(F)F)ccc1Cl)N[C@@H]1CCCc2c[nH]nc21 ZINC000512005285 920775480 /nfs/dbraw/zinc/77/54/80/920775480.db2.gz GOCRYBHNLVDVOX-QMTHXVAHSA-N 0 3 400.832 4.466 20 0 HIADHN COc1ccc(C(=O)c2ccccc2C(=O)N2CCCC[C@H](N3CCCC3)C2)cc1 ZINC000512028064 920802519 /nfs/dbraw/zinc/80/25/19/920802519.db2.gz PCIAGXJHLVREQI-FQEVSTJZSA-N 0 3 406.526 4.017 20 0 HIADHN COc1ccc(CNCCc2nc(-c3ccncc3)cs2)c(Br)c1 ZINC000512055475 920826030 /nfs/dbraw/zinc/82/60/30/920826030.db2.gz CULVISHHCKOJLF-UHFFFAOYSA-N 0 3 404.333 4.309 20 0 HIADHN Cc1nn(C)cc1[C@H](C)N[C@@H](C)CC(=O)Nc1cc(C(F)(F)F)ccc1Cl ZINC000512087348 920851801 /nfs/dbraw/zinc/85/18/01/920851801.db2.gz IRTZVDXFJWEKCQ-QWRGUYRKSA-N 0 3 402.848 4.469 20 0 HIADHN COc1ccc(CNCCc2nccn2Cc2ccccc2)c(Br)c1 ZINC000512109494 920865843 /nfs/dbraw/zinc/86/58/43/920865843.db2.gz WMXXIEWKAGYKDA-UHFFFAOYSA-N 0 3 400.320 4.035 20 0 HIADHN Cc1cc([C@@H](C)NCc2ccc(CS(C)(=O)=O)cc2)sc1Br ZINC000512110168 920866020 /nfs/dbraw/zinc/86/60/20/920866020.db2.gz ZKRVBEWESLAIFF-GFCCVEGCSA-N 0 3 402.379 4.214 20 0 HIADHN Cc1cc([C@H](C)NCc2cccc(OCC(=O)N(C)C)c2)sc1Br ZINC000512119910 920873155 /nfs/dbraw/zinc/87/31/55/920873155.db2.gz DMKOMONVPUIKMI-ZDUSSCGKSA-N 0 3 411.365 4.137 20 0 HIADHN CN(C)Cc1cnc(CNC[C@@H](c2ccccc2)N2CCc3sccc3C2)s1 ZINC000512135359 920882602 /nfs/dbraw/zinc/88/26/02/920882602.db2.gz JAWPQHSLKZAFEU-FQEVSTJZSA-N 0 3 412.628 4.155 20 0 HIADHN C[C@H](NC(=O)c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1)C1=CCN(C)CC1 ZINC000512138826 920885155 /nfs/dbraw/zinc/88/51/55/920885155.db2.gz NFOSSOMZERGQTF-AWEZNQCLSA-N 0 3 405.420 4.273 20 0 HIADHN Cc1ccc(-c2nn(Cc3ccccc3)cc2C(=O)N[C@@H](C)C2=CCN(C)CC2)cc1 ZINC000512145493 920888479 /nfs/dbraw/zinc/88/84/79/920888479.db2.gz XNAMDOQRTCNIIM-FQEVSTJZSA-N 0 3 414.553 4.287 20 0 HIADHN Cc1cccc2sc(N(Cc3ccccc3)C(=O)CN[C@H]3CSC[C@H]3C)nc21 ZINC000512167305 920903228 /nfs/dbraw/zinc/90/32/28/920903228.db2.gz WWJYTIKLVVEMSI-AEFFLSMTSA-N 0 3 411.596 4.479 20 0 HIADHN OCC[C@H](NC[C@H](O)CO[C@H]1CCCc2ccccc21)c1ccc(Cl)c(Cl)c1 ZINC000512213570 920960319 /nfs/dbraw/zinc/96/03/19/920960319.db2.gz PEAMVURMXDEERL-HSQYWUDLSA-N 0 3 424.368 4.462 20 0 HIADHN C[C@H](C(=O)Nc1ccc(CC(=O)N2CCc3ccccc32)cc1)N1[C@H](C)CC[C@@H]1C ZINC000512295276 921051545 /nfs/dbraw/zinc/05/15/45/921051545.db2.gz ONDQTQSILJBKQN-CEXWTWQISA-N 0 3 405.542 4.018 20 0 HIADHN CC(=O)N(C)C1CCN(Cc2cn(Cc3ccccc3)nc2-c2ccc(C)cc2)CC1 ZINC000512296369 921052224 /nfs/dbraw/zinc/05/22/24/921052224.db2.gz YAYJJOJYLACIFV-UHFFFAOYSA-N 0 3 416.569 4.350 20 0 HIADHN COc1cc(CN[C@H]2CCO[C@@H]2c2ccnn2C(C)C)ccc1OCC(F)(F)F ZINC000512344509 921090114 /nfs/dbraw/zinc/09/01/14/921090114.db2.gz XSFPEGZPPNERAH-KXBFYZLASA-N 0 3 413.440 4.034 20 0 HIADHN CCOc1ccc(CN2CCC(C(=O)NCCc3cccs3)CC2)cc1OCC ZINC000512359895 921103309 /nfs/dbraw/zinc/10/33/09/921103309.db2.gz ONKCAGHKBOBZSV-UHFFFAOYSA-N 0 3 416.587 4.116 20 0 HIADHN COc1ccc(CN[C@H]2CCO[C@@H]2c2ccnn2C(C)C)cc1OCc1cccnc1 ZINC000512360043 921103519 /nfs/dbraw/zinc/10/35/19/921103519.db2.gz QVMKBFQTZJOANA-RDPSFJRHSA-N 0 3 422.529 4.066 20 0 HIADHN CCOc1cc(CN2CCC(C(=O)NC3CCCCC3)CC2)ccc1OC(F)F ZINC000512364223 921105483 /nfs/dbraw/zinc/10/54/83/921105483.db2.gz BGLHCNNFIOWKHJ-UHFFFAOYSA-N 0 3 410.505 4.348 20 0 HIADHN Cc1ccc(-c2noc(CCCN3CCN(CCc4cccs4)CC3)n2)cc1F ZINC000513446169 921812430 /nfs/dbraw/zinc/81/24/30/921812430.db2.gz CIIOFEIEVRXSPX-UHFFFAOYSA-N 0 3 414.550 4.039 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)c1ccc(Oc2ccccc2)nc1 ZINC000513504332 921852713 /nfs/dbraw/zinc/85/27/13/921852713.db2.gz BNNSMCOSWLSXMT-UHFFFAOYSA-N 0 3 411.452 4.356 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)NCc1ccc(NC(=O)c2ccco2)cc1)c1ccco1 ZINC000513502711 921852779 /nfs/dbraw/zinc/85/27/79/921852779.db2.gz DKFXDZHKOPNLIH-VQIMIIECSA-N 0 3 424.501 4.054 20 0 HIADHN CC(C)[C@@H](C(=O)N1CCC(C(=O)c2c(F)cc(F)cc2F)CC1)N1CCCCC1 ZINC000513580788 921911954 /nfs/dbraw/zinc/91/19/54/921911954.db2.gz RGVIZWISLRXSAX-FQEVSTJZSA-N 0 3 410.480 4.036 20 0 HIADHN COc1ccc([C@@H](Cc2ccncc2)NCc2cccc(C(=O)NC3CC3)c2)cc1 ZINC000513654453 921976248 /nfs/dbraw/zinc/97/62/48/921976248.db2.gz INSRZYHUUMOVOY-XMMPIXPASA-N 0 3 401.510 4.056 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)CN[C@H]1CCC[C@H]1Oc1cc(F)cc(F)c1 ZINC000513730099 922049773 /nfs/dbraw/zinc/04/97/73/922049773.db2.gz VKGYUBKUKLPBAI-QFBILLFUSA-N 0 3 410.848 4.155 20 0 HIADHN CC(C)(C)OC(=O)C1CCN(Cc2ccc(-n3ccc(C(F)(F)F)n3)cc2)CC1 ZINC000513758583 922077599 /nfs/dbraw/zinc/07/75/99/922077599.db2.gz ABKMMGNVASAXKN-UHFFFAOYSA-N 0 3 409.452 4.445 20 0 HIADHN COCCOc1ccccc1CN1CCC([C@@H]2C(=O)Nc3cc(Cl)ccc32)CC1 ZINC000513762667 922081678 /nfs/dbraw/zinc/08/16/78/922081678.db2.gz RZWACDIQHLWMMB-QFIPXVFZSA-N 0 3 414.933 4.313 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)Cc1c[nH]c2cccc(Br)c12 ZINC000513803960 922128030 /nfs/dbraw/zinc/12/80/30/922128030.db2.gz PESJQZOJTLARJZ-UHFFFAOYSA-N 0 3 414.347 4.063 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)c3ccccc3Oc3ccncc3)CC2)C[C@H](C)O1 ZINC000513831639 922159947 /nfs/dbraw/zinc/15/99/47/922159947.db2.gz VMRXMRAWODAGIN-PMACEKPBSA-N 0 3 423.557 4.225 20 0 HIADHN Fc1ccc(N2CCOCC2)c(CN[C@@H]2CCc3c2cccc3Br)c1 ZINC000513871352 922200365 /nfs/dbraw/zinc/20/03/65/922200365.db2.gz PHIHMGBXXQIEGZ-LJQANCHMSA-N 0 3 405.311 4.202 20 0 HIADHN O=C(NCc1sccc1Br)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000513884696 922213307 /nfs/dbraw/zinc/21/33/07/922213307.db2.gz CBBBSVUOPLZALC-INIZCTEOSA-N 0 3 408.365 4.147 20 0 HIADHN C[C@@H](NC(=O)NC[C@@H](c1ccccc1)N1CCCC1)c1cccc(N2CCCC2=O)c1 ZINC000513889252 922217959 /nfs/dbraw/zinc/21/79/59/922217959.db2.gz PLLONRXODLATPX-XXBNENTESA-N 0 3 420.557 4.011 20 0 HIADHN COc1cc(Cl)c(C(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)cc1OC ZINC000513930983 922252067 /nfs/dbraw/zinc/25/20/67/922252067.db2.gz BVGKBTJSPJCBMW-KRWDZBQOSA-N 0 3 402.922 4.094 20 0 HIADHN COc1cc(Cl)c(C(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)cc1OC ZINC000514007447 922331807 /nfs/dbraw/zinc/33/18/07/922331807.db2.gz IXYAPEVJFGWSOD-MRXNPFEDSA-N 0 3 402.922 4.094 20 0 HIADHN CC[C@H](NCc1ccc(N2CCO[C@H](C)C2)nc1)c1ccc(OC(F)(F)F)cc1 ZINC000514095256 922419651 /nfs/dbraw/zinc/41/96/51/922419651.db2.gz QCOINBHPTNYYDM-BEFAXECRSA-N 0 3 409.452 4.446 20 0 HIADHN CCN1CCN(c2ccccc2CN(Cc2ccco2)Cc2ccc(O)cc2)CC1 ZINC000514104629 922432482 /nfs/dbraw/zinc/43/24/82/922432482.db2.gz LFKAKQMFMAUOJF-UHFFFAOYSA-N 0 3 405.542 4.330 20 0 HIADHN Fc1ccc(CN(CCc2ccccn2)Cc2ccccc2N2CCOCC2)cc1 ZINC000514103854 922432907 /nfs/dbraw/zinc/43/29/07/922432907.db2.gz FUHPUZVBJYYXSY-UHFFFAOYSA-N 0 3 405.517 4.302 20 0 HIADHN COc1ccc([C@H](Cc2ccncc2)NCc2ccc(-n3nc(C)cc3C)nc2)cc1 ZINC000514104075 922433068 /nfs/dbraw/zinc/43/30/68/922433068.db2.gz HGPSDPVPAWONLL-DEOSSOPVSA-N 0 3 413.525 4.361 20 0 HIADHN O=S(=O)(NC1CCN(C(c2ccccc2)c2ccccc2)CC1)c1ccccc1 ZINC000514118199 922452394 /nfs/dbraw/zinc/45/23/94/922452394.db2.gz GDXBJMNBHBMWIK-UHFFFAOYSA-N 0 3 406.551 4.219 20 0 HIADHN C[C@@H](Oc1ccc(C(=O)Nc2cccc(CN3CC[C@H](O)C3)c2)cn1)c1ccccc1 ZINC000562377987 945066544 /nfs/dbraw/zinc/06/65/44/945066544.db2.gz WHXAHEMTQKDOFS-JPYJTQIMSA-N 0 3 417.509 4.041 20 0 HIADHN C[C@@H](NC(=O)N(CCN(C)C)Cc1ccco1)c1ccc(Oc2cccnc2)cc1 ZINC000514178361 922516581 /nfs/dbraw/zinc/51/65/81/922516581.db2.gz MBUZIQCNLWFDPN-GOSISDBHSA-N 0 3 408.502 4.301 20 0 HIADHN CC1CCN([C@@H](CNC(=O)NCc2ccccc2-n2ccnc2)c2cccs2)CC1 ZINC000514182696 922521987 /nfs/dbraw/zinc/52/19/87/922521987.db2.gz OFVSLPAYNQJWGI-NRFANRHFSA-N 0 3 423.586 4.206 20 0 HIADHN CC[C@@H]1C[C@H](CC(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)CCO1 ZINC000514190146 922530880 /nfs/dbraw/zinc/53/08/80/922530880.db2.gz PTOKLHAVQWAITC-IEBWSBKVSA-N 0 3 400.485 4.191 20 0 HIADHN O=C(NCc1ccccc1Br)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000514222922 922558727 /nfs/dbraw/zinc/55/87/27/922558727.db2.gz RVLIUNLPWRBAHL-IBGZPJMESA-N 0 3 402.336 4.085 20 0 HIADHN COc1cc(C)c([C@H](C)NC(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)cc1OC ZINC000514225267 922562878 /nfs/dbraw/zinc/56/28/78/922562878.db2.gz MFJCPZONALRBJZ-NSHGMRRFSA-N 0 3 411.546 4.208 20 0 HIADHN Cc1ccc([C@@H]2CCCN2CC(=O)N2CCC[C@@H]2c2ccc3c(c2)OCCO3)cc1 ZINC000514235948 922574696 /nfs/dbraw/zinc/57/46/96/922574696.db2.gz LJMJIRACZXEETJ-FCHUYYIVSA-N 0 3 406.526 4.267 20 0 HIADHN CC(C)(C)OC(=O)C[C@H]1CCCN(C(=O)NC[C@H](c2cccs2)N2CCCC2)C1 ZINC000514425133 922620946 /nfs/dbraw/zinc/62/09/46/922620946.db2.gz GRSUCYSBMQHMDR-QZTJIDSGSA-N 0 3 421.607 4.038 20 0 HIADHN CS(=O)(=O)C1(CN[C@H]2CCc3c2cc(Br)cc3Cl)CCCC1 ZINC000514622492 922727494 /nfs/dbraw/zinc/72/74/94/922727494.db2.gz ZYNSALSQDVRSBX-HNNXBMFYSA-N 0 3 406.773 4.037 20 0 HIADHN CSc1ccc([C@H](CNC[C@H](O)C(F)(F)F)N2CCc3sccc3C2)cc1 ZINC000514700725 922765023 /nfs/dbraw/zinc/76/50/23/922765023.db2.gz LFAKDCPCHFEXAE-WMZOPIPTSA-N 0 3 416.534 4.082 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)[C@H](C)Oc3ccc4c(c3)CCC4)c(C)c2)CC1 ZINC000515086188 922899925 /nfs/dbraw/zinc/89/99/25/922899925.db2.gz OHQQTOOEUBCGIE-IBGZPJMESA-N 0 3 407.558 4.032 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCc3ccc(C(F)(F)F)cc3)c(C)c2)CC1 ZINC000515113255 922926229 /nfs/dbraw/zinc/92/62/29/922926229.db2.gz NKKWGVBANNTYRO-UHFFFAOYSA-N 0 3 420.479 4.477 20 0 HIADHN CC(=O)N1C[C@@H]2CCC[C@H](N[C@@H](C)c3nnc(-c4ccc(Cl)c(Cl)c4)o3)[C@@H]2C1 ZINC000515249782 923015894 /nfs/dbraw/zinc/01/58/94/923015894.db2.gz NFQPTIKCMCFHNL-MKXCTONWSA-N 0 3 423.344 4.341 20 0 HIADHN COc1ccc([C@@H](Cc2ccccc2)NCc2ccc(N3CCO[C@@H](C)C3)nc2)cc1 ZINC000515257047 923021055 /nfs/dbraw/zinc/02/10/55/923021055.db2.gz JKOLYQLJGZXTDU-NBGIEHNGSA-N 0 3 417.553 4.389 20 0 HIADHN C[C@H](NC(=O)NC[C@@H](c1ccccc1)N(C)C)c1nc2ccccc2n1C(F)F ZINC000515296149 923041576 /nfs/dbraw/zinc/04/15/76/923041576.db2.gz XJBZNLUYENXXJJ-KSSFIOAISA-N 0 3 401.461 4.095 20 0 HIADHN CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)cc1)C1CC1 ZINC000515395799 923080125 /nfs/dbraw/zinc/08/01/25/923080125.db2.gz BHRNZUOFCKMDKV-IBGZPJMESA-N 0 3 409.505 4.192 20 0 HIADHN COc1cnccc1N1CCN(C(=O)Nc2ccc3oc4ccccc4c3c2)CC1 ZINC000515493611 923132938 /nfs/dbraw/zinc/13/29/38/923132938.db2.gz UGZYXAVHPZTXNE-UHFFFAOYSA-N 0 3 402.454 4.344 20 0 HIADHN O[C@@H](COc1cccc2[nH]ccc21)CN1CCC(c2noc3cc(F)ccc32)CC1 ZINC000515529633 923156795 /nfs/dbraw/zinc/15/67/95/923156795.db2.gz ATKYURYHPOZHFR-QGZVFWFLSA-N 0 3 409.461 4.068 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CCCN(c2ccccc2)CC1)c1ccsc1 ZINC000515529267 923156899 /nfs/dbraw/zinc/15/68/99/923156899.db2.gz WEVLMONRNLUMAH-NRFANRHFSA-N 0 3 400.592 4.053 20 0 HIADHN COc1ccc(CN(C)C[C@H](O)CO[C@@H]2CCCc3ccccc32)cc1OC(F)F ZINC000515548631 923167989 /nfs/dbraw/zinc/16/79/89/923167989.db2.gz OTZRDKMXQTWPHF-AZUAARDMSA-N 0 3 421.484 4.184 20 0 HIADHN Cc1cc(NC(=O)N2CC(C)(C)[C@H]2C2CC2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000515716019 923297045 /nfs/dbraw/zinc/29/70/45/923297045.db2.gz BEDZOVGDKXSLFO-RBBKRZOGSA-N 0 3 407.562 4.291 20 0 HIADHN C[C@H](NC(=O)NC[C@H](c1ccccc1)N(C)C)c1cccc(OCc2ccccn2)c1 ZINC000515854703 923394111 /nfs/dbraw/zinc/39/41/11/923394111.db2.gz CDAPSBVLVDAABU-YADARESESA-N 0 3 418.541 4.324 20 0 HIADHN C[C@@H](c1ccc(F)cc1)N(C)C(=O)NCCCCN1CCN(c2ccccc2)CC1 ZINC000515903007 923420973 /nfs/dbraw/zinc/42/09/73/923420973.db2.gz ANOPYZDQQNIUMW-FQEVSTJZSA-N 0 3 412.553 4.131 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)N1CCC[C@H]1C1CCCCC1 ZINC000515903212 923421679 /nfs/dbraw/zinc/42/16/79/923421679.db2.gz GFAAAHAGSAVJAV-DEOSSOPVSA-N 0 3 412.622 4.343 20 0 HIADHN CCOc1ccc([C@H](C)NC(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)cc1OC ZINC000516163751 923582044 /nfs/dbraw/zinc/58/20/44/923582044.db2.gz TWOGSTZPSFASTB-WFXMLNOXSA-N 0 3 411.546 4.290 20 0 HIADHN COc1ccc(OC)c([C@@H]2CCCN2C(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)c1 ZINC000516163566 923582633 /nfs/dbraw/zinc/58/26/33/923582633.db2.gz HYCYWMDKVUEKJZ-RFWXGWTQSA-N 0 3 423.557 4.386 20 0 HIADHN Cc1cc(NC(=O)N[C@H]2CCN(Cc3ccccc3)[C@@H]2C)ccc1OC1CCOCC1 ZINC000516341445 923676927 /nfs/dbraw/zinc/67/69/27/923676927.db2.gz XYJZBISNCPQJCU-XXBNENTESA-N 0 3 423.557 4.337 20 0 HIADHN CSc1ccccc1NC(=O)[C@H](C)N[C@@H]1CCN(C)[C@H]1c1ccc(Cl)cc1 ZINC000516351754 923682416 /nfs/dbraw/zinc/68/24/16/923682416.db2.gz KBEFGDHELPAGCA-QMIHWGKISA-N 0 3 403.979 4.424 20 0 HIADHN CC(=O)Nc1ccc(S[C@H](C)C(=O)N[C@H](CN2CCCC2)c2ccccc2)cc1 ZINC000516391969 923706306 /nfs/dbraw/zinc/70/63/06/923706306.db2.gz XYOFHADGCUITDP-VGOFRKELSA-N 0 3 411.571 4.079 20 0 HIADHN CC1(CC(=O)NC2CCN(CCOc3ccc(Br)cc3)CC2)CCCC1 ZINC000516512728 923770346 /nfs/dbraw/zinc/77/03/46/923770346.db2.gz DNJIJSQEVGLSJF-UHFFFAOYSA-N 0 3 423.395 4.379 20 0 HIADHN CCOc1cc(CN2CCC[C@@H](CCNC(C)=O)C2)ccc1OCc1ccccc1 ZINC000516514534 923772171 /nfs/dbraw/zinc/77/21/71/923772171.db2.gz XPZHKFDZKKYFFT-NRFANRHFSA-N 0 3 410.558 4.403 20 0 HIADHN COc1cc2nc(NC(=O)[C@H]3CCCN(Cc4ccccc4)C3)sc2cc1OC ZINC000516555302 923794657 /nfs/dbraw/zinc/79/46/57/923794657.db2.gz QOQQTHZHANFQNR-INIZCTEOSA-N 0 3 411.527 4.164 20 0 HIADHN COCc1ccccc1CNC(=O)CNC(C)(C)c1ccc(Br)c(C)c1 ZINC000516558800 923795978 /nfs/dbraw/zinc/79/59/78/923795978.db2.gz FOJGVGBAOZUPQT-UHFFFAOYSA-N 0 3 419.363 4.045 20 0 HIADHN CC[C@H](C)C(=O)Nc1cccc(CNC(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)c1 ZINC000516578861 923800687 /nfs/dbraw/zinc/80/06/87/923800687.db2.gz UZGMCZQOLHIUGI-SFYKDHMMSA-N 0 3 422.573 4.306 20 0 HIADHN COc1ccc(OC2CCN(C(=O)N[C@H]3CCN([C@H](C)c4ccccc4)C3)CC2)cc1 ZINC000516581457 923802064 /nfs/dbraw/zinc/80/20/64/923802064.db2.gz GMWFPQSXWCOXFB-CTNGQTDRSA-N 0 3 423.557 4.084 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)NCCSCc2ccccc2F)C1 ZINC000516708154 923855967 /nfs/dbraw/zinc/85/59/67/923855967.db2.gz AFUUTGOSBXCHHI-YLJYHZDGSA-N 0 3 401.551 4.194 20 0 HIADHN COc1cc(NC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)c(OC)cc1Cl ZINC000516763413 923880807 /nfs/dbraw/zinc/88/08/07/923880807.db2.gz UAUIXUJJCJWXCC-HNNXBMFYSA-N 0 3 406.885 4.347 20 0 HIADHN Cc1cc(NC(=O)c2cccnc2OC(C)C)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000516985758 923952231 /nfs/dbraw/zinc/95/22/31/923952231.db2.gz UMVCEYAFASXYMK-HXUWFJFHSA-N 0 3 419.529 4.073 20 0 HIADHN COc1cc(C)c(CN2CCC(O)(Cc3ccc(OC(F)(F)F)cc3)CC2)c(C)n1 ZINC000516997602 923960145 /nfs/dbraw/zinc/96/01/45/923960145.db2.gz IFKMADCQTPHNBG-UHFFFAOYSA-N 0 3 424.463 4.175 20 0 HIADHN O=C(Nc1ccc2[nH]c(-c3ccccc3)nc2c1)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000517006479 923963868 /nfs/dbraw/zinc/96/38/68/923963868.db2.gz KGBLUPDYBCKWIX-FQEVSTJZSA-N 0 3 411.509 4.476 20 0 HIADHN C[C@H]1[C@@H](NC(=O)c2ccc(-c3nc(C4CC4)no3)cc2)CCN1Cc1ccccc1 ZINC000517021852 923967094 /nfs/dbraw/zinc/96/70/94/923967094.db2.gz YYUJSYAYBIDNAC-KKSFZXQISA-N 0 3 402.498 4.007 20 0 HIADHN C[C@@H](O)CN(CC(=O)N1N=C(c2cccs2)C[C@@H]1c1ccco1)C1CCCCC1 ZINC000517119200 924008199 /nfs/dbraw/zinc/00/81/99/924008199.db2.gz PBXAWKKSMUPVIX-VQIMIIECSA-N 0 3 415.559 4.034 20 0 HIADHN CC[C@H]1CN(c2nnc(C(C)C)n2C[C@H]2CCCCO2)CCN1Cc1ccccc1 ZINC000517248890 924059943 /nfs/dbraw/zinc/05/99/43/924059943.db2.gz GWUWTDUKOOQVAZ-FCHUYYIVSA-N 0 3 411.594 4.071 20 0 HIADHN Cc1sc2nc(C)nc(SCC(=O)NC[C@H](C)N3CCCC[C@@H]3C)c2c1C ZINC000517347194 924121030 /nfs/dbraw/zinc/12/10/30/924121030.db2.gz ALOBPJACUYZTGD-STQMWFEESA-N 0 3 406.621 4.088 20 0 HIADHN CN(C)CCn1c2cc(NC(=O)[C@@H]3C[C@@H]3c3ccc4ccccc4c3)ccc2oc1=O ZINC000517487051 924225131 /nfs/dbraw/zinc/22/51/31/924225131.db2.gz FWFWWNLTBMTLPI-NHCUHLMSSA-N 0 3 415.493 4.052 20 0 HIADHN CN(C[C@H](O)COc1ccccc1)[C@@H]1CCSc2ccc(Br)cc21 ZINC000517526745 924246676 /nfs/dbraw/zinc/24/66/76/924246676.db2.gz BZZOTLFWSYMUSR-MAUKXSAKSA-N 0 3 408.361 4.358 20 0 HIADHN FC(F)(F)CN1CC[C@H](NCc2ccc(-c3ccc(Br)cc3)o2)C1 ZINC000517552594 924261493 /nfs/dbraw/zinc/26/14/93/924261493.db2.gz OOOHHAQDSKNUDA-AWEZNQCLSA-N 0 3 403.242 4.435 20 0 HIADHN FC(F)Oc1ccc(-c2noc([C@@H]3CN(Cc4ccccc4)CCC3(F)F)n2)nc1 ZINC000517623784 926732038 /nfs/dbraw/zinc/73/20/38/926732038.db2.gz FQLBHHCLLBLERT-HNNXBMFYSA-N 0 3 422.382 4.358 20 0 HIADHN Cc1ccc2sc(C(=O)Nc3cccc(CN4CCC(C(N)=O)CC4)c3)cc2c1 ZINC000517629740 926738579 /nfs/dbraw/zinc/73/85/79/926738579.db2.gz BLDYRXDFMAKJCU-UHFFFAOYSA-N 0 3 407.539 4.159 20 0 HIADHN Cc1ccc(-n2cc(C(=O)N(C)[C@@H]3CCN(C4CC4)C3)c(-c3ccccc3)n2)cc1 ZINC000517694735 926797775 /nfs/dbraw/zinc/79/77/75/926797775.db2.gz LFDYQSOVDFHDDR-JOCHJYFZSA-N 0 3 400.526 4.156 20 0 HIADHN CSc1ccc([C@H](CNC(=O)c2ccc(NC(C)=O)c(SC)c2)N(C)C)cc1 ZINC000517725057 926814768 /nfs/dbraw/zinc/81/47/68/926814768.db2.gz HYVQQYPBQBCSTO-IBGZPJMESA-N 0 3 417.600 4.122 20 0 HIADHN CN(C)Cc1cccc(NC(=O)C(=O)N2CCC[C@@H]2c2cccc3ccccc32)c1 ZINC000517818358 926850513 /nfs/dbraw/zinc/85/05/13/926850513.db2.gz VTHGOWCVHYPXFF-HSZRJFAPSA-N 0 3 401.510 4.204 20 0 HIADHN COc1ccccc1CCN(C)C(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000517857857 926865449 /nfs/dbraw/zinc/86/54/49/926865449.db2.gz OLCQOGQFIBFBHP-JOCHJYFZSA-N 0 3 420.475 4.151 20 0 HIADHN CC(C)(C)NC(=O)c1ccc(NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)cc1 ZINC000517897163 926880114 /nfs/dbraw/zinc/88/01/14/926880114.db2.gz QXQMQHUURDGDTQ-LJQANCHMSA-N 0 3 411.521 4.205 20 0 HIADHN CSc1nccn1-c1ccc(C(=O)N[C@@H](CN2CCCC2)c2ccccc2)cc1 ZINC000518042108 926980856 /nfs/dbraw/zinc/98/08/56/926980856.db2.gz FIMLMQOLYBUVKL-NRFANRHFSA-N 0 3 406.555 4.161 20 0 HIADHN Cc1ccc(-n2ncc(C(=O)NCCN3CCC[C@@H](C)C3)c2C2CC2)cc1Cl ZINC000518045013 926984338 /nfs/dbraw/zinc/98/43/38/926984338.db2.gz SXSFOHOBTWOFFD-OAHLLOKOSA-N 0 3 400.954 4.173 20 0 HIADHN Cc1cc(C(=O)NC(C)C)ccc1NC(=O)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000518170784 927061506 /nfs/dbraw/zinc/06/15/06/927061506.db2.gz FFOVVXOPQZRMRS-QFIPXVFZSA-N 0 3 408.546 4.092 20 0 HIADHN CCCC[C@@H](NCc1ccc2[nH]cnc2c1)C(=O)Nc1cccc(N2CCCC2)c1 ZINC000518277174 927135432 /nfs/dbraw/zinc/13/54/32/927135432.db2.gz JYECLHXGSNZVRB-JOCHJYFZSA-N 0 3 405.546 4.450 20 0 HIADHN CCCC[C@@H](NCc1ccc2nc[nH]c2c1)C(=O)Nc1cccc(N2CCCC2)c1 ZINC000518277174 927135442 /nfs/dbraw/zinc/13/54/42/927135442.db2.gz JYECLHXGSNZVRB-JOCHJYFZSA-N 0 3 405.546 4.450 20 0 HIADHN Cc1ccc(NC(=O)N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)cc1C(F)(F)F ZINC000518313745 927177193 /nfs/dbraw/zinc/17/71/93/927177193.db2.gz IHTLBXXCBCGQBC-IYBDPMFKSA-N 0 3 413.484 4.367 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)NCc2ccc(N3CCCCCC3)nc2)C1 ZINC000518402453 927242845 /nfs/dbraw/zinc/24/28/45/927242845.db2.gz AYDLCCGCYKSGOQ-NZQKXSOJSA-N 0 3 421.589 4.097 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)N(C)Cc2ccc(Br)cc2)C1 ZINC000518403406 927244765 /nfs/dbraw/zinc/24/47/65/927244765.db2.gz NUCSCSQIVWTNCU-OXJNMPFZSA-N 0 3 416.363 4.426 20 0 HIADHN COc1cccc(C[C@@H]2CCCN2C(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)c1 ZINC000518403127 927245125 /nfs/dbraw/zinc/24/51/25/927245125.db2.gz HYYJJFLFGFEUHD-PTUXOGIPSA-N 0 3 407.558 4.247 20 0 HIADHN O[C@H](CNCc1ccc(-c2ccc(Br)cc2)o1)COc1ccccc1 ZINC000518771374 927484947 /nfs/dbraw/zinc/48/49/47/927484947.db2.gz YWSIHUSQMFBMHQ-QGZVFWFLSA-N 0 3 402.288 4.239 20 0 HIADHN Cc1nc(C(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)c(-c2ccccc2)o1 ZINC000518821244 927516301 /nfs/dbraw/zinc/51/63/01/927516301.db2.gz UWMZDJAHHVLINP-NRFANRHFSA-N 0 3 407.514 4.470 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCCc3c[nH]c4ccc(F)cc34)c(C)c2)CC1 ZINC000518827415 927524034 /nfs/dbraw/zinc/52/40/34/927524034.db2.gz RFXKHDRBOYZFPV-UHFFFAOYSA-N 0 3 423.536 4.122 20 0 HIADHN CC[C@H](C)Oc1ccc(NC(=O)N2CCC(CN3C[C@@H](C)O[C@H](C)C3)CC2)cc1 ZINC000518838333 927538306 /nfs/dbraw/zinc/53/83/06/927538306.db2.gz CUAGMTYFCKNKOK-IPMKNSEASA-N 0 3 403.567 4.217 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)NCc1ccc(F)c(F)c1 ZINC000518879416 927592556 /nfs/dbraw/zinc/59/25/56/927592556.db2.gz LHWBYNFXDYPMQU-UHFFFAOYSA-N 0 3 415.406 4.257 20 0 HIADHN CC(C)CC(=O)Nc1ccc(NC(=O)CCCN2CCN(c3ccccc3)CC2)cc1 ZINC000518881379 927593514 /nfs/dbraw/zinc/59/35/14/927593514.db2.gz GFECBFBVBIFOFC-UHFFFAOYSA-N 0 3 422.573 4.212 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)Cc1csc(Cc2ccc(F)cc2)n1 ZINC000518938952 927643823 /nfs/dbraw/zinc/64/38/23/927643823.db2.gz GOXFQTJAFRWUJH-UHFFFAOYSA-N 0 3 413.518 4.124 20 0 HIADHN C[C@@H](NC(=O)C(=O)Nc1cccc(-c2ccccc2)c1)[C@H](c1ccccc1)N(C)C ZINC000519007439 927686242 /nfs/dbraw/zinc/68/62/42/927686242.db2.gz SQGGHGTZAVANRL-WZONZLPQSA-N 0 3 401.510 4.100 20 0 HIADHN O=S(=O)(CCCNCc1cnc(-c2cccs2)s1)c1ccc(Cl)cc1 ZINC000519115186 927782640 /nfs/dbraw/zinc/78/26/40/927782640.db2.gz NECRKQNGYDHFCY-UHFFFAOYSA-N 0 3 412.989 4.479 20 0 HIADHN CN(Cc1cccc(C(F)(F)F)c1)C(=O)NCCCN1CCc2ccccc2C1 ZINC000519182725 927814625 /nfs/dbraw/zinc/81/46/25/927814625.db2.gz UOXKRNKONLLWLY-UHFFFAOYSA-N 0 3 405.464 4.295 20 0 HIADHN COCc1cccc2sc(NC(=O)N[C@H]3CCN([C@H](C)c4ccccc4)C3)nc21 ZINC000519197404 927822617 /nfs/dbraw/zinc/82/26/17/927822617.db2.gz BECMDHJXIHFANC-QAPCUYQASA-N 0 3 410.543 4.400 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)Nc1ccccc1Br ZINC000519226215 927835779 /nfs/dbraw/zinc/83/57/79/927835779.db2.gz QUEVZBKJNBNEBN-UHFFFAOYSA-N 0 3 404.352 4.477 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2cccc(NC(=O)c3cccs3)c2)N(C)C)cc1 ZINC000519278850 927860554 /nfs/dbraw/zinc/86/05/54/927860554.db2.gz XMJGDBNOMPOFRH-HXUWFJFHSA-N 0 3 407.539 4.342 20 0 HIADHN CN(Cc1ccc(Br)o1)C(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000519361869 927896962 /nfs/dbraw/zinc/89/69/62/927896962.db2.gz ICOURQZPWUIAQX-HNNXBMFYSA-N 0 3 409.299 4.052 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)CCn1cnc2ccccc21 ZINC000519417019 927933999 /nfs/dbraw/zinc/93/39/99/927933999.db2.gz WZSGBTYAOGMXBA-UHFFFAOYSA-N 0 3 418.463 4.036 20 0 HIADHN COCCCOc1ccccc1NC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000519432479 927944098 /nfs/dbraw/zinc/94/40/98/927944098.db2.gz NUUKVRBETJCBMD-LJQANCHMSA-N 0 3 400.494 4.092 20 0 HIADHN Cc1ccc(Cc2nnc(NC(=O)NCCCN3CCc4ccccc4C3)s2)cc1 ZINC000519450664 927958145 /nfs/dbraw/zinc/95/81/45/927958145.db2.gz IJULQFKVJYEWRM-UHFFFAOYSA-N 0 3 421.570 4.007 20 0 HIADHN CN1CCN(CCCNc2nc(C(F)F)nc3ccccc32)[C@H](c2ccccc2)C1 ZINC000519477917 927976769 /nfs/dbraw/zinc/97/67/69/927976769.db2.gz FDZXLFOMQYIQPB-FQEVSTJZSA-N 0 3 411.500 4.358 20 0 HIADHN CCc1ccc([C@H](CNC(=O)Nc2ccc(C(=O)NC(C)C)c(C)c2)N(C)C)cc1 ZINC000519496911 927991704 /nfs/dbraw/zinc/99/17/04/927991704.db2.gz NXLMCYVLGXIZKH-QFIPXVFZSA-N 0 3 410.562 4.120 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)N[C@H]1CCc2c1cccc2Cl ZINC000519505577 927997921 /nfs/dbraw/zinc/99/79/21/927997921.db2.gz DVRAIAPSTAIHRG-FQEVSTJZSA-N 0 3 407.892 4.379 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1C(=O)NC[C@H](c1ccc(OC(C)C)cc1)N(C)C ZINC000519562643 928017235 /nfs/dbraw/zinc/01/72/35/928017235.db2.gz LOHFMFJPRFYNAG-HSZRJFAPSA-N 0 3 420.557 4.309 20 0 HIADHN COc1cccc(C2(c3noc(-c4ccc(CN5CCSCC5)cc4)n3)CC2)c1 ZINC000519567240 928018856 /nfs/dbraw/zinc/01/88/56/928018856.db2.gz KJQRBNABCDMKFK-UHFFFAOYSA-N 0 3 407.539 4.374 20 0 HIADHN C[C@H](N[C@@H]1CCN(C)[C@H]1c1ccc(Cl)cc1)C(=O)Nc1ccc(OC(F)F)cc1 ZINC000519725925 928059261 /nfs/dbraw/zinc/05/92/61/928059261.db2.gz QGZVQLJDDIKWMR-BKTGTZMESA-N 0 3 423.891 4.303 20 0 HIADHN CN1CCN(CC2=Cc3cc(Br)ccc3OC2)C[C@H]1Cc1ccccc1 ZINC000519773084 928071729 /nfs/dbraw/zinc/07/17/29/928071729.db2.gz SINVXGWXDZHJOW-OAQYLSRUSA-N 0 3 413.359 4.084 20 0 HIADHN COCCCCN(Cc1ccccc1)C(=O)NCC(C)(C)N1CCc2ccccc2C1 ZINC000519982836 928208995 /nfs/dbraw/zinc/20/89/95/928208995.db2.gz CCWLFEMCTLGMML-UHFFFAOYSA-N 0 3 423.601 4.462 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)NCCCN2CCc3ccccc3C2)c(C)c1 ZINC000519987494 928214132 /nfs/dbraw/zinc/21/41/32/928214132.db2.gz CAAYWRZCYSAXCQ-IBGZPJMESA-N 0 3 422.573 4.093 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)Nc1ccc(NC(=O)C2CC2)cc1 ZINC000520042933 928266444 /nfs/dbraw/zinc/26/64/44/928266444.db2.gz OOJJRQLYGHTFLT-UHFFFAOYSA-N 0 3 408.546 4.063 20 0 HIADHN Cc1cc(C(=O)N2CCCC[C@H]2C)ccc1NC(=O)NC[C@H](c1ccccc1)N(C)C ZINC000520049638 928274463 /nfs/dbraw/zinc/27/44/63/928274463.db2.gz CFNZQPVTAGDSTM-AUSIDOKSSA-N 0 3 422.573 4.434 20 0 HIADHN COCCOc1c(Cl)cccc1NC(=O)N[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000520050757 928275733 /nfs/dbraw/zinc/27/57/33/928275733.db2.gz ANFBERYPTAOSTM-AEFFLSMTSA-N 0 3 417.937 4.322 20 0 HIADHN CCN(CC)C(=O)c1cccc(NC(=O)NC[C@@H]2CCCCN2Cc2ccccc2)c1 ZINC000520055162 928281301 /nfs/dbraw/zinc/28/13/01/928281301.db2.gz SMTCKBLWCRFSGT-QHCPKHFHSA-N 0 3 422.573 4.345 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)NC[C@@H]1CCCO[C@H]1c1ccccc1 ZINC000520058267 928284235 /nfs/dbraw/zinc/28/42/35/928284235.db2.gz XLWWUVCCLZHZDV-DQEYMECFSA-N 0 3 423.601 4.360 20 0 HIADHN C[C@H](CNC(=O)CSc1nnc(-c2ccc3ccccc3c2)o1)N1CCC(C)CC1 ZINC000520064847 928289453 /nfs/dbraw/zinc/28/94/53/928289453.db2.gz JWZNMKDBIXXKME-QGZVFWFLSA-N 0 3 424.570 4.219 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1nc(C(C)C)ncc1Cl)c1cccc(OC)c1 ZINC000520101845 928312029 /nfs/dbraw/zinc/31/20/29/928312029.db2.gz XQXSXGDHSOCTTK-SFHVURJKSA-N 0 3 404.942 4.075 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1nc(C(C)C)ncc1Cl)c1cccc(OC)c1 ZINC000520101844 928312706 /nfs/dbraw/zinc/31/27/06/928312706.db2.gz XQXSXGDHSOCTTK-GOSISDBHSA-N 0 3 404.942 4.075 20 0 HIADHN C[C@H](NC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1)c1cccc(N2CCCC2=O)c1 ZINC000520109661 928317368 /nfs/dbraw/zinc/31/73/68/928317368.db2.gz XHJMHXQQNGTODM-GHTZIAJQSA-N 0 3 423.532 4.042 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)NCc1cc2c(s1)CCCC2 ZINC000520130691 928328639 /nfs/dbraw/zinc/32/86/39/928328639.db2.gz ZVKHOUBNTPFRDT-UHFFFAOYSA-N 0 3 407.530 4.179 20 0 HIADHN Cc1c(C(=O)N(CCN(C)C)c2ccccc2)cnn1-c1cccc(C(F)(F)F)c1 ZINC000520164020 928357079 /nfs/dbraw/zinc/35/70/79/928357079.db2.gz UUIIJDRTRIDIKB-UHFFFAOYSA-N 0 3 416.447 4.408 20 0 HIADHN CCN(CC)CC(=O)N[C@@H](c1ccccc1)c1ccc2[nH]c(C(F)(F)F)nc2c1 ZINC000520188922 928376778 /nfs/dbraw/zinc/37/67/78/928376778.db2.gz PEIRWAGZKPBIEY-IBGZPJMESA-N 0 3 404.436 4.129 20 0 HIADHN CCN(CC)CC(=O)N[C@@H](c1ccccc1)c1ccc2nc(C(F)(F)F)[nH]c2c1 ZINC000520188922 928376792 /nfs/dbraw/zinc/37/67/92/928376792.db2.gz PEIRWAGZKPBIEY-IBGZPJMESA-N 0 3 404.436 4.129 20 0 HIADHN CC[C@H](NCC1=Cc2ccccc2OC1)c1ccccc1OCC(=O)N1CCCC1 ZINC000520201748 928386030 /nfs/dbraw/zinc/38/60/30/928386030.db2.gz IONRMSDZSSCYHE-QFIPXVFZSA-N 0 3 406.526 4.205 20 0 HIADHN COc1cccc(COc2cccc(Cl)c2CNCCc2cccc(C(N)=O)c2)c1 ZINC000520215067 928394090 /nfs/dbraw/zinc/39/40/90/928394090.db2.gz FFLJFVZKCKZQTE-UHFFFAOYSA-N 0 3 424.928 4.359 20 0 HIADHN CC(C)[C@@H](C(=O)Nc1cccc(C(=O)Nc2ccc(Cl)cn2)c1)N1CCCCC1 ZINC000520243855 928412535 /nfs/dbraw/zinc/41/25/35/928412535.db2.gz PNGWVEXEOJQJJK-FQEVSTJZSA-N 0 3 414.937 4.436 20 0 HIADHN COc1ccc(C[C@@H](N[C@@H]2CCN(c3ccccc3)C2=O)c2ccccc2)cc1OC ZINC000520249344 928417243 /nfs/dbraw/zinc/41/72/43/928417243.db2.gz ZKTDDFICQPHEIW-DHIUTWEWSA-N 0 3 416.521 4.383 20 0 HIADHN O=C(C[C@@H]1C=CCC1)Nc1ccccc1NC(=O)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000520272194 928437846 /nfs/dbraw/zinc/43/78/46/928437846.db2.gz PTZSIWAWMKGANZ-TZIWHRDSSA-N 0 3 418.541 4.227 20 0 HIADHN O=C(C[C@H]1C=CCC1)Nc1ccccc1NC(=O)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000520272193 928437949 /nfs/dbraw/zinc/43/79/49/928437949.db2.gz PTZSIWAWMKGANZ-PZJWPPBQSA-N 0 3 418.541 4.227 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N2CCC(OCCC(C)C)CC2)N2CCCC2)cc1 ZINC000520296808 928458829 /nfs/dbraw/zinc/45/88/29/928458829.db2.gz SWQPMRQFJDIHEO-QHCPKHFHSA-N 0 3 401.595 4.369 20 0 HIADHN COCCN1CCC(NC(=O)Nc2cc(Cl)ccc2Oc2ccccc2)CC1 ZINC000520387031 928539891 /nfs/dbraw/zinc/53/98/91/928539891.db2.gz UZLMMESMSZPUTA-UHFFFAOYSA-N 0 3 403.910 4.365 20 0 HIADHN COCCN(Cc1ccccc1)C(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1 ZINC000520424765 928559783 /nfs/dbraw/zinc/55/97/83/928559783.db2.gz WOCCBOUEPUDUEY-NRFANRHFSA-N 0 3 415.603 4.379 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N(CC)[C@@H]1CCOC(C)(C)C1)c1cccc(OC)c1 ZINC000520469236 928584296 /nfs/dbraw/zinc/58/42/96/928584296.db2.gz HQQBMSKNTPCGOI-TZIWHRDSSA-N 0 3 405.583 4.067 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)NC[C@@H](c2ccccc2)N2CCCC2)c(C)c1 ZINC000520597845 928662152 /nfs/dbraw/zinc/66/21/52/928662152.db2.gz HQGIOBUGUAIJDI-CVDCTZTESA-N 0 3 422.573 4.482 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)N[C@@H]1C[C@H]1c1cccc(Br)c1 ZINC000520781682 928814700 /nfs/dbraw/zinc/81/47/00/928814700.db2.gz WHOKQVLRPLTDCJ-VQTJNVASSA-N 0 3 416.363 4.078 20 0 HIADHN COc1ccc(CN[C@@H]2CC(=O)N(c3ccccc3Cl)C2)cc1Br ZINC000520973249 928897553 /nfs/dbraw/zinc/89/75/53/928897553.db2.gz SFSDCELZOMNCPR-CYBMUJFWSA-N 0 3 409.711 4.006 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)N[C@H](CN2CCCC2)c2ccccc2)c(Cl)c1 ZINC000520985929 928904901 /nfs/dbraw/zinc/90/49/01/928904901.db2.gz CSIAXCLNFOPLDJ-HXUWFJFHSA-N 0 3 400.910 4.257 20 0 HIADHN Cc1cc(C(=O)N(CCN(C)C)Cc2cccc(Cl)c2)c(C)n1-c1nccs1 ZINC000520989106 928906491 /nfs/dbraw/zinc/90/64/91/928906491.db2.gz IPMNTWMJCCYQHM-UHFFFAOYSA-N 0 3 416.978 4.408 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3cccc(-c4nccs4)c3)CC2)C[C@@H](C)O1 ZINC000521007349 928921488 /nfs/dbraw/zinc/92/14/88/928921488.db2.gz KBWBIXFZLPYZCL-IAGOWNOFSA-N 0 3 414.575 4.163 20 0 HIADHN COc1ccc(CC[C@H](C)NC(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)cc1 ZINC000521013917 928931497 /nfs/dbraw/zinc/93/14/97/928931497.db2.gz DRASQKVUJXXOIP-KRWDZBQOSA-N 0 3 419.516 4.068 20 0 HIADHN COc1ccc(F)cc1[C@H](C)NC(=O)N(CCN(C)C)Cc1cccc(Cl)c1 ZINC000521067362 928971121 /nfs/dbraw/zinc/97/11/21/928971121.db2.gz PMPASIBQQXKOHV-HNNXBMFYSA-N 0 3 407.917 4.322 20 0 HIADHN CCCN(CC(=O)Nc1ccc(CN2CCOCC2)cc1)[C@@H](CC)c1ccccc1 ZINC000521193859 929054780 /nfs/dbraw/zinc/05/47/80/929054780.db2.gz VTQHYWYRDPVRMG-DEOSSOPVSA-N 0 3 409.574 4.321 20 0 HIADHN CC(C)OCc1cccc(NC(=O)NCCCN2CCN(C)C[C@H]2c2ccccc2)c1 ZINC000521273958 929094082 /nfs/dbraw/zinc/09/40/82/929094082.db2.gz LNQULLPKXPOVQY-DEOSSOPVSA-N 0 3 424.589 4.112 20 0 HIADHN CC1(C)CN(C2(CNC(=O)Nc3ccc(OC(F)F)cc3)CCCCC2)CCO1 ZINC000521331167 929146484 /nfs/dbraw/zinc/14/64/84/929146484.db2.gz SKWKYUWGZUAMFY-UHFFFAOYSA-N 0 3 411.493 4.223 20 0 HIADHN COc1ccc(NC(=O)c2ccc(NC(=O)[C@@H](C(C)C)N3CCCCC3)cc2)cc1 ZINC000521440538 929221311 /nfs/dbraw/zinc/22/13/11/929221311.db2.gz LMGCKNKKGBAASN-JOCHJYFZSA-N 0 3 409.530 4.397 20 0 HIADHN CN(CCCOc1ccc(F)cc1)C(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000521452087 929228977 /nfs/dbraw/zinc/22/89/77/929228977.db2.gz WTAYEBXUXOWBQO-LJQANCHMSA-N 0 3 405.539 4.135 20 0 HIADHN CC(C)[C@H](C(=O)Nc1ccc(CC(=O)N(C)c2ccccc2)cc1)N1CCCCC1 ZINC000521469439 929235439 /nfs/dbraw/zinc/23/54/39/929235439.db2.gz JXDFATXXQPHNBU-XMMPIXPASA-N 0 3 407.558 4.341 20 0 HIADHN NC(=O)[C@@H](NCCCc1cccc(C(F)(F)F)c1)c1ccc(Br)cc1 ZINC000521535324 929281031 /nfs/dbraw/zinc/28/10/31/929281031.db2.gz ABNXIJXZUPAMCE-INIZCTEOSA-N 0 3 415.253 4.217 20 0 HIADHN COCCN1CCC(NC(=O)[C@H](Sc2ccccc2Cl)c2ccccc2)CC1 ZINC000521577409 929307783 /nfs/dbraw/zinc/30/77/83/929307783.db2.gz JKMFHNVHHYGCTK-OAQYLSRUSA-N 0 3 418.990 4.400 20 0 HIADHN COc1ccc(OC(F)F)c(NC(=O)N(CCN(C)C)Cc2cccc(F)c2)c1 ZINC000521694451 929370072 /nfs/dbraw/zinc/37/00/72/929370072.db2.gz CFYPPQDNBGZXHA-UHFFFAOYSA-N 0 3 411.424 4.031 20 0 HIADHN O=C(CN(CCc1ccccc1F)C1CCCC1)NC[C@H]1CCN(c2ccccc2)C1 ZINC000521815556 929475066 /nfs/dbraw/zinc/47/50/66/929475066.db2.gz NBODQFOFLWXENV-OAQYLSRUSA-N 0 3 423.576 4.256 20 0 HIADHN CC[C@H](C)[C@@H](NCc1cnc2n[nH]c(C)c2c1)C(=O)Nc1cccc(N2CCCC2)c1 ZINC000521831625 929483572 /nfs/dbraw/zinc/48/35/72/929483572.db2.gz BLZUYESTHBYQHQ-KSFYIVLOSA-N 0 3 420.561 4.010 20 0 HIADHN COCCN(C(=O)NCC(C)(C)N1CCc2ccccc2C1)[C@H](C)c1ccccc1 ZINC000521887537 929536122 /nfs/dbraw/zinc/53/61/22/929536122.db2.gz STWQDYNHMCDCDB-HXUWFJFHSA-N 0 3 409.574 4.243 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)c1cc(-c2cccc(F)c2)no1 ZINC000521989280 929613554 /nfs/dbraw/zinc/61/35/54/929613554.db2.gz LVLPWLHLXROLTK-UHFFFAOYSA-N 0 3 411.502 4.324 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N(C)Cc2ccc(Br)o2)N2CCCC2)cc1 ZINC000521993330 929615421 /nfs/dbraw/zinc/61/54/21/929615421.db2.gz KBZJVLZTMHKJMT-SFHVURJKSA-N 0 3 420.351 4.329 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)NCc2ccc(OCC(F)(F)F)cc2)c1 ZINC000524494962 929642852 /nfs/dbraw/zinc/64/28/52/929642852.db2.gz VJWYJNOYDWWLAD-UHFFFAOYSA-N 0 3 423.479 4.210 20 0 HIADHN CCOc1cc(C(=O)N2CCN(C3CCC(C)CC3)CC2)cc(OCC)c1OCC ZINC000524543179 929674449 /nfs/dbraw/zinc/67/44/49/929674449.db2.gz UULOYCBPUVRRIW-UHFFFAOYSA-N 0 3 418.578 4.219 20 0 HIADHN CC1CCC(N2CCN(C(=O)c3ccccc3NC(=O)c3ccccc3)CC2)CC1 ZINC000524542890 929674626 /nfs/dbraw/zinc/67/46/26/929674626.db2.gz OMWLIUULJQBMJQ-UHFFFAOYSA-N 0 3 405.542 4.275 20 0 HIADHN C[S@](=O)Cc1cc(NC(=O)[C@H]2CCCN(Cc3ccccc3)C2)ccc1Cl ZINC000524545950 929676287 /nfs/dbraw/zinc/67/62/87/929676287.db2.gz PSLSXOYYFFRBPT-SOKVYYICSA-N 0 3 404.963 4.069 20 0 HIADHN Cc1cc(NC(=O)NC[C@H]2CCCN2Cc2ccccc2)ccc1OC1CCOCC1 ZINC000524599806 929709091 /nfs/dbraw/zinc/70/90/91/929709091.db2.gz XZFSUSIWOUPGMQ-JOCHJYFZSA-N 0 3 423.557 4.339 20 0 HIADHN Cc1cccc([C@@H](C)C(=O)NC2CCN(CCOc3ccc(Cl)cc3)CC2)c1 ZINC000524603601 929712187 /nfs/dbraw/zinc/71/21/87/929712187.db2.gz RDMRCOWMJUCWTO-GOSISDBHSA-N 0 3 400.950 4.412 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)NCc1csc(Br)c1 ZINC000524627392 929736265 /nfs/dbraw/zinc/73/62/65/929736265.db2.gz YFKWCGFHFJTGTF-HNNXBMFYSA-N 0 3 422.392 4.317 20 0 HIADHN COc1cc(-c2nnc(CN3CC[C@H](C)[C@@H]4CCCC[C@H]43)o2)cc(OC)c1OC ZINC000524758834 929820447 /nfs/dbraw/zinc/82/04/47/929820447.db2.gz FYKAJZRENIJWKY-BHYGNILZSA-N 0 3 401.507 4.163 20 0 HIADHN Cc1cccc(NC(=O)NCCCN2CCN(C)C[C@H]2c2ccccc2)c1Cl ZINC000524795786 929831317 /nfs/dbraw/zinc/83/13/17/929831317.db2.gz KQDLEPDZMRSPRW-FQEVSTJZSA-N 0 3 400.954 4.149 20 0 HIADHN CCOC(=O)CCc1ccc(NC(=O)NC[C@@H](CC)N2CCc3ccccc3C2)cc1 ZINC000524829096 929848563 /nfs/dbraw/zinc/84/85/63/929848563.db2.gz JRBKXCPSZWQXSL-HSZRJFAPSA-N 0 3 423.557 4.141 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)c1ccccc1OCc1cscn1 ZINC000524864957 929863830 /nfs/dbraw/zinc/86/38/30/929863830.db2.gz JSCHWMZGDKMOOH-IBGZPJMESA-N 0 3 421.566 4.459 20 0 HIADHN C/C=C/c1ccc(OCC(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)c(OC)c1 ZINC000524866113 929864816 /nfs/dbraw/zinc/86/48/16/929864816.db2.gz YINMSFDSCRJRBO-CWFIWJMMSA-N 0 3 408.542 4.230 20 0 HIADHN COc1ccc(NC(=O)[C@H](N[C@@H]2[C@@H]3CCO[C@H]3C2(C)C)c2ccccc2)cc1Cl ZINC000524944425 929906864 /nfs/dbraw/zinc/90/68/64/929906864.db2.gz FIBXPCZPRPPOLS-LLUDDFSJSA-N 0 3 414.933 4.432 20 0 HIADHN Cc1ccc(NC(=O)NCCCCN2CCN(C)CC2)cc1OCC1CCCCC1 ZINC000524990718 929955969 /nfs/dbraw/zinc/95/59/69/929955969.db2.gz AUVBCEMJPCHOCA-UHFFFAOYSA-N 0 3 416.610 4.103 20 0 HIADHN COc1ccc([C@H](CNC(=O)CCc2c[nH]c3c2cccc3C)N2CCCC2)cc1 ZINC000525007373 929970290 /nfs/dbraw/zinc/97/02/90/929970290.db2.gz CQGREBWKLQFYPK-QHCPKHFHSA-N 0 3 405.542 4.371 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2CNCCNC(=O)C(C)(C)C)c(C)c1 ZINC000525182172 930078481 /nfs/dbraw/zinc/07/84/81/930078481.db2.gz LXRBIVGULDXFAI-UHFFFAOYSA-N 0 3 404.558 4.408 20 0 HIADHN CC[C@H](C)[C@H](NCc1cnc2c(C)cccn12)C(=O)Nc1cccc(N2CCCC2)c1 ZINC000525192948 930081994 /nfs/dbraw/zinc/08/19/94/930081994.db2.gz GZGGCFDNJIFWTA-MBSDFSHPSA-N 0 3 419.573 4.386 20 0 HIADHN COc1cc(OC)c(OC)cc1CNC[C@H](C)Oc1cccc(Br)c1 ZINC000525194825 930083026 /nfs/dbraw/zinc/08/30/26/930083026.db2.gz AOJCMMKGRGXXRG-ZDUSSCGKSA-N 0 3 410.308 4.032 20 0 HIADHN Cc1nc2cc(NC(=O)[C@@]3(C(F)(F)F)CCN(Cc4ccccc4)C3)ccc2n1C ZINC000525211990 930088257 /nfs/dbraw/zinc/08/82/57/930088257.db2.gz LABJSLUMXXUHAV-OAQYLSRUSA-N 0 3 416.447 4.275 20 0 HIADHN C[C@H](CC(=O)c1cccc(Br)c1)C(=O)NCCN1[C@H](C)CCC[C@@H]1C ZINC000525242909 930102415 /nfs/dbraw/zinc/10/24/15/930102415.db2.gz CUQWUBFRRXPEGU-OAGGEKHMSA-N 0 3 409.368 4.037 20 0 HIADHN CCOC(=O)CCc1ccc(NC(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)cc1 ZINC000525343728 930181317 /nfs/dbraw/zinc/18/13/17/930181317.db2.gz XORYIGXQVHTZMR-HSZRJFAPSA-N 0 3 423.557 4.449 20 0 HIADHN Cc1ccc(C(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)cc1NC(=O)NC(C)(C)C ZINC000525371796 930203276 /nfs/dbraw/zinc/20/32/76/930203276.db2.gz SEFJAYUQPRKGRQ-RXVVDRJESA-N 0 3 422.573 4.480 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)c1cccc(OCc2cccnc2)c1 ZINC000525382748 930209391 /nfs/dbraw/zinc/20/93/91/930209391.db2.gz BXLUMKAZHAKVAH-OAQYLSRUSA-N 0 3 415.537 4.397 20 0 HIADHN C[C@@H]1C[C@H]1C(=O)Nc1ccc(C(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)cc1 ZINC000525384203 930211220 /nfs/dbraw/zinc/21/12/20/930211220.db2.gz UDVXXQQAWPPKRA-SELNLUPBSA-N 0 3 405.542 4.018 20 0 HIADHN CCCC(=O)Nc1ccc(CNC(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)cc1 ZINC000525403886 930221814 /nfs/dbraw/zinc/22/18/14/930221814.db2.gz WLKNSORPKYTYRS-FQEVSTJZSA-N 0 3 422.573 4.231 20 0 HIADHN C[C@H](c1ccccc1)N(CC(=O)Nc1ccc(CN2CCOCC2)cc1)CC1CCC1 ZINC000525409798 930223553 /nfs/dbraw/zinc/22/35/53/930223553.db2.gz OXHAZTDAYSCYJR-OAQYLSRUSA-N 0 3 421.585 4.321 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1ccc(N2CCCCC2)nc1 ZINC000525417029 930228765 /nfs/dbraw/zinc/22/87/65/930228765.db2.gz SPSGQRRCCRUICT-HXUWFJFHSA-N 0 3 407.562 4.200 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1ccc(OCC(F)(F)F)nc1 ZINC000525418619 930229869 /nfs/dbraw/zinc/22/98/69/930229869.db2.gz FMRVXBYRPWIKSN-INIZCTEOSA-N 0 3 422.451 4.151 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1ccc(OCC(F)(F)F)nc1 ZINC000525418620 930230125 /nfs/dbraw/zinc/23/01/25/930230125.db2.gz FMRVXBYRPWIKSN-MRXNPFEDSA-N 0 3 422.451 4.151 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)NCc1coc(-c2cccs2)n1 ZINC000525449988 930247686 /nfs/dbraw/zinc/24/76/86/930247686.db2.gz IUISBZOZILPGMD-KRWDZBQOSA-N 0 3 410.543 4.209 20 0 HIADHN Cc1cccc(NC2CCN(C(=O)N[C@@H]3CCN([C@H](C)c4ccccc4)C3)CC2)c1 ZINC000525498487 930285440 /nfs/dbraw/zinc/28/54/40/930285440.db2.gz ZBSNTLVWSKGXGR-HYBUGGRVSA-N 0 3 406.574 4.416 20 0 HIADHN Cc1cccc(-c2nn(-c3ccc(F)cc3)cc2C(=O)N(C)[C@@H]2CCCN(C)C2)c1 ZINC000525522986 930301034 /nfs/dbraw/zinc/30/10/34/930301034.db2.gz KFGDZBFRMRHSGX-OAQYLSRUSA-N 0 3 406.505 4.153 20 0 HIADHN CN1CCC[C@H](CNC(=O)c2csc(Nc3ccccn3)n2)[C@H]1c1cccs1 ZINC000525573552 930338609 /nfs/dbraw/zinc/33/86/09/930338609.db2.gz QFELUKXSKNNQEH-KDOFPFPSSA-N 0 3 413.572 4.156 20 0 HIADHN CC(C)COc1ccc(C(=O)Nc2ccc(C(=O)N(C)[C@@H]3CCCN(C)C3)cc2)cc1 ZINC000525579585 930342637 /nfs/dbraw/zinc/34/26/37/930342637.db2.gz ATKHSFMUSRLJLP-JOCHJYFZSA-N 0 3 423.557 4.140 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2cc(NC(=O)C(C)C)ccc2Cl)N(C)C)cc1 ZINC000525579871 930342738 /nfs/dbraw/zinc/34/27/38/930342738.db2.gz PWRXZUXJEFOQQO-HXUWFJFHSA-N 0 3 401.938 4.276 20 0 HIADHN CC(C)OCc1ccc(C(=O)Nc2ccc(C(=O)N(C)[C@H]3CCCN(C)C3)cc2)cc1 ZINC000525580457 930343303 /nfs/dbraw/zinc/34/33/03/930343303.db2.gz VTTJECWANGLMCT-QHCPKHFHSA-N 0 3 423.557 4.030 20 0 HIADHN CCCCOc1ccc(C(=O)Nc2ccc(C(=O)N(C)[C@H]3CCCN(C)C3)cc2)cc1 ZINC000525581908 930344421 /nfs/dbraw/zinc/34/44/21/930344421.db2.gz WANRWQQRROUQEN-QFIPXVFZSA-N 0 3 423.557 4.284 20 0 HIADHN COc1ccc(Br)cc1C(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000525583319 930345314 /nfs/dbraw/zinc/34/53/14/930345314.db2.gz SQBKLYYGJUFDIN-RHSMWYFYSA-N 0 3 403.320 4.023 20 0 HIADHN Cc1ccc(-c2nn(-c3ccc(F)cc3)cc2C(=O)N(C)[C@@H]2CCCN(C)C2)cc1 ZINC000525618165 930365017 /nfs/dbraw/zinc/36/50/17/930365017.db2.gz LWETXVQAKVUTHT-OAQYLSRUSA-N 0 3 406.505 4.153 20 0 HIADHN CN(C(=O)c1ccccc1OCc1ccccc1Br)[C@H]1CCCN(C)C1 ZINC000525619044 930365826 /nfs/dbraw/zinc/36/58/26/930365826.db2.gz RTFBMLPQCJSKEO-KRWDZBQOSA-N 0 3 417.347 4.194 20 0 HIADHN C[C@H](NC(=O)[C@H](C)N1CC[C@@H](c2ccccc2)[C@H](C)C1)c1ccc2c(c1)OCCO2 ZINC000525635834 930375635 /nfs/dbraw/zinc/37/56/35/930375635.db2.gz SHMHOYBEMBAOAG-MDPIYQRISA-N 0 3 408.542 4.149 20 0 HIADHN CCCN(CCN(C)C)C(=O)Cc1c(C)nn(-c2ccc(Cl)cc2Cl)c1C ZINC000525646296 930380595 /nfs/dbraw/zinc/38/05/95/930380595.db2.gz PCTWSPJBSXTUBA-UHFFFAOYSA-N 0 3 411.377 4.139 20 0 HIADHN CC(C)(C)c1noc(-c2ccccc2C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)n1 ZINC000525726425 930416764 /nfs/dbraw/zinc/41/67/64/930416764.db2.gz IADBQSCIDVKKOS-IBGZPJMESA-N 0 3 418.541 4.429 20 0 HIADHN COc1cc(-c2nnc(CN3CCC[C@@H](C(C)(C)C)CC3)o2)cc(OC)c1OC ZINC000525784410 930443647 /nfs/dbraw/zinc/44/36/47/930443647.db2.gz GSEDXHHYLHWAHG-MRXNPFEDSA-N 0 3 403.523 4.411 20 0 HIADHN C[C@H](N[C@@H](CN1CCN(C)CC1)c1ccccc1)c1ccc(Br)cc1F ZINC000525857693 930469387 /nfs/dbraw/zinc/46/93/87/930469387.db2.gz SRMDYUCVMSRHHP-KKSFZXQISA-N 0 3 420.370 4.228 20 0 HIADHN COc1ccc([C@H](C)N[C@H]2CCCN(Cc3ccc(F)cc3F)C2=O)cc1Cl ZINC000526048017 930515060 /nfs/dbraw/zinc/51/50/60/930515060.db2.gz QGBIJBWKBHSMSA-DJJJIMSYSA-N 0 3 408.876 4.469 20 0 HIADHN Cc1[nH]c2ccc(CNC(=O)NC3CC(N4CCC(C(F)(F)F)CC4)C3)cc2c1C ZINC000526838972 930546901 /nfs/dbraw/zinc/54/69/01/930546901.db2.gz LKIGECPAZMDZNA-UHFFFAOYSA-N 0 3 422.495 4.389 20 0 HIADHN C[C@H](NCc1ccc2c(c1)sc(=O)n2C)c1cccc(OCc2ccccn2)c1 ZINC000526981037 930561313 /nfs/dbraw/zinc/56/13/13/930561313.db2.gz NIFPSYKQXJBSAM-INIZCTEOSA-N 0 3 405.523 4.425 20 0 HIADHN COCC(=O)Nc1cccc(CN[C@@H]2CCCc3cc(Br)ccc32)c1 ZINC000527033974 930571839 /nfs/dbraw/zinc/57/18/39/930571839.db2.gz QGZSJVVRXATIIL-LJQANCHMSA-N 0 3 403.320 4.201 20 0 HIADHN O=C(c1c[nH]c(=O)c2ccccc12)N(CCN1CCCC1)Cc1ccc(Cl)cc1 ZINC000527041235 930574584 /nfs/dbraw/zinc/57/45/84/930574584.db2.gz WAYVTEPYCKWYEG-UHFFFAOYSA-N 0 3 409.917 4.332 20 0 HIADHN C[C@@H](CC(=O)Nc1ccc(Br)cc1)N[C@@H]1CCOc2ccc(F)cc21 ZINC000527099699 930589740 /nfs/dbraw/zinc/58/97/40/930589740.db2.gz APKYMQAAKZNELB-YVEFUNNKSA-N 0 3 407.283 4.419 20 0 HIADHN O=C(Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)c1csc(C(F)(F)F)n1 ZINC000527250746 930620500 /nfs/dbraw/zinc/62/05/00/930620500.db2.gz OYEMVDXIPSVVRW-AWEZNQCLSA-N 0 3 421.448 4.058 20 0 HIADHN Fc1cccnc1N1CC[C@@H](N[C@@H](c2ccc(Br)cc2F)C2CC2)C1 ZINC000527282921 930625709 /nfs/dbraw/zinc/62/57/09/930625709.db2.gz PWUMIYGTRBNXRY-RDTXWAMCSA-N 0 3 408.290 4.442 20 0 HIADHN Cn1c(=O)sc2cc(CNCc3cc4cc(Br)ccc4[nH]3)ccc21 ZINC000527524884 930673688 /nfs/dbraw/zinc/67/36/88/930673688.db2.gz DSOWBNKGNWWYKD-UHFFFAOYSA-N 0 3 402.317 4.134 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)Nc3ccc(C(F)(F)F)c(Br)c3)[C@H]2C1 ZINC000530343704 930687839 /nfs/dbraw/zinc/68/78/39/930687839.db2.gz RXWTXACAJCMHAH-HZMBPMFUSA-N 0 3 406.246 4.026 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2ccccc2OC[C@H]2CCCCO2)[C@@H]1c1ccccc1 ZINC000530462598 930718585 /nfs/dbraw/zinc/71/85/85/930718585.db2.gz PMHISMGMECXBLC-NWSQWKLXSA-N 0 3 409.530 4.201 20 0 HIADHN CC(C)N1CCN([C@H]2CCN(C(=O)c3ccc(O[C@H](C)c4ccccc4)cc3)C2)CC1 ZINC000530522841 930738033 /nfs/dbraw/zinc/73/80/33/930738033.db2.gz ICMGWFYJQSDQFP-QPPBQGQZSA-N 0 3 421.585 4.067 20 0 HIADHN COc1ccc(-c2nnc(SCc3nc(-c4ccc(CN(C)C)cc4)no3)o2)cc1 ZINC000530633000 930779715 /nfs/dbraw/zinc/77/97/15/930779715.db2.gz OKFPZKISXWNZDJ-UHFFFAOYSA-N 0 3 423.498 4.149 20 0 HIADHN C[C@H](SCC(=O)Nc1ccc(F)cc1)c1nc(-c2ccc(CN(C)C)cc2)no1 ZINC000530633325 930779816 /nfs/dbraw/zinc/77/98/16/930779816.db2.gz UJUNOAJRZWWGFR-AWEZNQCLSA-N 0 3 414.506 4.370 20 0 HIADHN CN(C)Cc1ccc(-c2noc(COc3ccccc3OCC(F)(F)F)n2)cc1 ZINC000530632912 930780530 /nfs/dbraw/zinc/78/05/30/930780530.db2.gz BHXMFYIZCSVMBY-UHFFFAOYSA-N 0 3 407.392 4.318 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@@H](C)NCc2c[nH]c(-c3ccccc3)n2)CC1 ZINC000530646844 930785929 /nfs/dbraw/zinc/78/59/29/930785929.db2.gz OTEBBGUMSRQCAV-GOSISDBHSA-N 0 3 407.537 4.209 20 0 HIADHN COc1cc(C(=O)N(Cc2ccccc2)C2CCN(C)CC2)ccc1OC(F)F ZINC000530680032 930796759 /nfs/dbraw/zinc/79/67/59/930796759.db2.gz IEEAKDSMHAXHDV-UHFFFAOYSA-N 0 3 404.457 4.033 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)CCCc2nc(-c3cccs3)no2)CC1 ZINC000530680009 930796939 /nfs/dbraw/zinc/79/69/39/930796939.db2.gz PYUADCUBZYNPPN-UHFFFAOYSA-N 0 3 424.570 4.244 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)N[C@H]1C[C@@H]1c1cccc(Br)c1 ZINC000530752855 930816906 /nfs/dbraw/zinc/81/69/06/930816906.db2.gz UKEZTKFDFYKRQL-MSOLQXFVSA-N 0 3 422.392 4.140 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccnc2)C1)N1CCC[C@]2(CCCc3ccccc32)C1 ZINC000530759224 930817964 /nfs/dbraw/zinc/81/79/64/930817964.db2.gz GTBFRSWCVQAZCG-ZEQKJWHPSA-N 0 3 403.570 4.190 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)c1ccc(N2CCc3ccccc3C2)cc1 ZINC000530796612 930825728 /nfs/dbraw/zinc/82/57/28/930825728.db2.gz ARUNZUHJCWCBFY-UHFFFAOYSA-N 0 3 403.526 4.046 20 0 HIADHN CCc1cccc(Oc2ccc(NC(=O)[C@]3(O)CCN(Cc4ccccc4)C3)cn2)c1 ZINC000530812058 930829709 /nfs/dbraw/zinc/82/97/09/930829709.db2.gz JHWIDDUEDDZDQD-VWLOTQADSA-N 0 3 417.509 4.012 20 0 HIADHN CCN1CCN(CCC(=O)N[C@H](c2ccc(Cl)cc2)c2ccccc2Cl)CC1 ZINC000530822522 930832257 /nfs/dbraw/zinc/83/22/57/930832257.db2.gz RZYCTSAUGLFCHO-JOCHJYFZSA-N 0 3 420.384 4.227 20 0 HIADHN Cc1[nH]c(=O)c(C(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)cc1-c1ccccc1 ZINC000530931144 930861193 /nfs/dbraw/zinc/86/11/93/930861193.db2.gz UQRHXYUKBFNTAL-QFIPXVFZSA-N 0 3 415.537 4.499 20 0 HIADHN COc1ccc(-c2csc(CNC(=O)[C@@H]3CCCN(Cc4cccnc4)C3)c2)cc1 ZINC000531081562 930912123 /nfs/dbraw/zinc/91/21/23/930912123.db2.gz FGEALPCMLSPGLS-HXUWFJFHSA-N 0 3 421.566 4.347 20 0 HIADHN O=C(NCCNCc1cnc(-c2cccs2)s1)c1ccc(Br)cc1 ZINC000531199798 930962574 /nfs/dbraw/zinc/96/25/74/930962574.db2.gz WEBBDBPYXYUXGC-UHFFFAOYSA-N 0 3 422.373 4.154 20 0 HIADHN O=C([C@H]1CCCN(Cc2cccnc2)C1)N1CCc2cc(Cl)cc(Cl)c2C1 ZINC000531225120 930973889 /nfs/dbraw/zinc/97/38/89/930973889.db2.gz NRFATSARGVYWRO-KRWDZBQOSA-N 0 3 404.341 4.185 20 0 HIADHN O=C(CC1(N2CCOCC2)CCCC1)NCc1ccc(COCc2ccccc2)cc1 ZINC000531288130 931002956 /nfs/dbraw/zinc/00/29/56/931002956.db2.gz MSGAZRVTIQIZRB-UHFFFAOYSA-N 0 3 422.569 4.055 20 0 HIADHN CC[C@@H](C(=O)Nc1ccc(Cl)c(-c2nnc3n2CCCCC3)c1)N(CC)CC ZINC000531310576 931011594 /nfs/dbraw/zinc/01/15/94/931011594.db2.gz PVDGIFUAGPAMIT-SFHVURJKSA-N 0 3 403.958 4.384 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)c2cnn(-c3ccccc3Cl)c2)CC1 ZINC000531396258 931042946 /nfs/dbraw/zinc/04/29/46/931042946.db2.gz JDLNBXMIQVHZEW-UHFFFAOYSA-N 0 3 408.933 4.262 20 0 HIADHN O=C(Nc1cc(F)ccc1OCC(F)(F)F)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000531461306 931066004 /nfs/dbraw/zinc/06/60/04/931066004.db2.gz OBFNBBCDMWBPLL-MRXNPFEDSA-N 0 3 411.399 4.163 20 0 HIADHN CN(C)Cc1ccc(C(=O)Nc2nccn2Cc2ccc(Br)cc2)cc1 ZINC000531521716 931090196 /nfs/dbraw/zinc/09/01/96/931090196.db2.gz AYTDYHGNDXEFLU-UHFFFAOYSA-N 0 3 413.319 4.008 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)c2ccccc2OCc2ccncc2)CN1Cc1ccccc1 ZINC000531569389 931105602 /nfs/dbraw/zinc/10/56/02/931105602.db2.gz WDFAVJAGRNBUKY-DENIHFKCSA-N 0 3 401.510 4.053 20 0 HIADHN C[C@@H](NC[C@@H](c1cccs1)N1CCN(C)CC1)c1sccc1Br ZINC000531677409 931147905 /nfs/dbraw/zinc/14/79/05/931147905.db2.gz VXSWTDGBJNVTLI-HIFRSBDPSA-N 0 3 414.438 4.211 20 0 HIADHN C[C@H](NCc1cccc(NC(=O)c2ccccn2)c1)c1ccc2c(c1)CCC(=O)N2 ZINC000531684206 931152098 /nfs/dbraw/zinc/15/20/98/931152098.db2.gz XZIWRVULUCYSMR-INIZCTEOSA-N 0 3 400.482 4.069 20 0 HIADHN Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)NCc1ccc(N2CCOCC2)nc1 ZINC000531689254 931154156 /nfs/dbraw/zinc/15/41/56/931154156.db2.gz XUAIAQYOQMQKLY-HNNXBMFYSA-N 0 3 412.534 4.340 20 0 HIADHN C[C@H](NC[C@@H](O)COc1cccc(C(F)(F)F)c1)c1cnn(Cc2ccccc2)c1 ZINC000531695692 931158118 /nfs/dbraw/zinc/15/81/18/931158118.db2.gz QJLHVJJAQGDIPG-OXJNMPFZSA-N 0 3 419.447 4.041 20 0 HIADHN C[C@H](NCc1ccc(N2CCc3ccccc3C2)nc1)c1ccc2c(c1)CCC(=O)N2 ZINC000531699498 931162603 /nfs/dbraw/zinc/16/26/03/931162603.db2.gz RAIXPQRZWRKPBN-SFHVURJKSA-N 0 3 412.537 4.380 20 0 HIADHN CC[C@@H](N[C@H](C)c1cc(OC)c(OC)cc1C)c1ccccc1OCC(=O)N(C)C ZINC000531700202 931163593 /nfs/dbraw/zinc/16/35/93/931163593.db2.gz QDEWIHHLFQZPRI-YLJYHZDGSA-N 0 3 414.546 4.281 20 0 HIADHN COc1ccc([C@@H](Cc2ccccc2C)NCc2ccc3c(c2)nnn3C)cc1OC ZINC000531701394 931164204 /nfs/dbraw/zinc/16/42/04/931164204.db2.gz MHLSWPDNXBAZTI-OAQYLSRUSA-N 0 3 416.525 4.368 20 0 HIADHN COc1ccc(CN[C@H](C)CC(=O)Nc2ccccc2C(F)(F)F)cc1NC(C)=O ZINC000531708955 931167830 /nfs/dbraw/zinc/16/78/30/931167830.db2.gz GHZMKOJUOFJONB-CYBMUJFWSA-N 0 3 423.435 4.179 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)C[C@@H](C)NCc1ccc(OCC2CC2)nc1 ZINC000531708483 931168207 /nfs/dbraw/zinc/16/82/07/931168207.db2.gz UUACZPWFMLBQND-CQSZACIVSA-N 0 3 403.910 4.039 20 0 HIADHN Cc1ccc(OC(F)F)c([C@@H](C)N[C@@H](CN2CCN(C)CC2)c2ccccc2)c1 ZINC000531710730 931170035 /nfs/dbraw/zinc/17/00/35/931170035.db2.gz VNIOGUXPMOJEOW-NQIIRXRSSA-N 0 3 403.517 4.236 20 0 HIADHN C[C@H](NC(=O)N1CCN(C2CCCCC2)CC1)c1ccc(OCc2cccnc2)cc1 ZINC000531740875 931179360 /nfs/dbraw/zinc/17/93/60/931179360.db2.gz IAKGDWUTAGOFBS-FQEVSTJZSA-N 0 3 422.573 4.382 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1C(=O)N1CCCN(Cc2ccccc2)C[C@H]1C ZINC000531802410 931204167 /nfs/dbraw/zinc/20/41/67/931204167.db2.gz QMWOCMAXXSPTJK-HXUWFJFHSA-N 0 3 416.569 4.285 20 0 HIADHN C[C@@H](NC[C@@H](c1cccs1)N1CCN(C)CC1)c1ccc(F)cc1OC(F)F ZINC000531932523 931250924 /nfs/dbraw/zinc/25/09/24/931250924.db2.gz SQVOUFXHMICSJB-PBHICJAKSA-N 0 3 413.509 4.128 20 0 HIADHN C[C@H](N[C@@H](C)c1cccc(NS(C)(=O)=O)c1)c1ccc(OCC(F)(F)F)cc1 ZINC000531950757 931260603 /nfs/dbraw/zinc/26/06/03/931260603.db2.gz ZBYZTIZDMDTAPJ-KBPBESRZSA-N 0 3 416.465 4.411 20 0 HIADHN CN1CCN(C[C@@H](N[C@@H]2CCSc3c(Cl)cccc32)c2ccccc2)CC1 ZINC000531965151 931267719 /nfs/dbraw/zinc/26/77/19/931267719.db2.gz LXEDMQHQXITYLL-NHCUHLMSSA-N 0 3 402.007 4.455 20 0 HIADHN C[C@@H](CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)N[C@H](CO)c1ccccc1 ZINC000531967594 931269353 /nfs/dbraw/zinc/26/93/53/931269353.db2.gz GZYFIGQLUJDNSQ-YVEFUNNKSA-N 0 3 400.828 4.399 20 0 HIADHN O=C(C1CCCCC1)N1CC[C@@H](NCc2cc3ccccc3nc2N2CCCCC2)C1 ZINC000532119779 931320045 /nfs/dbraw/zinc/32/00/45/931320045.db2.gz AJCJRFPRBWHPOM-HSZRJFAPSA-N 0 3 420.601 4.496 20 0 HIADHN CCC[C@@H](NCc1cccc(-n2cccn2)c1)C(=O)Nc1cccc(N2CCCC2)c1 ZINC000532122554 931321927 /nfs/dbraw/zinc/32/19/27/931321927.db2.gz SXORASRSANBBKU-XMMPIXPASA-N 0 3 417.557 4.370 20 0 HIADHN CN(C(=O)c1ccccc1OCc1ccncc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000532146073 931327979 /nfs/dbraw/zinc/32/79/79/931327979.db2.gz QNTSXHULYJCWSZ-QFIPXVFZSA-N 0 3 401.510 4.007 20 0 HIADHN O[C@H](COC[C@@H]1CCCO1)CN1CCC(=Cc2cc(Cl)ccc2Cl)CC1 ZINC000532165426 931334338 /nfs/dbraw/zinc/33/43/38/931334338.db2.gz ICMWJQROFADBKC-OALUTQOASA-N 0 3 400.346 4.029 20 0 HIADHN CCCC(=O)Nc1cccc(CN[C@H](C)c2ccc(NS(=O)(=O)CC)cc2)c1 ZINC000532192330 931343398 /nfs/dbraw/zinc/34/33/98/931343398.db2.gz LCJZMWNHBXBRQY-MRXNPFEDSA-N 0 3 403.548 4.038 20 0 HIADHN CCCC(=O)Nc1cccc(CN[C@@H](C)c2ccc(NS(=O)(=O)CC)cc2)c1 ZINC000532192329 931343438 /nfs/dbraw/zinc/34/34/38/931343438.db2.gz LCJZMWNHBXBRQY-INIZCTEOSA-N 0 3 403.548 4.038 20 0 HIADHN C[C@@H](NCc1ccc(N2CCOCC2)nc1)c1ccc(OCc2ccccc2)cc1 ZINC000532200137 931347268 /nfs/dbraw/zinc/34/72/68/931347268.db2.gz AFXMPIUMVGFOKF-HXUWFJFHSA-N 0 3 403.526 4.348 20 0 HIADHN CNC(=O)c1ccc(CN[C@@H](C)c2cccc(OCc3cn4ccccc4n3)c2)cc1 ZINC000532202550 931348501 /nfs/dbraw/zinc/34/85/01/931348501.db2.gz LDIDASZPVNOIGT-SFHVURJKSA-N 0 3 414.509 4.124 20 0 HIADHN C[C@H](NCc1cccc(OCCN2CCOCC2)c1)c1ccc(Br)cc1 ZINC000532204471 931349470 /nfs/dbraw/zinc/34/94/70/931349470.db2.gz LDAUIYPGRYXBQM-KRWDZBQOSA-N 0 3 419.363 4.011 20 0 HIADHN Cc1c([C@H](C)N[C@@H](C)c2ccc(NS(C)(=O)=O)cc2)cnn1-c1ccc(F)cc1 ZINC000532217995 931358151 /nfs/dbraw/zinc/35/81/51/931358151.db2.gz KPTWKKSSUZVFTF-GJZGRUSLSA-N 0 3 416.522 4.103 20 0 HIADHN C[C@H](N[C@H](CN1CCN(C)CC1)c1ccccc1)c1ccc(Br)c(F)c1 ZINC000532270432 931378684 /nfs/dbraw/zinc/37/86/84/931378684.db2.gz FGXCOATVGQMWKQ-HRAATJIYSA-N 0 3 420.370 4.228 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@H](C)N[C@@H]2CCCc3ccc(OC)cc32)cc1 ZINC000532441344 931435595 /nfs/dbraw/zinc/43/55/95/931435595.db2.gz CAEOWNCDEGHSFB-GAJHUEQPSA-N 0 3 416.587 4.454 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@@H](C)N[C@@H](C)c2ccc(OC)c(OC)c2)cc1 ZINC000532441194 931435675 /nfs/dbraw/zinc/43/56/75/931435675.db2.gz GYHUJDKZBZNMFT-SJORKVTESA-N 0 3 420.575 4.146 20 0 HIADHN CCCNC(=O)c1cccc(CN[C@H](C)CC(=O)N(C)Cc2ccccc2Cl)c1 ZINC000532447690 931438361 /nfs/dbraw/zinc/43/83/61/931438361.db2.gz SZBHKLUSCIIRJZ-QGZVFWFLSA-N 0 3 415.965 4.007 20 0 HIADHN C[C@H](NCc1ccc(Cn2ccnc2)cc1)c1ccc(S(=O)(=O)C2CCCC2)cc1 ZINC000532451105 931439910 /nfs/dbraw/zinc/43/99/10/931439910.db2.gz BIKHUDVNURSGBO-IBGZPJMESA-N 0 3 423.582 4.499 20 0 HIADHN Cc1nc(C(C)(C)C)sc1[C@H](C)NCc1ccc(CS(=O)(=O)NC(C)C)cc1 ZINC000532466227 931447675 /nfs/dbraw/zinc/44/76/75/931447675.db2.gz HLMUFSHJTCXTPG-HNNXBMFYSA-N 0 3 423.648 4.428 20 0 HIADHN COc1ccc(Br)cc1-c1nc(CN2CCN(CC3CC3)CC2)cs1 ZINC000532474299 931452581 /nfs/dbraw/zinc/45/25/81/931452581.db2.gz MVHXUXCAJDHAAV-UHFFFAOYSA-N 0 3 422.392 4.109 20 0 HIADHN Cc1ccc([C@@H](C)N(C)Cc2cc(=O)n3cc(Br)ccc3n2)c(C)c1 ZINC000532493808 931460088 /nfs/dbraw/zinc/46/00/88/931460088.db2.gz XLFBJUONFIHKFD-OAHLLOKOSA-N 0 3 400.320 4.267 20 0 HIADHN COc1ccc(NC(=O)C[C@H](C)NCc2ccc(Oc3ccccc3)nc2)c(OC)c1 ZINC000532494467 931461361 /nfs/dbraw/zinc/46/13/61/931461361.db2.gz FANQZICWDHENRQ-KRWDZBQOSA-N 0 3 421.497 4.398 20 0 HIADHN COc1cc(OC)cc(N2CC[C@@H](N[C@@H](C)c3sccc3Br)C2)c1 ZINC000532549725 931518693 /nfs/dbraw/zinc/51/86/93/931518693.db2.gz QNIJCJMSOKATNJ-QWHCGFSZSA-N 0 3 411.365 4.457 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@@H](C)N[C@@H](c2ccc(F)cc2)C2CCC2)cc1OC ZINC000532687623 931585399 /nfs/dbraw/zinc/58/53/99/931585399.db2.gz GTOINTXSZVFTET-WAIKUNEKSA-N 0 3 414.521 4.321 20 0 HIADHN CCOc1ccc([C@H]2CCCN2C(=O)CNC2(c3ccccc3)CCOCC2)cc1 ZINC000532708832 931600317 /nfs/dbraw/zinc/60/03/17/931600317.db2.gz NIAKEOREVDWFOL-HSZRJFAPSA-N 0 3 408.542 4.044 20 0 HIADHN CC(C)[C@H](NC(=O)CNC1(c2ccc(Cl)cc2)CCOCC1)c1ccccc1 ZINC000532714236 931603717 /nfs/dbraw/zinc/60/37/17/931603717.db2.gz HUAWJTHUWUIOET-QFIPXVFZSA-N 0 3 400.950 4.449 20 0 HIADHN Cc1ccc(NCc2cnc(-c3ccccc3)[nH]2)cc1NC(=O)CN1CCCCC1 ZINC000532727755 931612237 /nfs/dbraw/zinc/61/22/37/931612237.db2.gz XNRGKCZMNFAJDU-UHFFFAOYSA-N 0 3 403.530 4.422 20 0 HIADHN COc1cccc(CN(C)C(=O)CN[C@@H](c2ccc(Cl)cc2)C(C)C)c1OC ZINC000532758453 931624317 /nfs/dbraw/zinc/62/43/17/931624317.db2.gz YYDSOAWBCCGAID-OAQYLSRUSA-N 0 3 404.938 4.303 20 0 HIADHN Clc1cccc(-n2cc(CNCC3(c4ccccc4)CCOCC3)nn2)c1Cl ZINC000532851221 931663970 /nfs/dbraw/zinc/66/39/70/931663970.db2.gz OSDKSSCKVPQGSR-UHFFFAOYSA-N 0 3 417.340 4.412 20 0 HIADHN C[C@@H]1CN(CC(=O)N2CCC(OCc3ccccc3)CC2)CC[C@H]1c1ccccc1 ZINC000532972481 931721135 /nfs/dbraw/zinc/72/11/35/931721135.db2.gz KTWGGZGDGGKZGW-PXDATVDWSA-N 0 3 406.570 4.320 20 0 HIADHN CC1CCC(N2CCN(CC(=O)Nc3nc(-c4cccs4)cs3)CC2)CC1 ZINC000532976572 931723408 /nfs/dbraw/zinc/72/34/08/931723408.db2.gz LBCOOPBJZNCTIU-UHFFFAOYSA-N 0 3 404.605 4.006 20 0 HIADHN COc1ccc(CN[C@H](C)[C@@H](OC2CCOCC2)c2ccccc2)c(OC)c1OC ZINC000533007346 931734050 /nfs/dbraw/zinc/73/40/50/931734050.db2.gz MQCUJVNMTJSFED-VGOFRKELSA-N 0 3 415.530 4.127 20 0 HIADHN O=C(CN[C@H](c1ccc(F)cc1)C1CCC1)NCC1(c2ccccc2)CCOCC1 ZINC000533055354 931757113 /nfs/dbraw/zinc/75/71/13/931757113.db2.gz YXDSLFBSEXPPJL-DEOSSOPVSA-N 0 3 410.533 4.121 20 0 HIADHN CCN(CC[S@@](=O)c1ccccc1)C1CCN(c2cc(C)nc(C(C)C)n2)CC1 ZINC000533073237 931763083 /nfs/dbraw/zinc/76/30/83/931763083.db2.gz MLEGTUAYFCJVPD-GDLZYMKVSA-N 0 3 414.619 4.007 20 0 HIADHN CN(C)S(=O)(=O)c1ccc(CNCc2ccc(Sc3ccccc3)cc2)cc1 ZINC000533150293 931787424 /nfs/dbraw/zinc/78/74/24/931787424.db2.gz YOSJREDMFGUKHW-UHFFFAOYSA-N 0 3 412.580 4.378 20 0 HIADHN Brc1cccc(-c2c[nH]c(CN[C@@H]3[C@H]4CCO[C@H]4C34CCCC4)n2)c1 ZINC000533179458 931803181 /nfs/dbraw/zinc/80/31/81/931803181.db2.gz NPHTVDQGMXNEQC-ATZDWAIDSA-N 0 3 402.336 4.277 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)c1cc2cc(F)ccc2o1 ZINC000533260289 931821524 /nfs/dbraw/zinc/82/15/24/931821524.db2.gz QFVQCHAYQHOCEQ-LJQANCHMSA-N 0 3 404.445 4.468 20 0 HIADHN CCc1nc(C)c([C@H](C)N(C)CCC(=O)Nc2cc(OC)c(OC)c(OC)c2)s1 ZINC000533294002 931831846 /nfs/dbraw/zinc/83/18/46/931831846.db2.gz DNOVVBCXNPDBHL-AWEZNQCLSA-N 0 3 421.563 4.061 20 0 HIADHN C[C@@H](NCc1ccc(Br)cn1)[C@H](OC1CCOCC1)c1ccccc1 ZINC000533329131 931839709 /nfs/dbraw/zinc/83/97/09/931839709.db2.gz XBAUDINPSIGQJB-QRWLVFNGSA-N 0 3 405.336 4.259 20 0 HIADHN CC(C)N(CC(=O)N(Cc1cccs1)c1ccc2c(c1)OCCO2)CC1CC1 ZINC000533352147 931846768 /nfs/dbraw/zinc/84/67/68/931846768.db2.gz LQWMBLIYWUPELN-UHFFFAOYSA-N 0 3 400.544 4.173 20 0 HIADHN Cc1cccc(NC(=O)[C@@H]2CCCN(Cc3cccc(OCC(F)(F)F)c3)C2)n1 ZINC000533354674 931847397 /nfs/dbraw/zinc/84/73/97/931847397.db2.gz NBHTZFDQTWDLKQ-QGZVFWFLSA-N 0 3 407.436 4.182 20 0 HIADHN COc1ccc(OC)c([C@@H](C)NC(=O)CN[C@H](c2ccc(F)cc2)C2CCC2)c1 ZINC000533376617 931853150 /nfs/dbraw/zinc/85/31/50/931853150.db2.gz GLBOFSVPSJYBEF-CMJOXMDJSA-N 0 3 400.494 4.151 20 0 HIADHN CCOc1ccc(OCCN2CCC(C(=O)N(Cc3ccccc3)C3CC3)CC2)cc1 ZINC000533395486 931856562 /nfs/dbraw/zinc/85/65/62/931856562.db2.gz ZINMBUUOZHTBRH-UHFFFAOYSA-N 0 3 422.569 4.367 20 0 HIADHN COc1ccc(C(=O)C2CCN(C[C@@H](O)Cc3ccc(C(F)(F)F)cc3)CC2)cc1 ZINC000533464006 931876102 /nfs/dbraw/zinc/87/61/02/931876102.db2.gz YBOLJYBMKWJEJH-FQEVSTJZSA-N 0 3 421.459 4.212 20 0 HIADHN COc1ccc([C@H](Cc2ccccc2C)NCc2cnc3cnccn23)cc1OC ZINC000533466594 931876493 /nfs/dbraw/zinc/87/64/93/931876493.db2.gz YCOSHXRWFOXAQO-NRFANRHFSA-N 0 3 402.498 4.129 20 0 HIADHN O=C(NC1CCN(CCc2nc(-c3ccc(Cl)cc3)no2)CC1)C1CCCCC1 ZINC000533480516 931879881 /nfs/dbraw/zinc/87/98/81/931879881.db2.gz NCSQBZZDLBNPMN-UHFFFAOYSA-N 0 3 416.953 4.093 20 0 HIADHN O=C(Nc1ccccc1Br)C1CCN(CCOc2ccccc2F)CC1 ZINC000533509298 931889280 /nfs/dbraw/zinc/88/92/80/931889280.db2.gz ZPZQANBKBSWXAL-UHFFFAOYSA-N 0 3 421.310 4.318 20 0 HIADHN C[C@H](c1cccc(O)c1)N(C)C[C@@H](O)COc1ccc(Cl)cc1Br ZINC000533514354 931891061 /nfs/dbraw/zinc/89/10/61/931891061.db2.gz MLKGYGSRMGYZOV-MLGOLLRUSA-N 0 3 414.727 4.241 20 0 HIADHN CC(=O)Nc1ccc(OC[C@H](O)CN2CCCC[C@H]2c2cc3ccccc3[nH]2)cc1 ZINC000533521389 931892906 /nfs/dbraw/zinc/89/29/06/931892906.db2.gz CSSLRKOCCQNPML-YKSBVNFPSA-N 0 3 407.514 4.093 20 0 HIADHN O=C(CN[C@H](c1ccccc1)C1CCCC1)N1CCC(C(=O)Nc2ccccc2)CC1 ZINC000533523094 931893926 /nfs/dbraw/zinc/89/39/26/931893926.db2.gz KHDZMEXBFYZLRA-RUZDIDTESA-N 0 3 419.569 4.385 20 0 HIADHN COc1cc(N[C@@H]2CCCN(Cc3ccc(OC(F)F)c(OC)c3)C2)cc(OC)c1 ZINC000533536617 931896809 /nfs/dbraw/zinc/89/68/09/931896809.db2.gz LELWGGGZVBONFP-MRXNPFEDSA-N 0 3 422.472 4.390 20 0 HIADHN O=C1c2ccccc2C(=O)N1[C@H]1CCCC[C@@H](NCc2csc(-c3ccco3)n2)C1 ZINC000533547943 931898303 /nfs/dbraw/zinc/89/83/03/931898303.db2.gz HGOHUCBIOSSNQK-WBVHZDCISA-N 0 3 421.522 4.490 20 0 HIADHN CCc1ccc([C@H](CNC(=O)c2ccc(OC)c(-c3ccccn3)c2)N(C)C)cc1 ZINC000533660702 931954456 /nfs/dbraw/zinc/95/44/56/931954456.db2.gz RRVJXXVXFOCCHW-QHCPKHFHSA-N 0 3 403.526 4.352 20 0 HIADHN CN1CC[C@@H](NC(=O)c2cccc(CN3CCCC3)c2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000533682660 931968350 /nfs/dbraw/zinc/96/83/50/931968350.db2.gz KWDYLXYOKRWHNL-FGZHOGPDSA-N 0 3 415.940 4.250 20 0 HIADHN Cc1nc2ccccc2n1C[C@H]1CCCN1C(=O)c1cccc(CN2CCCC2)c1 ZINC000533749812 932007447 /nfs/dbraw/zinc/00/74/47/932007447.db2.gz ROMCWYMISLXIRZ-JOCHJYFZSA-N 0 3 402.542 4.245 20 0 HIADHN Cc1nc2ccccc2n1C[C@@H]1CCCN1CC(=O)N(C)[C@H](C)c1ccc(F)cc1 ZINC000533760787 932016501 /nfs/dbraw/zinc/01/65/01/932016501.db2.gz HDJKJDNTFXOEIM-UTKZUKDTSA-N 0 3 408.521 4.168 20 0 HIADHN C[C@H](NC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1)c1ccc(OCC(F)(F)F)cc1 ZINC000533891455 932084542 /nfs/dbraw/zinc/08/45/42/932084542.db2.gz QKYRZTNPSXBVOY-RYGJVYDSSA-N 0 3 421.463 4.433 20 0 HIADHN CN1CC[C@@H](NC(=O)NCCc2nc3cc(Cl)ccc3s2)[C@H]1c1ccccc1 ZINC000533913787 932096362 /nfs/dbraw/zinc/09/63/62/932096362.db2.gz XLNXCOGDWRPYRO-OXQOHEQNSA-N 0 3 414.962 4.237 20 0 HIADHN Cc1nc(-c2ccc(CNC(=O)N[C@H]3CCN(C)[C@@H]3c3ccccc3)cc2)cs1 ZINC000533945623 932118627 /nfs/dbraw/zinc/11/86/27/932118627.db2.gz SBSNOAOLUMUBPO-RBBKRZOGSA-N 0 3 406.555 4.363 20 0 HIADHN CN1CC[C@@H](NC(=O)N2CCC(Oc3ccccc3Cl)CC2)[C@H]1c1ccccc1 ZINC000533983671 932160064 /nfs/dbraw/zinc/16/00/64/932160064.db2.gz HDEKRAZYCFHTFF-IFMALSPDSA-N 0 3 413.949 4.338 20 0 HIADHN CN1CC[C@H](NC(=O)CCCc2nc(-c3ccc(Cl)cc3)no2)[C@@H]1c1ccccc1 ZINC000534018155 932199973 /nfs/dbraw/zinc/19/99/73/932199973.db2.gz AZHGJKHNISDHMU-UGKGYDQZSA-N 0 3 424.932 4.274 20 0 HIADHN CN1CC[C@H](NC(=O)c2cccc(-n3nccc3C(F)(F)F)c2)[C@@H]1c1ccccc1 ZINC000534018415 932200028 /nfs/dbraw/zinc/20/00/28/932200028.db2.gz DENPDOCUBAGLAA-ICSRJNTNSA-N 0 3 414.431 4.066 20 0 HIADHN CN(C)C(=O)c1cccc(CCN[C@@H]2CCc3c2c(Br)ccc3F)c1 ZINC000534058930 932238314 /nfs/dbraw/zinc/23/83/14/932238314.db2.gz JGJLHWVULAEIEK-GOSISDBHSA-N 0 3 405.311 4.110 20 0 HIADHN CCN1CC[C@H](N(C)C(=O)Nc2ccc(Cl)cc2C(=O)c2ccc[nH]2)[C@@H](C)C1 ZINC000534213812 932335892 /nfs/dbraw/zinc/33/58/92/932335892.db2.gz YXQPRFSHGBFZKI-LIRRHRJNSA-N 0 3 402.926 4.093 20 0 HIADHN COc1ccc(-c2nnc(NC(=O)[C@@H]3CCCN(Cc4ccccc4)C3)s2)cc1 ZINC000534238037 932357438 /nfs/dbraw/zinc/35/74/38/932357438.db2.gz AXTVKOCLXGWPMU-GOSISDBHSA-N 0 3 408.527 4.064 20 0 HIADHN CC(C)N1CCN([C@H]2CCN(C(=O)c3ccccc3NCCC3=CCCCC3)C2)CC1 ZINC000534278842 932374904 /nfs/dbraw/zinc/37/49/04/932374904.db2.gz GWOXVFOIDSNJQS-QHCPKHFHSA-N 0 3 424.633 4.230 20 0 HIADHN COc1cccc(-c2nc(C)c(C(=O)N3CCCN(Cc4ccccc4)C[C@@H]3C)[nH]2)c1 ZINC000534417018 932435168 /nfs/dbraw/zinc/43/51/68/932435168.db2.gz LPVPXGAMTSKBCG-SFHVURJKSA-N 0 3 418.541 4.130 20 0 HIADHN O=C([C@@H]1CC[C@@H]2CCCC[C@@H]2C1)N1CCC[C@H](CN2CCN(c3ccccn3)CC2)C1 ZINC000534426470 932443392 /nfs/dbraw/zinc/44/33/92/932443392.db2.gz MJAUGLKBEWLNRB-UEQSERJNSA-N 0 3 424.633 4.049 20 0 HIADHN CC(C)C1CCC(N2CCN(C(=O)N[C@H](C)c3ccc([S@@](C)=O)cc3)CC2)CC1 ZINC000534442507 932456515 /nfs/dbraw/zinc/45/65/15/932456515.db2.gz OJBQNZRTYAWREM-HBDKSTKBSA-N 0 3 419.635 4.027 20 0 HIADHN COC(=O)CCSc1cccc(NC(=O)N2CCN(CC3CCCCC3)CC2)c1 ZINC000534484222 932521081 /nfs/dbraw/zinc/52/10/81/932521081.db2.gz KXUFKFLFXWDTAH-UHFFFAOYSA-N 0 3 419.591 4.072 20 0 HIADHN CC[C@@H](NC(=O)NC[C@H](c1cccc(OC)c1)N(CC)CC)c1c(C)noc1C ZINC000534518430 932542407 /nfs/dbraw/zinc/54/24/07/932542407.db2.gz TUJQIHUBAZPRMZ-WOJBJXKFSA-N 0 3 402.539 4.133 20 0 HIADHN CN1CC[C@@H](NC(=O)NCc2ccc(COCC(F)(F)F)cc2)[C@H]1c1ccccc1 ZINC000534610361 932595687 /nfs/dbraw/zinc/59/56/87/932595687.db2.gz RHAUKHOAUKZEEW-WOJBJXKFSA-N 0 3 421.463 4.010 20 0 HIADHN CN(CCCc1cc(-c2ccccc2)no1)C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000534683118 932653559 /nfs/dbraw/zinc/65/35/59/932653559.db2.gz AEUDHQCQOPDVSU-ISKFKSNPSA-N 0 3 418.541 4.361 20 0 HIADHN CN1CC[C@@H](NC(=O)NCCc2csc(-c3ccccc3)n2)[C@H]1c1ccccc1 ZINC000534718238 932685818 /nfs/dbraw/zinc/68/58/18/932685818.db2.gz YHBRSGSDXUQCCF-NHCUHLMSSA-N 0 3 406.555 4.097 20 0 HIADHN Cc1nc(C)n(-c2ccccc2NC(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)n1 ZINC000534742451 932713548 /nfs/dbraw/zinc/71/35/48/932713548.db2.gz WTWUXCURQXJVTE-NRFANRHFSA-N 0 3 418.545 4.012 20 0 HIADHN CN1CC[C@H](NC(=O)CCCc2ccc(Br)s2)[C@@H]1c1ccccc1 ZINC000534752476 932727618 /nfs/dbraw/zinc/72/76/18/932727618.db2.gz BJDBHDBQBBCDCP-LPHOPBHVSA-N 0 3 407.377 4.395 20 0 HIADHN Cc1cc(C)c(CC(C(=O)N2CC[C@@H](C(N)=O)c3ccccc32)C(F)(F)F)c(C)c1 ZINC000534781255 932762106 /nfs/dbraw/zinc/76/21/06/932762106.db2.gz SPXGQMDBGRYTMJ-IEBWSBKVSA-N 0 3 418.459 4.339 20 0 HIADHN O[C@H](COc1ccc(-c2ccccc2)cc1)CN1CCC(Nc2ccccn2)CC1 ZINC000534862455 932812556 /nfs/dbraw/zinc/81/25/56/932812556.db2.gz JFJINUNZCBKCPG-QHCPKHFHSA-N 0 3 403.526 4.065 20 0 HIADHN C[C@H](C(=O)N1CCC[C@H]1CN1CCCCC1)c1cccc(C(=O)c2ccccc2)c1 ZINC000534874475 932817914 /nfs/dbraw/zinc/81/79/14/932817914.db2.gz DVNCWVMIRCQOAS-RDPSFJRHSA-N 0 3 404.554 4.498 20 0 HIADHN C[C@@H](C(=O)N1CCC[C@@H]1CN1CCCCC1)c1cccc(C(=O)c2ccccc2)c1 ZINC000534874474 932818115 /nfs/dbraw/zinc/81/81/15/932818115.db2.gz DVNCWVMIRCQOAS-HYBUGGRVSA-N 0 3 404.554 4.498 20 0 HIADHN CN(C)CCN(Cc1cccc(O)c1)C(=O)c1csc(-c2ccccc2Cl)n1 ZINC000534925403 932840985 /nfs/dbraw/zinc/84/09/85/932840985.db2.gz HMYCHBZKIVQDOO-UHFFFAOYSA-N 0 3 415.946 4.373 20 0 HIADHN C[C@@H](CCc1ccc(O)cc1)NC(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000534927948 932842759 /nfs/dbraw/zinc/84/27/59/932842759.db2.gz VQSDHSVADNUSKX-HTAPYJJXSA-N 0 3 420.475 4.284 20 0 HIADHN CN1CC[C@H](CNCc2nccn2CC(F)(F)F)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000534970658 932869335 /nfs/dbraw/zinc/86/93/35/932869335.db2.gz GSUGWGDBZKXHSQ-DYVFJYSZSA-N 0 3 404.839 4.021 20 0 HIADHN CC(C)NS(=O)(=O)Cc1ccccc1CN[C@@H]1CCCc2ccc(Cl)cc21 ZINC000534977814 932872779 /nfs/dbraw/zinc/87/27/79/932872779.db2.gz YZWRWCNRRONJJV-OAQYLSRUSA-N 0 3 406.979 4.335 20 0 HIADHN Cc1cc(C)c(CC(C(=O)Nc2ccc(CNC(N)=O)cc2)C(F)(F)F)c(C)c1 ZINC000535162227 932978457 /nfs/dbraw/zinc/97/84/57/932978457.db2.gz PSDOTYRXODWQJF-SFHVURJKSA-N 0 3 407.436 4.140 20 0 HIADHN CN(C)[C@H](CNC(=O)c1cc2cc(Br)ccc2o1)Cc1ccccc1 ZINC000535255519 933039209 /nfs/dbraw/zinc/03/92/09/933039209.db2.gz RYABRDWGDKGCGB-KRWDZBQOSA-N 0 3 401.304 4.098 20 0 HIADHN CN(C)[C@@H](CNC(=O)c1cccc(-c2noc(CC(C)(C)C)n2)c1)Cc1ccccc1 ZINC000535261638 933041438 /nfs/dbraw/zinc/04/14/38/933041438.db2.gz NHUSFEYNAFPNME-OAQYLSRUSA-N 0 3 420.557 4.228 20 0 HIADHN COCCSc1ccc([C@H](C)NC(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)cc1 ZINC000535364786 933094033 /nfs/dbraw/zinc/09/40/33/933094033.db2.gz MQKXMIUTTXPJGT-WTOYTKOKSA-N 0 3 413.587 4.231 20 0 HIADHN CCN(C(=O)c1ccnc(OCC(F)F)c1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000535368175 933096440 /nfs/dbraw/zinc/09/64/40/933096440.db2.gz UJQSTZCKQOHQDP-LPHOPBHVSA-N 0 3 403.473 4.023 20 0 HIADHN CN(CCCc1cc(-c2ccccc2)n[nH]1)C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000535396938 933114716 /nfs/dbraw/zinc/11/47/16/933114716.db2.gz RQGOSYHWSAHJBI-ISKFKSNPSA-N 0 3 417.557 4.096 20 0 HIADHN Cc1nc(-c2ccc(CNC(=O)N[C@@H]3CCN(C)[C@H]3c3ccccc3)s2)cs1 ZINC000535398518 933115552 /nfs/dbraw/zinc/11/55/52/933115552.db2.gz VGKLVPIYFOYICN-XLIONFOSSA-N 0 3 412.584 4.425 20 0 HIADHN CN1CC[C@H](NC(=O)NCc2ccnc(Oc3ccc(F)cc3)c2)[C@H]1c1ccccc1 ZINC000535432088 933131775 /nfs/dbraw/zinc/13/17/75/933131775.db2.gz HWHXGFHUHBQYPM-JTHBVZDNSA-N 0 3 420.488 4.258 20 0 HIADHN CN1CC[C@@H](NC(=O)N(Cc2ccccc2)CC2CCOCC2)[C@@H]1c1ccccc1 ZINC000535433621 933133324 /nfs/dbraw/zinc/13/33/24/933133324.db2.gz UWYRBDIVVVOBMG-RPWUZVMVSA-N 0 3 407.558 4.070 20 0 HIADHN OC[C@@H](Cc1c[nH]c2ccccc12)N[C@H]1CCc2c1c(Br)ccc2F ZINC000535508004 933201608 /nfs/dbraw/zinc/20/16/08/933201608.db2.gz KGBWPVHUMIFSDT-YJYMSZOUSA-N 0 3 403.295 4.250 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)NC[C@H](C)c2nc(-c3ccccc3)no2)N(C)C)cc1 ZINC000535520515 933211208 /nfs/dbraw/zinc/21/12/08/933211208.db2.gz QAJWJOARQOABNU-LAUBAEHRSA-N 0 3 421.545 4.005 20 0 HIADHN CC(C)Cn1ncc(NC(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)c1C(F)F ZINC000535535324 933227706 /nfs/dbraw/zinc/22/77/06/933227706.db2.gz LLSHIGKCQUCOQJ-QGZVFWFLSA-N 0 3 405.493 4.215 20 0 HIADHN CSc1cccc(N(C(=O)c2cnc([C@H]3CCCO3)s2)C2CCN(C)CC2)c1 ZINC000535541010 933233686 /nfs/dbraw/zinc/23/36/86/933233686.db2.gz AYGQLDREUOVASB-GOSISDBHSA-N 0 3 417.600 4.458 20 0 HIADHN CN(C)CCN(Cc1cccc(O)c1)C(=O)[C@H]1C[C@H]1c1ccccc1C(F)(F)F ZINC000535640208 933280363 /nfs/dbraw/zinc/28/03/63/933280363.db2.gz SEYVJDPJXJJCSK-OALUTQOASA-N 0 3 406.448 4.105 20 0 HIADHN O=C1[C@H](NCc2cccc(COCc3ccco3)c2)CCCN1c1ccccc1F ZINC000535709205 933363843 /nfs/dbraw/zinc/36/38/43/933363843.db2.gz HXQZGYKQUCHXTP-JOCHJYFZSA-N 0 3 408.473 4.421 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)C(=O)N[C@@H]1CCCc2ccc(C(C)C)cc21 ZINC000535711233 933365206 /nfs/dbraw/zinc/36/52/06/933365206.db2.gz NXAOTFBFPIUUJZ-OAQYLSRUSA-N 0 3 423.557 4.013 20 0 HIADHN COc1c(Br)cc(CN(C)C[C@H]2CCCCO2)cc1Br ZINC000535830334 933420976 /nfs/dbraw/zinc/42/09/76/933420976.db2.gz AFVHNWULIXBSPF-GFCCVEGCSA-N 0 3 407.146 4.221 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(CN3CC[C@@H](C)[C@@H](n4ccnc4)C3)c2)cc1 ZINC000535850004 933432923 /nfs/dbraw/zinc/43/29/23/933432923.db2.gz CCEYMGCFKFECBT-JPYJTQIMSA-N 0 3 404.514 4.227 20 0 HIADHN C[C@H](C(=O)Nc1ccc2c(c1)OC1(CCCCC1)O2)N1CC[C@H](C2CCOCC2)C1 ZINC000535871355 933453773 /nfs/dbraw/zinc/45/37/73/933453773.db2.gz SQMJTQWBTZPLMJ-MJGOQNOKSA-N 0 3 414.546 4.194 20 0 HIADHN CCN(CC)[C@H](CNC(=O)[C@@H](C)C1CCOCC1)c1ccc(C(F)(F)F)cc1 ZINC000535882840 933463682 /nfs/dbraw/zinc/46/36/82/933463682.db2.gz LRNIKBBBIKXCGX-HNAYVOBHSA-N 0 3 400.485 4.267 20 0 HIADHN FC(F)(F)c1ccc(CN2CC[C@@H](NCc3cnc([C@H]4CCCO4)s3)C2)cc1 ZINC000535944723 933511333 /nfs/dbraw/zinc/51/13/33/933511333.db2.gz VPTJOKHCQQXCGT-SJLPKXTDSA-N 0 3 411.493 4.378 20 0 HIADHN CN(C)c1ccc(C(F)(F)F)cc1NC(=O)NC[C@H](Cc1ccccc1)N(C)C ZINC000536012674 933571485 /nfs/dbraw/zinc/57/14/85/933571485.db2.gz IHBUAZILMVZBTR-KRWDZBQOSA-N 0 3 408.468 4.066 20 0 HIADHN CN1CC[C@H](NC(=O)NCc2cccc(COCc3ccco3)c2)[C@H]1c1ccccc1 ZINC000536094045 933644077 /nfs/dbraw/zinc/64/40/77/933644077.db2.gz CMXIAZOORNQSPC-BJKOFHAPSA-N 0 3 419.525 4.241 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCC[C@@H]1[C@@H]1C[C@H](C)CC[C@@H]1O)c1ccsc1 ZINC000537305496 933706823 /nfs/dbraw/zinc/70/68/23/933706823.db2.gz VWPAVGDTINIMSH-PPQDBTBKSA-N 0 3 407.624 4.102 20 0 HIADHN CSc1ccc([C@@H](CNC(=O)Cc2ccc(Br)cc2)N(C)C)cc1 ZINC000562890549 945140770 /nfs/dbraw/zinc/14/07/70/945140770.db2.gz XMRJWLCSQJSBHM-GOSISDBHSA-N 0 3 407.377 4.133 20 0 HIADHN c1sc(-c2ncccn2)nc1CN1CCC[C@H](c2n[nH]c(C3CCCCC3)n2)C1 ZINC000537559932 938323959 /nfs/dbraw/zinc/32/39/59/938323959.db2.gz AMEYUVHDYSZQIY-INIZCTEOSA-N 0 3 409.563 4.146 20 0 HIADHN COc1ccc(NC(=O)[C@H](C)N2CCC[C@H](c3n[nH]c(C4CCCCC4)n3)C2)cc1 ZINC000537561599 938324945 /nfs/dbraw/zinc/32/49/45/938324945.db2.gz HFDIGUFZGKVVNJ-WMZOPIPTSA-N 0 3 411.550 4.068 20 0 HIADHN Cc1cc(NC(=O)NC/C=C/c2ccccc2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000537584954 938329083 /nfs/dbraw/zinc/32/90/83/938329083.db2.gz PIMAEIHTYFRDNQ-NWMLYGLHSA-N 0 3 415.541 4.473 20 0 HIADHN CNC(=O)CC1CCN(Cc2cn(-c3ccc(F)cc3)nc2-c2cccc(C)c2)CC1 ZINC000537616062 938334213 /nfs/dbraw/zinc/33/42/13/938334213.db2.gz URLRWEVDTLVRPQ-UHFFFAOYSA-N 0 3 420.532 4.335 20 0 HIADHN COCCCOC1CCN(Cc2cn(Cc3ccccc3)nc2-c2cccnc2)CC1 ZINC000537617339 938334989 /nfs/dbraw/zinc/33/49/89/938334989.db2.gz DGQCGJYPXMLEHX-UHFFFAOYSA-N 0 3 420.557 4.011 20 0 HIADHN Cc1nn(C)c(N2CCOCC2)c1CN1C[C@H](C)C[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000537620860 938336147 /nfs/dbraw/zinc/33/61/47/938336147.db2.gz YWPHFWCQZUCOBN-FOIQADDNSA-N 0 3 422.495 4.167 20 0 HIADHN COCC1(O)CCN(Cc2cn(Cc3ccccc3)nc2-c2ccc(C)c(C)c2)CC1 ZINC000537624218 938337885 /nfs/dbraw/zinc/33/78/85/938337885.db2.gz HEIZVJXEYMRKDP-UHFFFAOYSA-N 0 3 419.569 4.189 20 0 HIADHN CCc1nc2ccccc2n1C1CCN([C@H](C)C(=O)N2CCc3sccc3C2)CC1 ZINC000537856651 938391409 /nfs/dbraw/zinc/39/14/09/938391409.db2.gz HFKJPPZUOVQEGA-QGZVFWFLSA-N 0 3 422.598 4.271 20 0 HIADHN COc1cc(CN[C@@H](C)c2ccc(NS(C)(=O)=O)cc2)ccc1OC1CCCC1 ZINC000537918286 938412993 /nfs/dbraw/zinc/41/29/93/938412993.db2.gz JLNOOGIKPHCNCA-INIZCTEOSA-N 0 3 418.559 4.239 20 0 HIADHN CS[C@H]1CN(C(=O)c2ccc(COc3ccc4ccccc4c3)o2)C[C@@H]1N(C)C ZINC000537924070 938415548 /nfs/dbraw/zinc/41/55/48/938415548.db2.gz MUFCTVWZESOTAR-UNMCSNQZSA-N 0 3 410.539 4.129 20 0 HIADHN CC(C)C[C@@H](NCc1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1)c1ccccc1 ZINC000537939029 938424656 /nfs/dbraw/zinc/42/46/56/938424656.db2.gz ZUBLHWDUAOPTEP-JTHBVZDNSA-N 0 3 416.587 4.021 20 0 HIADHN Cc1cccc(NC(=O)C[C@H](C)N[C@H](CO)c2ccc(Br)cc2)c1C ZINC000537941877 938425797 /nfs/dbraw/zinc/42/57/97/938425797.db2.gz HLVCLVLJJMYZRM-IFXJQAMLSA-N 0 3 405.336 4.106 20 0 HIADHN COc1cc([C@H](C)N[C@@H](C)[C@@H](OC)c2ccc(Cl)cc2)ccc1S(C)(=O)=O ZINC000537969646 938439682 /nfs/dbraw/zinc/43/96/82/938439682.db2.gz JDFYKEFYSWPVRS-PJSUUKDQSA-N 0 3 411.951 4.179 20 0 HIADHN Cn1c2ccc(F)cc2nc1CCN[C@H]1CCc2c1c(Br)ccc2F ZINC000537972825 938441880 /nfs/dbraw/zinc/44/18/80/938441880.db2.gz DMSNOKWUCABECQ-HNNXBMFYSA-N 0 3 406.274 4.434 20 0 HIADHN C[C@@H](N[C@H]1CCN(CC(F)(F)F)C1=O)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000537976757 938444883 /nfs/dbraw/zinc/44/48/83/938444883.db2.gz IGCPROZKJMISDX-KUHUBIRLSA-N 0 3 410.411 4.219 20 0 HIADHN COC(=O)COc1cccc(CN[C@H](C)c2sc(Cc3ccccc3)nc2C)c1 ZINC000537981346 938446395 /nfs/dbraw/zinc/44/63/95/938446395.db2.gz HXIQTTNONRAHLY-MRXNPFEDSA-N 0 3 410.539 4.445 20 0 HIADHN COC(=O)COc1cccc(CN[C@H]2CCCc3ccc(Br)cc32)c1 ZINC000537983940 938448208 /nfs/dbraw/zinc/44/82/08/938448208.db2.gz DRYGCWFDRYVBKJ-IBGZPJMESA-N 0 3 404.304 4.168 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(Cl)cc2)CC1)[C@H]1C[C@H]1c1ccc(F)cc1 ZINC000537987333 938450143 /nfs/dbraw/zinc/45/01/43/938450143.db2.gz NSVRTZUVWDNOKI-VXKWHMMOSA-N 0 3 416.924 4.242 20 0 HIADHN COc1cc(CN[C@H](C)c2cccc(C(F)(F)F)c2)ccc1OCC(=O)N(C)C ZINC000537990772 938452132 /nfs/dbraw/zinc/45/21/32/938452132.db2.gz JTXHSZAFMDDDHF-CQSZACIVSA-N 0 3 410.436 4.032 20 0 HIADHN Cc1cc(C)c2c(c1)[C@@H](N[C@H](C)c1ccc(S(=O)(=O)N(C)C)cc1)CCCO2 ZINC000537990710 938452495 /nfs/dbraw/zinc/45/24/95/938452495.db2.gz KBAXKHAVXQDQFX-UTKZUKDTSA-N 0 3 402.560 4.118 20 0 HIADHN COc1ccc(C[C@@H](NCCc2ncn(C)n2)c2cc(Cl)ccc2Cl)cc1 ZINC000538020417 938465882 /nfs/dbraw/zinc/46/58/82/938465882.db2.gz FPIOMIOGJXUGCK-LJQANCHMSA-N 0 3 405.329 4.247 20 0 HIADHN CCN1CCCN(C(=O)Nc2ccc(-c3nc4cc(F)ccc4n3C)cc2C)CC1 ZINC000538046666 938480683 /nfs/dbraw/zinc/48/06/83/938480683.db2.gz ZWMGXEHNQDXGDB-UHFFFAOYSA-N 0 3 409.509 4.247 20 0 HIADHN COc1ccc(CN(C(=O)NC[C@@H]2CCCCN2C2CC2)[C@H](C)C2CC2)c(OC)c1 ZINC000563320634 945179421 /nfs/dbraw/zinc/17/94/21/945179421.db2.gz QNSJWJBCIRUHLX-UTKZUKDTSA-N 0 3 415.578 4.031 20 0 HIADHN CCN(c1ccccc1)c1ccc(CN[C@@H](C)c2ccc(S(N)(=O)=O)cc2)cc1 ZINC000538118064 938506782 /nfs/dbraw/zinc/50/67/82/938506782.db2.gz QIXFXVADKXAJKV-SFHVURJKSA-N 0 3 409.555 4.343 20 0 HIADHN CCN(c1ccccc1)c1ccc(CN[C@H](C)c2ccc(S(N)(=O)=O)cc2)cc1 ZINC000538118063 938506808 /nfs/dbraw/zinc/50/68/08/938506808.db2.gz QIXFXVADKXAJKV-GOSISDBHSA-N 0 3 409.555 4.343 20 0 HIADHN CCC(=O)Nc1ccc(S(=O)(=O)[N-]c2ccc(C[N@@H+]3CCC[C@@H](C)C3)cc2)cc1 ZINC000538132875 938516124 /nfs/dbraw/zinc/51/61/24/938516124.db2.gz UBKQLJZKQIOZCN-QGZVFWFLSA-N 0 3 415.559 4.068 20 0 HIADHN CCC(=O)Nc1ccc(S(=O)(=O)[N-]c2ccc(C[N@H+]3CCC[C@@H](C)C3)cc2)cc1 ZINC000538132875 938516127 /nfs/dbraw/zinc/51/61/27/938516127.db2.gz UBKQLJZKQIOZCN-QGZVFWFLSA-N 0 3 415.559 4.068 20 0 HIADHN COc1cc2c(cc1F)CC[C@@H]2N[C@@H]1CCCN([C@H](C)c2ccccc2F)C1=O ZINC000563325408 945181986 /nfs/dbraw/zinc/18/19/86/945181986.db2.gz HUIPFOQMEWPRPT-PUCZYUMASA-N 0 3 400.469 4.303 20 0 HIADHN Cc1cc(N2CCCC2)ccc1NC(=O)CN[C@@H](C)c1ccccc1-n1cccn1 ZINC000538158487 938528266 /nfs/dbraw/zinc/52/82/66/938528266.db2.gz BWXMECKDJIRCIB-IBGZPJMESA-N 0 3 403.530 4.070 20 0 HIADHN CCC[C@@H](NCC(=O)Nc1ccc(C(=O)N(C)C)cc1)c1cccc(C(F)(F)F)c1 ZINC000538161250 938530273 /nfs/dbraw/zinc/53/02/73/938530273.db2.gz LWQSCCHAKVUCGS-LJQANCHMSA-N 0 3 421.463 4.477 20 0 HIADHN Nc1ccc(F)c(NC(=O)CCN[C@@H](COc2ccccc2F)c2ccccc2)c1 ZINC000538165407 938531780 /nfs/dbraw/zinc/53/17/80/938531780.db2.gz IWEGEIBQJOANBN-NRFANRHFSA-N 0 3 411.452 4.286 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)N(C)Cc1c(F)cccc1Cl)c1cccc(-n2cccn2)c1 ZINC000538187373 938543858 /nfs/dbraw/zinc/54/38/58/938543858.db2.gz HBYRMTBQXZYGNC-CVEARBPZSA-N 0 3 414.912 4.363 20 0 HIADHN Clc1ccc2c(c1)OCCC[C@@H]2NCc1cccc(OCCN2CCOCC2)c1 ZINC000538206207 938554398 /nfs/dbraw/zinc/55/43/98/938554398.db2.gz HYLVYIYDMCVKAH-QFIPXVFZSA-N 0 3 416.949 4.055 20 0 HIADHN O=C(CN[C@H](c1ccc(Cl)cc1)C1CCC1)NC[C@H]1CCN(c2ccccc2)C1 ZINC000538206641 938554896 /nfs/dbraw/zinc/55/48/96/938554896.db2.gz PXAPCBVPUXPSMU-KOSHJBKYSA-N 0 3 411.977 4.414 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(-c2cccnc2)cc1)C(=O)Nc1ccc2c(c1)OCCO2 ZINC000538223519 938563325 /nfs/dbraw/zinc/56/33/25/938563325.db2.gz PFOCNKFXURBSGB-IRXDYDNUSA-N 0 3 403.482 4.198 20 0 HIADHN CCNC(=O)c1cccc(NC(=O)CN[C@@H](c2ccc(C(F)(F)F)cc2)C(C)C)c1 ZINC000538223564 938563346 /nfs/dbraw/zinc/56/33/46/938563346.db2.gz SFVHBQWDURSINL-HXUWFJFHSA-N 0 3 421.463 4.381 20 0 HIADHN COc1cc(NC(=O)CN[C@@H](c2cccc(F)c2)C2CCCC2)cc(OC)c1OC ZINC000538232347 938567436 /nfs/dbraw/zinc/56/74/36/938567436.db2.gz ALFWQHOQMVWKGA-JOCHJYFZSA-N 0 3 416.493 4.311 20 0 HIADHN CN(Cc1ccc(OC(F)F)cc1)C(=O)CN[C@H](C[C@H]1CCOC1)c1ccccc1 ZINC000538233429 938568052 /nfs/dbraw/zinc/56/80/52/938568052.db2.gz MAHIHKSJEAWFKA-WIYYLYMNSA-N 0 3 418.484 4.004 20 0 HIADHN CS(=O)(=O)c1ccc(OCCN[C@H](Cc2ccccc2)c2ccccc2F)cc1 ZINC000538257020 938576284 /nfs/dbraw/zinc/57/62/84/938576284.db2.gz GGSGOESLCJDIPE-HSZRJFAPSA-N 0 3 413.514 4.182 20 0 HIADHN O=S(=O)(CCN[C@H](c1cccs1)C1CC1)c1ccc(Br)cc1 ZINC000538269288 938579879 /nfs/dbraw/zinc/57/98/79/938579879.db2.gz YKKFAVGWPVGIAB-INIZCTEOSA-N 0 3 400.363 4.025 20 0 HIADHN C[C@@H](NCC(=O)Nc1ccnn1CC1CCCCC1)c1cccc(N2CCCC2)c1 ZINC000538277553 938581574 /nfs/dbraw/zinc/58/15/74/938581574.db2.gz VBKBMIVPKYJFLK-LJQANCHMSA-N 0 3 409.578 4.353 20 0 HIADHN C[C@@H](CCCc1ccccc1)C(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000538287818 938583607 /nfs/dbraw/zinc/58/36/07/938583607.db2.gz ROQVJVBZGNXHIH-FDFHNCONSA-N 0 3 400.607 4.383 20 0 HIADHN Cn1ccnc1[C@@H](NCCSCCOc1cccc(Br)c1)C1CC1 ZINC000538299719 938587125 /nfs/dbraw/zinc/58/71/25/938587125.db2.gz PEKRBTARNSRZBG-KRWDZBQOSA-N 0 3 410.381 4.036 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)c1ccc(-c2noc(C(F)F)n2)cc1 ZINC000538345333 938599180 /nfs/dbraw/zinc/59/91/80/938599180.db2.gz MRKIPLCQKJDZHY-UHFFFAOYSA-N 0 3 418.419 4.017 20 0 HIADHN CCN(C[C@@H]1CCN(CCc2cc(Cl)c3c(c2)OCCCO3)C1)CC(F)(F)F ZINC000538354371 938601878 /nfs/dbraw/zinc/60/18/78/938601878.db2.gz WAPWFGIYVVJEBO-INIZCTEOSA-N 0 3 420.903 4.250 20 0 HIADHN CCOC(=O)C1CCN(C(=O)[C@H](C)N[C@H](c2ccc(CC(C)C)cc2)C2CC2)CC1 ZINC000538390531 938609438 /nfs/dbraw/zinc/60/94/38/938609438.db2.gz SBEHCVZPILIDAG-FDDCHVKYSA-N 0 3 414.590 4.116 20 0 HIADHN CCN1CCN(c2ccc(N[C@H](C)c3cccc(N4CCCC4=O)c3)c(C)c2)CC1 ZINC000538508512 938638266 /nfs/dbraw/zinc/63/82/66/938638266.db2.gz PQNJDWCVGFCMEB-HXUWFJFHSA-N 0 3 406.574 4.437 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCc2cc(OC)c(F)cc2C1)c1ccsc1 ZINC000538517114 938639669 /nfs/dbraw/zinc/63/96/69/938639669.db2.gz IKVDXBAHKZKORK-LJQANCHMSA-N 0 3 405.539 4.047 20 0 HIADHN CCNC(=O)C(C)(C)CN[C@@H](C)c1ccc(Br)cc1Br ZINC000538558178 938648871 /nfs/dbraw/zinc/64/88/71/938648871.db2.gz YXCNJFUHEZFNFA-JTQLQIEISA-N 0 3 406.162 4.025 20 0 HIADHN Cc1cc(C(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)nn1[C@H](C)C1CC1 ZINC000538565719 938650906 /nfs/dbraw/zinc/65/09/06/938650906.db2.gz CSXORDUNNYCUBL-NQIIRXRSSA-N 0 3 418.545 4.058 20 0 HIADHN CCOC(=O)c1c2c(sc1NC(=O)[C@H](C)CCCOC)C(C)(C)NC(C)(C)C2 ZINC000538688238 938684391 /nfs/dbraw/zinc/68/43/91/938684391.db2.gz HQVSKSWJZNZAKF-CYBMUJFWSA-N 0 3 410.580 4.085 20 0 HIADHN COCC1(O)CCN(Cc2cccc(NC(=O)c3ccc(Cl)cc3Cl)c2)CC1 ZINC000538728957 938694520 /nfs/dbraw/zinc/69/45/20/938694520.db2.gz IMNVCLNPTUFXBI-UHFFFAOYSA-N 0 3 423.340 4.219 20 0 HIADHN CN(Cc1c[nH]nc1-c1ccc(Cl)cc1)C[C@@H](c1cccs1)N1CCOCC1 ZINC000538734318 938696606 /nfs/dbraw/zinc/69/66/06/938696606.db2.gz QXSOQJYBEOPSSY-IBGZPJMESA-N 0 3 416.978 4.297 20 0 HIADHN Cc1nn(Cc2ccc(C)cc2)c(C)c1CN1CCC(OC[C@H]2CCCCO2)CC1 ZINC000538764044 938705186 /nfs/dbraw/zinc/70/51/86/938705186.db2.gz JTDZUCCLFWGBPY-XMMPIXPASA-N 0 3 411.590 4.407 20 0 HIADHN COCCc1nc(C)c([C@H](C)NCc2ccc(CN3C[C@@H](C)O[C@H](C)C3)cc2)s1 ZINC000538867700 938728226 /nfs/dbraw/zinc/72/82/26/938728226.db2.gz PFXTXNFIXDWDED-KURKYZTESA-N 0 3 417.619 4.100 20 0 HIADHN COCCn1ccc2ccc(NC(=O)N(CCN(C)C)Cc3cccc(F)c3)cc21 ZINC000538902825 938734175 /nfs/dbraw/zinc/73/41/75/938734175.db2.gz JLIVBVWUGFBVOL-UHFFFAOYSA-N 0 3 412.509 4.023 20 0 HIADHN O=C([C@@H]1CC12CCN(Cc1ccccc1Oc1cccnc1)CC2)N1CCCCC1 ZINC000538905583 938735141 /nfs/dbraw/zinc/73/51/41/938735141.db2.gz BGOMSMRFEWRZGQ-QFIPXVFZSA-N 0 3 405.542 4.489 20 0 HIADHN COCCn1ccc2ccc(NC(=O)N[C@H]3CCN([C@H](C)c4ccccc4)C3)cc21 ZINC000538906472 938735420 /nfs/dbraw/zinc/73/54/20/938735420.db2.gz ODRAIJNBRBMNER-GCJKJVERSA-N 0 3 406.530 4.245 20 0 HIADHN CN(C)CCN(C(=O)c1cc(OCC(F)(F)F)c2ccccc2n1)c1ccccc1 ZINC000538965329 938753172 /nfs/dbraw/zinc/75/31/72/938753172.db2.gz QKTGOJKUMGATGA-UHFFFAOYSA-N 0 3 417.431 4.384 20 0 HIADHN CC[C@H](N[C@@H](C)c1cc(OC)c(OC)cc1F)[C@H](c1ccc(C)cc1)n1cncn1 ZINC000539039431 938778109 /nfs/dbraw/zinc/77/81/09/938778109.db2.gz AWMCXZJQTDFKQK-GRWTVWFQSA-N 0 3 412.509 4.462 20 0 HIADHN COc1cc(CN[C@@H](C)c2ccc(-c3ccc(F)cc3)s2)ccc1OCC(N)=O ZINC000539040882 938778199 /nfs/dbraw/zinc/77/81/99/938778199.db2.gz VSLRXJOTYQFKBH-AWEZNQCLSA-N 0 3 414.502 4.278 20 0 HIADHN CC(C)c1ccc([C@@H](C)NCc2ccc(S(=O)(=O)NC[C@@H]3CCCO3)cc2)cc1 ZINC000539041334 938778828 /nfs/dbraw/zinc/77/88/28/938778828.db2.gz MAFJJDGZCIBRNQ-GCJKJVERSA-N 0 3 416.587 4.118 20 0 HIADHN COc1ccc([C@H](NC2CCN(Cc3ccccn3)CC2)c2ccccc2OC)cc1 ZINC000539041741 938778880 /nfs/dbraw/zinc/77/88/80/938778880.db2.gz QFLCOZFTXZQDDJ-SANMLTNESA-N 0 3 417.553 4.442 20 0 HIADHN CCCCOc1ccc([C@H](C)N[C@@H](C)Cn2ncc3ccccc3c2=O)cc1OC ZINC000539041707 938779058 /nfs/dbraw/zinc/77/90/58/938779058.db2.gz OHZXPCHSYSYKKC-ROUUACIJSA-N 0 3 409.530 4.323 20 0 HIADHN C[C@H](CN[C@@H](C)c1ccc(-n2cncn2)cc1Cl)c1nc(-c2ccccc2)no1 ZINC000539052047 938784131 /nfs/dbraw/zinc/78/41/31/938784131.db2.gz DUIHWIADVQTJAM-CABCVRRESA-N 0 3 408.893 4.425 20 0 HIADHN Ic1ccc2c(c1)[C@@H](NCc1ccc3c(c1)COC3)CCCO2 ZINC000539067601 938791532 /nfs/dbraw/zinc/79/15/32/938791532.db2.gz XPEZDPLEZLHRCO-SFHVURJKSA-N 0 3 421.278 4.325 20 0 HIADHN C[C@H](NCCOc1ccc(F)c(F)c1)c1ccc(S(=O)(=O)C2CCCC2)cc1 ZINC000539069374 938791833 /nfs/dbraw/zinc/79/18/33/938791833.db2.gz ZINHNYJBNOZRSG-HNNXBMFYSA-N 0 3 409.498 4.411 20 0 HIADHN C[C@@H](NCCOc1ccc(F)c(F)c1)c1ccc(S(=O)(=O)C2CCCC2)cc1 ZINC000539069375 938792512 /nfs/dbraw/zinc/79/25/12/938792512.db2.gz ZINHNYJBNOZRSG-OAHLLOKOSA-N 0 3 409.498 4.411 20 0 HIADHN COc1ccc(C[C@H](NC[C@H](O)[C@@H]2CCOC2)c2cc(Cl)ccc2Cl)cc1 ZINC000539073580 938794474 /nfs/dbraw/zinc/79/44/74/938794474.db2.gz OEIICTBKZRGBQA-NQERJWCQSA-N 0 3 410.341 4.273 20 0 HIADHN C[C@H](NC[C@H](c1cccc(Cl)c1)N1CCOCC1)c1nc2c(s1)CCCC2 ZINC000539081337 938798397 /nfs/dbraw/zinc/79/83/97/938798397.db2.gz ZSBZJHTUOWFMAT-HNAYVOBHSA-N 0 3 405.995 4.399 20 0 HIADHN Cc1c([C@H](C)NCCCc2nc(-c3ccncc3)cs2)nnn1-c1ccccc1 ZINC000539082871 938799050 /nfs/dbraw/zinc/79/90/50/938799050.db2.gz BZJCSWUHKPTNCL-INIZCTEOSA-N 0 3 404.543 4.378 20 0 HIADHN COc1cc(OC)cc(N2CC[C@H](N[C@@H](C)c3ccc(-c4ccncc4)cc3)C2=O)c1 ZINC000539085451 938799372 /nfs/dbraw/zinc/79/93/72/938799372.db2.gz OBBXPKZKUFBKRC-XDHUDOTRSA-N 0 3 417.509 4.222 20 0 HIADHN C[C@H](NCc1ccc(C(=O)N2C[C@@H](C)O[C@H](C)C2)cc1)c1cnc2ccsc2c1 ZINC000539089588 938800345 /nfs/dbraw/zinc/80/03/45/938800345.db2.gz AYYLGJBRXUBNEP-ZACQAIPSSA-N 0 3 409.555 4.397 20 0 HIADHN CCN(CC)C(=O)Nc1ccc([C@H](C)N[C@H]2C[C@@H](C)N(c3ccccc3)C2=O)cc1 ZINC000539090053 938800756 /nfs/dbraw/zinc/80/07/56/938800756.db2.gz YSNGKEYMHRLTKX-FGSXEWAUSA-N 0 3 408.546 4.405 20 0 HIADHN C[C@H](NCc1ccc(C(=O)N2CCCCC2)cc1)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000539091204 938800981 /nfs/dbraw/zinc/80/09/81/938800981.db2.gz VMDZVSNPBXREJG-KRWDZBQOSA-N 0 3 405.542 4.393 20 0 HIADHN C[C@@H](NCc1ccc(C(=O)N2CCCCC2)cc1)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000539091206 938801139 /nfs/dbraw/zinc/80/11/39/938801139.db2.gz VMDZVSNPBXREJG-QGZVFWFLSA-N 0 3 405.542 4.393 20 0 HIADHN Cc1c([C@H](C)NCc2ccc(Cn3ccccc3=O)cc2)cnn1-c1ccc(F)cc1 ZINC000539091920 938801314 /nfs/dbraw/zinc/80/13/14/938801314.db2.gz SVIMLBAKSPSOCR-SFHVURJKSA-N 0 3 416.500 4.381 20 0 HIADHN COc1ccc([C@@H](C)NCc2ccc(C(=O)N3C[C@@H](C)O[C@@H](C)C3)cc2)cc1Cl ZINC000539093455 938801725 /nfs/dbraw/zinc/80/17/25/938801725.db2.gz LQIIWYNMQRHLRT-IXDOHACOSA-N 0 3 416.949 4.449 20 0 HIADHN Fc1ccc(-c2nc(CN[C@H]3CCCOc4ccc(Br)cc43)n[nH]2)cc1 ZINC000539119549 938805357 /nfs/dbraw/zinc/80/53/57/938805357.db2.gz RGXQQAKMZFHXBY-INIZCTEOSA-N 0 3 417.282 4.377 20 0 HIADHN Cc1noc(C2CCC(N[C@H](C)c3nnn(-c4cccc(Cl)c4)c3C)CC2)n1 ZINC000539121645 938805987 /nfs/dbraw/zinc/80/59/87/938805987.db2.gz AJLZWTAMNYLDHG-OLJMKKDRSA-N 0 3 400.914 4.298 20 0 HIADHN CCCN1c2ccc(NC(=O)N[C@@H]3CCCN(Cc4ccccc4)C3)cc2CCC1=O ZINC000539132523 938808368 /nfs/dbraw/zinc/80/83/68/938808368.db2.gz TVPVZRHZNSCRBB-JOCHJYFZSA-N 0 3 420.557 4.162 20 0 HIADHN C[C@H](N[C@@H]1CCO[C@H]1c1ccc(Cl)c(F)c1)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000539195552 938818015 /nfs/dbraw/zinc/81/80/15/938818015.db2.gz BFBZZNJSRGPWHH-JVMOKEISSA-N 0 3 415.889 4.203 20 0 HIADHN CS(=O)(=O)Cc1cccc(CN[C@@H](c2ccc(Br)cc2)C2CC2)c1 ZINC000539201046 938818491 /nfs/dbraw/zinc/81/84/91/938818491.db2.gz LACNWVBSBSWKSL-LJQANCHMSA-N 0 3 408.361 4.235 20 0 HIADHN COc1cc(OC)c(CCN[C@H](C)c2nc3ccc(Cl)cc3n2C)c(OC)c1 ZINC000539201705 938818682 /nfs/dbraw/zinc/81/86/82/938818682.db2.gz DWGGBUOAXNTPRM-CYBMUJFWSA-N 0 3 403.910 4.146 20 0 HIADHN CC[C@@H](NCC(=O)N1CCC(C(=O)Nc2ccccc2)CC1)c1cccc(Cl)c1 ZINC000539245701 938824911 /nfs/dbraw/zinc/82/49/11/938824911.db2.gz FMQAZDOBNZLFRQ-OAQYLSRUSA-N 0 3 413.949 4.258 20 0 HIADHN Cc1ccc(S(=O)(=O)CCCN[C@H](C)c2cccc(OCc3ccccn3)c2)cc1 ZINC000539253438 938827068 /nfs/dbraw/zinc/82/70/68/938827068.db2.gz FFSCWTFRBSNYOO-HXUWFJFHSA-N 0 3 424.566 4.484 20 0 HIADHN COc1cc([C@H](C)N[C@@H]2CCCN(CC(F)(F)F)C2=O)ccc1OC1CCCC1 ZINC000539253922 938827173 /nfs/dbraw/zinc/82/71/73/938827173.db2.gz JCSPZHBOXMJILE-WMLDXEAASA-N 0 3 414.468 4.221 20 0 HIADHN C[C@H](NCC(=O)Nc1ccc2c(c1)OC1(CCCC1)O2)c1ccccc1-n1cccn1 ZINC000539263551 938829476 /nfs/dbraw/zinc/82/94/76/938829476.db2.gz YILHXRPNFZGRHF-KRWDZBQOSA-N 0 3 418.497 4.203 20 0 HIADHN Cc1ccccc1[C@@H](CC(C)C)NCC(=O)NCc1ccccc1CN1CCCC1=O ZINC000539262706 938829620 /nfs/dbraw/zinc/82/96/20/938829620.db2.gz MAZMETZKOIVJHC-XMMPIXPASA-N 0 3 421.585 4.111 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)Nc1cccc(Br)c1)c1cccc(-n2cccn2)c1 ZINC000539289060 938834209 /nfs/dbraw/zinc/83/42/09/938834209.db2.gz NSMMDUWKARQIQW-CABCVRRESA-N 0 3 413.319 4.313 20 0 HIADHN COC[C@H](NCc1ccc(CN2C[C@@H](C)O[C@@H](C)C2)cc1)c1ccc(F)c(F)c1 ZINC000539307812 938838295 /nfs/dbraw/zinc/83/82/95/938838295.db2.gz ALBJNBCGODYWGQ-MFEFFIJZSA-N 0 3 404.501 4.051 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@@H](C)NCc2nc3ccccc3nc2C)CC1 ZINC000539312014 938839309 /nfs/dbraw/zinc/83/93/09/938839309.db2.gz FQMQJZFHBRFFFT-QGZVFWFLSA-N 0 3 407.537 4.070 20 0 HIADHN COc1cc(C(C)=O)ccc1OC[C@@H](O)CN[C@H](c1ccccc1F)C1CCCC1 ZINC000539325699 938841595 /nfs/dbraw/zinc/84/15/95/938841595.db2.gz OXVHYWJECNRAJR-CYFREDJKSA-N 0 3 415.505 4.298 20 0 HIADHN O=C(CN[C@H](C[C@@H]1CCOC1)c1ccccc1)Nc1ccc(OC(F)(F)F)cc1 ZINC000539334870 938843844 /nfs/dbraw/zinc/84/38/44/938843844.db2.gz NPVZPLUJGLHAKJ-HNAYVOBHSA-N 0 3 408.420 4.281 20 0 HIADHN C[C@@H](NCC(=O)N1CCO[C@@H](c2ccc(F)cc2)C1)c1ccc(-c2ccncc2)cc1 ZINC000539336321 938844087 /nfs/dbraw/zinc/84/40/87/938844087.db2.gz HJGOQQLADOHREX-HOYKHHGWSA-N 0 3 419.500 4.138 20 0 HIADHN C[C@H](NCC(=O)N1CCO[C@@H](c2ccc(F)cc2)C1)c1ccc(-c2ccncc2)cc1 ZINC000539336324 938844136 /nfs/dbraw/zinc/84/41/36/938844136.db2.gz HJGOQQLADOHREX-MHECFPHRSA-N 0 3 419.500 4.138 20 0 HIADHN COc1ccc(NC(=O)[C@H](C)N[C@@H](C)c2ccc(-c3ccncc3)cc2)c(OC)c1 ZINC000539338430 938844565 /nfs/dbraw/zinc/84/45/65/938844565.db2.gz QKGPSFMVVYTJAK-IRXDYDNUSA-N 0 3 405.498 4.444 20 0 HIADHN C[C@H](NCC(=O)N1CC[C@H](C)Sc2ccccc21)c1ccc(-n2cccn2)cc1 ZINC000539338065 938844695 /nfs/dbraw/zinc/84/46/95/938844695.db2.gz ZJVXFQSVYBKJTD-ROUUACIJSA-N 0 3 406.555 4.440 20 0 HIADHN Cc1cccc([C@H](NCC(=O)N2CCC(NC(=O)c3ccccc3)CC2)C(C)(C)C)c1 ZINC000539342950 938845344 /nfs/dbraw/zinc/84/53/44/938845344.db2.gz SVKFQCJYWDUGTM-DEOSSOPVSA-N 0 3 421.585 4.093 20 0 HIADHN COc1ccc([C@H](CNCc2ccc(-c3ccncc3)cc2F)N2CCOCC2)cc1 ZINC000539415415 938857370 /nfs/dbraw/zinc/85/73/70/938857370.db2.gz GTWLQFLLRAJREL-VWLOTQADSA-N 0 3 421.516 4.059 20 0 HIADHN C[C@@H]1C[C@@H]1[C@@H](NCC(=O)Nc1ccccc1N1CCCC1=O)c1ccc(Cl)cc1 ZINC000539421133 938857870 /nfs/dbraw/zinc/85/78/70/938857870.db2.gz BGWSFAMAJSVMFU-TWWFPWMWSA-N 0 3 411.933 4.392 20 0 HIADHN Cc1cc([C@H](N[C@@H](C)C(=O)N[C@@H](C)c2ccc3c(c2)OCCO3)C2CC2)ccc1F ZINC000539421493 938858283 /nfs/dbraw/zinc/85/82/83/938858283.db2.gz CYAQALMCNBGYMG-PBPSECFOSA-N 0 3 412.505 4.212 20 0 HIADHN CC[C@@H](NCc1csc(-c2c(C)c(C)nn(C)c2=O)n1)C(C)(C)c1ccccc1 ZINC000539424892 938858610 /nfs/dbraw/zinc/85/86/10/938858610.db2.gz PQRCQTKVYYDQOW-LJQANCHMSA-N 0 3 410.587 4.367 20 0 HIADHN CCCN1CCC(N(C)C(=O)Nc2ccc(Cl)cc2C(=O)c2ccc[nH]2)CC1 ZINC000539453193 938862753 /nfs/dbraw/zinc/86/27/53/938862753.db2.gz OEZQPLHTZTYALS-UHFFFAOYSA-N 0 3 402.926 4.237 20 0 HIADHN C[C@@H](N[C@@H](c1ccc2c(c1)OCCO2)C1CC1)C(=O)Nc1ccc(F)cc1Cl ZINC000539492055 938867867 /nfs/dbraw/zinc/86/78/67/938867867.db2.gz XLGROWMQFJGHCK-MPBGBICISA-N 0 3 404.869 4.318 20 0 HIADHN COc1cccc2cc([C@@H](C)NCc3ccc(CS(=O)(=O)NC(C)C)cc3)oc21 ZINC000539499189 938869237 /nfs/dbraw/zinc/86/92/37/938869237.db2.gz CHPNURMAFVKYRF-MRXNPFEDSA-N 0 3 416.543 4.120 20 0 HIADHN CS(=O)(=O)[C@H]1CCC[C@H](NCc2cccc(NC(=O)c3ccc(Cl)cc3)c2)C1 ZINC000539520184 938872945 /nfs/dbraw/zinc/87/29/45/938872945.db2.gz XHNDHBOBWHMUTM-ICSRJNTNSA-N 0 3 420.962 4.038 20 0 HIADHN CCS(=O)(=O)c1ccc(N2CCC(N[C@H](C)c3cccc(F)c3F)CC2)cc1 ZINC000539544590 938877471 /nfs/dbraw/zinc/87/74/71/938877471.db2.gz HZBCKTFAUBNRAE-OAHLLOKOSA-N 0 3 408.514 4.078 20 0 HIADHN COC(=O)c1occc1CNc1cccc(N2CCN(CCc3ccccc3)CC2)c1 ZINC000539546055 938877688 /nfs/dbraw/zinc/87/76/88/938877688.db2.gz BVLINEMVKRKLCH-UHFFFAOYSA-N 0 3 419.525 4.043 20 0 HIADHN CC(C)c1cccc(-c2ccc(C(=O)N3CC[C@@H](N4CCN(C)CC4)[C@@H](C)C3)o2)c1 ZINC000539590333 938884390 /nfs/dbraw/zinc/88/43/90/938884390.db2.gz CELGBGMEKQHVRN-SIKLNZKXSA-N 0 3 409.574 4.168 20 0 HIADHN Fc1cccnc1N1CC[C@H](NCc2cc(Cl)ccc2OCc2cccnc2)C1 ZINC000539599672 938886075 /nfs/dbraw/zinc/88/60/75/938886075.db2.gz YJEAOYHKZLJPEC-IBGZPJMESA-N 0 3 412.896 4.217 20 0 HIADHN CC(C)[C@@H]1C[C@H](N[C@@H](c2ccc(F)cc2)c2cccc(S(C)(=O)=O)c2)CCO1 ZINC000539608537 938887558 /nfs/dbraw/zinc/88/75/58/938887558.db2.gz QTTCSDCJQZSOAB-HJNYFJLDSA-N 0 3 405.535 4.112 20 0 HIADHN COCc1cccc(CN[C@H]2CCCN(Cc3cccc(C(F)(F)F)c3)C2=O)c1 ZINC000539635353 938891421 /nfs/dbraw/zinc/89/14/21/938891421.db2.gz REUWAWUBVOCKAQ-FQEVSTJZSA-N 0 3 406.448 4.133 20 0 HIADHN COCCNC(=O)[C@H](CC(C)C)N[C@@H](C)c1sc(-c2ccccc2F)nc1C ZINC000539690486 938902937 /nfs/dbraw/zinc/90/29/37/938902937.db2.gz RGTJWUJQUVVESP-KSSFIOAISA-N 0 3 407.555 4.086 20 0 HIADHN Cc1nc([C@@H]2CCCN([C@@H](C)c3nnc(-c4ccc(Cl)cc4Cl)o3)C2)n[nH]1 ZINC000539765333 938929340 /nfs/dbraw/zinc/92/93/40/938929340.db2.gz FNIDZTKAMWCOJL-CMPLNLGQSA-N 0 3 407.305 4.411 20 0 HIADHN Cc1n[nH]c([C@@H]2CCCN([C@@H](C)c3nnc(-c4ccc(Cl)cc4Cl)o3)C2)n1 ZINC000539765333 938929349 /nfs/dbraw/zinc/92/93/49/938929349.db2.gz FNIDZTKAMWCOJL-CMPLNLGQSA-N 0 3 407.305 4.411 20 0 HIADHN Cc1nnc([C@@H]2CCCN([C@@H](C)c3nnc(-c4ccc(Cl)cc4Cl)o3)C2)[nH]1 ZINC000539765333 938929360 /nfs/dbraw/zinc/92/93/60/938929360.db2.gz FNIDZTKAMWCOJL-CMPLNLGQSA-N 0 3 407.305 4.411 20 0 HIADHN CS(=O)(=O)[C@@H]1CCC[C@H](N[C@H](c2ccccc2)c2ccc(OC(F)F)cc2)C1 ZINC000539813193 938940329 /nfs/dbraw/zinc/94/03/29/938940329.db2.gz SWJUARCZEPFQEK-DFQSSKMNSA-N 0 3 409.498 4.323 20 0 HIADHN CC(=O)Nc1ccc(CN2CCC(C(=O)N(Cc3ccccc3)C3CC3)CC2)cc1 ZINC000539837828 938953540 /nfs/dbraw/zinc/95/35/40/938953540.db2.gz GQZSFHKLYXZICV-UHFFFAOYSA-N 0 3 405.542 4.048 20 0 HIADHN CCO[C@@H]1C[C@@H](O)C12CCN(Cc1ccc(OC)c(OCc3ccccc3)c1)CC2 ZINC000539838490 938953646 /nfs/dbraw/zinc/95/36/46/938953646.db2.gz SHCSIHVGBQLVRK-DNQXCXABSA-N 0 3 411.542 4.026 20 0 HIADHN O=C1Nc2cc(Cl)ccc2[C@H]1C1CCN(Cc2c[nH]nc2-c2cccnc2)CC1 ZINC000539839464 938953793 /nfs/dbraw/zinc/95/37/93/938953793.db2.gz WGRXTUNGXKFRBL-HXUWFJFHSA-N 0 3 407.905 4.073 20 0 HIADHN COc1cc(N[C@@H]2CCCN(Cc3c(C)nn(C(C)(C)C)c3C)C2)cc(OC)c1 ZINC000539849203 938957013 /nfs/dbraw/zinc/95/70/13/938957013.db2.gz BYLHFHJNHLEZQS-GOSISDBHSA-N 0 3 400.567 4.349 20 0 HIADHN CCCN(CC(F)(F)F)C(=O)[C@@H]1CCCN(Cc2cnc(-c3ccccc3)[nH]2)C1 ZINC000539851291 938957761 /nfs/dbraw/zinc/95/77/61/938957761.db2.gz QGCPDAHRKXCSGN-QGZVFWFLSA-N 0 3 408.468 4.090 20 0 HIADHN Brc1ccc2c(c1)[C@@H](N1CCC[C@H](c3nnc4n3CCC4)C1)CCC2 ZINC000539882907 938965183 /nfs/dbraw/zinc/96/51/83/938965183.db2.gz YSCVAPXLIKCJOB-YJBOKZPZSA-N 0 3 401.352 4.244 20 0 HIADHN Cc1ccc(-n2cc(CNc3cc(C(N)=O)ccc3CN(C)C)c(C(C)(C)C)n2)cc1 ZINC000539932149 938978954 /nfs/dbraw/zinc/97/89/54/938978954.db2.gz PBSQNXFLXMRTCA-UHFFFAOYSA-N 0 3 419.573 4.251 20 0 HIADHN C[C@@H](NCc1cccnc1-n1cccn1)c1cccc(OCc2cn3ccccc3n2)c1 ZINC000539969223 938982328 /nfs/dbraw/zinc/98/23/28/938982328.db2.gz JFSVFXMXLJSYPW-LJQANCHMSA-N 0 3 424.508 4.345 20 0 HIADHN COCCc1nc(C)c([C@H](C)NC[C@H](O)COc2cccc(Cl)c2Cl)s1 ZINC000539968383 938982389 /nfs/dbraw/zinc/98/23/89/938982389.db2.gz SPKTZRSTJIRAPP-AAEUAGOBSA-N 0 3 419.374 4.038 20 0 HIADHN O=C(CCc1ccncc1)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1 ZINC000540022532 939041601 /nfs/dbraw/zinc/04/16/01/939041601.db2.gz CYCFIVDQRVOQKL-UHFFFAOYSA-N 0 3 414.553 4.018 20 0 HIADHN Cc1c(F)cccc1NC(=O)CCN1CC[C@@H](Oc2ccc(C(F)(F)F)cn2)C1 ZINC000540054943 939052225 /nfs/dbraw/zinc/05/22/25/939052225.db2.gz FBTOHNVMAOZNAY-OAHLLOKOSA-N 0 3 411.399 4.030 20 0 HIADHN CCc1nc2ccccc2n1C1CCN(C(=O)NC[C@H](c2ccccc2)N(C)C)CC1 ZINC000540057963 939053128 /nfs/dbraw/zinc/05/31/28/939053128.db2.gz ROTMCSHNPCPDMK-HSZRJFAPSA-N 0 3 419.573 4.248 20 0 HIADHN Cc1ccc(NC(=O)C[C@H](C)N[C@@H]2CC(=O)N(C)[C@H]2c2ccc(Cl)cc2)c(C)c1 ZINC000540162244 939097556 /nfs/dbraw/zinc/09/75/56/939097556.db2.gz GUPNUVKYGZOXJJ-YBVWCTEOSA-N 0 3 413.949 4.236 20 0 HIADHN COc1ccc(C[C@@H](N[C@@H]2CCN(C(C)=O)C2)c2cc(Cl)ccc2Cl)cc1 ZINC000540161717 939097581 /nfs/dbraw/zinc/09/75/81/939097581.db2.gz VJSFXDSTWGQKMA-DYESRHJHSA-N 0 3 407.341 4.496 20 0 HIADHN CCS(=O)(=O)Nc1ccc([C@@H](C)NCc2cc(Cl)c3c(c2)OCCCO3)cc1 ZINC000540173306 939103167 /nfs/dbraw/zinc/10/31/67/939103167.db2.gz MWVVAHHWQDPWKK-CQSZACIVSA-N 0 3 424.950 4.114 20 0 HIADHN COCCSc1ccc([C@H](C)N[C@H](C)c2cccc(NS(C)(=O)=O)c2)cc1 ZINC000540173670 939103617 /nfs/dbraw/zinc/10/36/17/939103617.db2.gz HOWUGHCGSZXWJZ-JKSUJKDBSA-N 0 3 408.589 4.208 20 0 HIADHN Cc1ccc(-c2nc3c(s2)[C@@H](N[C@H]2CCN(CC(F)(F)F)C2=O)CCC3)cc1 ZINC000540174630 939104498 /nfs/dbraw/zinc/10/44/98/939104498.db2.gz MQECGLQQRNASEG-HOCLYGCPSA-N 0 3 409.477 4.249 20 0 HIADHN COc1ccc([C@H](CN[C@H](C)c2ccccc2Br)N(C)C)cc1OC ZINC000540175538 939104922 /nfs/dbraw/zinc/10/49/22/939104922.db2.gz JXDLANMIOPPBBX-KDOFPFPSSA-N 0 3 407.352 4.420 20 0 HIADHN C[C@H]1C[C@H](NCc2cccc(NS(C)(=O)=O)c2)c2cccc(Br)c21 ZINC000540176392 939105618 /nfs/dbraw/zinc/10/56/18/939105618.db2.gz PCQMKPBTIVAUGJ-SJCJKPOMSA-N 0 3 409.349 4.159 20 0 HIADHN C[C@@H](NC1CCC(O)(C(F)(F)F)CC1)c1cc2c(cc1Br)OCCO2 ZINC000540188151 939113493 /nfs/dbraw/zinc/11/34/93/939113493.db2.gz BJVLHIZFHVWTFQ-VHTNMKBUSA-N 0 3 424.257 4.107 20 0 HIADHN C[C@H](NC1CCC(O)(C(F)(F)F)CC1)c1cc2c(cc1Br)OCCO2 ZINC000540188148 939113580 /nfs/dbraw/zinc/11/35/80/939113580.db2.gz BJVLHIZFHVWTFQ-SGWRBKMISA-N 0 3 424.257 4.107 20 0 HIADHN COc1cc(CN[C@H](C)c2ccc(Cl)c(Cl)c2)ccc1OCC(=O)N(C)C ZINC000540192406 939116922 /nfs/dbraw/zinc/11/69/22/939116922.db2.gz KRBIPHRVKJHXCW-CYBMUJFWSA-N 0 3 411.329 4.320 20 0 HIADHN CC(=O)Nc1cccc(CN[C@@H](C)CC(=O)Nc2ccc(OC(F)(F)F)cc2)c1 ZINC000540191909 939117250 /nfs/dbraw/zinc/11/72/50/939117250.db2.gz XBXGSEUSZQPWJV-ZDUSSCGKSA-N 0 3 409.408 4.051 20 0 HIADHN CNS(=O)(=O)c1ccc([C@@H](C)NCc2ccc(COc3ccccc3)cc2)cc1 ZINC000540191673 939117268 /nfs/dbraw/zinc/11/72/68/939117268.db2.gz PZFXWJVJKFGVGH-GOSISDBHSA-N 0 3 410.539 4.025 20 0 HIADHN CC(C)[C@@H](NCc1cccc(NC(=O)[C@@H]2CCCO2)c1)c1ccc2[nH]c(=O)oc2c1 ZINC000540302903 939187804 /nfs/dbraw/zinc/18/78/04/939187804.db2.gz VPOYEOTYWNHRMF-PZJWPPBQSA-N 0 3 409.486 4.138 20 0 HIADHN C[C@H](NCCN1c2cccc3cccc(c23)S1(=O)=O)c1cccc(OC(F)F)c1 ZINC000540319145 939192964 /nfs/dbraw/zinc/19/29/64/939192964.db2.gz KXNOUYISZCDOTK-AWEZNQCLSA-N 0 3 418.465 4.301 20 0 HIADHN CCn1c2ccccc2c2cc(NC(=O)[C@@H](C)N(C)CCCn3ccnc3)ccc21 ZINC000540321505 939193719 /nfs/dbraw/zinc/19/37/19/939193719.db2.gz UVQHVIXBRQNVCQ-GOSISDBHSA-N 0 3 403.530 4.360 20 0 HIADHN CCC[C@@H](NCC(=O)N1c2ccccc2NC(=O)C[C@@H]1C(F)(F)F)c1ccccc1 ZINC000540341831 939200295 /nfs/dbraw/zinc/20/02/95/939200295.db2.gz YFPOSKWCUHVMRA-VQIMIIECSA-N 0 3 419.447 4.424 20 0 HIADHN CCOc1ccc([C@@H]2CCCN2C(=O)CN[C@H](C)c2ccccc2-n2cccn2)cc1 ZINC000540359297 939208657 /nfs/dbraw/zinc/20/86/57/939208657.db2.gz HSPMEFFPJOWGII-XXBNENTESA-N 0 3 418.541 4.285 20 0 HIADHN C[C@@H](NCC(=O)N1CC[C@H](C)Sc2ccccc21)c1ccccc1-n1cccn1 ZINC000540361253 939209630 /nfs/dbraw/zinc/20/96/30/939209630.db2.gz UVBAOTTVTVUZAT-ZWKOTPCHSA-N 0 3 406.555 4.440 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(OCC(F)(F)F)cc1)C(=O)N(C)Cc1cccc(F)c1 ZINC000540361530 939210491 /nfs/dbraw/zinc/21/04/91/939210491.db2.gz IBTROCROJDMZRI-HUUCEWRRSA-N 0 3 412.427 4.465 20 0 HIADHN CC(C)(C)C[C@@H](NCC(=O)Nc1cc(-n2cnnn2)ccc1Cl)c1ccccc1 ZINC000540375294 939215279 /nfs/dbraw/zinc/21/52/79/939215279.db2.gz GGDUPZVUDGICSN-LJQANCHMSA-N 0 3 412.925 4.021 20 0 HIADHN C[C@@H](NCC(=O)N1CCC(Cc2ccccc2)CC1)c1cccc(-n2cccn2)c1 ZINC000540386159 939223579 /nfs/dbraw/zinc/22/35/79/939223579.db2.gz NPPXZOIXVCFDOW-HXUWFJFHSA-N 0 3 402.542 4.004 20 0 HIADHN C[C@H](NCC(=O)N(C)Cc1ccc(Cl)c(Cl)c1)c1cccc(-n2cccn2)c1 ZINC000540388650 939225436 /nfs/dbraw/zinc/22/54/36/939225436.db2.gz SFXQTOFRAAHQMW-HNNXBMFYSA-N 0 3 417.340 4.488 20 0 HIADHN O=C(CN[C@@H](c1ccccc1)[C@H]1CCOC1)NCC1(c2ccc(F)cc2)CCCC1 ZINC000540389661 939226861 /nfs/dbraw/zinc/22/68/61/939226861.db2.gz GQYNZTHHXNUGMZ-RDPSFJRHSA-N 0 3 410.533 4.121 20 0 HIADHN O=C(CN[C@H](c1ccccc1)[C@@H]1CCOC1)Nc1ccc2c(c1)OC1(CCCC1)O2 ZINC000540390493 939229081 /nfs/dbraw/zinc/22/90/81/939229081.db2.gz YXQDFVSCZSDUQL-WZONZLPQSA-N 0 3 408.498 4.034 20 0 HIADHN C[C@@H](NC[C@H](O)COc1ccc(Cl)cc1Cl)c1cccc(N2CCCC2=O)c1 ZINC000540408452 939238233 /nfs/dbraw/zinc/23/82/33/939238233.db2.gz BYFSLRJDSVUBOR-KDOFPFPSSA-N 0 3 423.340 4.211 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(-c2cccnc2)cc1)C(=O)NC(=O)Nc1ccccc1F ZINC000540424740 939243868 /nfs/dbraw/zinc/24/38/68/939243868.db2.gz WSPAYYRTUWKEIJ-HZPDHXFCSA-N 0 3 406.461 4.275 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)Nc1cc(Cl)ccc1Cl)c1ccc(-n2ccnn2)cc1 ZINC000540429487 939245345 /nfs/dbraw/zinc/24/53/45/939245345.db2.gz IXERQSRVTFMZIM-OLZOCXBDSA-N 0 3 404.301 4.252 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(-c2cccnc2)cc1)C(=O)N1CCN(c2ccccc2)CC1 ZINC000540431025 939246091 /nfs/dbraw/zinc/24/60/91/939246091.db2.gz WSNSTVYRZXICTB-LEWJYISDSA-N 0 3 414.553 4.137 20 0 HIADHN COc1cc(NC(=O)CN[C@@H](c2cccc(C)c2)C(C)(C)C)cc(OC)c1OC ZINC000540438651 939250672 /nfs/dbraw/zinc/25/06/72/939250672.db2.gz MUCXUVWCAJKZGK-QFIPXVFZSA-N 0 3 400.519 4.336 20 0 HIADHN COc1ccc(NC(=O)[C@@H](C)N[C@H](C)c2ccc(-c3ccncc3)cc2)cc1OC ZINC000540440239 939250879 /nfs/dbraw/zinc/25/08/79/939250879.db2.gz RSESNVDPCYQIRY-IAGOWNOFSA-N 0 3 405.498 4.444 20 0 HIADHN CCN(CC)C(=O)c1ccc(NC(=O)CN[C@H](C)c2cccc(N3CCCC3)c2)cc1 ZINC000540479127 939268701 /nfs/dbraw/zinc/26/87/01/939268701.db2.gz WAVWATDADYFNST-LJQANCHMSA-N 0 3 422.573 4.058 20 0 HIADHN C[C@H]1CN([C@@H](CNCc2cn(C)nc2C(C)(C)C)c2c(F)cccc2Cl)CCO1 ZINC000540530626 939292634 /nfs/dbraw/zinc/29/26/34/939292634.db2.gz GNUBAPAFXJPWFS-KXBFYZLASA-N 0 3 422.976 4.062 20 0 HIADHN CCc1c2cc(C)ccc2oc1[C@H](C)NCc1ccc([C@@]2(C)NC(=O)NC2=O)cc1 ZINC000540593638 939313482 /nfs/dbraw/zinc/31/34/82/939313482.db2.gz IHKHCFWFLPFUIU-IZHWHUGBSA-N 0 3 405.498 4.209 20 0 HIADHN COc1ccc([C@@H](C)NC2CCN(C(=O)c3ccccc3)CC2)c(Br)c1 ZINC000540593709 939314219 /nfs/dbraw/zinc/31/42/19/939314219.db2.gz JQWSINVNSMXLEJ-OAHLLOKOSA-N 0 3 417.347 4.413 20 0 HIADHN Cc1cc(C(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)nn1C1CCCCC1 ZINC000540630261 939323774 /nfs/dbraw/zinc/32/37/74/939323774.db2.gz KNTWYIBFDKCAFI-UHFFFAOYSA-N 0 3 404.505 4.179 20 0 HIADHN CCN1CCN(Cc2ccc(N[C@H](C)c3cc(OC)c(OC)c(OC)c3)cc2)CC1 ZINC000540698503 939342771 /nfs/dbraw/zinc/34/27/71/939342771.db2.gz OYIFAVIXFWGZRV-GOSISDBHSA-N 0 3 413.562 4.023 20 0 HIADHN C[C@@H](N[C@@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O)c1cccc(CO)c1 ZINC000540778034 939369181 /nfs/dbraw/zinc/36/91/81/939369181.db2.gz ACDMKHAENMQAKJ-FOIQADDNSA-N 0 3 406.448 4.040 20 0 HIADHN Oc1ccc(C2CCC(Nc3ccc4nc(CCN5CCOCC5)[nH]c4c3)CC2)cc1 ZINC000540807756 939379269 /nfs/dbraw/zinc/37/92/69/939379269.db2.gz MJWKPMPEVQPOII-UHFFFAOYSA-N 0 3 420.557 4.282 20 0 HIADHN O=C([C@@H]1CCCN1Cc1ccccc1)N1CCC[C@@H](c2nnc(C3CCCCC3)[nH]2)C1 ZINC000540850774 939393983 /nfs/dbraw/zinc/39/39/83/939393983.db2.gz OICHVJDGPCYNDC-YADHBBJMSA-N 0 3 421.589 4.223 20 0 HIADHN COc1ccc(-c2noc(CN3CCC[C@@H](c4nc(C5CCCCC5)n[nH]4)C3)n2)cc1 ZINC000540864867 939402278 /nfs/dbraw/zinc/40/22/78/939402278.db2.gz OZYCEDRKMRUBIB-GOSISDBHSA-N 0 3 422.533 4.291 20 0 HIADHN COc1ccc(-c2noc(CN3CCC[C@@H](c4n[nH]c(C5CCCCC5)n4)C3)n2)cc1 ZINC000540864867 939402281 /nfs/dbraw/zinc/40/22/81/939402281.db2.gz OZYCEDRKMRUBIB-GOSISDBHSA-N 0 3 422.533 4.291 20 0 HIADHN CC[C@H](C)n1nc(C(=O)N(CCN(C)C)Cc2ccc(Br)cc2)cc1C ZINC000540889354 939411028 /nfs/dbraw/zinc/41/10/28/939411028.db2.gz HCYSRZUYXFMEGG-HNNXBMFYSA-N 0 3 421.383 4.129 20 0 HIADHN C[C@H](N[C@@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O)c1ccc(-n2ccnn2)cc1 ZINC000540889786 939411363 /nfs/dbraw/zinc/41/13/63/939411363.db2.gz WQLZDFWEEUOZMM-ORAYPTAESA-N 0 3 416.312 4.030 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)NCC(=O)N(Cc2ccco2)CC(F)(F)F)cc1 ZINC000541025731 939434575 /nfs/dbraw/zinc/43/45/75/939434575.db2.gz KGOMRAPGEYZBNU-HNNXBMFYSA-N 0 3 420.435 4.015 20 0 HIADHN CCN(CC)C(=O)CCC1CCN([C@@H](C(=O)N2CCCCC2)c2ccccc2)CC1 ZINC000541086328 939455077 /nfs/dbraw/zinc/45/50/77/939455077.db2.gz VWLIJYANBURECY-XMMPIXPASA-N 0 3 413.606 4.101 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N2CCC(CCCn3ccnc3)CC2)N2CCCC2)cc1 ZINC000541185076 939484793 /nfs/dbraw/zinc/48/47/93/939484793.db2.gz SXJSEBDSBVJLPS-XMMPIXPASA-N 0 3 423.605 4.230 20 0 HIADHN COC(=O)c1cccc(NC(=O)C[C@H](C)N[C@H]2CCSc3c(F)cccc32)c1 ZINC000541210503 939485731 /nfs/dbraw/zinc/48/57/31/939485731.db2.gz PVCWQNFLYXFAHE-UGSOOPFHSA-N 0 3 402.491 4.156 20 0 HIADHN CS(=O)(=O)Cc1ccc(CN[C@H]2CCCc3c(Br)cccc32)cc1 ZINC000541222271 939486285 /nfs/dbraw/zinc/48/62/85/939486285.db2.gz BCOWJPYIYGJWOY-IBGZPJMESA-N 0 3 408.361 4.161 20 0 HIADHN CCOC(=O)C1CCN(C(=O)C[C@H](C)NCc2ccccc2Oc2ccccc2)CC1 ZINC000541221694 939486320 /nfs/dbraw/zinc/48/63/20/939486320.db2.gz MDHHLOXKDRHGOO-IBGZPJMESA-N 0 3 424.541 4.149 20 0 HIADHN CCCN(C(=O)c1cnn(CCC(F)(F)F)c1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000541290926 939489611 /nfs/dbraw/zinc/48/96/11/939489611.db2.gz NVEGGULGNIKXAK-HXUWFJFHSA-N 0 3 422.495 4.352 20 0 HIADHN Cc1ccc([C@@H]2CCN(C(=O)NCCCCN3CCN(c4ccccc4)CC3)C2)cc1 ZINC000541338807 939492313 /nfs/dbraw/zinc/49/23/13/939492313.db2.gz XGCOKWKXYWWSRZ-XMMPIXPASA-N 0 3 420.601 4.096 20 0 HIADHN CO[C@@H](c1ccccc1F)[C@H](C)NCc1cnc2c(C)cc(Br)cn12 ZINC000541378042 939500778 /nfs/dbraw/zinc/50/07/78/939500778.db2.gz JAOTXOJRWWXUGG-SCLBCKFNSA-N 0 3 406.299 4.410 20 0 HIADHN Cc1cc(CNCc2ccc(C(=O)N3C[C@@H](C)O[C@@H](C)C3)cc2)cc2cccnc12 ZINC000541388999 939503415 /nfs/dbraw/zinc/50/34/15/939503415.db2.gz LSPQCKHQXQXTRN-KDURUIRLSA-N 0 3 403.526 4.082 20 0 HIADHN O=C(NCCCNc1cccc(F)c1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000541474067 939529868 /nfs/dbraw/zinc/52/98/68/939529868.db2.gz WDHXHNQOYAXMJB-UHFFFAOYSA-N 0 3 416.566 4.041 20 0 HIADHN COc1ccc(S(=O)(=O)[N-]c2cccc(C[NH2+][C@H](C)CCC(F)(F)F)c2)cc1 ZINC000541540870 939548124 /nfs/dbraw/zinc/54/81/24/939548124.db2.gz UBLDREORSBEUFI-CQSZACIVSA-N 0 3 416.465 4.317 20 0 HIADHN COc1cc(CN[C@@H](CN2CCOCC2)c2ccccc2C)ccc1OC1CCCC1 ZINC000541542606 939548547 /nfs/dbraw/zinc/54/85/47/939548547.db2.gz PFKIFNSFHXKUPM-DEOSSOPVSA-N 0 3 424.585 4.488 20 0 HIADHN O=C(NC1CCCCC1)N1CCC(N[C@H](c2ccc(F)cc2)c2cccnc2)CC1 ZINC000541565694 939556681 /nfs/dbraw/zinc/55/66/81/939556681.db2.gz RILMNIPPNKYOCO-HSZRJFAPSA-N 0 3 410.537 4.406 20 0 HIADHN Cc1nc(-c2ccccc2)sc1[C@H](C)N[C@H]1CCCN(Cc2ccccn2)C1=O ZINC000541568508 939556914 /nfs/dbraw/zinc/55/69/14/939556914.db2.gz UGSZWYLQPCUEHY-JXFKEZNVSA-N 0 3 406.555 4.355 20 0 HIADHN Cn1cc([C@@H](NCCCc2nc(-c3ccc(F)cc3)no2)c2cccc(F)c2)cn1 ZINC000541568781 939557724 /nfs/dbraw/zinc/55/77/24/939557724.db2.gz DKGZPHIEDKKBHM-NRFANRHFSA-N 0 3 409.440 4.060 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)Cc2nc(-c3ccc(F)cc3)cs2)CC1 ZINC000541574192 939558529 /nfs/dbraw/zinc/55/85/29/939558529.db2.gz ARYSEPXHRZZHEH-UHFFFAOYSA-N 0 3 413.518 4.208 20 0 HIADHN COc1cc(-c2nnc(CN[C@@H]3C[C@H](C)CC[C@H]3C(C)C)o2)cc(OC)c1OC ZINC000541611061 939569465 /nfs/dbraw/zinc/56/94/65/939569465.db2.gz FNKZWDAJWMGBOP-HYVNUMGLSA-N 0 3 403.523 4.313 20 0 HIADHN CC(C)C[C@@H](NCC(=O)NCC1(c2ccccc2)CCOCC1)c1cccs1 ZINC000541625772 939574531 /nfs/dbraw/zinc/57/45/31/939574531.db2.gz KMNDKGPIJZHGSA-HXUWFJFHSA-N 0 3 400.588 4.290 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@H]2CCCC[C@H]2NCc2cccc(Cn3cccn3)c2)cc1 ZINC000541742155 939618575 /nfs/dbraw/zinc/61/85/75/939618575.db2.gz WDBCXAGIDCFEES-RPWUZVMVSA-N 0 3 423.582 4.115 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@H]2NCc2ccc(Cn3ccnc3)cc2)cc1 ZINC000541744103 939618855 /nfs/dbraw/zinc/61/88/55/939618855.db2.gz BXEBEJKYGYGINM-DNQXCXABSA-N 0 3 423.582 4.115 20 0 HIADHN OC[C@@H](CN[C@@H](c1ccccc1)c1cncnc1)Cc1ccccc1C(F)(F)F ZINC000541743337 939618973 /nfs/dbraw/zinc/61/89/73/939618973.db2.gz IGTXCUJLVIGJOT-IERDGZPVSA-N 0 3 401.432 4.026 20 0 HIADHN C[C@@H]1CCCN(Cc2ccccc2CNCc2c(Cl)cccc2S(C)(=O)=O)C1 ZINC000541794450 939632831 /nfs/dbraw/zinc/63/28/31/939632831.db2.gz ASWLHCRWQLQATH-QGZVFWFLSA-N 0 3 421.006 4.265 20 0 HIADHN COc1ccc([C@H](NC2CCN(C(C)=O)CC2)c2ccccc2Cl)cc1OC ZINC000541843767 939646059 /nfs/dbraw/zinc/64/60/59/939646059.db2.gz HYTGCAVEAODOCQ-QFIPXVFZSA-N 0 3 402.922 4.047 20 0 HIADHN CCC(CC)[C@@H]1C[C@H](NC(=O)NC[C@H](c2ccc(OC)cc2)N2CCCC2)CCO1 ZINC000541851031 939647189 /nfs/dbraw/zinc/64/71/89/939647189.db2.gz YQSAWIJWEPTQNB-MZYLBHOOSA-N 0 3 417.594 4.115 20 0 HIADHN COc1ccc(C(=O)NCCN[C@@H](CSC)c2ccc(C(F)(F)F)cc2)cc1 ZINC000541917797 939653965 /nfs/dbraw/zinc/65/39/65/939653965.db2.gz ZUKRBINXVBDHFQ-SFHVURJKSA-N 0 3 412.477 4.138 20 0 HIADHN COC(=O)c1ccc(CNCc2ccccc2-c2ccc(Cn3cccn3)cc2)[nH]1 ZINC000541920276 939654323 /nfs/dbraw/zinc/65/43/23/939654323.db2.gz BMJYREDFJVQGKQ-UHFFFAOYSA-N 0 3 400.482 4.003 20 0 HIADHN COCCCNC(=O)C1CCN(Cc2ccc(-c3cccc(C(F)(F)F)c3)o2)CC1 ZINC000541925499 939655675 /nfs/dbraw/zinc/65/56/75/939655675.db2.gz MBPYITAXEUYFEK-UHFFFAOYSA-N 0 3 424.463 4.330 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)N[C@H](C)C(=O)Nc2ccc3c(c2)OCCCO3)cc1 ZINC000541956075 939661858 /nfs/dbraw/zinc/66/18/58/939661858.db2.gz NAQFUBQPEURRAF-IAGOWNOFSA-N 0 3 420.513 4.020 20 0 HIADHN CCN1CC[C@H](NCc2cnc([C@@H]3CCCO3)s2)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000542013186 939684638 /nfs/dbraw/zinc/68/46/38/939684638.db2.gz MZMGTUVATAOEAV-LNLFQRSKSA-N 0 3 411.493 4.337 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)Nc2cc(F)c(OC(C)(C)C)c(F)c2)CC1 ZINC000542027601 939691988 /nfs/dbraw/zinc/69/19/88/939691988.db2.gz YSHHUPZTGVUPDY-UHFFFAOYSA-N 0 3 413.509 4.153 20 0 HIADHN CC[C@H](CNC(=O)N1CCC(c2ccc(C)nc2)CC1)N1CCc2ccccc2C1 ZINC000542109785 939717105 /nfs/dbraw/zinc/71/71/05/939717105.db2.gz ZJLFMGMLPUSDTB-XMMPIXPASA-N 0 3 406.574 4.116 20 0 HIADHN Cc1ccc(C(=O)NC2CCN(CCOc3ccc(F)cc3)CC2)c(Cl)c1C ZINC000542136474 939725925 /nfs/dbraw/zinc/72/59/25/939725925.db2.gz BUYHJNBKPNNZJD-UHFFFAOYSA-N 0 3 404.913 4.369 20 0 HIADHN CC(C)n1ccc(C[C@H](C)N[C@H](C)c2cc3c(cc2Br)OCCO3)n1 ZINC000542143643 939729134 /nfs/dbraw/zinc/72/91/34/939729134.db2.gz WOSGFQPVKVVAHW-UONOGXRCSA-N 0 3 408.340 4.280 20 0 HIADHN CCOC(=O)C1CCN(C(=O)C[C@@H](C)N[C@H](c2ccc(F)cc2F)C(C)(C)C)CC1 ZINC000542147726 939730678 /nfs/dbraw/zinc/73/06/78/939730678.db2.gz ITORYGNURSPOFT-QVKFZJNVSA-N 0 3 424.532 4.222 20 0 HIADHN CN(C)C(=O)COc1cccc(CN[C@@H]2CCCc3c(Br)cccc32)c1 ZINC000542152075 939732480 /nfs/dbraw/zinc/73/24/80/939732480.db2.gz DZCQXVUHWGZLRM-HXUWFJFHSA-N 0 3 417.347 4.083 20 0 HIADHN CC(C)OC(=O)C1(C(=O)OC(C)C)CC(N[C@H]2c3cccc(F)c3CC[C@@H]2C)C1 ZINC000542165100 939740449 /nfs/dbraw/zinc/74/04/49/939740449.db2.gz VKSIGFPVUBALKN-MGPUTAFESA-N 0 3 405.510 4.091 20 0 HIADHN COC(=O)CN1CCC(N[C@H](c2ccc(Cl)cc2)c2ccccc2Cl)CC1 ZINC000542169491 939741872 /nfs/dbraw/zinc/74/18/72/939741872.db2.gz PRJXZHDYPANHKX-OAQYLSRUSA-N 0 3 407.341 4.310 20 0 HIADHN C[C@H](N[C@H](Cc1ccc(C(F)(F)F)cc1)C(N)=O)c1cccc(N2CCCC2)c1 ZINC000542231890 939766340 /nfs/dbraw/zinc/76/63/40/939766340.db2.gz AYPTWAYIPSULQS-MGPUTAFESA-N 0 3 405.464 4.053 20 0 HIADHN CN(CCCc1cc(-c2ccc(F)cc2)n[nH]1)Cc1cncc(Br)c1 ZINC000542280352 939783372 /nfs/dbraw/zinc/78/33/72/939783372.db2.gz KKTBFXKIFNYZBA-UHFFFAOYSA-N 0 3 403.299 4.438 20 0 HIADHN C[C@@H](C[S@](C)=O)NCc1cn(Cc2ccccc2)nc1-c1ccc(Cl)cc1 ZINC000542301844 939791565 /nfs/dbraw/zinc/79/15/65/939791565.db2.gz MQZFMIVPNKSGJF-OQRWROFFSA-N 0 3 401.963 4.108 20 0 HIADHN COc1c(Br)cc(Br)cc1CN[C@@]1(C)CCO[C@H]1C1CC1 ZINC000542312886 939795941 /nfs/dbraw/zinc/79/59/41/939795941.db2.gz JNSKPHBBCYSRMA-HOTGVXAUSA-N 0 3 419.157 4.267 20 0 HIADHN COc1c(Br)cc(Br)cc1CN[C@@]1(C)CCO[C@@H]1C1CC1 ZINC000542312885 939796206 /nfs/dbraw/zinc/79/62/06/939796206.db2.gz JNSKPHBBCYSRMA-CVEARBPZSA-N 0 3 419.157 4.267 20 0 HIADHN COc1cc(-c2nnc(CN3CC[C@H](c4ccc(C)cc4)C3)o2)cc(OC)c1OC ZINC000542317332 939798383 /nfs/dbraw/zinc/79/83/83/939798383.db2.gz FZGJFEHQYJFBSD-KRWDZBQOSA-N 0 3 409.486 4.060 20 0 HIADHN CC1(C(=O)N2CCC(C(=O)c3ccccc3)CC2)CCN(Cc2ccccc2)CC1 ZINC000542487948 939831836 /nfs/dbraw/zinc/83/18/36/939831836.db2.gz SMMCKQQDIHUVHU-UHFFFAOYSA-N 0 3 404.554 4.410 20 0 HIADHN Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)NC[C@@H](O)COc1ccccc1C(C)C ZINC000542534610 939839314 /nfs/dbraw/zinc/83/93/14/939839314.db2.gz YQAIBVXQHVRMJX-WMLDXEAASA-N 0 3 413.484 4.276 20 0 HIADHN COC(=O)C[C@H](N[C@@H](C)C(=O)Nc1ccccc1C(F)(F)F)C1CCCCC1 ZINC000542534178 939839337 /nfs/dbraw/zinc/83/93/37/939839337.db2.gz YGHLDNWSNSLCLP-GUYCJALGSA-N 0 3 400.441 4.134 20 0 HIADHN CN(CC(=O)N1CCC(Cc2ccccc2)CC1)[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000542627713 939850154 /nfs/dbraw/zinc/85/01/54/939850154.db2.gz LQVWYPAZGHXDOV-JWQCQUIFSA-N 0 3 424.560 4.459 20 0 HIADHN CN(Cc1c(F)cccc1Cl)C(=O)CN(C)[C@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000542629054 939850292 /nfs/dbraw/zinc/85/02/92/939850292.db2.gz WUKMAXOJQDDMBP-UWJYYQICSA-N 0 3 422.903 4.429 20 0 HIADHN CCN(Cc1cccc(F)c1)C(=O)CN(C)[C@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000542628141 939850343 /nfs/dbraw/zinc/85/03/43/939850343.db2.gz OMGKKESJXYFIQI-FCHUYYIVSA-N 0 3 402.485 4.165 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@@H]2NCc2ccccc2-n2ccnc2)cc1 ZINC000542664432 939852646 /nfs/dbraw/zinc/85/26/46/939852646.db2.gz KQIQDZMZIZLKOU-JTHBVZDNSA-N 0 3 409.555 4.055 20 0 HIADHN CCOCc1ccc(CN[C@H]2CCCC[C@H]2S(=O)(=O)c2ccc(C)cc2)cc1 ZINC000542669561 939853008 /nfs/dbraw/zinc/85/30/08/939853008.db2.gz MGTQPBHHAKYLIU-XZOQPEGZSA-N 0 3 401.572 4.406 20 0 HIADHN O=C(CCNCc1cnc(-c2ccccc2)nc1)Nc1ccc(Br)cc1 ZINC000542691243 939854458 /nfs/dbraw/zinc/85/44/58/939854458.db2.gz FWDYPJODUNLDMK-UHFFFAOYSA-N 0 3 411.303 4.025 20 0 HIADHN CS[C@H]1CN(C(=O)c2oc3ccc(Br)cc3c2C)C[C@@H]1N1CCCC1 ZINC000542772945 939860217 /nfs/dbraw/zinc/86/02/17/939860217.db2.gz JRCVGFPGYXSKDA-RDJZCZTQSA-N 0 3 423.376 4.156 20 0 HIADHN CSc1ccc(CN(C)C(=O)CN[C@H](C)c2ccc(-n3ccnc3C)cc2)cc1 ZINC000542885267 939865268 /nfs/dbraw/zinc/86/52/68/939865268.db2.gz YXBJCLOECXNSCT-QGZVFWFLSA-N 0 3 408.571 4.212 20 0 HIADHN Cc1ccc(-c2ccc(C(=O)NCc3ccccc3CN3CCC(O)CC3)s2)o1 ZINC000542893851 939874658 /nfs/dbraw/zinc/87/46/58/939874658.db2.gz MCPSREYYNGHLSU-UHFFFAOYSA-N 0 3 410.539 4.203 20 0 HIADHN CSc1ccc(F)cc1CN[C@H](C)CC(=O)Nc1ccc(NC(=O)C2CC2)cc1 ZINC000543064050 939917634 /nfs/dbraw/zinc/91/76/34/939917634.db2.gz MTMURIDVEQHLSL-CQSZACIVSA-N 0 3 415.534 4.403 20 0 HIADHN COC(=O)c1cccc(NC(=O)C[C@H](C)N[C@@H](C)c2ccccc2OC(F)F)c1 ZINC000543066735 939919839 /nfs/dbraw/zinc/91/98/39/939919839.db2.gz MEIWUIVOBXYIGA-KBPBESRZSA-N 0 3 406.429 4.143 20 0 HIADHN CCOc1ccc(C(C)(C)C(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)cc1OCC ZINC000543095293 939940956 /nfs/dbraw/zinc/94/09/56/939940956.db2.gz LRGUTRNRLURFHC-NFBKMPQASA-N 0 3 410.558 4.323 20 0 HIADHN CN(C)c1cccc([C@H]2CCCN2[C@H](Cc2ccc(C(F)(F)F)cc2)C(N)=O)c1 ZINC000543202700 939994424 /nfs/dbraw/zinc/99/44/24/939994424.db2.gz KQWUGSBFUKYQTJ-WOJBJXKFSA-N 0 3 405.464 4.005 20 0 HIADHN COc1ccc(CNCCCc2nc(-c3ccc(F)cc3)no2)c(Cl)c1OC ZINC000543240853 940005928 /nfs/dbraw/zinc/00/59/28/940005928.db2.gz YATPIHZVXIIEAF-UHFFFAOYSA-N 0 3 405.857 4.269 20 0 HIADHN Cc1cc(-c2nc(C3CC3)no2)ccc1NC(=O)NC[C@@H](c1ccccc1)N(C)C ZINC000543348748 940037664 /nfs/dbraw/zinc/03/76/64/940037664.db2.gz GGLOZFWPGKYVCN-FQEVSTJZSA-N 0 3 405.502 4.347 20 0 HIADHN CCS(=O)(=O)c1ccc(CN[C@@H]2CCCc3c(Br)cccc32)cc1 ZINC000563766339 945291625 /nfs/dbraw/zinc/29/16/25/945291625.db2.gz LOVGYZVRPTYXGU-LJQANCHMSA-N 0 3 408.361 4.410 20 0 HIADHN CC[C@@H]1CCC[C@@H](CN2CCN(CC(=O)Nc3ccccc3C(F)(F)F)CC2)C1 ZINC000543396786 940051149 /nfs/dbraw/zinc/05/11/49/940051149.db2.gz PYVFVFDEMYXLEW-QZTJIDSGSA-N 0 3 411.512 4.478 20 0 HIADHN COc1cc(OC)cc(N2CC[C@@H](CN[C@H](c3ccc(F)cc3)c3cccnc3)C2)c1 ZINC000543404551 940053703 /nfs/dbraw/zinc/05/37/03/940053703.db2.gz IKRLJUSNRYDICA-AVRWGWEMSA-N 0 3 421.516 4.443 20 0 HIADHN COc1cc(OC)cc(N2CC[C@@H](CN[C@H](c3ccccc3)c3ccc(F)cn3)C2)c1 ZINC000543404904 940054197 /nfs/dbraw/zinc/05/41/97/940054197.db2.gz LQDVMPYEDREIPL-AVRWGWEMSA-N 0 3 421.516 4.443 20 0 HIADHN CC[C@@H](N[C@@H]1CCCN(Cc2ccccn2)C1=O)c1ccc2cc(OC)ccc2c1 ZINC000543426996 940061090 /nfs/dbraw/zinc/06/10/90/940061090.db2.gz PTQOAYWEZXAODF-DNQXCXABSA-N 0 3 403.526 4.475 20 0 HIADHN O=C(CN[C@@H](c1cccs1)C1CC1)Nc1ccc(I)cc1 ZINC000543438183 940064394 /nfs/dbraw/zinc/06/43/94/940064394.db2.gz CHVNMCJSPOVABT-MRXNPFEDSA-N 0 3 412.296 4.032 20 0 HIADHN COC(=O)c1sccc1NC(=O)CN[C@@H](Cc1ccccc1)c1cccs1 ZINC000543453794 940067568 /nfs/dbraw/zinc/06/75/68/940067568.db2.gz FJHLVRILHXPMHA-INIZCTEOSA-N 0 3 400.525 4.108 20 0 HIADHN Cc1ccsc1[C@H](Cc1ccccc1)NCC(=O)Nc1nnc(-c2ccco2)o1 ZINC000543453487 940067654 /nfs/dbraw/zinc/06/76/54/940067654.db2.gz PNNCXEKAWDKEGW-INIZCTEOSA-N 0 3 408.483 4.212 20 0 HIADHN CCc1ccccc1NC(=O)CN(C)C(=O)[C@H](C)N[C@H](CC(C)C)c1cccs1 ZINC000543484891 940079387 /nfs/dbraw/zinc/07/93/87/940079387.db2.gz FZWGJIKLWCRZBZ-FXAWDEMLSA-N 0 3 415.603 4.473 20 0 HIADHN CCc1ccccc1NC(=O)CN(C)C(=O)[C@H](C)N[C@@H](CC(C)C)c1cccs1 ZINC000543484893 940079646 /nfs/dbraw/zinc/07/96/46/940079646.db2.gz FZWGJIKLWCRZBZ-PXNSSMCTSA-N 0 3 415.603 4.473 20 0 HIADHN CC(C)C[C@H](N[C@H](C)C(=O)N[C@@H](C)c1ccc2c(c1)OCCO2)c1cccs1 ZINC000543485941 940080158 /nfs/dbraw/zinc/08/01/58/940080158.db2.gz PNPOUFPMDDKQIO-JZXOWHBKSA-N 0 3 402.560 4.462 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)C1(c2ccc(OC)c(OC)c2)CCC1)c1ccsc1 ZINC000543540057 940099178 /nfs/dbraw/zinc/09/91/78/940099178.db2.gz XDGIIVZPPDGWEO-IBGZPJMESA-N 0 3 416.587 4.386 20 0 HIADHN CCCOc1ccc(CNC(=O)CN(C)[C@@H]2CCO[C@H](c3ccc(F)cc3)C2)cc1 ZINC000543555804 940107117 /nfs/dbraw/zinc/10/71/17/940107117.db2.gz XIHHBYPHMDZYDR-GGAORHGYSA-N 0 3 414.521 4.083 20 0 HIADHN Cc1ccc(NC(=O)[C@H](C)N[C@@H](C)[C@@H]2COc3ccccc32)c(Br)c1 ZINC000543558183 940107979 /nfs/dbraw/zinc/10/79/79/940107979.db2.gz BTGFIGVRCMURKL-DZKIICNBSA-N 0 3 403.320 4.239 20 0 HIADHN CS[C@@H]1CN(C(=O)c2csc(-c3cccc(Cl)c3)n2)C[C@@H]1N1CCCC1 ZINC000543701427 940164977 /nfs/dbraw/zinc/16/49/77/940164977.db2.gz UMWFAMZHSKGTRY-DLBZAZTESA-N 0 3 407.992 4.115 20 0 HIADHN Cc1c2cc(Cl)ccc2oc1C(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1CO ZINC000543707085 940166823 /nfs/dbraw/zinc/16/68/23/940166823.db2.gz JQJODWRRMHJGFO-FXAWDEMLSA-N 0 3 412.917 4.007 20 0 HIADHN CC(C)N(CCN(C)C)C(=O)Nc1ccc(Cl)c(C(=O)NC2CCCCC2)c1 ZINC000543829390 940201195 /nfs/dbraw/zinc/20/11/95/940201195.db2.gz PRXSREUTRDJXBJ-UHFFFAOYSA-N 0 3 408.974 4.206 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)c2ccn(Cc3ccccc3)c2)cc1 ZINC000543849421 940207817 /nfs/dbraw/zinc/20/78/17/940207817.db2.gz AYXLMNNKCKQWKA-XMMPIXPASA-N 0 3 403.526 4.112 20 0 HIADHN Cn1nccc1[C@H]1CCCCN1C(=O)N[C@H](CN1CCc2ccccc2C1)C(C)(C)C ZINC000543877251 940221592 /nfs/dbraw/zinc/22/15/92/940221592.db2.gz SLXOTRRVFAGZAS-DHIUTWEWSA-N 0 3 423.605 4.130 20 0 HIADHN Cc1c2cccc(Br)c2oc1C(=O)NCCCCN1C[C@H](C)O[C@@H](C)C1 ZINC000543880093 940222820 /nfs/dbraw/zinc/22/28/20/940222820.db2.gz IOHBIVJRNOCHRV-KBPBESRZSA-N 0 3 423.351 4.123 20 0 HIADHN C[C@H](C(=O)N1CCC[C@@H]1c1cccs1)N1CCC(CCCn2ccnc2)CC1 ZINC000543987778 940284196 /nfs/dbraw/zinc/28/41/96/940284196.db2.gz INFUPFXDJIZPDD-UYAOXDASSA-N 0 3 400.592 4.189 20 0 HIADHN C[C@@H]1CCCN(C(=O)C2CCN(CCCc3ccccc3Br)CC2)C1 ZINC000544070330 940317282 /nfs/dbraw/zinc/31/72/82/940317282.db2.gz RSXZNRBIJZJLLN-QGZVFWFLSA-N 0 3 407.396 4.352 20 0 HIADHN Cc1nc(N(C)C[C@@H](C)c2nccs2)cc(N(C)C[C@H](C)c2nccs2)n1 ZINC000544123106 940332035 /nfs/dbraw/zinc/33/20/35/940332035.db2.gz GXFHUVDVKXJFKC-OKILXGFUSA-N 0 3 402.593 4.178 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)[C@@H]1CCn2c(cnc2C2CCCCC2)C1 ZINC000544224207 940359820 /nfs/dbraw/zinc/35/98/20/940359820.db2.gz ASMCKAPEVDXGQI-PKTZIBPZSA-N 0 3 420.601 4.274 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)[C@H]2CCn3c(cnc3C3CCCCC3)C2)CN1Cc1ccccc1 ZINC000544287521 940380363 /nfs/dbraw/zinc/38/03/63/940380363.db2.gz WKIIQAFJBMUQGV-OIBXWCBGSA-N 0 3 420.601 4.272 20 0 HIADHN c1cncc(CN2CCC[C@H](c3nc(-c4cccnc4OC4CCCC4)no3)C2)c1 ZINC000544319854 940389460 /nfs/dbraw/zinc/38/94/60/940389460.db2.gz LQAOUSPUIXWIJZ-SFHVURJKSA-N 0 3 405.502 4.228 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(Cc4cc(Cl)ccc4Cl)n3)cn2)CC1 ZINC000544345470 940395681 /nfs/dbraw/zinc/39/56/81/940395681.db2.gz AUUDSMSPHCCCNX-UHFFFAOYSA-N 0 3 418.328 4.171 20 0 HIADHN O=C(C1CCC(N[C@H](c2ccc(F)cc2)c2cccnc2)CC1)N1CCSCC1 ZINC000544359330 940400263 /nfs/dbraw/zinc/40/02/63/940400263.db2.gz ODKULACGVWNSQJ-FQUBMZHMSA-N 0 3 413.562 4.034 20 0 HIADHN CC(C)([C@H](NC(=O)[C@H]1COc2ccccc21)c1ccc(F)c(F)c1)N1CCCC1 ZINC000544358573 940400291 /nfs/dbraw/zinc/40/02/91/940400291.db2.gz QWVPXSZUCRTYOA-LAUBAEHRSA-N 0 3 400.469 4.173 20 0 HIADHN Cn1cc(N2CCC[C@@H](N[C@H](c3ccc(F)cc3)c3cnc4ccccc4c3)C2)cn1 ZINC000544359261 940400299 /nfs/dbraw/zinc/40/02/99/940400299.db2.gz HMHMGIQQKZRFOW-RCZVLFRGSA-N 0 3 415.516 4.455 20 0 HIADHN Cc1cccc([C@@H](CN[C@H](c2ccc(F)cc2)c2cccnc2)N2CCOCC2)c1 ZINC000544359246 940400569 /nfs/dbraw/zinc/40/05/69/940400569.db2.gz FUFNEFMALDQXQT-JWQCQUIFSA-N 0 3 405.517 4.282 20 0 HIADHN Cc1cc([C@H](NC[C@@H](c2cccs2)N2CCN(C)CC2)c2cccnc2)ccc1F ZINC000544360664 940401549 /nfs/dbraw/zinc/40/15/49/940401549.db2.gz PFIUYHOUAPJRJT-UPVQGACJSA-N 0 3 424.589 4.258 20 0 HIADHN CCOC(=O)C[C@H](C)N(C)Cc1cc(Br)ccc1OCc1ccccn1 ZINC000544368614 940403812 /nfs/dbraw/zinc/40/38/12/940403812.db2.gz NSIYECGTOOOXKM-HNNXBMFYSA-N 0 3 421.335 4.197 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(COc4cccc5ccccc54)n3)cn2)CC1 ZINC000544373108 940405092 /nfs/dbraw/zinc/40/50/92/940405092.db2.gz PICIXAXKPVYPSE-UHFFFAOYSA-N 0 3 415.497 4.006 20 0 HIADHN COc1ccc(C(=O)C[C@H](C)C(=O)NC2C[C@H]3CC[C@@H](C2)N3Cc2ccccc2)cc1 ZINC000544394989 940410912 /nfs/dbraw/zinc/41/09/12/940410912.db2.gz BMARPBCIUGIZHN-FNXHNPQUSA-N 0 3 420.553 4.216 20 0 HIADHN CCOC(=O)c1c2c(sc1NC(=O)c1ccncc1CC)C(C)(C)NC(C)(C)C2 ZINC000544401676 940413028 /nfs/dbraw/zinc/41/30/28/940413028.db2.gz NCHTXOPMVANDLF-UHFFFAOYSA-N 0 3 415.559 4.294 20 0 HIADHN Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)NC[C@@H](O)COc1cc(C)ccc1Cl ZINC000544421210 940420502 /nfs/dbraw/zinc/42/05/02/940420502.db2.gz IWKWMGGQPUURAZ-IUODEOHRSA-N 0 3 419.875 4.115 20 0 HIADHN Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)NC[C@H](O)COc1cccc2ccccc21 ZINC000544420863 940420727 /nfs/dbraw/zinc/42/07/27/940420727.db2.gz FEAAOMITYRGJKY-KDOFPFPSSA-N 0 3 421.463 4.306 20 0 HIADHN Cc1csc([C@H](C)NCCCOc2cccc(I)c2)n1 ZINC000544477002 940448841 /nfs/dbraw/zinc/44/88/41/940448841.db2.gz HBGMVQHAEBSEMW-LBPRGKRZSA-N 0 3 402.301 4.176 20 0 HIADHN C[C@H](NCC(=O)N(C)Cc1cc(Br)cs1)[C@@H]1Oc2ccccc2[C@@H]1C ZINC000544514114 940465474 /nfs/dbraw/zinc/46/54/74/940465474.db2.gz HRUUHGOJBPTLGD-WTOJCKNJSA-N 0 3 423.376 4.012 20 0 HIADHN CCOc1cccc2[nH]cc(CC(=O)NC[C@@H](c3ccc(SC)cc3)N(C)C)c21 ZINC000563912369 945323353 /nfs/dbraw/zinc/32/33/53/945323353.db2.gz ROGCRQXQLPJQTL-FQEVSTJZSA-N 0 3 411.571 4.250 20 0 HIADHN COc1cc(CN[C@H]2CCO[C@H](c3ccc(F)cc3)C2)c(Br)cc1O ZINC000544618366 940491429 /nfs/dbraw/zinc/49/14/29/940491429.db2.gz NJUSHOWCXUNXLC-YJBOKZPZSA-N 0 3 410.283 4.312 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)N[C@@H]2CCO[C@@H](c3ccc(F)cc3)C2)c1 ZINC000544651860 940498887 /nfs/dbraw/zinc/49/88/87/940498887.db2.gz KXNKBNVCTKVBBY-DHIUTWEWSA-N 0 3 413.537 4.128 20 0 HIADHN COc1ccc(NC(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)cc1OC(C)C ZINC000544884155 940521521 /nfs/dbraw/zinc/52/15/21/940521521.db2.gz CJBCKCYBKFQTAZ-UHFFFAOYSA-N 0 3 411.546 4.265 20 0 HIADHN Cc1cc(C)nc(-c2noc([C@]3(C(F)(F)F)CCN(Cc4ccccc4)C3)n2)c1 ZINC000544989542 940531249 /nfs/dbraw/zinc/53/12/49/940531249.db2.gz SQGDAHPWOFTHLN-FQEVSTJZSA-N 0 3 402.420 4.454 20 0 HIADHN Cc1cc(-c2noc([C@@H]3CCCN(Cc4cccc(F)c4)C3)n2)ccc1-n1cncn1 ZINC000545010983 940533323 /nfs/dbraw/zinc/53/33/23/940533323.db2.gz IQUBYWDVZBTSHE-LJQANCHMSA-N 0 3 418.476 4.144 20 0 HIADHN C(=C/c1ccc(OCc2ccccn2)cc1)\c1nc(CC2=N[C@@H]3CCCC[C@H]3N2)no1 ZINC000545125922 940545529 /nfs/dbraw/zinc/54/55/29/940545529.db2.gz DHOMHFFLCURYOA-PKGLBKFNSA-N 0 3 415.497 4.069 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](NCCC[C@@H]2CCCCO2)c2ccc(F)c(F)c2)c1 ZINC000545459782 940570898 /nfs/dbraw/zinc/57/08/98/940570898.db2.gz AQPHLVRMZPGNPK-PGRDOPGGSA-N 0 3 423.525 4.397 20 0 HIADHN NC(=O)[C@H](Cc1ccc(Cl)cc1)NCc1cccc(COCc2ccccc2)c1 ZINC000545474767 940571267 /nfs/dbraw/zinc/57/12/67/940571267.db2.gz KOFYKFCTDBGCMU-QHCPKHFHSA-N 0 3 408.929 4.243 20 0 HIADHN C[C@H](N[C@@H](Cc1ccc(Cl)cc1)C(N)=O)c1ccc(OCC(F)(F)F)cc1 ZINC000545473631 940571282 /nfs/dbraw/zinc/57/12/82/940571282.db2.gz OELFAPDCWHYYPE-SJCJKPOMSA-N 0 3 400.828 4.028 20 0 HIADHN C[C@@H](N[C@@H](Cc1ccc(Cl)cc1)C(N)=O)c1ccc(OCC(F)(F)F)cc1 ZINC000545473630 940571332 /nfs/dbraw/zinc/57/13/32/940571332.db2.gz OELFAPDCWHYYPE-PXAZEXFGSA-N 0 3 400.828 4.028 20 0 HIADHN C(=Cc1ccc(OCc2cccnc2)cc1)c1nc(CC2=N[C@@H]3CCCC[C@@H]3N2)no1 ZINC000545845741 940631039 /nfs/dbraw/zinc/63/10/39/940631039.db2.gz HBVNKOUBSMNKEF-QEOITGFPSA-N 0 3 415.497 4.069 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)c1cn(C)nc1-c1ccc(Cl)s1)c1ccco1 ZINC000563987785 945336768 /nfs/dbraw/zinc/33/67/68/945336768.db2.gz MGXFPOTZOGGUHY-GXTWGEPZSA-N 0 3 406.939 4.254 20 0 HIADHN COC1CCN(C2(CNC(=O)CCCCC(=O)c3ccc(C)cc3)CCCC2)CC1 ZINC000546085354 940694741 /nfs/dbraw/zinc/69/47/41/940694741.db2.gz UREMNKITSVSIBC-UHFFFAOYSA-N 0 3 414.590 4.278 20 0 HIADHN CCN(C(=O)c1ccc(OC)c(Br)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000546184260 940723917 /nfs/dbraw/zinc/72/39/17/940723917.db2.gz JBBWCBRRVQWXNF-SFHVURJKSA-N 0 3 417.347 4.194 20 0 HIADHN C[C@H](Oc1cccc(Cl)c1)c1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1 ZINC000546361205 940801912 /nfs/dbraw/zinc/80/19/12/940801912.db2.gz PACPZPRSQMSFJQ-HNNXBMFYSA-N 0 3 413.909 4.067 20 0 HIADHN C[C@@H](Oc1cccc(Cl)c1)c1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1 ZINC000546361206 940801951 /nfs/dbraw/zinc/80/19/51/940801951.db2.gz PACPZPRSQMSFJQ-OAHLLOKOSA-N 0 3 413.909 4.067 20 0 HIADHN C[C@H](CCc1cccc(F)c1)c1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1 ZINC000546363110 940802292 /nfs/dbraw/zinc/80/22/92/940802292.db2.gz PGUHQKZROOIMMH-QGZVFWFLSA-N 0 3 409.509 4.149 20 0 HIADHN CC1CCN([C@H](CNC(=O)N2CC3(CCC3)[C@@H]2[C@H]2CCCO2)c2cccs2)CC1 ZINC000564013317 945350076 /nfs/dbraw/zinc/35/00/76/945350076.db2.gz JMRVPKDRLIIBES-SBHAEUEKSA-N 0 3 417.619 4.264 20 0 HIADHN CC(=O)N1CCC[C@H](c2noc(-c3cccc(CN(C)Cc4ccccc4)c3)n2)C1 ZINC000546468990 940828441 /nfs/dbraw/zinc/82/84/41/940828441.db2.gz RACBHGFGIDDLTM-QFIPXVFZSA-N 0 3 404.514 4.095 20 0 HIADHN CN(C)C[C@@H](NC(=O)c1cccc(NC(=O)c2cccs2)c1)c1ccc(F)cc1 ZINC000564021201 945352247 /nfs/dbraw/zinc/35/22/47/945352247.db2.gz GPDORIZGZATNSC-LJQANCHMSA-N 0 3 411.502 4.172 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3ccc(Cl)cc3OC(F)F)cc2)CC1 ZINC000546568091 940855169 /nfs/dbraw/zinc/85/51/69/940855169.db2.gz YNHBUWQCSLWKSX-UHFFFAOYSA-N 0 3 409.864 4.336 20 0 HIADHN CS(=O)(=O)Nc1cccc(CN[C@H](Cc2cccnc2)c2ccc(Cl)cc2)c1 ZINC000546874447 940899535 /nfs/dbraw/zinc/89/95/35/940899535.db2.gz PSOSVJWWOKQVEI-OAQYLSRUSA-N 0 3 415.946 4.180 20 0 HIADHN CSc1ccc([C@@H](C)NC(=O)NC[C@H]2CN(Cc3ccccc3)CCCO2)cc1 ZINC000546882474 940900743 /nfs/dbraw/zinc/90/07/43/940900743.db2.gz DDDYRQLABMEFTA-NQIIRXRSSA-N 0 3 413.587 4.060 20 0 HIADHN CCN(C(=O)c1cccc(OCc2cscn2)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000546889882 940902454 /nfs/dbraw/zinc/90/24/54/940902454.db2.gz WERNMROYLDDTIG-JOCHJYFZSA-N 0 3 421.566 4.459 20 0 HIADHN COc1cccc(OC)c1OC[C@H](O)CNC(c1ccccc1C)c1ccccc1C ZINC000546932729 940917747 /nfs/dbraw/zinc/91/77/47/940917747.db2.gz CNYOYKLKNSDWHG-HXUWFJFHSA-N 0 3 421.537 4.440 20 0 HIADHN CC(C)C(=O)Nc1cccc(-c2noc([C@@H]3CCCN(Cc4cccnc4)C3)n2)c1 ZINC000547004520 940951545 /nfs/dbraw/zinc/95/15/45/940951545.db2.gz PRLAMHBWPMPIHR-LJQANCHMSA-N 0 3 405.502 4.106 20 0 HIADHN O[C@H](COCc1cccs1)CN1CC=C(c2cccc(Br)c2)CC1 ZINC000547292602 941053972 /nfs/dbraw/zinc/05/39/72/941053972.db2.gz RWALHRHQIWQRFT-SFHVURJKSA-N 0 3 408.361 4.177 20 0 HIADHN COCc1cccc(OCC2(CN3CCC([C@@](C)(O)C(F)(F)F)CC3)CC2)c1 ZINC000547344735 941057426 /nfs/dbraw/zinc/05/74/26/941057426.db2.gz UWSVIARIMCMBND-LJQANCHMSA-N 0 3 401.469 4.017 20 0 HIADHN Brc1cccc(-c2ccc(CN3CCOC4(CCOCC4)CC3)o2)c1 ZINC000547425271 941061794 /nfs/dbraw/zinc/06/17/94/941061794.db2.gz HJOWPBAELBPIMI-UHFFFAOYSA-N 0 3 406.320 4.481 20 0 HIADHN O=C(NCC1(c2ccc(C(F)(F)F)cc2)CC1)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000547738944 941074159 /nfs/dbraw/zinc/07/41/59/941074159.db2.gz RGWYDNBSXHZKRW-SFHVURJKSA-N 0 3 417.475 4.160 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)c3cc(-c4ccccc4)c(C)[nH]c3=O)c2)CC1 ZINC000547783895 941075661 /nfs/dbraw/zinc/07/56/61/941075661.db2.gz HVXTWBKSYMZUHU-UHFFFAOYSA-N 0 3 416.525 4.157 20 0 HIADHN O=C(CC(F)(F)F)Nc1ccc(NC(=O)c2cccc(CN3CCCC3)c2)cc1 ZINC000548924595 941129473 /nfs/dbraw/zinc/12/94/73/941129473.db2.gz LKBCYMVEEGUAKM-UHFFFAOYSA-N 0 3 405.420 4.426 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CC[C@](F)(c4ccccc4F)C3)c2)CC1 ZINC000548977181 941137662 /nfs/dbraw/zinc/13/76/62/941137662.db2.gz OVHPQRZCWTWUDP-HSZRJFAPSA-N 0 3 414.500 4.070 20 0 HIADHN CCN1CCN(Cc2ccc(NCc3ccc(C)cc3-c3ccnn3C)cc2)CC1 ZINC000548981291 941138569 /nfs/dbraw/zinc/13/85/69/941138569.db2.gz FBXNEMOWILKVSG-UHFFFAOYSA-N 0 3 403.574 4.145 20 0 HIADHN COc1ccc([C@@H](CNC(=O)Nc2ccc(C(F)(F)F)nc2C)N2CCCC2)cc1 ZINC000549045302 941148035 /nfs/dbraw/zinc/14/80/35/941148035.db2.gz MWHNPPUUEHNBNV-GOSISDBHSA-N 0 3 422.451 4.376 20 0 HIADHN O=C(CC(F)(F)F)Nc1ccc(NC(=O)N2CCN(C3CCCCC3)CC2)cc1 ZINC000549055349 941149469 /nfs/dbraw/zinc/14/94/69/941149469.db2.gz QBSXINMEGRJEGZ-UHFFFAOYSA-N 0 3 412.456 4.060 20 0 HIADHN CCOc1ccccc1NC(=O)CN[C@@H]1CCN(CC)[C@H]1c1ccc(Cl)c(F)c1 ZINC000549111302 941160767 /nfs/dbraw/zinc/16/07/67/941160767.db2.gz PCIUABXBEQWARJ-KNQAVFIVSA-N 0 3 419.928 4.241 20 0 HIADHN COc1cccc([C@@H]2[C@@H](N[C@@H](C)C(=O)Nc3cc(C)ccc3C)CCN2C2CC2)c1 ZINC000549112194 941160967 /nfs/dbraw/zinc/16/09/67/941160967.db2.gz GOGPLBCMSBJCJW-JKFKMHIGSA-N 0 3 407.558 4.207 20 0 HIADHN CS(=O)(=O)Nc1cccc(CN[C@@H]2CCCCc3cc(Br)ccc32)c1 ZINC000549146214 941165412 /nfs/dbraw/zinc/16/54/12/941165412.db2.gz KVMQQIRJEQURLA-LJQANCHMSA-N 0 3 423.376 4.378 20 0 HIADHN CCOc1c(Cl)cc(CNC[C@H](O)COc2ccc3ccccc3c2)cc1OC ZINC000549152350 941166017 /nfs/dbraw/zinc/16/60/17/941166017.db2.gz PIROERQKBHQQCS-IBGZPJMESA-N 0 3 415.917 4.430 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@H](N[C@H](CO)c2cccc(Br)c2)c2ccccc21 ZINC000549228907 941172396 /nfs/dbraw/zinc/17/23/96/941172396.db2.gz PAJPNJYSFIOIRJ-HSALFYBXSA-N 0 3 418.331 4.254 20 0 HIADHN CN(C)C[C@H](NC(=O)Cc1cccc(OCC(F)(F)F)c1)c1ccc(Cl)cc1 ZINC000549239440 941173321 /nfs/dbraw/zinc/17/33/21/941173321.db2.gz BLFAMTZBLOEERK-SFHVURJKSA-N 0 3 414.855 4.243 20 0 HIADHN COC(=O)c1c(F)cc(NC(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)cc1F ZINC000549363519 941182795 /nfs/dbraw/zinc/18/27/95/941182795.db2.gz MRXOTOHPWSLHKE-LJQANCHMSA-N 0 3 417.456 4.018 20 0 HIADHN CCn1c([C@@H](C)Oc2ccc(F)cc2)nnc1N1CCN(C2CCCCC2)CC1 ZINC000549375826 941183729 /nfs/dbraw/zinc/18/37/29/941183729.db2.gz JWPOTXJCAAXRSH-QGZVFWFLSA-N 0 3 401.530 4.032 20 0 HIADHN Cc1ccc(CN2CCCN(C(=O)c3ccc(Cl)cc3)CC2)c(-c2cnn(C)c2)c1 ZINC000549409069 941186956 /nfs/dbraw/zinc/18/69/56/941186956.db2.gz UPFUNYNURYVXNI-UHFFFAOYSA-N 0 3 422.960 4.397 20 0 HIADHN COc1cccc([C@@H]2[C@H](NCC(=O)Nc3ccccc3C(C)(C)C)CCN2C2CC2)c1 ZINC000549476751 941194469 /nfs/dbraw/zinc/19/44/69/941194469.db2.gz HEWGHNWQSHDKAO-ILBGXUMGSA-N 0 3 421.585 4.499 20 0 HIADHN COc1cccc([C@@H]2[C@H](NCc3nccn3Cc3ccccc3)CCN2C2CC2)c1 ZINC000549477028 941194686 /nfs/dbraw/zinc/19/46/86/941194686.db2.gz IFYNVSFPVHOAOE-ILBGXUMGSA-N 0 3 402.542 4.008 20 0 HIADHN CCN1CC[C@H](NCc2cc(F)cc3c2OCOC3)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000549478588 941194841 /nfs/dbraw/zinc/19/48/41/941194841.db2.gz XGKNIAUBPUGTMU-PMACEKPBSA-N 0 3 408.876 4.410 20 0 HIADHN CCN1CC[C@H](N[C@@H](C)C(=O)Nc2ccc(C)cc2F)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000549482090 941195175 /nfs/dbraw/zinc/19/51/75/941195175.db2.gz KXURWKZQUQYFSK-LPLGYCIKSA-N 0 3 423.454 4.304 20 0 HIADHN CCCCNC(=O)c1ccc(CN[C@H]2CC[C@@H](C(=O)OCC)c3ccccc32)cc1 ZINC000549525912 941198001 /nfs/dbraw/zinc/19/80/01/941198001.db2.gz BEFOBSNAZHPECE-PKTZIBPZSA-N 0 3 408.542 4.488 20 0 HIADHN COc1ccc([C@H]2C[C@H](NC(=O)N[C@H](CN(C)C)c3ccc(Cl)cc3)C2)cc1F ZINC000549553714 941199126 /nfs/dbraw/zinc/19/91/26/941199126.db2.gz ARFZOXBTTBXRKQ-YVWKXTFCSA-N 0 3 419.928 4.336 20 0 HIADHN CCCN(CC)C(=O)c1ccc(C(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)cc1 ZINC000549616852 941201504 /nfs/dbraw/zinc/20/15/04/941201504.db2.gz DJXUZUFJAMKJQW-OAQYLSRUSA-N 0 3 415.965 4.245 20 0 HIADHN CN(C)C[C@H](NC(=O)c1cccc(OCc2cccnc2)c1)c1ccc(Cl)cc1 ZINC000549618014 941201547 /nfs/dbraw/zinc/20/15/47/941201547.db2.gz WNXCPBSGVMJBCK-QFIPXVFZSA-N 0 3 409.917 4.347 20 0 HIADHN CCN(C(=O)N[C@@H]1CCc2cc(F)c(OC)cc21)[C@H]1CCN(Cc2ccccc2)C1 ZINC000549625614 941201862 /nfs/dbraw/zinc/20/18/62/941201862.db2.gz QHWYLBQIRPLUBT-SIKLNZKXSA-N 0 3 411.521 4.128 20 0 HIADHN COc1ccc2ccccc2c1CNc1ccc(C(=O)NCCN2CCCC2)cc1 ZINC000549681656 941204325 /nfs/dbraw/zinc/20/43/25/941204325.db2.gz OMMNVYJBTVLWCB-UHFFFAOYSA-N 0 3 403.526 4.286 20 0 HIADHN C[C@H]1CN(c2ccc(Cl)c(F)c2)CCN1C[C@H]1CCN(C(=O)c2ccccc2)C1 ZINC000549718179 941205578 /nfs/dbraw/zinc/20/55/78/941205578.db2.gz ZWEFVYLZWUTMKK-ZWKOTPCHSA-N 0 3 415.940 4.152 20 0 HIADHN C[C@@H]1CN(c2ccc(Cl)c(F)c2)CCN1C[C@H]1CCN(C(=O)c2ccccc2)C1 ZINC000549718177 941205614 /nfs/dbraw/zinc/20/56/14/941205614.db2.gz ZWEFVYLZWUTMKK-QZTJIDSGSA-N 0 3 415.940 4.152 20 0 HIADHN Cc1ccc([C@H](CNC(=O)[C@H](C)Cc2cnc3ccccc3n2)N2CCCC2)cc1 ZINC000549886720 941228018 /nfs/dbraw/zinc/22/80/18/941228018.db2.gz XRFNVEJFRFCBNN-DVECYGJZSA-N 0 3 402.542 4.070 20 0 HIADHN Cc1ccc([C@H](CNC(=O)[C@@H](C)Cc2cnc3ccccc3n2)N2CCCC2)cc1 ZINC000549886716 941228331 /nfs/dbraw/zinc/22/83/31/941228331.db2.gz XRFNVEJFRFCBNN-CYFREDJKSA-N 0 3 402.542 4.070 20 0 HIADHN C[C@H](c1ccc(F)cc1)N1CCC[C@@H](NCc2ccc(-c3cnn(C)c3)s2)C1=O ZINC000549907507 941235691 /nfs/dbraw/zinc/23/56/91/941235691.db2.gz LXFXLZPUTKMRBT-FOIQADDNSA-N 0 3 412.534 4.130 20 0 HIADHN Cc1ccc(-c2nnc(N3CCN(CC4CC4)CC3)n2Cc2cccs2)cc1F ZINC000549949364 941245995 /nfs/dbraw/zinc/24/59/95/941245995.db2.gz JRNJWKHNNZFGNM-UHFFFAOYSA-N 0 3 411.550 4.034 20 0 HIADHN Cc1cc(-c2noc([C@H](C)N[C@@H](C)C3CCN(CC(F)(F)F)CC3)n2)ccc1F ZINC000550023995 941267480 /nfs/dbraw/zinc/26/74/80/941267480.db2.gz HZDJCUZLAQWUGO-KBPBESRZSA-N 0 3 414.447 4.498 20 0 HIADHN O=C(NCCN1CCCC1)c1ccc(NCc2ccc(F)c(C(F)(F)F)c2)cc1 ZINC000550071916 941279463 /nfs/dbraw/zinc/27/94/63/941279463.db2.gz DCZWYUJYVYYLQG-UHFFFAOYSA-N 0 3 409.427 4.282 20 0 HIADHN O=C(NCCN1CCCC1)c1ccc(NCc2csc(-c3ccccc3)n2)cc1 ZINC000550072173 941279559 /nfs/dbraw/zinc/27/95/59/941279559.db2.gz OBXYZABAFGONNI-UHFFFAOYSA-N 0 3 406.555 4.248 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)C2CCC(OC[C@@H]3CCCO3)CC2)N2CCCC2)cc1 ZINC000550272782 941307332 /nfs/dbraw/zinc/30/73/32/941307332.db2.gz AAYFHTPGTUQTPP-STTLMXHVSA-N 0 3 414.590 4.003 20 0 HIADHN Cc1ccc([C@H](CNC(=O)C2CCC(OC[C@@H]3CCCO3)CC2)N2CCCC2)cc1 ZINC000550272780 941307467 /nfs/dbraw/zinc/30/74/67/941307467.db2.gz AAYFHTPGTUQTPP-MXXWWZHRSA-N 0 3 414.590 4.003 20 0 HIADHN Cc1ccccc1-n1cc(CNC2(Cc3ccc(F)cc3Cl)CCOCC2)nn1 ZINC000550288959 941309750 /nfs/dbraw/zinc/30/97/50/941309750.db2.gz ZHLRYACASVUNDN-UHFFFAOYSA-N 0 3 414.912 4.250 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1scnc1COC)c1ccc(C(F)(F)F)cc1 ZINC000550553303 941337901 /nfs/dbraw/zinc/33/79/01/941337901.db2.gz LQWAUNHYHAHBMO-MRXNPFEDSA-N 0 3 415.481 4.121 20 0 HIADHN Brc1cc2c(s1)CC[C@H]2NCc1ccccc1CN1CCOCC1 ZINC000550608492 941346071 /nfs/dbraw/zinc/34/60/71/941346071.db2.gz IJQJMARYBOFFEA-QGZVFWFLSA-N 0 3 407.377 4.120 20 0 HIADHN C[C@H](NCc1ccccc1OCC(=O)NC[C@H]1CCCO1)c1cccc(C2CC2)c1 ZINC000550618712 941346310 /nfs/dbraw/zinc/34/63/10/941346310.db2.gz FVSKDMBSEZUUMA-FDDCHVKYSA-N 0 3 408.542 4.089 20 0 HIADHN Cc1cc(C)c(NC(=O)CN[C@H]2CCN(C)[C@@H]2c2ccc(F)c(F)c2)c(Cl)c1 ZINC000550714523 941357739 /nfs/dbraw/zinc/35/77/39/941357739.db2.gz XQFUQRLLSIOQQQ-GHTZIAJQSA-N 0 3 407.892 4.209 20 0 HIADHN O[C@H](CNCc1ccccc1F)COC(c1ccc(F)cc1)c1ccc(F)cc1 ZINC000550720858 941359415 /nfs/dbraw/zinc/35/94/15/941359415.db2.gz DWAWQLXUZUMCQK-OAQYLSRUSA-N 0 3 401.428 4.361 20 0 HIADHN COc1ccc(CCN[C@H](c2cnn(C)c2)c2cccc(F)c2)c(Cl)c1OC ZINC000550858247 941375043 /nfs/dbraw/zinc/37/50/43/941375043.db2.gz ORLKAMUCJPQTKO-FQEVSTJZSA-N 0 3 403.885 4.152 20 0 HIADHN Fc1ccc([C@H](NC[C@H]2CCCCN2Cc2cccc(Cl)c2)c2nnc[nH]2)cc1 ZINC000551050350 941400951 /nfs/dbraw/zinc/40/09/51/941400951.db2.gz FXCMCKWHMHSMBG-RTWAWAEBSA-N 0 3 413.928 4.331 20 0 HIADHN Cc1cccc(C(C)C)c1NC(=O)CN[C@@H]1CCN(C)[C@H]1c1ccc(F)c(F)c1 ZINC000551066576 941403804 /nfs/dbraw/zinc/40/38/04/941403804.db2.gz UCRCCOZNMUDIQU-OFNKIYASSA-N 0 3 401.501 4.370 20 0 HIADHN Cc1cccc(C(C)C)c1NC(=O)CN[C@H]1CCN(C)[C@@H]1c1ccc(F)c(F)c1 ZINC000551066575 941403870 /nfs/dbraw/zinc/40/38/70/941403870.db2.gz UCRCCOZNMUDIQU-NZQKXSOJSA-N 0 3 401.501 4.370 20 0 HIADHN Cc1cccc(C(C)C)c1NC(=O)CN[C@@H]1CCN(C)[C@@H]1c1ccc(F)c(F)c1 ZINC000551066574 941403984 /nfs/dbraw/zinc/40/39/84/941403984.db2.gz UCRCCOZNMUDIQU-NFBKMPQASA-N 0 3 401.501 4.370 20 0 HIADHN OC[C@@H](N[C@@H]1COc2ccccc2C1)c1ccc(Br)cc1C(F)(F)F ZINC000551174483 941422176 /nfs/dbraw/zinc/42/21/76/941422176.db2.gz COACREDBHZETLJ-XJKSGUPXSA-N 0 3 416.237 4.095 20 0 HIADHN FC(F)COc1cccc(CNCc2cccc(I)c2)c1 ZINC000551185637 941424700 /nfs/dbraw/zinc/42/47/00/941424700.db2.gz ZCTGSBKRHFDPSP-UHFFFAOYSA-N 0 3 403.210 4.225 20 0 HIADHN O=C(NC[C@@H]1CCCCN1Cc1ccccc1)Nc1ccc(Oc2cccnc2)nc1 ZINC000551393331 941468613 /nfs/dbraw/zinc/46/86/13/941468613.db2.gz MIXYGURHELLGTE-NRFANRHFSA-N 0 3 417.513 4.445 20 0 HIADHN CC(C)c1ccccc1OC[C@@H](O)CN[C@@H](c1cncc(Br)c1)C1CC1 ZINC000551419117 941474825 /nfs/dbraw/zinc/47/48/25/941474825.db2.gz TVHJFLFZAXDHAD-GHTZIAJQSA-N 0 3 419.363 4.448 20 0 HIADHN COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NCC(=O)Nc1ccccc1-c1ccccc1 ZINC000551421981 941475782 /nfs/dbraw/zinc/47/57/82/941475782.db2.gz MXCOWNAYSJSQEH-AUSIDOKSSA-N 0 3 416.521 4.302 20 0 HIADHN Cc1ccc([C@H](NC[C@H]2CN(Cc3ccccc3)CCCO2)c2ccccn2)cc1 ZINC000551448649 941481244 /nfs/dbraw/zinc/48/12/44/941481244.db2.gz WOIOEVBFXJSMCP-AHWVRZQESA-N 0 3 401.554 4.360 20 0 HIADHN COc1nc2ccccc2cc1CNc1ccc(C(=O)N(C)[C@@H]2CCCN(C)C2)cc1 ZINC000551451511 941482082 /nfs/dbraw/zinc/48/20/82/941482082.db2.gz MWBBORVEIUWMIT-JOCHJYFZSA-N 0 3 418.541 4.022 20 0 HIADHN COc1cccc(C(=O)CCCC(=O)N[C@H]2CCN(Cc3ccccc3)[C@@H](C)C2)c1 ZINC000551468776 941486335 /nfs/dbraw/zinc/48/63/35/941486335.db2.gz KLJZYASWCQYDFC-UGKGYDQZSA-N 0 3 408.542 4.218 20 0 HIADHN COc1ncc([C@@H](C)N[C@@H](C)c2cc(F)ccc2N2CCN(C)CC2)cc1Cl ZINC000551530199 941496086 /nfs/dbraw/zinc/49/60/86/941496086.db2.gz OZEOGWWUDOGIOW-CABCVRRESA-N 0 3 406.933 4.046 20 0 HIADHN O=C(NCC(F)(F)F)C1CCN(Cc2cnc(-c3ccc(Cl)cc3)s2)CC1 ZINC000551556098 941500341 /nfs/dbraw/zinc/50/03/41/941500341.db2.gz DEAQLLUIBRFRBN-UHFFFAOYSA-N 0 3 417.884 4.354 20 0 HIADHN C[C@@H](CC(=O)Nc1ccc(OC(F)(F)F)cc1)NCc1ccnc(OC(F)F)c1 ZINC000551570100 941504006 /nfs/dbraw/zinc/50/40/06/941504006.db2.gz BAIFBTOBOXQNRL-NSHDSACASA-N 0 3 419.350 4.089 20 0 HIADHN COc1ccc([C@@H](NCc2cccc(N3C(=O)N[C@@](C)(C4CC4)C3=O)c2)C2CC2)cc1 ZINC000551572771 941504769 /nfs/dbraw/zinc/50/47/69/941504769.db2.gz KDMDKLUJOVDJTQ-DHLKQENFSA-N 0 3 419.525 4.161 20 0 HIADHN CC(C)n1ncc2cc(CN[C@H](c3cncc(Br)c3)C3CC3)cnc21 ZINC000551615012 941512843 /nfs/dbraw/zinc/51/28/43/941512843.db2.gz LEACZACJAAIANA-SFHVURJKSA-N 0 3 400.324 4.411 20 0 HIADHN C[C@H]1CN(C2CC2)C[C@@H]1NC(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000551641375 941517065 /nfs/dbraw/zinc/51/70/65/941517065.db2.gz YBFKUUWSPOZXSZ-ZBEGNZNMSA-N 0 3 423.401 4.348 20 0 HIADHN COCC[C@@H](N[C@H]1CCCN(CC(F)(F)F)C1=O)c1ccc(Cl)c(Cl)c1 ZINC000551724177 941533714 /nfs/dbraw/zinc/53/37/14/941533714.db2.gz MRGPADGYGLMKPE-CABCVRRESA-N 0 3 413.267 4.214 20 0 HIADHN CCCc1noc2nc(C3CC3)cc(C(=O)N[C@@H](CN(C)C)c3ccc(OC)cc3)c12 ZINC000551795690 941546138 /nfs/dbraw/zinc/54/61/38/941546138.db2.gz PXLGAMRARPMOMR-NRFANRHFSA-N 0 3 422.529 4.094 20 0 HIADHN O=C(c1cc(Br)cs1)N1CCN(c2ccnc3ccccc32)CC1 ZINC000552007345 941567828 /nfs/dbraw/zinc/56/78/28/941567828.db2.gz WQLXMQUOAREFIH-UHFFFAOYSA-N 0 3 402.317 4.021 20 0 HIADHN Cc1ccc(-c2nc(CC(=O)N3CCN(c4ccnc5ccccc54)CC3)cs2)o1 ZINC000552008761 941567989 /nfs/dbraw/zinc/56/79/89/941567989.db2.gz YZVBMTZFMLALSI-UHFFFAOYSA-N 0 3 418.522 4.151 20 0 HIADHN O=C(c1cnn(-c2ccc(Cl)cc2)c1)N1CCN(c2ccnc3ccccc32)CC1 ZINC000552008906 941568531 /nfs/dbraw/zinc/56/85/31/941568531.db2.gz GLGRVLWXNCMOQB-UHFFFAOYSA-N 0 3 417.900 4.036 20 0 HIADHN CO[C@@H]1C[C@@H](c2ccccc2)CC[C@@H]1NCC(=O)Nc1ccc(N2CCCC2)cc1C ZINC000552058699 941576582 /nfs/dbraw/zinc/57/65/82/941576582.db2.gz WSLYJBQKHKQELZ-GVXSCFBNSA-N 0 3 421.585 4.475 20 0 HIADHN CNC(=O)COc1cccc(CN[C@@H](CSC)c2ccc(C(F)(F)F)cc2)c1 ZINC000552074234 941580019 /nfs/dbraw/zinc/58/00/19/941580019.db2.gz GUNMPSPTPWPKJK-SFHVURJKSA-N 0 3 412.477 4.024 20 0 HIADHN O=C([C@@H]1CN(Cc2ccccc2)CCC1(F)F)N(CCC(F)(F)F)CC1CC1 ZINC000552077213 941580664 /nfs/dbraw/zinc/58/06/64/941580664.db2.gz AFAVMQRFPSGPRH-KRWDZBQOSA-N 0 3 404.423 4.335 20 0 HIADHN CC[C@H](N[C@H](C)c1cccc(N2CCCS2(=O)=O)c1)c1ccc(OC)c(OC)c1 ZINC000552090437 941583185 /nfs/dbraw/zinc/58/31/85/941583185.db2.gz KCTRDZWQFPHCFB-UZLBHIALSA-N 0 3 418.559 4.046 20 0 HIADHN Cc1c([C@@H](C)NCCn2cc(Br)cn2)cnn1-c1cc(C)ccc1C ZINC000552096809 941584127 /nfs/dbraw/zinc/58/41/27/941584127.db2.gz LBSCEDLNDAJEQD-OAHLLOKOSA-N 0 3 402.340 4.107 20 0 HIADHN Cc1ccc(OCc2ccc(C(=O)N(C)CCCN(C)Cc3ccncc3)o2)c(C)c1 ZINC000552112648 941587330 /nfs/dbraw/zinc/58/73/30/941587330.db2.gz NXJMQRUWYMTTJV-UHFFFAOYSA-N 0 3 421.541 4.465 20 0 HIADHN COc1cc(CN2CCC[C@H](O)CC2)ccc1OCCOc1ccccc1Cl ZINC000552147156 941593811 /nfs/dbraw/zinc/59/38/11/941593811.db2.gz OKYFHHNRKAUXQA-SFHVURJKSA-N 0 3 405.922 4.153 20 0 HIADHN C[C@@H](NC(=O)c1cccc(C(=O)Nc2ccccc2)c1)[C@H](c1ccccc1)N(C)C ZINC000552162748 941595644 /nfs/dbraw/zinc/59/56/44/941595644.db2.gz FPYKHRJYSMTAPK-WZONZLPQSA-N 0 3 401.510 4.360 20 0 HIADHN O=C(NCc1nc2ccccc2n1C1CC1)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000552162755 941595691 /nfs/dbraw/zinc/59/56/91/941595691.db2.gz FYSUMPGJZZJZBX-LJQANCHMSA-N 0 3 424.495 4.145 20 0 HIADHN CC[C@H](N[C@H](C)c1ccc(S(=O)(=O)NC)cc1)c1ccc(OC(F)(F)F)cc1 ZINC000552250101 941614030 /nfs/dbraw/zinc/61/40/30/941614030.db2.gz VCPOFDPEEODDLP-ACJLOTCBSA-N 0 3 416.465 4.295 20 0 HIADHN COc1ccc(NC(=O)CN[C@@H]2CC[C@H](c3ccccc3)C[C@@H]2OC)cc1Cl ZINC000552258630 941615801 /nfs/dbraw/zinc/61/58/01/941615801.db2.gz RNQJQZVTQKBCNU-SCWSEQNSSA-N 0 3 402.922 4.228 20 0 HIADHN OC[C@@H](CN[C@@H](c1ncc[nH]1)C1CCCCC1)Cc1ccccc1OC(F)(F)F ZINC000552270757 941619348 /nfs/dbraw/zinc/61/93/48/941619348.db2.gz BIIUWXXQMMUBNL-DNVCBOLYSA-N 0 3 411.468 4.371 20 0 HIADHN C[C@H]1CSc2ccc(Br)cc2[C@H]1NCC1(S(C)(=O)=O)CCCC1 ZINC000552338645 941637852 /nfs/dbraw/zinc/63/78/52/941637852.db2.gz LAWKOKPWSYDCPC-LRDDRELGSA-N 0 3 418.422 4.179 20 0 HIADHN O=C(N[C@H](c1cncc(Br)c1)C1CC1)c1cccc(CN2CCCC2)c1 ZINC000552416427 941664961 /nfs/dbraw/zinc/66/49/61/941664961.db2.gz UPJUJQIFBYJHJL-FQEVSTJZSA-N 0 3 414.347 4.321 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)c2ccc(-c3ccc(C(C)=O)cc3)o2)cc1 ZINC000552468247 941679755 /nfs/dbraw/zinc/67/97/55/941679755.db2.gz GRTUNHSJFQEKRX-OAQYLSRUSA-N 0 3 406.482 4.191 20 0 HIADHN CNC(=O)CCOC1CCN(Cc2cccc(OCc3ccccc3Cl)c2)CC1 ZINC000552488178 941686339 /nfs/dbraw/zinc/68/63/39/941686339.db2.gz VMDNBKCLVQXOAU-UHFFFAOYSA-N 0 3 416.949 4.036 20 0 HIADHN O[C@H](CNCc1ccc(Oc2cccnc2)c(F)c1)COc1ccc(Cl)cc1 ZINC000552493925 941688863 /nfs/dbraw/zinc/68/88/63/941688863.db2.gz PLKBYXNHBHAMEL-QGZVFWFLSA-N 0 3 402.853 4.196 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)[C@H]1C[C@@H]1c1cccc(C(F)(F)F)c1 ZINC000552514823 941691994 /nfs/dbraw/zinc/69/19/94/941691994.db2.gz OZDNCHHKPIBBLX-ZCNNSNEGSA-N 0 3 404.432 4.014 20 0 HIADHN CO[C@@H]1CCC[C@@H](C(=O)N(Cc2ccccc2Br)C2CCN(C)CC2)C1 ZINC000552748255 941751245 /nfs/dbraw/zinc/75/12/45/941751245.db2.gz ORHXLUSURWNWQQ-VQIMIIECSA-N 0 3 423.395 4.077 20 0 HIADHN Fc1ccc(C2(NCc3ccc(I)cc3)CCOCC2)cc1 ZINC000552832087 941780180 /nfs/dbraw/zinc/78/01/80/941780180.db2.gz PUXZCSJUVGBNSX-UHFFFAOYSA-N 0 3 411.258 4.226 20 0 HIADHN COc1ccccc1[C@H]1CC[C@@H](C)CN1C(=O)CC1(N2CCOCC2)CCCC1 ZINC000552887973 941798137 /nfs/dbraw/zinc/79/81/37/941798137.db2.gz JJLKKJHHGGKIRN-TZIWHRDSSA-N 0 3 400.563 4.030 20 0 HIADHN CCCN(C)[C@H](CNC(=O)[C@H]1CCCN(C(=O)[C@@H](C)CC)C1)c1ccc(Cl)cc1 ZINC000553027452 941819683 /nfs/dbraw/zinc/81/96/83/941819683.db2.gz ZUBYLJWZKHUZSO-HFSMHLIXSA-N 0 3 422.013 4.124 20 0 HIADHN CCCN(C)[C@H](CNC(=O)c1c(F)ccc(OC)c1OC)c1ccc(Cl)cc1 ZINC000553030621 941820453 /nfs/dbraw/zinc/82/04/53/941820453.db2.gz ZKBREIYTZVFVPI-QGZVFWFLSA-N 0 3 408.901 4.309 20 0 HIADHN CN1CCN(C(=O)c2cccc(CN3CCCC3)c2)c2ccc(Br)cc21 ZINC000553064265 941827282 /nfs/dbraw/zinc/82/72/82/941827282.db2.gz KCWHHBQMABZTSG-UHFFFAOYSA-N 0 3 414.347 4.142 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)c1ccc(OCc2cscn2)c(OC)c1 ZINC000553153232 941841613 /nfs/dbraw/zinc/84/16/13/941841613.db2.gz IRGALGWFSGQSGV-UHFFFAOYSA-N 0 3 417.575 4.069 20 0 HIADHN O=C1NC(CC(F)(F)F)C(=O)N1c1cccc(-c2ccc(Br)cc2)c1 ZINC000553164837 941842908 /nfs/dbraw/zinc/84/29/08/941842908.db2.gz PQMGOVVTXNUTDC-AWEZNQCLSA-N 0 3 413.193 4.493 20 0 HIADHN O=C1NC(CC(F)(F)F)C(=O)N1c1cccc(-c2ccc(Br)cc2)c1 ZINC000553164838 941842973 /nfs/dbraw/zinc/84/29/73/941842973.db2.gz PQMGOVVTXNUTDC-CQSZACIVSA-N 0 3 413.193 4.493 20 0 HIADHN C/C=C\c1ccc(OC[C@@H](O)CNCc2ccc(Br)s2)c(OC)c1 ZINC000553199871 941848404 /nfs/dbraw/zinc/84/84/04/941848404.db2.gz VRMGUTBYVMRJSL-NQHOJNORSA-N 0 3 412.349 4.082 20 0 HIADHN CCN(CC(=O)N(C)[C@@H](C)c1ccc(F)c(F)c1)[C@@H](C)Cc1ccc(OC)cc1 ZINC000553317485 941866518 /nfs/dbraw/zinc/86/65/18/941866518.db2.gz WCBUXJAKMGWNQM-IRXDYDNUSA-N 0 3 404.501 4.446 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)CCc2ncc(-c3ccccc3)o2)N(C)C)cc1 ZINC000553673439 941941904 /nfs/dbraw/zinc/94/19/04/941941904.db2.gz UGVHWMJWLGAIJO-JOCHJYFZSA-N 0 3 421.541 4.481 20 0 HIADHN CCOc1ccc(-c2nc(CC)c(C(=O)N3CC[C@@H](N4CCCC4)[C@@H]3C)s2)cc1 ZINC000553775500 941965540 /nfs/dbraw/zinc/96/55/40/941965540.db2.gz XCRLGBWCOAEBQN-OXJNMPFZSA-N 0 3 413.587 4.470 20 0 HIADHN Cc1cc(C)c(CN2CCC[C@@H](C(=O)NCC3CC3)C2)c(OCc2ccccc2)n1 ZINC000553864381 941986975 /nfs/dbraw/zinc/98/69/75/941986975.db2.gz XFCGPQNAXGJZFI-JOCHJYFZSA-N 0 3 407.558 4.016 20 0 HIADHN OCC[C@@H](NC[C@H](O)COc1c(Cl)cccc1Cl)c1ccc(Cl)cc1 ZINC000553959567 942007364 /nfs/dbraw/zinc/00/73/64/942007364.db2.gz YPYRWFSLAWCNIZ-WMLDXEAASA-N 0 3 404.721 4.100 20 0 HIADHN CC1CCN([C@@H](CN2C(=O)[C@H]3c4ccccc4CCN3C2=O)c2cccs2)CC1 ZINC000554034949 942022636 /nfs/dbraw/zinc/02/26/36/942022636.db2.gz PZLVWIBGASOFBU-PZJWPPBQSA-N 0 3 409.555 4.083 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1cccc(C(=O)NC(C)(C)C)c1)c1ccco1 ZINC000554133389 942045840 /nfs/dbraw/zinc/04/58/40/942045840.db2.gz WAXMFVFJHVCYQA-MAUKXSAKSA-N 0 3 400.523 4.059 20 0 HIADHN CN(C)C[C@H](NC(=O)Nc1ccccc1OC[C@@H]1CCCCO1)c1ccc(F)cc1 ZINC000554192162 942063364 /nfs/dbraw/zinc/06/33/64/942063364.db2.gz WRWKQBMIBHENOZ-FPOVZHCZSA-N 0 3 415.509 4.198 20 0 HIADHN C[C@H](CN(C(=O)NC[C@@H](c1cccs1)N1CCCC1)[C@@H](C)CO)c1ccccc1 ZINC000554218611 942071104 /nfs/dbraw/zinc/07/11/04/942071104.db2.gz OUTUOQIJAWNOQU-DYXWJJEUSA-N 0 3 415.603 4.081 20 0 HIADHN CCCN(C(=O)c1cccs1)C1CCN(C[C@@H](O)Cc2cccc(Cl)c2)CC1 ZINC000554236028 942074228 /nfs/dbraw/zinc/07/42/28/942074228.db2.gz MEFJATXCDKBOQK-FQEVSTJZSA-N 0 3 421.006 4.322 20 0 HIADHN Cc1cccc(-c2nn(-c3ccccc3)cc2C(=O)N(C)[C@@H]2CCN(C3CC3)C2)c1 ZINC000554328220 942105458 /nfs/dbraw/zinc/10/54/58/942105458.db2.gz PGXFVUDGZDJDDG-JOCHJYFZSA-N 0 3 400.526 4.156 20 0 HIADHN Cc1cccc(-c2nn(-c3ccccc3)cc2C(=O)N(C)[C@H]2CCN(C3CC3)C2)c1 ZINC000554328240 942105618 /nfs/dbraw/zinc/10/56/18/942105618.db2.gz PGXFVUDGZDJDDG-QFIPXVFZSA-N 0 3 400.526 4.156 20 0 HIADHN CC(C)Cc1ccc([C@H](CNC(=O)Nc2ccc3c(c2)NC(=O)[C@@H](C)O3)N(C)C)cc1 ZINC000554366283 942116046 /nfs/dbraw/zinc/11/60/46/942116046.db2.gz ZNHPOCMEJKCJAN-IERDGZPVSA-N 0 3 424.545 4.029 20 0 HIADHN CC(C)Cc1ccc([C@H](CNC(=O)Nc2ccc3c(c2)NC(=O)[C@H](C)O3)N(C)C)cc1 ZINC000554366285 942116358 /nfs/dbraw/zinc/11/63/58/942116358.db2.gz ZNHPOCMEJKCJAN-KKSFZXQISA-N 0 3 424.545 4.029 20 0 HIADHN C[C@@H](N[C@@H]1CCCN(S(=O)(=O)c2cccs2)C1)c1ccc(Cl)c(F)c1 ZINC000554370465 942116863 /nfs/dbraw/zinc/11/68/63/942116863.db2.gz RCRPDYSWGJZUDS-TZMCWYRMSA-N 0 3 402.944 4.045 20 0 HIADHN O=C(CCC(F)(F)F)N1CCC[C@@H](N[C@H]2CCCc3nn(-c4ccccc4)cc32)C1 ZINC000554376807 942118692 /nfs/dbraw/zinc/11/86/92/942118692.db2.gz WPVXQFZDFUENCJ-APWZRJJASA-N 0 3 420.479 4.173 20 0 HIADHN Cc1nn(C)c2sc([C@H](C)N[C@@H]3CC(=O)N(C)[C@H]3c3ccc(Cl)c(F)c3)cc12 ZINC000554385128 942121571 /nfs/dbraw/zinc/12/15/71/942121571.db2.gz RNYVRPAFDFUKFQ-MAAWUACBSA-N 0 3 420.941 4.358 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)NCc1c(C)nn(-c2ccccc2)c1C)c1ccco1 ZINC000554476676 942155960 /nfs/dbraw/zinc/15/59/60/942155960.db2.gz YVBZWPNASXZWPG-IERDGZPVSA-N 0 3 409.534 4.011 20 0 HIADHN CC(=O)N(Cc1ccc(NC(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)cc1)C(C)C ZINC000554476411 942156046 /nfs/dbraw/zinc/15/60/46/942156046.db2.gz VXIKEMKCECRLNT-JPYJTQIMSA-N 0 3 410.562 4.256 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)c1nn(-c2ccccc2C)c2c1CCC2)c1ccco1 ZINC000554632019 942180731 /nfs/dbraw/zinc/18/07/31/942180731.db2.gz JNGNLOONEZHMDI-IEBWSBKVSA-N 0 3 406.530 4.122 20 0 HIADHN Cc1c(C(=O)N[C@@H](CN(C)C)c2ccc(F)cc2)cnn1-c1cccc(Cl)c1 ZINC000554656434 942189542 /nfs/dbraw/zinc/18/95/42/942189542.db2.gz ZREZWYSWTBDDDT-FQEVSTJZSA-N 0 3 400.885 4.006 20 0 HIADHN Cc1ccc(C(=O)N[C@H](CN(C)C)c2ccc(F)cc2)cc1NC(=O)c1ccccc1 ZINC000554656389 942189910 /nfs/dbraw/zinc/18/99/10/942189910.db2.gz ZDIOEJYQEKEDLL-HSZRJFAPSA-N 0 3 419.500 4.419 20 0 HIADHN COc1ccc([C@@H](C)NCc2cccc(I)c2)c(C)c1OC ZINC000554720196 942210133 /nfs/dbraw/zinc/21/01/33/942210133.db2.gz XLPYFJHOILIJGL-CYBMUJFWSA-N 0 3 411.283 4.468 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)c2nc3ccccc3cc2Br)o1 ZINC000554728396 942213914 /nfs/dbraw/zinc/21/39/14/942213914.db2.gz SDZKNJDBQWBNJZ-UHFFFAOYSA-N 0 3 416.319 4.103 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)Nc1cc(F)ccc1OC[C@@H]1CCCO1 ZINC000554751121 942221515 /nfs/dbraw/zinc/22/15/15/942221515.db2.gz QFOAWCHEGQZRDY-XLIONFOSSA-N 0 3 415.509 4.026 20 0 HIADHN CN(C)c1noc([C@H]2CCCN(CCOC(c3ccccc3)c3ccccc3)C2)n1 ZINC000554830278 942269363 /nfs/dbraw/zinc/26/93/63/942269363.db2.gz LGIHOUSZPTVFKS-NRFANRHFSA-N 0 3 406.530 4.121 20 0 HIADHN COC(=O)c1cc(CN[C@@H]2c3cc(Br)ccc3SC[C@@H]2C)cn1C ZINC000554855276 942291800 /nfs/dbraw/zinc/29/18/00/942291800.db2.gz OIRAULHRCIFECZ-GTNSWQLSSA-N 0 3 409.349 4.147 20 0 HIADHN COc1ccc(-c2cncc(C(=O)N3CCN(c4ccnc5ccccc54)CC3)c2)cc1 ZINC000554862531 942295529 /nfs/dbraw/zinc/29/55/29/942295529.db2.gz LJSUSRSPUSOHBO-UHFFFAOYSA-N 0 3 424.504 4.268 20 0 HIADHN Cc1cc(NC(=O)NCC(C)(C)C(F)(F)F)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000554866101 942299435 /nfs/dbraw/zinc/29/94/35/942299435.db2.gz CNHVSXPXWDKZCZ-QGZVFWFLSA-N 0 3 423.483 4.349 20 0 HIADHN CN(C)C[C@H](NC(=O)Nc1ccc(OC[C@@H]2CCCO2)cc1)c1ccc(Cl)cc1 ZINC000554909507 942316028 /nfs/dbraw/zinc/31/60/28/942316028.db2.gz FHXJUPDDPQDINK-SFTDATJTSA-N 0 3 417.937 4.322 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)c1ncsc1C(F)(F)F ZINC000554960124 942334065 /nfs/dbraw/zinc/33/40/65/942334065.db2.gz ZGEXNMVEGUKUFM-CQSZACIVSA-N 0 3 421.448 4.058 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)Nc3ccc(-c4ccccn4)cc3)CC2)C[C@H](C)O1 ZINC000555013596 942356732 /nfs/dbraw/zinc/35/67/32/942356732.db2.gz UENNTSWOYPXXEK-OALUTQOASA-N 0 3 408.546 4.102 20 0 HIADHN CCSc1nccnc1-c1noc([C@H]2CN(Cc3ccccc3)CCC2(F)F)n1 ZINC000555019120 942358377 /nfs/dbraw/zinc/35/83/77/942358377.db2.gz GBRYSAFIGPITKE-OAHLLOKOSA-N 0 3 417.485 4.263 20 0 HIADHN CCn1c(CSc2ccccc2OC)nnc1N1CCN(C2CCCCC2)CC1 ZINC000555048571 942369779 /nfs/dbraw/zinc/36/97/79/942369779.db2.gz RPSXFHRUJVRUCN-UHFFFAOYSA-N 0 3 415.607 4.054 20 0 HIADHN CCCOCc1ccccc1CNC(=O)N[C@H](CN(C)C)c1ccc(Cl)cc1 ZINC000555075195 942378197 /nfs/dbraw/zinc/37/81/97/942378197.db2.gz PXWZENLDAGQRRX-OAQYLSRUSA-N 0 3 403.954 4.369 20 0 HIADHN CC[C@@H]1CCCCN1C(=O)[C@H](C)N[C@@H]1CCN(CC)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000555125941 942392613 /nfs/dbraw/zinc/39/26/13/942392613.db2.gz SCBKMVDVROMGJQ-IHLUGKFPSA-N 0 3 411.512 4.008 20 0 HIADHN CC(C)N1CC[C@H](N[C@@H](C)C(=O)N(C)Cc2ccccc2)[C@H]1c1ccc(F)c(F)c1 ZINC000555125674 942392901 /nfs/dbraw/zinc/39/29/01/942392901.db2.gz LKKBZOPHZPZGDA-PDIWNELESA-N 0 3 415.528 4.125 20 0 HIADHN CCN1CC[C@H](NCC(=O)N(C)[C@@H](C)c2ccccc2)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000555129054 942394937 /nfs/dbraw/zinc/39/49/37/942394937.db2.gz JPXYUJDFRZPBOR-RSDPBLMXSA-N 0 3 419.491 4.048 20 0 HIADHN COc1cccc([C@H]2[C@H](NCC(=O)Nc3c(C)cc(C)cc3C)CCN2C2CC2)c1 ZINC000555130084 942394966 /nfs/dbraw/zinc/39/49/66/942394966.db2.gz QIBOEEYBQFXZIC-RDGATRHJSA-N 0 3 407.558 4.127 20 0 HIADHN CCc1ccc(NC(=O)CN[C@@H]2CCN(CC)[C@H]2c2cc(F)c(F)c(F)c2)cc1 ZINC000555132214 942396784 /nfs/dbraw/zinc/39/67/84/942396784.db2.gz TWTLSMYQXLTBGB-KNQAVFIVSA-N 0 3 405.464 4.030 20 0 HIADHN CCOc1ccc(NC(=O)CN[C@H]2CCN(C(C)C)[C@@H]2c2ccc(F)c(F)c2)cc1 ZINC000555133284 942397487 /nfs/dbraw/zinc/39/74/87/942397487.db2.gz QWVVZFOIHDFGJF-JTHBVZDNSA-N 0 3 417.500 4.116 20 0 HIADHN CCc1nc2cc(CN[C@@H](CN3CCOCC3)c3ccccc3C)ccc2n1C1CC1 ZINC000555232792 942438758 /nfs/dbraw/zinc/43/87/58/942438758.db2.gz MKYPCLVIENQTOH-DEOSSOPVSA-N 0 3 418.585 4.405 20 0 HIADHN CC(C)C1CCC(N2CCN([C@H]3CCN([C@H](C)c4ccc(F)cc4)C3=O)CC2)CC1 ZINC000555379624 942503978 /nfs/dbraw/zinc/50/39/78/942503978.db2.gz BEHCLAIHUFWORZ-VAUYKUKKSA-N 0 3 415.597 4.320 20 0 HIADHN C[C@H](c1ccc(F)cc1)N1CC[C@H](N[C@@H]2CCN(C)[C@H]2c2ccc(Cl)cc2)C1=O ZINC000555527835 942629332 /nfs/dbraw/zinc/62/93/32/942629332.db2.gz TVFJJBOFUACHAD-JAPHVTHTSA-N 0 3 415.940 4.176 20 0 HIADHN c1coc(COCc2cccc(CN[C@@H]3CCCc4c3cnn4-c3ncccn3)c2)c1 ZINC000555595450 942660463 /nfs/dbraw/zinc/66/04/63/942660463.db2.gz JVQKZIFBDTWYCZ-JOCHJYFZSA-N 0 3 415.497 4.139 20 0 HIADHN C[C@@H](Cc1cnc2ccccc2n1)C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000555618854 942673337 /nfs/dbraw/zinc/67/33/37/942673337.db2.gz ZIMURATWJIMRGK-SFHVURJKSA-N 0 3 420.582 4.038 20 0 HIADHN CC[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)NCCCCN1C[C@@H](C)O[C@H](C)C1 ZINC000555852509 942753867 /nfs/dbraw/zinc/75/38/67/942753867.db2.gz APPDYCBSRCBFEF-ZHALLVOQSA-N 0 3 414.512 4.280 20 0 HIADHN CN(C)CCN1C[C@H](C(=O)Nc2ccc(Cl)cc2-c2ccccc2Cl)CC1=O ZINC000556077841 942801996 /nfs/dbraw/zinc/80/19/96/942801996.db2.gz UVNCHJRWCNLTKD-CQSZACIVSA-N 0 3 420.340 4.009 20 0 HIADHN CCc1sc(C(=O)N(Cc2ccco2)C2CCN(C)CC2)cc1Br ZINC000556127691 942808070 /nfs/dbraw/zinc/80/80/70/942808070.db2.gz PBAINMPTOUWYAM-UHFFFAOYSA-N 0 3 411.365 4.403 20 0 HIADHN O=C(Nc1ccccc1)N1CC[C@H](N[C@H]2CCc3sc(Br)cc32)C1 ZINC000556177629 942814651 /nfs/dbraw/zinc/81/46/51/942814651.db2.gz FHJUVZRPJYZZOO-ZFWWWQNUSA-N 0 3 406.349 4.394 20 0 HIADHN CC(C)NC(=O)Nc1ccc([C@H](C)N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)cc1 ZINC000556247060 942825894 /nfs/dbraw/zinc/82/58/94/942825894.db2.gz YAJCTMPNKHSBHV-FGTMMUONSA-N 0 3 408.546 4.233 20 0 HIADHN CS[C@@H]1CN(C(=O)c2ccccc2-c2ncc(-c3ccccc3)o2)C[C@H]1N(C)C ZINC000556279539 942831532 /nfs/dbraw/zinc/83/15/32/942831532.db2.gz OJRZZWYDKGAPJE-TZIWHRDSSA-N 0 3 407.539 4.126 20 0 HIADHN CC(C)(NCC(=O)N1CCC(C(=O)Nc2ccccc2)CC1)c1ccc(Cl)cc1 ZINC000556281640 942832392 /nfs/dbraw/zinc/83/23/92/942832392.db2.gz RHQNNDWZGFWTSW-UHFFFAOYSA-N 0 3 413.949 4.042 20 0 HIADHN CN(C)Cc1ccc(S(=O)(=O)Nc2c(Cl)cc(F)cc2Br)cc1 ZINC000556303616 942836658 /nfs/dbraw/zinc/83/66/58/942836658.db2.gz WEZAZBFTEVCEFJ-UHFFFAOYSA-N 0 3 421.719 4.104 20 0 HIADHN CN(C(=O)c1ccc(NCc2cccc(Br)c2)cc1)[C@H]1CCCN(C)C1 ZINC000556336536 942844204 /nfs/dbraw/zinc/84/42/04/942844204.db2.gz NPMSNMYCXBHIFI-FQEVSTJZSA-N 0 3 416.363 4.227 20 0 HIADHN COc1cc(CNCc2cccc(I)c2)ccc1OC(F)F ZINC000556405429 942858362 /nfs/dbraw/zinc/85/83/62/942858362.db2.gz YSJZJCQSMUZUGC-UHFFFAOYSA-N 0 3 419.209 4.191 20 0 HIADHN Cc1cc(-c2noc([C@@H](C)NC[C@@H]3CN(Cc4ccccc4)CCCO3)n2)ccc1F ZINC000556503016 942886478 /nfs/dbraw/zinc/88/64/78/942886478.db2.gz YUTSZASVVJJUKU-WIYYLYMNSA-N 0 3 424.520 4.126 20 0 HIADHN C[C@@H](NC[C@H]1CN(Cc2ccccc2)CCCO1)c1nc2ccccc2n1C(F)F ZINC000556532226 942893007 /nfs/dbraw/zinc/89/30/07/942893007.db2.gz OPCHLJBNVCBVGV-MJGOQNOKSA-N 0 3 414.500 4.373 20 0 HIADHN C[C@@H](NCc1cccc(N2C(=O)N[C@](C)(C3CC3)C2=O)c1)c1ccc2c(c1)CCC2 ZINC000556607260 942912879 /nfs/dbraw/zinc/91/28/79/942912879.db2.gz BUMINLNBZFPQBI-PUAOIOHZSA-N 0 3 403.526 4.251 20 0 HIADHN C[C@H](NC(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1)c1nc2ccccc2[nH]1 ZINC000556613405 942915998 /nfs/dbraw/zinc/91/59/98/942915998.db2.gz WYGMPWNCQSMNSP-YCRPNKLZSA-N 0 3 416.447 4.195 20 0 HIADHN O=C(CCCCC(=O)N1CCN(c2ccnc3ccccc32)CC1)c1ccccc1 ZINC000556833197 942937870 /nfs/dbraw/zinc/93/78/70/942937870.db2.gz XQBQPSACAMSJRX-UHFFFAOYSA-N 0 3 401.510 4.327 20 0 HIADHN C[C@@H](NC[C@@H](c1ccc(Cl)cc1)N1CCc2sccc2C1)c1ccc(=O)[nH]n1 ZINC000556857513 942941220 /nfs/dbraw/zinc/94/12/20/942941220.db2.gz BQGSMRXWSVNBLZ-KUHUBIRLSA-N 0 3 414.962 4.347 20 0 HIADHN C[C@H](NCc1cccc(Cn2cnc3ccccc32)c1)c1ccc2c(c1)OCC(=O)N2 ZINC000556869793 942944839 /nfs/dbraw/zinc/94/48/39/942944839.db2.gz BGTTWIIRTBJUQO-KRWDZBQOSA-N 0 3 412.493 4.266 20 0 HIADHN C[C@H](NCc1ccc(Cn2cnc3ccccc32)cc1)c1ccc2c(c1)OCC(=O)N2 ZINC000556870887 942945771 /nfs/dbraw/zinc/94/57/71/942945771.db2.gz JVUUIXUSALAUAF-KRWDZBQOSA-N 0 3 412.493 4.266 20 0 HIADHN CO[C@@H]1C[C@@H](c2ccccc2)CC[C@H]1NCC(=O)Nc1nc(-c2ccco2)cs1 ZINC000556875385 942947677 /nfs/dbraw/zinc/94/76/77/942947677.db2.gz AKBOKXCJTULEOO-SQGPQFPESA-N 0 3 411.527 4.283 20 0 HIADHN OC[C@H](CN[C@@H](c1ncc[nH]1)C1CCCCC1)Cc1ccc(Br)cc1 ZINC000556881584 942948595 /nfs/dbraw/zinc/94/85/95/942948595.db2.gz XCWBLWKPDGSQSM-QFBILLFUSA-N 0 3 406.368 4.234 20 0 HIADHN C[C@@H](NC(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F)c1cccc(-n2cccn2)c1 ZINC000556892564 942954263 /nfs/dbraw/zinc/95/42/63/942954263.db2.gz KQEWGPOZTKPHQV-GCJKJVERSA-N 0 3 424.495 4.207 20 0 HIADHN C[C@@H](NC(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F)c1cccc(-n2cccn2)c1 ZINC000556892568 942954580 /nfs/dbraw/zinc/95/45/80/942954580.db2.gz KQEWGPOZTKPHQV-XMSQKQJNSA-N 0 3 424.495 4.207 20 0 HIADHN CNC(=O)COc1cccc(CN[C@@H](C)c2sc(-c3ccc(F)cc3)nc2C)c1 ZINC000556898103 942958037 /nfs/dbraw/zinc/95/80/37/942958037.db2.gz ULLXBVFWKBUUPZ-AWEZNQCLSA-N 0 3 413.518 4.233 20 0 HIADHN Cc1cc(Br)cc(C)c1N1CCC[C@H](N[C@@H](C)c2nccnc2C)C1 ZINC000556924108 942968256 /nfs/dbraw/zinc/96/82/56/942968256.db2.gz FXSKDXCEWZHRKE-WMZOPIPTSA-N 0 3 403.368 4.484 20 0 HIADHN Cc1cc(CCC(=O)N(C)CCCN(C)Cc2ccncc2)ccc1Br ZINC000556932885 942971720 /nfs/dbraw/zinc/97/17/20/942971720.db2.gz DOEOSONLDPPEBR-UHFFFAOYSA-N 0 3 418.379 4.066 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@@H](O)C2)c1)c1ccc(OC2CCC2)cc1Cl ZINC000557023281 942997164 /nfs/dbraw/zinc/99/71/64/942997164.db2.gz ODOGWFYLUHKTER-QGZVFWFLSA-N 0 3 400.906 4.090 20 0 HIADHN C[C@H](Cn1ccc2ccccc21)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000557041226 943002186 /nfs/dbraw/zinc/00/21/86/943002186.db2.gz AXAYGQAHQGAYPT-VNCLNFNDSA-N 0 3 407.480 4.199 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)CCc1nc(-c2ccoc2)no1)c1ccc(Cl)cc1 ZINC000557059435 943007883 /nfs/dbraw/zinc/00/78/83/943007883.db2.gz RTMZOYSCZJBCFE-SFHVURJKSA-N 0 3 416.909 4.115 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)c2ccc(C)c(Oc3ccncc3)c2)cc1 ZINC000557206874 943051792 /nfs/dbraw/zinc/05/17/92/943051792.db2.gz MGJSZGLNNZAOJD-JOCHJYFZSA-N 0 3 405.498 4.224 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)N[C@H](c1ccccc1)[C@H]1CCOC1 ZINC000557228333 943057063 /nfs/dbraw/zinc/05/70/63/943057063.db2.gz RHRQFHXTCOCICR-RBBKRZOGSA-N 0 3 415.965 4.191 20 0 HIADHN CC(C)C[C@H](NCc1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1)c1cccs1 ZINC000557271818 943064277 /nfs/dbraw/zinc/06/42/77/943064277.db2.gz FLQBIUPIMPASJY-ICSRJNTNSA-N 0 3 422.616 4.082 20 0 HIADHN O=C(Cc1cccs1)N(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000557449413 943134923 /nfs/dbraw/zinc/13/49/23/943134923.db2.gz REJYRXGAVVETPR-JOCHJYFZSA-N 0 3 405.567 4.379 20 0 HIADHN Cc1ccc(C)c(OC[C@@H](O)CNCc2ccc(Oc3cccnc3)c(F)c2)c1C ZINC000557480407 943157125 /nfs/dbraw/zinc/15/71/25/943157125.db2.gz IBYSGDDZESDTSN-FQEVSTJZSA-N 0 3 410.489 4.468 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)c1nc(COC)sc1-c1ccccc1 ZINC000557632939 943239962 /nfs/dbraw/zinc/23/99/62/943239962.db2.gz FSMKRZNVTRXYBU-UHFFFAOYSA-N 0 3 401.576 4.295 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)CCc2ccnc3ccccc23)N(C)C)cc1 ZINC000557934550 943333031 /nfs/dbraw/zinc/33/30/31/943333031.db2.gz GGYXTDCIFFPOIH-DEOSSOPVSA-N 0 3 405.542 4.374 20 0 HIADHN C[C@H]1C[C@H]1N1CCN(C(=O)c2ncoc2-c2cccc(C(F)(F)F)c2)C[C@@H](C)C1 ZINC000558021420 943358190 /nfs/dbraw/zinc/35/81/90/943358190.db2.gz CYVUAIVXAORTIF-GRDNDAEWSA-N 0 3 407.436 4.163 20 0 HIADHN C[C@@H]1C[C@H]1N1CCN(C(=O)C2(Cc3ccc(OC(F)(F)F)cc3)CC2)C[C@@H](C)C1 ZINC000558027728 943360801 /nfs/dbraw/zinc/36/08/01/943360801.db2.gz SUYJRCBCTJUGNG-FRQCXROJSA-N 0 3 410.480 4.097 20 0 HIADHN CCCN1CCN(c2ccccc2CN[C@H](C)c2nccn2-c2ccccc2)CC1 ZINC000558119793 943385414 /nfs/dbraw/zinc/38/54/14/943385414.db2.gz NSFGGILAKDVPMV-OAQYLSRUSA-N 0 3 403.574 4.255 20 0 HIADHN CN(C)Cc1cccc(NC(=O)N2CCO[C@H](c3cccc(OC(F)(F)F)c3)C2)c1 ZINC000558142190 943394697 /nfs/dbraw/zinc/39/46/97/943394697.db2.gz MNJSISNCDYKSFW-IBGZPJMESA-N 0 3 423.435 4.252 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)c1ccccc1OC1CC1 ZINC000558144986 943395469 /nfs/dbraw/zinc/39/54/69/943395469.db2.gz ANXXPTXMNIYBEQ-LJQANCHMSA-N 0 3 402.498 4.124 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)N[C@H](C)CN(C)Cc2ccccc2)c(C(F)(F)F)c1 ZINC000558190469 943423358 /nfs/dbraw/zinc/42/33/58/943423358.db2.gz OHUXOVLEMAQYTL-CQSZACIVSA-N 0 3 422.451 4.306 20 0 HIADHN Cc1cc(Oc2ncccn2)ccc1NC(=O)N[C@H]1CCN(Cc2ccccc2)[C@H]1C ZINC000558194527 943427276 /nfs/dbraw/zinc/42/72/76/943427276.db2.gz YRGBXYLWORBLQH-AVRDEDQJSA-N 0 3 417.513 4.362 20 0 HIADHN CC[C@H](N[C@@H]1CCN(Cc2ccc(OC)cc2OC)C1=O)c1cccc(Cl)c1 ZINC000558240094 943453902 /nfs/dbraw/zinc/45/39/02/943453902.db2.gz ABQOMKPFENPFDK-VQTJNVASSA-N 0 3 402.922 4.199 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1cc(N2CCCC2=O)ccc1Cl)c1ccco1 ZINC000558268756 943470424 /nfs/dbraw/zinc/47/04/24/943470424.db2.gz UDLSQTWNJHIAFF-KSSFIOAISA-N 0 3 418.925 4.311 20 0 HIADHN CCC(=O)Nc1ccc(Cl)c(NC(=O)N[C@H](CN(C)C)c2ccc(F)cc2)c1 ZINC000558290070 943486141 /nfs/dbraw/zinc/48/61/41/943486141.db2.gz DEGNPICETWUJLX-GOSISDBHSA-N 0 3 406.889 4.252 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1ccc(Cl)c(C(=O)NC2CC2)c1)c1ccco1 ZINC000558299028 943491802 /nfs/dbraw/zinc/49/18/02/943491802.db2.gz CEDDSXUABBVHIP-SCLBCKFNSA-N 0 3 418.925 4.076 20 0 HIADHN CC1CCN([C@@H](CNC(=O)N2CCCC[C@H]2c2cc[nH]n2)c2cccs2)CC1 ZINC000558381231 943537384 /nfs/dbraw/zinc/53/73/84/943537384.db2.gz LSCFHCNBMDJZET-OALUTQOASA-N 0 3 401.580 4.181 20 0 HIADHN CSc1cccnc1-c1noc([C@@H]2CN(Cc3ccccc3)CCC2(F)F)n1 ZINC000558384464 943539404 /nfs/dbraw/zinc/53/94/04/943539404.db2.gz IDRAZVKHYUCVAX-HNNXBMFYSA-N 0 3 402.470 4.478 20 0 HIADHN Fc1ccc(-n2cc(CN3C[C@H](c4ccccc4)[C@@H]4COCC[C@H]43)nn2)c(Cl)c1 ZINC000558412319 943552854 /nfs/dbraw/zinc/55/28/54/943552854.db2.gz VYJXHYSOJWIPFE-SVFBPWRDSA-N 0 3 412.896 4.064 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)NCc2ccc(-c3csc(C)n3)cc2)cc1 ZINC000558478757 943569967 /nfs/dbraw/zinc/56/99/67/943569967.db2.gz GWQVURBBTHFSFR-NRFANRHFSA-N 0 3 424.570 4.229 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)NCc2ccc(-c3csc(C)n3)cc2)cc1 ZINC000558478760 943570384 /nfs/dbraw/zinc/57/03/84/943570384.db2.gz GWQVURBBTHFSFR-OAQYLSRUSA-N 0 3 424.570 4.229 20 0 HIADHN Cc1cc(N2CCC(NCc3c(Cl)cc(Cl)cc3N(C)C)CC2)nc(C)n1 ZINC000558485581 943571913 /nfs/dbraw/zinc/57/19/13/943571913.db2.gz FPNJJCJDCPRHTG-UHFFFAOYSA-N 0 3 408.377 4.225 20 0 HIADHN COc1ccc(Cn2nc(C)c(CNC[C@@]3(C)OCCc4sccc43)c2C)cc1 ZINC000558494103 943575292 /nfs/dbraw/zinc/57/52/92/943575292.db2.gz YNLRUSSIDXSWGN-HSZRJFAPSA-N 0 3 411.571 4.196 20 0 HIADHN Cn1ccnc1COc1ccc(CN2CCC(N3CCc4cc(F)ccc43)CC2)cc1 ZINC000558730219 943633945 /nfs/dbraw/zinc/63/39/45/943633945.db2.gz ORXJKGFEUYGJBB-UHFFFAOYSA-N 0 3 420.532 4.165 20 0 HIADHN Cc1c(NC(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)noc1-c1ccccc1F ZINC000558771068 943655220 /nfs/dbraw/zinc/65/52/20/943655220.db2.gz RTBJTMTWPBZQJY-SFHVURJKSA-N 0 3 416.884 4.867 20 0 HIADHN COCCOc1cc(C)ccc1NC(=O)N[C@@H](CN(C)C)c1ccc(Cl)cc1 ZINC000558771007 943655480 /nfs/dbraw/zinc/65/54/80/943655480.db2.gz VUEJVIFKEJFCSD-IBGZPJMESA-N 0 3 405.926 4.098 20 0 HIADHN COCCCn1nccc1CN[C@@H]1CCN(C(C)C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000558781070 943661448 /nfs/dbraw/zinc/66/14/48/943661448.db2.gz KDGWKMQXCGLOJG-NHCUHLMSSA-N 0 3 408.949 4.026 20 0 HIADHN Cc1ccc(Cc2ccccn2)cc1NC(=O)NC[C@@H](Cc1ccccc1)N(C)C ZINC000558855028 943701330 /nfs/dbraw/zinc/70/13/30/943701330.db2.gz UBCKEOSYBZLOBP-HSZRJFAPSA-N 0 3 402.542 4.275 20 0 HIADHN CCn1c([C@H](C)Oc2cccc(Cl)c2)nnc1N1CCN(C2CCCC2)CC1 ZINC000558857880 943702822 /nfs/dbraw/zinc/70/28/22/943702822.db2.gz NWHLGLTZIGFXNI-INIZCTEOSA-N 0 3 403.958 4.156 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)N1CC[C@H](C(F)(F)F)C2(CCC2)C1 ZINC000558869053 943710755 /nfs/dbraw/zinc/71/07/55/943710755.db2.gz XRIBSOKTKSRVKE-INIZCTEOSA-N 0 3 419.557 4.112 20 0 HIADHN COc1cccc([C@H]2[C@@H](NCC(=O)Nc3cccc4ccccc43)CCN2C2CC2)c1 ZINC000558894285 943727784 /nfs/dbraw/zinc/72/77/84/943727784.db2.gz GLNIHMNURPXOKB-AHWVRZQESA-N 0 3 415.537 4.355 20 0 HIADHN CCN1CC[C@H](N[C@H](C)C(=O)Nc2cc(F)ccc2C)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000558898437 943732003 /nfs/dbraw/zinc/73/20/03/943732003.db2.gz SYXIRAJAWNCLIX-MPKWNAGQSA-N 0 3 423.454 4.304 20 0 HIADHN CCc1ccccc1NC(=O)CN[C@@H]1CCN(CC)[C@H]1c1ccc(Cl)c(F)c1 ZINC000558897141 943732838 /nfs/dbraw/zinc/73/28/38/943732838.db2.gz PFZFXMSDRSUFKJ-IRLDBZIGSA-N 0 3 403.929 4.405 20 0 HIADHN CCN1CC[C@H](NCC(=O)Nc2c(C)cc(C)cc2C)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000558902498 943736484 /nfs/dbraw/zinc/73/64/84/943736484.db2.gz ZGUHHVOJWXFEOO-WMZHIEFXSA-N 0 3 419.491 4.393 20 0 HIADHN CC(C)(C)N1CC[C@@H](NCC(=O)Nc2nccs2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000558902139 943736566 /nfs/dbraw/zinc/73/65/66/943736566.db2.gz MVQTYXRRVDMPON-WBVHZDCISA-N 0 3 410.946 4.078 20 0 HIADHN COc1ccc([C@H](OC)[C@H](C)NC(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)cc1 ZINC000558908459 943740953 /nfs/dbraw/zinc/74/09/53/943740953.db2.gz SXZLXUFFDSKESB-IWMITWMQSA-N 0 3 419.953 4.027 20 0 HIADHN Brc1ccc2c(c1)CCCC[C@@H]2NCc1ccc(N2CCOCC2)nc1 ZINC000558921256 943747531 /nfs/dbraw/zinc/74/75/31/943747531.db2.gz XATFOFMUMIFFHF-FQEVSTJZSA-N 0 3 416.363 4.238 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)NCC(C)(C)C(F)(F)F ZINC000558946939 943767449 /nfs/dbraw/zinc/76/74/49/943767449.db2.gz TWLCEBZACJIXJT-UHFFFAOYSA-N 0 3 413.406 4.367 20 0 HIADHN C[C@@H](CN1CCN(CC(=O)Nc2ccccc2C(F)(F)F)CC1)C1CCCCC1 ZINC000559032546 943810460 /nfs/dbraw/zinc/81/04/60/943810460.db2.gz YJOAXIDOLGWDQI-KRWDZBQOSA-N 0 3 411.512 4.478 20 0 HIADHN CCc1oc(CNC[C@H]2CCN(c3ccc(Br)cc3)C2)cc1C(=O)OC ZINC000559067787 943822076 /nfs/dbraw/zinc/82/20/76/943822076.db2.gz OFLQDDFNVCJUNO-CQSZACIVSA-N 0 3 421.335 4.007 20 0 HIADHN C[C@@H](Oc1ccccc1NC(=O)[C@@H]1CCCN(Cc2cccnc2)C1)C(F)(F)F ZINC000559099076 943838373 /nfs/dbraw/zinc/83/83/73/943838373.db2.gz BZTLTRWPRLADLM-NVXWUHKLSA-N 0 3 407.436 4.262 20 0 HIADHN CC[C@H](c1nnc(N2CCN(C3CCCC3)CC2)n1C[C@@H]1CCCO1)c1ccccc1 ZINC000559137633 943851647 /nfs/dbraw/zinc/85/16/47/943851647.db2.gz KUDMOOIILJDLQY-GOTSBHOMSA-N 0 3 423.605 4.064 20 0 HIADHN O=C(NCCN1CCCC1)c1ccc(NCc2ccc(Br)cc2F)cc1 ZINC000559229728 943881160 /nfs/dbraw/zinc/88/11/60/943881160.db2.gz SAELNGKGWHQYLZ-UHFFFAOYSA-N 0 3 420.326 4.026 20 0 HIADHN CCc1nc(-c2ccccc2NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)n[nH]1 ZINC000559352951 943906108 /nfs/dbraw/zinc/90/61/08/943906108.db2.gz NOPOEAWUQMDWKQ-QGZVFWFLSA-N 0 3 407.493 4.024 20 0 HIADHN COc1cccc(-c2ccc(CN[C@H]3CCCc4cc(S(N)(=O)=O)ccc43)cc2)c1 ZINC000559766621 944046975 /nfs/dbraw/zinc/04/69/75/944046975.db2.gz KIVOMPGPQBTJBR-DEOSSOPVSA-N 0 3 422.550 4.177 20 0 HIADHN CN1CC[C@H](NCC(=O)Nc2c(Cl)cccc2Cl)[C@@H]1c1ccc(F)c(F)c1 ZINC000559793013 944051049 /nfs/dbraw/zinc/05/10/49/944051049.db2.gz JDEMHABCQQYMDG-LPHOPBHVSA-N 0 3 414.283 4.245 20 0 HIADHN CN(C(=O)c1ccc(NCc2ccc3c(c2)CC(C)(C)O3)cc1)[C@H]1CCCN(C)C1 ZINC000559997039 944119434 /nfs/dbraw/zinc/11/94/34/944119434.db2.gz PKSXLMQTIIWZJE-QFIPXVFZSA-N 0 3 407.558 4.178 20 0 HIADHN Cc1ccc(OC(F)F)c(CNc2ccc(C(=O)N(C)[C@H]3CCCN(C)C3)cc2)c1 ZINC000559998731 944120581 /nfs/dbraw/zinc/12/05/81/944120581.db2.gz FHOSWZALOIKZCU-FQEVSTJZSA-N 0 3 417.500 4.375 20 0 HIADHN Fc1ccc(Br)cc1-c1noc([C@@H]2CCCN(Cc3cccnc3)C2)n1 ZINC000560004826 944125338 /nfs/dbraw/zinc/12/53/38/944125338.db2.gz AOVYWYMZGFFJEB-CQSZACIVSA-N 0 3 417.282 4.413 20 0 HIADHN COc1ccc(CNCc2cccc(I)c2)cc1OC(F)F ZINC000560056849 944143839 /nfs/dbraw/zinc/14/38/39/944143839.db2.gz OBDSROILQMONLI-UHFFFAOYSA-N 0 3 419.209 4.191 20 0 HIADHN COCC[C@@H](NC(=O)N[C@@H](C)C1=CCN(C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000560103716 944160711 /nfs/dbraw/zinc/16/07/11/944160711.db2.gz UTRRZLVUWRNMPT-SCLBCKFNSA-N 0 3 400.350 4.021 20 0 HIADHN COc1ccc(C[C@H](C)CN(C)CC(=O)N2CCC(OCc3ccccc3)CC2)cc1 ZINC000560110450 944162951 /nfs/dbraw/zinc/16/29/51/944162951.db2.gz IWFMAUQAVOAQCA-NRFANRHFSA-N 0 3 424.585 4.013 20 0 HIADHN CN(Cc1ccccc1)C(=O)CN[C@H](c1cccc(C(F)(F)F)c1)C1CCOCC1 ZINC000560175770 944187429 /nfs/dbraw/zinc/18/74/29/944187429.db2.gz VWVUIHSJYLYSFW-QFIPXVFZSA-N 0 3 420.475 4.421 20 0 HIADHN COC(=O)[C@H](Cc1ccccc1)[C@H](C)N[C@@H](C)C(=O)Nc1c(C)cc(C)cc1Cl ZINC000560178975 944188231 /nfs/dbraw/zinc/18/82/31/944188231.db2.gz DFMPGHRESVUSIR-JENIJYKNSA-N 0 3 416.949 4.294 20 0 HIADHN COC(=O)[C@H](Cc1ccccc1)[C@H](C)N[C@H](C)C(=O)Nc1c(C)cc(C)cc1Cl ZINC000560178976 944188402 /nfs/dbraw/zinc/18/84/02/944188402.db2.gz DFMPGHRESVUSIR-YQVWRLOYSA-N 0 3 416.949 4.294 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)[C@H]2C[C@@H]2c2ccccc2C(F)(F)F)cc1 ZINC000560245937 944205577 /nfs/dbraw/zinc/20/55/77/944205577.db2.gz MXDMRYYEQUIKBI-HBFSDRIKSA-N 0 3 406.448 4.237 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)[C@H](C)Cc2cccc(C(F)(F)F)c2)cc1 ZINC000560252748 944207678 /nfs/dbraw/zinc/20/76/78/944207678.db2.gz WMPGIUASABZDOG-FOIQADDNSA-N 0 3 408.464 4.312 20 0 HIADHN COc1ccc2c(c1)[C@H](NCc1cccc(N3C(=O)N[C@](C)(C4CC4)C3=O)c1)CCC2 ZINC000560266030 944212159 /nfs/dbraw/zinc/21/21/59/944212159.db2.gz UVLIPBGMUXMPFZ-RCZVLFRGSA-N 0 3 419.525 4.087 20 0 HIADHN C[C@H](N[C@@H](c1cncc(Br)c1)C1CC1)c1cccc(NS(C)(=O)=O)c1 ZINC000560267067 944212551 /nfs/dbraw/zinc/21/25/51/944212551.db2.gz UVHPPCGGLILITP-KPZWWZAWSA-N 0 3 424.364 4.018 20 0 HIADHN Cc1ccc([C@H](NCc2cccc(N3C(=O)N[C@@](C)(C4CC4)C3=O)c2)C2CC2)cc1 ZINC000560270915 944215200 /nfs/dbraw/zinc/21/52/00/944215200.db2.gz UPHMSFGEDXMMAY-DHLKQENFSA-N 0 3 403.526 4.461 20 0 HIADHN COc1cc(CCC(=O)Nc2ccccc2CN(C)C)ccc1OCC(F)(F)F ZINC000560360974 944228359 /nfs/dbraw/zinc/22/83/59/944228359.db2.gz NLADZESLWYNXDF-UHFFFAOYSA-N 0 3 410.436 4.269 20 0 HIADHN CN(C)Cc1ccccc1NC(=O)Cc1ccc(OCCOc2ccccc2)cc1 ZINC000560359039 944228743 /nfs/dbraw/zinc/22/87/43/944228743.db2.gz OEJFVQYYUIANFJ-UHFFFAOYSA-N 0 3 404.510 4.387 20 0 HIADHN O[C@@H](CNCc1cc(Cl)c2c(c1)OCCCO2)CO[C@@H]1CCCc2ccccc21 ZINC000560455058 944232704 /nfs/dbraw/zinc/23/27/04/944232704.db2.gz ULFXLGOYWGARNZ-GHTZIAJQSA-N 0 3 417.933 4.046 20 0 HIADHN C/C=C\c1ccc(OC[C@H](O)CN[C@H]2CCOc3c(Cl)cccc32)c(OC)c1 ZINC000560515483 944240767 /nfs/dbraw/zinc/24/07/67/944240767.db2.gz USUMLOYBJFHHDL-VRQBABSCSA-N 0 3 403.906 4.235 20 0 HIADHN COCC(=O)Nc1cccc(CN[C@@H](c2cccc(OC(F)(F)F)c2)C2CC2)c1 ZINC000560521822 944241404 /nfs/dbraw/zinc/24/14/04/944241404.db2.gz FOXUCHKXLSIGQK-HXUWFJFHSA-N 0 3 408.420 4.411 20 0 HIADHN COc1ccc([C@H](C)N[C@@H](C)c2cc(F)ccc2N2CCN(C)CC2)c(C)c1OC ZINC000560528594 944243750 /nfs/dbraw/zinc/24/37/50/944243750.db2.gz JEEAAROPGJRKMS-ROUUACIJSA-N 0 3 415.553 4.315 20 0 HIADHN COc1cc(Br)c(CN(C)CCCN(C)Cc2ccco2)cc1OC ZINC000560540779 944247479 /nfs/dbraw/zinc/24/74/79/944247479.db2.gz XLOHUDXFHCHGRF-UHFFFAOYSA-N 0 3 411.340 4.013 20 0 HIADHN CC(=O)N(c1nc(CN2CCN(C)Cc3ccccc32)cs1)c1ccc(F)cc1 ZINC000560542330 944248831 /nfs/dbraw/zinc/24/88/31/944248831.db2.gz CYHBHHOTGNCHBX-UHFFFAOYSA-N 0 3 410.518 4.419 20 0 HIADHN COc1ccc(CN2CCC(CO)(c3ccccc3)CC2)cc1OCc1cccnc1 ZINC000560557121 944253600 /nfs/dbraw/zinc/25/36/00/944253600.db2.gz QJYIGYCJYQTMIT-UHFFFAOYSA-N 0 3 418.537 4.195 20 0 HIADHN Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)NC[C@@H](N1CCOCC1)C(F)(F)F ZINC000560580760 944262462 /nfs/dbraw/zinc/26/24/62/944262462.db2.gz JRVVMDSEYPNEHK-WMLDXEAASA-N 0 3 413.509 4.341 20 0 HIADHN C[C@H](CC(=O)NCCc1ccccc1)N[C@@H](CCO)c1ccc(Cl)c(Cl)c1 ZINC000560584298 944263805 /nfs/dbraw/zinc/26/38/05/944263805.db2.gz CVQPTBFRYCDJLK-QRWLVFNGSA-N 0 3 409.357 4.144 20 0 HIADHN C[C@@H]1CCc2[nH]c3ccc(C(=O)Nc4cccc(CN5CC[C@H](O)C5)c4)cc3c2C1 ZINC000560675350 944290188 /nfs/dbraw/zinc/29/01/88/944290188.db2.gz IDJZFXPYOQJQFN-UZLBHIALSA-N 0 3 403.526 4.112 20 0 HIADHN O=C(CCCOc1cccc2ccccc21)Nc1cccc(CN2CC[C@@H](O)C2)c1 ZINC000560677749 944291212 /nfs/dbraw/zinc/29/12/12/944291212.db2.gz MCBOIQNJVGHKJI-JOCHJYFZSA-N 0 3 404.510 4.204 20 0 HIADHN O=C(CCCOc1cccc2ccccc21)Nc1cccc(CN2CC[C@H](O)C2)c1 ZINC000560677750 944291250 /nfs/dbraw/zinc/29/12/50/944291250.db2.gz MCBOIQNJVGHKJI-QFIPXVFZSA-N 0 3 404.510 4.204 20 0 HIADHN Cc1ccc2nc(C3CC3)cc(C(=O)Nc3cccc(CN4CC[C@H](O)C4)c3)c2c1 ZINC000560677852 944291351 /nfs/dbraw/zinc/29/13/51/944291351.db2.gz MVCDNVFQFFRVOS-FQEVSTJZSA-N 0 3 401.510 4.240 20 0 HIADHN CCCN(C)[C@H](CNC(=O)[C@@H](C)Cc1c(C)nn(C)c1C)c1ccc(Cl)cc1 ZINC000560710862 944304816 /nfs/dbraw/zinc/30/48/16/944304816.db2.gz YKLFKKBCQDJFHQ-YCRPNKLZSA-N 0 3 404.986 4.068 20 0 HIADHN CCCN(C)[C@H](CNC(=O)c1ccc(N(C)C(C)=O)cc1)c1ccc(Cl)cc1 ZINC000560712589 944306275 /nfs/dbraw/zinc/30/62/75/944306275.db2.gz XCKNEHMQWSIMKA-OAQYLSRUSA-N 0 3 401.938 4.136 20 0 HIADHN C[C@@H](NCc1ccc(S(=O)(=O)N2CCCC2)cc1)c1cccc(-c2ccncc2)c1 ZINC000560881932 944364865 /nfs/dbraw/zinc/36/48/65/944364865.db2.gz BWRFBUWRMASDFO-LJQANCHMSA-N 0 3 421.566 4.384 20 0 HIADHN O=C(Nc1ccnc(N2CCc3ccccc3C2)c1)c1cn[nH]c1-c1ccc(F)cc1 ZINC000561109654 944457418 /nfs/dbraw/zinc/45/74/18/944457418.db2.gz HNNVSXYMMAZCQE-UHFFFAOYSA-N 0 3 413.456 4.426 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)c1cc(C2CC2)nc2ccc(F)cc21 ZINC000561320399 944549724 /nfs/dbraw/zinc/54/97/24/944549724.db2.gz CAGCEUAGVQPLEY-IBGZPJMESA-N 0 3 405.473 4.070 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)COc1ccc(Cl)c2cccnc12)c1ccco1 ZINC000561370263 944564617 /nfs/dbraw/zinc/56/46/17/944564617.db2.gz NGMJTPDQFJXXOT-YOEHRIQHSA-N 0 3 401.894 4.106 20 0 HIADHN COc1ccc(OC)c([C@H](C)NC(=O)[C@H](C)N2C[C@H](c3ccc(F)cc3)C[C@H]2C)c1 ZINC000561391293 944574184 /nfs/dbraw/zinc/57/41/84/944574184.db2.gz AQPUMWVHQOMUSD-VUHPKUFZSA-N 0 3 414.521 4.287 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N(C)Cc1nc(-c2cccs2)no1)c1ccsc1 ZINC000561463204 944617509 /nfs/dbraw/zinc/61/75/09/944617509.db2.gz RUHKWPOIQBRKLR-HNNXBMFYSA-N 0 3 419.576 4.084 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)c1cc2cc(Br)ccc2[nH]1)c1ccco1 ZINC000561609547 944705581 /nfs/dbraw/zinc/70/55/81/944705581.db2.gz BXBPTIDOKUEVJK-PXAZEXFGSA-N 0 3 404.308 4.383 20 0 HIADHN COc1ccc(C2(C(=O)NC[C@@H](c3ccc(OC(C)C)cc3)N(C)C)CCC2)cc1 ZINC000561615157 944708847 /nfs/dbraw/zinc/70/88/47/944708847.db2.gz NLSUZSNFNNPZLX-QHCPKHFHSA-N 0 3 410.558 4.323 20 0 HIADHN CCC(CC)n1nc(C(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)cc1C ZINC000561616047 944709328 /nfs/dbraw/zinc/70/93/28/944709328.db2.gz XROSQYNIVRAYMG-JOCHJYFZSA-N 0 3 400.567 4.373 20 0 HIADHN CC(=O)Nc1cc(C(=O)N[C@H]2CCN(Cc3ccccc3)[C@@H]2C)cc(C(F)(F)F)c1 ZINC000561624121 944713746 /nfs/dbraw/zinc/71/37/46/944713746.db2.gz LHADDBNBNNMOKE-VLIAUNLRSA-N 0 3 419.447 4.057 20 0 HIADHN Cc1ccccc1NC(=O)Cc1noc([C@H]2CCCN(Cc3cccc(F)c3)C2)n1 ZINC000561687642 944747846 /nfs/dbraw/zinc/74/78/46/944747846.db2.gz MIBGSEBMZXPNBR-SFHVURJKSA-N 0 3 408.477 4.078 20 0 HIADHN CSc1ccc([C@H](CNC(=O)c2cnc3c(F)ccc(F)c3c2)N(C)C)cc1 ZINC000561727400 944766948 /nfs/dbraw/zinc/76/69/48/944766948.db2.gz WCOLJXFOZGUPIR-IBGZPJMESA-N 0 3 401.482 4.268 20 0 HIADHN COCCOCc1ccc(CN[C@H](C)c2ccc(OC)c(Br)c2)cc1 ZINC000561738295 944772693 /nfs/dbraw/zinc/77/26/93/944772693.db2.gz DBBALVRWVMCRTP-OAHLLOKOSA-N 0 3 408.336 4.472 20 0 HIADHN CC(C)CC(=O)Nc1ccc(Cl)c(C(=O)N2CCN([C@@H]3C[C@H]3C)C[C@H](C)C2)c1 ZINC000561762570 944784988 /nfs/dbraw/zinc/78/49/88/944784988.db2.gz VOJXBPNSYOSEOU-RZQQEMMASA-N 0 3 405.970 4.127 20 0 HIADHN C[C@H]1C[C@H]1N1CCN(C(=O)c2occc2CN2c3ccccc3C[C@@H]2C)C[C@@H](C)C1 ZINC000561765948 944787295 /nfs/dbraw/zinc/78/72/95/944787295.db2.gz XUZOONLESOIWOG-KEXUJGGDSA-N 0 3 407.558 4.033 20 0 HIADHN CC[C@H](N[C@@H]1CCc2c1ccc(OC)c2F)c1ccccc1OCC(=O)N(C)C ZINC000561772132 944789184 /nfs/dbraw/zinc/78/91/84/944789184.db2.gz LQSINLAHWFDUED-RBUKOAKNSA-N 0 3 400.494 4.030 20 0 HIADHN C[C@H](N[C@@H]1CCN(C)[C@@H]1c1ccc(Cl)cc1)C(=O)N1CCC[C@@H]1c1cccs1 ZINC000562049015 944910517 /nfs/dbraw/zinc/91/05/17/944910517.db2.gz NGFARXLYBWDZGF-BQBKMSKFSA-N 0 3 418.006 4.489 20 0 HIADHN CN1CC[C@@H](NCc2cn3ccc(Br)cc3n2)[C@@H]1c1ccc(Cl)cc1 ZINC000562067928 944921077 /nfs/dbraw/zinc/92/10/77/944921077.db2.gz AJVTYDVGFIFCOB-MJGOQNOKSA-N 0 3 419.754 4.285 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)Nc1ccccc1N1C[C@@H](C)O[C@H](C)C1 ZINC000562116497 944950178 /nfs/dbraw/zinc/95/01/78/944950178.db2.gz VLTXKSCONFIURH-WOJBJXKFSA-N 0 3 402.583 4.030 20 0 HIADHN C[C@H](NC(=O)NC[C@H](Cc1ccccc1)N(C)C)c1ccc(Oc2cccnc2)cc1 ZINC000562174382 945002421 /nfs/dbraw/zinc/00/24/21/945002421.db2.gz BVNSBLGHDIWLBN-UGKGYDQZSA-N 0 3 418.541 4.407 20 0 HIADHN CCCN(C)[C@H](CNC(=O)CCCn1c(C)cc(=O)cc1C)c1ccc(Cl)cc1 ZINC000562177623 945003605 /nfs/dbraw/zinc/00/36/05/945003605.db2.gz ZIIFCWKWXPDRHH-JOCHJYFZSA-N 0 3 417.981 4.098 20 0 HIADHN C[C@@H](CNC(=O)Nc1ccc(-c2noc(C(F)F)n2)cc1)N(C)Cc1ccccc1 ZINC000562203887 945018460 /nfs/dbraw/zinc/01/84/60/945018460.db2.gz PYLIUPGRCGTANQ-AWEZNQCLSA-N 0 3 415.444 4.316 20 0 HIADHN CSc1ccc([C@@H](CNC(=O)c2ccc(OCc3ccncc3)cc2)N(C)C)cc1 ZINC000564092420 945375980 /nfs/dbraw/zinc/37/59/80/945375980.db2.gz DFWZPKJEXVMCAP-HSZRJFAPSA-N 0 3 421.566 4.415 20 0 HIADHN C[C@@H](NCC(=O)Nc1nc(CN2CCCC2)cs1)c1ccc(F)c2ccccc21 ZINC000564151427 945401651 /nfs/dbraw/zinc/40/16/51/945401651.db2.gz GLQSHAKWODKIFT-OAHLLOKOSA-N 0 3 412.534 4.321 20 0 HIADHN CCc1nnc(-c2ccc(NC(=O)N[C@@H]3CCN(Cc4ccccc4)[C@H]3C)cc2)o1 ZINC000564165771 945411231 /nfs/dbraw/zinc/41/12/31/945411231.db2.gz NSAVMZHULBGTDX-OXJNMPFZSA-N 0 3 405.502 4.084 20 0 HIADHN COc1ccc(-c2[nH]ncc2C(=O)Nc2nc(CN3CCCCCC3)cs2)cc1 ZINC000564231522 945446203 /nfs/dbraw/zinc/44/62/03/945446203.db2.gz QUGSHNOEQVZKRZ-UHFFFAOYSA-N 0 3 411.531 4.170 20 0 HIADHN COc1cc(Br)c(CN[C@H]2CCN(C)[C@H]2c2ccccc2)cc1OC ZINC000564256046 945474248 /nfs/dbraw/zinc/47/42/48/945474248.db2.gz MHJYVVUVCSDZPZ-PXNSSMCTSA-N 0 3 405.336 4.001 20 0 HIADHN COc1cc(Br)c(CN2C[C@H](c3ccccc3)[C@@H]3COCC[C@@H]32)cc1O ZINC000564307134 945509324 /nfs/dbraw/zinc/50/93/24/945509324.db2.gz BEXSCLHUIXGFTJ-AOIWGVFYSA-N 0 3 418.331 4.168 20 0 HIADHN C[C@H](N[C@H]1CCCc2ccc(S(N)(=O)=O)cc21)c1ccc(-c2cccnc2)cc1 ZINC000564422893 945573437 /nfs/dbraw/zinc/57/34/37/945573437.db2.gz BWAWUVLJKFKPOV-HJPURHCSSA-N 0 3 407.539 4.124 20 0 HIADHN CN1CCC(N(Cc2ccccc2Br)C(=O)c2cc(F)ccc2F)CC1 ZINC000564591220 945691645 /nfs/dbraw/zinc/69/16/45/945691645.db2.gz RRGLWGQEEPVMRP-UHFFFAOYSA-N 0 3 423.301 4.464 20 0 HIADHN C/C(=C\c1cccc(C(F)(F)F)c1)CNCC(=O)N[C@H]1CCOc2ccccc21 ZINC000564604891 945702161 /nfs/dbraw/zinc/70/21/61/945702161.db2.gz CODONNJQEIYJGW-LSSBLYJVSA-N 0 3 404.432 4.338 20 0 HIADHN CCN1CCN(Cc2ccc(N[C@H](C)c3ccc(Br)cn3)cc2)CC1 ZINC000564783736 945757417 /nfs/dbraw/zinc/75/74/17/945757417.db2.gz UDENITQQVGTOOZ-MRXNPFEDSA-N 0 3 403.368 4.155 20 0 HIADHN CCN(CC)C(=O)[C@H](NCCCc1nc(-c2ccc(F)cc2)no1)c1ccccc1 ZINC000565442544 945830250 /nfs/dbraw/zinc/83/02/50/945830250.db2.gz ANGPSLRCPZZRIZ-OAQYLSRUSA-N 0 3 410.493 4.008 20 0 HIADHN C[C@H]1C[C@@H]1N1CCN(C(=O)c2ccc3c(c2)nc(Cc2cccs2)n3C)C[C@@H](C)C1 ZINC000565617097 945855800 /nfs/dbraw/zinc/85/58/00/945855800.db2.gz NEQNTLFPIWXTEG-HOIFWPIMSA-N 0 3 422.598 4.028 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)cc1C(=O)N[C@@H](CN(C)C)c1ccc(F)cc1 ZINC000565739283 945876600 /nfs/dbraw/zinc/87/66/00/945876600.db2.gz YLHBAXFCWKXQTA-FQEVSTJZSA-N 0 3 400.885 4.006 20 0 HIADHN COc1ccccc1N1CC[C@@H](NC/C(C)=C\c2ccccc2OC(F)F)C1=O ZINC000566685533 946072199 /nfs/dbraw/zinc/07/21/99/946072199.db2.gz RVRIFQSULYZQKD-AKMXKPQHSA-N 0 3 402.441 4.095 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3cc4cc(Cl)sc4[nH]3)CC2)C[C@H](C)O1 ZINC000566946840 946187146 /nfs/dbraw/zinc/18/71/46/946187146.db2.gz CLLZHJIJXZKXQH-OKILXGFUSA-N 0 3 409.983 4.234 20 0 HIADHN CC(C)c1noc(Cc2ccc(NC(=O)N3CCN(CCC(C)(C)C)CC3)cc2)n1 ZINC000567064192 946230497 /nfs/dbraw/zinc/23/04/97/946230497.db2.gz GOWBICLTTHGBTQ-UHFFFAOYSA-N 0 3 413.566 4.370 20 0 HIADHN c1ccc2c(c1)[nH]c1c2CCC[C@@H]1NCc1ccccc1OCCN1CCOCC1 ZINC000567141726 946250894 /nfs/dbraw/zinc/25/08/94/946250894.db2.gz RCLMWFGWTRXBQN-QHCPKHFHSA-N 0 3 405.542 4.046 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)Nc1cccc2c1CN(c1nccs1)C2 ZINC000567143661 946251451 /nfs/dbraw/zinc/25/14/51/946251451.db2.gz TZSSDTGVOXKANK-QGZVFWFLSA-N 0 3 421.570 4.305 20 0 HIADHN CCOC(=O)Cn1nc(C)c(CN2CCC([C@H](F)c3ccccc3F)CC2)c1C ZINC000567200592 946268745 /nfs/dbraw/zinc/26/87/45/946268745.db2.gz NDBHXJOEFSBFPA-QFIPXVFZSA-N 0 3 405.489 4.125 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)c1ccc(OC(F)F)c(F)c1 ZINC000567254913 946279190 /nfs/dbraw/zinc/27/91/90/946279190.db2.gz ZELMQBOUUSRIDN-UHFFFAOYSA-N 0 3 410.461 4.271 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)c1csc(-c2cnn(C)c2)n1)c1ccc(Cl)cc1 ZINC000567258563 946280003 /nfs/dbraw/zinc/28/00/03/946280003.db2.gz HGRDTASNUNMUOC-SFHVURJKSA-N 0 3 417.966 4.010 20 0 HIADHN COC(=O)c1ccc(CN[C@H](Cc2ccccc2C)c2ccc(OC)c(OC)c2)[nH]1 ZINC000567505567 946352280 /nfs/dbraw/zinc/35/22/80/946352280.db2.gz GBLGUZVJZJDQKT-OAQYLSRUSA-N 0 3 408.498 4.201 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)c1ccn(-c2cccc(C(F)(F)F)c2)n1)c1ccco1 ZINC000567538504 946365551 /nfs/dbraw/zinc/36/55/51/946365551.db2.gz VIMCSNGHPMOXLG-RDTXWAMCSA-N 0 3 420.435 4.343 20 0 HIADHN CC1(C)CN(c2nnc(C3CCC3)n2C[C@H]2CCCCO2)CCN1Cc1ccccc1 ZINC000567904873 946422199 /nfs/dbraw/zinc/42/21/99/946422199.db2.gz RPKWCHXKDFEMBU-JOCHJYFZSA-N 0 3 423.605 4.216 20 0 HIADHN CC[C@@H](C)[C@H](NCC(=O)Nc1ccccc1SCC(N)=O)c1ccc(Cl)cc1 ZINC000568063784 946453194 /nfs/dbraw/zinc/45/31/94/946453194.db2.gz WOKLHNGCTMPUEY-SZNDQCEHSA-N 0 3 419.978 4.233 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)Nc1ccc(C(=O)N2CCCC2)cc1C)c1ccco1 ZINC000568128610 946472615 /nfs/dbraw/zinc/47/26/15/946472615.db2.gz BXVQGEVEIRCOCF-YLJYHZDGSA-N 0 3 412.534 4.075 20 0 HIADHN COc1ccc(CN[C@H](Cc2ccccc2)C(=O)Nc2ccccc2)c(C)c1OC ZINC000568318788 946504063 /nfs/dbraw/zinc/50/40/63/946504063.db2.gz BXZUJPHEJFXUNC-JOCHJYFZSA-N 0 3 404.510 4.352 20 0 HIADHN CC(=O)Nc1cccc([C@@H](C)NCCC(=O)Nc2cccc(Br)c2)c1 ZINC000568326584 946508320 /nfs/dbraw/zinc/50/83/20/946508320.db2.gz KDAMILWXSZVKTJ-CYBMUJFWSA-N 0 3 404.308 4.087 20 0 HIADHN COc1cccc2c1CCC[C@@H]2NCc1cccc(N2C(=O)NC3(CCCC3)C2=O)c1 ZINC000568615574 946628815 /nfs/dbraw/zinc/62/88/15/946628815.db2.gz VATBRMABSIQDCG-NRFANRHFSA-N 0 3 419.525 4.231 20 0 HIADHN Cc1ccc(-n2cnnc2SC[C@H]2CN(Cc3ccccc3)CCCO2)c(C)c1 ZINC000568656908 946637543 /nfs/dbraw/zinc/63/75/43/946637543.db2.gz RTRTXDGYEKYCJL-OAQYLSRUSA-N 0 3 408.571 4.267 20 0 HIADHN CN(C)C[C@H](NC(=O)[C@H]1C[C@@H]1c1ccc(Br)cc1)c1ccc(F)cc1 ZINC000568789294 946688188 /nfs/dbraw/zinc/68/81/88/946688188.db2.gz BESOGGJHNBAEAR-QYZOEREBSA-N 0 3 405.311 4.111 20 0 HIADHN COc1ccccc1[C@H](CC(C)C)N[C@@H]1CCCc2cc(S(N)(=O)=O)ccc21 ZINC000568908027 946745793 /nfs/dbraw/zinc/74/57/93/946745793.db2.gz QNWIMHTYOVXLIC-RTWAWAEBSA-N 0 3 402.560 4.097 20 0 HIADHN CCCN(CC)C[C@H](C)N[C@@H](c1ccc(C)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000569041444 946805698 /nfs/dbraw/zinc/80/56/98/946805698.db2.gz VEFFMWLDSNOLPN-CVDCTZTESA-N 0 3 402.604 4.198 20 0 HIADHN CCN1CC[C@@H](NCc2cnn(C)c2C(F)(F)F)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000569359146 946860274 /nfs/dbraw/zinc/86/02/74/946860274.db2.gz DINBGQSHFMQUOM-CVEARBPZSA-N 0 3 404.839 4.157 20 0 HIADHN OC[C@H]1C=C[C@@H](N(Cc2cccs2)C[C@@H](O)Cc2ccc(C(F)(F)F)cc2)C1 ZINC000569371728 946862032 /nfs/dbraw/zinc/86/20/32/946862032.db2.gz GNBHKXGQQKVXBI-UHOSZYNNSA-N 0 3 411.489 4.110 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)Nc1ccc(OC(F)F)cc1F ZINC000569383822 946862442 /nfs/dbraw/zinc/86/24/42/946862442.db2.gz ZFWBJBFOFPSUEU-UHFFFAOYSA-N 0 3 409.452 4.455 20 0 HIADHN FC(F)(F)c1ccc(-c2nc(CN[C@@H]3CCCC[C@@H]3N3CCOCC3)co2)cc1 ZINC000569431554 946874260 /nfs/dbraw/zinc/87/42/60/946874260.db2.gz XOXYPMTWRMZKGQ-MOPGFXCFSA-N 0 3 409.452 4.093 20 0 HIADHN CCOc1ccc(NC(=O)COc2ccc(CN3CC[C@H]3C(C)C)cc2OC)cc1 ZINC000569443055 946875922 /nfs/dbraw/zinc/87/59/22/946875922.db2.gz GWDHDJIWJYZHEY-NRFANRHFSA-N 0 3 412.530 4.342 20 0 HIADHN Cc1cc(C(=O)NC(C)C)ccc1NC(=O)N[C@H](CN(C)C)c1ccc(Cl)cc1 ZINC000569475149 946877936 /nfs/dbraw/zinc/87/79/36/946877936.db2.gz FBZRIKQRIIXWAJ-HXUWFJFHSA-N 0 3 416.953 4.211 20 0 HIADHN COc1cccc(C(=O)CCCC(=O)N2C[C@@H]3CCN(Cc4ccccc4)C[C@@H]3C2)c1 ZINC000569636500 946913152 /nfs/dbraw/zinc/91/31/52/946913152.db2.gz KFTMXSSYUKAGTN-XZOQPEGZSA-N 0 3 420.553 4.029 20 0 HIADHN CNS(=O)(=O)c1ccc([C@@H](C)N[C@@H](C)c2ccc(OC(C)C)c(Cl)c2)cc1 ZINC000569700883 946941265 /nfs/dbraw/zinc/94/12/65/946941265.db2.gz LGGXNYKYJYDLER-CABCVRRESA-N 0 3 410.967 4.447 20 0 HIADHN CNS(=O)(=O)c1ccc([C@H](C)N[C@H](C)c2ccc(OC(C)C)c(Cl)c2)cc1 ZINC000569700886 946942070 /nfs/dbraw/zinc/94/20/70/946942070.db2.gz LGGXNYKYJYDLER-LSDHHAIUSA-N 0 3 410.967 4.447 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(CNCc3ccc4cnn(C)c4c3)c2)cc1 ZINC000569755207 946987076 /nfs/dbraw/zinc/98/70/76/946987076.db2.gz USOIBKREJSNYOS-UHFFFAOYSA-N 0 3 400.482 4.124 20 0 HIADHN C[C@H]1C[C@@H](N2CCCC2)CN1C(=O)c1cc2sc(Nc3ccccc3)nc2s1 ZINC000569857050 947021845 /nfs/dbraw/zinc/02/18/45/947021845.db2.gz JMJUZJIQTWLEBZ-GOEBONIOSA-N 0 3 412.584 4.800 20 0 HIADHN CN(C)c1noc([C@@H]2CCCN(Cc3c(OC(F)F)ccc4ccccc43)C2)n1 ZINC000569913689 947045571 /nfs/dbraw/zinc/04/55/71/947045571.db2.gz BRDCUDGCWIUZAU-OAHLLOKOSA-N 0 3 402.445 4.270 20 0 HIADHN COc1ccc2cc(CNc3ccc(C(=O)NCCN4CCCC4)cc3)ccc2c1 ZINC000569945261 947047965 /nfs/dbraw/zinc/04/79/65/947047965.db2.gz MWGWMSIZWKEQAH-UHFFFAOYSA-N 0 3 403.526 4.286 20 0 HIADHN O=C(N1CCC=C(c2ccccn2)C1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000569970553 947057328 /nfs/dbraw/zinc/05/73/28/947057328.db2.gz RHDWIFSOOZFMCR-JOCHJYFZSA-N 0 3 415.459 4.152 20 0 HIADHN CC(C)(C)C[C@@H](O)CC(=O)N(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000570234495 947155755 /nfs/dbraw/zinc/15/57/55/947155755.db2.gz XLTJPQJSPJUJNA-RPWUZVMVSA-N 0 3 423.601 4.262 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc2c(c1)OCC(=O)N2)c1ccc(NC(=O)c2ccncc2)cc1 ZINC000570339161 947207426 /nfs/dbraw/zinc/20/74/26/947207426.db2.gz PLGVLYUMYAYIJH-HZPDHXFCSA-N 0 3 416.481 4.077 20 0 HIADHN CCN(CC(=O)Nc1ccc(NC(=O)c2cccs2)cc1)[C@H]1CCOC(C)(C)C1 ZINC000570366722 947222180 /nfs/dbraw/zinc/22/21/80/947222180.db2.gz GDDCOYAUVGJPIP-SFHVURJKSA-N 0 3 415.559 4.218 20 0 HIADHN Cc1cc(F)ccc1-c1nc(C(C)(C)C(=O)N[C@H]2C[C@H](C)N(C3CC3)C2)cs1 ZINC000570558450 947299884 /nfs/dbraw/zinc/29/98/84/947299884.db2.gz OWOOTIMNEVOBKR-HOCLYGCPSA-N 0 3 401.551 4.277 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)Nc2ccccc2N2CCCC2=O)N(C)C)cc1 ZINC000570708464 947331986 /nfs/dbraw/zinc/33/19/86/947331986.db2.gz DHGIABDHOSIUEZ-JOCHJYFZSA-N 0 3 424.545 4.025 20 0 HIADHN CCOC(=O)c1ccn(-c2cccc(CNCc3cc(O)cc(C(F)(F)F)c3)c2)n1 ZINC000570767717 947353118 /nfs/dbraw/zinc/35/31/18/947353118.db2.gz UDFWPMNJDVJUSN-UHFFFAOYSA-N 0 3 419.403 4.063 20 0 HIADHN Cc1cc(C[C@H](C)NCc2cn3ccc(Br)cc3n2)n(-c2ccccc2)n1 ZINC000570978018 947408338 /nfs/dbraw/zinc/40/83/38/947408338.db2.gz LEDKEYFBJKNUDJ-HNNXBMFYSA-N 0 3 424.346 4.312 20 0 HIADHN CSc1ccc([C@@H](CNC(=O)c2sc([C@H]3CCCOC3)nc2C)N(C)C)cc1 ZINC000571120405 947513713 /nfs/dbraw/zinc/51/37/13/947513713.db2.gz LQVXLYJXFRNHOJ-FUHWJXTLSA-N 0 3 419.616 4.100 20 0 HIADHN NC(=O)C1CCN(Cc2cccc(NC(=O)c3ccc(C4CCCC4)cc3)c2)CC1 ZINC000571247820 947567793 /nfs/dbraw/zinc/56/77/93/947567793.db2.gz ATJJSTYPLJCRDC-UHFFFAOYSA-N 0 3 405.542 4.294 20 0 HIADHN COc1ccc([C@@H](C)NCc2cccc(N3CCOCC3)c2)cc1Br ZINC000571660850 947738056 /nfs/dbraw/zinc/73/80/56/947738056.db2.gz YIMFPICWJZPIJC-OAHLLOKOSA-N 0 3 405.336 4.145 20 0 HIADHN Cc1cc(CN[C@H]2CCCc3ccc(S(N)(=O)=O)cc32)ccc1-c1ccccc1 ZINC000571783485 947780860 /nfs/dbraw/zinc/78/08/60/947780860.db2.gz FGVNIAZCZGRUMH-DEOSSOPVSA-N 0 3 406.551 4.477 20 0 HIADHN CN1CC[C@H](NCC(=O)Nc2cc(Cl)ccc2F)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000571810746 947792161 /nfs/dbraw/zinc/79/21/61/947792161.db2.gz NYOLGZXMTWSBMX-LPHOPBHVSA-N 0 3 414.283 4.245 20 0 HIADHN CN1CC[C@@H](NCC(=O)Nc2cc(Cl)ccc2F)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000571810741 947792272 /nfs/dbraw/zinc/79/22/72/947792272.db2.gz NYOLGZXMTWSBMX-APWZRJJASA-N 0 3 414.283 4.245 20 0 HIADHN Cc1cccc2cc(C(=O)Nc3ccc(C(=O)NCCN4CCCC4)cc3)sc21 ZINC000571835957 947800096 /nfs/dbraw/zinc/80/00/96/947800096.db2.gz MXGBPRZRFSHVDF-UHFFFAOYSA-N 0 3 407.539 4.288 20 0 HIADHN C/C(=C\c1ccccc1OC(F)F)CN(C)[C@H](C)c1cccc(S(N)(=O)=O)c1 ZINC000571966341 947824034 /nfs/dbraw/zinc/82/40/34/947824034.db2.gz OBQGDWWFGDQYGX-ATGUSINASA-N 0 3 410.486 4.032 20 0 HIADHN CC[C@@H](C(=O)Nc1cccc(CN2CC[C@H](O)C2)c1)c1cccc(C(F)(F)F)c1 ZINC000572173024 947856736 /nfs/dbraw/zinc/85/67/36/947856736.db2.gz AVSIITLLKDMVJQ-VQTJNVASSA-N 0 3 406.448 4.404 20 0 HIADHN CC(C)(C)N(Cc1ccccn1)C(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000572278835 947875157 /nfs/dbraw/zinc/87/51/57/947875157.db2.gz FDVXOKXWRJHTMC-HXUWFJFHSA-N 0 3 401.501 4.366 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1ccc(Oc2cccnc2)nc1 ZINC000572292446 947877454 /nfs/dbraw/zinc/87/74/54/947877454.db2.gz GJKKOORHEBSUJT-LJQANCHMSA-N 0 3 417.513 4.397 20 0 HIADHN COc1ccc([C@H](Cc2ccccc2)NCC(=O)Nc2cc(OC)cc(OC)c2)cc1 ZINC000572412930 947896783 /nfs/dbraw/zinc/89/67/83/947896783.db2.gz GCUMKNOBAXUYAQ-DEOSSOPVSA-N 0 3 420.509 4.225 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cn(C)nc1C1CC1)c1ccc(C(F)(F)F)cc1 ZINC000572451199 947911467 /nfs/dbraw/zinc/91/14/67/947911467.db2.gz HUVDOEGHZBUPFY-SFHVURJKSA-N 0 3 408.468 4.129 20 0 HIADHN Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)N[C@H](C)CN(C)Cc1ccccc1 ZINC000572520190 947925978 /nfs/dbraw/zinc/92/59/78/947925978.db2.gz AFAHLXKVYRGZME-LJQANCHMSA-N 0 3 422.573 4.309 20 0 HIADHN COC[C@@]1(CNCc2c(Cl)cccc2N2CCCC2)OCCc2ccccc21 ZINC000572531162 947933260 /nfs/dbraw/zinc/93/32/60/947933260.db2.gz GGTNBNAYBJJDDQ-HSZRJFAPSA-N 0 3 400.950 4.144 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)C2(c3cccc(Cl)c3)CC(=O)C2)CCN1Cc1ccccc1 ZINC000572654788 947969211 /nfs/dbraw/zinc/96/92/11/947969211.db2.gz MZLIESHARDQDIT-UWJYYQICSA-N 0 3 410.945 4.110 20 0 HIADHN C[C@@H]1C[C@@H]1N1CCN(C(=O)c2ccc(Br)c(C(F)(F)F)c2)C[C@@H](C)C1 ZINC000572670967 947975976 /nfs/dbraw/zinc/97/59/76/947975976.db2.gz JSNWBQPHRCXOAF-OZVIIMIRSA-N 0 3 419.285 4.270 20 0 HIADHN O=C(CN[C@@H]1c2ccccc2CC12CCOCC2)N(Cc1ccco1)c1ccccc1 ZINC000572891533 948031140 /nfs/dbraw/zinc/03/11/40/948031140.db2.gz GAYZQVLKGTUSHR-RUZDIDTESA-N 0 3 416.521 4.497 20 0 HIADHN COc1cccc([C@@H]2[C@@H](N[C@H](C)C(=O)Nc3ccc(C)cc3C)CCN2C2CC2)c1 ZINC000572902584 948033435 /nfs/dbraw/zinc/03/34/35/948033435.db2.gz ITTLZGXVHIBZDZ-PUZWTLIVSA-N 0 3 407.558 4.207 20 0 HIADHN CN(CCCN(C)C(=O)c1ccccc1-c1nc(C(C)(C)C)no1)Cc1ccncc1 ZINC000573101336 948078427 /nfs/dbraw/zinc/07/84/27/948078427.db2.gz SIGZYCBJWFOQGP-UHFFFAOYSA-N 0 3 421.545 4.023 20 0 HIADHN CN(C)C[C@H](NC(=O)c1cc(Br)cc2cccnc21)c1ccc(F)cc1 ZINC000573158264 948093995 /nfs/dbraw/zinc/09/39/95/948093995.db2.gz RGZVFSCAXBPVND-SFHVURJKSA-N 0 3 416.294 4.169 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)c1csc(-c2cccc(Cl)c2)n1 ZINC000573332219 948158166 /nfs/dbraw/zinc/15/81/66/948158166.db2.gz RWTDTOKDGZOAJO-SFHVURJKSA-N 0 3 413.930 4.282 20 0 HIADHN C[C@H]1[C@@H](NC(=O)N2CCC(C(F)(F)F)(C(F)(F)F)C2)CCN1Cc1ccccc1 ZINC000573474676 948212700 /nfs/dbraw/zinc/21/27/00/948212700.db2.gz CKPAFLBADICKEB-ZFWWWQNUSA-N 0 3 423.401 4.176 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)CCc1nc(-c2ccc(Cl)cc2)no1)c1ccco1 ZINC000573593872 948244614 /nfs/dbraw/zinc/24/46/14/948244614.db2.gz WDBAGXHWCWIHAS-PBHICJAKSA-N 0 3 416.909 4.161 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)c2cc(O)ccc2C(F)(F)F)N(C)C)cc1 ZINC000573714896 948280437 /nfs/dbraw/zinc/28/04/37/948280437.db2.gz DTSLYHSMBYAFFG-LJQANCHMSA-N 0 3 410.436 4.231 20 0 HIADHN C[C@H](C(=O)N[C@H]1CCN(Cc2ccccc2)[C@H]1C)c1ccc(Br)s1 ZINC000573716030 948280762 /nfs/dbraw/zinc/28/07/62/948280762.db2.gz UQCWWVQCAAVVLM-DZKIICNBSA-N 0 3 407.377 4.393 20 0 HIADHN Cc1ccc(-c2n[nH]c(NC(=O)[C@@H]3CCn4c(cnc4C4CCCCC4)C3)c2C)o1 ZINC000573789243 948299596 /nfs/dbraw/zinc/29/95/96/948299596.db2.gz VCIDRHBQQFIUIG-QGZVFWFLSA-N 0 3 407.518 4.732 20 0 HIADHN Cc1cc(C)c(CCNC(=O)CN(C)[C@H]2CCO[C@H](c3ccc(F)cc3)C2)c(C)c1 ZINC000573845165 948308757 /nfs/dbraw/zinc/30/87/57/948308757.db2.gz ITCLNFICPCJRDQ-UPVQGACJSA-N 0 3 412.549 4.262 20 0 HIADHN NC(=O)[C@H]1CCCN(Cc2ccccc2NC(=O)c2ccc(C3=CCCC3)cc2)C1 ZINC000573972707 948338754 /nfs/dbraw/zinc/33/87/54/948338754.db2.gz BPBNEBMXNIRACT-QFIPXVFZSA-N 0 3 403.526 4.204 20 0 HIADHN CC(C)N1C[C@@H](c2noc(-c3cccc(CN(C)Cc4ccccc4)c3)n2)CC1=O ZINC000574299146 948405363 /nfs/dbraw/zinc/40/53/63/948405363.db2.gz ZYPSDPDJSHQFEL-NRFANRHFSA-N 0 3 404.514 4.093 20 0 HIADHN CN(Cc1c(F)cccc1Cl)C(=O)CN[C@H]1CCN(C)[C@@H]1c1ccc(Cl)cc1 ZINC000574488540 948456878 /nfs/dbraw/zinc/45/68/78/948456878.db2.gz BCNBZBOPBHXYAE-PZJWPPBQSA-N 0 3 424.347 4.126 20 0 HIADHN CC(C)N1CCN(c2ccc(-c3nc(-c4cc(=O)[nH]c5ccccc54)no3)cc2)CC1 ZINC000574725377 948513962 /nfs/dbraw/zinc/51/39/62/948513962.db2.gz LYBGLJUBHCUHCB-UHFFFAOYSA-N 0 3 415.497 4.188 20 0 HIADHN Cc1cc(NC(=O)N2CC3(C2)CCCCC3)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000574730069 948516813 /nfs/dbraw/zinc/51/68/13/948516813.db2.gz LUBAWYZOQDVNBL-NRFANRHFSA-N 0 3 407.562 4.437 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N1CCC(OCC2CCCCC2)CC1)c1ccco1 ZINC000574783313 948524592 /nfs/dbraw/zinc/52/45/92/948524592.db2.gz QCHFWQXOKNALNT-RXVVDRJESA-N 0 3 405.583 4.480 20 0 HIADHN CC[C@H](C(=O)N1CCC(c2nnc(-c3ccccc3)[n-]2)CC1)[N@H+](C)Cc1ccccc1 ZINC000574795950 948529179 /nfs/dbraw/zinc/52/91/79/948529179.db2.gz WOKSQMHJONINRY-JOCHJYFZSA-N 0 3 417.557 4.088 20 0 HIADHN CC[C@H](C(=O)N1CCC(c2nnc(-c3ccccc3)[n-]2)CC1)[N@@H+](C)Cc1ccccc1 ZINC000574795950 948529193 /nfs/dbraw/zinc/52/91/93/948529193.db2.gz WOKSQMHJONINRY-JOCHJYFZSA-N 0 3 417.557 4.088 20 0 HIADHN Clc1ccc(OCCOc2ccc(CNCc3c[nH]c4nccnc34)cc2)cc1 ZINC000575034855 948579686 /nfs/dbraw/zinc/57/96/86/948579686.db2.gz FSEWYZMESUZHFP-UHFFFAOYSA-N 0 3 408.889 4.311 20 0 HIADHN C[C@@H](NC(=O)CNC1(c2ccccc2)CCOCC1)c1ccc(Cl)c(Cl)c1 ZINC000575151572 948605714 /nfs/dbraw/zinc/60/57/14/948605714.db2.gz XGEDZCOKQHGROJ-OAHLLOKOSA-N 0 3 407.341 4.466 20 0 HIADHN O=c1[n-]c(CN2C[C@H]3CC[N@H+](Cc4ccccc4)C[C@@H]3C2)nc2c3ccccc3oc21 ZINC000575166315 948617135 /nfs/dbraw/zinc/61/71/35/948617135.db2.gz DEDLZNSAJMOKBF-RTBURBONSA-N 0 3 414.509 4.036 20 0 HIADHN O=c1[n-]c(CN2C[C@H]3CC[N@@H+](Cc4ccccc4)C[C@@H]3C2)nc2c3ccccc3oc21 ZINC000575166315 948617154 /nfs/dbraw/zinc/61/71/54/948617154.db2.gz DEDLZNSAJMOKBF-RTBURBONSA-N 0 3 414.509 4.036 20 0 HIADHN COCCO[C@@H]1CCCN(Cc2cccc(NC(=O)c3ccccc3Cl)c2)C1 ZINC000575334223 948648141 /nfs/dbraw/zinc/64/81/41/948648141.db2.gz JCVALURZMKOTSR-LJQANCHMSA-N 0 3 402.922 4.220 20 0 HIADHN CSc1ccc([C@@H](CNC(=O)c2ccc(-n3nc(C)cc3C)cc2)N(C)C)cc1 ZINC000575355129 948652679 /nfs/dbraw/zinc/65/26/79/948652679.db2.gz OWGSALKLXKGQNP-JOCHJYFZSA-N 0 3 408.571 4.244 20 0 HIADHN O=C(NCCCN[C@@H](c1ncc[nH]1)C1CCCCC1)c1cccc(Br)c1 ZINC000575735965 948688930 /nfs/dbraw/zinc/68/89/30/948688930.db2.gz VHWGNPAPDPOTSI-GOSISDBHSA-N 0 3 419.367 4.203 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)[C@H]2CCn3c(cnc3C3CCCCC3)C2)CC1 ZINC000575825415 948726424 /nfs/dbraw/zinc/72/64/24/948726424.db2.gz KIKMJRWHDZEZGP-FQEVSTJZSA-N 0 3 424.589 4.209 20 0 HIADHN CC[C@H]1c2ccsc2CCN1C(=O)CN[C@@H]1c2ccccc2CC12CCOCC2 ZINC000575958246 948802457 /nfs/dbraw/zinc/80/24/57/948802457.db2.gz HPJDCQUBCAAMKL-NZQKXSOJSA-N 0 3 410.583 4.268 20 0 HIADHN Cc1cncc(COC[C@@]23CCC[C@H]2CN(c2ccc(CN4CCCC4)cn2)C3)c1 ZINC001164804349 721601430 /nfs/dbraw/zinc/60/14/30/721601430.db2.gz YHBWPYBFWRMFIV-ZCYQVOJMSA-N 0 3 406.574 4.204 20 0 HIADHN Cc1cncc(COC[C@@]23CCC[C@@H]2CN(c2ccc(CN4CCCC4)cn2)C3)c1 ZINC001164804336 721601526 /nfs/dbraw/zinc/60/15/26/721601526.db2.gz YHBWPYBFWRMFIV-NOZRDPDXSA-N 0 3 406.574 4.204 20 0 HIADHN FC1(F)CCN(c2cc3ccsc3cn2)C[C@]12CCN(Cc1ccccn1)C2 ZINC001164906576 721713168 /nfs/dbraw/zinc/71/31/68/721713168.db2.gz MZHNPCTWNSBQLX-HXUWFJFHSA-N 0 3 400.498 4.429 20 0 HIADHN Cc1cccc2c(C)cc(N3CCC4(CC3)COCCN(Cc3ccncc3)C4)nc12 ZINC001164961158 722053176 /nfs/dbraw/zinc/05/31/76/722053176.db2.gz SSGHOIBJWSDZKN-UHFFFAOYSA-N 0 3 416.569 4.366 20 0 HIADHN Clc1cc(N2CC[C@H]3CN(Cc4cccnc4)CCO[C@@H]3C2)c2sccc2n1 ZINC001164980537 722109888 /nfs/dbraw/zinc/10/98/88/722109888.db2.gz RSNLLAMHMLMGMN-QFBILLFUSA-N 0 3 414.962 4.072 20 0 HIADHN Fc1cccc(CN2CC[C@@]23CCCN(c2ncnc4[nH]c5ccccc5c42)C3)c1 ZINC001164994917 722201706 /nfs/dbraw/zinc/20/17/06/722201706.db2.gz JTQUEVMGZRWZNT-XMMPIXPASA-N 0 3 401.489 4.495 20 0 HIADHN COc1cc2ncnc(N3CCC[C@]4(CCN4Cc4cccc(F)c4)C3)c2c(OC)c1 ZINC001164993766 722201721 /nfs/dbraw/zinc/20/17/21/722201721.db2.gz ASTQVOKNVICUQK-DEOSSOPVSA-N 0 3 422.504 4.031 20 0 HIADHN CCOC(=O)/C=C\c1ccc(N2CCC[C@]3(CCN3Cc3cccc(F)c3)C2)nc1 ZINC001164995370 722204709 /nfs/dbraw/zinc/20/47/09/722204709.db2.gz MQJSIIQPJHKBMM-SINIUOCSSA-N 0 3 409.505 4.042 20 0 HIADHN COC(=O)c1ccc2cc(N3CCC[C@@]4(CCN4Cc4cccc(F)c4)C3)ncc2c1 ZINC001164997205 722207130 /nfs/dbraw/zinc/20/71/30/722207130.db2.gz XBSJALZALFMMMB-RUZDIDTESA-N 0 3 419.500 4.405 20 0 HIADHN CC[C@H](C)[C@@H](NC(=O)Nc1ccc(N2CCN(CC)CC2)cc1C)C(F)(F)F ZINC000436093025 861373842 /nfs/dbraw/zinc/37/38/42/861373842.db2.gz YENYMDWFKJGAKH-KBXCAEBGSA-N 0 3 400.489 4.235 20 0 HIADHN COc1cccc([C@@H](C/N=C/c2cc(Br)ccc2O)N2CCCC2)c1 ZINC000005291964 845099023 /nfs/dbraw/zinc/09/90/23/845099023.db2.gz BKDRGROBRCUNCV-PPRFWAEMSA-N 0 3 403.320 4.419 20 0 HIADHN COc1ccc([C@H](CNC(=S)Nc2ccc(OC(F)F)cc2)N2CCCC2)cc1 ZINC000006336011 845191243 /nfs/dbraw/zinc/19/12/43/845191243.db2.gz NFWADXVVLDODKM-IBGZPJMESA-N 0 3 421.513 4.420 20 0 HIADHN CN(C)Cc1ccccc1CNC(=O)COc1cc(Cl)c(Cl)cc1Cl ZINC000009917244 845603405 /nfs/dbraw/zinc/60/34/05/845603405.db2.gz YCMOBQVESQTKTQ-UHFFFAOYSA-N 0 3 401.721 4.404 20 0 HIADHN Cc1nn(-c2ccccc2)c2sc(C(=O)NCc3ccccc3CN(C)C)cc12 ZINC000009917220 845603457 /nfs/dbraw/zinc/60/34/57/845603457.db2.gz LCBJYZUCJDWDKH-UHFFFAOYSA-N 0 3 404.539 4.387 20 0 HIADHN CCOc1ccccc1OCCCC(=O)N1c2ccc(C)cc2[C@@H]2CN(C)CC[C@@H]21 ZINC000010045408 845615128 /nfs/dbraw/zinc/61/51/28/845615128.db2.gz ROWGFJWSSZWNSX-UNMCSNQZSA-N 0 3 408.542 4.387 20 0 HIADHN COc1ccc(CN2CCCN(c3nc(C)nc4sc5c(c43)CCC5)CC2)cc1 ZINC000011172792 845762504 /nfs/dbraw/zinc/76/25/04/845762504.db2.gz HQKPCJRSNPJQKW-UHFFFAOYSA-N 0 3 408.571 4.209 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)CCC(=O)c3ccc4c(c3)CCCC4)cc2)CC1 ZINC000011951973 845843077 /nfs/dbraw/zinc/84/30/77/845843077.db2.gz NEGVVTRMHNSHIJ-UHFFFAOYSA-N 0 3 419.569 4.309 20 0 HIADHN COC(=O)c1c(C)c(C)sc1NC(=S)NC1CCN(Cc2ccccc2)CC1 ZINC000013828173 845918498 /nfs/dbraw/zinc/91/84/98/845918498.db2.gz YGESRNXTSJTBOU-UHFFFAOYSA-N 0 3 417.600 4.103 20 0 HIADHN CN(C)[C@H](CNC(=O)c1cc2ccccc2cc1NC(=O)C1CC1)c1ccccc1 ZINC000014062001 845922097 /nfs/dbraw/zinc/92/20/97/845922097.db2.gz OCMSBMPLSWMNRA-HSZRJFAPSA-N 0 3 401.510 4.221 20 0 HIADHN O=S(=O)(NCc1ccccc1CN1CCCCC1)c1ccccc1C(F)(F)F ZINC000015360757 846039970 /nfs/dbraw/zinc/03/99/70/846039970.db2.gz FCCBLPAEDJOYJP-UHFFFAOYSA-N 0 3 412.477 4.170 20 0 HIADHN Cc1cccc(C(=O)Nc2ccccc2C(=O)NC[C@@H](c2ccccc2)N(C)C)c1 ZINC000015372980 846042373 /nfs/dbraw/zinc/04/23/73/846042373.db2.gz VTTNTMYZJXUSAV-QHCPKHFHSA-N 0 3 401.510 4.280 20 0 HIADHN COc1cccc(NC(=O)[C@H](NCCCn2cnc3ccccc32)c2ccccc2)c1 ZINC000015504833 846054812 /nfs/dbraw/zinc/05/48/12/846054812.db2.gz SZFNUJMSGCTHPR-XMMPIXPASA-N 0 3 414.509 4.405 20 0 HIADHN CC1CCN([C@@H](CNC(=S)Nc2ccc([N+](=O)[O-])cc2)c2cccs2)CC1 ZINC000016241518 846141746 /nfs/dbraw/zinc/14/17/46/846141746.db2.gz UFWRKJUONMFCMB-KRWDZBQOSA-N 0 3 404.561 4.416 20 0 HIADHN CCOc1ccc(OCCCC(=O)Nc2ccc(N3CCN(CC)CC3)cc2)cc1 ZINC000018892136 846345120 /nfs/dbraw/zinc/34/51/20/846345120.db2.gz IXKAOAQTVROJDY-UHFFFAOYSA-N 0 3 411.546 4.025 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)CCc3ncc(-c4ccccc4)o3)c(C)c2)CC1 ZINC000021465245 846448871 /nfs/dbraw/zinc/44/88/71/846448871.db2.gz KYBWXLGKDZKSEK-UHFFFAOYSA-N 0 3 418.541 4.363 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)N[C@H]1C[C@H](c2cccc(F)c2)C1 ZINC000436356582 861683979 /nfs/dbraw/zinc/68/39/79/861683979.db2.gz VWWMRGKTWVBCOJ-XYWHTSSQSA-N 0 3 413.562 4.485 20 0 HIADHN Cc1ccc(NC(=O)[C@H](NCC(C)(C)N2C[C@@H](C)O[C@@H](C)C2)c2ccccc2)cc1 ZINC000022735119 846611696 /nfs/dbraw/zinc/61/16/96/846611696.db2.gz OWCUSYNQGNAIGH-ZRCGQRJVSA-N 0 3 409.574 4.152 20 0 HIADHN Cc1c(C(=O)NC[C@H](c2ccccc2)N(C)C)cnn1-c1cccc(C(F)(F)F)c1 ZINC000022990462 846645598 /nfs/dbraw/zinc/64/55/98/846645598.db2.gz NSEWITJYJZFENV-HXUWFJFHSA-N 0 3 416.447 4.232 20 0 HIADHN Cc1cccc2nc(C3CCN(C(=O)N[C@@H]4CCN(C)[C@H]4c4ccccc4)CC3)oc21 ZINC000436370737 861709169 /nfs/dbraw/zinc/70/91/69/861709169.db2.gz ZZZXPNKJGSCJOV-IRLDBZIGSA-N 0 3 418.541 4.471 20 0 HIADHN CN(C)Cc1ccccc1CNC(=O)c1ccc(-c2ccc3c(c2)OCCO3)s1 ZINC000024084230 846786714 /nfs/dbraw/zinc/78/67/14/846786714.db2.gz VWZLYEDTCDTLCB-UHFFFAOYSA-N 0 3 408.523 4.178 20 0 HIADHN CC(C)[C@H](CNC(=O)c1cccc(NC(=O)[C@H]2C[C@@H]2C)c1)N1CCc2ccccc2C1 ZINC000024622400 846844540 /nfs/dbraw/zinc/84/45/40/846844540.db2.gz GHJJDJPGOGWXHA-NWVWQQAFSA-N 0 3 419.569 4.094 20 0 HIADHN O=C(CN[C@H](Cc1ccccc1)c1ccccc1)Nc1cccc(C(=O)NC2CC2)c1 ZINC000024734733 846859909 /nfs/dbraw/zinc/85/99/09/846859909.db2.gz UJIYEXBABIEEBK-XMMPIXPASA-N 0 3 413.521 4.091 20 0 HIADHN C[C@H](CN1CCCCC1)NC(=O)c1ccc(Cl)c(NC(=O)c2cccs2)c1 ZINC000024802035 846868906 /nfs/dbraw/zinc/86/89/06/846868906.db2.gz BUQZHSFEVXKOFA-CQSZACIVSA-N 0 3 405.951 4.258 20 0 HIADHN C[C@@H](CN1CCCCC1)NC(=O)c1ccc(Cl)c(NC(=O)c2cccs2)c1 ZINC000024802029 846869515 /nfs/dbraw/zinc/86/95/15/846869515.db2.gz BUQZHSFEVXKOFA-AWEZNQCLSA-N 0 3 405.951 4.258 20 0 HIADHN O=C(CCN1CCC[C@H]1[C@@H](O)C(F)(F)F)Nc1ccc(Oc2ccccc2)cc1 ZINC000436393709 861737686 /nfs/dbraw/zinc/73/76/86/861737686.db2.gz UZVCNQPTMGLJGG-AZUAARDMSA-N 0 3 408.420 4.195 20 0 HIADHN CC(C)(CNC(=O)CCc1ncc(-c2ccccc2)o1)N1CCc2ccccc2C1 ZINC000025464091 846981767 /nfs/dbraw/zinc/98/17/67/846981767.db2.gz YJICDFWKQWBHJL-UHFFFAOYSA-N 0 3 403.526 4.227 20 0 HIADHN CCN(CC)[C@H](CNC(=O)C(C)(C)Oc1ccc(F)cc1)c1cccc(OC)c1 ZINC000025860347 847047372 /nfs/dbraw/zinc/04/73/72/847047372.db2.gz PNIBVKLWNMLJNB-OAQYLSRUSA-N 0 3 402.510 4.191 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cc(C2CC2)nc2onc(C)c21)c1cccc(OC)c1 ZINC000025862476 847048339 /nfs/dbraw/zinc/04/83/39/847048339.db2.gz PPZLCJRHWXRLHU-NRFANRHFSA-N 0 3 422.529 4.230 20 0 HIADHN CC(C)(CNC(=O)NCc1coc(-c2cccs2)n1)N1CCc2ccccc2C1 ZINC000026164778 847097678 /nfs/dbraw/zinc/09/76/78/847097678.db2.gz WIESMHOERJAUQI-UHFFFAOYSA-N 0 3 410.543 4.039 20 0 HIADHN O=C1C[C@H](NCc2c[nH]nc2-c2ccsc2)CN1Cc1ccccc1C(F)(F)F ZINC000436406683 861754287 /nfs/dbraw/zinc/75/42/87/861754287.db2.gz JHVAMHXZHXBVOZ-INIZCTEOSA-N 0 3 420.460 4.048 20 0 HIADHN Fc1ccc(Cn2cc(CN[C@@H]3CCO[C@H]3c3ccc(Cl)c(F)c3)cn2)cc1 ZINC000436408802 861758287 /nfs/dbraw/zinc/75/82/87/861758287.db2.gz LFTJZUVCTNPJMF-RTWAWAEBSA-N 0 3 403.860 4.483 20 0 HIADHN Cc1[nH]c2c(cccc2C(=O)NCCCCN2CCN(c3cccc(C)c3)CC2)c1C ZINC000026962321 847227218 /nfs/dbraw/zinc/22/72/18/847227218.db2.gz DMLQTASRAGQAJA-UHFFFAOYSA-N 0 3 418.585 4.425 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)CCSc3ccc(OC)cc3)c(C)c2)CC1 ZINC000027109221 847249592 /nfs/dbraw/zinc/24/95/92/847249592.db2.gz SWPMRHJPXXSJMQ-UHFFFAOYSA-N 0 3 413.587 4.266 20 0 HIADHN CCN1CCN(c2ccc(N[C@H](C)C(=O)Nc3cccc4ncccc43)c(C)c2)CC1 ZINC000027170936 847261435 /nfs/dbraw/zinc/26/14/35/847261435.db2.gz UQHNTSHVUPYTMR-LJQANCHMSA-N 0 3 417.557 4.124 20 0 HIADHN COc1cccc([C@@H](CNC(=O)Cc2ccc(C(F)(F)F)cc2)N2CCCC2)c1 ZINC000027342301 847285648 /nfs/dbraw/zinc/28/56/48/847285648.db2.gz ZBPXCRLDLKXDRT-HXUWFJFHSA-N 0 3 406.448 4.210 20 0 HIADHN CCOc1ccc([C@H](NCC(=O)Nc2ccc3c(c2)OCO3)C(C)C)cc1OCC ZINC000027379461 847293207 /nfs/dbraw/zinc/29/32/07/847293207.db2.gz GBTQZMGVJNRTMC-HSZRJFAPSA-N 0 3 414.502 4.138 20 0 HIADHN Cc1onc(-c2c(F)cccc2Cl)c1C(=O)NC[C@@H](c1ccccc1)N(C)C ZINC000027456216 847306749 /nfs/dbraw/zinc/30/67/49/847306749.db2.gz HCMNNYFEWFKLNC-KRWDZBQOSA-N 0 3 401.869 4.475 20 0 HIADHN COc1ccc(CCC(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)cc1OC ZINC000027573192 847321647 /nfs/dbraw/zinc/32/16/47/847321647.db2.gz CELWQGLYGVPZOA-LJQANCHMSA-N 0 3 416.587 4.287 20 0 HIADHN CC1CCN([C@H](CNC(=O)CCc2ccc3c(c2)OCCO3)c2cccs2)CC1 ZINC000027574845 847322369 /nfs/dbraw/zinc/32/23/69/847322369.db2.gz DQVKAOKYCBLNIF-LJQANCHMSA-N 0 3 414.571 4.041 20 0 HIADHN C[C@H](CN1CCCCC1)NC(=O)c1cnn(-c2ccc(Cl)cc2)c1C(F)(F)F ZINC000027763253 847348668 /nfs/dbraw/zinc/34/86/68/847348668.db2.gz GFDSOIPDBFOGKI-CYBMUJFWSA-N 0 3 414.859 4.149 20 0 HIADHN COc1cc(CN[C@@H](C)c2cccc(C(F)(F)F)c2)cc(Cl)c1OCC(N)=O ZINC000028305777 847405110 /nfs/dbraw/zinc/40/51/10/847405110.db2.gz RZRNZYLRVZSTMV-NSHDSACASA-N 0 3 416.827 4.082 20 0 HIADHN Cn1c(=S)n(CN2CCN(Cc3cccc4ccccc43)CC2)nc1-c1ccco1 ZINC000028785473 847460507 /nfs/dbraw/zinc/46/05/07/847460507.db2.gz FVDRRHTYZXIRKS-UHFFFAOYSA-N 0 3 419.554 4.140 20 0 HIADHN Cc1ccc(-n2ncc(C(=O)NC[C@@H](Cc3ccccc3)N(C)C)c2C(C)C)cc1 ZINC000028840230 847467163 /nfs/dbraw/zinc/46/71/63/847467163.db2.gz IBLWCMPRAZVGKW-JOCHJYFZSA-N 0 3 404.558 4.207 20 0 HIADHN Cc1noc(C)c1COc1cccc(C(=O)N[C@@H](CN2CCCC2)c2ccccc2)c1 ZINC000029177731 847520256 /nfs/dbraw/zinc/52/02/56/847520256.db2.gz PEGZJKUVRYHXHE-DEOSSOPVSA-N 0 3 419.525 4.437 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cnn(Cc2ccccc2Cl)c1)c1ccsc1 ZINC000029415099 847560023 /nfs/dbraw/zinc/56/00/23/847560023.db2.gz USOBNZAYWBBXFT-FQEVSTJZSA-N 0 3 416.978 4.459 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cnn(-c4ccccc4)c3C3CC3)cc2)CC1 ZINC000029798976 847621508 /nfs/dbraw/zinc/62/15/08/847621508.db2.gz PEODTGUHUAHJDU-UHFFFAOYSA-N 0 3 415.541 4.144 20 0 HIADHN CC(C)[C@H]1CCCCN1CC(=O)N(Cc1nnc(-c2ccccc2Cl)o1)C1CC1 ZINC000436468003 861816379 /nfs/dbraw/zinc/81/63/79/861816379.db2.gz HYKHRLLDMRGVFD-LJQANCHMSA-N 0 3 416.953 4.392 20 0 HIADHN O=C(c1cc(C2CC2)[nH]n1)N1CCN(Cc2ccc(-c3cccc(F)c3)s2)CC1 ZINC000030181045 847686918 /nfs/dbraw/zinc/68/69/18/847686918.db2.gz JUJBDPOWOUXVCE-UHFFFAOYSA-N 0 3 410.518 4.113 20 0 HIADHN COc1cc(CNCc2ccc(Cn3cncn3)cc2)ccc1OCc1cccs1 ZINC000030634218 847748734 /nfs/dbraw/zinc/74/87/34/847748734.db2.gz CZYLTCXRGONNQN-UHFFFAOYSA-N 0 3 420.538 4.265 20 0 HIADHN COc1cc(CNCc2ccc(CN3CCc4ccccc43)cc2)cc2c1OCCO2 ZINC000030639900 847750300 /nfs/dbraw/zinc/75/03/00/847750300.db2.gz BCUGKPSKEWXFLS-UHFFFAOYSA-N 0 3 416.521 4.319 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)c1cccc(NC(=O)C2CCCCC2)c1 ZINC000030640675 847751382 /nfs/dbraw/zinc/75/13/82/847751382.db2.gz MWKDKEBHMMZFLO-UHFFFAOYSA-N 0 3 419.569 4.384 20 0 HIADHN Cc1ccc(COc2ccc(CNCc3ccc(N4CCN(C)CC4)nc3)cc2)cc1 ZINC000030660786 847754211 /nfs/dbraw/zinc/75/42/11/847754211.db2.gz APJOWAOBLDRHSJ-UHFFFAOYSA-N 0 3 416.569 4.011 20 0 HIADHN COc1cc(CNCc2cccnc2-n2ccnc2)ccc1OCc1cccs1 ZINC000030902461 847795562 /nfs/dbraw/zinc/79/55/62/847795562.db2.gz VSRYJQPZQGIHKF-UHFFFAOYSA-N 0 3 406.511 4.206 20 0 HIADHN CCOCc1ccc(CNCc2cn(C)nc2-c2ccc3c(c2)OCCCO3)cc1 ZINC000030902779 847795916 /nfs/dbraw/zinc/79/59/16/847795916.db2.gz UZFCJAQCIONROO-UHFFFAOYSA-N 0 3 407.514 4.075 20 0 HIADHN Cc1ccccc1CN1CCCN(C(=O)c2c[nH]c(=S)n2-c2ccccc2)CC1 ZINC000031766004 847944906 /nfs/dbraw/zinc/94/49/06/847944906.db2.gz RUZJBHXGPZIIAV-UHFFFAOYSA-N 0 3 406.555 4.191 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cccc(OC[C@H]2CCCO2)c1)c1ccsc1 ZINC000031984521 847974745 /nfs/dbraw/zinc/97/47/45/847974745.db2.gz IMQOHKZDSFAFTM-RTWAWAEBSA-N 0 3 402.560 4.119 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cccc(NC(=O)c2cccnc2)c1)c1ccsc1 ZINC000031983311 847974866 /nfs/dbraw/zinc/97/48/66/847974866.db2.gz MGTKZOCSMANOPZ-NRFANRHFSA-N 0 3 422.554 4.208 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1sc(-c2ccccn2)nc1C)c1ccsc1 ZINC000031985944 847974879 /nfs/dbraw/zinc/97/48/79/847974879.db2.gz LLPAKGDFLGIOHT-KRWDZBQOSA-N 0 3 400.573 4.388 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)COc1ccccc1C(F)(F)F)c1ccsc1 ZINC000031983446 847974925 /nfs/dbraw/zinc/97/49/25/847974925.db2.gz ZXYPCKYTRAPDNJ-INIZCTEOSA-N 0 3 400.466 4.345 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cc(C2CC2)nc2c1c(C)nn2C)c1ccsc1 ZINC000031984712 847974969 /nfs/dbraw/zinc/97/49/69/847974969.db2.gz GMJWYVPLOSHOQJ-LJQANCHMSA-N 0 3 411.575 4.029 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cccc(OC[C@H]2CCCO2)c1)c1ccsc1 ZINC000031984523 847975006 /nfs/dbraw/zinc/97/50/06/847975006.db2.gz IMQOHKZDSFAFTM-NHCUHLMSSA-N 0 3 402.560 4.119 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cc(C2CC2)nc2c1c(C)nn2C)c1ccsc1 ZINC000031984711 847975027 /nfs/dbraw/zinc/97/50/27/847975027.db2.gz GMJWYVPLOSHOQJ-IBGZPJMESA-N 0 3 411.575 4.029 20 0 HIADHN CC[C@H](CNC(=O)Cc1nc(-c2cccs2)oc1C)N1CCc2ccccc2C1 ZINC000032447526 848029397 /nfs/dbraw/zinc/02/93/97/848029397.db2.gz AGYKSACTSBNGPB-LJQANCHMSA-N 0 3 409.555 4.207 20 0 HIADHN CC[C@@H](CNC(=O)Cc1csc(-c2ccc(C)o2)n1)N1CCc2ccccc2C1 ZINC000032447691 848029766 /nfs/dbraw/zinc/02/97/66/848029766.db2.gz IQOGTTXQYZDIKH-FQEVSTJZSA-N 0 3 409.555 4.207 20 0 HIADHN CCc1ccc([C@H](CNC(=O)c2ccc(Cl)c(N3CCCC3=O)c2)N(C)C)cc1 ZINC000032733594 848069076 /nfs/dbraw/zinc/06/90/76/848069076.db2.gz BUWHRSIWSPKCMI-NRFANRHFSA-N 0 3 413.949 4.062 20 0 HIADHN COc1ccc(Br)c(C(=O)NC[C@H](c2ccccc2)N2CCCC2)c1 ZINC000036659898 848152991 /nfs/dbraw/zinc/15/29/91/848152991.db2.gz MUBMXDVCOCSYPV-LJQANCHMSA-N 0 3 403.320 4.025 20 0 HIADHN Cc1nc(-c2ccc(C)cc2)c(CC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)s1 ZINC000036877028 848170452 /nfs/dbraw/zinc/17/04/52/848170452.db2.gz OOIBEBDZTQXWPO-OAQYLSRUSA-N 0 3 405.567 4.360 20 0 HIADHN CCOC(=O)c1c2c(sc1NC(=O)c1ccn(C(C)C)n1)C(C)(C)NC(C)(C)C2 ZINC000038508745 848178282 /nfs/dbraw/zinc/17/82/82/848178282.db2.gz RSONRBHDUZMHND-UHFFFAOYSA-N 0 3 418.563 4.114 20 0 HIADHN COc1cccc(CN2CCC(C(=O)Nc3ccccc3Br)CC2)c1 ZINC000038834908 848180746 /nfs/dbraw/zinc/18/07/46/848180746.db2.gz JJQSOQNBLIDEAJ-UHFFFAOYSA-N 0 3 403.320 4.308 20 0 HIADHN COc1ccc2[nH]cc(C3CCN(CCCn4c(=O)[nH]c5ccccc54)CC3)c2c1 ZINC000039383193 848183967 /nfs/dbraw/zinc/18/39/67/848183967.db2.gz PARCWSRJLFWZFN-UHFFFAOYSA-N 0 3 404.514 4.089 20 0 HIADHN Cc1nn(CC(C)C)c(C)c1CCC(=O)N1CCCN(Cc2ccccc2C)CC1 ZINC000041315133 848210707 /nfs/dbraw/zinc/21/07/07/848210707.db2.gz JWSPLGJTZKUNKP-UHFFFAOYSA-N 0 3 410.606 4.131 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)C[C@@H]1c2ccccc2C=CN1C(C)=O)c1ccsc1 ZINC000041441261 848214419 /nfs/dbraw/zinc/21/44/19/848214419.db2.gz XBHJQPVKDRGIIV-YADHBBJMSA-N 0 3 411.571 4.211 20 0 HIADHN CCOc1ccccc1C(=O)N1CCC[C@@H]1C(=O)C(C#N)c1nc2ccccc2s1 ZINC000041498162 848222587 /nfs/dbraw/zinc/22/25/87/848222587.db2.gz ZYDPBNGTAGQHCA-FUHWJXTLSA-N 0 3 419.506 4.176 20 0 HIADHN C[C@@H](NC(=O)c1ccccc1)C(=O)C(C#N)c1nc2cc(C(F)(F)F)ccc2s1 ZINC000041549361 848230537 /nfs/dbraw/zinc/23/05/37/848230537.db2.gz VTCKNBXQKYRRPW-RISCZKNCSA-N 0 3 417.412 4.310 20 0 HIADHN N#CC(C(=O)CCc1cnn(-c2ccccc2)c1)c1nc2ccccc2n1C(F)F ZINC000041557830 848232918 /nfs/dbraw/zinc/23/29/18/848232918.db2.gz ABBZOGJLXXJHLO-QGZVFWFLSA-N 0 3 405.408 4.426 20 0 HIADHN c1c(CNCc2ccnc(N3CCCC3)c2)c(-c2cccnc2)nn1-c1ccccc1 ZINC000042207694 848301578 /nfs/dbraw/zinc/30/15/78/848301578.db2.gz NRADMZBIMTUPFB-UHFFFAOYSA-N 0 3 410.525 4.219 20 0 HIADHN CC(C)NC(=O)CCNCc1cccc(NC(=O)c2ccc(Cl)cc2Cl)c1 ZINC000042225319 848304231 /nfs/dbraw/zinc/30/42/31/848304231.db2.gz HRBCEHRRKFHHJT-UHFFFAOYSA-N 0 3 408.329 4.250 20 0 HIADHN COc1ccc(NC(C)=O)cc1NC(=O)[C@@H](C)N[C@H](C)c1cccc2ccccc21 ZINC000042636680 848335542 /nfs/dbraw/zinc/33/55/42/848335542.db2.gz LKZUIUYDNBSIAC-HZPDHXFCSA-N 0 3 405.498 4.485 20 0 HIADHN CCOc1ccc(NC(=O)NCCCCN2CCN(c3cccc(C)c3)CC2)cc1 ZINC000043145393 848390760 /nfs/dbraw/zinc/39/07/60/848390760.db2.gz FHJSSOFRWUWRLF-UHFFFAOYSA-N 0 3 410.562 4.118 20 0 HIADHN COc1cc(NC(=O)N2CCCN(Cc3ccccc3C)CC2)c(OC)cc1Cl ZINC000043449478 848424918 /nfs/dbraw/zinc/42/49/18/848424918.db2.gz VUSDNBDBUFTULN-UHFFFAOYSA-N 0 3 417.937 4.405 20 0 HIADHN COc1ccc([C@H](C)NC(=O)Nc2cccc(CN(C)C)c2)cc1Br ZINC000044293179 848540364 /nfs/dbraw/zinc/54/03/64/848540364.db2.gz JTFPRVLZTPYYCL-ZDUSSCGKSA-N 0 3 406.324 4.402 20 0 HIADHN CN(C)c1ccc(NC(=O)N[C@H]2CCN(Cc3ccccc3)C2)c(C(F)(F)F)c1 ZINC000044368902 848552635 /nfs/dbraw/zinc/55/26/35/848552635.db2.gz LREKMVQISMTQRI-INIZCTEOSA-N 0 3 406.452 4.167 20 0 HIADHN CC(C)(C)n1ncc(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)c1C(F)(F)F ZINC000045080143 848630993 /nfs/dbraw/zinc/63/09/93/848630993.db2.gz XVQPDBXVHJZEKF-KRWDZBQOSA-N 0 3 408.468 4.224 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1ccc(NC(=O)OC)cc1)c1cccc(OC)c1 ZINC000045304704 848662639 /nfs/dbraw/zinc/66/26/39/848662639.db2.gz PNGIBWJPHPBNFB-HXUWFJFHSA-N 0 3 414.506 4.078 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N[C@H](C)c1nc2ccccc2[nH]1)c1cccc(OC)c1 ZINC000045595660 848698348 /nfs/dbraw/zinc/69/83/48/848698348.db2.gz GSDNTYPSMNGPOG-IERDGZPVSA-N 0 3 409.534 4.015 20 0 HIADHN C[C@@H](C(=O)Nc1ccc(Cl)cc1C(F)(F)F)N1CCN(C2CCCC2)CC1 ZINC000045768259 848724475 /nfs/dbraw/zinc/72/44/75/848724475.db2.gz CUWFZTJIXPYMCT-ZDUSSCGKSA-N 0 3 403.876 4.246 20 0 HIADHN Cc1ccc(-c2noc(CCCN3CCC(NC(=O)c4ccccc4)CC3)n2)cc1F ZINC000045794994 848729502 /nfs/dbraw/zinc/72/95/02/848729502.db2.gz MQPGCZWPDFYGTI-UHFFFAOYSA-N 0 3 422.504 4.011 20 0 HIADHN C[C@H](NC(=O)N1CCCN(Cc2ccccc2)CC1)c1cccc(OC(F)F)c1 ZINC000046610379 848885427 /nfs/dbraw/zinc/88/54/27/848885427.db2.gz INBZLVFUIPHZKK-KRWDZBQOSA-N 0 3 403.473 4.267 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)N(C)[C@H](C)c3cccs3)CC2)c1 ZINC000046867894 848949999 /nfs/dbraw/zinc/94/99/99/848949999.db2.gz IATUEAXISFQJFL-HXUWFJFHSA-N 0 3 414.619 4.361 20 0 HIADHN Cc1ccsc1CN(C)C(=O)NCCCCN1CCN(c2cccc(C)c2)CC1 ZINC000046867870 848950030 /nfs/dbraw/zinc/95/00/30/848950030.db2.gz XOOLLVJRSJUUHA-UHFFFAOYSA-N 0 3 414.619 4.109 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N[C@@H](C)c3cc(F)ccc3OC)c(C)c2)CC1 ZINC000046984953 848967427 /nfs/dbraw/zinc/96/74/27/848967427.db2.gz IYMQWQQUDGQPCE-KRWDZBQOSA-N 0 3 414.525 4.167 20 0 HIADHN CCOc1ccccc1CN(C)C(=O)Nc1ccc(N2CCN(CC)CC2)cc1C ZINC000047373756 849034529 /nfs/dbraw/zinc/03/45/29/849034529.db2.gz UIPSXQNSMYLELD-UHFFFAOYSA-N 0 3 410.562 4.200 20 0 HIADHN Cc1ccc(-n2cnnc2SCC(=O)Nc2cccc(CN(C)C)c2)cc1Cl ZINC000047453942 849051021 /nfs/dbraw/zinc/05/10/21/849051021.db2.gz JFEHPBYRHCOUTQ-UHFFFAOYSA-N 0 3 415.950 4.022 20 0 HIADHN CC(C)NC(=O)Nc1ccc([C@@H](C)NCc2cc(Cl)c3c(c2)OCCO3)cc1 ZINC000047723549 849099065 /nfs/dbraw/zinc/09/90/65/849099065.db2.gz HNFKGBBPOQEZOJ-CQSZACIVSA-N 0 3 403.910 4.492 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)N[C@H](c1ccccc1)c1ccccn1 ZINC000047950483 849143946 /nfs/dbraw/zinc/14/39/46/849143946.db2.gz ACFTXAOIFKLJJM-RBBKRZOGSA-N 0 3 406.555 4.369 20 0 HIADHN COc1cc(C)c([C@H](C)NC(=O)NC[C@@H](c2cccs2)N2CCCC2)cc1OC ZINC000047951694 849143976 /nfs/dbraw/zinc/14/39/76/849143976.db2.gz WUXKNNQSIWUOJI-WMZOPIPTSA-N 0 3 417.575 4.271 20 0 HIADHN CCOc1ccc(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2)cc1OCC ZINC000048054622 849155507 /nfs/dbraw/zinc/15/55/07/849155507.db2.gz SSJAUOAHGHSQEP-UHFFFAOYSA-N 0 3 403.498 4.219 20 0 HIADHN CCOC(=O)/C=C/c1ccc(NC(=O)NC[C@H](c2cccs2)N2CCCC2)cc1 ZINC000048064914 849158307 /nfs/dbraw/zinc/15/83/07/849158307.db2.gz KZMQEBUSJKDOKK-VSRDTVRMSA-N 0 3 413.543 4.283 20 0 HIADHN CCC(=O)Nc1ccc(NC(=O)NC[C@@H](c2cccc(OC)c2)N2CCCC2)cc1 ZINC000048390452 849216219 /nfs/dbraw/zinc/21/62/19/849216219.db2.gz ACHSCYIPBKGEPF-NRFANRHFSA-N 0 3 410.518 4.002 20 0 HIADHN CCC(=O)Nc1ccc(NC(=O)NC[C@H](c2cccc(OC)c2)N(CC)CC)cc1 ZINC000048393577 849216409 /nfs/dbraw/zinc/21/64/09/849216409.db2.gz YVTLZCYKRJWREC-OAQYLSRUSA-N 0 3 412.534 4.248 20 0 HIADHN CSc1ccc(CNCc2ccc(S(=O)(=O)N3CCC[C@H](C)C3)cc2)cc1 ZINC000048746514 849262665 /nfs/dbraw/zinc/26/26/65/849262665.db2.gz WDHFDYYUFKPJMV-KRWDZBQOSA-N 0 3 404.601 4.119 20 0 HIADHN Cc1nn(Cc2ccccc2)c(Cl)c1CNC1CCN(Cc2ccncc2)CC1 ZINC000048748011 849263107 /nfs/dbraw/zinc/26/31/07/849263107.db2.gz PFPLDFUXGOEHBR-UHFFFAOYSA-N 0 3 409.965 4.042 20 0 HIADHN CNC(=O)COc1cccc(CNCc2ccc(-c3cccc(Cl)c3)s2)c1 ZINC000048778955 849267014 /nfs/dbraw/zinc/26/70/14/849267014.db2.gz LBXAZTXAJRWNJF-UHFFFAOYSA-N 0 3 400.931 4.483 20 0 HIADHN Cc1nccn1-c1ccc(CNCc2ccc(-n3ccc(C(F)(F)F)n3)cc2)cn1 ZINC000048782552 849267944 /nfs/dbraw/zinc/26/79/44/849267944.db2.gz LPVHLKPLICCDPI-UHFFFAOYSA-N 0 3 412.419 4.070 20 0 HIADHN Cc1nccn1-c1ccc(CNCc2cc(C)c(OCc3ccccn3)c(C)c2)cn1 ZINC000048782539 849268538 /nfs/dbraw/zinc/26/85/38/849268538.db2.gz ZVLYHRBXEOAZNE-UHFFFAOYSA-N 0 3 413.525 4.456 20 0 HIADHN N#CC(C(=O)C1CCN(C(=O)CCc2ccccc2)CC1)c1ccc2ccccc2n1 ZINC000048857234 849275680 /nfs/dbraw/zinc/27/56/80/849275680.db2.gz KXAIVFGWDUHPMM-JOCHJYFZSA-N 0 3 411.505 4.282 20 0 HIADHN O=C(CN1CCN(CC2CCCCC2)CC1)Nc1ccc(Cl)cc1C(F)(F)F ZINC000049981820 849337544 /nfs/dbraw/zinc/33/75/44/849337544.db2.gz DGZLWUMXVDYNRF-UHFFFAOYSA-N 0 3 417.903 4.495 20 0 HIADHN COc1cc(OC)c([C@@H](C)[NH2+]C2CCN(C(=O)c3ccccc3[O-])CC2)cc1Cl ZINC000436827577 862008600 /nfs/dbraw/zinc/00/86/00/862008600.db2.gz KQOFKWPHUZCJRI-CQSZACIVSA-N 0 3 418.921 4.018 20 0 HIADHN O=C(c1ccccc1[O-])N1CCC([NH2+][C@H]2CCc3ccc(OC(F)(F)F)cc32)CC1 ZINC000436831890 862012444 /nfs/dbraw/zinc/01/24/44/862012444.db2.gz UKWALSJBEPBLGS-IBGZPJMESA-N 0 3 420.431 4.173 20 0 HIADHN O=C(NCc1ccccc1)C1CCN(Cc2ccc(OCc3cccnc3)cc2)CC1 ZINC000050959016 849422644 /nfs/dbraw/zinc/42/26/44/849422644.db2.gz ARTKJOIKROZWGF-UHFFFAOYSA-N 0 3 415.537 4.189 20 0 HIADHN Cc1cccc(NC(=O)[C@H]2CCCN(Cc3ccc(OCc4cccnc4)cc3)C2)n1 ZINC000050960663 849422774 /nfs/dbraw/zinc/42/27/74/849422774.db2.gz SGDXQYHHBFBNAV-QFIPXVFZSA-N 0 3 416.525 4.215 20 0 HIADHN CC(=O)c1cccc(OC[C@H](O)CN2CCC(c3c(C)[nH]c4ccccc43)CC2)c1 ZINC000051473274 849473215 /nfs/dbraw/zinc/47/32/15/849473215.db2.gz ASLPZLPJDRMCJZ-OAQYLSRUSA-N 0 3 406.526 4.298 20 0 HIADHN Cc1cc(O)c(C(C)C)cc1C(=O)NCCCCN1CCN(c2ccccc2)CC1 ZINC000436851935 862029448 /nfs/dbraw/zinc/02/94/48/862029448.db2.gz GLUGSTUWHGDRED-UHFFFAOYSA-N 0 3 409.574 4.156 20 0 HIADHN COC(=O)Nc1ccc(CNC(=O)CN[C@@H](c2ccc(Cl)cc2)C(C)C)cc1 ZINC000052428151 849580367 /nfs/dbraw/zinc/58/03/67/849580367.db2.gz YTTYPLURCNFSQM-HXUWFJFHSA-N 0 3 403.910 4.121 20 0 HIADHN C[C@@H](CNC(=O)N1CCC(C(=O)c2ccc(Cl)cc2)CC1)N1CCC[C@@H](C)C1 ZINC000052525288 849592885 /nfs/dbraw/zinc/59/28/85/849592885.db2.gz YFUNAPKVXHDRCK-SJORKVTESA-N 0 3 405.970 4.065 20 0 HIADHN COc1ccc(CN(C)C(=O)NC[C@H](c2ccccc2)N2CCC(C)CC2)cc1O ZINC000052582059 849596964 /nfs/dbraw/zinc/59/69/64/849596964.db2.gz MWYUQNSZKWYEFM-OAQYLSRUSA-N 0 3 411.546 4.015 20 0 HIADHN CCc1cccc(NC(=O)CNC2(c3ccc(Br)cc3)CCOCC2)c1 ZINC000052833897 849633521 /nfs/dbraw/zinc/63/35/21/849633521.db2.gz ABRTUBCOLGGYBQ-UHFFFAOYSA-N 0 3 417.347 4.246 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)[C@@H](C)Sc1ccc(NC(C)=O)cc1)c1ccsc1 ZINC000052877957 849638719 /nfs/dbraw/zinc/63/87/19/849638719.db2.gz ZKDJWUGQVMSGHT-QRWLVFNGSA-N 0 3 419.616 4.386 20 0 HIADHN COc1ccc(-c2nc(C)c(C(=O)N(CCN(C)C)C3CCCC3)s2)cc1OC ZINC000053152443 849672188 /nfs/dbraw/zinc/67/21/88/849672188.db2.gz XMSRXPLUPVKRRD-UHFFFAOYSA-N 0 3 417.575 4.082 20 0 HIADHN CC1CCN(Cc2ccccc2CNC(=O)CCC(=O)c2ccc(F)cc2F)CC1 ZINC000053264867 849687000 /nfs/dbraw/zinc/68/70/00/849687000.db2.gz TXDXRPCMSGGPMS-UHFFFAOYSA-N 0 3 414.496 4.476 20 0 HIADHN CN(CCNC(=O)COc1ccc(C2SCCCS2)cc1)Cc1ccccc1 ZINC000053349091 849697675 /nfs/dbraw/zinc/69/76/75/849697675.db2.gz FNJJONNQBNCDMX-UHFFFAOYSA-N 0 3 416.612 4.182 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Cc1coc(-c2ccccc2)n1)c1cccc(OC)c1 ZINC000053477554 849718133 /nfs/dbraw/zinc/71/81/33/849718133.db2.gz UGCVXBAYZMNJLF-QFIPXVFZSA-N 0 3 407.514 4.092 20 0 HIADHN NC(=O)C1CCN(Cc2cccc(NC(=O)c3sccc3-c3ccccc3)c2)CC1 ZINC000053996159 849790381 /nfs/dbraw/zinc/79/03/81/849790381.db2.gz VDNKPOQJZAXMAH-UHFFFAOYSA-N 0 3 419.550 4.365 20 0 HIADHN Cc1ccccc1-n1ncc(C(=O)NCCN(C)Cc2ccccc2)c1C(F)(F)F ZINC000054265470 849836112 /nfs/dbraw/zinc/83/61/12/849836112.db2.gz OKMRWCISCRFTMF-UHFFFAOYSA-N 0 3 416.447 4.061 20 0 HIADHN CN(C)Cc1cccc(NC(=O)NCC2(c3cccc(Cl)c3)CCOCC2)c1 ZINC000054408461 849861602 /nfs/dbraw/zinc/86/16/02/849861602.db2.gz IWOWYQLHYXFTEO-UHFFFAOYSA-N 0 3 401.938 4.272 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1NC(=O)CCN1CC=C(c2ccc(O)cc2)CC1 ZINC000054429230 849866477 /nfs/dbraw/zinc/86/64/77/849866477.db2.gz ZAAJHCYRCCXPMY-UHFFFAOYSA-N 0 3 416.525 4.313 20 0 HIADHN CCCC(=O)Nc1cccc(CNC(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)c1 ZINC000054717978 849912096 /nfs/dbraw/zinc/91/20/96/849912096.db2.gz ZXDJWFSBFFGALI-AVRDEDQJSA-N 0 3 408.546 4.060 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N[C@@H]1CCCOc2ccc(F)cc21 ZINC000054784437 849922736 /nfs/dbraw/zinc/92/27/36/849922736.db2.gz COBBQONMORWART-QZTJIDSGSA-N 0 3 403.523 4.237 20 0 HIADHN C[C@H](NCc1ccccc1CN1CCN(c2ccccc2)CC1)c1nc(C2CC2)no1 ZINC000056144164 850252945 /nfs/dbraw/zinc/25/29/45/850252945.db2.gz RATWZOLAMOWHRJ-IBGZPJMESA-N 0 3 417.557 4.120 20 0 HIADHN C[C@@H](c1ccc2ccccc2c1)N1CCC(NS(=O)(=O)c2cccs2)CC1 ZINC000056281690 850311639 /nfs/dbraw/zinc/31/16/39/850311639.db2.gz CJSKUPPHUFZKOI-INIZCTEOSA-N 0 3 400.569 4.405 20 0 HIADHN C[C@@H]1C[C@@H]1c1ccc(CCC(=O)NCCCCN2CCN(c3ccccc3)CC2)o1 ZINC000057113241 850549233 /nfs/dbraw/zinc/54/92/33/850549233.db2.gz GGKBICXFDLCQKE-OFNKIYASSA-N 0 3 409.574 4.054 20 0 HIADHN CCN(CC)[C@H](CNC(=O)C1(c2ccc(F)cc2)CCOCC1)c1ccsc1 ZINC000057211911 850579905 /nfs/dbraw/zinc/57/99/05/850579905.db2.gz MXZRLYDMHHUSPG-HXUWFJFHSA-N 0 3 404.551 4.135 20 0 HIADHN CCN(CC)[C@H](CNC(=O)C1(c2cccc(F)c2)CCOCC1)c1ccsc1 ZINC000057211909 850580230 /nfs/dbraw/zinc/58/02/30/850580230.db2.gz YXNLDTRTALMDKB-HXUWFJFHSA-N 0 3 404.551 4.135 20 0 HIADHN CN(C)Cc1ccccc1CNC(=O)Cc1csc(-c2ccc(Cl)s2)n1 ZINC000057427401 850634512 /nfs/dbraw/zinc/63/45/12/850634512.db2.gz FIFVBSKJIMVCSK-UHFFFAOYSA-N 0 3 405.976 4.446 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)N[C@@H]1CCSc2ccc(F)cc21 ZINC000057514209 850656246 /nfs/dbraw/zinc/65/62/46/850656246.db2.gz FWGUGLHZCKMJTD-QGZVFWFLSA-N 0 3 409.596 4.023 20 0 HIADHN CC[C@H](CNC(=O)Nc1cc(NC(=O)C2CC2)ccc1C)N1CCc2ccccc2C1 ZINC000057543258 850664758 /nfs/dbraw/zinc/66/47/58/850664758.db2.gz OJMSJXUCGVMPQP-JOCHJYFZSA-N 0 3 420.557 4.302 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCCc1cccc2cccnc21)c1cccc(OC)c1 ZINC000057562346 850668903 /nfs/dbraw/zinc/66/89/03/850668903.db2.gz GOTMJICZDBLSEO-HSZRJFAPSA-N 0 3 420.557 4.168 20 0 HIADHN CC[C@H](CNC(=O)Nc1nnc(-c2ccsc2)s1)N1CCc2ccccc2C1 ZINC000057787562 850715477 /nfs/dbraw/zinc/71/54/77/850715477.db2.gz DPTAUWMEPDYLSS-QGZVFWFLSA-N 0 3 413.572 4.225 20 0 HIADHN Cc1nc(-c2ccc(C)cc2NC(=O)CN[C@@H](C)c2ccc3c(c2)CCCC3)n[nH]1 ZINC000436980480 862160016 /nfs/dbraw/zinc/16/00/16/862160016.db2.gz QJHZQBKAHZIKMK-INIZCTEOSA-N 0 3 403.530 4.257 20 0 HIADHN CCN(Cc1cccc(NC(=O)NCC(C)(C)N2CCc3ccccc3C2)c1)C(C)=O ZINC000058153496 850775112 /nfs/dbraw/zinc/77/51/12/850775112.db2.gz VJIFHOCIMICOFL-UHFFFAOYSA-N 0 3 422.573 4.013 20 0 HIADHN COc1cc(CNCc2cc3ccccc3[nH]2)cc(I)c1OC ZINC000058473632 850833435 /nfs/dbraw/zinc/83/34/35/850833435.db2.gz YHAQPJRWJBLGRZ-UHFFFAOYSA-N 0 3 422.266 4.080 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)C1(c2ccc(F)cc2)CCCC1 ZINC000058490326 850837704 /nfs/dbraw/zinc/83/77/04/850837704.db2.gz MNVVRCGSSIUAPD-UHFFFAOYSA-N 0 3 423.576 4.356 20 0 HIADHN CC(C)Cc1ccc(C(=O)C2CCN(C[C@H](O)COCc3cccs3)CC2)cc1 ZINC000058580716 850861526 /nfs/dbraw/zinc/86/15/26/850861526.db2.gz CXJCRHGEUPJWMO-QFIPXVFZSA-N 0 3 415.599 4.419 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1ccc(C(F)(F)F)nc1C)c1cccc(OC)c1 ZINC000058698914 850893842 /nfs/dbraw/zinc/89/38/42/850893842.db2.gz TXTPSJOTPLUZHE-GOSISDBHSA-N 0 3 409.452 4.230 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)c2csc(-c3ccccc3OC)n2)N(C)C)cc1 ZINC000058784133 850925238 /nfs/dbraw/zinc/92/52/38/850925238.db2.gz BBORDXRXHHUTFE-HXUWFJFHSA-N 0 3 409.555 4.414 20 0 HIADHN COc1ccccc1-c1nc(C(=O)N(CCN(C)C)Cc2ccccc2F)cs1 ZINC000058853453 850943708 /nfs/dbraw/zinc/94/37/08/850943708.db2.gz XFVQGGLUEJUQNK-UHFFFAOYSA-N 0 3 413.518 4.162 20 0 HIADHN COc1cc(C(=O)N(CCN(C)C)Cc2ccc(F)cc2)ccc1OC1CCCC1 ZINC000059000596 850976284 /nfs/dbraw/zinc/97/62/84/850976284.db2.gz XGLAUBJSTWCYGR-UHFFFAOYSA-N 0 3 414.521 4.360 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)C1(c2ccc(Cl)cc2)CC1 ZINC000059850387 851018179 /nfs/dbraw/zinc/01/81/79/851018179.db2.gz VUHWAYZREHMPDF-UHFFFAOYSA-N 0 3 411.977 4.090 20 0 HIADHN Cc1[nH]c2ccc(C(=O)NCCCCN3CCN(Cc4ccccc4)CC3)cc2c1C ZINC000059850026 851018415 /nfs/dbraw/zinc/01/84/15/851018415.db2.gz NFBSEEAKJOHGLP-UHFFFAOYSA-N 0 3 418.585 4.113 20 0 HIADHN Cc1ccc([C@H](CNC(=O)C2(c3cccc(Br)c3)CC2)N(C)C)cc1 ZINC000060155841 851046706 /nfs/dbraw/zinc/04/67/06/851046706.db2.gz RDKJPQKXEMQUKN-IBGZPJMESA-N 0 3 401.348 4.208 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)/C=C/c2ccc(OCc3cccnc3)cc2)N(C)C)cc1 ZINC000060155829 851047369 /nfs/dbraw/zinc/04/73/69/851047369.db2.gz XXVJLRFXZSEERX-ZFBAEGHFSA-N 0 3 415.537 4.401 20 0 HIADHN O=C(c1cccn1Cc1ccccc1)N1CCCN(CCCc2ccccc2)CC1 ZINC000060355365 851075384 /nfs/dbraw/zinc/07/53/84/851075384.db2.gz JVPCSBQCSOILET-UHFFFAOYSA-N 0 3 401.554 4.317 20 0 HIADHN O=C(c1cnc(NC2CCN(Cc3ccccc3)CC2)c(Cl)c1)N1CCCCC1 ZINC000060445746 851103036 /nfs/dbraw/zinc/10/30/36/851103036.db2.gz BGPACIXDJPPPHX-UHFFFAOYSA-N 0 3 412.965 4.438 20 0 HIADHN Cc1cc(I)ccc1NC(=O)c1cccc(CN2CCCC2)c1 ZINC000060549581 851144236 /nfs/dbraw/zinc/14/42/36/851144236.db2.gz GCTHROXQGDPISI-UHFFFAOYSA-N 0 3 420.294 4.448 20 0 HIADHN O=C(NCc1cccc(Br)c1)NC[C@H](c1cccs1)N1CCCC1 ZINC000060564969 851149642 /nfs/dbraw/zinc/14/96/42/851149642.db2.gz UHNDEVRHWWWGCZ-MRXNPFEDSA-N 0 3 408.365 4.147 20 0 HIADHN COc1ccc(C(C)(C)CNC(=O)NC[C@H](c2cccs2)N2CCCC2)cc1 ZINC000060577074 851153046 /nfs/dbraw/zinc/15/30/46/851153046.db2.gz LKDKSZZEDIIZGH-LJQANCHMSA-N 0 3 401.576 4.171 20 0 HIADHN CC(C)c1cc(C(=O)N2CCN(CC3CCCCC3)CC2)c2cnn(C(C)C)c2n1 ZINC000060579972 851154484 /nfs/dbraw/zinc/15/44/84/851154484.db2.gz SWSFONSPKKEZAS-UHFFFAOYSA-N 0 3 411.594 4.474 20 0 HIADHN CN(C)CCN(CCc1ccccc1)C(=O)c1ccc(NC(=O)c2ccccc2)cc1 ZINC000060713638 851196537 /nfs/dbraw/zinc/19/65/37/851196537.db2.gz IGEKZRLOXOKLEX-UHFFFAOYSA-N 0 3 415.537 4.185 20 0 HIADHN CCN1CCN(Cc2ccc(CNC(=O)c3ccc(SC(F)F)cc3)cc2)CC1 ZINC000060758460 851206392 /nfs/dbraw/zinc/20/63/92/851206392.db2.gz XBAXNLCFCRSSAC-UHFFFAOYSA-N 0 3 419.541 4.069 20 0 HIADHN CCOC(=O)c1c2c(sc1NC(=O)c1cc(Cl)ccn1)C(C)(C)NC(C)(C)C2 ZINC000060776370 851210402 /nfs/dbraw/zinc/21/04/02/851210402.db2.gz ACCCSQYIDIOYMN-UHFFFAOYSA-N 0 3 421.950 4.385 20 0 HIADHN CCOC(=O)c1ccc(NC(=S)NC[C@@H](c2ccc(C)cc2)N2CCCC2)cc1 ZINC000060827108 851223955 /nfs/dbraw/zinc/22/39/55/851223955.db2.gz FNRDBUHINJKIHI-NRFANRHFSA-N 0 3 411.571 4.295 20 0 HIADHN S=C(NCCSc1ccccc1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000060837495 851226846 /nfs/dbraw/zinc/22/68/46/851226846.db2.gz MZLLOAOGJPVHEQ-UHFFFAOYSA-N 0 3 417.669 4.357 20 0 HIADHN COc1ccccc1[C@@H](CNc1cc(C)nc(-c2ccncc2)n1)N1CCCCC1 ZINC000060860565 851233940 /nfs/dbraw/zinc/23/39/40/851233940.db2.gz CPPJOLTZGQKKJS-OAQYLSRUSA-N 0 3 403.530 4.495 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N3CCC(OCc4ccccc4)CC3)cc2)CC1 ZINC000061135312 851301617 /nfs/dbraw/zinc/30/16/17/851301617.db2.gz SSZQVBILJOYZTO-UHFFFAOYSA-N 0 3 421.585 4.038 20 0 HIADHN CCOC(=O)N(C)c1ccc(NC(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)cc1 ZINC000061191301 851314018 /nfs/dbraw/zinc/31/40/18/851314018.db2.gz YPQSHTXNHNDARR-UHFFFAOYSA-N 0 3 424.545 4.062 20 0 HIADHN O=C(COc1ccc(C(F)(F)F)cc1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000061287548 851338370 /nfs/dbraw/zinc/33/83/70/851338370.db2.gz UVHLCKWERKEJOQ-UHFFFAOYSA-N 0 3 424.488 4.314 20 0 HIADHN O=C(CCOc1ccc(Cl)cc1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000061287725 851340060 /nfs/dbraw/zinc/34/00/60/851340060.db2.gz HIGDSWUQAMFBPU-UHFFFAOYSA-N 0 3 404.963 4.339 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)c1cc([N+](=O)[O-])ccc1Cl ZINC000061289737 851340104 /nfs/dbraw/zinc/34/01/04/851340104.db2.gz YVUYPXNDFMRBCH-UHFFFAOYSA-N 0 3 405.907 4.092 20 0 HIADHN O=C(CCOc1cccc(Cl)c1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000061287833 851340132 /nfs/dbraw/zinc/34/01/32/851340132.db2.gz XOLXPHSDZZLJPJ-UHFFFAOYSA-N 0 3 404.963 4.339 20 0 HIADHN CN(C)CCN(C(=O)CSCc1cc(-c2cccs2)on1)c1ccccc1 ZINC000061433692 851375950 /nfs/dbraw/zinc/37/59/50/851375950.db2.gz NBOSZIHGEHLOLQ-UHFFFAOYSA-N 0 3 401.557 4.231 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1C(=O)NC[C@H](c1ccc(C)cc1)N1CCCC1 ZINC000061503140 851391096 /nfs/dbraw/zinc/39/10/96/851391096.db2.gz KVSLMBUEWMNDLD-HSZRJFAPSA-N 0 3 402.542 4.364 20 0 HIADHN CCOc1ccc(/C=C(/C#N)C(=O)Nc2ccc(CCN3CCSCC3)cc2)cc1 ZINC000061572244 851408647 /nfs/dbraw/zinc/40/86/47/851408647.db2.gz JAOYJVSRVJQJED-FXBPSFAMSA-N 0 3 421.566 4.222 20 0 HIADHN CC1CCN([C@@H](CNC(=O)c2csc(-c3ccccn3)n2)c2ccccc2)CC1 ZINC000061622454 851415551 /nfs/dbraw/zinc/41/55/51/851415551.db2.gz MYWAHQPLQSQQMM-NRFANRHFSA-N 0 3 406.555 4.408 20 0 HIADHN COCCOc1ccc(NC(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)cc1F ZINC000061776736 851447589 /nfs/dbraw/zinc/44/75/89/851447589.db2.gz SHOMYEUDWZHKLV-NRFANRHFSA-N 0 3 415.509 4.118 20 0 HIADHN O=C(NCCc1ccccc1Cl)Nc1ccc(CCN2CCSCC2)cc1 ZINC000061791781 851454322 /nfs/dbraw/zinc/45/43/22/851454322.db2.gz LPWOUSAUUNIQBY-UHFFFAOYSA-N 0 3 403.979 4.296 20 0 HIADHN COc1ccc(CN(C)C(=O)Nc2ccc(CCN3CCSCC3)cc2)cc1F ZINC000061793222 851455286 /nfs/dbraw/zinc/45/52/86/851455286.db2.gz UIRUCQXJXVVRJJ-UHFFFAOYSA-N 0 3 417.550 4.090 20 0 HIADHN C[C@@H](NC(=O)Nc1ccc(CCN2CCSCC2)cc1)c1ccc(F)cc1F ZINC000061793441 851455534 /nfs/dbraw/zinc/45/55/34/851455534.db2.gz YFGGEVLGXZPWHO-OAHLLOKOSA-N 0 3 405.514 4.439 20 0 HIADHN CCOCc1ccccc1CNC(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000061793536 851455592 /nfs/dbraw/zinc/45/55/92/851455592.db2.gz FOFPLZZNYARMIL-UHFFFAOYSA-N 0 3 413.587 4.136 20 0 HIADHN O=C(NCc1cccc(OCC(F)(F)F)c1)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000061870852 851465643 /nfs/dbraw/zinc/46/56/43/851465643.db2.gz FROQBLZUHJLLJL-IBGZPJMESA-N 0 3 421.463 4.092 20 0 HIADHN C[C@@H](NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1)c1ccc(OC(F)F)cc1 ZINC000061966786 851482346 /nfs/dbraw/zinc/48/23/46/851482346.db2.gz RQCFVBZMEOEBFX-APWZRJJASA-N 0 3 403.473 4.313 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)Nc1ccc(Br)cc1 ZINC000062368170 851530524 /nfs/dbraw/zinc/53/05/24/851530524.db2.gz XWFIQRGLFJFEIO-UHFFFAOYSA-N 0 3 412.278 4.323 20 0 HIADHN CCOc1ccc(NC(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)cc1OCC ZINC000062375964 851533034 /nfs/dbraw/zinc/53/30/34/851533034.db2.gz AXLZJXUXYXBYGI-UHFFFAOYSA-N 0 3 421.488 4.358 20 0 HIADHN CCCNC(=O)c1cccc(NC(=O)N(CCN(C)C)Cc2cccc(Cl)c2)c1 ZINC000062389582 851538371 /nfs/dbraw/zinc/53/83/71/851538371.db2.gz KRVZBWMACBOPQA-UHFFFAOYSA-N 0 3 416.953 4.076 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)Nc1ccc(N2CCCCC2)nc1 ZINC000062390771 851539237 /nfs/dbraw/zinc/53/92/37/851539237.db2.gz AHXVYJKYMVJATR-UHFFFAOYSA-N 0 3 415.969 4.321 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)Nc1ccc(Cn2cccn2)cc1 ZINC000062411897 851547199 /nfs/dbraw/zinc/54/71/99/851547199.db2.gz TUGZFWRDLFCGKZ-UHFFFAOYSA-N 0 3 411.937 4.181 20 0 HIADHN CCOc1ccc([C@@H](C)NC(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)cc1 ZINC000062477026 851560304 /nfs/dbraw/zinc/56/03/04/851560304.db2.gz QWWSEHQWKPHVKV-MRXNPFEDSA-N 0 3 405.489 4.198 20 0 HIADHN CC(C)COc1cccc(CNC(=O)N(CCN(C)C)Cc2ccc(F)cc2F)c1 ZINC000062501177 851565975 /nfs/dbraw/zinc/56/59/75/851565975.db2.gz NITMVOHDAQCOPX-UHFFFAOYSA-N 0 3 419.516 4.273 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)N[C@@H]1CCCOc2ccc(F)cc21 ZINC000062500175 851566268 /nfs/dbraw/zinc/56/62/68/851566268.db2.gz CXHBSZAXJFCKSE-HXUWFJFHSA-N 0 3 421.463 4.091 20 0 HIADHN CC(C)COc1ccccc1CNC(=O)N(CCN(C)C)Cc1ccccc1F ZINC000062647464 851585179 /nfs/dbraw/zinc/58/51/79/851585179.db2.gz LRGCDMAATMLVLO-UHFFFAOYSA-N 0 3 401.526 4.134 20 0 HIADHN FC(F)(F)c1ccc(CCNC(=S)NC2CCN(Cc3ccccc3)CC2)cc1 ZINC000063143851 851619707 /nfs/dbraw/zinc/61/97/07/851619707.db2.gz IZNPSJGINSVMTC-UHFFFAOYSA-N 0 3 421.532 4.377 20 0 HIADHN CN(Cc1c(F)cccc1Cl)C(=S)NC1CCN(Cc2ccccc2)CC1 ZINC000063143894 851619741 /nfs/dbraw/zinc/61/97/41/851619741.db2.gz REWOMQXTYOTADV-UHFFFAOYSA-N 0 3 405.970 4.450 20 0 HIADHN S=C(NCc1csc(Br)c1)NC1CCN(Cc2ccccc2)CC1 ZINC000063148572 851622295 /nfs/dbraw/zinc/62/22/95/851622295.db2.gz MDXPLNMRENYHAB-UHFFFAOYSA-N 0 3 424.433 4.139 20 0 HIADHN CC(C)COc1ccccc1CNC(=S)NC1CCN(Cc2ccccc2)CC1 ZINC000063150552 851623156 /nfs/dbraw/zinc/62/31/56/851623156.db2.gz PDYXNZFNTKAZFR-UHFFFAOYSA-N 0 3 411.615 4.350 20 0 HIADHN CCCC(=O)Nc1cccc(CNC(=S)NC2CCN(Cc3ccccc3)CC2)c1 ZINC000063149333 851623964 /nfs/dbraw/zinc/62/39/64/851623964.db2.gz PUXWXBOVEPUDLX-UHFFFAOYSA-N 0 3 424.614 4.054 20 0 HIADHN CC(=O)c1c(C)cc(C)c(CN2CCC(C(=O)NCCc3cccs3)CC2)c1C ZINC000063301962 851654806 /nfs/dbraw/zinc/65/48/06/851654806.db2.gz DQMWFRHIUXYKHF-UHFFFAOYSA-N 0 3 412.599 4.447 20 0 HIADHN C[C@@H](N[C@H](Cc1ccccc1Cl)c1ccccc1)C(=O)Nc1ccc(C(N)=O)cc1 ZINC000063312000 851657117 /nfs/dbraw/zinc/65/71/17/851657117.db2.gz WDSOPOGLQXDDCD-OPAMFIHVSA-N 0 3 421.928 4.340 20 0 HIADHN COc1ccccc1NC(=O)c1ccc(NC(=O)CCN(C)Cc2ccoc2C)cc1 ZINC000063559672 851714126 /nfs/dbraw/zinc/71/41/26/851714126.db2.gz LHVGHWVYLISKDX-UHFFFAOYSA-N 0 3 421.497 4.310 20 0 HIADHN COc1ccc2ccccc2c1CNCc1ccc(C(=O)N2C[C@@H](C)O[C@H](C)C2)cc1 ZINC000063561702 851714823 /nfs/dbraw/zinc/71/48/23/851714823.db2.gz GGQDPOISJYESIO-RTBURBONSA-N 0 3 418.537 4.388 20 0 HIADHN COc1ccc(-c2nc(C)c(C(=O)N3CCCN(C(C)(C)C)CC3)s2)cc1OC ZINC000063722561 851748063 /nfs/dbraw/zinc/74/80/63/851748063.db2.gz OGFBHGPMFIJOHF-UHFFFAOYSA-N 0 3 417.575 4.082 20 0 HIADHN COc1cc(NC(=O)C(C)(C)C)c(C(=O)Nc2cccc(CN(C)C)c2)cc1OC ZINC000063779191 851761310 /nfs/dbraw/zinc/76/13/10/851761310.db2.gz JGZZXWXMXMKFSF-UHFFFAOYSA-N 0 3 413.518 4.002 20 0 HIADHN COc1ccc(NC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)c(OC)c1 ZINC000064316870 851869165 /nfs/dbraw/zinc/86/91/65/851869165.db2.gz XPGSNSIHSAFPLD-FQEVSTJZSA-N 0 3 408.420 4.097 20 0 HIADHN COc1ccccc1NC(=S)N(CCN(C)C)Cc1ccc(C(F)(F)F)cc1 ZINC000064371363 851880501 /nfs/dbraw/zinc/88/05/01/851880501.db2.gz XVFCVVZZDOFRQH-UHFFFAOYSA-N 0 3 411.493 4.475 20 0 HIADHN COc1cccc(CN(CCC(=O)Nc2ccc(Cl)cc2F)C[C@@H]2CCCO2)c1 ZINC000064400247 851889223 /nfs/dbraw/zinc/88/92/23/851889223.db2.gz OJCVVNQZGPQSAW-IBGZPJMESA-N 0 3 420.912 4.498 20 0 HIADHN C[C@H]1CN(c2ccc(NC(=O)N3CCN(CC4CCCCC4)CC3)cc2)C[C@H](C)O1 ZINC000064716301 851964602 /nfs/dbraw/zinc/96/46/02/851964602.db2.gz IVHJJSCBITWCOW-PMACEKPBSA-N 0 3 414.594 4.030 20 0 HIADHN CCOc1cccc(CNC(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)c1 ZINC000064755429 851977990 /nfs/dbraw/zinc/97/79/90/851977990.db2.gz UKARRJJNFOPWFS-UHFFFAOYSA-N 0 3 423.479 4.378 20 0 HIADHN COc1cc(CNC(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)ccc1C ZINC000064764006 851979909 /nfs/dbraw/zinc/97/99/09/851979909.db2.gz UOXRNBNJGYYHRL-UHFFFAOYSA-N 0 3 423.479 4.296 20 0 HIADHN COc1ccc(CCN(Cc2ccccc2)Cc2cc(=O)n3c(C)csc3n2)cc1 ZINC000064807318 851989236 /nfs/dbraw/zinc/98/92/36/851989236.db2.gz LDLHTYJIADJDNP-UHFFFAOYSA-N 0 3 419.550 4.318 20 0 HIADHN Cc1ccc2c(c1)[C@H]1CN(C)CC[C@@H]1N2C(=O)c1ccn(-c2ccccc2Cl)n1 ZINC000064898548 852015361 /nfs/dbraw/zinc/01/53/61/852015361.db2.gz CJZPSAFPINBDNM-UTKZUKDTSA-N 0 3 406.917 4.282 20 0 HIADHN COc1ccc([C@H](CNC(=O)NCc2ccc3[nH]c(C)c(C)c3c2)N2CCCC2)cc1 ZINC000065032227 852044715 /nfs/dbraw/zinc/04/47/15/852044715.db2.gz GHPGUJCRNXAPQU-DEOSSOPVSA-N 0 3 420.557 4.430 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cccc(NC(C)=O)c1)c1ccc(C(F)(F)F)cc1 ZINC000065121942 852072165 /nfs/dbraw/zinc/07/21/65/852072165.db2.gz DHCIJVCXXXOZOF-FQEVSTJZSA-N 0 3 421.463 4.477 20 0 HIADHN O=C(NCc1cccc(OC(F)F)c1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000065375578 852116494 /nfs/dbraw/zinc/11/64/94/852116494.db2.gz CTVOQPQDWQRBQR-UHFFFAOYSA-N 0 3 421.513 4.201 20 0 HIADHN Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)N(CCc1ccccc1)CCN(C)C ZINC000065376699 852116878 /nfs/dbraw/zinc/11/68/78/852116878.db2.gz HWOSMCJURHRSJT-UHFFFAOYSA-N 0 3 424.589 4.019 20 0 HIADHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)Nc1cccc(F)c1F ZINC000065424530 852128393 /nfs/dbraw/zinc/12/83/93/852128393.db2.gz ZFAMNBOQVIPTIY-UHFFFAOYSA-N 0 3 412.278 4.323 20 0 HIADHN C[C@@H](NCc1ccc(Br)c([N+](=O)[O-])c1)c1ccc(N2CCOCC2)cc1 ZINC000065429947 852128900 /nfs/dbraw/zinc/12/89/00/852128900.db2.gz UJZDNHZFTBYBBC-CQSZACIVSA-N 0 3 420.307 4.045 20 0 HIADHN CN(CCNC(=O)Nc1ccc(OC(F)F)cc1OC(F)F)Cc1ccccc1 ZINC000065446574 852136524 /nfs/dbraw/zinc/13/65/24/852136524.db2.gz HOCSULGNGCNPMJ-UHFFFAOYSA-N 0 3 415.387 4.143 20 0 HIADHN Cc1nn(C(F)F)c(C)c1CC(=O)NC[C@H](c1cccs1)N1CCC(C)CC1 ZINC000065534326 852169440 /nfs/dbraw/zinc/16/94/40/852169440.db2.gz PGWDKHORIBHFPY-QGZVFWFLSA-N 0 3 410.534 4.088 20 0 HIADHN Cc1nc(-c2ccc(CCNC(=O)NCCN(C)Cc3ccccc3)s2)cs1 ZINC000065542179 852171380 /nfs/dbraw/zinc/17/13/80/852171380.db2.gz YXBFJJUAJCTTFP-UHFFFAOYSA-N 0 3 414.600 4.154 20 0 HIADHN CN(C)CCN(C(=O)c1ccc(-n2ccc(C(F)(F)F)n2)cc1)C1CCCCC1 ZINC000065746302 852243423 /nfs/dbraw/zinc/24/34/23/852243423.db2.gz QBFVJOGZNQPFNO-UHFFFAOYSA-N 0 3 408.468 4.228 20 0 HIADHN CC1CCN([C@@H](CNC(=O)c2ccc(CN3CCCC3=O)cc2)c2ccccc2)CC1 ZINC000065802467 852260673 /nfs/dbraw/zinc/26/06/73/852260673.db2.gz IECXVWPLSHSALC-DEOSSOPVSA-N 0 3 419.569 4.012 20 0 HIADHN CC(C)NC(=O)Nc1ccc(NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)cc1 ZINC000065859882 852287891 /nfs/dbraw/zinc/28/78/91/852287891.db2.gz CVVCFCPXLJOXDP-GOSISDBHSA-N 0 3 412.509 4.206 20 0 HIADHN Cc1cccc(NC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)c1C(=O)N1CCCC1 ZINC000065867650 852291291 /nfs/dbraw/zinc/29/12/91/852291291.db2.gz QCIDQKHVTQFZAL-FQEVSTJZSA-N 0 3 423.532 4.221 20 0 HIADHN Cc1cc(NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)n(Cc2ccccc2)n1 ZINC000065876720 852298345 /nfs/dbraw/zinc/29/83/45/852298345.db2.gz DNKIXBADFLHWHZ-OAQYLSRUSA-N 0 3 406.505 4.230 20 0 HIADHN O=C(NCCc1ccccc1C(F)(F)F)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000065881446 852300633 /nfs/dbraw/zinc/30/06/33/852300633.db2.gz VXSFXAALOPQWKB-GOSISDBHSA-N 0 3 408.439 4.415 20 0 HIADHN CCn1c2ccccc2nc1[C@H](C)NC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000065927781 852319191 /nfs/dbraw/zinc/31/91/91/852319191.db2.gz QALHAARRCRLNPU-PKOBYXMFSA-N 0 3 408.521 4.285 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CC(=O)N(CCN(C)C)Cc1cccc(Cl)c1 ZINC000065937047 852324832 /nfs/dbraw/zinc/32/48/32/852324832.db2.gz ZAGBPOFLHCDTNJ-UHFFFAOYSA-N 0 3 424.976 4.275 20 0 HIADHN COCc1c2ccccc2oc1C(=O)N(CCN(C)C)Cc1cccc(Cl)c1 ZINC000065937004 852325284 /nfs/dbraw/zinc/32/52/84/852325284.db2.gz JZYKATCOFHXNNR-UHFFFAOYSA-N 0 3 400.906 4.437 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)c1csc(-c2ccccc2F)n1 ZINC000065937388 852325912 /nfs/dbraw/zinc/32/59/12/852325912.db2.gz WNJICTMYXNRXPC-UHFFFAOYSA-N 0 3 419.472 4.431 20 0 HIADHN CC(=O)Nc1cc(C(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)ccc1C ZINC000065938925 852328565 /nfs/dbraw/zinc/32/85/65/852328565.db2.gz XCYDRXCKCDFHOB-UHFFFAOYSA-N 0 3 421.463 4.176 20 0 HIADHN O=S(=O)([N-]C1CC[NH+](CC2CCCCC2)CC1)c1cc(Cl)ccc1Cl ZINC000065974244 852337498 /nfs/dbraw/zinc/33/74/98/852337498.db2.gz ZZJRPXKHPSOPPW-UHFFFAOYSA-N 0 3 405.391 4.316 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)NCCc1ccc(C(F)(F)F)cc1 ZINC000065984224 852340267 /nfs/dbraw/zinc/34/02/67/852340267.db2.gz JEWYAIAWPKEHHY-UHFFFAOYSA-N 0 3 411.443 4.160 20 0 HIADHN Cc1ccccc1C(=O)N[C@H](CC(C)C)C(=O)NC[C@H](c1ccccc1)N1CCCC1 ZINC000069251086 852390126 /nfs/dbraw/zinc/39/01/26/852390126.db2.gz SHLYXCMITZGMNX-DNQXCXABSA-N 0 3 421.585 4.093 20 0 HIADHN O=C(Cc1c(Cl)cccc1Cl)NCCCCN1CCN(c2ccccc2)CC1 ZINC000071966797 852450205 /nfs/dbraw/zinc/45/02/05/852450205.db2.gz CQDGVDKGTJSIKR-UHFFFAOYSA-N 0 3 420.384 4.255 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@@H](c1ccc(F)cc1)[C@@H]1CCCO1)c1ccsc1 ZINC000071999375 852457585 /nfs/dbraw/zinc/45/75/85/852457585.db2.gz VXHOKXOPYOHGDG-HKBOAZHASA-N 0 3 419.566 4.490 20 0 HIADHN CCN1CCN(CCCNC(=O)/C=C/c2ccc(-c3ccccc3Cl)s2)CC1 ZINC000071999698 852457812 /nfs/dbraw/zinc/45/78/12/852457812.db2.gz GKIHFOFXUGWLSP-PKNBQFBNSA-N 0 3 418.006 4.226 20 0 HIADHN CC1CCN([C@H](CNC(=O)c2ccc(NC(=O)C3CC3)cc2)c2ccccc2)CC1 ZINC000072006488 852462278 /nfs/dbraw/zinc/46/22/78/852462278.db2.gz YXUCICXYHQCJDG-HSZRJFAPSA-N 0 3 405.542 4.238 20 0 HIADHN COc1ccc([C@H](CNC(=O)[C@@H]2CCCN2Cc2ccccc2)N2CCCCC2)cc1 ZINC000072015393 852466673 /nfs/dbraw/zinc/46/66/73/852466673.db2.gz IZOSNSQLILUUIK-DQEYMECFSA-N 0 3 421.585 4.003 20 0 HIADHN COc1cc(Br)cc(C)c1NC(=O)N(CCN(C)C)Cc1ccccc1 ZINC000072015583 852467209 /nfs/dbraw/zinc/46/72/09/852467209.db2.gz DJOIRLSLAWFYMI-UHFFFAOYSA-N 0 3 420.351 4.362 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@@H](C)NCc2cc(C)c(OC)c(C)c2)cc1 ZINC000072032356 852474212 /nfs/dbraw/zinc/47/42/12/852474212.db2.gz PQKCMBXZOBBNDJ-GOSISDBHSA-N 0 3 404.576 4.193 20 0 HIADHN C[C@H](NCC1(c2c(F)cccc2F)CCCC1)C(=O)Nc1ccc2c(c1)OCO2 ZINC000072057680 852490172 /nfs/dbraw/zinc/49/01/72/852490172.db2.gz AIXLKYWAQQPZAU-AWEZNQCLSA-N 0 3 402.441 4.122 20 0 HIADHN CN(Cc1ccc(Br)s1)C(=O)N[C@H](CN1CCCC1)c1ccccc1 ZINC000097204877 852588900 /nfs/dbraw/zinc/58/89/00/852588900.db2.gz ZJHPTHKHPSCWQH-QGZVFWFLSA-N 0 3 422.392 4.489 20 0 HIADHN Cc1cc(C(=O)N[C@H](CN2CCCC2)c2ccccc2)c(C)n1Cc1ccccn1 ZINC000097286006 852596610 /nfs/dbraw/zinc/59/66/10/852596610.db2.gz ZOFRHVRXRRTPRY-XMMPIXPASA-N 0 3 402.542 4.115 20 0 HIADHN C[C@@H](NC(=O)N[C@H]1CCN(Cc2ccccc2)C1)c1ccc(Br)cc1 ZINC000105292548 852697062 /nfs/dbraw/zinc/69/70/62/852697062.db2.gz QSKKFSSOCIBXPU-BEFAXECRSA-N 0 3 402.336 4.084 20 0 HIADHN C[C@@H](NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(Br)cc1 ZINC000105292542 852697083 /nfs/dbraw/zinc/69/70/83/852697083.db2.gz QSKKFSSOCIBXPU-DNVCBOLYSA-N 0 3 402.336 4.084 20 0 HIADHN Cc1ccc(-n2ncc(C(=O)NC[C@@H](c3ccccc3)N(C)C)c2C(F)(F)F)cc1 ZINC000105596884 852715775 /nfs/dbraw/zinc/71/57/75/852715775.db2.gz LMYDUXRHAOCSLO-IBGZPJMESA-N 0 3 416.447 4.232 20 0 HIADHN O=C(N[C@@H]1CCN(Cc2ccccc2)C1)C1(c2ccc(Br)cc2)CCC1 ZINC000105701774 852723027 /nfs/dbraw/zinc/72/30/27/852723027.db2.gz CAUDCZUMOBMAIX-HXUWFJFHSA-N 0 3 413.359 4.262 20 0 HIADHN O=C(Nc1ccc(OCc2ccccc2)nc1)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000108120785 852824176 /nfs/dbraw/zinc/82/41/76/852824176.db2.gz SICCBPVAQNVBHL-QFIPXVFZSA-N 0 3 402.498 4.057 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Cc1ccc(F)c(Br)c1)c1ccsc1 ZINC000108316778 852838224 /nfs/dbraw/zinc/83/82/24/852838224.db2.gz CIKTVIKRORLUKB-KRWDZBQOSA-N 0 3 413.356 4.392 20 0 HIADHN CC(C)c1ccc(-c2noc(CCC(=O)N3CCN(CCC(C)(C)C)CC3)n2)cc1 ZINC000108397556 852846082 /nfs/dbraw/zinc/84/60/82/852846082.db2.gz BFWJSDSVTMGBQS-UHFFFAOYSA-N 0 3 412.578 4.373 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)CCCC(=O)c3ccc(OC)cc3)c(C)c2)CC1 ZINC000108416150 852847739 /nfs/dbraw/zinc/84/77/39/852847739.db2.gz ZYQSWMFCLVUFHB-UHFFFAOYSA-N 0 3 423.557 4.137 20 0 HIADHN CCn1c2ccccc2nc1SCC(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000108820959 852882426 /nfs/dbraw/zinc/88/24/26/852882426.db2.gz RZBHZAMETMAYGC-HKUYNNGSSA-N 0 3 408.571 4.100 20 0 HIADHN COc1cccc(Oc2ccc(CNC(=O)c3cccc(CN4CCCC4)c3)cn2)c1 ZINC000108965511 852899211 /nfs/dbraw/zinc/89/92/11/852899211.db2.gz FNTSCNPAEUUTIB-UHFFFAOYSA-N 0 3 417.509 4.408 20 0 HIADHN O=C(Nc1cc2c(cc1Cl)OCCCO2)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000109338673 852955732 /nfs/dbraw/zinc/95/57/32/852955732.db2.gz LWLJVJLPVFTFNK-MRXNPFEDSA-N 0 3 418.896 4.491 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)[C@H]1C[C@@H]1c1cccc(Br)c1 ZINC000109557933 852983946 /nfs/dbraw/zinc/98/39/46/852983946.db2.gz XQZZJWLHOMUNLG-RTWAWAEBSA-N 0 3 413.359 4.117 20 0 HIADHN CCC[C@H](C(=O)N1CCC[C@@H](CN2CCN(c3ccccn3)CC2)C1)c1ccccc1 ZINC000109649670 852994933 /nfs/dbraw/zinc/99/49/33/852994933.db2.gz ZXIFTAKHJLOXFW-UPVQGACJSA-N 0 3 420.601 4.026 20 0 HIADHN Cc1nc(COc2ccc(Cl)cc2)sc1C(=O)N1CCC[C@H]1CN1CCCC1 ZINC000109687904 852999383 /nfs/dbraw/zinc/99/93/83/852999383.db2.gz PRCORAISHLYMKY-KRWDZBQOSA-N 0 3 419.978 4.384 20 0 HIADHN CN(C(=O)Cc1coc2cc3c(cc12)CCC3)C1CCN(CCc2ccccn2)CC1 ZINC000109795898 853016198 /nfs/dbraw/zinc/01/61/98/853016198.db2.gz SFNFPSKYDBQKEJ-UHFFFAOYSA-N 0 3 417.553 4.025 20 0 HIADHN Cc1ccc2c(CN3CCC(CNC(=O)OC(C)(C)C)CC3)cc(=O)oc2c1C ZINC000109804186 853016932 /nfs/dbraw/zinc/01/69/32/853016932.db2.gz DNRNIGTWOCVKFK-UHFFFAOYSA-N 0 3 400.519 4.147 20 0 HIADHN O=C(Nc1cccc(OCc2cscn2)c1)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000110007311 853045908 /nfs/dbraw/zinc/04/59/08/853045908.db2.gz JATRSFOWWUWHEQ-IBGZPJMESA-N 0 3 408.527 4.118 20 0 HIADHN C[C@H](Cc1ccccc1F)NC(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000110121447 853063135 /nfs/dbraw/zinc/06/31/35/853063135.db2.gz JFDDBUGJCXLSBN-IIBYNOLFSA-N 0 3 408.439 4.328 20 0 HIADHN Cc1cc(Br)oc1C(=O)N1CCCN(CCCc2ccccc2)CC1 ZINC000110196846 853071836 /nfs/dbraw/zinc/07/18/36/853071836.db2.gz LEORHNNBPBELRF-UHFFFAOYSA-N 0 3 405.336 4.131 20 0 HIADHN COc1cc(C(=O)N2CCCN(CCCc3ccccc3)CC2)ccc1OC(C)C ZINC000110204012 853073256 /nfs/dbraw/zinc/07/32/56/853073256.db2.gz PMEDMGUXKQBVOV-UHFFFAOYSA-N 0 3 410.558 4.263 20 0 HIADHN Clc1ccc(Cc2nc(CN3CCC(CCN4CCOCC4)CC3)cs2)cc1 ZINC000110235498 853078250 /nfs/dbraw/zinc/07/82/50/853078250.db2.gz SUPNRVAGQSSLNU-UHFFFAOYSA-N 0 3 420.022 4.322 20 0 HIADHN c1ccc2nc(N3CCCCC3)c(CNCCOc3ccc4c(c3)OCO4)cc2c1 ZINC000110249209 853080316 /nfs/dbraw/zinc/08/03/16/853080316.db2.gz CCUFYVRGCJLMKF-UHFFFAOYSA-N 0 3 405.498 4.122 20 0 HIADHN CC(C)c1noc(-c2ccc(NC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)cc2)n1 ZINC000110313371 853086063 /nfs/dbraw/zinc/08/60/63/853086063.db2.gz IRJWPZQQNAYAST-HXUWFJFHSA-N 0 3 405.502 4.256 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)CCc3ccc(-c4ccccc4)o3)CC2)C[C@H](C)O1 ZINC000110411509 853096266 /nfs/dbraw/zinc/09/62/66/853096266.db2.gz HUPRUJWEDDOEGC-BGYRXZFFSA-N 0 3 410.558 4.227 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)c3sc(CC(C)C)nc3C)cc2)CC1 ZINC000110694522 853139666 /nfs/dbraw/zinc/13/96/66/853139666.db2.gz QVXSQAZKKVKQAS-UHFFFAOYSA-N 0 3 400.592 4.040 20 0 HIADHN Cc1cc(NC(=O)N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)ccc1Br ZINC000110717468 853144283 /nfs/dbraw/zinc/14/42/83/853144283.db2.gz GHOGHEULDQTRGZ-IYBDPMFKSA-N 0 3 424.383 4.111 20 0 HIADHN CN(CCN1CCCC1)C(=O)c1cccnc1Sc1ccc(Br)cc1 ZINC000110912377 853167474 /nfs/dbraw/zinc/16/74/74/853167474.db2.gz YYKAVQSHIUMDSQ-UHFFFAOYSA-N 0 3 420.376 4.163 20 0 HIADHN CCN(CC)[C@H](CNC(=O)[C@@H](c1ccccc1)N1CCCCC1=O)c1ccsc1 ZINC000110934606 853170631 /nfs/dbraw/zinc/17/06/31/853170631.db2.gz BKPKKQJVXSCFTK-IFMALSPDSA-N 0 3 413.587 4.001 20 0 HIADHN O=C(Nc1ccc(Cl)cn1)[C@@H]1CCCN(Cc2ccc(OC(F)(F)F)cc2)C1 ZINC000110983801 853179847 /nfs/dbraw/zinc/17/98/47/853179847.db2.gz NKHCTTPDARITHI-CQSZACIVSA-N 0 3 413.827 4.484 20 0 HIADHN CN(C)C(=O)Sc1ccc(NC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)cc1 ZINC000111012846 853187285 /nfs/dbraw/zinc/18/72/85/853187285.db2.gz NWDNPEJJWWTARU-KRWDZBQOSA-N 0 3 415.534 4.450 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2cccc(OCc3cscn3)c2)N(C)C)cc1 ZINC000111165373 853215448 /nfs/dbraw/zinc/21/54/48/853215448.db2.gz MSQIPZCZFRMJGD-OAQYLSRUSA-N 0 3 410.543 4.455 20 0 HIADHN COc1c(Br)cc(Br)cc1CNCCc1cscn1 ZINC000111626387 853228934 /nfs/dbraw/zinc/22/89/34/853228934.db2.gz MHBHMHRCORPIEU-UHFFFAOYSA-N 0 3 406.143 4.009 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)[C@H]2C[C@@H]2c2ccc(Br)cc2)o1 ZINC000116378159 853300197 /nfs/dbraw/zinc/30/01/97/853300197.db2.gz BZMZSIXWJMGFPR-MOPGFXCFSA-N 0 3 405.336 4.044 20 0 HIADHN CCN(CC)CCN(Cc1cccs1)S(=O)(=O)Cc1ccccc1Cl ZINC000116772717 853332626 /nfs/dbraw/zinc/33/26/26/853332626.db2.gz ALDAKZZYUDFLAR-UHFFFAOYSA-N 0 3 400.997 4.075 20 0 HIADHN Cc1nc(COc2cccc(C(=O)N(CCc3ccccc3)CCN(C)C)c2)cs1 ZINC000117114424 853344061 /nfs/dbraw/zinc/34/40/61/853344061.db2.gz DFQYQDAUPGKFHS-UHFFFAOYSA-N 0 3 423.582 4.277 20 0 HIADHN Cc1cc(C)n(Cc2ccc(C(=O)NC[C@H](c3cccs3)N3CCCC3)cc2)n1 ZINC000139679656 853418009 /nfs/dbraw/zinc/41/80/09/853418009.db2.gz GJMWTVYCXQXQMR-OAQYLSRUSA-N 0 3 408.571 4.177 20 0 HIADHN Cc1ccc(NC(=O)[C@H](C)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c(Cl)c1 ZINC000140190371 853437768 /nfs/dbraw/zinc/43/77/68/853437768.db2.gz MDUZFUWAXYIVRS-IRXDYDNUSA-N 0 3 401.938 4.163 20 0 HIADHN CCOc1cc(CNCc2ccc(Cn3ccccc3=O)cc2)cc(Cl)c1OC ZINC000140421166 853444106 /nfs/dbraw/zinc/44/41/06/853444106.db2.gz BXKWKVDBBTZKAS-UHFFFAOYSA-N 0 3 412.917 4.247 20 0 HIADHN Cc1ccc([C@H](CNC(=O)NCc2coc(-c3cccs3)n2)N2CCCC2)cc1 ZINC000141717508 853479013 /nfs/dbraw/zinc/47/90/13/853479013.db2.gz SFJWRTOGFHELPN-IBGZPJMESA-N 0 3 410.543 4.348 20 0 HIADHN COc1cc(OC)c(NC(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)cc1Cl ZINC000142973855 853505482 /nfs/dbraw/zinc/50/54/82/853505482.db2.gz CXMPDGMGDBFVPM-UHFFFAOYSA-N 0 3 417.937 4.140 20 0 HIADHN Cc1nn(C(F)F)c(C)c1CC(=O)N[C@H](CN1CCc2ccccc2C1)C(C)(C)C ZINC000144882355 853542511 /nfs/dbraw/zinc/54/25/11/853542511.db2.gz LJOUPADOSOVEOV-HXUWFJFHSA-N 0 3 418.532 4.027 20 0 HIADHN CCN(C(=S)NC1CCN(Cc2ccccc2)CC1)[C@@H](C)c1ccc(C#N)cc1 ZINC000145326532 853549355 /nfs/dbraw/zinc/54/93/55/853549355.db2.gz JERLGZJNUSBSCA-IBGZPJMESA-N 0 3 406.599 4.480 20 0 HIADHN C[C@H](OCCCNC(=S)NC1CCN(Cc2ccccc2)CC1)c1ccccc1 ZINC000145502809 853552369 /nfs/dbraw/zinc/55/23/69/853552369.db2.gz NLEVCWXDGSFHFA-FQEVSTJZSA-N 0 3 411.615 4.283 20 0 HIADHN COc1cccc(NC(=O)C(C#N)C(=O)c2cnc(-c3ccc(C)cc3C)s2)c1 ZINC000147050308 853580801 /nfs/dbraw/zinc/58/08/01/853580801.db2.gz BEXRZCVAFWJZRL-GOSISDBHSA-N 0 3 405.479 4.397 20 0 HIADHN COc1ccc(NC(=O)C(C#N)C(=O)c2cnc(-c3ccc(C)cc3C)s2)cc1 ZINC000147154870 853582699 /nfs/dbraw/zinc/58/26/99/853582699.db2.gz XCJIYCCFVLXVQS-GOSISDBHSA-N 0 3 405.479 4.397 20 0 HIADHN COc1ccc(CN[C@H](C)c2ccc(N3CCOC3=O)cc2)cc1OCCCC#N ZINC000147197830 853584233 /nfs/dbraw/zinc/58/42/33/853584233.db2.gz OEGNBZIECABUFH-QGZVFWFLSA-N 0 3 409.486 4.185 20 0 HIADHN COc1ccc(OC(F)F)c(NC(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)c1 ZINC000149457995 853625525 /nfs/dbraw/zinc/62/55/25/853625525.db2.gz WULLOZXXTVXXRA-UHFFFAOYSA-N 0 3 419.472 4.079 20 0 HIADHN N#CC(C(=O)Cc1csc(-c2ccc(Cl)s2)n1)C(=O)Nc1ccccc1 ZINC000150047047 853636740 /nfs/dbraw/zinc/63/67/40/853636740.db2.gz VDRJSJMURVPCKA-CYBMUJFWSA-N 0 3 401.900 4.415 20 0 HIADHN Cc1sc2ncnc(SCCC(=O)C(C#N)C(=O)Nc3ccccc3)c2c1C ZINC000150076539 853636762 /nfs/dbraw/zinc/63/67/62/853636762.db2.gz UNTDSXLFJRSPFU-OAHLLOKOSA-N 0 3 410.524 4.138 20 0 HIADHN COc1cc(CNCc2cccnc2-n2ccnc2)ccc1OCc1ccc(F)cc1 ZINC000195569593 853689519 /nfs/dbraw/zinc/68/95/19/853689519.db2.gz DLNKLABRRGZTCD-UHFFFAOYSA-N 0 3 418.472 4.284 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3cccc(NC(=O)C(C)C)c3)c(C)c2)CC1 ZINC000195700957 853767453 /nfs/dbraw/zinc/76/74/53/853767453.db2.gz FKBVGAVXWBOOKZ-UHFFFAOYSA-N 0 3 423.561 4.375 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)Nc3ccc4nc(N(C)C)ccc4c3)cc2)CC1 ZINC000195742607 853789467 /nfs/dbraw/zinc/78/94/67/853789467.db2.gz KNYLTBJTAYQDKP-UHFFFAOYSA-N 0 3 417.557 4.084 20 0 HIADHN Cc1ccc(N2CCC(C(=O)Nc3cccc(CN4CCSCC4)c3C)CC2)nc1 ZINC000195744391 853791204 /nfs/dbraw/zinc/79/12/04/853791204.db2.gz PBKLZEHTCWBUOD-UHFFFAOYSA-N 0 3 424.614 4.102 20 0 HIADHN Cc1cc(C(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)c(C)n1Cc1ccccn1 ZINC000195745092 853791234 /nfs/dbraw/zinc/79/12/34/853791234.db2.gz QSHZMISYTUAEQU-RUZDIDTESA-N 0 3 416.569 4.424 20 0 HIADHN Cc1ccc(-c2nn(Cc3ccccc3)cc2C(=O)N(C)C2CCN(C)CC2)cc1C ZINC000215836068 853838716 /nfs/dbraw/zinc/83/87/16/853838716.db2.gz ZIVPDZDXWKURIC-UHFFFAOYSA-N 0 3 416.569 4.381 20 0 HIADHN COc1c(Br)cc(CNC[C@H](O)c2ccsc2)cc1Br ZINC000219105114 853867085 /nfs/dbraw/zinc/86/70/85/853867085.db2.gz FPSJBGUMLXHRGW-ZDUSSCGKSA-N 0 3 421.154 4.105 20 0 HIADHN CCOc1c(Br)cc(Br)cc1CNC[C@@H](O)CC(C)C ZINC000224268054 853878608 /nfs/dbraw/zinc/87/86/08/853878608.db2.gz CXQZQEWSPRJRFP-ZDUSSCGKSA-N 0 3 409.162 4.107 20 0 HIADHN CN(C)CCN(C(=O)c1cc(Br)sc1Br)C1CCCC1 ZINC000227276519 853884977 /nfs/dbraw/zinc/88/49/77/853884977.db2.gz BRGVPEUMNZTWPO-UHFFFAOYSA-N 0 3 424.202 4.220 20 0 HIADHN c1cn(-c2ccc(CNCc3cn(Cc4ccccc4)nc3-c3cccnc3)cc2)cn1 ZINC000236581581 853899446 /nfs/dbraw/zinc/89/94/46/853899446.db2.gz WWZLWDPLRMNKNE-UHFFFAOYSA-N 0 3 420.520 4.469 20 0 HIADHN Brc1cc(CN[C@H](c2ccc3c(c2)OCCO3)C2CC2)cc2c1OCO2 ZINC000236596037 853900656 /nfs/dbraw/zinc/90/06/56/853900656.db2.gz GQVQNGAYNNRDAJ-IBGZPJMESA-N 0 3 418.287 4.190 20 0 HIADHN CC(C)c1noc(CCCNCc2nc(-c3ccc(Br)cc3)c[nH]2)n1 ZINC000236633696 853905918 /nfs/dbraw/zinc/90/59/18/853905918.db2.gz ICQVTROGYYOBHB-UHFFFAOYSA-N 0 3 404.312 4.068 20 0 HIADHN CC(=O)N(c1nc(CNC[C@@H](C)N2CCC(C)CC2)cs1)c1ccc(F)cc1 ZINC000236658792 853908339 /nfs/dbraw/zinc/90/83/39/853908339.db2.gz LHOZZNKXZIRPMR-MRXNPFEDSA-N 0 3 404.555 4.177 20 0 HIADHN CC(C)COc1ccc(CNCc2ccc(S(=O)(=O)N3CCCCC3)cc2)cc1 ZINC000236717786 853915205 /nfs/dbraw/zinc/91/52/05/853915205.db2.gz APWXCZGAULHJBM-UHFFFAOYSA-N 0 3 416.587 4.186 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@@H](C)NCc2cnn(-c3ccccc3)c2)CC1 ZINC000236851862 853929008 /nfs/dbraw/zinc/92/90/08/853929008.db2.gz XWGTYEVZSVHPSH-LJQANCHMSA-N 0 3 407.537 4.004 20 0 HIADHN CCOc1cc(CN[C@@H]2CCSc3ccccc32)ccc1O[C@H](C)C(=O)N(C)C ZINC000236893012 853933185 /nfs/dbraw/zinc/93/31/85/853933185.db2.gz MPWSHLRZZGUOSF-VQIMIIECSA-N 0 3 414.571 4.268 20 0 HIADHN CCOc1cc(CNC(C)(C)c2cccc(F)c2)ccc1O[C@H](C)C(=O)N(C)C ZINC000236910352 853936179 /nfs/dbraw/zinc/93/61/79/853936179.db2.gz QRIPZYXAUOZEBO-MRXNPFEDSA-N 0 3 402.510 4.105 20 0 HIADHN CCOc1cc(CNC[C@@](C)(O)c2ccco2)cc(Br)c1OC(F)F ZINC000236948277 853941594 /nfs/dbraw/zinc/94/15/94/853941594.db2.gz SHIGHTNLTFEORO-QGZVFWFLSA-N 0 3 420.250 4.040 20 0 HIADHN CCNC(=O)c1ccc(CNCc2ccc(OCc3cccs3)c(OC)c2)cc1 ZINC000236979054 853946403 /nfs/dbraw/zinc/94/64/03/853946403.db2.gz FAVXMHMNFONFIU-UHFFFAOYSA-N 0 3 410.539 4.375 20 0 HIADHN Cc1cc(CN[C@@H](Cc2ccccc2)C(=O)N(C)C)cc(C)c1OCc1ccccn1 ZINC000237025950 853953394 /nfs/dbraw/zinc/95/33/94/853953394.db2.gz TVNKQXIXNBSZRU-DEOSSOPVSA-N 0 3 417.553 4.067 20 0 HIADHN CNC(=O)c1ccc(CN[C@@H]2c3cc(Br)ccc3SC[C@H]2C)cc1 ZINC000237042148 853956734 /nfs/dbraw/zinc/95/67/34/853956734.db2.gz HJPREHHUGBATHE-XIKOKIGWSA-N 0 3 405.361 4.381 20 0 HIADHN COc1cc(CNC(C)(C)c2ccc(Cl)cc2)ccc1OCC(=O)N1CCCC1 ZINC000237098660 853964001 /nfs/dbraw/zinc/96/40/01/853964001.db2.gz JQGQHXZLSSYZJT-UHFFFAOYSA-N 0 3 416.949 4.375 20 0 HIADHN CN(C)[C@@H](CNCc1nc(-c2cccc(Br)c2)c[nH]1)c1cccs1 ZINC000237179080 853976223 /nfs/dbraw/zinc/97/62/23/853976223.db2.gz JURCJSYLYXTUTR-INIZCTEOSA-N 0 3 405.365 4.293 20 0 HIADHN COc1cc(CNCc2ccccc2CN2C[C@@H](C)O[C@H](C)C2)ccc1OC(F)F ZINC000237215569 853984290 /nfs/dbraw/zinc/98/42/90/853984290.db2.gz BCUMESJZDUVYPD-IAGOWNOFSA-N 0 3 420.500 4.196 20 0 HIADHN COCCOc1ccc(CN[C@@H](C)c2ccc(NC(=O)c3ccncc3)cc2)cc1 ZINC000237213440 853984757 /nfs/dbraw/zinc/98/47/57/853984757.db2.gz IHISNJNDANGUSJ-SFHVURJKSA-N 0 3 405.498 4.210 20 0 HIADHN COc1cc(CN[C@H](C)c2ccc(NC(N)=O)cc2)ccc1OCc1ccncc1 ZINC000237221832 853985660 /nfs/dbraw/zinc/98/56/60/853985660.db2.gz GKBQOHJXKYMZQC-MRXNPFEDSA-N 0 3 406.486 4.011 20 0 HIADHN COc1ccc(CNCc2ccc(-n3ccc(C(F)(F)F)n3)cc2)cc1NC(C)=O ZINC000237249561 853990837 /nfs/dbraw/zinc/99/08/37/853990837.db2.gz OCEVFHBNKMBDEW-UHFFFAOYSA-N 0 3 418.419 4.148 20 0 HIADHN COc1ccc(CNCc2ccc(-n3cncn3)cc2)cc1OCc1ccccc1 ZINC000237251204 853991334 /nfs/dbraw/zinc/99/13/34/853991334.db2.gz BWIQDSHOHISRHG-UHFFFAOYSA-N 0 3 400.482 4.145 20 0 HIADHN COc1cc(CNCc2ccc3ccccc3c2)ccc1OCC(=O)N1CCCC1 ZINC000237273014 853994894 /nfs/dbraw/zinc/99/48/94/853994894.db2.gz JQQQAYXBJYKTCR-UHFFFAOYSA-N 0 3 404.510 4.139 20 0 HIADHN COc1cc(CNCc2cccc(Cn3cccn3)c2)ccc1OCC(F)(F)F ZINC000237278425 853996688 /nfs/dbraw/zinc/99/66/88/853996688.db2.gz FVSWKRBQQCQETO-UHFFFAOYSA-N 0 3 405.420 4.171 20 0 HIADHN CS(=O)(=O)CCCNCc1ccc(OCc2ccc(Cl)c(Cl)c2)cc1 ZINC000237300239 854001376 /nfs/dbraw/zinc/00/13/76/854001376.db2.gz UASFSRFNWDRTOR-UHFFFAOYSA-N 0 3 402.343 4.097 20 0 HIADHN COc1ccc(NC(=O)C[C@H](C)N[C@H]2CCOc3c(Cl)cccc32)c(OC)c1 ZINC000237307382 854003502 /nfs/dbraw/zinc/00/35/02/854003502.db2.gz MCJAJJQWZCENKZ-GUYCJALGSA-N 0 3 404.894 4.188 20 0 HIADHN COc1ccc(CN[C@@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)c(OC)c1OC ZINC000237328533 854007635 /nfs/dbraw/zinc/00/76/35/854007635.db2.gz XCGQPGFXSXTPMH-GOSISDBHSA-N 0 3 424.463 4.095 20 0 HIADHN COc1ccc(OC)c(NC(=O)C[C@@H](C)N[C@@H](c2nc3ccccc3[nH]2)C(C)C)c1 ZINC000237397600 854022686 /nfs/dbraw/zinc/02/26/86/854022686.db2.gz UMHWZTHBIQJIRT-IVZQSRNASA-N 0 3 410.518 4.284 20 0 HIADHN COc1ccc(-c2ccc(CNC[C@](C)(O)c3ccc(F)cc3F)o2)c([N+](=O)[O-])c1 ZINC000237430680 854031389 /nfs/dbraw/zinc/03/13/89/854031389.db2.gz KVVKIPJKYOLNPH-NRFANRHFSA-N 0 3 418.396 4.139 20 0 HIADHN C[C@H](C[C@@H]1CCCCCN1C(=O)OC(C)(C)C)N[C@@H](C)c1nnc2ccccn21 ZINC000237449497 854035770 /nfs/dbraw/zinc/03/57/70/854035770.db2.gz NYYBPZSUUVAYKI-SQNIBIBYSA-N 0 3 401.555 4.338 20 0 HIADHN C[C@@H](NCc1cccc(OCc2ccccc2)c1)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000237455098 854036323 /nfs/dbraw/zinc/03/63/23/854036323.db2.gz ULQWLOPXASETHQ-LJQANCHMSA-N 0 3 424.566 4.367 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(CNC[C@@H](O)c3ccc(Cl)cc3)c2)cc1 ZINC000237465269 854037848 /nfs/dbraw/zinc/03/78/48/854037848.db2.gz GRKVKUMFXUYTIM-JOCHJYFZSA-N 0 3 410.901 4.424 20 0 HIADHN COc1cc(OC)cc([C@@H](O)CNCc2ccc(-c3nc4ccccc4s3)o2)c1 ZINC000237465406 854037957 /nfs/dbraw/zinc/03/79/57/854037957.db2.gz ULJPEVIIFDETOJ-IBGZPJMESA-N 0 3 410.495 4.397 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(OCCNCc3ccccc3OC)c2)cc1 ZINC000237476424 854041086 /nfs/dbraw/zinc/04/10/86/854041086.db2.gz NRTDHGHGNCJCAT-UHFFFAOYSA-N 0 3 406.482 4.125 20 0 HIADHN COc1ccc(C[C@H](C)NCc2csc(-c3ccc4c(c3)OCO4)n2)cc1OC ZINC000237556131 854054251 /nfs/dbraw/zinc/05/42/51/854054251.db2.gz AUENKKGDDIENAG-AWEZNQCLSA-N 0 3 412.511 4.277 20 0 HIADHN Cc1ccc(COc2ccc(CNCc3ccc(N4CCO[C@H](C)C4)nc3)cc2)cc1 ZINC000237595186 854059533 /nfs/dbraw/zinc/05/95/33/854059533.db2.gz AVGPKYVEMQXFDC-OAQYLSRUSA-N 0 3 417.553 4.484 20 0 HIADHN C[C@H]1CN(Cc2ccccc2CNCc2ccc(F)c(Br)c2)C[C@H](C)O1 ZINC000237622054 854063791 /nfs/dbraw/zinc/06/37/91/854063791.db2.gz MFWOKCQZTOGXCT-HOTGVXAUSA-N 0 3 421.354 4.487 20 0 HIADHN C[C@H]1CN(Cc2ccccc2CNCc2ccc(Br)s2)C[C@H](C)O1 ZINC000237621420 854064016 /nfs/dbraw/zinc/06/40/16/854064016.db2.gz DKQAKKDCOBFKPE-GJZGRUSLSA-N 0 3 409.393 4.410 20 0 HIADHN Cc1nn(Cc2ccccc2Cl)c(C)c1CNCc1ccc(N2CCOCC2)cc1 ZINC000237679235 854073782 /nfs/dbraw/zinc/07/37/82/854073782.db2.gz JATDGYMPBNCBHG-UHFFFAOYSA-N 0 3 424.976 4.328 20 0 HIADHN Cn1nncc1CNC[C@@H](c1ccc(Cl)cc1Cl)N1CCc2sccc2C1 ZINC000237684100 854074873 /nfs/dbraw/zinc/07/48/73/854074873.db2.gz PSPWDHFUJDLOLE-SFHVURJKSA-N 0 3 422.385 4.073 20 0 HIADHN Cc1nn(C)c(C)c1CCNCc1c(C)nn(Cc2ccccc2Cl)c1Cl ZINC000237698880 854078059 /nfs/dbraw/zinc/07/80/59/854078059.db2.gz GTHXCHPUFDTKHA-UHFFFAOYSA-N 0 3 406.361 4.229 20 0 HIADHN Cc1nn(-c2ccc(Br)cc2)c(C)c1CNC[C@@](C)(O)c1ccsc1 ZINC000237700771 854078970 /nfs/dbraw/zinc/07/89/70/854078970.db2.gz LCYRIZUQMPNYNS-LJQANCHMSA-N 0 3 420.376 4.310 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)c(C)c1CNC[C@](C)(O)c1ccc(F)cc1F ZINC000237723382 854083852 /nfs/dbraw/zinc/08/38/52/854083852.db2.gz ZBUVCBBANAJVQZ-NRFANRHFSA-N 0 3 405.876 4.418 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(Cl)c1CNCCc1nc2c(cccc2F)n1C ZINC000237775442 854094647 /nfs/dbraw/zinc/09/46/47/854094647.db2.gz RBOHVAMZRRFHQZ-UHFFFAOYSA-N 0 3 415.875 4.331 20 0 HIADHN O=C(Nc1cccc(CNCCn2c(=O)[nH]c3ccccc32)c1)c1ccccc1Cl ZINC000237862407 854110650 /nfs/dbraw/zinc/11/06/50/854110650.db2.gz WELULJWIJXSHJS-UHFFFAOYSA-N 0 3 420.900 4.025 20 0 HIADHN O=C(NCCNCc1cccc(NC(=O)c2ccc(Cl)cc2)c1)c1cccs1 ZINC000237871533 854111897 /nfs/dbraw/zinc/11/18/97/854111897.db2.gz TYWYLILLHWRQBQ-UHFFFAOYSA-N 0 3 413.930 4.173 20 0 HIADHN O=C(NC1CCCCC1)N1CCC(NCc2csc(-c3cccs3)n2)CC1 ZINC000237928340 854120987 /nfs/dbraw/zinc/12/09/87/854120987.db2.gz PUHDLMIUGAAJGC-UHFFFAOYSA-N 0 3 404.605 4.468 20 0 HIADHN O=[N+]([O-])c1cc(CNC[C@H](O)c2ccccc2F)ccc1Oc1ccc(F)cc1 ZINC000238063674 854139607 /nfs/dbraw/zinc/13/96/07/854139607.db2.gz XRZMARMNTJUTBS-FQEVSTJZSA-N 0 3 400.381 4.489 20 0 HIADHN Cc1noc2nc(-c3ccccc3)cc(C(=O)N(CCN(C)C)Cc3ccccc3)c12 ZINC000248033577 854174692 /nfs/dbraw/zinc/17/46/92/854174692.db2.gz UHKWEUILEQXORS-UHFFFAOYSA-N 0 3 414.509 4.402 20 0 HIADHN c1ccc(-c2nnc(SCCN3CCCCC3)n2Cc2ccc3c(c2)OCO3)cc1 ZINC000248330044 854189724 /nfs/dbraw/zinc/18/97/24/854189724.db2.gz FFEQIYIOMRYNLS-UHFFFAOYSA-N 0 3 422.554 4.300 20 0 HIADHN O=C(N[C@H]1CCCN(Cc2ccccc2)C1)N(Cc1cccs1)C[C@H]1CCCO1 ZINC000255957014 854229574 /nfs/dbraw/zinc/22/95/74/854229574.db2.gz FCUXBCRKTGTHNN-LEWJYISDSA-N 0 3 413.587 4.103 20 0 HIADHN Cc1sc2ncnc(SCCC(=O)N(CC(C)C)C3CCN(C)CC3)c2c1C ZINC000261482197 854277220 /nfs/dbraw/zinc/27/72/20/854277220.db2.gz NLPGHWCPROTNBO-UHFFFAOYSA-N 0 3 420.648 4.369 20 0 HIADHN CN(C)[C@H](CNc1cc(C(F)(F)F)nc(-c2cccnc2)n1)c1ccc(F)cc1 ZINC000301262621 854342268 /nfs/dbraw/zinc/34/22/68/854342268.db2.gz BXMZOHQCBGHJLU-MRXNPFEDSA-N 0 3 405.399 4.411 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(NC3CC[NH+]([C@@H](C)c4ccccc4)CC3)nc2)n1 ZINC000301317974 854356920 /nfs/dbraw/zinc/35/69/20/854356920.db2.gz PDDMULSYEHDGET-KRWDZBQOSA-N 0 3 403.530 4.444 20 0 HIADHN Cc1nc(-c2ccc(NC[C@@H]3CCC[N@H+](Cc4cccs4)C3)nc2)[n-]c(=O)c1C ZINC000301404205 854384474 /nfs/dbraw/zinc/38/44/74/854384474.db2.gz KQJAHOWIGHBEHD-KRWDZBQOSA-N 0 3 409.559 4.247 20 0 HIADHN Cc1nc(-c2ccc(NC[C@@H]3CCC[N@@H+](Cc4cccs4)C3)nc2)[n-]c(=O)c1C ZINC000301404205 854384479 /nfs/dbraw/zinc/38/44/79/854384479.db2.gz KQJAHOWIGHBEHD-KRWDZBQOSA-N 0 3 409.559 4.247 20 0 HIADHN Cc1nc2ccc(Br)cc2c(N[C@@H]2CCC[C@@H](S(C)(=O)=O)C2)c1C ZINC000301407916 854385217 /nfs/dbraw/zinc/38/52/17/854385217.db2.gz VZPQOVXWAWKUCJ-HUUCEWRRSA-N 0 3 411.365 4.382 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(Nc2nc(-c3ccncc3)nc3c2CCC3)CC1 ZINC000301782721 854464964 /nfs/dbraw/zinc/46/49/64/854464964.db2.gz JZVGSZWZUQHAFC-KRWDZBQOSA-N 0 3 400.530 4.060 20 0 HIADHN COc1ccccc1[C@H](CNc1ncnc2c1cnn2C(C)(C)C)N1CCCCC1 ZINC000301894905 854487149 /nfs/dbraw/zinc/48/71/49/854487149.db2.gz POECHPGYXCHFGK-IBGZPJMESA-N 0 3 408.550 4.229 20 0 HIADHN Cc1cc(C)n(-c2cncc(NC[C@@H](c3cccc(C(F)(F)F)c3)N(C)C)n2)n1 ZINC000302216766 854551588 /nfs/dbraw/zinc/55/15/88/854551588.db2.gz IYJSRJLJKGZZBI-KRWDZBQOSA-N 0 3 404.440 4.013 20 0 HIADHN COc1ccc([C@@H](NCC(=O)N2CCC[C@H]2c2ccc3c(c2)OCCO3)C(C)C)cc1 ZINC000302764071 854625901 /nfs/dbraw/zinc/62/59/01/854625901.db2.gz SDALXKIEBKXESR-OFVILXPXSA-N 0 3 424.541 4.117 20 0 HIADHN COc1ccc([C@H](CNc2ncc(Cl)cc2Br)N(C)C)cc1OC ZINC000302801075 854637173 /nfs/dbraw/zinc/63/71/73/854637173.db2.gz CJBJADJSYXSGAY-AWEZNQCLSA-N 0 3 414.731 4.230 20 0 HIADHN COc1ccc([C@H](CNC(=O)N[C@@H](c2ccc(OC)cc2)C2CC2)N2CCCC2)cc1 ZINC000302896750 854669926 /nfs/dbraw/zinc/66/99/26/854669926.db2.gz LVZNWRFOFXVWIU-BJKOFHAPSA-N 0 3 423.557 4.291 20 0 HIADHN CCOc1ccc(OCC)c(NC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)c1 ZINC000302944222 854690775 /nfs/dbraw/zinc/69/07/75/854690775.db2.gz AVCWFBFXDDYWNV-SFHVURJKSA-N 0 3 400.494 4.474 20 0 HIADHN CCOC(=O)c1cc(C)sc1NC(=O)c1ccc(N2CCN(C(C)C)CC2)cc1 ZINC000302950918 854693704 /nfs/dbraw/zinc/69/37/04/854693704.db2.gz DHPIGKWWUGKHAZ-UHFFFAOYSA-N 0 3 415.559 4.016 20 0 HIADHN CCn1cc(CC(=O)NC[C@@H](c2cccc(OC)c2)N2CCCC2)c2ccccc21 ZINC000303050343 854739594 /nfs/dbraw/zinc/73/95/94/854739594.db2.gz RNQCHUTWISWOLR-DEOSSOPVSA-N 0 3 405.542 4.166 20 0 HIADHN COCCN1CCC(NC(=O)c2sc(-c3ccccc3)nc2-c2ccccc2)CC1 ZINC000303067543 854746421 /nfs/dbraw/zinc/74/64/21/854746421.db2.gz WCCFVZUXOMSZAD-UHFFFAOYSA-N 0 3 421.566 4.318 20 0 HIADHN COc1ccc(CC2CCN([C@H](C)C(=O)N[C@@H](C)c3ccccc3OC)CC2)cc1 ZINC000303086543 854754441 /nfs/dbraw/zinc/75/44/41/854754441.db2.gz GTXHVHILPCQKJD-RBUKOAKNSA-N 0 3 410.558 4.224 20 0 HIADHN Cc1cc2oc(=O)cc(CN3CCC[C@H](CN(C)C(=O)OC(C)(C)C)C3)c2cc1C ZINC000303104169 854762467 /nfs/dbraw/zinc/76/24/67/854762467.db2.gz IZJAMEJEBYLJHJ-GOSISDBHSA-N 0 3 414.546 4.489 20 0 HIADHN O=C(Nc1ccnn1CCc1ccccc1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000303105720 854763264 /nfs/dbraw/zinc/76/32/64/854763264.db2.gz DUKDYSOUKCCEAI-OAQYLSRUSA-N 0 3 406.505 4.116 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)NC[C@H]2CCN(c3ccc(F)cc3)C2)N2CCCC2)cc1 ZINC000303120259 854769972 /nfs/dbraw/zinc/76/99/72/854769972.db2.gz IFWIJUHAJGZTHG-HYBUGGRVSA-N 0 3 424.564 4.097 20 0 HIADHN Cc1nn(-c2ccccc2)cc1C(=O)NC[C@H](c1ccccc1)N1CCC(C)CC1 ZINC000303130946 854775615 /nfs/dbraw/zinc/77/56/15/854775615.db2.gz KHZJLWBEWNDNJY-XMMPIXPASA-N 0 3 402.542 4.384 20 0 HIADHN C[C@H]1CCCC[N@@H+]1Cc1ccc(NC(=O)[C@@H]2CCCN2C(=O)c2ccccc2[O-])cc1 ZINC000303136720 854778721 /nfs/dbraw/zinc/77/87/21/854778721.db2.gz AJIXTENRAIRDPQ-AVRDEDQJSA-N 0 3 421.541 4.010 20 0 HIADHN C[C@H]1CCCC[N@H+]1Cc1ccc(NC(=O)[C@@H]2CCCN2C(=O)c2ccccc2[O-])cc1 ZINC000303136720 854778723 /nfs/dbraw/zinc/77/87/23/854778723.db2.gz AJIXTENRAIRDPQ-AVRDEDQJSA-N 0 3 421.541 4.010 20 0 HIADHN CN(C[C@@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)c1c(Cl)cccc1Cl ZINC000437340225 862614076 /nfs/dbraw/zinc/61/40/76/862614076.db2.gz JXWNSGJTDKFDAI-INIZCTEOSA-N 0 3 413.370 4.136 20 0 HIADHN O=C(Nc1nnc(Cc2ccccc2F)s1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000303336133 854878839 /nfs/dbraw/zinc/87/88/39/854878839.db2.gz XNUYZKIXFNYZFZ-SFHVURJKSA-N 0 3 410.518 4.119 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)c1ccn(-c2ccc(Cl)c(Cl)c2)n1 ZINC000303338363 854880832 /nfs/dbraw/zinc/88/08/32/854880832.db2.gz VPHBXRABXAUGCI-UHFFFAOYSA-N 0 3 417.340 4.383 20 0 HIADHN CCN1CCN(C(=O)CC2CCN([C@H](C)c3ccc(Cl)c(Cl)c3)CC2)CC1 ZINC000303400170 854909225 /nfs/dbraw/zinc/90/92/25/854909225.db2.gz ZVPLGYOPTQVKED-MRXNPFEDSA-N 0 3 412.405 4.321 20 0 HIADHN CCN1CCCC[C@@H]1CNC(=O)c1cnn(-c2ccc(Cl)cc2)c1C(F)(F)F ZINC000303481811 854975106 /nfs/dbraw/zinc/97/51/06/854975106.db2.gz OOVPDFYXXMJCSE-OAHLLOKOSA-N 0 3 414.859 4.149 20 0 HIADHN C[C@H](SCC(=O)N(CCN(C)C)Cc1cccc(F)c1)c1nc2ccccc2[nH]1 ZINC000303489246 854979331 /nfs/dbraw/zinc/97/93/31/854979331.db2.gz KKVAFANLADJENZ-INIZCTEOSA-N 0 3 414.550 4.087 20 0 HIADHN Cc1nc(COc2cccc(C(=O)NC[C@@H](C)N(C)Cc3ccccc3)c2)cs1 ZINC000303494426 854983569 /nfs/dbraw/zinc/98/35/69/854983569.db2.gz QLIVIRKRBCDNGW-QGZVFWFLSA-N 0 3 409.555 4.281 20 0 HIADHN C[C@H](C(=O)NCC1(c2cccc(C(F)(F)F)c2)CCOCC1)N1CCCCCC1 ZINC000303511561 854999749 /nfs/dbraw/zinc/99/97/49/854999749.db2.gz CKOGFYLNJUYPLS-QGZVFWFLSA-N 0 3 412.496 4.134 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)NCCCc1nc(-c2ccncc2)cs1 ZINC000303567278 855044327 /nfs/dbraw/zinc/04/43/27/855044327.db2.gz OGLUDARYLXAEKE-UHFFFAOYSA-N 0 3 420.538 4.376 20 0 HIADHN CCN(CC)C(=O)[C@@H]1CCCN1CCC(=O)Nc1ccccc1Oc1ccccc1 ZINC000303577511 855052792 /nfs/dbraw/zinc/05/27/92/855052792.db2.gz LZWCQIHQURSVJU-NRFANRHFSA-N 0 3 409.530 4.140 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N(Cc3ccco3)Cc3ccccc3)cc2)CC1 ZINC000303584319 855057693 /nfs/dbraw/zinc/05/76/93/855057693.db2.gz SAIJZNHVWJTCJN-UHFFFAOYSA-N 0 3 403.526 4.264 20 0 HIADHN CC(C)(C)c1ccc([C@@H](O)CNC(=O)N[C@@H](CN2CCCC2)c2ccccc2)cc1 ZINC000303635683 855092580 /nfs/dbraw/zinc/09/25/80/855092580.db2.gz GSELMSZAIUOREN-GOTSBHOMSA-N 0 3 409.574 4.154 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)N1CCC(C(F)(F)F)(C(F)(F)F)C1 ZINC000303666889 855118995 /nfs/dbraw/zinc/11/89/95/855118995.db2.gz ISSAXHFDSQBXKX-UHFFFAOYSA-N 0 3 408.342 4.451 20 0 HIADHN CCCN(C(=O)c1cccc(-n2ccnc2)c1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000303713717 855147219 /nfs/dbraw/zinc/14/72/19/855147219.db2.gz UUWJJSDWKOXNFQ-XMMPIXPASA-N 0 3 402.542 4.389 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)[C@@H]3C[C@H]3c3c(F)cccc3Cl)cc2)CC1 ZINC000303797841 855203613 /nfs/dbraw/zinc/20/36/13/855203613.db2.gz GHDMWMUOAPQEHO-RTBURBONSA-N 0 3 415.940 4.359 20 0 HIADHN O=C(Nc1cc(F)c(F)c(F)c1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000303811526 855214397 /nfs/dbraw/zinc/21/43/97/855214397.db2.gz CRFBZEKGOCTFCR-SFHVURJKSA-N 0 3 402.338 4.497 20 0 HIADHN O=C(Nc1cc(F)c(F)c(F)c1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000303811524 855214864 /nfs/dbraw/zinc/21/48/64/855214864.db2.gz CRFBZEKGOCTFCR-GOSISDBHSA-N 0 3 402.338 4.497 20 0 HIADHN CCc1ccc([C@@H]2COCCN2C(=O)NC[C@H](c2ccsc2)N(CC)CC)o1 ZINC000303828267 855228558 /nfs/dbraw/zinc/22/85/58/855228558.db2.gz ZCMVLRQSOQWSKF-MOPGFXCFSA-N 0 3 405.564 4.070 20 0 HIADHN Cc1ccc(C[C@H](C)NC(=O)Nc2ccc(CCN3CCSCC3)cc2)s1 ZINC000303858644 855253759 /nfs/dbraw/zinc/25/37/59/855253759.db2.gz WFAJGMKPEWJCIZ-INIZCTEOSA-N 0 3 403.617 4.401 20 0 HIADHN Cc1nc(-c2cccc(NC(=O)N3CCCN(Cc4ccccc4)C[C@H]3C)c2)no1 ZINC000303879810 855266383 /nfs/dbraw/zinc/26/63/83/855266383.db2.gz OGUVJNIBBPQHKW-QGZVFWFLSA-N 0 3 405.502 4.173 20 0 HIADHN CC(C)C(=O)N(C)Cc1ccc(C(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)cc1 ZINC000303914071 855286530 /nfs/dbraw/zinc/28/65/30/855286530.db2.gz RSBAVVGSXWFSLV-NRFANRHFSA-N 0 3 421.585 4.038 20 0 HIADHN Cc1cc(C)n(-c2ccc(C(=O)N3CCCN(Cc4ccccc4)C[C@@H]3C)cc2F)n1 ZINC000303914872 855287681 /nfs/dbraw/zinc/28/76/81/855287681.db2.gz UXSYPIZLQKISSF-FQEVSTJZSA-N 0 3 420.532 4.365 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)c2cc(NC(=O)C(C)C)ccc2Cl)c1 ZINC000303921436 855292534 /nfs/dbraw/zinc/29/25/34/855292534.db2.gz SYSFNPUZPURYST-UHFFFAOYSA-N 0 3 415.965 4.447 20 0 HIADHN Cc1cc(Br)ccc1C(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C ZINC000303934749 855301772 /nfs/dbraw/zinc/30/17/72/855301772.db2.gz XQUPAJPNZSYIRS-KRWDZBQOSA-N 0 3 401.348 4.494 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)CCc2nnc(-c3ccc(Cl)cc3)o2)N(C)C)cc1 ZINC000303952098 855315118 /nfs/dbraw/zinc/31/51/18/855315118.db2.gz VYMSGQAHKVOLNQ-LJQANCHMSA-N 0 3 412.921 4.050 20 0 HIADHN CC(C)(C)OC(=O)NC/C=C/CNCc1ccc(Br)c2cccnc12 ZINC000310832453 855367179 /nfs/dbraw/zinc/36/71/79/855367179.db2.gz KLTYAYBTHPUZTA-SNAWJCMRSA-N 0 3 406.324 4.168 20 0 HIADHN Cn1ncc(Br)c1CNCCc1cccc(OCc2ccccc2)c1 ZINC000311010177 855368653 /nfs/dbraw/zinc/36/86/53/855368653.db2.gz JVGYKZPEPBKRRZ-UHFFFAOYSA-N 0 3 400.320 4.094 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)c1cnc(Cl)c(Br)c1 ZINC000326555105 855410455 /nfs/dbraw/zinc/41/04/55/855410455.db2.gz UQRNOELBPGDRBT-MRXNPFEDSA-N 0 3 408.727 4.064 20 0 HIADHN CC(C)(C)OC(=O)N1CCCC[C@@H]1CNCc1ccc(Br)cc1F ZINC000382730375 855434604 /nfs/dbraw/zinc/43/46/04/855434604.db2.gz BSQYNCZDPFPGIW-OAHLLOKOSA-N 0 3 401.320 4.467 20 0 HIADHN COc1ccc(Br)cc1C(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC000383013298 855434667 /nfs/dbraw/zinc/43/46/67/855434667.db2.gz FDXDOWVLXKJSEY-MRXNPFEDSA-N 0 3 417.347 4.194 20 0 HIADHN C[C@H]1[C@@H](NC(=O)c2cccc(Br)c2Cl)CCN1Cc1ccccc1 ZINC000383281693 855436896 /nfs/dbraw/zinc/43/68/96/855436896.db2.gz LDGCDQOYZQJVAV-GUYCJALGSA-N 0 3 407.739 4.495 20 0 HIADHN COc1c(Br)cc(Br)cc1CNC[C@](C)(OC)C1CC1 ZINC000384049141 855439825 /nfs/dbraw/zinc/43/98/25/855439825.db2.gz WKLZTLBWHFEWBJ-HNNXBMFYSA-N 0 3 407.146 4.125 20 0 HIADHN CN(C)Cc1ccccc1CNC(=O)[C@@H]1C[C@@]12CCc1cc(Br)ccc12 ZINC000409479600 855502175 /nfs/dbraw/zinc/50/21/75/855502175.db2.gz MNYZXBYZBNAZLN-RBBKRZOGSA-N 0 3 413.359 4.031 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)Nc1nc2ccccc2s1 ZINC000409589204 855555389 /nfs/dbraw/zinc/55/53/89/855555389.db2.gz MWFFTHQDTVYMPO-UHFFFAOYSA-N 0 3 409.559 4.020 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3C[C@@H](c4ccccc4)O[C@@H](C)C3)c(C)c2)CC1 ZINC000409617225 855566877 /nfs/dbraw/zinc/56/68/77/855566877.db2.gz ROEONYDIYQYXQK-RDPSFJRHSA-N 0 3 422.573 4.131 20 0 HIADHN Cc1nc2ccc(Br)cc2c(N2CCC[C@H](S(C)(=O)=O)CC2)c1C ZINC000409672372 855595718 /nfs/dbraw/zinc/59/57/18/855595718.db2.gz HQKKWABSHNOVBT-HNNXBMFYSA-N 0 3 411.365 4.018 20 0 HIADHN COc1ccc(NC(=O)NCCCCN2CCN(c3ccccc3)CC2)cc1Cl ZINC000409755538 855637466 /nfs/dbraw/zinc/63/74/66/855637466.db2.gz WHPGUHYBLVQIBZ-UHFFFAOYSA-N 0 3 416.953 4.073 20 0 HIADHN O=C(N[C@H]1C[C@@H]1c1ccccc1OC(F)F)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000437389614 862713463 /nfs/dbraw/zinc/71/34/63/862713463.db2.gz DXJFUPDATXBDSG-AHRSYUTCSA-N 0 3 418.459 4.311 20 0 HIADHN CCC(=O)Nc1cccc(C(=O)N[C@H](CN2CCc3ccccc3C2)C(C)(C)C)c1 ZINC000410050013 855800265 /nfs/dbraw/zinc/80/02/65/855800265.db2.gz AOOLLXFDSXAEHN-JOCHJYFZSA-N 0 3 407.558 4.238 20 0 HIADHN CC(C)(C)[C@@H](CN1CCc2ccccc2C1)NC(=O)Cc1cccc2cccnc21 ZINC000410054211 855803124 /nfs/dbraw/zinc/80/31/24/855803124.db2.gz PRNSJKMHPZZMAO-HSZRJFAPSA-N 0 3 401.554 4.367 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)[C@@H]1CCCC(F)(F)C1 ZINC000410092866 855815279 /nfs/dbraw/zinc/81/52/79/855815279.db2.gz CZVQBVAFWKMOIK-RTBURBONSA-N 0 3 402.489 4.403 20 0 HIADHN COc1ccc2ccccc2c1CNC(=O)NCCCN1CCc2ccccc2C1 ZINC000410206564 855862592 /nfs/dbraw/zinc/86/25/92/855862592.db2.gz VTEHCTKEDZEOCY-UHFFFAOYSA-N 0 3 403.526 4.096 20 0 HIADHN C[C@@H]1CN(c2ccc(CN[C@H](Cc3cccnc3)c3cccc(Cl)c3)cn2)CCO1 ZINC000425949231 856015087 /nfs/dbraw/zinc/01/50/87/856015087.db2.gz GXHYIYGJXFQHQY-WZONZLPQSA-N 0 3 422.960 4.429 20 0 HIADHN CN1CC[C@@H](NC(=O)NCc2nc(-c3ccccc3F)cs2)[C@@H]1c1ccccc1 ZINC000425985542 856032282 /nfs/dbraw/zinc/03/22/82/856032282.db2.gz RINOLBAECMUTRC-NQIIRXRSSA-N 0 3 410.518 4.194 20 0 HIADHN CS(=O)(=O)Cc1ccccc1CN[C@@H](Cc1cccnc1)c1cccc(Cl)c1 ZINC000426015063 856048241 /nfs/dbraw/zinc/04/82/41/856048241.db2.gz FFXZFUXAMPCBJP-QFIPXVFZSA-N 0 3 414.958 4.353 20 0 HIADHN COc1ccc(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2F)c2cccnc12 ZINC000426082841 856094856 /nfs/dbraw/zinc/09/48/56/856094856.db2.gz BPWNORJUNIJMPL-UHFFFAOYSA-N 0 3 414.456 4.117 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)N[C@@H]1CCOC2(CCCCC2)C1 ZINC000426114841 856115804 /nfs/dbraw/zinc/11/58/04/856115804.db2.gz QHTWQBVNKYWINY-OAQYLSRUSA-N 0 3 417.619 4.281 20 0 HIADHN Cc1c(NC(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@@H]2CO)cccc1C(F)(F)F ZINC000426143027 856136947 /nfs/dbraw/zinc/13/69/47/856136947.db2.gz KXJWNPFNBJXCQL-YLJYHZDGSA-N 0 3 421.463 4.018 20 0 HIADHN CSc1cccc(N(C(=O)c2cn(C)nc2C(C)(C)C)C2CCN(C)CC2)c1 ZINC000426279629 856217115 /nfs/dbraw/zinc/21/71/15/856217115.db2.gz QRLHJQGQDIZFPZ-UHFFFAOYSA-N 0 3 400.592 4.181 20 0 HIADHN Cc1cc(CNC2CC(c3cccc(Br)c3)C2)nc(N2CCCC2)n1 ZINC000426310215 856238094 /nfs/dbraw/zinc/23/80/94/856238094.db2.gz AOKUGAVHXDLDKF-UHFFFAOYSA-N 0 3 401.352 4.184 20 0 HIADHN COc1ccccc1[C@H](NC(=O)NC[C@@H](c1ccc(C)cc1)N(C)C)c1ccco1 ZINC000426314800 856240533 /nfs/dbraw/zinc/24/05/33/856240533.db2.gz YGKWLJUREDQLCH-REWPJTCUSA-N 0 3 407.514 4.288 20 0 HIADHN C[C@@H](N[C@@H](C)CCCOc1ccccc1C(N)=O)c1nc(C(F)(F)F)cs1 ZINC000426528665 856334874 /nfs/dbraw/zinc/33/48/74/856334874.db2.gz GIZOGHJFXPBDHG-NWDGAFQWSA-N 0 3 401.454 4.159 20 0 HIADHN CC(C)(C)N1C[C@@H](c2nc(Cc3cc(C(F)(F)F)ccn3)no2)[C@H](C(F)(F)F)C1 ZINC000426577568 856357963 /nfs/dbraw/zinc/35/79/63/856357963.db2.gz CWVKZEHRZQYYRY-CHWSQXEVSA-N 0 3 422.373 4.450 20 0 HIADHN CN(CCN(Cc1ccccc1)C(=O)N[C@H]1CCOC2(CCC2)C1)Cc1ccccc1 ZINC000426622735 856379011 /nfs/dbraw/zinc/37/90/11/856379011.db2.gz JFBDLHAPZAAMGI-DEOSSOPVSA-N 0 3 421.585 4.432 20 0 HIADHN O=C(Nc1ccccc1)c1ccc(CN2CCC(OC[C@H]3CCCCO3)CC2)cc1 ZINC000426773887 856470098 /nfs/dbraw/zinc/47/00/98/856470098.db2.gz LSLZBZUKDFQKMY-XMMPIXPASA-N 0 3 408.542 4.489 20 0 HIADHN COc1ccc(CN(C)[C@H](C)c2cccc(N3CCCS3(=O)=O)c2)cc1Cl ZINC000426803565 856488020 /nfs/dbraw/zinc/48/80/20/856488020.db2.gz NLXUCRRVPFIBOY-OAHLLOKOSA-N 0 3 408.951 4.082 20 0 HIADHN C[C@@H](c1cccc(N2CCCS2(=O)=O)c1)N(C)Cc1cc(F)cc2cccnc21 ZINC000426807467 856489294 /nfs/dbraw/zinc/48/92/94/856489294.db2.gz HXCUYJGHCPFBOX-INIZCTEOSA-N 0 3 413.518 4.107 20 0 HIADHN C[C@H](NC(=O)N1CCN(C2CCC(C)CC2)CC1)c1nc(C(F)(F)F)cs1 ZINC000426889854 856528842 /nfs/dbraw/zinc/52/88/42/856528842.db2.gz IBMPWBOIJIWPBF-MOKVOYLWSA-N 0 3 404.502 4.129 20 0 HIADHN C[C@@H](NC(=O)N(CCN(C)C)Cc1cccs1)c1nc(C(F)(F)F)cs1 ZINC000426897596 856531987 /nfs/dbraw/zinc/53/19/87/856531987.db2.gz HCNOZGORUSEALP-LLVKDONJSA-N 0 3 406.499 4.058 20 0 HIADHN CN1CC[C@H](NC(=O)c2cc3ccccc3n2CC(F)(F)F)[C@H]1c1ccccc1 ZINC000426973317 856572247 /nfs/dbraw/zinc/57/22/47/856572247.db2.gz RVGDMQLHQQTPOI-FXAWDEMLSA-N 0 3 401.432 4.379 20 0 HIADHN Cc1cc(NC(=O)c2ccc(NC(C)C)nc2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000427059648 856614954 /nfs/dbraw/zinc/61/49/54/856614954.db2.gz BQRILCXMBLASRI-NRFANRHFSA-N 0 3 418.545 4.106 20 0 HIADHN CCn1ncc(C(=O)Nc2ccc(N3CCN(CC)CC3)cc2C)c1-c1ccccc1 ZINC000427117348 856647188 /nfs/dbraw/zinc/64/71/88/856647188.db2.gz LEWKDACQSTVGLM-UHFFFAOYSA-N 0 3 417.557 4.273 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)CCCCCc3ccc(F)cc3)CC2)C[C@H](C)O1 ZINC000427127054 856655084 /nfs/dbraw/zinc/65/50/84/856655084.db2.gz SMBATKBCRHJPBT-PMACEKPBSA-N 0 3 404.570 4.276 20 0 HIADHN O=C(N[C@@H]1CCOC2(CCCCC2)C1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000427266807 856744271 /nfs/dbraw/zinc/74/42/71/856744271.db2.gz VGHUXUHDHRLMGB-DENIHFKCSA-N 0 3 424.507 4.439 20 0 HIADHN O=C(N[C@H]1CCOC2(CCCC2)C1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000427274741 856746607 /nfs/dbraw/zinc/74/66/07/856746607.db2.gz NEQHSBICXBGLPJ-GHTZIAJQSA-N 0 3 410.480 4.049 20 0 HIADHN COc1ccc(C(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)c2ccccc12 ZINC000427286828 856752650 /nfs/dbraw/zinc/75/26/50/856752650.db2.gz HWFGXQHFPVUBQF-OALUTQOASA-N 0 3 410.558 4.200 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)c3csc(-c4cccs4)n3)CC2)C[C@H](C)O1 ZINC000427287772 856752775 /nfs/dbraw/zinc/75/27/75/856752775.db2.gz MIVNUYDKEJHYHH-HOTGVXAUSA-N 0 3 419.616 4.223 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)CCSc3ccccc3F)CC2)C[C@@H](C)O1 ZINC000427290304 856753633 /nfs/dbraw/zinc/75/36/33/856753633.db2.gz AGRGSVZYSFYHEA-QZTJIDSGSA-N 0 3 408.583 4.046 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3cc(Cl)sc3Cl)CC2)C[C@@H](C)O1 ZINC000427298172 856758793 /nfs/dbraw/zinc/75/87/93/856758793.db2.gz ACAHIBHFKSYCNZ-CHWSQXEVSA-N 0 3 405.391 4.406 20 0 HIADHN Cc1ccc(SCCC(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)cc1 ZINC000427300199 856759944 /nfs/dbraw/zinc/75/99/44/856759944.db2.gz SDANZFDCWSTYMD-PMACEKPBSA-N 0 3 404.620 4.215 20 0 HIADHN C[C@@H](CCc1ccccc1F)C(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000427304008 856760855 /nfs/dbraw/zinc/76/08/55/856760855.db2.gz GGLXDIJMJJWPGY-XUVXKRRUSA-N 0 3 404.570 4.132 20 0 HIADHN C[C@@H](CCc1ccccc1F)C(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000427304006 856760954 /nfs/dbraw/zinc/76/09/54/856760954.db2.gz GGLXDIJMJJWPGY-SLFFLAALSA-N 0 3 404.570 4.132 20 0 HIADHN Cc1nc(-c2ccccc2)oc1C(=O)N1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000427309788 856763409 /nfs/dbraw/zinc/76/34/09/856763409.db2.gz WANZWVDBBPEBOI-ROUUACIJSA-N 0 3 411.546 4.002 20 0 HIADHN Cc1cc(C(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)cc(C)c1OC(F)F ZINC000427312648 856764694 /nfs/dbraw/zinc/76/46/94/856764694.db2.gz JKDDMCDPFAPMRA-ROUUACIJSA-N 0 3 424.532 4.256 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)[C@@H]3C[C@@H]3c3cccc(Cl)c3)CC2)C[C@@H](C)O1 ZINC000427318576 856768197 /nfs/dbraw/zinc/76/81/97/856768197.db2.gz ADAKEULEMHUHJY-XWOARTFESA-N 0 3 404.982 4.181 20 0 HIADHN Cc1nc(-c2ccccc2)ccc1C(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000427330946 856774699 /nfs/dbraw/zinc/77/46/99/856774699.db2.gz OBNUPVOJFWSFQO-BGYRXZFFSA-N 0 3 421.585 4.409 20 0 HIADHN O=C(N1CCc2ccc(F)c(F)c2C1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000427355331 856790356 /nfs/dbraw/zinc/79/03/56/856790356.db2.gz SCLYSBPIJQPGLJ-NRFANRHFSA-N 0 3 424.413 4.304 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)CCCc3ccc(Cl)cc3)CC2)C[C@H](C)O1 ZINC000427356519 856790573 /nfs/dbraw/zinc/79/05/73/856790573.db2.gz FWTCSNYZVVIIGO-OALUTQOASA-N 0 3 406.998 4.401 20 0 HIADHN Cc1ccc([C@H]2C[C@H](C)CCN2C(=O)CCCN2CCN(c3ccccc3)CC2)o1 ZINC000437484034 862842062 /nfs/dbraw/zinc/84/20/62/862842062.db2.gz NPIIPFVZARMFSK-NFBKMPQASA-N 0 3 409.574 4.490 20 0 HIADHN C[C@@H]1CCN(C(=O)c2ccccc2OCc2cscn2)CCN1Cc1ccccc1 ZINC000437488140 862845629 /nfs/dbraw/zinc/84/56/29/862845629.db2.gz CHDJLSPRDNFEQU-LJQANCHMSA-N 0 3 421.566 4.459 20 0 HIADHN O=S(=O)(CCCN[C@H]1CCCc2ncc(C(F)(F)F)cc21)Cc1ccccc1 ZINC000427595071 856882302 /nfs/dbraw/zinc/88/23/02/856882302.db2.gz SHUVCPMKCQUQRR-SFHVURJKSA-N 0 3 412.477 4.073 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)CCc1cc(Cl)ccc1Br ZINC000427601962 856883930 /nfs/dbraw/zinc/88/39/30/856883930.db2.gz NGCVOBIWJHWZID-UHFFFAOYSA-N 0 3 424.770 4.021 20 0 HIADHN C[C@H](NC1CCN(C(=O)c2ccccc2F)CC1)c1ncc(Br)cc1F ZINC000427601025 856884328 /nfs/dbraw/zinc/88/43/28/856884328.db2.gz JMALVWWHUJJRSS-LBPRGKRZSA-N 0 3 424.289 4.078 20 0 HIADHN O[C@H](C(F)F)[C@@H](Cc1ccccc1)N[C@H]1CCCc2ncc(C(F)(F)F)cc21 ZINC000427687334 856908539 /nfs/dbraw/zinc/90/85/39/856908539.db2.gz VJTSYQGBWOJNID-KSZLIROESA-N 0 3 400.391 4.305 20 0 HIADHN CCCCNC(=O)[C@H]1CCCN(Cc2cnn(Cc3ccc(C(F)(F)F)cc3)c2)C1 ZINC000428241037 857123034 /nfs/dbraw/zinc/12/30/34/857123034.db2.gz QPQYJZGRGXESMP-IBGZPJMESA-N 0 3 422.495 4.079 20 0 HIADHN Cn1ccnc1CC1CCN(Cc2cnn(Cc3ccc(C(F)(F)F)cc3)c2)CC1 ZINC000428247448 857125378 /nfs/dbraw/zinc/12/53/78/857125378.db2.gz QCHUNCWUCHXHQQ-UHFFFAOYSA-N 0 3 417.479 4.138 20 0 HIADHN O=C(NC1CCN(Cc2ccccc2)CC1)c1cc(Br)c(F)cc1F ZINC000428274046 857136258 /nfs/dbraw/zinc/13/62/58/857136258.db2.gz GXURNCQOCYUUIL-UHFFFAOYSA-N 0 3 409.274 4.122 20 0 HIADHN Cn1ccnc1SCc1ccc(C(=O)NC[C@]2(C)CCCN2Cc2ccccc2)o1 ZINC000428325282 857155154 /nfs/dbraw/zinc/15/51/54/857155154.db2.gz LLOJXISKPXTYHI-QHCPKHFHSA-N 0 3 424.570 4.090 20 0 HIADHN C[C@H](c1cccc(N2CCCS2(=O)=O)c1)N(C)C/C=C\c1ccc(F)cc1F ZINC000428481408 857219219 /nfs/dbraw/zinc/21/92/19/857219219.db2.gz NJPIYOMPFDOJEQ-HQQUCIOCSA-N 0 3 406.498 4.211 20 0 HIADHN Brc1cccc(-c2ccc(CN3CCC(Cn4cncn4)CC3)o2)c1 ZINC000428482865 857220562 /nfs/dbraw/zinc/22/05/62/857220562.db2.gz IKFHCUKCURGLKY-UHFFFAOYSA-N 0 3 401.308 4.213 20 0 HIADHN Cc1onc(-c2cccc(Cl)c2)c1C(=O)Nc1cccc(CN2CC[C@H](O)C2)c1 ZINC000428536173 857248861 /nfs/dbraw/zinc/24/88/61/857248861.db2.gz RDUJABTUCXTRIP-IBGZPJMESA-N 0 3 411.889 4.122 20 0 HIADHN COCCS(=O)(=O)c1ccc(CNCc2ccc(-c3ccc(C)cc3)s2)cc1 ZINC000428540815 857252435 /nfs/dbraw/zinc/25/24/35/857252435.db2.gz SIGHYPSHWMNDPS-UHFFFAOYSA-N 0 3 415.580 4.433 20 0 HIADHN c1sc(COc2ccccc2)nc1CNC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000428541018 857252766 /nfs/dbraw/zinc/25/27/66/857252766.db2.gz ONWSKVPPXJKMKY-QHCPKHFHSA-N 0 3 423.582 4.103 20 0 HIADHN OC[C@H](CNCc1sccc1Br)Cc1ccc(Br)cc1 ZINC000428549119 857257570 /nfs/dbraw/zinc/25/75/70/857257570.db2.gz PLZRGELMDXJWJI-LBPRGKRZSA-N 0 3 419.182 4.214 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)N1CCC(c2ncccc2Cl)CC1 ZINC000428686388 857297342 /nfs/dbraw/zinc/29/73/42/857297342.db2.gz ZXVOMMHFKXXPMP-NRFANRHFSA-N 0 3 412.965 4.461 20 0 HIADHN CCN1CCCN(C(=O)N[C@H](C)c2ccc(OCc3ccccc3)c(OC)c2)CC1 ZINC000428712259 857306671 /nfs/dbraw/zinc/30/66/71/857306671.db2.gz PZIVTLHZVPLBFH-LJQANCHMSA-N 0 3 411.546 4.072 20 0 HIADHN CN1CCC[C@H](CNC(=O)c2ncc(F)cc2F)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000428716611 857308086 /nfs/dbraw/zinc/30/80/86/857308086.db2.gz ALEUNYMHDDXMQW-FZKQIMNGSA-N 0 3 413.390 4.192 20 0 HIADHN CCCc1nc(CN(Cc2ccncc2)[C@@H]2CCCN(Cc3ccccc3)C2)no1 ZINC000428788749 857339567 /nfs/dbraw/zinc/33/95/67/857339567.db2.gz MXDMXINRTWSUCJ-JOCHJYFZSA-N 0 3 405.546 4.084 20 0 HIADHN COC(=O)c1ccc(COc2ccccc2CN2CCC[C@@H](c3nc(C)no3)C2)cc1 ZINC000437586093 862899589 /nfs/dbraw/zinc/89/95/89/862899589.db2.gz XDPCJVXTKXDPNV-OAQYLSRUSA-N 0 3 421.497 4.123 20 0 HIADHN C[C@@H](c1ccccc1)[C@H](NCc1cn(-c2ccccc2)nc1-c1ccccc1)C(N)=O ZINC000428846141 857370252 /nfs/dbraw/zinc/37/02/52/857370252.db2.gz AVFIUNPWLQLLDQ-CYFREDJKSA-N 0 3 410.521 4.287 20 0 HIADHN COc1cc(OC)cc(N2CC[C@@H](CNCc3nc4ccc(F)cc4s3)C2)c1 ZINC000428860685 857376064 /nfs/dbraw/zinc/37/60/64/857376064.db2.gz HUDAXZZEELFTEO-AWEZNQCLSA-N 0 3 401.507 4.069 20 0 HIADHN CCCOc1ccc(C(F)(F)F)cc1NC(=O)N(CCN(C)C)C[C@H]1CCCO1 ZINC000437594684 862907340 /nfs/dbraw/zinc/90/73/40/862907340.db2.gz WTXQHVDBWJIQAX-MRXNPFEDSA-N 0 3 417.472 4.069 20 0 HIADHN CCCN(C(=O)c1cn(C)c(=O)c2ccccc12)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000428917827 857413468 /nfs/dbraw/zinc/41/34/68/857413468.db2.gz RZOJOYRUIGWNAI-NRFANRHFSA-N 0 3 417.553 4.055 20 0 HIADHN COc1c(Cl)cccc1NC(=O)N1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000429044250 857473029 /nfs/dbraw/zinc/47/30/29/857473029.db2.gz JFEUETUCRXQKLT-HOTGVXAUSA-N 0 3 409.958 4.092 20 0 HIADHN CN(C)CCN(C)C(=O)Nc1cccc(NC(=O)Nc2cccc(C(F)(F)F)c2)c1 ZINC000429044274 857473418 /nfs/dbraw/zinc/47/34/18/857473418.db2.gz JHMONYFKGJTJKF-UHFFFAOYSA-N 0 3 423.439 4.375 20 0 HIADHN CCOc1ccc(NC(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)c(C)c1 ZINC000429049992 857477687 /nfs/dbraw/zinc/47/76/87/857477687.db2.gz WLSBWFDLARPTRP-OALUTQOASA-N 0 3 403.567 4.137 20 0 HIADHN C[C@H](C1CC1)N(Cc1ccccc1)C(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000429054202 857480098 /nfs/dbraw/zinc/48/00/98/857480098.db2.gz PKXMWNIDQGHOFP-PXDATVDWSA-N 0 3 421.585 4.288 20 0 HIADHN C[C@H](NC(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1)c1cccc(N2CCCC2)c1 ZINC000429080711 857499205 /nfs/dbraw/zinc/49/92/05/857499205.db2.gz ONLBZMDUDUNMDA-JTAQYXEDSA-N 0 3 406.574 4.483 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1NC(=O)CCN1Cc2ccccc2O[C@H](C)C1 ZINC000429123153 857520918 /nfs/dbraw/zinc/52/09/18/857520918.db2.gz OOJDWEQEFUBKDR-QGZVFWFLSA-N 0 3 404.514 4.101 20 0 HIADHN CN(C)[C@H](CNC(=O)N(C)[C@@H](c1ccc(Cl)cc1)c1cnccn1)c1ccccc1 ZINC000429191381 857546331 /nfs/dbraw/zinc/54/63/31/857546331.db2.gz GOMWVMUYAPDNNY-YADHBBJMSA-N 0 3 423.948 4.164 20 0 HIADHN Brc1ccc(-c2nccc(CN3CCOC[C@@H](C4CCC4)C3)n2)cc1 ZINC000429255135 857577609 /nfs/dbraw/zinc/57/76/09/857577609.db2.gz MDTQVRIHIYVRJS-KRWDZBQOSA-N 0 3 402.336 4.155 20 0 HIADHN CCCn1ccnc1CCCN(C)[C@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O ZINC000429260359 857579786 /nfs/dbraw/zinc/57/97/86/857579786.db2.gz MIQNRXCXINORHK-SFHVURJKSA-N 0 3 409.361 4.270 20 0 HIADHN CC(=O)N1CCC(N(CCCSCc2ccccc2)Cc2cncs2)CC1 ZINC000429297425 857596440 /nfs/dbraw/zinc/59/64/40/857596440.db2.gz ZJNFZCSPYYCCHU-UHFFFAOYSA-N 0 3 403.617 4.280 20 0 HIADHN O=C(CN[C@H]1Cc2cccc(O)c2C1)N[C@@H](c1ccccc1)c1ccc(Cl)cc1 ZINC000429302259 857597757 /nfs/dbraw/zinc/59/77/57/857597757.db2.gz RNMJSBQHAXGPJH-RDPSFJRHSA-N 0 3 406.913 4.008 20 0 HIADHN Cc1cc(C)c(-c2csc(NC(=O)CN[C@@H]3Cc4cccc(O)c4C3)n2)c(C)c1 ZINC000429321240 857602048 /nfs/dbraw/zinc/60/20/48/857602048.db2.gz XHHODAVCTCHCTK-QGZVFWFLSA-N 0 3 407.539 4.136 20 0 HIADHN O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)C1(c2ccccc2F)CCCC1 ZINC000429347001 857612525 /nfs/dbraw/zinc/61/25/25/857612525.db2.gz DNNFNQGKRZIHMJ-OAQYLSRUSA-N 0 3 410.533 4.045 20 0 HIADHN Cc1csc(NC(=O)CN2CCN(CCCc3ccccc3)C[C@@H]2CC(C)C)n1 ZINC000429397786 857642555 /nfs/dbraw/zinc/64/25/55/857642555.db2.gz SSFSBJBOCBOYRY-NRFANRHFSA-N 0 3 414.619 4.055 20 0 HIADHN Cc1nn(C)c(C)c1NC(=O)[C@H](C)N[C@H]1c2cccc(Br)c2CC1(C)C ZINC000429407327 857649113 /nfs/dbraw/zinc/64/91/13/857649113.db2.gz LHBKEWPDORQVRC-SGTLLEGYSA-N 0 3 419.367 4.040 20 0 HIADHN C[C@H](NC[C@@H](CO)Cc1ccc(Br)cc1)c1nc2c(s1)CCCC2 ZINC000429412956 857653324 /nfs/dbraw/zinc/65/33/24/857653324.db2.gz RDSUFEOQPSKYIQ-ZFWWWQNUSA-N 0 3 409.393 4.286 20 0 HIADHN COC1(C[C@@H](C)N[C@@H](c2cccc(S(C)(=O)=O)c2)c2ccc(F)c(F)c2)CCC1 ZINC000429417156 857655463 /nfs/dbraw/zinc/65/54/63/857655463.db2.gz KJQZPSCNCJMRSG-VFNWGFHPSA-N 0 3 423.525 4.395 20 0 HIADHN OC[C@H](CN[C@H](c1ccccc1)c1ccccn1)Cc1cccc(Br)c1 ZINC000429418625 857655485 /nfs/dbraw/zinc/65/54/85/857655485.db2.gz OGKJIOXEJHWHRS-PGRDOPGGSA-N 0 3 411.343 4.374 20 0 HIADHN C[C@@H](NC(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1)[C@@H](C)c1ccccc1 ZINC000429440552 857670046 /nfs/dbraw/zinc/67/00/46/857670046.db2.gz HXYIRGABACQGBI-PLACYPQZSA-N 0 3 401.595 4.100 20 0 HIADHN C[C@@H](NC(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1)[C@H](C)c1ccccc1 ZINC000429440546 857670121 /nfs/dbraw/zinc/67/01/21/857670121.db2.gz HXYIRGABACQGBI-JSXRDJHFSA-N 0 3 401.595 4.100 20 0 HIADHN C[C@H](NC[C@H](CO)Cc1cccc(Br)c1)c1nc2c(s1)CCCC2 ZINC000429456808 857679804 /nfs/dbraw/zinc/67/98/04/857679804.db2.gz RHSGZGHPAJNDJE-DZGCQCFKSA-N 0 3 409.393 4.286 20 0 HIADHN COC1CCC(N(C)C(=O)N[C@@H](CN2CCc3ccccc3C2)C(C)(C)C)CC1 ZINC000429496891 857698249 /nfs/dbraw/zinc/69/82/49/857698249.db2.gz ZRUMHDVHJDYHSG-HRTMPFAESA-N 0 3 401.595 4.058 20 0 HIADHN CCc1cnc(CN(C)C(=O)N[C@@H](CN2CCc3ccccc3C2)C(C)(C)C)s1 ZINC000429501186 857700142 /nfs/dbraw/zinc/70/01/42/857700142.db2.gz HNYJFPHGLFFQQA-FQEVSTJZSA-N 0 3 414.619 4.320 20 0 HIADHN Cc1cc([C@@H]2CCCN2C(=O)N[C@@H](CN2CCc3ccccc3C2)C(C)(C)C)on1 ZINC000429502495 857701392 /nfs/dbraw/zinc/70/13/92/857701392.db2.gz JXLGSAOXRLMDEY-UNMCSNQZSA-N 0 3 410.562 4.303 20 0 HIADHN O=C1[C@@H](N2CCC(c3ccncc3)CC2)CCCN1Cc1cccc(C(F)(F)F)c1 ZINC000429539462 857731916 /nfs/dbraw/zinc/73/19/16/857731916.db2.gz VMLFXVNRJSHMPK-NRFANRHFSA-N 0 3 417.475 4.471 20 0 HIADHN Cc1c(Cl)cc(F)c(NC(=O)NC[C@H]2CN(Cc3ccccc3)CCCO2)c1F ZINC000429614610 857796988 /nfs/dbraw/zinc/79/69/88/857796988.db2.gz YBYVYMVUYHQBFW-INIZCTEOSA-N 0 3 423.891 4.339 20 0 HIADHN O=C(c1ccc(F)cc1)[C@@H]1CCCN(C[C@H]2CN(Cc3ccccc3)CCCO2)C1 ZINC000429683746 857833728 /nfs/dbraw/zinc/83/37/28/857833728.db2.gz RFYKEWCMFPYOJA-ISKFKSNPSA-N 0 3 410.533 4.012 20 0 HIADHN CC(C)n1ncc2ccc(NC(=O)NC[C@H]3CN(Cc4ccccc4)CCCO3)cc21 ZINC000429736521 857859108 /nfs/dbraw/zinc/85/91/08/857859108.db2.gz OXWBZCYSWOANAG-QFIPXVFZSA-N 0 3 421.545 4.030 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)N1CCC(c2ccncc2)CC1 ZINC000429743750 857864981 /nfs/dbraw/zinc/86/49/81/857864981.db2.gz LZDQUQFREBJBQN-UHFFFAOYSA-N 0 3 410.587 4.084 20 0 HIADHN CC(C)n1cc2cc(NC(=O)NC[C@@H]3CN(Cc4ccccc4)CCCO3)ccc2n1 ZINC000429747136 857866600 /nfs/dbraw/zinc/86/66/00/857866600.db2.gz JMXXLZGQPLWITD-JOCHJYFZSA-N 0 3 421.545 4.030 20 0 HIADHN O=C(NC[C@H]1CN(Cc2ccccc2)CCCO1)Nc1ccc(CC(F)(F)F)cc1 ZINC000429763662 857876521 /nfs/dbraw/zinc/87/65/21/857876521.db2.gz IXUVSYZTHFWEPQ-FQEVSTJZSA-N 0 3 421.463 4.204 20 0 HIADHN C[C@H]1CCCN(CCNC(=O)C(C)(C)c2csc(-c3c(F)cccc3F)n2)C1 ZINC000429847596 857910205 /nfs/dbraw/zinc/91/02/05/857910205.db2.gz QILCKDGPSXOWEX-AWEZNQCLSA-N 0 3 407.530 4.214 20 0 HIADHN CCNC(=O)COc1ccc(CN2CCC(c3ccc(F)cc3C)CC2)cc1OC ZINC000430089467 858025674 /nfs/dbraw/zinc/02/56/74/858025674.db2.gz ZOCNTPHOVVTXFJ-UHFFFAOYSA-N 0 3 414.521 4.037 20 0 HIADHN CN(CCSc1nnc(-c2cccs2)n1C[C@@H]1CCCO1)Cc1ccccc1 ZINC000430118814 858040292 /nfs/dbraw/zinc/04/02/92/858040292.db2.gz JOZIXNJCAZZHRN-SFHVURJKSA-N 0 3 414.600 4.410 20 0 HIADHN CN(C)C(=O)COc1ccccc1CN1CC[C@H](Sc2cccc(Cl)c2)C1 ZINC000430192121 858075463 /nfs/dbraw/zinc/07/54/63/858075463.db2.gz ADQNJKDTXBCMBZ-IBGZPJMESA-N 0 3 404.963 4.174 20 0 HIADHN C[C@@H]1CN(CCC(=O)Nc2ccc(Oc3ccccc3)cc2)C[C@@]2(CCO[C@H](C)C2)O1 ZINC000430259861 858099716 /nfs/dbraw/zinc/09/97/16/858099716.db2.gz FXVLARLGOIONRO-FHAGJXEFSA-N 0 3 424.541 4.466 20 0 HIADHN CCN1CCCN(C(=O)N[C@@H](CC2CC2)c2cc(F)cc(Br)c2)CC1 ZINC000430302557 858114781 /nfs/dbraw/zinc/11/47/81/858114781.db2.gz LDWBFFJXVDSBIZ-SFHVURJKSA-N 0 3 412.347 4.167 20 0 HIADHN CN(C(=O)[C@@H]1CCN(Cc2cc(Br)cc3cccnc32)C1)c1ccccc1 ZINC000430343891 858128085 /nfs/dbraw/zinc/12/80/85/858128085.db2.gz NXCVTJJIHPYZMC-QGZVFWFLSA-N 0 3 424.342 4.482 20 0 HIADHN Clc1cccc(-c2noc(CCN(CCc3ccccn3)Cc3cccnc3)n2)c1 ZINC000430345383 858128915 /nfs/dbraw/zinc/12/89/15/858128915.db2.gz QMGQRVLSQPJBLY-UHFFFAOYSA-N 0 3 419.916 4.467 20 0 HIADHN CCn1ccnc1[C@@H]1CCCCN1C(=O)Nc1ccc(N2CCN(CC)CC2)cc1C ZINC000430351492 858131059 /nfs/dbraw/zinc/13/10/59/858131059.db2.gz JEHVYMKMWOASFG-QFIPXVFZSA-N 0 3 424.593 4.112 20 0 HIADHN Cc1ccc(CCCC(=O)Nc2ccc(C(=O)N(C)[C@@H]3CCCN(C)C3)cc2)s1 ZINC000430589216 858228350 /nfs/dbraw/zinc/22/83/50/858228350.db2.gz CXUVBMJMZOPXDT-HXUWFJFHSA-N 0 3 413.587 4.184 20 0 HIADHN CCOc1ccc(C(=O)CCC(=O)N[C@@H]2CCN(Cc3ccccc3)[C@@H](C)C2)cc1 ZINC000430685260 858268599 /nfs/dbraw/zinc/26/85/99/858268599.db2.gz QGWBFPHOHVBEOX-SIKLNZKXSA-N 0 3 408.542 4.218 20 0 HIADHN C[C@H]1Oc2ccc(C(=O)C3CCN(CCSCc4ccccc4)CC3)cc2NC1=O ZINC000430734120 858280695 /nfs/dbraw/zinc/28/06/95/858280695.db2.gz KYUQVBBFRUPJKC-QGZVFWFLSA-N 0 3 424.566 4.234 20 0 HIADHN Cc1cccc(C)c1[C@H](C)N[C@H](C)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000430737360 858281861 /nfs/dbraw/zinc/28/18/61/858281861.db2.gz WRTLBJAJMHZXSE-KGLIPLIRSA-N 0 3 411.365 4.125 20 0 HIADHN CNC(=O)[C@@]1(C)CCN(Cc2c(C)nn(-c3ccccc3)c2Oc2cccc(F)c2)C1 ZINC000430758468 858292692 /nfs/dbraw/zinc/29/26/92/858292692.db2.gz AQSZFLWDQOFLPB-DEOSSOPVSA-N 0 3 422.504 4.070 20 0 HIADHN Cc1cc(NC(=O)C(C)(C)c2c(C)noc2C)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000430786710 858304877 /nfs/dbraw/zinc/30/48/77/858304877.db2.gz RJGXQDPHLWQFLI-HXUWFJFHSA-N 0 3 421.545 4.160 20 0 HIADHN CC[C@H](c1ccccc1)N1CC(=O)N(CC(C)(C)N2CCc3ccccc3C2)C1=O ZINC000430847668 858330986 /nfs/dbraw/zinc/33/09/86/858330986.db2.gz ZJOAZGCASBDOPC-JOCHJYFZSA-N 0 3 405.542 4.239 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)N2CCC[C@H]2c2ccc(Br)c(F)c2)CN1C1CC1 ZINC000430855409 858336118 /nfs/dbraw/zinc/33/61/18/858336118.db2.gz STXWUGCGLNNAKX-IAISJRAMSA-N 0 3 410.331 4.060 20 0 HIADHN O=C1N[C@H](c2ccc(Cl)cc2Cl)C(=O)N1C[C@H](c1cccs1)N1CCCC1 ZINC000430976219 858389204 /nfs/dbraw/zinc/38/92/04/858389204.db2.gz RDHMOKVTIMWXJC-NVXWUHKLSA-N 0 3 424.353 4.485 20 0 HIADHN CC(C)C(=O)Nc1cccc(NC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)c1 ZINC000437676388 863018290 /nfs/dbraw/zinc/01/82/90/863018290.db2.gz BEPVFYOXFAOEKE-LJQANCHMSA-N 0 3 408.546 4.409 20 0 HIADHN CC(=O)N1CCN(c2ccccc2CN[C@@H]2CCCOc3c(C(C)C)cccc32)CC1 ZINC000431354311 858576666 /nfs/dbraw/zinc/57/66/66/858576666.db2.gz WXWLJURMQFPUAU-XMMPIXPASA-N 0 3 421.585 4.482 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)c1cccc(OCC(F)(F)F)c1 ZINC000431478054 858636065 /nfs/dbraw/zinc/63/60/65/858636065.db2.gz OLZBGNDAJBZNNP-QGZVFWFLSA-N 0 3 406.448 4.364 20 0 HIADHN O=C(NC[C@@H]1CCCN(Cc2c[nH]nc2-c2ccsc2)C1)Nc1cccc(F)c1 ZINC000437721972 863051920 /nfs/dbraw/zinc/05/19/20/863051920.db2.gz PCXQNTQBDAGNRO-HNNXBMFYSA-N 0 3 413.522 4.311 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)c3c(Cl)cc(F)cc3Cl)CC2)C[C@H](C)O1 ZINC000431621029 858694323 /nfs/dbraw/zinc/69/43/23/858694323.db2.gz BENUBFVUBPEQCC-BETUJISGSA-N 0 3 403.325 4.094 20 0 HIADHN CC[C@@H](CNC(=O)C1(Cc2ccc(F)cc2)CCOCC1)N1CCc2ccccc2C1 ZINC000431956718 858886655 /nfs/dbraw/zinc/88/66/55/858886655.db2.gz VCMSLHWBMZDUSO-DEOSSOPVSA-N 0 3 424.560 4.118 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)Cc3c[nH]c4cccc(Cl)c34)cc2)CC1 ZINC000432000262 858915138 /nfs/dbraw/zinc/91/51/38/858915138.db2.gz MQTNSSQNDXADKP-UHFFFAOYSA-N 0 3 410.949 4.140 20 0 HIADHN COC(=O)C12CCC(C(=O)NC[C@H](c3cccs3)N3CCC(C)CC3)(CC1)CC2 ZINC000432039163 858944606 /nfs/dbraw/zinc/94/46/06/858944606.db2.gz DDIAFHKCRYONII-WDGBRCNXSA-N 0 3 418.603 4.151 20 0 HIADHN CCN1CCN(c2ccc(C(=O)NC(c3cccs3)c3cccs3)cc2)CC1 ZINC000467542037 881363295 /nfs/dbraw/zinc/36/32/95/881363295.db2.gz IVFRGVUZXMIOTG-UHFFFAOYSA-N 0 3 411.596 4.471 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)C1(Cc2cccc(F)c2)CCOCC1 ZINC000432064316 858962381 /nfs/dbraw/zinc/96/23/81/858962381.db2.gz UWRMCRWQVDLFLK-QHCPKHFHSA-N 0 3 410.533 4.118 20 0 HIADHN CN(c1ccccc1)c1cc(NC2CC(N3CCC(C(F)(F)F)CC3)C2)ncn1 ZINC000432163983 859024932 /nfs/dbraw/zinc/02/49/32/859024932.db2.gz BXTVZZDHLJMLOY-UHFFFAOYSA-N 0 3 405.468 4.462 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)c2cncc(-c3ccc4c(c3)CCO4)c2)CC1 ZINC000432202396 859044001 /nfs/dbraw/zinc/04/40/01/859044001.db2.gz JJJUIZPUGMNQED-UHFFFAOYSA-N 0 3 417.509 4.013 20 0 HIADHN Cc1cc(NC(=O)N2Cc3ccc(C)cc3C2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000432277787 859081823 /nfs/dbraw/zinc/08/18/23/859081823.db2.gz UGFMIRTVRCFPPU-HSZRJFAPSA-N 0 3 415.541 4.495 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)C2(Cc3ccc(F)cc3)CCOCC2)C1 ZINC000432420151 859156708 /nfs/dbraw/zinc/15/67/08/859156708.db2.gz JEEOWQIMZHXYQJ-WMZHIEFXSA-N 0 3 410.533 4.117 20 0 HIADHN CCC(C)(C)OCc1ccccc1NC(=O)N1CCN(c2ccncc2OC)CC1 ZINC000432439001 859165391 /nfs/dbraw/zinc/16/53/91/859165391.db2.gz FEYFBWZSGZUIGE-UHFFFAOYSA-N 0 3 412.534 4.150 20 0 HIADHN CC1(C)CN(C(=O)Nc2ccc(CCN3CCSCC3)cc2)[C@@H]1c1ccncc1 ZINC000432765870 859344886 /nfs/dbraw/zinc/34/48/86/859344886.db2.gz DXJWZHZSRXOJDV-OAQYLSRUSA-N 0 3 410.587 4.288 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3cncc(-c4ccccc4)c3)CC2)C[C@@H](C)O1 ZINC000467606888 881413115 /nfs/dbraw/zinc/41/31/15/881413115.db2.gz WURWOSSUCPWUJI-WOJBJXKFSA-N 0 3 407.558 4.100 20 0 HIADHN CN(C)Cc1ccc(S(=O)(=O)N2CCC[C@@H]2c2cccc(Br)c2)cc1 ZINC000432864329 859395325 /nfs/dbraw/zinc/39/53/25/859395325.db2.gz HJIYHVDMAKFHRJ-LJQANCHMSA-N 0 3 423.376 4.037 20 0 HIADHN C[C@H]1C[C@@H]1c1ccc(CN(CCC(=O)Nc2ccc(C(N)=O)c(Cl)c2)C2CC2)o1 ZINC000432895696 859415460 /nfs/dbraw/zinc/41/54/60/859415460.db2.gz YXCMLEXVJHJVOI-UGSOOPFHSA-N 0 3 415.921 4.149 20 0 HIADHN CCN1CCC[C@@H](CN(C)Cc2nc3ccc(F)cc3s2)[C@@H]1c1cnn(C)c1 ZINC000432922260 859432235 /nfs/dbraw/zinc/43/22/35/859432235.db2.gz LGYMIOLFOYNBSN-YCRPNKLZSA-N 0 3 401.555 4.074 20 0 HIADHN Cc1ccc(-c2ccc(C)c(NC(=O)NC[C@@]3(O)CCN(Cc4ccccc4)C3)c2)o1 ZINC000432978641 859460521 /nfs/dbraw/zinc/46/05/21/859460521.db2.gz JXLFISWFNJFDSM-VWLOTQADSA-N 0 3 419.525 4.322 20 0 HIADHN CSc1ccc(F)cc1CNC(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000467620898 881424160 /nfs/dbraw/zinc/42/41/60/881424160.db2.gz CTYXGZYFASMNEN-UHFFFAOYSA-N 0 3 419.591 4.461 20 0 HIADHN C[C@@H](SCCN(C)Cc1ccccc1)C(=O)Nc1cccc(N2CCCC2=O)c1 ZINC000433047954 859498724 /nfs/dbraw/zinc/49/87/24/859498724.db2.gz VEURLVADSUIJOD-GOSISDBHSA-N 0 3 411.571 4.006 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)CN2CCC[C@H](c3ccccc3)C2)cc1OC ZINC000433077180 859512025 /nfs/dbraw/zinc/51/20/25/859512025.db2.gz NFTZLTIZYOJSPL-VXKWHMMOSA-N 0 3 408.542 4.247 20 0 HIADHN COc1cc(-c2nnc(CN(C)C3CCC(C(C)C)CC3)o2)cc(OC)c1OC ZINC000433147268 859540713 /nfs/dbraw/zinc/54/07/13/859540713.db2.gz CIKLTQJMLAWLEO-UHFFFAOYSA-N 0 3 403.523 4.409 20 0 HIADHN COc1ccccc1-c1noc(C2CCN(CCOCCOc3ccccc3)CC2)n1 ZINC000433162047 859548331 /nfs/dbraw/zinc/54/83/31/859548331.db2.gz LHTJZJUNRVQWHW-UHFFFAOYSA-N 0 3 423.513 4.020 20 0 HIADHN COc1ccc(OCc2ccccn2)c(CNCC2(CO)CC(c3ccccc3)C2)c1 ZINC000433192505 859562229 /nfs/dbraw/zinc/56/22/29/859562229.db2.gz ZJDYSOZHNRLMRN-UHFFFAOYSA-N 0 3 418.537 4.315 20 0 HIADHN Fc1cccc([C@@H]2CN(CCC3CCOCC3)CCN2CCC2CCOCC2)c1 ZINC000433206176 859565789 /nfs/dbraw/zinc/56/57/89/859565789.db2.gz HKGHHRRLAMBYFC-DEOSSOPVSA-N 0 3 404.570 4.118 20 0 HIADHN FC(F)(F)c1cnc(N2CC[C@H](NCc3ccc(-c4cc[nH]n4)o3)C2)c(Cl)c1 ZINC000433345459 859657279 /nfs/dbraw/zinc/65/72/79/859657279.db2.gz XJCIOOVLUKLVJZ-LBPRGKRZSA-N 0 3 411.815 4.105 20 0 HIADHN CN(C)Cc1ccc(S(=O)(=O)NC(C)(C)Cc2ccc(C(F)(F)F)cc2)cc1 ZINC000433353515 859658415 /nfs/dbraw/zinc/65/84/15/859658415.db2.gz LSFADQXCIBCFRE-UHFFFAOYSA-N 0 3 414.493 4.067 20 0 HIADHN C[C@H](NCCNC(=O)CC1CCCC1)c1ccc(OC[C@H]2CCCCO2)c(F)c1 ZINC000433369866 859661711 /nfs/dbraw/zinc/66/17/11/859661711.db2.gz ANYVRDUKKQYXCS-FXAWDEMLSA-N 0 3 406.542 4.121 20 0 HIADHN CCNC(=O)c1ccc(CN[C@@H](C)c2ccc(OC[C@H]3CCCCO3)c(F)c2)cc1 ZINC000433371419 859661795 /nfs/dbraw/zinc/66/17/95/859661795.db2.gz AZWJSGITAVAZHP-LAUBAEHRSA-N 0 3 414.521 4.374 20 0 HIADHN Cc1cccc(C(=O)NCCN[C@@H](C)c2ccc(OC[C@@H]3CCCCO3)c(F)c2)c1 ZINC000433391500 859671648 /nfs/dbraw/zinc/67/16/48/859671648.db2.gz RWNBMDIJWIJZOU-RXVVDRJESA-N 0 3 414.521 4.163 20 0 HIADHN C[C@@H](NCc1ccc(NC(N)=O)cc1)c1ccc(OC[C@H]2CCCCO2)c(F)c1 ZINC000433395542 859674495 /nfs/dbraw/zinc/67/44/95/859674495.db2.gz ABWDDLDSCDCIAW-DNVCBOLYSA-N 0 3 401.482 4.115 20 0 HIADHN Cc1cccc(OC[C@H](O)CN[C@@H](C)c2ccc(OC[C@H]3CCCCO3)c(F)c2)c1 ZINC000433397125 859676062 /nfs/dbraw/zinc/67/60/62/859676062.db2.gz IHPOQKKGOPEGOZ-CZTZKLFOSA-N 0 3 417.521 4.173 20 0 HIADHN CN(C(=O)NCCC1CC(OC(C)(C)C)C1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000433479855 859722768 /nfs/dbraw/zinc/72/27/68/859722768.db2.gz JGJIJKOOWQRDOB-ORFBVSJDSA-N 0 3 401.595 4.276 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3c4c(ccc3Cl)OCC4)CC2)C[C@H](C)O1 ZINC000433508449 859743191 /nfs/dbraw/zinc/74/31/91/859743191.db2.gz GEQVBWDKFKLKHC-IYBDPMFKSA-N 0 3 421.969 4.018 20 0 HIADHN CSC1(CNC(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)CCC1 ZINC000433566866 859782511 /nfs/dbraw/zinc/78/25/11/859782511.db2.gz XUSRLGILUGDCFK-IBGZPJMESA-N 0 3 413.591 4.046 20 0 HIADHN O=C(N1CCc2ccc(F)cc2C1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000433566389 859782664 /nfs/dbraw/zinc/78/26/64/859782664.db2.gz ZSWHTGTVEZYULB-OAQYLSRUSA-N 0 3 406.423 4.165 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)N[C@H](c2cc(F)ccc2F)C(F)F)c1 ZINC000433657301 859826543 /nfs/dbraw/zinc/82/65/43/859826543.db2.gz UXEDHWTZFJOMFU-LJQANCHMSA-N 0 3 411.443 4.353 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CC[C@@](C)(c4ccc(C)cc4)C3)c2)CC1 ZINC000433820061 859911906 /nfs/dbraw/zinc/91/19/06/859911906.db2.gz CLIGJVGTOUVAMC-RUZDIDTESA-N 0 3 406.574 4.332 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)NCc3cc(F)c(Cl)cc3F)c2)CC1 ZINC000433820161 859912084 /nfs/dbraw/zinc/91/20/84/859912084.db2.gz LUOSFMWQRRKBFY-UHFFFAOYSA-N 0 3 408.880 4.082 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)c2cccc(CSc3nccn3C)c2)CN1Cc1ccccc1 ZINC000467684610 881477722 /nfs/dbraw/zinc/47/77/22/881477722.db2.gz CXOMCOQUWKZDKJ-GCJKJVERSA-N 0 3 420.582 4.105 20 0 HIADHN O=C(Cc1cc(Br)ccc1F)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000433866284 859942243 /nfs/dbraw/zinc/94/22/43/859942243.db2.gz DEFVGNHRHUXWNX-IBGZPJMESA-N 0 3 405.311 4.084 20 0 HIADHN CN(C)Cc1ccc(S(=O)(=O)N2CCCCC[C@H]2CC(=O)c2cccs2)cc1 ZINC000433880553 859949371 /nfs/dbraw/zinc/94/93/71/859949371.db2.gz RTOWPWCMRHXXPM-SFHVURJKSA-N 0 3 420.600 4.016 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)NC[C@@H]1CCCN(c2ccccc2)C1 ZINC000433914858 859966560 /nfs/dbraw/zinc/96/65/60/859966560.db2.gz KQUXZXJWZLSIEU-XUZZJYLKSA-N 0 3 406.574 4.039 20 0 HIADHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc2c(c1)nc(C(F)(F)F)n2C(C)C ZINC000434025043 860047599 /nfs/dbraw/zinc/04/75/99/860047599.db2.gz YVVOTEANHPRQML-CVEARBPZSA-N 0 3 408.468 4.335 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)c2ccc(OCc3ccccn3)cc2)CN1Cc1ccccc1 ZINC000467700724 881495506 /nfs/dbraw/zinc/49/55/06/881495506.db2.gz NHXCZAITRLILJZ-AUSIDOKSSA-N 0 3 401.510 4.053 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N(CCCO)Cc2cccc(Cl)c2)C1 ZINC000434037721 860055933 /nfs/dbraw/zinc/05/59/33/860055933.db2.gz SEFRZMPKJCRQRN-GCJKJVERSA-N 0 3 415.965 4.070 20 0 HIADHN O=C(Nc1cccc(-c2noc(C3CC3)n2)c1)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000434069754 860079326 /nfs/dbraw/zinc/07/93/26/860079326.db2.gz DMXDKQJRWOJUBB-FQEVSTJZSA-N 0 3 403.486 4.010 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)c2ccccc2NCc2cccnc2)C1 ZINC000434086826 860093615 /nfs/dbraw/zinc/09/36/15/860093615.db2.gz ICYYARPPQWAVSP-KNQAVFIVSA-N 0 3 400.526 4.259 20 0 HIADHN CC(C)Oc1ccc(Br)cc1NC(=O)N(CCN(C)C)Cc1ccco1 ZINC000434108047 860109999 /nfs/dbraw/zinc/10/99/99/860109999.db2.gz CCYLMLPSBXBTFT-UHFFFAOYSA-N 0 3 424.339 4.425 20 0 HIADHN Cc1ccn(C2CCN(C(=O)NC[C@@H](c3ccccc3)N3CCC(C)CC3)CC2)n1 ZINC000434269239 860243277 /nfs/dbraw/zinc/24/32/77/860243277.db2.gz LULQRFGJOVMPIV-QHCPKHFHSA-N 0 3 409.578 4.011 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)Cc1cc(C)ccc1C ZINC000434313003 860274841 /nfs/dbraw/zinc/27/48/41/860274841.db2.gz RTVYDJSOXSTRQR-HSZRJFAPSA-N 0 3 402.542 4.437 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)CO[C@@H]1CCCC[C@H]1C ZINC000434319567 860279693 /nfs/dbraw/zinc/27/96/93/860279693.db2.gz YLDOSWGLGXMQIC-STZQEDGTSA-N 0 3 410.562 4.172 20 0 HIADHN COc1cccc([C@@H](C)C(=O)Nc2c(C)cnn2[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000434325224 860286665 /nfs/dbraw/zinc/28/66/65/860286665.db2.gz HKBBCNHISFCNDH-DENIHFKCSA-N 0 3 418.541 4.389 20 0 HIADHN CCOc1c(F)cccc1C(=O)Nc1c(C)cnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000434326370 860287585 /nfs/dbraw/zinc/28/75/85/860287585.db2.gz MPUJBSBPMKWKNW-IBGZPJMESA-N 0 3 422.504 4.429 20 0 HIADHN COc1ccc(C(=O)Nc2c(C)cnn2[C@H]2CCN(Cc3ccccc3)C2)cc1F ZINC000434329607 860290488 /nfs/dbraw/zinc/29/04/88/860290488.db2.gz AWCQUQQGVATOLD-IBGZPJMESA-N 0 3 408.477 4.039 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)[C@H](C)Oc1ccccc1 ZINC000434329659 860292173 /nfs/dbraw/zinc/29/21/73/860292173.db2.gz BSROYKZCKVMPLK-FPOVZHCZSA-N 0 3 404.514 4.045 20 0 HIADHN CC(=O)c1cccc(C(=O)Nc2c(C)cnn2[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000434333558 860295140 /nfs/dbraw/zinc/29/51/40/860295140.db2.gz MSNUQNBMMUBWPK-JOCHJYFZSA-N 0 3 402.498 4.093 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)CCO[C@H](C)CC(C)C ZINC000434335088 860296782 /nfs/dbraw/zinc/29/67/82/860296782.db2.gz UEZHYVCBNVJBPM-IFMALSPDSA-N 0 3 412.578 4.418 20 0 HIADHN COC(=O)C[C@@H](NC(=O)c1cccc(CN2CCCC2)c1)c1ccc(Cl)c(F)c1 ZINC000434434896 860350702 /nfs/dbraw/zinc/35/07/02/860350702.db2.gz NAMSMZSKYCITGI-HXUWFJFHSA-N 0 3 418.896 4.109 20 0 HIADHN Cc1ncsc1CN(C)C[C@@H]1CCN(Cc2sccc2Br)C1 ZINC000434494919 860372070 /nfs/dbraw/zinc/37/20/70/860372070.db2.gz QNSCLQCKAOJGOH-ZDUSSCGKSA-N 0 3 400.411 4.229 20 0 HIADHN c1nc(C2CCN(Cc3nn(-c4ccccc4)c4c3CCC4)CC2)n2c1CCCC2 ZINC000434674043 860454875 /nfs/dbraw/zinc/45/48/75/860454875.db2.gz TXHBOIKPASIRHD-UHFFFAOYSA-N 0 3 401.558 4.273 20 0 HIADHN Cc1sc2nc([C@H](C)N3CCC(c4ncc5n4CCCC5)CC3)nc(N)c2c1C ZINC000434677346 860455691 /nfs/dbraw/zinc/45/56/91/860455691.db2.gz XFNZRXJSHPBZII-AWEZNQCLSA-N 0 3 410.591 4.364 20 0 HIADHN C[C@@H](NC(=O)CN1CCC(c2ncc3n2CCCC3)CC1)c1cccc2ccccc21 ZINC000434680589 860457334 /nfs/dbraw/zinc/45/73/34/860457334.db2.gz JVZCDFJKSKIVLF-LJQANCHMSA-N 0 3 416.569 4.429 20 0 HIADHN COc1ccccc1CN(CCC(=O)Nc1cccc(F)c1C)C[C@H]1CCCO1 ZINC000434686055 860460620 /nfs/dbraw/zinc/46/06/20/860460620.db2.gz RAKZHJFNEMEERI-LJQANCHMSA-N 0 3 400.494 4.153 20 0 HIADHN Cc1cc(Cl)ccc1NC(=O)[C@@H](C)N1CCC(c2ncc3n2CCCC3)CC1 ZINC000434687775 860461886 /nfs/dbraw/zinc/46/18/86/860461886.db2.gz FYEKPLJXPQZHMJ-MRXNPFEDSA-N 0 3 400.954 4.388 20 0 HIADHN C[C@@H](CC(=O)NCCCCN1C[C@@H](C)O[C@@H](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000434759199 860484472 /nfs/dbraw/zinc/48/44/72/860484472.db2.gz NINYYFWKZNFQEI-YESZJQIVSA-N 0 3 400.485 4.205 20 0 HIADHN C[C@@H](CC(=O)NCCCCN1C[C@@H](C)O[C@H](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000434759197 860484499 /nfs/dbraw/zinc/48/44/99/860484499.db2.gz NINYYFWKZNFQEI-GVDBMIGSSA-N 0 3 400.485 4.205 20 0 HIADHN COc1cc(-c2ccccc2)sc1C(=O)NCCCCN1C[C@@H](C)O[C@@H](C)C1 ZINC000434765148 860487221 /nfs/dbraw/zinc/48/72/21/860487221.db2.gz BDDJOAUSXGPYIZ-CALCHBBNSA-N 0 3 402.560 4.043 20 0 HIADHN C[C@@H](CC(=O)NCCCCN1C[C@@H](C)O[C@H](C)C1)c1cccc(C(F)(F)F)c1 ZINC000434779347 860492768 /nfs/dbraw/zinc/49/27/68/860492768.db2.gz USGSIWHJKGWIQF-GVDBMIGSSA-N 0 3 400.485 4.205 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)c2cccc(COc3cccc(F)c3)c2)C[C@H](C)O1 ZINC000434783163 860493422 /nfs/dbraw/zinc/49/34/22/860493422.db2.gz KMIUUBACESOBLB-KDURUIRLSA-N 0 3 414.521 4.024 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CNC(=O)CN1CC[C@@H](c2ccccc2)[C@@H]1C ZINC000434898218 860543775 /nfs/dbraw/zinc/54/37/75/860543775.db2.gz UKDYCXRULURKJR-GBXCKJPGSA-N 0 3 416.569 4.042 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1cc(OC)c(OC)c(C)c1OC)c1ccsc1 ZINC000434905389 860549099 /nfs/dbraw/zinc/54/90/99/860549099.db2.gz QRQWJGFZXRNBMY-KRWDZBQOSA-N 0 3 421.563 4.287 20 0 HIADHN CC(=O)Nc1ccc(OC[C@@H](O)CN(Cc2cc(F)ccc2F)C2CCCC2)cc1 ZINC000434911653 860550771 /nfs/dbraw/zinc/55/07/71/860550771.db2.gz ZHKQSYWLQKDNKY-NRFANRHFSA-N 0 3 418.484 4.108 20 0 HIADHN C/C=C\c1ccc(OC[C@H](O)CN2CCC(OCC3CCCC3)CC2)c(OC)c1 ZINC000434909720 860550897 /nfs/dbraw/zinc/55/08/97/860550897.db2.gz PMWHVHSFXQIXJL-IXWARAEBSA-N 0 3 403.563 4.139 20 0 HIADHN CC(=O)NC[C@@H]1CCCN(Cc2cn(Cc3ccccc3)nc2-c2cccs2)C1 ZINC000434990331 860588170 /nfs/dbraw/zinc/58/81/70/860588170.db2.gz GRRVLGKZJYPVOD-FQEVSTJZSA-N 0 3 408.571 4.008 20 0 HIADHN CCc1cc(C)cc(CC)c1NC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1CO ZINC000435180129 860681883 /nfs/dbraw/zinc/68/18/83/860681883.db2.gz BWWLCDFUYOPMSY-GOTSBHOMSA-N 0 3 409.574 4.124 20 0 HIADHN CCc1cc(C)cc(CC)c1NC(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000435180241 860681924 /nfs/dbraw/zinc/68/19/24/860681924.db2.gz CYCGZICUEJTHCU-KDURUIRLSA-N 0 3 401.595 4.473 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)C2(c3ccccc3Cl)CCOCC2)CN1Cc1ccccc1 ZINC000467754868 881568462 /nfs/dbraw/zinc/56/84/62/881568462.db2.gz XJDSVGIWZONBFG-AZUAARDMSA-N 0 3 412.961 4.167 20 0 HIADHN C[C@H](SCC(=O)N[C@H]1C[C@@H](C)N(Cc2ccccc2)C1)c1nc2ccccc2[nH]1 ZINC000467755108 881568701 /nfs/dbraw/zinc/56/87/01/881568701.db2.gz QVZIAKBPGGCJSY-AOIWGVFYSA-N 0 3 408.571 4.136 20 0 HIADHN Cc1cc(NC(=O)CSCCC(C)C)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435269511 860709812 /nfs/dbraw/zinc/70/98/12/860709812.db2.gz RSVLXUWTPPLTSH-HXUWFJFHSA-N 0 3 400.592 4.356 20 0 HIADHN Cc1cc(NC(=O)C2(c3ccccc3F)CC2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435277064 860713906 /nfs/dbraw/zinc/71/39/06/860713906.db2.gz AGVVGWQGUJHFNF-FQEVSTJZSA-N 0 3 418.516 4.448 20 0 HIADHN Cc1cc(NC(=O)c2ccnc3ccccc32)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435281301 860715935 /nfs/dbraw/zinc/71/59/35/860715935.db2.gz QIEBUQKNTKAULX-HXUWFJFHSA-N 0 3 411.509 4.439 20 0 HIADHN CCc1nc(C)c(C(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)s1 ZINC000435281051 860716353 /nfs/dbraw/zinc/71/63/53/860716353.db2.gz PNJCYPRRPVVJDU-GOSISDBHSA-N 0 3 409.559 4.218 20 0 HIADHN Cc1cc(NC(=O)Cc2ccccc2Cl)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435280063 860716381 /nfs/dbraw/zinc/71/63/81/860716381.db2.gz MKKFKOHAJYJNAD-HXUWFJFHSA-N 0 3 408.933 4.473 20 0 HIADHN Cc1cc(NC(=O)c2cccc3c2CCC3)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435280408 860716414 /nfs/dbraw/zinc/71/64/14/860716414.db2.gz NOCJXRXBRBAHOG-NRFANRHFSA-N 0 3 400.526 4.380 20 0 HIADHN Cc1cc(NC(=O)C[C@@H](C)c2cccnc2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435285133 860718677 /nfs/dbraw/zinc/71/86/77/860718677.db2.gz NWCYIHHRJQEYAJ-XMSQKQJNSA-N 0 3 403.530 4.166 20 0 HIADHN CCO[C@H](CC(=O)Nc1cc(C)nn1[C@@H]1CCN(Cc2ccccc2)C1)C1=CCCC1 ZINC000435292813 860723105 /nfs/dbraw/zinc/72/31/05/860723105.db2.gz ZELKRBKIEMYXPC-DHIUTWEWSA-N 0 3 422.573 4.483 20 0 HIADHN COc1cc(C(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)ccc1C ZINC000435299510 860726627 /nfs/dbraw/zinc/72/66/27/860726627.db2.gz QZFIJJXSOSOBJU-OAQYLSRUSA-N 0 3 404.514 4.208 20 0 HIADHN CCSc1cc(C(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)ccn1 ZINC000435368549 860766012 /nfs/dbraw/zinc/76/60/12/860766012.db2.gz BCTFUHWZGVJONK-LJQANCHMSA-N 0 3 407.543 4.089 20 0 HIADHN COc1ccc(CCCC(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000435367797 860766064 /nfs/dbraw/zinc/76/60/64/860766064.db2.gz AMYORTNGHDQAKD-QFIPXVFZSA-N 0 3 418.541 4.300 20 0 HIADHN CC(C)c1ccc(OCC(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000435369389 860767373 /nfs/dbraw/zinc/76/73/73/860767373.db2.gz LACWRTGIPJHMKO-QFIPXVFZSA-N 0 3 418.541 4.471 20 0 HIADHN O=C(CCc1cccc(F)c1F)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435370161 860768272 /nfs/dbraw/zinc/76/82/72/860768272.db2.gz OEZGDPMDRZAUNP-IBGZPJMESA-N 0 3 410.468 4.180 20 0 HIADHN C[C@H](Oc1cccc(Cl)c1)C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435371723 860769768 /nfs/dbraw/zinc/76/97/68/860769768.db2.gz XBKHEQWLNBWPFN-PXNSSMCTSA-N 0 3 424.932 4.390 20 0 HIADHN C[C@H](C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(F)c(F)c1 ZINC000435372953 860770426 /nfs/dbraw/zinc/77/04/26/860770426.db2.gz CFGAFNRCZMKPCX-QFBILLFUSA-N 0 3 410.468 4.351 20 0 HIADHN O=C(Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)c1ccccc1OCC1CC1 ZINC000435372274 860770934 /nfs/dbraw/zinc/77/09/34/860770934.db2.gz QVCCXTDERJUIOA-NRFANRHFSA-N 0 3 416.525 4.371 20 0 HIADHN O=C(Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)C12CC3CC(CC(C3)C1)C2 ZINC000435374024 860771517 /nfs/dbraw/zinc/77/15/17/860771517.db2.gz PBZOATANXMBNTQ-UQQXROCHSA-N 0 3 404.558 4.485 20 0 HIADHN C[C@@H](OC1CCCCCC1)C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435374950 860772930 /nfs/dbraw/zinc/77/29/30/860772930.db2.gz KGZLPUNGVLQSHX-CTNGQTDRSA-N 0 3 410.562 4.397 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)[C@H]1C[C@H]1c1cccc(F)c1F ZINC000435381453 860777198 /nfs/dbraw/zinc/77/71/98/860777198.db2.gz TZYKEULKFGNYJX-HOJAQTOUSA-N 0 3 422.479 4.351 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)[C@@H]1C[C@@H]1c1cccc(F)c1F ZINC000435381455 860777914 /nfs/dbraw/zinc/77/79/14/860777914.db2.gz TZYKEULKFGNYJX-MISYRCLQSA-N 0 3 422.479 4.351 20 0 HIADHN CCN(Cc1ccccn1)C(=O)Nc1cc(C)nn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435517411 860835090 /nfs/dbraw/zinc/83/50/90/860835090.db2.gz XDDUIVQZTLJNHR-QFIPXVFZSA-N 0 3 418.545 4.088 20 0 HIADHN Cc1cc(NC(=O)N[C@H]2CCCC(F)(F)C2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435518888 860836348 /nfs/dbraw/zinc/83/63/48/860836348.db2.gz WILYPLMATYMILW-OALUTQOASA-N 0 3 417.504 4.338 20 0 HIADHN Cc1cc(NC(=O)NCc2cccc(F)c2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435518075 860836638 /nfs/dbraw/zinc/83/66/38/860836638.db2.gz SGKWJBUMMBGDTH-OAQYLSRUSA-N 0 3 407.493 4.099 20 0 HIADHN Cc1csc([C@H](C)NC(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435532389 860848614 /nfs/dbraw/zinc/84/86/14/860848614.db2.gz DUKPMRHGQXVHNJ-PKOBYXMFSA-N 0 3 424.574 4.286 20 0 HIADHN Cc1c(NC(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)cnn1-c1ccccc1F ZINC000435557211 860877545 /nfs/dbraw/zinc/87/75/45/860877545.db2.gz QOEVGYNPQGVWLL-LJQANCHMSA-N 0 3 407.493 4.058 20 0 HIADHN Cc1cc(C)n(-c2ccc(NC(=O)N(C)[C@H]3CCCN(Cc4ccccc4)C3)cn2)n1 ZINC000467775792 881594519 /nfs/dbraw/zinc/59/45/19/881594519.db2.gz HWEAUSNMPKBRSB-QFIPXVFZSA-N 0 3 418.545 4.012 20 0 HIADHN CC(C)C[C@@H]1CCCN1CC(=O)N(Cc1nnc(-c2ccccc2Cl)o1)C1CC1 ZINC000435677985 860957687 /nfs/dbraw/zinc/95/76/87/860957687.db2.gz KYPGKOIMQNSDCW-KRWDZBQOSA-N 0 3 416.953 4.392 20 0 HIADHN Cc1cc(NC(=O)CNc2c(C)cccc2C)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435688117 860970565 /nfs/dbraw/zinc/97/05/65/860970565.db2.gz MDUXJLYWYRZDQK-JOCHJYFZSA-N 0 3 417.557 4.306 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)[C@H]3CCOc4ccccc43)c(OCC)c2)CC1 ZINC000435835054 861096656 /nfs/dbraw/zinc/09/66/56/861096656.db2.gz LLEGEBFKBRARLW-NRFANRHFSA-N 0 3 423.557 4.122 20 0 HIADHN C[C@H](N[C@@H](Cc1ccc(C(F)(F)F)cc1)C(N)=O)c1ccc(Br)cc1 ZINC000435885884 861144300 /nfs/dbraw/zinc/14/43/00/861144300.db2.gz PGEDNWNBFRBHRY-ZBEGNZNMSA-N 0 3 415.253 4.215 20 0 HIADHN CCCCc1oc2ccccc2c1CN1CC[C@@H](N(Cc2noc(CC)n2)C(C)=O)C1 ZINC000435886877 861144658 /nfs/dbraw/zinc/14/46/58/861144658.db2.gz CMBMNWHQQKVQOL-GOSISDBHSA-N 0 3 424.545 4.344 20 0 HIADHN Cc1ccc([C@@H](NCCc2cccc(OC(F)(F)F)c2)[C@H](C)S(C)(=O)=O)cc1 ZINC000435906742 861167480 /nfs/dbraw/zinc/16/74/80/861167480.db2.gz HVSZUJZYBXSNLH-KXBFYZLASA-N 0 3 415.477 4.200 20 0 HIADHN Cc1cc(NC(=O)c2ccc(OC(C)C)cn2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435911534 861172567 /nfs/dbraw/zinc/17/25/67/861172567.db2.gz NBOUIJBAJLTKBK-HXUWFJFHSA-N 0 3 419.529 4.073 20 0 HIADHN Cc1ccc(NC(=O)Nc2ccccc2)cc1NC(=O)N1CC[C@@H](N2CC=CC2)C1 ZINC000437747825 863072445 /nfs/dbraw/zinc/07/24/45/863072445.db2.gz KKEUMNVJCRVVQK-HXUWFJFHSA-N 0 3 405.502 4.117 20 0 HIADHN Cc1ccc(NC(=O)Nc2ccccc2)cc1NC(=O)N1CC[C@H](N2CC=CC2)C1 ZINC000437747823 863073010 /nfs/dbraw/zinc/07/30/10/863073010.db2.gz KKEUMNVJCRVVQK-FQEVSTJZSA-N 0 3 405.502 4.117 20 0 HIADHN Cc1cc(C)n(-c2ccc(NC(=O)N3CC[C@@H](C)N(Cc4ccccc4)CC3)cn2)n1 ZINC000437780175 863098443 /nfs/dbraw/zinc/09/84/43/863098443.db2.gz VTJUXWAQTCGZMZ-LJQANCHMSA-N 0 3 418.545 4.012 20 0 HIADHN C[C@@H]1CCN(C(=O)Nc2ccc(N3CCCCC3)nc2)CCN1Cc1ccccc1 ZINC000437787732 863105841 /nfs/dbraw/zinc/10/58/41/863105841.db2.gz LSUQOJTYLURXBW-HXUWFJFHSA-N 0 3 407.562 4.200 20 0 HIADHN Cc1ccc(NC(=O)C2CC2)cc1NC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1 ZINC000437790962 863109745 /nfs/dbraw/zinc/10/97/45/863109745.db2.gz ZWIPSRCGAWDGLF-IBGZPJMESA-N 0 3 420.557 4.472 20 0 HIADHN Cc1cc(-c2cc(C(=O)N[C@@H]3CN(C4CC4)C[C@@H]3C)c3c(C)noc3n2)c(C)s1 ZINC000467806595 881631261 /nfs/dbraw/zinc/63/12/61/881631261.db2.gz SGEUXQUBCWEBTE-JEOXALJRSA-N 0 3 410.543 4.089 20 0 HIADHN Cc1ccc(C(=O)NC2CC2)cc1NC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC000437862243 863222872 /nfs/dbraw/zinc/22/28/72/863222872.db2.gz XABCHKCPTCVTLF-LJQANCHMSA-N 0 3 420.557 4.016 20 0 HIADHN C[C@H]1CCN(C(=O)Nc2cccc(-c3nccn3C)c2)CCN1Cc1ccccc1 ZINC000437973208 863341949 /nfs/dbraw/zinc/34/19/49/863341949.db2.gz FYZAQJNGYQERAR-IBGZPJMESA-N 0 3 403.530 4.215 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)N[C@H]2C[C@@H]2c2ccccc2OC(F)F)CN1Cc1ccccc1 ZINC000438016726 863376885 /nfs/dbraw/zinc/37/68/85/863376885.db2.gz WIGIUWRWVDKIHO-QOJCHSLYSA-N 0 3 415.484 4.106 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)N1CC[C@H](Cc2ccccc2)C1 ZINC000438076512 863466206 /nfs/dbraw/zinc/46/62/06/863466206.db2.gz DTMULYYFKKZWAY-JOCHJYFZSA-N 0 3 409.599 4.374 20 0 HIADHN Cc1ccc(-c2nnco2)cc1NC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC000438083575 863479971 /nfs/dbraw/zinc/47/99/71/863479971.db2.gz YANWGOPSSSTARO-GOSISDBHSA-N 0 3 405.502 4.173 20 0 HIADHN COC(=O)c1ccc(COc2ccccc2CN2CC[C@H](C)[C@@H](n3ccnc3)C2)cc1 ZINC000438104852 863515744 /nfs/dbraw/zinc/51/57/44/863515744.db2.gz MVIXOXWTLGMTMK-CVDCTZTESA-N 0 3 419.525 4.332 20 0 HIADHN CC(=O)N1CCN(c2ccccc2CN[C@@H](C)c2ccc(C(F)(F)F)cc2)CC1 ZINC000467835144 881669323 /nfs/dbraw/zinc/66/93/23/881669323.db2.gz YWPOIRMFIPNUNE-INIZCTEOSA-N 0 3 405.464 4.225 20 0 HIADHN CC[C@H](NCc1cccc(NC(=O)CCN2CCOCC2)c1)c1cccc(Cl)c1 ZINC000467837562 881672702 /nfs/dbraw/zinc/67/27/02/881672702.db2.gz CZNYENOQRQEQKB-QFIPXVFZSA-N 0 3 415.965 4.242 20 0 HIADHN CN(C)CCN(C[C@@H]1CCCO1)C(=O)Nc1ccc(OCC2CCCCC2)cc1 ZINC000438206544 863638782 /nfs/dbraw/zinc/63/87/82/863638782.db2.gz NYYVYYCGDSNEDM-QFIPXVFZSA-N 0 3 403.567 4.220 20 0 HIADHN C[C@@H](NC(=O)c1cccc(CN2CCCC2)c1)[C@H](OC1CCOCC1)c1ccccc1 ZINC000438244809 863705873 /nfs/dbraw/zinc/70/58/73/863705873.db2.gz GOGRQXXPGANIFO-NLFFAJNJSA-N 0 3 422.569 4.338 20 0 HIADHN COC(=O)[C@H](C)Oc1ccc(CN2CCC(c3nc4cccc(C)c4o3)CC2)cc1 ZINC000438325762 863803291 /nfs/dbraw/zinc/80/32/91/863803291.db2.gz JIHMOCQFZPWTHV-KRWDZBQOSA-N 0 3 408.498 4.456 20 0 HIADHN CN(C)CCN(C(=O)Nc1cc(Cl)ccc1N1CCSCC1)C1CCCC1 ZINC000467851942 881701007 /nfs/dbraw/zinc/70/10/07/881701007.db2.gz DCUNWRBFWXJMPI-UHFFFAOYSA-N 0 3 411.015 4.231 20 0 HIADHN CC(C)c1nn(-c2ccc(Br)cc2)cc1CN1CC[C@@H](O)C(C)(C)C1 ZINC000438340921 863813795 /nfs/dbraw/zinc/81/37/95/863813795.db2.gz YSENQSWPVZZBKO-GOSISDBHSA-N 0 3 406.368 4.351 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)Nc2cc3c(cc2Cl)OCCO3)CC1 ZINC000438347196 863816813 /nfs/dbraw/zinc/81/68/13/863816813.db2.gz NOCRDDZNAKLJSK-UHFFFAOYSA-N 0 3 415.921 4.240 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)N[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000438367999 863829800 /nfs/dbraw/zinc/82/98/00/863829800.db2.gz QIUZDZJZKXYAIP-QFBILLFUSA-N 0 3 407.345 4.018 20 0 HIADHN CCSCc1cccc(NC(=O)N2CCC(CN3C[C@@H](C)O[C@H](C)C3)CC2)c1 ZINC000438377217 863835896 /nfs/dbraw/zinc/83/58/96/863835896.db2.gz QJWMRRWBADAUKF-QZTJIDSGSA-N 0 3 405.608 4.293 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)N[C@@H]2C[C@H]2c2ccc(Cl)c(F)c2)CC1 ZINC000438383976 863838424 /nfs/dbraw/zinc/83/84/24/863838424.db2.gz GEXYWFWEDKWMJP-FXAWDEMLSA-N 0 3 405.901 4.234 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)N[C@H]1C[C@H](c2ccccc2F)C1 ZINC000438420327 863857616 /nfs/dbraw/zinc/85/76/16/863857616.db2.gz RFQXMUPXQZBTFV-QAQDUYKDSA-N 0 3 405.464 4.123 20 0 HIADHN CCc1c(C(=O)CN(C)[C@H]2CCN(Cc3ccccc3)[C@@H](C)C2)[nH]c(C)c1C(C)=O ZINC000438454297 863878694 /nfs/dbraw/zinc/87/86/94/863878694.db2.gz JNKTZJJGDOVXEP-UWJYYQICSA-N 0 3 409.574 4.256 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)c1cc2c(cccc2Br)[nH]1 ZINC000438467856 863888598 /nfs/dbraw/zinc/88/85/98/863888598.db2.gz VDUBTBUERVPMSD-UHFFFAOYSA-N 0 3 406.349 4.196 20 0 HIADHN Cc1cc(CN(C)[C@H]2CCOc3ccc(Br)cc32)ccc1-n1cncn1 ZINC000438478279 863895397 /nfs/dbraw/zinc/89/53/97/863895397.db2.gz LWNMISXFWFJSST-IBGZPJMESA-N 0 3 413.319 4.294 20 0 HIADHN Cc1noc2nc(C(C)C)cc(C(=O)N(Cc3ccccc3)C3CCN(C)CC3)c12 ZINC000438562622 863994827 /nfs/dbraw/zinc/99/48/27/863994827.db2.gz QVQIKFSJKUZQCY-UHFFFAOYSA-N 0 3 406.530 4.391 20 0 HIADHN COc1ccc(C)cc1NC(=O)[C@H](C)N1CCN(C2CCC(C(C)C)CC2)CC1 ZINC000438562665 863995438 /nfs/dbraw/zinc/99/54/38/863995438.db2.gz QZWUQQZZXGNVAO-MWXLCCTBSA-N 0 3 401.595 4.163 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3cccc(CC(F)(F)F)c3)CC2)C[C@H](C)O1 ZINC000438571664 864005163 /nfs/dbraw/zinc/00/51/63/864005163.db2.gz ZUBMNWLXANTIBB-IYBDPMFKSA-N 0 3 413.484 4.145 20 0 HIADHN CCc1csc(NC(=O)N(CCN(C)C)Cc2ccc(Br)cc2)n1 ZINC000438597224 864025664 /nfs/dbraw/zinc/02/56/64/864025664.db2.gz KQQLIZQQLCXCFU-UHFFFAOYSA-N 0 3 411.369 4.064 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)N(CCC(F)(F)F)CC1CC1 ZINC000438602546 864029281 /nfs/dbraw/zinc/02/92/81/864029281.db2.gz YLUPQQBKLPSATA-UHFFFAOYSA-N 0 3 415.525 4.474 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)Nc2ccc(OC[C@@H]3CCCO3)cc2)CC1 ZINC000438629565 864058106 /nfs/dbraw/zinc/05/81/06/864058106.db2.gz NYRXCUNQTOKIKT-DEOSSOPVSA-N 0 3 423.557 4.373 20 0 HIADHN CC1CCC(N2CCN(C(=O)Nc3c(F)cc(Br)cc3F)CC2)CC1 ZINC000438641261 864078027 /nfs/dbraw/zinc/07/80/27/864078027.db2.gz LREHNFQPCDGNSH-UHFFFAOYSA-N 0 3 416.310 4.456 20 0 HIADHN O[C@@H](CO[C@@H]1CCCc2ccccc21)CN1CC=C(c2c[nH]c3ncccc23)CC1 ZINC000438650379 864090594 /nfs/dbraw/zinc/09/05/94/864090594.db2.gz POEWPESXFYQYCQ-HYBUGGRVSA-N 0 3 403.526 4.107 20 0 HIADHN CCN(C(=O)C(=O)Nc1cccc([C@H](C)OC)c1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000438652865 864094526 /nfs/dbraw/zinc/09/45/26/864094526.db2.gz BTLHVUKMPWNANY-YDHSSHFGSA-N 0 3 423.557 4.017 20 0 HIADHN CCN(C(=O)C(=O)Nc1cc(F)cc(Cl)c1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000438655646 864097653 /nfs/dbraw/zinc/09/76/53/864097653.db2.gz NKVZNSHBRQOBDW-YWZLYKJASA-N 0 3 417.912 4.102 20 0 HIADHN CN(C)CCN(C[C@@H]1CCCO1)C(=O)Nc1ccc2nc(C(C)(C)C)sc2c1 ZINC000438655682 864098047 /nfs/dbraw/zinc/09/80/47/864098047.db2.gz ZLRNBIJKRXAQDR-INIZCTEOSA-N 0 3 404.580 4.168 20 0 HIADHN COc1ccccc1NC(=O)C1CCN(CCOc2ccc(SC)cc2)CC1 ZINC000438660939 864108668 /nfs/dbraw/zinc/10/86/68/864108668.db2.gz OTSBTLJQONMJDI-UHFFFAOYSA-N 0 3 400.544 4.147 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Nc1ccnc(Sc2ccccn2)c1 ZINC000438661060 864109303 /nfs/dbraw/zinc/10/93/03/864109303.db2.gz MPMLQAONZNVALC-UHFFFAOYSA-N 0 3 413.572 4.285 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Nc1cc(F)ccc1OC[C@@H]1CCCO1 ZINC000438664421 864116999 /nfs/dbraw/zinc/11/69/99/864116999.db2.gz HYZLYOXXWJTBCZ-KRWDZBQOSA-N 0 3 421.538 4.041 20 0 HIADHN CCCn1ccc2cc(NC(=O)NCc3ccccc3CN3CCC(O)CC3)ccc21 ZINC000438668768 864126820 /nfs/dbraw/zinc/12/68/20/864126820.db2.gz ZKNJRVUBWBWPAZ-UHFFFAOYSA-N 0 3 420.557 4.330 20 0 HIADHN CSc1ccc(OCCN2CCC(NC(=O)Nc3ccc(F)cc3)CC2)cc1 ZINC000438668493 864127445 /nfs/dbraw/zinc/12/74/45/864127445.db2.gz NOWUYNKWQVGVOE-UHFFFAOYSA-N 0 3 403.523 4.213 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)c2ccc(OCc3ccccc3)nc2)CC1 ZINC000438718870 864200823 /nfs/dbraw/zinc/20/08/23/864200823.db2.gz ZEOBVZWDCDPINB-UHFFFAOYSA-N 0 3 415.537 4.397 20 0 HIADHN C[C@@H]1CCCN1C(=O)CCN(C)Cc1cn(-c2ccccc2)nc1-c1ccccc1 ZINC000438785223 864278655 /nfs/dbraw/zinc/27/86/55/864278655.db2.gz VHQITFAYIKMAQU-HXUWFJFHSA-N 0 3 402.542 4.372 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Nc1c(F)cc(Br)cc1F ZINC000438882073 864368124 /nfs/dbraw/zinc/36/81/24/864368124.db2.gz HXOOBVVGCDZLPT-UHFFFAOYSA-N 0 3 418.307 4.385 20 0 HIADHN COc1ccc([C@H](CNC(=O)[C@H]2C[C@]23CCCc2ccccc23)N2CCCC2)cc1 ZINC000438917704 864396299 /nfs/dbraw/zinc/39/62/99/864396299.db2.gz MNCJIQNISYPEAP-USZFVNFHSA-N 0 3 404.554 4.243 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)Cc2cccc(OC(F)(F)F)c2)CC1 ZINC000438928877 864407946 /nfs/dbraw/zinc/40/79/46/864407946.db2.gz UIGDSRSUJJXFSE-UHFFFAOYSA-N 0 3 406.448 4.251 20 0 HIADHN Cc1ccsc1[C@H]1C[C@H]1C(=O)NCCCCN1CCN(c2cccc(C)c2)CC1 ZINC000439043522 864495677 /nfs/dbraw/zinc/49/56/77/864495677.db2.gz XEJPJIWIRNWIFD-FCHUYYIVSA-N 0 3 411.615 4.187 20 0 HIADHN Cc1ccsc1[C@@H]1C[C@H]1C(=O)NCCCCN1CCN(c2cccc(C)c2)CC1 ZINC000439043532 864496023 /nfs/dbraw/zinc/49/60/23/864496023.db2.gz XEJPJIWIRNWIFD-FGZHOGPDSA-N 0 3 411.615 4.187 20 0 HIADHN CC[C@H](NCc1cc(Br)ccc1C)c1ccccc1OCC(=O)N(C)C ZINC000439138990 864570731 /nfs/dbraw/zinc/57/07/31/864570731.db2.gz HCIRKXVNYAUXPH-IBGZPJMESA-N 0 3 419.363 4.465 20 0 HIADHN C[C@H](Cc1cccc(Br)c1)NC(=O)N(CCN(C)C)Cc1cccs1 ZINC000439164512 864595411 /nfs/dbraw/zinc/59/54/11/864595411.db2.gz BXEJFLIVPLKDHT-OAHLLOKOSA-N 0 3 424.408 4.215 20 0 HIADHN CCN(C[C@@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)c1cccc(Cl)c1C ZINC000439223846 864640560 /nfs/dbraw/zinc/64/05/60/864640560.db2.gz JDZLAOFQVWOOSS-LJQANCHMSA-N 0 3 406.979 4.181 20 0 HIADHN CCN(C[C@@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)c1ccc(F)cc1Cl ZINC000439229794 864646852 /nfs/dbraw/zinc/64/68/52/864646852.db2.gz OWXBNEPAKILKBI-QGZVFWFLSA-N 0 3 410.942 4.012 20 0 HIADHN CCN(C[C@@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)c1ccc(Cl)cc1F ZINC000439231698 864647535 /nfs/dbraw/zinc/64/75/35/864647535.db2.gz VXGDMDZQNUSMNV-QGZVFWFLSA-N 0 3 410.942 4.012 20 0 HIADHN CCN(C[C@@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)c1ccc2ccccc2c1 ZINC000439233604 864649487 /nfs/dbraw/zinc/64/94/87/864649487.db2.gz ZMKTYTYVTPDDGA-OAQYLSRUSA-N 0 3 408.567 4.373 20 0 HIADHN CCN(C[C@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)c1ccc(C)c2ncccc12 ZINC000439235597 864652055 /nfs/dbraw/zinc/65/20/55/864652055.db2.gz KEWIGHTWRCPJMD-NRFANRHFSA-N 0 3 423.582 4.076 20 0 HIADHN CCN(C[C@@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)c1cc(F)ccc1Cl ZINC000439237502 864653264 /nfs/dbraw/zinc/65/32/64/864653264.db2.gz OBFCYOLMRHXXCL-QGZVFWFLSA-N 0 3 410.942 4.012 20 0 HIADHN O=C(NC[C@H]1CCC[C@H](C(F)(F)F)C1)NCC1(N2CCSCC2)CCCC1 ZINC000439243525 864661371 /nfs/dbraw/zinc/66/13/71/864661371.db2.gz CNFMYCSYWKVRFK-HOTGVXAUSA-N 0 3 407.546 4.016 20 0 HIADHN Cc1occc1C(=O)Nc1cc(NC(=O)N(CCN(C)C)C2CCCC2)ccc1F ZINC000467919921 881790896 /nfs/dbraw/zinc/79/08/96/881790896.db2.gz MRSIAIBLRWWXKT-UHFFFAOYSA-N 0 3 416.497 4.318 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@H]2NC(=O)N(CCN(C)C)Cc2cccs2)cc1 ZINC000439501352 864855912 /nfs/dbraw/zinc/85/59/12/864855912.db2.gz DDBMSEUXJIXGDI-RTWAWAEBSA-N 0 3 401.576 4.050 20 0 HIADHN CC(C)Oc1ccc([C@@H](C)N[C@H](C)C(=O)N2CCN(c3ccc(F)cc3)CC2)cc1 ZINC000439565856 864890437 /nfs/dbraw/zinc/89/04/37/864890437.db2.gz CCMMCGMCWLHVGF-RTBURBONSA-N 0 3 413.537 4.001 20 0 HIADHN C[C@H](NCc1ccccc1CN(C)Cc1ccco1)C(=O)Nc1ccc(Cl)cn1 ZINC000439599588 864923995 /nfs/dbraw/zinc/92/39/95/864923995.db2.gz SZZJLGKIJDDPPP-INIZCTEOSA-N 0 3 412.921 4.077 20 0 HIADHN Cc1ccccc1-c1cc(C(=O)N(CCN(C)C)C(C)C)c2cnn(C(C)C)c2n1 ZINC000439609983 864932906 /nfs/dbraw/zinc/93/29/06/864932906.db2.gz DITMGEYILFBFLV-UHFFFAOYSA-N 0 3 407.562 4.400 20 0 HIADHN C[C@H](NC(=O)N(Cc1ccccc1)C1CCN(C)CC1)[C@H]1Oc2ccccc2[C@H]1C ZINC000439635062 864960966 /nfs/dbraw/zinc/96/09/66/864960966.db2.gz RODHEKDKFPVPGX-IMWIBFENSA-N 0 3 407.558 4.246 20 0 HIADHN Cc1c(F)c(C(F)(F)F)ccc1C(=O)Nc1ccc(OC2CCN(C)CC2)nc1 ZINC000467968675 881826867 /nfs/dbraw/zinc/82/68/67/881826867.db2.gz KDWHODFRHHDYIJ-UHFFFAOYSA-N 0 3 411.399 4.273 20 0 HIADHN CC(C)n1cc(Br)cc1C(=O)NC1CCN([C@@H](C)c2ccncc2)CC1 ZINC000439736657 865069071 /nfs/dbraw/zinc/06/90/71/865069071.db2.gz WGBUUVUYUYRNJC-HNNXBMFYSA-N 0 3 419.367 4.182 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)CCOc2ccc(Cl)cc2Cl)CC1 ZINC000439740384 865072044 /nfs/dbraw/zinc/07/20/44/865072044.db2.gz CFZKFCIQGMFFBC-OAHLLOKOSA-N 0 3 422.356 4.499 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)c2ccc(N(C)c3ccccc3)nc2)CC1 ZINC000439760818 865086454 /nfs/dbraw/zinc/08/64/54/865086454.db2.gz AVTCVQWCNFIZCG-IBGZPJMESA-N 0 3 415.541 4.200 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)c2ccc(N(C)c3ccccc3)nc2)CC1 ZINC000439760819 865087234 /nfs/dbraw/zinc/08/72/34/865087234.db2.gz AVTCVQWCNFIZCG-LJQANCHMSA-N 0 3 415.541 4.200 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)COc2cc(Cl)ccc2Cl)CC1 ZINC000439763689 865088177 /nfs/dbraw/zinc/08/81/77/865088177.db2.gz AVAOUXMJLUJFFS-AWEZNQCLSA-N 0 3 408.329 4.109 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)c2cccc(Oc3ccncc3)c2)CC1 ZINC000439762628 865088242 /nfs/dbraw/zinc/08/82/42/865088242.db2.gz FGGDGAKLJPPCQJ-GOSISDBHSA-N 0 3 402.498 4.224 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)COc2ccc(Cl)c(Cl)c2)CC1 ZINC000439765470 865090503 /nfs/dbraw/zinc/09/05/03/865090503.db2.gz GOUQUVABNXQGBE-AWEZNQCLSA-N 0 3 408.329 4.109 20 0 HIADHN O=C(Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)C1(Cc2ccccc2F)CC1 ZINC000467986743 881834918 /nfs/dbraw/zinc/83/49/18/881834918.db2.gz YQLZZGGKCVICNA-NRFANRHFSA-N 0 3 418.516 4.431 20 0 HIADHN C[C@@H](CSc1ccc(F)cc1)C(=O)NC1CCN([C@H](C)c2ccncc2)CC1 ZINC000439776995 865101296 /nfs/dbraw/zinc/10/12/96/865101296.db2.gz ZAZDUCAJEQFMHP-DLBZAZTESA-N 0 3 401.551 4.291 20 0 HIADHN Cc1nn(-c2ccc(Br)cc2)cc1CN1CCC([C@@H]2CCCO2)CC1 ZINC000439781925 865104244 /nfs/dbraw/zinc/10/42/44/865104244.db2.gz NRGYSPYXWQYSRC-FQEVSTJZSA-N 0 3 404.352 4.334 20 0 HIADHN Cc1ccc(-c2ccnn2C)cc1NC(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C ZINC000439947334 865242337 /nfs/dbraw/zinc/24/23/37/865242337.db2.gz DNMZKMZFJSRXOV-GCJKJVERSA-N 0 3 403.530 4.038 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3cc(Cl)c(Cl)cc3F)CC2)C[C@H](C)O1 ZINC000439967186 865258968 /nfs/dbraw/zinc/25/89/68/865258968.db2.gz WIZSUEMBEUGWBT-BETUJISGSA-N 0 3 418.340 4.486 20 0 HIADHN COc1ccc2c(c1)[C@@H](N[C@H](C)CC(=O)Nc1cc(Cl)ccc1OC)CCO2 ZINC000468025600 881859812 /nfs/dbraw/zinc/85/98/12/881859812.db2.gz JLMOFNIEDOCVLW-DYVFJYSZSA-N 0 3 404.894 4.188 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)NCc2cccc(-c3ccccn3)c2)C1 ZINC000440071980 865338984 /nfs/dbraw/zinc/33/89/84/865338984.db2.gz CHZYCLOXZGYLQQ-CVDCTZTESA-N 0 3 400.526 4.383 20 0 HIADHN CC(C)N(CCN(C)C)C(=O)N[C@@H]1c2cc(Br)ccc2SC[C@H]1C ZINC000440223654 865459292 /nfs/dbraw/zinc/45/92/92/865459292.db2.gz CRKUIXXHGIQZAK-DYVFJYSZSA-N 0 3 414.413 4.214 20 0 HIADHN CC(C)C1CCC(N2CCN(C(=O)Nc3ccc4c(c3)CCCC(=O)N4)CC2)CC1 ZINC000440389212 865683186 /nfs/dbraw/zinc/68/31/86/865683186.db2.gz QBXTYTUKQOOGNM-UHFFFAOYSA-N 0 3 412.578 4.326 20 0 HIADHN Cc1ccc(/C=C\CC(=O)Nc2ccc(C(=O)N(C)[C@H]3CCCN(C)C3)cc2)cc1 ZINC000440566776 865821080 /nfs/dbraw/zinc/82/10/80/865821080.db2.gz SDOIXDMLLYDCGN-IUIUGSMNSA-N 0 3 405.542 4.203 20 0 HIADHN C[C@@H](N[C@H]1CC(C)(C)CCc2ccccc21)C(=O)Nc1ccccc1S(C)(=O)=O ZINC000440610521 865837101 /nfs/dbraw/zinc/83/71/01/865837101.db2.gz HFQRBOJWNOXQAH-UZLBHIALSA-N 0 3 414.571 4.111 20 0 HIADHN CC(C)n1c2ccccc2nc1[C@@H]1CCCN(C[C@@H](O)COc2ccccc2F)C1 ZINC000440655020 865857983 /nfs/dbraw/zinc/85/79/83/865857983.db2.gz OIZBFGDZWNKZKQ-RTBURBONSA-N 0 3 411.521 4.376 20 0 HIADHN Cc1nc(-c2ccc(C(=O)NCC3(N4CCSCC4)CCCC3)cc2)cs1 ZINC000440744418 865885105 /nfs/dbraw/zinc/88/51/05/865885105.db2.gz CNKYLIQQBNQCEL-UHFFFAOYSA-N 0 3 401.601 4.210 20 0 HIADHN Cc1ccccc1-c1cc(C(=O)N[C@@H]2C[C@@H](C)N(C3CC3)C2)c2cnn(C(C)C)c2n1 ZINC000440913899 866009681 /nfs/dbraw/zinc/00/96/81/866009681.db2.gz MHOXIOKDWKXJMI-QZTJIDSGSA-N 0 3 417.557 4.343 20 0 HIADHN O=C(CCN1CCN(c2ccccc2)CC1)Nc1cccc(CCC(F)(F)F)c1 ZINC000440916272 866012535 /nfs/dbraw/zinc/01/25/35/866012535.db2.gz RRHSXIMTZNCXBS-UHFFFAOYSA-N 0 3 405.464 4.332 20 0 HIADHN CC(C)n1ncc2c1nc(-c1ccccc1)cc2C(=O)N[C@H]1C[C@@H](C)N(C2CC2)C1 ZINC000440916732 866012648 /nfs/dbraw/zinc/01/26/48/866012648.db2.gz YMJULXRHDBCQFU-AEFFLSMTSA-N 0 3 403.530 4.034 20 0 HIADHN Cc1noc(C)c1COc1cc2ccccc2cc1C(=O)N[C@@H]1C[C@H](C)N(C2CC2)C1 ZINC000440916298 866012973 /nfs/dbraw/zinc/01/29/73/866012973.db2.gz RSZLNUNADYQWQA-MGPUTAFESA-N 0 3 419.525 4.379 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)c2ccccc2-c2nc(-c3cccc(Cl)c3)no2)CN1C1CC1 ZINC000440928342 866024546 /nfs/dbraw/zinc/02/45/46/866024546.db2.gz XYBJOVHTCJFVIR-WMLDXEAASA-N 0 3 422.916 4.412 20 0 HIADHN Cc1ccccc1NC(=O)CCN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1 ZINC000440932385 866029943 /nfs/dbraw/zinc/02/99/43/866029943.db2.gz YZYCBCODJXNALG-HSZRJFAPSA-N 0 3 415.537 4.371 20 0 HIADHN COc1cc(-c2nnc(CN3C[C@@H](c4ccccc4)C(C)(C)C3)o2)cc(OC)c1OC ZINC000441072802 866162909 /nfs/dbraw/zinc/16/29/09/866162909.db2.gz JVWBJUQZASYMHB-SFHVURJKSA-N 0 3 423.513 4.388 20 0 HIADHN FC(F)(F)c1csc([C@@H]2CCCN(CCOCCOc3ccccc3)C2)n1 ZINC000441072854 866162973 /nfs/dbraw/zinc/16/29/73/866162973.db2.gz YUQULOAVYPDKCN-OAHLLOKOSA-N 0 3 400.466 4.437 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N[C@H](C)c3ccccc3C(F)(F)F)cc2)CC1 ZINC000468118272 881948413 /nfs/dbraw/zinc/94/84/13/881948413.db2.gz WYUGBVNJZLKMSS-MRXNPFEDSA-N 0 3 405.464 4.338 20 0 HIADHN Cc1cc(CN(C)C(=O)N[C@H]2C[C@H](C)N(C3CC3)C2)cc(C)c1OCC(F)(F)F ZINC000441280249 866355123 /nfs/dbraw/zinc/35/51/23/866355123.db2.gz CFJNJFLQWWVLGY-RDJZCZTQSA-N 0 3 413.484 4.011 20 0 HIADHN C[C@H](C(=O)Nc1ccc(OCc2ccccc2)cc1)N1CCC[C@H]([C@@H]2CCOC2)C1 ZINC000441284517 866358304 /nfs/dbraw/zinc/35/83/04/866358304.db2.gz XQVXNMRVHKIJTM-BAGYTPMASA-N 0 3 408.542 4.341 20 0 HIADHN Cn1ccnc1CC1CCN(Cc2ncc(-c3ccc(Br)cc3)o2)CC1 ZINC000441310138 866380273 /nfs/dbraw/zinc/38/02/73/866380273.db2.gz JNXCDLNETRZCNI-UHFFFAOYSA-N 0 3 415.335 4.292 20 0 HIADHN Cc1ccc([C@H]2CCC[C@H]2N(C)CC(=O)Nc2cccc(N3CCCC3=O)c2)cc1 ZINC000441338355 866408976 /nfs/dbraw/zinc/40/89/76/866408976.db2.gz CYIZNQATANWZGW-DHIUTWEWSA-N 0 3 405.542 4.328 20 0 HIADHN Cc1ccc([C@@H]2CCC[C@@H]2N(C)CC(=O)NC[C@H]2CCN(c3ccccc3)C2)cc1 ZINC000441339845 866410445 /nfs/dbraw/zinc/41/04/45/866410445.db2.gz IYMIJKYRORAVKE-ZODMCCGTSA-N 0 3 405.586 4.206 20 0 HIADHN CC[C@@H](Cc1ccc(C)cc1)N(CC)CC(=O)Nc1ccc(CN2CCOCC2)cc1 ZINC000441348321 866417682 /nfs/dbraw/zinc/41/76/82/866417682.db2.gz BYKNOEQFLAWNPS-VWLOTQADSA-N 0 3 423.601 4.109 20 0 HIADHN CC[C@@H](Cc1ccc(C)cc1)N(C)CC(=O)NCC1(c2ccccc2)CCOCC1 ZINC000441354816 866425540 /nfs/dbraw/zinc/42/55/40/866425540.db2.gz ISKUBPKARITOTE-DEOSSOPVSA-N 0 3 408.586 4.113 20 0 HIADHN Cc1c(C(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)cnn1CCC(C)C ZINC000441455055 866529402 /nfs/dbraw/zinc/52/94/02/866529402.db2.gz VCINYNAWEMUVTK-OAQYLSRUSA-N 0 3 420.561 4.133 20 0 HIADHN COc1ccc([C@@H]2CCN([C@@H]3CCCN(c4ccc(OC(F)F)cc4)C3=O)C2)cc1 ZINC000441529756 866605370 /nfs/dbraw/zinc/60/53/70/866605370.db2.gz AYWZBUZSFLNYSI-DYESRHJHSA-N 0 3 416.468 4.282 20 0 HIADHN C[C@H](C(=O)Nc1cccc(CSc2ccccn2)c1)N1CC[C@H]([C@H]2CCOC2)C1 ZINC000441661249 866779346 /nfs/dbraw/zinc/77/93/46/866779346.db2.gz JUQWKTUPFAYDKM-HOJAQTOUSA-N 0 3 411.571 4.059 20 0 HIADHN Cc1cccc(COc2ccc(NC(=O)NCCN3CCN(C)C(C)(C)C3)c(C)c2)c1 ZINC000441675130 866800143 /nfs/dbraw/zinc/80/01/43/866800143.db2.gz YUBGKBSLMCPWDB-UHFFFAOYSA-N 0 3 424.589 4.030 20 0 HIADHN C[C@@H](NC(=O)C(=O)Nc1cccc(-c2cccs2)c1)[C@@H](c1ccccc1)N(C)C ZINC000441682677 866803409 /nfs/dbraw/zinc/80/34/09/866803409.db2.gz BIFGACXQXYRRSU-IERDGZPVSA-N 0 3 407.539 4.161 20 0 HIADHN Cc1c(Cl)cc(NC(=O)C(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)cc1Cl ZINC000441707520 866814773 /nfs/dbraw/zinc/81/47/73/866814773.db2.gz MFOYTPZYBWFXRP-FZKQIMNGSA-N 0 3 408.329 4.048 20 0 HIADHN Cc1cc(Cl)c(NC(=O)C(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)cc1Cl ZINC000441706476 866814843 /nfs/dbraw/zinc/81/48/43/866814843.db2.gz XHXMPDLCHZWISK-SCLBCKFNSA-N 0 3 408.329 4.048 20 0 HIADHN CC(C)Sc1c(Cl)cccc1NC(=O)C(=O)NC[C@H](C)N1CCCC[C@H]1C ZINC000441767850 866844656 /nfs/dbraw/zinc/84/46/56/866844656.db2.gz SXYSOZBMXNTBKR-CABCVRRESA-N 0 3 411.999 4.158 20 0 HIADHN CCC[C@H]1CCc2nc(NC(=O)N(CCN(C)C)Cc3ccccn3)sc2C1 ZINC000441924658 866988868 /nfs/dbraw/zinc/98/88/68/866988868.db2.gz FMAOHPFXPBBXSL-INIZCTEOSA-N 0 3 401.580 4.039 20 0 HIADHN CCC[C@H]1CCc2nc(NC(=O)NC3CCN(CCOC(C)C)CC3)sc2C1 ZINC000441966723 867030325 /nfs/dbraw/zinc/03/03/25/867030325.db2.gz PQCCJJFFQFSUSU-INIZCTEOSA-N 0 3 408.612 4.059 20 0 HIADHN Cc1nc(-c2ccc(C(=O)N3CCC(CN4C[C@H](C)O[C@@H](C)C4)CC3)cc2)cs1 ZINC000442019428 867069796 /nfs/dbraw/zinc/06/97/96/867069796.db2.gz OVMWRDVENMJKDJ-IRXDYDNUSA-N 0 3 413.587 4.080 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)CC(C)(C)CC(=O)c3ccccc3)CC2)C[C@@H](C)O1 ZINC000442024239 867071768 /nfs/dbraw/zinc/07/17/68/867071768.db2.gz XZEBMYLPIDHXEY-WOJBJXKFSA-N 0 3 414.590 4.024 20 0 HIADHN CCN1CCCN(C(=O)N[C@@H]2CCCc3sc(-c4ccc(F)cc4)nc32)CC1 ZINC000468168580 882046212 /nfs/dbraw/zinc/04/62/12/882046212.db2.gz LMACNUCAOVCJMV-QGZVFWFLSA-N 0 3 402.539 4.064 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N[C@@H](CC(C)C)c3nc4ccccc4[nH]3)cc2)CC1 ZINC000468178766 882056159 /nfs/dbraw/zinc/05/61/59/882056159.db2.gz PJIOVZLMOHLQPX-QHCPKHFHSA-N 0 3 419.573 4.222 20 0 HIADHN Cc1ccc([C@H](Cn2ccnc2)NC(=O)c2ccc(Nc3ccncc3)cc2)c(C)c1 ZINC000442185536 867208351 /nfs/dbraw/zinc/20/83/51/867208351.db2.gz FNVJZURPJKTHQF-DEOSSOPVSA-N 0 3 411.509 4.232 20 0 HIADHN COc1ccc([C@H](CNC(=O)Nc2cnn(CCC(C)C)c2C)N2CCCC2)cc1 ZINC000442231244 867264184 /nfs/dbraw/zinc/26/41/84/867264184.db2.gz UDGXXZMMPRCSND-QFIPXVFZSA-N 0 3 413.566 4.205 20 0 HIADHN Cc1cc(SC2CCCCC2)ccc1NC(=O)C(=O)N[C@H](C)C1=CCN(C)CC1 ZINC000442341464 867335996 /nfs/dbraw/zinc/33/59/96/867335996.db2.gz OQYKYAHIOSARAG-QGZVFWFLSA-N 0 3 415.603 4.125 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cnn2c1CCCC2)c1ccc(C(F)(F)F)cc1 ZINC000442363480 867350163 /nfs/dbraw/zinc/35/01/63/867350163.db2.gz YKCBLFNANLNIHF-LJQANCHMSA-N 0 3 408.468 4.051 20 0 HIADHN COCCC[C@H](NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)nc1)c1ccc(F)cc1 ZINC000442710194 867639634 /nfs/dbraw/zinc/63/96/34/867639634.db2.gz BXYBEFWUBJOTBI-HMFYCAOWSA-N 0 3 401.526 4.092 20 0 HIADHN Cc1c2cc(Cl)ccc2sc1CNC(=O)N1CCN(CC2CCOCC2)CC1 ZINC000442730936 867653171 /nfs/dbraw/zinc/65/31/71/867653171.db2.gz RNKCTSONVOWGDO-UHFFFAOYSA-N 0 3 421.994 4.117 20 0 HIADHN COCCC[C@H](NCc1cccc(NC(=O)[C@H]2CCCO2)c1)c1ccc(F)cc1 ZINC000442789427 867675119 /nfs/dbraw/zinc/67/51/19/867675119.db2.gz GVNDQRFSXGACEM-FCHUYYIVSA-N 0 3 400.494 4.201 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1ccncc1Oc1ccccc1 ZINC000442819960 867686585 /nfs/dbraw/zinc/68/65/85/867686585.db2.gz JLSFSOIFWYVXKH-UHFFFAOYSA-N 0 3 419.447 4.409 20 0 HIADHN CN1CCN(CCNC(=O)c2cc(Cl)ccc2Oc2ccc(F)cc2)CC1(C)C ZINC000442967280 867769183 /nfs/dbraw/zinc/76/91/83/867769183.db2.gz PMHZMAZYNPIYFC-UHFFFAOYSA-N 0 3 419.928 4.027 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc(CNCc2ccc(C(F)(F)F)cc2C)cc1 ZINC000443006929 867791679 /nfs/dbraw/zinc/79/16/79/867791679.db2.gz ZBKUMQOCKUTJGX-UHFFFAOYSA-N 0 3 414.493 4.334 20 0 HIADHN COc1ccc2c(c1)CCC[C@H]2CNC(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000468229992 882120296 /nfs/dbraw/zinc/12/02/96/882120296.db2.gz JRIOKMJAOARPBL-QFIPXVFZSA-N 0 3 421.585 4.421 20 0 HIADHN C[C@H](c1nc(-c2ccc(N(C)C(=O)c3ccncc3)cc2)no1)N1[C@H](C)CC[C@H]1C ZINC000443201839 867873283 /nfs/dbraw/zinc/87/32/83/867873283.db2.gz JGMNDRXUNRGZPD-BRWVUGGUSA-N 0 3 405.502 4.342 20 0 HIADHN CN(C)CCN(C)C(=O)c1ccccc1SCc1ccc(Br)cc1 ZINC000443227061 867881812 /nfs/dbraw/zinc/88/18/12/867881812.db2.gz OSYCOVNMDIZCBK-UHFFFAOYSA-N 0 3 407.377 4.375 20 0 HIADHN C[C@@H](C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1)c1cccc(Cl)c1 ZINC000443345486 867916683 /nfs/dbraw/zinc/91/66/83/867916683.db2.gz RLJOIDNAASTCIL-MRXNPFEDSA-N 0 3 404.913 4.242 20 0 HIADHN O=C(C/C=C\c1ccccc1F)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000443355506 867921706 /nfs/dbraw/zinc/92/17/06/867921706.db2.gz WEUGXESITGVHHZ-HYXAFXHYSA-N 0 3 400.469 4.028 20 0 HIADHN O=C(Cc1ccccc1C(F)(F)F)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000443356110 867923497 /nfs/dbraw/zinc/92/34/97/867923497.db2.gz XDEQEQYNQWARJC-UHFFFAOYSA-N 0 3 424.438 4.047 20 0 HIADHN CC1CCN([C@H](CNC(=O)c2ccc(O[C@@H]3CCOC3)cc2)c2cccs2)CC1 ZINC000468246779 882149057 /nfs/dbraw/zinc/14/90/57/882149057.db2.gz KIGBSVXXDCXWLW-NHCUHLMSSA-N 0 3 414.571 4.119 20 0 HIADHN CCN1CCC[C@@H](CN(C)C(=O)NCC[C@@H](C)CC(C)(C)C)[C@@H]1c1cnn(C)c1 ZINC000443550127 868107103 /nfs/dbraw/zinc/10/71/03/868107103.db2.gz IGBOACNJOMPLSO-SVFBPWRDSA-N 0 3 405.631 4.297 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)Cc3cccc(C(F)F)c3)CC2)c1 ZINC000468252421 882161867 /nfs/dbraw/zinc/16/18/67/882161867.db2.gz UKUOSZFZRWHXKR-UHFFFAOYSA-N 0 3 415.528 4.194 20 0 HIADHN CCCCNC(=O)[C@H]1CCCN(Cc2cc(C)nc(-c3ccc(Cl)cc3)n2)C1 ZINC000443635133 868215237 /nfs/dbraw/zinc/21/52/37/868215237.db2.gz VFPSHBHTAHJUAE-SFHVURJKSA-N 0 3 400.954 4.234 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)CCc2ccc(-c3ccccc3F)o2)C[C@H](C)O1 ZINC000443651005 868244158 /nfs/dbraw/zinc/24/41/58/868244158.db2.gz IRJNIRDBEIGBHN-HDICACEKSA-N 0 3 402.510 4.024 20 0 HIADHN C[C@H]1CCN(CC(=O)N(Cc2nnc(-c3ccccc3Cl)o2)C2CC2)C[C@H](C)C1 ZINC000443655002 868252593 /nfs/dbraw/zinc/25/25/93/868252593.db2.gz NMPJSIDFYCASKQ-JKSUJKDBSA-N 0 3 416.953 4.249 20 0 HIADHN C[C@H]1CN(CCCCNC(=O)c2ccc(Oc3ccncc3)c(Cl)c2)C[C@H](C)O1 ZINC000443665078 868271835 /nfs/dbraw/zinc/27/18/35/868271835.db2.gz GTZORLBPCITGFO-IRXDYDNUSA-N 0 3 417.937 4.147 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)c2ccc(Oc3ccncc3)c(Cl)c2)C[C@@H](C)O1 ZINC000443665077 868272291 /nfs/dbraw/zinc/27/22/91/868272291.db2.gz GTZORLBPCITGFO-IAGOWNOFSA-N 0 3 417.937 4.147 20 0 HIADHN CC[C@@H](C(=O)NCCCCN1C[C@@H](C)O[C@@H](C)C1)c1cccc(C(F)(F)F)c1 ZINC000443675867 868282180 /nfs/dbraw/zinc/28/21/80/868282180.db2.gz OSMBJLAVXJDKBE-JTDSTZFVSA-N 0 3 400.485 4.205 20 0 HIADHN CN1CCN(c2ncccc2CNc2ccnc3cc(C(F)(F)F)ccc32)CC1 ZINC000443675435 868283464 /nfs/dbraw/zinc/28/34/64/868283464.db2.gz PNJMOTOSEQSZSO-UHFFFAOYSA-N 0 3 401.436 4.013 20 0 HIADHN C[C@H](CC(=O)NCCCCN1C[C@@H](C)O[C@@H](C)C1)c1ccccc1C(F)(F)F ZINC000443677758 868284251 /nfs/dbraw/zinc/28/42/51/868284251.db2.gz UGWCISGTUQBXFJ-ZACQAIPSSA-N 0 3 400.485 4.205 20 0 HIADHN Cc1ccccc1[C@H]([C@H](C)NC(=O)C(=O)Nc1ccc(C(F)(F)F)c(C)c1)N(C)C ZINC000443846511 868375922 /nfs/dbraw/zinc/37/59/22/868375922.db2.gz WAOSFULIRHOHPU-KXBFYZLASA-N 0 3 421.463 4.068 20 0 HIADHN Cc1ccccc1[C@@H]([C@@H](C)NC(=O)C(=O)Nc1ccccc1OC1CCCC1)N(C)C ZINC000443846610 868378018 /nfs/dbraw/zinc/37/80/18/868378018.db2.gz ZXJJXCFVKYSKDS-WZONZLPQSA-N 0 3 423.557 4.063 20 0 HIADHN CC(C)CN(CCN(C)C)C(=O)Nc1ccccc1CN(C)C(=O)c1cccs1 ZINC000443902994 868439631 /nfs/dbraw/zinc/43/96/31/868439631.db2.gz CGHJVIIIZXISSN-UHFFFAOYSA-N 0 3 416.591 4.072 20 0 HIADHN OC[C@H](CNCc1cnc(C(F)(F)F)s1)Cc1cccc(OC(F)(F)F)c1 ZINC000443983877 868509262 /nfs/dbraw/zinc/50/92/62/868509262.db2.gz GJQMQNMSBDVPIO-NSHDSACASA-N 0 3 414.371 4.001 20 0 HIADHN CCNC(=O)COc1cccc(CNCc2ccc(Oc3cccc(F)c3)cc2)c1 ZINC000443986346 868511125 /nfs/dbraw/zinc/51/11/25/868511125.db2.gz WANIADMZIOSPSX-UHFFFAOYSA-N 0 3 408.473 4.423 20 0 HIADHN COc1ccc(CN[C@H]2CCN(c3ccccc3OC)C2)c(OCc2cccnc2)c1 ZINC000443999154 868520006 /nfs/dbraw/zinc/52/00/06/868520006.db2.gz BKFNOXAOMCHJRP-NRFANRHFSA-N 0 3 419.525 4.046 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)N[C@@H](CC(F)(F)F)c3ccc(C(F)(F)F)cc3)[C@@H]2C1 ZINC000444021301 868548645 /nfs/dbraw/zinc/54/86/45/868548645.db2.gz DWWRWGJFAAQKNY-VNQPRFMTSA-N 0 3 423.401 4.435 20 0 HIADHN CCN(CC(F)(F)F)C(=O)[C@@H]1CCCN(Cc2ccccc2Oc2cccnc2)C1 ZINC000444162478 868644661 /nfs/dbraw/zinc/64/46/61/868644661.db2.gz ATSHSHXSVPGLMI-GOSISDBHSA-N 0 3 421.463 4.497 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)C2(Cc3ccc(C(F)(F)F)cc3)CC2)C[C@H](C)O1 ZINC000444180382 868652228 /nfs/dbraw/zinc/65/22/28/868652228.db2.gz GKKXPFXLBKPMAE-CALCHBBNSA-N 0 3 412.496 4.034 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)NC(=O)NC[C@@H](c2cccs2)N2CCCC2)cc1 ZINC000444337984 868764629 /nfs/dbraw/zinc/76/46/29/868764629.db2.gz MYVNNTCTDGJELY-UTKZUKDTSA-N 0 3 423.586 4.440 20 0 HIADHN Cc1ccc(C(N)=O)cc1NC(=O)N1CCN(Cc2ccccc2)C2(CCCCC2)C1 ZINC000444390163 868804658 /nfs/dbraw/zinc/80/46/58/868804658.db2.gz SUGOGIRPQFXOSE-UHFFFAOYSA-N 0 3 420.557 4.147 20 0 HIADHN O=C(CCc1cc(Br)cs1)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000444454393 868834568 /nfs/dbraw/zinc/83/45/68/868834568.db2.gz NLGFKEAQHGROMS-UHFFFAOYSA-N 0 3 423.376 4.039 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)cc1C(=O)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000444456225 868834826 /nfs/dbraw/zinc/83/48/26/868834826.db2.gz WIMMDDCXYZDBPD-UHFFFAOYSA-N 0 3 424.932 4.043 20 0 HIADHN Cc1ccc(C(C)C)cc1O[C@@H](C)C(=O)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000444460011 868836549 /nfs/dbraw/zinc/83/65/49/868836549.db2.gz IVXLOXJEYKTLPZ-IBGZPJMESA-N 0 3 410.558 4.481 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)c1cc(-c2cccc(Cl)c2)on1 ZINC000444460326 868836865 /nfs/dbraw/zinc/83/68/65/868836865.db2.gz JGKGLUXUFSEJRU-UHFFFAOYSA-N 0 3 411.889 4.204 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1cc(-c2ccccc2Cl)[nH]n1 ZINC000444548793 868877856 /nfs/dbraw/zinc/87/78/56/868877856.db2.gz KULYJCNSUSPFBR-UHFFFAOYSA-N 0 3 424.932 4.187 20 0 HIADHN CCc1ccccc1CCN1CCN(CCCc2nc(-c3cccs3)no2)CC1 ZINC000444595064 868895608 /nfs/dbraw/zinc/89/56/08/868895608.db2.gz UJNPJCULILABHE-UHFFFAOYSA-N 0 3 410.587 4.153 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)NC(=O)N(Cc2ccco2)C2CCN(C)CC2)cc1 ZINC000444598562 868896941 /nfs/dbraw/zinc/89/69/41/868896941.db2.gz RPAWHACTXTUQBA-GOSISDBHSA-N 0 3 421.545 4.141 20 0 HIADHN C[C@H](NCCO[C@H]1CCCCO1)c1cccc(NC(=O)Cc2ccccc2F)c1 ZINC000444689951 868960159 /nfs/dbraw/zinc/96/01/59/868960159.db2.gz PTHIQALNRLZEEX-SBUREZEXSA-N 0 3 400.494 4.201 20 0 HIADHN O[C@@H](COc1ccc(Cl)cc1Br)CN1CC[C@@H](CC(F)(F)F)C1 ZINC000444689429 868960283 /nfs/dbraw/zinc/96/02/83/868960283.db2.gz FVBIKBZJBMVYGV-CMPLNLGQSA-N 0 3 416.665 4.117 20 0 HIADHN Cc1nn(C)cc1[C@@H](C)NC(=O)N1CCN(Cc2ccccc2)C2(CCCCC2)C1 ZINC000444706548 868966743 /nfs/dbraw/zinc/96/67/43/868966743.db2.gz NILYHSWBBGFTBB-LJQANCHMSA-N 0 3 409.578 4.020 20 0 HIADHN Cc1nccn1CCCCNC(=O)N1CCN(Cc2ccccc2)C2(CCCCC2)C1 ZINC000444708489 868968558 /nfs/dbraw/zinc/96/85/58/868968558.db2.gz RHNOTJFPIUISTF-UHFFFAOYSA-N 0 3 423.605 4.202 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)N([C@H](C)c2ccc3ccccc3c2)C2CC2)CC1 ZINC000444717863 868973699 /nfs/dbraw/zinc/97/36/99/868973699.db2.gz TZRPYXDEZSLNBE-NHCUHLMSSA-N 0 3 422.617 4.348 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)NCc1cccc(-c2cccnc2)c1 ZINC000468318657 882247662 /nfs/dbraw/zinc/24/76/62/882247662.db2.gz LAJFCRJVRWIHMG-UHFFFAOYSA-N 0 3 406.505 4.161 20 0 HIADHN Cc1cccc(S(=O)(=O)CCCN[C@@H](C)c2ccc(Br)s2)c1 ZINC000444754423 868987203 /nfs/dbraw/zinc/98/72/03/868987203.db2.gz BBBWLAOETLYNPT-ZDUSSCGKSA-N 0 3 402.379 4.334 20 0 HIADHN Cc1nc2ccc(Br)cc2c(N2CCC3(CCN(C)C3=O)CC2)c1C ZINC000444867576 869066617 /nfs/dbraw/zinc/06/66/17/869066617.db2.gz FKTQAJKZOKEPFE-UHFFFAOYSA-N 0 3 402.336 4.063 20 0 HIADHN CC1CCN([C@@H](CNC(=O)N(C)Cc2cc(C(C)(C)C)n[nH]2)c2cccs2)CC1 ZINC000444886951 869077595 /nfs/dbraw/zinc/07/75/95/869077595.db2.gz MAQPFQIJAWZQMG-SFHVURJKSA-N 0 3 417.623 4.383 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)[C@H]2C[C@H]2c2cc(F)c(F)c(F)c2)cc1 ZINC000468341530 882276767 /nfs/dbraw/zinc/27/67/67/882276767.db2.gz VEGRYRNZXLSKDD-WFXMLNOXSA-N 0 3 418.459 4.169 20 0 HIADHN COC(=O)c1cn(C2CCN([C@H](C)c3ccc(Oc4ccccc4)cc3)CC2)nn1 ZINC000445488179 869558020 /nfs/dbraw/zinc/55/80/20/869558020.db2.gz CMJCQKSEZCUTLS-QGZVFWFLSA-N 0 3 406.486 4.255 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)CCC(=O)c3ccc(F)c(F)c3)c(C)c2)CC1 ZINC000445644611 869716018 /nfs/dbraw/zinc/71/60/18/869716018.db2.gz IFABYXLZDDTETN-UHFFFAOYSA-N 0 3 415.484 4.017 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3ncc(Cc4ccccc4)s3)cc2)CC1 ZINC000468385182 882330951 /nfs/dbraw/zinc/33/09/51/882330951.db2.gz UTEFYAKABFMUQM-UHFFFAOYSA-N 0 3 406.555 4.128 20 0 HIADHN Cc1ccc(Oc2ccc(Cl)cc2NC(=O)CN[C@H]2CCCC[C@H]2C(N)=O)cc1 ZINC000445766785 869810960 /nfs/dbraw/zinc/81/09/60/869810960.db2.gz MECOMKRCCFXHGN-MSOLQXFVSA-N 0 3 415.921 4.013 20 0 HIADHN COc1cc(C)ccc1Oc1ccc(N2C(=O)NC(CC(F)(F)F)C2=O)cc1F ZINC000445950177 869913653 /nfs/dbraw/zinc/91/36/53/869913653.db2.gz UXMKWNJLWQMSQE-CYBMUJFWSA-N 0 3 412.339 4.312 20 0 HIADHN O=C(NC[C@@H]1CCCN(Cc2cccs2)C1)c1cnc(Cc2ccccc2)s1 ZINC000446141091 870084390 /nfs/dbraw/zinc/08/43/90/870084390.db2.gz XFNHIAGLSYKYFV-SFHVURJKSA-N 0 3 411.596 4.437 20 0 HIADHN Cc1c2cc(C)ccc2sc1C(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1CO ZINC000446224211 870161410 /nfs/dbraw/zinc/16/14/10/870161410.db2.gz FEGRDQHXGJDSSO-PZJWPPBQSA-N 0 3 408.567 4.131 20 0 HIADHN CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)N[C@@H]1CC[C@H](Cc2ccccc2)C1 ZINC000446638735 870547362 /nfs/dbraw/zinc/54/73/62/870547362.db2.gz PFHYKKZUWIQDAJ-ONTLXTELSA-N 0 3 406.574 4.127 20 0 HIADHN COc1ccc([C@@H](CCn2cncn2)NCc2ccc(Br)s2)cc1 ZINC000446754727 870665764 /nfs/dbraw/zinc/66/57/64/870665764.db2.gz XRMAVWGNPCTZIZ-MRXNPFEDSA-N 0 3 407.337 4.032 20 0 HIADHN C[C@@H](NCc1ccccc1OCC(=O)NC[C@@H]1CCCO1)c1cc2ccccc2s1 ZINC000446757271 870668643 /nfs/dbraw/zinc/66/86/43/870668643.db2.gz SPBHGEJHFRLSLV-XLIONFOSSA-N 0 3 424.566 4.426 20 0 HIADHN COc1ccc([C@H](CCn2cncn2)NCc2ccnc(OC3CCCCC3)c2)cc1 ZINC000446838384 870756856 /nfs/dbraw/zinc/75/68/56/870756856.db2.gz HUCIEBIRGIERPR-QHCPKHFHSA-N 0 3 421.545 4.314 20 0 HIADHN Cc1nn(C)c2ncc(CNC3(c4cccc(C(F)(F)F)c4)CCOCC3)cc12 ZINC000446846845 870764938 /nfs/dbraw/zinc/76/49/38/870764938.db2.gz FMJSEPABMVPBIX-UHFFFAOYSA-N 0 3 404.436 4.091 20 0 HIADHN Cc1ccc(CN[C@@H](C)CC(=O)Nc2ccc(C(C)C)cc2)cc1S(C)(=O)=O ZINC000446894064 870812905 /nfs/dbraw/zinc/81/29/05/870812905.db2.gz KEQDCZBTIAPPJM-KRWDZBQOSA-N 0 3 402.560 4.029 20 0 HIADHN C[C@H](CC(=O)Nc1ccc(Br)cc1)NCc1ccc2c(n1)CCCC2 ZINC000446902456 870821416 /nfs/dbraw/zinc/82/14/16/870821416.db2.gz NCEFKZQFUKSOFL-CQSZACIVSA-N 0 3 402.336 4.230 20 0 HIADHN COC(=O)[C@](C)(CN[C@H](C)C(=O)Nc1c(C)cccc1C(C)C)c1ccc(F)cc1 ZINC000447024399 870900313 /nfs/dbraw/zinc/90/03/13/870900313.db2.gz WUXVRCJMHZHEIN-MZNJEOGPSA-N 0 3 414.521 4.305 20 0 HIADHN Cc1ccc(NC(=O)N(CCN(C)C)Cc2ccco2)c(-c2nc(C3CC3)no2)c1 ZINC000447048855 870926282 /nfs/dbraw/zinc/92/62/82/870926282.db2.gz QZLSGBNYLGODHC-UHFFFAOYSA-N 0 3 409.490 4.111 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1cccc(NC(=O)C2CCCCC2)c1 ZINC000447056090 870936193 /nfs/dbraw/zinc/93/61/93/870936193.db2.gz XQXGYQIBFRYAFO-UHFFFAOYSA-N 0 3 412.534 4.394 20 0 HIADHN COc1ccc(Oc2ccc(NC(=O)N(CCN(C)C)Cc3ccco3)cn2)cc1 ZINC000447074687 870956031 /nfs/dbraw/zinc/95/60/31/870956031.db2.gz HPAQLZANFPNGAT-UHFFFAOYSA-N 0 3 410.474 4.071 20 0 HIADHN Brc1ccc(-n2cc(CNCc3cc(-n4ccnc4)cs3)cn2)cc1 ZINC000447076379 870960144 /nfs/dbraw/zinc/96/01/44/870960144.db2.gz HPZHYDNYYPFRLI-UHFFFAOYSA-N 0 3 414.332 4.172 20 0 HIADHN C[C@H]1CCN(C(=O)Nc2cnn(-c3ccccc3F)c2)CCN1Cc1ccccc1 ZINC000447185941 871077984 /nfs/dbraw/zinc/07/79/84/871077984.db2.gz TUZNCCBUEKCZFP-SFHVURJKSA-N 0 3 407.493 4.140 20 0 HIADHN Cc1ccc([C@H](C)NC(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)cc1F ZINC000447224794 871109626 /nfs/dbraw/zinc/10/96/26/871109626.db2.gz YGCORLOBRDLVPM-FHWLQOOXSA-N 0 3 405.558 4.116 20 0 HIADHN C[C@@H](NC(=O)N(CCN(C)C)Cc1ccco1)c1ccc(OCC(F)(F)F)cc1 ZINC000447337127 871230766 /nfs/dbraw/zinc/23/07/66/871230766.db2.gz CGPIAHQWICHGBX-OAHLLOKOSA-N 0 3 413.440 4.055 20 0 HIADHN CS(=O)(=O)c1ccc(OCCCN[C@H](c2ccccc2)c2cccc(F)c2)cc1 ZINC000447339529 871234563 /nfs/dbraw/zinc/23/45/63/871234563.db2.gz GOGITVPYDCWJLR-HSZRJFAPSA-N 0 3 413.514 4.377 20 0 HIADHN CC(C)[C@@H](NC(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1)c1ccc(F)cc1F ZINC000468500076 882493467 /nfs/dbraw/zinc/49/34/67/882493467.db2.gz CKPKTKCNWUARHR-DRSNIGMVSA-N 0 3 423.548 4.193 20 0 HIADHN CC(C)[C@H](NC(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1)c1ccc(F)cc1F ZINC000468500079 882494057 /nfs/dbraw/zinc/49/40/57/882494057.db2.gz CKPKTKCNWUARHR-YVHKJVDXSA-N 0 3 423.548 4.193 20 0 HIADHN COc1ccccc1-c1csc([C@@H]2CCCN(C[C@H](O)COc3ccccc3)C2)n1 ZINC000447388174 871299061 /nfs/dbraw/zinc/29/90/61/871299061.db2.gz WAFNPMNDHJLFFW-MOPGFXCFSA-N 0 3 424.566 4.438 20 0 HIADHN Cc1sc(CC(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)nc1C(C)C ZINC000447549245 871423807 /nfs/dbraw/zinc/42/38/07/871423807.db2.gz DOTVXYTZRCVVQJ-IBGZPJMESA-N 0 3 423.586 4.400 20 0 HIADHN Cc1ccc([C@@H](NC[C@@H]2CCCCN2C2CC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000447593381 871500015 /nfs/dbraw/zinc/50/00/15/871500015.db2.gz RNODBTUEKDXSMK-LADGPHEKSA-N 0 3 412.599 4.094 20 0 HIADHN Cc1cc([C@H](NC[C@@H](CO)Cc2cc(F)c(F)c(F)c2)c2cccnc2)ccc1F ZINC000447607365 871517590 /nfs/dbraw/zinc/51/75/90/871517590.db2.gz RSTCNYIEPOHBOX-HJPURHCSSA-N 0 3 418.434 4.477 20 0 HIADHN O=C1[C@H](N[C@H](C[C@H]2CCOC2)c2ccccc2)CCN1c1ccc(Cl)c(F)c1 ZINC000447887858 871802046 /nfs/dbraw/zinc/80/20/46/871802046.db2.gz GXUKWWDWEQECNY-IPHXSNPTSA-N 0 3 402.897 4.342 20 0 HIADHN CN1CCCC(C)(C)[C@H]1CNC(=O)Nc1cnn(-c2ccccc2)c1C(F)(F)F ZINC000448006179 871849703 /nfs/dbraw/zinc/84/97/03/871849703.db2.gz BVXJURHFCCKZKC-MRXNPFEDSA-N 0 3 409.456 4.133 20 0 HIADHN CN1CCCC(C)(C)[C@H]1CNC(=O)N1CCC[C@@H](c2nc(C(F)(F)F)cs2)C1 ZINC000448028223 871867598 /nfs/dbraw/zinc/86/75/98/871867598.db2.gz CNKJUVKWCFITJA-UKRRQHHQSA-N 0 3 418.529 4.171 20 0 HIADHN CO[C@@H]1CCOc2c(NC(=O)N(CCN(C)C)Cc3ccc(F)c(F)c3)cccc21 ZINC000448045866 871877719 /nfs/dbraw/zinc/87/77/19/871877719.db2.gz VCKSHUFHVMAOAQ-HXUWFJFHSA-N 0 3 419.472 4.031 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)N(C)[C@@H](C)c3c(F)cccc3F)CC2)c1 ZINC000468552348 882597861 /nfs/dbraw/zinc/59/78/61/882597861.db2.gz GXHDOKTZPFGDSY-SFHVURJKSA-N 0 3 401.501 4.005 20 0 HIADHN CCN(C(=O)NC[C@H](c1ccccc1)N1CCC(C)CC1)[C@H]1CCOC(C)(C)C1 ZINC000460119115 872589244 /nfs/dbraw/zinc/58/92/44/872589244.db2.gz XPFGGMVPDGAAIH-FCHUYYIVSA-N 0 3 401.595 4.449 20 0 HIADHN CCN(C(=O)Nc1cccc(-c2nccn2C)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000460128615 872609051 /nfs/dbraw/zinc/60/90/51/872609051.db2.gz GIWIHOWDKMVZDM-JOCHJYFZSA-N 0 3 403.530 4.215 20 0 HIADHN C[C@H](CC(=O)NCCCCN1CCN(c2ccccc2)CC1)Cc1cccc(F)c1 ZINC000468574800 882643661 /nfs/dbraw/zinc/64/36/61/882643661.db2.gz DQSFYKQMAHRZMQ-NRFANRHFSA-N 0 3 411.565 4.113 20 0 HIADHN CCn1c(COc2ccccc2-c2ccccc2)nnc1N(C)[C@H]1CCN(C2CC2)C1 ZINC000460189977 872758669 /nfs/dbraw/zinc/75/86/69/872758669.db2.gz PSNIBXWNFNSHBT-NRFANRHFSA-N 0 3 417.557 4.217 20 0 HIADHN C[C@H](C(=O)Nc1ccc(C(=O)N(C)[C@@H]2CCCN(C)C2)cc1)c1cccc(Cl)c1 ZINC000460215266 872801098 /nfs/dbraw/zinc/80/10/98/872801098.db2.gz JMZMZTPRWCXABN-HRAATJIYSA-N 0 3 413.949 4.248 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)N2CCCC[C@H]2c2nnc(C3CCC3)o2)CN1Cc1ccccc1 ZINC000460366428 873001335 /nfs/dbraw/zinc/00/13/35/873001335.db2.gz ZMNPZZQEQZYMGP-QMMLZNLJSA-N 0 3 423.561 4.237 20 0 HIADHN COc1ccccc1[C@H](NC(=O)N[C@H](C)CN(C)Cc1ccccc1)c1ccco1 ZINC000460376673 873015840 /nfs/dbraw/zinc/01/58/40/873015840.db2.gz KRVZEBLGEWSEIC-JPYJTQIMSA-N 0 3 407.514 4.197 20 0 HIADHN CCC[C@@H]1C[C@H]1NC(=O)N(Cc1ccccc1Br)C1CCN(C)CC1 ZINC000460396320 873045493 /nfs/dbraw/zinc/04/54/93/873045493.db2.gz ZYWSUPGQRNFPFS-DNVCBOLYSA-N 0 3 408.384 4.244 20 0 HIADHN COc1cccc(F)c1[C@H](C)NC(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000460479325 873164618 /nfs/dbraw/zinc/16/46/18/873164618.db2.gz KEUFQRGGDDIDHC-BTYIYWSLSA-N 0 3 424.438 4.466 20 0 HIADHN COc1cccc(F)c1[C@@H](C)NC(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000460479327 873165109 /nfs/dbraw/zinc/16/51/09/873165109.db2.gz KEUFQRGGDDIDHC-VFNWGFHPSA-N 0 3 424.438 4.466 20 0 HIADHN CN(C)Cc1cccc(C(=O)N2CCc3c(Br)ccc(Cl)c3C2)c1 ZINC000468608131 882711470 /nfs/dbraw/zinc/71/14/70/882711470.db2.gz LYRZERKWNXMDOT-UHFFFAOYSA-N 0 3 407.739 4.363 20 0 HIADHN CN1CCC(N(Cc2ccccc2Br)C(=O)NCCC2(C)CC2)CC1 ZINC000460665416 873409120 /nfs/dbraw/zinc/40/91/20/873409120.db2.gz AUQGWNMGACCQQN-UHFFFAOYSA-N 0 3 408.384 4.245 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1ccc(OC2CCOCC2)cc1)c1ccsc1 ZINC000460736470 873558134 /nfs/dbraw/zinc/55/81/34/873558134.db2.gz PBFKJLKTLITKFL-OAQYLSRUSA-N 0 3 402.560 4.119 20 0 HIADHN CN(Cc1ccccc1)Cc1cccc(-c2nc(CCn3nnc4ccccc43)no2)c1 ZINC000460743524 873572760 /nfs/dbraw/zinc/57/27/60/873572760.db2.gz VVZCVBFKQGMMHS-UHFFFAOYSA-N 0 3 424.508 4.356 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)c2ccc(OCc3ccccn3)cc2)c1 ZINC000460883250 873794633 /nfs/dbraw/zinc/79/46/33/873794633.db2.gz NCMGXQRCODWDNA-UHFFFAOYSA-N 0 3 403.526 4.173 20 0 HIADHN CSC1(CNC(=O)c2ccccc2C(=O)c2ccc(C)c(C)c2)CCN(C)CC1 ZINC000460970225 873865998 /nfs/dbraw/zinc/86/59/98/873865998.db2.gz CBCYYFZQTHQNBA-UHFFFAOYSA-N 0 3 410.583 4.092 20 0 HIADHN CC[C@@H](C(=O)Nc1ccc(C(=O)N(C)[C@H]2CCCN(C)C2)cc1)c1ccc(F)cc1 ZINC000461010528 873883494 /nfs/dbraw/zinc/88/34/94/873883494.db2.gz ZGKIHSOOVGDXGJ-FCHUYYIVSA-N 0 3 411.521 4.124 20 0 HIADHN CO[C@@H](CNC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1)c1ccc(Cl)cc1 ZINC000461031527 873894392 /nfs/dbraw/zinc/89/43/92/873894392.db2.gz DNKHRHCJZPRSEU-RXVVDRJESA-N 0 3 404.913 4.195 20 0 HIADHN O=C(N[C@@H]1c2ccccc2CC12CCOCC2)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000461035981 873897434 /nfs/dbraw/zinc/89/74/34/873897434.db2.gz DLJKXOXSQTZLSF-XUZZJYLKSA-N 0 3 422.544 4.248 20 0 HIADHN CC(C)(C)CC(=O)Nc1ccc(Cl)c(C(=O)N2CC[C@@H](N3CCCCC3)C2)c1 ZINC000461079751 873986924 /nfs/dbraw/zinc/98/69/24/873986924.db2.gz GHKXNDDZPOFXEQ-QGZVFWFLSA-N 0 3 405.970 4.415 20 0 HIADHN CCOc1cccc2cc([C@@H](C)NCc3ccc(N4CCCS4(=O)=O)cc3)oc21 ZINC000461094574 874010865 /nfs/dbraw/zinc/01/08/65/874010865.db2.gz ZKCVHEGMKTWEFM-MRXNPFEDSA-N 0 3 414.527 4.222 20 0 HIADHN O=S1(=O)CCCN1c1ccc(CN[C@@H]2CCc3c2ccc(Cl)c3Cl)cc1 ZINC000461095729 874011281 /nfs/dbraw/zinc/01/12/81/874011281.db2.gz XMOBJGVMVUBQOS-GOSISDBHSA-N 0 3 411.354 4.310 20 0 HIADHN CC[C@@H](NC[C@@H]1CN(C(=O)c2ccccc2)[C@H]2CCN1C2)c1cccc(Cl)c1F ZINC000461101824 874019953 /nfs/dbraw/zinc/01/99/53/874019953.db2.gz FNFCJHCOWCJRQT-WAOWUJCRSA-N 0 3 415.940 4.119 20 0 HIADHN CC[C@H](NC[C@H]1CN(C(=O)c2ccccc2)[C@H]2CCN1C2)c1cccc(Cl)c1F ZINC000461101825 874020221 /nfs/dbraw/zinc/02/02/21/874020221.db2.gz FNFCJHCOWCJRQT-WFXMLNOXSA-N 0 3 415.940 4.119 20 0 HIADHN CCOc1c(Br)cc(CN2CCCC[C@H](CCOC)C2)cc1OC ZINC000468698415 882818843 /nfs/dbraw/zinc/81/88/43/882818843.db2.gz KMFHBXVGUOZSIN-OAHLLOKOSA-N 0 3 400.357 4.495 20 0 HIADHN COC(=O)[C@@H](C)Oc1ccc(CNCc2cc3cc(Br)ccc3[nH]2)cc1 ZINC000468699943 882819938 /nfs/dbraw/zinc/81/99/38/882819938.db2.gz LQRPBAGVFXBNND-CYBMUJFWSA-N 0 3 417.303 4.161 20 0 HIADHN OCC[C@H](NCc1csc(-c2ccc(C(F)(F)F)cc2)n1)C1CCOCC1 ZINC000461360163 874363037 /nfs/dbraw/zinc/36/30/37/874363037.db2.gz DENNDAFMELFCLI-KRWDZBQOSA-N 0 3 400.466 4.096 20 0 HIADHN Cc1ccc(C(=O)CCC(=O)N2C[C@H]3CCN(Cc4ccccc4)C[C@H]3C2)cc1C ZINC000461439476 874492717 /nfs/dbraw/zinc/49/27/17/874492717.db2.gz RQMGPEOBOZRRPL-RPWUZVMVSA-N 0 3 404.554 4.247 20 0 HIADHN Cc1cc(C(=O)CCC(=O)N2C[C@H]3CN(Cc4ccccc4)CC[C@@H]3C2)c(C)s1 ZINC000461444501 874500793 /nfs/dbraw/zinc/50/07/93/874500793.db2.gz LJLBOHRCHKPMMD-NHCUHLMSSA-N 0 3 410.583 4.308 20 0 HIADHN Cc1cn(-c2c(F)cccc2F)nc1C(=O)N[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000468745871 882839676 /nfs/dbraw/zinc/83/96/76/882839676.db2.gz WGRXZTJBYYCEBH-AEFFLSMTSA-N 0 3 410.468 4.024 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)N(CCc1ccccc1)Cc1ccncc1 ZINC000461716885 874865721 /nfs/dbraw/zinc/86/57/21/874865721.db2.gz QUEFVCJLDPMEFB-JOCHJYFZSA-N 0 3 416.569 4.356 20 0 HIADHN CC1CCN([C@H](CNC(=O)N2CCC(OC(C)(C)C)CC2)c2ccccc2)CC1 ZINC000468827624 882878998 /nfs/dbraw/zinc/87/89/98/882878998.db2.gz DBOWOPMCLOMVIM-JOCHJYFZSA-N 0 3 401.595 4.449 20 0 HIADHN C[C@@H]1CN(c2nnc(C3CCC3)n2C[C@@H]2CCCCO2)[C@@H](C)CN1Cc1ccccc1 ZINC000461826684 874955341 /nfs/dbraw/zinc/95/53/41/874955341.db2.gz IXDCGKNBXDAGKB-QTEQDKRBSA-N 0 3 423.605 4.214 20 0 HIADHN COc1cccc(C2(CNC(=O)N(Cc3ccccc3)C3CCN(C)CC3)CC2)c1 ZINC000461898942 875044929 /nfs/dbraw/zinc/04/49/29/875044929.db2.gz ADZVCWIGPHETOB-UHFFFAOYSA-N 0 3 407.558 4.033 20 0 HIADHN CN1CC[C@H](NC(=O)N[C@H]2CCCc3cn(C4CCCC4)nc32)[C@H]1c1ccccc1 ZINC000461944105 875076495 /nfs/dbraw/zinc/07/64/95/875076495.db2.gz ADLDOAMQDMWJNV-QNWVGRARSA-N 0 3 407.562 4.120 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)N[C@H]2CCCc3cn(C4CCCC4)nc32)o1 ZINC000461972532 875094719 /nfs/dbraw/zinc/09/47/19/875094719.db2.gz ZOOYKLQDDHKJJF-NRFANRHFSA-N 0 3 413.566 4.050 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)N(Cc3ccco3)Cc3ccccc3)CC2)c1 ZINC000462023072 875139464 /nfs/dbraw/zinc/13/94/64/875139464.db2.gz NPKDTLWZCRCYCL-UHFFFAOYSA-N 0 3 417.553 4.329 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C1(c2ccccc2Cl)CCOCC1 ZINC000462174295 875272678 /nfs/dbraw/zinc/27/26/78/875272678.db2.gz GKTLBSSMOIGUPP-GCJKJVERSA-N 0 3 412.961 4.025 20 0 HIADHN Cc1ccc(-c2cnc(CCC(=O)N[C@@H]3CN(Cc4ccccc4)C[C@H]3C)o2)cc1 ZINC000462181319 875280902 /nfs/dbraw/zinc/28/09/02/875280902.db2.gz JVCWZFSSFDGIKX-DENIHFKCSA-N 0 3 403.526 4.219 20 0 HIADHN Cc1ccc(-c2nc(CC(=O)N[C@@H]3CN(Cc4ccccc4)C[C@H]3C)cs2)cc1 ZINC000462189611 875293242 /nfs/dbraw/zinc/29/32/42/875293242.db2.gz OHNLXSIUYNRFNK-XMSQKQJNSA-N 0 3 405.567 4.298 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1ccc(NC(=O)c2cccs2)cc1 ZINC000462195103 875302606 /nfs/dbraw/zinc/30/26/06/875302606.db2.gz KCDGKPNPJQCCQP-UTKZUKDTSA-N 0 3 419.550 4.251 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)CCCc1ncc(-c2ccccc2)o1 ZINC000462197942 875306822 /nfs/dbraw/zinc/30/68/22/875306822.db2.gz WUNYHNRKSRGBOT-UGKGYDQZSA-N 0 3 403.526 4.301 20 0 HIADHN CN(C)C[C@@H](NC(=O)NC[C@@H](Cc1ccccc1)C(F)(F)F)c1ccc(F)cc1 ZINC000462236952 875348537 /nfs/dbraw/zinc/34/85/37/875348537.db2.gz RTCHZZVBJBDNOL-IEBWSBKVSA-N 0 3 411.443 4.149 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)Nc1cc2c(cc1Cl)OCCCO2 ZINC000462247369 875366646 /nfs/dbraw/zinc/36/66/46/875366646.db2.gz NTBMMPSFCNZLDH-KXBFYZLASA-N 0 3 415.921 4.143 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Nc1ccc(NC(=O)c2ccco2)cc1 ZINC000462267080 875393851 /nfs/dbraw/zinc/39/38/51/875393851.db2.gz HCGFHRQAWWUCFP-DYESRHJHSA-N 0 3 418.497 4.174 20 0 HIADHN CC(C)Cn1ncc(NC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)c1C(F)F ZINC000462273315 875401322 /nfs/dbraw/zinc/40/13/22/875401322.db2.gz BQYPDQZARSVQFD-CRAIPNDOSA-N 0 3 405.493 4.119 20 0 HIADHN Cc1nc(C(F)(F)F)sc1C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000462344926 875458103 /nfs/dbraw/zinc/45/81/03/875458103.db2.gz ZUGGDTCWJYPWMF-UHFFFAOYSA-N 0 3 415.403 4.005 20 0 HIADHN C[C@H](NCc1cnn([C@@]2(C)CCS(=O)(=O)C2)c1)c1ccc(Cl)c2ccccc21 ZINC000462527609 875644288 /nfs/dbraw/zinc/64/42/88/875644288.db2.gz SRUYVQCVOMFOOA-BTYIYWSLSA-N 0 3 417.962 4.074 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)c1cc(Cl)cc2c1OCC2 ZINC000462616782 875728251 /nfs/dbraw/zinc/72/82/51/875728251.db2.gz JJMJFKUZSFMHMA-LJQANCHMSA-N 0 3 422.916 4.171 20 0 HIADHN COc1ccccc1/C=C\CN[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1=O ZINC000462739762 875811559 /nfs/dbraw/zinc/81/15/59/875811559.db2.gz WWWWDAQPUQJCMD-BQHGXPCASA-N 0 3 402.441 4.095 20 0 HIADHN CC(C)Oc1cccc(CN[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2=O)c1 ZINC000462743279 875814052 /nfs/dbraw/zinc/81/40/52/875814052.db2.gz WTOUVEWIYBDSSE-HXUWFJFHSA-N 0 3 404.457 4.360 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)CCc2cncc3ccccc32)cc1 ZINC000462776523 875833499 /nfs/dbraw/zinc/83/34/99/875833499.db2.gz SSGOTJCOOKARSB-DEOSSOPVSA-N 0 3 403.526 4.129 20 0 HIADHN FC(F)(F)c1cc(Cl)c2nnc(CN[C@@H]3CCC[C@@H]([C@H]4CCOC4)C3)n2c1 ZINC000462791866 875842846 /nfs/dbraw/zinc/84/28/46/875842846.db2.gz SSTCJWXJCGQBLP-MBNYWOFBSA-N 0 3 402.848 4.086 20 0 HIADHN CO[C@](C)(CN[C@@H](c1cccc(S(C)(=O)=O)c1)c1ccc(C)cc1C)C1CC1 ZINC000462802923 875851940 /nfs/dbraw/zinc/85/19/40/875851940.db2.gz IQIQPEDBCQFYPN-XZOQPEGZSA-N 0 3 401.572 4.201 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@H](C)N[C@H]2CCCc3c(O)cccc32)cc1 ZINC000462815861 875857264 /nfs/dbraw/zinc/85/72/64/875857264.db2.gz JRXBXCUYJRGQKL-KKSFZXQISA-N 0 3 402.560 4.151 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](N[C@@H]2CCO[C@H](C3CC3)C2)c2ccc(Cl)cc2)c1 ZINC000462837203 875870917 /nfs/dbraw/zinc/87/09/17/875870917.db2.gz ZEIDSWGZYYBTAJ-BAGYTPMASA-N 0 3 419.974 4.380 20 0 HIADHN C[C@H]1C[C@H](NCc2cnc(N3CCOCC3)c(F)c2)c2cccc(Br)c21 ZINC000462837470 875872412 /nfs/dbraw/zinc/87/24/12/875872412.db2.gz XNKPLKVVHXGKAX-UGSOOPFHSA-N 0 3 420.326 4.158 20 0 HIADHN COc1ccc([C@H](C)NCc2cccc(N3CCCS3(=O)=O)c2)c2ccccc12 ZINC000462842190 875877781 /nfs/dbraw/zinc/87/77/81/875877781.db2.gz XAJIMTXNJWSBNX-KRWDZBQOSA-N 0 3 410.539 4.239 20 0 HIADHN C[C@@H](NC[C@@H](O)CN1CCc2ccccc2C1)c1csc(-c2ccccc2F)n1 ZINC000462885113 875912426 /nfs/dbraw/zinc/91/24/26/875912426.db2.gz UDJSVPPZJLXFBZ-VQIMIIECSA-N 0 3 411.546 4.019 20 0 HIADHN Cc1nc2ccc(Br)cc2c(NCc2cccc(C(=O)N(C)C)c2)c1C ZINC000462921740 875950804 /nfs/dbraw/zinc/95/08/04/875950804.db2.gz JBTZFQHVTOVZCS-UHFFFAOYSA-N 0 3 412.331 4.350 20 0 HIADHN C[C@H](NCc1cccc(OCCN2CCOCC2)c1)c1ccc(OC(C)(C)C)cc1 ZINC000463012340 876028621 /nfs/dbraw/zinc/02/86/21/876028621.db2.gz QNTSZWKXDKFGSU-FQEVSTJZSA-N 0 3 412.574 4.426 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N1CCC(C(F)(F)F)(C(F)(F)F)C1 ZINC000463011308 876028719 /nfs/dbraw/zinc/02/87/19/876028719.db2.gz LGIKRFWXHRAVIJ-ZFWWWQNUSA-N 0 3 423.401 4.033 20 0 HIADHN CCc1nc(C)c([C@H](C)N(C)C(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)s1 ZINC000463018268 876035604 /nfs/dbraw/zinc/03/56/04/876035604.db2.gz BYLAEPALYBXKJB-IEZWGBDMSA-N 0 3 400.592 4.237 20 0 HIADHN COCCCCN(Cc1ccccc1)C(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C ZINC000463020081 876037786 /nfs/dbraw/zinc/03/77/86/876037786.db2.gz NWRQOZMKKMATBO-QPPBQGQZSA-N 0 3 409.574 4.145 20 0 HIADHN OC[C@]1(Cc2ccccc2)CCCN(Cc2ccccc2OCc2ccccn2)C1 ZINC000463030447 876050770 /nfs/dbraw/zinc/05/07/70/876050770.db2.gz SNGNLFIJHVAVGY-SANMLTNESA-N 0 3 402.538 4.478 20 0 HIADHN Cc1nc2ccccc2n1CCCCCN1CCN(CCOc2ccccc2)CC1 ZINC000463077265 876109282 /nfs/dbraw/zinc/10/92/82/876109282.db2.gz NVJLIPADXOCEHG-UHFFFAOYSA-N 0 3 406.574 4.212 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)cc1C(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000463167149 876222543 /nfs/dbraw/zinc/22/25/43/876222543.db2.gz VMODPQBLCCNESL-YLJYHZDGSA-N 0 3 408.933 4.399 20 0 HIADHN C[C@@H]1CC[C@H](O)[C@@H]([C@@H]2CCCCN2Cc2nc(-c3cc(F)c(F)c(F)c3)no2)C1 ZINC000463198835 876258485 /nfs/dbraw/zinc/25/84/85/876258485.db2.gz FPATXOSJFVKJNP-NMVRNDPTSA-N 0 3 409.452 4.306 20 0 HIADHN COc1ccc(-c2ncc(C(=O)NC3CCN(Cc4ccccc4)CC3)s2)cc1 ZINC000463248693 876305676 /nfs/dbraw/zinc/30/56/76/876305676.db2.gz WLGHVDLDXUAMBX-UHFFFAOYSA-N 0 3 407.539 4.213 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](NCCCC2CCOCC2)c2ccc(F)cc2)c1 ZINC000463248673 876306153 /nfs/dbraw/zinc/30/61/53/876306153.db2.gz VZTPZUKZSPOXLX-QFIPXVFZSA-N 0 3 405.535 4.115 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)N[C@@H]1CCO[C@@H](c2ccccc2)C1 ZINC000463255928 876312220 /nfs/dbraw/zinc/31/22/20/876312220.db2.gz CSYKHBWEBOOJPV-DNQXCXABSA-N 0 3 409.574 4.113 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)N[C@@H]1CCO[C@H](c2ccccc2)C1 ZINC000463255929 876312644 /nfs/dbraw/zinc/31/26/44/876312644.db2.gz CSYKHBWEBOOJPV-RPWUZVMVSA-N 0 3 409.574 4.113 20 0 HIADHN C[C@@H]1CCCc2ccccc2[C@@H]1NC(=O)N(C)C1CCN(CCc2ccccn2)CC1 ZINC000463268417 876326638 /nfs/dbraw/zinc/32/66/38/876326638.db2.gz RSXNKFXKIZVURR-CJFMBICVSA-N 0 3 420.601 4.444 20 0 HIADHN Cc1n[nH]c(C)c1[C@@H]1CCCCCN1C(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C ZINC000463270327 876327602 /nfs/dbraw/zinc/32/76/02/876327602.db2.gz GFCVCVRDVIVVRV-WTNAPCKOSA-N 0 3 409.578 4.174 20 0 HIADHN Cc1n[nH]c(C)c1[C@@H]1CCCCCN1C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C ZINC000463270329 876327672 /nfs/dbraw/zinc/32/76/72/876327672.db2.gz GFCVCVRDVIVVRV-YHYVQYDKSA-N 0 3 409.578 4.174 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)NCc1ccc(-c2ccncc2)cc1 ZINC000463275481 876333072 /nfs/dbraw/zinc/33/30/72/876333072.db2.gz LGSCJIVRRUCQCO-NTKDMRAZSA-N 0 3 400.526 4.068 20 0 HIADHN COc1ccc2c(c1)nc(CNC1CCN(Cc3c(F)cccc3Cl)CC1)n2C ZINC000463277983 876334516 /nfs/dbraw/zinc/33/45/16/876334516.db2.gz AZMQFTFLKZLCEO-UHFFFAOYSA-N 0 3 416.928 4.129 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NC[C@H]1CCN(c2ccccc2F)C1)c1ccsc1 ZINC000463344769 876398566 /nfs/dbraw/zinc/39/85/66/876398566.db2.gz MIIMQSPJUPSAFF-DYESRHJHSA-N 0 3 418.582 4.096 20 0 HIADHN CC(C)[C@@H](CNC(=O)[C@H]1SCCc2sccc21)N1CCc2ccccc2C1 ZINC000463408584 876462166 /nfs/dbraw/zinc/46/21/66/876462166.db2.gz ZXVOHVITSMXRBS-CTNGQTDRSA-N 0 3 400.613 4.278 20 0 HIADHN O=C(CCN1Cc2ccc(O)cc2C2(CC2)C1)Nc1ccc(Br)cc1 ZINC000463418013 876471753 /nfs/dbraw/zinc/47/17/53/876471753.db2.gz WVENPNXJUFGATL-UHFFFAOYSA-N 0 3 401.304 4.031 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](NCCc2ccc(F)c(F)c2)c2ccc(F)cc2)c1 ZINC000468973858 883041099 /nfs/dbraw/zinc/04/10/99/883041099.db2.gz MPBMMMXANNMAEY-QFIPXVFZSA-N 0 3 419.468 4.429 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)[C@H]1C[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000463526975 876599749 /nfs/dbraw/zinc/59/97/49/876599749.db2.gz IJHKGLDOAURMBF-CVEARBPZSA-N 0 3 412.402 4.076 20 0 HIADHN Cc1cc(Br)cc(C(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)c1 ZINC000463568944 876660479 /nfs/dbraw/zinc/66/04/79/876660479.db2.gz KYFIUMVOIRFXOW-IAGOWNOFSA-N 0 3 423.395 4.109 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)[C@H]2C[C@@H]2c2cc(F)c(F)c(F)c2)CC1 ZINC000463574068 876669194 /nfs/dbraw/zinc/66/91/94/876669194.db2.gz MFEOVZNXMUTIAI-MOPGFXCFSA-N 0 3 402.460 4.330 20 0 HIADHN Cc1nn(C)c(Sc2ccccc2)c1C(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000463594255 876704624 /nfs/dbraw/zinc/70/46/24/876704624.db2.gz UGTGZSLXHSAEQP-UYAOXDASSA-N 0 3 420.582 4.445 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3ccc(OCc4ccncc4)cc3)cc2)CC1 ZINC000468991515 883056570 /nfs/dbraw/zinc/05/65/70/883056570.db2.gz PGGGQJXIWXISDK-UHFFFAOYSA-N 0 3 416.525 4.055 20 0 HIADHN COc1ccc(Cn2nc(C)c(CNCCOc3ccc(F)cc3F)c2C)cc1 ZINC000463736621 876857110 /nfs/dbraw/zinc/85/71/10/876857110.db2.gz BGYUIERLIKGCOV-UHFFFAOYSA-N 0 3 401.457 4.004 20 0 HIADHN CN(C(=O)C(C)(C)c1csc(-c2cc(F)ccc2F)n1)[C@@H]1CCN(C2CC2)C1 ZINC000463775047 876895571 /nfs/dbraw/zinc/89/55/71/876895571.db2.gz ZLSXNNRNZRNGIA-OAHLLOKOSA-N 0 3 405.514 4.061 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)cc1C(=O)N(Cc1ccco1)C1CCN(C)CC1 ZINC000463822534 876936880 /nfs/dbraw/zinc/93/68/80/876936880.db2.gz CZNOFYIULRNPHJ-UHFFFAOYSA-N 0 3 412.921 4.164 20 0 HIADHN Cn1ccc(N2CCC[C@H](N[C@@H](Cc3ccccc3Cl)c3ccccc3)C2=O)n1 ZINC000463889884 877011944 /nfs/dbraw/zinc/01/19/44/877011944.db2.gz BEMZYFDIFGIXNI-SFTDATJTSA-N 0 3 408.933 4.143 20 0 HIADHN CCN1CCN(c2ccc(N[C@@H](C)c3nc(Cc4ccccc4)no3)c(C)c2)CC1 ZINC000463900031 877022940 /nfs/dbraw/zinc/02/29/40/877022940.db2.gz YYTFETVGMDLFNG-IBGZPJMESA-N 0 3 405.546 4.284 20 0 HIADHN CCOC(=O)C1CCN(C(=O)[C@@H](C)N[C@H](CC(C)(C)C)c2ccc(F)cc2)CC1 ZINC000463910213 877030620 /nfs/dbraw/zinc/03/06/20/877030620.db2.gz ISWWRVJHUABQQA-OXQOHEQNSA-N 0 3 406.542 4.083 20 0 HIADHN COc1ccc([C@@H](CNC(=O)NC[C@@H](C)c2ccc(F)cc2F)N2CCCC2)cc1 ZINC000463959207 877083289 /nfs/dbraw/zinc/08/32/89/877083289.db2.gz SPOAROXVVDESEO-OPAMFIHVSA-N 0 3 417.500 4.213 20 0 HIADHN COc1ccc([C@H](CNC(=O)NC[C@@H](C)Cc2cccs2)N2CCCC2)cc1 ZINC000463967586 877092669 /nfs/dbraw/zinc/09/26/69/877092669.db2.gz XFSGNSXXVOYPRR-UWJYYQICSA-N 0 3 401.576 4.072 20 0 HIADHN CC(C)[C@@H](C(=O)Nc1ccc(C(=O)N(C)[C@H]2CCCN(C)C2)cc1)c1ccccc1 ZINC000464019587 877154108 /nfs/dbraw/zinc/15/41/08/877154108.db2.gz WUDFWANXRZGKBU-XZOQPEGZSA-N 0 3 407.558 4.231 20 0 HIADHN CC[C@@H](CNC(=O)N[C@H](C)c1cn(C(C)(C)C)nc1C)N1CCc2ccccc2C1 ZINC000464139459 877303984 /nfs/dbraw/zinc/30/39/84/877303984.db2.gz IITBNRDYGYMKFD-UTKZUKDTSA-N 0 3 411.594 4.144 20 0 HIADHN CC[C@@H](CNC(=O)N[C@@H](C)c1cn(C(C)(C)C)nc1C)N1CCc2ccccc2C1 ZINC000464139460 877304623 /nfs/dbraw/zinc/30/46/23/877304623.db2.gz IITBNRDYGYMKFD-UWJYYQICSA-N 0 3 411.594 4.144 20 0 HIADHN Cc1nn(C(C)(C)C)cc1[C@@H](C)NC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C ZINC000464144479 877309916 /nfs/dbraw/zinc/30/99/16/877309916.db2.gz DSYVESLAZVDYTA-RTBURBONSA-N 0 3 411.594 4.314 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)c2csc(CCc3ccccc3)n2)CC1 ZINC000503245240 912225259 /nfs/dbraw/zinc/22/52/59/912225259.db2.gz WABUPTMEUJQSKA-UHFFFAOYSA-N 0 3 409.555 4.258 20 0 HIADHN O=c1ccccn1C[C@@H](NCCOc1cccc(Br)c1)c1ccccc1 ZINC000503255003 912235657 /nfs/dbraw/zinc/23/56/57/912235657.db2.gz GTDXRAGMQOGBDY-HXUWFJFHSA-N 0 3 413.315 4.021 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)N1CC[C@H](CSc2ccccc2)C1 ZINC000464323006 877513601 /nfs/dbraw/zinc/51/36/01/877513601.db2.gz DECYGFYSLCWHLF-QFIPXVFZSA-N 0 3 423.626 4.230 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)N(C)CCc1cccc(Br)c1)c1ccco1 ZINC000464392256 877593966 /nfs/dbraw/zinc/59/39/66/877593966.db2.gz HIIYYZSZLOISOV-CRAIPNDOSA-N 0 3 422.367 4.355 20 0 HIADHN CC(C)N(C(=O)CN(CCCOc1ccccc1)C1CCOCC1)C1CCCC1 ZINC000464593449 877820181 /nfs/dbraw/zinc/82/01/81/877820181.db2.gz OCTYGAHNWCDKNC-UHFFFAOYSA-N 0 3 402.579 4.116 20 0 HIADHN CCC[C@H]1[C@@H](C)CCCN1CC(=O)N(C)CC(=O)Nc1ccccc1C(F)(F)F ZINC000464731995 877967216 /nfs/dbraw/zinc/96/72/16/877967216.db2.gz HXAVICLBWRXQKL-YJBOKZPZSA-N 0 3 413.484 4.003 20 0 HIADHN CC(=O)Nc1ccc(OC[C@H](O)CN2Cc3ccccc3C[C@H]2c2ccccc2)cc1 ZINC000464739348 877973229 /nfs/dbraw/zinc/97/32/29/877973229.db2.gz PUPNOHTYVRUAHD-RSXGOPAZSA-N 0 3 416.521 4.184 20 0 HIADHN CCS[C@@H]1CC[C@H](N(C)CC(=O)N(C)Cc2ccc3cc(OC)ccc3c2)C1 ZINC000464768930 878012830 /nfs/dbraw/zinc/01/28/30/878012830.db2.gz COKJSCPKURELBB-RBBKRZOGSA-N 0 3 400.588 4.413 20 0 HIADHN CC(C)[C@H](Cc1ccc(F)cc1)N(C)Cc1nc2c(cnn2-c2ccccc2)c(=O)[nH]1 ZINC000464784941 878032766 /nfs/dbraw/zinc/03/27/66/878032766.db2.gz ADSNGVYBTGHIOH-NRFANRHFSA-N 0 3 419.504 4.359 20 0 HIADHN CC(C)[C@H](Cc1ccc(F)cc1)[N@H+](C)Cc1nc2c(cnn2-c2ccccc2)c(=O)[n-]1 ZINC000464784941 878032785 /nfs/dbraw/zinc/03/27/85/878032785.db2.gz ADSNGVYBTGHIOH-NRFANRHFSA-N 0 3 419.504 4.359 20 0 HIADHN CC(C)[C@H](Cc1ccc(F)cc1)[N@@H+](C)Cc1nc2c(cnn2-c2ccccc2)c(=O)[n-]1 ZINC000464784941 878032800 /nfs/dbraw/zinc/03/28/00/878032800.db2.gz ADSNGVYBTGHIOH-NRFANRHFSA-N 0 3 419.504 4.359 20 0 HIADHN Cc1nn(C)c(C)c1NC(=O)[C@H](C)N[C@@H](COc1c(C)cccc1C)C(C)(C)C ZINC000464785825 878032919 /nfs/dbraw/zinc/03/29/19/878032919.db2.gz GWRUSARDCFITHA-HKUYNNGSSA-N 0 3 400.567 4.064 20 0 HIADHN CCOc1cccc(CNC(=O)NC[C@@H](c2ccc(C)cc2)N(C)C)c1OC(F)F ZINC000464804199 878047923 /nfs/dbraw/zinc/04/79/23/878047923.db2.gz DDOGLNLAMCIMCM-SFHVURJKSA-N 0 3 421.488 4.097 20 0 HIADHN CC[C@H]1CCCCN1CCNC(=O)C(=O)Nc1ccccc1Sc1ccccc1 ZINC000503325998 912304276 /nfs/dbraw/zinc/30/42/76/912304276.db2.gz PVTMWUNMBJCABJ-SFHVURJKSA-N 0 3 411.571 4.157 20 0 HIADHN C[C@H](C(=O)N1CCC[C@H]1c1cccs1)N1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC000464839509 878105352 /nfs/dbraw/zinc/10/53/52/878105352.db2.gz PWILBTDEGAWYKK-SJBKTWHCSA-N 0 3 411.615 4.397 20 0 HIADHN CCCCOC1CCN(C[C@@H](O)COc2ccc(Cl)cc2Br)CC1 ZINC000464859176 878139768 /nfs/dbraw/zinc/13/97/68/878139768.db2.gz QGACQDGUMQMFBI-OAHLLOKOSA-N 0 3 420.775 4.123 20 0 HIADHN CC[C@H](C)NC(=O)[C@@H]1C[C@H](C)N(Cc2cnn(C)c2C(F)(F)F)[C@H]2CCCC[C@@H]12 ZINC000464868217 878152145 /nfs/dbraw/zinc/15/21/45/878152145.db2.gz XZNUCEIQUKVOSL-XWJBARJFSA-N 0 3 414.516 4.123 20 0 HIADHN COC(=O)c1ccc(CNC2(c3ccc(Br)cc3)CCOCC2)cc1F ZINC000464868992 878153289 /nfs/dbraw/zinc/15/32/89/878153289.db2.gz NTBNTOJLADMGKM-UHFFFAOYSA-N 0 3 422.294 4.170 20 0 HIADHN C[C@@H]1CCN(C(=O)c2cccc(OCc3cccnc3)c2)CCN1Cc1ccccc1 ZINC000464892790 878194064 /nfs/dbraw/zinc/19/40/64/878194064.db2.gz LFZBXXMVQXUNAU-OAQYLSRUSA-N 0 3 415.537 4.397 20 0 HIADHN C[C@H]1CCN(C(=O)c2cccc(OCc3cscn3)c2)CCN1Cc1ccccc1 ZINC000464907156 878221307 /nfs/dbraw/zinc/22/13/07/878221307.db2.gz PIGWWOJXJPBLGM-IBGZPJMESA-N 0 3 421.566 4.459 20 0 HIADHN C/C=C/c1ccc(OCC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)c(OC)c1 ZINC000464909488 878225896 /nfs/dbraw/zinc/22/58/96/878225896.db2.gz LRYOBVFNKZDJCX-BFSLETRISA-N 0 3 408.542 4.230 20 0 HIADHN COc1ccc(-c2nc(C)c(C(=O)N3CCC[C@@H]3CN3CCCCC3)s2)c(F)c1 ZINC000503356222 912330773 /nfs/dbraw/zinc/33/07/73/912330773.db2.gz QRPODBADYJUQDL-MRXNPFEDSA-N 0 3 417.550 4.357 20 0 HIADHN CCOc1cccc(CNC(=O)c2oc3ccccc3c2CN(C)C)c1OC(F)F ZINC000465042112 878402971 /nfs/dbraw/zinc/40/29/71/878402971.db2.gz LYCBGVSVHKBGDG-UHFFFAOYSA-N 0 3 418.440 4.425 20 0 HIADHN O[C@H](COc1c(Cl)cccc1Cl)CN1CCC[C@@H](c2ncc3n2CCCC3)C1 ZINC000503367795 912344109 /nfs/dbraw/zinc/34/41/09/912344109.db2.gz BEHHDKIUDDVYGE-WBVHZDCISA-N 0 3 424.372 4.146 20 0 HIADHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)c1cccc2cnccc21 ZINC000465175918 878562289 /nfs/dbraw/zinc/56/22/89/878562289.db2.gz SNLLBSHKXDKSSO-UHFFFAOYSA-N 0 3 412.331 4.201 20 0 HIADHN Cc1nc(C)c(NC(=O)N(CCN(C)C)Cc2ccc(Br)cc2)s1 ZINC000465245495 878666906 /nfs/dbraw/zinc/66/69/06/878666906.db2.gz YDYUMKSXPABNLT-UHFFFAOYSA-N 0 3 411.369 4.118 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)NCC(C)(C)Cc1cccc(Cl)c1 ZINC000465302780 878746517 /nfs/dbraw/zinc/74/65/17/878746517.db2.gz AQIVCCNJOXMZHR-UHFFFAOYSA-N 0 3 415.965 4.034 20 0 HIADHN O=C([C@@H](c1ccccc1)N1CCC[C@H](c2ncc3n2CCCC3)C1)N1CCCCC1 ZINC000503407987 912388008 /nfs/dbraw/zinc/38/80/08/912388008.db2.gz GUTGYMQDZDDFBU-JTHBVZDNSA-N 0 3 406.574 4.153 20 0 HIADHN C[C@@H](NC(=O)NC[C@@H](c1cccs1)N1CCCC1)c1cccc(-n2cccn2)c1 ZINC000465426140 878855882 /nfs/dbraw/zinc/85/58/82/878855882.db2.gz RLVPELTUZLOIIG-XLIONFOSSA-N 0 3 409.559 4.131 20 0 HIADHN CCO[C@@H](C)c1nc(CN(C)C(=O)NC[C@@H](c2cccs2)N2CCCC2)cs1 ZINC000465430054 878861521 /nfs/dbraw/zinc/86/15/21/878861521.db2.gz XZORXXWWHYGZFA-RDJZCZTQSA-N 0 3 422.620 4.281 20 0 HIADHN C[C@@H]1CN(C(=O)NC[C@H](c2ccccc2)N2CCCC2)C[C@@H](c2ccc(F)cc2)O1 ZINC000465431266 878863019 /nfs/dbraw/zinc/86/30/19/878863019.db2.gz SDSLLADGPHUDFO-YSZBQJHXSA-N 0 3 411.521 4.134 20 0 HIADHN C[C@@H]1CN(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)C[C@@H](c2ccc(F)cc2)O1 ZINC000465431263 878863692 /nfs/dbraw/zinc/86/36/92/878863692.db2.gz SDSLLADGPHUDFO-LEOXJPRUSA-N 0 3 411.521 4.134 20 0 HIADHN C[C@H](CCc1cccn1C)NC(=O)NC[C@H](c1cccs1)N1CCC(C)CC1 ZINC000465433758 878866332 /nfs/dbraw/zinc/86/63/32/878866332.db2.gz OFIXXLIXJAGEQH-UYAOXDASSA-N 0 3 402.608 4.180 20 0 HIADHN CCO[C@@H](C)c1nc(CN(C)C(=O)NC[C@H](c2ccc(CC)cc2)N(C)C)cs1 ZINC000465434111 878866420 /nfs/dbraw/zinc/86/64/20/878866420.db2.gz PEAKAGZISPFNRW-OXJNMPFZSA-N 0 3 418.607 4.247 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@H]2CNC(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000465439723 878871564 /nfs/dbraw/zinc/87/15/64/878871564.db2.gz YRCDCBBARGWMPP-HJOGWXRNSA-N 0 3 407.558 4.036 20 0 HIADHN CCC(CC)c1cc(CNC(=O)NC[C@@H](c2cccc(OC)c2)N2CCCC2)on1 ZINC000465465363 878899889 /nfs/dbraw/zinc/89/98/89/878899889.db2.gz IOTANSXCYBBKPM-QFIPXVFZSA-N 0 3 414.550 4.223 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)NC(=O)c2oc3ccccc3c2CN(C)C)cc1 ZINC000465466804 878901895 /nfs/dbraw/zinc/90/18/95/878901895.db2.gz ORNPMDNAQFODQX-INIZCTEOSA-N 0 3 402.498 4.480 20 0 HIADHN COc1cccc([C@H](CNC(=O)NC[C@H](C)Sc2ccccc2)N2CCCC2)c1 ZINC000465474630 878911775 /nfs/dbraw/zinc/91/17/75/878911775.db2.gz IYQPBVBPXYWVRO-AVRDEDQJSA-N 0 3 413.587 4.312 20 0 HIADHN Cc1ccc(C)c(NC(=O)Cc2nc(CN[C@@H]3CCCC34CCOCC4)cs2)c1 ZINC000503413438 912397785 /nfs/dbraw/zinc/39/77/85/912397785.db2.gz SMJIAGCKMDDVQY-HXUWFJFHSA-N 0 3 413.587 4.380 20 0 HIADHN CCOC(=O)c1c(C)c(C)sc1NC(=O)N(CCN(C)C)Cc1cccs1 ZINC000503413908 912398504 /nfs/dbraw/zinc/39/85/04/912398504.db2.gz CGHRSVZCEOHYQL-UHFFFAOYSA-N 0 3 409.577 4.199 20 0 HIADHN CCN1CCN(Cc2ccc(CNC(=O)N3CC[C@H](C)C[C@@H]3c3ccco3)cc2)CC1 ZINC000465518462 878966425 /nfs/dbraw/zinc/96/64/25/878966425.db2.gz DWOKSBMBIFIQGD-NZQKXSOJSA-N 0 3 424.589 4.100 20 0 HIADHN Brc1ccc2[nH]c(CN3CCC[C@@H](c4ncc5n4CCCC5)C3)nc2c1 ZINC000503417628 912407159 /nfs/dbraw/zinc/40/71/59/912407159.db2.gz VXHFXJYKYSQEBH-CQSZACIVSA-N 0 3 414.351 4.238 20 0 HIADHN Brc1ccc2nc(CN3CCC[C@@H](c4ncc5n4CCCC5)C3)[nH]c2c1 ZINC000503417628 912407181 /nfs/dbraw/zinc/40/71/81/912407181.db2.gz VXHFXJYKYSQEBH-CQSZACIVSA-N 0 3 414.351 4.238 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)N2CC[C@@H](C)C[C@H]2c2ccco2)CC1 ZINC000465553861 879020212 /nfs/dbraw/zinc/02/02/12/879020212.db2.gz WYSJEGIXLWZUHA-OFNKIYASSA-N 0 3 424.589 4.100 20 0 HIADHN C[C@@H](NC(=O)N[C@H](CN1CCCC1)c1ccccc1)c1ccc(-n2cccn2)cc1 ZINC000465588070 879068163 /nfs/dbraw/zinc/06/81/63/879068163.db2.gz BKIJGYMLEZPDBQ-AUSIDOKSSA-N 0 3 403.530 4.070 20 0 HIADHN C[C@@H]1CN(C(=O)N[C@@H](CN2CCCC2)c2ccccc2)C[C@@H](c2ccc(F)cc2)O1 ZINC000465605989 879098844 /nfs/dbraw/zinc/09/88/44/879098844.db2.gz QJISIEGHFFUCHV-LEOXJPRUSA-N 0 3 411.521 4.134 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)c2cnc(-c3ccc(F)c(F)c3)s2)o1 ZINC000503425972 912418219 /nfs/dbraw/zinc/41/82/19/912418219.db2.gz GDGFVECWLNQFES-UHFFFAOYSA-N 0 3 405.470 4.194 20 0 HIADHN CN(C)CCN(C[C@H]1CCCO1)C(=O)N[C@@H](c1ccccc1)c1cccc(Cl)c1 ZINC000465623427 879131349 /nfs/dbraw/zinc/13/13/49/879131349.db2.gz CGOZCKKDPTYELO-YADHBBJMSA-N 0 3 415.965 4.182 20 0 HIADHN C[C@@H]1CCN(C(=O)NCc2ccc(OC(F)F)cc2)CCN1Cc1ccccc1 ZINC000465643506 879161072 /nfs/dbraw/zinc/16/10/72/879161072.db2.gz XMYGLFRWPHIMPA-QGZVFWFLSA-N 0 3 403.473 4.094 20 0 HIADHN C[C@H]1CCN(C(=O)NCC2(c3ccccc3)CCOCC2)CCN1Cc1ccccc1 ZINC000465654165 879179199 /nfs/dbraw/zinc/17/91/99/879179199.db2.gz HZKHPIQZQVPFTI-QFIPXVFZSA-N 0 3 421.585 4.041 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)N1CC[C@@H](CSc2ccccc2)C1 ZINC000465655061 879179556 /nfs/dbraw/zinc/17/95/56/879179556.db2.gz IXVDLXPOZZSANU-LJQANCHMSA-N 0 3 419.660 4.172 20 0 HIADHN CSc1ccc(F)cc1CNC(=O)NCC(C)(C)N1CCc2ccccc2C1 ZINC000465694924 879250587 /nfs/dbraw/zinc/25/05/87/879250587.db2.gz QMNZAPRYOQDURZ-UHFFFAOYSA-N 0 3 401.551 4.184 20 0 HIADHN C[C@@H]1CCN(C(=O)NC[C@H]2CCCO[C@@H]2c2ccccc2)CCN1Cc1ccccc1 ZINC000465730793 879311522 /nfs/dbraw/zinc/31/15/22/879311522.db2.gz WEFKEPGYRCAFQP-NQHRYMMQSA-N 0 3 421.585 4.460 20 0 HIADHN C[C@@H](CNC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1)COCc1ccccc1 ZINC000465757838 879352449 /nfs/dbraw/zinc/35/24/49/879352449.db2.gz PWMPDRSCZKDJFC-FCHUYYIVSA-N 0 3 409.574 4.145 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1)c1ccc(-n2cccn2)cc1 ZINC000465767186 879366204 /nfs/dbraw/zinc/36/62/04/879366204.db2.gz YWDIVGJZDZAFLQ-CNNODRBYSA-N 0 3 403.530 4.068 20 0 HIADHN Cc1cccn2c(=O)cc(CN3CCC(c4ccc(Br)cc4)CC3)nc12 ZINC000503439414 912453047 /nfs/dbraw/zinc/45/30/47/912453047.db2.gz VIZFXIULJIHPCX-UHFFFAOYSA-N 0 3 412.331 4.145 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)N[C@@H](C)c2ccccc2Oc2ccccc2)CC1 ZINC000465799307 879409197 /nfs/dbraw/zinc/40/91/97/879409197.db2.gz IIZMBLOZZVXDTQ-RTWAWAEBSA-N 0 3 424.589 4.113 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)NC(C)(C)c2nc(C(F)(F)F)cs2)N(C)C)cc1 ZINC000465822136 879449967 /nfs/dbraw/zinc/44/99/67/879449967.db2.gz UWKODCWBVAZRFS-CQSZACIVSA-N 0 3 414.497 4.308 20 0 HIADHN CCC[C@@H](NC(=O)NC[C@H](C)CN1CCN(C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000465824986 879454003 /nfs/dbraw/zinc/45/40/03/879454003.db2.gz AMWAUNFANAVXIV-HNAYVOBHSA-N 0 3 415.409 4.017 20 0 HIADHN COc1ccccc1C[C@@H](C)N(C)C(=O)NC[C@H](c1ccc(C)cc1)N1CCCC1 ZINC000465825671 879454933 /nfs/dbraw/zinc/45/49/33/879454933.db2.gz HLWYRLCJJDXXNT-NFBKMPQASA-N 0 3 409.574 4.413 20 0 HIADHN CCO[C@H](C)c1nc(CN(C)C(=O)NC[C@@H]2CCCN2Cc2ccccc2)cs1 ZINC000465931518 879594943 /nfs/dbraw/zinc/59/49/43/879594943.db2.gz NRXJESSXNWOIQL-XLIONFOSSA-N 0 3 416.591 4.047 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)N[C@@H](CC(C)(C)C)c2ccc(Cl)cc2)CC1 ZINC000465964625 879632664 /nfs/dbraw/zinc/63/26/64/879632664.db2.gz GMKBLAZGUQWWJI-NQIIRXRSSA-N 0 3 423.045 4.390 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)N[C@H](CC(C)C)c2ccc(Cl)cc2)CC1 ZINC000465968828 879637923 /nfs/dbraw/zinc/63/79/23/879637923.db2.gz OEXPIEYKFWQLLD-GHTZIAJQSA-N 0 3 409.018 4.000 20 0 HIADHN Cc1cc([C@H](NC(=O)N[C@@H]2CCN(C3CC3)C2)c2ccccc2Cl)ccc1F ZINC000466014770 879697302 /nfs/dbraw/zinc/69/73/02/879697302.db2.gz JKENNBWTJJXEKG-IERDGZPVSA-N 0 3 401.913 4.413 20 0 HIADHN COc1cccc([C@@H](Cc2cc(C)cc(C)c2)NC(=O)N2CCN(C)CC[C@H]2C)c1 ZINC000466036675 879726086 /nfs/dbraw/zinc/72/60/86/879726086.db2.gz OVLVCRURDXOFCX-HYBUGGRVSA-N 0 3 409.574 4.331 20 0 HIADHN COc1cccc([C@@H](NC(=O)N2CCN(C)CC[C@@H]2C)c2ccccc2Cl)c1 ZINC000466041219 879730008 /nfs/dbraw/zinc/73/00/08/879730008.db2.gz OPUSVGKWQGFXHA-HRAATJIYSA-N 0 3 401.938 4.174 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NC[C@H]3CCO[C@H]3c3ccccc3)c(C)c2)CC1 ZINC000466065789 879765415 /nfs/dbraw/zinc/76/54/15/879765415.db2.gz TZZCZZBZKCIFKU-QPPBQGQZSA-N 0 3 422.573 4.036 20 0 HIADHN CN(C)Cc1cccc(NC(=O)NCCOc2ncc(C(F)(F)F)cc2Cl)c1 ZINC000466074982 879782391 /nfs/dbraw/zinc/78/23/91/879782391.db2.gz GHJRNGVPVIIPLW-UHFFFAOYSA-N 0 3 416.831 4.016 20 0 HIADHN C[C@@H]1C[C@H]1[C@H](NC(=O)N(CCN(C)C)Cc1ccccn1)c1ccc(Cl)cc1 ZINC000466152644 879858187 /nfs/dbraw/zinc/85/81/87/879858187.db2.gz PARAPDWFIIWOBK-MAODMQOUSA-N 0 3 400.954 4.206 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NC[C@@H](C)Oc3ccc(C)cc3)c(C)c2)CC1 ZINC000466163255 879866001 /nfs/dbraw/zinc/86/60/01/879866001.db2.gz JOAXTIIJSZIPOQ-HXUWFJFHSA-N 0 3 410.562 4.034 20 0 HIADHN Cc1ccccc1C1(CNC(=O)N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)CCOCC1 ZINC000466225316 879925069 /nfs/dbraw/zinc/92/50/69/879925069.db2.gz KZZKTEDMCITAGB-GMAHTHKFSA-N 0 3 421.585 4.005 20 0 HIADHN C[C@@H]1CCN(C)CCN1C(=O)N[C@H](c1ccccc1Cl)c1cc(F)ccc1F ZINC000466236992 879943680 /nfs/dbraw/zinc/94/36/80/879943680.db2.gz ANMKQWDXRCGJEN-JLTOFOAXSA-N 0 3 407.892 4.443 20 0 HIADHN CSc1cccc([C@H](NC(=O)N2CCCN(C)CC2)c2ccc(F)c(F)c2)c1 ZINC000466266625 880000262 /nfs/dbraw/zinc/00/02/62/880000262.db2.gz ILOLINKMMAYKFH-FQEVSTJZSA-N 0 3 405.514 4.123 20 0 HIADHN C[C@H](CNC(=O)Nc1cccc(CN(C)C)c1)Oc1cccc(Br)c1 ZINC000466299825 880047859 /nfs/dbraw/zinc/04/78/59/880047859.db2.gz QLSKSAITRNTJDZ-CQSZACIVSA-N 0 3 406.324 4.100 20 0 HIADHN COc1ccc(C(=O)Nc2ccc(C(=O)N(CCN(C)C)c3ccccc3)s2)cc1 ZINC000466314342 880068394 /nfs/dbraw/zinc/06/83/94/880068394.db2.gz NDTPKSJVMIOLME-UHFFFAOYSA-N 0 3 423.538 4.217 20 0 HIADHN CO[C@@H](CNC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C)c1cccc(Cl)c1 ZINC000466343844 880101326 /nfs/dbraw/zinc/10/13/26/880101326.db2.gz PSKNVVLDALMJIF-AVRDEDQJSA-N 0 3 415.965 4.334 20 0 HIADHN CCC(CC)(CNC(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1)c1ccccc1 ZINC000466350594 880108125 /nfs/dbraw/zinc/10/81/25/880108125.db2.gz UPMVHZHRCAGLRR-OYRHEFFESA-N 0 3 415.622 4.275 20 0 HIADHN C[C@@H](CNC(=O)N(CCN(C)C)Cc1ccc(F)cc1F)c1ccc(F)cc1F ZINC000466428303 880202847 /nfs/dbraw/zinc/20/28/47/880202847.db2.gz KSRTVTVWJCZUCV-AWEZNQCLSA-N 0 3 411.443 4.120 20 0 HIADHN COc1ccc(C(=O)Nc2ccc(C(=O)NC[C@H](C)N3CCCC[C@H]3C)s2)cc1 ZINC000466457259 880237671 /nfs/dbraw/zinc/23/76/71/880237671.db2.gz RGMGRXBRDIVGJK-CVEARBPZSA-N 0 3 415.559 4.002 20 0 HIADHN CCOc1cc(CN[C@H]2CCCc3sccc32)ccc1O[C@@H](C)C(=O)N(C)C ZINC000466461284 880242256 /nfs/dbraw/zinc/24/22/56/880242256.db2.gz GYMVTRXBXAVRLD-YJBOKZPZSA-N 0 3 402.560 4.170 20 0 HIADHN C[C@H](C(=O)Nc1ccc2c(c1)OC1(CCCCC1)O2)N(C)CCC1CCOCC1 ZINC000466464620 880246570 /nfs/dbraw/zinc/24/65/70/880246570.db2.gz LSKRHONFWLVHLO-QGZVFWFLSA-N 0 3 402.535 4.194 20 0 HIADHN COc1ccc([C@H](CNC(=O)Nc2cccc(NC(=O)C(C)C)c2)N2CCCC2)cc1 ZINC000503498990 912546649 /nfs/dbraw/zinc/54/66/49/912546649.db2.gz PWSMSWIMZWHLGY-QFIPXVFZSA-N 0 3 424.545 4.248 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1C[C@@H](C)N(Cc2ccccc2)C1)c1ncc(-c2ccccc2)o1 ZINC000466504684 880279403 /nfs/dbraw/zinc/27/94/03/880279403.db2.gz NJJWMOAWKJXJHB-LVCYWYKZSA-N 0 3 404.514 4.365 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)Nc2ccc(OC[C@H]3CCCO3)cc2)CN1Cc1ccccc1 ZINC000466514316 880288189 /nfs/dbraw/zinc/28/81/89/880288189.db2.gz KXSFVRZVDDGNHO-JMUQELJHSA-N 0 3 409.530 4.029 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)cc1OC ZINC000466517007 880291693 /nfs/dbraw/zinc/29/16/93/880291693.db2.gz TYRFQJYAJIPLKZ-NYVOZVTQSA-N 0 3 423.557 4.213 20 0 HIADHN C[C@H]1C[C@H](NC(=O)N2CC=C(c3c[nH]c4ncccc34)CC2)CN1Cc1ccccc1 ZINC000466519265 880295045 /nfs/dbraw/zinc/29/50/45/880295045.db2.gz PJFJJLUXCBFUSU-RXVVDRJESA-N 0 3 415.541 4.025 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)Nc2ccccc2N2C[C@@H](C)O[C@@H](C)C2)CN1Cc1ccccc1 ZINC000466530053 880305058 /nfs/dbraw/zinc/30/50/58/880305058.db2.gz UMONKAQYRHXBOK-XWSHUIEDSA-N 0 3 422.573 4.085 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1C[C@H](C)N(Cc2ccccc2)C1)c1nc(C2CCCCC2)no1 ZINC000466533824 880308298 /nfs/dbraw/zinc/30/82/98/880308298.db2.gz KDQLTYUIDCBMOC-ABSDTBQOSA-N 0 3 411.550 4.141 20 0 HIADHN CN1CCN(CCC(C)(C)NC(=O)Nc2cc(Cl)ccc2OCC2CCC2)CC1 ZINC000466664420 880446323 /nfs/dbraw/zinc/44/63/23/880446323.db2.gz BGLNVRFTKFFOIS-UHFFFAOYSA-N 0 3 423.001 4.057 20 0 HIADHN Cc1ccc(-c2nc(CNC(=O)N(CCN(C)C)Cc3ccc(F)cc3)co2)cc1 ZINC000466768354 880548843 /nfs/dbraw/zinc/54/88/43/880548843.db2.gz VTIHUXMEDJDEJC-UHFFFAOYSA-N 0 3 410.493 4.063 20 0 HIADHN CSc1ccc([C@@H](C)NC(=O)N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)cc1 ZINC000466847240 880617033 /nfs/dbraw/zinc/61/70/33/880617033.db2.gz TWXKRSJRCFXVRJ-FGTMMUONSA-N 0 3 405.608 4.000 20 0 HIADHN CSc1ccc([C@@H](C)NC(=O)N2CCC(CN3C[C@H](C)O[C@@H](C)C3)CC2)cc1 ZINC000466847242 880617747 /nfs/dbraw/zinc/61/77/47/880617747.db2.gz TWXKRSJRCFXVRJ-OKZBNKHCSA-N 0 3 405.608 4.000 20 0 HIADHN Cc1ccc(C[C@H](CO)NCc2cccc(Br)c2OC(F)F)cc1 ZINC000466897046 880663654 /nfs/dbraw/zinc/66/36/54/880663654.db2.gz WBOHMOQWMXSSAI-OAHLLOKOSA-N 0 3 400.263 4.052 20 0 HIADHN C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)N(C)[C@H]1CCSc2ccc(Br)cc21 ZINC000466921329 880689120 /nfs/dbraw/zinc/68/91/20/880689120.db2.gz KAIDXXCWQQDSNT-JLZZUVOBSA-N 0 3 424.408 4.110 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)NCc1ccc(-c2cccnc2)cc1 ZINC000466947525 880722102 /nfs/dbraw/zinc/72/21/02/880722102.db2.gz AHKDITNXFCVQRL-UHFFFAOYSA-N 0 3 406.505 4.161 20 0 HIADHN C[C@H](NC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1)c1ccc(-n2cccn2)cc1 ZINC000466964249 880757751 /nfs/dbraw/zinc/75/77/51/880757751.db2.gz JJRJRSCDILUYOJ-RTWAWAEBSA-N 0 3 417.557 4.239 20 0 HIADHN CC(C)c1ccc(C(=O)Nc2ccccc2CN2CCC[C@H](C(N)=O)C2)cc1Cl ZINC000466998042 880807988 /nfs/dbraw/zinc/80/79/88/880807988.db2.gz MQYKNGWSENRWMB-SFHVURJKSA-N 0 3 413.949 4.413 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1CCN(Cc2ccccc2)[C@H]1C)c1nc(C(F)(F)F)cs1 ZINC000503546115 912610461 /nfs/dbraw/zinc/61/04/61/912610461.db2.gz FEFRZAUNXCKDAO-KCQAQPDRSA-N 0 3 412.481 4.185 20 0 HIADHN C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)[C@H](Sc1ccc(F)c(F)c1)c1ccccc1 ZINC000467023325 880824576 /nfs/dbraw/zinc/82/45/76/880824576.db2.gz KPJQMDNTADMINF-XMDBHEJHSA-N 0 3 402.510 4.397 20 0 HIADHN C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)[C@@H](Sc1ccc(F)c(F)c1)c1ccccc1 ZINC000467023323 880824869 /nfs/dbraw/zinc/82/48/69/880824869.db2.gz KPJQMDNTADMINF-OREJSRFESA-N 0 3 402.510 4.397 20 0 HIADHN Cc1ccc(C(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)cc1NC(=O)c1ccco1 ZINC000467024037 880824995 /nfs/dbraw/zinc/82/49/95/880824995.db2.gz SFIIMUOVWCRUOI-GHTZIAJQSA-N 0 3 417.509 4.233 20 0 HIADHN Cc1nc(CCC(=O)N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)oc1-c1ccccc1 ZINC000467028898 880829016 /nfs/dbraw/zinc/82/90/16/880829016.db2.gz NTUQBJOMFPLLMP-GCJKJVERSA-N 0 3 403.526 4.362 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)N[C@H](C)c2nc(C3CCCCC3)no2)c1 ZINC000467037347 880834433 /nfs/dbraw/zinc/83/44/33/880834433.db2.gz ZRMUCACTQIUXOF-GOSISDBHSA-N 0 3 413.566 4.260 20 0 HIADHN c1cc(Oc2ccccc2)oc1CNc1ccc2nc(CCN3CCOCC3)[nH]c2c1 ZINC000503547741 912612219 /nfs/dbraw/zinc/61/22/19/912612219.db2.gz ZYRWPRGYJQQXSG-UHFFFAOYSA-N 0 3 418.497 4.435 20 0 HIADHN C[C@H]1C[C@H](NC(=O)c2cnn(C(C)(C)C)c2C(F)(F)F)CN1Cc1ccccc1 ZINC000467051730 880843277 /nfs/dbraw/zinc/84/32/77/880843277.db2.gz RHYLXJIJFOADEU-HOCLYGCPSA-N 0 3 408.468 4.050 20 0 HIADHN Cc1cccc(-c2nc(CC(=O)N[C@H]3C[C@H](C)N(Cc4ccccc4)C3)cs2)c1 ZINC000467054367 880844036 /nfs/dbraw/zinc/84/40/36/880844036.db2.gz SFRCJNZKQDSLBO-RXVVDRJESA-N 0 3 405.567 4.440 20 0 HIADHN Cc1cccc(-c2nc(CC(=O)N[C@@H]3C[C@H](C)N(Cc4ccccc4)C3)cs2)c1 ZINC000467054365 880844243 /nfs/dbraw/zinc/84/42/43/880844243.db2.gz SFRCJNZKQDSLBO-GHTZIAJQSA-N 0 3 405.567 4.440 20 0 HIADHN COc1ccc(C(C)(C)C(=O)N2CCCN(CCCc3ccccc3)CC2)cc1OC ZINC000467101370 880863580 /nfs/dbraw/zinc/86/35/80/880863580.db2.gz MREZJQYVGVUHBQ-UHFFFAOYSA-N 0 3 424.585 4.149 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)[C@H]1CCCc2n[nH]cc21)c1ccc(C(F)(F)F)cc1 ZINC000467107644 880866587 /nfs/dbraw/zinc/86/65/87/880866587.db2.gz SNGUMJLNYVHDLR-LPHOPBHVSA-N 0 3 408.468 4.048 20 0 HIADHN Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)N[C@H]1C[C@@H](C)N(Cc2ccccc2)C1 ZINC000467107349 880866933 /nfs/dbraw/zinc/86/69/33/880866933.db2.gz PPQSHKIGIRBOIS-KNQAVFIVSA-N 0 3 422.573 4.165 20 0 HIADHN Cc1cc(Oc2ncccn2)ccc1NC(=O)N[C@H]1C[C@H](C)N(Cc2ccccc2)C1 ZINC000467109499 880868676 /nfs/dbraw/zinc/86/86/76/880868676.db2.gz GYJYRLPUPFQOOK-ICSRJNTNSA-N 0 3 417.513 4.362 20 0 HIADHN COC[C@@H]1CCCCN(CC(=O)N[C@@H](c2ccccc2)c2ccc(Cl)cc2)C1 ZINC000467117758 880874728 /nfs/dbraw/zinc/87/47/28/880874728.db2.gz GNKPUKDODFOFLU-JPYJTQIMSA-N 0 3 400.950 4.294 20 0 HIADHN Cc1c(NC(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)cccc1C(=O)N1CCCC1 ZINC000467118358 880875732 /nfs/dbraw/zinc/87/57/32/880875732.db2.gz WKBMAUXDTJZGGN-GHTZIAJQSA-N 0 3 420.557 4.016 20 0 HIADHN COC[C@@H]1CCCCN(CC(=O)NC[C@H](c2c[nH]c3ccccc32)c2ccccc2)C1 ZINC000467121181 880876820 /nfs/dbraw/zinc/87/68/20/880876820.db2.gz VCDGSWOHXSVGSZ-OFNKIYASSA-N 0 3 419.569 4.165 20 0 HIADHN CC[C@@H]1Oc2cc([C@H](C)NC(=O)c3oc4ccccc4c3CN(C)C)ccc2NC1=O ZINC000467125040 880879256 /nfs/dbraw/zinc/87/92/56/880879256.db2.gz GQBLONRNTLDLEV-LIRRHRJNSA-N 0 3 421.497 4.095 20 0 HIADHN COC(=O)COc1ccc([C@H](C)N[C@H](C)C(=O)Nc2ccc(C(C)(C)C)cc2)cc1 ZINC000467189908 880917476 /nfs/dbraw/zinc/91/74/76/880917476.db2.gz CMPPGKWRSAZDLI-DLBZAZTESA-N 0 3 412.530 4.214 20 0 HIADHN C[C@@H](c1cccc(N2CCCS2(=O)=O)c1)N(C)C[C@H]1CCC2(CCCCC2)O1 ZINC000467189949 880917655 /nfs/dbraw/zinc/91/76/55/880917655.db2.gz DISPJFALWUTBAD-GHTZIAJQSA-N 0 3 406.592 4.101 20 0 HIADHN COC[C@H]1CCCCN([C@H](C)C(=O)Nc2ccc3c(c2)OC2(CCCCC2)O3)C1 ZINC000467298612 881043937 /nfs/dbraw/zinc/04/39/37/881043937.db2.gz FSENUTANRQIQCQ-MSOLQXFVSA-N 0 3 402.535 4.194 20 0 HIADHN O=C([C@H]1CCCc2[nH]ncc21)N1CCN(Cc2ccc(-c3ccccc3F)s2)CC1 ZINC000467300483 881048972 /nfs/dbraw/zinc/04/89/72/881048972.db2.gz DKIPQBBKSHIBKP-KRWDZBQOSA-N 0 3 424.545 4.042 20 0 HIADHN O=C([C@@H]1CCCc2[nH]ncc21)N1CCN(Cc2ccc(-c3ccccc3F)s2)CC1 ZINC000467300484 881049198 /nfs/dbraw/zinc/04/91/98/881049198.db2.gz DKIPQBBKSHIBKP-QGZVFWFLSA-N 0 3 424.545 4.042 20 0 HIADHN CC(C)C[C@@H](N[C@@H](C)Cc1cccc(C(F)(F)F)c1)c1nc(-c2nc[nH]n2)no1 ZINC000467334753 881084748 /nfs/dbraw/zinc/08/47/48/881084748.db2.gz OQQSSKXJLNIURY-SWLSCSKDSA-N 0 3 408.428 4.182 20 0 HIADHN CCOCCOCc1cccc(NC(=O)N2CCN(C3CCC(C)CC3)CC2)c1C ZINC000467354853 881116987 /nfs/dbraw/zinc/11/69/87/881116987.db2.gz FCAHPUAUWCABPW-UHFFFAOYSA-N 0 3 417.594 4.276 20 0 HIADHN COc1ccc2c(c1)[C@@H](NC[C@H](O)COc1cccc(C(F)(F)F)c1)CCS2 ZINC000467418421 881207334 /nfs/dbraw/zinc/20/73/34/881207334.db2.gz JYHJMUKBMABHGA-KSSFIOAISA-N 0 3 413.461 4.280 20 0 HIADHN CN(C)c1cccc(CN[C@H](c2cccc(Br)c2)C2CCOCC2)n1 ZINC000467424337 881212365 /nfs/dbraw/zinc/21/23/65/881212365.db2.gz SDTHYSFJAUZBRR-FQEVSTJZSA-N 0 3 404.352 4.168 20 0 HIADHN Cc1c([C@H](C)NCCN2CCc3ccccc3C2=O)cnn1-c1cc(C)ccc1C ZINC000467427778 881219634 /nfs/dbraw/zinc/21/96/34/881219634.db2.gz HRULWPYMNFOSTF-IBGZPJMESA-N 0 3 402.542 4.147 20 0 HIADHN CCN(CC)C(=O)Nc1ccc([C@H](C)N[C@H]2CC(=O)N(Cc3ccccc3)[C@@H]2C)cc1 ZINC000467433697 881228984 /nfs/dbraw/zinc/22/89/84/881228984.db2.gz KKOOXIZASPJQHV-YYDVJCTNSA-N 0 3 422.573 4.401 20 0 HIADHN CCN(CC)C(=O)c1ccc(NC(=O)N(CCN(C)C)C2CCCC2)cc1Cl ZINC000467445266 881248377 /nfs/dbraw/zinc/24/83/77/881248377.db2.gz KOSGABAGMMDEQW-UHFFFAOYSA-N 0 3 408.974 4.160 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)c(Cl)c1 ZINC000467463606 881273843 /nfs/dbraw/zinc/27/38/43/881273843.db2.gz HBEXNYANKGTGAN-KSSFIOAISA-N 0 3 400.910 4.083 20 0 HIADHN Cc1c2cc(F)ccc2sc1C(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000467504405 881320251 /nfs/dbraw/zinc/32/02/51/881320251.db2.gz RKRYGMWIBKBCBC-UHFFFAOYSA-N 0 3 412.530 4.236 20 0 HIADHN CSc1ccc([C@@H](C)N[C@@H](C)C(=O)N[C@H](C)c2ccc3c(c2)OCCO3)cc1 ZINC000503587393 912670786 /nfs/dbraw/zinc/67/07/86/912670786.db2.gz TVOBQHVIOCSPQU-OAGGEKHMSA-N 0 3 400.544 4.096 20 0 HIADHN CC(C)Cn1ccc2c1cccc2C(=O)N1CCC(CN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000469065565 883141680 /nfs/dbraw/zinc/14/16/80/883141680.db2.gz RTYWHIFAXANSHX-PMACEKPBSA-N 0 3 411.590 4.259 20 0 HIADHN CC(C)Cn1ccc2c1cccc2C(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000469065435 883142254 /nfs/dbraw/zinc/14/22/54/883142254.db2.gz RTYWHIFAXANSHX-BGYRXZFFSA-N 0 3 411.590 4.259 20 0 HIADHN CC(C)[C@H](CNC(=O)N(C)C1CCN(CCc2ccccn2)CC1)Cc1ccccc1 ZINC000469068882 883149060 /nfs/dbraw/zinc/14/90/60/883149060.db2.gz QGTBEGSACWJGOL-QHCPKHFHSA-N 0 3 422.617 4.245 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)N3C[C@@H](c4ccc(F)cc4)C[C@@H]3C)CC2)c1 ZINC000469095760 883185588 /nfs/dbraw/zinc/18/55/88/883185588.db2.gz VGSVIKRWNBEICZ-UNMCSNQZSA-N 0 3 409.549 4.051 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)NCc1ccc(C(=O)OC(C)(C)C)cc1 ZINC000469094794 883185688 /nfs/dbraw/zinc/18/56/88/883185688.db2.gz BCGVBPPIUGGRIQ-UHFFFAOYSA-N 0 3 408.498 4.380 20 0 HIADHN C[C@@H](N[C@H]1CCCN(Cc2ccc(F)cc2F)C1=O)c1ccc2ncsc2c1 ZINC000469154426 883252586 /nfs/dbraw/zinc/25/25/86/883252586.db2.gz YTYYRYDGYIWCHR-YJYMSZOUSA-N 0 3 401.482 4.416 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3ccc(Oc4ccc(F)cc4)cn3)cc2)CC1 ZINC000469211657 883311767 /nfs/dbraw/zinc/31/17/67/883311767.db2.gz WPXKXCGRYOHTAG-UHFFFAOYSA-N 0 3 420.488 4.407 20 0 HIADHN COc1cccc([C@@H](C)CCCC(=O)NC[C@@H]2CN(Cc3ccccc3)CCCO2)c1 ZINC000469235400 883334478 /nfs/dbraw/zinc/33/44/78/883334478.db2.gz SVFRQDURCGBDCN-SQJMNOBHSA-N 0 3 424.585 4.376 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@H](C)N[C@@H](C)c2cnn(C(C)C)c2C)CC1 ZINC000469240410 883339195 /nfs/dbraw/zinc/33/91/95/883339195.db2.gz PTQIYXKLGWMHOT-ROUUACIJSA-N 0 3 401.574 4.465 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CCC(OC(C)(C)C)CC1)c1cccc(OC)c1 ZINC000469245048 883343334 /nfs/dbraw/zinc/34/33/34/883343334.db2.gz JJRFDSQXEJNOHJ-NRFANRHFSA-N 0 3 405.583 4.067 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)Cc3cccc(Cl)c3Cl)CC2)C[C@H](C)O1 ZINC000469307845 883407538 /nfs/dbraw/zinc/40/75/38/883407538.db2.gz VTOJJIQILJDCNG-HOTGVXAUSA-N 0 3 413.389 4.274 20 0 HIADHN COc1cccc([C@H](C)CCCC(=O)N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)c1 ZINC000469318129 883421344 /nfs/dbraw/zinc/42/13/44/883421344.db2.gz XBWFSHWSBRGLIF-NJYVYQBISA-N 0 3 416.606 4.317 20 0 HIADHN CC(C)[C@H](CNC(=O)N(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1)Cc1ccccc1 ZINC000469335214 883447199 /nfs/dbraw/zinc/44/71/99/883447199.db2.gz LJVPWWCRHXIVJS-HJOGWXRNSA-N 0 3 408.590 4.231 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)N1CCC(OC2CCCC2)CC1 ZINC000469430875 883615326 /nfs/dbraw/zinc/61/53/26/883615326.db2.gz XKASKVZTTXPMQK-QHCPKHFHSA-N 0 3 401.595 4.276 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)N1CCC(n2cc(Cl)cn2)CC1 ZINC000469441409 883633647 /nfs/dbraw/zinc/63/36/47/883633647.db2.gz VAESEEHEWCDLEX-OAQYLSRUSA-N 0 3 417.985 4.040 20 0 HIADHN CC(C)N(C)C(=O)C1CCN(C(=O)CN(Cc2ccccc2)[C@H](C)C(C)(C)C)CC1 ZINC000469444033 883638409 /nfs/dbraw/zinc/63/84/09/883638409.db2.gz FYUFEEUQBBXVHQ-HXUWFJFHSA-N 0 3 415.622 4.029 20 0 HIADHN Cc1nc(-c2ccccc2)sc1[C@@H](C)N(C)CCc1nnnn1-c1ccccc1 ZINC000469449106 883648699 /nfs/dbraw/zinc/64/86/99/883648699.db2.gz XXRIKHUBZHRENF-QGZVFWFLSA-N 0 3 404.543 4.330 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)[C@@H]3C[C@H]3c3ccc(Cl)s3)CC2)C[C@H](C)O1 ZINC000469528304 883800407 /nfs/dbraw/zinc/80/04/07/883800407.db2.gz BQQHCQUXRYCQPG-CWLKWCNXSA-N 0 3 411.011 4.243 20 0 HIADHN CCN1CCN(c2ccc(C(=O)NCCCO[C@H]3CCCc4ccccc43)cc2)CC1 ZINC000469530116 883801269 /nfs/dbraw/zinc/80/12/69/883801269.db2.gz ZKXGCHYWZICNJS-VWLOTQADSA-N 0 3 421.585 4.043 20 0 HIADHN CC(C)n1c2ccccc2nc1[C@H](C)NC(=O)CCN1CCN(c2ccccc2)CC1 ZINC000469552224 883811095 /nfs/dbraw/zinc/81/10/95/883811095.db2.gz POORONPXRMAFPC-FQEVSTJZSA-N 0 3 419.573 4.007 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)[C@H](C)Oc2cccc3ccccc32)CC1 ZINC000469692512 883874185 /nfs/dbraw/zinc/87/41/85/883874185.db2.gz ISURDYMSZCGNHQ-MOPGFXCFSA-N 0 3 403.526 4.344 20 0 HIADHN CC[C@@H](NCc1cccc(C(=O)N2CCOCC2)c1)c1cccc(Br)c1 ZINC000469812236 883987646 /nfs/dbraw/zinc/98/76/46/883987646.db2.gz XPUWNLNWBXETQM-HXUWFJFHSA-N 0 3 417.347 4.162 20 0 HIADHN Cc1ccc(C(=O)CCCCC(=O)NC[C@H]2CN(Cc3ccccc3)CCCO2)cc1 ZINC000469828744 884007260 /nfs/dbraw/zinc/00/72/60/884007260.db2.gz FBFINBGTHZSLHQ-DEOSSOPVSA-N 0 3 422.569 4.145 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)N[C@@H](C)c2ccc(OCC3CC3)c(F)c2)o1 ZINC000469833241 884012728 /nfs/dbraw/zinc/01/27/28/884012728.db2.gz XPVYIWLRFOKUMP-KRWDZBQOSA-N 0 3 417.525 4.350 20 0 HIADHN C[C@@H](CC(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1)c1c[nH]c2ccccc21 ZINC000469849802 884032954 /nfs/dbraw/zinc/03/29/54/884032954.db2.gz AMSVEXVQGJTKIG-FPOVZHCZSA-N 0 3 405.542 4.069 20 0 HIADHN O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)c1ccccc1CCC(F)(F)F ZINC000469857967 884043238 /nfs/dbraw/zinc/04/32/38/884043238.db2.gz ZQBUPHNUINIQMD-HXUWFJFHSA-N 0 3 420.475 4.202 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)c2ccc(Cl)c(N)c2Cl)cc1 ZINC000469878920 884069895 /nfs/dbraw/zinc/06/98/95/884069895.db2.gz DATZBKBGBNKBFU-KRWDZBQOSA-N 0 3 408.329 4.151 20 0 HIADHN Cc1ccc(CCN(Cc2ccco2)C(=O)CC2(N3CCOCC3)CCCC2)cc1 ZINC000469924936 884116935 /nfs/dbraw/zinc/11/69/35/884116935.db2.gz CBLNRDPYMGMSOD-UHFFFAOYSA-N 0 3 410.558 4.194 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)N[C@@H](c2nc3ccccc3[nH]2)C(C)C)N(C)C)cc1 ZINC000503682237 912790049 /nfs/dbraw/zinc/79/00/49/912790049.db2.gz RIGMCUXZMXBDEW-FGZHOGPDSA-N 0 3 407.562 4.425 20 0 HIADHN Brc1ccccc1-c1noc([C@@H]2CCCN2CCN2CCCCC2)n1 ZINC000469980457 884193840 /nfs/dbraw/zinc/19/38/40/884193840.db2.gz CYPSJZHRZPBUOI-KRWDZBQOSA-N 0 3 405.340 4.122 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1C[C@H](C)O[C@@H](c2ccsc2)C1)c1ccsc1 ZINC000470042788 884284389 /nfs/dbraw/zinc/28/43/89/884284389.db2.gz OBJBKGUFZORXTK-KFKAGJAMSA-N 0 3 407.605 4.364 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@H]2NC(=O)NC[C@H](c2ccccc2)N2CCCC2)cc1 ZINC000470062895 884315964 /nfs/dbraw/zinc/31/59/64/884315964.db2.gz SQGBJYXZVRDKBX-SMIHKQSGSA-N 0 3 407.558 4.351 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)Nc1ccc2c(c1)OC1(CCCCC1)O2 ZINC000503751424 912815829 /nfs/dbraw/zinc/81/58/29/912815829.db2.gz DFSGABKHPSOZFE-UHFFFAOYSA-N 0 3 410.518 4.109 20 0 HIADHN CC[C@H](C)[C@H](NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1)C(F)(F)F ZINC000470122380 884384058 /nfs/dbraw/zinc/38/40/58/884384058.db2.gz NQYLQRXJYHTSHO-RSUZKEPVSA-N 0 3 403.411 4.068 20 0 HIADHN O=C(NC[C@H]1CCCCN1C1CC1)c1cc(C(F)(F)F)ccc1Br ZINC000470167533 884443419 /nfs/dbraw/zinc/44/34/19/884443419.db2.gz RIMYKNZDJOYXNM-CYBMUJFWSA-N 0 3 405.258 4.215 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)[C@H](OC1CCOCC1)c1ccccc1 ZINC000470166769 884444791 /nfs/dbraw/zinc/44/47/91/884444791.db2.gz HZIBBXAZHYGJLI-JWQCQUIFSA-N 0 3 424.585 4.196 20 0 HIADHN O=C(NC[C@@H]1CCCCN1C1CC1)c1ccc(Br)cc1C(F)(F)F ZINC000470170081 884448353 /nfs/dbraw/zinc/44/83/53/884448353.db2.gz OFQTYSOOKWVVPP-ZDUSSCGKSA-N 0 3 405.258 4.215 20 0 HIADHN COc1ccc([C@H](CO)N(C)Cc2cc(Br)cc3cccnc32)cc1 ZINC000470205783 884522113 /nfs/dbraw/zinc/52/21/13/884522113.db2.gz NZRHMBQVTLKFGQ-IBGZPJMESA-N 0 3 401.304 4.171 20 0 HIADHN Cc1cccc(CNC(=O)c2oc3ccccc3c2CN(C)C)c1Br ZINC000470314404 884689684 /nfs/dbraw/zinc/68/96/84/884689684.db2.gz RSTBOLMTMGQGTK-UHFFFAOYSA-N 0 3 401.304 4.495 20 0 HIADHN COc1cc(F)c(C(=O)N[C@H](CN2CCc3ccccc3C2)C(C)(C)C)cc1OC ZINC000470336592 884721576 /nfs/dbraw/zinc/72/15/76/884721576.db2.gz ILHNYVJHIRLHIB-JOCHJYFZSA-N 0 3 414.521 4.046 20 0 HIADHN Cc1cnccc1OC1CCN(C(=O)[C@H](C)N2CCC(Cc3ccccc3)CC2)CC1 ZINC000470403417 884807808 /nfs/dbraw/zinc/80/78/08/884807808.db2.gz JPHJRHFIMKXFHO-NRFANRHFSA-N 0 3 421.585 4.103 20 0 HIADHN O=C(Nc1nc2ccccc2s1)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000470440087 884837873 /nfs/dbraw/zinc/83/78/73/884837873.db2.gz BFBXSLXVXPWVAO-UHFFFAOYSA-N 0 3 414.506 4.100 20 0 HIADHN Cc1cccc(NC(=O)C[C@H](C)N[C@@H](Cn2ccccc2=O)c2ccccc2)c1C ZINC000503927302 912868678 /nfs/dbraw/zinc/86/86/78/912868678.db2.gz PDIMCZWOSIQLED-CVDCTZTESA-N 0 3 403.526 4.213 20 0 HIADHN C[C@H](NC(=O)NC[C@H](Cc1ccccc1)N(C)C)c1ccc(-c2ccncc2)cc1 ZINC000470471258 884862445 /nfs/dbraw/zinc/86/24/45/884862445.db2.gz VWGOFTUKLWXIFJ-CYFREDJKSA-N 0 3 402.542 4.282 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)N[C@H](C)c2ccc(-c3ccncc3)cc2)o1 ZINC000470487135 884875020 /nfs/dbraw/zinc/87/50/20/884875020.db2.gz PCBWAEDZCWXQEP-LJQANCHMSA-N 0 3 406.530 4.484 20 0 HIADHN C[C@H]1CN(C2CCOCC2)CCN1C(=O)C[C@H](Cc1ccccc1)c1ccccc1 ZINC000470490499 884877695 /nfs/dbraw/zinc/87/76/95/884877695.db2.gz UBLVUFNFCVJAGQ-URXFXBBRSA-N 0 3 406.570 4.115 20 0 HIADHN C[C@@H]1CN(C2CCOCC2)CCN1C(=O)CCCCc1ccc(Cl)c(Cl)c1 ZINC000470497908 884884921 /nfs/dbraw/zinc/88/49/21/884884921.db2.gz ONJAAQYUPSYWLP-MRXNPFEDSA-N 0 3 413.389 4.418 20 0 HIADHN Cc1nn(CC(C)C)c(C)c1CCC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470677145 885108598 /nfs/dbraw/zinc/10/85/98/885108598.db2.gz HFGAGURHXHRGHC-QHCPKHFHSA-N 0 3 410.606 4.212 20 0 HIADHN CC(C)c1nc(CCNC(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)cs1 ZINC000470719523 885162704 /nfs/dbraw/zinc/16/27/04/885162704.db2.gz IBZDAAPQWBXHHQ-FQEVSTJZSA-N 0 3 400.592 4.115 20 0 HIADHN CN(C(=O)NCc1cc(Br)cs1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470722201 885168950 /nfs/dbraw/zinc/16/89/50/885168950.db2.gz GJVZZCNLPZQOAS-QGZVFWFLSA-N 0 3 422.392 4.317 20 0 HIADHN CN(C(=O)NC[C@@H]1CCCO[C@@H]1c1ccccc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470726958 885177212 /nfs/dbraw/zinc/17/72/12/885177212.db2.gz PYBCQYPMYRMOPS-ISJGIBHGSA-N 0 3 421.585 4.460 20 0 HIADHN C[C@@H](COc1ccc(F)cc1F)NC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470731070 885184079 /nfs/dbraw/zinc/18/40/79/885184079.db2.gz BTYAEOGDYYAKCN-FXAWDEMLSA-N 0 3 417.500 4.038 20 0 HIADHN CN(C(=O)NCc1cc(-c2ccccc2)on1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470733030 885187672 /nfs/dbraw/zinc/18/76/72/885187672.db2.gz MWMRCSNYVJPHPS-JOCHJYFZSA-N 0 3 404.514 4.148 20 0 HIADHN C[C@@H]1CN(C(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)C[C@@H](c2ccsc2)O1 ZINC000470735990 885190753 /nfs/dbraw/zinc/19/07/53/885190753.db2.gz IAQSHWZCSAEWHR-BLIXFSHQSA-N 0 3 402.535 4.088 20 0 HIADHN COc1ccc(C(C)(C)CNC(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000470738219 885195676 /nfs/dbraw/zinc/19/56/76/885195676.db2.gz UGOUTTIZYQVPBO-QFIPXVFZSA-N 0 3 409.574 4.279 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)N(C)Cc2nc(C(F)(F)F)cs2)N(C)C)cc1 ZINC000470741002 885202873 /nfs/dbraw/zinc/20/28/73/885202873.db2.gz RYNGHEHUPHUDPU-OAHLLOKOSA-N 0 3 414.497 4.169 20 0 HIADHN CN(Cc1nc(C(F)(F)F)cs1)C(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000470744872 885207126 /nfs/dbraw/zinc/20/71/26/885207126.db2.gz QMTKJCRFFSKWBR-LBPRGKRZSA-N 0 3 418.510 4.202 20 0 HIADHN COc1ccc(OC)c([C@@H](C)NC(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000470745394 885209940 /nfs/dbraw/zinc/20/99/40/885209940.db2.gz PCZIMASQXUNWOT-UYAOXDASSA-N 0 3 411.546 4.071 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CC[C@@H](COc2ccccc2)C1)c1ccsc1 ZINC000504010960 912915683 /nfs/dbraw/zinc/91/56/83/912915683.db2.gz XZRKLGOCXXTFHU-WIYYLYMNSA-N 0 3 401.576 4.242 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CC[C@H](COc2ccccc2)C1)c1ccsc1 ZINC000504010957 912917273 /nfs/dbraw/zinc/91/72/73/912917273.db2.gz XZRKLGOCXXTFHU-GHTZIAJQSA-N 0 3 401.576 4.242 20 0 HIADHN Cc1nc2cc(F)cc(C(=O)N(C)[C@@H]3CCCN(Cc4ccccc4)C3)c2nc1C ZINC000470816322 885304777 /nfs/dbraw/zinc/30/47/77/885304777.db2.gz HILSUFRGIOWYDU-HXUWFJFHSA-N 0 3 406.505 4.122 20 0 HIADHN CN(Cc1ccc(C(=O)OC(C)(C)C)cc1)C[C@@H]1C[C@H](F)CN1Cc1nccs1 ZINC000470820006 885308391 /nfs/dbraw/zinc/30/83/91/885308391.db2.gz AVCRKLMGLYVSHS-OALUTQOASA-N 0 3 419.566 4.143 20 0 HIADHN CCOC(=O)c1csc(C2CCN(C[C@@H](O)Cc3ccc4ccccc4c3)CC2)n1 ZINC000470874084 885362132 /nfs/dbraw/zinc/36/21/32/885362132.db2.gz SGKDNZISVKYJLB-NRFANRHFSA-N 0 3 424.566 4.256 20 0 HIADHN C[C@H](CNC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1)c1ccc(F)cc1F ZINC000470884015 885377499 /nfs/dbraw/zinc/37/74/99/885377499.db2.gz TWBGXBGSFVCYOY-YLJYHZDGSA-N 0 3 401.501 4.374 20 0 HIADHN C[C@H](NC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1)c1cccc(-n2cccn2)c1 ZINC000470885142 885380286 /nfs/dbraw/zinc/38/02/86/885380286.db2.gz XOVUXBDTZHXLPP-RDPSFJRHSA-N 0 3 417.557 4.239 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)c2ccc(COc3ccc(F)cc3)o2)o1 ZINC000504025640 912929710 /nfs/dbraw/zinc/92/97/10/912929710.db2.gz RNPKISCCNOLTMK-UHFFFAOYSA-N 0 3 400.450 4.103 20 0 HIADHN COCCCC[C@@H](NCC(=O)N1CCc2[nH]c3ccccc3c2C1)c1ccccc1 ZINC000471001403 885502659 /nfs/dbraw/zinc/50/26/59/885502659.db2.gz OWKOOLJPVJFJBQ-JOCHJYFZSA-N 0 3 405.542 4.200 20 0 HIADHN COCCCC[C@H](NCCN1c2cccc3cccc(c23)S1(=O)=O)c1ccccc1 ZINC000471026017 885532950 /nfs/dbraw/zinc/53/29/50/885532950.db2.gz SDMJLWDTRHTVPY-NRFANRHFSA-N 0 3 424.566 4.496 20 0 HIADHN CN1CCN(CC(=O)N[C@@H](c2cccs2)c2ccc(F)cc2)C2(CCCCC2)C1 ZINC000471036089 885542815 /nfs/dbraw/zinc/54/28/15/885542815.db2.gz VQORBNJNSLEMJL-JOCHJYFZSA-N 0 3 415.578 4.043 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)c1cc2c(C(F)F)nn(C)c2s1 ZINC000471122622 885658533 /nfs/dbraw/zinc/65/85/33/885658533.db2.gz BSRKFGPATXSSFO-INIZCTEOSA-N 0 3 420.529 4.459 20 0 HIADHN C[C@@H]1CCc2nc(NC(=O)NC3CC(N4CCC(C(F)(F)F)CC4)C3)sc2C1 ZINC000471121714 885658697 /nfs/dbraw/zinc/65/86/97/885658697.db2.gz JJSOIMWIMRDRMI-LMWSTFAQSA-N 0 3 416.513 4.195 20 0 HIADHN CCOc1ccc(NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cc1OC ZINC000471128129 885666709 /nfs/dbraw/zinc/66/67/09/885666709.db2.gz AEFIPIMAFWUJDY-UHFFFAOYSA-N 0 3 415.456 4.021 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)[C@H](C)c3cccs3)c(OCC)c2)CC1 ZINC000471163372 885719941 /nfs/dbraw/zinc/71/99/41/885719941.db2.gz VCOYREDPRSXGLS-QGZVFWFLSA-N 0 3 401.576 4.421 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3cccc(COC)c3)c(OCC)c2)CC1 ZINC000471169057 885726380 /nfs/dbraw/zinc/72/63/80/885726380.db2.gz MYBGHMGJYKICKH-UHFFFAOYSA-N 0 3 411.546 4.016 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3cc(F)c(F)c(F)c3)c(OCC)c2)CC1 ZINC000471168181 885726583 /nfs/dbraw/zinc/72/65/83/885726583.db2.gz FYQOJTNBBJKRBN-UHFFFAOYSA-N 0 3 421.463 4.287 20 0 HIADHN COC1CCN(C(C)(C)CNC(=O)c2cc(SC)c(Cl)cc2Cl)CC1 ZINC000471268107 885847014 /nfs/dbraw/zinc/84/70/14/885847014.db2.gz XXYFLHZAXQQTLN-UHFFFAOYSA-N 0 3 405.391 4.335 20 0 HIADHN Cc1c(NC(=O)N(C)C)cccc1NC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000471364502 885994879 /nfs/dbraw/zinc/99/48/79/885994879.db2.gz ZMUZIDPTYLTVGK-HXUWFJFHSA-N 0 3 423.561 4.217 20 0 HIADHN CN(C)[C@H](CNC(=O)Nc1cccc(CCC(=O)OC(C)(C)C)c1)c1ccccc1 ZINC000471374352 886015909 /nfs/dbraw/zinc/01/59/09/886015909.db2.gz LYHGBYUGYZKOJI-OAQYLSRUSA-N 0 3 411.546 4.385 20 0 HIADHN COc1cccc([C@@H](CNC(=O)[C@@H](C(C)C)N(C)C)c2c[nH]c3ccccc32)c1OC ZINC000471401019 886051398 /nfs/dbraw/zinc/05/13/98/886051398.db2.gz HXYPGGQGZZHCCK-NFBKMPQASA-N 0 3 423.557 4.019 20 0 HIADHN CN(C)c1ccc(-c2cncc(C(=O)NC3CCN(Cc4ccccc4)CC3)c2)cc1 ZINC000471461966 886144309 /nfs/dbraw/zinc/14/43/09/886144309.db2.gz JVARRZLXJJXKQN-UHFFFAOYSA-N 0 3 414.553 4.209 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)N[C@@H]1C[C@H]1c1ccc(OC(F)F)cc1)c1ccco1 ZINC000504104003 913013193 /nfs/dbraw/zinc/01/31/93/913013193.db2.gz NDZADTARJORAPT-BVPBIZIASA-N 0 3 407.461 4.166 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)N[C@@H]1C[C@H]1c1ccc(OC(F)F)cc1)c1ccco1 ZINC000504104004 913013235 /nfs/dbraw/zinc/01/32/35/913013235.db2.gz NDZADTARJORAPT-RNJTYBCJSA-N 0 3 407.461 4.166 20 0 HIADHN Cc1ccc(C(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)cc1NC(=O)c1ccco1 ZINC000471527649 886231668 /nfs/dbraw/zinc/23/16/68/886231668.db2.gz CXQFSTJUGPBSQX-JTSKRJEESA-N 0 3 405.498 4.262 20 0 HIADHN Cc1ccc([C@@H](NC(=O)N[C@H]2CCN(Cc3ccccc3)C2)c2ccccn2)cc1 ZINC000471530387 886234741 /nfs/dbraw/zinc/23/47/41/886234741.db2.gz QYKIGTPGGMNYBS-LADGPHEKSA-N 0 3 400.526 4.053 20 0 HIADHN COc1cc(C[NH2+]CCc2ccccc2OC(F)F)cc(Br)c1[O-] ZINC000471550669 886259529 /nfs/dbraw/zinc/25/95/29/886259529.db2.gz JTNMMOZUYOPKLK-UHFFFAOYSA-N 0 3 402.235 4.097 20 0 HIADHN Cc1cccc(C(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)c1I ZINC000471558954 886268363 /nfs/dbraw/zinc/26/83/63/886268363.db2.gz HUYKPSUVPAPABG-RDTXWAMCSA-N 0 3 422.310 4.021 20 0 HIADHN Cc1noc(CSc2ccc(C(=O)N[C@H](C)[C@@H](c3ccccc3)N(C)C)cc2)n1 ZINC000471576928 886289274 /nfs/dbraw/zinc/28/92/74/886289274.db2.gz GFTKCAVLEFVJPY-VFNWGFHPSA-N 0 3 410.543 4.092 20 0 HIADHN C[C@@H](CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)N[C@@H](CO)c1ccsc1 ZINC000471586545 886297104 /nfs/dbraw/zinc/29/71/04/886297104.db2.gz DHZSLVFRQRUTQE-BONVTDFDSA-N 0 3 406.857 4.461 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)N[C@H]2C[C@H](c3cccc(Cl)c3)C2)cc1 ZINC000504124576 913028593 /nfs/dbraw/zinc/02/85/93/913028593.db2.gz ZUHNGRNHTOVCCP-YFVAEKQCSA-N 0 3 401.938 4.197 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)Cc3csc(-c4ccccc4)n3)c2)CC1 ZINC000471623188 886340984 /nfs/dbraw/zinc/34/09/84/886340984.db2.gz YJNKEZMISNTEQV-UHFFFAOYSA-N 0 3 406.555 4.133 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)c3cnn(-c4ccc(Cl)cc4)c3C)c2)CC1 ZINC000471646570 886360181 /nfs/dbraw/zinc/36/01/81/886360181.db2.gz MECLSFRMNANNBR-UHFFFAOYSA-N 0 3 423.948 4.228 20 0 HIADHN O=C(NC1CCCCC1)C1CCN(Cc2ccccc2OCc2ccccn2)CC1 ZINC000512375537 921114300 /nfs/dbraw/zinc/11/43/00/921114300.db2.gz UFTVAAHQWCNKAY-UHFFFAOYSA-N 0 3 407.558 4.322 20 0 HIADHN Cc1ccc([C@H](NC(=O)NCC2(N3CCSCC3)CCCC2)c2ccccn2)cc1 ZINC000471677650 886386421 /nfs/dbraw/zinc/38/64/21/886386421.db2.gz ILGVDINYKMABED-QFIPXVFZSA-N 0 3 424.614 4.140 20 0 HIADHN COc1ccc(CN(C)C(=O)CN[C@H](c2ccc(Cl)cc2)C(C)C)cc1OC ZINC000471697284 886404025 /nfs/dbraw/zinc/40/40/25/886404025.db2.gz NEYIAKFFHJPOEA-QFIPXVFZSA-N 0 3 404.938 4.303 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N[C@H]1CCc2c1cccc2Cl ZINC000471731298 886449053 /nfs/dbraw/zinc/44/90/53/886449053.db2.gz IRLGNZLPKOVBQN-JRSKDTKFSA-N 0 3 415.887 4.432 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)CS[C@@H](C)c2nc3ccccc3[nH]2)C1 ZINC000471800488 886536905 /nfs/dbraw/zinc/53/69/05/886536905.db2.gz RPCREMGFRFLFED-ZIFCJYIRSA-N 0 3 408.571 4.309 20 0 HIADHN COc1ccc(NC(=O)[C@H](C)N[C@H]2C[C@@H](OCc3ccccc3)C2(C)C)c(OC)c1 ZINC000471855399 886625476 /nfs/dbraw/zinc/62/54/76/886625476.db2.gz GBSSDBWOHNTOGC-WQTXXOFMSA-N 0 3 412.530 4.004 20 0 HIADHN Cc1cn([C@@H](C)c2ccccc2)nc1NC(=O)NCCCN1CCc2ccccc2C1 ZINC000471861253 886635649 /nfs/dbraw/zinc/63/56/49/886635649.db2.gz NFOAGGKWZSMRHD-FQEVSTJZSA-N 0 3 417.557 4.371 20 0 HIADHN COC(=O)c1cc(NC(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)c(C)cc1C ZINC000471863553 886639193 /nfs/dbraw/zinc/63/91/93/886639193.db2.gz OZZQZHLXGCHAMA-IBGZPJMESA-N 0 3 409.530 4.218 20 0 HIADHN Cc1cn([C@@H](C)c2ccccc2)nc1NC(=O)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000471914372 886700785 /nfs/dbraw/zinc/70/07/85/886700785.db2.gz HLPIZOBRDZMGPI-UGKGYDQZSA-N 0 3 403.530 4.197 20 0 HIADHN Cc1cn([C@H](C)c2ccccc2)nc1NC(=O)NC[C@@H](Cc1ccccc1)N(C)C ZINC000471915581 886703256 /nfs/dbraw/zinc/70/32/56/886703256.db2.gz RMWQVHFRFBCJDL-DENIHFKCSA-N 0 3 405.546 4.095 20 0 HIADHN CC(C)(CNC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1)Cc1ccccc1 ZINC000471915931 886703539 /nfs/dbraw/zinc/70/35/39/886703539.db2.gz VQCPNYFZEBFEAL-UHFFFAOYSA-N 0 3 411.512 4.360 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2ccc3nc(-c4ccccn4)oc3c2)[C@H]1c1ccccc1 ZINC000471924193 886714696 /nfs/dbraw/zinc/71/46/96/886714696.db2.gz LZEYVZJEVXPZTQ-DENIHFKCSA-N 0 3 413.481 4.457 20 0 HIADHN Cc1cc(-c2nc(C3CC3)no2)ccc1NC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000471925376 886716420 /nfs/dbraw/zinc/71/64/20/886716420.db2.gz RVOZBZVTKQDVGB-NHCUHLMSSA-N 0 3 417.513 4.489 20 0 HIADHN C[C@H](NC(=O)NC[C@H](Cc1ccccc1)N(C)C)c1nc(-c2ccccc2)cs1 ZINC000504191614 913075136 /nfs/dbraw/zinc/07/51/36/913075136.db2.gz VYZFIUZYJGZNTE-PXNSSMCTSA-N 0 3 408.571 4.343 20 0 HIADHN C[C@H](C(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1)c1ccc(Cl)c(Cl)c1 ZINC000471976289 886807174 /nfs/dbraw/zinc/80/71/74/886807174.db2.gz FBDJBWPBCWIZLI-OAGGEKHMSA-N 0 3 413.389 4.445 20 0 HIADHN Cc1c(NC(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)cnn1-c1cc(C)ccc1C ZINC000471980769 886810138 /nfs/dbraw/zinc/81/01/38/886810138.db2.gz SIQJTAPOZOXQAY-NZQKXSOJSA-N 0 3 403.530 4.364 20 0 HIADHN CCO[C@H]1C[C@@H](NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)C1(CC)CC ZINC000471989788 886816610 /nfs/dbraw/zinc/81/66/10/886816610.db2.gz BYRPQWNWELFLDH-HIEASXQVSA-N 0 3 419.532 4.075 20 0 HIADHN CCS[C@@H]1CCC[C@@H](NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)C1 ZINC000472008590 886832287 /nfs/dbraw/zinc/83/22/87/886832287.db2.gz PHEFSGRDFVUCGT-RDHHWEPZSA-N 0 3 407.546 4.155 20 0 HIADHN Cc1cc(C)cc(C[C@@H](C)NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)c1 ZINC000472015463 886837590 /nfs/dbraw/zinc/83/75/90/886837590.db2.gz CBTOJHWHRCIISR-PBPGXSGUSA-N 0 3 411.512 4.339 20 0 HIADHN CCN(C(=O)c1ccc2nc(C(F)(F)F)cn2c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000472024978 886846857 /nfs/dbraw/zinc/84/68/57/886846857.db2.gz KVVLSHXOBXLZEJ-SFHVURJKSA-N 0 3 416.447 4.090 20 0 HIADHN CCS[C@H]1CCCC[C@@H]1NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472045458 886861347 /nfs/dbraw/zinc/86/13/47/886861347.db2.gz SVPDYGBBMHZBCT-GQGLESIBSA-N 0 3 407.546 4.155 20 0 HIADHN C[C@H](CCN1CCN(C)CC1)NC(=O)c1cc(Cl)ccc1Oc1ccc(F)cc1 ZINC000472087316 886886536 /nfs/dbraw/zinc/88/65/36/886886536.db2.gz RLQZTAZQSTXCOB-MRXNPFEDSA-N 0 3 419.928 4.027 20 0 HIADHN C[C@]1(CNC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)CCCc2ccccc21 ZINC000472129156 886921228 /nfs/dbraw/zinc/92/12/28/886921228.db2.gz YTHIOFOUCUZSFX-OBFZPWGMSA-N 0 3 423.523 4.385 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)N[C@H]3CC[N@@H+]([C@@H](C)c4ccccc4)C3)cc2)cc(=O)[n-]1 ZINC000504234923 913106287 /nfs/dbraw/zinc/10/62/87/913106287.db2.gz FLTGQPFWSOEDSD-KKSFZXQISA-N 0 3 417.513 4.115 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)N[C@H]3CC[N@H+]([C@@H](C)c4ccccc4)C3)cc2)cc(=O)[n-]1 ZINC000504234923 913106290 /nfs/dbraw/zinc/10/62/90/913106290.db2.gz FLTGQPFWSOEDSD-KKSFZXQISA-N 0 3 417.513 4.115 20 0 HIADHN CC(C)OCCOCc1cccc(NC(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)c1 ZINC000472303824 887126755 /nfs/dbraw/zinc/12/67/55/887126755.db2.gz FTHJUQJEBCSFAP-GOTSBHOMSA-N 0 3 411.546 4.195 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2ccc(-c3noc(C(F)F)n3)cc2)[C@@H]1c1ccccc1 ZINC000472315243 887146569 /nfs/dbraw/zinc/14/65/69/887146569.db2.gz SHGKNIRYULVGKV-IRXDYDNUSA-N 0 3 413.428 4.241 20 0 HIADHN O=C(Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)c1cc(O)c2ccccc2c1 ZINC000472351172 887185877 /nfs/dbraw/zinc/18/58/77/887185877.db2.gz VZFJXEDENHQMMA-NRFANRHFSA-N 0 3 412.493 4.441 20 0 HIADHN CC(C)(C)c1cnc(CNC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)o1 ZINC000472368683 887207265 /nfs/dbraw/zinc/20/72/65/887207265.db2.gz KOMANTMDXAQDIK-FQEVSTJZSA-N 0 3 409.452 4.043 20 0 HIADHN Cc1nc(-c2ccccc2)sc1[C@@H](C)NC(=O)N(CCN(C)C)Cc1ccccn1 ZINC000504263545 913125426 /nfs/dbraw/zinc/12/54/26/913125426.db2.gz BIRNZPCFXBVTTN-GOSISDBHSA-N 0 3 423.586 4.348 20 0 HIADHN CC[C@H](NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1nc2ccccc2[nH]1 ZINC000472451875 887303508 /nfs/dbraw/zinc/30/35/08/887303508.db2.gz LHJAZLBPINPKAF-GPANFISMSA-N 0 3 423.483 4.119 20 0 HIADHN Cc1cc(N2CCCC2)ccc1NC(=O)CN(C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000472472992 887333027 /nfs/dbraw/zinc/33/30/27/887333027.db2.gz AQVJZITYXJCLFT-DEOSSOPVSA-N 0 3 420.601 4.130 20 0 HIADHN CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)N[C@H]1CC[C@@H](c2ccc(F)cc2)C1 ZINC000472527997 887399857 /nfs/dbraw/zinc/39/98/57/887399857.db2.gz NSIBRFMZMUKSND-VLSUOOLDSA-N 0 3 410.537 4.191 20 0 HIADHN C[C@@H](CNC(=O)N[C@@H](c1cccc(Cl)c1)C1CCCCC1)CN1CCN(C)CC1 ZINC000472636292 887501273 /nfs/dbraw/zinc/50/12/73/887501273.db2.gz FFKXGHYORDEWQA-PGRDOPGGSA-N 0 3 421.029 4.144 20 0 HIADHN C[C@H](CO)N(CC(=O)N1N=C(c2cccs2)C[C@@H]1c1cccs1)C1CCCC1 ZINC000472639499 887504069 /nfs/dbraw/zinc/50/40/69/887504069.db2.gz UXHHSTMANODNGQ-CRAIPNDOSA-N 0 3 417.600 4.113 20 0 HIADHN CN(C)Cc1ccc(S(=O)(=O)N(Cc2cccs2)Cc2cccs2)cc1 ZINC000472681009 887534207 /nfs/dbraw/zinc/53/42/07/887534207.db2.gz BBZDXDSNIGGXDX-UHFFFAOYSA-N 0 3 406.598 4.262 20 0 HIADHN COc1ccc(N(Cc2ccccc2)S(=O)(=O)c2ccc(CN(C)C)cc2)cc1 ZINC000472686800 887541365 /nfs/dbraw/zinc/54/13/65/887541365.db2.gz XVQINQUQXCHZLX-UHFFFAOYSA-N 0 3 410.539 4.152 20 0 HIADHN CN(C(=O)Nc1cccc(N2CCCCC2=O)c1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000472799819 887644183 /nfs/dbraw/zinc/64/41/83/887644183.db2.gz PNGJYBDNZLGWEI-HSZRJFAPSA-N 0 3 420.557 4.332 20 0 HIADHN Cc1ccc(NC(=O)N[C@H]2CCN(Cc3ccccc3)C2)c(-c2nc(C3CC3)no2)c1 ZINC000472834033 887683494 /nfs/dbraw/zinc/68/34/94/887683494.db2.gz DXQAUYOYIBTXEK-IBGZPJMESA-N 0 3 417.513 4.318 20 0 HIADHN CCN(C(=O)NC[C@@H](c1cccs1)N1CCCC1)[C@H](COC)Cc1ccccc1 ZINC000472916402 887761951 /nfs/dbraw/zinc/76/19/51/887761951.db2.gz DVTQHCZMWLDNPC-SFTDATJTSA-N 0 3 415.603 4.174 20 0 HIADHN COc1cc(CN2CC[C@]3(C2)OCc2ccccc23)ccc1OCc1ccncc1 ZINC000473124691 887916706 /nfs/dbraw/zinc/91/67/06/887916706.db2.gz RFMZTZRLOIDUCC-RUZDIDTESA-N 0 3 402.494 4.301 20 0 HIADHN O[C@@H](COc1ccc(-c2ccccc2)cc1)CN1CC[C@@]2(C1)OCc1ccccc12 ZINC000473153455 887932612 /nfs/dbraw/zinc/93/26/12/887932612.db2.gz VNDOBVYGBKIVSU-BVAGGSTKSA-N 0 3 401.506 4.225 20 0 HIADHN O=C(CCC(=O)c1ccc2c(c1)CCCC2)NC[C@@H]1CCN(Cc2ccccc2)C1 ZINC000473295857 888047886 /nfs/dbraw/zinc/04/78/86/888047886.db2.gz MDAHLDOVUOGKLV-NRFANRHFSA-N 0 3 404.554 4.167 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)C1(c2ccccc2Br)CC1 ZINC000473392962 888106972 /nfs/dbraw/zinc/10/69/72/888106972.db2.gz VKBAHQNOJMYQFS-QGZVFWFLSA-N 0 3 419.388 4.496 20 0 HIADHN C[C@H](CCN1CCN(C)CC1)NC(=O)Nc1ccc(-c2nc3ccccc3s2)cc1 ZINC000473498209 888222372 /nfs/dbraw/zinc/22/23/72/888222372.db2.gz NSLPKCGVLYPUJK-QGZVFWFLSA-N 0 3 423.586 4.111 20 0 HIADHN Cc1cccc(Oc2ccccc2NC(=O)NC(C)(C)CCN2CCN(C)CC2)c1 ZINC000473505595 888231847 /nfs/dbraw/zinc/23/18/47/888231847.db2.gz ROOBYMXSCVYLDU-UHFFFAOYSA-N 0 3 410.562 4.325 20 0 HIADHN O=C(Cc1ccc(Cl)cc1Cl)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473511587 888240529 /nfs/dbraw/zinc/24/05/29/888240529.db2.gz ICIOLMQHIMOHHS-UHFFFAOYSA-N 0 3 409.279 4.457 20 0 HIADHN C[C@@H](CSCc1ccccc1)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473513437 888243377 /nfs/dbraw/zinc/24/33/77/888243377.db2.gz NKQCPWCUCRTAOP-MNNVXMFVSA-N 0 3 414.537 4.477 20 0 HIADHN CC(C)[C@H]1CC[C@@H](C)C[C@H]1OCC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473513514 888244200 /nfs/dbraw/zinc/24/42/00/888244200.db2.gz NYQIIADATVUGKL-SWIVEIQFSA-N 0 3 418.544 4.385 20 0 HIADHN CCc1c(C(=O)N2CC[C@]3(C2)CCCN(Cc2ccccc2)C3)[nH]c(C)c1C(C)=O ZINC000473515129 888245916 /nfs/dbraw/zinc/24/59/16/888245916.db2.gz MZVSBSBYHBLBII-RUZDIDTESA-N 0 3 407.558 4.216 20 0 HIADHN CC[C@H](C)n1ncc(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)c1C1CC1 ZINC000473518284 888250357 /nfs/dbraw/zinc/25/03/57/888250357.db2.gz CUCPVMANLYZUSJ-IGEOTXOUSA-N 0 3 412.500 4.267 20 0 HIADHN COc1ccc(S[C@@H](C)C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cc1 ZINC000473518623 888251903 /nfs/dbraw/zinc/25/19/03/888251903.db2.gz AKNPSKNFIICTHL-JEYLPNPQSA-N 0 3 416.509 4.097 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)[C@@H]1C[C@@]12CCCc1ccccc12 ZINC000473520139 888253748 /nfs/dbraw/zinc/25/37/48/888253748.db2.gz IHTGQLLVOHPPEZ-KLXIGZAZSA-N 0 3 406.492 4.202 20 0 HIADHN Cc1ncc(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)c(Cl)c1Cl ZINC000473520968 888255645 /nfs/dbraw/zinc/25/56/45/888255645.db2.gz JFBGFTSHFWBXEF-UHFFFAOYSA-N 0 3 410.267 4.232 20 0 HIADHN CC(C)(C)c1noc2ncc(C(=O)NC3CC(N4CCC(C(F)(F)F)CC4)C3)cc21 ZINC000473523315 888258903 /nfs/dbraw/zinc/25/89/03/888258903.db2.gz VHDQZIAPEOKUOX-UHFFFAOYSA-N 0 3 424.467 4.055 20 0 HIADHN O=C(COc1ccc(C(F)(F)F)cc1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473525254 888261826 /nfs/dbraw/zinc/26/18/26/888261826.db2.gz PAJZGPGEVRQSBR-UHFFFAOYSA-N 0 3 424.385 4.006 20 0 HIADHN Cc1cc(O[C@H](C)C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)ccc1Cl ZINC000473526386 888263510 /nfs/dbraw/zinc/26/35/10/888263510.db2.gz QNHJDFVFNDWVSP-IUDNXUCKSA-N 0 3 418.887 4.337 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)[C@@H]1C[C@@H]1c1cccc(Cl)c1 ZINC000473527726 888265428 /nfs/dbraw/zinc/26/54/28/888265428.db2.gz RXEKGALQIZKUFF-OPQOLIRYSA-N 0 3 400.872 4.365 20 0 HIADHN CC(C)(Oc1ccc(Cl)cc1)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473534488 888271388 /nfs/dbraw/zinc/27/13/88/888271388.db2.gz YVKXMKAFHBHBJD-UHFFFAOYSA-N 0 3 418.887 4.419 20 0 HIADHN CCCCN(C)c1ccc(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cc1 ZINC000473536125 888273350 /nfs/dbraw/zinc/27/33/50/888273350.db2.gz ZKWGEPDAPYFPKZ-UHFFFAOYSA-N 0 3 411.512 4.458 20 0 HIADHN COc1cccc(C(=O)c2ccc(C(=O)N3CCCC[C@@H](N4CCCC4)C3)cc2)c1 ZINC000473587875 888331766 /nfs/dbraw/zinc/33/17/66/888331766.db2.gz NPAKSKBGNHWDBP-JOCHJYFZSA-N 0 3 406.526 4.017 20 0 HIADHN O=C(N[C@@H]1C[C@H]1c1ccc(Br)c(F)c1)c1cccc(CN2CCCC2)c1 ZINC000473620321 888360728 /nfs/dbraw/zinc/36/07/28/888360728.db2.gz GWOLMTLTXAQTOD-FXAWDEMLSA-N 0 3 417.322 4.470 20 0 HIADHN Cc1cccc(C)c1Oc1ccccc1NC(=O)N[C@@H](C)CCN1CCN(C)CC1 ZINC000473671802 888432846 /nfs/dbraw/zinc/43/28/46/888432846.db2.gz XGVYYLUWDMTYLI-FQEVSTJZSA-N 0 3 410.562 4.243 20 0 HIADHN CN1CCN(CCC(C)(C)NC(=O)Nc2ccc(F)cc2-c2ccc(F)cc2)CC1 ZINC000473680878 888447591 /nfs/dbraw/zinc/44/75/91/888447591.db2.gz WAIMDJKSHNQYTF-UHFFFAOYSA-N 0 3 416.516 4.169 20 0 HIADHN CCSc1nnc(NC(=O)N(CC)[C@@H]2CCN([C@H](C)c3ccccc3)C2)s1 ZINC000473683167 888452943 /nfs/dbraw/zinc/45/29/43/888452943.db2.gz QEWZIWXXTWIWQR-GDBMZVCRSA-N 0 3 405.593 4.339 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)C(C)(C)c3ccc(Cl)cc3F)CC2)C[C@@H](C)O1 ZINC000473703751 888480524 /nfs/dbraw/zinc/48/05/24/888480524.db2.gz ZWUWFEGVOAKRLR-HZPDHXFCSA-N 0 3 410.961 4.105 20 0 HIADHN CCCN(C(=O)NCC1(CCOC)CCC1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000473718332 888495804 /nfs/dbraw/zinc/49/58/04/888495804.db2.gz ODGRZPFAAHMJMZ-JOCHJYFZSA-N 0 3 401.595 4.279 20 0 HIADHN CN(CCNC(=O)Nc1cnn(-c2ccccc2)c1C(F)(F)F)Cc1ccccc1 ZINC000473774794 888577376 /nfs/dbraw/zinc/57/73/76/888577376.db2.gz JBSJIOLDHJJMID-UHFFFAOYSA-N 0 3 417.435 4.145 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N(C)[C@H](C)c3ccc(F)c(F)c3)c2)CC1 ZINC000473822466 888653427 /nfs/dbraw/zinc/65/34/27/888653427.db2.gz IRRFWQVFDJJSHM-MRXNPFEDSA-N 0 3 402.489 4.332 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3C[C@H](c4ccccc4)C(C)(C)C3)c2)CC1 ZINC000473833270 888668118 /nfs/dbraw/zinc/66/81/18/888668118.db2.gz BRSNHIDHQUTBPP-HSZRJFAPSA-N 0 3 406.574 4.486 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@H]3CCCOc4cc(F)ccc43)c2)CC1 ZINC000473835833 888672010 /nfs/dbraw/zinc/67/20/10/888672010.db2.gz FDBUBJFDPBAAIC-NRFANRHFSA-N 0 3 412.509 4.003 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CCC(c4ccc(OC)cc4)CC3)c2)CC1 ZINC000473836344 888674274 /nfs/dbraw/zinc/67/42/74/888674274.db2.gz MHDWBQYTSHVZIP-UHFFFAOYSA-N 0 3 422.573 4.249 20 0 HIADHN C[C@H](NC(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1)c1cc2ccccc2s1 ZINC000504480542 913274312 /nfs/dbraw/zinc/27/43/12/913274312.db2.gz OVYZLSMXIQZDBR-KSZLIROESA-N 0 3 415.603 4.493 20 0 HIADHN COc1ccc(C(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)c(OC(F)F)c1 ZINC000473885264 888753907 /nfs/dbraw/zinc/75/39/07/888753907.db2.gz MFMIDUWYIFVNOF-MRXNPFEDSA-N 0 3 404.457 4.033 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCC(Nc2nc(C)cs2)CC1)c1ccsc1 ZINC000473896659 888771026 /nfs/dbraw/zinc/77/10/26/888771026.db2.gz SYNIWWFPBXVUEP-GOSISDBHSA-N 0 3 421.636 4.182 20 0 HIADHN C[C@@H](CC(=O)Nc1ccccc1)N[C@@H]1CCN(c2ccc(Cl)cc2Cl)C1=O ZINC000473986269 888847638 /nfs/dbraw/zinc/84/76/38/888847638.db2.gz IPVFSDXIKFTYBX-SUMWQHHRSA-N 0 3 406.313 4.106 20 0 HIADHN O=C(Nc1ccccc1-c1ccccc1)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1CO ZINC000473993274 888853897 /nfs/dbraw/zinc/85/38/97/888853897.db2.gz SDELKPYIRSNAMW-ISKFKSNPSA-N 0 3 415.537 4.358 20 0 HIADHN CC(=O)Nc1ccc(CN[C@@H]2CCCN(c3ccc(Cl)cc3Cl)C2=O)cc1 ZINC000474008632 888866016 /nfs/dbraw/zinc/86/60/16/888866016.db2.gz HFFIIADSZALKLW-GOSISDBHSA-N 0 3 406.313 4.237 20 0 HIADHN CN1CCN(CCC(C)(C)NC(=O)N[C@@H](c2cccc(Cl)c2)C2CCCC2)CC1 ZINC000474018468 888872758 /nfs/dbraw/zinc/87/27/58/888872758.db2.gz FJQNEPUXNGFJQA-OAQYLSRUSA-N 0 3 421.029 4.287 20 0 HIADHN Cc1cccc2c1OCC[C@H]2N[C@H](C)CC(=O)Nc1ccc(NC(=O)C2CC2)cc1 ZINC000474095067 888920975 /nfs/dbraw/zinc/92/09/75/888920975.db2.gz KOBGZWZVLAPAHJ-IIBYNOLFSA-N 0 3 407.514 4.174 20 0 HIADHN C[C@H]1CN(C2CCN(Cc3ccc(Br)cc3C(F)(F)F)CC2)CCO1 ZINC000474144875 888971843 /nfs/dbraw/zinc/97/18/43/888971843.db2.gz DMPKCALAZSBUPK-ZDUSSCGKSA-N 0 3 421.301 4.153 20 0 HIADHN COc1cc(C(C)=O)ccc1OC[C@@H](O)CN(Cc1ccc(F)cc1)C(C)(C)C ZINC000474159687 888996997 /nfs/dbraw/zinc/99/69/97/888996997.db2.gz OAMSZQPNPFNRCJ-FQEVSTJZSA-N 0 3 403.494 4.077 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N[C@H](CO)c2c(Cl)cccc2Cl)C1 ZINC000474180207 889018919 /nfs/dbraw/zinc/01/89/19/889018919.db2.gz CVIWDFUNNYBILS-SIXWZSSISA-N 0 3 422.356 4.162 20 0 HIADHN CN(Cc1csc(CC(=O)Nc2ccccc2)n1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000474228081 889070889 /nfs/dbraw/zinc/07/08/89/889070889.db2.gz FJGLKZORBUSNHU-JOCHJYFZSA-N 0 3 420.582 4.031 20 0 HIADHN COc1ccc(/C=C2/CCc3c2nc2ccccc2c3C(=O)N(C)CCN(C)C)cc1 ZINC000474253885 889109221 /nfs/dbraw/zinc/10/92/21/889109221.db2.gz UJZVXNYRQUQIIK-ZPHPHTNESA-N 0 3 415.537 4.364 20 0 HIADHN Cc1cc(C)n(-c2ccccc2CNC(=O)N(CCN(C)C)Cc2cccc(C)c2)n1 ZINC000474320541 889189485 /nfs/dbraw/zinc/18/94/85/889189485.db2.gz RENAWZSQEGRARZ-UHFFFAOYSA-N 0 3 419.573 4.071 20 0 HIADHN COc1cc(OC)c(NC(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)cc1Cl ZINC000474335265 889207516 /nfs/dbraw/zinc/20/75/16/889207516.db2.gz WEMOGPIQOSHBDS-INIZCTEOSA-N 0 3 403.910 4.095 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)c2ccc(=O)n(Cc3csc(C(C)C)n3)c2)c1 ZINC000474351798 889229441 /nfs/dbraw/zinc/22/94/41/889229441.db2.gz CLMQSEFXOLHKFG-UHFFFAOYSA-N 0 3 424.570 4.099 20 0 HIADHN COc1ccc2nc(CNCc3ccc(CN4C[C@H](C)O[C@@H](C)C4)cc3)sc2c1 ZINC000474353212 889231631 /nfs/dbraw/zinc/23/16/31/889231631.db2.gz NMRFJRSKWIJUBR-IRXDYDNUSA-N 0 3 411.571 4.204 20 0 HIADHN COc1ccc2nc(CNC3CCN(C(=O)CCc4ccccc4)CC3)sc2c1 ZINC000474362826 889241162 /nfs/dbraw/zinc/24/11/62/889241162.db2.gz QFVFJAAGEIDVAJ-UHFFFAOYSA-N 0 3 409.555 4.018 20 0 HIADHN CO[C@@]1(C)CCCN(C(=O)N[C@@H](CN2CCc3ccccc3C2)C(C)(C)C)CC1 ZINC000474361913 889241450 /nfs/dbraw/zinc/24/14/50/889241450.db2.gz GLQHHOJHZRLDRL-URXFXBBRSA-N 0 3 401.595 4.060 20 0 HIADHN C[C@H](N[C@H]1CCN([C@H](C(=O)OC(C)(C)C)c2ccccc2)C1=O)c1cccs1 ZINC000474431322 889295889 /nfs/dbraw/zinc/29/58/89/889295889.db2.gz HEVXDXKWGYQDMY-IEZWGBDMSA-N 0 3 400.544 4.083 20 0 HIADHN C[C@H](NC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1)c1noc(-c2ccccc2)n1 ZINC000474508327 889371151 /nfs/dbraw/zinc/37/11/51/889371151.db2.gz BZFNCIADMIOUNO-OALUTQOASA-N 0 3 419.529 4.104 20 0 HIADHN C[C@H](NC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C)c1noc(-c2ccccc2)n1 ZINC000474517344 889384379 /nfs/dbraw/zinc/38/43/79/889384379.db2.gz IYTKDAPFEXNZPQ-OALUTQOASA-N 0 3 419.529 4.104 20 0 HIADHN CN1CC[C@H](NC(=O)N[C@@H]2C[C@H]2c2ccc(Br)s2)[C@@H]1c1ccccc1 ZINC000474540414 889415860 /nfs/dbraw/zinc/41/58/60/889415860.db2.gz NVXGZMCHOVJYIZ-FSZRXZPDSA-N 0 3 420.376 4.111 20 0 HIADHN C[C@@H]1CCN(C(=O)c2ccc3nc(C(F)(F)F)cn3c2)CCN1Cc1ccccc1 ZINC000474559384 889435659 /nfs/dbraw/zinc/43/56/59/889435659.db2.gz QKSMSVNLGZIQFY-MRXNPFEDSA-N 0 3 416.447 4.090 20 0 HIADHN O=C(CCc1cnc[nH]1)N[C@@H](c1ccccc1)c1ccc2[nH]c(C(F)(F)F)nc2c1 ZINC000474590992 889460166 /nfs/dbraw/zinc/46/01/66/889460166.db2.gz CUFWEVNGPZCQML-IBGZPJMESA-N 0 3 413.403 4.143 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)N[C@H]1COc2ccc(Cl)cc21 ZINC000474596697 889464906 /nfs/dbraw/zinc/46/49/06/889464906.db2.gz SNRXERNKYMKCGL-IBGZPJMESA-N 0 3 417.962 4.187 20 0 HIADHN CC(C)n1cnnc1-c1ccccc1NC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000474621395 889486009 /nfs/dbraw/zinc/48/60/09/889486009.db2.gz QOACMCSCOLVADW-FQEVSTJZSA-N 0 3 418.545 4.264 20 0 HIADHN Cc1ccc(NC(=O)Nc2cccc3c2CCN(C(=O)CN2CCC(C)CC2)C3)cc1 ZINC000474700662 889559495 /nfs/dbraw/zinc/55/94/95/889559495.db2.gz HSRPQQQQJCXPHV-UHFFFAOYSA-N 0 3 420.557 4.256 20 0 HIADHN CN(C(=O)Nc1ccc(NC(=O)c2ccco2)cc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000474722046 889578722 /nfs/dbraw/zinc/57/87/22/889578722.db2.gz WRECZPPBCXKRHZ-OAQYLSRUSA-N 0 3 418.497 4.270 20 0 HIADHN COc1cccc([C@@H](N[C@H](C)C2CCS(=O)(=O)CC2)c2ccccc2Cl)c1 ZINC000474804452 889656748 /nfs/dbraw/zinc/65/67/48/889656748.db2.gz OUZKFGITLDTSGV-QVKFZJNVSA-N 0 3 407.963 4.241 20 0 HIADHN CC(C)[C@@H]([NH2+]CCCCc1ccc(Cl)c(Cl)c1)c1nc(-c2nc[n-]n2)no1 ZINC000474804407 889656956 /nfs/dbraw/zinc/65/69/56/889656956.db2.gz ODJQFSUCFQSSPU-OAHLLOKOSA-N 0 3 409.321 4.471 20 0 HIADHN CC(C)[C@@H](NCCCCc1ccc(Cl)c(Cl)c1)c1nc(-c2nc[nH]n2)no1 ZINC000474804407 889656962 /nfs/dbraw/zinc/65/69/62/889656962.db2.gz ODJQFSUCFQSSPU-OAHLLOKOSA-N 0 3 409.321 4.471 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)c3c[nH]cc3-c3cccc(OC)c3)c2)CC1 ZINC000474844280 889701957 /nfs/dbraw/zinc/70/19/57/889701957.db2.gz VYMGMULKXKHKKZ-UHFFFAOYSA-N 0 3 404.514 4.085 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)Cc2csc(-c3ccccc3Cl)n2)CC1 ZINC000474886674 889742283 /nfs/dbraw/zinc/74/22/83/889742283.db2.gz JJLZLHVSAFGFPJ-UHFFFAOYSA-N 0 3 421.994 4.012 20 0 HIADHN CC(C)C[C@H](N[C@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1)c1nc(-c2nc[nH]n2)no1 ZINC000474891643 889748770 /nfs/dbraw/zinc/74/87/70/889748770.db2.gz ZDZDNOMDZQIFOO-XQHKEYJVSA-N 0 3 406.943 4.439 20 0 HIADHN CC(C)C[C@H]([NH2+][C@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1)c1nc(-c2nc[n-]n2)no1 ZINC000474891643 889748777 /nfs/dbraw/zinc/74/87/77/889748777.db2.gz ZDZDNOMDZQIFOO-XQHKEYJVSA-N 0 3 406.943 4.439 20 0 HIADHN COc1ccc([C@@H](C)[C@@H](C)NCc2nnc3ccc(C(F)(F)F)cn32)cc1OC ZINC000474893388 889750439 /nfs/dbraw/zinc/75/04/39/889750439.db2.gz NLBKWMAIPLVPHO-QWHCGFSZSA-N 0 3 408.424 4.047 20 0 HIADHN COc1ccc([C@H](C)[C@H](C)NCc2nnc3ccc(C(F)(F)F)cn32)cc1OC ZINC000474893385 889750575 /nfs/dbraw/zinc/75/05/75/889750575.db2.gz NLBKWMAIPLVPHO-OLZOCXBDSA-N 0 3 408.424 4.047 20 0 HIADHN CC(C)(C)[C@@H]1C[C@@H](NCc2c(F)ccc(I)c2F)CCO1 ZINC000474894834 889753807 /nfs/dbraw/zinc/75/38/07/889753807.db2.gz UAUUHZFFULLAID-HZMBPMFUSA-N 0 3 409.258 4.253 20 0 HIADHN Cc1onc(-c2c(F)cccc2Cl)c1C(=O)NC1CCN(CCOC(C)C)CC1 ZINC000474899214 889758638 /nfs/dbraw/zinc/75/86/38/889758638.db2.gz ZINBZGHWEGEJKO-UHFFFAOYSA-N 0 3 423.916 4.062 20 0 HIADHN C[C@H](O)CCCN(Cc1ccco1)C[C@H](O)Cn1c2ccccc2c2ccccc21 ZINC000474954168 889809428 /nfs/dbraw/zinc/80/94/28/889809428.db2.gz JOZMRQYQUQXQSW-PMACEKPBSA-N 0 3 406.526 4.412 20 0 HIADHN CCN(C(=O)Nc1cc(-c2nnco2)ccc1C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475002478 889854574 /nfs/dbraw/zinc/85/45/74/889854574.db2.gz REXWQFWICDWMSA-FQEVSTJZSA-N 0 3 405.502 4.173 20 0 HIADHN CCN(C(=O)Nc1cc(NC(C)=O)ccc1Cl)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475008328 889860200 /nfs/dbraw/zinc/86/02/00/889860200.db2.gz LNBOLBWJIANBJU-IBGZPJMESA-N 0 3 414.937 4.427 20 0 HIADHN CCN(C(=O)Nc1ccc2nc(N(C)C)oc2c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475009376 889862374 /nfs/dbraw/zinc/86/23/74/889862374.db2.gz YNGZHYWIAOISDJ-LJQANCHMSA-N 0 3 407.518 4.022 20 0 HIADHN CCN(C(=O)Nc1ccc(OC[C@@H]2CCCO2)cc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475008339 889862496 /nfs/dbraw/zinc/86/24/96/889862496.db2.gz FYPKTMUYBIWOFL-UPVQGACJSA-N 0 3 423.557 4.373 20 0 HIADHN C[C@H](CCN1CCN(CCOc2ccccc2Cl)CC1)OCc1ccccc1 ZINC000475051364 889897985 /nfs/dbraw/zinc/89/79/85/889897985.db2.gz WXYZNYXBJQBEFY-HXUWFJFHSA-N 0 3 402.966 4.332 20 0 HIADHN C[C@@H](CCN1CCN(CCOc2ccccc2Cl)CC1)OCc1ccccc1 ZINC000475051362 889898269 /nfs/dbraw/zinc/89/82/69/889898269.db2.gz WXYZNYXBJQBEFY-FQEVSTJZSA-N 0 3 402.966 4.332 20 0 HIADHN C[C@H](CCN1CCCN(C(=O)c2cccc(Cl)c2)CC1)OCc1ccccc1 ZINC000475053312 889899278 /nfs/dbraw/zinc/89/92/78/889899278.db2.gz IHFNFAIZMNFAMY-LJQANCHMSA-N 0 3 400.950 4.483 20 0 HIADHN COc1ccc(CC[C@@H]2CCCCN2Cc2nccc(OC)c2OC)cc1OC ZINC000475055915 889900693 /nfs/dbraw/zinc/90/06/93/889900693.db2.gz BAPZVQJUGSVSME-SFHVURJKSA-N 0 3 400.519 4.103 20 0 HIADHN Cc1cc(CN(C)C[C@@H]2C[C@H](F)CN2Cc2nccs2)c(OC(F)F)cc1C ZINC000475089151 889935705 /nfs/dbraw/zinc/93/57/05/889935705.db2.gz KWWXVMIZQFUASL-IRXDYDNUSA-N 0 3 413.509 4.406 20 0 HIADHN CCOc1ccc([C@H](C)NC(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)cc1OC ZINC000475129118 889991657 /nfs/dbraw/zinc/99/16/57/889991657.db2.gz LJGGFQXNJHEDAZ-RXVVDRJESA-N 0 3 411.546 4.071 20 0 HIADHN C[C@H](NC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1)c1ccccc1OC(F)F ZINC000475146382 890013512 /nfs/dbraw/zinc/01/35/12/890013512.db2.gz OBXUEXFUACJHSJ-WMZOPIPTSA-N 0 3 403.473 4.265 20 0 HIADHN CCN(C(=O)NCc1cccc(OC(F)F)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475163897 890028373 /nfs/dbraw/zinc/02/83/73/890028373.db2.gz KRPUWQMJVRHYCE-IBGZPJMESA-N 0 3 403.473 4.094 20 0 HIADHN CCN(C(=O)NC[C@@H]1CCCO[C@H]1c1ccccc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475172755 890039901 /nfs/dbraw/zinc/03/99/01/890039901.db2.gz GCTRFJLEDBNHOR-SDHOMARFSA-N 0 3 421.585 4.460 20 0 HIADHN CCN(C(=O)NC[C@H](c1ccccc1)C(C)(C)CO)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475176083 890043147 /nfs/dbraw/zinc/04/31/47/890043147.db2.gz YWQRFJAAIQEUSW-DNQXCXABSA-N 0 3 423.601 4.095 20 0 HIADHN C[C@H](CC(=O)N1CCC[C@@H](CN2CCN(c3ccccn3)CC2)C1)C1CCCCC1 ZINC000504676119 913414795 /nfs/dbraw/zinc/41/47/95/913414795.db2.gz FYGBEWBABDXNMT-YADHBBJMSA-N 0 3 412.622 4.049 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)c2cn(C)nc2-c2ccc(Cl)s2)C1 ZINC000475242141 890121434 /nfs/dbraw/zinc/12/14/34/890121434.db2.gz AOJNKTSVQCMPQW-GDBMZVCRSA-N 0 3 414.962 4.367 20 0 HIADHN CN(C(=O)Cc1csc(Cc2ccc(F)cc2)n1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475307749 890218364 /nfs/dbraw/zinc/21/83/64/890218364.db2.gz GRNWXATZDGTXND-QFIPXVFZSA-N 0 3 423.557 4.148 20 0 HIADHN CN(C(=O)[C@@H]1C[C@@H]1c1ccccc1OC(F)(F)F)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475306829 890219716 /nfs/dbraw/zinc/21/97/16/890219716.db2.gz VDHPWTKJQLUWCE-DFQSSKMNSA-N 0 3 418.459 4.422 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2ccccc2)cc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475309591 890222816 /nfs/dbraw/zinc/22/28/16/890222816.db2.gz XBGBFMVJAISEOI-DEOSSOPVSA-N 0 3 413.521 4.285 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)c1cnc(Cc2ccccc2F)s1 ZINC000475318860 890236281 /nfs/dbraw/zinc/23/62/81/890236281.db2.gz OOTZXDUYWSEQFE-UHFFFAOYSA-N 0 3 415.509 4.216 20 0 HIADHN COCCC[C@H](Cc1ccccc1)NCc1cn(-c2ccc(F)c(Cl)c2)nn1 ZINC000475332833 890252081 /nfs/dbraw/zinc/25/20/81/890252081.db2.gz KQAWBUVFMIIVNQ-QGZVFWFLSA-N 0 3 402.901 4.187 20 0 HIADHN Cc1ccc([C@H](N[C@@H](C)CCCOc2ccccc2C(N)=O)c2ccccn2)cc1 ZINC000475332500 890252193 /nfs/dbraw/zinc/25/21/93/890252193.db2.gz HKPMKPZYUBYXMZ-CYFREDJKSA-N 0 3 403.526 4.416 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)C(C)(C)c3cccc(Cl)c3F)CC2)C[C@H](C)O1 ZINC000475344911 890267386 /nfs/dbraw/zinc/26/73/86/890267386.db2.gz YHUROLFKEIPOSM-HOTGVXAUSA-N 0 3 410.961 4.105 20 0 HIADHN COc1ccc([C@@H](CNC(=O)N[C@H](C)c2cc(F)ccc2OC)N2CCCC2)cc1 ZINC000504708417 913440738 /nfs/dbraw/zinc/44/07/38/913440738.db2.gz QUBQWPQCCAMXAD-IIBYNOLFSA-N 0 3 415.509 4.040 20 0 HIADHN COc1cc(CN[C@H]2CCCc3ccc(F)cc32)ccc1OCC(=O)N1CCCC1 ZINC000475486078 890392076 /nfs/dbraw/zinc/39/20/76/890392076.db2.gz JSKZYZVUOSOABV-NRFANRHFSA-N 0 3 412.505 4.003 20 0 HIADHN COCCOc1ccc(CN2CCC(n3c(C)nc4ccccc43)CC2)cc1OC ZINC000475496660 890403994 /nfs/dbraw/zinc/40/39/94/890403994.db2.gz YVCGGNOQDIURGE-UHFFFAOYSA-N 0 3 409.530 4.216 20 0 HIADHN CN(C(=O)N[C@H]1CC[C@@H](c2cccc(F)c2)C1)C1CCN(CCc2ccccn2)CC1 ZINC000475522457 890445572 /nfs/dbraw/zinc/44/55/72/890445572.db2.gz IFOSFMKDQPINGB-OFNKIYASSA-N 0 3 424.564 4.205 20 0 HIADHN Cc1nc(CN(C)[C@@H]2CCCN(Cc3cnc(-c4ccsc4)s3)CC2)no1 ZINC000475629394 890568611 /nfs/dbraw/zinc/56/86/11/890568611.db2.gz YFVPUCSPAQYIMY-MRXNPFEDSA-N 0 3 403.577 4.050 20 0 HIADHN C[C@@H](CC(=O)N1CCCCCC1)N[C@H](CO)c1ccc(Cl)cc1C(F)(F)F ZINC000475638032 890579571 /nfs/dbraw/zinc/57/95/71/890579571.db2.gz NOZOXKONGVKFAJ-SUMWQHHRSA-N 0 3 406.876 4.163 20 0 HIADHN COc1ccc(CN2CCC[C@@]2(CO)Cc2ccccc2)c(Br)c1OC ZINC000475647939 890591448 /nfs/dbraw/zinc/59/14/48/890591448.db2.gz HWAPJCYUJLPBQK-NRFANRHFSA-N 0 3 420.347 4.036 20 0 HIADHN Cc1ccc2nc(CN(Cc3cccc(Br)c3)CC3CC3)cc(=O)n2c1 ZINC000475731371 890671045 /nfs/dbraw/zinc/67/10/45/890671045.db2.gz UOUZRQLVJMLMRB-UHFFFAOYSA-N 0 3 412.331 4.178 20 0 HIADHN C[C@@H]1C[C@@H](C)[C@@H](C)N(CC(=O)N(Cc2nnc(-c3ccccc3Cl)o2)C2CC2)C1 ZINC000475732791 890673178 /nfs/dbraw/zinc/67/31/78/890673178.db2.gz RNNXOBWUCHGMIZ-BZUAXINKSA-N 0 3 416.953 4.247 20 0 HIADHN CN(C(=O)CN1CCC[C@]2(CCCOC2)C1)[C@@H](c1ccccc1)c1ccc(F)cc1 ZINC000475743226 890685642 /nfs/dbraw/zinc/68/56/42/890685642.db2.gz XMUFVXWVVLSJAC-DQEYMECFSA-N 0 3 410.533 4.266 20 0 HIADHN C[C@H](NCC1(N2CCSCC2)CCCC1)c1nc(-c2ccc(Cl)cc2)no1 ZINC000475756064 890702521 /nfs/dbraw/zinc/70/25/21/890702521.db2.gz ZIJIOPDYEWUXDL-HNNXBMFYSA-N 0 3 406.983 4.402 20 0 HIADHN CN(C(=O)c1cc(NCc2ccccc2)nc2ccccc21)[C@H]1CCN(C2CC2)C1 ZINC000475842109 890775307 /nfs/dbraw/zinc/77/53/07/890775307.db2.gz YSKZDADRTDBXMC-FQEVSTJZSA-N 0 3 400.526 4.156 20 0 HIADHN O=C(N[C@H](c1ccccc1)C1CCCC1)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1CO ZINC000475894153 890826829 /nfs/dbraw/zinc/82/68/29/890826829.db2.gz ZTRZZGKOBYJQOM-UBFVSLLYSA-N 0 3 421.585 4.100 20 0 HIADHN Cc1nc(CC(C)C)oc1C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000475908669 890837980 /nfs/dbraw/zinc/83/79/80/890837980.db2.gz BDQDFPKFEQMUQT-IBGZPJMESA-N 0 3 407.518 4.077 20 0 HIADHN Cc1nc(CC2CC2)sc1C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475913421 890841384 /nfs/dbraw/zinc/84/13/84/890841384.db2.gz YBXNNYTZPBCIKU-LJQANCHMSA-N 0 3 421.570 4.300 20 0 HIADHN CC(C)C[C@H](NC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1CO)c1cccs1 ZINC000475916825 890844439 /nfs/dbraw/zinc/84/44/39/890844439.db2.gz ONBQESMKYLLBED-HKBOAZHASA-N 0 3 415.603 4.018 20 0 HIADHN CC(C)(CNC(=O)Nc1cccc(N2CCCCC2=O)c1)N1CCc2ccccc2C1 ZINC000504770532 913502825 /nfs/dbraw/zinc/50/28/25/913502825.db2.gz MYILNQQOIUMWOP-UHFFFAOYSA-N 0 3 420.557 4.162 20 0 HIADHN Cn1cc(C(=O)NC[C@H](c2ccccc2)N2CCCC2)c(-c2ccc(Cl)s2)n1 ZINC000476022436 890955126 /nfs/dbraw/zinc/95/51/26/890955126.db2.gz MECHLBKIEIPYFQ-QGZVFWFLSA-N 0 3 414.962 4.369 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N[C@H](CC(C)(C)C)c2ccc(F)cc2)CC1 ZINC000476036719 890967327 /nfs/dbraw/zinc/96/73/27/890967327.db2.gz UXSFYKHFXFOBOT-OAQYLSRUSA-N 0 3 407.574 4.492 20 0 HIADHN O=C(c1cc2sc(N3CCCC3)nc2s1)N1CCCN(C2CCCC2)CC1 ZINC000476091273 891014916 /nfs/dbraw/zinc/01/49/16/891014916.db2.gz OYPUDKJVKPSKDI-UHFFFAOYSA-N 0 3 404.605 4.049 20 0 HIADHN C[C@@H](NC(=O)N(C)[C@H]1CCN(C2CC2)C1)c1ccc(NC(=O)c2ccc(F)cc2)cc1 ZINC000476152455 891076045 /nfs/dbraw/zinc/07/60/45/891076045.db2.gz MBEAIEKQAZOAOA-ZHRRBRCNSA-N 0 3 424.520 4.017 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1ccc(OCC2CCOCC2)cc1)c1ccco1 ZINC000476162254 891087872 /nfs/dbraw/zinc/08/78/72/891087872.db2.gz QABVSCUJTQBJFB-LAUBAEHRSA-N 0 3 415.534 4.336 20 0 HIADHN CC(C)([C@@H](NC(=O)Cn1cnc2ccccc21)c1ccc(F)c(F)c1)N1CCCC1 ZINC000476187090 891119904 /nfs/dbraw/zinc/11/99/04/891119904.db2.gz FJNRWMBVTPJKIM-QFIPXVFZSA-N 0 3 412.484 4.046 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)N[C@H]2CCSc3ccc(Cl)cc32)cc1 ZINC000476203666 891133762 /nfs/dbraw/zinc/13/37/62/891133762.db2.gz FQVJQUPQFJWWKZ-OALUTQOASA-N 0 3 419.978 4.488 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)Nc1c(F)cc(F)cc1Br ZINC000476367597 891276299 /nfs/dbraw/zinc/27/62/99/891276299.db2.gz UMBXILPFIQVKEJ-UHFFFAOYSA-N 0 3 412.278 4.323 20 0 HIADHN CC[C@H]1CCCCN1CCNC(=O)c1cn(C2CC2)c2cc(Cl)c(F)cc2c1=O ZINC000476425236 891336602 /nfs/dbraw/zinc/33/66/02/891336602.db2.gz UMMZMHGYERKJBC-AWEZNQCLSA-N 0 3 419.928 4.123 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N(CCc2ccccc2F)C2CCCC2)CC1 ZINC000476445292 891356177 /nfs/dbraw/zinc/35/61/77/891356177.db2.gz CSRSVIJILQDGNU-UHFFFAOYSA-N 0 3 419.585 4.212 20 0 HIADHN CCN(C(=O)NC1CCN(CCOC(C)C)CC1)[C@@H](Cc1ccc(F)cc1)C(C)C ZINC000476446168 891358164 /nfs/dbraw/zinc/35/81/64/891358164.db2.gz DUOBSRWWMUWCMN-QHCPKHFHSA-N 0 3 421.601 4.314 20 0 HIADHN COc1ccccc1[C@H](C)N(C)C(=O)CN1CCN(C2CCC(C(C)C)CC2)CC1 ZINC000476537635 891449097 /nfs/dbraw/zinc/44/90/97/891449097.db2.gz CUKAPGPAIBWWOV-HWELCPFYSA-N 0 3 415.622 4.047 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)c2ccc(COC(F)(F)F)cc2)cc1 ZINC000476551435 891467127 /nfs/dbraw/zinc/46/71/27/891467127.db2.gz SAFNMOXHBPOGNB-FQEVSTJZSA-N 0 3 422.447 4.299 20 0 HIADHN C[C@@H](c1ccc(Cl)cc1)N(C)C(=O)CN1CC[C@H](COCc2ccccc2)C1 ZINC000476590083 891520294 /nfs/dbraw/zinc/52/02/94/891520294.db2.gz YHAAIIFQAWADGL-ICSRJNTNSA-N 0 3 400.950 4.398 20 0 HIADHN Cc1nc2c(s1)[C@@H](N(C)C(=O)NC[C@@H](c1cccs1)N1CCCC1)CCC2 ZINC000476687520 891639802 /nfs/dbraw/zinc/63/98/02/891639802.db2.gz VOVOIOSLGMLEIS-IRXDYDNUSA-N 0 3 404.605 4.369 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CCC[C@@H]1c1csc(C)n1)c1cccc(OC)c1 ZINC000476721452 891686696 /nfs/dbraw/zinc/68/66/96/891686696.db2.gz IWOWOTVIRNMTDC-RTWAWAEBSA-N 0 3 416.591 4.390 20 0 HIADHN COCCN1CCC(NC(=O)N[C@H](c2ccccc2)c2cccc3ccccc32)CC1 ZINC000476738927 891705742 /nfs/dbraw/zinc/70/57/42/891705742.db2.gz YIMCTTZOJOFGKL-RUZDIDTESA-N 0 3 417.553 4.339 20 0 HIADHN C[C@@H](CNC(=O)c1cn(C2CC2)c2cc(Cl)c(F)cc2c1=O)N1CCCC[C@@H]1C ZINC000476763676 891735279 /nfs/dbraw/zinc/73/52/79/891735279.db2.gz NKAYUAMFNCUIPE-KBPBESRZSA-N 0 3 419.928 4.122 20 0 HIADHN O=C(Nc1cccc2c1CN(CC(F)(F)F)C2)N1CCN(C2CCCCC2)CC1 ZINC000504859444 913589844 /nfs/dbraw/zinc/58/98/44/913589844.db2.gz UIRAYEMJJLHKLG-UHFFFAOYSA-N 0 3 410.484 4.047 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N(Cc2ccccc2)CC2CCOCC2)C1 ZINC000476816883 891803066 /nfs/dbraw/zinc/80/30/66/891803066.db2.gz OKJGPEHAYZSTNC-BWKNWUBXSA-N 0 3 421.585 4.460 20 0 HIADHN O=C(c1ccnc2[nH]cnc21)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000476856994 891824794 /nfs/dbraw/zinc/82/47/94/891824794.db2.gz VWAAGUXCOAYPQT-UHFFFAOYSA-N 0 3 418.328 4.003 20 0 HIADHN O=C(Nc1ccccc1C(=O)N1CCCCC1)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000504877131 913606172 /nfs/dbraw/zinc/60/61/72/913606172.db2.gz RZODRROVCHRVGX-NRFANRHFSA-N 0 3 420.557 4.099 20 0 HIADHN CN(C)Cc1ccsc1C(=O)NC[C@@H]1CCN(C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000476984683 891910429 /nfs/dbraw/zinc/91/04/29/891910429.db2.gz YOBQVFXYBBFNJH-KBXCAEBGSA-N 0 3 409.958 4.025 20 0 HIADHN COc1ccc([C@H]2CCCCCN2C(=O)CN2CCC[C@]3(CCCOC3)C2)cc1 ZINC000477051839 891981639 /nfs/dbraw/zinc/98/16/39/891981639.db2.gz TVAYDVLMGXGTKH-VWNXMTODSA-N 0 3 400.563 4.032 20 0 HIADHN C[C@H](c1ccc([S@](C)=O)cc1)N(C)CCC(=O)Nc1cccc(Br)c1 ZINC000477056149 891987894 /nfs/dbraw/zinc/98/78/94/891987894.db2.gz JKWGZOPCFOWXJS-PWECECGKSA-N 0 3 423.376 4.208 20 0 HIADHN CC[C@H](c1ccccc1)[C@H]1CCCN1Cc1ccc(S(=O)(=O)N2CCCC2)o1 ZINC000477184844 892106769 /nfs/dbraw/zinc/10/67/69/892106769.db2.gz DUSMQKIXNRLAKZ-NHCUHLMSSA-N 0 3 402.560 4.222 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2ccc(C(C)(C)C)s2)cc1)[C@@H]1CCCN(C)C1 ZINC000477278154 892231145 /nfs/dbraw/zinc/23/11/45/892231145.db2.gz KMSWAWKURYYCIA-GOSISDBHSA-N 0 3 413.587 4.464 20 0 HIADHN C[C@H](CNC(=O)N1CCn2cccc2[C@H]1c1ccccc1)N(C)Cc1ccccc1 ZINC000477397717 892352265 /nfs/dbraw/zinc/35/22/65/892352265.db2.gz XYTMHAGZCDSPGE-HYBUGGRVSA-N 0 3 402.542 4.123 20 0 HIADHN Cc1nc(-c2ccc(F)c(F)c2)sc1C(=O)N1CCCN(C2CCCC2)CC1 ZINC000477421859 892374680 /nfs/dbraw/zinc/37/46/80/892374680.db2.gz ZCHXQKODZTUKNX-UHFFFAOYSA-N 0 3 405.514 4.487 20 0 HIADHN O[C@H](COc1cccc(C(F)(F)F)c1)CN1CCC[C@@H]1c1ccc2c(c1)OCO2 ZINC000477458620 892420484 /nfs/dbraw/zinc/42/04/84/892420484.db2.gz LKFILFPDMAWICL-FUHWJXTLSA-N 0 3 409.404 4.011 20 0 HIADHN CN(C(=O)N[C@H]1CCCc2nc(-c3ccc(F)cc3)sc21)[C@@H]1CCN(C2CC2)C1 ZINC000477496933 892499492 /nfs/dbraw/zinc/49/94/92/892499492.db2.gz IANUNLUIMZLOJV-MJGOQNOKSA-N 0 3 414.550 4.205 20 0 HIADHN CCc1cccc2c(CCNC(=O)N(CCN(C)C)Cc3cccc(F)c3)c[nH]c21 ZINC000477658778 892794738 /nfs/dbraw/zinc/79/47/38/892794738.db2.gz ICMAGNSJGNGPSL-UHFFFAOYSA-N 0 3 410.537 4.185 20 0 HIADHN CCc1cccc2c(CCNC(=O)N(Cc3ccco3)C3CCN(C)CC3)c[nH]c21 ZINC000477667299 892802140 /nfs/dbraw/zinc/80/21/40/892802140.db2.gz VZFUTSKLUBVFOF-UHFFFAOYSA-N 0 3 408.546 4.172 20 0 HIADHN CN(C(=O)CNC1(c2cccc(Br)c2)CCCCC1)c1nccs1 ZINC000477667447 892802250 /nfs/dbraw/zinc/80/22/50/892802250.db2.gz VNENENRNUQVJIE-UHFFFAOYSA-N 0 3 408.365 4.318 20 0 HIADHN Cn1cc(-c2cc(F)ccc2NC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)cn1 ZINC000477670869 892803383 /nfs/dbraw/zinc/80/33/83/892803383.db2.gz GZVJGNXBIYZLDL-KRWDZBQOSA-N 0 3 410.468 4.216 20 0 HIADHN CC(C)n1ncc2c1C[C@H](N[C@@H](C)c1ccccc1I)CC2 ZINC000477686643 892810101 /nfs/dbraw/zinc/81/01/01/892810101.db2.gz AQFAJLBUOLXVBB-DZGCQCFKSA-N 0 3 409.315 4.277 20 0 HIADHN Cc1ccc2c(CCC(=O)Nc3cccc(CN4CCC(CO)CC4)c3)c[nH]c2c1 ZINC000477703793 892818388 /nfs/dbraw/zinc/81/83/88/892818388.db2.gz PZPANJUNLDYVNK-UHFFFAOYSA-N 0 3 405.542 4.252 20 0 HIADHN C[C@H](CSc1ccc(F)cc1)C(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000477718135 892824775 /nfs/dbraw/zinc/82/47/75/892824775.db2.gz XNVCQDPWMBUVSH-QGZVFWFLSA-N 0 3 416.562 4.397 20 0 HIADHN O=C(CSc1ccc(Cl)cc1)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000477722671 892826615 /nfs/dbraw/zinc/82/66/15/892826615.db2.gz KLMPWNHQIMCMCL-UHFFFAOYSA-N 0 3 404.963 4.275 20 0 HIADHN Cc1cc(O[C@H](C)C(=O)Nc2cccc(CN3CCC(CO)CC3)c2)ccc1Cl ZINC000477727029 892828617 /nfs/dbraw/zinc/82/86/17/892828617.db2.gz QXTJVNNHRXHQDC-QGZVFWFLSA-N 0 3 416.949 4.259 20 0 HIADHN Cn1c2ccccc2c(Cl)c1C(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000477737701 892834383 /nfs/dbraw/zinc/83/43/83/892834383.db2.gz JLISQSRXDIZOCP-UHFFFAOYSA-N 0 3 411.933 4.288 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1ccc2c3c(cccc31)CC2 ZINC000477742311 892837913 /nfs/dbraw/zinc/83/79/13/892837913.db2.gz LIWWWMLMUNNJQH-UHFFFAOYSA-N 0 3 400.522 4.395 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CCC[C@H]1c1ccc2c(c1)OCO2)c1ccsc1 ZINC000477744960 892839731 /nfs/dbraw/zinc/83/97/31/892839731.db2.gz CWWVBRXJXZNHAL-OALUTQOASA-N 0 3 415.559 4.406 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)c1ccc(Br)c(Cl)c1 ZINC000477752903 892844355 /nfs/dbraw/zinc/84/43/55/892844355.db2.gz XZEQPWRWWPVZDH-UHFFFAOYSA-N 0 3 423.738 4.312 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)N(C)Cc2nc(-c3ccccc3)c[nH]2)C1 ZINC000477817702 892885998 /nfs/dbraw/zinc/88/59/98/892885998.db2.gz GQNQZRULKFMLBB-RXVVDRJESA-N 0 3 403.530 4.054 20 0 HIADHN COC(=O)c1csc(-c2cccc(CN[C@@H](C)c3ccc([S@@](C)=O)cc3)c2)n1 ZINC000477849239 892907252 /nfs/dbraw/zinc/90/72/52/892907252.db2.gz OYHALOCLDQXHCA-HJFSHJIFSA-N 0 3 414.552 4.185 20 0 HIADHN COC(=O)c1csc(-c2cccc(CN[C@@H](C)c3ccc([S@](C)=O)cc3)c2)n1 ZINC000477849241 892908481 /nfs/dbraw/zinc/90/84/81/892908481.db2.gz OYHALOCLDQXHCA-POXGOYDTSA-N 0 3 414.552 4.185 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)NCc2ccccc2OC(F)F)N(C)C)cc1 ZINC000477851006 892910240 /nfs/dbraw/zinc/91/02/40/892910240.db2.gz MFUPRCSTELUGOZ-LJQANCHMSA-N 0 3 421.488 4.177 20 0 HIADHN CC(C)CC[C@H](NCc1ccc(S(=O)(=O)CCO)cc1)c1ccc(Cl)cc1 ZINC000477914947 892997471 /nfs/dbraw/zinc/99/74/71/892997471.db2.gz HBVXSAVYYVPSEG-NRFANRHFSA-N 0 3 409.979 4.373 20 0 HIADHN CCN(CC)C(=O)Nc1ccc([C@@H](C)N[C@H]2CCN(Cc3ccc(C)cc3)C2=O)cc1 ZINC000477918230 893001819 /nfs/dbraw/zinc/00/18/19/893001819.db2.gz OYDLGMXVGISLDJ-XXBNENTESA-N 0 3 422.573 4.320 20 0 HIADHN O=C(Nc1ccc(OCC(F)(F)F)c(F)c1)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000504977767 913721608 /nfs/dbraw/zinc/72/16/08/913721608.db2.gz VFSACAUATUHDGQ-MRXNPFEDSA-N 0 3 411.399 4.163 20 0 HIADHN CCCN(C(=O)[C@H]1CC(=O)Nc2cc(F)ccc21)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000504994393 913740450 /nfs/dbraw/zinc/74/04/50/913740450.db2.gz OLGHYAJQUCOGNX-UNMCSNQZSA-N 0 3 423.532 4.155 20 0 HIADHN Cc1ccc(-c2n[nH]c(SCC(=O)Nc3ccc(CN(C)C)c(Cl)c3)n2)cc1 ZINC000478054022 893206737 /nfs/dbraw/zinc/20/67/37/893206737.db2.gz OLFRQCAIUMCDDQ-UHFFFAOYSA-N 0 3 415.950 4.226 20 0 HIADHN CC1CCN([C@H](CNC(=O)Nc2cccc3c2ccn(C)c3=O)c2ccccc2)CC1 ZINC000505006316 913749068 /nfs/dbraw/zinc/74/90/68/913749068.db2.gz SMELUWVAUWQHSA-HSZRJFAPSA-N 0 3 418.541 4.133 20 0 HIADHN CC1CCN([C@H](CNC(=O)Nc2cccc3c2ccn(C)c3=O)c2cccs2)CC1 ZINC000505007189 913750502 /nfs/dbraw/zinc/75/05/02/913750502.db2.gz ZOFISCXFCNUMBW-HXUWFJFHSA-N 0 3 424.570 4.195 20 0 HIADHN CC[C@H](C)NC(=O)CCNCc1cn(-c2ccc(Br)cc2)nc1C(C)C ZINC000478216263 893376248 /nfs/dbraw/zinc/37/62/48/893376248.db2.gz YXDMHJSUURPYMK-HNNXBMFYSA-N 0 3 421.383 4.153 20 0 HIADHN CCN(CC(=O)Nc1c(Cl)cccc1Cl)C(=O)[C@@H](C)N1[C@H](C)CC[C@@H]1C ZINC000478231929 893392926 /nfs/dbraw/zinc/39/29/26/893392926.db2.gz HEXRGXRXFXTTIV-HZSPNIEDSA-N 0 3 400.350 4.042 20 0 HIADHN C[C@@H](CNC(=O)C(=O)Nc1ccc(Oc2ccccc2)cc1)N(C)Cc1ccccc1 ZINC000478255737 893435738 /nfs/dbraw/zinc/43/57/38/893435738.db2.gz PIYWDWQOFAOQCI-IBGZPJMESA-N 0 3 417.509 4.054 20 0 HIADHN C[C@H](CC(=O)Nc1ccccc1)N[C@@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O ZINC000478273733 893471763 /nfs/dbraw/zinc/47/17/63/893471763.db2.gz KSXAISKAZHJVSD-FZKQIMNGSA-N 0 3 406.313 4.106 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)NCc1ccnc(OCc2ccccc2)c1 ZINC000478298192 893513163 /nfs/dbraw/zinc/51/31/63/893513163.db2.gz GUFBSTCNFQVGQR-UHFFFAOYSA-N 0 3 410.562 4.068 20 0 HIADHN CC[C@@H](C)n1ncc(C(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)c1C ZINC000478333471 893568165 /nfs/dbraw/zinc/56/81/65/893568165.db2.gz DWRBGSFSLMEOMF-WIYYLYMNSA-N 0 3 420.561 4.367 20 0 HIADHN Cc1ccc(-c2noc(CCCN[C@H](c3cnn(C)c3)c3ccc(F)cc3)n2)cc1F ZINC000478336060 893572073 /nfs/dbraw/zinc/57/20/73/893572073.db2.gz XPQWWLTWDBJRSW-QFIPXVFZSA-N 0 3 423.467 4.369 20 0 HIADHN CN1C[C@H](NC(=O)Cc2csc(-c3ccccc3Cl)n2)[C@@H](c2ccccc2)C1 ZINC000478370950 893634688 /nfs/dbraw/zinc/63/46/88/893634688.db2.gz MZHQSIRGROGKDS-QUCCMNQESA-N 0 3 411.958 4.220 20 0 HIADHN CCCN(C(=O)CCc1nc(C(C)(C)C)no1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000505046085 913789290 /nfs/dbraw/zinc/78/92/90/913789290.db2.gz OGIQHBRZERURTH-HXUWFJFHSA-N 0 3 412.578 4.203 20 0 HIADHN COc1cc2c(cc1OC)[C@@H](c1ccccc1)N(CCC(=O)Nc1cccnc1)CC2 ZINC000478485116 893807476 /nfs/dbraw/zinc/80/74/76/893807476.db2.gz SPJTVTQFCXCUPP-RUZDIDTESA-N 0 3 417.509 4.075 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)NCCc1cccc(OCC(F)(F)F)c1 ZINC000478514723 893822842 /nfs/dbraw/zinc/82/28/42/893822842.db2.gz FQRYZRYEAGXGOU-UHFFFAOYSA-N 0 3 420.431 4.408 20 0 HIADHN O=C(NCCCCN1CCN(c2cccc(C(F)(F)F)c2)CC1)Nc1ccccc1 ZINC000505124614 913829574 /nfs/dbraw/zinc/82/95/74/913829574.db2.gz RCUICFUJGJOHCP-UHFFFAOYSA-N 0 3 420.479 4.429 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)N[C@H](CC(F)(F)F)c2ccccc2)c1 ZINC000478940371 894221935 /nfs/dbraw/zinc/22/19/35/894221935.db2.gz UICRGPVCKUMNIS-HXUWFJFHSA-N 0 3 423.479 4.462 20 0 HIADHN COCCSc1ccc([C@@H](C)N[C@@H]2CCCN(c3ccccc3F)C2=O)cc1 ZINC000479043254 894305417 /nfs/dbraw/zinc/30/54/17/894305417.db2.gz WCNAPEZLOJHAKP-OXQOHEQNSA-N 0 3 402.535 4.410 20 0 HIADHN Cc1cc(Br)cc(Cl)c1C(=O)NC1CCN(CCOC(C)C)CC1 ZINC000479050738 894311200 /nfs/dbraw/zinc/31/12/00/894311200.db2.gz TYQIWIMTKOMNTK-UHFFFAOYSA-N 0 3 417.775 4.030 20 0 HIADHN O=c1ccccn1Cc1ccc(CN[C@H]2CCCc3nn(-c4ccccc4)cc32)cc1 ZINC000479057865 894316190 /nfs/dbraw/zinc/31/61/90/894316190.db2.gz IQIHPTMNOBVRLB-DEOSSOPVSA-N 0 3 410.521 4.250 20 0 HIADHN Cc1csc(CCCCN[C@@H](C)c2cc(S(N)(=O)=O)c(Cl)cc2Cl)n1 ZINC000479060474 894320882 /nfs/dbraw/zinc/32/08/82/894320882.db2.gz ACZYYOIZYLFASC-NSHDSACASA-N 0 3 422.403 4.079 20 0 HIADHN C[C@H](NC[C@@H]1CCCO[C@H]1C(C)(C)C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479080967 894347071 /nfs/dbraw/zinc/34/70/71/894347071.db2.gz OTOBLFKCBRLYSP-NVGCLXPQSA-N 0 3 423.406 4.133 20 0 HIADHN CC[C@H](C)NC(=O)[C@@H]1C[C@H](C)N(Cc2nc(-c3ccsc3)no2)[C@@H]2CCCC[C@H]12 ZINC000479114287 894382279 /nfs/dbraw/zinc/38/22/79/894382279.db2.gz IGXGGZLOAITQNC-BHEBFOIGSA-N 0 3 416.591 4.482 20 0 HIADHN CCCN1CCC[C@H]1C(=O)Nc1cccc(CNC(=O)Nc2ccccc2Cl)c1 ZINC000479200735 894466377 /nfs/dbraw/zinc/46/63/77/894466377.db2.gz WAHXRBIZPCGJFQ-FQEVSTJZSA-N 0 3 414.937 4.475 20 0 HIADHN C[C@H](Cc1ccc(Br)cc1)NCc1nnc2ccc(C(F)(F)F)cn21 ZINC000479267987 894540066 /nfs/dbraw/zinc/54/00/66/894540066.db2.gz YIOHLWBKMOUNFX-LLVKDONJSA-N 0 3 413.241 4.231 20 0 HIADHN CN(C)CCN(C(=O)Nc1cc(Br)ccc1N1CCCC1)C1CCCC1 ZINC000479327113 894619670 /nfs/dbraw/zinc/61/96/70/894619670.db2.gz YOSOWWOXKOBIGV-UHFFFAOYSA-N 0 3 423.399 4.387 20 0 HIADHN O=C1CCCN1Cc1ccc(CN[C@H]2CCCc3nn(-c4ccccc4)cc32)cc1 ZINC000479330796 894623997 /nfs/dbraw/zinc/62/39/97/894623997.db2.gz MGFJDNHGSKGJHL-QHCPKHFHSA-N 0 3 400.526 4.162 20 0 HIADHN COCCOc1ccc([C@H](C)N[C@@H]2CCc3cc(OC)c(OC)cc32)cc1OC ZINC000479344764 894639190 /nfs/dbraw/zinc/63/91/90/894639190.db2.gz DBSMFKCRVQILMZ-HNAYVOBHSA-N 0 3 401.503 4.076 20 0 HIADHN CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)NCCCc1cccc(Cl)c1 ZINC000479359134 894658478 /nfs/dbraw/zinc/65/84/78/894658478.db2.gz JWLKKYIETYNKJG-FPOVZHCZSA-N 0 3 400.954 4.002 20 0 HIADHN COc1cc2c(cc1OC)[C@@H](NCc1ccc(N3CCc4ccccc4C3)nc1)CC2 ZINC000479366240 894666079 /nfs/dbraw/zinc/66/60/79/894666079.db2.gz WZBCIEHBKJKVEJ-QHCPKHFHSA-N 0 3 415.537 4.439 20 0 HIADHN C[C@H](NCCc1nc(-c2cccc(Cl)c2)no1)c1ccc(Br)cn1 ZINC000479400103 894703252 /nfs/dbraw/zinc/70/32/52/894703252.db2.gz XFFHILBOWPJUAQ-NSHDSACASA-N 0 3 407.699 4.441 20 0 HIADHN C[C@H](NCCOc1ccc(Br)cc1)c1ccc(Br)cn1 ZINC000479407016 894712731 /nfs/dbraw/zinc/71/27/31/894712731.db2.gz KHLGXYKRFKVZHK-NSHDSACASA-N 0 3 400.114 4.336 20 0 HIADHN C[C@H](NC1(Cc2ccccc2)CCC1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479412288 894719541 /nfs/dbraw/zinc/71/95/41/894719541.db2.gz AHKGGJYIQKIVAZ-ZDUSSCGKSA-N 0 3 413.370 4.457 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)N(C)Cc2nc(-c3ccccc3)c[nH]2)N(C)C)cc1 ZINC000479415229 894723657 /nfs/dbraw/zinc/72/36/57/894723657.db2.gz MPCBVXUACRKKOM-JOCHJYFZSA-N 0 3 405.546 4.083 20 0 HIADHN CN(Cc1nc(-c2ccccc2)c[nH]1)C(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000479423534 894736167 /nfs/dbraw/zinc/73/61/67/894736167.db2.gz PZTGKZMYKJHJPH-IBGZPJMESA-N 0 3 409.559 4.117 20 0 HIADHN C[C@H]1CCCN(S(=O)(=O)c2ccc(CN[C@@H]3CCc4ccc(F)cc43)cc2)C1 ZINC000479433049 894746450 /nfs/dbraw/zinc/74/64/50/894746450.db2.gz XOIUUBJOSDUEKM-KSFYIVLOSA-N 0 3 402.535 4.023 20 0 HIADHN O=C1c2ccccc2CCN1CCN[C@@H](c1ccc(Br)cc1F)C1CC1 ZINC000479439476 894754514 /nfs/dbraw/zinc/75/45/14/894754514.db2.gz QMAPXEKXKBLBTC-HXUWFJFHSA-N 0 3 417.322 4.327 20 0 HIADHN O=C1[C@H](N[C@H]2CCCc3cc(Br)ccc32)CCCN1Cc1ccccn1 ZINC000479447138 894765449 /nfs/dbraw/zinc/76/54/49/894765449.db2.gz CGMYRLXUZCPLEZ-VQTJNVASSA-N 0 3 414.347 4.002 20 0 HIADHN CCS(=O)(=O)c1c(Cl)cccc1CN[C@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000479458448 894779549 /nfs/dbraw/zinc/77/95/49/894779549.db2.gz XSBMWPFRJQLVMK-PKOBYXMFSA-N 0 3 411.926 4.283 20 0 HIADHN Cc1c([C@H](C)NC2CC(N3CCC(C(F)(F)F)CC3)C2)nnn1-c1ccc(C)cc1 ZINC000479472013 894794205 /nfs/dbraw/zinc/79/42/05/894794205.db2.gz BRFQOIHRGZJTEQ-IJNIYJAUSA-N 0 3 421.511 4.340 20 0 HIADHN CCS(=O)(=O)c1c(Cl)cccc1CNCCc1cn(C)c2cc(F)ccc12 ZINC000479476464 894800061 /nfs/dbraw/zinc/80/00/61/894800061.db2.gz BRVSORDYYQGBCP-UHFFFAOYSA-N 0 3 408.926 4.097 20 0 HIADHN CC(=O)N1CCC[C@@H](CN[C@H](c2ccc3c(c2)OCCO3)c2ccccc2Cl)C1 ZINC000479489284 894810699 /nfs/dbraw/zinc/81/06/99/894810699.db2.gz JLBFGHXHZLGQIP-GAJHUEQPSA-N 0 3 414.933 4.049 20 0 HIADHN C[C@H](NCc1ccc2ncccc2c1)c1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000479507188 894821987 /nfs/dbraw/zinc/82/19/87/894821987.db2.gz ZFERNPYFLZOBOV-SFHVURJKSA-N 0 3 409.555 4.260 20 0 HIADHN C[C@H]1CN(Cc2ccccn2)CC[C@@H]1Nc1ccc(NC(=O)c2ccccc2)cn1 ZINC000479535588 894840090 /nfs/dbraw/zinc/84/00/90/894840090.db2.gz AGKXSRQUSNFTKF-AVRDEDQJSA-N 0 3 401.514 4.051 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2ncc(Cc3ccccc3)s2)c1 ZINC000479577779 894869070 /nfs/dbraw/zinc/86/90/70/894869070.db2.gz OYUGLXDRIHTGJT-UHFFFAOYSA-N 0 3 424.570 4.338 20 0 HIADHN CCCCCOc1ccc(CNCc2ccc(N3CCCS3(=O)=O)c(F)c2)cc1 ZINC000479608405 894882191 /nfs/dbraw/zinc/88/21/91/894882191.db2.gz VTMXFDYTIRICQW-UHFFFAOYSA-N 0 3 420.550 4.224 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3CC[C@@](C)(c4ccc(F)cc4)C3)c(C)c2)CC1 ZINC000479617254 894887694 /nfs/dbraw/zinc/88/76/94/894887694.db2.gz VHHWWDIIAZKCNI-RUZDIDTESA-N 0 3 424.564 4.472 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)NCc1ncoc1-c1ccccc1 ZINC000479730436 895029595 /nfs/dbraw/zinc/02/95/95/895029595.db2.gz PWRQXSKBXOUOTK-UHFFFAOYSA-N 0 3 406.530 4.048 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)N[C@@H](C)c2ccc3ncsc3c2)c1 ZINC000479763448 895064409 /nfs/dbraw/zinc/06/44/09/895064409.db2.gz PHOXIYONXFYUMR-INIZCTEOSA-N 0 3 412.559 4.139 20 0 HIADHN COc1cc([C@H](C)NC(=O)N[C@H](CN(C)C)c2ccc(F)cc2)ccc1OC(C)C ZINC000479790014 895094559 /nfs/dbraw/zinc/09/45/59/895094559.db2.gz QIGNYEKCNADVFV-OXJNMPFZSA-N 0 3 417.525 4.285 20 0 HIADHN COc1ccc(C(=O)Nc2ccc(C(=O)N[C@@H](C)CN3CCCCCC3)s2)cc1 ZINC000479797502 895103203 /nfs/dbraw/zinc/10/32/03/895103203.db2.gz OSTFFWBRZBYZQL-INIZCTEOSA-N 0 3 415.559 4.003 20 0 HIADHN C[C@H](CN1CCCCCC1)NC(=O)c1ccc(NC(=O)Nc2ccccc2)s1 ZINC000479804110 895108832 /nfs/dbraw/zinc/10/88/32/895108832.db2.gz LBSRTPFRZYQGGX-MRXNPFEDSA-N 0 3 400.548 4.386 20 0 HIADHN CCOC(=O)c1cc(NC[C@H](c2ccc(OC)cc2)N2CCCC2)ncc1Cl ZINC000479849206 895182188 /nfs/dbraw/zinc/18/21/88/895182188.db2.gz PSOJMKZBKUHOLU-LJQANCHMSA-N 0 3 403.910 4.169 20 0 HIADHN COC[C@@H](NC[C@H](c1cccs1)N1CCOCC1)c1cccc(C(F)(F)F)c1 ZINC000479856242 895191368 /nfs/dbraw/zinc/19/13/68/895191368.db2.gz WDCKUCNZNUXBNJ-QZTJIDSGSA-N 0 3 414.493 4.118 20 0 HIADHN COc1ccc([C@H](C)NCc2ccccc2CN2CCOCC2)cc1Br ZINC000479872133 895215307 /nfs/dbraw/zinc/21/53/07/895215307.db2.gz GUZMDJZYUJVMEP-INIZCTEOSA-N 0 3 419.363 4.141 20 0 HIADHN COc1ccc([C@@H](C)NCc2ccccc2CN2CCOCC2)cc1Br ZINC000479872134 895215527 /nfs/dbraw/zinc/21/55/27/895215527.db2.gz GUZMDJZYUJVMEP-MRXNPFEDSA-N 0 3 419.363 4.141 20 0 HIADHN COc1ccccc1[C@H](CN[C@H](C)c1nnn(-c2ccc(F)cc2)c1C)N1CCCC1 ZINC000479875490 895218769 /nfs/dbraw/zinc/21/87/69/895218769.db2.gz QSZDSZCCCYNMCA-VGSWGCGISA-N 0 3 423.536 4.211 20 0 HIADHN COc1ccc(CN[C@H]2CCN(c3ccccc3C(F)(F)F)C2)c(OC)c1OC ZINC000479883614 895228280 /nfs/dbraw/zinc/22/82/80/895228280.db2.gz MDWLIQNNJQMBCR-HNNXBMFYSA-N 0 3 410.436 4.100 20 0 HIADHN CC(C)(C)c1ccc2cc(C(=O)NCc3ccccc3CN3CCC(O)CC3)[nH]c2c1 ZINC000479975075 895327529 /nfs/dbraw/zinc/32/75/29/895327529.db2.gz LHCJPPXDXRNMGT-UHFFFAOYSA-N 0 3 419.569 4.352 20 0 HIADHN C[C@H](NCc1cn(-c2ccccc2)nc1-c1ccccc1)c1ccc(-n2cnnn2)cc1 ZINC000480014603 895365578 /nfs/dbraw/zinc/36/55/78/895365578.db2.gz NNPKCGABQNWKKO-IBGZPJMESA-N 0 3 421.508 4.366 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2ccc(C3CCC3)cc2)cc1)[C@H]1CCCN(C)C1 ZINC000480025178 895375121 /nfs/dbraw/zinc/37/51/21/895375121.db2.gz XEFHRCVNSIGXTE-QHCPKHFHSA-N 0 3 405.542 4.373 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)C(C)(C)c2ccc(-c3ccccc3)cc2)CC1 ZINC000505303194 913962924 /nfs/dbraw/zinc/96/29/24/913962924.db2.gz FXVFODJXDLDONF-OAQYLSRUSA-N 0 3 407.602 4.021 20 0 HIADHN COc1cc(OC)c([C@H](C)NC[C@H](c2ccc(F)cc2)N2CCOCC2)cc1Cl ZINC000480068946 895417773 /nfs/dbraw/zinc/41/77/73/895417773.db2.gz KSXHTRRSOGKIPN-MGPUTAFESA-N 0 3 422.928 4.220 20 0 HIADHN COc1cccc([C@@H](CN[C@@H](C)c2cc(OC)c(OC)cc2F)N2CCCC2)c1 ZINC000480080239 895435815 /nfs/dbraw/zinc/43/58/15/895435815.db2.gz AAMAKJQXUJEGSZ-HRAATJIYSA-N 0 3 402.510 4.339 20 0 HIADHN COc1cccc([C@H](CN[C@@H](C)c2nnn(-c3ccc(F)cc3)c2C)N2CCCC2)c1 ZINC000480081454 895438301 /nfs/dbraw/zinc/43/83/01/895438301.db2.gz FOFHEOUPKLZTLB-SBUREZEXSA-N 0 3 423.536 4.211 20 0 HIADHN COc1ccc([C@H](CN[C@@H](C)c2ccc(F)cc2OC(F)F)N2CCOCC2)cc1 ZINC000480082996 895440176 /nfs/dbraw/zinc/44/01/76/895440176.db2.gz FWVPXWZVGBSEKP-YWZLYKJASA-N 0 3 424.463 4.160 20 0 HIADHN COc1ccc([C@H](CN[C@@H](C)c2nnn(-c3ccc(F)cc3)c2C)N2CCCC2)cc1 ZINC000480084467 895443895 /nfs/dbraw/zinc/44/38/95/895443895.db2.gz ROXOZFHQZHNZPX-SBUREZEXSA-N 0 3 423.536 4.211 20 0 HIADHN CC[C@@H](c1ccccc1)[C@@H]1CCCN1CC(=O)Nc1cccc(C(=O)NC2CC2)c1 ZINC000480118885 895491664 /nfs/dbraw/zinc/49/16/64/895491664.db2.gz DWEDSZOKOKMUJT-GOTSBHOMSA-N 0 3 405.542 4.176 20 0 HIADHN CC[C@H](CN[C@@H]1CCS(=O)(=O)c2ccc(Br)cc21)c1ccccc1 ZINC000480195885 895592214 /nfs/dbraw/zinc/59/22/14/895592214.db2.gz ONGZZXUJHIPCCR-RDTXWAMCSA-N 0 3 408.361 4.451 20 0 HIADHN COc1ccc2c(c1)[C@H](NCc1ccc(CN3C[C@@H](C)O[C@H](C)C3)cc1)CCCO2 ZINC000480241886 895650934 /nfs/dbraw/zinc/65/09/34/895650934.db2.gz QQJCKUBKMOBFOG-KHCICDEESA-N 0 3 410.558 4.308 20 0 HIADHN CC(C)[C@@H]1CCC[C@@H](N[C@H]2CCS(=O)(=O)c3ccc(Br)cc32)C1 ZINC000480256397 895666977 /nfs/dbraw/zinc/66/69/77/895666977.db2.gz AQUXUDOEGRGBBT-UNEWFSDZSA-N 0 3 400.382 4.472 20 0 HIADHN C[C@H](Cc1ccccc1F)N[C@@H]1CCS(=O)(=O)c2ccc(Br)cc21 ZINC000480258871 895667989 /nfs/dbraw/zinc/66/79/89/895667989.db2.gz SQFKTUUQCZEKKJ-SJKOYZFVSA-N 0 3 412.324 4.028 20 0 HIADHN C[C@@H](Cc1ccccc1F)N[C@H]1CCS(=O)(=O)c2ccc(Br)cc21 ZINC000480258869 895668625 /nfs/dbraw/zinc/66/86/25/895668625.db2.gz SQFKTUUQCZEKKJ-SJCJKPOMSA-N 0 3 412.324 4.028 20 0 HIADHN COc1cc(F)c([C@H](C)NC[C@@H](c2ccccc2Cl)N2CCOCC2)cc1OC ZINC000480272219 895680674 /nfs/dbraw/zinc/68/06/74/895680674.db2.gz BGCAFFMPXRVHPY-YWZLYKJASA-N 0 3 422.928 4.220 20 0 HIADHN CCOCc1ccccc1CN[C@H](C)c1ccc(S(=O)(=O)N(CC)CC)cc1 ZINC000480273743 895680888 /nfs/dbraw/zinc/68/08/88/895680888.db2.gz IXBJMBMASBWLSD-GOSISDBHSA-N 0 3 404.576 4.104 20 0 HIADHN Cc1cc(NC(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)nn1[C@H](C)C1CC1 ZINC000480320562 895723711 /nfs/dbraw/zinc/72/37/11/895723711.db2.gz RCTXDXBGENSPCE-UTKZUKDTSA-N 0 3 413.566 4.374 20 0 HIADHN CC[C@H](C(=O)N1CCC(NCc2nccn2-c2ccccc2)CC1)c1ccccc1 ZINC000480396187 895801074 /nfs/dbraw/zinc/80/10/74/895801074.db2.gz PBUHYXCABRVQSE-QHCPKHFHSA-N 0 3 402.542 4.147 20 0 HIADHN Cc1cccc(Oc2ccccc2NC(=O)N2CC[C@@H](N3CCN(C)CC3)[C@@H](C)C2)c1 ZINC000480408384 895809044 /nfs/dbraw/zinc/80/90/44/895809044.db2.gz VIXZZWRZCBEECQ-NZQKXSOJSA-N 0 3 422.573 4.277 20 0 HIADHN C[C@H](O)[C@](C)(CNCc1nc2cc(C(F)(F)F)ccc2n1C)Cc1ccccc1 ZINC000480449347 895838124 /nfs/dbraw/zinc/83/81/24/895838124.db2.gz YHNGHZWFXRNTNB-BTYIYWSLSA-N 0 3 405.464 4.312 20 0 HIADHN Fc1cc(Br)cc2c1CC[C@H]2N[C@@H](CN1CCOCC1)c1ccccc1 ZINC000480451766 895840176 /nfs/dbraw/zinc/84/01/76/895840176.db2.gz YHMNRXJHAWZJLL-RTWAWAEBSA-N 0 3 419.338 4.239 20 0 HIADHN Cc1ccc([C@H](CN2CCOCC2)N[C@H](C)c2ccc(NC(=O)NC(C)C)cc2)cc1 ZINC000480458415 895844930 /nfs/dbraw/zinc/84/49/30/895844930.db2.gz CUMRSPKDZIXIHI-YKSBVNFPSA-N 0 3 424.589 4.249 20 0 HIADHN Cc1cccc(Oc2ccc(NC(=O)N3CC[C@H](N4CCN(C)CC4)[C@@H](C)C3)cc2)c1 ZINC000480542156 895903967 /nfs/dbraw/zinc/90/39/67/895903967.db2.gz RCGBCYZHVMUXBO-RDPSFJRHSA-N 0 3 422.573 4.277 20 0 HIADHN CCCOc1ccc(CN[C@@H](C)c2ccc(NS(=O)(=O)CC)cc2)cc1OC ZINC000480549912 895910345 /nfs/dbraw/zinc/91/03/45/895910345.db2.gz GCFMGXCIVQRGMK-INIZCTEOSA-N 0 3 406.548 4.096 20 0 HIADHN Cc1cc(C(=O)NC[C@H]2CCCN(Cc3cccs3)C2)nn1-c1cccc(F)c1 ZINC000480570234 895929659 /nfs/dbraw/zinc/92/96/59/895929659.db2.gz UBIWXCASYIYODB-QGZVFWFLSA-N 0 3 412.534 4.023 20 0 HIADHN C[C@@H](NCc1ccc(N2C[C@@H](C)O[C@@H](C)C2)nc1)c1ccc(OCC(F)(F)F)cc1 ZINC000480600278 895962996 /nfs/dbraw/zinc/96/29/96/895962996.db2.gz GVGHCJGJOIHLMD-IXDOHACOSA-N 0 3 423.479 4.487 20 0 HIADHN Cn1cc(CN2CCN(C(c3ccccc3)c3ccccc3)CC2)c(-c2cccnc2)n1 ZINC000505355855 914020875 /nfs/dbraw/zinc/02/08/75/914020875.db2.gz NQVSOZFIIYRWLT-UHFFFAOYSA-N 0 3 423.564 4.389 20 0 HIADHN C[C@H](NCc1ccc(C(=O)N2CCN(C)CC2)cc1)c1ccc(Cl)c(Cl)c1 ZINC000480613788 895980645 /nfs/dbraw/zinc/98/06/45/895980645.db2.gz MSQZBJIMYAMDFL-HNNXBMFYSA-N 0 3 406.357 4.232 20 0 HIADHN C[C@H](NCc1ccnc(OCC(F)(F)F)c1)c1ccc(OCc2nccn2C)cc1 ZINC000480631331 896001127 /nfs/dbraw/zinc/00/11/27/896001127.db2.gz OADLKHJNSWMEPF-HNNXBMFYSA-N 0 3 420.435 4.186 20 0 HIADHN CN(C)C[C@@H](NC(=O)Nc1ccc2nc(-c3ccccn3)oc2c1)c1ccc(F)cc1 ZINC000480639849 896008650 /nfs/dbraw/zinc/00/86/50/896008650.db2.gz AJWYEWVYNQBIOD-HXUWFJFHSA-N 0 3 419.460 4.453 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)N1CCC[C@H]1c1ccc2c(c1)OCO2 ZINC000480652834 896021761 /nfs/dbraw/zinc/02/17/61/896021761.db2.gz XPPOEBRGFIWQQS-SFTDATJTSA-N 0 3 407.514 4.099 20 0 HIADHN CS[C@@H](CN[C@H]1CCS(=O)(=O)c2ccc(Br)cc21)C(C)(C)C ZINC000480657777 896025497 /nfs/dbraw/zinc/02/54/97/896025497.db2.gz AYNSCMPLFMFOGE-ZFWWWQNUSA-N 0 3 406.411 4.035 20 0 HIADHN CCCOc1ccc([C@@H](C)NCc2ccc(N3CCCS3(=O)=O)c(F)c2)cc1 ZINC000480665088 896031241 /nfs/dbraw/zinc/03/12/41/896031241.db2.gz PXHUIKJNBQUCRE-MRXNPFEDSA-N 0 3 406.523 4.005 20 0 HIADHN CC(C)COc1ccc([C@@H](C)NCc2ccc(N3CCCS3(=O)=O)c(F)c2)cc1 ZINC000480690867 896051876 /nfs/dbraw/zinc/05/18/76/896051876.db2.gz BDLVIXPYRHBFBH-QGZVFWFLSA-N 0 3 420.550 4.251 20 0 HIADHN CC(C)COc1ccc([C@H](C)NCc2ccc(N3CCCS3(=O)=O)c(F)c2)cc1 ZINC000480690864 896052365 /nfs/dbraw/zinc/05/23/65/896052365.db2.gz BDLVIXPYRHBFBH-KRWDZBQOSA-N 0 3 420.550 4.251 20 0 HIADHN CCOc1ccc(Cl)cc1[C@H](C)NCc1ccc(N2CCN(CC)CC2)nc1 ZINC000480694571 896056931 /nfs/dbraw/zinc/05/69/31/896056931.db2.gz HDXPOZXZKMZPKW-KRWDZBQOSA-N 0 3 402.970 4.126 20 0 HIADHN CCNC(=O)COc1ccc(CN[C@@H](C)c2cc(Cl)cc(Cl)c2)cc1OC ZINC000480702335 896063629 /nfs/dbraw/zinc/06/36/29/896063629.db2.gz WRXQZUVJTQJSPD-ZDUSSCGKSA-N 0 3 411.329 4.368 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)c1ccc(-c2n[nH]c(C3CC3)n2)cc1 ZINC000480704155 896067358 /nfs/dbraw/zinc/06/73/58/896067358.db2.gz CJFSCXLYUOBYDJ-GOSISDBHSA-N 0 3 415.541 4.086 20 0 HIADHN Fc1ccc([C@H](NCCc2ccc(OCC(F)(F)F)nc2)c2cccnc2)cc1 ZINC000480716604 896077831 /nfs/dbraw/zinc/07/78/31/896077831.db2.gz QYLHFCPSCWTFEP-FQEVSTJZSA-N 0 3 405.395 4.479 20 0 HIADHN Fc1ccc([C@@H](NCCc2ccc(OCC(F)(F)F)nc2)c2cccnc2)cc1 ZINC000480716609 896078175 /nfs/dbraw/zinc/07/81/75/896078175.db2.gz QYLHFCPSCWTFEP-HXUWFJFHSA-N 0 3 405.395 4.479 20 0 HIADHN CCN1CCN(c2ccc(CN[C@H](C)c3nc(-c4ccccc4)cs3)cn2)CC1 ZINC000480732653 896094324 /nfs/dbraw/zinc/09/43/24/896094324.db2.gz SWPCLHRBSDKMGX-GOSISDBHSA-N 0 3 407.587 4.198 20 0 HIADHN Cc1nc(-c2cc([C@@H](C)NCc3ccnc(N4CCN(C)CC4)c3)cs2)cs1 ZINC000480734351 896095297 /nfs/dbraw/zinc/09/52/97/896095297.db2.gz VVZVETHKCVWANP-OAHLLOKOSA-N 0 3 413.616 4.178 20 0 HIADHN CC[C@H](C)n1nc(NC(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)cc1C ZINC000480751363 896113490 /nfs/dbraw/zinc/11/34/90/896113490.db2.gz UHOKSZKOVASDSE-JXFKEZNVSA-N 0 3 401.555 4.374 20 0 HIADHN CCN(C[C@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)Cc1ccc(Cl)c(F)c1 ZINC000480752607 896116197 /nfs/dbraw/zinc/11/61/97/896116197.db2.gz AFMUUHNQZHCHBV-IBGZPJMESA-N 0 3 424.969 4.153 20 0 HIADHN CC[C@@H](N[C@@H](C)c1ccc(S(=O)(=O)N2CCOCC2)cc1)c1cccc(Cl)c1 ZINC000480767304 896129661 /nfs/dbraw/zinc/12/96/61/896129661.db2.gz DWZMIUHEHMYJOC-HRAATJIYSA-N 0 3 422.978 4.163 20 0 HIADHN CCOCc1ccc(CN[C@H](C)c2ccc(S(=O)(=O)N3CCCCC3)cc2)cc1 ZINC000480816598 896188441 /nfs/dbraw/zinc/18/84/41/896188441.db2.gz ISMLEIHGANFERM-LJQANCHMSA-N 0 3 416.587 4.249 20 0 HIADHN COc1cc(CN[C@@H]2CCSc3ccc(Br)cc32)ccc1OCCO ZINC000480879245 896235610 /nfs/dbraw/zinc/23/56/10/896235610.db2.gz KYAXDTZEVUHWOT-MRXNPFEDSA-N 0 3 424.360 4.156 20 0 HIADHN COc1cc(CN[C@H](C)c2sc(-c3ccc(F)cc3)nc2C)ccc1OCCO ZINC000480897095 896252449 /nfs/dbraw/zinc/25/24/49/896252449.db2.gz FAMSKPBXIGZCHC-CQSZACIVSA-N 0 3 416.518 4.488 20 0 HIADHN CC(C)COc1ccc([C@H](C)NCc2cccc(NC(=O)Cn3cccn3)c2)cc1 ZINC000480896047 896252575 /nfs/dbraw/zinc/25/25/75/896252575.db2.gz BACWEUPBVKGEFG-IBGZPJMESA-N 0 3 406.530 4.407 20 0 HIADHN O=S(=O)(CCCN[C@H]1CCc2ccc(OC(F)(F)F)cc21)Cc1ccccc1 ZINC000480899816 896255337 /nfs/dbraw/zinc/25/53/37/896255337.db2.gz PNYKEHCEQBNJJY-IBGZPJMESA-N 0 3 413.461 4.167 20 0 HIADHN CCc1ccc([C@@H](CC)NCc2cccc(NC(=O)CCN3CCOCC3)c2)cc1 ZINC000480905239 896261709 /nfs/dbraw/zinc/26/17/09/896261709.db2.gz HOXKSODZGXNHGR-XMMPIXPASA-N 0 3 409.574 4.151 20 0 HIADHN COc1cc(CN[C@H]2CCCc3nc(-c4ccccc4)sc32)ccc1OCCO ZINC000480913366 896271819 /nfs/dbraw/zinc/27/18/19/896271819.db2.gz XNLBWNUUJZPLII-SFHVURJKSA-N 0 3 410.539 4.357 20 0 HIADHN O=C(NCCN[C@H]1CCSc2c(F)cccc21)c1ccc(Br)cc1 ZINC000480915666 896273787 /nfs/dbraw/zinc/27/37/87/896273787.db2.gz ZXDGRVMVXSQRHR-INIZCTEOSA-N 0 3 409.324 4.145 20 0 HIADHN C[C@@H](NCc1cccc(COc2ccccc2)c1)c1cccc(NS(C)(=O)=O)c1 ZINC000480921224 896278129 /nfs/dbraw/zinc/27/81/29/896278129.db2.gz PGHBSMYKLLHKRK-GOSISDBHSA-N 0 3 410.539 4.488 20 0 HIADHN CNS(=O)(=O)c1cccc(CN[C@H](CCCc2ccccc2)c2ccccc2)c1 ZINC000481040745 896365085 /nfs/dbraw/zinc/36/50/85/896365085.db2.gz RHIHDLJEKGPOPQ-XMMPIXPASA-N 0 3 408.567 4.449 20 0 HIADHN CCS[C@@H]1CCCCN(CC(=O)N2CCC[C@@H]2c2ccc3c(c2)OCCCO3)C1 ZINC000481078268 896397122 /nfs/dbraw/zinc/39/71/22/896397122.db2.gz QWIRCSBYUBPQQA-WOJBJXKFSA-N 0 3 418.603 4.119 20 0 HIADHN C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1NCc1nc2c3ccccc3oc2c(=O)[n-]1 ZINC000481189563 896538400 /nfs/dbraw/zinc/53/84/00/896538400.db2.gz KHFHDSNLVWYUDL-VQIMIIECSA-N 0 3 402.498 4.082 20 0 HIADHN C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1NCc1nc2c3ccccc3oc2c(=O)[n-]1 ZINC000481189563 896538414 /nfs/dbraw/zinc/53/84/14/896538414.db2.gz KHFHDSNLVWYUDL-VQIMIIECSA-N 0 3 402.498 4.082 20 0 HIADHN C[C@@H](NC[C@H](c1cccc(F)c1)N1CCOCC1)c1ccc(F)cc1OC(F)F ZINC000481231813 896581758 /nfs/dbraw/zinc/58/17/58/896581758.db2.gz IJYPKJXRAFWZAX-AUUYWEPGSA-N 0 3 412.427 4.290 20 0 HIADHN Cc1nc(Cc2ccccc2)sc1[C@H](C)NCc1cccnc1N1CCN(C)CC1 ZINC000481237077 896587326 /nfs/dbraw/zinc/58/73/26/896587326.db2.gz QHYPQLJUBWKMNZ-SFHVURJKSA-N 0 3 421.614 4.040 20 0 HIADHN CN1CCN(c2ncccc2CN[C@@H]2CCCSc3ccc(Cl)cc32)CC1 ZINC000481241230 896591838 /nfs/dbraw/zinc/59/18/38/896591838.db2.gz JXHHMAAPXWVGFF-LJQANCHMSA-N 0 3 402.995 4.204 20 0 HIADHN O=S(=O)(CCCN[C@H]1CCCOc2ccc(Br)cc21)c1ccccc1 ZINC000481240638 896591992 /nfs/dbraw/zinc/59/19/92/896591992.db2.gz IHEKQMCRBJRANJ-SFHVURJKSA-N 0 3 424.360 4.116 20 0 HIADHN CN1CCN(c2ncccc2CN[C@H](Cc2cccc(F)c2)c2cccc(F)c2)CC1 ZINC000481246989 896598441 /nfs/dbraw/zinc/59/84/41/896598441.db2.gz PHAMNCIQFXYQKE-XMMPIXPASA-N 0 3 422.523 4.185 20 0 HIADHN COc1ccc([C@@H](CNC(=O)Nc2ccc(OCC(F)F)cc2)N2CCCC2)cc1 ZINC000481251973 896602419 /nfs/dbraw/zinc/60/24/19/896602419.db2.gz MUZAGXIJGNVEMK-HXUWFJFHSA-N 0 3 419.472 4.298 20 0 HIADHN Cc1cc(C)n(-c2ccc(CN[C@H](C)c3ccc(NC(=O)NC4CC4)cc3)cn2)n1 ZINC000481306852 896652306 /nfs/dbraw/zinc/65/23/06/896652306.db2.gz NUEJJRFWTUMIMQ-QGZVFWFLSA-N 0 3 404.518 4.019 20 0 HIADHN C[C@H](N[C@@H]1CCSc2ccc(F)cc21)c1ccc(OCC(=O)NC2CC2)cc1 ZINC000481316550 896666752 /nfs/dbraw/zinc/66/67/52/896666752.db2.gz ANYMUPAEWSMTSB-VBKZILBWSA-N 0 3 400.519 4.371 20 0 HIADHN COc1ccc([C@@H](NC(=O)N[C@H](CN(C)C)c2ccc(F)cc2)C(F)(F)F)cc1 ZINC000481331103 896690551 /nfs/dbraw/zinc/69/05/51/896690551.db2.gz OJQYIXBZOBZFIC-QZTJIDSGSA-N 0 3 413.415 4.040 20 0 HIADHN Cc1nc(NC(=O)NC[C@H](c2cccs2)N2CCCC2)ccc1Br ZINC000481370319 896759660 /nfs/dbraw/zinc/75/96/60/896759660.db2.gz IMQOULASPDXFSV-CQSZACIVSA-N 0 3 409.353 4.173 20 0 HIADHN Cc1cc(C)c2c(c1)[C@@H](NCc1cccc(OCCN3CCOCC3)c1)CCCO2 ZINC000481409201 896815211 /nfs/dbraw/zinc/81/52/11/896815211.db2.gz AQZFVCHZALNKIU-DEOSSOPVSA-N 0 3 410.558 4.018 20 0 HIADHN CN(C)C[C@H](NC(=O)Nc1cnn(-c2ccc(Cl)cc2)c1)c1ccc(F)cc1 ZINC000481440829 896839678 /nfs/dbraw/zinc/83/96/78/896839678.db2.gz LJQKJVNAGAETQH-IBGZPJMESA-N 0 3 401.873 4.089 20 0 HIADHN CC(C)NC(=O)Nc1ccc([C@H](C)NCc2cccc(NC(=O)[C@H]3CCCO3)c2)cc1 ZINC000481535038 896895780 /nfs/dbraw/zinc/89/57/80/896895780.db2.gz PGVRMEKSFYWMOY-HTAPYJJXSA-N 0 3 424.545 4.185 20 0 HIADHN CCOc1ccc(CN[C@@H](C)c2ccc(S(=O)(=O)NCc3ccco3)cc2)cc1 ZINC000481561183 896937700 /nfs/dbraw/zinc/93/77/00/896937700.db2.gz YAHABKGZANISPK-KRWDZBQOSA-N 0 3 414.527 4.008 20 0 HIADHN Cc1ccc(NC(=O)C[C@H](C)N[C@@H](CC(=O)N(C)C)c2ccccc2)c(Cl)c1 ZINC000481569315 896948224 /nfs/dbraw/zinc/94/82/24/896948224.db2.gz VVQHCWMKDCTLFK-JXFKEZNVSA-N 0 3 401.938 4.175 20 0 HIADHN Cc1cc(C)n(-c2ccc(CN[C@H]3CCCc4c3cnn4C)c(C(F)(F)F)c2)n1 ZINC000481579809 896958822 /nfs/dbraw/zinc/95/88/22/896958822.db2.gz WSTZSVSKAYKXDB-IBGZPJMESA-N 0 3 403.452 4.409 20 0 HIADHN C[C@H](NCc1cc2c(c(Br)c1)OCO2)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000481579449 896958936 /nfs/dbraw/zinc/95/89/36/896958936.db2.gz WAOQWUDVEGNWRM-NSHDSACASA-N 0 3 417.303 4.258 20 0 HIADHN C[C@@H](NC[C@H](O)COc1ccc(C(F)(F)F)cc1)c1ccccc1OC(F)F ZINC000481580364 896961065 /nfs/dbraw/zinc/96/10/65/896961065.db2.gz XWBXCVYMDJMHDU-OCCSQVGLSA-N 0 3 405.363 4.397 20 0 HIADHN OC1(Cc2ccc(F)cc2)CCN(CCOc2cccc(Br)c2)CC1 ZINC000481624829 897009791 /nfs/dbraw/zinc/00/97/91/897009791.db2.gz ONTRSFWZWMERCL-UHFFFAOYSA-N 0 3 408.311 4.037 20 0 HIADHN COc1cccc([C@H]2C[C@H]2C(=O)Nc2cc(C)cc(N3CCN(C(C)C)CC3)c2)c1 ZINC000481644617 897029951 /nfs/dbraw/zinc/02/99/51/897029951.db2.gz MEQGGPCEHUVUOH-DNQXCXABSA-N 0 3 407.558 4.276 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)CCCC(=O)c3ccc(C)cc3)cc2)CC1 ZINC000481643816 897030057 /nfs/dbraw/zinc/03/00/57/897030057.db2.gz WHEPTBBWUWGXCD-UHFFFAOYSA-N 0 3 407.558 4.124 20 0 HIADHN CC(C)NS(=O)(=O)Cc1ccccc1CN[C@@H]1CCC(C)(C)c2ccccc21 ZINC000481660864 897044961 /nfs/dbraw/zinc/04/49/61/897044961.db2.gz KTBKTISPBOFOBF-JOCHJYFZSA-N 0 3 400.588 4.417 20 0 HIADHN CC[C@@H](NCCOc1ccccc1Cl)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000481669088 897053020 /nfs/dbraw/zinc/05/30/20/897053020.db2.gz MNLFXNMKDDCGGJ-MRXNPFEDSA-N 0 3 417.358 4.021 20 0 HIADHN C[C@@H](N[C@@H]1CCCc2cc(OC(F)F)ccc21)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000481736348 897131528 /nfs/dbraw/zinc/13/15/28/897131528.db2.gz NLBLFCUTYBZVCW-JLTOFOAXSA-N 0 3 424.513 4.267 20 0 HIADHN CC(C)C[C@@H]1OCCC[C@@H]1NCC(=O)Nc1ccc(NC(=O)c2cccs2)cc1 ZINC000481738615 897133302 /nfs/dbraw/zinc/13/33/02/897133302.db2.gz FBXDFUCFEAJFEU-OALUTQOASA-N 0 3 415.559 4.122 20 0 HIADHN OC[C@H](CNCc1c(Cl)cccc1OCc1ccccc1Cl)[C@@H]1CCOC1 ZINC000481815889 897189055 /nfs/dbraw/zinc/18/90/55/897189055.db2.gz PWDIZMFUWSRMIS-WBVHZDCISA-N 0 3 410.341 4.307 20 0 HIADHN CCCCCNC(=O)C1CCN(Cc2ccc(-c3ccccc3C(=O)OC)o2)CC1 ZINC000481919536 897305050 /nfs/dbraw/zinc/30/50/50/897305050.db2.gz SWNFHSODJVZSPH-UHFFFAOYSA-N 0 3 412.530 4.252 20 0 HIADHN COc1cc(F)c([C@H](C)N[C@@H]2CCN(c3cc(Cl)ccc3OC)C2)cc1OC ZINC000481933755 897318002 /nfs/dbraw/zinc/31/80/02/897318002.db2.gz IJNUKQRVPCEBBJ-DZGCQCFKSA-N 0 3 408.901 4.434 20 0 HIADHN CC[C@@H](NCc1ccc2ncccc2c1)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000481987586 897382092 /nfs/dbraw/zinc/38/20/92/897382092.db2.gz CNFGWEINWCRLEV-GOSISDBHSA-N 0 3 403.935 4.037 20 0 HIADHN CCO[C@H](CN[C@H](CC)c1ccc(Cl)c(S(=O)(=O)NC)c1)c1ccccc1 ZINC000481989361 897384437 /nfs/dbraw/zinc/38/44/37/897384437.db2.gz ALDMFVIRVJOISO-RTBURBONSA-N 0 3 410.967 4.067 20 0 HIADHN C[C@@H]1CCC[C@H](CN[C@@H]2CCS(=O)(=O)c3ccc(Br)cc32)[C@@H]1C ZINC000481994213 897389617 /nfs/dbraw/zinc/38/96/17/897389617.db2.gz WEDGUTIRPNOGSD-VMUDFCTBSA-N 0 3 400.382 4.330 20 0 HIADHN CCc1c(C(=O)Nc2cc(C)cc(N3CCN(C(C)C)CC3)c2)cnn1CC(C)C ZINC000482014088 897414477 /nfs/dbraw/zinc/41/44/77/897414477.db2.gz IMUSRVAYUVHFCG-UHFFFAOYSA-N 0 3 411.594 4.193 20 0 HIADHN Cc1cc(NC(=O)c2cn(C)nc2-c2cccs2)cc(N2CCN(C(C)C)CC2)c1 ZINC000482020389 897424306 /nfs/dbraw/zinc/42/43/06/897424306.db2.gz ZPOPWDZVHAPJOT-UHFFFAOYSA-N 0 3 423.586 4.240 20 0 HIADHN Cc1cc(NC(=O)[C@H](C)n2cnc3ccccc32)cc(N2CCN(C(C)C)CC2)c1 ZINC000482027057 897434076 /nfs/dbraw/zinc/43/40/76/897434076.db2.gz QXVUXRVSENPMGU-IBGZPJMESA-N 0 3 405.546 4.075 20 0 HIADHN COC(=O)c1ccc(-c2ccc(CNCc3ccccc3-c3cnn(C)c3)o2)cc1 ZINC000482031345 897441682 /nfs/dbraw/zinc/44/16/82/897441682.db2.gz MQAZPRXRQFJUFT-UHFFFAOYSA-N 0 3 401.466 4.424 20 0 HIADHN CC1(C)CN(C(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)CC[C@H]1C(F)(F)F ZINC000482034630 897448535 /nfs/dbraw/zinc/44/85/35/897448535.db2.gz QZDRIMGZYBZUMZ-SJLPKXTDSA-N 0 3 400.460 4.475 20 0 HIADHN Cc1nn(C(C)(C)C)cc1[C@@H](C)NCCC(=O)Nc1ccc(Br)cc1 ZINC000482045499 897467176 /nfs/dbraw/zinc/46/71/76/897467176.db2.gz RRECVYOIUSLPQO-CYBMUJFWSA-N 0 3 407.356 4.388 20 0 HIADHN Cc1nn(Cc2ccc(C)cc2)c(C)c1CCC(=O)N1CCN(C2CCCCC2)CC1 ZINC000482065148 897498370 /nfs/dbraw/zinc/49/83/70/897498370.db2.gz YHUPCFRNWZXKGK-UHFFFAOYSA-N 0 3 422.617 4.266 20 0 HIADHN C[C@H](N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)c1ccc(OC(F)(F)F)cc1 ZINC000482108280 897556764 /nfs/dbraw/zinc/55/67/64/897556764.db2.gz HNOXEKPOISLURN-JXFKEZNVSA-N 0 3 406.448 4.470 20 0 HIADHN COC(=O)c1ccccc1-c1ccc(CN[C@H]2CCN(C(=O)C3CCCCC3)C2)o1 ZINC000482209951 897690242 /nfs/dbraw/zinc/69/02/42/897690242.db2.gz MNGMSDYXIOSVPW-SFHVURJKSA-N 0 3 410.514 4.004 20 0 HIADHN CCC[C@@H](N[C@H](CC)c1ccc2c(c1)OCCO2)C(=O)N1CCc2sccc2C1 ZINC000482241259 897722381 /nfs/dbraw/zinc/72/23/81/897722381.db2.gz IFDACBIDTFPWEK-RTBURBONSA-N 0 3 414.571 4.314 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)Nc1cnn(C)c1C(F)(F)F)c1ccc(Cl)cc1 ZINC000482286632 897781167 /nfs/dbraw/zinc/78/11/67/897781167.db2.gz MKWHBNXJIANODZ-HNNXBMFYSA-N 0 3 417.863 4.297 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)N[C@H](c1ccc(Cl)cc1)C(F)(F)F ZINC000482331523 897835463 /nfs/dbraw/zinc/83/54/63/897835463.db2.gz NVZKIZDUKZFQRJ-MRXNPFEDSA-N 0 3 403.832 4.310 20 0 HIADHN COc1ccc([C@H](NC(=O)NCCCN2CCc3ccccc3C2)C(F)(F)F)cc1 ZINC000482369766 897889802 /nfs/dbraw/zinc/88/98/02/897889802.db2.gz ZNTSBTJJNBBGQU-FQEVSTJZSA-N 0 3 421.463 4.046 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)N[C@@H](c1c(F)cccc1F)C(F)(F)F ZINC000482372085 897894735 /nfs/dbraw/zinc/89/47/35/897894735.db2.gz MFXMDRLULQBVOZ-SFHVURJKSA-N 0 3 415.406 4.342 20 0 HIADHN Cc1c(C(=O)NCCCN2CCc3ccccc3C2)cnn1-c1ccccc1Cl ZINC000482396747 897933091 /nfs/dbraw/zinc/93/30/91/897933091.db2.gz RZGMDKHCCIZHJN-UHFFFAOYSA-N 0 3 408.933 4.012 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)CCCc2nc3ccccc3s2)c1 ZINC000482397633 897934508 /nfs/dbraw/zinc/93/45/08/897934508.db2.gz MOWOTYAEKPMGCS-UHFFFAOYSA-N 0 3 411.571 4.218 20 0 HIADHN CN(C)CCN(C[C@@H]1CCCO1)C(=O)N[C@@H](c1cccc2ccccc21)C(F)(F)F ZINC000482401971 897941290 /nfs/dbraw/zinc/94/12/90/897941290.db2.gz GMNMPMFTORZVTN-PXNSSMCTSA-N 0 3 423.479 4.195 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)N[C@@H](c3ccccc3C(F)(F)F)C(F)(F)F)[C@H]2C1 ZINC000482404070 897945039 /nfs/dbraw/zinc/94/50/39/897945039.db2.gz MIDSBWPNGARCNK-UGFHNGPFSA-N 0 3 409.374 4.044 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)c2cc(OC)c(C(C)C)c(OC)c2)c1 ZINC000482409555 897953320 /nfs/dbraw/zinc/95/33/20/897953320.db2.gz RJULZGMTYQKGTH-UHFFFAOYSA-N 0 3 414.546 4.040 20 0 HIADHN Cc1cc(C)n(-c2ccc(C(=O)N[C@@H]3CCN([C@@H](C)c4ccccc4)C3)cc2F)n1 ZINC000482476460 898054208 /nfs/dbraw/zinc/05/42/08/898054208.db2.gz INFMTTNPCDTMFB-GHTZIAJQSA-N 0 3 406.505 4.194 20 0 HIADHN CCO[C@@H]1C[C@H](NCc2cc(OC)c(OC)cc2SC)[C@@H]1Oc1ccccc1 ZINC000482513182 898098913 /nfs/dbraw/zinc/09/89/13/898098913.db2.gz RZQOSVZPXWAFFZ-WEYGHZABSA-N 0 3 403.544 4.140 20 0 HIADHN COc1ccc([C@H](C)N[C@@H](C)c2cc(F)ccc2N2CCN(C)CC2)c(OC)c1 ZINC000482551205 898141753 /nfs/dbraw/zinc/14/17/53/898141753.db2.gz QOSCVKHTIMUYMC-IRXDYDNUSA-N 0 3 401.526 4.007 20 0 HIADHN Cc1c([C@H](C)NC[C@H](O)COc2ccc(F)c(F)c2)cnn1-c1cccc(Cl)c1 ZINC000482568628 898163981 /nfs/dbraw/zinc/16/39/81/898163981.db2.gz HXOQDVHHMYJZSS-GUYCJALGSA-N 0 3 421.875 4.203 20 0 HIADHN CCCCCn1nc(C(=O)Nc2cc(CN(C)C)ccc2C)c2ccccc2c1=O ZINC000482588128 898186027 /nfs/dbraw/zinc/18/60/27/898186027.db2.gz PCWQVWQMHZGHDC-UHFFFAOYSA-N 0 3 406.530 4.209 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)[C@H]1CCCN(C(=O)Nc2ccccc2F)C1 ZINC000482602513 898204155 /nfs/dbraw/zinc/20/41/55/898204155.db2.gz AZLXHUIDHQWLPU-SFHVURJKSA-N 0 3 412.509 4.078 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)C[C@H](c3cccs3)n3cccc3)c2)CC1 ZINC000505537427 914232405 /nfs/dbraw/zinc/23/24/05/914232405.db2.gz AAHTXNIYLLDJPQ-OAQYLSRUSA-N 0 3 408.571 4.310 20 0 HIADHN CCn1c(SCC(=O)Nc2cc(CN(C)C)ccc2C)nnc1-c1ccccc1C ZINC000482626001 898229771 /nfs/dbraw/zinc/22/97/71/898229771.db2.gz DYXDNBYOMZVNFX-UHFFFAOYSA-N 0 3 423.586 4.374 20 0 HIADHN Cc1noc(C)c1CCN[C@@H](C)c1cccc(S(=O)(=O)NC2CCCCCC2)c1 ZINC000482651929 898254820 /nfs/dbraw/zinc/25/48/20/898254820.db2.gz PFCNXYCEECTLBB-INIZCTEOSA-N 0 3 419.591 4.186 20 0 HIADHN CN1C(=O)C[C@@H](NCc2ccc(OCc3ccccn3)cc2)[C@@H]1c1ccc(F)c(F)c1 ZINC000482688314 898287622 /nfs/dbraw/zinc/28/76/22/898287622.db2.gz CPWKYSHBKVJWOY-VWNXMTODSA-N 0 3 423.463 4.000 20 0 HIADHN CC(C)c1nn(-c2ccc(Br)cc2)cc1CNCCNC(=O)C(C)(C)C ZINC000482759815 898366414 /nfs/dbraw/zinc/36/64/14/898366414.db2.gz KCRCXZACGZFISI-UHFFFAOYSA-N 0 3 421.383 4.010 20 0 HIADHN Clc1ccc(C2(NCc3ccc(Cl)cc3-n3cncn3)CCOCC2)cc1 ZINC000482800813 898410830 /nfs/dbraw/zinc/41/08/30/898410830.db2.gz URMAXQPVOPWEBY-UHFFFAOYSA-N 0 3 403.313 4.370 20 0 HIADHN CCCOc1cn(-c2ccccc2)nc1C(=O)N1C[C@@H]2CCCN2Cc2ccccc21 ZINC000482835237 898443763 /nfs/dbraw/zinc/44/37/63/898443763.db2.gz AXHJVCDRVLAKQO-NRFANRHFSA-N 0 3 416.525 4.286 20 0 HIADHN C[C@H]1CN(CCCCNC(=O)c2sc(C3CC3)nc2-c2ccccc2)C[C@H](C)O1 ZINC000482835915 898445820 /nfs/dbraw/zinc/44/58/20/898445820.db2.gz LNWOHUULMLYELZ-IRXDYDNUSA-N 0 3 413.587 4.307 20 0 HIADHN COc1ccc(-c2nc(C)c([C@H](C)N[C@H](Cc3ccccc3)C(=O)N(C)C)s2)cc1 ZINC000482864789 898475478 /nfs/dbraw/zinc/47/54/78/898475478.db2.gz IVUAZIDTNWWMHC-HRAATJIYSA-N 0 3 423.582 4.477 20 0 HIADHN Cc1ccc(NC(=O)N2CCN(C3CCCCC3)CC2)c(OC[C@H]2CCCO2)c1 ZINC000482917495 898535033 /nfs/dbraw/zinc/53/50/33/898535033.db2.gz JAPDXUZLVWYAQW-HXUWFJFHSA-N 0 3 401.551 4.035 20 0 HIADHN C[C@@H](NCc1ccccc1CN1C(=O)NC2(CCCCC2)C1=O)c1ccc(F)cc1 ZINC000482970797 898604245 /nfs/dbraw/zinc/60/42/45/898604245.db2.gz LNOGIEAAGMJQBU-QGZVFWFLSA-N 0 3 409.505 4.431 20 0 HIADHN CC(C)CNC(=O)c1ccc(NC(=O)N2CCN(C3CCCCC3)CC2)cc1Cl ZINC000482977176 898612428 /nfs/dbraw/zinc/61/24/28/898612428.db2.gz IYPHEDAWTLTALC-UHFFFAOYSA-N 0 3 420.985 4.208 20 0 HIADHN CO[C@]1(C)CCCN(CC(=O)N[C@H](c2ccccc2)c2cccc(Cl)c2)CC1 ZINC000482996323 898640667 /nfs/dbraw/zinc/64/06/67/898640667.db2.gz FFCXPCUCXLDOQB-DHIUTWEWSA-N 0 3 400.950 4.437 20 0 HIADHN CC(C)C[C@@](C)(N[C@@H]1CCN(C2CCOCC2)C1=O)c1cccc(Br)c1 ZINC000483060197 898736343 /nfs/dbraw/zinc/73/63/43/898736343.db2.gz VMAFCRUWSPJTKJ-TZIWHRDSSA-N 0 3 423.395 4.080 20 0 HIADHN C[C@@H](NCc1cccc(-n2ccnc2)c1)c1ccc(S(=O)(=O)C2CCCC2)cc1 ZINC000483121926 898808618 /nfs/dbraw/zinc/80/86/18/898808618.db2.gz BIKTXMSOSWGUEU-GOSISDBHSA-N 0 3 409.555 4.439 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)N[C@H](C)c2ccccc2C(F)(F)F)cc1 ZINC000483142634 898821685 /nfs/dbraw/zinc/82/16/85/898821685.db2.gz XILMSDNERQLXIS-AUUYWEPGSA-N 0 3 409.452 4.377 20 0 HIADHN C[C@H](NCc1ccc(F)c(CN(C)C)c1)c1ccccc1I ZINC000483145613 898823479 /nfs/dbraw/zinc/82/34/79/898823479.db2.gz QFOCPCHFWJOTTD-ZDUSSCGKSA-N 0 3 412.290 4.343 20 0 HIADHN COc1ccc(S(=O)(=O)Nc2cccc(CN[C@H](C)c3cccc(F)c3)c2)cc1 ZINC000483146661 898824692 /nfs/dbraw/zinc/82/46/92/898824692.db2.gz YDKGERBPWUNCRJ-MRXNPFEDSA-N 0 3 414.502 4.486 20 0 HIADHN C[C@@H](N[C@@H](C)CN1CCN(c2ccccn2)CC1)c1nc(-c2ccccc2)cs1 ZINC000483160105 898831231 /nfs/dbraw/zinc/83/12/31/898831231.db2.gz PZOSXLVKVNCZNY-RBUKOAKNSA-N 0 3 407.587 4.066 20 0 HIADHN C[C@@H](NC(=O)Cc1c[nH]c2cccc(Br)c12)[C@H](c1ccccc1)N(C)C ZINC000505582946 914288698 /nfs/dbraw/zinc/28/86/98/914288698.db2.gz XIUDWMCMOHQPBE-SPLOXXLWSA-N 0 3 414.347 4.281 20 0 HIADHN Brc1ccc2c(c1)[C@@H](NCc1cccc(-n3cncn3)c1)CCS2 ZINC000483174994 898841522 /nfs/dbraw/zinc/84/15/22/898841522.db2.gz SPQCVTIWCBESJH-KRWDZBQOSA-N 0 3 401.333 4.357 20 0 HIADHN CC1(C)CN(CCC(=O)Nc2ccccc2Oc2ccccc2)C[C@]2(CCOC2)O1 ZINC000483205282 898858595 /nfs/dbraw/zinc/85/85/95/898858595.db2.gz YOGFAZDADFCMEY-DEOSSOPVSA-N 0 3 410.514 4.077 20 0 HIADHN CC(C)N(C)c1ccc(CN2CCC(C(=O)Nc3cc(Cl)ccc3O)CC2)cn1 ZINC000483246819 898889899 /nfs/dbraw/zinc/88/98/99/898889899.db2.gz LSLHQNBBHAHJJD-UHFFFAOYSA-N 0 3 416.953 4.136 20 0 HIADHN C[C@H](NC(=O)NCc1ccccc1OCC(F)(F)F)[C@H](c1ccccc1)N(C)C ZINC000483276573 898915522 /nfs/dbraw/zinc/91/55/22/898915522.db2.gz NZEUHMFYMLNBDQ-HNAYVOBHSA-N 0 3 409.452 4.118 20 0 HIADHN C[C@@H](NC(=O)c1cccc(-c2noc(C(F)(F)F)n2)c1)[C@@H](c1ccccc1)N(C)C ZINC000505590130 914297437 /nfs/dbraw/zinc/29/74/37/914297437.db2.gz DXKHAQVNDOKJRM-DYVFJYSZSA-N 0 3 418.419 4.177 20 0 HIADHN C[C@H](NC(=O)c1ccc(-c2noc(C(F)F)n2)cc1)[C@@H](c1ccccc1)N(C)C ZINC000505591234 914297778 /nfs/dbraw/zinc/29/77/78/914297778.db2.gz MAPSVULZQCMUJJ-GUYCJALGSA-N 0 3 400.429 4.095 20 0 HIADHN COc1ccc(CNC(=O)Nc2ccc(CCN3CCSCC3)cc2)cc1Cl ZINC000483339793 898970530 /nfs/dbraw/zinc/97/05/30/898970530.db2.gz QDLJQYUHKWFKIS-UHFFFAOYSA-N 0 3 419.978 4.262 20 0 HIADHN Cc1ccc(NC(=O)C(C)(C)C)cc1NC(=O)N1CCN(C2CCCCC2)CC1 ZINC000483356336 898993459 /nfs/dbraw/zinc/99/34/59/898993459.db2.gz LPNCDHAKEWZJEQ-UHFFFAOYSA-N 0 3 400.567 4.462 20 0 HIADHN C[C@H](NC(=O)C1(c2ccccc2Br)CC1)[C@H](c1ccccc1)N(C)C ZINC000505597206 914303540 /nfs/dbraw/zinc/30/35/40/914303540.db2.gz QTZOTKHHXCLTOX-HNAYVOBHSA-N 0 3 401.348 4.288 20 0 HIADHN COc1ccc(-c2cc(C(=O)N3C[C@H](SC)[C@@H](N4CCCC4)C3)sc2C)cc1 ZINC000483390736 899024955 /nfs/dbraw/zinc/02/49/55/899024955.db2.gz CUYZRNKLNGKTCL-FPOVZHCZSA-N 0 3 416.612 4.384 20 0 HIADHN CS[C@@H]1CN(C(=O)c2sc(-c3ccc(C)cc3C)nc2C)C[C@@H]1N1CCCC1 ZINC000483391139 899025909 /nfs/dbraw/zinc/02/59/09/899025909.db2.gz DNTWGYSHLJOBMC-RBUKOAKNSA-N 0 3 415.628 4.387 20 0 HIADHN CC(C)n1ncc2c1nc(C1CC1)cc2C(=O)N[C@H](C)[C@H](c1ccccc1)N(C)C ZINC000505601211 914307048 /nfs/dbraw/zinc/30/70/48/914307048.db2.gz CSQLAMZMTHADRL-OPAMFIHVSA-N 0 3 405.546 4.311 20 0 HIADHN CS[C@H]1CN(C(=O)c2sc(C3CC3)nc2-c2ccccc2)C[C@H]1N1CCCC1 ZINC000483399536 899031848 /nfs/dbraw/zinc/03/18/48/899031848.db2.gz CHYZMWGJVHYLBT-MSOLQXFVSA-N 0 3 413.612 4.339 20 0 HIADHN CCS[C@H]1CCC[C@@H](NC(=O)Nc2ccc(N3CCN(CC)CC3)cc2C)C1 ZINC000483435963 899068291 /nfs/dbraw/zinc/06/82/91/899068291.db2.gz BWUCYWYPQCMCAD-QUCCMNQESA-N 0 3 404.624 4.323 20 0 HIADHN O=C1CCCN1[C@H]1CCN(Cc2ccc(-c3ccc(Br)cc3)s2)C1 ZINC000483440799 899075586 /nfs/dbraw/zinc/07/55/86/899075586.db2.gz RGSDTQKGEVZMKD-INIZCTEOSA-N 0 3 405.361 4.374 20 0 HIADHN C[C@H](NC(=O)C1CCC(NC(=O)CC2CCCC2)CC1)[C@@H](c1ccccc1)N(C)C ZINC000505610005 914314433 /nfs/dbraw/zinc/31/44/33/914314433.db2.gz LSRDSGCLUBDOBL-XKYBLWFHSA-N 0 3 413.606 4.049 20 0 HIADHN C[C@H](NC(=O)CSCc1cc(-c2cccs2)on1)[C@H](c1ccccc1)N(C)C ZINC000505611890 914315458 /nfs/dbraw/zinc/31/54/58/914315458.db2.gz OYKMOUQTFDKEML-YCRPNKLZSA-N 0 3 415.584 4.444 20 0 HIADHN C[C@H](NC(=O)[C@@H]1CCO[C@H]1c1ccc(Cl)c(F)c1)[C@@H](c1ccccc1)N(C)C ZINC000505615251 914318303 /nfs/dbraw/zinc/31/83/03/914318303.db2.gz VTSAEYWXTRCVST-ITNCUTESSA-N 0 3 404.913 4.364 20 0 HIADHN COc1ccc(-c2cnc(CCC(=O)N[C@@H](C)[C@H](c3ccccc3)N(C)C)o2)cc1 ZINC000505615864 914319388 /nfs/dbraw/zinc/31/93/88/914319388.db2.gz YZKLSJXMKNMFLG-BXKMTCNYSA-N 0 3 407.514 4.090 20 0 HIADHN CC(C)C(=O)Nc1ccc(Cl)c(C(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)c1 ZINC000505633734 914332459 /nfs/dbraw/zinc/33/24/59/914332459.db2.gz LONZHJQOVDPHHC-MGPUTAFESA-N 0 3 401.938 4.356 20 0 HIADHN CCN1CCN(c2ccccc2CN[C@H](C)c2nc(-c3ccc(C)c(F)c3)no2)CC1 ZINC000483647624 899304607 /nfs/dbraw/zinc/30/46/07/899304607.db2.gz UCUXYAIOKQSPHI-GOSISDBHSA-N 0 3 423.536 4.177 20 0 HIADHN Cc1ccc(OCc2cccc(C(=O)N[C@@H](C)[C@H](c3ccccc3)N(C)C)c2)cn1 ZINC000505634803 914334721 /nfs/dbraw/zinc/33/47/21/914334721.db2.gz MNGHGLMLWVDQED-YADARESESA-N 0 3 403.526 4.390 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)c2sc(C(=O)N(CCN(C)C)C3CC3)cc12 ZINC000505637095 914338477 /nfs/dbraw/zinc/33/84/77/914338477.db2.gz QOSCFXVOLZMFNP-UHFFFAOYSA-N 0 3 402.951 4.215 20 0 HIADHN CO[C@@H]1CCCC[C@@H]1NCC(=O)N1N=C(c2ccc(Cl)cc2)C[C@@H]1c1ccco1 ZINC000483718078 899376724 /nfs/dbraw/zinc/37/67/24/899376724.db2.gz CVFUNBLFFGKWOS-DFQSSKMNSA-N 0 3 415.921 4.158 20 0 HIADHN CO[C@@H]1CCCC[C@H]1NCC(=O)N1N=C(c2ccc(Cl)cc2)C[C@H]1c1ccco1 ZINC000483718081 899377172 /nfs/dbraw/zinc/37/71/72/899377172.db2.gz CVFUNBLFFGKWOS-YZGWKJHDSA-N 0 3 415.921 4.158 20 0 HIADHN C[C@@H](N[C@H]1CCCN(c2ccccc2Cl)C1=O)c1cccc(N2CCOCC2)c1 ZINC000483735073 899396559 /nfs/dbraw/zinc/39/65/59/899396559.db2.gz XGRSFCJHIPTJSO-UTKZUKDTSA-N 0 3 413.949 4.023 20 0 HIADHN CNC(=O)[C@H](Cc1c[nH]c2ccccc12)N[C@@H](C)c1ccc(OCC(F)(F)F)cc1 ZINC000483748016 899411607 /nfs/dbraw/zinc/41/16/07/899411607.db2.gz QDGGBHQRZOLIIA-XOBRGWDASA-N 0 3 419.447 4.117 20 0 HIADHN Cc1cc(C(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)nc(-c2ccc(Cl)cc2)n1 ZINC000505644404 914345200 /nfs/dbraw/zinc/34/52/00/914345200.db2.gz ATWOVSBRXYWNJC-OAQYLSRUSA-N 0 3 420.944 4.452 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)Nc2cc3c(cc2Cl)OCCO3)C1 ZINC000483755506 899416778 /nfs/dbraw/zinc/41/67/78/899416778.db2.gz KDZVPHBSTIYVIQ-GDBMZVCRSA-N 0 3 401.894 4.068 20 0 HIADHN O=C(Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)c1cnc2c(F)cccc2c1 ZINC000483796894 899469550 /nfs/dbraw/zinc/46/95/50/899469550.db2.gz GXAWCDABZJVRTM-FQEVSTJZSA-N 0 3 415.472 4.270 20 0 HIADHN Cc1ccc(NC(=O)N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)cc1-c1ncco1 ZINC000483801472 899475699 /nfs/dbraw/zinc/47/56/99/899475699.db2.gz QUKQRTGXLZRHAO-HDICACEKSA-N 0 3 412.534 4.003 20 0 HIADHN C[C@H](NCCc1nc(C(F)(F)F)cs1)c1ccc(-n2cncn2)cc1Cl ZINC000483867903 899549464 /nfs/dbraw/zinc/54/94/64/899549464.db2.gz LVOCEPRLNDCITN-JTQLQIEISA-N 0 3 401.845 4.289 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N[C@H](c1cc(F)ccc1F)C(F)F)c1ccco1 ZINC000483877992 899555625 /nfs/dbraw/zinc/55/56/25/899555625.db2.gz UHPYIGMRWJXNBW-UXEPBGEESA-N 0 3 401.404 4.293 20 0 HIADHN Cc1cc(NC(=O)c2ccn(C)c2C2CCC2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000484154145 899775300 /nfs/dbraw/zinc/77/53/00/899775300.db2.gz CRPRVULFCHQQFO-OAQYLSRUSA-N 0 3 417.557 4.497 20 0 HIADHN C[C@@H](NCCCOC[C@H]1CCOC1)c1ccc(Br)cc1Br ZINC000484163732 899783746 /nfs/dbraw/zinc/78/37/46/899783746.db2.gz MBPHPYKGUXTCOG-CHWSQXEVSA-N 0 3 421.173 4.305 20 0 HIADHN C[C@H](NCCCOC[C@H]1CCOC1)c1ccc(Br)cc1Br ZINC000484163744 899784083 /nfs/dbraw/zinc/78/40/83/899784083.db2.gz MBPHPYKGUXTCOG-QWHCGFSZSA-N 0 3 421.173 4.305 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N[C@H](C)Cc1ccc(Cl)cc1Cl ZINC000484224394 899821694 /nfs/dbraw/zinc/82/16/94/899821694.db2.gz QRFUSIITLJCEMO-CQSZACIVSA-N 0 3 422.356 4.049 20 0 HIADHN CSc1cccc(N(C(=O)c2cc(Br)cn2C)C2CCN(C)CC2)c1 ZINC000484290884 899855662 /nfs/dbraw/zinc/85/56/62/899855662.db2.gz DIFHVFHMRFWYEQ-UHFFFAOYSA-N 0 3 422.392 4.251 20 0 HIADHN CCn1nc(C(C)C)cc1C(=O)N(c1cccc(SC)c1)C1CCN(C)CC1 ZINC000484296751 899858794 /nfs/dbraw/zinc/85/87/94/899858794.db2.gz NXRLOJOVUNPPPS-UHFFFAOYSA-N 0 3 400.592 4.489 20 0 HIADHN CSc1cccc(N(C(=O)CSCc2ccccn2)C2CCN(C)CC2)c1 ZINC000484298592 899861349 /nfs/dbraw/zinc/86/13/49/899861349.db2.gz UPVRBIOPMIIKIP-UHFFFAOYSA-N 0 3 401.601 4.164 20 0 HIADHN COc1ccccc1-c1nc(C2CCN(CCOCCOc3ccccc3)CC2)no1 ZINC000484329006 899883074 /nfs/dbraw/zinc/88/30/74/899883074.db2.gz ZSRFALAWEYLVRS-UHFFFAOYSA-N 0 3 423.513 4.020 20 0 HIADHN CCc1noc2ncc(C(=O)N(c3cccc(SC)c3)C3CCN(C)CC3)cc12 ZINC000484372854 899915941 /nfs/dbraw/zinc/91/59/41/899915941.db2.gz NVONPAULVUNXMZ-UHFFFAOYSA-N 0 3 410.543 4.248 20 0 HIADHN COc1ccccc1OCCC(=O)N(c1cccc(SC)c1)C1CCN(C)CC1 ZINC000484399175 899926150 /nfs/dbraw/zinc/92/61/50/899926150.db2.gz CVVUJTKVILPLTH-UHFFFAOYSA-N 0 3 414.571 4.313 20 0 HIADHN CSc1cccc(N(C(=O)c2cc(C)n(C(C)(C)C)n2)C2CCN(C)CC2)c1 ZINC000484407178 899930437 /nfs/dbraw/zinc/93/04/37/899930437.db2.gz RCGVOZVIQSJGEE-UHFFFAOYSA-N 0 3 400.592 4.409 20 0 HIADHN CSc1cccc(N(C(=O)c2cc3c(C)nn(C)c3s2)C2CCN(C)CC2)c1 ZINC000484409149 899932104 /nfs/dbraw/zinc/93/21/04/899932104.db2.gz QRJDKOVLTIMPKB-UHFFFAOYSA-N 0 3 414.600 4.406 20 0 HIADHN CSc1cccc(N(C(=O)c2cc(NC(C)=O)ccc2F)C2CCN(C)CC2)c1 ZINC000484409075 899932276 /nfs/dbraw/zinc/93/22/76/899932276.db2.gz QCXRPVMEDLIISG-UHFFFAOYSA-N 0 3 415.534 4.247 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)Nc1ccc(N2CCC2=O)cc1)c1ccc(Cl)cc1 ZINC000484438524 899945322 /nfs/dbraw/zinc/94/53/22/899945322.db2.gz JVDHXIXYCVZTTD-FQEVSTJZSA-N 0 3 414.937 4.281 20 0 HIADHN O[C@]1(CN[C@H](Cc2ccccc2F)c2ccccc2Br)CCSC1 ZINC000484473193 899966288 /nfs/dbraw/zinc/96/62/88/899966288.db2.gz MBGHRBUFRJCXHB-MOPGFXCFSA-N 0 3 410.352 4.330 20 0 HIADHN COc1cc(OC)cc(N2CC[C@H](N[C@@H](C)c3ccc(F)cc3OC(F)F)C2)c1 ZINC000484491820 899984369 /nfs/dbraw/zinc/98/43/69/899984369.db2.gz JAFHVFFKSPTRBE-ZFWWWQNUSA-N 0 3 410.436 4.374 20 0 HIADHN CN1CCC[C@H](N[C@@H]2CCCc3nc(-c4ccccc4Br)sc32)C1=O ZINC000484506078 899996157 /nfs/dbraw/zinc/99/61/57/899996157.db2.gz UGVBROXSFFWYIU-ZBFHGGJFSA-N 0 3 420.376 4.160 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(S(=O)(=O)N(C)C)cc1)c1ccc(OCC2CC2)c(F)c1 ZINC000484508455 899999345 /nfs/dbraw/zinc/99/93/45/899999345.db2.gz PIOIQJWCLNLVCP-JKSUJKDBSA-N 0 3 420.550 4.277 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(OCC2CC2)c(F)c1)c1cccc(NS(C)(=O)=O)c1 ZINC000484510296 900002204 /nfs/dbraw/zinc/00/22/04/900002204.db2.gz WOUHRHVWXUAFEA-CABCVRRESA-N 0 3 406.523 4.398 20 0 HIADHN COCCOc1ccc([C@@H](C)NCc2ccccc2-n2nc(C)cc2C)cc1OC ZINC000484519502 900008053 /nfs/dbraw/zinc/00/80/53/900008053.db2.gz KDUPACIOSPJTAQ-LJQANCHMSA-N 0 3 409.530 4.374 20 0 HIADHN C[C@H](N[C@@H](C)c1cccc(N2CCCS2(=O)=O)c1)c1cccc(N2CCCC2)c1 ZINC000484644055 900090026 /nfs/dbraw/zinc/09/00/26/900090026.db2.gz TUGKBDNRBFDIOJ-OALUTQOASA-N 0 3 413.587 4.239 20 0 HIADHN CCOc1cn(-c2ccccc2)nc1C(=O)NC[C@H](c1ccsc1)N(CC)CC ZINC000484703020 900138398 /nfs/dbraw/zinc/13/83/98/900138398.db2.gz DUKMVHKBRHJESZ-LJQANCHMSA-N 0 3 412.559 4.145 20 0 HIADHN CCOC(=O)c1c(CN2C[C@@H](C)[C@H](CO)C2)nc2ccccc2c1-c1ccccc1 ZINC000484714858 900147406 /nfs/dbraw/zinc/14/74/06/900147406.db2.gz NININPPSTQPIOP-MJGOQNOKSA-N 0 3 404.510 4.139 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)NCc1ccc(F)cc1Br)c1ccco1 ZINC000484721017 900152141 /nfs/dbraw/zinc/15/21/41/900152141.db2.gz WQXJSSOCDPCQBZ-BLLLJJGKSA-N 0 3 412.303 4.110 20 0 HIADHN CCc1nc(C2CCN([C@H](C)C(=O)N[C@@H](C)c3ccc(Cl)cc3Cl)CC2)n[nH]1 ZINC000484740631 900164044 /nfs/dbraw/zinc/16/40/44/900164044.db2.gz NUYKFAZIIJQUMP-QWHCGFSZSA-N 0 3 424.376 4.119 20 0 HIADHN CCc1n[nH]c(C2CCN([C@H](C)C(=O)N[C@@H](C)c3ccc(Cl)cc3Cl)CC2)n1 ZINC000484740631 900164047 /nfs/dbraw/zinc/16/40/47/900164047.db2.gz NUYKFAZIIJQUMP-QWHCGFSZSA-N 0 3 424.376 4.119 20 0 HIADHN CCc1nnc(C2CCN([C@H](C)C(=O)N[C@@H](C)c3ccc(Cl)cc3Cl)CC2)[nH]1 ZINC000484740631 900164052 /nfs/dbraw/zinc/16/40/52/900164052.db2.gz NUYKFAZIIJQUMP-QWHCGFSZSA-N 0 3 424.376 4.119 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)Nc1ccnn1C(C)(C)C ZINC000484781098 900190647 /nfs/dbraw/zinc/19/06/47/900190647.db2.gz ZNXFPNBWGKMGCT-UHFFFAOYSA-N 0 3 411.472 4.253 20 0 HIADHN O=C(Nc1cccc(C(=O)Nc2ccccn2)c1)c1cccc(CN2CCCC2)c1 ZINC000505745609 914424262 /nfs/dbraw/zinc/42/42/62/914424262.db2.gz ZLPFEECSJLQKBH-UHFFFAOYSA-N 0 3 400.482 4.182 20 0 HIADHN CCC1CCC(N(C)CC(=O)N(C)CC(=O)Nc2ccccc2C(F)(F)F)CC1 ZINC000484921331 900296534 /nfs/dbraw/zinc/29/65/34/900296534.db2.gz HXIRFJOSMJLMLB-UHFFFAOYSA-N 0 3 413.484 4.003 20 0 HIADHN Cc1cccnc1C(C)(C)CNC(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000484949242 900316985 /nfs/dbraw/zinc/31/69/85/900316985.db2.gz BJTVIUPMCZLSPO-JOCHJYFZSA-N 0 3 419.491 4.238 20 0 HIADHN Cc1cccc(C)c1NC(=O)CCCN1CCCN(C(=O)c2ccc(F)cc2)CC1 ZINC000484995190 900348890 /nfs/dbraw/zinc/34/88/90/900348890.db2.gz ISFFULUETSGBLY-UHFFFAOYSA-N 0 3 411.521 4.009 20 0 HIADHN COc1ccc(NC(=O)CCN2CCC(Oc3ccc(F)cc3F)CC2)cc1Cl ZINC000485031015 900372392 /nfs/dbraw/zinc/37/23/92/900372392.db2.gz ZIRUMVBTCUVSKA-UHFFFAOYSA-N 0 3 424.875 4.499 20 0 HIADHN Cc1noc([C@H]2CCCN(CCC(=O)Nc3ccc(OCc4ccccc4)cc3)C2)n1 ZINC000485047652 900381341 /nfs/dbraw/zinc/38/13/41/900381341.db2.gz VUQMSVXUAPJKJJ-FQEVSTJZSA-N 0 3 420.513 4.165 20 0 HIADHN Cc1noc([C@@H]2CCCN(CCC(=O)Nc3ccc(OCc4ccccc4)cc3)C2)n1 ZINC000485047653 900381836 /nfs/dbraw/zinc/38/18/36/900381836.db2.gz VUQMSVXUAPJKJJ-HXUWFJFHSA-N 0 3 420.513 4.165 20 0 HIADHN COc1ccc(-c2nc(CN[C@]3(CO)C[C@H](C)CC(C)(C)C3)cs2)c(OC)c1 ZINC000485066071 900390850 /nfs/dbraw/zinc/39/08/50/900390850.db2.gz FSXBEFLSXZZYSV-IVZQSRNASA-N 0 3 404.576 4.494 20 0 HIADHN COc1ccc(NC(=O)CCN2CCC(c3noc(C(C)C)n3)CC2)cc1Cl ZINC000485092608 900404410 /nfs/dbraw/zinc/40/44/10/900404410.db2.gz PEXDBJFPTNYSMQ-UHFFFAOYSA-N 0 3 406.914 4.063 20 0 HIADHN CCC(=O)N[C@H]1CCCN(CCCC(=O)Nc2c(CC)ccc(Cl)c2CC)C1 ZINC000485096417 900406138 /nfs/dbraw/zinc/40/61/38/900406138.db2.gz XNUZHNPRMYUSGL-KRWDZBQOSA-N 0 3 407.986 4.174 20 0 HIADHN O=C(Nc1cccc(Cl)c1Br)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000485247846 900533151 /nfs/dbraw/zinc/53/31/51/900533151.db2.gz SMVORQLWUPGBOM-CQSZACIVSA-N 0 3 408.727 4.499 20 0 HIADHN CCC[C@H](NCC(=O)Nc1ccccc1I)c1ccccc1 ZINC000485280212 900558091 /nfs/dbraw/zinc/55/80/91/900558091.db2.gz BVEWAGQSJGLLPL-INIZCTEOSA-N 0 3 408.283 4.361 20 0 HIADHN CCC[C@H](NCC(=O)Nc1cc(C(F)(F)F)ccc1-n1cncn1)c1ccccc1 ZINC000485287816 900565207 /nfs/dbraw/zinc/56/52/07/900565207.db2.gz PYRDIWYHYYSGME-KRWDZBQOSA-N 0 3 417.435 4.356 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3cccc(Oc4ccncc4)c3)CC2)C[C@H](C)O1 ZINC000485317045 900595908 /nfs/dbraw/zinc/59/59/08/900595908.db2.gz JFWZTUMSYHCEQL-KDURUIRLSA-N 0 3 424.545 4.227 20 0 HIADHN CCc1c(NC(=O)N[C@@H]2CCCN(C)[C@H]2C)cnn1-c1cccc(C(F)(F)F)c1 ZINC000485323432 900604932 /nfs/dbraw/zinc/60/49/32/900604932.db2.gz PCCVTJVAATXUQO-XJKSGUPXSA-N 0 3 409.456 4.058 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CCC[C@@]12CCOC2)c1ccc(C(F)(F)F)cc1 ZINC000485333078 900619132 /nfs/dbraw/zinc/61/91/32/900619132.db2.gz TTYZTJQOHVCFGC-ICSRJNTNSA-N 0 3 413.484 4.053 20 0 HIADHN CC[C@@H](C)n1ncc(NC(=O)NC[C@@H](c2cccc(OC)c2)N(CC)CC)c1C ZINC000485350948 900645074 /nfs/dbraw/zinc/64/50/74/900645074.db2.gz QVDLVFPDDAVXRJ-IERDGZPVSA-N 0 3 401.555 4.376 20 0 HIADHN CN(C)C[C@H](NC(=O)NCc1nc2cc(Cl)ccc2s1)c1ccc(F)cc1 ZINC000485379803 900677383 /nfs/dbraw/zinc/67/73/83/900677383.db2.gz YBIYWLGWXRKULF-INIZCTEOSA-N 0 3 406.914 4.191 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)NCc1cccc(NC(=O)CC(C)C)c1 ZINC000485418420 900716970 /nfs/dbraw/zinc/71/69/70/900716970.db2.gz YYAPCNIZRTYONG-UHFFFAOYSA-N 0 3 402.583 4.079 20 0 HIADHN CCCCN(C)c1ccc(C(=O)Nc2ccc(C(=O)NCCN3CCCC3)cc2)cc1 ZINC000485479223 900772754 /nfs/dbraw/zinc/77/27/54/900772754.db2.gz ILPYBZJFGBQXEJ-UHFFFAOYSA-N 0 3 422.573 4.001 20 0 HIADHN CCOc1cc(CN2C[C@H](c3ccc(F)cc3)C[C@@H]2C)nc2nc(C(F)(F)F)nn21 ZINC000485685236 900935972 /nfs/dbraw/zinc/93/59/72/900935972.db2.gz OVRGGBJEXKKYHO-GXTWGEPZSA-N 0 3 423.414 4.059 20 0 HIADHN CC[C@H](NCc1ccc(OCC(=O)OC)cc1)c1cc(F)cc(Br)c1 ZINC000485710812 900960558 /nfs/dbraw/zinc/96/05/58/900960558.db2.gz NNPHQMNAYLAPSY-SFHVURJKSA-N 0 3 410.283 4.381 20 0 HIADHN C[C@@H]1CN(C)C[C@H]1C(=O)Nc1nnc(SCc2c(Cl)cccc2Cl)s1 ZINC000485859313 901100058 /nfs/dbraw/zinc/10/00/58/901100058.db2.gz ZXWUMMDGAQBUPN-NXEZZACHSA-N 0 3 417.387 4.273 20 0 HIADHN COC(=O)c1ccc2c(c1)nc(CN1C[C@H](c3ccccc3)[C@@H]3CCCC[C@H]31)[nH]c2=O ZINC000485880166 901115942 /nfs/dbraw/zinc/11/59/42/901115942.db2.gz IRHKPUJVNKTOGN-CZTZKLFOSA-N 0 3 417.509 4.280 20 0 HIADHN CCN(C(=O)C(=O)Nc1ccc(Cl)c(F)c1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000485883415 901117725 /nfs/dbraw/zinc/11/77/25/901117725.db2.gz NISCNGSLFPUPBX-YJBOKZPZSA-N 0 3 417.912 4.102 20 0 HIADHN Cc1csc(C(=O)Nc2cccc3c2CCN(CC(C)(C)O)C3)c1Br ZINC000485937810 901159126 /nfs/dbraw/zinc/15/91/26/901159126.db2.gz DENHNYVFCGPIOM-UHFFFAOYSA-N 0 3 423.376 4.200 20 0 HIADHN C[C@H]1C[C@@H](c2ccc(C(F)(F)F)cc2)N(CCn2cnc3ccccc3c2=O)C1 ZINC000485968639 901185445 /nfs/dbraw/zinc/18/54/45/901185445.db2.gz WCBWTNOKGXTGTL-YWZLYKJASA-N 0 3 401.432 4.498 20 0 HIADHN CN(C(=O)c1ccc(Oc2cccc(Br)c2)cc1)[C@H]1CN2CCC1CC2 ZINC000486167161 901354672 /nfs/dbraw/zinc/35/46/72/901354672.db2.gz AJGVZKRACLSSPT-FQEVSTJZSA-N 0 3 415.331 4.408 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)C[C@@H](c3ccccc3)C(F)(F)F)CC2)C[C@H](C)O1 ZINC000486293204 901475063 /nfs/dbraw/zinc/47/50/63/901475063.db2.gz QIKIXVXPCVWZGG-QKLQHJQFSA-N 0 3 412.496 4.070 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(NC[C@H](c3ccccc3OC)[NH+]3CCCC3)nc2)n1 ZINC000486443700 901601840 /nfs/dbraw/zinc/60/18/40/901601840.db2.gz UBRKLRBOTCTNLV-HXUWFJFHSA-N 0 3 419.529 4.064 20 0 HIADHN Cc1cc(C)n([C@@H](C)CC(=O)N[C@@H](c2ccc(F)c(F)c2)C(C)(C)N2CCCC2)n1 ZINC000486562108 901706716 /nfs/dbraw/zinc/70/67/16/901706716.db2.gz QFJOTCARBWRKIL-JTSKRJEESA-N 0 3 418.532 4.461 20 0 HIADHN Cc1noc(C)c1CCC(=O)N[C@H](c1ccc(F)c(F)c1)C(C)(C)N1CCCC1 ZINC000486575175 901718331 /nfs/dbraw/zinc/71/83/31/901718331.db2.gz ZINFUPBHUUWHIE-OAQYLSRUSA-N 0 3 405.489 4.234 20 0 HIADHN C[C@H]1CCCN(S(=O)(=O)c2ccc(CNCc3cc4ccc(F)cc4[nH]3)cc2)C1 ZINC000486717053 901810284 /nfs/dbraw/zinc/81/02/84/901810284.db2.gz MJFRRWQRPQISKS-INIZCTEOSA-N 0 3 415.534 4.017 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N[C@H]3CCOC4(CCCCC4)C3)c(C)c2)CC1 ZINC000486743162 901825456 /nfs/dbraw/zinc/82/54/56/901825456.db2.gz DZEGIUMXLAFICJ-FQEVSTJZSA-N 0 3 414.594 4.140 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N[C@H](c3ccccc3)c3ccncc3)cc2)CC1 ZINC000486778889 901848521 /nfs/dbraw/zinc/84/85/21/901848521.db2.gz MTJSLXXXZFKLOW-RUZDIDTESA-N 0 3 414.553 4.131 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1ccn(-c2c(F)cccc2F)n1)c1ccsc1 ZINC000486809010 901867083 /nfs/dbraw/zinc/86/70/83/901867083.db2.gz MXEUUQALPZANIP-GOSISDBHSA-N 0 3 404.486 4.025 20 0 HIADHN Cc1ccc(Cc2cnc(NC(=O)N3CC[C@@H]4CCN(C)C[C@H]43)s2)cc1Cl ZINC000486905216 901951979 /nfs/dbraw/zinc/95/19/79/901951979.db2.gz DSLHROJXFCKAKP-MAUKXSAKSA-N 0 3 404.967 4.254 20 0 HIADHN COc1cc(CNCc2c[nH]nc2-c2ccc(C(F)(F)F)cc2)cc(OC)c1OC ZINC000486970180 901995812 /nfs/dbraw/zinc/99/58/12/901995812.db2.gz QJINKXZTUQSDNF-UHFFFAOYSA-N 0 3 421.419 4.411 20 0 HIADHN CC(C)([C@@H](NC(=O)Cc1n[nH]c2ccccc21)c1ccc(F)c(F)c1)N1CCCC1 ZINC000487099761 902057898 /nfs/dbraw/zinc/05/78/98/902057898.db2.gz MTGASCDNQTUTBA-QFIPXVFZSA-N 0 3 412.484 4.116 20 0 HIADHN Brc1cccc(N2CC[C@H](NCc3cnc([C@H]4CCCO4)s3)C2)c1 ZINC000487176576 902086981 /nfs/dbraw/zinc/08/69/81/902086981.db2.gz YLBILLDAGBFWEO-WMLDXEAASA-N 0 3 408.365 4.126 20 0 HIADHN COC1CCN(C(C)(C)CNC(=O)c2cc(Cl)ccc2OC2CCCC2)CC1 ZINC000487245573 902115813 /nfs/dbraw/zinc/11/58/13/902115813.db2.gz FOJHZRBDOAIXOJ-UHFFFAOYSA-N 0 3 408.970 4.281 20 0 HIADHN COc1ccc(C2(CNCc3c(Br)cnn3C)CCCCC2)cc1OC ZINC000487298152 902141615 /nfs/dbraw/zinc/14/16/15/902141615.db2.gz JZAFNGJUPURSRY-UHFFFAOYSA-N 0 3 422.367 4.192 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)[C@H]2CCO[C@@H]2c2cnn(-c3ccccc3F)c2)c1 ZINC000487298212 902142027 /nfs/dbraw/zinc/14/20/27/902142027.db2.gz AYVLETYXVGLLMH-NZQKXSOJSA-N 0 3 422.504 4.098 20 0 HIADHN CCN1CCC[C@@H](CN(C)C(=O)Nc2cc(C)c(F)cc2Cl)[C@@H]1c1cnn(C)c1 ZINC000487311343 902147270 /nfs/dbraw/zinc/14/72/70/902147270.db2.gz CQDMISBDMLAPCY-MGPUTAFESA-N 0 3 421.948 4.458 20 0 HIADHN Cc1cc(Br)cc(NC(=O)c2ccc(CN3CCC(CO)CC3)cc2)c1 ZINC000487408768 902189978 /nfs/dbraw/zinc/18/99/78/902189978.db2.gz FNIZNABKWPMWEQ-UHFFFAOYSA-N 0 3 417.347 4.214 20 0 HIADHN CN(CCN(Cc1ccccc1)C(=O)Cc1cn2ccccc2n1)Cc1ccccc1 ZINC000487409404 902191417 /nfs/dbraw/zinc/19/14/17/902191417.db2.gz DGCHKKCWHZIIFS-UHFFFAOYSA-N 0 3 412.537 4.038 20 0 HIADHN Fc1cccc(Cl)c1COc1ccc(CN2CCC(n3cncn3)CC2)cc1 ZINC000512384166 921120801 /nfs/dbraw/zinc/12/08/01/921120801.db2.gz LHFWMQUOWJXIIH-UHFFFAOYSA-N 0 3 400.885 4.487 20 0 HIADHN CN(C)Cc1ccccc1C(=O)Nc1nnc(-c2cccc(OC(F)(F)F)c2)s1 ZINC000487759861 902347961 /nfs/dbraw/zinc/34/79/61/902347961.db2.gz LADSNAWVZZEGNE-UHFFFAOYSA-N 0 3 422.432 4.418 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(Oc2cccnc2)cc1)C(=O)NC(=O)Nc1ccccc1F ZINC000487931382 902461751 /nfs/dbraw/zinc/46/17/51/902461751.db2.gz FBMLOHDQFAGAPU-JKSUJKDBSA-N 0 3 422.460 4.400 20 0 HIADHN C[C@H]1CN(C2CCOCC2)CCN1C(=O)Nc1ccc(SC2CCCC2)cc1 ZINC000487933501 902463579 /nfs/dbraw/zinc/46/35/79/902463579.db2.gz UUCRYOLREMNASW-KRWDZBQOSA-N 0 3 403.592 4.438 20 0 HIADHN COCCN(CC(=O)Nc1ccc(NC(=O)c2cccs2)cc1)[C@@H]1CCC[C@@H]1C ZINC000487985109 902507743 /nfs/dbraw/zinc/50/77/43/902507743.db2.gz CWJHLGXTLGLTJH-QFBILLFUSA-N 0 3 415.559 4.076 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)NC(=O)NC1CCCCC1)c1ccc(Oc2cccnc2)cc1 ZINC000487995802 902517830 /nfs/dbraw/zinc/51/78/30/902517830.db2.gz SBRKNXHQWCZZJY-SJORKVTESA-N 0 3 410.518 4.072 20 0 HIADHN Cc1ccc(NC(=O)[C@H]2CSCN2C(=O)c2cccc(CN3CCCC3)c2)c(C)c1 ZINC000488105835 902608116 /nfs/dbraw/zinc/60/81/16/902608116.db2.gz SFNRIZSOUTZDBA-JOCHJYFZSA-N 0 3 423.582 4.053 20 0 HIADHN C[C@H]1CN(C2CCOCC2)CCN1C(=O)Nc1ccc2oc(CC(C)(C)C)nc2c1 ZINC000488312570 902760723 /nfs/dbraw/zinc/76/07/23/902760723.db2.gz VFXIJCLZFKDZLQ-INIZCTEOSA-N 0 3 414.550 4.133 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)CCC(=O)c1ccc2c(c1)CCC2 ZINC000488480538 902847777 /nfs/dbraw/zinc/84/77/77/902847777.db2.gz CVSHWMXFTKDQFM-DVECYGJZSA-N 0 3 404.554 4.165 20 0 HIADHN C[C@H](c1ccc(Br)cc1)N1CCN(CCCOCC(F)(F)F)CC1 ZINC000488488548 902851790 /nfs/dbraw/zinc/85/17/90/902851790.db2.gz IDQFGEXVTPUVSG-CQSZACIVSA-N 0 3 409.290 4.097 20 0 HIADHN Cc1cccc(-c2ccc(CNC(=O)N3CCN(C4CCOCC4)C[C@@H]3C)cc2)c1 ZINC000488512205 902864195 /nfs/dbraw/zinc/86/41/95/902864195.db2.gz ZMGCXPGGJRBGEZ-FQEVSTJZSA-N 0 3 407.558 4.057 20 0 HIADHN Cc1c(C(=O)N[C@H]2CCN(Cc3ccccc3)C[C@H]2C)[nH]c2c1C(=O)CC(C)(C)C2 ZINC000488516553 902866364 /nfs/dbraw/zinc/86/63/64/902866364.db2.gz NLRACEUOCQHOQF-APWZRJJASA-N 0 3 407.558 4.119 20 0 HIADHN C[C@@H]1CN(C2CCOCC2)CCN1C(=O)Nc1ccc(-c2cccc(F)c2)c(F)c1 ZINC000488571222 902887437 /nfs/dbraw/zinc/88/74/37/902887437.db2.gz GGPRTISQJDNCDV-MRXNPFEDSA-N 0 3 415.484 4.349 20 0 HIADHN Cc1cc(C(=O)N(Cc2ccccc2)C2CCN(C)CC2)c(C)n1-c1nccs1 ZINC000488671662 902933359 /nfs/dbraw/zinc/93/33/59/902933359.db2.gz CVNQQDGBEQJCOW-UHFFFAOYSA-N 0 3 408.571 4.287 20 0 HIADHN C[C@@H]1CN(C2CCOCC2)CCN1Cc1csc(COc2ccc(Cl)cc2)n1 ZINC000488674862 902935873 /nfs/dbraw/zinc/93/58/73/902935873.db2.gz IACYVHHYOBTNGT-MRXNPFEDSA-N 0 3 421.994 4.061 20 0 HIADHN C[C@H]1CN(C2CCOCC2)CCN1Cc1csc(Cc2ccc(Cl)cc2)n1 ZINC000488713422 902962555 /nfs/dbraw/zinc/96/25/55/902962555.db2.gz LCOPEZXYQCPVIU-INIZCTEOSA-N 0 3 405.995 4.072 20 0 HIADHN CN(C)Cc1ccccc1CNC(=O)c1ccc(C(F)(F)F)cc1N1CCCC1 ZINC000506004704 914675886 /nfs/dbraw/zinc/67/58/86/914675886.db2.gz GICOOKBFXRBACC-UHFFFAOYSA-N 0 3 405.464 4.297 20 0 HIADHN Cc1cc(C)c(-c2nnc(SCC(=O)NC[C@@H](c3ccccc3)N(C)C)o2)c(C)c1 ZINC000488802757 903008691 /nfs/dbraw/zinc/00/86/91/903008691.db2.gz HNNICJSVCRZSBC-IBGZPJMESA-N 0 3 424.570 4.173 20 0 HIADHN COc1ccc(NC(=O)[C@@H](C)N[C@H](COc2ccccc2F)C(C)(C)C)c(OC)c1 ZINC000489025196 903128557 /nfs/dbraw/zinc/12/85/57/903128557.db2.gz CLDWXXWBHGUTGY-QVKFZJNVSA-N 0 3 418.509 4.253 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1cc(C)nn1-c1cc(C)ccn1)c1ccsc1 ZINC000489129944 903219053 /nfs/dbraw/zinc/21/90/53/903219053.db2.gz JELWKUOIIJHVEQ-SFHVURJKSA-N 0 3 412.563 4.150 20 0 HIADHN CCc1cccc2c1OCC[C@@H]2NC(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000489130696 903220581 /nfs/dbraw/zinc/22/05/81/903220581.db2.gz CPSSATXNNQETNH-QHCPKHFHSA-N 0 3 407.558 4.379 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)N[C@@H]2CCOc3c(Cl)cccc32)CC1 ZINC000489234640 903278837 /nfs/dbraw/zinc/27/88/37/903278837.db2.gz AAFCTCVKZDCZDI-OAQYLSRUSA-N 0 3 413.949 4.470 20 0 HIADHN Cc1cc(N2CCCCCC2)ccc1NC(=O)N(CCN(C)C)Cc1ccccn1 ZINC000489289892 903312216 /nfs/dbraw/zinc/31/22/16/903312216.db2.gz OISCFOFOPVNGQA-UHFFFAOYSA-N 0 3 409.578 4.366 20 0 HIADHN CCN(CC1CCN(c2ccccn2)CC1)[C@H](C)C(=O)Nc1nc2ccccc2s1 ZINC000489292300 903312867 /nfs/dbraw/zinc/31/28/67/903312867.db2.gz MWJDJIWPAWMQAZ-QGZVFWFLSA-N 0 3 423.586 4.257 20 0 HIADHN Cc1cc(CN(C)[C@H](C)c2ccc(S(N)(=O)=O)cc2)ccc1Oc1cccnc1 ZINC000506027866 914710345 /nfs/dbraw/zinc/71/03/45/914710345.db2.gz VFBXDTAQOYWBAN-QGZVFWFLSA-N 0 3 411.527 4.023 20 0 HIADHN O=C(Nc1ccc(F)cc1)[C@H](N[C@H]1CCO[C@]2(CCSC2)C1)c1ccccc1 ZINC000489477971 903408796 /nfs/dbraw/zinc/40/87/96/903408796.db2.gz NEMQNBGLQQEAJZ-TUNNFDKTSA-N 0 3 400.519 4.150 20 0 HIADHN CCOc1cc(Cl)ccc1C(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000489505793 903428418 /nfs/dbraw/zinc/42/84/18/903428418.db2.gz ILPFMQHHSLEXHL-UHFFFAOYSA-N 0 3 402.922 4.195 20 0 HIADHN C[C@H](N[C@@H](Cc1ccccc1)[C@H](O)C(F)F)c1ccc(Br)c(F)c1 ZINC000489543407 903454494 /nfs/dbraw/zinc/45/44/94/903454494.db2.gz GUQAQHRVLNYKPV-GOPGUHFVSA-N 0 3 402.254 4.476 20 0 HIADHN Cc1ccc(NC(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)cc1C(=O)N(C)C(C)C ZINC000489564014 903466249 /nfs/dbraw/zinc/46/62/49/903466249.db2.gz DVGZKZBTMBVPMZ-FGZHOGPDSA-N 0 3 408.546 4.042 20 0 HIADHN Cc1cccc2c(CCNC(=O)N(Cc3ccccc3)C3CCN(C)CC3)c[nH]c21 ZINC000489574980 903473292 /nfs/dbraw/zinc/47/32/92/903473292.db2.gz VNSBLABTSTUGCL-UHFFFAOYSA-N 0 3 404.558 4.325 20 0 HIADHN O[C@@H](COc1ccc(-c2ccccc2)cc1)CN1CCC(n2cc(Cl)cn2)CC1 ZINC000506035868 914721115 /nfs/dbraw/zinc/72/11/15/914721115.db2.gz KDHPBUNFLSXQCY-JOCHJYFZSA-N 0 3 411.933 4.280 20 0 HIADHN CN(C)Cc1cccc(NC(=O)Nc2cccc(CS(=O)(=O)C(C)(C)C)c2)c1 ZINC000489601265 903490132 /nfs/dbraw/zinc/49/01/32/903490132.db2.gz WYFJAGVFVFHLTQ-UHFFFAOYSA-N 0 3 403.548 4.106 20 0 HIADHN CCCN(C(=O)NC[C@H]1CCCn2cc(C)nc21)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000506038924 914725895 /nfs/dbraw/zinc/72/58/95/914725895.db2.gz RQGIAEJABTZNEZ-DHIUTWEWSA-N 0 3 423.605 4.155 20 0 HIADHN Cc1nc(C(C)(C)NCCOCCNC(C)(C)c2nc(C)c(C)s2)sc1C ZINC000489624386 903503336 /nfs/dbraw/zinc/50/33/36/903503336.db2.gz SGNGZMWXDNCCKA-UHFFFAOYSA-N 0 3 410.653 4.199 20 0 HIADHN Cc1cccc(CC(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)c1Cl ZINC000489712338 903554892 /nfs/dbraw/zinc/55/48/92/903554892.db2.gz WNPKGXGTQHAUCG-HXUWFJFHSA-N 0 3 408.933 4.473 20 0 HIADHN C[C@@H](OCCCNC(=O)N(Cc1ccccc1)C1CCN(C)CC1)c1ccccc1 ZINC000489881295 903649644 /nfs/dbraw/zinc/64/96/44/903649644.db2.gz HHPNMMJMINSFFS-OAQYLSRUSA-N 0 3 409.574 4.460 20 0 HIADHN Cc1nc2ccccc2n1CCCNC(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000489906194 903665124 /nfs/dbraw/zinc/66/51/24/903665124.db2.gz BQZWLYIQKQDRNQ-UHFFFAOYSA-N 0 3 419.573 4.041 20 0 HIADHN Cc1cccc2c1[C@H](C)C[C@@H]2CC(=O)Nc1ccccc1CN1CCC[C@H](C(N)=O)C1 ZINC000489909156 903666513 /nfs/dbraw/zinc/66/65/13/903666513.db2.gz GRQSDDFJRRSULD-HLAWJBBLSA-N 0 3 419.569 4.312 20 0 HIADHN CN1CCC(Oc2ccc(NC(=O)CCCCC(=O)c3ccc(F)cc3)cn2)CC1 ZINC000489963696 903700369 /nfs/dbraw/zinc/70/03/69/903700369.db2.gz QZQNZGVYZKRLQT-UHFFFAOYSA-N 0 3 413.493 4.076 20 0 HIADHN C[C@@H](c1nc(-c2ccc(Cl)cc2)no1)N1CCC(CCCN2CCOCC2)CC1 ZINC000506047354 914743022 /nfs/dbraw/zinc/74/30/22/914743022.db2.gz KJFFFFCGGAYYIF-KRWDZBQOSA-N 0 3 418.969 4.275 20 0 HIADHN Cc1ccc([C@@H]2C[C@H](C)N(CC(=O)N3CCC(OCc4ccccc4)CC3)C2)cc1 ZINC000490051173 903744565 /nfs/dbraw/zinc/74/45/65/903744565.db2.gz BRDDFSCIQBJYPV-XUZZJYLKSA-N 0 3 406.570 4.381 20 0 HIADHN C[C@@H](NCCCCCn1nnc(-c2ccccc2)n1)c1nc(C(F)(F)F)cs1 ZINC000490080519 903763197 /nfs/dbraw/zinc/76/31/97/903763197.db2.gz PEHPJVHSTZQGGS-CYBMUJFWSA-N 0 3 410.469 4.337 20 0 HIADHN CCN1CCN([C@H](C)CN[C@H](c2cccc(SC)c2)c2cc(F)ccc2F)CC1 ZINC000490171583 903809156 /nfs/dbraw/zinc/80/91/56/903809156.db2.gz FUYKAGHDSRXHIQ-UZUQRXQVSA-N 0 3 419.585 4.392 20 0 HIADHN Cc1ccc([C@H](NC[C@@H](C)N2CCCC[C@@H]2C)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000490184933 903815019 /nfs/dbraw/zinc/81/50/19/903815019.db2.gz PZGOSVLBMZGFJY-ROKPMTFOSA-N 0 3 414.615 4.340 20 0 HIADHN O=C(N[C@@H](c1ccccc1)c1ccncc1)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000490238579 903846142 /nfs/dbraw/zinc/84/61/42/903846142.db2.gz FJKFVWNLMFBSEH-RPWUZVMVSA-N 0 3 400.526 4.135 20 0 HIADHN O=C(Nc1nc2ccc(C(F)(F)F)cc2[nH]1)c1ccc(CN2CCSCC2)cc1 ZINC000490276974 903870678 /nfs/dbraw/zinc/87/06/78/903870678.db2.gz UHXPUPRMFLFQFS-UHFFFAOYSA-N 0 3 420.460 4.383 20 0 HIADHN CCNC(=O)Nc1ccc(C)c(NC(=O)NC[C@@H](c2ccc(CC)cc2)N(C)C)c1 ZINC000490300973 903888938 /nfs/dbraw/zinc/88/89/38/903888938.db2.gz QQOXXRDAXLBYFI-NRFANRHFSA-N 0 3 411.550 4.123 20 0 HIADHN COc1ccc(NC(=O)NC[C@@H](c2ccccc2)N2CCCC2)cc1Br ZINC000490302800 903891217 /nfs/dbraw/zinc/89/12/17/903891217.db2.gz YOPUZZIKMRTRFM-SFHVURJKSA-N 0 3 418.335 4.416 20 0 HIADHN Cc1cc(NC(=O)CCN(C)Cc2cn(-c3ccccc3)nc2-c2cccs2)no1 ZINC000490303235 903891304 /nfs/dbraw/zinc/89/13/04/903891304.db2.gz VSXUUVYHSIMTCY-UHFFFAOYSA-N 0 3 421.526 4.358 20 0 HIADHN CC1CCN([C@@H](CNC(=O)N[C@H]2CCOC3(CCCC3)C2)c2cccs2)CC1 ZINC000490316457 903896542 /nfs/dbraw/zinc/89/65/42/903896542.db2.gz OZYLIZJDRWCVIL-OALUTQOASA-N 0 3 405.608 4.312 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N2CCC[C@H]2c2nc3cc(C)ccc3[nH]2)N(C)C)cc1 ZINC000490325680 903906127 /nfs/dbraw/zinc/90/61/27/903906127.db2.gz BQNKJELDIKLGPU-VXKWHMMOSA-N 0 3 405.546 4.329 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N2CCC[C@H]2c2nc3ccc(C)cc3[nH]2)N(C)C)cc1 ZINC000490325680 903906154 /nfs/dbraw/zinc/90/61/54/903906154.db2.gz BQNKJELDIKLGPU-VXKWHMMOSA-N 0 3 405.546 4.329 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N2CCC[C@@H]2c2nc3cc(C)ccc3[nH]2)N(C)C)cc1 ZINC000490325681 903907308 /nfs/dbraw/zinc/90/73/08/903907308.db2.gz BQNKJELDIKLGPU-YADHBBJMSA-N 0 3 405.546 4.329 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N2CCC[C@@H]2c2nc3ccc(C)cc3[nH]2)N(C)C)cc1 ZINC000490325681 903907313 /nfs/dbraw/zinc/90/73/13/903907313.db2.gz BQNKJELDIKLGPU-YADHBBJMSA-N 0 3 405.546 4.329 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)Nc3ccc(NC(=O)c4ccc(Cl)cc4)cc3)[C@H]2C1 ZINC000490327971 903913921 /nfs/dbraw/zinc/91/39/21/903913921.db2.gz PLJWCSVPKWJGHC-QRWLVFNGSA-N 0 3 412.921 4.150 20 0 HIADHN CCNC(=O)Nc1ccc(C)c(NC(=O)N[C@@H](CN2CCCC2)c2ccccc2)c1 ZINC000490341400 903932592 /nfs/dbraw/zinc/93/25/92/903932592.db2.gz YYIKGDSYXAZCGA-NRFANRHFSA-N 0 3 409.534 4.095 20 0 HIADHN CCC(C)(C)OCc1cccc(NC(=O)C(=O)NCC(C)(C)N2CCCCC2)c1C ZINC000490476380 904030503 /nfs/dbraw/zinc/03/05/03/904030503.db2.gz AEOCHWJBZZETLY-UHFFFAOYSA-N 0 3 417.594 4.019 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)Nc3ccc(-c4ccco4)cc3F)CC2)C[C@H](C)O1 ZINC000490510428 904060266 /nfs/dbraw/zinc/06/02/66/904060266.db2.gz SZACVYDEPKCBDF-IRXDYDNUSA-N 0 3 415.509 4.439 20 0 HIADHN Cn1cc(-c2ccc(F)c(C(=O)NC[C@@]3(C)CCCN3Cc3ccccc3)c2)cn1 ZINC000490523156 904070257 /nfs/dbraw/zinc/07/02/57/904070257.db2.gz FKKKQXSUOYEPAP-XMMPIXPASA-N 0 3 406.505 4.011 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2cc(C(=O)NC3CC3)ccc2C)N2CCCC2)cc1 ZINC000490684575 904170979 /nfs/dbraw/zinc/17/09/79/904170979.db2.gz ONWXXNKOYJQAAO-HSZRJFAPSA-N 0 3 420.557 4.154 20 0 HIADHN C[C@H](NC(=O)NCCc1coc(-c2ccc(F)cc2)n1)[C@@H](c1ccccc1)N(C)C ZINC000490745970 904205576 /nfs/dbraw/zinc/20/55/76/904205576.db2.gz OAALEGAAWBFOKR-KKSFZXQISA-N 0 3 410.493 4.014 20 0 HIADHN CN(C)[C@H](CNC(=O)N[C@H](c1c[nH]c2ccccc21)C(F)(F)F)Cc1ccccc1 ZINC000490812731 904257733 /nfs/dbraw/zinc/25/77/33/904257733.db2.gz LHRXJHGJFMJMPH-OXJNMPFZSA-N 0 3 418.463 4.243 20 0 HIADHN CC(C)(C)[C@@H]1C[C@@H](NC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)CCO1 ZINC000490821173 904266182 /nfs/dbraw/zinc/26/61/82/904266182.db2.gz AUAYQSSZBPCSMP-WFXMLNOXSA-N 0 3 412.496 4.151 20 0 HIADHN CCC(C)(C)OCc1cccc(NC(=O)C(=O)NC[C@H](C)N2CCCC[C@H]2C)c1C ZINC000490854520 904288699 /nfs/dbraw/zinc/28/86/99/904288699.db2.gz VENBUXQXSOLNJO-MSOLQXFVSA-N 0 3 417.594 4.018 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)NCCc1nnc(C(C)C)s1)c1ccc(Cl)cc1 ZINC000490990011 904355102 /nfs/dbraw/zinc/35/51/02/904355102.db2.gz QBPQLWNLQFVZIK-KRWDZBQOSA-N 0 3 424.014 4.240 20 0 HIADHN CCc1ccc([C@H](N[C@@H](C)C[C@@H]2CCCO2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000491024524 904374931 /nfs/dbraw/zinc/37/49/31/904374931.db2.gz SUCJSVQSKMOCKE-HYVJGQCMSA-N 0 3 401.572 4.289 20 0 HIADHN CCc1ccc([C@H](N[C@@H](C)C[C@H]2CCCO2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000491024525 904375870 /nfs/dbraw/zinc/37/58/70/904375870.db2.gz SUCJSVQSKMOCKE-LXBDKUERSA-N 0 3 401.572 4.289 20 0 HIADHN CCN(CC)C[C@H](C)N[C@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000491038957 904390926 /nfs/dbraw/zinc/39/09/26/904390926.db2.gz QKSDSBCJCKVRMR-HRAATJIYSA-N 0 3 408.995 4.153 20 0 HIADHN COc1ccc([C@@H](CN[C@H](c2cnn(C)c2)c2cccc(F)c2)N2CCCC2)cc1 ZINC000491258681 904506220 /nfs/dbraw/zinc/50/62/20/904506220.db2.gz FUOMGCHXZNNNEN-RPWUZVMVSA-N 0 3 408.521 4.084 20 0 HIADHN COc1ccc([C@@H](CN[C@@H](c2cnn(C)c2)c2cccc(F)c2)N2CCCC2)cc1 ZINC000491258680 904506721 /nfs/dbraw/zinc/50/67/21/904506721.db2.gz FUOMGCHXZNNNEN-DNQXCXABSA-N 0 3 408.521 4.084 20 0 HIADHN Cn1cc(CN2CCC[C@@H](c3nnc4ccccn43)C2)c(-c2ccccc2Cl)n1 ZINC000506140752 914820701 /nfs/dbraw/zinc/82/07/01/914820701.db2.gz IHGFVNNKLCSRNP-MRXNPFEDSA-N 0 3 406.921 4.163 20 0 HIADHN O=C1CCCN1CCCN[C@@H](c1ccc(Br)cc1)c1ccccc1F ZINC000491356631 904553566 /nfs/dbraw/zinc/55/35/66/904553566.db2.gz PKRQYAMBZOYKJH-FQEVSTJZSA-N 0 3 405.311 4.280 20 0 HIADHN CC(C)COCCCN[C@@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000491368134 904561681 /nfs/dbraw/zinc/56/16/81/904561681.db2.gz PATYVLOXXNTBLM-NRFANRHFSA-N 0 3 409.979 4.485 20 0 HIADHN COc1ccccc1-c1ncc(CNC[C@H](OC(C)C)c2ccccc2OC)cn1 ZINC000491390296 904573545 /nfs/dbraw/zinc/57/35/45/904573545.db2.gz SZFCQRAXRCAPDV-QHCPKHFHSA-N 0 3 407.514 4.417 20 0 HIADHN Cc1ccc([C@H](NC[C@@H]2Cc3ccccc3O2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000491392923 904573626 /nfs/dbraw/zinc/57/36/26/904573626.db2.gz BIFXEUBNLRFLOG-URXFXBBRSA-N 0 3 407.535 4.081 20 0 HIADHN COc1cccc([C@H](CNC(=O)c2c[nH]cc2-c2ccccc2F)N2CCCC2)c1 ZINC000491399518 904579359 /nfs/dbraw/zinc/57/93/59/904579359.db2.gz IRIBCRPMUZCKCG-QHCPKHFHSA-N 0 3 407.489 4.396 20 0 HIADHN Cc1ccc([C@@H](NCCN2CCCCCC2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000491399889 904579842 /nfs/dbraw/zinc/57/98/42/904579842.db2.gz YJJKFABPOSFZKZ-DEOSSOPVSA-N 0 3 414.615 4.262 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)Nc1cc(F)c(OC(F)F)cc1F ZINC000491421655 904586619 /nfs/dbraw/zinc/58/66/19/904586619.db2.gz ZBTPQHAUHCQWDB-PXAZEXFGSA-N 0 3 411.399 4.208 20 0 HIADHN CCN(CC)[C@H](CN[C@H](c1cnn(C)c1)c1cccc(F)c1)c1cccc(OC)c1 ZINC000491425162 904590029 /nfs/dbraw/zinc/59/00/29/904590029.db2.gz ZCSPWADZSICKOL-RPWUZVMVSA-N 0 3 410.537 4.330 20 0 HIADHN Cc1ncc(NC(=O)N(CCN2CCCC2)Cc2ccc(Cl)c(Cl)c2)cn1 ZINC000491538993 904641486 /nfs/dbraw/zinc/64/14/86/904641486.db2.gz UDKOGFWUTCIPFB-UHFFFAOYSA-N 0 3 408.333 4.222 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)Nc2ccc(C(=O)NC(C)C)cc2C)c1 ZINC000491551290 904645851 /nfs/dbraw/zinc/64/58/51/904645851.db2.gz OIMTZWGLQJPLLD-UHFFFAOYSA-N 0 3 410.562 4.037 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)Nc2ccccc2N2C[C@H](C)O[C@@H](C)C2)c1 ZINC000491557249 904649598 /nfs/dbraw/zinc/64/95/98/904649598.db2.gz KDNUMXUKEYCCPD-SFTDATJTSA-N 0 3 424.589 4.204 20 0 HIADHN C[C@H](c1ccccc1Br)N(C)C(=O)NC[C@@H](c1ccccc1)N(C)C ZINC000506167254 914831416 /nfs/dbraw/zinc/83/14/16/914831416.db2.gz UVBYILDENVXFPD-BEFAXECRSA-N 0 3 404.352 4.454 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)Nc3cc(Br)cc(C(F)(F)F)c3)[C@@H]2C1 ZINC000491998156 904754342 /nfs/dbraw/zinc/75/43/42/904754342.db2.gz KKDMFIMBAZZUSI-IINYFYTJSA-N 0 3 406.246 4.026 20 0 HIADHN Cn1cc(CN[C@@H](Cc2ccc(F)cc2)[C@@H]2COc3ccccc3O2)c(C(F)F)n1 ZINC000492004988 904760427 /nfs/dbraw/zinc/76/04/27/904760427.db2.gz XZGHJTZQRCEUEF-PXNSSMCTSA-N 0 3 417.431 4.038 20 0 HIADHN C[C@@H](NCc1cc(Br)c2c(c1)OCCCO2)[C@@H]1OCCc2sccc21 ZINC000492021955 904763409 /nfs/dbraw/zinc/76/34/09/904763409.db2.gz HDNAHICWLRNSDU-XIKOKIGWSA-N 0 3 424.360 4.464 20 0 HIADHN Cc1nc(C)c(CCN[C@H](c2ccc(C)cc2)c2cccc(S(C)(=O)=O)c2)s1 ZINC000492196255 904813853 /nfs/dbraw/zinc/81/38/53/904813853.db2.gz NARCMVFZLVMUIX-JOCHJYFZSA-N 0 3 414.596 4.394 20 0 HIADHN COC(=O)c1scc(-c2ccc(C)cc2)c1NC(=O)N1CCN(C)CC[C@@H]1C ZINC000492287412 904828542 /nfs/dbraw/zinc/82/85/42/904828542.db2.gz DEXQEIBQNJECBE-HNNXBMFYSA-N 0 3 401.532 4.068 20 0 HIADHN CN(C(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F)[C@@H](c1ncc[nH]1)c1ccccc1 ZINC000492468815 904855761 /nfs/dbraw/zinc/85/57/61/904855761.db2.gz WIHZMDSZICHJLG-NHCUHLMSSA-N 0 3 424.495 4.115 20 0 HIADHN Cn1ccnc1COc1ccc(CN2CCC3(CC2)OCCc2ccsc23)cc1 ZINC000492490973 904859453 /nfs/dbraw/zinc/85/94/53/904859453.db2.gz QFJDBZJDKRVUTH-UHFFFAOYSA-N 0 3 409.555 4.125 20 0 HIADHN COc1ccc([C@H](NCCN2C[C@H]3CC[C@@H](C2)O3)c2ccc(C(F)(F)F)cc2)cc1 ZINC000492516431 904863128 /nfs/dbraw/zinc/86/31/28/904863128.db2.gz TXIGPOQOVBAIPF-BHIFYINESA-N 0 3 420.475 4.256 20 0 HIADHN COc1ccc([C@H](N[C@H](C)CN2CCOCC2)c2ccc(C(F)(F)F)cc2)cc1 ZINC000492517446 904864066 /nfs/dbraw/zinc/86/40/66/904864066.db2.gz XLYRYBLRQLXFLH-IIBYNOLFSA-N 0 3 408.464 4.114 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)C[C@H](C)c1c(C)n[nH]c1C ZINC000492594390 904874659 /nfs/dbraw/zinc/87/46/59/904874659.db2.gz ZEZDBTQSKKHNMY-HRAATJIYSA-N 0 3 420.561 4.111 20 0 HIADHN COc1ccc([C@@H](CN[C@@H](C)c2ccccc2Br)N2CCOCC2)cc1 ZINC000492786033 904904484 /nfs/dbraw/zinc/90/44/84/904904484.db2.gz WWPKXUKWQABIFC-HRAATJIYSA-N 0 3 419.363 4.182 20 0 HIADHN COc1ccc(CN2CCC(C(=O)N3CCCC3)CC2)cc1OCc1ccccc1 ZINC000506235269 914856903 /nfs/dbraw/zinc/85/69/03/914856903.db2.gz NCTDSWUVOBLOFM-UHFFFAOYSA-N 0 3 408.542 4.109 20 0 HIADHN OCC[C@@]1(CN[C@H](c2cccc(F)c2)c2cccc(Br)c2)CCOC1 ZINC000493009328 904984845 /nfs/dbraw/zinc/98/48/45/904984845.db2.gz MYQFYARUJFCMHH-PMACEKPBSA-N 0 3 408.311 4.056 20 0 HIADHN CO[C@@H]1C[C@H](N[C@H](c2cccc(S(C)(=O)=O)c2)c2ccc(C)cc2C)C1(C)C ZINC000493009054 904986479 /nfs/dbraw/zinc/98/64/79/904986479.db2.gz MBKJKAAOQUXQIZ-BHDDXSALSA-N 0 3 401.572 4.199 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)CSCc1coc(-c2ccccc2)n1 ZINC000493024470 904990332 /nfs/dbraw/zinc/99/03/32/904990332.db2.gz FGIYTZLRGZNVTG-UHFFFAOYSA-N 0 3 409.555 4.165 20 0 HIADHN Cc1ccc([C@@H](NCC2(CCO)CCCC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000493056815 905004570 /nfs/dbraw/zinc/00/45/70/905004570.db2.gz KZZSNIVYOMBAOS-JOCHJYFZSA-N 0 3 401.572 4.020 20 0 HIADHN O=C(Nc1cccc(-c2nccs2)c1)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000493070322 905008890 /nfs/dbraw/zinc/00/88/90/905008890.db2.gz CHVICTHDBWQXSO-UHFFFAOYSA-N 0 3 407.539 4.267 20 0 HIADHN CO[C@]1(C)C[C@H](N[C@H](c2ccc(C)cc2)c2cccc(S(C)(=O)=O)c2)C1(C)C ZINC000493106533 905022579 /nfs/dbraw/zinc/02/25/79/905022579.db2.gz UYTIMCNOWXHBJX-QZNHQXDQSA-N 0 3 401.572 4.281 20 0 HIADHN CCC[C@@H](CCO)CN[C@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000493177303 905041394 /nfs/dbraw/zinc/04/13/94/905041394.db2.gz PVDKJNLZMQVOGG-HRAATJIYSA-N 0 3 409.979 4.221 20 0 HIADHN Cc1ccc([C@H](NC2CC(OC(C)(C)C)C2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000493245431 905064930 /nfs/dbraw/zinc/06/49/30/905064930.db2.gz BRCJYJFQOXQLQO-AOMIVXANSA-N 0 3 401.572 4.424 20 0 HIADHN Cc1ccc([C@H](NC[C@H](CCO)CC(C)C)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000493254138 905070313 /nfs/dbraw/zinc/07/03/13/905070313.db2.gz ZZRGYMYQDVOGOJ-XXBNENTESA-N 0 3 403.588 4.122 20 0 HIADHN COCCC1(CN[C@@H](c2cccc(S(C)(=O)=O)c2)c2ccc(F)c(F)c2)CCC1 ZINC000493275822 905072004 /nfs/dbraw/zinc/07/20/04/905072004.db2.gz CIHUVNBGWRVVDP-NRFANRHFSA-N 0 3 423.525 4.254 20 0 HIADHN CCc1ccc([C@@H](NCCCNc2ccccn2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000493277463 905075862 /nfs/dbraw/zinc/07/58/62/905075862.db2.gz QXBWVAYDYVSSGW-XMMPIXPASA-N 0 3 423.582 4.229 20 0 HIADHN CC(C)Cn1ncc(C(=O)NC[C@@]2(C)CCCN2Cc2ccccc2)c1C(F)F ZINC000493311238 905084567 /nfs/dbraw/zinc/08/45/67/905084567.db2.gz SFNAOGUUHQLNBH-JOCHJYFZSA-N 0 3 404.505 4.261 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)c3cccc(Oc4ccc(Cl)c(Cl)c4)n3)[C@@H]2C1 ZINC000493345452 905092139 /nfs/dbraw/zinc/09/21/39/905092139.db2.gz XVGYSYXDVCYMAB-SCLBCKFNSA-N 0 3 406.313 4.347 20 0 HIADHN Cc1ccc(-c2cc(C(=O)N3CC[C@@H]4CCN(C)C[C@@H]43)c3cnn(C(C)C)c3n2)s1 ZINC000493412188 905110622 /nfs/dbraw/zinc/11/06/22/905110622.db2.gz VDWBPCHWRBNXCX-JXFKEZNVSA-N 0 3 423.586 4.215 20 0 HIADHN COc1ccc(-c2[nH]c3ccccc3c2CCC(=O)N2CC[C@@H]3CCN(C)C[C@@H]32)cc1 ZINC000493441647 905123393 /nfs/dbraw/zinc/12/33/93/905123393.db2.gz YIWVXJZVHFTMMI-UUOWRZLLSA-N 0 3 417.553 4.329 20 0 HIADHN Cc1cc(-c2cc(C(=O)N3CC[C@H]4CCN(C)C[C@H]43)c3cnn(C(C)C)c3n2)c(C)o1 ZINC000493481807 905138707 /nfs/dbraw/zinc/13/87/07/905138707.db2.gz QRDYSKMUSXUDFQ-VGOFRKELSA-N 0 3 421.545 4.055 20 0 HIADHN COc1cc(-c2nnc(CN[C@@H]3CCC[C@@H]3Cc3ccccc3)o2)cc(OC)c1OC ZINC000493525527 905150338 /nfs/dbraw/zinc/15/03/38/905150338.db2.gz LZTJEWIGSHPRBV-IEBWSBKVSA-N 0 3 423.513 4.263 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)c3ccc(Oc4ccc(C(F)(F)F)cn4)cc3)[C@H]2C1 ZINC000493557999 905160760 /nfs/dbraw/zinc/16/07/60/905160760.db2.gz SNODRDHFBYBPFH-KDOFPFPSSA-N 0 3 405.420 4.059 20 0 HIADHN COc1cccc(COc2cccc(NC(=O)N3CC[C@H]4CCN(C)C[C@@H]43)c2C)c1 ZINC000493920770 905274306 /nfs/dbraw/zinc/27/43/06/905274306.db2.gz RFSKEPOLZACRIF-KNQAVFIVSA-N 0 3 409.530 4.141 20 0 HIADHN O=C(NCc1ccco1)c1cccc(CN[C@H]2CCO[C@@H]2c2ccc(F)c(F)c2)c1 ZINC000493937395 905289680 /nfs/dbraw/zinc/28/96/80/905289680.db2.gz PTJIRILBELFWIA-FCHUYYIVSA-N 0 3 412.436 4.108 20 0 HIADHN Cc1cc(F)ccc1N1CCC[C@H](N[C@H]2CCO[C@H]2c2ccc(F)c(F)c2)C1=O ZINC000493951596 905302081 /nfs/dbraw/zinc/30/20/81/905302081.db2.gz CMYOQCCGEKEABY-ZJOUEHCJSA-N 0 3 404.432 4.028 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)c2ccc(NC(=O)c3cccs3)cc2)CCN1Cc1ccccc1 ZINC000493999112 905342464 /nfs/dbraw/zinc/34/24/64/905342464.db2.gz HECZEJYLVFYJEW-UTKZUKDTSA-N 0 3 419.550 4.393 20 0 HIADHN C[C@@H]1[C@H](NC(=O)c2ccccc2OCc2cscn2)CCN1Cc1ccccc1 ZINC000494006248 905347145 /nfs/dbraw/zinc/34/71/45/905347145.db2.gz HFKPGDCOLROMFT-DYESRHJHSA-N 0 3 407.539 4.115 20 0 HIADHN C[C@H]1[C@H](NC(=O)Cc2nc(-c3ccc(F)cc3)cs2)CCN1Cc1ccccc1 ZINC000494007220 905348873 /nfs/dbraw/zinc/34/88/73/905348873.db2.gz PBXGGITYCKIBRJ-OXJNMPFZSA-N 0 3 409.530 4.271 20 0 HIADHN CC(C)C(=O)NC[C@@H]1CCCN(Cc2cn(Cc3ccccc3)nc2C(C)(C)C)C1 ZINC000512405120 921139523 /nfs/dbraw/zinc/13/95/23/921139523.db2.gz XXZNWTBFCICDPN-NRFANRHFSA-N 0 3 410.606 4.213 20 0 HIADHN C[C@H]1C[C@H](N2CCOCC2)CN1Cc1c(-c2ccc(Cl)cc2)nc2sccn12 ZINC000512408218 921141117 /nfs/dbraw/zinc/14/11/17/921141117.db2.gz CJUUIIOSFZEIIN-YJBOKZPZSA-N 0 3 416.978 4.011 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1nc2c(cccc2Br)s1 ZINC000494038241 905380545 /nfs/dbraw/zinc/38/05/45/905380545.db2.gz KGOCADBBRRAUSE-UHFFFAOYSA-N 0 3 423.336 4.248 20 0 HIADHN C[C@H]1[C@H](NC(=O)c2cc(NC(=O)C(C)(C)C)ccc2F)CCN1Cc1ccccc1 ZINC000494046240 905386273 /nfs/dbraw/zinc/38/62/73/905386273.db2.gz FFHJPOBRBQYVTG-HRAATJIYSA-N 0 3 411.521 4.203 20 0 HIADHN COCc1nc(C(=O)N[C@H]2CCN(Cc3ccccc3)[C@@H]2C)c(-c2ccccc2)s1 ZINC000494051311 905390353 /nfs/dbraw/zinc/39/03/53/905390353.db2.gz UNIUVXOHVDHTDE-XLIONFOSSA-N 0 3 421.566 4.349 20 0 HIADHN C[C@@H]1[C@H](NC(=O)COc2ccc(Oc3ccccn3)cc2)CCN1Cc1ccccc1 ZINC000494060769 905396596 /nfs/dbraw/zinc/39/65/96/905396596.db2.gz QOMCYOFABIOGSW-AUSIDOKSSA-N 0 3 417.509 4.032 20 0 HIADHN CN1CCN(Cc2ccc(CNC(=O)C(C)(C)CCCc3ccccc3)cc2)CC1 ZINC000494076237 905412861 /nfs/dbraw/zinc/41/28/61/905412861.db2.gz YFJHXSYFOSJCDI-UHFFFAOYSA-N 0 3 407.602 4.099 20 0 HIADHN Cc1ccc(C(F)(F)F)cc1NC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1CO ZINC000494109499 905455998 /nfs/dbraw/zinc/45/59/98/905455998.db2.gz UMKGBMIHFKFDRP-IEBWSBKVSA-N 0 3 421.463 4.018 20 0 HIADHN COCCN(CCC(=O)Nc1ccccc1C)Cc1cc(Br)cs1 ZINC000494151798 905489657 /nfs/dbraw/zinc/48/96/57/905489657.db2.gz FKHMSLKBMZODTL-UHFFFAOYSA-N 0 3 411.365 4.296 20 0 HIADHN CSc1cnn(-c2ccccc2)c1NC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000494173589 905510094 /nfs/dbraw/zinc/51/00/94/905510094.db2.gz SJYCBPFMXDAKMZ-HXUWFJFHSA-N 0 3 421.570 4.332 20 0 HIADHN COCCOc1ccccc1CN1CCC[C@@H](CNC(=O)Nc2ccc(C)cc2)C1 ZINC000512426461 921153439 /nfs/dbraw/zinc/15/34/39/921153439.db2.gz GUEQPNMNLNIEDI-FQEVSTJZSA-N 0 3 411.546 4.054 20 0 HIADHN CCNC(=O)COc1ccc(CNCc2ccc(-c3ccccc3)c(C)c2)cc1OC ZINC000494262220 905585923 /nfs/dbraw/zinc/58/59/23/905585923.db2.gz MLKAZFYBFUEJTR-UHFFFAOYSA-N 0 3 418.537 4.475 20 0 HIADHN COCCOc1ccc(CN2CCC[C@@H](CNC(=O)Nc3ccc(C)cc3)C2)cc1 ZINC000512444574 921166579 /nfs/dbraw/zinc/16/65/79/921166579.db2.gz QASHMBAACWPUIX-NRFANRHFSA-N 0 3 411.546 4.054 20 0 HIADHN Cc1ccc(NC(=O)NC[C@@H]2CCCN(Cc3c[nH]nc3-c3cccs3)C2)cc1 ZINC000512445331 921167105 /nfs/dbraw/zinc/16/71/05/921167105.db2.gz ZBFPJHKLKSVXHE-KRWDZBQOSA-N 0 3 409.559 4.480 20 0 HIADHN Cc1ccnc(-c2n[n-]c([C@@H](C)N[C@@H]3C[C@H]4CC[C@@H](C3)[N@H+]4Cc3ccccc3)n2)c1 ZINC000494421865 905708111 /nfs/dbraw/zinc/70/81/11/905708111.db2.gz AKFAQIAWSSAJOV-WLRLJWMZSA-N 0 3 402.546 4.021 20 0 HIADHN Cc1ccnc(-c2n[n-]c([C@@H](C)N[C@@H]3C[C@H]4CC[C@@H](C3)[N@@H+]4Cc3ccccc3)n2)c1 ZINC000494421865 905708125 /nfs/dbraw/zinc/70/81/25/905708125.db2.gz AKFAQIAWSSAJOV-WLRLJWMZSA-N 0 3 402.546 4.021 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2CN2CCC[C@H](CNC(=O)C(C)C)C2)o1 ZINC000512455243 921173297 /nfs/dbraw/zinc/17/32/97/921173297.db2.gz BQWXLICSZWICHY-HXUWFJFHSA-N 0 3 420.557 4.425 20 0 HIADHN Cc1cccc2sc(N(Cc3ccccc3)C(=O)CN[C@@H]3CCO[C@H]3C3CC3)nc21 ZINC000494475808 905757695 /nfs/dbraw/zinc/75/76/95/905757695.db2.gz MXBIFEHHNKTKSQ-XXBNENTESA-N 0 3 421.566 4.295 20 0 HIADHN CO[C@H](c1ccccc1)[C@H](C)NCc1nnc(-c2ccc(Br)cc2)[nH]1 ZINC000494621180 905867004 /nfs/dbraw/zinc/86/70/04/905867004.db2.gz NQWZHSVZUFTFQR-UGSOOPFHSA-N 0 3 401.308 4.100 20 0 HIADHN Cc1cc(NC(=O)Nc2cc(CC(C)C)[nH]n2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000494645058 905880034 /nfs/dbraw/zinc/88/00/34/905880034.db2.gz BUHVVRBGZGUGGI-HXUWFJFHSA-N 0 3 421.549 4.204 20 0 HIADHN COc1ccccc1SC[C@H](C)CNC(=O)N[C@@H](CN(C)C)c1ccc(F)cc1 ZINC000494695572 905903442 /nfs/dbraw/zinc/90/34/42/905903442.db2.gz DPEDIPTVSRZCBH-APWZRJJASA-N 0 3 419.566 4.165 20 0 HIADHN CN(Cc1cccc2[nH]ccc21)C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000494736413 905935743 /nfs/dbraw/zinc/93/57/43/905935743.db2.gz RYPCAXPZDSAKNX-UHFFFAOYSA-N 0 3 408.571 4.423 20 0 HIADHN COc1ccccc1CC(C)(C)C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000494746196 905947145 /nfs/dbraw/zinc/94/71/45/905947145.db2.gz MDBSHSGSSKAWOU-UHFFFAOYSA-N 0 3 412.599 4.494 20 0 HIADHN CCCOc1c(Cl)cc(C(=O)N(CCN(C)C)Cc2cccc(O)c2)cc1OC ZINC000494772445 905969214 /nfs/dbraw/zinc/96/92/14/905969214.db2.gz ZGCGRSMBUCFQNT-UHFFFAOYSA-N 0 3 420.937 4.047 20 0 HIADHN C[C@@H]1CCN(C)CCN1C(=O)NC[C@@H](OCc1ccccc1)c1ccc(Cl)cc1 ZINC000494782594 905981929 /nfs/dbraw/zinc/98/19/29/905981929.db2.gz CEWNWESIADUZIQ-XMSQKQJNSA-N 0 3 415.965 4.334 20 0 HIADHN CC1CCN([C@H](CNC(=O)c2ccc3c(c2)C(C)(C)C(=O)N3)c2cccs2)CC1 ZINC000494784902 905986278 /nfs/dbraw/zinc/98/62/78/905986278.db2.gz MSSBOAKMTKQDJE-LJQANCHMSA-N 0 3 411.571 4.181 20 0 HIADHN Cc1ccc(S(=O)(=O)C[C@H](C)NC2CC(c3ccc(Br)cc3)C2)cc1 ZINC000494789013 905989980 /nfs/dbraw/zinc/98/99/80/905989980.db2.gz XEQFCUQCEIBZSE-DMKPSLHHSA-N 0 3 422.388 4.456 20 0 HIADHN CC(=O)Nc1ccc(Cl)c(C(=O)N(CCN(C)C)Cc2cccc(Cl)c2)c1 ZINC000494840597 906031687 /nfs/dbraw/zinc/03/16/87/906031687.db2.gz RQIYZYUTXDFMBW-UHFFFAOYSA-N 0 3 408.329 4.156 20 0 HIADHN C[C@H]1CN(C2CCOCC2)CCN1C(=O)N[C@H](c1ccc(Cl)cc1)C1CCC1 ZINC000494857028 906040150 /nfs/dbraw/zinc/04/01/50/906040150.db2.gz DJRTWGROEGQQGK-KKSFZXQISA-N 0 3 405.970 4.076 20 0 HIADHN CN(CC(=O)N[C@@H](c1ccccc1)c1ccc2[nH]c(C(F)(F)F)nc2c1)C1CCC1 ZINC000494874179 906055386 /nfs/dbraw/zinc/05/53/86/906055386.db2.gz OAHKMXLSBOEMHI-FQEVSTJZSA-N 0 3 416.447 4.272 20 0 HIADHN CN(CC(=O)N[C@@H](c1ccccc1)c1ccc2nc(C(F)(F)F)[nH]c2c1)C1CCC1 ZINC000494874179 906055403 /nfs/dbraw/zinc/05/54/03/906055403.db2.gz OAHKMXLSBOEMHI-FQEVSTJZSA-N 0 3 416.447 4.272 20 0 HIADHN C[C@@H](NC(=O)N1CCN(C2CCOCC2)C[C@H]1C)c1ccccc1Oc1ccccc1 ZINC000494902893 906078441 /nfs/dbraw/zinc/07/84/41/906078441.db2.gz KKRHZDBMAUYPHQ-WOJBJXKFSA-N 0 3 423.557 4.435 20 0 HIADHN O=C(CN[C@@H](C[C@@H]1CCOC1)c1ccc(F)cc1)Nc1ccc(Br)cc1 ZINC000494905780 906080882 /nfs/dbraw/zinc/08/08/82/906080882.db2.gz FGJRQFLPMCSHGN-LIRRHRJNSA-N 0 3 421.310 4.284 20 0 HIADHN O=C(CN[C@@H](C[C@H]1CCOC1)c1ccc(F)cc1)Nc1ccc(Br)cc1 ZINC000494905779 906081296 /nfs/dbraw/zinc/08/12/96/906081296.db2.gz FGJRQFLPMCSHGN-KUHUBIRLSA-N 0 3 421.310 4.284 20 0 HIADHN O=C(Nc1ccc(Br)cc1)C1CCN(C/C=C/c2ccncc2)CC1 ZINC000494926316 906099876 /nfs/dbraw/zinc/09/98/76/906099876.db2.gz XGEOGAVOYYSXOS-OWOJBTEDSA-N 0 3 400.320 4.208 20 0 HIADHN O=C1CCCCN1C1CCN(Cc2c[nH]nc2-c2ccc(C(F)(F)F)cc2)CC1 ZINC000494934837 906106105 /nfs/dbraw/zinc/10/61/05/906106105.db2.gz WEWKJBUEAAWJNQ-UHFFFAOYSA-N 0 3 406.452 4.072 20 0 HIADHN CC(C)[C@H](C)NC(=O)C1CCN(Cc2c[nH]nc2-c2ccc(C(F)(F)F)cc2)CC1 ZINC000494957969 906128915 /nfs/dbraw/zinc/12/89/15/906128915.db2.gz KUAXJSUJKAGXST-HNNXBMFYSA-N 0 3 422.495 4.468 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCCc1cscn1)c1ccc(C(F)(F)F)cc1 ZINC000494976574 906143174 /nfs/dbraw/zinc/14/31/74/906143174.db2.gz MMULNBISYILUKH-KRWDZBQOSA-N 0 3 414.497 4.087 20 0 HIADHN NC(=O)c1ccc(CN(Cc2c[nH]nc2-c2ccc(C(F)(F)F)cc2)C2CC2)cc1 ZINC000495000381 906162903 /nfs/dbraw/zinc/16/29/03/906162903.db2.gz XGAWZMQNOBIOOG-UHFFFAOYSA-N 0 3 414.431 4.359 20 0 HIADHN COc1ccccc1[C@H](NC(=O)N[C@@H]1C[C@@H](C)N(Cc2ccccc2)C1)c1ccco1 ZINC000495009099 906169827 /nfs/dbraw/zinc/16/98/27/906169827.db2.gz TUBNSMBYBQYSMY-FPGHNAPASA-N 0 3 419.525 4.340 20 0 HIADHN CC(C)C(=O)NCCCN[C@H](c1ccc(Br)cc1)c1ccccc1F ZINC000495025064 906183100 /nfs/dbraw/zinc/18/31/00/906183100.db2.gz GMTUYWAHBBVEEG-LJQANCHMSA-N 0 3 407.327 4.430 20 0 HIADHN CNC(=O)[C@@H]1CCC[C@@H]1N[C@@H](c1cccc(F)c1)c1cccc(Br)c1 ZINC000495049100 906203559 /nfs/dbraw/zinc/20/35/59/906203559.db2.gz OGNSCBYEALIHRM-CEXWTWQISA-N 0 3 405.311 4.182 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N[C@H](C)c2nc(C(F)(F)F)cs2)N(C)C)cc1 ZINC000495178464 906288628 /nfs/dbraw/zinc/28/86/28/906288628.db2.gz QMRHXKHOLOKIBX-TZMCWYRMSA-N 0 3 400.470 4.133 20 0 HIADHN CC(C)Nc1ccc(C(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)cn1 ZINC000495247997 906337260 /nfs/dbraw/zinc/33/72/60/906337260.db2.gz OHQBBXDGIYGUAP-UHFFFAOYSA-N 0 3 408.468 4.125 20 0 HIADHN CC[C@H](CNC(=O)c1ccc(OCC(F)(F)F)cc1)N1CCc2ccccc2C1 ZINC000495345211 906391330 /nfs/dbraw/zinc/39/13/30/906391330.db2.gz LPHWFPBWQABDJF-LJQANCHMSA-N 0 3 406.448 4.194 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)Cc2cscc2Br)cc1 ZINC000495345268 906391446 /nfs/dbraw/zinc/39/14/46/906391446.db2.gz NCVDYYMKINGJBT-SFHVURJKSA-N 0 3 423.376 4.015 20 0 HIADHN Cc1nc([C@H]2CCCOC2)sc1C(=O)NCCN1CCC2(CCCCC2)CC1 ZINC000512556900 921234299 /nfs/dbraw/zinc/23/42/99/921234299.db2.gz IHTKXSCPTFBIES-SFHVURJKSA-N 0 3 405.608 4.122 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)NCC(=O)Nc2cccc(Br)c2)cc1 ZINC000495397130 906426735 /nfs/dbraw/zinc/42/67/35/906426735.db2.gz UDPWZMMCIMTDBC-AWEZNQCLSA-N 0 3 413.319 4.233 20 0 HIADHN CC(=O)NCCc1ccc([C@H](C)N[C@@H](C)c2c(C)nn(CC(F)(F)F)c2C)cc1 ZINC000495421939 906443170 /nfs/dbraw/zinc/44/31/70/906443170.db2.gz WQPQFWYNNQLHOP-KBPBESRZSA-N 0 3 410.484 4.153 20 0 HIADHN CS[C@H]1CN(C(=O)c2csc(-c3ccc(Cl)c(Cl)c3)n2)C[C@@H]1N(C)C ZINC000495681352 906523944 /nfs/dbraw/zinc/52/39/44/906523944.db2.gz GTVCFWXIBUPXRD-GJZGRUSLSA-N 0 3 416.399 4.235 20 0 HIADHN c1nc(-c2ccccn2)sc1CN1CCC(c2nc(-c3ccccc3)n[nH]2)CC1 ZINC000512572091 921244057 /nfs/dbraw/zinc/24/40/57/921244057.db2.gz DZAGASVIJMLWTA-UHFFFAOYSA-N 0 3 402.527 4.370 20 0 HIADHN CC(C)N(CCN(C)C)C(=O)c1cc(-c2ccc(F)cc2)nc2onc(C3CC3)c21 ZINC000495937692 906580789 /nfs/dbraw/zinc/58/07/89/906580789.db2.gz RUKWWBWYKBYSRY-UHFFFAOYSA-N 0 3 410.493 4.319 20 0 HIADHN CC(C)N(CCN(C)C)C(=O)Cc1csc(-c2ccc(Cl)cc2Cl)n1 ZINC000495954194 906586219 /nfs/dbraw/zinc/58/62/19/906586219.db2.gz OXDGQPFTLKJYLO-UHFFFAOYSA-N 0 3 400.375 4.458 20 0 HIADHN Cc1nc(CCC(=O)N(CCN(C)C)C(C)C)oc1-c1ccc(Br)cc1 ZINC000495980853 906591206 /nfs/dbraw/zinc/59/12/06/906591206.db2.gz GYBZMLLFIMPWTE-UHFFFAOYSA-N 0 3 422.367 4.144 20 0 HIADHN COc1ccc(CN2CCC(C(=O)N[C@@H](C)C(C)C)CC2)cc1OCCC(C)C ZINC000512588984 921251610 /nfs/dbraw/zinc/25/16/10/921251610.db2.gz ZZGPVYLIOJVLGX-IBGZPJMESA-N 0 3 404.595 4.493 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)c1cc(-c2ccc(Cl)cc2)n[nH]1 ZINC000496223729 906632400 /nfs/dbraw/zinc/63/24/00/906632400.db2.gz DAFSASBGYCTBCO-HXUWFJFHSA-N 0 3 423.948 4.252 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)c1csc(-c2ccc(F)cc2)n1 ZINC000496224888 906632789 /nfs/dbraw/zinc/63/27/89/906632789.db2.gz IUMKEKQKCGVYLW-UHFFFAOYSA-N 0 3 401.482 4.292 20 0 HIADHN CCc1ccc(C(=O)CCC(=O)N(Cc2ccncc2)C[C@@H]2CCCN2CC)cc1 ZINC000496247502 906638526 /nfs/dbraw/zinc/63/85/26/906638526.db2.gz WQJIAFULPVKPGZ-QHCPKHFHSA-N 0 3 407.558 4.120 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)c1cc(-c2ccccc2Cl)n[nH]1 ZINC000496336309 906661364 /nfs/dbraw/zinc/66/13/64/906661364.db2.gz BRGUANPJTPOLJM-UHFFFAOYSA-N 0 3 400.885 4.073 20 0 HIADHN O=C(Nc1ccc(O)cc1)C1CCN(Cc2cccc(OCc3ccccn3)c2)CC1 ZINC000512604253 921257058 /nfs/dbraw/zinc/25/70/58/921257058.db2.gz HIHYENOGVPJANT-UHFFFAOYSA-N 0 3 417.509 4.217 20 0 HIADHN CN(Cc1cc(Br)ccc1OCc1ccccn1)C[C@@H]1CCCC[C@@H]1O ZINC000497094995 906803561 /nfs/dbraw/zinc/80/35/61/906803561.db2.gz FQRNOZFGMKFQOJ-JXFKEZNVSA-N 0 3 419.363 4.406 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)CCOc2cccc(Cl)c2Cl)CC1 ZINC000497353294 906847808 /nfs/dbraw/zinc/84/78/08/906847808.db2.gz DBRVEBQPLGPVFH-UHFFFAOYSA-N 0 3 411.329 4.478 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)CCc2ncc(-c3ccccc3F)o2)CC1 ZINC000497356255 906849195 /nfs/dbraw/zinc/84/91/95/906849195.db2.gz UDKCNSXGWBZBOP-UHFFFAOYSA-N 0 3 411.477 4.129 20 0 HIADHN COc1cc([C@H](C)NC(=O)N2CC[C@@H]3CCN(C)C[C@H]32)ccc1OCc1ccccc1 ZINC000497375718 906864345 /nfs/dbraw/zinc/86/43/45/906864345.db2.gz CABYOJXXVAOOCK-RCZSKKKRSA-N 0 3 423.557 4.071 20 0 HIADHN CS(=O)(=O)N(CC(F)(F)F)C1CCN(C2c3ccccc3-c3ccccc32)CC1 ZINC000497444430 906919283 /nfs/dbraw/zinc/91/92/83/906919283.db2.gz QZRVSMQFQNZTTG-UHFFFAOYSA-N 0 3 424.488 4.045 20 0 HIADHN Cc1cc(NC(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)c(F)cc1Br ZINC000497446598 906920788 /nfs/dbraw/zinc/92/07/88/906920788.db2.gz YUMMJZFFOXASIX-FUHWJXTLSA-N 0 3 406.299 4.464 20 0 HIADHN CCC[C@@H](C)NC(=O)[C@H]1CCCN(Cc2cccc(C(=O)Nc3ccccc3)c2)C1 ZINC000497448286 906922578 /nfs/dbraw/zinc/92/25/78/906922578.db2.gz YJDWDRXVTLGUEI-KNQAVFIVSA-N 0 3 407.558 4.456 20 0 HIADHN COc1cc(CN2CCC(C(=O)NCc3ccc(C)cc3)CC2)ccc1OC(C)C ZINC000512663753 921280239 /nfs/dbraw/zinc/28/02/39/921280239.db2.gz PUYNSVNMROQPDM-UHFFFAOYSA-N 0 3 410.558 4.319 20 0 HIADHN COc1ccc(CNC(=O)C2CCN(Cc3ccc(OC(F)(F)F)cc3)CC2)cc1 ZINC000512668717 921282258 /nfs/dbraw/zinc/28/22/58/921282258.db2.gz NFWSHVGKLXJHJI-UHFFFAOYSA-N 0 3 422.447 4.122 20 0 HIADHN Cc1nn(C)c(N2CCOCC2)c1CN1CCC(c2cccc3ccccc32)CC1 ZINC000512685865 921287419 /nfs/dbraw/zinc/28/74/19/921287419.db2.gz DWVQBIHNLQVJQM-UHFFFAOYSA-N 0 3 404.558 4.098 20 0 HIADHN O[C@H](COc1cc(Cl)ccc1Cl)CN(Cc1cccs1)C[C@@H]1CCCO1 ZINC000497593370 907074711 /nfs/dbraw/zinc/07/47/11/907074711.db2.gz AQGWGJDUQTVZFY-HOTGVXAUSA-N 0 3 416.370 4.476 20 0 HIADHN CC(C)(C)[C@@H](CN1CCc2ccccc2C1)NC(=O)N1CCC2(CCOCC2)CC1 ZINC000497617058 907094390 /nfs/dbraw/zinc/09/43/90/907094390.db2.gz NYAUSGFCUUMYBW-JOCHJYFZSA-N 0 3 413.606 4.062 20 0 HIADHN CCOc1cc(C[NH2+]C[C@H](c2ccccc2OC)N2CCCC2)cc(Cl)c1[O-] ZINC000497704506 907207891 /nfs/dbraw/zinc/20/78/91/907207891.db2.gz IFOZQYORJIQOMI-LJQANCHMSA-N 0 3 404.938 4.380 20 0 HIADHN Cc1nc(C(C)(C)NCC2(CNC(C)(C)c3nc(C)c(C)s3)COC2)sc1C ZINC000497846957 907326000 /nfs/dbraw/zinc/32/60/00/907326000.db2.gz MDNGOQLKJJEOCN-UHFFFAOYSA-N 0 3 422.664 4.199 20 0 HIADHN Cc1ccc(-c2nc(CC(=O)NC[C@H](C(C)C)N3CCc4ccccc4C3)cs2)o1 ZINC000512810515 921316533 /nfs/dbraw/zinc/31/65/33/921316533.db2.gz SFTITAARDAPGTD-OAQYLSRUSA-N 0 3 423.582 4.453 20 0 HIADHN C[C@@H]1CCC[C@@H](C)N1C(=O)COc1ccc(C(=O)Nc2cccc(CN(C)C)c2)cc1 ZINC000497936220 907400002 /nfs/dbraw/zinc/40/00/02/907400002.db2.gz RPFSJAMKCSJKBI-RTBURBONSA-N 0 3 423.557 4.169 20 0 HIADHN CCN(C(=O)c1cnn(Cc2ccccc2)c1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000497950114 907418989 /nfs/dbraw/zinc/41/89/89/907418989.db2.gz HCPYFSINQHXHAD-RDPSFJRHSA-N 0 3 402.542 4.229 20 0 HIADHN COc1ccc([C@H](CNC(=O)CCc2ccc(OC(F)F)cc2)N2CCCC2)cc1 ZINC000497984589 907463070 /nfs/dbraw/zinc/46/30/70/907463070.db2.gz PTOWRWGERHHBKQ-NRFANRHFSA-N 0 3 418.484 4.183 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)c1ccc(-c2noc(C(F)F)n2)cc1 ZINC000498002079 907487144 /nfs/dbraw/zinc/48/71/44/907487144.db2.gz UAXOLHAEPZJBRW-SFHVURJKSA-N 0 3 412.440 4.069 20 0 HIADHN CCN(C(=O)CSCc1c(C)noc1C)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000498004707 907489542 /nfs/dbraw/zinc/48/95/42/907489542.db2.gz PMVIDYAUHCWNTC-PXNSSMCTSA-N 0 3 401.576 4.209 20 0 HIADHN CCN(C(=O)c1cccc(CN2CCCC2=O)c1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000498021269 907519003 /nfs/dbraw/zinc/51/90/03/907519003.db2.gz CLWFYANBVLUHMX-GBXCKJPGSA-N 0 3 419.569 4.107 20 0 HIADHN C[C@H](SCC(=O)N(CCN(C)C)Cc1ccc(F)cc1)c1nc2ccccc2[nH]1 ZINC000498125102 907641063 /nfs/dbraw/zinc/64/10/63/907641063.db2.gz FNIZPGSCESHPGT-INIZCTEOSA-N 0 3 414.550 4.087 20 0 HIADHN CN(C)CCN(C(=O)C1CCN(C(=O)c2cccc3ccccc32)CC1)C1CCCC1 ZINC000498469245 907938506 /nfs/dbraw/zinc/93/85/06/907938506.db2.gz WCRBMDLZHIADOW-UHFFFAOYSA-N 0 3 421.585 4.025 20 0 HIADHN C[C@H](NCc1ccc(-c2cccc(Br)c2)s1)C1(S(C)(=O)=O)CC1 ZINC000512875105 921373053 /nfs/dbraw/zinc/37/30/53/921373053.db2.gz YWGSUCNYGXWSGT-LBPRGKRZSA-N 0 3 414.390 4.233 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1CCN(Cc2ccccc2)[C@H]1C)c1nc(C2CCCCC2)no1 ZINC000498705022 908129138 /nfs/dbraw/zinc/12/91/38/908129138.db2.gz CDCOFXURSSMVIM-ABSDTBQOSA-N 0 3 411.550 4.141 20 0 HIADHN COc1cccc(-c2nn(-c3ccc(C)cc3)cc2C(=O)N2CCN(C)CC[C@@H]2C)c1 ZINC000498707292 908132566 /nfs/dbraw/zinc/13/25/66/908132566.db2.gz NJGQRBMAKVIPHB-IBGZPJMESA-N 0 3 418.541 4.023 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@@H]2CNC(=O)N[C@@H](CN(C)C)c2ccc(F)cc2)cc1 ZINC000498724083 908149842 /nfs/dbraw/zinc/14/98/42/908149842.db2.gz ZJXHHSIPEIUWDU-PUHATCMVSA-N 0 3 413.537 4.204 20 0 HIADHN Cc1ccc(-c2nn(-c3ccc(F)cc3)cc2C(=O)N2CCN(C)CC[C@@H]2C)cc1 ZINC000498730005 908158390 /nfs/dbraw/zinc/15/83/90/908158390.db2.gz XJSQYURMORBZHK-SFHVURJKSA-N 0 3 406.505 4.153 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)N2CCC[C@@H](c3nccs3)C2)N(C)C)cc1 ZINC000512902696 921394574 /nfs/dbraw/zinc/39/45/74/921394574.db2.gz QXDGGBWAIYZRLV-QUCCMNQESA-N 0 3 416.591 4.122 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)N2CCCC[C@H]2c2cccn2C)N(C)C)cc1 ZINC000512902682 921394710 /nfs/dbraw/zinc/39/47/10/921394710.db2.gz QUMQSDGSBNUQKS-XZOQPEGZSA-N 0 3 412.578 4.352 20 0 HIADHN CC(C)c1cccc(NC(=O)N2CCC[C@@H](CN3CCN(c4ccccn4)CC3)C2)c1 ZINC000498859226 908262474 /nfs/dbraw/zinc/26/24/74/908262474.db2.gz WIAVNCHVLYRYMB-NRFANRHFSA-N 0 3 421.589 4.271 20 0 HIADHN CC(=O)CCc1ccc(O[C@H](C)C(=O)NC[C@@H]2CCCCN2Cc2ccccc2)cc1 ZINC000498919830 908330472 /nfs/dbraw/zinc/33/04/72/908330472.db2.gz VHLQRHJDZPSDFZ-QPPBQGQZSA-N 0 3 422.569 4.146 20 0 HIADHN Cc1cc(C(=O)[C@H](C)N2CCC[C@H](c3nc(C4CC4)n[nH]3)C2)c(C)n1Cc1ccco1 ZINC000498928979 908337413 /nfs/dbraw/zinc/33/74/13/908337413.db2.gz LSEWYXOVYDYFGS-HKUYNNGSSA-N 0 3 421.545 4.193 20 0 HIADHN Cc1cc(C(=O)[C@H](C)N2CCC[C@H](c3n[nH]c(C4CC4)n3)C2)c(C)n1Cc1ccco1 ZINC000498928979 908337428 /nfs/dbraw/zinc/33/74/28/908337428.db2.gz LSEWYXOVYDYFGS-HKUYNNGSSA-N 0 3 421.545 4.193 20 0 HIADHN CCN1C[C@@H](C)N(Cc2csc(N(C(C)=O)c3ccc(C)cc3C)n2)C[C@H]1C ZINC000498928541 908338212 /nfs/dbraw/zinc/33/82/12/908338212.db2.gz YDIQJFMUWRBDCD-QZTJIDSGSA-N 0 3 400.592 4.359 20 0 HIADHN CCN1C[C@@H](C)N(Cc2csc(N(C(C)=O)c3cccc(Cl)c3)n2)C[C@H]1C ZINC000498928609 908338793 /nfs/dbraw/zinc/33/87/93/908338793.db2.gz ZEKXLRXXKVLPOH-HUUCEWRRSA-N 0 3 406.983 4.396 20 0 HIADHN Cc1cncc(CCC(=O)N[C@@H](c2ccc(F)c(F)c2)C(C)(C)N2CCCC2)c1 ZINC000498934161 908341453 /nfs/dbraw/zinc/34/14/53/908341453.db2.gz IDNMVDQFBBLSIL-QFIPXVFZSA-N 0 3 401.501 4.333 20 0 HIADHN CCN1C[C@H](C)N(Cc2csc(N(C(C)=O)c3ccc(C)c(C)c3)n2)C[C@H]1C ZINC000498939562 908346164 /nfs/dbraw/zinc/34/61/64/908346164.db2.gz WATMLRRGRGXKHJ-MSOLQXFVSA-N 0 3 400.592 4.359 20 0 HIADHN Cc1cccc([C@@H](NC(=O)N(Cc2ccco2)C2CCN(C)CC2)c2ccccn2)c1 ZINC000499012539 908388502 /nfs/dbraw/zinc/38/85/02/908388502.db2.gz VUGKFPDQELHHMG-XMMPIXPASA-N 0 3 418.541 4.378 20 0 HIADHN Cc1cccc([C@@H](NC(=O)N[C@H]2CCN(Cc3ccccc3)C2)c2ccccn2)c1 ZINC000499013370 908388656 /nfs/dbraw/zinc/38/86/56/908388656.db2.gz LSRXPOUVIKVBDD-LADGPHEKSA-N 0 3 400.526 4.053 20 0 HIADHN CC(C)(C)c1nc(CCNC(=O)NC[C@@H](c2cccs2)N2CCCC2)cs1 ZINC000499092978 908455452 /nfs/dbraw/zinc/45/54/52/908455452.db2.gz WAECEOWMJQQZBI-INIZCTEOSA-N 0 3 406.621 4.181 20 0 HIADHN Cc1nc(COc2cccc(C(=O)NC[C@H](c3ccc(C)cc3)N(C)C)c2)cs1 ZINC000499145840 908502966 /nfs/dbraw/zinc/50/29/66/908502966.db2.gz YRMVGOPWJMEABA-JOCHJYFZSA-N 0 3 409.555 4.372 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N[C@H](C)c1ccc(-n2ccnc2C)cc1)c1ccco1 ZINC000499326355 908701797 /nfs/dbraw/zinc/70/17/97/908701797.db2.gz FEZUECWNBRDAEO-CSODHUTKSA-N 0 3 409.534 4.263 20 0 HIADHN CCOC(=O)c1c2c(sc1NC(=O)c1cnc(C)s1)C(C)(C)NC(C)(C)C2 ZINC000499331079 908705840 /nfs/dbraw/zinc/70/58/40/908705840.db2.gz XGGPWRUKZTVYRP-UHFFFAOYSA-N 0 3 407.561 4.101 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)NCCc1csc(-c2ccccc2)n1)c1ccco1 ZINC000499333572 908708101 /nfs/dbraw/zinc/70/81/01/908708101.db2.gz FPAZMUUYGSENSW-APWZRJJASA-N 0 3 412.559 4.374 20 0 HIADHN O=C(NCc1cccc(OCC(F)(F)F)c1)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000499491462 908815963 /nfs/dbraw/zinc/81/59/63/908815963.db2.gz IUIXPYVZLKQAOX-FQEVSTJZSA-N 0 3 421.463 4.264 20 0 HIADHN COc1ccc(NC(=O)C2(NCc3cnc4ccccc4c3)CCCC2)cc1OC ZINC000499556193 908838779 /nfs/dbraw/zinc/83/87/79/908838779.db2.gz ZGOUIEDIXDPBLI-UHFFFAOYSA-N 0 3 405.498 4.293 20 0 HIADHN CC[C@@H]1CCCCN1CCNC(=O)c1sc(NC(=O)c2cccc(F)c2)cc1C ZINC000499722883 908890373 /nfs/dbraw/zinc/89/03/73/908890373.db2.gz NBXYIINMFWEJNG-GOSISDBHSA-N 0 3 417.550 4.442 20 0 HIADHN CN(C)CCN(C[C@@H]1CCCO1)C(=O)c1cccc(OCc2cccc(Cl)c2)c1 ZINC000499895897 909019212 /nfs/dbraw/zinc/01/92/12/909019212.db2.gz PIRBENQTPCURAZ-QFIPXVFZSA-N 0 3 416.949 4.102 20 0 HIADHN Fc1ccc(-c2noc([C@H]3CCCN(Cc4ccc(N5CCCC5)nc4)C3)n2)cc1 ZINC000513035332 921492987 /nfs/dbraw/zinc/49/29/87/921492987.db2.gz GMDQDHGYCUGBIY-IBGZPJMESA-N 0 3 407.493 4.251 20 0 HIADHN Fc1ccc(-c2noc([C@@H]3CCCN(Cc4ccc(N5CCCC5)nc4)C3)n2)cc1 ZINC000513035333 921493353 /nfs/dbraw/zinc/49/33/53/921493353.db2.gz GMDQDHGYCUGBIY-LJQANCHMSA-N 0 3 407.493 4.251 20 0 HIADHN CCN(C(=O)c1cc(C)n(-c2ccccc2)n1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000499998900 909450406 /nfs/dbraw/zinc/45/04/06/909450406.db2.gz HIHOXHSZUUYQGO-NFBKMPQASA-N 0 3 402.542 4.478 20 0 HIADHN CCCCCOc1ccc(C(=O)N(C)C2CCN(CCc3ccccn3)CC2)cc1 ZINC000500013658 909468611 /nfs/dbraw/zinc/46/86/11/909468611.db2.gz YFMQPWIJHGGZJQ-UHFFFAOYSA-N 0 3 409.574 4.430 20 0 HIADHN CCc1nnc(NC(=O)[C@H](C)[C@H](C)NCc2cc(C)c(C)cc2OC(F)F)s1 ZINC000513046131 921504626 /nfs/dbraw/zinc/50/46/26/921504626.db2.gz JJVINOGMCUHPIL-OLZOCXBDSA-N 0 3 412.506 4.072 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NC3CC(C)(c4ccccc4)C3)c(C)c2)CC1 ZINC000500096670 909574981 /nfs/dbraw/zinc/57/49/81/909574981.db2.gz JEYJOGKEFMKFAG-UHFFFAOYSA-N 0 3 406.574 4.379 20 0 HIADHN Cc1noc(C)c1[C@@H](C)CNC(=O)NC[C@H](c1ccc(CC(C)C)cc1)N(C)C ZINC000500101912 909582095 /nfs/dbraw/zinc/58/20/95/909582095.db2.gz JIXWTWWZKMKMJP-HRAATJIYSA-N 0 3 400.567 4.196 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N[C@@H](c1ccco1)c1ccccc1OC)c1ccco1 ZINC000500181770 909677698 /nfs/dbraw/zinc/67/76/98/909677698.db2.gz KFAGMRNPCXUWHP-AQOAWAETSA-N 0 3 411.502 4.399 20 0 HIADHN Cc1nn(-c2ccccc2)c(Oc2ccc(F)cc2)c1CNCCCNC(=O)C(C)C ZINC000500246697 909736734 /nfs/dbraw/zinc/73/67/34/909736734.db2.gz WGIBRSVCVYPTTQ-UHFFFAOYSA-N 0 3 424.520 4.364 20 0 HIADHN COc1cc(CN[C@@H]2CCCc3cc(F)ccc32)ccc1OCC(=O)N1CCCC1 ZINC000500252711 909739925 /nfs/dbraw/zinc/73/99/25/909739925.db2.gz VHFSGQJFEOXOSB-OAQYLSRUSA-N 0 3 412.505 4.003 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCCc1nc2c(cccc2C)o1)c1ccsc1 ZINC000500265085 909746358 /nfs/dbraw/zinc/74/63/58/909746358.db2.gz XAJUMFLUWZEXFM-QGZVFWFLSA-N 0 3 400.548 4.123 20 0 HIADHN Fc1ccc(Br)c(F)c1CNCCCCn1cc(Br)cn1 ZINC000500381638 909826770 /nfs/dbraw/zinc/82/67/70/909826770.db2.gz FWBAYRRHEUTMNA-UHFFFAOYSA-N 0 3 423.099 4.256 20 0 HIADHN CC(C)Oc1ccc([C@@H](C)NC(=O)NCC2(N3CCSCC3)CCCC2)cc1 ZINC000500391512 909830561 /nfs/dbraw/zinc/83/05/61/909830561.db2.gz FVPKPOGRKMKZTH-GOSISDBHSA-N 0 3 405.608 4.196 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)c2ccc(C)cc2Br)cc1 ZINC000500404647 909837926 /nfs/dbraw/zinc/83/79/26/909837926.db2.gz AOSFTVHXORWGHK-HXUWFJFHSA-N 0 3 417.347 4.333 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)c2cc(C)ccc2Br)cc1 ZINC000500405575 909838077 /nfs/dbraw/zinc/83/80/77/909838077.db2.gz CNHKSCLYPQKDSN-FQEVSTJZSA-N 0 3 417.347 4.333 20 0 HIADHN O=C1[C@H](N2CCN(CC3CCCCC3)CC2)CCN1c1ccc(C(F)(F)F)cc1 ZINC000500422473 909846955 /nfs/dbraw/zinc/84/69/55/909846955.db2.gz POJUQAZYSIWADU-HXUWFJFHSA-N 0 3 409.496 4.009 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)Cc2ccc(Br)s2)cc1 ZINC000500430418 909851113 /nfs/dbraw/zinc/85/11/13/909851113.db2.gz HAGFYVCKDMYTLV-QGZVFWFLSA-N 0 3 423.376 4.015 20 0 HIADHN Clc1cc(CNCc2c[nH]nc2-c2cccnc2)ccc1I ZINC000500448539 909865367 /nfs/dbraw/zinc/86/53/67/909865367.db2.gz VWVGHSMOXLJUCG-UHFFFAOYSA-N 0 3 424.673 4.020 20 0 HIADHN CC(C)N1CCC[C@H](NC(=O)C(C)(C)c2csc(-c3c(F)cccc3F)n2)C1 ZINC000500490697 909887629 /nfs/dbraw/zinc/88/76/29/909887629.db2.gz WXRCOJQPKBXFRS-AWEZNQCLSA-N 0 3 407.530 4.355 20 0 HIADHN C[NH+](C)CCn1ncc(C(=O)Nc2ccc([O-])c(C(F)(F)F)c2)c1-c1ccccc1 ZINC000500528912 909909569 /nfs/dbraw/zinc/90/95/69/909909569.db2.gz USZYTKVZVBWXQZ-UHFFFAOYSA-N 0 3 418.419 4.088 20 0 HIADHN CC[C@@H](NC(=O)NCc1ccc(CN2CCN(CC)CC2)cc1)c1ccc(C)cc1 ZINC000500625056 909974938 /nfs/dbraw/zinc/97/49/38/909974938.db2.gz CLUNACLBZLCHHZ-XMMPIXPASA-N 0 3 408.590 4.083 20 0 HIADHN Cc1ccccc1[C@H]([C@H](C)NC(=O)C(=O)Nc1cc(C(F)F)ccc1Cl)N(C)C ZINC000500626210 909976554 /nfs/dbraw/zinc/97/65/54/909976554.db2.gz SAROIDBSFVJGNA-UGSOOPFHSA-N 0 3 423.891 4.332 20 0 HIADHN Cc1c(C(=O)N(CC(C)C)C2CCN(C)CC2)cnn1-c1cccc(C(F)(F)F)c1 ZINC000500676804 910013644 /nfs/dbraw/zinc/01/36/44/910013644.db2.gz INWIZWDXAVWLGU-UHFFFAOYSA-N 0 3 422.495 4.392 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)CCOc1ccccc1-c1ccccc1 ZINC000500749614 910060161 /nfs/dbraw/zinc/06/01/61/910060161.db2.gz LZOQTEPVHFRLNT-UHFFFAOYSA-N 0 3 403.526 4.108 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)Cc1csc(-c2ccc(Cl)s2)n1 ZINC000500794681 910083663 /nfs/dbraw/zinc/08/36/63/910083663.db2.gz LGYXAQRLHBDANT-UHFFFAOYSA-N 0 3 420.991 4.053 20 0 HIADHN CCCOc1ccc(-c2nc(C(=O)N(CCN(C)C)Cc3ccccn3)cs2)cc1 ZINC000500796238 910086405 /nfs/dbraw/zinc/08/64/05/910086405.db2.gz QCEGVMWKXVRMRF-UHFFFAOYSA-N 0 3 424.570 4.198 20 0 HIADHN CC(C)(COCc1ccccc1)NCC(=O)Nc1ccc2c(c1)OC1(CCCC1)O2 ZINC000500817836 910099091 /nfs/dbraw/zinc/09/90/91/910099091.db2.gz UCXFLWMXZIMEPI-UHFFFAOYSA-N 0 3 410.514 4.252 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)c2cc(C3CC3)nn2-c2ccccc2)C1 ZINC000500845669 910120426 /nfs/dbraw/zinc/12/04/26/910120426.db2.gz XDUJSLJZVWGZIA-GHTZIAJQSA-N 0 3 400.526 4.315 20 0 HIADHN Cc1cccc([C@H](NC(=O)N[C@H]2CCN(Cc3ccccc3)[C@@H]2C)c2ccccn2)c1 ZINC000501090090 910289473 /nfs/dbraw/zinc/28/94/73/910289473.db2.gz RQRJDKPZQVKDAE-PBXXJUDPSA-N 0 3 414.553 4.442 20 0 HIADHN CCCOc1ccc(CN2CCC3(C[C@H]3C(=O)N3CCCCC3)CC2)cc1OCC ZINC000501135713 910315380 /nfs/dbraw/zinc/31/53/80/910315380.db2.gz SURWQYKNFNMFAU-NRFANRHFSA-N 0 3 414.590 4.489 20 0 HIADHN CCNC(=O)c1ccc(C)c(NC(=O)NC[C@@H](c2ccsc2)N(CC)CC)c1 ZINC000501168327 910337084 /nfs/dbraw/zinc/33/70/84/910337084.db2.gz XPIJNBRDIDBTHJ-IBGZPJMESA-N 0 3 402.564 4.011 20 0 HIADHN CCOc1ccc(C(=O)CCC(=O)N[C@H]2CCN(Cc3ccccc3)CC2(C)C)cc1 ZINC000513125561 921568755 /nfs/dbraw/zinc/56/87/55/921568755.db2.gz HCAONMNDYCXMMG-DEOSSOPVSA-N 0 3 422.569 4.465 20 0 HIADHN CN(C)CCN(CC1CCCCC1)C(=O)c1cccc(OCc2cscn2)c1 ZINC000501232136 910389453 /nfs/dbraw/zinc/38/94/53/910389453.db2.gz WOQAYQKMIMJWMV-UHFFFAOYSA-N 0 3 401.576 4.306 20 0 HIADHN Cc1cccc2sc(N(Cc3ccccc3)C(=O)CN[C@H](C)Cn3cccn3)nc21 ZINC000501282366 910444961 /nfs/dbraw/zinc/44/49/61/910444961.db2.gz XOEFRPWRCZLZRN-GOSISDBHSA-N 0 3 419.554 4.013 20 0 HIADHN Cc1ccccc1C(=O)NC1CCN(CCOc2ccc(C(F)(F)F)cc2)CC1 ZINC000501300472 910455282 /nfs/dbraw/zinc/45/52/82/910455282.db2.gz KHOXXCCDPARIDA-UHFFFAOYSA-N 0 3 406.448 4.287 20 0 HIADHN CC[C@H](CNC(=O)N1CCc2[nH]c3ccccc3c2C1)N1CCc2ccccc2C1 ZINC000501326420 910471286 /nfs/dbraw/zinc/47/12/86/910471286.db2.gz JUSLKISIASVUBG-HXUWFJFHSA-N 0 3 402.542 4.073 20 0 HIADHN CC[C@H](CNC(=O)N1CCC[C@H]1c1ccc(OC)cc1)N1CCc2ccccc2C1 ZINC000501378833 910506594 /nfs/dbraw/zinc/50/65/94/910506594.db2.gz SPELEEYTRKDYEA-VWNXMTODSA-N 0 3 407.558 4.379 20 0 HIADHN CC[C@@H](CNC(=O)N(C)Cc1ccc(OC(F)F)cc1)N1CCc2ccccc2C1 ZINC000501389885 910521852 /nfs/dbraw/zinc/52/18/52/910521852.db2.gz QLOATCGPUHDHSN-FQEVSTJZSA-N 0 3 417.500 4.266 20 0 HIADHN C[C@@H](NCC(c1ccc(F)cc1)c1ccc(F)cc1)c1nnnn1-c1ccccc1 ZINC000501432017 910563435 /nfs/dbraw/zinc/56/34/35/910563435.db2.gz CJOMQODYBBNLRM-MRXNPFEDSA-N 0 3 405.452 4.423 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)N[C@@H]2CCCOc3c(Cl)cccc32)cc1 ZINC000501546255 910647827 /nfs/dbraw/zinc/64/78/27/910647827.db2.gz XREDDAVOXAHTIN-WOJBJXKFSA-N 0 3 417.937 4.164 20 0 HIADHN CCCn1nccc1C1CCN(C[C@H](O)COc2cc(Cl)ccc2Cl)CC1 ZINC000501562081 910670196 /nfs/dbraw/zinc/67/01/96/910670196.db2.gz VHUJBUYJPKQZAR-KRWDZBQOSA-N 0 3 412.361 4.219 20 0 HIADHN C[C@H](NC(=O)CN[C@]1(Cc2ccc(C(F)(F)F)cc2)CCOC1)c1ccc(F)cc1 ZINC000513171954 921599747 /nfs/dbraw/zinc/59/97/47/921599747.db2.gz DIZOFDJREXHOMA-BTYIYWSLSA-N 0 3 424.438 4.013 20 0 HIADHN CC(=O)Nc1c[nH]nc1[C@H]1CCCN(C[C@H](C)c2cccc(Br)c2)C1 ZINC000501768067 910824108 /nfs/dbraw/zinc/82/41/08/910824108.db2.gz HDDMZIOSMITUDI-BBRMVZONSA-N 0 3 405.340 4.114 20 0 HIADHN O=C(CN1CCC[C@H]1Cc1ccccc1)N1CCC[C@H]1c1ccc2c(c1)OCCCO2 ZINC000501785895 910839755 /nfs/dbraw/zinc/83/97/55/910839755.db2.gz RFCUTFPFLPPLSZ-GOTSBHOMSA-N 0 3 420.553 4.219 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N[C@@H]1CCCc2cn(C3CCCC3)nc21)c1ccco1 ZINC000501799318 910850225 /nfs/dbraw/zinc/85/02/25/910850225.db2.gz SAPKIAJDMLMNLD-PWIZWCRZSA-N 0 3 413.566 4.397 20 0 HIADHN CCSc1ccc(CC(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)cc1 ZINC000501874005 910897333 /nfs/dbraw/zinc/89/73/33/910897333.db2.gz PVVMIKMKWVDTLK-KDURUIRLSA-N 0 3 404.620 4.079 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)c3occc3-c3ccc(F)cc3)CC2)C[C@H](C)O1 ZINC000501873534 910898050 /nfs/dbraw/zinc/89/80/50/910898050.db2.gz OIHPASIWUJHZKP-ROUUACIJSA-N 0 3 414.521 4.437 20 0 HIADHN C[C@@H]1[C@H](NC(=O)N[C@@H]2CCCc3cn(C4CCCC4)nc32)CCN1Cc1ccccc1 ZINC000501921288 910919041 /nfs/dbraw/zinc/91/90/41/910919041.db2.gz ZCBXXWQZKQRTDL-SXSPYAJSSA-N 0 3 421.589 4.338 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)c1ccc(Br)o1 ZINC000501979618 910961988 /nfs/dbraw/zinc/96/19/88/910961988.db2.gz PCWYLNLGASFJKG-UHFFFAOYSA-N 0 3 419.241 4.265 20 0 HIADHN Cc1onc(-c2cccc(Br)c2)c1C(=O)N1CC[C@@H](N2CCCCC2)C1 ZINC000502042172 910995919 /nfs/dbraw/zinc/99/59/19/910995919.db2.gz NSRLNRUHXLHPHB-QGZVFWFLSA-N 0 3 418.335 4.113 20 0 HIADHN Cc1cccc(NC(=O)CN[C@]2(Cc3ccc(C(F)(F)F)cc3)CCOC2)c1C ZINC000513210903 921626095 /nfs/dbraw/zinc/62/60/95/921626095.db2.gz SRNNLNAMGPVATJ-NRFANRHFSA-N 0 3 406.448 4.252 20 0 HIADHN C[C@@H]1CCN(C(=O)Nc2cn(C)nc2-c2ccccc2)CCN1Cc1ccccc1 ZINC000502171796 911095779 /nfs/dbraw/zinc/09/57/79/911095779.db2.gz KXJNWCJQFOZDSW-LJQANCHMSA-N 0 3 403.530 4.215 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CC[C@H](c2ccccc2F)C1)c1cccc(OC)c1 ZINC000502176276 911098415 /nfs/dbraw/zinc/09/84/15/911098415.db2.gz YGVVMSCLBYMJFP-WMZHIEFXSA-N 0 3 413.537 4.416 20 0 HIADHN CC(C)(COc1ccc(C(F)(F)F)cn1)NCC(=O)Nc1cc(Cl)ccc1F ZINC000502241937 911194533 /nfs/dbraw/zinc/19/45/33/911194533.db2.gz JZLOHTLDPNMIKC-UHFFFAOYSA-N 0 3 419.806 4.279 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)N[C@H](C)c2cc(OC)c(OC)cc2C)N(C)C)cc1 ZINC000502270589 911217885 /nfs/dbraw/zinc/21/78/85/911217885.db2.gz RIDBWLNRRGKRGX-DYESRHJHSA-N 0 3 413.562 4.238 20 0 HIADHN C[C@@H](CC(=O)Nc1ccc(F)cc1)N[C@H]1CCOc2c(Br)cccc21 ZINC000502322043 911297725 /nfs/dbraw/zinc/29/77/25/911297725.db2.gz PHSMQNVMLCVKBK-SJCJKPOMSA-N 0 3 407.283 4.419 20 0 HIADHN CCc1cccc(CC)c1NC(=O)NCCCN1CCN(C)C[C@H]1c1ccccc1 ZINC000502330228 911309641 /nfs/dbraw/zinc/30/96/41/911309641.db2.gz CTKVRPVYWOHXFU-QHCPKHFHSA-N 0 3 408.590 4.312 20 0 HIADHN C[C@@H](NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1)c1ccc(OC(F)F)cc1 ZINC000502334668 911315565 /nfs/dbraw/zinc/31/55/65/911315565.db2.gz RQCFVBZMEOEBFX-VQIMIIECSA-N 0 3 403.473 4.313 20 0 HIADHN Cc1cc(Cl)ccc1NC(=O)NCCCN1CCN(C)C[C@H]1c1ccccc1 ZINC000502354313 911334012 /nfs/dbraw/zinc/33/40/12/911334012.db2.gz MUFSVSKCDWDMPR-NRFANRHFSA-N 0 3 400.954 4.149 20 0 HIADHN O=C(Nc1c[nH]nc1[C@@H]1CCCN(CCc2ccc(F)c(F)c2)C1)c1ccccc1 ZINC000502363202 911347820 /nfs/dbraw/zinc/34/78/20/911347820.db2.gz VNQPGCGXLNBGAX-GOSISDBHSA-N 0 3 410.468 4.362 20 0 HIADHN CCOC(=O)c1csc(C2CCN(Cc3ccccc3-c3ccnn3C)CC2)n1 ZINC000513247796 921656015 /nfs/dbraw/zinc/65/60/15/921656015.db2.gz WUSUWCMRGXFBLV-UHFFFAOYSA-N 0 3 410.543 4.100 20 0 HIADHN Cc1cccc(C(C)C)c1NC(=O)NCCCN1CCN(Cc2ccccc2)CC1 ZINC000502393718 911378304 /nfs/dbraw/zinc/37/83/04/911378304.db2.gz QDJZYNIYMJAHAF-UHFFFAOYSA-N 0 3 408.590 4.448 20 0 HIADHN C[C@H](NC(=O)NCCCN1CCN(C)C[C@H]1c1ccccc1)c1ccc(Cl)cc1 ZINC000502397512 911381638 /nfs/dbraw/zinc/38/16/38/911381638.db2.gz AXDBGXWNTXTRNT-AVRDEDQJSA-N 0 3 414.981 4.079 20 0 HIADHN COc1ccc(OC)c(NC(=O)C[C@H](C)N[C@@H](C)c2ccccc2OC(F)F)c1 ZINC000502499160 911501882 /nfs/dbraw/zinc/50/18/82/911501882.db2.gz FOXZKFZAZAESEB-KBPBESRZSA-N 0 3 408.445 4.373 20 0 HIADHN CC(C)c1noc(-c2ccccc2C(=O)NC[C@@H]2CCCN2Cc2ccccc2)n1 ZINC000513264241 921667390 /nfs/dbraw/zinc/66/73/90/921667390.db2.gz VOIVYOPGNBOFHN-IBGZPJMESA-N 0 3 404.514 4.254 20 0 HIADHN COc1ccc(NC(=O)C[C@H](C)N[C@H](C)c2ccccc2OC(F)F)c(OC)c1 ZINC000502501285 911504520 /nfs/dbraw/zinc/50/45/20/911504520.db2.gz LOLQITDYYDQWNU-UONOGXRCSA-N 0 3 408.445 4.373 20 0 HIADHN O=C(c1cccc(CN[C@]2(Cc3ccc(Cl)cc3)CCOC2)c1)N1CCCCC1 ZINC000502550382 911557581 /nfs/dbraw/zinc/55/75/81/911557581.db2.gz IUXIWEUPCZCWGW-DEOSSOPVSA-N 0 3 412.961 4.458 20 0 HIADHN O=C(CN[C@@H]1CCCC[C@H]1OC(F)F)Nc1ccc(Cl)cc1C(F)(F)F ZINC000502567885 911574278 /nfs/dbraw/zinc/57/42/78/911574278.db2.gz XADONSDOBXKGMY-CHWSQXEVSA-N 0 3 400.775 4.437 20 0 HIADHN CCN(Cc1ccc(OC)c(OC)c1)C(=O)CN[C@@H](c1ccc(F)cc1)C(C)C ZINC000502591995 911594356 /nfs/dbraw/zinc/59/43/56/911594356.db2.gz OMITXDADAVRQTO-HSZRJFAPSA-N 0 3 402.510 4.178 20 0 HIADHN CCOc1ccc([C@@H](C)NC(=O)CN[C@@H](c2ccc(F)cc2)C(C)C)cc1OC ZINC000502593110 911595385 /nfs/dbraw/zinc/59/53/85/911595385.db2.gz RTIOBCVDCYVYMT-WAIKUNEKSA-N 0 3 402.510 4.397 20 0 HIADHN CCOc1ccc([C@H](C)NC(=O)CN[C@@H](c2ccc(F)cc2)C(C)C)cc1OC ZINC000502593109 911595556 /nfs/dbraw/zinc/59/55/56/911595556.db2.gz RTIOBCVDCYVYMT-QMHKHESXSA-N 0 3 402.510 4.397 20 0 HIADHN CCOc1ccc([C@H](C)NC(=O)CN[C@H](c2ccc(F)cc2)C(C)C)cc1OC ZINC000502593107 911595764 /nfs/dbraw/zinc/59/57/64/911595764.db2.gz RTIOBCVDCYVYMT-HJPURHCSSA-N 0 3 402.510 4.397 20 0 HIADHN O=C(NC1CCN(Cc2ccccc2)CC1)c1csc(Cc2cccc(F)c2)n1 ZINC000502647984 911687861 /nfs/dbraw/zinc/68/78/61/911687861.db2.gz DLTQHBMNWXNFTF-UHFFFAOYSA-N 0 3 409.530 4.267 20 0 HIADHN CC[C@H](NC(=O)NC[C@@H](Cc1ccccc1)N(C)C)c1ccccc1OC(F)F ZINC000502648201 911688112 /nfs/dbraw/zinc/68/81/12/911688112.db2.gz JCWMHPYQNBJXBX-MJGOQNOKSA-N 0 3 405.489 4.211 20 0 HIADHN COC(=O)[C@](C)(CNCc1ccc(Sc2ccccn2)o1)c1ccc(F)cc1 ZINC000513286054 921684490 /nfs/dbraw/zinc/68/44/90/921684490.db2.gz IGNFASXPMMIKQA-OAQYLSRUSA-N 0 3 400.475 4.185 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)N[C@H](CC(F)(F)F)C(C)C)N(C)C)cc1 ZINC000502694510 911731610 /nfs/dbraw/zinc/73/16/10/911731610.db2.gz OFTNKNFSSFSCBO-QZTJIDSGSA-N 0 3 403.489 4.353 20 0 HIADHN CCN1CC[C@H]2OCCN(C(=O)c3ccc(Oc4cccc(Cl)c4)cc3)[C@H]2C1 ZINC000502712149 911745532 /nfs/dbraw/zinc/74/55/32/911745532.db2.gz OQNAEFBVDNCTLL-LEWJYISDSA-N 0 3 400.906 4.068 20 0 HIADHN Cc1c(C(=O)NC[C@H]2CCCN2Cc2ccccc2)cnn1-c1ccc(Cl)cc1 ZINC000513289914 921688300 /nfs/dbraw/zinc/68/83/00/921688300.db2.gz UCTKBLXOAINCHK-OAQYLSRUSA-N 0 3 408.933 4.229 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)CCC(=O)c3ccc(F)c(F)c3)c2)CC1 ZINC000502887670 911885140 /nfs/dbraw/zinc/88/51/40/911885140.db2.gz IMWDWHZRZHIIFC-UHFFFAOYSA-N 0 3 415.484 4.097 20 0 HIADHN CCc1c(C(=O)NC[C@@H](c2ccc(CC)cc2)N(C)C)cnn1Cc1ccccc1 ZINC000513312006 921705084 /nfs/dbraw/zinc/70/50/84/921705084.db2.gz YNRYCWDMEYHFIW-DEOSSOPVSA-N 0 3 404.558 4.089 20 0 HIADHN O[C@@H](Cc1ccccc1C(F)(F)F)CN1CCC[C@H]1c1nnc(-c2ccccc2)[nH]1 ZINC000503186723 912163706 /nfs/dbraw/zinc/16/37/06/912163706.db2.gz MPIHLISMHOWZTH-HKUYNNGSSA-N 0 3 416.447 4.231 20 0 HIADHN O=c1ccccn1C[C@H](NCCOc1ccc(Br)cc1)c1ccccc1 ZINC000503212869 912194419 /nfs/dbraw/zinc/19/44/19/912194419.db2.gz WMARCSJNFCQJDG-FQEVSTJZSA-N 0 3 413.315 4.021 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)N(C)[C@H]3CCCC[C@@H]3C)CC2)c1 ZINC000503217116 912199482 /nfs/dbraw/zinc/19/94/82/912199482.db2.gz NUJBYICKRZKFGF-GMAHTHKFSA-N 0 3 400.611 4.117 20 0 HIADHN COc1cccc(-c2nn(C(C)(C)C)cc2CN(CCC(N)=O)Cc2ccccc2)c1 ZINC000506280754 914881321 /nfs/dbraw/zinc/88/13/21/914881321.db2.gz PJLPKDOLJZKRFN-UHFFFAOYSA-N 0 3 420.557 4.191 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)Nc2ccc(C(=O)NC3CCCC3)cc2)C1 ZINC000506295751 914890379 /nfs/dbraw/zinc/89/03/79/914890379.db2.gz TYZGIIAMYCLYHW-FDDCHVKYSA-N 0 3 420.557 4.316 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)Nc2ccc(C(=O)NC3CCCC3)cc2)C1 ZINC000506295752 914890661 /nfs/dbraw/zinc/89/06/61/914890661.db2.gz TYZGIIAMYCLYHW-JPYJTQIMSA-N 0 3 420.557 4.316 20 0 HIADHN CCCNC(=O)C1CCN(Cc2cn(-c3ccccc3)nc2-c2cccs2)CC1 ZINC000506344097 914963006 /nfs/dbraw/zinc/96/30/06/914963006.db2.gz XYYISBDUICVJKZ-UHFFFAOYSA-N 0 3 408.571 4.339 20 0 HIADHN Fc1ccccc1N1CCCN(CCc2nc(-c3cccc(Cl)c3)no2)CC1 ZINC000513361184 921737035 /nfs/dbraw/zinc/73/70/35/921737035.db2.gz IFFLDTICQOZFLI-UHFFFAOYSA-N 0 3 400.885 4.284 20 0 HIADHN CC(C)N(C(=O)[C@H](C)N1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1)C(C)C ZINC000506454691 915054487 /nfs/dbraw/zinc/05/44/87/915054487.db2.gz KMGFGDWWEBMHKP-HNNXBMFYSA-N 0 3 411.949 4.164 20 0 HIADHN CC[C@H](C)[C@@H](C)C(=O)NC1CCN(CCOc2ccc(Br)cc2)CC1 ZINC000506470644 915069710 /nfs/dbraw/zinc/06/97/10/915069710.db2.gz MTVHTUJIFCCROX-JKSUJKDBSA-N 0 3 411.384 4.091 20 0 HIADHN COc1ccc(OC)c(-c2nn(-c3ccccc3)cc2CN(C)C[C@H]2CCCO2)c1 ZINC000506476957 915076859 /nfs/dbraw/zinc/07/68/59/915076859.db2.gz KZDDJRNZNHYYKS-OAQYLSRUSA-N 0 3 407.514 4.167 20 0 HIADHN CN(C)C(=O)CC1CCN(Cc2cn(-c3ccccc3)nc2-c2ccc(F)cc2)CC1 ZINC000513385110 921757362 /nfs/dbraw/zinc/75/73/62/921757362.db2.gz SZIYKGVCPPZNGX-UHFFFAOYSA-N 0 3 420.532 4.369 20 0 HIADHN Fc1ccccc1N1CCCN(CCc2nc(-c3ccc(Cl)cc3)no2)CC1 ZINC000513381880 921754977 /nfs/dbraw/zinc/75/49/77/921754977.db2.gz ULJMYQWYHITQSH-UHFFFAOYSA-N 0 3 400.885 4.284 20 0 HIADHN O=C(NC1CCN(Cc2cn(Cc3ccccc3)nc2-c2ccccc2)CC1)C1CC1 ZINC000506646662 915317794 /nfs/dbraw/zinc/31/77/94/915317794.db2.gz BYDNIRFIVOHLQI-UHFFFAOYSA-N 0 3 414.553 4.089 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CN1CCC[C@H](c2nnc3n2CCCCC3)C1 ZINC000506652940 915323590 /nfs/dbraw/zinc/32/35/90/915323590.db2.gz IIECEXCMLUJDSP-FQEVSTJZSA-N 0 3 404.562 4.187 20 0 HIADHN COc1cccc([C@@H]2CCCN2Cc2ccc(OCC(=O)N3CCCC3)c(OC)c2)c1 ZINC000506690669 915368878 /nfs/dbraw/zinc/36/88/78/915368878.db2.gz RRCMVEJECZUETP-QFIPXVFZSA-N 0 3 424.541 4.042 20 0 HIADHN CCOc1ccc([C@H]2CCCN2Cc2ccccc2OCC(=O)N2CCCC2)cc1 ZINC000506705277 915381883 /nfs/dbraw/zinc/38/18/83/915381883.db2.gz BKVCHXBGVZSFNG-HSZRJFAPSA-N 0 3 408.542 4.424 20 0 HIADHN O=C(NCc1ccccc1)C1CCN(Cc2ccccc2OCC(F)(F)F)CC1 ZINC000506744934 915434781 /nfs/dbraw/zinc/43/47/81/915434781.db2.gz UWGSHSXRAXHLMO-UHFFFAOYSA-N 0 3 406.448 4.156 20 0 HIADHN COc1cccc(C[C@@H](NCc2csc(CNC(=O)c3ccccc3)n2)C2CC2)c1 ZINC000513404714 921772246 /nfs/dbraw/zinc/77/22/46/921772246.db2.gz OCFXODBIWZKFJG-JOCHJYFZSA-N 0 3 421.566 4.193 20 0 HIADHN COc1ccc([C@H](C)NC(=O)N[C@H]2CCN(Cc3ccccc3)[C@H]2C)c(C)c1OC ZINC000513418671 921787299 /nfs/dbraw/zinc/78/72/99/921787299.db2.gz CAGOAASCOSWMEX-WFXMLNOXSA-N 0 3 411.546 4.035 20 0 HIADHN COc1ccc([C@@H]2CCCCCN2C(=O)CN[C@@H](C)c2ccc3n[nH]cc3c2)cc1 ZINC000513421058 921789376 /nfs/dbraw/zinc/78/93/76/921789376.db2.gz SRANKAMHFXMPRW-SBUREZEXSA-N 0 3 406.530 4.366 20 0 HIADHN c1nc(CN2CCCN(Cc3ccc(-n4cnc5ccccc54)cc3)CC2)cs1 ZINC000513424949 921794023 /nfs/dbraw/zinc/79/40/23/921794023.db2.gz NEDGZLGGQBEABM-UHFFFAOYSA-N 0 3 403.555 4.190 20 0 HIADHN CC(C)(C)[C@H](NCC(=O)NCC1(c2ccccc2)CCOCC1)c1ccc(F)cc1 ZINC000507005787 915817563 /nfs/dbraw/zinc/81/75/63/915817563.db2.gz BCXBDWAITOAPSZ-HSZRJFAPSA-N 0 3 412.549 4.367 20 0 HIADHN COc1ccc(-c2nc(C)c([C@H](C)NC(=O)N(C)[C@@H]3CCN(C4CC4)C3)s2)cc1 ZINC000507059529 915846336 /nfs/dbraw/zinc/84/63/36/915846336.db2.gz KQYADMZZKNVEDA-MAUKXSAKSA-N 0 3 414.575 4.066 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2csc(-c3ncccc3F)n2)N2CCCC2)cc1 ZINC000507071851 915852939 /nfs/dbraw/zinc/85/29/39/915852939.db2.gz PDKKPDKHBMZLET-LJQANCHMSA-N 0 3 410.518 4.220 20 0 HIADHN Cc1onc(-c2ccccc2)c1C(=O)N1CCCN(CCCc2ccccc2)CC1 ZINC000507102804 915870907 /nfs/dbraw/zinc/87/09/07/915870907.db2.gz MUTSOKJQBOSDKJ-UHFFFAOYSA-N 0 3 403.526 4.431 20 0 HIADHN COc1cccc(C(=O)N2CCCN(CCCc3ccccc3)CC2)c1OC(F)F ZINC000507150424 915892624 /nfs/dbraw/zinc/89/26/24/915892624.db2.gz VUPNYEBXBYJYBY-UHFFFAOYSA-N 0 3 418.484 4.077 20 0 HIADHN CCOc1cc(CN(Cc2ccc(F)cc2)C(C)C)ccc1O[C@H](C)C(=O)N(C)C ZINC000507171053 915914923 /nfs/dbraw/zinc/91/49/23/915914923.db2.gz RXRUSIHQRBJEHU-GOSISDBHSA-N 0 3 416.537 4.491 20 0 HIADHN COc1ccc(OC)c([C@@H]2CCCN2C(=O)CN2CC[C@@H](c3ccccc3C)C2)c1 ZINC000507218587 915970239 /nfs/dbraw/zinc/97/02/39/915970239.db2.gz LLJALXUZHNZUDL-XXBNENTESA-N 0 3 408.542 4.165 20 0 HIADHN C[C@@H](N[C@@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O)c1ccc2n[nH]cc2c1 ZINC000507225616 915979380 /nfs/dbraw/zinc/97/93/80/915979380.db2.gz AKRIITCMXNGUJD-JLTOFOAXSA-N 0 3 416.447 4.424 20 0 HIADHN CCCn1nccc1C1CCN(C(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)CC1 ZINC000507308326 916069139 /nfs/dbraw/zinc/06/91/39/916069139.db2.gz YFXLMYMSSULHFG-UGKGYDQZSA-N 0 3 409.578 4.018 20 0 HIADHN CCOC(=O)CC1CCN(Cc2cn(-c3ccc(Br)cc3)nc2C)CC1 ZINC000507346511 916099719 /nfs/dbraw/zinc/09/97/19/916099719.db2.gz BWBNYKZRBFTYMH-UHFFFAOYSA-N 0 3 420.351 4.108 20 0 HIADHN O=C1NCCCC[C@@H]1N[C@@H]1CCCc2nc(-c3ccc(Br)cc3)sc21 ZINC000507410668 916184003 /nfs/dbraw/zinc/18/40/03/916184003.db2.gz YZHTXYLENLQKRW-ZBFHGGJFSA-N 0 3 420.376 4.208 20 0 HIADHN CCc1cccnc1[C@@H](C)NCc1cc(C(F)(F)F)ccc1N1CCN(C)CC1 ZINC000507458088 916226717 /nfs/dbraw/zinc/22/67/17/916226717.db2.gz CLUBSMRVTDJVLB-MRXNPFEDSA-N 0 3 406.496 4.265 20 0 HIADHN COCCSc1ccc([C@H](C)N[C@H](C)C(=O)N[C@@H](C)c2ccc(F)cc2)cc1 ZINC000507468365 916239189 /nfs/dbraw/zinc/23/91/89/916239189.db2.gz ZRKCYPKCXWTREU-YESZJQIVSA-N 0 3 404.551 4.481 20 0 HIADHN Cc1onc(-c2cccnc2)c1C(=O)NC[C@@H](c1ccccc1)N1CCC(C)CC1 ZINC000507483796 916251715 /nfs/dbraw/zinc/25/17/15/916251715.db2.gz HZOIPTWHGNMTHQ-NRFANRHFSA-N 0 3 404.514 4.248 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3cccc(OC)c3F)c(OCC)c2)CC1 ZINC000507607472 916364207 /nfs/dbraw/zinc/36/42/07/916364207.db2.gz RBNCXDXWIACRNJ-UHFFFAOYSA-N 0 3 415.509 4.017 20 0 HIADHN Cc1ccc([C@H](NCC[C@H]2CCCCO2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000507610434 916368369 /nfs/dbraw/zinc/36/83/69/916368369.db2.gz JZVOWNSEAQUYFZ-NFBKMPQASA-N 0 3 401.572 4.345 20 0 HIADHN O=C(Nc1ccc(N2CCCC2)cn1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000507659741 916421194 /nfs/dbraw/zinc/42/11/94/916421194.db2.gz VNSQDIDCLVONFL-NRFANRHFSA-N 0 3 418.463 4.075 20 0 HIADHN Cc1cc(C(=O)N2C[C@@H](N(C)C)Cc3ccccc32)nc(-c2ccc(Cl)cc2)n1 ZINC000507711619 916502931 /nfs/dbraw/zinc/50/29/31/916502931.db2.gz YMOFMZYTIPTTMZ-IBGZPJMESA-N 0 3 406.917 4.239 20 0 HIADHN CN1C(=O)C[C@@H](NCc2cccc(OCc3ccccn3)c2)[C@@H]1c1ccc(Cl)cc1 ZINC000507818826 916615345 /nfs/dbraw/zinc/61/53/45/916615345.db2.gz JYBVIWGCHJLUDQ-VWNXMTODSA-N 0 3 421.928 4.376 20 0 HIADHN Cc1cccn2c(CNCc3ccccc3-c3ccc(Cn4cncn4)cc3)cnc12 ZINC000507851038 916671629 /nfs/dbraw/zinc/67/16/29/916671629.db2.gz IRUWVSTYJXUVDV-UHFFFAOYSA-N 0 3 408.509 4.239 20 0 HIADHN Cc1ccc2ncc(CNCc3ccccc3-c3ccc(Cn4cncn4)cc3)n2c1 ZINC000507851679 916672410 /nfs/dbraw/zinc/67/24/10/916672410.db2.gz LVRKYLDUHPUTEZ-UHFFFAOYSA-N 0 3 408.509 4.239 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2C(=O)N2CCN3CCC2CC3)c(C)c1 ZINC000507874225 916710939 /nfs/dbraw/zinc/71/09/39/916710939.db2.gz JRDRFWSZVXLFRV-UHFFFAOYSA-N 0 3 400.526 4.076 20 0 HIADHN Cc1ccc(NC(=O)[C@@H]2CCCN(Cc3ccccc3OCc3cccnc3)C2)nc1 ZINC000508011689 916850069 /nfs/dbraw/zinc/85/00/69/916850069.db2.gz BCOGTZSDNPSASL-JOCHJYFZSA-N 0 3 416.525 4.215 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@H](C)[C@H]1CCCOC1)c1ccc(C(F)(F)F)cc1 ZINC000508159144 916980460 /nfs/dbraw/zinc/98/04/60/916980460.db2.gz FAVVWQYERJUKTH-HHXXYDBFSA-N 0 3 415.500 4.203 20 0 HIADHN CC[C@@H](CNC(=O)N[C@@H](c1nccs1)c1ccccc1)N1CCc2ccccc2C1 ZINC000508189851 917012482 /nfs/dbraw/zinc/01/24/82/917012482.db2.gz HTKYLQTZYBCEGO-FCHUYYIVSA-N 0 3 420.582 4.369 20 0 HIADHN COc1ccc(NC(=O)[C@H](C)N2[C@H](C)CC[C@@H]2C)cc1NC(=O)c1cccc(F)c1 ZINC000508203205 917022626 /nfs/dbraw/zinc/02/26/26/917022626.db2.gz CCEVUVODXBAGJW-XHSDSOJGSA-N 0 3 413.493 4.286 20 0 HIADHN CC(C)N1CCc2nc(CNc3nccn3Cc3ccccc3Cl)sc2C1 ZINC000508449821 917234026 /nfs/dbraw/zinc/23/40/26/917234026.db2.gz AYZXTSRYOJFMGM-UHFFFAOYSA-N 0 3 401.967 4.420 20 0 HIADHN O=C(N[C@@H]1CCc2cc(F)ccc21)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000508605851 917375767 /nfs/dbraw/zinc/37/57/67/917375767.db2.gz WKKUFSUHFWVWEI-CTNGQTDRSA-N 0 3 406.423 4.384 20 0 HIADHN Cn1ccnc1C[C@H]1CCCN(Cc2cc(Cl)ccc2OC[C@H]2CCCO2)C1 ZINC000508638980 917403871 /nfs/dbraw/zinc/40/38/71/917403871.db2.gz PRHKQWSAKDMESI-YLJYHZDGSA-N 0 3 403.954 4.086 20 0 HIADHN CC[C@H](C)NC(=O)[C@@H]1C[C@H](C)N(Cc2nnc(-c3ccccc3)o2)[C@@H]2CCCC[C@H]12 ZINC000508655850 917420837 /nfs/dbraw/zinc/42/08/37/917420837.db2.gz OVABGAWCCIQPIL-HSROGRKHSA-N 0 3 410.562 4.421 20 0 HIADHN CN(CCc1cnccn1)Cc1ccc(OCc2ccccc2)c(Br)c1 ZINC000508671355 917436328 /nfs/dbraw/zinc/43/63/28/917436328.db2.gz QALDIJGNXPKLMM-UHFFFAOYSA-N 0 3 412.331 4.493 20 0 HIADHN Clc1ccc([C@H](Cc2cccnc2)NCc2ccccc2Cn2cncn2)cc1 ZINC000508725160 917486608 /nfs/dbraw/zinc/48/66/08/917486608.db2.gz XKJHMQRSJQFYPD-QHCPKHFHSA-N 0 3 403.917 4.448 20 0 HIADHN C[C@@H](NCc1ccccc1Cn1cncn1)c1ccc(OC[C@H]2CCCCO2)c(F)c1 ZINC000508731253 917491889 /nfs/dbraw/zinc/49/18/89/917491889.db2.gz VUAATYDQNJWRTB-XMSQKQJNSA-N 0 3 424.520 4.264 20 0 HIADHN CCN(CC)C(=O)Nc1ccc([C@H](C)NCc2ccccc2Cn2cncn2)cc1 ZINC000508741139 917500521 /nfs/dbraw/zinc/50/05/21/917500521.db2.gz VBKZNNCQOJNCMR-SFHVURJKSA-N 0 3 406.534 4.051 20 0 HIADHN Brc1cccc2c1OCCC[C@@H]2NCc1ccccc1Cn1cncn1 ZINC000508747578 917504713 /nfs/dbraw/zinc/50/47/13/917504713.db2.gz OIHCJHYHKYAMIS-IBGZPJMESA-N 0 3 413.319 4.092 20 0 HIADHN C[C@@H](NC(=O)N(CCN(C)Cc1ccccc1)Cc1ccccc1)[C@@H]1CCCOC1 ZINC000508756202 917512228 /nfs/dbraw/zinc/51/22/28/917512228.db2.gz SSKWUMCPTIJBSE-ZJSXRUAMSA-N 0 3 409.574 4.145 20 0 HIADHN C[C@H](NC(=O)NC(C)(C)c1nc(C(F)(F)F)cs1)[C@@H](c1ccccc1)N(C)C ZINC000508856677 917609721 /nfs/dbraw/zinc/60/97/21/917609721.db2.gz VZFPTFOIAGPVSX-WFASDCNBSA-N 0 3 414.497 4.388 20 0 HIADHN CCN(CC1CCN(c2ccccn2)CC1)C(=O)N[C@H](C)[C@@H](c1ccccc1)N(C)C ZINC000508857341 917611696 /nfs/dbraw/zinc/61/16/96/917611696.db2.gz WWYCTJWVOGNULM-YKSBVNFPSA-N 0 3 423.605 4.021 20 0 HIADHN C[C@@H](NC(=O)N1CCC(Oc2ccc(F)cc2F)CC1)[C@H](c1ccccc1)N(C)C ZINC000508860115 917613842 /nfs/dbraw/zinc/61/38/42/917613842.db2.gz ZXEYEBXUEMWWKF-OPAMFIHVSA-N 0 3 417.500 4.209 20 0 HIADHN C[C@H](NC(=O)N(C)Cc1ccc(OCC(F)(F)F)cc1)[C@H](c1ccccc1)N(C)C ZINC000508861843 917615024 /nfs/dbraw/zinc/61/50/24/917615024.db2.gz IKWIXIMAVFGXJZ-OXJNMPFZSA-N 0 3 423.479 4.461 20 0 HIADHN C[C@@H](NC(=O)N1CCC(c2ncccc2Cl)CC1)[C@@H](c1ccccc1)N(C)C ZINC000508875212 917629030 /nfs/dbraw/zinc/62/90/30/917629030.db2.gz BQRJJOMQUYELLU-IERDGZPVSA-N 0 3 400.954 4.315 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)cc1OC ZINC000508880333 917634418 /nfs/dbraw/zinc/63/44/18/917634418.db2.gz LGBWAFSMPKLECE-MONBJTKQSA-N 0 3 411.546 4.242 20 0 HIADHN C[C@H](NC(=O)N(Cc1cccc(F)c1)C[C@H]1CCCO1)[C@@H](c1ccccc1)N(C)C ZINC000508888646 917644457 /nfs/dbraw/zinc/64/44/57/917644457.db2.gz CNWHCJWJQBBRQL-NMNUPHIUSA-N 0 3 413.537 4.208 20 0 HIADHN C[C@H](NC(=O)N1CC=C(c2c[nH]c3ncccc23)CC1)[C@@H](c1ccccc1)N(C)C ZINC000508890515 917646039 /nfs/dbraw/zinc/64/60/39/917646039.db2.gz ACTDKTQNQPDJOF-JTSKRJEESA-N 0 3 403.530 4.053 20 0 HIADHN C[C@H](NC(=O)N1CCC(c2nc3ccccc3[nH]2)CC1)[C@H](c1ccccc1)N(C)C ZINC000508902438 917658469 /nfs/dbraw/zinc/65/84/69/917658469.db2.gz WKFDZGHZBNZIPJ-HTAPYJJXSA-N 0 3 405.546 4.143 20 0 HIADHN C[C@H](NC(=O)Nc1ccc(C(=O)NC2CCCC2)cc1)[C@@H](c1ccccc1)N(C)C ZINC000508904625 917660463 /nfs/dbraw/zinc/66/04/63/917660463.db2.gz IICBMQRMUALZOV-JTSKRJEESA-N 0 3 408.546 4.172 20 0 HIADHN C[C@@H](NC(=O)Nc1ccc(C(=O)N2CCC(C)CC2)cc1)[C@H](c1ccccc1)N(C)C ZINC000508908442 917665730 /nfs/dbraw/zinc/66/57/30/917665730.db2.gz SMMNETREGFSRAL-AUSIDOKSSA-N 0 3 422.573 4.372 20 0 HIADHN O=C(NCc1ccc2ccccc2n1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000508930810 917690336 /nfs/dbraw/zinc/69/03/36/917690336.db2.gz YOJNTXXVQHORSW-JOCHJYFZSA-N 0 3 413.443 4.306 20 0 HIADHN COc1cccc([C@@H](C)NC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)c1 ZINC000509003358 917758001 /nfs/dbraw/zinc/75/80/01/917758001.db2.gz WWQJGGZYCUCEEG-IERDGZPVSA-N 0 3 406.448 4.327 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)N(Cc1ccccn1)C1CC1)c1ccc(Cl)cc1 ZINC000509016732 917770978 /nfs/dbraw/zinc/77/09/78/917770978.db2.gz LLGXKEYHPIFOKH-NRFANRHFSA-N 0 3 400.954 4.492 20 0 HIADHN O=C([C@@H]1CN(Cc2ccccc2)CCC1(F)F)N1CCC(OC2CCCC2)CC1 ZINC000509036054 917790588 /nfs/dbraw/zinc/79/05/88/917790588.db2.gz DLRHBSBADXRAQJ-NRFANRHFSA-N 0 3 406.517 4.094 20 0 HIADHN O=C(N[C@@H]1CCCOc2ccccc21)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000509063225 917811380 /nfs/dbraw/zinc/81/13/80/917811380.db2.gz LRNOTCFGVWYJEY-WOJBJXKFSA-N 0 3 400.469 4.174 20 0 HIADHN C[C@@H](c1ccc(N2CCCS2(=O)=O)cc1)N(C)Cc1ccccc1C(F)(F)F ZINC000509125331 917858559 /nfs/dbraw/zinc/85/85/59/917858559.db2.gz PBDBOIUSZLEAII-HNNXBMFYSA-N 0 3 412.477 4.438 20 0 HIADHN CC(C)c1nc(CCNC(=O)[C@@H]2CN(Cc3ccccc3)CCC2(F)F)cs1 ZINC000509245068 917938359 /nfs/dbraw/zinc/93/83/59/917938359.db2.gz FBVXETQXVQSHJP-SFHVURJKSA-N 0 3 407.530 4.083 20 0 HIADHN Cc1cc(NC(=O)Cc2ccc(O)cc2Cl)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000509273967 917960716 /nfs/dbraw/zinc/96/07/16/917960716.db2.gz KCZQLPDRCKGTIV-IBGZPJMESA-N 0 3 424.932 4.179 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)Cc1ccc(O)cc1Cl ZINC000509275618 917962483 /nfs/dbraw/zinc/96/24/83/917962483.db2.gz UHZNMMIONDVGEU-IBGZPJMESA-N 0 3 424.932 4.179 20 0 HIADHN COc1cc(CN2CCC[C@@H](C(=O)Nc3ccc(Cl)cn3)C2)ccc1OC(C)C ZINC000509355391 918019932 /nfs/dbraw/zinc/01/99/32/918019932.db2.gz DDKWLYXTZMAEIY-QGZVFWFLSA-N 0 3 417.937 4.382 20 0 HIADHN COc1ccc(C(=O)CCN2CCC[C@H](CNC(=O)Nc3ccc(C)cc3)C2)cc1 ZINC000509373910 918039630 /nfs/dbraw/zinc/03/96/30/918039630.db2.gz RPJKASHTOIJBOT-LJQANCHMSA-N 0 3 409.530 4.110 20 0 HIADHN O=C(Nc1ccc(Br)cn1)C1CCN(C/C=C\c2ccc(F)cc2)CC1 ZINC000509393910 918060361 /nfs/dbraw/zinc/06/03/61/918060361.db2.gz TVRBKBVNRYEQQK-UPHRSURJSA-N 0 3 418.310 4.347 20 0 HIADHN Cn1cnnc1C1CCN(Cc2ccc(OC(F)(F)[C@@H](F)C(F)(F)F)cc2)CC1 ZINC000509398989 918065852 /nfs/dbraw/zinc/06/58/52/918065852.db2.gz JRUBUHKCNPBRSM-INIZCTEOSA-N 0 3 422.373 4.067 20 0 HIADHN CCCc1nc(C(=O)NC[C@@H]2CCCN(C)[C@H]2c2ccc(C(F)(F)F)cc2)co1 ZINC000509401773 918067773 /nfs/dbraw/zinc/06/77/73/918067773.db2.gz OXRJQSGGTPNCIY-KXBFYZLASA-N 0 3 409.452 4.459 20 0 HIADHN Cn1cc(-c2ccc(CN[C@@H]3CC(=O)N(C)[C@H]3c3ccc(Cl)c(F)c3)s2)cn1 ZINC000509479653 918127078 /nfs/dbraw/zinc/12/70/78/918127078.db2.gz ZQSJVFDJZVHXSU-XLIONFOSSA-N 0 3 418.925 4.003 20 0 HIADHN COc1cccc(-c2c[nH]cc2C(=O)NC[C@H](c2cccc(OC)c2)N2CCCC2)c1 ZINC000509484142 918129691 /nfs/dbraw/zinc/12/96/91/918129691.db2.gz OVCYRVGCODWAPX-XMMPIXPASA-N 0 3 419.525 4.266 20 0 HIADHN Cc1ccc(NC(=O)[C@@H](C)N[C@H]2CCc3ccccc3OC2)c(Br)c1 ZINC000509530197 918177748 /nfs/dbraw/zinc/17/77/48/918177748.db2.gz XUCQHBDMYHAOEK-ZBFHGGJFSA-N 0 3 403.320 4.068 20 0 HIADHN COCCOc1ccc([C@@H](C)NCc2ccc(-c3cnn(C)c3)s2)cc1OC ZINC000509536340 918185205 /nfs/dbraw/zinc/18/52/05/918185205.db2.gz CCMWMGMVPSNKKP-OAHLLOKOSA-N 0 3 401.532 4.033 20 0 HIADHN C[C@H]1CCCN(C(=O)C2CCN(Cc3ccccc3OCc3ccncc3)CC2)C1 ZINC000509560240 918211251 /nfs/dbraw/zinc/21/12/51/918211251.db2.gz NXAOKSUHFBQOEO-FQEVSTJZSA-N 0 3 407.558 4.131 20 0 HIADHN CC[C@H](NC(=O)N(CCN(C)C)Cc1ccccc1F)c1ccc(OC)c(OC)c1 ZINC000509569132 918219486 /nfs/dbraw/zinc/21/94/86/918219486.db2.gz NBROHYPFMORABI-FQEVSTJZSA-N 0 3 417.525 4.067 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N1CCC[C@@H]1c1ccc2c(c1)OCCO2)c1ccco1 ZINC000509571308 918221891 /nfs/dbraw/zinc/22/18/91/918221891.db2.gz RYSJCJBWEFKBDE-QXAKKESOSA-N 0 3 413.518 4.027 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)N1CCC(Nc2cccc(OC)c2)CC1)c1ccco1 ZINC000509575074 918224890 /nfs/dbraw/zinc/22/48/90/918224890.db2.gz VDHRMKYTZAUGMM-UTKZUKDTSA-N 0 3 414.550 4.004 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)N1CCC(OC2CCC(C)CC2)CC1)c1ccco1 ZINC000509592339 918240314 /nfs/dbraw/zinc/24/03/14/918240314.db2.gz ABTVTCGPAOBGKN-VUMZAAJDSA-N 0 3 405.583 4.478 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)N(C)Cc1ccc(SC)c(OC)c1)c1ccco1 ZINC000509593229 918242828 /nfs/dbraw/zinc/24/28/28/918242828.db2.gz CRGOERUUMJYHJQ-WBVHZDCISA-N 0 3 405.564 4.281 20 0 HIADHN CC[C@H](NC(=O)N[C@H](CN(C)C)c1ccc(Cl)cc1)c1ccc(OC)c(OC)c1 ZINC000509594937 918243671 /nfs/dbraw/zinc/24/36/71/918243671.db2.gz GBIPQLTZHLBJCE-RBUKOAKNSA-N 0 3 419.953 4.410 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N1CCC2(CC1)OCCc1ccsc12)c1ccco1 ZINC000509595989 918246307 /nfs/dbraw/zinc/24/63/07/918246307.db2.gz LYMKJMZTEIYGEY-WMZOPIPTSA-N 0 3 417.575 4.044 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N(C)Cc1cccc(Br)c1)c1ccco1 ZINC000509596593 918246588 /nfs/dbraw/zinc/24/65/88/918246588.db2.gz RZHYNYVHRCLURB-WMLDXEAASA-N 0 3 408.340 4.313 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N1CC[C@@](F)(c2cc(F)cc(F)c2)C1)c1ccco1 ZINC000509601663 918251860 /nfs/dbraw/zinc/25/18/60/918251860.db2.gz LLVXLRYHOYDVOE-HLLQZAQXSA-N 0 3 409.452 4.267 20 0 HIADHN COc1ccc([C@@H](CNCc2ccc(Sc3ccccn3)o2)N(C)C)cc1OC ZINC000509653814 918290738 /nfs/dbraw/zinc/29/07/38/918290738.db2.gz RJXJKIOSDCRDRK-GOSISDBHSA-N 0 3 413.543 4.236 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N[C@H](C[C@H]2CCOC2)c2ccccc2)C1 ZINC000509767861 918382114 /nfs/dbraw/zinc/38/21/14/918382114.db2.gz QUXUPGUIWCZTIE-MYSJAJEPSA-N 0 3 407.558 4.289 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N[C@H](C[C@@H]2CCOC2)c2ccccc2)C1 ZINC000509767859 918382195 /nfs/dbraw/zinc/38/21/95/918382195.db2.gz QUXUPGUIWCZTIE-CDPNLFKUSA-N 0 3 407.558 4.289 20 0 HIADHN O=C(N[C@@H](C[C@H]1CCOC1)c1ccccc1)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000509782696 918392624 /nfs/dbraw/zinc/39/26/24/918392624.db2.gz UTHFOPIAZVXGMC-JRFVFWCSSA-N 0 3 407.558 4.118 20 0 HIADHN Cn1cc(Oc2ccccc2C(=O)Nc2ccc(CCN3CCSCC3)cc2)cn1 ZINC000509830607 918431249 /nfs/dbraw/zinc/43/12/49/918431249.db2.gz MGBBTSZTFRQOOG-UHFFFAOYSA-N 0 3 422.554 4.056 20 0 HIADHN CC[C@@H](CNC(=O)N[C@@H](COCC(C)C)c1ccco1)N1CCc2ccccc2C1 ZINC000509872066 918473764 /nfs/dbraw/zinc/47/37/64/918473764.db2.gz VVDLXJFHTFRXTI-VXKWHMMOSA-N 0 3 413.562 4.129 20 0 HIADHN CC[C@H](CNC(=O)N[C@@H](COCC(C)C)c1ccco1)N1CCc2ccccc2C1 ZINC000509872067 918474024 /nfs/dbraw/zinc/47/40/24/918474024.db2.gz VVDLXJFHTFRXTI-YADHBBJMSA-N 0 3 413.562 4.129 20 0 HIADHN CN(C[C@@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)c1csc2ccccc21 ZINC000509922896 918523258 /nfs/dbraw/zinc/52/32/58/918523258.db2.gz FOYBOXDFJUXIRG-SFHVURJKSA-N 0 3 400.569 4.044 20 0 HIADHN CC(C)Oc1ccccc1NC(=O)NCCCCN1CCN(c2ccccc2)CC1 ZINC000509927730 918526818 /nfs/dbraw/zinc/52/68/18/918526818.db2.gz PXVSHSFWWRLGHP-UHFFFAOYSA-N 0 3 410.562 4.198 20 0 HIADHN O=C(Nc1ccccc1)N1CC[C@@H](NCc2ccc(Br)c(Cl)c2)C1 ZINC000509964585 918555909 /nfs/dbraw/zinc/55/59/09/918555909.db2.gz VYXCWMKJMWTWCH-OAHLLOKOSA-N 0 3 408.727 4.499 20 0 HIADHN C[C@@H]([N-]S(=O)(=O)c1cc(Cl)ccc1C(F)(F)F)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000509972087 918561512 /nfs/dbraw/zinc/56/15/12/918561512.db2.gz VUMOGJDPKWDZDC-CHWSQXEVSA-N 0 3 424.916 4.290 20 0 HIADHN C[C@@H]([N-]S(=O)(=O)c1cc(Cl)ccc1C(F)(F)F)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000509972087 918561524 /nfs/dbraw/zinc/56/15/24/918561524.db2.gz VUMOGJDPKWDZDC-CHWSQXEVSA-N 0 3 424.916 4.290 20 0 HIADHN CN(C)[C@H](CNC(=O)c1ccc(Oc2ccncc2)c(Cl)c1)Cc1ccccc1 ZINC000510106414 918669857 /nfs/dbraw/zinc/66/98/57/918669857.db2.gz PNLLIAJWDYFBEZ-IBGZPJMESA-N 0 3 409.917 4.430 20 0 HIADHN CN(Cc1c[nH]nc1-c1ccc(F)cc1)C[C@H](O)COc1ccc(C(F)(F)F)cc1 ZINC000510206219 918755259 /nfs/dbraw/zinc/75/52/59/918755259.db2.gz AHNLPBPWWRMLQI-SFHVURJKSA-N 0 3 423.410 4.106 20 0 HIADHN CC[C@H](NCC(=O)N1CCc2sccc2[C@@H]1CC)c1ccc(OC)c(OC)c1 ZINC000510236618 918776226 /nfs/dbraw/zinc/77/62/26/918776226.db2.gz FHULXZWRMXMBFR-ROUUACIJSA-N 0 3 402.560 4.342 20 0 HIADHN CC[C@H](NCC(=O)N(C)[C@H](C)c1ccc(F)c(F)c1)c1ccc(OC)c(OC)c1 ZINC000510244668 918781210 /nfs/dbraw/zinc/78/12/10/918781210.db2.gz VEMINAMPGYHFFU-KUHUBIRLSA-N 0 3 406.473 4.242 20 0 HIADHN CCCN(Cc1nc(-c2cccs2)no1)C1CCN(c2cc(C)nc(C)n2)CC1 ZINC000510244089 918781578 /nfs/dbraw/zinc/78/15/78/918781578.db2.gz OHTZALHSVOPZFW-UHFFFAOYSA-N 0 3 412.563 4.086 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N(C)C[C@@H]1OCCc2ccccc21)c1ccsc1 ZINC000510255001 918789631 /nfs/dbraw/zinc/78/96/31/918789631.db2.gz IKJWLWAXCJLECI-SFTDATJTSA-N 0 3 401.576 4.086 20 0 HIADHN C[C@@H](c1ncc(-c2ccc(Cl)cc2Cl)o1)N1CCN(C[C@@H]2CCOC2)CC1 ZINC000510374500 918860612 /nfs/dbraw/zinc/86/06/12/918860612.db2.gz GUZLPBQJDJCKAQ-GJZGRUSLSA-N 0 3 410.345 4.364 20 0 HIADHN Cn1ccnc1[C@@H](NC(=O)N1CCN(Cc2ccccc2)C2(CCCCC2)C1)C1CC1 ZINC000510379147 918862686 /nfs/dbraw/zinc/86/26/86/918862686.db2.gz LYLGYDQXVFNUFI-QFIPXVFZSA-N 0 3 421.589 4.102 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)NCc1ccnc(OCc2ccccc2)c1 ZINC000510383036 918864485 /nfs/dbraw/zinc/86/44/85/918864485.db2.gz SMMJPFISFHLGPN-UHFFFAOYSA-N 0 3 415.493 4.398 20 0 HIADHN O=C(Nc1cccc(COCc2ccco2)c1)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000510416854 918885279 /nfs/dbraw/zinc/88/52/79/918885279.db2.gz ZQUYDPWXJYQISZ-QFIPXVFZSA-N 0 3 405.498 4.392 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)Nc1cccc(Cl)c1-n1cccn1 ZINC000510459921 918915808 /nfs/dbraw/zinc/91/58/08/918915808.db2.gz PPKDBYYUVNJBKU-FQEVSTJZSA-N 0 3 409.921 4.484 20 0 HIADHN C[C@H](NC(=O)NC[C@@H]1CC2c3ccccc3C1c1ccccc12)C1=CCN(C)CC1 ZINC000510485054 918936204 /nfs/dbraw/zinc/93/62/04/918936204.db2.gz YLQCNIONUXYFKC-XWXQCQSESA-N 0 3 401.554 4.233 20 0 HIADHN CN(CCC1CCCCC1)C(=O)NCCCCN1CCN(c2ccccc2)CC1 ZINC000510498381 918945712 /nfs/dbraw/zinc/94/57/12/918945712.db2.gz ZAPJCZQDLWNAKT-UHFFFAOYSA-N 0 3 400.611 4.201 20 0 HIADHN O=C(Nc1cccc(OCc2cccnc2)c1)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000510498484 918947658 /nfs/dbraw/zinc/94/76/58/918947658.db2.gz ZXSNGGLMOQHJEQ-JOCHJYFZSA-N 0 3 402.498 4.057 20 0 HIADHN CCCCCOc1ccc([C@@H](C)NC(=O)N[C@@H](C)C2=CCN(C)CC2)cc1OC ZINC000510502503 918951465 /nfs/dbraw/zinc/95/14/65/918951465.db2.gz QQJKUDBJRFHQTO-ZWKOTPCHSA-N 0 3 403.567 4.275 20 0 HIADHN Cc1ccccc1C1(CNC(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)CCOCC1 ZINC000510549591 918993509 /nfs/dbraw/zinc/99/35/09/918993509.db2.gz MRSYGRFNDASPCI-GMAHTHKFSA-N 0 3 421.585 4.178 20 0 HIADHN CCCOc1ccc(Oc2ncccc2CNC(=O)N[C@H](C)C2=CCN(C)CC2)cc1 ZINC000510559297 919002850 /nfs/dbraw/zinc/00/28/50/919002850.db2.gz FRVJVDBMBOURCZ-GOSISDBHSA-N 0 3 424.545 4.112 20 0 HIADHN C[C@@H](NC(=O)N[C@H](C)C1=CCN(C)CC1)c1ccc(NC(=O)c2ccc(F)cc2)cc1 ZINC000510570699 919014253 /nfs/dbraw/zinc/01/42/53/919014253.db2.gz JZHXUKJLCIKSIJ-IAGOWNOFSA-N 0 3 424.520 4.089 20 0 HIADHN C[C@@H]1COCC[C@H]1CNC(=O)N(CCN(C)Cc1ccccc1)Cc1ccccc1 ZINC000510618644 919060567 /nfs/dbraw/zinc/06/05/67/919060567.db2.gz VGLRHLYUKVNGDQ-QPPBQGQZSA-N 0 3 409.574 4.003 20 0 HIADHN COc1ccc(C[C@@H](NCc2cnn(CC(F)F)c2)c2ccccc2)cc1OC ZINC000510628238 919068524 /nfs/dbraw/zinc/06/85/24/919068524.db2.gz GJRKBRZQMIOVPG-LJQANCHMSA-N 0 3 401.457 4.239 20 0 HIADHN CN(Cc1cc(F)cc2cccnc21)C[C@@H](O)COc1ccccc1C(F)(F)F ZINC000510645465 919087012 /nfs/dbraw/zinc/08/70/12/919087012.db2.gz DTZCWYOELIAYOB-QGZVFWFLSA-N 0 3 408.395 4.264 20 0 HIADHN Brc1ccc2c(c1)[C@@H](NCc1ccnc(OC3CCOCC3)c1)CC2 ZINC000510688122 919125271 /nfs/dbraw/zinc/12/52/71/919125271.db2.gz QKCZWHKFDLKRCZ-IBGZPJMESA-N 0 3 403.320 4.179 20 0 HIADHN CCCC(=O)Nc1cccc(NC(=O)NC[C@H](c2cccc(OC)c2)N2CCCC2)c1 ZINC000510701095 919139632 /nfs/dbraw/zinc/13/96/32/919139632.db2.gz KPYSCGICGDJCFG-JOCHJYFZSA-N 0 3 424.545 4.392 20 0 HIADHN CCCOc1ccc(NC(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)cc1 ZINC000510710779 919151319 /nfs/dbraw/zinc/15/13/19/919151319.db2.gz FSMKWYOHYIHIBG-RTBURBONSA-N 0 3 403.567 4.219 20 0 HIADHN O=C(Nc1ccccc1OC[C@H]1CCCCO1)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000510739425 919187184 /nfs/dbraw/zinc/18/71/84/919187184.db2.gz WZPIEQFWQKLZDC-FCHUYYIVSA-N 0 3 423.557 4.421 20 0 HIADHN CCOC1CC(CN2CCC[C@@H]2c2nc(-c3ccccc3Br)no2)C1 ZINC000510768882 919225068 /nfs/dbraw/zinc/22/50/68/919225068.db2.gz ZZUSAOVLMKDZHU-MQBCKMQZSA-N 0 3 406.324 4.451 20 0 HIADHN CC[C@H](CC1CCCC1)C(=O)N1CCC[C@H](CN2CCN(c3ccccn3)CC2)C1 ZINC000510785182 919249586 /nfs/dbraw/zinc/24/95/86/919249586.db2.gz ZDUHJEXLUYFXGU-DHIUTWEWSA-N 0 3 412.622 4.049 20 0 HIADHN COc1ccccc1CCN(C)C(=O)NC[C@H](c1cccs1)N1CCC(C)CC1 ZINC000510827674 919307345 /nfs/dbraw/zinc/30/73/45/919307345.db2.gz PLVKCYXUBTWPHS-HXUWFJFHSA-N 0 3 415.603 4.414 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)NCC2(C(F)(F)F)CCC2)N(C)C)cc1 ZINC000510864038 919355369 /nfs/dbraw/zinc/35/53/69/919355369.db2.gz CRAGHQQOVPTPEZ-QGZVFWFLSA-N 0 3 401.473 4.108 20 0 HIADHN COc1ccc([C@@H](CNC(=O)Nc2ccc(-c3csnn3)cc2)N2CCCC2)cc1 ZINC000510872987 919365587 /nfs/dbraw/zinc/36/55/87/919365587.db2.gz CCTSMAHBTCJSFU-OAQYLSRUSA-N 0 3 423.542 4.172 20 0 HIADHN COc1cc(CNCc2ccccc2-c2ccnn2C)cc(Br)c1OC ZINC000510923311 919440833 /nfs/dbraw/zinc/44/08/33/919440833.db2.gz XVNUXPISIXJIFB-UHFFFAOYSA-N 0 3 416.319 4.157 20 0 HIADHN O=C(Cc1ccccc1)N1CCC[C@@H](N[C@H]2CCCc3nn(-c4ccccc4)cc32)C1 ZINC000510934361 919455076 /nfs/dbraw/zinc/45/50/76/919455076.db2.gz YGBLNHFSAYOXBK-QPPBQGQZSA-N 0 3 414.553 4.073 20 0 HIADHN COc1cc(OC)c(CCNCc2ccc(Sc3ccccn3)o2)c(OC)c1 ZINC000510966537 919510277 /nfs/dbraw/zinc/51/02/77/919510277.db2.gz IKXPTINARFRJBZ-UHFFFAOYSA-N 0 3 400.500 4.184 20 0 HIADHN Cc1c([C@H](C)N[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)cnn1-c1ccc(F)cc1 ZINC000510991472 919547122 /nfs/dbraw/zinc/54/71/22/919547122.db2.gz ITMSCOKELYMOHK-PGRDOPGGSA-N 0 3 420.532 4.204 20 0 HIADHN Cc1[nH]c2ccc(Br)cc2c1CC(=O)N(CC(C)C)C1CCN(C)CC1 ZINC000511026124 919598578 /nfs/dbraw/zinc/59/85/78/919598578.db2.gz GHCXILZRYLCHSQ-UHFFFAOYSA-N 0 3 420.395 4.360 20 0 HIADHN COC[C@@H](N[C@H]1CCCN(C(=O)Cc2ccccc2)C1)c1cccc(C(F)(F)F)c1 ZINC000511052557 919648326 /nfs/dbraw/zinc/64/83/26/919648326.db2.gz BXXIQZMIXMCFEN-LEWJYISDSA-N 0 3 420.475 4.216 20 0 HIADHN CCc1ccc([C@H](CNC(=O)Nc2ccccc2N2C[C@@H](C)O[C@H](C)C2)N(C)C)cc1 ZINC000511085099 919686455 /nfs/dbraw/zinc/68/64/55/919686455.db2.gz IWOBMHFRBVQNML-IECBHUPTSA-N 0 3 424.589 4.287 20 0 HIADHN CN(Cc1ccc(OCC(F)(F)F)cc1)Cc1ccc(Cl)cc1-n1cncn1 ZINC000511110865 919719871 /nfs/dbraw/zinc/71/98/71/919719871.db2.gz SETFYIRGIAJYGD-UHFFFAOYSA-N 0 3 410.827 4.494 20 0 HIADHN O=C(N[C@H](c1ccccc1)c1cccnc1)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000511146777 919765245 /nfs/dbraw/zinc/76/52/45/919765245.db2.gz QOAWMDWOJHWNGP-DHIUTWEWSA-N 0 3 421.491 4.445 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)c2csc(-c3ncccc3F)n2)CC1 ZINC000511154583 919774005 /nfs/dbraw/zinc/77/40/05/919774005.db2.gz CXXPBOWZSIKDQP-UHFFFAOYSA-N 0 3 410.518 4.081 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)c1ccc(Oc2ccncc2)c(Cl)c1 ZINC000511156071 919776027 /nfs/dbraw/zinc/77/60/27/919776027.db2.gz GRBDXLKGOBSHHD-UHFFFAOYSA-N 0 3 410.905 4.126 20 0 HIADHN CCOc1ccc(OCC)c(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2)c1 ZINC000511222375 919830780 /nfs/dbraw/zinc/83/07/80/919830780.db2.gz MJMZWNPXRIJVJA-UHFFFAOYSA-N 0 3 403.498 4.219 20 0 HIADHN C[C@H](NC(=O)NC1(c2ccc(Br)cc2)CCCC1)C1=CCN(C)CC1 ZINC000511229073 919832995 /nfs/dbraw/zinc/83/29/95/919832995.db2.gz PGAMWBNSMTWVOZ-HNNXBMFYSA-N 0 3 406.368 4.168 20 0 HIADHN C[C@H](NC(=O)N1CCc2ccccc2[C@H](c2ccccc2)[C@@H]1C)C1=CCN(C)CC1 ZINC000511232289 919835747 /nfs/dbraw/zinc/83/57/47/919835747.db2.gz JZLHQIJKAGAXFX-RLSLOFABSA-N 0 3 403.570 4.425 20 0 HIADHN COc1cccc([C@H](NC(=O)N[C@@H](C)C2=CCN(C)CC2)c2ccccc2Cl)c1 ZINC000511231841 919835828 /nfs/dbraw/zinc/83/58/28/919835828.db2.gz IWZWBTSZLAZUQY-AOMKIAJQSA-N 0 3 413.949 4.388 20 0 HIADHN COc1cccc([C@H](NC(=O)N[C@H](C)C2=CCN(C)CC2)c2ccccc2Cl)c1 ZINC000511231850 919836322 /nfs/dbraw/zinc/83/63/22/919836322.db2.gz IWZWBTSZLAZUQY-ZHRRBRCNSA-N 0 3 413.949 4.388 20 0 HIADHN C[C@@H](NC(=O)NCCc1cccc(OCCCc2ccccc2)c1)C1=CCN(C)CC1 ZINC000511247860 919848170 /nfs/dbraw/zinc/84/81/70/919848170.db2.gz ASGOETPOGPCDPZ-OAQYLSRUSA-N 0 3 421.585 4.190 20 0 HIADHN C[C@H](NC(=O)N1CCC(C)(c2cccc(Br)c2)CC1)C1=CCN(C)CC1 ZINC000511248820 919850437 /nfs/dbraw/zinc/85/04/37/919850437.db2.gz NAMXMTKTDYERBG-INIZCTEOSA-N 0 3 420.395 4.163 20 0 HIADHN C[C@@H](NC(=O)N(C)CCCCCc1cc(-c2ccccc2)n[nH]1)C1=CCN(C)CC1 ZINC000511250336 919852338 /nfs/dbraw/zinc/85/23/38/919852338.db2.gz QROXYPYJUFMPJY-LJQANCHMSA-N 0 3 409.578 4.081 20 0 HIADHN C[C@@H](NC(=O)c1cccc(NC(=O)CCCc2cccs2)c1)C1=CCN(C)CC1 ZINC000511369828 919961858 /nfs/dbraw/zinc/96/18/58/919961858.db2.gz PDKHYCGMDGNVDL-QGZVFWFLSA-N 0 3 411.571 4.090 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)N[C@@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000511372114 919966675 /nfs/dbraw/zinc/96/66/75/919966675.db2.gz GEWFQLWYSRXYFD-CVDCTZTESA-N 0 3 413.537 4.067 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)N[C@H](C[C@@H]2CCOC2)c2ccccc2)c1 ZINC000511373079 919968448 /nfs/dbraw/zinc/96/84/48/919968448.db2.gz VOJAAKGHTKZEIB-LADGPHEKSA-N 0 3 409.574 4.236 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)N[C@@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000511373124 919971326 /nfs/dbraw/zinc/97/13/26/919971326.db2.gz MTCBNAKHAYCMMF-NKKJXINNSA-N 0 3 407.558 4.291 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N[C@H](C[C@H]2CCOC2)c2ccccc2)N(C)C)cc1 ZINC000511382554 919983355 /nfs/dbraw/zinc/98/33/55/919983355.db2.gz LASQGGBWEFGUOB-HUVFLSCGSA-N 0 3 409.574 4.319 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)N[C@@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000511389331 919994039 /nfs/dbraw/zinc/99/40/39/919994039.db2.gz BVAUJEAUOVREMF-REWPJTCUSA-N 0 3 413.537 4.067 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)N[C@@H](C[C@H]2CCOC2)c2ccccc2)CN1Cc1ccccc1 ZINC000511392516 920000959 /nfs/dbraw/zinc/00/09/59/920000959.db2.gz WCQDRKFIXCQDNJ-ZXMXYHOLSA-N 0 3 407.558 4.117 20 0 HIADHN CCOc1ccc(NC(=O)NCCCCN2CCN(c3cccc(C)c3)CC2)c(C)c1 ZINC000511483741 920093014 /nfs/dbraw/zinc/09/30/14/920093014.db2.gz PCBXMOAUTPTHLL-UHFFFAOYSA-N 0 3 424.589 4.426 20 0 HIADHN CCCN(CC)C(=O)c1ccc(C(=O)NC[C@H](CC)N2CCc3ccccc3C2)cc1 ZINC000511509287 920127479 /nfs/dbraw/zinc/12/74/79/920127479.db2.gz VXPRXSVFOQQZKH-DEOSSOPVSA-N 0 3 421.585 4.125 20 0 HIADHN Cc1cc(Cl)c(C(=O)Nc2ccc(C(=O)N(C)[C@H]3CCCN(C)C3)cc2)cc1C ZINC000511572262 920215803 /nfs/dbraw/zinc/21/58/03/920215803.db2.gz ITOPYTPXINQZFX-IBGZPJMESA-N 0 3 413.949 4.375 20 0 HIADHN O=C(CN[C@H](c1cccc(OC(F)(F)F)c1)C1CC1)N1CCC[C@@H](C(F)(F)F)C1 ZINC000511589222 920237258 /nfs/dbraw/zinc/23/72/58/920237258.db2.gz WUHGNPHJELWLSP-PBHICJAKSA-N 0 3 424.385 4.427 20 0 HIADHN O=C(Nc1cccc(C(=O)N2CCCCC2)c1)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000511609092 920259583 /nfs/dbraw/zinc/25/95/83/920259583.db2.gz ILLUHKVJGUXHOX-QHCPKHFHSA-N 0 3 420.557 4.271 20 0 HIADHN COc1ccc(C(=O)C2CCN(C(=O)[C@@H]3CCCN(Cc4ccccc4)C3)CC2)cc1 ZINC000511631686 920293657 /nfs/dbraw/zinc/29/36/57/920293657.db2.gz VSRUWAOBMIUAAI-HSZRJFAPSA-N 0 3 420.553 4.029 20 0 HIADHN CO[C@@H]1[C@H]2C[C@H]3CN(Cc4csc(-c5ccc(Br)cc5)n4)[C@H]1[C@H]3C2 ZINC000511642320 920306692 /nfs/dbraw/zinc/30/66/92/920306692.db2.gz XFWDPBWGVZTHNB-MZDBXJLNSA-N 0 3 405.361 4.428 20 0 HIADHN CC(=O)Nc1ccc2nc(NC(=O)[C@@H]3CCCN(Cc4ccccc4)C3)sc2c1 ZINC000511646998 920313404 /nfs/dbraw/zinc/31/34/04/920313404.db2.gz IPRFFUZSLKJZAU-QGZVFWFLSA-N 0 3 408.527 4.105 20 0 HIADHN C[C@H](CC(=O)Nc1cc(C(F)(F)F)ccc1Cl)N[C@@H]1c2ccccc2C[C@H]1O ZINC000511765306 920449049 /nfs/dbraw/zinc/44/90/49/920449049.db2.gz OZXZGCIWIGPMRB-BAXPTACRSA-N 0 3 412.839 4.324 20 0 HIADHN C[C@@H](c1ccc2ccccc2c1)N(Cc1cnc(N2CCN(C)CC2)nc1)C1CC1 ZINC000511775016 920461893 /nfs/dbraw/zinc/46/18/93/920461893.db2.gz FPOKEVAARURTRD-IBGZPJMESA-N 0 3 401.558 4.107 20 0 HIADHN COc1ccc([C@H](NC(=O)CN2C[C@H](c3ccccc3)[C@@H]3COCC[C@@H]32)C(C)C)cc1 ZINC000511795013 920490158 /nfs/dbraw/zinc/49/01/58/920490158.db2.gz HJQSLAZHDVVILS-DDRRAVBJSA-N 0 3 422.569 4.013 20 0 HIADHN CCN(CC)C(=O)c1ccc(NC(=O)CN2C[C@H](c3ccccc3)[C@H]3CCC[C@@H]32)cc1 ZINC000511842614 920557622 /nfs/dbraw/zinc/55/76/22/920557622.db2.gz KLMBITYKAMHENQ-SMIHKQSGSA-N 0 3 419.569 4.375 20 0 HIADHN CC(C)Cc1ccc([C@H](CNC(=O)N[C@@H](C)c2c(F)cncc2F)N(C)C)cc1 ZINC000511873547 920604253 /nfs/dbraw/zinc/60/42/53/920604253.db2.gz FZDVSPOBJUOAHA-YWZLYKJASA-N 0 3 404.505 4.221 20 0 HIADHN O=C(Nc1ccccc1OCC(F)(F)F)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000511882627 920617286 /nfs/dbraw/zinc/61/72/86/920617286.db2.gz USHUULYXROOAPP-UHFFFAOYSA-N 0 3 422.447 4.084 20 0 HIADHN CCn1cc([C@H]2OCCC[C@@H]2NCc2cnn(-c3ccc(C(F)(F)F)cc3)c2)cn1 ZINC000511913207 920654539 /nfs/dbraw/zinc/65/45/39/920654539.db2.gz WSRPXUHDAPVDQK-VQTJNVASSA-N 0 3 419.451 4.117 20 0 HIADHN C[C@H](CC(=O)Nc1cc(C(F)(F)F)ccc1Cl)N[C@H](CO)c1ccsc1 ZINC000511921639 920666513 /nfs/dbraw/zinc/66/65/13/920666513.db2.gz IJOHMBCMDZKKPU-MEBBXXQBSA-N 0 3 406.857 4.461 20 0 HIADHN Cc1cc([C@H](C)N[C@H](C)Cn2ncc3ccccc3c2=O)sc1Br ZINC000511924528 920670576 /nfs/dbraw/zinc/67/05/76/920670576.db2.gz AALXEULQPQGGTH-OLZOCXBDSA-N 0 3 406.349 4.268 20 0 HIADHN CCc1nn(C)cc1CN[C@@H](C)CC(=O)Nc1cc(C(F)(F)F)ccc1Cl ZINC000511957976 920719274 /nfs/dbraw/zinc/71/92/74/920719274.db2.gz RHKWMZYSQQIWNL-NSHDSACASA-N 0 3 402.848 4.162 20 0 HIADHN COc1ccccc1C[C@H](NCc1ncc(I)s1)C(C)C ZINC000511996578 920765880 /nfs/dbraw/zinc/76/58/80/920765880.db2.gz JLQZZJNWRZFBBY-ZDUSSCGKSA-N 0 3 416.328 4.113 20 0 HIADHN CN(C)Cc1cnc(CNC2CCN(Cc3ccc(Cl)c(Cl)c3)CC2)s1 ZINC000512008477 920780623 /nfs/dbraw/zinc/78/06/23/920780623.db2.gz QLFZTWBUXUDLEK-UHFFFAOYSA-N 0 3 413.418 4.266 20 0 HIADHN COc1cc(CN2CCc3cc(OC)c(OC)cc3CC2)c(SC)cc1OC ZINC000512052642 920823107 /nfs/dbraw/zinc/82/31/07/920823107.db2.gz MXHNXYGKKMXRRY-UHFFFAOYSA-N 0 3 403.544 4.044 20 0 HIADHN CC1CCN(CC(=O)N2CCC[C@H](Cc3nc(C4CCCCCC4)no3)C2)CC1 ZINC000512058603 920827801 /nfs/dbraw/zinc/82/78/01/920827801.db2.gz PAJWGZDXANBXLP-LJQANCHMSA-N 0 3 402.583 4.020 20 0 HIADHN Ic1cnc(CNC[C@H]2CCCO[C@H]2c2ccccc2)s1 ZINC000512082906 920846612 /nfs/dbraw/zinc/84/66/12/920846612.db2.gz MIBQBLPJFTUZEC-CJNGLKHVSA-N 0 3 414.312 4.005 20 0 HIADHN COc1cccc(OC)c1CNC[C@@H]1CCN(c2ccc(Br)cc2)C1 ZINC000512083266 920848100 /nfs/dbraw/zinc/84/81/00/920848100.db2.gz IOOHQDVAZHVNHT-HNNXBMFYSA-N 0 3 405.336 4.082 20 0 HIADHN Cc1c([C@H](C)N[C@@H](C)CC(=O)Nc2cc(C(F)(F)F)ccc2Cl)cnn1C ZINC000512097397 920858120 /nfs/dbraw/zinc/85/81/20/920858120.db2.gz DKTRBJHHHMQVSH-QWRGUYRKSA-N 0 3 402.848 4.469 20 0 HIADHN CO[C@@H]1C[C@@H](c2ccccc2)CC[C@H]1NC(=O)N(CCN(C)C)Cc1cccs1 ZINC000512098828 920858932 /nfs/dbraw/zinc/85/89/32/920858932.db2.gz SHJQSFAGZWLRAO-KSEOMHKRSA-N 0 3 415.603 4.173 20 0 HIADHN COc1ccc(CNc2ccc(N3CCN(C)CC3)cc2C)c(Br)c1 ZINC000512107629 920865016 /nfs/dbraw/zinc/86/50/16/920865016.db2.gz QNAOIQYWMBKKNJ-UHFFFAOYSA-N 0 3 404.352 4.130 20 0 HIADHN C[C@H](NC(=O)c1ccc(Oc2ccc(Br)cc2)nc1)C1=CCN(C)CC1 ZINC000512126888 920876560 /nfs/dbraw/zinc/87/65/60/920876560.db2.gz HYCNLBJSVGKJKM-AWEZNQCLSA-N 0 3 416.319 4.017 20 0 HIADHN Cc1cc(-c2cc(C(=O)N[C@@H](C)C3=CCN(C)CC3)c3c(C)noc3n2)c(C)s1 ZINC000512139835 920886397 /nfs/dbraw/zinc/88/63/97/920886397.db2.gz TZUDWVMZUDBILU-ZDUSSCGKSA-N 0 3 410.543 4.257 20 0 HIADHN OCC[C@@H](NC[C@@H](O)COc1ccc(Cl)cc1)c1ccc(Cl)c(Cl)c1 ZINC000512153028 920893381 /nfs/dbraw/zinc/89/33/81/920893381.db2.gz QHXKUOWYXLDKOS-RDTXWAMCSA-N 0 3 404.721 4.100 20 0 HIADHN CCN1CCN(CCC(=O)Nc2ccc(Sc3ccccc3Cl)cc2)CC1 ZINC000512162655 920899657 /nfs/dbraw/zinc/89/96/57/920899657.db2.gz CKXLNYCTAXCAJM-UHFFFAOYSA-N 0 3 403.979 4.457 20 0 HIADHN Cc1cccc2sc(N(Cc3ccccc3)C(=O)CN[C@@H]3CSC[C@H]3C)nc21 ZINC000512167310 920904041 /nfs/dbraw/zinc/90/40/41/920904041.db2.gz WWJYTIKLVVEMSI-SJLPKXTDSA-N 0 3 411.596 4.479 20 0 HIADHN COc1cc(F)c([C@H](C)NC(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)cc1OC ZINC000512197212 920943000 /nfs/dbraw/zinc/94/30/00/920943000.db2.gz ATBSUVBONSAUTK-BQFCYCMXSA-N 0 3 415.509 4.039 20 0 HIADHN COCc1ccccc1/C=C(/C)CNCC(=O)Nc1cccc(Br)c1 ZINC000512215776 920965243 /nfs/dbraw/zinc/96/52/43/920965243.db2.gz XGYZNRFBIZCBPG-GDNBJRDFSA-N 0 3 403.320 4.227 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3[nH]c(C)c(C(C)=O)c3C(C)C)c(C)c2)CC1 ZINC000512276814 921031739 /nfs/dbraw/zinc/03/17/39/921031739.db2.gz YBUJPMREJNODIR-UHFFFAOYSA-N 0 3 410.562 4.352 20 0 HIADHN CCCN(CC(=O)Nc1ccc(C)c(C)c1)C1CCN(c2cc(C)nc(C)n2)CC1 ZINC000512277637 921032690 /nfs/dbraw/zinc/03/26/90/921032690.db2.gz HDHNNDFFHXHTAH-UHFFFAOYSA-N 0 3 409.578 4.030 20 0 HIADHN CCCN(Cc1nc(-c2ccc(F)cc2)no1)C1CCN(c2cc(C)nc(C)n2)CC1 ZINC000512281072 921036095 /nfs/dbraw/zinc/03/60/95/921036095.db2.gz IUXBNNFCWCONML-UHFFFAOYSA-N 0 3 424.524 4.164 20 0 HIADHN CCCOc1cc(CN2CCC(C(=O)N3CCc4ccccc43)CC2)ccc1OC ZINC000512285353 921039441 /nfs/dbraw/zinc/03/94/41/921039441.db2.gz HFFXZRDZEVLKRL-UHFFFAOYSA-N 0 3 408.542 4.285 20 0 HIADHN CN(CC(=O)N1CCC[C@@H]1c1ccc2c(c1)OCCCO2)[C@@H]1CCc2ccccc2C1 ZINC000512323096 921072641 /nfs/dbraw/zinc/07/26/41/921072641.db2.gz LLNZIXHMLUNRPH-DHIUTWEWSA-N 0 3 420.553 4.001 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NCc2cnn(-c3ccc(C(F)(F)F)cc3)c2)cc1 ZINC000512344580 921090316 /nfs/dbraw/zinc/09/03/16/921090316.db2.gz YTCBLKLZLSZRAS-OAQYLSRUSA-N 0 3 418.463 4.292 20 0 HIADHN FC(F)(F)c1cc(Br)cc(CN[C@H]2CCO[C@@H]2c2cccnc2)c1 ZINC000512350166 921095301 /nfs/dbraw/zinc/09/53/01/921095301.db2.gz IKTRDNXIUMCPTJ-JKSUJKDBSA-N 0 3 401.226 4.483 20 0 HIADHN O[C@@H](CN[C@@H]1CCSc2ccc(Br)cc21)COc1ccc(F)cc1 ZINC000513472480 921831714 /nfs/dbraw/zinc/83/17/14/921831714.db2.gz FXPVWPXRFRRFNG-WMLDXEAASA-N 0 3 412.324 4.155 20 0 HIADHN CCOc1cc(CNC2(CO)CC2)cc(Br)c1OCc1ccccc1 ZINC000513513396 921860381 /nfs/dbraw/zinc/86/03/81/921860381.db2.gz SGISEJWVLPBHRJ-UHFFFAOYSA-N 0 3 406.320 4.041 20 0 HIADHN O[C@@H](CN[C@H](Cc1ccccn1)c1cccnc1)COc1cccc(Cl)c1Cl ZINC000513546447 921883670 /nfs/dbraw/zinc/88/36/70/921883670.db2.gz XWKPLYFSGBEMAP-PKOBYXMFSA-N 0 3 418.324 4.097 20 0 HIADHN CN(C)C[C@@H](NC(=O)Cc1cscc1Br)c1ccc(Cl)cc1 ZINC000513573957 921906768 /nfs/dbraw/zinc/90/67/68/921906768.db2.gz SVEDPLSQSDOIDA-OAHLLOKOSA-N 0 3 401.757 4.126 20 0 HIADHN c1ccc(COc2ccc(CNC[C@H]3COCCO3)c(OCc3ccccc3)c2)cc1 ZINC000513627213 921955037 /nfs/dbraw/zinc/95/50/37/921955037.db2.gz MVXDVVHJXYVMOC-VWLOTQADSA-N 0 3 419.521 4.350 20 0 HIADHN c1c(CN2CCCN(c3cccnn3)CC2)c(-c2ccccc2)nn1Cc1ccccc1 ZINC000513646614 921970209 /nfs/dbraw/zinc/97/02/09/921970209.db2.gz AFFVCDFMLNMEMV-UHFFFAOYSA-N 0 3 424.552 4.101 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2CN2CCCN(c3cccnn3)CC2)cc1 ZINC000513659249 921980787 /nfs/dbraw/zinc/98/07/87/921980787.db2.gz BAGIFNLOHAYSQH-UHFFFAOYSA-N 0 3 424.552 4.350 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)c(C)c1CN1CCC[C@@H](c2nnc3n2CCC3)C1 ZINC000513684299 922005312 /nfs/dbraw/zinc/00/53/12/922005312.db2.gz QSYCWSYEQWBOCY-QGZVFWFLSA-N 0 3 410.953 4.060 20 0 HIADHN FC(F)(F)c1ccc(-c2ccc(CN3CCCN(c4cccnn4)CC3)o2)cc1 ZINC000513707818 922027347 /nfs/dbraw/zinc/02/73/47/922027347.db2.gz JHXJGMKEIZELJP-UHFFFAOYSA-N 0 3 402.420 4.468 20 0 HIADHN COc1ccc([C@@H](Cc2ccncc2)N[C@H]2CC(=O)N(c3ccccc3Cl)C2)cc1 ZINC000513707378 922027760 /nfs/dbraw/zinc/02/77/60/922027760.db2.gz BXGAIRXLYLUPEJ-SIKLNZKXSA-N 0 3 421.928 4.423 20 0 HIADHN CN(CCCc1cc(-c2ccc(F)cc2)n(C)n1)Cc1cncc(Br)c1 ZINC000513708759 922029465 /nfs/dbraw/zinc/02/94/65/922029465.db2.gz WZBVNPSOLYQAGD-UHFFFAOYSA-N 0 3 417.326 4.448 20 0 HIADHN C[C@H](CCOCc1ccccc1)NC(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000513716279 922036703 /nfs/dbraw/zinc/03/67/03/922036703.db2.gz ZIFYZRKWSQBTDL-OAQYLSRUSA-N 0 3 409.574 4.288 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2CN2CCC(N3CCCC3=O)CC2)cc1 ZINC000513751148 922070600 /nfs/dbraw/zinc/07/06/00/922070600.db2.gz XSLGGXPXKHUEAH-UHFFFAOYSA-N 0 3 414.553 4.435 20 0 HIADHN C[C@@H](NCc1ccc(CN2CCc3ccccc32)cc1)c1ccc2c(c1)OCC(=O)N2 ZINC000513758618 922078392 /nfs/dbraw/zinc/07/83/92/922078392.db2.gz AKBZDAWLKKYFLR-GOSISDBHSA-N 0 3 413.521 4.431 20 0 HIADHN CN1CCN(c2ncccc2CN[C@@H]2CC3(CCCCC3)Oc3ccccc32)CC1 ZINC000513786738 922112983 /nfs/dbraw/zinc/11/29/83/922112983.db2.gz MLQKDNMBBQQGAG-JOCHJYFZSA-N 0 3 406.574 4.150 20 0 HIADHN CN1CCN(c2cc(CN[C@H]3CC4(CCCCC4)Oc4ccccc43)ccn2)CC1 ZINC000513787949 922114430 /nfs/dbraw/zinc/11/44/30/922114430.db2.gz HZGGGAWGAJDMDD-QFIPXVFZSA-N 0 3 406.574 4.150 20 0 HIADHN COc1ccc([C@@H](CNC(=O)Cc2cccc3ccc(OC)cc32)N2CCCC2)cc1 ZINC000513806169 922130427 /nfs/dbraw/zinc/13/04/27/922130427.db2.gz DSASNMXRGZFCGF-RUZDIDTESA-N 0 3 418.537 4.353 20 0 HIADHN CC(=O)N(C)C1CCN(C[C@H](O)COc2ccc(C(C)(C)CC(C)(C)C)cc2)CC1 ZINC000513820232 922143502 /nfs/dbraw/zinc/14/35/02/922143502.db2.gz LORNNOFCQBAOSE-QFIPXVFZSA-N 0 3 418.622 4.083 20 0 HIADHN COc1cc(Cl)c(C(=O)N2CCCN(CCCc3ccccc3)CC2)cc1OC ZINC000513821601 922145274 /nfs/dbraw/zinc/14/52/74/922145274.db2.gz LVHMAEWLWMZYBH-UHFFFAOYSA-N 0 3 416.949 4.138 20 0 HIADHN COc1ccc(Br)cc1CN(C)C[C@@H]1CCN(C(=O)c2ccccc2)C1 ZINC000513962572 922281328 /nfs/dbraw/zinc/28/13/28/922281328.db2.gz AJBMUECDSANVPH-INIZCTEOSA-N 0 3 417.347 4.052 20 0 HIADHN C[C@@H](c1ccccc1Cl)N1CCN(C[C@@H]2CCN(C(=O)c3ccccc3)C2)CC1 ZINC000513965289 922283130 /nfs/dbraw/zinc/28/31/30/922283130.db2.gz WSNQEBIFJLCERZ-PMACEKPBSA-N 0 3 411.977 4.181 20 0 HIADHN CC(C)c1ccc(CN2CCN(C[C@@H]3CCN(C(=O)c4ccccc4)C3)CC2)cc1 ZINC000513965792 922284338 /nfs/dbraw/zinc/28/43/38/922284338.db2.gz FWYRGPUFWLOEMR-QHCPKHFHSA-N 0 3 405.586 4.090 20 0 HIADHN CSc1cc2c(cc1NC(=O)N[C@H](CN1CCCC1)c1ccccc1)OCCO2 ZINC000513976514 922296933 /nfs/dbraw/zinc/29/69/33/922296933.db2.gz XVLCPRICFFOHIA-GOSISDBHSA-N 0 3 413.543 4.138 20 0 HIADHN COc1cc(Cl)c(C(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)cc1OC ZINC000514007446 922332415 /nfs/dbraw/zinc/33/24/15/922332415.db2.gz IXYAPEVJFGWSOD-INIZCTEOSA-N 0 3 402.922 4.094 20 0 HIADHN CC[C@H](C)N(Cc1nc2ccccc2c(=O)[nH]1)C[C@H]1CCN(C(=O)c2ccccc2)C1 ZINC000514118808 922452145 /nfs/dbraw/zinc/45/21/45/922452145.db2.gz NJUGHYIRXPMGTF-OALUTQOASA-N 0 3 418.541 4.098 20 0 HIADHN C[C@H](NC(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1)c1ccc(NC(=O)C2CC2)cc1 ZINC000514141070 922474429 /nfs/dbraw/zinc/47/44/29/922474429.db2.gz AVRMUYOCUOUYCV-BSRJHKFKSA-N 0 3 420.557 4.231 20 0 HIADHN CC(C)COC[C@@H](NC(=O)NC[C@H](c1cccs1)N1CCCC1)c1ccco1 ZINC000514150166 922485296 /nfs/dbraw/zinc/48/52/96/922485296.db2.gz YEOBEFBNKXXVBR-QZTJIDSGSA-N 0 3 405.564 4.191 20 0 HIADHN Cc1nc2ccccc2n1CCCNC(=O)NC[C@@H](c1ccc(C)cc1)N1CCCC1 ZINC000514149456 922485926 /nfs/dbraw/zinc/48/59/26/922485926.db2.gz MZCKFQFHPBSAPR-DEOSSOPVSA-N 0 3 419.573 4.180 20 0 HIADHN O=C(NCc1ccc(Oc2cccc(F)c2)nc1)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000514158923 922496969 /nfs/dbraw/zinc/49/69/69/922496969.db2.gz YAUSXHQUPKLBNQ-OAQYLSRUSA-N 0 3 420.488 4.087 20 0 HIADHN CCn1c2ccccc2nc1[C@H]1CCCN1C(=O)NC[C@H](Cc1ccccc1)N(C)C ZINC000514161504 922500174 /nfs/dbraw/zinc/50/01/74/922500174.db2.gz BEWKHYXQCNINPA-NZQKXSOJSA-N 0 3 419.573 4.076 20 0 HIADHN CCn1c2ccccc2nc1[C@@H]1CCCN1C(=O)NC[C@H](Cc1ccccc1)N(C)C ZINC000514161506 922500996 /nfs/dbraw/zinc/50/09/96/922500996.db2.gz BEWKHYXQCNINPA-REWPJTCUSA-N 0 3 419.573 4.076 20 0 HIADHN C[C@@H](NC(=O)N(CCN(C)C)Cc1ccccn1)c1ccc(Oc2cccnc2)cc1 ZINC000514170852 922509488 /nfs/dbraw/zinc/50/94/88/922509488.db2.gz VIGCKAKCNBJPMW-LJQANCHMSA-N 0 3 419.529 4.103 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)CN2CCC[C@H]2Cc2ccccc2C)c(OC)c1 ZINC000514171180 922509642 /nfs/dbraw/zinc/50/96/42/922509642.db2.gz YVIDBJHISVXASC-URXFXBBRSA-N 0 3 422.569 4.383 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N[C@H](C)c2ccc(Br)cc2)N(C)C)cc1 ZINC000514181129 922519957 /nfs/dbraw/zinc/51/99/57/922519957.db2.gz ZUUAZXZYSHANMD-DNVCBOLYSA-N 0 3 404.352 4.421 20 0 HIADHN CCN(Cc1ccc(OC)c(OC)c1)C(=O)CN1CCC[C@H]1Cc1ccccc1C ZINC000514181005 922520014 /nfs/dbraw/zinc/52/00/14/922520014.db2.gz YNKVYZVYVMTRKC-QFIPXVFZSA-N 0 3 410.558 4.068 20 0 HIADHN COc1ccc(OC)c([C@@H]2CCCN2C(=O)CN2CCC[C@@H]2Cc2ccccc2C)c1 ZINC000514187652 922527754 /nfs/dbraw/zinc/52/77/54/922527754.db2.gz ZCAIDHWRQVADHS-QPPBQGQZSA-N 0 3 422.569 4.383 20 0 HIADHN CC[C@H]1C[C@H](CC(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)CCO1 ZINC000514196410 922535540 /nfs/dbraw/zinc/53/55/40/922535540.db2.gz YIGNYCBFIXBCMT-APWZRJJASA-N 0 3 400.485 4.191 20 0 HIADHN COc1cccc([C@H](CNC(=O)NCc2ccc(C(F)(F)F)cc2)N2CCCC2)c1 ZINC000514197259 922535577 /nfs/dbraw/zinc/53/55/77/922535577.db2.gz LGGZZLFVGQRXBO-FQEVSTJZSA-N 0 3 421.463 4.350 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@H](C)COc1ccc(F)cc1F)c1ccsc1 ZINC000514221023 922554983 /nfs/dbraw/zinc/55/49/83/922554983.db2.gz FGUXMTFKOAPISU-RDTXWAMCSA-N 0 3 411.518 4.176 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCc1cccc(Br)c1)c1ccsc1 ZINC000514223172 922558532 /nfs/dbraw/zinc/55/85/32/922558532.db2.gz VDOBQAUYBPKXHR-QGZVFWFLSA-N 0 3 410.381 4.393 20 0 HIADHN Cc1nc(-c2ccc(CNC(=O)N[C@H]3CCN(Cc4ccccc4)C3)s2)cs1 ZINC000514438645 922627192 /nfs/dbraw/zinc/62/71/92/922627192.db2.gz QVQABMNAHLVWSG-KRWDZBQOSA-N 0 3 412.584 4.254 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)c1ccc2[nH]c(C(F)F)nc2c1 ZINC000514541596 922688914 /nfs/dbraw/zinc/68/89/14/922688914.db2.gz DRHRXNHMMDZRSJ-UHFFFAOYSA-N 0 3 400.473 4.137 20 0 HIADHN COc1ccc([C@H](CNC(=O)CN(C)[C@H](C)c2ccccc2)N2CCCCC2)cc1 ZINC000514745349 922778704 /nfs/dbraw/zinc/77/87/04/922778704.db2.gz NYCMKKATNWUKKA-YKSBVNFPSA-N 0 3 409.574 4.031 20 0 HIADHN C[C@H](NCC(=O)Nc1ccc(CN2CCOCC2)cc1)c1ccc(F)c2ccccc21 ZINC000514753658 922783447 /nfs/dbraw/zinc/78/34/47/922783447.db2.gz HUGRQPJSSCAMNE-SFHVURJKSA-N 0 3 421.516 4.100 20 0 HIADHN COCCCN(C(=O)c1sc(-c2ccc(Cl)cc2)nc1C)C1CCN(C)CC1 ZINC000514763384 922792443 /nfs/dbraw/zinc/79/24/43/922792443.db2.gz GRZZHXXJEYGORS-UHFFFAOYSA-N 0 3 421.994 4.345 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)Nc1ccc(Oc2cccnc2)nc1 ZINC000514956684 922852638 /nfs/dbraw/zinc/85/26/38/922852638.db2.gz RYZWFDGOQKQEKW-NRFANRHFSA-N 0 3 403.486 4.228 20 0 HIADHN CCOCCOc1ccc(Br)cc1CN1CC[C@H](C2CCOCC2)C1 ZINC000514956414 922852740 /nfs/dbraw/zinc/85/27/40/922852740.db2.gz HHKYGMHTDJKTTF-KRWDZBQOSA-N 0 3 412.368 4.113 20 0 HIADHN CC(C)N(Cc1ccccc1)C(=O)[C@H](C)N[C@@H]1CCN(C)[C@H]1c1ccc(F)c(F)c1 ZINC000515017676 922880249 /nfs/dbraw/zinc/88/02/49/922880249.db2.gz CUMHYCNFKMPSBK-IMRHEYAYSA-N 0 3 415.528 4.125 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)N[C@@H](C)c1nc2ccccc2n1C(F)F ZINC000515086836 922899523 /nfs/dbraw/zinc/89/95/23/922899523.db2.gz GGYVAELALSCFNJ-CVEARBPZSA-N 0 3 415.488 4.312 20 0 HIADHN COc1ccc2[nH]cc(CC(=O)NC[C@H](c3cccs3)N3CCC(C)CC3)c2c1 ZINC000515088743 922902522 /nfs/dbraw/zinc/90/25/22/922902522.db2.gz IVTXSMHTIAWVQO-OAQYLSRUSA-N 0 3 411.571 4.370 20 0 HIADHN C[C@@H](NCc1cccc(COCc2ccco2)c1)C(=O)N1CCc2sccc2C1 ZINC000515210069 922993121 /nfs/dbraw/zinc/99/31/21/922993121.db2.gz CBDZXZCAUMUPTG-QGZVFWFLSA-N 0 3 410.539 4.121 20 0 HIADHN COC(=O)c1cccc(NC(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)c1 ZINC000515254808 923021262 /nfs/dbraw/zinc/02/12/62/923021262.db2.gz RBLUMZMRXUSFIY-GOSISDBHSA-N 0 3 401.532 4.129 20 0 HIADHN Cc1ccc(Oc2ccccc2NC(=O)C(=O)NC[C@H](C)N2CCCC[C@H]2C)cc1 ZINC000515277872 923031619 /nfs/dbraw/zinc/03/16/19/923031619.db2.gz MHLQMXVDLFUCRB-MOPGFXCFSA-N 0 3 409.530 4.105 20 0 HIADHN COCCCN(C(=O)c1ccc2c(ccn2Cc2ccccc2)c1)C1CCN(C)CC1 ZINC000515360605 923065828 /nfs/dbraw/zinc/06/58/28/923065828.db2.gz VNAFWHFYNISUPM-UHFFFAOYSA-N 0 3 419.569 4.263 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1cnc2c(cnn2C(C)C)c1)c1cccc(OC)c1 ZINC000515415148 923090164 /nfs/dbraw/zinc/09/01/64/923090164.db2.gz LTLFDIAJVZIAIM-OAQYLSRUSA-N 0 3 424.549 4.225 20 0 HIADHN CCc1noc(-c2ccc(C)c(NC(=O)N[C@H]3CCN(Cc4ccccc4)[C@@H]3C)c2)n1 ZINC000515461088 923117931 /nfs/dbraw/zinc/11/79/31/923117931.db2.gz FBEDBKKNMZAFOL-XLIONFOSSA-N 0 3 419.529 4.392 20 0 HIADHN COc1ccc(CN(C)C[C@@H](O)CO[C@H]2CCCc3ccccc32)cc1OC(F)F ZINC000515548633 923168525 /nfs/dbraw/zinc/16/85/25/923168525.db2.gz OTZRDKMXQTWPHF-QUCCMNQESA-N 0 3 421.484 4.184 20 0 HIADHN Cc1cc(Br)cn2c(CN[C@H](c3ccccc3)C(C)(C)CO)cnc12 ZINC000515710709 923293894 /nfs/dbraw/zinc/29/38/94/923293894.db2.gz YFOJCZIWIXMEOF-GOSISDBHSA-N 0 3 402.336 4.255 20 0 HIADHN CSc1ccc(NC(=O)[C@H](C)N[C@@H](C)c2ccc(NC(=O)NC3CC3)cc2)cc1 ZINC000515756242 923329340 /nfs/dbraw/zinc/32/93/40/923329340.db2.gz SNSVAFKDKZFROX-GJZGRUSLSA-N 0 3 412.559 4.370 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)N3CCC[C@@H]3C3CCCC3)CC2)c1 ZINC000515803873 923362370 /nfs/dbraw/zinc/36/23/70/923362370.db2.gz VQVOUECZOPWCBQ-XMMPIXPASA-N 0 3 412.622 4.261 20 0 HIADHN CCOc1ccc(NC(=O)NC[C@@H](c2ccc(OC)cc2)N2CCCC2)cc1F ZINC000515808236 923363779 /nfs/dbraw/zinc/36/37/79/923363779.db2.gz UYQPIOPQBYFUSE-FQEVSTJZSA-N 0 3 401.482 4.192 20 0 HIADHN CCSCc1ccc(C(=O)NCCCCN2CCN(c3ccccc3)CC2)cc1 ZINC000515809901 923365572 /nfs/dbraw/zinc/36/55/72/923365572.db2.gz ZLJGPGOBIIGKBH-UHFFFAOYSA-N 0 3 411.615 4.272 20 0 HIADHN O=C(NCCCCN1CCN(Cc2ccccc2)CC1)c1cccc(C(F)(F)F)c1 ZINC000515833267 923382606 /nfs/dbraw/zinc/38/26/06/923382606.db2.gz OTDBKBUKYYWLQJ-UHFFFAOYSA-N 0 3 419.491 4.033 20 0 HIADHN CC(C)Oc1cccc([C@H](C)NC(=O)N(CCN(C)C)Cc2ccccc2F)c1 ZINC000515835741 923384491 /nfs/dbraw/zinc/38/44/91/923384491.db2.gz YFZYQGNHQDFJRB-SFHVURJKSA-N 0 3 401.526 4.447 20 0 HIADHN COc1cccc([C@@H](CNC(=O)NCc2cc3c(s2)CCCC3)N2CCCC2)c1 ZINC000515842102 923387541 /nfs/dbraw/zinc/38/75/41/923387541.db2.gz SPJRFOJJMUKPDG-OAQYLSRUSA-N 0 3 413.587 4.272 20 0 HIADHN CC[C@H](NC(=O)NC[C@H](c1ccccc1)N1CCCC1)c1ccc2c(c1)OCCO2 ZINC000515865641 923398930 /nfs/dbraw/zinc/39/89/30/923398930.db2.gz QAHKFBUBDLRHLW-LEWJYISDSA-N 0 3 409.530 4.045 20 0 HIADHN CC(C)C1CCC(N2CCN(c3nnc(C4CC4)n3C[C@@H]3CCCCO3)CC2)CC1 ZINC000515876376 923408613 /nfs/dbraw/zinc/40/86/13/923408613.db2.gz AGAFOSRAGYYCCX-VTLFHKLASA-N 0 3 415.626 4.061 20 0 HIADHN CSc1ncc(Cl)c(C(=O)NC[C@H](c2ccccc2)N2CCC(C)CC2)n1 ZINC000515980442 923477009 /nfs/dbraw/zinc/47/70/09/923477009.db2.gz IOZSIQQNFMXRBY-QGZVFWFLSA-N 0 3 404.967 4.055 20 0 HIADHN COc1cc(C(=O)NC[C@H](c2ccccc2)N2CCC(C)CC2)ccc1OC(F)F ZINC000515982833 923478884 /nfs/dbraw/zinc/47/88/84/923478884.db2.gz CSRHATWSEOKNTP-LJQANCHMSA-N 0 3 418.484 4.500 20 0 HIADHN COC(=O)c1ccc(CN[C@@H]2CCO[C@H](c3ccc(F)cc3)C2)c(Br)c1 ZINC000516076574 923530169 /nfs/dbraw/zinc/53/01/69/923530169.db2.gz OFFLYBVWKWCWND-MJGOQNOKSA-N 0 3 422.294 4.385 20 0 HIADHN COc1ccc(C(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)cc1Br ZINC000516204844 923598319 /nfs/dbraw/zinc/59/83/19/923598319.db2.gz WJYKMZDBKSHKTR-RHSMWYFYSA-N 0 3 403.320 4.023 20 0 HIADHN COc1ccccc1[C@@H](C)NC(=O)[C@H](C)N1CCC(CCc2ccc(O)cc2)CC1 ZINC000516298242 923652286 /nfs/dbraw/zinc/65/22/86/923652286.db2.gz BPLAXPQQKJDPNR-MOPGFXCFSA-N 0 3 410.558 4.311 20 0 HIADHN COc1ccccc1[C@H](C)NC(=O)[C@@H](C)N1CCC(CCc2ccc(O)cc2)CC1 ZINC000516298244 923652710 /nfs/dbraw/zinc/65/27/10/923652710.db2.gz BPLAXPQQKJDPNR-RBUKOAKNSA-N 0 3 410.558 4.311 20 0 HIADHN CCN(CC)C(=O)c1cccc(NC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)c1 ZINC000516329251 923668726 /nfs/dbraw/zinc/66/87/26/923668726.db2.gz VLGAJJZRVCKLSH-FQEVSTJZSA-N 0 3 411.521 4.158 20 0 HIADHN COc1ccc([C@@H]2CCCCCN2C(=O)[C@@H]2CCCN(Cc3cccnc3)C2)cc1 ZINC000516331373 923670637 /nfs/dbraw/zinc/67/06/37/923670637.db2.gz VYLSCUDYYLLWNQ-VWNXMTODSA-N 0 3 407.558 4.446 20 0 HIADHN C[C@@H]1CCCCN1CCNC(=O)c1ccccc1SCc1cn2ccccc2n1 ZINC000516392336 923708701 /nfs/dbraw/zinc/70/87/01/923708701.db2.gz QQZNVLAHJVCQLH-GOSISDBHSA-N 0 3 408.571 4.231 20 0 HIADHN CC[C@H](N[C@@H](C)c1ccc(OC)c(OC)c1C)c1ccccc1OCC(=O)N(C)C ZINC000516498485 923760355 /nfs/dbraw/zinc/76/03/55/923760355.db2.gz BJHGVPHINQNFMX-PXNSSMCTSA-N 0 3 414.546 4.281 20 0 HIADHN CC(C)CC(=O)Nc1ccc(NC(=O)N[C@@H]2CCN(Cc3ccccc3)[C@@H]2C)cc1 ZINC000516657344 923830912 /nfs/dbraw/zinc/83/09/12/923830912.db2.gz XZMCBUSEAZIFKS-XMSQKQJNSA-N 0 3 408.546 4.456 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)NCCSCc2ccccc2F)C1 ZINC000516708152 923855746 /nfs/dbraw/zinc/85/57/46/923855746.db2.gz AFUUTGOSBXCHHI-PXNSSMCTSA-N 0 3 401.551 4.194 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N(C)Cc2csc(Br)c2)C1 ZINC000516708999 923857330 /nfs/dbraw/zinc/85/73/30/923857330.db2.gz RTOZJLDHSGXSKB-PBHICJAKSA-N 0 3 422.392 4.488 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)NC[C@H]2CCCO[C@H]2c2ccccc2)CC1 ZINC000516715987 923859955 /nfs/dbraw/zinc/85/99/55/923859955.db2.gz VCDQPOAMGQRDIQ-OFNKIYASSA-N 0 3 411.546 4.053 20 0 HIADHN Cc1cc(=O)[nH]c2cc(C(=O)NC[C@@H](c3ccc(OC(C)C)cc3)N(C)C)ccc12 ZINC000516810706 923897814 /nfs/dbraw/zinc/89/78/14/923897814.db2.gz NJCHVMJGQWYCOB-QFIPXVFZSA-N 0 3 407.514 4.069 20 0 HIADHN O=C(NCc1nc2cc(Cl)ccc2s1)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000516836550 923912493 /nfs/dbraw/zinc/91/24/93/923912493.db2.gz ZZMFTWVISHNPRM-QGZVFWFLSA-N 0 3 414.962 4.414 20 0 HIADHN Cc1nc(-c2ccccc2)oc1C(=O)NC[C@H](c1ccc(OC(C)C)cc1)N(C)C ZINC000516888593 923926797 /nfs/dbraw/zinc/92/67/97/923926797.db2.gz ZLWFAUCWNRPIGD-OAQYLSRUSA-N 0 3 407.514 4.470 20 0 HIADHN C[C@@H](Nc1cnn(-c2ccc(F)cc2F)c(=O)c1Cl)[C@H](c1ccccc1)N(C)C ZINC000516899918 923934602 /nfs/dbraw/zinc/93/46/02/923934602.db2.gz OIELEGHRLMJRQW-ZUOKHONESA-N 0 3 418.875 4.267 20 0 HIADHN CCOc1cc(C[NH2+]C[C@H]2CCN(c3ccccc3)C2)cc(Br)c1[O-] ZINC000516989798 923954056 /nfs/dbraw/zinc/95/40/56/923954056.db2.gz LZCPYFQWZSEQLS-OAHLLOKOSA-N 0 3 405.336 4.170 20 0 HIADHN CC(C)[C@@H](NC[C@@H](O)CS(=O)(=O)c1cccs1)c1ccc(C(C)(C)C)cc1 ZINC000517045623 923971750 /nfs/dbraw/zinc/97/17/50/923971750.db2.gz FFRJKFGWNJLJGW-UYAOXDASSA-N 0 3 409.617 4.167 20 0 HIADHN CN(C)CCN(C[C@@H]1CCCO1)C(=O)c1ccc(Oc2cccc(Cl)c2)cc1 ZINC000517085206 923988451 /nfs/dbraw/zinc/98/84/51/923988451.db2.gz VXZXSOKMFSAGCC-NRFANRHFSA-N 0 3 402.922 4.315 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)N1CCn2cccc2[C@@H]1c1ccccc1 ZINC000517111651 924003579 /nfs/dbraw/zinc/00/35/79/924003579.db2.gz WFOWCCRTMPZMNI-DQEYMECFSA-N 0 3 414.553 4.440 20 0 HIADHN O=C(CCC(=O)N1CC[C@@]2(CCN(Cc3ccccc3)C2)C1)c1ccc(Cl)cc1 ZINC000517252356 924062957 /nfs/dbraw/zinc/06/29/57/924062957.db2.gz PYSBILATEBJTRJ-XMMPIXPASA-N 0 3 410.945 4.428 20 0 HIADHN Cc1nc(CCC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)oc1-c1ccccc1 ZINC000517352704 924125955 /nfs/dbraw/zinc/12/59/55/924125955.db2.gz CIMLYUWNDITDMK-QFIPXVFZSA-N 0 3 403.526 4.363 20 0 HIADHN CN1CCN(Cc2ccc(CNC(=O)[C@H]3C[C@@H]3c3cccc4ccccc43)cc2)CC1 ZINC000517406699 924161136 /nfs/dbraw/zinc/16/11/36/924161136.db2.gz FZEXZGHSQAKUKW-FTJBHMTQSA-N 0 3 413.565 4.007 20 0 HIADHN Cc1c(C(=O)N2CCC(N3CCc4ccccc4C3)CC2)[nH]c2c1C(=O)CC(C)(C)C2 ZINC000517447801 924196600 /nfs/dbraw/zinc/19/66/00/924196600.db2.gz PXYUHIJXOINJNT-UHFFFAOYSA-N 0 3 419.569 4.141 20 0 HIADHN Cc1noc(C[C@H](NC[C@H](O)CO[C@@H](C)c2ccc(Cl)cc2)c2ccccc2)n1 ZINC000517476550 924217850 /nfs/dbraw/zinc/21/78/50/924217850.db2.gz DQNPCIHXQSBDNX-JHVJFLLYSA-N 0 3 415.921 4.044 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)NCc2cccnc2OC2CCCC2)C1 ZINC000517541772 924254136 /nfs/dbraw/zinc/25/41/36/924254136.db2.gz VULAPDLWNLCAJL-GHTZIAJQSA-N 0 3 408.546 4.038 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)Nc2ccc(NC(C)=O)cc2Cl)N(C)C)cc1 ZINC000517573355 926687452 /nfs/dbraw/zinc/68/74/52/926687452.db2.gz ZMVWEWDJAPYNGO-HXUWFJFHSA-N 0 3 402.926 4.285 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)c1[nH]c2ccc(F)cc2c1Cl ZINC000517601696 926709656 /nfs/dbraw/zinc/70/96/56/926709656.db2.gz WBKQAQAHUVQVRA-KRWDZBQOSA-N 0 3 414.912 4.482 20 0 HIADHN O=C(CN(Cc1ccccc1)C1CCCCC1)NC[C@H]1CCN(c2ccccc2)C1 ZINC000517626128 926734119 /nfs/dbraw/zinc/73/41/19/926734119.db2.gz DQZMBZSQYADGLH-HSZRJFAPSA-N 0 3 405.586 4.464 20 0 HIADHN O=C(CN(Cc1ccccc1)C1CCCCC1)NC[C@@H]1CCN(c2ccccc2)C1 ZINC000517626130 926734447 /nfs/dbraw/zinc/73/44/47/926734447.db2.gz DQZMBZSQYADGLH-QHCPKHFHSA-N 0 3 405.586 4.464 20 0 HIADHN CCCC(=O)Nc1cccc(CNC(=O)[C@H](C)N2CCC(Cc3ccccc3)CC2)c1 ZINC000517664434 926771232 /nfs/dbraw/zinc/77/12/32/926771232.db2.gz YZJYBFYPYWTFST-FQEVSTJZSA-N 0 3 421.585 4.385 20 0 HIADHN C[C@@H](CN1CCCCC1)NC(=O)C(=O)Nc1ccccc1Oc1ccc(Cl)cc1 ZINC000517919105 926890054 /nfs/dbraw/zinc/89/00/54/926890054.db2.gz CHLCHTKBZKFLCX-INIZCTEOSA-N 0 3 415.921 4.061 20 0 HIADHN C[C@H](CN1CCCCC1)NC(=O)C(=O)Nc1ccccc1Oc1ccc(Cl)cc1 ZINC000517919106 926890254 /nfs/dbraw/zinc/89/02/54/926890254.db2.gz CHLCHTKBZKFLCX-MRXNPFEDSA-N 0 3 415.921 4.061 20 0 HIADHN COc1ccc(-c2nc(C)c(C(=O)NCCN3[C@@H](C)CCC[C@@H]3C)s2)cc1OC ZINC000518070974 927006552 /nfs/dbraw/zinc/00/65/52/927006552.db2.gz ZUOJAPKSNYZBJK-GJZGRUSLSA-N 0 3 417.575 4.128 20 0 HIADHN CC(C)N1CC[C@H](NCc2cc(F)cc3c2OCOC3)[C@@H]1c1ccc(F)c(F)c1 ZINC000518221987 927087742 /nfs/dbraw/zinc/08/77/42/927087742.db2.gz LAXMCTFBYQEBSD-SFTDATJTSA-N 0 3 406.448 4.284 20 0 HIADHN O=C(c1ccc(CNCc2cccc(OCC3CCCCC3)c2)cc1)N1CCOCC1 ZINC000518278355 927135145 /nfs/dbraw/zinc/13/51/45/927135145.db2.gz OFQUFYCVMFIZOE-UHFFFAOYSA-N 0 3 422.569 4.408 20 0 HIADHN CCN1CCCC[C@@H]1C(=O)N1CCc2c(cccc2NC(=O)Nc2ccccc2)C1 ZINC000518337076 927202584 /nfs/dbraw/zinc/20/25/84/927202584.db2.gz XVXNBEKDBSDRJX-JOCHJYFZSA-N 0 3 406.530 4.090 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N(C)Cc2ccccc2Br)C1 ZINC000518403358 927244494 /nfs/dbraw/zinc/24/44/94/927244494.db2.gz KAWZDYUXOGBMSJ-VQIMIIECSA-N 0 3 416.363 4.426 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)NCc2cccc(OCC(F)(F)F)c2)C1 ZINC000518403655 927245237 /nfs/dbraw/zinc/24/52/37/927245237.db2.gz QPMPJUFQKFUZTO-APWZRJJASA-N 0 3 421.463 4.262 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)NCc2cc(F)ccc2Br)C1 ZINC000518407099 927247622 /nfs/dbraw/zinc/24/76/22/927247622.db2.gz AFKBBGIFDYYFTD-KDOFPFPSSA-N 0 3 420.326 4.223 20 0 HIADHN OC[C@@]1(CNCc2cc(Br)ccc2OC(F)F)C[C@@H]1c1ccccc1 ZINC000518445216 927278538 /nfs/dbraw/zinc/27/85/38/927278538.db2.gz CRPXFHWCMYVYOF-APWZRJJASA-N 0 3 412.274 4.306 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)N(Cc1ccccc1)C[C@@H]1CCCO1 ZINC000518475405 927296429 /nfs/dbraw/zinc/29/64/29/927296429.db2.gz ZQFXDYQAHRTXRC-ZEQRLZLVSA-N 0 3 407.558 4.214 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N(C)Cc2cccc(Br)c2)C1 ZINC000518499811 927310436 /nfs/dbraw/zinc/31/04/36/927310436.db2.gz MCJQWLPDOVMDON-OXQOHEQNSA-N 0 3 416.363 4.426 20 0 HIADHN CN(C)[C@H](CNC(=O)NCc1ccc(Oc2cccnc2)c(F)c1)c1ccccc1 ZINC000518522784 927326069 /nfs/dbraw/zinc/32/60/69/927326069.db2.gz NFZZOYOIXFAMEE-OAQYLSRUSA-N 0 3 408.477 4.115 20 0 HIADHN COc1ccc2[nH]cc(C3CCN([C@@H](C)C(=O)NCCc4ccccc4)CC3)c2c1 ZINC000518576797 927356451 /nfs/dbraw/zinc/35/64/51/927356451.db2.gz YBBPPAIAOCPMMQ-SFHVURJKSA-N 0 3 405.542 4.103 20 0 HIADHN COc1ccc(-c2cc(C(=O)NCC(C)(C)N3CCC(OC)CC3)sc2C)cc1 ZINC000518610642 927377184 /nfs/dbraw/zinc/37/71/84/927377184.db2.gz ROYDFZFXRHDYED-UHFFFAOYSA-N 0 3 416.587 4.351 20 0 HIADHN COC1CCN(C(C)(C)CNC(=O)c2ccccc2OCc2ccccc2C)CC1 ZINC000518612560 927378965 /nfs/dbraw/zinc/37/89/65/927378965.db2.gz FAJPPLSQGWJSCE-UHFFFAOYSA-N 0 3 410.558 4.193 20 0 HIADHN Cc1cccc([C@H](CNCc2ccc(Br)cc2F)N2CCOCC2)c1 ZINC000518762389 927481155 /nfs/dbraw/zinc/48/11/55/927481155.db2.gz WCLGDHXRAHCJBF-FQEVSTJZSA-N 0 3 407.327 4.060 20 0 HIADHN CCc1c(C(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)nnn1-c1cccc(Cl)c1 ZINC000518788219 927493745 /nfs/dbraw/zinc/49/37/45/927493745.db2.gz VMYRGEDRQFVHSE-QFBILLFUSA-N 0 3 423.948 4.048 20 0 HIADHN CCN1CCCN(C(=O)c2ccccc2Sc2ccc(Br)cn2)CC1 ZINC000518889609 927600529 /nfs/dbraw/zinc/60/05/29/927600529.db2.gz BXOUEYFCHJCFLX-UHFFFAOYSA-N 0 3 420.376 4.163 20 0 HIADHN C[C@@H](c1nc2ccccc2s1)N(C)C(=O)CCCN1CCN(c2ccccc2)CC1 ZINC000518903837 927614529 /nfs/dbraw/zinc/61/45/29/927614529.db2.gz YIKWXEWVJSKLAG-IBGZPJMESA-N 0 3 422.598 4.418 20 0 HIADHN CC(C)Oc1ccc([C@@H](C)NC(=O)CCCN2CCN(c3ccccc3)CC2)cc1 ZINC000518907052 927617240 /nfs/dbraw/zinc/61/72/40/927617240.db2.gz JTTOOFXEIMSBFO-OAQYLSRUSA-N 0 3 409.574 4.253 20 0 HIADHN CSc1ccc([C@H](CNC(=O)c2cnc3onc(C(C)(C)C)c3c2)N(C)C)cc1 ZINC000519024253 927700275 /nfs/dbraw/zinc/70/02/75/927700275.db2.gz HZOGLUDEUGCLLT-SFHVURJKSA-N 0 3 412.559 4.275 20 0 HIADHN CC(C)[C@H](C(=O)Nc1ccc(C(=O)NCc2ccc(F)cc2)cc1)N1CCCCC1 ZINC000519105296 927774180 /nfs/dbraw/zinc/77/41/80/927774180.db2.gz JDJCBDQJIOLGFZ-JOCHJYFZSA-N 0 3 411.521 4.205 20 0 HIADHN C[C@H]1CCCN(Cc2csc(NC(=O)N3CCN(CC4CCCCC4)CC3)n2)C1 ZINC000519261968 927854026 /nfs/dbraw/zinc/85/40/26/927854026.db2.gz KASAGGQDKKSSOR-SFHVURJKSA-N 0 3 419.639 4.105 20 0 HIADHN O=C(NCC1(c2ccccc2Cl)CCOCC1)c1cccc(CN2CCCC2)c1 ZINC000519279188 927861661 /nfs/dbraw/zinc/86/16/61/927861661.db2.gz XGJYUGXVNJSDMT-UHFFFAOYSA-N 0 3 412.961 4.414 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)NCc2cccnc2Oc2cccc(F)c2)N(C)C)cc1 ZINC000519294206 927867403 /nfs/dbraw/zinc/86/74/03/927867403.db2.gz LGKCFGWURCZXCF-JOCHJYFZSA-N 0 3 422.504 4.424 20 0 HIADHN CN(Cc1ccc(Br)o1)C(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000519361871 927896735 /nfs/dbraw/zinc/89/67/35/927896735.db2.gz ICOURQZPWUIAQX-OAHLLOKOSA-N 0 3 409.299 4.052 20 0 HIADHN Cc1cc(C)n(-c2ccccc2NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)n1 ZINC000519363686 927898003 /nfs/dbraw/zinc/89/80/03/927898003.db2.gz OYZUMZIYYJSMJM-HXUWFJFHSA-N 0 3 406.505 4.479 20 0 HIADHN Cc1ccc(Cc2nnc(NC(=O)N(CCN(C)C)Cc3cccc(C)c3)s2)cc1 ZINC000519451316 927958793 /nfs/dbraw/zinc/95/87/93/927958793.db2.gz YLRZVJFQQYSXEQ-UHFFFAOYSA-N 0 3 423.586 4.341 20 0 HIADHN Cc1ccc(NC(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)cc1C(=O)NC(C)C ZINC000519498449 927994062 /nfs/dbraw/zinc/99/40/62/927994062.db2.gz JIQLEALPYNJSCF-WIYYLYMNSA-N 0 3 408.546 4.090 20 0 HIADHN CC(C)OCCOCc1cccc(NC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000519500195 927994367 /nfs/dbraw/zinc/99/43/67/927994367.db2.gz UNVZGUILSQWUHO-HSZRJFAPSA-N 0 3 411.546 4.024 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)Nc2ccn(Cc3ccccc3)n2)N(C)C)cc1 ZINC000519655954 928036956 /nfs/dbraw/zinc/03/69/56/928036956.db2.gz DVGZRRVXNPXXKR-JOCHJYFZSA-N 0 3 421.545 4.143 20 0 HIADHN COc1ccc(CN2CC[C@@H](NC/C(C)=C/c3ccccc3OC(F)F)C2=O)cc1 ZINC000519673912 928046946 /nfs/dbraw/zinc/04/69/46/928046946.db2.gz QUSZVBBAIIXWQT-MQMQVCBVSA-N 0 3 416.468 4.091 20 0 HIADHN Cc1n[nH]cc1C1CCN(Cc2cn(-c3ccc(Br)cc3)nc2C)CC1 ZINC000519689448 928049054 /nfs/dbraw/zinc/04/90/54/928049054.db2.gz MEXSQQSQDBBXIH-UHFFFAOYSA-N 0 3 414.351 4.354 20 0 HIADHN CCOc1cc(CNCc2ccccc2Cn2cccn2)cc(Br)c1O ZINC000519755860 928068725 /nfs/dbraw/zinc/06/87/25/928068725.db2.gz XRSBZGQNDUOFEA-UHFFFAOYSA-N 0 3 416.319 4.088 20 0 HIADHN Cc1noc(C)c1COc1ccccc1C(=O)N[C@H]1CCN(Cc2ccccc2)[C@@H]1C ZINC000519787441 928075361 /nfs/dbraw/zinc/07/53/61/928075361.db2.gz FHRNSUHSQFMAJQ-JPYJTQIMSA-N 0 3 419.525 4.263 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)c1ccccc1COc1ccccc1 ZINC000519821370 928085467 /nfs/dbraw/zinc/08/54/67/928085467.db2.gz DVJGYHZGQOOFPJ-QFIPXVFZSA-N 0 3 402.494 4.085 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1C(=O)NC[C@@H](c1ccc(C)cc1)N1CCCC1 ZINC000519936863 928171745 /nfs/dbraw/zinc/17/17/45/928171745.db2.gz MRAPLMFUTNPLPH-DEOSSOPVSA-N 0 3 416.569 4.424 20 0 HIADHN Cc1ccc([C@H](CNC(=O)[C@@H](c2ccccc2)N2CCSCC2)N2CCCC2)cc1 ZINC000519936790 928172176 /nfs/dbraw/zinc/17/21/76/928172176.db2.gz RGRKXCLJSMIGQY-BJKOFHAPSA-N 0 3 423.626 4.038 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)Cc2csc(Cc3ccc(F)cc3)n2)C1 ZINC000519945060 928178297 /nfs/dbraw/zinc/17/82/97/928178297.db2.gz UGLSEEJKWJZCFC-UTKZUKDTSA-N 0 3 423.557 4.367 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)Nc1ccc(OC(F)F)c(F)c1 ZINC000520046019 928270099 /nfs/dbraw/zinc/27/00/99/928270099.db2.gz IYBQAROAISZYJV-UHFFFAOYSA-N 0 3 409.452 4.455 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)N2CCN(CC3CCCCC3)CC2)c(C)c1 ZINC000520055696 928280277 /nfs/dbraw/zinc/28/02/77/928280277.db2.gz QLEVMWJLXHQCHS-IBGZPJMESA-N 0 3 414.594 4.253 20 0 HIADHN COc1ccc2[nH]cc(C3=CCN(C(=O)[C@H]4CCCN4Cc4ccccc4)CC3)c2c1 ZINC000520146560 928339659 /nfs/dbraw/zinc/33/96/59/928339659.db2.gz MUGXXIOZMBDJNP-RUZDIDTESA-N 0 3 415.537 4.457 20 0 HIADHN OCCOc1ccc(CNCc2cn(Cc3ccccc3)nc2-c2ccccc2)cc1 ZINC000520214307 928392330 /nfs/dbraw/zinc/39/23/30/928392330.db2.gz TXWMXOADICCNPV-UHFFFAOYSA-N 0 3 413.521 4.259 20 0 HIADHN Cc1cc(C)n(-c2ccc(CNCc3cnc4n[nH]c(C)c4c3)c(C(F)(F)F)c2)n1 ZINC000520215787 928393296 /nfs/dbraw/zinc/39/32/96/928393296.db2.gz NXRVXKWLEGCSNI-UHFFFAOYSA-N 0 3 414.435 4.377 20 0 HIADHN O[C@H](CNCc1ccccc1OC(F)(F)F)COc1ccc(C(F)(F)F)cc1 ZINC000520215889 928393805 /nfs/dbraw/zinc/39/38/05/928393805.db2.gz YLEJJIXISQIURK-CQSZACIVSA-N 0 3 409.326 4.134 20 0 HIADHN COc1ccc(C[C@@H](N[C@H]2CCN(c3ccccc3)C2=O)c2ccccc2)cc1OC ZINC000520249347 928417108 /nfs/dbraw/zinc/41/71/08/928417108.db2.gz ZKTDDFICQPHEIW-XZOQPEGZSA-N 0 3 416.521 4.383 20 0 HIADHN C[C@H](NC[C@H]1CC[C@@H](c2nc(C3CC3)no2)O1)c1cc(Br)ccc1F ZINC000520262402 928426125 /nfs/dbraw/zinc/42/61/25/928426125.db2.gz AEYAQHNBVOEZEG-WNMQOVRZSA-N 0 3 410.287 4.420 20 0 HIADHN CC(C)N(C)c1cccc(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2F)c1 ZINC000520283694 928445725 /nfs/dbraw/zinc/44/57/25/928445725.db2.gz ONLZKEGLMWAQFY-UHFFFAOYSA-N 0 3 404.505 4.405 20 0 HIADHN COc1ccccc1NC(=O)[C@H](C)N(C)CCCc1cc(-c2cccc(F)c2)n[nH]1 ZINC000520288063 928450161 /nfs/dbraw/zinc/45/01/61/928450161.db2.gz WZLIKZJNTIKORN-INIZCTEOSA-N 0 3 410.493 4.116 20 0 HIADHN C[C@@H](C(=O)N(C)C1CCCCC1)N(C)CCCc1cc(-c2cccc(F)c2)n[nH]1 ZINC000520287746 928450404 /nfs/dbraw/zinc/45/04/04/928450404.db2.gz GZUNLWRRELSXBJ-KRWDZBQOSA-N 0 3 400.542 4.260 20 0 HIADHN C[C@@H]1CN(c2nnc(C3CCCC3)n2C[C@H]2CCOC2)[C@H](C)CN1Cc1ccccc1 ZINC000520301024 928463602 /nfs/dbraw/zinc/46/36/02/928463602.db2.gz BHCNTPRFVCEHRQ-KCZVDYSFSA-N 0 3 423.605 4.071 20 0 HIADHN CCn1c2ccccc2nc1[C@H](C)NC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000520309786 928471971 /nfs/dbraw/zinc/47/19/71/928471971.db2.gz QALHAARRCRLNPU-HKUYNNGSSA-N 0 3 408.521 4.285 20 0 HIADHN C[C@H](CNC(=O)[C@@H]1C[C@@H]1c1cccc(Br)c1)N(C)Cc1ccccc1 ZINC000520327476 928491698 /nfs/dbraw/zinc/49/16/98/928491698.db2.gz FNEJAJWUPZDUMO-CDHQVMDDSA-N 0 3 401.348 4.189 20 0 HIADHN COC(=O)c1cc(CN2CCCN(Cc3ccc(C(F)(F)F)cc3)CC2)c(C)o1 ZINC000520350526 928512584 /nfs/dbraw/zinc/51/25/84/928512584.db2.gz ZDXFGKXISDOSSV-UHFFFAOYSA-N 0 3 410.436 4.101 20 0 HIADHN Cc1cc(NC(=O)c2cccc(F)c2)sc1C(=O)N[C@@H](C)CN1CCCCC1 ZINC000520363042 928520830 /nfs/dbraw/zinc/52/08/30/928520830.db2.gz YZAZVXJWPPJXOV-HNNXBMFYSA-N 0 3 403.523 4.052 20 0 HIADHN CN(C)CCN(C(=O)CCc1nnc(-c2cc3ccccc3o2)o1)C1CCCCC1 ZINC000520365387 928522259 /nfs/dbraw/zinc/52/22/59/928522259.db2.gz JLRZTULBPDNAGB-UHFFFAOYSA-N 0 3 410.518 4.138 20 0 HIADHN Cc1cccc(-c2nnc(-c3ccc(C(=O)N(C)[C@@H]4CCN(C5CC5)C4)cc3)o2)c1 ZINC000520366439 928522310 /nfs/dbraw/zinc/52/23/10/928522310.db2.gz OUMLDSHSUIJUHX-OAQYLSRUSA-N 0 3 402.498 4.021 20 0 HIADHN CN(C(=O)c1cccnc1Nc1ccc(Cl)c(Cl)c1)[C@@H]1CCN(C2CC2)C1 ZINC000520368739 928524567 /nfs/dbraw/zinc/52/45/67/928524567.db2.gz JGYNARFOFUFCLT-OAHLLOKOSA-N 0 3 405.329 4.441 20 0 HIADHN O=C(Cc1coc(-c2ccc(Cl)cc2)n1)NCC1(N2CCSCC2)CCCC1 ZINC000520513894 928612378 /nfs/dbraw/zinc/61/23/78/928612378.db2.gz ZCLIRYLGBSDWAE-UHFFFAOYSA-N 0 3 419.978 4.015 20 0 HIADHN O=C([C@@H](Sc1ccc(F)cc1F)c1ccccc1)N1CC[C@@H](N2CCCC2)C1 ZINC000520689101 928737123 /nfs/dbraw/zinc/73/71/23/928737123.db2.gz HMTISSMDEXWTMH-NQIIRXRSSA-N 0 3 402.510 4.495 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)[C@@H]3C[C@H]3c3cccc4ccccc43)CC2)C[C@@H](C)O1 ZINC000520762371 928806189 /nfs/dbraw/zinc/80/61/89/928806189.db2.gz TVFWEEKAGBYOMO-ZSVMJGIMSA-N 0 3 406.570 4.291 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)N[C@@H](c1ccc(F)cc1)[C@@H]1CCCO1 ZINC000520816046 928831254 /nfs/dbraw/zinc/83/12/54/928831254.db2.gz LBJCATJIYUISQK-VJBWXMMDSA-N 0 3 411.521 4.182 20 0 HIADHN Cc1ccc(Cc2nnc(NC(=O)N[C@@H]3CCN([C@H](C)c4ccccc4)C3)s2)cc1 ZINC000520856391 928846647 /nfs/dbraw/zinc/84/66/47/928846647.db2.gz CKXZGYPMULRYAR-YLJYHZDGSA-N 0 3 421.570 4.394 20 0 HIADHN Cc1ccc(Cc2nnc(NC(=O)NC[C@H](c3ccccc3)N3CCCC3)s2)cc1 ZINC000520858082 928847348 /nfs/dbraw/zinc/84/73/48/928847348.db2.gz LRCYAUPJPWNREL-HXUWFJFHSA-N 0 3 421.570 4.396 20 0 HIADHN Cc1ccc([C@H](CNc2cnn(-c3ccc(F)cc3F)c(=O)c2Cl)N(C)C)cc1 ZINC000520869533 928852116 /nfs/dbraw/zinc/85/21/16/928852116.db2.gz INXGDOMARKTSCX-IBGZPJMESA-N 0 3 418.875 4.187 20 0 HIADHN O=C(NCCc1ccco1)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000521062117 928968229 /nfs/dbraw/zinc/96/82/29/928968229.db2.gz YSBVNVHSUFVUFG-UHFFFAOYSA-N 0 3 410.345 4.437 20 0 HIADHN COc1cc(F)ccc1NC(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1 ZINC000521062692 928969514 /nfs/dbraw/zinc/96/95/14/928969514.db2.gz RXRYPIUVKPMIQH-UHFFFAOYSA-N 0 3 413.415 4.449 20 0 HIADHN CCN1CCCC[C@H]1CNC(=O)c1ccccc1SCc1cn2ccccc2n1 ZINC000521129769 929013555 /nfs/dbraw/zinc/01/35/55/929013555.db2.gz NMWRIFFSNIOQOA-IBGZPJMESA-N 0 3 408.571 4.231 20 0 HIADHN CC(C)[C@H](C(=O)Nc1cccc(CN(C)Cc2cscn2)c1)N1CCCCC1 ZINC000521148539 929025551 /nfs/dbraw/zinc/02/55/51/929025551.db2.gz IRLQLLINKPLRJL-OAQYLSRUSA-N 0 3 400.592 4.224 20 0 HIADHN C[C@H](CNC(=O)N1CCO[C@@H](c2ccc(F)c(Cl)c2)C1)N(C)Cc1ccccc1 ZINC000521162606 929035251 /nfs/dbraw/zinc/03/52/51/929035251.db2.gz WJLHLEJDCVNMFF-IIBYNOLFSA-N 0 3 419.928 4.083 20 0 HIADHN CCN1CCCC[C@H]1C(=O)N1CCc2c(cccc2NC(=O)Nc2ccccc2F)C1 ZINC000521181553 929048112 /nfs/dbraw/zinc/04/81/12/929048112.db2.gz HTNCNXCTBUSNPS-QFIPXVFZSA-N 0 3 424.520 4.229 20 0 HIADHN CC(=O)Nc1ccc(OC[C@@H](O)CN(Cc2ccccc2)Cc2ccccc2C)cc1 ZINC000521193467 929053560 /nfs/dbraw/zinc/05/35/60/929053560.db2.gz DIVIRJJLYPFWRO-VWLOTQADSA-N 0 3 418.537 4.396 20 0 HIADHN CN(Cc1cccc(C(F)(F)F)c1)C(=O)NCC1(N2CCSCC2)CCCC1 ZINC000521456247 929229967 /nfs/dbraw/zinc/22/99/67/929229967.db2.gz UKXDVYRIWNZKJA-UHFFFAOYSA-N 0 3 415.525 4.208 20 0 HIADHN O=C(NCCCCOc1ccc(F)cc1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000521532341 929278328 /nfs/dbraw/zinc/27/83/28/929278328.db2.gz JZINEPZQIBLVBW-LJQANCHMSA-N 0 3 402.485 4.152 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)c1cnc2onc(C(C)(C)C)c2c1 ZINC000521572315 929304845 /nfs/dbraw/zinc/30/48/45/929304845.db2.gz YQQSPPZYTSXOCP-UHFFFAOYSA-N 0 3 414.937 4.378 20 0 HIADHN NS(=O)(=O)c1ccc2c(c1)CCC[C@@H]2N[C@H]1CCc2c1ccc(Cl)c2Cl ZINC000521595080 929316797 /nfs/dbraw/zinc/31/67/97/929316797.db2.gz QWTGHVZJJBJWOF-ROUUACIJSA-N 0 3 411.354 4.295 20 0 HIADHN COC(=O)c1cc2cc(NC(=O)[C@@H]3CCCN(Cc4cccc(F)c4)C3)ccc2o1 ZINC000521601895 929322986 /nfs/dbraw/zinc/32/29/86/929322986.db2.gz LVTILRAPCSVKSX-MRXNPFEDSA-N 0 3 410.445 4.209 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)N[C@@H](c1ccccc1)c1ccccn1 ZINC000521680264 929363143 /nfs/dbraw/zinc/36/31/43/929363143.db2.gz YGRGLZUMDYPHNN-QHCPKHFHSA-N 0 3 424.495 4.223 20 0 HIADHN O=C(NCc1nccs1)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000521685888 929367117 /nfs/dbraw/zinc/36/71/17/929367117.db2.gz IGRVEQBSWSJWJQ-UHFFFAOYSA-N 0 3 413.374 4.258 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)c2cn(C)nc2-c2ccccc2Cl)C1 ZINC000521751671 929413035 /nfs/dbraw/zinc/41/30/35/929413035.db2.gz BJCPBUXIZHHWGC-AEFFLSMTSA-N 0 3 408.933 4.306 20 0 HIADHN Cc1ccc(OCc2nc(CC(=O)N(CCN(C)C)c3ccccc3)cs2)cc1 ZINC000521794828 929455241 /nfs/dbraw/zinc/45/52/41/929455241.db2.gz YIEVSDXJJLFFCZ-UHFFFAOYSA-N 0 3 409.555 4.168 20 0 HIADHN Cc1ccc([C@H](CNCc2ccccc2OCc2ccccc2)N2CCOCC2)o1 ZINC000521822666 929479195 /nfs/dbraw/zinc/47/91/95/929479195.db2.gz CGYXTXOLKKKEFO-QHCPKHFHSA-N 0 3 406.526 4.330 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NCc2csc(-c3ccc4c(c3)OCO4)n2)C1 ZINC000521828134 929482075 /nfs/dbraw/zinc/48/20/75/929482075.db2.gz DEGRSXSMHGNWQH-LPHOPBHVSA-N 0 3 407.539 4.464 20 0 HIADHN CC[C@@H](C)[C@@H](NCc1cnc2n[nH]c(C)c2c1)C(=O)Nc1cccc(N2CCCC2)c1 ZINC000521831626 929483200 /nfs/dbraw/zinc/48/32/00/929483200.db2.gz BLZUYESTHBYQHQ-OPAMFIHVSA-N 0 3 420.561 4.010 20 0 HIADHN CCc1cccc2c(CC(=O)Nc3ccc(CN4CCN(CC)CC4)cc3)c[nH]c21 ZINC000521873433 929522517 /nfs/dbraw/zinc/52/25/17/929522517.db2.gz SAXMHSMMERVLRA-UHFFFAOYSA-N 0 3 404.558 4.049 20 0 HIADHN CCCCOc1cccc(NC(=O)N2CCC(CN3C[C@H](C)O[C@@H](C)C3)CC2)c1 ZINC000521876639 929523928 /nfs/dbraw/zinc/52/39/28/929523928.db2.gz OBYTYGNQWMUJGW-OALUTQOASA-N 0 3 403.567 4.219 20 0 HIADHN COc1ccc([C@H](CNC(=O)NCc2ccccc2C(F)(F)F)N2CCCC2)cc1 ZINC000521891510 929540588 /nfs/dbraw/zinc/54/05/88/929540588.db2.gz RVEWZQSLGAFENY-FQEVSTJZSA-N 0 3 421.463 4.350 20 0 HIADHN CCN1CCCN(C(=O)c2cn(Cc3ccccc3)nc2-c2ccc(Cl)cc2)CC1 ZINC000521923610 929565989 /nfs/dbraw/zinc/56/59/89/929565989.db2.gz AOBOJHGAIJIJLO-UHFFFAOYSA-N 0 3 422.960 4.420 20 0 HIADHN Cc1ccccc1[C@@H]1C[C@H](C)N(CC(=O)N2CCC(C(=O)Nc3ccccc3)CC2)C1 ZINC000524593660 929704343 /nfs/dbraw/zinc/70/43/43/929704343.db2.gz LENUGOBKEUVFSG-RBBKRZOGSA-N 0 3 419.569 4.050 20 0 HIADHN Cc1cccc([C@H](C)C(=O)NC2CCN(CCOc3ccc(Cl)cc3)CC2)c1 ZINC000524603602 929712430 /nfs/dbraw/zinc/71/24/30/929712430.db2.gz RDMRCOWMJUCWTO-SFHVURJKSA-N 0 3 400.950 4.412 20 0 HIADHN COc1ccccc1[C@@H](NC(=O)NCCN(C)Cc1ccccc1)c1ccccc1 ZINC000524614692 929723605 /nfs/dbraw/zinc/72/36/05/929723605.db2.gz UDDQMSBFCMPUKE-DEOSSOPVSA-N 0 3 403.526 4.216 20 0 HIADHN CC(C)C(=O)Nc1ccc(NC(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)cc1 ZINC000524629698 929739165 /nfs/dbraw/zinc/73/91/65/929739165.db2.gz KPXKCDKGNKBAGP-LJQANCHMSA-N 0 3 408.546 4.409 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1ccc(N2CCCCCC2)nc1)c1ccsc1 ZINC000524708027 929806184 /nfs/dbraw/zinc/80/61/84/929806184.db2.gz RMQVSOQYVMJAEU-FQEVSTJZSA-N 0 3 400.592 4.336 20 0 HIADHN CC[C@H]1CCCCN1CCNC(=O)[C@H](C)CC(=O)c1cccc(Br)c1 ZINC000524714019 929808639 /nfs/dbraw/zinc/80/86/39/929808639.db2.gz UGAOBRZEOLAHBQ-QAPCUYQASA-N 0 3 409.368 4.039 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCc1ncc(C)s1)c1ccc(C(F)(F)F)cc1 ZINC000524781821 929827852 /nfs/dbraw/zinc/82/78/52/929827852.db2.gz JVYJSGGFUPXXAW-INIZCTEOSA-N 0 3 414.497 4.353 20 0 HIADHN Cc1cnn(-c2ccc(NC(=O)N3CCCN(Cc4ccccc4)C[C@H]3C)cc2F)c1 ZINC000524906588 929883314 /nfs/dbraw/zinc/88/33/14/929883314.db2.gz XCQYRCFVGCEWPK-LJQANCHMSA-N 0 3 421.520 4.448 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)NCc1nc(C(F)(F)F)cs1 ZINC000524929006 929894904 /nfs/dbraw/zinc/89/49/04/929894904.db2.gz NWCQXGFWSZDNNH-UHFFFAOYSA-N 0 3 420.888 4.089 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)N[C@H](c1ccccc1)[C@H]1CCCO1 ZINC000524932441 929896780 /nfs/dbraw/zinc/89/67/80/929896780.db2.gz YNPNFGNFGLNZJF-AGILITTLSA-N 0 3 407.558 4.213 20 0 HIADHN C[C@@H](CNC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C)COCc1ccccc1 ZINC000524931524 929896953 /nfs/dbraw/zinc/89/69/53/929896953.db2.gz CQUIKRXKOHHKNA-VXKWHMMOSA-N 0 3 409.574 4.145 20 0 HIADHN COc1cc(CN[C@H](c2ccc3c(c2)OCCO3)C2CC2)c(SC)cc1OC ZINC000524944217 929907401 /nfs/dbraw/zinc/90/74/01/929907401.db2.gz ANEYBWTWHSCLFI-QFIPXVFZSA-N 0 3 401.528 4.438 20 0 HIADHN CCOc1c(Cl)cc(CN[C@H](C)[C@H]2CN(Cc3ccccc3)CCO2)cc1OC ZINC000524947543 929909468 /nfs/dbraw/zinc/90/94/68/929909468.db2.gz USFAGVXIYQHFRW-VGOFRKELSA-N 0 3 418.965 4.126 20 0 HIADHN CCOc1c(Cl)cc(CN[C@H](C)[C@@H]2CN(Cc3ccccc3)CCO2)cc1OC ZINC000524947545 929910072 /nfs/dbraw/zinc/91/00/72/929910072.db2.gz USFAGVXIYQHFRW-VGSWGCGISA-N 0 3 418.965 4.126 20 0 HIADHN COCCN1CCC(NC(=O)c2ccc(Oc3ccc(C(C)(C)C)cc3)nc2)CC1 ZINC000524961372 929925352 /nfs/dbraw/zinc/92/53/52/929925352.db2.gz JXNLDWJCNYHVEY-UHFFFAOYSA-N 0 3 411.546 4.012 20 0 HIADHN Cc1ccc(NC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1OCC1CCOCC1 ZINC000524991124 929957236 /nfs/dbraw/zinc/95/72/36/929957236.db2.gz ZCQFRIFTSIAHAT-HSZRJFAPSA-N 0 3 423.557 4.196 20 0 HIADHN CC(C)(C)CNC(=O)c1ccc(C(=O)NC[C@H](c2ccccc2)N2CCCC2)cc1 ZINC000525068529 930015018 /nfs/dbraw/zinc/01/50/18/930015018.db2.gz FRGKNYWEMVEDPL-JOCHJYFZSA-N 0 3 407.558 4.029 20 0 HIADHN Cc1noc(-c2ccccc2C(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)n1 ZINC000525111707 930044458 /nfs/dbraw/zinc/04/44/58/930044458.db2.gz WHOBVPXVMPTQCY-IBGZPJMESA-N 0 3 410.543 4.310 20 0 HIADHN C[C@@H](CNC(=O)c1ccc(Sc2ccccc2Cl)nn1)N1CCC(C)CC1 ZINC000525128845 930051686 /nfs/dbraw/zinc/05/16/86/930051686.db2.gz KYAUZOHZCHYNHD-HNNXBMFYSA-N 0 3 404.967 4.131 20 0 HIADHN FC(F)(F)c1cnc(OCCNCc2cccc3c2OCCCO3)c(Cl)c1 ZINC000525183882 930079580 /nfs/dbraw/zinc/07/95/80/930079580.db2.gz IFKOZDHVGHGMIT-UHFFFAOYSA-N 0 3 402.800 4.084 20 0 HIADHN CC[C@@H](C)[C@@H](NCc1cnc2c(C)cccn12)C(=O)Nc1cccc(N2CCCC2)c1 ZINC000525192949 930082262 /nfs/dbraw/zinc/08/22/62/930082262.db2.gz GZGGCFDNJIFWTA-WZONZLPQSA-N 0 3 419.573 4.386 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)c1cnn(-c2ccccc2Cl)c1 ZINC000525384681 930211269 /nfs/dbraw/zinc/21/12/69/930211269.db2.gz GMXUPGCEBYEQQF-GOSISDBHSA-N 0 3 408.933 4.262 20 0 HIADHN CC(=O)N1CCCc2cc(NC(=O)N3CCCN(Cc4ccccc4)C[C@H]3C)ccc21 ZINC000525414701 930226985 /nfs/dbraw/zinc/22/69/85/930226985.db2.gz GFIVGZFRILKYDQ-LJQANCHMSA-N 0 3 420.557 4.114 20 0 HIADHN COc1ccc([C@H](CNC(=O)Nc2ccc(-c3cc[nH]n3)cc2)N2CCCC2)cc1 ZINC000525414841 930227001 /nfs/dbraw/zinc/22/70/01/930227001.db2.gz MWYYLSGRQNVQFI-QFIPXVFZSA-N 0 3 405.502 4.044 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1ccc(N2CCCCC2)nc1 ZINC000525417028 930228337 /nfs/dbraw/zinc/22/83/37/930228337.db2.gz SPSGQRRCCRUICT-FQEVSTJZSA-N 0 3 407.562 4.200 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1nnc(-c2ccsc2)s1 ZINC000525416198 930228921 /nfs/dbraw/zinc/22/89/21/930228921.db2.gz ICAASIMIJRRIEN-HNNXBMFYSA-N 0 3 413.572 4.395 20 0 HIADHN CCCCOc1ncccc1CNC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C ZINC000525448560 930246854 /nfs/dbraw/zinc/24/68/54/930246854.db2.gz JUGKECHISYOCOO-HXUWFJFHSA-N 0 3 410.562 4.067 20 0 HIADHN COc1ccc(-c2[nH]c3ccccc3c2CCC(=O)N(C)[C@H]2CCCN(C)C2)cc1 ZINC000525524200 930301829 /nfs/dbraw/zinc/30/18/29/930301829.db2.gz LDLOUIKXXYOWAA-IBGZPJMESA-N 0 3 405.542 4.329 20 0 HIADHN Cc1ccc(-c2cc(C(=O)N(C)[C@@H]3CCCN(C)C3)c3cnn(C(C)C)c3n2)s1 ZINC000525525326 930301853 /nfs/dbraw/zinc/30/18/53/930301853.db2.gz GBMKCXGRNNYKLK-MRXNPFEDSA-N 0 3 411.575 4.215 20 0 HIADHN CN(C(=O)c1ccc(Oc2cccc(Br)c2)cc1)[C@H]1CCCN(C)C1 ZINC000525525915 930302777 /nfs/dbraw/zinc/30/27/77/930302777.db2.gz JGDVRSFHLLORDR-KRWDZBQOSA-N 0 3 403.320 4.408 20 0 HIADHN CCCCc1ccc(CC(=O)Nc2ccc(C(=O)N(C)[C@@H]3CCCN(C)C3)cc2)cc1 ZINC000525579398 930342009 /nfs/dbraw/zinc/34/20/09/930342009.db2.gz RCUIZKSWOKORSG-XMMPIXPASA-N 0 3 421.585 4.377 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Cc2ccc(NC(=O)CC(C)(C)C)cc2)N(C)C)cc1 ZINC000525579842 930342496 /nfs/dbraw/zinc/34/24/96/930342496.db2.gz PAXSZXZKTCINFB-QFIPXVFZSA-N 0 3 409.574 4.331 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2ccc(Cl)c(Cl)c2)cc1)[C@@H]1CCCN(C)C1 ZINC000525581247 930343471 /nfs/dbraw/zinc/34/34/71/930343471.db2.gz OXVCWOQSOBLUNS-QGZVFWFLSA-N 0 3 420.340 4.412 20 0 HIADHN C[C@H](CNC(=O)Nc1cccc(CC(=O)OC(C)(C)C)c1)N(C)Cc1ccccc1 ZINC000525740844 930422737 /nfs/dbraw/zinc/42/27/37/930422737.db2.gz MNMMRAOSBSEIID-GOSISDBHSA-N 0 3 411.546 4.213 20 0 HIADHN CN(CC(C)(C)C)C(=O)c1cccc(C(=O)NC[C@H]2CCCN2Cc2ccccc2)c1 ZINC000525754654 930430294 /nfs/dbraw/zinc/43/02/94/930430294.db2.gz JEZSAXZEZLQJNG-HSZRJFAPSA-N 0 3 421.585 4.199 20 0 HIADHN CC(=O)Nc1cccc(OCCNCc2cc(Cl)ccc2OC[C@H]2CCCO2)c1 ZINC000525759182 930433317 /nfs/dbraw/zinc/43/33/17/930433317.db2.gz RRJUCGUYOVLOQA-OAQYLSRUSA-N 0 3 418.921 4.025 20 0 HIADHN CCN(C(=O)C(=O)Nc1cc(F)ccc1Cl)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000526123239 930539306 /nfs/dbraw/zinc/53/93/06/930539306.db2.gz RGGGKKVAHHRYQP-YJBOKZPZSA-N 0 3 417.912 4.102 20 0 HIADHN COc1ccc([C@H](C)NCc2ccc3c(c2)sc(=O)n3C)cc1Br ZINC000526974330 930560404 /nfs/dbraw/zinc/56/04/04/930560404.db2.gz ZTRVHMQDUZYICT-NSHDSACASA-N 0 3 407.333 4.222 20 0 HIADHN Cc1ccccc1[C@@H]([C@H](C)NC(=O)C(=O)Nc1cccc(Cl)c1Cl)N(C)C ZINC000527206858 930612876 /nfs/dbraw/zinc/61/28/76/930612876.db2.gz FQLBUUUZAUYCKD-SCLBCKFNSA-N 0 3 408.329 4.048 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1c[nH]c2ncc(Br)cc12)c1ccsc1 ZINC000527447419 930658400 /nfs/dbraw/zinc/65/84/00/930658400.db2.gz LZOKBUYXZKSVBN-MRXNPFEDSA-N 0 3 421.364 4.200 20 0 HIADHN Cc1ccc([C@@H]2CCN(C(=O)NC3CC(N4CCC(C(F)(F)F)CC4)C3)C2)cc1 ZINC000527461485 930660157 /nfs/dbraw/zinc/66/01/57/930660157.db2.gz VVEXRSFJDOCPHL-QHGAOEGBSA-N 0 3 409.496 4.299 20 0 HIADHN Cn1c2ccc(CNCc3ccc(-c4nc5ccccc5[nH]4)cc3)cc2sc1=O ZINC000527518041 930672885 /nfs/dbraw/zinc/67/28/85/930672885.db2.gz RIZAMSFXISPLAA-UHFFFAOYSA-N 0 3 400.507 4.433 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2cccc(CC(=O)OC(C)(C)C)c2)[C@@H]1c1ccccc1 ZINC000530354183 930690243 /nfs/dbraw/zinc/69/02/43/930690243.db2.gz XFMGCGLEXIMKCN-IRLDBZIGSA-N 0 3 409.530 4.138 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2cc3c(cc2Cl)OCCCO3)[C@H]1c1ccccc1 ZINC000530409734 930704217 /nfs/dbraw/zinc/70/42/17/930704217.db2.gz IWNMHKVRHRNLNW-OXJNMPFZSA-N 0 3 401.894 4.068 20 0 HIADHN CNC(=O)c1ccc(CN[C@H](Cc2ccccn2)c2ccc(Br)cc2)cc1 ZINC000530439489 930708667 /nfs/dbraw/zinc/70/86/67/930708667.db2.gz ZDCNECMDLCGTOM-OAQYLSRUSA-N 0 3 424.342 4.277 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2ccc(OC(F)F)c3ncccc23)[C@@H]1c1ccccc1 ZINC000530462022 930716862 /nfs/dbraw/zinc/71/68/62/930716862.db2.gz GFYAPXMRLBRJIJ-PXNSSMCTSA-N 0 3 412.440 4.403 20 0 HIADHN COc1ccc(NC(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)cc1OCC(F)(F)F ZINC000530515589 930733303 /nfs/dbraw/zinc/73/33/03/930733303.db2.gz ZDESXXYAXWINRL-LPHOPBHVSA-N 0 3 423.435 4.203 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2ccc(C(=O)NC3CCCCC3)cc2)[C@H]1c1ccccc1 ZINC000530515312 930733906 /nfs/dbraw/zinc/73/39/06/930733906.db2.gz VZWJLEHPDWVRFR-XZOQPEGZSA-N 0 3 420.557 4.316 20 0 HIADHN COc1ccc(NC(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)cc1OCC(F)(F)F ZINC000530515591 930734175 /nfs/dbraw/zinc/73/41/75/930734175.db2.gz ZDESXXYAXWINRL-VQIMIIECSA-N 0 3 423.435 4.203 20 0 HIADHN COc1ccc2nc(CN[C@@H]3CCN(C4CC4)[C@@H]3c3cccc(OC)c3)sc2c1 ZINC000530545682 930742726 /nfs/dbraw/zinc/74/27/26/930742726.db2.gz KMMVSAYHDFQHBS-NFBKMPQASA-N 0 3 409.555 4.381 20 0 HIADHN CC[C@H](C)[C@@H](NCc1cnc2cccc(C)n12)C(=O)Nc1cccc(N2CCCC2)c1 ZINC000530665102 930792039 /nfs/dbraw/zinc/79/20/39/930792039.db2.gz WUADWRZEFBXCAP-MHECFPHRSA-N 0 3 419.573 4.386 20 0 HIADHN CC(C)OCc1ccccc1CNC(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000530678867 930796359 /nfs/dbraw/zinc/79/63/59/930796359.db2.gz BSEVPZZTPNJWQD-UHFFFAOYSA-N 0 3 409.574 4.418 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)N[C@@H]1C[C@@H]1c1cccc(Br)c1 ZINC000530752859 930816667 /nfs/dbraw/zinc/81/66/67/930816667.db2.gz UKEZTKFDFYKRQL-QZTJIDSGSA-N 0 3 422.392 4.140 20 0 HIADHN CCCOc1ccc(NC(=O)CC2(N3CCOCC3)CCCC2)cc1OCCC ZINC000530804440 930828035 /nfs/dbraw/zinc/82/80/35/930828035.db2.gz VZNILFWPUQFNFE-UHFFFAOYSA-N 0 3 404.551 4.238 20 0 HIADHN CCc1cccc(Oc2ccc(NC(=O)[C@@]3(O)CCN(Cc4ccccc4)C3)cn2)c1 ZINC000530812047 930829928 /nfs/dbraw/zinc/82/99/28/930829928.db2.gz JHWIDDUEDDZDQD-RUZDIDTESA-N 0 3 417.509 4.012 20 0 HIADHN COc1ccccc1-c1noc([C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)n1 ZINC000530879241 930847533 /nfs/dbraw/zinc/84/75/33/930847533.db2.gz IFAWCJUIXLRZDA-HXUWFJFHSA-N 0 3 403.404 4.451 20 0 HIADHN Cc1[nH]c(=O)c(C(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)cc1-c1ccccc1 ZINC000530931111 930861420 /nfs/dbraw/zinc/86/14/20/930861420.db2.gz UQRHXYUKBFNTAL-JOCHJYFZSA-N 0 3 415.537 4.499 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)CCSc3ccc(F)cc3)CC2)C[C@H](C)O1 ZINC000530940950 930863024 /nfs/dbraw/zinc/86/30/24/930863024.db2.gz SGBDTOLUQPZLOQ-HDICACEKSA-N 0 3 408.583 4.046 20 0 HIADHN Cc1[nH]c(=O)c(C(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)cc1-c1ccccc1 ZINC000530941955 930863556 /nfs/dbraw/zinc/86/35/56/930863556.db2.gz PXIWLTGQIXFHLP-IBGZPJMESA-N 0 3 415.537 4.499 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)N(C)CCCCCc2cc(-c3ccccc3)n[nH]2)CN1C1CC1 ZINC000531006941 930882867 /nfs/dbraw/zinc/88/28/67/930882867.db2.gz QYLJPRVVTBKGLI-NQIIRXRSSA-N 0 3 409.578 4.056 20 0 HIADHN CN(C)Cc1ccc(-c2noc(CCc3nc(-c4ccc(Cl)cc4)no3)n2)cc1 ZINC000531109593 930922717 /nfs/dbraw/zinc/92/27/17/930922717.db2.gz WVLDDDVENNETIY-UHFFFAOYSA-N 0 3 409.877 4.287 20 0 HIADHN COC[C@](C)(CCO)NCc1cccc(NC(=O)c2ccc(Cl)cc2Cl)c1 ZINC000531172114 930952271 /nfs/dbraw/zinc/95/22/71/930952271.db2.gz KLDLVMWHHWUUPT-FQEVSTJZSA-N 0 3 411.329 4.123 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)CCC(=O)c3ccc(Cl)cc3)CC2)C[C@H](C)O1 ZINC000531178951 930954691 /nfs/dbraw/zinc/95/46/91/930954691.db2.gz AMKLPBLHAFKEGS-ROUUACIJSA-N 0 3 420.981 4.041 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccnc2)C1)N1CCC[C@H]1c1nc2cc(Cl)ccc2[nH]1 ZINC000531243709 930979124 /nfs/dbraw/zinc/97/91/24/930979124.db2.gz NGVQQYARMYJRKW-UTKZUKDTSA-N 0 3 423.948 4.187 20 0 HIADHN CCCOc1cccc(C[NH2+]Cc2nnc(-c3ccc(Br)cc3)[n-]2)c1 ZINC000531256561 930984573 /nfs/dbraw/zinc/98/45/73/930984573.db2.gz UGWKWUIRCNNLSR-UHFFFAOYSA-N 0 3 401.308 4.313 20 0 HIADHN Cc1[nH]c(=O)c(C(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)cc1-c1ccccc1 ZINC000531407823 931046019 /nfs/dbraw/zinc/04/60/19/931046019.db2.gz XHFSLFIPGYVPDX-IBGZPJMESA-N 0 3 415.537 4.499 20 0 HIADHN Cc1cccc(-c2n[nH]cc2C[NH2+]Cc2nnc(-c3ccc(Br)cc3)[n-]2)c1 ZINC000531495423 931078694 /nfs/dbraw/zinc/07/86/94/931078694.db2.gz AWZVYXDWMCEKCF-UHFFFAOYSA-N 0 3 423.318 4.223 20 0 HIADHN CC(C)c1c(C(=O)Nc2cccc(CN3CCC(O)CC3)c2)cnn1-c1ccccc1 ZINC000531497494 931079065 /nfs/dbraw/zinc/07/90/65/931079065.db2.gz LYVVABCPPXJIJF-UHFFFAOYSA-N 0 3 418.541 4.205 20 0 HIADHN FC(F)COc1ccc(C[NH2+]Cc2nnc(-c3ccc(Br)cc3)[n-]2)cc1 ZINC000531495483 931079267 /nfs/dbraw/zinc/07/92/67/931079267.db2.gz KXOKIOMJVGHMAX-UHFFFAOYSA-N 0 3 423.261 4.168 20 0 HIADHN C[C@H](NC(=O)N1CCCN(Cc2ccccc2)CC1)c1cccc(N2CCCC2)c1 ZINC000531504457 931082259 /nfs/dbraw/zinc/08/22/59/931082259.db2.gz AJLTUSORCRYXLR-NRFANRHFSA-N 0 3 406.574 4.265 20 0 HIADHN CC1CCN([C@@H](CNC(=O)Cc2ccn(-c3ccccc3)n2)c2cccs2)CC1 ZINC000531538486 931096613 /nfs/dbraw/zinc/09/66/13/931096613.db2.gz HVFIZEVXYMUYGA-NRFANRHFSA-N 0 3 408.571 4.066 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)c2ccccc2OCc2ccncc2)CN1Cc1ccccc1 ZINC000531569391 931105248 /nfs/dbraw/zinc/10/52/48/931105248.db2.gz WDFAVJAGRNBUKY-SIKLNZKXSA-N 0 3 401.510 4.053 20 0 HIADHN CC(C)N1CCN([C@@H]2CCN(C(=O)C3(c4ccc(Cl)cc4)CCCCC3)C2)CC1 ZINC000531578129 931108007 /nfs/dbraw/zinc/10/80/07/931108007.db2.gz FUNWEVNIJFVYON-JOCHJYFZSA-N 0 3 418.025 4.169 20 0 HIADHN CC(C)N1CCN([C@H]2CCN(C(=O)c3ccc(CSc4ccccc4)cc3)C2)CC1 ZINC000531578530 931108296 /nfs/dbraw/zinc/10/82/96/931108296.db2.gz KJAZWKFHFPUZAZ-QHCPKHFHSA-N 0 3 423.626 4.219 20 0 HIADHN CC(=O)Nc1cc(-c2nc(-c3ccc(CN(C)C)cc3)no2)cc(C(F)(F)F)c1 ZINC000531603702 931120488 /nfs/dbraw/zinc/12/04/88/931120488.db2.gz FPGBXNATRICJBN-UHFFFAOYSA-N 0 3 404.392 4.442 20 0 HIADHN CC(C)(C)OC(=O)C[C@H]1CCCN(CCc2nc(-c3ccc(Cl)cc3)no2)C1 ZINC000531614933 931127883 /nfs/dbraw/zinc/12/78/83/931127883.db2.gz KTHZCBHOGXLFGG-OAHLLOKOSA-N 0 3 405.926 4.376 20 0 HIADHN C[C@@H](CCS(C)(=O)=O)NCc1cccc(Oc2cccc(C(F)(F)F)c2)c1 ZINC000531630540 931132348 /nfs/dbraw/zinc/13/23/48/931132348.db2.gz BUACKJPTFMOVRI-AWEZNQCLSA-N 0 3 401.450 4.411 20 0 HIADHN CC[C@H](C)NC(=O)c1cccc(CN[C@@H](C)c2ccc(OCc3nccn3C)cc2)c1 ZINC000531682133 931150622 /nfs/dbraw/zinc/15/06/22/931150622.db2.gz NLLILKOVBYWYSB-OALUTQOASA-N 0 3 420.557 4.378 20 0 HIADHN C[C@H](CC(=O)Nc1cccc(C(F)(F)F)c1)NCc1cccc(N2CCCC2=O)c1 ZINC000531682276 931150788 /nfs/dbraw/zinc/15/07/88/931150788.db2.gz SZDYCWMQUHAEIX-OAHLLOKOSA-N 0 3 419.447 4.339 20 0 HIADHN CC(C)NC(=O)Nc1ccc([C@@H](C)NCc2ccccc2CN2CCCC2=O)cc1 ZINC000531685119 931151870 /nfs/dbraw/zinc/15/18/70/931151870.db2.gz HCDGZVUGPJMLSA-GOSISDBHSA-N 0 3 408.546 4.190 20 0 HIADHN C[C@@H](NCc1ccc(COCC(F)(F)F)cc1)c1ccc(S(C)(=O)=O)cc1 ZINC000531687951 931153070 /nfs/dbraw/zinc/15/30/70/931153070.db2.gz PNEDHSUTEMLMTC-CQSZACIVSA-N 0 3 401.450 4.020 20 0 HIADHN CC(C)CCOc1ccc([C@H](C)NCc2ccc(C(=O)N3CCOCC3)cc2)cc1 ZINC000531697820 931160830 /nfs/dbraw/zinc/16/08/30/931160830.db2.gz JZSVOJIXFKUCHD-FQEVSTJZSA-N 0 3 410.558 4.435 20 0 HIADHN Cc1nc(-c2cccnc2)sc1[C@H](C)N[C@@H](CN1CCN(C)CC1)c1ccccc1 ZINC000531703685 931165921 /nfs/dbraw/zinc/16/59/21/931165921.db2.gz WDPPJVWBMVZDMC-AVRDEDQJSA-N 0 3 421.614 4.153 20 0 HIADHN Cc1ccc(OC(F)F)c([C@H](C)N[C@H](CN2CCN(C)CC2)c2ccccc2)c1 ZINC000531710729 931168700 /nfs/dbraw/zinc/16/87/00/931168700.db2.gz VNIOGUXPMOJEOW-GHTZIAJQSA-N 0 3 403.517 4.236 20 0 HIADHN COc1ccc(S(=O)(=O)[N-]c2cccc(C[NH2+][C@@H](C)CCc3ccco3)c2)cc1 ZINC000531711680 931169963 /nfs/dbraw/zinc/16/99/63/931169963.db2.gz ZCAAROLNASGVCP-KRWDZBQOSA-N 0 3 414.527 4.200 20 0 HIADHN Cc1cccc([C@@H]2CCCN2CCC(=O)Nc2ccc(Br)cc2F)n1 ZINC000531733576 931177288 /nfs/dbraw/zinc/17/72/88/931177288.db2.gz RHXJPRHQGAOHSO-SFHVURJKSA-N 0 3 406.299 4.457 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)NCC(=O)N2CCC(Cc3ccccc3)CC2)cc1 ZINC000531737705 931179064 /nfs/dbraw/zinc/17/90/64/931179064.db2.gz PUJNHWRGPAMNIB-HXUWFJFHSA-N 0 3 416.569 4.313 20 0 HIADHN CSCc1cc(F)ccc1CNC(=O)N(Cc1ccco1)C1CCN(C)CC1 ZINC000531781198 931195020 /nfs/dbraw/zinc/19/50/20/931195020.db2.gz GXFZLURUPKYFKH-UHFFFAOYSA-N 0 3 405.539 4.088 20 0 HIADHN CC(C)N1CCN([C@@H]2CCN(C(=O)c3cc4c(s3)CC[C@H](C(C)(C)C)C4)C2)CC1 ZINC000531832314 931212318 /nfs/dbraw/zinc/21/23/18/931212318.db2.gz TZHOKVFXSCGPIW-VQTJNVASSA-N 0 3 417.663 4.140 20 0 HIADHN CC(C)N1CCN([C@H]2CCN(C(=O)c3cc4sc5ccccc5c4s3)C2)CC1 ZINC000531832520 931212339 /nfs/dbraw/zinc/21/23/39/931212339.db2.gz MGNGCWWUXWGZMV-INIZCTEOSA-N 0 3 413.612 4.357 20 0 HIADHN Cc1nc2sc(-c3ccccc3)cc2c(N2CC[C@@H](N3CCN(C(C)C)CC3)C2)n1 ZINC000531836239 931214662 /nfs/dbraw/zinc/21/46/62/931214662.db2.gz UKYBNVBYCHCEIU-HXUWFJFHSA-N 0 3 421.614 4.271 20 0 HIADHN Cc1cc(-c2ccccc2)ccc1NC(=O)N1CC[C@H](N2CCN(C(C)C)CC2)C1 ZINC000531839997 931216074 /nfs/dbraw/zinc/21/60/74/931216074.db2.gz YYGCFUZTDPFNSP-QHCPKHFHSA-N 0 3 406.574 4.294 20 0 HIADHN O=C(CCOc1ccc(F)c(Cl)c1)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000531908410 931243201 /nfs/dbraw/zinc/24/32/01/931243201.db2.gz GDLKOYFWORNYKI-UHFFFAOYSA-N 0 3 420.912 4.091 20 0 HIADHN C[C@@H](NC[C@H](c1cccs1)N1CCN(C)CC1)c1ccc(F)cc1OC(F)F ZINC000531932528 931251164 /nfs/dbraw/zinc/25/11/64/931251164.db2.gz SQVOUFXHMICSJB-RHSMWYFYSA-N 0 3 413.509 4.128 20 0 HIADHN C[C@@H](N[C@@H](C)c1cccc(NS(C)(=O)=O)c1)c1ccc(OCC(F)(F)F)cc1 ZINC000531950758 931260765 /nfs/dbraw/zinc/26/07/65/931260765.db2.gz ZBYZTIZDMDTAPJ-KGLIPLIRSA-N 0 3 416.465 4.411 20 0 HIADHN CC(C)NS(=O)(=O)Cc1ccccc1CN[C@@H](C)c1cccc(-c2ccncc2)c1 ZINC000531958403 931264464 /nfs/dbraw/zinc/26/44/64/931264464.db2.gz YBFILQDNDIQDPT-IBGZPJMESA-N 0 3 423.582 4.427 20 0 HIADHN C[C@H](CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)N[C@H](CO)c1ccccc1 ZINC000531967593 931269462 /nfs/dbraw/zinc/26/94/62/931269462.db2.gz GZYFIGQLUJDNSQ-SJKOYZFVSA-N 0 3 400.828 4.399 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(-c2ccncc2)cc1)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000531984721 931275538 /nfs/dbraw/zinc/27/55/38/931275538.db2.gz TYJNVYPBPJYSNS-ZWKOTPCHSA-N 0 3 409.555 4.411 20 0 HIADHN CC(C)N1CCN([C@@H]2CCN(C(=O)[C@H](Sc3ccccc3)c3ccccc3)C2)CC1 ZINC000532088881 931307517 /nfs/dbraw/zinc/30/75/17/931307517.db2.gz HVIZMBFUVQKNSO-ISKFKSNPSA-N 0 3 423.626 4.147 20 0 HIADHN CC(C)N1CCN([C@@H]2CCN(C(=O)C3(c4ccc(Cl)c(Cl)c4)CCC3)C2)CC1 ZINC000532088121 931307702 /nfs/dbraw/zinc/30/77/02/931307702.db2.gz HZBAFOHKCITMIM-GOSISDBHSA-N 0 3 424.416 4.042 20 0 HIADHN Cc1sc(C(=O)N2CC[C@H](N3CCN(C(C)C)CC3)C2)cc1-c1ccc(F)cc1 ZINC000532088705 931307847 /nfs/dbraw/zinc/30/78/47/931307847.db2.gz FNIKJVDVPWCOOX-FQEVSTJZSA-N 0 3 415.578 4.103 20 0 HIADHN CC(C)N1CCN([C@@H]2CCN(C(=O)N[C@@H](CC3CCCCC3)C(C)(C)C)C2)CC1 ZINC000532094948 931310843 /nfs/dbraw/zinc/31/08/43/931310843.db2.gz XSQVPXBFQJYALB-YADHBBJMSA-N 0 3 406.659 4.181 20 0 HIADHN Cc1[nH]c(=O)c(C(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)cc1-c1ccccc1 ZINC000532149055 931328897 /nfs/dbraw/zinc/32/88/97/931328897.db2.gz UYTCZGURQWUKJS-OAQYLSRUSA-N 0 3 401.510 4.109 20 0 HIADHN CCCNC(=O)c1cccc(CN[C@@H](C)CC(=O)N(C)Cc2cccc(Cl)c2)c1 ZINC000532192952 931343634 /nfs/dbraw/zinc/34/36/34/931343634.db2.gz JQDPKILKWRZAEB-KRWDZBQOSA-N 0 3 415.965 4.007 20 0 HIADHN C[C@@H](N[C@@H](C)c1cccc(N2CCCS2(=O)=O)c1)c1ccc(OC(F)F)cc1 ZINC000532197677 931345022 /nfs/dbraw/zinc/34/50/22/931345022.db2.gz XFTNNIPPIBZGAE-CABCVRRESA-N 0 3 410.486 4.240 20 0 HIADHN C[C@@H](NC[C@H](O)COc1cccc(C(F)(F)F)c1)c1ccccc1OC(F)F ZINC000532207418 931351417 /nfs/dbraw/zinc/35/14/17/931351417.db2.gz JAXPIPLALKXKHT-OCCSQVGLSA-N 0 3 405.363 4.397 20 0 HIADHN C[C@@H](CCNCc1cc(Br)ccc1OCc1ccccc1)[S@](C)=O ZINC000532207900 931351446 /nfs/dbraw/zinc/35/14/46/931351446.db2.gz PQXLYRXOGVBRSL-OWJWWREXSA-N 0 3 410.377 4.275 20 0 HIADHN CC(C)N1CCN([C@@H]2CCN(C(=O)CCCCc3ccc(C(C)(C)C)cc3)C2)CC1 ZINC000532342991 931402646 /nfs/dbraw/zinc/40/26/46/931402646.db2.gz FRZQMIVUTLLORH-XMMPIXPASA-N 0 3 413.650 4.324 20 0 HIADHN CC(C)N1CCN([C@H]2CCN(C(=O)Nc3ccc4c(c3)oc3ccccc34)C2)CC1 ZINC000532350562 931404869 /nfs/dbraw/zinc/40/48/69/931404869.db2.gz GOUSMVDWVYIOFK-IBGZPJMESA-N 0 3 406.530 4.218 20 0 HIADHN C[C@H]1CN(C(=O)c2ccc(CNCc3ccc(Cl)c4cccnc34)cc2)C[C@H](C)O1 ZINC000532367498 931411469 /nfs/dbraw/zinc/41/14/69/931411469.db2.gz XCIWLVFKIPVTFQ-IRXDYDNUSA-N 0 3 423.944 4.427 20 0 HIADHN COc1cc(CNCc2cnn(CC(F)(F)F)c2)c(-c2ccccc2)cc1OC ZINC000532429306 931431295 /nfs/dbraw/zinc/43/12/95/931431295.db2.gz TYPPFUXOZNQWLK-UHFFFAOYSA-N 0 3 405.420 4.419 20 0 HIADHN CCC(=O)Nc1cccc(CN[C@@H](C)CC(=O)Nc2cccc(Br)c2)c1 ZINC000532447561 931438583 /nfs/dbraw/zinc/43/85/83/931438583.db2.gz JVTQCZJNQHNOTJ-AWEZNQCLSA-N 0 3 418.335 4.305 20 0 HIADHN C[C@H](CC(=O)Nc1ccc(Br)cc1)NCc1cnn(-c2ccccc2)c1 ZINC000532451561 931439425 /nfs/dbraw/zinc/43/94/25/931439425.db2.gz BIOCFLVLNGHNGO-OAHLLOKOSA-N 0 3 413.319 4.142 20 0 HIADHN CN1CCN(c2ccc(CN[C@H]3CCCSc4ccc(Cl)cc43)cn2)CC1 ZINC000532451676 931440329 /nfs/dbraw/zinc/44/03/29/931440329.db2.gz HNKNOHJDMFIUOJ-IBGZPJMESA-N 0 3 402.995 4.204 20 0 HIADHN Cc1ccc(CNC(=O)c2cccc(CN[C@H](C)CC(=O)N3CCCCCC3)c2)cc1 ZINC000532459500 931444818 /nfs/dbraw/zinc/44/48/18/931444818.db2.gz XSADPSLFSMUUPR-OAQYLSRUSA-N 0 3 421.585 4.196 20 0 HIADHN COc1ccc2cc([C@H](C)NCc3ccc(C(=O)N4CCOCC4)cc3)ccc2c1 ZINC000532471986 931451319 /nfs/dbraw/zinc/45/13/19/931451319.db2.gz WDRMQPGDRVSLMV-SFHVURJKSA-N 0 3 404.510 4.172 20 0 HIADHN CC[C@H](N[C@H](CN1CCN(C)CC1)c1ccccc1)c1ccccc1OC(F)F ZINC000532481118 931455742 /nfs/dbraw/zinc/45/57/42/931455742.db2.gz OXLKUMSYHOTUKE-LEWJYISDSA-N 0 3 403.517 4.317 20 0 HIADHN CC(C)(C)CCN1CCN(CC(=O)Nc2nc(-c3ccc(F)c(F)c3)cs2)CC1 ZINC000532493862 931460028 /nfs/dbraw/zinc/46/00/28/931460028.db2.gz SZNHBVBTQIMGBQ-UHFFFAOYSA-N 0 3 422.545 4.081 20 0 HIADHN C[C@H](C(=O)N(c1nccs1)C1CCCCC1)N1CCN(CCC(C)(C)C)CC1 ZINC000532493214 931460239 /nfs/dbraw/zinc/46/02/39/931460239.db2.gz CBYALGJXIINTND-GOSISDBHSA-N 0 3 406.640 4.251 20 0 HIADHN CC[C@H](C(=O)N[C@@H](C)c1sc(-c2ccc(Br)cc2)nc1C)N(C)C ZINC000532494187 931460989 /nfs/dbraw/zinc/46/09/89/931460989.db2.gz AFSVCJVIHOIYQX-XHDPSFHLSA-N 0 3 410.381 4.398 20 0 HIADHN O[C@@H](CNCc1ccc(F)cc1C(F)(F)F)COc1ccccc1Br ZINC000532496490 931461986 /nfs/dbraw/zinc/46/19/86/931461986.db2.gz YMAKDUJGRLYKGZ-ZDUSSCGKSA-N 0 3 422.216 4.137 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)Nc2ccc(SC3CCCC3)cc2)CC1 ZINC000532507881 931467574 /nfs/dbraw/zinc/46/75/74/931467574.db2.gz UZXQXOCNTINYLB-SFHVURJKSA-N 0 3 404.624 4.116 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)N[C@H](C)c2ccc(S(C)(=O)=O)c(F)c2)cc1 ZINC000532519176 931472157 /nfs/dbraw/zinc/47/21/57/931472157.db2.gz MXCGBSXAWMZAFY-LSDHHAIUSA-N 0 3 401.507 4.135 20 0 HIADHN COc1ccccc1C[C@@H](C)N[C@@H](c1ccccc1)c1cccc(S(C)(=O)=O)c1 ZINC000532537623 931515097 /nfs/dbraw/zinc/51/50/97/931515097.db2.gz LBJSHVPVTRBEOO-KOSHJBKYSA-N 0 3 409.551 4.409 20 0 HIADHN O=C(CCN1CCC[C@@H]1[C@H](O)C(F)(F)F)Nc1ccccc1Oc1ccccc1 ZINC000532553284 931520485 /nfs/dbraw/zinc/52/04/85/931520485.db2.gz WIAKHIOSWJPHHQ-XLIONFOSSA-N 0 3 408.420 4.195 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)CN2C[C@@H](c3ccccc3)C[C@H]2C)cc1OC ZINC000532582842 931540254 /nfs/dbraw/zinc/54/02/54/931540254.db2.gz YYAAPHGKCWUFHR-COPCDDAFSA-N 0 3 408.542 4.245 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(NC(=O)NC2CC2)cc1)C(=O)N1c2ccccc2CC[C@H]1C ZINC000532614622 931554480 /nfs/dbraw/zinc/55/44/80/931554480.db2.gz RINMUYSZFJQQGA-SQNIBIBYSA-N 0 3 420.557 4.378 20 0 HIADHN O[C@H](CNCc1cnc(C2CCCC2)s1)COc1ccccc1Br ZINC000532627217 931560076 /nfs/dbraw/zinc/56/00/76/931560076.db2.gz FOLUUWAAXQYUET-CQSZACIVSA-N 0 3 411.365 4.093 20 0 HIADHN O[C@H](COc1c(Cl)cccc1Cl)CN1CCC(c2nc3ccccc3[nH]2)CC1 ZINC000532718937 931607152 /nfs/dbraw/zinc/60/71/52/931607152.db2.gz JVWWZPNXQBGRTM-HNNXBMFYSA-N 0 3 420.340 4.489 20 0 HIADHN O=C1c2ccccc2C(=O)N1[C@H]1CCCC[C@H](NCc2coc(-c3cccs3)n2)C1 ZINC000532765447 931626875 /nfs/dbraw/zinc/62/68/75/931626875.db2.gz XOWXUKKOLQYOJQ-RDJZCZTQSA-N 0 3 421.522 4.490 20 0 HIADHN O=C(CCNCc1cnc(-c2ccc(Br)cc2)s1)Nc1ccccn1 ZINC000532785491 931630288 /nfs/dbraw/zinc/63/02/88/931630288.db2.gz FDLBHNAUWJDHNN-UHFFFAOYSA-N 0 3 417.332 4.086 20 0 HIADHN CC(C)Cc1ccc(CNCc2ccccc2CS(=O)(=O)N2CCCC2)cc1 ZINC000532857981 931668394 /nfs/dbraw/zinc/66/83/94/931668394.db2.gz WBGBAOJFMFVUEJ-UHFFFAOYSA-N 0 3 400.588 4.101 20 0 HIADHN CN(CC(=O)N(Cc1nnc(-c2ccccc2Cl)o1)C1CC1)CC1CCCCC1 ZINC000532900881 931685322 /nfs/dbraw/zinc/68/53/22/931685322.db2.gz OLZQUMUTKHXCEN-UHFFFAOYSA-N 0 3 416.953 4.393 20 0 HIADHN COc1cc(Br)c(CN[C@@H]2CCOC3(CCSCC3)C2)c(OC)c1 ZINC000532905351 931687401 /nfs/dbraw/zinc/68/74/01/931687401.db2.gz ISHMCWVZGHONAL-CYBMUJFWSA-N 0 3 416.381 4.001 20 0 HIADHN CCN1CCCN(CC(=O)Nc2nc(-c3ccc(Cl)c(Cl)c3)cs2)CC1 ZINC000532942776 931706350 /nfs/dbraw/zinc/70/63/50/931706350.db2.gz IERZFNAHNGSXPA-UHFFFAOYSA-N 0 3 413.374 4.083 20 0 HIADHN C[C@@H](O)CN(CC(=O)Nc1cccc(CSc2ccccn2)c1)C1CCCCC1 ZINC000532966485 931716849 /nfs/dbraw/zinc/71/68/49/931716849.db2.gz MWSYDBGYWUCZRI-GOSISDBHSA-N 0 3 413.587 4.328 20 0 HIADHN CCCN(CC(=O)Nc1ccc(Br)cc1F)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000532970203 931720521 /nfs/dbraw/zinc/72/05/21/931720521.db2.gz ADGDLTPBEUTRKY-XWIAVFTESA-N 0 3 413.331 4.052 20 0 HIADHN Cc1ccccc1Sc1ccc(C(=O)N2CC[C@@H](N3CCN(C(C)C)CC3)C2)cc1 ZINC000532993473 931730635 /nfs/dbraw/zinc/73/06/35/931730635.db2.gz VAKJSSGWLMUUTM-JOCHJYFZSA-N 0 3 423.626 4.387 20 0 HIADHN COc1cc2c(cc1CN[C@H](C)[C@@H](OC1CCOCC1)c1ccccc1)O[C@H](C)C2 ZINC000533007321 931733853 /nfs/dbraw/zinc/73/38/53/931733853.db2.gz HVZYCCZMWJRMOD-QJMRKGMQSA-N 0 3 411.542 4.434 20 0 HIADHN O=C(CCN1CCC([C@@H](O)C(F)(F)F)CC1)Nc1ccc(Oc2ccccc2)cc1 ZINC000533025137 931744242 /nfs/dbraw/zinc/74/42/42/931744242.db2.gz LIYKGPSYKZFHKZ-OAQYLSRUSA-N 0 3 422.447 4.443 20 0 HIADHN COC(=O)CC1(NCC(=O)Nc2cc(C(F)(F)F)ccc2Cl)CCCCC1 ZINC000533068191 931761349 /nfs/dbraw/zinc/76/13/49/931761349.db2.gz ZBBSBOZGOYQFKA-UHFFFAOYSA-N 0 3 406.832 4.153 20 0 HIADHN COCCN1CCC[C@H]1CNCc1nc(-c2cc(Cl)ccc2Cl)cs1 ZINC000533149336 931787806 /nfs/dbraw/zinc/78/78/06/931787806.db2.gz OYHHLFJTSBUIBP-AWEZNQCLSA-N 0 3 400.375 4.317 20 0 HIADHN CC(C)N1CCN([C@H]2CCN(C(=O)Nc3ccc(SC4CCCC4)cc3)C2)CC1 ZINC000533259022 931821405 /nfs/dbraw/zinc/82/14/05/931821405.db2.gz ZLOPCEPCETUROJ-FQEVSTJZSA-N 0 3 416.635 4.354 20 0 HIADHN Cc1cc(C)n(-c2ccc(CN3CC[C@@H](NC(=O)Nc4ccc(F)cc4)C3)cc2)n1 ZINC000533364561 931849204 /nfs/dbraw/zinc/84/92/04/931849204.db2.gz QJVFOQMQROUNRH-OAQYLSRUSA-N 0 3 407.493 4.024 20 0 HIADHN COc1cc(C)c([C@@H](C)NC(=O)CN[C@H](c2ccc(F)cc2)C2CCC2)cc1OC ZINC000533367895 931850247 /nfs/dbraw/zinc/85/02/47/931850247.db2.gz ZZSHDWMFBREHDL-GYCJOSAFSA-N 0 3 414.521 4.460 20 0 HIADHN CCN(CC)C(=O)c1cccc(NC(=O)CN[C@H](c2ccc(F)cc2)C2CCC2)c1 ZINC000533376542 931852631 /nfs/dbraw/zinc/85/26/31/931852631.db2.gz AFXYANXSRTXRPZ-QHCPKHFHSA-N 0 3 411.521 4.377 20 0 HIADHN O=C(CN[C@@H](c1ccccc1)C1CCCC1)NCc1ccccc1Cn1cccn1 ZINC000533384207 931854403 /nfs/dbraw/zinc/85/44/03/931854403.db2.gz LGWDBAGHVUHQNF-VWLOTQADSA-N 0 3 402.542 4.069 20 0 HIADHN CCCN(CC(=O)Nc1ccc(NC(C)=O)cc1)[C@H]1C[C@@H](OCC)C12CCCC2 ZINC000533428847 931865517 /nfs/dbraw/zinc/86/55/17/931865517.db2.gz FGSMCWPLBWSSQS-LEWJYISDSA-N 0 3 401.551 4.033 20 0 HIADHN Cc1ccccc1O[C@@H]1CCCC[C@@H]1NC(=O)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000533450500 931874041 /nfs/dbraw/zinc/87/40/41/931874041.db2.gz KSZAGNANMOSWOT-WPFOTENUSA-N 0 3 407.558 4.108 20 0 HIADHN O=c1cc(CN(C2CC2)[C@H]2CCCc3ccccc32)nc2ccc(Br)cn12 ZINC000533487008 931882632 /nfs/dbraw/zinc/88/26/32/931882632.db2.gz LACYISOKYYWNOH-FQEVSTJZSA-N 0 3 424.342 4.499 20 0 HIADHN O=C(NC[C@H]1CCCCN1CCCc1nc(-c2ccccc2)no1)Nc1ccccc1 ZINC000533494849 931884488 /nfs/dbraw/zinc/88/44/88/931884488.db2.gz MGAKTCIIPCSIBI-OAQYLSRUSA-N 0 3 419.529 4.345 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CNC(=O)CN[C@H](c1ccc(F)cc1)C1CCC1 ZINC000533513780 931890623 /nfs/dbraw/zinc/89/06/23/931890623.db2.gz UAJVIRYMPDAIOD-VWLOTQADSA-N 0 3 420.532 4.375 20 0 HIADHN C[C@H](NC(=O)CNC1(c2ccccc2)CCOCC1)c1ccc(Cl)cc1Cl ZINC000533517238 931891757 /nfs/dbraw/zinc/89/17/57/931891757.db2.gz DNBNHPFCSZULOD-HNNXBMFYSA-N 0 3 407.341 4.466 20 0 HIADHN Cc1cc(F)ccc1N1CCC[C@@H](N2CCC(c3c[nH]c4ncccc34)CC2)C1=O ZINC000533518335 931892290 /nfs/dbraw/zinc/89/22/90/931892290.db2.gz DHENZVITELCIAV-JOCHJYFZSA-N 0 3 406.505 4.385 20 0 HIADHN O=C(CNC1(c2ccccc2)CCOCC1)N[C@H](c1cccs1)c1ccc(F)cc1 ZINC000533518469 931892464 /nfs/dbraw/zinc/89/24/64/931892464.db2.gz JAMQPCXNXXUGCO-QHCPKHFHSA-N 0 3 424.541 4.388 20 0 HIADHN CC(C)N1CCN([C@@H]2CCN([C@@H](C)c3ncc(-c4ccc(Cl)cc4)o3)C2)CC1 ZINC000533559061 931900264 /nfs/dbraw/zinc/90/02/64/931900264.db2.gz PFZHVLLQFPWKKK-FXAWDEMLSA-N 0 3 402.970 4.156 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)Nc1cccc(-c2ncco2)c1 ZINC000533620845 931928957 /nfs/dbraw/zinc/92/89/57/931928957.db2.gz PEAZGXZUVFUCQC-UHFFFAOYSA-N 0 3 419.529 4.066 20 0 HIADHN CC(C)Oc1cccc(CN(C)C(=O)CCCN2CCN(c3ccccc3)CC2)c1 ZINC000533737658 932000369 /nfs/dbraw/zinc/00/03/69/932000369.db2.gz JEYWNCHTLDPMFE-UHFFFAOYSA-N 0 3 409.574 4.035 20 0 HIADHN CC(C)(COc1ccc(C(F)(F)F)cn1)NCc1cnc([C@@H]2CCCO2)s1 ZINC000533757282 932013105 /nfs/dbraw/zinc/01/31/05/932013105.db2.gz STURAXNPBFULRM-AWEZNQCLSA-N 0 3 401.454 4.356 20 0 HIADHN Cc1ccc(C)c(OC2CCN(C(=O)NC[C@H](Cc3ccccc3)N(C)C)CC2)c1 ZINC000533810227 932042506 /nfs/dbraw/zinc/04/25/06/932042506.db2.gz HHDZHAUUAKFCPO-QFIPXVFZSA-N 0 3 409.574 4.029 20 0 HIADHN CN1CC[C@@H](NC(=O)NCc2cccc(NC(=O)C3CCCC3)c2)[C@H]1c1ccccc1 ZINC000533890784 932083865 /nfs/dbraw/zinc/08/38/65/932083865.db2.gz IORQJFWCWZZRQC-DHIUTWEWSA-N 0 3 420.557 4.060 20 0 HIADHN CN1CC[C@@H](NC(=O)NCc2nc3cc(Cl)ccc3s2)[C@@H]1c1ccccc1 ZINC000533893421 932085694 /nfs/dbraw/zinc/08/56/94/932085694.db2.gz XCAFVZXEWVSTEE-BEFAXECRSA-N 0 3 400.935 4.194 20 0 HIADHN C[C@H](Cc1c(Cl)cccc1Cl)NC(=O)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000534003563 932186561 /nfs/dbraw/zinc/18/65/61/932186561.db2.gz SYCRHJFGODCEOW-NVXWUHKLSA-N 0 3 406.357 4.348 20 0 HIADHN CN1CC[C@H](NC(=O)c2ccc(NC(=O)c3cccs3)cc2)[C@@H]1c1ccccc1 ZINC000534017282 932198375 /nfs/dbraw/zinc/19/83/75/932198375.db2.gz DEFALFMHLXEEKP-FPOVZHCZSA-N 0 3 405.523 4.176 20 0 HIADHN CC(C)c1cc(C(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)c2cnn(C(C)C)c2n1 ZINC000534020738 932202831 /nfs/dbraw/zinc/20/28/31/932202831.db2.gz VRPOQVGCODIDGD-UNMCSNQZSA-N 0 3 405.546 4.311 20 0 HIADHN O[C@@H]1C[C@@H](CNCc2ccc(-c3nc4ccccc4s3)o2)N(Cc2ccccc2)C1 ZINC000534083636 932263302 /nfs/dbraw/zinc/26/33/02/932263302.db2.gz JZUZVJMZUBVIGH-RBUKOAKNSA-N 0 3 419.550 4.281 20 0 HIADHN Cc1ccc(Br)c(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2)c1 ZINC000534160188 932308146 /nfs/dbraw/zinc/30/81/46/932308146.db2.gz WBMIHANTKWYYNQ-UHFFFAOYSA-N 0 3 408.315 4.492 20 0 HIADHN Cc1c2cccc(Cl)c2oc1C(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1CO ZINC000534181797 932319228 /nfs/dbraw/zinc/31/92/28/932319228.db2.gz MAKJKMMYLZASSX-FXAWDEMLSA-N 0 3 412.917 4.007 20 0 HIADHN O=C(N[C@H]1CCN(Cc2ccccc2)C[C@H]1CO)c1ccc(Oc2ccccc2)cc1 ZINC000534182686 932319973 /nfs/dbraw/zinc/31/99/73/932319973.db2.gz RKKUMJPJYCVQLU-DHLKQENFSA-N 0 3 416.521 4.092 20 0 HIADHN O=C(N[C@@H]1CCN(Cc2ccccc2)C[C@H]1CO)c1cccc(OC2CCCCC2)c1 ZINC000534181967 932320080 /nfs/dbraw/zinc/32/00/80/932320080.db2.gz LJJNEYBAMZXUOM-WIOPSUGQSA-N 0 3 422.569 4.011 20 0 HIADHN CN(C)CCN(Cc1cccc(O)c1)C(=O)Cc1csc2ccc(Cl)cc12 ZINC000534191040 932323788 /nfs/dbraw/zinc/32/37/88/932323788.db2.gz NZHTZNXTXMOLID-UHFFFAOYSA-N 0 3 402.947 4.393 20 0 HIADHN CC(C)n1ccnc1CN1CCCN(Cc2c[nH]nc2-c2ccc(Cl)cc2)CC1 ZINC000534350111 932389677 /nfs/dbraw/zinc/38/96/77/932389677.db2.gz MDKSOXJBMBMVCX-UHFFFAOYSA-N 0 3 412.969 4.215 20 0 HIADHN C[C@@H](C(=O)Nc1ccc(OCc2ccccc2)cc1)N1CC[C@@H](C2CCOCC2)C1 ZINC000534380228 932407297 /nfs/dbraw/zinc/40/72/97/932407297.db2.gz FSHILGLRIRQBQK-SIKLNZKXSA-N 0 3 408.542 4.341 20 0 HIADHN O=C(CN1CC[C@@H](C2CCOCC2)C1)N[C@@H](c1ccccc1)c1cccc(Cl)c1 ZINC000534381670 932408982 /nfs/dbraw/zinc/40/89/82/932408982.db2.gz APTZJMRVILDEQB-QPPBQGQZSA-N 0 3 412.961 4.294 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N2CCC[C@H]2Cn2cnc3ccccc32)C1 ZINC000534449884 932464511 /nfs/dbraw/zinc/46/45/11/932464511.db2.gz SSJMGSRFTIPGAU-FCEUIQTBSA-N 0 3 417.557 4.046 20 0 HIADHN Brc1ccccc1N1CC[C@@H](NCc2cnc([C@H]3CCCO3)s2)C1 ZINC000534464054 932481082 /nfs/dbraw/zinc/48/10/82/932481082.db2.gz AGHMNCOMSYLTHJ-CXAGYDPISA-N 0 3 408.365 4.126 20 0 HIADHN Cc1cccc(Nc2ccccc2C(=O)Nc2ccc(=O)n(CCN(C)C)c2)c1C ZINC000534488835 932527230 /nfs/dbraw/zinc/52/72/30/932527230.db2.gz JGJSLCVMYDBPSA-UHFFFAOYSA-N 0 3 404.514 4.023 20 0 HIADHN CN(C)[C@H](CNC(=O)C1(c2ccc(Br)cc2)CCC1)Cc1ccccc1 ZINC000534521254 932543566 /nfs/dbraw/zinc/54/35/66/932543566.db2.gz ANELVKZVTFRQEO-FQEVSTJZSA-N 0 3 415.375 4.160 20 0 HIADHN CN(C)[C@H](CNC(=O)Nc1cc(F)ccc1SCC(F)F)Cc1ccccc1 ZINC000534526683 932545461 /nfs/dbraw/zinc/54/54/61/932545461.db2.gz DCURDFWMNKKUQV-INIZCTEOSA-N 0 3 411.493 4.477 20 0 HIADHN Cc1c([C@H](C)NC(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)cnn1-c1ccc(F)cc1 ZINC000534682908 932653868 /nfs/dbraw/zinc/65/38/68/932653868.db2.gz PVMFVUVLFGVQIN-PBNUPURSSA-N 0 3 421.520 4.125 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)CCc2cc(Br)ccc2F)CC1 ZINC000534684322 932654624 /nfs/dbraw/zinc/65/46/24/932654624.db2.gz MPBAEPMZTRJWBF-UHFFFAOYSA-N 0 3 423.326 4.237 20 0 HIADHN Cc1nc(C)n(-c2ccccc2NC(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)n1 ZINC000534751277 932726285 /nfs/dbraw/zinc/72/62/85/932726285.db2.gz DYFHYKIHWUGSTE-QHCPKHFHSA-N 0 3 418.545 4.151 20 0 HIADHN C[C@@H](C(=O)N1CCCN(C2CCCC2)CC1)c1cccc(C(=O)c2ccccc2)c1 ZINC000534887868 932824032 /nfs/dbraw/zinc/82/40/32/932824032.db2.gz NPPFAHWATNIUTH-HXUWFJFHSA-N 0 3 404.554 4.498 20 0 HIADHN Cc1cc(NC(=O)NC2CCC(F)(F)CC2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000534896214 932827449 /nfs/dbraw/zinc/82/74/49/932827449.db2.gz QRXAHVPCLBBXJM-IBGZPJMESA-N 0 3 417.504 4.338 20 0 HIADHN O=C(Nc1ccc(C(F)(F)F)nc1)N1CCCN(CCCc2ccccc2)CC1 ZINC000534900294 932830280 /nfs/dbraw/zinc/83/02/80/932830280.db2.gz LOKMXSPIOHYGOX-UHFFFAOYSA-N 0 3 406.452 4.273 20 0 HIADHN Cc1cc(C(=O)N(CCN(C)C)Cc2cccc(O)c2)nc(-c2ccc(Cl)cc2)n1 ZINC000534924821 932841242 /nfs/dbraw/zinc/84/12/42/932841242.db2.gz AAZJKTZADYOARH-UHFFFAOYSA-N 0 3 424.932 4.015 20 0 HIADHN COc1ccc2nc(C3CC3)cc(C(=O)N(CCN(C)C)Cc3cccc(O)c3)c2c1 ZINC000534927159 932842018 /nfs/dbraw/zinc/84/20/18/932842018.db2.gz YUBYFHLKBXIZHB-UHFFFAOYSA-N 0 3 419.525 4.030 20 0 HIADHN CC(C)c1cc(C(=O)N(CCN(C)C)Cc2cccc(O)c2)c2cnn(C(C)C)c2n1 ZINC000534926909 932842048 /nfs/dbraw/zinc/84/20/48/932842048.db2.gz VCOADSWJFXBCQH-UHFFFAOYSA-N 0 3 423.561 4.045 20 0 HIADHN O=C(Nc1ccc2c(c1)OCO2)C1CCN(Cc2ccc(Cl)c3cccnc23)CC1 ZINC000535066051 932896452 /nfs/dbraw/zinc/89/64/52/932896452.db2.gz BMWUKZIWSJWVPC-UHFFFAOYSA-N 0 3 423.900 4.468 20 0 HIADHN O=C(Nc1cccc(CNC(=O)N2CCN(C3CCCCC3)CC2)c1)c1ccccc1 ZINC000535112132 932928717 /nfs/dbraw/zinc/92/87/17/932928717.db2.gz OSLYWOOFKGMGTG-UHFFFAOYSA-N 0 3 420.557 4.099 20 0 HIADHN CC(C)(COc1ncccc1C(F)(F)F)NCc1cnc([C@H]2CCCO2)s1 ZINC000535183868 933000855 /nfs/dbraw/zinc/00/08/55/933000855.db2.gz AMROHXYIOMMCTH-CQSZACIVSA-N 0 3 401.454 4.356 20 0 HIADHN CN(C)CCn1cc(NC(=O)c2ccccc2SCc2cccs2)ccc1=O ZINC000535225972 933028553 /nfs/dbraw/zinc/02/85/53/933028553.db2.gz PMPNJARKJOCEOL-UHFFFAOYSA-N 0 3 413.568 4.016 20 0 HIADHN CCOc1ccc(NC(=O)NC[C@H](Cc2ccccc2)N(C)C)c(C(F)(F)F)c1 ZINC000535262416 933041736 /nfs/dbraw/zinc/04/17/36/933041736.db2.gz UYAMOVCAUPGPOZ-INIZCTEOSA-N 0 3 409.452 4.399 20 0 HIADHN CC[C@@H](NC(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1)c1c(C)noc1C ZINC000535278738 933046932 /nfs/dbraw/zinc/04/69/32/933046932.db2.gz XPNYXKRAHLVSRY-YLJYHZDGSA-N 0 3 409.452 4.313 20 0 HIADHN Cc1cc(C(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)ccc1Br ZINC000535287607 933051041 /nfs/dbraw/zinc/05/10/41/933051041.db2.gz JKDJBBHGPYJBFZ-IRXDYDNUSA-N 0 3 423.395 4.109 20 0 HIADHN CN(C)[C@@H](CNC(=O)Nc1cccc2c1CN(c1ccccn1)C2)c1ccccc1 ZINC000535324006 933073049 /nfs/dbraw/zinc/07/30/49/933073049.db2.gz AVRYUNZZMKRUEC-QFIPXVFZSA-N 0 3 401.514 4.026 20 0 HIADHN C[C@H](NC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1)c1nc2ccccc2n1C(F)F ZINC000535340426 933082229 /nfs/dbraw/zinc/08/22/29/933082229.db2.gz OCCRSJSOZDHAJD-UCLAIMLFSA-N 0 3 413.472 4.237 20 0 HIADHN CC(C)Cn1ncc(C(=O)NC[C@@H]2CCCN(C)[C@H]2c2cccs2)c1C(F)F ZINC000535388211 933108461 /nfs/dbraw/zinc/10/84/61/933108461.db2.gz LLOKFOKFECLTIH-WMLDXEAASA-N 0 3 410.534 4.351 20 0 HIADHN CN(Cc1ccccc1OC(F)(F)F)C(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000535395082 933112976 /nfs/dbraw/zinc/11/29/76/933112976.db2.gz DKAOAODLNFSXGR-MJGOQNOKSA-N 0 3 407.436 4.172 20 0 HIADHN Cc1nc(-c2ccc(CNC(=O)N[C@H]3CCN(C)[C@H]3c3ccccc3)s2)cs1 ZINC000535398517 933115956 /nfs/dbraw/zinc/11/59/56/933115956.db2.gz VGKLVPIYFOYICN-PXNSSMCTSA-N 0 3 412.584 4.425 20 0 HIADHN CCc1c(C(=O)Nc2cc(C)cc(CN(C)C)c2)nnn1-c1ccc(OC(C)C)cc1 ZINC000535421597 933127699 /nfs/dbraw/zinc/12/76/99/933127699.db2.gz YTXSXEWADAIEQK-UHFFFAOYSA-N 0 3 421.545 4.239 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)[C@H]2CCCN(c3ncccc3C(F)(F)F)C2)c1 ZINC000535421837 933128822 /nfs/dbraw/zinc/12/88/22/933128822.db2.gz TVKALXKOLVZORC-KRWDZBQOSA-N 0 3 420.479 4.326 20 0 HIADHN CN1CC[C@@H](NC(=O)NCc2ccnc(Oc3ccc(F)cc3)c2)[C@H]1c1ccccc1 ZINC000535432085 933131832 /nfs/dbraw/zinc/13/18/32/933131832.db2.gz HWHXGFHUHBQYPM-FYYLOGMGSA-N 0 3 420.488 4.258 20 0 HIADHN COc1ccc([C@@H](CNC(=O)Nc2cc3c(cc2Cl)OCO3)N2CCCC2)cc1 ZINC000535474803 933166433 /nfs/dbraw/zinc/16/64/33/933166433.db2.gz JGSZHIKRPLLEAC-GOSISDBHSA-N 0 3 417.893 4.036 20 0 HIADHN CC[C@H](C)n1ncc(C(=O)Nc2ccc(CN3CCN(CC)CC3)cc2)c1C1CC1 ZINC000535505285 933198019 /nfs/dbraw/zinc/19/80/19/933198019.db2.gz VWBHOLHYSIRLFB-SFHVURJKSA-N 0 3 409.578 4.121 20 0 HIADHN OC[C@@H](Cc1c[nH]c2ccccc12)N[C@@H]1CCc2c1c(Br)ccc2F ZINC000535507696 933200686 /nfs/dbraw/zinc/20/06/86/933200686.db2.gz KGBWPVHUMIFSDT-BFUOFWGJSA-N 0 3 403.295 4.250 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)c1cccc([C@H]2CCOC2)c1 ZINC000535619781 933271318 /nfs/dbraw/zinc/27/13/18/933271318.db2.gz GGSGXCVSDDUXEM-FQEVSTJZSA-N 0 3 420.475 4.413 20 0 HIADHN CC(C)Cn1cc(NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)c(C(F)F)n1 ZINC000535663551 933308073 /nfs/dbraw/zinc/30/80/73/933308073.db2.gz FXASYKJXGPDZHJ-MRXNPFEDSA-N 0 3 408.468 4.467 20 0 HIADHN CC(C)[C@@H](Oc1cccc(Cl)c1)C(=O)NC1CCN([C@H](C)c2ccncc2)CC1 ZINC000535836748 933423220 /nfs/dbraw/zinc/42/32/20/933423220.db2.gz SVFIUXKPNFYNFG-VGOFRKELSA-N 0 3 415.965 4.480 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(CN3CC[C@@H](C)[C@H](n4ccnc4)C3)c2)cc1 ZINC000535850006 933431578 /nfs/dbraw/zinc/43/15/78/933431578.db2.gz CCEYMGCFKFECBT-WZONZLPQSA-N 0 3 404.514 4.227 20 0 HIADHN COc1ccc(C(=O)N(Cc2ccccc2)C2CCN(C)CC2)cc1-c1ccccn1 ZINC000535854957 933437816 /nfs/dbraw/zinc/43/78/16/933437816.db2.gz JBCZEWUGLVEDBG-UHFFFAOYSA-N 0 3 415.537 4.494 20 0 HIADHN C[C@H](C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)N1CC[C@H](C2CCOCC2)C1 ZINC000535870352 933452142 /nfs/dbraw/zinc/45/21/42/933452142.db2.gz LZLKHIGMPDVGFJ-OCCSQVGLSA-N 0 3 404.860 4.434 20 0 HIADHN Cc1cc(C)c(CC(C(=O)Nc2ccnn2C[C@@H]2CCOC2)C(F)(F)F)c(C)c1 ZINC000535879854 933460914 /nfs/dbraw/zinc/46/09/14/933460914.db2.gz NNVVUXUZNPWHKH-FUHWJXTLSA-N 0 3 409.452 4.205 20 0 HIADHN CC1(C)CCC[C@H](CC(=O)N2CCC[C@@H](CN3CCN(c4ccccn4)CC3)C2)C1 ZINC000535966557 933529096 /nfs/dbraw/zinc/52/90/96/933529096.db2.gz IYQBULOSOKGPSI-YADHBBJMSA-N 0 3 412.622 4.049 20 0 HIADHN CC(=O)CCc1ccc2oc(C(=O)NC[C@H](Cc3ccccc3)N(C)C)c(C)c2c1 ZINC000536012418 933570908 /nfs/dbraw/zinc/57/09/08/933570908.db2.gz GAHKJXOLEYOEBI-NRFANRHFSA-N 0 3 406.526 4.166 20 0 HIADHN CN1CC[C@H](NC(=O)NCc2cccc(COCc3ccco3)c2)[C@@H]1c1ccccc1 ZINC000536094055 933644748 /nfs/dbraw/zinc/64/47/48/933644748.db2.gz CMXIAZOORNQSPC-ZEQRLZLVSA-N 0 3 419.525 4.241 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)CCc2cc(Br)ccc2F)o1 ZINC000536095139 933646213 /nfs/dbraw/zinc/64/62/13/933646213.db2.gz LVOXAFICDWBLRV-UHFFFAOYSA-N 0 3 411.315 4.013 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)c2cc(Br)cc3cccnc32)o1 ZINC000536097635 933650303 /nfs/dbraw/zinc/65/03/03/933650303.db2.gz FPNZZSLNDJASIM-UHFFFAOYSA-N 0 3 416.319 4.103 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)c3ccc(OC4CCC4)cc3Cl)CC2)C[C@@H](C)O1 ZINC000536108310 933660298 /nfs/dbraw/zinc/66/02/98/933660298.db2.gz LTFNFGLKHKDARF-IAGOWNOFSA-N 0 3 420.981 4.233 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)[C@@H](C)N[C@H](c1ccc2c(c1)OCCO2)C1CC1 ZINC000537289730 933699771 /nfs/dbraw/zinc/69/97/71/933699771.db2.gz HSKHHKMTIIZTKZ-ASSNKEHSSA-N 0 3 416.905 4.188 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)[C@H](C)N[C@H](c1ccc2c(c1)OCCO2)C1CC1 ZINC000537289741 933700011 /nfs/dbraw/zinc/70/00/11/933700011.db2.gz HSKHHKMTIIZTKZ-ZSEKCTLFSA-N 0 3 416.905 4.188 20 0 HIADHN CCC1(CC)[C@H](N[C@H](c2ccccc2)c2cccc(S(C)(=O)=O)c2)C[C@@H]1OC ZINC000537296951 933703653 /nfs/dbraw/zinc/70/36/53/933703653.db2.gz ZMPPGDASEHGAEG-BHIFYINESA-N 0 3 401.572 4.363 20 0 HIADHN CC[C@@H](NCc1ccccc1CS(C)(=O)=O)c1cc(F)cc(Br)c1 ZINC000537308461 933708643 /nfs/dbraw/zinc/70/86/43/933708643.db2.gz WUVBIPKCVICQBG-GOSISDBHSA-N 0 3 414.340 4.374 20 0 HIADHN Cc1cc(C(=O)N(Cc2ccco2)C2CCN(C)CC2)nn1-c1cc(C)cc(C)c1 ZINC000537399369 933758103 /nfs/dbraw/zinc/75/81/03/933758103.db2.gz SCWOWTJFAOFAGG-UHFFFAOYSA-N 0 3 406.530 4.127 20 0 HIADHN CC(C)N1CC[C@H](NC(=O)N[C@H]2CCCc3cn[nH]c32)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000537453954 933780075 /nfs/dbraw/zinc/78/00/75/933780075.db2.gz HMTPPWVECDRUCJ-BJLQDIEVSA-N 0 3 419.932 4.103 20 0 HIADHN CC(=O)Nc1cc(NC(=O)NC[C@@H](c2ccc(CC(C)C)cc2)N(C)C)ccc1F ZINC000562881086 945139997 /nfs/dbraw/zinc/13/99/97/945139997.db2.gz UOGJWPPPEDBQOD-QFIPXVFZSA-N 0 3 414.525 4.407 20 0 HIADHN CC(C)N1CC[C@H](NC(=O)c2cccc(CN(C)C)c2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000537521194 938315224 /nfs/dbraw/zinc/31/52/24/938315224.db2.gz MSKKWWKDDAWXJF-FCHUYYIVSA-N 0 3 417.956 4.495 20 0 HIADHN Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)C(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000537551895 938321588 /nfs/dbraw/zinc/32/15/88/938321588.db2.gz RRCWPJZOZVETOQ-QOKNQOGYSA-N 0 3 422.495 4.117 20 0 HIADHN Cc1nc([C@@H]2CCCN([C@H](C(=O)Nc3cc(C)ccc3C)c3ccccc3)C2)n[nH]1 ZINC000537564333 938326031 /nfs/dbraw/zinc/32/60/31/938326031.db2.gz SVDLRTFFECSQED-IRLDBZIGSA-N 0 3 403.530 4.289 20 0 HIADHN Cc1n[nH]c([C@@H]2CCCN([C@H](C(=O)Nc3cc(C)ccc3C)c3ccccc3)C2)n1 ZINC000537564333 938326034 /nfs/dbraw/zinc/32/60/34/938326034.db2.gz SVDLRTFFECSQED-IRLDBZIGSA-N 0 3 403.530 4.289 20 0 HIADHN Cc1nnc([C@@H]2CCCN([C@H](C(=O)Nc3cc(C)ccc3C)c3ccccc3)C2)[nH]1 ZINC000537564333 938326037 /nfs/dbraw/zinc/32/60/37/938326037.db2.gz SVDLRTFFECSQED-IRLDBZIGSA-N 0 3 403.530 4.289 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N[C@@H]1CCCOc2cc(F)ccc21 ZINC000537564802 938326673 /nfs/dbraw/zinc/32/66/73/938326673.db2.gz JKWHAWALYBKRHM-QZTJIDSGSA-N 0 3 403.523 4.237 20 0 HIADHN COC(=O)C1CCN(CCCNC(=O)c2cc(C)ccc2SC2CCCC2)CC1 ZINC000537569982 938327266 /nfs/dbraw/zinc/32/72/66/938327266.db2.gz UFUFWVKQBBCEIY-UHFFFAOYSA-N 0 3 418.603 4.035 20 0 HIADHN O=C(Nc1ccc(F)cc1)C1CCN(Cc2ccc(OC[C@@H]3CCCO3)cc2)CC1 ZINC000537614411 938333365 /nfs/dbraw/zinc/33/33/65/938333365.db2.gz GKDBEWQQPVYEKF-QHCPKHFHSA-N 0 3 412.505 4.234 20 0 HIADHN COc1cc(CN(C)CC[C@@H](C)O)cc(Br)c1OCc1ccccc1 ZINC000537623461 938337228 /nfs/dbraw/zinc/33/72/28/938337228.db2.gz FFGIMBYTCJZXOZ-OAHLLOKOSA-N 0 3 408.336 4.239 20 0 HIADHN CC(=O)Nc1ccccc1CN1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1 ZINC000537627073 938339464 /nfs/dbraw/zinc/33/94/64/938339464.db2.gz LUUCKUIJHPAYLB-UHFFFAOYSA-N 0 3 403.885 4.288 20 0 HIADHN CCN(C[C@H]1CCN(Cc2cc(OC)c(OC)cc2SC)C1)CC(F)(F)F ZINC000537647793 938345936 /nfs/dbraw/zinc/34/59/36/938345936.db2.gz IGKMDJBDCBRYLX-CQSZACIVSA-N 0 3 406.514 4.132 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(CN3CC[C@H](C(=O)OC(C)(C)C)C3)c2)cc1 ZINC000537648941 938346322 /nfs/dbraw/zinc/34/63/22/938346322.db2.gz NVUINWIGSJPUGN-IBGZPJMESA-N 0 3 410.514 4.111 20 0 HIADHN COCc1cccc(OCC2(CN(C)[C@H](C)c3ccc([S@](C)=O)cc3)CC2)c1 ZINC000537677762 938352069 /nfs/dbraw/zinc/35/20/69/938352069.db2.gz NFHBPDQONPUVRH-WRHNGFHOSA-N 0 3 401.572 4.422 20 0 HIADHN C[C@H]1CCN(Cc2cn(Cc3ccccc3)nc2-c2cccnc2)C[C@H]1n1ccnc1 ZINC000537724917 938363251 /nfs/dbraw/zinc/36/32/51/938363251.db2.gz JHFFSXVZGCVBRS-GBXCKJPGSA-N 0 3 412.541 4.273 20 0 HIADHN CCn1nc(C)c(CNc2cccc(N3CCN(CCc4ccccc4)CC3)c2)c1C ZINC000537774729 938374251 /nfs/dbraw/zinc/37/42/51/938374251.db2.gz SOTOVWNXXONNKM-UHFFFAOYSA-N 0 3 417.601 4.497 20 0 HIADHN COCc1ccc(CNc2cccc(N3CCN(CCc4ccccc4)CC3)c2)o1 ZINC000537776036 938374289 /nfs/dbraw/zinc/37/42/89/938374289.db2.gz CCHZWFXNZGRFID-UHFFFAOYSA-N 0 3 405.542 4.403 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)NCc1cc(Cl)sc1Cl ZINC000537815848 938383233 /nfs/dbraw/zinc/38/32/33/938383233.db2.gz ITKMWARHSLRRKO-UHFFFAOYSA-N 0 3 404.338 4.467 20 0 HIADHN O=C([C@H]1CC12CCN(Cc1ccc(OCc3cccnc3)cc1)CC2)N1CCCCC1 ZINC000537849630 938389751 /nfs/dbraw/zinc/38/97/51/938389751.db2.gz YMZXBONDNNKAST-XMMPIXPASA-N 0 3 419.569 4.275 20 0 HIADHN CCc1ccc([C@H](CNC(=O)Nc2cn(CC(C)C)nc2C(F)F)N(C)C)cc1 ZINC000537914026 938411197 /nfs/dbraw/zinc/41/11/97/938411197.db2.gz MUPLEDOPMQWGBF-SFHVURJKSA-N 0 3 407.509 4.464 20 0 HIADHN COc1ccc([C@@H](C)NCc2ccc(S(=O)(=O)N3CCCC3)cc2)c2ccccc12 ZINC000537919458 938413899 /nfs/dbraw/zinc/41/38/99/938413899.db2.gz YXMFIGCDKPFEOP-GOSISDBHSA-N 0 3 424.566 4.484 20 0 HIADHN C[C@@H](CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)NCc1cccc(N(C)C)n1 ZINC000537938988 938424494 /nfs/dbraw/zinc/42/44/94/938424494.db2.gz YZLPQILOZJYLNQ-LBPRGKRZSA-N 0 3 414.859 4.327 20 0 HIADHN Cc1c([C@@H](C)N[C@H](C)Cn2ncc3ccccc3c2=O)cnn1-c1cc(C)ccc1C ZINC000537941986 938426357 /nfs/dbraw/zinc/42/63/57/938426357.db2.gz KXKDPJBHNRRWJY-RTBURBONSA-N 0 3 415.541 4.247 20 0 HIADHN Cc1ccc(S(=O)(=O)NCCN[C@H](C)c2sc(-c3ccccc3)nc2C)s1 ZINC000537950555 938429591 /nfs/dbraw/zinc/42/95/91/938429591.db2.gz CHCSIVIQMHZCLH-CQSZACIVSA-N 0 3 421.613 4.118 20 0 HIADHN CCS(=O)(=O)Nc1ccc([C@H](C)NCc2csc(Br)c2)cc1 ZINC000537966413 938438051 /nfs/dbraw/zinc/43/80/51/938438051.db2.gz KGSFJIKVKCXEIE-NSHDSACASA-N 0 3 403.367 4.123 20 0 HIADHN COCCNS(=O)(=O)c1ccc(CN[C@@H](C)c2cccc(-c3ccccc3)c2)cc1 ZINC000537966514 938438072 /nfs/dbraw/zinc/43/80/72/938438072.db2.gz OTVUSEXQZBTQMH-IBGZPJMESA-N 0 3 424.566 4.129 20 0 HIADHN C[C@@H](NCCc1nc2cc(F)ccc2n1C)c1ccccc1I ZINC000537968543 938439985 /nfs/dbraw/zinc/43/99/85/938439985.db2.gz LMOVOODQESWCQO-GFCCVEGCSA-N 0 3 423.273 4.210 20 0 HIADHN CCN(Cc1ccccc1)C(=O)CN[C@H](C)CC(=O)Nc1ccccc1C(F)(F)F ZINC000537972479 938441339 /nfs/dbraw/zinc/44/13/39/938441339.db2.gz MEDBIOXRMSPPKF-MRXNPFEDSA-N 0 3 421.463 4.061 20 0 HIADHN COc1cc([C@@H](C)N[C@@H]2CC(=O)N(c3ccccc3Cl)C2)ccc1OC(F)F ZINC000537976486 938445115 /nfs/dbraw/zinc/44/51/15/938445115.db2.gz YTOMQFCHSFHBLL-TZMCWYRMSA-N 0 3 410.848 4.406 20 0 HIADHN O=C(NCCN[C@H]1CCc2c1cc(Br)cc2F)c1ccccc1Cl ZINC000537979226 938445741 /nfs/dbraw/zinc/44/57/41/938445741.db2.gz YOGYOXXUTBXGED-KRWDZBQOSA-N 0 3 411.702 4.249 20 0 HIADHN COC[C@H](N[C@H](C)CC(=O)Nc1cccc(Br)c1)c1ccc(F)cc1 ZINC000537986745 938449966 /nfs/dbraw/zinc/44/99/66/938449966.db2.gz JZBKIRHVKLPYRR-ACJLOTCBSA-N 0 3 409.299 4.283 20 0 HIADHN C[C@@H](NCc1ccc(C(=O)N2C[C@@H](C)O[C@H](C)C2)cc1)c1ccc(OC(F)F)cc1 ZINC000537990008 938451241 /nfs/dbraw/zinc/45/12/41/938451241.db2.gz FOAIGCRLYMCSSB-BRWVUGGUSA-N 0 3 418.484 4.388 20 0 HIADHN CCN1CC[C@H](NC(=O)Nc2cccc(CN(C)C)c2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000538003517 938458712 /nfs/dbraw/zinc/45/87/12/938458712.db2.gz ZQEZEQLQKROWJZ-SFTDATJTSA-N 0 3 418.944 4.498 20 0 HIADHN CN1CCC[C@H](CNC(=O)c2cnc(Oc3ccccc3)cn2)[C@@H]1c1cccs1 ZINC000538036004 938475793 /nfs/dbraw/zinc/47/57/93/938475793.db2.gz WJWXNMDYMUHWEF-IIBYNOLFSA-N 0 3 408.527 4.143 20 0 HIADHN CN1CCC[C@H](CNC(=O)c2cnc(Oc3ccccc3)cn2)[C@H]1c1cccs1 ZINC000538036003 938475820 /nfs/dbraw/zinc/47/58/20/938475820.db2.gz WJWXNMDYMUHWEF-IERDGZPVSA-N 0 3 408.527 4.143 20 0 HIADHN CN(C)CCN(C[C@H]1CCCO1)C(=O)Nc1ccc(Br)c2ccccc12 ZINC000538051087 938483786 /nfs/dbraw/zinc/48/37/86/938483786.db2.gz BTPWVKLNYDKGPJ-OAHLLOKOSA-N 0 3 420.351 4.177 20 0 HIADHN COc1cc(CN[C@@H](c2ccc(Br)cc2)C2CC2)ccc1OCCO ZINC000538058399 938489560 /nfs/dbraw/zinc/48/95/60/938489560.db2.gz APXFYJCAARPUBO-HXUWFJFHSA-N 0 3 406.320 4.070 20 0 HIADHN COc1ccccc1[C@H](NCc1ccc(C(=O)N2CCOCC2)cc1)C1CCCC1 ZINC000538101171 938502592 /nfs/dbraw/zinc/50/25/92/938502592.db2.gz QXUMLLXGDYGGMR-XMMPIXPASA-N 0 3 408.542 4.189 20 0 HIADHN C[C@H](NC[C@H](c1cccc(F)c1)N1CCOCC1)c1nc2ccc(Cl)cc2n1C ZINC000538101626 938502943 /nfs/dbraw/zinc/50/29/43/938502943.db2.gz YUTKXSXNIGNNSH-YCRPNKLZSA-N 0 3 416.928 4.090 20 0 HIADHN CC[C@@H](N[C@@H](C)C(=O)N(C)Cc1ccc(OC)c(OC)c1)c1cccc(Cl)c1 ZINC000538125110 938511365 /nfs/dbraw/zinc/51/13/65/938511365.db2.gz LZYXTQNUZLHKIK-HNAYVOBHSA-N 0 3 404.938 4.445 20 0 HIADHN CC[C@H](NCCO[C@H]1CCCC[C@@H]1C)c1ccccc1OCC(=O)N1CCCC1 ZINC000538149784 938522079 /nfs/dbraw/zinc/52/20/79/938522079.db2.gz DMOGMNVVZZNQSU-BVSLBCMMSA-N 0 3 402.579 4.324 20 0 HIADHN COc1ccc(C[C@@H](NCC(=O)NCc2sccc2C)c2ccccc2)cc1OC ZINC000538151066 938523328 /nfs/dbraw/zinc/52/33/28/938523328.db2.gz IQPHDTNNNMZJSK-HXUWFJFHSA-N 0 3 424.566 4.264 20 0 HIADHN COc1cc([C@@H](C)NCC[S@@](=O)c2ccccc2)ccc1OCc1ccncc1 ZINC000538154271 938525509 /nfs/dbraw/zinc/52/55/09/938525509.db2.gz BKSCPIPEYCAFIF-LDLUVENISA-N 0 3 410.539 4.128 20 0 HIADHN COc1ccc(C[C@@H](NCC(=O)N[C@H](C)c2ccccc2)c2ccccc2)cc1OC ZINC000538159511 938529529 /nfs/dbraw/zinc/52/95/29/938529529.db2.gz IFYBSYDYNYXLSP-AUSIDOKSSA-N 0 3 418.537 4.455 20 0 HIADHN CCC(CC)[C@@H](NCC(=O)Nc1ccc(CN2CCOCC2)cc1)c1cccs1 ZINC000538177127 938538019 /nfs/dbraw/zinc/53/80/19/938538019.db2.gz QKAMJJUPRJLGSS-HSZRJFAPSA-N 0 3 415.603 4.286 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)N[C@H]1CCCC[C@@H]1C)c1ccc(NC(=O)c2ccncc2)cc1 ZINC000538191694 938547088 /nfs/dbraw/zinc/54/70/88/938547088.db2.gz WNUMVLLZVSSRKC-SUWCGCSTSA-N 0 3 408.546 4.068 20 0 HIADHN COc1cc(C(C)=O)ccc1OC[C@@H](O)CN[C@@H](c1ccc(F)cc1F)C(C)(C)C ZINC000538224198 938564318 /nfs/dbraw/zinc/56/43/18/938564318.db2.gz PSUKGGDGJRLAEQ-JTSKRJEESA-N 0 3 421.484 4.293 20 0 HIADHN CC(C)(C)[C@@H](NCC(=O)NCC1(c2ccccc2)CCOCC1)c1cccc(F)c1 ZINC000538232287 938566832 /nfs/dbraw/zinc/56/68/32/938566832.db2.gz YCXBIGLAEHUQDU-QHCPKHFHSA-N 0 3 412.549 4.367 20 0 HIADHN C[C@@H](NC(=O)[C@H](C)N[C@H](C)c1ccc(-n2ccnn2)cc1)c1ccc2ccccc2c1 ZINC000538234386 938567661 /nfs/dbraw/zinc/56/76/61/938567661.db2.gz LSSCYGSQGTUEFS-QRVBRYPASA-N 0 3 413.525 4.337 20 0 HIADHN Cc1ccc(NC(=O)CN[C@@H](C[C@H]2CCOC2)c2ccccc2)c(Br)c1 ZINC000538234608 938568651 /nfs/dbraw/zinc/56/86/51/938568651.db2.gz UBPMZUCIGJEGHX-UZLBHIALSA-N 0 3 417.347 4.454 20 0 HIADHN CC1CCN([C@H](CNC(=O)c2cnn(C)c2-c2ccccc2)c2cccs2)CC1 ZINC000538250904 938574136 /nfs/dbraw/zinc/57/41/36/938574136.db2.gz YIVBKPRDNSXFPT-HXUWFJFHSA-N 0 3 408.571 4.352 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)NCC(=O)Nc2nc3ccc(F)cc3s2)cc1 ZINC000538268032 938579575 /nfs/dbraw/zinc/57/95/75/938579575.db2.gz ACSVNLKAAGDAIQ-CYBMUJFWSA-N 0 3 409.490 4.219 20 0 HIADHN C[C@@H](N[C@H](C)c1cccc(N2CCCC2)c1)C(=O)Nc1cccc(N2CCCC2=O)c1 ZINC000538277414 938581624 /nfs/dbraw/zinc/58/16/24/938581624.db2.gz TXKYXCCNBGPFNL-RTBURBONSA-N 0 3 420.557 4.091 20 0 HIADHN C[C@@H](N[C@@H](C)c1cccc(N2CCCC2)c1)C(=O)Nc1ccc2c(c1)OCCCO2 ZINC000538279144 938582167 /nfs/dbraw/zinc/58/21/67/938582167.db2.gz KBUYTQHGJCSRDQ-ZWKOTPCHSA-N 0 3 409.530 4.126 20 0 HIADHN C[C@@H](NCC(=O)NCc1ccc(OC(F)(F)F)cc1)c1cccc(N2CCCC2)c1 ZINC000538277980 938582238 /nfs/dbraw/zinc/58/22/38/938582238.db2.gz WQUYOMFPJUQKLZ-MRXNPFEDSA-N 0 3 421.463 4.152 20 0 HIADHN Cc1cc(NC(=O)CN[C@@H](C)c2cccc(N3CCCC3)c2)n(-c2ccc(F)cc2)n1 ZINC000538280813 938582497 /nfs/dbraw/zinc/58/24/97/938582497.db2.gz YYKONUCDVYBTGY-SFHVURJKSA-N 0 3 421.520 4.209 20 0 HIADHN CCC[C@@H]1CN(Cc2csc(N(CC)C(C)=O)n2)CCN1Cc1ccccc1 ZINC000538300760 938587170 /nfs/dbraw/zinc/58/71/70/938587170.db2.gz UYURIZNQMDHTAR-OAQYLSRUSA-N 0 3 400.592 4.002 20 0 HIADHN C[C@H](NC(=O)CN[C@@H](c1ccc2c(c1)OCCO2)C1CC1)c1ccc(Cl)cc1 ZINC000538391875 938609472 /nfs/dbraw/zinc/60/94/72/938609472.db2.gz ZXIOERIQPFXSTC-RCDICMHDSA-N 0 3 400.906 4.029 20 0 HIADHN C[C@@H](NC(=O)CN[C@H](c1ccc2c(c1)OCCO2)C1CC1)c1ccc(Cl)cc1 ZINC000538391874 938609649 /nfs/dbraw/zinc/60/96/49/938609649.db2.gz ZXIOERIQPFXSTC-PEBXRYMYSA-N 0 3 400.906 4.029 20 0 HIADHN Cc1cc(C(=O)NC2CCN(Cc3ccccc3)CC2)nn1-c1ccccc1Cl ZINC000538449802 938625447 /nfs/dbraw/zinc/62/54/47/938625447.db2.gz NNUQOEFGALJOND-UHFFFAOYSA-N 0 3 408.933 4.229 20 0 HIADHN CN(C)Cc1cccc(NC(=O)C(=O)N[C@H]2C[C@@H]3CCC(C)(C)c4cccc2c43)c1 ZINC000538483233 938632210 /nfs/dbraw/zinc/63/22/10/938632210.db2.gz DYRQLKBRTNGAJD-UWJYYQICSA-N 0 3 405.542 4.103 20 0 HIADHN Cc1cc(C(=O)Nc2ccc(CCN3CCSCC3)cc2)nn1-c1ccc(F)cc1 ZINC000538533486 938643346 /nfs/dbraw/zinc/64/33/46/938643346.db2.gz KCEJDCRSOJOIPK-UHFFFAOYSA-N 0 3 424.545 4.163 20 0 HIADHN CC[C@H](C)Oc1cc(CNC(=O)N(Cc2ccccc2)C2CCN(C)CC2)ccn1 ZINC000538646988 938672315 /nfs/dbraw/zinc/67/23/15/938672315.db2.gz KVXVXNFOQFQXTG-IBGZPJMESA-N 0 3 410.562 4.065 20 0 HIADHN NC(=O)[C@H](N[C@H]1CC=C(c2ccc(F)cc2)CC1)c1cccc(Br)c1 ZINC000538655171 938674835 /nfs/dbraw/zinc/67/48/35/938674835.db2.gz OMWZQUTUWLWSJB-RBUKOAKNSA-N 0 3 403.295 4.340 20 0 HIADHN O[C@H](COc1ccccc1Cl)CN1CCC[C@H](c2nnc(C3CCCCC3)[nH]2)C1 ZINC000538665478 938679401 /nfs/dbraw/zinc/67/94/01/938679401.db2.gz GYPPZLQOHQXGOG-ROUUACIJSA-N 0 3 418.969 4.125 20 0 HIADHN COc1ccc(OC)c([C@H]2CCCN2C(=O)CN[C@@]2(C)CCCc3ccccc32)c1 ZINC000538707212 938687224 /nfs/dbraw/zinc/68/72/24/938687224.db2.gz AQOQRQICHZFCAQ-RDGATRHJSA-N 0 3 408.542 4.209 20 0 HIADHN C[C@@]1(C2CCN(Cc3ccc(-c4ccc(Cl)c(Cl)c4)o3)CC2)NC(=O)NC1=O ZINC000538725077 938692782 /nfs/dbraw/zinc/69/27/82/938692782.db2.gz TVTBSOIVAQHJNV-FQEVSTJZSA-N 0 3 422.312 4.064 20 0 HIADHN COc1cccc(NC2CCN(Cc3ccc(OCc4noc(C)n4)cc3)CC2)c1 ZINC000538730662 938695143 /nfs/dbraw/zinc/69/51/43/938695143.db2.gz DLRNOHPXHGOYIY-UHFFFAOYSA-N 0 3 408.502 4.042 20 0 HIADHN COCCOC1CCN(Cc2cnc(-c3ccc(Br)cc3)s2)CC1 ZINC000538730788 938695285 /nfs/dbraw/zinc/69/52/85/938695285.db2.gz OZACJHITVVBLFY-UHFFFAOYSA-N 0 3 411.365 4.200 20 0 HIADHN O=C1CCCN1[C@@H]1CCCN(Cc2cn(Cc3ccccc3)nc2-c2ccccc2)C1 ZINC000538733290 938695777 /nfs/dbraw/zinc/69/57/77/938695777.db2.gz FLSLRFVGELNFSP-XMMPIXPASA-N 0 3 414.553 4.185 20 0 HIADHN COc1cc(CN2CCC[C@@]3(CNC(=O)C3)C2)ccc1OCc1ccc(Cl)cc1 ZINC000538738421 938697602 /nfs/dbraw/zinc/69/76/02/938697602.db2.gz UUMYXDABMMFIHS-HSZRJFAPSA-N 0 3 414.933 4.030 20 0 HIADHN CCCN(CC(F)(F)F)C(=O)[C@H]1CCCN(Cc2cnc(N(CC)CC)s2)C1 ZINC000538750845 938701214 /nfs/dbraw/zinc/70/12/14/938701214.db2.gz BTELGSZINDIBSC-HNNXBMFYSA-N 0 3 420.545 4.002 20 0 HIADHN COc1cc(CN(C)CCc2nccs2)cc(Br)c1OC(F)F ZINC000538763352 938704722 /nfs/dbraw/zinc/70/47/22/938704722.db2.gz YREUJQGQJRKDFD-UHFFFAOYSA-N 0 3 407.280 4.190 20 0 HIADHN CCOCCO[C@H]1CCN(Cc2cccc(NC(=O)c3ccccc3Cl)c2)C1 ZINC000538800131 938715706 /nfs/dbraw/zinc/71/57/06/938715706.db2.gz QODUCYNCRYHLCP-IBGZPJMESA-N 0 3 402.922 4.220 20 0 HIADHN CCN(CC)[C@@H](C(=O)Nc1cc(CN(C)C)ccn1)c1cccc(C(F)(F)F)c1 ZINC000538822651 938720411 /nfs/dbraw/zinc/72/04/11/938720411.db2.gz XWQPFXDYUUKBKY-LJQANCHMSA-N 0 3 408.468 4.184 20 0 HIADHN CCCOCc1ccccc1CNCc1c(Cl)cccc1N1CCN(C)CC1 ZINC000538851457 938725091 /nfs/dbraw/zinc/72/50/91/938725091.db2.gz NJQIJOHRYYZWLS-UHFFFAOYSA-N 0 3 401.982 4.308 20 0 HIADHN C[C@H](CC(=O)N(C)C1CCN(CCc2ccccn2)CC1)Cc1ccc(Cl)cc1 ZINC000538959022 938750351 /nfs/dbraw/zinc/75/03/51/938750351.db2.gz MSRKUHCPAVNLCH-IBGZPJMESA-N 0 3 413.993 4.469 20 0 HIADHN CC[C@@H](NCc1ccc(CS(=O)(=O)NC(C)C)cc1)c1cc(C)ccc1OC ZINC000538987005 938760689 /nfs/dbraw/zinc/76/06/89/938760689.db2.gz NFMCVEWURFNEEK-OAQYLSRUSA-N 0 3 404.576 4.072 20 0 HIADHN CSc1ccc([C@H](C)NCc2ccc(S(=O)(=O)N3CCCCC3)cc2)cc1 ZINC000539019051 938770420 /nfs/dbraw/zinc/77/04/20/938770420.db2.gz SFUQDVOCRFDOSG-KRWDZBQOSA-N 0 3 404.601 4.434 20 0 HIADHN CC(C)COc1ccc([C@@H](C)NCc2ccc(S(=O)(=O)N3CCCC3)cc2)cc1 ZINC000539021456 938771565 /nfs/dbraw/zinc/77/15/65/938771565.db2.gz ZALCKXOFTCFQCR-LJQANCHMSA-N 0 3 416.587 4.357 20 0 HIADHN COc1ccc(COCCN[C@H](C)c2ccc(S(=O)(=O)C3CCCC3)cc2)cc1 ZINC000539037004 938776612 /nfs/dbraw/zinc/77/66/12/938776612.db2.gz OHKMXGKJXWJERX-GOSISDBHSA-N 0 3 417.571 4.279 20 0 HIADHN C[C@@H](NCc1cccc(NC(=O)c2ccccc2)c1)c1ccc(NS(C)(=O)=O)cc1 ZINC000539039850 938778042 /nfs/dbraw/zinc/77/80/42/938778042.db2.gz FQHPZNKSNNULRA-QGZVFWFLSA-N 0 3 423.538 4.161 20 0 HIADHN C[C@@H](NCc1ccccc1-n1cccn1)c1ccc(S(=O)(=O)C2CCCC2)cc1 ZINC000539042493 938778996 /nfs/dbraw/zinc/77/89/96/938778996.db2.gz BWNPJUDCRBVRQN-GOSISDBHSA-N 0 3 409.555 4.439 20 0 HIADHN C[C@H](Cn1ncc2ccccc2c1=O)N[C@@H](C)c1ccc(F)c(Br)c1 ZINC000539044230 938780033 /nfs/dbraw/zinc/78/00/33/938780033.db2.gz VVRVXEOCMBWXHN-OLZOCXBDSA-N 0 3 404.283 4.037 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(S(=O)(=O)C2CCCC2)cc1)c1ccc(-n2ccnn2)cc1 ZINC000539043755 938780140 /nfs/dbraw/zinc/78/01/40/938780140.db2.gz QIXWOCZQQXSQOH-ROUUACIJSA-N 0 3 424.570 4.395 20 0 HIADHN CCc1ccccc1NC(=O)C[C@H](C)N[C@H]1CC(=O)N(C)[C@@H]1c1ccc(Cl)cc1 ZINC000539049570 938782602 /nfs/dbraw/zinc/78/26/02/938782602.db2.gz UVEYCTGQNOBBMZ-RWAHWCJQSA-N 0 3 413.949 4.181 20 0 HIADHN C[C@H](NCCN(C)S(=O)(=O)c1cccs1)c1ccc(SCC(F)F)cc1 ZINC000539051230 938783479 /nfs/dbraw/zinc/78/34/79/938783479.db2.gz BJROZYDAJFFIJS-ZDUSSCGKSA-N 0 3 420.572 4.077 20 0 HIADHN CC1CCN(S(=O)(=O)Cc2ccccc2CN[C@H]2CCCc3sccc32)CC1 ZINC000539052644 938783897 /nfs/dbraw/zinc/78/38/97/938783897.db2.gz KCAADYYDFFWYCX-NRFANRHFSA-N 0 3 418.628 4.477 20 0 HIADHN Cc1nc(-c2ccccc2F)sc1[C@@H](C)N[C@@H]1CCCN(CC(F)(F)F)C1=O ZINC000539053522 938784670 /nfs/dbraw/zinc/78/46/70/938784670.db2.gz XSZPOGZSMBIHQH-IAQYHMDHSA-N 0 3 415.456 4.462 20 0 HIADHN C[C@H](NC[C@@H](CO)Cc1ccc(OC(F)(F)F)cc1)c1nc2c(s1)CCCC2 ZINC000539059641 938786966 /nfs/dbraw/zinc/78/69/66/938786966.db2.gz CWJPYPURLZKYQY-ZFWWWQNUSA-N 0 3 414.493 4.422 20 0 HIADHN C[C@H](N[C@@H](COc1ccccc1F)c1ccccc1)c1ccc(-n2cnnn2)cc1 ZINC000539066964 938791292 /nfs/dbraw/zinc/79/12/92/938791292.db2.gz MTFULJYVNMPWQR-JTSKRJEESA-N 0 3 403.461 4.272 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc(CN[C@@H](C)c2cccc(OC(F)F)c2)cc1 ZINC000539069407 938792076 /nfs/dbraw/zinc/79/20/76/938792076.db2.gz BAZFHYGHOVASCG-HNNXBMFYSA-N 0 3 412.502 4.169 20 0 HIADHN COCCSc1ccc([C@H](C)N[C@H](C)c2ccc(S(=O)(=O)N(C)C)cc2)cc1 ZINC000539076570 938796299 /nfs/dbraw/zinc/79/62/99/938796299.db2.gz GXPWEPDMCIBHCU-DLBZAZTESA-N 0 3 422.616 4.087 20 0 HIADHN Cc1nc(-c2ccccc2)sc1[C@H](C)NCc1ccc(NS(C)(=O)=O)cc1 ZINC000539089410 938800456 /nfs/dbraw/zinc/80/04/56/938800456.db2.gz CFPUDBZCDZUSLL-AWEZNQCLSA-N 0 3 401.557 4.341 20 0 HIADHN CC(C)C[C@H](N[C@H](C)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1cccs1 ZINC000539091252 938801003 /nfs/dbraw/zinc/80/10/03/938801003.db2.gz HQCVKLWNOMXEMA-XLIONFOSSA-N 0 3 422.616 4.207 20 0 HIADHN C[C@H](NCc1ccc(C(=O)N2CCCCC2)cc1)c1ccc(NC(=O)NC2CC2)cc1 ZINC000539092471 938801673 /nfs/dbraw/zinc/80/16/73/938801673.db2.gz BELGUXVDBQIBRL-SFHVURJKSA-N 0 3 420.557 4.447 20 0 HIADHN COCC[C@@H]([NH2+]Cc1nnc(-c2ccc(Br)cc2)[n-]1)c1ccc(F)cc1 ZINC000539119821 938805727 /nfs/dbraw/zinc/80/57/27/938805727.db2.gz FZOLATRJLQKZSQ-QGZVFWFLSA-N 0 3 419.298 4.241 20 0 HIADHN CCN1CC[C@H](NC(=O)c2cccc(CN(C)C)c2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000539128258 938807708 /nfs/dbraw/zinc/80/77/08/938807708.db2.gz QMBAIBWYYYCRJB-LEWJYISDSA-N 0 3 403.929 4.106 20 0 HIADHN COCCOc1c(Cl)cc(NC(=O)[C@@H]2CCCN2C2CCCC2)cc1Cl ZINC000539138565 938809660 /nfs/dbraw/zinc/80/96/60/938809660.db2.gz BKESZKZMHNYWKV-KRWDZBQOSA-N 0 3 401.334 4.364 20 0 HIADHN COc1cc(CN[C@H](c2ccc(Cl)c(Cl)c2)C2CC2)ccc1OCC(N)=O ZINC000539217718 938820064 /nfs/dbraw/zinc/82/00/64/938820064.db2.gz ZZHNGGUWAFZUEM-FQEVSTJZSA-N 0 3 409.313 4.107 20 0 HIADHN COc1ccccc1CNC(=O)[C@H](C)N[C@H](C)c1ccc(OCc2cccnc2)cc1 ZINC000539225231 938821453 /nfs/dbraw/zinc/82/14/53/938821453.db2.gz GUZSETJUVUNYSG-MOPGFXCFSA-N 0 3 419.525 4.025 20 0 HIADHN Cc1cccc(OC[C@@H](O)CN[C@H](C)c2cccc(NC(=O)c3ccccc3)c2)c1 ZINC000539232688 938822585 /nfs/dbraw/zinc/82/25/85/938822585.db2.gz CNHTZBWKEFCHNS-XXBNENTESA-N 0 3 404.510 4.338 20 0 HIADHN Cc1cccc(OC[C@H](O)CN[C@@H](C)c2cccc(NC(=O)c3ccccc3)c2)c1 ZINC000539232687 938822811 /nfs/dbraw/zinc/82/28/11/938822811.db2.gz CNHTZBWKEFCHNS-WMZHIEFXSA-N 0 3 404.510 4.338 20 0 HIADHN CC[C@H](NCC(=O)N1CCC[C@@H]1c1ccc(OC)cc1OC)c1ccc(OC)cc1 ZINC000539241149 938824020 /nfs/dbraw/zinc/82/40/20/938824020.db2.gz AMXJEMOHZIBALD-FCHUYYIVSA-N 0 3 412.530 4.117 20 0 HIADHN COc1cc([C@@H](C)N[C@H]2CCCN(CC(F)(F)F)C2=O)ccc1OC1CCCC1 ZINC000539253920 938827050 /nfs/dbraw/zinc/82/70/50/938827050.db2.gz JCSPZHBOXMJILE-PBHICJAKSA-N 0 3 414.468 4.221 20 0 HIADHN CCC[C@@H](NCC(=O)Nc1cccc(C(=O)N(C)C)c1)c1cccc(C(F)(F)F)c1 ZINC000539261074 938829263 /nfs/dbraw/zinc/82/92/63/938829263.db2.gz XWXOUZSNYSAVHA-LJQANCHMSA-N 0 3 421.463 4.477 20 0 HIADHN C[C@H](c1cc2ccccc2o1)N(C)C(=O)CN[C@@H](C)c1cccc(-n2cccn2)c1 ZINC000539286553 938833792 /nfs/dbraw/zinc/83/37/92/938833792.db2.gz LZLSVGSYALOEAR-ZWKOTPCHSA-N 0 3 402.498 4.489 20 0 HIADHN CCOc1ccccc1[C@H](CC)NC(=O)CN[C@@H](C)c1cccc(-n2cccn2)c1 ZINC000539290350 938834379 /nfs/dbraw/zinc/83/43/79/938834379.db2.gz YEZRNJJJRPCPPZ-AVRDEDQJSA-N 0 3 406.530 4.189 20 0 HIADHN COCCOc1ccc(C(F)(F)F)cc1NC(=O)[C@@H](C)N[C@@H](C)c1ccccc1 ZINC000539303785 938837308 /nfs/dbraw/zinc/83/73/08/938837308.db2.gz LPZXYYOTKYENOP-LSDHHAIUSA-N 0 3 410.436 4.408 20 0 HIADHN COC[C@@H](NCc1ccc(CN2C[C@@H](C)O[C@@H](C)C2)cc1)c1ccc(F)c(F)c1 ZINC000539307818 938838286 /nfs/dbraw/zinc/83/82/86/938838286.db2.gz ALBJNBCGODYWGQ-SAHWJRBASA-N 0 3 404.501 4.051 20 0 HIADHN CC[C@H](NCCc1ccc(OCC(=O)Nc2ccc(C)cc2)cc1)c1nccn1C ZINC000539315004 938839776 /nfs/dbraw/zinc/83/97/76/938839776.db2.gz RYEOMXSWYJDXOL-QFIPXVFZSA-N 0 3 406.530 4.029 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)Nc3c(F)cc(Cl)cc3F)CC2)C[C@H](C)O1 ZINC000539320479 938840734 /nfs/dbraw/zinc/84/07/34/938840734.db2.gz LHCAZUBACJRFGL-KBPBESRZSA-N 0 3 415.912 4.361 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3c(F)cc(Cl)cc3F)CC2)C[C@@H](C)O1 ZINC000539320481 938840893 /nfs/dbraw/zinc/84/08/93/938840893.db2.gz LHCAZUBACJRFGL-ZIAGYGMSSA-N 0 3 415.912 4.361 20 0 HIADHN COc1cccc(CN(C)C(=O)CN[C@H](c2cccc(F)c2)C2CCCC2)c1OC ZINC000539323590 938841331 /nfs/dbraw/zinc/84/13/31/938841331.db2.gz JGGDXPVSRSRCRI-QHCPKHFHSA-N 0 3 414.521 4.322 20 0 HIADHN Cc1cc(NC(=O)CN[C@H](C[C@@H]2CCOC2)c2ccccc2)ccc1Br ZINC000539324107 938841413 /nfs/dbraw/zinc/84/14/13/938841413.db2.gz CJRWAESSSIDUKP-OXJNMPFZSA-N 0 3 417.347 4.454 20 0 HIADHN O=C(CN[C@H](C[C@H]1CCOC1)c1ccccc1)N[C@H](c1nccs1)c1ccccc1 ZINC000539335359 938843814 /nfs/dbraw/zinc/84/38/14/938843814.db2.gz AZRMPEBXZQWWOK-AAIMPIBUSA-N 0 3 421.566 4.106 20 0 HIADHN C[C@@H](NCC(=O)N1CCO[C@H](c2ccc(F)cc2)C1)c1ccc(-c2ccncc2)cc1 ZINC000539336323 938844098 /nfs/dbraw/zinc/84/40/98/938844098.db2.gz HJGOQQLADOHREX-KOSHJBKYSA-N 0 3 419.500 4.138 20 0 HIADHN COc1ccc(NC(=O)[C@H](C)N[C@H](C)c2ccc(-c3ccncc3)cc2)c(OC)c1 ZINC000539338431 938844702 /nfs/dbraw/zinc/84/47/02/938844702.db2.gz QKGPSFMVVYTJAK-SJORKVTESA-N 0 3 405.498 4.444 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)N[C@H](C)C(=O)NC23CC4CC(CC(C4)C2)C3)cc1 ZINC000539363200 938848725 /nfs/dbraw/zinc/84/87/25/938848725.db2.gz QXNHYMJBNLANDI-JFDUVJTASA-N 0 3 406.574 4.305 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)c3ccc(C(F)(F)F)cc3Cl)CC2)C[C@H](C)O1 ZINC000539372879 938850702 /nfs/dbraw/zinc/85/07/02/938850702.db2.gz FNYZOLIWTLPAMN-OKILXGFUSA-N 0 3 418.887 4.320 20 0 HIADHN COc1ccc([C@@H](NC(=O)CN[C@H](C)c2cccc(N3CCCC3)c2)C(C)C)cc1 ZINC000539379244 938851771 /nfs/dbraw/zinc/85/17/71/938851771.db2.gz SSIJKTZZRXWIBG-CLOONOSVSA-N 0 3 409.574 4.460 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)N[C@@H]2CCCOc3c(Cl)cccc32)CC1 ZINC000539470233 938865174 /nfs/dbraw/zinc/86/51/74/938865174.db2.gz KFELASXUJFSFPR-HXUWFJFHSA-N 0 3 417.937 4.453 20 0 HIADHN CNC(=O)Cc1nc(CN[C@H](Cc2ccc(Cl)cc2)C2CCCCC2)cs1 ZINC000539490755 938867592 /nfs/dbraw/zinc/86/75/92/938867592.db2.gz FGEXUQDAXWYYLK-LJQANCHMSA-N 0 3 405.995 4.366 20 0 HIADHN C[C@H](N[C@@H](c1ccc2c(c1)OCCO2)C1CC1)C(=O)Nc1ccc(F)cc1Cl ZINC000539492051 938867825 /nfs/dbraw/zinc/86/78/25/938867825.db2.gz XLGROWMQFJGHCK-FKIZINRSSA-N 0 3 404.869 4.318 20 0 HIADHN CC[C@@H](NCc1ccc(OCCO)c(OC)c1)c1cc(F)cc(Br)c1 ZINC000539498233 938868861 /nfs/dbraw/zinc/86/88/61/938868861.db2.gz AGBFPXZRFJUFRH-QGZVFWFLSA-N 0 3 412.299 4.209 20 0 HIADHN CC[C@H](NCc1ccc(CS(C)(=O)=O)cc1)c1cc(F)cc(Br)c1 ZINC000539499410 938869164 /nfs/dbraw/zinc/86/91/64/938869164.db2.gz GKILHIXWIUNSFF-SFHVURJKSA-N 0 3 414.340 4.374 20 0 HIADHN COc1ccc(Br)c(CNC2CCN(C(=O)NC3CCCCC3)CC2)c1 ZINC000539500404 938869532 /nfs/dbraw/zinc/86/95/32/938869532.db2.gz HMXSXNJGEJRSEV-UHFFFAOYSA-N 0 3 424.383 4.054 20 0 HIADHN CCc1cc(N2CCC[C@H](N[C@@H](C)c3ccc(OC)cc3Br)C2)ncn1 ZINC000539509062 938870931 /nfs/dbraw/zinc/87/09/31/938870931.db2.gz SLQVJLREVCOYLD-HOCLYGCPSA-N 0 3 419.367 4.130 20 0 HIADHN Fc1ccc(Br)c2c1CC[C@@H]2NCCc1csc(N2CCCC2)n1 ZINC000539602740 938886712 /nfs/dbraw/zinc/88/67/12/938886712.db2.gz QTAWGDPEIDQILY-INIZCTEOSA-N 0 3 410.356 4.465 20 0 HIADHN CCN1CCN(Cc2ccc(N[C@H](C)c3cccc(N4CCCC4=O)c3)cc2)CC1 ZINC000539635116 938891480 /nfs/dbraw/zinc/89/14/80/938891480.db2.gz SDHQPOMMWHTJGO-HXUWFJFHSA-N 0 3 406.574 4.124 20 0 HIADHN CC(C)C[C@@H]1C[C@@H](NC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)CCO1 ZINC000539664293 938896886 /nfs/dbraw/zinc/89/68/86/938896886.db2.gz GQFKLRMBPWKLDH-QKNQBKEWSA-N 0 3 412.496 4.151 20 0 HIADHN Cc1cc(C(=O)N2CCCN(C(C)(C)C)CC2)nn1-c1ccc(Cl)c(Cl)c1 ZINC000539683166 938900684 /nfs/dbraw/zinc/90/06/84/938900684.db2.gz HUOXHVCFEGSTTQ-UHFFFAOYSA-N 0 3 409.361 4.434 20 0 HIADHN COc1ccc([C@H](C)Nc2cccc([C@H]3CNC(=O)C3)c2)cc1CN1CCCCC1 ZINC000539736672 938917289 /nfs/dbraw/zinc/91/72/89/938917289.db2.gz AUNXUOLQUPHUFR-GHTZIAJQSA-N 0 3 407.558 4.458 20 0 HIADHN NC(=O)[C@H](N[C@@H]1CC=C(c2ccc(F)cc2)CC1)c1ccc(Br)cc1 ZINC000539754174 938922195 /nfs/dbraw/zinc/92/21/95/938922195.db2.gz JNWFXGKYVJQYFU-RTBURBONSA-N 0 3 403.295 4.340 20 0 HIADHN COCCC[C@@H](C)C(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1 ZINC000539798315 938937249 /nfs/dbraw/zinc/93/72/49/938937249.db2.gz CVVCRIZQCCQAHA-OAQYLSRUSA-N 0 3 409.574 4.053 20 0 HIADHN O=C(C1CCN(Cc2cnc(-c3ccccc3)[nH]2)CC1)N(Cc1ccccc1)C1CC1 ZINC000539837931 938953631 /nfs/dbraw/zinc/95/36/31/938953631.db2.gz DFPIOPSRXUCYGZ-UHFFFAOYSA-N 0 3 414.553 4.480 20 0 HIADHN CCN(CC(F)(F)F)C(=O)[C@@H]1CCCN(Cc2cccc(OC)c2OC(C)C)C1 ZINC000539850274 938956914 /nfs/dbraw/zinc/95/69/14/938956914.db2.gz DOECELZJAAINJK-QGZVFWFLSA-N 0 3 416.484 4.105 20 0 HIADHN COc1cc(N[C@@H]2CCCN(Cc3ccc(OC)c(OC(F)F)c3)C2)cc(OC)c1 ZINC000539849755 938956950 /nfs/dbraw/zinc/95/69/50/938956950.db2.gz KZBIZGKWGRUILB-MRXNPFEDSA-N 0 3 422.472 4.390 20 0 HIADHN CCCN(CC(F)(F)F)C(=O)[C@@H]1CCCN(Cc2cnc(CC(C)C)s2)C1 ZINC000539850025 938956968 /nfs/dbraw/zinc/95/69/68/938956968.db2.gz AAHSCFOOAOTIHG-OAHLLOKOSA-N 0 3 405.530 4.355 20 0 HIADHN CC[C@H](C)[C@H](NCc1cccc2nccn21)C(=O)Nc1cccc(N2CCCC2)c1 ZINC000539853396 938958433 /nfs/dbraw/zinc/95/84/33/938958433.db2.gz BQUBZUAHUJQLQU-MBSDFSHPSA-N 0 3 405.546 4.078 20 0 HIADHN COc1ccc(CN(CC(=O)N(C)Cc2ccco2)C2CCCCC2)cc1OC ZINC000539887358 938966070 /nfs/dbraw/zinc/96/60/70/938966070.db2.gz UIHZPLXNRWIGDC-UHFFFAOYSA-N 0 3 400.519 4.090 20 0 HIADHN CO[C@H](C)c1noc(CN2CCCN(Cc3ccc(-c4ccccc4)s3)CC2)n1 ZINC000539892210 938968380 /nfs/dbraw/zinc/96/83/80/938968380.db2.gz BSHOXGNKBKNGEX-QGZVFWFLSA-N 0 3 412.559 4.213 20 0 HIADHN CC[C@H]1CN(Cc2ccc(OCCOc3ccccc3Cl)c(OC)c2)C[C@@H]1O ZINC000539897648 938971331 /nfs/dbraw/zinc/97/13/31/938971331.db2.gz UVASEBNFLSTWGQ-HKUYNNGSSA-N 0 3 405.922 4.009 20 0 HIADHN C[C@H]1C[C@H](NC(=O)N(CCN2CCCC2)Cc2ccc(Cl)c(Cl)c2)CCO1 ZINC000539903770 938974646 /nfs/dbraw/zinc/97/46/46/938974646.db2.gz JQRAQZHMXNDYKP-DOTOQJQBSA-N 0 3 414.377 4.168 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)N(CCN2CCCC2)Cc2ccc(Cl)c(Cl)c2)CCO1 ZINC000539903775 938974985 /nfs/dbraw/zinc/97/49/85/938974985.db2.gz JQRAQZHMXNDYKP-RDJZCZTQSA-N 0 3 414.377 4.168 20 0 HIADHN COCC(=O)Nc1cccc(CN[C@H]2CCCc3ccc(Br)cc32)c1 ZINC000539967491 938982358 /nfs/dbraw/zinc/98/23/58/938982358.db2.gz SMRLOIMCDTZDBS-IBGZPJMESA-N 0 3 403.320 4.201 20 0 HIADHN COCCc1nc(C)c([C@@H](C)NC[C@H](O)COc2cccc(Cl)c2Cl)s1 ZINC000539968386 938982372 /nfs/dbraw/zinc/98/23/72/938982372.db2.gz SPKTZRSTJIRAPP-YPMHNXCESA-N 0 3 419.374 4.038 20 0 HIADHN COc1cc(OC)cc(N2CC[C@H](CN[C@H](C)c3nc4c(s3)CCCC4)C2)c1 ZINC000540084386 939064204 /nfs/dbraw/zinc/06/42/04/939064204.db2.gz BKWSTRHQKVSOQV-HZPDHXFCSA-N 0 3 401.576 4.216 20 0 HIADHN COc1cc(CN[C@H](C)c2ccc(-c3ccncc3)cc2)ccc1OCC(=O)N(C)C ZINC000540119277 939079945 /nfs/dbraw/zinc/07/99/45/939079945.db2.gz PJISCFOKEIRPGJ-GOSISDBHSA-N 0 3 419.525 4.075 20 0 HIADHN COc1cccc(C[C@@H](NCc2ccc(S(=O)(=O)N(C)C)cc2)c2ccccc2)c1 ZINC000540120843 939080383 /nfs/dbraw/zinc/08/03/83/939080383.db2.gz PRVGJNBLIIWVIU-XMMPIXPASA-N 0 3 424.566 4.019 20 0 HIADHN CCOc1ccccc1-c1cccc(C(=O)NCCCCN2C[C@@H](C)O[C@H](C)C2)c1 ZINC000540133555 939085690 /nfs/dbraw/zinc/08/56/90/939085690.db2.gz UOWYGIBSGNQHKK-WOJBJXKFSA-N 0 3 410.558 4.372 20 0 HIADHN CC[C@H](NCc1ccccc1CS(=O)(=O)N1CCC(C)CC1)c1ccccc1 ZINC000540151233 939093026 /nfs/dbraw/zinc/09/30/26/939093026.db2.gz PPGALEJTRZJTHY-QHCPKHFHSA-N 0 3 400.588 4.489 20 0 HIADHN Cc1ccc2c(c1)[C@@H](NCc1ccc(Br)cc1N1CCOCC1)CC2 ZINC000540162600 939097741 /nfs/dbraw/zinc/09/77/41/939097741.db2.gz LCTCGTBBCBKYGY-FQEVSTJZSA-N 0 3 401.348 4.371 20 0 HIADHN Clc1ccc(-c2noc(CCN[C@@H](Cc3ccccn3)c3cccnc3)n2)cc1 ZINC000540178334 939106376 /nfs/dbraw/zinc/10/63/76/939106376.db2.gz ZPXLADALUKFGTP-FQEVSTJZSA-N 0 3 405.889 4.296 20 0 HIADHN COc1ccc(CN2CC[C@@H](N[C@@H](C)c3cccc(-c4ccncc4)c3)C2=O)cc1 ZINC000540182762 939108457 /nfs/dbraw/zinc/10/84/57/939108457.db2.gz OLAMGVITVFGYLB-MHECFPHRSA-N 0 3 401.510 4.209 20 0 HIADHN Cc1cccc(COc2ccc([C@@H](C)N[C@@H]3CCCN(c4ccn(C)n4)C3=O)cc2)c1 ZINC000540181407 939108987 /nfs/dbraw/zinc/10/89/87/939108987.db2.gz GGNYELKVXBYTEA-AUSIDOKSSA-N 0 3 418.541 4.154 20 0 HIADHN COc1ccc(CN2CC[C@H](N[C@@H](C)c3ccc(OCC(F)(F)F)cc3)C2=O)cc1 ZINC000540183835 939109757 /nfs/dbraw/zinc/10/97/57/939109757.db2.gz ULDXPWJAYUTCEQ-YWZLYKJASA-N 0 3 422.447 4.088 20 0 HIADHN CC[C@@H](N[C@H](c1cccc(S(C)(=O)=O)c1)c1cc(F)ccc1F)C1CCOCC1 ZINC000540188403 939113008 /nfs/dbraw/zinc/11/30/08/939113008.db2.gz JIBOBIUBDHEVGP-FGZHOGPDSA-N 0 3 423.525 4.253 20 0 HIADHN CC[C@@H](N[C@@H](C)c1ccc(OCCOC)c(OC)c1)c1ccc2c(c1)OCCO2 ZINC000540192014 939117184 /nfs/dbraw/zinc/11/71/84/939117184.db2.gz XDKOWMBYAFKSSN-QFBILLFUSA-N 0 3 401.503 4.294 20 0 HIADHN CNS(=O)(=O)c1ccc([C@H](C)NCc2ccc(COc3ccccc3)cc2)cc1 ZINC000540191674 939117325 /nfs/dbraw/zinc/11/73/25/939117325.db2.gz PZFXWJVJKFGVGH-SFHVURJKSA-N 0 3 410.539 4.025 20 0 HIADHN CC(C)NC(=O)Nc1ccc([C@@H](C)NCc2ccc(Cn3ccccc3=O)cc2)cc1 ZINC000540192359 939117516 /nfs/dbraw/zinc/11/75/16/939117516.db2.gz IQAPSRYNQIFYNB-LJQANCHMSA-N 0 3 418.541 4.277 20 0 HIADHN C[C@@H](N[C@H]1CCCc2nc(-c3ccccc3Br)sc21)C(=O)N(C)C ZINC000540221076 939136334 /nfs/dbraw/zinc/13/63/34/939136334.db2.gz STNVESJCCJOQKN-RISCZKNCSA-N 0 3 408.365 4.016 20 0 HIADHN Cc1ccccc1NC(=O)C[C@@H](C)N[C@@H]1CC(=O)N(c2cccc(C(F)(F)F)c2)C1 ZINC000540223637 939139331 /nfs/dbraw/zinc/13/93/31/939139331.db2.gz ONHPKFRWTOQVDW-NVXWUHKLSA-N 0 3 419.447 4.126 20 0 HIADHN CCc1nn(C)cc1NC(=O)NC[C@@H](c1ccc(C(F)(F)F)cc1)N(CC)CC ZINC000540233241 939154952 /nfs/dbraw/zinc/15/49/52/939154952.db2.gz HDMOJJMHBUQDBE-SFHVURJKSA-N 0 3 411.472 4.206 20 0 HIADHN CO[C@H](c1ccc(Br)cc1)[C@H](C)N[C@@H]1CC(=O)N(C)c2ccccc21 ZINC000540315952 939191148 /nfs/dbraw/zinc/19/11/48/939191148.db2.gz KWUBRUKFSWTWKX-ZLXGRDSLSA-N 0 3 403.320 4.223 20 0 HIADHN Cc1ccsc1[C@H](Cc1ccccc1)N[C@@H](C)c1cccc(S(N)(=O)=O)c1 ZINC000540320475 939193705 /nfs/dbraw/zinc/19/37/05/939193705.db2.gz LLKRUHOWNNLMLE-JXFKEZNVSA-N 0 3 400.569 4.339 20 0 HIADHN CC[C@H](NCC(=O)NCC1(c2ccccc2)CCOCC1)c1ccc(Cl)cc1 ZINC000540330021 939196946 /nfs/dbraw/zinc/19/69/46/939196946.db2.gz DNODJDNRMXQBKI-NRFANRHFSA-N 0 3 400.950 4.245 20 0 HIADHN CC[C@@H](NCC(=O)NCC1(c2ccccc2)CCOCC1)c1ccc(Cl)cc1 ZINC000540330022 939197007 /nfs/dbraw/zinc/19/70/07/939197007.db2.gz DNODJDNRMXQBKI-OAQYLSRUSA-N 0 3 400.950 4.245 20 0 HIADHN COc1ccc(NC(=O)CN[C@H](c2ccc3c(c2)OCCO3)C(C)C)cc1Cl ZINC000540341022 939200307 /nfs/dbraw/zinc/20/03/07/939200307.db2.gz GJFJTMYOSDEECW-NRFANRHFSA-N 0 3 404.894 4.045 20 0 HIADHN COc1ccc([C@@H](C)NCC(=O)Nc2ccc3nc(C(F)(F)F)[nH]c3c2)cc1F ZINC000540342106 939200688 /nfs/dbraw/zinc/20/06/88/939200688.db2.gz CIPXYKIVCQMAPT-SNVBAGLBSA-N 0 3 410.371 4.019 20 0 HIADHN CC(C)C[C@H](NCC(=O)N(C)CC(=O)Nc1ccccc1Cl)c1ccccc1 ZINC000540343132 939200877 /nfs/dbraw/zinc/20/08/77/939200877.db2.gz MOYVKABPCZYOAF-FQEVSTJZSA-N 0 3 401.938 4.114 20 0 HIADHN Cc1ccc(S(=O)(=O)CCCN(C)[C@H]2CCN(Cc3ccccc3)[C@@H](C)C2)cc1 ZINC000540345690 939201584 /nfs/dbraw/zinc/20/15/84/939201584.db2.gz DANOXGYHNJSIKS-GMAHTHKFSA-N 0 3 414.615 4.144 20 0 HIADHN CC[C@@H](NCCC(=O)NC)c1ccccc1OCc1ccccc1Br ZINC000540358469 939208456 /nfs/dbraw/zinc/20/84/56/939208456.db2.gz AOVPDJSGNLMYQR-GOSISDBHSA-N 0 3 405.336 4.205 20 0 HIADHN Cc1ccccc1[C@@H](CC(C)C)NCC(=O)N1CCC(NC(=O)c2ccccc2)CC1 ZINC000540360956 939209169 /nfs/dbraw/zinc/20/91/69/939209169.db2.gz KIEPTDYFHYYJKP-XMMPIXPASA-N 0 3 421.585 4.093 20 0 HIADHN O=C(CN[C@H](c1ccccc1)[C@H]1CCOC1)N[C@@H](Cc1ccccc1)c1ccccc1 ZINC000540389979 939227255 /nfs/dbraw/zinc/22/72/55/939227255.db2.gz LBASRISBVQEWOY-OHSXHVKISA-N 0 3 414.549 4.454 20 0 HIADHN Cc1cc(C)cc([C@@H](C)NCC(=O)Nc2ccccc2I)c1 ZINC000540406100 939237044 /nfs/dbraw/zinc/23/70/44/939237044.db2.gz APQBBRROFYZTRD-CQSZACIVSA-N 0 3 408.283 4.197 20 0 HIADHN CSc1cccc(NC(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)c1C ZINC000540407397 939237415 /nfs/dbraw/zinc/23/74/15/939237415.db2.gz JTKGKPPSMQVOCE-IAGOWNOFSA-N 0 3 405.608 4.460 20 0 HIADHN C[C@H](NC[C@H](O)COc1ccc(Cl)cc1Cl)c1cccc(N2CCCC2=O)c1 ZINC000540408453 939237985 /nfs/dbraw/zinc/23/79/85/939237985.db2.gz BYFSLRJDSVUBOR-KSSFIOAISA-N 0 3 423.340 4.211 20 0 HIADHN CC(C)COc1ccc(C(C)(C)NCC(=O)N2CCC[C@H](C(F)(F)F)C2)cc1 ZINC000540416578 939240790 /nfs/dbraw/zinc/24/07/90/939240790.db2.gz ILCCKEBDNHJJBJ-KRWDZBQOSA-N 0 3 400.485 4.347 20 0 HIADHN O=C(CN[C@H](c1cccc(F)c1)C1CCCC1)Nc1cccc(C(=O)NC2CC2)c1 ZINC000540430075 939245632 /nfs/dbraw/zinc/24/56/32/939245632.db2.gz JEKBIYQRYCAHJM-QHCPKHFHSA-N 0 3 409.505 4.178 20 0 HIADHN Cc1cccc([C@@H](NCC(=O)NCc2ccccc2CN2CCCC2=O)C(C)(C)C)c1 ZINC000540437250 939248584 /nfs/dbraw/zinc/24/85/84/939248584.db2.gz ZBHDMOUHKWRYCV-RUZDIDTESA-N 0 3 421.585 4.111 20 0 HIADHN Cc1cccc(OCCNC(=O)[C@@H](C)N[C@@H](C)c2ccc(-c3ccncc3)cc2)c1 ZINC000540436424 939248890 /nfs/dbraw/zinc/24/88/90/939248890.db2.gz VOQYOBKQGDHYNA-VQTJNVASSA-N 0 3 403.526 4.291 20 0 HIADHN C[C@](Cc1cccc(Br)c1)(NCc1cc(=O)c(O)co1)c1ccccc1 ZINC000540443772 939252324 /nfs/dbraw/zinc/25/23/24/939252324.db2.gz FXGVCRJIHUJNTJ-OAQYLSRUSA-N 0 3 414.299 4.356 20 0 HIADHN CC[C@@H]1Oc2cc([C@H](C)NCc3ccc(-n4nc(C)cc4C)cc3)ccc2NC1=O ZINC000540457921 939259900 /nfs/dbraw/zinc/25/99/00/939259900.db2.gz KCEWTVBKDJYQKP-JTSKRJEESA-N 0 3 404.514 4.449 20 0 HIADHN COc1cc(OC)c(NC(=O)CN[C@H](c2ccc(F)c(C)c2)C2CC2)cc1Cl ZINC000540523311 939287671 /nfs/dbraw/zinc/28/76/71/939287671.db2.gz NWBRUFHICAVWQJ-NRFANRHFSA-N 0 3 406.885 4.484 20 0 HIADHN O=C(c1ccc(CNCc2cccc(OCc3ccccc3)c2)cc1)N1CCOCC1 ZINC000540570146 939307860 /nfs/dbraw/zinc/30/78/60/939307860.db2.gz ZEGAJYVUDNEJDX-UHFFFAOYSA-N 0 3 416.521 4.028 20 0 HIADHN CCOC(=O)c1nn(-c2ccccc2)cc1CNC[C@H]1CCCO[C@H]1c1ccccc1 ZINC000540570597 939308364 /nfs/dbraw/zinc/30/83/64/939308364.db2.gz FAZNXIFLXJFFNP-YKSBVNFPSA-N 0 3 419.525 4.307 20 0 HIADHN COc1cccc2cc([C@@H](C)NC[C@@H](O)COc3ccccc3Br)oc21 ZINC000540605123 939317558 /nfs/dbraw/zinc/31/75/58/939317558.db2.gz CJQVHQRTQAVAGY-UKRRQHHQSA-N 0 3 420.303 4.294 20 0 HIADHN Cc1c([C@H](C)NCC2([C@@H](C)CCO)CCC2)nnn1-c1cccc(Br)c1 ZINC000540607776 939318318 /nfs/dbraw/zinc/31/83/18/939318318.db2.gz MMEGLOXMCSGEDJ-GJZGRUSLSA-N 0 3 421.383 4.178 20 0 HIADHN Brc1ccc(CNCc2cccc3cc[nH]c32)c(N2CCOCC2)c1 ZINC000540623156 939322731 /nfs/dbraw/zinc/32/27/31/939322731.db2.gz JFRYKUYOTFOVOM-UHFFFAOYSA-N 0 3 400.320 4.057 20 0 HIADHN CC(C)c1cccc(-c2ccc(C(=O)N3CC[C@H](N4CCN(C(C)C)CC4)C3)o2)c1 ZINC000540662578 939334182 /nfs/dbraw/zinc/33/41/82/939334182.db2.gz NBAJSXUOTLITKX-QFIPXVFZSA-N 0 3 409.574 4.311 20 0 HIADHN Cc1cc(NC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)nn1-c1cccc(F)c1 ZINC000540678769 939337191 /nfs/dbraw/zinc/33/71/91/939337191.db2.gz NZAGPLCPJBWUOA-SFHVURJKSA-N 0 3 421.520 4.448 20 0 HIADHN CN(C)Cc1cccc(NC(=O)N2CCC[C@@H](c3nnc(C4CCCCC4)[nH]3)C2)c1 ZINC000540862564 939399902 /nfs/dbraw/zinc/39/99/02/939399902.db2.gz HBJCQSHMMROJKK-LJQANCHMSA-N 0 3 410.566 4.326 20 0 HIADHN CC(C)[C@H](NCc1ccc(S(=O)(=O)N2CCCC2)cc1)c1ccc(F)c(F)c1 ZINC000540987069 939425244 /nfs/dbraw/zinc/42/52/44/939425244.db2.gz ISZRDBPOUQETTJ-NRFANRHFSA-N 0 3 408.514 4.236 20 0 HIADHN CSC[C@@H](NCc1ccc(N2CCN(C)CC2)nc1)c1ccc(C(F)(F)F)cc1 ZINC000540988631 939425722 /nfs/dbraw/zinc/42/57/22/939425722.db2.gz HWCJNEMCFOHHKD-LJQANCHMSA-N 0 3 424.536 4.046 20 0 HIADHN OCC[C@@H](NCCCc1nc(-c2cccs2)no1)c1ccccc1Br ZINC000541021987 939432509 /nfs/dbraw/zinc/43/25/09/939432509.db2.gz RNIFRJDCSTVFPI-OAHLLOKOSA-N 0 3 422.348 4.207 20 0 HIADHN COc1ccc([C@@H](NC(=O)CN[C@H](C)c2ccc(-n3ccnc3C)cc2)C2CC2)cc1 ZINC000541027277 939434811 /nfs/dbraw/zinc/43/48/11/939434811.db2.gz YMZVSIYUSKMKGY-NSYGIPOTSA-N 0 3 418.541 4.107 20 0 HIADHN CN(C)[C@@H](CNC(=O)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1)c1ccccc1 ZINC000541034917 939437906 /nfs/dbraw/zinc/43/79/06/939437906.db2.gz OQXSJUBDFPMZTE-VQTJNVASSA-N 0 3 421.463 4.091 20 0 HIADHN CCN1CC[C@@H](NCc2ccc(Br)cn2)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000541065674 939447418 /nfs/dbraw/zinc/44/74/18/939447418.db2.gz VSJYHEPIDZHVPL-SJLPKXTDSA-N 0 3 414.269 4.187 20 0 HIADHN COc1ccc(F)cc1[C@@H](C)N[C@H](C)CC(=O)Nc1ccc(NC(=O)C2CC2)cc1 ZINC000541212651 939485873 /nfs/dbraw/zinc/48/58/73/939485873.db2.gz VDACXGJELRAWRY-HUUCEWRRSA-N 0 3 413.493 4.251 20 0 HIADHN O=C(Nc1ccc(C(=O)NCCN2CCCC2)cc1)c1ccc(-c2cccs2)o1 ZINC000541218693 939486153 /nfs/dbraw/zinc/48/61/53/939486153.db2.gz RFCQXABUCUFBCG-UHFFFAOYSA-N 0 3 409.511 4.086 20 0 HIADHN CCCc1c(C(=O)NCC2(N3CCSCC3)CCCC2)cnn1C1CCCC1 ZINC000541295346 939489781 /nfs/dbraw/zinc/48/97/81/939489781.db2.gz GWSDNOOBZYEMAA-UHFFFAOYSA-N 0 3 404.624 4.042 20 0 HIADHN COCC[C@@H](Cc1ccco1)NCc1nc(-c2cccc(Br)c2)c[nH]1 ZINC000541379460 939500941 /nfs/dbraw/zinc/50/09/41/939500941.db2.gz NVBVWMZDPGMQBI-INIZCTEOSA-N 0 3 404.308 4.170 20 0 HIADHN CC(C)c1ccc(CN[C@@H](CN2CCC(C(N)=O)CC2)c2ccc(Cl)cc2)cc1 ZINC000541550467 939552295 /nfs/dbraw/zinc/55/22/95/939552295.db2.gz ZLKWYDQCXDTJBG-QHCPKHFHSA-N 0 3 413.993 4.492 20 0 HIADHN O=S1(=O)CCC(CCN[C@@H](c2ccc(F)cc2)c2cnc3ccccc3c2)CC1 ZINC000541566390 939556542 /nfs/dbraw/zinc/55/65/42/939556542.db2.gz QUYLNKJLGCKDFN-QHCPKHFHSA-N 0 3 412.530 4.268 20 0 HIADHN CCC[C@@H](NCc1ccc(Br)cc1N1CCOCC1)c1cccnc1 ZINC000541742024 939618476 /nfs/dbraw/zinc/61/84/76/939618476.db2.gz OTZXUCYRINEUCF-LJQANCHMSA-N 0 3 404.352 4.312 20 0 HIADHN O=C(N[C@@H]1CCO[C@H](c2ccc(F)cc2)C1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000541749474 939620175 /nfs/dbraw/zinc/62/01/75/939620175.db2.gz MFQGUPNLSJJJIP-PTUXOGIPSA-N 0 3 414.496 4.213 20 0 HIADHN CS[C@H]1CN(C(=O)c2csc(-c3ccc(Cl)cc3)n2)C[C@H]1N1CCCC1 ZINC000541844080 939645938 /nfs/dbraw/zinc/64/59/38/939645938.db2.gz YKWMUAKLNZBDGK-SJORKVTESA-N 0 3 407.992 4.115 20 0 HIADHN Cc1nn(-c2ccccc2)cc1NC(=O)NC[C@@H](c1ccc(C)cc1)N1CCCC1 ZINC000541907645 939651390 /nfs/dbraw/zinc/65/13/90/939651390.db2.gz YRLCXYCHUKJZDX-QHCPKHFHSA-N 0 3 403.530 4.448 20 0 HIADHN CC(C)[C@@H](NC(=O)N(CCN(C)C)Cc1ccccn1)c1ccc(Cl)cc1F ZINC000541928401 939656437 /nfs/dbraw/zinc/65/64/37/939656437.db2.gz QCUAVLLTCXXGIL-HXUWFJFHSA-N 0 3 406.933 4.345 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)NCC(=O)N(C)Cc2ccc(Cl)s2)cc1 ZINC000541954990 939661426 /nfs/dbraw/zinc/66/14/26/939661426.db2.gz FNDANQYCXFUXLV-CQSZACIVSA-N 0 3 402.951 4.205 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)N[C@@H](C)C(=O)Nc2ccc3c(c2)OCCCO3)cc1 ZINC000541956076 939661677 /nfs/dbraw/zinc/66/16/77/939661677.db2.gz NAQFUBQPEURRAF-IRXDYDNUSA-N 0 3 420.513 4.020 20 0 HIADHN CC(C)[C@H]1C[C@H](CC(=O)NC2CCN(CCOc3ccc(Cl)cc3)CC2)CCO1 ZINC000541961948 939663220 /nfs/dbraw/zinc/66/32/20/939663220.db2.gz QODHWBKHWIPAKO-XMSQKQJNSA-N 0 3 422.997 4.141 20 0 HIADHN Cc1ccccc1[C@H](CO)NC[C@H](O)CO[C@@H](c1ccccc1)c1ccccc1C ZINC000541982231 939669725 /nfs/dbraw/zinc/66/97/25/939669725.db2.gz IAJBMGJBLGFRIE-HRNNMHKYSA-N 0 3 405.538 4.094 20 0 HIADHN CCN1CC[C@@H](NCc2cc(OC)c(OC)cc2OC)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000541992109 939671973 /nfs/dbraw/zinc/67/19/73/939671973.db2.gz NFTYHBZUKBMPHY-VGOFRKELSA-N 0 3 424.463 4.055 20 0 HIADHN CCN1CC[C@@H](NCc2cc(OC)c(OC)cc2OC)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000541992110 939672018 /nfs/dbraw/zinc/67/20/18/939672018.db2.gz NFTYHBZUKBMPHY-VGSWGCGISA-N 0 3 424.463 4.055 20 0 HIADHN CC1CCN([C@@H](CNC(=O)c2cc(-c3cnn(C)c3)ccc2F)c2ccccc2)CC1 ZINC000542021527 939688949 /nfs/dbraw/zinc/68/89/49/939688949.db2.gz ALQVDCHREVXDRJ-DEOSSOPVSA-N 0 3 420.532 4.429 20 0 HIADHN CC[C@@H](CNC(=O)N1CCC(c2ccc(C)nc2)CC1)N1CCc2ccccc2C1 ZINC000542109784 939717318 /nfs/dbraw/zinc/71/73/18/939717318.db2.gz ZJLFMGMLPUSDTB-DEOSSOPVSA-N 0 3 406.574 4.116 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCC(c2ccc(C)nc2)CC1)c1cccc(OC)c1 ZINC000542111534 939718039 /nfs/dbraw/zinc/71/80/39/939718039.db2.gz KADBGLCXUGJMLK-XMMPIXPASA-N 0 3 424.589 4.371 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)c2ccc(C)cc2Sc2ccccc2)CC1 ZINC000542359803 939807402 /nfs/dbraw/zinc/80/74/02/939807402.db2.gz MBPGSVIHEJDNSG-HXUWFJFHSA-N 0 3 411.615 4.150 20 0 HIADHN COc1ccc(CN[C@H](CN2CCOCC2)c2ccccc2C)cc1OC1CCCC1 ZINC000542471274 939828525 /nfs/dbraw/zinc/82/85/25/939828525.db2.gz PHXHIOTVENCULA-XMMPIXPASA-N 0 3 424.585 4.488 20 0 HIADHN COC1CCC(N[C@@H](c2cccc(S(C)(=O)=O)c2)c2ccc(F)c(F)c2)CC1 ZINC000542485786 939831542 /nfs/dbraw/zinc/83/15/42/939831542.db2.gz UNULWNACVHYHQE-BPZDKFOGSA-N 0 3 409.498 4.005 20 0 HIADHN O[C@H](CN[C@@H](Cn1cnc2ccccc21)c1ccc(F)cc1)COc1ccc(F)cc1 ZINC000542517988 939836065 /nfs/dbraw/zinc/83/60/65/939836065.db2.gz MDLKLZIKHCDQJQ-OFNKIYASSA-N 0 3 423.463 4.085 20 0 HIADHN COc1ccc([C@H]2CCCN2C[C@H](O)COc2cc(C)ccc2Cl)cc1OC ZINC000542520026 939836509 /nfs/dbraw/zinc/83/65/09/939836509.db2.gz GDZPERBMWYFKIC-PKOBYXMFSA-N 0 3 405.922 4.242 20 0 HIADHN COC(=O)C[C@@H](N[C@H](C)C(=O)N(c1nccs1)C1CCCCC1)C1CCCCC1 ZINC000542531114 939838511 /nfs/dbraw/zinc/83/85/11/939838511.db2.gz KAJBQFOPVYIDON-VQIMIIECSA-N 0 3 421.607 4.299 20 0 HIADHN C[S@@](=O)C[C@H](NCCOc1ccc(Cl)cc1Br)c1ccccc1 ZINC000542539070 939840232 /nfs/dbraw/zinc/84/02/32/939840232.db2.gz UECOYSQFGKJKFU-QMHKHESXSA-N 0 3 416.768 4.191 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)N[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000542545356 939841541 /nfs/dbraw/zinc/84/15/41/939841541.db2.gz UFUKJOPGKOJONV-XPWALMASSA-N 0 3 411.521 4.182 20 0 HIADHN Cc1cnc([C@H](C)CNC(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)s1 ZINC000542554482 939842786 /nfs/dbraw/zinc/84/27/86/939842786.db2.gz JKGYAWPXBPSUOD-NVXWUHKLSA-N 0 3 406.621 4.389 20 0 HIADHN Cc1nccc(NCc2cccc(C(=O)NC[C@H](c3cccs3)N3CCCC3)c2)n1 ZINC000542569588 939844838 /nfs/dbraw/zinc/84/48/38/939844838.db2.gz PSXIOKUVZDCNDB-HXUWFJFHSA-N 0 3 421.570 4.026 20 0 HIADHN C[C@H](NCc1cc2c(cc1Br)OCCCO2)[C@@H]1COc2ccccc21 ZINC000542627883 939850083 /nfs/dbraw/zinc/85/00/83/939850083.db2.gz SCTYFEKDJTVVHY-BBRMVZONSA-N 0 3 404.304 4.265 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)NC(c1ccccc1)c1ccccc1)[C@@H]1COc2ccccc21 ZINC000542629225 939850300 /nfs/dbraw/zinc/85/03/00/939850300.db2.gz YEVCHPNCBADWIZ-MSYCTHLASA-N 0 3 400.522 4.435 20 0 HIADHN Brc1ccc(N2CC[C@@H](CN[C@@H](c3ccccc3)c3cncnc3)C2)cc1 ZINC000542668277 939852931 /nfs/dbraw/zinc/85/29/31/939852931.db2.gz HSFVQLWOPOZLQG-JTSKRJEESA-N 0 3 423.358 4.445 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@H]2NC[C@H](c2cccs2)N(C)C)cc1 ZINC000542671910 939853241 /nfs/dbraw/zinc/85/32/41/939853241.db2.gz VIEDUWASICFOML-SFHLNBCPSA-N 0 3 406.617 4.034 20 0 HIADHN CS[C@@H]1CN(C(=O)c2oc3ccc(Br)cc3c2C)C[C@H]1N1CCCC1 ZINC000542772942 939860241 /nfs/dbraw/zinc/86/02/41/939860241.db2.gz JRCVGFPGYXSKDA-NVXWUHKLSA-N 0 3 423.376 4.156 20 0 HIADHN CC(C)N(CCN(C)C)C(=O)Nc1ccc(Br)cc1Br ZINC000542899923 939874948 /nfs/dbraw/zinc/87/49/48/939874948.db2.gz FDTWSHWIRHIGPA-UHFFFAOYSA-N 0 3 407.150 4.016 20 0 HIADHN CCN1CC[C@H](NCc2cnc(-c3ccccc3)nc2)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000542942936 939882777 /nfs/dbraw/zinc/88/27/77/939882777.db2.gz XRBCGABBURRNTG-UNMCSNQZSA-N 0 3 412.459 4.486 20 0 HIADHN COC(=O)c1cccc(NC(=O)C[C@@H](C)N[C@@H]2CCSc3ccc(F)cc32)c1 ZINC000543068139 939921068 /nfs/dbraw/zinc/92/10/68/939921068.db2.gz UEWBGAXZVVWBFF-FZKQIMNGSA-N 0 3 402.491 4.156 20 0 HIADHN CCNC(=O)COc1cccc(CN[C@H]2CCCc3c(Br)cccc32)c1 ZINC000543113531 939951858 /nfs/dbraw/zinc/95/18/58/939951858.db2.gz BOJHZKMAGDTLEP-FQEVSTJZSA-N 0 3 417.347 4.131 20 0 HIADHN Cc1cc(NC(=O)c2cccnc2C2CC2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000543155510 939978614 /nfs/dbraw/zinc/97/86/14/939978614.db2.gz CIXWBKMUNFFXDL-FQEVSTJZSA-N 0 3 401.514 4.163 20 0 HIADHN CC[C@@H]1CCC[C@H](CN2CCN(CC(=O)Nc3ccccc3C(F)(F)F)CC2)C1 ZINC000543396783 940050996 /nfs/dbraw/zinc/05/09/96/940050996.db2.gz PYVFVFDEMYXLEW-MSOLQXFVSA-N 0 3 411.512 4.478 20 0 HIADHN CC[C@H]1CCC[C@H](CN2CCN(CC(=O)Nc3ccccc3C(F)(F)F)CC2)C1 ZINC000543396788 940051225 /nfs/dbraw/zinc/05/12/25/940051225.db2.gz PYVFVFDEMYXLEW-ROUUACIJSA-N 0 3 411.512 4.478 20 0 HIADHN CCc1ccc([C@H](CN2CCOCC2)NCc2ccc(NC(=O)C(C)C)cc2)cc1 ZINC000543399911 940051785 /nfs/dbraw/zinc/05/17/85/940051785.db2.gz PEBMNZJJIIGREE-DEOSSOPVSA-N 0 3 409.574 4.007 20 0 HIADHN CCc1ccc([C@H](CN2CCOCC2)NCc2ccc(-c3cccnc3)cc2)cc1 ZINC000543402215 940052832 /nfs/dbraw/zinc/05/28/32/940052832.db2.gz GJSJHWZXLSIDDT-SANMLTNESA-N 0 3 401.554 4.474 20 0 HIADHN CCc1ccc([C@@H](CN2CCOCC2)NCc2cc(Br)cs2)cc1 ZINC000543403934 940053611 /nfs/dbraw/zinc/05/36/11/940053611.db2.gz HLFVBYUYRJXGJI-LJQANCHMSA-N 0 3 409.393 4.236 20 0 HIADHN COc1cc(OC)cc(N2CC[C@H](CN[C@@H](c3ccccc3)c3ccc(F)cn3)C2)c1 ZINC000543404908 940054525 /nfs/dbraw/zinc/05/45/25/940054525.db2.gz LQDVMPYEDREIPL-CJAUYULYSA-N 0 3 421.516 4.443 20 0 HIADHN C[C@@H]1C[C@@H](CCN[C@H](c2cccc(S(C)(=O)=O)c2)c2ccc(F)c(F)c2)CCO1 ZINC000543419048 940059266 /nfs/dbraw/zinc/05/92/66/940059266.db2.gz NHKOWWREWMQRPZ-ZMPRRUGASA-N 0 3 423.525 4.253 20 0 HIADHN CCc1ccc([C@H](CN2CCOCC2)NCc2cccc(OCC(F)F)c2)cc1 ZINC000543424410 940060888 /nfs/dbraw/zinc/06/08/88/940060888.db2.gz SDEQVUSVJQGYEL-QFIPXVFZSA-N 0 3 404.501 4.056 20 0 HIADHN COC(=O)c1ccc(C)c(NC(=O)CN[C@@H](Cc2ccccc2)c2cccs2)c1 ZINC000543454005 940067560 /nfs/dbraw/zinc/06/75/60/940067560.db2.gz GLQSBVUTFBSNRK-FQEVSTJZSA-N 0 3 408.523 4.355 20 0 HIADHN COc1ccc(C(NC(=O)CNC(C)(C)c2cccs2)c2ccc(OC)cc2)cc1 ZINC000543499486 940085933 /nfs/dbraw/zinc/08/59/33/940085933.db2.gz VRJMGTSCHYDLDQ-UHFFFAOYSA-N 0 3 424.566 4.496 20 0 HIADHN Cc1ccc(NC(=O)CN[C@H](C)[C@@H]2Oc3ccccc3[C@@H]2C)c(Br)c1 ZINC000543549942 940105726 /nfs/dbraw/zinc/10/57/26/940105726.db2.gz ZJPPHAHDRMAZEN-LRDNONRASA-N 0 3 403.320 4.239 20 0 HIADHN COc1cc(-c2noc(CNC3(Cc4ccccc4)CCCC3)n2)cc(OC)c1OC ZINC000543552876 940106755 /nfs/dbraw/zinc/10/67/55/940106755.db2.gz DOCBRAVKQXKIMG-UHFFFAOYSA-N 0 3 423.513 4.408 20 0 HIADHN O=C(Nc1csc(-c2ccccn2)n1)N1CCCN(CCCc2ccccc2)CC1 ZINC000543619620 940135724 /nfs/dbraw/zinc/13/57/24/940135724.db2.gz GHPQJDVWLBYFHX-UHFFFAOYSA-N 0 3 421.570 4.378 20 0 HIADHN CSC[C@H](N[C@H](C)Cn1ncc2ccccc2c1=O)c1ccc(C(F)(F)F)cc1 ZINC000543774790 940181694 /nfs/dbraw/zinc/18/16/94/940181694.db2.gz DPJRUSXMDKESCL-KUHUBIRLSA-N 0 3 421.488 4.498 20 0 HIADHN CN1CC[C@@H](CNCc2ncc(Br)s2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000543848975 940207995 /nfs/dbraw/zinc/20/79/95/940207995.db2.gz DKPWVABTZKBDTH-ZBEGNZNMSA-N 0 3 418.763 4.481 20 0 HIADHN CN(C)C(=O)c1ccc(CN[C@@H]2CCN(C(C)(C)C)[C@H]2c2ccc(Cl)c(F)c2)[nH]1 ZINC000543850112 940208349 /nfs/dbraw/zinc/20/83/49/940208349.db2.gz IZGPFLQOLISEJQ-QUCCMNQESA-N 0 3 420.960 4.213 20 0 HIADHN Cn1cc(CNCC2=Cc3cc(Br)ccc3OC2)c(-c2ccccc2)n1 ZINC000543877330 940221628 /nfs/dbraw/zinc/22/16/28/940221628.db2.gz XTEYNBXVVQXIID-UHFFFAOYSA-N 0 3 410.315 4.415 20 0 HIADHN COc1ccc(Cn2ccnc2SC[C@H]2CN(Cc3ccccc3)CCCO2)cc1 ZINC000563800075 945304110 /nfs/dbraw/zinc/30/41/10/945304110.db2.gz HOZMLTBLSMRVNN-HSZRJFAPSA-N 0 3 423.582 4.323 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cc(-c2cnn(C)c2)ccc1F)c1ccsc1 ZINC000543932827 940251792 /nfs/dbraw/zinc/25/17/92/940251792.db2.gz RBSOXURMQOMJST-FQEVSTJZSA-N 0 3 400.523 4.101 20 0 HIADHN C[C@@H](NC(=O)[C@H](C)N1CCC(CCCn2ccnc2)CC1)c1ccc(Cl)cc1 ZINC000543988688 940284720 /nfs/dbraw/zinc/28/47/20/940284720.db2.gz WTSFDLXSCLOQEH-MSOLQXFVSA-N 0 3 402.970 4.295 20 0 HIADHN C[C@H]1CN(c2ccc(CN[C@@H]3CCCc4c(Br)cccc43)cn2)CCO1 ZINC000544008401 940296382 /nfs/dbraw/zinc/29/63/82/940296382.db2.gz KUMLYLWUTZVTPU-MGPUTAFESA-N 0 3 416.363 4.236 20 0 HIADHN Cc1cccc([C@H]2CCN(CC(=O)N3CCC[C@@H]3c3ccc4c(c3)OCCCO4)C2)c1 ZINC000544183414 940346396 /nfs/dbraw/zinc/34/63/96/940346396.db2.gz GOZLCDSYCYFSJR-XZOQPEGZSA-N 0 3 420.553 4.309 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)[C@@H]2CCn3c(cnc3C3CCCCC3)C2)N(C)C)cc1 ZINC000544198851 940351613 /nfs/dbraw/zinc/35/16/13/940351613.db2.gz FJWKAQIXVHVXHC-FYYLOGMGSA-N 0 3 408.590 4.221 20 0 HIADHN Cc1cc(NC(=O)N2CCCN(CCCc3ccccc3)CC2)nn1[C@@H](C)C1CC1 ZINC000544265912 940373085 /nfs/dbraw/zinc/37/30/85/940373085.db2.gz UXGPJWINOGGRSL-FQEVSTJZSA-N 0 3 409.578 4.335 20 0 HIADHN CCCN(C(=O)NCC[C@@H]1CCO[C@H](C)C1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000544330091 940392008 /nfs/dbraw/zinc/39/20/08/940392008.db2.gz RCQIHCVLNQTPIL-MQSCRBSSSA-N 0 3 401.595 4.278 20 0 HIADHN CC(C)([C@H](NC(=O)Cn1ncc2ccccc21)c1ccc(F)c(F)c1)N1CCCC1 ZINC000544358326 940399870 /nfs/dbraw/zinc/39/98/70/940399870.db2.gz PFGMFXZRWGTGJN-JOCHJYFZSA-N 0 3 412.484 4.046 20 0 HIADHN CC(C)[C@H](CN[C@@H](c1ccc(F)cc1)c1cnccn1)N1CCc2ccccc2C1 ZINC000544358839 940400220 /nfs/dbraw/zinc/40/02/20/940400220.db2.gz COFBKFNFVUZMDK-DQEYMECFSA-N 0 3 404.533 4.378 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(-c4cc5cc(F)ccc5s4)n3)cn2)CC1 ZINC000544363425 940402050 /nfs/dbraw/zinc/40/20/50/940402050.db2.gz XEDJNIWRSSLNLV-UHFFFAOYSA-N 0 3 409.490 4.294 20 0 HIADHN Cc1c2cc(F)ccc2oc1-c1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1 ZINC000544390474 940409405 /nfs/dbraw/zinc/40/94/05/940409405.db2.gz AUISTDINXPVIFJ-UHFFFAOYSA-N 0 3 407.449 4.134 20 0 HIADHN COc1cc(-c2noc(CN[C@@H]3C[C@H](C)CC[C@H]3C(C)C)n2)cc(OC)c1OC ZINC000544434914 940429318 /nfs/dbraw/zinc/42/93/18/940429318.db2.gz DRFVSAQFRASRKB-HYVNUMGLSA-N 0 3 403.523 4.313 20 0 HIADHN CC(C)N1CC[C@@H](N[C@@H](C)C(=O)N2CCc3ccccc32)[C@@H]1c1ccc(F)c(F)c1 ZINC000563901095 945320665 /nfs/dbraw/zinc/32/06/65/945320665.db2.gz QABVMMNXEXAHAK-YTJPUZGESA-N 0 3 413.512 4.056 20 0 HIADHN COc1ccc(C2(C(=O)NC[C@@H](c3ccccc3)N3CCCC3)CCC2)cc1OC ZINC000544465852 940442852 /nfs/dbraw/zinc/44/28/52/940442852.db2.gz VVFVFNJQWUWHSV-NRFANRHFSA-N 0 3 408.542 4.079 20 0 HIADHN OC[C@H](CN[C@H](c1ccccc1)c1cncnc1)Cc1ccc(C(F)(F)F)cc1 ZINC000544576047 940483200 /nfs/dbraw/zinc/48/32/00/940483200.db2.gz KYFRQYABBDPKHG-LAUBAEHRSA-N 0 3 401.432 4.026 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@H]2CCCC[C@H]2NCc2ccc(Cn3cccn3)cc2)cc1 ZINC000544583128 940484554 /nfs/dbraw/zinc/48/45/54/940484554.db2.gz UXJIPULZGMDSOY-RPWUZVMVSA-N 0 3 423.582 4.115 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N(C)[C@H]2CCO[C@@H](c3ccc(F)cc3)C2)N(C)C)cc1 ZINC000544662363 940499751 /nfs/dbraw/zinc/49/97/51/940499751.db2.gz OCTBCXZXLQLTNC-RJGXRXQPSA-N 0 3 413.537 4.299 20 0 HIADHN COc1cc2c(cc1CN[C@H](C)[C@@H](OC)c1ccc(Br)cc1)OCO2 ZINC000544709562 940505368 /nfs/dbraw/zinc/50/53/68/940505368.db2.gz DLDKVGOFYITCHY-CWTRNNRKSA-N 0 3 408.292 4.052 20 0 HIADHN COC(=O)[C@@H](C)Cc1ccc(NC(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)cc1 ZINC000544797967 940515192 /nfs/dbraw/zinc/51/51/92/940515192.db2.gz GXBXOAJEWCYWSE-VQTJNVASSA-N 0 3 423.557 4.167 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)NCc2nc3ccccc3n2C2CC2)N2CCCC2)cc1 ZINC000544805257 940515946 /nfs/dbraw/zinc/51/59/46/940515946.db2.gz ALVCTAOGIQGLJP-HSZRJFAPSA-N 0 3 417.557 4.316 20 0 HIADHN CCN(C(=O)c1cc(C)nc2c1cnn2C(C)C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000544848434 940519020 /nfs/dbraw/zinc/51/90/20/940519020.db2.gz BDRAWQJQXQZCAY-HXUWFJFHSA-N 0 3 405.546 4.057 20 0 HIADHN Cc1cc(C)nc(-c2noc([C@@]3(C(F)(F)F)CCN(Cc4ccccc4)C3)n2)c1 ZINC000544989543 940531228 /nfs/dbraw/zinc/53/12/28/940531228.db2.gz SQGDAHPWOFTHLN-HXUWFJFHSA-N 0 3 402.420 4.454 20 0 HIADHN CC(=O)N(CCc1noc(-c2cccc(CN(C)Cc3ccccc3)c2)n1)C(C)C ZINC000545076819 940539954 /nfs/dbraw/zinc/53/99/54/940539954.db2.gz NNKCWNKXSACXKW-UHFFFAOYSA-N 0 3 406.530 4.168 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@@H]1CCOC(C)(C)C1)c1ccc(C(F)(F)F)cc1 ZINC000545236777 940557921 /nfs/dbraw/zinc/55/79/21/940557921.db2.gz OCFMVLPWFVPQAU-QZTJIDSGSA-N 0 3 415.500 4.345 20 0 HIADHN C[C@H](CNC(=O)c1cc(Cl)ccc1Sc1ccccc1)CN1CCN(C)CC1 ZINC000545387300 940567865 /nfs/dbraw/zinc/56/78/65/940567865.db2.gz DVCNTNSNTGZJSK-QGZVFWFLSA-N 0 3 418.006 4.105 20 0 HIADHN CS[C@@H]1CN(C(=O)Nc2ccc(Oc3ccc(Cl)cn3)cc2)C[C@@H]1N(C)C ZINC000545421955 940569086 /nfs/dbraw/zinc/56/90/86/940569086.db2.gz LZOAOVBAQLQDGO-DLBZAZTESA-N 0 3 406.939 4.037 20 0 HIADHN CS[C@@H]1CN(C(=O)Nc2ccc(Oc3ccc(Cl)cn3)cc2)C[C@H]1N(C)C ZINC000545421956 940569110 /nfs/dbraw/zinc/56/91/10/940569110.db2.gz LZOAOVBAQLQDGO-IAGOWNOFSA-N 0 3 406.939 4.037 20 0 HIADHN C[C@@H]1CCN(C(=O)NCc2nc3ccccc3n2C2CC2)CCN1Cc1ccccc1 ZINC000545449007 940570364 /nfs/dbraw/zinc/57/03/64/940570364.db2.gz IXNHYLSEXXAORX-LJQANCHMSA-N 0 3 417.557 4.177 20 0 HIADHN CCN(C(=O)Cc1csc(Cc2ccccc2)n1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000545475401 940571317 /nfs/dbraw/zinc/57/13/17/940571317.db2.gz OHUHZPYMMVWFDI-HSZRJFAPSA-N 0 3 419.594 4.399 20 0 HIADHN CC(=O)Nc1ccc(CN2CCC(Oc3cccc(Br)c3)CC2)cc1 ZINC000545554854 940574602 /nfs/dbraw/zinc/57/46/02/940574602.db2.gz NTXQHRNHRHXBKF-UHFFFAOYSA-N 0 3 403.320 4.451 20 0 HIADHN Fc1cccc(CN2CCC[C@H](c3nc(-c4cncc(Br)c4)no3)C2)c1 ZINC000545608303 940576984 /nfs/dbraw/zinc/57/69/84/940576984.db2.gz KUAQASOKWSPWPP-AWEZNQCLSA-N 0 3 417.282 4.413 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(-c4ccc(SC5CC5)cc4)n3)cn2)CC1 ZINC000545656969 940579194 /nfs/dbraw/zinc/57/91/94/940579194.db2.gz CDEWWVYGOCDHHY-UHFFFAOYSA-N 0 3 407.543 4.195 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(/C=C/c4cc5ccccc5o4)n3)cn2)CC1 ZINC000545660790 940579455 /nfs/dbraw/zinc/57/94/55/940579455.db2.gz XATPCESSOLZUQX-CSKARUKUSA-N 0 3 401.470 4.190 20 0 HIADHN FC(F)(F)[C@]1(c2nc(-c3ccc4nc[nH]c4c3)no2)CCN(Cc2ccccc2)C1 ZINC000545754120 940583955 /nfs/dbraw/zinc/58/39/55/940583955.db2.gz QICUXQUTYYRFMU-HXUWFJFHSA-N 0 3 413.403 4.319 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)c1ccc(NC(=O)c2cccs2)cc1)c1ccco1 ZINC000563989557 945338183 /nfs/dbraw/zinc/33/81/83/945338183.db2.gz WMRMCXHRIZNLJI-MAUKXSAKSA-N 0 3 411.527 4.453 20 0 HIADHN CN(C)C[C@@H](NC(=O)c1cc(OC(F)F)cc(OC(F)F)c1)c1ccc(F)cc1 ZINC000563991508 945338555 /nfs/dbraw/zinc/33/85/55/945338555.db2.gz WPKDSXJKUXNREE-MRXNPFEDSA-N 0 3 418.362 4.061 20 0 HIADHN C[C@H](N[C@@H]1COc2ccc(F)cc2C1)c1ccc(S(=O)(=O)C2CCCC2)cc1 ZINC000563998779 945340865 /nfs/dbraw/zinc/34/08/65/945340865.db2.gz NDBMDGNUVUPAAX-KXBFYZLASA-N 0 3 403.519 4.196 20 0 HIADHN c1c(CN2CCOC3(CCOCC3)CC2)c(-c2ccccc2)nn1Cc1ccccc1 ZINC000546010230 940673987 /nfs/dbraw/zinc/67/39/87/940673987.db2.gz VHPSGPXCQKLJAI-UHFFFAOYSA-N 0 3 417.553 4.370 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3scnc3C3CCCC3)CC2)C[C@H](C)O1 ZINC000546146754 940713140 /nfs/dbraw/zinc/71/31/40/940713140.db2.gz VCQCYHWKJMUSCH-CALCHBBNSA-N 0 3 405.608 4.152 20 0 HIADHN CN(C(=O)NCc1nc2ccccc2n1C1CC1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000546155654 940716507 /nfs/dbraw/zinc/71/65/07/940716507.db2.gz OEBQBWYHDHOZRD-OAQYLSRUSA-N 0 3 417.557 4.177 20 0 HIADHN COCC(=O)Nc1cccc(CN[C@H](Cc2cccnc2)c2ccc(Cl)cc2)c1 ZINC000546163584 940718818 /nfs/dbraw/zinc/71/88/18/940718818.db2.gz MOSUKGFNHVIYAM-JOCHJYFZSA-N 0 3 409.917 4.394 20 0 HIADHN CCN(C(=O)Cc1coc(-c2ccc(F)cc2)n1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000546183357 940723460 /nfs/dbraw/zinc/72/34/60/940723460.db2.gz BHFNSLUVNDGCMZ-QFIPXVFZSA-N 0 3 407.489 4.146 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(F)cc2)CC1)c1ccc(F)c(Cl)c1F ZINC000546202852 940728384 /nfs/dbraw/zinc/72/83/84/940728384.db2.gz KMVRJSDMJJTDAC-UHFFFAOYSA-N 0 3 412.839 4.031 20 0 HIADHN COCCn1cc2c(n1)[C@@H](N[C@H](C)Cc1ccc(Br)cc1F)CCC2 ZINC000546227228 940735563 /nfs/dbraw/zinc/73/55/63/940735563.db2.gz FOJZWTOXWUIJCL-ACJLOTCBSA-N 0 3 410.331 4.029 20 0 HIADHN Cc1[nH]c2ccc(-c3nc(-c4ccc(N5CCCN(C)CC5)nc4)no3)cc2c1C ZINC000546364978 940802535 /nfs/dbraw/zinc/80/25/35/940802535.db2.gz CBAQRMPWSBNLFK-UHFFFAOYSA-N 0 3 402.502 4.039 20 0 HIADHN C[C@@H]1C[C@@H]1c1ccc(/C=C/c2nc(-c3ccc(N4CCCN(C)CC4)nc3)no2)o1 ZINC000546368698 940803566 /nfs/dbraw/zinc/80/35/66/940803566.db2.gz HRDHAVFVBNNARW-MCFURUIZSA-N 0 3 405.502 4.160 20 0 HIADHN CC(C)CC(=O)Nc1ccc(Cl)c(C(=O)N[C@@H](CN(C)C)c2ccc(F)cc2)c1 ZINC000564021375 945352085 /nfs/dbraw/zinc/35/20/85/945352085.db2.gz IHZYHFYSEOBIKQ-FQEVSTJZSA-N 0 3 419.928 4.496 20 0 HIADHN Cc1[nH]c(=O)c(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)cc1-c1ccccc1 ZINC000546614237 940861179 /nfs/dbraw/zinc/86/11/79/940861179.db2.gz MKCITSHLYIWAHN-GAJHUEQPSA-N 0 3 401.510 4.013 20 0 HIADHN O=C(NCc1nc2ccccc2n1C1CC1)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000546848934 940894481 /nfs/dbraw/zinc/89/44/81/940894481.db2.gz SPDAASJIRFEPED-QFIPXVFZSA-N 0 3 403.530 4.008 20 0 HIADHN CCO[C@@H]1C[C@H](N[C@H](C)c2ccc(OC[C@@H]3CCCCO3)c(F)c2)[C@]12CCCO2 ZINC000546869640 940898523 /nfs/dbraw/zinc/89/85/23/940898523.db2.gz FILAJKMKACLLNU-QREOPNFFSA-N 0 3 407.526 4.151 20 0 HIADHN CN1CC[C@H](c2noc(-c3ccc(CN4CCSCC4)cc3)n2)c2ccccc21 ZINC000547051987 940975867 /nfs/dbraw/zinc/97/58/67/940975867.db2.gz BDXJVDWMLYMUBF-FQEVSTJZSA-N 0 3 406.555 4.257 20 0 HIADHN CN1CCCN(c2ccc(-c3noc([C@@H]4C[C@]45CCCc4ccccc45)n3)cn2)CC1 ZINC000547067355 940981634 /nfs/dbraw/zinc/98/16/34/940981634.db2.gz CKWODHLAALBHLF-OFVILXPXSA-N 0 3 415.541 4.035 20 0 HIADHN Cc1ccc(-c2cc(C(F)(F)F)c(C#N)c(SCCCN3CCN(C)CC3)n2)o1 ZINC000547496063 941065565 /nfs/dbraw/zinc/06/55/65/941065565.db2.gz ZAXCVVSMUIZWLS-UHFFFAOYSA-N 0 3 424.492 4.270 20 0 HIADHN CCCOc1ccc(CN(C)[C@@H](C)c2cccc(N3CCCS3(=O)=O)c2)cc1 ZINC000547660069 941070845 /nfs/dbraw/zinc/07/08/45/941070845.db2.gz QYGCBPVTFFSCPK-SFHVURJKSA-N 0 3 402.560 4.208 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@H]1CCOc2ccc(F)cc21)c1cccc(OC)c1 ZINC000547699805 941072543 /nfs/dbraw/zinc/07/25/43/941072543.db2.gz SVYZTXKSPWFIDK-LEWJYISDSA-N 0 3 415.509 4.040 20 0 HIADHN CCN(C(=O)Nc1ccc(-n2nc(C)cc2C)nc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000547786527 941075942 /nfs/dbraw/zinc/07/59/42/941075942.db2.gz VCWKLNDRIVIAJE-QFIPXVFZSA-N 0 3 418.545 4.012 20 0 HIADHN CC(C)N1CCN([C@H]2CCN(C(=O)C34CC5(C)CC(C)(CC(C)(C5)C3)C4)C2)CC1 ZINC000547803679 941076470 /nfs/dbraw/zinc/07/64/70/941076470.db2.gz GOZWUACNMXOTOF-IKFUGLRZSA-N 0 3 401.639 4.000 20 0 HIADHN Cc1ccnc2c1cccc2S(=O)(=O)N(C)[C@H]1CCN(Cc2ccccc2)[C@H](C)C1 ZINC000547966468 941081258 /nfs/dbraw/zinc/08/12/58/941081258.db2.gz PMTCHMYPWVGPMX-CTNGQTDRSA-N 0 3 423.582 4.217 20 0 HIADHN CCOc1ccc(NC(=O)[C@@H]2CCCN(Cc3cccnc3)C2)cc1Br ZINC000547989609 941082278 /nfs/dbraw/zinc/08/22/78/941082278.db2.gz LSVAMLVOYRKDNS-MRXNPFEDSA-N 0 3 418.335 4.094 20 0 HIADHN COc1ccc(-c2ccncc2)cc1CN[C@H](C)[C@H]1CN(Cc2ccccc2)CCO1 ZINC000548477335 941107212 /nfs/dbraw/zinc/10/72/12/941107212.db2.gz FHPNFNMWUULLLL-FQRUVTKNSA-N 0 3 417.553 4.136 20 0 HIADHN CC1(C(=O)Nc2ccc(Br)cc2[O-])CC[NH+](Cc2ccccc2)CC1 ZINC000548688783 941119620 /nfs/dbraw/zinc/11/96/20/941119620.db2.gz VGJOQISVMNVXCN-UHFFFAOYSA-N 0 3 403.320 4.396 20 0 HIADHN O=C(N[C@H]1CCOc2ccc(F)cc21)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000548706886 941120655 /nfs/dbraw/zinc/12/06/55/941120655.db2.gz VSJXPYPTXUHEJP-GHTZIAJQSA-N 0 3 422.422 4.220 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CCC2(CCO2)CC1)c1ccc(C(F)(F)F)cc1 ZINC000548901381 941128437 /nfs/dbraw/zinc/12/84/37/941128437.db2.gz BHMHZHDIYCITNT-SFHVURJKSA-N 0 3 413.484 4.053 20 0 HIADHN CCN1C(=O)CCc2cc(NC(=O)N[C@@H](CN(C)C)c3ccc(Cl)cc3)ccc21 ZINC000548977174 941137843 /nfs/dbraw/zinc/13/78/43/941137843.db2.gz QTFPYXXNMXKSGE-IBGZPJMESA-N 0 3 414.937 4.064 20 0 HIADHN Nc1nccc([C@@H]2CCCN(Cc3ccc(-c4ccc(Br)cc4)o3)C2)n1 ZINC000549164089 941167580 /nfs/dbraw/zinc/16/75/80/941167580.db2.gz CUKPZGKAZQUORH-OAHLLOKOSA-N 0 3 413.319 4.461 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)[C@H](C)c3ccc(C(=O)C(C)C)cc3)cc2)CC1 ZINC000549232041 941172695 /nfs/dbraw/zinc/17/26/95/941172695.db2.gz XYDMJIGKVLXKEU-HXUWFJFHSA-N 0 3 421.585 4.405 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)[C@@H](C)c2ccc(C(=O)C(C)C)cc2)c1 ZINC000549269204 941175624 /nfs/dbraw/zinc/17/56/24/941175624.db2.gz YUWWMFZXFCCCFT-IBGZPJMESA-N 0 3 410.558 4.228 20 0 HIADHN C[C@@H]1CCN(C(=O)Nc2ccc3nnc(C4CCC4)n3c2)CCN1Cc1ccccc1 ZINC000549283530 941176813 /nfs/dbraw/zinc/17/68/13/941176813.db2.gz NZKBXVQLEMHDNW-GOSISDBHSA-N 0 3 418.545 4.125 20 0 HIADHN COc1ccc(-c2ccc(C)c(NC(=O)NC[C@@H](c3ccccc3)N(C)C)c2)cn1 ZINC000549389963 941185360 /nfs/dbraw/zinc/18/53/60/941185360.db2.gz RJEIMIFAAVRGGY-QFIPXVFZSA-N 0 3 404.514 4.490 20 0 HIADHN CCNC(=O)c1cccc(NC(=O)CN[C@@H](c2cccc(C(F)(F)F)c2)C2CC2)c1 ZINC000549409531 941187213 /nfs/dbraw/zinc/18/72/13/941187213.db2.gz RZWSJNBKXJSHQR-HXUWFJFHSA-N 0 3 419.447 4.135 20 0 HIADHN CC(C)(CNCc1cc(Br)cc(Br)c1N)C(F)(F)F ZINC000549410131 941187296 /nfs/dbraw/zinc/18/72/96/941187296.db2.gz PFZBVQAZZPPNSB-UHFFFAOYSA-N 0 3 404.068 4.472 20 0 HIADHN CC(C)N1CC[C@H](N[C@@H](C)C(=O)Nc2ccc(Cl)cn2)[C@H]1c1ccc(F)c(F)c1 ZINC000549468440 941192878 /nfs/dbraw/zinc/19/28/78/941192878.db2.gz KSADBWQZIKCSPG-YHJVDBJQSA-N 0 3 422.907 4.154 20 0 HIADHN CN(C)C[C@@H](NC(=O)NCCc1nc(C(C)(C)C)cs1)c1ccc(Cl)cc1 ZINC000549469709 941193197 /nfs/dbraw/zinc/19/31/97/941193197.db2.gz WIOSWFWTMWQCDR-MRXNPFEDSA-N 0 3 408.999 4.239 20 0 HIADHN CC(C)N1CC[C@@H](N[C@@H](C)C(=O)Nc2c(F)cccc2F)[C@H]1c1ccc(F)c(F)c1 ZINC000549471639 941193322 /nfs/dbraw/zinc/19/33/22/941193322.db2.gz NMAIAYMXLRYPFN-DRWCTHJISA-N 0 3 423.454 4.384 20 0 HIADHN CCN1CC[C@H](N[C@@H](C)C(=O)Nc2ccccc2OC)[C@H]1c1ccc(Cl)c(F)c1 ZINC000549475162 941194259 /nfs/dbraw/zinc/19/42/59/941194259.db2.gz CNWFHGZGOJKUDD-ONTRVFCTSA-N 0 3 419.928 4.240 20 0 HIADHN COc1cccc([C@@H]2[C@@H](NCC(=O)Nc3ccccc3C(C)(C)C)CCN2C2CC2)c1 ZINC000549476953 941194538 /nfs/dbraw/zinc/19/45/38/941194538.db2.gz HEWGHNWQSHDKAO-UKILVPOCSA-N 0 3 421.585 4.499 20 0 HIADHN CCN1CC[C@H](N[C@H](C)C(=O)N(C)C2CCCCC2)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000549482088 941195201 /nfs/dbraw/zinc/19/52/01/941195201.db2.gz KWOFZBCGQLELQP-XWRIVVANSA-N 0 3 411.512 4.008 20 0 HIADHN COc1c2ccccc2oc1CNC(=O)N[C@H](CN(C)C)c1ccc(Cl)cc1 ZINC000549575527 941200056 /nfs/dbraw/zinc/20/00/56/941200056.db2.gz ADKZXRSIHBBBPH-QGZVFWFLSA-N 0 3 401.894 4.197 20 0 HIADHN Cc1nn(CC(C)C)c(C)c1CCC(=O)N[C@H](CN(C)C)c1ccc(Cl)cc1 ZINC000549615309 941201468 /nfs/dbraw/zinc/20/14/68/941201468.db2.gz CLPPWOYRJQWTLX-OAQYLSRUSA-N 0 3 404.986 4.161 20 0 HIADHN COc1cc2c(cc1F)CC[C@H]2NC(=O)N[C@@H](CN(C)C)c1ccc(Cl)cc1 ZINC000549624068 941201831 /nfs/dbraw/zinc/20/18/31/941201831.db2.gz FDIOULUTMLDAMP-MOPGFXCFSA-N 0 3 405.901 4.077 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@H](NCc2ccc(S(C)(=O)=O)c(Cl)c2)c2ccccc21 ZINC000549624376 941201878 /nfs/dbraw/zinc/20/18/78/941201878.db2.gz JAJDOTIXFDPZLD-MJGOQNOKSA-N 0 3 421.946 4.015 20 0 HIADHN Clc1cc(CNCc2coc3ccccc23)ccc1OCCN1CCOCC1 ZINC000549820446 941208523 /nfs/dbraw/zinc/20/85/23/941208523.db2.gz DAJSDRFWVGRUPT-UHFFFAOYSA-N 0 3 400.906 4.087 20 0 HIADHN COc1ccc(CN(Cc2cn(-c3ccncc3)nc2C)[C@@H](C)C2CC2)c(OC)c1 ZINC000549821457 941208571 /nfs/dbraw/zinc/20/85/71/941208571.db2.gz XAUXOXVWQIFHPJ-SFHVURJKSA-N 0 3 406.530 4.394 20 0 HIADHN COc1ccc([C@H](NC(=O)N(CCN(C)C)Cc2cccc(F)c2)C(C)C)cc1 ZINC000549920813 941238992 /nfs/dbraw/zinc/23/89/92/941238992.db2.gz ULVMPHLEDBLRKI-JOCHJYFZSA-N 0 3 401.526 4.305 20 0 HIADHN Clc1cccc(N2CCOCC2)c1CNCCc1nc(-c2ccccn2)cs1 ZINC000550156263 941290674 /nfs/dbraw/zinc/29/06/74/941290674.db2.gz PHXJMHOLGXDCHE-UHFFFAOYSA-N 0 3 414.962 4.027 20 0 HIADHN COc1cc(C(=O)Nc2cc(CN(C)C)ccc2C)cc(Br)c1OC ZINC000550290090 941310139 /nfs/dbraw/zinc/31/01/39/941310139.db2.gz ZGIMDIVZUHOKHL-UHFFFAOYSA-N 0 3 407.308 4.089 20 0 HIADHN CCS(=O)(=O)c1ccc([C@@H](C)N[C@H](C)c2ccc(NC(=O)NC3CC3)cc2)cc1 ZINC000550425726 941325017 /nfs/dbraw/zinc/32/50/17/941325017.db2.gz UFRXXOSADKOZEG-HZPDHXFCSA-N 0 3 415.559 4.176 20 0 HIADHN COC(=O)CCC[C@@H]1CCC[C@@H](N[C@@H](c2nc(-c3ccncc3)no2)C(C)C)C1 ZINC000550643667 941349000 /nfs/dbraw/zinc/34/90/00/941349000.db2.gz CISNPYREXHZXQU-ILZDJORESA-N 0 3 400.523 4.320 20 0 HIADHN COc1ccc(C2(C[NH2+][C@@H](c3cccs3)c3nnc[n-]3)CCCCC2)cc1OC ZINC000550665911 941351879 /nfs/dbraw/zinc/35/18/79/941351879.db2.gz RGKLDDCOBXCNFU-FQEVSTJZSA-N 0 3 412.559 4.465 20 0 HIADHN CC[C@H](N[C@@H]1CCCN([C@H](C)c2ccc(F)cc2)C1=O)c1ccc2c(c1)OCCO2 ZINC000550894645 941380409 /nfs/dbraw/zinc/38/04/09/941380409.db2.gz ISEPTJYIFMRJSD-TYCQWZJGSA-N 0 3 412.505 4.390 20 0 HIADHN CN(C(=O)C(C)(C)c1csc(-c2c(F)cccc2F)n1)[C@@H]1CCN(C2CC2)C1 ZINC000551015256 941395295 /nfs/dbraw/zinc/39/52/95/941395295.db2.gz VAWLOBFJOKOCJL-CQSZACIVSA-N 0 3 405.514 4.061 20 0 HIADHN COc1cccc(-c2nc(CN[C@@H]3CCN(C)[C@@H]3c3ccccc3)cs2)c1OC ZINC000551069872 941404335 /nfs/dbraw/zinc/40/43/35/941404335.db2.gz WMZDYNIYGSBCDX-TZIWHRDSSA-N 0 3 409.555 4.362 20 0 HIADHN O[C@H](CNCc1cnc(-c2ccc(Cl)cc2)s1)COc1ccc(F)c(F)c1 ZINC000551185876 941424569 /nfs/dbraw/zinc/42/45/69/941424569.db2.gz AKIGOBLULLEBHI-CQSZACIVSA-N 0 3 410.873 4.271 20 0 HIADHN COc1ccc2ccc(C(=O)NC3CCN(CCOc4ccc(F)cc4)CC3)cc2c1 ZINC000551326150 941452932 /nfs/dbraw/zinc/45/29/32/941452932.db2.gz UFMBZMSVVYLDII-UHFFFAOYSA-N 0 3 422.500 4.261 20 0 HIADHN COc1ncc([C@@H](C)NC[C@@H](O)COc2cccc(Cl)c2Cl)cc1Cl ZINC000551529992 941496016 /nfs/dbraw/zinc/49/60/16/941496016.db2.gz LFWJWIUDBMAMQN-ZYHUDNBSSA-N 0 3 405.709 4.141 20 0 HIADHN O=C(NC1CCCCC1)N1CCC(NCc2c(F)cccc2OC(F)(F)F)CC1 ZINC000551536448 941497166 /nfs/dbraw/zinc/49/71/66/941497166.db2.gz OOIYVIORYSRCIB-UHFFFAOYSA-N 0 3 417.447 4.321 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)c2cc(-c3ccccn3)ccc2Cl)cc1 ZINC000551537974 941497548 /nfs/dbraw/zinc/49/75/48/941497548.db2.gz DKPKHVHUTQMOIQ-JOCHJYFZSA-N 0 3 409.917 4.443 20 0 HIADHN CC(C)Oc1ccc([C@@H](C)NCc2ccc(N3CCN(C)CC3)nc2)cc1Cl ZINC000551537598 941497711 /nfs/dbraw/zinc/49/77/11/941497711.db2.gz AYKPFEIVJREZFU-QGZVFWFLSA-N 0 3 402.970 4.125 20 0 HIADHN C[C@]1(C2CC2)NC(=O)N(c2cccc(CNCc3csc4ccccc34)c2)C1=O ZINC000551584308 941506853 /nfs/dbraw/zinc/50/68/53/941506853.db2.gz ACOSJTLLHUTQAQ-HSZRJFAPSA-N 0 3 405.523 4.416 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCC(F)(c2cccnc2)CC1)c1ccsc1 ZINC000551617033 941513119 /nfs/dbraw/zinc/51/31/19/941513119.db2.gz KJJZFYZCBGYAQQ-LJQANCHMSA-N 0 3 404.555 4.196 20 0 HIADHN Cc1cc(NC(=O)[C@@H]2CCc3cccc(O)c32)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000551712616 941531645 /nfs/dbraw/zinc/53/16/45/941531645.db2.gz VKZVPHZCNVSEHO-LEWJYISDSA-N 0 3 416.525 4.013 20 0 HIADHN O=C(CCN1CCC(F)(c2cccnc2)CC1)Nc1cccc(Br)c1 ZINC000551747659 941538092 /nfs/dbraw/zinc/53/80/92/941538092.db2.gz DXHCTWOHRXXGDK-UHFFFAOYSA-N 0 3 406.299 4.134 20 0 HIADHN C[C@H](NCc1ccc(OC2CCCC2)cc1)c1cccc(N2CCCS2(=O)=O)c1 ZINC000551812576 941550405 /nfs/dbraw/zinc/55/04/05/941550405.db2.gz WEJABYZZDZVDQZ-SFHVURJKSA-N 0 3 414.571 4.399 20 0 HIADHN CN1CCN(c2ccncc2NC(=O)c2ccc(-c3cccc4cccnc43)cc2)CC1 ZINC000551935014 941562574 /nfs/dbraw/zinc/56/25/74/941562574.db2.gz XTWMWRQVSCZDNZ-UHFFFAOYSA-N 0 3 423.520 4.301 20 0 HIADHN Cc1cc([C@H](C)N[C@@H](CN2CCN(C)CC2)c2ccccc2)sc1Br ZINC000552013697 941568721 /nfs/dbraw/zinc/56/87/21/941568721.db2.gz QFTCDFCVUDDOOK-WMZOPIPTSA-N 0 3 422.436 4.458 20 0 HIADHN C[C@H](NC(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F)c1ccc(-n2cccn2)cc1 ZINC000552068911 941579199 /nfs/dbraw/zinc/57/91/99/941579199.db2.gz UFMRQAWKPWAISS-PGRDOPGGSA-N 0 3 424.495 4.207 20 0 HIADHN CNC(=O)COc1cccc(CN[C@H]2CCCc3nc(-c4ccccc4)sc32)c1 ZINC000552086437 941582189 /nfs/dbraw/zinc/58/21/89/941582189.db2.gz HDTIJGTXKZSAST-IBGZPJMESA-N 0 3 407.539 4.102 20 0 HIADHN FC(F)(F)C1(CN[C@H]2CCCOc3ccc(I)cc32)CC1 ZINC000552095936 941584147 /nfs/dbraw/zinc/58/41/47/941584147.db2.gz JUNZPCHAMLRKID-LBPRGKRZSA-N 0 3 411.205 4.437 20 0 HIADHN COc1ccccc1-c1ccc([C@H](C)NC[C@@H](N2CCOCC2)C(F)(F)F)cc1 ZINC000552097216 941584704 /nfs/dbraw/zinc/58/47/04/941584704.db2.gz WTNFIEUSKZYFRK-HRAATJIYSA-N 0 3 408.464 4.276 20 0 HIADHN COc1ccc(CNCCC(=O)Nc2cc(Cl)cc(Cl)c2)c(OC)c1OC ZINC000552129914 941590060 /nfs/dbraw/zinc/59/00/60/941590060.db2.gz RENJXYDBAZMFAD-UHFFFAOYSA-N 0 3 413.301 4.138 20 0 HIADHN Cc1ccc(-c2nc(C(=O)Nc3cccc(CN4CC[C@H](O)C4)c3)cs2)c(C)c1 ZINC000552200023 941600919 /nfs/dbraw/zinc/60/09/19/941600919.db2.gz RQTYETPGVBQJQQ-IBGZPJMESA-N 0 3 407.539 4.246 20 0 HIADHN CN(c1ccccc1)c1ccccc1C(=O)Nc1cccc(CN2CC[C@H](O)C2)c1 ZINC000552199970 941601293 /nfs/dbraw/zinc/60/12/93/941601293.db2.gz PPDZAJABENHCGS-QFIPXVFZSA-N 0 3 401.510 4.273 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)C1(Oc2ccc(Cl)cc2)CC1 ZINC000552219013 941606694 /nfs/dbraw/zinc/60/66/94/941606694.db2.gz DTYHMGIXXJPQHN-UHFFFAOYSA-N 0 3 416.871 4.173 20 0 HIADHN CO[C@@H]1C[C@H](c2ccccc2)CC[C@@H]1NCC(=O)Nc1ccccc1Br ZINC000552268109 941618191 /nfs/dbraw/zinc/61/81/91/941618191.db2.gz ABAGHLIKTBXEFW-LSTHTHJFSA-N 0 3 417.347 4.329 20 0 HIADHN Cc1ccc(NC(=O)C[C@@H](C)N[C@H](CC(=O)N(C)C)c2ccccc2)cc1Cl ZINC000552295627 941624853 /nfs/dbraw/zinc/62/48/53/941624853.db2.gz RNGDIXGXOZHEEC-OXQOHEQNSA-N 0 3 401.938 4.175 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3ccccc3N3CCCCC3)CC2)C[C@@H](C)O1 ZINC000552342003 941639116 /nfs/dbraw/zinc/63/91/16/941639116.db2.gz BQWDTMNBWCPVNQ-NHCUHLMSSA-N 0 3 413.606 4.028 20 0 HIADHN COCc1ccc([C@@H]2CCCN2C(=O)[C@@H]2CN(Cc3ccccc3)CCC2(F)F)o1 ZINC000552449064 941674985 /nfs/dbraw/zinc/67/49/85/941674985.db2.gz OMPCBDJLMZJURA-PMACEKPBSA-N 0 3 418.484 4.247 20 0 HIADHN CCc1ccc([C@H](NCC(=O)Nc2cc(C)nn2-c2nc(C)cc(C)n2)C(C)C)cc1 ZINC000552465554 941678667 /nfs/dbraw/zinc/67/86/67/941678667.db2.gz KWKURKZCBNQCSL-HSZRJFAPSA-N 0 3 420.561 4.075 20 0 HIADHN O=C(CCCOc1cccc(Cl)c1Cl)Nc1cccc(CN2CC[C@H](O)C2)c1 ZINC000552514398 941691118 /nfs/dbraw/zinc/69/11/18/941691118.db2.gz BLTVRIIUAWKGPH-KRWDZBQOSA-N 0 3 423.340 4.358 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)c1cn(CC(F)(F)F)nc1C)c1ccc(Cl)cc1 ZINC000552580491 941711382 /nfs/dbraw/zinc/71/13/82/941711382.db2.gz IQMAPALRBCIXQN-KRWDZBQOSA-N 0 3 416.875 4.220 20 0 HIADHN Cc1nsc(C)c1C(=O)N(Cc1ccccc1Br)C1CCN(C)CC1 ZINC000552747884 941751124 /nfs/dbraw/zinc/75/11/24/941751124.db2.gz ARSMPQPNKQHPED-UHFFFAOYSA-N 0 3 422.392 4.259 20 0 HIADHN CO[C@H](c1ccc(F)cc1)[C@@H](C)NC(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000552775705 941758618 /nfs/dbraw/zinc/75/86/18/941758618.db2.gz POLRVJVSAGWTPA-JPYJTQIMSA-N 0 3 413.537 4.208 20 0 HIADHN C[C@H](C(=O)N(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1)c1ccccn1 ZINC000552827762 941780032 /nfs/dbraw/zinc/78/00/32/941780032.db2.gz YIZHFJCDSAEVBL-URXFXBBRSA-N 0 3 414.553 4.274 20 0 HIADHN COc1ccc(CN(Cc2cc(=O)c(OC)co2)[C@@H]2CCCC[C@H]2C)cc1OC ZINC000552835460 941782345 /nfs/dbraw/zinc/78/23/45/941782345.db2.gz MPPOBVBGDWKWIF-VQIMIIECSA-N 0 3 401.503 4.247 20 0 HIADHN CCOc1ccc(CN(CCCn2ccnc2)Cc2cccc3c2OCCO3)cc1 ZINC000552858813 941789689 /nfs/dbraw/zinc/78/96/89/941789689.db2.gz MLRGJGAFXUVMMX-UHFFFAOYSA-N 0 3 407.514 4.146 20 0 HIADHN COc1ccc(C(=O)C[C@H](C)C(=O)N2CC[C@]3(CCN(Cc4ccccc4)C3)C2)cc1 ZINC000553176118 941845118 /nfs/dbraw/zinc/84/51/18/941845118.db2.gz RPWFNZXMXPRNBY-FNZWTVRRSA-N 0 3 420.553 4.029 20 0 HIADHN CCc1nc(-c2ccc(Cl)cc2)[nH]c1C(=O)N(C)CCCN(C)Cc1ccco1 ZINC000553403435 941879966 /nfs/dbraw/zinc/87/99/66/941879966.db2.gz MXDHICKSKBSVEF-UHFFFAOYSA-N 0 3 414.937 4.480 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)CCSc3cccc(Cl)c3)CC2)C[C@H](C)O1 ZINC000553409523 941880493 /nfs/dbraw/zinc/88/04/93/941880493.db2.gz CAOOINHXFQWDMB-IRXDYDNUSA-N 0 3 411.011 4.170 20 0 HIADHN C[C@@H](Sc1ccc(Br)cc1)C(=O)N1CCN(C2CCC2)C[C@H](C)C1 ZINC000553525747 941903089 /nfs/dbraw/zinc/90/30/89/941903089.db2.gz IKGIWYOPLGVXNM-LSDHHAIUSA-N 0 3 411.409 4.263 20 0 HIADHN COc1ccc(C(=O)CC(C)(C)CC(=O)N2CCN(C3CCC3)C[C@@H](C)C2)cc1 ZINC000553528505 941903689 /nfs/dbraw/zinc/90/36/89/941903689.db2.gz POTCHVGBQDKYAZ-GOSISDBHSA-N 0 3 400.563 4.017 20 0 HIADHN Cc1noc(C)c1CCC(=O)N1CCN(CCCc2ccccc2)C[C@H]1CC(C)C ZINC000553546796 941906445 /nfs/dbraw/zinc/90/64/45/941906445.db2.gz NNOVLBFIJZJJLS-HSZRJFAPSA-N 0 3 411.590 4.416 20 0 HIADHN COc1ccc([C@H](CNC(=O)[C@@H](C)Cc2cncc3ccccc32)N2CCCC2)cc1 ZINC000553626273 941924685 /nfs/dbraw/zinc/92/46/85/941924685.db2.gz VNLXHXGJWCEVRZ-DFBJGRDBSA-N 0 3 417.553 4.375 20 0 HIADHN CC[C@@H](C)Oc1cccc(NC(=O)N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)c1 ZINC000553654347 941935406 /nfs/dbraw/zinc/93/54/06/941935406.db2.gz KJAFCPJAHCRYRC-QRVBRYPASA-N 0 3 403.567 4.217 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)c2cccc(NC(=O)[C@H]3C[C@H]3C)c2)N(C)C)cc1 ZINC000553671053 941941284 /nfs/dbraw/zinc/94/12/84/941941284.db2.gz RPHMFNLWMMQBIW-VSDWSMLSSA-N 0 3 423.557 4.101 20 0 HIADHN C[C@@H]1C[C@H]1N1CCN(C(=O)c2cc(NC(=O)NC(C)(C)C)ccc2Cl)C[C@@H](C)C1 ZINC000553767781 941963258 /nfs/dbraw/zinc/96/32/58/941963258.db2.gz JYARFPZWTDGSRN-QMTMVMCOSA-N 0 3 420.985 4.062 20 0 HIADHN CC1CCN(Cc2ccccc2CNS(=O)(=O)c2ccc(C(F)F)cc2)CC1 ZINC000553784824 941968395 /nfs/dbraw/zinc/96/83/95/941968395.db2.gz POKVZZVHLSGSDW-UHFFFAOYSA-N 0 3 408.514 4.335 20 0 HIADHN CCCN(C)[C@H](CNC(=O)N[C@@H](C)c1nc(C(C)(C)C)no1)c1ccc(Cl)cc1 ZINC000553797029 941971582 /nfs/dbraw/zinc/97/15/82/941971582.db2.gz DUIFVFAILRGSHC-WMLDXEAASA-N 0 3 421.973 4.464 20 0 HIADHN CCc1nc2cc(CNC(=O)N(C)CCCN(C)Cc3ccco3)ccc2n1C1CC1 ZINC000553817507 941975685 /nfs/dbraw/zinc/97/56/85/941975685.db2.gz YMUGJTIYJNWNFM-UHFFFAOYSA-N 0 3 423.561 4.190 20 0 HIADHN Cc1c2cccc(Br)c2oc1C(=O)N1CCN(C2CCC2)C[C@H](C)C1 ZINC000553865190 941986780 /nfs/dbraw/zinc/98/67/80/941986780.db2.gz IAIGEXNWYHINNN-ZDUSSCGKSA-N 0 3 405.336 4.450 20 0 HIADHN CCCN(C)[C@H](CNC(=O)N1CCC2(CC(OCC)C2)C1)c1ccc(Cl)cc1 ZINC000553893135 941991973 /nfs/dbraw/zinc/99/19/73/941991973.db2.gz DVJINNHIUPHHOT-SNCIUUNGSA-N 0 3 407.986 4.324 20 0 HIADHN CCCN(C)[C@H](CNC(=O)N1CCC[C@@H]([C@H]2CCOC2)C1)c1ccc(Cl)cc1 ZINC000553895036 941992721 /nfs/dbraw/zinc/99/27/21/941992721.db2.gz LHTLHBQGYIFAQV-SVFBPWRDSA-N 0 3 407.986 4.181 20 0 HIADHN OCC[C@@H](NC[C@H](O)COc1ccc(Cl)cc1Cl)c1ccc(Cl)cc1 ZINC000553944187 942004399 /nfs/dbraw/zinc/00/43/99/942004399.db2.gz PUHNTQQRBNPQSX-DOTOQJQBSA-N 0 3 404.721 4.100 20 0 HIADHN CC[C@@H](CNC(=O)[C@H](C)Cc1cncc2ccccc21)N1CCc2ccccc2C1 ZINC000553964011 942008596 /nfs/dbraw/zinc/00/85/96/942008596.db2.gz OGRJSWIKALFYRF-DVECYGJZSA-N 0 3 401.554 4.367 20 0 HIADHN Cc1cc(C(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)c2cnn(C(C)C)c2n1 ZINC000554017509 942020519 /nfs/dbraw/zinc/02/05/19/942020519.db2.gz YSQUUUCQSGTIBB-QFIPXVFZSA-N 0 3 423.561 4.141 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)c2ccc([C@@H]3CCCOC3)cc2)N(C)C)cc1 ZINC000554040392 942023963 /nfs/dbraw/zinc/02/39/63/942023963.db2.gz NKCDPASYWCXWGF-ISKFKSNPSA-N 0 3 410.558 4.401 20 0 HIADHN C[C@@H](NC1CCN(C(=O)c2ccccc2Cl)CC1)c1nccn1-c1ccccc1 ZINC000554087439 942033876 /nfs/dbraw/zinc/03/38/76/942033876.db2.gz BUVZFZVBSNYSLO-QGZVFWFLSA-N 0 3 408.933 4.481 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)Nc1cccc(C(=O)NC(C)(C)C)c1)c1ccco1 ZINC000554133390 942045797 /nfs/dbraw/zinc/04/57/97/942045797.db2.gz WAXMFVFJHVCYQA-QAPCUYQASA-N 0 3 400.523 4.059 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1ccc(C(=O)NC(C)(C)C)cc1)c1ccco1 ZINC000554135413 942046385 /nfs/dbraw/zinc/04/63/85/942046385.db2.gz KKXBXAGQUZUMFJ-YJBOKZPZSA-N 0 3 400.523 4.059 20 0 HIADHN CC[C@@H](C)NC(=O)c1ccc(NC(=O)N[C@@H](CN(C)C)c2ccc(F)cc2)c(C)c1 ZINC000554162331 942052913 /nfs/dbraw/zinc/05/29/13/942052913.db2.gz QSQDDRCCERHOEK-IERDGZPVSA-N 0 3 414.525 4.087 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1ccc(C(=O)NCC(C)C)cc1C)c1ccco1 ZINC000554182093 942060568 /nfs/dbraw/zinc/06/05/68/942060568.db2.gz OGRASFAPIFTGCS-PXNSSMCTSA-N 0 3 414.550 4.225 20 0 HIADHN FC(F)(F)COc1ccc(CN2CCC[C@@H](c3nc(-c4ccccc4)n[nH]3)C2)cn1 ZINC000554200082 942064871 /nfs/dbraw/zinc/06/48/71/942064871.db2.gz RFOOAHYFFBOAEX-QGZVFWFLSA-N 0 3 417.435 4.187 20 0 HIADHN CN(C)[C@H](CNC(=O)N[C@@H](CCO)c1ccc(Cl)c(Cl)c1)c1ccccc1 ZINC000554216607 942070695 /nfs/dbraw/zinc/07/06/95/942070695.db2.gz LBSHMBCIBXDWIF-RBUKOAKNSA-N 0 3 410.345 4.019 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)Nc1ccc(OCC2CCOCC2)cc1 ZINC000554256620 942081278 /nfs/dbraw/zinc/08/12/78/942081278.db2.gz OKMVOTPZFFIGKR-UHFFFAOYSA-N 0 3 403.567 4.222 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)Nc2ccc(N3CCCC3=O)cc2)N(C)C)cc1 ZINC000554385829 942121718 /nfs/dbraw/zinc/12/17/18/942121718.db2.gz LGHSWHAEFHJQIJ-QFIPXVFZSA-N 0 3 424.545 4.025 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)Nc1ccc(Oc2ncccn2)cc1C)c1ccco1 ZINC000554413829 942132901 /nfs/dbraw/zinc/13/29/01/942132901.db2.gz AXANFJBUWOVZMD-APWZRJJASA-N 0 3 409.490 4.421 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)Nc1cc2c(cc1SC)OCCO2)c1ccco1 ZINC000554421966 942136434 /nfs/dbraw/zinc/13/64/34/942136434.db2.gz FNIRERWBEBTOKB-HIFRSBDPSA-N 0 3 405.520 4.024 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)Nc1ccccc1OC[C@@H]1CCCCO1 ZINC000554426158 942138843 /nfs/dbraw/zinc/13/88/43/942138843.db2.gz GYFNYLIADPFARE-FQEVSTJZSA-N 0 3 403.567 4.364 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1ccc(N2CCSCC2)cc1C)c1ccco1 ZINC000554428744 942140411 /nfs/dbraw/zinc/14/04/11/942140411.db2.gz ZWVNWRMSFYYUKL-FXAWDEMLSA-N 0 3 416.591 4.392 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N2C[C@H](c3ccccc3)[C@H]3COCC[C@@H]32)N(C)C)cc1 ZINC000554451517 942148512 /nfs/dbraw/zinc/14/85/12/942148512.db2.gz ZTAANGHWDCDAEC-NGSHPTGOSA-N 0 3 421.585 4.066 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)N[C@@H](c2ccc(Cl)cc2)C2CC2)cc1 ZINC000554468324 942153826 /nfs/dbraw/zinc/15/38/26/942153826.db2.gz NKQDAKAWRAMKNI-LEWJYISDSA-N 0 3 401.938 4.402 20 0 HIADHN Cc1nc(-c2ccc(C(=O)NC[C@@H](c3ccc(CC(C)C)cc3)N(C)C)cc2)n[nH]1 ZINC000554663916 942192882 /nfs/dbraw/zinc/19/28/82/942192882.db2.gz OVCFSDKEBYOQNI-QFIPXVFZSA-N 0 3 405.546 4.011 20 0 HIADHN COC(=O)Cc1csc(NC(=O)CN[C@@H](c2ccc(C(C)(C)C)cc2)C(C)C)n1 ZINC000554855991 942291705 /nfs/dbraw/zinc/29/17/05/942291705.db2.gz XLAFSCQMKQJYMU-HXUWFJFHSA-N 0 3 417.575 4.082 20 0 HIADHN C/C=C\c1ccc(OC[C@H](O)CNCc2ccc(F)cc2C(F)(F)F)c(OC)c1 ZINC000554863369 942297109 /nfs/dbraw/zinc/29/71/09/942297109.db2.gz RCXCRNYPPBTOMG-CWIOURORSA-N 0 3 413.411 4.416 20 0 HIADHN CN(C)C[C@@H](NC(=O)Nc1cccc(OC[C@@H]2CCCO2)c1)c1ccc(Cl)cc1 ZINC000554871291 942301973 /nfs/dbraw/zinc/30/19/73/942301973.db2.gz RIPDLLZTVDZXOM-LEWJYISDSA-N 0 3 417.937 4.322 20 0 HIADHN C/C(=C\c1ccccc1C(F)(F)F)CN1CCC(C(=O)Nc2nncs2)CC1 ZINC000554880523 942305756 /nfs/dbraw/zinc/30/57/56/942305756.db2.gz IWARNDKHEFSZOH-JLHYYAGUSA-N 0 3 410.465 4.311 20 0 HIADHN Cc1n[nH]c(C)c1[C@@H]1CCCCCN1Cc1ccccc1OCC(=O)N1CCCC1 ZINC000554878652 942305910 /nfs/dbraw/zinc/30/59/10/942305910.db2.gz CPHQPAQUIFPWBM-NRFANRHFSA-N 0 3 410.562 4.145 20 0 HIADHN CC(C)[C@H](NC(=O)CN[C@H]1c2ccccc2CC12CCOCC2)c1ccc(F)cc1 ZINC000554972581 942338449 /nfs/dbraw/zinc/33/84/49/942338449.db2.gz LHEDFBKIFXQTCJ-ZEQRLZLVSA-N 0 3 410.533 4.323 20 0 HIADHN Clc1cccc([C@@H](Cc2cccnc2)NCc2ccc(Cn3cncn3)cc2)c1 ZINC000555000134 942349539 /nfs/dbraw/zinc/34/95/39/942349539.db2.gz KSXDLOYWKGLTDI-HSZRJFAPSA-N 0 3 403.917 4.448 20 0 HIADHN NS(=O)(=O)c1ccc2c(c1)[C@@H](N[C@@H](c1cccc(C(F)(F)F)c1)C1CC1)CCC2 ZINC000555002729 942351113 /nfs/dbraw/zinc/35/11/13/942351113.db2.gz LFIKOQJTJCYOSH-VQTJNVASSA-N 0 3 424.488 4.471 20 0 HIADHN C[C@@H](NC[C@H](Cc1ccccc1)C(F)(F)F)c1cccc(NS(C)(=O)=O)c1 ZINC000555002973 942351424 /nfs/dbraw/zinc/35/14/24/942351424.db2.gz LNDGUPGNPNHOFN-PBHICJAKSA-N 0 3 400.466 4.130 20 0 HIADHN CC(C)N1CC[C@H](NCc2cn(C)nc2C(F)F)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000555004679 942351773 /nfs/dbraw/zinc/35/17/73/942351773.db2.gz QKFZVILWVMQCEG-WMZOPIPTSA-N 0 3 400.876 4.464 20 0 HIADHN CCSc1nccnc1-c1noc([C@@H]2CN(Cc3ccccc3)CCC2(F)F)n1 ZINC000555019119 942358602 /nfs/dbraw/zinc/35/86/02/942358602.db2.gz GBRYSAFIGPITKE-HNNXBMFYSA-N 0 3 417.485 4.263 20 0 HIADHN COc1cccc(CNC(=O)[C@H](C)N[C@@H](c2cccc(C(F)(F)F)c2)C2CC2)c1 ZINC000555078298 942379581 /nfs/dbraw/zinc/37/95/81/942379581.db2.gz MCGRLYOWLCDCPS-VBKZILBWSA-N 0 3 406.448 4.460 20 0 HIADHN Fc1cccc(CN2CCC[C@H](c3nc(Cc4ccc(-n5cccn5)cc4)no3)C2)c1 ZINC000555086801 942381847 /nfs/dbraw/zinc/38/18/47/942381847.db2.gz GAYYPJJVIPYFSJ-FQEVSTJZSA-N 0 3 417.488 4.365 20 0 HIADHN CN1CCC(N(Cc2ccccc2Br)C(=O)NC2CCCCC2)CC1 ZINC000555119970 942390673 /nfs/dbraw/zinc/39/06/73/942390673.db2.gz VCDPOQBRJDMBSS-UHFFFAOYSA-N 0 3 408.384 4.388 20 0 HIADHN CC[C@@H]1CCCCN1C(=O)[C@H](C)N[C@H]1CCN(CC)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000555125943 942392808 /nfs/dbraw/zinc/39/28/08/942392808.db2.gz SCBKMVDVROMGJQ-RRTIHBJFSA-N 0 3 411.512 4.008 20 0 HIADHN CCOC(=O)[C@H]1CC[C@H](NCc2ccc(OCC(F)(F)F)nc2)c2ccccc21 ZINC000555165282 942412373 /nfs/dbraw/zinc/41/23/73/942412373.db2.gz PRNATXUNRYPAFG-ROUUACIJSA-N 0 3 408.420 4.294 20 0 HIADHN Cc1ccc(C)n1-c1nc(CC(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)cs1 ZINC000555230007 942437901 /nfs/dbraw/zinc/43/79/01/942437901.db2.gz IDTGRDGREOTCHR-IBGZPJMESA-N 0 3 416.978 4.166 20 0 HIADHN Cc1oc(-c2cccs2)nc1CC(=O)N[C@H](CN(C)C)c1ccc(Cl)cc1 ZINC000555230800 942438827 /nfs/dbraw/zinc/43/88/27/942438827.db2.gz PRPCLNVIIOOEGG-QGZVFWFLSA-N 0 3 403.935 4.327 20 0 HIADHN CN(C)C[C@H](NC(=O)c1ccc(NC(=O)N(C)C)cc1Cl)c1ccc(Cl)cc1 ZINC000555231133 942438908 /nfs/dbraw/zinc/43/89/08/942438908.db2.gz VCXKXKMRAUMANZ-SFHVURJKSA-N 0 3 423.344 4.120 20 0 HIADHN O[C@H](CNCc1ccc(Oc2cccnc2)c(F)c1)COc1cccc2[nH]ccc21 ZINC000555331262 942479630 /nfs/dbraw/zinc/47/96/30/942479630.db2.gz ZDBXFEVAOGTZHV-QGZVFWFLSA-N 0 3 407.445 4.024 20 0 HIADHN Cc1nn(-c2ccccn2)c(C)c1CNc1cccc(CN2CCSCC2)c1C ZINC000555340329 942485077 /nfs/dbraw/zinc/48/50/77/942485077.db2.gz BNYJBBROFZITMI-UHFFFAOYSA-N 0 3 407.587 4.353 20 0 HIADHN COc1ccc(CN(Cc2ccc(-n3cncn3)cc2)C2CC2)cc1OC(F)F ZINC000555365610 942496992 /nfs/dbraw/zinc/49/69/92/942496992.db2.gz LQZSUNUDVFQXDQ-UHFFFAOYSA-N 0 3 400.429 4.042 20 0 HIADHN CCO[C@@H]1C[C@H](NCc2ccc(Br)cc2C(F)(F)F)[C@@H]1n1cccn1 ZINC000555647451 942685933 /nfs/dbraw/zinc/68/59/33/942685933.db2.gz CCGVCJOTWIASDL-XHSDSOJGSA-N 0 3 418.257 4.173 20 0 HIADHN Cc1ccc2nc(CN3CCC(c4ccc(OC(F)(F)F)cc4)CC3)cc(=O)n2c1 ZINC000555728424 942714447 /nfs/dbraw/zinc/71/44/47/942714447.db2.gz OQXDVSGDIFYZBQ-UHFFFAOYSA-N 0 3 417.431 4.281 20 0 HIADHN CC[C@@H](CNC(=O)N1CCC(OC2CCCCC2)CC1)N1CCc2ccccc2C1 ZINC000555738388 942718066 /nfs/dbraw/zinc/71/80/66/942718066.db2.gz IDWWYESAPYLBSV-QFIPXVFZSA-N 0 3 413.606 4.347 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)[C@@H]1CCc2cccc(O)c21 ZINC000555789387 942733387 /nfs/dbraw/zinc/73/33/87/942733387.db2.gz NJYPALBBLQKBMQ-GOSISDBHSA-N 0 3 406.448 4.031 20 0 HIADHN Fc1ccc([C@H](NCC2(c3ccc4c(c3)OCO4)CCCCC2)c2nnc[nH]2)cc1 ZINC000556061167 942799718 /nfs/dbraw/zinc/79/97/18/942799718.db2.gz RXUGARLDQGOYCA-NRFANRHFSA-N 0 3 408.477 4.254 20 0 HIADHN CS(=O)(=O)C[C@H](NCc1ccc(Oc2ccc(C(F)(F)F)cc2)cc1)C1CC1 ZINC000556077273 942802060 /nfs/dbraw/zinc/80/20/60/942802060.db2.gz VCVSYAIMYWJRKV-IBGZPJMESA-N 0 3 413.461 4.411 20 0 HIADHN CS(=O)(=O)[C@@H]1CCC[C@@H](N[C@H](c2ccccc2)c2ccc(Br)cc2)C1 ZINC000556263948 942827941 /nfs/dbraw/zinc/82/79/41/942827941.db2.gz IGXXNIFUKUGDNC-VAMGGRTRSA-N 0 3 422.388 4.484 20 0 HIADHN Cc1ccc(C)c(Sc2ccc(NC(=O)CN[C@H]3CCC(=O)N[C@H]3C3CC3)cc2)c1 ZINC000556523048 942891121 /nfs/dbraw/zinc/89/11/21/942891121.db2.gz SZKSBJSVDOBQGN-RDPSFJRHSA-N 0 3 423.582 4.040 20 0 HIADHN COC(=O)[C@H](Cc1ccccc1)[C@H](C)N[C@H](C)C(=O)Nc1cccc(Cl)c1Cl ZINC000556522605 942891337 /nfs/dbraw/zinc/89/13/37/942891337.db2.gz KFHNOSVEMCUKOV-SQWLQELKSA-N 0 3 423.340 4.330 20 0 HIADHN C[C@@H](NC[C@@H]1CN(Cc2ccccc2)CCCO1)c1nc2ccccc2n1C(F)F ZINC000556532225 942893126 /nfs/dbraw/zinc/89/31/26/942893126.db2.gz OPCHLJBNVCBVGV-IEBWSBKVSA-N 0 3 414.500 4.373 20 0 HIADHN CC(C)Oc1ccc([C@H](C)N[C@@H]2CCCN(Cc3ccccn3)C2=O)cc1Cl ZINC000556572890 942902796 /nfs/dbraw/zinc/90/27/96/942902796.db2.gz ITCLTFGKGRUBBM-OXJNMPFZSA-N 0 3 401.938 4.364 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)c2ccc(OC)c(OC3CCCC3)c2)cc1 ZINC000556588260 942908019 /nfs/dbraw/zinc/90/80/19/942908019.db2.gz ADHSGCQKFMFKHD-NRFANRHFSA-N 0 3 412.530 4.058 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)c2cc(C3CC3)nc3onc(C(C)C)c32)cc1 ZINC000556590142 942908395 /nfs/dbraw/zinc/90/83/95/942908395.db2.gz ZKMPIRRJBOEDRB-FQEVSTJZSA-N 0 3 422.529 4.265 20 0 HIADHN Cc1nc(CCN(C)Cc2cn(-c3ccc(C)cc3)nc2-c2ccc(F)cc2)no1 ZINC000556599608 942911299 /nfs/dbraw/zinc/91/12/99/942911299.db2.gz ZCXCBJIARQLKFO-UHFFFAOYSA-N 0 3 405.477 4.353 20 0 HIADHN Cc1sc(-c2ccco2)nc1C(=O)N1CCN(c2ccnc3ccccc32)CC1 ZINC000556833014 942937603 /nfs/dbraw/zinc/93/76/03/942937603.db2.gz PVCBHGVKCBAXIP-UHFFFAOYSA-N 0 3 404.495 4.222 20 0 HIADHN CC[C@H](NCc1cccc(C(=O)N2CCOCC2)c1)c1ccc(OC(F)(F)F)cc1 ZINC000556870988 942945681 /nfs/dbraw/zinc/94/56/81/942945681.db2.gz HUSKDSCBACDFOI-FQEVSTJZSA-N 0 3 422.447 4.299 20 0 HIADHN C[C@H](NC(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F)c1cccc(-n2cccn2)c1 ZINC000556892558 942954118 /nfs/dbraw/zinc/95/41/18/942954118.db2.gz KQEWGPOZTKPHQV-AVRDEDQJSA-N 0 3 424.495 4.207 20 0 HIADHN CCOc1cc(C[NH2+]C[C@H](C)COCc2ccccc2)cc(Br)c1[O-] ZINC000556893049 942954151 /nfs/dbraw/zinc/95/41/51/942954151.db2.gz OFLSMBYDIFKMQR-HNNXBMFYSA-N 0 3 408.336 4.496 20 0 HIADHN CCN(CC)C(=O)Nc1ccc([C@H](C)NCc2ccc(C[S@@](C)=O)cc2)cc1 ZINC000556897922 942957745 /nfs/dbraw/zinc/95/77/45/942957745.db2.gz CWGWRMXNPPWCJN-YMGMXPECSA-N 0 3 401.576 4.290 20 0 HIADHN CNC(=O)COc1cccc(CN[C@H]2CC(C)(C)c3ccc(Br)cc32)c1 ZINC000556898927 942957785 /nfs/dbraw/zinc/95/77/85/942957785.db2.gz PXTVSEYFWICRIV-IBGZPJMESA-N 0 3 417.347 4.086 20 0 HIADHN Brc1cccc([C@@H](NCc2cnn3ccccc23)C2CCOCC2)c1 ZINC000556910730 942961355 /nfs/dbraw/zinc/96/13/55/942961355.db2.gz DZWPFMBTWXJAEU-FQEVSTJZSA-N 0 3 400.320 4.354 20 0 HIADHN Cc1cc2cc(CN[C@H](CN3CCC(C(N)=O)CC3)c3ccc(Cl)cc3)ccc2[nH]1 ZINC000556913265 942963255 /nfs/dbraw/zinc/96/32/55/942963255.db2.gz RWTJESZENNJAHV-HSZRJFAPSA-N 0 3 424.976 4.158 20 0 HIADHN CC1(C)C[C@@H](NCC2(S(C)(=O)=O)CCCC2)c2cc(Br)ccc21 ZINC000556921171 942966426 /nfs/dbraw/zinc/96/64/26/942966426.db2.gz SSCDIJHMVBLYTG-MRXNPFEDSA-N 0 3 400.382 4.119 20 0 HIADHN O=C(NCc1ncoc1-c1ccccc1)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000556925426 942969345 /nfs/dbraw/zinc/96/93/45/942969345.db2.gz XKOMJXOCJZFPPR-IBGZPJMESA-N 0 3 411.452 4.115 20 0 HIADHN Cc1cc(NC(=O)c2nc(C3CC3)oc2C)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000556939274 942974837 /nfs/dbraw/zinc/97/48/37/942974837.db2.gz GOOOYMTVESMUTK-LJQANCHMSA-N 0 3 405.502 4.065 20 0 HIADHN Cc1nn(-c2ccc(Br)cc2)cc1CN1CC2(CCOCC2)[C@@H]1C1CC1 ZINC000556950359 942977579 /nfs/dbraw/zinc/97/75/79/942977579.db2.gz VCNPNQRQMDSYFI-FQEVSTJZSA-N 0 3 416.363 4.334 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3CCC(Cc4cccnc4)CC3)c(C)c2)CC1 ZINC000557097100 943019175 /nfs/dbraw/zinc/01/91/75/943019175.db2.gz IOIVPKVSZLVPML-UHFFFAOYSA-N 0 3 421.589 4.019 20 0 HIADHN COc1ccc2c(c1)OC[C@H](N[C@H](C)c1ccc(S(=O)(=O)C3CCCC3)cc1)C2 ZINC000557266447 943064066 /nfs/dbraw/zinc/06/40/66/943064066.db2.gz RCGNIGAHQGSPKC-VQIMIIECSA-N 0 3 415.555 4.066 20 0 HIADHN CCNC(=O)COc1cccc(CN[C@H](C)c2sc(-c3ccccc3)nc2C)c1 ZINC000557277373 943064701 /nfs/dbraw/zinc/06/47/01/943064701.db2.gz LQLQVOMUCICDEW-MRXNPFEDSA-N 0 3 409.555 4.484 20 0 HIADHN C[C@@H]1C[C@@H]1[C@H](NCC(=O)Nc1cccc(C(=O)NC2CC2)c1)c1ccc(Cl)cc1 ZINC000557710279 943265032 /nfs/dbraw/zinc/26/50/32/943265032.db2.gz UIKKZEWEZMGHID-VQUVXCFPSA-N 0 3 411.933 4.158 20 0 HIADHN O[C@H](CNCc1cn(-c2ccccc2)nc1-c1cccc(Br)c1)C(F)F ZINC000557838438 943309373 /nfs/dbraw/zinc/30/93/73/943309373.db2.gz JTRLNCMQARFKEZ-QGZVFWFLSA-N 0 3 422.273 4.017 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)c1sc(C)c(Br)c1OC)c1ccco1 ZINC000557911272 943326662 /nfs/dbraw/zinc/32/66/62/943326662.db2.gz DHCKKLVQKMGUBH-CMPLNLGQSA-N 0 3 415.353 4.280 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)[C@@H]2C[C@H]2c2cccc(F)c2F)N(C)C)cc1 ZINC000557934191 943333229 /nfs/dbraw/zinc/33/32/29/943333229.db2.gz DDFZRBOKQCIFQY-ZVDOUQERSA-N 0 3 402.485 4.275 20 0 HIADHN CSc1ccc2ncnc(N3CCC(CCN4C[C@H](C)O[C@@H](C)C4)CC3)c2c1 ZINC000558017573 943357316 /nfs/dbraw/zinc/35/73/16/943357316.db2.gz ZQYDUPMVBZVXND-IRXDYDNUSA-N 0 3 400.592 4.067 20 0 HIADHN COc1cc(CN[C@H](C)c2cccc(-n3ccnn3)c2)ccc1OCC(F)(F)F ZINC000558220468 943441232 /nfs/dbraw/zinc/44/12/32/943441232.db2.gz PNNQAIKSCGQMDT-CQSZACIVSA-N 0 3 406.408 4.068 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)Nc2nc(C(F)(F)F)cs2)N(C)C)cc1 ZINC000558241694 943453382 /nfs/dbraw/zinc/45/33/82/943453382.db2.gz RATOLBUCAKVOSU-AWEZNQCLSA-N 0 3 416.469 4.374 20 0 HIADHN C[C@@H](N[C@@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O)c1cccc(-n2ccnn2)c1 ZINC000558260061 943464632 /nfs/dbraw/zinc/46/46/32/943464632.db2.gz XEMOOASYUANYKI-BFUOFWGJSA-N 0 3 416.312 4.030 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)Nc1cc(N2CCCC2=O)ccc1Cl)c1ccco1 ZINC000558268758 943470025 /nfs/dbraw/zinc/47/00/25/943470025.db2.gz UDLSQTWNJHIAFF-RDTXWAMCSA-N 0 3 418.925 4.311 20 0 HIADHN COC(=O)COc1ccccc1[C@@H](C)N[C@H]1CCc2c1cccc2Br ZINC000558342677 943518435 /nfs/dbraw/zinc/51/84/35/943518435.db2.gz QULHEXXUXCEWQQ-ACJLOTCBSA-N 0 3 404.304 4.339 20 0 HIADHN Cc1ccc(NC(=O)N[C@@H](CN(C)C)c2ccc(F)cc2)c(-c2nc(C3CC3)no2)c1 ZINC000558351529 943521851 /nfs/dbraw/zinc/52/18/51/943521851.db2.gz DJUHOXBMNHCUBT-FQEVSTJZSA-N 0 3 423.492 4.486 20 0 HIADHN CN(C)Cc1cccc(NC(=O)NCCc2c[nH]c3cccc(Br)c23)c1 ZINC000558447550 943561065 /nfs/dbraw/zinc/56/10/65/943561065.db2.gz OAOAYWKYTLMENC-UHFFFAOYSA-N 0 3 415.335 4.356 20 0 HIADHN CN1CC[C@H](NCC(=O)Nc2ccccc2C(F)(F)F)[C@H]1c1ccc(Cl)cc1 ZINC000558467132 943567448 /nfs/dbraw/zinc/56/74/48/943567448.db2.gz OFFDPHZGRLSFMT-PKOBYXMFSA-N 0 3 411.855 4.332 20 0 HIADHN CC1CCN(CCNC(=O)C(C)(C)c2csc(-c3cc(F)ccc3F)n2)CC1 ZINC000558483914 943572006 /nfs/dbraw/zinc/57/20/06/943572006.db2.gz MAIDJFCYFJIZCY-UHFFFAOYSA-N 0 3 407.530 4.214 20 0 HIADHN CNS(=O)(=O)c1ccc([C@H](C)N[C@@H](Cc2ccccc2)c2ccc(OC)cc2)cc1 ZINC000558505690 943579229 /nfs/dbraw/zinc/57/92/29/943579229.db2.gz NKQJGHUVIAWETR-UUOWRZLLSA-N 0 3 424.566 4.238 20 0 HIADHN COc1cc(Br)c(CN2CCCC[C@@H]2[C@@H]2CCCC[C@@H]2O)cc1OC ZINC000558658309 943625040 /nfs/dbraw/zinc/62/50/40/943625040.db2.gz CFBKMXWLFIDFHV-JQHSSLGASA-N 0 3 412.368 4.372 20 0 HIADHN Cc1ccc(-c2cncc(F)c2)cc1NC(=O)CCN1CCN(c2ccccc2)CC1 ZINC000558730006 943633780 /nfs/dbraw/zinc/63/37/80/943633780.db2.gz OUQOHTFBVPCZAU-UHFFFAOYSA-N 0 3 418.516 4.347 20 0 HIADHN O=C(CN1[C@@H]2CC[C@H]1C[C@@H](c1ccccc1)C2)NC[C@H]1CCN(c2ccccc2)C1 ZINC000558734791 943635249 /nfs/dbraw/zinc/63/52/49/943635249.db2.gz TXNRVHRTGMOEFC-CEYBMKEASA-N 0 3 403.570 4.040 20 0 HIADHN c1ccc(CN2C[C@@H](c3ccccc3)[C@H](NCc3nnc(-c4ccccc4)o3)C2)cc1 ZINC000558738041 943635770 /nfs/dbraw/zinc/63/57/70/943635770.db2.gz LLSORDGQMJKISS-BJKOFHAPSA-N 0 3 410.521 4.494 20 0 HIADHN COc1cc(OC)cc(C2(F)CCN(C(=O)Nc3cccc(CN(C)C)c3)CC2)c1 ZINC000558750284 943641886 /nfs/dbraw/zinc/64/18/86/943641886.db2.gz XXEHSUMRXMALAV-UHFFFAOYSA-N 0 3 415.509 4.258 20 0 HIADHN CN(C)C[C@H](NC(=O)Nc1cccc(NC(=O)C2CC2)c1)c1ccc(Cl)cc1 ZINC000558767703 943653423 /nfs/dbraw/zinc/65/34/23/943653423.db2.gz MKEJKWZCDNPHSW-IBGZPJMESA-N 0 3 400.910 4.113 20 0 HIADHN CN(C)C[C@H](NC(=O)NCc1csc(Br)c1)c1ccc(Cl)cc1 ZINC000558865325 943706868 /nfs/dbraw/zinc/70/68/68/943706868.db2.gz ICGZVLYIIWEJIQ-AWEZNQCLSA-N 0 3 416.772 4.266 20 0 HIADHN CC(C)N1CC[C@@H](NCC(=O)N(C2CC2)C2CCCC2)[C@@H]1c1ccc(F)c(F)c1 ZINC000558895644 943729593 /nfs/dbraw/zinc/72/95/93/943729593.db2.gz KRHHXHUKXACIDY-GGAORHGYSA-N 0 3 405.533 4.012 20 0 HIADHN C[C@H]1CCO[C@H]1c1nnc(N2CCN(C3CCCCC3)CC2)n1CCc1ccccc1 ZINC000558899359 943734510 /nfs/dbraw/zinc/73/45/10/943734510.db2.gz BLOGEEBCLIENFT-NZQKXSOJSA-N 0 3 423.605 4.073 20 0 HIADHN CCN1CC[C@@H](NCC(=O)Nc2c(C)cc(C)cc2C)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000558902499 943736791 /nfs/dbraw/zinc/73/67/91/943736791.db2.gz ZGUHHVOJWXFEOO-XXBNENTESA-N 0 3 419.491 4.393 20 0 HIADHN COCCc1ccc(OC[C@H](O)CNC2(c3ccc(Cl)c(Cl)c3)CC2)cc1 ZINC000559130162 943850045 /nfs/dbraw/zinc/85/00/45/943850045.db2.gz PAVHZCKNTVFDOS-QGZVFWFLSA-N 0 3 410.341 4.201 20 0 HIADHN O=c1c2ccccc2nc(S[C@@H]2CCN(Cc3ccccc3)C2)n1Cc1ccco1 ZINC000559194861 943868833 /nfs/dbraw/zinc/86/88/33/943868833.db2.gz NFRGEUDMJZKESC-HXUWFJFHSA-N 0 3 417.534 4.404 20 0 HIADHN COc1cc(CN[C@@H](C)c2ccc(-n3cccn3)c(F)c2)cc(Br)c1O ZINC000559333325 943897920 /nfs/dbraw/zinc/89/79/20/943897920.db2.gz KUTQVWDHHJXEIY-LBPRGKRZSA-N 0 3 420.282 4.339 20 0 HIADHN CCO[C@@H]1C[C@@H](NCc2cccc(NC(=O)c3ccccc3Cl)c2)[C@@H]1n1cccn1 ZINC000559364275 943911976 /nfs/dbraw/zinc/91/19/76/943911976.db2.gz KZPQZVHCXADSLQ-VSKRKVRLSA-N 0 3 424.932 4.297 20 0 HIADHN CC(C)(CNC(=O)N1CCC(OC2CCCCC2)CC1)N1CCc2ccccc2C1 ZINC000559454558 943960292 /nfs/dbraw/zinc/96/02/92/943960292.db2.gz VSAXJVCYJVXGLX-UHFFFAOYSA-N 0 3 413.606 4.347 20 0 HIADHN O[C@@H](CNCc1cc(F)cc(Br)c1)CO[C@H]1CCCc2ccccc21 ZINC000559739298 944041487 /nfs/dbraw/zinc/04/14/87/944041487.db2.gz DOVGRWANXANCIL-ICSRJNTNSA-N 0 3 408.311 4.133 20 0 HIADHN CN1CC[C@H](NCC(=O)Nc2ccc3c(c2)OC2(CCCCC2)O3)[C@H]1c1ccccc1 ZINC000559791093 944050875 /nfs/dbraw/zinc/05/08/75/944050875.db2.gz NSNZCXLVPCNRNZ-GBXCKJPGSA-N 0 3 421.541 4.092 20 0 HIADHN CC[C@H](NCc1cc(Cl)ccc1N1CCOCC1)c1ccc(C(=O)OC)cc1 ZINC000559846539 944066626 /nfs/dbraw/zinc/06/66/26/944066626.db2.gz ZLGWFTAYPCFJEW-FQEVSTJZSA-N 0 3 402.922 4.204 20 0 HIADHN C[C@H](N[C@H]1CCCN([C@@H](C)c2ccccc2F)C1=O)c1ccc(-n2ccnc2)cc1 ZINC000559878517 944072797 /nfs/dbraw/zinc/07/27/97/944072797.db2.gz PIGUNDXDZYGYJF-BSRJHKFKSA-N 0 3 406.505 4.414 20 0 HIADHN NC(=O)[C@H](NCCCCc1ccc(Cl)s1)c1ccc(Br)cc1 ZINC000559953739 944099035 /nfs/dbraw/zinc/09/90/35/944099035.db2.gz HLBVJOGAOBXTNE-OAHLLOKOSA-N 0 3 401.757 4.303 20 0 HIADHN CN(Cc1cccc(Br)c1)C[C@H](O)CO[C@@H]1CCCc2ccccc21 ZINC000559958717 944099622 /nfs/dbraw/zinc/09/96/22/944099622.db2.gz IUJJAFHJCLFURI-PZJWPPBQSA-N 0 3 404.348 4.336 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)Nc2ccc(Oc3cccnc3)nc2)C1 ZINC000559966154 944103182 /nfs/dbraw/zinc/10/31/82/944103182.db2.gz NZNZMIWHGFSGHM-PXNSSMCTSA-N 0 3 403.486 4.226 20 0 HIADHN COCC[C@H](NC(=O)N[C@@H](C)C1=CCN(C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000560103717 944160593 /nfs/dbraw/zinc/16/05/93/944160593.db2.gz UTRRZLVUWRNMPT-UGSOOPFHSA-N 0 3 400.350 4.021 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N1CCC=C(c2ccccc2)C1 ZINC000560107574 944161898 /nfs/dbraw/zinc/16/18/98/944161898.db2.gz PGBDDYZXATYHKN-UHFFFAOYSA-N 0 3 407.480 4.291 20 0 HIADHN COC(=O)[C@H](Cc1ccccc1)[C@@H](C)N[C@H](C)C(=O)Nc1ccc(Cl)cc1Cl ZINC000560178519 944188274 /nfs/dbraw/zinc/18/82/74/944188274.db2.gz QIXYQUXQSARDGL-CKEIUWERSA-N 0 3 423.340 4.330 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)Cc2sc(C)nc2-c2ccc(C)cc2)cc1 ZINC000560247760 944206926 /nfs/dbraw/zinc/20/69/26/944206926.db2.gz BOKPLJBKZKLXCT-OAQYLSRUSA-N 0 3 423.582 4.397 20 0 HIADHN CCOC(=O)COc1ccc(CN[C@H](c2cncc(Br)c2)C2CC2)cc1 ZINC000560266837 944212055 /nfs/dbraw/zinc/21/20/55/944212055.db2.gz LPGPLFOGDSYICZ-FQEVSTJZSA-N 0 3 419.319 4.027 20 0 HIADHN CCOc1cc2c(cc1CNC[C@H](O)CO[C@H](C)c1ccc(Cl)cc1)O[C@H](C)C2 ZINC000560315320 944225512 /nfs/dbraw/zinc/22/55/12/944225512.db2.gz WHBUZMLTGWAHBG-ZOCZFRKYSA-N 0 3 419.949 4.290 20 0 HIADHN CC(C)([C@@H](NC(=O)[C@H]1CCc2cccc(O)c21)c1ccc(F)c(F)c1)N1CCCC1 ZINC000560366997 944228211 /nfs/dbraw/zinc/22/82/11/944228211.db2.gz YRKXYQCBXRFQGG-JTSKRJEESA-N 0 3 414.496 4.432 20 0 HIADHN Cc1ccc(CN2CC[C@H](CN(C)C(=O)CCC(=O)c3ccc4c(c3)CCC4)C2)s1 ZINC000560482176 944236623 /nfs/dbraw/zinc/23/66/23/944236623.db2.gz LBJVIVQQAXAWEU-LJQANCHMSA-N 0 3 424.610 4.489 20 0 HIADHN COc1ccc([C@H](Cc2ccncc2)NCc2ccnc(OCC(F)(F)F)c2)cc1 ZINC000560514678 944239952 /nfs/dbraw/zinc/23/99/52/944239952.db2.gz QSZSHHRZELEJCG-FQEVSTJZSA-N 0 3 417.431 4.500 20 0 HIADHN CC(C)Cc1cccc([C@@H](C)NCc2cccc(NC(=O)CCN3CCOCC3)c2)c1 ZINC000560522039 944241966 /nfs/dbraw/zinc/24/19/66/944241966.db2.gz QZTKODPWWKHTCM-OAQYLSRUSA-N 0 3 423.601 4.397 20 0 HIADHN C[C@@H](NCc1ccc(-c2ccc3c(c2)CCO3)cc1)c1ccc2c(c1)OCC(=O)N2 ZINC000560530957 944244569 /nfs/dbraw/zinc/24/45/69/944244569.db2.gz VNURSVHIYAVIJK-MRXNPFEDSA-N 0 3 400.478 4.470 20 0 HIADHN O=S1(=O)CCc2cc(CN[C@@H](c3cccc(OC(F)(F)F)c3)C3CC3)ccc21 ZINC000560543697 944248508 /nfs/dbraw/zinc/24/85/08/944248508.db2.gz KUCMECZQYDOFRT-LJQANCHMSA-N 0 3 411.445 4.156 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O[C@H]3CCOC3)CC2)c1)c1ccc(Cl)cc1 ZINC000560562707 944255804 /nfs/dbraw/zinc/25/58/04/944255804.db2.gz SCXJQUKGYCNFDF-QFIPXVFZSA-N 0 3 414.933 4.362 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)c1cc(F)c(Br)c(Cl)c1 ZINC000560578322 944261386 /nfs/dbraw/zinc/26/13/86/944261386.db2.gz LRTHJSLFDVOXAL-UHFFFAOYSA-N 0 3 403.679 4.039 20 0 HIADHN C[C@H](CC(=O)NCCc1ccccc1)N[C@H](CCO)c1ccc(Cl)c(Cl)c1 ZINC000560584295 944263597 /nfs/dbraw/zinc/26/35/97/944263597.db2.gz CVQPTBFRYCDJLK-FOIQADDNSA-N 0 3 409.357 4.144 20 0 HIADHN O=C(c1cc(Cl)c[nH]1)N1CCC(N[C@H](c2ccc(F)cc2)c2cccnc2)CC1 ZINC000560584617 944263638 /nfs/dbraw/zinc/26/36/38/944263638.db2.gz LBVXTKISSLUSRC-OAQYLSRUSA-N 0 3 412.896 4.186 20 0 HIADHN CN(CCCN(C)C(=O)[C@H]1C[C@H]1c1ccc(Cl)cc1Cl)Cc1ccncc1 ZINC000560594267 944266600 /nfs/dbraw/zinc/26/66/00/944266600.db2.gz FZBJHFJYZHZRMV-OALUTQOASA-N 0 3 406.357 4.472 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)[C@@H]1C[C@@H]1c1ccccc1C(F)(F)F ZINC000560676226 944290593 /nfs/dbraw/zinc/29/05/93/944290593.db2.gz POSLXQYCWYROPR-QXAKKESOSA-N 0 3 404.432 4.014 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)c1csc(-c2ccccc2Cl)n1 ZINC000560674835 944290684 /nfs/dbraw/zinc/29/06/84/944290684.db2.gz DTMOIPUMWZOXOJ-INIZCTEOSA-N 0 3 413.930 4.282 20 0 HIADHN CCCN(C)[C@H](CNC(=O)c1cccc(C(=O)NC2CC2)c1)c1ccc(Cl)cc1 ZINC000560710849 944304855 /nfs/dbraw/zinc/30/48/55/944304855.db2.gz XQXGNFXSCZGGOW-OAQYLSRUSA-N 0 3 413.949 4.045 20 0 HIADHN C[C@@H](N[C@H](CO)Cc1ccc(F)cc1)c1ccc(OC(F)F)cc1OC(F)F ZINC000560908977 944368454 /nfs/dbraw/zinc/36/84/54/944368454.db2.gz MQFSXAOPNZVDKG-RISCZKNCSA-N 0 3 405.363 4.283 20 0 HIADHN C[C@@H](N[C@@H](CO)Cc1ccc(F)cc1)c1ccc(OC(F)F)cc1OC(F)F ZINC000560908969 944368505 /nfs/dbraw/zinc/36/85/05/944368505.db2.gz MQFSXAOPNZVDKG-BXUZGUMPSA-N 0 3 405.363 4.283 20 0 HIADHN FC(F)Oc1cc2c(cc1CNCCc1cnc(SC3CCCC3)nc1)OCO2 ZINC000561058562 944421528 /nfs/dbraw/zinc/42/15/28/944421528.db2.gz VEJNHDPNZDVTHN-UHFFFAOYSA-N 0 3 423.485 4.174 20 0 HIADHN O=C(CCc1cccnc1)N(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000561073982 944428780 /nfs/dbraw/zinc/42/87/80/944428780.db2.gz DYUKVDGGWXETIL-VWLOTQADSA-N 0 3 414.553 4.103 20 0 HIADHN O=C(CNC1(c2ccc(F)cc2)CCOCC1)N(Cc1ccccc1)CC(F)(F)F ZINC000561123770 944466787 /nfs/dbraw/zinc/46/67/87/944466787.db2.gz ZDDAEWGNJZUVLQ-UHFFFAOYSA-N 0 3 424.438 4.012 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)c1ccc(CNC(=O)c2cccs2)cc1 ZINC000561264899 944533715 /nfs/dbraw/zinc/53/37/15/944533715.db2.gz BTRVAIYENOBBSB-UHFFFAOYSA-N 0 3 413.587 4.016 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)c1ccc(C)c(NC(=O)NC(C)(C)C)c1 ZINC000561265221 944533748 /nfs/dbraw/zinc/53/37/48/944533748.db2.gz PALLJBCEGLABHW-UHFFFAOYSA-N 0 3 402.583 4.253 20 0 HIADHN CC1(C)Cc2ccc(Br)cc2[C@@H]1NCc1ccc2c(c1)NC(=O)CO2 ZINC000561315322 944548341 /nfs/dbraw/zinc/54/83/41/944548341.db2.gz OJVNBDXXISTQCV-IBGZPJMESA-N 0 3 401.304 4.193 20 0 HIADHN CN(CCC(F)(F)F)[C@@H](CNC(=O)C(C)(C)c1cnc[nH]1)c1ccc(Cl)cc1 ZINC000561322657 944551053 /nfs/dbraw/zinc/55/10/53/944551053.db2.gz ZTGKQTFUNPKOLS-HNNXBMFYSA-N 0 3 416.875 4.082 20 0 HIADHN COc1cccc(OC(F)(F)F)c1CNC(=O)c1cccc(CN2CCCC2)c1 ZINC000561335816 944555505 /nfs/dbraw/zinc/55/55/05/944555505.db2.gz AIAWUFIXTVCJFC-UHFFFAOYSA-N 0 3 408.420 4.120 20 0 HIADHN C[C@H](N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1)c1cccc(-n2ccnn2)c1 ZINC000561354905 944560755 /nfs/dbraw/zinc/56/07/55/944560755.db2.gz STIOCPBUCMLEOC-CYFREDJKSA-N 0 3 411.509 4.168 20 0 HIADHN CSc1ccc([C@H](CNC(=O)c2csc(-c3ncccc3F)n2)N(C)C)cc1 ZINC000561378432 944567655 /nfs/dbraw/zinc/56/76/55/944567655.db2.gz VWDFEONTMFPIOZ-KRWDZBQOSA-N 0 3 416.547 4.099 20 0 HIADHN CCN(C(=O)CN[C@H]1c2ccccc2CC12CCOCC2)c1nc2ccccc2s1 ZINC000561405906 944582488 /nfs/dbraw/zinc/58/24/88/944582488.db2.gz NKUXTCJRKYSRRP-QFIPXVFZSA-N 0 3 421.566 4.333 20 0 HIADHN C[C@@H]1CN(C(=O)c2cc(Cl)cc(Br)c2F)CCN(C2CCC2)C1 ZINC000561534847 944661729 /nfs/dbraw/zinc/66/17/29/944661729.db2.gz SFRKVTGPKXRJAI-NSHDSACASA-N 0 3 403.723 4.188 20 0 HIADHN COc1cc(C(=O)N[C@@H](CN(C)C)c2ccc(F)cc2)ccc1OC1CCCC1 ZINC000561615174 944710094 /nfs/dbraw/zinc/71/00/94/944710094.db2.gz OHWXEEAQYFPUCR-FQEVSTJZSA-N 0 3 400.494 4.188 20 0 HIADHN COc1cc(Cl)c(C(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)cc1OC ZINC000561657379 944732915 /nfs/dbraw/zinc/73/29/15/944732915.db2.gz MATZLLHHAKTHQV-IBGZPJMESA-N 0 3 420.937 4.177 20 0 HIADHN Cc1ccccc1NC(=O)Cc1noc([C@@H]2CCCN(Cc3cccc(F)c3)C2)n1 ZINC000561687639 944748131 /nfs/dbraw/zinc/74/81/31/944748131.db2.gz MIBGSEBMZXPNBR-GOSISDBHSA-N 0 3 408.477 4.078 20 0 HIADHN C[C@H]1C[C@@H]1N1CCN(C(=O)c2cc(F)c(Br)c(Cl)c2)C[C@@H](C)C1 ZINC000561761569 944785064 /nfs/dbraw/zinc/78/50/64/944785064.db2.gz MTEODRYMCCGORL-PGUXBMHVSA-N 0 3 403.723 4.044 20 0 HIADHN C[C@H]1C[C@@H]1N1CCN(C(=O)c2cccnc2SCc2ccc(F)cc2)C[C@@H](C)C1 ZINC000561764414 944786602 /nfs/dbraw/zinc/78/66/02/944786602.db2.gz JYONWIDUBSJYNV-FIKGOQFSSA-N 0 3 413.562 4.315 20 0 HIADHN C[C@@H](NC(=O)NC[C@@H](c1ccccc1)N1CCCC1)c1nccn1-c1ccccc1 ZINC000561995827 944888949 /nfs/dbraw/zinc/88/89/49/944888949.db2.gz PQPPKFXXBYTIFL-KNQAVFIVSA-N 0 3 403.530 4.070 20 0 HIADHN COc1cc([C@H](C)NC[C@H]2CCN(c3cccc(Br)c3)C2)c(F)cn1 ZINC000562018925 944897286 /nfs/dbraw/zinc/89/72/86/944897286.db2.gz YSIFQOLUQZOHJW-UONOGXRCSA-N 0 3 408.315 4.169 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)Nc1ccccc1N1C[C@@H](C)O[C@@H](C)C1 ZINC000562116495 944949514 /nfs/dbraw/zinc/94/95/14/944949514.db2.gz VLTXKSCONFIURH-BGYRXZFFSA-N 0 3 402.583 4.030 20 0 HIADHN C[C@@H](NC(=O)NC[C@H](Cc1ccccc1)N(C)C)c1ccc(Oc2cccnc2)cc1 ZINC000562174380 945003311 /nfs/dbraw/zinc/00/33/11/945003311.db2.gz BVNSBLGHDIWLBN-KNQAVFIVSA-N 0 3 418.541 4.407 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1cc(Cl)c(F)c(C(=O)OC)c1)c1ccco1 ZINC000562265699 945050089 /nfs/dbraw/zinc/05/00/89/945050089.db2.gz LKMRQPYTYAVXMD-NHYWBVRUSA-N 0 3 411.861 4.110 20 0 HIADHN O=C(NC[C@H]1CCCN1Cc1ccccc1)Nc1ccc(OC[C@H]2CCCO2)cc1 ZINC000564118594 945387099 /nfs/dbraw/zinc/38/70/99/945387099.db2.gz ZZVSRKINRMUIMS-FYYLOGMGSA-N 0 3 409.530 4.031 20 0 HIADHN COC(=O)c1cc(CN[C@@H](Cc2ccccc2C)c2ccc(OC)c(OC)c2)cn1C ZINC000564294758 945503936 /nfs/dbraw/zinc/50/39/36/945503936.db2.gz JXVPDRLSOUTGRR-NRFANRHFSA-N 0 3 422.525 4.211 20 0 HIADHN O[C@@H]1[C@H](CNCc2cc(C(F)(F)F)ccc2Br)CCC12CCOCC2 ZINC000564413230 945564847 /nfs/dbraw/zinc/56/48/47/945564847.db2.gz CACKQFMEZCPFEO-BLLLJJGKSA-N 0 3 422.285 4.125 20 0 HIADHN COc1ccc([C@H](Cc2ccccc2)NCc2ccccc2CS(C)(=O)=O)cc1 ZINC000564423388 945574848 /nfs/dbraw/zinc/57/48/48/945574848.db2.gz IVHAIKQJGCTNBO-DEOSSOPVSA-N 0 3 409.551 4.313 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)N[C@H]1c2ccccc2CC12CCOCC2 ZINC000564575934 945683499 /nfs/dbraw/zinc/68/34/99/945683499.db2.gz SQEBUKOYRZONEN-UPVQGACJSA-N 0 3 419.569 4.044 20 0 HIADHN O=C(Nc1nncs1)C1CCN(Cc2c(OC(F)F)ccc3ccccc32)CC1 ZINC000564612325 945706335 /nfs/dbraw/zinc/70/63/35/945706335.db2.gz XOHSKLCQUDKLIB-UHFFFAOYSA-N 0 3 418.469 4.143 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1ccccc1OC1CC1 ZINC000564683089 945727316 /nfs/dbraw/zinc/72/73/16/945727316.db2.gz MOOYZGDVEPGEKU-HXUWFJFHSA-N 0 3 416.525 4.432 20 0 HIADHN Cc1cccc(Cc2cnc(NC(=O)CN[C@@H]3CCN(C)[C@@H]3c3ccccc3)s2)c1 ZINC000564688207 945731246 /nfs/dbraw/zinc/73/12/46/945731246.db2.gz BIDSMULVNOKZPC-FYYLOGMGSA-N 0 3 420.582 4.016 20 0 HIADHN C[C@H](NC[C@H](CO)Cc1c(F)cccc1Cl)c1ccc(Br)cn1 ZINC000564766876 945754690 /nfs/dbraw/zinc/75/46/90/945754690.db2.gz RIWPGPUGZYNZKP-NWDGAFQWSA-N 0 3 401.707 4.138 20 0 HIADHN Cc1cc(NC(=O)c2cccc3[nH]c(C)nc32)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000565077104 945769063 /nfs/dbraw/zinc/76/90/63/945769063.db2.gz LWCWHFWXLZEONJ-LJQANCHMSA-N 0 3 414.513 4.076 20 0 HIADHN CO[C@H](C)[C@@H](C)N[C@H](C)C(=O)N1N=C(c2ccc(Cl)cc2)C[C@H]1c1ccco1 ZINC000565109947 945775758 /nfs/dbraw/zinc/77/57/58/945775758.db2.gz UQKNZWADXORXEN-GPINWOSQSA-N 0 3 403.910 4.012 20 0 HIADHN Cc1onc(-c2ccccc2)c1C(=O)NC[C@H](c1ccc(OC(C)C)cc1)N(C)C ZINC000565323405 945809864 /nfs/dbraw/zinc/80/98/64/945809864.db2.gz HKHWGYOSKSCSCZ-OAQYLSRUSA-N 0 3 407.514 4.470 20 0 HIADHN CSc1ccc([C@H](CNC(=O)c2cc(C)n(C3CCCCC3)n2)N(C)C)cc1 ZINC000565428531 945828137 /nfs/dbraw/zinc/82/81/37/945828137.db2.gz TYSVSIZQTWJCJG-NRFANRHFSA-N 0 3 400.592 4.451 20 0 HIADHN C[C@@H](c1ccc(Cl)cc1)N1CCN(C[C@@H]2CCN(C(=O)c3ccccc3)C2)CC1 ZINC000565490288 945837565 /nfs/dbraw/zinc/83/75/65/945837565.db2.gz DKRNFAIHBBHNHD-PMACEKPBSA-N 0 3 411.977 4.181 20 0 HIADHN C[C@@H](NCc1ccnc(OC(F)F)c1)c1ccc(I)cc1 ZINC000565788980 945882809 /nfs/dbraw/zinc/88/28/09/945882809.db2.gz GQINUXVVOFVFRD-SNVBAGLBSA-N 0 3 404.198 4.138 20 0 HIADHN COc1cc2c(c(CN3CCC[C@@H](c4nc(C(F)(F)F)cn4C)C3)c1)O[C@H](C)C2 ZINC000565977557 945954248 /nfs/dbraw/zinc/95/42/48/945954248.db2.gz ZIGRGJDDFCOZRA-ZIAGYGMSSA-N 0 3 409.452 4.151 20 0 HIADHN COc1cccc([C@H]2[C@H](NCc3nc4sc(C)c(C)c4c(=O)[nH]3)CCN2C2CC2)c1 ZINC000566022117 945973245 /nfs/dbraw/zinc/97/32/45/945973245.db2.gz SLJHRXDCEZXLOB-NQIIRXRSSA-N 0 3 424.570 4.090 20 0 HIADHN Clc1ccc([C@@H](CNCc2conc2Cc2ccccc2)N2CCOCC2)cc1 ZINC000566574949 946043448 /nfs/dbraw/zinc/04/34/48/946043448.db2.gz SNERHGBKAJCRNP-HSZRJFAPSA-N 0 3 411.933 4.082 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)c1cccc(COc2ccc(C)nc2)c1)c1ccco1 ZINC000566639244 946060856 /nfs/dbraw/zinc/06/08/56/946060856.db2.gz JZTLSHQPSQTSEC-VGSWGCGISA-N 0 3 407.514 4.421 20 0 HIADHN C[C@@H](CC(=O)Nc1cccc(C(F)(F)F)c1)NCc1cc2ccccc2n(C)c1=O ZINC000566655170 946068419 /nfs/dbraw/zinc/06/84/19/946068419.db2.gz PDNFSZBYQRNESJ-AWEZNQCLSA-N 0 3 417.431 4.064 20 0 HIADHN CC[C@@](C)(COc1ncccc1Cl)NCC(=O)N(C)[C@@H](C)c1ccccc1OC ZINC000566669762 946068959 /nfs/dbraw/zinc/06/89/59/946068959.db2.gz MGTUVXZULMOQHY-AOMKIAJQSA-N 0 3 419.953 4.100 20 0 HIADHN COc1ccccc1N1CC[C@H](NC/C(C)=C/c2ccccc2OC(F)F)C1=O ZINC000566685539 946072222 /nfs/dbraw/zinc/07/22/22/946072222.db2.gz RVRIFQSULYZQKD-VOGRQWBCSA-N 0 3 402.441 4.095 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)c3nc4ccccc4cc3Cl)cc2)CC1 ZINC000566707808 946079706 /nfs/dbraw/zinc/07/97/06/946079706.db2.gz ZQKUMVVVTGKWJT-UHFFFAOYSA-N 0 3 408.933 4.278 20 0 HIADHN COC(=O)[C@@H](C)Oc1ccc(CN2CCC(c3noc4cc(F)ccc43)CC2)cc1 ZINC000566789676 946099967 /nfs/dbraw/zinc/09/99/67/946099967.db2.gz PGJFVPDPYSVWJT-OAHLLOKOSA-N 0 3 412.461 4.287 20 0 HIADHN Cc1c(NC(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)cnn1-c1ccc(Cl)cc1 ZINC000566937958 946176126 /nfs/dbraw/zinc/17/61/26/946176126.db2.gz ITZDIIFICYKMRR-FPOVZHCZSA-N 0 3 409.921 4.401 20 0 HIADHN O=C([C@@H]1CN(Cc2ccccc2)CCC1(F)F)N1CC(Cc2ccc(F)c(F)c2)C1 ZINC000567130938 946246352 /nfs/dbraw/zinc/24/63/52/946246352.db2.gz HHRYSDHFNATDLK-IBGZPJMESA-N 0 3 420.450 4.123 20 0 HIADHN CCSc1ccc(Cl)cc1NC(=O)N1CC[C@@H](N2CCN(C(C)C)CC2)C1 ZINC000567160247 946260275 /nfs/dbraw/zinc/26/02/75/946260275.db2.gz HCULZBFHLZLMFH-QGZVFWFLSA-N 0 3 411.015 4.084 20 0 HIADHN Cc1cccnc1C(C)(C)CNC(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000567524385 946358969 /nfs/dbraw/zinc/35/89/69/946358969.db2.gz NSLYUIBIVWICGI-UHFFFAOYSA-N 0 3 412.603 4.081 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)c1ccn(-c2cccc(C(F)(F)F)c2)n1)c1ccco1 ZINC000567538501 946366502 /nfs/dbraw/zinc/36/65/02/946366502.db2.gz VIMCSNGHPMOXLG-KBXCAEBGSA-N 0 3 420.435 4.343 20 0 HIADHN Cc1cc(F)ccc1-c1nc(C(C)(C)C(=O)N[C@H](C)C2=CCN(C)CC2)cs1 ZINC000567553716 946375779 /nfs/dbraw/zinc/37/57/79/946375779.db2.gz AYXNWEIYOOKQAM-OAHLLOKOSA-N 0 3 401.551 4.302 20 0 HIADHN C[C@@H](NC[C@H](Cc1ccccc1)C(F)(F)F)c1cccc(S(=O)(=O)N(C)C)c1 ZINC000567576763 946380302 /nfs/dbraw/zinc/38/03/02/946380302.db2.gz STCGDGNXKJLHGS-QAPCUYQASA-N 0 3 414.493 4.009 20 0 HIADHN CC(=O)N(c1nc(CNC[C@@H](c2ccc(CC(C)C)cc2)N(C)C)cs1)C1CC1 ZINC000567785292 946408294 /nfs/dbraw/zinc/40/82/94/946408294.db2.gz ICOOYPGFLDVCDV-QFIPXVFZSA-N 0 3 414.619 4.249 20 0 HIADHN O=C(Nc1cccc(Oc2cccnn2)c1)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000568095161 946460076 /nfs/dbraw/zinc/46/00/76/946460076.db2.gz VDBKPFLZNDCCHD-HXUWFJFHSA-N 0 3 424.451 4.365 20 0 HIADHN O[C@H](COc1c(Cl)cccc1Cl)CN1CCC(OCCc2ccccc2)CC1 ZINC000568121600 946467800 /nfs/dbraw/zinc/46/78/00/946467800.db2.gz DHQVQYDVBXZCEU-SFHVURJKSA-N 0 3 424.368 4.457 20 0 HIADHN CCCN(CCN1CCCC1)C(=O)c1cnc2ccc(Oc3ccccc3)cc2c1O ZINC000568128285 946470629 /nfs/dbraw/zinc/47/06/29/946470629.db2.gz NDZZGFIWINQMNL-UHFFFAOYSA-N 0 3 419.525 4.268 20 0 HIADHN CN1CCN(C[C@@H](Nc2ncnc3sc4ccccc4c32)c2ccccc2)CC1 ZINC000568351230 946523253 /nfs/dbraw/zinc/52/32/53/946523253.db2.gz YRTACNGOTRAYSN-LJQANCHMSA-N 0 3 403.555 4.245 20 0 HIADHN Cc1ccc(C(=O)C2CCN(C[C@@H]3CN(Cc4ccccc4)CCCO3)CC2)cc1 ZINC000568423393 946537760 /nfs/dbraw/zinc/53/77/60/946537760.db2.gz QYMIQUKKIKOMRL-RUZDIDTESA-N 0 3 406.570 4.181 20 0 HIADHN Cc1cc2cc(CNC(=O)NC3CC(N4CCC(C(F)(F)F)CC4)C3)ccc2[nH]1 ZINC000568494677 946571875 /nfs/dbraw/zinc/57/18/75/946571875.db2.gz YOPFCXUUFKULEA-UHFFFAOYSA-N 0 3 408.468 4.081 20 0 HIADHN CC(C)Cn1cc(NC(=O)N[C@@H]2CCN(Cc3ccccc3)[C@H]2C)c(C(F)F)n1 ZINC000568524645 946576197 /nfs/dbraw/zinc/57/61/97/946576197.db2.gz APRZCTCNCGOCOX-DOTOQJQBSA-N 0 3 405.493 4.261 20 0 HIADHN C[C@H](N[C@H]1c2ccccc2CC12CCOCC2)C(=O)Nc1ccc(F)cc1Cl ZINC000568568826 946604955 /nfs/dbraw/zinc/60/49/55/946604955.db2.gz NKHRDPKGJUNKGD-XOBRGWDASA-N 0 3 402.897 4.490 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)Nc3ccnc4ccc(Oc5ccccc5)cc43)[C@@H]2C1 ZINC000568803561 946702895 /nfs/dbraw/zinc/70/28/95/946702895.db2.gz RVNQKQUEEZDSDD-UZUQRXQVSA-N 0 3 402.498 4.007 20 0 HIADHN CC(C)C[C@@H](C)N(C)C(=O)CNC1(c2cccc(C(F)(F)F)c2)CCOCC1 ZINC000568835156 946723103 /nfs/dbraw/zinc/72/31/03/946723103.db2.gz IFUGTYUOWGJFRJ-MRXNPFEDSA-N 0 3 400.485 4.194 20 0 HIADHN CC(C)C[C@H](C)N(C)C(=O)CNC1(c2cccc(C(F)(F)F)c2)CCOCC1 ZINC000568835155 946723362 /nfs/dbraw/zinc/72/33/62/946723362.db2.gz IFUGTYUOWGJFRJ-INIZCTEOSA-N 0 3 400.485 4.194 20 0 HIADHN Cc1ccc(NC(=O)NC(=O)[C@H](C)N[C@@H](C[C@H]2CCOC2)c2ccccc2)c(C)c1 ZINC000569073153 946815613 /nfs/dbraw/zinc/81/56/13/946815613.db2.gz MKTFCPONALCCSE-JQVVWYNYSA-N 0 3 409.530 4.098 20 0 HIADHN CC(C)[C@H](NC(=O)NCCCCN1CCN(C)CC1)c1ccc(C(C)(C)C)cc1 ZINC000569140708 946820772 /nfs/dbraw/zinc/82/07/72/946820772.db2.gz ROTWAAVAJBRBKV-QFIPXVFZSA-N 0 3 402.627 4.008 20 0 HIADHN O[C@@H](CN[C@H]1CCOc2c(Cl)cccc21)COc1ccccc1C(F)(F)F ZINC000569166056 946829711 /nfs/dbraw/zinc/82/97/11/946829711.db2.gz AOMJFXYZBYAORA-LRDDRELGSA-N 0 3 401.812 4.212 20 0 HIADHN C[C@H](N[C@H]1CCN(C)[C@@H]1c1ccc(Cl)cc1)C(=O)Nc1ccccc1OC(F)F ZINC000569394813 946865984 /nfs/dbraw/zinc/86/59/84/946865984.db2.gz QJIRKDZTALHIMI-SOVGHPHASA-N 0 3 423.891 4.303 20 0 HIADHN C[C@H](N[C@H]1CCN(C)[C@H]1c1ccc(Cl)cc1)C(=O)Nc1ccccc1OC(F)F ZINC000569394812 946866202 /nfs/dbraw/zinc/86/62/02/946866202.db2.gz QJIRKDZTALHIMI-IXDGSTSKSA-N 0 3 423.891 4.303 20 0 HIADHN COc1ccc([C@H](NC(=O)CN[C@@H]2c3ccccc3CC23CCOCC3)C(C)C)cc1 ZINC000569427878 946874536 /nfs/dbraw/zinc/87/45/36/946874536.db2.gz RJMNJECQUXSXQQ-JWQCQUIFSA-N 0 3 422.569 4.192 20 0 HIADHN C[C@@H]1C[C@H]1N1CCN(C(=O)c2ccc(-c3noc(CC(C)(C)C)n3)cc2)C[C@@H](C)C1 ZINC000569797338 947008609 /nfs/dbraw/zinc/00/86/09/947008609.db2.gz KNKKYJYOMFMKHD-SQGPQFPESA-N 0 3 410.562 4.128 20 0 HIADHN C[C@@H](CN1CCN(Cc2nc3sc4c(c3c(=O)[nH]2)CCCC4)CC1)c1ccccc1 ZINC000569848805 947018708 /nfs/dbraw/zinc/01/87/08/947018708.db2.gz YIOLCCBDGVWGRI-KRWDZBQOSA-N 0 3 422.598 4.197 20 0 HIADHN O=C(C(=O)N1CCC2(C1)CCN(Cc1ccccc1)CC2)c1ccc(Cl)s1 ZINC000569855431 947020252 /nfs/dbraw/zinc/02/02/52/947020252.db2.gz ZINYDDVUFMNKCN-UHFFFAOYSA-N 0 3 402.947 4.099 20 0 HIADHN Cc1nc(COc2ccc(Cl)cc2)sc1C(=O)N1CC[C@H](N2CCCC2)[C@H]1C ZINC000570116332 947099028 /nfs/dbraw/zinc/09/90/28/947099028.db2.gz SAOOMWXDPOLIFC-QAPCUYQASA-N 0 3 419.978 4.383 20 0 HIADHN CC(=O)N(Cc1ccc(NC(=O)N[C@@H]2CCN(Cc3ccccc3)[C@@H]2C)cc1)C(C)C ZINC000570125019 947102609 /nfs/dbraw/zinc/10/26/09/947102609.db2.gz YKCVMAKHXYFQFE-NTKDMRAZSA-N 0 3 422.573 4.228 20 0 HIADHN COc1ccc([C@H](Cc2ccccc2)NCc2cccnc2N2CCOCC2)cc1 ZINC000570205727 947140759 /nfs/dbraw/zinc/14/07/59/947140759.db2.gz LWTFWMRSJMORJC-DEOSSOPVSA-N 0 3 403.526 4.000 20 0 HIADHN COc1ccc([C@@H](Cc2ccccc2)NCc2cccnc2N2CCOCC2)cc1 ZINC000570205728 947142199 /nfs/dbraw/zinc/14/21/99/947142199.db2.gz LWTFWMRSJMORJC-XMMPIXPASA-N 0 3 403.526 4.000 20 0 HIADHN O=C(CCc1ccc(-c2ccccc2F)o1)Nc1cccc(CN2CC[C@@H](O)C2)c1 ZINC000570267139 947175718 /nfs/dbraw/zinc/17/57/18/947175718.db2.gz HQSYCAPLPZSJLJ-LJQANCHMSA-N 0 3 408.473 4.224 20 0 HIADHN O=C(CCc1ccc(-c2ccccc2F)o1)Nc1cccc(CN2CC[C@H](O)C2)c1 ZINC000570267138 947176364 /nfs/dbraw/zinc/17/63/64/947176364.db2.gz HQSYCAPLPZSJLJ-IBGZPJMESA-N 0 3 408.473 4.224 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1ccc(CN(C(C)=O)C(C)C)cc1)c1ccco1 ZINC000570268181 947177458 /nfs/dbraw/zinc/17/74/58/947177458.db2.gz YODUIIOSQQTSSV-LAUBAEHRSA-N 0 3 414.550 4.287 20 0 HIADHN CC(C)Cc1ccc([C@@H](CNC(=O)N[C@H](C)c2ccc3c(c2)CC(=O)N3)N(C)C)cc1 ZINC000570304621 947186286 /nfs/dbraw/zinc/18/62/86/947186286.db2.gz GTWYTSMGPODPSD-UZUQRXQVSA-N 0 3 422.573 4.043 20 0 HIADHN CN(C)C[C@H](NC(=O)N[C@@H]1CCO[C@@H]1c1ccc(F)c(F)c1)c1ccc(Cl)cc1 ZINC000570380185 947228657 /nfs/dbraw/zinc/22/86/57/947228657.db2.gz JLNIHPPPQOCCJQ-HSALFYBXSA-N 0 3 423.891 4.050 20 0 HIADHN Cc1ccc(C)c(NC(=O)[C@H](C)N[C@@H]2CCN(C)[C@H]2c2ccc(Cl)c(F)c2)c1 ZINC000570438501 947248422 /nfs/dbraw/zinc/24/84/22/947248422.db2.gz HQTFCJILKHFELB-DLVCFXQMSA-N 0 3 403.929 4.458 20 0 HIADHN Cc1ccc(C)c(NC(=O)[C@H](C)N[C@@H]2CCN(C)[C@@H]2c2ccc(Cl)c(F)c2)c1 ZINC000570438502 947248659 /nfs/dbraw/zinc/24/86/59/947248659.db2.gz HQTFCJILKHFELB-NYSBEXSLSA-N 0 3 403.929 4.458 20 0 HIADHN C[C@@H](CNC(=O)c1nc2ccccc2cc1Br)N(C)Cc1ccccc1 ZINC000570480430 947262011 /nfs/dbraw/zinc/26/20/11/947262011.db2.gz QFCSRLRZRLAYHW-HNNXBMFYSA-N 0 3 412.331 4.248 20 0 HIADHN COCC1(NCc2cn(-c3ccc(Br)cc3)nc2C(C)C)CCOCC1 ZINC000570706220 947330740 /nfs/dbraw/zinc/33/07/40/947330740.db2.gz SETXZPIHLSNEAO-UHFFFAOYSA-N 0 3 422.367 4.043 20 0 HIADHN CCOc1ccc(NC(=O)CN[C@H]2c3ccccc3CC23CCOCC3)cc1OCC ZINC000570731840 947339768 /nfs/dbraw/zinc/33/97/68/947339768.db2.gz VOYXIPCPWWQIMZ-DEOSSOPVSA-N 0 3 424.541 4.106 20 0 HIADHN CN(C(=O)c1ccc(NCc2ccc(OC(F)(F)F)cc2)cc1)[C@@H]1CCCN(C)C1 ZINC000570745715 947343426 /nfs/dbraw/zinc/34/34/26/947343426.db2.gz ILNASMDHCHRUIR-LJQANCHMSA-N 0 3 421.463 4.364 20 0 HIADHN CN(C)C[C@@H](NC(=O)Nc1ccc(Oc2cccnc2)nc1)c1ccc(Cl)cc1 ZINC000571027637 947445187 /nfs/dbraw/zinc/44/51/87/947445187.db2.gz AGIZNKDOYPVUAH-LJQANCHMSA-N 0 3 411.893 4.347 20 0 HIADHN COC(=O)c1ccc(CN[C@@H](CN2CCCC2)c2ccccc2)c(Br)c1 ZINC000571110902 947503052 /nfs/dbraw/zinc/50/30/52/947503052.db2.gz VXHYARYFLIHJQK-FQEVSTJZSA-N 0 3 417.347 4.162 20 0 HIADHN CSc1ccc([C@H](CNC(=O)c2sc([C@@H]3CCCOC3)nc2C)N(C)C)cc1 ZINC000571120404 947512351 /nfs/dbraw/zinc/51/23/51/947512351.db2.gz LQVXLYJXFRNHOJ-AEFFLSMTSA-N 0 3 419.616 4.100 20 0 HIADHN COCCn1cc(C(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)c2ccccc21 ZINC000571195275 947540493 /nfs/dbraw/zinc/54/04/93/947540493.db2.gz SGZKLBHSUJQNIV-DEOSSOPVSA-N 0 3 423.557 4.108 20 0 HIADHN O=C1CC[C@@H]2CN([C@@H]3CCCc4ccc(Br)cc43)CC[C@@H]2N1C1CC1 ZINC000571389940 947632914 /nfs/dbraw/zinc/63/29/14/947632914.db2.gz BQZXEYVANISSPR-UIAACRFSSA-N 0 3 403.364 4.302 20 0 HIADHN CCOC(=O)c1nnc(-c2cccc(C[NH2+][C@@H]3CCC[C@H](c4ncccc4C)C3)c2)[n-]1 ZINC000571448172 947653729 /nfs/dbraw/zinc/65/37/29/947653729.db2.gz UZIGCLQDNHXNKT-AZUAARDMSA-N 0 3 419.529 4.168 20 0 HIADHN CCOC(=O)c1nc(-c2cccc(C[NH2+][C@@H]3CCC[C@H](c4ncccc4C)C3)c2)n[n-]1 ZINC000571448172 947653739 /nfs/dbraw/zinc/65/37/39/947653739.db2.gz UZIGCLQDNHXNKT-AZUAARDMSA-N 0 3 419.529 4.168 20 0 HIADHN C/C(=C/c1ccccc1OC(F)F)CN(C)[C@@H](C)c1cccc(S(N)(=O)=O)c1 ZINC000571966344 947824153 /nfs/dbraw/zinc/82/41/53/947824153.db2.gz OBQGDWWFGDQYGX-SZGZABIGSA-N 0 3 410.486 4.032 20 0 HIADHN Cc1ccc(-c2noc([C@H]3CCCN(Cc4cccnc4)C3)n2)cc1N1CCCC1 ZINC000572025629 947829854 /nfs/dbraw/zinc/82/98/54/947829854.db2.gz WSHBUVNSKQELTK-NRFANRHFSA-N 0 3 403.530 4.420 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N[C@H](C)c1ccc2n[nH]cc2c1)c1cccc(OC)c1 ZINC000572025355 947830068 /nfs/dbraw/zinc/83/00/68/947830068.db2.gz BRELXEDVNGDVHI-ZHRRBRCNSA-N 0 3 409.534 4.015 20 0 HIADHN C[C@@H]1[C@H](NC(=O)Nc2ccc(NC(=O)c3ccco3)cc2)CCN1Cc1ccccc1 ZINC000572273125 947873287 /nfs/dbraw/zinc/87/32/87/947873287.db2.gz LBLQOXXZUKGYAT-DYESRHJHSA-N 0 3 418.497 4.316 20 0 HIADHN O=C(c1cc(F)c2ccccc2c1)N1CCC[C@H](c2n[nH]cc2CN2CCCC2)C1 ZINC000572309759 947880168 /nfs/dbraw/zinc/88/01/68/947880168.db2.gz AFWYERJDWUBPHU-SFHVURJKSA-N 0 3 406.505 4.318 20 0 HIADHN CC(C)N1CC[C@H](N[C@@H](C)C(=O)Nc2ccc(F)cc2F)[C@H]1c1ccc(F)c(F)c1 ZINC000572375191 947889730 /nfs/dbraw/zinc/88/97/30/947889730.db2.gz ILSODRQKQICSIL-SKOKVVANSA-N 0 3 423.454 4.384 20 0 HIADHN C[C@@H](CN1CCC[C@@H](CNC(=O)CC(F)(F)F)C1)c1cccc(Br)c1 ZINC000572563895 947949420 /nfs/dbraw/zinc/94/94/20/947949420.db2.gz QJXIBFYFQZHNRG-KBPBESRZSA-N 0 3 421.301 4.333 20 0 HIADHN C[C@H](NC(=O)c1nccnc1-c1nc2ccccc2s1)[C@@H](c1ccccc1)N(C)C ZINC000572631120 947962411 /nfs/dbraw/zinc/96/24/11/947962411.db2.gz LXLUFWQTEKCIEX-BTYIYWSLSA-N 0 3 417.538 4.175 20 0 HIADHN C[C@H]1C[C@H](NC(=O)C2(c3cccc(Cl)c3)CC(=O)C2)CCN1Cc1ccccc1 ZINC000572654785 947968942 /nfs/dbraw/zinc/96/89/42/947968942.db2.gz MZLIESHARDQDIT-LAUBAEHRSA-N 0 3 410.945 4.110 20 0 HIADHN C[C@@H]1C[C@H]1N1CCN(C(=O)c2ccc(Br)c(C(F)(F)F)c2)C[C@@H](C)C1 ZINC000572670964 947976196 /nfs/dbraw/zinc/97/61/96/947976196.db2.gz JSNWBQPHRCXOAF-HWWQOWPSSA-N 0 3 419.285 4.270 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)c2c(C)c(C)sc2Br)cc1 ZINC000572786747 948010844 /nfs/dbraw/zinc/01/08/44/948010844.db2.gz OEZBMKJSNYVAPS-OAHLLOKOSA-N 0 3 411.365 4.169 20 0 HIADHN Cc1c([C@H](C)NCCn2cc(Br)cn2)cnn1-c1cccc(Cl)c1 ZINC000572827709 948020633 /nfs/dbraw/zinc/02/06/33/948020633.db2.gz FJHHYLAWHBWHQG-LBPRGKRZSA-N 0 3 408.731 4.144 20 0 HIADHN C[C@@H](Cc1ccc(F)cc1Br)[NH2+]Cc1nnc(COc2ccccc2)[n-]1 ZINC000572915926 948037914 /nfs/dbraw/zinc/03/79/14/948037914.db2.gz JYFAQJCWPQXWKW-ZDUSSCGKSA-N 0 3 419.298 4.006 20 0 HIADHN CCC(CC)Nc1ccncc1NC(=O)CCc1nnc(-c2ccc(Cl)cc2)o1 ZINC000573019649 948059217 /nfs/dbraw/zinc/05/92/17/948059217.db2.gz GJPKVVMIPTZKPG-UHFFFAOYSA-N 0 3 413.909 4.379 20 0 HIADHN Cc1ccc([C@H](NC[C@H]2COc3ccccc32)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000573133339 948083790 /nfs/dbraw/zinc/08/37/90/948083790.db2.gz RJSGVJSDBXMIQU-RDPSFJRHSA-N 0 3 407.535 4.254 20 0 HIADHN CCOC(=O)c1cccc(OC[C@@H](O)CN[C@H]2CCSc3ccc(Cl)cc32)c1 ZINC000573231219 948115158 /nfs/dbraw/zinc/11/51/58/948115158.db2.gz YVRUWSNXDOKIRU-LPHOPBHVSA-N 0 3 421.946 4.083 20 0 HIADHN CNC(=O)COc1cccc(CN[C@H]2CCCc3nc(-c4ccc(C)cc4)sc32)c1 ZINC000573391071 948176654 /nfs/dbraw/zinc/17/66/54/948176654.db2.gz MLGIPVQFHGVVRB-FQEVSTJZSA-N 0 3 421.566 4.411 20 0 HIADHN Cc1cccc(NC(=O)N[C@@H]2CCN(Cc3ccccc3)[C@H]2C)c1C(=O)N1CCCC1 ZINC000573474733 948212344 /nfs/dbraw/zinc/21/23/44/948212344.db2.gz FRBXJIPVYWEMAT-PZJWPPBQSA-N 0 3 420.557 4.016 20 0 HIADHN COc1ccc(C(=O)NC[C@@H](c2ccc(SC)cc2)N(C)C)cc1OC(F)F ZINC000573596349 948245955 /nfs/dbraw/zinc/24/59/55/948245955.db2.gz PFWVNWXAMPMDMK-INIZCTEOSA-N 0 3 410.486 4.051 20 0 HIADHN CCSc1cccc(F)c1NC(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000573647544 948266212 /nfs/dbraw/zinc/26/62/12/948266212.db2.gz GYEJKYZFVLYZDA-SFHVURJKSA-N 0 3 417.550 4.350 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)c2cccc3cccc(Br)c32)C[C@H](C)O1 ZINC000573708092 948279214 /nfs/dbraw/zinc/27/92/14/948279214.db2.gz MZIKJLAYAMVXFO-IYBDPMFKSA-N 0 3 419.363 4.222 20 0 HIADHN C[C@H](C(=O)N[C@H]1CCN(Cc2ccccc2)[C@@H]1C)c1ccc(Br)s1 ZINC000573716035 948280020 /nfs/dbraw/zinc/28/00/20/948280020.db2.gz UQCWWVQCAAVVLM-LZWOXQAQSA-N 0 3 407.377 4.393 20 0 HIADHN COc1ccc(-c2ocnc2C(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)cc1 ZINC000573758585 948290969 /nfs/dbraw/zinc/29/09/69/948290969.db2.gz FSWOPNLHGDJVJO-SFHVURJKSA-N 0 3 405.498 4.087 20 0 HIADHN C[C@H](C(=O)N(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1)C(F)(F)F ZINC000573825052 948303320 /nfs/dbraw/zinc/30/33/20/948303320.db2.gz FWYCSVNXBGKWDR-XLIONFOSSA-N 0 3 405.464 4.273 20 0 HIADHN CSc1ccc([C@H](CNC(=O)c2cc(NC(C)=O)ccc2Cl)N(C)C)cc1 ZINC000574192864 948383742 /nfs/dbraw/zinc/38/37/42/948383742.db2.gz GZSXVYWMLDGRNL-IBGZPJMESA-N 0 3 405.951 4.053 20 0 HIADHN CC(C)[C@H](CNC(=O)[C@H](C)Cc1cnc2ccccc2n1)N1CCc2ccccc2C1 ZINC000574295447 948404025 /nfs/dbraw/zinc/40/40/25/948404025.db2.gz OGKXLBFKDLWESI-CLOONOSVSA-N 0 3 416.569 4.008 20 0 HIADHN O=C(CCC(F)(F)F)N1CCC[C@@H](NCc2ccc(Br)cc2F)C1 ZINC000574312832 948408407 /nfs/dbraw/zinc/40/84/07/948408407.db2.gz KEVIMVOSOSVGRQ-CYBMUJFWSA-N 0 3 411.237 4.011 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)Nc1cnn(Cc2ccc(Cl)cc2)c1)c1ccco1 ZINC000574349725 948419505 /nfs/dbraw/zinc/41/95/05/948419505.db2.gz WDPWXMXYALFURF-DNVCBOLYSA-N 0 3 415.925 4.429 20 0 HIADHN CN(C)C[C@H](NC(=O)c1cccc(NC(=O)c2ccco2)c1)c1ccc(Cl)cc1 ZINC000574535374 948464363 /nfs/dbraw/zinc/46/43/63/948464363.db2.gz UOGMNTLYOXPGET-IBGZPJMESA-N 0 3 411.889 4.218 20 0 HIADHN CCOC(=O)c1nnc(C2CC[NH+](C/C(C)=C/c3cccc(C(F)(F)F)c3)CC2)[n-]1 ZINC000574559561 948474028 /nfs/dbraw/zinc/47/40/28/948474028.db2.gz YXIHQCMCRFNZEQ-SDNWHVSQSA-N 0 3 422.451 4.283 20 0 HIADHN Cc1c(NC(=O)N[C@H]2CCN(Cc3ccccc3)[C@H]2C)cccc1C(=O)N1CCCC1 ZINC000574839158 948540203 /nfs/dbraw/zinc/54/02/03/948540203.db2.gz HFIITEYNNWVTGW-CVDCTZTESA-N 0 3 420.557 4.016 20 0 HIADHN C[C@@H](NC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1)c1nccn1-c1ccccc1 ZINC000574937194 948557470 /nfs/dbraw/zinc/55/74/70/948557470.db2.gz XKMPBSZODGDZCP-UYAOXDASSA-N 0 3 406.505 4.101 20 0 HIADHN CC[C@H]1CC[C@H](C)N1CC(=O)N(Cc1nnc(-c2ccccc2Cl)o1)C1CC1 ZINC000575079999 948585929 /nfs/dbraw/zinc/58/59/29/948585929.db2.gz XUVTWEMIGOHKQF-GJZGRUSLSA-N 0 3 402.926 4.144 20 0 HIADHN CC[C@@H]1CC[C@H](C)N1CC(=O)N(Cc1nnc(-c2ccccc2Cl)o1)C1CC1 ZINC000575080001 948586110 /nfs/dbraw/zinc/58/61/10/948586110.db2.gz XUVTWEMIGOHKQF-LSDHHAIUSA-N 0 3 402.926 4.144 20 0 HIADHN O=c1[n-]c(CN2C[C@@H]3CC[N@H+](Cc4ccccc4)C[C@@H]3C2)nc2c3ccccc3oc21 ZINC000575166314 948615095 /nfs/dbraw/zinc/61/50/95/948615095.db2.gz DEDLZNSAJMOKBF-RBUKOAKNSA-N 0 3 414.509 4.036 20 0 HIADHN O=c1[n-]c(CN2C[C@@H]3CC[N@@H+](Cc4ccccc4)C[C@@H]3C2)nc2c3ccccc3oc21 ZINC000575166314 948615114 /nfs/dbraw/zinc/61/51/14/948615114.db2.gz DEDLZNSAJMOKBF-RBUKOAKNSA-N 0 3 414.509 4.036 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)c1cnc(-c2cnn(C)c2)s1)c1ccc(Cl)cc1 ZINC000575416793 948666183 /nfs/dbraw/zinc/66/61/83/948666183.db2.gz YEIPENJEXKCFOY-KRWDZBQOSA-N 0 3 417.966 4.010 20 0 HIADHN CN(C)[C@@]1(CN[C@H](c2ccc(Br)o2)c2ccc(F)cc2)CCSC1 ZINC000575783885 948706041 /nfs/dbraw/zinc/70/60/41/948706041.db2.gz LSTTYIOPXJCLJL-ZWKOTPCHSA-N 0 3 413.356 4.298 20 0 HIADHN C[C@@H](NCc1ccc(C[S@](C)=O)cc1)c1ccc(I)cc1 ZINC000575855703 948744394 /nfs/dbraw/zinc/74/43/94/948744394.db2.gz RKAAULWRWWFPDI-ASSNKEHSSA-N 0 3 413.324 4.021 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N(C)[C@H]3CC[C@@H](C(F)(F)F)CC3)cc2)CC1 ZINC000576027334 948812671 /nfs/dbraw/zinc/81/26/71/948812671.db2.gz ZEQGOOFVOWMYTN-KDURUIRLSA-N 0 3 411.512 4.410 20 0 HIADHN COc1ccc([C@@H](CNC(=O)Cc2ccc(Cl)c(Cl)c2)N2CCCC2)cc1 ZINC000009595247 571272295 /nfs/dbraw/zinc/27/22/95/571272295.db2.gz XPLBWXZVMVJLJI-HXUWFJFHSA-N 0 3 407.341 4.498 20 0 HIADHN FC(F)(c1cnc(Cl)c(-c2ccc(Cl)cc2)c1)N1CC[C@H]2NCCO[C@@H]2C1 ZINC001164391779 718826631 /nfs/dbraw/zinc/82/66/31/718826631.db2.gz XGGHSIYUKMYPTA-IAGOWNOFSA-N 0 3 414.283 4.167 20 0 HIADHN Cn1cc(CN2CC[C@H]3CN(c4cc(Cl)nc5cc(Cl)ccc54)C[C@@H]3C2)cn1 ZINC001164771731 721106610 /nfs/dbraw/zinc/10/66/10/721106610.db2.gz STTYADUCBXDGFU-HOTGVXAUSA-N 0 3 416.356 4.233 20 0 HIADHN Cc1csc2c1nc(Cl)cc2N1CCN2C[C@@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164865673 721115770 /nfs/dbraw/zinc/11/57/70/721115770.db2.gz OFQYSRISGPKJNF-SJORKVTESA-N 0 3 414.962 4.133 20 0 HIADHN Cn1cc(CN2CC[C@@H]3CN(c4ccc5c(Cl)ccc(Cl)c5n4)C[C@H]3C2)cn1 ZINC001164760716 721234867 /nfs/dbraw/zinc/23/48/67/721234867.db2.gz GHPMEOIHUJUJJQ-HZPDHXFCSA-N 0 3 416.356 4.233 20 0 HIADHN COc1ccc2c(ccnc2N2CCC(F)(F)[C@@]3(CCN(Cc4ccccn4)C3)C2)c1 ZINC001164906194 721694253 /nfs/dbraw/zinc/69/42/53/721694253.db2.gz LZPCCLUGTGILHH-HSZRJFAPSA-N 0 3 424.495 4.376 20 0 HIADHN CC(C)Oc1cccc(N2CCC(F)(F)[C@]3(CCN(Cc4ccccn4)C3)C2)n1 ZINC001164907796 721709849 /nfs/dbraw/zinc/70/98/49/721709849.db2.gz UESLJBYEVJCQDH-NRFANRHFSA-N 0 3 402.489 4.002 20 0 HIADHN FC1(F)CCN(c2nnc(Cl)c3ccoc32)C[C@]12CCN(Cc1ccccn1)C2 ZINC001164904383 721714838 /nfs/dbraw/zinc/71/48/38/721714838.db2.gz DCEXXQHXOUCFBS-LJQANCHMSA-N 0 3 419.863 4.009 20 0 HIADHN Cc1cc2ncnc(N3CCC(F)(F)[C@]4(CCN(Cc5ccccn5)C4)C3)c2cc1C ZINC001164912165 721733621 /nfs/dbraw/zinc/73/36/21/721733621.db2.gz MEXCJTVPSHUTAD-QHCPKHFHSA-N 0 3 423.511 4.379 20 0 HIADHN Cc1cccc2ccc(N3CCC4(CC3)COCCN(Cc3ccncc3)C4)nc12 ZINC001164961215 722051874 /nfs/dbraw/zinc/05/18/74/722051874.db2.gz WHCSSMREDLTTSU-UHFFFAOYSA-N 0 3 402.542 4.057 20 0 HIADHN Clc1cc(N2CC[C@H]3CN(Cc4cccnc4)CCO[C@@H]3C2)c2ccsc2n1 ZINC001164982522 722110210 /nfs/dbraw/zinc/11/02/10/722110210.db2.gz WWCCPSJSZHOQPM-QFBILLFUSA-N 0 3 414.962 4.072 20 0 HIADHN Clc1cc(N2CC[C@H]3CN(Cc4cccnc4)CCO[C@H]3C2)c2sccc2n1 ZINC001164980535 722110362 /nfs/dbraw/zinc/11/03/62/722110362.db2.gz RSNLLAMHMLMGMN-LPHOPBHVSA-N 0 3 414.962 4.072 20 0 HIADHN Clc1ccc2ccc(N3CC[C@H]4CN(Cc5cccnc5)CCO[C@H]4C3)nc2c1 ZINC001164976724 722128613 /nfs/dbraw/zinc/12/86/13/722128613.db2.gz MHVGSHAYOPMPOU-UGKGYDQZSA-N 0 3 408.933 4.011 20 0 HIADHN Cc1ccc2cc(Cl)nc(N3CC[C@H]4CN(Cc5cccnc5)CCO[C@@H]4C3)c2c1 ZINC001164973202 722130483 /nfs/dbraw/zinc/13/04/83/722130483.db2.gz BMGUUYCXCVCSOB-RBBKRZOGSA-N 0 3 422.960 4.319 20 0 HIADHN Cc1ccc2c(C)cc(N3CC[C@@H]4CN(Cc5cccnc5)CCO[C@H]4C3)nc2c1C ZINC001164982774 722143696 /nfs/dbraw/zinc/14/36/96/722143696.db2.gz SHXUQSRFTJICBL-VWNXMTODSA-N 0 3 416.569 4.282 20 0 HIADHN CC(C)c1nc(N2CC[C@H]3CN(Cc4cccnc4)CCO[C@H]3C2)cc(C(C)(C)C)n1 ZINC001164977987 722147793 /nfs/dbraw/zinc/14/77/93/722147793.db2.gz JBDYSLCFLXTQFF-SFTDATJTSA-N 0 3 423.605 4.020 20 0 HIADHN COc1cc2ncc(N3CCC[C@]4(CCN4Cc4cccc(F)c4)C3)nc2cc1OC ZINC001164994517 722199227 /nfs/dbraw/zinc/19/92/27/722199227.db2.gz NMSNNJBVOIVGKG-DEOSSOPVSA-N 0 3 422.504 4.031 20 0 HIADHN CCOc1ccc2ncnc(N3CCC[C@@]4(CCN4Cc4cccc(F)c4)C3)c2c1 ZINC001164995970 722201072 /nfs/dbraw/zinc/20/10/72/722201072.db2.gz QPANQJBPPXSSQL-XMMPIXPASA-N 0 3 406.505 4.413 20 0 HIADHN COc1cc(OC)c2ncnc(N3CCC[C@]4(CCN4Cc4cccc(F)c4)C3)c2c1 ZINC001164998533 722213231 /nfs/dbraw/zinc/21/32/31/722213231.db2.gz WTZDGUOHWWCSTL-DEOSSOPVSA-N 0 3 422.504 4.031 20 0 HIADHN CN(C)CCN(C(=O)Nc1cccc(C[S@@](=O)c2ccccc2)c1)C1CCCC1 ZINC000435997840 861280950 /nfs/dbraw/zinc/28/09/50/861280950.db2.gz DINLVIBBIHXDQV-GDLZYMKVSA-N 0 3 413.587 4.333 20 0 HIADHN CC[C@H](Nc1ccccc1)C(=O)Nc1cc(C)nn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000436007657 861296387 /nfs/dbraw/zinc/29/63/87/861296387.db2.gz YTAFDDPXCRCBLA-GOTSBHOMSA-N 0 3 417.557 4.468 20 0 HIADHN Cc1cc(NC(=O)[C@H](c2cccnc2)C(C)C)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000436151173 861449578 /nfs/dbraw/zinc/44/95/78/861449578.db2.gz KXNHSVUGDOMBBB-VWNXMTODSA-N 0 3 417.557 4.412 20 0 HIADHN Cc1cc(Br)ccc1SCC(=O)NCc1ccccc1CN(C)C ZINC000006992549 845232957 /nfs/dbraw/zinc/23/29/57/845232957.db2.gz LYCJBVGNFVUBDL-UHFFFAOYSA-N 0 3 407.377 4.228 20 0 HIADHN COc1cc(CNCc2c[nH]nc2-c2ccsc2)cc(Br)c1OC ZINC000436241634 861549793 /nfs/dbraw/zinc/54/97/93/861549793.db2.gz RVUIWHRFYFGLTE-UHFFFAOYSA-N 0 3 408.321 4.208 20 0 HIADHN CC(C)c1ccc([C@H](NCC(=O)Nc2ccccc2SCC(N)=O)C(C)C)cc1 ZINC000007804532 845417550 /nfs/dbraw/zinc/41/75/50/845417550.db2.gz NKRQMVBMBJIRHU-HSZRJFAPSA-N 0 3 413.587 4.313 20 0 HIADHN C[C@@H](N[C@H]1C[C@H](c2cccc(F)c2)C1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000436286395 861591834 /nfs/dbraw/zinc/59/18/34/861591834.db2.gz HBMQCKOOGDAQFM-MPKXVKKWSA-N 0 3 417.333 4.377 20 0 HIADHN O=C([C@@H]1CC[C@H](N[C@H]2CCc3c2c(Br)ccc3F)C1)N1CCCCC1 ZINC000436294273 861600689 /nfs/dbraw/zinc/60/06/89/861600689.db2.gz FHJVBITZMATGJV-GLJUWKHASA-N 0 3 409.343 4.346 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)CSCc3cccc(Cl)c3)cc2)CC1 ZINC000011945935 845842992 /nfs/dbraw/zinc/84/29/92/845842992.db2.gz NPGSWJJVRGHTTB-UHFFFAOYSA-N 0 3 403.979 4.354 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(C)c1C(=O)NC1CCN(Cc2ccccc2)CC1 ZINC000014796391 845982269 /nfs/dbraw/zinc/98/22/69/845982269.db2.gz UFIOWFIZUDEULZ-UHFFFAOYSA-N 0 3 406.505 4.023 20 0 HIADHN C[C@@H]1[C@H](NC(=O)N[C@@H](CC(F)(F)F)c2ccc(C(F)(F)F)cc2)CCCN1C ZINC000436326782 861630158 /nfs/dbraw/zinc/63/01/58/861630158.db2.gz FCMCVJFSBJWBBZ-DFBGVHRSSA-N 0 3 411.390 4.481 20 0 HIADHN CCOC(=O)c1sc2nc(C)nc(NC[C@H](c3cccs3)N(C)C)c2c1C ZINC000015171312 846015170 /nfs/dbraw/zinc/01/51/70/846015170.db2.gz CVSWWDMJOPYMQH-CYBMUJFWSA-N 0 3 404.561 4.261 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)N[C@@H](CC(F)(F)F)c2ccc(C(F)(F)F)cc2)CCCN1C ZINC000436326956 861632149 /nfs/dbraw/zinc/63/21/49/861632149.db2.gz FCMCVJFSBJWBBZ-UGFHNGPFSA-N 0 3 411.390 4.481 20 0 HIADHN COc1cc(C(=O)NC[C@@H](c2ccccc2)N(C)C)ccc1OCc1ccccc1 ZINC000016599311 846189655 /nfs/dbraw/zinc/18/96/55/846189655.db2.gz VXQXJZJISNDMIY-QFIPXVFZSA-N 0 3 404.510 4.307 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Cc3csc(-c4ccc(C)cc4)n3)cc2)CC1 ZINC000020004149 846374430 /nfs/dbraw/zinc/37/44/30/846374430.db2.gz FBRURAWAUBMTEL-UHFFFAOYSA-N 0 3 420.582 4.442 20 0 HIADHN COc1ccc(Nc2nnc(SCC(=O)C(C#N)c3nc(C)cs3)s2)cc1 ZINC000020055126 846377560 /nfs/dbraw/zinc/37/75/60/846377560.db2.gz WPUQMEMUCUDVRX-ZDUSSCGKSA-N 0 3 417.541 4.024 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cccc(Br)c1)c1cccc(OC)c1 ZINC000021070928 846402454 /nfs/dbraw/zinc/40/24/54/846402454.db2.gz RZHRKKACGYZFGY-IBGZPJMESA-N 0 3 405.336 4.271 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)c1nn(-c2ccc(F)cc2)c2c1CCC2 ZINC000022464285 846574014 /nfs/dbraw/zinc/57/40/14/846574014.db2.gz AXAHDLSMVFWXAQ-QHCPKHFHSA-N 0 3 418.516 4.067 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)c1nn(-c2ccc(F)cc2)c2c1CCC2 ZINC000022464279 846574406 /nfs/dbraw/zinc/57/44/06/846574406.db2.gz AXAHDLSMVFWXAQ-HSZRJFAPSA-N 0 3 418.516 4.067 20 0 HIADHN C[C@@H](N[C@H](CCCc1ccccc1)c1ccccc1)C(=O)Nc1ccc(C(N)=O)cc1 ZINC000022819098 846625096 /nfs/dbraw/zinc/62/50/96/846625096.db2.gz VDFAMVLXSQFLMW-NTKDMRAZSA-N 0 3 415.537 4.466 20 0 HIADHN CN(C)Cc1ccccc1CNC(=O)Cn1c(Cc2ccccc2)nc2ccccc21 ZINC000024084837 846786799 /nfs/dbraw/zinc/78/67/99/846786799.db2.gz YPOOVPWTFJVEBQ-UHFFFAOYSA-N 0 3 412.537 4.005 20 0 HIADHN Cc1noc2nc(-c3ccccc3)cc(C(=O)N[C@H]3CCN(Cc4ccccc4)C3)c12 ZINC000025252779 846948709 /nfs/dbraw/zinc/94/87/09/846948709.db2.gz LPYQITCILLNYLJ-FQEVSTJZSA-N 0 3 412.493 4.203 20 0 HIADHN COc1ccc([C@H]2CCCN2C[C@@H](O)COCc2ccccc2Cl)c(OC)c1 ZINC000025301245 846956655 /nfs/dbraw/zinc/95/66/55/846956655.db2.gz OAPRQRDSHVBIHL-DYESRHJHSA-N 0 3 405.922 4.072 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cc(C2CC2)nc2onc(C)c21)c1cccc(OC)c1 ZINC000025862481 847048363 /nfs/dbraw/zinc/04/83/63/847048363.db2.gz PPZLCJRHWXRLHU-OAQYLSRUSA-N 0 3 422.529 4.230 20 0 HIADHN COCc1ccccc1CNC(=O)NC[C@H](c1cccs1)N1CCC(C)CC1 ZINC000026146009 847095751 /nfs/dbraw/zinc/09/57/51/847095751.db2.gz ZGGLDBUMOJUGQH-HXUWFJFHSA-N 0 3 401.576 4.167 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)c3cc(-c4cccs4)on3)CC2)c1 ZINC000026961524 847227579 /nfs/dbraw/zinc/22/75/79/847227579.db2.gz PRQHPONNEVBUIJ-UHFFFAOYSA-N 0 3 424.570 4.044 20 0 HIADHN COc1ccc(CN(C)C[C@@H](O)COc2c(C)ccc(C)c2C)cc1OC(F)F ZINC000027210097 847266667 /nfs/dbraw/zinc/26/66/67/847266667.db2.gz ZPJJDCQILRQADM-GOSISDBHSA-N 0 3 409.473 4.094 20 0 HIADHN COc1cccc([C@H](CNC(=O)Cc2c(Cl)cccc2Cl)N2CCCC2)c1 ZINC000027340971 847285539 /nfs/dbraw/zinc/28/55/39/847285539.db2.gz ZZQJASJJNWJCQO-FQEVSTJZSA-N 0 3 407.341 4.498 20 0 HIADHN COc1cccc([C@@H](CNC(=O)CCCc2c[nH]c3ccccc23)N2CCCC2)c1 ZINC000027340823 847285903 /nfs/dbraw/zinc/28/59/03/847285903.db2.gz IHHHEYYZDNZULV-XMMPIXPASA-N 0 3 405.542 4.453 20 0 HIADHN CCOc1ccc([C@H](NCC(=O)Nc2cccnc2Cl)C(C)C)cc1OCC ZINC000027380763 847293328 /nfs/dbraw/zinc/29/33/28/847293328.db2.gz USBXCLXFDYAMBQ-HXUWFJFHSA-N 0 3 405.926 4.458 20 0 HIADHN Cc1ccccc1CN1CCCN(C(=O)c2c[nH]c(=S)n2-c2ccc(F)cc2)CC1 ZINC000027390895 847295669 /nfs/dbraw/zinc/29/56/69/847295669.db2.gz ZUWZLTRHVGDTIM-UHFFFAOYSA-N 0 3 424.545 4.331 20 0 HIADHN CC1CCN([C@H](CNC(=O)c2ccc(Cn3cccn3)cc2)c2cccs2)CC1 ZINC000027575142 847321998 /nfs/dbraw/zinc/32/19/98/847321998.db2.gz MNQSAWGWTJJMFW-OAQYLSRUSA-N 0 3 408.571 4.196 20 0 HIADHN COc1ccc(O[C@H](C)C(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)cc1 ZINC000027575391 847323703 /nfs/dbraw/zinc/32/37/03/847323703.db2.gz QHIAQQLAMWVGFY-XLIONFOSSA-N 0 3 402.560 4.113 20 0 HIADHN Cc1ccc(-n2ncc(C(=O)N[C@@H](C)CN3CCCCC3)c2C2CC2)cc1Cl ZINC000027766996 847348896 /nfs/dbraw/zinc/34/88/96/847348896.db2.gz KDNBNACUPFAIAM-INIZCTEOSA-N 0 3 400.954 4.316 20 0 HIADHN COc1ccc(NC(=O)[C@H](C)N[C@@H](C)c2ccc(Br)cc2)cc1OC ZINC000028893859 847473184 /nfs/dbraw/zinc/47/31/84/847473184.db2.gz FAIVWXWBTKIXFJ-STQMWFEESA-N 0 3 407.308 4.144 20 0 HIADHN COc1cc(C(=O)NC[C@H](C(C)C)N2CCc3ccccc3C2)ccc1OC(F)F ZINC000029174047 847519186 /nfs/dbraw/zinc/51/91/86/847519186.db2.gz JOMGSBDCXWNQNT-LJQANCHMSA-N 0 3 418.484 4.109 20 0 HIADHN CC(C)(C)OC(=O)NCc1ccc(C(=O)N[C@H](CN2CCCC2)c2ccccc2)cc1 ZINC000029178661 847520324 /nfs/dbraw/zinc/52/03/24/847520324.db2.gz WNLIRDKEQMECCN-JOCHJYFZSA-N 0 3 423.557 4.278 20 0 HIADHN C[C@@H](Oc1ccc(Br)cc1)C(=O)N[C@H](CN1CCCC1)c1ccccc1 ZINC000029177982 847520457 /nfs/dbraw/zinc/52/04/57/847520457.db2.gz HDASUWDYWRVBGD-OXQOHEQNSA-N 0 3 417.347 4.170 20 0 HIADHN CCOc1ccc(C(=O)CCC(=O)Nc2ccc(N3CCN(CC)CC3)cc2C)cc1 ZINC000029375078 847554121 /nfs/dbraw/zinc/55/41/21/847554121.db2.gz XOVLVHHCEXTBSR-UHFFFAOYSA-N 0 3 423.557 4.137 20 0 HIADHN O=C(/C=C/c1ccc2ccc(Cl)cc2n1)NCC1(N2CCSCC2)CCCC1 ZINC000029370373 847554517 /nfs/dbraw/zinc/55/45/17/847554517.db2.gz NSIMQUXLOOVEQP-BQYQJAHWSA-N 0 3 415.990 4.379 20 0 HIADHN COc1ccc2cc(CNC(=O)N[C@@H](CN3CCCC3)c3ccccc3)ccc2c1 ZINC000029724916 847609189 /nfs/dbraw/zinc/60/91/89/847609189.db2.gz WAPYWZOVGVRNLM-DEOSSOPVSA-N 0 3 403.526 4.485 20 0 HIADHN COc1ccc2ccccc2c1CNC(=O)N[C@H](CN1CCCC1)c1ccccc1 ZINC000029729775 847610181 /nfs/dbraw/zinc/61/01/81/847610181.db2.gz WGNWMCDOWJJZMM-HSZRJFAPSA-N 0 3 403.526 4.485 20 0 HIADHN COCc1c(C(=O)NCCCN2CCc3ccccc3C2)sc2cccc(F)c21 ZINC000029839934 847630076 /nfs/dbraw/zinc/63/00/76/847630076.db2.gz WRRGAEJURLHSLK-UHFFFAOYSA-N 0 3 412.530 4.365 20 0 HIADHN CC[C@@H](CNC(=O)CCCOc1ccc(C(C)=O)cc1)N1CCc2ccccc2C1 ZINC000029912389 847649388 /nfs/dbraw/zinc/64/93/88/847649388.db2.gz QENILWDLMRWQQH-QHCPKHFHSA-N 0 3 408.542 4.001 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3ccc(Br)cc3F)c(C)c2)CC1 ZINC000030019787 847672818 /nfs/dbraw/zinc/67/28/18/847672818.db2.gz RYRSCEQARNOWBH-UHFFFAOYSA-N 0 3 420.326 4.291 20 0 HIADHN C[C@H](NCc1cccc(COCc2ccco2)c1)C(=O)Nc1ccc(N(C)C)cc1 ZINC000030511182 847726165 /nfs/dbraw/zinc/72/61/65/847726165.db2.gz NYCAVEZHEAXAAP-SFHVURJKSA-N 0 3 407.514 4.179 20 0 HIADHN Cc1c(CN[C@H](CN2CCOCC2)c2ccc(C)cc2)sc2nc(C)nc(C)c12 ZINC000030628460 847747568 /nfs/dbraw/zinc/74/75/68/847747568.db2.gz PGCPWRAHGOPFJQ-HXUWFJFHSA-N 0 3 410.587 4.088 20 0 HIADHN COCC(=O)Nc1cccc(CNCc2cc(C)c(OCc3ccccn3)c(C)c2)c1 ZINC000030630816 847748636 /nfs/dbraw/zinc/74/86/36/847748636.db2.gz YBODKSJHKDWMKA-UHFFFAOYSA-N 0 3 419.525 4.152 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N[C@@H](C)c1cc(OC)ccc1OC)c1ccsc1 ZINC000031193925 847839626 /nfs/dbraw/zinc/83/96/26/847839626.db2.gz MFBHIWQZOJMKNG-KXBFYZLASA-N 0 3 405.564 4.209 20 0 HIADHN CC(C)n1ncc2c1nc(C1CC1)cc2C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000031565791 847908831 /nfs/dbraw/zinc/90/88/31/847908831.db2.gz IEHCZBBQBJOONX-HXUWFJFHSA-N 0 3 417.557 4.284 20 0 HIADHN Cc1cccc(-c2nc(CC(=O)NCC3(N4CCSCC4)CCCC3)cs2)c1 ZINC000031959820 847971638 /nfs/dbraw/zinc/97/16/38/847971638.db2.gz ITTDEMKHGUYYSX-UHFFFAOYSA-N 0 3 415.628 4.139 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)[C@H](NC(=O)c1cccc(C)c1)C(C)C)c1ccsc1 ZINC000031987751 847975903 /nfs/dbraw/zinc/97/59/03/847975903.db2.gz DSXINAGOGQOVHK-LEWJYISDSA-N 0 3 415.603 4.010 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1ccc(OC)c(Br)c1)c1ccsc1 ZINC000031986567 847975928 /nfs/dbraw/zinc/97/59/28/847975928.db2.gz WXURBQYVXYORAY-MRXNPFEDSA-N 0 3 411.365 4.332 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)COc1ccc(Br)cc1)c1ccsc1 ZINC000031987431 847975937 /nfs/dbraw/zinc/97/59/37/847975937.db2.gz VEHGKHLVKFZCRX-KRWDZBQOSA-N 0 3 411.365 4.089 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)Cc3ccc4ccccc4c3)CC2)c1 ZINC000032067908 847984866 /nfs/dbraw/zinc/98/48/66/847984866.db2.gz XLWCCLPUYVYYEJ-UHFFFAOYSA-N 0 3 415.581 4.409 20 0 HIADHN Cc1ccc(C(=O)NCCCN2CCc3ccccc3C2)cc1NC(=O)c1ccco1 ZINC000032399068 848019248 /nfs/dbraw/zinc/01/92/48/848019248.db2.gz HQOAWLKLFFJZOP-UHFFFAOYSA-N 0 3 417.509 4.019 20 0 HIADHN O=C(/C=C/c1ccc2ccc(Cl)cc2n1)NCCCN1CCc2ccccc2C1 ZINC000032401416 848019779 /nfs/dbraw/zinc/01/97/79/848019779.db2.gz MULFFWASCUXAJY-ZHACJKMWSA-N 0 3 405.929 4.466 20 0 HIADHN O=C(CCc1ncc(-c2ccc(Cl)cc2)o1)NCCCN1CCc2ccccc2C1 ZINC000032400767 848020399 /nfs/dbraw/zinc/02/03/99/848020399.db2.gz BSCKPWDONSYYRH-UHFFFAOYSA-N 0 3 423.944 4.492 20 0 HIADHN Cc1cc(NC(=O)c2cc(Cc3ccccc3)ccc2[O-])n(C2CC[NH+](C)CC2)n1 ZINC000436585321 861860587 /nfs/dbraw/zinc/86/05/87/861860587.db2.gz PLCMVHTXBKBACC-UHFFFAOYSA-N 0 3 404.514 4.007 20 0 HIADHN CC1CCN([C@H](CNC(=O)c2ccc(NC(=O)C3CC3)cc2)c2cccs2)CC1 ZINC000036684665 848154989 /nfs/dbraw/zinc/15/49/89/848154989.db2.gz GFFWCCOBCLVLIZ-HXUWFJFHSA-N 0 3 411.571 4.300 20 0 HIADHN COc1cccc(CN2CCC(C(=O)Nc3ccc(Br)cc3)CC2)c1 ZINC000038834014 848180428 /nfs/dbraw/zinc/18/04/28/848180428.db2.gz DIDFQURUVHVPHK-UHFFFAOYSA-N 0 3 403.320 4.308 20 0 HIADHN Cc1oc(-c2cccs2)nc1CC(=O)N1CCCN(Cc2ccccc2C)CC1 ZINC000041315407 848211033 /nfs/dbraw/zinc/21/10/33/848211033.db2.gz BFHYPYPMQLBDLV-UHFFFAOYSA-N 0 3 409.555 4.297 20 0 HIADHN N#CC(C(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1nc2ccccc2[nH]1 ZINC000041495921 848221455 /nfs/dbraw/zinc/22/14/55/848221455.db2.gz JTIQCYSFYGQLMH-GFCCVEGCSA-N 0 3 417.347 4.168 20 0 HIADHN CN(CC(=O)C(C#N)c1nc(-c2ccc(Cl)cc2)cs1)C(=O)c1cccs1 ZINC000041513964 848224656 /nfs/dbraw/zinc/22/46/56/848224656.db2.gz IHQSSCRZHCUTSA-AWEZNQCLSA-N 0 3 415.927 4.473 20 0 HIADHN COc1ccc2c(C)c(CCC(=O)C(C#N)c3nc4ccccc4o3)c(=O)oc2c1 ZINC000041542180 848228983 /nfs/dbraw/zinc/22/89/83/848228983.db2.gz GWXNSZBOZKZXQK-KRWDZBQOSA-N 0 3 402.406 4.060 20 0 HIADHN CCOC(=O)N[C@@H](C(=O)C(C#N)c1nc2cc(C(F)(F)F)ccc2s1)C(C)C ZINC000041548362 848229865 /nfs/dbraw/zinc/22/98/65/848229865.db2.gz MITNYMVFOZUFOO-BXUZGUMPSA-N 0 3 413.421 4.262 20 0 HIADHN CC1CCN([C@@H](CNC(=O)C2(c3ccccc3)CCOCC2)c2cccs2)CC1 ZINC000041774817 848249215 /nfs/dbraw/zinc/24/92/15/848249215.db2.gz FYUUOXFENJTDPB-NRFANRHFSA-N 0 3 412.599 4.386 20 0 HIADHN CCOc1ccc(C(=O)CCC(=O)NC2CCN(Cc3ccccc3C)CC2)cc1 ZINC000042127148 848290012 /nfs/dbraw/zinc/29/00/12/848290012.db2.gz HYZGQAHWOYFXCI-UHFFFAOYSA-N 0 3 408.542 4.137 20 0 HIADHN COc1cc(-c2nc(-c3ccc(C[NH+]4CCC(C)CC4)cc3)no2)cc(OC)c1[O-] ZINC000436690447 861895215 /nfs/dbraw/zinc/89/52/15/861895215.db2.gz QMXIIIUVEDENRI-UHFFFAOYSA-N 0 3 409.486 4.358 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)N(Cc1cccs1)C[C@@H]1CCCO1 ZINC000043231139 848396350 /nfs/dbraw/zinc/39/63/50/848396350.db2.gz KGHJMKPYBWKANF-HKUYNNGSSA-N 0 3 419.616 4.337 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)N(Cc1cccs1)C[C@H]1CCCO1 ZINC000043231141 848396866 /nfs/dbraw/zinc/39/68/66/848396866.db2.gz KGHJMKPYBWKANF-MJGOQNOKSA-N 0 3 419.616 4.337 20 0 HIADHN COc1ccc(C)cc1NC(=O)NCCCCN1CCN(c2cccc(C)c2)CC1 ZINC000043279522 848404462 /nfs/dbraw/zinc/40/44/62/848404462.db2.gz PEJUBHHQVZOYOL-UHFFFAOYSA-N 0 3 410.562 4.036 20 0 HIADHN C[C@@H](N[C@H](C)c1cccc2ccccc21)C(=O)Nc1ccc(N2CCOCC2)cc1 ZINC000043303466 848406308 /nfs/dbraw/zinc/40/63/08/848406308.db2.gz XWUOELHCXASQKJ-RTBURBONSA-N 0 3 403.526 4.354 20 0 HIADHN O=C(c1ccccc1[O-])N1CCC([NH2+]Cc2ccc(-c3c(F)cccc3F)o2)CC1 ZINC000436711002 861899935 /nfs/dbraw/zinc/89/99/35/861899935.db2.gz CDLKZGKEOGJJAZ-UHFFFAOYSA-N 0 3 412.436 4.325 20 0 HIADHN CCN(CC)C(=O)c1cccc(NC(=O)NC[C@@H](c2ccsc2)N(CC)CC)c1 ZINC000043498143 848431999 /nfs/dbraw/zinc/43/19/99/848431999.db2.gz GKKGBQYVZCWADI-FQEVSTJZSA-N 0 3 416.591 4.435 20 0 HIADHN CN(C)C[C@@H]1CCc2ccccc2N1C(=O)c1cncc(-c2ccc(N(C)C)cc2)c1 ZINC000436719360 861904395 /nfs/dbraw/zinc/90/43/95/861904395.db2.gz HGSPJLNTMTWEIS-DEOSSOPVSA-N 0 3 414.553 4.338 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1ccccc1C(=O)N1CCCC1)c1ccsc1 ZINC000043797159 848468970 /nfs/dbraw/zinc/46/89/70/848468970.db2.gz IPCBVVCULUNWLI-HXUWFJFHSA-N 0 3 414.575 4.189 20 0 HIADHN CC(C)(C)NC(=O)c1ccc(NC(=O)NC[C@H](c2cccs2)N2CCCC2)cc1 ZINC000044017451 848501715 /nfs/dbraw/zinc/50/17/15/848501715.db2.gz XIYJFFYBLPWCFL-GOSISDBHSA-N 0 3 414.575 4.235 20 0 HIADHN CC(C)c1cccc(C(C)C)c1NC(=S)NC[C@@H](C(C)C)N1CCN(C)CC1 ZINC000044073279 848509716 /nfs/dbraw/zinc/50/97/16/848509716.db2.gz ZMSDALFJXKOXEI-NRFANRHFSA-N 0 3 404.668 4.492 20 0 HIADHN CN(C)C[C@H]1CCc2ccccc2N1C(=O)c1ccc(NC(=O)c2ccccc2)cc1 ZINC000436725612 861911692 /nfs/dbraw/zinc/91/16/92/861911692.db2.gz SNPAKTIJSQEQKY-HSZRJFAPSA-N 0 3 413.521 4.462 20 0 HIADHN COCCOc1ccc(NC(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)cc1 ZINC000044301045 848541153 /nfs/dbraw/zinc/54/11/53/848541153.db2.gz ZQEDZQOZPZMJLA-FQEVSTJZSA-N 0 3 417.575 4.368 20 0 HIADHN COc1ccc(CCN[C@@H](C(=O)Nc2ccc(F)cc2)c2ccccc2)cc1OC ZINC000045295795 848661075 /nfs/dbraw/zinc/66/10/75/848661075.db2.gz HGBRMGWYQLEFGA-HSZRJFAPSA-N 0 3 408.473 4.355 20 0 HIADHN CCN(Cc1cc(=O)n2cc(Br)ccc2n1)[C@@H](C)c1cccc(OC)c1 ZINC000045806201 848732438 /nfs/dbraw/zinc/73/24/38/848732438.db2.gz GGKCWYJNVVVWPP-AWEZNQCLSA-N 0 3 416.319 4.049 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)N(C)Cc3ccccc3C)CC2)c1 ZINC000046867854 848950473 /nfs/dbraw/zinc/95/04/73/848950473.db2.gz KJPHQAGGYYWERI-UHFFFAOYSA-N 0 3 408.590 4.047 20 0 HIADHN CCOc1ccc([C@@H](C)NC(=O)N2CCCN(Cc3ccccc3)CC2)cc1OC ZINC000047045450 848976735 /nfs/dbraw/zinc/97/67/35/848976735.db2.gz CYLVZHCWPHYOOC-LJQANCHMSA-N 0 3 411.546 4.072 20 0 HIADHN O=C(NC1CCN(Cc2ccc(OCC(F)(F)F)cc2)CC1)c1ccc(F)cc1 ZINC000047266005 849017059 /nfs/dbraw/zinc/01/70/59/849017059.db2.gz LRWBAFYZYYPAOM-UHFFFAOYSA-N 0 3 410.411 4.161 20 0 HIADHN Cc1ccc(CNC(=O)c2cccc(CNCc3ccc(-n4cccn4)cc3)c2)cc1 ZINC000047718120 849098267 /nfs/dbraw/zinc/09/82/67/849098267.db2.gz KOJFTIZGHPQQSN-UHFFFAOYSA-N 0 3 410.521 4.401 20 0 HIADHN COc1cc(CN[C@H](C)c2ccc(NC(=O)NC(C)C)cc2)cc(OC)c1OC ZINC000047723566 849099009 /nfs/dbraw/zinc/09/90/09/849099009.db2.gz QPWVTQJAAKBGEG-OAHLLOKOSA-N 0 3 401.507 4.093 20 0 HIADHN COc1cc(CNCc2ccc(-n3cccn3)cc2)ccc1OCc1ccncc1 ZINC000047751462 849103856 /nfs/dbraw/zinc/10/38/56/849103856.db2.gz MVKDSADOOWPCJJ-UHFFFAOYSA-N 0 3 400.482 4.145 20 0 HIADHN COc1ccc(OC(F)F)c(NC(=O)NC[C@@H](c2cccs2)N2CCCC2)c1 ZINC000047921072 849138449 /nfs/dbraw/zinc/13/84/49/849138449.db2.gz DLQAAOLTZSFHMJ-HNNXBMFYSA-N 0 3 411.474 4.317 20 0 HIADHN O=C(NCc1cccc(COCc2ccco2)c1)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000047964822 849145107 /nfs/dbraw/zinc/14/51/07/849145107.db2.gz VAYZSGASPQXBOE-QHCPKHFHSA-N 0 3 419.525 4.070 20 0 HIADHN C[C@@H](Sc1ccc(Br)cc1)C(=O)NCc1ccccc1CN(C)C ZINC000048269419 849201865 /nfs/dbraw/zinc/20/18/65/849201865.db2.gz NZBOHUDZFYQYNK-CQSZACIVSA-N 0 3 407.377 4.308 20 0 HIADHN COc1ccc(NC(=O)NCCCN2CCc3ccccc3C2)c(C(F)(F)F)c1 ZINC000048549681 849241109 /nfs/dbraw/zinc/24/11/09/849241109.db2.gz QTGKFIODEBAWIQ-UHFFFAOYSA-N 0 3 407.436 4.284 20 0 HIADHN COc1ccc(C[C@H](NCc2cnc(N3CCCC3)nc2)c2ccc(OC)cc2)cc1 ZINC000048683543 849255065 /nfs/dbraw/zinc/25/50/65/849255065.db2.gz HQZGWRXMQGISGN-DEOSSOPVSA-N 0 3 418.541 4.168 20 0 HIADHN c1coc(COCc2cccc(CNCc3c[nH]nc3-c3ccc4c(c3)OCO4)c2)c1 ZINC000048711886 849257739 /nfs/dbraw/zinc/25/77/39/849257739.db2.gz WHFSZDVITYTIAK-UHFFFAOYSA-N 0 3 417.465 4.405 20 0 HIADHN C[C@H](NCc1ccc(SC(F)(F)F)cc1)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000048780530 849267448 /nfs/dbraw/zinc/26/74/48/849267448.db2.gz HJXOHXAFSGYBHG-ZDUSSCGKSA-N 0 3 418.506 4.400 20 0 HIADHN COc1ccc(CSCC(=O)C(C#N)c2nc3ccccc3s2)cc1[N+](=O)[O-] ZINC000048824383 849271278 /nfs/dbraw/zinc/27/12/78/849271278.db2.gz DOADVLHBKIDFBQ-ZDUSSCGKSA-N 0 3 413.480 4.323 20 0 HIADHN Cc1ccc(OC(F)F)c([C@H](C)[NH2+]C2CCN(C(=O)c3ccccc3[O-])CC2)c1 ZINC000436825259 862006292 /nfs/dbraw/zinc/00/62/92/862006292.db2.gz CHWWTKBAWYFXLP-HNNXBMFYSA-N 0 3 404.457 4.257 20 0 HIADHN C[C@H]([NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1)c1cccc(OC(F)(F)F)c1 ZINC000436825341 862007351 /nfs/dbraw/zinc/00/73/51/862007351.db2.gz DBGDIUKDUMALBJ-AWEZNQCLSA-N 0 3 408.420 4.246 20 0 HIADHN O=C(c1ccccc1[O-])N1CCC([NH2+][C@H]2CCc3cc(Br)ccc32)CC1 ZINC000436826503 862007864 /nfs/dbraw/zinc/00/78/64/862007864.db2.gz HLYHCQXRZUTPHS-IBGZPJMESA-N 0 3 415.331 4.036 20 0 HIADHN CC(C)(CNC(=O)N1CCC(C(=O)c2ccc(Cl)cc2)CC1)N1CCCCC1 ZINC000050096389 849353335 /nfs/dbraw/zinc/35/33/35/849353335.db2.gz JUUZMDDAXAIFRE-UHFFFAOYSA-N 0 3 405.970 4.209 20 0 HIADHN O=C(Nc1cc(Cl)ccc1[O-])C1CC[NH+](Cc2cccc(OC(F)F)c2)CC1 ZINC000050960589 849423000 /nfs/dbraw/zinc/42/30/00/849423000.db2.gz CLSILMIXKUYSAC-UHFFFAOYSA-N 0 3 410.848 4.498 20 0 HIADHN COc1ccccc1[C@H](C)N(C)C(=O)CN(C)C[C@@H]1CCCO[C@@H]1c1ccccc1 ZINC000051132033 849434658 /nfs/dbraw/zinc/43/46/58/849434658.db2.gz WAMSIEVARLCNEA-QYXIYQDXSA-N 0 3 410.558 4.314 20 0 HIADHN Cc1ccc2c(CN3CCC[C@@H](C(=O)Nc4ccc(Cl)cn4)C3)cc(=O)oc2c1 ZINC000052829616 849631621 /nfs/dbraw/zinc/63/16/21/849631621.db2.gz UYDFBAFGRHLZDF-OAHLLOKOSA-N 0 3 411.889 4.001 20 0 HIADHN COc1ccc(-c2nc(C(=O)N(CC(C)C)C3CCN(C)CC3)cs2)cc1OC ZINC000053223647 849681224 /nfs/dbraw/zinc/68/12/24/849681224.db2.gz OFAPIBKIWFZMMI-UHFFFAOYSA-N 0 3 417.575 4.020 20 0 HIADHN CC(C)CN(C(=S)NCCSc1ccc(Cl)cc1)C1CCN(C)CC1 ZINC000053525420 849726093 /nfs/dbraw/zinc/72/60/93/849726093.db2.gz WZGYXXNLFYZALF-UHFFFAOYSA-N 0 3 400.057 4.359 20 0 HIADHN COc1cccc([C@H](CNC(=O)N[C@H](C)c2ccc(OC)c(F)c2)N2CCCC2)c1 ZINC000053553113 849730805 /nfs/dbraw/zinc/73/08/05/849730805.db2.gz XQPNYFCAHNDDFO-IERDGZPVSA-N 0 3 415.509 4.040 20 0 HIADHN CC(C)Sc1ccc(C(=O)Nc2cccc(CN3CCC(C(N)=O)CC3)c2)cc1 ZINC000053997082 849791745 /nfs/dbraw/zinc/79/17/45/849791745.db2.gz WTWIZJGYFXTYSQ-UHFFFAOYSA-N 0 3 411.571 4.137 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)CCCc2nnc(-c3ccccc3)o2)C1 ZINC000054223147 849828983 /nfs/dbraw/zinc/82/89/83/849828983.db2.gz QEXRLRYJXQQPDW-RXVVDRJESA-N 0 3 404.514 4.011 20 0 HIADHN CCN(Cc1cccc(NC(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)c1)C(C)=O ZINC000054409432 849862794 /nfs/dbraw/zinc/86/27/94/849862794.db2.gz LKHJTXMHHURHRH-FDDCHVKYSA-N 0 3 408.546 4.012 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)CCN(Cc1cccs1)C[C@@H]1CCCO1 ZINC000054427654 849865174 /nfs/dbraw/zinc/86/51/74/849865174.db2.gz OYHBCCUQOBHISZ-INIZCTEOSA-N 0 3 408.951 4.420 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)NC[C@@H](c2cccs2)N2CCCC2)cc1 ZINC000054478315 849876565 /nfs/dbraw/zinc/87/65/65/849876565.db2.gz QHDTZAVLWYLVBK-LPHOPBHVSA-N 0 3 414.575 4.235 20 0 HIADHN CCOC(=O)N(C)c1ccc(NC(=O)NC[C@H](c2cccs2)N2CCCC2)cc1 ZINC000054529062 849883936 /nfs/dbraw/zinc/88/39/36/849883936.db2.gz LTHPIFMJLIBQNX-GOSISDBHSA-N 0 3 416.547 4.299 20 0 HIADHN CCOC(=O)N(C)c1ccc(NC(=O)NC[C@@H](c2ccc(CC)cc2)N(C)C)cc1 ZINC000054529027 849883998 /nfs/dbraw/zinc/88/39/98/849883998.db2.gz FUOXVSNWBKUDBC-NRFANRHFSA-N 0 3 412.534 4.266 20 0 HIADHN CCOC(=O)N(C)c1ccc(NC(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)cc1 ZINC000054529501 849884272 /nfs/dbraw/zinc/88/42/72/849884272.db2.gz FILDVGMLTWFWNY-FXAWDEMLSA-N 0 3 410.518 4.236 20 0 HIADHN CCCN(CCN1CCN(CC)CC1)C(=O)c1cc(C(C)C)cc(C(C)C)c1O ZINC000436929704 862107626 /nfs/dbraw/zinc/10/76/26/862107626.db2.gz DFOLXPIPCCZQOR-UHFFFAOYSA-N 0 3 403.611 4.129 20 0 HIADHN COc1ccc(NC(=O)[C@@H](C)N[C@@H](C)c2ccc(OCc3cccnc3)cc2)cc1 ZINC000056144350 850253861 /nfs/dbraw/zinc/25/38/61/850253861.db2.gz WWKBVPSBORYLHE-ZWKOTPCHSA-N 0 3 405.498 4.347 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)C2(c3cccc(Cl)c3)CCOCC2)C1 ZINC000056168873 850268417 /nfs/dbraw/zinc/26/84/17/850268417.db2.gz QWEKPFQERBXRLQ-AVRDEDQJSA-N 0 3 412.961 4.340 20 0 HIADHN CCN1CCN(c2ccc(N[C@H](C)C(=O)Nc3cc(Cl)ccc3F)c(C)c2)CC1 ZINC000056170397 850270011 /nfs/dbraw/zinc/27/00/11/850270011.db2.gz RQDLEIHXBOJELV-MRXNPFEDSA-N 0 3 418.944 4.369 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(NC(=O)c2ccc(F)cc2)cc1)C(=O)N1CCC(C)CC1 ZINC000056207180 850283349 /nfs/dbraw/zinc/28/33/49/850283349.db2.gz UFADYNFGZMNUNX-QZTJIDSGSA-N 0 3 411.521 4.376 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(NC(=O)c2ccc(F)cc2)cc1)C(=O)N1CCC(C)CC1 ZINC000056207179 850283723 /nfs/dbraw/zinc/28/37/23/850283723.db2.gz UFADYNFGZMNUNX-ROUUACIJSA-N 0 3 411.521 4.376 20 0 HIADHN CC(C)COC1CCN(C(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)CC1 ZINC000056360514 850334202 /nfs/dbraw/zinc/33/42/02/850334202.db2.gz UNNILQIKAGLBKC-FQEVSTJZSA-N 0 3 407.624 4.368 20 0 HIADHN CCN(CC)C(=O)c1ccccc1NC(=O)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000056532776 850385657 /nfs/dbraw/zinc/38/56/57/850385657.db2.gz XNUDOABTXPNWLB-QFIPXVFZSA-N 0 3 408.546 4.127 20 0 HIADHN CC(C)(CNC(=O)Nc1ccc(-c2csnn2)cc1)N1CCc2ccccc2C1 ZINC000056787825 850481999 /nfs/dbraw/zinc/48/19/99/850481999.db2.gz RFPWRWPWBFIACS-UHFFFAOYSA-N 0 3 407.543 4.164 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)N[C@H]1CCOc2c(Cl)cccc21 ZINC000056806287 850490398 /nfs/dbraw/zinc/49/03/98/850490398.db2.gz WHQCNXCRMXZXIA-IBGZPJMESA-N 0 3 405.901 4.076 20 0 HIADHN Cc1nc(Cc2ccc(F)cc2)sc1C(=O)N(CC(C)C)C1CCN(C)CC1 ZINC000056986487 850529859 /nfs/dbraw/zinc/52/98/59/850529859.db2.gz AHWUSPXLTQDCFF-UHFFFAOYSA-N 0 3 403.567 4.374 20 0 HIADHN C[C@H]1C[C@H]1c1ccc(CCC(=O)NCCCCN2CCN(c3ccccc3)CC2)o1 ZINC000057113244 850548444 /nfs/dbraw/zinc/54/84/44/850548444.db2.gz GGKBICXFDLCQKE-NZQKXSOJSA-N 0 3 409.574 4.054 20 0 HIADHN COc1cc(-c2nc(CN3CCC[C@]3(CO)Cc3ccccc3)cs2)ccc1O ZINC000436962334 862144324 /nfs/dbraw/zinc/14/43/24/862144324.db2.gz NOTAAKZFEPCJMR-HSZRJFAPSA-N 0 3 410.539 4.094 20 0 HIADHN Cc1n[nH]c(C)c1NC(=O)CN(Cc1ccc2c(c1)OCO2)[C@@H]1CCC[C@H](C)[C@@H]1C ZINC000057622039 850681618 /nfs/dbraw/zinc/68/16/18/850681618.db2.gz QCKDPFDIASNNDJ-YZVOILCLSA-N 0 3 412.534 4.021 20 0 HIADHN COc1ccc([C@H](CNC(=O)N[C@@H]2CCSc3ccccc32)N2CCCC2)cc1 ZINC000057769055 850711501 /nfs/dbraw/zinc/71/15/01/850711501.db2.gz KGWUPILNEPQJGG-RTWAWAEBSA-N 0 3 411.571 4.368 20 0 HIADHN Cc1sc2ncnc(SCCC(=O)N(CCN(C)C)c3ccccc3)c2c1C ZINC000058297195 850794907 /nfs/dbraw/zinc/79/49/07/850794907.db2.gz DJSOTYJHEADOKA-UHFFFAOYSA-N 0 3 414.600 4.385 20 0 HIADHN CN(C)CCN(C(=O)c1nc(-c2cccs2)n(-c2ccccc2)n1)c1ccccc1 ZINC000058297697 850796133 /nfs/dbraw/zinc/79/61/33/850796133.db2.gz QUNOJYVVNWTDPG-UHFFFAOYSA-N 0 3 417.538 4.204 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)c1[nH]c2ccccc2c1Cl ZINC000058490642 850837625 /nfs/dbraw/zinc/83/76/25/850837625.db2.gz AXKFZHJAHWSMDA-UHFFFAOYSA-N 0 3 410.949 4.154 20 0 HIADHN COc1ccccc1-c1nc(C(=O)N(CCc2ccccc2)CCN(C)C)cs1 ZINC000058685048 850888103 /nfs/dbraw/zinc/88/81/03/850888103.db2.gz YLVFNIAKAAJMER-UHFFFAOYSA-N 0 3 409.555 4.065 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1ccc(C(F)(F)F)nc1C)c1cccc(OC)c1 ZINC000058698913 850893914 /nfs/dbraw/zinc/89/39/14/850893914.db2.gz TXTPSJOTPLUZHE-SFHVURJKSA-N 0 3 409.452 4.230 20 0 HIADHN O=C(CCN1CCCC[C@@H]1CNC(=O)Nc1ccccc1)Nc1ccccc1Cl ZINC000058754132 850912986 /nfs/dbraw/zinc/91/29/86/850912986.db2.gz ANLXFUUROSEWCO-GOSISDBHSA-N 0 3 414.937 4.345 20 0 HIADHN CC(C)Cn1cc(C(=O)Nc2ccc3oc(=O)n(CCN(C)C)c3c2)c2ccccc21 ZINC000059004065 850977702 /nfs/dbraw/zinc/97/77/02/850977702.db2.gz UBWQUJCIYOZLGF-UHFFFAOYSA-N 0 3 420.513 4.019 20 0 HIADHN CCCN(CC(=O)Nc1cccc(C(=O)N(CC)CC)c1)[C@@H]1CCc2ccccc2C1 ZINC000060039723 851033920 /nfs/dbraw/zinc/03/39/20/851033920.db2.gz KLYWZGOZJXWCKT-XMMPIXPASA-N 0 3 421.585 4.377 20 0 HIADHN Cc1ccc(C(=O)CCC(=O)Nc2ccc(CCN3CCSCC3)cc2)cc1C ZINC000060240548 851054630 /nfs/dbraw/zinc/05/46/30/851054630.db2.gz ZVZOCJLNJKDKAG-UHFFFAOYSA-N 0 3 410.583 4.496 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)CCN(Cc1cccc(F)c1)C[C@H]1CCCO1 ZINC000060269415 851057015 /nfs/dbraw/zinc/05/70/15/851057015.db2.gz QTDJUBYTRTYDGL-LJQANCHMSA-N 0 3 420.912 4.498 20 0 HIADHN CN1CCN(Cc2ccc(CNC(=S)Nc3cc(Cl)cc(Cl)c3)cc2)CC1 ZINC000060432809 851097692 /nfs/dbraw/zinc/09/76/92/851097692.db2.gz CJBVQKARGXVDGQ-UHFFFAOYSA-N 0 3 423.413 4.227 20 0 HIADHN CCc1cccc(CC)c1NC(=S)NCc1ccc(CN2CCN(C)CC2)cc1 ZINC000060432863 851097792 /nfs/dbraw/zinc/09/77/92/851097792.db2.gz WIMXOCUNUXDXCV-UHFFFAOYSA-N 0 3 410.631 4.045 20 0 HIADHN O=C(NCc1sccc1Br)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000060454993 851104773 /nfs/dbraw/zinc/10/47/73/851104773.db2.gz UJLQNCXYGQSZRA-AWEZNQCLSA-N 0 3 411.340 4.178 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2CNCCNC(=O)c2ccccc2F)o1 ZINC000060527306 851134699 /nfs/dbraw/zinc/13/46/99/851134699.db2.gz MCMCMILPRDHZHN-UHFFFAOYSA-N 0 3 418.472 4.099 20 0 HIADHN O=C(NCc1cccc(Br)c1)NC[C@H](c1ccccc1)N1CCCC1 ZINC000060564651 851148552 /nfs/dbraw/zinc/14/85/52/851148552.db2.gz YOVKCMHNGASXAR-LJQANCHMSA-N 0 3 402.336 4.085 20 0 HIADHN FC(F)Oc1ccc(CNC[C@H](c2ccco2)N2CCCC2)c(OC(F)F)c1 ZINC000060829424 851225117 /nfs/dbraw/zinc/22/51/17/851225117.db2.gz ASMMKCJZKSJFNT-OAHLLOKOSA-N 0 3 402.388 4.409 20 0 HIADHN CC(=O)Nc1ccc(NC(=S)Nc2ccc(CCN3CCSCC3)cc2)cc1 ZINC000060837497 851227329 /nfs/dbraw/zinc/22/73/29/851227329.db2.gz CNDXCFMMRJXFEJ-UHFFFAOYSA-N 0 3 414.600 4.045 20 0 HIADHN CC(C)Cc1ccc(S(=O)(=O)NCC2CCN(Cc3cccs3)CC2)cc1 ZINC000060923299 851249215 /nfs/dbraw/zinc/24/92/15/851249215.db2.gz DFUVRBAZGSTUFG-UHFFFAOYSA-N 0 3 406.617 4.137 20 0 HIADHN Cc1cc(S(=O)(=O)NCC2CCN(Cc3cccs3)CC2)ccc1OC(C)C ZINC000060923309 851249685 /nfs/dbraw/zinc/24/96/85/851249685.db2.gz UKCGOHKUHGXSLT-UHFFFAOYSA-N 0 3 422.616 4.034 20 0 HIADHN CN(C[C@@H]1CCN(Cc2ccccc2)C1)C(=O)CCC(=O)c1ccc2c(c1)CCC2 ZINC000437035496 862222489 /nfs/dbraw/zinc/22/24/89/862222489.db2.gz HJHUJISDJDZWQF-NRFANRHFSA-N 0 3 404.554 4.119 20 0 HIADHN CN(C)[C@@H](CNC(=O)NCc1cccc(COCc2ccco2)c1)c1ccccc1 ZINC000060954867 851257469 /nfs/dbraw/zinc/25/74/69/851257469.db2.gz YIZJVGGYAGCZEE-QHCPKHFHSA-N 0 3 407.514 4.099 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)Nc3ccc(N4CCCC4)c(F)c3)cc2)CC1 ZINC000061167770 851310111 /nfs/dbraw/zinc/31/01/11/851310111.db2.gz KRANMFPKNQKCOA-UHFFFAOYSA-N 0 3 410.537 4.209 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)Nc3cccc(N4CCCCC4)c3)cc2)CC1 ZINC000061191494 851314087 /nfs/dbraw/zinc/31/40/87/851314087.db2.gz GSGWGRUIPMQHAJ-UHFFFAOYSA-N 0 3 406.574 4.460 20 0 HIADHN CN(C)Cc1ccccc1CNC(=O)CCc1nc2ccccc2n1-c1ccccc1 ZINC000061231754 851324510 /nfs/dbraw/zinc/32/45/10/851324510.db2.gz HCDUTSAGLIEUPO-UHFFFAOYSA-N 0 3 412.537 4.336 20 0 HIADHN CC1=NN(c2ccc(C(=O)Nc3ccc(CCN4CCSCC4)cc3)cc2)CC1 ZINC000061287771 851339366 /nfs/dbraw/zinc/33/93/66/851339366.db2.gz AKJGLNVSPJOODP-UHFFFAOYSA-N 0 3 408.571 4.116 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)c1cc(-c2ccccc2F)on1 ZINC000061287759 851339699 /nfs/dbraw/zinc/33/96/99/851339699.db2.gz QFNPVOOETAICDT-UHFFFAOYSA-N 0 3 411.502 4.324 20 0 HIADHN COC(=O)c1cc(NC(=O)N2CCCN(Cc3ccccc3C)CC2)ccc1Cl ZINC000061423070 851372857 /nfs/dbraw/zinc/37/28/57/851372857.db2.gz RQHRHMBSRNGTPR-UHFFFAOYSA-N 0 3 415.921 4.175 20 0 HIADHN CCc1c(C(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)cnn1-c1ccccc1 ZINC000061502874 851391605 /nfs/dbraw/zinc/39/16/05/851391605.db2.gz IUTALUPMRCKJHT-XMMPIXPASA-N 0 3 402.542 4.310 20 0 HIADHN Cc1c(C(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)cnn1-c1ccccc1C ZINC000061502846 851391647 /nfs/dbraw/zinc/39/16/47/851391647.db2.gz PAQVUAYAXWDVDZ-XMMPIXPASA-N 0 3 402.542 4.364 20 0 HIADHN Fc1ccc([C@H](CNCc2ccc(CSC(F)F)o2)N2CCOCC2)cc1 ZINC000061555239 851403482 /nfs/dbraw/zinc/40/34/82/851403482.db2.gz FWMVJHYYNNAXPV-SFHVURJKSA-N 0 3 400.466 4.038 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2ccc(C(=O)N3CCCC3)cc2)N2CCCC2)cc1 ZINC000061749140 851439168 /nfs/dbraw/zinc/43/91/68/851439168.db2.gz DBYPNRSFYOITGH-QHCPKHFHSA-N 0 3 420.557 4.190 20 0 HIADHN CCN(Cc1ccc(OC)c(OC)c1)C(=O)CN1CCC(Cc2ccccc2)CC1 ZINC000061757807 851440855 /nfs/dbraw/zinc/44/08/55/851440855.db2.gz GIQFKLCCOQJQPJ-UHFFFAOYSA-N 0 3 410.558 4.007 20 0 HIADHN Cc1cccc(OC[C@@H](C)NC(=O)Nc2ccc(CCN3CCSCC3)cc2)c1 ZINC000061791081 851453474 /nfs/dbraw/zinc/45/34/74/851453474.db2.gz MOXSTWMDJILZFO-LJQANCHMSA-N 0 3 413.587 4.175 20 0 HIADHN Cc1cc(C)cc(OCCNC(=O)Nc2ccc(CCN3CCSCC3)cc2)c1 ZINC000061791016 851454152 /nfs/dbraw/zinc/45/41/52/851454152.db2.gz KZUYUIACKNIUCN-UHFFFAOYSA-N 0 3 413.587 4.095 20 0 HIADHN CN(CCc1ccc(F)cc1)C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000061791031 851454419 /nfs/dbraw/zinc/45/44/19/851454419.db2.gz CPSYGRWFOUZPBN-UHFFFAOYSA-N 0 3 401.551 4.123 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)C(=O)Nc1cc(Cl)ccc1Cl)c1ccccc1 ZINC000061878757 851466991 /nfs/dbraw/zinc/46/69/91/851466991.db2.gz YULWKUVAZUZYJZ-SFHVURJKSA-N 0 3 408.329 4.131 20 0 HIADHN Fc1ccc(-c2n[nH]cc2CNCc2cc(Br)c3c(c2)OCCO3)cc1 ZINC000062256662 851517334 /nfs/dbraw/zinc/51/73/34/851517334.db2.gz BHVAEKXIBBZHRN-UHFFFAOYSA-N 0 3 418.266 4.039 20 0 HIADHN COc1ccc2nc(NC(=O)N(CCN(C)C)Cc3ccc(F)c(F)c3)sc2c1 ZINC000062367949 851530408 /nfs/dbraw/zinc/53/04/08/851530408.db2.gz RDFPJGWQGRKUOW-UHFFFAOYSA-N 0 3 420.485 4.179 20 0 HIADHN Cc1nc2ccc(NC(=O)N(CCN(C)C)Cc3ccc(F)c(F)c3)cc2s1 ZINC000062375151 851532649 /nfs/dbraw/zinc/53/26/49/851532649.db2.gz JVAMBLGRYSYRHP-UHFFFAOYSA-N 0 3 404.486 4.479 20 0 HIADHN CCOc1ccc(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2F)cc1OCC ZINC000062375958 851532853 /nfs/dbraw/zinc/53/28/53/851532853.db2.gz CMNHSWUOLRNKBU-UHFFFAOYSA-N 0 3 421.488 4.358 20 0 HIADHN CCOc1ccc(OCC)c(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2F)c1 ZINC000062377765 851534147 /nfs/dbraw/zinc/53/41/47/851534147.db2.gz RWYBEHHXKKBNFJ-UHFFFAOYSA-N 0 3 421.488 4.358 20 0 HIADHN CCCOC(=O)c1ccc(NC(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)cc1 ZINC000062390387 851539357 /nfs/dbraw/zinc/53/93/57/851539357.db2.gz QDQRCQUCEBSRCX-UHFFFAOYSA-N 0 3 419.472 4.127 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)Nc1ccc(-c2csnn2)cc1 ZINC000062410639 851545908 /nfs/dbraw/zinc/54/59/08/851545908.db2.gz PYFPBSXUSMXFJC-UHFFFAOYSA-N 0 3 417.485 4.079 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)NCc1csc2ccccc12 ZINC000062486803 851563210 /nfs/dbraw/zinc/56/32/10/851563210.db2.gz LGPAEQQMQOPUPL-UHFFFAOYSA-N 0 3 403.498 4.453 20 0 HIADHN CCOc1ccc([C@@H](C)NC(=O)N(CCN(C)C)Cc2cccc(F)c2)cc1OC ZINC000062487817 851564226 /nfs/dbraw/zinc/56/42/26/851564226.db2.gz OIKDRDLBOXNJHT-QGZVFWFLSA-N 0 3 417.525 4.067 20 0 HIADHN CCOc1ccc(C(=O)CCC(=O)NCC2CCN(Cc3ccccc3)CC2)cc1 ZINC000063081328 851612460 /nfs/dbraw/zinc/61/24/60/851612460.db2.gz KIBXXBZSTCVWRK-UHFFFAOYSA-N 0 3 408.542 4.077 20 0 HIADHN Fc1ccc2c(c1)[C@@H](NC(=S)NC1CCN(Cc3ccccc3)CC1)CCS2 ZINC000063145783 851621603 /nfs/dbraw/zinc/62/16/03/851621603.db2.gz YJLZKZMPJGJKKZ-FQEVSTJZSA-N 0 3 415.603 4.491 20 0 HIADHN S=C(NC1CCN(Cc2ccccc2)CC1)N(Cc1ccccc1)C[C@@H]1CCCO1 ZINC000063150753 851623832 /nfs/dbraw/zinc/62/38/32/851623832.db2.gz CHLUCRYKZWADSW-DEOSSOPVSA-N 0 3 423.626 4.207 20 0 HIADHN COc1ccc(CCN[C@H](C(=O)Nc2ccc(F)cc2)c2ccccc2)c(OC)c1 ZINC000063774054 851759966 /nfs/dbraw/zinc/75/99/66/851759966.db2.gz UEJSXOGCLNHARV-QHCPKHFHSA-N 0 3 408.473 4.355 20 0 HIADHN COC(=O)COc1c(C)cc(CNCc2c(C)nn(Cc3ccccc3)c2C)cc1C ZINC000063903621 851789432 /nfs/dbraw/zinc/78/94/32/851789432.db2.gz NWKMOMQOKUHKKI-UHFFFAOYSA-N 0 3 421.541 4.007 20 0 HIADHN COc1ccc(Oc2cc(CNC(=O)c3cccc(CN4CCCC4)c3)ccn2)cc1 ZINC000064026681 851817446 /nfs/dbraw/zinc/81/74/46/851817446.db2.gz YEBVCSKSYYITFG-UHFFFAOYSA-N 0 3 417.509 4.408 20 0 HIADHN Cc1ccc2nc(COC(=O)C3CCN(c4cc(Cl)ccc4Cl)C3=O)cn2c1 ZINC000064072360 851824179 /nfs/dbraw/zinc/82/41/79/851824179.db2.gz JWTUIYNWFHTALK-HNNXBMFYSA-N 0 3 418.280 4.046 20 0 HIADHN CN(C(=O)CN1CCN(CC2CCCCC2)CC1)C(c1ccccc1)c1ccccc1 ZINC000064129750 851833814 /nfs/dbraw/zinc/83/38/14/851833814.db2.gz BHAAMFMCBJESDF-UHFFFAOYSA-N 0 3 419.613 4.432 20 0 HIADHN COCCN(Cc1cccs1)C(=O)NC[C@@H](c1ccc(C)cc1)N1CCCC1 ZINC000064237540 851855380 /nfs/dbraw/zinc/85/53/80/851855380.db2.gz NYVUTZJVPNSOCX-NRFANRHFSA-N 0 3 401.576 4.052 20 0 HIADHN C[C@H]1CCCCN1CCNC(=O)C(=O)Nc1ccc(Oc2cccc(Cl)c2)cc1 ZINC000064269599 851860719 /nfs/dbraw/zinc/86/07/19/851860719.db2.gz LSJRDYLONVEAFT-INIZCTEOSA-N 0 3 415.921 4.061 20 0 HIADHN O=C(Nc1cccc(-n2cccn2)c1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000064336740 851874627 /nfs/dbraw/zinc/87/46/27/851874627.db2.gz VGAUQJSIKOLAOG-OAQYLSRUSA-N 0 3 414.431 4.265 20 0 HIADHN COc1cccc(CN(Cc2ccc(OCc3nccn3C)cc2)C[C@@H]2CCCO2)c1 ZINC000064400118 851889213 /nfs/dbraw/zinc/88/92/13/851889213.db2.gz XHJIVPUAKBMLGW-DEOSSOPVSA-N 0 3 421.541 4.189 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)[C@H]1C[C@H]1c1cccc(Br)c1 ZINC000064497727 851913895 /nfs/dbraw/zinc/91/38/95/851913895.db2.gz SAWKVKLBRCOZQN-PMACEKPBSA-N 0 3 419.338 4.282 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3ccc(Br)c(F)c3)c(C)c2)CC1 ZINC000064645334 851945981 /nfs/dbraw/zinc/94/59/81/851945981.db2.gz MVVMPMNUPJQYON-UHFFFAOYSA-N 0 3 420.326 4.291 20 0 HIADHN C[C@H](CCc1ccco1)NC(=O)N(CCN(C)C)Cc1ccc(C(F)(F)F)cc1 ZINC000064753857 851977705 /nfs/dbraw/zinc/97/77/05/851977705.db2.gz FYQOKGJEXYGDHR-MRXNPFEDSA-N 0 3 411.468 4.393 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Cc1cn2ccsc2n1)c1ccc(C(F)(F)F)cc1 ZINC000065217595 852088508 /nfs/dbraw/zinc/08/85/08/852088508.db2.gz RJSCOVQBFKQFQF-KRWDZBQOSA-N 0 3 424.492 4.156 20 0 HIADHN CCCOc1ccc(OCCN2CCC(NC(=O)c3ccc(C)s3)CC2)cc1 ZINC000065262046 852094028 /nfs/dbraw/zinc/09/40/28/852094028.db2.gz ZTUPJDQZPVDQTF-UHFFFAOYSA-N 0 3 402.560 4.119 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCCCCOCc3ccccc3)c(C)c2)CC1 ZINC000065276776 852096249 /nfs/dbraw/zinc/09/62/49/852096249.db2.gz FRBUSLMCMQBZGE-UHFFFAOYSA-N 0 3 424.589 4.255 20 0 HIADHN Cc1c(Cl)cccc1NC(=O)[C@H](C)N[C@H](C)c1ccc(N2CCOCC2)cc1 ZINC000065278400 852098236 /nfs/dbraw/zinc/09/82/36/852098236.db2.gz FKFUOUFRTNBLDH-SJORKVTESA-N 0 3 401.938 4.163 20 0 HIADHN O=C(Nc1ccccc1C(=O)N1CCCCC1)N1CCN(CC2CCCCC2)CC1 ZINC000065358471 852112275 /nfs/dbraw/zinc/11/22/75/852112275.db2.gz KADFWEAONILFND-UHFFFAOYSA-N 0 3 412.578 4.043 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2ccc(NC(=O)c3ccco3)cc2)N(C)C)cc1 ZINC000065360130 852113358 /nfs/dbraw/zinc/11/33/58/852113358.db2.gz MEVSPYQQIPUVBQ-FQEVSTJZSA-N 0 3 406.486 4.265 20 0 HIADHN O=C(NC[C@H]1CCCCN1Cc1ccccc1)Nc1cccc(C(=O)N2CCCC2)c1 ZINC000065360811 852113418 /nfs/dbraw/zinc/11/34/18/852113418.db2.gz WGLZGGTWJBIYJC-HSZRJFAPSA-N 0 3 420.557 4.099 20 0 HIADHN Cc1cc(N2CCSCC2)ccc1NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000065378158 852117847 /nfs/dbraw/zinc/11/78/47/852117847.db2.gz NOHRUGISKXARQG-NRFANRHFSA-N 0 3 424.614 4.334 20 0 HIADHN COCCOc1c(Cl)cccc1NC(=O)N1CCN(CC2CCCCC2)CC1 ZINC000065420099 852126609 /nfs/dbraw/zinc/12/66/09/852126609.db2.gz YPGMGJUAYSXGFC-UHFFFAOYSA-N 0 3 409.958 4.095 20 0 HIADHN CCc1ccc([C@H](CNC(=O)Nc2ccc(C(=O)N[C@H](C)CC)cc2)N(C)C)cc1 ZINC000065458592 852142736 /nfs/dbraw/zinc/14/27/36/852142736.db2.gz JPGLSPSNYCDWLM-VGSWGCGISA-N 0 3 410.562 4.202 20 0 HIADHN COc1cccc(CN2CCC(NC(=O)c3cc(C)n(CC(F)(F)F)c3C)CC2)c1 ZINC000065506382 852161155 /nfs/dbraw/zinc/16/11/55/852161155.db2.gz CCYGDKSITKTZGW-UHFFFAOYSA-N 0 3 423.479 4.070 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N3CCC(Cc4ccccc4)CC3)cc2)CC1 ZINC000065742105 852241578 /nfs/dbraw/zinc/24/15/78/852241578.db2.gz VZAASLGDJYSKCD-UHFFFAOYSA-N 0 3 405.586 4.312 20 0 HIADHN CN(C)CCN(C(=O)CCCc1nc(-c2ccc(Cl)cc2)no1)C1CCCCC1 ZINC000065746594 852243590 /nfs/dbraw/zinc/24/35/90/852243590.db2.gz WNUQJHHPGIUCPY-UHFFFAOYSA-N 0 3 418.969 4.436 20 0 HIADHN Cc1noc(CSc2ccccc2C(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)n1 ZINC000065826914 852270714 /nfs/dbraw/zinc/27/07/14/852270714.db2.gz OFINCRQTOWQKCR-VQIMIIECSA-N 0 3 422.554 4.236 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)CCOc2ccccc2Br)C1 ZINC000065826955 852270889 /nfs/dbraw/zinc/27/08/89/852270889.db2.gz YSMKDEURXZLJTI-AEFFLSMTSA-N 0 3 417.347 4.170 20 0 HIADHN CC[C@@H](NC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1)c1ccc2c(c1)OCCO2 ZINC000065875209 852297489 /nfs/dbraw/zinc/29/74/89/852297489.db2.gz JKEIPABPRKHTKS-PZJWPPBQSA-N 0 3 412.505 4.076 20 0 HIADHN COCCCOc1ccccc1NC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000065881055 852299559 /nfs/dbraw/zinc/29/95/59/852299559.db2.gz NUUKVRBETJCBMD-IBGZPJMESA-N 0 3 400.494 4.092 20 0 HIADHN Cc1ccc(-c2nc(CC(=O)N(CCN(C)C)Cc3ccc(F)cc3)cs2)cc1 ZINC000065931733 852322033 /nfs/dbraw/zinc/32/20/33/852322033.db2.gz ZUQWOCXNICUXAH-UHFFFAOYSA-N 0 3 411.546 4.391 20 0 HIADHN COc1ccc(OCc2ccccn2)c(CNC[C@@H](c2ccc(F)cc2)N(C)C)c1 ZINC000065932470 852322348 /nfs/dbraw/zinc/32/23/48/852322348.db2.gz FIAQWZYCVYUYNQ-QHCPKHFHSA-N 0 3 409.505 4.201 20 0 HIADHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)c1cnc(C(C)(C)C)s1 ZINC000065931816 852322415 /nfs/dbraw/zinc/32/24/15/852322415.db2.gz INYQJRCOPTXSDH-UHFFFAOYSA-N 0 3 424.408 4.407 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)Cc1csc(Cc2ccccc2)n1 ZINC000065931590 852322724 /nfs/dbraw/zinc/32/27/24/852322724.db2.gz AZDKPROJGUQCJT-UHFFFAOYSA-N 0 3 411.546 4.006 20 0 HIADHN CC(C)NC(=O)Nc1cccc(C(=O)N(CCN(C)C)Cc2cccc(Cl)c2)c1 ZINC000065936719 852324632 /nfs/dbraw/zinc/32/46/32/852324632.db2.gz FHFRBRGGSKFFMQ-UHFFFAOYSA-N 0 3 416.953 4.074 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)CCc1cnn(-c2ccccc2)c1 ZINC000065936993 852325263 /nfs/dbraw/zinc/32/52/63/852325263.db2.gz ISVCLVLNKMYAAZ-UHFFFAOYSA-N 0 3 410.949 4.049 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)c1cnc(-c2ccccc2F)s1 ZINC000065938361 852326355 /nfs/dbraw/zinc/32/63/55/852326355.db2.gz OURSUCMTDXJTSS-UHFFFAOYSA-N 0 3 419.472 4.431 20 0 HIADHN COc1ccc(C)cc1CC(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1 ZINC000065939024 852327582 /nfs/dbraw/zinc/32/75/82/852327582.db2.gz XSERMTWFATXENH-UHFFFAOYSA-N 0 3 408.464 4.155 20 0 HIADHN COc1ccc(CCC(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)cc1 ZINC000065938996 852327830 /nfs/dbraw/zinc/32/78/30/852327830.db2.gz DVCBOCRMJIGYRX-UHFFFAOYSA-N 0 3 408.464 4.237 20 0 HIADHN Cc1cccc(NC(=O)[C@@H]2CCCN(Cc3ccc(OCc4ccccn4)cc3)C2)n1 ZINC000065950845 852330491 /nfs/dbraw/zinc/33/04/91/852330491.db2.gz SOJMJRFOVJSKTC-OAQYLSRUSA-N 0 3 416.525 4.215 20 0 HIADHN Cc1ccc(NC(=O)C2CCN(Cc3ccc(OCc4ccccn4)cc3)CC2)nc1 ZINC000065951262 852331035 /nfs/dbraw/zinc/33/10/35/852331035.db2.gz ALXZLZXSIAUGIL-UHFFFAOYSA-N 0 3 416.525 4.215 20 0 HIADHN CCOC(=O)c1ccc(NC(=O)N(CCN(C)C)Cc2cccc(Cl)c2)cc1 ZINC000065984068 852340432 /nfs/dbraw/zinc/34/04/32/852340432.db2.gz JHOHGIPIJVFTPD-UHFFFAOYSA-N 0 3 403.910 4.112 20 0 HIADHN O=C(NCc1ccccc1)c1ccc(NC(=O)c2cccc(CN3CCCC3)c2)cc1 ZINC000066051059 852365542 /nfs/dbraw/zinc/36/55/42/852365542.db2.gz JICXONOTYBBYLU-UHFFFAOYSA-N 0 3 413.521 4.465 20 0 HIADHN CC1CCN([C@@H](CNC(=O)[C@@H]2CCCN2C(=O)OC(C)(C)C)c2cccs2)CC1 ZINC000069210723 852388090 /nfs/dbraw/zinc/38/80/90/852388090.db2.gz HSBWRDALYAMXEC-ROUUACIJSA-N 0 3 421.607 4.037 20 0 HIADHN COc1cccc(CCC(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)c1OC ZINC000069549918 852397385 /nfs/dbraw/zinc/39/73/85/852397385.db2.gz IMSHHVFKMTXHTI-IBGZPJMESA-N 0 3 416.587 4.287 20 0 HIADHN C[C@H](NC(=O)NC[C@H](c1ccccc1)N1CCCC1)c1ccc(OC(F)F)cc1 ZINC000071913301 852429672 /nfs/dbraw/zinc/42/96/72/852429672.db2.gz GIOLKJKUEKTGSC-OXJNMPFZSA-N 0 3 403.473 4.485 20 0 HIADHN Cc1c(Br)c2ccccc2n1CC(=O)NCc1ccccc1CN(C)C ZINC000071939621 852438821 /nfs/dbraw/zinc/43/88/21/852438821.db2.gz CKDGNMZWNOVTRO-UHFFFAOYSA-N 0 3 414.347 4.090 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)Nc1ccc(C(=O)N2CCCCCC2)cc1 ZINC000071943697 852440521 /nfs/dbraw/zinc/44/05/21/852440521.db2.gz AFXFFZLFMPFXPB-UHFFFAOYSA-N 0 3 422.573 4.299 20 0 HIADHN Cc1cccc([C@@H]2CCCN2CC(=O)N2CCC[C@@H]2c2ccc3c(c2)OCCO3)c1 ZINC000071987797 852454553 /nfs/dbraw/zinc/45/45/53/852454553.db2.gz QOJSHELBWRHOTF-FCHUYYIVSA-N 0 3 406.526 4.267 20 0 HIADHN CC(C)C(=O)Nc1ccc(C(=O)NC[C@H](c2ccccc2)N2CCC(C)CC2)cc1 ZINC000072007044 852462176 /nfs/dbraw/zinc/46/21/76/852462176.db2.gz DERCLGMTQJTEST-HSZRJFAPSA-N 0 3 407.558 4.484 20 0 HIADHN O=C(Nc1nc(-c2ccc3c(c2)OCCO3)cs1)c1cccc(CN2CCCC2)c1 ZINC000072014850 852467033 /nfs/dbraw/zinc/46/70/33/852467033.db2.gz ARERTQMUYZOAIL-UHFFFAOYSA-N 0 3 421.522 4.429 20 0 HIADHN COc1c(Cl)cc(Cl)cc1CNC[C@@H](c1ccc(F)cc1)N1CCOCC1 ZINC000072043941 852483661 /nfs/dbraw/zinc/48/36/61/852483661.db2.gz FEMTYAHATSNJMO-IBGZPJMESA-N 0 3 413.320 4.304 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)NC[C@H](c2ccc(C)cc2)N(C)C)c(OC)c1 ZINC000072044297 852484604 /nfs/dbraw/zinc/48/46/04/852484604.db2.gz KXFWRVYDMVLMSW-FCHUYYIVSA-N 0 3 411.546 4.162 20 0 HIADHN CCOc1c(Br)cc(Br)cc1CNCC1(O)CCCC1 ZINC000096479254 852548873 /nfs/dbraw/zinc/54/88/73/852548873.db2.gz IBGGLZUSHABJGV-UHFFFAOYSA-N 0 3 407.146 4.005 20 0 HIADHN Cc1cc(C(=O)NC[C@H](c2ccccc2)N2CCCC2)c(C)n1Cc1ccccn1 ZINC000097288292 852598805 /nfs/dbraw/zinc/59/88/05/852598805.db2.gz PNTCSKFJXMATRZ-XMMPIXPASA-N 0 3 402.542 4.115 20 0 HIADHN CCN1CCN(c2ccc(CNCc3ccc(-c4ccccc4Cl)o3)cn2)CC1 ZINC000097357136 852604751 /nfs/dbraw/zinc/60/47/51/852604751.db2.gz SHNRMXTYSOOCLW-UHFFFAOYSA-N 0 3 410.949 4.427 20 0 HIADHN CCOc1cccc2cc([C@H](C)NC(=O)N[C@H]3CCN(Cc4ccccc4)C3)oc21 ZINC000107708930 852788413 /nfs/dbraw/zinc/78/84/13/852788413.db2.gz LXEDRLGZTFFJQL-PXNSSMCTSA-N 0 3 407.514 4.466 20 0 HIADHN Cc1nn(C(C)(C)C)c2nc(C3CC3)cc(C(=O)NC[C@H](c3ccccc3)N(C)C)c12 ZINC000107766188 852793988 /nfs/dbraw/zinc/79/39/88/852793988.db2.gz JLYCZHSIOFEVIZ-OAQYLSRUSA-N 0 3 419.573 4.405 20 0 HIADHN C[C@@H](NC(=O)N1CCCN(Cc2ccccc2)CC1)c1ccc(Br)cc1 ZINC000107834565 852801800 /nfs/dbraw/zinc/80/18/00/852801800.db2.gz NSORHAXOWARIND-QGZVFWFLSA-N 0 3 416.363 4.428 20 0 HIADHN CC[C@H](CNC(=O)N1CCC[C@H]1c1cccc(OC)c1)N1CCc2ccccc2C1 ZINC000107967687 852813681 /nfs/dbraw/zinc/81/36/81/852813681.db2.gz FNTLDUCDMDVQHH-VWNXMTODSA-N 0 3 407.558 4.379 20 0 HIADHN O=C(NCCCCN1CCN(Cc2ccccc2)CC1)c1cc(Cl)ccc1Cl ZINC000108482209 852854484 /nfs/dbraw/zinc/85/44/84/852854484.db2.gz OOBSUBKMTYSXOW-UHFFFAOYSA-N 0 3 420.384 4.321 20 0 HIADHN O=C(CNC1(c2cccc(Br)c2)CCOCC1)NCCC1=CCCCC1 ZINC000108815482 852882466 /nfs/dbraw/zinc/88/24/66/852882466.db2.gz KIDJCERVSMNXQI-UHFFFAOYSA-N 0 3 421.379 4.051 20 0 HIADHN c1csc(CCN2CCN(c3nc(-c4cccnc4)nc4ccccc43)CC2)c1 ZINC000108931698 852894670 /nfs/dbraw/zinc/89/46/70/852894670.db2.gz RLIGMADWKRPQAU-UHFFFAOYSA-N 0 3 401.539 4.118 20 0 HIADHN COc1ccc2[nH]cc(C3CCN([C@@H](C)C(=O)NCCc4ccc(F)cc4)CC3)c2c1 ZINC000108971727 852901857 /nfs/dbraw/zinc/90/18/57/852901857.db2.gz JPESBZNXHPUHBW-KRWDZBQOSA-N 0 3 423.532 4.242 20 0 HIADHN Cc1cc(-c2cc(C(=O)N[C@@H]3CCN(C4CC4)C3)c3cnn(C(C)C)c3n2)c(C)s1 ZINC000109029383 852911295 /nfs/dbraw/zinc/91/12/95/852911295.db2.gz WPVYGHTWJHEPKU-MRXNPFEDSA-N 0 3 423.586 4.324 20 0 HIADHN CC(C)Oc1cccc([C@@H](C)NC(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)c1 ZINC000109188535 852932842 /nfs/dbraw/zinc/93/28/42/852932842.db2.gz DNQBMWOPRLQICG-HXUWFJFHSA-N 0 3 409.574 4.495 20 0 HIADHN O=C(NCc1ccc(Br)cc1Cl)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000109258330 852944497 /nfs/dbraw/zinc/94/44/97/852944497.db2.gz FFXKLBHPXLZEJB-QGZVFWFLSA-N 0 3 422.754 4.176 20 0 HIADHN Cc1noc(C)c1COc1cccc(C(=O)NC[C@H](c2ccc(C)cc2)N(C)C)c1 ZINC000109288731 852947170 /nfs/dbraw/zinc/94/71/70/852947170.db2.gz XHCAYUAUQXNMRV-HSZRJFAPSA-N 0 3 407.514 4.212 20 0 HIADHN O=C([C@H]1CCCN(Cc2cccc(F)c2)C1)N1CCn2cccc2[C@H]1c1ccccc1 ZINC000109346095 852956623 /nfs/dbraw/zinc/95/66/23/852956623.db2.gz ITNUAMSUQHNITC-WIOPSUGQSA-N 0 3 417.528 4.471 20 0 HIADHN COc1cccc(CCC(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)c1 ZINC000109358014 852957510 /nfs/dbraw/zinc/95/75/10/852957510.db2.gz BMRBWVFCKAQOHS-UHFFFAOYSA-N 0 3 408.464 4.237 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)C1=Cc2ccccc2OC1 ZINC000109358493 852958096 /nfs/dbraw/zinc/95/80/96/852958096.db2.gz AWGDRGFOBTUXDK-UHFFFAOYSA-N 0 3 404.432 4.072 20 0 HIADHN COc1ccc(Cl)cc1CN(C)C(=O)c1ccc(N2CCN(C(C)C)CC2)cc1 ZINC000109490564 852976028 /nfs/dbraw/zinc/97/60/28/852976028.db2.gz HWXMBMQOAQUICB-UHFFFAOYSA-N 0 3 415.965 4.151 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)c1cc(F)ccc1Br ZINC000109499519 852978488 /nfs/dbraw/zinc/97/84/88/852978488.db2.gz ANSAWDXEJYIILP-UHFFFAOYSA-N 0 3 423.351 4.432 20 0 HIADHN Cc1sc(-c2ccco2)nc1C(=O)NC[C@H]1CCCN(Cc2cccs2)C1 ZINC000109565377 852986334 /nfs/dbraw/zinc/98/63/34/852986334.db2.gz PFLVKJSYSIPJEE-OAHLLOKOSA-N 0 3 401.557 4.415 20 0 HIADHN Cc1cc(C)n(Cc2cccc(C(=O)NC[C@H](c3ccc(C)cc3)N3CCCC3)c2)n1 ZINC000109782694 853013997 /nfs/dbraw/zinc/01/39/97/853013997.db2.gz BHEOBCMLWHOESB-RUZDIDTESA-N 0 3 416.569 4.424 20 0 HIADHN CN(C(=O)CCSc1ccc(Cl)cc1)C1CCN(CCc2ccccn2)CC1 ZINC000109794602 853015783 /nfs/dbraw/zinc/01/57/83/853015783.db2.gz JFBAENBCWSDOSZ-UHFFFAOYSA-N 0 3 418.006 4.383 20 0 HIADHN NC(=O)[C@H]1CCCN(Cc2ccccc2NC(=O)c2cc3cc(Cl)ccc3o2)C1 ZINC000109891375 853029958 /nfs/dbraw/zinc/02/99/58/853029958.db2.gz TWEMPRASIGIPHG-HNNXBMFYSA-N 0 3 411.889 4.036 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)Nc3ccccc3NCC(F)(F)F)cc2)CC1 ZINC000109903457 853032347 /nfs/dbraw/zinc/03/23/47/853032347.db2.gz AGLZPYWSEZMGPS-UHFFFAOYSA-N 0 3 420.479 4.444 20 0 HIADHN CC(C)(C)c1ncc(NC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)cn1 ZINC000110119543 853061538 /nfs/dbraw/zinc/06/15/38/853061538.db2.gz OBFSQLQXDRBTKF-FQEVSTJZSA-N 0 3 406.452 4.167 20 0 HIADHN CCCN(CC(=O)N(c1ccccc1)C(C)C)C1CCN(C(=O)c2ccccc2)CC1 ZINC000110291074 853083966 /nfs/dbraw/zinc/08/39/66/853083966.db2.gz HBNMGBCGDPFMBC-UHFFFAOYSA-N 0 3 421.585 4.445 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)c3ccccc3Cc3ccccc3)CC2)C[C@H](C)O1 ZINC000110411437 853096472 /nfs/dbraw/zinc/09/64/72/853096472.db2.gz XXRBONKQBLVMSJ-SFTDATJTSA-N 0 3 406.570 4.239 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)C3(c4cccc(F)c4)CCCCC3)CC2)C[C@H](C)O1 ZINC000110412633 853096623 /nfs/dbraw/zinc/09/66/23/853096623.db2.gz QYDLPWAENWPNLV-PMACEKPBSA-N 0 3 416.581 4.375 20 0 HIADHN Cc1c(C(=O)N2CCC(CN3C[C@@H](C)O[C@H](C)C3)CC2)sc2cccc(F)c12 ZINC000110408487 853096714 /nfs/dbraw/zinc/09/67/14/853096714.db2.gz ICVAUBJMPQWUTH-HUUCEWRRSA-N 0 3 404.551 4.310 20 0 HIADHN CCCn1c(SC[C@@H](O)CN(C)Cc2ccccc2)nnc1-c1cccc(C)c1 ZINC000110437314 853100270 /nfs/dbraw/zinc/10/02/70/853100270.db2.gz WEGJTCWAEBMWSE-NRFANRHFSA-N 0 3 410.587 4.249 20 0 HIADHN Cc1nc(-c2ccccc2)sc1C(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000110459283 853102569 /nfs/dbraw/zinc/10/25/69/853102569.db2.gz SWEWCERBLNRVEZ-IAGOWNOFSA-N 0 3 413.587 4.080 20 0 HIADHN Cc1ccc(C(=O)NCCNCC2=Cc3cc(Cl)cc(Cl)c3OC2)cc1F ZINC000110462117 853103583 /nfs/dbraw/zinc/10/35/83/853103583.db2.gz OLABPYLTVHDBKZ-UHFFFAOYSA-N 0 3 409.288 4.236 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)Nc3ccc(Cl)cc3Cl)CC2)C[C@H](C)O1 ZINC000110727242 853145345 /nfs/dbraw/zinc/14/53/45/853145345.db2.gz BJYVJGJSFWAFJL-KBPBESRZSA-N 0 3 400.350 4.347 20 0 HIADHN CCN(CC)[C@H](C(=O)NC[C@@H](c1ccccc1OC)N1CCCC1)c1ccccc1 ZINC000111075245 853197964 /nfs/dbraw/zinc/19/79/64/853197964.db2.gz KKEHNWTXOMPPQS-UPVQGACJSA-N 0 3 409.574 4.031 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2[nH]nc(C(C)C)c2Br)N2CCCC2)cc1 ZINC000111151783 853211763 /nfs/dbraw/zinc/21/17/63/853211763.db2.gz FZSXNNDMRZXVAE-INIZCTEOSA-N 0 3 419.367 4.171 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2cccc(OCc3cscn3)c2)N(C)C)cc1 ZINC000111165375 853215087 /nfs/dbraw/zinc/21/50/87/853215087.db2.gz MSQIPZCZFRMJGD-NRFANRHFSA-N 0 3 410.543 4.455 20 0 HIADHN CCN1CCN(Cc2ccc(CNc3nc(C(F)F)nc4ccccc43)cc2)CC1 ZINC000111194047 853219066 /nfs/dbraw/zinc/21/90/66/853219066.db2.gz CXSSMODFCOMUCN-UHFFFAOYSA-N 0 3 411.500 4.317 20 0 HIADHN CCCOc1ccc(CN[C@H](C)c2ccc(S(=O)(=O)N(CC)CC)cc2)cc1 ZINC000115187714 853246952 /nfs/dbraw/zinc/24/69/52/853246952.db2.gz SZEHHVPEAPTDST-GOSISDBHSA-N 0 3 404.576 4.357 20 0 HIADHN CC(=O)Nc1ccc([O-])c(C(=O)NCc2ccccc2C[N@@H+](C)C2CCCCC2)c1 ZINC000115735786 853262936 /nfs/dbraw/zinc/26/29/36/853262936.db2.gz DIKMLFDXOVPZQX-UHFFFAOYSA-N 0 3 409.530 4.045 20 0 HIADHN CC(=O)Nc1ccc([O-])c(C(=O)NCc2ccccc2C[N@H+](C)C2CCCCC2)c1 ZINC000115735786 853262944 /nfs/dbraw/zinc/26/29/44/853262944.db2.gz DIKMLFDXOVPZQX-UHFFFAOYSA-N 0 3 409.530 4.045 20 0 HIADHN CNC(=O)c1ccc(CN(Cc2ccc(OCc3ccccn3)cc2)C2CC2)cc1 ZINC000115844356 853268188 /nfs/dbraw/zinc/26/81/88/853268188.db2.gz YEJJRNUKWDPHQL-UHFFFAOYSA-N 0 3 401.510 4.185 20 0 HIADHN COc1ccc(NC(=O)[C@@H]2CCCN(Cc3cccnc3)C2)cc1OC1CCCC1 ZINC000115841244 853268358 /nfs/dbraw/zinc/26/83/58/853268358.db2.gz VFLZFNVFWSERLR-LJQANCHMSA-N 0 3 409.530 4.262 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3CCC[C@H]3c3ccc(O)cc3)c(C)c2)CC1 ZINC000138516405 853389296 /nfs/dbraw/zinc/38/92/96/853389296.db2.gz JAZRDKJRORTPCX-QHCPKHFHSA-N 0 3 408.546 4.212 20 0 HIADHN COCCN1CCC(NC(=O)C23C[C@@H]4C[C@H](C2)CC(c2ccc(C)cc2)(C4)C3)CC1 ZINC000138553140 853391202 /nfs/dbraw/zinc/39/12/02/853391202.db2.gz NQQUGJCVKPBYAX-JGSRLKPESA-N 0 3 410.602 4.060 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)c1sccc1Br ZINC000138677746 853394585 /nfs/dbraw/zinc/39/45/85/853394585.db2.gz WLCDYMUGTCUHPY-UHFFFAOYSA-N 0 3 411.390 4.354 20 0 HIADHN O=C(Cc1ccc(OC(F)F)cc1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000138696023 853394614 /nfs/dbraw/zinc/39/46/14/853394614.db2.gz ZYZYCVNYOVOXCD-UHFFFAOYSA-N 0 3 406.498 4.061 20 0 HIADHN Cc1cc(Cl)ccc1NC(=O)[C@H](C)N[C@@H](C)c1ccc(N2CCOCC2)cc1 ZINC000140187862 853436685 /nfs/dbraw/zinc/43/66/85/853436685.db2.gz LQPUXPFCHUQBNK-IRXDYDNUSA-N 0 3 401.938 4.163 20 0 HIADHN CNS(=O)(=O)c1ccc([C@H](C)NCc2cccc(OCc3ccccc3)c2)cc1 ZINC000140312516 853440801 /nfs/dbraw/zinc/44/08/01/853440801.db2.gz ZOSPRQVATUFUPD-SFHVURJKSA-N 0 3 410.539 4.025 20 0 HIADHN CNS(=O)(=O)c1ccc([C@H](C)NCc2ccc(OCc3ccccc3)cc2)cc1 ZINC000140317575 853441704 /nfs/dbraw/zinc/44/17/04/853441704.db2.gz MJNYSKXCGDPWOF-SFHVURJKSA-N 0 3 410.539 4.025 20 0 HIADHN O=c1ccccn1Cc1ccc(CNCc2ccc(OCc3ccncc3)cc2)cc1 ZINC000140415505 853444266 /nfs/dbraw/zinc/44/42/66/853444266.db2.gz VVMYYQNDSJIZGM-UHFFFAOYSA-N 0 3 411.505 4.160 20 0 HIADHN Cc1cc(C(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)nn1C(C)(C)C ZINC000140892033 853456634 /nfs/dbraw/zinc/45/66/34/853456634.db2.gz MQIINGSGDCAHLF-UHFFFAOYSA-N 0 3 410.484 4.169 20 0 HIADHN COc1ccc(CN[C@@H](C)c2ccc(N3CCOC3=O)cc2)cc1Br ZINC000142753718 853498953 /nfs/dbraw/zinc/49/89/53/853498953.db2.gz AFTXJFAXTMDHPA-ZDUSSCGKSA-N 0 3 405.292 4.265 20 0 HIADHN Cc1nn(C(F)F)c(C)c1CC(=O)C(C#N)C(=O)Nc1ccc(Cl)cc1Cl ZINC000143148098 853508183 /nfs/dbraw/zinc/50/81/83/853508183.db2.gz CYCMJFXQXSIFKL-LBPRGKRZSA-N 0 3 415.227 4.092 20 0 HIADHN Cc1ccccc1C(=O)NC1CCN(Cc2ccc(OCc3ccncc3)cc2)CC1 ZINC000143350277 853512897 /nfs/dbraw/zinc/51/28/97/853512897.db2.gz LSHDKYXNMLKWPQ-UHFFFAOYSA-N 0 3 415.537 4.363 20 0 HIADHN Cc1ccc(NC(=O)C2CCN(Cc3ccc(OCc4ccncc4)cc3)CC2)nc1 ZINC000143459738 853516160 /nfs/dbraw/zinc/51/61/60/853516160.db2.gz RGVWSQITFDDPNS-UHFFFAOYSA-N 0 3 416.525 4.215 20 0 HIADHN O=C(NC1CCN(Cc2ccc(OCc3ccncc3)cc2)CC1)C1CCCCC1 ZINC000143868264 853524381 /nfs/dbraw/zinc/52/43/81/853524381.db2.gz RRSSWAKNLIZQBH-UHFFFAOYSA-N 0 3 407.558 4.322 20 0 HIADHN COc1ccc(CCCN(C)C(=S)NC2CCN(Cc3ccccc3)CC2)cc1 ZINC000145683934 853555527 /nfs/dbraw/zinc/55/55/27/853555527.db2.gz YDODSWKZHMQNRO-UHFFFAOYSA-N 0 3 411.615 4.099 20 0 HIADHN N#CC(C(=O)Cc1csc(-c2ccc(Cl)s2)n1)C(=O)NCc1ccccc1 ZINC000149659949 853628673 /nfs/dbraw/zinc/62/86/73/853628673.db2.gz VRPXRAPZACMSJU-CQSZACIVSA-N 0 3 415.927 4.093 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)N(Cc1ccccc1)C[C@@H]1CCCO1 ZINC000195613367 853714964 /nfs/dbraw/zinc/71/49/64/853714964.db2.gz BMAXPPBLEBYUDT-BJKOFHAPSA-N 0 3 407.558 4.214 20 0 HIADHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)N[C@@H]1CCCc2occc21 ZINC000195635280 853728717 /nfs/dbraw/zinc/72/87/17/853728717.db2.gz JQDHOINXBOBUOA-GOSISDBHSA-N 0 3 420.351 4.193 20 0 HIADHN C[C@H](NC[C@H](O)COc1ccccc1F)c1cccc(NC(=O)c2ccccc2)c1 ZINC000195662314 853744482 /nfs/dbraw/zinc/74/44/82/853744482.db2.gz KRJYGCVROKUEEF-UWJYYQICSA-N 0 3 408.473 4.169 20 0 HIADHN COc1ccc([C@H](NCC(=O)N2CCC[C@H]2c2ccc(OC)cc2OC)C2CC2)cc1 ZINC000195667943 853747251 /nfs/dbraw/zinc/74/72/51/853747251.db2.gz IZDMFKNADNVTGZ-WIOPSUGQSA-N 0 3 424.541 4.117 20 0 HIADHN COc1ccc([C@H](NCC(=O)Nc2cc(C3CC3)nn2-c2ccccc2)C2CC2)cc1 ZINC000195673906 853750556 /nfs/dbraw/zinc/75/05/56/853750556.db2.gz YYZFAMVWNDPNMS-RUZDIDTESA-N 0 3 416.525 4.438 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2cnn(-c3ccccc3)c2C(F)(F)F)N(C)C)cc1 ZINC000195717692 853776429 /nfs/dbraw/zinc/77/64/29/853776429.db2.gz GRVJBBDXSYKDEX-LJQANCHMSA-N 0 3 416.447 4.232 20 0 HIADHN CC(C)n1ncc2ccc(NC(=O)NCC3(N4CCSCC4)CCCC3)cc21 ZINC000195738177 853786639 /nfs/dbraw/zinc/78/66/39/853786639.db2.gz XFCYAGXBVZFSFC-UHFFFAOYSA-N 0 3 401.580 4.100 20 0 HIADHN CCOC(=O)/C=C\c1ccc(NC(=O)NC[C@H](c2ccccc2)N2CCCC2)cc1 ZINC000206818924 853799996 /nfs/dbraw/zinc/79/99/96/853799996.db2.gz QGWNHAACFPUFDC-OOZJCBPQSA-N 0 3 407.514 4.222 20 0 HIADHN CN(C(=O)c1cn(Cc2ccccc2)nc1-c1ccc(Cl)cc1)C1CCN(C)CC1 ZINC000215836735 853838674 /nfs/dbraw/zinc/83/86/74/853838674.db2.gz BSXLBCGQIMDIMW-UHFFFAOYSA-N 0 3 422.960 4.418 20 0 HIADHN Cc1ccccc1C(=O)NC1CCN(CCOc2ccccc2C(F)(F)F)CC1 ZINC000215890443 853839193 /nfs/dbraw/zinc/83/91/93/853839193.db2.gz BLUPKADNGVVPLZ-UHFFFAOYSA-N 0 3 406.448 4.287 20 0 HIADHN CC[C@@H](N[C@@H](C)C(=O)Nc1cccc(C(=O)N(CC)CC)c1)c1ccc(OC)cc1 ZINC000218854317 853864088 /nfs/dbraw/zinc/86/40/88/853864088.db2.gz DSOITZYPYKTVHV-HTAPYJJXSA-N 0 3 411.546 4.245 20 0 HIADHN CCC[C@](C)(O)CNCc1cc(Br)cc(Br)c1OCC ZINC000226252992 853880077 /nfs/dbraw/zinc/88/00/77/853880077.db2.gz BYLFXWLIRDUGTK-HNNXBMFYSA-N 0 3 409.162 4.251 20 0 HIADHN CN(C)Cc1cccc(NC(=O)c2ccc(I)c(Cl)c2)c1 ZINC000232382744 853897700 /nfs/dbraw/zinc/89/77/00/853897700.db2.gz XBVQFPORDVWCBV-UHFFFAOYSA-N 0 3 414.674 4.259 20 0 HIADHN c1sc(-c2ccc3c(c2)OCO3)nc1CNCC1(c2ccccc2)CCOCC1 ZINC000236606503 853902626 /nfs/dbraw/zinc/90/26/26/853902626.db2.gz FTWFNXXYMOZMGG-UHFFFAOYSA-N 0 3 408.523 4.377 20 0 HIADHN CC(C)[C@H](CNCc1csc(-c2cccc(Br)c2)n1)N1CCOCC1 ZINC000236695780 853913175 /nfs/dbraw/zinc/91/31/75/853913175.db2.gz VSDJYEKSJOZOLO-SFHVURJKSA-N 0 3 424.408 4.019 20 0 HIADHN Brc1ccc(-c2c[nH]c(CNCCCCNc3ccccn3)n2)cc1 ZINC000236748390 853918351 /nfs/dbraw/zinc/91/83/51/853918351.db2.gz RXBKXVYKFUWJCC-UHFFFAOYSA-N 0 3 400.324 4.216 20 0 HIADHN c1cnn(-c2ccc(CCNCc3csc(-c4ccc5c(c4)OCO5)n3)cc2)c1 ZINC000236750672 853919508 /nfs/dbraw/zinc/91/95/08/853919508.db2.gz UGOZLJYELZKULU-UHFFFAOYSA-N 0 3 404.495 4.057 20 0 HIADHN Cc1nn(-c2ccc(F)cc2F)c(C)c1CNC[C@@H](O)c1ccc(OC(C)C)cc1 ZINC000236814111 853925941 /nfs/dbraw/zinc/92/59/41/853925941.db2.gz RUWUSMPSSWHAKB-HSZRJFAPSA-N 0 3 415.484 4.378 20 0 HIADHN CCN(CC)C(=O)CCCNCc1csc(-c2cccc(Br)c2)n1 ZINC000237023108 853952733 /nfs/dbraw/zinc/95/27/33/853952733.db2.gz YAGJPOFAMUUQCD-UHFFFAOYSA-N 0 3 410.381 4.311 20 0 HIADHN CCC[C@H](NCc1ccc(NC(C)=O)cc1)C(=O)Nc1cccc(N2CCCC2)c1 ZINC000237032023 853953351 /nfs/dbraw/zinc/95/33/51/853953351.db2.gz OXOBDNLRIUOUAR-QHCPKHFHSA-N 0 3 408.546 4.142 20 0 HIADHN CCC[C@H](NCc1ccc(O[C@H](C)C#N)cc1)C(=O)Nc1cccc(N2CCCC2)c1 ZINC000237033756 853954444 /nfs/dbraw/zinc/95/44/44/853954444.db2.gz DWMOJMABAOAQLZ-DVECYGJZSA-N 0 3 420.557 4.475 20 0 HIADHN CCc1nn(C)c(Cl)c1CNC[C@H]1CCN(c2ccc(Br)cc2)C1 ZINC000237062774 853959170 /nfs/dbraw/zinc/95/91/70/853959170.db2.gz IGIOLRLLPMABRM-CYBMUJFWSA-N 0 3 411.775 4.015 20 0 HIADHN COc1cc(OC)c(OC)cc1CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1 ZINC000237075107 853960780 /nfs/dbraw/zinc/96/07/80/853960780.db2.gz HIHLHKDUIIHWQA-GOSISDBHSA-N 0 3 424.463 4.095 20 0 HIADHN Cc1ccc(-c2n[nH]cc2CNCc2ccc(N(C)C(=O)c3ccncc3)cc2)cc1 ZINC000237095508 853964374 /nfs/dbraw/zinc/96/43/74/853964374.db2.gz KLOCPXZBSHGTKD-UHFFFAOYSA-N 0 3 411.509 4.347 20 0 HIADHN COc1cc(CNCc2ccc(NC(N)=O)cc2)ccc1OCc1ccc(F)cc1 ZINC000237099947 853964393 /nfs/dbraw/zinc/96/43/93/853964393.db2.gz JVUKEXRJBQFJAI-UHFFFAOYSA-N 0 3 409.461 4.194 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)C[C@@H](C)NCc1cc2c(cc1OC)C[C@@H](C)O2 ZINC000237130274 853969558 /nfs/dbraw/zinc/96/95/58/853969558.db2.gz ILYONWNHYRUHAC-ZIAGYGMSSA-N 0 3 418.921 4.188 20 0 HIADHN CN(C)[C@@H](CNCc1nc(-c2ccc(Br)cc2)c[nH]1)c1cccc(F)c1 ZINC000237178865 853976844 /nfs/dbraw/zinc/97/68/44/853976844.db2.gz BDVWCOHCDICERV-IBGZPJMESA-N 0 3 417.326 4.371 20 0 HIADHN COc1cc(CCNCc2c(C)nn(Cc3ccc(F)cc3)c2Cl)ccc1O ZINC000237297204 854000720 /nfs/dbraw/zinc/00/07/20/854000720.db2.gz WUAVLAIDPHVNSB-UHFFFAOYSA-N 0 3 403.885 4.079 20 0 HIADHN COc1ccc(OCc2nc(CNC[C@@H]3CCCN3Cc3ccccc3)cs2)cc1 ZINC000237302956 854003043 /nfs/dbraw/zinc/00/30/43/854003043.db2.gz DEXNRUDCVHPQEO-NRFANRHFSA-N 0 3 423.582 4.485 20 0 HIADHN COc1cc(CN[C@H](c2cccc(F)c2)C2CCCC2)cc(Cl)c1OCC(N)=O ZINC000237336386 854008701 /nfs/dbraw/zinc/00/87/01/854008701.db2.gz ZDBFWMYSWMJWIS-NRFANRHFSA-N 0 3 420.912 4.373 20 0 HIADHN COc1cc(CN[C@@H]2CCC(C)(C)c3ccccc32)cc(Cl)c1OCC(N)=O ZINC000237347917 854010717 /nfs/dbraw/zinc/01/07/17/854010717.db2.gz WUOHVABSSDCQNE-GOSISDBHSA-N 0 3 402.922 4.115 20 0 HIADHN COc1cc([C@H](C)NCc2cnc3c(C)cccn23)ccc1OCc1ccncc1 ZINC000237393587 854021856 /nfs/dbraw/zinc/02/18/56/854021856.db2.gz WMRGTJZYPMATTM-SFHVURJKSA-N 0 3 402.498 4.476 20 0 HIADHN COc1ccc(OC)c(NC(=O)C[C@H](C)N[C@H]2CCSc3c(F)cccc32)c1 ZINC000237403372 854024806 /nfs/dbraw/zinc/02/48/06/854024806.db2.gz YPZIEFUYAKCYSC-GUYCJALGSA-N 0 3 404.507 4.387 20 0 HIADHN COc1cc(CNCc2cccnc2-n2cccn2)c(-c2ccccc2)cc1OC ZINC000237406254 854025563 /nfs/dbraw/zinc/02/55/63/854025563.db2.gz OJQWGBQPZKHGBA-UHFFFAOYSA-N 0 3 400.482 4.241 20 0 HIADHN COc1cc2c(c(CN[C@@H](C)CC(=O)Nc3cccc(N4CCCC4)c3)c1)O[C@@H](C)C2 ZINC000237421031 854029440 /nfs/dbraw/zinc/02/94/40/854029440.db2.gz HGBWPWXNCUPEON-ROUUACIJSA-N 0 3 423.557 4.126 20 0 HIADHN CC(=O)Nc1cccc([C@@H](C)NCCC(=O)Nc2ccc(Br)cc2)c1 ZINC000237426388 854030541 /nfs/dbraw/zinc/03/05/41/854030541.db2.gz ZGCBHBOJHQMXGU-CYBMUJFWSA-N 0 3 404.308 4.087 20 0 HIADHN Cc1ccc(C(=O)NCCNCc2cccc(NC(=O)c3ccccc3Cl)c2)cc1 ZINC000237630602 854064930 /nfs/dbraw/zinc/06/49/30/854064930.db2.gz NHPWWEZPCAALHF-UHFFFAOYSA-N 0 3 421.928 4.420 20 0 HIADHN O=C1CCCN1c1ccc(CNCc2ccc(-n3ccc(C(F)(F)F)n3)cc2)cc1 ZINC000237756508 854090234 /nfs/dbraw/zinc/09/02/34/854090234.db2.gz WQPXQJALYQDDLM-UHFFFAOYSA-N 0 3 414.431 4.308 20 0 HIADHN Fc1ccc(F)c(CNC[C@@H](c2ccc(C(F)(F)F)cc2)N2CCOCC2)c1 ZINC000237814449 854102225 /nfs/dbraw/zinc/10/22/25/854102225.db2.gz LAPOAQZHVILKPV-IBGZPJMESA-N 0 3 400.391 4.147 20 0 HIADHN Cc1nn(Cc2ccc(Cl)cc2)c(C)c1CNCCC(=O)N1CCCCCC1 ZINC000237879856 854113841 /nfs/dbraw/zinc/11/38/41/854113841.db2.gz BLMTWUDGFAAGLX-UHFFFAOYSA-N 0 3 402.970 4.084 20 0 HIADHN Cc1ccc([C@@H](CNCc2cc(Cl)ccc2OC(F)F)N2CCOCC2)o1 ZINC000237883764 854114585 /nfs/dbraw/zinc/11/45/85/854114585.db2.gz VESGPDGXLKHPBJ-MRXNPFEDSA-N 0 3 400.853 4.006 20 0 HIADHN FC(F)Oc1ccc(N2CCC[C@@H](NCc3c(Cl)nc4ccccn43)C2)cc1 ZINC000237914270 854117732 /nfs/dbraw/zinc/11/77/32/854117732.db2.gz XBWNICBCTLZTMQ-CQSZACIVSA-N 0 3 406.864 4.348 20 0 HIADHN CC(C)c1cc(C(=O)N(CCN(C)C)Cc2ccccc2)c2cnn(C(C)C)c2n1 ZINC000247976318 854170580 /nfs/dbraw/zinc/17/05/80/854170580.db2.gz IMHPKFJPYIGPNY-UHFFFAOYSA-N 0 3 407.562 4.340 20 0 HIADHN Cc1ccccc1-n1nc(C(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)c2c1CCC2 ZINC000250993710 854196483 /nfs/dbraw/zinc/19/64/83/854196483.db2.gz QEYZODNMDWWFRW-TZIWHRDSSA-N 0 3 414.553 4.235 20 0 HIADHN CC1CCN([C@@H](CNc2nc3c(cnn3C(C)(C)C)c(=O)[nH]2)c2ccccc2)CC1 ZINC000301147821 854312092 /nfs/dbraw/zinc/31/20/92/854312092.db2.gz HTHFQJONPYYPHP-IBGZPJMESA-N 0 3 408.550 4.172 20 0 HIADHN CN(CCCN1CCN(C)CC1)c1ncnc2cc(-c3ccc(Cl)cc3)sc21 ZINC000301210823 854329455 /nfs/dbraw/zinc/32/94/55/854329455.db2.gz UZERXMWHUHOIHV-UHFFFAOYSA-N 0 3 415.994 4.085 20 0 HIADHN Cc1ccc([C@H](CNc2ccc(C(=O)N3CCc4ccccc43)cn2)N2CCCC2)o1 ZINC000301233377 854334629 /nfs/dbraw/zinc/33/46/29/854334629.db2.gz KIMYQNURGXZFAG-QFIPXVFZSA-N 0 3 416.525 4.435 20 0 HIADHN O=C(c1cccnc1NCC1(N2CCSCC2)CCCC1)N1CCc2ccccc21 ZINC000301350686 854368540 /nfs/dbraw/zinc/36/85/40/854368540.db2.gz IRIAEIWGCRQLSG-UHFFFAOYSA-N 0 3 422.598 4.058 20 0 HIADHN O=C(c1cccnc1N1CCN(Cc2cccc3ccccc32)CC1)N1CCCCC1 ZINC000301379705 854376754 /nfs/dbraw/zinc/37/67/54/854376754.db2.gz YGYUUTKBYKSZDN-UHFFFAOYSA-N 0 3 414.553 4.183 20 0 HIADHN CN(C)[C@H](CNc1ncccc1C(=O)N1CCc2ccccc21)c1ccc(F)cc1 ZINC000301383831 854377899 /nfs/dbraw/zinc/37/78/99/854377899.db2.gz VXUHOMWFFZDEFZ-JOCHJYFZSA-N 0 3 404.489 4.138 20 0 HIADHN Cc1nc(-c2ccc(N3CC[NH+](C4CCC(C(C)C)CC4)CC3)nc2)[n-]c(=O)c1C ZINC000301571502 854422653 /nfs/dbraw/zinc/42/26/53/854422653.db2.gz OEZHXKNYTSTSHR-UHFFFAOYSA-N 0 3 409.578 4.198 20 0 HIADHN Clc1ccc(Br)c2ccc(NC3CCN([C@H]4CCOC4)CC3)nc12 ZINC000302034199 854519531 /nfs/dbraw/zinc/51/95/31/854519531.db2.gz TXAFDSVYCGOYBR-ZDUSSCGKSA-N 0 3 410.743 4.316 20 0 HIADHN Clc1ccc(Br)c2ccc(NC3CCN([C@@H]4CCOC4)CC3)nc12 ZINC000302033831 854519652 /nfs/dbraw/zinc/51/96/52/854519652.db2.gz TXAFDSVYCGOYBR-CYBMUJFWSA-N 0 3 410.743 4.316 20 0 HIADHN COc1cccc([C@H](CNc2ccc3nnc(-c4ccsc4)n3n2)N2CCCC2)c1 ZINC000302352060 854563502 /nfs/dbraw/zinc/56/35/02/854563502.db2.gz YLXUXFDPNYAQHC-IBGZPJMESA-N 0 3 420.542 4.110 20 0 HIADHN C[C@@H]1CN(C2CCN(c3ccnc4c(Cl)cc(Br)cc34)CC2)CCO1 ZINC000302722573 854613485 /nfs/dbraw/zinc/61/34/85/854613485.db2.gz IFVIPUOFZFZWEN-CYBMUJFWSA-N 0 3 424.770 4.340 20 0 HIADHN COc1cc2c(cc1OC)CN(C(=O)CN[C@@H](C)c1cccc3ccccc31)CC2 ZINC000302763763 854625705 /nfs/dbraw/zinc/62/57/05/854625705.db2.gz YJBYJXOJLUQAJM-KRWDZBQOSA-N 0 3 404.510 4.093 20 0 HIADHN COc1ccc([C@H](CNC(=O)N[C@H](C)c2ccc(F)cc2F)N2CCCC2)cc1 ZINC000302816660 854644658 /nfs/dbraw/zinc/64/46/58/854644658.db2.gz VDCKKDQUIFMCKB-VFNWGFHPSA-N 0 3 403.473 4.171 20 0 HIADHN COc1ccc([C@@H](CNC(=O)N[C@@H](C)c2ccc(F)cc2F)N2CCCC2)cc1 ZINC000302816663 854644806 /nfs/dbraw/zinc/64/48/06/854644806.db2.gz VDCKKDQUIFMCKB-YCRPNKLZSA-N 0 3 403.473 4.171 20 0 HIADHN CN(Cc1ccccc1Br)C(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000302904636 854674048 /nfs/dbraw/zinc/67/40/48/854674048.db2.gz YJLGYRHMGRXOBV-KRWDZBQOSA-N 0 3 422.392 4.489 20 0 HIADHN Cc1cc(C(=O)NC[C@@H](c2ccccc2)N(C)C)c2ccc(Br)cc2n1 ZINC000302924482 854682275 /nfs/dbraw/zinc/68/22/75/854682275.db2.gz BQBOTTXXKZDLLO-FQEVSTJZSA-N 0 3 412.331 4.338 20 0 HIADHN CN(C)[C@@H](CNC(=O)CCCOc1ccccc1Br)c1ccccc1 ZINC000302935093 854686761 /nfs/dbraw/zinc/68/67/61/854686761.db2.gz ISAWJWQMPVHXDC-SFHVURJKSA-N 0 3 405.336 4.027 20 0 HIADHN O=C(Cc1ccc(OC(F)(F)F)cc1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000303036662 854733375 /nfs/dbraw/zinc/73/33/75/854733375.db2.gz PAJDNSBPSDKDJT-UHFFFAOYSA-N 0 3 424.488 4.358 20 0 HIADHN O=C(CCc1cnn(-c2ccccc2)c1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000303051981 854739510 /nfs/dbraw/zinc/73/95/10/854739510.db2.gz RUBQFCXEWCRXDR-UHFFFAOYSA-N 0 3 420.582 4.035 20 0 HIADHN Cc1cc(C)n(Cc2cccc(C(=O)N[C@H](CN3CCCC3)c3ccccc3)c2)n1 ZINC000303052635 854739682 /nfs/dbraw/zinc/73/96/82/854739682.db2.gz VVRFAPFUYJGCBH-XMMPIXPASA-N 0 3 402.542 4.115 20 0 HIADHN COc1cccc([C@H](CNC(=O)CCCOc2ccccc2Cl)N2CCCC2)c1 ZINC000303060167 854743274 /nfs/dbraw/zinc/74/32/74/854743274.db2.gz UJBBVYJOVIYFJE-NRFANRHFSA-N 0 3 416.949 4.461 20 0 HIADHN Cc1c(C(=O)Nc2ccc(CCN3CCSCC3)cc2)cnn1Cc1ccccc1 ZINC000303074789 854749577 /nfs/dbraw/zinc/74/95/77/854749577.db2.gz YSGJXGNHCZJPQZ-UHFFFAOYSA-N 0 3 420.582 4.083 20 0 HIADHN COc1c(F)cc(NC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)cc1F ZINC000303084544 854753449 /nfs/dbraw/zinc/75/34/49/854753449.db2.gz ATTLPZXZMLPAJB-IBGZPJMESA-N 0 3 414.374 4.367 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2ccccc2NC(=O)c2ccsc2)N(C)C)cc1 ZINC000303090644 854756425 /nfs/dbraw/zinc/75/64/25/854756425.db2.gz ZJTSRQXSEBCBKR-OAQYLSRUSA-N 0 3 407.539 4.342 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cc(Br)cnc1Cl)c1ccsc1 ZINC000303101408 854760995 /nfs/dbraw/zinc/76/09/95/854760995.db2.gz HVGKLERZVVENKG-AWEZNQCLSA-N 0 3 416.772 4.372 20 0 HIADHN CCN(CC)[C@H](CNC(=O)C1(NC(=O)OC(C)(C)C)CCCC1)c1ccsc1 ZINC000303191780 854809795 /nfs/dbraw/zinc/80/97/95/854809795.db2.gz WWFKRZFRBGBFKH-QGZVFWFLSA-N 0 3 409.596 4.085 20 0 HIADHN CC(C)(C(=O)NCCCN1CCc2ccccc2C1)c1cccc(Br)c1 ZINC000303189900 854809887 /nfs/dbraw/zinc/80/98/87/854809887.db2.gz VGFNEUIKCNREIB-UHFFFAOYSA-N 0 3 415.375 4.291 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Cc1ccccc1C(F)(F)F)c1cccc(OC)c1 ZINC000303254518 854837719 /nfs/dbraw/zinc/83/77/19/854837719.db2.gz NZEGQYVXPZVMRS-FQEVSTJZSA-N 0 3 408.464 4.456 20 0 HIADHN COc1cccc([C@H](CNC(=O)C[C@@H](C)Cc2ccccc2OC)N2CCCC2)c1 ZINC000303288901 854854429 /nfs/dbraw/zinc/85/44/29/854854429.db2.gz KHUGXUPCFULFDE-CVDCTZTESA-N 0 3 410.558 4.226 20 0 HIADHN COc1ccccc1C[C@@H](C)CC(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000303350960 854887045 /nfs/dbraw/zinc/88/70/45/854887045.db2.gz XPPMCWIKOVWIJN-LJQANCHMSA-N 0 3 412.599 4.494 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Cc3ccc(OCC(C)C)cc3)c(C)c2)CC1 ZINC000303351767 854887849 /nfs/dbraw/zinc/88/78/49/854887849.db2.gz YLGNHUBPQHPQFJ-UHFFFAOYSA-N 0 3 409.574 4.353 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)NC[C@@H](O)c1ccc2ccccc2c1 ZINC000303431929 854932727 /nfs/dbraw/zinc/93/27/27/854932727.db2.gz XANCLOLBKNKWMA-BJKOFHAPSA-N 0 3 403.526 4.010 20 0 HIADHN CC(C)C(=O)Nc1ccc(CNC(=O)[C@@H](C)N2CCC(Cc3ccccc3)CC2)cc1 ZINC000303450097 854949575 /nfs/dbraw/zinc/94/95/75/854949575.db2.gz DURFTIVMVSVCMN-HXUWFJFHSA-N 0 3 421.585 4.241 20 0 HIADHN C[C@H](CNC(=O)NCc1ccc(Oc2ccc(F)cc2)nc1)N(C)Cc1ccccc1 ZINC000303453772 854953670 /nfs/dbraw/zinc/95/36/70/854953670.db2.gz JKOKVLDIHNPIDN-GOSISDBHSA-N 0 3 422.504 4.333 20 0 HIADHN O=C(NC[C@H](O)c1ccc(Cl)cc1Cl)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000303456588 854956635 /nfs/dbraw/zinc/95/66/35/854956635.db2.gz KESSQBGDFJVIAV-PMACEKPBSA-N 0 3 422.356 4.163 20 0 HIADHN C[C@H](CNC(=O)Cc1ccc(NC(=O)OC(C)(C)C)cc1)N(C)Cc1ccccc1 ZINC000303485200 854977554 /nfs/dbraw/zinc/97/75/54/854977554.db2.gz PCHAKPLQMNWAAL-GOSISDBHSA-N 0 3 411.546 4.213 20 0 HIADHN CN(C(=O)CN(Cc1ccccc1)CC1CCOCC1)[C@H]1CCCc2ccccc21 ZINC000303516111 855004588 /nfs/dbraw/zinc/00/45/88/855004588.db2.gz XYQBJEOKTKBHET-VWLOTQADSA-N 0 3 406.570 4.451 20 0 HIADHN C[C@@H](CNC(=O)C1(c2ccc(Br)cc2)CC1)N(C)Cc1ccccc1 ZINC000303540541 855025351 /nfs/dbraw/zinc/02/53/51/855025351.db2.gz YKFWPTMTRLXKCH-INIZCTEOSA-N 0 3 401.348 4.117 20 0 HIADHN Cc1nc2c(s1)[C@@H](N(C)C(=O)[C@@H]1CCCN(Cc3cccc(F)c3)C1)CCC2 ZINC000303576855 855052820 /nfs/dbraw/zinc/05/28/20/855052820.db2.gz ZLOJHFKLESHJPV-XLIONFOSSA-N 0 3 401.551 4.339 20 0 HIADHN C[C@H](CNC(=O)/C=C/c1ccc(-c2ccccc2Cl)s1)CN1CCN(C)CC1 ZINC000303617097 855079283 /nfs/dbraw/zinc/07/92/83/855079283.db2.gz ZZWHJHHAIXOIGP-SYJIQKIWSA-N 0 3 418.006 4.081 20 0 HIADHN CCCCN(CC/C=C/c1ccc(Br)cc1)[C@H]1CCS(=O)(=O)C1 ZINC000303648054 855103494 /nfs/dbraw/zinc/10/34/94/855103494.db2.gz DARYMKXKJBEKIA-JXTAAOLFSA-N 0 3 400.382 4.142 20 0 HIADHN CCCCN(CC/C=C/c1ccc(Br)cc1)[C@@H]1CCS(=O)(=O)C1 ZINC000303648057 855103619 /nfs/dbraw/zinc/10/36/19/855103619.db2.gz DARYMKXKJBEKIA-MJICGBHWSA-N 0 3 400.382 4.142 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3ccccc3OC(C)(C)C)CC2)C[C@H](C)O1 ZINC000303701134 855141106 /nfs/dbraw/zinc/14/11/06/855141106.db2.gz OGQJICNHTGVFMY-HDICACEKSA-N 0 3 403.567 4.217 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1NC(=O)[C@@H](C)N1CCN(C2CCC(C)CC2)CC1 ZINC000303737655 855161985 /nfs/dbraw/zinc/16/19/85/855161985.db2.gz XEPBOFUNPFOIDH-NFOQDIRWSA-N 0 3 423.605 4.012 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)[C@@H](C)Oc3ccc(SC)cc3)c(C)c2)CC1 ZINC000303807318 855211330 /nfs/dbraw/zinc/21/13/30/855211330.db2.gz KOVZCFILYJFWJG-GOSISDBHSA-N 0 3 413.587 4.265 20 0 HIADHN COc1cc(OC)c(NC(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)cc1Cl ZINC000303851738 855248102 /nfs/dbraw/zinc/24/81/02/855248102.db2.gz KVAZKOCHFPQMMR-INIZCTEOSA-N 0 3 417.937 4.486 20 0 HIADHN Cc1cc(C)n(-c2ccc(C(=O)N3CCCN(Cc4ccccc4)C[C@H]3C)cc2F)n1 ZINC000303914877 855287135 /nfs/dbraw/zinc/28/71/35/855287135.db2.gz UXSYPIZLQKISSF-HXUWFJFHSA-N 0 3 420.532 4.365 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)[C@@H]1C[C@H]1c1cc(F)ccc1F ZINC000303928365 855297245 /nfs/dbraw/zinc/29/72/45/855297245.db2.gz UWJGKOPZPFJQOG-AZUAARDMSA-N 0 3 402.510 4.298 20 0 HIADHN O=C(NC[C@H]1CCCCN1Cc1ccccc1)c1c(F)cccc1Br ZINC000379713824 855427819 /nfs/dbraw/zinc/42/78/19/855427819.db2.gz UOEPCEDRKASZBT-MRXNPFEDSA-N 0 3 405.311 4.373 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)c1ccc(F)cc1Br ZINC000383050452 855435859 /nfs/dbraw/zinc/43/58/59/855435859.db2.gz IGJBHQMSZPPTGG-OAHLLOKOSA-N 0 3 405.311 4.325 20 0 HIADHN COc1ccc(Br)cc1C(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C ZINC000383043536 855436008 /nfs/dbraw/zinc/43/60/08/855436008.db2.gz DNVHKFFBGNNKPZ-INIZCTEOSA-N 0 3 417.347 4.194 20 0 HIADHN C[C@@H](C[C@@H]1COCCN1C(=O)OC(C)(C)C)NCc1ccsc1Br ZINC000388551047 855447582 /nfs/dbraw/zinc/44/75/82/855447582.db2.gz PAKDLDUZOAANDF-GXTWGEPZSA-N 0 3 419.385 4.015 20 0 HIADHN C[C@@H](NC[C@@H]1CN(Cc2ccccc2)CCCO1)c1sccc1Br ZINC000390846073 855457141 /nfs/dbraw/zinc/45/71/41/855457141.db2.gz FLHILXJUUCWOQJ-NVXWUHKLSA-N 0 3 409.393 4.452 20 0 HIADHN COc1ccc([C@@H](C)NCc2cc(Br)c(OC)c(OC)c2)cc1OC ZINC000392326416 855463934 /nfs/dbraw/zinc/46/39/34/855463934.db2.gz ZGTMTBVKGVPXAS-GFCCVEGCSA-N 0 3 410.308 4.334 20 0 HIADHN C[C@@H](NCC1([S@@](C)=O)CCC1)c1ccc(Br)cc1Br ZINC000393697197 855469045 /nfs/dbraw/zinc/46/90/45/855469045.db2.gz HKUVMUSHWDGHIN-GIGQVBGESA-N 0 3 409.187 4.163 20 0 HIADHN Brc1cc(Br)cc(CNCc2ccc3c(c2)OCCO3)c1 ZINC000394583809 855470969 /nfs/dbraw/zinc/47/09/69/855470969.db2.gz VQCMHROIPMLTEQ-UHFFFAOYSA-N 0 3 413.109 4.273 20 0 HIADHN C[C@H]1C[C@H](NCc2cccc(F)c2Br)CCN1C(=O)OC(C)(C)C ZINC000394620402 855471031 /nfs/dbraw/zinc/47/10/31/855471031.db2.gz XIMHTQQEQLHKSV-GXTWGEPZSA-N 0 3 401.320 4.466 20 0 HIADHN CCOCCOc1ccc(Br)cc1CN[C@@H]1CCCc2[nH]c(=O)ccc21 ZINC000409471483 855497612 /nfs/dbraw/zinc/49/76/12/855497612.db2.gz XOFUPDFMPOHDCX-QGZVFWFLSA-N 0 3 421.335 4.132 20 0 HIADHN O=C(Nc1ccc(OCc2noc(C3CC3)n2)cc1)c1cccc(CN2CCCC2)c1 ZINC000409513323 855517210 /nfs/dbraw/zinc/51/72/10/855517210.db2.gz MHQPQCJLOMRNKJ-UHFFFAOYSA-N 0 3 418.497 4.374 20 0 HIADHN CSc1nccn1-c1ccc(C(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)cc1 ZINC000409569712 855544960 /nfs/dbraw/zinc/54/49/60/855544960.db2.gz IUXYKRFFQZDFGW-FXAWDEMLSA-N 0 3 406.555 4.160 20 0 HIADHN CCN(CC)[C@H](CNC(=O)[C@H]1CCCc2nn(C)cc21)c1ccc(C(F)(F)F)cc1 ZINC000409572084 855545706 /nfs/dbraw/zinc/54/57/06/855545706.db2.gz AVQKHEFSZZVZLB-FXAWDEMLSA-N 0 3 422.495 4.058 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)NC[C@H]3CCCC(F)(F)C3)CC2)c1 ZINC000409636572 855575023 /nfs/dbraw/zinc/57/50/23/855575023.db2.gz HAGFYZPPEKWANG-FQEVSTJZSA-N 0 3 422.564 4.022 20 0 HIADHN O=C(Cc1cccc(OC(F)F)c1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000409763691 855640768 /nfs/dbraw/zinc/64/07/68/855640768.db2.gz PPBDHBUHGVKKBI-UHFFFAOYSA-N 0 3 406.498 4.061 20 0 HIADHN C[C@@H](C(=O)NCc1ccccc1CN1CCC(O)CC1)c1ccc(C(F)(F)F)cc1 ZINC000409772765 855645909 /nfs/dbraw/zinc/64/59/09/855645909.db2.gz ZBKHULUCYYHJCQ-MRXNPFEDSA-N 0 3 420.475 4.082 20 0 HIADHN Cc1cc(NC(=O)CCCC2CCOCC2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000409833259 855678608 /nfs/dbraw/zinc/67/86/08/855678608.db2.gz AKWYWMKJRZXRNC-JOCHJYFZSA-N 0 3 410.562 4.174 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)c3cnccc3Oc3ccccc3)c2)CC1 ZINC000409935171 855732397 /nfs/dbraw/zinc/73/23/97/855732397.db2.gz AYEWPGKVIJGUNC-UHFFFAOYSA-N 0 3 402.498 4.268 20 0 HIADHN Cc1cc(NC(=O)[C@H]2CCCC(F)(F)C2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000409980856 855759734 /nfs/dbraw/zinc/75/97/34/855759734.db2.gz PWCMROHAWOCBPG-RBUKOAKNSA-N 0 3 402.489 4.403 20 0 HIADHN CC(C)(C)[C@@H](CN1CCc2ccccc2C1)NC(=O)c1cncc(Br)c1 ZINC000410051273 855801169 /nfs/dbraw/zinc/80/11/69/855801169.db2.gz GLXTYXXUJXQKQT-LJQANCHMSA-N 0 3 416.363 4.047 20 0 HIADHN Cc1noc2nc(C)cc(C(=O)N[C@@H](CN3CCc4ccccc4C3)C(C)(C)C)c12 ZINC000410055563 855803301 /nfs/dbraw/zinc/80/33/01/855803301.db2.gz WHFVZCRRIQQLES-FQEVSTJZSA-N 0 3 406.530 4.042 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1C[C@@H](C)O[C@H](c2ccccc2)C1)c1ccsc1 ZINC000410120226 855828550 /nfs/dbraw/zinc/82/85/50/855828550.db2.gz TVAGGGGPHGORQY-UIFIKXQLSA-N 0 3 401.576 4.303 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1C[C@@H](c2ccccc2)O[C@@H](C)C1)c1ccsc1 ZINC000410120228 855828640 /nfs/dbraw/zinc/82/86/40/855828640.db2.gz TVAGGGGPHGORQY-WMQCIHAUSA-N 0 3 401.576 4.303 20 0 HIADHN CC(C)[C@H](NC(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1)c1ccc(F)cc1 ZINC000410221331 855867249 /nfs/dbraw/zinc/86/72/49/855867249.db2.gz VJQUZOUSSINNAM-HMFYCAOWSA-N 0 3 405.558 4.054 20 0 HIADHN COc1ccc(CNCCc2nc3c(cccc3C)o2)c(OCc2cccnc2)c1 ZINC000410318124 855925616 /nfs/dbraw/zinc/92/56/16/855925616.db2.gz OGMVUDWACDEFKL-UHFFFAOYSA-N 0 3 403.482 4.451 20 0 HIADHN CC[C@H](CSc1ccc(C)c(C)c1)NC(=O)N1CCN(C2CCOCC2)C[C@@H]1C ZINC000425914008 855996210 /nfs/dbraw/zinc/99/62/10/855996210.db2.gz DRCYCOQBHDOIIG-VQTJNVASSA-N 0 3 419.635 4.069 20 0 HIADHN C[C@H]1CN(C2CCOCC2)CCN1C(=O)N[C@@H](c1cccc(Cl)c1)C1CCCC1 ZINC000425928283 856004322 /nfs/dbraw/zinc/00/43/22/856004322.db2.gz XTKMAKIJGJFOMM-HTAPYJJXSA-N 0 3 419.997 4.466 20 0 HIADHN Cc1ccc2cc([C@H](C)NCc3ccc(CS(=O)(=O)NC(C)C)cc3)oc2c1 ZINC000425933589 856007757 /nfs/dbraw/zinc/00/77/57/856007757.db2.gz ZZKWGANGJXMMJT-KRWDZBQOSA-N 0 3 400.544 4.420 20 0 HIADHN CCc1nc(C)c(CNC(=O)N(CCN(C)Cc2ccccc2)Cc2ccccc2)o1 ZINC000425938309 856010461 /nfs/dbraw/zinc/01/04/61/856010461.db2.gz WSFLWPKCIIFIDX-UHFFFAOYSA-N 0 3 420.557 4.389 20 0 HIADHN COC(=O)c1ccc(COc2ccc(CNCc3cscc3C)cc2OC)o1 ZINC000425972527 856024882 /nfs/dbraw/zinc/02/48/82/856024882.db2.gz YUCMZDPZJVAGSQ-UHFFFAOYSA-N 0 3 401.484 4.314 20 0 HIADHN CC[C@H](C)[C@@H](NC(=O)N1CCN(C2CCOCC2)C[C@@H]1C)c1ccc(Cl)cc1 ZINC000426025263 856054969 /nfs/dbraw/zinc/05/49/69/856054969.db2.gz YSIGQGRLKYPCFO-XGHQBKJUSA-N 0 3 407.986 4.322 20 0 HIADHN CCN(CCN[C@H](C)c1ccccc1I)CCC(F)(F)F ZINC000426031786 856058559 /nfs/dbraw/zinc/05/85/59/856058559.db2.gz ULYBLDGGIMGSQN-GFCCVEGCSA-N 0 3 414.253 4.216 20 0 HIADHN C[C@H](NC1CCN(S(=O)(=O)C(C)(C)C)CC1)c1nc(-c2ccccc2)cs1 ZINC000426035006 856062139 /nfs/dbraw/zinc/06/21/39/856062139.db2.gz KGMKUWUAOCMICC-HNNXBMFYSA-N 0 3 407.605 4.053 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3CCC[C@@H]3c3csc(C)n3)c(C)c2)CC1 ZINC000426104587 856110140 /nfs/dbraw/zinc/11/01/40/856110140.db2.gz QZQCAEOPQZAJRA-OAQYLSRUSA-N 0 3 413.591 4.271 20 0 HIADHN O=C(Nc1cccc(-c2cccs2)c1)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1CO ZINC000426109021 856112250 /nfs/dbraw/zinc/11/22/50/856112250.db2.gz AXNHOGQNFKSMEM-RBBKRZOGSA-N 0 3 421.566 4.420 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)N1CCc2ccc(F)c(F)c2C1 ZINC000426111514 856114990 /nfs/dbraw/zinc/11/49/90/856114990.db2.gz IIZNCLOMBJMDCS-UHFFFAOYSA-N 0 3 417.525 4.146 20 0 HIADHN CN(C)[C@H](CNC(=O)N1CCC[C@H](c2nc3c(s2)CCCC3)C1)c1ccccc1 ZINC000426232920 856190791 /nfs/dbraw/zinc/19/07/91/856190791.db2.gz PFFGNTGTJFJCTN-AZUAARDMSA-N 0 3 412.603 4.214 20 0 HIADHN CCS[C@@H]1CCCC[C@@H]1NC(=O)Nc1ccc(N2CCN(CC)CC2)cc1C ZINC000426630850 856382768 /nfs/dbraw/zinc/38/27/68/856382768.db2.gz VYMOOBKJHXWQIW-LEWJYISDSA-N 0 3 404.624 4.323 20 0 HIADHN CCN(C(=O)c1cc(C)nc(C(F)(F)F)n1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000426640138 856389624 /nfs/dbraw/zinc/38/96/24/856389624.db2.gz QEVJGJRQQYGGCM-RDJZCZTQSA-N 0 3 406.452 4.101 20 0 HIADHN Cc1cccc(-c2cncc(C(=O)N3CCC(CCN4C[C@@H](C)O[C@@H](C)C4)CC3)c2)c1 ZINC000426657607 856397411 /nfs/dbraw/zinc/39/74/11/856397411.db2.gz QDZXHZDKRLMREG-OYRHEFFESA-N 0 3 421.585 4.409 20 0 HIADHN COc1cccc(/C=C(/CC(=O)N(C)CCN(C)C)c2nc3ccccc3s2)c1 ZINC000426689774 856414196 /nfs/dbraw/zinc/41/41/96/856414196.db2.gz XHKUEJZBPAYGAW-JXAWBTAJSA-N 0 3 409.555 4.256 20 0 HIADHN CN(C(=O)c1c[nH]nc1-c1c(F)cccc1F)C1CCN(Cc2ccccc2)CC1 ZINC000426732201 856440740 /nfs/dbraw/zinc/44/07/40/856440740.db2.gz HQOHUVOXQKOUFN-UHFFFAOYSA-N 0 3 410.468 4.092 20 0 HIADHN C[C@@H]1CN(CCC2CCN(Cc3nc4ccccc4n3C(F)F)CC2)C[C@H](C)O1 ZINC000426782853 856475627 /nfs/dbraw/zinc/47/56/27/856475627.db2.gz HWPIYSIEGUZDHK-CALCHBBNSA-N 0 3 406.521 4.143 20 0 HIADHN Cc1ccc(C(=O)NCCCCN2C[C@@H](C)O[C@@H](C)C2)c(Sc2ccccc2)n1 ZINC000426878972 856524324 /nfs/dbraw/zinc/52/43/24/856524324.db2.gz NKEZMGZHLLBGKF-KDURUIRLSA-N 0 3 413.587 4.160 20 0 HIADHN C[C@H](NC(=O)N(CCN(C)C)Cc1ccccc1F)c1nc(C(F)(F)F)cs1 ZINC000426899660 856532937 /nfs/dbraw/zinc/53/29/37/856532937.db2.gz WYGCIFYKLLLVFC-LBPRGKRZSA-N 0 3 418.460 4.135 20 0 HIADHN CC[C@@H](C)Oc1ccc(C(=O)Nc2ccc(C(=O)N(C)[C@@H]3CCCN(C)C3)cc2)cc1 ZINC000426947157 856556712 /nfs/dbraw/zinc/55/67/12/856556712.db2.gz BPFRNVLNWSRPGR-XMSQKQJNSA-N 0 3 423.557 4.282 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)C/C=C\c2ccccc2F)cc1)[C@H]1CCCN(C)C1 ZINC000426948125 856556848 /nfs/dbraw/zinc/55/68/48/856556848.db2.gz KGYSUFCOVYYYTL-DPVXCJKMSA-N 0 3 409.505 4.034 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)CCCCCc3ccc(F)cc3)CC2)C[C@@H](C)O1 ZINC000427127055 856655494 /nfs/dbraw/zinc/65/54/94/856655494.db2.gz SMBATKBCRHJPBT-WOJBJXKFSA-N 0 3 404.570 4.276 20 0 HIADHN C[C@H]1CCN(C(=O)c2ccc(-c3ccccc3)[nH]c2=O)CCN1Cc1ccccc1 ZINC000437464376 862826455 /nfs/dbraw/zinc/82/64/55/862826455.db2.gz CDSGDMOFFNSAQJ-IBGZPJMESA-N 0 3 401.510 4.191 20 0 HIADHN CCc1c(C(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)cnn1-c1ccccc1 ZINC000437467045 862829092 /nfs/dbraw/zinc/82/90/92/862829092.db2.gz BRMQDNXRYLEKJD-FQEVSTJZSA-N 0 3 402.542 4.171 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)c3cccc(Oc4ccncc4)c3)CC2)C[C@H](C)O1 ZINC000427286735 856752049 /nfs/dbraw/zinc/75/20/49/856752049.db2.gz GZPFXYOPCMETSI-PMACEKPBSA-N 0 3 423.557 4.225 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)c3cccc(OC4CCCC4)c3)CC2)C[C@H](C)O1 ZINC000427287748 856752242 /nfs/dbraw/zinc/75/22/42/856752242.db2.gz MGCOYWZXZZVTEW-PMACEKPBSA-N 0 3 414.590 4.360 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)c3c(Cl)c4ccccc4n3C)CC2)C[C@H](C)O1 ZINC000427293947 856756301 /nfs/dbraw/zinc/75/63/01/856756301.db2.gz BPJQHYMFSTWHFD-IRXDYDNUSA-N 0 3 417.981 4.183 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)[C@@H]3CCCC[C@H]3C(F)(F)F)CC2)C[C@@H](C)O1 ZINC000427298138 856758487 /nfs/dbraw/zinc/75/84/87/856758487.db2.gz ZUYGPSQZAVTIOG-PSBWJHGTSA-N 0 3 404.517 4.093 20 0 HIADHN Cc1nc2cc(F)ccc2cc1C(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000427298282 856758879 /nfs/dbraw/zinc/75/88/79/856758879.db2.gz AZJQYZWNBFRGFC-IAGOWNOFSA-N 0 3 413.537 4.034 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3cc(Oc4ccccc4)ccn3)CC2)C[C@H](C)O1 ZINC000427299374 856759508 /nfs/dbraw/zinc/75/95/08/856759508.db2.gz MDIOQFWTWUSBSC-BGYRXZFFSA-N 0 3 423.557 4.225 20 0 HIADHN C[C@H](SCc1ccccc1)C(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000427306146 856762119 /nfs/dbraw/zinc/76/21/19/856762119.db2.gz ZRCWIQCDPCBIKW-ZCNNSNEGSA-N 0 3 404.620 4.046 20 0 HIADHN Cc1nc(-c2ccccc2)oc1C(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000427309786 856763473 /nfs/dbraw/zinc/76/34/73/856763473.db2.gz WANZWVDBBPEBOI-HDICACEKSA-N 0 3 411.546 4.002 20 0 HIADHN Cc1onc(-c2ccccc2)c1C(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000427310190 856764354 /nfs/dbraw/zinc/76/43/54/856764354.db2.gz XVDIAASJWYUJCQ-HDICACEKSA-N 0 3 411.546 4.002 20 0 HIADHN Cc1onc(-c2ccccc2)c1C(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000427310191 856764562 /nfs/dbraw/zinc/76/45/62/856764562.db2.gz XVDIAASJWYUJCQ-QZTJIDSGSA-N 0 3 411.546 4.002 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3ccc(-c4ccc(F)cc4)o3)CC2)C[C@@H](C)O1 ZINC000427319895 856768803 /nfs/dbraw/zinc/76/88/03/856768803.db2.gz JXKLEKLRKRBMFR-QZTJIDSGSA-N 0 3 414.521 4.437 20 0 HIADHN Cc1ccc2c(CCC(=O)N3CCC(CCN4C[C@@H](C)O[C@@H](C)C4)CC3)c[nH]c2c1 ZINC000427321874 856770407 /nfs/dbraw/zinc/77/04/07/856770407.db2.gz QYLIHIQLXCYHCW-BGYRXZFFSA-N 0 3 411.590 4.147 20 0 HIADHN COc1ccc2cc(C(=O)N3CC[C@@H](C)N(Cc4ccccc4)CC3)c(C)nc2c1 ZINC000437472897 862834411 /nfs/dbraw/zinc/83/44/11/862834411.db2.gz FWSYUHSVWZHGQM-GOSISDBHSA-N 0 3 403.526 4.288 20 0 HIADHN C[C@@H](CCc1cccc(F)c1)C(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000427343802 856783578 /nfs/dbraw/zinc/78/35/78/856783578.db2.gz YFQPBUHRGCTFOF-SLFFLAALSA-N 0 3 404.570 4.132 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)[C@H]3CCSc4ccccc43)CC2)C[C@H](C)O1 ZINC000427346823 856784951 /nfs/dbraw/zinc/78/49/51/856784951.db2.gz KUSMRPHWMOWUPN-UEXGIBASSA-N 0 3 402.604 4.004 20 0 HIADHN COc1ccccc1CC(C)(C)C(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000427359125 856791463 /nfs/dbraw/zinc/79/14/63/856791463.db2.gz TZLQGPDMOQXGBG-WOJBJXKFSA-N 0 3 416.606 4.002 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Cc3csc4ccccc34)CC2)C[C@@H](C)O1 ZINC000427360245 856791561 /nfs/dbraw/zinc/79/15/61/856791561.db2.gz YPAJFYUGOVEYIE-QZTJIDSGSA-N 0 3 400.588 4.182 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Cc3csc4ccccc34)CC2)C[C@H](C)O1 ZINC000427360244 856792137 /nfs/dbraw/zinc/79/21/37/856792137.db2.gz YPAJFYUGOVEYIE-HDICACEKSA-N 0 3 400.588 4.182 20 0 HIADHN CCc1c(NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)cnn1CCC(C)C ZINC000427416084 856811644 /nfs/dbraw/zinc/81/16/44/856811644.db2.gz VDOVNQJVKCYSDQ-LJQANCHMSA-N 0 3 400.542 4.481 20 0 HIADHN Cc1ccc(-c2cc(C(=O)Nc3cc(CN4CCOCC4)ccc3C)[nH]n2)c(C)c1 ZINC000427462106 856831057 /nfs/dbraw/zinc/83/10/57/856831057.db2.gz IEMKSLIDMLQQAA-UHFFFAOYSA-N 0 3 404.514 4.086 20 0 HIADHN COc1ccc(C(=O)CCC(=O)Nc2cc(CN3CCCC3)ccc2C)cc1OC ZINC000427491034 856840430 /nfs/dbraw/zinc/84/04/30/856840430.db2.gz RLQHSVXQDFYZOZ-UHFFFAOYSA-N 0 3 410.514 4.210 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N[C@@H](C)c1cc(Cl)ccc1Cl ZINC000427506127 856844603 /nfs/dbraw/zinc/84/46/03/856844603.db2.gz MQHHUFLFNKXPPS-ZDUSSCGKSA-N 0 3 408.329 4.179 20 0 HIADHN C[C@H](NC1CCN([C@@H](C)c2ccncc2)CC1)c1ncc(Br)cc1F ZINC000427525419 856849675 /nfs/dbraw/zinc/84/96/75/856849675.db2.gz QZMWPARWPGSDGT-KBPBESRZSA-N 0 3 407.331 4.254 20 0 HIADHN C[C@H]1CCN(C(=O)COc2ccc(Cl)c3cccnc23)CCN1Cc1ccccc1 ZINC000437489521 862848000 /nfs/dbraw/zinc/84/80/00/862848000.db2.gz ZZEYGMFEHGVAIS-SFHVURJKSA-N 0 3 423.944 4.390 20 0 HIADHN COc1ccc(CCN[C@H](C)c2ncc(Br)cc2F)cc1OC(F)F ZINC000427693791 856911818 /nfs/dbraw/zinc/91/18/18/856911818.db2.gz HALNBOJKPWTNAX-SNVBAGLBSA-N 0 3 419.241 4.487 20 0 HIADHN C[C@@H]1CCN(C(=O)c2ccc(OCc3ccccc3)nc2)CCN1Cc1ccccc1 ZINC000437492420 862849987 /nfs/dbraw/zinc/84/99/87/862849987.db2.gz GBLHNYHZYOSLIM-OAQYLSRUSA-N 0 3 415.537 4.397 20 0 HIADHN O=C(CCc1ccccc1)N1CC[C@@H](N[C@H]2CCCc3ncc(C(F)(F)F)cc32)C1 ZINC000427698463 856913998 /nfs/dbraw/zinc/91/39/98/856913998.db2.gz TVUSUGABDANGOU-NQIIRXRSSA-N 0 3 417.475 4.301 20 0 HIADHN CCc1noc(-c2ccc(CCN[C@H](C)c3ncc(Br)cc3F)cc2)n1 ZINC000427710836 856918283 /nfs/dbraw/zinc/91/82/83/856918283.db2.gz QMMWVCPJFNSUCI-GFCCVEGCSA-N 0 3 419.298 4.489 20 0 HIADHN CC(C)n1ncc2cc(S(=O)(=O)NCC(C)(C)N[C@@H](C)c3ccccc3)ccc21 ZINC000427845196 856978505 /nfs/dbraw/zinc/97/85/05/856978505.db2.gz PFROZXQBGBIVJL-KRWDZBQOSA-N 0 3 414.575 4.025 20 0 HIADHN Fc1cccc([C@H](N[C@@H]2CCn3ccnc3C2)c2cccc(Br)c2)c1 ZINC000427866095 856987149 /nfs/dbraw/zinc/98/71/49/856987149.db2.gz OZCROSYHZBQHAM-UYAOXDASSA-N 0 3 400.295 4.479 20 0 HIADHN Fc1cccc([C@H](N[C@H]2CCn3ccnc3C2)c2cccc(Br)c2)c1 ZINC000427866092 856987247 /nfs/dbraw/zinc/98/72/47/856987247.db2.gz OZCROSYHZBQHAM-AZUAARDMSA-N 0 3 400.295 4.479 20 0 HIADHN CO[C@H](C)c1nc(CN2CCCN(CCCOc3cc(C)ccc3C)CC2)cs1 ZINC000437539002 862873772 /nfs/dbraw/zinc/87/37/72/862873772.db2.gz QUXHLBXCEVOLTG-HXUWFJFHSA-N 0 3 417.619 4.444 20 0 HIADHN C[C@H]1CCN(Cc2cnn(Cc3ccc(C(F)(F)F)cc3)c2)C[C@H]1n1ccnc1 ZINC000428265515 857133310 /nfs/dbraw/zinc/13/33/10/857133310.db2.gz OXIJXBGDDQBFRQ-OXJNMPFZSA-N 0 3 403.452 4.230 20 0 HIADHN CO[C@@H](C)c1nc(CN2CCCN(CCOc3cc(C)ccc3C)CC2)cs1 ZINC000437540835 862875051 /nfs/dbraw/zinc/87/50/51/862875051.db2.gz WAFRXAIRYBZHDQ-IBGZPJMESA-N 0 3 403.592 4.054 20 0 HIADHN Cc1nc(-c2cccs2)ccc1C(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000428445521 857206455 /nfs/dbraw/zinc/20/64/55/857206455.db2.gz ZGJPLNPFKUFVKS-FQEVSTJZSA-N 0 3 421.566 4.139 20 0 HIADHN COc1cc(CN2CC[C@H](O)[C@@H](C)C2)ccc1OCc1ccc(Br)cc1 ZINC000428473631 857213988 /nfs/dbraw/zinc/21/39/88/857213988.db2.gz NMZCSFCIGJLHDM-KXBFYZLASA-N 0 3 420.347 4.239 20 0 HIADHN CCOc1cc(CN2CC[C@@H](O)[C@H](C)C2)ccc1OCCOc1cccc(Cl)c1 ZINC000428480103 857219011 /nfs/dbraw/zinc/21/90/11/857219011.db2.gz BJMDCFZSUGIXFD-DYESRHJHSA-N 0 3 419.949 4.399 20 0 HIADHN COc1ccc(C2(C(=O)Nc3cccc(CN4CC[C@H](O)C4)c3)CC3(CCC3)C2)cc1 ZINC000428531288 857244469 /nfs/dbraw/zinc/24/44/69/857244469.db2.gz AQRJHIFTOHNXID-QFIPXVFZSA-N 0 3 420.553 4.102 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)C12C[C@H]3C[C@@H](C1)CC(C(F)(F)F)(C3)C2 ZINC000428531206 857244578 /nfs/dbraw/zinc/24/45/78/857244578.db2.gz FHIQAZUYEJOUOM-JSGZMEPFSA-N 0 3 422.491 4.341 20 0 HIADHN O=C(Cc1csc2ccc(Cl)cc12)Nc1cccc(CN2CC[C@@H](O)C2)c1 ZINC000428540490 857251128 /nfs/dbraw/zinc/25/11/28/857251128.db2.gz RUMMDSBGFCRFAN-GOSISDBHSA-N 0 3 400.931 4.303 20 0 HIADHN Cn1c(CNC[C@]2(Cc3ccc(F)cc3)CCC[C@H]2O)nc2ccc(Cl)cc21 ZINC000428564104 857266987 /nfs/dbraw/zinc/26/69/87/857266987.db2.gz IJXJUIZHAJUOQJ-IFMALSPDSA-N 0 3 401.913 4.229 20 0 HIADHN CSc1cccc(N(C(=O)c2ccnc(N3CC[C@@H](C)C3)c2)C2CCN(C)CC2)c1 ZINC000437568896 862891221 /nfs/dbraw/zinc/89/12/21/862891221.db2.gz PDSIKOBCLCVSFT-GOSISDBHSA-N 0 3 424.614 4.391 20 0 HIADHN COc1ccc2nc(CNC[C@]3(Cc4ccc(F)cc4)CCC[C@@H]3O)sc2c1 ZINC000428571142 857269419 /nfs/dbraw/zinc/26/94/19/857269419.db2.gz JFLTVWOMADCDLH-RBBKRZOGSA-N 0 3 400.519 4.308 20 0 HIADHN CCN1CCN(CCC(=O)Nc2ccc(C)c(OCc3cccc(Cl)c3)c2)CC1 ZINC000428593782 857274363 /nfs/dbraw/zinc/27/43/63/857274363.db2.gz BSLGDYNNYYEAMW-UHFFFAOYSA-N 0 3 415.965 4.194 20 0 HIADHN COc1cc(OC)c(NC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)cc1Cl ZINC000437576364 862894795 /nfs/dbraw/zinc/89/47/95/862894795.db2.gz FUNIICFDXXGZEB-INIZCTEOSA-N 0 3 417.937 4.486 20 0 HIADHN Cc1cc([C@H](C)NC(=O)NC[C@H]2CN(Cc3ccccc3)CCCO2)c(C)s1 ZINC000428691026 857298759 /nfs/dbraw/zinc/29/87/59/857298759.db2.gz GQESOYFKULOIIV-PXNSSMCTSA-N 0 3 401.576 4.016 20 0 HIADHN CSc1cccc(N(C(=O)c2cn(C)c(=O)c3ccccc23)C2CCN(C)CC2)c1 ZINC000428711320 857306619 /nfs/dbraw/zinc/30/66/19/857306619.db2.gz OFXVMOVDIBTZFW-UHFFFAOYSA-N 0 3 421.566 4.001 20 0 HIADHN COC(=O)[C@@H]1CCO[C@H]1C1CCN([C@H]2CCCc3ccc(Br)cc32)CC1 ZINC000428730039 857311805 /nfs/dbraw/zinc/31/18/05/857311805.db2.gz IVAVGDIQVHWOAT-HOJAQTOUSA-N 0 3 422.363 4.117 20 0 HIADHN CCC(C)(C)OCc1cccc(NC(=O)N(CCN(C)C)C[C@H]2CCCO2)c1C ZINC000428758506 857321485 /nfs/dbraw/zinc/32/14/85/857321485.db2.gz MJPCPXJJMVPXBY-HXUWFJFHSA-N 0 3 405.583 4.275 20 0 HIADHN COc1cc(CN(Cc2ccncc2)[C@H]2CCCN(Cc3ccccc3)C2)ccn1 ZINC000428797560 857346594 /nfs/dbraw/zinc/34/65/94/857346594.db2.gz DMCBAKVZDGLGEA-DEOSSOPVSA-N 0 3 402.542 4.152 20 0 HIADHN CC(C)c1noc(CN(Cc2ccncc2)[C@@H]2CCCN(Cc3ccccc3)C2)n1 ZINC000428812887 857357419 /nfs/dbraw/zinc/35/74/19/857357419.db2.gz ODZFJZYGPGJWNX-JOCHJYFZSA-N 0 3 405.546 4.255 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)NCc3cc4ccccc4s3)CC2)C[C@H](C)O1 ZINC000428827609 857363231 /nfs/dbraw/zinc/36/32/31/857363231.db2.gz NOFUVJXINBGCDA-HDICACEKSA-N 0 3 415.603 4.322 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)Nc3ncc(C(C)(C)C)s3)CC2)C[C@H](C)O1 ZINC000428846289 857370153 /nfs/dbraw/zinc/37/01/53/857370153.db2.gz BTURKAKDQMDNJZ-HOTGVXAUSA-N 0 3 408.612 4.184 20 0 HIADHN CC(C)N(CC(=O)N1CCC(C(=O)Nc2ccccc2)CC1)[C@H](C)c1ccccc1 ZINC000428868897 857379653 /nfs/dbraw/zinc/37/96/53/857379653.db2.gz SROIFMYRJRCICW-HXUWFJFHSA-N 0 3 407.558 4.335 20 0 HIADHN CCc1nc2cc(NC(=O)N3CCC(CCN4C[C@@H](C)O[C@H](C)C4)CC3)ccc2o1 ZINC000428889226 857393103 /nfs/dbraw/zinc/39/31/03/857393103.db2.gz VWNMZVFKTDUABZ-IAGOWNOFSA-N 0 3 414.550 4.133 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)N[C@@H]3CCSc4ccccc43)CC2)C[C@@H](C)O1 ZINC000428917969 857412876 /nfs/dbraw/zinc/41/28/76/857412876.db2.gz SLKMIZZJKFQYFW-DBXWQHBBSA-N 0 3 417.619 4.144 20 0 HIADHN CCO[C@H]1C[C@@H](O)C12CCN(Cc1cccc3c(Br)cccc13)CC2 ZINC000429046836 857474533 /nfs/dbraw/zinc/47/45/33/857474533.db2.gz JIPUSBSPBLWBRS-UXHICEINSA-N 0 3 404.348 4.354 20 0 HIADHN CSCc1ccc(NC(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)cc1 ZINC000429059953 857486010 /nfs/dbraw/zinc/48/60/10/857486010.db2.gz BRRVLYHLDOIZJE-QZTJIDSGSA-N 0 3 405.608 4.293 20 0 HIADHN C[C@@H](NC(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1)c1cccc(O)c1 ZINC000429120612 857518722 /nfs/dbraw/zinc/51/87/22/857518722.db2.gz BGVBOYCINQXIEZ-OAHLLOKOSA-N 0 3 409.452 4.245 20 0 HIADHN C[C@@H](NC(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1)c1cc2ccccc2o1 ZINC000429188360 857546443 /nfs/dbraw/zinc/54/64/43/857546443.db2.gz MQGSNZLJQWATGB-GUDVDZBRSA-N 0 3 413.562 4.415 20 0 HIADHN C[C@@H](NC(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1)c1cccc(Cl)c1 ZINC000429201308 857550545 /nfs/dbraw/zinc/55/05/45/857550545.db2.gz RVMSOGUCFUNEJY-KZNAEPCWSA-N 0 3 407.986 4.322 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)Nc3ccc(OC(F)F)cc3)CC2)C[C@H](C)O1 ZINC000429220905 857561043 /nfs/dbraw/zinc/56/10/43/857561043.db2.gz LFAOGYYDHHZRDW-HOTGVXAUSA-N 0 3 411.493 4.031 20 0 HIADHN CCCn1ccnc1CCCN(C)[C@H](C)C(=O)Nc1cc(C)c(Cl)cc1OC ZINC000429255044 857576768 /nfs/dbraw/zinc/57/67/68/857576768.db2.gz SBHMQEVOJUFDLH-MRXNPFEDSA-N 0 3 406.958 4.155 20 0 HIADHN CN(C)CCN(C)C(=O)Nc1ccc(COc2ccc(Br)cc2)cc1 ZINC000429257870 857578501 /nfs/dbraw/zinc/57/85/01/857578501.db2.gz GAUHOWOMQZSKPH-UHFFFAOYSA-N 0 3 406.324 4.053 20 0 HIADHN CSC[C@@H]1CCCN(CC(=O)N(Cc2ccc(C(F)(F)F)cc2)C2CC2)C1 ZINC000429290740 857593764 /nfs/dbraw/zinc/59/37/64/857593764.db2.gz ZNGZPXOLDIPAIA-MRXNPFEDSA-N 0 3 400.510 4.271 20 0 HIADHN O=C(CN[C@@H]1Cc2cccc(O)c2C1)N1CCC[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000429297822 857596138 /nfs/dbraw/zinc/59/61/38/857596138.db2.gz UTKLPUJFHFTFJS-BEFAXECRSA-N 0 3 405.325 4.120 20 0 HIADHN C[C@H](N[C@@H]1Cc2cccc(O)c2C1)C(=O)Nc1cccc(CSc2ccccn2)c1 ZINC000429314099 857599748 /nfs/dbraw/zinc/59/97/48/857599748.db2.gz YFXDREYDKJEEES-OXJNMPFZSA-N 0 3 419.550 4.164 20 0 HIADHN C[C@@H](N[C@H]1Cc2cccc(O)c2C1)C(=O)Nc1ccc(OCc2ccccc2)cc1 ZINC000429313487 857600034 /nfs/dbraw/zinc/60/00/34/857600034.db2.gz GOEGUXVQXWHDOK-UTKZUKDTSA-N 0 3 402.494 4.055 20 0 HIADHN Cc1cc(C)c(-c2csc(NC(=O)CN[C@@H]3Cc4cccc(O)c4C3)n2)cc1C ZINC000429319495 857602680 /nfs/dbraw/zinc/60/26/80/857602680.db2.gz UUNHLYBBAMLPQP-QGZVFWFLSA-N 0 3 407.539 4.136 20 0 HIADHN FC(F)(F)Cn1nnnc1CN[C@H]1CCCCC[C@@H]1c1ccccc1C(F)(F)F ZINC000429328465 857605170 /nfs/dbraw/zinc/60/51/70/857605170.db2.gz JCXCMYSOWJPRIP-HIFRSBDPSA-N 0 3 421.389 4.460 20 0 HIADHN OC[C@H](CN[C@H](c1ccccc1)c1ccccn1)Cc1ccc(Br)cc1 ZINC000429417531 857655291 /nfs/dbraw/zinc/65/52/91/857655291.db2.gz GVCNJTIYJXPYDS-PGRDOPGGSA-N 0 3 411.343 4.374 20 0 HIADHN Fc1ccc([C@H](NC[C@H]2CN(Cc3ccccc3)CCCO2)c2cccnc2)c(F)c1 ZINC000429452903 857677375 /nfs/dbraw/zinc/67/73/75/857677375.db2.gz ZIXICSCTZDLQNG-WIOPSUGQSA-N 0 3 423.507 4.330 20 0 HIADHN CC(C)(C)[C@H](CN1CCc2ccccc2C1)NC(=O)N1CCC(OCC2CC2)CC1 ZINC000429491043 857693639 /nfs/dbraw/zinc/69/36/39/857693639.db2.gz NVOVAEWVEFCRQI-QHCPKHFHSA-N 0 3 413.606 4.060 20 0 HIADHN Cc1cnn([C@H]2CCCN(C(=O)N[C@H](CN3CCc4ccccc4C3)C(C)(C)C)C2)c1 ZINC000429504864 857702309 /nfs/dbraw/zinc/70/23/09/857702309.db2.gz RNRGWDLZTUNKIR-XZOQPEGZSA-N 0 3 423.605 4.011 20 0 HIADHN O=C(Nc1ccnn1Cc1cccc(Cl)c1Cl)N1CCN(C2CCCC2)CC1 ZINC000429520682 857714999 /nfs/dbraw/zinc/71/49/99/857714999.db2.gz LVQMCKHIFYZXFU-UHFFFAOYSA-N 0 3 422.360 4.330 20 0 HIADHN Cc1noc(C[C@@H](NCC[S@](=O)c2cc(Cl)ccc2Cl)c2ccccc2)n1 ZINC000429547458 857738942 /nfs/dbraw/zinc/73/89/42/857738942.db2.gz JMKUXYQANLUJDD-CRYYWNKWSA-N 0 3 424.353 4.366 20 0 HIADHN C[C@@H]1CCc2c(sc3nc(CCN4CCC(c5ccncc5)CC4)nc(N)c23)C1 ZINC000429573225 857759646 /nfs/dbraw/zinc/75/96/46/857759646.db2.gz YGODNQAOSWEXGZ-OAHLLOKOSA-N 0 3 407.587 4.215 20 0 HIADHN Cc1nc(CC(C)C)c(NC(=O)NC[C@H]2CN(Cc3ccccc3)CCCO2)s1 ZINC000429601183 857784188 /nfs/dbraw/zinc/78/41/88/857784188.db2.gz KVTNTPHXOKZLBR-IBGZPJMESA-N 0 3 416.591 4.063 20 0 HIADHN Cc1ccc(NC(=O)NC[C@@H]2CN(Cc3ccccc3)CCCO2)cc1-c1ncco1 ZINC000429615460 857798529 /nfs/dbraw/zinc/79/85/29/857798529.db2.gz ZSPZEGQASAIBHF-OAQYLSRUSA-N 0 3 420.513 4.063 20 0 HIADHN CCOc1cc2c(cc1NC(=O)NC[C@H](c1ccsc1)N(CC)CC)OCCO2 ZINC000429634238 857810980 /nfs/dbraw/zinc/81/09/80/857810980.db2.gz IQIRKPRZEJKCNQ-QGZVFWFLSA-N 0 3 419.547 4.123 20 0 HIADHN CC[C@H](NC[C@H]1CN(Cc2ccccc2)CCCO1)c1nc(C(F)(F)F)cs1 ZINC000429683070 857833376 /nfs/dbraw/zinc/83/33/76/857833376.db2.gz PLOJAGZZYGGJAB-IRXDYDNUSA-N 0 3 413.509 4.494 20 0 HIADHN Cc1cc(NC(=O)NC[C@H]2CN(Cc3ccccc3)CCCO2)ccc1OC(C)C ZINC000429750769 857870139 /nfs/dbraw/zinc/87/01/39/857870139.db2.gz VTYDYNYSDHCOAM-QFIPXVFZSA-N 0 3 411.546 4.195 20 0 HIADHN COc1ccc(NC(=O)[C@H](N[C@H]2CCC[C@@H]2CCO)c2ccccc2)cc1Cl ZINC000429765584 857877543 /nfs/dbraw/zinc/87/75/43/857877543.db2.gz AZFUPIJECIZRQB-MFMILTCTSA-N 0 3 402.922 4.169 20 0 HIADHN CN(C[C@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)c1ccc(Cl)cc1Cl ZINC000429845364 857908244 /nfs/dbraw/zinc/90/82/44/857908244.db2.gz ZHKRCVJDQXQMSH-MRXNPFEDSA-N 0 3 413.370 4.136 20 0 HIADHN O=C(Nc1cccc(-c2ncc3n2CCCC3)c1)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000429965316 857974305 /nfs/dbraw/zinc/97/43/05/857974305.db2.gz SSEOZGSVJPPWSH-QFIPXVFZSA-N 0 3 415.541 4.282 20 0 HIADHN Cc1ccc(NC(=O)C[C@H](C)N[C@H](CO)c2ccc(Br)c(F)c2)c(C)c1 ZINC000430125247 858043177 /nfs/dbraw/zinc/04/31/77/858043177.db2.gz MGOCZPDZAAIGRQ-IFXJQAMLSA-N 0 3 423.326 4.245 20 0 HIADHN COCc1cccc(OCC2(CN3C[C@H](C)O[C@@]4(CCO[C@@H](C)C4)C3)CCC2)c1 ZINC000430257548 858098530 /nfs/dbraw/zinc/09/85/30/858098530.db2.gz MERHLKYOHHQYJF-MZLICYQSSA-N 0 3 403.563 4.041 20 0 HIADHN O[C@H](Cc1ccccc1C(F)(F)F)CN(CCc1ccccn1)Cc1cccnc1 ZINC000430311837 858118613 /nfs/dbraw/zinc/11/86/13/858118613.db2.gz LOJNHEBMZOAFQB-OAQYLSRUSA-N 0 3 415.459 4.144 20 0 HIADHN CCOc1ccc(C(=O)CCC(=O)N[C@H]2CCN(Cc3ccccc3)[C@H](C)C2)cc1 ZINC000430685259 858268310 /nfs/dbraw/zinc/26/83/10/858268310.db2.gz QGWBFPHOHVBEOX-KNQAVFIVSA-N 0 3 408.542 4.218 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)CCC(=O)c2ccc(F)cc2F)CCN1Cc1ccccc1 ZINC000430685689 858269342 /nfs/dbraw/zinc/26/93/42/858269342.db2.gz RZYORTWKPNMRSF-VQIMIIECSA-N 0 3 400.469 4.097 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3ccc(OC(C)(C)C)cc3)CC2)C[C@@H](C)O1 ZINC000430692917 858271691 /nfs/dbraw/zinc/27/16/91/858271691.db2.gz XHPFPVWLWAXYPF-RTBURBONSA-N 0 3 402.579 4.215 20 0 HIADHN C[C@H](N[C@@H](c1ccccc1)C1CCC1)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000430720339 858278183 /nfs/dbraw/zinc/27/81/83/858278183.db2.gz MOFOALHCTBJVFT-DJJJIMSYSA-N 0 3 423.376 4.289 20 0 HIADHN COc1ccccc1-n1nccc1CN1CCC[C@@H]1Cn1c(C)nc2ccccc21 ZINC000430750613 858288305 /nfs/dbraw/zinc/28/83/05/858288305.db2.gz OTCVCPPWDKZGQF-LJQANCHMSA-N 0 3 401.514 4.204 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)N2CCC[C@@H]2c2ccc(Br)c(F)c2)CN1C1CC1 ZINC000430855411 858335721 /nfs/dbraw/zinc/33/57/21/858335721.db2.gz STXWUGCGLNNAKX-UVBSCNOISA-N 0 3 410.331 4.060 20 0 HIADHN CCN(CC)[C@H](CN1C(=O)N[C@H](c2ccc(Cl)c(F)c2)C1=O)c1ccsc1 ZINC000430867538 858345620 /nfs/dbraw/zinc/34/56/20/858345620.db2.gz KVKAKQSOQMTONQ-IAGOWNOFSA-N 0 3 409.914 4.217 20 0 HIADHN CCN(CC)[C@@H](CN1C(=O)N[C@@H](c2ccc(Cl)c(F)c2)C1=O)c1ccsc1 ZINC000430867539 858346038 /nfs/dbraw/zinc/34/60/38/858346038.db2.gz KVKAKQSOQMTONQ-IRXDYDNUSA-N 0 3 409.914 4.217 20 0 HIADHN COc1cc(CN2CC[C@@H](C(=O)N(C)c3ccccc3)C2)ccc1OCC(F)(F)F ZINC000430877735 858351662 /nfs/dbraw/zinc/35/16/62/858351662.db2.gz JUOPVRSKJQUHPQ-QGZVFWFLSA-N 0 3 422.447 4.121 20 0 HIADHN COc1ccc([C@@H](CNC(=O)N[C@H]2C[C@H](c3ccc(F)cc3)C2)N2CCCC2)cc1 ZINC000430940170 858376318 /nfs/dbraw/zinc/37/63/18/858376318.db2.gz ODQAJDJMVCDWBH-KJXAQDMKSA-N 0 3 411.521 4.217 20 0 HIADHN Cc1ccc([C@H](CN2C(=O)CN(Cc3ccc(Cl)cc3)C2=O)N2CCCC2)cc1 ZINC000431085542 858440267 /nfs/dbraw/zinc/44/02/67/858440267.db2.gz OFXWSCULCAYOJN-NRFANRHFSA-N 0 3 411.933 4.250 20 0 HIADHN COC(=O)c1ccc(COc2ccccc2CN2CCC(c3cn[nH]c3)CC2)cc1 ZINC000437684017 863024382 /nfs/dbraw/zinc/02/43/82/863024382.db2.gz DTODZVIHRAVLLN-UHFFFAOYSA-N 0 3 405.498 4.155 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)NC[C@H]1CCC(F)(F)C1 ZINC000431116488 858453968 /nfs/dbraw/zinc/45/39/68/858453968.db2.gz WYJUXLJGAZPJDA-HNNXBMFYSA-N 0 3 407.427 4.214 20 0 HIADHN CN(C[C@H](O)COCC(F)(F)F)[C@H](c1ccc(F)cc1)c1ccc(Cl)cc1 ZINC000431125957 858457425 /nfs/dbraw/zinc/45/74/25/858457425.db2.gz DRSNCQVBKBXFJB-ROUUACIJSA-N 0 3 405.819 4.440 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3ccc4nc(C5CC5)oc4c3)CC2)C[C@H](C)O1 ZINC000431154412 858473677 /nfs/dbraw/zinc/47/36/77/858473677.db2.gz VNHWISATLAHCSW-IYBDPMFKSA-N 0 3 412.534 4.058 20 0 HIADHN CCc1ccc(Cl)c(CC)c1NC(=O)N1CCN(c2ccncc2OC)CC1 ZINC000431436390 858613893 /nfs/dbraw/zinc/61/38/93/858613893.db2.gz TZTLASJRNWPNNV-UHFFFAOYSA-N 0 3 402.926 4.223 20 0 HIADHN CN1CCN(CCCNC(=O)c2c(Cl)cc(F)cc2Cl)[C@H](c2ccccc2)C1 ZINC000431484204 858639099 /nfs/dbraw/zinc/63/90/99/858639099.db2.gz CPIYIKGOTNFYMN-IBGZPJMESA-N 0 3 424.347 4.241 20 0 HIADHN C[C@H](NC(=O)NC[C@H](c1ccccc1)N(C)C)c1noc(-c2ccc(Cl)cc2)n1 ZINC000431723017 858764390 /nfs/dbraw/zinc/76/43/90/858764390.db2.gz IQZRKWFTKODRAB-KBXCAEBGSA-N 0 3 413.909 4.053 20 0 HIADHN COc1cnccc1N1CCN(C(=O)Nc2cccc(COC3CCCCC3)c2)CC1 ZINC000431962363 858890081 /nfs/dbraw/zinc/89/00/81/858890081.db2.gz ZLBDPHPBNQMPHA-UHFFFAOYSA-N 0 3 424.545 4.294 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)N1CC[C@@H](c2ccc(F)cc2)C1 ZINC000432024076 858935460 /nfs/dbraw/zinc/93/54/60/858935460.db2.gz IYBNGOONGWSBGX-HXUWFJFHSA-N 0 3 413.562 4.438 20 0 HIADHN CN(C)C(=O)COc1ccccc1CN1CCC(F)(c2cccc(Cl)c2)CC1 ZINC000467549519 881371230 /nfs/dbraw/zinc/37/12/30/881371230.db2.gz AQONBNSWHJCLMH-UHFFFAOYSA-N 0 3 404.913 4.268 20 0 HIADHN Brc1cccc(C2CC([NH2+]Cc3nnc(COc4ccccc4)[n-]3)C2)c1 ZINC000432408132 859149957 /nfs/dbraw/zinc/14/99/57/859149957.db2.gz AEVYYIFXUHWUNB-UHFFFAOYSA-N 0 3 413.319 4.182 20 0 HIADHN Cc1ccc(S(=O)(=O)C[C@@H](C)NC2CC(c3cccc(Br)c3)C2)cc1 ZINC000432410746 859150945 /nfs/dbraw/zinc/15/09/45/859150945.db2.gz RFSMMIWNGIRFLA-LSJNQWAISA-N 0 3 422.388 4.456 20 0 HIADHN Cc1nn(C(C)(C)C)cc1[C@H](C)NC(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000467565348 881388257 /nfs/dbraw/zinc/38/82/57/881388257.db2.gz UMUNLAPOGDJEAU-MAUKXSAKSA-N 0 3 403.596 4.205 20 0 HIADHN O=C(Nc1ccc(Cc2nc3ccccc3s2)cc1)[C@@H]1CCCN1C1CCOCC1 ZINC000432593977 859245757 /nfs/dbraw/zinc/24/57/57/859245757.db2.gz RHVNFRJKVSTXDR-NRFANRHFSA-N 0 3 421.566 4.469 20 0 HIADHN O=C(CO[C@@H]1CCCc2ccccc21)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000432719311 859317557 /nfs/dbraw/zinc/31/75/57/859317557.db2.gz NERVJNKFUHKMGA-AFMYVXGZSA-N 0 3 410.480 4.002 20 0 HIADHN O[C@H](COCC(F)(F)F)CN(Cc1ccccc1Br)C1CCCC1 ZINC000432773428 859353299 /nfs/dbraw/zinc/35/32/99/859353299.db2.gz GDBFECSYFMFUND-HNNXBMFYSA-N 0 3 410.274 4.134 20 0 HIADHN CN(CCCNC(=O)C1CCC1)Cc1cnc(-c2ccc(Br)cc2)s1 ZINC000432811241 859369858 /nfs/dbraw/zinc/36/98/58/859369858.db2.gz CSBIPRHGEZKTRD-UHFFFAOYSA-N 0 3 422.392 4.311 20 0 HIADHN OC1CCN(Cc2ccccc2CNc2nc3cc(Cl)cc(Cl)c3o2)CC1 ZINC000432826042 859376599 /nfs/dbraw/zinc/37/65/99/859376599.db2.gz XUYODOXWLTZQRI-UHFFFAOYSA-N 0 3 406.313 4.703 20 0 HIADHN CC[C@@H](C(=O)Nc1cccc(Oc2ncc(Br)cn2)c1)N(CC)CC ZINC000432870691 859399834 /nfs/dbraw/zinc/39/98/34/859399834.db2.gz DGNRKOGJNXWVIH-INIZCTEOSA-N 0 3 407.312 4.090 20 0 HIADHN CN(CCSCC(=O)Nc1cc2c(cc1Cl)OCCCO2)Cc1ccccc1 ZINC000433048279 859500778 /nfs/dbraw/zinc/50/07/78/859500778.db2.gz WBTKNBDODNIXGC-UHFFFAOYSA-N 0 3 420.962 4.305 20 0 HIADHN O=C(CN1CCC[C@@H](c2ccccc2)C1)N1CCC[C@@H]1c1ccc2c(c1)OCCO2 ZINC000433067558 859507175 /nfs/dbraw/zinc/50/71/75/859507175.db2.gz LEQDTJZJGGXTFJ-FGZHOGPDSA-N 0 3 406.526 4.001 20 0 HIADHN COc1ccc(C[C@@H](NCc2ccc(NC(C)=O)nc2)c2ccc(OC)cc2)cc1 ZINC000433077417 859512418 /nfs/dbraw/zinc/51/24/18/859512418.db2.gz RIPNPHWHTUXXMU-HSZRJFAPSA-N 0 3 405.498 4.131 20 0 HIADHN Cc1cc(C)c(CC(C(=O)Nc2n[nH]c(-c3ccncc3)n2)C(F)(F)F)c(C)c1 ZINC000433089395 859518128 /nfs/dbraw/zinc/51/81/28/859518128.db2.gz ONAWNKLPQHYHJS-MRXNPFEDSA-N 0 3 403.408 4.152 20 0 HIADHN CCOc1ccccc1OCCN1CCC(c2nc(-c3ccccc3OC)no2)CC1 ZINC000433158293 859545882 /nfs/dbraw/zinc/54/58/82/859545882.db2.gz JHOLABJLAHSGDY-UHFFFAOYSA-N 0 3 423.513 4.402 20 0 HIADHN COC[C@H](NCc1ccc(OCc2ccc(Cl)cc2)c(OC)c1)[C@H]1CCCO1 ZINC000433208400 859567161 /nfs/dbraw/zinc/56/71/61/859567161.db2.gz NSRPGMBNQCPCJI-VQTJNVASSA-N 0 3 405.922 4.211 20 0 HIADHN CCc1ccc([C@@H](CN2CCOCC2)NCc2cccc(-c3cccnc3)c2)cc1 ZINC000467641894 881437479 /nfs/dbraw/zinc/43/74/79/881437479.db2.gz UGRKLMQUVKGPOW-AREMUKBSSA-N 0 3 401.554 4.474 20 0 HIADHN FC(F)(F)c1ccccc1[C@H]1CCCCC[C@@H]1NCc1nnnn1C1CCOCC1 ZINC000433241946 859586526 /nfs/dbraw/zinc/58/65/26/859586526.db2.gz FMQIYMJDGBPHKR-MJGOQNOKSA-N 0 3 423.483 4.250 20 0 HIADHN FC(F)(F)c1cnc(CNCCCN2CCN(c3cccc(Cl)c3)CC2)s1 ZINC000433331642 859647948 /nfs/dbraw/zinc/64/79/48/859647948.db2.gz NXBJAWZRTMZXQR-UHFFFAOYSA-N 0 3 418.916 4.117 20 0 HIADHN CCNC(=O)c1ccc(CN[C@H](C)c2ccc(OC[C@@H]3CCCCO3)c(F)c2)cc1 ZINC000433371422 859662013 /nfs/dbraw/zinc/66/20/13/859662013.db2.gz AZWJSGITAVAZHP-UTKZUKDTSA-N 0 3 414.521 4.374 20 0 HIADHN Cc1cccc(C(=O)NCCN[C@@H](C)c2ccc(OC[C@H]3CCCCO3)c(F)c2)c1 ZINC000433391495 859672131 /nfs/dbraw/zinc/67/21/31/859672131.db2.gz RWNBMDIJWIJZOU-GHTZIAJQSA-N 0 3 414.521 4.163 20 0 HIADHN C[C@H]1COCC[C@@H]1NC(=O)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000433453101 859709299 /nfs/dbraw/zinc/70/92/99/859709299.db2.gz YCARSFPTJMAVCG-KXBFYZLASA-N 0 3 414.377 4.026 20 0 HIADHN O=C(NCc1ccccc1)[C@H](N[C@@H]1CCOC2(CCSCC2)C1)c1ccccc1 ZINC000433460961 859713698 /nfs/dbraw/zinc/71/36/98/859713698.db2.gz COBRVEMJDFETBF-FGZHOGPDSA-N 0 3 410.583 4.079 20 0 HIADHN CCN(C(=O)NCCC1CC(OC(C)(C)C)C1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000433485614 859726831 /nfs/dbraw/zinc/72/68/31/859726831.db2.gz HVUAKIOTGQLSFD-ORFBVSJDSA-N 0 3 401.595 4.276 20 0 HIADHN CCOc1ccc2c(c1)CCN(C(=O)Nc1ccc(N3CCN(CC)CC3)cc1C)C2 ZINC000433632459 859818376 /nfs/dbraw/zinc/81/83/76/859818376.db2.gz BNGRVPNGMGOGTG-UHFFFAOYSA-N 0 3 422.573 4.126 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3ccc(Cl)c(OC)c3)c(C)c2)CC1 ZINC000433654410 859825767 /nfs/dbraw/zinc/82/57/67/859825767.db2.gz BNBHBYCZWUBLPT-UHFFFAOYSA-N 0 3 402.926 4.443 20 0 HIADHN O=C(Nc1ccc(Oc2ncc(Cl)cn2)c(Cl)c1)N1CC[C@@H](N2CC=CC2)C1 ZINC000433686487 859837951 /nfs/dbraw/zinc/83/79/51/859837951.db2.gz UAWINQBLASMPKK-OAHLLOKOSA-N 0 3 420.300 4.054 20 0 HIADHN Cn1cc(-c2cc(F)ccc2NC(=O)NC[C@H](c2ccccc2)N2CCCC2)cn1 ZINC000433799146 859897546 /nfs/dbraw/zinc/89/75/46/859897546.db2.gz ONRMIDJCRSIEOH-JOCHJYFZSA-N 0 3 407.493 4.185 20 0 HIADHN CN(C)Cc1ccc(S(=O)(=O)N(Cc2cccc(-c3cccnc3)c2)C2CC2)cc1 ZINC000433868187 859943142 /nfs/dbraw/zinc/94/31/42/859943142.db2.gz MBIIOPJRDCVJPZ-UHFFFAOYSA-N 0 3 421.566 4.164 20 0 HIADHN O=C(Cc1cc(F)ccc1Br)NC[C@@H](c1cccs1)N1CCCC1 ZINC000433867502 859943396 /nfs/dbraw/zinc/94/33/96/859943396.db2.gz IMDAMUROOZZZFN-INIZCTEOSA-N 0 3 411.340 4.146 20 0 HIADHN CC(C)C(=O)Nc1ccc(Cl)c(C(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)c1 ZINC000467689631 881481605 /nfs/dbraw/zinc/48/16/05/881481605.db2.gz WLBJTVSZKYZERL-QFBILLFUSA-N 0 3 413.949 4.327 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)c2ccccc2NCc2cccnc2)CN1Cc1ccccc1 ZINC000467688690 881481757 /nfs/dbraw/zinc/48/17/57/881481757.db2.gz MUFNQCPVOGWFKI-DENIHFKCSA-N 0 3 400.526 4.087 20 0 HIADHN Cc1c(NC(=O)NC[C@@H](c2cccs2)N2CCCC2)noc1-c1ccccc1F ZINC000433906705 859962355 /nfs/dbraw/zinc/96/23/55/859962355.db2.gz GMPFGIQZUYNSKR-KRWDZBQOSA-N 0 3 414.506 4.809 20 0 HIADHN Cc1c(NC(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)noc1-c1ccccc1F ZINC000433921963 859973706 /nfs/dbraw/zinc/97/37/06/859973706.db2.gz KNKMHTXVAWOXBR-AEFFLSMTSA-N 0 3 408.477 4.746 20 0 HIADHN Cc1nc(COc2ccccc2C(=O)N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)cs1 ZINC000467692969 881486317 /nfs/dbraw/zinc/48/63/17/881486317.db2.gz WABIGGWSGUMYNZ-PXNSSMCTSA-N 0 3 421.566 4.423 20 0 HIADHN O=C(NC[C@@H]1CCCCN1C1CC1)N1CCC[C@H](c2nc(C(F)(F)F)cs2)C1 ZINC000433955527 860000371 /nfs/dbraw/zinc/00/03/71/860000371.db2.gz ONQKQZDLIUHYKP-ZFWWWQNUSA-N 0 3 416.513 4.068 20 0 HIADHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(-c2noc(-c3ccc(F)cc3)n2)cc1 ZINC000434022761 860046662 /nfs/dbraw/zinc/04/66/62/860046662.db2.gz BMQJZTWSNQXWSF-RTWAWAEBSA-N 0 3 420.488 4.242 20 0 HIADHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc(NC(=O)CC(C)(C)C)ccc1Cl ZINC000434064262 860074292 /nfs/dbraw/zinc/07/42/92/860074292.db2.gz VZTWQCAJLPODMY-SJORKVTESA-N 0 3 405.970 4.414 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)N(CCCO)Cc1cccc(Cl)c1 ZINC000434078986 860087571 /nfs/dbraw/zinc/08/75/71/860087571.db2.gz MYXUYCHAWOGXPY-QFIPXVFZSA-N 0 3 415.965 4.071 20 0 HIADHN C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1 ZINC000467713346 881512035 /nfs/dbraw/zinc/51/20/35/881512035.db2.gz LUVSNIBUTYKLCN-FZKQIMNGSA-N 0 3 405.420 4.105 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)Cc1ccccc1Cl ZINC000434307726 860269559 /nfs/dbraw/zinc/26/95/59/860269559.db2.gz ANBIHBSAKYLNBF-FQEVSTJZSA-N 0 3 408.933 4.473 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)Cc1ccc2c(c1)CCC2 ZINC000434313203 860274479 /nfs/dbraw/zinc/27/44/79/860274479.db2.gz ULEUBKYOSBIMAY-DEOSSOPVSA-N 0 3 414.553 4.308 20 0 HIADHN CC[C@H](OC1CCCC1)C(=O)Nc1c(C)cnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000434314903 860275330 /nfs/dbraw/zinc/27/53/30/860275330.db2.gz HSPLDQGZDHLGHT-IRLDBZIGSA-N 0 3 410.562 4.315 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)CSCCC(C)C ZINC000434319907 860279931 /nfs/dbraw/zinc/27/99/31/860279931.db2.gz WZJJWZJBALLWBN-FQEVSTJZSA-N 0 3 400.592 4.356 20 0 HIADHN CCc1nc(C)c(C(=O)Nc2c(C)cnn2[C@H]2CCN(Cc3ccccc3)C2)s1 ZINC000434320281 860281410 /nfs/dbraw/zinc/28/14/10/860281410.db2.gz AUHGNILBWLHFHT-SFHVURJKSA-N 0 3 409.559 4.218 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1csc(C(C)C)n1 ZINC000434321287 860282448 /nfs/dbraw/zinc/28/24/48/860282448.db2.gz LUSRSEKBFMRKNK-GOSISDBHSA-N 0 3 409.559 4.471 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)[C@H](C)Oc1ccc(F)cc1 ZINC000434323434 860285013 /nfs/dbraw/zinc/28/50/13/860285013.db2.gz JBZSWNKGVZCOKV-RXVVDRJESA-N 0 3 422.504 4.184 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)[C@@H]1CSc2ccccc21 ZINC000434324770 860286699 /nfs/dbraw/zinc/28/66/99/860286699.db2.gz FRGCEAATUMESKW-PZJWPPBQSA-N 0 3 418.566 4.467 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)[C@@H]1Cc2ccccc2S1 ZINC000434327729 860288990 /nfs/dbraw/zinc/28/89/90/860288990.db2.gz RRIGRAFIHNIXQF-IRLDBZIGSA-N 0 3 418.566 4.294 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)COc1ccc(Cl)cc1 ZINC000434331750 860293993 /nfs/dbraw/zinc/29/39/93/860293993.db2.gz DGGKAUBYFACMFG-HXUWFJFHSA-N 0 3 424.932 4.309 20 0 HIADHN CCCc1ncc(C(=O)Nc2c(C)cnn2[C@@H]2CCN(Cc3ccccc3)C2)s1 ZINC000434334395 860296701 /nfs/dbraw/zinc/29/67/01/860296701.db2.gz QMGIJIUMHSXEGL-GOSISDBHSA-N 0 3 409.559 4.300 20 0 HIADHN O=C(NCc1cccc(NC(=O)Nc2ccccc2)c1)NC[C@H]1CCCCN1C1CC1 ZINC000434348047 860304594 /nfs/dbraw/zinc/30/45/94/860304594.db2.gz AAFXDUPECPRXHA-JOCHJYFZSA-N 0 3 421.545 4.147 20 0 HIADHN COc1ccccc1CN(Cc1cccs1)C(=O)NC[C@@H]1CCCCN1C1CC1 ZINC000434349982 860305423 /nfs/dbraw/zinc/30/54/23/860305423.db2.gz NTFUILCPOWRLRX-FQEVSTJZSA-N 0 3 413.587 4.485 20 0 HIADHN CCOc1ccc(Oc2cc(CNC(=O)NC[C@@H]3CCCCN3C3CC3)ccn2)cc1 ZINC000434352853 860306548 /nfs/dbraw/zinc/30/65/48/860306548.db2.gz QFCVGZQYVHBGBK-FQEVSTJZSA-N 0 3 424.545 4.089 20 0 HIADHN O=C(NC[C@H]1CCCCN1C1CC1)N(Cc1csc(Br)c1)C1CC1 ZINC000434355271 860307625 /nfs/dbraw/zinc/30/76/25/860307625.db2.gz MFYHIMFWSOODCD-MRXNPFEDSA-N 0 3 412.397 4.202 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)c1ccccc1NCc1cccnc1 ZINC000434395923 860332878 /nfs/dbraw/zinc/33/28/78/860332878.db2.gz PAQHGQQHCFQRNW-QFIPXVFZSA-N 0 3 400.526 4.088 20 0 HIADHN Cc1nc(CSc2ccc(C(=O)NC[C@@H]3CCCCN3C3CC3)cc2)cs1 ZINC000434427013 860345252 /nfs/dbraw/zinc/34/52/52/860345252.db2.gz XQUSQHUSPAZYSG-IBGZPJMESA-N 0 3 401.601 4.491 20 0 HIADHN Cc1nc2cc(C(=O)NC[C@H]3CCCCN3C3CC3)ccc2n1Cc1ccsc1 ZINC000434443470 860355101 /nfs/dbraw/zinc/35/51/01/860355101.db2.gz ZCXIPWYZZNLHSK-HXUWFJFHSA-N 0 3 408.571 4.201 20 0 HIADHN C[C@H]1CN(CCOC2CCN(CCc3cccc(Cl)c3Cl)CC2)C[C@H](C)O1 ZINC000434477459 860366436 /nfs/dbraw/zinc/36/64/36/860366436.db2.gz BLPFCNYCXBZQNE-IRXDYDNUSA-N 0 3 415.405 4.126 20 0 HIADHN COc1ccc(CN2CC[C@@H](n3c(C)nc4c3CCCC4)C2)cc1Br ZINC000434495417 860372677 /nfs/dbraw/zinc/37/26/77/860372677.db2.gz VQDOFBYOJBSJJJ-MRXNPFEDSA-N 0 3 404.352 4.288 20 0 HIADHN CCOC(=O)CC1(NCC(=O)Nc2c(Cl)cccc2C(F)(F)F)CCCC1 ZINC000434612266 860428726 /nfs/dbraw/zinc/42/87/26/860428726.db2.gz PZXYYVLRWIEOAI-UHFFFAOYSA-N 0 3 406.832 4.153 20 0 HIADHN Fc1ccc(-n2nc(CN3CCC(c4ncc5n4CCCC5)CC3)c3c2CCC3)cc1 ZINC000434682557 860458498 /nfs/dbraw/zinc/45/84/98/860458498.db2.gz WKWQZIFZXCYMBV-UHFFFAOYSA-N 0 3 419.548 4.413 20 0 HIADHN CCc1ccc([C@@H](C)NC(=O)[C@H](C)N2CCC(c3ncc4n3CCCC4)CC2)cc1 ZINC000434685283 860459717 /nfs/dbraw/zinc/45/97/17/860459717.db2.gz NILGVDYQSUKOIH-MOPGFXCFSA-N 0 3 408.590 4.227 20 0 HIADHN C[C@H](NC(=O)CN1CCC(c2ncc3n2CCCC3)CC1)c1ccc2ccccc2c1 ZINC000434688674 860461923 /nfs/dbraw/zinc/46/19/23/860461923.db2.gz ORCVBJJEWUTTLW-IBGZPJMESA-N 0 3 416.569 4.429 20 0 HIADHN CCCN(Cc1ccc(C)cc1)C(=O)CN1CCC(c2ncc3n2CCCC3)CC1 ZINC000434736613 860476706 /nfs/dbraw/zinc/47/67/06/860476706.db2.gz MHBOSOLVMYRPPO-UHFFFAOYSA-N 0 3 408.590 4.146 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)CCCCc2nc3ccccc3s2)C[C@@H](C)O1 ZINC000434764873 860487204 /nfs/dbraw/zinc/48/72/04/860487204.db2.gz PJZJTCWEXMZDFG-QZTJIDSGSA-N 0 3 403.592 4.015 20 0 HIADHN C[C@H](CC(=O)NCCCCN1C[C@@H](C)O[C@H](C)C1)c1cccc(C(F)(F)F)c1 ZINC000434779346 860492535 /nfs/dbraw/zinc/49/25/35/860492535.db2.gz USGSIWHJKGWIQF-BRWVUGGUSA-N 0 3 400.485 4.205 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)c2ccccc2OCc2ccc(F)cc2)C[C@@H](C)O1 ZINC000434789060 860494477 /nfs/dbraw/zinc/49/44/77/860494477.db2.gz LTBMUULVLPVCCD-RTBURBONSA-N 0 3 414.521 4.024 20 0 HIADHN CCN(C(=O)NC[C@H]1CCCN(c2ccccc2)C1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000434868548 860528960 /nfs/dbraw/zinc/52/89/60/860528960.db2.gz LWHWUSRXOOWDSA-ILBGXUMGSA-N 0 3 420.601 4.209 20 0 HIADHN CCN1CCN(Cc2ccccc2CN[C@H](C)c2nc(C(F)(F)F)cs2)CC1 ZINC000467748310 881551929 /nfs/dbraw/zinc/55/19/29/881551929.db2.gz XXQDCUQTHTYVSI-OAHLLOKOSA-N 0 3 412.525 4.150 20 0 HIADHN COc1ccc([C@H](CNC(=O)CCc2ccc(Cl)c(OC)c2)N2CCCC2)cc1 ZINC000435047335 860614019 /nfs/dbraw/zinc/61/40/19/860614019.db2.gz FYOXLAQZONDAMH-NRFANRHFSA-N 0 3 416.949 4.243 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(CN3CCC(n4ccc(C)n4)CC3)c2)cc1 ZINC000435061543 860622441 /nfs/dbraw/zinc/62/24/41/860622441.db2.gz QEFQOJVBGFCJME-UHFFFAOYSA-N 0 3 404.514 4.290 20 0 HIADHN CC(C)c1nn(C)cc1NC(=O)N(CCN(C)C)Cc1ccc(C(F)(F)F)cc1 ZINC000435174184 860677984 /nfs/dbraw/zinc/67/79/84/860677984.db2.gz SDVKSLGOFLLJMI-UHFFFAOYSA-N 0 3 411.472 4.158 20 0 HIADHN Cc1cc(NC(=O)[C@H](C)OCc2ccccc2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435273239 860711658 /nfs/dbraw/zinc/71/16/58/860711658.db2.gz XUDYOCOTJKEASB-REWPJTCUSA-N 0 3 418.541 4.182 20 0 HIADHN Cc1cc(NC(=O)c2cnn(C(C)(C)C)c2C)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435273251 860711791 /nfs/dbraw/zinc/71/17/91/860711791.db2.gz XXPKFASIONOEAB-FQEVSTJZSA-N 0 3 420.561 4.151 20 0 HIADHN CO[C@](C)(C(=O)Nc1cc(C)nn1[C@H]1CCN(Cc2ccccc2)C1)c1ccccc1 ZINC000435277364 860714112 /nfs/dbraw/zinc/71/41/12/860714112.db2.gz BPLSAOJSKQPYBR-DHLKQENFSA-N 0 3 418.541 4.139 20 0 HIADHN Cc1cc(NC(=O)Cc2ccc(F)c(F)c2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435279842 860715058 /nfs/dbraw/zinc/71/50/58/860715058.db2.gz QKBVELDAUNOEBO-IBGZPJMESA-N 0 3 410.468 4.098 20 0 HIADHN COc1cccc([C@H](C)C(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000435282055 860716979 /nfs/dbraw/zinc/71/69/79/860716979.db2.gz YISYKEIDENKGRJ-SIKLNZKXSA-N 0 3 418.541 4.389 20 0 HIADHN Cc1cc(NC(=O)CCCc2csc(C)n2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435285854 860718661 /nfs/dbraw/zinc/71/86/61/860718661.db2.gz ASCXRMLCOBZDLP-OAQYLSRUSA-N 0 3 423.586 4.365 20 0 HIADHN Cc1cc(NC(=O)C[C@H](C)c2cccnc2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435285132 860719152 /nfs/dbraw/zinc/71/91/52/860719152.db2.gz NWCYIHHRJQEYAJ-PGRDOPGGSA-N 0 3 403.530 4.166 20 0 HIADHN CCC(CC)n1ccc(C(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435288755 860721147 /nfs/dbraw/zinc/72/11/47/860721147.db2.gz KXQWIWGCAKISGA-NRFANRHFSA-N 0 3 420.561 4.448 20 0 HIADHN Cc1cc(NC(=O)c2cnc(C)nc2C(C)C)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435291352 860721928 /nfs/dbraw/zinc/72/19/28/860721928.db2.gz OAFPMNZXAQSUGQ-FQEVSTJZSA-N 0 3 418.545 4.113 20 0 HIADHN Cc1cc(NC(=O)[C@H](C)Oc2cccc(F)c2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435292785 860723056 /nfs/dbraw/zinc/72/30/56/860723056.db2.gz ZXBYQINKFWWBSA-RXVVDRJESA-N 0 3 422.504 4.184 20 0 HIADHN CC(C)c1noc(-c2ccccc2C(=O)N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)n1 ZINC000467757138 881573808 /nfs/dbraw/zinc/57/38/08/881573808.db2.gz XAUYHMLMPHNUOJ-MJGOQNOKSA-N 0 3 404.514 4.253 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(-n2cccc2)cc1 ZINC000435368561 860765853 /nfs/dbraw/zinc/76/58/53/860765853.db2.gz BGIQFPIGNZGGPA-HSZRJFAPSA-N 0 3 411.509 4.373 20 0 HIADHN O=C(Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)c1ccc(-c2cnco2)cc1 ZINC000435371111 860769332 /nfs/dbraw/zinc/76/93/32/860769332.db2.gz SRLFTRBBYLEBMU-NRFANRHFSA-N 0 3 413.481 4.237 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)[C@H]1C[C@H]1c1c(F)cccc1F ZINC000435372513 860770272 /nfs/dbraw/zinc/77/02/72/860770272.db2.gz JVEXNPUHAMQDKV-QRVBRYPASA-N 0 3 422.479 4.351 20 0 HIADHN O=C(CCOc1ccccc1Cl)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435372389 860770845 /nfs/dbraw/zinc/77/08/45/860770845.db2.gz ANIXFVOZKWDCLQ-IBGZPJMESA-N 0 3 424.932 4.391 20 0 HIADHN C[C@H](CCOc1ccccc1)C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435374244 860772905 /nfs/dbraw/zinc/77/29/05/860772905.db2.gz PMROWZPYDRRUCK-IFMALSPDSA-N 0 3 418.541 4.374 20 0 HIADHN Cc1cccc(O[C@H](C)C(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000435375827 860774006 /nfs/dbraw/zinc/77/40/06/860774006.db2.gz WYTKHHJCBSBXQW-TZIWHRDSSA-N 0 3 404.514 4.045 20 0 HIADHN CC(C)COc1ncccc1C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435377519 860774776 /nfs/dbraw/zinc/77/47/76/860774776.db2.gz CMAVSZAJNLXJBZ-HXUWFJFHSA-N 0 3 419.529 4.012 20 0 HIADHN O=C(CCc1nc2ccccc2o1)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435380446 860776890 /nfs/dbraw/zinc/77/68/90/860776890.db2.gz RKNKMPZVCIZFDZ-LJQANCHMSA-N 0 3 415.497 4.043 20 0 HIADHN C[C@@H]1CC[C@H](C)N1[C@H]1CCCN(S(=O)(=O)c2c(Cl)cc(F)cc2Cl)C1 ZINC000435423283 860795575 /nfs/dbraw/zinc/79/55/75/860795575.db2.gz SJBMWTKMQXQIDL-SCRDCRAPSA-N 0 3 409.354 4.158 20 0 HIADHN Cc1cc(NC(=O)N(C)CCc2cccs2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435513170 860831565 /nfs/dbraw/zinc/83/15/65/860831565.db2.gz ILTIGIVXJJPSMH-HXUWFJFHSA-N 0 3 423.586 4.406 20 0 HIADHN Cc1cc(NC(=O)N(C)[C@@H](C)c2ccccn2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435515076 860833189 /nfs/dbraw/zinc/83/31/89/860833189.db2.gz FJORGLGIDORAFQ-PZJWPPBQSA-N 0 3 418.545 4.258 20 0 HIADHN Cc1cc([C@@H](C)NC(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)ccc1F ZINC000435517915 860834948 /nfs/dbraw/zinc/83/49/48/860834948.db2.gz RUITYYNTIOBZRJ-CEXWTWQISA-N 0 3 405.558 4.116 20 0 HIADHN Cc1cc(NC(=O)NC[C@]2(C)CCCS2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435528838 860844956 /nfs/dbraw/zinc/84/49/56/860844956.db2.gz WKNRWGRTKSYVGM-UGKGYDQZSA-N 0 3 413.591 4.046 20 0 HIADHN Cc1cc(NC(=O)NC2(c3ccccc3)CC2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435534756 860849501 /nfs/dbraw/zinc/84/95/01/860849501.db2.gz AIRPICOQLVESPA-JOCHJYFZSA-N 0 3 415.541 4.449 20 0 HIADHN Cc1cc(NC(=O)NC2(c3ccccc3)CC2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435534757 860849864 /nfs/dbraw/zinc/84/98/64/860849864.db2.gz AIRPICOQLVESPA-QFIPXVFZSA-N 0 3 415.541 4.449 20 0 HIADHN CC[C@H](NC(=O)Nc1cc(C)nn1[C@@H]1CCN(Cc2ccccc2)C1)c1ccncc1 ZINC000435536876 860851030 /nfs/dbraw/zinc/85/10/30/860851030.db2.gz MOZLZOLYZTXKMC-YADHBBJMSA-N 0 3 418.545 4.306 20 0 HIADHN Cc1cnn(-c2ccc(C)cc2NC(=O)N(CCN(C)C)Cc2cccc(F)c2)c1 ZINC000435559630 860879874 /nfs/dbraw/zinc/87/98/74/860879874.db2.gz QFSYKCZZPJTHOP-UHFFFAOYSA-N 0 3 409.509 4.224 20 0 HIADHN Cc1cc(C(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)c(C)n1C1CC1 ZINC000435645045 860932482 /nfs/dbraw/zinc/93/24/82/860932482.db2.gz KWSNHMJYJZBRMM-OAQYLSRUSA-N 0 3 403.530 4.336 20 0 HIADHN CCCN1CCN(c2ccccc2CNc2cc(NC(=O)N(C)C)ccc2C)CC1 ZINC000435731342 861013782 /nfs/dbraw/zinc/01/37/82/861013782.db2.gz JNVRMLFHYMLCIY-UHFFFAOYSA-N 0 3 409.578 4.233 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)NC[C@H]3CCC[N@@H+]3C3CCCCC3)cc2)cc(=O)[n-]1 ZINC000435730501 861013880 /nfs/dbraw/zinc/01/38/80/861013880.db2.gz HKQGKGFYFFKEAI-HXUWFJFHSA-N 0 3 409.534 4.076 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)NC[C@H]3CCC[N@H+]3C3CCCCC3)cc2)cc(=O)[n-]1 ZINC000435730501 861013893 /nfs/dbraw/zinc/01/38/93/861013893.db2.gz HKQGKGFYFFKEAI-HXUWFJFHSA-N 0 3 409.534 4.076 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)C1(OCc2ccccc2)CCOCC1)c1ccsc1 ZINC000435809733 861075107 /nfs/dbraw/zinc/07/51/07/861075107.db2.gz QMILLDWGPODAKZ-NRFANRHFSA-N 0 3 416.587 4.013 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)[C@H](CC)Nc3ccccc3)c(OCC)c2)CC1 ZINC000435834347 861096459 /nfs/dbraw/zinc/09/64/59/861096459.db2.gz IHJGWZRXEQIGMP-QFIPXVFZSA-N 0 3 424.589 4.447 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(Br)cc1)C(=O)N[C@@H]1CCOc2ccccc21 ZINC000435881004 861139568 /nfs/dbraw/zinc/13/95/68/861139568.db2.gz MYTXNSTWHUBTOF-SUNYJGFJSA-N 0 3 403.320 4.128 20 0 HIADHN CN(C)Cc1cccc(NC(=O)N(C)[C@@H]2c3cc(Cl)cc(Cl)c3C[C@H]2O)c1 ZINC000435919484 861178886 /nfs/dbraw/zinc/17/88/86/861178886.db2.gz YGFBHOQEEDISHU-RTBURBONSA-N 0 3 408.329 4.177 20 0 HIADHN C[C@@H]1CCN(C(=O)Nc2cccc(C(=O)NC(C)(C)C)c2)CCN1Cc1ccccc1 ZINC000437769215 863088637 /nfs/dbraw/zinc/08/86/37/863088637.db2.gz CUWVRIHWZQPVHK-LJQANCHMSA-N 0 3 422.573 4.343 20 0 HIADHN Cc1cc(C)n(-c2ccc(NC(=O)N3CC[C@H](C)N(Cc4ccccc4)CC3)cn2)n1 ZINC000437780174 863098084 /nfs/dbraw/zinc/09/80/84/863098084.db2.gz VTJUXWAQTCGZMZ-IBGZPJMESA-N 0 3 418.545 4.012 20 0 HIADHN Cc1c(NC(=O)N(CCN(C)C)Cc2ccccc2)cnn1-c1cc(C)ccc1C ZINC000437796866 863116400 /nfs/dbraw/zinc/11/64/00/863116400.db2.gz FAITUBGDHNFFBG-UHFFFAOYSA-N 0 3 405.546 4.393 20 0 HIADHN Cc1cc(-c2cc(C(=O)N[C@H]3CN(C4CC4)C[C@H]3C)c3cnn(C(C)C)c3n2)c(C)o1 ZINC000467804569 881628883 /nfs/dbraw/zinc/62/88/83/881628883.db2.gz XYLTWIYVDSAJDA-PEBXRYMYSA-N 0 3 421.545 4.102 20 0 HIADHN Cc1cc(-c2cc(C(=O)N[C@H]3CN(C4CC4)C[C@H]3C)c3c(C)noc3n2)c(C)s1 ZINC000467806598 881631035 /nfs/dbraw/zinc/63/10/35/881631035.db2.gz SGEUXQUBCWEBTE-WYRIXSBYSA-N 0 3 410.543 4.089 20 0 HIADHN C[C@H]1CN(C2CC2)C[C@H]1NC(=O)c1ccccc1CSc1nc2ccccc2o1 ZINC000467805363 881631214 /nfs/dbraw/zinc/63/12/14/881631214.db2.gz CLJHKMFBGGCBMW-MGPUTAFESA-N 0 3 407.539 4.333 20 0 HIADHN CC(C)(C)c1cc(NC(=O)N2CC[C@H](N3CC=CC3)C2)n(-c2cccc(Cl)c2)n1 ZINC000437870416 863230522 /nfs/dbraw/zinc/23/05/22/863230522.db2.gz UPGAEEAIURUBQE-SFHVURJKSA-N 0 3 413.953 4.301 20 0 HIADHN CCN(Cc1ccccc1NC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1)C(C)=O ZINC000437920425 863296959 /nfs/dbraw/zinc/29/69/59/863296959.db2.gz YRDVYMSJHDGRMO-FQEVSTJZSA-N 0 3 422.573 4.183 20 0 HIADHN C[C@@H]1CCC[C@@H](OCc2cccc(NC(=O)N(CCN(C)C)C[C@@H]3CCCO3)c2)C1 ZINC000438074768 863461091 /nfs/dbraw/zinc/46/10/91/863461091.db2.gz DUEMBPUUVZWLFH-PTUXOGIPSA-N 0 3 417.594 4.356 20 0 HIADHN C[C@@H](NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)nc1)c1cccc(Br)c1 ZINC000467837987 881672927 /nfs/dbraw/zinc/67/29/27/881672927.db2.gz DBSZYDKWXAZRLV-BZUAXINKSA-N 0 3 404.352 4.309 20 0 HIADHN CCOC(=O)Cn1nc(C)c(CN2CCC[C@@H](COc3ccccc3Cl)C2)c1C ZINC000438120603 863538923 /nfs/dbraw/zinc/53/89/23/863538923.db2.gz RUJUKAXDDUGKKE-GOSISDBHSA-N 0 3 419.953 4.007 20 0 HIADHN CN(C)CCN(C[C@@H]1CCCO1)C(=O)Nc1cccc(CSC2CCCC2)c1 ZINC000438261348 863729004 /nfs/dbraw/zinc/72/90/04/863729004.db2.gz PQPQBFVRIFFYIW-FQEVSTJZSA-N 0 3 405.608 4.437 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)C3(Cc4ccccc4)CC3)CC2)c1 ZINC000438269677 863737378 /nfs/dbraw/zinc/73/73/78/863737378.db2.gz GJJKVCOETPGTIF-UHFFFAOYSA-N 0 3 405.586 4.036 20 0 HIADHN C[C@H]1CN(CC(C)(C)O)CCN1Cc1csc(-c2ccc(C(F)(F)F)cc2)n1 ZINC000438285104 863759901 /nfs/dbraw/zinc/75/99/01/863759901.db2.gz QRHYJCPICJPWOJ-AWEZNQCLSA-N 0 3 413.509 4.106 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Nc1ccccc1OCC(F)(F)F ZINC000438311651 863791340 /nfs/dbraw/zinc/79/13/40/863791340.db2.gz KJIWNIGDWIJACE-UHFFFAOYSA-N 0 3 401.454 4.285 20 0 HIADHN O=C(Nc1ccc(OCC(F)(F)F)c(C(F)(F)F)c1)N1CC[C@H](N2CC=CC2)C1 ZINC000438337109 863810923 /nfs/dbraw/zinc/81/09/23/863810923.db2.gz XAFATPNFJOEEIU-ZDUSSCGKSA-N 0 3 423.357 4.125 20 0 HIADHN COc1ccc(-c2nn(Cc3ccccc3)cc2CN2CC[C@@H](O)C(C)(C)C2)cc1 ZINC000438349300 863817975 /nfs/dbraw/zinc/81/79/75/863817975.db2.gz XJNFLIYYSRTJTB-HSZRJFAPSA-N 0 3 405.542 4.200 20 0 HIADHN C[C@H](Oc1ccc(C(F)(F)F)cc1)C(=O)N(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1 ZINC000438371620 863832037 /nfs/dbraw/zinc/83/20/37/863832037.db2.gz MSUUVGDURLGVKM-KNBMTAEXSA-N 0 3 421.463 4.019 20 0 HIADHN CCSCc1cccc(NC(=O)N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)c1 ZINC000438377215 863836123 /nfs/dbraw/zinc/83/61/23/863836123.db2.gz QJWMRRWBADAUKF-HDICACEKSA-N 0 3 405.608 4.293 20 0 HIADHN O=C(NCCN1CCCCC1)Nc1ccnc(Oc2ccccc2Br)c1 ZINC000438386576 863840009 /nfs/dbraw/zinc/84/00/09/863840009.db2.gz REFIEMBKWBOLFF-UHFFFAOYSA-N 0 3 419.323 4.244 20 0 HIADHN COC(=O)C(C)(C)c1ccc(NC(=O)N[C@@H](CN2CCCC2)c2ccccc2)cc1 ZINC000438461530 863884128 /nfs/dbraw/zinc/88/41/28/863884128.db2.gz OTOXHLAZFUWPBP-NRFANRHFSA-N 0 3 409.530 4.096 20 0 HIADHN Cc1cc(NC(=O)C(C)(C)C)sc1C(=O)N(CCN(C)C)Cc1cccs1 ZINC000438465949 863887597 /nfs/dbraw/zinc/88/75/97/863887597.db2.gz CTYOGKJSSSEFGH-UHFFFAOYSA-N 0 3 407.605 4.307 20 0 HIADHN COc1ccc([C@H](C)N[C@H](C)c2cc(F)ccc2N2CCN(C)CC2)cc1OC ZINC000467856982 881707043 /nfs/dbraw/zinc/70/70/43/881707043.db2.gz UCHSKQQZWPQGIG-DLBZAZTESA-N 0 3 401.526 4.007 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)CCOc2ccc(F)cc2Cl)CC1 ZINC000438552180 863982624 /nfs/dbraw/zinc/98/26/24/863982624.db2.gz JXDHXBGFERJGIV-UHFFFAOYSA-N 0 3 404.913 4.371 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)c2ccnc(SCC(F)(F)F)c2)CC1 ZINC000438553324 863984160 /nfs/dbraw/zinc/98/41/60/863984160.db2.gz LRMHJCPLFWUORN-UHFFFAOYSA-N 0 3 423.504 4.473 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)Nc1ccccc1CC(F)(F)F ZINC000438624879 864052046 /nfs/dbraw/zinc/05/20/46/864052046.db2.gz LOIKJTPYCWWOBR-UHFFFAOYSA-N 0 3 401.498 4.275 20 0 HIADHN CCN(C(=O)C(=O)Nc1cccc([C@H](C)OC)c1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000438652862 864094219 /nfs/dbraw/zinc/09/42/19/864094219.db2.gz BTLHVUKMPWNANY-SFYKDHMMSA-N 0 3 423.557 4.017 20 0 HIADHN CCN(C(=O)C(=O)Nc1cccc([C@H](C)OC)c1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000438652860 864094741 /nfs/dbraw/zinc/09/47/41/864094741.db2.gz BTLHVUKMPWNANY-SELNLUPBSA-N 0 3 423.557 4.017 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)Nc1c(F)cc(Br)cc1F ZINC000438655150 864097834 /nfs/dbraw/zinc/09/78/34/864097834.db2.gz XOKLRXKBABGNJV-UHFFFAOYSA-N 0 3 412.278 4.323 20 0 HIADHN CCN(C(=O)C(=O)Nc1ccc(SC)cc1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000438656487 864099212 /nfs/dbraw/zinc/09/92/12/864099212.db2.gz PTCSCLSVSIPATM-FXAWDEMLSA-N 0 3 411.571 4.031 20 0 HIADHN CCN(C(=O)C(=O)Nc1ccc(F)c(Cl)c1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000438664928 864115360 /nfs/dbraw/zinc/11/53/60/864115360.db2.gz BIMXKVWDSOYADM-QAPCUYQASA-N 0 3 417.912 4.102 20 0 HIADHN CCOc1ccc(NC(=O)C(=O)N(CC)[C@H]2CCN([C@@H](C)c3ccccc3)C2)c(C)c1 ZINC000438666751 864121737 /nfs/dbraw/zinc/12/17/37/864121737.db2.gz RVCIWUIXFGPIJK-FPOVZHCZSA-N 0 3 423.557 4.016 20 0 HIADHN CCN(C(=O)C(=O)Nc1cccc(SC)c1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000438667416 864125029 /nfs/dbraw/zinc/12/50/29/864125029.db2.gz XIKVIMSTWNOBBD-FXAWDEMLSA-N 0 3 411.571 4.031 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Nc1cccc(OCC(F)(F)F)c1 ZINC000438692740 864161491 /nfs/dbraw/zinc/16/14/91/864161491.db2.gz LQGMMHKPTRITPP-UHFFFAOYSA-N 0 3 401.454 4.285 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)N(CCN(C)C)Cc2cccs2)c(C)c1 ZINC000438696750 864166186 /nfs/dbraw/zinc/16/61/86/864166186.db2.gz VTIHYQNFPKFZLG-KRWDZBQOSA-N 0 3 416.591 4.181 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)c2ccc(OCc3ccncc3)cc2)CC1 ZINC000438716598 864199683 /nfs/dbraw/zinc/19/96/83/864199683.db2.gz ZJWRSABKOFTLAL-UHFFFAOYSA-N 0 3 415.537 4.397 20 0 HIADHN Cc1ccccc1C(=O)NC1CCN(CCc2cccc(OC(F)(F)F)c2)CC1 ZINC000438787610 864281045 /nfs/dbraw/zinc/28/10/45/864281045.db2.gz FDQRRCPJXXAUSV-UHFFFAOYSA-N 0 3 406.448 4.331 20 0 HIADHN O=C(Nc1ccccc1)NC1CCN(CCc2cccc(OC(F)(F)F)c2)CC1 ZINC000438801243 864292407 /nfs/dbraw/zinc/29/24/07/864292407.db2.gz LAYDACPBSDAQQF-UHFFFAOYSA-N 0 3 407.436 4.414 20 0 HIADHN Cc1cc(NC(=O)NCc2ccccc2CN2CCC(O)CC2)ccc1C(F)(F)F ZINC000438883835 864370088 /nfs/dbraw/zinc/37/00/88/864370088.db2.gz QOGHYNQSPIRVGH-UHFFFAOYSA-N 0 3 421.463 4.292 20 0 HIADHN O[C@@H]1CCCC[C@@H]1[C@H]1CCCCN1Cc1cc2c(cc1Br)OCCO2 ZINC000439003134 864456374 /nfs/dbraw/zinc/45/63/74/864456374.db2.gz PWSFCXBLLBADNY-KBAYOESNSA-N 0 3 410.352 4.126 20 0 HIADHN Cc1cc(Br)ccc1NC(=O)CN1CCCC[C@@H]1[C@H]1CCCC[C@H]1O ZINC000439006046 864460058 /nfs/dbraw/zinc/46/00/58/864460058.db2.gz FVYVBDXXEQNERO-BHIYHBOVSA-N 0 3 409.368 4.102 20 0 HIADHN O[C@@H]1CCCC[C@H]1[C@@H]1CCCCN1Cc1nnc(-c2ccccc2Br)o1 ZINC000439013959 864465039 /nfs/dbraw/zinc/46/50/39/864465039.db2.gz FIZXHBJLHJLDFV-RYQLBKOJSA-N 0 3 420.351 4.405 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)c1ccc2c(c1)[nH]c(=O)n2C1CCCC1 ZINC000439030962 864487038 /nfs/dbraw/zinc/48/70/38/864487038.db2.gz XIFYJWYVNMDVLT-UHFFFAOYSA-N 0 3 412.559 4.123 20 0 HIADHN CS(=O)(=O)Nc1cccc(CN[C@H](c2ccc(Br)s2)C2CC2)c1 ZINC000439141354 864573612 /nfs/dbraw/zinc/57/36/12/864573612.db2.gz RTZHPYFXJXEVIY-INIZCTEOSA-N 0 3 415.378 4.123 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)C1(Cc2ccc(OC(F)(F)F)cc2)CC1 ZINC000439171326 864599789 /nfs/dbraw/zinc/59/97/89/864599789.db2.gz SDXFQOBKJJOOPZ-UHFFFAOYSA-N 0 3 410.436 4.091 20 0 HIADHN C[C@H](NC(=O)N(CCN(C)C)Cc1cccs1)c1nc2ccccc2n1C(F)F ZINC000439205777 864629740 /nfs/dbraw/zinc/62/97/40/864629740.db2.gz ARCBCMLVTRTZED-AWEZNQCLSA-N 0 3 421.517 4.327 20 0 HIADHN CCN(C[C@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)c1cccc2cc(C)cnc21 ZINC000439219822 864637767 /nfs/dbraw/zinc/63/77/67/864637767.db2.gz BRFJVBDUBWAOCP-NRFANRHFSA-N 0 3 423.582 4.076 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3ccnc4ccccc43)c(OCC)c2)CC1 ZINC000439282718 864704056 /nfs/dbraw/zinc/70/40/56/864704056.db2.gz CPLZVTGXZWFUFV-UHFFFAOYSA-N 0 3 418.541 4.418 20 0 HIADHN O=C(CCN1CCC([C@H]2CCCO2)CC1)Nc1ccccc1C(=O)c1ccccc1 ZINC000439293442 864717243 /nfs/dbraw/zinc/71/72/43/864717243.db2.gz DJDKQUKTQIJRPF-HSZRJFAPSA-N 0 3 406.526 4.137 20 0 HIADHN Cc1cccn2c(=O)cc(CN3CCC(c4cccc(Br)c4)CC3)nc12 ZINC000439320277 864756193 /nfs/dbraw/zinc/75/61/93/864756193.db2.gz QSOZESAZRNEXIS-UHFFFAOYSA-N 0 3 412.331 4.145 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)NCCc1c[nH]c2ccc(Cl)cc12 ZINC000439323146 864759687 /nfs/dbraw/zinc/75/96/87/864759687.db2.gz WMUPRWGSLXWRDD-UHFFFAOYSA-N 0 3 404.967 4.199 20 0 HIADHN Cc1nc(C)c([C@H](C)N(C)C[C@H](O)COc2cc(F)cc(Br)c2)s1 ZINC000439436466 864830850 /nfs/dbraw/zinc/83/08/50/864830850.db2.gz XAQARTLAUJSJNV-NHYWBVRUSA-N 0 3 417.344 4.094 20 0 HIADHN CC(C)Oc1ccc([C@H](C)N[C@H](C)C(=O)N2CCN(c3ccc(F)cc3)CC2)cc1 ZINC000439565854 864889984 /nfs/dbraw/zinc/88/99/84/864889984.db2.gz CCMMCGMCWLHVGF-RBUKOAKNSA-N 0 3 413.537 4.001 20 0 HIADHN C[C@@H](NCc1ccccc1CN(C)Cc1ccco1)C(=O)N1c2ccccc2C[C@@H]1C ZINC000439595416 864918762 /nfs/dbraw/zinc/91/87/62/864918762.db2.gz JXLQMAOBGNPIBC-VQTJNVASSA-N 0 3 417.553 4.368 20 0 HIADHN CN(C)Cc1cccc(NC(=O)C(=O)N(Cc2ccccc2F)C2CCCCC2)c1 ZINC000439655675 864982355 /nfs/dbraw/zinc/98/23/55/864982355.db2.gz XFEGMISZEYPFCF-UHFFFAOYSA-N 0 3 411.521 4.187 20 0 HIADHN CC[C@](C)(O)CN(Cc1ccccc1)C(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000439702999 865039074 /nfs/dbraw/zinc/03/90/74/865039074.db2.gz BOUOXSZVBADXRD-XRODADMRSA-N 0 3 409.574 4.195 20 0 HIADHN COc1cc(C2(C(=O)NC3CCN([C@@H](C)c4ccncc4)CC3)CCC2)ccc1C ZINC000439741284 865072358 /nfs/dbraw/zinc/07/23/58/865072358.db2.gz QZLUAPWHZXJVSQ-IBGZPJMESA-N 0 3 407.558 4.162 20 0 HIADHN CC(C)[C@H]1CC[C@@H](C)C[C@@H]1OCC(=O)NC1CCN([C@H](C)c2ccncc2)CC1 ZINC000439759020 865085067 /nfs/dbraw/zinc/08/50/67/865085067.db2.gz SBGYPBMBKLCCJO-NNLJWKLDSA-N 0 3 401.595 4.201 20 0 HIADHN C[C@H](SCC(=O)NC1CCN([C@@H](C)c2ccncc2)CC1)c1nc2ccccc2[nH]1 ZINC000439764263 865090954 /nfs/dbraw/zinc/09/09/54/865090954.db2.gz HDRBOUUHNCTPOK-IRXDYDNUSA-N 0 3 423.586 4.094 20 0 HIADHN C[C@@H](Oc1cccc(C(C)(C)C)c1)C(=O)NC1CCN([C@H](C)c2ccncc2)CC1 ZINC000439768116 865094450 /nfs/dbraw/zinc/09/44/50/865094450.db2.gz LXCSPIWFFUEHEI-RTBURBONSA-N 0 3 409.574 4.488 20 0 HIADHN CCn1ncc(NC(=O)N2CCCN(CCCc3ccccc3)CC2)c1C(F)(F)F ZINC000439878787 865189312 /nfs/dbraw/zinc/18/93/12/865189312.db2.gz CUJAHRLEPZTZCP-UHFFFAOYSA-N 0 3 423.483 4.094 20 0 HIADHN COc1cccc([C@@H](C)CC(=O)NCCCCN2CCN(c3cccc(C)c3)CC2)c1 ZINC000439888646 865200635 /nfs/dbraw/zinc/20/06/35/865200635.db2.gz MCNZXDLSQHXKIX-QFIPXVFZSA-N 0 3 423.601 4.216 20 0 HIADHN Cc1c([C@H](C)NC[C@]2(C)CCO[C@H]2C2CC2)nnn1-c1cccc(Br)c1 ZINC000468038658 881868159 /nfs/dbraw/zinc/86/81/59/881868159.db2.gz QJUHHSBSHHEXRT-MRFFXTKBSA-N 0 3 419.367 4.194 20 0 HIADHN COc1ccc([C@H](CNC(=O)N(CCN(C)C)C(C)C)c2c[nH]c3ccccc32)cc1 ZINC000440205646 865436921 /nfs/dbraw/zinc/43/69/21/865436921.db2.gz ZIPZONSPEPCOCJ-QFIPXVFZSA-N 0 3 422.573 4.290 20 0 HIADHN Cc1nc2c(s1)[C@H](N[C@H]1CC(=O)N(Cc3ccccc3C(F)(F)F)C1)CCC2 ZINC000468049596 881875698 /nfs/dbraw/zinc/87/56/98/881875698.db2.gz OFSCFUIVNILJSI-WMLDXEAASA-N 0 3 409.477 4.238 20 0 HIADHN CC(=O)Nc1ccc([C@@H](C)N[C@@H]2CC(=O)N(Cc3ccccc3C(F)(F)F)C2)cc1 ZINC000468051849 881876560 /nfs/dbraw/zinc/87/65/60/881876560.db2.gz XBHQVEYWEBQHLY-AUUYWEPGSA-N 0 3 419.447 4.116 20 0 HIADHN CCNC(=O)c1ccc(C)c(NC(=O)N2CCN(C3CCC(C(C)C)CC3)CC2)c1 ZINC000440268227 865517828 /nfs/dbraw/zinc/51/78/28/865517828.db2.gz FXXWMXGYXHFOJU-UHFFFAOYSA-N 0 3 414.594 4.109 20 0 HIADHN CN(C)CCN(C(=O)NCc1cccc(NC(=O)C2CCCCC2)c1)C1CCCC1 ZINC000468055518 881879268 /nfs/dbraw/zinc/87/92/68/881879268.db2.gz UAWSPKZBYMQOTJ-UHFFFAOYSA-N 0 3 414.594 4.221 20 0 HIADHN COc1cc([C@H](C)NC(=O)N(CCN(C)C)C2CCCC2)ccc1OCC(C)C ZINC000468056344 881879516 /nfs/dbraw/zinc/87/95/16/881879516.db2.gz GTFOZMDQUQFLEU-SFHVURJKSA-N 0 3 405.583 4.307 20 0 HIADHN CN(Cc1ccc(Cl)s1)C(=O)CNC1(c2ccc(Cl)cc2)CCOCC1 ZINC000440310542 865575781 /nfs/dbraw/zinc/57/57/81/865575781.db2.gz YAVNXIYRXBLLMF-UHFFFAOYSA-N 0 3 413.370 4.309 20 0 HIADHN CC(C)C1CCC(N2CCN([C@H](C)C(=O)NCCc3c[nH]c4ccccc34)CC2)CC1 ZINC000440320450 865590330 /nfs/dbraw/zinc/59/03/30/865590330.db2.gz XXCZJVQRHXQBLB-HVIUMASTSA-N 0 3 424.633 4.048 20 0 HIADHN C[C@H](C(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1)n1ccc2ccccc2c1=O ZINC000468072769 881887875 /nfs/dbraw/zinc/88/78/75/881887875.db2.gz DTYYNIBAKNMHOI-NQIIRXRSSA-N 0 3 423.582 4.213 20 0 HIADHN Cc1oncc1C(=O)Nc1ccc(NC(=O)c2oc3ccccc3c2CN(C)C)cc1 ZINC000468086326 881894615 /nfs/dbraw/zinc/89/46/15/881894615.db2.gz LIMVDSIAFBSWLW-UHFFFAOYSA-N 0 3 418.453 4.295 20 0 HIADHN CCN(Cc1c[nH]c2ccccc12)C(=O)c1ccc(N2CCN(C(C)C)CC2)cc1 ZINC000468090682 881897918 /nfs/dbraw/zinc/89/79/18/881897918.db2.gz WZKDECQRFXYQFK-UHFFFAOYSA-N 0 3 404.558 4.361 20 0 HIADHN CC(=O)c1ccc(C(=O)N(C[C@H]2CCN(Cc3ccccc3)C2)CC(F)(F)F)s1 ZINC000440436512 865738780 /nfs/dbraw/zinc/73/87/80/865738780.db2.gz VEQZGHPGWGNPQR-KRWDZBQOSA-N 0 3 424.488 4.477 20 0 HIADHN CCOC(=O)c1c2c(sc1NC(=O)C1CC(F)(F)C1)C(C)(C)NC(C)(C)C2 ZINC000440550751 865816004 /nfs/dbraw/zinc/81/60/04/865816004.db2.gz LPIKKMGEZWTRRN-UHFFFAOYSA-N 0 3 400.491 4.068 20 0 HIADHN CCOc1ccccc1OCCN1CCC(Nc2cc(OC)cc(OC)c2)CC1 ZINC000440552176 865816803 /nfs/dbraw/zinc/81/68/03/865816803.db2.gz PPRIOSPTKJVTRY-UHFFFAOYSA-N 0 3 400.519 4.058 20 0 HIADHN CN(C)CCn1c(=O)oc2ccc(NC(=O)C(C)(C)Cc3cccc(Cl)c3)cc21 ZINC000440573909 865823627 /nfs/dbraw/zinc/82/36/27/865823627.db2.gz FMGGBALFBXJYKW-UHFFFAOYSA-N 0 3 415.921 4.017 20 0 HIADHN CCCN(C(=O)c1cc2cnn(CC)c2nc1C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000440717533 865873457 /nfs/dbraw/zinc/87/34/57/865873457.db2.gz LFQIWXHWJJCLHW-QFIPXVFZSA-N 0 3 419.573 4.276 20 0 HIADHN Cc1c(C(=O)Nc2ccc(CCN3CCSCC3)cc2)cnn1CCC(C)C ZINC000440783604 865910329 /nfs/dbraw/zinc/91/03/29/865910329.db2.gz XYESGELCTCSPPQ-UHFFFAOYSA-N 0 3 400.592 4.081 20 0 HIADHN COc1cc2[nH]c(CCCNC(=O)c3cccc(CN4CCCC4)c3)cc2c(OC)c1 ZINC000440921035 866016631 /nfs/dbraw/zinc/01/66/31/866016631.db2.gz TZFFMXLBQUKVFS-UHFFFAOYSA-N 0 3 421.541 4.144 20 0 HIADHN Cc1nc(-c2ccc(C(=O)Nc3ccc(OC4CCN(C)CC4)nc3)cc2)cs1 ZINC000441070869 866158093 /nfs/dbraw/zinc/15/80/93/866158093.db2.gz XCTXXFVGRPCNCR-UHFFFAOYSA-N 0 3 408.527 4.239 20 0 HIADHN CC(C)c1ncc(CN(C)C(=O)NC[C@H](c2ccccc2)N2CCC(C)CC2)cn1 ZINC000441234931 866311619 /nfs/dbraw/zinc/31/16/19/866311619.db2.gz OECQDIKHNHBSHX-JOCHJYFZSA-N 0 3 409.578 4.215 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)Nc1ccc(OC2CCCC2)c(F)c1 ZINC000441255711 866328688 /nfs/dbraw/zinc/32/86/88/866328688.db2.gz LIHDLJXLRXPKCN-UHFFFAOYSA-N 0 3 413.493 4.094 20 0 HIADHN COc1ccc([C@@H](CNC(=O)CN(C)CCC2CC2)c2c[nH]c3ccccc32)cc1 ZINC000441262559 866336712 /nfs/dbraw/zinc/33/67/12/866336712.db2.gz OTVIYANEKHCTIY-JOCHJYFZSA-N 0 3 405.542 4.157 20 0 HIADHN C[C@H](C(=O)Nc1ccc(OCc2ccccc2)cc1)N1CCC[C@@H]([C@H]2CCOC2)C1 ZINC000441284521 866358093 /nfs/dbraw/zinc/35/80/93/866358093.db2.gz XQVXNMRVHKIJTM-FCEUIQTBSA-N 0 3 408.542 4.341 20 0 HIADHN C[C@@H]1CCCN1C(=O)CCN1CCc2c(cccc2NC(=O)Nc2ccc(F)cc2)C1 ZINC000441325104 866396161 /nfs/dbraw/zinc/39/61/61/866396161.db2.gz PJJRZSNBVMYZIY-QGZVFWFLSA-N 0 3 424.520 4.229 20 0 HIADHN C[C@@H]1CCCN1C(=O)CCN1CCc2c(cccc2NC(=O)Nc2ccccc2F)C1 ZINC000441395773 866469868 /nfs/dbraw/zinc/46/98/68/866469868.db2.gz PNURJSPYUJNDBS-QGZVFWFLSA-N 0 3 424.520 4.229 20 0 HIADHN COCCN(C(=O)N[C@@H]1C[C@H](C)N(C2CC2)C1)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000441397326 866470215 /nfs/dbraw/zinc/47/02/15/866470215.db2.gz QLKFEEXJEABSBB-HDMKZQKVSA-N 0 3 413.484 4.050 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N(Cc1ccccc1)[C@H](C)C(C)(C)C ZINC000441400532 866475237 /nfs/dbraw/zinc/47/52/37/866475237.db2.gz GOTLUNLGBCJBCB-LJQANCHMSA-N 0 3 409.574 4.459 20 0 HIADHN C[C@@H](NC(=O)CN(C[C@@H]1CCCO1)C1CCCC1)c1ccc(Br)cc1 ZINC000441444737 866521560 /nfs/dbraw/zinc/52/15/60/866521560.db2.gz UPJCEPDVJNVBOT-BEFAXECRSA-N 0 3 409.368 4.050 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N(C)[C@H](C)c3nc4ccccc4s3)cc2)CC1 ZINC000468141152 881996761 /nfs/dbraw/zinc/99/67/61/881996761.db2.gz ZOQNNZDMPLUOJF-QGZVFWFLSA-N 0 3 408.571 4.271 20 0 HIADHN C[C@@H](C(=O)N(Cc1cccc(Br)c1)C1CCOCC1)N1CCCCCC1 ZINC000468145668 882002096 /nfs/dbraw/zinc/00/20/96/882002096.db2.gz JVVJFEDBLGMHLL-KRWDZBQOSA-N 0 3 423.395 4.221 20 0 HIADHN COc1ccc(CN(C)C(=O)CN(C)[C@H](Cc2ccc(F)cc2)C(C)C)cc1OC ZINC000441624853 866723817 /nfs/dbraw/zinc/72/38/17/866723817.db2.gz XHMJDQZKNROOCO-OAQYLSRUSA-N 0 3 416.537 4.000 20 0 HIADHN O=C(NCc1cccc(COCC(F)(F)F)c1)c1cccc(CN2CCCC2)c1 ZINC000441721059 866819627 /nfs/dbraw/zinc/81/96/27/866819627.db2.gz UULICAPEDVRURC-UHFFFAOYSA-N 0 3 406.448 4.291 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CC[C@@H](OC)C[C@@H]1C)c1ccc(C(F)(F)F)cc1 ZINC000441897534 866961000 /nfs/dbraw/zinc/96/10/00/866961000.db2.gz NNRULULPHMIJTO-KFKAGJAMSA-N 0 3 415.500 4.297 20 0 HIADHN CC[C@@H]1CCc2nc(NC(=O)N3CCC(CN4C[C@@H](C)O[C@H](C)C4)CC3)sc2C1 ZINC000441940337 867006625 /nfs/dbraw/zinc/00/66/25/867006625.db2.gz FHFVQODCGHLENK-BRWVUGGUSA-N 0 3 420.623 4.011 20 0 HIADHN CC(C)N(CCN(C)C)C(=O)N[C@@H]1CCCc2sc(-c3ccc(F)cc3)nc21 ZINC000468164067 882036924 /nfs/dbraw/zinc/03/69/24/882036924.db2.gz JNKPSPBVFQYIFT-QGZVFWFLSA-N 0 3 404.555 4.308 20 0 HIADHN O=C(Nc1nc(C2CCC2)cs1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000442062517 867093707 /nfs/dbraw/zinc/09/37/07/867093707.db2.gz VTCBLTJWELTHLF-UHFFFAOYSA-N 0 3 402.486 4.337 20 0 HIADHN COCCc1ccccc1NC(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000468203283 882082699 /nfs/dbraw/zinc/08/26/99/882082699.db2.gz ZIXQDDZAWRLFAB-NRFANRHFSA-N 0 3 406.448 4.269 20 0 HIADHN Cc1ccccc1CN1CCCN(C(=O)CN[C@H](C)c2cc3ccccc3o2)CC1 ZINC000442889781 867723666 /nfs/dbraw/zinc/72/36/66/867723666.db2.gz LTYSJLJACZPKDJ-HXUWFJFHSA-N 0 3 405.542 4.126 20 0 HIADHN CN1CCN(CCNC(=O)c2ccc(Oc3ccc(Cl)cc3)c(F)c2)CC1(C)C ZINC000442962044 867765985 /nfs/dbraw/zinc/76/59/85/867765985.db2.gz FYDIHIJJXZQCRW-UHFFFAOYSA-N 0 3 419.928 4.027 20 0 HIADHN Cn1ccnc1SCc1ccc(C(=O)NCCN2CCC3(CCCCC3)CC2)o1 ZINC000442979995 867776336 /nfs/dbraw/zinc/77/63/36/867776336.db2.gz QLOAHWNULQJQMQ-UHFFFAOYSA-N 0 3 416.591 4.082 20 0 HIADHN CCC[C@@H](NCc1cccc(NC(=O)CCN2CCOCC2)c1)c1ccsc1 ZINC000443093211 867818044 /nfs/dbraw/zinc/81/80/44/867818044.db2.gz MEHPMSOPCVTVDM-OAQYLSRUSA-N 0 3 401.576 4.040 20 0 HIADHN Cc1[nH]c2c(cccc2C(=O)NC2CCN(CCOc3ccc(F)cc3)CC2)c1C ZINC000443351068 867920758 /nfs/dbraw/zinc/92/07/58/867920758.db2.gz YZWDXXZUCDTFBQ-UHFFFAOYSA-N 0 3 409.505 4.197 20 0 HIADHN Cc1cc(CN2CCC[C@@H](CNC(=O)C(C)(C)C)C2)nc(-c2ccc(Cl)cc2)n1 ZINC000443603249 868161050 /nfs/dbraw/zinc/16/10/50/868161050.db2.gz JULULTVIFWEMEQ-KRWDZBQOSA-N 0 3 414.981 4.480 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)C[C@@H](Cc2ccccc2)c2ccccc2)C[C@@H](C)O1 ZINC000443664748 868271048 /nfs/dbraw/zinc/27/10/48/868271048.db2.gz FPRQBNPHXQCBJC-TZBSWOFLSA-N 0 3 408.586 4.409 20 0 HIADHN Cc1cccc(COc2cccc(CC(=O)NCCCCN3C[C@@H](C)O[C@@H](C)C3)c2)c1 ZINC000443672816 868278442 /nfs/dbraw/zinc/27/84/42/868278442.db2.gz GXTJGWNPPQBGQJ-SZPZYZBQSA-N 0 3 424.585 4.122 20 0 HIADHN C[C@@H](CC(=O)Nc1cccc(CN2CCC(CO)CC2)c1)c1ccc(F)cc1F ZINC000443803230 868340213 /nfs/dbraw/zinc/34/02/13/868340213.db2.gz PXANCJMFBLHQDL-INIZCTEOSA-N 0 3 402.485 4.301 20 0 HIADHN CCOC(=O)c1c(NC(=O)CC[C@@H]2CC[C@H](C)O2)sc2c1CC(C)(C)NC2(C)C ZINC000443810520 868344641 /nfs/dbraw/zinc/34/46/41/868344641.db2.gz AVTUQJQJXKQZIF-KBPBESRZSA-N 0 3 422.591 4.370 20 0 HIADHN Cc1ccccc1[C@@H]([C@H](C)NC(=O)C(=O)Nc1ccc(C)c(C(F)(F)F)c1)N(C)C ZINC000443839220 868369039 /nfs/dbraw/zinc/36/90/39/868369039.db2.gz KUYXCRJHCPXNGR-HNAYVOBHSA-N 0 3 421.463 4.068 20 0 HIADHN O=C(CCN1CCN(c2ccccc2)CC1)N[C@@H]1CCSc2ccc(Cl)cc21 ZINC000468266524 882186246 /nfs/dbraw/zinc/18/62/46/882186246.db2.gz PABMWPPHRGSESX-HXUWFJFHSA-N 0 3 415.990 4.205 20 0 HIADHN Cc1nc2ccc(Br)cc2c(N2CCCC[C@@H](S(C)(=O)=O)C2)c1C ZINC000443959745 868493531 /nfs/dbraw/zinc/49/35/31/868493531.db2.gz IPZWNCCUTNFOEU-OAHLLOKOSA-N 0 3 411.365 4.018 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@H](C)NCc2cnc(C(F)(F)F)s2)CC1 ZINC000443988868 868512702 /nfs/dbraw/zinc/51/27/02/868512702.db2.gz PIVSZMSTLHXLIF-ZDUSSCGKSA-N 0 3 416.488 4.294 20 0 HIADHN CC(C)CN(CCN(C)C)C(=O)Nc1cc(Br)ccc1Br ZINC000444032491 868565117 /nfs/dbraw/zinc/56/51/17/868565117.db2.gz PWESVWBAIZZEGZ-UHFFFAOYSA-N 0 3 421.177 4.263 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)c1c[nH]nc1-c1cc2ccccc2o1 ZINC000444180831 868651703 /nfs/dbraw/zinc/65/17/03/868651703.db2.gz IPZIKHBTJYVXKW-UHFFFAOYSA-N 0 3 416.481 4.032 20 0 HIADHN C[C@@H](Oc1cccc2ccccc21)C(=O)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000444274509 868709931 /nfs/dbraw/zinc/70/99/31/868709931.db2.gz CAADKUMTPFVYPH-GOSISDBHSA-N 0 3 404.510 4.203 20 0 HIADHN CN(C)CCN(C(=O)NCc1ccc(Cn2cnc3ccccc32)cc1)C1CCCC1 ZINC000468301677 882224627 /nfs/dbraw/zinc/22/46/27/882224627.db2.gz VUGUZVITPBDDHG-UHFFFAOYSA-N 0 3 419.573 4.100 20 0 HIADHN COc1ccc(CN(C)C[C@H](O)CO[C@@H](c2ccccc2)c2ccccc2C)cc1O ZINC000444404386 868813850 /nfs/dbraw/zinc/81/38/50/868813850.db2.gz SOHQAGXMQAMHAY-NVQXNPDNSA-N 0 3 421.537 4.308 20 0 HIADHN O=C(CCc1ccc(-c2ccccc2)[nH]1)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000444449168 868833156 /nfs/dbraw/zinc/83/31/56/868833156.db2.gz FDPYTJAJZRVMFN-UHFFFAOYSA-N 0 3 403.526 4.210 20 0 HIADHN Cc1ccccc1-c1nc(C(=O)Nc2cccc(CN3CCC(O)CC3)c2)cs1 ZINC000444455011 868835120 /nfs/dbraw/zinc/83/51/20/868835120.db2.gz RCGZKNFWJCLBLI-UHFFFAOYSA-N 0 3 407.539 4.328 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1cc(Cl)cc2cccnc21 ZINC000444547678 868877649 /nfs/dbraw/zinc/87/76/49/868877649.db2.gz JFLRWWSGJFHKGO-UHFFFAOYSA-N 0 3 409.917 4.345 20 0 HIADHN Cc1ccc(Cl)c(O[C@H](C)C(=O)Nc2cccc(CN3CCC(CO)CC3)c2)c1 ZINC000444547723 868877729 /nfs/dbraw/zinc/87/77/29/868877729.db2.gz JKBBCAIQWMRYSM-QGZVFWFLSA-N 0 3 416.949 4.259 20 0 HIADHN O=C(COc1ccc(Cl)cc1Cl)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000444556849 868881243 /nfs/dbraw/zinc/88/12/43/868881243.db2.gz ZHFYHXMZVCCKSA-UHFFFAOYSA-N 0 3 423.340 4.215 20 0 HIADHN O=C(Cc1coc2cc3c(cc12)CCC3)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000444556739 868881463 /nfs/dbraw/zinc/88/14/63/868881463.db2.gz ZYEODCSGDQCPGA-UHFFFAOYSA-N 0 3 418.537 4.307 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)NC(=O)N2CCCN(Cc3ccccc3)CC2)cc1 ZINC000444589966 868892337 /nfs/dbraw/zinc/89/23/37/868892337.db2.gz AMJVFDQCFKHCAY-HXUWFJFHSA-N 0 3 417.557 4.159 20 0 HIADHN CCOc1ccc(OC[C@H](O)CN2CCC(c3nc4cccc(C)c4o3)CC2)cc1 ZINC000444774701 868996977 /nfs/dbraw/zinc/99/69/77/868996977.db2.gz XPSJBJOWBRZLDR-LJQANCHMSA-N 0 3 410.514 4.154 20 0 HIADHN CCOC(=O)c1n[nH]c(C2CCN([C@H]3CCc4c3cc(Cl)cc4Cl)CC2)n1 ZINC000444818718 869028997 /nfs/dbraw/zinc/02/89/97/869028997.db2.gz XDEPMJWQTDOITB-INIZCTEOSA-N 0 3 409.317 4.155 20 0 HIADHN Cc1coc(-c2cccc(NC(=O)NCC3(N4CCSCC4)CCCC3)c2)n1 ZINC000468328149 882260007 /nfs/dbraw/zinc/26/00/07/882260007.db2.gz PDUJMTODZXNXDW-UHFFFAOYSA-N 0 3 400.548 4.133 20 0 HIADHN Cc1coc(-c2cccc(NC(=O)N3CCC(CN4C[C@H](C)O[C@@H](C)C4)CC3)c2)n1 ZINC000468334434 882266759 /nfs/dbraw/zinc/26/67/59/882266759.db2.gz RGMXAKSNKDJZHA-ROUUACIJSA-N 0 3 412.534 4.003 20 0 HIADHN C[C@@H](NC(=O)Cc1noc([C@H]2CCCN(Cc3cccc(F)c3)C2)n1)c1ccccc1 ZINC000445289885 869341364 /nfs/dbraw/zinc/34/13/64/869341364.db2.gz AKAYFAVDSKNLSX-XLIONFOSSA-N 0 3 422.504 4.008 20 0 HIADHN Ic1ccccc1-c1noc([C@@H]2CCCN2C2CCCC2)n1 ZINC000445383735 869467705 /nfs/dbraw/zinc/46/77/05/869467705.db2.gz JWPMNXZACOSAPC-HNNXBMFYSA-N 0 3 409.271 4.421 20 0 HIADHN Fc1cccc(CN2CCC[C@@H](c3nc(-c4cnn(-c5ccccc5)c4)no3)C2)c1 ZINC000445440047 869522631 /nfs/dbraw/zinc/52/26/31/869522631.db2.gz YVKQTZWIEQZGLP-GOSISDBHSA-N 0 3 403.461 4.441 20 0 HIADHN C[C@@H](NC(=O)N[C@H](CN1CCCC1)c1ccccc1)c1cccc(N2CCCC2)c1 ZINC000445503062 869568005 /nfs/dbraw/zinc/56/80/05/869568005.db2.gz JGZBIAALBILMCR-HYBUGGRVSA-N 0 3 406.574 4.484 20 0 HIADHN Fc1ccc(Oc2ccc(-c3noc([C@@H]4CCCN4C4CCOCC4)n3)cn2)cc1 ZINC000445563175 869620397 /nfs/dbraw/zinc/62/03/97/869620397.db2.gz IZDHOHAJTRQEFS-IBGZPJMESA-N 0 3 410.449 4.379 20 0 HIADHN CC(C)[C@@H](CC(F)(F)F)NCC(=O)N1CCC[C@@H]1c1ccc2c(c1)OCCCO2 ZINC000445878691 869869427 /nfs/dbraw/zinc/86/94/27/869869427.db2.gz VMCUXXXDQLYQAO-IAGOWNOFSA-N 0 3 414.468 4.078 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)CN[C@H](CC(F)(F)F)C(C)C)c(C(F)(F)F)c1 ZINC000445887091 869873318 /nfs/dbraw/zinc/87/33/18/869873318.db2.gz RUSVUBVROYEXKT-CQSZACIVSA-N 0 3 413.362 4.169 20 0 HIADHN CN(CCc1nc2ccccc2n1C)[C@H]1CCOc2ccc(Br)cc21 ZINC000445891130 869874636 /nfs/dbraw/zinc/87/46/36/869874636.db2.gz RXXJIJFLZFIMQW-KRWDZBQOSA-N 0 3 400.320 4.334 20 0 HIADHN CN(CCc1nc2ccccc2n1C)[C@@H]1CCOc2ccc(Br)cc21 ZINC000445891131 869874955 /nfs/dbraw/zinc/87/49/55/869874955.db2.gz RXXJIJFLZFIMQW-QGZVFWFLSA-N 0 3 400.320 4.334 20 0 HIADHN CCCCOc1ccccc1CN1CCC(C(=O)NCc2ccc(OC)cc2)CC1 ZINC000468408032 882349976 /nfs/dbraw/zinc/34/99/76/882349976.db2.gz JHSWBQPQWBYBFT-UHFFFAOYSA-N 0 3 410.558 4.403 20 0 HIADHN O=C1NC(CC(F)(F)F)C(=O)N1c1ccc(Oc2cccc(C(F)(F)F)n2)cc1 ZINC000445971023 869940632 /nfs/dbraw/zinc/94/06/32/869940632.db2.gz JJLPNJOJYIGFCU-NSHDSACASA-N 0 3 419.281 4.270 20 0 HIADHN CCOC(=O)c1sc2nc(CN[C@@H]3CCC[C@H]3c3ccccc3)nc(N)c2c1C ZINC000445987533 869951246 /nfs/dbraw/zinc/95/12/46/869951246.db2.gz GHIGMDXLWRFRPH-JKSUJKDBSA-N 0 3 410.543 4.185 20 0 HIADHN COc1cc(-c2nnc(CN[C@@H]3CCC[C@@H]3c3ccccc3)o2)cc(OC)c1OC ZINC000446002488 869965959 /nfs/dbraw/zinc/96/59/59/869965959.db2.gz FYDGMZWCLDLXHC-QZTJIDSGSA-N 0 3 409.486 4.188 20 0 HIADHN CN(C)C(=O)Cc1nc(CN[C@@H]2CCC[C@@H]2c2ccccc2C(F)(F)F)cs1 ZINC000446002193 869966086 /nfs/dbraw/zinc/96/60/86/869966086.db2.gz NPXWWKCYALNTKK-NVXWUHKLSA-N 0 3 411.493 4.219 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)Nc3cc(NC(=O)C(C)C)ccc3C)CC2)c1 ZINC000468434871 882377607 /nfs/dbraw/zinc/37/76/07/882377607.db2.gz JVDVLKOQRVSCRV-UHFFFAOYSA-N 0 3 422.573 4.049 20 0 HIADHN COc1cc(SC)ccc1NC(=O)N1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000446414514 870322342 /nfs/dbraw/zinc/32/23/42/870322342.db2.gz XPNKNNBMSRIVJQ-IRXDYDNUSA-N 0 3 421.607 4.160 20 0 HIADHN C[C@H](CSc1ccc(F)cc1)C(=O)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000446416013 870325498 /nfs/dbraw/zinc/32/54/98/870325498.db2.gz LSPCTCYVTYLBLA-MRXNPFEDSA-N 0 3 402.535 4.149 20 0 HIADHN Cc1nn(Cc2ccccc2)c2sc(C(=O)N(CCN(C)C)Cc3ccco3)cc12 ZINC000446440948 870359971 /nfs/dbraw/zinc/35/99/71/870359971.db2.gz PMXYZAUCUMCEGI-UHFFFAOYSA-N 0 3 422.554 4.252 20 0 HIADHN CC(C)CN(CCN(C)C)C(=O)NCc1nc2c(s1)C[C@@H](c1ccccc1)CC2 ZINC000468464912 882409495 /nfs/dbraw/zinc/40/94/95/882409495.db2.gz DJQSJZJAKZSEBH-IBGZPJMESA-N 0 3 414.619 4.145 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)Nc3ccsc3Cl)CC2)c1 ZINC000446585028 870493275 /nfs/dbraw/zinc/49/32/75/870493275.db2.gz YIIMTOZVLBVSFX-UHFFFAOYSA-N 0 3 406.983 4.434 20 0 HIADHN C[C@H](NCc1cccc(NC(=O)CCN2CCOCC2)c1)c1cc2ccccc2s1 ZINC000446742288 870650433 /nfs/dbraw/zinc/65/04/33/870650433.db2.gz FNZMIRTZFILLIE-SFHVURJKSA-N 0 3 423.582 4.413 20 0 HIADHN CN(C)Cc1cccc(C(=O)Nc2ccc(I)cc2Cl)c1 ZINC000468475146 882431025 /nfs/dbraw/zinc/43/10/25/882431025.db2.gz MEKRKWUSMMOBNW-UHFFFAOYSA-N 0 3 414.674 4.259 20 0 HIADHN Cc1ccc([C@@H](CN[C@@H](C)c2ccc(Br)cc2F)N2CCOCC2)o1 ZINC000446759965 870673437 /nfs/dbraw/zinc/67/34/37/870673437.db2.gz RIYWXFITMCBZDO-KBXCAEBGSA-N 0 3 411.315 4.214 20 0 HIADHN Cc1ccc(CNC(=O)N(CCN(C)C)Cc2cccs2)c(OCC2CC2)c1 ZINC000446779149 870698398 /nfs/dbraw/zinc/69/83/98/870698398.db2.gz ZKEIDWSYHMLORH-UHFFFAOYSA-N 0 3 401.576 4.119 20 0 HIADHN CC(C)OC(=O)C[C@@H]1CCCN(Cc2cn(-c3ccccc3)nc2-c2cccnc2)C1 ZINC000468475377 882434717 /nfs/dbraw/zinc/43/47/17/882434717.db2.gz OSWBVTBEKSGQRI-FQEVSTJZSA-N 0 3 418.541 4.488 20 0 HIADHN CN1CCCC(C)(C)[C@H]1CNC(=O)c1cc(NC(=O)NC(C)(C)C)ccc1Cl ZINC000468476912 882436517 /nfs/dbraw/zinc/43/65/17/882436517.db2.gz XUQXIFJFJUEYDA-QGZVFWFLSA-N 0 3 408.974 4.110 20 0 HIADHN OCC1(Cc2ccccc2)CCN(Cc2ccccc2OCc2cccnc2)CC1 ZINC000446838093 870757080 /nfs/dbraw/zinc/75/70/80/870757080.db2.gz DXJOSWDNFOINJR-UHFFFAOYSA-N 0 3 402.538 4.478 20 0 HIADHN CCOC(=O)c1nnc(C2CC[NH+](Cc3ccc(-c4ccccc4OC)cc3)CC2)[n-]1 ZINC000446840769 870758653 /nfs/dbraw/zinc/75/86/53/870758653.db2.gz IOWWTLLVYNMKTJ-UHFFFAOYSA-N 0 3 420.513 4.037 20 0 HIADHN CCOC(=O)c1n[n-]c(C2CC[NH+](Cc3ccc(-c4ccccc4OC)cc3)CC2)n1 ZINC000446840769 870758666 /nfs/dbraw/zinc/75/86/66/870758666.db2.gz IOWWTLLVYNMKTJ-UHFFFAOYSA-N 0 3 420.513 4.037 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CN1CCC(CO)(Cc2ccccc2)CC1 ZINC000446848439 870767411 /nfs/dbraw/zinc/76/74/11/870767411.db2.gz RWAMZIIJOOFJMJ-UHFFFAOYSA-N 0 3 403.570 4.365 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(C)c1CN1CCC(CO)(Cc2ccccc2)CC1 ZINC000446848645 870768832 /nfs/dbraw/zinc/76/88/32/870768832.db2.gz TUVYECVDMUUNSU-UHFFFAOYSA-N 0 3 407.533 4.445 20 0 HIADHN Cc1ccc([C@H](CCn2cncn2)NCc2cc(Cl)c3c(c2)OCCCO3)cc1 ZINC000446925260 870838193 /nfs/dbraw/zinc/83/81/93/870838193.db2.gz NKTOEXKBANNWHP-FQEVSTJZSA-N 0 3 412.921 4.322 20 0 HIADHN Cc1ccc([C@H](CCn2cncn2)NCc2ccc(C)cc2OC[C@@H]2CCOC2)cc1 ZINC000446938268 870848141 /nfs/dbraw/zinc/84/81/41/870848141.db2.gz HXYFXJDGJCCLSM-QPPBQGQZSA-N 0 3 420.557 4.231 20 0 HIADHN CN(C)c1noc([C@H]2CCCN(Cc3cn(Cc4ccccc4)nc3C(C)(C)C)C2)n1 ZINC000446976037 870873973 /nfs/dbraw/zinc/87/39/73/870873973.db2.gz UYDLIMCESIZFIP-IBGZPJMESA-N 0 3 422.577 4.058 20 0 HIADHN CCN1CCC[C@@H](CN(C)C(=O)N[C@@H](C)CC2CCCCC2)[C@@H]1c1cnn(C)c1 ZINC000446995439 870882800 /nfs/dbraw/zinc/88/28/00/870882800.db2.gz XTZUFORSKOJNNR-RCZSKKKRSA-N 0 3 403.615 4.193 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1cc(-c2n[nH]c(C)n2)ccc1C)c1ccsc1 ZINC000447050916 870929200 /nfs/dbraw/zinc/92/92/00/870929200.db2.gz QIOBJPCHFRAQBX-IBGZPJMESA-N 0 3 412.563 4.355 20 0 HIADHN Cc1nc(-c2ccc(C)c(NC(=O)NC[C@@H](c3ccccc3)N3CCCC3)c2)n[nH]1 ZINC000447051267 870929693 /nfs/dbraw/zinc/92/96/93/870929693.db2.gz SEQCUKYNYWKGPP-NRFANRHFSA-N 0 3 404.518 4.047 20 0 HIADHN CN1CCC2(CCN(Cc3cn(Cc4ccccc4)nc3-c3cccs3)CC2)C1=O ZINC000447063001 870943113 /nfs/dbraw/zinc/94/31/13/870943113.db2.gz HDXPVCYPFOVNAT-UHFFFAOYSA-N 0 3 420.582 4.104 20 0 HIADHN COCCO[C@@H]1C[C@H](CO)CN(Cc2ccc(-c3ccc(C(C)(C)C)cc3)o2)C1 ZINC000447076015 870959178 /nfs/dbraw/zinc/95/91/78/870959178.db2.gz IITTZBBKXWIXQW-PGRDOPGGSA-N 0 3 401.547 4.090 20 0 HIADHN CN1CCCC(C)(C)[C@H]1CNC(=O)c1ccc(Br)cc1C(F)(F)F ZINC000468493669 882480554 /nfs/dbraw/zinc/48/05/54/882480554.db2.gz YAKAGAWPGVPOIP-CQSZACIVSA-N 0 3 407.274 4.318 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)NCc1ccccc1OCc1ccccc1 ZINC000447319994 871213303 /nfs/dbraw/zinc/21/33/03/871213303.db2.gz VHFVLDOWARIJKE-UHFFFAOYSA-N 0 3 407.514 4.132 20 0 HIADHN CCC[C@@]1(COC)CCCN1Cc1nc(-c2ccc(OC(F)F)c(OC)c2)no1 ZINC000447400834 871311823 /nfs/dbraw/zinc/31/18/23/871311823.db2.gz SDIGPIZNJWJCBR-FQEVSTJZSA-N 0 3 411.449 4.128 20 0 HIADHN Cc1sc(CC(=O)Nc2ccc(CCN3CCSCC3)cc2)nc1C(C)C ZINC000447453492 871346360 /nfs/dbraw/zinc/34/63/60/871346360.db2.gz VZMCKXJMTIWBBJ-UHFFFAOYSA-N 0 3 403.617 4.347 20 0 HIADHN COC(=O)c1coc([C@@H](C)NC2CCN(Cc3cccc(C(F)(F)F)c3)CC2)c1 ZINC000447554206 871435832 /nfs/dbraw/zinc/43/58/32/871435832.db2.gz ZJTRXDOWFOMLOW-CQSZACIVSA-N 0 3 410.436 4.400 20 0 HIADHN COC(=O)c1coc([C@H](C)NC2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)c1 ZINC000447594358 871501088 /nfs/dbraw/zinc/50/10/88/871501088.db2.gz YHTVRYQAWKUEPP-ZDUSSCGKSA-N 0 3 424.419 4.040 20 0 HIADHN OC[C@@H](CN[C@@H](c1ccc(F)cc1)c1cccnc1)Cc1cc(F)c(F)c(F)c1 ZINC000447607258 871516621 /nfs/dbraw/zinc/51/66/21/871516621.db2.gz QWRQDHRKJQEDRD-QRQCRPRQSA-N 0 3 404.407 4.168 20 0 HIADHN C[C@H](CC1CCOCC1)N[C@@H](c1ccc(F)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000468519563 882531659 /nfs/dbraw/zinc/53/16/59/882531659.db2.gz WCILNQZSIUWOFK-ZHRRBRCNSA-N 0 3 405.535 4.113 20 0 HIADHN C[C@@H](CC1CCOCC1)N[C@@H](c1ccc(F)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000468519560 882532232 /nfs/dbraw/zinc/53/22/32/882532232.db2.gz WCILNQZSIUWOFK-AOMKIAJQSA-N 0 3 405.535 4.113 20 0 HIADHN C[C@H](c1ccc(S(N)(=O)=O)cc1)N(C)Cc1ccc(Oc2cccc(F)c2)cc1 ZINC000447797842 871734200 /nfs/dbraw/zinc/73/42/00/871734200.db2.gz OHAANOBQMSFMNO-MRXNPFEDSA-N 0 3 414.502 4.458 20 0 HIADHN Brc1ccc(N2CC[C@@H](CNCc3nc(-c4ccccc4)c[nH]3)C2)cc1 ZINC000447841088 871763910 /nfs/dbraw/zinc/76/39/10/871763910.db2.gz WIPYQVPUJSGFJZ-INIZCTEOSA-N 0 3 411.347 4.455 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@H](C)NCc2nc(-c3ccccc3)c[nH]2)CC1 ZINC000447847233 871767257 /nfs/dbraw/zinc/76/72/57/871767257.db2.gz YZILJFFYTVSSKL-SFHVURJKSA-N 0 3 407.537 4.209 20 0 HIADHN Cc1nn(C)c(CNCC2(c3ccccc3Br)CC2)c1Br ZINC000447928131 871816137 /nfs/dbraw/zinc/81/61/37/871816137.db2.gz CXVGCTBGTTTWHO-UHFFFAOYSA-N 0 3 413.157 4.075 20 0 HIADHN CC(C)N(C)C(=O)c1ccc(Cl)c(NC(=O)NC[C@H]2N(C)CCCC2(C)C)c1 ZINC000447972348 871829359 /nfs/dbraw/zinc/82/93/59/871829359.db2.gz QDJDKDOWWVEDEH-GOSISDBHSA-N 0 3 408.974 4.062 20 0 HIADHN Cc1oc2ccccc2c1CNC(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000468530725 882551761 /nfs/dbraw/zinc/55/17/61/882551761.db2.gz ROFBFZLGZLKLHV-QZTJIDSGSA-N 0 3 413.562 4.162 20 0 HIADHN Clc1ccc(-c2nc3sccn3c2CN2CCC[C@@H]2CN2CCOCC2)cc1 ZINC000448033798 871869114 /nfs/dbraw/zinc/86/91/14/871869114.db2.gz DVPMOJFVAOXVHW-GOSISDBHSA-N 0 3 416.978 4.013 20 0 HIADHN CC(C)c1ncc(C(=O)N(CCN(C)C)Cc2ccc(Br)cc2)s1 ZINC000448155754 872033162 /nfs/dbraw/zinc/03/31/62/872033162.db2.gz FGLJPVLZABUQGB-UHFFFAOYSA-N 0 3 410.381 4.233 20 0 HIADHN CC(C)c1ncc(C(=O)NC2CCN(CCOc3ccc(Cl)cc3)CC2)s1 ZINC000448249978 872167536 /nfs/dbraw/zinc/16/75/36/872167536.db2.gz ZCSKLXDCTGBHIJ-UHFFFAOYSA-N 0 3 407.967 4.193 20 0 HIADHN CCN(CC)CCN(C(=O)[C@@H]1CCC(=O)c2cccn21)c1cccc(C(F)(F)F)c1 ZINC000448340426 872283291 /nfs/dbraw/zinc/28/32/91/872283291.db2.gz BUZRKHAXKAGKGR-IBGZPJMESA-N 0 3 421.463 4.400 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)N(C)[C@H](C)c3c(F)cccc3F)CC2)c1 ZINC000468552347 882598317 /nfs/dbraw/zinc/59/83/17/882598317.db2.gz GXHDOKTZPFGDSY-GOSISDBHSA-N 0 3 401.501 4.005 20 0 HIADHN O=C(C[C@@H]1CCCN1C(=O)C1CCN(Cc2ccccc2)CC1)c1ccc(F)cc1 ZINC000448440487 872384161 /nfs/dbraw/zinc/38/41/61/872384161.db2.gz RPHJRSKKSHOXPC-QHCPKHFHSA-N 0 3 408.517 4.302 20 0 HIADHN CCN(C(=O)Nc1ccccc1-n1ccc(C)n1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000460127597 872604182 /nfs/dbraw/zinc/60/41/82/872604182.db2.gz MXAGRQXGDVZJIK-OAQYLSRUSA-N 0 3 403.530 4.309 20 0 HIADHN CCN(C(=O)Nc1cccc(N2CCCCC2=O)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000460129591 872611498 /nfs/dbraw/zinc/61/14/98/872611498.db2.gz QYRFRLAEZTVAMO-HSZRJFAPSA-N 0 3 420.557 4.332 20 0 HIADHN CCCN(CCN1CCN(CC)CC1)C(=O)NCc1cccc(Oc2ccccc2)c1 ZINC000460130877 872615488 /nfs/dbraw/zinc/61/54/88/872615488.db2.gz AQGBLGGFPCYADE-UHFFFAOYSA-N 0 3 424.589 4.038 20 0 HIADHN CCCN(CCN1CCN(CC)CC1)C(=O)N[C@@H](C)c1ccc(SC(C)C)cc1 ZINC000460254253 872843527 /nfs/dbraw/zinc/84/35/27/872843527.db2.gz DDIGGBVHMFPOQQ-FQEVSTJZSA-N 0 3 420.667 4.307 20 0 HIADHN CCCN(CCN1CCN(CC)CC1)C(=O)N[C@H](c1ccc(Cl)cc1)C1CCC1 ZINC000460268494 872857878 /nfs/dbraw/zinc/85/78/78/872857878.db2.gz IFBZLLZKCUINRH-QFIPXVFZSA-N 0 3 421.029 4.240 20 0 HIADHN CN1CCC(N(Cc2ccccc2Br)C(=O)N[C@H]2CC=CCC2)CC1 ZINC000460327939 872927968 /nfs/dbraw/zinc/92/79/68/872927968.db2.gz NNRXWXJBXXDPBQ-KRWDZBQOSA-N 0 3 406.368 4.164 20 0 HIADHN CCCN(CCN1CCN(CC)CC1)C(=O)N[C@@H](c1cccc(F)c1)C1CCCC1 ZINC000460504208 873190182 /nfs/dbraw/zinc/19/01/82/873190182.db2.gz NMGZYQCBBZXNPK-HSZRJFAPSA-N 0 3 418.601 4.116 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)[C@@H](C)c3cccc(Cl)c3)CC2)c1 ZINC000460718911 873517753 /nfs/dbraw/zinc/51/77/53/873517753.db2.gz SYWXJVZXIQAUKH-FQEVSTJZSA-N 0 3 413.993 4.471 20 0 HIADHN CC[C@@H](C(=O)Nc1ccc(C(=O)N(C)[C@@H]2CCCN(C)C2)cc1)c1ccc(F)cc1 ZINC000461010529 873883750 /nfs/dbraw/zinc/88/37/50/873883750.db2.gz ZGKIHSOOVGDXGJ-FGZHOGPDSA-N 0 3 411.521 4.124 20 0 HIADHN CC[C@H](C)c1nnc(N2C[C@H](C)N(Cc3ccccc3)C[C@@H]2C)n1C[C@H]1CCCO1 ZINC000461073163 873969578 /nfs/dbraw/zinc/96/95/78/873969578.db2.gz ZQUFEGWWIAIIKF-BPBCIEFSSA-N 0 3 411.594 4.070 20 0 HIADHN CC(C)c1ccc2c(c1)[C@@H](NCc1ccc(N3CCCS3(=O)=O)cc1)CCCO2 ZINC000461085492 873997608 /nfs/dbraw/zinc/99/76/08/873997608.db2.gz OTFORTNZHNINEH-QFIPXVFZSA-N 0 3 414.571 4.353 20 0 HIADHN CC[C@@H](NCc1ccc(N2CCCS2(=O)=O)cc1)c1ccccc1OC(F)F ZINC000461095231 874011947 /nfs/dbraw/zinc/01/19/47/874011947.db2.gz OPZUCBJHXNZLMU-GOSISDBHSA-N 0 3 410.486 4.069 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)c1ccc(-c2cc(F)c(F)c(F)c2)cc1 ZINC000461115613 874040139 /nfs/dbraw/zinc/04/01/39/874040139.db2.gz XKHLAISROCEBDH-UHFFFAOYSA-N 0 3 413.443 4.370 20 0 HIADHN CCOc1ccc(CN(C(=O)CCN2CCN(c3ccccc3)CC2)C(C)C)cc1 ZINC000468676289 882805118 /nfs/dbraw/zinc/80/51/18/882805118.db2.gz JQWWYJNPHUXUKG-UHFFFAOYSA-N 0 3 409.574 4.035 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)c1cc(-c2ccccc2)ns1 ZINC000468709160 882824117 /nfs/dbraw/zinc/82/41/17/882824117.db2.gz IKJMHWPMHBIUDJ-UHFFFAOYSA-N 0 3 401.482 4.292 20 0 HIADHN C[C@H](C(=O)N1CC[C@H](COCc2ccccc2)C1)N1CCC(Cc2ccccc2)CC1 ZINC000461372549 874376999 /nfs/dbraw/zinc/37/69/99/874376999.db2.gz CKRJCDPLVIQUBN-GJZUVCINSA-N 0 3 420.597 4.395 20 0 HIADHN O=C(Nc1ccc2nc([C@H]3CCCO3)[nH]c2c1)[C@@H]1CCCCN1Cc1ccccc1 ZINC000468706950 882823256 /nfs/dbraw/zinc/82/32/56/882823256.db2.gz NTAXPZCKYUEZSA-FCHUYYIVSA-N 0 3 404.514 4.408 20 0 HIADHN O=S1(=O)CCCN1c1ccc(CNCc2ccc(OCc3ccccc3)cc2)cc1 ZINC000461415778 874433409 /nfs/dbraw/zinc/43/34/09/874433409.db2.gz YMYQNAKSBCTHPC-UHFFFAOYSA-N 0 3 422.550 4.095 20 0 HIADHN Cc1cccnc1C(C)(C)CNC(=O)NC[C@@H](c1ccc(OC(C)C)cc1)N(C)C ZINC000461416912 874436575 /nfs/dbraw/zinc/43/65/75/874436575.db2.gz IKRRARMXIPCYNJ-NRFANRHFSA-N 0 3 412.578 4.057 20 0 HIADHN COCc1nc2n(n1)C[C@H](NCc1ccccc1Oc1ccc(F)cc1Cl)CC2 ZINC000461433764 874482805 /nfs/dbraw/zinc/48/28/05/874482805.db2.gz XAJBTTPCXSJXNO-MRXNPFEDSA-N 0 3 416.884 4.114 20 0 HIADHN O=C(Nc1cccc(Oc2cccnn2)c1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000461563586 874659012 /nfs/dbraw/zinc/65/90/12/874659012.db2.gz FHNQYBYMXYIIOV-SFHVURJKSA-N 0 3 406.461 4.259 20 0 HIADHN C[C@@H]1CCN(C)CCN1C(=O)N[C@H]1CCCc2c3cc(Br)ccc3[nH]c21 ZINC000461714660 874863714 /nfs/dbraw/zinc/86/37/14/874863714.db2.gz JDSBPQIPCDNBGL-ACJLOTCBSA-N 0 3 419.367 4.043 20 0 HIADHN CC(C)N(CCN(C)C)C(=O)N[C@H]1CCCc2c3cc(Br)ccc3[nH]c21 ZINC000461733817 874879598 /nfs/dbraw/zinc/87/95/98/874879598.db2.gz YQJSDSPWWYYPSW-SFHVURJKSA-N 0 3 421.383 4.289 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)Nc3cccc(-c4nccs4)c3)CC2)c1 ZINC000461874629 875027329 /nfs/dbraw/zinc/02/73/29/875027329.db2.gz AGTNKWIAQWEJPI-UHFFFAOYSA-N 0 3 406.555 4.269 20 0 HIADHN Cc1c([C@@H](C)NC[C@@H](O)COc2cccc(Cl)c2Cl)cnn1C(C)(C)C ZINC000468847428 882888086 /nfs/dbraw/zinc/88/80/86/882888086.db2.gz GBTBZLSPNZWHCN-TZMCWYRMSA-N 0 3 400.350 4.344 20 0 HIADHN Cc1ccc(C(=O)N2C[C@H](C)C[C@@H](C)C2)cc1NC(=O)c1cccc(CN(C)C)c1 ZINC000461883747 875035090 /nfs/dbraw/zinc/03/50/90/875035090.db2.gz OHOCSXSMLDJXSC-QZTJIDSGSA-N 0 3 407.558 4.427 20 0 HIADHN Cc1csc(C(=O)Nc2cc(CN(C)C)ccc2C)c1I ZINC000469325969 883433249 /nfs/dbraw/zinc/43/32/49/883433249.db2.gz QOLIAXNPFPHCRH-UHFFFAOYSA-N 0 3 414.312 4.283 20 0 HIADHN C[C@@H](CNC(=O)N[C@@H]1CCCc2cn(C3CCCC3)nc21)N(C)Cc1ccccc1 ZINC000461957789 875085903 /nfs/dbraw/zinc/08/59/03/875085903.db2.gz PSFGJEYXPGOVHH-PGRDOPGGSA-N 0 3 409.578 4.195 20 0 HIADHN O=C(NC[C@H]1CCCN1Cc1ccccc1)N[C@H]1CCCc2cn(C3CCCC3)nc21 ZINC000461996661 875117310 /nfs/dbraw/zinc/11/73/10/875117310.db2.gz QYKPFRGNRGTUPP-PKTZIBPZSA-N 0 3 421.589 4.339 20 0 HIADHN CN(C)Cc1cccc(C(=O)Nc2cc(-c3nnc4n3CCCCC4)ccc2F)c1 ZINC000461996754 875117370 /nfs/dbraw/zinc/11/73/70/875117370.db2.gz VSJRDENWLDVYJE-UHFFFAOYSA-N 0 3 407.493 4.125 20 0 HIADHN O=C(CCN1CCN(c2ccccc2)CC1)N1CCC(c2c[nH]c3ccccc32)CC1 ZINC000462028729 875143903 /nfs/dbraw/zinc/14/39/03/875143903.db2.gz FOIUHSXHCPYPIR-UHFFFAOYSA-N 0 3 416.569 4.086 20 0 HIADHN CCOc1ccc([C@@H]2CCCN2C(=O)CCN2CCN(c3cccc(C)c3)CC2)cc1 ZINC000462045213 875158674 /nfs/dbraw/zinc/15/86/74/875158674.db2.gz BNTSXQRGPDMJFI-VWLOTQADSA-N 0 3 421.585 4.270 20 0 HIADHN O=S(=O)(NCC1CCN(Cc2cccs2)CC1)c1ccc(C(F)(F)F)s1 ZINC000462100865 875210489 /nfs/dbraw/zinc/21/04/89/875210489.db2.gz JITSLVCMKNNWBN-UHFFFAOYSA-N 0 3 424.535 4.019 20 0 HIADHN CC(C)c1noc(-c2ccccc2C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)n1 ZINC000462161468 875257001 /nfs/dbraw/zinc/25/70/01/875257001.db2.gz DQMSPDXXROVLFQ-LAUBAEHRSA-N 0 3 404.514 4.110 20 0 HIADHN CC(C)c1noc(-c2ccccc2C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)n1 ZINC000462161467 875257604 /nfs/dbraw/zinc/25/76/04/875257604.db2.gz DQMSPDXXROVLFQ-DYESRHJHSA-N 0 3 404.514 4.110 20 0 HIADHN C[C@H](NC(=O)N(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1)c1ccc(C(F)(F)F)cc1 ZINC000462165401 875261520 /nfs/dbraw/zinc/26/15/20/875261520.db2.gz PZUFJMOMKBRQOQ-QSFXBCCZSA-N 0 3 420.479 4.496 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Cc1csc(Cc2ccc(F)cc2)n1 ZINC000462165144 875262022 /nfs/dbraw/zinc/26/20/22/875262022.db2.gz ACYCFYDSMQLLQH-VGOFRKELSA-N 0 3 423.557 4.052 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1cccc(NC(=O)c2cccs2)c1 ZINC000462187429 875291146 /nfs/dbraw/zinc/29/11/46/875291146.db2.gz IHPNUXKBEDYDPA-LAUBAEHRSA-N 0 3 419.550 4.251 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Cc1csc(-c2cccc(F)c2)n1 ZINC000462194567 875302375 /nfs/dbraw/zinc/30/23/75/875302375.db2.gz IRCKJSNFQPOQCS-HRAATJIYSA-N 0 3 409.530 4.128 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C1(c2ccc(Cl)cc2)CCOCC1 ZINC000462195775 875304478 /nfs/dbraw/zinc/30/44/78/875304478.db2.gz MQGYETCWVSPWQX-GCJKJVERSA-N 0 3 412.961 4.025 20 0 HIADHN C[C@H](CC(=O)N(CCN(C)C)Cc1ccco1)c1ccc(F)c(Br)c1 ZINC000462212473 875320038 /nfs/dbraw/zinc/32/00/38/875320038.db2.gz JMMRNSFOYZLEAW-CQSZACIVSA-N 0 3 411.315 4.265 20 0 HIADHN O=C1NC2(CCCC2)C(=O)N1CCN[C@H](c1ccccc1)c1cccc2ccccc21 ZINC000462237077 875349727 /nfs/dbraw/zinc/34/97/27/875349727.db2.gz JEFKUJRNEDSALV-HSZRJFAPSA-N 0 3 413.521 4.383 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Nc1cccc(OCc2cccnc2)c1 ZINC000462241604 875356956 /nfs/dbraw/zinc/35/69/56/875356956.db2.gz AIRVYAZBNJIQTL-NTKDMRAZSA-N 0 3 416.525 4.303 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)Nc1cccc(OCc2cscn2)c1 ZINC000462252253 875373420 /nfs/dbraw/zinc/37/34/20/875373420.db2.gz ATJSGUUUKSMMMG-JTSKRJEESA-N 0 3 422.554 4.364 20 0 HIADHN CC(C)(C)c1ccccc1S(=O)(=O)NCC1CCN(Cc2cccs2)CC1 ZINC000462252232 875374352 /nfs/dbraw/zinc/37/43/52/875374352.db2.gz AKDJFZITAJOIMQ-UHFFFAOYSA-N 0 3 406.617 4.236 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)c(C)c1 ZINC000462258472 875381252 /nfs/dbraw/zinc/38/12/52/875381252.db2.gz LMSATGLMCQKPIW-YDHSSHFGSA-N 0 3 422.573 4.165 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Nc1ccc(C(=O)NC2CCCC2)cc1 ZINC000462263227 875389353 /nfs/dbraw/zinc/38/93/53/875389353.db2.gz NUUCDCYMSHMRIB-FDDCHVKYSA-N 0 3 420.557 4.001 20 0 HIADHN CCCN1c2ccc(NC(=O)N[C@@H]3CN(Cc4ccccc4)C[C@H]3C)cc2CCC1=O ZINC000462287327 875411438 /nfs/dbraw/zinc/41/14/38/875411438.db2.gz CVNDGHPVHGPQDZ-XMSQKQJNSA-N 0 3 420.557 4.018 20 0 HIADHN CC(C)(CNC(=O)N[C@@H]1CCO[C@H](c2ccccc2)C1)N1CCc2ccccc2C1 ZINC000462299969 875421574 /nfs/dbraw/zinc/42/15/74/875421574.db2.gz UZAWGGPOAPSELU-PKTZIBPZSA-N 0 3 407.558 4.043 20 0 HIADHN CCN1CC[C@@H](N(C)S(=O)(=O)c2ccc3nc(C(C)(C)C)sc3c2)C[C@H]1C ZINC000462334379 875450970 /nfs/dbraw/zinc/45/09/70/875450970.db2.gz JMCOTVCNDRWMPN-HUUCEWRRSA-N 0 3 409.621 4.087 20 0 HIADHN Cc1cc(S(=O)(=O)N(C)[C@H]2CCN(Cc3ccccc3)[C@H](C)C2)cc(C)c1F ZINC000462339478 875454105 /nfs/dbraw/zinc/45/41/05/875454105.db2.gz IAMXRZUQTMZOBX-QUCCMNQESA-N 0 3 404.551 4.116 20 0 HIADHN C[C@H]1CN(C)CC[C@@H]1N(C)S(=O)(=O)c1ccc(Oc2ccccc2Cl)cc1 ZINC000462358385 875471720 /nfs/dbraw/zinc/47/17/20/875471720.db2.gz LKQDWBAKUBUVBR-KXBFYZLASA-N 0 3 408.951 4.093 20 0 HIADHN CC[C@@H](NCc1cccc(N2CCCS2(=O)=O)c1)c1ccc(Br)cc1 ZINC000462360038 875473188 /nfs/dbraw/zinc/47/31/88/875473188.db2.gz OHMHINDBFCEQKT-LJQANCHMSA-N 0 3 423.376 4.230 20 0 HIADHN CC(C)[C@@H](C)N1Cc2cccc(NS(=O)(=O)c3ccccc3Cn3ccnc3)c2C1 ZINC000462363477 875476836 /nfs/dbraw/zinc/47/68/36/875476836.db2.gz DMCJFBRNZOJWPD-GOSISDBHSA-N 0 3 424.570 4.092 20 0 HIADHN CCN(CC)[C@H](CNc1ncccc1C(=O)N1CCc2ccccc21)c1ccco1 ZINC000462379832 875491408 /nfs/dbraw/zinc/49/14/08/875491408.db2.gz YUSCSZIMDILUCR-OAQYLSRUSA-N 0 3 404.514 4.373 20 0 HIADHN Cc1cccc2c1ncc(C)c2N1CCN(CC(=O)Nc2c(C)cccc2C)CC1 ZINC000462441996 875547747 /nfs/dbraw/zinc/54/77/47/875547747.db2.gz QQFVPSVXYSVRLW-UHFFFAOYSA-N 0 3 402.542 4.229 20 0 HIADHN C[C@@H](NCC(=O)Nc1ccc(C(=O)N(C)C)cc1)c1ccc(Cl)c2ccccc21 ZINC000462453487 875560998 /nfs/dbraw/zinc/56/09/98/875560998.db2.gz UQNIFYUFMCFQRU-OAHLLOKOSA-N 0 3 409.917 4.484 20 0 HIADHN CCCN(C(=O)NCc1ccc2cc[nH]c2n1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000462526135 875642260 /nfs/dbraw/zinc/64/22/60/875642260.db2.gz LTWZZBKKQKZBOJ-QFIPXVFZSA-N 0 3 405.546 4.149 20 0 HIADHN OC[C@@H](CNCc1sccc1Br)Cc1ccc(C(F)(F)F)cc1 ZINC000462537081 875658051 /nfs/dbraw/zinc/65/80/51/875658051.db2.gz UFTFUSBJOVWJGZ-GFCCVEGCSA-N 0 3 408.283 4.470 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)Cc1csc(-c2cccnc2)n1 ZINC000468900673 882952810 /nfs/dbraw/zinc/95/28/10/882952810.db2.gz HVLOZHSORRBIMZ-NRFANRHFSA-N 0 3 408.571 4.020 20 0 HIADHN FC(F)c1ccc(CNCc2ccc(OCCN3CCOCC3)c(Cl)c2)cc1 ZINC000462659979 875764331 /nfs/dbraw/zinc/76/43/31/875764331.db2.gz STYXKRNVIJDWIK-UHFFFAOYSA-N 0 3 410.892 4.278 20 0 HIADHN CCN1CCN(c2ccc(NCc3cc4c(cc3OC(F)F)OCO4)c(C)c2)CC1 ZINC000462679922 875774910 /nfs/dbraw/zinc/77/49/10/875774910.db2.gz LWGFJFKUQQOKRJ-UHFFFAOYSA-N 0 3 419.472 4.079 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)Nc1c(F)cc(Br)cc1F ZINC000462684747 875778398 /nfs/dbraw/zinc/77/83/98/875778398.db2.gz UOFDFPWYVFGGMN-SJCJKPOMSA-N 0 3 424.289 4.369 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Nc1c(F)cc(Br)cc1F ZINC000462684751 875778490 /nfs/dbraw/zinc/77/84/90/875778490.db2.gz UOFDFPWYVFGGMN-SJKOYZFVSA-N 0 3 424.289 4.369 20 0 HIADHN COc1cccc(O[C@H](C)CNCc2cnn(-c3ccc(Br)cc3)c2)c1 ZINC000462734936 875808864 /nfs/dbraw/zinc/80/88/64/875808864.db2.gz CGOBRQYLDFHVNF-OAHLLOKOSA-N 0 3 416.319 4.201 20 0 HIADHN FC(F)(F)c1ccnc(NCCNCc2ccc(Br)cc2Cl)n1 ZINC000462744625 875814236 /nfs/dbraw/zinc/81/42/36/875814236.db2.gz LUIIDBARARMOCF-UHFFFAOYSA-N 0 3 409.637 4.113 20 0 HIADHN CCc1cc(N2CCC[C@H](NCc3ccc(Br)cc3Cl)C2)ncn1 ZINC000462747096 875815249 /nfs/dbraw/zinc/81/52/49/875815249.db2.gz XLPZJFBIIMIILE-INIZCTEOSA-N 0 3 409.759 4.214 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)[C@@H]1CCn2c(cnc2C2CCCCC2)C1 ZINC000462804750 875851210 /nfs/dbraw/zinc/85/12/10/875851210.db2.gz CKPAMZIWXSWMNL-ZFJSRUIDSA-N 0 3 420.601 4.130 20 0 HIADHN CO[C@@](C)(CN[C@@H](c1cccc(S(C)(=O)=O)c1)c1ccc(C)cc1C)C1CC1 ZINC000462802921 875851281 /nfs/dbraw/zinc/85/12/81/875851281.db2.gz IQIQPEDBCQFYPN-GOTSBHOMSA-N 0 3 401.572 4.201 20 0 HIADHN COCCC[C@@H](NCc1c2c(nn1C)CCCC2)c1ccc(Br)cc1 ZINC000462813947 875856254 /nfs/dbraw/zinc/85/62/54/875856254.db2.gz BRYUWTIPGGFUAC-GOSISDBHSA-N 0 3 406.368 4.319 20 0 HIADHN CNc1cc(N2CCC[C@@H]2CN[C@H](C)c2csc(-c3ccccc3F)n2)ncn1 ZINC000462817195 875858612 /nfs/dbraw/zinc/85/86/12/875858612.db2.gz NBICUBOAFPLIGE-HUUCEWRRSA-N 0 3 412.538 4.101 20 0 HIADHN Cn1nc2c(c1CN[C@@H](c1cccc(Br)c1)C1CCOCC1)CCCC2 ZINC000462818887 875858907 /nfs/dbraw/zinc/85/89/07/875858907.db2.gz LDTCHTATSYZILM-OAQYLSRUSA-N 0 3 418.379 4.319 20 0 HIADHN C[C@@H](NCc1cccc(N2CCCS2(=O)=O)c1)c1cccc(-c2ccncc2)c1 ZINC000462847299 875881727 /nfs/dbraw/zinc/88/17/27/875881727.db2.gz FOZIMJKXSNYZHW-GOSISDBHSA-N 0 3 407.539 4.139 20 0 HIADHN Cc1cccc([C@H](NC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)c2ccccn2)c1 ZINC000463023738 876042612 /nfs/dbraw/zinc/04/26/12/876042612.db2.gz YYQZINWKZCBSIH-AMDXRBSFSA-N 0 3 414.553 4.299 20 0 HIADHN COc1cc(CN2CCC[C@@](CO)(Cc3ccccc3)C2)c(SC)cc1OC ZINC000463026067 876046048 /nfs/dbraw/zinc/04/60/48/876046048.db2.gz VGZSBVOFOYTCRV-HSZRJFAPSA-N 0 3 401.572 4.243 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)c3cccc(-c4cscn4)c3)cc2)CC1 ZINC000463104796 876141667 /nfs/dbraw/zinc/14/16/67/876141667.db2.gz CRFKAAHJTNGOIN-UHFFFAOYSA-N 0 3 406.555 4.200 20 0 HIADHN C[C@@H](c1ccsc1)N1CCN(C(=O)NC[C@H](c2cccs2)N2CCCC2)CC1 ZINC000463158133 876210848 /nfs/dbraw/zinc/21/08/48/876210848.db2.gz CJIZBDAKHXLHTM-PKOBYXMFSA-N 0 3 418.632 4.035 20 0 HIADHN COc1ccc(CN2CCCC[C@@H]2[C@H]2CCCC[C@@H]2O)c(Br)c1OC ZINC000463197110 876255475 /nfs/dbraw/zinc/25/54/75/876255475.db2.gz OKGQJGFZMLIXSJ-ZACQAIPSSA-N 0 3 412.368 4.372 20 0 HIADHN COCC1(CN2CCC[C@H]2c2nc(-c3ccccc3Br)no2)CCC1 ZINC000463196779 876257007 /nfs/dbraw/zinc/25/70/07/876257007.db2.gz FNHJKWVCLAUEMA-INIZCTEOSA-N 0 3 406.324 4.453 20 0 HIADHN C[C@@H]1CC[C@H](O)[C@@H]([C@H]2CCCCN2Cc2nc(-c3cc(F)c(F)c(F)c3)no2)C1 ZINC000463198832 876258436 /nfs/dbraw/zinc/25/84/36/876258436.db2.gz FPATXOSJFVKJNP-FOZNTRSISA-N 0 3 409.452 4.306 20 0 HIADHN Cc1nc2c(n1[C@H]1CCN(Cc3nc4ccc(Br)cc4o3)C1)CCCC2 ZINC000463199887 876261151 /nfs/dbraw/zinc/26/11/51/876261151.db2.gz ZYBMZQPSNSOSPT-HNNXBMFYSA-N 0 3 415.335 4.421 20 0 HIADHN CCOc1ccccc1[C@H](CC)NC(=O)CN1CCCC[C@@H]1[C@H]1CCCC[C@H]1O ZINC000463213768 876273709 /nfs/dbraw/zinc/27/37/09/876273709.db2.gz NXVSXWYCHWEZIN-CIAFKFPVSA-N 0 3 402.579 4.058 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N(Cc1ccccc1)CC1CCOCC1 ZINC000463259809 876317697 /nfs/dbraw/zinc/31/76/97/876317697.db2.gz FHHANHCYYTYEOH-BWKNWUBXSA-N 0 3 421.585 4.145 20 0 HIADHN Nc1c(Br)cc(Br)cc1CNCCOC1CCCCC1 ZINC000463282578 876339925 /nfs/dbraw/zinc/33/99/25/876339925.db2.gz LARHSPYQCHSXGJ-UHFFFAOYSA-N 0 3 406.162 4.233 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)[C@H](C)CC(=O)c3ccccc3F)c(C)c2)CC1 ZINC000463327949 876384211 /nfs/dbraw/zinc/38/42/11/876384211.db2.gz QVVBOYUTXSPANF-GOSISDBHSA-N 0 3 411.521 4.124 20 0 HIADHN CCN(CC(=O)N(Cc1nnc(-c2ccccc2Cl)o1)C1CC1)CC(C)(C)C ZINC000463362236 876416226 /nfs/dbraw/zinc/41/62/26/876416226.db2.gz SVBGKAPZXGOABU-UHFFFAOYSA-N 0 3 404.942 4.249 20 0 HIADHN Cc1cc(CCNC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)ccc1Cl ZINC000463413045 876466885 /nfs/dbraw/zinc/46/68/85/876466885.db2.gz JGILPMVQSMHEEX-UHFFFAOYSA-N 0 3 417.903 4.295 20 0 HIADHN COc1ccc([C@H](CNC(=O)[C@@H]2C[C@@H]2c2cc(F)c(F)c(F)c2)N2CCCC2)cc1 ZINC000463500327 876560566 /nfs/dbraw/zinc/56/05/66/876560566.db2.gz OKWNMQWSKMENDL-OPYAIIAOSA-N 0 3 418.459 4.169 20 0 HIADHN COc1ccc([C@H](CNC(=O)[C@@H]2C[C@H]2c2cc(F)c(F)c(F)c2)N2CCCC2)cc1 ZINC000463500328 876561149 /nfs/dbraw/zinc/56/11/49/876561149.db2.gz OKWNMQWSKMENDL-UEXGIBASSA-N 0 3 418.459 4.169 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)[C@@H]3C[C@@H]3c3cc(F)c(F)c(F)c3)c(C)c2)CC1 ZINC000463516186 876581199 /nfs/dbraw/zinc/58/11/99/876581199.db2.gz VIDMLJXXZUXVMK-QZTJIDSGSA-N 0 3 417.475 4.296 20 0 HIADHN Cc1ncsc1-c1nc2ccccc2n1CC(=O)N(CCN(C)C)c1ccccc1 ZINC000463570489 876665935 /nfs/dbraw/zinc/66/59/35/876665935.db2.gz NZJJVHIYCQKJFY-UHFFFAOYSA-N 0 3 419.554 4.063 20 0 HIADHN Cc1nn(C)c(Sc2ccccc2)c1C(=O)N[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000463594254 876704917 /nfs/dbraw/zinc/70/49/17/876704917.db2.gz UGTGZSLXHSAEQP-QUCCMNQESA-N 0 3 420.582 4.445 20 0 HIADHN Cc1nn(C)c(Sc2ccccc2)c1C(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000463594253 876705057 /nfs/dbraw/zinc/70/50/57/876705057.db2.gz UGTGZSLXHSAEQP-ICSRJNTNSA-N 0 3 420.582 4.445 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)N[C@@H]1CCOc2c(F)ccc(F)c21 ZINC000463610682 876730376 /nfs/dbraw/zinc/73/03/76/876730376.db2.gz HTAAWLMEXQEGEI-OXJNMPFZSA-N 0 3 415.484 4.094 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2cccc(-c3ncc4n3CCCC4)c2)[C@H]1c1ccccc1 ZINC000463704398 876824067 /nfs/dbraw/zinc/82/40/67/876824067.db2.gz QGQCZIVJCBORLR-DHIUTWEWSA-N 0 3 415.541 4.453 20 0 HIADHN COc1ccc(Cn2nc(C)c(CNCc3ccc(Cn4ccnc4)cc3)c2C)cc1 ZINC000463728823 876849536 /nfs/dbraw/zinc/84/95/36/876849536.db2.gz BDKQQDJEZYCWOD-UHFFFAOYSA-N 0 3 415.541 4.091 20 0 HIADHN COc1ccc(Cn2nc(C)c(CNCc3ccccc3-c3cnn(C)c3)c2C)cc1 ZINC000463749764 876872581 /nfs/dbraw/zinc/87/25/81/876872581.db2.gz WKANLKUGBSHIBK-UHFFFAOYSA-N 0 3 415.541 4.247 20 0 HIADHN Cc1nn(C)c2cc(NC(=O)NC[C@@H](c3ccc(OC(C)C)cc3)N(C)C)ccc12 ZINC000463834858 876955959 /nfs/dbraw/zinc/95/59/59/876955959.db2.gz HQSVCGCFUAUUCN-QFIPXVFZSA-N 0 3 409.534 4.093 20 0 HIADHN Cc1cc(N2CC[C@H](N[C@H](CCCc3ccccc3)c3ccccc3)C2=O)n(C)n1 ZINC000463898736 877020484 /nfs/dbraw/zinc/02/04/84/877020484.db2.gz UEWLXYNCBZWMRG-PKTZIBPZSA-N 0 3 402.542 4.188 20 0 HIADHN O=C(NCCCN(Cc1ccccc1)Cc1ccccc1)[C@@H]1CCC(=O)c2cccn21 ZINC000469026832 883094748 /nfs/dbraw/zinc/09/47/48/883094748.db2.gz NMVXZZFSPGERNP-DEOSSOPVSA-N 0 3 415.537 4.214 20 0 HIADHN O=C1c2ccccc2C(=O)N1CCCCNCc1cc(Cl)ccc1Br ZINC000464051394 877193608 /nfs/dbraw/zinc/19/36/08/877193608.db2.gz NGCOEYKMMOVCMC-UHFFFAOYSA-N 0 3 421.722 4.269 20 0 HIADHN CC[C@@H](C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(OC)cc1 ZINC000464208027 877378958 /nfs/dbraw/zinc/37/89/58/877378958.db2.gz UEQGCFNHMSUTOI-FYYLOGMGSA-N 0 3 418.541 4.471 20 0 HIADHN Cc1nn(C(C)(C)C)cc1[C@@H](C)NC(=O)NCC(C)(C)N1CCc2ccccc2C1 ZINC000464363175 877560995 /nfs/dbraw/zinc/56/09/95/877560995.db2.gz SGLMGSABUQGVKP-QGZVFWFLSA-N 0 3 411.594 4.144 20 0 HIADHN COc1ccccc1S(=O)(=O)CCCN[C@H](C)c1ccc(C(F)(F)F)cc1 ZINC000464489255 877708565 /nfs/dbraw/zinc/70/85/65/877708565.db2.gz FLMDPSDSBNTILJ-CQSZACIVSA-N 0 3 401.450 4.229 20 0 HIADHN Cc1cccc(S(=O)(=O)CCCN[C@@H](C)c2ccc(OC(F)(F)F)cc2)c1 ZINC000464494671 877712917 /nfs/dbraw/zinc/71/29/17/877712917.db2.gz IDQLXZFDIOFWMS-HNNXBMFYSA-N 0 3 401.450 4.408 20 0 HIADHN CC(C)CN(C(=O)c1ccc(Br)c(Cl)c1F)C1CCN(C)CC1 ZINC000464578214 877801159 /nfs/dbraw/zinc/80/11/59/877801159.db2.gz MXGTZVZWXYSDAK-UHFFFAOYSA-N 0 3 405.739 4.434 20 0 HIADHN COCCCN(C(=O)c1cc(Br)cc2ccccc21)C1CCN(C)CC1 ZINC000464706346 877929388 /nfs/dbraw/zinc/92/93/88/877929388.db2.gz DJSZXVHWPBUGFT-UHFFFAOYSA-N 0 3 419.363 4.175 20 0 HIADHN COCCCN(C(=O)c1cc(C2CC2)nc2ccc(Cl)cc21)C1CCN(C)CC1 ZINC000464720565 877947386 /nfs/dbraw/zinc/94/73/86/877947386.db2.gz QRZXSDQRHZZCCH-UHFFFAOYSA-N 0 3 415.965 4.339 20 0 HIADHN COCCCN(C(=O)c1ccc(N2CCCc3ccccc32)cc1)C1CCN(C)CC1 ZINC000464724139 877955423 /nfs/dbraw/zinc/95/54/23/877955423.db2.gz QOVZIRDTTQGNOU-UHFFFAOYSA-N 0 3 421.585 4.344 20 0 HIADHN COCCCN(C(=O)c1cc2ccccc2cc1OC(F)F)C1CCN(C)CC1 ZINC000464725392 877958028 /nfs/dbraw/zinc/95/80/28/877958028.db2.gz XHGQZOGHLSHYSX-UHFFFAOYSA-N 0 3 406.473 4.014 20 0 HIADHN CCCN(CC(F)(F)F)C(=O)[C@H]1CCCN(CCSc2ccccc2F)C1 ZINC000464727730 877962203 /nfs/dbraw/zinc/96/22/03/877962203.db2.gz CXEZWKCZBIXBPA-HNNXBMFYSA-N 0 3 406.489 4.431 20 0 HIADHN COc1cc(C(C)=O)ccc1OC[C@H](O)CN1CCCC[C@H]1c1cccc(C)c1C ZINC000464778469 878021814 /nfs/dbraw/zinc/02/18/14/878021814.db2.gz ONIMNPGIJORISW-GGAORHGYSA-N 0 3 411.542 4.482 20 0 HIADHN CCc1ccc(-c2noc(CN(CC)CC3CCN(c4ccccn4)CC3)n2)cc1 ZINC000464807999 878057215 /nfs/dbraw/zinc/05/72/15/878057215.db2.gz VEGCDHKOTXVFIP-UHFFFAOYSA-N 0 3 405.546 4.433 20 0 HIADHN CN1CCC(Oc2ccc(NC(=O)c3cccc(Br)c3Cl)cn2)CC1 ZINC000503332100 912309739 /nfs/dbraw/zinc/30/97/39/912309739.db2.gz JPTOZDORURREDQ-UHFFFAOYSA-N 0 3 424.726 4.223 20 0 HIADHN CC[C@H](C)NC(=O)[C@@H]1C[C@H](C)N(Cc2cnn(C)c2C(F)(F)F)[C@@H]2CCCC[C@H]12 ZINC000464868216 878152960 /nfs/dbraw/zinc/15/29/60/878152960.db2.gz XZNUCEIQUKVOSL-WSWKGWCUSA-N 0 3 414.516 4.123 20 0 HIADHN Cc1cc(Br)ccc1C(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC000464897143 878204074 /nfs/dbraw/zinc/20/40/74/878204074.db2.gz SFMQPURFQCSCKB-QGZVFWFLSA-N 0 3 401.348 4.494 20 0 HIADHN COc1cc(C(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)ccc1OCC(C)C ZINC000464898673 878205558 /nfs/dbraw/zinc/20/55/58/878205558.db2.gz YZKHHDMQDDOBAI-FQEVSTJZSA-N 0 3 410.558 4.467 20 0 HIADHN Cc1cc(C(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)c2c(n1)onc2C(C)C ZINC000464906537 878221603 /nfs/dbraw/zinc/22/16/03/878221603.db2.gz WAZSLFCPLBJYJQ-GOSISDBHSA-N 0 3 406.530 4.391 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCc3cc(F)ccc3SC)c(C)c2)CC1 ZINC000465070553 878430594 /nfs/dbraw/zinc/43/05/94/878430594.db2.gz YNNDPLQGCIOSEF-UHFFFAOYSA-N 0 3 416.566 4.320 20 0 HIADHN Cc1ccc([C@H](NC(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)c2ccccn2)cc1 ZINC000503372323 912352947 /nfs/dbraw/zinc/35/29/47/912352947.db2.gz JWIQCSBEAHIWRE-WDJPJFJCSA-N 0 3 402.542 4.470 20 0 HIADHN CCO[C@H](CC(=O)NC1CCN(CCOc2ccc(Cl)cc2)CC1)C1=CCCC1 ZINC000465134882 878516798 /nfs/dbraw/zinc/51/67/98/878516798.db2.gz YGYPHZWUTBVSME-JOCHJYFZSA-N 0 3 420.981 4.205 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)N[C@@H](c2ccc(C)cc2)c2ccccn2)cc1 ZINC000503374920 912356226 /nfs/dbraw/zinc/35/62/26/912356226.db2.gz VQDBWRQVMKNGOS-RPWUZVMVSA-N 0 3 418.541 4.090 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)N(Cc1ccc(F)cc1F)C1CC1 ZINC000503386914 912369999 /nfs/dbraw/zinc/36/99/99/912369999.db2.gz FLDSDEGVNUDKIN-UHFFFAOYSA-N 0 3 409.546 4.000 20 0 HIADHN CC(C)N(Cc1ccccc1)C(=O)[C@@H](C)N1CCC[C@@H](c2ncc3n2CCCC3)C1 ZINC000503388448 912371370 /nfs/dbraw/zinc/37/13/70/912371370.db2.gz CNJWJONJRDTMGY-IFMALSPDSA-N 0 3 408.590 4.225 20 0 HIADHN COc1ccccc1C[C@@H](C)N(C)C(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000465423564 878852628 /nfs/dbraw/zinc/85/26/28/878852628.db2.gz NHQILFASAHAICU-IEBWSBKVSA-N 0 3 401.576 4.166 20 0 HIADHN CC[C@@H](NC(=O)NC[C@H](c1cccs1)N1CCC(C)CC1)c1c(C)nn(C)c1C ZINC000465427553 878857914 /nfs/dbraw/zinc/85/79/14/878857914.db2.gz YJDLLAXZYSIFHC-RTBURBONSA-N 0 3 417.623 4.322 20 0 HIADHN C[C@H]1CCN(C(=O)N[C@H](c2ccccc2)c2ccccn2)CCN1Cc1ccccc1 ZINC000465429842 878861495 /nfs/dbraw/zinc/86/14/95/878861495.db2.gz GWXKWGRFGQZNTR-SQJMNOBHSA-N 0 3 414.553 4.477 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)N[C@@H](C)c2cccc(-n3cccn3)c2)N(C)C)cc1 ZINC000465431285 878863091 /nfs/dbraw/zinc/86/30/91/878863091.db2.gz IUFJTWCQTNAFGS-FDDCHVKYSA-N 0 3 405.546 4.098 20 0 HIADHN CCO[C@@H](C)c1nc(CN(C)C(=O)NC[C@@H](c2ccccc2)N2CCCC2)cs1 ZINC000465436605 878870140 /nfs/dbraw/zinc/87/01/40/878870140.db2.gz AVJORTVURWGPNP-PXNSSMCTSA-N 0 3 416.591 4.219 20 0 HIADHN CO[C@@H](CNC(=O)NC[C@H](c1cccs1)N1CCCC1)c1ccc(Cl)cc1 ZINC000465440029 878871726 /nfs/dbraw/zinc/87/17/26/878871726.db2.gz ZJRZFBLPOQQRID-MSOLQXFVSA-N 0 3 407.967 4.225 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCc1coc(-c2ccccc2)n1)c1cccc(OC)c1 ZINC000465479921 878919424 /nfs/dbraw/zinc/91/94/24/878919424.db2.gz NBNVDNOJBBXQKE-JOCHJYFZSA-N 0 3 422.529 4.233 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NC[C@H](OC)c1cccc(Cl)c1)c1ccsc1 ZINC000465532505 878989831 /nfs/dbraw/zinc/98/98/31/878989831.db2.gz FWGZSARFNVIDBF-MOPGFXCFSA-N 0 3 409.983 4.471 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CC[C@@H](COCc2ccccc2)C1)c1ccsc1 ZINC000465532876 878990298 /nfs/dbraw/zinc/99/02/98/878990298.db2.gz WBGROGDDXSCCIQ-IRLDBZIGSA-N 0 3 415.603 4.379 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)N1CC[C@@H](COCc2ccccc2)C1 ZINC000465533422 878990536 /nfs/dbraw/zinc/99/05/36/878990536.db2.gz XVTWTADOTDOYGC-ISKFKSNPSA-N 0 3 407.558 4.072 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CC[C@@H](COCc2ccccc2)C1)c1ccsc1 ZINC000465532875 878990742 /nfs/dbraw/zinc/99/07/42/878990742.db2.gz WBGROGDDXSCCIQ-IFMALSPDSA-N 0 3 415.603 4.379 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)N2CC[C@H](C)C[C@@H]2c2ccco2)CC1 ZINC000465553859 879020297 /nfs/dbraw/zinc/02/02/97/879020297.db2.gz WYSJEGIXLWZUHA-NZQKXSOJSA-N 0 3 424.589 4.100 20 0 HIADHN COc1ccc(OC)c([C@@H](C)NC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)c1 ZINC000465568097 879042460 /nfs/dbraw/zinc/04/24/60/879042460.db2.gz JHALTNIZOQDOJY-RTBURBONSA-N 0 3 411.546 4.071 20 0 HIADHN C[C@H](COc1ccc(F)cc1F)NC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC000465742900 879329132 /nfs/dbraw/zinc/32/91/32/879329132.db2.gz VFMHARCCHPDHIA-QZTJIDSGSA-N 0 3 417.500 4.038 20 0 HIADHN C[C@H](CNC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1)COCc1ccccc1 ZINC000465757844 879351478 /nfs/dbraw/zinc/35/14/78/879351478.db2.gz PWMPDRSCZKDJFC-YADHBBJMSA-N 0 3 409.574 4.145 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)NCc2ccc(C(=O)OC(C)(C)C)cc2)C1 ZINC000465759690 879356002 /nfs/dbraw/zinc/35/60/02/879356002.db2.gz POSRGKJTKJHYBP-GCJKJVERSA-N 0 3 423.557 4.277 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)NC[C@@H]2CCCO[C@H]2c2ccc(C)cc2)N(C)C)cc1 ZINC000465817523 879442160 /nfs/dbraw/zinc/44/21/60/879442160.db2.gz OWMCSELLPPDMPS-VXNXHJTFSA-N 0 3 409.574 4.373 20 0 HIADHN Cc1ccc([C@H](CNC(=O)NC[C@@H]2CCO[C@@H]2c2ccccc2)N2CCCC2)cc1 ZINC000465820274 879446688 /nfs/dbraw/zinc/44/66/88/879446688.db2.gz RNUIASLNAMAPGC-KMDXXIMOSA-N 0 3 407.558 4.209 20 0 HIADHN Cc1ccc(COc2ccc(C[C@H](C)NC(=O)N3CC[C@H](N4CC=CC4)C3)cc2)cc1 ZINC000465851391 879493730 /nfs/dbraw/zinc/49/37/30/879493730.db2.gz UPYABSATKHYZMZ-URXFXBBRSA-N 0 3 419.569 4.161 20 0 HIADHN CC(C)C[C@@H](NC(=O)N1CCN(CC2CCOCC2)CC1)c1ccc(Cl)cc1 ZINC000465966309 879634387 /nfs/dbraw/zinc/63/43/87/879634387.db2.gz HJVIVMBXUBQBIH-OAQYLSRUSA-N 0 3 407.986 4.181 20 0 HIADHN COc1ccc([C@@H](C)CCNC(=O)N(CCN(C)C)Cc2ccccc2F)cc1 ZINC000466037280 879727442 /nfs/dbraw/zinc/72/74/42/879727442.db2.gz POVZZKXEYWCUNG-SFHVURJKSA-N 0 3 401.526 4.101 20 0 HIADHN COc1ccccc1[C@@]1(C)C[C@H]1NC(=O)N(CCN(C)C)Cc1cccc(Cl)c1 ZINC000466047651 879736362 /nfs/dbraw/zinc/73/63/62/879736362.db2.gz GXAZRXJJEAIJMV-FYYLOGMGSA-N 0 3 415.965 4.152 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NC[C@@H]3CCO[C@@H]3c3ccccc3)c(C)c2)CC1 ZINC000466065791 879764472 /nfs/dbraw/zinc/76/44/72/879764472.db2.gz TZZCZZBZKCIFKU-XUZZJYLKSA-N 0 3 422.573 4.036 20 0 HIADHN COc1ccccc1[C@H](NC(=O)N1CC[C@@H](N2CC=CC2)C1)c1ccccc1Cl ZINC000466079087 879794226 /nfs/dbraw/zinc/79/42/26/879794226.db2.gz OSYRAZKKZXTNDY-VGOFRKELSA-N 0 3 411.933 4.094 20 0 HIADHN COc1ccccc1[C@H](NC(=O)N1CC[C@H](N2CC=CC2)C1)c1ccccc1Cl ZINC000466079085 879795516 /nfs/dbraw/zinc/79/55/16/879795516.db2.gz OSYRAZKKZXTNDY-HTAPYJJXSA-N 0 3 411.933 4.094 20 0 HIADHN CO[C@H](CNC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C)c1ccc(Cl)cc1 ZINC000466081052 879800130 /nfs/dbraw/zinc/80/01/30/879800130.db2.gz HMWUXHXDAGKUOA-PGRDOPGGSA-N 0 3 415.965 4.334 20 0 HIADHN CO[C@@H](CNC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1)c1ccc(Cl)cc1 ZINC000466092261 879810484 /nfs/dbraw/zinc/81/04/84/879810484.db2.gz NEJMIGBPEOQLRP-GCJKJVERSA-N 0 3 415.965 4.334 20 0 HIADHN Cc1cnc([C@H](NC(=O)N(CCCc2ccccc2)CCN(C)C)C2CC2)s1 ZINC000466113449 879826793 /nfs/dbraw/zinc/82/67/93/879826793.db2.gz BMSUYKJKQSDRLT-HXUWFJFHSA-N 0 3 400.592 4.109 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)N2CCCCC[C@H]2c2ccc(Cl)cc2)CC1 ZINC000466132030 879844139 /nfs/dbraw/zinc/84/41/39/879844139.db2.gz MYZQQOXHXJITOM-KNQAVFIVSA-N 0 3 421.029 4.240 20 0 HIADHN C[C@@H](CNC(=O)N(CCN(C)C)Cc1cccc(F)c1)Oc1ccccc1Cl ZINC000466167309 879869018 /nfs/dbraw/zinc/86/90/18/879869018.db2.gz OKDDKMMWAXCBSG-INIZCTEOSA-N 0 3 407.917 4.020 20 0 HIADHN COc1ccc(-c2cncc(C(=O)N3CCCN(Cc4ccccc4)C[C@H]3C)c2)cc1 ZINC000466238692 879945510 /nfs/dbraw/zinc/94/55/10/879945510.db2.gz RLZSBVGHKSKAKJ-HXUWFJFHSA-N 0 3 415.537 4.494 20 0 HIADHN COc1ccc(C(C)(C)C(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)cc1OC ZINC000466238593 879946733 /nfs/dbraw/zinc/94/67/33/879946733.db2.gz QTRJJMOJCAMOMB-LJQANCHMSA-N 0 3 410.558 4.104 20 0 HIADHN COc1ccc(-c2cncc(C(=O)N(C)[C@H]3CCCN(Cc4ccccc4)C3)c2)cc1 ZINC000466245108 879958952 /nfs/dbraw/zinc/95/89/52/879958952.db2.gz WPRUEISFKXSNED-DEOSSOPVSA-N 0 3 415.537 4.494 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)[C@@H]1CCO[C@H]1c1ccc(Cl)c(F)c1 ZINC000466330034 880082677 /nfs/dbraw/zinc/08/26/77/880082677.db2.gz DKMSGDZRNGADLF-OZPQRRJYSA-N 0 3 416.924 4.193 20 0 HIADHN CCC(CC)(CNC(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1)c1ccccc1 ZINC000466350593 880108183 /nfs/dbraw/zinc/10/81/83/880108183.db2.gz UPMVHZHRCAGLRR-NHCUHLMSSA-N 0 3 415.622 4.275 20 0 HIADHN C[C@H](CNC(=O)Nc1cccc(CN(C)C)c1)Oc1ccc(Br)cc1 ZINC000466375338 880134506 /nfs/dbraw/zinc/13/45/06/880134506.db2.gz ZLXWXJSCYDWGBO-CQSZACIVSA-N 0 3 406.324 4.100 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccc(O)cc1)C(=O)c1csc(C(C)(C)C)n1 ZINC000503489886 912536119 /nfs/dbraw/zinc/53/61/19/912536119.db2.gz QFURMMULHJTHTI-KRWDZBQOSA-N 0 3 401.576 4.273 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N[C@@H](c2ccccc2)c2cccnc2)N(C)C)cc1 ZINC000503500413 912547817 /nfs/dbraw/zinc/54/78/17/912547817.db2.gz YCGRLMABWGWNBH-ZEQRLZLVSA-N 0 3 402.542 4.336 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1C[C@@H](C)N(Cc2ccccc2)C1)c1nc(C(C)(C)C)cs1 ZINC000466505719 880280505 /nfs/dbraw/zinc/28/05/05/880280505.db2.gz QGZBHFIDFQFTQM-SOLBZPMBSA-N 0 3 400.592 4.464 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)cc1OC ZINC000466517006 880290660 /nfs/dbraw/zinc/29/06/60/880290660.db2.gz TYRFQJYAJIPLKZ-COPCDDAFSA-N 0 3 423.557 4.213 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)NCc2csc(-c3ccccc3)n2)CN1Cc1ccccc1 ZINC000466517225 880291550 /nfs/dbraw/zinc/29/15/50/880291550.db2.gz ISBFZBPCLXTJAM-YLJYHZDGSA-N 0 3 406.555 4.272 20 0 HIADHN CC(=O)Nc1ccc(Cl)c(NC(=O)N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)c1 ZINC000466516007 880291927 /nfs/dbraw/zinc/29/19/27/880291927.db2.gz DRHZQHNGWBSGAK-KSSFIOAISA-N 0 3 400.910 4.083 20 0 HIADHN C[C@H]1C[C@H](NC(=O)N2CCC(OCCc3ccccc3)CC2)CN1Cc1ccccc1 ZINC000466517888 880292898 /nfs/dbraw/zinc/29/28/98/880292898.db2.gz WZCVEQZNPWGVQL-URXFXBBRSA-N 0 3 421.585 4.083 20 0 HIADHN Cc1ccc(NC(=O)C2CC2)cc1NC(=O)N[C@@H]1C[C@@H](C)N(Cc2ccccc2)C1 ZINC000466518427 880295467 /nfs/dbraw/zinc/29/54/67/880295467.db2.gz ZABUGDXHRQSFCC-DYESRHJHSA-N 0 3 406.530 4.128 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)NC(=O)N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)cc1 ZINC000466541342 880315326 /nfs/dbraw/zinc/31/53/26/880315326.db2.gz QWWQBELENCXAOH-YDHSSHFGSA-N 0 3 417.557 4.204 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)Nc1cc(Cl)c(Cl)cn1 ZINC000466657964 880437125 /nfs/dbraw/zinc/43/71/25/880437125.db2.gz NSLBCUFBXZBQOD-UHFFFAOYSA-N 0 3 403.260 4.262 20 0 HIADHN CCc1c(NC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)cnn1-c1ccccc1 ZINC000466664765 880446518 /nfs/dbraw/zinc/44/65/18/880446518.db2.gz LYEFTZWTEZCQDE-XMSQKQJNSA-N 0 3 403.530 4.077 20 0 HIADHN C[C@@H](NC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1)c1cccc(-n2cccn2)c1 ZINC000466684592 880474654 /nfs/dbraw/zinc/47/46/54/880474654.db2.gz UARZLEPSKYUNRI-LEWJYISDSA-N 0 3 417.557 4.239 20 0 HIADHN CC1CCN([C@H](CNC(=O)NC[C@]2(C)CCO[C@@H]2C2CC2)c2cccs2)CC1 ZINC000466789474 880568835 /nfs/dbraw/zinc/56/88/35/880568835.db2.gz LNMTYGBXWJKGMT-UZKOGDIHSA-N 0 3 405.608 4.026 20 0 HIADHN CCN(C(=O)c1ccc(C(=O)NC(C)C)cc1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000503530930 912586077 /nfs/dbraw/zinc/58/60/77/912586077.db2.gz OUKGJCXTUDXKSD-AUSIDOKSSA-N 0 3 407.558 4.122 20 0 HIADHN CC[C@@H]1C[C@@H](C(=O)Nc2cccc(N3CCN(CCc4ccccc4)CC3)c2)CCO1 ZINC000503528919 912584338 /nfs/dbraw/zinc/58/43/38/912584338.db2.gz WVRMYIAAMLVOLX-WIOPSUGQSA-N 0 3 421.585 4.195 20 0 HIADHN O=C(CC1(N2CCOCC2)CCCC1)N1CCC(F)(c2cccc(Cl)c2)CC1 ZINC000466883482 880650653 /nfs/dbraw/zinc/65/06/53/880650653.db2.gz QJAMAVQHPLUKTI-UHFFFAOYSA-N 0 3 408.945 4.162 20 0 HIADHN Cc1ccc([C@H]2OCCC[C@@H]2CNC(=O)N2CCN(C3CCC(C)CC3)CC2)cc1 ZINC000466937728 880706638 /nfs/dbraw/zinc/70/66/38/880706638.db2.gz HVFZDQAAZQRJSG-RSHDMXJRSA-N 0 3 413.606 4.369 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)N[C@H](C)c2ccc(Br)cc2)cc1 ZINC000503538487 912599356 /nfs/dbraw/zinc/59/93/56/912599356.db2.gz YBXUUHHCZBRNDF-KUHUBIRLSA-N 0 3 420.351 4.121 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)NCc1ccc(-c2cccnc2)cc1 ZINC000466949957 880725408 /nfs/dbraw/zinc/72/54/08/880725408.db2.gz GJYBSEORFYTRQD-UHFFFAOYSA-N 0 3 416.569 4.455 20 0 HIADHN CC(C)c1ccc(C(=O)Nc2ccc3oc(=O)n(CCN(C)C)c3c2)cc1Cl ZINC000467001271 880810512 /nfs/dbraw/zinc/81/05/12/880810512.db2.gz FKHSPYNDPIQUIA-UHFFFAOYSA-N 0 3 401.894 4.185 20 0 HIADHN COCc1ccc([C@@H]2CCCN2CCc2nc3sc4c(c3c(N)n2)CCCC4)o1 ZINC000467019811 880821950 /nfs/dbraw/zinc/82/19/50/880821950.db2.gz DAGCGFXVJKZBEI-INIZCTEOSA-N 0 3 412.559 4.271 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)CSCc2coc(-c3ccccc3)n2)CN1Cc1ccccc1 ZINC000467021873 880823268 /nfs/dbraw/zinc/82/32/68/880823268.db2.gz GRUJTESFXKJCPQ-GHTZIAJQSA-N 0 3 421.566 4.354 20 0 HIADHN C[C@H](NC(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C)c1nc(C(F)(F)F)cs1 ZINC000503546106 912610740 /nfs/dbraw/zinc/61/07/40/912610740.db2.gz FAQTZLSEVBQOQS-SLEUVZQESA-N 0 3 400.470 4.214 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)C2(c3cccc(Cl)c3)CCOCC2)CN1Cc1ccccc1 ZINC000467029354 880828780 /nfs/dbraw/zinc/82/87/80/880828780.db2.gz SSFYPZISPXIIRZ-XMSQKQJNSA-N 0 3 412.961 4.167 20 0 HIADHN C[C@H](NC(=O)N1CCCN(Cc2ccccc2)CC1)c1nc(C2CCCCC2)no1 ZINC000467033878 880831876 /nfs/dbraw/zinc/83/18/76/880831876.db2.gz CLFIUTKUDOZMHP-SFHVURJKSA-N 0 3 411.550 4.096 20 0 HIADHN Cc1noc(CSc2ccc(C(=O)N[C@H]3C[C@@H](C)N(Cc4ccccc4)C3)cc2)n1 ZINC000467033732 880831926 /nfs/dbraw/zinc/83/19/26/880831926.db2.gz NIJKKTLEWYHXNP-UZLBHIALSA-N 0 3 422.554 4.063 20 0 HIADHN Cc1noc(CSc2ccc(C(=O)N[C@@H]3C[C@H](C)N(Cc4ccccc4)C3)cc2)n1 ZINC000467033726 880832004 /nfs/dbraw/zinc/83/20/04/880832004.db2.gz NIJKKTLEWYHXNP-OXJNMPFZSA-N 0 3 422.554 4.063 20 0 HIADHN C[C@@H](NC(=O)N(CCN(C)C)CC1CCCCC1)c1nc(C2CCCCC2)no1 ZINC000467045702 880839653 /nfs/dbraw/zinc/83/96/53/880839653.db2.gz MWLOSVLCNQIJSN-QGZVFWFLSA-N 0 3 405.587 4.332 20 0 HIADHN Cc1noc(CSc2ccccc2C(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)n1 ZINC000467046190 880840636 /nfs/dbraw/zinc/84/06/36/880840636.db2.gz NHPCQELJWSPCEO-QFBILLFUSA-N 0 3 422.554 4.063 20 0 HIADHN C[C@H]1C[C@H](NC(=O)CCc2nc(-c3ccc(Cl)cc3)no2)CN1Cc1ccccc1 ZINC000467053930 880844215 /nfs/dbraw/zinc/84/42/15/880844215.db2.gz NZTAOSOZLMXXSW-JXFKEZNVSA-N 0 3 424.932 4.102 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)c(C)c1 ZINC000467108460 880867771 /nfs/dbraw/zinc/86/77/71/880867771.db2.gz BVPUWUGUDRAURM-CNNODRBYSA-N 0 3 422.573 4.308 20 0 HIADHN COc1ccc(C(=O)Nc2ccc(C(=O)NCc3ccccc3CN(C)C)s2)cc1 ZINC000467114004 880873151 /nfs/dbraw/zinc/87/31/51/880873151.db2.gz JZSYALHDGGONEF-UHFFFAOYSA-N 0 3 423.538 4.001 20 0 HIADHN Cc1c(NC(=O)N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)cccc1C(=O)N1CCCC1 ZINC000467118359 880875509 /nfs/dbraw/zinc/87/55/09/880875509.db2.gz WKBMAUXDTJZGGN-NQIIRXRSSA-N 0 3 420.557 4.016 20 0 HIADHN C[C@H](NC(=O)N[C@@H](CN(C)C)c1ccc(F)cc1)c1ccc(Br)cc1 ZINC000503550482 912619102 /nfs/dbraw/zinc/61/91/02/912619102.db2.gz GHXMQSYUGRJBOI-UGSOOPFHSA-N 0 3 408.315 4.251 20 0 HIADHN CC(C)C[C@H]1CCN(CC(=O)N(Cc2nnc(-c3ccccc3Cl)o2)C2CC2)C1 ZINC000467173670 880901506 /nfs/dbraw/zinc/90/15/06/880901506.db2.gz BWEIYLNTMIOWPD-MRXNPFEDSA-N 0 3 416.953 4.249 20 0 HIADHN O=C(Nc1ccccc1)C1CCN(CCOc2ccc(OC(F)(F)F)cc2)CC1 ZINC000467190534 880917695 /nfs/dbraw/zinc/91/76/95/880917695.db2.gz JQZYZJYXDQHBMG-UHFFFAOYSA-N 0 3 408.420 4.315 20 0 HIADHN CCOc1cccc(CN(Cc2cccc(Br)c2)C2CCOCC2)n1 ZINC000467300967 881048276 /nfs/dbraw/zinc/04/82/76/881048276.db2.gz WUOCWRNLSJQBEY-UHFFFAOYSA-N 0 3 405.336 4.424 20 0 HIADHN CC(C)Cn1cc(CN(Cc2cccc(Br)c2)C2CCOCC2)cn1 ZINC000467350925 881108651 /nfs/dbraw/zinc/10/86/51/881108651.db2.gz WCESCNLXBHMCMI-UHFFFAOYSA-N 0 3 406.368 4.483 20 0 HIADHN Fc1cncc([C@H](NCc2nc(-c3ccc(Br)cc3)n[nH]2)C2CC2)c1 ZINC000467357469 881121394 /nfs/dbraw/zinc/12/13/94/881121394.db2.gz XKKPXLGWNOZUKK-QGZVFWFLSA-N 0 3 402.271 4.009 20 0 HIADHN O=C(c1cc(COc2c(Cl)cccc2Cl)on1)N1CC[C@@H](N2CCCCC2)C1 ZINC000467370552 881142418 /nfs/dbraw/zinc/14/24/18/881142418.db2.gz QEFACEMUIWJWKK-CQSZACIVSA-N 0 3 424.328 4.261 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2ccccc2CC(=O)OC(C)(C)C)N(C)C)cc1 ZINC000467407210 881192983 /nfs/dbraw/zinc/19/29/83/881192983.db2.gz RWUUVYQWOWBQOK-NRFANRHFSA-N 0 3 411.546 4.304 20 0 HIADHN CCc1noc(-c2ccc(C)c(NC(=O)N[C@H]3C[C@H](C)N(Cc4ccccc4)C3)c2)n1 ZINC000467458232 881266129 /nfs/dbraw/zinc/26/61/29/881266129.db2.gz FWYQNDFRPBFMOF-PXNSSMCTSA-N 0 3 419.529 4.392 20 0 HIADHN CC(C)Cn1ccc2c1cccc2C(=O)Nc1ccc2oc(=O)n(CCN(C)C)c2c1 ZINC000469063409 883139713 /nfs/dbraw/zinc/13/97/13/883139713.db2.gz SOGJBMBDTMXZQB-UHFFFAOYSA-N 0 3 420.513 4.019 20 0 HIADHN COc1ccc([C@H](N[C@H](C)Cn2cccn2)c2ccccc2)cc1Br ZINC000469063234 883140095 /nfs/dbraw/zinc/14/00/95/883140095.db2.gz UHXTZJSOLKVAGP-FOIQADDNSA-N 0 3 400.320 4.422 20 0 HIADHN COc1ccccc1NC(=O)C1CCN(Cc2ccc3c(c2)COC(C)(C)O3)CC1 ZINC000469131864 883228830 /nfs/dbraw/zinc/22/88/30/883228830.db2.gz VVBLLFGJLIWDSI-UHFFFAOYSA-N 0 3 410.514 4.191 20 0 HIADHN CCN1CCN(CCC(=O)N(Cc2c(OC)ccc3ccccc32)C2CCCC2)CC1 ZINC000469190652 883291806 /nfs/dbraw/zinc/29/18/06/883291806.db2.gz GJKLSOJYTCRSTR-UHFFFAOYSA-N 0 3 423.601 4.147 20 0 HIADHN CC(=O)Nc1cccc([C@H](C)NC(=O)N[C@H](CN(C)Cc2ccccc2)C(C)C)c1 ZINC000469420330 883596110 /nfs/dbraw/zinc/59/61/10/883596110.db2.gz OQKNPTGDFMBYNH-FDDCHVKYSA-N 0 3 410.562 4.162 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)N[C@H]1CCO[C@H](c2ccccc2)C1 ZINC000469439549 883629357 /nfs/dbraw/zinc/62/93/57/883629357.db2.gz XXFULBWNZBBYCC-HJOGWXRNSA-N 0 3 409.574 4.363 20 0 HIADHN COc1ccc(COC[C@H](O)CN2CCC(=Cc3ccc(F)c(F)c3)CC2)cc1 ZINC000469445867 883642854 /nfs/dbraw/zinc/64/28/54/883642854.db2.gz HTRQQEBXPKIMNU-HXUWFJFHSA-N 0 3 403.469 4.030 20 0 HIADHN CN(Cc1cc(-c2cnn(C)c2)no1)CC1(c2ccc(Br)cc2)CC1 ZINC000469521699 883790446 /nfs/dbraw/zinc/79/04/46/883790446.db2.gz GSYAEMKBOMLDGJ-UHFFFAOYSA-N 0 3 401.308 4.001 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N(C[C@H]3CCCO3)C3CCC(C)CC3)cc2)CC1 ZINC000469627020 883839462 /nfs/dbraw/zinc/83/94/62/883839462.db2.gz GQADMMHZPSWFAF-VZYOYLOZSA-N 0 3 413.606 4.028 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)Nc1ccc(O[C@H]2CCOC2)cc1 ZINC000469648678 883847921 /nfs/dbraw/zinc/84/79/21/883847921.db2.gz CRKFPDQQTQBFHC-XZOQPEGZSA-N 0 3 411.546 4.132 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)Nc1ccc(NC[C@@H]2CCCO2)c(F)c1 ZINC000469685424 883869888 /nfs/dbraw/zinc/86/98/88/883869888.db2.gz VYXNCUVZRQRHPC-INIZCTEOSA-N 0 3 411.477 4.477 20 0 HIADHN O=C(CCN1CCN(c2ccccc2)CC1)Nc1cccc(N2CCCCCC2)c1 ZINC000469694654 883874590 /nfs/dbraw/zinc/87/45/90/883874590.db2.gz HSMZCTXUIUUIJI-UHFFFAOYSA-N 0 3 406.574 4.218 20 0 HIADHN COc1ccc2c(c1)[C@@H](N(Cc1ccccc1)C(=O)CN1[C@H](C)CC[C@@H]1C)CCO2 ZINC000469699525 883877751 /nfs/dbraw/zinc/87/77/51/883877751.db2.gz IETYLDRKRPZQJY-YYDVJCTNSA-N 0 3 408.542 4.420 20 0 HIADHN O=C(Nc1ccc(F)c(Cl)c1)C1CCN(CCOCC(F)(F)C(F)F)CC1 ZINC000469712563 883883346 /nfs/dbraw/zinc/88/33/46/883883346.db2.gz INRNGYPYQZDEJY-UHFFFAOYSA-N 0 3 414.802 4.047 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)Nc3ccc(CC(F)(F)F)cc3)CC2)c1 ZINC000469732238 883890508 /nfs/dbraw/zinc/89/05/08/883890508.db2.gz AFKYTBSUYJHBQR-UHFFFAOYSA-N 0 3 405.464 4.251 20 0 HIADHN Cc1csc2nc(CN(C)C[C@H](C)Oc3ccc(Cl)c(Cl)c3)cc(=O)n12 ZINC000469734687 883892636 /nfs/dbraw/zinc/89/26/36/883892636.db2.gz QDIBITIRXHTVJT-LBPRGKRZSA-N 0 3 412.342 4.271 20 0 HIADHN COC(=O)c1cccc(NC(=O)CN[C@H](Cc2ccc(Cl)cc2)c2ccccc2)n1 ZINC000469784504 883959226 /nfs/dbraw/zinc/95/92/26/883959226.db2.gz ZJJIYTSTJQOIQA-HXUWFJFHSA-N 0 3 423.900 4.034 20 0 HIADHN CN(C)[C@H](CN[C@@H](c1ccccc1)c1cncnc1)c1cccc(C(F)(F)F)c1 ZINC000469789597 883964735 /nfs/dbraw/zinc/96/47/35/883964735.db2.gz FSCOJIDZTZSQQO-RTWAWAEBSA-N 0 3 400.448 4.477 20 0 HIADHN CC[C@@H](NCc1cccc(C(=O)N2CCOCC2)c1)c1ccc(OC(F)F)cc1 ZINC000469810568 883985774 /nfs/dbraw/zinc/98/57/74/883985774.db2.gz RAKCYVYRGCGMTL-HXUWFJFHSA-N 0 3 404.457 4.001 20 0 HIADHN C[C@H](NC(=O)N(CCN(C)C)Cc1ccccc1)c1ccc(OCC2CC2)c(F)c1 ZINC000469825439 884004458 /nfs/dbraw/zinc/00/44/58/884004458.db2.gz TWESXGUAQUZJCW-SFHVURJKSA-N 0 3 413.537 4.449 20 0 HIADHN Cc1c2cc(Cl)ccc2oc1C(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000469836758 884018876 /nfs/dbraw/zinc/01/88/76/884018876.db2.gz QTAHJAIILODWBB-IBGZPJMESA-N 0 3 412.917 4.416 20 0 HIADHN CCC[C@@H]1C[C@H](C(=O)Nc2c(C)cnn2[C@@H]2CCN(Cc3ccccc3)C2)CCO1 ZINC000503670193 912777869 /nfs/dbraw/zinc/77/78/69/912777869.db2.gz KNJMRALZSYCFAL-YPAWHYETSA-N 0 3 410.562 4.172 20 0 HIADHN O=C(CCc1ccc(-c2ccccc2)[nH]1)NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000469846327 884029510 /nfs/dbraw/zinc/02/95/10/884029510.db2.gz KFUZEVMGDODURK-DEOSSOPVSA-N 0 3 417.553 4.022 20 0 HIADHN O=C(CCCc1nc2ccccc2s1)NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000469849948 884034128 /nfs/dbraw/zinc/03/41/28/884034128.db2.gz UGFGYYZADAKBPC-HXUWFJFHSA-N 0 3 423.582 4.026 20 0 HIADHN CC(C)(C(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1)c1ccc(Cl)cc1 ZINC000469853871 884037816 /nfs/dbraw/zinc/03/78/16/884037816.db2.gz PYGQJFROMMXPDH-NRFANRHFSA-N 0 3 400.950 4.025 20 0 HIADHN Cc1c(C(=O)NC[C@H]2CN(Cc3ccccc3)CCCO2)sc2cccc(F)c12 ZINC000469863227 884052268 /nfs/dbraw/zinc/05/22/68/884052268.db2.gz BYTBUQJVTHFQIC-SFHVURJKSA-N 0 3 412.530 4.370 20 0 HIADHN CC(C)(C(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1)c1ccc(Cl)cc1F ZINC000469866848 884055648 /nfs/dbraw/zinc/05/56/48/884055648.db2.gz OSKJGLJHUMILEN-IBGZPJMESA-N 0 3 418.940 4.164 20 0 HIADHN O=C(C[C@H](c1ccccc1)C(F)(F)F)NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000469873744 884062756 /nfs/dbraw/zinc/06/27/56/884062756.db2.gz SLPQGPQWWDASOY-NHCUHLMSSA-N 0 3 420.475 4.130 20 0 HIADHN CCCCOc1cc(OC)ccc1C(=O)N(Cc1ccco1)C1CCN(C)CC1 ZINC000469927751 884121456 /nfs/dbraw/zinc/12/14/56/884121456.db2.gz YODLXPYNDWOMHB-UHFFFAOYSA-N 0 3 400.519 4.204 20 0 HIADHN Cc1ccccc1-n1nccc1NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000469929919 884123219 /nfs/dbraw/zinc/12/32/19/884123219.db2.gz VSSGNUTXXFTUBN-UHFFFAOYSA-N 0 3 421.467 4.108 20 0 HIADHN Cc1cnc(CCN(C)Cc2cc(Br)cc(Br)c2N)s1 ZINC000469949353 884147667 /nfs/dbraw/zinc/14/76/67/884147667.db2.gz ZMOWXKRPQUSRSU-UHFFFAOYSA-N 0 3 419.186 4.233 20 0 HIADHN CC(C)[C@@H](NC(=O)NCC(C)(C)N1CCc2ccccc2C1)c1nc2ccccc2[nH]1 ZINC000503686167 912791932 /nfs/dbraw/zinc/79/19/32/912791932.db2.gz SUWWAKDDZQUHIX-JOCHJYFZSA-N 0 3 419.573 4.396 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)N[C@@H](c1nc(C2CC2)no1)C(C)C ZINC000470062169 884313281 /nfs/dbraw/zinc/31/32/81/884313281.db2.gz MVRGVUHJYUZQGT-VQTJNVASSA-N 0 3 413.566 4.100 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@H]2NC(=O)NC[C@@H](c2ccccc2)N2CCCC2)cc1 ZINC000470062894 884315380 /nfs/dbraw/zinc/31/53/80/884315380.db2.gz SQGBJYXZVRDKBX-SGNDLWITSA-N 0 3 407.558 4.351 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@H]2NC(=O)N[C@@H](CN2CCCC2)c2ccccc2)cc1 ZINC000470077552 884334209 /nfs/dbraw/zinc/33/42/09/884334209.db2.gz YLAPNZYKPBKSHV-SGNDLWITSA-N 0 3 407.558 4.351 20 0 HIADHN CC(C)N(Cc1nnc(-c2ccccc2Cl)o1)C(=O)[C@H](C)N1CCCCCC1 ZINC000503784268 912823538 /nfs/dbraw/zinc/82/35/38/912823538.db2.gz YXHBUZGLDORXDB-INIZCTEOSA-N 0 3 404.942 4.392 20 0 HIADHN CC(C)Cn1ncc(C(=O)N[C@@H](CN(C)Cc2ccccc2)C(C)C)c1C(F)F ZINC000470168194 884446474 /nfs/dbraw/zinc/44/64/74/884446474.db2.gz HZHUPFSCYFADJY-IBGZPJMESA-N 0 3 406.521 4.363 20 0 HIADHN CC(C)(C)NC(=O)Nc1ccc(Cl)c(C(=O)NC[C@@H]2CCCCN2C2CC2)c1 ZINC000470174104 884456928 /nfs/dbraw/zinc/45/69/28/884456928.db2.gz QKDRESYSDQDOGV-INIZCTEOSA-N 0 3 406.958 4.007 20 0 HIADHN COc1cc(CNC(=O)N2CCN(C3CCCC3)CC2)ccc1OCc1ccccc1 ZINC000503820303 912831832 /nfs/dbraw/zinc/83/18/32/912831832.db2.gz FHXFTTZQZGXSQB-UHFFFAOYSA-N 0 3 423.557 4.044 20 0 HIADHN CC(C)[C@H](CNC(=O)Nc1ccccc1O[C@H]1CCOC1)N1CCc2ccccc2C1 ZINC000470261408 884604603 /nfs/dbraw/zinc/60/46/03/884604603.db2.gz PTBMSVXOPDIMGL-GMAHTHKFSA-N 0 3 423.557 4.059 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)N1CCC[C@@H](c2nccs2)C1 ZINC000470279146 884640679 /nfs/dbraw/zinc/64/06/79/884640679.db2.gz JDTKHPNOTLQLCN-WOJBJXKFSA-N 0 3 400.592 4.189 20 0 HIADHN Cc1cc(C(=O)NCCCCN2CCN(Cc3ccccc3)CC2)c(Cl)cc1F ZINC000470339423 884726419 /nfs/dbraw/zinc/72/64/19/884726419.db2.gz YMDUSZOCTBAMJM-UHFFFAOYSA-N 0 3 417.956 4.115 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N3CC[C@@H](c4c(F)cccc4F)C3)cc2)CC1 ZINC000470343978 884734671 /nfs/dbraw/zinc/73/46/71/884734671.db2.gz JMTDHIWIXQTPQT-LJQANCHMSA-N 0 3 413.512 4.125 20 0 HIADHN C[C@@H](NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(-c2ccncc2)cc1 ZINC000470480923 884868636 /nfs/dbraw/zinc/86/86/36/884868636.db2.gz ZIYVWYUGUBNJPZ-NTKDMRAZSA-N 0 3 400.526 4.383 20 0 HIADHN CCc1cc(OC)ccc1CN1CCC(C(=O)c2ccc3c(c2)NC(=O)[C@@H](C)O3)CC1 ZINC000503937192 912873056 /nfs/dbraw/zinc/87/30/56/912873056.db2.gz LNJZGBOKVCHZCD-MRXNPFEDSA-N 0 3 422.525 4.072 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N(C)[C@H](Cc3ccc(F)cc3)C(C)C)cc2)CC1 ZINC000470546827 884956131 /nfs/dbraw/zinc/95/61/31/884956131.db2.gz MLRRAWMZVPTIAY-XMMPIXPASA-N 0 3 411.565 4.307 20 0 HIADHN O=C(CC1(N2CCOCC2)CCCC1)N1CCC(=Cc2ccc(F)c(F)c2)CC1 ZINC000470593342 885013635 /nfs/dbraw/zinc/01/36/35/885013635.db2.gz YCMQIFAYAZTSKG-UHFFFAOYSA-N 0 3 404.501 4.006 20 0 HIADHN C[C@@H]1C[C@@H]1C(=O)Nc1ccc(C(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000470654554 885076608 /nfs/dbraw/zinc/07/66/08/885076608.db2.gz UIBAOPLMMWIIMP-YSZBQJHXSA-N 0 3 405.542 4.018 20 0 HIADHN Cc1ccc(-c2nc(CC(=O)N(C)[C@H]3CCCN(Cc4ccccc4)C3)cs2)o1 ZINC000470658125 885080587 /nfs/dbraw/zinc/08/05/87/885080587.db2.gz WXUQCOHNGHGUTK-FQEVSTJZSA-N 0 3 409.555 4.377 20 0 HIADHN Cc1cc(Br)ccc1C(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470659834 885084493 /nfs/dbraw/zinc/08/44/93/885084493.db2.gz GPEOOQMVBDKVNM-IBGZPJMESA-N 0 3 401.348 4.494 20 0 HIADHN C[C@@H]1C[C@@H]1C(=O)Nc1cccc(C(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000470665714 885092477 /nfs/dbraw/zinc/09/24/77/885092477.db2.gz GKDJSHOMPIRVRF-LEOXJPRUSA-N 0 3 405.542 4.018 20 0 HIADHN CC(=O)c1ccc(OCCCC(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000470671619 885101445 /nfs/dbraw/zinc/10/14/45/885101445.db2.gz ZPVMUTLNQFRKJU-HSZRJFAPSA-N 0 3 408.542 4.171 20 0 HIADHN CC(=O)CCc1ccc(O[C@H](C)C(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000470678146 885109072 /nfs/dbraw/zinc/10/90/72/885109072.db2.gz JIWYZNPQUVWGHE-ZJSXRUAMSA-N 0 3 422.569 4.099 20 0 HIADHN CSCc1nc2ccccc2n1CC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470685702 885119501 /nfs/dbraw/zinc/11/95/01/885119501.db2.gz XVSLBLJYTCXKHH-HXUWFJFHSA-N 0 3 422.598 4.022 20 0 HIADHN CN(CCCCNC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1)c1ccccc1 ZINC000470718511 885160541 /nfs/dbraw/zinc/16/05/41/885160541.db2.gz TWCPUUYNQHVPJT-DEOSSOPVSA-N 0 3 408.590 4.209 20 0 HIADHN CN(C(=O)NCCc1ccc2ccccc2n1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470720253 885165018 /nfs/dbraw/zinc/16/50/18/885165018.db2.gz RKSJCWQWASBPNY-HSZRJFAPSA-N 0 3 402.542 4.083 20 0 HIADHN CC[C@@H](NC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1)c1ccc2c(c1)OCCO2 ZINC000470722255 885169417 /nfs/dbraw/zinc/16/94/17/885169417.db2.gz HRZRNENMTZPXRY-FCHUYYIVSA-N 0 3 423.557 4.215 20 0 HIADHN CN(C(=O)NCc1cc(Br)cs1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470722200 885169594 /nfs/dbraw/zinc/16/95/94/885169594.db2.gz GJVZZCNLPZQOAS-KRWDZBQOSA-N 0 3 422.392 4.317 20 0 HIADHN CN(C(=O)NCc1cccc(OC(F)F)c1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470732627 885185225 /nfs/dbraw/zinc/18/52/25/885185225.db2.gz KQXPYAVSJZVRDE-LJQANCHMSA-N 0 3 403.473 4.094 20 0 HIADHN CC(=O)Nc1cccc([C@@H](C)NC(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000470736104 885191375 /nfs/dbraw/zinc/19/13/75/885191375.db2.gz GLHUUCORYMUZED-JPYJTQIMSA-N 0 3 408.546 4.012 20 0 HIADHN CN(Cc1nc(C(F)(F)F)cs1)C(=O)NC[C@H](c1ccccc1)N1CCCC1 ZINC000470744447 885208069 /nfs/dbraw/zinc/20/80/69/885208069.db2.gz PAWIBSWZJMQBBD-OAHLLOKOSA-N 0 3 412.481 4.140 20 0 HIADHN COc1ccc([C@@H](C)CCNC(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000470885547 885380051 /nfs/dbraw/zinc/38/00/51/885380051.db2.gz DDFUQVLAWUIMOX-NZQKXSOJSA-N 0 3 409.574 4.495 20 0 HIADHN COc1ccccc1[C@]1(C)C[C@H]1NC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470895134 885393079 /nfs/dbraw/zinc/39/30/79/885393079.db2.gz RTVIAYFJDVMITN-ZWSUVBHBSA-N 0 3 407.558 4.031 20 0 HIADHN CSc1cccc(N(C(=O)c2cc3nccnc3cc2F)C2CCN(C)CC2)c1 ZINC000470946248 885445450 /nfs/dbraw/zinc/44/54/50/885445450.db2.gz FHOMWJZIOYHYCV-UHFFFAOYSA-N 0 3 410.518 4.232 20 0 HIADHN O=C(c1cc2nccnc2cc1F)N(CCN1CCCC1)Cc1ccc(Cl)cc1 ZINC000470946357 885445949 /nfs/dbraw/zinc/44/59/49/885445949.db2.gz NTVKPAZQCRWGKY-UHFFFAOYSA-N 0 3 412.896 4.161 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)Nc1ccccc1COc1ccccc1 ZINC000504037702 912944140 /nfs/dbraw/zinc/94/41/40/912944140.db2.gz QWSAONQBDQASCL-UHFFFAOYSA-N 0 3 404.514 4.256 20 0 HIADHN C[C@H](Oc1ccc2ccccc2c1)C(=O)Nc1ccc(OC2CCN(C)CC2)nc1 ZINC000471027928 885536035 /nfs/dbraw/zinc/53/60/35/885536035.db2.gz HWJIKBOXXOKRHU-KRWDZBQOSA-N 0 3 405.498 4.114 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)N1CCN(c2cncc3ccccc32)CC1 ZINC000471107344 885640481 /nfs/dbraw/zinc/64/04/81/885640481.db2.gz PCRUKXPCTKZVAM-UHFFFAOYSA-N 0 3 414.509 4.005 20 0 HIADHN O=C(Nc1ccccc1Br)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000471115089 885650257 /nfs/dbraw/zinc/65/02/57/885650257.db2.gz GTXKRIAMXHJMBF-UHFFFAOYSA-N 0 3 420.273 4.376 20 0 HIADHN CSc1nc(-c2ccco2)nc(C)c1C(=O)N[C@H](C)[C@H](c1ccccc1)N(C)C ZINC000471136318 885677336 /nfs/dbraw/zinc/67/73/36/885677336.db2.gz JQMCRUUSAWYEKR-DNVCBOLYSA-N 0 3 410.543 4.188 20 0 HIADHN COc1ccc(C2(C(=O)N[C@@H](C)[C@@H](c3ccccc3)N(C)C)CCCC2)cc1OC ZINC000471139226 885681448 /nfs/dbraw/zinc/68/14/48/885681448.db2.gz DXZVVVXUYKDYPM-MBSDFSHPSA-N 0 3 410.558 4.323 20 0 HIADHN O=C(CCN1CCC(Oc2ccccn2)CC1)N[C@H](c1cccs1)c1ccccc1 ZINC000471154776 885705248 /nfs/dbraw/zinc/70/52/48/885705248.db2.gz WLNVOUFHUAMJFK-DEOSSOPVSA-N 0 3 421.566 4.282 20 0 HIADHN CC(=O)Nc1cc(C(=O)NC[C@H](c2ccccc2)N2CCCC2)cc(C(F)(F)F)c1 ZINC000471173807 885734845 /nfs/dbraw/zinc/73/48/45/885734845.db2.gz UEFXWGOJNGTHTQ-HXUWFJFHSA-N 0 3 419.447 4.231 20 0 HIADHN CN(CCCCOc1ccccc1C(F)(F)F)[C@H]1CCCC[C@H]1S(C)(=O)=O ZINC000471241249 885818406 /nfs/dbraw/zinc/81/84/06/885818406.db2.gz DTBALQVFPNAQOG-FUHWJXTLSA-N 0 3 407.498 4.152 20 0 HIADHN C[C@@H]1[C@H](C(F)(F)F)CCN1C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000471246770 885822847 /nfs/dbraw/zinc/82/28/47/885822847.db2.gz WPMBTZBRVYSQGV-RHSMWYFYSA-N 0 3 401.498 4.083 20 0 HIADHN O=C(CCN1CCc2ccccc2C1)Nc1ccc(OCc2ccccn2)c(F)c1 ZINC000471385213 886031927 /nfs/dbraw/zinc/03/19/27/886031927.db2.gz LPEWTQBVMMPVQF-UHFFFAOYSA-N 0 3 405.473 4.187 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N[C@@H]1C[C@H]1c1ccc(OC(F)F)cc1)c1ccco1 ZINC000504104006 913012619 /nfs/dbraw/zinc/01/26/19/913012619.db2.gz NDZADTARJORAPT-VIBAHUMZSA-N 0 3 407.461 4.166 20 0 HIADHN CCN(C(=O)Nc1cc(OC)cc(-n2cccn2)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000471486381 886183317 /nfs/dbraw/zinc/18/33/17/886183317.db2.gz YYPHVXPCDGFHKB-OAQYLSRUSA-N 0 3 419.529 4.009 20 0 HIADHN O=C(NCCCSc1ccccc1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000471490584 886188509 /nfs/dbraw/zinc/18/85/09/886188509.db2.gz CEDWPGRHLYTEGO-UHFFFAOYSA-N 0 3 415.525 4.273 20 0 HIADHN C[C@H](NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1ccc(F)cc1F ZINC000471492640 886192439 /nfs/dbraw/zinc/19/24/39/886192439.db2.gz UQQDJFHJCVIJNT-QGLTVNCISA-N 0 3 405.411 4.130 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)NCC1CCN(c2ccccc2)CC1 ZINC000471498545 886201223 /nfs/dbraw/zinc/20/12/23/886201223.db2.gz ZLCSVCILPBCCHH-XMMPIXPASA-N 0 3 406.574 4.039 20 0 HIADHN CCN1CCC[C@@H](CN(C)C(=O)Nc2nc(C(C)(C)C)cs2)[C@@H]1c1cnn(C)c1 ZINC000471500243 886202843 /nfs/dbraw/zinc/20/28/43/886202843.db2.gz KQXCSWMPXQOCMY-MAUKXSAKSA-N 0 3 418.611 4.111 20 0 HIADHN C[C@H](Cc1ccccc1Br)NC(=O)N(CCN(C)C)Cc1cccs1 ZINC000471540478 886246919 /nfs/dbraw/zinc/24/69/19/886246919.db2.gz ULZZEBNCDFJHHP-OAHLLOKOSA-N 0 3 424.408 4.215 20 0 HIADHN C[C@@H](NC(=O)CCc1nnc(-c2ccc(Cl)cc2)o1)[C@@H](c1ccccc1)N(C)C ZINC000471541244 886248222 /nfs/dbraw/zinc/24/82/22/886248222.db2.gz KVRMTNRCIDKKGH-VFNWGFHPSA-N 0 3 412.921 4.130 20 0 HIADHN O=C(NCc1ccccc1-c1ccc(C[NH+]2CCCC2)cc1)NCc1ncccc1[O-] ZINC000471609486 886323827 /nfs/dbraw/zinc/32/38/27/886323827.db2.gz JTVKFVVTRPJZLP-UHFFFAOYSA-N 0 3 416.525 4.049 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)c3cnc(Cc4ccccc4)s3)c2)CC1 ZINC000471633183 886351751 /nfs/dbraw/zinc/35/17/51/886351751.db2.gz IXPAUWBTJKMASN-UHFFFAOYSA-N 0 3 406.555 4.128 20 0 HIADHN COCCC[C@H](Cc1ccccc1)NC(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000471727775 886444855 /nfs/dbraw/zinc/44/48/55/886444855.db2.gz PSZGPMQTLAASJS-TUACAJSNSA-N 0 3 409.574 4.159 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)NCC2CCN(c3ccccc3)CC2)C1 ZINC000471730999 886450119 /nfs/dbraw/zinc/45/01/19/886450119.db2.gz GZOUDQBDQPCEGP-OFNKIYASSA-N 0 3 406.574 4.038 20 0 HIADHN CC(=O)Nc1cc(C(=O)NC[C@@H](c2ccc(C)cc2)N(C)C)cc(C(F)(F)F)c1 ZINC000471758754 886491074 /nfs/dbraw/zinc/49/10/74/886491074.db2.gz VPPRPQLIYPSJRB-IBGZPJMESA-N 0 3 407.436 4.005 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N[C@H](c2ccc(C)cc2)c2ccccn2)N(C)C)cc1 ZINC000471765867 886498475 /nfs/dbraw/zinc/49/84/75/886498475.db2.gz DESVDAHZPJHUEY-BJKOFHAPSA-N 0 3 402.542 4.390 20 0 HIADHN CCN(C(=O)c1noc(-c2cccc(OC)c2)n1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000471807014 886543982 /nfs/dbraw/zinc/54/39/82/886543982.db2.gz BCGBFLFQUYDUPI-FXAWDEMLSA-N 0 3 420.513 4.043 20 0 HIADHN COc1ccc([C@H](NC(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)C(F)(F)F)cc1 ZINC000471917088 886705171 /nfs/dbraw/zinc/70/51/71/886705171.db2.gz FHAZLVYLCXNGAM-FHWLQOOXSA-N 0 3 407.436 4.043 20 0 HIADHN C[C@H](C(=O)Nc1ccc2oc(=O)n(CCN(C)C)c2c1)c1ccc(Cl)c(Cl)c1 ZINC000471938405 886736431 /nfs/dbraw/zinc/73/64/31/886736431.db2.gz BIICTDIQGBBTHC-LBPRGKRZSA-N 0 3 422.312 4.205 20 0 HIADHN C[C@H](CNC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1)Cc1cccs1 ZINC000471973319 886804633 /nfs/dbraw/zinc/80/46/33/886804633.db2.gz OVCXRODPJSGPOW-JEYLPNPQSA-N 0 3 403.514 4.031 20 0 HIADHN Cc1cc(C)n(-c2ccccc2CNC(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)n1 ZINC000471976229 886806670 /nfs/dbraw/zinc/80/66/70/886806670.db2.gz HUOSQHWZHBACNP-NFBKMPQASA-N 0 3 417.557 4.124 20 0 HIADHN CN(CCNC(=O)N[C@@H](c1cccc(Cl)c1)c1ccccn1)Cc1ccccc1 ZINC000471989242 886816704 /nfs/dbraw/zinc/81/67/04/886816704.db2.gz SHXWCVGXGHZLRW-QFIPXVFZSA-N 0 3 408.933 4.256 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2ccc(F)cc2-c2nc(C3CC3)no2)[C@H]1c1ccccc1 ZINC000471992158 886818576 /nfs/dbraw/zinc/81/85/76/886818576.db2.gz MVEAFLTZIPSTQM-VQTJNVASSA-N 0 3 421.476 4.320 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)c3cc(F)ccc3-c3ccoc3)CC2)C[C@@H](C)O1 ZINC000472027663 886849828 /nfs/dbraw/zinc/84/98/28/886849828.db2.gz AKXYKDGZGQSUCK-IAGOWNOFSA-N 0 3 400.494 4.047 20 0 HIADHN CCSc1cccc(CNCc2ccc(S(=O)(=O)N3CCCCC3)cc2)c1 ZINC000472038603 886856783 /nfs/dbraw/zinc/85/67/83/886856783.db2.gz QKQWNKTWIGLZKU-UHFFFAOYSA-N 0 3 404.601 4.263 20 0 HIADHN CCn1nc(CN[C@@H](C)c2cc(F)ccc2N2CCN(CC)CC2)c2ccccc21 ZINC000472052797 886865118 /nfs/dbraw/zinc/86/51/18/886865118.db2.gz NHXSCCVBSJMNGZ-SFHVURJKSA-N 0 3 409.553 4.188 20 0 HIADHN C[C@H](CCN1CCN(C)CC1)NC(=O)c1ccc(Sc2ccc(Cl)cc2)cc1 ZINC000472086897 886886834 /nfs/dbraw/zinc/88/68/34/886886834.db2.gz ZJDJSUOVDKZFRK-QGZVFWFLSA-N 0 3 418.006 4.247 20 0 HIADHN COc1ccc([C@@H](NC[C@H](O)CCOC(C)C)c2ccccc2)cc1Br ZINC000472165009 886963332 /nfs/dbraw/zinc/96/33/32/886963332.db2.gz WOIMEINPADNOMK-NQIIRXRSSA-N 0 3 422.363 4.313 20 0 HIADHN CN(C(=O)c1ccc2nc(C(F)(F)F)cn2c1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000472309935 887137185 /nfs/dbraw/zinc/13/71/85/887137185.db2.gz KAQVADXXMCWYKY-SFHVURJKSA-N 0 3 416.447 4.090 20 0 HIADHN CC[C@@H]1CN(CCC(=O)Nc2cc(Cl)ccc2Cl)[C@@H](CC)CN1C(C)=O ZINC000472317682 887150548 /nfs/dbraw/zinc/15/05/48/887150548.db2.gz QWKNYLGPASXIHR-JKSUJKDBSA-N 0 3 400.350 4.043 20 0 HIADHN CC[C@@H]1CN(CCC(=O)Nc2c(Cl)cccc2Cl)[C@@H](CC)CN1C(C)=O ZINC000472334927 887170769 /nfs/dbraw/zinc/17/07/69/887170769.db2.gz AWGAEHMBFFANAP-LSDHHAIUSA-N 0 3 400.350 4.043 20 0 HIADHN C[C@H](c1ccc(F)c(F)c1)N(C)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472451040 887303796 /nfs/dbraw/zinc/30/37/96/887303796.db2.gz VJWNGAAKEVOZAW-UWTIGNOOSA-N 0 3 419.438 4.473 20 0 HIADHN CC[C@@H](NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1nc2ccccc2[nH]1 ZINC000472451876 887303891 /nfs/dbraw/zinc/30/38/91/887303891.db2.gz LHJAZLBPINPKAF-UYSNPLJNSA-N 0 3 423.483 4.119 20 0 HIADHN CCC1(CC)[C@H](OC)C[C@@H]1N(C)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472454473 887306892 /nfs/dbraw/zinc/30/68/92/887306892.db2.gz HMMIPDKKUHAQQV-ZGUYJTEBSA-N 0 3 419.532 4.027 20 0 HIADHN Cc1ccc([C@]2(C)CCN(C(=O)NC3CC(N4CCC(C(F)(F)F)CC4)C3)C2)cc1 ZINC000472455344 887308671 /nfs/dbraw/zinc/30/86/71/887308671.db2.gz UJLDWLFEAYNYSD-QETWGEEDSA-N 0 3 423.523 4.473 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N1CCC[C@@H](Cc2ccccc2)C1 ZINC000472456614 887310862 /nfs/dbraw/zinc/31/08/62/887310862.db2.gz RXJVWVPAUDSTBH-PELRDEGISA-N 0 3 423.523 4.456 20 0 HIADHN COCCC[C@@H](Cc1ccccc1)NC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C ZINC000472458682 887313941 /nfs/dbraw/zinc/31/39/41/887313941.db2.gz YQCGJQXFNPZCQX-RDGATRHJSA-N 0 3 423.601 4.330 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N1Cc2ccccc2C2(CC2)C1 ZINC000472466133 887325107 /nfs/dbraw/zinc/32/51/07/887325107.db2.gz XXNAUEKCMMJABY-UHFFFAOYSA-N 0 3 407.480 4.049 20 0 HIADHN C[C@H]1C[C@@H](c2ccccc2)CN1C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472467608 887328301 /nfs/dbraw/zinc/32/83/01/887328301.db2.gz ZWHKDILIJATQEC-CIELIIMNSA-N 0 3 409.496 4.379 20 0 HIADHN COCCCOc1ccccc1NC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000472690515 887545417 /nfs/dbraw/zinc/54/54/17/887545417.db2.gz LFMWAFXNTVRFFV-OAQYLSRUSA-N 0 3 411.546 4.230 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)c(Cl)c1 ZINC000472736415 887582929 /nfs/dbraw/zinc/58/29/29/887582929.db2.gz HFOJGCQBJMIGCR-IBGZPJMESA-N 0 3 414.937 4.427 20 0 HIADHN CCCCCn1cc(CNC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)c(C)n1 ZINC000504318705 913165020 /nfs/dbraw/zinc/16/50/20/913165020.db2.gz PATABOMHTLZDPA-FQEVSTJZSA-N 0 3 400.542 4.049 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2ccc(F)cc2-c2nc(C3CC3)no2)N(C)C)cc1 ZINC000472861985 887717393 /nfs/dbraw/zinc/71/73/93/887717393.db2.gz XNDPIFHOLFWMIG-FQEVSTJZSA-N 0 3 423.492 4.486 20 0 HIADHN CC(C)CC[C@@H](NC(=O)N[C@H](C)CCN1CCN(C)CC1)c1ccc(Cl)cc1 ZINC000472918301 887763469 /nfs/dbraw/zinc/76/34/69/887763469.db2.gz BAZRHIGQZRIQHO-WIYYLYMNSA-N 0 3 409.018 4.143 20 0 HIADHN C[C@H](CCN1CCN(C)CC1)NC(=O)N(Cc1ccccc1)[C@H](C)c1cccs1 ZINC000472920182 887766884 /nfs/dbraw/zinc/76/68/84/887766884.db2.gz VEUWJDUHOIEBHL-WOJBJXKFSA-N 0 3 414.619 4.047 20 0 HIADHN Cc1cc(NC(=O)c2cccc(CN(C)C)c2)nn1CCCOc1ccc(F)cc1 ZINC000504358274 913191286 /nfs/dbraw/zinc/19/12/86/913191286.db2.gz DTCIOBLIKXAXBG-UHFFFAOYSA-N 0 3 410.493 4.114 20 0 HIADHN O[C@H](COc1ccc(Oc2ccccc2)cc1)CN1CC[C@@]2(C1)OCc1ccccc12 ZINC000473159364 887937949 /nfs/dbraw/zinc/93/79/49/887937949.db2.gz HJWNDKYHEAIHPF-LVXARBLLSA-N 0 3 417.505 4.350 20 0 HIADHN COc1ccc(C(=O)CCCC(=O)NC2[C@@H](C)CN(Cc3ccccc3)C[C@@H]2C)cc1 ZINC000473269745 888028206 /nfs/dbraw/zinc/02/82/06/888028206.db2.gz MZLFSQRFKWRJSJ-PMACEKPBSA-N 0 3 422.569 4.321 20 0 HIADHN C[C@H](CC(=O)NC1[C@H](C)CN(Cc2ccccc2)C[C@H]1C)C(=O)c1cccc(F)c1 ZINC000473283400 888038910 /nfs/dbraw/zinc/03/89/10/888038910.db2.gz WZDXQSXAGBEMDC-GUDVDZBRSA-N 0 3 410.533 4.307 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)NCCc1cccc(-c2ccccc2)c1 ZINC000473355121 888079678 /nfs/dbraw/zinc/07/96/78/888079678.db2.gz KZYDRDMYKKXLLH-UHFFFAOYSA-N 0 3 415.537 4.021 20 0 HIADHN COc1c(CNC(=O)NC[C@H](c2ccc(OC)cc2)N2CCCC2)oc2ccccc21 ZINC000473404009 888120413 /nfs/dbraw/zinc/12/04/13/888120413.db2.gz DGFNZQYYCJAIMA-HXUWFJFHSA-N 0 3 423.513 4.086 20 0 HIADHN CC(C)N1CCC[C@@H](N[C@@H](Cc2ccccn2)c2ccc(Br)cc2)C1=O ZINC000473444640 888165942 /nfs/dbraw/zinc/16/59/42/888165942.db2.gz ZMJOBIHIFONALP-UXHICEINSA-N 0 3 416.363 4.117 20 0 HIADHN CCO[C@H](CCNC(=O)Nc1ccc(N2CCN(CC)CC2)cc1C)C1CCCC1 ZINC000473444868 888167060 /nfs/dbraw/zinc/16/70/60/888167060.db2.gz VGVYOLKBIUAPGF-HSZRJFAPSA-N 0 3 416.610 4.244 20 0 HIADHN CC(C)(C)n1nc(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cc1C1CC1 ZINC000473514266 888245627 /nfs/dbraw/zinc/24/56/27/888245627.db2.gz RCZBIQQNTICMOF-UHFFFAOYSA-N 0 3 412.500 4.051 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)[C@H]1CCOc2ccc(Cl)cc21 ZINC000473517225 888248084 /nfs/dbraw/zinc/24/80/84/888248084.db2.gz HMKQNLDVJPTGCL-GPANFISMSA-N 0 3 416.871 4.128 20 0 HIADHN Cc1cccc(CSCC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)c1 ZINC000473517915 888250565 /nfs/dbraw/zinc/25/05/65/888250565.db2.gz BYFDOMYAROGSGN-UHFFFAOYSA-N 0 3 400.510 4.150 20 0 HIADHN Cc1ccc(OCCCC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)c(C)c1 ZINC000473518685 888251826 /nfs/dbraw/zinc/25/18/26/888251826.db2.gz FNNHEDBWELJIQC-UHFFFAOYSA-N 0 3 412.496 4.384 20 0 HIADHN Cc1ccc(Br)cc1C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473519167 888251955 /nfs/dbraw/zinc/25/19/55/888251955.db2.gz AVHYTJARIQWGIK-UHFFFAOYSA-N 0 3 419.285 4.293 20 0 HIADHN Cc1ccc(C)c(SCC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)c1 ZINC000473521037 888255536 /nfs/dbraw/zinc/25/55/36/888255536.db2.gz JIQQOTRJFWOLBE-UHFFFAOYSA-N 0 3 400.510 4.317 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)[C@@H]1SCCc2sccc21 ZINC000473522347 888257068 /nfs/dbraw/zinc/25/70/68/888257068.db2.gz FPILQZGWVROOCX-SEEARECTSA-N 0 3 404.523 4.000 20 0 HIADHN O=C(Cc1coc2cc3c(cc12)CCC3)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473523895 888259731 /nfs/dbraw/zinc/25/97/31/888259731.db2.gz UEBMAMKHUWIZJA-UHFFFAOYSA-N 0 3 420.475 4.386 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1cc(-c2ccccc2)ns1 ZINC000473523621 888260073 /nfs/dbraw/zinc/26/00/73/888260073.db2.gz WCWFHOIPIFLHNR-UHFFFAOYSA-N 0 3 409.477 4.345 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)[C@H]1C[C@H]1c1cc(F)c(F)c(F)c1 ZINC000473523955 888260849 /nfs/dbraw/zinc/26/08/49/888260849.db2.gz HNNROOZKKJORCF-WUCCLRPBSA-N 0 3 420.397 4.129 20 0 HIADHN CCC(CC)n1nc(C)cc1C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473526189 888264106 /nfs/dbraw/zinc/26/41/06/888264106.db2.gz QRRUJHJDUUFTNU-UHFFFAOYSA-N 0 3 400.489 4.088 20 0 HIADHN COc1ccccc1C[C@@H](C)CC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473527778 888264931 /nfs/dbraw/zinc/26/49/31/888264931.db2.gz SAGLOKOBJDYKRA-VNCLNFNDSA-N 0 3 412.496 4.185 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1cccc(-c2cscn2)c1 ZINC000473535306 888272729 /nfs/dbraw/zinc/27/27/29/888272729.db2.gz WZTZEEPHXSBAQM-UHFFFAOYSA-N 0 3 409.477 4.345 20 0 HIADHN Cc1cccc(C2(CNC(=O)N(CCN(C)C)Cc3ccccn3)CCCCC2)c1 ZINC000504413828 913229231 /nfs/dbraw/zinc/22/92/31/913229231.db2.gz MXJSOAUDRAEAJK-UHFFFAOYSA-N 0 3 408.590 4.365 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cn2ccnc2s1)c1ccc(C(F)(F)F)cc1 ZINC000473582864 888324618 /nfs/dbraw/zinc/32/46/18/888324618.db2.gz NDNQIQFKFDZXQP-HNNXBMFYSA-N 0 3 410.465 4.228 20 0 HIADHN C[C@H](CC(=O)N1C[C@H]2CN(Cc3ccccc3)C[C@H]2C1)C(=O)c1ccc(Cl)cc1 ZINC000473583886 888325204 /nfs/dbraw/zinc/32/52/04/888325204.db2.gz SRVSYDNIPWRZOD-UIFIKXQLSA-N 0 3 410.945 4.139 20 0 HIADHN C[C@@H](NC(=O)N(Cc1cccc(Br)c1)CC1CC1)C1=CCN(C)CC1 ZINC000473646341 888392947 /nfs/dbraw/zinc/39/29/47/888392947.db2.gz HYVWVVBIGYKQOD-OAHLLOKOSA-N 0 3 406.368 4.021 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)NCCc2cccc3[nH]ccc32)N(C)C)cc1 ZINC000504426548 913240680 /nfs/dbraw/zinc/24/06/80/913240680.db2.gz KIBPFZNSENRPMS-HSZRJFAPSA-N 0 3 408.546 4.100 20 0 HIADHN CN1CCN(CCC(C)(C)NC(=O)Nc2cccc(CCCc3ccccc3)c2)CC1 ZINC000473678739 888444025 /nfs/dbraw/zinc/44/40/25/888444025.db2.gz SRSROOBGAUYAGJ-UHFFFAOYSA-N 0 3 422.617 4.400 20 0 HIADHN Cc1ccc(NC(=O)N[C@H](C)CCN2CCN(C)CC2)cc1OCC1CCCCC1 ZINC000473696028 888471488 /nfs/dbraw/zinc/47/14/88/888471488.db2.gz JQWDDNXVKXMJAT-HXUWFJFHSA-N 0 3 416.610 4.102 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)C(C)(C)c3ccc(Cl)cc3F)CC2)C[C@H](C)O1 ZINC000473703752 888480874 /nfs/dbraw/zinc/48/08/74/888480874.db2.gz ZWUWFEGVOAKRLR-IYBDPMFKSA-N 0 3 410.961 4.105 20 0 HIADHN C[C@@H](Oc1ccccc1NC(=O)NC(C)(C)CCN1CCN(C)CC1)c1ccccc1 ZINC000473723527 888501631 /nfs/dbraw/zinc/50/16/31/888501631.db2.gz OBGWXCBTSHDBDC-HXUWFJFHSA-N 0 3 424.589 4.364 20 0 HIADHN COCCOc1ccc(C(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)c(Cl)c1 ZINC000473725778 888502326 /nfs/dbraw/zinc/50/23/26/888502326.db2.gz VWQVLTYUXZERBQ-QFIPXVFZSA-N 0 3 416.949 4.241 20 0 HIADHN CCC1(CC)CCC(NC(=O)NCc2ccccc2CN2CCC(O)CC2)CC1 ZINC000473748252 888534356 /nfs/dbraw/zinc/53/43/56/888534356.db2.gz SQRKTWFXXHYUJL-UHFFFAOYSA-N 0 3 401.595 4.192 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@H](c3nc4ccccc4[nH]3)C(C)C)c2)CC1 ZINC000473802748 888623393 /nfs/dbraw/zinc/62/33/93/888623393.db2.gz BSZBDKXZYHVKPJ-QFIPXVFZSA-N 0 3 420.561 4.224 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3c4c(nn3C(C)C)CCC4)c(C)c2)CC1 ZINC000473805480 888627378 /nfs/dbraw/zinc/62/73/78/888627378.db2.gz LQLQKDMDXLHZQY-UHFFFAOYSA-N 0 3 410.566 4.047 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@H]3CCCOc4c(F)cccc43)c2)CC1 ZINC000473808023 888631223 /nfs/dbraw/zinc/63/12/23/888631223.db2.gz NUVBHORIGZVEAL-NRFANRHFSA-N 0 3 412.509 4.003 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)NCc1ccsc1Br)c1ccco1 ZINC000504459546 913264484 /nfs/dbraw/zinc/26/44/84/913264484.db2.gz ZZRRFPJYRZAVLP-AAEUAGOBSA-N 0 3 400.342 4.032 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@H](C)c3ccc(OC(C)C)cc3)c2)CC1 ZINC000473815039 888641422 /nfs/dbraw/zinc/64/14/22/888641422.db2.gz BTWNSXFSPKKARB-LJQANCHMSA-N 0 3 410.562 4.498 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CCC(c4cccc(OC)c4)CC3)c2)CC1 ZINC000473816721 888643635 /nfs/dbraw/zinc/64/36/35/888643635.db2.gz HZVGCYOITIZFQC-UHFFFAOYSA-N 0 3 422.573 4.249 20 0 HIADHN CC[C@H](NC(=O)Nc1cccc(N2CCN(CC)CC2)c1)c1ccc(F)cc1F ZINC000473821000 888652067 /nfs/dbraw/zinc/65/20/67/888652067.db2.gz QORRBPILCYCDRM-NRFANRHFSA-N 0 3 402.489 4.380 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3C[C@H](C)C[C@@H]3c3cccc(OC)c3)c2)CC1 ZINC000473831653 888666540 /nfs/dbraw/zinc/66/65/40/888666540.db2.gz WSCZQFORINCDOF-NTKDMRAZSA-N 0 3 422.573 4.452 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)NCc3cccc(C(F)(F)F)c3)c2)CC1 ZINC000473833593 888668697 /nfs/dbraw/zinc/66/86/97/888668697.db2.gz DYEBADOBCDCRSS-UHFFFAOYSA-N 0 3 406.452 4.169 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CCC(Cc4ccccc4)CC3)c2)CC1 ZINC000473833946 888669921 /nfs/dbraw/zinc/66/99/21/888669921.db2.gz YOYHQOYURMBTKQ-UHFFFAOYSA-N 0 3 406.574 4.315 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1ccccc1NCc1ccco1 ZINC000473835327 888672047 /nfs/dbraw/zinc/67/20/47/888672047.db2.gz KDEYPSRAIVGQNH-UHFFFAOYSA-N 0 3 421.463 4.427 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@H](C)c3ccc(OC(F)F)cc3)c2)CC1 ZINC000473840000 888680998 /nfs/dbraw/zinc/68/09/98/888680998.db2.gz CFUTWNJIFUDKPR-MRXNPFEDSA-N 0 3 418.488 4.313 20 0 HIADHN CC(C)Sc1ccccc1NC(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000473846808 888693994 /nfs/dbraw/zinc/69/39/94/888693994.db2.gz KKRXLUOVUWTJCW-UHFFFAOYSA-N 0 3 413.587 4.466 20 0 HIADHN C[C@@H](NC(=O)N1CC[C@H](CN(C)Cc2cccnc2)C1)c1cc2cccc(F)c2o1 ZINC000473873909 888737065 /nfs/dbraw/zinc/73/70/65/888737065.db2.gz HTJOWDMTVLGVLQ-SJLPKXTDSA-N 0 3 410.493 4.191 20 0 HIADHN C[C@@H](NC(=O)N(C)C1CCN(CCc2ccccn2)CC1)c1cc2cccc(F)c2o1 ZINC000473928954 888808345 /nfs/dbraw/zinc/80/83/45/888808345.db2.gz RUMMFXTUSMKPGG-QGZVFWFLSA-N 0 3 424.520 4.376 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)N[C@H](C)c2ccc(Br)cn2)N(C)C)cc1 ZINC000473967476 888835586 /nfs/dbraw/zinc/83/55/86/888835586.db2.gz GIIYGTOJQIVOLK-AUUYWEPGSA-N 0 3 419.367 4.070 20 0 HIADHN CSc1cccc(C)c1NC(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000473974596 888839745 /nfs/dbraw/zinc/83/97/45/888839745.db2.gz BANUICPXODMHMQ-QZTJIDSGSA-N 0 3 405.608 4.460 20 0 HIADHN C[C@@H](NC(=O)NC[C@H](c1cccs1)N1CCCC1)c1ccc(Br)cn1 ZINC000473984856 888846672 /nfs/dbraw/zinc/84/66/72/888846672.db2.gz YPLICKRKVOYJOY-CZUORRHYSA-N 0 3 423.380 4.103 20 0 HIADHN CC[C@@H](NCc1nc2ccc(OC)cc2s1)[C@H](c1ccc(C)cc1)n1cncn1 ZINC000473993057 888853492 /nfs/dbraw/zinc/85/34/92/888853492.db2.gz GTFHIMNYWBFCBI-GCJKJVERSA-N 0 3 407.543 4.363 20 0 HIADHN C[C@@H](CC(=O)N(C)c1ccccc1)N[C@H]1CCN(c2ccc(Cl)cc2Cl)C1=O ZINC000474108065 888928414 /nfs/dbraw/zinc/92/84/14/888928414.db2.gz UPRLHMBYJHZSQD-KSSFIOAISA-N 0 3 420.340 4.130 20 0 HIADHN CN(C(=O)NCC1(CCOCc2ccccc2)CC1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000474142238 888967731 /nfs/dbraw/zinc/96/77/31/888967731.db2.gz NNXABYYVZHOCAU-XMMPIXPASA-N 0 3 421.585 4.289 20 0 HIADHN CC(C)c1nc2c([nH]1)C[C@@H](C(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1)CC2 ZINC000474203505 889041876 /nfs/dbraw/zinc/04/18/76/889041876.db2.gz IOWGQRFHDWNZFQ-PXNSSMCTSA-N 0 3 414.619 4.289 20 0 HIADHN CC(C)c1nc2c([nH]1)CC[C@H](C(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1)C2 ZINC000474203505 889041894 /nfs/dbraw/zinc/04/18/94/889041894.db2.gz IOWGQRFHDWNZFQ-PXNSSMCTSA-N 0 3 414.619 4.289 20 0 HIADHN CN(C)CCN(Cc1cccc(O)c1)C(=O)CCCc1cccc(C(F)(F)F)c1 ZINC000474250370 889101335 /nfs/dbraw/zinc/10/13/35/889101335.db2.gz WVGDMZIHUQCJTD-UHFFFAOYSA-N 0 3 408.464 4.324 20 0 HIADHN COc1ccc(CC2CCN(CC(=O)N3CCc4[nH]c5ccccc5c4C3)CC2)cc1 ZINC000504532454 913312503 /nfs/dbraw/zinc/31/25/03/913312503.db2.gz IKBQIZABGHGNEH-UHFFFAOYSA-N 0 3 417.553 4.016 20 0 HIADHN Brc1ccc(CNCc2cc3ccccc3[nH]2)c(N2CCOCC2)c1 ZINC000474357862 889234973 /nfs/dbraw/zinc/23/49/73/889234973.db2.gz RLXAGGPYWVZGRO-UHFFFAOYSA-N 0 3 400.320 4.057 20 0 HIADHN CCOc1ccc(NC(=O)CN2CCN(C[C@@H](c3ccccc3)C(C)C)CC2)cc1 ZINC000474371707 889249013 /nfs/dbraw/zinc/24/90/13/889249013.db2.gz CODQSQKVRXLJDZ-XMMPIXPASA-N 0 3 409.574 4.081 20 0 HIADHN CC(C)c1nc2c([nH]1)C[C@@H](C(=O)NC1CCN(Cc3ccc(Cl)cc3)CC1)CC2 ZINC000474393115 889262304 /nfs/dbraw/zinc/26/23/04/889262304.db2.gz WLHCMCONIYHGSH-KRWDZBQOSA-N 0 3 414.981 4.072 20 0 HIADHN CC(C)c1nc2c([nH]1)CC[C@H](C(=O)NC1CCN(Cc3ccc(Cl)cc3)CC1)C2 ZINC000474393115 889262319 /nfs/dbraw/zinc/26/23/19/889262319.db2.gz WLHCMCONIYHGSH-KRWDZBQOSA-N 0 3 414.981 4.072 20 0 HIADHN CN(C)[C@H](CNC(=O)c1cc(F)c(Br)cc1Cl)Cc1ccccc1 ZINC000474398999 889267537 /nfs/dbraw/zinc/26/75/37/889267537.db2.gz IGBNUBGLESPTHF-ZDUSSCGKSA-N 0 3 413.718 4.144 20 0 HIADHN Fc1cc2c(cc1Br)[C@H](NC1CCN(CCC(F)(F)F)CC1)CO2 ZINC000504554384 913328737 /nfs/dbraw/zinc/32/87/37/913328737.db2.gz KXIGTDSEIZMPOA-CQSZACIVSA-N 0 3 411.237 4.028 20 0 HIADHN C[C@H](CS(=O)(=O)c1ccccc1)N[C@@H]1CCN(c2ccc(Cl)cc2Cl)C1 ZINC000474423076 889287777 /nfs/dbraw/zinc/28/77/77/889287777.db2.gz ZFPPBQSRCUIJCP-GDBMZVCRSA-N 0 3 413.370 4.024 20 0 HIADHN C[C@H](CS(=O)(=O)c1ccccc1)N[C@H]1CCN(c2ccc(Cl)cc2Cl)C1 ZINC000474423081 889287846 /nfs/dbraw/zinc/28/78/46/889287846.db2.gz ZFPPBQSRCUIJCP-ZBFHGGJFSA-N 0 3 413.370 4.024 20 0 HIADHN CC(C)c1nc2c([nH]1)CC[C@@H](C(=O)N[C@H](c1ccccc1)c1ccc3nc[nH]c3c1)C2 ZINC000474428541 889292684 /nfs/dbraw/zinc/29/26/84/889292684.db2.gz UUQWUBIJTAITLY-WZONZLPQSA-N 0 3 413.525 4.420 20 0 HIADHN CC(C)Sc1cccc(Cl)c1CNCCCN1C(=O)NC2(CCCC2)C1=O ZINC000474458720 889324424 /nfs/dbraw/zinc/32/44/24/889324424.db2.gz INLIKRRFYUBVCC-UHFFFAOYSA-N 0 3 409.983 4.185 20 0 HIADHN CCN(C(=O)c1cccc(-c2n[nH]c(C)n2)c1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000474521103 889389799 /nfs/dbraw/zinc/38/97/99/889389799.db2.gz OXHYWTXVESMBEQ-JTSKRJEESA-N 0 3 403.530 4.078 20 0 HIADHN CN(C(=O)Nc1cccc(OCc2cscn2)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000474611433 889476741 /nfs/dbraw/zinc/47/67/41/889476741.db2.gz IHGCAJNZPPZABZ-OAQYLSRUSA-N 0 3 422.554 4.460 20 0 HIADHN CCc1nnc(-c2ccc(NC(=O)N(C)[C@H]3CCN(Cc4ccccc4)C3)cc2)o1 ZINC000474617917 889481872 /nfs/dbraw/zinc/48/18/72/889481872.db2.gz HMQCWFQPWRFKGW-FQEVSTJZSA-N 0 3 405.502 4.037 20 0 HIADHN Cc1cc(Oc2ncccn2)ccc1NC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000474744978 889600669 /nfs/dbraw/zinc/60/06/69/889600669.db2.gz ZUMDCQQUVLAJND-HXUWFJFHSA-N 0 3 417.513 4.316 20 0 HIADHN COc1cccc([C@H](N[C@H](C)C2CCS(=O)(=O)CC2)c2ccccc2Cl)c1 ZINC000474804453 889656983 /nfs/dbraw/zinc/65/69/83/889656983.db2.gz OUZKFGITLDTSGV-VFNWGFHPSA-N 0 3 407.963 4.241 20 0 HIADHN CC(C)[C@H]([NH2+]CCCCc1ccc(Cl)c(Cl)c1)c1nc(-c2nc[n-]n2)no1 ZINC000474804406 889657094 /nfs/dbraw/zinc/65/70/94/889657094.db2.gz ODJQFSUCFQSSPU-HNNXBMFYSA-N 0 3 409.321 4.471 20 0 HIADHN CC(C)[C@H](NCCCCc1ccc(Cl)c(Cl)c1)c1nc(-c2nc[nH]n2)no1 ZINC000474804406 889657103 /nfs/dbraw/zinc/65/71/03/889657103.db2.gz ODJQFSUCFQSSPU-HNNXBMFYSA-N 0 3 409.321 4.471 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)[C@@H](C)Oc2ccccc2Cc2ccccc2)CC1 ZINC000474876773 889730175 /nfs/dbraw/zinc/73/01/75/889730175.db2.gz FPDGJMFMFVPVAQ-OAQYLSRUSA-N 0 3 424.585 4.050 20 0 HIADHN Cn1cc(-c2ncc(CNCCSCc3ccc(Cl)cc3Cl)cn2)cn1 ZINC000474884032 889740177 /nfs/dbraw/zinc/74/01/77/889740177.db2.gz AXVKXPXDCDXDRM-UHFFFAOYSA-N 0 3 408.358 4.207 20 0 HIADHN Cc1cccc(COc2cccc(C(=O)NC3CCN(CCOC(C)C)CC3)c2)c1 ZINC000474886724 889742725 /nfs/dbraw/zinc/74/27/25/889742725.db2.gz KJBVDOUTECIAHN-UHFFFAOYSA-N 0 3 410.558 4.193 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)[C@@H](C)Cc2ccc(Cl)cc2Cl)CC1 ZINC000474890871 889749102 /nfs/dbraw/zinc/74/91/02/889749102.db2.gz BNTRMLWVEBQAJY-HNNXBMFYSA-N 0 3 401.378 4.178 20 0 HIADHN Cc1c2cc(Br)ccc2oc1C(=O)NC1CCN(CCOC(C)C)CC1 ZINC000474895428 889753594 /nfs/dbraw/zinc/75/35/94/889753594.db2.gz WFUKHRIKAGLSLX-UHFFFAOYSA-N 0 3 423.351 4.123 20 0 HIADHN Cc1nc(-c2ccc(C)cc2C)sc1C(=O)NC1CCN(CCOC(C)C)CC1 ZINC000474894965 889753895 /nfs/dbraw/zinc/75/38/95/889753895.db2.gz KSUSGSPKEJSIBT-UHFFFAOYSA-N 0 3 415.603 4.355 20 0 HIADHN CC(C)C1CCC(N2CCN(C(=O)CCc3nc(C4CCCC4)no3)CC2)CC1 ZINC000474945890 889802575 /nfs/dbraw/zinc/80/25/75/889802575.db2.gz TVQHCEXADLTAGF-UHFFFAOYSA-N 0 3 402.583 4.019 20 0 HIADHN C[C@@H](O)CCCN(Cc1ccco1)C[C@H](O)Cn1c2ccccc2c2ccccc21 ZINC000474954169 889809846 /nfs/dbraw/zinc/80/98/46/889809846.db2.gz JOZMRQYQUQXQSW-UXHICEINSA-N 0 3 406.526 4.412 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1cnn(-c2ccc(Cl)cc2Cl)c1 ZINC000474983145 889837443 /nfs/dbraw/zinc/83/74/43/889837443.db2.gz AHGOIMXNGXJYAF-UHFFFAOYSA-N 0 3 422.316 4.368 20 0 HIADHN CCN(C(=O)Nc1ccc(-c2csnn2)cc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475001003 889851795 /nfs/dbraw/zinc/85/17/95/889851795.db2.gz MNUGGFNSBBYMLO-FQEVSTJZSA-N 0 3 407.543 4.333 20 0 HIADHN CCN(C(=O)Nc1ccc(OCCOC)cc1C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475002081 889852993 /nfs/dbraw/zinc/85/29/93/889852993.db2.gz GXIZURNFKRHPIC-NRFANRHFSA-N 0 3 411.546 4.149 20 0 HIADHN CCN(C(=O)Nc1ccc(OCCOC)cc1C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475002083 889853423 /nfs/dbraw/zinc/85/34/23/889853423.db2.gz GXIZURNFKRHPIC-OAQYLSRUSA-N 0 3 411.546 4.149 20 0 HIADHN CCN(CC)C(=O)c1ccc(NC(=O)N(CC)[C@@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000475003659 889855996 /nfs/dbraw/zinc/85/59/96/889855996.db2.gz XBDNJMDOSVKCAF-HSZRJFAPSA-N 0 3 422.573 4.297 20 0 HIADHN CC(C)[C@@H](NC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1)c1ccc2c(c1)OCCO2 ZINC000475007958 889860665 /nfs/dbraw/zinc/86/06/65/889860665.db2.gz JZWJFYDZAPYXOT-XUZZJYLKSA-N 0 3 423.557 4.071 20 0 HIADHN CCN(C(=O)Nc1cnn(-c2ccccc2)c1C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475011021 889865702 /nfs/dbraw/zinc/86/57/02/889865702.db2.gz RJQYJYLWBGYLQB-JOCHJYFZSA-N 0 3 403.530 4.309 20 0 HIADHN CCN(C(=O)Nc1cnn(-c2ccccc2F)c1C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475013036 889866617 /nfs/dbraw/zinc/86/66/17/889866617.db2.gz HQCSKRPXCBTRDO-FQEVSTJZSA-N 0 3 421.520 4.448 20 0 HIADHN CCN(C(=O)Nc1ccc2ccn(CCOC)c2c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475020514 889872782 /nfs/dbraw/zinc/87/27/82/889872782.db2.gz ZTKHOLLLRZSJII-QHCPKHFHSA-N 0 3 420.557 4.416 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)Nc1ccccc1OCC(F)F ZINC000475033745 889885339 /nfs/dbraw/zinc/88/53/39/889885339.db2.gz LCDSAOASEVJQKE-UHFFFAOYSA-N 0 3 413.415 4.204 20 0 HIADHN C[C@H](CCN1CCCN(C(=O)c2ccc(Cl)cc2)CC1)OCc1ccccc1 ZINC000475053435 889899380 /nfs/dbraw/zinc/89/93/80/889899380.db2.gz JOGARDDIWJVANG-LJQANCHMSA-N 0 3 400.950 4.483 20 0 HIADHN CN(Cc1ccc(F)c(C(F)(F)F)c1)C[C@@H]1C[C@H](F)CN1Cc1nccs1 ZINC000475103350 889950371 /nfs/dbraw/zinc/95/03/71/889950371.db2.gz XWQLWVHKOGSCQP-KBPBESRZSA-N 0 3 405.436 4.345 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N(C)Cc1nc2c(s1)CCCC2)c1ccsc1 ZINC000475137570 890004015 /nfs/dbraw/zinc/00/40/15/890004015.db2.gz KLDMPHUKWQDZIF-KRWDZBQOSA-N 0 3 406.621 4.308 20 0 HIADHN CCN(C(=O)N[C@H](C[C@@H]1CCOC1)c1ccccc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475166005 890031056 /nfs/dbraw/zinc/03/10/56/890031056.db2.gz UPQHCIMZHUBWTK-ZKMPZPQNSA-N 0 3 421.585 4.460 20 0 HIADHN CCN(C(=O)NCc1csc(-c2ccco2)n1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475174222 890042032 /nfs/dbraw/zinc/04/20/32/890042032.db2.gz UYQHDRPPLYDRKX-LJQANCHMSA-N 0 3 410.543 4.209 20 0 HIADHN CCN(C(=O)NCc1nc2ccccc2n1C1CC1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475183979 890054241 /nfs/dbraw/zinc/05/42/41/890054241.db2.gz RUMQWWQPKYGCCP-OAQYLSRUSA-N 0 3 417.557 4.177 20 0 HIADHN CSCc1cc(F)ccc1CNC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475285218 890183683 /nfs/dbraw/zinc/18/36/83/890183683.db2.gz MBRCHGUXAOOBKZ-OAQYLSRUSA-N 0 3 401.551 4.105 20 0 HIADHN COc1ccc([C@@H](CNC(=O)[C@H](C)c2cn(C)c3ccccc23)N2CCCC2)cc1 ZINC000475285390 890186152 /nfs/dbraw/zinc/18/61/52/890186152.db2.gz GTTSKPNLGXQEOI-HOYKHHGWSA-N 0 3 405.542 4.244 20 0 HIADHN CN(C(=O)CCc1ncc(-c2ccccc2F)o1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475300511 890208522 /nfs/dbraw/zinc/20/85/22/890208522.db2.gz AQQSIZSQKZJGFP-LJQANCHMSA-N 0 3 407.489 4.146 20 0 HIADHN CC[C@H](C)n1ncc2c1nc(C)cc2C(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475303420 890212022 /nfs/dbraw/zinc/21/20/22/890212022.db2.gz ICFJHKUFGOEMDY-ICSRJNTNSA-N 0 3 405.546 4.057 20 0 HIADHN Cc1nc2ccc(C(=O)N(CCN(C)C)Cc3cccc(C(F)(F)F)c3)cc2n1C ZINC000475313855 890228795 /nfs/dbraw/zinc/22/87/95/890228795.db2.gz PJZVZRXSPWMSAH-UHFFFAOYSA-N 0 3 418.463 4.105 20 0 HIADHN CN(C(=O)C1(c2ccc(Cl)cc2)CCOCC1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475322059 890242514 /nfs/dbraw/zinc/24/25/14/890242514.db2.gz YXMXGIYOWLUHAV-JOCHJYFZSA-N 0 3 412.961 4.121 20 0 HIADHN CN(C(=O)[C@@H]1C[C@@H]1c1ccccc1OC(F)F)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475423557 890344719 /nfs/dbraw/zinc/34/47/19/890344719.db2.gz QWOLOPVQZZXSRZ-DFQSSKMNSA-N 0 3 400.469 4.124 20 0 HIADHN O=C1c2ccccc2C(=O)N1C1CCC(NCc2c(F)cccc2OC(F)F)CC1 ZINC000475434525 890352695 /nfs/dbraw/zinc/35/26/95/890352695.db2.gz JYYOTGNGOGRBKD-UHFFFAOYSA-N 0 3 418.415 4.124 20 0 HIADHN CN(C(=O)N[C@@H]1C[C@H]1c1ccc(OC(F)F)cc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475485586 890391377 /nfs/dbraw/zinc/39/13/77/890391377.db2.gz GYFKITWPFCSTRG-HLAWJBBLSA-N 0 3 415.484 4.060 20 0 HIADHN Cc1nc(CC2CC2)oc1C(=O)N(CCN1CCCC1)Cc1ccc(Cl)cc1 ZINC000475502719 890414884 /nfs/dbraw/zinc/41/48/84/890414884.db2.gz JTPVNFVQKRRXGQ-UHFFFAOYSA-N 0 3 401.938 4.327 20 0 HIADHN CCOc1cc(CN[C@H]2CCCc3ccc(F)cc32)ccc1O[C@@H](C)C(=O)N(C)C ZINC000475503756 890417471 /nfs/dbraw/zinc/41/74/71/890417471.db2.gz SYCCVJAQPGFINC-KKSFZXQISA-N 0 3 414.521 4.247 20 0 HIADHN COCc1cnc(CN[C@H](C)CCc2ccc(I)cc2)s1 ZINC000475508553 890423923 /nfs/dbraw/zinc/42/39/23/890423923.db2.gz JIGPRAJCCXIQNX-GFCCVEGCSA-N 0 3 416.328 4.005 20 0 HIADHN CN(C(=O)N[C@@H]1CC[C@H](c2cccc(F)c2)C1)C1CCN(CCc2ccccn2)CC1 ZINC000475522456 890444856 /nfs/dbraw/zinc/44/48/56/890444856.db2.gz IFOSFMKDQPINGB-NZQKXSOJSA-N 0 3 424.564 4.205 20 0 HIADHN CN(C(=O)c1cc2cc(Br)ccc2[nH]1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475542465 890466810 /nfs/dbraw/zinc/46/68/10/890466810.db2.gz WNUUYHJVCLVVLK-GOSISDBHSA-N 0 3 412.331 4.277 20 0 HIADHN CN(C(=O)c1c[nH]c2ccc(Br)cc12)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475544532 890468482 /nfs/dbraw/zinc/46/84/82/890468482.db2.gz GQPUMXATSJZWFY-QGZVFWFLSA-N 0 3 412.331 4.277 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)cc1C(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475544161 890468605 /nfs/dbraw/zinc/46/86/05/890468605.db2.gz GQUKNSREVGQDQZ-NRFANRHFSA-N 0 3 408.933 4.181 20 0 HIADHN CN(C(=O)c1ccc(OCc2ccncc2)cc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475543700 890468650 /nfs/dbraw/zinc/46/86/50/890468650.db2.gz FKPZJPRKSINJCK-HSZRJFAPSA-N 0 3 401.510 4.007 20 0 HIADHN Cc1ccc(C(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)cc1NC(=O)NC(C)(C)C ZINC000475553456 890479056 /nfs/dbraw/zinc/47/90/56/890479056.db2.gz KDSWSUNTGPIQLQ-OAQYLSRUSA-N 0 3 422.573 4.262 20 0 HIADHN CC(C)(CNC(=O)N1CCc2[nH]c3ccccc3c2C1)N1CCc2ccccc2C1 ZINC000504733246 913470396 /nfs/dbraw/zinc/47/03/96/913470396.db2.gz WCUWADJAHFLHJN-UHFFFAOYSA-N 0 3 402.542 4.073 20 0 HIADHN Cc1csc(-c2ccc(NC(=O)NC3CCN(CCOC(C)C)CC3)cc2)n1 ZINC000475629448 890569449 /nfs/dbraw/zinc/56/94/49/890569449.db2.gz ZOPLKAUERWNTAF-UHFFFAOYSA-N 0 3 402.564 4.129 20 0 HIADHN C[C@H](CC(=O)Nc1ccccc1)N[C@H](CO)c1ccc(Cl)cc1C(F)(F)F ZINC000475638464 890578942 /nfs/dbraw/zinc/57/89/42/890578942.db2.gz PECYSAVIIMIIPJ-SJKOYZFVSA-N 0 3 400.828 4.399 20 0 HIADHN COc1cccc([C@@H](CNC(=O)Nc2cc(-n3cccn3)ccc2C)N2CCCC2)c1 ZINC000475644121 890585792 /nfs/dbraw/zinc/58/57/92/890585792.db2.gz YGHFRVOFJJAUSY-HSZRJFAPSA-N 0 3 419.529 4.148 20 0 HIADHN CCN(C(=O)c1ccn(-c2c(F)cccc2F)n1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000475656208 890601478 /nfs/dbraw/zinc/60/14/78/890601478.db2.gz MNWSFBAHDNVLEJ-PKOBYXMFSA-N 0 3 424.495 4.448 20 0 HIADHN COc1cccc(-c2nc(CN3CCC[C@@]3(CO)Cc3ccccc3)cs2)c1OC ZINC000475656658 890602789 /nfs/dbraw/zinc/60/27/89/890602789.db2.gz PKYBMASDCMPMPF-DEOSSOPVSA-N 0 3 424.566 4.397 20 0 HIADHN COc1ccc(-c2nc(CN3CCC[C@]3(CO)Cc3ccccc3)cs2)cc1OC ZINC000475671581 890615275 /nfs/dbraw/zinc/61/52/75/890615275.db2.gz QKHXPFXWMZKNFP-XMMPIXPASA-N 0 3 424.566 4.397 20 0 HIADHN CCc1nnc(-c2ccc(NC(=O)N[C@H]3CCCN(Cc4ccccc4)C3)cc2)o1 ZINC000475676367 890618938 /nfs/dbraw/zinc/61/89/38/890618938.db2.gz BCDKZEMVBIFJFN-FQEVSTJZSA-N 0 3 405.502 4.085 20 0 HIADHN O=C(CN1CCC[C@]1(CO)Cc1ccccc1)Nc1ccccc1-c1ccccc1 ZINC000475686039 890627057 /nfs/dbraw/zinc/62/70/57/890627057.db2.gz JKTDWKCLGJHXCQ-AREMUKBSSA-N 0 3 400.522 4.362 20 0 HIADHN CC(=O)Nc1ccc(S(=O)(=O)CCCN[C@H](C)c2cc3cccc(F)c3o2)cc1 ZINC000475689087 890630274 /nfs/dbraw/zinc/63/02/74/890630274.db2.gz BYIRUOICYZUEBZ-CQSZACIVSA-N 0 3 418.490 4.045 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)N[C@H]2C[C@H](c3ccc(Cl)cc3)C2)CC1 ZINC000475703241 890641603 /nfs/dbraw/zinc/64/16/03/890641603.db2.gz VVESMVSXMOWJJE-UAPYVXQJSA-N 0 3 401.938 4.485 20 0 HIADHN CCc1nnc(-c2ccc(NC(=O)NC[C@@H](CC)N3CCc4ccccc4C3)cc2)o1 ZINC000475710672 890648197 /nfs/dbraw/zinc/64/81/97/890648197.db2.gz SCXFESNOQFBIFB-OAQYLSRUSA-N 0 3 419.529 4.257 20 0 HIADHN CCc1nnc(-c2ccc(NC(=O)NC[C@H]3CCCN3Cc3ccccc3)cc2)o1 ZINC000475712788 890650207 /nfs/dbraw/zinc/65/02/07/890650207.db2.gz ZPEYCXQHKGZDNC-HXUWFJFHSA-N 0 3 405.502 4.085 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)CCN(C)[C@@H](C)c1ccc([S@@](C)=O)cc1 ZINC000475743716 890685771 /nfs/dbraw/zinc/68/57/71/890685771.db2.gz KJZCXSHWKZPXGH-PGGUUEOZSA-N 0 3 408.951 4.108 20 0 HIADHN CN(C(=O)Nc1cc(-c2ccccc2)ns1)C1CCN(CCc2ccccn2)CC1 ZINC000475799547 890735562 /nfs/dbraw/zinc/73/55/62/890735562.db2.gz SJRKKTFKIZHQHT-UHFFFAOYSA-N 0 3 421.570 4.376 20 0 HIADHN CC(C)n1cc2cc(NC(=O)N(CCN(C)C)Cc3ccc(F)c(F)c3)ccc2n1 ZINC000475820185 890754734 /nfs/dbraw/zinc/75/47/34/890754734.db2.gz WVHGOSBSWFZRCM-UHFFFAOYSA-N 0 3 415.488 4.491 20 0 HIADHN Cc1cc(NC(=O)c2oc(CC(C)C)nc2C)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000475908134 890836657 /nfs/dbraw/zinc/83/66/57/890836657.db2.gz YCVSJEQKOCZUBG-FQEVSTJZSA-N 0 3 421.545 4.386 20 0 HIADHN COc1ccc(C(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)c(OC(F)F)c1 ZINC000475926716 890851996 /nfs/dbraw/zinc/85/19/96/890851996.db2.gz BOFFEEGRLGWMPR-INIZCTEOSA-N 0 3 404.457 4.033 20 0 HIADHN Cc1nc2ccccc2n1CCC(=O)Nc1ccc(CN2CCSCC2)cc1C ZINC000475933144 890857984 /nfs/dbraw/zinc/85/79/84/890857984.db2.gz ZCHGRRPONLESNL-UHFFFAOYSA-N 0 3 408.571 4.231 20 0 HIADHN CSc1ccc(NC(=O)N2CCC(CN3C[C@@H](C)O[C@H](C)C3)CC2)cc1Cl ZINC000475971135 890888908 /nfs/dbraw/zinc/88/89/08/890888908.db2.gz ZRWOWDKFQZCEDB-HUUCEWRRSA-N 0 3 411.999 4.415 20 0 HIADHN C[C@@H](NC(=O)NC[C@@H](Cc1ccccc1)N(C)C)c1ccc(-c2cccnc2)cc1 ZINC000475972201 890889817 /nfs/dbraw/zinc/88/98/17/890889817.db2.gz CWAXXQRKMXMAGV-NTKDMRAZSA-N 0 3 402.542 4.282 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2cccc3c2CN(CC(F)(F)F)C3)[C@H]1c1ccccc1 ZINC000504768770 913500115 /nfs/dbraw/zinc/50/01/15/913500115.db2.gz AXMSIQBDURCPBX-WOJBJXKFSA-N 0 3 418.463 4.131 20 0 HIADHN Cc1nc(C)c(CNC(=O)N[C@H](CN2CCc3ccccc3C2)C(C)(C)C)s1 ZINC000476020508 890953715 /nfs/dbraw/zinc/95/37/15/890953715.db2.gz IEAYFTLSWPPOFR-HXUWFJFHSA-N 0 3 400.592 4.032 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N[C@H](C)Cc2ccc(Cl)cc2Cl)CC1 ZINC000476036112 890967397 /nfs/dbraw/zinc/96/73/97/890967397.db2.gz VZFSFOKMHBYYPJ-OAHLLOKOSA-N 0 3 416.393 4.113 20 0 HIADHN Cc1nc([C@H](C)NC(=O)N[C@H](CN2CCc3ccccc3C2)C(C)(C)C)cs1 ZINC000476052549 890982102 /nfs/dbraw/zinc/98/21/02/890982102.db2.gz UNFFOAKBXINYDL-MGPUTAFESA-N 0 3 400.592 4.285 20 0 HIADHN CN(C)CCN(C)C(=O)NCc1ccc(Oc2ccc(Oc3ccccc3)cc2)nc1 ZINC000476063528 890993285 /nfs/dbraw/zinc/99/32/85/890993285.db2.gz RGXSNZZEZPDOEM-UHFFFAOYSA-N 0 3 420.513 4.369 20 0 HIADHN CSc1cnn(-c2ccccc2)c1NC(=O)N[C@H](C)[C@@H](c1ccccc1)N(C)C ZINC000476131235 891053236 /nfs/dbraw/zinc/05/32/36/891053236.db2.gz CYTRKRMLKRFINL-UZLBHIALSA-N 0 3 409.559 4.407 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)N1CCCC2(CCCCC2)C1 ZINC000476132216 891054115 /nfs/dbraw/zinc/05/41/15/891054115.db2.gz DMTANLFFSRCQGW-UHFFFAOYSA-N 0 3 412.622 4.345 20 0 HIADHN CN(C)C[C@@H](NC(=O)NCCc1nc2cc(Cl)ccc2s1)c1ccc(F)cc1 ZINC000476132248 891054749 /nfs/dbraw/zinc/05/47/49/891054749.db2.gz CLBRMQCKFFPPHR-QGZVFWFLSA-N 0 3 420.941 4.233 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)N[C@H]2CCSc3ccc(Cl)cc32)cc1 ZINC000476203668 891133876 /nfs/dbraw/zinc/13/38/76/891133876.db2.gz FQVJQUPQFJWWKZ-RBUKOAKNSA-N 0 3 419.978 4.488 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccc(O)cc1)C(=O)c1sc(CC2CC2)nc1C ZINC000476335327 891241489 /nfs/dbraw/zinc/24/14/89/891241489.db2.gz SRDFXJZMXJFEDO-LJQANCHMSA-N 0 3 413.587 4.236 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N(Cc2ccc(C(C)C)cc2)C2CC2)CC1 ZINC000476437662 891349733 /nfs/dbraw/zinc/34/97/33/891349733.db2.gz RMNJUIJLLVSPTH-UHFFFAOYSA-N 0 3 401.595 4.373 20 0 HIADHN CCc1ccc([C@H]2C[C@@H](C)CCN2C(=O)NC2CCN(CCOC(C)C)CC2)o1 ZINC000476451730 891363913 /nfs/dbraw/zinc/36/39/13/891363913.db2.gz LAHSKVPUYHFSNW-GHTZIAJQSA-N 0 3 405.583 4.214 20 0 HIADHN COc1cccc(COCc2noc(-c3ccc(CN4CCSCC4)cc3)n2)c1 ZINC000504838240 913561553 /nfs/dbraw/zinc/56/15/53/913561553.db2.gz FBOAUQJDCJBJHV-UHFFFAOYSA-N 0 3 411.527 4.011 20 0 HIADHN C[C@@H]1CC[C@@H](C)N1CC(=O)N[C@@H](Cc1ccccn1)c1ccc(Br)cc1 ZINC000476538119 891452601 /nfs/dbraw/zinc/45/26/01/891452601.db2.gz GVHARADHTATJPK-QINHECLXSA-N 0 3 416.363 4.117 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1c(SC)cnn1-c1ccccc1)c1ccco1 ZINC000476558646 891477057 /nfs/dbraw/zinc/47/70/57/891477057.db2.gz BDSWVZUAWLQKHN-DOTOQJQBSA-N 0 3 413.547 4.438 20 0 HIADHN CCN(C[C@@H]1CCN(CC(=O)N(C)[C@H](C)c2ccc(Cl)cc2)C1)CC(F)(F)F ZINC000476579996 891505635 /nfs/dbraw/zinc/50/56/35/891505635.db2.gz WIAJSYNADVMCET-CVEARBPZSA-N 0 3 419.919 4.066 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N(C)[C@H]2CCCc3nc(C)sc32)N(C)C)cc1 ZINC000476622645 891557452 /nfs/dbraw/zinc/55/74/52/891557452.db2.gz FKBXATYMVBRYJI-PMACEKPBSA-N 0 3 400.592 4.336 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCC[C@H](C(F)(F)F)[C@@H]1C)c1cccc(OC)c1 ZINC000476713283 891674336 /nfs/dbraw/zinc/67/43/36/891674336.db2.gz GRSRLVYIXHRMHY-ZYSHUDEJSA-N 0 3 415.500 4.451 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)NCc1c(C)nn(Cc2ccccc2)c1C)c1ccco1 ZINC000476960753 891892322 /nfs/dbraw/zinc/89/23/22/891892322.db2.gz KKGBMQGHZSGJGC-JTSKRJEESA-N 0 3 423.561 4.070 20 0 HIADHN COc1ccc([C@H]2CCCCCN2C(=O)CN2CCC[C@@]3(CCCOC3)C2)cc1 ZINC000477051833 891981715 /nfs/dbraw/zinc/98/17/15/891981715.db2.gz TVAYDVLMGXGTKH-ISKFKSNPSA-N 0 3 400.563 4.032 20 0 HIADHN COCCN1CCC[C@H]1CNC(=O)N(Cc1ccc(C)cc1)[C@H]1CCc2ccccc21 ZINC000477112299 892043759 /nfs/dbraw/zinc/04/37/59/892043759.db2.gz UVQJNNIAWUGHDZ-ZCYQVOJMSA-N 0 3 421.585 4.305 20 0 HIADHN C[C@@H](NC(=O)N[C@@H](Cc1cccc(Br)c1)CC1CC1)C1=CCN(C)CC1 ZINC000477179605 892098705 /nfs/dbraw/zinc/09/87/05/892098705.db2.gz GTEFHLZIRQRBSZ-FOIQADDNSA-N 0 3 420.395 4.110 20 0 HIADHN Cc1ccnc(Oc2ccc(NC(=O)N[C@H](C)[C@H](c3ccccc3)N(C)C)cc2)n1 ZINC000477183886 892103676 /nfs/dbraw/zinc/10/36/76/892103676.db2.gz AJZPIBJAVFZSOY-DYESRHJHSA-N 0 3 405.502 4.390 20 0 HIADHN COc1cc(OC)c(NC(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)cc1F ZINC000477193613 892118144 /nfs/dbraw/zinc/11/81/44/892118144.db2.gz WUUVMWUQZWIGCK-LJQANCHMSA-N 0 3 419.497 4.055 20 0 HIADHN Cc1nc([C@H]2CCCN2C(=O)N[C@H](CN(C)Cc2ccccc2)C(C)C)cs1 ZINC000477213584 892143707 /nfs/dbraw/zinc/14/37/07/892143707.db2.gz GYXNHSDHZYIRLG-TZIWHRDSSA-N 0 3 400.592 4.455 20 0 HIADHN COc1ccc(Cl)cc1N1CC[C@@H](NCc2cnn(-c3ccc(F)cc3)c2)C1 ZINC000477212236 892145318 /nfs/dbraw/zinc/14/53/18/892145318.db2.gz ATNCBRHQXRGLPJ-GOSISDBHSA-N 0 3 400.885 4.042 20 0 HIADHN Cc1nc([C@@H](C)N2CCC[C@@H](CN3CCOCC3)C2)oc1-c1ccc(Cl)cc1 ZINC000477290794 892249198 /nfs/dbraw/zinc/24/91/98/892249198.db2.gz JEQWIIRLGVFYMW-MSOLQXFVSA-N 0 3 403.954 4.409 20 0 HIADHN C[C@H](CNC(=O)N(CCc1ccccc1)Cc1cccnc1)N(C)Cc1ccccc1 ZINC000477338275 892307634 /nfs/dbraw/zinc/30/76/34/892307634.db2.gz LXYOICOPNLGTRA-JOCHJYFZSA-N 0 3 416.569 4.356 20 0 HIADHN C[C@H](CNC(=O)N(Cc1cccc(F)c1)C[C@H]1CCCO1)N(C)Cc1ccccc1 ZINC000477339545 892308050 /nfs/dbraw/zinc/30/80/50/892308050.db2.gz HHZDNXWNSFBRNR-AUSIDOKSSA-N 0 3 413.537 4.037 20 0 HIADHN CCn1ncc2ccc(NC(=O)NC[C@H](C(C)C)N3CCc4ccccc4C3)cc21 ZINC000477441735 892392683 /nfs/dbraw/zinc/39/26/83/892392683.db2.gz HBCYLVPXTDUWAS-HSZRJFAPSA-N 0 3 405.546 4.261 20 0 HIADHN C[C@@H](NC(=O)N(C)[C@H]1CCN(C2CC2)C1)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000477445378 892396870 /nfs/dbraw/zinc/39/68/70/892396870.db2.gz PMQBTAUZLFCKBX-VGSWGCGISA-N 0 3 411.521 4.344 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@@H](C)N[C@@H](C)c2ccc(F)c(OC)c2)cc1 ZINC000504926824 913665222 /nfs/dbraw/zinc/66/52/22/913665222.db2.gz KRYNWKAQMOEQCU-CVEARBPZSA-N 0 3 408.539 4.277 20 0 HIADHN Cc1ccc(-n2ncc(C(=O)NCCCN3CCc4ccccc4C3)c2C(C)C)cc1 ZINC000477506367 892514225 /nfs/dbraw/zinc/51/42/25/892514225.db2.gz FGVSPPKAYWQTAR-UHFFFAOYSA-N 0 3 416.569 4.482 20 0 HIADHN CC1CCC(N(Cc2ccc3c(c2)OCO3)Cc2cc(=O)n3ccsc3n2)CC1 ZINC000477599033 892677388 /nfs/dbraw/zinc/67/73/88/892677388.db2.gz HGSCFPZUEGCPNC-UHFFFAOYSA-N 0 3 411.527 4.066 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1cccc(-c2cscn2)c1 ZINC000477695191 892813881 /nfs/dbraw/zinc/81/38/81/892813881.db2.gz AMOOYCGQBGABBA-UHFFFAOYSA-N 0 3 407.539 4.267 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1cccc(Oc2ccncc2)c1 ZINC000477715119 892823492 /nfs/dbraw/zinc/82/34/92/892823492.db2.gz IHQFQKFAFPYJTR-UHFFFAOYSA-N 0 3 417.509 4.331 20 0 HIADHN CSc1ccc(O[C@@H](C)C(=O)Nc2cccc(CN3CCC(CO)CC3)c2)cc1 ZINC000477723413 892827383 /nfs/dbraw/zinc/82/73/83/892827383.db2.gz IXZRBAJKBGOPFN-KRWDZBQOSA-N 0 3 414.571 4.019 20 0 HIADHN CC(C)[C@@H]1CC[C@@H](C)C[C@@H]1OCC(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000477749514 892842234 /nfs/dbraw/zinc/84/22/34/892842234.db2.gz ZPGYQMNOGGDKQE-YGOYIFOWSA-N 0 3 416.606 4.307 20 0 HIADHN C[C@H](NC(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C)c1nc2ccccc2n1C(F)F ZINC000477877577 892937914 /nfs/dbraw/zinc/93/79/14/892937914.db2.gz KQXMHFMPDNOMRK-DOXZYTNZSA-N 0 3 415.488 4.483 20 0 HIADHN CC(C)c1ccc(NC(=O)C[C@@H](C)N[C@@H]2CCN(Cc3ccc(F)cc3)C2=O)cc1 ZINC000477920092 893006361 /nfs/dbraw/zinc/00/63/61/893006361.db2.gz UJDFNUPYLHZEJP-VGOFRKELSA-N 0 3 411.521 4.057 20 0 HIADHN Cc1ccc(CN2CC[C@H](N[C@@H](C)CC(=O)Nc3cc(Cl)ccc3C)C2=O)cc1 ZINC000477937522 893025661 /nfs/dbraw/zinc/02/56/61/893025661.db2.gz ZTJARGBQBCZHBN-PXNSSMCTSA-N 0 3 413.949 4.065 20 0 HIADHN Cc1ccc(C[C@@H](NCc2ccc(S(=O)(=O)CCO)cc2)c2ccc(C)cc2)cc1 ZINC000477943493 893033720 /nfs/dbraw/zinc/03/37/20/893033720.db2.gz LLELDLLTHKHXPN-RUZDIDTESA-N 0 3 423.578 4.143 20 0 HIADHN O=C(CSCc1cccnc1)N(CCN1CCCC1)Cc1ccc(Cl)cc1 ZINC000477985027 893085585 /nfs/dbraw/zinc/08/55/85/893085585.db2.gz DUROHLICAXVIOS-UHFFFAOYSA-N 0 3 403.979 4.093 20 0 HIADHN CCCN(C(=O)c1cc2ccccc2[nH]c1=O)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000504994683 913739527 /nfs/dbraw/zinc/73/95/27/913739527.db2.gz RTXVKZDAKXEXST-NRFANRHFSA-N 0 3 403.526 4.457 20 0 HIADHN CC(C)[C@@H](CNC(=O)c1ccc(-c2cncnc2)cc1F)N1CCc2ccccc2C1 ZINC000478069906 893232353 /nfs/dbraw/zinc/23/23/53/893232353.db2.gz XSSBMOUJKIBLHG-XMMPIXPASA-N 0 3 418.516 4.095 20 0 HIADHN CC(C)CCn1ccc(NC(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)n1 ZINC000478144220 893314816 /nfs/dbraw/zinc/31/48/16/893314816.db2.gz KMEFZRSJLAOZNS-FQEVSTJZSA-N 0 3 401.555 4.141 20 0 HIADHN O=C(N[C@@H]1C[C@H]1c1ccc(OC(F)F)cc1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000478176565 893342074 /nfs/dbraw/zinc/34/20/74/893342074.db2.gz IHVSBCLIGSOSSZ-DZFGPLHGSA-N 0 3 418.459 4.311 20 0 HIADHN COCCC(=O)N1CCC(NCc2c(Cl)cccc2Oc2ccccc2)CC1 ZINC000478301313 893518417 /nfs/dbraw/zinc/51/84/17/893518417.db2.gz WCAPKSFOEDFYKY-UHFFFAOYSA-N 0 3 402.922 4.249 20 0 HIADHN CC(C)(NCc1ccc(Br)c2cccnc12)C(=O)NCC1CCCC1 ZINC000478306140 893527462 /nfs/dbraw/zinc/52/74/62/893527462.db2.gz SKCVXWGPCAEVSG-UHFFFAOYSA-N 0 3 404.352 4.172 20 0 HIADHN CC1CCN(CCNC(=O)c2ccc(Oc3ccc(C(F)(F)F)cn3)cc2)CC1 ZINC000478310967 893533750 /nfs/dbraw/zinc/53/37/50/893533750.db2.gz IMSLZYZYBYQSBK-UHFFFAOYSA-N 0 3 407.436 4.354 20 0 HIADHN Cc1ccc(-c2nnc(-c3ccc(C(=O)NCCN4CCC(C)CC4)cc3)o2)cc1 ZINC000478318336 893544834 /nfs/dbraw/zinc/54/48/34/893544834.db2.gz UKFHWGJNHTYCOP-UHFFFAOYSA-N 0 3 404.514 4.174 20 0 HIADHN CN1C[C@H](NC(=O)c2cccc(NC(=O)C3CCCCC3)c2)[C@@H](c2ccccc2)C1 ZINC000478373899 893638001 /nfs/dbraw/zinc/63/80/01/893638001.db2.gz VPWOUXFRYZFVIX-PKTZIBPZSA-N 0 3 405.542 4.033 20 0 HIADHN C[C@@H](NC(=O)N(C)C1CCN(CCc2ccccn2)CC1)c1c(F)cccc1Cl ZINC000478382967 893654149 /nfs/dbraw/zinc/65/41/49/893654149.db2.gz BMBPMQDHSPFXIR-MRXNPFEDSA-N 0 3 418.944 4.284 20 0 HIADHN O=C(N[C@H](c1ccccc1)c1ccccn1)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000505105589 913820131 /nfs/dbraw/zinc/82/01/31/913820131.db2.gz QMWHNOLKWAMFBE-JTHBVZDNSA-N 0 3 421.491 4.445 20 0 HIADHN CC(C)c1csc(CNC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)n1 ZINC000478724308 893997703 /nfs/dbraw/zinc/99/77/03/893997703.db2.gz ZQCOLGFTFZQYFJ-IBGZPJMESA-N 0 3 411.493 4.337 20 0 HIADHN Cc1c2ccccc2oc1[C@H](C)NC(=O)NCc1ccc(CN2CCN(C)CC2)cc1 ZINC000478786855 894061349 /nfs/dbraw/zinc/06/13/49/894061349.db2.gz LTMCXHKDFGKZFK-IBGZPJMESA-N 0 3 420.557 4.049 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)NCc2ccc3[nH]c(C)c(C)c3c2)c1 ZINC000478791817 894066737 /nfs/dbraw/zinc/06/67/37/894066737.db2.gz GDMWJTRDGAKHRV-UHFFFAOYSA-N 0 3 408.546 4.067 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N2CC3(CCOCC3)c3ccccc32)C1 ZINC000478793321 894068860 /nfs/dbraw/zinc/06/88/60/894068860.db2.gz IMOLWIMELVQWRL-TZIWHRDSSA-N 0 3 405.542 4.100 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@@H]2CN[C@@H](C(N)=O)c2cccc(Br)c2)cc1 ZINC000478799300 894073358 /nfs/dbraw/zinc/07/33/58/894073358.db2.gz ITAGELSDGZEEQR-RLLQIKCJSA-N 0 3 417.347 4.041 20 0 HIADHN COc1ccccc1C[C@@H]1CCCN1C(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000478920020 894200629 /nfs/dbraw/zinc/20/06/29/894200629.db2.gz CCIACOQRBHUOPQ-GMAHTHKFSA-N 0 3 410.533 4.280 20 0 HIADHN COc1cc(Br)cc(NC(=O)N[C@H](CN(C)C)c2ccc(F)cc2)c1 ZINC000478949053 894231457 /nfs/dbraw/zinc/23/14/57/894231457.db2.gz HFMILSJAQIRWLG-QGZVFWFLSA-N 0 3 410.287 4.021 20 0 HIADHN O=C(CCc1ccccc1)N1CC[C@H](N[C@@H]2CCCc3nn(-c4ccccc4)cc32)C1 ZINC000479062404 894321594 /nfs/dbraw/zinc/32/15/94/894321594.db2.gz BBFHRJDLFAMIFM-XUZZJYLKSA-N 0 3 414.553 4.073 20 0 HIADHN CC(C)[C@H](CN[C@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl)c1cccnc1 ZINC000479070173 894334643 /nfs/dbraw/zinc/33/46/43/894334643.db2.gz ZSUQDBSHGYZALL-DOMZBBRYSA-N 0 3 416.374 4.126 20 0 HIADHN Fc1cc(Br)ccc1[C@@H](NCc1cccc(-n2cncn2)c1)C1CC1 ZINC000479073155 894337826 /nfs/dbraw/zinc/33/78/26/894337826.db2.gz DBSPPSHKUBALMZ-IBGZPJMESA-N 0 3 401.283 4.410 20 0 HIADHN C[C@@H](NCCc1ccc(Cl)s1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479073531 894338867 /nfs/dbraw/zinc/33/88/67/894338867.db2.gz XOTUQNSFAXGVNH-MRVPVSSYSA-N 0 3 413.779 4.249 20 0 HIADHN Cc1cccc([C@H](C)CN[C@@H](C)c2cc(S(N)(=O)=O)c(Cl)cc2Cl)c1 ZINC000479084022 894350952 /nfs/dbraw/zinc/35/09/52/894350952.db2.gz WTLABRVINFWIRM-OLZOCXBDSA-N 0 3 401.359 4.404 20 0 HIADHN O=S(=O)(c1ccc(CN[C@@H]2CCc3ccc(Cl)cc32)cc1)N1CCCCC1 ZINC000479255049 894520545 /nfs/dbraw/zinc/52/05/45/894520545.db2.gz NGVHFCVEJXIXSZ-OAQYLSRUSA-N 0 3 404.963 4.292 20 0 HIADHN C[C@H]1CN(c2ccc(CN[C@@H]3CCCc4cc(Br)ccc43)cn2)CCO1 ZINC000479329952 894621513 /nfs/dbraw/zinc/62/15/13/894621513.db2.gz HZXUVMQBUAUZKU-MGPUTAFESA-N 0 3 416.363 4.236 20 0 HIADHN CCCN(C(=O)c1ccc(N2CCN(CC)CC2)cc1)[C@H]1CCCc2cccnc21 ZINC000479347553 894643033 /nfs/dbraw/zinc/64/30/33/894643033.db2.gz ISIHWHUJQZNKEA-QHCPKHFHSA-N 0 3 406.574 4.153 20 0 HIADHN C[C@H](NCCc1cccc(Cl)c1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479356238 894653396 /nfs/dbraw/zinc/65/33/96/894653396.db2.gz FPUMGZQPSNLMGL-JTQLQIEISA-N 0 3 407.750 4.188 20 0 HIADHN C[C@H](NCCCOC1CCCCC1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479366215 894666231 /nfs/dbraw/zinc/66/62/31/894666231.db2.gz WSDAXDKDRQNNQO-LBPRGKRZSA-N 0 3 409.379 4.031 20 0 HIADHN COc1c(Br)cccc1CNc1ccccc1CN1CCC(O)CC1 ZINC000479370929 894671543 /nfs/dbraw/zinc/67/15/43/894671543.db2.gz LOAWAFNJOGRVNR-UHFFFAOYSA-N 0 3 405.336 4.027 20 0 HIADHN CC(=O)Nc1cccc(NC(=O)[C@@H]2CN(Cc3ccccc3)CCC2(F)F)c1C ZINC000505229146 913894683 /nfs/dbraw/zinc/89/46/83/913894683.db2.gz FPHCNRUNLOURQQ-SFHVURJKSA-N 0 3 401.457 4.049 20 0 HIADHN C[C@@H](NCCOc1ccc(Br)cc1)c1ccc(Br)cn1 ZINC000479407015 894712332 /nfs/dbraw/zinc/71/23/32/894712332.db2.gz KHLGXYKRFKVZHK-LLVKDONJSA-N 0 3 400.114 4.336 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N(C)Cc2nc(-c3ccccc3)c[nH]2)N(C)C)cc1 ZINC000479415235 894723376 /nfs/dbraw/zinc/72/33/76/894723376.db2.gz MPCBVXUACRKKOM-QFIPXVFZSA-N 0 3 405.546 4.083 20 0 HIADHN Cc1cc(C)c(S(N)(=O)=O)cc1[C@H](C)N[C@H]1CCc2c1cccc2Br ZINC000479419557 894729934 /nfs/dbraw/zinc/72/99/34/894729934.db2.gz QBCBPZNSDSOBJU-UGSOOPFHSA-N 0 3 423.376 4.051 20 0 HIADHN C[C@@H]1CCc2ccc(Br)cc2[C@H](NC[C@H]2CCCCS2(=O)=O)C1 ZINC000479441378 894757273 /nfs/dbraw/zinc/75/72/73/894757273.db2.gz UDDJITUKAKBXRB-MZMPZRCHSA-N 0 3 400.382 4.020 20 0 HIADHN CO[C@H](c1ccccc1Cl)[C@H](C)N[C@H](C)c1cc(S(N)(=O)=O)c(C)cc1C ZINC000479448497 894767952 /nfs/dbraw/zinc/76/79/52/894767952.db2.gz DIPANBXFBOHSTA-SIFCLUCFSA-N 0 3 410.967 4.031 20 0 HIADHN Cc1cc2[nH]c(CNc3ccc4nc(CCN5CCOCC5)[nH]c4c3)cc2c(C)c1 ZINC000479468899 894791623 /nfs/dbraw/zinc/79/16/23/894791623.db2.gz ZUWFVYWJKVMVTM-UHFFFAOYSA-N 0 3 403.530 4.148 20 0 HIADHN COc1ccc([C@H](NC[C@@H]2CCCN(C(C)=O)C2)c2ccccc2Cl)cc1OC ZINC000479468706 894791872 /nfs/dbraw/zinc/79/18/72/894791872.db2.gz CNZNOOACEYAPGN-SBUREZEXSA-N 0 3 416.949 4.295 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)c1ccc(Sc2ccccc2Cl)nn1 ZINC000479484123 894807188 /nfs/dbraw/zinc/80/71/88/894807188.db2.gz PWBSNYXBAYXSNT-UHFFFAOYSA-N 0 3 416.934 4.078 20 0 HIADHN C[C@H](NCC1(S(C)(=O)=O)CC1)c1ccc(Oc2ccc(Br)cc2)cc1 ZINC000479490427 894810822 /nfs/dbraw/zinc/81/08/22/894810822.db2.gz NMRDSPYPLKNWPS-AWEZNQCLSA-N 0 3 424.360 4.469 20 0 HIADHN CCOC(=O)[C@@H](NC1CCN([C@H](C)c2ccncc2)CC1)c1cccc(Cl)c1 ZINC000479492458 894812186 /nfs/dbraw/zinc/81/21/86/894812186.db2.gz VMVQFXAJTYNSCZ-IERDGZPVSA-N 0 3 401.938 4.154 20 0 HIADHN O=C(CN[C@@H]1CCCc2nc(-c3ccc(F)cc3)sc21)N1Cc2ccccc2C1 ZINC000479518117 894829751 /nfs/dbraw/zinc/82/97/51/894829751.db2.gz ZIGXQIJNNGPYHB-LJQANCHMSA-N 0 3 407.514 4.459 20 0 HIADHN CCc1nc2c(s1)[C@@H](N(C)C(=O)NC[C@H](C)N(C)Cc1ccccc1)CCC2 ZINC000479525112 894834039 /nfs/dbraw/zinc/83/40/39/894834039.db2.gz DIWQBCOCYKLWBY-LPHOPBHVSA-N 0 3 400.592 4.245 20 0 HIADHN C[C@H]1CCN(C(=O)NCc2csc(-c3ccco3)n2)CCN1Cc1ccccc1 ZINC000479614240 894885725 /nfs/dbraw/zinc/88/57/25/894885725.db2.gz HAVCUDJPYZJZLZ-KRWDZBQOSA-N 0 3 410.543 4.209 20 0 HIADHN CC(C)[C@](C)(NC(=O)N[C@H](C)C1=CCN(C)CC1)c1ccc(Br)cc1 ZINC000479746881 895046519 /nfs/dbraw/zinc/04/65/19/895046519.db2.gz BVGXUJRFPPGGTB-QRWLVFNGSA-N 0 3 408.384 4.270 20 0 HIADHN Cc1ccc2c(C(=O)Nc3cccc(CN4CCC(C(N)=O)CC4)c3)csc2c1 ZINC000479753485 895053144 /nfs/dbraw/zinc/05/31/44/895053144.db2.gz VGZDGOAAFGULNO-UHFFFAOYSA-N 0 3 407.539 4.159 20 0 HIADHN COc1ccc(CN2CCCN(Cc3cc(Cl)c(OC)c(OC)c3)CC2)cc1 ZINC000505283803 913942187 /nfs/dbraw/zinc/94/21/87/913942187.db2.gz QPIJDNQHZGFOGQ-UHFFFAOYSA-N 0 3 404.938 4.074 20 0 HIADHN C[C@H](NC[C@@H](c1ccco1)N1CCCC1)c1ccccc1I ZINC000479853183 895186586 /nfs/dbraw/zinc/18/65/86/895186586.db2.gz PDIOYIHGLHPREA-YOEHRIQHSA-N 0 3 410.299 4.372 20 0 HIADHN CN(C)C(=O)c1cccc(C(=O)N2CCN(Cc3ccccc3)C3(CCCCC3)C2)c1 ZINC000479861241 895197243 /nfs/dbraw/zinc/19/72/43/895197243.db2.gz NRAVJLRPHXSWTM-UHFFFAOYSA-N 0 3 419.569 4.049 20 0 HIADHN C[C@H](NC[C@H](c1ccco1)N1CCCC1)c1ccc(S(=O)(=O)C2CCCC2)cc1 ZINC000479864987 895203824 /nfs/dbraw/zinc/20/38/24/895203824.db2.gz XSEQNKPXWYMPRR-PGRDOPGGSA-N 0 3 416.587 4.484 20 0 HIADHN CC(C)N1CCc2nc(CN[C@@H]3CCN(c4ccccc4C(F)(F)F)C3)sc2C1 ZINC000479867152 895208627 /nfs/dbraw/zinc/20/86/27/895208627.db2.gz PCOLAGIYMMLTQL-OAHLLOKOSA-N 0 3 424.536 4.297 20 0 HIADHN COc1ccccc1[C@@H](CN[C@H](C)c1nnn(-c2ccc(F)cc2)c1C)N1CCCC1 ZINC000479875488 895217340 /nfs/dbraw/zinc/21/73/40/895217340.db2.gz QSZDSZCCCYNMCA-VGOFRKELSA-N 0 3 423.536 4.211 20 0 HIADHN Cc1nc(-c2cccnc2)sc1[C@H](C)NCc1ccccc1CN1CCOCC1 ZINC000479903433 895250514 /nfs/dbraw/zinc/25/05/14/895250514.db2.gz QXETWJNRSBVEBW-KRWDZBQOSA-N 0 3 408.571 4.197 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)CSc3nccc4ccccc43)c(C)c2)CC1 ZINC000479945416 895299712 /nfs/dbraw/zinc/29/97/12/895299712.db2.gz FXEQYFYSFUPEGA-UHFFFAOYSA-N 0 3 420.582 4.416 20 0 HIADHN CCCCN(CC)c1ccc(C(=O)NCc2ccccc2CN2CCC(O)CC2)cc1 ZINC000479978086 895331446 /nfs/dbraw/zinc/33/14/46/895331446.db2.gz FSYIFMOHGXVDQA-UHFFFAOYSA-N 0 3 423.601 4.200 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)c1ccccc1OC1CCCCC1 ZINC000479988311 895342169 /nfs/dbraw/zinc/34/21/69/895342169.db2.gz VPJKXCOCDMYGRV-UHFFFAOYSA-N 0 3 422.569 4.285 20 0 HIADHN CCCc1c(NC(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)cnn1-c1cc(C)ccn1 ZINC000480118779 895492145 /nfs/dbraw/zinc/49/21/45/895492145.db2.gz DEAUABHHTIHYEV-JPYJTQIMSA-N 0 3 420.561 4.341 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)Nc1cn(C)nc1C(F)(F)F)c1ccc(Cl)cc1 ZINC000480150242 895533952 /nfs/dbraw/zinc/53/39/52/895533952.db2.gz GHBDUWDBFFDKCY-HNNXBMFYSA-N 0 3 417.863 4.297 20 0 HIADHN CCCN(C)[C@H](CNC(=O)Nc1cn(C)nc1C(F)(F)F)c1ccc(Cl)cc1 ZINC000480150244 895534679 /nfs/dbraw/zinc/53/46/79/895534679.db2.gz GHBDUWDBFFDKCY-OAHLLOKOSA-N 0 3 417.863 4.297 20 0 HIADHN C[C@H](NCc1cc(C(F)(F)F)ccc1N1CCN(C)CC1)c1ccc(Cl)cn1 ZINC000480167920 895557787 /nfs/dbraw/zinc/55/77/87/895557787.db2.gz JFPALLRSZNSENF-AWEZNQCLSA-N 0 3 412.887 4.356 20 0 HIADHN CCN(CC)C(=O)c1ccc(CN[C@H](C)c2ccc(OCc3nccn3C)cc2)cc1 ZINC000480209608 895611646 /nfs/dbraw/zinc/61/16/46/895611646.db2.gz OITSWZQPBAXLMM-LJQANCHMSA-N 0 3 420.557 4.332 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)Nc1cc(C(C)(C)C)nn1-c1ccccn1)c1ccco1 ZINC000480237338 895646407 /nfs/dbraw/zinc/64/64/07/895646407.db2.gz PTUUIJWBXQVKGI-IAGOWNOFSA-N 0 3 424.549 4.409 20 0 HIADHN COc1cc(F)c([C@@H](C)NC[C@H](c2ccccc2Cl)N2CCOCC2)cc1OC ZINC000480272216 895681213 /nfs/dbraw/zinc/68/12/13/895681213.db2.gz BGCAFFMPXRVHPY-FOIQADDNSA-N 0 3 422.928 4.220 20 0 HIADHN CC[C@@H](N[C@@H](C)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccc(Cl)cc1 ZINC000480335974 895740454 /nfs/dbraw/zinc/74/04/54/895740454.db2.gz YEBPDZLWYHMTQW-HRAATJIYSA-N 0 3 422.978 4.163 20 0 HIADHN FC(F)(F)c1ccnc(NCCNCc2cc(Br)c(Cl)s2)n1 ZINC000480342477 895746125 /nfs/dbraw/zinc/74/61/25/895746125.db2.gz MNSLTQJUPPKCHZ-UHFFFAOYSA-N 0 3 415.666 4.175 20 0 HIADHN Cc1ccc(Oc2ccc(NC(=O)N3CC[C@@H](N4CCN(C)CC4)[C@@H](C)C3)cc2)cc1 ZINC000480536254 895899161 /nfs/dbraw/zinc/89/91/61/895899161.db2.gz AMMMLMBCQDUFFL-GBXCKJPGSA-N 0 3 422.573 4.277 20 0 HIADHN CCc1c(C(=O)Nc2cccc3c2CCN(CC(C)(C)O)C3)cnn1C(CC)CC ZINC000480537696 895901244 /nfs/dbraw/zinc/90/12/44/895901244.db2.gz ONRJRUVSKTUBOW-UHFFFAOYSA-N 0 3 412.578 4.188 20 0 HIADHN Cc1nc(-c2ccccn2)nc(NC2CC(N3CCC(C(F)(F)F)CC3)C2)c1C ZINC000480560130 895919727 /nfs/dbraw/zinc/91/97/27/895919727.db2.gz DNFXUHCRWQCRNO-UHFFFAOYSA-N 0 3 405.468 4.373 20 0 HIADHN CCc1ccc(CN[C@@H](C)c2ccc(S(=O)(=O)NCc3ccco3)cc2)s1 ZINC000480614384 895980508 /nfs/dbraw/zinc/98/05/08/895980508.db2.gz SPCLKOZUCWHHCD-HNNXBMFYSA-N 0 3 404.557 4.233 20 0 HIADHN CCS(=O)(=O)Nc1ccc([C@H](C)NCc2cccc(OCC(F)(F)F)c2)cc1 ZINC000480618812 895986697 /nfs/dbraw/zinc/98/66/97/895986697.db2.gz YKMIHCMQCTUMNR-AWEZNQCLSA-N 0 3 416.465 4.240 20 0 HIADHN CC(C)Oc1cccc([C@@H](C)N[C@H](C)c2cccc(N3CCCS3(=O)=O)c2)c1 ZINC000480620696 895987451 /nfs/dbraw/zinc/98/74/51/895987451.db2.gz ZAOJUXLGQFVAQZ-QZTJIDSGSA-N 0 3 402.560 4.426 20 0 HIADHN CC[C@H](NCc1ccc(N2CCO[C@H](C)C2)nc1)c1cccc(Br)c1 ZINC000480619712 895987622 /nfs/dbraw/zinc/98/76/22/895987622.db2.gz XTORBYNMBRVTHI-BEFAXECRSA-N 0 3 404.352 4.310 20 0 HIADHN C[C@@H](NCc1ccc(N2C[C@@H](C)O[C@@H](C)C2)nc1)c1ccc(OC(F)(F)F)cc1 ZINC000480622696 895991766 /nfs/dbraw/zinc/99/17/66/895991766.db2.gz WAUUNWLFCWKWBR-OWCLPIDISA-N 0 3 409.452 4.445 20 0 HIADHN C[C@H]1[C@@H](C(F)(F)F)CCCN1C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000480638144 896007066 /nfs/dbraw/zinc/00/70/66/896007066.db2.gz QWLWNUGOHLFSAT-YJBOKZPZSA-N 0 3 415.525 4.473 20 0 HIADHN Cc1cc(NC(=O)Nc2ccc(CCN3CCSCC3)cc2)nn1[C@@H](C)C1CC1 ZINC000480640972 896010452 /nfs/dbraw/zinc/01/04/52/896010452.db2.gz WPCCCERWZZCQIP-KRWDZBQOSA-N 0 3 413.591 4.398 20 0 HIADHN Cc1nnc(-c2ccccc2C(=O)NC[C@H](c2ccccc2)N2CCC(C)CC2)o1 ZINC000480691573 896054983 /nfs/dbraw/zinc/05/49/83/896054983.db2.gz WCSXOJHTWACCFZ-JOCHJYFZSA-N 0 3 404.514 4.248 20 0 HIADHN Cc1ccccc1NC(=O)C[C@H](C)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1=O ZINC000480694788 896056987 /nfs/dbraw/zinc/05/69/87/896056987.db2.gz PWHCZRSMJSZEJW-MAUKXSAKSA-N 0 3 419.447 4.126 20 0 HIADHN CN1CCN(c2cc(CN[C@@H]3CCCc4c(Cl)sc(Cl)c43)ccn2)CC1 ZINC000480703787 896065585 /nfs/dbraw/zinc/06/55/85/896065585.db2.gz FKEGOWSPNVCTGX-OAHLLOKOSA-N 0 3 411.402 4.369 20 0 HIADHN COc1ccccc1-c1ccc([C@H](C)NCc2ccnc(N3CCN(C)CC3)c2)cc1 ZINC000480705198 896067220 /nfs/dbraw/zinc/06/72/20/896067220.db2.gz MOLRLSLYFSPRHG-FQEVSTJZSA-N 0 3 416.569 4.360 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2ccc(-c3n[nH]c(C4CC4)n3)cc2)N2CCCC2)cc1 ZINC000480710908 896072231 /nfs/dbraw/zinc/07/22/31/896072231.db2.gz FMPOPIMIQNZYCD-QFIPXVFZSA-N 0 3 415.541 4.224 20 0 HIADHN C[C@H](NCc1ccc(N2CCC(C)CC2)nc1)c1ccc(NC(=O)NC2CC2)cc1 ZINC000480722306 896083216 /nfs/dbraw/zinc/08/32/16/896083216.db2.gz ORRDLIKTJSSHAQ-SFHVURJKSA-N 0 3 407.562 4.453 20 0 HIADHN CC[C@H](N[C@@H](C)c1ccc(S(=O)(=O)N2CCOCC2)cc1)c1cccc(Cl)c1 ZINC000480767309 896129571 /nfs/dbraw/zinc/12/95/71/896129571.db2.gz DWZMIUHEHMYJOC-KKSFZXQISA-N 0 3 422.978 4.163 20 0 HIADHN C[C@@H](NC[C@@H](c1cccc(Cl)c1)N1CCCC1)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000480774195 896137787 /nfs/dbraw/zinc/13/77/87/896137787.db2.gz VIVXZUWFYVBDIQ-QRWLVFNGSA-N 0 3 424.969 4.370 20 0 HIADHN CCCS(=O)(=O)N1CCC(N[C@@H]2CCCc3c(Cl)sc(Cl)c32)CC1 ZINC000480774413 896138153 /nfs/dbraw/zinc/13/81/53/896138153.db2.gz ASANMKIZQLCMJG-CYBMUJFWSA-N 0 3 411.420 4.226 20 0 HIADHN C[C@@H]1CN(C(=O)Nc2ccc3c(c2)C(C)(C)CC3(C)C)CC[C@@H]1N1CCN(C)CC1 ZINC000480816431 896188336 /nfs/dbraw/zinc/18/83/36/896188336.db2.gz FQGDUFIVUXLLMG-GCJKJVERSA-N 0 3 412.622 4.135 20 0 HIADHN COc1ccc([C@H](C)NCc2ccc(CN3CCCC3=O)cc2)cc1Br ZINC000480876811 896233866 /nfs/dbraw/zinc/23/38/66/896233866.db2.gz HOCFPLXQQXHQTQ-HNNXBMFYSA-N 0 3 417.347 4.431 20 0 HIADHN C[C@H](NCc1cccc(NC(=O)c2ccncc2)c1)c1cccc(N2CCOCC2)c1 ZINC000480879111 896236582 /nfs/dbraw/zinc/23/65/82/896236582.db2.gz GPNYONDDLVCDRT-IBGZPJMESA-N 0 3 416.525 4.021 20 0 HIADHN C[C@H](NCCc1ccc(OCC(=O)NC2CC2)cc1)c1nc(-c2ccccc2)cs1 ZINC000480910378 896266048 /nfs/dbraw/zinc/26/60/48/896266048.db2.gz KCAZLLUADITRJI-KRWDZBQOSA-N 0 3 421.566 4.361 20 0 HIADHN Cc1ccc(C(=O)Nc2cccc(CN[C@@H](C)c3ccc(-n4cnnn4)cc3)c2)cc1 ZINC000480911875 896269047 /nfs/dbraw/zinc/26/90/47/896269047.db2.gz UTFCEEBUABGVHE-SFHVURJKSA-N 0 3 412.497 4.074 20 0 HIADHN COc1cc(CN[C@@H](C)c2sc(-c3ccccc3F)nc2C)ccc1OCCO ZINC000480912514 896269660 /nfs/dbraw/zinc/26/96/60/896269660.db2.gz UYWLKSSMOQYTOL-AWEZNQCLSA-N 0 3 416.518 4.488 20 0 HIADHN CC[C@H](NCc1cccc(NC(=O)Cn2cccn2)c1)c1ccc(OC(F)F)cc1 ZINC000480912969 896270267 /nfs/dbraw/zinc/27/02/67/896270267.db2.gz SQFVVIONJGAMTO-FQEVSTJZSA-N 0 3 414.456 4.364 20 0 HIADHN Cc1nc(-c2cccnc2)sc1[C@H](C)NCc1ccc(CN2CCCC2=O)cc1 ZINC000480913843 896271461 /nfs/dbraw/zinc/27/14/61/896271461.db2.gz VUCHZHLFSNNMDM-INIZCTEOSA-N 0 3 406.555 4.487 20 0 HIADHN COc1cccc([C@H](C)N[C@H](C)c2ccc(S(=O)(=O)NCc3ccco3)cc2)c1 ZINC000480917101 896275878 /nfs/dbraw/zinc/27/58/78/896275878.db2.gz XOOFGSUGZZLFNB-SJORKVTESA-N 0 3 414.527 4.179 20 0 HIADHN Cc1nc(-c2cccnc2)sc1[C@H](C)NCCCS(=O)(=O)Cc1ccccc1 ZINC000480923354 896279806 /nfs/dbraw/zinc/27/98/06/896279806.db2.gz ZMXMADZSFFKAEV-INIZCTEOSA-N 0 3 415.584 4.169 20 0 HIADHN O=S(=O)(CCO)c1ccc(CNCc2ccc(-c3cccc(Cl)c3)s2)cc1 ZINC000480933560 896283884 /nfs/dbraw/zinc/28/38/84/896283884.db2.gz WLMPYDOSVHSZHX-UHFFFAOYSA-N 0 3 421.971 4.124 20 0 HIADHN CNS(=O)(=O)c1cccc(CN[C@H](C)c2ccc(-c3ccc(F)cc3)s2)c1 ZINC000481027727 896355770 /nfs/dbraw/zinc/35/57/70/896355770.db2.gz RWPHNYKVJUDWHY-CQSZACIVSA-N 0 3 404.532 4.313 20 0 HIADHN COc1ccc2ccccc2c1-c1cc(CN(C)CC(C)(C)CN2CCOCC2)on1 ZINC000481083621 896402933 /nfs/dbraw/zinc/40/29/33/896402933.db2.gz ATVHYMKCXXQGNA-UHFFFAOYSA-N 0 3 423.557 4.294 20 0 HIADHN Cc1c([C@@H](C)NC[C@@H](O)COCC(C)C)cnn1-c1ccc(Cl)cc1Cl ZINC000481165189 896497942 /nfs/dbraw/zinc/49/79/42/896497942.db2.gz CWMYRWVZPKUOOB-CZUORRHYSA-N 0 3 400.350 4.172 20 0 HIADHN Cc1c([C@H](C)NCC2(c3ccc(F)cc3)CCOCC2)nnn1-c1ccc(C)cc1 ZINC000481165872 896498414 /nfs/dbraw/zinc/49/84/14/896498414.db2.gz AUNGCKKZDLGEOP-SFHVURJKSA-N 0 3 408.521 4.422 20 0 HIADHN Cc1c([C@H](C)NCC2(c3ccc(F)cc3)CCOCC2)nnn1-c1ccc(F)cc1 ZINC000481167519 896502037 /nfs/dbraw/zinc/50/20/37/896502037.db2.gz CTLRFTKEHDEZMY-INIZCTEOSA-N 0 3 412.484 4.253 20 0 HIADHN COc1cc([C@@H](C)N[C@H]2CCc3cc(Br)ccc32)ccc1OCCO ZINC000481173797 896509084 /nfs/dbraw/zinc/50/90/84/896509084.db2.gz GXUQWHPWGHAGFT-ACJLOTCBSA-N 0 3 406.320 4.167 20 0 HIADHN COc1cc([C@@H](C)N[C@@H]2CCc3ccc(OC(F)(F)F)cc32)ccc1OCCO ZINC000481180472 896516967 /nfs/dbraw/zinc/51/69/67/896516967.db2.gz MFNNQJUZAMZAQX-FZKQIMNGSA-N 0 3 411.420 4.303 20 0 HIADHN CC[C@@H](NCc1cccnc1N1CCN(C)CC1)c1ccc2cc(OC)ccc2c1 ZINC000481224701 896577219 /nfs/dbraw/zinc/57/72/19/896577219.db2.gz WLFODJVMWBAZTF-XMMPIXPASA-N 0 3 404.558 4.236 20 0 HIADHN C[C@@H](NCc1cccnc1N1CCN(C)CC1)c1ccc(SCC(F)F)cc1 ZINC000481245231 896597562 /nfs/dbraw/zinc/59/75/62/896597562.db2.gz FUPINOLJIQXALM-MRXNPFEDSA-N 0 3 406.546 4.041 20 0 HIADHN Cc1nc2c(s1)[C@@H](NCc1ccc(S(=O)(=O)N3CCC[C@H](C)C3)cc1)CCC2 ZINC000481303056 896649368 /nfs/dbraw/zinc/64/93/68/896649368.db2.gz FOJFHOGNWHYGDL-KXBFYZLASA-N 0 3 419.616 4.039 20 0 HIADHN COc1ccc(-c2nnc(NC(=O)N[C@@H](C)[C@H](c3ccccc3)N(C)C)s2)cc1 ZINC000481309594 896656830 /nfs/dbraw/zinc/65/68/30/896656830.db2.gz BVNRPIBZGNHPAS-KBXCAEBGSA-N 0 3 411.531 4.027 20 0 HIADHN Cc1c([C@@H](C)NCc2cccc(CN3CCOCC3)c2)cnn1-c1cc(C)ccc1C ZINC000481311872 896658058 /nfs/dbraw/zinc/65/80/58/896658058.db2.gz LLKFXAQEQCNGKS-OAQYLSRUSA-N 0 3 418.585 4.481 20 0 HIADHN CC[C@H](N[C@@H]1CCc2c1cccc2OC)c1ccccc1OCC(=O)N1CCCC1 ZINC000481312273 896660254 /nfs/dbraw/zinc/66/02/54/896660254.db2.gz HNSDANONRDALLT-FCHUYYIVSA-N 0 3 408.542 4.425 20 0 HIADHN C[C@H](N[C@H]1CCSc2ccc(F)cc21)c1ccc(OCC(=O)NC2CC2)cc1 ZINC000481316552 896668182 /nfs/dbraw/zinc/66/81/82/896668182.db2.gz ANYMUPAEWSMTSB-XOBRGWDASA-N 0 3 400.519 4.371 20 0 HIADHN C[C@H]1CCCN(S(=O)(=O)c2ccc(CN[C@H]3CCSc4ccccc43)cc2)C1 ZINC000481321689 896675334 /nfs/dbraw/zinc/67/53/34/896675334.db2.gz LHYSGBFZFZJSFK-UWJYYQICSA-N 0 3 416.612 4.434 20 0 HIADHN Cc1c([C@H](C)NCc2cccc(CN3CCOCC3)c2)cnn1-c1ccc(F)cc1 ZINC000481324190 896680806 /nfs/dbraw/zinc/68/08/06/896680806.db2.gz QSNLPAWKYUTERX-SFHVURJKSA-N 0 3 408.521 4.003 20 0 HIADHN FC(F)(F)Oc1ccc2c(c1)[C@H](NCc1cccc(CN3CCOCC3)c1)CC2 ZINC000481326267 896683670 /nfs/dbraw/zinc/68/36/70/896683670.db2.gz XBEBSDWKVZDMIP-OAQYLSRUSA-N 0 3 406.448 4.195 20 0 HIADHN C[C@H](NCc1cccc(OCCN2CCOCC2)c1)c1cccc(C(F)(F)F)c1 ZINC000481409856 896814881 /nfs/dbraw/zinc/81/48/81/896814881.db2.gz BMRKSOYITASASD-KRWDZBQOSA-N 0 3 408.464 4.267 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCc3ccc(OC)c(Cl)c3)c(C)c2)CC1 ZINC000481465753 896857460 /nfs/dbraw/zinc/85/74/60/896857460.db2.gz PEIHZXUPEWHWBL-UHFFFAOYSA-N 0 3 416.953 4.121 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3CCc4c(F)cc(F)cc4C3)c(C)c2)CC1 ZINC000481481600 896865118 /nfs/dbraw/zinc/86/51/18/896865118.db2.gz PSSNTNGWDUEQQS-UHFFFAOYSA-N 0 3 414.500 4.005 20 0 HIADHN Cc1ccc(OCCCC(=O)N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)c(Cl)c1 ZINC000481519332 896885202 /nfs/dbraw/zinc/88/52/02/896885202.db2.gz NDLLSJFFWQJVFB-KDURUIRLSA-N 0 3 422.997 4.155 20 0 HIADHN C[C@@H](NC[C@H](O)COc1ccc(C(F)(F)F)cc1)c1cnn(Cc2ccccc2)c1 ZINC000481533832 896895916 /nfs/dbraw/zinc/89/59/16/896895916.db2.gz LXWOIJADHVRALY-UZLBHIALSA-N 0 3 419.447 4.041 20 0 HIADHN COC[C@@H](NCc1cccc(CN2CCO[C@H](C)C2)c1)c1cccc(C(F)(F)F)c1 ZINC000481550290 896917230 /nfs/dbraw/zinc/91/72/30/896917230.db2.gz CFEYEFKOLXUEQL-VGOFRKELSA-N 0 3 422.491 4.403 20 0 HIADHN CC[C@H](NC[C@H](O)COc1ccc2c(c1)CCC(=O)N2)c1ccc(Cl)cc1Cl ZINC000481556712 896927977 /nfs/dbraw/zinc/92/79/77/896927977.db2.gz JKHZSQVPEBNINC-KXBFYZLASA-N 0 3 423.340 4.359 20 0 HIADHN O[C@@H](CN[C@H]1CCSc2c(F)cccc21)COc1ccc(C(F)(F)F)cc1 ZINC000481567947 896946514 /nfs/dbraw/zinc/94/65/14/896946514.db2.gz BNABYPJWJHRIIW-GUYCJALGSA-N 0 3 401.425 4.411 20 0 HIADHN CNC(=O)c1cccc(CN2CCC(COc3ccccc3C(F)(F)F)CC2)c1 ZINC000481614081 896996437 /nfs/dbraw/zinc/99/64/37/896996437.db2.gz KBWWTRUWOXQUPP-UHFFFAOYSA-N 0 3 406.448 4.356 20 0 HIADHN CCOCCOc1ccc(Cl)cc1NC(=O)N1CCN(CCC(C)(C)C)CC1 ZINC000481620621 897004399 /nfs/dbraw/zinc/00/43/99/897004399.db2.gz DBFGSRPHHCAIPQ-UHFFFAOYSA-N 0 3 411.974 4.341 20 0 HIADHN Cc1cc(NC(=O)Cc2csc(C(C)(C)C)n2)cc(N2CCN(C(C)C)CC2)c1 ZINC000481633976 897019696 /nfs/dbraw/zinc/01/96/96/897019696.db2.gz YWLRZQGWHQKHAE-UHFFFAOYSA-N 0 3 414.619 4.461 20 0 HIADHN Cc1cc(NC(=O)Cc2cc(F)c(F)cc2F)cc(N2CCN(C(C)C)CC2)c1 ZINC000481641934 897026784 /nfs/dbraw/zinc/02/67/84/897026784.db2.gz WMYFZAQVUCAJSK-UHFFFAOYSA-N 0 3 405.464 4.124 20 0 HIADHN Cc1nn(-c2ccccc2)cc1C(=O)Nc1cc(C)cc(N2CCN(C(C)C)CC2)c1 ZINC000481647200 897033367 /nfs/dbraw/zinc/03/33/67/897033367.db2.gz RUBGQURODYJTJB-UHFFFAOYSA-N 0 3 417.557 4.272 20 0 HIADHN CC[C@H](N[C@H](c1ccccc1)[C@@H]1CCOC1)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000481659776 897043178 /nfs/dbraw/zinc/04/31/78/897043178.db2.gz JULHVBCZVKYQLL-SLYNCCJLSA-N 0 3 422.978 4.067 20 0 HIADHN CC[C@H](NCCOc1ccccc1Cl)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000481669087 897053944 /nfs/dbraw/zinc/05/39/44/897053944.db2.gz MNLFXNMKDDCGGJ-INIZCTEOSA-N 0 3 417.358 4.021 20 0 HIADHN O=C(CCN1CCC[C@@]2(C1)OCc1ccccc12)Nc1ccccc1Br ZINC000481700432 897087536 /nfs/dbraw/zinc/08/75/36/897087536.db2.gz WRDWNRBAPYGONK-NRFANRHFSA-N 0 3 415.331 4.299 20 0 HIADHN C[C@@H](NC(=O)Nc1ccc2c(c1)CCC(=O)N2CC1CC1)[C@H](c1ccccc1)N(C)C ZINC000481755815 897146484 /nfs/dbraw/zinc/14/64/84/897146484.db2.gz PQGFPLPYSCFLNJ-MZNJEOGPSA-N 0 3 420.557 4.189 20 0 HIADHN CC(C)C[C@H]1OCCC[C@H]1NCC(=O)Nc1cccc(CSc2ccccn2)c1 ZINC000481769987 897155277 /nfs/dbraw/zinc/15/52/77/897155277.db2.gz VYBKGBJAIUFOJB-NHCUHLMSSA-N 0 3 413.587 4.496 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2ccc(-c3cncnc3)cc2F)N2CCCC2)cc1 ZINC000481885696 897259365 /nfs/dbraw/zinc/25/93/65/897259365.db2.gz DHAOGYQJIVWKGE-HSZRJFAPSA-N 0 3 404.489 4.158 20 0 HIADHN CCN(C(=O)c1ccc(-c2cncnc2)cc1F)[C@H]1CCN(Cc2ccccc2)C1 ZINC000481901262 897279733 /nfs/dbraw/zinc/27/97/33/897279733.db2.gz DNOZFWHEEKPGOI-NRFANRHFSA-N 0 3 404.489 4.019 20 0 HIADHN COc1ccc(-c2ccncc2)cc1CN1CCC[C@@H](C(=O)Nc2cccc(C)n2)C1 ZINC000481911340 897294094 /nfs/dbraw/zinc/29/40/94/897294094.db2.gz DXRQURBQARRWGN-OAQYLSRUSA-N 0 3 416.525 4.311 20 0 HIADHN C[C@@H]1CCCN(S(=O)(=O)c2ccc(CN[C@H](c3cccnc3)C3CCC3)cc2)C1 ZINC000481915632 897298859 /nfs/dbraw/zinc/29/88/59/897298859.db2.gz MSAZHHBFDJFROV-JPYJTQIMSA-N 0 3 413.587 4.133 20 0 HIADHN COc1ccc(-c2nnc(NC(=O)N[C@H](CN3CCCC3)c3ccccc3)s2)cc1 ZINC000481973894 897365806 /nfs/dbraw/zinc/36/58/06/897365806.db2.gz ASSRUDOUMQBSJG-LJQANCHMSA-N 0 3 423.542 4.172 20 0 HIADHN O=C1C[C@H](N[C@@H](c2cccnc2)C2CCC2)CN1Cc1ccccc1C(F)(F)F ZINC000481992026 897388289 /nfs/dbraw/zinc/38/82/89/897388289.db2.gz MWYUWZGXJHPJNE-GHTZIAJQSA-N 0 3 403.448 4.332 20 0 HIADHN COC(=O)c1ccc(-c2ccc(CN3CCC[C@H](CNC(=O)C(C)(C)C)C3)o2)cc1 ZINC000482007895 897404470 /nfs/dbraw/zinc/40/44/70/897404470.db2.gz QEBMGGZQHWHHCP-QGZVFWFLSA-N 0 3 412.530 4.108 20 0 HIADHN Cc1ccc(-c2nc(CCN[C@H](C)c3ccc(S(C)(=O)=O)c(F)c3)co2)cc1 ZINC000482013273 897413064 /nfs/dbraw/zinc/41/30/64/897413064.db2.gz FWMBXOLCBXPSHE-OAHLLOKOSA-N 0 3 402.491 4.086 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)Nc1ccc(Cl)cn1 ZINC000482096101 897540926 /nfs/dbraw/zinc/54/09/26/897540926.db2.gz OECUCFZBSMBWRK-UHFFFAOYSA-N 0 3 400.832 4.350 20 0 HIADHN CCOc1ccc([C@H](C)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)cc1OCC ZINC000482106370 897555436 /nfs/dbraw/zinc/55/54/36/897555436.db2.gz AXHHAHGHTHNEMS-UGKGYDQZSA-N 0 3 410.558 4.368 20 0 HIADHN COCCOc1ccc([C@@H](C)NCc2ccc(NC(=O)c3cccnc3)cc2)cc1 ZINC000482111748 897561765 /nfs/dbraw/zinc/56/17/65/897561765.db2.gz RPVQKRPFHGVBMC-GOSISDBHSA-N 0 3 405.498 4.210 20 0 HIADHN CC(C)NC(=O)Nc1ccc([C@H](C)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)cc1 ZINC000482118430 897571005 /nfs/dbraw/zinc/57/10/05/897571005.db2.gz DLKSYTWHJPJZBM-CVDCTZTESA-N 0 3 422.573 4.101 20 0 HIADHN CC(C)NC(=O)Nc1ccc([C@@H](C)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)cc1 ZINC000482118432 897571198 /nfs/dbraw/zinc/57/11/98/897571198.db2.gz DLKSYTWHJPJZBM-XXBNENTESA-N 0 3 422.573 4.101 20 0 HIADHN O=C([C@H](Cc1ccccc1)N[C@@H]1CCc2cc(Br)ccc21)N1CCCC1 ZINC000482121704 897575998 /nfs/dbraw/zinc/57/59/98/897575998.db2.gz OAEFYJVXVUCBSU-RTWAWAEBSA-N 0 3 413.359 4.260 20 0 HIADHN C[C@@H](N[C@H](C)c1cccc(S(=O)(=O)N(C)C)c1)c1cccc(-c2ccncc2)c1 ZINC000482249022 897731578 /nfs/dbraw/zinc/73/15/78/897731578.db2.gz YEZONIFSGLHSGE-QZTJIDSGSA-N 0 3 409.555 4.411 20 0 HIADHN CCC[C@H](N[C@@H](C)c1ccc(-n2cccn2)cc1)C(=O)N1CCc2sccc2C1 ZINC000482251615 897733421 /nfs/dbraw/zinc/73/34/21/897733421.db2.gz ZCAMSGZNUWVWHA-UWJYYQICSA-N 0 3 408.571 4.338 20 0 HIADHN Cc1c(C(=O)NC2CCN(CCOc3ccc(Cl)cc3)CC2)cnc2ccccc12 ZINC000482322882 897822982 /nfs/dbraw/zinc/82/29/82/897822982.db2.gz YIARVDSNYSVPKH-UHFFFAOYSA-N 0 3 423.944 4.470 20 0 HIADHN COc1ccc([C@H](NC(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)C(F)(F)F)cc1 ZINC000482328083 897831248 /nfs/dbraw/zinc/83/12/48/897831248.db2.gz IRDONRZZUJADTK-QSFXBCCZSA-N 0 3 421.463 4.433 20 0 HIADHN COc1ccc([C@@H](NC(=O)N2CCCN(Cc3ccccc3)CC2)C(F)(F)F)cc1 ZINC000482344008 897852415 /nfs/dbraw/zinc/85/24/15/897852415.db2.gz MHHLCQIELWAKLM-HXUWFJFHSA-N 0 3 421.463 4.216 20 0 HIADHN C[C@@H](NC(=O)N[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)C1=CCN(C)CC1 ZINC000482355086 897870012 /nfs/dbraw/zinc/87/00/12/897870012.db2.gz UBZUTBQYFFMEMJ-ABAIWWIYSA-N 0 3 409.374 4.258 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)CCc2ncc(-c3ccc(C)cc3)o2)c1 ZINC000482356819 897871791 /nfs/dbraw/zinc/87/17/91/897871791.db2.gz LGVNPHUUMMVNFE-UHFFFAOYSA-N 0 3 421.541 4.182 20 0 HIADHN Cc1c(C(=O)N[C@@H](CN2CCCC2)c2ccccc2)cnn1-c1ccccc1Cl ZINC000482359337 897877148 /nfs/dbraw/zinc/87/71/48/897877148.db2.gz FZNPZWVQBOHBDN-NRFANRHFSA-N 0 3 408.933 4.401 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)c2cccc(-c3csc(C)n3)c2)c1 ZINC000482384303 897913631 /nfs/dbraw/zinc/91/36/31/897913631.db2.gz KKVZSCQSIUMLAK-UHFFFAOYSA-N 0 3 409.555 4.331 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)Nc1c(F)cc(F)cc1Br ZINC000482391531 897923993 /nfs/dbraw/zinc/92/39/93/897923993.db2.gz JNRFBHYVTQNYTK-UHFFFAOYSA-N 0 3 404.299 4.457 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)N[C@@H](c3ccccc3C(F)(F)F)C(F)(F)F)[C@@H]2C1 ZINC000482404068 897944408 /nfs/dbraw/zinc/94/44/08/897944408.db2.gz MIDSBWPNGARCNK-DFBGVHRSSA-N 0 3 409.374 4.044 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1cccc2c1CN(CC(F)(F)F)C2)c1ccco1 ZINC000482422283 897973412 /nfs/dbraw/zinc/97/34/12/897973412.db2.gz NCEOIKKCXCNGQG-KBXCAEBGSA-N 0 3 424.467 4.408 20 0 HIADHN CC(C)Cc1ccc([C@@H](CNC(=O)Nc2cnn(C)c2C(F)(F)F)N(C)C)cc1 ZINC000482443155 898004735 /nfs/dbraw/zinc/00/47/35/898004735.db2.gz CPIKDYJHXBKVRU-QGZVFWFLSA-N 0 3 411.472 4.062 20 0 HIADHN COc1ccc([C@H](CCC(C)C)NCc2cccnc2N2CCC(C(N)=O)CC2)cc1 ZINC000482458565 898030385 /nfs/dbraw/zinc/03/03/85/898030385.db2.gz SYTKYPQFZXXCNE-QHCPKHFHSA-N 0 3 424.589 4.059 20 0 HIADHN O=C([C@H]1CCCN(Cc2cccc(F)c2)C1)N1CCC[C@]2(C1)OCc1ccccc12 ZINC000482473121 898047886 /nfs/dbraw/zinc/04/78/86/898047886.db2.gz BFGAQQSUFVULOH-NBGIEHNGSA-N 0 3 408.517 4.086 20 0 HIADHN CC(=O)c1cccc(C(=O)N(C[C@@H]2CCN(Cc3ccccc3)C2)CC(F)(F)F)c1 ZINC000482492207 898071588 /nfs/dbraw/zinc/07/15/88/898071588.db2.gz TVSBSLRIHBDPFT-LJQANCHMSA-N 0 3 418.459 4.416 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)c2sc(C3CC3)nc2-c2ccccc2)CC1 ZINC000482495147 898075755 /nfs/dbraw/zinc/07/57/55/898075755.db2.gz MSEUUGHUAMIZKO-UHFFFAOYSA-N 0 3 413.587 4.307 20 0 HIADHN CCOc1cc(NC2CCN(Cc3cc(-c4ccncc4)ccc3OC)CC2)ncn1 ZINC000482515001 898101982 /nfs/dbraw/zinc/10/19/82/898101982.db2.gz WSAQYZJBLYXGFF-UHFFFAOYSA-N 0 3 419.529 4.022 20 0 HIADHN O=C(CCc1cc(Cl)cc(Cl)c1)NCc1ccccc1CN1CCC(O)CC1 ZINC000482515331 898102370 /nfs/dbraw/zinc/10/23/70/898102370.db2.gz WPUUVXQMOBTPIT-UHFFFAOYSA-N 0 3 421.368 4.199 20 0 HIADHN COc1cc(C)c([C@@H](C)N[C@@H](C)c2cc(F)ccc2N2CCN(C)CC2)cc1OC ZINC000482567953 898161647 /nfs/dbraw/zinc/16/16/47/898161647.db2.gz UODLPAZRUVAURR-MSOLQXFVSA-N 0 3 415.553 4.315 20 0 HIADHN Cc1c([C@@H](C)NC[C@@H](O)COc2ccc(F)c(F)c2)cnn1-c1cccc(Cl)c1 ZINC000482568624 898163696 /nfs/dbraw/zinc/16/36/96/898163696.db2.gz HXOQDVHHMYJZSS-CXAGYDPISA-N 0 3 421.875 4.203 20 0 HIADHN COCCOc1ccc(Cl)cc1C(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000482587018 898183982 /nfs/dbraw/zinc/18/39/82/898183982.db2.gz XBVDQRLYKJXVQD-FQEVSTJZSA-N 0 3 416.949 4.102 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C1=Cc2cc(Br)ccc2OC1 ZINC000482606931 898207017 /nfs/dbraw/zinc/20/70/17/898207017.db2.gz JFHMAXCRABWJDH-UHFFFAOYSA-N 0 3 401.304 4.234 20 0 HIADHN COc1ccc(-c2noc(CCCC(=O)Nc3cc(CN(C)C)ccc3C)n2)cc1 ZINC000482611665 898212305 /nfs/dbraw/zinc/21/23/05/898212305.db2.gz VWEXIDOAOSIOTR-UHFFFAOYSA-N 0 3 408.502 4.077 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)[C@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O ZINC000482629518 898232935 /nfs/dbraw/zinc/23/29/35/898232935.db2.gz LIMRHEKOIYATDE-MRXNPFEDSA-N 0 3 420.340 4.355 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)N1CCC[C@]2(C1)OCc1ccccc12 ZINC000482632366 898234804 /nfs/dbraw/zinc/23/48/04/898234804.db2.gz QGIIZNGKIYOGDA-UKILVPOCSA-N 0 3 405.542 4.055 20 0 HIADHN CC(C)CN(C(=O)NC[C@H](Cc1ccccc1)N(C)C)[C@H]1CCCc2cccnc21 ZINC000482634163 898237685 /nfs/dbraw/zinc/23/76/85/898237685.db2.gz IVQUPMVDCCHGSB-GOTSBHOMSA-N 0 3 408.590 4.300 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)NCc1ccc(Br)s1)c1ccco1 ZINC000482705681 898305949 /nfs/dbraw/zinc/30/59/49/898305949.db2.gz IDYAJLRPUHBFCZ-DGCLKSJQSA-N 0 3 400.342 4.032 20 0 HIADHN CCN1C[C@@H](C)N(CCOc2c(Br)cccc2Br)C[C@@H]1C ZINC000482799319 898407385 /nfs/dbraw/zinc/40/73/85/898407385.db2.gz SAJPWWGSGPGRLW-QWHCGFSZSA-N 0 3 420.189 4.005 20 0 HIADHN Cc1cc(C(=O)NCC2(N3CCSCC3)CCCCC2)c2c(n1)onc2C(C)C ZINC000482883819 898497290 /nfs/dbraw/zinc/49/72/90/898497290.db2.gz ZGLLCRFDAHNASK-UHFFFAOYSA-N 0 3 416.591 4.136 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(NC(=O)c2ccncc2)cc1)c1ccc([S@@](C)=O)cc1 ZINC000482941617 898565612 /nfs/dbraw/zinc/56/56/12/898565612.db2.gz AZJIRIUDCKJTDC-CLQKXYRXSA-N 0 3 407.539 4.483 20 0 HIADHN CC(C)NC(=O)Nc1ccc([C@@H](C)NCc2ccnc(OC3CCOCC3)c2)cc1 ZINC000482944268 898568630 /nfs/dbraw/zinc/56/86/30/898568630.db2.gz KQHZIMMQSOJLNB-QGZVFWFLSA-N 0 3 412.534 4.020 20 0 HIADHN C[C@H](NCc1ccnc(OC2CCOCC2)c1)c1ccc(OCC(F)(F)F)cc1 ZINC000482961927 898591706 /nfs/dbraw/zinc/59/17/06/898591706.db2.gz PFWLUXFOGHRJNQ-HNNXBMFYSA-N 0 3 410.436 4.431 20 0 HIADHN CO[C@@]1(C)CCCN([C@@H](C)C(=O)Nc2ccc(NC(=O)c3cccs3)cc2)CC1 ZINC000483014530 898670086 /nfs/dbraw/zinc/67/00/86/898670086.db2.gz IKJJIBQAUOXYNW-AOMKIAJQSA-N 0 3 415.559 4.218 20 0 HIADHN COc1ccccc1-c1csc(C2CCN(C(=O)CN3CCC(C)CC3)CC2)n1 ZINC000483054222 898727987 /nfs/dbraw/zinc/72/79/87/898727987.db2.gz VWYHAZTWIKMQBL-UHFFFAOYSA-N 0 3 413.587 4.257 20 0 HIADHN C[C@H](NC(=O)Cc1c[nH]c2cc(Br)ccc12)[C@@H](c1ccccc1)N(C)C ZINC000505574452 914280714 /nfs/dbraw/zinc/28/07/14/914280714.db2.gz JGINVYHCMPBMQC-QKKBWIMNSA-N 0 3 414.347 4.281 20 0 HIADHN CCN(CC1CCC1)[C@H](C)C(=O)Nc1ccc(C(=O)Nc2ccccc2OC)cc1 ZINC000483129468 898813143 /nfs/dbraw/zinc/81/31/43/898813143.db2.gz LBLPJRKLRHJQGW-QGZVFWFLSA-N 0 3 409.530 4.397 20 0 HIADHN CC(C)(C)[S@@](=O)Cc1cccc(NC(=O)N2CCN(C3CCCCC3)CC2)c1 ZINC000483172173 898840756 /nfs/dbraw/zinc/84/07/56/898840756.db2.gz XHBIHFDTPWZRCL-NDEPHWFRSA-N 0 3 405.608 4.216 20 0 HIADHN C[C@H](NC(=O)Cc1c[nH]c2cccc(Br)c12)[C@H](c1ccccc1)N(C)C ZINC000505582944 914289840 /nfs/dbraw/zinc/28/98/40/914289840.db2.gz XIUDWMCMOHQPBE-LHSJRXKWSA-N 0 3 414.347 4.281 20 0 HIADHN CCC1(C(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)CCN(C(=O)c2ccccc2)CC1 ZINC000505585124 914291000 /nfs/dbraw/zinc/29/10/00/914291000.db2.gz DBFSDDIEUVTGEF-OFNKIYASSA-N 0 3 421.585 4.127 20 0 HIADHN CC1CCC(O)(CN[C@H](CO)c2ccc(Br)cc2C(F)(F)F)CC1 ZINC000483250036 898891229 /nfs/dbraw/zinc/89/12/29/898891229.db2.gz LWQUDBNYNAOSAG-YWCUFVOSSA-N 0 3 410.274 4.032 20 0 HIADHN Cc1c2ccccc2oc1[C@H](NC(=O)C(=O)Nc1cccc(CN(C)C)c1)C(C)C ZINC000483256526 898897726 /nfs/dbraw/zinc/89/77/26/898897726.db2.gz ICKFWNLIWJXITE-OAQYLSRUSA-N 0 3 407.514 4.255 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)Nc3cc(C(F)(F)F)ccc3Br)[C@H]2C1 ZINC000483330824 898960328 /nfs/dbraw/zinc/96/03/28/898960328.db2.gz CGPNTFDMDJOZDS-HZMBPMFUSA-N 0 3 406.246 4.026 20 0 HIADHN CCOc1cc(CN2CCSCC[C@@H]2C)ccc1OCc1ccc(C(=O)OC)o1 ZINC000483425260 899055545 /nfs/dbraw/zinc/05/55/45/899055545.db2.gz HPGVHHOZBYNIKF-INIZCTEOSA-N 0 3 419.543 4.371 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2CN2CC[C@H](N3CCCC3=O)C2)cc1 ZINC000483429640 899060318 /nfs/dbraw/zinc/06/03/18/899060318.db2.gz GNCIXIFBESKFKR-QHCPKHFHSA-N 0 3 400.526 4.044 20 0 HIADHN COCCOc1cccc(CN2CCC(c3noc(-c4ccccc4OC)n3)CC2)c1 ZINC000483432567 899062497 /nfs/dbraw/zinc/06/24/97/899062497.db2.gz IYQKPPAKBQCSQD-UHFFFAOYSA-N 0 3 423.513 4.150 20 0 HIADHN Cc1noc(C)c1COc1cccc(C(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)c1 ZINC000505606190 914310618 /nfs/dbraw/zinc/31/06/18/914310618.db2.gz GQDOTVYWMMFOIK-HXOBKFHXSA-N 0 3 407.514 4.292 20 0 HIADHN Cc1cc(NC(=O)c2ccco2)sc1C(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C ZINC000505605946 914310995 /nfs/dbraw/zinc/31/09/95/914310995.db2.gz JDQCNDRQEKUTJP-HNAYVOBHSA-N 0 3 411.527 4.323 20 0 HIADHN Cc1sc2ncnc(SCC(=O)N[C@H](C)[C@H](c3ccccc3)N(C)C)c2c1C ZINC000505609142 914312944 /nfs/dbraw/zinc/31/29/44/914312944.db2.gz KHSVJLMICLWVGT-AUUYWEPGSA-N 0 3 414.600 4.208 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1cc(F)c(OC(F)F)cc1F)c1ccco1 ZINC000483448930 899086131 /nfs/dbraw/zinc/08/61/31/899086131.db2.gz RZKRIYICUKWGLN-HZMBPMFUSA-N 0 3 403.376 4.410 20 0 HIADHN C[C@H](NC(=O)CSCc1cc(-c2cccs2)on1)[C@@H](c1ccccc1)N(C)C ZINC000505611884 914315632 /nfs/dbraw/zinc/31/56/32/914315632.db2.gz OYKMOUQTFDKEML-BTYIYWSLSA-N 0 3 415.584 4.444 20 0 HIADHN Cc1nn(-c2cccc(Cl)c2)c2sc(C(=O)N(CCN(C)C)C3CC3)cc12 ZINC000505628216 914327413 /nfs/dbraw/zinc/32/74/13/914327413.db2.gz BKYOULDRVBGUCK-UHFFFAOYSA-N 0 3 402.951 4.215 20 0 HIADHN Cc1ccc(-c2nc3c(s2)[C@H](NCc2cccc(OCC(N)=O)c2)CCC3)cc1 ZINC000483637562 899292620 /nfs/dbraw/zinc/29/26/20/899292620.db2.gz HUOYNKYAZZFWDY-LJQANCHMSA-N 0 3 407.539 4.150 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)Nc2c(F)cc(F)cc2-c2ccccc2)CC1 ZINC000483645506 899300928 /nfs/dbraw/zinc/30/09/28/899300928.db2.gz BZMBNXCNWHFVKK-KRWDZBQOSA-N 0 3 416.516 4.027 20 0 HIADHN CCN1CCN(c2ccccc2CN[C@H](C)c2nc(-c3ccc(F)c(C)c3)no2)CC1 ZINC000483649262 899306471 /nfs/dbraw/zinc/30/64/71/899306471.db2.gz DOYAGCZEQLEQAN-GOSISDBHSA-N 0 3 423.536 4.177 20 0 HIADHN COc1ccccc1-c1noc([C@H](C)NC2CCC(C(=O)OC(C)(C)C)CC2)n1 ZINC000483651894 899310041 /nfs/dbraw/zinc/31/00/41/899310041.db2.gz HNEJMGVZMYRUKR-FHERZECASA-N 0 3 401.507 4.296 20 0 HIADHN COc1ccc2[nH]c3c(c2c1)C[C@H](N[C@@H](C)c1nc(-c2cccc(OC)c2)no1)CC3 ZINC000483655338 899314075 /nfs/dbraw/zinc/31/40/75/899314075.db2.gz PRPACZLYFXTRNT-GOEBONIOSA-N 0 3 418.497 4.443 20 0 HIADHN CC[C@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)c1cccc(Br)c1 ZINC000483707443 899363191 /nfs/dbraw/zinc/36/31/91/899363191.db2.gz BTMGUMUAFZGUPH-ICSRJNTNSA-N 0 3 414.347 4.328 20 0 HIADHN CNS(=O)(=O)c1ccc([C@@H](C)NCc2ccc(-c3cccc(OC)c3)cc2)cc1 ZINC000483712557 899369417 /nfs/dbraw/zinc/36/94/17/899369417.db2.gz LKWCOUOTNCJSSN-QGZVFWFLSA-N 0 3 410.539 4.121 20 0 HIADHN COCCOc1ccc([C@@H](C)N[C@@H]2CCCN(c3ccccc3Cl)C2=O)cc1 ZINC000483716586 899374327 /nfs/dbraw/zinc/37/43/27/899374327.db2.gz VOYRUOWFHRMPAQ-OXQOHEQNSA-N 0 3 402.922 4.211 20 0 HIADHN CC[C@@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)c1ccc(OC(F)F)cc1 ZINC000483717227 899375492 /nfs/dbraw/zinc/37/54/92/899375492.db2.gz YXENIWMKKKVADW-QUCCMNQESA-N 0 3 401.457 4.167 20 0 HIADHN Cc1noc2nc(-c3ccccc3)cc(C(=O)N3CCN(C4CCCCC4)CC3)c12 ZINC000483851449 899532355 /nfs/dbraw/zinc/53/23/55/899532355.db2.gz COGHDAKYVHRGAX-UHFFFAOYSA-N 0 3 404.514 4.289 20 0 HIADHN Cc1c([C@H](C)NC[C@H](CCO)CC(C)C)nnn1-c1cccc(Br)c1 ZINC000483852340 899534948 /nfs/dbraw/zinc/53/49/48/899534948.db2.gz RGRKEUCDBXVTRB-GOEBONIOSA-N 0 3 409.372 4.034 20 0 HIADHN CCC1(CN[C@@H](C)c2nnn(-c3cccc(Br)c3)c2C)CCOCC1 ZINC000483855782 899539293 /nfs/dbraw/zinc/53/92/93/899539293.db2.gz XUJKORGINBQEGQ-AWEZNQCLSA-N 0 3 407.356 4.196 20 0 HIADHN CC[C@@H]1Oc2cc([C@@H](C)N[C@@H](C)c3ccc4c(c3)C(C)(C)C(=O)N4)ccc2NC1=O ZINC000483857132 899540674 /nfs/dbraw/zinc/54/06/74/899540674.db2.gz JZZYGRDMNOTLQQ-MNVSYLFESA-N 0 3 407.514 4.438 20 0 HIADHN CC[C@@H]1Oc2cc([C@@H](C)N[C@@H](C)c3cccc(N4CCOCC4)c3)ccc2NC1=O ZINC000483858723 899542112 /nfs/dbraw/zinc/54/21/12/899542112.db2.gz MJQSDRMMFBBGKM-JKSBSHDWSA-N 0 3 409.530 4.045 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N[C@H](c1cc(F)ccc1F)C(F)F)c1ccco1 ZINC000483877993 899556204 /nfs/dbraw/zinc/55/62/04/899556204.db2.gz UHPYIGMRWJXNBW-XNJJOIOASA-N 0 3 401.404 4.293 20 0 HIADHN O=C(Nc1ccc(Cl)cn1)C1CCN(CCOc2ccc(Cl)c(F)c2)CC1 ZINC000483952424 899603086 /nfs/dbraw/zinc/60/30/86/899603086.db2.gz VVZSVRWBENFODV-UHFFFAOYSA-N 0 3 412.292 4.257 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2ccnc(Oc3ccccc3)c2)c1 ZINC000483974606 899617965 /nfs/dbraw/zinc/61/79/65/899617965.db2.gz DWDRKCNHAVIQAO-UHFFFAOYSA-N 0 3 420.513 4.478 20 0 HIADHN Cc1cc(-n2ccnc2)ccc1CN(C)[C@H](CO)c1cccc(Br)c1 ZINC000484067686 899700010 /nfs/dbraw/zinc/70/00/10/899700010.db2.gz IQTGFKFJJYHDFF-HXUWFJFHSA-N 0 3 400.320 4.109 20 0 HIADHN CSc1cccc(N(C(=O)[C@@H](C)Oc2cccc(F)c2)C2CCN(C)CC2)c1 ZINC000484292194 899856657 /nfs/dbraw/zinc/85/66/57/899856657.db2.gz GLAOIEHDRRGMIR-MRXNPFEDSA-N 0 3 402.535 4.442 20 0 HIADHN Cc1csc2nc(CN[C@](C)(c3ccc(Br)cc3)C(C)C)cc(=O)n12 ZINC000484325267 899880721 /nfs/dbraw/zinc/88/07/21/899880721.db2.gz BQUDAMXZZAMVKZ-IBGZPJMESA-N 0 3 420.376 4.488 20 0 HIADHN CSc1cccc(N(C(=O)c2cn(-c3cccc(C)c3)nn2)C2CCN(C)CC2)c1 ZINC000484400850 899925988 /nfs/dbraw/zinc/92/59/88/899925988.db2.gz BDANPHJCUWCSFD-UHFFFAOYSA-N 0 3 421.570 4.039 20 0 HIADHN CSc1cccc(N(C(=O)c2ccc(Br)cn2)C2CCN(C)CC2)c1 ZINC000484406747 899930750 /nfs/dbraw/zinc/93/07/50/899930750.db2.gz QZRBCESWQRPJAZ-UHFFFAOYSA-N 0 3 420.376 4.307 20 0 HIADHN COCCOc1ccc(C(=O)N(c2cccc(SC)c2)C2CCN(C)CC2)cc1 ZINC000484408874 899931550 /nfs/dbraw/zinc/93/15/50/899931550.db2.gz VEDYPZFKHNHXBM-UHFFFAOYSA-N 0 3 414.571 4.175 20 0 HIADHN Cc1cccc(-c2cc(Cl)ccc2NC(=O)C(=O)N[C@H](C)C2=CCN(C)CC2)c1 ZINC000484416324 899934380 /nfs/dbraw/zinc/93/43/80/899934380.db2.gz ZIJCZEBILJGMFX-MRXNPFEDSA-N 0 3 411.933 4.021 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(S(=O)(=O)N(C)C)cc1)c1ccc(-c2cccnc2)cc1 ZINC000484473162 899966708 /nfs/dbraw/zinc/96/67/08/899966708.db2.gz MCEGFIPDUUHFOM-ROUUACIJSA-N 0 3 409.555 4.411 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)CCN[C@H](C)c1cccc(N2CCCC2=O)c1 ZINC000484487471 899979693 /nfs/dbraw/zinc/97/96/93/899979693.db2.gz DCFVBDKVTLVXJF-OAHLLOKOSA-N 0 3 415.921 4.155 20 0 HIADHN Cc1ccc(CN[C@H](C)c2cccc(N3CCOCC3)c2)c(OC[C@H]2CCCO2)c1 ZINC000484497987 899988317 /nfs/dbraw/zinc/98/83/17/899988317.db2.gz KCWOOUBQJOAKFP-HYBUGGRVSA-N 0 3 410.558 4.240 20 0 HIADHN C[C@H](N[C@@H]1CCN(c2c(F)cccc2F)C1)c1ccc(-n2cncn2)cc1Cl ZINC000484623032 900075961 /nfs/dbraw/zinc/07/59/61/900075961.db2.gz QQNWSQRGGCBIHF-UONOGXRCSA-N 0 3 403.864 4.128 20 0 HIADHN CSCc1cc(F)ccc1CN[C@@H](C)c1cccc(N2CCCS2(=O)=O)c1 ZINC000484624705 900077927 /nfs/dbraw/zinc/07/79/27/900077927.db2.gz UVYJKBVLNJWLCE-HNNXBMFYSA-N 0 3 408.564 4.079 20 0 HIADHN C[C@@H](N[C@@H](C)c1cccc(N2CCCS2(=O)=O)c1)c1cccc(N2CCCC2)c1 ZINC000484644054 900089553 /nfs/dbraw/zinc/08/95/53/900089553.db2.gz TUGKBDNRBFDIOJ-MOPGFXCFSA-N 0 3 413.587 4.239 20 0 HIADHN CCc1c(NC(=O)NCCN2CCCCC2)cnn1-c1ccc(C(F)(F)F)cc1 ZINC000484806184 900209483 /nfs/dbraw/zinc/20/94/83/900209483.db2.gz AAECWEUYEZAAPH-UHFFFAOYSA-N 0 3 409.456 4.061 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)C(C)(C)c3ccc(F)cc3)CC2)c1 ZINC000484845631 900242937 /nfs/dbraw/zinc/24/29/37/900242937.db2.gz HZZPJSNHRKJWBI-UHFFFAOYSA-N 0 3 411.565 4.130 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(N[C@@H](C)[C@H]3CC[N@H+](Cc4ccccc4)C3)nc2)n1 ZINC000485191007 900484745 /nfs/dbraw/zinc/48/47/45/900484745.db2.gz VFBXBJQTKDRZSV-PXNSSMCTSA-N 0 3 403.530 4.129 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(N[C@@H](C)[C@H]3CC[N@@H+](Cc4ccccc4)C3)nc2)n1 ZINC000485191007 900484754 /nfs/dbraw/zinc/48/47/54/900484754.db2.gz VFBXBJQTKDRZSV-PXNSSMCTSA-N 0 3 403.530 4.129 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(N[C@H](C)[C@H]3CC[N@H+](Cc4ccccc4)C3)nc2)n1 ZINC000485191010 900484908 /nfs/dbraw/zinc/48/49/08/900484908.db2.gz VFBXBJQTKDRZSV-XLIONFOSSA-N 0 3 403.530 4.129 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(N[C@H](C)[C@H]3CC[N@@H+](Cc4ccccc4)C3)nc2)n1 ZINC000485191010 900484915 /nfs/dbraw/zinc/48/49/15/900484915.db2.gz VFBXBJQTKDRZSV-XLIONFOSSA-N 0 3 403.530 4.129 20 0 HIADHN CCc1c(NC(=O)N2CCC(CN3C[C@@H](C)O[C@H](C)C3)CC2)cnn1C(CC)CC ZINC000485210117 900500207 /nfs/dbraw/zinc/50/02/07/900500207.db2.gz RDEUYMKWQMOBGC-QZTJIDSGSA-N 0 3 419.614 4.160 20 0 HIADHN CCc1c(NC(=O)N[C@@H]2CCCN(C)[C@@H]2C)cnn1-c1cccc(C(F)(F)F)c1 ZINC000485323431 900605022 /nfs/dbraw/zinc/60/50/22/900605022.db2.gz PCCVTJVAATXUQO-CZUORRHYSA-N 0 3 409.456 4.058 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)NCc1nc2cc(Cl)ccc2s1)c1ccco1 ZINC000485411454 900709176 /nfs/dbraw/zinc/70/91/76/900709176.db2.gz KPEMXLPSYOTXQW-SWLSCSKDSA-N 0 3 406.939 4.471 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)Nc2ccc(-n3cccn3)c(F)c2)CC1 ZINC000485586156 900850032 /nfs/dbraw/zinc/85/00/32/900850032.db2.gz ROMIXNMHRRRHKB-UHFFFAOYSA-N 0 3 407.493 4.140 20 0 HIADHN CC(C)C(=O)Nc1ccc(CNC(=O)N(Cc2ccccc2)C2CCN(C)CC2)cc1 ZINC000485596946 900858681 /nfs/dbraw/zinc/85/86/81/900858681.db2.gz GZFFHQLACWPXAT-UHFFFAOYSA-N 0 3 422.573 4.087 20 0 HIADHN CN(C)Cc1ccccc1C(=O)NC[C@@H](c1ccccc1)N1CCc2sccc2C1 ZINC000485604001 900863343 /nfs/dbraw/zinc/86/33/43/900863343.db2.gz UDFYTTLJWDGTHB-QHCPKHFHSA-N 0 3 419.594 4.339 20 0 HIADHN CCc1ccc(Cl)c(CC)c1NC(=O)CCCN1CC[C@](O)(C(F)(F)F)C1 ZINC000485677441 900929760 /nfs/dbraw/zinc/92/97/60/900929760.db2.gz FDFSPHHDRLKFLR-GOSISDBHSA-N 0 3 406.876 4.183 20 0 HIADHN COCCO[C@H]1COCC[C@@H]1NCc1ccc(-c2ccc(Cl)c(Cl)c2)o1 ZINC000485724181 900973493 /nfs/dbraw/zinc/97/34/93/900973493.db2.gz KSNBZBDFHMRYPJ-HKUYNNGSSA-N 0 3 400.302 4.164 20 0 HIADHN C[C@H]([NH2+]C(C)(C)CNC(=O)NCc1ccc([O-])c(Br)c1)c1ccccc1 ZINC000485773852 901030189 /nfs/dbraw/zinc/03/01/89/901030189.db2.gz IFCIKQDGSPRVOF-AWEZNQCLSA-N 0 3 420.351 4.083 20 0 HIADHN Cc1cccc2c1[C@@H](C)C[C@@H]2CC(=O)Nc1ccc2oc(=O)n(CCN(C)C)c2c1 ZINC000485796978 901048796 /nfs/dbraw/zinc/04/87/96/901048796.db2.gz VSUMZNQLEPZPHO-DLBZAZTESA-N 0 3 407.514 4.084 20 0 HIADHN C[C@@H]1CN(C)C[C@@H]1C(=O)Nc1nnc(SCc2c(Cl)cccc2Cl)s1 ZINC000485859319 901100025 /nfs/dbraw/zinc/10/00/25/901100025.db2.gz ZXWUMMDGAQBUPN-ZJUUUORDSA-N 0 3 417.387 4.273 20 0 HIADHN CC(=O)c1ccc(C(=O)N(C[C@H]2CCN(Cc3ccccc3)C2)CC(F)(F)F)o1 ZINC000485901502 901132320 /nfs/dbraw/zinc/13/23/20/901132320.db2.gz SGHLFYOHKDRCES-KRWDZBQOSA-N 0 3 408.420 4.009 20 0 HIADHN C[C@@H]1CC(=O)CC[C@@H]1C(=O)N1CCC(N(C)Cc2cccc(C(F)(F)F)c2)CC1 ZINC000485945812 901165841 /nfs/dbraw/zinc/16/58/41/901165841.db2.gz QPKUDXTXVYRRBK-QRWLVFNGSA-N 0 3 410.480 4.134 20 0 HIADHN CCOC(=O)c1cnc2ccc(C)cc2c1N(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1 ZINC000485998960 901215278 /nfs/dbraw/zinc/21/52/78/901215278.db2.gz DGXDMONBFDYMNF-CVDCTZTESA-N 0 3 418.541 4.244 20 0 HIADHN Cc1nc2sc3c(c2c(N(C)C[C@@H]2CCCN(C)[C@H]2c2cnn(C)c2)n1)CCCC3 ZINC000486002088 901216133 /nfs/dbraw/zinc/21/61/33/901216133.db2.gz INTPBEFCHKWUJO-HRAATJIYSA-N 0 3 424.618 4.131 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)c1cc(F)c(F)c(F)c1 ZINC000486166659 901353726 /nfs/dbraw/zinc/35/37/26/901353726.db2.gz QWPUIJIKYOTWKJ-UHFFFAOYSA-N 0 3 404.354 4.327 20 0 HIADHN C[C@@H](C(=O)NC(c1ccccc1)c1ccccc1)N1CCN(C2CCCCC2)CC1 ZINC000486227906 901410473 /nfs/dbraw/zinc/41/04/73/901410473.db2.gz DFNIUHTUXLDUMB-NRFANRHFSA-N 0 3 405.586 4.231 20 0 HIADHN O=C(CN1CCN(C2CCCCC2)CC1)Nc1cccc(CSc2ccccn2)c1 ZINC000486244299 901426950 /nfs/dbraw/zinc/42/69/50/901426950.db2.gz SQQZWHSNPDJAEI-UHFFFAOYSA-N 0 3 424.614 4.263 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)Nc1cccc(COc2ccc(F)cc2)c1 ZINC000486422688 901580888 /nfs/dbraw/zinc/58/08/88/901580888.db2.gz XUTFSRODUBAEQQ-UHFFFAOYSA-N 0 3 422.504 4.395 20 0 HIADHN Cc1cc(C)n([C@@H](C)CC(=O)N[C@H](c2ccc(F)c(F)c2)C(C)(C)N2CCCC2)n1 ZINC000486562104 901707187 /nfs/dbraw/zinc/70/71/87/901707187.db2.gz QFJOTCARBWRKIL-HTAPYJJXSA-N 0 3 418.532 4.461 20 0 HIADHN CC(C)[C@@H](Oc1ccc(Cl)cc1)C(=O)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000486564643 901709899 /nfs/dbraw/zinc/70/98/99/901709899.db2.gz JLZPXZDMBOLLQM-JOCHJYFZSA-N 0 3 416.949 4.339 20 0 HIADHN C[C@H]1CN(C2CCOCC2)CCN1C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 ZINC000486770683 901843422 /nfs/dbraw/zinc/84/34/22/901843422.db2.gz JHFYFQOHHFNYSK-LBPRGKRZSA-N 0 3 405.848 4.076 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1ccn(-c2c(F)cccc2F)n1)c1ccsc1 ZINC000486809012 901867350 /nfs/dbraw/zinc/86/73/50/901867350.db2.gz MXEUUQALPZANIP-SFHVURJKSA-N 0 3 404.486 4.025 20 0 HIADHN O=C(N[C@@H](c1ccccc1)c1ccncc1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000486828770 901879827 /nfs/dbraw/zinc/87/98/27/901879827.db2.gz RCQYZQIUAYTUOO-VWNXMTODSA-N 0 3 403.501 4.339 20 0 HIADHN O=C(N[C@@H](c1ccccc1)c1ccncc1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000486828768 901880118 /nfs/dbraw/zinc/88/01/18/901880118.db2.gz RCQYZQIUAYTUOO-UPVQGACJSA-N 0 3 403.501 4.339 20 0 HIADHN CC(C)(C)Oc1cccc(CN2C[C@H]3CCC[C@@]3(c3nc(-c4cccnc4)no3)C2)n1 ZINC000486846097 901892912 /nfs/dbraw/zinc/89/29/12/901892912.db2.gz XMQAWUAJFITSNW-HOYKHHGWSA-N 0 3 419.529 4.258 20 0 HIADHN CC[C@H]1CCCCN1C(=O)[C@H](C)N1C[C@H]2CCC[C@@]2(c2nc(-c3ccccc3)no2)C1 ZINC000486851673 901896667 /nfs/dbraw/zinc/89/66/67/901896667.db2.gz BDVZVZLGAHEUJD-BINBFKAUSA-N 0 3 422.573 4.270 20 0 HIADHN C[C@@H](Cc1ccc(Br)cc1)NC(=O)N(CCN(C)C)Cc1ccccc1 ZINC000505926125 914575025 /nfs/dbraw/zinc/57/50/25/914575025.db2.gz BLDRSEUKLDRMPI-KRWDZBQOSA-N 0 3 418.379 4.154 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)Nc2nnc(/C=C/c3ccco3)s2)c1 ZINC000486892557 901935677 /nfs/dbraw/zinc/93/56/77/901935677.db2.gz ZYJFGFLHZARFRD-MDZDMXLPSA-N 0 3 411.531 4.206 20 0 HIADHN Cc1n[nH]c(C)c1[C@@H](C)C(=O)N[C@@H](c1ccc(F)c(F)c1)C(C)(C)N1CCCC1 ZINC000487138210 902069755 /nfs/dbraw/zinc/06/97/55/902069755.db2.gz NAKVJKHRRUCXME-XCLFUZPHSA-N 0 3 404.505 4.140 20 0 HIADHN CCOc1cc(CNCc2cscc2C)ccc1OCC(=O)N1CCCCC1 ZINC000487172031 902084222 /nfs/dbraw/zinc/08/42/22/902084222.db2.gz MVFFIHGSNPCWII-UHFFFAOYSA-N 0 3 402.560 4.136 20 0 HIADHN Cc1ccc(CNCc2ccc(-c3ccccc3Br)s2)c(=O)n1C ZINC000487207631 902101902 /nfs/dbraw/zinc/10/19/02/902101902.db2.gz QBOLCITZQZNQHO-UHFFFAOYSA-N 0 3 403.345 4.475 20 0 HIADHN C[C@@H](NCc1cnc(-c2ccco2)s1)c1cc(F)ccc1N1CCN(C)CC1 ZINC000487293323 902139035 /nfs/dbraw/zinc/13/90/35/902139035.db2.gz ZHJLZAVBGIQXLO-OAHLLOKOSA-N 0 3 400.523 4.145 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)[C@H]2CCO[C@@H]2c2ccnn2-c2ccccc2C)c1 ZINC000487309946 902147088 /nfs/dbraw/zinc/14/70/88/902147088.db2.gz LTZSUPJPAOOGKS-URXFXBBRSA-N 0 3 418.541 4.267 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)N[C@@H]1CCC[C@@H](c2ccccc2)C1 ZINC000487417845 902200414 /nfs/dbraw/zinc/20/04/14/902200414.db2.gz WHVITRPPGKMLRV-ZJSXRUAMSA-N 0 3 421.585 4.169 20 0 HIADHN CN(C)Cc1ccccc1C(=O)N1CCC(Nc2cccc(Br)c2)CC1 ZINC000487496673 902225681 /nfs/dbraw/zinc/22/56/81/902225681.db2.gz YYVMXOJBPJGWQP-UHFFFAOYSA-N 0 3 416.363 4.227 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(Oc2cccnc2)cc1)C(=O)NC(=O)NC1CCCCC1 ZINC000487995797 902518394 /nfs/dbraw/zinc/51/83/94/902518394.db2.gz SBRKNXHQWCZZJY-DLBZAZTESA-N 0 3 410.518 4.072 20 0 HIADHN CCc1nc2ccccc2n1C1CCN(CCC(=O)c2ccc3c(c2)OCCO3)CC1 ZINC000488161713 902655464 /nfs/dbraw/zinc/65/54/64/902655464.db2.gz MBVAQBDBFVZCFD-UHFFFAOYSA-N 0 3 419.525 4.280 20 0 HIADHN CC(=O)N(c1nc(CN2CCN(C)[C@@H](C(C)C)C2)cs1)c1cccc(Cl)c1 ZINC000488181828 902669886 /nfs/dbraw/zinc/66/98/86/902669886.db2.gz GCYAPJBHTBGQSK-LJQANCHMSA-N 0 3 406.983 4.253 20 0 HIADHN C[C@H]1CN(C2CCOCC2)CCN1C(=O)Nc1c(F)cc(F)cc1-c1ccccc1 ZINC000488383324 902793130 /nfs/dbraw/zinc/79/31/30/902793130.db2.gz XTWCITUVTSAXPJ-INIZCTEOSA-N 0 3 415.484 4.349 20 0 HIADHN C[C@H]1CN(C2CCOCC2)CCN1C(=O)Nc1ccc(Oc2cccc(F)c2)cc1 ZINC000488394593 902803767 /nfs/dbraw/zinc/80/37/67/902803767.db2.gz IPLZMZNICJZFOS-KRWDZBQOSA-N 0 3 413.493 4.335 20 0 HIADHN COc1ccc(S(=O)(=O)[N-]c2cccc(C[NH2+][C@H]3CS[C@@H](C(C)C)C3)c2)cc1 ZINC000488418278 902818320 /nfs/dbraw/zinc/81/83/20/902818320.db2.gz NFMQKFPHRHCGHF-WIYYLYMNSA-N 0 3 420.600 4.116 20 0 HIADHN CC(C)[C@@H]1C[C@H](N[C@H](CN2CCCC2=O)c2cccc(C(F)(F)F)c2)CS1 ZINC000488426116 902821338 /nfs/dbraw/zinc/82/13/38/902821338.db2.gz VKHNMPBZQHOLHI-KSZLIROESA-N 0 3 400.510 4.489 20 0 HIADHN C[C@@H](c1cccc(N2CCCS2(=O)=O)c1)N(C)Cc1cccc(Br)c1 ZINC000488429800 902823725 /nfs/dbraw/zinc/82/37/25/902823725.db2.gz FGDZDLFOQRJWPP-HNNXBMFYSA-N 0 3 423.376 4.182 20 0 HIADHN Cc1ccnc(Oc2cc(NC(=O)N3CCN(C4CCOCC4)C[C@H]3C)ccc2C)c1 ZINC000488495187 902855223 /nfs/dbraw/zinc/85/52/23/902855223.db2.gz BUYMVDSXLXKXIE-LJQANCHMSA-N 0 3 424.545 4.208 20 0 HIADHN C[C@@H]1CN(C2CCOCC2)CCN1C(=O)Nc1ccc(OC2CCCCC2)cc1 ZINC000488517945 902866507 /nfs/dbraw/zinc/86/65/07/902866507.db2.gz DGFIBTRLMXNNDW-GOSISDBHSA-N 0 3 401.551 4.115 20 0 HIADHN C[C@@H]1CN(C2CCOCC2)CCN1C(=O)Nc1ccc2nc(C(C)(C)C)sc2c1 ZINC000488524810 902869540 /nfs/dbraw/zinc/86/95/40/902869540.db2.gz XFXUMCKWPIYPAZ-OAHLLOKOSA-N 0 3 416.591 4.311 20 0 HIADHN CC[C@@H](C)N(CC(=O)Nc1ccccc1C(F)(F)F)C[C@H](O)Cc1ccccc1 ZINC000488616468 902902112 /nfs/dbraw/zinc/90/21/12/902902112.db2.gz HXPUVYDGUYAAOB-SJLPKXTDSA-N 0 3 408.464 4.348 20 0 HIADHN C[C@H]1CN(C2CCOCC2)CCN1C(=O)Nc1cc(Cl)cc(C(F)(F)F)c1 ZINC000488637543 902911986 /nfs/dbraw/zinc/91/19/86/902911986.db2.gz MIPXQMPALQRRSI-LBPRGKRZSA-N 0 3 405.848 4.076 20 0 HIADHN C[C@H]1C[C@@H]1C(=O)Nc1cccc(C(=O)N(Cc2ccccc2)C2CCN(C)CC2)c1 ZINC000488672763 902932924 /nfs/dbraw/zinc/93/29/24/902932924.db2.gz FIDKOAITIYSABL-MBSDFSHPSA-N 0 3 405.542 4.018 20 0 HIADHN CC(C)n1ncc(C(=O)N2CCC(CN3C[C@H](C)O[C@@H](C)C3)CC2)c1-c1ccccc1 ZINC000488829269 903029488 /nfs/dbraw/zinc/02/94/88/903029488.db2.gz CUWNAXWFEGHLDQ-PMACEKPBSA-N 0 3 424.589 4.092 20 0 HIADHN COc1ccc(NC(=O)[C@H](C)N[C@@H](COc2ccccc2F)C(C)(C)C)c(OC)c1 ZINC000489025195 903128223 /nfs/dbraw/zinc/12/82/23/903128223.db2.gz CLDWXXWBHGUTGY-BTYIYWSLSA-N 0 3 418.509 4.253 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)N[C@@H](c2ccccc2)[C@@H]2CCCO2)CC1 ZINC000489147114 903232114 /nfs/dbraw/zinc/23/21/14/903232114.db2.gz DGJTUPVNTYQRHI-ZEQRLZLVSA-N 0 3 407.558 4.213 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)NC[C@@H]2CCCO[C@@H]2c2ccccc2)CC1 ZINC000489368586 903349005 /nfs/dbraw/zinc/34/90/05/903349005.db2.gz NAGQCNIBBQHRNS-UKILVPOCSA-N 0 3 421.585 4.460 20 0 HIADHN CC(C)c1ccc2c(c1)[C@@H](NCCOc1ccc(S(C)(=O)=O)cc1)CCCO2 ZINC000489467411 903400561 /nfs/dbraw/zinc/40/05/61/903400561.db2.gz UGQBOLGBMNGSKC-NRFANRHFSA-N 0 3 403.544 4.096 20 0 HIADHN CC[C@@H](CN1CCN(CC(=O)Nc2ccccc2C(F)(F)F)CC1)c1ccccc1 ZINC000506034410 914717294 /nfs/dbraw/zinc/71/72/94/914717294.db2.gz CUUXWAMFJDKRIX-SFHVURJKSA-N 0 3 419.491 4.455 20 0 HIADHN Cc1cc(C(C)(C)C)cc2c1OCCC[C@H]2NCc1cccnc1N1CCN(C)CC1 ZINC000489558043 903461939 /nfs/dbraw/zinc/46/19/39/903461939.db2.gz NKMPRXVPPAVVDO-HSZRJFAPSA-N 0 3 422.617 4.443 20 0 HIADHN C[C@@H](c1nc2ccccc2n1C(F)F)N1CCC(CCCN2CCOCC2)CC1 ZINC000506035317 914720822 /nfs/dbraw/zinc/72/08/22/914720822.db2.gz FRJONJOKZXESTN-KRWDZBQOSA-N 0 3 406.521 4.317 20 0 HIADHN Cc1ccc(NC(=O)N(CCN(C)C)Cc2cccs2)cc1C(=O)N(C)C(C)C ZINC000489607584 903496245 /nfs/dbraw/zinc/49/62/45/903496245.db2.gz GHYVPKFNQUNXKW-UHFFFAOYSA-N 0 3 416.591 4.133 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)Nc2cc(Cl)ccc2C(F)(F)F)CC1 ZINC000489730622 903564571 /nfs/dbraw/zinc/56/45/71/903564571.db2.gz BOEGAZPZQBXRSY-UHFFFAOYSA-N 0 3 407.864 4.370 20 0 HIADHN C[C@H](c1cccc(Cl)c1)N(C)C(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000489784441 903596762 /nfs/dbraw/zinc/59/67/62/903596762.db2.gz XNGGPODDIHDVKT-QGZVFWFLSA-N 0 3 415.965 4.199 20 0 HIADHN CC(=O)Nc1cccc([C@H](C)NC(=O)N(Cc2ccccc2)C2CCN(C)CC2)c1 ZINC000489877572 903647523 /nfs/dbraw/zinc/64/75/23/903647523.db2.gz UOEMDLAVUZQKCB-SFHVURJKSA-N 0 3 408.546 4.012 20 0 HIADHN Cc1sc(CC(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)nc1C(C)C ZINC000489954508 903696560 /nfs/dbraw/zinc/69/65/60/903696560.db2.gz PJZFQXJCONFIOL-LJQANCHMSA-N 0 3 403.592 4.324 20 0 HIADHN Cc1ccc([C@@H]2C[C@H](C)N(CC(=O)NCC3(c4ccccc4)CCOCC3)C2)cc1 ZINC000490060840 903751788 /nfs/dbraw/zinc/75/17/88/903751788.db2.gz JHTYRWDTZKWTML-JTHBVZDNSA-N 0 3 406.570 4.037 20 0 HIADHN Cn1cc([C@H](NC2CCN(Cc3ccc(F)c(F)c3)CC2)c2cccc(F)c2)cn1 ZINC000490123822 903780675 /nfs/dbraw/zinc/78/06/75/903780675.db2.gz FSVLGUCEYQGOJG-HSZRJFAPSA-N 0 3 414.475 4.181 20 0 HIADHN O=C(NCCCN[C@H](c1ccccc1)c1ccccn1)c1cccc(Br)c1 ZINC000490129036 903782352 /nfs/dbraw/zinc/78/23/52/903782352.db2.gz BYWFZZIKKCJMIJ-OAQYLSRUSA-N 0 3 424.342 4.343 20 0 HIADHN Cc1ccc([C@@H](NCCN2CCCC[C@H]2C)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000490168378 903806776 /nfs/dbraw/zinc/80/67/76/903806776.db2.gz UVUVFDRDPMREGO-YKSBVNFPSA-N 0 3 414.615 4.260 20 0 HIADHN Cc1ccc(C)c([C@H](NCC2CCN(S(C)(=O)=O)CC2)c2ccccc2Cl)c1 ZINC000490171229 903808036 /nfs/dbraw/zinc/80/80/36/903808036.db2.gz AWELDWPGTZILJR-JOCHJYFZSA-N 0 3 421.006 4.307 20 0 HIADHN C[C@H](c1nnc(-c2cccc(Cl)c2)o1)N1CCC(CCCN2CCOCC2)CC1 ZINC000506052873 914751269 /nfs/dbraw/zinc/75/12/69/914751269.db2.gz ZYTXMEAMXWPOGD-QGZVFWFLSA-N 0 3 418.969 4.275 20 0 HIADHN Cc1ccc(C)c([C@H](NCc2cccnc2N2CCN(C)CC2)c2ccccc2)c1 ZINC000490171861 903809247 /nfs/dbraw/zinc/80/92/47/903809247.db2.gz JEQHSOZKORWARQ-RUZDIDTESA-N 0 3 400.570 4.329 20 0 HIADHN CCc1ccc([C@@H](NC[C@H](CC)N2CCCC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000490171906 903809371 /nfs/dbraw/zinc/80/93/71/903809371.db2.gz JONKECLJKPHIJQ-LADGPHEKSA-N 0 3 414.615 4.206 20 0 HIADHN c1ccc([C@@H](NCC2(c3ccc4c(c3)OCO4)CCOCC2)c2ccccn2)cc1 ZINC000490173515 903810366 /nfs/dbraw/zinc/81/03/66/903810366.db2.gz VYUTVKLNAQDRBU-XMMPIXPASA-N 0 3 402.494 4.238 20 0 HIADHN CC(C)[C@@H](CN[C@@H](c1ccc(F)cc1)c1cccc(S(C)(=O)=O)c1)N1CCCC1 ZINC000490173559 903811567 /nfs/dbraw/zinc/81/15/67/903811567.db2.gz WIGGNQZDVAYOTP-PKTZIBPZSA-N 0 3 418.578 4.029 20 0 HIADHN C[C@H](CN[C@H](c1ccc(F)cc1)c1cccc(S(C)(=O)=O)c1)N1CCC[C@@H](C)C1 ZINC000490184767 903815035 /nfs/dbraw/zinc/81/50/35/903815035.db2.gz OEUPEBUKSFPWJR-PMAPCBKXSA-N 0 3 418.578 4.029 20 0 HIADHN COc1cccc(CCN[C@@H](c2ccc(C)cc2)c2cccc(S(C)(=O)=O)c2)c1 ZINC000490189655 903817369 /nfs/dbraw/zinc/81/73/69/903817369.db2.gz AGWGJFRGQNSCKP-DEOSSOPVSA-N 0 3 409.551 4.329 20 0 HIADHN CCC(CC)[C@@H](CN[C@H](c1ccc(C)cc1)c1cccc(S(C)(=O)=O)c1)N(C)C ZINC000490191845 903818399 /nfs/dbraw/zinc/81/83/99/903818399.db2.gz XTVYMEUJSSRLLW-DNQXCXABSA-N 0 3 416.631 4.444 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)N[C@@H]2CCCOc3ccccc32)N(C)C)cc1 ZINC000490195544 903820668 /nfs/dbraw/zinc/82/06/68/903820668.db2.gz BMKJAYJHPADOLK-FGZHOGPDSA-N 0 3 411.546 4.290 20 0 HIADHN CC[C@H](CNC(=O)N[C@@H](c1ccccc1)c1ccncc1)N1CCc2ccccc2C1 ZINC000490289958 903878963 /nfs/dbraw/zinc/87/89/63/903878963.db2.gz RHTLXEJFBSUTKU-RPBOFIJWSA-N 0 3 414.553 4.307 20 0 HIADHN Cc1ccc2nc([C@H]3CCCN3C(=O)NC[C@@H](C)N3CCc4ccccc4C3)[nH]c2c1 ZINC000490303145 903891386 /nfs/dbraw/zinc/89/13/86/903891386.db2.gz ZYSQHVJXLLXLAE-WZONZLPQSA-N 0 3 417.557 4.165 20 0 HIADHN CC(C)Oc1ccc2ccccc2c1CN(C)[C@@H](C)c1ccc(S(N)(=O)=O)cc1 ZINC000506056867 914761500 /nfs/dbraw/zinc/76/15/00/914761500.db2.gz ZTEAUAKSBYNWPO-KRWDZBQOSA-N 0 3 412.555 4.467 20 0 HIADHN CCN(Cc1ccc2c(c1)OCO2)Cc1ccc(OC)c(OCc2cccnc2)c1 ZINC000506059984 914763294 /nfs/dbraw/zinc/76/32/94/914763294.db2.gz OJGCOTXBBQUVMK-UHFFFAOYSA-N 0 3 406.482 4.420 20 0 HIADHN CCNC(=O)Nc1ccc(C)c(NC(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)c1 ZINC000490355478 903949180 /nfs/dbraw/zinc/94/91/80/903949180.db2.gz SOKLJCPCZWJFQX-PXNSSMCTSA-N 0 3 409.534 4.093 20 0 HIADHN CN(C(=O)Nc1cc(F)cc(Br)c1F)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000490509548 904059370 /nfs/dbraw/zinc/05/93/70/904059370.db2.gz JCYGHDZHWMQGRN-OAHLLOKOSA-N 0 3 424.289 4.466 20 0 HIADHN CN(C)C[C@@H](NC(=O)Nc1cccc(-c2noc(C(F)(F)F)n2)c1)c1ccccc1 ZINC000490517038 904065817 /nfs/dbraw/zinc/06/58/17/904065817.db2.gz MUIQFDZWIYKWCD-MRXNPFEDSA-N 0 3 419.407 4.180 20 0 HIADHN O=C(Nc1cccc(-c2noc(C(F)(F)F)n2)c1)N1CCN(C2CCCCC2)CC1 ZINC000490530086 904078474 /nfs/dbraw/zinc/07/84/74/904078474.db2.gz YPYWIRZGXHNYEG-UHFFFAOYSA-N 0 3 423.439 4.238 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)NCc1ccc(OC)cc1C(F)(F)F)c1ccco1 ZINC000490729409 904196246 /nfs/dbraw/zinc/19/62/46/904196246.db2.gz CSYPOBPQKGYWIR-DYVFJYSZSA-N 0 3 413.440 4.236 20 0 HIADHN CC(=O)N(c1nc(CN2CCN(CC(C)C)CC2)cs1)c1ccc(Cl)cc1 ZINC000506084277 914790872 /nfs/dbraw/zinc/79/08/72/914790872.db2.gz ADEYOCXJHQDTEX-UHFFFAOYSA-N 0 3 406.983 4.255 20 0 HIADHN CN(C)C[C@H](NC(=O)N[C@@H](c1c[nH]c2ccccc21)C(F)(F)F)c1ccccc1 ZINC000490787530 904234812 /nfs/dbraw/zinc/23/48/12/904234812.db2.gz AHKUWWDVYVDAOP-OALUTQOASA-N 0 3 404.436 4.373 20 0 HIADHN CN(CCNC(=O)N[C@@H](c1c[nH]c2ccccc21)C(F)(F)F)Cc1ccccc1 ZINC000490804570 904251260 /nfs/dbraw/zinc/25/12/60/904251260.db2.gz JXJPZZNCDQODMP-IBGZPJMESA-N 0 3 404.436 4.203 20 0 HIADHN Cc1ccc(NC(=O)Nc2ccccc2)cc1NC(=O)N1CC[C@H]2CCN(C)C[C@H]21 ZINC000490805604 904251372 /nfs/dbraw/zinc/25/13/72/904251372.db2.gz LYMCGFCPQQUAMV-DYESRHJHSA-N 0 3 407.518 4.197 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)c2ccn(-c3ccc(Br)cc3)n2)c1 ZINC000490887906 904304214 /nfs/dbraw/zinc/30/42/14/904304214.db2.gz XKFXDEBDCYEZEJ-UHFFFAOYSA-N 0 3 413.319 4.257 20 0 HIADHN COc1ccccc1-c1ncc(CNCCOc2ccc(Br)cc2)cn1 ZINC000490887234 904304342 /nfs/dbraw/zinc/30/43/42/904304342.db2.gz QCMKNXLXLMSVNO-UHFFFAOYSA-N 0 3 414.303 4.083 20 0 HIADHN COc1ccc(Cl)cc1CNC(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000490980787 904349722 /nfs/dbraw/zinc/34/97/22/904349722.db2.gz ONGSMAYAYWLOIK-UHFFFAOYSA-N 0 3 419.978 4.262 20 0 HIADHN O=C(NCCc1cccc2cccnc21)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000506100427 914803238 /nfs/dbraw/zinc/80/32/38/914803238.db2.gz ANIXEGLKRRFMPS-OAQYLSRUSA-N 0 3 409.480 4.051 20 0 HIADHN CC(C)N(Cc1ccc([S@@](C)=O)cc1)C[C@@H](O)COc1cccc2ccccc21 ZINC000506099415 914803555 /nfs/dbraw/zinc/80/35/55/914803555.db2.gz QDQZWTPPUKVOEG-ONOMSOESSA-N 0 3 411.567 4.228 20 0 HIADHN CCOc1ccc([C@@H](N[C@H](C)CN2CCN(C)CC2)c2ccccc2Cl)cc1 ZINC000491024571 904374635 /nfs/dbraw/zinc/37/46/35/904374635.db2.gz UEFHSIQMLYSHPN-WZONZLPQSA-N 0 3 401.982 4.054 20 0 HIADHN CCCc1c(C(=O)N(CC)C[C@H]2CCN(Cc3ccccc3)C2)[nH]c(C)c1C(C)=O ZINC000491030586 904382386 /nfs/dbraw/zinc/38/23/86/904382386.db2.gz WWHNGWNJIXLUBI-NRFANRHFSA-N 0 3 409.574 4.462 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)N2CC(C)(C)[C@@H]2c2cccnc2)N(C)C)cc1 ZINC000491082970 904418594 /nfs/dbraw/zinc/41/85/94/904418594.db2.gz XBVPJEGUFMXGHA-VXKWHMMOSA-N 0 3 410.562 4.264 20 0 HIADHN COc1ccccc1NC(=O)c1ccc(NC(=O)[C@@H](C)N2CC[C@H](C3CC3)C2)cc1 ZINC000491218180 904487531 /nfs/dbraw/zinc/48/75/31/904487531.db2.gz ONDLQVKOGBASAP-APWZRJJASA-N 0 3 407.514 4.006 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)Nc3ncc(Cc4ccc(C(F)(F)F)cc4)s3)[C@H]2C1 ZINC000491304905 904525597 /nfs/dbraw/zinc/52/55/97/904525597.db2.gz LAESKIMAKNNYNL-PBHICJAKSA-N 0 3 424.492 4.311 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](NCCc2ccccn2)c2ccc(Cl)cc2)c1 ZINC000491306684 904527459 /nfs/dbraw/zinc/52/74/59/904527459.db2.gz OXUTWOFQANBNIR-NRFANRHFSA-N 0 3 400.931 4.060 20 0 HIADHN O=S1(=O)CC[C@H](CN[C@H](c2ccc(Cl)cc2)c2ccc(OC(F)F)cc2)C1 ZINC000491316819 904534823 /nfs/dbraw/zinc/53/48/23/904534823.db2.gz MTIJAXMOFVCLAF-FZKQIMNGSA-N 0 3 415.889 4.055 20 0 HIADHN Cc1ccc([C@@H](NC[C@H](c2ccccc2)N(C)C)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000491343597 904547920 /nfs/dbraw/zinc/54/79/20/904547920.db2.gz PKTPCFMSDIGBNK-JWQCQUIFSA-N 0 3 422.594 4.380 20 0 HIADHN CC(C)N(CCN[C@H](c1cccc(S(C)(=O)=O)c1)c1ccc(F)cc1F)C(C)C ZINC000491354775 904552723 /nfs/dbraw/zinc/55/27/23/904552723.db2.gz DAGFCWQJQNSABR-JOCHJYFZSA-N 0 3 424.557 4.166 20 0 HIADHN COc1ccc([C@H](CN[C@H](c2cnn(C)c2)c2cccc(F)c2)N2CCCCC2)cc1 ZINC000491370358 904561838 /nfs/dbraw/zinc/56/18/38/904561838.db2.gz ZSVPBJOARPUCBN-DQEYMECFSA-N 0 3 422.548 4.474 20 0 HIADHN Cc1ccc([C@@H](NCC(C)(C)N2CCCCC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000491370154 904562548 /nfs/dbraw/zinc/56/25/48/904562548.db2.gz YNPAJDMSUOITTI-HSZRJFAPSA-N 0 3 414.615 4.342 20 0 HIADHN CCc1ccc([C@H](NCCN2CCCCCC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000491395155 904575650 /nfs/dbraw/zinc/57/56/50/904575650.db2.gz INEFONPJVVTOPZ-DEOSSOPVSA-N 0 3 414.615 4.208 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)N2CCCC[C@H]2c2ccc(C(C)C)cc2)CC1 ZINC000491425103 904590303 /nfs/dbraw/zinc/59/03/03/904590303.db2.gz VWEVRVUONWJGFD-URXFXBBRSA-N 0 3 414.638 4.320 20 0 HIADHN O=C(Nc1ccc2oc(C3CC3)nc2c1)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000491445959 904600469 /nfs/dbraw/zinc/60/04/69/904600469.db2.gz SQUWYFHWVGFSTK-UHFFFAOYSA-N 0 3 405.498 4.162 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)N(CCN(C)C)Cc2cccc(C)c2)cc1 ZINC000491467975 904610538 /nfs/dbraw/zinc/61/05/38/904610538.db2.gz LTMFXEHLFFJTOY-IBGZPJMESA-N 0 3 410.562 4.119 20 0 HIADHN CN(C)[C@@H](CNC(=O)N1CCC[C@@H](c2nc3ccc(F)cc3o2)C1)c1ccccc1 ZINC000506170140 914832170 /nfs/dbraw/zinc/83/21/70/914832170.db2.gz IXGRHQSCOZCGSU-XLIONFOSSA-N 0 3 410.493 4.159 20 0 HIADHN COc1ccc([C@H](CNC(=O)NCc2ccc3[nH]c(C)cc3c2)N2CCCC2)cc1 ZINC000506172722 914832997 /nfs/dbraw/zinc/83/29/97/914832997.db2.gz FYJPNQPCWYGVIS-QHCPKHFHSA-N 0 3 406.530 4.121 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(S(=O)(=O)N(C)C)cc1)c1cc(Br)cs1 ZINC000491846015 904711123 /nfs/dbraw/zinc/71/11/23/904711123.db2.gz HNNJQZDFNIHUSH-VXGBXAGGSA-N 0 3 417.394 4.173 20 0 HIADHN CN1CCN(C)[C@@H](CN[C@@H](c2ccc(Cl)cc2)c2ccc(C(F)(F)F)cc2)C1 ZINC000492177090 904810097 /nfs/dbraw/zinc/81/00/97/904810097.db2.gz DNKXZSHBRIHEAC-VQTJNVASSA-N 0 3 411.899 4.284 20 0 HIADHN CC[C@H](C)[C@](C)(O)CN[C@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000492177783 904810645 /nfs/dbraw/zinc/81/06/45/904810645.db2.gz INCBPPZZTDLUMZ-IWMITWMQSA-N 0 3 409.979 4.220 20 0 HIADHN CCc1ccc([C@H](NC[C@@](C)(O)[C@@H](C)CC)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000492223268 904817959 /nfs/dbraw/zinc/81/79/59/904817959.db2.gz KPKHAVKBHBDWGT-PDIWNELESA-N 0 3 403.588 4.129 20 0 HIADHN CCc1ccc([C@H](NC[C@](C)(O)[C@@H](C)CC)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000492223269 904818071 /nfs/dbraw/zinc/81/80/71/904818071.db2.gz KPKHAVKBHBDWGT-RTFZILSDSA-N 0 3 403.588 4.129 20 0 HIADHN CC[C@H](C)[C@](C)(O)CN[C@@H](c1cccc(S(C)(=O)=O)c1)c1ccc(C)cc1C ZINC000492227161 904819731 /nfs/dbraw/zinc/81/97/31/904819731.db2.gz YFXNJOLCGLIVPR-OFAXGOBFSA-N 0 3 403.588 4.183 20 0 HIADHN CCc1ccc([C@H](CNC(=O)Nc2nc(C3CCOCC3)cs2)N(C)C)cc1 ZINC000492561841 904869506 /nfs/dbraw/zinc/86/95/06/904869506.db2.gz XDDWVCJXXZCSBU-IBGZPJMESA-N 0 3 402.564 4.024 20 0 HIADHN COc1ccc([C@@H](CN[C@H](C)c2ccccc2Br)N2CCOCC2)cc1 ZINC000492786035 904905318 /nfs/dbraw/zinc/90/53/18/904905318.db2.gz WWPKXUKWQABIFC-IIBYNOLFSA-N 0 3 419.363 4.182 20 0 HIADHN CCCCCOc1ccc(C(=O)CCC(=O)N2CCC[C@H]3CN(C)CC[C@@H]32)cc1 ZINC000492788303 904907550 /nfs/dbraw/zinc/90/75/50/904907550.db2.gz HZPLFBQMCFQSKZ-UNMCSNQZSA-N 0 3 400.563 4.161 20 0 HIADHN C[C@H](OC[C@H](O)CN1CCC2(CC1)OCCc1ccsc12)c1ccc(Cl)cc1 ZINC000492810755 904910247 /nfs/dbraw/zinc/91/02/47/904910247.db2.gz UMKZEYWOQBBUPW-OXJNMPFZSA-N 0 3 421.990 4.404 20 0 HIADHN COc1cccc([C@H](CNc2ccc(C(=O)N3CCc4ccccc43)cn2)N(C)C)c1 ZINC000492893979 904943219 /nfs/dbraw/zinc/94/32/19/904943219.db2.gz PTERDSZEEFFTPL-QHCPKHFHSA-N 0 3 416.525 4.008 20 0 HIADHN O=C(Nc1ccc(Cc2ccncc2)cc1)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000492968491 904971983 /nfs/dbraw/zinc/97/19/83/904971983.db2.gz CIRFDRRYFGUCHP-UHFFFAOYSA-N 0 3 415.537 4.129 20 0 HIADHN COC1CCC(CN[C@@H](c2cccc(S(C)(=O)=O)c2)c2ccc(F)c(F)c2)CC1 ZINC000493009978 904989514 /nfs/dbraw/zinc/98/95/14/904989514.db2.gz PFBIKYFOYONNFA-URWDPPFZSA-N 0 3 423.525 4.253 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](NCC2(CCO)CCCCC2)c2ccc(F)cc2)c1 ZINC000493038193 905000322 /nfs/dbraw/zinc/00/03/22/905000322.db2.gz UAEOCJNUGGFRHL-QFIPXVFZSA-N 0 3 419.562 4.241 20 0 HIADHN CO[C@H](CN[C@@H](c1cccc(S(C)(=O)=O)c1)c1ccc(C)cc1C)C(C)(C)C ZINC000493039469 905001597 /nfs/dbraw/zinc/00/15/97/905001597.db2.gz ZPXYYKXQHJBHPK-YADHBBJMSA-N 0 3 403.588 4.447 20 0 HIADHN CC(=O)N1CC[C@H](NCc2cc(Cl)c3c(c2)OCCCO3)c2ccccc2C1 ZINC000493156041 905035731 /nfs/dbraw/zinc/03/57/31/905035731.db2.gz WOGMVZZVBKNTGO-FQEVSTJZSA-N 0 3 400.906 4.084 20 0 HIADHN C[C@]1(CN[C@H](c2ccc(Cl)cc2)c2cccc(S(C)(=O)=O)c2)CCCC[C@@H]1O ZINC000493180063 905043020 /nfs/dbraw/zinc/04/30/20/905043020.db2.gz XQJXJPOVGMATMV-BHDDXSALSA-N 0 3 421.990 4.364 20 0 HIADHN CCc1cnc(CCN[C@@H](c2ccc(C)cc2)c2cccc(S(C)(=O)=O)c2)s1 ZINC000493202489 905047167 /nfs/dbraw/zinc/04/71/67/905047167.db2.gz GQYCOSKAZZLKPZ-QFIPXVFZSA-N 0 3 414.596 4.339 20 0 HIADHN COc1cc2[nH]c(CCCN[C@H](c3cnn(C)c3)c3cccc(F)c3)cc2c(OC)c1 ZINC000493235403 905060349 /nfs/dbraw/zinc/06/03/49/905060349.db2.gz XWRQMMIAXVXCBN-DEOSSOPVSA-N 0 3 422.504 4.370 20 0 HIADHN CCOc1ccc([C@@H](NC2CCN(C(=O)COC)CC2)c2ccccc2Cl)cc1 ZINC000493250890 905067651 /nfs/dbraw/zinc/06/76/51/905067651.db2.gz SRQXEKQGKZCEIN-HSZRJFAPSA-N 0 3 416.949 4.055 20 0 HIADHN Cc1ccccc1-c1cc(C(=O)N2CC[C@H]3CCN(C)C[C@H]32)c2cnn(C(C)C)c2n1 ZINC000493469433 905133485 /nfs/dbraw/zinc/13/34/85/905133485.db2.gz ZYRXAPBOULCWJH-WZONZLPQSA-N 0 3 417.557 4.154 20 0 HIADHN Cc1cc(-c2cc(C(=O)N3CC[C@@H]4CCN(C)C[C@@H]43)c3cnn(C(C)C)c3n2)c(C)o1 ZINC000493481803 905138202 /nfs/dbraw/zinc/13/82/02/905138202.db2.gz QRDYSKMUSXUDFQ-JTSKRJEESA-N 0 3 421.545 4.055 20 0 HIADHN COc1ccc([C@@H](CNC(=O)c2c[nH]cc2-c2ccccc2F)N2CCCC2)cc1 ZINC000493634269 905177931 /nfs/dbraw/zinc/17/79/31/905177931.db2.gz JBEXLZJYBDWGDC-HSZRJFAPSA-N 0 3 407.489 4.396 20 0 HIADHN O=C1CCCN1C[C@@H](N[C@@H]1CCc2ccccc2OC1)c1cccc(C(F)(F)F)c1 ZINC000493821978 905227947 /nfs/dbraw/zinc/22/79/47/905227947.db2.gz PPWXJYZYLFBQEB-WOJBJXKFSA-N 0 3 418.459 4.352 20 0 HIADHN CC(C)c1ccc(-c2noc(CCC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)n2)cc1 ZINC000493910886 905262122 /nfs/dbraw/zinc/26/21/22/905262122.db2.gz KAGGMGNCHVJHPX-JOCHJYFZSA-N 0 3 418.541 4.183 20 0 HIADHN COc1ccccc1COc1cccc(NC(=O)N2CC[C@H]3CCN(C)C[C@H]32)c1C ZINC000493920071 905272211 /nfs/dbraw/zinc/27/22/11/905272211.db2.gz MXIBVVRCAYDKML-WIYYLYMNSA-N 0 3 409.530 4.141 20 0 HIADHN O=C(Nc1cccnc1)N(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000493926670 905280699 /nfs/dbraw/zinc/28/06/99/905280699.db2.gz PBACOFTTXQRRSQ-HSZRJFAPSA-N 0 3 401.514 4.175 20 0 HIADHN COCCSc1ccc([C@H](C)NC(=O)N[C@@H](CN(C)C)c2ccc(F)cc2)cc1 ZINC000493939522 905291836 /nfs/dbraw/zinc/29/18/36/905291836.db2.gz FJKSJCKDRAWMGX-KKSFZXQISA-N 0 3 419.566 4.227 20 0 HIADHN CCOCc1ccc(CNC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)cc1 ZINC000493950937 905300387 /nfs/dbraw/zinc/30/03/87/905300387.db2.gz VAANTJUCPKFBAD-JOCHJYFZSA-N 0 3 420.475 4.294 20 0 HIADHN Fc1ccc([C@@H]2OCC[C@@H]2NCc2nc3ccc(Br)cc3[nH]2)cc1F ZINC000493952451 905302578 /nfs/dbraw/zinc/30/25/78/905302578.db2.gz KVOHSPAJQPLKRT-YJBOKZPZSA-N 0 3 408.246 4.223 20 0 HIADHN C[C@@H]1[C@H](NC(=O)c2cccc(CSc3nccn3C)c2)CCN1Cc1ccccc1 ZINC000493997763 905340111 /nfs/dbraw/zinc/34/01/11/905340111.db2.gz BCVLNVPQRQHFJB-XMSQKQJNSA-N 0 3 420.582 4.105 20 0 HIADHN C[C@H]1[C@@H](NC(=O)CCCc2ncc(-c3ccccc3)o2)CCN1Cc1ccccc1 ZINC000493999416 905341023 /nfs/dbraw/zinc/34/10/23/905341023.db2.gz IVHOOMRQDRZODT-UGKGYDQZSA-N 0 3 403.526 4.444 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)c2ccc(OCc3ccccn3)cc2)CCN1Cc1ccccc1 ZINC000493999508 905341297 /nfs/dbraw/zinc/34/12/97/905341297.db2.gz JGLCWIQNPFHKGP-DVECYGJZSA-N 0 3 401.510 4.053 20 0 HIADHN Cc1cc(C(=O)N[C@H]2CCN(Cc3ccccc3)[C@@H]2C)ccc1NC(=O)CC(C)C ZINC000493998518 905341842 /nfs/dbraw/zinc/34/18/42/905341842.db2.gz DODVWYFPMCRMEV-XXBNENTESA-N 0 3 407.558 4.372 20 0 HIADHN Cc1nc(COc2ccccc2C(=O)N[C@@H]2CCN(Cc3ccccc3)[C@@H]2C)cs1 ZINC000494005601 905346669 /nfs/dbraw/zinc/34/66/69/905346669.db2.gz AUEQRMBMEBQADZ-VGOFRKELSA-N 0 3 421.566 4.423 20 0 HIADHN C[C@H]1[C@H](NC(=O)c2ccc(-c3noc(C(F)F)n3)cc2)CCN1Cc1ccccc1 ZINC000494007167 905347903 /nfs/dbraw/zinc/34/79/03/905347903.db2.gz OSZPKBULPWFYAS-KBXCAEBGSA-N 0 3 412.440 4.067 20 0 HIADHN C[C@@H]1[C@H](NC(=O)c2cn(C)nc2-c2ccccc2Cl)CCN1Cc1ccccc1 ZINC000494035761 905373472 /nfs/dbraw/zinc/37/34/72/905373472.db2.gz BCVZSOUELUSTTB-IIBYNOLFSA-N 0 3 408.933 4.133 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](NCCC[C@@H]2CCCC[C@@H]2O)c2ccc(F)cc2)c1 ZINC000494046366 905386530 /nfs/dbraw/zinc/38/65/30/905386530.db2.gz DBCVRCCRDKEHRX-PDIWNELESA-N 0 3 419.562 4.240 20 0 HIADHN O[C@H](CN[C@@H](c1cccc(F)c1)c1cccc(Br)c1)C1CCOCC1 ZINC000494047024 905387148 /nfs/dbraw/zinc/38/71/48/905387148.db2.gz FZIBKPZKJNTSKY-WOJBJXKFSA-N 0 3 408.311 4.055 20 0 HIADHN CCc1noc(-c2ccc(CCN[C@@H](c3cnn(C)c3)c3cccc(F)c3)cc2)n1 ZINC000494056754 905395776 /nfs/dbraw/zinc/39/57/76/905395776.db2.gz RKKRKLWLKONKOY-JOCHJYFZSA-N 0 3 405.477 4.093 20 0 HIADHN CC(C)n1ncc2c1nc(C1CC1)cc2C(=O)N[C@@H]1CCN(Cc2ccccc2)[C@H]1C ZINC000494070611 905409477 /nfs/dbraw/zinc/40/94/77/905409477.db2.gz XYTNCPQJFNPJCI-HTAPYJJXSA-N 0 3 417.557 4.282 20 0 HIADHN CCN1CCN(c2ccc(CNCc3ccc(-c4ccccc4)cc3OC)cn2)CC1 ZINC000512422143 921149907 /nfs/dbraw/zinc/14/99/07/921149907.db2.gz PFUFHJRZGOIAEZ-UHFFFAOYSA-N 0 3 416.569 4.189 20 0 HIADHN CCCn1ccc2ccc(NC(=O)N[C@H]3CCN(Cc4ccccc4)C[C@H]3CO)cc21 ZINC000494152230 905490224 /nfs/dbraw/zinc/49/02/24/905490224.db2.gz IITWDGXHDRIJLU-GMAHTHKFSA-N 0 3 420.557 4.056 20 0 HIADHN CSc1cnn(-c2ccccc2)c1NC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000494173588 905509696 /nfs/dbraw/zinc/50/96/96/905509696.db2.gz SJYCBPFMXDAKMZ-FQEVSTJZSA-N 0 3 421.570 4.332 20 0 HIADHN CCCC(=O)NC[C@H]1CCCN(Cc2cccc(NC(=O)c3ccc(OC)cc3)c2)C1 ZINC000512434643 921158953 /nfs/dbraw/zinc/15/89/53/921158953.db2.gz ZNOOVBCUPVONNW-HXUWFJFHSA-N 0 3 423.557 4.076 20 0 HIADHN O=C(Nc1cccc(OC2CCCC2)c1)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1CO ZINC000494263116 905588193 /nfs/dbraw/zinc/58/81/93/905588193.db2.gz VLYIASMBEQYUTC-HYBUGGRVSA-N 0 3 423.557 4.013 20 0 HIADHN CN1C(=O)C[C@@H](NCc2ccc(Cl)c3cccnc23)[C@H]1c1ccc(F)c(F)c1 ZINC000494277653 905601849 /nfs/dbraw/zinc/60/18/49/905601849.db2.gz SSNFZTSYOLNRKW-WIYYLYMNSA-N 0 3 401.844 4.228 20 0 HIADHN CN1C(=O)C[C@@H](NCc2ccc(Cl)c3cccnc23)[C@@H]1c1ccc(F)c(F)c1 ZINC000494277651 905602230 /nfs/dbraw/zinc/60/22/30/905602230.db2.gz SSNFZTSYOLNRKW-NQIIRXRSSA-N 0 3 401.844 4.228 20 0 HIADHN O=C(CCN1CCC[C@H](CNC(=O)Nc2cccc(F)c2)C1)c1ccc(F)cc1 ZINC000512438338 921161584 /nfs/dbraw/zinc/16/15/84/921161584.db2.gz CVWHTFLNENQBJH-MRXNPFEDSA-N 0 3 401.457 4.071 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1nc(C2CCOCC2)cs1)c1ccsc1 ZINC000494301601 905621227 /nfs/dbraw/zinc/62/12/27/905621227.db2.gz QCBJTPZDJFEWFE-KRWDZBQOSA-N 0 3 408.593 4.303 20 0 HIADHN Cc1nc2ccc(CNCc3ccc(S(=O)(=O)N4CCCCC4)cc3)cc2s1 ZINC000494305225 905622599 /nfs/dbraw/zinc/62/25/99/905622599.db2.gz ANZBUFKFSNJULS-UHFFFAOYSA-N 0 3 415.584 4.069 20 0 HIADHN Cc1ccnc(-c2nnc([C@H](C)[NH2+][C@@H]3CCc4cc(Br)ccc4C3)[n-]2)c1 ZINC000494363716 905664178 /nfs/dbraw/zinc/66/41/78/905664178.db2.gz FVULWWFCGJQVOU-SUMWQHHRSA-N 0 3 412.335 4.146 20 0 HIADHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)Nc1nc2c(cccc2Br)s1 ZINC000494387326 905682611 /nfs/dbraw/zinc/68/26/11/905682611.db2.gz UBUPQSXHYYKCFB-NEPJUHHUSA-N 0 3 409.353 4.149 20 0 HIADHN Cc1ccc(C(C)(C)CNC(=O)N(C)C2CCN(CCc3ccccn3)CC2)c(C)c1 ZINC000494443790 905729462 /nfs/dbraw/zinc/72/94/62/905729462.db2.gz CFXCADPOLVPPHP-UHFFFAOYSA-N 0 3 422.617 4.325 20 0 HIADHN C[C@H](N[C@@H]1CCO[C@H]1c1ccc(Cl)cc1)C(=O)N1CCSc2ccccc21 ZINC000494476178 905757291 /nfs/dbraw/zinc/75/72/91/905757291.db2.gz UYLSMIKOYBBLJB-NQYLQCIDSA-N 0 3 402.947 4.287 20 0 HIADHN Cc1ccc2nc(-c3ccc(NC(=O)CN[C@H]4CCO[C@H]4C4CC4)cc3)sc2c1 ZINC000494486425 905771127 /nfs/dbraw/zinc/77/11/27/905771127.db2.gz UKOSKKQXLKDANA-UGKGYDQZSA-N 0 3 407.539 4.367 20 0 HIADHN C/C(=C\c1ccccc1)CN(C)C(=O)NCCCCN1CCN(c2ccccc2)CC1 ZINC000494521509 905811283 /nfs/dbraw/zinc/81/12/83/905811283.db2.gz DIFSRAGUIBPKAX-XTQSDGFTSA-N 0 3 420.601 4.334 20 0 HIADHN CO[C@H](c1ccccc1)[C@@H](C)NCc1nnc(-c2ccc(Br)cc2)[nH]1 ZINC000494621177 905867066 /nfs/dbraw/zinc/86/70/66/905867066.db2.gz NQWZHSVZUFTFQR-ACJLOTCBSA-N 0 3 401.308 4.100 20 0 HIADHN C[C@H]1CN(C2CCOCC2)CCN1C(=O)N[C@H](CC(C)(C)C)c1ccc(F)cc1 ZINC000494665841 905890305 /nfs/dbraw/zinc/89/03/05/905890305.db2.gz FEMUWKRZWOBJOW-LAUBAEHRSA-N 0 3 405.558 4.198 20 0 HIADHN COc1ccccc1SC[C@@H](C)CNC(=O)N[C@@H](CN(C)C)c1ccc(F)cc1 ZINC000494695573 905902885 /nfs/dbraw/zinc/90/28/85/905902885.db2.gz DPEDIPTVSRZCBH-LPHOPBHVSA-N 0 3 419.566 4.165 20 0 HIADHN CCCn1nc(C)c(CN2CCC[C@@H](CNC(=O)Nc3cccc(F)c3)C2)c1C ZINC000512479395 921189546 /nfs/dbraw/zinc/18/95/46/921189546.db2.gz GLAKJZATPQRXIU-SFHVURJKSA-N 0 3 401.530 4.083 20 0 HIADHN COC[C@H](N[C@H]1CCc2nnc(-c3ccc(F)cc3)n2C1)c1ccc(Cl)cc1 ZINC000494759633 905956901 /nfs/dbraw/zinc/95/69/01/905956901.db2.gz WMMJRRYWHBQINX-OALUTQOASA-N 0 3 400.885 4.030 20 0 HIADHN O=C(NC[C@H](OCc1ccccc1)c1ccc(Cl)cc1)N1CCN2CCC1CC2 ZINC000494775754 905973275 /nfs/dbraw/zinc/97/32/75/905973275.db2.gz UNBWOWQYEITMHP-QFIPXVFZSA-N 0 3 413.949 4.088 20 0 HIADHN Cc1ccc(S(=O)(=O)C[C@@H](C)NC2CC(c3ccc(Br)cc3)C2)cc1 ZINC000494789014 905989848 /nfs/dbraw/zinc/98/98/48/905989848.db2.gz XEQFCUQCEIBZSE-LSJNQWAISA-N 0 3 422.388 4.456 20 0 HIADHN CCOc1cc(CNCc2ccc(C3CCC3)cc2)ccc1O[C@H](C)C(=O)N(C)C ZINC000494841765 906031027 /nfs/dbraw/zinc/03/10/27/906031027.db2.gz GYGFWDWQPTVHIR-GOSISDBHSA-N 0 3 410.558 4.498 20 0 HIADHN CCN1CCC[C@@H](CN(C)C(=O)N[C@@H]2CCCc3ccc(C)cc32)[C@@H]1c1cnn(C)c1 ZINC000494854529 906037843 /nfs/dbraw/zinc/03/78/43/906037843.db2.gz VXOYPMXWSDBOEZ-TUACAJSNSA-N 0 3 423.605 4.221 20 0 HIADHN C[C@@H]1CN(c2ccc(CN[C@H](C[C@@H]3CCOC3)c3ccc(F)cc3)cn2)C[C@H](C)O1 ZINC000494917413 906090685 /nfs/dbraw/zinc/09/06/85/906090685.db2.gz AYWHCEHPCYEPKJ-QPXQOZNCSA-N 0 3 413.537 4.092 20 0 HIADHN CC1(C)C[C@@H](N[C@H](c2cccc(S(C)(=O)=O)c2)c2ccc(F)c(F)c2)CCO1 ZINC000494949284 906121936 /nfs/dbraw/zinc/12/19/36/906121936.db2.gz KFBSRRQWHOGNHN-OXJNMPFZSA-N 0 3 409.498 4.005 20 0 HIADHN Cc1ccc([C@H](NCC2([C@H](O)C(C)C)CC2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000494969429 906137886 /nfs/dbraw/zinc/13/78/86/906137886.db2.gz MMSXRFFFGAPHBX-DHIUTWEWSA-N 0 3 415.599 4.183 20 0 HIADHN Cc1ccc([C@H](NCC2([C@@H](O)C(C)C)CC2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000494969433 906138201 /nfs/dbraw/zinc/13/82/01/906138201.db2.gz MMSXRFFFGAPHBX-PKTZIBPZSA-N 0 3 415.599 4.183 20 0 HIADHN CN(C)[C@@H](CNC(=O)N(C)Cc1ccc(Br)c(F)c1)c1ccccc1 ZINC000495039247 906196495 /nfs/dbraw/zinc/19/64/95/906196495.db2.gz PQPYRMWIZFQAHW-SFHVURJKSA-N 0 3 408.315 4.033 20 0 HIADHN COc1cc(CN[C@H]2CCc3ccc(C(C)C)cc32)cc(Cl)c1OCC(N)=O ZINC000495156449 906274454 /nfs/dbraw/zinc/27/44/54/906274454.db2.gz HVQZDRNNKMWLNJ-IBGZPJMESA-N 0 3 402.922 4.113 20 0 HIADHN CCCNC(=O)[C@H]1CCCN(Cc2ccc(OCc3cccs3)c(OC)c2)C1 ZINC000512552287 921230966 /nfs/dbraw/zinc/23/09/66/921230966.db2.gz LRMLFQLCKGAPNJ-SFHVURJKSA-N 0 3 402.560 4.074 20 0 HIADHN CCC[C@H](C)NC(=O)[C@@H]1CCCN(Cc2cn(C)nc2-c2ccccc2Cl)C1 ZINC000512557295 921235003 /nfs/dbraw/zinc/23/50/03/921235003.db2.gz OTVVQMROEUAFHT-DLBZAZTESA-N 0 3 402.970 4.257 20 0 HIADHN CCC[C@H](C)NC(=O)[C@@H]1CCCN(Cc2ccc(OCC(F)(F)F)c(OC)c2)C1 ZINC000512561593 921237894 /nfs/dbraw/zinc/23/78/94/921237894.db2.gz LXXFHCVCXQZYIF-DOTOQJQBSA-N 0 3 416.484 4.153 20 0 HIADHN Cc1ccc2nc(-c3ccc(NC(=O)[C@@H](C)N[C@@H](C)Cn4cccn4)cc3)sc2c1 ZINC000495470399 906470689 /nfs/dbraw/zinc/47/06/89/906470689.db2.gz NTOAFCPJMYQKNH-DLBZAZTESA-N 0 3 419.554 4.474 20 0 HIADHN CCCNC(=O)[C@@H]1CCCN(Cc2cnc(-c3ccc(Br)cc3)s2)C1 ZINC000512565555 921240569 /nfs/dbraw/zinc/24/05/69/921240569.db2.gz QWLJRWGPXYXREI-OAHLLOKOSA-N 0 3 422.392 4.311 20 0 HIADHN CS[C@H]1CN(C(=O)c2ccc(-c3nc4ccccc4s3)s2)C[C@@H]1N(C)C ZINC000495608657 906513372 /nfs/dbraw/zinc/51/33/72/906513372.db2.gz UQQKJMZPCXLGEI-GUYCJALGSA-N 0 3 403.598 4.142 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)c2sc3cc(Cl)ccc3c2Cl)CC1 ZINC000495653969 906519669 /nfs/dbraw/zinc/51/96/69/906519669.db2.gz JUNYVFHWTHTGKH-CYBMUJFWSA-N 0 3 414.402 4.212 20 0 HIADHN CCS(=O)(=O)c1ccc(N2CCC(N[C@H](C)c3cc(F)ccc3F)CC2)cc1 ZINC000495682496 906524051 /nfs/dbraw/zinc/52/40/51/906524051.db2.gz ISHORISVNWDYMR-OAHLLOKOSA-N 0 3 408.514 4.078 20 0 HIADHN CCCN(CCN(C)C)C(=O)c1csc(-c2ccc(Br)s2)n1 ZINC000496244412 906635968 /nfs/dbraw/zinc/63/59/68/906635968.db2.gz LOJXGGCKFNHWEK-UHFFFAOYSA-N 0 3 402.383 4.048 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)CCC(=O)c1cc(C)ccc1C ZINC000496273199 906644238 /nfs/dbraw/zinc/64/42/38/906644238.db2.gz RHAAUXDNKQLYJR-QFIPXVFZSA-N 0 3 407.558 4.174 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)CCc1ccccc1Br ZINC000496339103 906660806 /nfs/dbraw/zinc/66/08/06/906660806.db2.gz JJDIDLOTZQICFM-UHFFFAOYSA-N 0 3 407.327 4.111 20 0 HIADHN Cc1cc(Cl)ccc1Cc1cnc(NC(=O)N[C@@H](C)C2=CCN(C)CC2)s1 ZINC000496450485 906686181 /nfs/dbraw/zinc/68/61/81/906686181.db2.gz SXIHKSHQTHLGJN-AWEZNQCLSA-N 0 3 404.967 4.468 20 0 HIADHN CCN(CC)[C@H](C(=O)N[C@@H](C)c1n[nH]c(C(C)C)n1)c1cccc(C(F)(F)F)c1 ZINC000496552988 906709346 /nfs/dbraw/zinc/70/93/46/906709346.db2.gz LNCUKXAXZOYGGD-BBRMVZONSA-N 0 3 411.472 4.207 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)N[C@H]2CCOc3ccc(F)cc32)N(C)C)cc1 ZINC000496689554 906736508 /nfs/dbraw/zinc/73/65/08/906736508.db2.gz LZIIJXLAZLLTRT-LEWJYISDSA-N 0 3 415.509 4.039 20 0 HIADHN CN(C(=O)Nc1cnn(C)c1-c1ccccc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000496802711 906758755 /nfs/dbraw/zinc/75/87/55/906758755.db2.gz BNZQANSHCMSPRC-NRFANRHFSA-N 0 3 403.530 4.215 20 0 HIADHN CO[C@H](c1ccccc1Cl)[C@@H](C)NCc1ccccc1OCC(=O)N1CCCC1 ZINC000497154219 906812948 /nfs/dbraw/zinc/81/29/48/906812948.db2.gz ZVWMITAIHZJTJI-HXOBKFHXSA-N 0 3 416.949 4.207 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)N[C@@H](c3ccc(Br)cc3)C3CCC3)[C@H]2C1 ZINC000497385969 906872080 /nfs/dbraw/zinc/87/20/80/906872080.db2.gz ILZBFPIYZLHKKZ-MDASCCDHSA-N 0 3 406.368 4.026 20 0 HIADHN CN1C[C@H](NC(=O)c2ccc(NC(=O)Nc3ccccc3)cc2)[C@H](c2ccccc2)C1 ZINC000497388563 906873879 /nfs/dbraw/zinc/87/38/79/906873879.db2.gz UNBHLFMYOSHWAW-GOTSBHOMSA-N 0 3 414.509 4.158 20 0 HIADHN CN1C[C@H](NC(=O)Cc2csc(-c3ccc(Cl)s3)n2)[C@H](c2ccccc2)C1 ZINC000497413276 906889349 /nfs/dbraw/zinc/88/93/49/906889349.db2.gz AQJIGMNNJGECKN-HOTGVXAUSA-N 0 3 417.987 4.282 20 0 HIADHN CCC(=O)c1ccc(OCCCCC(=O)N[C@H]2CN(C)C[C@H]2c2ccccc2)cc1 ZINC000497435337 906908840 /nfs/dbraw/zinc/90/88/40/906908840.db2.gz OJWAMVGYNXISMS-GOTSBHOMSA-N 0 3 408.542 4.042 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)NCc3ccc(OC(C)(C)C)cc3C(F)(F)F)[C@@H]2C1 ZINC000497509626 906998097 /nfs/dbraw/zinc/99/80/97/906998097.db2.gz VDAQKJMBXFBYNR-RDTXWAMCSA-N 0 3 413.484 4.118 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)NCc3csc(-c4ccc(C(F)(F)F)cc4)n3)[C@@H]2C1 ZINC000497511072 907001842 /nfs/dbraw/zinc/00/18/42/907001842.db2.gz WKLYUOFUIIEYIY-CXAGYDPISA-N 0 3 424.492 4.065 20 0 HIADHN NC(=O)CC[C@H]1CCCN(Cc2cnc(-c3ccc(Br)cc3)s2)C1 ZINC000512692632 921289162 /nfs/dbraw/zinc/28/91/62/921289162.db2.gz GNNFLNWQSRCEOU-CYBMUJFWSA-N 0 3 408.365 4.050 20 0 HIADHN CC(C)[C@@H](c1ccccc1)N(C)C(=O)NCCCN1CCN(C)C[C@@H]1c1ccccc1 ZINC000497604670 907083130 /nfs/dbraw/zinc/08/31/30/907083130.db2.gz SUXTVSNKFAITSJ-RPBOFIJWSA-N 0 3 422.617 4.404 20 0 HIADHN C[C@@H](NC(=O)N[C@@H](CN1CCc2ccccc2C1)C(C)(C)C)c1c(F)cncc1F ZINC000497607348 907087346 /nfs/dbraw/zinc/08/73/46/907087346.db2.gz ACXSYMPGDNRBQH-QRWLVFNGSA-N 0 3 416.516 4.193 20 0 HIADHN C[C@H]1[C@@H](NC(=O)NCc2csc(-c3ccccc3)n2)CCN1Cc1ccccc1 ZINC000497615984 907092315 /nfs/dbraw/zinc/09/23/15/907092315.db2.gz AZWDOAMBAPWSBR-UWJYYQICSA-N 0 3 406.555 4.272 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)N[C@H]3CCCc4nc(-c5ccc(F)cc5)sc43)[C@H]2C1 ZINC000497645045 907131862 /nfs/dbraw/zinc/13/18/62/907131862.db2.gz YJQAZBFJFQTDSV-CCKFTAQKSA-N 0 3 414.550 4.062 20 0 HIADHN C[C@@H](Sc1nnnn1CCN(C)C)c1ncc(-c2ccc(Cl)cc2Cl)o1 ZINC000512742218 921300163 /nfs/dbraw/zinc/30/01/63/921300163.db2.gz JHLARYIYUNSASV-SNVBAGLBSA-N 0 3 413.334 4.050 20 0 HIADHN CCc1nc(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)nn1-c1ccccc1Cl ZINC000497696070 907201798 /nfs/dbraw/zinc/20/17/98/907201798.db2.gz JXOULNVBHCXGCC-FQEVSTJZSA-N 0 3 423.948 4.050 20 0 HIADHN COc1cccc([C@H](CNC(=O)Cc2cc(Cl)ccc2Cl)N2CCCC2)c1 ZINC000497703008 907208048 /nfs/dbraw/zinc/20/80/48/907208048.db2.gz WJDJXOVSWJGZAM-FQEVSTJZSA-N 0 3 407.341 4.498 20 0 HIADHN COc1cccc([C@H](CNC(=O)C[C@H]2CCCc3cc(OC)ccc32)N2CCCC2)c1 ZINC000497707549 907212784 /nfs/dbraw/zinc/21/27/84/907212784.db2.gz YUOCAQRGGJHAGI-NLFFAJNJSA-N 0 3 422.569 4.467 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)c1ccnc(OCc2ccccc2)c1 ZINC000497728669 907227338 /nfs/dbraw/zinc/22/73/38/907227338.db2.gz XYPFKHNWNZDRIU-QHCPKHFHSA-N 0 3 401.510 4.228 20 0 HIADHN Cc1ccc(C)c(CNCc2ccnc(N3CCN(c4ccc(F)cc4)CC3)c2)c1 ZINC000512810005 921316859 /nfs/dbraw/zinc/31/68/59/921316859.db2.gz OVUQSALGFZHKDS-UHFFFAOYSA-N 0 3 404.533 4.454 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)Cc1c[nH]c2cc(F)ccc12 ZINC000497902788 907375828 /nfs/dbraw/zinc/37/58/28/907375828.db2.gz ZMMZHNLISXPAIN-UHFFFAOYSA-N 0 3 421.438 4.459 20 0 HIADHN CN(C)Cc1cccc(NC(=O)C(=O)NCC(C)(C)c2ccc(Cl)c(Cl)c2)c1 ZINC000497928007 907394328 /nfs/dbraw/zinc/39/43/28/907394328.db2.gz RKJFFOQSSNEKQO-UHFFFAOYSA-N 0 3 422.356 4.088 20 0 HIADHN Cc1cc(CNCc2ccnc(N3CCN(c4ccc(F)cc4)CC3)c2)cc(C)c1O ZINC000512816818 921321509 /nfs/dbraw/zinc/32/15/09/921321509.db2.gz SCNJAFIMIQSWRE-UHFFFAOYSA-N 0 3 420.532 4.160 20 0 HIADHN CC(C)(C)c1nc(CCNC(=O)N[C@H](CN2CCCC2)c2ccccc2)cs1 ZINC000497951391 907421902 /nfs/dbraw/zinc/42/19/02/907421902.db2.gz PYPSHVQEKUAEJK-LJQANCHMSA-N 0 3 400.592 4.119 20 0 HIADHN Cc1cccc([C@H](NC(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)c2ccccn2)c1 ZINC000497958577 907430230 /nfs/dbraw/zinc/43/02/30/907430230.db2.gz PXNZVRVEWKNZSX-HJOGWXRNSA-N 0 3 400.526 4.224 20 0 HIADHN C[C@@H](NC(=O)Nc1ccc(Cl)c(C(=O)Nc2ccccc2)c1)C1=CCN(C)CC1 ZINC000512820536 921325655 /nfs/dbraw/zinc/32/56/55/921325655.db2.gz MHIZENSIGUDKPM-OAHLLOKOSA-N 0 3 412.921 4.364 20 0 HIADHN CCN(C(=O)c1cncc(Br)c1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000498007359 907494253 /nfs/dbraw/zinc/49/42/53/907494253.db2.gz AKFMOBSRUFOSQW-KXBFYZLASA-N 0 3 402.336 4.142 20 0 HIADHN CCN(C(=O)c1cccc(CN2CCCC2=O)c1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000498021273 907518430 /nfs/dbraw/zinc/51/84/30/907518430.db2.gz CLWFYANBVLUHMX-RDPSFJRHSA-N 0 3 419.569 4.107 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)N2CCC[C@H](C(F)(F)F)C2)N(C)C)cc1 ZINC000512827452 921331735 /nfs/dbraw/zinc/33/17/35/921331735.db2.gz MRTGSNJOADQBPJ-FUHWJXTLSA-N 0 3 401.473 4.060 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)N(C)Cc2cccc3[nH]ccc32)N(C)C)cc1 ZINC000512828103 921333077 /nfs/dbraw/zinc/33/30/77/921333077.db2.gz PFKOIFJWUFCFDC-HSZRJFAPSA-N 0 3 408.546 4.399 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)[C@H]1C[C@H]1c1ccccc1C(F)(F)F ZINC000498054854 907565142 /nfs/dbraw/zinc/56/51/42/907565142.db2.gz NHIORKGCPNQFDK-PMACEKPBSA-N 0 3 402.460 4.374 20 0 HIADHN C[C@H](SCC(=O)N(CCN(C)C)Cc1ccccc1F)c1nc2ccccc2[nH]1 ZINC000498111534 907620457 /nfs/dbraw/zinc/62/04/57/907620457.db2.gz JXYWFUVVMVUTCH-INIZCTEOSA-N 0 3 414.550 4.087 20 0 HIADHN CN1CCN(CCCNC(=O)c2cc(Cl)ccc2Cl)[C@H](c2ccccc2)C1 ZINC000498119030 907631162 /nfs/dbraw/zinc/63/11/62/907631162.db2.gz BZZSYUJVGLJYQF-FQEVSTJZSA-N 0 3 406.357 4.102 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)c1ccnc2ccccc21 ZINC000498126382 907643154 /nfs/dbraw/zinc/64/31/54/907643154.db2.gz OBCWILTUMOHTHR-UHFFFAOYSA-N 0 3 401.432 4.458 20 0 HIADHN CCCCc1ccc([C@@H](NC(=O)N(C)CCCN2CCN(C)CC2)C(C)C)cc1 ZINC000498126614 907643301 /nfs/dbraw/zinc/64/33/01/907643301.db2.gz KZBWJXHUQZLQNU-QHCPKHFHSA-N 0 3 402.627 4.005 20 0 HIADHN CC[C@@H](C)c1ccc([C@H](NC(=O)N(C)CCCN2CCN(C)CC2)C(C)C)cc1 ZINC000498128228 907644442 /nfs/dbraw/zinc/64/44/42/907644442.db2.gz TVQWHKYCEHLVSY-NFBKMPQASA-N 0 3 402.627 4.176 20 0 HIADHN COc1ncccc1C(=O)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000498127157 907644553 /nfs/dbraw/zinc/64/45/53/907644553.db2.gz NVGBQWKBJDALSN-UHFFFAOYSA-N 0 3 408.329 4.135 20 0 HIADHN CCCOc1ccc([C@H](C)NC(=O)N2CC[C@H]3CCN(C)C[C@H]32)cc1OCCC ZINC000498129147 907646533 /nfs/dbraw/zinc/64/65/33/907646533.db2.gz YLWUTDSPFRONAC-NLWGTHIKSA-N 0 3 403.567 4.061 20 0 HIADHN COCCc1ccc(Oc2ccc(NC(=O)N[C@@H](C)C3=CCN(C)CC3)cc2)cc1 ZINC000512843757 921347574 /nfs/dbraw/zinc/34/75/74/921347574.db2.gz FIIKTSXQJBVNEB-SFHVURJKSA-N 0 3 409.530 4.440 20 0 HIADHN Cc1cccc2[nH]c(CNC(=O)NC[C@H](c3cccs3)N3CCC(C)CC3)nc21 ZINC000498255317 907792548 /nfs/dbraw/zinc/79/25/48/907792548.db2.gz VTZLNMGJTUAJMI-GOSISDBHSA-N 0 3 411.575 4.205 20 0 HIADHN CSc1cccc([C@H](NC(=O)N2CCN3CCC2CC3)c2cc(F)ccc2F)c1 ZINC000498268299 907805448 /nfs/dbraw/zinc/80/54/48/907805448.db2.gz TTYBZPGZGOYZQU-NRFANRHFSA-N 0 3 417.525 4.266 20 0 HIADHN CSc1cccc([C@@H](NC(=O)N2CCN3CCC2CC3)c2ccc(F)c(F)c2)c1 ZINC000498286064 907818829 /nfs/dbraw/zinc/81/88/29/907818829.db2.gz PVPUERHXPKZDQS-OAQYLSRUSA-N 0 3 417.525 4.266 20 0 HIADHN C[C@H](SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)NCCN1CCC(C)CC1 ZINC000498352196 907852818 /nfs/dbraw/zinc/85/28/18/907852818.db2.gz GCBQYPYXTKIZBS-INIZCTEOSA-N 0 3 421.994 4.465 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1ccc(Cn2nc(C)cc2C)cc1)c1ccsc1 ZINC000498358906 907856335 /nfs/dbraw/zinc/85/63/35/907856335.db2.gz JXLJTAPLPQZYKH-JOCHJYFZSA-N 0 3 410.587 4.423 20 0 HIADHN COc1cc(CNCC2=CCCOC2)cc(Br)c1OCc1ccccc1 ZINC000498374131 907864417 /nfs/dbraw/zinc/86/44/17/907864417.db2.gz PWAZXUDSMOUOJP-UHFFFAOYSA-N 0 3 418.331 4.473 20 0 HIADHN CNC(=O)[C@@H]1CCC[C@H]1NCc1cc(Br)ccc1OCc1ccccc1 ZINC000498376362 907866058 /nfs/dbraw/zinc/86/60/58/907866058.db2.gz SJVCFTYJBGDSTD-RTBURBONSA-N 0 3 417.347 4.032 20 0 HIADHN CC(C)n1ncc2c1nc(-c1ccco1)cc2C(=O)N(CCN(C)C)C1CCCC1 ZINC000498462430 907929910 /nfs/dbraw/zinc/92/99/10/907929910.db2.gz JIXJZWSZQVHITC-UHFFFAOYSA-N 0 3 409.534 4.219 20 0 HIADHN COc1cccc(C2CCN(C(=O)c3ccc(N4CCN(C(C)C)CC4)cc3)CC2)c1 ZINC000498484836 907955888 /nfs/dbraw/zinc/95/58/88/907955888.db2.gz NTXSOCHLAQKJQN-UHFFFAOYSA-N 0 3 421.585 4.245 20 0 HIADHN COc1ccc(NC(=O)c2ccccc2CN(C)C)cc1NC(=O)c1cccc(F)c1 ZINC000498553609 908015040 /nfs/dbraw/zinc/01/50/40/908015040.db2.gz GXDLSIXMAPLMQG-UHFFFAOYSA-N 0 3 421.472 4.401 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)NCc1cc(F)c(C(F)(F)F)cc1F ZINC000512876740 921374080 /nfs/dbraw/zinc/37/40/80/921374080.db2.gz AFJMKFOSSUQCAF-UHFFFAOYSA-N 0 3 421.435 4.319 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)NCc2ccc(OC(C)(C)C)nc2)CC1 ZINC000498706862 908132342 /nfs/dbraw/zinc/13/23/42/908132342.db2.gz MAQICSCCSVJZQH-UHFFFAOYSA-N 0 3 410.562 4.065 20 0 HIADHN Cc1cc(-c2cc(C(=O)N3CCN(C)CC[C@H]3C)c3cnn(C(C)C)c3n2)c(C)o1 ZINC000498709886 908136612 /nfs/dbraw/zinc/13/66/12/908136612.db2.gz MKEOIBGSERMXFX-OAHLLOKOSA-N 0 3 409.534 4.055 20 0 HIADHN CC[C@@H](C)n1ncc2c1nc(C)cc2C(=O)N(CCN(C)C)Cc1ccccc1F ZINC000498709796 908136986 /nfs/dbraw/zinc/13/69/86/908136986.db2.gz BLERWIGQFQTJRO-QGZVFWFLSA-N 0 3 411.525 4.054 20 0 HIADHN C[C@H]1CCN(C)CCN1C(=O)[C@](C)(Cc1nc2ccccc2s1)c1ccccc1 ZINC000498717196 908142081 /nfs/dbraw/zinc/14/20/81/908142081.db2.gz RFGXAIPMSRFHPQ-MHECFPHRSA-N 0 3 407.583 4.349 20 0 HIADHN CCc1ccc(-c2nn(-c3ccccc3)cc2C(=O)N2CCN(C)CC[C@@H]2C)cc1 ZINC000498720508 908145467 /nfs/dbraw/zinc/14/54/67/908145467.db2.gz IHBKWDDNDFQOAM-IBGZPJMESA-N 0 3 402.542 4.268 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@@H]2CNC(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)cc1 ZINC000498726871 908153815 /nfs/dbraw/zinc/15/38/15/908153815.db2.gz GLZURFPKVDAIDE-JFTIXFDTSA-N 0 3 409.574 4.453 20 0 HIADHN COc1cccc(C2(NC(=O)NC[C@H](c3ccc(OC(C)C)cc3)N(C)C)CC2)c1 ZINC000512895836 921388310 /nfs/dbraw/zinc/38/83/10/921388310.db2.gz LJCGABSAOBCULM-JOCHJYFZSA-N 0 3 411.546 4.074 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)N2CC[C@@H](CC(F)(F)F)C2)N(C)C)cc1 ZINC000512900938 921392828 /nfs/dbraw/zinc/39/28/28/921392828.db2.gz GARLAMPURDUEJE-YJBOKZPZSA-N 0 3 401.473 4.060 20 0 HIADHN Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000498857721 908261539 /nfs/dbraw/zinc/26/15/39/908261539.db2.gz STTPKHJTPRGVIP-DENIHFKCSA-N 0 3 420.557 4.188 20 0 HIADHN Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000498859263 908262388 /nfs/dbraw/zinc/26/23/88/908262388.db2.gz NCBNRRJXRDJDNX-QHCPKHFHSA-N 0 3 420.557 4.190 20 0 HIADHN Cc1nc(C(C)(C)NC(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)sc1C ZINC000512902331 921394337 /nfs/dbraw/zinc/39/43/37/921394337.db2.gz NRDUQVZPAQCGJB-LJQANCHMSA-N 0 3 418.607 4.384 20 0 HIADHN Cc1sc2ccc(Cl)cc2c1S(=O)(=O)N(C)[C@H](C)C1CCN(C)CC1 ZINC000498884531 908285052 /nfs/dbraw/zinc/28/50/52/908285052.db2.gz RXHULKXJLNNGHY-GFCCVEGCSA-N 0 3 400.997 4.214 20 0 HIADHN C[C@@H](NC(=O)NCc1nccn1CCCc1ccccc1)[C@@H](c1ccccc1)N(C)C ZINC000498891174 908297075 /nfs/dbraw/zinc/29/70/75/908297075.db2.gz MHKAZJCOMAVTDB-YKSBVNFPSA-N 0 3 419.573 4.007 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)NC2CCC3(CCOCC3)CC2)N(C)C)cc1 ZINC000498902600 908309912 /nfs/dbraw/zinc/30/99/12/908309912.db2.gz WFYHTNOHOVIAHO-QFIPXVFZSA-N 0 3 417.594 4.115 20 0 HIADHN C[C@H](C(=O)N[C@@H](C)c1ccc2c(c1)CCCC2)N1CCC[C@H](c2nc(C3CC3)n[nH]2)C1 ZINC000498903825 908312487 /nfs/dbraw/zinc/31/24/87/908312487.db2.gz DCUBRDHHLPCUAT-JKSBSHDWSA-N 0 3 421.589 4.006 20 0 HIADHN C[C@H](C(=O)N[C@@H](C)c1ccc2c(c1)CCCC2)N1CCC[C@H](c2n[nH]c(C3CC3)n2)C1 ZINC000498903825 908312502 /nfs/dbraw/zinc/31/25/02/908312502.db2.gz DCUBRDHHLPCUAT-JKSBSHDWSA-N 0 3 421.589 4.006 20 0 HIADHN CCN1C[C@@H](C)N(CC(=O)Nc2nc(-c3c(C)cc(C)cc3C)cs2)C[C@@H]1C ZINC000498910056 908320132 /nfs/dbraw/zinc/32/01/32/908320132.db2.gz BRIGKSXMYFKJLY-ZWKOTPCHSA-N 0 3 400.592 4.088 20 0 HIADHN CCN1C[C@@H](C)N(CC(=O)Nc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C[C@@H]1C ZINC000498924055 908334518 /nfs/dbraw/zinc/33/45/18/908334518.db2.gz JVRSOPRJYMNIDR-NWDGAFQWSA-N 0 3 411.390 4.077 20 0 HIADHN C[C@H](C(=O)N[C@@H](C)c1cccc2ccccc21)N1CCC[C@@H](c2nc(C3CC3)n[nH]2)C1 ZINC000498935718 908343279 /nfs/dbraw/zinc/34/32/79/908343279.db2.gz ADAOXGFDDNAPLL-SQGPQFPESA-N 0 3 417.557 4.281 20 0 HIADHN C[C@H](C(=O)N[C@@H](C)c1cccc2ccccc21)N1CCC[C@@H](c2n[nH]c(C3CC3)n2)C1 ZINC000498935718 908343294 /nfs/dbraw/zinc/34/32/94/908343294.db2.gz ADAOXGFDDNAPLL-SQGPQFPESA-N 0 3 417.557 4.281 20 0 HIADHN CN(C)C(=O)[C@@H]1CCC[C@@H](N[C@H](c2ccco2)c2ccc(Br)cc2)C1 ZINC000498938771 908346565 /nfs/dbraw/zinc/34/65/65/908346565.db2.gz DVSKYKFYKCPJJP-SUMDDJOVSA-N 0 3 405.336 4.368 20 0 HIADHN CC[C@H](C)Sc1ccc(NC(=O)C(=O)NC[C@H](C)N2CCCC[C@H]2C)c(C)c1 ZINC000498968425 908361815 /nfs/dbraw/zinc/36/18/15/908361815.db2.gz CJNCHOKCBWQUGL-SQNIBIBYSA-N 0 3 405.608 4.203 20 0 HIADHN FC(F)(F)c1cccc([C@@H]2CCC[C@@H]2NCc2cn(Cc3cccnc3)nn2)c1 ZINC000512913315 921406131 /nfs/dbraw/zinc/40/61/31/921406131.db2.gz NQQUDSYKJAXEGX-PMACEKPBSA-N 0 3 401.436 4.166 20 0 HIADHN Cc1cccc([C@@H](NC(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)c2ccccn2)c1 ZINC000499026673 908401969 /nfs/dbraw/zinc/40/19/69/908401969.db2.gz KPJDFBDCXHIZLV-ILBGXUMGSA-N 0 3 414.553 4.395 20 0 HIADHN Cc1cccc([C@H](NC(=O)N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)c2ccccn2)c1 ZINC000499030932 908406180 /nfs/dbraw/zinc/40/61/80/908406180.db2.gz VFYSDFLPADAWDO-PBXXJUDPSA-N 0 3 414.553 4.442 20 0 HIADHN Cc1cccc([C@H](NC(=O)N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)c2ccccn2)c1 ZINC000499030930 908406664 /nfs/dbraw/zinc/40/66/64/908406664.db2.gz VFYSDFLPADAWDO-OPHFCASCSA-N 0 3 414.553 4.442 20 0 HIADHN COc1ccc(C[C@@H](N[C@@H](C)C(=O)NCc2ccccc2)c2ccc(OC)cc2)cc1 ZINC000499068983 908435032 /nfs/dbraw/zinc/43/50/32/908435032.db2.gz KDATYEPDPTWRKA-UQBPGWFLSA-N 0 3 418.537 4.282 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(-n2cncn2)cc1)C(=O)Nc1ccc(Cl)cc1Cl ZINC000499074826 908440319 /nfs/dbraw/zinc/44/03/19/908440319.db2.gz YJVSWFSHZVHKSH-QWHCGFSZSA-N 0 3 404.301 4.252 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)N[C@@H](c1cccc(F)c1)c1ccccn1 ZINC000499086478 908448956 /nfs/dbraw/zinc/44/89/56/908448956.db2.gz ZAWKXZRUAIGLJO-ZEQRLZLVSA-N 0 3 418.516 4.446 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N[C@@H](c2cccc(F)c2)c2ccccn2)N(C)C)cc1 ZINC000499086188 908449914 /nfs/dbraw/zinc/44/99/14/908449914.db2.gz YBMOCKDJZBECIR-ZEQRLZLVSA-N 0 3 420.532 4.475 20 0 HIADHN Cc1cc(NC(=O)c2ccco2)sc1C(=O)NC[C@@H](c1ccc(C)cc1)N(C)C ZINC000499137330 908492659 /nfs/dbraw/zinc/49/26/59/908492659.db2.gz RTONDSVUSPRJLG-KRWDZBQOSA-N 0 3 411.527 4.243 20 0 HIADHN CCN(CC(=O)Nc1c(Br)cc(C)cc1Br)CC1CC1 ZINC000499142304 908500212 /nfs/dbraw/zinc/50/02/12/908500212.db2.gz PEXOCMAZFTZMPK-UHFFFAOYSA-N 0 3 404.146 4.190 20 0 HIADHN CC(C)(O)CN1CCc2c(cccc2NC(=O)Cc2c[nH]c3cccc(Cl)c23)C1 ZINC000499204871 908558567 /nfs/dbraw/zinc/55/85/67/908558567.db2.gz AUDOQUFGPMSYLO-UHFFFAOYSA-N 0 3 411.933 4.132 20 0 HIADHN CCOc1cccc(CNC(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)c1OC(F)F ZINC000499210831 908566281 /nfs/dbraw/zinc/56/62/81/908566281.db2.gz LLECZORQLQXJJO-KXBFYZLASA-N 0 3 421.488 4.177 20 0 HIADHN Cc1ccc(C[C@@H]2CCCN2C(=O)CCCN2CCN(c3ccccc3)CC2)cc1 ZINC000499234076 908597288 /nfs/dbraw/zinc/59/72/88/908597288.db2.gz AEZCICSLECFONQ-VWLOTQADSA-N 0 3 405.586 4.131 20 0 HIADHN Cc1nc(-c2c[nH]c(C(=O)N(CCN(C)C)Cc3cccc(Cl)c3)c2)cs1 ZINC000499254963 908630090 /nfs/dbraw/zinc/63/00/90/908630090.db2.gz WQTHXEXQDZQWLV-UHFFFAOYSA-N 0 3 402.951 4.304 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)N2CCc3nc(-c4ccccc4Cl)sc3C2)CN1C1CC1 ZINC000499304447 908675804 /nfs/dbraw/zinc/67/58/04/908675804.db2.gz RLQCBOBQAYTKGQ-ZIAGYGMSSA-N 0 3 416.978 4.156 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)NCCc2csc(C(C)(C)C)n2)CC1 ZINC000499336521 908711336 /nfs/dbraw/zinc/71/13/36/908711336.db2.gz YTSCQMSKJWQLLN-UHFFFAOYSA-N 0 3 414.619 4.289 20 0 HIADHN COc1cccc([C@H](C)C(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)c1 ZINC000499382377 908746785 /nfs/dbraw/zinc/74/67/85/908746785.db2.gz HOHNJCJPRAFZAL-INIZCTEOSA-N 0 3 408.464 4.408 20 0 HIADHN Cc1ccc(-c2nnc(-c3ccc(C(=O)N[C@H](C)CN4CCCCC4)cc3)o2)cc1 ZINC000512959324 921437714 /nfs/dbraw/zinc/43/77/14/921437714.db2.gz XSLKYYQOQHTXAY-GOSISDBHSA-N 0 3 404.514 4.316 20 0 HIADHN COCCn1cc(C(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)c2ccccc21 ZINC000499418886 908782518 /nfs/dbraw/zinc/78/25/18/908782518.db2.gz DNMJAZXYDIPQLN-DEOSSOPVSA-N 0 3 405.542 4.163 20 0 HIADHN CN(C)Cc1cccc(NC(=O)C(=O)NCc2ccccc2Sc2ccccc2)c1 ZINC000499544691 908835817 /nfs/dbraw/zinc/83/58/17/908835817.db2.gz MTYRJBSLKBWIDV-UHFFFAOYSA-N 0 3 419.550 4.154 20 0 HIADHN CN(C(=O)c1cn(C)nc1-c1ccccc1Cl)C1CCN(Cc2ccccc2)CC1 ZINC000499550092 908837378 /nfs/dbraw/zinc/83/73/78/908837378.db2.gz XKLXVKKZTYJMCJ-UHFFFAOYSA-N 0 3 422.960 4.477 20 0 HIADHN Cc1nn(-c2ccccc2)c(Oc2ccc(F)cc2)c1CNC[C@]1(O)CCSC1 ZINC000499676861 908873902 /nfs/dbraw/zinc/87/39/02/908873902.db2.gz FHFLJDZIQQYECY-JOCHJYFZSA-N 0 3 413.518 4.070 20 0 HIADHN C[C@H](CN1CCC[C@H](C)C1)NC(=O)c1oc2ccccc2c1CSc1ncccn1 ZINC000499725469 908892236 /nfs/dbraw/zinc/89/22/36/908892236.db2.gz AGGPKKKRTDWFDH-DLBZAZTESA-N 0 3 424.570 4.365 20 0 HIADHN COc1ccccc1-c1csc([C@@H]2CCCN(C[C@@](C)(O)C(F)(F)F)C2)n1 ZINC000499732997 908893553 /nfs/dbraw/zinc/89/35/53/908893553.db2.gz JFNAJAYSGPVDKG-FZKQIMNGSA-N 0 3 400.466 4.311 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCc1ccc(OC2CCCC2)nc1)c1ccsc1 ZINC000499750680 908898428 /nfs/dbraw/zinc/89/84/28/908898428.db2.gz SMRZAOWIKJSKGB-FQEVSTJZSA-N 0 3 416.591 4.347 20 0 HIADHN Cc1cc(CCNCc2cn(-c3ccc(Br)cc3)nc2C(C)C)on1 ZINC000512977927 921450899 /nfs/dbraw/zinc/45/08/99/921450899.db2.gz VAEPJSBKFYWNMB-UHFFFAOYSA-N 0 3 403.324 4.387 20 0 HIADHN CS(=O)(=O)C1(CNCc2cccc(OCc3ccccc3Cl)c2)CCCC1 ZINC000513002459 921467926 /nfs/dbraw/zinc/46/79/26/921467926.db2.gz ZITBLSHMHRGBJX-UHFFFAOYSA-N 0 3 407.963 4.366 20 0 HIADHN CCN1CCN(c2ccccc2CNCc2c(OC)cccc2OC(F)(F)F)CC1 ZINC000513032252 921491855 /nfs/dbraw/zinc/49/18/55/921491855.db2.gz KAGSKBZKFGUQDM-UHFFFAOYSA-N 0 3 423.479 4.026 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2ccc(-c3noc(C(F)(F)F)n3)cc2)N(C)C)cc1 ZINC000499979433 909427317 /nfs/dbraw/zinc/42/73/17/909427317.db2.gz ZIEVBGWLACEALC-KRWDZBQOSA-N 0 3 418.419 4.097 20 0 HIADHN CC(C)Cn1ncc(NC(=O)N2CCC(CN3C[C@@H](C)O[C@H](C)C3)CC2)c1C(C)C ZINC000500006879 909457461 /nfs/dbraw/zinc/45/74/61/909457461.db2.gz UKTWLBOVFUUMAF-RTBURBONSA-N 0 3 419.614 4.016 20 0 HIADHN C[C@@H]1C[C@@H]1c1ccc([C@@H]2C[C@H]2C(=O)NCCCCN2CCN(c3ccccc3)CC2)o1 ZINC000500068477 909538377 /nfs/dbraw/zinc/53/83/77/909538377.db2.gz WQWMUSSHZHCFHB-CWKRKGSWSA-N 0 3 421.585 4.225 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3ccc(F)cc3OC(C)(C)C)CC2)C[C@H](C)O1 ZINC000500091148 909569567 /nfs/dbraw/zinc/56/95/67/909569567.db2.gz MOCCYRQLQFONQN-CALCHBBNSA-N 0 3 421.557 4.356 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)N[C@@H]2CCOC3(CCCCC3)C2)N(C)C)cc1 ZINC000500147997 909624456 /nfs/dbraw/zinc/62/44/56/909624456.db2.gz OJYXGTRDNWEGAT-IRLDBZIGSA-N 0 3 417.594 4.258 20 0 HIADHN CNC(=O)[C@@H]1CCC[C@@H]1NCc1c(C)nn(-c2ccccc2)c1Oc1cccc(F)c1 ZINC000500230269 909719509 /nfs/dbraw/zinc/71/95/09/909719509.db2.gz PDIFGMKYVQZSDI-IRLDBZIGSA-N 0 3 422.504 4.116 20 0 HIADHN CCc1nnc(NC(=O)[C@@H](C)[C@@H](C)NCc2ccc(F)c(Cl)c2Cl)s1 ZINC000513068300 921523295 /nfs/dbraw/zinc/52/32/95/921523295.db2.gz JAWWICZMGYHKRY-DTWKUNHWSA-N 0 3 405.326 4.299 20 0 HIADHN COCCn1cc(CNCc2ccc(-c3ccccc3Br)s2)cn1 ZINC000500379446 909825142 /nfs/dbraw/zinc/82/51/42/909825142.db2.gz VDHPGMBKYPRQGS-UHFFFAOYSA-N 0 3 406.349 4.310 20 0 HIADHN C[C@@H](NC(=O)NCC(C)(C)N1CCc2ccccc2C1)c1ccccc1OC(F)F ZINC000500405801 909837627 /nfs/dbraw/zinc/83/76/27/909837627.db2.gz STMFLLTVFWHDCB-MRXNPFEDSA-N 0 3 417.500 4.485 20 0 HIADHN CCS(=O)(=O)c1c(Cl)cccc1CNCCCc1c[nH]c2ccc(F)cc12 ZINC000500469087 909875902 /nfs/dbraw/zinc/87/59/02/909875902.db2.gz JGIRYXXEVIHDFS-UHFFFAOYSA-N 0 3 408.926 4.476 20 0 HIADHN C[C@@H]1[C@H](NC(=O)N[C@@H](C[C@@H]2CCOC2)c2ccccc2)CCN1Cc1ccccc1 ZINC000500589511 909951003 /nfs/dbraw/zinc/95/10/03/909951003.db2.gz IBHDTDIQVZQOJX-MHHVOYGZSA-N 0 3 407.558 4.117 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)N[C@@H](C)c2cc(C)sc2C)CC1 ZINC000500628832 909978201 /nfs/dbraw/zinc/97/82/01/909978201.db2.gz NVYZSOUYEBGIAT-SFHVURJKSA-N 0 3 414.619 4.063 20 0 HIADHN CCC[C@@H](NCc1cc(C(F)(F)F)ccc1N1CCN(C)CC1)c1ccccn1 ZINC000500645285 909988979 /nfs/dbraw/zinc/98/89/79/909988979.db2.gz CKBRNZOCJQUURG-LJQANCHMSA-N 0 3 406.496 4.483 20 0 HIADHN CCc1nnc(NC(=O)[C@@H](C)[C@H](C)NCc2ccc(-c3ccccc3F)o2)s1 ZINC000513093403 921542568 /nfs/dbraw/zinc/54/25/68/921542568.db2.gz AFVOQAGKEPNMGK-STQMWFEESA-N 0 3 402.495 4.253 20 0 HIADHN COc1ccc(C(=O)CCC(=O)N[C@H]2CCN(Cc3ccccc3)CC2(C)C)cc1 ZINC000513092245 921542910 /nfs/dbraw/zinc/54/29/10/921542910.db2.gz KENFSMMMLKIPCI-QHCPKHFHSA-N 0 3 408.542 4.075 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)c1cc(Br)cc2ccccc21 ZINC000500748733 910058672 /nfs/dbraw/zinc/05/86/72/910058672.db2.gz IWIWKBXSGSAMQS-UHFFFAOYSA-N 0 3 412.331 4.201 20 0 HIADHN CSc1ccc(Cl)c(C(=O)N(C)C2CCN(CCc3ccccn3)CC2)c1 ZINC000500767195 910068134 /nfs/dbraw/zinc/06/81/34/910068134.db2.gz RQFCVSLRFYNNBO-UHFFFAOYSA-N 0 3 403.979 4.236 20 0 HIADHN Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)N(CCN(C)C)Cc1ccccn1 ZINC000500778440 910074967 /nfs/dbraw/zinc/07/49/67/910074967.db2.gz WYPLHAADMRPPCZ-UHFFFAOYSA-N 0 3 414.962 4.371 20 0 HIADHN O=C(Nc1cccc(F)c1)C1CCN(Cc2ccc(Oc3cnccn3)cc2)CC1 ZINC000513106441 921554115 /nfs/dbraw/zinc/55/41/15/921554115.db2.gz MGVPITSSVVZDKA-UHFFFAOYSA-N 0 3 406.461 4.259 20 0 HIADHN CCOc1cccc(C(=O)N(CCN(C)C)Cc2ccc(Br)cc2)c1 ZINC000500984585 910218335 /nfs/dbraw/zinc/21/83/35/910218335.db2.gz XGMLSMJKMJUQQO-UHFFFAOYSA-N 0 3 405.336 4.052 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)Nc1cccc(NC(=O)c2ccoc2)c1 ZINC000501169039 910338252 /nfs/dbraw/zinc/33/82/52/910338252.db2.gz SLMRPECAWHCOSO-UHFFFAOYSA-N 0 3 406.486 4.128 20 0 HIADHN Cc1cc(C)n2c(CN3CCC[C@@H](c4nc(-c5ccc(Cl)cc5)no4)C3)cnc2n1 ZINC000513128827 921572505 /nfs/dbraw/zinc/57/25/05/921572505.db2.gz SXPXJRBTDRFJMT-QGZVFWFLSA-N 0 3 422.920 4.429 20 0 HIADHN CC[C@@H](CNC(=O)Nc1cccc(OC[C@@H]2CCCO2)c1)N1CCc2ccccc2C1 ZINC000501333474 910474499 /nfs/dbraw/zinc/47/44/99/910474499.db2.gz OCNGOPUIFBWAJD-UPVQGACJSA-N 0 3 423.557 4.203 20 0 HIADHN CC(=O)c1cccc(O[C@@H](C)C(=O)NC[C@@H](c2ccccc2)N2CCC(C)CC2)c1 ZINC000501341969 910479932 /nfs/dbraw/zinc/47/99/32/910479932.db2.gz FZBQKMKLCFCDSS-RDPSFJRHSA-N 0 3 408.542 4.246 20 0 HIADHN CC1CCN([C@@H](CNC(=O)C2(c3ccc(F)cc3)CCOCC2)c2ccccc2)CC1 ZINC000501344761 910482040 /nfs/dbraw/zinc/48/20/40/910482040.db2.gz RQHFXSGGCDWCQK-DEOSSOPVSA-N 0 3 424.560 4.463 20 0 HIADHN CCOCCOc1ccccc1C(=O)NC[C@@H](c1ccccc1)N1CCC(C)CC1 ZINC000501345557 910482118 /nfs/dbraw/zinc/48/21/18/910482118.db2.gz WLPBTXCYEZMRQQ-QHCPKHFHSA-N 0 3 410.558 4.305 20 0 HIADHN CC[C@H](CNC(=O)Nc1ccccc1Br)N1CCc2ccccc2C1 ZINC000501353696 910489750 /nfs/dbraw/zinc/48/97/50/910489750.db2.gz ZALIXSMTTWRSFZ-QGZVFWFLSA-N 0 3 402.336 4.408 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)c2cnn(-c3ccc(Cl)cc3Cl)c2)o1 ZINC000501359218 910492140 /nfs/dbraw/zinc/49/21/40/910492140.db2.gz ANMXPZQHPYDDKD-UHFFFAOYSA-N 0 3 421.328 4.285 20 0 HIADHN C/C(=C/c1ccccc1C(F)(F)F)CNCc1cccnc1N1CCN(C)CC1 ZINC000501377931 910507482 /nfs/dbraw/zinc/50/74/82/910507482.db2.gz NIJOGWOBCCHSSC-VKAVYKQESA-N 0 3 404.480 4.045 20 0 HIADHN CNS(=O)(=O)c1cccc([C@@H](C)NC/C(C)=C/c2ccccc2C(F)(F)F)c1 ZINC000501456341 910580769 /nfs/dbraw/zinc/58/07/69/910580769.db2.gz UGJQCCWMCGRURU-ATGUSINASA-N 0 3 412.477 4.368 20 0 HIADHN COC(=O)CCC[C@@H]1CCC[C@H](N[C@@H](C)c2nc(-c3cccc(OC)c3)no2)C1 ZINC000513163502 921595002 /nfs/dbraw/zinc/59/50/02/921595002.db2.gz AYDFAFNDEAOKCK-BQFCYCMXSA-N 0 3 401.507 4.298 20 0 HIADHN CN(C)C[C@H](NC(=O)N[C@@H]1CCO[C@H]1c1ccc(Cl)c(F)c1)c1ccc(F)cc1 ZINC000501570359 910676477 /nfs/dbraw/zinc/67/64/77/910676477.db2.gz VANIFLDZORRQRW-AABGKKOBSA-N 0 3 423.891 4.050 20 0 HIADHN Cc1ccccc1C1(CN[C@H](C(=O)N2CCCCC2)c2ccccc2)CCOCC1 ZINC000513174515 921600894 /nfs/dbraw/zinc/60/08/94/921600894.db2.gz UYOMCLBGYMPARJ-DEOSSOPVSA-N 0 3 406.570 4.387 20 0 HIADHN CCOc1cccc(CN2CCC[C@H](c3n[nH]cc3NC(=O)c3ccccc3)C2)c1 ZINC000501763157 910818720 /nfs/dbraw/zinc/81/87/20/910818720.db2.gz NRLRABUKDIRLKA-FQEVSTJZSA-N 0 3 404.514 4.440 20 0 HIADHN COc1ccc(CN2CCC[C@@H](c3n[nH]cc3NC(=O)c3ccccc3)C2)cc1C ZINC000501765216 910820156 /nfs/dbraw/zinc/82/01/56/910820156.db2.gz ANPMZOCZIIIGAR-HXUWFJFHSA-N 0 3 404.514 4.359 20 0 HIADHN C[C@H](NCC(=O)N1Cc2ccccc2[C@@H](c2ccccc2)C1)c1ccc2n[nH]cc2c1 ZINC000513184814 921607661 /nfs/dbraw/zinc/60/76/61/921607661.db2.gz VHHGOHHOPWEJKK-MHECFPHRSA-N 0 3 410.521 4.388 20 0 HIADHN CC1(C)CCC(CC(=O)N2CCC[C@H](CN3CCN(c4ccccn4)CC3)C2)CC1 ZINC000501772423 910826477 /nfs/dbraw/zinc/82/64/77/910826477.db2.gz BHDDDPIGEJMJGG-JOCHJYFZSA-N 0 3 412.622 4.049 20 0 HIADHN CN(Cc1ccc(Br)cc1)C(=O)N[C@H](CN1CCCC1)c1ccccc1 ZINC000501795201 910847673 /nfs/dbraw/zinc/84/76/73/910847673.db2.gz DGUMGKUJXXFZHV-HXUWFJFHSA-N 0 3 416.363 4.428 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)c3ccc(Oc4ccccc4)nc3)cc2)CC1 ZINC000513191391 921611359 /nfs/dbraw/zinc/61/13/59/921611359.db2.gz LLAZBSMPGFIHIN-UHFFFAOYSA-N 0 3 416.525 4.264 20 0 HIADHN C[C@@H](NC(=O)N[C@@H](CN1CCCC1)c1ccccc1)c1cccc(OC(F)F)c1 ZINC000501799052 910850607 /nfs/dbraw/zinc/85/06/07/910850607.db2.gz FPLBGHBXBDOXNN-UZLBHIALSA-N 0 3 403.473 4.485 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)N1CCC[C@@H]1c1ccc2c(c1)OCCO2 ZINC000501801624 910852161 /nfs/dbraw/zinc/85/21/61/910852161.db2.gz FVNOOBGJVCMZKG-FGZHOGPDSA-N 0 3 421.541 4.141 20 0 HIADHN O=C(Nc1ccc(OC[C@@H]2CCCO2)cc1)N[C@H](CN1CCCC1)c1ccccc1 ZINC000501804292 910855101 /nfs/dbraw/zinc/85/51/01/910855101.db2.gz JSSHIZYSERFVCC-XZOQPEGZSA-N 0 3 409.530 4.203 20 0 HIADHN O=C(Nc1ccc(OC[C@H]2CCCO2)cc1)N[C@H](CN1CCCC1)c1ccccc1 ZINC000501804289 910855377 /nfs/dbraw/zinc/85/53/77/910855377.db2.gz JSSHIZYSERFVCC-DHIUTWEWSA-N 0 3 409.530 4.203 20 0 HIADHN CCN(Cc1cccc(NC(=O)N[C@@H](CN2CCCC2)c2ccccc2)c1)C(C)=O ZINC000501853178 910886472 /nfs/dbraw/zinc/88/64/72/910886472.db2.gz YRTWJFQQTUAYAS-QHCPKHFHSA-N 0 3 408.546 4.014 20 0 HIADHN CCc1ccccc1NC(=O)CN[C@]1(Cc2ccc(C(F)(F)F)cc2)CCOC1 ZINC000513195346 921614838 /nfs/dbraw/zinc/61/48/38/921614838.db2.gz AQYXAHVUOFBKKS-NRFANRHFSA-N 0 3 406.448 4.198 20 0 HIADHN CC(=O)N(c1nc(CN2CCN(C3CCCC3)CC2)cs1)c1ccccc1F ZINC000501868467 910894967 /nfs/dbraw/zinc/89/49/67/910894967.db2.gz FTYXRJKBLWMGQE-UHFFFAOYSA-N 0 3 402.539 4.027 20 0 HIADHN CCN(C(=O)c1cc2c(c(Cl)c1)OCO2)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000501953070 910940189 /nfs/dbraw/zinc/94/01/89/910940189.db2.gz BNRQIBMRQJHYGF-QAPCUYQASA-N 0 3 400.906 4.366 20 0 HIADHN CSc1cccc(NC(=O)CN[C@]2(Cc3ccc(C(F)(F)F)cc3)CCOC2)c1 ZINC000513206252 921622545 /nfs/dbraw/zinc/62/25/45/921622545.db2.gz VBMUVWZGUMIAHP-FQEVSTJZSA-N 0 3 424.488 4.357 20 0 HIADHN C[C@H](C[NH2+][C@H](c1nc(-c2nc[n-]n2)no1)C(C)(C)C)c1ccc(C(F)(F)F)cc1 ZINC000502020894 910980427 /nfs/dbraw/zinc/98/04/27/910980427.db2.gz FNYQYQAVIKUFQQ-BXUZGUMPSA-N 0 3 408.428 4.354 20 0 HIADHN C[C@H](CN[C@H](c1nc(-c2nc[nH]n2)no1)C(C)(C)C)c1ccc(C(F)(F)F)cc1 ZINC000502020894 910980433 /nfs/dbraw/zinc/98/04/33/910980433.db2.gz FNYQYQAVIKUFQQ-BXUZGUMPSA-N 0 3 408.428 4.354 20 0 HIADHN COc1ccc(C2(CN[C@@H](C(=O)N3CCCCC3)c3ccccc3)CCOCC2)cc1 ZINC000513204994 921622784 /nfs/dbraw/zinc/62/27/84/921622784.db2.gz KRVJRCRFAGZYTM-XMMPIXPASA-N 0 3 422.569 4.087 20 0 HIADHN CC(C)C(=O)NC1CCN(Cc2cn(-c3ccccc3)nc2-c2ccccc2)CC1 ZINC000502052104 911002313 /nfs/dbraw/zinc/00/23/13/911002313.db2.gz WAXWYOLOMRXDAE-UHFFFAOYSA-N 0 3 402.542 4.276 20 0 HIADHN Cc1cccc(C)c1NC(=O)CN[C@]1(Cc2ccc(C(F)(F)F)cc2)CCOC1 ZINC000513211597 921628315 /nfs/dbraw/zinc/62/83/15/921628315.db2.gz YNYCCDQUGMULTR-NRFANRHFSA-N 0 3 406.448 4.252 20 0 HIADHN Cn1cc(NC(=O)N(Cc2ccccc2)C2CCN(C)CC2)c(-c2ccccc2)n1 ZINC000502205211 911149282 /nfs/dbraw/zinc/14/92/82/911149282.db2.gz DSYGEHVOFMTLEJ-UHFFFAOYSA-N 0 3 403.530 4.215 20 0 HIADHN CCc1cccc(C)c1NC(=O)CNC(C)(C)COc1ccc(C(F)(F)F)cn1 ZINC000502246134 911200136 /nfs/dbraw/zinc/20/01/36/911200136.db2.gz UKFRZVLEWMESQM-UHFFFAOYSA-N 0 3 409.452 4.357 20 0 HIADHN COc1cc(C)c([C@@H](C)NC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)cc1OC ZINC000502282104 911234996 /nfs/dbraw/zinc/23/49/96/911234996.db2.gz JCMNRASKWWXQDM-QUCCMNQESA-N 0 3 411.546 4.037 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)c1nc(-c2ccccc2)cs1 ZINC000513236122 921648182 /nfs/dbraw/zinc/64/81/82/921648182.db2.gz UXEHBMUAGOOVNS-UHFFFAOYSA-N 0 3 401.482 4.292 20 0 HIADHN CC(=O)Nc1c[nH]nc1[C@H]1CCCN([C@@H]2CCCc3ccc(Br)cc32)C1 ZINC000502356860 911338150 /nfs/dbraw/zinc/33/81/50/911338150.db2.gz CSWSOCPACQOSJX-HNAYVOBHSA-N 0 3 417.351 4.388 20 0 HIADHN CCc1cccc(OCCN2CCC[C@H](c3n[nH]cc3NC(=O)C3CCCC3)C2)c1 ZINC000502363195 911347924 /nfs/dbraw/zinc/34/79/24/911347924.db2.gz VLXDSNDUGIYFMI-FQEVSTJZSA-N 0 3 410.562 4.359 20 0 HIADHN COCC[C@@H]1CCC[C@@H]1N[C@H](c1cccc(S(C)(=O)=O)c1)c1ccc(F)c(F)c1 ZINC000502404600 911388755 /nfs/dbraw/zinc/38/87/55/911388755.db2.gz QOAMPKFGHHDXSD-UZQPLGKSSA-N 0 3 423.525 4.253 20 0 HIADHN Cn1cc(C(=O)NC[C@H]2CCCN2Cc2ccccc2)c(-c2ccccc2Cl)n1 ZINC000513262761 921666372 /nfs/dbraw/zinc/66/63/72/921666372.db2.gz OFMDCQBQFDMWDM-GOSISDBHSA-N 0 3 408.933 4.135 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1ccc2nccnc2c1)c1ccc(C(F)(F)F)cc1 ZINC000502504643 911508540 /nfs/dbraw/zinc/50/85/40/911508540.db2.gz BLXKONMSIACIBL-HXUWFJFHSA-N 0 3 416.447 4.462 20 0 HIADHN COC1CCN(C2(CNC(=O)c3sc(-c4ccccc4)nc3C)CCCC2)CC1 ZINC000502513389 911516726 /nfs/dbraw/zinc/51/67/26/911516726.db2.gz RICLYJDJYLAAPT-UHFFFAOYSA-N 0 3 413.587 4.272 20 0 HIADHN Cc1cc(C)n(-c2ccc(C(=O)NC[C@H]3CCCN3Cc3ccccc3)cc2F)n1 ZINC000513263918 921668362 /nfs/dbraw/zinc/66/83/62/921668362.db2.gz TVCAMVLPXQOORK-OAQYLSRUSA-N 0 3 406.505 4.023 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3ccc([C@H]4CCCOC4)cc3)c(C)c2)CC1 ZINC000502542211 911549566 /nfs/dbraw/zinc/54/95/66/911549566.db2.gz UKZRNGFLRFKOBG-QFIPXVFZSA-N 0 3 407.558 4.283 20 0 HIADHN COc1ccc([C@H](CO)N(C)C[C@H](O)COc2cc(C)c(Cl)cc2C(C)C)cc1 ZINC000502547167 911553414 /nfs/dbraw/zinc/55/34/14/911553414.db2.gz TXMDNIUPUBDROA-AVRDEDQJSA-N 0 3 421.965 4.186 20 0 HIADHN C[C@@H](c1ccc(F)c(F)c1)N(C)C(=O)CN[C@]1(Cc2ccc(Cl)cc2)CCOC1 ZINC000502553402 911561756 /nfs/dbraw/zinc/56/17/56/911561756.db2.gz SJNWJNLIODUZTR-NYHFZMIOSA-N 0 3 422.903 4.129 20 0 HIADHN CC(C)(C)CC(C)(C)c1ccc(OC[C@H](O)CN2CCN(C3CCC3)CC2)cc1 ZINC000502572337 911578685 /nfs/dbraw/zinc/57/86/85/911578685.db2.gz TXSUFFOWLPABBD-JOCHJYFZSA-N 0 3 402.623 4.310 20 0 HIADHN COC(=O)[C@@](C)(CNCc1ccc(Sc2ccccn2)o1)c1ccc(F)cc1 ZINC000513286053 921684449 /nfs/dbraw/zinc/68/44/49/921684449.db2.gz IGNFASXPMMIKQA-NRFANRHFSA-N 0 3 400.475 4.185 20 0 HIADHN O=C(NC[C@H]1CCCN1Cc1ccccc1)c1cc(C2CC2)nn1-c1ccccc1 ZINC000513294053 921691298 /nfs/dbraw/zinc/69/12/98/921691298.db2.gz MWHBEACLNPXAOP-JOCHJYFZSA-N 0 3 400.526 4.144 20 0 HIADHN Cc1ccc(-c2nc(CC(=O)NC[C@@H]3CCCN3Cc3ccccc3)cs2)cc1 ZINC000513294284 921691639 /nfs/dbraw/zinc/69/16/39/921691639.db2.gz PDCPBIFCPUPFIY-QFIPXVFZSA-N 0 3 405.567 4.442 20 0 HIADHN Cc1oc(-c2ccccc2)nc1C(=O)Nc1cccc(N2CCN(C(C)C)CC2)c1 ZINC000502854699 911862483 /nfs/dbraw/zinc/86/24/83/911862483.db2.gz FTJSGVJGUAJCJC-UHFFFAOYSA-N 0 3 404.514 4.433 20 0 HIADHN Cc1nc2c(cnn2C(C)C)cc1C(=O)Nc1cccc(N2CCN(C(C)C)CC2)c1 ZINC000502854658 911862816 /nfs/dbraw/zinc/86/28/16/911862816.db2.gz FDKSCXKTEDFOBO-UHFFFAOYSA-N 0 3 420.561 4.103 20 0 HIADHN COc1ccc(OCCCC(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)cc1 ZINC000502854204 911862962 /nfs/dbraw/zinc/86/29/62/911862962.db2.gz CBHJSLQILFOWNC-UHFFFAOYSA-N 0 3 411.546 4.023 20 0 HIADHN Cc1nccn1CCCCN1CCC[C@@H]1c1ccccc1I ZINC000502868078 911873995 /nfs/dbraw/zinc/87/39/95/911873995.db2.gz PWXDPWKGERPYGK-GOSISDBHSA-N 0 3 409.315 4.413 20 0 HIADHN COc1ccc(Cl)cc1CC(=O)Nc1cccc(N2CCN(C(C)C)CC2)c1 ZINC000502882004 911882454 /nfs/dbraw/zinc/88/24/54/911882454.db2.gz SIZLTLSUUVXBMD-UHFFFAOYSA-N 0 3 401.938 4.060 20 0 HIADHN COc1ccc2c(CC(=O)Nc3cccc(N4CCN(C(C)C)CC4)c3)coc2c1 ZINC000502900344 911891283 /nfs/dbraw/zinc/89/12/83/911891283.db2.gz ZQDJAGLIPPHNNN-UHFFFAOYSA-N 0 3 407.514 4.153 20 0 HIADHN Cc1ccc(OCCCCNC(=O)NC[C@H](c2cccs2)N2CCCC2)cc1 ZINC000502967674 911949337 /nfs/dbraw/zinc/94/93/37/911949337.db2.gz FFJNOKGJJBEFSE-HXUWFJFHSA-N 0 3 401.576 4.352 20 0 HIADHN CCN1CCN([C@H](C)CNC(=O)[C@@H](Oc2cccc(C(C)C)c2)c2ccccc2)CC1 ZINC000503010787 911984541 /nfs/dbraw/zinc/98/45/41/911984541.db2.gz BPFVDDKOEZZNRN-BWKNWUBXSA-N 0 3 423.601 4.072 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)c1ccc([C@@H]2CCCOC2)cc1 ZINC000503060055 912023765 /nfs/dbraw/zinc/02/37/65/912023765.db2.gz PPWFOJYBDFWEIP-HXUWFJFHSA-N 0 3 402.485 4.063 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)N[C@H]2CCCc3c(O)cccc32)N(C)C)cc1 ZINC000503136440 912097060 /nfs/dbraw/zinc/09/70/60/912097060.db2.gz GSGJDAGGAUKKQK-FCHUYYIVSA-N 0 3 411.546 4.159 20 0 HIADHN COc1ccc([C@H](CNC(=O)N2CCN(C)CC[C@H]2C)c2c[nH]c3ccccc32)cc1 ZINC000503151455 912116624 /nfs/dbraw/zinc/11/66/24/912116624.db2.gz KIMVYLDJBOCFGO-GCJKJVERSA-N 0 3 420.557 4.044 20 0 HIADHN COc1ccc([C@@H](CNC(=O)N2CCN(C)CC[C@@H]2C)c2c[nH]c3ccccc32)cc1 ZINC000503151456 912117025 /nfs/dbraw/zinc/11/70/25/912117025.db2.gz KIMVYLDJBOCFGO-PGRDOPGGSA-N 0 3 420.557 4.044 20 0 HIADHN O[C@H](CO[C@@H]1CCCc2ccccc21)CN1CCC[C@@H]1c1n[nH]c(-c2ccccc2)n1 ZINC000503161381 912129314 /nfs/dbraw/zinc/12/93/14/912129314.db2.gz UHYLLQPBJDSLGN-MDNUFGMLSA-N 0 3 418.541 4.064 20 0 HIADHN O[C@H](CO[C@@H]1CCCc2ccccc21)C[N@@H+]1CCC[C@@H]1c1nnc(-c2ccccc2)[n-]1 ZINC000503161381 912129332 /nfs/dbraw/zinc/12/93/32/912129332.db2.gz UHYLLQPBJDSLGN-MDNUFGMLSA-N 0 3 418.541 4.064 20 0 HIADHN O[C@H](CO[C@@H]1CCCc2ccccc21)C[N@H+]1CCC[C@@H]1c1nnc(-c2ccccc2)[n-]1 ZINC000503161381 912129354 /nfs/dbraw/zinc/12/93/54/912129354.db2.gz UHYLLQPBJDSLGN-MDNUFGMLSA-N 0 3 418.541 4.064 20 0 HIADHN COc1ccc(CN2CCN(CCc3ccccc3)CC2)cc1OCc1cccnc1 ZINC000506280579 914881004 /nfs/dbraw/zinc/88/10/04/914881004.db2.gz OLBXZHSYLRIHLM-UHFFFAOYSA-N 0 3 417.553 4.030 20 0 HIADHN Cc1cccc(NC(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)c1C(=O)N1CCCC1 ZINC000506280999 914882169 /nfs/dbraw/zinc/88/21/69/914882169.db2.gz KMRUPTQERNEAAM-CTNGQTDRSA-N 0 3 420.557 4.188 20 0 HIADHN CC(C)Cc1ccc([C@@H](CNC(=O)N2CCC3(CCOCC3)CC2)N(C)C)cc1 ZINC000513345717 921729186 /nfs/dbraw/zinc/72/91/86/921729186.db2.gz MYNVYEHJRRIMSK-JOCHJYFZSA-N 0 3 401.595 4.090 20 0 HIADHN Cc1ccc(NC(=O)C2CC2)cc1NC(=O)N[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000506296240 914891349 /nfs/dbraw/zinc/89/13/49/914891349.db2.gz XNRWEGFFCYHMFU-UTKZUKDTSA-N 0 3 406.530 4.301 20 0 HIADHN Cc1cc(C)n(-c2cccc(NC(=O)N[C@@H]3CCN([C@@H](C)c4ccccc4)C3)c2)n1 ZINC000506296605 914891922 /nfs/dbraw/zinc/89/19/22/914891922.db2.gz BCONPMPWZCPMSI-SIKLNZKXSA-N 0 3 403.530 4.446 20 0 HIADHN CCN(CC)C(=O)Cc1ccc(NC(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)cc1 ZINC000506297795 914892385 /nfs/dbraw/zinc/89/23/85/914892385.db2.gz NAMGBQXSSXZIEF-CVDCTZTESA-N 0 3 422.573 4.055 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2CN2CCC(CC(=O)N(C)C)CC2)o1 ZINC000513349963 921730780 /nfs/dbraw/zinc/73/07/80/921730780.db2.gz DUBKJPPOAIZRCV-UHFFFAOYSA-N 0 3 406.530 4.131 20 0 HIADHN CCOc1cc(CN(C)[C@H](C)c2ccc(OC)cc2)ccc1O[C@H](C)C(=O)N(C)C ZINC000506326672 914933498 /nfs/dbraw/zinc/93/34/98/914933498.db2.gz QEHAEIRHBYSJEA-QZTJIDSGSA-N 0 3 414.546 4.142 20 0 HIADHN CC(C)Cc1ccc([C@H](CNC(=O)N2CCC[C@H]2C2CCOCC2)N(C)C)cc1 ZINC000513357353 921735772 /nfs/dbraw/zinc/73/57/72/921735772.db2.gz MJUHQFDECBOCEA-GOTSBHOMSA-N 0 3 401.595 4.088 20 0 HIADHN CC(C)Cc1ccc([C@@H](CNC(=O)N(C)C[C@@H](C)c2nccs2)N(C)C)cc1 ZINC000513356096 921736103 /nfs/dbraw/zinc/73/61/03/921736103.db2.gz BWNHRZAHLBTMDU-YLJYHZDGSA-N 0 3 402.608 4.389 20 0 HIADHN COC(=O)CCn1nc(C)c(CN2Cc3ccccc3[C@@H](c3ccccc3)C2)c1C ZINC000506396619 915013201 /nfs/dbraw/zinc/01/32/01/915013201.db2.gz SPKQPXHXGUKCPN-XMMPIXPASA-N 0 3 403.526 4.211 20 0 HIADHN Cc1c2ccc(F)cc2sc1C(=O)N(C)C[C@]1(O)CCN(Cc2ccccc2)C1 ZINC000506511004 915135018 /nfs/dbraw/zinc/13/50/18/915135018.db2.gz IUVMQXMVMCLHEW-HSZRJFAPSA-N 0 3 412.530 4.058 20 0 HIADHN COc1ccc(Br)c(NC(=O)NCCCN2CCc3ccccc3C2)c1 ZINC000506517848 915149283 /nfs/dbraw/zinc/14/92/83/915149283.db2.gz RJPQWQHRVGNDJL-UHFFFAOYSA-N 0 3 418.335 4.028 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)c2cnn(-c3ccccc3)c2C2CC2)C1 ZINC000513376151 921749821 /nfs/dbraw/zinc/74/98/21/921749821.db2.gz GANKSOIWKQRXGR-WIYYLYMNSA-N 0 3 400.526 4.315 20 0 HIADHN CCCN(C(=O)NCCc1c[nH]c2ncccc12)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000506540842 915185640 /nfs/dbraw/zinc/18/56/40/915185640.db2.gz KSSYRNWPHHQRQE-QFIPXVFZSA-N 0 3 419.573 4.192 20 0 HIADHN CCCS(=O)(=O)NC1CCN(Cc2ccc3c(c2)c2ccccc2n3CC)CC1 ZINC000506613188 915267001 /nfs/dbraw/zinc/26/70/01/915267001.db2.gz QSABQXVLNPZVQB-UHFFFAOYSA-N 0 3 413.587 4.108 20 0 HIADHN CC(C)Cc1cccc([C@@H](C)C(=O)Nc2cccc(CN3CCC(C(N)=O)CC3)c2)c1 ZINC000506614741 915270973 /nfs/dbraw/zinc/27/09/73/915270973.db2.gz VTIQNDIMZHVHEQ-LJQANCHMSA-N 0 3 421.585 4.325 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CN1CCC[C@@H](c2nnc3n2CCCCC3)C1 ZINC000506625584 915285309 /nfs/dbraw/zinc/28/53/09/915285309.db2.gz UNDFDGWLAYLRRZ-JOCHJYFZSA-N 0 3 418.589 4.246 20 0 HIADHN COc1ccccc1O[C@@H]1CCCN(CCc2nc(-c3cccc(Cl)c3)no2)C1 ZINC000513396211 921765796 /nfs/dbraw/zinc/76/57/96/921765796.db2.gz COCCAHCENSBLDY-GOSISDBHSA-N 0 3 413.905 4.485 20 0 HIADHN c1ccc(OCc2cccnc2)c(CN2CCC[C@@H](c3nnc4n3CCCCC4)C2)c1 ZINC000506689397 915367854 /nfs/dbraw/zinc/36/78/54/915367854.db2.gz KLRUOQJBISVNBX-JOCHJYFZSA-N 0 3 417.557 4.358 20 0 HIADHN COc1ccc([C@H](NC(=O)N2CCN(C3CCCC3)CC2)c2ccccc2OC)cc1 ZINC000506690248 915369333 /nfs/dbraw/zinc/36/93/33/915369333.db2.gz RLLYEVVMWFTITQ-DEOSSOPVSA-N 0 3 423.557 4.063 20 0 HIADHN CCOc1cc(CN2CCC(c3nnc4ccccn43)CC2)ccc1OC(F)F ZINC000506728817 915413379 /nfs/dbraw/zinc/41/33/79/915413379.db2.gz ZTHWGEMNEOGATG-UHFFFAOYSA-N 0 3 402.445 4.109 20 0 HIADHN Cc1sc2ncnc(N3CCC(C(=O)Nc4cccc(CN(C)C)c4)CC3)c2c1C ZINC000506774634 915488557 /nfs/dbraw/zinc/48/85/57/915488557.db2.gz HCRVRYCFKYHOQM-UHFFFAOYSA-N 0 3 423.586 4.225 20 0 HIADHN Cc1ccc(-c2nc(C(=O)NC[C@H]3CCCN(Cc4cccs4)C3)cs2)o1 ZINC000513414531 921782805 /nfs/dbraw/zinc/78/28/05/921782805.db2.gz JBGAJRXFTKTQKG-OAHLLOKOSA-N 0 3 401.557 4.415 20 0 HIADHN CCSc1cccc(NC(=O)NCCCN2CCN(C)C[C@@H]2c2ccccc2)c1 ZINC000506878739 915670014 /nfs/dbraw/zinc/67/00/14/915670014.db2.gz VIPQWWGWYWCQNW-JOCHJYFZSA-N 0 3 412.603 4.299 20 0 HIADHN CC(C)(C)[C@@H](NCC(=O)Nc1ccnn1Cc1cccs1)c1ccc(F)cc1 ZINC000507007125 915817903 /nfs/dbraw/zinc/81/79/03/915817903.db2.gz MADUMAKPRPNZOL-FQEVSTJZSA-N 0 3 400.523 4.448 20 0 HIADHN COc1ccc(CN(C)C(=O)CN[C@@H](c2ccc(F)cc2)C(C)(C)C)cc1OC ZINC000507041724 915836717 /nfs/dbraw/zinc/83/67/17/915836717.db2.gz UFWHWVPUTKUDOG-QFIPXVFZSA-N 0 3 402.510 4.178 20 0 HIADHN CCOc1ccc(SCC(=O)N2CCCN(CCCc3ccccc3)CC2)cc1 ZINC000507097065 915867251 /nfs/dbraw/zinc/86/72/51/915867251.db2.gz MTYCOMZWNONLNA-UHFFFAOYSA-N 0 3 412.599 4.345 20 0 HIADHN C/C=C/c1ccc(OCC(=O)N2CCCN(CCCc3ccccc3)CC2)c(OC)c1 ZINC000507096117 915867517 /nfs/dbraw/zinc/86/75/17/915867517.db2.gz AAAGWAIQKBGLSM-YCRREMRBSA-N 0 3 422.569 4.274 20 0 HIADHN COc1ccc(CN2CCC[C@H](C(=O)NCC3CC3)C2)cc1OCc1ccccc1 ZINC000507096851 915867538 /nfs/dbraw/zinc/86/75/38/915867538.db2.gz AUIODSKJFBXYTH-QFIPXVFZSA-N 0 3 408.542 4.012 20 0 HIADHN O=C(c1ccccc1OC[C@@H]1CCCO1)N1CCCN(CCCc2ccccc2)CC1 ZINC000507150151 915891364 /nfs/dbraw/zinc/89/13/64/915891364.db2.gz ORAWOHWAIGYYIQ-QHCPKHFHSA-N 0 3 422.569 4.025 20 0 HIADHN O=C(c1cnn(-c2cccc(Cl)c2)c1)N1CCCN(CCCc2ccccc2)CC1 ZINC000507155913 915895707 /nfs/dbraw/zinc/89/57/07/915895707.db2.gz ILKXRTGJPYHOKJ-UHFFFAOYSA-N 0 3 422.960 4.306 20 0 HIADHN C/C=C\c1ccc(OC[C@@H](O)CN2CCC(Nc3ccc(F)cc3)CC2)c(OC)c1 ZINC000507220388 915974105 /nfs/dbraw/zinc/97/41/05/915974105.db2.gz WHTASVLFJNVGPC-BNOLWBGWSA-N 0 3 414.521 4.184 20 0 HIADHN COc1ccc2cc(CN(C)C(=O)[C@H](C)N[C@H](C)c3ccc4n[nH]cc4c3)ccc2c1 ZINC000507268319 916031202 /nfs/dbraw/zinc/03/12/02/916031202.db2.gz QGSFWDRTHFXOOI-SJORKVTESA-N 0 3 416.525 4.422 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N[C@H](c2nccs2)c2ccccc2)C1 ZINC000507334673 916091064 /nfs/dbraw/zinc/09/10/64/916091064.db2.gz RGPVMCUYKSNHGF-UIFIKXQLSA-N 0 3 406.555 4.367 20 0 HIADHN CN1CCC[C@H](CNC(=O)c2cc(C3CC3)no2)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000507356664 916109994 /nfs/dbraw/zinc/10/99/94/916109994.db2.gz HOSDCVXERHDQCR-BEFAXECRSA-N 0 3 407.436 4.384 20 0 HIADHN CCOC(=O)c1ccc(N2CCCN([C@@H](C)c3ccc(OC(F)F)cc3)CC2)nc1 ZINC000507382227 916141197 /nfs/dbraw/zinc/14/11/97/916141197.db2.gz PTFXHTFSHKHBPX-INIZCTEOSA-N 0 3 419.472 4.133 20 0 HIADHN COCCSc1ccc([C@H](C)N[C@H](C)C(=O)NCc2ccc(Cl)cc2)cc1 ZINC000507465914 916234361 /nfs/dbraw/zinc/23/43/61/916234361.db2.gz RDSPKUWRHNXKJU-JKSUJKDBSA-N 0 3 406.979 4.434 20 0 HIADHN CN(Cc1ccccc1-c1ccnn1C)[C@H]1c2cc(Cl)cc(Cl)c2C[C@@H]1O ZINC000507531049 916289963 /nfs/dbraw/zinc/28/99/63/916289963.db2.gz LUGKTILNEQQSQO-SFTDATJTSA-N 0 3 402.325 4.484 20 0 HIADHN CCSc1ccc([C@H](C)N[C@@H](C)C(=O)NCc2ccc(OC)c(OC)c2)cc1 ZINC000507537915 916294579 /nfs/dbraw/zinc/29/45/79/916294579.db2.gz SSJIUTWFQHAXKF-HOTGVXAUSA-N 0 3 402.560 4.171 20 0 HIADHN CN1CCC[C@H](CNC(=O)c2csc(-c3ncccc3F)n2)[C@H]1c1cccs1 ZINC000507545355 916302214 /nfs/dbraw/zinc/30/22/14/916302214.db2.gz FJOIEQBBRSLKSG-ACJLOTCBSA-N 0 3 416.547 4.219 20 0 HIADHN CCCN(CC(=O)Nc1ccc2c(c1)CCC2)C1CCN(C(=O)c2ccccc2)CC1 ZINC000507577465 916330735 /nfs/dbraw/zinc/33/07/35/916330735.db2.gz ITBBTMWGNXWJHI-UHFFFAOYSA-N 0 3 419.569 4.131 20 0 HIADHN CCCN(Cc1nnc(-c2ccccc2)o1)C1CCN(C(=O)c2ccccc2)CC1 ZINC000507578716 916333008 /nfs/dbraw/zinc/33/30/08/916333008.db2.gz QUUCTKZDLISTIA-UHFFFAOYSA-N 0 3 404.514 4.253 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)c2nn(-c3ccc(F)cc3)c3c2CCC3)C1 ZINC000507606399 916363110 /nfs/dbraw/zinc/36/31/10/916363110.db2.gz POMNNYZXUPNLCW-XLIONFOSSA-N 0 3 418.516 4.065 20 0 HIADHN C[C@@H](N[C@H]1CCc2nnc(-c3ccc(F)cc3)n2C1)c1nc2ccc(Cl)cc2n1C ZINC000507609999 916367632 /nfs/dbraw/zinc/36/76/32/916367632.db2.gz GULZWSBQABEKEV-DYVFJYSZSA-N 0 3 424.911 4.290 20 0 HIADHN CCCc1c(C(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)cnn1Cc1ccccc1 ZINC000507615231 916373039 /nfs/dbraw/zinc/37/30/39/916373039.db2.gz YAZUIOVFHTVKDS-OFNKIYASSA-N 0 3 416.569 4.449 20 0 HIADHN CC[C@@H]1C[C@@H](CN2CCN(Cc3csc(-c4ccc(OC)cc4)n3)CC2)CCO1 ZINC000507615847 916374114 /nfs/dbraw/zinc/37/41/14/916374114.db2.gz BNCFMPVXTJUOHR-GHTZIAJQSA-N 0 3 415.603 4.142 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)c2nn(-c3ccccc3F)c3c2CCC3)C1 ZINC000507619336 916378218 /nfs/dbraw/zinc/37/82/18/916378218.db2.gz GLEVHMWRXLTTFX-MJGOQNOKSA-N 0 3 418.516 4.065 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)Cn2c3ccccc3nc2C(F)(F)F)C1 ZINC000507628228 916387020 /nfs/dbraw/zinc/38/70/20/916387020.db2.gz DIWCJWGCHJEESW-DOTOQJQBSA-N 0 3 416.447 4.007 20 0 HIADHN C[C@@H](NC(=O)[C@@H](C)N(C)CCCc1cc(-c2ccccc2)n[nH]1)c1ccc(F)cc1 ZINC000507669102 916436529 /nfs/dbraw/zinc/43/65/29/916436529.db2.gz NISSTLMLURIJIY-QZTJIDSGSA-N 0 3 408.521 4.346 20 0 HIADHN COc1cc(CN(C)C[C@@H](O)COc2cccc(C(F)(F)F)c2)ccc1SC ZINC000507684207 916455390 /nfs/dbraw/zinc/45/53/90/916455390.db2.gz QTPKWQCEBLSYBF-MRXNPFEDSA-N 0 3 415.477 4.308 20 0 HIADHN COc1ccc(OC)c([C@H](C)NCCC(=O)Nc2ccc(Br)cc2)c1 ZINC000507726101 916520109 /nfs/dbraw/zinc/52/01/09/916520109.db2.gz NSKCWGHOYDIBRG-ZDUSSCGKSA-N 0 3 407.308 4.146 20 0 HIADHN CC[C@H]1C[C@H](C[N@H+](C)Cc2cccc([N-]S(=O)(=O)c3ccccc3)c2)CCO1 ZINC000507776617 916561167 /nfs/dbraw/zinc/56/11/67/916561167.db2.gz OCWCWTXLDXUVPG-CTNGQTDRSA-N 0 3 402.560 4.124 20 0 HIADHN CC[C@H]1C[C@H](C[N@@H+](C)Cc2cccc([N-]S(=O)(=O)c3ccccc3)c2)CCO1 ZINC000507776617 916561180 /nfs/dbraw/zinc/56/11/80/916561180.db2.gz OCWCWTXLDXUVPG-CTNGQTDRSA-N 0 3 402.560 4.124 20 0 HIADHN CC(C)[C@@H](CN[C@H](c1nccn1C)c1cccc(F)c1)N1CCc2ccccc2C1 ZINC000507812981 916607632 /nfs/dbraw/zinc/60/76/32/916607632.db2.gz IXQJOKOSBRDASH-RPWUZVMVSA-N 0 3 406.549 4.321 20 0 HIADHN Cc1cccc2ncc(CNCc3ccccc3-c3ccc(Cn4cncn4)cc3)n21 ZINC000507840004 916647615 /nfs/dbraw/zinc/64/76/15/916647615.db2.gz FHZPZYONVSSCSY-UHFFFAOYSA-N 0 3 408.509 4.239 20 0 HIADHN COc1ccc(CN[C@H]2CC(=O)N(C)[C@H]2c2ccc(Cl)cc2)cc1OC(F)F ZINC000507859110 916690459 /nfs/dbraw/zinc/69/04/59/916690459.db2.gz IGYCRURIBFIGHS-KXBFYZLASA-N 0 3 410.848 4.012 20 0 HIADHN CCCOc1ccc(CN2CCC(C(=O)Nc3ccc(C)cn3)CC2)cc1OCC ZINC000507985823 916829076 /nfs/dbraw/zinc/82/90/76/916829076.db2.gz PKDUHFHEBDBYFE-UHFFFAOYSA-N 0 3 411.546 4.428 20 0 HIADHN Cc1cccc(NC(=O)[C@@H]2CCCN(Cc3ccccc3OCc3ccccn3)C2)n1 ZINC000507998844 916839823 /nfs/dbraw/zinc/83/98/23/916839823.db2.gz NIAUOMVOYZOXQT-OAQYLSRUSA-N 0 3 416.525 4.215 20 0 HIADHN CSc1ccccc1[C@@H](C)NC(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000508062645 916886227 /nfs/dbraw/zinc/88/62/27/916886227.db2.gz HCSKAZZEVIUJFC-GUDVDZBRSA-N 0 3 419.635 4.390 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1cc(Br)ccc1F ZINC000508068414 916890848 /nfs/dbraw/zinc/89/08/48/916890848.db2.gz DPSPEQCVOIBSIA-UHFFFAOYSA-N 0 3 421.310 4.045 20 0 HIADHN O=C(COc1ccc2ccccc2c1)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000508073211 916895064 /nfs/dbraw/zinc/89/50/64/916895064.db2.gz VPKOPTZXNPDXAE-UHFFFAOYSA-N 0 3 404.510 4.062 20 0 HIADHN CC[C@H](CNC(=O)N[C@@H](c1nccs1)c1ccccc1)N1CCc2ccccc2C1 ZINC000508189852 917012199 /nfs/dbraw/zinc/01/21/99/917012199.db2.gz HTKYLQTZYBCEGO-FGZHOGPDSA-N 0 3 420.582 4.369 20 0 HIADHN O=C(NCCN1CCC2(CCCCC2)CC1)[C@@H](OC1CCOCC1)c1ccccc1 ZINC000508299858 917109737 /nfs/dbraw/zinc/10/97/37/917109737.db2.gz NBBFEQDKWICJEX-QHCPKHFHSA-N 0 3 414.590 4.086 20 0 HIADHN COc1ccc([C@H]2C[C@H](NC(=O)N(CCN(C)C)Cc3cccc(C)c3)C2)cc1F ZINC000508393073 917187780 /nfs/dbraw/zinc/18/77/80/917187780.db2.gz GQTNIYMPQNMCJF-MEMLXQNLSA-N 0 3 413.537 4.162 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cnc(COC)s1)c1ccc(C(F)(F)F)cc1 ZINC000508410511 917199147 /nfs/dbraw/zinc/19/91/47/917199147.db2.gz HIALCKJQXFJPDZ-HNNXBMFYSA-N 0 3 415.481 4.121 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)c1cccc(C(=O)Nc2ccccc2)c1 ZINC000508531834 917313994 /nfs/dbraw/zinc/31/39/94/917313994.db2.gz AWCOMQZHIVPTMT-UHFFFAOYSA-N 0 3 401.510 4.143 20 0 HIADHN COc1ccc([C@@H](CNC(=O)c2ccc(Cl)c3cccnc23)N2CCCC2)cc1 ZINC000508796033 917551831 /nfs/dbraw/zinc/55/18/31/917551831.db2.gz OYXMVHMYPUSPHU-OAQYLSRUSA-N 0 3 409.917 4.464 20 0 HIADHN C[C@H](NC(=O)N(C)CCCc1cc(-c2ccccc2)n[nH]1)[C@@H](c1ccccc1)N(C)C ZINC000508851808 917604702 /nfs/dbraw/zinc/60/47/02/917604702.db2.gz IBAWHCBLYBIEPH-CYFREDJKSA-N 0 3 419.573 4.342 20 0 HIADHN C[C@H](NC(=O)Nc1ccc(NC(=O)c2ccco2)cc1)[C@H](c1ccccc1)N(C)C ZINC000508865070 917619768 /nfs/dbraw/zinc/61/97/68/917619768.db2.gz NVSFNTBNNPPTRO-HRAATJIYSA-N 0 3 406.486 4.345 20 0 HIADHN C[C@H](NC(=O)N(C)Cc1cc(Br)cs1)[C@H](c1ccccc1)N(C)C ZINC000508875261 917628991 /nfs/dbraw/zinc/62/89/91/917628991.db2.gz BUVNMISVPXDXIL-SUMWQHHRSA-N 0 3 410.381 4.343 20 0 HIADHN COCCC[C@H](CNC(=O)N1CCN(C2CCCC2)CC1)c1ccc(Cl)cc1 ZINC000508889022 917644042 /nfs/dbraw/zinc/64/40/42/917644042.db2.gz DBTXMTRHTBDCHP-LJQANCHMSA-N 0 3 407.986 4.120 20 0 HIADHN COc1ccc(CN(C)C(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)cc1OC(F)F ZINC000508892326 917647795 /nfs/dbraw/zinc/64/77/95/917647795.db2.gz CGKXFQXIHGSMQI-MGPUTAFESA-N 0 3 421.488 4.129 20 0 HIADHN COC[C@H](c1ccc(Cl)cc1)N(C)C(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C ZINC000508899773 917654238 /nfs/dbraw/zinc/65/42/38/917654238.db2.gz QMDLKCKCYXTGRN-DQLDELGASA-N 0 3 403.954 4.360 20 0 HIADHN C[C@H](NC(=O)N(C)Cc1ccccc1Br)[C@@H](c1ccccc1)N(C)C ZINC000508898522 917654651 /nfs/dbraw/zinc/65/46/51/917654651.db2.gz LQVZAZCQWBIKCW-KXBFYZLASA-N 0 3 404.352 4.282 20 0 HIADHN C[C@H](NC(=O)N1CCO[C@H](c2ccc(F)cc2Cl)C1)[C@H](c1ccccc1)N(C)C ZINC000508907771 917663529 /nfs/dbraw/zinc/66/35/29/917663529.db2.gz QZGYLSWZVFKGCF-ONGXBYRLSA-N 0 3 419.928 4.253 20 0 HIADHN C[C@H](NC(=O)N1CCO[C@H](c2ccccc2Cl)C1)[C@H](c1ccccc1)N(C)C ZINC000508907752 917663927 /nfs/dbraw/zinc/66/39/27/917663927.db2.gz QWXBSPNDDBMGFX-ORYQWCPZSA-N 0 3 401.938 4.114 20 0 HIADHN C[C@H](NC(=O)N1CCO[C@H](c2ccc(F)c(Cl)c2)C1)[C@H](c1ccccc1)N(C)C ZINC000508925981 917684251 /nfs/dbraw/zinc/68/42/51/917684251.db2.gz UPVUOCAKJAFJAI-ONGXBYRLSA-N 0 3 419.928 4.253 20 0 HIADHN COc1ccc([C@H](C)NC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)cc1 ZINC000508996604 917749752 /nfs/dbraw/zinc/74/97/52/917749752.db2.gz ODJXHHYBJWUDEJ-KKSFZXQISA-N 0 3 406.448 4.327 20 0 HIADHN COc1ccc([C@H](C)NC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)cc1 ZINC000508996601 917750474 /nfs/dbraw/zinc/75/04/74/917750474.db2.gz ODJXHHYBJWUDEJ-HRAATJIYSA-N 0 3 406.448 4.327 20 0 HIADHN COc1c(C)cnc(CN2CCC(N(C)Cc3csc(C(C)C)n3)CC2)c1C ZINC000509056614 917806455 /nfs/dbraw/zinc/80/64/55/917806455.db2.gz OGVVAIPDRJLNNY-UHFFFAOYSA-N 0 3 402.608 4.383 20 0 HIADHN COC(=O)C[C@@](C)(NCC/C=C/c1ccc(Br)cc1)c1ccccn1 ZINC000509127799 917859576 /nfs/dbraw/zinc/85/95/76/917859576.db2.gz QLGPYTZUYZEWNP-WRSLSUIGSA-N 0 3 403.320 4.316 20 0 HIADHN COC(=O)C[C@](C)(NCC/C=C/c1ccc(Br)cc1)c1ccccn1 ZINC000509127795 917859872 /nfs/dbraw/zinc/85/98/72/917859872.db2.gz QLGPYTZUYZEWNP-BEGIUABZSA-N 0 3 403.320 4.316 20 0 HIADHN Fc1ccc([C@@H]2CN(CCCN3CCN(c4ccccc4)CC3)CCO2)c(Cl)c1 ZINC000509158682 917876717 /nfs/dbraw/zinc/87/67/17/917876717.db2.gz WZKNWWLMKHAQNV-QHCPKHFHSA-N 0 3 417.956 4.065 20 0 HIADHN O=C(Nc1ccc(Cl)cn1)C1CCN(Cc2c[nH]nc2-c2ccc(F)cc2)CC1 ZINC000509347928 918013322 /nfs/dbraw/zinc/01/33/22/918013322.db2.gz HHXTVKRKQXEQLS-UHFFFAOYSA-N 0 3 413.884 4.115 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1 ZINC000509348557 918014119 /nfs/dbraw/zinc/01/41/19/918014119.db2.gz RCOPORCZDQFYGD-UHFFFAOYSA-N 0 3 423.948 4.388 20 0 HIADHN O=C(Nc1ccc(Cl)cn1)C1CCN(Cc2cccc(OC(F)(F)F)c2)CC1 ZINC000509348443 918014165 /nfs/dbraw/zinc/01/41/65/918014165.db2.gz PHGRACKLDPEMEL-UHFFFAOYSA-N 0 3 413.827 4.484 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)N[C@H](c2nccs2)c2ccccc2)N(C)C)cc1 ZINC000509369778 918035594 /nfs/dbraw/zinc/03/55/94/918035594.db2.gz FQEOMIWLWURTME-RTWAWAEBSA-N 0 3 408.571 4.397 20 0 HIADHN O=C(Nc1ccc(Cl)cn1)[C@@H]1CCCN(Cc2ccc(Oc3cnccn3)cc2)C1 ZINC000509392681 918058537 /nfs/dbraw/zinc/05/85/37/918058537.db2.gz KTFFCAMGUXZTMQ-QGZVFWFLSA-N 0 3 423.904 4.168 20 0 HIADHN COc1cc2c(cc1F)CC[C@@H]2NCc1c(Cl)cccc1N1CCN(C)CC1 ZINC000509431521 918089690 /nfs/dbraw/zinc/08/96/90/918089690.db2.gz PVYNYADEEYEEAP-FQEVSTJZSA-N 0 3 403.929 4.017 20 0 HIADHN Cn1cc(-c2ccc(CN[C@H]3CCCN(c4ccccc4Cl)C3=O)s2)cn1 ZINC000509463610 918112823 /nfs/dbraw/zinc/11/28/23/918112823.db2.gz LZLPJVSOEUYQPV-KRWDZBQOSA-N 0 3 400.935 4.087 20 0 HIADHN O=C(Nc1cc(Cl)ccc1[O-])C1CC[NH+](Cc2c[nH]nc2-c2ccccc2)CC1 ZINC000509528682 918175561 /nfs/dbraw/zinc/17/55/61/918175561.db2.gz SVOUYRYJJJFBOV-UHFFFAOYSA-N 0 3 410.905 4.286 20 0 HIADHN COCCSc1ccc([C@H](C)NC(=O)N2CCN(CCC(C)(C)C)CC2)cc1 ZINC000509537764 918186433 /nfs/dbraw/zinc/18/64/33/918186433.db2.gz DMBGWTBOHKATNR-SFHVURJKSA-N 0 3 407.624 4.250 20 0 HIADHN COc1ccccc1NC(=O)C1CCN(Cc2cccc(OC(F)(F)F)c2)CC1 ZINC000509540941 918188819 /nfs/dbraw/zinc/18/88/19/918188819.db2.gz KFJUWOJAJWLNGA-UHFFFAOYSA-N 0 3 408.420 4.445 20 0 HIADHN C[C@@H]1CCCN(C(=O)C2CCN(Cc3ccc(OCc4cccnc4)cc3)CC2)C1 ZINC000509557778 918207294 /nfs/dbraw/zinc/20/72/94/918207294.db2.gz NHHLCSUTEKCRKA-HXUWFJFHSA-N 0 3 407.558 4.131 20 0 HIADHN C[C@H]1CCCN(C(=O)C2CCN(Cc3c[nH]nc3-c3ccc(Cl)cc3)CC2)C1 ZINC000509563613 918213201 /nfs/dbraw/zinc/21/32/01/918213201.db2.gz HQUXHBRSTFRTSF-INIZCTEOSA-N 0 3 400.954 4.201 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)N(C)Cc1cccc(OC(F)(F)F)c1)c1ccco1 ZINC000509568067 918218395 /nfs/dbraw/zinc/21/83/95/918218395.db2.gz KSUQKRKJBLTEBZ-RHSMWYFYSA-N 0 3 413.440 4.449 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)N(C)CCc1ccc(Br)cc1)c1ccco1 ZINC000509572216 918222026 /nfs/dbraw/zinc/22/20/26/918222026.db2.gz ULZXEDPGGPSJKP-CRAIPNDOSA-N 0 3 422.367 4.355 20 0 HIADHN COc1ccccc1NC(=O)C1CCN(Cc2ccccc2OCC(F)(F)F)CC1 ZINC000509583575 918232145 /nfs/dbraw/zinc/23/21/45/918232145.db2.gz LCIHWAZNHSBUNU-UHFFFAOYSA-N 0 3 422.447 4.487 20 0 HIADHN Cc1cc(-c2noc([C@@H](C)NCCCN3CCN(c4ccccc4)CC3)n2)ccc1F ZINC000509605176 918254371 /nfs/dbraw/zinc/25/43/71/918254371.db2.gz OWHKIYVIZKGVCT-LJQANCHMSA-N 0 3 423.536 4.047 20 0 HIADHN CC[C@H](NC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1)c1ccc(OC)c(OC)c1 ZINC000509613393 918261378 /nfs/dbraw/zinc/26/13/78/918261378.db2.gz LJWAYJXOKKQFBJ-SFTDATJTSA-N 0 3 411.546 4.071 20 0 HIADHN COc1ccc(OC)c(C(=O)N(CCN2CCCC2)Cc2ccc(Cl)cc2)c1 ZINC000509742750 918362359 /nfs/dbraw/zinc/36/23/59/918362359.db2.gz LUGAEQJDBUITGE-UHFFFAOYSA-N 0 3 402.922 4.095 20 0 HIADHN Cc1ccc(NC(=O)[C@H](NC(=O)c2ccccc2Cl)C(C)C)c(CN(C)C)c1 ZINC000509757710 918373476 /nfs/dbraw/zinc/37/34/76/918373476.db2.gz YYLHMYBPVQKTDZ-HXUWFJFHSA-N 0 3 401.938 4.103 20 0 HIADHN CC(C)(CNC(=O)N[C@@H](C[C@@H]1CCOC1)c1ccccc1)N1CCc2ccccc2C1 ZINC000509760730 918375554 /nfs/dbraw/zinc/37/55/54/918375554.db2.gz HITOAQIBEYWOQJ-RDPSFJRHSA-N 0 3 421.585 4.290 20 0 HIADHN COC(=O)[C@@H](C)CN(C)Cc1cccc(NC(=O)c2ccc(Cl)cc2Cl)c1 ZINC000509788410 918395036 /nfs/dbraw/zinc/39/50/36/918395036.db2.gz RDZILPMGRCJRCH-ZDUSSCGKSA-N 0 3 409.313 4.487 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)N(Cc3ccco3)C(C)C)CC2)c1 ZINC000509815312 918418579 /nfs/dbraw/zinc/41/85/79/918418579.db2.gz ZSJFRMVEGPAKBF-UHFFFAOYSA-N 0 3 412.578 4.110 20 0 HIADHN O=C(NCc1cc2ccccc2[nH]1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000509916922 918516693 /nfs/dbraw/zinc/51/66/93/918516693.db2.gz MHOQPVSYCKRONT-OAQYLSRUSA-N 0 3 401.432 4.239 20 0 HIADHN Cc1nc2c3ccccc3nn2c(C)c1CCC(=O)N(CC(C)C)C1CCN(C)CC1 ZINC000509933414 918532085 /nfs/dbraw/zinc/53/20/85/918532085.db2.gz ZLIYCJNIXAJEOV-UHFFFAOYSA-N 0 3 421.589 4.011 20 0 HIADHN COc1ccc(-c2ccncc2)cc1CN[C@H]1CCN(C(=O)Nc2ccccc2)C1 ZINC000509964499 918555808 /nfs/dbraw/zinc/55/58/08/918555808.db2.gz VANQXBJULKYMQO-QFIPXVFZSA-N 0 3 402.498 4.153 20 0 HIADHN COc1ccc2ccc(C(=O)NC3CC(N4CCC(C(F)(F)F)CC4)C3)cc2c1 ZINC000509983391 918570998 /nfs/dbraw/zinc/57/09/98/918570998.db2.gz QAFDVQWSEFNKEZ-UHFFFAOYSA-N 0 3 406.448 4.384 20 0 HIADHN CCOC(=O)C(C)(C)C1CCN(Cc2cccc(C(=O)NCc3ccco3)c2)CC1 ZINC000510106972 918670021 /nfs/dbraw/zinc/67/00/21/918670021.db2.gz WWPKFMMHQJWUSS-UHFFFAOYSA-N 0 3 412.530 4.011 20 0 HIADHN Cc1nc(-c2ccc(C)cc2NC(=O)CN2CCC[C@](C)(c3ccccc3)CC2)n[nH]1 ZINC000510161934 918713959 /nfs/dbraw/zinc/71/39/59/918713959.db2.gz XLABHBLWNUDXOP-VWLOTQADSA-N 0 3 417.557 4.471 20 0 HIADHN CN(C)C(=O)c1ccc(CN(C)CCCCCc2cc(-c3ccc(F)cc3)n[nH]2)[nH]1 ZINC000510178519 918729605 /nfs/dbraw/zinc/72/96/05/918729605.db2.gz YOHVPVVSOPHZRF-UHFFFAOYSA-N 0 3 411.525 4.091 20 0 HIADHN CCCN(CC(=O)N(c1ccccc1)C(C)C)C1CCN(c2cc(C)nc(C)n2)CC1 ZINC000510238255 918777218 /nfs/dbraw/zinc/77/72/18/918777218.db2.gz BXRKYQKNXOFOQF-UHFFFAOYSA-N 0 3 423.605 4.216 20 0 HIADHN CCCN(CC(=O)c1c(C)[nH]c2ccccc21)C1CCN(c2cc(C)nc(C)n2)CC1 ZINC000510240745 918778845 /nfs/dbraw/zinc/77/88/45/918778845.db2.gz HRNJLABAQUMJJN-UHFFFAOYSA-N 0 3 419.573 4.447 20 0 HIADHN CC(C)(C)c1csc(CNC(=O)[C@@H]2CN(Cc3ccccc3)CCC2(F)F)n1 ZINC000510315999 918825829 /nfs/dbraw/zinc/82/58/29/918825829.db2.gz TXHDBHVOIGKIGU-INIZCTEOSA-N 0 3 407.530 4.214 20 0 HIADHN CN(C)[C@@H](CNC(=O)Nc1ccc(C(=O)NCc2ccccc2)cc1)c1ccccc1 ZINC000510387218 918866895 /nfs/dbraw/zinc/86/68/95/918866895.db2.gz VHZLDNQDFPPQCB-QHCPKHFHSA-N 0 3 416.525 4.041 20 0 HIADHN C[C@@H](C(=O)N[C@H](Cn1cnc2ccccc21)c1ccc(F)cc1)N1CCCCCC1 ZINC000510390431 918869300 /nfs/dbraw/zinc/86/93/00/918869300.db2.gz XYBRSKNXDWCYEB-PGRDOPGGSA-N 0 3 408.521 4.297 20 0 HIADHN CC1CCN(C(=O)C2CCN(Cc3ccccc3OCc3ccncc3)CC2)CC1 ZINC000510408675 918879256 /nfs/dbraw/zinc/87/92/56/918879256.db2.gz BFBOGOYXCPGXBP-UHFFFAOYSA-N 0 3 407.558 4.131 20 0 HIADHN CC1CCN(C(=O)C2CCN(Cc3c[nH]nc3-c3ccc(Cl)cc3)CC2)CC1 ZINC000510421576 918887238 /nfs/dbraw/zinc/88/72/38/918887238.db2.gz LRQMEQLATXTTHT-UHFFFAOYSA-N 0 3 400.954 4.201 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)c(C)c1CN1CCC(CC(=O)N2CCCC2)CC1 ZINC000510485555 918937423 /nfs/dbraw/zinc/93/74/23/918937423.db2.gz NHUULIBKGWXQHZ-UHFFFAOYSA-N 0 3 414.981 4.367 20 0 HIADHN CC(C)(C)c1nn(Cc2ccccc2)cc1CN1CCC(CC(=O)N2CCCC2)CC1 ZINC000510492744 918940595 /nfs/dbraw/zinc/94/05/95/918940595.db2.gz SPBIPCYWQAIQAA-UHFFFAOYSA-N 0 3 422.617 4.453 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2CN2CCC(N3CCO[C@H](C)C3)CC2)o1 ZINC000510549208 918993998 /nfs/dbraw/zinc/99/39/98/918993998.db2.gz CHFWOYAEBPXGME-HXUWFJFHSA-N 0 3 420.557 4.126 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3CC[C@H](c4ccccc4C)C3)c(C)c2)CC1 ZINC000510596897 919039209 /nfs/dbraw/zinc/03/92/09/919039209.db2.gz APOVAKSBWAOJAI-NRFANRHFSA-N 0 3 406.574 4.467 20 0 HIADHN Cc1cc(Br)cc(C)c1N1CCC[C@H](N2CC[C@@]3(C2)CCCOC3)C1=O ZINC000510615527 919057746 /nfs/dbraw/zinc/05/77/46/919057746.db2.gz CHRCAXORIOVFDW-GHTZIAJQSA-N 0 3 421.379 4.064 20 0 HIADHN Cc1csc([C@@H](C)NC2CCC(NC(=O)COc3ccc(Cl)cc3)CC2)n1 ZINC000510631491 919073025 /nfs/dbraw/zinc/07/30/25/919073025.db2.gz FWWZPJHUPCTCNY-ODIFPOPNSA-N 0 3 407.967 4.262 20 0 HIADHN CN(Cc1c[nH]nc1-c1ccccc1F)C[C@@H](O)COc1ccccc1C(F)(F)F ZINC000510632694 919073727 /nfs/dbraw/zinc/07/37/27/919073727.db2.gz ICYUMTCNFHTJJG-OAHLLOKOSA-N 0 3 423.410 4.106 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1ccc(C(=O)NCC(C)C)cc1)c1ccsc1 ZINC000510678375 919117608 /nfs/dbraw/zinc/11/76/08/919117608.db2.gz CRHFQQGVUZGHCQ-FQEVSTJZSA-N 0 3 416.591 4.339 20 0 HIADHN C[C@@H](N[C@@H]1CCc2ccc(Br)cc21)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000510693371 919130166 /nfs/dbraw/zinc/13/01/66/919130166.db2.gz ANWWCWPQYUGWME-BFUOFWGJSA-N 0 3 423.376 4.038 20 0 HIADHN CCCC(=O)Nc1cccc(NC(=O)NC[C@@H](c2cccc(OC)c2)N2CCCC2)c1 ZINC000510701096 919139939 /nfs/dbraw/zinc/13/99/39/919139939.db2.gz KPYSCGICGDJCFG-QFIPXVFZSA-N 0 3 424.545 4.392 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)c1cccc2cccc(Br)c21 ZINC000510735056 919180095 /nfs/dbraw/zinc/18/00/95/919180095.db2.gz LYVIXQBYGOUBHM-UHFFFAOYSA-N 0 3 412.331 4.201 20 0 HIADHN O=C(Nc1ccccc1OC[C@H]1CCCCO1)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000510739431 919186979 /nfs/dbraw/zinc/18/69/79/919186979.db2.gz WZPIEQFWQKLZDC-FGZHOGPDSA-N 0 3 423.557 4.421 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)N1CCC(OCCc2ccccc2)CC1 ZINC000510803551 919277116 /nfs/dbraw/zinc/27/71/16/919277116.db2.gz KXQFTHHROSXPFZ-UHFFFAOYSA-N 0 3 406.526 4.358 20 0 HIADHN C[C@@H](NC(=O)c1ccc(COc2ccc(Br)cc2)o1)C1=CCN(C)CC1 ZINC000510805683 919278560 /nfs/dbraw/zinc/27/85/60/919278560.db2.gz ZDZQJNTVNKLTCC-CQSZACIVSA-N 0 3 419.319 4.001 20 0 HIADHN CCC1(C(=O)Nc2cc(CN(C)C)ccc2C)CCN(C(=O)c2ccccc2)CC1 ZINC000510814595 919290572 /nfs/dbraw/zinc/29/05/72/919290572.db2.gz PSSDOTWGAXJNMO-UHFFFAOYSA-N 0 3 407.558 4.328 20 0 HIADHN COc1cccc(Cc2nnc([N-]C(=O)c3oc4ccccc4c3C[NH+](C)C)s2)c1 ZINC000510844920 919329829 /nfs/dbraw/zinc/32/98/29/919329829.db2.gz BPXFXWPDSQIHMD-UHFFFAOYSA-N 0 3 422.510 4.198 20 0 HIADHN COc1ccc(C[C@H](NC(=O)[C@H](C)N2CCCCCC2)c2ccccc2)cc1OC ZINC000510860708 919351929 /nfs/dbraw/zinc/35/19/29/919351929.db2.gz CCCKQHNJTQSXGH-UGKGYDQZSA-N 0 3 410.558 4.368 20 0 HIADHN COc1ccc(CNC(=O)c2oc3ccccc3c2CN(C)C)c(C(F)(F)F)c1 ZINC000510882218 919378481 /nfs/dbraw/zinc/37/84/81/919378481.db2.gz RWNJQLWGPZSEFP-UHFFFAOYSA-N 0 3 406.404 4.452 20 0 HIADHN Brc1ccc(CN(CCCCC2CCOCC2)CCn2ccnc2)o1 ZINC000510907545 919408794 /nfs/dbraw/zinc/40/87/94/919408794.db2.gz XXRBCUHGNNZDBO-UHFFFAOYSA-N 0 3 410.356 4.338 20 0 HIADHN CC(C)(C)CCN1CCN(C(=O)Nc2ccccc2OC[C@H]2CCCCO2)CC1 ZINC000510921187 919432412 /nfs/dbraw/zinc/43/24/12/919432412.db2.gz XUYBYYRNLYGAGY-LJQANCHMSA-N 0 3 403.567 4.220 20 0 HIADHN O=C(CC(F)(F)F)NC[C@@H]1CCCN(CCCc2ccccc2Br)C1 ZINC000510919576 919433460 /nfs/dbraw/zinc/43/34/60/919433460.db2.gz JFHNUMPBILVRPW-AWEZNQCLSA-N 0 3 421.301 4.162 20 0 HIADHN COC[C@H](N[C@H]1CCN(C(=O)Nc2ccccc2)C1)c1cccc(C(F)(F)F)c1 ZINC000510970409 919517156 /nfs/dbraw/zinc/51/71/56/919517156.db2.gz VAFIJMLDOHJVGS-OALUTQOASA-N 0 3 407.436 4.289 20 0 HIADHN COc1cc(C(=O)N(CCN(C)C)Cc2ccc(F)cc2)cc(OC)c1C(C)C ZINC000511015345 919582711 /nfs/dbraw/zinc/58/27/11/919582711.db2.gz ZFDZSMPTZQACKJ-UHFFFAOYSA-N 0 3 402.510 4.170 20 0 HIADHN CCOC(=O)c1oc2c(c1C)[C@@H](N[C@H]1CCN(C(=O)Nc3ccccc3)C1)CCC2 ZINC000511028159 919602747 /nfs/dbraw/zinc/60/27/47/919602747.db2.gz FSQCPTJZJZMMPZ-ROUUACIJSA-N 0 3 411.502 4.038 20 0 HIADHN CCC(C)(C)NC(=O)c1ccc(NC(=O)NCCCN2CCc3ccccc3C2)cc1 ZINC000511038442 919622859 /nfs/dbraw/zinc/62/28/59/919622859.db2.gz QOYCJSIISQJGBI-UHFFFAOYSA-N 0 3 422.573 4.175 20 0 HIADHN O=C(COc1ccccc1)N1CC[C@H](N[C@@H]2CCSc3ccc(Cl)cc32)C1 ZINC000511045963 919634784 /nfs/dbraw/zinc/63/47/84/919634784.db2.gz JOODZRCPUMRFEF-QFBILLFUSA-N 0 3 402.947 4.146 20 0 HIADHN Cc1ccc(-n2nc(C(=O)N(CC(C)C)C3CCN(C)CC3)c3c2CCCC3)cc1 ZINC000511051199 919644103 /nfs/dbraw/zinc/64/41/03/919644103.db2.gz YRJSJLKGURGEKY-UHFFFAOYSA-N 0 3 408.590 4.252 20 0 HIADHN Cc1cccc2nc(CN3CCC[C@@H](c4cccc(C(F)(F)F)c4)C3)cc(=O)n12 ZINC000511110340 919720469 /nfs/dbraw/zinc/72/04/69/919720469.db2.gz QYFYYWZPJVJNHX-QGZVFWFLSA-N 0 3 401.432 4.401 20 0 HIADHN COCCCNC(=O)C1CCN(Cc2ccc(-c3ccc(C(F)(F)F)cc3)o2)CC1 ZINC000511127365 919740049 /nfs/dbraw/zinc/74/00/49/919740049.db2.gz SZOPRJZRFRBOIY-UHFFFAOYSA-N 0 3 424.463 4.330 20 0 HIADHN CCOc1ccc(NC(=O)c2ccc(NC(=O)N[C@H](C)C3=CCN(C)CC3)cc2)cc1 ZINC000511232440 919835873 /nfs/dbraw/zinc/83/58/73/919835873.db2.gz WMKXROBIIPAPPD-QGZVFWFLSA-N 0 3 422.529 4.110 20 0 HIADHN CC[C@H](C)n1ncc2c1nc(C)cc2C(=O)NC[C@H](CC)N1CCc2ccccc2C1 ZINC000511269014 919867131 /nfs/dbraw/zinc/86/71/31/919867131.db2.gz UAWFXPOTKTYGNE-RXVVDRJESA-N 0 3 419.573 4.277 20 0 HIADHN Cc1cc(CN(C)C(=O)N[C@H](C)C2=CCN(C)CC2)cc(C)c1OCC(F)(F)F ZINC000511294457 919889538 /nfs/dbraw/zinc/88/95/38/919889538.db2.gz RFTTZKHTLDTOKR-MRXNPFEDSA-N 0 3 413.484 4.036 20 0 HIADHN COc1ccc2c(c1)CN(C(=O)N[C@@H](C)C1=CCN(C)CC1)[C@@H](c1ccccc1)C2 ZINC000511296769 919893094 /nfs/dbraw/zinc/89/30/94/919893094.db2.gz ZHPHMEVOQDRLLL-MHECFPHRSA-N 0 3 405.542 4.155 20 0 HIADHN C[C@H]1CCCCN1C(=O)c1ccc(NC(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000511298828 919894618 /nfs/dbraw/zinc/89/46/18/919894618.db2.gz WQOPMELHXNOLMS-CVDCTZTESA-N 0 3 420.557 4.097 20 0 HIADHN Cc1noc(C)c1COc1ccc(CC(=O)N(CCN(C)C)C2CCCCC2)cc1 ZINC000511420168 920035291 /nfs/dbraw/zinc/03/52/91/920035291.db2.gz CUVBYPYJNOAWRM-UHFFFAOYSA-N 0 3 413.562 4.136 20 0 HIADHN Cc1nn(-c2ccc(Br)cc2)cc1CN1CCC(c2cn[nH]c2)CC1 ZINC000511486835 920093897 /nfs/dbraw/zinc/09/38/97/920093897.db2.gz ITFBYAIUABUQEX-UHFFFAOYSA-N 0 3 400.324 4.046 20 0 HIADHN O=C(N[C@H](CC(F)(F)F)c1ccc(F)cc1)N1CCN(C2CCCCC2)CC1 ZINC000511563153 920203856 /nfs/dbraw/zinc/20/38/56/920203856.db2.gz NLWPOXWQTZUJIC-GOSISDBHSA-N 0 3 401.448 4.479 20 0 HIADHN O=C(CN[C@@H](c1cccc(OC(F)(F)F)c1)C1CC1)Nc1ccc2c(c1)OCCO2 ZINC000511565323 920207085 /nfs/dbraw/zinc/20/70/85/920207085.db2.gz JVGCFVKPSQYCFN-HXUWFJFHSA-N 0 3 422.403 4.036 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)Nc1cccc(OCc2cccnc2)c1 ZINC000511583113 920227512 /nfs/dbraw/zinc/22/75/12/920227512.db2.gz XLGRIXOAHMINMS-UHFFFAOYSA-N 0 3 422.504 4.395 20 0 HIADHN CN(Cc1ccccc1)Cc1cccc(C(=O)NCCN2CCc3sccc3C2)c1 ZINC000511608774 920259127 /nfs/dbraw/zinc/25/91/27/920259127.db2.gz GJJPMMYDKQZMJG-UHFFFAOYSA-N 0 3 419.594 4.168 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)Nc2cccc(C(=O)N3CCCCC3)c2)N(C)C)cc1 ZINC000511624102 920281044 /nfs/dbraw/zinc/28/10/44/920281044.db2.gz BWEBZDWESJSVOX-HSZRJFAPSA-N 0 3 422.573 4.300 20 0 HIADHN COc1ccc(CN(C)C[C@H]2OCCc3ccccc32)cc1OCc1cccnc1 ZINC000511638615 920300283 /nfs/dbraw/zinc/30/02/83/920300283.db2.gz BBPOAOPOJCGFBY-RUZDIDTESA-N 0 3 404.510 4.415 20 0 HIADHN CCOc1cc(CN(C)C[C@@H]2CCCCO2)ccc1OCC(=O)Nc1ccccc1 ZINC000511656965 920322546 /nfs/dbraw/zinc/32/25/46/920322546.db2.gz PHUSGKUMRAGMFU-NRFANRHFSA-N 0 3 412.530 4.104 20 0 HIADHN O=C(CCN1CC[C@H](C(F)(F)F)[C@H](CO)C1)Nc1ccc(Oc2ccccc2)cc1 ZINC000511662841 920328019 /nfs/dbraw/zinc/32/80/19/920328019.db2.gz BVIHNEMWRIUCNR-JXFKEZNVSA-N 0 3 422.447 4.300 20 0 HIADHN OC[C@@H]1CN(CCSc2ccnc3cc(Cl)ccc32)CC[C@H]1C(F)(F)F ZINC000511667442 920334447 /nfs/dbraw/zinc/33/44/47/920334447.db2.gz ONCKULKYSCISTF-SWLSCSKDSA-N 0 3 404.885 4.473 20 0 HIADHN CC[C@H](C)n1ncc2c1nc(C)cc2C(=O)N[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000511677503 920341077 /nfs/dbraw/zinc/34/10/77/920341077.db2.gz MHKJMONIJREQKG-NSHGMRRFSA-N 0 3 405.546 4.276 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)c2ccc(OCc3ccccc3)nc2)C1 ZINC000511678276 920342729 /nfs/dbraw/zinc/34/27/29/920342729.db2.gz XROXSAWAOYFLLC-CVDCTZTESA-N 0 3 401.510 4.226 20 0 HIADHN COCc1ccsc1C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1c1ccccc1 ZINC000511730265 920396949 /nfs/dbraw/zinc/39/69/49/920396949.db2.gz GZHBOPDMCPPAAD-FCHUYYIVSA-N 0 3 406.551 4.293 20 0 HIADHN Cc1cc(C(=O)CN2C[C@H](c3ccccc3)[C@@H]3COCC[C@@H]32)c(C)n1Cc1ccco1 ZINC000511754848 920434772 /nfs/dbraw/zinc/43/47/72/920434772.db2.gz JRLMJKQZYLRIKQ-DSITVLBTSA-N 0 3 418.537 4.433 20 0 HIADHN Fc1ccccc1[C@H]1CC[C@@H](NCc2ncc(I)s2)C1 ZINC000511764349 920447505 /nfs/dbraw/zinc/44/75/05/920447505.db2.gz DULUCOTVRZBJDX-WDEREUQCSA-N 0 3 402.276 4.313 20 0 HIADHN CC(C)(C)[C@H](NC(=O)CN1C[C@H](c2ccccc2)[C@H]2COCC[C@@H]21)c1cccs1 ZINC000511765937 920452091 /nfs/dbraw/zinc/45/20/91/920452091.db2.gz YMMGCJZKVQVANQ-ISHFTEKXSA-N 0 3 412.599 4.456 20 0 HIADHN CCOc1ccccc1[C@H](CC)NC(=O)CN1C[C@H](c2ccccc2)[C@H]2COCC[C@H]21 ZINC000511779064 920468729 /nfs/dbraw/zinc/46/87/29/920468729.db2.gz DVLPMHFTMKKASZ-JLLPCOHGSA-N 0 3 422.569 4.157 20 0 HIADHN C[C@@H]1CCN(C(=O)CN2C[C@H](c3ccccc3)[C@H]3COCC[C@H]32)c2ccccc2S1 ZINC000511794271 920487531 /nfs/dbraw/zinc/48/75/31/920487531.db2.gz SKFORIQOPRNVCM-ZHHKINOHSA-N 0 3 422.594 4.408 20 0 HIADHN CN(C)C(=O)Cc1nc(CN[C@H]2CCC[C@@H]2c2cccc(C(F)(F)F)c2)cs1 ZINC000511804568 920499684 /nfs/dbraw/zinc/49/96/84/920499684.db2.gz DFDJIKRKFGCAAW-SJORKVTESA-N 0 3 411.493 4.219 20 0 HIADHN Cn1c(CN[C@@H]2CCC[C@@H]2c2cccc(C(F)(F)F)c2)nc2ccccc2c1=O ZINC000511806847 920503553 /nfs/dbraw/zinc/50/35/53/920503553.db2.gz BCRZZAJUBSKWBF-SJLPKXTDSA-N 0 3 401.432 4.378 20 0 HIADHN CCOC(=O)c1c(C)oc2nc(CN3C[C@H](c4ccccc4)[C@H]4CCC[C@H]43)nc(N)c21 ZINC000511821782 920518735 /nfs/dbraw/zinc/51/87/35/920518735.db2.gz FTLUPCJGTAVHBA-KZNAEPCWSA-N 0 3 420.513 4.058 20 0 HIADHN CCCN(CC)C(=O)c1ccc(C(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)cc1 ZINC000511828903 920530460 /nfs/dbraw/zinc/53/04/60/920530460.db2.gz GYVDQNPIQQAWRP-AUSIDOKSSA-N 0 3 407.558 4.124 20 0 HIADHN Cc1ccc2[nH]c3c(c2c1)C[C@@H](NCc1ncc(I)s1)CC3 ZINC000511906160 920643112 /nfs/dbraw/zinc/64/31/12/920643112.db2.gz IIFVEDCCQMKWPH-NSHDSACASA-N 0 3 423.323 4.185 20 0 HIADHN Cc1cc([C@@H](C)N[C@H]2CCCN(Cc3ccccn3)C2=O)sc1Br ZINC000511924661 920670249 /nfs/dbraw/zinc/67/02/49/920670249.db2.gz BDAGCJWHVHBOAP-HIFRSBDPSA-N 0 3 408.365 4.056 20 0 HIADHN CC(C)N1CC[C@@H](NCc2ncc(CN(C)C)s2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000511925356 920673632 /nfs/dbraw/zinc/67/36/32/920673632.db2.gz YBGXKVDRYLDDNY-UYAOXDASSA-N 0 3 410.990 4.311 20 0 HIADHN FC(F)(F)[C@@H]1CCC[C@H](CNCc2ncc(I)s2)C1 ZINC000512015925 920787572 /nfs/dbraw/zinc/78/75/72/920787572.db2.gz QNTGZAISYDSKSK-DTWKUNHWSA-N 0 3 404.239 4.206 20 0 HIADHN C[C@@H]1CN(C[C@H]2CCCN2CC2=Cc3cc(Cl)cc(Cl)c3OC2)C[C@H](C)O1 ZINC000512072352 920838977 /nfs/dbraw/zinc/83/89/77/920838977.db2.gz NKFVKUPSQVOSDJ-ZRGWGRIASA-N 0 3 411.373 4.343 20 0 HIADHN FC(F)(F)c1ccc(-n2cc(CNCCN3CCc4sccc4C3)cn2)cc1 ZINC000512082622 920846589 /nfs/dbraw/zinc/84/65/89/920846589.db2.gz GBDWHYDRZQTKAC-UHFFFAOYSA-N 0 3 406.477 4.101 20 0 HIADHN Cc1c([C@H](C)N[C@H](C)CC(=O)Nc2cc(C(F)(F)F)ccc2Cl)cnn1C ZINC000512097396 920857636 /nfs/dbraw/zinc/85/76/36/920857636.db2.gz DKTRBJHHHMQVSH-MNOVXSKESA-N 0 3 402.848 4.469 20 0 HIADHN Cc1c([C@@H](C)N[C@@H](C)CC(=O)Nc2cc(C(F)(F)F)ccc2Cl)cnn1C ZINC000512097398 920857859 /nfs/dbraw/zinc/85/78/59/920857859.db2.gz DKTRBJHHHMQVSH-WDEREUQCSA-N 0 3 402.848 4.469 20 0 HIADHN Cc1cc([C@@H](C)NCc2cccc(CS(C)(=O)=O)c2)sc1Br ZINC000512104129 920862787 /nfs/dbraw/zinc/86/27/87/920862787.db2.gz HKSRYGUCEHAYMO-GFCCVEGCSA-N 0 3 402.379 4.214 20 0 HIADHN CN(C)CCn1c(=O)oc2ccc(NC(=O)CCc3ccc(Cl)c(Cl)c3)cc21 ZINC000512114181 920868035 /nfs/dbraw/zinc/86/80/35/920868035.db2.gz UEOFZUJUHAEYKB-UHFFFAOYSA-N 0 3 422.312 4.034 20 0 HIADHN C[C@@H]1CSC[C@@H]1NCC(=O)N1N=C(c2cc3ccccc3o2)C[C@H]1c1ccco1 ZINC000512171843 920907887 /nfs/dbraw/zinc/90/78/87/920907887.db2.gz ZFFGVTHHSSGJAB-JLSDUUJJSA-N 0 3 409.511 4.045 20 0 HIADHN OCC[C@H](NC[C@@H](O)COCc1ccccc1Cl)c1ccc(Cl)c(Cl)c1 ZINC000512192808 920935448 /nfs/dbraw/zinc/93/54/48/920935448.db2.gz FLTBFHRJWMJCBV-BEFAXECRSA-N 0 3 418.748 4.238 20 0 HIADHN CN(CCOc1ccccc1Br)CCc1nc(-c2ccccc2)no1 ZINC000512229206 920981316 /nfs/dbraw/zinc/98/13/16/920981316.db2.gz QQCZAZKSSSVHFH-UHFFFAOYSA-N 0 3 402.292 4.052 20 0 HIADHN CCN(CC)C(=O)C1CCN(Cc2cccc(NC(=O)c3ccc(OC)cc3)c2)CC1 ZINC000512231196 920984092 /nfs/dbraw/zinc/98/40/92/920984092.db2.gz XEAMOVBGKAPVFI-UHFFFAOYSA-N 0 3 423.557 4.028 20 0 HIADHN FC(F)(F)c1ccc(CN2CC[C@H](NCc3cccc4c3OCCCO4)C2)cc1 ZINC000512244414 921000954 /nfs/dbraw/zinc/00/09/54/921000954.db2.gz POALRHFKAKBECQ-IBGZPJMESA-N 0 3 406.448 4.231 20 0 HIADHN C[C@H](NC(=O)CN(C)[C@@H]1CCc2ccccc2C1)c1ccc(Br)cc1 ZINC000512317901 921068086 /nfs/dbraw/zinc/06/80/86/921068086.db2.gz HBUWIJMPBWWXMH-MGPUTAFESA-N 0 3 401.348 4.116 20 0 HIADHN CCCOc1ccc(CN2CCC(C(=O)NCCc3cccs3)CC2)cc1OC ZINC000512350387 921096164 /nfs/dbraw/zinc/09/61/64/921096164.db2.gz NLBYIHBSXQYEGM-UHFFFAOYSA-N 0 3 416.587 4.116 20 0 HIADHN CCCOc1c(Br)cc(CN[C@H]2CCO[C@@H]2c2cccnc2)cc1OC ZINC000512354930 921100027 /nfs/dbraw/zinc/10/00/27/921100027.db2.gz NHRHFFCTEZBXIX-PKOBYXMFSA-N 0 3 421.335 4.261 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)c1ccc(C(F)(F)F)cn1 ZINC000513480412 921837162 /nfs/dbraw/zinc/83/71/62/921837162.db2.gz BVJLFKZQBQNNJA-UHFFFAOYSA-N 0 3 419.369 4.323 20 0 HIADHN C[C@@H](c1ccc(F)c(F)c1)N(C)C[C@@H](O)COc1ccc(Br)cc1 ZINC000513496859 921847029 /nfs/dbraw/zinc/84/70/29/921847029.db2.gz MHNYDMPBMUTNJG-SWLSCSKDSA-N 0 3 400.263 4.160 20 0 HIADHN Cn1ccnc1SCc1cccc(C(=O)NC[C@H]2CCCN2Cc2ccccc2)c1 ZINC000513568985 921901274 /nfs/dbraw/zinc/90/12/74/921901274.db2.gz WYVJEXZWIWTHOL-JOCHJYFZSA-N 0 3 420.582 4.107 20 0 HIADHN Cc1nc([C@H]2CCCOC2)sc1C(=O)N[C@H](CN(C)C)c1ccc(Cl)cc1 ZINC000513574365 921906886 /nfs/dbraw/zinc/90/68/86/921906886.db2.gz WIIBRTNFPOCHDC-DOTOQJQBSA-N 0 3 407.967 4.032 20 0 HIADHN Cc1cc(Cl)ccc1CN1CCN(C(=O)Nc2cccc(CN(C)C)c2)CC1 ZINC000513590604 921922129 /nfs/dbraw/zinc/92/21/29/921922129.db2.gz WVODEIKMUYWZDU-UHFFFAOYSA-N 0 3 400.954 4.060 20 0 HIADHN COc1ccccc1[C@@H]1CCN(C(=O)[C@H]2CN(Cc3ccccc3)CCC2(F)F)C1 ZINC000513596004 921926076 /nfs/dbraw/zinc/92/60/76/921926076.db2.gz VNLXOZJBWZPHHM-TZIWHRDSSA-N 0 3 414.496 4.169 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)c1ccc2c(c1)[nH]c(=O)n2C1CCCC1 ZINC000513599238 921929962 /nfs/dbraw/zinc/92/99/62/921929962.db2.gz XQHQQDOFYJHHJX-NRFANRHFSA-N 0 3 418.541 4.251 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)Cc1csc(-c2cccs2)n1 ZINC000513600111 921932729 /nfs/dbraw/zinc/93/27/29/921932729.db2.gz VBQMEYONZLXAGS-UHFFFAOYSA-N 0 3 413.612 4.437 20 0 HIADHN FC(F)Cn1cc(CN[C@@H](c2cccc(C(F)(F)F)c2)C2CCOCC2)cn1 ZINC000513632447 921958259 /nfs/dbraw/zinc/95/82/59/921958259.db2.gz CQJXQJBNQKQEHP-GOSISDBHSA-N 0 3 403.395 4.425 20 0 HIADHN c1cc(-c2nc3ccccc3s2)oc1CN1CCC[C@@H](c2nnc3n2CCC3)C1 ZINC000513660719 921982947 /nfs/dbraw/zinc/98/29/47/921982947.db2.gz KGNORZGYPDVOMN-OAHLLOKOSA-N 0 3 405.527 4.474 20 0 HIADHN COc1ccc([C@H](Cc2ccncc2)NCc2ccccc2N2CCOCC2)cc1 ZINC000513668366 921992112 /nfs/dbraw/zinc/99/21/12/921992112.db2.gz XMSCHGIFRFQPSA-DEOSSOPVSA-N 0 3 403.526 4.000 20 0 HIADHN c1ccc(CCCOc2cccc(CN3CCCN(c4cccnn4)CC3)c2)cc1 ZINC000513683026 922003775 /nfs/dbraw/zinc/00/37/75/922003775.db2.gz FHMWMXATVISMIK-UHFFFAOYSA-N 0 3 402.542 4.201 20 0 HIADHN COc1ccc([C@@H](C)NCc2cc(Br)c3c(c2)OCCO3)c(C)c1OC ZINC000513714035 922034208 /nfs/dbraw/zinc/03/42/08/922034208.db2.gz XCLQXRQGUIZNJN-CYBMUJFWSA-N 0 3 422.319 4.397 20 0 HIADHN CCN(Cc1cn(C)nc1-c1ccccc1Cl)Cc1ccc(C(=O)N(C)C)cc1 ZINC000513716592 922036046 /nfs/dbraw/zinc/03/60/46/922036046.db2.gz FACMDNDIJJUBPS-UHFFFAOYSA-N 0 3 410.949 4.464 20 0 HIADHN O=C1CCCN1C1CCN(Cc2cn(-c3ccccc3)nc2-c2ccccc2)CC1 ZINC000513742649 922063170 /nfs/dbraw/zinc/06/31/70/922063170.db2.gz ZWACEEVJJRDWMU-UHFFFAOYSA-N 0 3 400.526 4.126 20 0 HIADHN CC(C)(CCC(=O)Nc1ccccc1CN1CCC[C@@H](C(N)=O)C1)c1ccccc1 ZINC000513829002 922156281 /nfs/dbraw/zinc/15/62/81/922156281.db2.gz UIPYBYWJOZQJHY-HXUWFJFHSA-N 0 3 407.558 4.080 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1ccccc1Oc1ccncc1 ZINC000513839651 922167177 /nfs/dbraw/zinc/16/71/77/922167177.db2.gz OANDMNXDOKFCRS-UHFFFAOYSA-N 0 3 417.509 4.331 20 0 HIADHN O=C(c1cc(F)ccc1F)C1CCN(C[C@H]2CCN(C(=O)c3ccccc3)C2)CC1 ZINC000513882885 922211338 /nfs/dbraw/zinc/21/13/38/922211338.db2.gz RKBBKKWDOQWUMY-QGZVFWFLSA-N 0 3 412.480 4.022 20 0 HIADHN Cc1cc(NC(=O)C[C@H](C)c2c(C)noc2C)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000513932739 922253566 /nfs/dbraw/zinc/25/35/66/922253566.db2.gz AJFDSDRYYLUHLF-KKSFZXQISA-N 0 3 421.545 4.376 20 0 HIADHN Cc1n[nH]c(C)c1NC(=O)CN(Cc1ccc2c(c1)OCO2)[C@@H]1CCC[C@H](C)[C@H]1C ZINC000513958403 922276592 /nfs/dbraw/zinc/27/65/92/922276592.db2.gz QCKDPFDIASNNDJ-QMTMVMCOSA-N 0 3 412.534 4.021 20 0 HIADHN CN1CCN(Cc2ccc(CNC(=O)Nc3cccc(-c4cccs4)c3)cc2)CC1 ZINC000513970320 922289394 /nfs/dbraw/zinc/28/93/94/922289394.db2.gz NYODJFOYMWBBEP-UHFFFAOYSA-N 0 3 420.582 4.484 20 0 HIADHN CSc1cc2c(cc1NC(=O)NC[C@@H](c1ccccc1)N1CCCC1)OCCO2 ZINC000513973762 922292905 /nfs/dbraw/zinc/29/29/05/922292905.db2.gz CJQODAREMWXRSQ-SFHVURJKSA-N 0 3 413.543 4.138 20 0 HIADHN CN1CCC(Oc2ccc(NCc3ccccc3OCc3cccnc3)cn2)CC1 ZINC000514073415 922396878 /nfs/dbraw/zinc/39/68/78/922396878.db2.gz WLHISRCUNXUGJJ-UHFFFAOYSA-N 0 3 404.514 4.141 20 0 HIADHN Cn1cc(CN(CCc2ccccn2)Cc2ccc(F)cc2)c(-c2cccnc2)n1 ZINC000514083799 922406248 /nfs/dbraw/zinc/40/62/48/922406248.db2.gz MTFPRSYDZANANL-UHFFFAOYSA-N 0 3 401.489 4.261 20 0 HIADHN COc1cc(CN(C)CCC(=O)NC(c2ccccc2)c2ccccc2)cc(OC)c1 ZINC000514084513 922408379 /nfs/dbraw/zinc/40/83/79/922408379.db2.gz QJVLMWQUIOFPSZ-UHFFFAOYSA-N 0 3 418.537 4.432 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N[C@H](c2ccccc2)c2ccccn2)C1 ZINC000514168384 922506111 /nfs/dbraw/zinc/50/61/11/922506111.db2.gz XOGFMKCSUVXSBB-WNOPAQSVSA-N 0 3 400.526 4.306 20 0 HIADHN C[C@H](NC(=O)N(CCN(C)C)Cc1ccccn1)c1ccc(Oc2cccnc2)cc1 ZINC000514170851 922509177 /nfs/dbraw/zinc/50/91/77/922509177.db2.gz VIGCKAKCNBJPMW-IBGZPJMESA-N 0 3 419.529 4.103 20 0 HIADHN C[C@@H](Cc1ccc(O)cc1)NC(=O)NC[C@H](c1cccs1)N1CCC(C)CC1 ZINC000514183116 922521341 /nfs/dbraw/zinc/52/13/41/922521341.db2.gz RVLDAWRJPJTYNY-FXAWDEMLSA-N 0 3 401.576 4.157 20 0 HIADHN C[C@H](Cc1ccc(O)cc1)NC(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1 ZINC000514183118 922521580 /nfs/dbraw/zinc/52/15/80/922521580.db2.gz RVLDAWRJPJTYNY-XLIONFOSSA-N 0 3 401.576 4.157 20 0 HIADHN CC[C@@H]1C[C@H](CC(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)CCO1 ZINC000514196413 922535153 /nfs/dbraw/zinc/53/51/53/922535153.db2.gz YIGNYCBFIXBCMT-VQIMIIECSA-N 0 3 400.485 4.191 20 0 HIADHN CC(C)CC(=O)Nc1cccc(CNC(=O)N[C@@H](CN2CCCC2)c2ccccc2)c1 ZINC000514213730 922549724 /nfs/dbraw/zinc/54/97/24/922549724.db2.gz IHSJMHQTOCZIMZ-QHCPKHFHSA-N 0 3 422.573 4.308 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N[C@@H](C)COc1ccc(F)cc1F)c1ccsc1 ZINC000514221022 922554543 /nfs/dbraw/zinc/55/45/43/922554543.db2.gz FGUXMTFKOAPISU-KSSFIOAISA-N 0 3 411.518 4.176 20 0 HIADHN Cc1ccc([C@H]2CCCN2CC(=O)N2CCC[C@H]2c2ccc3c(c2)OCCO3)cc1 ZINC000514235951 922574824 /nfs/dbraw/zinc/57/48/24/922574824.db2.gz LJMJIRACZXEETJ-YADHBBJMSA-N 0 3 406.526 4.267 20 0 HIADHN Cc1nc(C(C)C)sc1[C@H](C)N(C)C(=O)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000514407093 922613632 /nfs/dbraw/zinc/61/36/32/922613632.db2.gz OCPOCCHISMXBPK-PKOBYXMFSA-N 0 3 400.592 4.402 20 0 HIADHN CC(C)(C)OC(=O)C[C@@H]1CCCN(C(=O)NC[C@@H](c2cccs2)N2CCCC2)C1 ZINC000514425135 922621475 /nfs/dbraw/zinc/62/14/75/922621475.db2.gz GRSUCYSBMQHMDR-ROUUACIJSA-N 0 3 421.607 4.038 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1nc(C(F)(F)F)cs1)c1cccc(OC)c1 ZINC000514503156 922654134 /nfs/dbraw/zinc/65/41/34/922654134.db2.gz SSXAEWPWNOBBKA-CQSZACIVSA-N 0 3 416.469 4.375 20 0 HIADHN COc1cc(NC(=O)NC[C@H](c2ccccc2)N2CCCC2)c(OC)cc1Cl ZINC000514508867 922660694 /nfs/dbraw/zinc/66/06/94/922660694.db2.gz MZZLYQPAPRJXOK-GOSISDBHSA-N 0 3 403.910 4.316 20 0 HIADHN CSc1ccc([C@H](CNC(=O)c2cc(C)n(-c3ccc(F)cc3)n2)N(C)C)cc1 ZINC000514629049 922730954 /nfs/dbraw/zinc/73/09/54/922730954.db2.gz LTLBRMKUWIIJNH-NRFANRHFSA-N 0 3 412.534 4.074 20 0 HIADHN CN(Cc1ccccc1N1CCCC1)C[C@H](O)COc1cc(Cl)ccc1Cl ZINC000514854897 922825743 /nfs/dbraw/zinc/82/57/43/922825743.db2.gz SCGJQIRLSAYVFS-SFHVURJKSA-N 0 3 409.357 4.465 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)Nc1ccc(Oc2cccnc2)nc1 ZINC000514956687 922852333 /nfs/dbraw/zinc/85/23/33/922852333.db2.gz RYZWFDGOQKQEKW-OAQYLSRUSA-N 0 3 403.486 4.228 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)c1cc2cc(Br)ccc2o1 ZINC000514957525 922852423 /nfs/dbraw/zinc/85/24/23/922852423.db2.gz ICEPIKAAUGSRLI-KRWDZBQOSA-N 0 3 415.287 4.014 20 0 HIADHN COc1ccc(OC(F)F)c(NC(=O)N[C@H]2CCN(Cc3ccccc3)[C@H]2C)c1 ZINC000514962149 922855463 /nfs/dbraw/zinc/85/54/63/922855463.db2.gz CQQACEIFFJSWBT-YOEHRIQHSA-N 0 3 405.445 4.081 20 0 HIADHN CSc1ccc([C@H](CNC(=O)[C@H](C)[C@@H]2OCCc3sccc32)N(C)C)cc1 ZINC000514967268 922857520 /nfs/dbraw/zinc/85/75/20/922857520.db2.gz YQICMASJPCGAQL-WNYOCNMUSA-N 0 3 404.601 4.139 20 0 HIADHN C[C@H]1C[C@H]1N1CCN(C(=O)c2cc(F)c(Br)cc2Cl)C[C@@H](C)C1 ZINC000515079671 922896533 /nfs/dbraw/zinc/89/65/33/922896533.db2.gz ACZKWBSGRCWEDU-XMZIXOGTSA-N 0 3 403.723 4.044 20 0 HIADHN COc1cccc([C@H](CNC(=O)Nc2cccc(NC(=O)C(C)C)c2)N2CCCC2)c1 ZINC000515120202 922933175 /nfs/dbraw/zinc/93/31/75/922933175.db2.gz DBUKRJNGYLQUOX-QFIPXVFZSA-N 0 3 424.545 4.248 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N3C[C@@H]4CCCCN4c4ccccc43)cc2)CC1 ZINC000515245124 923012424 /nfs/dbraw/zinc/01/24/24/923012424.db2.gz GEXDGJGWKKEOBJ-QHCPKHFHSA-N 0 3 418.585 4.236 20 0 HIADHN CN(C)[C@H](CNC(=O)N(C)CCCc1cc(-c2ccc(F)cc2)n[nH]1)c1ccccc1 ZINC000515295763 923039348 /nfs/dbraw/zinc/03/93/48/923039348.db2.gz FZCRIHSBPLPPFU-HSZRJFAPSA-N 0 3 423.536 4.093 20 0 HIADHN O=C(NCCN1CCCC1)c1ccc(NCc2ncc(-c3ccccc3)s2)cc1 ZINC000515314506 923043448 /nfs/dbraw/zinc/04/34/48/923043448.db2.gz BLGBXVJIDAXIND-UHFFFAOYSA-N 0 3 406.555 4.248 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCCN(c2ccccc2)CC1)c1ccsc1 ZINC000515529268 923157831 /nfs/dbraw/zinc/15/78/31/923157831.db2.gz WEVLMONRNLUMAH-OAQYLSRUSA-N 0 3 400.592 4.053 20 0 HIADHN CCN(CC)C(=O)c1cccc(NC(=O)CN2CCC[C@@H]2CCc2ccccc2)c1 ZINC000515553548 923172418 /nfs/dbraw/zinc/17/24/18/923172418.db2.gz DSRDWEDNKYFRGP-HSZRJFAPSA-N 0 3 407.558 4.204 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)Cc2cscc2Br)CC1 ZINC000515680788 923267185 /nfs/dbraw/zinc/26/71/85/923267185.db2.gz PTXSOOASAMQWAJ-UHFFFAOYSA-N 0 3 407.377 4.176 20 0 HIADHN Cc1ccc([C@@H](C)N[C@H](C)C(=O)Nc2ccc(I)cc2)cc1 ZINC000515715981 923298388 /nfs/dbraw/zinc/29/83/88/923298388.db2.gz ZGRRHOOXZMFBEL-ZIAGYGMSSA-N 0 3 408.283 4.277 20 0 HIADHN CC[C@@H](NC(=O)NC[C@@H](c1ccccc1)N1CCCC1)c1ccc2c(c1)OCCO2 ZINC000515865643 923399412 /nfs/dbraw/zinc/39/94/12/923399412.db2.gz QAHKFBUBDLRHLW-RTWAWAEBSA-N 0 3 409.530 4.045 20 0 HIADHN Cc1ccc(-n2ncc(C(=O)N3CCN([C@@H]4C[C@@H]4C)C[C@H](C)C3)c2C(F)(F)F)cc1 ZINC000515891521 923418202 /nfs/dbraw/zinc/41/82/02/923418202.db2.gz RPYHKWVCQYKJEI-TXPKVOOTSA-N 0 3 420.479 4.002 20 0 HIADHN CC1CCN([C@@H](CNC(=O)c2cccc(NC(=O)NC3CC3)c2)c2ccccc2)CC1 ZINC000515979978 923476242 /nfs/dbraw/zinc/47/62/42/923476242.db2.gz KNLPBJOAEUXDBX-QHCPKHFHSA-N 0 3 420.557 4.174 20 0 HIADHN CC[C@H](CNC(=O)N(C)CCCc1ccc(OC)cc1)N1CCc2ccccc2C1 ZINC000516150603 923577302 /nfs/dbraw/zinc/57/73/02/923577302.db2.gz SSZRHKUEDOWPGW-HSZRJFAPSA-N 0 3 409.574 4.106 20 0 HIADHN CCCC(=O)Nc1cccc(CNC(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)c1 ZINC000516163837 923581936 /nfs/dbraw/zinc/58/19/36/923581936.db2.gz ZXDJWFSBFFGALI-GCJKJVERSA-N 0 3 408.546 4.060 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)c2cc(Cl)c3c(c2)OCCCO3)C1 ZINC000516204880 923597834 /nfs/dbraw/zinc/59/78/34/923597834.db2.gz JYQRCZKYDQLDSH-CRAIPNDOSA-N 0 3 400.906 4.067 20 0 HIADHN C[C@H](CCc1ccco1)NC(=O)N(CCN(C)C)Cc1ccc(Br)cc1 ZINC000516235787 923620584 /nfs/dbraw/zinc/62/05/84/923620584.db2.gz TVWGJMPETHYCQI-MRXNPFEDSA-N 0 3 422.367 4.137 20 0 HIADHN Cc1ccc(C(=O)C2CCN(C(=O)N[C@H](C)CN3C[C@H](C)C[C@@H](C)C3)CC2)c(C)c1 ZINC000516242341 923623615 /nfs/dbraw/zinc/62/36/15/923623615.db2.gz FDMNNWHYXHEUJO-SFHLNBCPSA-N 0 3 413.606 4.274 20 0 HIADHN C[C@H](COc1ccccc1C(F)(F)F)NC(=O)c1cccc(CN2CCCC2)c1 ZINC000516270010 923637602 /nfs/dbraw/zinc/63/76/02/923637602.db2.gz JXECGDVZPXBJRD-MRXNPFEDSA-N 0 3 406.448 4.499 20 0 HIADHN CCCN(CC(=O)Nc1ccnn1Cc1cccs1)[C@@H]1CCc2ccccc2C1 ZINC000516299245 923652220 /nfs/dbraw/zinc/65/22/20/923652220.db2.gz SVBIACLYFZTMDA-HXUWFJFHSA-N 0 3 408.571 4.201 20 0 HIADHN CC[C@@H](N[C@H](C)c1ccc(OC)c(OC)c1C)c1ccccc1OCC(=O)N(C)C ZINC000516498487 923760793 /nfs/dbraw/zinc/76/07/93/923760793.db2.gz BJHGVPHINQNFMX-YLJYHZDGSA-N 0 3 414.546 4.281 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)c2ccccc2OCc2ccncc2)C1 ZINC000516623195 923820075 /nfs/dbraw/zinc/82/00/75/923820075.db2.gz XGTQWBCZICJQKG-KNQAVFIVSA-N 0 3 401.510 4.226 20 0 HIADHN Cc1cc(Sc2ccccc2)ccc1NC(=O)C(=O)N[C@@H](C)CN1CCCCC1 ZINC000516743774 923871374 /nfs/dbraw/zinc/87/13/74/923871374.db2.gz JMEZEJGLLKPVMK-SFHVURJKSA-N 0 3 411.571 4.075 20 0 HIADHN COc1ccc(Cl)cc1NCCC(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000516773980 923883705 /nfs/dbraw/zinc/88/37/05/923883705.db2.gz NNTTWMFUPGGSOI-KRWDZBQOSA-N 0 3 407.967 4.165 20 0 HIADHN CCOc1cc(C[NH2+]C[C@@H]2CCN(c3ccccc3)C2)cc(Br)c1[O-] ZINC000516989797 923954665 /nfs/dbraw/zinc/95/46/65/923954665.db2.gz LZCPYFQWZSEQLS-HNNXBMFYSA-N 0 3 405.336 4.170 20 0 HIADHN CC[C@H](c1ccccc1OC)N(C)C(=O)CCCN1CCN(c2ccccc2)CC1 ZINC000517256898 924063930 /nfs/dbraw/zinc/06/39/30/924063930.db2.gz OWETUPDEQGDZPI-HSZRJFAPSA-N 0 3 409.574 4.207 20 0 HIADHN COc1ccc([C@@H](Cc2ccccc2)NCC(=O)Nc2cc(C(C)(C)C)nn2C)cc1 ZINC000517441965 924189751 /nfs/dbraw/zinc/18/97/51/924189751.db2.gz LESDSYDVIKUMJY-OAQYLSRUSA-N 0 3 420.557 4.238 20 0 HIADHN Cc1nc(C)c(CCNC(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)s1 ZINC000517450589 924197896 /nfs/dbraw/zinc/19/78/96/924197896.db2.gz IULBYPJCIGAKGH-KRWDZBQOSA-N 0 3 406.621 4.136 20 0 HIADHN Cc1ccc(C(=O)C2CCN(C(=O)NCC(C)(C)N3CCC[C@H](C)C3)CC2)c(C)c1 ZINC000517589859 926699267 /nfs/dbraw/zinc/69/92/67/926699267.db2.gz CEVYRQSXCPIUKL-IBGZPJMESA-N 0 3 413.606 4.418 20 0 HIADHN C[C@H](C(=O)N1CCCCC1)N(C)CCCCCc1cc(-c2cccc(F)c2)n[nH]1 ZINC000517599216 926707942 /nfs/dbraw/zinc/70/79/42/926707942.db2.gz VUDHMXGLCTWFGV-GOSISDBHSA-N 0 3 400.542 4.261 20 0 HIADHN Cc1cc(N2CCCC2)ccc1NC(=O)CN[C@H](C)c1cccc(N2CCCC2)c1 ZINC000517602061 926711054 /nfs/dbraw/zinc/71/10/54/926711054.db2.gz DXSHTXDJLFEERT-HXUWFJFHSA-N 0 3 406.574 4.485 20 0 HIADHN COc1ccc(CN2CCC[C@@H](c3nc(C(F)(F)F)cn3C)C2)cc1OC(F)F ZINC000517625759 926733922 /nfs/dbraw/zinc/73/39/22/926733922.db2.gz LWBTXWJBLCWOKQ-CYBMUJFWSA-N 0 3 419.394 4.429 20 0 HIADHN Cc1cc(-c2cc(C(=O)N(C)[C@@H]3CCN(C4CC4)C3)c3c(C)noc3n2)c(C)s1 ZINC000517648666 926756162 /nfs/dbraw/zinc/75/61/62/926756162.db2.gz PUBXRUQWZXXWRG-MRXNPFEDSA-N 0 3 410.543 4.185 20 0 HIADHN CC[C@H](Sc1ccccc1)C(=O)NCc1ccc(CN2CCN(CC)CC2)cc1 ZINC000517663583 926770911 /nfs/dbraw/zinc/77/09/11/926770911.db2.gz HKMOODBBERMXKX-QHCPKHFHSA-N 0 3 411.615 4.011 20 0 HIADHN CC[C@@H](Sc1ccccc1)C(=O)NCc1ccc(CN2CCN(CC)CC2)cc1 ZINC000517663581 926771427 /nfs/dbraw/zinc/77/14/27/926771427.db2.gz HKMOODBBERMXKX-HSZRJFAPSA-N 0 3 411.615 4.011 20 0 HIADHN Cc1noc(C)c1COc1cc2ccccc2cc1C(=O)N(C)[C@H]1CCN(C2CC2)C1 ZINC000517692931 926796124 /nfs/dbraw/zinc/79/61/24/926796124.db2.gz VWXDIGAOQSLHFW-NRFANRHFSA-N 0 3 419.525 4.332 20 0 HIADHN CN(C(=O)[C@@H](Oc1ccc(F)cc1Cl)c1ccccc1)[C@H]1CCN(C2CC2)C1 ZINC000517697336 926800549 /nfs/dbraw/zinc/80/05/49/926800549.db2.gz ONRSCWKYDUXEMO-RXVVDRJESA-N 0 3 402.897 4.294 20 0 HIADHN c1nc(-c2ccncc2)sc1CN1CCC[C@H](c2nc(-c3ccccc3)n[nH]2)C1 ZINC000517726260 926815910 /nfs/dbraw/zinc/81/59/10/926815910.db2.gz FNKCCHRQRUBFNB-SFHVURJKSA-N 0 3 402.527 4.370 20 0 HIADHN CCC[C@@H](NC(=O)NCCCCN1CCN(C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000517773676 926830654 /nfs/dbraw/zinc/83/06/54/926830654.db2.gz UOJJPTXTRNMFPV-LJQANCHMSA-N 0 3 415.409 4.161 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccc(F)c2)C1)N(Cc1ccncc1)Cc1cccnc1 ZINC000517805533 926844376 /nfs/dbraw/zinc/84/43/76/926844376.db2.gz HIIYQUJCOCEXCU-HSZRJFAPSA-N 0 3 418.516 4.057 20 0 HIADHN CCN(C(=O)C(=O)Nc1cc(CN(C)C)ccc1OC)[C@H](C)c1cc2ccccc2o1 ZINC000517820698 926852099 /nfs/dbraw/zinc/85/20/99/926852099.db2.gz JZVBEIJHMHNMFD-MRXNPFEDSA-N 0 3 423.513 4.051 20 0 HIADHN CCN(C)C(=O)c1cccc(C(=O)N(CC)[C@@H]2CCN([C@H](C)c3ccccc3)C2)c1 ZINC000517823900 926853166 /nfs/dbraw/zinc/85/31/66/926853166.db2.gz JAUBHNLCYOCEAF-AUSIDOKSSA-N 0 3 407.558 4.076 20 0 HIADHN COCCN(CCN(C)C)C(=O)c1cc2sc(Nc3ccccc3C)nc2s1 ZINC000517874325 926871658 /nfs/dbraw/zinc/87/16/58/926871658.db2.gz YQUXMMFYYDWJCU-UHFFFAOYSA-N 0 3 418.588 4.060 20 0 HIADHN CCN(CC)[C@H](C(=O)NC1CCN(Cc2ccc(F)c(F)c2)CC1)c1ccccc1 ZINC000517882629 926873652 /nfs/dbraw/zinc/87/36/52/926873652.db2.gz PFZZIICYWWWHLS-QHCPKHFHSA-N 0 3 415.528 4.129 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCc1ncccc1C)c1ccc(C(F)(F)F)cc1 ZINC000517887343 926875294 /nfs/dbraw/zinc/87/52/94/926875294.db2.gz LEIVQFNUTGJQQK-IBGZPJMESA-N 0 3 408.468 4.291 20 0 HIADHN O=C(Nc1ccc2c(c1)OC1(CCCCC1)O2)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000517897234 926880452 /nfs/dbraw/zinc/88/04/52/926880452.db2.gz WTWCUBWUFOFEJG-LJQANCHMSA-N 0 3 407.514 4.364 20 0 HIADHN CC(C)Sc1ccc(Cl)cc1NC(=O)C(=O)NC[C@@H](C)N1CCC[C@@H](C)C1 ZINC000517951612 926900922 /nfs/dbraw/zinc/90/09/22/926900922.db2.gz YPNFWLRFPJPEBS-HUUCEWRRSA-N 0 3 411.999 4.016 20 0 HIADHN CCCN(C)CC(=O)NCCc1cn(-c2ccccc2)nc1-c1ccc(Cl)cc1 ZINC000518049142 926985855 /nfs/dbraw/zinc/98/58/55/926985855.db2.gz AHPCSMRKRATJNB-UHFFFAOYSA-N 0 3 410.949 4.193 20 0 HIADHN O=C(c1oc2ccccc2c1CSc1ncccn1)N1CC[C@@H](N2CCCCC2)C1 ZINC000518087180 927014197 /nfs/dbraw/zinc/01/41/97/927014197.db2.gz PRYUFPUFDLOEBN-QGZVFWFLSA-N 0 3 422.554 4.216 20 0 HIADHN COCCOc1ccc(NC(=O)NC[C@@H](c2cccs2)N2CCCC2)cc1Cl ZINC000518196406 927076717 /nfs/dbraw/zinc/07/67/17/927076717.db2.gz KLQFYHUUXSTVTA-KRWDZBQOSA-N 0 3 423.966 4.385 20 0 HIADHN CCCC[C@H](NCc1ccc2[nH]cnc2c1)C(=O)Nc1cccc(N2CCCC2)c1 ZINC000518277177 927135762 /nfs/dbraw/zinc/13/57/62/927135762.db2.gz JYECLHXGSNZVRB-QFIPXVFZSA-N 0 3 405.546 4.450 20 0 HIADHN CCCC[C@H](NCc1ccc2nc[nH]c2c1)C(=O)Nc1cccc(N2CCCC2)c1 ZINC000518277177 927135773 /nfs/dbraw/zinc/13/57/73/927135773.db2.gz JYECLHXGSNZVRB-QFIPXVFZSA-N 0 3 405.546 4.450 20 0 HIADHN COCCN(C)CCNC(=O)c1c2c(nc3ccccc31)/C(=C/c1cccs1)CC2 ZINC000518288824 927148111 /nfs/dbraw/zinc/14/81/11/927148111.db2.gz QZJRXNSSNMQEFQ-WUKNDPDISA-N 0 3 421.566 4.091 20 0 HIADHN C[C@@H](C(=O)NC1CCCC1)N(C)CCCCCc1cc(-c2ccc(F)cc2)n[nH]1 ZINC000518316704 927179924 /nfs/dbraw/zinc/17/99/24/927179924.db2.gz RCARBZIGYUWXEF-KRWDZBQOSA-N 0 3 400.542 4.308 20 0 HIADHN CCCC(=O)Nc1ccc(CNC(=O)[C@H](C)N2CCC(Cc3ccccc3)CC2)cc1 ZINC000518390375 927236528 /nfs/dbraw/zinc/23/65/28/927236528.db2.gz JIGLBAIRARWMFN-FQEVSTJZSA-N 0 3 421.585 4.385 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)NCc2ccc(N3CCCCCC3)nc2)C1 ZINC000518402452 927243479 /nfs/dbraw/zinc/24/34/79/927243479.db2.gz AYDLCCGCYKSGOQ-NFBKMPQASA-N 0 3 421.589 4.097 20 0 HIADHN COc1cc(C(=O)N(C)[C@H]2CN3CCC2CC3)ccc1OCc1ccc(Cl)cc1 ZINC000518434889 927268747 /nfs/dbraw/zinc/26/87/47/927268747.db2.gz URZOAECYOZHSCC-FQEVSTJZSA-N 0 3 414.933 4.094 20 0 HIADHN C[C@@H](c1cc(F)ccc1F)N(C)C(=O)CCCN1CCN(c2ccccc2)CC1 ZINC000518442972 927274452 /nfs/dbraw/zinc/27/44/52/927274452.db2.gz FWRWSYAIBDCXFR-SFHVURJKSA-N 0 3 401.501 4.087 20 0 HIADHN C[C@H]1CN([C@H](CNCC2=Cc3ccccc3OC2)c2c(F)cccc2Cl)CCO1 ZINC000518765549 927483325 /nfs/dbraw/zinc/48/33/25/927483325.db2.gz LMRGWGGIUNWTSK-HRAATJIYSA-N 0 3 416.924 4.307 20 0 HIADHN C[C@@H]1CCCCN1CCNC(=O)c1cccnc1Oc1ccc(Br)cc1 ZINC000518773375 927486355 /nfs/dbraw/zinc/48/63/55/927486355.db2.gz MROKATASBYHIQU-OAHLLOKOSA-N 0 3 418.335 4.241 20 0 HIADHN CC[C@H](C)Oc1ccc(NC(=O)N2CCC(CN3C[C@H](C)O[C@@H](C)C3)CC2)cc1 ZINC000518838331 927538172 /nfs/dbraw/zinc/53/81/72/927538172.db2.gz CUAGMTYFCKNKOK-FHWLQOOXSA-N 0 3 403.567 4.217 20 0 HIADHN O=C(Cc1csc(Cc2ccc(F)cc2)n1)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000518935176 927639930 /nfs/dbraw/zinc/63/99/30/927639930.db2.gz HMCVCQDUPFCKMV-QFIPXVFZSA-N 0 3 423.557 4.369 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)Nc2cccc(OC[C@@H]3CCCO3)c2)N(C)C)cc1 ZINC000519011331 927691605 /nfs/dbraw/zinc/69/16/05/927691605.db2.gz YHFUNRJRAFZTGX-XZOQPEGZSA-N 0 3 411.546 4.231 20 0 HIADHN COc1cc(CN(C)C(=O)N[C@H]2CCN(Cc3ccccc3)[C@H]2C)ccc1SC ZINC000519020276 927698300 /nfs/dbraw/zinc/69/83/00/927698300.db2.gz AFWOGNNVUDMITE-PXNSSMCTSA-N 0 3 413.587 4.222 20 0 HIADHN COc1ccc([C@H](Cc2ccc(F)cc2)N[C@@H](C)C(=O)NCCc2ccccc2)cc1 ZINC000519064327 927742695 /nfs/dbraw/zinc/74/26/95/927742695.db2.gz WCSMVBIRHIQBAI-DFBJGRDBSA-N 0 3 420.528 4.455 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)Cc2coc(-c3ccc(Cl)cc3)n2)C1 ZINC000519107818 927776288 /nfs/dbraw/zinc/77/62/88/927776288.db2.gz IKDQXFBAEBTTLL-JXFKEZNVSA-N 0 3 409.917 4.489 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N[C@H](c2ccc(F)cc2)[C@@H]2CCCO2)N(C)C)cc1 ZINC000519250874 927846723 /nfs/dbraw/zinc/84/67/23/927846723.db2.gz OALAAJDCAZDPDT-RJGXRXQPSA-N 0 3 413.537 4.210 20 0 HIADHN CC(C)N(Cc1ccccn1)C[C@H](O)COc1ccc(Cl)cc1Br ZINC000519284251 927863293 /nfs/dbraw/zinc/86/32/93/927863293.db2.gz LGNITVRZLWZTSN-INIZCTEOSA-N 0 3 413.743 4.148 20 0 HIADHN CCOc1cccc2cc([C@H](C)N[C@@H]3CCCc4cc(S(N)(=O)=O)ccc43)oc21 ZINC000519306072 927873844 /nfs/dbraw/zinc/87/38/44/927873844.db2.gz YFJAPNHASZERFJ-IFXJQAMLSA-N 0 3 414.527 4.207 20 0 HIADHN CCCOc1ccc(CNC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)cc1OC ZINC000519362179 927896996 /nfs/dbraw/zinc/89/69/96/927896996.db2.gz UVRIPDAFEPBZSZ-FQEVSTJZSA-N 0 3 414.521 4.152 20 0 HIADHN CCCO[C@H]1CCCN(C(=O)NC[C@H](c2cccc(OC)c2)N(CC)CC)CC1 ZINC000519452279 927959575 /nfs/dbraw/zinc/95/95/75/927959575.db2.gz WVDRJDAFYZUADP-RBBKRZOGSA-N 0 3 405.583 4.069 20 0 HIADHN CC(C)Oc1cccc([C@@H](C)NC(=O)N(CCN(C)C)Cc2cccc(F)c2)c1 ZINC000519507247 927999794 /nfs/dbraw/zinc/99/97/94/927999794.db2.gz UCKFUUXYCFEFTL-GOSISDBHSA-N 0 3 401.526 4.447 20 0 HIADHN CCOCCOc1c(Cl)cccc1NC(=O)NC[C@@H](c1ccc(C)cc1)N(C)C ZINC000519512581 928004073 /nfs/dbraw/zinc/00/40/73/928004073.db2.gz ZGXVOESFQHXRNL-FQEVSTJZSA-N 0 3 419.953 4.488 20 0 HIADHN Cc1c(NC(=O)N[C@H]2CCN(Cc3ccccc3)[C@H]2C)cnn1-c1ccccc1F ZINC000519551873 928011714 /nfs/dbraw/zinc/01/17/14/928011714.db2.gz CSJGWTAJPHQPAY-JXFKEZNVSA-N 0 3 407.493 4.104 20 0 HIADHN CN(C)C[C@H](NC(=O)CCNC(=O)c1ccc2ccccc2c1)c1ccc(Cl)cc1 ZINC000519710338 928054048 /nfs/dbraw/zinc/05/40/48/928054048.db2.gz LKMZUPCATXNTBE-QFIPXVFZSA-N 0 3 423.944 4.032 20 0 HIADHN C[C@@H](NC(=O)C(C)(C)c1csc(-c2cc(F)ccc2F)n1)C1=CCN(C)CC1 ZINC000519760762 928067785 /nfs/dbraw/zinc/06/77/85/928067785.db2.gz COPHXRKXSXDASD-CYBMUJFWSA-N 0 3 405.514 4.133 20 0 HIADHN CCOCC(C)(C)CN[C@@H](c1ccc(CC)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000519772819 928069344 /nfs/dbraw/zinc/06/93/44/928069344.db2.gz ALKHTNFQTPJVAQ-QFIPXVFZSA-N 0 3 403.588 4.394 20 0 HIADHN Cc1noc(C)c1COc1ccccc1C(=O)N[C@H]1CCN(Cc2ccccc2)[C@H]1C ZINC000519787448 928075191 /nfs/dbraw/zinc/07/51/91/928075191.db2.gz FHRNSUHSQFMAJQ-MBSDFSHPSA-N 0 3 419.525 4.263 20 0 HIADHN COc1ccc(OC)c(CN(C(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)C2CC2)c1 ZINC000519810995 928083772 /nfs/dbraw/zinc/08/37/72/928083772.db2.gz GABZLBJKWVHXFQ-RXVVDRJESA-N 0 3 423.557 4.213 20 0 HIADHN COCCO[C@H]1CCCN(Cc2cn(-c3ccccc3)nc2-c2ccc(OC)cc2)C1 ZINC000519834394 928087792 /nfs/dbraw/zinc/08/77/92/928087792.db2.gz GPZASYJIEQWMDY-DEOSSOPVSA-N 0 3 421.541 4.175 20 0 HIADHN C[C@H](N[C@@H](Cc1ccccc1Cl)c1ccccc1)C(=O)Nc1ccc(C(N)=O)cc1 ZINC000519876126 928111213 /nfs/dbraw/zinc/11/12/13/928111213.db2.gz WDSOPOGLQXDDCD-AOMKIAJQSA-N 0 3 421.928 4.340 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N(Cc3ccco3)Cc3cccnc3)cc2)CC1 ZINC000519930650 928165134 /nfs/dbraw/zinc/16/51/34/928165134.db2.gz HWMZZTQRVCYGDK-UHFFFAOYSA-N 0 3 418.541 4.048 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)Nc1cccc(OC[C@H]2CCCO2)c1 ZINC000519971952 928199511 /nfs/dbraw/zinc/19/95/11/928199511.db2.gz ITLIJLFLDRPNIK-PKTZIBPZSA-N 0 3 409.530 4.203 20 0 HIADHN CC[C@@H](C)NC(=O)c1ccc(NC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)c(C)c1 ZINC000519988324 928215102 /nfs/dbraw/zinc/21/51/02/928215102.db2.gz NJMPHHWUOJIJJR-DENIHFKCSA-N 0 3 422.573 4.309 20 0 HIADHN CCOc1cc2c(cc1NC(=O)NC[C@H](c1cccs1)N1CCCC1)O[C@H](C)C2 ZINC000520048879 928273756 /nfs/dbraw/zinc/27/37/56/928273756.db2.gz XIMJKQHDZLRYDG-CRAIPNDOSA-N 0 3 415.559 4.429 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)NCc1ccc(Oc2cccc(F)c2)nc1 ZINC000520052749 928276888 /nfs/dbraw/zinc/27/68/88/928276888.db2.gz ZLQYLVSJQYASAK-UHFFFAOYSA-N 0 3 422.504 4.286 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)NC[C@H]1CCCO[C@@H]1c1ccccc1 ZINC000520058268 928283571 /nfs/dbraw/zinc/28/35/71/928283571.db2.gz XLWWUVCCLZHZDV-JWQCQUIFSA-N 0 3 423.601 4.360 20 0 HIADHN C[C@@H](Oc1ccc(C(=O)N(CCN(C)C)Cc2ccccc2)cn1)c1ccccc1 ZINC000520106497 928315175 /nfs/dbraw/zinc/31/51/75/928315175.db2.gz XDWCAGIAIVKSGN-HXUWFJFHSA-N 0 3 403.526 4.426 20 0 HIADHN CCOc1cc2c(cc1NC(=O)[C@H]1CCCN(Cc3cccc(F)c3)C1)O[C@H](C)C2 ZINC000520106904 928315693 /nfs/dbraw/zinc/31/56/93/928315693.db2.gz RNPMVJUTEPPQOP-AEFFLSMTSA-N 0 3 412.505 4.399 20 0 HIADHN CC(=O)Nc1ccc(OC[C@H](O)CN2CC=C(c3cccc4ccccc43)CC2)cc1 ZINC000520170635 928360059 /nfs/dbraw/zinc/36/00/59/928360059.db2.gz HDTDTQFDYMHTPL-HSZRJFAPSA-N 0 3 416.521 4.327 20 0 HIADHN CCN(C(=O)NCC1(N2CCSCC2)CCCC1)[C@@H](C)Cc1ccc(OC)cc1 ZINC000520197802 928383696 /nfs/dbraw/zinc/38/36/96/928383696.db2.gz PPGLJJWMJCVBOX-IBGZPJMESA-N 0 3 419.635 4.019 20 0 HIADHN O=C(C[C@H]1C=CCC1)Nc1ccccc1NC(=O)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000520272192 928437441 /nfs/dbraw/zinc/43/74/41/928437441.db2.gz PTZSIWAWMKGANZ-FPOVZHCZSA-N 0 3 418.541 4.227 20 0 HIADHN COc1ccccc1CCNC(=O)CNC/C(C)=C\c1cccc(C(F)(F)F)c1 ZINC000520280196 928442506 /nfs/dbraw/zinc/44/25/06/928442506.db2.gz POKDSIKMQSPVHE-VBKFSLOCSA-N 0 3 406.448 4.066 20 0 HIADHN CCn1c2ccccc2nc1[C@@H](C)NC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000520309788 928471705 /nfs/dbraw/zinc/47/17/05/928471705.db2.gz QALHAARRCRLNPU-MJGOQNOKSA-N 0 3 408.521 4.285 20 0 HIADHN O=S(=O)([N-]CCCCC[NH+]1CCCCC1)c1cc(Br)ccc1Cl ZINC000520387468 928540091 /nfs/dbraw/zinc/54/00/91/928540091.db2.gz PKNIBKFPOFOVEW-UHFFFAOYSA-N 0 3 423.804 4.037 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cncnc1C(C)C)c1ccc(C(F)(F)F)cc1 ZINC000520446435 928570392 /nfs/dbraw/zinc/57/03/92/928570392.db2.gz AMJWLKBWELGKPW-SFHVURJKSA-N 0 3 408.468 4.432 20 0 HIADHN Cc1cc(NC(=O)Nc2ccc(-c3ncon3)cc2)cc(N2CCN(C(C)C)CC2)c1 ZINC000520557371 928639987 /nfs/dbraw/zinc/63/99/87/928639987.db2.gz MGEJARXEMZTQAD-UHFFFAOYSA-N 0 3 420.517 4.219 20 0 HIADHN CN1CCN(CCCNC(=O)N(Cc2ccco2)C2CCCC2)[C@H](c2ccccc2)C1 ZINC000520622075 928679314 /nfs/dbraw/zinc/67/93/14/928679314.db2.gz WMSACEHHLVIZPF-DEOSSOPVSA-N 0 3 424.589 4.113 20 0 HIADHN CCCCOc1ccccc1NC(=O)N(C)C1CCN(CCc2ccccn2)CC1 ZINC000520668889 928712511 /nfs/dbraw/zinc/71/25/11/928712511.db2.gz IUZRNTAUPDKMDV-UHFFFAOYSA-N 0 3 410.562 4.431 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)N[C@@H](c1ccc(F)cc1)[C@H]1CCCO1 ZINC000520816048 928831325 /nfs/dbraw/zinc/83/13/25/928831325.db2.gz LBJCATJIYUISQK-ZLNRFVROSA-N 0 3 411.521 4.182 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)Nc1ccc(-c2csnn2)cc1 ZINC000520823307 928833362 /nfs/dbraw/zinc/83/33/62/928833362.db2.gz ZEZRIBZHBWNHLO-UHFFFAOYSA-N 0 3 409.559 4.233 20 0 HIADHN CCCO[C@H]1CCCN(C(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)CC1 ZINC000520825122 928834651 /nfs/dbraw/zinc/83/46/51/928834651.db2.gz XWAQUINOKSXQDO-FPOVZHCZSA-N 0 3 412.496 4.249 20 0 HIADHN Cc1ccc(Cc2nnc(NC(=O)NC[C@@H](c3ccccc3)N3CCCC3)s2)cc1 ZINC000520858081 928847212 /nfs/dbraw/zinc/84/72/12/928847212.db2.gz LRCYAUPJPWNREL-FQEVSTJZSA-N 0 3 421.570 4.396 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)C3(c4cccc(OC)c4)CCCC3)cc2)CC1 ZINC000520865006 928850779 /nfs/dbraw/zinc/85/07/79/928850779.db2.gz ZDDJVBDLYNPEKS-UHFFFAOYSA-N 0 3 421.585 4.283 20 0 HIADHN C[C@@H](C(=O)N(CCN(C)C)Cc1ccc(Br)cc1)c1ccccc1F ZINC000520927269 928878594 /nfs/dbraw/zinc/87/85/94/928878594.db2.gz VYTIKCXYQZRQEL-OAHLLOKOSA-N 0 3 407.327 4.282 20 0 HIADHN CCCCc1oc2ccccc2c1CNCc1ccc([C@@]2(C)NC(=O)NC2=O)cc1 ZINC000520963542 928891773 /nfs/dbraw/zinc/89/17/73/928891773.db2.gz QJVZREIHRUMUHF-XMMPIXPASA-N 0 3 405.498 4.120 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)c1[nH]c2ccc(F)cc2c1Cl ZINC000520985549 928903544 /nfs/dbraw/zinc/90/35/44/928903544.db2.gz KUAQEUBAZUTIKZ-UHFFFAOYSA-N 0 3 409.839 4.443 20 0 HIADHN NC(=O)c1cccc(Oc2ccc(NC(=O)c3cccc(CN4CCCC4)c3)cc2)c1 ZINC000521017432 928933916 /nfs/dbraw/zinc/93/39/16/928933916.db2.gz UWXFSAQMKPFAMW-UHFFFAOYSA-N 0 3 415.493 4.426 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)c1cc(Cl)c2c(c1)OCCCO2 ZINC000521051067 928962069 /nfs/dbraw/zinc/96/20/69/928962069.db2.gz UUNFRSLGKIYFPV-UHFFFAOYSA-N 0 3 416.949 4.138 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)N[C@@H](c1ccco1)c1ccccc1 ZINC000521061155 928968159 /nfs/dbraw/zinc/96/81/59/928968159.db2.gz SDMGVZBWUUVONN-JOCHJYFZSA-N 0 3 413.468 4.421 20 0 HIADHN CCOc1ccc([C@H](C)NC(=O)N(CCN(C)C)Cc2cccc(F)c2)cc1OC ZINC000521068860 928972113 /nfs/dbraw/zinc/97/21/13/928972113.db2.gz OIKDRDLBOXNJHT-KRWDZBQOSA-N 0 3 417.525 4.067 20 0 HIADHN O=C(NC[C@@H]1CCc2ccccc21)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000521082981 928980336 /nfs/dbraw/zinc/98/03/36/928980336.db2.gz KVRVTXDTMHBXTD-SIKLNZKXSA-N 0 3 402.460 4.287 20 0 HIADHN C[C@H](CNC(=O)c1cccc(-n2nccc2C(F)(F)F)c1)N(C)Cc1ccccc1 ZINC000521094652 928990248 /nfs/dbraw/zinc/99/02/48/928990248.db2.gz ARDSZFPSYWTDEV-MRXNPFEDSA-N 0 3 416.447 4.141 20 0 HIADHN Cc1cc(C(=O)N(CCN2CCCC2)Cc2ccc(Cl)cc2)nn1C(C)(C)C ZINC000521137571 929018425 /nfs/dbraw/zinc/01/84/25/929018425.db2.gz UPILJKSHFUXKST-UHFFFAOYSA-N 0 3 402.970 4.338 20 0 HIADHN CN(C)CCN(C(=O)c1cc2c(cc(Br)cc2F)[nH]1)c1ccccc1 ZINC000521182571 929047798 /nfs/dbraw/zinc/04/77/98/929047798.db2.gz LSNPGPAARCDETF-UHFFFAOYSA-N 0 3 404.283 4.278 20 0 HIADHN CCCN(CC(=O)NCC1(c2ccccc2)CCOCC1)[C@@H]1CCc2ccccc21 ZINC000521193723 929055024 /nfs/dbraw/zinc/05/50/24/929055024.db2.gz PNIMQUOSKDCNKT-XMMPIXPASA-N 0 3 406.570 4.251 20 0 HIADHN CCN1CCN(C(=O)CC2CCN(Cc3ccccc3Oc3ccccc3)CC2)CC1 ZINC000521305200 929114251 /nfs/dbraw/zinc/11/42/51/929114251.db2.gz MLCGUOMGCXPICV-UHFFFAOYSA-N 0 3 421.585 4.245 20 0 HIADHN CC[C@@H](CNC(=O)NCCCCN1CCN(c2ccccc2)CC1)c1ccccc1 ZINC000521413849 929209203 /nfs/dbraw/zinc/20/92/03/929209203.db2.gz WANPMXWAWTYCMY-QFIPXVFZSA-N 0 3 408.590 4.082 20 0 HIADHN CC[C@H](CNC(=O)NCCCCN1CCN(c2ccccc2)CC1)c1ccccc1 ZINC000521413848 929209997 /nfs/dbraw/zinc/20/99/97/929209997.db2.gz WANPMXWAWTYCMY-JOCHJYFZSA-N 0 3 408.590 4.082 20 0 HIADHN CN(C)[C@@H](CNC(=O)NCc1ccc(Br)cc1Cl)c1ccccc1 ZINC000521436608 929220900 /nfs/dbraw/zinc/22/09/00/929220900.db2.gz IDZWLQVPEHDLLT-KRWDZBQOSA-N 0 3 410.743 4.205 20 0 HIADHN Cc1cc(C(=O)N2CCCC[C@H]2C)ccc1NC(=O)NCCN(C)Cc1ccccc1 ZINC000521443646 929223826 /nfs/dbraw/zinc/22/38/26/929223826.db2.gz SRVXJHHAFLDQBE-HXUWFJFHSA-N 0 3 422.573 4.263 20 0 HIADHN Cc1nc(-c2cccc(NC(=O)N(CCCc3ccccc3)CCN(C)C)c2)no1 ZINC000521457279 929229429 /nfs/dbraw/zinc/22/94/29/929229429.db2.gz FUEZOLYTXQPMEQ-UHFFFAOYSA-N 0 3 407.518 4.073 20 0 HIADHN O=C(Cc1coc(-c2ccc(Cl)cc2)n1)NCCCN1CCc2ccccc2C1 ZINC000521468441 929235170 /nfs/dbraw/zinc/23/51/70/929235170.db2.gz ULYRNBWNZVDLJB-UHFFFAOYSA-N 0 3 409.917 4.102 20 0 HIADHN [O-]c1cc(F)cc(C[NH2+]C2(Cc3ccc(F)cc3Br)CCOCC2)c1 ZINC000521470295 929236450 /nfs/dbraw/zinc/23/64/50/929236450.db2.gz JAVLNZODQMTHMF-UHFFFAOYSA-N 0 3 412.274 4.314 20 0 HIADHN CCN(Cc1ccccc1NC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1)C(C)=O ZINC000521533102 929279165 /nfs/dbraw/zinc/27/91/65/929279165.db2.gz KWXCGXMQMSMILG-NRFANRHFSA-N 0 3 411.521 4.045 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)c1cncc2ccccc21 ZINC000521569507 929303082 /nfs/dbraw/zinc/30/30/82/929303082.db2.gz AVBCAUPEXUPGLL-UHFFFAOYSA-N 0 3 401.432 4.458 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)c1ccc(Oc2cccnc2)cc1 ZINC000521569949 929303139 /nfs/dbraw/zinc/30/31/39/929303139.db2.gz UKCXMHQYUPIUNX-UHFFFAOYSA-N 0 3 411.452 4.356 20 0 HIADHN Cc1cc(C(=O)N(CCN(C)C)Cc2cccc(Cl)c2)c(C)n1Cc1ccccn1 ZINC000521572804 929305695 /nfs/dbraw/zinc/30/56/95/929305695.db2.gz VXQTWIVLOZEHJQ-UHFFFAOYSA-N 0 3 424.976 4.406 20 0 HIADHN CN(C)CCN(C[C@@H]1CCCO1)C(=O)c1ccc(-c2ccc(OC(F)F)cc2)s1 ZINC000521618122 929331031 /nfs/dbraw/zinc/33/10/31/929331031.db2.gz MWSDXTVWCCPGBJ-KRWDZBQOSA-N 0 3 424.513 4.199 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)Nc1nc2c(s1)CCC2 ZINC000521681655 929362907 /nfs/dbraw/zinc/36/29/07/929362907.db2.gz BCCQOVBQMMOITL-UHFFFAOYSA-N 0 3 412.481 4.246 20 0 HIADHN CCN(Cc1cccc(Br)c1)C(=O)NCCN(C)Cc1ccccc1 ZINC000521768741 929431238 /nfs/dbraw/zinc/43/12/38/929431238.db2.gz SSRJEKPHIBCZHE-UHFFFAOYSA-N 0 3 404.352 4.113 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)c(C)c1CC(=O)N(CCN(C)C)c1ccccc1 ZINC000521791402 929450285 /nfs/dbraw/zinc/45/02/85/929450285.db2.gz AJFBHDBTPREACP-UHFFFAOYSA-N 0 3 410.949 4.280 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NCc2csc(-c3ccc4c(c3)OCO4)n2)C1 ZINC000521828133 929481935 /nfs/dbraw/zinc/48/19/35/929481935.db2.gz DEGRSXSMHGNWQH-APWZRJJASA-N 0 3 407.539 4.464 20 0 HIADHN CC[C@@H]1CCCCN1C(=O)[C@@H](C)N(C)CCCc1cc(-c2cccc(F)c2)n[nH]1 ZINC000521879222 929528484 /nfs/dbraw/zinc/52/84/84/929528484.db2.gz ZUPXPVWNHYJMEL-DYESRHJHSA-N 0 3 400.542 4.260 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)Nc3cccc(OC4CCCC4)c3)CC2)C[C@H](C)O1 ZINC000521880110 929531641 /nfs/dbraw/zinc/53/16/41/929531641.db2.gz FSJYRVXBVCVVOX-OALUTQOASA-N 0 3 415.578 4.361 20 0 HIADHN COc1cccc([C@@H](CNC(=O)Nc2cccc(N(C)C(C)C)c2)N2CCCC2)c1 ZINC000521898680 929543549 /nfs/dbraw/zinc/54/35/49/929543549.db2.gz WPIVVERZLVBGEN-HSZRJFAPSA-N 0 3 410.562 4.498 20 0 HIADHN C[C@H](C(=O)N1[C@H](C)CCC[C@H]1C)N(C)CCCc1cc(-c2cccc(F)c2)n[nH]1 ZINC000521902621 929547292 /nfs/dbraw/zinc/54/72/92/929547292.db2.gz GCWPBCCRIDLULA-KZNAEPCWSA-N 0 3 400.542 4.258 20 0 HIADHN O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)N1CC[C@H]1c1ccc(Cl)cc1 ZINC000521926377 929567852 /nfs/dbraw/zinc/56/78/52/929567852.db2.gz LBVYMSCSZVTUTI-YADHBBJMSA-N 0 3 413.949 4.088 20 0 HIADHN CCN1CCN(C[C@H](C)CNc2ncnc3scc(-c4ccc(F)cc4)c32)CC1 ZINC000524491332 929639194 /nfs/dbraw/zinc/63/91/94/929639194.db2.gz NCEOGDKIPLVAKU-MRXNPFEDSA-N 0 3 413.566 4.183 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N2CCC(c3c[nH]c4ncccc34)CC2)N(C)C)cc1 ZINC000524518721 929662332 /nfs/dbraw/zinc/66/23/32/929662332.db2.gz PPEIKGABIMHOCC-JOCHJYFZSA-N 0 3 405.546 4.063 20 0 HIADHN CC1CCC(N2CCN(C(=O)c3cccc(NC(=O)c4ccc(F)cc4)c3)CC2)CC1 ZINC000524533585 929669507 /nfs/dbraw/zinc/66/95/07/929669507.db2.gz APOCWZHIFIHRED-UHFFFAOYSA-N 0 3 423.532 4.415 20 0 HIADHN CS(=O)(=O)c1cccc(OCCN(Cc2ccc(F)cc2)C2CCCCC2)c1 ZINC000524591940 929702635 /nfs/dbraw/zinc/70/26/35/929702635.db2.gz YOPFCEIUCZWJQX-UHFFFAOYSA-N 0 3 405.535 4.443 20 0 HIADHN Cc1ccccc1[C@@H]1C[C@@H](C)N(CC(=O)N2CCC(C(=O)Nc3ccccc3)CC2)C1 ZINC000524593658 929704292 /nfs/dbraw/zinc/70/42/92/929704292.db2.gz LENUGOBKEUVFSG-IFMALSPDSA-N 0 3 419.569 4.050 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2ccc(OC3CCOCC3)c(C)c2)N(C)C)cc1 ZINC000524599668 929709959 /nfs/dbraw/zinc/70/99/59/929709959.db2.gz RTVVQXGOEOKHSP-QFIPXVFZSA-N 0 3 411.546 4.286 20 0 HIADHN CC(C)c1c(C(=O)N2CC[C@H](N3CCCCC3)C2)cnn1-c1cccc(Cl)c1 ZINC000524610394 929719421 /nfs/dbraw/zinc/71/94/21/929719421.db2.gz OMKKSYRSAVWSMU-IBGZPJMESA-N 0 3 400.954 4.350 20 0 HIADHN CC(C)C(=O)Nc1ccc(NC(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)cc1 ZINC000524629697 929739644 /nfs/dbraw/zinc/73/96/44/929739644.db2.gz KPXKCDKGNKBAGP-IBGZPJMESA-N 0 3 408.546 4.409 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)NCc1ccc(-c2ccncc2)cc1 ZINC000524723936 929810891 /nfs/dbraw/zinc/81/08/91/929810891.db2.gz MZHDGPMELOUZMO-UHFFFAOYSA-N 0 3 424.495 4.300 20 0 HIADHN COc1cc(-c2nnc(CN3CC[C@H](C)[C@@H]4CCCC[C@@H]43)o2)cc(OC)c1OC ZINC000524758837 929820608 /nfs/dbraw/zinc/82/06/08/929820608.db2.gz FYKAJZRENIJWKY-XIRDDKMYSA-N 0 3 401.507 4.163 20 0 HIADHN C[C@@H](NC(=O)NCC1(N2CCSCC2)CCCC1)c1ccccc1C(F)(F)F ZINC000524777645 929826669 /nfs/dbraw/zinc/82/66/69/929826669.db2.gz ZBCGVDCWJNNUCN-OAHLLOKOSA-N 0 3 415.525 4.427 20 0 HIADHN CSc1ccc(C)c(C(=O)NC2CCN(CCOc3ccc(F)cc3)CC2)c1 ZINC000524813827 929840755 /nfs/dbraw/zinc/84/07/55/929840755.db2.gz XHDSTMITCZKTEH-UHFFFAOYSA-N 0 3 402.535 4.129 20 0 HIADHN CC(C)C[C@@H](C(=O)Nc1cccc(CN2CCC(C(N)=O)CC2)c1)c1ccccc1 ZINC000524855192 929859904 /nfs/dbraw/zinc/85/99/04/929859904.db2.gz HCJJNETVHFADOQ-HSZRJFAPSA-N 0 3 407.558 4.152 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)N[C@@H](c1ccccc1)[C@@H]1CCCO1 ZINC000524932444 929897062 /nfs/dbraw/zinc/89/70/62/929897062.db2.gz YNPNFGNFGLNZJF-QDSKXPNFSA-N 0 3 407.558 4.213 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)Nc1ccc(F)cc1OCC1CC1 ZINC000524936646 929898595 /nfs/dbraw/zinc/89/85/95/929898595.db2.gz AGSBRDHAYPUXLF-UHFFFAOYSA-N 0 3 403.473 4.349 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)[C@H]1C[C@@H]1c1ccccc1OC(F)(F)F ZINC000524969342 929932995 /nfs/dbraw/zinc/93/29/95/929932995.db2.gz WAMZMXOAIGBDOE-SXLOBPIMSA-N 0 3 418.459 4.470 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)c1cnc(-c2ccncc2)s1 ZINC000524984654 929948415 /nfs/dbraw/zinc/94/84/15/929948415.db2.gz FSQVRMBPPUNJEJ-UHFFFAOYSA-N 0 3 400.935 4.063 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)c1cccc(C(=O)N(C)CC(C)(C)C)c1 ZINC000525013653 929974164 /nfs/dbraw/zinc/97/41/64/929974164.db2.gz GTCORTDCIPHGOL-UHFFFAOYSA-N 0 3 409.574 4.009 20 0 HIADHN COc1ccc(C)cc1-n1ccc(C(=O)NC[C@@H]2CCCN(C)[C@@H]2c2cccs2)n1 ZINC000525036014 929993051 /nfs/dbraw/zinc/99/30/51/929993051.db2.gz MRTQQGXLBXVKOX-JTSKRJEESA-N 0 3 424.570 4.064 20 0 HIADHN CCc1nc(C)c([C@H](C)N(C)C(=O)CCCN2CCN(c3ccccc3)CC2)s1 ZINC000525048570 930001983 /nfs/dbraw/zinc/00/19/83/930001983.db2.gz XHXVSKBLUAJINH-IBGZPJMESA-N 0 3 414.619 4.136 20 0 HIADHN C[C@H]1CN(CC(=O)N(C)Cc2ccc(OC(F)F)cc2)CC[C@H]1c1ccccc1 ZINC000525121736 930048383 /nfs/dbraw/zinc/04/83/83/930048383.db2.gz BYKSBNJBSLZHCO-LAUBAEHRSA-N 0 3 402.485 4.372 20 0 HIADHN Cc1cc(C(=O)NC[C@@H]2CCCN2Cc2ccccc2)ccc1NC(=O)CC(C)C ZINC000525148332 930065120 /nfs/dbraw/zinc/06/51/20/930065120.db2.gz XYMJJOZOYLAKTK-QFIPXVFZSA-N 0 3 407.558 4.374 20 0 HIADHN Cc1ccc(CN(Cc2ccco2)C(=O)CC2(N3CCOCC3)CCCC2)s1 ZINC000525179039 930077992 /nfs/dbraw/zinc/07/79/92/930077992.db2.gz ZVYJQZBXCFRXJQ-UHFFFAOYSA-N 0 3 402.560 4.213 20 0 HIADHN CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NCc1cccc(OCc2ccccc2)c1 ZINC000525183025 930078816 /nfs/dbraw/zinc/07/88/16/930078816.db2.gz NEXNFRHQQRNMAA-VWLOTQADSA-N 0 3 413.521 4.194 20 0 HIADHN CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NCc1ccc(-c2ccccc2OC)cc1 ZINC000525182889 930079052 /nfs/dbraw/zinc/07/90/52/930079052.db2.gz BDZCNBWFGSWMAE-DEOSSOPVSA-N 0 3 413.521 4.290 20 0 HIADHN CC(C)c1ccc([C@@H]2C[C@H]2C(=O)Nc2ccccc2CN2CCC[C@H](C(N)=O)C2)cc1 ZINC000525314596 930152238 /nfs/dbraw/zinc/15/22/38/930152238.db2.gz QADOBDBGDOVCIV-RJGXRXQPSA-N 0 3 419.569 4.250 20 0 HIADHN CCCN(CCN(C)C)C(=O)c1ccccc1Sc1ccc(Br)cn1 ZINC000525340703 930178009 /nfs/dbraw/zinc/17/80/09/930178009.db2.gz GJZIKPUXESWSJK-UHFFFAOYSA-N 0 3 422.392 4.409 20 0 HIADHN CCN(CC)[C@H](CNC(=O)[C@H](c1c(F)cccc1Cl)N(C)C)c1ccsc1 ZINC000525383932 930210250 /nfs/dbraw/zinc/21/02/50/930210250.db2.gz HLFAMSBMCUBHMB-MJGOQNOKSA-N 0 3 411.974 4.343 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)c1cc(F)cc(Br)c1 ZINC000525384483 930211700 /nfs/dbraw/zinc/21/17/00/930211700.db2.gz XFRNPPFRCDEBFK-HNNXBMFYSA-N 0 3 405.311 4.325 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)N[C@@H]1C[C@@H]1c1c(F)cccc1Cl ZINC000525394452 930215633 /nfs/dbraw/zinc/21/56/33/930215633.db2.gz REEWMUMHJWNPNZ-FXAWDEMLSA-N 0 3 401.913 4.083 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)NCc1ccc(Br)s1 ZINC000525399413 930218688 /nfs/dbraw/zinc/21/86/88/930218688.db2.gz MRSQZHVXTGCUJU-OAHLLOKOSA-N 0 3 422.392 4.317 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)NCCCCOCCc1ccccc1 ZINC000525399018 930218984 /nfs/dbraw/zinc/21/89/84/930218984.db2.gz WIRAKKGPNDYWBW-QHCPKHFHSA-N 0 3 423.601 4.332 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)Nc1ccc(F)cc1OCC1CC1 ZINC000525448856 930246324 /nfs/dbraw/zinc/24/63/24/930246324.db2.gz YYSJMQTVSZOBNC-UHFFFAOYSA-N 0 3 421.463 4.488 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)[C@H]1C[C@H]1c1ccccc1OC(F)(F)F ZINC000525471534 930261365 /nfs/dbraw/zinc/26/13/65/930261365.db2.gz SLDFRBDHTSBZDD-HOTGVXAUSA-N 0 3 408.420 4.398 20 0 HIADHN CN(C)Cc1cccc(C(=O)N2CCC[C@@H](c3nc(-c4ccc(Cl)cc4)no3)C2)c1 ZINC000525493960 930280442 /nfs/dbraw/zinc/28/04/42/930280442.db2.gz XFMGBLKGJQRPLD-LJQANCHMSA-N 0 3 424.932 4.471 20 0 HIADHN Cc1ccc(NC(=O)[C@@H]2CCN(c3cc(Cl)ccc3Cl)C2=O)c(CN(C)C)c1 ZINC000525495063 930281759 /nfs/dbraw/zinc/28/17/59/930281759.db2.gz BXBXCEFPGPIUHR-INIZCTEOSA-N 0 3 420.340 4.355 20 0 HIADHN CN1CCC[C@@H](CNC(=O)c2csc(Nc3ccccn3)n2)[C@@H]1c1cccs1 ZINC000525573551 930338467 /nfs/dbraw/zinc/33/84/67/930338467.db2.gz QFELUKXSKNNQEH-KBXCAEBGSA-N 0 3 413.572 4.156 20 0 HIADHN CC[C@H](Cc1ccccc1)N(C)CC(=O)N1CCC[C@@H]1c1cc(OC)ccc1OC ZINC000525638572 930377668 /nfs/dbraw/zinc/37/76/68/930377668.db2.gz RTJFYBVWCNMZFL-NFBKMPQASA-N 0 3 410.558 4.320 20 0 HIADHN C[C@@H]1C[C@H](c2ccccc2)[C@H](C)N1C(=O)CCCN1CCN(c2ccccc2)CC1 ZINC000525645403 930380656 /nfs/dbraw/zinc/38/06/56/930380656.db2.gz LIUJZBNVMJWANI-SLSDLSHTSA-N 0 3 405.586 4.382 20 0 HIADHN CC(C)(CCS(C)(=O)=O)NCc1ccc(-c2ccc(Br)cc2)o1 ZINC000525696317 930407244 /nfs/dbraw/zinc/40/72/44/930407244.db2.gz YBKMIXQCVBZUGH-UHFFFAOYSA-N 0 3 400.338 4.012 20 0 HIADHN C[C@@H]1CCN(C(=O)c2cc(Cl)c3c(c2)OCCCO3)CCN1Cc1ccccc1 ZINC000525737472 930420739 /nfs/dbraw/zinc/42/07/39/930420739.db2.gz NBABHYHMSDNYJW-QGZVFWFLSA-N 0 3 414.933 4.238 20 0 HIADHN C[C@@H](CNC(=O)Nc1cccc(CC(=O)OC(C)(C)C)c1)N(C)Cc1ccccc1 ZINC000525740845 930422460 /nfs/dbraw/zinc/42/24/60/930422460.db2.gz MNMMRAOSBSEIID-SFHVURJKSA-N 0 3 411.546 4.213 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(OC(F)F)cc1)c1ccc(OCC(=O)NC2CC2)cc1 ZINC000525760705 930434020 /nfs/dbraw/zinc/43/40/20/930434020.db2.gz BJBHCGOLVSFUAO-HUUCEWRRSA-N 0 3 404.457 4.357 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N2CCO[C@@H](c3ccccc3C)C2)N2CCCC2)cc1 ZINC000525809357 930452283 /nfs/dbraw/zinc/45/22/83/930452283.db2.gz HJBJGABPZIGGOO-DNQXCXABSA-N 0 3 407.558 4.223 20 0 HIADHN C[C@H](NC(=O)C(=O)Nc1ccc2oc3ccccc3c2c1)[C@H](c1ccccc1)N(C)C ZINC000525905196 930480366 /nfs/dbraw/zinc/48/03/66/930480366.db2.gz NXNXZGWKJPTCGE-QMHKHESXSA-N 0 3 415.493 4.332 20 0 HIADHN C[C@H](NC(=O)Nc1ccc(C(F)(F)F)c(Br)c1)C1=CCN(C)CC1 ZINC000526065174 930517609 /nfs/dbraw/zinc/51/76/09/930517609.db2.gz ZMASZAWAUSYMDB-JTQLQIEISA-N 0 3 406.246 4.240 20 0 HIADHN O=C(CCOc1cccc(Cl)c1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000526945554 930554975 /nfs/dbraw/zinc/55/49/75/930554975.db2.gz ZTFQCZUDDMFALH-UHFFFAOYSA-N 0 3 404.860 4.030 20 0 HIADHN C[C@@H](CNC(=O)[C@H]1CCCN(Cc2cccnc2)C1)c1ccc(C(F)(F)F)cc1 ZINC000526956103 930557697 /nfs/dbraw/zinc/55/76/97/930557697.db2.gz GJBUUTQCRQDJAW-LPHOPBHVSA-N 0 3 405.464 4.232 20 0 HIADHN CN(CCN(Cc1ccccc1)C(=O)NCc1ncccc1F)Cc1ccccc1 ZINC000526977846 930560667 /nfs/dbraw/zinc/56/06/67/930560667.db2.gz CCRKSWQKEXTCBG-UHFFFAOYSA-N 0 3 406.505 4.065 20 0 HIADHN COc1cc(Cl)ccc1NC(=O)COc1ccc(CN2[C@@H](C)C[C@@H]2C)cc1OC ZINC000526989373 930562985 /nfs/dbraw/zinc/56/29/85/930562985.db2.gz RKQHLSWPMPCQHS-GJZGRUSLSA-N 0 3 418.921 4.357 20 0 HIADHN O=C(CCOc1ccc(F)c(Cl)c1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000527194582 930609584 /nfs/dbraw/zinc/60/95/84/930609584.db2.gz DFPVZFPCAYQHKZ-UHFFFAOYSA-N 0 3 422.850 4.170 20 0 HIADHN CC(C)(C)[C@H](CN1CCc2ccccc2C1)NC(=O)c1c[nH]c(=O)c2ccccc12 ZINC000527294285 930628498 /nfs/dbraw/zinc/62/84/98/930628498.db2.gz CLSZGHYRFPOWIK-QFIPXVFZSA-N 0 3 403.526 4.143 20 0 HIADHN CN(CCc1ccncc1)Cc1cccc(Br)c1OC[C@@H]1CCCO1 ZINC000527489771 930667666 /nfs/dbraw/zinc/66/76/66/930667666.db2.gz XCOBMQRHXHNTFF-SFHVURJKSA-N 0 3 405.336 4.076 20 0 HIADHN Cc1nn(-c2ccccc2)c(Oc2cccc(F)c2)c1CNCCc1cnccn1 ZINC000527528750 930674752 /nfs/dbraw/zinc/67/47/52/930674752.db2.gz VBERIBXTYFFGAB-UHFFFAOYSA-N 0 3 403.461 4.234 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2cccc(CC(=O)OC(C)(C)C)c2)[C@@H]1c1ccccc1 ZINC000530354185 930690757 /nfs/dbraw/zinc/69/07/57/930690757.db2.gz XFMGCGLEXIMKCN-UNMCSNQZSA-N 0 3 409.530 4.138 20 0 HIADHN CN(C)c1ccc(NC(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)c(C(F)(F)F)c1 ZINC000530357473 930693786 /nfs/dbraw/zinc/69/37/86/930693786.db2.gz ZMJWRSNAJVMRQS-RBUKOAKNSA-N 0 3 406.452 4.338 20 0 HIADHN NC(=O)c1ccc(CN[C@@H](Cc2ccccn2)c2ccc(Br)cc2)cc1 ZINC000530386700 930698920 /nfs/dbraw/zinc/69/89/20/930698920.db2.gz WWQWPWLWGNUDJE-FQEVSTJZSA-N 0 3 410.315 4.017 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)Nc1cccc2c1OC(C)(C)C2 ZINC000530396541 930701201 /nfs/dbraw/zinc/70/12/01/930701201.db2.gz SGSYDXRWBYLKAP-UHFFFAOYSA-N 0 3 403.473 4.274 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2cc3c(cc2Cl)OCCCO3)[C@@H]1c1ccccc1 ZINC000530409736 930704954 /nfs/dbraw/zinc/70/49/54/930704954.db2.gz IWNMHKVRHRNLNW-UZLBHIALSA-N 0 3 401.894 4.068 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2ccc(OC(F)F)c3ncccc23)[C@@H]1c1ccccc1 ZINC000530462023 930717558 /nfs/dbraw/zinc/71/75/58/930717558.db2.gz GFYAPXMRLBRJIJ-XLIONFOSSA-N 0 3 412.440 4.403 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2ccc(OC(F)F)c3ncccc23)[C@H]1c1ccccc1 ZINC000530462016 930717662 /nfs/dbraw/zinc/71/76/62/930717662.db2.gz GFYAPXMRLBRJIJ-FXAWDEMLSA-N 0 3 412.440 4.403 20 0 HIADHN CCCNC(=O)c1ccc(NC(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)cc1Cl ZINC000530515316 930733479 /nfs/dbraw/zinc/73/34/79/930733479.db2.gz WCGKBJCSUHYIML-WOJBJXKFSA-N 0 3 414.937 4.047 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2cc(N3CCCC3=O)ccc2Cl)[C@H]1c1ccccc1 ZINC000530515854 930733548 /nfs/dbraw/zinc/73/35/48/930733548.db2.gz CSOCQWYQRCNLMX-WIYYLYMNSA-N 0 3 412.921 4.034 20 0 HIADHN O=C(CC1(N2CCOCC2)CCCC1)Nc1cccc(COCCc2ccccc2)c1 ZINC000530571098 930753687 /nfs/dbraw/zinc/75/36/87/930753687.db2.gz JXTUGBGJXSGVCY-UHFFFAOYSA-N 0 3 422.569 4.420 20 0 HIADHN CN(C(=O)c1ccccc1OCc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000530589060 930759994 /nfs/dbraw/zinc/75/99/94/930759994.db2.gz BXTSTYROTAQLLR-QHCPKHFHSA-N 0 3 415.537 4.397 20 0 HIADHN COC(=O)c1cc2c(o1)c(OC)ccc2CNCc1ccc(NC(=O)C(C)C)cc1 ZINC000530664961 930792263 /nfs/dbraw/zinc/79/22/63/930792263.db2.gz RRBYWHJHRRLSKV-UHFFFAOYSA-N 0 3 410.470 4.112 20 0 HIADHN Cc1[nH]c(=O)c(C(=O)NCC(C)(C)N2CCc3ccccc3C2)cc1-c1ccccc1 ZINC000530703413 930802356 /nfs/dbraw/zinc/80/23/56/930802356.db2.gz LPLZJJZZWWZBSX-UHFFFAOYSA-N 0 3 415.537 4.329 20 0 HIADHN COc1ccc(F)c(NC(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)c1 ZINC000530804019 930827994 /nfs/dbraw/zinc/82/79/94/930827994.db2.gz TWQIGZMNDCOTBK-UHFFFAOYSA-N 0 3 413.415 4.449 20 0 HIADHN O=C(CC1(N2CCOCC2)CCCC1)N(Cc1ccccc1C(F)(F)F)C1CC1 ZINC000530813957 930830377 /nfs/dbraw/zinc/83/03/77/930830377.db2.gz QJQVXYOKYHGEBI-UHFFFAOYSA-N 0 3 410.480 4.232 20 0 HIADHN CC(C)(C)N1CCCN(C(=O)c2ccc(Sc3ccccc3Cl)nn2)CC1 ZINC000530814038 930830576 /nfs/dbraw/zinc/83/05/76/930830576.db2.gz IQGXKGYTOXFPHF-UHFFFAOYSA-N 0 3 404.967 4.228 20 0 HIADHN CCc1cc(CNC(=O)N(CCN(C)Cc2ccccc2)Cc2ccccc2)on1 ZINC000530916820 930857795 /nfs/dbraw/zinc/85/77/95/930857795.db2.gz UPZGXBMMVTXECX-UHFFFAOYSA-N 0 3 406.530 4.081 20 0 HIADHN C[C@@H](NC(=O)NC[C@@H](c1ccccc1)N1CCCC1)c1cccc(N2CCCC2)c1 ZINC000531027882 930889842 /nfs/dbraw/zinc/88/98/42/930889842.db2.gz FBIGDZSCRDWWFN-YKSBVNFPSA-N 0 3 406.574 4.484 20 0 HIADHN CC[C@@H](C(=O)Nc1ccc(CC(=O)N2CCCc3ccccc32)cc1)N(CC)CC ZINC000531057358 930900134 /nfs/dbraw/zinc/90/01/34/930900134.db2.gz WUVRUMHWCDHIIT-QFIPXVFZSA-N 0 3 407.558 4.267 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)c2ccc(F)cc2Br)CC1 ZINC000531157393 930948345 /nfs/dbraw/zinc/94/83/45/930948345.db2.gz ZXXLKDVOIMMRHB-UHFFFAOYSA-N 0 3 405.311 4.325 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1nnc(SCc2ccccc2)s1 ZINC000531279283 930997343 /nfs/dbraw/zinc/99/73/43/930997343.db2.gz UBDKNHWTMCUXLQ-UHFFFAOYSA-N 0 3 417.560 4.019 20 0 HIADHN COc1ccc([C@@H](CNC(=O)[C@@H]2CCCCN2Cc2ccccc2)N2CCCC2)cc1 ZINC000531281677 931000069 /nfs/dbraw/zinc/00/00/69/931000069.db2.gz XZYVKKFYFUIDNW-LOSJGSFVSA-N 0 3 421.585 4.003 20 0 HIADHN Cc1cc(C)n(-c2ccc(CC(=O)N(C)[C@H]3CCCN(Cc4ccccc4)C3)cc2)n1 ZINC000531301691 931007326 /nfs/dbraw/zinc/00/73/26/931007326.db2.gz WAQRYASCLRJGPP-VWLOTQADSA-N 0 3 416.569 4.155 20 0 HIADHN Cc1c(-c2nc(-c3ccc(CN(C)C)cc3)no2)nnn1-c1ccc(F)c(Cl)c1 ZINC000531348868 931026777 /nfs/dbraw/zinc/02/67/77/931026777.db2.gz OHXNMTPOXMYGCV-UHFFFAOYSA-N 0 3 412.856 4.147 20 0 HIADHN COC(=O)c1cc2c(o1)c(OC)ccc2CNCc1ccc(N2CCCCCC2)nc1 ZINC000531380504 931037899 /nfs/dbraw/zinc/03/78/99/931037899.db2.gz ARSQIYAOJGIRPQ-UHFFFAOYSA-N 0 3 423.513 4.293 20 0 HIADHN O=C(NC[C@@H](Cc1ccccc1)c1ccccc1)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000531389272 931040485 /nfs/dbraw/zinc/04/04/85/931040485.db2.gz KQHJTTNDPGTSJK-IZZNHLLZSA-N 0 3 413.565 4.436 20 0 HIADHN O=C(c1ccc(-c2nc(C3CC3)no2)cc1)N(CCN1CCCC1)c1ccccc1 ZINC000531431997 931055875 /nfs/dbraw/zinc/05/58/75/931055875.db2.gz IYWXQCHVUCTEKQ-UHFFFAOYSA-N 0 3 402.498 4.357 20 0 HIADHN O=C(Nc1ccc(CNCc2ccc(N3CCCC3)nc2)cc1)c1ccc(F)cc1 ZINC000531564308 931104643 /nfs/dbraw/zinc/10/46/43/931104643.db2.gz LJMYWZSZZBHNEJ-UHFFFAOYSA-N 0 3 404.489 4.363 20 0 HIADHN CC(C)Sc1ccc([C@H](C)NC(=O)N2CC[C@@H](N3CCN(C(C)C)CC3)C2)cc1 ZINC000531584358 931110485 /nfs/dbraw/zinc/11/04/85/931110485.db2.gz RVYCWQCLAOHJPX-PZJWPPBQSA-N 0 3 418.651 4.058 20 0 HIADHN C[C@H](CCS(C)(=O)=O)NCc1cccc(Oc2cccc(C(F)(F)F)c2)c1 ZINC000531630543 931132486 /nfs/dbraw/zinc/13/24/86/931132486.db2.gz BUACKJPTFMOVRI-CQSZACIVSA-N 0 3 401.450 4.411 20 0 HIADHN C[C@H]1CN(C(=O)c2ccc(CNCc3cc(Cl)cc4cccnc43)cc2)C[C@H](C)O1 ZINC000531658643 931142285 /nfs/dbraw/zinc/14/22/85/931142285.db2.gz HANNUJXRMGTZLY-IRXDYDNUSA-N 0 3 423.944 4.427 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)NCc2cccc(NC(=O)[C@@H]3CCCO3)c2)cc1 ZINC000531695446 931158831 /nfs/dbraw/zinc/15/88/31/931158831.db2.gz VFNIEAQNMJFGKM-HXOBKFHXSA-N 0 3 404.514 4.149 20 0 HIADHN COc1ccc([C@@H](C)NCc2ccc(CS(=O)(=O)NC(C)C)cc2)cc1Cl ZINC000531695707 931158997 /nfs/dbraw/zinc/15/89/97/931158997.db2.gz BETUYBYJRXQRCR-OAHLLOKOSA-N 0 3 410.967 4.027 20 0 HIADHN CC(=O)N1CCN(c2ccccc2CN[C@H](C)c2ccccc2C(F)(F)F)CC1 ZINC000531706378 931167267 /nfs/dbraw/zinc/16/72/67/931167267.db2.gz PVEPJBSHCAQALM-MRXNPFEDSA-N 0 3 405.464 4.225 20 0 HIADHN C[C@@H]1C[C@@H](NCc2cccc(CS(C)(=O)=O)c2)c2cccc(Br)c21 ZINC000531707568 931168285 /nfs/dbraw/zinc/16/82/85/931168285.db2.gz FKIXJMUSFPJXLG-FZKQIMNGSA-N 0 3 408.361 4.332 20 0 HIADHN c1sc(-c2ccc3c(c2)OCO3)nc1CNCCCc1ccc2c(c1)OCCO2 ZINC000531818246 931207426 /nfs/dbraw/zinc/20/74/26/931207426.db2.gz ICPYNIADKQWGCA-UHFFFAOYSA-N 0 3 410.495 4.032 20 0 HIADHN C[C@H](NC(=O)[C@@H]1CCCN(Cc2cccnc2)C1)c1ccc(OCC2CC2)c(F)c1 ZINC000531834827 931213690 /nfs/dbraw/zinc/21/36/90/931213690.db2.gz NCGRGGSQZUURSQ-LAUBAEHRSA-N 0 3 411.521 4.099 20 0 HIADHN CC(C)c1ccc([C@@H](NC(=O)N2CC[C@@H](N3CCN(C(C)C)CC3)C2)C(C)C)cc1 ZINC000531839049 931215151 /nfs/dbraw/zinc/21/51/51/931215151.db2.gz MENNKDJOJOATQQ-RPWUZVMVSA-N 0 3 414.638 4.317 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CNCCOc1ccc(C(F)(F)F)cn1 ZINC000531864148 931226373 /nfs/dbraw/zinc/22/63/73/931226373.db2.gz KGAOFXKMSGUBCM-UHFFFAOYSA-N 0 3 404.436 4.131 20 0 HIADHN COc1cc(OC)c([C@H](C)NC[C@H](c2cccs2)N2CCN(C)CC2)cc1Cl ZINC000531932580 931251021 /nfs/dbraw/zinc/25/10/21/931251021.db2.gz UEWOQBBVAJPYHR-MAUKXSAKSA-N 0 3 424.010 4.058 20 0 HIADHN COc1cc([C@H](C)NCc2ccccc2CN2CCCC2=O)ccc1OC(F)F ZINC000531939666 931255260 /nfs/dbraw/zinc/25/52/60/931255260.db2.gz WFFQAGIQQXWEOW-HNNXBMFYSA-N 0 3 404.457 4.270 20 0 HIADHN O=C(c1ccccc1Cl)N1CCC(NCc2cn3cc(Cl)ccc3n2)CC1 ZINC000531942448 931255795 /nfs/dbraw/zinc/25/57/95/931255795.db2.gz FBVXDNOWJCSFPL-UHFFFAOYSA-N 0 3 403.313 4.036 20 0 HIADHN CNS(=O)(=O)c1ccc([C@H](C)N[C@@H](C)c2sc(-c3ccccc3)nc2C)cc1 ZINC000531952600 931261892 /nfs/dbraw/zinc/26/18/92/931261892.db2.gz WNYWYMBPDSYYII-GJZGRUSLSA-N 0 3 415.584 4.438 20 0 HIADHN C[C@H](CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)N[C@@H]1c2ccccc2C[C@@H]1O ZINC000531953289 931262711 /nfs/dbraw/zinc/26/27/11/931262711.db2.gz KMQLZKWFWPUQIG-XTDINYQCSA-N 0 3 412.839 4.324 20 0 HIADHN CN1CCN(C[C@@H](N[C@H]2CCSc3c(Cl)cccc32)c2ccccc2)CC1 ZINC000531965150 931267257 /nfs/dbraw/zinc/26/72/57/931267257.db2.gz LXEDMQHQXITYLL-LEWJYISDSA-N 0 3 402.007 4.455 20 0 HIADHN CCC[C@@H](N[C@@H](C)c1ccc2c(c1)OCCCO2)C(=O)N1CCc2sccc2C1 ZINC000531965757 931268445 /nfs/dbraw/zinc/26/84/45/931268445.db2.gz SMYKFVCJJNRTRY-QFBILLFUSA-N 0 3 414.571 4.314 20 0 HIADHN Cc1ccc2nc(CN[C@H](C)CC(=O)Nc3ccc(Br)cc3)[nH]c2c1 ZINC000531984379 931275715 /nfs/dbraw/zinc/27/57/15/931275715.db2.gz CESCPJYARITCFJ-CYBMUJFWSA-N 0 3 401.308 4.141 20 0 HIADHN Cc1ccc2nc(CN[C@@H](C)CC(=O)Nc3ccc(Br)cc3)[nH]c2c1 ZINC000531984380 931275791 /nfs/dbraw/zinc/27/57/91/931275791.db2.gz CESCPJYARITCFJ-ZDUSSCGKSA-N 0 3 401.308 4.141 20 0 HIADHN CCNC(=O)COc1ccc(CN[C@@H](c2ccccc2F)C2CCCC2)cc1OC ZINC000532039869 931294376 /nfs/dbraw/zinc/29/43/76/931294376.db2.gz RFODXSJOKZUUBE-XMMPIXPASA-N 0 3 414.521 4.370 20 0 HIADHN Cc1[nH]c(=O)c(C(=O)N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)cc1-c1ccccc1 ZINC000532079358 931304611 /nfs/dbraw/zinc/30/46/11/931304611.db2.gz TYQMJRJAGNIKFH-UTKZUKDTSA-N 0 3 401.510 4.155 20 0 HIADHN Cc1[nH]c(=O)c(C(=O)N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)cc1-c1ccccc1 ZINC000532079356 931304709 /nfs/dbraw/zinc/30/47/09/931304709.db2.gz TYQMJRJAGNIKFH-DYESRHJHSA-N 0 3 401.510 4.155 20 0 HIADHN CC[C@H](NCc1ccc(C(=O)N2CCOCC2)cc1)c1ccc(Br)cc1 ZINC000532115844 931319090 /nfs/dbraw/zinc/31/90/90/931319090.db2.gz DPZMMHLLRKCYRF-FQEVSTJZSA-N 0 3 417.347 4.162 20 0 HIADHN CN1CCN(CCCCNC(=O)N[C@H](c2cccc(Cl)c2)C2CCCCC2)CC1 ZINC000532118911 931319981 /nfs/dbraw/zinc/31/99/81/931319981.db2.gz DFEZLHNXKVBKRM-QFIPXVFZSA-N 0 3 421.029 4.288 20 0 HIADHN CN(C(=O)c1ccccc1OCc1ccncc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000532146072 931327570 /nfs/dbraw/zinc/32/75/70/931327570.db2.gz QNTSXHULYJCWSZ-JOCHJYFZSA-N 0 3 401.510 4.007 20 0 HIADHN C[C@H](CC(=O)Nc1ccc(OC(F)(F)F)cc1)NCc1cnn(-c2ccccc2)c1 ZINC000532197264 931345449 /nfs/dbraw/zinc/34/54/49/931345449.db2.gz FKORHFZVGGSJAP-OAHLLOKOSA-N 0 3 418.419 4.278 20 0 HIADHN C[C@H](NC[C@H](c1c(F)cccc1Cl)N1CCCC1)c1ccc(S(C)(=O)=O)cc1 ZINC000532196083 931345524 /nfs/dbraw/zinc/34/55/24/931345524.db2.gz YGQSUITTWXPSNW-MGPUTAFESA-N 0 3 424.969 4.370 20 0 HIADHN COc1cc(CN[C@@H](C)CC(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)ccn1 ZINC000532202936 931348261 /nfs/dbraw/zinc/34/82/61/931348261.db2.gz KBLBIJPGUIWSIP-NSHDSACASA-N 0 3 401.816 4.269 20 0 HIADHN C[C@@H](NCc1ccc(OCCOc2ccccc2)nc1)c1ccc2c(c1)CCC(=O)N2 ZINC000532210703 931353230 /nfs/dbraw/zinc/35/32/30/931353230.db2.gz JZJMQJRMONDXSG-GOSISDBHSA-N 0 3 417.509 4.275 20 0 HIADHN CC(C)N1CCN([C@@H]2CCN(C(=O)c3ccc4c(c3)C(C)(C)CCC4(C)C)C2)CC1 ZINC000532342550 931401575 /nfs/dbraw/zinc/40/15/75/931401575.db2.gz QVBMZVONVVAPRD-OAQYLSRUSA-N 0 3 411.634 4.276 20 0 HIADHN CC(C)N1CCN([C@@H]2CCN(C(=O)C[C@H](Cc3ccccc3)c3ccccc3)C2)CC1 ZINC000532347678 931403648 /nfs/dbraw/zinc/40/36/48/931403648.db2.gz CCTVMQNIPQIPFF-IZZNHLLZSA-N 0 3 419.613 4.030 20 0 HIADHN C[C@@H](CC(=O)Nc1ccc(Br)cc1)NCc1cnn(-c2ccccc2)c1 ZINC000532451559 931439451 /nfs/dbraw/zinc/43/94/51/931439451.db2.gz BIOCFLVLNGHNGO-HNNXBMFYSA-N 0 3 413.319 4.142 20 0 HIADHN O[C@H](CN[C@H]1CCSc2ccc(F)cc21)COc1cccc(C(F)(F)F)c1 ZINC000532465275 931446697 /nfs/dbraw/zinc/44/66/97/931446697.db2.gz VAEBRYSSAPAIOB-PBHICJAKSA-N 0 3 401.425 4.411 20 0 HIADHN O[C@@H](CN[C@@H]1CCSc2ccc(F)cc21)COc1cccc(C(F)(F)F)c1 ZINC000532465277 931447869 /nfs/dbraw/zinc/44/78/69/931447869.db2.gz VAEBRYSSAPAIOB-WMLDXEAASA-N 0 3 401.425 4.411 20 0 HIADHN COc1ccc(NC(=O)C[C@@H](C)NCc2ccc(Oc3ccccc3)nc2)c(OC)c1 ZINC000532494468 931461211 /nfs/dbraw/zinc/46/12/11/931461211.db2.gz FANQZICWDHENRQ-QGZVFWFLSA-N 0 3 421.497 4.398 20 0 HIADHN CCN1CCCN(CC(=O)Nc2ccccc2Sc2ccc(Cl)cc2)CC1 ZINC000532520746 931472502 /nfs/dbraw/zinc/47/25/02/931472502.db2.gz QYZALYQPEMMTMG-UHFFFAOYSA-N 0 3 403.979 4.457 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)N1c2ccccc2CC[C@H]1C)c1ccc(NC(=O)NC2CC2)cc1 ZINC000532614621 931554413 /nfs/dbraw/zinc/55/44/13/931554413.db2.gz RINMUYSZFJQQGA-KURKYZTESA-N 0 3 420.557 4.378 20 0 HIADHN O=C([C@H](c1ccccc1)N1CCC(c2c[nH]c3ncccc23)CC1)N1CCCCC1 ZINC000532708848 931599924 /nfs/dbraw/zinc/59/99/24/931599924.db2.gz OLWVNIHZCBNEQJ-QHCPKHFHSA-N 0 3 402.542 4.496 20 0 HIADHN O=C([C@@H](c1ccccc1)N1CCC(c2c[nH]c3ncccc23)CC1)N1CCCCC1 ZINC000532708847 931601208 /nfs/dbraw/zinc/60/12/08/931601208.db2.gz OLWVNIHZCBNEQJ-HSZRJFAPSA-N 0 3 402.542 4.496 20 0 HIADHN CC(=O)Nc1cccc(CN2CCC(C(=O)N(Cc3ccccc3)C3CC3)CC2)c1 ZINC000532732843 931616045 /nfs/dbraw/zinc/61/60/45/931616045.db2.gz VIXBBGPEFPOOLB-UHFFFAOYSA-N 0 3 405.542 4.048 20 0 HIADHN CCN(CC(=O)N(C)[C@H](C)CC(C)C)C1CCN(c2cc(C)nc(C(C)C)n2)CC1 ZINC000532732604 931616117 /nfs/dbraw/zinc/61/61/17/931616117.db2.gz PDCMWLQPDWIOAQ-HXUWFJFHSA-N 0 3 417.642 4.092 20 0 HIADHN CCCN1CCN(c2ccccc2CNc2cccc([C@@H](C)N3CCOCC3)c2)CC1 ZINC000532736728 931617937 /nfs/dbraw/zinc/61/79/37/931617937.db2.gz XRCGJRXFVTWGCI-JOCHJYFZSA-N 0 3 422.617 4.224 20 0 HIADHN O=C1c2ccccc2C(=O)N1[C@H]1CCCC[C@@H](NCc2coc(-c3cccs3)n2)C1 ZINC000532765448 931626905 /nfs/dbraw/zinc/62/69/05/931626905.db2.gz XOWXUKKOLQYOJQ-WBVHZDCISA-N 0 3 421.522 4.490 20 0 HIADHN CCC(C)(C)c1ccc(CNCc2cc(Cl)c(OCC(N)=O)c(OC)c2)cc1 ZINC000532783837 931630650 /nfs/dbraw/zinc/63/06/50/931630650.db2.gz YRIJYMQYXHMKLI-UHFFFAOYSA-N 0 3 404.938 4.190 20 0 HIADHN CCCOc1ccc(CNCc2ccc(Br)cc2N2CCOCC2)cc1 ZINC000532886536 931679038 /nfs/dbraw/zinc/67/90/38/931679038.db2.gz PWYVGJJLYZWUQM-UHFFFAOYSA-N 0 3 419.363 4.364 20 0 HIADHN CN(C)Cc1ccc(C(N)=O)cc1NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000532934410 931702649 /nfs/dbraw/zinc/70/26/49/931702649.db2.gz UXARYMLFZWMRLQ-UHFFFAOYSA-N 0 3 419.369 4.497 20 0 HIADHN CCN(CC(=O)N1CCC(OCc2ccccc2)CC1)[C@@H](C)Cc1ccc(OC)cc1 ZINC000532960796 931714628 /nfs/dbraw/zinc/71/46/28/931714628.db2.gz FVKWFQRMYAHEHK-NRFANRHFSA-N 0 3 424.585 4.156 20 0 HIADHN Cc1sc2[nH]c(CN(C)[C@H]3CCN(C4CC4)C3)nc(=O)c2c1-c1ccc(C)cc1 ZINC000532981963 931725803 /nfs/dbraw/zinc/72/58/03/931725803.db2.gz PTLMOMTUFJFKHW-SFHVURJKSA-N 0 3 408.571 4.349 20 0 HIADHN C[C@@H](NCc1cnn(-c2ccc(F)cc2)c1)[C@@H](OC1CCOCC1)c1ccccc1 ZINC000533007546 931733698 /nfs/dbraw/zinc/73/36/98/931733698.db2.gz HIJQBGLKKYHZLV-HOYKHHGWSA-N 0 3 409.505 4.426 20 0 HIADHN COc1cc2c(cc1CN[C@H](C)[C@H](OC1CCOCC1)c1ccccc1)O[C@H](C)C2 ZINC000533007319 931733885 /nfs/dbraw/zinc/73/38/85/931733885.db2.gz HVZYCCZMWJRMOD-GAKIBJFNSA-N 0 3 411.542 4.434 20 0 HIADHN COc1cccc(OC)c1OC[C@H](O)CN(Cc1ccc(F)cc1F)C1CCCC1 ZINC000533027760 931745701 /nfs/dbraw/zinc/74/57/01/931745701.db2.gz DYIOXWVCQMIGFS-LJQANCHMSA-N 0 3 421.484 4.167 20 0 HIADHN C[C@H]1CN(C(=O)c2ccc(CNCc3cccc(-c4ccccn4)c3)cc2)C[C@H](C)O1 ZINC000533038828 931748586 /nfs/dbraw/zinc/74/85/86/931748586.db2.gz UYPCHAMJZYYCAZ-PMACEKPBSA-N 0 3 415.537 4.288 20 0 HIADHN COc1ccc(OC)c([C@H]2CCCN2C(=O)CN[C@H](c2ccccc2)C2CCC2)c1 ZINC000533046366 931751116 /nfs/dbraw/zinc/75/11/16/931751116.db2.gz RIABDCOMWWYCLH-RCZVLFRGSA-N 0 3 408.542 4.498 20 0 HIADHN CCN(CC)C(=O)c1ccc(NC(=O)CNC2(c3ccc(F)cc3)CCCC2)cc1 ZINC000533051383 931754675 /nfs/dbraw/zinc/75/46/75/931754675.db2.gz IOJPKNADKHFHTH-UHFFFAOYSA-N 0 3 411.521 4.305 20 0 HIADHN O=C(NCc1ccco1)c1cccc(CN2CCC(c3c[nH]c4ncccc34)CC2)c1 ZINC000533060020 931757908 /nfs/dbraw/zinc/75/79/08/931757908.db2.gz IJSWHLKNJIXPGP-UHFFFAOYSA-N 0 3 414.509 4.466 20 0 HIADHN C[C@H](NC(=O)CNC1(c2ccc(Cl)cc2)CCOCC1)c1ccc(Cl)cc1 ZINC000533063256 931760051 /nfs/dbraw/zinc/76/00/51/931760051.db2.gz HGZIFOZKHKDVPW-HNNXBMFYSA-N 0 3 407.341 4.466 20 0 HIADHN CCc1ccc(CCN2CCN(CCCc3nc(-c4cccs4)no3)CC2)cc1 ZINC000533068756 931761626 /nfs/dbraw/zinc/76/16/26/931761626.db2.gz ZUTIALRDXVUUTK-UHFFFAOYSA-N 0 3 410.587 4.153 20 0 HIADHN CC(C)(C)OC(=O)CCN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1 ZINC000533072767 931763362 /nfs/dbraw/zinc/76/33/62/931763362.db2.gz IZIIDCHKMDUPNO-UHFFFAOYSA-N 0 3 401.334 4.376 20 0 HIADHN COc1ccc(OC2CCN(C[C@H](O)Cc3ccccc3C(F)(F)F)CC2)cc1 ZINC000533099717 931770343 /nfs/dbraw/zinc/77/03/43/931770343.db2.gz SMWRHTCZYCDFGZ-QGZVFWFLSA-N 0 3 409.448 4.161 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)Cc1c[nH]c2cccc(Br)c12 ZINC000533121135 931774501 /nfs/dbraw/zinc/77/45/01/931774501.db2.gz FQBIAFVHVSPUJW-UHFFFAOYSA-N 0 3 416.319 4.182 20 0 HIADHN Cc1cc(NC(=O)CO[C@@H]2CCC[C@@H](C)C2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000533261241 931821579 /nfs/dbraw/zinc/82/15/79/931821579.db2.gz FWVXTVAAGUEXRY-STZQEDGTSA-N 0 3 410.562 4.172 20 0 HIADHN CCCN(CC(=O)Nc1ccc(OC(F)(F)F)cc1)[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000533292439 931830943 /nfs/dbraw/zinc/83/09/43/931830943.db2.gz KOTDVOUGMGQVQL-KBAYOESNSA-N 0 3 400.441 4.049 20 0 HIADHN COc1ccc([C@H](NCCC(=O)NC(C)C)c2ccccc2)cc1Br ZINC000533374444 931851969 /nfs/dbraw/zinc/85/19/69/931851969.db2.gz GBDNVBNACJEGDG-HXUWFJFHSA-N 0 3 405.336 4.051 20 0 HIADHN COc1ccc(OC)c([C@H](C)NC(=O)CN[C@H](c2ccc(F)cc2)C2CCC2)c1 ZINC000533376620 931852927 /nfs/dbraw/zinc/85/29/27/931852927.db2.gz GLBOFSVPSJYBEF-WNSKOXEYSA-N 0 3 400.494 4.151 20 0 HIADHN O=C(CN[C@H](c1ccccc1)C1CCCC1)NCc1ccc(C(=O)N2CCCC2)cc1 ZINC000533384051 931854579 /nfs/dbraw/zinc/85/45/79/931854579.db2.gz CLMXLSFKAUYYPC-RUZDIDTESA-N 0 3 419.569 4.060 20 0 HIADHN CCCN(CC(=O)Nc1ccc2[nH]c(C(F)(F)F)nc2c1)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000533430092 931866264 /nfs/dbraw/zinc/86/62/64/931866264.db2.gz WHRPKAFTJPAXRV-XWIAVFTESA-N 0 3 424.467 4.046 20 0 HIADHN Cc1ccccc1O[C@@H]1CCCC[C@@H]1NC(=O)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000533450497 931873918 /nfs/dbraw/zinc/87/39/18/931873918.db2.gz KSZAGNANMOSWOT-AOHZBQACSA-N 0 3 407.558 4.108 20 0 HIADHN O=C(Cc1ccc(OCc2ccccn2)cc1)N(CCN1CCCC1)c1ccccc1 ZINC000533564856 931902994 /nfs/dbraw/zinc/90/29/94/931902994.db2.gz GEOUQXKRUQZLQC-UHFFFAOYSA-N 0 3 415.537 4.332 20 0 HIADHN CC[C@H](NCc1cnn(-c2ccc(F)cc2)c1)[C@H](c1ccc(C)cc1)n1cncn1 ZINC000533739930 932001925 /nfs/dbraw/zinc/00/19/25/932001925.db2.gz MSMIEJIBVYFVIU-GOTSBHOMSA-N 0 3 404.493 4.069 20 0 HIADHN FC(F)(F)Oc1cccc(N2CC[C@@H](NCc3cnc([C@@H]4CCCO4)s3)C2)c1 ZINC000533742784 932003132 /nfs/dbraw/zinc/00/31/32/932003132.db2.gz GVAIMBUNICHBCJ-DYVFJYSZSA-N 0 3 413.465 4.262 20 0 HIADHN CC[C@H](NCc1cc(OC)cc2c1O[C@H](C)C2)[C@@H](c1ccc(C)cc1)n1cncn1 ZINC000533742866 932003380 /nfs/dbraw/zinc/00/33/80/932003380.db2.gz LFPMRVMQQZNQOB-MQNAVGNWSA-N 0 3 406.530 4.076 20 0 HIADHN CC[C@H](NCc1cc(OC)cc2c1O[C@@H](C)C2)[C@H](c1ccc(C)cc1)n1cncn1 ZINC000533742925 932003624 /nfs/dbraw/zinc/00/36/24/932003624.db2.gz LFPMRVMQQZNQOB-RTFZILSDSA-N 0 3 406.530 4.076 20 0 HIADHN C[C@@H](Oc1ccc(C(=O)NC[C@@H](Cc2ccccc2)N(C)C)cn1)c1ccccc1 ZINC000533808969 932041282 /nfs/dbraw/zinc/04/12/82/932041282.db2.gz TWDXQJVJJFKEOE-AUSIDOKSSA-N 0 3 403.526 4.124 20 0 HIADHN C[C@H](Oc1ccc(C(=O)NC[C@@H](Cc2ccccc2)N(C)C)cn1)c1ccccc1 ZINC000533808972 932041940 /nfs/dbraw/zinc/04/19/40/932041940.db2.gz TWDXQJVJJFKEOE-WMZHIEFXSA-N 0 3 403.526 4.124 20 0 HIADHN CN(C)[C@H](CNC(=O)N1CCC[C@@H](c2nc3ccccc3s2)C1)Cc1ccccc1 ZINC000533809688 932042564 /nfs/dbraw/zinc/04/25/64/932042564.db2.gz UGHZAHMZNDYERL-UXHICEINSA-N 0 3 422.598 4.358 20 0 HIADHN CC(C)CC(=O)Nc1ccc(Cl)c(C(=O)NC[C@H](Cc2ccccc2)N(C)C)c1 ZINC000533814462 932044242 /nfs/dbraw/zinc/04/42/42/932044242.db2.gz COYFFLKUMWCAAI-IBGZPJMESA-N 0 3 415.965 4.227 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)c1ccc(C(=O)N(C)c2ccccc2)cc1 ZINC000533833764 932051640 /nfs/dbraw/zinc/05/16/40/932051640.db2.gz YUQWMLFGSNXYHL-UHFFFAOYSA-N 0 3 421.566 4.229 20 0 HIADHN CN1CC[C@@H](NC(=O)NCc2cccc(NC(=O)C3CCCC3)c2)[C@@H]1c1ccccc1 ZINC000533890788 932084192 /nfs/dbraw/zinc/08/41/92/932084192.db2.gz IORQJFWCWZZRQC-PKTZIBPZSA-N 0 3 420.557 4.060 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1)c1ccc(OCC(F)(F)F)cc1 ZINC000533891453 932084917 /nfs/dbraw/zinc/08/49/17/932084917.db2.gz QKYRZTNPSXBVOY-CWFSZBLJSA-N 0 3 421.463 4.433 20 0 HIADHN CN1CC[C@H](NC(=O)N2CCO[C@H](c3ccc(F)c(Cl)c3)C2)[C@@H]1c1ccccc1 ZINC000533948757 932122239 /nfs/dbraw/zinc/12/22/39/932122239.db2.gz IXEDDUDFPLAVTR-ACRUOGEOSA-N 0 3 417.912 4.007 20 0 HIADHN CCc1ccc(-c2nc(CC(=O)N[C@@H]3CCN(C)[C@H]3c3ccccc3)cs2)cc1 ZINC000534018513 932199201 /nfs/dbraw/zinc/19/92/01/932199201.db2.gz IZZAUPFPSYMEJL-GGAORHGYSA-N 0 3 405.567 4.477 20 0 HIADHN Clc1cc(Br)cc2c1CC[C@@H]2NCc1cccc(-n2cncn2)c1 ZINC000534058568 932237063 /nfs/dbraw/zinc/23/70/63/932237063.db2.gz DVTYSEQCYBRNTN-SFHVURJKSA-N 0 3 403.711 4.460 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N2CCCC[C@@H]2CCc2ccccc2)CC1 ZINC000534073355 932252441 /nfs/dbraw/zinc/25/24/41/932252441.db2.gz WZAYYZQTWVTOOM-HSZRJFAPSA-N 0 3 401.595 4.073 20 0 HIADHN CN1CC[C@@H](NC(=O)CCc2ncc(-c3ccc(Cl)cc3)o2)[C@H]1c1ccccc1 ZINC000534107878 932282409 /nfs/dbraw/zinc/28/24/09/932282409.db2.gz YFCHQPSEOCSEGJ-AUSIDOKSSA-N 0 3 409.917 4.489 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)N[C@@H]1CCN(C)[C@H]1c1ccc(Cl)cc1 ZINC000534125761 932292526 /nfs/dbraw/zinc/29/25/26/932292526.db2.gz XCDUTMBOAMYVDT-CTNGQTDRSA-N 0 3 411.933 4.323 20 0 HIADHN CC[C@@H](C)n1ncc(C(=O)Nc2cccc(CN3CCC(CO)CC3)c2)c1C1CC1 ZINC000534148223 932302579 /nfs/dbraw/zinc/30/25/79/932302579.db2.gz ZFJPXOXOJPUKMD-QGZVFWFLSA-N 0 3 410.562 4.188 20 0 HIADHN O=C(N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1CO)c1ccc(Oc2ccccc2)cc1 ZINC000534182688 932320287 /nfs/dbraw/zinc/32/02/87/932320287.db2.gz RKKUMJPJYCVQLU-RCZVLFRGSA-N 0 3 416.521 4.092 20 0 HIADHN Cc1ccc(-c2nc(C(=O)N(CCN(C)C)Cc3cccc(O)c3)cs2)c(C)c1 ZINC000534190073 932323091 /nfs/dbraw/zinc/32/30/91/932323091.db2.gz HMQJMKBMEPPASS-UHFFFAOYSA-N 0 3 409.555 4.337 20 0 HIADHN C[C@H](Cc1cccc(C(F)(F)F)c1)C(=O)N(CCN(C)C)Cc1cccc(O)c1 ZINC000534192578 932324308 /nfs/dbraw/zinc/32/43/08/932324308.db2.gz OGIDDHSSTIOGEI-MRXNPFEDSA-N 0 3 408.464 4.180 20 0 HIADHN COCCn1nc(C)c(NC(=O)C(Cc2c(C)cc(C)cc2C)C(F)(F)F)c1C ZINC000534414554 932434395 /nfs/dbraw/zinc/43/43/95/932434395.db2.gz BRPMQSUNDAERLG-GOSISDBHSA-N 0 3 411.468 4.431 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@H](C)NCc2cnc([C@H]3CCCO3)s2)CC1 ZINC000534465470 932482735 /nfs/dbraw/zinc/48/27/35/932482735.db2.gz OQVFHOWNBVWWNH-HRAATJIYSA-N 0 3 418.582 4.126 20 0 HIADHN Cc1cc(C)c(CC(C(=O)Nc2nc3c(s2)CN(C)CC3)C(F)(F)F)c(C)c1 ZINC000534469730 932493241 /nfs/dbraw/zinc/49/32/41/932493241.db2.gz OBNVGIXVLUOASZ-OAHLLOKOSA-N 0 3 411.493 4.416 20 0 HIADHN Cc1cc(C)c(CC(C(=O)Nc2ccnn2-c2ccc(C)nn2)C(F)(F)F)c(C)c1 ZINC000534475095 932505296 /nfs/dbraw/zinc/50/52/96/932505296.db2.gz UGQLXYYJJXFHIR-QGZVFWFLSA-N 0 3 417.435 4.256 20 0 HIADHN Cc1ccc(-c2ccc(C(=O)Nc3ccc(=O)n(CCN(C)C)c3)c(F)c2)cc1C ZINC000534491768 932529535 /nfs/dbraw/zinc/52/95/35/932529535.db2.gz QYVOOMVKNZRONI-UHFFFAOYSA-N 0 3 407.489 4.085 20 0 HIADHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)C1CCC(F)(F)CC1 ZINC000534612058 932596107 /nfs/dbraw/zinc/59/61/07/932596107.db2.gz RSSDCXFWPODFPD-UHFFFAOYSA-N 0 3 403.311 4.165 20 0 HIADHN Cc1c([C@H](C)NC(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)cnn1-c1ccc(F)cc1 ZINC000534682907 932653442 /nfs/dbraw/zinc/65/34/42/932653442.db2.gz PVMFVUVLFGVQIN-IRBZQWRBSA-N 0 3 421.520 4.125 20 0 HIADHN Cc1ccc(-c2nc(C(=O)N3CCCN(CCCc4ccccc4)CC3)cs2)n1C ZINC000534697400 932668789 /nfs/dbraw/zinc/66/87/89/932668789.db2.gz UOOVXBXJOKRFCR-UHFFFAOYSA-N 0 3 422.598 4.238 20 0 HIADHN Cc1cccc(NC(=O)N2CCC[C@@H](C(=O)Nc3cc(C)cc(CN(C)C)c3)C2)c1 ZINC000534707125 932678548 /nfs/dbraw/zinc/67/85/48/932678548.db2.gz QXSRCOZIQSNYRF-HXUWFJFHSA-N 0 3 408.546 4.248 20 0 HIADHN CC[C@H](NC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1)c1nc(-c2ccccc2)c[nH]1 ZINC000534713651 932682562 /nfs/dbraw/zinc/68/25/62/932682562.db2.gz HEHUWYSKCHRSRI-JAXLGGSGSA-N 0 3 403.530 4.272 20 0 HIADHN CN1CC[C@H](NC(=O)N2CCn3cccc3[C@@H]2c2ccccc2)[C@H]1c1ccccc1 ZINC000534721029 932688503 /nfs/dbraw/zinc/68/85/03/932688503.db2.gz ITTJXYBGNXTISH-QTJGBDASSA-N 0 3 400.526 4.048 20 0 HIADHN CN(C)Cc1cccc(C(=O)Nc2ccnn2Cc2ccc(OC(F)(F)F)cc2)c1 ZINC000534787711 932769127 /nfs/dbraw/zinc/76/91/27/932769127.db2.gz LQXXZDVDZKKYSF-UHFFFAOYSA-N 0 3 418.419 4.144 20 0 HIADHN Clc1cc2c(c(Br)c1)CC[C@H]2NCc1ccc(N2CCOCC2)nc1 ZINC000534792655 932772863 /nfs/dbraw/zinc/77/28/63/932772863.db2.gz ALNWBAKBAPYQBD-GOSISDBHSA-N 0 3 422.754 4.111 20 0 HIADHN COc1ccc(COCCCC(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)cc1 ZINC000534814526 932787458 /nfs/dbraw/zinc/78/74/58/932787458.db2.gz LVJMTNRXPIGFAB-OAQYLSRUSA-N 0 3 410.558 4.115 20 0 HIADHN C[C@H](CNC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1)c1nc(-c2ccccc2)no1 ZINC000534834919 932801008 /nfs/dbraw/zinc/80/10/08/932801008.db2.gz DCQTUXSBPXUJGE-YLJYHZDGSA-N 0 3 422.504 4.008 20 0 HIADHN C[C@@H](CNC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1)c1nc(-c2ccccc2)no1 ZINC000534834916 932801095 /nfs/dbraw/zinc/80/10/95/932801095.db2.gz DCQTUXSBPXUJGE-FXAWDEMLSA-N 0 3 422.504 4.008 20 0 HIADHN COc1cccc([C@@H](CNC(=O)CCCc2cc(F)ccc2F)N2CCCC2)c1 ZINC000534877154 932818684 /nfs/dbraw/zinc/81/86/84/932818684.db2.gz OHURMPHXCZOVIQ-JOCHJYFZSA-N 0 3 402.485 4.249 20 0 HIADHN CC(=O)c1ccc(Oc2ccc(C(=O)NCCCCN3C[C@H](C)O[C@@H](C)C3)cc2)cc1 ZINC000534883023 932821767 /nfs/dbraw/zinc/82/17/67/932821767.db2.gz SIOSZGZSTKQFGZ-OALUTQOASA-N 0 3 424.541 4.301 20 0 HIADHN COc1ccc(C[C@H](C)CN(C)CC(=O)Nc2ccc(N3CCCC3)cc2C)cc1 ZINC000534906014 932832623 /nfs/dbraw/zinc/83/26/23/932832623.db2.gz KBQQYUNZJMXTIP-IBGZPJMESA-N 0 3 409.574 4.353 20 0 HIADHN O=S1(=O)CCC(CN2CCC(CCc3cccc(C(F)(F)F)c3)CC2)CC1 ZINC000535052855 932892540 /nfs/dbraw/zinc/89/25/40/932892540.db2.gz ZCGZDVADQBAEFD-UHFFFAOYSA-N 0 3 403.510 4.175 20 0 HIADHN CC(C)c1nn(-c2ccc(Br)cc2)cc1CN1CCC(CCO)CC1 ZINC000535069083 932896932 /nfs/dbraw/zinc/89/69/32/932896932.db2.gz RUNDLIWZCDCWOD-UHFFFAOYSA-N 0 3 406.368 4.353 20 0 HIADHN COc1cc(CN2C3CCC2CC3)ccc1OCC(=O)Nc1ccccc1Cl ZINC000535069228 932897020 /nfs/dbraw/zinc/89/70/20/932897020.db2.gz JXXAQNIHAMRHPF-UHFFFAOYSA-N 0 3 400.906 4.493 20 0 HIADHN CCOc1cc(CN2CCC(C(=O)NCC(F)(F)F)CC2)ccc1OCC(C)C ZINC000535077492 932898197 /nfs/dbraw/zinc/89/81/97/932898197.db2.gz QBBUAIRSZSDLDH-UHFFFAOYSA-N 0 3 416.484 4.011 20 0 HIADHN Cc1c(NC(=O)NC[C@H](Cc2ccccc2)N(C)C)cccc1OCC(F)(F)F ZINC000535258698 933040676 /nfs/dbraw/zinc/04/06/76/933040676.db2.gz WRIZRQZOIPXSRK-KRWDZBQOSA-N 0 3 409.452 4.231 20 0 HIADHN CC1CCN([C@H](CNC(=O)N2CC=C(C(F)(F)F)CC2)c2cccs2)CC1 ZINC000535273108 933044919 /nfs/dbraw/zinc/04/49/19/933044919.db2.gz XDQAARVIQRPKEX-MRXNPFEDSA-N 0 3 401.498 4.425 20 0 HIADHN CCN(C(=O)c1ccnc(OCC(F)F)c1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000535368176 933096660 /nfs/dbraw/zinc/09/66/60/933096660.db2.gz UJQSTZCKQOHQDP-QFBILLFUSA-N 0 3 403.473 4.023 20 0 HIADHN CN(Cc1cc(Br)cs1)C(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000535393361 933112308 /nfs/dbraw/zinc/11/23/08/933112308.db2.gz BYPIILPWNFXGHR-IRXDYDNUSA-N 0 3 408.365 4.097 20 0 HIADHN CC[C@H](NC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1)c1nc(C(F)(F)F)cs1 ZINC000535397934 933115596 /nfs/dbraw/zinc/11/55/96/933115596.db2.gz SHYOQUGXWOBHQQ-OFQRWUPVSA-N 0 3 412.481 4.358 20 0 HIADHN COc1ccccc1[C@H](NC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1)c1ccco1 ZINC000535429503 933130820 /nfs/dbraw/zinc/13/08/20/933130820.db2.gz HJLXWKYOFGDCRZ-VJBMBRPKSA-N 0 3 405.498 4.122 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)C3(c4ccc(F)cc4F)CCCC3)CC2)C[C@H](C)O1 ZINC000535520036 933210997 /nfs/dbraw/zinc/21/09/97/933210997.db2.gz QFSUVUCLBWRVNS-HDICACEKSA-N 0 3 420.544 4.124 20 0 HIADHN COc1ccc(CN([C@@H]2CCN(CC(F)(F)F)C2=O)C2CCCCC2)cc1OC ZINC000535792589 933390096 /nfs/dbraw/zinc/39/00/96/933390096.db2.gz SGLBCROBAVKVFQ-QGZVFWFLSA-N 0 3 414.468 4.002 20 0 HIADHN CCN(CC)[C@H](CNC(=O)[C@H](C)C1CCOCC1)c1ccc(C(F)(F)F)cc1 ZINC000535882839 933463485 /nfs/dbraw/zinc/46/34/85/933463485.db2.gz LRNIKBBBIKXCGX-DNVCBOLYSA-N 0 3 400.485 4.267 20 0 HIADHN Cc1cc(C)c(CC(C(=O)Nc2sccc2S(C)(=O)=O)C(F)(F)F)c(C)c1 ZINC000535966228 933527980 /nfs/dbraw/zinc/52/79/80/933527980.db2.gz LHDCYEGMMCLLMP-AWEZNQCLSA-N 0 3 419.490 4.437 20 0 HIADHN Cc1nc2ccccc2n1C[C@H]1CCCN1CC(=O)N[C@@H](c1ccccc1)C1CC1 ZINC000535966167 933528174 /nfs/dbraw/zinc/52/81/74/933528174.db2.gz XZDSFRYVAIIPRO-BWKNWUBXSA-N 0 3 402.542 4.077 20 0 HIADHN CC(=O)c1ccc2c(c1)CCN(CCC(=O)Nc1ccccc1C(F)(F)F)CC2 ZINC000535967542 933529447 /nfs/dbraw/zinc/52/94/47/933529447.db2.gz ULUGQZZAGKIHMJ-UHFFFAOYSA-N 0 3 404.432 4.337 20 0 HIADHN CN(C)c1ccc(C(F)(F)F)cc1NC(=O)NC[C@@H](Cc1ccccc1)N(C)C ZINC000536012675 933570655 /nfs/dbraw/zinc/57/06/55/933570655.db2.gz IHBUAZILMVZBTR-QGZVFWFLSA-N 0 3 408.468 4.066 20 0 HIADHN CN1CC[C@@H](NC(=O)NCc2cccc(COCc3ccco3)c2)[C@@H]1c1ccccc1 ZINC000536094053 933643951 /nfs/dbraw/zinc/64/39/51/933643951.db2.gz CMXIAZOORNQSPC-RPWUZVMVSA-N 0 3 419.525 4.241 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)c2ccc(F)cc2Br)cc1 ZINC000536095025 933644906 /nfs/dbraw/zinc/64/49/06/933644906.db2.gz LCVPITALBXBXCL-IBGZPJMESA-N 0 3 421.310 4.164 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)CCc2ncc(-c3ccccc3)o2)cc1 ZINC000536096514 933648752 /nfs/dbraw/zinc/64/87/52/933648752.db2.gz RTPFESJRMVXIEJ-QFIPXVFZSA-N 0 3 419.525 4.236 20 0 HIADHN CC[C@H](NCCCS(=O)(=O)c1ccccc1)c1cc(F)cc(Br)c1 ZINC000537295530 933702217 /nfs/dbraw/zinc/70/22/17/933702217.db2.gz MFIOPPGZJSTPTJ-SFHVURJKSA-N 0 3 414.340 4.493 20 0 HIADHN COc1ccc([C@@H](C)NC2CCN(C(=O)c3ccco3)CC2)c(Br)c1 ZINC000537295673 933702355 /nfs/dbraw/zinc/70/23/55/933702355.db2.gz KWKDUEYRZRRECE-CYBMUJFWSA-N 0 3 407.308 4.006 20 0 HIADHN CCC1(CC)[C@H](N[C@H](c2ccccc2)c2cccc(S(C)(=O)=O)c2)C[C@H]1OC ZINC000537296954 933703046 /nfs/dbraw/zinc/70/30/46/933703046.db2.gz ZMPPGDASEHGAEG-YPAWHYETSA-N 0 3 401.572 4.363 20 0 HIADHN CC[C@@H](NCc1cccc(OCC(=O)OC)c1)c1cc(F)cc(Br)c1 ZINC000537306267 933707528 /nfs/dbraw/zinc/70/75/28/933707528.db2.gz FSXRKWXRTRPBON-GOSISDBHSA-N 0 3 410.283 4.381 20 0 HIADHN C[C@H](N[C@H]1CCC[C@@H](S(C)(=O)=O)C1)c1cc2cc(Br)ccc2o1 ZINC000537307074 933707781 /nfs/dbraw/zinc/70/77/81/933707781.db2.gz KMGKPYSESIQAPC-TUKIKUTGSA-N 0 3 400.338 4.202 20 0 HIADHN CCC(CC)n1nc(C(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)cc1C ZINC000537356692 933733454 /nfs/dbraw/zinc/73/34/54/933733454.db2.gz KIJIWHGIIPOGRT-NRFANRHFSA-N 0 3 420.561 4.448 20 0 HIADHN Cc1ccc(N[C@H]2CCN(Cc3ccccn3)C[C@H]2C)cc1I ZINC000537406513 933761612 /nfs/dbraw/zinc/76/16/12/933761612.db2.gz KEMIHDWWEVXCFF-BEFAXECRSA-N 0 3 421.326 4.317 20 0 HIADHN CCN1CCN(c2ccc(N[C@H](C)c3nnn(-c4ccccc4)c3C)c(C)c2)CC1 ZINC000537406341 933761673 /nfs/dbraw/zinc/76/16/73/933761673.db2.gz CTHPSTAZJSRVPO-LJQANCHMSA-N 0 3 404.562 4.199 20 0 HIADHN CCN1CCN(Cc2ccc(N[C@@H](C)c3ccc4c(c3)C(C)(C)C(=O)N4)cc2)CC1 ZINC000537434420 933774000 /nfs/dbraw/zinc/77/40/00/933774000.db2.gz NPKDYOSFCWWEJB-SFHVURJKSA-N 0 3 406.574 4.227 20 0 HIADHN CC(C)[C@@H](c1ccc(F)cc1)N(C)Cc1cc(=O)n2cc(Br)ccc2n1 ZINC000562425348 945072879 /nfs/dbraw/zinc/07/28/79/945072879.db2.gz QAOJXIRPXGYJFD-FQEVSTJZSA-N 0 3 418.310 4.425 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2CN2CCC(O[C@H]3CCOC3)CC2)o1 ZINC000562857883 945128228 /nfs/dbraw/zinc/12/82/28/945128228.db2.gz YDLHBEMRQROKAV-QFIPXVFZSA-N 0 3 407.514 4.211 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2CN2CCC[C@@H](C(=O)N3CCCC3)C2)o1 ZINC000537631077 938341486 /nfs/dbraw/zinc/34/14/86/938341486.db2.gz WWHAMSFXXRMMDL-HXUWFJFHSA-N 0 3 418.541 4.275 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2CN2CCC[C@H](C(=O)N3CCCC3)C2)o1 ZINC000537631074 938341579 /nfs/dbraw/zinc/34/15/79/938341579.db2.gz WWHAMSFXXRMMDL-FQEVSTJZSA-N 0 3 418.541 4.275 20 0 HIADHN CCO[C@@H]1C[C@@H](O)C12CCN(Cc1cn(-c3ccc(C)cc3)nc1C(C)(C)C)CC2 ZINC000537635474 938341821 /nfs/dbraw/zinc/34/18/21/938341821.db2.gz WQTFTJUFCSMUCT-FGZHOGPDSA-N 0 3 411.590 4.230 20 0 HIADHN C[C@H]1Oc2ccc(C(=O)C3CCN(Cc4ccc5ncccc5c4)CC3)cc2NC1=O ZINC000537637704 938342911 /nfs/dbraw/zinc/34/29/11/938342911.db2.gz NNOLMPVQKXAZPC-MRXNPFEDSA-N 0 3 415.493 4.049 20 0 HIADHN CC(C)N1CCN([C@@H]2CCN(Cc3cc(Cl)ccc3OC3CCCC3)C2)CC1 ZINC000537660023 938348635 /nfs/dbraw/zinc/34/86/35/938348635.db2.gz ZYCBMWVXXPYCGG-OAQYLSRUSA-N 0 3 406.014 4.262 20 0 HIADHN CCCOc1c(Cl)cc(CN2CC[C@@H](N3CCN(C(C)C)CC3)C2)cc1OCC ZINC000537660933 938349149 /nfs/dbraw/zinc/34/91/49/938349149.db2.gz JPFANGKLGGKRIW-HXUWFJFHSA-N 0 3 424.029 4.128 20 0 HIADHN CC[C@](C)(COc1ncccc1Cl)NCC(=O)N(C)c1nc2ccccc2s1 ZINC000537682488 938353310 /nfs/dbraw/zinc/35/33/10/938353310.db2.gz VGTOSPBKCIRCFP-HXUWFJFHSA-N 0 3 418.950 4.145 20 0 HIADHN COc1cc(CN2CCCCC[C@H]2/C=C/c2ccccc2)cc(OC)c1OCC(N)=O ZINC000537709819 938361216 /nfs/dbraw/zinc/36/12/16/938361216.db2.gz JQNUNDGCIBCHSI-IWGBCORSSA-N 0 3 424.541 4.026 20 0 HIADHN Cc1ccc(NC(=O)C[C@@H](C)N[C@@H]2CC(=O)N(c3c(F)cccc3F)C2)c(Cl)c1 ZINC000537767598 938372994 /nfs/dbraw/zinc/37/29/94/938372994.db2.gz KHAJHSRFJRNGMX-ZIAGYGMSSA-N 0 3 421.875 4.039 20 0 HIADHN C[C@H](N[C@H]1CCN(c2cnn(C)c2)C1=O)c1ccc(-c2ccc(Cl)cc2)s1 ZINC000537774093 938373969 /nfs/dbraw/zinc/37/39/69/938373969.db2.gz LNTBCAFYMZRURK-GUYCJALGSA-N 0 3 400.935 4.258 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)NCc1cc(Cl)sc1Cl ZINC000537819374 938383571 /nfs/dbraw/zinc/38/35/71/938383571.db2.gz YWVOSFOJULTZLZ-UHFFFAOYSA-N 0 3 404.338 4.467 20 0 HIADHN C[C@H](CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)NCc1cccc(N(C)C)n1 ZINC000537938987 938424348 /nfs/dbraw/zinc/42/43/48/938424348.db2.gz YZLPQILOZJYLNQ-GFCCVEGCSA-N 0 3 414.859 4.327 20 0 HIADHN Cc1cccc(NC(=O)C[C@H](C)N[C@@H](c2ccc(Cl)cc2)[C@H]2CN(C)CCO2)c1 ZINC000537943244 938426341 /nfs/dbraw/zinc/42/63/41/938426341.db2.gz HIVTWFPZUKRAJG-LXBDKUERSA-N 0 3 415.965 4.027 20 0 HIADHN C[C@H](NCCOc1cccc(C(F)(F)F)n1)c1ccc(-n2cncn2)cc1Cl ZINC000537950699 938429487 /nfs/dbraw/zinc/42/94/87/938429487.db2.gz IYNHAXIYBWZIHH-LBPRGKRZSA-N 0 3 411.815 4.064 20 0 HIADHN C[C@H]1Cc2ccccc2[C@H]1NCc1ccc(Br)cc1N1CCOCC1 ZINC000537957340 938432285 /nfs/dbraw/zinc/43/22/85/938432285.db2.gz BHHCHDLMXAULIR-BTYIYWSLSA-N 0 3 401.348 4.309 20 0 HIADHN C[C@@H](NC[C@@H]1CCCN(c2nccn3cnnc23)C1)c1cc(Cl)sc1Cl ZINC000537959436 938434058 /nfs/dbraw/zinc/43/40/58/938434058.db2.gz GVWIZCOASNIVAV-NEPJUHHUSA-N 0 3 411.362 4.060 20 0 HIADHN C[C@H](NC[C@@H](O)COc1ccccc1Br)c1ccc2ccccc2n1 ZINC000537959350 938434302 /nfs/dbraw/zinc/43/43/02/938434302.db2.gz CSUYDELJLAJUQW-GOEBONIOSA-N 0 3 401.304 4.088 20 0 HIADHN Fc1ccc2c(c1)[C@H](NCc1ccc(Br)cc1N1CCOCC1)CC2 ZINC000537964681 938437008 /nfs/dbraw/zinc/43/70/08/938437008.db2.gz ZNNQFRRSNWIVFK-LJQANCHMSA-N 0 3 405.311 4.202 20 0 HIADHN CCc1noc(-c2ccc(CCN[C@@H](C)c3nnn(-c4ccc(C)cc4)c3C)cc2)n1 ZINC000537977548 938444709 /nfs/dbraw/zinc/44/47/09/938444709.db2.gz LZPZFMBQTIZSSP-KRWDZBQOSA-N 0 3 416.529 4.390 20 0 HIADHN C[C@@H](N[C@H]1CCN(c2ccc(Cl)cc2)C1=O)c1ccc(OCc2nccn2C)cc1 ZINC000537983013 938447298 /nfs/dbraw/zinc/44/72/98/938447298.db2.gz TWXYQEBCYGWVBU-IERDGZPVSA-N 0 3 424.932 4.109 20 0 HIADHN C[C@@H](NCC1(CS(C)(=O)=O)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000538019949 938465122 /nfs/dbraw/zinc/46/51/22/938465122.db2.gz RSQHWXFKSYVOSN-SNVBAGLBSA-N 0 3 403.388 4.200 20 0 HIADHN C[C@H](N[C@H]1CC(=O)N(c2cccc(C(F)(F)F)c2)C1)c1ccc2c(c1)CCC(=O)N2 ZINC000538021838 938466933 /nfs/dbraw/zinc/46/69/33/938466933.db2.gz UZZCTWLMSRTFTD-GUYCJALGSA-N 0 3 417.431 4.046 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N[C@H](COC)c1ccc(F)c(F)c1)c1ccsc1 ZINC000538036866 938476608 /nfs/dbraw/zinc/47/66/08/938476608.db2.gz CDMSEBPFSPFIJZ-MOPGFXCFSA-N 0 3 411.518 4.096 20 0 HIADHN COc1ccccc1[C@@H](NCc1cccc(OCCN2CCOCC2)c1)C1CCCC1 ZINC000538101549 938503172 /nfs/dbraw/zinc/50/31/72/938503172.db2.gz VYWCCZIRUDWQKM-SANMLTNESA-N 0 3 424.585 4.427 20 0 HIADHN Cc1ccc2[nH]c([C@H]3CCCN([C@@H](C)C(=O)N4CCc5ccccc5C4)C3)nc2c1 ZINC000538120073 938508166 /nfs/dbraw/zinc/50/81/66/938508166.db2.gz MNSLRSZHJVDUPZ-RXVVDRJESA-N 0 3 402.542 4.024 20 0 HIADHN Cc1ccc2nc([C@H]3CCCN([C@@H](C)C(=O)N4CCc5ccccc5C4)C3)[nH]c2c1 ZINC000538120073 938508170 /nfs/dbraw/zinc/50/81/70/938508170.db2.gz MNSLRSZHJVDUPZ-RXVVDRJESA-N 0 3 402.542 4.024 20 0 HIADHN Cc1ccc2[nH]c([C@@H]3CCCN([C@H](C)C(=O)N4CCc5ccccc5C4)C3)nc2c1 ZINC000538120074 938508440 /nfs/dbraw/zinc/50/84/40/938508440.db2.gz MNSLRSZHJVDUPZ-WIYYLYMNSA-N 0 3 402.542 4.024 20 0 HIADHN Cc1ccc2nc([C@@H]3CCCN([C@H](C)C(=O)N4CCc5ccccc5C4)C3)[nH]c2c1 ZINC000538120074 938508444 /nfs/dbraw/zinc/50/84/44/938508444.db2.gz MNSLRSZHJVDUPZ-WIYYLYMNSA-N 0 3 402.542 4.024 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(OCc2cccnc2)cc1)C(=O)N(C)Cc1ccccc1 ZINC000538124812 938511903 /nfs/dbraw/zinc/51/19/03/938511903.db2.gz NYAXQGQSZVZSII-VQTJNVASSA-N 0 3 403.526 4.358 20 0 HIADHN COc1cc([C@H](C)NCC[S@](=O)c2ccccc2)ccc1OCc1ccncc1 ZINC000538154273 938525483 /nfs/dbraw/zinc/52/54/83/938525483.db2.gz BKSCPIPEYCAFIF-YRVHBCJASA-N 0 3 410.539 4.128 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(OCC(F)(F)F)cc1)C(=O)NC(=O)Nc1ccccc1 ZINC000538163007 938531288 /nfs/dbraw/zinc/53/12/88/938531288.db2.gz HYJVXAILHLHZQE-UONOGXRCSA-N 0 3 409.408 4.015 20 0 HIADHN CC(C)(C)C[C@@H](NCC(=O)Nc1cccc(C(=O)NC2CC2)c1)c1ccc(F)cc1 ZINC000538171407 938534606 /nfs/dbraw/zinc/53/46/06/938534606.db2.gz PJTWUEFCIXROIR-OAQYLSRUSA-N 0 3 411.521 4.424 20 0 HIADHN CCC(CC)[C@H](NCC(=O)Nc1ccc(CN2CCOCC2)cc1)c1cccs1 ZINC000538177129 938537561 /nfs/dbraw/zinc/53/75/61/938537561.db2.gz QKAMJJUPRJLGSS-QHCPKHFHSA-N 0 3 415.603 4.286 20 0 HIADHN C[C@H](N[C@@H](C)c1cccc(-n2cccn2)c1)C(=O)Nc1nc2ccc(F)cc2s1 ZINC000538187046 938542905 /nfs/dbraw/zinc/54/29/05/938542905.db2.gz FYBPBUCZSZTEDS-KBPBESRZSA-N 0 3 409.490 4.299 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(NC(=O)c2ccncc2)cc1)C(=O)NC1CCC(C)CC1 ZINC000538187878 938544155 /nfs/dbraw/zinc/54/41/55/938544155.db2.gz JTXFSWVIVQXINL-UISNHOIMSA-N 0 3 408.546 4.068 20 0 HIADHN CC(C)[C@H](NCc1cccc(S(=O)(=O)N(C)C)c1)c1ccc(C(F)(F)F)cc1 ZINC000538226321 938565026 /nfs/dbraw/zinc/56/50/26/938565026.db2.gz NRRYTDSIDGVVDA-IBGZPJMESA-N 0 3 414.493 4.443 20 0 HIADHN Cc1cc(NC(=O)CN[C@@H](c2cccc(C)c2)C(C)(C)C)n(-c2nc(C)cc(C)n2)n1 ZINC000538234921 938568675 /nfs/dbraw/zinc/56/86/75/938568675.db2.gz MBRTWSLYDRVJSF-QFIPXVFZSA-N 0 3 420.561 4.211 20 0 HIADHN Cc1cccc([C@@H](NCC(=O)NCC(=O)Nc2c(C)cc(C)cc2C)C(C)(C)C)c1 ZINC000538236001 938569307 /nfs/dbraw/zinc/56/93/07/938569307.db2.gz AFRXGTBEEGJNMG-XMMPIXPASA-N 0 3 409.574 4.352 20 0 HIADHN CCN(CC)CCN(C(=O)[C@@H]1CCC(=O)[C@@H](C)C1)c1cccc(Br)c1 ZINC000538256820 938576145 /nfs/dbraw/zinc/57/61/45/938576145.db2.gz QGIRKKWNDRGHIK-JKSUJKDBSA-N 0 3 409.368 4.129 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)c3c(C)nc4ccccc4c3C)cc2)CC1 ZINC000538283266 938582853 /nfs/dbraw/zinc/58/28/53/938582853.db2.gz SKVISFLTORBPRE-UHFFFAOYSA-N 0 3 402.542 4.241 20 0 HIADHN C[C@H](CCCc1ccccc1)C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000538299845 938587204 /nfs/dbraw/zinc/58/72/04/938587204.db2.gz WPNAHNXTIPIHJN-HXUWFJFHSA-N 0 3 412.549 4.444 20 0 HIADHN O[C@@H](CNCc1cn(-c2ccccc2)nc1-c1cccs1)COc1ccccc1 ZINC000538311752 938590090 /nfs/dbraw/zinc/59/00/90/938590090.db2.gz NIRYVXNZDGFBLQ-FQEVSTJZSA-N 0 3 405.523 4.130 20 0 HIADHN CCN(CC)C(=O)c1cccc(NC(=O)CN[C@H](c2ccc(F)c(C)c2)C2CC2)c1 ZINC000538321349 938592035 /nfs/dbraw/zinc/59/20/35/938592035.db2.gz BKTXXJDTRAOLEG-QHCPKHFHSA-N 0 3 411.521 4.296 20 0 HIADHN CC[C@H](NCc1csc(CC(=O)Nc2cc(C)ccc2C)n1)C1CCOCC1 ZINC000538321832 938592196 /nfs/dbraw/zinc/59/21/96/938592196.db2.gz CHHPVVPBSJYBLM-IBGZPJMESA-N 0 3 401.576 4.236 20 0 HIADHN COc1ccc(OC)c([C@@H](C)NC(=O)CN[C@H](c2ccc(F)c(C)c2)C2CC2)c1 ZINC000538324533 938593127 /nfs/dbraw/zinc/59/31/27/938593127.db2.gz VXDYDQSDCBUQKL-CMJOXMDJSA-N 0 3 400.494 4.069 20 0 HIADHN CSc1ccc(C)c(NC(=O)NCCCN2CCN(C)C[C@@H]2c2ccccc2)c1 ZINC000538325402 938593524 /nfs/dbraw/zinc/59/35/24/938593524.db2.gz XBEHOJTYQFYUSY-JOCHJYFZSA-N 0 3 412.603 4.217 20 0 HIADHN O=C(CN[C@H](c1ccc2c(c1)OCCO2)C1CC1)N(Cc1ccco1)c1ccccc1 ZINC000538388802 938608993 /nfs/dbraw/zinc/60/89/93/938608993.db2.gz CPNFWGCPEBORGQ-VWLOTQADSA-N 0 3 418.493 4.325 20 0 HIADHN CCc1cc(N2CCC(N[C@H](C)c3ccc(OC)cc3Br)CC2)ncn1 ZINC000538395985 938610677 /nfs/dbraw/zinc/61/06/77/938610677.db2.gz USSGCRZDCAIEDX-CQSZACIVSA-N 0 3 419.367 4.130 20 0 HIADHN CCOc1cccc2cc([C@@H](C)NCc3cccc(OCCN4CCOCC4)c3)oc21 ZINC000538398781 938611216 /nfs/dbraw/zinc/61/12/16/938611216.db2.gz TZSWSYCRILEZCG-LJQANCHMSA-N 0 3 424.541 4.393 20 0 HIADHN C[C@H](N[C@H]1CCO[C@@H]1c1ccc(F)c(F)c1)c1ccc(-n2cncn2)cc1Cl ZINC000538406221 938612942 /nfs/dbraw/zinc/61/29/42/938612942.db2.gz TWVPRJMVLFRTJL-OCCQLPPTSA-N 0 3 404.848 4.380 20 0 HIADHN C[C@H](N[C@H]1CCO[C@H]1c1ccc(F)c(F)c1)c1ccc(-n2cncn2)cc1Cl ZINC000538406222 938613031 /nfs/dbraw/zinc/61/30/31/938613031.db2.gz TWVPRJMVLFRTJL-OUWQEXSBSA-N 0 3 404.848 4.380 20 0 HIADHN OCCOc1ccc(CNCc2cn(-c3ccccc3)nc2-c2cccs2)cc1 ZINC000538410104 938613982 /nfs/dbraw/zinc/61/39/82/938613982.db2.gz WOIGFULYGXWIGS-UHFFFAOYSA-N 0 3 405.523 4.262 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)c3cc(C)n(C4CCCCC4)n3)cc2)CC1 ZINC000538460294 938627399 /nfs/dbraw/zinc/62/73/99/938627399.db2.gz ZVQHPQBTWZOUNJ-UHFFFAOYSA-N 0 3 409.578 4.087 20 0 HIADHN COc1cccc(N2CC[C@H](NCc3cc(OC)ccc3OCc3ccccn3)C2)c1 ZINC000538499161 938636206 /nfs/dbraw/zinc/63/62/06/938636206.db2.gz XKQRNHGCMJKSOS-FQEVSTJZSA-N 0 3 419.525 4.046 20 0 HIADHN COc1cccc(N2CC[C@@H](NCc3cc(OC)ccc3OCc3ccccn3)C2)c1 ZINC000538499162 938636272 /nfs/dbraw/zinc/63/62/72/938636272.db2.gz XKQRNHGCMJKSOS-HXUWFJFHSA-N 0 3 419.525 4.046 20 0 HIADHN Cc1cc(C(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)nn1[C@H](C)C1CC1 ZINC000538523386 938641204 /nfs/dbraw/zinc/64/12/04/938641204.db2.gz VMGTZTSAIHDVFW-MRXNPFEDSA-N 0 3 422.495 4.385 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)Cc1c(C)cccc1C ZINC000538565678 938650805 /nfs/dbraw/zinc/65/08/05/938650805.db2.gz BYGJPBOYURVISH-JOCHJYFZSA-N 0 3 402.542 4.437 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)Cc1c(C)cccc1C ZINC000538565681 938650841 /nfs/dbraw/zinc/65/08/41/938650841.db2.gz BYGJPBOYURVISH-QFIPXVFZSA-N 0 3 402.542 4.437 20 0 HIADHN NC(=O)[C@H](N[C@@H]1CC=C(c2ccc(F)cc2)CC1)c1cccc(Br)c1 ZINC000538655173 938674601 /nfs/dbraw/zinc/67/46/01/938674601.db2.gz OMWZQUTUWLWSJB-RTBURBONSA-N 0 3 403.295 4.340 20 0 HIADHN COc1cc(CN2CCC[C@H](CC(N)=O)C2)ccc1OCc1ccc(Cl)cc1 ZINC000538722989 938691535 /nfs/dbraw/zinc/69/15/35/938691535.db2.gz DXLRHSHELZGKCZ-QGZVFWFLSA-N 0 3 402.922 4.015 20 0 HIADHN CC(=O)Nc1ccc(CN(Cc2cc(C)nc(N3CCCCC3)n2)CC(C)C)cc1 ZINC000538724699 938692664 /nfs/dbraw/zinc/69/26/64/938692664.db2.gz XFJIEWRERJAMHW-UHFFFAOYSA-N 0 3 409.578 4.392 20 0 HIADHN COC(=O)[C@H]1CC12CCN(Cc1cn(Cc3ccccc3)nc1-c1cccs1)CC2 ZINC000538726858 938693095 /nfs/dbraw/zinc/69/30/95/938693095.db2.gz BMSZYMPNVZBQLD-HXUWFJFHSA-N 0 3 421.566 4.435 20 0 HIADHN COc1cc(CN2CC[C@@H](Cc3cnn(C)c3)C2)cc(OC)c1OCc1ccccc1 ZINC000538729075 938694453 /nfs/dbraw/zinc/69/44/53/938694453.db2.gz PMBWJXNJRWWEIF-FQEVSTJZSA-N 0 3 421.541 4.081 20 0 HIADHN CC(C)(C)C(=O)NC[C@H]1CCCN(CC2=Cc3cc(Br)ccc3OC2)C1 ZINC000538733247 938695669 /nfs/dbraw/zinc/69/56/69/938695669.db2.gz BWXMHGMZXCPHIC-OAHLLOKOSA-N 0 3 421.379 4.099 20 0 HIADHN CC(C)(C)c1nn(Cc2ccccc2)cc1CN1CCC(CN2CCCCC2=O)CC1 ZINC000538737236 938697456 /nfs/dbraw/zinc/69/74/56/938697456.db2.gz OPIROAMBRCUKNW-UHFFFAOYSA-N 0 3 422.617 4.453 20 0 HIADHN CCOc1c(OC)cc(CN2CCC[C@H]2Cn2c(C)nc3ccccc32)cc1OC ZINC000538762813 938704880 /nfs/dbraw/zinc/70/48/80/938704880.db2.gz LLYAOOMCYMFVNT-IBGZPJMESA-N 0 3 409.530 4.425 20 0 HIADHN CCOc1c(Br)cc(Br)cc1CN(C)C[C@H]1CCOC1 ZINC000538763294 938704912 /nfs/dbraw/zinc/70/49/12/938704912.db2.gz SQPWWSLTQLCSGX-LLVKDONJSA-N 0 3 407.146 4.079 20 0 HIADHN COc1ccccc1COC1CCN(C(=O)c2oc3ccccc3c2CN(C)C)CC1 ZINC000538807161 938717788 /nfs/dbraw/zinc/71/77/88/938717788.db2.gz PGIFNXIOBNFOSV-UHFFFAOYSA-N 0 3 422.525 4.324 20 0 HIADHN COc1ccc(CN(C(=O)N[C@H]2C[C@H](C)N(C3CC3)C2)C2CCCCC2)cc1OC ZINC000538811765 938719030 /nfs/dbraw/zinc/71/90/30/938719030.db2.gz FMHJFSFTGOVXKQ-HKUYNNGSSA-N 0 3 415.578 4.173 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)c2csc(Br)c2)cc1 ZINC000538830719 938721667 /nfs/dbraw/zinc/72/16/67/938721667.db2.gz MXPRCSMWDQUFJZ-MRXNPFEDSA-N 0 3 409.349 4.086 20 0 HIADHN CC(C)OCc1ccccc1CNCc1c(Cl)cccc1N1CCN(C)CC1 ZINC000538852098 938725133 /nfs/dbraw/zinc/72/51/33/938725133.db2.gz SEFJYPJYJCBHMD-UHFFFAOYSA-N 0 3 401.982 4.307 20 0 HIADHN O=C([C@@H]1CC12CCN(CCOc1cc(Cl)cc(Cl)c1)CC2)N1CCCCC1 ZINC000538901723 938733850 /nfs/dbraw/zinc/73/38/50/938733850.db2.gz XHXVTVGLLBGFTM-IBGZPJMESA-N 0 3 411.373 4.487 20 0 HIADHN CC(=O)c1cccc(OCc2cc(C(=O)Nc3cc(C)cc(CN(C)C)c3)no2)c1 ZINC000538929170 938739556 /nfs/dbraw/zinc/73/95/56/938739556.db2.gz VIHFYERNOWSCHD-UHFFFAOYSA-N 0 3 407.470 4.079 20 0 HIADHN FC(F)(F)c1ccc(O[C@@H]2CCN(CCCc3nc(-c4ccccc4)no3)C2)nc1 ZINC000538959178 938750555 /nfs/dbraw/zinc/75/05/55/938750555.db2.gz OASHBTHONBEOFY-QGZVFWFLSA-N 0 3 418.419 4.236 20 0 HIADHN C[C@@H](CC(=O)N(C)C1CCN(CCc2ccccn2)CC1)Cc1ccc(Cl)cc1 ZINC000538959024 938750563 /nfs/dbraw/zinc/75/05/63/938750563.db2.gz MSRKUHCPAVNLCH-LJQANCHMSA-N 0 3 413.993 4.469 20 0 HIADHN CCc1ccc([C@H](CO)N[C@@H](C)CC(=O)Nc2ccc(Br)cc2)cc1 ZINC000539041900 938778609 /nfs/dbraw/zinc/77/86/09/938778609.db2.gz UKWMEYSUNNHKCT-LIRRHRJNSA-N 0 3 405.336 4.052 20 0 HIADHN CC(C)NC(=O)Nc1ccc([C@@H](C)N[C@@H]2CCN(CCCc3ccccc3)C2=O)cc1 ZINC000539045632 938781161 /nfs/dbraw/zinc/78/11/61/938781161.db2.gz DLBSQIJGACOVMJ-AUSIDOKSSA-N 0 3 422.573 4.101 20 0 HIADHN C[C@H](N[C@@H]1CC(=O)N(C)[C@H]1c1ccc(Cl)cc1)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000539049417 938782870 /nfs/dbraw/zinc/78/28/70/938782870.db2.gz QLGZXMVIPCRYAC-NQZBTDCJSA-N 0 3 411.933 4.192 20 0 HIADHN CC[C@@H](NCc1nnc(-c2ccc(Br)cc2)[nH]1)c1cccc(OC)c1 ZINC000539054201 938784681 /nfs/dbraw/zinc/78/46/81/938784681.db2.gz DULJBVNFHSSVRX-QGZVFWFLSA-N 0 3 401.308 4.484 20 0 HIADHN CC[C@@H]([NH2+]Cc1nnc(-c2ccc(Br)cc2)[n-]1)c1cccc(OC)c1 ZINC000539054201 938784686 /nfs/dbraw/zinc/78/46/86/938784686.db2.gz DULJBVNFHSSVRX-QGZVFWFLSA-N 0 3 401.308 4.484 20 0 HIADHN C[C@H](CC(=O)Nc1ccc(OC(F)(F)F)cc1)NCc1cccc2c1OCCCO2 ZINC000539066585 938790532 /nfs/dbraw/zinc/79/05/32/938790532.db2.gz ONSANASNOKUUQF-CQSZACIVSA-N 0 3 424.419 4.253 20 0 HIADHN C[C@@H](N[C@H](COc1ccccc1F)c1ccccc1)c1ccc(-n2cnnn2)cc1 ZINC000539066966 938791268 /nfs/dbraw/zinc/79/12/68/938791268.db2.gz MTFULJYVNMPWQR-VGOFRKELSA-N 0 3 403.461 4.272 20 0 HIADHN COC[C@@H](N[C@H](C)CC(=O)Nc1ccc(Br)cc1)c1ccc(F)cc1 ZINC000539088556 938800097 /nfs/dbraw/zinc/80/00/97/938800097.db2.gz VTWQQAWLLJFRBT-FZKQIMNGSA-N 0 3 409.299 4.283 20 0 HIADHN CC[C@@H](N[C@@H]1CCN(c2cc(OC)cc(OC)c2)C1=O)c1ccc(OC(F)F)cc1 ZINC000539088538 938800115 /nfs/dbraw/zinc/80/01/15/938800115.db2.gz VAYOMLHCEJABOS-WOJBJXKFSA-N 0 3 420.456 4.151 20 0 HIADHN Cc1cc(N2CC[C@H](N[C@@H](C)c3ccc(OCc4ccccc4C)cc3)C2=O)n(C)n1 ZINC000539088544 938800246 /nfs/dbraw/zinc/80/02/46/938800246.db2.gz VDOSXZIFZBIRHL-CVDCTZTESA-N 0 3 418.541 4.072 20 0 HIADHN CNS(=O)(=O)c1ccc([C@H](C)NCc2ccc(-c3ccc(OC)cc3)cc2)cc1 ZINC000539088664 938800485 /nfs/dbraw/zinc/80/04/85/938800485.db2.gz YKDOJWQDDGGING-KRWDZBQOSA-N 0 3 410.539 4.121 20 0 HIADHN CC(C)C[C@@H](N[C@@H](C)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1cccs1 ZINC000539091246 938801016 /nfs/dbraw/zinc/80/10/16/938801016.db2.gz HQCVKLWNOMXEMA-FXAWDEMLSA-N 0 3 422.616 4.207 20 0 HIADHN O=S(=O)(c1ccc(CN[C@@H]2CCCc3ccc(Cl)cc32)cc1)N1CCCC1 ZINC000539092916 938801755 /nfs/dbraw/zinc/80/17/55/938801755.db2.gz HDQXDJZHQZOKQV-OAQYLSRUSA-N 0 3 404.963 4.292 20 0 HIADHN COc1ccc(S(=O)(=O)[N-]c2cccc(C[NH2+]Cc3c(C)cccc3C)c2)cc1 ZINC000539103383 938803512 /nfs/dbraw/zinc/80/35/12/938803512.db2.gz AZQWBPMRDCSUKM-UHFFFAOYSA-N 0 3 410.539 4.403 20 0 HIADHN C[C@H]1Cc2ccc(F)cc2[C@@H]1[NH2+]Cc1nnc(-c2ccc(Br)cc2)[n-]1 ZINC000539121106 938805785 /nfs/dbraw/zinc/80/57/85/938805785.db2.gz AINSGIGKXZPQOV-BBATYDOGSA-N 0 3 401.283 4.396 20 0 HIADHN CC(C)[C@H](N[C@H](C)c1cccc(S(N)(=O)=O)c1)c1ccc(C(F)(F)F)cc1 ZINC000539217392 938820292 /nfs/dbraw/zinc/82/02/92/938820292.db2.gz NUMCHEVJNGVFBL-ACJLOTCBSA-N 0 3 400.466 4.401 20 0 HIADHN COc1ccc([C@H](NCc2ccc(S(=O)(=O)N3CCCCC3)cc2)C2CC2)cc1 ZINC000539218716 938820533 /nfs/dbraw/zinc/82/05/33/938820533.db2.gz YYKDNHJIIFQTQW-HSZRJFAPSA-N 0 3 414.571 4.111 20 0 HIADHN Cc1ccccc1CCNC(=O)[C@H](C)N[C@H](C)c1ccc(OCc2cccnc2)cc1 ZINC000539226678 938821852 /nfs/dbraw/zinc/82/18/52/938821852.db2.gz NYZYIALBJIZLRI-RTWAWAEBSA-N 0 3 417.553 4.367 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)CNC1(c2ccc3c(c2)OCCO3)CCCC1 ZINC000539242138 938824163 /nfs/dbraw/zinc/82/41/63/938824163.db2.gz ZHUMVDQCTOPVQI-UHFFFAOYSA-N 0 3 416.905 4.117 20 0 HIADHN COc1cc([C@H](C)N[C@H]2CCCN(CC(F)(F)F)C2=O)ccc1OC1CCCC1 ZINC000539253923 938826984 /nfs/dbraw/zinc/82/69/84/938826984.db2.gz JCSPZHBOXMJILE-YOEHRIQHSA-N 0 3 414.468 4.221 20 0 HIADHN COc1ccc(C[C@H](NCc2cccc(C(=O)N(C)C)c2)c2ccccc2)cc1OC ZINC000539253798 938827177 /nfs/dbraw/zinc/82/71/77/938827177.db2.gz ZINKYUHOAVCRCI-QHCPKHFHSA-N 0 3 418.537 4.479 20 0 HIADHN Cc1ccccc1[C@H](CC(C)C)NCC(=O)Nc1ccc(CN2CCOCC2)cc1 ZINC000539261354 938829124 /nfs/dbraw/zinc/82/91/24/938829124.db2.gz OOULZKAQOGYHKH-DEOSSOPVSA-N 0 3 409.574 4.143 20 0 HIADHN COc1ccc(F)cc1[C@H](C)NCCc1nc2sc3c(c2c(N)n1)CCCC3 ZINC000539269122 938830786 /nfs/dbraw/zinc/83/07/86/938830786.db2.gz RFCNCSOZQIFDQP-LBPRGKRZSA-N 0 3 400.523 4.193 20 0 HIADHN CCOc1ccc([C@H]2CCCN2C(=O)CN[C@@H](CC)c2ccc3c(c2)OCCO3)cc1 ZINC000539279843 938832576 /nfs/dbraw/zinc/83/25/76/938832576.db2.gz LZMDVACRSQFENG-FCHUYYIVSA-N 0 3 424.541 4.261 20 0 HIADHN CCC(CC)[C@@H](NCC(=O)N1CCC(NC(=O)c2ccccc2)CC1)c1ccccc1 ZINC000539280585 938832771 /nfs/dbraw/zinc/83/27/71/938832771.db2.gz NGHOCMJHHSMOHS-RUZDIDTESA-N 0 3 421.585 4.175 20 0 HIADHN COC(=O)c1ccc(CN[C@@H](C)c2ccc(NC(=O)c3ccncc3)cc2)cc1F ZINC000539286159 938833649 /nfs/dbraw/zinc/83/36/49/938833649.db2.gz DVYNIQDGYQQKJG-HNNXBMFYSA-N 0 3 407.445 4.110 20 0 HIADHN COc1cc(F)c([C@H](C)NC[C@H](O)CO[C@H](C)c2ccc(Cl)cc2)cc1OC ZINC000539286843 938833985 /nfs/dbraw/zinc/83/39/85/938833985.db2.gz OMYZZFVOQGIUGS-VBQJREDUSA-N 0 3 411.901 4.286 20 0 HIADHN COc1cc(F)c([C@@H](C)NC[C@H](O)Cc2ccc(C(F)(F)F)cc2)cc1OC ZINC000539288723 938834226 /nfs/dbraw/zinc/83/42/26/938834226.db2.gz DUZSOWRUJJONCX-IUODEOHRSA-N 0 3 401.400 4.116 20 0 HIADHN Cc1nn(-c2ccc(C)cc2)c(C)c1NC(=O)CN[C@H](c1ccccc1)[C@@H]1CCOC1 ZINC000539289399 938834234 /nfs/dbraw/zinc/83/42/34/938834234.db2.gz MPCHOAYPPMSNFS-PXDATVDWSA-N 0 3 418.541 4.103 20 0 HIADHN Cc1nn(-c2ccc(C)cc2)c(C)c1NC(=O)CN[C@H](c1ccccc1)[C@H]1CCOC1 ZINC000539289401 938834410 /nfs/dbraw/zinc/83/44/10/938834410.db2.gz MPCHOAYPPMSNFS-SQJMNOBHSA-N 0 3 418.541 4.103 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)N(C)Cc1nc2ccccc2s1)c1cccc(-n2cccn2)c1 ZINC000539289644 938834424 /nfs/dbraw/zinc/83/44/24/938834424.db2.gz XIAJKBQNZZGTMO-SJORKVTESA-N 0 3 419.554 4.180 20 0 HIADHN CCOc1ccccc1[C@@H](CC)NC(=O)CN[C@H](C)c1cccc(-n2cccn2)c1 ZINC000539290354 938834442 /nfs/dbraw/zinc/83/44/42/938834442.db2.gz YEZRNJJJRPCPPZ-XMSQKQJNSA-N 0 3 406.530 4.189 20 0 HIADHN C[C@H](NCCSCc1ccc(Cl)cc1Cl)c1cccc(S(N)(=O)=O)c1 ZINC000539297639 938836036 /nfs/dbraw/zinc/83/60/36/938836036.db2.gz HZUCYUNPMDZBCQ-LBPRGKRZSA-N 0 3 419.399 4.225 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)N[C@@H]1CCO[C@H]1c1ccc(Cl)cc1 ZINC000539305536 938837538 /nfs/dbraw/zinc/83/75/38/938837538.db2.gz KKEBAIRJPDMNOD-XLIONFOSSA-N 0 3 403.910 4.062 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)Nc1c(F)cc(Cl)cc1F ZINC000539317151 938840161 /nfs/dbraw/zinc/84/01/61/938840161.db2.gz PFOWOXASSJXOTP-UHFFFAOYSA-N 0 3 403.807 4.492 20 0 HIADHN Cc1cc(NC(=O)CN[C@@H](C[C@H]2CCOC2)c2ccccc2)ccc1Br ZINC000539324109 938841424 /nfs/dbraw/zinc/84/14/24/938841424.db2.gz CJRWAESSSIDUKP-UZLBHIALSA-N 0 3 417.347 4.454 20 0 HIADHN O=C(CN[C@@H](C[C@H]1CCOC1)c1ccccc1)Nc1ccc(Br)cc1F ZINC000539334711 938843493 /nfs/dbraw/zinc/84/34/93/938843493.db2.gz GQHDGCNNSLMAPP-KUHUBIRLSA-N 0 3 421.310 4.284 20 0 HIADHN CN1CCC(N(Cc2ccccc2Br)C(=O)c2ccccc2F)CC1 ZINC000563510003 945209325 /nfs/dbraw/zinc/20/93/25/945209325.db2.gz IBHWHMIDUPBEPW-UHFFFAOYSA-N 0 3 405.311 4.325 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)NCC(=O)N(C)[C@@H]2CCCc3ccccc32)cc1 ZINC000539368650 938849944 /nfs/dbraw/zinc/84/99/44/938849944.db2.gz PLFHZVOESAHIDQ-MHECFPHRSA-N 0 3 402.542 4.367 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)c3ccc(C(F)(F)F)cc3Cl)CC2)C[C@@H](C)O1 ZINC000539372880 938850633 /nfs/dbraw/zinc/85/06/33/938850633.db2.gz FNYZOLIWTLPAMN-ZIAGYGMSSA-N 0 3 418.887 4.320 20 0 HIADHN COc1ccc([C@@H](CNCc2ccc(-c3ccncc3)cc2F)N2CCOCC2)cc1 ZINC000539415412 938857387 /nfs/dbraw/zinc/85/73/87/938857387.db2.gz GTWLQFLLRAJREL-RUZDIDTESA-N 0 3 421.516 4.059 20 0 HIADHN C[C@@H]1C[C@H]1[C@@H](NCC(=O)Nc1ccccc1N1CCCC1=O)c1ccc(Cl)cc1 ZINC000539421134 938857829 /nfs/dbraw/zinc/85/78/29/938857829.db2.gz BGWSFAMAJSVMFU-YLEKAMJDSA-N 0 3 411.933 4.392 20 0 HIADHN CO[C@H](c1ccccc1F)[C@@H](C)NC(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000539470167 938865123 /nfs/dbraw/zinc/86/51/23/938865123.db2.gz IYPGXCZXLWFEPB-JPYJTQIMSA-N 0 3 413.537 4.208 20 0 HIADHN COc1ccc([C@@H](NCC(=O)N(C)Cc2ccccc2Br)C2CC2)cc1 ZINC000539492380 938867856 /nfs/dbraw/zinc/86/78/56/938867856.db2.gz RPLVOGLAGNBGSW-NRFANRHFSA-N 0 3 417.347 4.157 20 0 HIADHN COc1cccc2cc([C@@H](C)NCCNC(=O)c3ccc(Br)cc3)oc21 ZINC000539498469 938868885 /nfs/dbraw/zinc/86/88/85/938868885.db2.gz HYDHCJKTISCVHV-CYBMUJFWSA-N 0 3 417.303 4.285 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@H](C)N[C@@H](C)[C@@H](OC)c2ccccc2F)cc1 ZINC000539507080 938870363 /nfs/dbraw/zinc/87/03/63/938870363.db2.gz QYFYQUWLPIHNGL-PNLZDCPESA-N 0 3 422.566 4.283 20 0 HIADHN CCN1CCN(Cc2ccc(N[C@H](C)c3nnn(-c4ccc(C)cc4)c3C)cc2)CC1 ZINC000539635450 938891397 /nfs/dbraw/zinc/89/13/97/938891397.db2.gz ZVIMEOBMKCCOMF-HXUWFJFHSA-N 0 3 418.589 4.195 20 0 HIADHN CC(C)C[C@@H]1C[C@H](NC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)CCO1 ZINC000539664295 938896795 /nfs/dbraw/zinc/89/67/95/938896795.db2.gz GQFKLRMBPWKLDH-SFHLNBCPSA-N 0 3 412.496 4.151 20 0 HIADHN CC(C)C[C@@H]1C[C@@H](NC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)CCO1 ZINC000539664296 938896817 /nfs/dbraw/zinc/89/68/17/938896817.db2.gz GQFKLRMBPWKLDH-ZVDOUQERSA-N 0 3 412.496 4.151 20 0 HIADHN CC(C)C[C@@H]1C[C@H](NC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)CCO1 ZINC000539664294 938896866 /nfs/dbraw/zinc/89/68/66/938896866.db2.gz GQFKLRMBPWKLDH-SBHAEUEKSA-N 0 3 412.496 4.151 20 0 HIADHN CCN(CC)c1ccc(C(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000539688227 938901452 /nfs/dbraw/zinc/90/14/52/938901452.db2.gz JGZCUCTYWKXWLB-HSZRJFAPSA-N 0 3 417.557 4.429 20 0 HIADHN Cc1cc(C(=O)N2CC[C@@H](N3CCCCC3)C2)nn1-c1ccc(Cl)c(Cl)c1 ZINC000539722210 938913205 /nfs/dbraw/zinc/91/32/05/938913205.db2.gz DHYHXGYSVNQGDP-MRXNPFEDSA-N 0 3 407.345 4.188 20 0 HIADHN C[C@H]1CN(Cc2ccccn2)CC[C@@H]1Nc1cccc(C(=O)NCc2ccccc2)c1 ZINC000539725730 938913759 /nfs/dbraw/zinc/91/37/59/938913759.db2.gz LYKNGULUSUDALP-CPJSRVTESA-N 0 3 414.553 4.334 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1ccc2nc(-c3ccccn3)oc2c1 ZINC000539725542 938913919 /nfs/dbraw/zinc/91/39/19/938913919.db2.gz REGCEKQHXFAIPH-UHFFFAOYSA-N 0 3 405.458 4.079 20 0 HIADHN COc1ccc([C@H](C)Nc2cccc([C@@H]3CNC(=O)C3)c2)cc1CN1CCCCC1 ZINC000539736677 938917120 /nfs/dbraw/zinc/91/71/20/938917120.db2.gz AUNXUOLQUPHUFR-RXVVDRJESA-N 0 3 407.558 4.458 20 0 HIADHN CCN(CC)C(=O)CCC1CCN(CC(=O)N(Cc2ccccc2)C(C)(C)C)CC1 ZINC000563562854 945216472 /nfs/dbraw/zinc/21/64/72/945216472.db2.gz WQCGRPVODVQFNJ-UHFFFAOYSA-N 0 3 415.622 4.174 20 0 HIADHN Cc1nc([C@H]2CCCN([C@H](C)c3nnc(-c4ccc(Cl)cc4Cl)o3)C2)n[nH]1 ZINC000539765336 938928656 /nfs/dbraw/zinc/92/86/56/938928656.db2.gz FNIDZTKAMWCOJL-PWSUYJOCSA-N 0 3 407.305 4.411 20 0 HIADHN Cc1n[nH]c([C@H]2CCCN([C@H](C)c3nnc(-c4ccc(Cl)cc4Cl)o3)C2)n1 ZINC000539765336 938928661 /nfs/dbraw/zinc/92/86/61/938928661.db2.gz FNIDZTKAMWCOJL-PWSUYJOCSA-N 0 3 407.305 4.411 20 0 HIADHN Cc1nnc([C@H]2CCCN([C@H](C)c3nnc(-c4ccc(Cl)cc4Cl)o3)C2)[nH]1 ZINC000539765336 938928669 /nfs/dbraw/zinc/92/86/69/938928669.db2.gz FNIDZTKAMWCOJL-PWSUYJOCSA-N 0 3 407.305 4.411 20 0 HIADHN Cc1nc([C@H]2CCCN([C@@H](C)c3nnc(-c4ccc(Cl)cc4Cl)o3)C2)n[nH]1 ZINC000539765334 938929199 /nfs/dbraw/zinc/92/91/99/938929199.db2.gz FNIDZTKAMWCOJL-JQWIXIFHSA-N 0 3 407.305 4.411 20 0 HIADHN Cc1n[nH]c([C@H]2CCCN([C@@H](C)c3nnc(-c4ccc(Cl)cc4Cl)o3)C2)n1 ZINC000539765334 938929200 /nfs/dbraw/zinc/92/92/00/938929200.db2.gz FNIDZTKAMWCOJL-JQWIXIFHSA-N 0 3 407.305 4.411 20 0 HIADHN Cc1nnc([C@H]2CCCN([C@@H](C)c3nnc(-c4ccc(Cl)cc4Cl)o3)C2)[nH]1 ZINC000539765334 938929203 /nfs/dbraw/zinc/92/92/03/938929203.db2.gz FNIDZTKAMWCOJL-JQWIXIFHSA-N 0 3 407.305 4.411 20 0 HIADHN COC(=O)[C@@H]1CC12CCN(Cc1cn(C(C)(C)C)nc1-c1cccc(OC)c1)CC2 ZINC000539827630 938948228 /nfs/dbraw/zinc/94/82/28/938948228.db2.gz NVHLKSYIJDWTGJ-FQEVSTJZSA-N 0 3 411.546 4.089 20 0 HIADHN CN(Cc1cc(Br)ccc1OCc1ccccn1)CC1(O)CCCC1 ZINC000539827080 938948595 /nfs/dbraw/zinc/94/85/95/938948595.db2.gz XAWYVXHDMCEORX-UHFFFAOYSA-N 0 3 405.336 4.160 20 0 HIADHN COc1cc(CN2CCC[C@H](CNC(=O)C(C)(C)C)C2)ccc1OCC(F)(F)F ZINC000539832920 938952227 /nfs/dbraw/zinc/95/22/27/938952227.db2.gz CODLLFDFDKQOQI-MRXNPFEDSA-N 0 3 416.484 4.011 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2CN2CCC[C@H](N3CCCC3=O)C2)cc1 ZINC000539833689 938952586 /nfs/dbraw/zinc/95/25/86/938952586.db2.gz JFBPLNHDKWWAJG-DEOSSOPVSA-N 0 3 414.553 4.435 20 0 HIADHN Fc1ccc(CN(CCc2ccccn2)Cc2ccc(-n3cncn3)c(F)c2)cc1 ZINC000539838223 938953568 /nfs/dbraw/zinc/95/35/68/938953568.db2.gz JAKWCVXOQJYLTA-UHFFFAOYSA-N 0 3 405.452 4.185 20 0 HIADHN COc1ccc2c(c1)CCCN(Cc1cn(C)nc1-c1ccc3c(c1)OCCCO3)C2 ZINC000539841434 938954732 /nfs/dbraw/zinc/95/47/32/938954732.db2.gz UQXIGIMIUXSKNE-UHFFFAOYSA-N 0 3 419.525 4.205 20 0 HIADHN CO[C@@H](C)c1noc(CN2CCCN(Cc3ccc(-c4ccccc4)s3)CC2)n1 ZINC000539892208 938968829 /nfs/dbraw/zinc/96/88/29/938968829.db2.gz BSHOXGNKBKNGEX-KRWDZBQOSA-N 0 3 412.559 4.213 20 0 HIADHN CCCN1CCN(c2ccccc2CN(C)Cc2nc([C@@H](C)SCC)no2)CC1 ZINC000539899310 938971748 /nfs/dbraw/zinc/97/17/48/938971748.db2.gz DLUCAUXVWSVIGQ-GOSISDBHSA-N 0 3 417.623 4.048 20 0 HIADHN COc1cc(OC)cc(Oc2ccc(CN3CCS[C@@H]4COCC[C@H]43)cc2)c1 ZINC000539911525 938976883 /nfs/dbraw/zinc/97/68/83/938976883.db2.gz NIDHNQVOOKICTQ-FGZHOGPDSA-N 0 3 401.528 4.202 20 0 HIADHN C[C@H]1CN(c2ccc(CN[C@H]3CCCc4ccc(Br)cc43)cn2)CCO1 ZINC000539969699 938982616 /nfs/dbraw/zinc/98/26/16/938982616.db2.gz RRASELOAKHKKQC-YWZLYKJASA-N 0 3 416.363 4.236 20 0 HIADHN COCCn1ccc2ccc(NC(=O)N3CC[C@H](C)N(Cc4ccccc4)CC3)cc21 ZINC000540001929 939035230 /nfs/dbraw/zinc/03/52/30/939035230.db2.gz JYROMUVYRNYVIA-FQEVSTJZSA-N 0 3 420.557 4.416 20 0 HIADHN O=C([C@H]1CC12CCN(Cc1ccccc1OCC(F)(F)F)CC2)N1CCCCC1 ZINC000540050409 939050952 /nfs/dbraw/zinc/05/09/52/939050952.db2.gz RBOVFHSHAWRUJT-GOSISDBHSA-N 0 3 410.480 4.242 20 0 HIADHN CCCN(C(=O)N[C@@H]1CCO[C@H](C(C)C)C1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000540085316 939064790 /nfs/dbraw/zinc/06/47/90/939064790.db2.gz WKQATSNAHYSMIM-ZLNRFVROSA-N 0 3 401.595 4.276 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3cc(C)n(-c4ccccc4)n3)c(C)c2)CC1 ZINC000540114315 939077602 /nfs/dbraw/zinc/07/76/02/939077602.db2.gz JJTIYCOMSKRBAJ-UHFFFAOYSA-N 0 3 418.545 4.275 20 0 HIADHN C[C@@H](NCc1ccc(COC2CCOCC2)cc1)c1cccc(N2CCCC2=O)c1 ZINC000540146528 939091543 /nfs/dbraw/zinc/09/15/43/939091543.db2.gz HHCZWLKWFGXQMQ-LJQANCHMSA-N 0 3 408.542 4.360 20 0 HIADHN COCCn1cc2c(n1)[C@@H](N[C@H](C)Cc1ccc(F)cc1Br)CCC2 ZINC000563613962 945226640 /nfs/dbraw/zinc/22/66/40/945226640.db2.gz PLGSIQMDBYACDC-ACJLOTCBSA-N 0 3 410.331 4.029 20 0 HIADHN Cc1ccc(S(=O)(=O)NCCN[C@@H](C)c2ccc(SCC(F)F)cc2)s1 ZINC000540152823 939093560 /nfs/dbraw/zinc/09/35/60/939093560.db2.gz RSSAVTFGFLQDAL-ZDUSSCGKSA-N 0 3 420.572 4.043 20 0 HIADHN C[C@H](N[C@H]1CC(=O)N(C)[C@H]1c1ccc(Cl)cc1)c1cccc(N2CCCC2=O)c1 ZINC000540155825 939094303 /nfs/dbraw/zinc/09/43/03/939094303.db2.gz MOFXFGZXPXJKDA-RSDPBLMXSA-N 0 3 411.933 4.089 20 0 HIADHN Cc1c([C@@H](C)N[C@H]2CCOC3(CCSCC3)C2)nnn1-c1cccc(Cl)c1 ZINC000540160343 939096184 /nfs/dbraw/zinc/09/61/84/939096184.db2.gz ULCHQOLEKWYUPE-PBHICJAKSA-N 0 3 406.983 4.325 20 0 HIADHN CCOc1ccc([C@H](CC)NCc2cccc(NS(C)(=O)=O)c2)cc1OCC ZINC000540176579 939105739 /nfs/dbraw/zinc/10/57/39/939105739.db2.gz WERRPDOTFNLOFT-IBGZPJMESA-N 0 3 406.548 4.096 20 0 HIADHN CNS(=O)(=O)c1ccc([C@H](C)N[C@H](C)c2ccc(OCC(C)C)c(OC)c2)cc1 ZINC000540192472 939117257 /nfs/dbraw/zinc/11/72/57/939117257.db2.gz HTCSZHKGOJMBDP-DLBZAZTESA-N 0 3 420.575 4.050 20 0 HIADHN CC[C@H](N[C@H](C)c1ccc(OCCOC)c(OC)c1)c1ccc2c(c1)OCCO2 ZINC000540192012 939117551 /nfs/dbraw/zinc/11/75/51/939117551.db2.gz XDKOWMBYAFKSSN-APWZRJJASA-N 0 3 401.503 4.294 20 0 HIADHN COc1ccc(C(=O)NCCN[C@@H](C)c2csc(-c3csc(C)n3)c2)cc1 ZINC000540195410 939119776 /nfs/dbraw/zinc/11/97/76/939119776.db2.gz RYTIHLVHDSWQEX-ZDUSSCGKSA-N 0 3 401.557 4.269 20 0 HIADHN CCO[C@@H]1C[C@H](NCc2ccc(OCc3cccs3)c(OC)c2)[C@H]1n1cccn1 ZINC000563637712 945229793 /nfs/dbraw/zinc/22/97/93/945229793.db2.gz XWJPNKMEKRZGNA-VLCRHTCISA-N 0 3 413.543 4.041 20 0 HIADHN CCc1cnccc1[C@@H](C)NC(=O)N(CCN(C)C)Cc1ccc(C(F)(F)F)cc1 ZINC000540306730 939188419 /nfs/dbraw/zinc/18/84/19/939188419.db2.gz CCOYNFAQVRAERX-MRXNPFEDSA-N 0 3 422.495 4.497 20 0 HIADHN CC[C@@H](CS(=O)(=O)c1ccccc1)N[C@H]1CCc2c1cccc2Br ZINC000540314802 939191440 /nfs/dbraw/zinc/19/14/40/939191440.db2.gz YTLGCTHZDHYULN-LIRRHRJNSA-N 0 3 408.361 4.279 20 0 HIADHN O=C1CCCN1C[C@H](NCc1c(-c2ccccc2)nc2ccccn21)c1ccccc1 ZINC000540319704 939192404 /nfs/dbraw/zinc/19/24/04/939192404.db2.gz RSRDCRUYVZWCBY-QFIPXVFZSA-N 0 3 410.521 4.455 20 0 HIADHN CC(C)[N@@H+](Cc1ccc([N-]S(=O)(=O)c2ccccc2)cc1)C[C@H]1CCCCO1 ZINC000540330837 939197072 /nfs/dbraw/zinc/19/70/72/939197072.db2.gz LIPFXTPGQUPYFK-OAQYLSRUSA-N 0 3 402.560 4.267 20 0 HIADHN CC(C)[N@H+](Cc1ccc([N-]S(=O)(=O)c2ccccc2)cc1)C[C@H]1CCCCO1 ZINC000540330837 939197073 /nfs/dbraw/zinc/19/70/73/939197073.db2.gz LIPFXTPGQUPYFK-OAQYLSRUSA-N 0 3 402.560 4.267 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)Nc3cccc(CC[N@@H+](C)C4CC4)c3)cc2)cc(=O)[n-]1 ZINC000540340428 939200061 /nfs/dbraw/zinc/20/00/61/939200061.db2.gz ZUWZXYIXNDXMJJ-UHFFFAOYSA-N 0 3 417.513 4.438 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)Nc3cccc(CC[N@H+](C)C4CC4)c3)cc2)cc(=O)[n-]1 ZINC000540340428 939200064 /nfs/dbraw/zinc/20/00/64/939200064.db2.gz ZUWZXYIXNDXMJJ-UHFFFAOYSA-N 0 3 417.513 4.438 20 0 HIADHN Cc1cc(CN2CCC[C@H](c3nncn3C3CC3)C2)nc(-c2ccc(Cl)cc2)n1 ZINC000540340703 939200243 /nfs/dbraw/zinc/20/02/43/939200243.db2.gz SIGCROGNIBXQGE-KRWDZBQOSA-N 0 3 408.937 4.411 20 0 HIADHN Cc1ccccc1C(=O)NC1CCN(C(=O)CN[C@@H](c2ccccc2C)C(C)C)CC1 ZINC000540360974 939209119 /nfs/dbraw/zinc/20/91/19/939209119.db2.gz LTPLJHNSQHUDFI-RUZDIDTESA-N 0 3 421.585 4.011 20 0 HIADHN COc1cc([C@@H](C)NCc2ccc(C(=O)Nc3ccccc3)cc2)ccc1OCCO ZINC000540376315 939216335 /nfs/dbraw/zinc/21/63/35/939216335.db2.gz PJJRCRFZEFGYRL-GOSISDBHSA-N 0 3 420.509 4.169 20 0 HIADHN O=C(CN[C@@H](c1ccccc1)[C@@H]1CCOC1)Nc1cc(C2CC2)nn1-c1ccccc1 ZINC000540389555 939227749 /nfs/dbraw/zinc/22/77/49/939227749.db2.gz OEWMQPLDNPMQRX-NLFFAJNJSA-N 0 3 416.525 4.056 20 0 HIADHN O=C(CN[C@@H](c1ccccc1)[C@H]1CCOC1)Nc1ccc(Br)cc1Cl ZINC000540395507 939233329 /nfs/dbraw/zinc/23/33/29/939233329.db2.gz VRGMVXQFPWKROV-LIRRHRJNSA-N 0 3 423.738 4.408 20 0 HIADHN CCN(C(=O)[C@@H](C)N[C@@H](C)c1ccc(NC(=O)c2ccncc2)cc1)c1ccccc1 ZINC000540396986 939233631 /nfs/dbraw/zinc/23/36/31/939233631.db2.gz MHZDVNYTBOKQHC-RBUKOAKNSA-N 0 3 416.525 4.426 20 0 HIADHN CCNC(=O)c1cccc(NC(=O)CN[C@H](c2ccc(Cl)cc2)[C@H](C)CC)c1 ZINC000540397785 939233773 /nfs/dbraw/zinc/23/37/73/939233773.db2.gz VWTDPNFHGWBBKI-VFNWGFHPSA-N 0 3 401.938 4.405 20 0 HIADHN C[C@@H](NCC(=O)N[C@@H](c1cccs1)c1ccccc1)c1ccc(-n2cccn2)cc1 ZINC000540435298 939247997 /nfs/dbraw/zinc/24/79/97/939247997.db2.gz NWTJIXYMKVQONE-HOYKHHGWSA-N 0 3 416.550 4.490 20 0 HIADHN C[C@@H](NCC(=O)Nc1ccc2c(c1)OC1(CCCC1)O2)c1ccc(-n2cccn2)cc1 ZINC000540435639 939248141 /nfs/dbraw/zinc/24/81/41/939248141.db2.gz OOAVWIQDPJHYET-QGZVFWFLSA-N 0 3 418.497 4.203 20 0 HIADHN O=C(CCCc1ccc2ccccc2c1)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1CO ZINC000540508680 939281869 /nfs/dbraw/zinc/28/18/69/939281869.db2.gz JSSYCHVJSJGWBS-IZZNHLLZSA-N 0 3 416.565 4.162 20 0 HIADHN Cc1ccc([C@H](NC(=O)CN[C@@H](c2ccc3c(c2)OCCO3)C2CC2)C2CC2)cc1 ZINC000540588777 939312180 /nfs/dbraw/zinc/31/21/80/939312180.db2.gz GDELYJFYZYENOH-RPBOFIJWSA-N 0 3 406.526 4.074 20 0 HIADHN CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NCc1ccc(Cl)c(Br)c1 ZINC000540616032 939320980 /nfs/dbraw/zinc/32/09/80/939320980.db2.gz WNVDAHSYHKCEKZ-SFHVURJKSA-N 0 3 420.738 4.031 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)N[C@@H]1C[C@@H]2CCC(C)(C)c3cccc1c32 ZINC000540665551 939334426 /nfs/dbraw/zinc/33/44/26/939334426.db2.gz OWLPUNAFVCBDED-PGRDOPGGSA-N 0 3 406.574 4.455 20 0 HIADHN COc1ccc(C2(C(=O)N[C@H]3CCN(C)[C@H]3c3ccccc3)CCCC2)cc1OC ZINC000540805479 939378389 /nfs/dbraw/zinc/37/83/89/939378389.db2.gz RCMASRWDPPPEKQ-REWPJTCUSA-N 0 3 408.542 4.077 20 0 HIADHN C[C@@H]1CN(Cc2ccccn2)CC[C@@H]1Nc1cccc(I)c1 ZINC000540818208 939382988 /nfs/dbraw/zinc/38/29/88/939382988.db2.gz JFRFEYFVPNEDHO-KDOFPFPSSA-N 0 3 407.299 4.009 20 0 HIADHN O=C([C@@H]1CCCN1Cc1ccccc1)N1CCC[C@H](c2nnc(C3CCCCC3)[nH]2)C1 ZINC000540850773 939394025 /nfs/dbraw/zinc/39/40/25/939394025.db2.gz OICHVJDGPCYNDC-VXKWHMMOSA-N 0 3 421.589 4.223 20 0 HIADHN COC(=O)c1oc([C@@H](C)N2CCC[C@H](c3nnc(C4CCCCC4)[nH]3)C2)cc1C ZINC000540865287 939402073 /nfs/dbraw/zinc/40/20/73/939402073.db2.gz MYAOQAOKHADUBI-WBVHZDCISA-N 0 3 400.523 4.481 20 0 HIADHN O=c1cc(CN[C@H](CC2CCC2)c2ccccc2)nc2ccc(Br)cn12 ZINC000540890082 939411419 /nfs/dbraw/zinc/41/14/19/939411419.db2.gz MDUGVAMJYHLPPU-LJQANCHMSA-N 0 3 412.331 4.478 20 0 HIADHN Cc1ncc2c(n1)CC[C@H](N[C@H](c1ccc3c(c1)OCCO3)c1ccccc1Cl)C2 ZINC000540916323 939417145 /nfs/dbraw/zinc/41/71/45/939417145.db2.gz STCBQTCTDDDIGJ-MHECFPHRSA-N 0 3 421.928 4.446 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)NCC(=O)N(C)c2nc3ccccc3s2)cc1 ZINC000541022397 939432388 /nfs/dbraw/zinc/43/23/88/939432388.db2.gz CJQRSXGSKBQEFC-HNNXBMFYSA-N 0 3 405.527 4.104 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)NCC(=O)N[C@@H](c2ccc(F)cc2)C(C)C)cc1 ZINC000541027520 939434819 /nfs/dbraw/zinc/43/48/19/939434819.db2.gz BCNMJSFLXXNQGO-MZNJEOGPSA-N 0 3 408.521 4.484 20 0 HIADHN CCc1ccc([C@H](C)NC(=O)[C@@H](C)N2CCC(CCC(=O)N(CC)CC)CC2)cc1 ZINC000541120643 939467828 /nfs/dbraw/zinc/46/78/28/939467828.db2.gz RTIDJKFFHVKEEM-VQTJNVASSA-N 0 3 415.622 4.175 20 0 HIADHN COc1ccc(NC(=O)C[C@@H](C)NCc2csc(Br)c2)c(OC)c1 ZINC000541218853 939486161 /nfs/dbraw/zinc/48/61/61/939486161.db2.gz YLZHFAKWBWUFKJ-LLVKDONJSA-N 0 3 413.337 4.035 20 0 HIADHN CCN1CC[C@H](N[C@H](C)c2nc3ccccc3n2C)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000541175805 939484362 /nfs/dbraw/zinc/48/43/62/939484362.db2.gz FHTCEYOJCJOESN-LZHZSBQWSA-N 0 3 402.464 4.477 20 0 HIADHN CC[C@H](N[C@@H](CC)c1cccc(S(N)(=O)=O)c1)c1ccc(Br)cc1 ZINC000541204626 939485543 /nfs/dbraw/zinc/48/55/43/939485543.db2.gz AKVGWDZWXQFJPR-ROUUACIJSA-N 0 3 411.365 4.289 20 0 HIADHN COc1ccc(NC(=O)C[C@@H](C)N[C@@H]2CCCOc3ccc(F)cc32)c(OC)c1 ZINC000541213782 939486003 /nfs/dbraw/zinc/48/60/03/939486003.db2.gz ZIJVBICQZMRWAZ-RDTXWAMCSA-N 0 3 402.466 4.064 20 0 HIADHN CCC[C@H](N[C@@H]1CCCN(Cc2nccn2C)C1=O)c1ccc(Cl)c(Cl)c1 ZINC000541228306 939486615 /nfs/dbraw/zinc/48/66/15/939486615.db2.gz IKENGHWGSVSFQI-ZWKOTPCHSA-N 0 3 409.361 4.349 20 0 HIADHN COc1ccc(Oc2ccc(CN[C@H]3CCCN(Cc4ccccn4)C3=O)cc2)cc1 ZINC000541386288 939502999 /nfs/dbraw/zinc/50/29/99/939502999.db2.gz MZSHTMCEGISMDE-DEOSSOPVSA-N 0 3 417.509 4.163 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)[C@@H]2CCn3c(cnc3C3CCCCC3)C2)N(C)C)cc1 ZINC000541406707 939507646 /nfs/dbraw/zinc/50/76/46/939507646.db2.gz PBFSHVHMLZYSEN-ISKFKSNPSA-N 0 3 422.617 4.475 20 0 HIADHN O=C(Nc1cccc(CN2CCOCC3(CCOCC3)C2)c1)c1ccc(Cl)cc1 ZINC000541535092 939546667 /nfs/dbraw/zinc/54/66/67/939546667.db2.gz AEZRGEHHRRYQKC-UHFFFAOYSA-N 0 3 414.933 4.221 20 0 HIADHN COc1cc(C[C@H](CO)CN[C@H](c2cccnc2)c2ccc(F)c(C)c2)cc(OC)c1 ZINC000541544529 939549408 /nfs/dbraw/zinc/54/94/08/939549408.db2.gz YWWQRAJHUCGVBK-DFBJGRDBSA-N 0 3 424.516 4.077 20 0 HIADHN Cc1cc([C@H](NC[C@H](c2cccc(F)c2)N2CCOCC2)c2cccnc2)ccc1F ZINC000541547125 939551116 /nfs/dbraw/zinc/55/11/16/939551116.db2.gz AHXPRPDPOWGAPE-RPBOFIJWSA-N 0 3 423.507 4.421 20 0 HIADHN Fc1ccc([C@@H](NCCCN2CCN(c3ccccc3)CC2)c2cccnc2)c(F)c1 ZINC000541551071 939552815 /nfs/dbraw/zinc/55/28/15/939552815.db2.gz CJHHLPVOKYZWDH-VWLOTQADSA-N 0 3 422.523 4.251 20 0 HIADHN Cc1nn(-c2ccccc2)c(Oc2ccc(F)cc2)c1CN1C[C@@H]2CC[C@@H](O)[C@H]2C1 ZINC000541554429 939554258 /nfs/dbraw/zinc/55/42/58/939554258.db2.gz FTSNXYFOIJVDGI-PDIWNELESA-N 0 3 407.489 4.315 20 0 HIADHN Cc1c([C@H](C)NCC[C@@H]2CCO[C@H](C)C2)nnn1-c1cccc(Br)c1 ZINC000541558145 939555156 /nfs/dbraw/zinc/55/51/56/939555156.db2.gz MGHRVMJISRXCLP-IJEWVQPXSA-N 0 3 407.356 4.194 20 0 HIADHN Cn1cc([C@H](NCCCc2nc(-c3ccc(F)cc3)no2)c2cccc(F)c2)cn1 ZINC000541568786 939557695 /nfs/dbraw/zinc/55/76/95/939557695.db2.gz DKGZPHIEDKKBHM-OAQYLSRUSA-N 0 3 409.440 4.060 20 0 HIADHN CCc1ccc([C@H](NC(=O)CN2CCC3(CCOCC3)[C@@H]2C)c2cccs2)cc1 ZINC000541718318 939613824 /nfs/dbraw/zinc/61/38/24/939613824.db2.gz OCIBLMDMQCQOLV-MBSDFSHPSA-N 0 3 412.599 4.407 20 0 HIADHN Cc1ccc(S(=O)(=O)C[C@H](C)NC2CCN(Cc3ccc(Cl)cc3)CC2)cc1 ZINC000541746090 939619237 /nfs/dbraw/zinc/61/92/37/939619237.db2.gz UOAAWDWNXSSVHN-SFHVURJKSA-N 0 3 421.006 4.065 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@H]2CCCC[C@H]2NCc2ccccc2-c2cnn(C)c2)cc1 ZINC000541767153 939625407 /nfs/dbraw/zinc/62/54/07/939625407.db2.gz SIDLCBRIBUITLH-RPWUZVMVSA-N 0 3 423.582 4.270 20 0 HIADHN Fc1cc(CN2CCC[C@@H](c3nnc4ccccn43)C2)ccc1OCC(F)(F)F ZINC000541773719 939627059 /nfs/dbraw/zinc/62/70/59/939627059.db2.gz KOLHVSWLUYNYAA-OAHLLOKOSA-N 0 3 408.399 4.189 20 0 HIADHN C[C@@H](NC(=O)Nc1ccc(OC(F)(F)F)cc1Br)C1=CCN(C)CC1 ZINC000541908033 939651466 /nfs/dbraw/zinc/65/14/66/939651466.db2.gz FXCYNUYCMKNDBY-SNVBAGLBSA-N 0 3 422.245 4.120 20 0 HIADHN COc1ccccc1COc1cccc(NC(=O)N[C@H](C)C2=CCN(C)CC2)c1C ZINC000541907754 939651477 /nfs/dbraw/zinc/65/14/77/939651477.db2.gz HTDWFHFLKZACIC-GOSISDBHSA-N 0 3 409.530 4.355 20 0 HIADHN CC(C)[C@H](NCc1cccc(OCCN2CCOCC2)c1)c1ccc(F)c(F)c1 ZINC000541913410 939651826 /nfs/dbraw/zinc/65/18/26/939651826.db2.gz JOPPFPKGECHJPI-QHCPKHFHSA-N 0 3 404.501 4.163 20 0 HIADHN COc1ccc(C(=O)NCCN[C@H](CSC)c2ccc(C(F)(F)F)cc2)cc1 ZINC000541917796 939653862 /nfs/dbraw/zinc/65/38/62/939653862.db2.gz ZUKRBINXVBDHFQ-GOSISDBHSA-N 0 3 412.477 4.138 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)N[C@H](C)C(=O)Nc2ccc3c(c2)OCCCO3)cc1 ZINC000541956074 939661662 /nfs/dbraw/zinc/66/16/62/939661662.db2.gz NAQFUBQPEURRAF-DLBZAZTESA-N 0 3 420.513 4.020 20 0 HIADHN C[C@H]1COc2ccccc2CN1C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000542024410 939690222 /nfs/dbraw/zinc/69/02/22/939690222.db2.gz PPFGZXLDFOIPSB-SFHVURJKSA-N 0 3 411.571 4.093 20 0 HIADHN C[C@@H](NCc1cn(C)nc1-c1ccccc1)c1ccc(OCc2nccn2C)cc1 ZINC000542106428 939715529 /nfs/dbraw/zinc/71/55/29/939715529.db2.gz PUNCXELGVXQMSQ-GOSISDBHSA-N 0 3 401.514 4.250 20 0 HIADHN CC(C)OC(=O)C1(C(=O)OC(C)C)CC(N[C@@H](c2ccc(Cl)cc2)C2CC2)C1 ZINC000542138450 939727554 /nfs/dbraw/zinc/72/75/54/939727554.db2.gz GFUPAOJWMYUBRA-LJQANCHMSA-N 0 3 407.938 4.433 20 0 HIADHN CC(C)n1ccc(C[C@H](C)N[C@@H](C)c2cc3c(cc2Br)OCCO3)n1 ZINC000542143641 939728935 /nfs/dbraw/zinc/72/89/35/939728935.db2.gz WOSGFQPVKVVAHW-KBPBESRZSA-N 0 3 408.340 4.280 20 0 HIADHN CCOc1ccccc1Oc1ccc(CNCc2cn(-c3ccncc3)nc2C)cn1 ZINC000542318330 939798667 /nfs/dbraw/zinc/79/86/67/939798667.db2.gz QWXPBFPHGTVFGW-UHFFFAOYSA-N 0 3 415.497 4.452 20 0 HIADHN COc1ccc([C@H]2CCCN2C(=O)CN2CC[C@H](c3ccc(C)cc3)C2)c(OC)c1 ZINC000542323458 939800344 /nfs/dbraw/zinc/80/03/44/939800344.db2.gz VZJWFCGQDCGLHL-NZQKXSOJSA-N 0 3 408.542 4.165 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)c2ccc(C)cc2Sc2ccccc2)CC1 ZINC000542359802 939807264 /nfs/dbraw/zinc/80/72/64/939807264.db2.gz MBPGSVIHEJDNSG-FQEVSTJZSA-N 0 3 411.615 4.150 20 0 HIADHN COc1cccc([C@H](CNC(=O)Nc2ccccc2-n2nccc2C)N2CCCC2)c1 ZINC000542424763 939819862 /nfs/dbraw/zinc/81/98/62/939819862.db2.gz DTEUXHSHWXYJSF-QHCPKHFHSA-N 0 3 419.529 4.148 20 0 HIADHN c1csc(-c2nn(Cc3ccccc3)cc2CN2CCOCC3(CCOCC3)C2)c1 ZINC000542464167 939827574 /nfs/dbraw/zinc/82/75/74/939827574.db2.gz YYSUVFWSGLQIMH-UHFFFAOYSA-N 0 3 423.582 4.289 20 0 HIADHN COc1ccc(C(=O)C[C@@H](C)C(=O)N[C@H]2[C@H](C)CN(Cc3ccccc3)C[C@@H]2C)cc1 ZINC000542489417 939832103 /nfs/dbraw/zinc/83/21/03/939832103.db2.gz IAVXYUWCUJFXIT-PUFAWVJESA-N 0 3 422.569 4.177 20 0 HIADHN O=C1[C@H](N[C@H]2CCCc3c(Br)cccc32)CCCN1Cc1ccccn1 ZINC000542497403 939832838 /nfs/dbraw/zinc/83/28/38/939832838.db2.gz BPAAWIMOBDEDCW-VQTJNVASSA-N 0 3 414.347 4.002 20 0 HIADHN O=C1[C@@H](N[C@@H]2CCCc3c(Br)cccc32)CCCN1Cc1ccccn1 ZINC000542497400 939832914 /nfs/dbraw/zinc/83/29/14/939832914.db2.gz BPAAWIMOBDEDCW-UXHICEINSA-N 0 3 414.347 4.002 20 0 HIADHN O=C(CN[C@H](Cc1ccccc1)c1cccs1)Nc1cccc(N2CCCC2=O)c1 ZINC000542525022 939837084 /nfs/dbraw/zinc/83/70/84/939837084.db2.gz HTFKXHMDWIJDJQ-OAQYLSRUSA-N 0 3 419.550 4.387 20 0 HIADHN C[C@H](N[C@@H](Cc1ccccc1)c1cccs1)C(=O)Nc1ccc2c(c1)OCCO2 ZINC000542525822 939837466 /nfs/dbraw/zinc/83/74/66/939837466.db2.gz MQBRJRPSLVTPQR-LPHOPBHVSA-N 0 3 408.523 4.420 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)N[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000542545347 939841623 /nfs/dbraw/zinc/84/16/23/939841623.db2.gz UFUKJOPGKOJONV-DNVJHFABSA-N 0 3 411.521 4.182 20 0 HIADHN Cc1c([C@H](C)NC[C@H](O)COc2ccc(C(C)(C)c3ccccc3)cc2)cnn1C ZINC000542591715 939847069 /nfs/dbraw/zinc/84/70/69/939847069.db2.gz YLWJFLZTJVKPHT-AVRDEDQJSA-N 0 3 407.558 4.145 20 0 HIADHN Cc1c([C@@H](C)NC[C@@H](O)COc2ccc(C(C)(C)c3ccccc3)cc2)cnn1C ZINC000542591718 939847096 /nfs/dbraw/zinc/84/70/96/939847096.db2.gz YLWJFLZTJVKPHT-XMSQKQJNSA-N 0 3 407.558 4.145 20 0 HIADHN C[C@H](NCC(=O)NCc1ccc(COc2ccccc2)cc1)[C@H]1COc2ccccc21 ZINC000542626310 939850108 /nfs/dbraw/zinc/85/01/08/939850108.db2.gz ICAACSVOPBLRBZ-YADARESESA-N 0 3 416.521 4.036 20 0 HIADHN CN(CC(=O)N1CCC(Cc2ccccc2)CC1)[C@@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000542627950 939850134 /nfs/dbraw/zinc/85/01/34/939850134.db2.gz LQVWYPAZGHXDOV-RPBOFIJWSA-N 0 3 424.560 4.459 20 0 HIADHN CCOC(=O)c1nn(-c2ccccc2)cc1CN[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000542689882 939854542 /nfs/dbraw/zinc/85/45/42/939854542.db2.gz YUMSVCAHAOXNLW-IFMALSPDSA-N 0 3 423.488 4.198 20 0 HIADHN C[C@H](CC(=O)Nc1cccc(N2CCCC2)c1)NCc1ccccc1OC(F)F ZINC000542699102 939855157 /nfs/dbraw/zinc/85/51/57/939855157.db2.gz GBAVRLXGJFBBIG-MRXNPFEDSA-N 0 3 403.473 4.395 20 0 HIADHN CCN(C(=O)Nc1ncn(C2CCCCC2)n1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000542717959 939856287 /nfs/dbraw/zinc/85/62/87/939856287.db2.gz KXSSLCBFKYIIJM-GHTZIAJQSA-N 0 3 410.566 4.473 20 0 HIADHN CCN(C(=O)Nc1ncn(C2CCCCC2)n1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000542717961 939856290 /nfs/dbraw/zinc/85/62/90/939856290.db2.gz KXSSLCBFKYIIJM-NQIIRXRSSA-N 0 3 410.566 4.473 20 0 HIADHN CSC[C@@H](NCCNC(=O)c1c(F)cccc1F)c1ccc(C(F)(F)F)cc1 ZINC000542844469 939862518 /nfs/dbraw/zinc/86/25/18/939862518.db2.gz SOXCFDKPTUDHJF-MRXNPFEDSA-N 0 3 418.431 4.407 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)NCC(=O)NCc2ccc(COC(C)C)cc2)cc1 ZINC000542887152 939865441 /nfs/dbraw/zinc/86/54/41/939865441.db2.gz VQOMTJBFKIVRGK-LJQANCHMSA-N 0 3 420.557 4.073 20 0 HIADHN CC(C)N(CCN(C)C)C(=O)Nc1cc(Br)ccc1Br ZINC000542901548 939875128 /nfs/dbraw/zinc/87/51/28/939875128.db2.gz FWCWUSLDZXPELS-UHFFFAOYSA-N 0 3 407.150 4.016 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)c3ccn(Cc4ccccc4)c3)c2)CC1 ZINC000542920464 939877772 /nfs/dbraw/zinc/87/77/72/939877772.db2.gz CMSSBWFSHVTGDU-UHFFFAOYSA-N 0 3 402.542 4.319 20 0 HIADHN C[C@H](CC(=O)Nc1cccc(Cl)c1)N[C@H](CO)c1ccc(C(F)(F)F)cc1 ZINC000543072640 939924817 /nfs/dbraw/zinc/92/48/17/939924817.db2.gz MMMITJXMBDBTMR-SJKOYZFVSA-N 0 3 400.828 4.399 20 0 HIADHN COC(=O)COc1ccc(CN2CCC[C@H](c3nc(C(F)(F)F)cs3)C2)cc1 ZINC000543092622 939939398 /nfs/dbraw/zinc/93/93/98/939939398.db2.gz IFNYLIUIONKJKM-AWEZNQCLSA-N 0 3 414.449 4.093 20 0 HIADHN COC(=O)CN1CCC(N[C@@H](c2cccc(SC)c2)c2ccc(F)c(F)c2)CC1 ZINC000543097124 939943102 /nfs/dbraw/zinc/94/31/02/939943102.db2.gz PECFXNJYOWRGFN-QFIPXVFZSA-N 0 3 420.525 4.003 20 0 HIADHN Brc1ccn2cc(CN3CCC(c4ncc5n4CCCC5)CC3)nc2c1 ZINC000563755737 945286084 /nfs/dbraw/zinc/28/60/84/945286084.db2.gz PGDLCFGCHNITMJ-UHFFFAOYSA-N 0 3 414.351 4.009 20 0 HIADHN C[C@@H](N[C@@H](Cc1ccc(F)cc1)C(N)=O)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000543160156 939980874 /nfs/dbraw/zinc/98/08/74/939980874.db2.gz OJLDOOIYECVHQB-MWTRTKDXSA-N 0 3 410.464 4.291 20 0 HIADHN Cc1cc(Br)cn2c(CN[C@@H](c3ccccc3)[C@H]3CCOC3)cnc12 ZINC000543238822 940004799 /nfs/dbraw/zinc/00/47/99/940004799.db2.gz OYHYJMGYVNTTCN-LPHOPBHVSA-N 0 3 400.320 4.273 20 0 HIADHN Cc1cn(C2CCCCC2)nc1NC(=O)NCC1(N2CCSCC2)CCCC1 ZINC000543296078 940021163 /nfs/dbraw/zinc/02/11/63/940021163.db2.gz GIGDHDNLUJQQTP-UHFFFAOYSA-N 0 3 405.612 4.180 20 0 HIADHN CC(C)Oc1c(F)cc(NC(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)cc1F ZINC000543321193 940029126 /nfs/dbraw/zinc/02/91/26/940029126.db2.gz JKTIHXGLTLWULO-GOSISDBHSA-N 0 3 403.473 4.490 20 0 HIADHN CN(C(=O)[C@H]1CCn2c(cnc2C2CCCCC2)C1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000543332400 940033731 /nfs/dbraw/zinc/03/37/31/940033731.db2.gz HJGGJBDOZNISLX-XZOQPEGZSA-N 0 3 420.601 4.226 20 0 HIADHN C[C@H](CN(C)C(=O)N[C@@H](CN1CCc2ccccc2C1)C(C)(C)C)c1nccs1 ZINC000543338201 940035203 /nfs/dbraw/zinc/03/52/03/940035203.db2.gz IJTHHQRWFUTSDZ-XLIONFOSSA-N 0 3 414.619 4.361 20 0 HIADHN COCCN1CC[C@H](N[C@@H](c2ccc(OC)cc2)c2ccc(C(F)(F)F)cc2)C1 ZINC000543414359 940057810 /nfs/dbraw/zinc/05/78/10/940057810.db2.gz SDZFSRKQUYHSLX-PZJWPPBQSA-N 0 3 408.464 4.114 20 0 HIADHN CC[C@@H](N[C@@H]1CCCN(Cc2ccccn2)C1=O)c1cccc(Br)c1 ZINC000543427046 940061421 /nfs/dbraw/zinc/06/14/21/940061421.db2.gz QNXSPPWLUOLMQT-RTBURBONSA-N 0 3 402.336 4.076 20 0 HIADHN COc1ccccc1COC1CCN(C[C@H](O)COc2cc(C)ccc2Cl)CC1 ZINC000543439048 940064322 /nfs/dbraw/zinc/06/43/22/940064322.db2.gz PQEANFBYGSTPLH-IBGZPJMESA-N 0 3 419.949 4.078 20 0 HIADHN COC[C@@H](Cc1ccccc1)N[C@H](CN1CCCC1=O)c1cccc(C(F)(F)F)c1 ZINC000543446608 940066056 /nfs/dbraw/zinc/06/60/56/940066056.db2.gz ISLWRYHVWPBQHB-NHCUHLMSSA-N 0 3 420.475 4.216 20 0 HIADHN CN(C)S(=O)(=O)c1cccc(CN[C@@H](Cc2ccccc2)c2cccs2)c1 ZINC000543454946 940067860 /nfs/dbraw/zinc/06/78/60/940067860.db2.gz QVWCOZNODCAHGN-FQEVSTJZSA-N 0 3 400.569 4.072 20 0 HIADHN CC[C@H](NCC(=O)Nc1cc(C(F)(F)F)ccc1N1CCCCC1)[C@H]1CCCO1 ZINC000543496731 940085090 /nfs/dbraw/zinc/08/50/90/940085090.db2.gz LRRASVOKPLIGOQ-QFBILLFUSA-N 0 3 413.484 4.181 20 0 HIADHN CCOc1ccc(CN(C)C(=O)CN(C)[C@H]2CCO[C@H](c3ccc(F)cc3)C2)cc1 ZINC000543559839 940108766 /nfs/dbraw/zinc/10/87/66/940108766.db2.gz UGWHFUWHCVAHRX-GMAHTHKFSA-N 0 3 414.521 4.035 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@H]2NCc2cn(C)nc2-c2ccccc2)cc1 ZINC000543598243 940125660 /nfs/dbraw/zinc/12/56/60/940125660.db2.gz UZEAFZWUBCRKQT-DHIUTWEWSA-N 0 3 423.582 4.270 20 0 HIADHN Brc1cccc(N2CC[C@@H](CN[C@@H](c3ccccc3)c3cncnc3)C2)c1 ZINC000543601129 940126925 /nfs/dbraw/zinc/12/69/25/940126925.db2.gz VWFYXRWNHTYVME-JTSKRJEESA-N 0 3 423.358 4.445 20 0 HIADHN Cc1nn(C(C)(C)C)c(C)c1CNCCC(=O)Nc1ccc(Br)cc1 ZINC000543620780 940136096 /nfs/dbraw/zinc/13/60/96/940136096.db2.gz MVQDXXJMKNCTFJ-UHFFFAOYSA-N 0 3 407.356 4.136 20 0 HIADHN CS[C@H]1CN(C(=O)c2csc(-c3cccc(Cl)c3)n2)C[C@@H]1N1CCCC1 ZINC000543701429 940165164 /nfs/dbraw/zinc/16/51/64/940165164.db2.gz UMWFAMZHSKGTRY-IRXDYDNUSA-N 0 3 407.992 4.115 20 0 HIADHN CC(=O)Nc1ccc([C@H](C)N[C@@H]2CC(=O)N(c3cccc(C(F)(F)F)c3)C2)cc1 ZINC000543775728 940182280 /nfs/dbraw/zinc/18/22/80/940182280.db2.gz JDMAPVIZEYRMNR-SCLBCKFNSA-N 0 3 405.420 4.120 20 0 HIADHN CC(=O)Nc1ccc([C@@H](C)N[C@H]2CC(=O)N(c3cccc(C(F)(F)F)c3)C2)cc1 ZINC000543775726 940182455 /nfs/dbraw/zinc/18/24/55/940182455.db2.gz JDMAPVIZEYRMNR-ACJLOTCBSA-N 0 3 405.420 4.120 20 0 HIADHN Cc1cccc(C)c1NC(=O)CCCN[C@@H](CCO)c1ccccc1Br ZINC000543809953 940193497 /nfs/dbraw/zinc/19/34/97/940193497.db2.gz SLGDHSVXVJZYSI-IBGZPJMESA-N 0 3 419.363 4.498 20 0 HIADHN Cc1cccc(C)c1NC(=O)CCCN[C@H](CCO)c1ccccc1Br ZINC000543809954 940193562 /nfs/dbraw/zinc/19/35/62/940193562.db2.gz SLGDHSVXVJZYSI-LJQANCHMSA-N 0 3 419.363 4.498 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)N[C@@H](C)C(=O)NC(=O)Nc2ccc(C)cc2C)cc1 ZINC000543812968 940194527 /nfs/dbraw/zinc/19/45/27/940194527.db2.gz WCTLWCVBVAZMMT-ROUUACIJSA-N 0 3 419.529 4.185 20 0 HIADHN CCN1CC[C@H](NCc2cnn(-c3ccccc3)c2)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000543849130 940207869 /nfs/dbraw/zinc/20/78/69/940207869.db2.gz LXZQHPMCRIKZOA-RBBKRZOGSA-N 0 3 400.448 4.215 20 0 HIADHN CN(C)c1ncc(CN[C@@H]2CCN(C(C)(C)C)[C@@H]2c2ccc(Cl)c(F)c2)cn1 ZINC000543850671 940208613 /nfs/dbraw/zinc/20/86/13/940208613.db2.gz WGKWFWZKTZQPNN-RTBURBONSA-N 0 3 405.949 4.039 20 0 HIADHN O[C@@H](COc1cccc2ccccc21)CN1CCC[C@@H](n2ccc(C(F)(F)F)n2)C1 ZINC000543873035 940219441 /nfs/dbraw/zinc/21/94/41/940219441.db2.gz LHPCRNCRZWXKKX-QZTJIDSGSA-N 0 3 419.447 4.132 20 0 HIADHN CCN(CC)C(=O)CCC1CCN(Cc2cccc(C(=O)N3CCCCC3)c2)CC1 ZINC000543909137 940238254 /nfs/dbraw/zinc/23/82/54/940238254.db2.gz SJROEMIVZZAGTI-UHFFFAOYSA-N 0 3 413.606 4.173 20 0 HIADHN CN(C)[C@H](CNC(=O)N1CCC(CCCn2ccnc2)CC1)c1ccc(Cl)cc1 ZINC000543972385 940278769 /nfs/dbraw/zinc/27/87/69/940278769.db2.gz UANXHVHIMZZNGY-OAQYLSRUSA-N 0 3 417.985 4.041 20 0 HIADHN COc1ccc(CN(C)C(=O)CN[C@H](c2ccc(Cl)cc2)C2CC2)cc1OC ZINC000543989787 940286906 /nfs/dbraw/zinc/28/69/06/940286906.db2.gz AUNCFAKIIGPDPD-QFIPXVFZSA-N 0 3 402.922 4.057 20 0 HIADHN COc1ccc2cc(CN[C@H](Cc3ccc(C(F)(F)F)cc3)C(N)=O)ccc2c1 ZINC000544095547 940325010 /nfs/dbraw/zinc/32/50/10/940325010.db2.gz UWPQPRHUIDMZCI-HXUWFJFHSA-N 0 3 402.416 4.053 20 0 HIADHN Cc1nc(-c2ccccc2)sc1NC(=O)NC1CCN(CCOC(C)C)CC1 ZINC000544268443 940373941 /nfs/dbraw/zinc/37/39/41/940373941.db2.gz FUJMTRHWWBXHOV-UHFFFAOYSA-N 0 3 402.564 4.129 20 0 HIADHN Cc1cc(NC(=O)c2cn(C(C)(C)C)nc2C)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000544269578 940374263 /nfs/dbraw/zinc/37/42/63/940374263.db2.gz UMNMAMONBHLGBC-HXUWFJFHSA-N 0 3 420.561 4.151 20 0 HIADHN Cc1nc(CN2CCC(CN[C@H](c3ccc(F)cc3)c3ccccn3)CC2)oc1C ZINC000544358414 940399511 /nfs/dbraw/zinc/39/95/11/940399511.db2.gz HBQVUUKWMAWKQR-XMMPIXPASA-N 0 3 408.521 4.417 20 0 HIADHN Cc1nc(CN2CCC(CN[C@@H](c3ccc(F)cc3)c3ccccn3)CC2)oc1C ZINC000544358413 940399680 /nfs/dbraw/zinc/39/96/80/940399680.db2.gz HBQVUUKWMAWKQR-DEOSSOPVSA-N 0 3 408.521 4.417 20 0 HIADHN CC(C)[C@@H](CN[C@H](c1ccc(F)cc1)c1cnccn1)N1CCc2ccccc2C1 ZINC000544358840 940400256 /nfs/dbraw/zinc/40/02/56/940400256.db2.gz COFBKFNFVUZMDK-JWQCQUIFSA-N 0 3 404.533 4.378 20 0 HIADHN Cc1cc([C@H](NC[C@H](c2cccs2)N2CCN(C)CC2)c2cccnc2)ccc1F ZINC000544360665 940401721 /nfs/dbraw/zinc/40/17/21/940401721.db2.gz PFIUYHOUAPJRJT-VWNXMTODSA-N 0 3 424.589 4.258 20 0 HIADHN CCc1ccc([C@H](CN2CCOCC2)NCc2ccc(-n3ccnc3C)c(F)c2)cc1 ZINC000544363357 940401942 /nfs/dbraw/zinc/40/19/42/940401942.db2.gz SMQFBTPUDQUJIP-DEOSSOPVSA-N 0 3 422.548 4.045 20 0 HIADHN O=C(c1ccccc1F)N1CCC(N[C@@H](c2ccccc2)c2ccc(F)cn2)CC1 ZINC000544368300 940403711 /nfs/dbraw/zinc/40/37/11/940403711.db2.gz QFSAEQIASCZXNG-QHCPKHFHSA-N 0 3 407.464 4.344 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)c(C)c1CN1CCC(OC[C@@H]2CCOC2)CC1 ZINC000544370062 940404486 /nfs/dbraw/zinc/40/44/86/940404486.db2.gz ANEHRYRTKXZBMX-GOSISDBHSA-N 0 3 403.954 4.160 20 0 HIADHN CCNC(=O)c1cccc(NC(=O)CN[C@@H](Cc2ccccc2)c2cccs2)c1 ZINC000544412596 940416744 /nfs/dbraw/zinc/41/67/44/940416744.db2.gz SMWVTWLSTGEEKK-FQEVSTJZSA-N 0 3 407.539 4.010 20 0 HIADHN CC(C)C[C@H](NCC(=O)Nc1cc(Cl)ccc1-n1cncn1)c1cccs1 ZINC000544448444 940435159 /nfs/dbraw/zinc/43/51/59/940435159.db2.gz ULDUWAOQJBXSIZ-INIZCTEOSA-N 0 3 403.939 4.298 20 0 HIADHN Cc1ccc(SCCNC(=O)CN(C)[C@@H]2CCO[C@H](c3ccc(F)cc3)C2)cc1 ZINC000544525611 940471279 /nfs/dbraw/zinc/47/12/79/940471279.db2.gz KMSPAIBXJPQXKV-IRLDBZIGSA-N 0 3 416.562 4.195 20 0 HIADHN COc1ccc(-c2csc(NC(=O)[C@H](C)N[C@@H](C)[C@H]3COc4ccccc43)n2)cc1 ZINC000544526695 940471681 /nfs/dbraw/zinc/47/16/81/940471681.db2.gz BEMXBEOBQYLMEP-YZVOILCLSA-N 0 3 423.538 4.300 20 0 HIADHN CCC[C@@H](NCc1ccc(S(=O)(=O)N2CCC[C@@H](C)C2)cc1)c1cccnc1 ZINC000544580336 940484072 /nfs/dbraw/zinc/48/40/72/940484072.db2.gz RBPUONQPHZUZHN-XMSQKQJNSA-N 0 3 401.576 4.133 20 0 HIADHN COc1cc2c(cc1CN[C@@H](C)[C@H](OC)c1ccc(Br)cc1)OCO2 ZINC000544709561 940505445 /nfs/dbraw/zinc/50/54/45/940505445.db2.gz DLDKVGOFYITCHY-BUXKBTBVSA-N 0 3 408.292 4.052 20 0 HIADHN CS[C@@H]1CN(C(=O)Nc2ccc(OC(C)C)cc2C(F)(F)F)C[C@@H]1N(C)C ZINC000544790975 940514307 /nfs/dbraw/zinc/51/43/07/940514307.db2.gz OYOOSNBKHVPXEA-JKSUJKDBSA-N 0 3 405.486 4.002 20 0 HIADHN CS[C@@H]1CN(C(=O)Nc2ccc(C)c(Oc3cc(C)ccn3)c2)C[C@H]1N(C)C ZINC000544792751 940514566 /nfs/dbraw/zinc/51/45/66/940514566.db2.gz IQOUHCQRVSFTDI-IEBWSBKVSA-N 0 3 400.548 4.000 20 0 HIADHN COc1ccc(-c2ccc(CN[C@H](Cc3ccc(Cl)cc3)C(N)=O)s2)cc1 ZINC000544846229 940518840 /nfs/dbraw/zinc/51/88/40/940518840.db2.gz KPZZETHOCGVGDI-LJQANCHMSA-N 0 3 400.931 4.263 20 0 HIADHN CO[C@@H](C)c1nc(Cc2noc(-c3ccc(CN4CCSCC4)cc3)n2)cs1 ZINC000545119484 940544510 /nfs/dbraw/zinc/54/45/10/940544510.db2.gz LFFZMXKFMNGPNY-AWEZNQCLSA-N 0 3 416.572 4.040 20 0 HIADHN C(=Cc1ccc(OCc2ccccn2)cc1)c1nc(CC2=N[C@@H]3CCCC[C@@H]3N2)no1 ZINC000545125923 940545597 /nfs/dbraw/zinc/54/55/97/940545597.db2.gz DHOMHFFLCURYOA-QKWGBRKZSA-N 0 3 415.497 4.069 20 0 HIADHN CCc1ccc([C@H](NC2Cc3ccccc3C2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000545157271 940552093 /nfs/dbraw/zinc/55/20/93/940552093.db2.gz FBCCGWNWBSBWSX-VWLOTQADSA-N 0 3 405.563 4.499 20 0 HIADHN Cc1cc(NC(=O)N2CC[C@H](N3CCN(C(C)C)CC3)C2)ccc1-c1ccccc1 ZINC000545176148 940554427 /nfs/dbraw/zinc/55/44/27/940554427.db2.gz NMKKRVUZNXVQJB-QHCPKHFHSA-N 0 3 406.574 4.294 20 0 HIADHN CSCc1ccccc1NC(=O)N1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000545429223 940569356 /nfs/dbraw/zinc/56/93/56/940569356.db2.gz XGXABUDTKFVKRT-ROUUACIJSA-N 0 3 405.608 4.293 20 0 HIADHN COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)cc1 ZINC000545430226 940569437 /nfs/dbraw/zinc/56/94/37/940569437.db2.gz ZRANWUFTSULFMR-YLJYHZDGSA-N 0 3 412.505 4.028 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](NCCC[C@H]2CCCCO2)c2ccc(F)c(F)c2)c1 ZINC000545459781 940570873 /nfs/dbraw/zinc/57/08/73/940570873.db2.gz AQPHLVRMZPGNPK-GCJKJVERSA-N 0 3 423.525 4.397 20 0 HIADHN CCN(C(=O)[C@H](C)Oc1ccc(CCC(C)=O)cc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000545474941 940571339 /nfs/dbraw/zinc/57/13/39/940571339.db2.gz IUUSPBQCMHPJAQ-XUZZJYLKSA-N 0 3 422.569 4.099 20 0 HIADHN CCN(C(=O)c1cccc(Nc2ccc(C)nn2)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000545492242 940571940 /nfs/dbraw/zinc/57/19/40/940571940.db2.gz MEPZVMNDQVMGET-QHCPKHFHSA-N 0 3 415.541 4.265 20 0 HIADHN O=C1CCCN1c1ccc(-c2noc(-c3ccc(CN4CCSCC4)cc3)n2)cc1 ZINC000545533004 940573581 /nfs/dbraw/zinc/57/35/81/940573581.db2.gz MPWYRKHVORNIKM-UHFFFAOYSA-N 0 3 420.538 4.079 20 0 HIADHN CCc1ccc(/C(C)=C\c2nc(-c3ccc(N4CCCN(C)CC4)nc3)no2)cc1 ZINC000545650972 940578949 /nfs/dbraw/zinc/57/89/49/940578949.db2.gz JNJJEGNXHMUDQH-VLGSPTGOSA-N 0 3 403.530 4.396 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(-c4csc(-c5cccs5)n4)n3)cn2)CC1 ZINC000545653781 940579044 /nfs/dbraw/zinc/57/90/44/940579044.db2.gz JZIXLRDPUOQDLH-UHFFFAOYSA-N 0 3 424.555 4.126 20 0 HIADHN Cc1cccn2cc(Cc3noc([C@@H]4CCCN(Cc5cccc(F)c5)C4)n3)nc12 ZINC000545677745 940580208 /nfs/dbraw/zinc/58/02/08/940580208.db2.gz DGQMNCLISHUVNF-GOSISDBHSA-N 0 3 405.477 4.135 20 0 HIADHN O=C(c1ccccc1)N(Cc1noc(C2CCN(Cc3ccccc3)CC2)n1)C1CC1 ZINC000545734133 940582943 /nfs/dbraw/zinc/58/29/43/940582943.db2.gz PTFRFTDSDIFRGT-UHFFFAOYSA-N 0 3 416.525 4.254 20 0 HIADHN CN(C)Cc1cc(-c2noc(-c3ccc(CN4CCSCC4)cc3)n2)ccc1F ZINC000545749887 940583702 /nfs/dbraw/zinc/58/37/02/940583702.db2.gz AOGOHMPSWHBKKB-UHFFFAOYSA-N 0 3 412.534 4.153 20 0 HIADHN COCCOc1ccc(Cc2noc(C3CCN(Cc4ccccc4)CC3)n2)cc1 ZINC000545777389 940585098 /nfs/dbraw/zinc/58/50/98/940585098.db2.gz VJLZEIKPIDJXAI-UHFFFAOYSA-N 0 3 407.514 4.065 20 0 HIADHN CN(C)c1nc2cc(-c3noc([C@H]4CCCN(Cc5cccc(F)c5)C4)n3)ccc2o1 ZINC000545824043 940616375 /nfs/dbraw/zinc/61/63/75/940616375.db2.gz WEKYCKPSMJGUQW-KRWDZBQOSA-N 0 3 421.476 4.463 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)c1cc(C)n(-c2ccccc2Cl)n1)c1ccco1 ZINC000563986686 945336241 /nfs/dbraw/zinc/33/62/41/945336241.db2.gz YITRQORCMVQIBC-RDTXWAMCSA-N 0 3 400.910 4.286 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)C1(c2ccccc2Br)CC1)c1ccco1 ZINC000563986303 945336325 /nfs/dbraw/zinc/33/63/25/945336325.db2.gz VHIQHAGOUTYTKT-RHSMWYFYSA-N 0 3 405.336 4.319 20 0 HIADHN Cc1cc(C(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)c(C)n1Cc1ccncc1 ZINC000545862699 940642082 /nfs/dbraw/zinc/64/20/82/940642082.db2.gz TWBWDYOWGSLMOY-WMZHIEFXSA-N 0 3 402.542 4.114 20 0 HIADHN Cc1cc(C(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)c(C)n1Cc1ccncc1 ZINC000545862698 940642460 /nfs/dbraw/zinc/64/24/60/940642460.db2.gz TWBWDYOWGSLMOY-CVDCTZTESA-N 0 3 402.542 4.114 20 0 HIADHN Cc1cc(CN2CCSCC2)ccc1N[C@H](C)Cn1cc(Br)cn1 ZINC000546007534 940673886 /nfs/dbraw/zinc/67/38/86/940673886.db2.gz FPLYXOOCASZVSG-OAHLLOKOSA-N 0 3 409.397 4.003 20 0 HIADHN C[C@H]1CCCC[N@@H+]1Cc1ccc([N-]S(=O)(=O)c2ccccc2Cn2ccnc2)cc1 ZINC000546087448 940695525 /nfs/dbraw/zinc/69/55/25/940695525.db2.gz GGZNNLOWJPMZJG-IBGZPJMESA-N 0 3 424.570 4.107 20 0 HIADHN C[C@H]1CCCC[N@H+]1Cc1ccc([N-]S(=O)(=O)c2ccccc2Cn2ccnc2)cc1 ZINC000546087448 940695529 /nfs/dbraw/zinc/69/55/29/940695529.db2.gz GGZNNLOWJPMZJG-IBGZPJMESA-N 0 3 424.570 4.107 20 0 HIADHN CCc1nnc(C)cc1C(=O)NC[C@@H](c1ccc(C(F)(F)F)cc1)N(CC)CC ZINC000546101090 940699481 /nfs/dbraw/zinc/69/94/81/940699481.db2.gz KUJCWBCMKXSNJX-IBGZPJMESA-N 0 3 408.468 4.179 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)N[C@H](CC(C)(C)C)C(F)(F)F)CC2)C[C@@H](C)O1 ZINC000546110710 940702238 /nfs/dbraw/zinc/70/22/38/940702238.db2.gz OFIRMRTVDZXLIL-JFIYKMOQSA-N 0 3 421.548 4.274 20 0 HIADHN COc1ccc(NC(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)cc1OC(C)C ZINC000546218735 940732603 /nfs/dbraw/zinc/73/26/03/940732603.db2.gz RUFZQINFIYOLRJ-UHFFFAOYSA-N 0 3 421.488 4.356 20 0 HIADHN Fc1cccc(CN2CCC[C@H](c3nc(-c4ccc(N5CCCC5)cn4)no3)C2)c1 ZINC000546500385 940837773 /nfs/dbraw/zinc/83/77/73/940837773.db2.gz FXMDQIPMZGQPLS-SFHVURJKSA-N 0 3 407.493 4.251 20 0 HIADHN Cc1noc(C)c1CO[C@@H]1CCN(CCC(=O)Nc2c(Cl)cccc2Cl)C1 ZINC000546589471 940858935 /nfs/dbraw/zinc/85/89/35/940858935.db2.gz VPHMINRPVQRPNS-CQSZACIVSA-N 0 3 412.317 4.218 20 0 HIADHN O=S(=O)(CCCN[C@H](COc1ccccc1F)c1ccccc1)c1ccccc1 ZINC000546629207 940862772 /nfs/dbraw/zinc/86/27/72/940862772.db2.gz JBOPEBBTITZDDX-JOCHJYFZSA-N 0 3 413.514 4.399 20 0 HIADHN Cc1nc(C(=O)N2CCCN(CCCc3ccccc3)CC2)c(-c2ccccc2)o1 ZINC000546790178 940883490 /nfs/dbraw/zinc/88/34/90/940883490.db2.gz KJZMAYAJBALUAT-UHFFFAOYSA-N 0 3 403.526 4.431 20 0 HIADHN CCN(C(=O)c1ccc(-c2nc(C3CC3)no2)cc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000546893100 940904017 /nfs/dbraw/zinc/90/40/17/940904017.db2.gz LOYNIVQHIHGNBX-QFIPXVFZSA-N 0 3 416.525 4.351 20 0 HIADHN O=C1C[C@@H](c2noc([C@@H]3CCCN(Cc4cccc(F)c4)C3)n2)CN1c1ccccc1 ZINC000547133673 941007408 /nfs/dbraw/zinc/00/74/08/941007408.db2.gz GGZXJMAAPBURQQ-RTBURBONSA-N 0 3 420.488 4.109 20 0 HIADHN c1cncc(CN2CCC[C@H](c3nc(-c4ccc(OC5CCOCC5)cc4)no3)C2)c1 ZINC000547202830 941031534 /nfs/dbraw/zinc/03/15/34/941031534.db2.gz MTBRTKNNNALIFT-FQEVSTJZSA-N 0 3 420.513 4.069 20 0 HIADHN CCN(CC)CCN(Cc1cccs1)C(=O)Nc1ccccc1C[S@](C)=O ZINC000547287833 941052381 /nfs/dbraw/zinc/05/23/81/941052381.db2.gz WDNQDVCAVNWDSG-MHZLTWQESA-N 0 3 407.605 4.003 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCO[C@@H](c2ccc(F)cc2F)C1)c1ccsc1 ZINC000547628979 941069403 /nfs/dbraw/zinc/06/94/03/941069403.db2.gz JLHDJUCQUSUQES-WOJBJXKFSA-N 0 3 423.529 4.192 20 0 HIADHN CCCOc1ccc(CN(C)[C@H](C)c2cccc(N3CCCS3(=O)=O)c2)cc1 ZINC000547660068 941070913 /nfs/dbraw/zinc/07/09/13/941070913.db2.gz QYGCBPVTFFSCPK-GOSISDBHSA-N 0 3 402.560 4.208 20 0 HIADHN COc1cccc(C2CCN(C(=O)NCCCN3CCc4ccccc4C3)CC2)c1 ZINC000548035624 941083760 /nfs/dbraw/zinc/08/37/60/941083760.db2.gz AOLGGJXQJWGKEB-UHFFFAOYSA-N 0 3 407.558 4.033 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)Nc3cccc4cc[nH]c43)CC2)c1 ZINC000548178255 941090822 /nfs/dbraw/zinc/09/08/22/941090822.db2.gz WJYFQJZNMOWTNN-UHFFFAOYSA-N 0 3 405.546 4.200 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccnc2)C1)N1C[C@H](c2ccccc2)[C@@H]2CCCC[C@@H]21 ZINC000548253301 941092377 /nfs/dbraw/zinc/09/23/77/941092377.db2.gz HAYGXTYWUXBFQI-RCTAOEEJSA-N 0 3 403.570 4.478 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2coc(C3CCCCC3)n2)cc1)[C@H]1CCCN(C)C1 ZINC000548274500 941092925 /nfs/dbraw/zinc/09/29/25/941092925.db2.gz IZKDMLGJMFFZMC-FQEVSTJZSA-N 0 3 424.545 4.141 20 0 HIADHN COCCOc1ccc(C(F)(F)F)cc1NC(=O)CN(C)[C@@H]1CCCC[C@H]1C ZINC000548403125 941100190 /nfs/dbraw/zinc/10/01/90/941100190.db2.gz PQLIFUNPSDEYHX-RHSMWYFYSA-N 0 3 402.457 4.180 20 0 HIADHN COc1ccc(NC(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)c2ncccc12 ZINC000548431079 941103157 /nfs/dbraw/zinc/10/31/57/941103157.db2.gz INBLLNYZBIHKCC-GOSISDBHSA-N 0 3 404.514 4.372 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)N3CC4(CC4)c4ccccc43)CC2)c1 ZINC000548505552 941110930 /nfs/dbraw/zinc/11/09/30/941110930.db2.gz XCJJNLABWIBBGW-UHFFFAOYSA-N 0 3 418.585 4.159 20 0 HIADHN CCNC(=O)Nc1cccc(NC(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)c1C ZINC000548968384 941135686 /nfs/dbraw/zinc/13/56/86/941135686.db2.gz URDPXAPOYUHQLT-LJQANCHMSA-N 0 3 417.941 4.214 20 0 HIADHN CC(C)C(=O)c1ccc([C@H](C)C(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)cc1 ZINC000549008652 941142439 /nfs/dbraw/zinc/14/24/39/941142439.db2.gz BFQOOURPJGPZAE-KRWDZBQOSA-N 0 3 416.512 4.497 20 0 HIADHN C[C@@H]1C[C@@H](CCNC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)C[C@H](C)O1 ZINC000549020757 941144198 /nfs/dbraw/zinc/14/41/98/941144198.db2.gz MXBMMFZGBLUDKV-SHJAMOMRSA-N 0 3 412.496 4.151 20 0 HIADHN C[C@@H]1CC(CCNC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)C[C@@H](C)O1 ZINC000549020755 941144343 /nfs/dbraw/zinc/14/43/43/941144343.db2.gz MXBMMFZGBLUDKV-LZJOCLMNSA-N 0 3 412.496 4.151 20 0 HIADHN CCc1ccccc1[C@@H]1C[C@H]1C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000549063833 941151209 /nfs/dbraw/zinc/15/12/09/941151209.db2.gz JWSLDFPJEPUHBJ-BJKOFHAPSA-N 0 3 410.533 4.151 20 0 HIADHN COc1cccc([C@@H]2[C@H](N[C@H](C)C(=O)Nc3cc(C)ccc3C)CCN2C2CC2)c1 ZINC000549112193 941160987 /nfs/dbraw/zinc/16/09/87/941160987.db2.gz GOGPLBCMSBJCJW-IHLLOCCUSA-N 0 3 407.558 4.207 20 0 HIADHN CCN1CC[C@@H](NCC(=O)Nc2cc(C)ccc2OC)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000549113495 941161239 /nfs/dbraw/zinc/16/12/39/941161239.db2.gz PZCLHWJGCDRERN-GCJKJVERSA-N 0 3 419.928 4.160 20 0 HIADHN COc1cccc([C@H]2[C@@H](NCC(=O)Nc3ccc(C)cc3Cl)CCN2C2CC2)c1 ZINC000549118296 941161872 /nfs/dbraw/zinc/16/18/72/941161872.db2.gz RWKQADKITMWFNQ-GMAHTHKFSA-N 0 3 413.949 4.163 20 0 HIADHN CCOC(=O)C1CCC(N(CC)CC(=O)c2cc(C)n(CC(F)(F)F)c2C)CC1 ZINC000549176164 941168634 /nfs/dbraw/zinc/16/86/34/941168634.db2.gz CYZMBSJRPZNTOK-UHFFFAOYSA-N 0 3 416.484 4.294 20 0 HIADHN Cc1[nH]c(=O)c(C(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)cc1-c1ccccc1 ZINC000549229668 941172412 /nfs/dbraw/zinc/17/24/12/941172412.db2.gz CLFZPQIJEPVMQF-NRFANRHFSA-N 0 3 409.917 4.449 20 0 HIADHN Cc1ccc([C@H](CNC(=O)NCCc2nc3ccccc3s2)N2CCCC2)cc1 ZINC000549276947 941176276 /nfs/dbraw/zinc/17/62/76/941176276.db2.gz WCMMGSIQWQHUGT-FQEVSTJZSA-N 0 3 408.571 4.284 20 0 HIADHN COc1cnc2ccccc2c1C(=O)N1CCCN(CCCc2ccccc2)CC1 ZINC000549342837 941181382 /nfs/dbraw/zinc/18/13/82/941181382.db2.gz ZEOXGKOAHSCNQV-UHFFFAOYSA-N 0 3 403.526 4.024 20 0 HIADHN C[C@H]1CN(C2CCOCC2)CCN1C(=O)Nc1ccc(-c2ccc(Cl)s2)nc1 ZINC000549371598 941183549 /nfs/dbraw/zinc/18/35/49/941183549.db2.gz GYGMCIIQDJYLOK-AWEZNQCLSA-N 0 3 420.966 4.181 20 0 HIADHN CC(=O)Nc1ccc(OC[C@@H](O)CN(Cc2ccc(C(C)C)nc2C)C(C)C)cc1 ZINC000549426441 941188846 /nfs/dbraw/zinc/18/88/46/941188846.db2.gz RWVHUGCZTRWMOW-QFIPXVFZSA-N 0 3 413.562 4.122 20 0 HIADHN Cc1ccc(C)c(NC(=O)CN[C@H]2CCN(C(C)C)[C@H]2c2ccc(F)c(F)c2)c1 ZINC000549469478 941193109 /nfs/dbraw/zinc/19/31/09/941193109.db2.gz UGMKOAWMDSJZHB-REWPJTCUSA-N 0 3 401.501 4.334 20 0 HIADHN CCN1CC[C@H](NCC(=O)Nc2cccc(SC)c2)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000549472361 941193735 /nfs/dbraw/zinc/19/37/35/941193735.db2.gz MZKYJMFZFJMZFM-RXVVDRJESA-N 0 3 423.504 4.189 20 0 HIADHN CN(CC(F)(F)F)C(=O)CN[C@@H]1CCN(C(C)(C)C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000549479067 941194750 /nfs/dbraw/zinc/19/47/50/941194750.db2.gz XGRMHHNIEUVNCY-NVXWUHKLSA-N 0 3 423.882 4.003 20 0 HIADHN CCN1CC[C@@H](NCC(=O)Nc2cc(C)cc(C)c2)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000549483172 941195311 /nfs/dbraw/zinc/19/53/11/941195311.db2.gz QQNCUBDSFACRRK-KNQAVFIVSA-N 0 3 405.464 4.084 20 0 HIADHN Cc1nn(C(C)(C)C)cc1[C@@H](C)NC(=O)N[C@H](CN(C)C)c1ccc(Cl)cc1 ZINC000549493765 941196252 /nfs/dbraw/zinc/19/62/52/941196252.db2.gz VPUQAWSSVVRFBQ-AUUYWEPGSA-N 0 3 405.974 4.263 20 0 HIADHN CCCCNC(=O)c1ccc(CN[C@@H]2CC[C@@H](C(=O)OCC)c3ccccc32)cc1 ZINC000549525910 941198062 /nfs/dbraw/zinc/19/80/62/941198062.db2.gz BEFOBSNAZHPECE-DHIUTWEWSA-N 0 3 408.542 4.488 20 0 HIADHN COc1ccc([C@H]2C[C@H](NC(=O)N[C@@H](CN(C)C)c3ccc(Cl)cc3)C2)cc1F ZINC000549553713 941199103 /nfs/dbraw/zinc/19/91/03/941199103.db2.gz ARFZOXBTTBXRKQ-QRFRQXIXSA-N 0 3 419.928 4.336 20 0 HIADHN Cc1ccsc1-c1nnc(N2CCN(C)[C@H](C(C)C)C2)n1Cc1cccs1 ZINC000549574349 941200026 /nfs/dbraw/zinc/20/00/26/941200026.db2.gz YOQGVMLCRRKFPS-KRWDZBQOSA-N 0 3 401.605 4.201 20 0 HIADHN CC(=O)c1cccc(OCCCC(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)c1 ZINC000549617563 941201536 /nfs/dbraw/zinc/20/15/36/941201536.db2.gz VEGHBJCNRFLDCE-NRFANRHFSA-N 0 3 402.922 4.121 20 0 HIADHN COc1cc2c(cc1F)CC[C@@H]2NC(=O)N[C@@H](CN(C)C)c1ccc(Cl)cc1 ZINC000549624069 941201800 /nfs/dbraw/zinc/20/18/00/941201800.db2.gz FDIOULUTMLDAMP-OALUTQOASA-N 0 3 405.901 4.077 20 0 HIADHN CC[C@H](C)c1nnc(N2CCN(C3CCC(C(C)C)CC3)CC2)n1C[C@@H]1CCOC1 ZINC000549652260 941203035 /nfs/dbraw/zinc/20/30/35/941203035.db2.gz WZIOPCHCTZYQHW-PHZLKFDYSA-N 0 3 417.642 4.165 20 0 HIADHN Clc1cccc(N2CCOCC2)c1CNCCCOc1cccc2cccnc21 ZINC000549755921 941206541 /nfs/dbraw/zinc/20/65/41/941206541.db2.gz ORJAUGJZPPRDCC-UHFFFAOYSA-N 0 3 411.933 4.284 20 0 HIADHN CCc1oc(CNC2CCN(Cc3coc(-c4ccccc4)n3)CC2)cc1C(=O)OC ZINC000549802683 941207730 /nfs/dbraw/zinc/20/77/30/941207730.db2.gz WKRXZMHWCXNEIM-UHFFFAOYSA-N 0 3 423.513 4.038 20 0 HIADHN CC(C)[C@H](CCc1ccccc1)C(=O)Nc1cccc(CN2CCC(C(N)=O)CC2)c1 ZINC000549822140 941208602 /nfs/dbraw/zinc/20/86/02/941208602.db2.gz NKBGTTKXMRJTBF-DEOSSOPVSA-N 0 3 421.585 4.227 20 0 HIADHN COc1cc(Br)c(CNCCc2cc(C(F)(F)F)ccn2)cc1OC ZINC000549879554 941224457 /nfs/dbraw/zinc/22/44/57/941224457.db2.gz FSPWMYKZKNWCEC-UHFFFAOYSA-N 0 3 419.241 4.212 20 0 HIADHN COc1ccc(-c2noc([C@@H](C)N[C@H](C)C3CCN(CC(F)(F)F)CC3)n2)cc1 ZINC000550024226 941267437 /nfs/dbraw/zinc/26/74/37/941267437.db2.gz FKUJUYOVSSPFCG-ZIAGYGMSSA-N 0 3 412.456 4.059 20 0 HIADHN CC[C@H]1CN(c2nnc(C3CCC3)n2C[C@H]2CCCCO2)CCN1Cc1ccccc1 ZINC000550055922 941275374 /nfs/dbraw/zinc/27/53/74/941275374.db2.gz DWRSQRLOYJIBFZ-XZOQPEGZSA-N 0 3 423.605 4.216 20 0 HIADHN COCCc1ccc(OC[C@H](O)CN2CCC([C@H](F)c3ccccc3F)CC2)cc1 ZINC000550097815 941284222 /nfs/dbraw/zinc/28/42/22/941284222.db2.gz VERXMWOWVQXYFK-YKSBVNFPSA-N 0 3 419.512 4.177 20 0 HIADHN OC1CCN(Cc2ccccc2N[C@H]2CCc3cccc(Br)c3C2)CC1 ZINC000550139195 941288754 /nfs/dbraw/zinc/28/87/54/941288754.db2.gz KUNWCMCGEMCQEQ-SFHVURJKSA-N 0 3 415.375 4.375 20 0 HIADHN COc1cccc(-c2nc(C)c(C(=O)N(Cc3ccccc3)C3CCN(C)CC3)[nH]2)c1 ZINC000550211578 941299237 /nfs/dbraw/zinc/29/92/37/941299237.db2.gz XWDAMVIRPATNMI-UHFFFAOYSA-N 0 3 418.541 4.130 20 0 HIADHN CCS(=O)(=O)c1ccc([C@@H](C)N[C@@H](C)c2ccc(NC(=O)NC3CC3)cc2)cc1 ZINC000550425727 941325237 /nfs/dbraw/zinc/32/52/37/941325237.db2.gz UFRXXOSADKOZEG-JKSUJKDBSA-N 0 3 415.559 4.176 20 0 HIADHN COC(=O)CCC[C@@H]1CCC[C@H](N[C@H](c2nc(-c3ccncc3)no2)C(C)C)C1 ZINC000550643668 941349076 /nfs/dbraw/zinc/34/90/76/941349076.db2.gz CISNPYREXHZXQU-QRFRQXIXSA-N 0 3 400.523 4.320 20 0 HIADHN FC(F)(F)c1cccc(C2(C[NH2+][C@H](c3cccs3)c3nnc[n-]3)CCOCC2)c1 ZINC000551004881 941393748 /nfs/dbraw/zinc/39/37/48/941393748.db2.gz AHGNBTATOMYZCT-QGZVFWFLSA-N 0 3 422.476 4.312 20 0 HIADHN NS(=O)(=O)c1ccc2c(c1)CCC[C@H]2N[C@H]1CCSc2ccc(Cl)cc21 ZINC000551015033 941395364 /nfs/dbraw/zinc/39/53/64/941395364.db2.gz TWMYEMGVXZUZFO-MSOLQXFVSA-N 0 3 408.976 4.192 20 0 HIADHN NS(=O)(=O)c1ccc2c(c1)CCC[C@H]2NCc1ccc(Oc2ccccc2)cc1 ZINC000551029261 941397438 /nfs/dbraw/zinc/39/74/38/941397438.db2.gz BNBJLIHWMVSQJU-HSZRJFAPSA-N 0 3 408.523 4.294 20 0 HIADHN NS(=O)(=O)c1ccc2c(c1)CCC[C@H]2NCc1ccc(OC2CCCCC2)cc1 ZINC000551029769 941397485 /nfs/dbraw/zinc/39/74/85/941397485.db2.gz RHIYWNSPRCAFJC-HSZRJFAPSA-N 0 3 414.571 4.213 20 0 HIADHN NS(=O)(=O)c1ccc2c(c1)CCC[C@@H]2N[C@@H](c1ccccc1F)C1CCCC1 ZINC000551063519 941403322 /nfs/dbraw/zinc/40/33/22/941403322.db2.gz SLUJDQYRWHBKJE-FCHUYYIVSA-N 0 3 402.535 4.372 20 0 HIADHN CN1CC[C@@H](NCC(=O)Nc2ccc(Br)cc2Cl)[C@@H]1c1ccccc1 ZINC000551098011 941409436 /nfs/dbraw/zinc/40/94/36/941409436.db2.gz UYBNMNARSSSTFX-MJGOQNOKSA-N 0 3 422.754 4.076 20 0 HIADHN O[C@@H](CNCc1cnc(-c2ccc(Cl)cc2)s1)COc1ccc(F)c(F)c1 ZINC000551185875 941424468 /nfs/dbraw/zinc/42/44/68/941424468.db2.gz AKIGOBLULLEBHI-AWEZNQCLSA-N 0 3 410.873 4.271 20 0 HIADHN C[C@H](N[C@@H]1CCCN([C@@H](C)c2ccccc2F)C1=O)c1ccc2c(c1)CCC(=O)N2 ZINC000551242887 941434433 /nfs/dbraw/zinc/43/44/33/941434433.db2.gz XYPCTHNARNXKSP-PONJGIIJSA-N 0 3 409.505 4.113 20 0 HIADHN CCCOc1ccccc1Oc1ncccc1CN[C@H]1CCC[C@@H](S(C)(=O)=O)C1 ZINC000551266102 941439529 /nfs/dbraw/zinc/43/95/29/941439529.db2.gz VZLRBCAPMIYZBZ-RBUKOAKNSA-N 0 3 418.559 4.108 20 0 HIADHN C[C@H](N[C@@H]1CCCN([C@@H](C)c2ccc(F)cc2)C1=O)c1ccc2c(c1)CCC(=O)N2 ZINC000551274577 941441727 /nfs/dbraw/zinc/44/17/27/941441727.db2.gz SHZANMXUWMJAQF-PONJGIIJSA-N 0 3 409.505 4.113 20 0 HIADHN COC(=O)[C@H](Cc1ccccc1)[C@H](C)N[C@@H](C)C(=O)Nc1c(C)cccc1C(C)C ZINC000551420385 941475406 /nfs/dbraw/zinc/47/54/06/941475406.db2.gz ZDVUCKTZOPYDFC-CNNODRBYSA-N 0 3 410.558 4.455 20 0 HIADHN O=C(CN[C@H](c1cccc(C(F)(F)F)c1)C1CCOCC1)NCc1ccccc1 ZINC000551422271 941475810 /nfs/dbraw/zinc/47/58/10/941475810.db2.gz ZLQHEWCVRPJHQD-NRFANRHFSA-N 0 3 406.448 4.079 20 0 HIADHN CN(C(=O)c1ccc(NCc2csc(C(C)(C)C)n2)cc1)[C@H]1CCCN(C)C1 ZINC000551446592 941480825 /nfs/dbraw/zinc/48/08/25/941480825.db2.gz VIJWGSQXRUHSOX-IBGZPJMESA-N 0 3 400.592 4.219 20 0 HIADHN CCCCO[C@@H]1C[C@@H](NCc2cc(C(F)(F)F)cc(S(C)(=O)=O)c2)C1(C)C ZINC000551517101 941493324 /nfs/dbraw/zinc/49/33/24/941493324.db2.gz DZDGDRGMPCIUTM-IAGOWNOFSA-N 0 3 407.498 4.182 20 0 HIADHN CC(C)Oc1ccc([C@@H](C)NCc2ccc([C@]3(C)NC(=O)NC3=O)cc2)cc1Cl ZINC000551533276 941496520 /nfs/dbraw/zinc/49/65/20/941496520.db2.gz JUQZTEFOWNWNHB-PEBXRYMYSA-N 0 3 415.921 4.033 20 0 HIADHN CC[C@H](N[C@@H](C)c1cnc(OC)c(Cl)c1)[C@@H]1CN(Cc2ccccc2)CCO1 ZINC000551533695 941496596 /nfs/dbraw/zinc/49/65/96/941496596.db2.gz NBALLTAVYLZHRO-NDXORKPFSA-N 0 3 403.954 4.074 20 0 HIADHN Cn1c2ccccc2nc1[C@H]1CCCCN1C[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000551699450 941528783 /nfs/dbraw/zinc/52/87/83/941528783.db2.gz CHYONUTWNVLWSX-WIOPSUGQSA-N 0 3 418.585 4.391 20 0 HIADHN COC(=O)[C@H](Cc1ccccc1)[C@@H](C)N[C@@H](C)C(=O)Nc1cc(Cl)ccc1Cl ZINC000551718116 941532750 /nfs/dbraw/zinc/53/27/50/941532750.db2.gz OPPBREDQUIUBSG-JKIFEVAISA-N 0 3 423.340 4.330 20 0 HIADHN O=C(CCN1CCC(F)(c2cccnc2)CC1)Nc1ccc(Br)cc1 ZINC000551748659 941537787 /nfs/dbraw/zinc/53/77/87/941537787.db2.gz ZHAYTKHAQLCVFD-UHFFFAOYSA-N 0 3 406.299 4.134 20 0 HIADHN CCOC(=O)c1oc2c(c1C)[C@H](N[C@@H](CN(C)C)c1ccc(OC)cc1)CCC2 ZINC000551804432 941548278 /nfs/dbraw/zinc/54/82/78/941548278.db2.gz ZSGIOOBJEINIEB-MOPGFXCFSA-N 0 3 400.519 4.043 20 0 HIADHN CC(C)CN(Cc1cnc(N2CCN(C)CC2)nc1)[C@@H](C)c1ccccc1Cl ZINC000551813088 941550133 /nfs/dbraw/zinc/55/01/33/941550133.db2.gz QWLGHGKVNUHDCA-SFHVURJKSA-N 0 3 401.986 4.101 20 0 HIADHN C[C@H](NCc1cccc(N2C(=O)N[C@](C)(C3CC3)C2=O)c1)c1cc2c(s1)CCC2 ZINC000551818523 941552139 /nfs/dbraw/zinc/55/21/39/941552139.db2.gz VNCIMALCTWXZNV-LFVRLGFBSA-N 0 3 409.555 4.313 20 0 HIADHN Cc1cc([C@@H](C)N[C@@H](CN2CCN(C)CC2)c2ccccc2)sc1Br ZINC000552013694 941568624 /nfs/dbraw/zinc/56/86/24/941568624.db2.gz QFTCDFCVUDDOOK-AEFFLSMTSA-N 0 3 422.436 4.458 20 0 HIADHN CC(C)c1cc(C(=O)N2CCN(c3ccnc4ccccc43)CC2)nn1C(C)(C)C ZINC000552009079 941568726 /nfs/dbraw/zinc/56/87/26/941568726.db2.gz VKVNRFQWSQVEOK-UHFFFAOYSA-N 0 3 405.546 4.272 20 0 HIADHN COc1ccc([C@H](Cc2ccncc2)NCc2ccc(-n3ccnc3)c(F)c2)cc1 ZINC000552047299 941573186 /nfs/dbraw/zinc/57/31/86/941573186.db2.gz HFBQVOVPGOGQHT-QHCPKHFHSA-N 0 3 402.473 4.489 20 0 HIADHN CCC[C@@H](N[C@H](C)c1ccc(OC)c(OC)c1C)C(=O)N1CCc2sccc2C1 ZINC000552044949 941573431 /nfs/dbraw/zinc/57/34/31/941573431.db2.gz SSPQMYQPBLIRTA-VQIMIIECSA-N 0 3 416.587 4.478 20 0 HIADHN C[C@H](N[C@@H](c1cccc(OC(F)(F)F)c1)C1CC1)c1ccc(S(N)(=O)=O)cc1 ZINC000552085859 941581600 /nfs/dbraw/zinc/58/16/00/941581600.db2.gz OWGXHHKMHOUZAP-KPZWWZAWSA-N 0 3 414.449 4.035 20 0 HIADHN COc1ccc([C@@H](C)NC[C@H]2CC[C@@H](c3nc(C4CC4)no3)O2)c(Br)c1 ZINC000552091230 941583624 /nfs/dbraw/zinc/58/36/24/941583624.db2.gz GAYKETDVMYWWCX-ZLENFMNRSA-N 0 3 422.323 4.289 20 0 HIADHN FC(F)(F)C1(CN[C@@H]2CCCOc3ccc(I)cc32)CC1 ZINC000552095935 941584224 /nfs/dbraw/zinc/58/42/24/941584224.db2.gz JUNZPCHAMLRKID-GFCCVEGCSA-N 0 3 411.205 4.437 20 0 HIADHN O=C([C@@H]1CN(Cc2ccccc2)CCC1(F)F)N1CCc2ccc(F)c(F)c2C1 ZINC000552127031 941589703 /nfs/dbraw/zinc/58/97/03/941589703.db2.gz OPAYOIJCFREXBJ-SFHVURJKSA-N 0 3 406.423 4.007 20 0 HIADHN O=C(CCc1ccc(OC(F)F)cc1)N1CCN(c2ccnc3ccccc32)CC1 ZINC000552148496 941593654 /nfs/dbraw/zinc/59/36/54/941593654.db2.gz LLOARPFEYOQMSV-UHFFFAOYSA-N 0 3 411.452 4.118 20 0 HIADHN COc1cc(CN2CCC[C@@H](c3nnc(C4CC4)[nH]3)C2)ccc1OCc1ccncc1 ZINC000552203270 941601926 /nfs/dbraw/zinc/60/19/26/941601926.db2.gz FSBMEPYCEKLCTC-HXUWFJFHSA-N 0 3 419.529 4.044 20 0 HIADHN CC[C@H](NCC(=O)N[C@@H]1CCOc2ccccc21)c1ccc(OC(F)(F)F)cc1 ZINC000552260468 941616483 /nfs/dbraw/zinc/61/64/83/941616483.db2.gz COSBYUNENHFKPZ-ZWKOTPCHSA-N 0 3 408.420 4.266 20 0 HIADHN c1csc(-c2nn(Cc3ccccc3)cc2CN2CCC(O[C@H]3CCOC3)CC2)c1 ZINC000552304639 941628043 /nfs/dbraw/zinc/62/80/43/941628043.db2.gz WJGSJXKJLSISDM-QFIPXVFZSA-N 0 3 423.582 4.430 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1ccccc1N1CCCCC1 ZINC000552327622 941632939 /nfs/dbraw/zinc/63/29/39/941632939.db2.gz BGSNAUFVPRFMAP-UHFFFAOYSA-N 0 3 407.558 4.134 20 0 HIADHN COCc1c(C(=O)N(C)CCCN(C)Cc2ccncc2)sc2cccc(F)c21 ZINC000552360453 941644171 /nfs/dbraw/zinc/64/41/71/941644171.db2.gz GZZUMDFZRVTPHK-UHFFFAOYSA-N 0 3 415.534 4.176 20 0 HIADHN Brc1ccc2c(c1)[C@H](NCc1ccc(-n3cncn3)cc1)CCS2 ZINC000552413147 941662930 /nfs/dbraw/zinc/66/29/30/941662930.db2.gz LVWGIHGBHXAVSX-QGZVFWFLSA-N 0 3 401.333 4.357 20 0 HIADHN Brc1ccc2c(c1)[C@@H](NCc1ccc(-n3cncn3)cc1)CCS2 ZINC000552413146 941663332 /nfs/dbraw/zinc/66/33/32/941663332.db2.gz LVWGIHGBHXAVSX-KRWDZBQOSA-N 0 3 401.333 4.357 20 0 HIADHN O=C(N[C@@H](c1cncc(Br)c1)C1CC1)c1cccc(CN2CCCC2)c1 ZINC000552416428 941664479 /nfs/dbraw/zinc/66/44/79/941664479.db2.gz UPJUJQIFBYJHJL-HXUWFJFHSA-N 0 3 414.347 4.321 20 0 HIADHN Cc1nn(C(C)(C)C)cc1[C@H](C)NC(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000552434129 941670034 /nfs/dbraw/zinc/67/00/34/941670034.db2.gz QLCTZRYIUNUUDV-JXFKEZNVSA-N 0 3 418.532 4.281 20 0 HIADHN Cc1nc([C@@H]2CCCOC2)sc1C(=O)N(CCN1CCCCCC1)C1CCC1 ZINC000552441615 941672368 /nfs/dbraw/zinc/67/23/68/941672368.db2.gz OAXWMYYRKICZEW-GOSISDBHSA-N 0 3 405.608 4.216 20 0 HIADHN CC(C)Cn1cc(NC(=O)N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)c(C(F)F)n1 ZINC000552490400 941686948 /nfs/dbraw/zinc/68/69/48/941686948.db2.gz QNLNSORAXKLMIT-WBVHZDCISA-N 0 3 405.493 4.261 20 0 HIADHN Cc1cc(Br)ccc1NC(=O)CN[C@H](C)c1ccccc1-n1cccn1 ZINC000552536498 941700545 /nfs/dbraw/zinc/70/05/45/941700545.db2.gz HODMSHUKYXEFTC-OAHLLOKOSA-N 0 3 413.319 4.233 20 0 HIADHN CC(=O)c1ccc(OC[C@H](O)CNCc2ccc(Oc3ccc(F)cc3)cc2)cc1 ZINC000552626120 941726415 /nfs/dbraw/zinc/72/64/15/941726415.db2.gz JNRLWEHZXQYOTF-OAQYLSRUSA-N 0 3 409.457 4.350 20 0 HIADHN O=C(CC1(N2CCOCC2)CCCC1)N1CCC([C@@H](F)c2ccccc2F)CC1 ZINC000552792725 941764702 /nfs/dbraw/zinc/76/47/02/941764702.db2.gz QQVHZYVUJJZMOO-JOCHJYFZSA-N 0 3 406.517 4.110 20 0 HIADHN CC[C@H](C)Oc1cccc(NC(=O)N(C)C2CCN(CCc3ccccn3)CC2)c1 ZINC000552825866 941779682 /nfs/dbraw/zinc/77/96/82/941779682.db2.gz XNOQQBVYUNVVLO-IBGZPJMESA-N 0 3 410.562 4.430 20 0 HIADHN Cc1c(CNC[C@H](O)COc2cccc(Br)c2)oc2ccc(F)cc12 ZINC000552836726 941783089 /nfs/dbraw/zinc/78/30/89/941783089.db2.gz QZCAGYLYNRGLGU-HNNXBMFYSA-N 0 3 408.267 4.172 20 0 HIADHN Cc1cc2ncc([C@H](C)N[C@H](C)c3ccc(NC(=O)c4ccncc4)cc3)c(C)n2n1 ZINC000552866357 941792735 /nfs/dbraw/zinc/79/27/35/941792735.db2.gz ZGUUOTULACDHGK-SJORKVTESA-N 0 3 414.513 4.405 20 0 HIADHN C[C@@H](c1ccc(Cl)cc1)N(C)C(=O)CNC1(c2ccc(F)cc2)CCOCC1 ZINC000552945285 941806335 /nfs/dbraw/zinc/80/63/35/941806335.db2.gz MDEMOKJKSGMOEG-INIZCTEOSA-N 0 3 404.913 4.294 20 0 HIADHN Cc1cc(NC(=O)CN[C@@H](C[C@H]2CCOC2)c2ccccc2)n(-c2ccccc2F)n1 ZINC000553063477 941826830 /nfs/dbraw/zinc/82/68/30/941826830.db2.gz XSILMEFAZKOKGY-NQIIRXRSSA-N 0 3 422.504 4.016 20 0 HIADHN CN(CCC(=O)N[C@@H](c1cccs1)c1ccccc1)C[C@H]1COc2ccccc2O1 ZINC000553063292 941826868 /nfs/dbraw/zinc/82/68/68/941826868.db2.gz JYTLBXMVDLTNHF-YADARESESA-N 0 3 422.550 4.116 20 0 HIADHN Cc1cc(CN2CCSCC2)ccc1NC(=O)C[C@@H](c1ncc[nH]1)c1ccccc1 ZINC000553074384 941828856 /nfs/dbraw/zinc/82/88/56/941828856.db2.gz FOUDKDUYEPELHI-OAQYLSRUSA-N 0 3 420.582 4.428 20 0 HIADHN CNc1ccc(Cl)c(C(=O)NC2CCN(CCOc3ccc(Cl)cc3)CC2)c1 ZINC000553481433 941892843 /nfs/dbraw/zinc/89/28/43/941892843.db2.gz ILUNEMWWBHKAMD-UHFFFAOYSA-N 0 3 422.356 4.308 20 0 HIADHN CC(C)Oc1ccc(-c2nn(-c3ccccc3)cc2CNC[C@@H](O)C(F)F)cc1 ZINC000553530129 941903830 /nfs/dbraw/zinc/90/38/30/941903830.db2.gz ATXXHIAWDMOEEW-HXUWFJFHSA-N 0 3 401.457 4.042 20 0 HIADHN CCN1CC[C@H](N(C)C(=O)Nc2ccc(Cl)cc2C(=O)c2ccc[nH]2)C[C@@H]1C ZINC000553614945 941921364 /nfs/dbraw/zinc/92/13/64/941921364.db2.gz BPTODVCSZPHMGM-HOCLYGCPSA-N 0 3 402.926 4.236 20 0 HIADHN CN(CCCN(C)c1cc(C(F)(F)F)nc(-c2ccncc2)n1)Cc1ccco1 ZINC000553704775 941947511 /nfs/dbraw/zinc/94/75/11/941947511.db2.gz DDTUKOPRAYEVHQ-UHFFFAOYSA-N 0 3 405.424 4.109 20 0 HIADHN CN(C)c1ccc(-c2cncc(C(=O)N(C)CCCN(C)Cc3ccco3)c2)cc1 ZINC000553743190 941957352 /nfs/dbraw/zinc/95/73/52/941957352.db2.gz CYKVSVKKJNJGHD-UHFFFAOYSA-N 0 3 406.530 4.002 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)N[C@H](C)c1nc(C(C)(C)C)no1)c1ccc(Cl)cc1 ZINC000553797027 941971567 /nfs/dbraw/zinc/97/15/67/941971567.db2.gz DUIFVFAILRGSHC-PBHICJAKSA-N 0 3 421.973 4.464 20 0 HIADHN CCN(CCN1CCCCCC1)C(=O)c1cnc(-c2ccc(OC)c(OC)c2)s1 ZINC000553801385 941972711 /nfs/dbraw/zinc/97/27/11/941972711.db2.gz HLYLMGUNJBZAJB-UHFFFAOYSA-N 0 3 417.575 4.165 20 0 HIADHN CCCN(C)[C@H](CNC(=O)N1CCC[C@@H]([C@@H]2CCOC2)C1)c1ccc(Cl)cc1 ZINC000553895035 941992882 /nfs/dbraw/zinc/99/28/82/941992882.db2.gz LHTLHBQGYIFAQV-SFHLNBCPSA-N 0 3 407.986 4.181 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)N1CCC[C@H](c2ccnn2C)C1)c1ccc(Cl)cc1 ZINC000553895088 941993000 /nfs/dbraw/zinc/99/30/00/941993000.db2.gz LUVXCLRXBZQDGB-RXVVDRJESA-N 0 3 417.985 4.046 20 0 HIADHN OCC[C@H](NC[C@@H](O)COc1c(Cl)cccc1Cl)c1ccc(Cl)cc1 ZINC000553959563 942007330 /nfs/dbraw/zinc/00/73/30/942007330.db2.gz YPYRWFSLAWCNIZ-PBHICJAKSA-N 0 3 404.721 4.100 20 0 HIADHN CC[C@@H](CNC(=O)[C@@H](C)Cc1cncc2ccccc21)N1CCc2ccccc2C1 ZINC000553964004 942008399 /nfs/dbraw/zinc/00/83/99/942008399.db2.gz OGRJSWIKALFYRF-CYFREDJKSA-N 0 3 401.554 4.367 20 0 HIADHN CN(Cc1ccc(OCC(F)(F)F)cc1)C(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000553990306 942014555 /nfs/dbraw/zinc/01/45/55/942014555.db2.gz XCQYAWMYJZMITF-VQTJNVASSA-N 0 3 421.463 4.215 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)c2ccc(F)cc2Br)N(C)C)cc1 ZINC000554013571 942019060 /nfs/dbraw/zinc/01/90/60/942019060.db2.gz VYAAFKKZXRTRDG-IBGZPJMESA-N 0 3 423.326 4.408 20 0 HIADHN COc1cc(OC2CC2)ccc1C(=O)NC[C@H](c1ccc(OC(C)C)cc1)N(C)C ZINC000554016094 942019822 /nfs/dbraw/zinc/01/98/22/942019822.db2.gz RYCUHKKUWOVZJZ-JOCHJYFZSA-N 0 3 412.530 4.056 20 0 HIADHN C[C@H](NC(=O)Nc1cc(N2CCCC2=O)ccc1Cl)[C@H](c1ccccc1)N(C)C ZINC000554107298 942037603 /nfs/dbraw/zinc/03/76/03/942037603.db2.gz DBFUDTRTRNGWOS-YCRPNKLZSA-N 0 3 414.937 4.280 20 0 HIADHN C[C@H](NC(=O)Nc1ccccc1C(=O)N1CCCCC1)[C@H](c1ccccc1)N(C)C ZINC000554111763 942038520 /nfs/dbraw/zinc/03/85/20/942038520.db2.gz BKVOSMVERCKRAI-PGRDOPGGSA-N 0 3 408.546 4.126 20 0 HIADHN COc1ccc([C@H](NC2CCC(NC(C)=O)CC2)c2ccccc2Cl)cc1OC ZINC000554117932 942041366 /nfs/dbraw/zinc/04/13/66/942041366.db2.gz LURAZLJPXDEDIW-KXXGJQBSSA-N 0 3 416.949 4.484 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N1Cc2cccc(Cl)c2C1 ZINC000554144257 942048653 /nfs/dbraw/zinc/04/86/53/942048653.db2.gz IQEHYEZHGAYDNZ-UHFFFAOYSA-N 0 3 401.860 4.171 20 0 HIADHN C[C@H](NC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C)c1nccn1-c1ccccc1 ZINC000554333678 942106368 /nfs/dbraw/zinc/10/63/68/942106368.db2.gz UIBOCZBYRKKTOF-RTWAWAEBSA-N 0 3 417.557 4.239 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)Nc1cccc(C(=O)NCC)c1)c1ccc(Cl)cc1 ZINC000554363201 942114369 /nfs/dbraw/zinc/11/43/69/942114369.db2.gz AWYQSGBVTAFWTE-FQEVSTJZSA-N 0 3 416.953 4.294 20 0 HIADHN CCOc1ccc(NC(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)cc1OC ZINC000554383254 942120860 /nfs/dbraw/zinc/12/08/60/942120860.db2.gz POGMGOPLFCNMOM-FQEVSTJZSA-N 0 3 415.534 4.306 20 0 HIADHN CCCC(=O)Nc1cccc(NC(=O)N[C@@H](CN(C)C)c2ccc(F)cc2)c1C ZINC000554411913 942132173 /nfs/dbraw/zinc/13/21/73/942132173.db2.gz DUHGRWWBQXNRKT-FQEVSTJZSA-N 0 3 400.498 4.297 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1ccc(C)cc1OC[C@@H]1CCCO1)c1ccco1 ZINC000554433114 942141190 /nfs/dbraw/zinc/14/11/90/942141190.db2.gz SNKFVMHOXBOIEQ-CMKODMSKSA-N 0 3 415.534 4.397 20 0 HIADHN CC(=O)N(Cc1ccc(NC(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)cc1)C(C)C ZINC000554476410 942156281 /nfs/dbraw/zinc/15/62/81/942156281.db2.gz VXIKEMKCECRLNT-FDDCHVKYSA-N 0 3 410.562 4.256 20 0 HIADHN COc1cccc(COc2cccc(NC(=O)N[C@H](C)C3=CCN(C)CC3)c2C)c1 ZINC000554619784 942176708 /nfs/dbraw/zinc/17/67/08/942176708.db2.gz IPDZPSMZWGRZCM-GOSISDBHSA-N 0 3 409.530 4.355 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)c1ccccc1OCc1c(C)noc1C)c1ccco1 ZINC000554633090 942180577 /nfs/dbraw/zinc/18/05/77/942180577.db2.gz SNLOHPZUNHBZOZ-MGPUTAFESA-N 0 3 411.502 4.323 20 0 HIADHN C[C@H](NCC(=O)NCC1(c2ccccc2)CCOCC1)c1ccc(F)c2ccccc21 ZINC000554743612 942218672 /nfs/dbraw/zinc/21/86/72/942218672.db2.gz ODWSCTVWDMTHDI-IBGZPJMESA-N 0 3 420.528 4.494 20 0 HIADHN Cc1nc(-c2ccc(C)cc2NC(=O)CN(C)[C@H]2CC[C@@H](C(F)(F)F)CC2)n[nH]1 ZINC000554749212 942219702 /nfs/dbraw/zinc/21/97/02/942219702.db2.gz JGJIFSUGTHOYFD-GASCZTMLSA-N 0 3 409.456 4.080 20 0 HIADHN Cc1cc(NC(=O)N[C@H](C)CN(C)Cc2ccccc2)ccc1OC1CCOCC1 ZINC000554756718 942223541 /nfs/dbraw/zinc/22/35/41/942223541.db2.gz DXUKAZYBCCLLKO-LJQANCHMSA-N 0 3 411.546 4.195 20 0 HIADHN Cc1cccn(Cc2c(F)cccc2NC2CCN(CCC(F)(F)F)CC2)c1=O ZINC000554887847 942309493 /nfs/dbraw/zinc/30/94/93/942309493.db2.gz FCLRQHIHJSDNIT-UHFFFAOYSA-N 0 3 411.443 4.173 20 0 HIADHN CCN(Cc1nc(-c2ccc(OC(F)F)c(OC)c2)no1)[C@H]1CCOC(C)(C)C1 ZINC000554951936 942330614 /nfs/dbraw/zinc/33/06/14/942330614.db2.gz DWSAALPUCKSWKR-AWEZNQCLSA-N 0 3 411.449 4.126 20 0 HIADHN CC(C)(CNC(=O)Nc1ccc(OC(F)F)cc1F)N1CCc2ccccc2C1 ZINC000554968837 942337702 /nfs/dbraw/zinc/33/77/02/942337702.db2.gz VPLGBDSRKFWHQC-UHFFFAOYSA-N 0 3 407.436 4.386 20 0 HIADHN CCn1c(-c2sc(-c3ccccc3)nc2C)nnc1N1CCN(C2CCCC2)CC1 ZINC000555017917 942358404 /nfs/dbraw/zinc/35/84/04/942358404.db2.gz FFMIIYVSJOHFNH-UHFFFAOYSA-N 0 3 422.602 4.462 20 0 HIADHN O=C(NC[C@H]1CN(Cc2ccccc2)CCCO1)c1cscc1-c1ccccc1 ZINC000555093470 942383576 /nfs/dbraw/zinc/38/35/76/942383576.db2.gz DAQAMAHWRSRWAC-NRFANRHFSA-N 0 3 406.551 4.436 20 0 HIADHN CCc1ccccc1NC(=O)CN[C@@H]1CCN(CC)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000555124917 942391868 /nfs/dbraw/zinc/39/18/68/942391868.db2.gz CQWPZKQFYCVMMJ-KNQAVFIVSA-N 0 3 405.464 4.030 20 0 HIADHN CC[C@@H]1CCCCN1C(=O)[C@H](C)N[C@@H]1CCN(CC)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000555125944 942392788 /nfs/dbraw/zinc/39/27/88/942392788.db2.gz SCBKMVDVROMGJQ-SSOMFZRPSA-N 0 3 411.512 4.008 20 0 HIADHN CCc1ccc(NC(=O)CN[C@H]2CCN(CC)[C@@H]2c2cc(F)c(F)c(F)c2)cc1 ZINC000555132216 942396296 /nfs/dbraw/zinc/39/62/96/942396296.db2.gz TWTLSMYQXLTBGB-SIKLNZKXSA-N 0 3 405.464 4.030 20 0 HIADHN CCc1cccc(NC(=O)CN[C@H]2CCN(CC)[C@H]2c2cc(F)c(F)c(F)c2)c1 ZINC000555132180 942396546 /nfs/dbraw/zinc/39/65/46/942396546.db2.gz IDCNMEQYDYZXJY-UGKGYDQZSA-N 0 3 405.464 4.030 20 0 HIADHN CCN1CC[C@H](N[C@@H](C)C(=O)Nc2c(C)cccc2C)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000555133011 942397448 /nfs/dbraw/zinc/39/74/48/942397448.db2.gz YAPZXXHDDJXXED-OHEPNIRZSA-N 0 3 419.491 4.473 20 0 HIADHN CCOc1ccc(NC(=O)CN[C@@H]2CCN(C(C)C)[C@@H]2c2ccc(F)c(F)c2)cc1 ZINC000555133279 942397540 /nfs/dbraw/zinc/39/75/40/942397540.db2.gz QWVVZFOIHDFGJF-FYYLOGMGSA-N 0 3 417.500 4.116 20 0 HIADHN CCN1CC[C@H](N[C@H](C)C(=O)Nc2c(C)cccc2C)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000555133009 942397710 /nfs/dbraw/zinc/39/77/10/942397710.db2.gz YAPZXXHDDJXXED-MPHOGZCYSA-N 0 3 419.491 4.473 20 0 HIADHN CN(C)C[C@@H](NC(=O)NC[C@@H](c1ccccc1)C(C)(C)CO)c1ccc(Cl)cc1 ZINC000555179812 942419542 /nfs/dbraw/zinc/41/95/42/942419542.db2.gz GYAVRZBOIOVAJX-LEWJYISDSA-N 0 3 417.981 4.044 20 0 HIADHN C[C@H](NC(=O)N[C@@H](CN(C)C)c1ccc(Cl)cc1)c1nc(C(F)(F)F)cs1 ZINC000555206530 942431488 /nfs/dbraw/zinc/43/14/88/942431488.db2.gz ISSGMICMRKMOAX-GWCFXTLKSA-N 0 3 420.888 4.478 20 0 HIADHN Cc1ccc(Br)cc1-c1nnc(N2CC[C@]3(C2)CCCN(C)C3)s1 ZINC000555206860 942431608 /nfs/dbraw/zinc/43/16/08/942431608.db2.gz XSWSLDCLLHFKTL-GOSISDBHSA-N 0 3 407.381 4.198 20 0 HIADHN Cc1c(C(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)cnn1-c1ccc(F)cc1F ZINC000555230402 942437973 /nfs/dbraw/zinc/43/79/73/942437973.db2.gz MTHLDFIWONTFEX-IBGZPJMESA-N 0 3 418.875 4.145 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@@H](N[C@H]2CCN(c3ccccc3Cl)C2=O)c2ccccc21 ZINC000555232847 942438940 /nfs/dbraw/zinc/43/89/40/942438940.db2.gz NOFPDWGSGOHJRW-RLLQIKCJSA-N 0 3 412.917 4.217 20 0 HIADHN CCN(CC)[C@H](CNC(=O)C1CCC(OC[C@H]2CCCO2)CC1)c1ccsc1 ZINC000555297970 942465889 /nfs/dbraw/zinc/46/58/89/942465889.db2.gz CBBWHZQSMUWHRA-CGNZLSCGSA-N 0 3 408.608 4.002 20 0 HIADHN CC[C@H](N[C@H](C)c1ccc(Br)cn1)[C@H](c1ccc(C)cc1)n1cncn1 ZINC000555378188 942503393 /nfs/dbraw/zinc/50/33/93/942503393.db2.gz VEFJHMLWDAGWBX-BPAFIMBUSA-N 0 3 414.351 4.463 20 0 HIADHN CC[C@H](C)c1nnc(N2CCN(Cc3ccccc3)[C@H](CC)C2)n1C[C@@H]1CCCO1 ZINC000555400935 942516559 /nfs/dbraw/zinc/51/65/59/942516559.db2.gz TZIVJQYJBRZZBO-NNWRFLSQSA-N 0 3 411.594 4.071 20 0 HIADHN c1coc(COCc2cccc(CN[C@H]3CCCc4c3cnn4-c3ncccn3)c2)c1 ZINC000555595451 942660060 /nfs/dbraw/zinc/66/00/60/942660060.db2.gz JVQKZIFBDTWYCZ-QFIPXVFZSA-N 0 3 415.497 4.139 20 0 HIADHN O=S(=O)(CCCNCc1ccc(OCC(F)(F)F)cc1)c1ccc(Cl)cc1 ZINC000555643635 942685972 /nfs/dbraw/zinc/68/59/72/942685972.db2.gz XMNPSAOBYYMISJ-UHFFFAOYSA-N 0 3 421.868 4.235 20 0 HIADHN CCO[C@@H]1C[C@@H](NCc2cc(Br)cc(C(F)(F)F)c2)[C@H]1n1cccn1 ZINC000555648455 942688115 /nfs/dbraw/zinc/68/81/15/942688115.db2.gz NDXNJDPOYRFWOI-BZUAXINKSA-N 0 3 418.257 4.173 20 0 HIADHN COc1ccccc1NC(=O)c1ccc(NC(=O)[C@H](C)N2CC[C@H](CC3CC3)C2)cc1 ZINC000555704399 942705440 /nfs/dbraw/zinc/70/54/40/942705440.db2.gz BAEFPHIMDKNARK-PKOBYXMFSA-N 0 3 421.541 4.397 20 0 HIADHN COc1cnccc1[C@H](C)NC[C@@H](O)CO[C@H](c1ccccc1)c1ccc(C)cc1 ZINC000556018221 942786399 /nfs/dbraw/zinc/78/63/99/942786399.db2.gz REURDCIUXJXZIF-UWUFEASWSA-N 0 3 406.526 4.216 20 0 HIADHN O=C(Nc1ccccc1)N1CC[C@@H](N[C@H]2CCc3sc(Br)cc32)C1 ZINC000556177627 942814805 /nfs/dbraw/zinc/81/48/05/942814805.db2.gz FHJUVZRPJYZZOO-HIFRSBDPSA-N 0 3 406.349 4.394 20 0 HIADHN CCS(=O)(=O)Nc1ccc([C@H](C)N[C@H](C)c2ccc(-n3cccn3)c(F)c2)cc1 ZINC000556223244 942820641 /nfs/dbraw/zinc/82/06/41/942820641.db2.gz WTNARBFUIGPODN-JKSUJKDBSA-N 0 3 416.522 4.185 20 0 HIADHN CCCn1c(=O)c2ccccc2nc1SC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000556295147 942835161 /nfs/dbraw/zinc/83/51/61/942835161.db2.gz FJCOHEOALIHIHN-HXUWFJFHSA-N 0 3 423.582 4.190 20 0 HIADHN CN(C(=O)c1ccc(NCc2ccc(F)c3cccnc23)cc1)[C@@H]1CCCN(C)C1 ZINC000556336790 942844116 /nfs/dbraw/zinc/84/41/16/942844116.db2.gz DWCSCHADHRTVOM-HXUWFJFHSA-N 0 3 406.505 4.152 20 0 HIADHN CN(C(=O)c1ccc(NCc2ccc(OCC3CC3)cc2)cc1)[C@H]1CCCN(C)C1 ZINC000556337505 942844821 /nfs/dbraw/zinc/84/48/21/942844821.db2.gz RYCRRDAHDAGQAK-QHCPKHFHSA-N 0 3 407.558 4.254 20 0 HIADHN CC(C)C(=O)Nc1ccc(CNCc2cccc(I)c2)cc1 ZINC000556403786 942857556 /nfs/dbraw/zinc/85/75/56/942857556.db2.gz FPZOBCXZOKXQJG-UHFFFAOYSA-N 0 3 408.283 4.176 20 0 HIADHN COc1ccccc1NC(=O)CN[C@@H](c1cccc(C(F)(F)F)c1)C1CCOCC1 ZINC000556515150 942889835 /nfs/dbraw/zinc/88/98/35/942889835.db2.gz LSBVMRUSHLOMDF-OAQYLSRUSA-N 0 3 422.447 4.410 20 0 HIADHN O=C(CCN1CCC(F)(c2cccnc2)CC1)Nc1ccccc1Br ZINC000556531452 942892963 /nfs/dbraw/zinc/89/29/63/942892963.db2.gz XZYKFHKFZOYUDS-UHFFFAOYSA-N 0 3 406.299 4.134 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@H](C)N[C@H](C)c2cnc(OC)c(Cl)c2)CC1 ZINC000556582632 942905853 /nfs/dbraw/zinc/90/58/53/942905853.db2.gz CDAVZKPUMBMOSM-CVEARBPZSA-N 0 3 420.960 4.436 20 0 HIADHN Cc1ccc2c(c1)[C@@H](NCc1cccc(N3C(=O)N[C@@](C)(C4CC4)C3=O)c1)CCC2 ZINC000556609880 942913919 /nfs/dbraw/zinc/91/39/19/942913919.db2.gz BUCLPTNYQCIKQQ-DHLKQENFSA-N 0 3 403.526 4.387 20 0 HIADHN COc1ccc(Br)c2[nH]c(C(=O)Nc3ccccc3CN(C)C)cc21 ZINC000556665167 942928726 /nfs/dbraw/zinc/92/87/26/942928726.db2.gz QQODLZYMGKTSSW-UHFFFAOYSA-N 0 3 402.292 4.253 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)c1cnn(-c2ccc(C(F)(F)F)cc2)c1 ZINC000556782081 942932009 /nfs/dbraw/zinc/93/20/09/942932009.db2.gz UGCOMZHZRXJSDF-UHFFFAOYSA-N 0 3 418.419 4.214 20 0 HIADHN CCCc1c(C(=O)N(C)C[C@@H]2CCN(Cc3ccc(C)s3)C2)[nH]c(C)c1C(C)=O ZINC000556828332 942937539 /nfs/dbraw/zinc/93/75/39/942937539.db2.gz LEDRKOSZFSXSEL-SFHVURJKSA-N 0 3 415.603 4.442 20 0 HIADHN O=C(c1ccccc1NCc1ccco1)N1CCN(c2ccnc3ccccc32)CC1 ZINC000556833444 942937857 /nfs/dbraw/zinc/93/78/57/942937857.db2.gz MRQHRUAZZYIHHG-UHFFFAOYSA-N 0 3 412.493 4.402 20 0 HIADHN Cc1c(C(=O)NC[C@@H](CN(C)C)c2ccc(Cl)cc2)[nH]c2c1C(=O)CC(C)(C)C2 ZINC000556851902 942939992 /nfs/dbraw/zinc/93/99/92/942939992.db2.gz SHQRPYBMMGPWNC-INIZCTEOSA-N 0 3 415.965 4.207 20 0 HIADHN CS(=O)(=O)Cc1ccc(CN[C@H](c2cccc(OC(F)(F)F)c2)C2CC2)cc1 ZINC000556859224 942942127 /nfs/dbraw/zinc/94/21/27/942942127.db2.gz ZFGLWIUHLIBIHE-IBGZPJMESA-N 0 3 413.461 4.371 20 0 HIADHN C[C@@H](NCc1cn(-c2ccccc2)nc1-c1ccncc1)c1ccccc1-n1ccnn1 ZINC000556873121 942946706 /nfs/dbraw/zinc/94/67/06/942946706.db2.gz UIVQIDXXVSQSRM-LJQANCHMSA-N 0 3 421.508 4.366 20 0 HIADHN C[C@H](NCc1cn(-c2ccccc2)nc1-c1ccncc1)c1ccccc1-n1ccnn1 ZINC000556873112 942947054 /nfs/dbraw/zinc/94/70/54/942947054.db2.gz UIVQIDXXVSQSRM-IBGZPJMESA-N 0 3 421.508 4.366 20 0 HIADHN OC[C@@H](CN[C@@H](c1ncc[nH]1)C1CCCCC1)Cc1ccccc1Br ZINC000556880100 942949022 /nfs/dbraw/zinc/94/90/22/942949022.db2.gz JFIIRURULOBPLG-DNVCBOLYSA-N 0 3 406.368 4.234 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)[C@H](C)Cc2cnc3ccccc3n2)N(C)C)cc1 ZINC000556989402 942988782 /nfs/dbraw/zinc/98/87/82/942988782.db2.gz CRBAYRKIYFIARZ-KOSHJBKYSA-N 0 3 420.557 4.015 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@@H](O)C2)c1)c1ccccc1OCc1ccc(F)cc1 ZINC000557022161 942996525 /nfs/dbraw/zinc/99/65/25/942996525.db2.gz DSOWDBLHPMPSIC-JOCHJYFZSA-N 0 3 420.484 4.224 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)c1csc(-c2ccc(Cl)s2)n1 ZINC000557024158 942997517 /nfs/dbraw/zinc/99/75/17/942997517.db2.gz WSBXMGDZFFQOGA-AWEZNQCLSA-N 0 3 419.959 4.344 20 0 HIADHN CN(CCC(F)(F)F)[C@@H](CNC(=O)[C@H]1CCCN1C1CC1)c1ccc(Cl)cc1 ZINC000557088149 943017542 /nfs/dbraw/zinc/01/75/42/943017542.db2.gz CVHAMXYYCWRCIV-MSOLQXFVSA-N 0 3 417.903 4.008 20 0 HIADHN C[C@@H](CC(=O)N1CC[C@@]2(CCN(Cc3ccccc3)C2)C1)C(=O)c1cccc(F)c1 ZINC000557127530 943026638 /nfs/dbraw/zinc/02/66/38/943026638.db2.gz PUZYWKZUJAEYPM-UQBPGWFLSA-N 0 3 408.517 4.159 20 0 HIADHN C[C@@H](NCc1nnc(-c2ccc(Br)cc2)[nH]1)c1ccc(-n2cccn2)cc1 ZINC000557278032 943065249 /nfs/dbraw/zinc/06/52/49/943065249.db2.gz RKEIFAQSOHIHEK-CQSZACIVSA-N 0 3 423.318 4.271 20 0 HIADHN C[C@@H]([NH2+]Cc1nnc(-c2ccc(Br)cc2)[n-]1)c1ccc(-n2cccn2)cc1 ZINC000557278032 943065257 /nfs/dbraw/zinc/06/52/57/943065257.db2.gz RKEIFAQSOHIHEK-CQSZACIVSA-N 0 3 423.318 4.271 20 0 HIADHN COCCC[C@@H](CNC(=O)CC1(N2CCOCC2)CCCC1)c1ccc(Cl)cc1 ZINC000557341064 943078247 /nfs/dbraw/zinc/07/82/47/943078247.db2.gz AWXASYOPEYSKCS-FQEVSTJZSA-N 0 3 422.997 4.002 20 0 HIADHN O=C(Cc1ccccc1F)N(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000557431565 943122734 /nfs/dbraw/zinc/12/27/34/943122734.db2.gz SWHJGINPEOTREP-DEOSSOPVSA-N 0 3 417.528 4.457 20 0 HIADHN CN(C)C[C@H](NC(=O)c1cnc(-c2ccc(F)c(F)c2)s1)c1ccc(F)cc1 ZINC000557487249 943163408 /nfs/dbraw/zinc/16/34/08/943163408.db2.gz UEQOSPDQIVVMJI-KRWDZBQOSA-N 0 3 405.445 4.260 20 0 HIADHN CCCCO[C@H]1C[C@H](NCC(=O)Nc2c(F)cc(F)cc2Br)C1(C)C ZINC000557520484 943188315 /nfs/dbraw/zinc/18/83/15/943188315.db2.gz HVQMGTGIZSVROQ-GJZGRUSLSA-N 0 3 419.310 4.239 20 0 HIADHN Nc1nccc([C@@H]2CCCN(Cc3ccc(-c4cccc(Br)c4)o3)C2)n1 ZINC000557522344 943189864 /nfs/dbraw/zinc/18/98/64/943189864.db2.gz KIEVSSVMLJQWQT-OAHLLOKOSA-N 0 3 413.319 4.461 20 0 HIADHN O=C(C[C@H](c1ncc[nH]1)c1ccccc1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000557584367 943220528 /nfs/dbraw/zinc/22/05/28/943220528.db2.gz JFSOFLOHXCXUGR-QFIPXVFZSA-N 0 3 420.582 4.162 20 0 HIADHN COc1ccc(CCCCC(=O)N2CCC[C@H](c3n[nH]cc3CN3CCCC3)C2)cc1 ZINC000557647037 943246813 /nfs/dbraw/zinc/24/68/13/943246813.db2.gz NAFJDZZRTZNJJH-NRFANRHFSA-N 0 3 424.589 4.133 20 0 HIADHN Clc1ccc2nc(CN[C@@H]3CCN(c4cccc(Br)c4)C3)cn2c1 ZINC000557678958 943256562 /nfs/dbraw/zinc/25/65/62/943256562.db2.gz AZNLMHXNHHCTDI-OAHLLOKOSA-N 0 3 405.727 4.119 20 0 HIADHN C[C@H](NC(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1)c1ccc2n[nH]cc2c1 ZINC000557720189 943269343 /nfs/dbraw/zinc/26/93/43/943269343.db2.gz ODMFXASQXIVHSE-YCRPNKLZSA-N 0 3 416.447 4.195 20 0 HIADHN CN(CCCN(C)C(=O)c1cccc2nc(-c3cccs3)[nH]c21)Cc1ccco1 ZINC000557775666 943287963 /nfs/dbraw/zinc/28/79/63/943287963.db2.gz ZXPFZFHXTVFMCW-UHFFFAOYSA-N 0 3 408.527 4.479 20 0 HIADHN CCN(CC)c1ncc(CNC(C)(C)COc2ncccc2Br)s1 ZINC000557844850 943310797 /nfs/dbraw/zinc/31/07/97/943310797.db2.gz UBCIQGRYWWAJJC-UHFFFAOYSA-N 0 3 413.385 4.094 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)c1cc2c(cccc2Br)[nH]1)c1ccco1 ZINC000557911035 943326907 /nfs/dbraw/zinc/32/69/07/943326907.db2.gz ZKXZTBMVPYWMIU-YVEFUNNKSA-N 0 3 404.308 4.383 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3cc(C(F)(F)F)ccc3F)CC2)C[C@H](C)O1 ZINC000557914493 943328512 /nfs/dbraw/zinc/32/85/12/943328512.db2.gz OYUWHOCMFGSPRP-OKILXGFUSA-N 0 3 417.447 4.198 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)Cc2csc(C(C)(C)C)n2)N(C)C)cc1 ZINC000557934635 943333298 /nfs/dbraw/zinc/33/32/98/943333298.db2.gz GVNHEYYHVMFPMV-IBGZPJMESA-N 0 3 403.592 4.189 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)c2cnc(-c3ccccn3)s2)N(C)C)cc1 ZINC000557936979 943333920 /nfs/dbraw/zinc/33/39/20/943333920.db2.gz TTWHVEFPVCBSIX-LJQANCHMSA-N 0 3 410.543 4.025 20 0 HIADHN C[C@@H]1C[C@H]1N1CCN(C(=O)c2cc(Cl)cc(F)c2Br)C[C@@H](C)C1 ZINC000558027620 943360632 /nfs/dbraw/zinc/36/06/32/943360632.db2.gz QZHNGBNQHYNTFD-FIXISWKDSA-N 0 3 403.723 4.044 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)N(C)Cc1nccn1C(F)F)c1ccc(Cl)cc1 ZINC000558110209 943382781 /nfs/dbraw/zinc/38/27/81/943382781.db2.gz ZSNPOQVLCGKQQP-INIZCTEOSA-N 0 3 413.900 4.156 20 0 HIADHN Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)N[C@H](Cc1ccc(F)cc1)C(N)=O ZINC000558122684 943386336 /nfs/dbraw/zinc/38/63/36/943386336.db2.gz QTDUVBQWAGYZBD-KZULUSFZSA-N 0 3 401.482 4.144 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)Nc2cc3c(cc2Cl)OCO3)N(C)C)cc1 ZINC000558246945 943456810 /nfs/dbraw/zinc/45/68/10/943456810.db2.gz POURFWRLENIAAE-SFHVURJKSA-N 0 3 419.909 4.280 20 0 HIADHN C[C@H](CC(=O)Nc1ccc(NC(=O)C2CC2)cc1)N[C@@H]1c2ccc(F)cc2O[C@@H]1C ZINC000558256070 943463047 /nfs/dbraw/zinc/46/30/47/943463047.db2.gz HGNFNSWWJGTDGQ-SOHPYSCWSA-N 0 3 411.477 4.003 20 0 HIADHN C[C@H](N[C@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O)c1cccc(-n2ccnn2)c1 ZINC000558260067 943464109 /nfs/dbraw/zinc/46/41/09/943464109.db2.gz XEMOOASYUANYKI-DJJJIMSYSA-N 0 3 416.312 4.030 20 0 HIADHN COCC(C)(C)CCCN[C@@H](C)c1nnn(-c2cccc(Br)c2)c1C ZINC000558259730 943464154 /nfs/dbraw/zinc/46/41/54/943464154.db2.gz WYEFDCRVXDLCIJ-AWEZNQCLSA-N 0 3 409.372 4.442 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1cc(N2CCCC2=O)ccc1Cl)c1ccco1 ZINC000558268754 943469451 /nfs/dbraw/zinc/46/94/51/943469451.db2.gz UDLSQTWNJHIAFF-KBXCAEBGSA-N 0 3 418.925 4.311 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)Nc1ccc(S(=O)(=O)C2CCCC2)cc1 ZINC000558276911 943477839 /nfs/dbraw/zinc/47/78/39/943477839.db2.gz HCFTUMOAVJPLKA-UHFFFAOYSA-N 0 3 421.607 4.133 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)Nc1ccc(C(=O)N[C@@H](C)CC)cc1C)c1ccco1 ZINC000558309771 943497624 /nfs/dbraw/zinc/49/76/24/943497624.db2.gz NLOPCQTXHXMKKK-UWVAXJGDSA-N 0 3 414.550 4.367 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)NC[C@H](N[C@@H](C)CC)c2ccco2)c(C)c1 ZINC000558309772 943497708 /nfs/dbraw/zinc/49/77/08/943497708.db2.gz NLOPCQTXHXMKKK-ZWOKBUDYSA-N 0 3 414.550 4.367 20 0 HIADHN C[C@@H](CCOCc1ccccc1)NC(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000558348581 943520514 /nfs/dbraw/zinc/52/05/14/943520514.db2.gz PAGJBDYXAZJLAZ-ICSRJNTNSA-N 0 3 401.576 4.180 20 0 HIADHN O=C(CCCN1CCC(CC(=O)N2CCCC2)CC1)c1ccc(Br)cc1 ZINC000558401532 943549808 /nfs/dbraw/zinc/54/98/08/943549808.db2.gz QUZFHFPZQSUNSX-UHFFFAOYSA-N 0 3 421.379 4.137 20 0 HIADHN COc1ccc([C@H](Cc2ccccc2)NCC(=O)N2CCC[C@@H](C(F)(F)F)C2)cc1 ZINC000558487496 943572819 /nfs/dbraw/zinc/57/28/19/943572819.db2.gz BFYZIPLPYYEYMF-CTNGQTDRSA-N 0 3 420.475 4.370 20 0 HIADHN COC(C)(C)c1nc(C)c(C(=O)Nc2ccc(CCN3CCSCC3)cc2)s1 ZINC000558508376 943579858 /nfs/dbraw/zinc/57/98/58/943579858.db2.gz NZFIRQUGXWNEGI-UHFFFAOYSA-N 0 3 419.616 4.177 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N(C)C[C@@H]2OCCc3ccccc32)N2CCCC2)cc1 ZINC000558826128 943681395 /nfs/dbraw/zinc/68/13/95/943681395.db2.gz SCBGIGKWKJWKCA-RPWUZVMVSA-N 0 3 407.558 4.087 20 0 HIADHN CC(C)N1CC[C@H](NCc2cc(-c3cnn(C)c3)no2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000558826854 943681586 /nfs/dbraw/zinc/68/15/86/943681586.db2.gz MQHSOVCXBWGARU-PZJWPPBQSA-N 0 3 417.916 4.181 20 0 HIADHN Cn1nccc1C1C[C@H]2CC[C@@H](C1)N2CC(=O)N(Cc1cccc(F)c1)C(C)(C)C ZINC000558863779 943707469 /nfs/dbraw/zinc/70/74/69/943707469.db2.gz FVBICPCSVTVXIH-VCSGRIEYSA-N 0 3 412.553 4.097 20 0 HIADHN C[C@@H](NC(=O)N[C@H](CN(C)C)c1ccc(Cl)cc1)c1ccc(-n2cccn2)cc1 ZINC000558887815 943720666 /nfs/dbraw/zinc/72/06/66/943720666.db2.gz JVGJLLGRYHYYMO-IIBYNOLFSA-N 0 3 411.937 4.189 20 0 HIADHN CCN1CC[C@@H](NCC(=O)Nc2cc(C(C)(C)C)no2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000558895633 943729545 /nfs/dbraw/zinc/72/95/45/943729545.db2.gz KIYCIANMSJFIEF-UZLBHIALSA-N 0 3 422.932 4.128 20 0 HIADHN CN(C)C[C@H](NC(=O)N[C@@H](c1nccs1)c1ccccc1)c1ccc(Cl)cc1 ZINC000558895274 943729634 /nfs/dbraw/zinc/72/96/34/943729634.db2.gz MTFLZGKICMCJCC-RBUKOAKNSA-N 0 3 414.962 4.488 20 0 HIADHN CCN1CC[C@@H](NCc2nc3ccccc3nc2C)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000558895819 943729906 /nfs/dbraw/zinc/72/99/06/943729906.db2.gz PHZNMOXCWCPBDE-DENIHFKCSA-N 0 3 400.448 4.281 20 0 HIADHN CCN1CC[C@H](N[C@@H](C)C(=O)Nc2ccnn2C(C)C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000558896590 943731157 /nfs/dbraw/zinc/73/11/57/943731157.db2.gz QFTIZAKYOHJBFK-ADLFWFRXSA-N 0 3 421.948 4.009 20 0 HIADHN CCN1CC[C@H](N[C@H](C)C(=O)Nc2ccnn2C(C)C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000558896594 943731383 /nfs/dbraw/zinc/73/13/83/943731383.db2.gz QFTIZAKYOHJBFK-WNYOCNMUSA-N 0 3 421.948 4.009 20 0 HIADHN C[C@H](NC(=O)N[C@H](CN(C)C)c1ccc(Cl)cc1)c1noc(-c2ccccc2)n1 ZINC000558910516 943742440 /nfs/dbraw/zinc/74/24/40/943742440.db2.gz NIJCKJTYUQFKAP-KBXCAEBGSA-N 0 3 413.909 4.053 20 0 HIADHN CCN(CC)[C@H](CNC(=O)[C@H](C)Cc1cnc2ccccc2n1)c1cccc(OC)c1 ZINC000558932140 943754558 /nfs/dbraw/zinc/75/45/58/943754558.db2.gz SYGWNENFTIEGAZ-HOYKHHGWSA-N 0 3 420.557 4.016 20 0 HIADHN COC1(CCN2CCN(CCOC(c3ccccc3)c3ccccc3)CC2)CCC1 ZINC000559107711 943841972 /nfs/dbraw/zinc/84/19/72/943841972.db2.gz RULVTASPGVWSHY-UHFFFAOYSA-N 0 3 408.586 4.369 20 0 HIADHN C[C@H](N[C@@H]1CCN([C@@H](C)c2ccc(F)cc2)C1=O)c1ccc(NC(=O)NC2CC2)cc1 ZINC000559148530 943853972 /nfs/dbraw/zinc/85/39/72/943853972.db2.gz ZYJHIMPMKBFJTI-PONJGIIJSA-N 0 3 424.520 4.122 20 0 HIADHN COc1cccc(CN(C(=O)Nc2cccc(CN(C)C)c2)C2CCC(O)CC2)c1 ZINC000559170966 943860356 /nfs/dbraw/zinc/86/03/56/943860356.db2.gz RYSNDUNMMSCJMZ-UHFFFAOYSA-N 0 3 411.546 4.094 20 0 HIADHN O=C(NCCN1CCCC1)c1ccc(NCc2csc(-c3cccs3)n2)cc1 ZINC000559224681 943878598 /nfs/dbraw/zinc/87/85/98/943878598.db2.gz BJZYYOHHPGGVIG-UHFFFAOYSA-N 0 3 412.584 4.309 20 0 HIADHN O=C(NCCN1CCCC1)c1ccc(NCc2cccc(OCC(F)(F)F)c2)cc1 ZINC000559228915 943880850 /nfs/dbraw/zinc/88/08/50/943880850.db2.gz HPQSBJUICZGWAO-UHFFFAOYSA-N 0 3 421.463 4.065 20 0 HIADHN CC(C)(C)c1nn(Cc2ccccc2)cc1CNCc1cccc(N2CCOCC2)c1 ZINC000559307392 943893845 /nfs/dbraw/zinc/89/38/45/943893845.db2.gz RVPSNWUEVZUYOJ-UHFFFAOYSA-N 0 3 418.585 4.355 20 0 HIADHN C[C@H](c1ccccc1F)N1CCC[C@@H](NCc2ccc(OCC(F)F)cc2)C1=O ZINC000559323623 943896662 /nfs/dbraw/zinc/89/66/62/943896662.db2.gz ZDBFTRSNYXZXGK-FOIQADDNSA-N 0 3 406.448 4.311 20 0 HIADHN Cc1ccc(Br)c(C)c1C(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000559449284 943957615 /nfs/dbraw/zinc/95/76/15/943957615.db2.gz QGMHMKZPLHKBGG-HZPDHXFCSA-N 0 3 423.395 4.027 20 0 HIADHN COc1cc(C(=O)Nc2ccc(C)cc2CN(C)C)cc(Br)c1OC ZINC000559581478 944012147 /nfs/dbraw/zinc/01/21/47/944012147.db2.gz OEGKZKAQSXEXGJ-UHFFFAOYSA-N 0 3 407.308 4.089 20 0 HIADHN NS(=O)(=O)c1ccc2c(c1)CCC[C@H]2N[C@@H]1CC2(CCCC2)Oc2ccccc21 ZINC000559785122 944049791 /nfs/dbraw/zinc/04/97/91/944049791.db2.gz MEIXMVBDKWFBER-NHCUHLMSSA-N 0 3 412.555 4.138 20 0 HIADHN NS(=O)(=O)c1ccc2c(c1)CCC[C@H]2N[C@H](COc1ccccc1)c1ccccc1 ZINC000559788373 944051621 /nfs/dbraw/zinc/05/16/21/944051621.db2.gz GIRJMTFZYFJRKM-DNQXCXABSA-N 0 3 422.550 4.121 20 0 HIADHN C[C@H](c1ccccc1F)N1CCC[C@@H](N[C@@H](C)c2ccc(-n3ccnc3)cc2)C1=O ZINC000559878525 944072755 /nfs/dbraw/zinc/07/27/55/944072755.db2.gz PIGUNDXDZYGYJF-YZZKKUAISA-N 0 3 406.505 4.414 20 0 HIADHN C[C@@H](N[C@@H](C)c1cccc(S(=O)(=O)NC2CCCCCC2)c1)c1cc[nH]c(=O)c1 ZINC000559878803 944073196 /nfs/dbraw/zinc/07/31/96/944073196.db2.gz RDONPPWCXOJVBJ-DLBZAZTESA-N 0 3 417.575 4.200 20 0 HIADHN C[C@H](N[C@@H]1CCCN([C@@H](C)c2ccc(F)cc2)C1=O)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000559897863 944078663 /nfs/dbraw/zinc/07/86/63/944078663.db2.gz SNASPPGDZPWJPX-PONJGIIJSA-N 0 3 423.532 4.458 20 0 HIADHN CN1CC[C@H](CN[C@H](c2cn[nH]n2)c2ccc(F)cc2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000559920751 944085987 /nfs/dbraw/zinc/08/59/87/944085987.db2.gz HQQXNWTYXMLORF-NQERJWCQSA-N 0 3 417.891 4.108 20 0 HIADHN O=C(NC[C@H]1CCCN1Cc1ccccc1)Nc1ccc(Oc2cccnc2)nc1 ZINC000559965650 944102779 /nfs/dbraw/zinc/10/27/79/944102779.db2.gz KWVMSCUXPGGXQS-HXUWFJFHSA-N 0 3 403.486 4.055 20 0 HIADHN CN(C(=O)c1ccc(NCc2ccccc2OC(F)(F)F)cc1)[C@@H]1CCCN(C)C1 ZINC000559998163 944121783 /nfs/dbraw/zinc/12/17/83/944121783.db2.gz NQRCYIFOMIIWNE-LJQANCHMSA-N 0 3 421.463 4.364 20 0 HIADHN COc1cccc(Cl)c1CNc1ccc(C(=O)N(C)[C@H]2CCCN(C)C2)cc1 ZINC000559999409 944123057 /nfs/dbraw/zinc/12/30/57/944123057.db2.gz UTOOMZSLTPMVBH-SFHVURJKSA-N 0 3 401.938 4.127 20 0 HIADHN COC(=O)[C@H](Cc1ccccc1)[C@@H](C)N[C@H](C)C(=O)Nc1ccccc1C(F)(F)F ZINC000560177444 944187405 /nfs/dbraw/zinc/18/74/05/944187405.db2.gz ZYZKQPLFIPQEIB-BFYDXBDKSA-N 0 3 422.447 4.042 20 0 HIADHN COC(=O)[C@H](Cc1ccccc1)[C@H](C)N[C@@H](C)C(=O)Nc1ccccc1C(F)(F)F ZINC000560177446 944187452 /nfs/dbraw/zinc/18/74/52/944187452.db2.gz ZYZKQPLFIPQEIB-YQQAZPJKSA-N 0 3 422.447 4.042 20 0 HIADHN C[C@@H]1C[C@@H](C)CN(C(=O)CN[C@@H](c2cccc(C(F)(F)F)c2)C2CCOCC2)C1 ZINC000560179757 944189727 /nfs/dbraw/zinc/18/97/27/944189727.db2.gz UEEPANDIQXASKW-WHSLLNHNSA-N 0 3 412.496 4.267 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)Cc2csc(-c3cccc(C)c3)n2)cc1 ZINC000560245908 944205489 /nfs/dbraw/zinc/20/54/89/944205489.db2.gz LVXFUBYNVPREBS-NRFANRHFSA-N 0 3 409.555 4.089 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)[C@@H](C)c2ccc3cc(OC)ccc3c2)cc1 ZINC000560248426 944206623 /nfs/dbraw/zinc/20/66/23/944206623.db2.gz LUIHBTVNMGMZEC-BXKMTCNYSA-N 0 3 406.526 4.380 20 0 HIADHN C[C@@H](N[C@H](c1cncc(Br)c1)C1CC1)c1ccc(NS(C)(=O)=O)cc1 ZINC000560268043 944213384 /nfs/dbraw/zinc/21/33/84/944213384.db2.gz IMJOPGOGMKEGQP-XIKOKIGWSA-N 0 3 424.364 4.018 20 0 HIADHN CN(C)Cc1ccccc1NC(=O)c1cc(N2CCCC2=O)cc(C(F)(F)F)c1 ZINC000560313612 944225133 /nfs/dbraw/zinc/22/51/33/944225133.db2.gz VXEKIDSXRBEROC-UHFFFAOYSA-N 0 3 405.420 4.146 20 0 HIADHN O=C(c1cnn(-c2cccc(Cl)c2)c1)N1CCN(c2ccnc3ccccc32)CC1 ZINC000560489686 944237810 /nfs/dbraw/zinc/23/78/10/944237810.db2.gz ZETHBCMMSQCFIC-UHFFFAOYSA-N 0 3 417.900 4.036 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc2c(c1)OCC(=O)N2)c1cccc(OCc2ccccn2)c1 ZINC000560522828 944241522 /nfs/dbraw/zinc/24/15/22/944241522.db2.gz KOSSXEMPELUGKO-SJORKVTESA-N 0 3 403.482 4.403 20 0 HIADHN C[C@H](NCc1ccc(-c2ccc3c(c2)CCO3)cc1)c1ccc2c(c1)OCC(=O)N2 ZINC000560530950 944244442 /nfs/dbraw/zinc/24/44/42/944244442.db2.gz VNURSVHIYAVIJK-INIZCTEOSA-N 0 3 400.478 4.470 20 0 HIADHN C[C@@H](NCc1ccc(NC(=O)c2ccc(F)cc2)cc1)c1ccc2c(c1)OCC(=O)N2 ZINC000560531066 944244583 /nfs/dbraw/zinc/24/45/83/944244583.db2.gz YNJXDPMYLQAVAX-OAHLLOKOSA-N 0 3 419.456 4.260 20 0 HIADHN COc1cc(Br)ccc1[C@@H](C)N[C@@H](C)c1ccccc1-n1ccnn1 ZINC000560549356 944250051 /nfs/dbraw/zinc/25/00/51/944250051.db2.gz MDMAPOPEAPAWNY-UONOGXRCSA-N 0 3 401.308 4.450 20 0 HIADHN COc1cccc(C2(N[C@H](C)CC(=O)Nc3ccc(NC(=O)C4CC4)cc3)CC2)c1 ZINC000560573744 944258700 /nfs/dbraw/zinc/25/87/00/944258700.db2.gz JZVBOQFUFSBDEA-MRXNPFEDSA-N 0 3 407.514 4.040 20 0 HIADHN Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)NC[C@@H](N1CCOCC1)C(F)(F)F ZINC000560580759 944262235 /nfs/dbraw/zinc/26/22/35/944262235.db2.gz JRVVMDSEYPNEHK-RHSMWYFYSA-N 0 3 413.509 4.341 20 0 HIADHN Cc1nc(Cc2ccccc2)sc1C(=O)N(C)CCCN(C)Cc1ccncc1 ZINC000560596010 944266408 /nfs/dbraw/zinc/26/64/08/944266408.db2.gz UDAYIEMXDDOBHT-UHFFFAOYSA-N 0 3 408.571 4.031 20 0 HIADHN CN(CCCN(C)C(=O)c1csc(-c2cccc(Cl)c2)n1)Cc1ccncc1 ZINC000560596309 944268252 /nfs/dbraw/zinc/26/82/52/944268252.db2.gz NBHWSBBCPVRNFC-UHFFFAOYSA-N 0 3 414.962 4.453 20 0 HIADHN COc1ccc(-c2[nH]c3ccccc3c2CCC(=O)N2[C@@H]3CC[C@H]2CCN(C)C3)cc1 ZINC000560625850 944278553 /nfs/dbraw/zinc/27/85/53/944278553.db2.gz IHVUKKPBDRFHET-VQTJNVASSA-N 0 3 417.553 4.471 20 0 HIADHN O=C(N[C@@H]1CCO[C@H](c2ccccc2)C1)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000560632498 944281519 /nfs/dbraw/zinc/28/15/19/944281519.db2.gz NRFBQDHNSUCZMX-VSKRKVRLSA-N 0 3 414.496 4.180 20 0 HIADHN CC(C)(C)C1=CCN(CCNC(=O)[C@H]2CCn3c(cnc3C3CCCCC3)C2)CC1 ZINC000560648970 944284737 /nfs/dbraw/zinc/28/47/37/944284737.db2.gz VARXEKXTKXJFSE-FQEVSTJZSA-N 0 3 412.622 4.288 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)c1cccc(C(=O)N(C)CC)c1)c1ccc(Cl)cc1 ZINC000560710316 944303760 /nfs/dbraw/zinc/30/37/60/944303760.db2.gz UQLBGSCUVUBWNG-NRFANRHFSA-N 0 3 415.965 4.245 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)[C@@H]1CC(=O)Nc2cc(F)ccc21)c1ccc(Cl)cc1 ZINC000560710827 944304759 /nfs/dbraw/zinc/30/47/59/944304759.db2.gz WYLJLTAMDUVYSR-QUCCMNQESA-N 0 3 417.912 4.104 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(S(=O)(=O)N(C)C)cc1)c1cccc(OC(F)(F)F)c1 ZINC000560885486 944365020 /nfs/dbraw/zinc/36/50/20/944365020.db2.gz XBMYIXJELGUKCO-UONOGXRCSA-N 0 3 416.465 4.247 20 0 HIADHN O[C@@H](CN[C@H]1CCCOc2ccc(F)cc21)COc1c(Cl)cccc1Cl ZINC000561257262 944530713 /nfs/dbraw/zinc/53/07/13/944530713.db2.gz NLFNQULQNIARMM-GUYCJALGSA-N 0 3 400.277 4.376 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)CCc1nc(-c2ccc(Cl)cc2)no1 ZINC000561264161 944532731 /nfs/dbraw/zinc/53/27/31/944532731.db2.gz MQJLMPOPIHBILZ-UHFFFAOYSA-N 0 3 404.942 4.047 20 0 HIADHN COc1cc(-c2noc([C@@H]3CN(Cc4ccccc4)CCC3(F)F)n2)cc(C)n1 ZINC000561392175 944575572 /nfs/dbraw/zinc/57/55/72/944575572.db2.gz VYVVTRSDIWMALQ-KRWDZBQOSA-N 0 3 400.429 4.073 20 0 HIADHN C[C@@H](N[C@H](c1ccc2c(c1)OCCO2)C1CC1)C(=O)Nc1cc(Cl)ccc1F ZINC000561402650 944581911 /nfs/dbraw/zinc/58/19/11/944581911.db2.gz RSYKWYRKPMGKOI-ODXCJYRJSA-N 0 3 404.869 4.318 20 0 HIADHN CCN(C(=O)CN[C@@H]1c2ccccc2CC12CCOCC2)c1nc2ccccc2s1 ZINC000561405905 944582373 /nfs/dbraw/zinc/58/23/73/944582373.db2.gz NKUXTCJRKYSRRP-JOCHJYFZSA-N 0 3 421.566 4.333 20 0 HIADHN CC(C)Oc1ccc([C@H](C)NCc2ccccc2CS(=O)(=O)N2CCCC2)cc1 ZINC000561492145 944632125 /nfs/dbraw/zinc/63/21/25/944632125.db2.gz FYDTYZYHDCHRHL-IBGZPJMESA-N 0 3 416.587 4.250 20 0 HIADHN CN(C(=O)Nc1cccc(-n2cccc2)c1)C1CCN(CCc2ccccn2)CC1 ZINC000561525382 944654893 /nfs/dbraw/zinc/65/48/93/944654893.db2.gz DASDOERDUNENCZ-UHFFFAOYSA-N 0 3 403.530 4.043 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)c1cc2cc(Br)ccc2[nH]1)c1ccco1 ZINC000561609551 944706461 /nfs/dbraw/zinc/70/64/61/944706461.db2.gz BXBPTIDOKUEVJK-SJKOYZFVSA-N 0 3 404.308 4.383 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)NC[C@@H](C)c1c(C)noc1C)c1ccc(Cl)cc1 ZINC000561633824 944718935 /nfs/dbraw/zinc/71/89/35/944718935.db2.gz SWRAXAFSVVQJFB-KUHUBIRLSA-N 0 3 406.958 4.431 20 0 HIADHN Cc1c(C(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)cnn1-c1ccccc1 ZINC000561658008 944732688 /nfs/dbraw/zinc/73/26/88/944732688.db2.gz SVQFXKMPSPTDCQ-HSZRJFAPSA-N 0 3 406.530 4.001 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)Cc2ccc(OC(F)F)cc2)N(C)C)cc1 ZINC000561658335 944733012 /nfs/dbraw/zinc/73/30/12/944733012.db2.gz VUOHWWAJVRCENC-HXUWFJFHSA-N 0 3 406.473 4.037 20 0 HIADHN Cc1onc(-c2ccc(C(F)(F)F)cc2)c1C(=O)N1CCN([C@@H]2C[C@H]2C)C[C@H](C)C1 ZINC000561762528 944784776 /nfs/dbraw/zinc/78/47/76/944784776.db2.gz URXNMRBYUDCRQS-PMUMKWKESA-N 0 3 421.463 4.471 20 0 HIADHN COc1ccc(CN2CCC(C(=O)N(Cc3ccccc3)C3CC3)CC2)c(C)c1OC ZINC000561949460 944871131 /nfs/dbraw/zinc/87/11/31/944871131.db2.gz WAKQHDDSMHVZJJ-UHFFFAOYSA-N 0 3 422.569 4.415 20 0 HIADHN C[C@H](NC(=O)NC[C@@H](c1ccccc1)N1CCCC1)c1nccn1-c1ccccc1 ZINC000561995829 944889025 /nfs/dbraw/zinc/88/90/25/944889025.db2.gz PQPPKFXXBYTIFL-UGKGYDQZSA-N 0 3 403.530 4.070 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(-c4nc5ccccc5cc4Cl)n3)cn2)CC1 ZINC000562105463 944941549 /nfs/dbraw/zinc/94/15/49/944941549.db2.gz ONYLIQYCTAKVKS-UHFFFAOYSA-N 0 3 420.904 4.142 20 0 HIADHN Cc1cc(NC(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)n(C(C)(C)C)n1 ZINC000562115262 944948869 /nfs/dbraw/zinc/94/88/69/944948869.db2.gz IVYFDGLLNIGZMY-LJQANCHMSA-N 0 3 401.555 4.158 20 0 HIADHN CN(C)C[C@@H](NC(=O)Nc1cccc(NC(=O)c2ccoc2)c1)c1ccc(F)cc1 ZINC000562146166 944974616 /nfs/dbraw/zinc/97/46/16/944974616.db2.gz WYTSZGFSRJFJCO-HXUWFJFHSA-N 0 3 410.449 4.095 20 0 HIADHN O=C(c1cccc(Cn2ccnc2)c1)N1CCC[C@H](c2n[nH]c(C3CCCCC3)n2)C1 ZINC000562175418 945003343 /nfs/dbraw/zinc/00/33/43/945003343.db2.gz ZNGPYWOJRWLFOZ-NRFANRHFSA-N 0 3 418.545 4.117 20 0 HIADHN CN(C)C[C@@H](NC(=O)Nc1cnn(Cc2ccc(Cl)cc2)c1)c1ccc(F)cc1 ZINC000562185361 945008781 /nfs/dbraw/zinc/00/87/81/945008781.db2.gz IEZVXKBAIZLHOE-HXUWFJFHSA-N 0 3 415.900 4.148 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)Nc1cccc(C[S@](=O)C(C)(C)C)c1 ZINC000562218907 945026429 /nfs/dbraw/zinc/02/64/29/945026429.db2.gz XNPRFDRGUPYQLZ-NDEPHWFRSA-N 0 3 407.624 4.464 20 0 HIADHN CC(=O)Nc1ccc(-c2csc(NC(=O)c3ccccc3CN(C)C)n2)c(F)c1 ZINC000562326329 945060448 /nfs/dbraw/zinc/06/04/48/945060448.db2.gz OIKGKLIIPPNNLD-UHFFFAOYSA-N 0 3 412.490 4.222 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)Nc1ccc(OC[C@H]2CCCO2)cc1 ZINC000564118597 945386762 /nfs/dbraw/zinc/38/67/62/945386762.db2.gz ZZVSRKINRMUIMS-JTHBVZDNSA-N 0 3 409.530 4.031 20 0 HIADHN Cc1cc(CN[C@@H]2CCCN(Cc3cccc(C(F)(F)F)c3)C2=O)cc(C)c1O ZINC000564303539 945507156 /nfs/dbraw/zinc/50/71/56/945507156.db2.gz DURBBSVNHIDTQF-LJQANCHMSA-N 0 3 406.448 4.309 20 0 HIADHN Cn1cc(C(F)(F)F)nc1[C@H]1CCCN(Cc2cnn(-c3ccc(F)cc3)c2)C1 ZINC000564303194 945507347 /nfs/dbraw/zinc/50/73/47/945507347.db2.gz GHHIWYALXDVMHS-HNNXBMFYSA-N 0 3 407.415 4.143 20 0 HIADHN CN1CC[C@@H](NCC(=O)N(Cc2ccccc2)C2CC2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000564395054 945552454 /nfs/dbraw/zinc/55/24/54/945552454.db2.gz HJUZCBYORJAWQK-FYYLOGMGSA-N 0 3 415.940 4.005 20 0 HIADHN CCc1ccc([C@H](C)NC(=O)[C@H](C)N[C@H]2c3ccccc3CC23CCOCC3)cc1 ZINC000564407378 945560013 /nfs/dbraw/zinc/56/00/13/945560013.db2.gz CRBVLYGRFBFCEM-JXQFQVJHSA-N 0 3 406.570 4.499 20 0 HIADHN FC(F)(F)c1ccc(Br)c(CNCCc2cn3c(n2)SCC3)c1 ZINC000564414897 945567022 /nfs/dbraw/zinc/56/70/22/945567022.db2.gz IKJXEPHHRSWETP-UHFFFAOYSA-N 0 3 406.271 4.102 20 0 HIADHN Cc1cc(NC(=O)c2cncnc2-c2ccccc2)cc(N2CCN(C(C)C)CC2)c1 ZINC000564437032 945585367 /nfs/dbraw/zinc/58/53/67/945585367.db2.gz RDMLCCPNFOGZMK-UHFFFAOYSA-N 0 3 415.541 4.235 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@@H]2NC[C@]2(C)OCCc3sccc32)cc1 ZINC000564438477 945587695 /nfs/dbraw/zinc/58/76/95/945587695.db2.gz JUKBDSWNKGWJPV-NNWRFLSQSA-N 0 3 419.612 4.219 20 0 HIADHN CCO[C@H]1C[C@H](NCC(=O)Nc2c(C)nn(-c3ccc(C)cc3)c2C)C12CCCC2 ZINC000564496777 945625455 /nfs/dbraw/zinc/62/54/55/945625455.db2.gz NEQSJXNIPRDZEJ-SFTDATJTSA-N 0 3 410.562 4.063 20 0 HIADHN O=C(NC[C@H]1CCCN1Cc1ccccc1)N[C@@H]1c2ccccc2CC12CCOCC2 ZINC000564575928 945683590 /nfs/dbraw/zinc/68/35/90/945683590.db2.gz SQEBUKOYRZONEN-ISKFKSNPSA-N 0 3 419.569 4.044 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)C[C@H](NC(C)=O)c1ccccc1)c1ccc(Cl)cc1 ZINC000565131737 945782836 /nfs/dbraw/zinc/78/28/36/945782836.db2.gz GQEVWKMPSCGICX-VXKWHMMOSA-N 0 3 415.965 4.107 20 0 HIADHN COCCCN(C(=O)CCCOc1cccc(Cl)c1Cl)C1CCN(C)CC1 ZINC000565140256 945787224 /nfs/dbraw/zinc/78/72/24/945787224.db2.gz HWAHSAHBCOXHSI-UHFFFAOYSA-N 0 3 417.377 4.112 20 0 HIADHN COC[C@H](NC(=O)NC[C@H](c1cccs1)N1CCCC1)c1cccc(Cl)c1 ZINC000565278622 945803861 /nfs/dbraw/zinc/80/38/61/945803861.db2.gz WRCCOBXJRNCSFR-ZWKOTPCHSA-N 0 3 407.967 4.225 20 0 HIADHN CC(C)(C)[C@H](Cc1ccccc1C(F)(F)F)NCc1cn(Cc2cccnc2)nn1 ZINC000565628536 945858537 /nfs/dbraw/zinc/85/85/37/945858537.db2.gz ZEBZPCRHPQWSCB-FQEVSTJZSA-N 0 3 417.479 4.487 20 0 HIADHN NC(=O)[C@@H]1CCCN(Cc2ccccc2NC(=O)c2ccc(C3CCCC3)cc2)C1 ZINC000565632358 945860280 /nfs/dbraw/zinc/86/02/80/945860280.db2.gz YSRQEITYXHRALK-JOCHJYFZSA-N 0 3 405.542 4.294 20 0 HIADHN Fc1ccc([C@@H]2C[C@@H](NCc3cn4ccc(Br)cc4n3)CCO2)cc1 ZINC000565721481 945872188 /nfs/dbraw/zinc/87/21/88/945872188.db2.gz NCUYFKKWAAGJKA-WMZOPIPTSA-N 0 3 404.283 4.246 20 0 HIADHN CCc1ccc(C[C@H](Cc2ccc(Cl)cc2)NCc2nnc3ccccn32)nc1 ZINC000565974538 945951704 /nfs/dbraw/zinc/95/17/04/945951704.db2.gz VBOXMIVVYLGQJH-NRFANRHFSA-N 0 3 405.933 4.284 20 0 HIADHN COc1cccc([C@@H]2[C@H](NCC(=O)Nc3c(C)cccc3Cl)CCN2C2CC2)c1 ZINC000566400547 946021728 /nfs/dbraw/zinc/02/17/28/946021728.db2.gz HRYUUVHDQBKADO-NFBKMPQASA-N 0 3 413.949 4.163 20 0 HIADHN COc1ccc([C@H](CNC(=O)Nc2ccc(OC(F)F)cc2F)N2CCCC2)cc1 ZINC000566574089 946043893 /nfs/dbraw/zinc/04/38/93/946043893.db2.gz RZUHHNQCDLPRCT-IBGZPJMESA-N 0 3 423.435 4.394 20 0 HIADHN C/C(=C\c1cccc(C(F)(F)F)c1)CN(C)[C@H](C)c1cccc(S(N)(=O)=O)c1 ZINC000566587843 946049816 /nfs/dbraw/zinc/04/98/16/946049816.db2.gz KTSGYMSOKSWZAR-YVGNARHYSA-N 0 3 412.477 4.449 20 0 HIADHN OC1(Cc2ccc(F)cc2F)C[C@H]2CC[C@@H](C1)N2Cc1ccc(N2CCCC2)nc1 ZINC000566646728 946064491 /nfs/dbraw/zinc/06/44/91/946064491.db2.gz RZRZOTHRHQYBAV-SVGJNIJCSA-N 0 3 413.512 4.061 20 0 HIADHN CC(=O)c1oc2cc(C)ccc2c1CC(=O)N1C[C@H]2CCCN2Cc2ccccc21 ZINC000566700900 946075637 /nfs/dbraw/zinc/07/56/37/946075637.db2.gz QUDJFRVPVOVWIQ-LJQANCHMSA-N 0 3 402.494 4.498 20 0 HIADHN Cc1c(NC(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)cnn1-c1ccc(Cl)cc1 ZINC000566937959 946177046 /nfs/dbraw/zinc/17/70/46/946177046.db2.gz ITZDIIFICYKMRR-PZJWPPBQSA-N 0 3 409.921 4.401 20 0 HIADHN C[C@@H]1CN(c2nnc(-c3cccc4cccnc43)n2C)[C@H](C)CN1Cc1ccccc1 ZINC000566942986 946181198 /nfs/dbraw/zinc/18/11/98/946181198.db2.gz VRBGMYRTQFMNNI-RTBURBONSA-N 0 3 412.541 4.130 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)c1ccc(C(=O)Nc2ccccc2)cc1)c1ccco1 ZINC000567016315 946217639 /nfs/dbraw/zinc/21/76/39/946217639.db2.gz UYNIKEMTPUANPD-UTKZUKDTSA-N 0 3 405.498 4.391 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)N1CCc2ccccc2C1)c1ccc(Oc2cccnc2)cc1 ZINC000567021476 946219581 /nfs/dbraw/zinc/21/95/81/946219581.db2.gz XEFADHOZFXAQOJ-MOPGFXCFSA-N 0 3 401.510 4.498 20 0 HIADHN COc1cc2c(cc1CN1CCC[C@@H](c3nc(C(F)(F)F)cn3C)C1)O[C@H](C)C2 ZINC000567084884 946236487 /nfs/dbraw/zinc/23/64/87/946236487.db2.gz DUZWFUCDYWOIMF-ZIAGYGMSSA-N 0 3 409.452 4.151 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)c1ccc2[nH]c3c(c2c1)CCCCC3 ZINC000567102721 946242775 /nfs/dbraw/zinc/24/27/75/946242775.db2.gz WZAZVIBBWGXLHN-FQEVSTJZSA-N 0 3 403.526 4.256 20 0 HIADHN CCCc1cccc(C(C)C)c1NC(=O)N1CC[C@@H](N2CCN(C(C)C)CC2)C1 ZINC000567298103 946300468 /nfs/dbraw/zinc/30/04/68/946300468.db2.gz OXOQRUDPQPGPMB-OAQYLSRUSA-N 0 3 400.611 4.395 20 0 HIADHN CN1CC[C@H](NCC(=O)Nc2ccc(Cl)cc2Cl)[C@@H]1c1ccc(F)c(F)c1 ZINC000567373742 946319365 /nfs/dbraw/zinc/31/93/65/946319365.db2.gz ZPIUGHHNPWYNDE-HKUYNNGSSA-N 0 3 414.283 4.245 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)c2cnn(-c3ccccc3)c2C2CC2)CCN1Cc1ccccc1 ZINC000567780744 946406741 /nfs/dbraw/zinc/40/67/41/946406741.db2.gz HOODYRKGIKNVRL-JPYJTQIMSA-N 0 3 400.526 4.143 20 0 HIADHN CC[C@@H](NCc1cccc(N2C(=O)NC3(CCCC3)C2=O)c1)c1cccc(OC)c1 ZINC000567799741 946415671 /nfs/dbraw/zinc/41/56/71/946415671.db2.gz DCQACSFJURSFRD-OAQYLSRUSA-N 0 3 407.514 4.305 20 0 HIADHN CCC(CC)[C@@H](c1ccc(Cl)cc1)N(C)C(=O)C(=O)N[C@H](C)C1=CCN(C)CC1 ZINC000567966384 946432083 /nfs/dbraw/zinc/43/20/83/946432083.db2.gz YIQAYDSKGNEYGT-IERDGZPVSA-N 0 3 419.997 4.042 20 0 HIADHN CCC(CC)[C@H](c1ccc(Cl)cc1)N(C)C(=O)C(=O)N[C@H](C)C1=CCN(C)CC1 ZINC000567966385 946432743 /nfs/dbraw/zinc/43/27/43/946432743.db2.gz YIQAYDSKGNEYGT-IIBYNOLFSA-N 0 3 419.997 4.042 20 0 HIADHN CCC(CC)[C@@H](c1ccc(Cl)cc1)N(C)C(=O)C(=O)N[C@@H](C)C1=CCN(C)CC1 ZINC000567966386 946432871 /nfs/dbraw/zinc/43/28/71/946432871.db2.gz YIQAYDSKGNEYGT-KKSFZXQISA-N 0 3 419.997 4.042 20 0 HIADHN CC(C)Cc1ccc([C@H](CNC(=O)c2ncccc2Br)N(C)C)cc1 ZINC000568049249 946450230 /nfs/dbraw/zinc/45/02/30/946450230.db2.gz YMTSHYSIJSPTFU-SFHVURJKSA-N 0 3 404.352 4.075 20 0 HIADHN CSc1ccc([C@H](CNC(=O)c2cnn(CC(C)C)c2C(F)F)N(C)C)cc1 ZINC000568132221 946473902 /nfs/dbraw/zinc/47/39/02/946473902.db2.gz PYWAWXIWIKHTDG-KRWDZBQOSA-N 0 3 410.534 4.231 20 0 HIADHN C[C@@H]1[C@H](NC(=O)c2cnn(C(C)(C)C)c2C(F)(F)F)CCN1Cc1ccccc1 ZINC000568313914 946500998 /nfs/dbraw/zinc/50/09/98/946500998.db2.gz IAMGMSBXLRPKRJ-RHSMWYFYSA-N 0 3 408.468 4.050 20 0 HIADHN CN(C)C[C@H](NC(=O)Nc1cccc(N2CCCCC2=O)c1)c1ccc(Cl)cc1 ZINC000568417204 946533087 /nfs/dbraw/zinc/53/30/87/946533087.db2.gz YCINYMQLMQXFCR-FQEVSTJZSA-N 0 3 414.937 4.281 20 0 HIADHN O[C@@H](CNCc1ccccc1OCc1ccccc1)COc1cccc2[nH]ccc21 ZINC000568461410 946563748 /nfs/dbraw/zinc/56/37/48/946563748.db2.gz MEWQHUPZYREOFI-NRFANRHFSA-N 0 3 402.494 4.276 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNCc2nc3cc(Cl)ccc3n2C)N(C)C)cc1 ZINC000568677650 946649913 /nfs/dbraw/zinc/64/99/13/946649913.db2.gz PWFZRGONUZKRKA-OAQYLSRUSA-N 0 3 400.954 4.406 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)c1c[nH]c(-c2ccccc2)n1 ZINC000568680752 946651501 /nfs/dbraw/zinc/65/15/01/946651501.db2.gz QYFGGRKABWHDMK-UHFFFAOYSA-N 0 3 416.447 4.300 20 0 HIADHN Cc1ccc(-c2nn(Cc3ccccc3)cc2C(=O)N2[C@@H]3CC[C@H]2CCN(C)C3)cc1 ZINC000568799727 946699200 /nfs/dbraw/zinc/69/92/00/946699200.db2.gz DOTONSROTSPIHG-XZOQPEGZSA-N 0 3 414.553 4.216 20 0 HIADHN COc1ccc([C@@H](Cc2ccccc2)N[C@@H](C)C(=O)Nc2ccnn2C(C)C)cc1 ZINC000569046728 946808443 /nfs/dbraw/zinc/80/84/43/946808443.db2.gz YCTSAJLKZFQNKN-PGRDOPGGSA-N 0 3 406.530 4.373 20 0 HIADHN Cc1cc(Br)cn2c(CN[C@@H](c3ccccc3)C3(CO)CCC3)cnc12 ZINC000569131836 946820005 /nfs/dbraw/zinc/82/00/05/946820005.db2.gz DCNHQXLHUTZVPE-IBGZPJMESA-N 0 3 414.347 4.399 20 0 HIADHN CC(C)Cc1ccc([C@@H](CNC(=O)c2ccncc2Br)N(C)C)cc1 ZINC000569162127 946828850 /nfs/dbraw/zinc/82/88/50/946828850.db2.gz PLEDVDPXQIBDHO-LJQANCHMSA-N 0 3 404.352 4.075 20 0 HIADHN C[C@H]1[C@H](NC(=O)Nc2cccc(OCc3cccnc3)c2)CCN1Cc1ccccc1 ZINC000569261046 946842286 /nfs/dbraw/zinc/84/22/86/946842286.db2.gz OXVGXEQNLLGIPX-YADARESESA-N 0 3 416.525 4.445 20 0 HIADHN Cc1cc(=O)[nH]c2cc(C(=O)Nc3ccc(CCN4CCSCC4)cc3)ccc12 ZINC000569266445 946844878 /nfs/dbraw/zinc/84/48/78/946844878.db2.gz HSLWVEOEFLIIPE-UHFFFAOYSA-N 0 3 407.539 4.092 20 0 HIADHN CSc1ccc(NC(=O)CN[C@H]2CCN(C(C)C)[C@H]2c2ccc(F)c(F)c2)cc1 ZINC000569359499 946860461 /nfs/dbraw/zinc/86/04/61/946860461.db2.gz WJBJQUYGKGJGAY-UNMCSNQZSA-N 0 3 419.541 4.439 20 0 HIADHN COc1ccc([C@H](C)NC[C@H](c2c(F)cccc2Cl)N2CCO[C@H](C)C2)cc1O ZINC000569512804 946883471 /nfs/dbraw/zinc/88/34/71/946883471.db2.gz HRFBESDVEOWZSQ-ZRGWGRIASA-N 0 3 422.928 4.306 20 0 HIADHN c1cc2c(s1)CCN([C@@H](CN[C@@H](c1nnc[nH]1)c1ccccc1)c1ccccc1)C2 ZINC000569617835 946897125 /nfs/dbraw/zinc/89/71/25/946897125.db2.gz ROBPFNOQKSZWRZ-JTHBVZDNSA-N 0 3 415.566 4.345 20 0 HIADHN c1cc2c(s1)CCN([C@H](CN[C@H](c1nnc[nH]1)c1ccccc1)c1ccccc1)C2 ZINC000569617833 946897371 /nfs/dbraw/zinc/89/73/71/946897371.db2.gz ROBPFNOQKSZWRZ-GGAORHGYSA-N 0 3 415.566 4.345 20 0 HIADHN C[C@H](N[C@H]1CCCN([C@@H](C)c2ccc(F)cc2)C1=O)c1ccc2c(c1)OCCCO2 ZINC000570111088 947096093 /nfs/dbraw/zinc/09/60/93/947096093.db2.gz IBERXOWWFISPEG-FIKGOQFSSA-N 0 3 412.505 4.390 20 0 HIADHN CC(=O)N1C[C@@H]2CCC[C@H](N[C@@H](C(=O)Nc3cc(C)ccc3C)c3ccccc3)[C@H]2C1 ZINC000570123317 947101207 /nfs/dbraw/zinc/10/12/07/947101207.db2.gz IVAPXKNEJAAPBV-KELBGUDLSA-N 0 3 419.569 4.220 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)Nc1ccc(CN(C(C)=O)C(C)C)cc1)c1ccco1 ZINC000570268182 947177911 /nfs/dbraw/zinc/17/79/11/947177911.db2.gz YODUIIOSQQTSSV-UTKZUKDTSA-N 0 3 414.550 4.287 20 0 HIADHN Cc1cccc(C)c1[C@H](C)NCC(=O)N1c2ccccc2NC(=O)C[C@@H]1C(F)(F)F ZINC000570441364 947249949 /nfs/dbraw/zinc/24/99/49/947249949.db2.gz NKZJYIKFBBQXTM-MAUKXSAKSA-N 0 3 419.447 4.260 20 0 HIADHN Cc1ncsc1-c1nc2ccccc2n1CC(=O)Nc1ccccc1CN(C)C ZINC000570495368 947268345 /nfs/dbraw/zinc/26/83/45/947268345.db2.gz CGWDRVLXJLRQOU-UHFFFAOYSA-N 0 3 405.527 4.169 20 0 HIADHN CN(C(=O)c1ccc(NCc2ccccc2Br)cc1)[C@@H]1CCCN(C)C1 ZINC000570552135 947290106 /nfs/dbraw/zinc/29/01/06/947290106.db2.gz JSUQLDLZIHVXEP-LJQANCHMSA-N 0 3 416.363 4.227 20 0 HIADHN Cc1c2cccc(Cl)c2sc1CN1CCC[C@H](CNS(=O)(=O)C2CC2)C1 ZINC000570590340 947306363 /nfs/dbraw/zinc/30/63/63/947306363.db2.gz QBKDYDJOSOOHIR-CQSZACIVSA-N 0 3 413.008 4.157 20 0 HIADHN O=C1[C@H](N[C@@H](C[C@H]2CCOC2)c2ccccc2)CCN1c1ccc(F)c(Cl)c1 ZINC000570639247 947320253 /nfs/dbraw/zinc/32/02/53/947320253.db2.gz HGADORKXVHDNNC-LPTQZCDUSA-N 0 3 402.897 4.342 20 0 HIADHN CCOc1cc(CN2CC[C@H](C(=O)N3CCCC3)C2)ccc1OCc1ccccc1 ZINC000570703086 947329829 /nfs/dbraw/zinc/32/98/29/947329829.db2.gz HYUGRBHCGDHGPG-QFIPXVFZSA-N 0 3 408.542 4.109 20 0 HIADHN COc1ncc([C@H](C)NCc2ccc(CN3C[C@@H](C)O[C@H](C)C3)cc2)cc1Cl ZINC000570913673 947392490 /nfs/dbraw/zinc/39/24/90/947392490.db2.gz OATQVNLAJMQYKV-ZACQAIPSSA-N 0 3 403.954 4.204 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)Cc3c[nH]c4cccc(Cl)c34)CC2)C[C@H](C)O1 ZINC000570949460 947396039 /nfs/dbraw/zinc/39/60/39/947396039.db2.gz XGTICMXRTSRVFF-IRXDYDNUSA-N 0 3 417.981 4.102 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)C1(c2cc(F)cc(Br)c2)CC1)c1ccco1 ZINC000570958309 947399243 /nfs/dbraw/zinc/39/92/43/947399243.db2.gz RLEVJRCMUIVXEZ-DYVFJYSZSA-N 0 3 423.326 4.458 20 0 HIADHN O=C(NC[C@H]1CCCO1)c1cccc(CN[C@H]2CCCc3c4ccccc4[nH]c32)c1 ZINC000571153513 947532126 /nfs/dbraw/zinc/53/21/26/947532126.db2.gz IAKZWSYILKHRJL-XXBNENTESA-N 0 3 403.526 4.244 20 0 HIADHN CN(C)S(=O)(=O)c1cccc(CN[C@@H](Cc2ccc(F)cc2)c2ccccc2)c1 ZINC000571308307 947586801 /nfs/dbraw/zinc/58/68/01/947586801.db2.gz GAYKUKFIKRBEDO-QHCPKHFHSA-N 0 3 412.530 4.150 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1sc(C(C)(C)OC)nc1C)c1cccc(OC)c1 ZINC000571366993 947625619 /nfs/dbraw/zinc/62/56/19/947625619.db2.gz ZQBFZWOJSNGZLE-GOSISDBHSA-N 0 3 419.591 4.155 20 0 HIADHN Cc1noc(-c2ccc(C)c(NC(=O)N[C@H]3CCN(Cc4ccccc4)[C@H]3C)c2)n1 ZINC000571474332 947663970 /nfs/dbraw/zinc/66/39/70/947663970.db2.gz MUPFTXHGNSNBIY-JXFKEZNVSA-N 0 3 405.502 4.138 20 0 HIADHN CCN1CC[C@@H](NCC(=O)Nc2ccc(SC)cc2)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000571584464 947713453 /nfs/dbraw/zinc/71/34/53/947713453.db2.gz XBLNODVMUQKTBO-NQIIRXRSSA-N 0 3 423.504 4.189 20 0 HIADHN Cc1ccccc1-n1cc(CNC[C@@H]2CCN(C)[C@H]2c2ccc(Cl)c(F)c2)nn1 ZINC000571717577 947759736 /nfs/dbraw/zinc/75/97/36/947759736.db2.gz DYKNOWFJHYCYBR-JTSKRJEESA-N 0 3 413.928 4.151 20 0 HIADHN CCCN(C)[C@H](CNC(=O)c1ccc(F)c(NC(C)=O)c1)c1ccc(Cl)cc1 ZINC000571781617 947779523 /nfs/dbraw/zinc/77/95/23/947779523.db2.gz ZBKWGLWTMSTPSF-HXUWFJFHSA-N 0 3 405.901 4.250 20 0 HIADHN CN1CCN(CCCSc2ncnc3cc(-c4ccc(F)cc4)sc32)CC1 ZINC000571888884 947807278 /nfs/dbraw/zinc/80/72/78/947807278.db2.gz VGFNPADNVWKVNR-UHFFFAOYSA-N 0 3 402.564 4.227 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3nc4ccccc4cc3Cl)CC2)C[C@@H](C)O1 ZINC000571933672 947816269 /nfs/dbraw/zinc/81/62/69/947816269.db2.gz YXUWKICTENESDT-IAGOWNOFSA-N 0 3 415.965 4.240 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N[C@H]2c3ccccc3CC23CCOCC3)C1 ZINC000571936271 947817340 /nfs/dbraw/zinc/81/73/40/947817340.db2.gz UNRJPMAEMBYLCZ-CKUXNOBLSA-N 0 3 419.569 4.215 20 0 HIADHN CNS(=O)(=O)c1cccc([C@@H](C)NC/C(C)=C\c2cccc(C(F)(F)F)c2)c1 ZINC000571955032 947821217 /nfs/dbraw/zinc/82/12/17/947821217.db2.gz WRJHNZOMRACECF-BAAYTWLHSA-N 0 3 412.477 4.368 20 0 HIADHN C[C@H](c1ccc(F)c(F)c1)N(C)C(=O)CN[C@H]1CCN(C)[C@@H]1c1ccc(Cl)cc1 ZINC000571963124 947823620 /nfs/dbraw/zinc/82/36/20/947823620.db2.gz SOESRDDIKUNZHF-VQUVXCFPSA-N 0 3 421.919 4.173 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)c1ccc(NC(=O)c2ccccc2)cc1 ZINC000572076488 947840800 /nfs/dbraw/zinc/84/08/00/947840800.db2.gz HROQZAPLGXEDSR-LJQANCHMSA-N 0 3 401.510 4.189 20 0 HIADHN CCCCO[C@H]1C[C@@H](NCC(=O)Nc2c(C)nn(-c3ccc(C)cc3)c2C)C1(C)C ZINC000572079680 947841347 /nfs/dbraw/zinc/84/13/47/947841347.db2.gz LTAJSTVMQIXUCT-RTWAWAEBSA-N 0 3 412.578 4.309 20 0 HIADHN C/C(=C\c1ccccc1OC(F)F)CN[C@H]1CCN(Cc2ccc(F)cc2)C1=O ZINC000572084107 947843064 /nfs/dbraw/zinc/84/30/64/947843064.db2.gz YXLWHBHHQPKFME-QZEGLACASA-N 0 3 404.432 4.221 20 0 HIADHN CC[C@H](C(=O)Nc1cccc(CN2CC[C@@H](O)C2)c1)c1cccc(C(F)(F)F)c1 ZINC000572173023 947856657 /nfs/dbraw/zinc/85/66/57/947856657.db2.gz AVSIITLLKDMVJQ-UXHICEINSA-N 0 3 406.448 4.404 20 0 HIADHN CCn1nccc1N1CCC[C@@H](N[C@@H](C)c2ccc(OC(C)C)c(Cl)c2)C1=O ZINC000572264301 947871122 /nfs/dbraw/zinc/87/11/22/947871122.db2.gz HRIKSIATXGJODM-MAUKXSAKSA-N 0 3 404.942 4.190 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)CCc1cc(F)ccc1Br)c1ccco1 ZINC000572394095 947894219 /nfs/dbraw/zinc/89/42/19/947894219.db2.gz MHDAXVCNGMHTEH-GUYCJALGSA-N 0 3 411.315 4.359 20 0 HIADHN C[C@H]1C[C@H](NS(=O)(=O)Cc2ccc3ccccc3c2)CCN1Cc1ccccc1 ZINC000572528380 947931588 /nfs/dbraw/zinc/93/15/88/947931588.db2.gz OKMUWEYWVBGRHM-YADARESESA-N 0 3 408.567 4.312 20 0 HIADHN C[C@H](CN1CCC[C@H](CNC(=O)CC(F)(F)F)C1)c1cccc(Br)c1 ZINC000572563898 947949381 /nfs/dbraw/zinc/94/93/81/947949381.db2.gz QJXIBFYFQZHNRG-ZIAGYGMSSA-N 0 3 421.301 4.333 20 0 HIADHN C[C@@H](Cn1ccc2ccccc21)c1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1 ZINC000572643635 947965977 /nfs/dbraw/zinc/96/59/77/947965977.db2.gz FOYHKLNCHAEPBY-SFHVURJKSA-N 0 3 416.529 4.032 20 0 HIADHN CCCn1ccnc1CCCN(C)Cc1cnn(-c2ccc(Br)cc2)c1 ZINC000572683379 947985389 /nfs/dbraw/zinc/98/53/89/947985389.db2.gz SLYWQOWWTTYEJC-UHFFFAOYSA-N 0 3 416.367 4.306 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CCC(C)(OC)CC1)c1ccc(C(F)(F)F)cc1 ZINC000573228755 948114332 /nfs/dbraw/zinc/11/43/32/948114332.db2.gz IGRLPLHVZHOMMP-SFHVURJKSA-N 0 3 415.500 4.299 20 0 HIADHN COC(=O)c1ccc(COc2ccc(CN3CC4(CCC4)[C@H]3C3CC3)cc2OC)o1 ZINC000573412505 948200729 /nfs/dbraw/zinc/20/07/29/948200729.db2.gz JFRVGAOTVWPRES-JOCHJYFZSA-N 0 3 411.498 4.418 20 0 HIADHN C[C@H](N[C@@H]1c2ccccc2CC12CCOCC2)C(=O)Nc1cccc2ncccc21 ZINC000573490924 948217223 /nfs/dbraw/zinc/21/72/23/948217223.db2.gz UXVUDZJHRYCVIS-GAJHUEQPSA-N 0 3 401.510 4.246 20 0 HIADHN CCN1CC[C@H](NCC(=O)N(C)Cc2ccccc2F)[C@H]1c1ccc(Cl)c(F)c1 ZINC000573627105 948256119 /nfs/dbraw/zinc/25/61/19/948256119.db2.gz CGTSWQJREGZLLJ-RBBKRZOGSA-N 0 3 421.919 4.002 20 0 HIADHN COC(=O)c1ccc(CNCc2ccc(Br)c(Br)c2)cc1 ZINC000573844976 948308832 /nfs/dbraw/zinc/30/88/32/948308832.db2.gz HYGOOSLLMNRMBX-UHFFFAOYSA-N 0 3 413.109 4.288 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)Nc1ncc(C(F)(F)F)s1 ZINC000573937413 948328861 /nfs/dbraw/zinc/32/88/61/948328861.db2.gz VVCQEDZJXCOWQB-UHFFFAOYSA-N 0 3 408.396 4.036 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)c1ccc(Oc2ccc(C(N)=O)cc2)cc1)c1ccco1 ZINC000573950583 948331661 /nfs/dbraw/zinc/33/16/61/948331661.db2.gz UWNVQJJVNVORBE-KKSFZXQISA-N 0 3 421.497 4.030 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@@H]2NCc2cn3ccc(Br)cc3n2)cc1 ZINC000573965221 948335905 /nfs/dbraw/zinc/33/59/05/948335905.db2.gz JUPCLBOPXMJLCB-ICSRJNTNSA-N 0 3 400.320 4.415 20 0 HIADHN Cc1ccc([C@@H](NCCCc2cccc(C)n2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000574062286 948355723 /nfs/dbraw/zinc/35/57/23/948355723.db2.gz PKBSDDQRKCYYKE-XMMPIXPASA-N 0 3 408.567 4.414 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)Nc1cccnc1C(F)(F)F ZINC000574118062 948368934 /nfs/dbraw/zinc/36/89/34/948368934.db2.gz YEBAVQBTADPYEQ-UHFFFAOYSA-N 0 3 400.832 4.350 20 0 HIADHN O=C(CCNCc1ccccc1OC(F)(F)F)Nc1ccc(Br)cc1 ZINC000574138436 948374624 /nfs/dbraw/zinc/37/46/24/948374624.db2.gz NIXPQWYJWIOYMF-UHFFFAOYSA-N 0 3 417.225 4.466 20 0 HIADHN Cc1cc(CN[C@H](CN2CCC(C(N)=O)CC2)c2ccc(Cl)cc2)ccc1Cl ZINC000574203377 948386563 /nfs/dbraw/zinc/38/65/63/948386563.db2.gz XIOZOOMKFJMCIN-OAQYLSRUSA-N 0 3 420.384 4.330 20 0 HIADHN COc1ccc([C@H](Cc2ccccc2)NS(=O)(=O)c2ccc(CN(C)C)cc2)cc1 ZINC000574243105 948396547 /nfs/dbraw/zinc/39/65/47/948396547.db2.gz MEJAWFLBSDXKGW-DEOSSOPVSA-N 0 3 424.566 4.019 20 0 HIADHN Cc1nc(-c2ncccn2)sc1C(=O)NC[C@H](c1ccc(CC(C)C)cc1)N(C)C ZINC000574334575 948416154 /nfs/dbraw/zinc/41/61/54/948416154.db2.gz VEIRCGQROLGZQV-LJQANCHMSA-N 0 3 423.586 4.140 20 0 HIADHN C[C@@H](NC[C@@H](c1ccc(Cl)cc1)N1CCOCC1)c1ccc(Br)cn1 ZINC000574456541 948447780 /nfs/dbraw/zinc/44/77/80/948447780.db2.gz ZBNUCNQZBJKJEN-KUHUBIRLSA-N 0 3 424.770 4.222 20 0 HIADHN CCc1ccc([C@@H](NCCC2(OC)CCC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000574657439 948496998 /nfs/dbraw/zinc/49/69/98/948496998.db2.gz NSXKPOKALRNKLN-JOCHJYFZSA-N 0 3 401.572 4.291 20 0 HIADHN Cc1nc2ccccn2c(=O)c1CCN1CCC[C@@H]1c1ccc(Br)cc1 ZINC000574797500 948530253 /nfs/dbraw/zinc/53/02/53/948530253.db2.gz CVWWSTNOFVVWMS-LJQANCHMSA-N 0 3 412.331 4.145 20 0 HIADHN CSC1(CN(C)Cc2cccc(Br)c2OC[C@H]2CCCO2)CC1 ZINC000574797197 948530894 /nfs/dbraw/zinc/53/08/94/948530894.db2.gz SYYIYWHIDYDKAG-OAHLLOKOSA-N 0 3 400.382 4.334 20 0 HIADHN Cc1c(NC(=O)N[C@@H]2CCN(Cc3ccccc3)[C@@H]2C)cccc1C(=O)N1CCCC1 ZINC000574839154 948539516 /nfs/dbraw/zinc/53/95/16/948539516.db2.gz HFIITEYNNWVTGW-AUSIDOKSSA-N 0 3 420.557 4.016 20 0 HIADHN C[C@@H](NC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1)c1nccn1-c1ccccc1 ZINC000574937193 948557557 /nfs/dbraw/zinc/55/75/57/948557557.db2.gz XKMPBSZODGDZCP-QUCCMNQESA-N 0 3 406.505 4.101 20 0 HIADHN COc1cc(CN(C)[C@@H](C)[C@@H]2Cc3ccccc3O2)cc(OC)c1OCC(F)F ZINC000575095104 948591419 /nfs/dbraw/zinc/59/14/19/948591419.db2.gz XCMRREXSCUJOSQ-KSSFIOAISA-N 0 3 407.457 4.172 20 0 HIADHN CCc1ccccc1NC(=O)[C@H](C)N[C@H]1CCN(CC)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000575198482 948626252 /nfs/dbraw/zinc/62/62/52/948626252.db2.gz LEKYNPODYAFVNR-PRPYNDMISA-N 0 3 419.491 4.418 20 0 HIADHN C[C@H]1CCCC[C@@H]1N(C)C(=O)CNC1(c2cccc(C(F)(F)F)c2)CCOCC1 ZINC000575207070 948629490 /nfs/dbraw/zinc/62/94/90/948629490.db2.gz BHXCHQZSPLMMLX-LPHOPBHVSA-N 0 3 412.496 4.338 20 0 HIADHN CN(C)C[C@@H](NC(=O)Nc1ccc2oc(C(F)(F)F)nc2c1)c1ccc(F)cc1 ZINC000575238373 948639866 /nfs/dbraw/zinc/63/98/66/948639866.db2.gz AWENRPNOVGZIDZ-OAHLLOKOSA-N 0 3 410.371 4.410 20 0 HIADHN CC[C@@H](N[C@@H]1CCCc2cc(S(N)(=O)=O)ccc21)c1ccccc1OC(F)F ZINC000575360085 948653355 /nfs/dbraw/zinc/65/33/55/948653355.db2.gz PTGVBIIUZAAYAL-QZTJIDSGSA-N 0 3 410.486 4.054 20 0 HIADHN COc1ccc(C[C@@H](C)C(=O)NC[C@H](c2ccc(SC)cc2)N(C)C)cc1OC ZINC000575831575 948728491 /nfs/dbraw/zinc/72/84/91/948728491.db2.gz RQKSXLSKNMMLGC-OXQOHEQNSA-N 0 3 416.587 4.023 20 0 HIADHN O[C@@H](COc1ccc(-c2ccccc2)cc1)CN1CCC(F)(c2cccnc2)CC1 ZINC000575904341 948765368 /nfs/dbraw/zinc/76/53/68/948765368.db2.gz HPSSMKGVUVCBLH-HSZRJFAPSA-N 0 3 406.501 4.449 20 0 HIADHN COCCOCc1ccc(CNc2ccc(CN3CCSCC3)cc2C)cc1 ZINC000575950487 948797335 /nfs/dbraw/zinc/79/73/35/948797335.db2.gz GFERPWKSGPLLLU-UHFFFAOYSA-N 0 3 400.588 4.319 20 0 HIADHN O[C@H](CN[C@@H]1CCSc2c(F)cccc21)COc1ccccc1C(F)(F)F ZINC000576068898 948819153 /nfs/dbraw/zinc/81/91/53/948819153.db2.gz XHVDYFMWFDCYGP-MLGOLLRUSA-N 0 3 401.425 4.411 20 0 HIADHN Clc1cccc2c1nc(Cl)nc2N1CC[C@@H]2[C@H]1CCN2Cc1cccnc1 ZINC001164726533 720373305 /nfs/dbraw/zinc/37/33/05/720373305.db2.gz PDINAJOIEJTJCV-IAGOWNOFSA-N 0 3 400.313 4.185 20 0 HIADHN Cn1cc(CN2CC[C@@H]3CN(c4cc(Cl)nc5cc(Cl)ccc54)C[C@H]3C2)cn1 ZINC001164771732 721107025 /nfs/dbraw/zinc/10/70/25/721107025.db2.gz STTYADUCBXDGFU-HZPDHXFCSA-N 0 3 416.356 4.233 20 0 HIADHN Cn1cc(CN2CC[C@@H]3CN(c4c(Cl)ccc5ccc(Cl)nc54)C[C@@H]3C2)cn1 ZINC001164768943 721234662 /nfs/dbraw/zinc/23/46/62/721234662.db2.gz YXGUHAWHZRUYJM-SJORKVTESA-N 0 3 416.356 4.233 20 0 HIADHN O=C(CC1CCC2(CC1)CCN(c1ncccc1CN1CCCC1)CC2)N1CC=CC1 ZINC001164777067 721328958 /nfs/dbraw/zinc/32/89/58/721328958.db2.gz LSQUOGWODIJOEI-UHFFFAOYSA-N 0 3 422.617 4.243 20 0 HIADHN Cc1ccc2ncnc(N3CCC(F)(F)[C@@]4(CCN(Cc5ccccn5)C4)C3)c2c1 ZINC001164907485 721694000 /nfs/dbraw/zinc/69/40/00/721694000.db2.gz UGPJZGBMZWVAGO-JOCHJYFZSA-N 0 3 409.484 4.071 20 0 HIADHN FC1(F)CCN(c2cc(Cl)nc3c2CCC3)C[C@]12CCN(Cc1ccccn1)C2 ZINC001164907842 721695489 /nfs/dbraw/zinc/69/54/89/721695489.db2.gz VCOHWTSQUARFGO-OAQYLSRUSA-N 0 3 418.919 4.356 20 0 HIADHN COc1cc(N2CCC(F)(F)[C@@]3(CCN(Cc4ccccn4)C3)C2)nc2ccccc21 ZINC001164905735 721715567 /nfs/dbraw/zinc/71/55/67/721715567.db2.gz JDRDWWVMHPEXHZ-HSZRJFAPSA-N 0 3 424.495 4.376 20 0 HIADHN Cc1cc2ccncc2nc1N1CCC(F)(F)[C@]2(CCN(Cc3ccccn3)C2)C1 ZINC001164913527 721731426 /nfs/dbraw/zinc/73/14/26/721731426.db2.gz WUUZOXONFGVKDF-QFIPXVFZSA-N 0 3 409.484 4.071 20 0 HIADHN Cc1ccc2nc(N3CCC4(CC3)COCCN(Cc3ccncc3)C4)ccc2c1 ZINC001164958031 722051603 /nfs/dbraw/zinc/05/16/03/722051603.db2.gz ARHWXBPWLFWQTK-UHFFFAOYSA-N 0 3 402.542 4.057 20 0 HIADHN Clc1ccc2c(ccnc2N2CC[C@H]3CN(Cc4cccnc4)CCO[C@@H]3C2)c1 ZINC001164976558 722109757 /nfs/dbraw/zinc/10/97/57/722109757.db2.gz LSSDDMJKTCWOTE-SIKLNZKXSA-N 0 3 408.933 4.011 20 0 HIADHN Cc1ccc2c(c1)cc(Cl)nc2N1CC[C@H]2CN(Cc3cccnc3)CCO[C@H]2C1 ZINC001164974252 722132236 /nfs/dbraw/zinc/13/22/36/722132236.db2.gz CSEBULPFGCCLCQ-UGKGYDQZSA-N 0 3 422.960 4.319 20 0 HIADHN CC(C)c1cc(N2CC[C@@H]3CN(Cc4cccnc4)CCO[C@@H]3C2)nc(C(C)(C)C)n1 ZINC001164973351 722147967 /nfs/dbraw/zinc/14/79/67/722147967.db2.gz BTZRMCANCIWKJY-IFMALSPDSA-N 0 3 423.605 4.020 20 0 HIADHN O=C(Nc1ccc(F)cc1)[C@@H](NCC1CCN(CC(F)(F)F)CC1)c1ccccc1 ZINC000435993585 861273356 /nfs/dbraw/zinc/27/33/56/861273356.db2.gz JDWRCEGCTCJGIZ-FQEVSTJZSA-N 0 3 423.454 4.369 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3cnn(C4CCCC4)c3C)c(C)c2)CC1 ZINC000436112935 861399099 /nfs/dbraw/zinc/39/90/99/861399099.db2.gz SROWAYGFFLMDFO-UHFFFAOYSA-N 0 3 410.566 4.401 20 0 HIADHN COc1ccc(COC[C@H](O)CN(C)Cc2ccc(Cl)c(Cl)c2)cc1OC ZINC000006083071 845168482 /nfs/dbraw/zinc/16/84/82/845168482.db2.gz VIFUHSQUDTZVDC-MRXNPFEDSA-N 0 3 414.329 4.020 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)CSc3ccc(F)c(Cl)c3)cc2)CC1 ZINC000007219249 845286954 /nfs/dbraw/zinc/28/69/54/845286954.db2.gz NEXRZTVMNOQZKD-UHFFFAOYSA-N 0 3 407.942 4.352 20 0 HIADHN CCOc1ccccc1OCCCC(=O)N1c2ccc(C)cc2[C@@H]2CN(C)CC[C@H]21 ZINC000010045410 845614743 /nfs/dbraw/zinc/61/47/43/845614743.db2.gz ROWGFJWSSZWNSX-RBBKRZOGSA-N 0 3 408.542 4.387 20 0 HIADHN CCNC(=O)COc1cccc(CNCc2cc(Cl)cc(C(F)(F)F)c2)c1 ZINC000436278729 861587247 /nfs/dbraw/zinc/58/72/47/861587247.db2.gz GFLNCFIQWPIDAC-UHFFFAOYSA-N 0 3 400.828 4.164 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3c[nH]nc3-c3ccc(Cl)cc3)cc2)CC1 ZINC000010192122 845629638 /nfs/dbraw/zinc/62/96/38/845629638.db2.gz AVPYTRQWKGEKNL-UHFFFAOYSA-N 0 3 409.921 4.124 20 0 HIADHN Cc1c([C@@H](C)N[C@H]2CC[C@@H](C(=O)N3CCCCC3)C2)nnn1-c1ccc(Cl)cc1 ZINC000436280744 861588129 /nfs/dbraw/zinc/58/81/29/861588129.db2.gz COSNBSSULAKSHK-SUMDDJOVSA-N 0 3 415.969 4.061 20 0 HIADHN C/C=C/c1ccc(OCC(=O)N2c3ccc(C)cc3[C@@H]3CN(C)CC[C@H]32)c(OC)c1 ZINC000011760328 845830992 /nfs/dbraw/zinc/83/09/92/845830992.db2.gz BFWSJNHJRXZJOT-KJXQILNXSA-N 0 3 406.526 4.250 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)CSCc3ccc(Cl)cc3)cc2)CC1 ZINC000011945954 845842913 /nfs/dbraw/zinc/84/29/13/845842913.db2.gz OIYKVIWWAKACDW-UHFFFAOYSA-N 0 3 403.979 4.354 20 0 HIADHN O=C(N[C@@H]1CCN(Cc2ccccc2)C1)c1cc(-c2ccncc2)nc2ccccc21 ZINC000014043240 845919975 /nfs/dbraw/zinc/91/99/75/845919975.db2.gz PIHIOIZIWCCCAL-OAQYLSRUSA-N 0 3 408.505 4.301 20 0 HIADHN CN(C)[C@@H](CNC(=O)c1cc2ccccc2cc1NC(=O)C1CC1)c1ccccc1 ZINC000014061998 845922141 /nfs/dbraw/zinc/92/21/41/845922141.db2.gz OCMSBMPLSWMNRA-QHCPKHFHSA-N 0 3 401.510 4.221 20 0 HIADHN O=C(Nc1ccccc1)C1CCN(Cc2cc(=O)oc3cc4c(cc23)CCC4)CC1 ZINC000015550860 846062196 /nfs/dbraw/zinc/06/21/96/846062196.db2.gz JQTJFUHUDMSHGZ-UHFFFAOYSA-N 0 3 402.494 4.132 20 0 HIADHN O=C1CCCN1c1ccc(CNCc2cn(-c3ccccc3)nc2-c2cccnc2)cc1 ZINC000015580926 846066117 /nfs/dbraw/zinc/06/61/17/846066117.db2.gz FAOCCGBUEQVXBW-UHFFFAOYSA-N 0 3 423.520 4.351 20 0 HIADHN CCOc1ccc(OCC(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)cc1 ZINC000018186137 846307769 /nfs/dbraw/zinc/30/77/69/846307769.db2.gz RYOUTSLCXPJTBU-FQEVSTJZSA-N 0 3 402.560 4.115 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)c1cnn(Cc2ccccc2Cl)c1 ZINC000022464025 846574442 /nfs/dbraw/zinc/57/44/42/846574442.db2.gz OFKGZORFPPZJDH-JOCHJYFZSA-N 0 3 408.933 4.152 20 0 HIADHN Cc1ccc(NC(=O)[C@@H](NCC(C)(C)N2C[C@@H](C)O[C@@H](C)C2)c2ccccc2)cc1 ZINC000022735124 846611511 /nfs/dbraw/zinc/61/15/11/846611511.db2.gz OWCUSYNQGNAIGH-MZKRTTBSSA-N 0 3 409.574 4.152 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)c1cc(Cl)c2c(c1)OCCCO2 ZINC000023739842 846744507 /nfs/dbraw/zinc/74/45/07/846744507.db2.gz LOXAXZUVTDDLFK-LJQANCHMSA-N 0 3 400.906 4.068 20 0 HIADHN O=C(CCC(=O)c1ccc2c(c1)CCCC2)NCc1ccccc1CN1CCCC1 ZINC000024190256 846798486 /nfs/dbraw/zinc/79/84/86/846798486.db2.gz AKWLHUZYKFTMED-UHFFFAOYSA-N 0 3 404.554 4.441 20 0 HIADHN CCO[C@H]1C[C@@](CO)(NCc2cccc(NC(=O)c3ccccc3Cl)c2)C1(C)C ZINC000436377595 861720113 /nfs/dbraw/zinc/72/01/13/861720113.db2.gz IGDDAYRNOOXRKS-REWPJTCUSA-N 0 3 416.949 4.248 20 0 HIADHN CCc1ccc(-c2nn(-c3ccccc3)cc2CNCCNC(=O)c2ccco2)cc1 ZINC000025053263 846912444 /nfs/dbraw/zinc/91/24/44/846912444.db2.gz XKDULCOAWQUZSS-UHFFFAOYSA-N 0 3 414.509 4.214 20 0 HIADHN O[C@@H](COc1cccc2ccccc21)CN1CCC[C@@H]1c1ccc2c(c1)OCCO2 ZINC000025227911 846944842 /nfs/dbraw/zinc/94/48/42/846944842.db2.gz MATOZGQGACRICZ-IFMALSPDSA-N 0 3 405.494 4.188 20 0 HIADHN CCN(Cc1ccc(OC)c(OC)c1)C[C@@H](O)COc1ccc(Cl)cc1Cl ZINC000025234605 846945161 /nfs/dbraw/zinc/94/51/61/846945161.db2.gz NOZXDRWWXHJRBI-MRXNPFEDSA-N 0 3 414.329 4.272 20 0 HIADHN Cc1onc(-c2ccccc2)c1C(=O)NC[C@H](C(C)C)N1CCc2ccccc2C1 ZINC000025534547 846995178 /nfs/dbraw/zinc/99/51/78/846995178.db2.gz COSPLISMHUIAMW-JOCHJYFZSA-N 0 3 403.526 4.463 20 0 HIADHN Fc1ccc(Cn2cc(CN[C@H]3CCO[C@H]3c3ccc(Cl)c(F)c3)cn2)cc1 ZINC000436408803 861759124 /nfs/dbraw/zinc/75/91/24/861759124.db2.gz LFTJZUVCTNPJMF-SFTDATJTSA-N 0 3 403.860 4.483 20 0 HIADHN O[C@@H](COc1ccc2ccccc2c1)CN1CCC[C@@H]1c1ccc2c(c1)OCCO2 ZINC000026480950 847155633 /nfs/dbraw/zinc/15/56/33/847155633.db2.gz LDJOEOKUZKKKQU-FYYLOGMGSA-N 0 3 405.494 4.188 20 0 HIADHN COc1cccc(CN(C)C(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)c1 ZINC000026522117 847162544 /nfs/dbraw/zinc/16/25/44/847162544.db2.gz NROSIJFYEGWEMS-HXUWFJFHSA-N 0 3 401.576 4.371 20 0 HIADHN C=CCSc1nc2ccccc2n1CN1CCC(NC(=O)c2ccc(F)cc2)CC1 ZINC000026649233 847181214 /nfs/dbraw/zinc/18/12/14/847181214.db2.gz XTAYFVQIZXPRRH-UHFFFAOYSA-N 0 3 424.545 4.305 20 0 HIADHN COc1ccc(OC)c([C@H](C)NC[C@H](O)COc2ccc(Cl)cc2Cl)c1 ZINC000026715117 847189899 /nfs/dbraw/zinc/18/98/99/847189899.db2.gz LKRSTEDFWBORRU-JSGCOSHPSA-N 0 3 400.302 4.101 20 0 HIADHN COc1ccc(CN(C)C[C@@H](O)COc2ccc3ccccc3c2)cc1OC(F)F ZINC000027210013 847266765 /nfs/dbraw/zinc/26/67/65/847266765.db2.gz YHDNDYQOAUQEJY-LJQANCHMSA-N 0 3 417.452 4.322 20 0 HIADHN CN(C)[C@H](CNC(=O)Cc1csc(-c2ccccc2Cl)n1)Cc1ccccc1 ZINC000027584867 847322994 /nfs/dbraw/zinc/32/29/94/847322994.db2.gz SUTUPSZICNJLCI-SFHVURJKSA-N 0 3 413.974 4.295 20 0 HIADHN COc1ccc(O[C@@H](C)C(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)cc1 ZINC000027575387 847323024 /nfs/dbraw/zinc/32/30/24/847323024.db2.gz QHIAQQLAMWVGFY-PXNSSMCTSA-N 0 3 402.560 4.113 20 0 HIADHN Cc1noc(C)c1COc1ccccc1C(=O)NC1CCN(Cc2ccccc2)CC1 ZINC000028272848 847402202 /nfs/dbraw/zinc/40/22/02/847402202.db2.gz MGYBDNBFTFDTFH-UHFFFAOYSA-N 0 3 419.525 4.265 20 0 HIADHN CC[C@H](CNC(=O)N[C@@H](c1ccccc1)c1ccccn1)N1CCc2ccccc2C1 ZINC000028392903 847414669 /nfs/dbraw/zinc/41/46/69/847414669.db2.gz KSXHLMOGIWPJOZ-NOZRDPDXSA-N 0 3 414.553 4.307 20 0 HIADHN O=C(NCCCCN1CCN(c2cccc(C(F)(F)F)c2)CC1)c1cccs1 ZINC000029166255 847518255 /nfs/dbraw/zinc/51/82/55/847518255.db2.gz HTLHCYQNKBNXLP-UHFFFAOYSA-N 0 3 411.493 4.099 20 0 HIADHN Cc1noc2nc(C3CC3)cc(C(=O)NC[C@@H](C(C)C)N3CCc4ccccc4C3)c12 ZINC000029174396 847520647 /nfs/dbraw/zinc/52/06/47/847520647.db2.gz UHMVEZDPKAEAGN-QFIPXVFZSA-N 0 3 418.541 4.221 20 0 HIADHN Cc1ccc(C(=O)NC[C@@H](c2ccccc2)N(C)C)cc1NC(=O)c1ccccc1 ZINC000029256389 847531637 /nfs/dbraw/zinc/53/16/37/847531637.db2.gz ZRSSOYNFRYDIAF-QHCPKHFHSA-N 0 3 401.510 4.280 20 0 HIADHN CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H](c2ccccc2)c2ccc(C)cc2)cc1 ZINC000029700993 847602213 /nfs/dbraw/zinc/60/22/13/847602213.db2.gz XHHGIPHQYBTOHL-ZCYQVOJMSA-N 0 3 404.510 4.072 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)c1ccc(OCc2ccncc2)cc1 ZINC000029754982 847613137 /nfs/dbraw/zinc/61/31/37/847613137.db2.gz NEQVISUJVRXYCN-XMMPIXPASA-N 0 3 401.510 4.228 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cnn(-c4cccc(Cl)c4)c3C)cc2)CC1 ZINC000029799038 847621787 /nfs/dbraw/zinc/62/17/87/847621787.db2.gz AVIZBSSEZRJBOY-UHFFFAOYSA-N 0 3 423.948 4.228 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Cc3nc(-c4ccccc4)oc3C)c(C)c2)CC1 ZINC000029962370 847660101 /nfs/dbraw/zinc/66/01/01/847660101.db2.gz DQSOQXUMJNBBKS-UHFFFAOYSA-N 0 3 418.541 4.282 20 0 HIADHN O=C(NC1CCN(Cc2ccc(-c3ccc(Br)cc3)o2)CC1)C1CC1 ZINC000030279984 847697569 /nfs/dbraw/zinc/69/75/69/847697569.db2.gz PVYUKSUHEJZLOV-UHFFFAOYSA-N 0 3 403.320 4.200 20 0 HIADHN O=S(=O)(NC1CCN(CCc2ccccc2)CC1)c1ccccc1-c1ccccc1 ZINC000030380991 847708428 /nfs/dbraw/zinc/70/84/28/847708428.db2.gz PDDHPNHUQRCGLI-UHFFFAOYSA-N 0 3 420.578 4.339 20 0 HIADHN c1cn(Cc2cccc(CNCc3cn(-c4ccccc4)nc3-c3ccncc3)c2)cn1 ZINC000030901973 847795710 /nfs/dbraw/zinc/79/57/10/847795710.db2.gz BAYRAOLOJVTHKO-UHFFFAOYSA-N 0 3 420.520 4.469 20 0 HIADHN COc1cc(CNCc2cccnc2-n2cccn2)ccc1OCc1ccccc1 ZINC000030902106 847796091 /nfs/dbraw/zinc/79/60/91/847796091.db2.gz VCBFBXLTZWEBLW-UHFFFAOYSA-N 0 3 400.482 4.145 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCc1ccc(NC(=O)C(C)C)cc1)c1ccsc1 ZINC000031097203 847822032 /nfs/dbraw/zinc/82/20/32/847822032.db2.gz IBCZQPAYUNPWQW-FQEVSTJZSA-N 0 3 416.591 4.225 20 0 HIADHN CC1CCN([C@H](CNC(=O)NCc2ccc(N(C)C)cc2)c2cccs2)CC1 ZINC000031726850 847939103 /nfs/dbraw/zinc/93/91/03/847939103.db2.gz YSVRRVSQDQMCKZ-HXUWFJFHSA-N 0 3 400.592 4.087 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)[C@@H](NC(=O)c1cccc(C)c1)C(C)C)c1ccsc1 ZINC000031987746 847976009 /nfs/dbraw/zinc/97/60/09/847976009.db2.gz DSXINAGOGQOVHK-SFTDATJTSA-N 0 3 415.603 4.010 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Cc3ccc(-n4cccc4)cc3)c(C)c2)CC1 ZINC000032235485 847992154 /nfs/dbraw/zinc/99/21/54/847992154.db2.gz TXNFHZJZETVUPF-UHFFFAOYSA-N 0 3 402.542 4.109 20 0 HIADHN CC[C@H](CNC(=O)Cc1csc(-c2cccs2)n1)N1CCc2ccccc2C1 ZINC000032446926 848028674 /nfs/dbraw/zinc/02/86/74/848028674.db2.gz IAOJGRPSVGUPLE-LJQANCHMSA-N 0 3 411.596 4.367 20 0 HIADHN CC[NH+](CC)CCOC1CCN(C(=O)c2cc(CCc3ccccc3)ccc2[O-])CC1 ZINC000436575647 861857874 /nfs/dbraw/zinc/85/78/74/861857874.db2.gz OQADBXVPDADERR-UHFFFAOYSA-N 0 3 424.585 4.140 20 0 HIADHN Cc1ccc(C(=O)N(C[C@H]2CC[N@H+](Cc3ccccc3)C2)CC(F)(F)F)c([O-])c1 ZINC000436578327 861858673 /nfs/dbraw/zinc/85/86/73/861858673.db2.gz WJWHWDKGDWOKME-SFHVURJKSA-N 0 3 406.448 4.227 20 0 HIADHN Cc1ccc(C(=O)N(C[C@H]2CC[N@@H+](Cc3ccccc3)C2)CC(F)(F)F)c([O-])c1 ZINC000436578327 861858678 /nfs/dbraw/zinc/85/86/78/861858678.db2.gz WJWHWDKGDWOKME-SFHVURJKSA-N 0 3 406.448 4.227 20 0 HIADHN O=C(CCCc1ncc(-c2ccccc2)o1)NCCCN1CCc2ccccc2C1 ZINC000032649477 848059810 /nfs/dbraw/zinc/05/98/10/848059810.db2.gz OFUUKDUPQAKBAA-UHFFFAOYSA-N 0 3 403.526 4.229 20 0 HIADHN Cc1nn(Cc2ccccc2Cl)c(Cl)c1C(=O)N[C@H](C)CN1CCCCC1 ZINC000032662590 848060294 /nfs/dbraw/zinc/06/02/94/848060294.db2.gz DYIHVHZKZFQCCE-CQSZACIVSA-N 0 3 409.361 4.151 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)c2cc(OC)ccc2Br)N(C)C)cc1 ZINC000032732975 848069437 /nfs/dbraw/zinc/06/94/37/848069437.db2.gz HNMDYYDCTYXWNC-LJQANCHMSA-N 0 3 405.336 4.053 20 0 HIADHN CCc1ccc([C@H](CNC(=O)c2cnn(-c3ccc(F)cc3F)c2C)N(C)C)cc1 ZINC000032735009 848069908 /nfs/dbraw/zinc/06/99/08/848069908.db2.gz RIRTYSXZVSBORQ-QFIPXVFZSA-N 0 3 412.484 4.054 20 0 HIADHN O=C(Cc1csc(-c2cccs2)n1)NC[C@H](c1cccs1)N1CCCC1 ZINC000032762019 848072912 /nfs/dbraw/zinc/07/29/12/848072912.db2.gz YVYXJXDWKIDVPH-OAHLLOKOSA-N 0 3 403.598 4.429 20 0 HIADHN C[C@H](OC[C@@H](O)CN1CCC[C@@H]1c1ccc2c(c1)OCCO2)c1ccc(Cl)cc1 ZINC000032769084 848074192 /nfs/dbraw/zinc/07/41/92/848074192.db2.gz DBMRNOUGBYIQNM-ORYQWCPZSA-N 0 3 417.933 4.387 20 0 HIADHN Cc1nn(C)c(Cl)c1CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000033987995 848140605 /nfs/dbraw/zinc/14/06/05/848140605.db2.gz HQIGUTCZSPCHGB-UHFFFAOYSA-N 0 3 401.769 4.443 20 0 HIADHN CCOc1c(Br)cc(Br)cc1CNCCc1ccccn1 ZINC000034991253 848143316 /nfs/dbraw/zinc/14/33/16/848143316.db2.gz POOYLVHJZVNBPL-UHFFFAOYSA-N 0 3 414.141 4.338 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)c1cc(C2CC2)nn1-c1ccccc1 ZINC000036659964 848153213 /nfs/dbraw/zinc/15/32/13/848153213.db2.gz YIQULXGCMVROKT-DEOSSOPVSA-N 0 3 400.526 4.317 20 0 HIADHN O=C(Cn1c2ccccc2nc1C(F)(F)F)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000036883686 848171835 /nfs/dbraw/zinc/17/18/35/848171835.db2.gz FFABEOMSKXMQKG-IBGZPJMESA-N 0 3 416.447 4.008 20 0 HIADHN CN(C)c1ccc([C@H](CNC(=O)C(c2ccccc2)c2ccccc2)N(C)C)cc1 ZINC000038635284 848179415 /nfs/dbraw/zinc/17/94/15/848179415.db2.gz XWVAHDBAHPFILL-DEOSSOPVSA-N 0 3 401.554 4.304 20 0 HIADHN N#CC(C(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1nc2ccccc2[nH]1 ZINC000041495919 848221396 /nfs/dbraw/zinc/22/13/96/848221396.db2.gz JTIQCYSFYGQLMH-LBPRGKRZSA-N 0 3 417.347 4.168 20 0 HIADHN N#CC(C(=O)C[C@H](NC(=O)c1ccccc1)c1ccccc1)c1nc2ccccc2[nH]1 ZINC000041497896 848221970 /nfs/dbraw/zinc/22/19/70/848221970.db2.gz LNJCLLIBTMJKMI-UGKGYDQZSA-N 0 3 408.461 4.301 20 0 HIADHN Cc1ccc(-n2cnnc2SCC(=O)C(C#N)c2nc3ccccc3s2)cc1 ZINC000041500611 848222871 /nfs/dbraw/zinc/22/28/71/848222871.db2.gz HUPVHQPPRQRNNQ-HNNXBMFYSA-N 0 3 405.508 4.154 20 0 HIADHN Cc1cc(CSc2ccccc2C(=O)NC[C@H](Cc2ccccc2)N(C)C)on1 ZINC000041799400 848252379 /nfs/dbraw/zinc/25/23/79/848252379.db2.gz QZMVMBLWUBUGOY-IBGZPJMESA-N 0 3 409.555 4.178 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCc1coc(-c2cccs2)n1)c1ccsc1 ZINC000042346043 848319487 /nfs/dbraw/zinc/31/94/87/848319487.db2.gz YSXTULYGWCJCOQ-INIZCTEOSA-N 0 3 404.561 4.347 20 0 HIADHN COc1ccc(NC(C)=O)cc1NC(=O)[C@H](C)N[C@@H](C)c1cccc2ccccc21 ZINC000042636677 848335468 /nfs/dbraw/zinc/33/54/68/848335468.db2.gz LKZUIUYDNBSIAC-HOTGVXAUSA-N 0 3 405.498 4.485 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)N1CCC(c2nc3ccccc3[nH]2)CC1 ZINC000042813078 848356653 /nfs/dbraw/zinc/35/66/53/848356653.db2.gz PGSQXSRPGCUURX-HSZRJFAPSA-N 0 3 417.557 4.289 20 0 HIADHN CC(C)[C@H](NC(=O)NC[C@@H](c1cccs1)N1CCCC1)c1nc2ccccc2[nH]1 ZINC000043107346 848385289 /nfs/dbraw/zinc/38/52/89/848385289.db2.gz GVRALBWLNQYFSI-ICSRJNTNSA-N 0 3 411.575 4.458 20 0 HIADHN O=C(NCc1cc(Br)cs1)NC[C@@H](c1cccs1)N1CCCC1 ZINC000043231504 848397325 /nfs/dbraw/zinc/39/73/25/848397325.db2.gz QLXJIPXSVPQBGN-AWEZNQCLSA-N 0 3 414.394 4.208 20 0 HIADHN CCOc1ccccc1NC(=O)NCCCCN1CCN(c2cccc(C)c2)CC1 ZINC000043332675 848411450 /nfs/dbraw/zinc/41/14/50/848411450.db2.gz DXOBECRXNIBMSI-UHFFFAOYSA-N 0 3 410.562 4.118 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)Nc1nc(CN2CCCCC2)cs1 ZINC000043517559 848434423 /nfs/dbraw/zinc/43/44/23/848434423.db2.gz XCHXFYKKXROJPQ-FQEVSTJZSA-N 0 3 413.591 4.088 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N(C)Cc3ccc(F)cc3F)c(C)c2)CC1 ZINC000043522369 848434751 /nfs/dbraw/zinc/43/47/51/848434751.db2.gz HHGONILLBWDJME-UHFFFAOYSA-N 0 3 402.489 4.079 20 0 HIADHN CC[C@@H](NC(=O)Nc1ccc(N2CCN(CC)CC2)cc1C)c1ccccc1OC ZINC000043521980 848434769 /nfs/dbraw/zinc/43/47/69/848434769.db2.gz SUQCAQFJUKIHBZ-OAQYLSRUSA-N 0 3 410.562 4.418 20 0 HIADHN Cc1ccc(-c2cnc(CCC(=O)N3c4ccccc4CC[C@H]3CN(C)C)o2)cc1 ZINC000436727047 861910743 /nfs/dbraw/zinc/91/07/43/861910743.db2.gz XUKYSVQLMLKFBN-NRFANRHFSA-N 0 3 403.526 4.492 20 0 HIADHN CN(C)CCN(Cc1ccc(C#N)cc1)C(=S)Nc1cccc(C(F)(F)F)c1 ZINC000044158270 848524379 /nfs/dbraw/zinc/52/43/79/848524379.db2.gz BPEBONPATGBIIX-UHFFFAOYSA-N 0 3 406.477 4.338 20 0 HIADHN CNC(=O)c1cccc(NC(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)c1C ZINC000044177444 848527079 /nfs/dbraw/zinc/52/70/79/848527079.db2.gz DDDQBHMTZQGEKD-LJQANCHMSA-N 0 3 414.575 4.011 20 0 HIADHN CCN(Cc1cccc(NC(=O)NC[C@@H](c2ccccc2)N2CCCC2)c1)C(C)=O ZINC000044381020 848554290 /nfs/dbraw/zinc/55/42/90/848554290.db2.gz BISKBQGBUWBUGZ-QHCPKHFHSA-N 0 3 408.546 4.014 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@H](C)c1nc2ccccc2[nH]1)c1cccc(OC)c1 ZINC000045595662 848698035 /nfs/dbraw/zinc/69/80/35/848698035.db2.gz GSDNTYPSMNGPOG-IIBYNOLFSA-N 0 3 409.534 4.015 20 0 HIADHN CCNC(=O)COc1ccc(CN[C@@H](C)c2ccc(C(F)(F)F)cc2)cc1OC ZINC000045822594 848735931 /nfs/dbraw/zinc/73/59/31/848735931.db2.gz BSKRUJKXBRCKIQ-AWEZNQCLSA-N 0 3 410.436 4.080 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N(C)CC(=O)Nc1cccc(C)c1C)c1ccsc1 ZINC000046252769 848811834 /nfs/dbraw/zinc/81/18/34/848811834.db2.gz OVFDSJNAKATLJF-FQEVSTJZSA-N 0 3 416.591 4.028 20 0 HIADHN O=C(CCN1CCN(Cc2cccc3cccnc32)CC1)Nc1ccccc1Cl ZINC000046509800 848864223 /nfs/dbraw/zinc/86/42/23/848864223.db2.gz KDKLHOKBOYXFEO-UHFFFAOYSA-N 0 3 408.933 4.035 20 0 HIADHN C[C@H](NC(=O)N1CCCN(Cc2ccccc2)CC1)c1ccc(OC(F)F)cc1 ZINC000046613123 848887024 /nfs/dbraw/zinc/88/70/24/848887024.db2.gz OTLXGAPHDJIEQR-KRWDZBQOSA-N 0 3 403.473 4.267 20 0 HIADHN COc1cc(-c2noc(CCCCCN[C@H](C)c3csc(C)n3)n2)ccc1O ZINC000436764324 861954509 /nfs/dbraw/zinc/95/45/09/861954509.db2.gz QLAWTFFRHGCWSO-CYBMUJFWSA-N 0 3 402.520 4.279 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cnn(-c2ccccc2)c1C)c1cccc(OC)c1 ZINC000046729504 848920792 /nfs/dbraw/zinc/92/07/92/848920792.db2.gz PYLMIBMMKVCCJY-HSZRJFAPSA-N 0 3 406.530 4.002 20 0 HIADHN O=C(Nc1ccccc1)c1ccc(CN2CCC[C@H](C(=O)Nc3ccccn3)C2)cc1 ZINC000047259998 849015724 /nfs/dbraw/zinc/01/57/24/849015724.db2.gz IAVVRQMIMISDIC-NRFANRHFSA-N 0 3 414.509 4.185 20 0 HIADHN N#CC(C(=O)C1CCN(C(=O)/C=C/c2ccccc2)CC1)c1ccc2ccccc2n1 ZINC000047376882 849035024 /nfs/dbraw/zinc/03/50/24/849035024.db2.gz OWHGHLSBMQTTCW-FLSMSTFGSA-N 0 3 409.489 4.363 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)NCc3cccc(Cl)c3)CC2)c1 ZINC000047616875 849085680 /nfs/dbraw/zinc/08/56/80/849085680.db2.gz JXZJZWPTLUYBAT-UHFFFAOYSA-N 0 3 414.981 4.050 20 0 HIADHN Cc1ccccc1CN1CCCN(C(=O)Nc2ccc(OC(F)F)c(F)c2)CC1 ZINC000047714337 849095492 /nfs/dbraw/zinc/09/54/92/849095492.db2.gz FSKFBVKWIGDUFK-UHFFFAOYSA-N 0 3 407.436 4.475 20 0 HIADHN Cc1ccc(COc2ccc(CNCc3ccc(NS(C)(=O)=O)cc3)cc2)cc1 ZINC000047750651 849104062 /nfs/dbraw/zinc/10/40/62/849104062.db2.gz HKKOYVDZNQRPEJ-UHFFFAOYSA-N 0 3 410.539 4.235 20 0 HIADHN COCCOc1ccc(NC(=O)N2CCCN(Cc3ccccc3C)CC2)c(C)c1 ZINC000047761857 849106936 /nfs/dbraw/zinc/10/69/36/849106936.db2.gz XFLWKJULGSMAMW-UHFFFAOYSA-N 0 3 411.546 4.068 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)NC[C@H](c1ccco1)N1CCCCC1 ZINC000047777565 849109495 /nfs/dbraw/zinc/10/94/95/849109495.db2.gz PMKQBBFCPCYNNA-RTBURBONSA-N 0 3 416.591 4.004 20 0 HIADHN CN(C)S(=O)(=O)c1ccc(CNCc2ccc(-c3ccc(F)cc3)s2)cc1 ZINC000047771023 849110137 /nfs/dbraw/zinc/11/01/37/849110137.db2.gz NQZXVBBXXZUAKS-UHFFFAOYSA-N 0 3 404.532 4.094 20 0 HIADHN CCC(C)(C)NC(=O)c1ccc(NC(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000047811261 849120417 /nfs/dbraw/zinc/12/04/17/849120417.db2.gz ZAWBKVJXHAYRSF-NRFANRHFSA-N 0 3 408.546 4.001 20 0 HIADHN COc1ccc(OC(F)F)c(NC(=O)NC[C@H](c2ccccc2)N2CCCC2)c1 ZINC000047921068 849138483 /nfs/dbraw/zinc/13/84/83/849138483.db2.gz MAKGOTGMRLNDDP-GOSISDBHSA-N 0 3 405.445 4.255 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)Nc1ccc(N2CCCC2)c(F)c1 ZINC000048138254 849175520 /nfs/dbraw/zinc/17/55/20/849175520.db2.gz IGMVZLWYTQHAKS-IBGZPJMESA-N 0 3 402.539 4.446 20 0 HIADHN CCC(=O)Nc1ccc(C)c(NC(=O)N2CCCN(Cc3ccccc3C)CC2)c1 ZINC000048256903 849199772 /nfs/dbraw/zinc/19/97/72/849199772.db2.gz JBNCXXLBMSETLM-UHFFFAOYSA-N 0 3 408.546 4.392 20 0 HIADHN O=C(CCc1ccccc1Br)N1CCCN(Cc2ccccc2)CC1 ZINC000048346183 849209532 /nfs/dbraw/zinc/20/95/32/849209532.db2.gz DJLJQWDIAIBPSQ-UHFFFAOYSA-N 0 3 401.348 4.116 20 0 HIADHN CC(C)[C@H](NC(=O)OCc1ccccc1)C(=O)C(C#N)c1nc2ccccc2s1 ZINC000048822795 849271205 /nfs/dbraw/zinc/27/12/05/849271205.db2.gz NDLAZPOKSMGHRR-APWZRJJASA-N 0 3 407.495 4.424 20 0 HIADHN Cc1cc([C@@H]2CCCN2C(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)on1 ZINC000049790443 849329575 /nfs/dbraw/zinc/32/95/75/849329575.db2.gz OYZBXCJUXIXDST-ZWKOTPCHSA-N 0 3 402.564 4.364 20 0 HIADHN C#CCN1CCC(C(=O)NC[C@@H](c2c[nH]c3ccccc32)c2ccccc2Cl)CC1 ZINC000050027430 849343533 /nfs/dbraw/zinc/34/35/33/849343533.db2.gz PUZLYALJLCURJQ-OAQYLSRUSA-N 0 3 419.956 4.415 20 0 HIADHN CC[C@H]([NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1)c1ccc(OC(F)F)cc1 ZINC000436827429 862007332 /nfs/dbraw/zinc/00/73/32/862007332.db2.gz JTUKUPPWYVVZDU-IBGZPJMESA-N 0 3 404.457 4.339 20 0 HIADHN Cc1nc(C(C)(C)C)sc1[C@H](C)[NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1 ZINC000436829867 862009592 /nfs/dbraw/zinc/00/95/92/862009592.db2.gz PRXVCZFZYOGBSC-AWEZNQCLSA-N 0 3 401.576 4.410 20 0 HIADHN C[C@@H]([NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1)c1ccccc1OC(F)(F)F ZINC000436831906 862011961 /nfs/dbraw/zinc/01/19/61/862011961.db2.gz UNHURWCTTWRBNV-CQSZACIVSA-N 0 3 408.420 4.246 20 0 HIADHN C[C@@H]([NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1)[C@H](C)c1nc2ccccc2s1 ZINC000436833779 862014584 /nfs/dbraw/zinc/01/45/84/862014584.db2.gz ZADBQSAKOXBXFG-JKSUJKDBSA-N 0 3 409.555 4.388 20 0 HIADHN COc1ccc(CN(C)C[C@@H](O)c2ccc(C(F)(F)F)cc2)cc1OC(F)F ZINC000051323764 849458246 /nfs/dbraw/zinc/45/82/46/849458246.db2.gz HBTDVBPNRSRQEH-OAHLLOKOSA-N 0 3 405.363 4.481 20 0 HIADHN CSc1ccc(CN(C)C(=O)CN(C)C[C@@H]2CCCO[C@@H]2c2ccccc2)cc1 ZINC000051582027 849485653 /nfs/dbraw/zinc/48/56/53/849485653.db2.gz LKFXMENTMHHOGR-XUZZJYLKSA-N 0 3 412.599 4.467 20 0 HIADHN COc1ccc(C(=O)NC[C@@H]2CCC[N@H+](C)[C@@H]2c2ccc(C(F)(F)F)cc2)c([O-])c1 ZINC000436848523 862026545 /nfs/dbraw/zinc/02/65/45/862026545.db2.gz AJFGZLMIEQQXSA-MGPUTAFESA-N 0 3 422.447 4.233 20 0 HIADHN COc1ccc(C(=O)NC[C@@H]2CCC[N@@H+](C)[C@@H]2c2ccc(C(F)(F)F)cc2)c([O-])c1 ZINC000436848523 862026561 /nfs/dbraw/zinc/02/65/61/862026561.db2.gz AJFGZLMIEQQXSA-MGPUTAFESA-N 0 3 422.447 4.233 20 0 HIADHN CC[C@@H](CNC(=O)c1ccc(-n2cc[nH]c2=S)cc1)N1CCc2ccccc2C1 ZINC000052591425 849600309 /nfs/dbraw/zinc/60/03/09/849600309.db2.gz NHDGUVAJFHGIGQ-FQEVSTJZSA-N 0 3 406.555 4.102 20 0 HIADHN COc1ccc([C@H](CNC(=O)N[C@H](C)c2ccc(OC)c(F)c2)N2CCCC2)cc1 ZINC000052710647 849615635 /nfs/dbraw/zinc/61/56/35/849615635.db2.gz SENGZOLJMPSWRE-IERDGZPVSA-N 0 3 415.509 4.040 20 0 HIADHN CC(C)CN(C(=O)COc1ccc(Br)cc1Cl)C1CCN(C)CC1 ZINC000053222597 849681382 /nfs/dbraw/zinc/68/13/82/849681382.db2.gz GMVZNIOMORICAH-UHFFFAOYSA-N 0 3 417.775 4.060 20 0 HIADHN CC(C)CN(C(=O)c1nc(-c2ccccc2)n2c1CCCCC2)C1CCN(C)CC1 ZINC000053232607 849682126 /nfs/dbraw/zinc/68/21/26/849682126.db2.gz BOCDCPXVTPXHOH-UHFFFAOYSA-N 0 3 408.590 4.469 20 0 HIADHN Cc1ccc(O[C@@H](C)C(=O)N(CC(C)C)C2CCN(C)CC2)c(Br)c1 ZINC000053232845 849682801 /nfs/dbraw/zinc/68/28/01/849682801.db2.gz UBLPSFPNOZVHFY-INIZCTEOSA-N 0 3 411.384 4.104 20 0 HIADHN O=C(CSc1ccc(C(F)(F)F)cn1)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000053372713 849701271 /nfs/dbraw/zinc/70/12/71/849701271.db2.gz CFRXLYDWSUKHET-KRWDZBQOSA-N 0 3 409.477 4.146 20 0 HIADHN CN(C)Cc1ccccc1NC(=O)[C@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O ZINC000053476468 849718047 /nfs/dbraw/zinc/71/80/47/849718047.db2.gz DFTMIAMLRCQIGO-OAHLLOKOSA-N 0 3 406.313 4.047 20 0 HIADHN NC(=O)C1CCN(Cc2cccc(NC(=O)c3cc4cc(Cl)ccc4o3)c2)CC1 ZINC000053996724 849791277 /nfs/dbraw/zinc/79/12/77/849791277.db2.gz URNRHXCVYKBPDI-UHFFFAOYSA-N 0 3 411.889 4.036 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)Cn2c3ccccc3nc2C(F)(F)F)C1 ZINC000054227168 849828925 /nfs/dbraw/zinc/82/89/25/849828925.db2.gz DIWCJWGCHJEESW-WBVHZDCISA-N 0 3 416.447 4.007 20 0 HIADHN CC(C)CNC(=O)c1ccc(NC(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)cc1 ZINC000054437111 849867063 /nfs/dbraw/zinc/86/70/63/849867063.db2.gz CWAMKEXQMIVQHO-PGRDOPGGSA-N 0 3 408.546 4.029 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)Nc2cccc(C(=O)NC(C)(C)C)c2)C1 ZINC000054434952 849867503 /nfs/dbraw/zinc/86/75/03/849867503.db2.gz DSEDQVKRORPUID-UWJYYQICSA-N 0 3 408.546 4.172 20 0 HIADHN CCOC(=O)N(C)c1ccc(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2)cc1 ZINC000054530028 849885237 /nfs/dbraw/zinc/88/52/37/849885237.db2.gz JSDRHJUUMIOJSE-UHFFFAOYSA-N 0 3 416.497 4.014 20 0 HIADHN O=C(CCCc1c[nH]c2ccccc12)NCCCCN1CCN(c2ccccc2)CC1 ZINC000054573929 849890649 /nfs/dbraw/zinc/89/06/49/849890649.db2.gz UGWHSPIAUKXLTM-UHFFFAOYSA-N 0 3 418.585 4.209 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N2CCC(OCc3ccccc3)CC2)C1 ZINC000054718644 849912028 /nfs/dbraw/zinc/91/20/28/849912028.db2.gz KBHABCHJQXDZBI-OFNKIYASSA-N 0 3 407.558 4.213 20 0 HIADHN CCN(Cc1ccc(OC)c(OC)c1)C(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000054717171 849912123 /nfs/dbraw/zinc/91/21/23/849912123.db2.gz XNHHAGOIGONCLS-RXVVDRJESA-N 0 3 411.546 4.071 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)N2CCC(OCc3ccccc3)CC2)C1 ZINC000054718643 849912189 /nfs/dbraw/zinc/91/21/89/849912189.db2.gz KBHABCHJQXDZBI-REWPJTCUSA-N 0 3 407.558 4.213 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=S)NCCSc2ccc(Cl)cc2)o1 ZINC000054974488 849949521 /nfs/dbraw/zinc/94/95/21/849949521.db2.gz SYZHKLRSSNDIPK-UHFFFAOYSA-N 0 3 412.024 4.272 20 0 HIADHN O=C(Nc1ccccc1)NC1CCN(C[C@@H](O)c2ccc(C(F)(F)F)cc2)CC1 ZINC000055032655 849959317 /nfs/dbraw/zinc/95/93/17/849959317.db2.gz CUTJPPLQIUZUAO-LJQANCHMSA-N 0 3 407.436 4.025 20 0 HIADHN O=C(Nc1ccccc1)NC1CCN(CCCc2nc(-c3cccs3)no2)CC1 ZINC000055031351 849959796 /nfs/dbraw/zinc/95/97/96/849959796.db2.gz VKKSCKYASIVWHJ-UHFFFAOYSA-N 0 3 411.531 4.017 20 0 HIADHN CN(C)S(=O)(=O)c1ccc(CNCc2ccc(F)c(-c3cccs3)c2)cc1 ZINC000055171309 849980836 /nfs/dbraw/zinc/98/08/36/849980836.db2.gz OCDWUDUUGZCNRH-UHFFFAOYSA-N 0 3 404.532 4.094 20 0 HIADHN Cc1cc(NC(=O)c2cccc(F)c2)sc1C(=O)NC[C@H](C)N1CCCC[C@@H]1C ZINC000055362507 850006884 /nfs/dbraw/zinc/00/68/84/850006884.db2.gz XIZNXFAFCYAGAC-HOTGVXAUSA-N 0 3 417.550 4.441 20 0 HIADHN CC(C)(C)CCN1CCN(CC(=O)Nc2ccc(N3CCCCCC3)cc2)CC1 ZINC000055934807 850210176 /nfs/dbraw/zinc/21/01/76/850210176.db2.gz KNBAUCUTAYHJJZ-UHFFFAOYSA-N 0 3 400.611 4.059 20 0 HIADHN COc1cc(-c2nc(CN3CCC(c4ncc5n4CCCC5)CC3)cs2)ccc1O ZINC000436927559 862107960 /nfs/dbraw/zinc/10/79/60/862107960.db2.gz SEYLGWCTIZYNLU-UHFFFAOYSA-N 0 3 424.570 4.437 20 0 HIADHN Cc1c([O-])ccc2c(CNCc3ccccc3C[N@H+]3CCC[C@H](C)C3)cc(=O)oc12 ZINC000056156174 850261292 /nfs/dbraw/zinc/26/12/92/850261292.db2.gz DSZBGOCTIGOPLW-KRWDZBQOSA-N 0 3 406.526 4.329 20 0 HIADHN Cc1c([O-])ccc2c(CNCc3ccccc3C[N@@H+]3CCC[C@H](C)C3)cc(=O)oc12 ZINC000056156174 850261304 /nfs/dbraw/zinc/26/13/04/850261304.db2.gz DSZBGOCTIGOPLW-KRWDZBQOSA-N 0 3 406.526 4.329 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)c2cnn(C(C)(C)C)c2C(F)(F)F)C1 ZINC000056168669 850268896 /nfs/dbraw/zinc/26/88/96/850268896.db2.gz BKPIMLAOHFIWOD-HOCLYGCPSA-N 0 3 408.468 4.222 20 0 HIADHN O=C(c1ccccc1[O-])N1CCC([NH2+]C2c3ccccc3CCc3ccccc32)CC1 ZINC000436946409 862122892 /nfs/dbraw/zinc/12/28/92/862122892.db2.gz ITQVHPHKRHGLDC-UHFFFAOYSA-N 0 3 412.533 4.475 20 0 HIADHN CCOc1ccc(C2(CNC(=O)Nc3cccc(CN(C)C)c3)CCOCC2)cc1 ZINC000056621308 850417755 /nfs/dbraw/zinc/41/77/55/850417755.db2.gz VTOPTERRQJIWQN-UHFFFAOYSA-N 0 3 411.546 4.017 20 0 HIADHN CC[C@@H](CNC(=O)Nc1cc(NC(C)=O)ccc1Cl)N1CCc2ccccc2C1 ZINC000056692610 850441603 /nfs/dbraw/zinc/44/16/03/850441603.db2.gz IYYBNHRIQVVVGP-IBGZPJMESA-N 0 3 414.937 4.257 20 0 HIADHN CC[C@H](CNC(=O)Nc1cc(NC(C)=O)ccc1Cl)N1CCc2ccccc2C1 ZINC000056692611 850442135 /nfs/dbraw/zinc/44/21/35/850442135.db2.gz IYYBNHRIQVVVGP-LJQANCHMSA-N 0 3 414.937 4.257 20 0 HIADHN Cc1nc(-c2cccc(NC(=O)NCC3(N4CCSCC4)CCCC3)c2)oc1C ZINC000056731544 850456548 /nfs/dbraw/zinc/45/65/48/850456548.db2.gz CZNNUIVQYFSXAN-UHFFFAOYSA-N 0 3 414.575 4.442 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)N[C@@H]1CCOc2c(Cl)cccc21 ZINC000056806262 850490110 /nfs/dbraw/zinc/49/01/10/850490110.db2.gz HVLWJUDBLMEWRX-LJQANCHMSA-N 0 3 405.901 4.076 20 0 HIADHN C[C@H](NC(=O)N(CCN(C)C)Cc1ccc(F)cc1)c1cccc(OC(F)F)c1 ZINC000056866505 850505518 /nfs/dbraw/zinc/50/55/18/850505518.db2.gz NKXWFJXNRSWKON-HNNXBMFYSA-N 0 3 409.452 4.262 20 0 HIADHN C[C@@H](NC(=O)N(CCN(C)C)Cc1ccc(F)cc1)c1cccc(OC(F)F)c1 ZINC000056866506 850505621 /nfs/dbraw/zinc/50/56/21/850505621.db2.gz NKXWFJXNRSWKON-OAHLLOKOSA-N 0 3 409.452 4.262 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)Nc1ccc(F)cc1Br ZINC000057757671 850709623 /nfs/dbraw/zinc/70/96/23/850709623.db2.gz QNRSRBWBHAAOMZ-UHFFFAOYSA-N 0 3 406.299 4.158 20 0 HIADHN CN(C)CCN(C(=O)c1ccc2c(c1)C[C@@H](c1ccccc1)OC2=O)c1ccccc1 ZINC000058297776 850796446 /nfs/dbraw/zinc/79/64/46/850796446.db2.gz WUUAMFWVSLWSNM-DEOSSOPVSA-N 0 3 414.505 4.349 20 0 HIADHN S=C(NCc1sccc1Br)NC1CCN(Cc2ccccc2)CC1 ZINC000058468471 850832676 /nfs/dbraw/zinc/83/26/76/850832676.db2.gz VOMCYKBNPBMEIT-UHFFFAOYSA-N 0 3 424.433 4.139 20 0 HIADHN CCN1CCN(CCNc2nc(C3CC3)nc3scc(-c4ccccc4)c32)CC1 ZINC000058542033 850851145 /nfs/dbraw/zinc/85/11/45/850851145.db2.gz LEAFMBJPFHEXJV-UHFFFAOYSA-N 0 3 407.587 4.285 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)Nc2cccc(C)c2C(=O)N2CCCC2)N(C)C)cc1 ZINC000058550978 850853938 /nfs/dbraw/zinc/85/39/38/850853938.db2.gz OFUBJGSKILTTNO-JOCHJYFZSA-N 0 3 422.573 4.218 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)C3(c4ccc(OC)cc4)CCCC3)cc2)CC1 ZINC000058805782 850932497 /nfs/dbraw/zinc/93/24/97/850932497.db2.gz OLBZBKQCJLIVDF-UHFFFAOYSA-N 0 3 421.585 4.283 20 0 HIADHN COc1ccccc1-c1nc(C(=O)N(CCN(C)C)Cc2cccc(F)c2)cs1 ZINC000058880067 850950096 /nfs/dbraw/zinc/95/00/96/850950096.db2.gz RKULHUIRBNWPPU-UHFFFAOYSA-N 0 3 413.518 4.162 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)CCSc3ccc(F)cc3)cc2)CC1 ZINC000058954361 850968242 /nfs/dbraw/zinc/96/82/42/850968242.db2.gz ICQRKWFKPWJLMP-UHFFFAOYSA-N 0 3 401.551 4.084 20 0 HIADHN O=C(NCCN1CCCCC1)c1cccnc1Sc1ccc(Br)cc1 ZINC000058980246 850971349 /nfs/dbraw/zinc/97/13/49/850971349.db2.gz OQRNDFJHOKDANG-UHFFFAOYSA-N 0 3 420.376 4.211 20 0 HIADHN CC1CCN([C@H](CNC(=O)N2CCC[C@@H]2c2cccn2C)c2cccs2)CC1 ZINC000059264378 850989404 /nfs/dbraw/zinc/98/94/04/850989404.db2.gz YNPBKQDMAPCHSF-WOJBJXKFSA-N 0 3 400.592 4.406 20 0 HIADHN COc1cc2c(cc1OC)CN(C(=O)CN(Cc1ccccc1)C1CCCCC1)CC2 ZINC000059350365 850999332 /nfs/dbraw/zinc/99/93/32/850999332.db2.gz GRCURYXJFABJCI-UHFFFAOYSA-N 0 3 422.569 4.423 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Cn2c3ccccc3nc2SC(F)F)N(C)C)cc1 ZINC000060155993 851046432 /nfs/dbraw/zinc/04/64/32/851046432.db2.gz BOBWIJVZOTXIIK-GOSISDBHSA-N 0 3 418.513 4.079 20 0 HIADHN Cc1cc(OCC(=O)Nc2ccc(CCN3CCSCC3)cc2)ccc1Cl ZINC000060221231 851053551 /nfs/dbraw/zinc/05/35/51/851053551.db2.gz OYSAPRPFPKATRK-UHFFFAOYSA-N 0 3 404.963 4.257 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)CCN(Cc1cccc(F)c1)C[C@@H]1CCCO1 ZINC000060269412 851056640 /nfs/dbraw/zinc/05/66/40/851056640.db2.gz QTDJUBYTRTYDGL-IBGZPJMESA-N 0 3 420.912 4.498 20 0 HIADHN CCCN(C(=O)c1ccc(-c2ccco2)[nH]c1=O)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000060351760 851072853 /nfs/dbraw/zinc/07/28/53/851072853.db2.gz HGTXKXRVOJHSFR-FQEVSTJZSA-N 0 3 419.525 4.152 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)c1cnc(Cc2ccc(F)cc2)s1 ZINC000060373127 851081946 /nfs/dbraw/zinc/08/19/46/851081946.db2.gz WVZGINYVCKJQKJ-UHFFFAOYSA-N 0 3 409.530 4.051 20 0 HIADHN O=C(Nc1cccc(I)c1)c1cccc(CN2CCCC2)c1 ZINC000060549959 851144213 /nfs/dbraw/zinc/14/42/13/851144213.db2.gz BPQUCAOASCNAIY-UHFFFAOYSA-N 0 3 406.267 4.139 20 0 HIADHN COc1cc(CN(C)C(=O)NC[C@@H](c2ccc(C)cc2)N(C)C)ccc1SC ZINC000060563737 851148049 /nfs/dbraw/zinc/14/80/49/851148049.db2.gz IHVGSOYHEOMRGB-IBGZPJMESA-N 0 3 401.576 4.170 20 0 HIADHN COc1ccc(C(C)(C)CNC(=O)N2CCCN(Cc3ccccc3C)CC2)cc1 ZINC000060576781 851153251 /nfs/dbraw/zinc/15/32/51/851153251.db2.gz VRQRLFISCRVHNP-UHFFFAOYSA-N 0 3 409.574 4.199 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(C)c1CNC[C@H](O)c1ccc(OC(F)(F)F)cc1 ZINC000060953010 851256719 /nfs/dbraw/zinc/25/67/19/851256719.db2.gz ZMAFNJMDKRDNCL-FQEVSTJZSA-N 0 3 423.410 4.350 20 0 HIADHN C[C@@H](NC(=O)NC[C@@H](c1ccccc1)N(C)C)c1ccc(OCc2cccnc2)cc1 ZINC000060954965 851258093 /nfs/dbraw/zinc/25/80/93/851258093.db2.gz VUUIFLUOMIWPKX-DVECYGJZSA-N 0 3 418.541 4.324 20 0 HIADHN COc1cc(Br)c(CNCCc2ccc(OC(F)F)cc2)cc1OC ZINC000061029674 851278295 /nfs/dbraw/zinc/27/82/95/851278295.db2.gz WYEBLXXIGJISMR-UHFFFAOYSA-N 0 3 416.262 4.400 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N(Cc3ccc(F)cc3F)C3CC3)cc2)CC1 ZINC000061138902 851302942 /nfs/dbraw/zinc/30/29/42/851302942.db2.gz HZYQATANJPVQAJ-UHFFFAOYSA-N 0 3 413.512 4.300 20 0 HIADHN CCn1c2ccccc2nc1[C@@H](C)NC(=O)c1ccc(N2CCN(C(C)C)CC2)cc1 ZINC000061199462 851316256 /nfs/dbraw/zinc/31/62/56/851316256.db2.gz YXOAANAWBJFNPE-LJQANCHMSA-N 0 3 419.573 4.078 20 0 HIADHN CCCC(=O)Nc1ccc(CNC(=O)NC[C@@H](c2ccc(CC)cc2)N(C)C)cc1 ZINC000061223001 851321233 /nfs/dbraw/zinc/32/12/33/851321233.db2.gz OIGGYHBXMDDUJU-QFIPXVFZSA-N 0 3 410.562 4.090 20 0 HIADHN O=C(CCCOc1ccc(F)cc1F)Nc1ccc(CCN2CCSCC2)cc1 ZINC000061287023 851338534 /nfs/dbraw/zinc/33/85/34/851338534.db2.gz IKMCWYJXCQBBGV-UHFFFAOYSA-N 0 3 420.525 4.354 20 0 HIADHN CCOc1ccc(SCC(=O)Nc2ccc(CCN3CCSCC3)cc2)cc1 ZINC000061288901 851339446 /nfs/dbraw/zinc/33/94/46/851339446.db2.gz AXAMLEPCGNAUNQ-UHFFFAOYSA-N 0 3 416.612 4.407 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)c1ccc(N2CCCCCC2)nc1 ZINC000061288067 851340175 /nfs/dbraw/zinc/34/01/75/851340175.db2.gz GZTCLYBJSJGPPK-UHFFFAOYSA-N 0 3 424.614 4.306 20 0 HIADHN CCc1ccc([C@H](CNC(=O)c2ccc(Cn3nc(C)cc3C)cc2)N(C)C)cc1 ZINC000061367431 851357980 /nfs/dbraw/zinc/35/79/80/851357980.db2.gz VOJKPCGXTUUFFR-DEOSSOPVSA-N 0 3 404.558 4.143 20 0 HIADHN CC(=O)c1cccc(OCCCC(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)c1 ZINC000061502313 851389935 /nfs/dbraw/zinc/38/99/35/851389935.db2.gz RSFKUZUBJXYRHQ-DEOSSOPVSA-N 0 3 408.542 4.310 20 0 HIADHN Cc1c([C@@H](C)NCC2CCN(CC(F)(F)F)CC2)nnn1-c1cccc(Cl)c1 ZINC000437050433 862243944 /nfs/dbraw/zinc/24/39/44/862243944.db2.gz IFZBQLDMRTXFKF-CYBMUJFWSA-N 0 3 415.891 4.154 20 0 HIADHN CCNC(=O)c1ccc(C)c(NC(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)c1 ZINC000061751277 851440453 /nfs/dbraw/zinc/44/04/53/851440453.db2.gz CTIJCZQHGJBEDM-QFIPXVFZSA-N 0 3 408.546 4.012 20 0 HIADHN C[C@H](COc1ccccc1F)NC(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000061790947 851453576 /nfs/dbraw/zinc/45/35/76/851453576.db2.gz OSNFSFUBZVZLJC-QGZVFWFLSA-N 0 3 417.550 4.006 20 0 HIADHN CCOCc1ccc(CNC(=O)Nc2ccc(CCN3CCSCC3)cc2)cc1 ZINC000061793534 851455372 /nfs/dbraw/zinc/45/53/72/851455372.db2.gz LEZLKSLSWYSCAF-UHFFFAOYSA-N 0 3 413.587 4.136 20 0 HIADHN C[C@H]1CCCCN1CCNC(=O)C(=O)Nc1ccc(Oc2ccccc2Cl)cc1 ZINC000062122070 851503480 /nfs/dbraw/zinc/50/34/80/851503480.db2.gz XSVZKKKREWJGAT-INIZCTEOSA-N 0 3 415.921 4.061 20 0 HIADHN Cc1ccc(Oc2ccc(NC(=O)C(=O)NC[C@@H](C)N3CCCC[C@@H]3C)cc2)cc1 ZINC000062120433 851503643 /nfs/dbraw/zinc/50/36/43/851503643.db2.gz ALHFBKWRHINJHK-RBUKOAKNSA-N 0 3 409.530 4.105 20 0 HIADHN CCOc1ccc(C2(C[NH2+]Cc3cc(=O)oc4c(C)c([O-])ccc34)CCOCC2)cc1 ZINC000062241142 851514783 /nfs/dbraw/zinc/51/47/83/851514783.db2.gz MJCXLWCLTIKNNW-UHFFFAOYSA-N 0 3 423.509 4.044 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)Nc1ccc(OCC(F)(F)F)cc1 ZINC000062380448 851536143 /nfs/dbraw/zinc/53/61/43/851536143.db2.gz PZOXUXSPAIBQOD-UHFFFAOYSA-N 0 3 413.415 4.363 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)Nc1ccccc1OCC(F)(F)F ZINC000062383076 851537015 /nfs/dbraw/zinc/53/70/15/851537015.db2.gz SQSJDIPMBFEZTB-UHFFFAOYSA-N 0 3 413.415 4.363 20 0 HIADHN Cc1ccc(NC(=O)C(C)C)cc1NC(=O)N(CCN(C)C)Cc1cccc(F)c1 ZINC000062392190 851539523 /nfs/dbraw/zinc/53/95/23/851539523.db2.gz CMUXFDQEBGUZPD-UHFFFAOYSA-N 0 3 414.525 4.324 20 0 HIADHN COc1ccc(NC(=O)N(CCN(C)C)Cc2cccc(F)c2)c(C(F)(F)F)c1 ZINC000062394609 851540569 /nfs/dbraw/zinc/54/05/69/851540569.db2.gz QAWKIGRGXARGQF-UHFFFAOYSA-N 0 3 413.415 4.449 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)Nc1cccc(Cl)c1N(C)C ZINC000062399218 851540956 /nfs/dbraw/zinc/54/09/56/851540956.db2.gz ODZRQQUINWHVOL-UHFFFAOYSA-N 0 3 410.896 4.280 20 0 HIADHN CCCCOc1cc(CN[C@@H](C)c2cccc(NS(C)(=O)=O)c2)ccc1OC ZINC000062421241 851549564 /nfs/dbraw/zinc/54/95/64/851549564.db2.gz TXBRYIKMGDJFHK-INIZCTEOSA-N 0 3 406.548 4.096 20 0 HIADHN CCCCOc1ccc(CN[C@H](C)c2cccc(NS(C)(=O)=O)c2)cc1OC ZINC000062421260 851549604 /nfs/dbraw/zinc/54/96/04/851549604.db2.gz QPCRAQFYPGZNRI-MRXNPFEDSA-N 0 3 406.548 4.096 20 0 HIADHN Cc1ccc([C@H](NC(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)C2CC2)cc1 ZINC000062477091 851560404 /nfs/dbraw/zinc/56/04/04/851560404.db2.gz SVRAUQZHMMQOFS-QFIPXVFZSA-N 0 3 401.501 4.498 20 0 HIADHN C[C@@H](NC(=O)N(CCN(C)C)Cc1cccc(F)c1)c1ccc(OC(F)F)cc1 ZINC000062486086 851562706 /nfs/dbraw/zinc/56/27/06/851562706.db2.gz OYGLWVQKJVRTBH-OAHLLOKOSA-N 0 3 409.452 4.262 20 0 HIADHN COc1ccc(CCCNC(=O)N(CCN(C)C)Cc2cccc(Cl)c2)cc1 ZINC000062499237 851566002 /nfs/dbraw/zinc/56/60/02/851566002.db2.gz KOKUZYPMVYDECB-UHFFFAOYSA-N 0 3 403.954 4.055 20 0 HIADHN CN1CCC[C@H](NC(=O)NC[C@@H](c2c[nH]c3ccccc32)c2ccccc2Cl)C1 ZINC000062641552 851584087 /nfs/dbraw/zinc/58/40/87/851584087.db2.gz NRNBDERFJIGBKT-QFBILLFUSA-N 0 3 410.949 4.347 20 0 HIADHN CC1CCN([C@H](CNC(=O)N(C)Cc2ccc(N(C)C)cc2)c2ccccc2)CC1 ZINC000062647643 851585321 /nfs/dbraw/zinc/58/53/21/851585321.db2.gz ORHDDUUQMSYODP-XMMPIXPASA-N 0 3 408.590 4.367 20 0 HIADHN FC(F)(F)c1cccc(NNC(=S)NC2CCN(Cc3ccccc3)CC2)c1 ZINC000063142547 851619802 /nfs/dbraw/zinc/61/98/02/851619802.db2.gz KURFVXUGDWVXBO-UHFFFAOYSA-N 0 3 408.493 4.161 20 0 HIADHN FC(F)(F)c1cccc(CNC(=S)NC2CCN(Cc3ccccc3)CC2)c1 ZINC000063143466 851620015 /nfs/dbraw/zinc/62/00/15/851620015.db2.gz LVUXTSYEVWFXSL-UHFFFAOYSA-N 0 3 407.505 4.334 20 0 HIADHN CC(C)OCc1ccccc1CNC(=S)NC1CCN(Cc2ccccc2)CC1 ZINC000063147773 851621649 /nfs/dbraw/zinc/62/16/49/851621649.db2.gz AQHLFYDKURJPIM-UHFFFAOYSA-N 0 3 411.615 4.240 20 0 HIADHN O=C(c1ccccc1)C1CCN(C(=S)NC2CCN(Cc3ccccc3)CC2)CC1 ZINC000063146655 851621719 /nfs/dbraw/zinc/62/17/19/851621719.db2.gz HNLQOYFFICQELZ-UHFFFAOYSA-N 0 3 421.610 4.120 20 0 HIADHN CC(=O)c1cccc(O[C@@H](C)C(=O)NC[C@H](c2ccccc2)N2CCC(C)CC2)c1 ZINC000063244023 851639405 /nfs/dbraw/zinc/63/94/05/851639405.db2.gz FZBQKMKLCFCDSS-GBXCKJPGSA-N 0 3 408.542 4.246 20 0 HIADHN CCOCCOc1c(Cl)cccc1NC(=O)NC[C@H](c1ccc(C)cc1)N(C)C ZINC000063397608 851677436 /nfs/dbraw/zinc/67/74/36/851677436.db2.gz ZGXVOESFQHXRNL-HXUWFJFHSA-N 0 3 419.953 4.488 20 0 HIADHN S=C(NCc1cccc(Br)c1)NC1CCN(Cc2ccccc2)CC1 ZINC000063563542 851715094 /nfs/dbraw/zinc/71/50/94/851715094.db2.gz FLMQMEDYSQRXOI-UHFFFAOYSA-N 0 3 418.404 4.078 20 0 HIADHN Cc1cc(NC(=O)c2cccc(F)c2)sc1C(=O)NC[C@H](C)N1CCC[C@H](C)C1 ZINC000063749490 851754500 /nfs/dbraw/zinc/75/45/00/851754500.db2.gz OKLFSHODRFKQCL-HOCLYGCPSA-N 0 3 417.550 4.298 20 0 HIADHN CN(C)CCN(Cc1ccc(Br)cc1)C(=S)Nc1ccccc1C#N ZINC000063790039 851764432 /nfs/dbraw/zinc/76/44/32/851764432.db2.gz GGZYJCJEGBJMJC-UHFFFAOYSA-N 0 3 417.376 4.081 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)NCc1cccc2ccccc21 ZINC000063797332 851766754 /nfs/dbraw/zinc/76/67/54/851766754.db2.gz SQWJWYLIOKNQOV-UHFFFAOYSA-N 0 3 416.569 4.241 20 0 HIADHN CN1C[C@H](CN[C@@H](c2ccc(Br)cc2)c2cncnc2)Cc2ccccc21 ZINC000437092365 862285091 /nfs/dbraw/zinc/28/50/91/862285091.db2.gz GWVYCKBTMRATJW-AOMKIAJQSA-N 0 3 423.358 4.227 20 0 HIADHN O=C(OCc1nc2ccccc2o1)C1CCN(c2ccc(Cl)c(Cl)c2)C1=O ZINC000064043486 851821018 /nfs/dbraw/zinc/82/10/18/851821018.db2.gz WNPDZYFFYFUMNR-GFCCVEGCSA-N 0 3 405.237 4.231 20 0 HIADHN CCOc1ccc(CNC(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)cc1OC ZINC000064237281 851855436 /nfs/dbraw/zinc/85/54/36/851855436.db2.gz LKLOBYQGBWIVKQ-NRFANRHFSA-N 0 3 411.546 4.039 20 0 HIADHN COc1cc(CC(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)ccc1C ZINC000064470587 851905684 /nfs/dbraw/zinc/90/56/84/851905684.db2.gz WFJHFVAQRPHBLV-UHFFFAOYSA-N 0 3 408.464 4.155 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Cn3ccc4ccc(Cl)cc43)c(C)c2)CC1 ZINC000064692965 851959003 /nfs/dbraw/zinc/95/90/03/851959003.db2.gz SWPFPZVACOKEPB-UHFFFAOYSA-N 0 3 410.949 4.384 20 0 HIADHN CCOC(=O)N[C@H](C(=O)C(C#N)c1nc(-c2c(F)cccc2F)cs1)C(C)C ZINC000064715262 851964520 /nfs/dbraw/zinc/96/45/20/851964520.db2.gz VSENNIGLMCFLTQ-ZBEGNZNMSA-N 0 3 407.442 4.035 20 0 HIADHN Cc1ccccc1CN1CCCN(C(=O)NCCc2c[nH]c3cc(F)ccc23)CC1 ZINC000065386778 852119087 /nfs/dbraw/zinc/11/90/87/852119087.db2.gz DSAMLKUUPDJEJE-UHFFFAOYSA-N 0 3 408.521 4.075 20 0 HIADHN C[C@@H](NC(=O)N1CCN(CC2CCCCC2)CC1)c1ccc(NC(=O)C2CC2)cc1 ZINC000065448232 852136694 /nfs/dbraw/zinc/13/66/94/852136694.db2.gz FBHPEBVOPAJODV-GOSISDBHSA-N 0 3 412.578 4.004 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N(CCc2ccccc2)Cc2cccnc2)N(C)C)cc1 ZINC000065468397 852145284 /nfs/dbraw/zinc/14/52/84/852145284.db2.gz ZAZFDPOVSKGDEJ-VWLOTQADSA-N 0 3 416.569 4.447 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N(C)Cc2ccc(Br)s2)N(C)C)cc1 ZINC000065469038 852145454 /nfs/dbraw/zinc/14/54/54/852145454.db2.gz KRQWQOAYGYUWJD-INIZCTEOSA-N 0 3 410.381 4.263 20 0 HIADHN CN(C)CCN(CCc1ccccc1)C(=O)NCCc1ccccc1C(F)(F)F ZINC000065514355 852163034 /nfs/dbraw/zinc/16/30/34/852163034.db2.gz UDQFRTYDTUTVPY-UHFFFAOYSA-N 0 3 407.480 4.064 20 0 HIADHN O=C(CNC1(c2cccc(Br)c2)CCOCC1)NCCC1CCCCC1 ZINC000065604519 852197488 /nfs/dbraw/zinc/19/74/88/852197488.db2.gz HHNHVCAKJUIIMV-UHFFFAOYSA-N 0 3 423.395 4.131 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccc(F)c2)C1)N1CC=C(c2c[nH]c3ncccc23)CC1 ZINC000065609358 852198409 /nfs/dbraw/zinc/19/84/09/852198409.db2.gz PPDYXLMTUPPOJX-HXUWFJFHSA-N 0 3 418.516 4.230 20 0 HIADHN Cc1ccc(F)c(NC(=S)NCCCCN2CCN(c3ccccc3)CC2)c1 ZINC000065703068 852225633 /nfs/dbraw/zinc/22/56/33/852225633.db2.gz CRTRIPVWQMJJLI-UHFFFAOYSA-N 0 3 400.567 4.023 20 0 HIADHN CCN(CC)[C@H](CNC(=O)C(=O)Nc1ccccc1C)c1ccc(C(F)(F)F)cc1 ZINC000065713522 852231268 /nfs/dbraw/zinc/23/12/68/852231268.db2.gz LQQUKMMGYQFNAZ-LJQANCHMSA-N 0 3 421.463 4.152 20 0 HIADHN CC1CCN([C@@H](CNC(=O)Nc2ccc3oc(=O)ccc3c2)c2cccs2)CC1 ZINC000065752934 852246007 /nfs/dbraw/zinc/24/60/07/852246007.db2.gz HJZMVJSAHSPFJA-SFHVURJKSA-N 0 3 411.527 4.449 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)C2(c3ccc4c(c3)OCCO4)CCCC2)C1 ZINC000065827022 852270675 /nfs/dbraw/zinc/27/06/75/852270675.db2.gz LMYIRTJJFPLYAB-UGKGYDQZSA-N 0 3 420.553 4.221 20 0 HIADHN COc1ccc(CNCc2ccccc2N2CCOCC2)cc1OCc1ccccc1 ZINC000065934930 852323588 /nfs/dbraw/zinc/32/35/88/852323588.db2.gz SBCCPJMJVVCVTO-UHFFFAOYSA-N 0 3 418.537 4.401 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)c1cc(-c2ccccc2F)on1 ZINC000065936871 852324857 /nfs/dbraw/zinc/32/48/57/852324857.db2.gz YFLYOXFJDAJJTR-UHFFFAOYSA-N 0 3 401.869 4.338 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)c1ccc(N2CCCCCC2)nc1 ZINC000065936785 852325308 /nfs/dbraw/zinc/32/53/08/852325308.db2.gz ARQGTRGZTMKQFM-UHFFFAOYSA-N 0 3 414.981 4.319 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)CCc1nc2ccccc2s1 ZINC000065938213 852326313 /nfs/dbraw/zinc/32/63/13/852326313.db2.gz VOEGODKWIMASJP-UHFFFAOYSA-N 0 3 403.498 4.098 20 0 HIADHN CN(C[C@@H]1CCCN(C(=O)c2cccc(CN3CCCC3)c2)C1)C(=O)OC(C)(C)C ZINC000066052437 852366189 /nfs/dbraw/zinc/36/61/89/852366189.db2.gz XQZHTLGNMWIDDI-FQEVSTJZSA-N 0 3 415.578 4.002 20 0 HIADHN Cc1cc(Br)ccc1SCC(=O)NC[C@@H](c1ccccc1)N(C)C ZINC000068988164 852379242 /nfs/dbraw/zinc/37/92/42/852379242.db2.gz IZRUFFWOALORGO-KRWDZBQOSA-N 0 3 407.377 4.269 20 0 HIADHN COc1cc(C(=O)NC[C@H](c2ccccc2)N(C)C)cc(Cl)c1OCC(C)C ZINC000069344218 852393350 /nfs/dbraw/zinc/39/33/50/852393350.db2.gz LUGJKYZMEJULQN-LJQANCHMSA-N 0 3 404.938 4.416 20 0 HIADHN O=C(CCc1cccc(Br)c1)N1CCCN(Cc2ccccc2)CC1 ZINC000071813123 852410136 /nfs/dbraw/zinc/41/01/36/852410136.db2.gz SUXGYDJBCARCBB-UHFFFAOYSA-N 0 3 401.348 4.116 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1ccc(-n2ccnc2SC)cc1)c1ccsc1 ZINC000071956463 852444882 /nfs/dbraw/zinc/44/48/82/852444882.db2.gz ASGREMIIXLFZHJ-IBGZPJMESA-N 0 3 414.600 4.469 20 0 HIADHN CC1CCN([C@H](CNC(=O)c2ccc(N3CCCC3=O)cc2)c2ccccc2)CC1 ZINC000072006448 852460978 /nfs/dbraw/zinc/46/09/78/852460978.db2.gz DRSHRIBVJPTQFM-HSZRJFAPSA-N 0 3 405.542 4.016 20 0 HIADHN CC[C@@H](CC(=O)N1CCC[C@H](CN2CCN(c3ccccn3)CC2)C1)c1ccccc1 ZINC000078414343 852514341 /nfs/dbraw/zinc/51/43/41/852514341.db2.gz DVAMODVHRXQQJZ-PKTZIBPZSA-N 0 3 420.601 4.026 20 0 HIADHN COc1ccc(CN(CC(=O)NCCc2nc3ccccc3s2)[C@@H](C)C2CC2)cc1 ZINC000096981783 852567850 /nfs/dbraw/zinc/56/78/50/852567850.db2.gz PNONPNQFKNHNRW-KRWDZBQOSA-N 0 3 423.582 4.264 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cc(C(C)C)nc4onc(C)c43)c(C)c2)CC1 ZINC000097006518 852572957 /nfs/dbraw/zinc/57/29/57/852572957.db2.gz UCCJZBRSJVFTRJ-UHFFFAOYSA-N 0 3 421.545 4.357 20 0 HIADHN CSc1nc(-c2ccco2)nc(C)c1C(=O)NC1CCN(Cc2ccccc2)CC1 ZINC000097100847 852582770 /nfs/dbraw/zinc/58/27/70/852582770.db2.gz CNUCNBHGPPAZIE-UHFFFAOYSA-N 0 3 422.554 4.161 20 0 HIADHN CN(Cc1ccc(Br)s1)C(=O)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000097204876 852588377 /nfs/dbraw/zinc/58/83/77/852588377.db2.gz ZJHPTHKHPSCWQH-KRWDZBQOSA-N 0 3 422.392 4.489 20 0 HIADHN Cc1cc(C(=O)N[C@@H](CN2CCCC2)c2ccccc2)c(C)n1Cc1ccccn1 ZINC000097286005 852596689 /nfs/dbraw/zinc/59/66/89/852596689.db2.gz ZOFRHVRXRRTPRY-DEOSSOPVSA-N 0 3 402.542 4.115 20 0 HIADHN CC(C)[C@H](NC(=O)N[C@@H](CN1CCCC1)c1ccccc1)c1nc2ccccc2[nH]1 ZINC000097394676 852606895 /nfs/dbraw/zinc/60/68/95/852606895.db2.gz FUEUXJYQUNMUDK-VXKWHMMOSA-N 0 3 405.546 4.396 20 0 HIADHN O=C(COc1ccccc1Cl)NC1CCN(CCOc2ccc(Cl)cc2)CC1 ZINC000097577237 852637222 /nfs/dbraw/zinc/63/72/22/852637222.db2.gz JFBZLFSREFZAHH-UHFFFAOYSA-N 0 3 423.340 4.032 20 0 HIADHN CN(CCC(=O)NC(c1ccccc1)c1ccccc1)Cc1ccc2c(c1)OCO2 ZINC000105421552 852704408 /nfs/dbraw/zinc/70/44/08/852704408.db2.gz FIBXNXIXWCDFRI-UHFFFAOYSA-N 0 3 402.494 4.143 20 0 HIADHN CC[C@H](C)c1ccccc1OCC(=O)NCc1ccc(CN2CCN(CC)CC2)cc1 ZINC000107651946 852783993 /nfs/dbraw/zinc/78/39/93/852783993.db2.gz ZEECVLYTAPEAAG-NRFANRHFSA-N 0 3 423.601 4.033 20 0 HIADHN CC1CCN([C@H](CNC(=O)Nc2cccnc2N2CCCC2)c2cccs2)CC1 ZINC000107705298 852788222 /nfs/dbraw/zinc/78/82/22/852788222.db2.gz KCNBEQFLLSRJDD-LJQANCHMSA-N 0 3 413.591 4.338 20 0 HIADHN O=C(COc1ccc(Cl)c2cccnc12)NC[C@H](c1ccccc1)N1CCCC1 ZINC000107829139 852800564 /nfs/dbraw/zinc/80/05/64/852800564.db2.gz DYDBNGCWRYEVCZ-HXUWFJFHSA-N 0 3 409.917 4.220 20 0 HIADHN CC[C@@H](CNC(=O)N1CCC[C@@H]1c1cccc(OC)c1)N1CCc2ccccc2C1 ZINC000107967675 852813404 /nfs/dbraw/zinc/81/34/04/852813404.db2.gz FNTLDUCDMDVQHH-LADGPHEKSA-N 0 3 407.558 4.379 20 0 HIADHN COc1cccc(CN2CCC(NC(=O)c3ccc4nc(Cl)ccc4c3)CC2)c1 ZINC000108528928 852856343 /nfs/dbraw/zinc/85/63/43/852856343.db2.gz BLLURBCZFNDALQ-UHFFFAOYSA-N 0 3 409.917 4.291 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)CCc1ncc(-c2ccccc2F)o1 ZINC000108688488 852872221 /nfs/dbraw/zinc/87/22/21/852872221.db2.gz BGKWMRFMGGYVOW-UHFFFAOYSA-N 0 3 413.468 4.143 20 0 HIADHN CN(C)C(=O)c1ccc(NC(=O)CN2CCC[C@H]2c2cccc3ccccc32)cc1 ZINC000108982102 852903383 /nfs/dbraw/zinc/90/33/83/852903383.db2.gz TVCSLDCVLSLFHT-QHCPKHFHSA-N 0 3 401.510 4.317 20 0 HIADHN COc1cc(OC)c(NC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)cc1Cl ZINC000109017455 852908620 /nfs/dbraw/zinc/90/86/20/852908620.db2.gz CAPBQHSWIAVARG-HNNXBMFYSA-N 0 3 406.885 4.347 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)CCCc1ncc(-c2ccccc2)o1 ZINC000109343984 852955748 /nfs/dbraw/zinc/95/57/48/852955748.db2.gz GWSBZGCMEZFYAM-UHFFFAOYSA-N 0 3 409.505 4.394 20 0 HIADHN O=C([C@H]1CCCN(Cc2cccc(F)c2)C1)N1CCn2cccc2[C@@H]1c1ccccc1 ZINC000109346096 852956384 /nfs/dbraw/zinc/95/63/84/852956384.db2.gz ITNUAMSUQHNITC-DHLKQENFSA-N 0 3 417.528 4.471 20 0 HIADHN Cc1cc(C)n(Cc2cccc(C(=O)NC[C@@H](c3ccccc3)N3CCCC3)c2)n1 ZINC000109383551 852963276 /nfs/dbraw/zinc/96/32/76/852963276.db2.gz WLEMLHFVRMRMJC-DEOSSOPVSA-N 0 3 402.542 4.115 20 0 HIADHN Cc1[nH]c(C(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)c(C)c1C(=O)OC(C)C ZINC000109503339 852978144 /nfs/dbraw/zinc/97/81/44/852978144.db2.gz WDZORBNLYQINTQ-FQEVSTJZSA-N 0 3 411.546 4.072 20 0 HIADHN O=C(COc1ccc2ccccc2c1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000109500058 852978292 /nfs/dbraw/zinc/97/82/92/852978292.db2.gz IGEFMGOASFPBER-UHFFFAOYSA-N 0 3 406.551 4.449 20 0 HIADHN C[C@H](Sc1ccccc1Cl)C(=O)N(C)C1CCN(CCc2ccccn2)CC1 ZINC000109809057 853017402 /nfs/dbraw/zinc/01/74/02/853017402.db2.gz UNJNEHRHJLTHMS-KRWDZBQOSA-N 0 3 418.006 4.381 20 0 HIADHN CC(C)Cn1cc(C(=O)N(C)C2CCN(CCc3ccccn3)CC2)c2ccccc21 ZINC000109808651 853017484 /nfs/dbraw/zinc/01/74/84/853017484.db2.gz PQFZJBDYADINLF-UHFFFAOYSA-N 0 3 418.585 4.471 20 0 HIADHN COc1cccc(C[C@@H]2CCCN2C(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)c1 ZINC000109900216 853031251 /nfs/dbraw/zinc/03/12/51/853031251.db2.gz WLOGOEYFNHIKRP-DEOSSOPVSA-N 0 3 421.585 4.073 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)c3ccccc3N(C)c3ccccc3)CC2)C[C@H](C)O1 ZINC000110406471 853096741 /nfs/dbraw/zinc/09/67/41/853096741.db2.gz YTSBZVDUQPFIPH-OYRHEFFESA-N 0 3 421.585 4.416 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)c3ccccc3Nc3ccccc3)CC2)C[C@H](C)O1 ZINC000110417724 853097458 /nfs/dbraw/zinc/09/74/58/853097458.db2.gz QRXSTPGWBYMORZ-PMACEKPBSA-N 0 3 407.558 4.392 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Cc3coc4ccc5ccccc5c34)CC2)C[C@@H](C)O1 ZINC000110453744 853101365 /nfs/dbraw/zinc/10/13/65/853101365.db2.gz QKWWRZXKSJPPQD-RTBURBONSA-N 0 3 420.553 4.476 20 0 HIADHN Cc1c2cc(Cl)ccc2oc1C(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000110456866 853102595 /nfs/dbraw/zinc/10/25/95/853102595.db2.gz WWWMBQJIJUJOIP-GASCZTMLSA-N 0 3 404.938 4.356 20 0 HIADHN c1cnn(-c2ccc(CNCc3cn(Cc4ccccc4)nc3-c3cccnc3)cc2)c1 ZINC000110576004 853120330 /nfs/dbraw/zinc/12/03/30/853120330.db2.gz NKVQPVGFEMUNGG-UHFFFAOYSA-N 0 3 420.520 4.469 20 0 HIADHN C[C@@H](CNc1nc(C2CC2)nc2scc(-c3ccccc3)c21)N1CCN(C)CC1 ZINC000110670264 853135237 /nfs/dbraw/zinc/13/52/37/853135237.db2.gz XRQQSMCQYRYASI-INIZCTEOSA-N 0 3 407.587 4.284 20 0 HIADHN COc1ccc(NC(=O)[C@H](C)N(C)CCCc2cc(-c3ccc(F)cc3)n[nH]2)cc1 ZINC000111039970 853191085 /nfs/dbraw/zinc/19/10/85/853191085.db2.gz GHUDCTUFPRNVHG-INIZCTEOSA-N 0 3 410.493 4.116 20 0 HIADHN C[C@@H](NC(C)(C)CNS(=O)(=O)c1ccccc1C(F)(F)F)c1ccccc1 ZINC000111048671 853193539 /nfs/dbraw/zinc/19/35/39/853193539.db2.gz KFNNBCQQKSZFBP-CQSZACIVSA-N 0 3 400.466 4.113 20 0 HIADHN C[C@@H](NC(C)(C)CNS(=O)(=O)Cc1cccc(C(F)(F)F)c1)c1ccccc1 ZINC000111049856 853194802 /nfs/dbraw/zinc/19/48/02/853194802.db2.gz DCSGYIYUEDMTNX-OAHLLOKOSA-N 0 3 414.493 4.254 20 0 HIADHN COc1ccc([C@H](CNC(=O)CNc2cccc(C(F)(F)F)c2)N2CCCC2)cc1 ZINC000111071383 853196833 /nfs/dbraw/zinc/19/68/33/853196833.db2.gz PWCPXRQKVAWLGK-FQEVSTJZSA-N 0 3 421.463 4.079 20 0 HIADHN COc1ccc2cc(CNC(=O)c3ccc(N4CCN(C(C)C)CC4)cc3)ccc2c1 ZINC000115983272 853277031 /nfs/dbraw/zinc/27/70/31/853277031.db2.gz MQLLRPIKPSUDTN-UHFFFAOYSA-N 0 3 417.553 4.309 20 0 HIADHN CCN(C(=O)c1ccn(-c2ccc(OC)cc2)n1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000116349397 853298708 /nfs/dbraw/zinc/29/87/08/853298708.db2.gz YIKLPQMOUCOEIU-SIKLNZKXSA-N 0 3 418.541 4.179 20 0 HIADHN COc1ccc(CCC2CCN(C(=O)[C@H]3CCCN(Cc4cccnc4)C3)CC2)cc1 ZINC000116390794 853300874 /nfs/dbraw/zinc/30/08/74/853300874.db2.gz NUWGFGNEXHQYOP-DEOSSOPVSA-N 0 3 421.585 4.174 20 0 HIADHN CCCN(C(=O)c1ccc(Cn2cccn2)cc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000116557301 853315190 /nfs/dbraw/zinc/31/51/90/853315190.db2.gz CAMYIELUQBPVJY-VWLOTQADSA-N 0 3 416.569 4.448 20 0 HIADHN COc1ccc2c(CC(=O)Nc3ccc(CCN4CCSCC4)cc3)coc2c1 ZINC000138706165 853394659 /nfs/dbraw/zinc/39/46/59/853394659.db2.gz RJURHHWHKYCIBD-UHFFFAOYSA-N 0 3 410.539 4.214 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)c1ccccc1Br ZINC000138714942 853395516 /nfs/dbraw/zinc/39/55/16/853395516.db2.gz HUDJTXBZLGEPFT-UHFFFAOYSA-N 0 3 405.361 4.293 20 0 HIADHN C[C@H]1c2ccsc2CCN1C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000139935456 853426562 /nfs/dbraw/zinc/42/65/62/853426562.db2.gz DZHDOVCMUZPIBF-INIZCTEOSA-N 0 3 401.601 4.491 20 0 HIADHN Cc1onc(-c2ccc(F)cc2)c1C(=O)NC[C@@H]1CCCN(Cc2cccs2)C1 ZINC000140026870 853430690 /nfs/dbraw/zinc/43/06/90/853430690.db2.gz FDCMKGHBRGOFCF-INIZCTEOSA-N 0 3 413.518 4.493 20 0 HIADHN O=c1ccccn1Cc1ccc(CNCc2ccc(F)c(Br)c2)cc1 ZINC000140420518 853443803 /nfs/dbraw/zinc/44/38/03/853443803.db2.gz CREDPZITLZRMHM-UHFFFAOYSA-N 0 3 401.279 4.088 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(CNCc3ccccc3-n3ccnc3)c2)cc1 ZINC000140465073 853446613 /nfs/dbraw/zinc/44/66/13/853446613.db2.gz NZDMEQIXPJHEHF-UHFFFAOYSA-N 0 3 412.493 4.423 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cnn(C)c1C1CC1)c1ccc(C(F)(F)F)cc1 ZINC000141350206 853469272 /nfs/dbraw/zinc/46/92/72/853469272.db2.gz WNUAQPQAAJOUAP-SFHVURJKSA-N 0 3 408.468 4.129 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2ccc(NC(=O)NC(C)C)cc2)N2CCCC2)cc1 ZINC000143045155 853507050 /nfs/dbraw/zinc/50/70/50/853507050.db2.gz APABJZXVMIRBBC-QFIPXVFZSA-N 0 3 408.546 4.092 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2ccc(-n3cc[nH]c3=S)cc2)N2CCCC2)cc1 ZINC000143069763 853507608 /nfs/dbraw/zinc/50/76/08/853507608.db2.gz XEUWLQNBCZJDFJ-NRFANRHFSA-N 0 3 406.555 4.410 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2cccc(NC(=O)c3ccco3)c2)N2CCCC2)cc1 ZINC000143051808 853507616 /nfs/dbraw/zinc/50/76/16/853507616.db2.gz ORXPVBDBVZLKCW-JOCHJYFZSA-N 0 3 417.509 4.407 20 0 HIADHN Cc1nn(C(F)F)c(C)c1CC(=O)C(C#N)C(=O)Nc1cc(Cl)cc(Cl)c1 ZINC000143164087 853509219 /nfs/dbraw/zinc/50/92/19/853509219.db2.gz JGXKPISZXXUIOC-CQSZACIVSA-N 0 3 415.227 4.092 20 0 HIADHN O=C(NCc1ccccc1)C1CCN(Cc2ccc(OCc3ccncc3)cc2)CC1 ZINC000143171476 853509457 /nfs/dbraw/zinc/50/94/57/853509457.db2.gz KDKUNBVVMXJFPT-UHFFFAOYSA-N 0 3 415.537 4.189 20 0 HIADHN S=C(N[C@@H](c1ccco1)c1ccccc1)NC1CCN(Cc2ccccc2)CC1 ZINC000145502070 853552275 /nfs/dbraw/zinc/55/22/75/853552275.db2.gz OEZGDMFQMNDUTO-HSZRJFAPSA-N 0 3 405.567 4.498 20 0 HIADHN CC1CCN([C@H](CNC(=O)Nc2nnc(C(F)F)s2)c2cccs2)CC1 ZINC000148311913 853605604 /nfs/dbraw/zinc/60/56/04/853605604.db2.gz ADNPDIAQXCXLPI-LLVKDONJSA-N 0 3 401.508 4.132 20 0 HIADHN COc1ccc2cc(CNCc3cccc(C(=O)NC[C@H]4CCCO4)c3)ccc2c1 ZINC000166068825 853653521 /nfs/dbraw/zinc/65/35/21/853653521.db2.gz FWNRWFHIBYWJTK-XMMPIXPASA-N 0 3 404.510 4.047 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)CSc2nc3ccccc3s2)CC1 ZINC000195540884 853674740 /nfs/dbraw/zinc/67/47/40/853674740.db2.gz YUMDOQKOWJDRCK-UHFFFAOYSA-N 0 3 401.557 4.104 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)/C=C/c2ccccc2OC(F)(F)F)CC1 ZINC000195593238 853702599 /nfs/dbraw/zinc/70/25/99/853702599.db2.gz MERQHKGNROOTHS-CMDGGOBGSA-N 0 3 408.420 4.314 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)c2cc3ccc(OC(F)(F)F)cc3[nH]2)CC1 ZINC000195593252 853702899 /nfs/dbraw/zinc/70/28/99/853702899.db2.gz VCYUFAQHHJDBNF-UHFFFAOYSA-N 0 3 421.419 4.396 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)N(Cc1ccccc1)C[C@H]1CCCO1 ZINC000195613369 853715032 /nfs/dbraw/zinc/71/50/32/853715032.db2.gz BMAXPPBLEBYUDT-DNQXCXABSA-N 0 3 407.558 4.214 20 0 HIADHN CC[C@@H](NCC(=O)NC1CCN(C(=O)C2CCCCC2)CC1)c1ccc(Cl)cc1 ZINC000195669385 853748351 /nfs/dbraw/zinc/74/83/51/853748351.db2.gz ARNQLTSSLDYBFW-OAQYLSRUSA-N 0 3 419.997 4.068 20 0 HIADHN COCCN1CCC(NC(=O)C2(c3ccc(C(C)(C)C)cc3)CCCCC2)CC1 ZINC000195689164 853758915 /nfs/dbraw/zinc/75/89/15/853758915.db2.gz YDAHADZJKZMCMR-UHFFFAOYSA-N 0 3 400.607 4.413 20 0 HIADHN O=C(NCc1ccc(OC(F)(F)F)cc1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000195722585 853778649 /nfs/dbraw/zinc/77/86/49/853778649.db2.gz IYPFOWFDSRNXRD-KRWDZBQOSA-N 0 3 410.411 4.253 20 0 HIADHN Cc1cc(-n2c(C)cc(C(=O)NC[C@@H](c3ccc(C)cc3)N3CCCC3)c2C)no1 ZINC000195745129 853791195 /nfs/dbraw/zinc/79/11/95/853791195.db2.gz CHNIVBPPAKFFMW-QFIPXVFZSA-N 0 3 406.530 4.266 20 0 HIADHN CC(C)N(Cc1ccc(Cl)c(Cl)c1)C(=O)C(=O)Nc1cccc(CN(C)C)c1 ZINC000437269075 862508710 /nfs/dbraw/zinc/50/87/10/862508710.db2.gz TWKMDLILKWWJQB-UHFFFAOYSA-N 0 3 422.356 4.431 20 0 HIADHN CCOc1c(Br)cc(CNCCOCC2CC2)cc1Br ZINC000224531046 853879106 /nfs/dbraw/zinc/87/91/06/853879106.db2.gz ABSZRLJWCLIDJN-UHFFFAOYSA-N 0 3 407.146 4.127 20 0 HIADHN Brc1cccc(-c2nc(CNCCCOC[C@@H]3CCCO3)cs2)c1 ZINC000236581467 853899943 /nfs/dbraw/zinc/89/99/43/853899943.db2.gz DEYYGQMCUVOWLT-KRWDZBQOSA-N 0 3 411.365 4.248 20 0 HIADHN O=[N+]([O-])c1cc(CN[C@@H](c2ccc3c(c2)OCCO3)C2CC2)ccc1Br ZINC000236605262 853901412 /nfs/dbraw/zinc/90/14/12/853901412.db2.gz BQYZSKLFZOPGMN-LJQANCHMSA-N 0 3 419.275 4.369 20 0 HIADHN CC(=O)Nc1ccc(CCNCc2c(C)nn(Cc3ccc(C)cc3)c2Cl)cc1 ZINC000236597435 853901511 /nfs/dbraw/zinc/90/15/11/853901511.db2.gz DORBMZIAKZWOHZ-UHFFFAOYSA-N 0 3 410.949 4.492 20 0 HIADHN CC(C)c1noc(CCCNCc2nc(-c3cccc(Br)c3)c[nH]2)n1 ZINC000236633742 853906157 /nfs/dbraw/zinc/90/61/57/853906157.db2.gz NAGSTONYXOYSFX-UHFFFAOYSA-N 0 3 404.312 4.068 20 0 HIADHN CC1(C)Cc2cc(CNCc3cccc(NC(=O)NCc4ccncc4)c3)ccc2O1 ZINC000236695352 853913428 /nfs/dbraw/zinc/91/34/28/853913428.db2.gz LDKCHWFTWJGUDK-UHFFFAOYSA-N 0 3 416.525 4.407 20 0 HIADHN CC(C)COc1ccc(CNCc2ccc(C(=O)N3C[C@H](C)O[C@@H](C)C3)cc2)cc1 ZINC000236716959 853915629 /nfs/dbraw/zinc/91/56/29/853915629.db2.gz CMCCBXPNJDSGCK-PMACEKPBSA-N 0 3 410.558 4.261 20 0 HIADHN CC(C)(CNCc1cccc(Oc2cccc(C(F)(F)F)c2)c1)S(C)(=O)=O ZINC000236750341 853919267 /nfs/dbraw/zinc/91/92/67/853919267.db2.gz YCWOTRJDTJPUCV-UHFFFAOYSA-N 0 3 401.450 4.411 20 0 HIADHN CCOc1cc(CN[C@H]2CCSc3ccccc32)ccc1O[C@@H](C)C(=O)N(C)C ZINC000236913440 853937015 /nfs/dbraw/zinc/93/70/15/853937015.db2.gz MPWSHLRZZGUOSF-LPHOPBHVSA-N 0 3 414.571 4.268 20 0 HIADHN CCOc1cc(CNC[C@](C)(O)c2ccco2)cc(Br)c1OC(F)F ZINC000236957111 853942699 /nfs/dbraw/zinc/94/26/99/853942699.db2.gz SHIGHTNLTFEORO-KRWDZBQOSA-N 0 3 420.250 4.040 20 0 HIADHN C#CCCOc1ccc(CNCc2cc(Br)c(OC)c(OC)c2)cc1 ZINC000237104743 853965260 /nfs/dbraw/zinc/96/52/60/853965260.db2.gz IFDCSBQKTBCEHZ-UHFFFAOYSA-N 0 3 404.304 4.158 20 0 HIADHN COc1ccc(Br)cc1CNC[C@@H](O)c1cccc(C(F)(F)F)c1 ZINC000237133337 853969790 /nfs/dbraw/zinc/96/97/90/853969790.db2.gz FREFBMQHBLSVEK-OAHLLOKOSA-N 0 3 404.226 4.300 20 0 HIADHN CN(CCC#N)c1ccc(CN[C@@H](Cc2ccccc2)C(=O)Nc2ccccc2)cc1 ZINC000237208026 853982353 /nfs/dbraw/zinc/98/23/53/853982353.db2.gz IDOQLNNUFAHCQY-VWLOTQADSA-N 0 3 412.537 4.376 20 0 HIADHN CNC(=O)c1ccc(CN[C@H]2c3cc(Br)ccc3SC[C@@H]2C)cc1 ZINC000237227976 853986279 /nfs/dbraw/zinc/98/62/79/853986279.db2.gz HJPREHHUGBATHE-KPZWWZAWSA-N 0 3 405.361 4.381 20 0 HIADHN COc1cc(CNCc2ccc(N(C)C(=O)c3ccncc3)cc2)ccc1OC(C)C ZINC000237247441 853989666 /nfs/dbraw/zinc/98/96/66/853989666.db2.gz KCXQMCUKZZMGKU-UHFFFAOYSA-N 0 3 419.525 4.444 20 0 HIADHN COc1cc(Br)cc(C[NH2+]CCc2nc(-c3ccccn3)cs2)c1[O-] ZINC000237242646 853989812 /nfs/dbraw/zinc/98/98/12/853989812.db2.gz XMGPTEMBGLIEST-UHFFFAOYSA-N 0 3 420.332 4.014 20 0 HIADHN COc1ccc(CNCc2ccc(-n3ccnc3)cc2)cc1OCc1cccnc1 ZINC000237250402 853991306 /nfs/dbraw/zinc/99/13/06/853991306.db2.gz MAHKZOKTBHNRTN-UHFFFAOYSA-N 0 3 400.482 4.145 20 0 HIADHN COc1cc(CNCc2ccc(-n3cncn3)c(C)c2)ccc1OCc1ccccc1 ZINC000237269281 853994151 /nfs/dbraw/zinc/99/41/51/853994151.db2.gz KEAPEWSRFRCUHO-UHFFFAOYSA-N 0 3 414.509 4.453 20 0 HIADHN COc1cc(CNCc2ccc(-n3cncn3)cc2)ccc1OCc1ccc(F)cc1 ZINC000237270006 853994294 /nfs/dbraw/zinc/99/42/94/853994294.db2.gz WRMVVXBWWKXUIP-UHFFFAOYSA-N 0 3 418.472 4.284 20 0 HIADHN COc1cccc(CNCc2ccccc2CN2C[C@H](C)O[C@@H](C)C2)c1OC(F)F ZINC000237388392 854020329 /nfs/dbraw/zinc/02/03/29/854020329.db2.gz QDQZEQSWMCUKPM-IRXDYDNUSA-N 0 3 420.500 4.196 20 0 HIADHN COc1cccc(CNCc2ccccc2CN2C[C@@H](C)O[C@H](C)C2)c1OC(C)C ZINC000237388213 854020638 /nfs/dbraw/zinc/02/06/38/854020638.db2.gz UYBKALQPVJQDOL-WOJBJXKFSA-N 0 3 412.574 4.381 20 0 HIADHN COc1ccc(OC)c(NC(=O)C[C@@H](C)N[C@@H]2CCSc3ccc(F)cc32)c1 ZINC000237397480 854022568 /nfs/dbraw/zinc/02/25/68/854022568.db2.gz DWOHQMPIBLSNAP-CXAGYDPISA-N 0 3 404.507 4.387 20 0 HIADHN Cc1nn(-c2ccccc2)c(Oc2ccc(Br)cc2)c1CN[C@@H](C)CO ZINC000237452546 854035967 /nfs/dbraw/zinc/03/59/67/854035967.db2.gz IVILRGSNVILQNN-AWEZNQCLSA-N 0 3 416.319 4.206 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(CNC[C@@H](O)c3c(F)cccc3F)c2)cc1 ZINC000237465194 854038023 /nfs/dbraw/zinc/03/80/23/854038023.db2.gz OMZUQOQVRCRGPW-OAQYLSRUSA-N 0 3 412.436 4.049 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(CNC[C@H](O)c3ccc(Cl)cc3)c2)cc1 ZINC000237466388 854038233 /nfs/dbraw/zinc/03/82/33/854038233.db2.gz GRKVKUMFXUYTIM-QFIPXVFZSA-N 0 3 410.901 4.424 20 0 HIADHN C[C@@H](NCc1ccc(CSC(F)F)o1)c1cc(F)ccc1N1CCN(C)CC1 ZINC000237485627 854043364 /nfs/dbraw/zinc/04/33/64/854043364.db2.gz ZOXNRTAMBLNJIU-CQSZACIVSA-N 0 3 413.509 4.477 20 0 HIADHN Cc1ccc(CNC(=O)c2cccc(CN[C@H](C)CC(=O)Nc3ccccc3)c2)cc1 ZINC000237508725 854047635 /nfs/dbraw/zinc/04/76/35/854047635.db2.gz NMMBNTGDIQPTFE-HXUWFJFHSA-N 0 3 415.537 4.432 20 0 HIADHN C[C@H](CC(=O)Nc1ccccc1)N[C@@H](Cc1ccccc1)C(=O)N(C)c1ccccc1 ZINC000237511132 854048316 /nfs/dbraw/zinc/04/83/16/854048316.db2.gz PMCLQOBERWFSIB-YKSBVNFPSA-N 0 3 415.537 4.268 20 0 HIADHN Cc1cc(Br)ccc1NC(=O)CCNCc1ccccc1OC(F)F ZINC000237563675 854055054 /nfs/dbraw/zinc/05/50/54/854055054.db2.gz UBKZZWBPNCGLTI-UHFFFAOYSA-N 0 3 413.262 4.477 20 0 HIADHN C[C@H](NCc1ccc(Br)c([N+](=O)[O-])c1)c1cccc(-n2cccn2)c1 ZINC000237583625 854058456 /nfs/dbraw/zinc/05/84/56/854058456.db2.gz JAEGYZZZCRIOHB-ZDUSSCGKSA-N 0 3 401.264 4.394 20 0 HIADHN C[C@](O)(CNCc1cc(Br)ccc1OCc1ccccn1)c1ccco1 ZINC000237734376 854085486 /nfs/dbraw/zinc/08/54/86/854085486.db2.gz DOXGJQDQQVGCJF-FQEVSTJZSA-N 0 3 417.303 4.013 20 0 HIADHN Cc1nn(C)c(Cl)c1CNC1CCN(Cc2cccc(C(F)(F)F)c2)CC1 ZINC000237734423 854086108 /nfs/dbraw/zinc/08/61/08/854086108.db2.gz RONSRELNGQXRAI-UHFFFAOYSA-N 0 3 400.876 4.155 20 0 HIADHN FC(F)(F)c1cccc(N2CCN(CCCNCc3csc(C4CC4)n3)CC2)c1 ZINC000237746763 854088029 /nfs/dbraw/zinc/08/80/29/854088029.db2.gz WUVIMFHPAHKREL-UHFFFAOYSA-N 0 3 424.536 4.341 20 0 HIADHN FC(F)(F)c1ccn(-c2ccc(CNCc3ccc(C4OCCO4)cc3)cc2)n1 ZINC000237756256 854089972 /nfs/dbraw/zinc/08/99/72/854089972.db2.gz VYQWODBHGBPTRS-UHFFFAOYSA-N 0 3 403.404 4.226 20 0 HIADHN Cc1nn(-c2ccc(F)cc2F)c(C)c1CN[C@@H]1CCN(c2ncccc2Cl)C1 ZINC000237795777 854098772 /nfs/dbraw/zinc/09/87/72/854098772.db2.gz ZTAQNCSAYLIUHH-MRXNPFEDSA-N 0 3 417.891 4.184 20 0 HIADHN Cc1ccc(COc2ccc(CNCc3ccccc3CS(C)(=O)=O)cc2)cc1 ZINC000237817894 854103006 /nfs/dbraw/zinc/10/30/06/854103006.db2.gz FWPJFSDOPOLEGP-UHFFFAOYSA-N 0 3 409.551 4.408 20 0 HIADHN Cc1nn(C)c(N2CCOCC2)c1CN[C@H](CCCc1ccccc1)c1ccccc1 ZINC000237832178 854105524 /nfs/dbraw/zinc/10/55/24/854105524.db2.gz GSIRTCDNWTYDPC-RUZDIDTESA-N 0 3 418.585 4.419 20 0 HIADHN Cc1cccn2cc(COc3ccc(CN[C@@](C)(CO)c4ccccc4)cc3)nc12 ZINC000237857457 854109695 /nfs/dbraw/zinc/10/96/95/854109695.db2.gz UUUUSFBMADFWCS-VWLOTQADSA-N 0 3 401.510 4.219 20 0 HIADHN Cc1nn(Cc2ccc(Cl)cc2)c(C)c1CNCCC(=O)NC1CCCCC1 ZINC000237879942 854113748 /nfs/dbraw/zinc/11/37/48/854113748.db2.gz CQHYDHIQBXFBQR-UHFFFAOYSA-N 0 3 402.970 4.130 20 0 HIADHN NC(=O)Nc1ccc(CNCc2cccc(NC(=O)c3ccc(Cl)cc3)c2)cc1 ZINC000237902984 854116638 /nfs/dbraw/zinc/11/66/38/854116638.db2.gz WQBQMYLYCWBPAN-UHFFFAOYSA-N 0 3 408.889 4.373 20 0 HIADHN NC(=O)Nc1ccc(CNCc2cccc(NC(=O)c3ccccc3Cl)c2)cc1 ZINC000237903030 854117107 /nfs/dbraw/zinc/11/71/07/854117107.db2.gz XTLDQONHSPCDDE-UHFFFAOYSA-N 0 3 408.889 4.373 20 0 HIADHN CCCCNC(=O)[C@@H]1CC[C@@H](C)N(CC(=O)N[C@H](C)c2cccc3ccccc32)C1 ZINC000249902903 854192791 /nfs/dbraw/zinc/19/27/91/854192791.db2.gz XDPBRCHUJHXAAP-SFHLNBCPSA-N 0 3 409.574 4.034 20 0 HIADHN Cc1cccc([C@H]2CCCN2CC(=O)N2CCC[C@H]2c2ccc3c(c2)OCCO3)c1 ZINC000251196478 854197689 /nfs/dbraw/zinc/19/76/89/854197689.db2.gz QOJSHELBWRHOTF-YADHBBJMSA-N 0 3 406.526 4.267 20 0 HIADHN Cc1nc(COc2ccc(F)cc2)sc1C(=O)N[C@H](C)CN1CCC[C@H](C)C1 ZINC000255958324 854230452 /nfs/dbraw/zinc/23/04/52/854230452.db2.gz HXRFGMLEEIZNFL-LSDHHAIUSA-N 0 3 405.539 4.020 20 0 HIADHN Cc1nc(COc2ccc(F)cc2)sc1C(=O)N[C@@H](C)CN1CCC[C@H](C)C1 ZINC000255958323 854230530 /nfs/dbraw/zinc/23/05/30/854230530.db2.gz HXRFGMLEEIZNFL-GJZGRUSLSA-N 0 3 405.539 4.020 20 0 HIADHN CCN(C(=O)c1ccc(Br)cn1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000261400968 854248936 /nfs/dbraw/zinc/24/89/36/854248936.db2.gz GKBKADJQNZSJHD-QAPCUYQASA-N 0 3 402.336 4.142 20 0 HIADHN COc1cccc([C@@H](CNc2ccc3nnc(-c4ccccc4)n3n2)N2CCCC2)c1 ZINC000301152479 854313702 /nfs/dbraw/zinc/31/37/02/854313702.db2.gz LBYVYZJWSGTTIZ-OAQYLSRUSA-N 0 3 414.513 4.049 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(NC[C@@H]3CCC[N@H+](Cc4cccs4)C3)nc2)n1 ZINC000301175433 854320208 /nfs/dbraw/zinc/32/02/08/854320208.db2.gz LZYPSZVMTYUQLW-INIZCTEOSA-N 0 3 409.559 4.192 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(NC[C@@H]3CCC[N@@H+](Cc4cccs4)C3)nc2)n1 ZINC000301175433 854320213 /nfs/dbraw/zinc/32/02/13/854320213.db2.gz LZYPSZVMTYUQLW-INIZCTEOSA-N 0 3 409.559 4.192 20 0 HIADHN COc1ccccc1[C@H](CNc1ccc2nnc(-c3ccccc3)n2n1)N1CCCC1 ZINC000301180315 854321346 /nfs/dbraw/zinc/32/13/46/854321346.db2.gz YWGXEAJJIUREAD-FQEVSTJZSA-N 0 3 414.513 4.049 20 0 HIADHN COc1ccccc1[C@@H](CNc1ccc2nnc(-c3ccccc3)n2n1)N1CCCC1 ZINC000301180316 854321449 /nfs/dbraw/zinc/32/14/49/854321449.db2.gz YWGXEAJJIUREAD-HXUWFJFHSA-N 0 3 414.513 4.049 20 0 HIADHN CN(C)[C@H](CNc1cc(C(F)(F)F)nc(-c2ccncc2)n1)c1ccc(F)cc1 ZINC000301350019 854367424 /nfs/dbraw/zinc/36/74/24/854367424.db2.gz IPBMWUJAYPUDNA-MRXNPFEDSA-N 0 3 405.399 4.411 20 0 HIADHN CN(C)[C@@H](CNc1ncccc1C(=O)N1CCc2ccccc21)c1ccc(F)cc1 ZINC000301383834 854377368 /nfs/dbraw/zinc/37/73/68/854377368.db2.gz VXUHOMWFFZDEFZ-QFIPXVFZSA-N 0 3 404.489 4.138 20 0 HIADHN Cc1nc(-c2ccc(NC3CC[NH+]([C@@H](C)c4ccccc4)CC3)nc2)[n-]c(=O)c1C ZINC000301388994 854379853 /nfs/dbraw/zinc/37/98/53/854379853.db2.gz FHTCNOOBUSHKOP-SFHVURJKSA-N 0 3 403.530 4.499 20 0 HIADHN Cc1nc(-c2ccc(NCC3CC[NH+](Cc4cccs4)CC3)nc2)[n-]c(=O)c1C ZINC000301404567 854384554 /nfs/dbraw/zinc/38/45/54/854384554.db2.gz KYGOZRAZYXALBC-UHFFFAOYSA-N 0 3 409.559 4.247 20 0 HIADHN Cc1nc2ccc(Br)cc2c(N[C@H]2CCC[C@@H](S(C)(=O)=O)C2)c1C ZINC000301407917 854385426 /nfs/dbraw/zinc/38/54/26/854385426.db2.gz VZPQOVXWAWKUCJ-LSDHHAIUSA-N 0 3 411.365 4.382 20 0 HIADHN Cc1ccc([C@@H](CNc2ccc(-c3nc(C)c(C)c(=O)[n-]3)cn2)[NH+]2CCCC2)cc1 ZINC000301428574 854392229 /nfs/dbraw/zinc/39/22/29/854392229.db2.gz UVGXRIPTWFNEFV-OAQYLSRUSA-N 0 3 403.530 4.418 20 0 HIADHN CC1CCN(C(=O)c2ccc(NC[C@@H](c3ccc(Cl)cc3)N(C)C)nc2)CC1 ZINC000301471334 854402248 /nfs/dbraw/zinc/40/22/48/854402248.db2.gz JTKVPKZORKDZAS-FQEVSTJZSA-N 0 3 400.954 4.322 20 0 HIADHN Cc1nc2ccc(Br)cc2c(N2CCC[C@@H](Cn3ccnn3)C2)c1C ZINC000301767198 854462091 /nfs/dbraw/zinc/46/20/91/854462091.db2.gz BRNOMYKYYBTMEP-OAHLLOKOSA-N 0 3 400.324 4.122 20 0 HIADHN COc1cccc([C@@H](CNc2ncnc3nc(SC)sc32)N2CCCC2)c1 ZINC000301933837 854496840 /nfs/dbraw/zinc/49/68/40/854496840.db2.gz QYZWUFUBWLSNPY-OAHLLOKOSA-N 0 3 401.561 4.066 20 0 HIADHN Cc1ccc2nccc(N3CCC(C(=O)c4ccc5c(c4)NC(=O)[C@H](C)O5)CC3)c2c1 ZINC000302159503 854539733 /nfs/dbraw/zinc/53/97/33/854539733.db2.gz OLAUEDZNCYWXBS-INIZCTEOSA-N 0 3 415.493 4.362 20 0 HIADHN CN(C[C@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)c1ccc(Cl)c(Cl)c1 ZINC000437315671 862581559 /nfs/dbraw/zinc/58/15/59/862581559.db2.gz RQAMJGXTTZYKCX-MRXNPFEDSA-N 0 3 413.370 4.136 20 0 HIADHN CN(C)[C@H](CNC(=O)c1c2c(sc1-n1cccc1)CSCC2)c1ccccc1 ZINC000302831100 854647333 /nfs/dbraw/zinc/64/73/33/854647333.db2.gz AGUVEWHJXVEAKB-GOSISDBHSA-N 0 3 411.596 4.361 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Cc1cccc(C(F)(F)F)c1)c1cccc(OC)c1 ZINC000302878871 854664880 /nfs/dbraw/zinc/66/48/80/854664880.db2.gz MDIREOGUCSIRNW-HXUWFJFHSA-N 0 3 408.464 4.456 20 0 HIADHN COc1ccc([C@@H](CNC(=O)N[C@H](c2ccc(OC)cc2)C2CC2)N2CCCC2)cc1 ZINC000302896753 854669731 /nfs/dbraw/zinc/66/97/31/854669731.db2.gz LVZNWRFOFXVWIU-RPWUZVMVSA-N 0 3 423.557 4.291 20 0 HIADHN COc1cccc([C@H](CNC(=O)N[C@@H](C)c2ccc(F)cc2F)N2CCCC2)c1 ZINC000302900654 854671844 /nfs/dbraw/zinc/67/18/44/854671844.db2.gz QIDSVSMTIAVRRJ-BTYIYWSLSA-N 0 3 403.473 4.171 20 0 HIADHN CN(Cc1ccc(Br)cc1)C(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000302903321 854672918 /nfs/dbraw/zinc/67/29/18/854672918.db2.gz VKBCTWPMKGAREV-QGZVFWFLSA-N 0 3 422.392 4.489 20 0 HIADHN CCc1noc2ncc(C(=O)N(CCN(C)C)Cc3cccc(C(F)(F)F)c3)cc12 ZINC000302988891 854711487 /nfs/dbraw/zinc/71/14/87/854711487.db2.gz MDPGDGPSTGYXHK-UHFFFAOYSA-N 0 3 420.435 4.008 20 0 HIADHN Cc1ccc([C@H](CNC(=O)[C@@H]2C[C@H]2c2ccc(Br)cc2)N(C)C)cc1 ZINC000303054714 854740444 /nfs/dbraw/zinc/74/04/44/854740444.db2.gz WIRZMEXXUYFCMI-ZCNNSNEGSA-N 0 3 401.348 4.280 20 0 HIADHN COc1ccc(OC)c(NC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)c1 ZINC000303071283 854747293 /nfs/dbraw/zinc/74/72/93/854747293.db2.gz XMGGSBIGJJJPSP-HXUWFJFHSA-N 0 3 408.420 4.097 20 0 HIADHN C[C@@H](Oc1ccccc1Cl)C(=O)N1CCCN(CCCc2ccccc2)CC1 ZINC000303104993 854763422 /nfs/dbraw/zinc/76/34/22/854763422.db2.gz IYZHJXNBWIANJQ-LJQANCHMSA-N 0 3 400.950 4.274 20 0 HIADHN O=C(CCc1ccccc1OC(F)(F)F)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000303186808 854807864 /nfs/dbraw/zinc/80/78/64/854807864.db2.gz LVLACTDBYWZQKJ-IBGZPJMESA-N 0 3 406.448 4.299 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)C1(NC(=O)OC(C)(C)C)CCCC1)c1ccsc1 ZINC000303191779 854809940 /nfs/dbraw/zinc/80/99/40/854809940.db2.gz WWFKRZFRBGBFKH-KRWDZBQOSA-N 0 3 409.596 4.085 20 0 HIADHN O=C(CCc1cc(Br)cs1)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000303292912 854856609 /nfs/dbraw/zinc/85/66/09/854856609.db2.gz LDHLOQDXDGQNRF-QGZVFWFLSA-N 0 3 407.377 4.224 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)NC[C@H](C)N(C)Cc2ccccc2)c(OC)c1 ZINC000303434826 854935351 /nfs/dbraw/zinc/93/53/51/854935351.db2.gz DEPVXNTWYLEERR-AVRDEDQJSA-N 0 3 411.546 4.071 20 0 HIADHN C[C@H](CNC(=O)[C@H]1C[C@H]1c1ccc(Br)cc1)N(C)Cc1ccccc1 ZINC000303450936 854949662 /nfs/dbraw/zinc/94/96/62/854949662.db2.gz JMVOPINLYXHVIG-XPGWFJOJSA-N 0 3 401.348 4.189 20 0 HIADHN O=C(NC1CCN(Cc2ccccc2)CC1)c1cccc(Br)c1Cl ZINC000303547343 855033013 /nfs/dbraw/zinc/03/30/13/855033013.db2.gz CAYBILUZULTIRP-UHFFFAOYSA-N 0 3 407.739 4.497 20 0 HIADHN CC(=O)Nc1ccc(S(=O)(=O)CCCNC2(c3ccc(Cl)cc3)CCC2)cc1 ZINC000303564528 855042654 /nfs/dbraw/zinc/04/26/54/855042654.db2.gz ARTLCYJPAKLVGL-UHFFFAOYSA-N 0 3 420.962 4.131 20 0 HIADHN O=C(c1cc(-c2cccnc2)on1)N(CCN1CCCC1)Cc1ccc(Cl)cc1 ZINC000303568236 855044975 /nfs/dbraw/zinc/04/49/75/855044975.db2.gz YGIPPZAUQVCJFS-UHFFFAOYSA-N 0 3 410.905 4.128 20 0 HIADHN COc1cc(F)c([C@H](C)NC(=O)N[C@H](CN2CCCC2)c2ccccc2)cc1OC ZINC000303586068 855059851 /nfs/dbraw/zinc/05/98/51/855059851.db2.gz QNEQMBOWWCCVHB-OXJNMPFZSA-N 0 3 415.509 4.040 20 0 HIADHN Cc1ccc(Cl)cc1N1CCN(C(=O)c2oc3ccccc3c2CN(C)C)CC1 ZINC000303587800 855061006 /nfs/dbraw/zinc/06/10/06/855061006.db2.gz TYQWRSJESOSFBY-UHFFFAOYSA-N 0 3 411.933 4.419 20 0 HIADHN CCCN(C(=O)c1cccc(-n2cccn2)c1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000303604458 855072010 /nfs/dbraw/zinc/07/20/10/855072010.db2.gz APJYZTUJIHOERQ-DEOSSOPVSA-N 0 3 402.542 4.389 20 0 HIADHN CCN(Cc1ccc(OC)c(OC)c1)C(=O)CN1C[C@@H](c2ccc(F)cc2)C[C@H]1C ZINC000303694696 855138004 /nfs/dbraw/zinc/13/80/04/855138004.db2.gz ABDONOTUMQRBLB-XLIONFOSSA-N 0 3 414.521 4.069 20 0 HIADHN Cc1cc(=O)oc2cc(OCCN3CCC[C@H]3c3ccc4c(c3)OCCO4)ccc12 ZINC000303786676 855197934 /nfs/dbraw/zinc/19/79/34/855197934.db2.gz DRHSCDAFRAFHRN-FQEVSTJZSA-N 0 3 407.466 4.089 20 0 HIADHN Cc1ccc(C[C@@H](C)N(C)C(=O)NCCCCN2CCN(c3ccccc3)CC2)cc1 ZINC000303805206 855209367 /nfs/dbraw/zinc/20/93/67/855209367.db2.gz MLVKHAQGQFNGGK-HSZRJFAPSA-N 0 3 422.617 4.170 20 0 HIADHN CSc1ccc(C)c(C(=O)Nc2ccc(C(=O)N(C)[C@H]3CCCN(C)C3)cc2)c1 ZINC000303821406 855222909 /nfs/dbraw/zinc/22/29/09/855222909.db2.gz ABDXAWYLAXADGY-IBGZPJMESA-N 0 3 411.571 4.135 20 0 HIADHN COc1cc(OC)c(NC(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)cc1Cl ZINC000303851740 855247588 /nfs/dbraw/zinc/24/75/88/855247588.db2.gz KVAZKOCHFPQMMR-MRXNPFEDSA-N 0 3 417.937 4.486 20 0 HIADHN C[C@H]1C[C@H](N(C)S(=O)(=O)Cc2cccc3cccnc32)CCN1Cc1ccccc1 ZINC000303868572 855260514 /nfs/dbraw/zinc/26/05/14/855260514.db2.gz XJUOIKUEHHMDGQ-WMZHIEFXSA-N 0 3 423.582 4.050 20 0 HIADHN CCOC(=O)Nc1ccc(NC(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)cc1 ZINC000303935028 855301818 /nfs/dbraw/zinc/30/18/18/855301818.db2.gz WHXAVJNCOCJYGJ-GOSISDBHSA-N 0 3 410.518 4.383 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1ncoc1-c1ccc(C)cc1)c1cccc(OC)c1 ZINC000303955396 855318880 /nfs/dbraw/zinc/31/88/80/855318880.db2.gz XAMBDEZSQLPCGR-OAQYLSRUSA-N 0 3 407.514 4.472 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)[C@]2(C)CCCc3ccccc32)cc1)[C@@H]1CCCN(C)C1 ZINC000303960704 855322445 /nfs/dbraw/zinc/32/24/45/855322445.db2.gz WNHCGRDEVADICF-ATIYNZHBSA-N 0 3 419.569 4.086 20 0 HIADHN Cc1cc(C(=O)NCCCN2CCc3ccccc3C2)ccc1NC(=O)CC(C)C ZINC000303970916 855330380 /nfs/dbraw/zinc/33/03/80/855330380.db2.gz DZQVKWWLJAYJFZ-UHFFFAOYSA-N 0 3 407.558 4.158 20 0 HIADHN Cc1cc(C(=O)N2CCN(Cc3ccccc3)C[C@H](C)C2)ccc1Br ZINC000323797473 855396797 /nfs/dbraw/zinc/39/67/97/855396797.db2.gz KCVMMHVMMSBJPI-INIZCTEOSA-N 0 3 401.348 4.352 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCN(C(=O)c2cc(F)ccc2Br)C1 ZINC000323922303 855397644 /nfs/dbraw/zinc/39/76/44/855397644.db2.gz OBGOWYBTJYQMAV-HNNXBMFYSA-N 0 3 405.311 4.182 20 0 HIADHN O=C(Nc1ccc(Br)cc1OC(F)(F)F)c1ccc2c(c1)CNC2 ZINC000326201343 855407390 /nfs/dbraw/zinc/40/73/90/855407390.db2.gz NVJFBDXEGNCSCQ-UHFFFAOYSA-N 0 3 401.182 4.203 20 0 HIADHN COc1ccc(Br)c(CNC2CCC(NC(=O)OC(C)(C)C)CC2)c1 ZINC000378915108 855424049 /nfs/dbraw/zinc/42/40/49/855424049.db2.gz VRMOYMBKVQEJRG-UHFFFAOYSA-N 0 3 413.356 4.383 20 0 HIADHN CCOc1c(Br)cc(CNCC2=CCCOC2)cc1Br ZINC000379736171 855428015 /nfs/dbraw/zinc/42/80/15/855428015.db2.gz MKUGSSMQDOUNOD-UHFFFAOYSA-N 0 3 405.130 4.047 20 0 HIADHN COc1ccc(Br)cc1CNC[C@@H](NC(=O)OC(C)(C)C)C(C)C ZINC000382748657 855434691 /nfs/dbraw/zinc/43/46/91/855434691.db2.gz OIYSPSZDFXNCNH-OAHLLOKOSA-N 0 3 401.345 4.097 20 0 HIADHN CCn1cc(Br)cc1C(=O)N1CCCN(Cc2ccccc2)C[C@H]1C ZINC000383049844 855435753 /nfs/dbraw/zinc/43/57/53/855435753.db2.gz HXEJQOSXVMMTEI-MRXNPFEDSA-N 0 3 404.352 4.007 20 0 HIADHN CCOc1c(Br)cc(Br)cc1CN[C@@H]1C[C@@H](C)O[C@H]1C ZINC000384964272 855440728 /nfs/dbraw/zinc/44/07/28/855440728.db2.gz XDKDVYPVWIIMQQ-ISTVAULSSA-N 0 3 407.146 4.266 20 0 HIADHN COc1ccc(Br)c(C(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000388590344 855448101 /nfs/dbraw/zinc/44/81/01/855448101.db2.gz SPVAFKDUPIZGRC-KRWDZBQOSA-N 0 3 417.347 4.194 20 0 HIADHN C[C@]1(CNC(=O)c2cc(Br)cnc2Cl)CCCN1Cc1ccccc1 ZINC000397927898 855473817 /nfs/dbraw/zinc/47/38/17/855473817.db2.gz CEMFMCBTILYWTQ-LJQANCHMSA-N 0 3 422.754 4.282 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)c2ccc(Cl)cc2Br)CN1Cc1ccccc1 ZINC000398163066 855476691 /nfs/dbraw/zinc/47/66/91/855476691.db2.gz WLACXCIGRUHWDC-CJNGLKHVSA-N 0 3 407.739 4.495 20 0 HIADHN Cc1ccc(-c2noc(CCC(=O)N[C@@H]3CCN([C@H](C)c4ccccc4)C3)n2)cc1F ZINC000409456057 855488095 /nfs/dbraw/zinc/48/80/95/855488095.db2.gz ZTSPPUHIWKKWFR-YLJYHZDGSA-N 0 3 422.504 4.068 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)c2ccnc(OCc3ccccc3)c2)C1 ZINC000409457142 855488536 /nfs/dbraw/zinc/48/85/36/855488536.db2.gz QELGTXJDEMFQHF-CVDCTZTESA-N 0 3 401.510 4.226 20 0 HIADHN Brc1ccc(-n2cc(CNC[C@@H](c3ccco3)N3CCCC3)cn2)cc1 ZINC000409488641 855506178 /nfs/dbraw/zinc/50/61/78/855506178.db2.gz WJXOEDIIMPYJMU-IBGZPJMESA-N 0 3 415.335 4.155 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)NC(c1ccccc1)c1ccccc1 ZINC000409525269 855523499 /nfs/dbraw/zinc/52/34/99/855523499.db2.gz JOMKHYATEFXSKE-UHFFFAOYSA-N 0 3 413.565 4.495 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)Cc1coc(-c2ccc(F)cc2)n1 ZINC000409714867 855617092 /nfs/dbraw/zinc/61/70/92/855617092.db2.gz MTPOIVXZUKXYJS-UHFFFAOYSA-N 0 3 409.505 4.046 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)CCCC1CCOCC1 ZINC000409837163 855680124 /nfs/dbraw/zinc/68/01/24/855680124.db2.gz FAGRJDVIRCVFAR-QFIPXVFZSA-N 0 3 410.562 4.174 20 0 HIADHN CN1CC[C@@H](NC(=O)[C@@H]2CCO[C@H]2c2ccc(Cl)c(F)c2)[C@H]1c1ccccc1 ZINC000409884529 855705783 /nfs/dbraw/zinc/70/57/83/855705783.db2.gz TXQLQDNZNPWWNO-OTNPHJDUSA-N 0 3 402.897 4.118 20 0 HIADHN Cc1ccc(-n2nc(C(=O)N(CCN(C)C)C3CCCCC3)c3c2CCC3)c(F)c1 ZINC000409889481 855707442 /nfs/dbraw/zinc/70/74/42/855707442.db2.gz XTJKBTPDUUHYPI-UHFFFAOYSA-N 0 3 412.553 4.145 20 0 HIADHN CCCc1noc2nc(CC)cc(C(=O)N(CCN(C)C)Cc3cccs3)c12 ZINC000409974649 855756161 /nfs/dbraw/zinc/75/61/61/855756161.db2.gz AERFYELFLPQGCB-UHFFFAOYSA-N 0 3 400.548 4.003 20 0 HIADHN CC(C)(C)[C@@H](CN1CCc2ccccc2C1)NC(=O)Cc1coc(-c2ccccc2)n1 ZINC000410050187 855800247 /nfs/dbraw/zinc/80/02/47/855800247.db2.gz BHMGPRIXQQIPMC-HSZRJFAPSA-N 0 3 417.553 4.473 20 0 HIADHN CC(C)[C@H](NC(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1)c1ccc(F)cc1 ZINC000410221334 855867607 /nfs/dbraw/zinc/86/76/07/855867607.db2.gz VJQUZOUSSINNAM-SVMVAKDDSA-N 0 3 405.558 4.054 20 0 HIADHN CN(C)[C@H](CNC(=O)NCc1cccc(NC(=O)c2ccccc2)c1)c1ccccc1 ZINC000410265365 855890225 /nfs/dbraw/zinc/89/02/25/855890225.db2.gz MLRCSCLGIYNUEB-HSZRJFAPSA-N 0 3 416.525 4.041 20 0 HIADHN COc1cccc2c1CC[C@@H](NCc1nnc3c(Cl)cc(C(F)(F)F)cn13)C2 ZINC000425914726 855996092 /nfs/dbraw/zinc/99/60/92/855996092.db2.gz HPQIGUZUDBLSQQ-CYBMUJFWSA-N 0 3 410.827 4.057 20 0 HIADHN COc1ccc([C@@H](CNC(=O)CCc2nc3c(cccc3C)[nH]2)N2CCCCC2)cc1 ZINC000426032313 856060049 /nfs/dbraw/zinc/06/00/49/856060049.db2.gz AEOKPECAPUACOT-JOCHJYFZSA-N 0 3 420.557 4.156 20 0 HIADHN COc1ccc([C@@H](CNC(=O)CCc2nc3cccc(C)c3[nH]2)N2CCCCC2)cc1 ZINC000426032313 856060053 /nfs/dbraw/zinc/06/00/53/856060053.db2.gz AEOKPECAPUACOT-JOCHJYFZSA-N 0 3 420.557 4.156 20 0 HIADHN C[C@@H](NC1CCN(S(=O)(=O)C(C)(C)C)CC1)c1nc(-c2ccccc2)cs1 ZINC000426035007 856062483 /nfs/dbraw/zinc/06/24/83/856062483.db2.gz KGMKUWUAOCMICC-OAHLLOKOSA-N 0 3 407.605 4.053 20 0 HIADHN Cc1cccc(C(NC(=O)N2CCN(C3CCOCC3)C[C@H]2C)c2cccc(C)c2)c1 ZINC000426045731 856070351 /nfs/dbraw/zinc/07/03/51/856070351.db2.gz CQANTARTNYRFCJ-OAQYLSRUSA-N 0 3 421.585 4.288 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)N[C@H]2CCCc3sc(Cl)cc32)cc1 ZINC000426053109 856075395 /nfs/dbraw/zinc/07/53/95/856075395.db2.gz VGCYFKXRSFKBFW-DLBZAZTESA-N 0 3 407.967 4.390 20 0 HIADHN COC(=O)C1CCC(N[C@@H](c2cccc(OC)c2)c2cc(F)ccc2OC)CC1 ZINC000426077719 856092101 /nfs/dbraw/zinc/09/21/01/856092101.db2.gz MFFQGTIPMUTATL-URWDPPFZSA-N 0 3 401.478 4.254 20 0 HIADHN O=C(NCC(F)(F)F)[C@H]1CCN(Cc2ccc(Oc3ccccc3F)c(F)c2)C1 ZINC000426105013 856110343 /nfs/dbraw/zinc/11/03/43/856110343.db2.gz SLIVQJKZTYFJCT-AWEZNQCLSA-N 0 3 414.374 4.258 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)C/C=C/c3ccccc3F)CC2)c1 ZINC000426180031 856159144 /nfs/dbraw/zinc/15/91/44/856159144.db2.gz WRCCNMRJKZATOC-JXMROGBWSA-N 0 3 409.549 4.256 20 0 HIADHN Cc1ccc(NC(=O)Nc2cccc3c2CCN(C(=O)[C@H]2CCCN2C2CC2)C3)cc1 ZINC000426313533 856240329 /nfs/dbraw/zinc/24/03/29/856240329.db2.gz NDCHRCKJTAKFTF-HSZRJFAPSA-N 0 3 418.541 4.151 20 0 HIADHN CCOc1cc(CN(C)C/C(C)=C/c2ccccc2)ccc1O[C@H](C)C(=O)N(C)C ZINC000426376023 856264762 /nfs/dbraw/zinc/26/47/62/856264762.db2.gz HWOUBHUVJJRDQJ-ZWUNQBBJSA-N 0 3 410.558 4.476 20 0 HIADHN CC(C)(C)N1C[C@@H](c2nc(Cc3ccc(C(F)(F)F)cn3)no2)[C@H](C(F)(F)F)C1 ZINC000426427540 856286101 /nfs/dbraw/zinc/28/61/01/856286101.db2.gz FLMRSLBWIJTQLT-CHWSQXEVSA-N 0 3 422.373 4.450 20 0 HIADHN CCOc1ccc(NC(=O)c2ccc(NC(=O)CN3CC[C@@H]4CCC[C@H]43)cc2)cc1 ZINC000426464842 856304944 /nfs/dbraw/zinc/30/49/44/856304944.db2.gz YGLSWHSDKBDYPB-HTAPYJJXSA-N 0 3 407.514 4.151 20 0 HIADHN COc1ccc(CN2CCc3cccc(OC)c3CC2)c(OCc2cccnc2)c1 ZINC000426568100 856353290 /nfs/dbraw/zinc/35/32/90/856353290.db2.gz YUVZQAWLRWCYBJ-UHFFFAOYSA-N 0 3 404.510 4.279 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)Nc3ccc(C(F)(F)F)cc3)CC2)C[C@H](C)O1 ZINC000426640073 856389532 /nfs/dbraw/zinc/38/95/32/856389532.db2.gz ZQJGHECAUUQIMX-HOTGVXAUSA-N 0 3 413.484 4.449 20 0 HIADHN CN(C)Cc1cccc(NC(=O)N(C)[C@@H](c2ccc(Cl)cc2)c2cnccn2)c1 ZINC000426644814 856391428 /nfs/dbraw/zinc/39/14/28/856391428.db2.gz XVUCCTSOKKBZRE-NRFANRHFSA-N 0 3 409.921 4.445 20 0 HIADHN COc1cc(CN(C)[C@H](C)c2cccc(N3CCCS3(=O)=O)c2)ccc1SC ZINC000426796055 856483687 /nfs/dbraw/zinc/48/36/87/856483687.db2.gz ZOFHHKICWNVXJB-MRXNPFEDSA-N 0 3 420.600 4.150 20 0 HIADHN CCc1c(C(=O)N(Cc2ccccc2Br)C2CCN(C)CC2)ccn1C ZINC000426798828 856485735 /nfs/dbraw/zinc/48/57/35/856485735.db2.gz JTNDKEGTHFSMGY-UHFFFAOYSA-N 0 3 418.379 4.087 20 0 HIADHN COc1ccc(CN(C)[C@@H](C)c2cccc(N3CCCS3(=O)=O)c2)cc1Cl ZINC000426803564 856488202 /nfs/dbraw/zinc/48/82/02/856488202.db2.gz NLXUCRRVPFIBOY-HNNXBMFYSA-N 0 3 408.951 4.082 20 0 HIADHN C[C@@H](C(=O)Nc1ccc(C(=O)N(C)[C@H]2CCCN(C)C2)cc1)c1ccc(Cl)s1 ZINC000426947406 856557287 /nfs/dbraw/zinc/55/72/87/856557287.db2.gz DYIVKKROXCDRMW-PBHICJAKSA-N 0 3 419.978 4.310 20 0 HIADHN Cc1cccc2c(CCC(=O)N3CCC(CCN4C[C@@H](C)O[C@@H](C)C4)CC3)c[nH]c21 ZINC000427291383 856755582 /nfs/dbraw/zinc/75/55/82/856755582.db2.gz FUEBQNNAHIXZPK-BGYRXZFFSA-N 0 3 411.590 4.147 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)c3ccc(Cl)c4cccnc34)CC2)C[C@H](C)O1 ZINC000427299576 856759828 /nfs/dbraw/zinc/75/98/28/856759828.db2.gz OHYHJXURYXKTHG-IRXDYDNUSA-N 0 3 415.965 4.240 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)c3cc(Oc4ccccc4)ccn3)CC2)C[C@H](C)O1 ZINC000427299375 856759986 /nfs/dbraw/zinc/75/99/86/856759986.db2.gz MDIOQFWTWUSBSC-PMACEKPBSA-N 0 3 423.557 4.225 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)[C@@H]3C[C@@]34CCCc3ccccc34)CC2)C[C@@H](C)O1 ZINC000427308551 856762837 /nfs/dbraw/zinc/76/28/37/856762837.db2.gz OGFUULZWMOAIKP-ZLAJYTSZSA-N 0 3 410.602 4.019 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)CSc3ccc(Cl)cc3)CC2)C[C@H](C)O1 ZINC000427312011 856764592 /nfs/dbraw/zinc/76/45/92/856764592.db2.gz GUAXYJOTZWSDAN-IRXDYDNUSA-N 0 3 411.011 4.170 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)c3ccc(-c4ccc(F)cc4)o3)CC2)C[C@H](C)O1 ZINC000427319897 856767779 /nfs/dbraw/zinc/76/77/79/856767779.db2.gz JXKLEKLRKRBMFR-ROUUACIJSA-N 0 3 414.521 4.437 20 0 HIADHN CCCOc1ccc(CCC(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)cc1 ZINC000427321750 856770374 /nfs/dbraw/zinc/77/03/74/856770374.db2.gz QSXIWDHAUOEZOB-SFTDATJTSA-N 0 3 416.606 4.146 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)[C@@H]3C[C@@H]3c3c(F)cccc3Cl)CC2)C[C@H](C)O1 ZINC000427341274 856781732 /nfs/dbraw/zinc/78/17/32/856781732.db2.gz CFJLMPNWXWLGAM-OGWHTMIXSA-N 0 3 422.972 4.321 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)[C@@H]3C[C@H]3c3c(F)cccc3Cl)CC2)C[C@H](C)O1 ZINC000427341276 856782155 /nfs/dbraw/zinc/78/21/55/856782155.db2.gz CFJLMPNWXWLGAM-UKBAYJJMSA-N 0 3 422.972 4.321 20 0 HIADHN COc1ccccc1CC(C)(C)C(=O)N1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000427359124 856792336 /nfs/dbraw/zinc/79/23/36/856792336.db2.gz TZLQGPDMOQXGBG-PMACEKPBSA-N 0 3 416.606 4.002 20 0 HIADHN FC(F)(F)c1cnc2c(c1)[C@H](NCc1cccc(CN3CCOCC3)c1)CCC2 ZINC000427563026 856866957 /nfs/dbraw/zinc/86/69/57/856866957.db2.gz KHBZZPYLLMBTFI-HXUWFJFHSA-N 0 3 405.464 4.100 20 0 HIADHN FC(F)(F)c1cnc2c(c1)[C@@H](NCc1ccccc1CN1CCOCC1)CCC2 ZINC000427564999 856867437 /nfs/dbraw/zinc/86/74/37/856867437.db2.gz LVWCCJFGQQNYSH-FQEVSTJZSA-N 0 3 405.464 4.100 20 0 HIADHN COc1cccc([C@@H](CN[C@@H](C)c2ncc(Br)cc2F)N2CCCC2)c1 ZINC000427600511 856884207 /nfs/dbraw/zinc/88/42/07/856884207.db2.gz GWXTYGMOHFMJAU-IFXJQAMLSA-N 0 3 422.342 4.480 20 0 HIADHN CO[C@H](C)c1nc(CN2CCCN(CCCOc3cc(C)cc(C)c3)CC2)cs1 ZINC000437499426 862854606 /nfs/dbraw/zinc/85/46/06/862854606.db2.gz SBKUDZLUQXZSCK-HXUWFJFHSA-N 0 3 417.619 4.444 20 0 HIADHN COc1cccc(N2CC[C@H](CN[C@H](C)c3ncc(Br)cc3F)C2)c1 ZINC000427694062 856911569 /nfs/dbraw/zinc/91/15/69/856911569.db2.gz IHIOMGNHQLDLCN-ZIAGYGMSSA-N 0 3 408.315 4.169 20 0 HIADHN C[C@H](CS(=O)(=O)N(C)[C@H]1CCN(Cc2ccccc2)[C@H](C)C1)c1ccccc1 ZINC000427847604 856979722 /nfs/dbraw/zinc/97/97/22/856979722.db2.gz AMPSPOLDHMHRSC-VIZSFHNOSA-N 0 3 400.588 4.105 20 0 HIADHN CCSc1cc(CN[C@H](C)CC(=O)Nc2ccc(Br)cc2)ccn1 ZINC000427871741 856989656 /nfs/dbraw/zinc/98/96/56/856989656.db2.gz BERBFGHEQDCLNM-CYBMUJFWSA-N 0 3 408.365 4.463 20 0 HIADHN Cc1ccc(-c2c[nH]cc2C(=O)Nc2cccc3c2CCN(CC(C)(C)O)C3)s1 ZINC000427895875 856996872 /nfs/dbraw/zinc/99/68/72/856996872.db2.gz OZSGHUZOORWNRE-UHFFFAOYSA-N 0 3 409.555 4.433 20 0 HIADHN CCNC(=O)Nc1ccc(C)c(NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)c1 ZINC000427940174 857016177 /nfs/dbraw/zinc/01/61/77/857016177.db2.gz CKZMDEJIDXDUIB-GOSISDBHSA-N 0 3 412.509 4.126 20 0 HIADHN CCOC(=O)c1c([N-]C(=O)c2ncc(F)cc2F)sc2c1CC(C)(C)[NH2+]C2(C)C ZINC000428323442 857154050 /nfs/dbraw/zinc/15/40/50/857154050.db2.gz BFVIHFDQBOCINV-UHFFFAOYSA-N 0 3 423.485 4.010 20 0 HIADHN Cc1c(C(=O)NC[C@H]2CN(Cc3ccccc3)CCCO2)cccc1-c1ccccn1 ZINC000428435379 857203712 /nfs/dbraw/zinc/20/37/12/857203712.db2.gz CFPFBFBCOXDWJM-QFIPXVFZSA-N 0 3 415.537 4.078 20 0 HIADHN O=C(N1CCOc2ccc(F)cc2C1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000428442100 857204760 /nfs/dbraw/zinc/20/47/60/857204760.db2.gz ZHONATZGFLIYHN-NRFANRHFSA-N 0 3 422.422 4.001 20 0 HIADHN COc1cc(CN2CC[C@@H](O)[C@@H](C)C2)ccc1OCc1ccc(Br)cc1 ZINC000428473630 857214990 /nfs/dbraw/zinc/21/49/90/857214990.db2.gz NMZCSFCIGJLHDM-HNAYVOBHSA-N 0 3 420.347 4.239 20 0 HIADHN c1csc(-c2nn(-c3ccccc3)cc2CN2CCC(Cn3cncn3)CC2)c1 ZINC000428477609 857217147 /nfs/dbraw/zinc/21/71/47/857217147.db2.gz UVSQETSLTSBIJD-UHFFFAOYSA-N 0 3 404.543 4.105 20 0 HIADHN CC(C)COc1cccc(CN(C)[C@H](C)c2cccc(N3CCCS3(=O)=O)c2)c1 ZINC000428478850 857217863 /nfs/dbraw/zinc/21/78/63/857217863.db2.gz GZHWXADTJPYOLT-LJQANCHMSA-N 0 3 416.587 4.454 20 0 HIADHN CC(C)COc1ccc(CN(C)[C@@H](C)c2cccc(N3CCCS3(=O)=O)c2)cc1 ZINC000428477685 857217927 /nfs/dbraw/zinc/21/79/27/857217927.db2.gz HAERPMDJSBKPHT-IBGZPJMESA-N 0 3 416.587 4.454 20 0 HIADHN CC1CCN([C@@H](CNC(=O)N2CCC(c3ccncc3)CC2)c2ccccc2)CC1 ZINC000428485756 857221988 /nfs/dbraw/zinc/22/19/88/857221988.db2.gz UWRZGHZMXLXNOF-DEOSSOPVSA-N 0 3 406.574 4.444 20 0 HIADHN CCc1[nH]c(-c2ccc(Cl)cc2)nc1C(=O)Nc1cccc(CN2CC[C@@H](O)C2)c1 ZINC000428535549 857247423 /nfs/dbraw/zinc/24/74/23/857247423.db2.gz HSWPGLNBGSFBMP-LJQANCHMSA-N 0 3 424.932 4.111 20 0 HIADHN OC[C@@H](CNCc1sccc1Br)Cc1cccc(Br)c1 ZINC000428535603 857247887 /nfs/dbraw/zinc/24/78/87/857247887.db2.gz LKZQBXYXDANGLG-GFCCVEGCSA-N 0 3 419.182 4.214 20 0 HIADHN OC[C@H](CNCc1sccc1Br)Cc1ccccc1Br ZINC000428540832 857253255 /nfs/dbraw/zinc/25/32/55/857253255.db2.gz CYQBEWXWKYACRK-NSHDSACASA-N 0 3 419.182 4.214 20 0 HIADHN CCCOc1ccc(C(=O)Nc2cccc(CN3CC[C@H](O)C3)c2)c(OC(C)C)c1 ZINC000428550390 857259559 /nfs/dbraw/zinc/25/95/59/857259559.db2.gz ISHXVZZWIAZOHD-FQEVSTJZSA-N 0 3 412.530 4.082 20 0 HIADHN COc1ccc2nc(CNC[C@H](CO)Cc3ccccc3Br)sc2c1 ZINC000428553954 857264177 /nfs/dbraw/zinc/26/41/77/857264177.db2.gz YKRCRNPJLUTUMS-CYBMUJFWSA-N 0 3 421.360 4.008 20 0 HIADHN COc1ccc(OCc2ccccn2)c(CNC[C@]2(CO)C[C@H]2c2ccc(F)cc2)c1 ZINC000428557891 857265048 /nfs/dbraw/zinc/26/50/48/857265048.db2.gz JYOWAYWMMDRXMS-ZCYQVOJMSA-N 0 3 422.500 4.064 20 0 HIADHN COc1ccc(OCc2ccccn2)c(CNC[C@]2(CO)C[C@@H]2c2ccc(F)cc2)c1 ZINC000428557889 857265381 /nfs/dbraw/zinc/26/53/81/857265381.db2.gz JYOWAYWMMDRXMS-NOZRDPDXSA-N 0 3 422.500 4.064 20 0 HIADHN Cn1c(CNC[C@@]2(Cc3ccc(F)cc3)CCC[C@H]2O)nc2cc(Cl)ccc21 ZINC000428573952 857269435 /nfs/dbraw/zinc/26/94/35/857269435.db2.gz QJIQXNXUTQWFFF-IRLDBZIGSA-N 0 3 401.913 4.229 20 0 HIADHN Clc1ccc(-n2cc(CNC[C@@H]3CCO[C@H]3c3ccccc3)nn2)c(Cl)c1 ZINC000428687387 857297645 /nfs/dbraw/zinc/29/76/45/857297645.db2.gz VSPNJYVUMOLFLN-YWZLYKJASA-N 0 3 403.313 4.442 20 0 HIADHN COc1cc(Br)c(CNC[C@@H]2CCO[C@H]2c2ccccc2)c(OC)c1 ZINC000428697692 857300775 /nfs/dbraw/zinc/30/07/75/857300775.db2.gz BNORAJKQXORPHT-YWZLYKJASA-N 0 3 406.320 4.334 20 0 HIADHN O=S1(=O)CCC2(CCN(CCCCOc3cccc(C(F)(F)F)c3)CC2)CC1 ZINC000428701358 857301530 /nfs/dbraw/zinc/30/15/30/857301530.db2.gz OGZVMPARQMXUPT-UHFFFAOYSA-N 0 3 419.509 4.155 20 0 HIADHN COc1ccc(CN(Cc2ccncc2)[C@@H]2CCCN(Cc3ccccc3)C2)cn1 ZINC000428775592 857332153 /nfs/dbraw/zinc/33/21/53/857332153.db2.gz BSDAVBFZAWDHRY-XMMPIXPASA-N 0 3 402.542 4.152 20 0 HIADHN FC(F)n1ccnc1CN(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000428807828 857353210 /nfs/dbraw/zinc/35/32/10/857353210.db2.gz SUUFKXVDURJMAC-OAQYLSRUSA-N 0 3 411.500 4.340 20 0 HIADHN C[C@H](c1ccccc1)[C@@H](NCc1cn(-c2ccccc2)nc1-c1ccccc1)C(N)=O ZINC000428846147 857370638 /nfs/dbraw/zinc/37/06/38/857370638.db2.gz AVFIUNPWLQLLDQ-NTKDMRAZSA-N 0 3 410.521 4.287 20 0 HIADHN CC(C)N(CC(=O)NCc1ccc(C(=O)N2CCCC2)cc1)[C@H](C)c1ccccc1 ZINC000428864995 857377107 /nfs/dbraw/zinc/37/71/07/857377107.db2.gz FLMTYLPXNOWZPH-HXUWFJFHSA-N 0 3 407.558 4.010 20 0 HIADHN Cc1ccccc1C(=O)NC1CCN(C(=O)CN(C(C)C)[C@H](C)c2ccccc2)CC1 ZINC000428873613 857380737 /nfs/dbraw/zinc/38/07/37/857380737.db2.gz VITLXQYZEYMXDJ-OAQYLSRUSA-N 0 3 421.585 4.187 20 0 HIADHN O=C(Nc1ccc(Cl)cn1)[C@H]1CCCN(Cc2c[nH]nc2-c2ccsc2)C1 ZINC000437592496 862906422 /nfs/dbraw/zinc/90/64/22/862906422.db2.gz LVOLMRDXWONMQV-ZDUSSCGKSA-N 0 3 401.923 4.037 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3cc(Cl)ccc3N(C)C)CC2)C[C@H](C)O1 ZINC000428897280 857399187 /nfs/dbraw/zinc/39/91/87/857399187.db2.gz FYKQDNHJIPCKIV-CALCHBBNSA-N 0 3 423.001 4.149 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)N1CCC(c2ncccc2Cl)CC1 ZINC000428958025 857435063 /nfs/dbraw/zinc/43/50/63/857435063.db2.gz BKWAVPMCBXXFCJ-QGZVFWFLSA-N 0 3 400.954 4.145 20 0 HIADHN C/C(=C\c1ccccc1)CN(C)C(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000429019249 857459033 /nfs/dbraw/zinc/45/90/33/857459033.db2.gz IQEXJTXBJQZRLE-VGBYGFDOSA-N 0 3 407.558 4.022 20 0 HIADHN CC(C)OCc1cccc(NC(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)c1 ZINC000429046157 857474780 /nfs/dbraw/zinc/47/47/80/857474780.db2.gz MCYSSHGBCMOLPM-BGYRXZFFSA-N 0 3 417.594 4.355 20 0 HIADHN CC(C)OCc1cccc(NC(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)c1 ZINC000429046161 857474796 /nfs/dbraw/zinc/47/47/96/857474796.db2.gz MCYSSHGBCMOLPM-WOJBJXKFSA-N 0 3 417.594 4.355 20 0 HIADHN O=C(NC[C@H]1CN(Cc2ccccc2)CCCO1)Nc1cccc(C(F)(F)F)c1 ZINC000429048028 857475905 /nfs/dbraw/zinc/47/59/05/857475905.db2.gz XXBMFKLFAFZVFR-IBGZPJMESA-N 0 3 407.436 4.118 20 0 HIADHN O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)N1CCCCC[C@@H]1c1ccco1 ZINC000429049214 857477134 /nfs/dbraw/zinc/47/71/34/857477134.db2.gz BGJWPMHIUVGUQV-FGZHOGPDSA-N 0 3 411.546 4.197 20 0 HIADHN CC(C)COc1cccc(NC(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)c1 ZINC000429094147 857506280 /nfs/dbraw/zinc/50/62/80/857506280.db2.gz CSZWZPCEROASTQ-PMACEKPBSA-N 0 3 417.594 4.465 20 0 HIADHN CCOc1cc(C)ccc1NC(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000429109768 857513373 /nfs/dbraw/zinc/51/33/73/857513373.db2.gz NRDVIFBDBZWUJV-RTBURBONSA-N 0 3 403.567 4.137 20 0 HIADHN C[C@@H](NC(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1)c1ccccc1Cl ZINC000429192479 857547470 /nfs/dbraw/zinc/54/74/70/857547470.db2.gz HNYUEXVBMWWVOF-FGTMMUONSA-N 0 3 407.986 4.322 20 0 HIADHN CC[C@H](NC(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1)c1ccc(OC)cc1 ZINC000429208152 857554929 /nfs/dbraw/zinc/55/49/29/857554929.db2.gz ZNYBFSDPQKLPBD-YYDVJCTNSA-N 0 3 417.594 4.067 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)Nc3ccccc3OC(F)F)CC2)C[C@H](C)O1 ZINC000429210943 857555906 /nfs/dbraw/zinc/55/59/06/857555906.db2.gz VKTCJVVPQFZBLI-HOTGVXAUSA-N 0 3 411.493 4.031 20 0 HIADHN C[C@@H]1CN(c2cccc(F)c2)CCN1CCC(=O)Nc1ccccc1C(F)(F)F ZINC000429242375 857570684 /nfs/dbraw/zinc/57/06/84/857570684.db2.gz SQBQZZDQUPRDKW-OAHLLOKOSA-N 0 3 409.427 4.384 20 0 HIADHN CCCn1ccnc1CCCN(C)[C@@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O ZINC000429260358 857579666 /nfs/dbraw/zinc/57/96/66/857579666.db2.gz MIQNRXCXINORHK-GOSISDBHSA-N 0 3 409.361 4.270 20 0 HIADHN CC(C)C[C@H]1CN(CCCc2ccccc2)CCN1CC(=O)NCc1cccs1 ZINC000429384157 857634750 /nfs/dbraw/zinc/63/47/50/857634750.db2.gz FJCQTIPFWLDJES-QFIPXVFZSA-N 0 3 413.631 4.029 20 0 HIADHN COc1ccccc1NC(=O)CN1CCN(CCCc2ccccc2)C[C@@H]1CC(C)C ZINC000429398630 857642811 /nfs/dbraw/zinc/64/28/11/857642811.db2.gz VNCHUTRSHKGFKC-QHCPKHFHSA-N 0 3 423.601 4.299 20 0 HIADHN CS(=O)(=O)C[C@H]1CCN(CCCC(c2ccc(F)cc2)c2ccc(F)cc2)C1 ZINC000429404032 857646836 /nfs/dbraw/zinc/64/68/36/857646836.db2.gz JIUPDYHWTRIKHM-KRWDZBQOSA-N 0 3 407.526 4.243 20 0 HIADHN COCCS(=O)(=O)c1ccc(CN[C@@H]2CCCc3ccc(C(C)C)cc32)cc1 ZINC000429417085 857655376 /nfs/dbraw/zinc/65/53/76/857655376.db2.gz MLOMAXYZYZGADB-HSZRJFAPSA-N 0 3 401.572 4.397 20 0 HIADHN COCCS(=O)(=O)c1ccc(CN[C@H](Cc2ccccc2)c2ccccc2)cc1 ZINC000429424926 857660062 /nfs/dbraw/zinc/66/00/62/857660062.db2.gz DJQRTALDVVHROI-XMMPIXPASA-N 0 3 409.551 4.180 20 0 HIADHN CN1CCN(c2ccc(CN[C@H](Cc3ccccc3F)c3ccccc3)cn2)CC1 ZINC000429430098 857661884 /nfs/dbraw/zinc/66/18/84/857661884.db2.gz AHNOIAGSKJHSAN-XMMPIXPASA-N 0 3 404.533 4.046 20 0 HIADHN CN1CCN(c2ccc(CN[C@@H](Cc3ccccc3F)c3ccccc3)cn2)CC1 ZINC000429430095 857662200 /nfs/dbraw/zinc/66/22/00/857662200.db2.gz AHNOIAGSKJHSAN-DEOSSOPVSA-N 0 3 404.533 4.046 20 0 HIADHN COc1cc(F)c([C@H](C)NC[C@@H]2CSCCN2Cc2ccccc2)cc1OC ZINC000429446047 857673881 /nfs/dbraw/zinc/67/38/81/857673881.db2.gz GJKWDJDOJYDCBV-FUHWJXTLSA-N 0 3 404.551 4.111 20 0 HIADHN Fc1ccc([C@@H](NC[C@@H]2CN(Cc3ccccc3)CCCO2)c2cccnc2)c(F)c1 ZINC000429452900 857677496 /nfs/dbraw/zinc/67/74/96/857677496.db2.gz ZIXICSCTZDLQNG-RDGATRHJSA-N 0 3 423.507 4.330 20 0 HIADHN CC(C)COC1CCN(C(=O)N[C@@H](CN2CCc3ccccc3C2)C(C)(C)C)CC1 ZINC000429492343 857694829 /nfs/dbraw/zinc/69/48/29/857694829.db2.gz QBMCYWJIGVNQMZ-QHCPKHFHSA-N 0 3 415.622 4.306 20 0 HIADHN CC(C)COC1CCN(C(=O)N[C@H](CN2CCc3ccccc3C2)C(C)(C)C)CC1 ZINC000429492340 857694976 /nfs/dbraw/zinc/69/49/76/857694976.db2.gz QBMCYWJIGVNQMZ-HSZRJFAPSA-N 0 3 415.622 4.306 20 0 HIADHN C[C@@H]1CCN(C(=O)NC[C@@H](c2ccccc2)C(C)(C)CO)CCN1Cc1ccccc1 ZINC000437628113 862950497 /nfs/dbraw/zinc/95/04/97/862950497.db2.gz QQRUUVRPLCUROC-QPPBQGQZSA-N 0 3 423.601 4.095 20 0 HIADHN CCCc1c(NC(=O)N(CCN(C)C)Cc2ccco2)cnn1-c1ccccc1C ZINC000429699777 857840293 /nfs/dbraw/zinc/84/02/93/857840293.db2.gz QKMQJDGNOZSNRQ-UHFFFAOYSA-N 0 3 409.534 4.322 20 0 HIADHN CC(C)Oc1ccc(NC(=O)NC[C@H]2CN(Cc3ccccc3)CCCO2)c(F)c1 ZINC000429734983 857857387 /nfs/dbraw/zinc/85/73/87/857857387.db2.gz KGPSZYHETDUCPE-FQEVSTJZSA-N 0 3 415.509 4.026 20 0 HIADHN O=C(Nc1ccnn1Cc1cccc2ccccc21)N1CCN(C2CCCC2)CC1 ZINC000429740354 857862969 /nfs/dbraw/zinc/86/29/69/857862969.db2.gz FBGQWQFJLIMLFJ-UHFFFAOYSA-N 0 3 403.530 4.177 20 0 HIADHN CC(C)(C)Oc1ccccc1NC(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000429744680 857865877 /nfs/dbraw/zinc/86/58/77/857865877.db2.gz RHJFUYQJOYMEFD-FQEVSTJZSA-N 0 3 411.546 4.277 20 0 HIADHN Cc1cccc(OC(F)F)c1NC(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000429748077 857867884 /nfs/dbraw/zinc/86/78/84/857867884.db2.gz ZDBWGEAHDWUJIA-SFHVURJKSA-N 0 3 419.472 4.009 20 0 HIADHN COc1ccc(NC(=O)[C@H](N[C@@H]2CCC[C@@H]2CCO)c2ccccc2)cc1Cl ZINC000429765590 857877599 /nfs/dbraw/zinc/87/75/99/857877599.db2.gz AZFUPIJECIZRQB-QFIXIFRTSA-N 0 3 402.922 4.169 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N(CC(C)(C)O)C1CC1)c1ccc(C(F)(F)F)cc1 ZINC000429774913 857880494 /nfs/dbraw/zinc/88/04/94/857880494.db2.gz NVKYXXOJZNWGOA-SFHVURJKSA-N 0 3 415.500 4.033 20 0 HIADHN CN(C)C(=O)[C@@H](N[C@H]1C[C@H](c2ccc(F)c(Br)c2)C1)c1ccccc1 ZINC000429807941 857891725 /nfs/dbraw/zinc/89/17/25/857891725.db2.gz JUEIKZUZSCLSER-BXWFABGCSA-N 0 3 405.311 4.253 20 0 HIADHN C[C@@H](C(=O)N(CCN(C)C)Cc1ccc(C(F)(F)F)cc1)c1ccc2c(c1)OCO2 ZINC000429897562 857933789 /nfs/dbraw/zinc/93/37/89/857933789.db2.gz DFBANWJWXVOBAH-OAHLLOKOSA-N 0 3 422.447 4.128 20 0 HIADHN CCCN1c2ccc(NC(=O)N[C@@H](C)[C@H](c3ccccc3)N(C)C)cc2CCC1=O ZINC000429982835 857982893 /nfs/dbraw/zinc/98/28/93/857982893.db2.gz SVUKDODKNORMRC-GAJHUEQPSA-N 0 3 408.546 4.189 20 0 HIADHN CCCn1c(SC[C@H]2CN(Cc3ccccc3)CCCO2)nnc1-c1ccncc1 ZINC000430096242 858029544 /nfs/dbraw/zinc/02/95/44/858029544.db2.gz DZEJJJFNHULQCR-OAQYLSRUSA-N 0 3 423.586 4.133 20 0 HIADHN c1coc(Cn2c(SC[C@H]3CN(Cc4ccccc4)CCCO3)nnc2C2CC2)c1 ZINC000430106996 858034030 /nfs/dbraw/zinc/03/40/30/858034030.db2.gz SCYCCWCBGCCSPH-OAQYLSRUSA-N 0 3 424.570 4.180 20 0 HIADHN O=S1(=O)CCC2(CCN(CCCCc3cccc(C(F)(F)F)c3)CC2)CC1 ZINC000430221470 858087604 /nfs/dbraw/zinc/08/76/04/858087604.db2.gz RXUDQUUQPPAMAB-UHFFFAOYSA-N 0 3 403.510 4.319 20 0 HIADHN O=C(CCN(CCc1ccccn1)Cc1cccnc1)N[C@H]1CCCc2ccccc21 ZINC000430310341 858118376 /nfs/dbraw/zinc/11/83/76/858118376.db2.gz AEGQXYHJCDOUCZ-VWLOTQADSA-N 0 3 414.553 4.105 20 0 HIADHN O[C@@H](Cc1ccccc1C(F)(F)F)CN(CCc1ccccn1)Cc1cccnc1 ZINC000430311836 858118441 /nfs/dbraw/zinc/11/84/41/858118441.db2.gz LOJNHEBMZOAFQB-NRFANRHFSA-N 0 3 415.459 4.144 20 0 HIADHN C[C@H]1C[C@H](NC(=O)CCC(=O)c2ccc3c(c2)CCC3)CCN1Cc1ccccc1 ZINC000430741513 858283788 /nfs/dbraw/zinc/28/37/88/858283788.db2.gz SYFOPTCMZISKGJ-YADARESESA-N 0 3 404.554 4.308 20 0 HIADHN CCN(CC)[C@@H](CN1C(=O)N[C@H](c2ccc(OC(F)F)cc2)C1=O)c1ccsc1 ZINC000430869009 858346963 /nfs/dbraw/zinc/34/69/63/858346963.db2.gz PAHOEVALSYFMQW-DLBZAZTESA-N 0 3 423.485 4.026 20 0 HIADHN Cc1cc([C@H]2CCCN2C(=O)N[C@H](C)C2=CCN(C)CC2)ccc1Br ZINC000430886523 858354535 /nfs/dbraw/zinc/35/45/35/858354535.db2.gz UJHDJBOPFGGKKN-DNVCBOLYSA-N 0 3 406.368 4.254 20 0 HIADHN CC1CCN([C@H](CN2C(=O)CN(CCc3ccccc3)C2=O)c2cccs2)CC1 ZINC000430951180 858380481 /nfs/dbraw/zinc/38/04/81/858380481.db2.gz UQXKSTNCEBJETG-HXUWFJFHSA-N 0 3 411.571 4.028 20 0 HIADHN CC1CCN([C@H](CN2C(=O)[C@@H](Cc3ccccc3)N(C)C2=O)c2cccs2)CC1 ZINC000430955319 858381450 /nfs/dbraw/zinc/38/14/50/858381450.db2.gz LXPSLGXORASVJQ-WOJBJXKFSA-N 0 3 411.571 4.026 20 0 HIADHN O=C1N[C@H](c2ccc3ccccc3c2)C(=O)N1C[C@H](c1cccs1)N1CCCC1 ZINC000430971904 858386884 /nfs/dbraw/zinc/38/68/84/858386884.db2.gz NFMXAIYLJPQNLN-TZIWHRDSSA-N 0 3 405.523 4.331 20 0 HIADHN O=C1N[C@H](c2ccc3ccccc3c2)C(=O)N1C[C@@H](c1cccs1)N1CCCC1 ZINC000430971902 858387246 /nfs/dbraw/zinc/38/72/46/858387246.db2.gz NFMXAIYLJPQNLN-PZJWPPBQSA-N 0 3 405.523 4.331 20 0 HIADHN O=C1N[C@H](c2ccc(Cl)cc2Cl)C(=O)N1C1CCN(Cc2ccccc2)CC1 ZINC000430976991 858388757 /nfs/dbraw/zinc/38/87/57/858388757.db2.gz DCNLOLVONWPIMA-LJQANCHMSA-N 0 3 418.324 4.251 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](N2C(=O)N[C@H](c3ccc(Cl)cc3Cl)C2=O)C1 ZINC000431031838 858410253 /nfs/dbraw/zinc/41/02/53/858410253.db2.gz DUQGZECKOGRLPL-ACWOFJMJSA-N 0 3 418.324 4.422 20 0 HIADHN CN(C(=O)N[C@@H]1CC[C@H](c2ccccc2F)C1)C1CCN(CCc2ccccn2)CC1 ZINC000431058881 858425152 /nfs/dbraw/zinc/42/51/52/858425152.db2.gz AHGVYKPGAOETIC-PZJWPPBQSA-N 0 3 424.564 4.205 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)NC2CC(F)(c3cccc(Cl)c3)C2)o1 ZINC000431082489 858439585 /nfs/dbraw/zinc/43/95/85/858439585.db2.gz UUCNBFIOQLUPMU-UHFFFAOYSA-N 0 3 407.917 4.342 20 0 HIADHN CCc1noc(-c2ccc(C)c(NC(=O)N3CCN(C4CCC(C)CC4)CC3)c2)n1 ZINC000431124469 858457399 /nfs/dbraw/zinc/45/73/99/858457399.db2.gz KPTGZGMKUHPTQE-UHFFFAOYSA-N 0 3 411.550 4.336 20 0 HIADHN C[C@H]1C[C@H](N(C)S(=O)(=O)Cc2cc(Cl)ccc2F)CCN1Cc1ccccc1 ZINC000431284757 858545977 /nfs/dbraw/zinc/54/59/77/858545977.db2.gz WIXXLHYUNLDLEG-OXJNMPFZSA-N 0 3 424.969 4.294 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)C3CCC(F)(F)CC3)c(OCC)c2)CC1 ZINC000431410073 858601550 /nfs/dbraw/zinc/60/15/50/858601550.db2.gz LVBLEEURUVWDAR-UHFFFAOYSA-N 0 3 409.521 4.381 20 0 HIADHN CCc1occc1C(=O)NCCCCN1CCN(c2cccc(C(F)(F)F)c2)CC1 ZINC000431467320 858630118 /nfs/dbraw/zinc/63/01/18/858630118.db2.gz XVOWSVUGJYTHBT-UHFFFAOYSA-N 0 3 423.479 4.193 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)c1c(Cl)cc(F)cc1Cl ZINC000431497624 858644332 /nfs/dbraw/zinc/64/43/32/858644332.db2.gz XXJBVIQSOPIQJQ-UHFFFAOYSA-N 0 3 424.347 4.465 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cccc(OCC(F)(F)F)c3)c(C)c2)CC1 ZINC000431499240 858645517 /nfs/dbraw/zinc/64/55/17/858645517.db2.gz FHRSZBIPRORWRB-UHFFFAOYSA-N 0 3 421.463 4.330 20 0 HIADHN Cc1nc2sccn2c1CN(C)CC[C@H](C)N(C)Cc1c(C)nc2sccn12 ZINC000431597956 858682145 /nfs/dbraw/zinc/68/21/45/858682145.db2.gz WFKQGVCXSPDLSE-AWEZNQCLSA-N 0 3 416.620 4.064 20 0 HIADHN O=C(NC1CCN(Cc2ccccc2)CC1)c1cncc(-c2ccc3c(c2)CCO3)c1 ZINC000431656636 858717846 /nfs/dbraw/zinc/71/78/46/858717846.db2.gz AQRLSILDQCHRSN-UHFFFAOYSA-N 0 3 413.521 4.078 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)c3cccc(OCC(F)(F)F)c3)cc2)CC1 ZINC000431763349 858799984 /nfs/dbraw/zinc/79/99/84/858799984.db2.gz ARWYZTDMPQIFFR-UHFFFAOYSA-N 0 3 421.463 4.018 20 0 HIADHN O=C(Cc1cccc(OCC(F)(F)F)c1)NC[C@H](c1cccs1)N1CCCC1 ZINC000431769102 858803380 /nfs/dbraw/zinc/80/33/80/858803380.db2.gz HDQSNPYPLXWAHV-QGZVFWFLSA-N 0 3 412.477 4.185 20 0 HIADHN CCOC(=O)Cn1nc(C)c(CN2CCC(F)(c3ccc(Cl)cc3)CC2)c1C ZINC000467540597 881362180 /nfs/dbraw/zinc/36/21/80/881362180.db2.gz QEFAUJRTFDFXBY-UHFFFAOYSA-N 0 3 407.917 4.177 20 0 HIADHN COc1cccc(C2(F)CCN(Cc3c[nH]nc3-c3ccc4c(c3)OCO4)CC2)c1 ZINC000467539956 881362227 /nfs/dbraw/zinc/36/22/27/881362227.db2.gz AAABBOZAEQKRKN-UHFFFAOYSA-N 0 3 409.461 4.275 20 0 HIADHN CN1CC[C@H](NC(=O)NCC[C@H](c2ccccc2)C(F)(F)F)[C@@H]1c1ccccc1 ZINC000432079686 858974100 /nfs/dbraw/zinc/97/41/00/858974100.db2.gz NHSGKBPHIKANCE-AABGKKOBSA-N 0 3 405.464 4.467 20 0 HIADHN CN(C(=O)N[C@H]1CC(C)(C)c2ccccc21)C1CCN(CCc2ccccn2)CC1 ZINC000432148644 859015701 /nfs/dbraw/zinc/01/57/01/859015701.db2.gz NPVYUYMHBMZFBA-QHCPKHFHSA-N 0 3 406.574 4.153 20 0 HIADHN Cc1cc(NC(=O)N[C@@H]2C[C@H]2c2ccccc2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000432276916 859080558 /nfs/dbraw/zinc/08/05/58/859080558.db2.gz KRJFNYFDVWNDGU-XPWALMASSA-N 0 3 415.541 4.316 20 0 HIADHN CN(C)CCN(C(=O)Nc1ccc(OCc2ccccn2)c(F)c1)C1CCCC1 ZINC000467559829 881382475 /nfs/dbraw/zinc/38/24/75/881382475.db2.gz LMKAXHKQWKQAHE-UHFFFAOYSA-N 0 3 400.498 4.138 20 0 HIADHN Cc1ccc([C@H](CNC(=O)NCCc2cccc(C(F)(F)F)n2)N2CCCC2)cc1 ZINC000432549073 859220899 /nfs/dbraw/zinc/22/08/99/859220899.db2.gz GXULHOOKAUYHLG-IBGZPJMESA-N 0 3 420.479 4.088 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)C1(Cc2cccc(F)c2)CCOCC1)c1ccsc1 ZINC000432712758 859311949 /nfs/dbraw/zinc/31/19/49/859311949.db2.gz BHYFRTQOTGPDJB-NRFANRHFSA-N 0 3 418.578 4.426 20 0 HIADHN O=C(NCc1ccn(C2CCCC2)n1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000432855162 859390235 /nfs/dbraw/zinc/39/02/35/859390235.db2.gz PXGYJCRLJTXIFC-NRFANRHFSA-N 0 3 420.479 4.069 20 0 HIADHN C[C@@H]1C[C@@H]1c1ccc(CN(CCC(=O)Nc2ccc(C(N)=O)c(Cl)c2)C2CC2)o1 ZINC000432895693 859415074 /nfs/dbraw/zinc/41/50/74/859415074.db2.gz YXCMLEXVJHJVOI-ACJLOTCBSA-N 0 3 415.921 4.149 20 0 HIADHN CCc1nc(-c2ccc(C(=O)N(CC)[C@@H]3CCN([C@@H](C)c4ccccc4)C3)cc2)n[nH]1 ZINC000433018345 859481226 /nfs/dbraw/zinc/48/12/26/859481226.db2.gz DMYQGSJRUVFHII-PGRDOPGGSA-N 0 3 417.557 4.332 20 0 HIADHN COc1ccccc1-c1noc(C2CCN(Cc3ccc4c(c3)ncn4C)CC2)n1 ZINC000433021425 859483335 /nfs/dbraw/zinc/48/33/35/859483335.db2.gz GMKQVMAGPVUJNI-UHFFFAOYSA-N 0 3 403.486 4.012 20 0 HIADHN Cc1cnc(C2CCN(CCc3nc4sc5c(c4c(N)n3)CCCC5)CC2)s1 ZINC000433157033 859544983 /nfs/dbraw/zinc/54/49/83/859544983.db2.gz KXIKVEVQMJZFFE-UHFFFAOYSA-N 0 3 413.616 4.339 20 0 HIADHN Cc1cnc(C2CCN(C[C@H](O)COc3ccccc3C(F)(F)F)CC2)s1 ZINC000433163757 859548125 /nfs/dbraw/zinc/54/81/25/859548125.db2.gz PIADBZZVAZKLMU-HNNXBMFYSA-N 0 3 400.466 4.090 20 0 HIADHN COc1cc(Br)c(CNC[C@@H]2CCCN(c3ccccc3)C2)cc1OC ZINC000433182851 859557949 /nfs/dbraw/zinc/55/79/49/859557949.db2.gz PAAIIEWONCHYAT-INIZCTEOSA-N 0 3 419.363 4.473 20 0 HIADHN CCNC(=O)N(C)c1cccc(NC(=O)NC[C@H](c2ccsc2)N(CC)CC)c1 ZINC000433244897 859588957 /nfs/dbraw/zinc/58/89/57/859588957.db2.gz ZFCSCRURUUIQRJ-LJQANCHMSA-N 0 3 417.579 4.118 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2cccc(F)c2Br)N2CCCC2)cc1 ZINC000433249107 859591039 /nfs/dbraw/zinc/59/10/39/859591039.db2.gz VNMVGSSIAUEJTG-GOSISDBHSA-N 0 3 405.311 4.464 20 0 HIADHN C[C@@H]1CN(C(=O)Nc2ccc(Cl)cc2C(=O)c2ccc[nH]2)CCN(C2CCC2)C1 ZINC000433288477 859618820 /nfs/dbraw/zinc/61/88/20/859618820.db2.gz ZJOHIAXEPUXBOO-HNNXBMFYSA-N 0 3 414.937 4.237 20 0 HIADHN CN(C)Cc1ccccc1C(=O)NCC1(c2cccc(Br)c2)CCC1 ZINC000433304824 859627515 /nfs/dbraw/zinc/62/75/15/859627515.db2.gz LSRCNWXCZIDQAC-UHFFFAOYSA-N 0 3 401.348 4.362 20 0 HIADHN C[C@@H](C(=O)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1)c1cncnc1 ZINC000433306090 859629315 /nfs/dbraw/zinc/62/93/15/859629315.db2.gz RBMAVMWWNQCPHG-OAHLLOKOSA-N 0 3 407.345 4.012 20 0 HIADHN CCNC(=O)c1ccc(CN[C@@H](C)c2ccc(OC[C@@H]3CCCCO3)c(F)c2)cc1 ZINC000433371425 859661973 /nfs/dbraw/zinc/66/19/73/859661973.db2.gz AZWJSGITAVAZHP-UWJYYQICSA-N 0 3 414.521 4.374 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)c2ccc(-c3nc(C4CC4)no3)cc2)C1 ZINC000433421124 859691004 /nfs/dbraw/zinc/69/10/04/859691004.db2.gz NLYSZUHGYHSFAO-IERDGZPVSA-N 0 3 402.498 4.179 20 0 HIADHN CC(C)Oc1cc(O)ccc1NC(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000433521571 859752746 /nfs/dbraw/zinc/75/27/46/859752746.db2.gz NDIQZDMWVQVAHN-UHFFFAOYSA-N 0 3 415.559 4.415 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)N[C@@H](c1cc(F)ccc1F)C(F)F ZINC000433617761 859812409 /nfs/dbraw/zinc/81/24/09/859812409.db2.gz OOZVVADGEHJXOR-MOPGFXCFSA-N 0 3 409.427 4.407 20 0 HIADHN CN(C(=O)N[C@@H](c1cc(F)ccc1F)C(F)F)[C@H]1CCN(Cc2ccccc2)C1 ZINC000433657117 859826761 /nfs/dbraw/zinc/82/67/61/859826761.db2.gz UDAZOKUNNDDDHM-LPHOPBHVSA-N 0 3 409.427 4.187 20 0 HIADHN O=C(Nc1ccc(Oc2ncc(Cl)cn2)c(Cl)c1)N1CC[C@H](N2CC=CC2)C1 ZINC000433686486 859837677 /nfs/dbraw/zinc/83/76/77/859837677.db2.gz UAWINQBLASMPKK-HNNXBMFYSA-N 0 3 420.300 4.054 20 0 HIADHN CCNC(=O)Nc1cccc(NC(=O)NC[C@@H](c2ccccc2)N2CCCC2)c1C ZINC000433725895 859856421 /nfs/dbraw/zinc/85/64/21/859856421.db2.gz CNWCTKVVWZRBMX-NRFANRHFSA-N 0 3 409.534 4.095 20 0 HIADHN Cc1c(Br)ccc(NC(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)c1F ZINC000433728193 859858215 /nfs/dbraw/zinc/85/82/15/859858215.db2.gz AFPBHLYYDJGFMT-WMZOPIPTSA-N 0 3 406.299 4.464 20 0 HIADHN O=C(N1CC[C@@H](CC(F)(F)F)C1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000433738300 859866330 /nfs/dbraw/zinc/86/63/30/859866330.db2.gz CWPCHXNWNVMVEX-DOTOQJQBSA-N 0 3 408.386 4.242 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1ccnc(Oc2ccc(F)cc2F)c1 ZINC000433752183 859875601 /nfs/dbraw/zinc/87/56/01/859875601.db2.gz VVTHTEFQOYQSGM-UHFFFAOYSA-N 0 3 416.428 4.341 20 0 HIADHN CC(C)[C@@H](N[C@@H](C)C(=O)Nc1ccccc1S(C)(=O)=O)c1ccc(Cl)cc1 ZINC000433779207 859889771 /nfs/dbraw/zinc/88/97/71/859889771.db2.gz HQPHRIQCRSITGB-IFXJQAMLSA-N 0 3 408.951 4.057 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)Nc2ccc(F)cc2-c2cnn(C)c2)CN1Cc1ccccc1 ZINC000433803525 859899922 /nfs/dbraw/zinc/89/99/22/859899922.db2.gz UPZSFMUQFQQPQK-UZLBHIALSA-N 0 3 407.493 4.011 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)Nc2ccc(F)cc2-c2cnn(C)c2)C1 ZINC000433807650 859902917 /nfs/dbraw/zinc/90/29/17/859902917.db2.gz JOVVOSPGTFURLD-JXFKEZNVSA-N 0 3 407.493 4.183 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)Nc2ccc(F)cc2-c2cnn(C)c2)C1 ZINC000433807651 859903513 /nfs/dbraw/zinc/90/35/13/859903513.db2.gz JOVVOSPGTFURLD-OXJNMPFZSA-N 0 3 407.493 4.183 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)N[C@H](c2cccc(Cl)c2)C2CCCC2)CC1 ZINC000433814958 859909228 /nfs/dbraw/zinc/90/92/28/859909228.db2.gz YPNUFWMFVLTVSI-GCJKJVERSA-N 0 3 421.029 4.144 20 0 HIADHN C[C@H](NS(=O)(=O)c1ccc(CN(C)C)cc1)[C@@H](C)c1ccccc1C(F)(F)F ZINC000433863559 859941074 /nfs/dbraw/zinc/94/10/74/859941074.db2.gz GEEVMIDZJHKIID-CABCVRRESA-N 0 3 414.493 4.238 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1noc2c1C[C@H](C)CC2 ZINC000433865197 859942257 /nfs/dbraw/zinc/94/22/57/859942257.db2.gz OPKIHYJNSTZOOA-VQIMIIECSA-N 0 3 419.529 4.004 20 0 HIADHN CN(C)Cc1ccc(S(=O)(=O)N2CCCCC[C@@H]2CC(=O)c2cccs2)cc1 ZINC000433880552 859949516 /nfs/dbraw/zinc/94/95/16/859949516.db2.gz RTOWPWCMRHXXPM-GOSISDBHSA-N 0 3 420.600 4.016 20 0 HIADHN CC(C)n1ncc2c1nc(C1CC1)cc2C(=O)N[C@@H]1C[C@H](C)N(Cc2ccccc2)C1 ZINC000467690539 881483846 /nfs/dbraw/zinc/48/38/46/881483846.db2.gz GNPCXJCBELVTLD-FXAWDEMLSA-N 0 3 417.557 4.282 20 0 HIADHN Cc1nc(-c2ccc(CCNC(=O)NC[C@@H]3CCCCN3C3CC3)s2)cs1 ZINC000433939956 859988052 /nfs/dbraw/zinc/98/80/52/859988052.db2.gz IYMIXGVGIFOFLS-INIZCTEOSA-N 0 3 404.605 4.039 20 0 HIADHN C[C@H]1C[C@H](NC(=O)c2cn(C)nc2-c2ccccc2Cl)CN1Cc1ccccc1 ZINC000467693701 881487961 /nfs/dbraw/zinc/48/79/61/881487961.db2.gz BQPCMKPWGWHIMI-WMZOPIPTSA-N 0 3 408.933 4.133 20 0 HIADHN CC(C)CC(=O)Nc1ccc(C(=O)N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)cc1F ZINC000467694411 881489290 /nfs/dbraw/zinc/48/92/90/881489290.db2.gz AABQUPMOOBBDQW-XLIONFOSSA-N 0 3 411.521 4.203 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)COc2ccc(Oc3ccccn3)cc2)CN1Cc1ccccc1 ZINC000467698885 881493964 /nfs/dbraw/zinc/49/39/64/881493964.db2.gz CGVXYEGPOVVNFR-TZIWHRDSSA-N 0 3 417.509 4.032 20 0 HIADHN COCCCNC(=O)C1CCN(c2ccnc3ccc(Oc4ccccc4)cc32)CC1 ZINC000434077702 860086053 /nfs/dbraw/zinc/08/60/53/860086053.db2.gz VRYLZCWVSWHNGX-UHFFFAOYSA-N 0 3 419.525 4.396 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)c2ccccc2NCc2cccnc2)C1 ZINC000434086827 860094097 /nfs/dbraw/zinc/09/40/97/860094097.db2.gz ICYYARPPQWAVSP-SIKLNZKXSA-N 0 3 400.526 4.259 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)c1ccc(-c2nc(C3CC3)no2)cc1 ZINC000434101569 860105574 /nfs/dbraw/zinc/10/55/74/860105574.db2.gz IYBZYPOTLXZWRD-UHFFFAOYSA-N 0 3 418.541 4.251 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1ccnc2ccccc21 ZINC000434312426 860272975 /nfs/dbraw/zinc/27/29/75/860272975.db2.gz LZRZHVQHPZVSSY-FQEVSTJZSA-N 0 3 411.509 4.439 20 0 HIADHN CCc1ccccc1OCC(=O)Nc1c(C)cnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000434313616 860274700 /nfs/dbraw/zinc/27/47/00/860274700.db2.gz AWFCHERZZGYSHP-QFIPXVFZSA-N 0 3 418.541 4.218 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)[C@@H](C)Oc1ccccc1F ZINC000434320440 860280672 /nfs/dbraw/zinc/28/06/72/860280672.db2.gz CESNSGDVFLCECO-UYAOXDASSA-N 0 3 422.504 4.184 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)c2cc(C3CC3)nc3ccc(Cl)cc32)CC1 ZINC000434320748 860281194 /nfs/dbraw/zinc/28/11/94/860281194.db2.gz GAJPXRITOLJHRT-UHFFFAOYSA-N 0 3 415.965 4.385 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)Cc1cc(F)ccc1F ZINC000434321191 860281358 /nfs/dbraw/zinc/28/13/58/860281358.db2.gz KUTMOTPGEFTWDB-FQEVSTJZSA-N 0 3 410.468 4.098 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)CCCOc1ccccc1 ZINC000434325025 860285691 /nfs/dbraw/zinc/28/56/91/860285691.db2.gz HFMDMQDYOZDIJQ-QFIPXVFZSA-N 0 3 418.541 4.436 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)[C@H]1Cc2ccccc2S1 ZINC000434327726 860288432 /nfs/dbraw/zinc/28/84/32/860288432.db2.gz RRIGRAFIHNIXQF-IFMALSPDSA-N 0 3 418.566 4.294 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1cccc(C(C)C)n1 ZINC000434330564 860291918 /nfs/dbraw/zinc/29/19/18/860291918.db2.gz OVXTXFPGBHYQNZ-HXUWFJFHSA-N 0 3 403.530 4.409 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1ccc2c(c1)CCC2 ZINC000434331260 860292932 /nfs/dbraw/zinc/29/29/32/860292932.db2.gz ZBBZZWXGZQSBRP-HSZRJFAPSA-N 0 3 400.526 4.380 20 0 HIADHN CCO[C@H](CC(=O)Nc1c(C)cnn1[C@H]1CCN(Cc2ccccc2)C1)C1=CCCC1 ZINC000434333133 860295077 /nfs/dbraw/zinc/29/50/77/860295077.db2.gz DKJDYFMTLLGDOU-XZOQPEGZSA-N 0 3 422.573 4.483 20 0 HIADHN COc1ccccc1CN(Cc1cccs1)C(=O)NC[C@H]1CCCCN1C1CC1 ZINC000434349983 860305795 /nfs/dbraw/zinc/30/57/95/860305795.db2.gz NTFUILCPOWRLRX-HXUWFJFHSA-N 0 3 413.587 4.485 20 0 HIADHN O[C@@H](COc1c(Cl)cccc1Cl)CN1CCC(c2ncc3n2CCCC3)CC1 ZINC000434665940 860451739 /nfs/dbraw/zinc/45/17/39/860451739.db2.gz OHONZAPIPKTLRZ-QGZVFWFLSA-N 0 3 424.372 4.146 20 0 HIADHN O[C@H](COc1c(Cl)cccc1Cl)CN1CCC(c2ncc3n2CCCC3)CC1 ZINC000434665939 860451847 /nfs/dbraw/zinc/45/18/47/860451847.db2.gz OHONZAPIPKTLRZ-KRWDZBQOSA-N 0 3 424.372 4.146 20 0 HIADHN Cc1ccc(Cl)cc1NC(=O)[C@H](C)N1CCC(c2ncc3n2CCCC3)CC1 ZINC000434673346 860453796 /nfs/dbraw/zinc/45/37/96/860453796.db2.gz CNHXCIUVIKOXJV-INIZCTEOSA-N 0 3 400.954 4.388 20 0 HIADHN CCc1ccc([C@H](C)NC(=O)[C@H](C)N2CCC(c3ncc4n3CCCC4)CC2)cc1 ZINC000434685284 860459780 /nfs/dbraw/zinc/45/97/80/860459780.db2.gz NILGVDYQSUKOIH-OALUTQOASA-N 0 3 408.590 4.227 20 0 HIADHN CCN(C(=O)CN1CCC(c2ncc3n2CCCC3)CC1)[C@@H](C)c1ccc(F)cc1 ZINC000434687074 860460652 /nfs/dbraw/zinc/46/06/52/860460652.db2.gz WCMOYUCWENSROD-SFHVURJKSA-N 0 3 412.553 4.148 20 0 HIADHN O[C@H](COc1ccc(Cl)cc1Cl)CN1CCC(c2ncc3n2CCCC3)CC1 ZINC000434688060 860461601 /nfs/dbraw/zinc/46/16/01/860461601.db2.gz HUORSOZKBFERBR-SFHVURJKSA-N 0 3 424.372 4.146 20 0 HIADHN CC(C)(C)Oc1cccc(CCC(=O)NC[C@@H](c2cccs2)N2CCCC2)n1 ZINC000467738827 881541738 /nfs/dbraw/zinc/54/17/38/881541738.db2.gz ZLLTVALTJKBJPQ-SFHVURJKSA-N 0 3 401.576 4.206 20 0 HIADHN C[C@@H](NC(=O)[C@H](C)N1CCC(c2ncc3n2CCCC3)CC1)c1ccc(Cl)cc1 ZINC000434751234 860482281 /nfs/dbraw/zinc/48/22/81/860482281.db2.gz CUUHZBQCOCDYFC-SJORKVTESA-N 0 3 414.981 4.318 20 0 HIADHN CCn1nccc1C1CCN(C[C@H](O)COc2ccc(-c3ccccc3)cc2)CC1 ZINC000434758104 860484525 /nfs/dbraw/zinc/48/45/25/860484525.db2.gz PESJIMAICBXEFG-QHCPKHFHSA-N 0 3 405.542 4.189 20 0 HIADHN Cc1c(F)cccc1NC(=O)CCN(C)[C@@H]1c2cc(Cl)cc(Cl)c2C[C@H]1O ZINC000434782252 860493359 /nfs/dbraw/zinc/49/33/59/860493359.db2.gz HXYYVPBPOKLSOD-UYAOXDASSA-N 0 3 411.304 4.360 20 0 HIADHN COc1ccc2c(c1)CN(CCC(=O)N[C@H](c1cccs1)c1ccccc1)CC2 ZINC000434790853 860495630 /nfs/dbraw/zinc/49/56/30/860495630.db2.gz ZLDPFMLJYCZDCN-DEOSSOPVSA-N 0 3 406.551 4.411 20 0 HIADHN O=C(CCN1CCCN(c2nccs2)CC1)Nc1ccc(Oc2ccccc2)cc1 ZINC000434830930 860511798 /nfs/dbraw/zinc/51/17/98/860511798.db2.gz LJSGUZYOEPKTIL-UHFFFAOYSA-N 0 3 422.554 4.476 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)NCc1cc(F)c(Cl)cc1F ZINC000434871634 860529715 /nfs/dbraw/zinc/52/97/15/860529715.db2.gz WYOKYOABLMVSIB-UHFFFAOYSA-N 0 3 417.834 4.170 20 0 HIADHN Cc1c(C(=O)N(Cc2ccco2)C2CCN(C)CC2)cnn1-c1cc(C)ccc1C ZINC000435024001 860604355 /nfs/dbraw/zinc/60/43/55/860604355.db2.gz ADJRMPJMGMOCID-UHFFFAOYSA-N 0 3 406.530 4.127 20 0 HIADHN CCn1nccc1C1CCN(Cc2c(C)nn(Cc3ccc(OC)cc3)c2C)CC1 ZINC000435042779 860612011 /nfs/dbraw/zinc/61/20/11/860612011.db2.gz WLLSMJDMJLIQSQ-UHFFFAOYSA-N 0 3 407.562 4.153 20 0 HIADHN CC(C)n1ccc(NC(=O)N(CCN2CCCC2)Cc2ccc(Cl)c(Cl)c2)n1 ZINC000435081497 860632932 /nfs/dbraw/zinc/63/29/32/860632932.db2.gz JNLSMGPAQJRCIY-UHFFFAOYSA-N 0 3 424.376 4.901 20 0 HIADHN CCOC(=O)[C@@H]1CCCN(Cc2cccc(NC(=O)c3ccccc3Cl)c2)C1 ZINC000435246084 860703453 /nfs/dbraw/zinc/70/34/53/860703453.db2.gz PKMWJIJKZYVMTL-QGZVFWFLSA-N 0 3 400.906 4.367 20 0 HIADHN CCCCn1ncc(C(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)c1C ZINC000435270610 860710405 /nfs/dbraw/zinc/71/04/05/860710405.db2.gz VNRPJLBKQMFSGB-OAQYLSRUSA-N 0 3 420.561 4.196 20 0 HIADHN Cc1cc(NC(=O)[C@@H](C)Oc2ccccc2F)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435275073 860712422 /nfs/dbraw/zinc/71/24/22/860712422.db2.gz OMPJEBXCHRXBFU-QUCCMNQESA-N 0 3 422.504 4.184 20 0 HIADHN Cc1cc(NC(=O)c2c(C)noc2C(C)C)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435275815 860713147 /nfs/dbraw/zinc/71/31/47/860713147.db2.gz VKFAAKVYGWSACL-IBGZPJMESA-N 0 3 407.518 4.311 20 0 HIADHN Cc1cc(NC(=O)[C@H](C)Oc2ccc(F)cc2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435276601 860713352 /nfs/dbraw/zinc/71/33/52/860713352.db2.gz ZUCJOEMJPAXHQS-GHTZIAJQSA-N 0 3 422.504 4.184 20 0 HIADHN CC[C@H](C(=O)Nc1cc(C)nn1[C@@H]1CCN(Cc2ccccc2)C1)c1c(C)noc1C ZINC000435286386 860718795 /nfs/dbraw/zinc/71/87/95/860718795.db2.gz CXJYABMHKHAPIB-RTWAWAEBSA-N 0 3 421.545 4.376 20 0 HIADHN CCOCCC1(C(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)CCC1 ZINC000435289608 860720835 /nfs/dbraw/zinc/72/08/35/860720835.db2.gz OEPWFMCRUSWFME-NRFANRHFSA-N 0 3 410.562 4.174 20 0 HIADHN Cc1cc(NC(=O)c2ccc3ncccc3c2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435292364 860722062 /nfs/dbraw/zinc/72/20/62/860722062.db2.gz RLOYGSOUWOMLQO-JOCHJYFZSA-N 0 3 411.509 4.439 20 0 HIADHN Cc1cc(NC(=O)COc2cc(C)ccc2F)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435293714 860723361 /nfs/dbraw/zinc/72/33/61/860723361.db2.gz CAMNOSYDFOJNEG-HXUWFJFHSA-N 0 3 422.504 4.104 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)c2[nH]c3ccccc3c2Br)CN1Cc1ccccc1 ZINC000467757667 881573613 /nfs/dbraw/zinc/57/36/13/881573613.db2.gz ITCOFDWAJZYFGL-GDBMZVCRSA-N 0 3 412.331 4.323 20 0 HIADHN Cc1ccc2oc(C(=O)Nc3ccnn3[C@@H]3CCN(Cc4ccccc4)C3)cc2n1 ZINC000435366377 860765000 /nfs/dbraw/zinc/76/50/00/860765000.db2.gz LJYCJDMVTMGCOM-GOSISDBHSA-N 0 3 401.470 4.032 20 0 HIADHN Cc1ccc2oc(C(=O)Nc3ccnn3[C@H]3CCN(Cc4ccccc4)C3)cc2n1 ZINC000435366379 860765068 /nfs/dbraw/zinc/76/50/68/860765068.db2.gz LJYCJDMVTMGCOM-SFHVURJKSA-N 0 3 401.470 4.032 20 0 HIADHN Cc1cccc2[nH]cc(CC(=O)Nc3ccnn3[C@@H]3CCN(Cc4ccccc4)C3)c21 ZINC000435366777 860765355 /nfs/dbraw/zinc/76/53/55/860765355.db2.gz OGISATNLJHNGKT-OAQYLSRUSA-N 0 3 413.525 4.301 20 0 HIADHN O=C(Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)c1ccc(OCC2CC2)cc1 ZINC000435370040 860767117 /nfs/dbraw/zinc/76/71/17/860767117.db2.gz NOMHPWSAMLLUJP-QFIPXVFZSA-N 0 3 416.525 4.371 20 0 HIADHN Cc1cccc(OCCC(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)c1C ZINC000435371055 860767903 /nfs/dbraw/zinc/76/79/03/860767903.db2.gz RYZXLGDDPNBQPD-QFIPXVFZSA-N 0 3 418.541 4.355 20 0 HIADHN O=C(Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)C1(Cc2ccccc2)CC1 ZINC000435370110 860768021 /nfs/dbraw/zinc/76/80/21/860768021.db2.gz NTHGEHUYPILMBP-QFIPXVFZSA-N 0 3 400.526 4.292 20 0 HIADHN C[C@H](C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)c1ccc(F)c(F)c1 ZINC000435372952 860770882 /nfs/dbraw/zinc/77/08/82/860770882.db2.gz CFGAFNRCZMKPCX-LPHOPBHVSA-N 0 3 410.468 4.351 20 0 HIADHN CCOc1ccccc1CCC(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435374061 860771435 /nfs/dbraw/zinc/77/14/35/860771435.db2.gz WEPNTKWPECJITB-QFIPXVFZSA-N 0 3 418.541 4.300 20 0 HIADHN CC(C)(C)c1ncc(C(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)s1 ZINC000435373695 860771921 /nfs/dbraw/zinc/77/19/21/860771921.db2.gz OCJIUIMZPCLBNX-KRWDZBQOSA-N 0 3 409.559 4.336 20 0 HIADHN O=C(COc1cccc(Cl)c1)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435373969 860771985 /nfs/dbraw/zinc/77/19/85/860771985.db2.gz OPMKNRJEZFEHTJ-IBGZPJMESA-N 0 3 410.905 4.001 20 0 HIADHN C[C@@H](CCOc1ccccc1)C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435374246 860773150 /nfs/dbraw/zinc/77/31/50/860773150.db2.gz PMROWZPYDRRUCK-RBBKRZOGSA-N 0 3 418.541 4.374 20 0 HIADHN COc1cc(Cl)ccc1C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435376519 860774035 /nfs/dbraw/zinc/77/40/35/860774035.db2.gz QZUIXJFAQCHWFY-SFHVURJKSA-N 0 3 410.905 4.244 20 0 HIADHN O=C(Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)c1cc(F)c(F)c(F)c1F ZINC000435379029 860776253 /nfs/dbraw/zinc/77/62/53/860776253.db2.gz HLDZTCNEOMODHD-AWEZNQCLSA-N 0 3 418.394 4.139 20 0 HIADHN CC[C@@H](OC1CCCCC1)C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435381728 860777717 /nfs/dbraw/zinc/77/77/17/860777717.db2.gz XPINQQMVKIARGZ-RBBKRZOGSA-N 0 3 410.562 4.397 20 0 HIADHN CCn1nc(C)c(NC(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)c1C ZINC000435516976 860834997 /nfs/dbraw/zinc/83/49/97/860834997.db2.gz VJFXNYGSBXMJNI-FQEVSTJZSA-N 0 3 421.549 4.116 20 0 HIADHN Cc1cc(NC(=O)NCCc2cccc(C)c2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435521521 860838722 /nfs/dbraw/zinc/83/87/22/860838722.db2.gz WVBOALBODYPYBS-HSZRJFAPSA-N 0 3 417.557 4.311 20 0 HIADHN COc1ccc(NC(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000435525847 860842545 /nfs/dbraw/zinc/84/25/45/860842545.db2.gz LNKQIYRLENROSF-HXUWFJFHSA-N 0 3 405.502 4.291 20 0 HIADHN Cc1cc(NC(=O)Nc2cnn(C(C)(C)C)c2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435533200 860848673 /nfs/dbraw/zinc/84/86/73/860848673.db2.gz UTQBDQHVOWTKOY-HXUWFJFHSA-N 0 3 421.549 4.234 20 0 HIADHN Cc1c(NC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)cnn1-c1ccccc1 ZINC000435560199 860879723 /nfs/dbraw/zinc/87/97/23/860879723.db2.gz LPLPKLFPPNDJEK-IBGZPJMESA-N 0 3 403.530 4.309 20 0 HIADHN C[C@@H](C(=O)N1CCc2ccccc2C1)N(C)CCCc1cc(-c2ccc(F)cc2)n[nH]1 ZINC000435576158 860893074 /nfs/dbraw/zinc/89/30/74/860893074.db2.gz FVOGJEJQJZFTSA-SFHVURJKSA-N 0 3 420.532 4.054 20 0 HIADHN Cc1cccc(CN(Cc2cccc(C)n2)C(=O)NC[C@@H](c2ccccc2)N(C)C)n1 ZINC000435577060 860893223 /nfs/dbraw/zinc/89/32/23/860893223.db2.gz IJZUJLMPLNQHFX-DEOSSOPVSA-N 0 3 417.557 4.108 20 0 HIADHN COC(=O)c1ccccc1-c1ccccc1C(=O)NC[C@H](c1ccccc1)N(C)C ZINC000435663022 860942107 /nfs/dbraw/zinc/94/21/07/860942107.db2.gz LNEANVPWQOZFAL-HSZRJFAPSA-N 0 3 402.494 4.173 20 0 HIADHN CCc1nc(CN(C(C)=O)[C@H]2CCN(Cc3cccc(-c4ccc(C)cc4)c3)C2)no1 ZINC000435871202 861131915 /nfs/dbraw/zinc/13/19/15/861131915.db2.gz JFCJXPSUISDFJZ-QHCPKHFHSA-N 0 3 418.541 4.230 20 0 HIADHN COc1ccccc1[C@@H](C)NC(=O)[C@@H](C)N[C@@H](C)c1ccc(Br)cc1 ZINC000435886931 861144169 /nfs/dbraw/zinc/14/41/69/861144169.db2.gz DECZLVFSEXKFGA-RRFJBIMHSA-N 0 3 405.336 4.374 20 0 HIADHN COc1ccc(C(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)cc1C1CC1 ZINC000435911738 861174353 /nfs/dbraw/zinc/17/43/53/861174353.db2.gz PDJJIGLXQABUJC-NRFANRHFSA-N 0 3 416.525 4.468 20 0 HIADHN C[C@H]1CCN(C(=O)Nc2cccc(C(=O)NC(C)(C)C)c2)CCN1Cc1ccccc1 ZINC000437769212 863089008 /nfs/dbraw/zinc/08/90/08/863089008.db2.gz CUWVRIHWZQPVHK-IBGZPJMESA-N 0 3 422.573 4.343 20 0 HIADHN Cc1cc(-c2cc(C(=O)N[C@@H]3CN(C4CC4)C[C@@H]3C)c3cnn(C(C)C)c3n2)c(C)o1 ZINC000467804570 881628815 /nfs/dbraw/zinc/62/88/15/881628815.db2.gz XYLTWIYVDSAJDA-RCDICMHDSA-N 0 3 421.545 4.102 20 0 HIADHN COc1cc(C)ccc1Oc1ccc(NC(=O)N2CC[C@H](N3CC=CC3)C2)cc1F ZINC000437832018 863182865 /nfs/dbraw/zinc/18/28/65/863182865.db2.gz FBLATXNGVNFLQQ-SFHVURJKSA-N 0 3 411.477 4.413 20 0 HIADHN COc1cc(Oc2ccccc2)ccc1NC(=O)N(CCN(C)C)Cc1ccccn1 ZINC000437877688 863239360 /nfs/dbraw/zinc/23/93/60/863239360.db2.gz ZSJZJFQFCGOOAP-UHFFFAOYSA-N 0 3 420.513 4.478 20 0 HIADHN CN(CC/C=C/c1ccc(Br)cc1)[C@@H]1CCCC[C@H]1S(C)(=O)=O ZINC000437879312 863240317 /nfs/dbraw/zinc/24/03/17/863240317.db2.gz BBJALIHZYDSLSG-JORFTBQQSA-N 0 3 400.382 4.140 20 0 HIADHN C[C@H]1CCN(C(=O)Nc2cc(F)ccc2-n2cccn2)CCN1Cc1ccccc1 ZINC000438034549 863395087 /nfs/dbraw/zinc/39/50/87/863395087.db2.gz VMIQTCYZCJFOIY-SFHVURJKSA-N 0 3 407.493 4.140 20 0 HIADHN Cc1ccc(NC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)cc1C(=O)NC(C)C ZINC000438046830 863409186 /nfs/dbraw/zinc/40/91/86/863409186.db2.gz YRDMUUAURNXBQR-FQEVSTJZSA-N 0 3 422.573 4.262 20 0 HIADHN CC[C@@H](C(=O)NC1CCN(CCOC(C)C)CC1)c1cccc(C(F)(F)F)c1 ZINC000438047135 863411190 /nfs/dbraw/zinc/41/11/90/863411190.db2.gz BRGOSQOQLFWJMK-LJQANCHMSA-N 0 3 400.485 4.205 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)N[C@H]1C[C@@H]1c1ccccc1OC(F)F ZINC000438053586 863420207 /nfs/dbraw/zinc/42/02/07/863420207.db2.gz VOVZJLILOWWTMH-AABGKKOBSA-N 0 3 415.484 4.280 20 0 HIADHN CCSc1ccc(Cl)cc1C(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000438067865 863447017 /nfs/dbraw/zinc/44/70/17/863447017.db2.gz QPWBIQKNUSBUMQ-IYBDPMFKSA-N 0 3 411.011 4.413 20 0 HIADHN CCO[C@H]1C[C@@H](NC(=O)Nc2ccc(CCN3CCSCC3)cc2)C12CCCC2 ZINC000438078130 863470746 /nfs/dbraw/zinc/47/07/46/863470746.db2.gz HMWONJKYWUAXKL-RTWAWAEBSA-N 0 3 417.619 4.137 20 0 HIADHN CCCN(CC(F)(F)F)C(=O)[C@H]1CCCN(Cc2c[nH]nc2-c2ccsc2)C1 ZINC000438104903 863516016 /nfs/dbraw/zinc/51/60/16/863516016.db2.gz OOBZOSRGFQCCMG-AWEZNQCLSA-N 0 3 414.497 4.151 20 0 HIADHN CO[C@H](C)c1nc(CN2CCCN(Cc3ccc4nc(C)ccc4c3)CC2)cs1 ZINC000438109876 863522615 /nfs/dbraw/zinc/52/26/15/863522615.db2.gz QDQFCOMOSXCFNJ-GOSISDBHSA-N 0 3 410.587 4.415 20 0 HIADHN CCOc1ccc(NC(=O)CN2CCN([C@H]3CC[C@@](C)(c4ccccc4)C3)CC2)cc1 ZINC000438122877 863541759 /nfs/dbraw/zinc/54/17/59/863541759.db2.gz ROVGACZRLJKHSL-JYFHCDHNSA-N 0 3 421.585 4.152 20 0 HIADHN Cc1ccc(-c2nc3cc(F)ccc3n2C)cc1NC(=O)N1CC[C@@H](N2CC=CC2)C1 ZINC000438255371 863720568 /nfs/dbraw/zinc/72/05/68/863720568.db2.gz HDXXRDQTAILYDY-LJQANCHMSA-N 0 3 419.504 4.166 20 0 HIADHN CCCn1ccc2ccc(NC(=O)NCc3ccc(CN4CCN(C)CC4)cc3)cc21 ZINC000438284555 863758314 /nfs/dbraw/zinc/75/83/14/863758314.db2.gz PKBCVPCHYOYSJP-UHFFFAOYSA-N 0 3 419.573 4.120 20 0 HIADHN C[C@@H](N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)c1cccc(Br)c1 ZINC000467847103 881694033 /nfs/dbraw/zinc/69/40/33/881694033.db2.gz UXCAPAWUUPJGAJ-UZLBHIALSA-N 0 3 401.348 4.333 20 0 HIADHN C[C@@H](NCCC(=O)N(C)Cc1ccccc1Br)c1ccc(F)c(F)c1 ZINC000467849687 881695848 /nfs/dbraw/zinc/69/58/48/881695848.db2.gz HHJLWHHELPXBEG-CYBMUJFWSA-N 0 3 411.290 4.427 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(Cl)cc2)CC1)C1(Cc2ccccc2)CC1 ZINC000438324341 863802342 /nfs/dbraw/zinc/80/23/42/863802342.db2.gz KSFYGFHTNUFACB-UHFFFAOYSA-N 0 3 412.961 4.322 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)Nc2ccc(C(=O)NC(C)(C)C)cc2)CC1 ZINC000438327018 863804657 /nfs/dbraw/zinc/80/46/57/863804657.db2.gz WZMZJKKLJMXMJC-UHFFFAOYSA-N 0 3 422.573 4.343 20 0 HIADHN CC(C)c1nn(-c2ccc(Br)cc2)cc1CN1CC[C@H](O)C(C)(C)C1 ZINC000438340924 863813599 /nfs/dbraw/zinc/81/35/99/863813599.db2.gz YSENQSWPVZZBKO-SFHVURJKSA-N 0 3 406.368 4.351 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3ccc(CC(F)(F)F)cc3)CC2)C[C@H](C)O1 ZINC000438373938 863832819 /nfs/dbraw/zinc/83/28/19/863832819.db2.gz KIYFQEQTPCQIIU-IYBDPMFKSA-N 0 3 413.484 4.145 20 0 HIADHN CN(C(=O)N[C@H]1C[C@@H]1c1ccccc1OC(F)F)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000438406069 863851724 /nfs/dbraw/zinc/85/17/24/863851724.db2.gz YGAYOSXEYSQMLS-RLLQIKCJSA-N 0 3 415.484 4.060 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)N[C@H]1C[C@@H]1c1ccccc1OC(F)F ZINC000438411651 863853907 /nfs/dbraw/zinc/85/39/07/863853907.db2.gz PAJBDWDPTDEKMJ-MJGOQNOKSA-N 0 3 421.463 4.056 20 0 HIADHN COc1ccc(Oc2ccc(NC(=O)N[C@H]3CCN(Cc4ccccc4)C3)cn2)cc1 ZINC000438442029 863868238 /nfs/dbraw/zinc/86/82/38/863868238.db2.gz BTKPRMOFWFAINT-FQEVSTJZSA-N 0 3 418.497 4.279 20 0 HIADHN Cc1cc(NC(=O)N2CCC(CN3C[C@@H](C)O[C@H](C)C3)CC2)ccc1OC(C)C ZINC000438444047 863870328 /nfs/dbraw/zinc/87/03/28/863870328.db2.gz IENUGUYPNWKTJD-RTBURBONSA-N 0 3 403.567 4.135 20 0 HIADHN Cc1cc(NC(=O)N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)ccc1OC(C)C ZINC000438444041 863870632 /nfs/dbraw/zinc/87/06/32/863870632.db2.gz IENUGUYPNWKTJD-KDURUIRLSA-N 0 3 403.567 4.135 20 0 HIADHN Cc1ccc(OCc2cccc(C(=O)N(CCN(C)C)Cc3cccs3)c2)cn1 ZINC000438469452 863889698 /nfs/dbraw/zinc/88/96/98/863889698.db2.gz WHVJJKIVFVFUBT-UHFFFAOYSA-N 0 3 409.555 4.235 20 0 HIADHN COc1ccccc1NC(=O)c1ccc(NC(=O)[C@H](C)N2CC[C@H](C(C)C)C2)cc1 ZINC000438487763 863904444 /nfs/dbraw/zinc/90/44/44/863904444.db2.gz UISHRCADNCWTIZ-HKUYNNGSSA-N 0 3 409.530 4.252 20 0 HIADHN C[C@@H](N(C)CC(=O)N(Cc1nnc(-c2ccccc2Cl)o1)C1CC1)C1(C)CC1 ZINC000438566481 864000358 /nfs/dbraw/zinc/00/03/58/864000358.db2.gz JNUGOYQJGPMXFL-CQSZACIVSA-N 0 3 402.926 4.001 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)Nc3cccc(CC(F)(F)F)c3)CC2)C[C@H](C)O1 ZINC000438571658 864005388 /nfs/dbraw/zinc/00/53/88/864005388.db2.gz ZUBMNWLXANTIBB-HOTGVXAUSA-N 0 3 413.484 4.145 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)Nc1ccc(F)c(Br)c1 ZINC000438595322 864023836 /nfs/dbraw/zinc/02/38/36/864023836.db2.gz ASZDUVYVIUVYLM-UHFFFAOYSA-N 0 3 412.278 4.323 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Nc1cc(Br)ccc1F ZINC000438646420 864085433 /nfs/dbraw/zinc/08/54/33/864085433.db2.gz YTUFGXXVWVGBMQ-UHFFFAOYSA-N 0 3 400.317 4.245 20 0 HIADHN CCN(C(=O)C(=O)Nc1ccc(F)c(Cl)c1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000438664927 864116761 /nfs/dbraw/zinc/11/67/61/864116761.db2.gz BIMXKVWDSOYADM-MAUKXSAKSA-N 0 3 417.912 4.102 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)Nc1cccc(Oc2ccccn2)c1 ZINC000438670504 864129903 /nfs/dbraw/zinc/12/99/03/864129903.db2.gz WGGOEXLCOGDNMU-UHFFFAOYSA-N 0 3 402.498 4.444 20 0 HIADHN Cc1ccc(NC(=O)N(CCN(C)C)Cc2cccs2)c(OC[C@@H]2CCCO2)c1 ZINC000438681463 864145261 /nfs/dbraw/zinc/14/52/61/864145261.db2.gz PEUDVWAXLZQICG-SFHVURJKSA-N 0 3 417.575 4.210 20 0 HIADHN CSc1ccc(OCCN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)cc1 ZINC000438782230 864276974 /nfs/dbraw/zinc/27/69/74/864276974.db2.gz NISOWFXFCLKPBL-UHFFFAOYSA-N 0 3 405.951 4.186 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Cc3cccc(OC(F)(F)F)c3)c(C)c2)CC1 ZINC000438900837 864382946 /nfs/dbraw/zinc/38/29/46/864382946.db2.gz YCBCOKRJBKJFOT-UHFFFAOYSA-N 0 3 421.463 4.217 20 0 HIADHN Cc1cc(Br)ccc1NC(=O)CN1CCCC[C@@H]1[C@@H]1C[C@@H](C)CC[C@@H]1O ZINC000439014796 864466266 /nfs/dbraw/zinc/46/62/66/864466266.db2.gz KITWZNURCUQHSB-OBZTVWKBSA-N 0 3 423.395 4.348 20 0 HIADHN CN(C)c1ccc(Cl)cc1NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000467915530 881784793 /nfs/dbraw/zinc/78/47/93/881784793.db2.gz GMITXMPABDDDHB-UHFFFAOYSA-N 0 3 418.891 4.333 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3ccccc3OCC)c(OCC)c2)CC1 ZINC000439301370 864729130 /nfs/dbraw/zinc/72/91/30/864729130.db2.gz ZFRNVGXPPOQATP-UHFFFAOYSA-N 0 3 411.546 4.268 20 0 HIADHN Cc1nc(C)c([C@@H](C)N(C)C[C@H](O)COc2cc(F)cc(Br)c2)s1 ZINC000439436456 864830573 /nfs/dbraw/zinc/83/05/73/864830573.db2.gz XAQARTLAUJSJNV-ABAIWWIYSA-N 0 3 417.344 4.094 20 0 HIADHN COc1ccccc1[C@@H](CNCc1cc(Cl)ccc1OC[C@H]1CCCO1)N(C)C ZINC000439475979 864844602 /nfs/dbraw/zinc/84/46/02/864844602.db2.gz GRBNOSYNDZLCPN-TZIWHRDSSA-N 0 3 418.965 4.299 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(C(F)(F)F)cc1)C(=O)N1CCN(c2ccc(F)cc2)CC1 ZINC000439549758 864876760 /nfs/dbraw/zinc/87/67/60/864876760.db2.gz ODXKDOODIQHFPX-JKSUJKDBSA-N 0 3 423.454 4.232 20 0 HIADHN C[C@@H](NCC1(c2ccc3c(c2)OCO3)CCOCC1)c1ncc(-c2ccccc2)o1 ZINC000439570743 864893635 /nfs/dbraw/zinc/89/36/35/864893635.db2.gz NBXJFLISJLEBIN-QGZVFWFLSA-N 0 3 406.482 4.469 20 0 HIADHN C[C@H](NCc1ccccc1CN(C)Cc1ccco1)C(=O)Nc1ccc(F)c(F)c1 ZINC000439597336 864919990 /nfs/dbraw/zinc/91/99/90/864919990.db2.gz PVYLOMQOGPUHJQ-INIZCTEOSA-N 0 3 413.468 4.307 20 0 HIADHN CN(Cc1ccco1)Cc1ccccc1CN[C@H]1CCCN(c2cccc(F)c2)C1=O ZINC000439599148 864920898 /nfs/dbraw/zinc/92/08/98/864920898.db2.gz ROFJLVWSAFXBML-DEOSSOPVSA-N 0 3 421.516 4.336 20 0 HIADHN Cc1ccc(NC(=O)[C@@H](NCCc2cccc(C(=O)N(C)C)c2)c2ccccc2)cc1 ZINC000439606163 864927585 /nfs/dbraw/zinc/92/75/85/864927585.db2.gz FDCGTYXEOZOTNQ-DEOSSOPVSA-N 0 3 415.537 4.209 20 0 HIADHN C[C@@H](NCc1ccccc1CN(C)Cc1ccco1)C(=O)Nc1ccc(F)cc1F ZINC000439608726 864930267 /nfs/dbraw/zinc/93/02/67/864930267.db2.gz BMEASFVYLNZTRP-MRXNPFEDSA-N 0 3 413.468 4.307 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@H]2CN[C@@H](C(N)=O)c2ccc(Br)cc2)cc1 ZINC000439659206 864987681 /nfs/dbraw/zinc/98/76/81/864987681.db2.gz DQTXREHCWDKISW-SXLOBPIMSA-N 0 3 417.347 4.041 20 0 HIADHN C[C@@H](Oc1ccccc1C(F)(F)F)C(=O)NC1CCN([C@H](C)c2ccncc2)CC1 ZINC000439732840 865064538 /nfs/dbraw/zinc/06/45/38/865064538.db2.gz BLLMCRUPVJJQOR-HZPDHXFCSA-N 0 3 421.463 4.210 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)CCc2ncc(-c3ccccc3)o2)CC1 ZINC000439743141 865075504 /nfs/dbraw/zinc/07/55/04/865075504.db2.gz IXJCCNHEYSEUAI-SFHVURJKSA-N 0 3 404.514 4.011 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)COc2cc(Cl)cc(Cl)c2)CC1 ZINC000439751196 865080310 /nfs/dbraw/zinc/08/03/10/865080310.db2.gz LDGAENNTDKZVHY-AWEZNQCLSA-N 0 3 408.329 4.109 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)C[C@H](c2ccccc2)C(F)(F)F)CC1 ZINC000439763319 865088882 /nfs/dbraw/zinc/08/88/82/865088882.db2.gz HSKZUBOFGDFWMO-OXJNMPFZSA-N 0 3 405.464 4.459 20 0 HIADHN Cc1ccc(Br)cc1C(=O)NC1CCN([C@@H](C)c2ccncc2)CC1 ZINC000439771121 865095486 /nfs/dbraw/zinc/09/54/86/865095486.db2.gz ZEEDWVAFCFOVIN-HNNXBMFYSA-N 0 3 402.336 4.108 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)c2[nH]c3ccc(F)cc3c2Cl)CC1 ZINC000439770343 865095986 /nfs/dbraw/zinc/09/59/86/865095986.db2.gz QQJKHORIAHQJTH-ZDUSSCGKSA-N 0 3 400.885 4.311 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)CCc2ncc(-c3ccccc3F)o2)CC1 ZINC000439777143 865101097 /nfs/dbraw/zinc/10/10/97/865101097.db2.gz ZKOYPCMIFIRAID-KRWDZBQOSA-N 0 3 422.504 4.150 20 0 HIADHN C[C@H](C(=O)Nc1ccccc1CN1CCC[C@H](C(N)=O)C1)c1ccc2ccccc2c1 ZINC000439796823 865117205 /nfs/dbraw/zinc/11/72/05/865117205.db2.gz ZFOLWALJMPEVQL-MBSDFSHPSA-N 0 3 415.537 4.279 20 0 HIADHN CCN(C(=O)c1ccc(-c2nnc(C)o2)cc1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000467991463 881837852 /nfs/dbraw/zinc/83/78/52/881837852.db2.gz ZLCRHBQNNOVDKH-JTSKRJEESA-N 0 3 404.514 4.343 20 0 HIADHN C[C@H](C(=O)NCc1ccc(CN2CCN(C)CC2)cc1)c1ccc2ccccc2c1 ZINC000439914404 865221936 /nfs/dbraw/zinc/22/19/36/865221936.db2.gz NQAYEPCOPRRAOQ-FQEVSTJZSA-N 0 3 401.554 4.007 20 0 HIADHN O=C(Nc1cccc(OCc2cn3ccccc3n2)c1)[C@H]1CCCN1C1CCCC1 ZINC000439951984 865244848 /nfs/dbraw/zinc/24/48/48/865244848.db2.gz BQXGRLAAKFDLND-JOCHJYFZSA-N 0 3 404.514 4.259 20 0 HIADHN Cc1ccc(-c2ccnn2C)cc1NC(=O)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000439956151 865248982 /nfs/dbraw/zinc/24/89/82/865248982.db2.gz LGIUNEPQRUGOMR-QFIPXVFZSA-N 0 3 403.530 4.354 20 0 HIADHN Cc1ccc(-c2ccnn2C)cc1NC(=O)N[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000439968834 865260210 /nfs/dbraw/zinc/26/02/10/865260210.db2.gz PTUWSXRQUDADQX-NQIIRXRSSA-N 0 3 403.530 4.353 20 0 HIADHN CC(C)C1CCC(N2CCN(C(=O)CCCc3nc(C(C)(C)C)no3)CC2)CC1 ZINC000439989010 865295858 /nfs/dbraw/zinc/29/58/58/865295858.db2.gz PODXXTOSPDHFTO-UHFFFAOYSA-N 0 3 404.599 4.049 20 0 HIADHN CC(C)N(CCN(C)C)C(=O)N[C@H]1CCCc2nc(-c3ccc(F)cc3)sc21 ZINC000440091524 865352657 /nfs/dbraw/zinc/35/26/57/865352657.db2.gz XKGDLEKHHZOCSU-SFHVURJKSA-N 0 3 404.555 4.308 20 0 HIADHN Cc1ccc(C(=O)NCC2CC2)cc1NC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000440136740 865375691 /nfs/dbraw/zinc/37/56/91/865375691.db2.gz XJVWRKIZVMEETJ-OAQYLSRUSA-N 0 3 423.532 4.125 20 0 HIADHN CCN1CCN(CCC(=O)N(Cc2ccc(-c3ccc(C)cc3)s2)C(C)C)CC1 ZINC000468036689 881867559 /nfs/dbraw/zinc/86/75/59/881867559.db2.gz FNPBZWJFXOCQNI-UHFFFAOYSA-N 0 3 413.631 4.488 20 0 HIADHN COc1ccc([C@H](NC[C@@H](O)COCC(C)C)c2ccccc2)cc1Br ZINC000440186957 865414002 /nfs/dbraw/zinc/41/40/02/865414002.db2.gz BSXWKBHEBGFNKY-WIYYLYMNSA-N 0 3 422.363 4.170 20 0 HIADHN COc1ccc([C@H](NC[C@H](O)COCC(C)C)c2ccccc2)cc1Br ZINC000440186952 865414200 /nfs/dbraw/zinc/41/42/00/865414200.db2.gz BSXWKBHEBGFNKY-GHTZIAJQSA-N 0 3 422.363 4.170 20 0 HIADHN COc1ccc(NC(=O)C[C@H](C)N[C@H](C)c2cn(C(C)(C)C)nc2C)c(OC)c1 ZINC000468040161 881869464 /nfs/dbraw/zinc/86/94/64/881869464.db2.gz DZIYAQLVOZLQMJ-LSDHHAIUSA-N 0 3 402.539 4.032 20 0 HIADHN C[C@@H](NC(=O)N(CCN(C)C)C1CCCC1)c1ccc(OCC(F)(F)F)cc1 ZINC000468049832 881875448 /nfs/dbraw/zinc/87/54/48/881875448.db2.gz AOFNKFUIOYLDQX-OAHLLOKOSA-N 0 3 401.473 4.205 20 0 HIADHN CN(C(=O)NCc1cccc(-c2ccccn2)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000440249440 865489195 /nfs/dbraw/zinc/48/91/95/865489195.db2.gz YXFKYXYRGXKUGF-QHCPKHFHSA-N 0 3 400.526 4.165 20 0 HIADHN CC(=O)Nc1cccc(NC(=O)N2CCN(C3CCC(C(C)C)CC3)CC2)c1C ZINC000440260638 865513309 /nfs/dbraw/zinc/51/33/09/865513309.db2.gz OMWLAKLFWGQLKW-UHFFFAOYSA-N 0 3 400.567 4.318 20 0 HIADHN O=C(CC1(N2CCOCC2)CCCC1)N1CCC[C@H]1c1ccc(Br)cc1 ZINC000468067245 881884889 /nfs/dbraw/zinc/88/48/89/881884889.db2.gz CKVNOYJZFSOOLM-IBGZPJMESA-N 0 3 421.379 4.148 20 0 HIADHN COc1cc(C(C)=O)ccc1OC[C@@H](O)CN1CCC[C@]2(CCCc3ccccc32)C1 ZINC000440327256 865602031 /nfs/dbraw/zinc/60/20/31/865602031.db2.gz QJDXERZDANAXOF-BKMJKUGQSA-N 0 3 423.553 4.008 20 0 HIADHN COc1ccc([C@@H](NC[C@H](O)COCc2cccs2)c2ccc(F)cc2)cc1 ZINC000440413052 865710712 /nfs/dbraw/zinc/71/07/12/865710712.db2.gz IAAYXWNCTAJWEU-UGKGYDQZSA-N 0 3 401.503 4.153 20 0 HIADHN CC(C)CCN(CCC(C)C)C(=O)CN(C)C1CCN(C(=O)c2ccccc2)CC1 ZINC000440460296 865764325 /nfs/dbraw/zinc/76/43/25/865764325.db2.gz KFZFTUFZVKMUMO-UHFFFAOYSA-N 0 3 415.622 4.144 20 0 HIADHN CC(C)[C@H](C(=O)NC1CCN(CCOc2ccc(Cl)cc2)CC1)c1ccncc1 ZINC000468099552 881905888 /nfs/dbraw/zinc/90/58/88/881905888.db2.gz GCCOZDQXUHTQTO-QFIPXVFZSA-N 0 3 415.965 4.134 20 0 HIADHN COc1ccc(COC[C@@H](O)CN2CC=C(c3ccc(Cl)cc3)CC2)cc1OC ZINC000440571101 865822537 /nfs/dbraw/zinc/82/25/37/865822537.db2.gz XSJMULSTVNFBRH-NRFANRHFSA-N 0 3 417.933 4.024 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)c2ccccc2CSc2nc3ccccc3[nH]2)CN1C1CC1 ZINC000440924160 866020338 /nfs/dbraw/zinc/02/03/38/866020338.db2.gz MJAHDVHQWWHSGM-WBVHZDCISA-N 0 3 406.555 4.210 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)c2cccc(NC(=O)CCCc3cccs3)c2)CN1C1CC1 ZINC000440926406 866023684 /nfs/dbraw/zinc/02/36/84/866023684.db2.gz XFLYALFZMOTEPQ-APWZRJJASA-N 0 3 411.571 4.065 20 0 HIADHN Cc1ccc([C@H](OC[C@H](O)CN2CCc3ccccc3[C@H]2CO)c2ccccc2)cc1 ZINC000440935426 866034393 /nfs/dbraw/zinc/03/43/93/866034393.db2.gz KYHHWUXYGWENSQ-ZRJLEYOISA-N 0 3 417.549 4.054 20 0 HIADHN CNC(=O)Cc1nc(CN2CCc3ccccc3[C@@H](c3ccccc3)[C@@H]2C)cs1 ZINC000441063885 866147253 /nfs/dbraw/zinc/14/72/53/866147253.db2.gz HJGPLGBLAFEVQX-BXKMTCNYSA-N 0 3 405.567 4.010 20 0 HIADHN CC(C)OC(=O)c1ccc(CN2CCC(n3cc(Br)cn3)CC2)cc1 ZINC000441151839 866243211 /nfs/dbraw/zinc/24/32/11/866243211.db2.gz VTKPMVVCQTZGLD-UHFFFAOYSA-N 0 3 406.324 4.048 20 0 HIADHN Cc1ccc([C@@H]2CCC[C@@H]2N(C)C(=O)C(=O)Nc2cc(CN(C)C)ccc2C)cc1 ZINC000441255967 866328470 /nfs/dbraw/zinc/32/84/70/866328470.db2.gz HZUSVRUPXOYNLJ-GMAHTHKFSA-N 0 3 407.558 4.098 20 0 HIADHN COc1ccc([C@H](CNC(=O)CN2CCC3(CCC3)C2)c2c[nH]c3ccccc32)cc1 ZINC000468125533 881964486 /nfs/dbraw/zinc/96/44/86/881964486.db2.gz GHFLBJXYGMGRDM-QFIPXVFZSA-N 0 3 417.553 4.301 20 0 HIADHN CC[C@@](C)(COc1ncccc1Cl)NCC(=O)Nc1cc(Cl)ccc1OC ZINC000441304561 866375566 /nfs/dbraw/zinc/37/55/66/866375566.db2.gz HDJHPXMVAYPBPZ-IBGZPJMESA-N 0 3 412.317 4.173 20 0 HIADHN CN1CCN(CCNC(=O)Nc2ccc(Oc3ccccc3Cl)cc2)CC1(C)C ZINC000441307798 866378808 /nfs/dbraw/zinc/37/88/08/866378808.db2.gz FHHHQIXKMIGSHC-UHFFFAOYSA-N 0 3 416.953 4.280 20 0 HIADHN CC[C@H](Cc1ccc(C)cc1)N(C)CC(=O)NCC1(c2ccccc2)CCOCC1 ZINC000441354819 866424830 /nfs/dbraw/zinc/42/48/30/866424830.db2.gz ISKUBPKARITOTE-XMMPIXPASA-N 0 3 408.586 4.113 20 0 HIADHN Cc1ccc([C@H]2CCC[C@H]2N(C)Cc2ccc(S(=O)(=O)N3CCCC3)o2)cc1 ZINC000441360039 866429422 /nfs/dbraw/zinc/42/94/22/866429422.db2.gz XKJBXGYYCMZRDD-NHCUHLMSSA-N 0 3 402.560 4.141 20 0 HIADHN CC[C@H](Cc1ccc(C)cc1)N(C)CC(=O)N1CCC(C(=O)Nc2ccccc2)CC1 ZINC000441363944 866432568 /nfs/dbraw/zinc/43/25/68/866432568.db2.gz XTGYWNDTCNVDCU-XMMPIXPASA-N 0 3 421.585 4.125 20 0 HIADHN C[C@@H](C1CC1)N(Cc1ccccc1)C(=O)CN1CC[C@@H](COCc2ccccc2)C1 ZINC000441364512 866434043 /nfs/dbraw/zinc/43/40/43/866434043.db2.gz ZFWDQAJGSZMUIG-XUZZJYLKSA-N 0 3 406.570 4.352 20 0 HIADHN OC[C@@]1(NCc2ccc(-n3ccc(C(F)(F)F)n3)cc2)CCCc2ccccc21 ZINC000441374410 866443534 /nfs/dbraw/zinc/44/35/34/866443534.db2.gz FJDWRKMOUQDUNY-NRFANRHFSA-N 0 3 401.432 4.205 20 0 HIADHN CC(C)N(Cc1cc(Br)ccc1F)C(=O)N[C@@H]1C[C@H](C)N(C2CC2)C1 ZINC000441378934 866448350 /nfs/dbraw/zinc/44/83/50/866448350.db2.gz CSRPQSGYWBENHO-XJKSGUPXSA-N 0 3 412.347 4.133 20 0 HIADHN COc1ccc(CCN(Cc2ccccc2)C(=O)N[C@H]2C[C@@H](C)N(C3CC3)C2)cc1 ZINC000441382209 866454092 /nfs/dbraw/zinc/45/40/92/866454092.db2.gz KABOFSRYQKQLJY-KNQAVFIVSA-N 0 3 407.558 4.075 20 0 HIADHN CSc1ccc(CN(C)C(=O)CN2CC[C@H](CSc3ccccc3)C2)cc1 ZINC000441510431 866590526 /nfs/dbraw/zinc/59/05/26/866590526.db2.gz CYWHHVXZUQXUFN-IBGZPJMESA-N 0 3 400.613 4.481 20 0 HIADHN CN1CCN(CCNC(=O)Nc2cc(-c3ccccc3)ccc2Cl)CC1(C)C ZINC000441802333 866868670 /nfs/dbraw/zinc/86/86/70/866868670.db2.gz YRRVUQCKDOXPLK-UHFFFAOYSA-N 0 3 400.954 4.155 20 0 HIADHN CC(C)Sc1c(Cl)cccc1NC(=O)C(=O)NCCN1[C@H](C)CCC[C@H]1C ZINC000441848602 866910229 /nfs/dbraw/zinc/91/02/29/866910229.db2.gz VAFRNPDKDUMTKB-HUUCEWRRSA-N 0 3 411.999 4.158 20 0 HIADHN Cn1nccc1[C@H]1CCCN(Cc2ccnc(-c3ccc(Br)cc3)n2)C1 ZINC000441905538 866970079 /nfs/dbraw/zinc/97/00/79/866970079.db2.gz QLVURQYZLNNIFF-INIZCTEOSA-N 0 3 412.335 4.019 20 0 HIADHN CC[C@@H]1CCc2nc(NC(=O)N3CCC(CN4C[C@@H](C)O[C@@H](C)C4)CC3)sc2C1 ZINC000441940338 867005777 /nfs/dbraw/zinc/00/57/77/867005777.db2.gz FHFVQODCGHLENK-IXDOHACOSA-N 0 3 420.623 4.011 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)C(=O)Nc3ccccc3C(C)(C)C)c2)CC1 ZINC000442177910 867200454 /nfs/dbraw/zinc/20/04/54/867200454.db2.gz SVVNJSHKTPSHFF-UHFFFAOYSA-N 0 3 422.573 4.092 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N[C@@H]1c2ccccc2CC[C@@H]1C(C)C ZINC000442549365 867524201 /nfs/dbraw/zinc/52/42/01/867524201.db2.gz YMIIGJYTSPYPON-OFNKIYASSA-N 0 3 407.558 4.071 20 0 HIADHN COc1ccc([C@@H](CNC(=O)CCc2c[nH]c3ccc(C)cc23)N2CCCC2)cc1 ZINC000468212355 882093984 /nfs/dbraw/zinc/09/39/84/882093984.db2.gz OCUHESUYROLSFR-XMMPIXPASA-N 0 3 405.542 4.371 20 0 HIADHN CN(C)CCN(C[C@@H]1CCCO1)C(=O)c1[nH]ccc1-c1c(Cl)cccc1Cl ZINC000442734622 867655485 /nfs/dbraw/zinc/65/54/85/867655485.db2.gz UVGFRYUVTRAVLI-AWEZNQCLSA-N 0 3 410.345 4.171 20 0 HIADHN CCc1ccccc1CC(=O)NC1CCN(CCOc2ccc(Cl)cc2)CC1 ZINC000442982260 867778304 /nfs/dbraw/zinc/77/83/04/867778304.db2.gz XFQDSAUEFFVBIC-UHFFFAOYSA-N 0 3 400.950 4.105 20 0 HIADHN CCOc1cc(CN2CC[C@H](OC)C[C@@H]2C)ccc1OCc1ccc(C(=O)OC)o1 ZINC000443065683 867808648 /nfs/dbraw/zinc/80/86/48/867808648.db2.gz IGAZMOSQCBVQQU-WMZOPIPTSA-N 0 3 417.502 4.043 20 0 HIADHN CC(C)NC(=O)Nc1ccc([C@@H](C)N[C@H]2CCCN(C3CCCCC3)C2=O)cc1 ZINC000443102710 867819218 /nfs/dbraw/zinc/81/92/18/867819218.db2.gz MRYCQEYOVSGQCD-UTKZUKDTSA-N 0 3 400.567 4.191 20 0 HIADHN C[C@H](c1nc(-c2ccc(N(C)C(=O)c3ccncc3)cc2)no1)N1[C@H](C)CC[C@@H]1C ZINC000443201840 867873316 /nfs/dbraw/zinc/87/33/16/867873316.db2.gz JGMNDRXUNRGZPD-IXDOHACOSA-N 0 3 405.502 4.342 20 0 HIADHN Cc1c(F)c(C(F)(F)F)ccc1C(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000443292168 867893201 /nfs/dbraw/zinc/89/32/01/867893201.db2.gz HEFFCEHYRGQRLZ-UHFFFAOYSA-N 0 3 424.438 4.040 20 0 HIADHN CC(C)[C@@H](Cc1ccccc1)C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000443343343 867914245 /nfs/dbraw/zinc/91/42/45/867914245.db2.gz IZLOVGHMPMZNEO-XMMPIXPASA-N 0 3 412.549 4.300 20 0 HIADHN CC[C@]1(C)Oc2ccc(NC(=O)N(CCN(C)C)Cc3ccc(F)cc3)cc2O1 ZINC000443372166 867934151 /nfs/dbraw/zinc/93/41/51/867934151.db2.gz JJUOZDPIDLSJSR-JOCHJYFZSA-N 0 3 401.482 4.319 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)N[C@H]1CCOc2c(F)cccc21 ZINC000443552976 868108099 /nfs/dbraw/zinc/10/80/99/868108099.db2.gz ONJBEVMPDMSJMU-IBGZPJMESA-N 0 3 405.901 4.076 20 0 HIADHN CCN(Cc1ccn(-c2c(F)cccc2F)n1)CC1CCN(c2ccccn2)CC1 ZINC000443601977 868161867 /nfs/dbraw/zinc/16/18/67/868161867.db2.gz GUNFUBZZBXQAJY-UHFFFAOYSA-N 0 3 411.500 4.284 20 0 HIADHN O[C@H](COc1ccccc1Cl)CN1CCC[C@@H](c2nc3ccc(F)cc3o2)C1 ZINC000443652199 868248539 /nfs/dbraw/zinc/24/85/39/868248539.db2.gz UACYNKYCRBYXBY-ZBFHGGJFSA-N 0 3 404.869 4.240 20 0 HIADHN COc1ccc(-c2cc(C(=O)NCCCCN3C[C@H](C)O[C@@H](C)C3)sc2C)cc1 ZINC000443671619 868278569 /nfs/dbraw/zinc/27/85/69/868278569.db2.gz CQCBZCFILAKRTJ-IRXDYDNUSA-N 0 3 416.587 4.351 20 0 HIADHN CC[C@H](C(=O)NCCCCN1C[C@@H](C)O[C@H](C)C1)c1cccc(C(F)(F)F)c1 ZINC000443675869 868282471 /nfs/dbraw/zinc/28/24/71/868282471.db2.gz OSMBJLAVXJDKBE-MDZRGWNJSA-N 0 3 400.485 4.205 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)N[C@H](C)c2ccc(Br)s2)o1 ZINC000443718698 868304334 /nfs/dbraw/zinc/30/43/34/868304334.db2.gz AQZYZNRBKTVOTI-CYBMUJFWSA-N 0 3 414.369 4.246 20 0 HIADHN Cc1[nH]c2ccc(Cl)cc2c1C(=O)Nc1ccc(C(=O)NCCN2CCCC2)cc1 ZINC000443745667 868320788 /nfs/dbraw/zinc/32/07/88/868320788.db2.gz HOBMJPNQKJWTPT-UHFFFAOYSA-N 0 3 424.932 4.208 20 0 HIADHN CCOC(=O)c1c(NC(=O)CC[C@@H]2CC[C@@H](C)O2)sc2c1CC(C)(C)NC2(C)C ZINC000443810521 868345093 /nfs/dbraw/zinc/34/50/93/868345093.db2.gz AVTUQJQJXKQZIF-KGLIPLIRSA-N 0 3 422.591 4.370 20 0 HIADHN Cc1ccccc1[C@@H]([C@@H](C)NC(=O)C(=O)Nc1cccc(C(F)(F)F)c1C)N(C)C ZINC000443843053 868374414 /nfs/dbraw/zinc/37/44/14/868374414.db2.gz RDTAZEIMCRRNSQ-DNVCBOLYSA-N 0 3 421.463 4.068 20 0 HIADHN CN(C)C(=O)COc1cccc(CNCc2ccc(Oc3cccc(F)c3)cc2)c1 ZINC000443982647 868507529 /nfs/dbraw/zinc/50/75/29/868507529.db2.gz UJLCSPKUIZTFQA-UHFFFAOYSA-N 0 3 408.473 4.375 20 0 HIADHN COc1ccc(CN[C@@H]2CCN(c3ccccc3OC)C2)c(OCc2cccnc2)c1 ZINC000443999155 868520492 /nfs/dbraw/zinc/52/04/92/868520492.db2.gz BKFNOXAOMCHJRP-OAQYLSRUSA-N 0 3 419.525 4.046 20 0 HIADHN Cc1occc1C(=O)Nc1cc(NC(=O)N(CCN(C)C)CC(C)C)ccc1F ZINC000444018229 868541715 /nfs/dbraw/zinc/54/17/15/868541715.db2.gz CFMYPWILPVLYQN-UHFFFAOYSA-N 0 3 404.486 4.031 20 0 HIADHN Clc1cc(Cl)cc(-c2nnc(N3CCN(CC4CCOCC4)CC3)s2)c1 ZINC000444085404 868608417 /nfs/dbraw/zinc/60/84/17/868608417.db2.gz HFAFLEJYIFNDLZ-UHFFFAOYSA-N 0 3 413.374 4.061 20 0 HIADHN C[C@H](NC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1)c1ccc(Br)s1 ZINC000444107181 868622217 /nfs/dbraw/zinc/62/22/17/868622217.db2.gz VDEJTDJIPXLQRA-HOCLYGCPSA-N 0 3 422.392 4.488 20 0 HIADHN COc1ccc(CNC(=O)N(CCN(C)C)C2CCCC2)cc1OC1CCCC1 ZINC000468298711 882223357 /nfs/dbraw/zinc/22/33/57/882223357.db2.gz XCTQCFRRJZPYRH-UHFFFAOYSA-N 0 3 403.567 4.032 20 0 HIADHN Cc1nc(-c2ccccc2)c(C(=O)Nc2cccc(CN3CCC(O)CC3)c2)s1 ZINC000444461062 868836769 /nfs/dbraw/zinc/83/67/69/868836769.db2.gz NSOJAPKVJXOWSP-UHFFFAOYSA-N 0 3 407.539 4.328 20 0 HIADHN CC(C)(C)c1cccc2c1OCCN2C(=O)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000444472801 868843365 /nfs/dbraw/zinc/84/33/65/868843365.db2.gz ATYYNKQSLCZUKF-UHFFFAOYSA-N 0 3 422.569 4.228 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)NC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000444585223 868891131 /nfs/dbraw/zinc/89/11/31/868891131.db2.gz YBCZIVAYIBLDLS-AUSIDOKSSA-N 0 3 417.557 4.206 20 0 HIADHN O=C(Nc1ccc(Nc2ncccn2)cc1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000444615516 868909082 /nfs/dbraw/zinc/90/90/82/868909082.db2.gz GRJQCGWBYWCRBT-GOSISDBHSA-N 0 3 405.477 4.210 20 0 HIADHN COc1ccc(-c2nc(NC(=O)CN[C@@H]3CC(C)(C)OC3(C)C)sc2C)cc1 ZINC000444641384 868927672 /nfs/dbraw/zinc/92/76/72/868927672.db2.gz UQJQJHVGDJOVED-MRXNPFEDSA-N 0 3 403.548 4.001 20 0 HIADHN Clc1ccc(C[C@@H](NCc2nnnn2CC2CCOCC2)C2CCCCC2)cc1 ZINC000444683295 868957245 /nfs/dbraw/zinc/95/72/45/868957245.db2.gz FIDMUGJTYLZSNE-OAQYLSRUSA-N 0 3 417.985 4.034 20 0 HIADHN C[C@@H](c1ccco1)N(C(=O)NCCCCN1CCN(Cc2ccccc2)CC1)C1CC1 ZINC000444717280 868973804 /nfs/dbraw/zinc/97/38/04/868973804.db2.gz RVXCJQYTYCMYGO-NRFANRHFSA-N 0 3 424.589 4.113 20 0 HIADHN O=C(CCN1CCC[C@@H]([C@@H](O)C(F)(F)F)C1)Nc1ccccc1Oc1ccccc1 ZINC000444723059 868976535 /nfs/dbraw/zinc/97/65/35/868976535.db2.gz UCEDRVKGNYUECF-IIBYNOLFSA-N 0 3 422.447 4.443 20 0 HIADHN Cc1ccccc1[C@H](CC(F)(F)F)NCCOc1cccc(S(C)(=O)=O)c1 ZINC000444777425 868998344 /nfs/dbraw/zinc/99/83/44/868998344.db2.gz FQUSGLLQFWDKAF-SFHVURJKSA-N 0 3 401.450 4.061 20 0 HIADHN Cc1cc(OC[C@H](O)CN2CCC[C@@H](c3nccn3C)C2)c(C(C)C)cc1Cl ZINC000444789299 869005680 /nfs/dbraw/zinc/00/56/80/869005680.db2.gz DKVXKGBIDWDKRP-QZTJIDSGSA-N 0 3 405.970 4.125 20 0 HIADHN CN(CCN1CCN(C(=O)Nc2cccc(C(C)(F)F)c2)CC1)Cc1ccccc1 ZINC000444940702 869120611 /nfs/dbraw/zinc/12/06/11/869120611.db2.gz IMSZLCBOLPSQIT-UHFFFAOYSA-N 0 3 416.516 4.080 20 0 HIADHN COc1cc(NC(=O)N(CCN(C)C)Cc2ccc(Br)cc2)ccc1F ZINC000445005961 869159825 /nfs/dbraw/zinc/15/98/25/869159825.db2.gz BFXQOMANOGCPJI-UHFFFAOYSA-N 0 3 424.314 4.193 20 0 HIADHN Cc1nnc2ccc(-c3noc(-c4cccc(CN(C)Cc5ccccc5)c4)n3)cn12 ZINC000445635627 869705655 /nfs/dbraw/zinc/70/56/55/869705655.db2.gz GZDHMOGPTFIINZ-UHFFFAOYSA-N 0 3 410.481 4.387 20 0 HIADHN CCc1ccccc1NC(=O)CN1CCN(CC2CCC(C(F)(F)F)CC2)CC1 ZINC000468403803 882345626 /nfs/dbraw/zinc/34/56/26/882345626.db2.gz ZGRCHALPEKIPRP-UHFFFAOYSA-N 0 3 411.512 4.174 20 0 HIADHN CC(C)[C@@H](NC(=O)CN[C@@H](CC(F)(F)F)C(C)C)c1ccc2c(c1)OCCCO2 ZINC000445878767 869869725 /nfs/dbraw/zinc/86/97/25/869869725.db2.gz WAMWAADMHLMOGI-OXJNMPFZSA-N 0 3 416.484 4.228 20 0 HIADHN CC(C)[C@@H](CC(F)(F)F)NCC(=O)N[C@H](c1ccc2c(c1)OCCCO2)C(C)C ZINC000445878769 869869812 /nfs/dbraw/zinc/86/98/12/869869812.db2.gz WAMWAADMHLMOGI-UZLBHIALSA-N 0 3 416.484 4.228 20 0 HIADHN Cc1nc(CC(C)C)c(C(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)s1 ZINC000445942653 869902464 /nfs/dbraw/zinc/90/24/64/869902464.db2.gz DDJLJPFLNAZGJH-CALCHBBNSA-N 0 3 407.624 4.002 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)CCC(=O)c2ccc(F)c(F)c2)CCN1Cc1ccccc1 ZINC000445945500 869906500 /nfs/dbraw/zinc/90/65/00/869906500.db2.gz ZDSKXAGVNJFIRT-LPHOPBHVSA-N 0 3 400.469 4.097 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3cc(F)cc(C(F)(F)F)c3)CC2)C[C@@H](C)O1 ZINC000445946385 869908350 /nfs/dbraw/zinc/90/83/50/869908350.db2.gz JGCVSJPUZFXVKJ-HUUCEWRRSA-N 0 3 416.459 4.196 20 0 HIADHN O=C1NC(CC(F)(F)F)C(=O)N1c1ccc(Oc2cccc(C(F)(F)F)n2)cc1 ZINC000445971022 869940941 /nfs/dbraw/zinc/94/09/41/869940941.db2.gz JJLPNJOJYIGFCU-LLVKDONJSA-N 0 3 419.281 4.270 20 0 HIADHN CSCc1cc(F)ccc1CNC(=O)N1CCCN(Cc2ccccc2)CC1 ZINC000446017601 869985302 /nfs/dbraw/zinc/98/53/02/869985302.db2.gz AKCQSGPGJFOLJX-UHFFFAOYSA-N 0 3 401.551 4.106 20 0 HIADHN O=C(CCN1CCN(c2ccccc2)CC1)N[C@H](c1ccccc1)c1ccc(F)cc1 ZINC000468419892 882364276 /nfs/dbraw/zinc/36/42/76/882364276.db2.gz WAHJDTSMPDCTTG-AREMUKBSSA-N 0 3 417.528 4.244 20 0 HIADHN CN(C)CCn1c(=O)oc2ccc(NC(=O)CCCc3csc4ccccc34)cc21 ZINC000446131529 870076029 /nfs/dbraw/zinc/07/60/29/870076029.db2.gz NCCGBHYQXLKNKF-UHFFFAOYSA-N 0 3 423.538 4.332 20 0 HIADHN CC(C)Oc1ccc2ccccc2c1CNC(=O)N(CCN(C)C)Cc1ccccn1 ZINC000468438682 882380214 /nfs/dbraw/zinc/38/02/14/882380214.db2.gz NKZGRZPKQNYUKD-UHFFFAOYSA-N 0 3 420.557 4.295 20 0 HIADHN Cc1sc(C(=O)NC[C@@]2(O)CCN(Cc3ccccc3)C2)cc1-c1ccc(F)cc1 ZINC000446252827 870195072 /nfs/dbraw/zinc/19/50/72/870195072.db2.gz LXKCYOPPUNWGIW-DEOSSOPVSA-N 0 3 424.541 4.229 20 0 HIADHN CC1CCN([C@@H](CNC(=O)Nc2cn(C)nc2C(F)(F)F)c2ccccc2)CC1 ZINC000446354132 870263731 /nfs/dbraw/zinc/26/37/31/870263731.db2.gz DDEURHTYXYZPNT-KRWDZBQOSA-N 0 3 409.456 4.034 20 0 HIADHN Cc1sc(C(=O)NCCCCN2C[C@H](C)O[C@@H](C)C2)cc1-c1ccc(F)cc1 ZINC000446384584 870290220 /nfs/dbraw/zinc/29/02/20/870290220.db2.gz APBZZMFVTSHOAH-HOTGVXAUSA-N 0 3 404.551 4.482 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)c1ccc(NC(=O)Nc2ccccc2)cc1 ZINC000446421207 870333006 /nfs/dbraw/zinc/33/30/06/870333006.db2.gz PTJBBZWMKXVQGD-UHFFFAOYSA-N 0 3 406.486 4.128 20 0 HIADHN Cc1ccc(C(=O)N(CCN(C)C)Cc2ccco2)cc1NC(=O)c1ccccc1F ZINC000446428650 870345255 /nfs/dbraw/zinc/34/52/55/870345255.db2.gz XEZRMMMSLDGKAF-UHFFFAOYSA-N 0 3 423.488 4.183 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)c1cccc(-c2noc(CC(C)(C)C)n2)c1 ZINC000446433504 870352455 /nfs/dbraw/zinc/35/24/55/870352455.db2.gz BQCKVARGYIKLQY-UHFFFAOYSA-N 0 3 410.518 4.122 20 0 HIADHN COc1cccc([C@H](CNC(=O)N[C@H](CC(F)(F)F)C(C)C)N2CCCC2)c1 ZINC000446569785 870481803 /nfs/dbraw/zinc/48/18/03/870481803.db2.gz SBFHVSONTGWTQN-MSOLQXFVSA-N 0 3 401.473 4.108 20 0 HIADHN CN(C)CCN(C[C@H]1CCCO1)C(=O)Nc1cccnc1-c1ccc(Cl)s1 ZINC000446576278 870486070 /nfs/dbraw/zinc/48/60/70/870486070.db2.gz FRHXEIJLHZMVEF-CQSZACIVSA-N 0 3 408.955 4.038 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)N[C@@H]3CCCc4sccc43)CC2)C[C@H](C)O1 ZINC000468465743 882413174 /nfs/dbraw/zinc/41/31/74/882413174.db2.gz HVYRXUISVXQEDU-FUHIMQAGSA-N 0 3 405.608 4.046 20 0 HIADHN CCCN(C(=O)N[C@@H](C)c1ccncc1OC)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000446634738 870540105 /nfs/dbraw/zinc/54/01/05/870540105.db2.gz NZCJBPLCGPQWJP-FPOVZHCZSA-N 0 3 410.562 4.237 20 0 HIADHN Cc1ccc([C@H](CCn2cncn2)NCc2ccnc(OCc3ccccc3)c2)cc1 ZINC000446749713 870656857 /nfs/dbraw/zinc/65/68/57/870656857.db2.gz BUHGJHRRCRHJPA-DEOSSOPVSA-N 0 3 413.525 4.482 20 0 HIADHN COc1cc(C)ccc1Oc1ccc(NC(=O)N(CCN(C)C)Cc2ccco2)cn1 ZINC000446829274 870744145 /nfs/dbraw/zinc/74/41/45/870744145.db2.gz FXVDFZKGEHKFPC-UHFFFAOYSA-N 0 3 424.501 4.380 20 0 HIADHN Cc1cc(C)n2c(CNC3(c4cccc(OC(F)(F)F)c4)CCOCC3)cnc2n1 ZINC000446832546 870749170 /nfs/dbraw/zinc/74/91/70/870749170.db2.gz CCIHRCFWXMMMTP-UHFFFAOYSA-N 0 3 420.435 4.040 20 0 HIADHN COc1cc(CNC2(c3cccc(C(F)(F)F)c3)CCOCC2)cc2c1OCO2 ZINC000446836864 870755104 /nfs/dbraw/zinc/75/51/04/870755104.db2.gz UALQVBLXGRAGJH-UHFFFAOYSA-N 0 3 409.404 4.238 20 0 HIADHN FC(F)(F)Oc1cccc(C2(NCc3ccc(N4CCCC4)nc3)CCOCC2)c1 ZINC000446846300 870765016 /nfs/dbraw/zinc/76/50/16/870765016.db2.gz XSNWILWABZQPDQ-UHFFFAOYSA-N 0 3 421.463 4.376 20 0 HIADHN COc1ccc([C@@H](CCn2cncn2)N[C@H]2CC(C)(C)Oc3cc(F)ccc32)cc1 ZINC000446924195 870837791 /nfs/dbraw/zinc/83/77/91/870837791.db2.gz DJFZNJYAKSJRGH-RTWAWAEBSA-N 0 3 410.493 4.449 20 0 HIADHN Cc1ccc(CNC(=O)N(CCN(C)C)Cc2ccccc2)c(OCC(F)(F)F)c1 ZINC000446949387 870856979 /nfs/dbraw/zinc/85/69/79/870856979.db2.gz UYESIBZKGFCAJA-UHFFFAOYSA-N 0 3 423.479 4.210 20 0 HIADHN COCC[C@@]1(NCc2cn(-c3ccc(Br)cc3)nc2C(C)C)CCOC1 ZINC000447075699 870958561 /nfs/dbraw/zinc/95/85/61/870958561.db2.gz DTUQIWPQVREFPU-HXUWFJFHSA-N 0 3 422.367 4.043 20 0 HIADHN COC(=O)[C@@](C)(CNCc1ccccc1OCc1ccncc1)c1ccc(F)cc1 ZINC000447087071 870977501 /nfs/dbraw/zinc/97/75/01/870977501.db2.gz NRTOKNJYMDWPKZ-DEOSSOPVSA-N 0 3 408.473 4.020 20 0 HIADHN C[C@H](NC(=O)N(CCN(C)C)Cc1ccccc1F)c1cccc(N2CCCC2)c1 ZINC000447221897 871107806 /nfs/dbraw/zinc/10/78/06/871107806.db2.gz JUSBNAQJLQCAFO-IBGZPJMESA-N 0 3 412.553 4.260 20 0 HIADHN Cc1ccc(NC(=O)CCN[C@@H](Cn2cnc3ccccc32)c2ccc(F)cc2)nc1 ZINC000447304589 871202033 /nfs/dbraw/zinc/20/20/33/871202033.db2.gz JEOJAOISMKUPBX-NRFANRHFSA-N 0 3 417.488 4.239 20 0 HIADHN CSc1cccc(N(C(=O)c2ccc(N(C)C(C)=O)cc2)C2CCN(C)CC2)c1 ZINC000447331442 871222159 /nfs/dbraw/zinc/22/21/59/871222159.db2.gz CUFHSUFYPPBXCR-UHFFFAOYSA-N 0 3 411.571 4.132 20 0 HIADHN O=C(CCN1CCC(Oc2ncccc2F)CC1)Nc1cccc(C(F)(F)F)c1 ZINC000447360813 871267657 /nfs/dbraw/zinc/26/76/57/871267657.db2.gz URCRUSCHVKBYSK-UHFFFAOYSA-N 0 3 411.399 4.112 20 0 HIADHN CN(CCOc1ccccc1NC(=O)COc1ccccc1)Cc1ccc(F)cc1 ZINC000468502004 882497624 /nfs/dbraw/zinc/49/76/24/882497624.db2.gz UEJRTEHHIXFNKF-UHFFFAOYSA-N 0 3 408.473 4.354 20 0 HIADHN CC(C)[C@@H]1C[C@@H](NCc2ccccc2OCC(=O)NC[C@H]2CCCO2)c2ccccc21 ZINC000447539862 871403632 /nfs/dbraw/zinc/40/36/32/871403632.db2.gz HWNGCJZQUAFGLW-FGCOXFRFSA-N 0 3 422.569 4.335 20 0 HIADHN COC(=O)c1coc([C@H](C)NC2CCN(Cc3ccc(Br)cc3)CC2)c1 ZINC000447573124 871474491 /nfs/dbraw/zinc/47/44/91/871474491.db2.gz FYPUEGIISXQMAG-AWEZNQCLSA-N 0 3 421.335 4.144 20 0 HIADHN Cc1c(Br)ccc(C(=O)N(C)C[C@@H]2CCN(C)[C@H]2c2cccnc2)c1F ZINC000447605230 871513376 /nfs/dbraw/zinc/51/33/76/871513376.db2.gz HHVNIJZGUZPKLP-KXBFYZLASA-N 0 3 420.326 4.057 20 0 HIADHN Cc1cc([C@H](NC[C@H](CO)Cc2cc(F)c(F)c(F)c2)c2cccnc2)ccc1F ZINC000447607366 871518587 /nfs/dbraw/zinc/51/85/87/871518587.db2.gz RSTCNYIEPOHBOX-MWTRTKDXSA-N 0 3 418.434 4.477 20 0 HIADHN COc1cc(CNCc2ccnc(N3CCN(c4ccc(F)cc4)CC3)c2)ccc1C ZINC000447817134 871747861 /nfs/dbraw/zinc/74/78/61/871747861.db2.gz PATLCZJSLKWSFK-UHFFFAOYSA-N 0 3 420.532 4.154 20 0 HIADHN C[C@H](O)C[C@@H]1CCCCN1CC(=O)NC[C@@H](c1c[nH]c2ccccc21)c1ccccc1 ZINC000447831073 871760100 /nfs/dbraw/zinc/76/01/00/871760100.db2.gz KGCLCVRPEKVBIE-IEIRFRATSA-N 0 3 419.569 4.041 20 0 HIADHN O=C1[C@H](N[C@H](c2ccccc2)[C@H]2CCCc3ccccc32)CCN1C1CCOCC1 ZINC000447888379 871802342 /nfs/dbraw/zinc/80/23/42/871802342.db2.gz JUIIXVGQXJTSJF-ISJGIBHGSA-N 0 3 404.554 4.217 20 0 HIADHN CN1CCCC(C)(C)[C@H]1CN[C@H](c1ccc(F)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000448025209 871865133 /nfs/dbraw/zinc/86/51/33/871865133.db2.gz CFAVPAXMFVQGKN-FGZHOGPDSA-N 0 3 418.578 4.029 20 0 HIADHN CCc1nn(-c2ccccc2)c(CC)c1CN[C@@H](C)c1ccc(-n2cncn2)cc1 ZINC000448025662 871866008 /nfs/dbraw/zinc/86/60/08/871866008.db2.gz FBOVMMBGXDYEBS-SFHVURJKSA-N 0 3 400.530 4.429 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)NC[C@@H]2C[C@@H](C(C)C)c3ccccc32)CC1 ZINC000448035817 871868922 /nfs/dbraw/zinc/86/89/22/871868922.db2.gz SPIYYRVELKYUJO-CVDCTZTESA-N 0 3 401.595 4.102 20 0 HIADHN CC[C@@H](CNC(=O)Nc1cccc2c1OCC[C@H]2OC)N1CCc2ccccc2C1 ZINC000448045353 871876495 /nfs/dbraw/zinc/87/64/95/871876495.db2.gz QKWMCXSVEMKILJ-SIKLNZKXSA-N 0 3 409.530 4.115 20 0 HIADHN CO[C@H]1CCOc2c(NC(=O)N(CCCc3ccccc3)CCN(C)C)cccc21 ZINC000448050424 871881380 /nfs/dbraw/zinc/88/13/80/871881380.db2.gz OGHIWAFUOMHWIK-QFIPXVFZSA-N 0 3 411.546 4.185 20 0 HIADHN CO[C@H]1CCOc2c(NC(=O)NC[C@@H](c3ccc(C)cc3)N3CCCC3)cccc21 ZINC000448050740 871881536 /nfs/dbraw/zinc/88/15/36/871881536.db2.gz OUGGSVQYPIMYQH-VXKWHMMOSA-N 0 3 409.530 4.424 20 0 HIADHN O=C(NC[C@H]1CCSC1)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000448247457 872165022 /nfs/dbraw/zinc/16/50/22/872165022.db2.gz DZGGZDZAKGOXNW-MRXNPFEDSA-N 0 3 416.418 4.354 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1cnn(-c2ccc(C(F)(F)F)cc2)c1 ZINC000448291282 872222879 /nfs/dbraw/zinc/22/28/79/872222879.db2.gz XJIFRPRWPDVPII-UHFFFAOYSA-N 0 3 421.423 4.080 20 0 HIADHN CCN(CC)CCN(C(=O)[C@H]1CCC(=O)c2cccn21)c1cccc(C(F)(F)F)c1 ZINC000448340434 872282189 /nfs/dbraw/zinc/28/21/89/872282189.db2.gz BUZRKHAXKAGKGR-LJQANCHMSA-N 0 3 421.463 4.400 20 0 HIADHN Brc1cccc(N[C@H]2CCCN(Cc3c[nH]nc3-c3cccnc3)C2)c1 ZINC000448370331 872321406 /nfs/dbraw/zinc/32/14/06/872321406.db2.gz HMGCMXMFLNMMTP-IBGZPJMESA-N 0 3 412.335 4.311 20 0 HIADHN Cc1nn(C(C)(C)C)cc1[C@H](C)NC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000468566548 882624727 /nfs/dbraw/zinc/62/47/27/882624727.db2.gz OZWWRYQWEYXKTQ-LPHOPBHVSA-N 0 3 400.542 4.175 20 0 HIADHN CCN(C(=O)Nc1cccc(NC(=O)C2CC2)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000460124003 872598878 /nfs/dbraw/zinc/59/88/78/872598878.db2.gz HRKZGUNJFWALDO-QFIPXVFZSA-N 0 3 406.530 4.163 20 0 HIADHN CCN(C(=O)Nc1cccc(-c2noc(C)n2)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000460132350 872618245 /nfs/dbraw/zinc/61/82/45/872618245.db2.gz GAQMRGJCRNZBGG-OAQYLSRUSA-N 0 3 405.502 4.173 20 0 HIADHN CCN(C(=O)Nc1ccc(C(=O)NCC(C)C)cc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000460134174 872622302 /nfs/dbraw/zinc/62/23/02/872622302.db2.gz PMCWMVJZFGWCGG-QHCPKHFHSA-N 0 3 422.573 4.201 20 0 HIADHN CC[C@@H](C)NC(=O)c1ccc(NC(=O)N(CC)[C@@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000460136140 872624801 /nfs/dbraw/zinc/62/48/01/872624801.db2.gz UGOMOWIQHSFNOV-AUSIDOKSSA-N 0 3 422.573 4.343 20 0 HIADHN O=C(N[C@H]1CCCN(Cc2ccccc2)C1)N1CCCC[C@H]1c1nnc(C2CCC2)o1 ZINC000460141768 872643895 /nfs/dbraw/zinc/64/38/95/872643895.db2.gz XEURINGYSINQKG-SFTDATJTSA-N 0 3 423.561 4.238 20 0 HIADHN CC(C)[C@H](C(=O)Nc1ccc(Cc2nnc3n2CCCCC3)cc1)N1CCCCC1 ZINC000468574456 882642886 /nfs/dbraw/zinc/64/28/86/882642886.db2.gz ILUBTJFKIGISCJ-HSZRJFAPSA-N 0 3 409.578 4.044 20 0 HIADHN CCCN(CCN(C)C)C(=O)c1ccccc1-c1nc(-c2cccc(Cl)c2)no1 ZINC000460385193 873028408 /nfs/dbraw/zinc/02/84/08/873028408.db2.gz YXOMGVCRPZBNRB-UHFFFAOYSA-N 0 3 412.921 4.471 20 0 HIADHN CCC[C@@H]1C[C@@H]1NC(=O)N(Cc1ccccc1Br)C1CCN(C)CC1 ZINC000460396318 873045408 /nfs/dbraw/zinc/04/54/08/873045408.db2.gz ZYWSUPGQRNFPFS-BEFAXECRSA-N 0 3 408.384 4.244 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)NC[C@H](C)Oc3ccccc3Cl)cc2)CC1 ZINC000460441115 873109894 /nfs/dbraw/zinc/10/98/94/873109894.db2.gz SYPHCBULBZLCBI-SFHVURJKSA-N 0 3 415.965 4.068 20 0 HIADHN CN1CC[C@H](NC(=O)N2CCCC[C@@H]2c2nnc(C3CCC3)o2)[C@H]1c1ccccc1 ZINC000460557469 873278942 /nfs/dbraw/zinc/27/89/42/873278942.db2.gz UYAFDNHQQHYCIW-XUVXKRRUSA-N 0 3 409.534 4.019 20 0 HIADHN C[C@@H]1CCCN(CCNC(=O)c2ccc(Oc3cccc(Cl)c3Cl)nn2)C1 ZINC000460734658 873553792 /nfs/dbraw/zinc/55/37/92/873553792.db2.gz KMLJRGOUZSXZJV-CYBMUJFWSA-N 0 3 409.317 4.037 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cc(C2CC2)n(C)n1)c1ccc(C(F)(F)F)cc1 ZINC000460854550 873752874 /nfs/dbraw/zinc/75/28/74/873752874.db2.gz ITGYFMJDOGUACH-IBGZPJMESA-N 0 3 408.468 4.129 20 0 HIADHN COc1ccc2sc(C(=O)N3CCC(CN4C[C@H](C)O[C@@H](C)C4)CC3)c(C)c2c1 ZINC000460862468 873766674 /nfs/dbraw/zinc/76/66/74/873766674.db2.gz JSEWWDXVFAVYKT-HOTGVXAUSA-N 0 3 416.587 4.180 20 0 HIADHN CC[C@H](C(=O)NCCCCN1CCN(Cc2ccccc2)CC1)c1ccc(F)cc1 ZINC000460970992 873866831 /nfs/dbraw/zinc/86/68/31/873866831.db2.gz SLPPDZFURIGHMT-DEOSSOPVSA-N 0 3 411.565 4.034 20 0 HIADHN Cc1cc(C)c(Br)c(C(=O)N2CCC(CN3C[C@@H](C)O[C@H](C)C3)CC2)c1 ZINC000460976116 873869965 /nfs/dbraw/zinc/86/99/65/873869965.db2.gz CEKVYRSYVNFWFS-IAGOWNOFSA-N 0 3 423.395 4.027 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)c2ccc(OCc3ccccn3)cc2)C1 ZINC000460977233 873870603 /nfs/dbraw/zinc/87/06/03/873870603.db2.gz LBZPHAVJHAWRBW-UGKGYDQZSA-N 0 3 401.510 4.226 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)c2ccc(OCc3ccccn3)cc2)C1 ZINC000460977232 873870784 /nfs/dbraw/zinc/87/07/84/873870784.db2.gz LBZPHAVJHAWRBW-SIKLNZKXSA-N 0 3 401.510 4.226 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N1CCCC[C@@H]1c1nnc(C2CCC2)o1)c1ccco1 ZINC000461025677 873891573 /nfs/dbraw/zinc/89/15/73/873891573.db2.gz MGAPMSTVTTUUFI-CGTJXYLNSA-N 0 3 415.538 4.296 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)c1ccc(OCc2ccccn2)cc1 ZINC000461075665 873973991 /nfs/dbraw/zinc/97/39/91/873973991.db2.gz PELURTCYVKJOIZ-NRFANRHFSA-N 0 3 415.537 4.397 20 0 HIADHN COc1ccccc1[C@@H](NCc1ccc(N2CCCS2(=O)=O)cc1)C1CCCC1 ZINC000461084122 873996107 /nfs/dbraw/zinc/99/61/07/873996107.db2.gz SFBIOEIGBICBHU-QHCPKHFHSA-N 0 3 414.571 4.256 20 0 HIADHN C[C@H](NC(=O)N1CCCC[C@@H]1c1nnc(C2CCC2)o1)[C@H](c1ccccc1)N(C)C ZINC000461208434 874209934 /nfs/dbraw/zinc/20/99/34/874209934.db2.gz JRYQVIUTHVNIIR-PWIZWCRZSA-N 0 3 411.550 4.265 20 0 HIADHN C[C@@H]1C[C@H](c2cccc(F)c2)N(C(=O)CCCN2CCN(c3ccccc3)CC2)C1 ZINC000461320679 874329796 /nfs/dbraw/zinc/32/97/96/874329796.db2.gz YQTARLUUGASOGJ-HYBUGGRVSA-N 0 3 409.549 4.338 20 0 HIADHN CCCN1CCC[C@H]1C(=O)NCc1ccc(Oc2ccccc2C(F)(F)F)nc1 ZINC000461332915 874343267 /nfs/dbraw/zinc/34/32/67/874343267.db2.gz OKEULHFHEWLMSN-KRWDZBQOSA-N 0 3 407.436 4.383 20 0 HIADHN CCCN1CCC[C@@H]1C(=O)NCc1ccc(Oc2ccccc2C(F)(F)F)nc1 ZINC000461332916 874343524 /nfs/dbraw/zinc/34/35/24/874343524.db2.gz OKEULHFHEWLMSN-QGZVFWFLSA-N 0 3 407.436 4.383 20 0 HIADHN CCN(C(=O)NC[C@@H](c1ccc(OC(C)C)cc1)N(C)C)[C@H]1CCOC(C)(C)C1 ZINC000461414477 874431422 /nfs/dbraw/zinc/43/14/22/874431422.db2.gz BFHNXPCAXBDFCM-FPOVZHCZSA-N 0 3 405.583 4.066 20 0 HIADHN CN1CCC(N(Cc2ccccc2Br)C(=O)N[C@H]2CCC2(C)C)CC1 ZINC000461422884 874453542 /nfs/dbraw/zinc/45/35/42/874453542.db2.gz QLDFQFXDZSUGRY-SFHVURJKSA-N 0 3 408.384 4.244 20 0 HIADHN O=C(CCC(=O)N1C[C@@H]2CCN(Cc3ccccc3)C[C@@H]2C1)c1ccc2c(c1)CCC2 ZINC000461439508 874492366 /nfs/dbraw/zinc/49/23/66/874492366.db2.gz RUFCLBAASREBPF-LOSJGSFVSA-N 0 3 416.565 4.119 20 0 HIADHN C[C@@H](CN(C)C(=O)N[C@@H](C)C1=CCN(C)CC1)Oc1ccc(Cl)c(Cl)c1 ZINC000468746547 882840798 /nfs/dbraw/zinc/84/07/98/882840798.db2.gz ZDAHDUFKQNLMJG-KBPBESRZSA-N 0 3 400.350 4.053 20 0 HIADHN CCCN(CCN1CCN(CC)CC1)C(=O)N[C@@H](C)c1ccc(F)c2ccccc21 ZINC000461510145 874587275 /nfs/dbraw/zinc/58/72/75/874587275.db2.gz AAHLJSPMQBCPCF-IBGZPJMESA-N 0 3 414.569 4.099 20 0 HIADHN Cc1c([C@H](C)NCc2cc(C(F)(F)F)ccc2N2CCN(C)CC2)cnn1C(C)C ZINC000468784126 882858480 /nfs/dbraw/zinc/85/84/80/882858480.db2.gz BKFIHHUHVIVSJS-INIZCTEOSA-N 0 3 423.527 4.394 20 0 HIADHN C[C@H]1CCN(C(=O)CN[C@H](c2ccccc2)C(F)(F)F)CCN1Cc1ccccc1 ZINC000468800418 882865474 /nfs/dbraw/zinc/86/54/74/882865474.db2.gz BYGJXYUGPQERTC-PGRDOPGGSA-N 0 3 419.491 4.003 20 0 HIADHN COc1cc(Br)ccc1[C@H](C)NC(=O)Nc1cccc(CN(C)C)c1 ZINC000468789595 882861385 /nfs/dbraw/zinc/86/13/85/882861385.db2.gz BLERBCUIIZLSEE-ZDUSSCGKSA-N 0 3 406.324 4.402 20 0 HIADHN C[C@@H]1CCc2onc(C(=O)N(CCN(C)C)Cc3cccc(C(F)(F)F)c3)c2C1 ZINC000468791272 882862082 /nfs/dbraw/zinc/86/20/82/882862082.db2.gz BVZTYNLEXSAYAN-CQSZACIVSA-N 0 3 409.452 4.022 20 0 HIADHN CC[C@H](C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1)c1ccc(F)cc1 ZINC000461660647 874813838 /nfs/dbraw/zinc/81/38/38/874813838.db2.gz YFHVNUUQUJPUAP-QFIPXVFZSA-N 0 3 402.485 4.118 20 0 HIADHN CC(C)(C)[C@@H](CN1CCc2ccccc2C1)NC(=O)c1ccoc1Br ZINC000468801795 882866373 /nfs/dbraw/zinc/86/63/73/882866373.db2.gz CDAAVXJBPRTZJO-QGZVFWFLSA-N 0 3 405.336 4.245 20 0 HIADHN C[C@H]1CCN(C)CCN1C(=O)N[C@@H]1CCCc2c3cc(Br)ccc3[nH]c21 ZINC000461714662 874864127 /nfs/dbraw/zinc/86/41/27/874864127.db2.gz JDSBPQIPCDNBGL-SCLBCKFNSA-N 0 3 419.367 4.043 20 0 HIADHN CCCN(CCN(CC)CC)C(=O)c1cn(C2CC2)c2cc(Cl)c(F)cc2c1=O ZINC000461725566 874872273 /nfs/dbraw/zinc/87/22/73/874872273.db2.gz HRODSPUNYXNHSH-UHFFFAOYSA-N 0 3 421.944 4.323 20 0 HIADHN CCOC(=O)[C@](C)(CN[C@H](C)C(=O)Nc1c(C)cc(C)cc1Cl)c1ccccc1 ZINC000468827185 882878773 /nfs/dbraw/zinc/87/87/73/882878773.db2.gz CMLYSMGYCSJUHP-UZUQRXQVSA-N 0 3 416.949 4.394 20 0 HIADHN CCOC(=O)[C@@](C)(CN[C@@H](C)C(=O)Nc1cccc(Cl)c1Cl)c1ccccc1 ZINC000468827380 882878977 /nfs/dbraw/zinc/87/89/77/882878977.db2.gz DJDMEYYTROJDQF-QKKBWIMNSA-N 0 3 423.340 4.431 20 0 HIADHN CCOC(=O)[C@](C)(CN[C@@H](C)C(=O)Nc1cccc(Cl)c1Cl)c1ccccc1 ZINC000468827232 882879078 /nfs/dbraw/zinc/87/90/78/882879078.db2.gz DJDMEYYTROJDQF-LHSJRXKWSA-N 0 3 423.340 4.431 20 0 HIADHN Cc1ccc(F)c(C(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)c1Br ZINC000468840710 882885594 /nfs/dbraw/zinc/88/55/94/882885594.db2.gz DHBUSMYYLNKFBG-ZBFHGGJFSA-N 0 3 405.311 4.462 20 0 HIADHN CC(C)c1nnc(N2C[C@H](C)N(Cc3ccccc3)C[C@H]2C)n1C[C@@H]1CCCCO1 ZINC000461874945 875028354 /nfs/dbraw/zinc/02/83/54/875028354.db2.gz MBZSREWPJGZTMP-VWPQPMDRSA-N 0 3 411.594 4.070 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)Nc3cc(Br)ccc3C)CC2)c1 ZINC000461877464 875030499 /nfs/dbraw/zinc/03/04/99/875030499.db2.gz SNKJRSLQFVSAND-UHFFFAOYSA-N 0 3 416.363 4.217 20 0 HIADHN CSc1nc(C2CC2)nc(C)c1C(=O)N1CCCN(CCCc2ccccc2)CC1 ZINC000462007629 875128094 /nfs/dbraw/zinc/12/80/94/875128094.db2.gz HFLIOTKBWMNLDT-UHFFFAOYSA-N 0 3 424.614 4.165 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N[C@H]2CCCc3cn(C4CCCC4)nc32)N(C)C)cc1 ZINC000462007785 875128145 /nfs/dbraw/zinc/12/81/45/875128145.db2.gz NGAUCWYAMDKWCP-VXKWHMMOSA-N 0 3 409.578 4.286 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N(Cc3ccco3)Cc3cccs3)cc2)CC1 ZINC000462032972 875147054 /nfs/dbraw/zinc/14/70/54/875147054.db2.gz TYHUGDULMQRKHG-UHFFFAOYSA-N 0 3 409.555 4.326 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)N[C@@H]2CCc3sc(Cl)cc32)c1 ZINC000462051771 875165105 /nfs/dbraw/zinc/16/51/05/875165105.db2.gz OOWBEZKPLNTYNK-QGZVFWFLSA-N 0 3 407.967 4.171 20 0 HIADHN Cc1nc2ccc(Br)cc2c(N2CCN(Cc3cccnc3)CC2)c1C ZINC000462098030 875207428 /nfs/dbraw/zinc/20/74/28/875207428.db2.gz SSGUFDZRLUEHNX-UHFFFAOYSA-N 0 3 411.347 4.331 20 0 HIADHN C[C@H]1CCCN(c2cc(C(=O)N3CCCN(Cc4ccccc4)C[C@H]3C)ccn2)C1 ZINC000462153899 875250052 /nfs/dbraw/zinc/25/00/52/875250052.db2.gz YKYHXFAQQIOAHR-LEWJYISDSA-N 0 3 406.574 4.055 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)NCc3ccc4sccc4c3)CC2)C[C@H](C)O1 ZINC000462164351 875259745 /nfs/dbraw/zinc/25/97/45/875259745.db2.gz HDGBXLPRDPOQHW-HDICACEKSA-N 0 3 415.603 4.322 20 0 HIADHN CC[C@@]1(CNC(=O)N(Cc2ccccc2)C2CCN(C)CC2)OCCc2ccccc21 ZINC000462167001 875263518 /nfs/dbraw/zinc/26/35/18/875263518.db2.gz NNRCQKFFHOSIAD-SANMLTNESA-N 0 3 421.585 4.171 20 0 HIADHN Cc1cc(C(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)ccc1NC(=O)CC(C)C ZINC000462172777 875271166 /nfs/dbraw/zinc/27/11/66/875271166.db2.gz XTNNTHCLOQMVST-CVDCTZTESA-N 0 3 407.558 4.230 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1cc(NC(=O)C(C)(C)C)ccc1F ZINC000462174587 875272495 /nfs/dbraw/zinc/27/24/95/875272495.db2.gz GUKRYEIVZUIASH-IIBYNOLFSA-N 0 3 411.521 4.061 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)Cc1csc(-c2cccc(F)c2)n1 ZINC000462194678 875302982 /nfs/dbraw/zinc/30/29/82/875302982.db2.gz IRCKJSNFQPOQCS-KKSFZXQISA-N 0 3 409.530 4.128 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1ccc(NC(=O)c2cccs2)cc1 ZINC000462195104 875303132 /nfs/dbraw/zinc/30/31/32/875303132.db2.gz KCDGKPNPJQCCQP-UWJYYQICSA-N 0 3 419.550 4.251 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C)c1ncc(-c2ccccc2)o1 ZINC000462226233 875336117 /nfs/dbraw/zinc/33/61/17/875336117.db2.gz QNISYNZDDXLVMH-LVCYWYKZSA-N 0 3 404.514 4.222 20 0 HIADHN O=C(CCN1CCC(c2noc(C3CC3)n2)CC1)Nc1cc(Cl)ccc1Cl ZINC000462240650 875355278 /nfs/dbraw/zinc/35/52/78/875355278.db2.gz YDUOYQRSBHMDNA-UHFFFAOYSA-N 0 3 409.317 4.462 20 0 HIADHN Cc1cc(Oc2ncccn2)ccc1NC(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C ZINC000462250433 875370208 /nfs/dbraw/zinc/37/02/08/875370208.db2.gz ZDWVCLSHVLLVRW-AVRDEDQJSA-N 0 3 417.513 4.219 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Nc1cccc(NC(=O)c2ccoc2)c1 ZINC000462256964 875380391 /nfs/dbraw/zinc/38/03/91/875380391.db2.gz UZYKQCJGJCRBHL-HTAPYJJXSA-N 0 3 418.497 4.174 20 0 HIADHN COc1ccc(NC(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)c(C(F)(F)F)c1 ZINC000462275237 875402972 /nfs/dbraw/zinc/40/29/72/875402972.db2.gz RWTHQIUVUKXGRY-KUHUBIRLSA-N 0 3 407.436 4.356 20 0 HIADHN O=C(NC[C@@H]1CCCCN1Cc1ccccc1)N[C@H]1CCO[C@H](c2ccccc2)C1 ZINC000462317594 875438085 /nfs/dbraw/zinc/43/80/85/875438085.db2.gz ZDNPZDXPGZDKRF-HJOGWXRNSA-N 0 3 407.558 4.261 20 0 HIADHN OC[C@@H](CNCc1sccc1Br)Cc1ccccc1C(F)(F)F ZINC000462536635 875654907 /nfs/dbraw/zinc/65/49/07/875654907.db2.gz SMVGFNHYEHHKHX-LLVKDONJSA-N 0 3 408.283 4.470 20 0 HIADHN O=S1(=O)CCCN1c1cccc(CNCc2cccc(OCc3ccccc3)c2)c1 ZINC000462543948 875666634 /nfs/dbraw/zinc/66/66/34/875666634.db2.gz ADSMAQBUGOLJAS-UHFFFAOYSA-N 0 3 422.550 4.095 20 0 HIADHN Cc1cc(CN[C@@H]2CC(=O)N([C@@H]3C[C@@H]3c3ccccc3)C2)ccc1Oc1cccnc1 ZINC000462744380 875814027 /nfs/dbraw/zinc/81/40/27/875814027.db2.gz GHXGUOVDBLJRFI-GMKZXUHWSA-N 0 3 413.521 4.429 20 0 HIADHN CSc1cc2c(cc1CNCCOc1ccc(Br)cc1)OCCO2 ZINC000462751351 875818364 /nfs/dbraw/zinc/81/83/64/875818364.db2.gz WPNDVPRXXZMULD-UHFFFAOYSA-N 0 3 410.333 4.111 20 0 HIADHN Cc1noc(C)c1COc1ccccc1C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C ZINC000462812406 875856088 /nfs/dbraw/zinc/85/60/88/875856088.db2.gz NLTRRXCTDXCXPN-UZUQRXQVSA-N 0 3 419.525 4.121 20 0 HIADHN CCOc1ccc([C@H](CC)NCc2cnc(N3CCOCC3)c(F)c2)cc1OCC ZINC000462831644 875867324 /nfs/dbraw/zinc/86/73/24/875867324.db2.gz FBOOWRHQEQMSAW-FQEVSTJZSA-N 0 3 417.525 4.096 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](N[C@@H]2CCO[C@@H](C3CC3)C2)c2ccc(Cl)cc2)c1 ZINC000462837205 875871261 /nfs/dbraw/zinc/87/12/61/875871261.db2.gz ZEIDSWGZYYBTAJ-CEMLEFRQSA-N 0 3 419.974 4.380 20 0 HIADHN CCc1ccc([C@H](N[C@@H]2CCO[C@H](C3CC3)C2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000462838711 875874130 /nfs/dbraw/zinc/87/41/30/875874130.db2.gz ZHISVQJYFZFNNA-NHTMILBNSA-N 0 3 413.583 4.289 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)Nc2c(C)cc(Cl)c3ccccc32)CC1 ZINC000462849909 875884576 /nfs/dbraw/zinc/88/45/76/875884576.db2.gz GAZRFHUMWWDBTQ-INIZCTEOSA-N 0 3 402.970 4.197 20 0 HIADHN Cc1cc(Cl)c2ccccc2c1NC(=O)N1CC[C@H](N2CCN(C)CC2)[C@@H](C)C1 ZINC000462853161 875886958 /nfs/dbraw/zinc/88/69/58/875886958.db2.gz ITPZHMCSGZNDNG-UWJYYQICSA-N 0 3 414.981 4.291 20 0 HIADHN Fc1ccccc1N1CC[C@H](CNCc2csc(-c3ccc4c(c3)OCO4)n2)C1 ZINC000462912026 875936953 /nfs/dbraw/zinc/93/69/53/875936953.db2.gz VQCYWVWHDCUIDP-OAHLLOKOSA-N 0 3 411.502 4.294 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N[C@H](c1nccs1)c1ccccc1 ZINC000463013037 876030311 /nfs/dbraw/zinc/03/03/11/876030311.db2.gz RIKQXEIOPOEPTR-UIFIKXQLSA-N 0 3 406.555 4.052 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N[C@@H]2CCO[C@H](c3ccccc3)C2)N2CCCC2)cc1 ZINC000463018253 876035308 /nfs/dbraw/zinc/03/53/08/876035308.db2.gz BXRKUXFRFAAVLO-SGNDLWITSA-N 0 3 407.558 4.351 20 0 HIADHN CCN(Cc1cn(Cc2ccccc2)nc1-c1ccc(OC)c(OC)c1)[C@@H]1CCOC1 ZINC000463039378 876063162 /nfs/dbraw/zinc/06/31/62/876063162.db2.gz SFBKAFCCGVOHIF-JOCHJYFZSA-N 0 3 421.541 4.226 20 0 HIADHN C[C@@H]1CCN(c2cnn(Cc3ccccc3)c(=O)c2Cl)CCN1Cc1ccccc1 ZINC000463072588 876102283 /nfs/dbraw/zinc/10/22/83/876102283.db2.gz WQMCSGWNFBIXOY-LJQANCHMSA-N 0 3 422.960 4.046 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)[C@H]3SCCc4ccccc43)CC2)c1 ZINC000463098927 876133512 /nfs/dbraw/zinc/13/35/12/876133512.db2.gz NWXGREUOMZOPSA-DEOSSOPVSA-N 0 3 423.626 4.044 20 0 HIADHN Cc1cc2cc(C(=O)NCCCCN3CCN(c4ccccc4)CC3)oc2cc1C ZINC000463124051 876166459 /nfs/dbraw/zinc/16/64/59/876166459.db2.gz MEGWYVSFAOVNRU-UHFFFAOYSA-N 0 3 405.542 4.382 20 0 HIADHN FC(F)(F)c1ccnc(Cc2noc(-c3ccc(CN4CCSCC4)cc3)n2)c1 ZINC000463173801 876229695 /nfs/dbraw/zinc/22/96/95/876229695.db2.gz CBQSQTDWLYXNDO-UHFFFAOYSA-N 0 3 420.460 4.290 20 0 HIADHN C[C@@H](Oc1cccc2ccccc21)C(=O)N(C)C1CCN(CCc2ccccn2)CC1 ZINC000468947407 883013925 /nfs/dbraw/zinc/01/39/25/883013925.db2.gz KTSPPAJHQGPCMY-HXUWFJFHSA-N 0 3 417.553 4.168 20 0 HIADHN COc1c(Br)c(C)sc1C(=O)NC1CCN(Cc2ccccc2)CC1 ZINC000463243521 876299398 /nfs/dbraw/zinc/29/93/98/876299398.db2.gz CMWWLWNQZYTBOW-UHFFFAOYSA-N 0 3 423.376 4.222 20 0 HIADHN Cc1ccc(S(=O)(=O)C[C@H](C)NC2CCN(Cc3ccccc3Cl)CC2)cc1 ZINC000463278435 876334635 /nfs/dbraw/zinc/33/46/35/876334635.db2.gz BYKKMVGAAOYIOF-SFHVURJKSA-N 0 3 421.006 4.065 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N[C@@H]1CCCc2cn(C3CCCC3)nc21 ZINC000463280943 876337224 /nfs/dbraw/zinc/33/72/24/876337224.db2.gz UMGJFPMBDVCZAZ-SXSPYAJSSA-N 0 3 421.589 4.195 20 0 HIADHN CO[C@@H](CN[C@@H](C)c1ccc(Br)cc1OCCCO)c1ccccc1 ZINC000463359512 876413102 /nfs/dbraw/zinc/41/31/02/876413102.db2.gz QQVBDGZQOBSAHD-YWZLYKJASA-N 0 3 408.336 4.249 20 0 HIADHN Cc1cc(CN2CCSCC2)ccc1NC(=O)CCCc1ccc(O)c(F)c1 ZINC000468966444 883032796 /nfs/dbraw/zinc/03/27/96/883032796.db2.gz OUJXKTNMHZFNMF-UHFFFAOYSA-N 0 3 402.535 4.350 20 0 HIADHN CC[C@H](O[C@H]1CCC[C@@H](C)C1)C(=O)Nc1ccc(N2CCN(CC)CC2)cc1C ZINC000463429616 876484339 /nfs/dbraw/zinc/48/43/39/876484339.db2.gz JRGJERMXSRIWLZ-JZWVFAODSA-N 0 3 401.595 4.449 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)cc1C(=O)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000463432637 876489667 /nfs/dbraw/zinc/48/96/67/876489667.db2.gz APGCRRKMGYSAML-QFIPXVFZSA-N 0 3 408.933 4.401 20 0 HIADHN OC[C@@]1(Cc2ccccc2)CCCN(C[C@@H](O)COc2c(Cl)cccc2Cl)C1 ZINC000463446081 876504443 /nfs/dbraw/zinc/50/44/43/876504443.db2.gz BMVITNWJEVHRPU-XMSQKQJNSA-N 0 3 424.368 4.050 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)[C@H]3C[C@H]3c3cc(F)c(F)c(F)c3)c(C)c2)CC1 ZINC000463516187 876581680 /nfs/dbraw/zinc/58/16/80/876581680.db2.gz VIDMLJXXZUXVMK-ROUUACIJSA-N 0 3 417.475 4.296 20 0 HIADHN CCc1ccc(-c2ccc(C(=O)N3CCC(CN4C[C@H](C)O[C@@H](C)C4)CC3)o2)cc1 ZINC000463558315 876644950 /nfs/dbraw/zinc/64/49/50/876644950.db2.gz PBVBHFBIEPTWPA-OALUTQOASA-N 0 3 410.558 4.470 20 0 HIADHN CC(C)c1nn(C)c2sc(C(=O)NC[C@@H]3CCCN(Cc4cccs4)C3)cc12 ZINC000463572648 876667459 /nfs/dbraw/zinc/66/74/59/876667459.db2.gz WUNGOXZXORKRAG-HNNXBMFYSA-N 0 3 416.616 4.462 20 0 HIADHN CCO[C@H](C)c1ncc(C(=O)Nc2ccc(CCN3CCSCC3)cc2)s1 ZINC000463578471 876676147 /nfs/dbraw/zinc/67/61/47/876676147.db2.gz OZMKYQNKOIPQDY-OAHLLOKOSA-N 0 3 405.589 4.084 20 0 HIADHN Cc1cc(Br)cc(C(=O)NC2CCN([C@@H](C)c3ccncc3)CC2)c1 ZINC000463579967 876677999 /nfs/dbraw/zinc/67/79/99/876677999.db2.gz UTGZJNOYQNMSIZ-HNNXBMFYSA-N 0 3 402.336 4.108 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000468998376 883063625 /nfs/dbraw/zinc/06/36/25/883063625.db2.gz OUVLMTWGZMSNPX-RTBURBONSA-N 0 3 418.006 4.224 20 0 HIADHN Cc1nn(C)c(Sc2ccccc2)c1C(=O)N[C@@H](C)CN(C)Cc1ccccc1 ZINC000463689956 876810404 /nfs/dbraw/zinc/81/04/04/876810404.db2.gz ZVHSEVBOULPYAH-KRWDZBQOSA-N 0 3 408.571 4.130 20 0 HIADHN Cc1cc(F)ccc1-c1nc(C(C)(C)C(=O)N(C)[C@H]2CCN(C3CC3)C2)cs1 ZINC000463776613 876896677 /nfs/dbraw/zinc/89/66/77/876896677.db2.gz QNUNYFMONHRXLL-KRWDZBQOSA-N 0 3 401.551 4.230 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)c2ccc(-c3ccc(C(C)(C)C)cc3)o2)CC1 ZINC000463816794 876930442 /nfs/dbraw/zinc/93/04/42/876930442.db2.gz JRKWPTHCRPYTRW-IBGZPJMESA-N 0 3 411.590 4.248 20 0 HIADHN Cc1nn(C)c2cc(NC(=O)NC[C@H](c3ccc(OC(C)C)cc3)N(C)C)ccc12 ZINC000463834857 876955127 /nfs/dbraw/zinc/95/51/27/876955127.db2.gz HQSVCGCFUAUUCN-JOCHJYFZSA-N 0 3 409.534 4.093 20 0 HIADHN C[C@@H](c1ccccc1)N(Cc1ccccc1)C(=O)C(=O)Nc1cccc(CN(C)C)c1 ZINC000463863892 876984110 /nfs/dbraw/zinc/98/41/10/876984110.db2.gz GNUHRGBEDHOGLW-FQEVSTJZSA-N 0 3 415.537 4.477 20 0 HIADHN Cn1ccc(N2CCC[C@@H](N[C@@H](Cc3ccccc3Cl)c3ccccc3)C2=O)n1 ZINC000463889883 877011915 /nfs/dbraw/zinc/01/19/15/877011915.db2.gz BEMZYFDIFGIXNI-RTWAWAEBSA-N 0 3 408.933 4.143 20 0 HIADHN Cn1cc(N2CCC[C@@H](N[C@H](Cc3ccccc3Cl)c3ccccc3)C2=O)cn1 ZINC000463908912 877030399 /nfs/dbraw/zinc/03/03/99/877030399.db2.gz ZAYMYMKHUOCBTC-FGZHOGPDSA-N 0 3 408.933 4.143 20 0 HIADHN COc1ccc([C@H](CNC(=O)N[C@@H](C)c2c(F)cccc2OC)N2CCCC2)cc1 ZINC000463956129 877078246 /nfs/dbraw/zinc/07/82/46/877078246.db2.gz WYYAWEQYOVWJFJ-JXFKEZNVSA-N 0 3 415.509 4.040 20 0 HIADHN COc1ccc([C@H](CNC(=O)NC[C@H](C)Cc2cccs2)N2CCCC2)cc1 ZINC000463967585 877092358 /nfs/dbraw/zinc/09/23/58/877092358.db2.gz XFSGNSXXVOYPRR-UTKZUKDTSA-N 0 3 401.576 4.072 20 0 HIADHN CC(C)[C@H](C(=O)Nc1ccc(C(=O)N(C)[C@H]2CCCN(C)C2)cc1)c1ccccc1 ZINC000464019585 877153106 /nfs/dbraw/zinc/15/31/06/877153106.db2.gz WUDFWANXRZGKBU-GOTSBHOMSA-N 0 3 407.558 4.231 20 0 HIADHN Cc1nn(C(C)(C)C)cc1[C@H](C)NC(=O)NC[C@H]1CCCCN1Cc1ccccc1 ZINC000464146177 877314824 /nfs/dbraw/zinc/31/48/24/877314824.db2.gz NLQAYXSBPWESSH-GHTZIAJQSA-N 0 3 411.594 4.361 20 0 HIADHN O=C(NCc1cccc(-c2cccnc2)c1)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000464148148 877315175 /nfs/dbraw/zinc/31/51/75/877315175.db2.gz BHAHTOBPJFSQBP-DEOSSOPVSA-N 0 3 400.526 4.212 20 0 HIADHN O=C(NCc1cccc(-c2cccnc2)c1)N1CCCN(Cc2ccccc2)CC1 ZINC000464148205 877316210 /nfs/dbraw/zinc/31/62/10/877316210.db2.gz BPXXPBKILGBRJU-UHFFFAOYSA-N 0 3 400.526 4.166 20 0 HIADHN Cc1nn(C(C)(C)C)cc1[C@@H](C)NC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC000464151982 877320101 /nfs/dbraw/zinc/32/01/01/877320101.db2.gz LMAUXWDYTTVNTQ-RTBURBONSA-N 0 3 411.594 4.314 20 0 HIADHN CSCc1cccnc1C(=O)Nc1c(C)cnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000464190312 877360233 /nfs/dbraw/zinc/36/02/33/877360233.db2.gz UYKDREJPLAUOFF-HXUWFJFHSA-N 0 3 421.570 4.149 20 0 HIADHN C[C@@H]1[C@H](NC(=O)N[C@@H]2CCCc3sc(-c4ccc(F)cc4)nc32)CCCN1C ZINC000464314346 877504532 /nfs/dbraw/zinc/50/45/32/877504532.db2.gz WPKHIKRRARBKRA-KBRIMQKVSA-N 0 3 402.539 4.109 20 0 HIADHN CC[C@@H]1CCCC[C@H]1OCC(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000464405693 877609244 /nfs/dbraw/zinc/60/92/44/877609244.db2.gz NGJTUKCEXOOFBD-BHIFYINESA-N 0 3 410.562 4.254 20 0 HIADHN Cc1cccc(S(=O)(=O)CCCN[C@@H](C)c2cccc(OC(F)(F)F)c2)c1 ZINC000464483695 877703129 /nfs/dbraw/zinc/70/31/29/877703129.db2.gz FBGIRCGJOZAGGH-HNNXBMFYSA-N 0 3 401.450 4.408 20 0 HIADHN CC(C)CN(C(=O)c1cn(-c2ccc(Cl)c(Cl)c2)cn1)C1CCN(C)CC1 ZINC000464566506 877784371 /nfs/dbraw/zinc/78/43/71/877784371.db2.gz FHPHMJDAJVFNFS-UHFFFAOYSA-N 0 3 409.361 4.372 20 0 HIADHN COc1cccc(C(=O)c2ccc(C(=O)N(CC(C)C)C3CCN(C)CC3)cc2)c1 ZINC000464583046 877807779 /nfs/dbraw/zinc/80/77/79/877807779.db2.gz QOCFPBGAKCKGOQ-UHFFFAOYSA-N 0 3 408.542 4.119 20 0 HIADHN O=C(CN(CCCOc1ccccc1)C1CCOCC1)N[C@@H]1CCCc2ccccc21 ZINC000464585515 877809458 /nfs/dbraw/zinc/80/94/58/877809458.db2.gz DWDWMCRDCCHQBL-RUZDIDTESA-N 0 3 422.569 4.130 20 0 HIADHN CCCN(CCc1cccs1)CC(=O)N1CCC[C@H]1c1ccc(OC)c(OC)c1 ZINC000464588837 877813886 /nfs/dbraw/zinc/81/38/86/877813886.db2.gz SZTZSBAZBVSRGD-FQEVSTJZSA-N 0 3 416.587 4.384 20 0 HIADHN CCCN(CCc1cccs1)CC(=O)N1CCC[C@@H]1c1cc(OC)ccc1OC ZINC000464593553 877820053 /nfs/dbraw/zinc/82/00/53/877820053.db2.gz CXCLZRJSUCENLL-OAQYLSRUSA-N 0 3 416.587 4.384 20 0 HIADHN Cc1nn(C(C)(C)C)cc1[C@@H](C)NC[C@@H](O)COc1cc(Cl)ccc1Cl ZINC000464632556 877850296 /nfs/dbraw/zinc/85/02/96/877850296.db2.gz XWFMSVNOLCWGNE-IUODEOHRSA-N 0 3 400.350 4.344 20 0 HIADHN COCCOC[C@@H]1CCN(Cc2c(-c3ccc(Cl)cc3)nc3sccn23)C1 ZINC000464742982 877975826 /nfs/dbraw/zinc/97/58/26/877975826.db2.gz VXYVQDYYRSTZNP-OAHLLOKOSA-N 0 3 405.951 4.201 20 0 HIADHN CCS[C@H]1CC[C@H](N(C)CC(=O)N(C)Cc2cc(Br)cs2)C1 ZINC000464767907 878009346 /nfs/dbraw/zinc/00/93/46/878009346.db2.gz DWTPOPMBVTWTEX-KBPBESRZSA-N 0 3 405.427 4.075 20 0 HIADHN COc1ccc(CCNC(=O)CN2CCCC[C@@H]2c2cccc(C)c2C)cc1OC ZINC000464780839 878024525 /nfs/dbraw/zinc/02/45/25/878024525.db2.gz XJBIUBOHSNNUJC-JOCHJYFZSA-N 0 3 410.558 4.207 20 0 HIADHN COc1cccc([C@H](CNC(=O)[C@H](C(C)C)N(C)C)c2c[nH]c3ccccc32)c1OC ZINC000464789984 878036727 /nfs/dbraw/zinc/03/67/27/878036727.db2.gz HXYPGGQGZZHCCK-REWPJTCUSA-N 0 3 423.557 4.019 20 0 HIADHN C[C@@H](C(=O)Nc1cccc(CSc2ccccn2)c1)N1CCC2(C1)CCOCC2 ZINC000464809363 878058875 /nfs/dbraw/zinc/05/88/75/878058875.db2.gz GLXJZHPOTUTEPI-SFHVURJKSA-N 0 3 411.571 4.203 20 0 HIADHN CCN(Cc1ccc(OCc2ccccc2)cc1)C(=O)CN1CCC2(C1)CCOCC2 ZINC000464821920 878074098 /nfs/dbraw/zinc/07/40/98/878074098.db2.gz KNFJUYAEGMFVED-UHFFFAOYSA-N 0 3 422.569 4.117 20 0 HIADHN C[C@H](C(=O)Nc1ccccc1OC(F)F)N1CC[C@H](C)N(Cc2ccccc2)CC1 ZINC000464838817 878102012 /nfs/dbraw/zinc/10/20/12/878102012.db2.gz OKBPDIDSNAMBLA-ZWKOTPCHSA-N 0 3 417.500 4.211 20 0 HIADHN Cc1cc(N2CCCC2)ccc1NC(=O)CN1CC[C@H](C)N(Cc2ccccc2)CC1 ZINC000464845268 878117988 /nfs/dbraw/zinc/11/79/88/878117988.db2.gz MCDSSHHIXJTTPW-QFIPXVFZSA-N 0 3 420.601 4.130 20 0 HIADHN Cc1cc(N2CCCC2)ccc1NC(=O)CN1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC000464845267 878118245 /nfs/dbraw/zinc/11/82/45/878118245.db2.gz MCDSSHHIXJTTPW-JOCHJYFZSA-N 0 3 420.601 4.130 20 0 HIADHN COC(=O)c1cc(CN2CCC[C@H](c3nc(-c4ccc(F)cc4)no3)C2)c(C)s1 ZINC000464864730 878146896 /nfs/dbraw/zinc/14/68/96/878146896.db2.gz RZYOAHPHJJWBAS-HNNXBMFYSA-N 0 3 415.490 4.412 20 0 HIADHN COC(=O)[C@H](C)[C@H](NCC[S@@](=O)c1cc(Cl)ccc1Cl)c1ccccc1 ZINC000464876578 878165513 /nfs/dbraw/zinc/16/55/13/878165513.db2.gz OASAMTKCZHIDQN-CTZXUXIISA-N 0 3 414.354 4.241 20 0 HIADHN CN(C)CCN(C(=O)COc1ccccc1OCc1ccccc1)c1ccccc1 ZINC000503340889 912318666 /nfs/dbraw/zinc/31/86/66/912318666.db2.gz HGWQPNCQTNCYMK-UHFFFAOYSA-N 0 3 404.510 4.239 20 0 HIADHN C[C@H]1CCN(C(=O)c2cccc(OCc3cccnc3)c2)CCN1Cc1ccccc1 ZINC000464892789 878194283 /nfs/dbraw/zinc/19/42/83/878194283.db2.gz LFZBXXMVQXUNAU-NRFANRHFSA-N 0 3 415.537 4.397 20 0 HIADHN C[C@@H]1CCN(C(=O)c2ccc(OCC(F)(F)F)cc2)CCN1Cc1ccccc1 ZINC000464896147 878200935 /nfs/dbraw/zinc/20/09/35/878200935.db2.gz NKRIVZMSPSHCAQ-QGZVFWFLSA-N 0 3 406.448 4.364 20 0 HIADHN C[C@H]1CCN(C(=O)c2cc(C3CC3)nn2-c2ccccc2)CCN1Cc1ccccc1 ZINC000464898361 878206568 /nfs/dbraw/zinc/20/65/68/878206568.db2.gz USYZQDHQZIRPNL-FQEVSTJZSA-N 0 3 414.553 4.486 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)c1cc(Oc2ccccc2)ccn1 ZINC000465172159 878558349 /nfs/dbraw/zinc/55/83/49/878558349.db2.gz BHQOISAQYVEXCZ-UHFFFAOYSA-N 0 3 411.452 4.356 20 0 HIADHN Cc1ccc(OC(F)F)c(CNC(=O)NC[C@@H](c2cccs2)N2CCCC2)c1 ZINC000465212277 878624163 /nfs/dbraw/zinc/62/41/63/878624163.db2.gz BDTKHMBOCFQUKL-INIZCTEOSA-N 0 3 409.502 4.294 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)c2sc(C(=O)N3CC[C@H]4CC[C@@H](C3)N4C)cc12 ZINC000465228050 878643247 /nfs/dbraw/zinc/64/32/47/878643247.db2.gz LHKZTTYXKXNQJL-WBVHZDCISA-N 0 3 414.962 4.358 20 0 HIADHN Cc1ccc(OC(F)F)c(CNC(=O)N(CCN(C)C)Cc2ccc(F)cc2)c1 ZINC000465229329 878645573 /nfs/dbraw/zinc/64/55/73/878645573.db2.gz WEZMCFAZNGVLMZ-UHFFFAOYSA-N 0 3 409.452 4.009 20 0 HIADHN CO[C@]1(C)C[C@H](N[C@H](C)C(=O)Nc2ccc(NC(=O)c3cccs3)cc2)C1(C)C ZINC000465414708 878848174 /nfs/dbraw/zinc/84/81/74/878848174.db2.gz UNCRQXLKVQGEPN-JVJLVOBOSA-N 0 3 415.559 4.121 20 0 HIADHN CC1CCN([C@H](CNC(=O)N2CCCC3(CCOCC3)C2)c2cccs2)CC1 ZINC000465421461 878850802 /nfs/dbraw/zinc/85/08/02/878850802.db2.gz GQDRQLGYGQLULJ-LJQANCHMSA-N 0 3 405.608 4.123 20 0 HIADHN CC[C@@H](NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1)c1nc(C(F)(F)F)cs1 ZINC000465430411 878861396 /nfs/dbraw/zinc/86/13/96/878861396.db2.gz HPARWALFBQZFPW-HUUCEWRRSA-N 0 3 412.481 4.187 20 0 HIADHN COc1ccc([C@H](C)CCNC(=O)NC[C@H](c2cccs2)N2CCCC2)cc1 ZINC000465433614 878864429 /nfs/dbraw/zinc/86/44/29/878864429.db2.gz NXKLAMUZKNOQLY-YLJYHZDGSA-N 0 3 401.576 4.387 20 0 HIADHN C[C@@H](NC(=O)NC[C@H](c1cccs1)N1CCC(C)CC1)c1nc(C(C)(C)C)no1 ZINC000465433953 878866431 /nfs/dbraw/zinc/86/64/31/878866431.db2.gz OVNFAYUZYJCSTM-HZPDHXFCSA-N 0 3 419.595 4.262 20 0 HIADHN C[C@@H](NC(=O)NC[C@H](c1ccccc1)N1CCCC1)c1nc(C2CCCCC2)no1 ZINC000465443416 878874644 /nfs/dbraw/zinc/87/46/44/878874644.db2.gz SXJZYBJEVUQZBZ-YLJYHZDGSA-N 0 3 411.550 4.315 20 0 HIADHN CN(C)[C@@H](CNC(=O)N(Cc1ccc2c(c1)CCO2)C1CCCC1)c1ccccc1 ZINC000465452468 878882256 /nfs/dbraw/zinc/88/22/56/878882256.db2.gz HDZICZCNKXVMKC-QHCPKHFHSA-N 0 3 407.558 4.379 20 0 HIADHN COc1cccc([C@@H](CNC(=O)N[C@@H](c2ncc(C)s2)C2CC2)N2CCCC2)c1 ZINC000465477330 878916268 /nfs/dbraw/zinc/91/62/68/878916268.db2.gz LQCKETQFCQJWCK-WOJBJXKFSA-N 0 3 414.575 4.048 20 0 HIADHN COc1cccc([C@@H](CNC(=O)N[C@H](c2ncc(C)s2)C2CC2)N2CCCC2)c1 ZINC000465477328 878916548 /nfs/dbraw/zinc/91/65/48/878916548.db2.gz LQCKETQFCQJWCK-UXHICEINSA-N 0 3 414.575 4.048 20 0 HIADHN C[C@@H]1CCN(C(=O)NCc2ccccc2OC(F)F)CCN1Cc1ccccc1 ZINC000465497298 878937030 /nfs/dbraw/zinc/93/70/30/878937030.db2.gz UHVZHPVEZJIFMV-QGZVFWFLSA-N 0 3 403.473 4.094 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N[C@@H](c1ncc(C)s1)C1CC1)c1cccc(OC)c1 ZINC000465504791 878941924 /nfs/dbraw/zinc/94/19/24/878941924.db2.gz SGCRTRBITSMLKX-VQTJNVASSA-N 0 3 416.591 4.294 20 0 HIADHN C[C@@H]1CCN(C(=O)NCc2ccnc(OC3CCCC3)c2)CCN1Cc1ccccc1 ZINC000465525920 878978085 /nfs/dbraw/zinc/97/80/85/878978085.db2.gz LGEALVWRDZIUSO-HXUWFJFHSA-N 0 3 422.573 4.209 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)N1CC[C@H](COCc2ccccc2)C1 ZINC000465533423 878989887 /nfs/dbraw/zinc/98/98/87/878989887.db2.gz XVTWTADOTDOYGC-LADGPHEKSA-N 0 3 407.558 4.072 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N(C)[C@@H](C)Cc1ccccc1OC)c1ccsc1 ZINC000465537033 878996210 /nfs/dbraw/zinc/99/62/10/878996210.db2.gz GHATWUFDFQXCII-FXAWDEMLSA-N 0 3 403.592 4.412 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)N1CC[C@H](CSc2ccccc2)C1 ZINC000465655060 879180298 /nfs/dbraw/zinc/18/02/98/879180298.db2.gz IXVDLXPOZZSANU-IBGZPJMESA-N 0 3 419.660 4.172 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)N[C@H](CCC(C)C)c2ccc(Cl)cc2)CC1 ZINC000465657818 879183275 /nfs/dbraw/zinc/18/32/75/879183275.db2.gz JYVQEPQHPCLHKT-DENIHFKCSA-N 0 3 423.045 4.390 20 0 HIADHN O=C(NCC1(c2cccc(C(F)(F)F)c2)CCCC1)N1CC[C@@H](N2CC=CC2)C1 ZINC000465743575 879329934 /nfs/dbraw/zinc/32/99/34/879329934.db2.gz ILMPIFMQDIRGTA-LJQANCHMSA-N 0 3 407.480 4.173 20 0 HIADHN C[C@H](NC(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1)c1cccc(-n2cccn2)c1 ZINC000465758401 879351198 /nfs/dbraw/zinc/35/11/98/879351198.db2.gz PAAQACGYAIQITL-IPJJNNNSSA-N 0 3 403.530 4.068 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)NCc2ccc(C(=O)OC(C)(C)C)cc2)C1 ZINC000465759686 879354090 /nfs/dbraw/zinc/35/40/90/879354090.db2.gz POSRGKJTKJHYBP-AVRDEDQJSA-N 0 3 423.557 4.277 20 0 HIADHN COc1ccc(C2CCN(C(=O)N[C@H]3CCN([C@@H](C)c4ccccc4)C3)CC2)cc1 ZINC000465766229 879366486 /nfs/dbraw/zinc/36/64/86/879366486.db2.gz ZHFJMFZKVRUOTL-CVDCTZTESA-N 0 3 407.558 4.420 20 0 HIADHN C[C@@H]1CCN(C(=O)NCCc2ccc3ccccc3n2)CCN1Cc1ccccc1 ZINC000465784647 879391423 /nfs/dbraw/zinc/39/14/23/879391423.db2.gz NTYUXFMJFBRVOE-HXUWFJFHSA-N 0 3 402.542 4.083 20 0 HIADHN Cc1[nH]c2ccccc2c1CCNC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC000465833505 879468410 /nfs/dbraw/zinc/46/84/10/879468410.db2.gz CRDCJRKZDPDTTA-LJQANCHMSA-N 0 3 404.558 4.325 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccc(O)cc1)C(=O)c1oc2ccccc2c1COC ZINC000503449508 912471310 /nfs/dbraw/zinc/47/13/10/912471310.db2.gz FAZBNQQWYFHIHI-IBGZPJMESA-N 0 3 422.525 4.412 20 0 HIADHN Cc1cccc2[nH]cc(CCNC(=O)N3CC[C@@H](C)N(Cc4ccccc4)CC3)c21 ZINC000465910488 879571697 /nfs/dbraw/zinc/57/16/97/879571697.db2.gz ZDMFAQSAAISEHV-HXUWFJFHSA-N 0 3 404.558 4.325 20 0 HIADHN Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)NC(=O)N1CC[C@@H](N2CC=CC2)C1 ZINC000465912523 879575240 /nfs/dbraw/zinc/57/52/40/879575240.db2.gz UPLOUEJLVUCGHG-MAUKXSAKSA-N 0 3 416.978 4.489 20 0 HIADHN CCc1nc(C)c([C@@H](C)N(C)C(=O)NC[C@H]2CCCN2Cc2ccccc2)s1 ZINC000465943059 879611731 /nfs/dbraw/zinc/61/17/31/879611731.db2.gz ZDDDBRXPYDDGCY-IEBWSBKVSA-N 0 3 400.592 4.381 20 0 HIADHN Cc1cccc(COc2ccc([C@H](C)NC(=O)N3CC[C@@H](N4CC=CC4)C3)cc2)c1 ZINC000465953521 879620463 /nfs/dbraw/zinc/62/04/63/879620463.db2.gz QBKJJEYYXSACRV-NZQKXSOJSA-N 0 3 405.542 4.291 20 0 HIADHN C[C@@H](CNC(=O)N[C@H](CC(C)(C)C)c1ccc(Cl)cc1)CN1CCN(C)CC1 ZINC000465964863 879632998 /nfs/dbraw/zinc/63/29/98/879632998.db2.gz CRNTWQURJIYINW-FXAWDEMLSA-N 0 3 409.018 4.000 20 0 HIADHN CC[C@H](NC(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1)C(C)(C)c1ccccc1 ZINC000465965872 879634892 /nfs/dbraw/zinc/63/48/92/879634892.db2.gz FURKBVAZHFGHQA-MZKRTTBSSA-N 0 3 415.622 4.274 20 0 HIADHN COc1ccccc1[C@@H](NC(=O)N1CCN(C)CC[C@@H]1C)c1ccccc1Cl ZINC000466079034 879795103 /nfs/dbraw/zinc/79/51/03/879795103.db2.gz OHHJVRDLEGFQDX-KKSFZXQISA-N 0 3 401.938 4.174 20 0 HIADHN Cc1csc([C@@H](NC(=O)N(CCN(C)C)Cc2cccc(Cl)c2)C2CC2)n1 ZINC000466081571 879799989 /nfs/dbraw/zinc/79/99/89/879799989.db2.gz ISPMFMXSYRPTQI-SFHVURJKSA-N 0 3 406.983 4.329 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)N[C@H]1CCc2c1cccc2O ZINC000466091185 879809643 /nfs/dbraw/zinc/80/96/43/879809643.db2.gz IQVYPTPYWQBNKB-IBGZPJMESA-N 0 3 421.463 4.172 20 0 HIADHN CCCN(C(=O)N[C@H]1CCc2c1cccc2O)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000466095363 879814061 /nfs/dbraw/zinc/81/40/61/879814061.db2.gz OFCVGYIBTULJFK-REWPJTCUSA-N 0 3 407.558 4.466 20 0 HIADHN C[C@@H](CNC(=O)N(Cc1ccco1)C1CCN(C)CC1)Oc1ccccc1Cl ZINC000466178623 879877112 /nfs/dbraw/zinc/87/71/12/879877112.db2.gz QGBOSGWKSUNYDA-INIZCTEOSA-N 0 3 405.926 4.006 20 0 HIADHN CSc1cccc([C@@H](NC(=O)N2CCCN(C)CC2)c2cc(F)ccc2F)c1 ZINC000466278142 880017860 /nfs/dbraw/zinc/01/78/60/880017860.db2.gz OPUOGUSMRWPRES-HXUWFJFHSA-N 0 3 405.514 4.123 20 0 HIADHN COc1ccc([C@@H](CNC(=O)Nc2ccc(Br)cc2)N2CCCC2)cc1 ZINC000503481244 912523753 /nfs/dbraw/zinc/52/37/53/912523753.db2.gz YZHBINJQWMSUQN-LJQANCHMSA-N 0 3 418.335 4.416 20 0 HIADHN CO[C@H](CNC(=O)N(CCN(C)C)Cc1cccc(C)c1)c1cccc(Cl)c1 ZINC000466347867 880104700 /nfs/dbraw/zinc/10/47/00/880104700.db2.gz RVTLXOFZJJOCNL-OAQYLSRUSA-N 0 3 403.954 4.109 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccc(O)cc1)C(=O)c1csc(C(C)(C)C)n1 ZINC000503489887 912534584 /nfs/dbraw/zinc/53/45/84/912534584.db2.gz QFURMMULHJTHTI-QGZVFWFLSA-N 0 3 401.576 4.273 20 0 HIADHN COc1ccc([C@H](CNC(=O)Nc2ccc(NC(=O)C3CC3)cc2)N2CCCC2)cc1 ZINC000503492839 912540052 /nfs/dbraw/zinc/54/00/52/912540052.db2.gz JOLWVGIQKWSZKL-QFIPXVFZSA-N 0 3 422.529 4.002 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1C[C@H](C)N(Cc2ccccc2)C1)c1ncc(-c2ccccc2)o1 ZINC000466504682 880279809 /nfs/dbraw/zinc/27/98/09/880279809.db2.gz NJJWMOAWKJXJHB-BBTUJRGHSA-N 0 3 404.514 4.365 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)Nc2cc3c(cc2Cl)OCCCO3)CN1Cc1ccccc1 ZINC000466514365 880288888 /nfs/dbraw/zinc/28/88/88/880288888.db2.gz LHPREAHBQVJFGB-WBVHZDCISA-N 0 3 415.921 4.286 20 0 HIADHN CC(C)CC(=O)Nc1ccc(NC(=O)N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)cc1 ZINC000466518145 880292944 /nfs/dbraw/zinc/29/29/44/880292944.db2.gz LKVMINTXVVFLIM-AVRDEDQJSA-N 0 3 408.546 4.456 20 0 HIADHN C[C@H]1C[C@H](NC(=O)Nc2ccc(C(=O)NC3CCCC3)cc2)CN1Cc1ccccc1 ZINC000466518178 880294047 /nfs/dbraw/zinc/29/40/47/880294047.db2.gz LSIYTWNERYLCNT-MBSDFSHPSA-N 0 3 420.557 4.144 20 0 HIADHN Cc1ccc(NC(=O)C2CC2)cc1NC(=O)N[C@H]1C[C@@H](C)N(Cc2ccccc2)C1 ZINC000466518629 880295545 /nfs/dbraw/zinc/29/55/45/880295545.db2.gz ZABUGDXHRQSFCC-UTKZUKDTSA-N 0 3 406.530 4.128 20 0 HIADHN COc1cc(CN(C)C(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)ccc1SC ZINC000466524534 880301555 /nfs/dbraw/zinc/30/15/55/880301555.db2.gz DRHQPWXJJMTZHU-FXAWDEMLSA-N 0 3 413.587 4.222 20 0 HIADHN C[C@H]1C[C@H](NC(=O)NCc2ccc(-c3ccncc3)cc2)CN1Cc1ccccc1 ZINC000466534511 880309823 /nfs/dbraw/zinc/30/98/23/880309823.db2.gz QKKPTRMAYWFRPE-CYFREDJKSA-N 0 3 400.526 4.211 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)Nc2cccc(OCc3cccnc3)c2)CN1Cc1ccccc1 ZINC000466540474 880315767 /nfs/dbraw/zinc/31/57/67/880315767.db2.gz OYHNWLRAQPYDSU-WMZHIEFXSA-N 0 3 416.525 4.445 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)N1CCO[C@H](c2cccc(Cl)c2)C1 ZINC000466566748 880342376 /nfs/dbraw/zinc/34/23/76/880342376.db2.gz YFWVAVHMLDEBQY-VXKWHMMOSA-N 0 3 413.949 4.260 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)NCc1ccnc(Oc2ccccc2F)c1 ZINC000503520779 912567248 /nfs/dbraw/zinc/56/72/48/912567248.db2.gz JGZWEOYVHDEYIU-UHFFFAOYSA-N 0 3 414.525 4.421 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)Nc3cc(Cl)c(Cl)cn3)CC2)C[C@H](C)O1 ZINC000466664212 880446674 /nfs/dbraw/zinc/44/66/74/880446674.db2.gz KFHMXFJWUOZKPK-KBPBESRZSA-N 0 3 415.365 4.132 20 0 HIADHN CN(C)Cc1cccc(NC(=O)NCc2cc3cc(Br)ccc3[nH]2)c1 ZINC000466680321 880468835 /nfs/dbraw/zinc/46/88/35/880468835.db2.gz RIFNMARXMFRNHY-UHFFFAOYSA-N 0 3 401.308 4.314 20 0 HIADHN CC(C)C[C@H]1CCCCN1CC(=O)N(C)CC(=O)Nc1ccccc1C(F)(F)F ZINC000466692404 880481623 /nfs/dbraw/zinc/48/16/23/880481623.db2.gz ROHKUGBVJOZAJG-MRXNPFEDSA-N 0 3 413.484 4.003 20 0 HIADHN CCCN1CCC[C@H]1C(=O)NC[C@H](c1c[nH]c2ccccc21)c1ccc(OC)cc1 ZINC000503526993 912576454 /nfs/dbraw/zinc/57/64/54/912576454.db2.gz IPIRRPFYVDYGHY-URXFXBBRSA-N 0 3 405.542 4.299 20 0 HIADHN Cc1ccc(-c2nc(CNC(=O)N(CCN(C)C)Cc3cccc(F)c3)co2)cc1 ZINC000466759318 880538638 /nfs/dbraw/zinc/53/86/38/880538638.db2.gz VGZDZVULRKCEHL-UHFFFAOYSA-N 0 3 410.493 4.063 20 0 HIADHN CSc1ccc([C@@H](C)NC(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)cc1 ZINC000466847999 880617674 /nfs/dbraw/zinc/61/76/74/880617674.db2.gz VNIWKGIWGBJOOK-GBESFXJTSA-N 0 3 419.635 4.390 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)NCc1cccc2cc[nH]c21 ZINC000466857291 880627371 /nfs/dbraw/zinc/62/73/71/880627371.db2.gz BMCVAMRJPYEAPJ-UHFFFAOYSA-N 0 3 418.463 4.460 20 0 HIADHN Cc1cccc(C[C@@H](CO)NCc2cccc(Br)c2OC(F)F)c1 ZINC000466920616 880689624 /nfs/dbraw/zinc/68/96/24/880689624.db2.gz RBWRYXZYFNGFNS-HNNXBMFYSA-N 0 3 400.263 4.052 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)N[C@H](C)c2ccc(Br)cc2)cc1 ZINC000503538486 912598043 /nfs/dbraw/zinc/59/80/43/912598043.db2.gz YBXUUHHCZBRNDF-AUUYWEPGSA-N 0 3 420.351 4.121 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)c2cccc(C(=O)N(C)CC(C)(C)C)c2)CN1Cc1ccccc1 ZINC000467040188 880837356 /nfs/dbraw/zinc/83/73/56/880837356.db2.gz HLOVUCHJSXMJFC-XXBNENTESA-N 0 3 421.585 4.198 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)CCc2cc(Br)cs2)CN1Cc1ccccc1 ZINC000467044737 880839600 /nfs/dbraw/zinc/83/96/00/880839600.db2.gz IDAQBVXGXAIOKS-WMLDXEAASA-N 0 3 407.377 4.222 20 0 HIADHN Cc1noc(C)c1COc1ccccc1C(=O)N[C@@H]1C[C@@H](C)N(Cc2ccccc2)C1 ZINC000467060017 880846880 /nfs/dbraw/zinc/84/68/80/880846880.db2.gz QBERDWHJLGOOAJ-DYESRHJHSA-N 0 3 419.525 4.263 20 0 HIADHN CCS[C@H]1CC[C@@H](N(C)C(=O)Nc2ccc(CCN3CCSCC3)cc2)C1 ZINC000467105698 880865975 /nfs/dbraw/zinc/86/59/75/880865975.db2.gz GJAUZWWNRKWZOE-UXHICEINSA-N 0 3 407.649 4.416 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)c(C)c1 ZINC000467108462 880867380 /nfs/dbraw/zinc/86/73/80/880867380.db2.gz BVPUWUGUDRAURM-JQVVWYNYSA-N 0 3 422.573 4.308 20 0 HIADHN Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)N[C@H]1C[C@H](C)N(Cc2ccccc2)C1 ZINC000467116701 880873601 /nfs/dbraw/zinc/87/36/01/880873601.db2.gz MHYJHPRYRSNPJS-UGKGYDQZSA-N 0 3 420.557 4.016 20 0 HIADHN COC[C@H]1CCCCN(CC(=O)N[C@@H](c2ccccc2)c2ccc(Cl)cc2)C1 ZINC000467117759 880874517 /nfs/dbraw/zinc/87/45/17/880874517.db2.gz GNKPUKDODFOFLU-MBSDFSHPSA-N 0 3 400.950 4.294 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N[C@@H](C)c1nc(C(F)(F)F)cs1)c1ccco1 ZINC000503551465 912618343 /nfs/dbraw/zinc/61/83/43/912618343.db2.gz MYPWFEWBWDARCB-SDDRHHMPSA-N 0 3 404.458 4.245 20 0 HIADHN COC[C@@H]1CCCCN(CC(=O)N[C@H](c2ccccc2)c2cccc(Cl)c2)C1 ZINC000467275442 881019516 /nfs/dbraw/zinc/01/95/16/881019516.db2.gz PVNHVLTVSPZZQP-WZONZLPQSA-N 0 3 400.950 4.294 20 0 HIADHN C[C@@H](Cc1cccc(C(F)(F)F)c1)NCc1nnc2ccc(C(F)(F)F)cn21 ZINC000467308313 881056058 /nfs/dbraw/zinc/05/60/58/881056058.db2.gz JLPFAUJVWFQALA-NSHDSACASA-N 0 3 402.342 4.488 20 0 HIADHN Brc1cccc(CN(Cc2cccc3c2OCO3)C2CCOCC2)c1 ZINC000467353649 881113965 /nfs/dbraw/zinc/11/39/65/881113965.db2.gz DWTMEWYCAOIHHF-UHFFFAOYSA-N 0 3 404.304 4.359 20 0 HIADHN COc1ccc([C@H](C)NCc2ccc(I)c(C)c2)cc1OC ZINC000467380443 881157982 /nfs/dbraw/zinc/15/79/82/881157982.db2.gz FGXQPKGLJNTHRU-ZDUSSCGKSA-N 0 3 411.283 4.468 20 0 HIADHN CCC[C@@H](N[C@H]1CCc2cc(F)c(OC)cc21)C(=O)N1CCc2sccc2C1 ZINC000467381622 881159999 /nfs/dbraw/zinc/15/99/99/881159999.db2.gz MGGQRSYPGSMJLE-RBUKOAKNSA-N 0 3 402.535 4.226 20 0 HIADHN COc1cc2c(cc1F)CC[C@H]2NC[C@@H](O)COc1cccc(Cl)c1Cl ZINC000467384884 881165120 /nfs/dbraw/zinc/16/51/20/881165120.db2.gz KPLGPYPROQCFSJ-MLGOLLRUSA-N 0 3 400.277 4.158 20 0 HIADHN COc1ccc2c(c1)[C@H](NC[C@H](O)COc1ccccc1Br)CCS2 ZINC000467391324 881174176 /nfs/dbraw/zinc/17/41/76/881174176.db2.gz BXMCELOYPAGIEG-SUMWQHHRSA-N 0 3 424.360 4.024 20 0 HIADHN O=C(CN[C@H](c1cccc(Br)c1)C1CCOCC1)Nc1ccc(F)cc1 ZINC000467404086 881190404 /nfs/dbraw/zinc/19/04/04/881190404.db2.gz MKLMFIGRTXHDFG-FQEVSTJZSA-N 0 3 421.310 4.284 20 0 HIADHN CCS(=O)(=O)c1cccc(CN[C@H]2CCc3cc(Br)cc(C)c32)c1 ZINC000467409749 881197611 /nfs/dbraw/zinc/19/76/11/881197611.db2.gz ADSHFVNPVQVCKY-SFHVURJKSA-N 0 3 408.361 4.328 20 0 HIADHN CCS(=O)(=O)c1cccc(CN[C@@H]2CCCc3ccc(Br)cc32)c1 ZINC000467412350 881199212 /nfs/dbraw/zinc/19/92/12/881199212.db2.gz RVNHVQZHPDXGOU-LJQANCHMSA-N 0 3 408.361 4.410 20 0 HIADHN CC1(c2ccccc2)CC(N[C@@H]2CCS(=O)(=O)c3ccc(Br)cc32)C1 ZINC000467417664 881207152 /nfs/dbraw/zinc/20/71/52/881207152.db2.gz KBTFQCXESWDBAK-KGXSXCIVSA-N 0 3 420.372 4.378 20 0 HIADHN CCS(=O)(=O)c1cccc(CN[C@H](C)CC(=O)Nc2ccc(C(C)C)cc2)c1 ZINC000467417798 881207792 /nfs/dbraw/zinc/20/77/92/881207792.db2.gz HNOIDKFBYDOXPR-QGZVFWFLSA-N 0 3 402.560 4.111 20 0 HIADHN Cc1cc(NC(=O)N[C@@H](C)CC(F)(F)F)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000467437478 881235392 /nfs/dbraw/zinc/23/53/92/881235392.db2.gz BKFXRDQOVBRFTK-DOTOQJQBSA-N 0 3 409.456 4.101 20 0 HIADHN CC(C)NC(=O)Nc1ccc([C@H](C)N[C@@H]2CC(=O)N(Cc3ccccc3)[C@@H]2C)cc1 ZINC000467440659 881241631 /nfs/dbraw/zinc/24/16/31/881241631.db2.gz WFJBBZWXKMOKCJ-NJNPRVFISA-N 0 3 408.546 4.057 20 0 HIADHN CC(=O)N(Cc1ccc(NC(=O)N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)cc1)C(C)C ZINC000467476112 881295519 /nfs/dbraw/zinc/29/55/19/881295519.db2.gz NGGHDIYRBANGIY-DVECYGJZSA-N 0 3 422.573 4.228 20 0 HIADHN Cc1ccnc(Oc2ccc(NC(=O)N[C@@H]3C[C@H](C)N(Cc4ccccc4)C3)cc2)n1 ZINC000467478962 881299423 /nfs/dbraw/zinc/29/94/23/881299423.db2.gz VXTZCWYZHOMNIB-GHTZIAJQSA-N 0 3 417.513 4.362 20 0 HIADHN COc1ccc([C@@H](N[C@H](C)Cn2cccn2)c2ccccc2)cc1Br ZINC000469063774 883140157 /nfs/dbraw/zinc/14/01/57/883140157.db2.gz UHXTZJSOLKVAGP-QRWLVFNGSA-N 0 3 400.320 4.422 20 0 HIADHN CC1(C)OCc2cc(CN3CCC[C@H](C(=O)Nc4ccc(Cl)cn4)C3)ccc2O1 ZINC000469065738 883142183 /nfs/dbraw/zinc/14/21/83/883142183.db2.gz QOTYLZFJUFAWQW-INIZCTEOSA-N 0 3 415.921 4.231 20 0 HIADHN C[C@@H]1CC[C@H](C)N1CC(=O)N[C@H](c1ccc2c(c1)OCCO2)c1ccccc1Cl ZINC000469102219 883192702 /nfs/dbraw/zinc/19/27/02/883192702.db2.gz ZULSMZNBAGIHFN-VBURHUQHSA-N 0 3 414.933 4.190 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)c3cc(-c4ccc(Cl)cc4)c[nH]3)CC2)C[C@@H](C)O1 ZINC000469114373 883205943 /nfs/dbraw/zinc/20/59/43/883205943.db2.gz WFFKAWJVBQSQLK-IAGOWNOFSA-N 0 3 415.965 4.297 20 0 HIADHN CCOC(=O)c1csc(CCN[C@H](c2ccc(F)cc2)c2ccc(OC)cc2)n1 ZINC000469124791 883220479 /nfs/dbraw/zinc/22/04/79/883220479.db2.gz HARIGQKFUSHQNT-OAQYLSRUSA-N 0 3 414.502 4.389 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)NCC3(c4cc(C(F)(F)F)ccc4Cl)CC3)[C@H]2C1 ZINC000469181183 883280245 /nfs/dbraw/zinc/28/02/45/883280245.db2.gz GBLDYKFQRAWINQ-DYVFJYSZSA-N 0 3 415.887 4.126 20 0 HIADHN COc1cc(Br)ccc1[C@@H](C)N[C@H](C)Cn1cc(Br)cn1 ZINC000469226275 883325742 /nfs/dbraw/zinc/32/57/42/883325742.db2.gz STTPGGMZULHGCM-GHMZBOCLSA-N 0 3 417.145 4.156 20 0 HIADHN CCc1[nH]nc(C(=O)N(CCc2ccccc2)Cc2ccncc2)c1Br ZINC000469231262 883329143 /nfs/dbraw/zinc/32/91/43/883329143.db2.gz KJQYPORTCYYYKK-UHFFFAOYSA-N 0 3 413.319 4.015 20 0 HIADHN CCCN1CCC(N(C)S(=O)(=O)c2cc(Cl)ccc2OCC2CCC2)CC1 ZINC000469271439 883369328 /nfs/dbraw/zinc/36/93/28/883369328.db2.gz ZEZRMJWQLHYXFM-UHFFFAOYSA-N 0 3 414.999 4.014 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3cccc(Br)c3C)cc2)CC1 ZINC000469386164 883531684 /nfs/dbraw/zinc/53/16/84/883531684.db2.gz MKVYSNCHJXGDRX-UHFFFAOYSA-N 0 3 402.336 4.152 20 0 HIADHN CCC[C@@H](NC(=O)N[C@H](CN(C)Cc1ccccc1)C(C)C)c1nnc2ccccn21 ZINC000469437496 883626581 /nfs/dbraw/zinc/62/65/81/883626581.db2.gz YZKBKLHTZZOLCR-NHCUHLMSSA-N 0 3 422.577 4.026 20 0 HIADHN O=c1cc(CN2CCC(Cc3ccc(F)c(F)c3)CC2)nc2ccc(Cl)cn12 ZINC000469463289 883678198 /nfs/dbraw/zinc/67/81/98/883678198.db2.gz SYGWMMKYJLFIEA-UHFFFAOYSA-N 0 3 403.860 4.081 20 0 HIADHN CCN1CCN([C@@H](C)CNC(=O)c2ccc(Oc3ccc(Cl)cc3)c(F)c2)CC1 ZINC000469504262 883752326 /nfs/dbraw/zinc/75/23/26/883752326.db2.gz BMNMIUBWHDADNQ-INIZCTEOSA-N 0 3 419.928 4.027 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N3CCS[C@H](C)[C@@H]3c3ccccc3)cc2)CC1 ZINC000469552296 883811030 /nfs/dbraw/zinc/81/10/30/883811030.db2.gz QKOAEWOFNZJKHF-AUSIDOKSSA-N 0 3 409.599 4.147 20 0 HIADHN C[C@@H]1CC[C@H](C)N1CC(=O)NCc1ccc(Oc2ccccc2C(F)(F)F)nc1 ZINC000469605705 883831896 /nfs/dbraw/zinc/83/18/96/883831896.db2.gz WPFWNSBKBMABIT-GASCZTMLSA-N 0 3 407.436 4.382 20 0 HIADHN COc1ccc(-n2c3ccccc3nc2NC(=O)c2cccc(CN(C)C)c2)cc1 ZINC000469616467 883835539 /nfs/dbraw/zinc/83/55/39/883835539.db2.gz ZJAOOBXATAORRQ-UHFFFAOYSA-N 0 3 400.482 4.348 20 0 HIADHN COc1ccc([C@H](CNC(=O)Nc2ccccc2-n2ccc(C)n2)N2CCCC2)cc1 ZINC000469661363 883855670 /nfs/dbraw/zinc/85/56/70/883855670.db2.gz HJRYZBJQWJHYHU-QHCPKHFHSA-N 0 3 419.529 4.148 20 0 HIADHN CC(=O)N1CCCc2cc(NC(=O)N[C@H](CN(C)Cc3ccccc3)C(C)C)ccc21 ZINC000469665980 883858972 /nfs/dbraw/zinc/85/89/72/883858972.db2.gz UVLRLGQNQHVHSZ-HSZRJFAPSA-N 0 3 422.573 4.264 20 0 HIADHN CCC1(CC)CCCN([C@@H](C)C(=O)Nc2c(C)n(C)n(-c3ccccc3)c2=O)CC1 ZINC000469736785 883894057 /nfs/dbraw/zinc/89/40/57/883894057.db2.gz KTCOYYMBMVCMBD-IBGZPJMESA-N 0 3 412.578 4.104 20 0 HIADHN COc1ccc(NC(=O)CCN[C@@H](C)c2ccc(Br)cc2OC)cc1 ZINC000469739418 883896028 /nfs/dbraw/zinc/89/60/28/883896028.db2.gz JFBGUBXCUXTDEH-ZDUSSCGKSA-N 0 3 407.308 4.146 20 0 HIADHN COc1cc(Br)ccc1[C@@H](C)NCCC(=O)N1CCc2ccccc2C1 ZINC000469758835 883923447 /nfs/dbraw/zinc/92/34/47/883923447.db2.gz ZRTGJUYCEHADEO-OAHLLOKOSA-N 0 3 417.347 4.083 20 0 HIADHN COc1ccccc1CC(=O)N1CCC(N[C@@H](C)c2csc(C(C)C)n2)CC1 ZINC000469792621 883967720 /nfs/dbraw/zinc/96/77/20/883967720.db2.gz VWOGIQRKOFXXHE-INIZCTEOSA-N 0 3 401.576 4.159 20 0 HIADHN O=C(NC[C@H]1CN(Cc2ccccc2)CCCO1)C(c1ccccc1)c1ccccc1 ZINC000469842846 884024996 /nfs/dbraw/zinc/02/49/96/884024996.db2.gz JLNBGGADJQENSZ-VWLOTQADSA-N 0 3 414.549 4.226 20 0 HIADHN O=C(NC[C@H]1CN(Cc2ccccc2)CCCO1)c1ccc(-c2ccc(F)cc2)o1 ZINC000469849815 884032134 /nfs/dbraw/zinc/03/21/34/884032134.db2.gz CEPCXLMCYLDLDN-NRFANRHFSA-N 0 3 408.473 4.107 20 0 HIADHN O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)[C@@H]1C[C@@H]1c1cccc2ccccc21 ZINC000469848694 884032637 /nfs/dbraw/zinc/03/26/37/884032637.db2.gz MKQYSJZQXVJJQL-DNRSQYFGSA-N 0 3 414.549 4.351 20 0 HIADHN Cc1nc(-c2ccccc2)c(C(=O)NC[C@H]2CN(Cc3ccccc3)CCCO2)s1 ZINC000469870835 884061417 /nfs/dbraw/zinc/06/14/17/884061417.db2.gz KDWXXQKIVUBXMH-NRFANRHFSA-N 0 3 421.566 4.139 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCC3(c4ccc(F)cc4)CC3)c(C)c2)CC1 ZINC000503675874 912782668 /nfs/dbraw/zinc/78/26/68/912782668.db2.gz ABSYIROJHGRFOE-UHFFFAOYSA-N 0 3 410.537 4.129 20 0 HIADHN CC1(C)OCc2cc(CN3CCC(c4nc(-c5ccccc5)n[nH]4)CC3)ccc2O1 ZINC000469910204 884100730 /nfs/dbraw/zinc/10/07/30/884100730.db2.gz NZUWJPRPMGGOPQ-UHFFFAOYSA-N 0 3 404.514 4.496 20 0 HIADHN CC1(C)OCc2cc(CN3CCC(n4cc(Br)cn4)CC3)ccc2O1 ZINC000469916670 884107004 /nfs/dbraw/zinc/10/70/04/884107004.db2.gz LMQGWFWWHQNIAD-UHFFFAOYSA-N 0 3 406.324 4.128 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)N3CC[C@H](c4ccc(Cl)cc4)C3)CC2)c1 ZINC000469965003 884173457 /nfs/dbraw/zinc/17/34/57/884173457.db2.gz HEFWIXBMVANTHH-NRFANRHFSA-N 0 3 411.977 4.177 20 0 HIADHN COC(C)(C)CCN(C)Cc1cccc(Br)c1OC[C@H]1CCCO1 ZINC000469975376 884186750 /nfs/dbraw/zinc/18/67/50/884186750.db2.gz JZJLUVWUNUWUNH-MRXNPFEDSA-N 0 3 400.357 4.254 20 0 HIADHN CCN1CCN(c2ccc(C(=O)NCCCCCOC3CCCCC3)cc2)CC1 ZINC000469993365 884208229 /nfs/dbraw/zinc/20/82/29/884208229.db2.gz UOWVYIMZLVNTJC-UHFFFAOYSA-N 0 3 401.595 4.078 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@@H]2NC(=O)NC[C@H]2CCCN2Cc2ccccc2)cc1 ZINC000470023862 884242018 /nfs/dbraw/zinc/24/20/18/884242018.db2.gz GINLYTNDHUOEKC-SGNDLWITSA-N 0 3 407.558 4.179 20 0 HIADHN C[C@@H]1CN(C(=O)NCC(C)(C)N2CCc3ccccc3C2)C[C@@H](c2ccsc2)O1 ZINC000470040588 884281725 /nfs/dbraw/zinc/28/17/25/884281725.db2.gz DTANOCKXPWUGSF-UTKZUKDTSA-N 0 3 413.587 4.056 20 0 HIADHN Cc1ccc([C@H]2OCCC[C@H]2NC(=O)N(CCN(C)C)Cc2ccc(F)cc2)cc1 ZINC000470048516 884293406 /nfs/dbraw/zinc/29/34/06/884293406.db2.gz WYOWMZRLPRKTEM-DHIUTWEWSA-N 0 3 413.537 4.128 20 0 HIADHN Cc1onc(-c2ccccc2)c1C(=O)Nc1cccc(N2CCN(C(C)C)CC2)c1 ZINC000503769062 912818735 /nfs/dbraw/zinc/81/87/35/912818735.db2.gz IPZCUFJWXKSBDS-UHFFFAOYSA-N 0 3 404.514 4.433 20 0 HIADHN CCCCCn1cc(CNC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)c(C)n1 ZINC000503789247 912825347 /nfs/dbraw/zinc/82/53/47/912825347.db2.gz AUSBWDULRLITJA-HXUWFJFHSA-N 0 3 411.594 4.188 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2ccccc2O[C@H]2CCOC2)N2CCCC2)cc1 ZINC000470261852 884607128 /nfs/dbraw/zinc/60/71/28/884607128.db2.gz WMVMVUKEVZOIBR-RBBKRZOGSA-N 0 3 409.530 4.121 20 0 HIADHN O=C(CN[C@H](c1cccc(C(F)(F)F)c1)C1CC1)N[C@@H]1CCOc2ccccc21 ZINC000503886523 912850602 /nfs/dbraw/zinc/85/06/02/912850602.db2.gz NSZFXKZKTXKATQ-NQIIRXRSSA-N 0 3 404.432 4.386 20 0 HIADHN C[C@@H](NCc1ccc(I)c(Cl)c1)c1cccc(CO)c1 ZINC000503891404 912852799 /nfs/dbraw/zinc/85/27/99/912852799.db2.gz IQIHNHPQMVIFKG-LLVKDONJSA-N 0 3 401.675 4.288 20 0 HIADHN C[C@H](CO)N1CCCN(C(=O)Nc2ccc(F)cc2-c2ccc(Cl)cc2)CC1 ZINC000470343570 884733096 /nfs/dbraw/zinc/73/30/96/884733096.db2.gz QMZBQFMATNOIKX-OAHLLOKOSA-N 0 3 405.901 4.067 20 0 HIADHN C[C@@H](CO)N1CCCN(C(=O)Nc2ccccc2Oc2ccc(Cl)cc2)CC1 ZINC000470347701 884737838 /nfs/dbraw/zinc/73/78/38/884737838.db2.gz XGRUVAMUNUFWJF-INIZCTEOSA-N 0 3 403.910 4.053 20 0 HIADHN CCCOc1cc(F)ccc1NC(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000470417491 884820109 /nfs/dbraw/zinc/82/01/09/884820109.db2.gz GQVOBCLUOQKSLN-HDICACEKSA-N 0 3 421.557 4.358 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)Nc2ccc(Br)cc2Cl)C[C@@H](C)O1 ZINC000470438797 884836862 /nfs/dbraw/zinc/83/68/62/884836862.db2.gz PROUFYNHCQIYLM-CHWSQXEVSA-N 0 3 418.763 4.113 20 0 HIADHN C[C@H](CCNC(=O)N(CCN(C)C)Cc1ccccn1)c1cccc(C(F)(F)F)c1 ZINC000470466513 884860039 /nfs/dbraw/zinc/86/00/39/884860039.db2.gz GXGVGTVMWCBVEW-QGZVFWFLSA-N 0 3 422.495 4.367 20 0 HIADHN C[C@@H](CC(=O)Nc1cccc(Cl)c1)N[C@@H](Cn1ccccc1=O)c1ccccc1 ZINC000503944023 912875898 /nfs/dbraw/zinc/87/58/98/912875898.db2.gz YFHOMUXYUNMRCS-UWJYYQICSA-N 0 3 409.917 4.250 20 0 HIADHN CCN(C[C@@H]1CCN(Cc2ccccc2)C1)C(=O)C[C@H](C)C(=O)c1cccc(F)c1 ZINC000470530558 884929618 /nfs/dbraw/zinc/92/96/18/884929618.db2.gz RDQMDKTYPKIVNZ-PZJWPPBQSA-N 0 3 410.533 4.405 20 0 HIADHN C/C(=C\c1ccccc1C(F)(F)F)CN(C)[C@H](C)c1ccc(S(N)(=O)=O)cc1 ZINC000503951232 912880316 /nfs/dbraw/zinc/88/03/16/912880316.db2.gz FGHJNIZLHRKRET-OKFGHLOFSA-N 0 3 412.477 4.449 20 0 HIADHN Cc1ccc(C(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)cc1NC(=O)c1ccco1 ZINC000503955561 912882720 /nfs/dbraw/zinc/88/27/20/912882720.db2.gz HQKDKNYBRGKHSW-NQIIRXRSSA-N 0 3 417.509 4.406 20 0 HIADHN Cc1cc(C(=O)N[C@@H](CN(C)Cc2ccccc2)C(C)C)c(C)n1Cc1ccncc1 ZINC000470588305 885005059 /nfs/dbraw/zinc/00/50/59/885005059.db2.gz QBPCHHKLXQZPBT-VWLOTQADSA-N 0 3 418.585 4.435 20 0 HIADHN CN(C(=O)c1cccc(OCc2cccnc2)c1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470656176 885078424 /nfs/dbraw/zinc/07/84/24/885078424.db2.gz MGGMHILLRHMWBI-XMMPIXPASA-N 0 3 415.537 4.397 20 0 HIADHN CN(C(=O)Cc1coc(-c2ccc(F)cc2)n1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470657057 885080284 /nfs/dbraw/zinc/08/02/84/885080284.db2.gz QPGWCHAXGRKUHR-JOCHJYFZSA-N 0 3 407.489 4.146 20 0 HIADHN CN(Cc1nc(C(F)(F)F)cs1)C(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000470666394 885094466 /nfs/dbraw/zinc/09/44/66/885094466.db2.gz ISXNKADBFITJON-CQSZACIVSA-N 0 3 415.456 4.172 20 0 HIADHN COc1ccc2nc(C)cc(C(=O)N(C)[C@@H]3CCCN(Cc4ccccc4)C3)c2c1 ZINC000470667794 885095828 /nfs/dbraw/zinc/09/58/28/885095828.db2.gz NBAUJOPBRDBLED-HXUWFJFHSA-N 0 3 403.526 4.288 20 0 HIADHN Cc1cccc(-c2nnc(-c3ccc(C(=O)N[C@@H]4CCCN(C(C)C)C4)cc3)o2)c1 ZINC000470694703 885131337 /nfs/dbraw/zinc/13/13/37/885131337.db2.gz RNEOWPSPBHUZMH-OAQYLSRUSA-N 0 3 404.514 4.315 20 0 HIADHN CCOC(=O)c1csc(C2CCN(C[C@H](O)Cc3ccc4ccccc4c3)CC2)n1 ZINC000470874085 885361294 /nfs/dbraw/zinc/36/12/94/885361294.db2.gz SGKDNZISVKYJLB-OAQYLSRUSA-N 0 3 424.566 4.256 20 0 HIADHN COc1cccc(C2(NC[C@H](O)Cc3ccc4ccccc4c3)CCOCC2)c1F ZINC000470873772 885362451 /nfs/dbraw/zinc/36/24/51/885362451.db2.gz LYBIGLOVWNNRID-OAQYLSRUSA-N 0 3 409.501 4.186 20 0 HIADHN CCN(C(=O)CCN1CCN(CC)CC1)[C@@H](C)c1ccc(-c2cccc(OC)c2)cc1 ZINC000470893693 885391922 /nfs/dbraw/zinc/39/19/22/885391922.db2.gz WEBAASPZVRAXJF-NRFANRHFSA-N 0 3 423.601 4.299 20 0 HIADHN CN(C(=O)NCc1ccccc1OCC1CC1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470898268 885397170 /nfs/dbraw/zinc/39/71/70/885397170.db2.gz CKMYIOGLRZJZIK-HSZRJFAPSA-N 0 3 407.558 4.281 20 0 HIADHN CCCN1CCN(c2ccccc2CNc2ccc(C(=O)N3CCCC3)cc2)CC1 ZINC000512374069 921114169 /nfs/dbraw/zinc/11/41/69/921114169.db2.gz CXMRWZPWIDAMJV-UHFFFAOYSA-N 0 3 406.574 4.067 20 0 HIADHN Cn1nc(C(F)F)c2cc(C(=O)NC[C@@H]3CCCN(C)[C@H]3c3cccs3)sc21 ZINC000470996074 885496217 /nfs/dbraw/zinc/49/62/17/885496217.db2.gz VCTZJFHUDVSUFW-MEDUHNTESA-N 0 3 424.542 4.447 20 0 HIADHN CN(C(=O)CN1CCN(C)CC12CCCCC2)[C@H](c1ccccc1)c1ccc(F)cc1 ZINC000471036526 885545087 /nfs/dbraw/zinc/54/50/87/885545087.db2.gz BMALDHQHTNARGT-RUZDIDTESA-N 0 3 423.576 4.324 20 0 HIADHN Cc1cc(NC(=O)c2ccc3nc(C)oc3c2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000471051039 885563509 /nfs/dbraw/zinc/56/35/09/885563509.db2.gz VPFCRSMCSKISMG-HXUWFJFHSA-N 0 3 415.497 4.340 20 0 HIADHN Cc1cc(NC(=O)c2cccc3oc(C)nc32)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000471052339 885565762 /nfs/dbraw/zinc/56/57/62/885565762.db2.gz JTUTUKQQSIRFTN-LJQANCHMSA-N 0 3 415.497 4.340 20 0 HIADHN O=C(NCc1nnc(-c2ccccc2)s1)NC[C@@H]1CCCCN1Cc1ccccc1 ZINC000471068743 885586862 /nfs/dbraw/zinc/58/68/62/885586862.db2.gz IYZKPYVWKZJJGI-FQEVSTJZSA-N 0 3 421.570 4.059 20 0 HIADHN CCN1CCc2nc3ccccc3c(C(=O)N[C@H](C)[C@@H](c3ccccc3)N(C)C)c2C1 ZINC000471122225 885659369 /nfs/dbraw/zinc/65/93/69/885659369.db2.gz WRMOEFFPHKLGPS-CJAUYULYSA-N 0 3 416.569 4.034 20 0 HIADHN CSc1nc(C(C)(C)C)nc(C)c1C(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C ZINC000471137189 885677851 /nfs/dbraw/zinc/67/78/51/885677851.db2.gz OFKKCGXGJFJBPW-MAUKXSAKSA-N 0 3 400.592 4.226 20 0 HIADHN Cc1cccc(I)c1C(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C ZINC000471139717 885683481 /nfs/dbraw/zinc/68/34/81/885683481.db2.gz KBROLAINIOASLR-KBXCAEBGSA-N 0 3 422.310 4.021 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)Cc3cc(F)ccc3F)c(OCC)c2)CC1 ZINC000471166087 885721951 /nfs/dbraw/zinc/72/19/51/885721951.db2.gz SDWCBXJRUNYPGZ-UHFFFAOYSA-N 0 3 417.500 4.077 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3cc(F)cc(F)c3)c(OCC)c2)CC1 ZINC000471171523 885730219 /nfs/dbraw/zinc/73/02/19/885730219.db2.gz YWEKQQYQMGGZKR-UHFFFAOYSA-N 0 3 403.473 4.148 20 0 HIADHN COc1ccc(CN(C)CCC(=O)NC(c2ccccc2)c2ccccc2)cc1O ZINC000471177487 885740231 /nfs/dbraw/zinc/74/02/31/885740231.db2.gz NNZKHSLPWGGQDH-UHFFFAOYSA-N 0 3 404.510 4.129 20 0 HIADHN CN(C)Cc1cccc(NC(=O)c2cc(I)ccc2Cl)c1 ZINC000471219148 885793124 /nfs/dbraw/zinc/79/31/24/885793124.db2.gz GKJJSGSXCNFHAQ-UHFFFAOYSA-N 0 3 414.674 4.259 20 0 HIADHN CSc1nc(C(C)(C)C)nc(C)c1C(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000471330443 885927365 /nfs/dbraw/zinc/92/73/65/885927365.db2.gz KKJXOYWSTSNGAG-FUHWJXTLSA-N 0 3 412.603 4.370 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1cccc(NC(=O)N(C)C)c1C)c1ccsc1 ZINC000471359908 885984779 /nfs/dbraw/zinc/98/47/79/885984779.db2.gz GHFLIRAOBNLWKZ-IBGZPJMESA-N 0 3 417.579 4.355 20 0 HIADHN CCc1ccc([C@H](CNC(=O)Nc2cccc(NC(=O)N(C)C)c2C)N(C)C)cc1 ZINC000471360687 885987192 /nfs/dbraw/zinc/98/71/92/885987192.db2.gz RWMWWPDUNFOZHS-NRFANRHFSA-N 0 3 411.550 4.075 20 0 HIADHN Cc1c(NC(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)cccc1NC(=O)N(C)C ZINC000471367931 886004224 /nfs/dbraw/zinc/00/42/24/886004224.db2.gz XUXARXRMSUMFGQ-IEBWSBKVSA-N 0 3 409.534 4.046 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1ccc(N2CCCCC2)c2ncccc12 ZINC000471415389 886069594 /nfs/dbraw/zinc/06/95/94/886069594.db2.gz KDJJXNUZKGDNMR-UHFFFAOYSA-N 0 3 421.545 4.414 20 0 HIADHN Cc1ncsc1CN(C)C[C@H]1CCN(C(=O)Nc2cccc(Br)c2)C1 ZINC000471477165 886171631 /nfs/dbraw/zinc/17/16/31/886171631.db2.gz SAEKPGJDEULBRA-CQSZACIVSA-N 0 3 423.380 4.200 20 0 HIADHN COc1cc(NC(=O)N(Cc2ccccc2)C2CCN(C)CC2)cc(-n2cccn2)c1 ZINC000471479394 886176095 /nfs/dbraw/zinc/17/60/95/886176095.db2.gz GYECNQKNLCFYNE-UHFFFAOYSA-N 0 3 419.529 4.009 20 0 HIADHN COc1cc(F)c(NC(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)cc1OC ZINC000504113214 913020784 /nfs/dbraw/zinc/02/07/84/913020784.db2.gz IWWHVQNKCJVOCP-IBGZPJMESA-N 0 3 401.482 4.110 20 0 HIADHN COc1ccc(CNCCc2ccccc2OC(F)F)c(Br)c1O ZINC000471527423 886231892 /nfs/dbraw/zinc/23/18/92/886231892.db2.gz QTGNXJPELMUWFV-UHFFFAOYSA-N 0 3 402.235 4.097 20 0 HIADHN CC(C)CCC1CCN(C(=O)NCc2ccccc2CN2CCC(O)CC2)CC1 ZINC000471545914 886252951 /nfs/dbraw/zinc/25/29/51/886252951.db2.gz HTFAPPIFGBQLDT-UHFFFAOYSA-N 0 3 401.595 4.001 20 0 HIADHN Cc1cccc(C(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)c1I ZINC000471558952 886267616 /nfs/dbraw/zinc/26/76/16/886267616.db2.gz HUYKPSUVPAPABG-KDOFPFPSSA-N 0 3 422.310 4.021 20 0 HIADHN Cc1noc(CSc2ccc(C(=O)N[C@@H](C)[C@H](c3ccccc3)N(C)C)cc2)n1 ZINC000471576929 886290319 /nfs/dbraw/zinc/29/03/19/886290319.db2.gz GFTKCAVLEFVJPY-YCRPNKLZSA-N 0 3 410.543 4.092 20 0 HIADHN CC(C)c1ccc(NC(=O)C[C@@H](C)NCc2n[nH]c(COc3ccccc3)n2)cc1 ZINC000471603900 886318918 /nfs/dbraw/zinc/31/89/18/886318918.db2.gz VRFOQVLCGQOWMT-QGZVFWFLSA-N 0 3 407.518 4.014 20 0 HIADHN C[C@H](NC(=O)N[C@H]1C[C@@H]1c1ccccc1OC(F)F)[C@H](c1ccccc1)N(C)C ZINC000504126487 913031280 /nfs/dbraw/zinc/03/12/80/913031280.db2.gz WOJWAEURQHVEBJ-XBQLCILLSA-N 0 3 403.473 4.135 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N[C@H]1C[C@@H]1c1ccccc1OC(F)F)c1ccco1 ZINC000504128637 913031943 /nfs/dbraw/zinc/03/19/43/913031943.db2.gz PFCCZPQKERTLSF-PQEBFOHHSA-N 0 3 407.461 4.166 20 0 HIADHN Cc1ccc([C@H](NC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)c2ccccn2)cc1 ZINC000471677963 886387706 /nfs/dbraw/zinc/38/77/06/886387706.db2.gz JKNQASRXSDKBPA-NOZRDPDXSA-N 0 3 414.553 4.443 20 0 HIADHN CCc1c(C(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)cnn1-c1ccc(OC)cc1 ZINC000471739656 886461382 /nfs/dbraw/zinc/46/13/82/886461382.db2.gz VNWYSBGWUHFYMT-QUCCMNQESA-N 0 3 418.541 4.009 20 0 HIADHN CCC(O)(CC)CCN[C@H](c1cccc(S(C)(=O)=O)c1)c1ccc(C)cc1C ZINC000471778240 886511714 /nfs/dbraw/zinc/51/17/14/886511714.db2.gz DLTDZWLJMYECCN-JOCHJYFZSA-N 0 3 403.588 4.327 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)c1ccc2nc(C(F)(F)F)cn2c1 ZINC000471833697 886586967 /nfs/dbraw/zinc/58/69/67/886586967.db2.gz QXRHUPLYIJDUGQ-UHFFFAOYSA-N 0 3 424.854 4.211 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)NC1(c2ccc(Cl)cc2)CC1 ZINC000471853621 886622472 /nfs/dbraw/zinc/62/24/72/886622472.db2.gz SUDSXZXTZNWEPD-UHFFFAOYSA-N 0 3 415.887 4.434 20 0 HIADHN Cc1cn([C@H](C)c2ccccc2)nc1NC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000471855265 886626332 /nfs/dbraw/zinc/62/63/32/886626332.db2.gz FUSFASSYKQAILF-COPCDDAFSA-N 0 3 403.530 4.368 20 0 HIADHN Cc1cn([C@H](C)c2ccccc2)nc1NC(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C ZINC000471864331 886641617 /nfs/dbraw/zinc/64/16/17/886641617.db2.gz ROPWYUAPXCMQKN-JXHRLWIKSA-N 0 3 417.557 4.443 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2ccc3nc(-c4ccccn4)oc3c2)[C@H]1c1ccccc1 ZINC000471924195 886714169 /nfs/dbraw/zinc/71/41/69/886714169.db2.gz LZEYVZJEVXPZTQ-SIKLNZKXSA-N 0 3 413.481 4.457 20 0 HIADHN C[C@@H](C(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1)c1ccc(Cl)c(Cl)c1 ZINC000471976272 886806738 /nfs/dbraw/zinc/80/67/38/886806738.db2.gz FBDJBWPBCWIZLI-BZUAXINKSA-N 0 3 413.389 4.445 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2ccccc2CC(=O)OC(C)(C)C)[C@H]1c1ccccc1 ZINC000471985107 886811903 /nfs/dbraw/zinc/81/19/03/886811903.db2.gz JSKTVQBDMOLHJM-IFMALSPDSA-N 0 3 409.530 4.138 20 0 HIADHN CCC(CC)[C@@H](c1ccc(Cl)cc1)N(C)C(=O)NC[C@H](C)CN1CCN(C)CC1 ZINC000471993359 886819718 /nfs/dbraw/zinc/81/97/18/886819718.db2.gz TUJCSNKXTAIPOU-AVRDEDQJSA-N 0 3 423.045 4.342 20 0 HIADHN Cc1ccc(OCCCC(=O)N(C)C2CCN(CCc3ccccn3)CC2)cc1C ZINC000471996186 886822017 /nfs/dbraw/zinc/82/20/17/886822017.db2.gz UWDRIWHUDPHHPL-UHFFFAOYSA-N 0 3 409.574 4.023 20 0 HIADHN CC(C)n1cnnc1-c1ccccc1NC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000472020532 886843832 /nfs/dbraw/zinc/84/38/32/886843832.db2.gz TYAYZUAFNZIXFT-LEWJYISDSA-N 0 3 404.518 4.093 20 0 HIADHN Cc1ccc2[nH]c(CNCc3ccc(S(=O)(=O)N4CCCCC4)cc3)cc2c1C ZINC000472036102 886855888 /nfs/dbraw/zinc/85/58/88/886855888.db2.gz BUJMLSDNWHCADO-UHFFFAOYSA-N 0 3 411.571 4.249 20 0 HIADHN CCn1nc(CNC(C)(C)COc2ncccc2Br)c2ccccc21 ZINC000472053286 886866420 /nfs/dbraw/zinc/86/64/20/886866420.db2.gz HQDRVBNFUJJRTN-UHFFFAOYSA-N 0 3 403.324 4.161 20 0 HIADHN CCC(CC)(C(=O)N[C@@H](C)CCN1CCN(C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000472119107 886905448 /nfs/dbraw/zinc/90/54/48/886905448.db2.gz AOAYVLUNCHIXEW-INIZCTEOSA-N 0 3 414.421 4.193 20 0 HIADHN Cc1ccc([C@@H](NC(=O)N[C@H](C)CN(C)Cc2ccccc2)c2ccccn2)cc1 ZINC000472143748 886940470 /nfs/dbraw/zinc/94/04/70/886940470.db2.gz HGVKEFYZDWNWNO-HYBUGGRVSA-N 0 3 402.542 4.299 20 0 HIADHN Cc1oc2ccccc2c1CCNC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472180934 886980876 /nfs/dbraw/zinc/98/08/76/886980876.db2.gz XWGUWTQBSZGHQO-UHFFFAOYSA-N 0 3 423.479 4.388 20 0 HIADHN CCN1CCN(CCC(=O)Nc2cccc(Sc3ccc(Cl)cc3)c2)CC1 ZINC000472220969 887024453 /nfs/dbraw/zinc/02/44/53/887024453.db2.gz KPIDJUQESJFJJF-UHFFFAOYSA-N 0 3 403.979 4.457 20 0 HIADHN C[C@H](Oc1ccc2ccccc2c1)C(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000472265238 887079621 /nfs/dbraw/zinc/07/96/21/887079621.db2.gz XTPHQRYZEDRAEN-IBGZPJMESA-N 0 3 418.537 4.450 20 0 HIADHN O=C(NC[C@H]1CCCCN1CCc1nc(-c2cccc(Cl)c2)no1)c1ccccc1 ZINC000472273844 887088261 /nfs/dbraw/zinc/08/82/61/887088261.db2.gz CQEDWFGNRXDBIB-HXUWFJFHSA-N 0 3 424.932 4.217 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2cccc(OCc3cscn3)c2)[C@H]1c1ccccc1 ZINC000472304255 887128041 /nfs/dbraw/zinc/12/80/41/887128041.db2.gz HCXXQAOGVQFRDL-LEWJYISDSA-N 0 3 408.527 4.289 20 0 HIADHN CC(C)c1noc(-c2ccc(NC(=O)N[C@@H]3CCN(C)[C@H]3c3ccccc3)cc2)n1 ZINC000472307577 887133682 /nfs/dbraw/zinc/13/36/82/887133682.db2.gz XXTHIZKISWOOIC-UXHICEINSA-N 0 3 405.502 4.427 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2ccc(OCc3ccncc3)cc2)[C@H]1c1ccccc1 ZINC000472309638 887137636 /nfs/dbraw/zinc/13/76/36/887137636.db2.gz CWZFTDPRRQJODN-DHIUTWEWSA-N 0 3 402.498 4.228 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2ccc(-c3noc(C(F)F)n3)cc2)[C@H]1c1ccccc1 ZINC000472315239 887146491 /nfs/dbraw/zinc/14/64/91/887146491.db2.gz SHGKNIRYULVGKV-DLBZAZTESA-N 0 3 413.428 4.241 20 0 HIADHN CC[C@H]1CN(C(C)=O)[C@@H](CC)CN1CCC(=O)Nc1ccccc1-c1ccccc1 ZINC000472344454 887178990 /nfs/dbraw/zinc/17/89/90/887178990.db2.gz TUXQIOIMQDAYHF-VXKWHMMOSA-N 0 3 407.558 4.404 20 0 HIADHN Cc1ccc(C2CCN(C(=O)NC3CC(N4CCC(C(F)(F)F)CC4)C3)CC2)cn1 ZINC000472443676 887294254 /nfs/dbraw/zinc/29/42/54/887294254.db2.gz KYTAHSAIGOISPZ-UHFFFAOYSA-N 0 3 424.511 4.084 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N1CCC(c2ccsc2)CC1 ZINC000472458846 887314405 /nfs/dbraw/zinc/31/44/05/887314405.db2.gz YNXCBQXJAJJNLZ-UHFFFAOYSA-N 0 3 415.525 4.442 20 0 HIADHN CN(Cc1ccc(Cl)s1)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472458669 887314902 /nfs/dbraw/zinc/31/49/02/887314902.db2.gz YNQHDWIDHMORQI-UHFFFAOYSA-N 0 3 409.905 4.348 20 0 HIADHN Cc1ccc(C[C@@H](C)N(C)C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cc1 ZINC000472461829 887319635 /nfs/dbraw/zinc/31/96/35/887319635.db2.gz CXVULCBSJZRFNM-PBPGXSGUSA-N 0 3 411.512 4.373 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1ncoc1-c1ccc(F)cc1)c1cccc(OC)c1 ZINC000472526485 887396165 /nfs/dbraw/zinc/39/61/65/887396165.db2.gz ZNIMRQHCEOVPOO-HXUWFJFHSA-N 0 3 411.477 4.302 20 0 HIADHN CCN1CCN(c2cccc(NCc3c(C)nn(Cc4ccccc4)c3C)c2)CC1 ZINC000472616552 887485491 /nfs/dbraw/zinc/48/54/91/887485491.db2.gz CZNQNVYUINPGTG-UHFFFAOYSA-N 0 3 403.574 4.302 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)NCC[C@H](C)[N@H+](C)Cc3ccccc3)cc2)cc(=O)[n-]1 ZINC000472681523 887536255 /nfs/dbraw/zinc/53/62/55/887536255.db2.gz DLGYVPKXTCGOLH-KRWDZBQOSA-N 0 3 419.529 4.190 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)NCC[C@H](C)[N@@H+](C)Cc3ccccc3)cc2)cc(=O)[n-]1 ZINC000472681523 887536261 /nfs/dbraw/zinc/53/62/61/887536261.db2.gz DLGYVPKXTCGOLH-KRWDZBQOSA-N 0 3 419.529 4.190 20 0 HIADHN COc1ccc(OC(F)F)c(NC(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000472702404 887554922 /nfs/dbraw/zinc/55/49/22/887554922.db2.gz XDAGLALORUOWOU-KRWDZBQOSA-N 0 3 419.472 4.425 20 0 HIADHN Cc1ccc(C(=O)NC2CC2)cc1NC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000472708918 887559818 /nfs/dbraw/zinc/55/98/18/887559818.db2.gz WXFSSXLQBYOGHF-JOCHJYFZSA-N 0 3 420.557 4.016 20 0 HIADHN CN(C)[C@H](CNC(=O)Nc1ccc(OCc2ccccn2)c(F)c1)c1ccccc1 ZINC000472922155 887769441 /nfs/dbraw/zinc/76/94/41/887769441.db2.gz HISCYCAUQJOECB-OAQYLSRUSA-N 0 3 408.477 4.224 20 0 HIADHN C[C@@H](N[C@H]1CCN(c2ccccc2C(F)(F)F)C1=O)c1ccc(-n2ccnc2)cc1 ZINC000473045404 887868223 /nfs/dbraw/zinc/86/82/23/887868223.db2.gz WZJQXSGCCYYRFM-BEFAXECRSA-N 0 3 414.431 4.347 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(C)c1CN1CCC(O)(Cc2cccc(F)c2)CC1 ZINC000473067888 887888675 /nfs/dbraw/zinc/88/86/75/887888675.db2.gz JKZJPNSMJBDERO-UHFFFAOYSA-N 0 3 411.496 4.337 20 0 HIADHN Cc1ccc2[nH]c(CN3CCC(C(=O)Nc4ccc5c(c4)OCO5)CC3)cc2c1C ZINC000473138447 887924194 /nfs/dbraw/zinc/92/41/94/887924194.db2.gz JJGBLJUOVNOTQP-UHFFFAOYSA-N 0 3 405.498 4.364 20 0 HIADHN O=C(CCN1CC[C@@]2(C1)OCc1ccccc12)N[C@@H](c1cccs1)c1ccccc1 ZINC000473155590 887932669 /nfs/dbraw/zinc/93/26/69/887932669.db2.gz AWBHWPFSKKEXTM-RPBOFIJWSA-N 0 3 418.562 4.475 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)CCC(=O)c1ccc(F)c(F)c1 ZINC000473278674 888035068 /nfs/dbraw/zinc/03/50/68/888035068.db2.gz SSYNXDMEZYYCES-CZKAHXPPSA-N 0 3 414.496 4.201 20 0 HIADHN C[C@@H](CCNC(=O)C(=O)Nc1cccc(CN(C)C)c1)c1cccc(C(F)(F)F)c1 ZINC000473296573 888049076 /nfs/dbraw/zinc/04/90/76/888049076.db2.gz ULDWXQQTVBSVKK-HNNXBMFYSA-N 0 3 421.463 4.016 20 0 HIADHN O=C(CCC(=O)N1CC[C@@]2(C1)CCCN(Cc1ccccc1)C2)c1ccc(F)cc1 ZINC000473505066 888232512 /nfs/dbraw/zinc/23/25/12/888232512.db2.gz JQZJFYNPVPPUMK-VWLOTQADSA-N 0 3 408.517 4.303 20 0 HIADHN COc1ccc2cc(C(=O)NC3CC(N4CCC(C(F)(F)F)CC4)C3)c(C)nc2c1 ZINC000473509769 888237412 /nfs/dbraw/zinc/23/74/12/888237412.db2.gz DDDCBJGEHXSAHC-UHFFFAOYSA-N 0 3 421.463 4.087 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)[C@@H]1CCCC[C@H]1C(F)(F)F ZINC000473512302 888242585 /nfs/dbraw/zinc/24/25/85/888242585.db2.gz JZKXVTRTQFJSQU-NEXFUWMNSA-N 0 3 400.407 4.277 20 0 HIADHN Cc1c(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)sc2nccc(C)c12 ZINC000473515618 888247259 /nfs/dbraw/zinc/24/72/59/888247259.db2.gz YTNSFOLIHFLHOC-UHFFFAOYSA-N 0 3 411.493 4.448 20 0 HIADHN O=C(CCOc1ccc(F)cc1Cl)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473517093 888248112 /nfs/dbraw/zinc/24/81/12/888248112.db2.gz GANZHYDZUHVUBS-UHFFFAOYSA-N 0 3 422.850 4.170 20 0 HIADHN Cc1cccc(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)c1Br ZINC000473516937 888248850 /nfs/dbraw/zinc/24/88/50/888248850.db2.gz FLWHLMQJMROKQY-UHFFFAOYSA-N 0 3 419.285 4.293 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1cc(F)ccc1Br ZINC000473516933 888249050 /nfs/dbraw/zinc/24/90/50/888249050.db2.gz FLGOLULIMHGAEC-UHFFFAOYSA-N 0 3 423.248 4.123 20 0 HIADHN C[C@@H](Cc1cccc(Cl)c1)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473522091 888257530 /nfs/dbraw/zinc/25/75/30/888257530.db2.gz SEAIREROCOLTDX-TZYSRNFLSA-N 0 3 402.888 4.440 20 0 HIADHN Cc1ccc2c(CCC(=O)NC3CC(N4CCC(C(F)(F)F)CC4)C3)c[nH]c2c1 ZINC000473528548 888265200 /nfs/dbraw/zinc/26/52/00/888265200.db2.gz VEJAOXXCXIOLLK-UHFFFAOYSA-N 0 3 407.480 4.330 20 0 HIADHN Cc1ccc(-c2cc(C(=O)NC3CC(N4CCC(C(F)(F)F)CC4)C3)[nH]n2)c(C)c1 ZINC000473530632 888269095 /nfs/dbraw/zinc/26/90/95/888269095.db2.gz OPEJLCPHYUOONH-UHFFFAOYSA-N 0 3 420.479 4.229 20 0 HIADHN Cc1oc(-c2ccccc2)nc1CC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473532226 888270050 /nfs/dbraw/zinc/27/00/50/888270050.db2.gz UHSBMWWVSVWQHS-UHFFFAOYSA-N 0 3 421.463 4.114 20 0 HIADHN Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)N[C@H](C)CCN1CCN(C)CC1 ZINC000473668183 888425263 /nfs/dbraw/zinc/42/52/63/888425263.db2.gz ZQOBNFVDALLTKF-RTWAWAEBSA-N 0 3 424.589 4.283 20 0 HIADHN Cc1cccc(COc2ccc(NC(=O)N[C@@H](C)CCN3CCN(C)CC3)c(C)c2)c1 ZINC000473672893 888434609 /nfs/dbraw/zinc/43/46/09/888434609.db2.gz COCRZAJXYVKUNZ-NRFANRHFSA-N 0 3 424.589 4.030 20 0 HIADHN CN(C)CCN(C[C@@H]1CCCO1)C(=O)c1ccc(-c2ccccc2C(F)(F)F)o1 ZINC000473688172 888460218 /nfs/dbraw/zinc/46/02/18/888460218.db2.gz ACFXEUBDGMTJMQ-HNNXBMFYSA-N 0 3 410.436 4.148 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CCC[C@H]3Cc3ccc(F)cc3)c2)CC1 ZINC000473807984 888631120 /nfs/dbraw/zinc/63/11/20/888631120.db2.gz NTBHOMVLNPESKK-QHCPKHFHSA-N 0 3 410.537 4.207 20 0 HIADHN Cc1c(NC(=O)N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)cccc1C(F)(F)F ZINC000473818270 888647459 /nfs/dbraw/zinc/64/74/59/888647459.db2.gz KQHZGFWAWMXLTH-GASCZTMLSA-N 0 3 413.484 4.367 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N(C)[C@@H](C)c3cc(F)ccc3F)c2)CC1 ZINC000473819162 888648791 /nfs/dbraw/zinc/64/87/91/888648791.db2.gz NGCHZZHFCHTGLN-INIZCTEOSA-N 0 3 402.489 4.332 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@H](C[C@@H]3CCOC3)c3ccccc3)c2)CC1 ZINC000473819966 888650613 /nfs/dbraw/zinc/65/06/13/888650613.db2.gz PBCBRJOUNFPVQJ-GBXCKJPGSA-N 0 3 422.573 4.118 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CC[C@@H](Cc4ccccc4)[C@H]3C)c2)CC1 ZINC000473826567 888659892 /nfs/dbraw/zinc/65/98/92/888659892.db2.gz FOFGWDNJNRZKNX-IRLDBZIGSA-N 0 3 406.574 4.314 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@@H](C)c3ncc(-c4ccccc4)o3)c2)CC1 ZINC000473826151 888660371 /nfs/dbraw/zinc/66/03/71/888660371.db2.gz DLJVUWPDVJWXMP-SFHVURJKSA-N 0 3 419.529 4.366 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CCC[C@H]3Cc3ccccc3C)c2)CC1 ZINC000473829128 888663333 /nfs/dbraw/zinc/66/33/33/888663333.db2.gz MQRYXEDIMBUCBO-DEOSSOPVSA-N 0 3 406.574 4.376 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CCC(OCC4CCCC4)CC3)c2)CC1 ZINC000473836652 888674228 /nfs/dbraw/zinc/67/42/28/888674228.db2.gz NYJBEBSSOKKHHT-UHFFFAOYSA-N 0 3 414.594 4.032 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N(Cc3ccc(OC)cc3)C3CC3)c2)CC1 ZINC000473839371 888681113 /nfs/dbraw/zinc/68/11/13/888681113.db2.gz HSIUCFJXHMLITI-UHFFFAOYSA-N 0 3 408.546 4.034 20 0 HIADHN CCC1(CC)CCC(NC(=O)N(C)C2CCN(CCc3ccccn3)CC2)CC1 ZINC000473870211 888730646 /nfs/dbraw/zinc/73/06/46/888730646.db2.gz WLGSMNREJYHUPN-UHFFFAOYSA-N 0 3 400.611 4.479 20 0 HIADHN O=C(Nc1ccc(C(=O)N2CCCN(C3CCCC3)CC2)s1)Nc1ccccc1 ZINC000473875150 888736831 /nfs/dbraw/zinc/73/68/31/888736831.db2.gz IVQAKNAHSFRTAW-UHFFFAOYSA-N 0 3 412.559 4.483 20 0 HIADHN CN(C)[C@@H](CNC(=O)N[C@H](c1cccc(Cl)c1)c1ccccn1)Cc1ccccc1 ZINC000473885958 888754173 /nfs/dbraw/zinc/75/41/73/888754173.db2.gz MQNMHURBGVIORY-FYYLOGMGSA-N 0 3 422.960 4.297 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CCSC[C@H]1c1nccs1)c1ccsc1 ZINC000473890288 888759678 /nfs/dbraw/zinc/75/96/78/888759678.db2.gz CFRCZWOBDWNHFZ-HOTGVXAUSA-N 0 3 410.634 4.087 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CCC(Nc2nc(C)cs2)CC1)c1ccsc1 ZINC000473896661 888771067 /nfs/dbraw/zinc/77/10/67/888771067.db2.gz SYNIWWFPBXVUEP-SFHVURJKSA-N 0 3 421.636 4.182 20 0 HIADHN C[C@H](NC(=O)NC[C@@H](c1cccs1)N1CCCC1)c1ccc(Br)cn1 ZINC000473984854 888846505 /nfs/dbraw/zinc/84/65/05/888846505.db2.gz YPLICKRKVOYJOY-BBRMVZONSA-N 0 3 423.380 4.103 20 0 HIADHN CN1CCN(CCC(C)(C)NC(=O)N[C@@H](CC2CCCC2)c2ccccc2)CC1 ZINC000474025220 888876394 /nfs/dbraw/zinc/87/63/94/888876394.db2.gz XJOPXSJFSIORPZ-QFIPXVFZSA-N 0 3 400.611 4.023 20 0 HIADHN CCOC1CC(CCN[C@H](c2ccc(F)cc2)c2cccc(S(C)(=O)=O)c2)C1 ZINC000474067503 888897749 /nfs/dbraw/zinc/89/77/49/888897749.db2.gz PRHHCYINLNSYTE-HTRPQEOZSA-N 0 3 405.535 4.113 20 0 HIADHN COc1ccc2c(c1)C(C)(C)C[C@H]2N[C@H](C)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000474070455 888898532 /nfs/dbraw/zinc/89/85/32/888898532.db2.gz BJQTZTZLDUCZIZ-QVKFZJNVSA-N 0 3 402.560 4.019 20 0 HIADHN COc1cccc(CN(Cc2ccc(Cl)cc2-n2cncn2)C[C@@H]2CCCO2)c1 ZINC000474143555 888967763 /nfs/dbraw/zinc/96/77/63/888967763.db2.gz GGRQNOKVPJWWAJ-NRFANRHFSA-N 0 3 412.921 4.111 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)[C@H]3CCN(c4ccccc4)[C@@H]3C)c2)CC1 ZINC000474151539 888980938 /nfs/dbraw/zinc/98/09/38/888980938.db2.gz NVZIWIBMPMZHLA-YKSBVNFPSA-N 0 3 406.574 4.071 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)C(C)(C)c2ccc(Cl)cc2F)CC1 ZINC000474247739 889097709 /nfs/dbraw/zinc/09/77/09/889097709.db2.gz GRJKUBFSNKVRNY-HNNXBMFYSA-N 0 3 403.929 4.494 20 0 HIADHN CN1CC[C@H](NC(=O)C2(c3cc(F)cc(C(F)(F)F)c3)CC2)[C@H]1c1ccccc1 ZINC000474258476 889115401 /nfs/dbraw/zinc/11/54/01/889115401.db2.gz LDBPVSMMNZPKDC-RBUKOAKNSA-N 0 3 406.423 4.438 20 0 HIADHN COc1ccccc1NC(=O)CN1CCN(C[C@@H](CC(C)C)c2ccccc2)CC1 ZINC000474260979 889119655 /nfs/dbraw/zinc/11/96/55/889119655.db2.gz WFLAHYWUCFYYKS-JOCHJYFZSA-N 0 3 409.574 4.081 20 0 HIADHN CSc1cccc(N(C(=O)c2ccc(-n3cncn3)c(C)c2)C2CCN(C)CC2)c1 ZINC000474274881 889140456 /nfs/dbraw/zinc/14/04/56/889140456.db2.gz XUTSRHVXPIJQKR-UHFFFAOYSA-N 0 3 421.570 4.039 20 0 HIADHN COc1ccc2nc(CNC[C@@H](c3ccccc3Cl)N3CCOCC3)sc2c1 ZINC000474339720 889211960 /nfs/dbraw/zinc/21/19/60/889211960.db2.gz CAKQCZVCBJHPSB-IBGZPJMESA-N 0 3 417.962 4.121 20 0 HIADHN COc1ccc2nc(CN[C@H]3CCN(c4cc(Cl)ccc4OC)C3)sc2c1 ZINC000474378085 889254443 /nfs/dbraw/zinc/25/44/43/889254443.db2.gz YCZDQTANFMGFGD-AWEZNQCLSA-N 0 3 403.935 4.335 20 0 HIADHN CC(C)[C@H](N[C@@H]1CCN([C@H](C(=O)OC(C)(C)C)c2ccccc2)C1=O)c1cccnc1 ZINC000474428742 889293725 /nfs/dbraw/zinc/29/37/25/889293725.db2.gz DZZJDNWSFQHIQQ-FSSWDIPSSA-N 0 3 423.557 4.052 20 0 HIADHN CC(C)[C@H](N[C@@H]1CCN([C@@H](C(=O)OC(C)(C)C)c2ccccc2)C1=O)c1cccnc1 ZINC000474428735 889293763 /nfs/dbraw/zinc/29/37/63/889293763.db2.gz DZZJDNWSFQHIQQ-BHIFYINESA-N 0 3 423.557 4.052 20 0 HIADHN COc1ccc([C@H](C)N[C@H]2CCN([C@H](C(=O)OC(C)(C)C)c3ccccc3)C2=O)cc1 ZINC000474433817 889299856 /nfs/dbraw/zinc/29/98/56/889299856.db2.gz QQFMTPFDENZAGC-HSQYWUDLSA-N 0 3 424.541 4.030 20 0 HIADHN CCc1noc(-c2ccc(C)c(NC(=O)N[C@@H](C)[C@@H](c3ccccc3)N(C)C)c2)n1 ZINC000474441025 889307456 /nfs/dbraw/zinc/30/74/56/889307456.db2.gz XAOUEQWGFDQAEI-KKSFZXQISA-N 0 3 407.518 4.420 20 0 HIADHN C[C@@H](NC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1)c1noc(-c2ccccc2)n1 ZINC000474527160 889399145 /nfs/dbraw/zinc/39/91/45/889399145.db2.gz VBAHHWUFXVZJIH-NQIIRXRSSA-N 0 3 419.529 4.104 20 0 HIADHN COc1cc(NC(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)c(OC)cc1Cl ZINC000474540379 889416455 /nfs/dbraw/zinc/41/64/55/889416455.db2.gz NOPAGHOMBQBMAY-INIZCTEOSA-N 0 3 403.910 4.095 20 0 HIADHN CN(C(=O)Nc1cc(Br)ccc1F)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000474583284 889454478 /nfs/dbraw/zinc/45/44/78/889454478.db2.gz DXVYSYFHFQFFJK-MRXNPFEDSA-N 0 3 406.299 4.326 20 0 HIADHN COc1ccc(OC(F)F)c(NC(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000474732043 889588314 /nfs/dbraw/zinc/58/83/14/889588314.db2.gz TWQSBXZGGOLTEQ-MRXNPFEDSA-N 0 3 405.445 4.035 20 0 HIADHN CN(C(=O)Nc1ccc(F)cc1Br)[C@H]1CCN(Cc2ccccc2)C1 ZINC000474753120 889611922 /nfs/dbraw/zinc/61/19/22/889611922.db2.gz TXMMZPDFTPOAIO-INIZCTEOSA-N 0 3 406.299 4.326 20 0 HIADHN C[C@@H](NCc1csc(-c2ccc(C(F)(F)F)cc2)n1)C1CCS(=O)(=O)CC1 ZINC000474810884 889663986 /nfs/dbraw/zinc/66/39/86/889663986.db2.gz QDRRMTCJKSVELQ-GFCCVEGCSA-N 0 3 418.506 4.132 20 0 HIADHN CN1CCN(CCC(C)(C)NC(=O)c2cc3sc4ccccc4c3s2)CC1 ZINC000474822763 889676224 /nfs/dbraw/zinc/67/62/24/889676224.db2.gz QLFKLZMLLMDFEH-UHFFFAOYSA-N 0 3 401.601 4.262 20 0 HIADHN C[C@H](NC(=O)CCN1CCN(c2ccccc2)CC1)c1ccc(-c2cccnc2)cc1 ZINC000474860793 889715655 /nfs/dbraw/zinc/71/56/55/889715655.db2.gz OHNRQDVUTNCZOF-NRFANRHFSA-N 0 3 414.553 4.138 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)CCCOc2cccc(Cl)c2Cl)CC1 ZINC000474876412 889730462 /nfs/dbraw/zinc/73/04/62/889730462.db2.gz WKRCMCDRVCBLQV-UHFFFAOYSA-N 0 3 417.377 4.158 20 0 HIADHN O=C(CCNCc1ccc(Br)cc1C(F)(F)F)N1CCCCCC1 ZINC000474885196 889741012 /nfs/dbraw/zinc/74/10/12/889741012.db2.gz VCXWPGAXXUKRHG-UHFFFAOYSA-N 0 3 407.274 4.350 20 0 HIADHN CC(C)C[C@@H](N[C@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1)c1nc(-c2nc[nH]n2)no1 ZINC000474891644 889748590 /nfs/dbraw/zinc/74/85/90/889748590.db2.gz ZDZDNOMDZQIFOO-YVECIDJPSA-N 0 3 406.943 4.439 20 0 HIADHN CC(C)C[C@@H]([NH2+][C@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1)c1nc(-c2nc[n-]n2)no1 ZINC000474891644 889748597 /nfs/dbraw/zinc/74/85/97/889748597.db2.gz ZDZDNOMDZQIFOO-YVECIDJPSA-N 0 3 406.943 4.439 20 0 HIADHN CN(C)Cc1ccc(C(=O)Nc2ccc(CC(=O)N3CCc4ccccc43)cc2)cc1 ZINC000504627199 913378960 /nfs/dbraw/zinc/37/89/60/913378960.db2.gz DOMLONWTAXLKJS-UHFFFAOYSA-N 0 3 413.521 4.132 20 0 HIADHN CN(Cc1nc2c(s1)CCCC2)C(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000474913875 889774691 /nfs/dbraw/zinc/77/46/91/889774691.db2.gz QOKDVKNBKKOLRR-KRWDZBQOSA-N 0 3 401.551 4.032 20 0 HIADHN CCN(C(=O)Nc1ccc2c(c1)CCCC(=O)N2)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475005311 889857408 /nfs/dbraw/zinc/85/74/08/889857408.db2.gz XIXLNWAQPXXVHQ-OAQYLSRUSA-N 0 3 406.530 4.090 20 0 HIADHN CN(C(=O)N[C@@H](c1ccccc1)c1ccccn1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475009978 889863791 /nfs/dbraw/zinc/86/37/91/889863791.db2.gz RGAFULAEPMIAOF-UPVQGACJSA-N 0 3 400.526 4.087 20 0 HIADHN CCN(C(=O)Nc1ccc(C)cc1OCCOC)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475011675 889865558 /nfs/dbraw/zinc/86/55/58/889865558.db2.gz ZVBQWRDRDLKWFP-NRFANRHFSA-N 0 3 411.546 4.149 20 0 HIADHN CCN(C(=O)Nc1ccc(C)c(C(=O)NC(C)C)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475011080 889865679 /nfs/dbraw/zinc/86/56/79/889865679.db2.gz SKFAVPAVLOPBCZ-JOCHJYFZSA-N 0 3 422.573 4.262 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)Nc2ccccc2OCC(F)F)CC1 ZINC000475037640 889890897 /nfs/dbraw/zinc/89/08/97/889890897.db2.gz GBQQZLNFWUZIQS-UHFFFAOYSA-N 0 3 403.473 4.459 20 0 HIADHN CCN1CCN(c2cccc(NCc3ccc(OC)c(Br)c3)c2)CC1 ZINC000475088845 889935991 /nfs/dbraw/zinc/93/59/91/889935991.db2.gz BBCCQNXAVCGLPC-UHFFFAOYSA-N 0 3 404.352 4.212 20 0 HIADHN CCN1CCN(c2cccc(NC3CCN(c4ccc(F)cc4F)CC3)c2)CC1 ZINC000475088849 889936437 /nfs/dbraw/zinc/93/64/37/889936437.db2.gz BCDGVFKWJHCUHF-UHFFFAOYSA-N 0 3 400.517 4.188 20 0 HIADHN CN(C(=O)NCc1ccc(Br)c(F)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475103851 889952459 /nfs/dbraw/zinc/95/24/59/889952459.db2.gz ZXLPBZAIRYSTHQ-QGZVFWFLSA-N 0 3 420.326 4.004 20 0 HIADHN CN(C(=O)NCc1csc(-c2ccccc2)n1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475114895 889968343 /nfs/dbraw/zinc/96/83/43/889968343.db2.gz YVCWEAKEPYLHLE-NRFANRHFSA-N 0 3 406.555 4.226 20 0 HIADHN CCOc1ccc([C@@H](C)NC(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)cc1OC ZINC000475129117 889992992 /nfs/dbraw/zinc/99/29/92/889992992.db2.gz LJGGFQXNJHEDAZ-NQIIRXRSSA-N 0 3 411.546 4.071 20 0 HIADHN CN(C(=O)NCc1ccccc1OC(F)(F)F)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475130231 889994243 /nfs/dbraw/zinc/99/42/43/889994243.db2.gz PDTKHSOFSHXVTP-GOSISDBHSA-N 0 3 407.436 4.001 20 0 HIADHN CC[C@@H](C)C(=O)Nc1cccc(CNC(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000475131507 889994628 /nfs/dbraw/zinc/99/46/28/889994628.db2.gz DFJBMQUARDIVRK-XXBNENTESA-N 0 3 422.573 4.087 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N(C)[C@@H](C)c1ccc([S@@](C)=O)cc1)c1ccsc1 ZINC000475136906 890002178 /nfs/dbraw/zinc/00/21/78/890002178.db2.gz IVVYTRWJHYEJQW-JVNMPEMCSA-N 0 3 421.632 4.271 20 0 HIADHN CC1CCN([C@H](CNC(=O)N2CCC[C@@]3(CCCOC3)C2)c2cccs2)CC1 ZINC000475148690 890015265 /nfs/dbraw/zinc/01/52/65/890015265.db2.gz ZLSHCEAHJDHYGE-DENIHFKCSA-N 0 3 405.608 4.123 20 0 HIADHN CCN(C(=O)N[C@H](C)c1noc(-c2ccccc2)n1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475161335 890024243 /nfs/dbraw/zinc/02/42/43/890024243.db2.gz HWFKIQNJCGZCKP-NQIIRXRSSA-N 0 3 419.529 4.104 20 0 HIADHN CCN(C(=O)NCc1nc(C(C)(C)C)cs1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475161152 890024389 /nfs/dbraw/zinc/02/43/89/890024389.db2.gz GWUVKQWEOCQUIN-GOSISDBHSA-N 0 3 400.592 4.247 20 0 HIADHN CCN(C(=O)NCc1ccc(OC)c(Cl)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475161065 890025365 /nfs/dbraw/zinc/02/53/65/890025365.db2.gz DMYIRUCQWAIAEA-LJQANCHMSA-N 0 3 401.938 4.155 20 0 HIADHN CCN(C(=O)N[C@@H](C)c1ccccc1-n1cccn1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475162750 890027787 /nfs/dbraw/zinc/02/77/87/890027787.db2.gz DZENGFHVBCANLS-RBBKRZOGSA-N 0 3 417.557 4.239 20 0 HIADHN CCN(C(=O)NCc1coc(-c2ccc(C)cc2)n1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475177513 890047807 /nfs/dbraw/zinc/04/78/07/890047807.db2.gz YQEJLPPYINDXMB-QHCPKHFHSA-N 0 3 418.541 4.456 20 0 HIADHN CCN(C(=O)Nc1cn(-c2ccccc2)nc1C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475208569 890077541 /nfs/dbraw/zinc/07/75/41/890077541.db2.gz YMTZMXWISMYWGL-JOCHJYFZSA-N 0 3 403.530 4.309 20 0 HIADHN CCc1c(C(=O)Nc2ccc(CCN3CCSCC3)cc2)cnn1C1CCCC1 ZINC000475264281 890156817 /nfs/dbraw/zinc/15/68/17/890156817.db2.gz WXHLOARIXHFVFQ-UHFFFAOYSA-N 0 3 412.603 4.404 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)NC(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000475278515 890174543 /nfs/dbraw/zinc/17/45/43/890174543.db2.gz HNHJSIPGVWYPMW-DVECYGJZSA-N 0 3 417.557 4.158 20 0 HIADHN Cc1ccc(OC(F)F)c(CNC(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000475282553 890180177 /nfs/dbraw/zinc/18/01/77/890180177.db2.gz RSLPSVMDIAVLON-IBGZPJMESA-N 0 3 403.473 4.012 20 0 HIADHN CCOc1cc(CN2CCC[C@](C)(OC)C2)ccc1OCc1ccc(C(=O)OC)o1 ZINC000475291269 890194110 /nfs/dbraw/zinc/19/41/10/890194110.db2.gz NTCPOOOTAAJGJT-QHCPKHFHSA-N 0 3 417.502 4.045 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)c1cnc(Cc2ccccc2F)s1 ZINC000475370328 890301057 /nfs/dbraw/zinc/30/10/57/890301057.db2.gz OOBLVRZDHHGTFO-UHFFFAOYSA-N 0 3 415.509 4.216 20 0 HIADHN Cn1c2ccc(C(F)(F)F)cc2nc1CN1CCC[C@@]1(CO)Cc1ccccc1 ZINC000475375729 890305571 /nfs/dbraw/zinc/30/55/71/890305571.db2.gz QIHFOPVWJKZJTB-NRFANRHFSA-N 0 3 403.448 4.162 20 0 HIADHN Cc1ccc(CN2CCSCC2)cc1NC(=O)[C@H]1CCc2[nH]c(C(C)C)nc2C1 ZINC000475466986 890375640 /nfs/dbraw/zinc/37/56/40/890375640.db2.gz SJDXXHWKASRKMR-SFHVURJKSA-N 0 3 412.603 4.134 20 0 HIADHN Cc1ccc(CN2CCSCC2)cc1NC(=O)[C@H]1CCc2nc(C(C)C)[nH]c2C1 ZINC000475466986 890375652 /nfs/dbraw/zinc/37/56/52/890375652.db2.gz SJDXXHWKASRKMR-SFHVURJKSA-N 0 3 412.603 4.134 20 0 HIADHN Cc1nc(CC2CC2)oc1C(=O)N(CCN(C)C)Cc1ccc(C(F)(F)F)cc1 ZINC000475505581 890419825 /nfs/dbraw/zinc/41/98/25/890419825.db2.gz VMAKUWMTTCPCIP-UHFFFAOYSA-N 0 3 409.452 4.158 20 0 HIADHN CN(C(=O)c1ccc(OCc2ccccn2)cc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475542972 890466408 /nfs/dbraw/zinc/46/64/08/890466408.db2.gz BGGUXYDDUIIDKK-QHCPKHFHSA-N 0 3 401.510 4.007 20 0 HIADHN CN(C(=O)c1c[nH]c2ccc(Br)cc12)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475544531 890468020 /nfs/dbraw/zinc/46/80/20/890468020.db2.gz GQPUMXATSJZWFY-KRWDZBQOSA-N 0 3 412.331 4.277 20 0 HIADHN COc1ccc(CN(CCc2ccccn2)Cc2ccccc2N2CCOCC2)cc1 ZINC000475556534 890484204 /nfs/dbraw/zinc/48/42/04/890484204.db2.gz VTMOODGISAXLBI-UHFFFAOYSA-N 0 3 417.553 4.172 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)Nc2ccccc2N2CCc3ccccc32)CC1 ZINC000475611309 890539985 /nfs/dbraw/zinc/53/99/85/890539985.db2.gz ZNPQOGIYWOYVPL-UHFFFAOYSA-N 0 3 422.573 4.392 20 0 HIADHN CCc1nnc(-c2ccc(NC(=O)N[C@@H](CN3CCCC3)c3ccccc3)cc2)o1 ZINC000475684790 890625265 /nfs/dbraw/zinc/62/52/65/890625265.db2.gz LHTQWWVIKBMCTN-FQEVSTJZSA-N 0 3 405.502 4.258 20 0 HIADHN CCc1nnc(-c2ccc(NC(=O)N(C)[C@@H]3CCCN(Cc4ccccc4)C3)cc2)o1 ZINC000475683425 890625410 /nfs/dbraw/zinc/62/54/10/890625410.db2.gz CKRKJEJUJPZVIU-OAQYLSRUSA-N 0 3 419.529 4.427 20 0 HIADHN C[C@@H]1C[C@H](C)[C@H](C)N(CC(=O)N(Cc2nnc(-c3ccccc3Cl)o2)C2CC2)C1 ZINC000475732794 890672473 /nfs/dbraw/zinc/67/24/73/890672473.db2.gz RNNXOBWUCHGMIZ-PMPSAXMXSA-N 0 3 416.953 4.247 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2cccc3c2CN(CC(F)(F)F)C3)[C@H]1c1ccccc1 ZINC000504768769 913500006 /nfs/dbraw/zinc/50/00/06/913500006.db2.gz AXMSIQBDURCPBX-VQTJNVASSA-N 0 3 418.463 4.131 20 0 HIADHN CC[C@H](NC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1CO)c1ccc(Cl)s1 ZINC000476026708 890958734 /nfs/dbraw/zinc/95/87/34/890958734.db2.gz CGPQOXWIVCBMJY-SQNIBIBYSA-N 0 3 421.994 4.035 20 0 HIADHN O=C(N[C@H]1CCc2ccccc2C1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000504792799 913517150 /nfs/dbraw/zinc/51/71/50/913517150.db2.gz IFKIIZGJBOXJDD-RBBKRZOGSA-N 0 3 402.460 4.115 20 0 HIADHN COCCN1CCC[C@@H]1CNC(=O)N[C@@H](C)c1ccc(Oc2ccccc2)c(F)c1 ZINC000476178972 891109929 /nfs/dbraw/zinc/10/99/29/891109929.db2.gz XQTNUDMHAOQSQL-PKOBYXMFSA-N 0 3 415.509 4.089 20 0 HIADHN CC(C)([C@H](NC(=O)Cn1cnc2ccccc21)c1ccc(F)c(F)c1)N1CCCC1 ZINC000476187087 891119832 /nfs/dbraw/zinc/11/98/32/891119832.db2.gz FJNRWMBVTPJKIM-JOCHJYFZSA-N 0 3 412.484 4.046 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)c2ccc3nc(-c4ccccc4)oc3c2)CC1 ZINC000476251970 891175599 /nfs/dbraw/zinc/17/55/99/891175599.db2.gz JLUCTKBBLFUTBC-UHFFFAOYSA-N 0 3 407.514 4.114 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)NCc2ccc(Br)s2)N(C)C)cc1 ZINC000504812849 913531621 /nfs/dbraw/zinc/53/16/21/913531621.db2.gz QIHGSRIZENLVJJ-MRXNPFEDSA-N 0 3 410.381 4.175 20 0 HIADHN COc1cc(CN(C)C[C@H](O)CO[C@H]2CCCc3ccccc32)ccc1SC ZINC000476294661 891207766 /nfs/dbraw/zinc/20/77/66/891207766.db2.gz HUESNTUSKZUYAB-FPOVZHCZSA-N 0 3 401.572 4.304 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)c2cn(C)nc2-c2ccc(Cl)s2)CN1Cc1ccccc1 ZINC000476305004 891217473 /nfs/dbraw/zinc/21/74/73/891217473.db2.gz XDQYMPQJTJBRTR-GOEBONIOSA-N 0 3 414.962 4.195 20 0 HIADHN COc1ccc(C(=O)CCCCCC(=O)N[C@H]2CN(C)C[C@H]2c2ccccc2)cc1 ZINC000476333166 891236965 /nfs/dbraw/zinc/23/69/65/891236965.db2.gz HMFCKRLAMQAWPP-GOTSBHOMSA-N 0 3 408.542 4.042 20 0 HIADHN O=C(Nc1c(F)cc(F)cc1Br)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000476365173 891272576 /nfs/dbraw/zinc/27/25/76/891272576.db2.gz NOPWVVDLHCQRBT-CQSZACIVSA-N 0 3 410.262 4.123 20 0 HIADHN COCCN1CCC[C@@H]1CNC(=O)N[C@@H](c1cccs1)c1ccc(C(C)C)cc1 ZINC000476414710 891327247 /nfs/dbraw/zinc/32/72/47/891327247.db2.gz YPYKFPCPGKLIRT-IFMALSPDSA-N 0 3 415.603 4.371 20 0 HIADHN O=C(Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)c1coc2cc(F)ccc12 ZINC000476424997 891336289 /nfs/dbraw/zinc/33/62/89/891336289.db2.gz AQXCVBCHNHHHSM-SFHVURJKSA-N 0 3 404.445 4.468 20 0 HIADHN CC[C@H]1CN(C(=O)NC2CCN(CCOC(C)C)CC2)CC[C@@H]1c1ccccc1 ZINC000476446570 891358483 /nfs/dbraw/zinc/35/84/83/891358483.db2.gz IQFMUFBMGSAJRI-REWPJTCUSA-N 0 3 401.595 4.101 20 0 HIADHN CCCc1ccc([C@H](NC(=O)NC[C@@H]2CCCN2CCOC)c2cccs2)cc1 ZINC000476495713 891407370 /nfs/dbraw/zinc/40/73/70/891407370.db2.gz YWTPXCOSWWNGLW-UNMCSNQZSA-N 0 3 415.603 4.200 20 0 HIADHN CN(C(=O)NC[C@@H]1CC2c3ccccc3C1c1ccccc12)[C@@H]1CCN(C2CC2)C1 ZINC000476680298 891630930 /nfs/dbraw/zinc/63/09/30/891630930.db2.gz ADBYCCNQJPLWPR-MJDSCDBUSA-N 0 3 401.554 4.162 20 0 HIADHN CCc1onc(-c2ccc(Br)cc2)c1C(=O)N[C@@H]1CCCN(C(C)C)C1 ZINC000476695791 891651493 /nfs/dbraw/zinc/65/14/93/891651493.db2.gz VNLFRGMJSHAQRC-MRXNPFEDSA-N 0 3 420.351 4.269 20 0 HIADHN CC(C)c1nc2c([nH]1)C[C@@H](C(=O)NC[C@H](c1cccc(C(F)(F)F)c1)N(C)C)CC2 ZINC000476725686 891689968 /nfs/dbraw/zinc/68/99/68/891689968.db2.gz MJGBOVJTBGAWHO-HNAYVOBHSA-N 0 3 422.495 4.076 20 0 HIADHN CC(C)c1nc2c([nH]1)CC[C@H](C(=O)NC[C@H](c1cccc(C(F)(F)F)c1)N(C)C)C2 ZINC000476725686 891689982 /nfs/dbraw/zinc/68/99/82/891689982.db2.gz MJGBOVJTBGAWHO-HNAYVOBHSA-N 0 3 422.495 4.076 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N(CCCO)[C@@H]2CCCc3ccccc32)C1 ZINC000476830697 891812471 /nfs/dbraw/zinc/81/24/71/891812471.db2.gz PKBWEQPQJPTQDF-QFZRFWILSA-N 0 3 421.585 4.294 20 0 HIADHN CCN(CC)CCN(CC(C)C)C(=O)c1cn(CC)c2ccc(Cl)cc2c1=O ZINC000476842865 891817396 /nfs/dbraw/zinc/81/73/96/891817396.db2.gz LLHLLNLYYDFYOB-UHFFFAOYSA-N 0 3 405.970 4.115 20 0 HIADHN CCCCc1oc2ccccc2c1CN(C)C(=O)NC[C@H]1CCCN1CCOC ZINC000477088124 892021827 /nfs/dbraw/zinc/02/18/27/892021827.db2.gz JOXUBYIZQJYLAX-GOSISDBHSA-N 0 3 401.551 4.028 20 0 HIADHN COCCN1CCC[C@@H]1CNC(=O)N(Cc1ccccc1)[C@H](C)c1cccs1 ZINC000477106117 892038117 /nfs/dbraw/zinc/03/81/17/892038117.db2.gz HRCYUMCUOPCKAE-UYAOXDASSA-N 0 3 401.576 4.132 20 0 HIADHN COCCN1CCC[C@H]1CNC(=O)Nc1ccc(Cc2nc3ccccc3s2)cc1 ZINC000477130579 892060185 /nfs/dbraw/zinc/06/01/85/892060185.db2.gz AERWTOVWBZAWAY-IBGZPJMESA-N 0 3 424.570 4.119 20 0 HIADHN COc1cc(OC)c(NC(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)cc1F ZINC000477193612 892119061 /nfs/dbraw/zinc/11/90/61/892119061.db2.gz WUUVMWUQZWIGCK-IBGZPJMESA-N 0 3 419.497 4.055 20 0 HIADHN O=C(CCCc1nc(-c2ccc(F)cc2)no1)N[C@H](CN1CCCC1)c1ccccc1 ZINC000477436574 892388742 /nfs/dbraw/zinc/38/87/42/892388742.db2.gz MLGCGFLKTFLUJF-OAQYLSRUSA-N 0 3 422.504 4.152 20 0 HIADHN CN(Cc1ccccc1N1CCCC1)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000504923300 913660484 /nfs/dbraw/zinc/66/04/84/913660484.db2.gz GJQCYCFDPCRARR-QHCPKHFHSA-N 0 3 406.574 4.093 20 0 HIADHN O[C@H](COc1cccc(C(F)(F)F)c1)CN1CCC[C@H]1c1ccc2c(c1)OCO2 ZINC000477458622 892423288 /nfs/dbraw/zinc/42/32/88/892423288.db2.gz LKFILFPDMAWICL-WMZOPIPTSA-N 0 3 409.404 4.011 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cccc(OC(F)(F)F)c3)c(C)c2)CC1 ZINC000477495578 892497419 /nfs/dbraw/zinc/49/74/19/892497419.db2.gz VWNXHMIWQOGMOQ-UHFFFAOYSA-N 0 3 407.436 4.288 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)Nc1ccc(OC(F)F)c(Cl)c1 ZINC000504959470 913698381 /nfs/dbraw/zinc/69/83/81/913698381.db2.gz LVXDYEIFXVWHIR-UHFFFAOYSA-N 0 3 419.925 4.425 20 0 HIADHN CC(C)n1ncc2c1C[C@@H](N[C@H](C)c1ccccc1I)CC2 ZINC000477686658 892809660 /nfs/dbraw/zinc/80/96/60/892809660.db2.gz AQFAJLBUOLXVBB-HIFRSBDPSA-N 0 3 409.315 4.277 20 0 HIADHN C[C@@H](NC(=O)NCC1(N2CCSCC2)CCCC1)c1cccc(C(F)(F)F)c1 ZINC000504965523 913701980 /nfs/dbraw/zinc/70/19/80/913701980.db2.gz NQHFAOCJZRLRPY-OAHLLOKOSA-N 0 3 415.525 4.427 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1cccn1Cc1cccs1 ZINC000477711283 892822282 /nfs/dbraw/zinc/82/22/82/892822282.db2.gz IWDROZOGEZBSPG-UHFFFAOYSA-N 0 3 409.555 4.055 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(CN3CCC(CO)CC3)c2)c2ccccc12 ZINC000477717598 892824333 /nfs/dbraw/zinc/82/43/33/892824333.db2.gz KIYQACUVWNISNJ-UHFFFAOYSA-N 0 3 404.510 4.305 20 0 HIADHN C[C@@H](CSc1ccc(F)cc1)C(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000477718131 892824879 /nfs/dbraw/zinc/82/48/79/892824879.db2.gz XNVCQDPWMBUVSH-KRWDZBQOSA-N 0 3 416.562 4.397 20 0 HIADHN CCc1ccc([C@H](C)NC(=O)[C@H](C)N2CC[C@@H](CN(CC)CC(F)(F)F)C2)cc1 ZINC000477729574 892830533 /nfs/dbraw/zinc/83/05/33/892830533.db2.gz YZWPKOZOEMGZRB-LNLFQRSKSA-N 0 3 413.528 4.021 20 0 HIADHN C[C@@H]1C[C@@H]1c1ccc([C@@H]2C[C@H]2C(=O)Nc2cccc(CN3CCC(CO)CC3)c2)o1 ZINC000477735807 892833694 /nfs/dbraw/zinc/83/36/94/892833694.db2.gz BIMAAEKRKXHHPO-IDZYALCFSA-N 0 3 408.542 4.350 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCC[C@@H]1c1ccc2c(c1)OCO2)c1ccsc1 ZINC000477744965 892839826 /nfs/dbraw/zinc/83/98/26/892839826.db2.gz CWWVBRXJXZNHAL-RTBURBONSA-N 0 3 415.559 4.406 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N2CCC[C@H]2c2ccc3c(c2)OCO3)C1 ZINC000477746110 892840592 /nfs/dbraw/zinc/84/05/92/892840592.db2.gz FMAJCEVQVRIBTH-QMMLZNLJSA-N 0 3 407.514 4.097 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)[C@@H]1C[C@]12CCCc1ccccc12 ZINC000477751901 892843973 /nfs/dbraw/zinc/84/39/73/892843973.db2.gz UICIKTBIHQJNHC-AHWVRZQESA-N 0 3 404.554 4.124 20 0 HIADHN CC(C)c1nc(C(=O)NC2CCN(C3CC3)CC2)nn1-c1c(Cl)cccc1Cl ZINC000504966527 913705471 /nfs/dbraw/zinc/70/54/71/913705471.db2.gz BBVRKQGQDGGWGL-UHFFFAOYSA-N 0 3 422.360 4.054 20 0 HIADHN CN(C(=O)NCc1ccc(-c2ccc3c(c2)CCCO3)cc1)[C@H]1CCN(C2CC2)C1 ZINC000477769544 892856509 /nfs/dbraw/zinc/85/65/09/892856509.db2.gz ZRWMNDDSMJTBQR-QHCPKHFHSA-N 0 3 405.542 4.057 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCc1nc(C(C)C)cs1)c1cccc(OC)c1 ZINC000477819870 892887456 /nfs/dbraw/zinc/88/74/56/892887456.db2.gz JTRDQKSXLUGAAN-LJQANCHMSA-N 0 3 404.580 4.157 20 0 HIADHN O=C(NCc1sccc1Br)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000477823573 892889617 /nfs/dbraw/zinc/88/96/17/892889617.db2.gz UJLQNCXYGQSZRA-CQSZACIVSA-N 0 3 411.340 4.178 20 0 HIADHN Cc1ccc([C@H](NC[C@@](C)(O)C2CCCCC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000477844237 892903280 /nfs/dbraw/zinc/90/32/80/892903280.db2.gz CJLPTCJEWMMLGR-BJKOFHAPSA-N 0 3 415.599 4.409 20 0 HIADHN COC(=O)c1csc(-c2cccc(CN[C@@H](C)c3cnc4cc(C)nn4c3C)c2)n1 ZINC000477868665 892927840 /nfs/dbraw/zinc/92/78/40/892927840.db2.gz VRPVBXGCAKGATQ-AWEZNQCLSA-N 0 3 421.526 4.107 20 0 HIADHN CCOc1ccc([C@@H](CC)N[C@@H]2CCN(Cc3ccc(F)cc3)C2=O)cc1OCC ZINC000477925446 893014422 /nfs/dbraw/zinc/01/44/22/893014422.db2.gz IQVIWLVBEGWHRW-NHCUHLMSSA-N 0 3 414.521 4.465 20 0 HIADHN C[C@@H](NCc1ccc(S(=O)(=O)CCO)cc1)c1ccc(-c2ccccc2)s1 ZINC000477927605 893015972 /nfs/dbraw/zinc/01/59/72/893015972.db2.gz KYVJERZQTOJCON-MRXNPFEDSA-N 0 3 401.553 4.032 20 0 HIADHN Cc1cc([C@H](NC[C@H](CO)Cc2ccc(F)c(F)c2)c2cccnc2)ccc1F ZINC000477931255 893019073 /nfs/dbraw/zinc/01/90/73/893019073.db2.gz MOSVRMFTCSVXRX-HXOBKFHXSA-N 0 3 400.444 4.338 20 0 HIADHN CN(C)[C@H](CNC(=O)Nc1ccc(OCC(F)(F)F)c(F)c1)Cc1ccccc1 ZINC000504982913 913725543 /nfs/dbraw/zinc/72/55/43/913725543.db2.gz LFTGEJCPARLTMK-INIZCTEOSA-N 0 3 413.415 4.061 20 0 HIADHN Cc1coc(-c2cc(NC(=O)NCC3(N4CCSCC4)CCCC3)ccc2C)n1 ZINC000477962008 893051779 /nfs/dbraw/zinc/05/17/79/893051779.db2.gz DVPZVVACRNSVCW-UHFFFAOYSA-N 0 3 414.575 4.442 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)NCCCCCOC2CCCCC2)CC1 ZINC000477995123 893095614 /nfs/dbraw/zinc/09/56/14/893095614.db2.gz LDQYPNRJTKFGJX-UHFFFAOYSA-N 0 3 405.583 4.405 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)c2cccnc2OCc2ccccc2F)CC1 ZINC000478056175 893211181 /nfs/dbraw/zinc/21/11/81/893211181.db2.gz XOHGDHKSRWHLIC-UHFFFAOYSA-N 0 3 423.488 4.129 20 0 HIADHN CCCN(C(=O)c1ccc2c(c1)CCC(=O)N2)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000505000571 913745692 /nfs/dbraw/zinc/74/56/92/913745692.db2.gz HADZBBMXIWIVHZ-QFIPXVFZSA-N 0 3 405.542 4.088 20 0 HIADHN CCN1CCN(Cc2ccc(CNC(=O)C(C)(C)c3ccccc3Cl)cc2)CC1 ZINC000505007487 913751324 /nfs/dbraw/zinc/75/13/24/913751324.db2.gz UBDYDHSNABFMKT-UHFFFAOYSA-N 0 3 413.993 4.072 20 0 HIADHN CC(C)c1nn(-c2ccc(Br)cc2)cc1CNCCOCC(F)(F)F ZINC000478251608 893425478 /nfs/dbraw/zinc/42/54/78/893425478.db2.gz NRKFWGMPKWMQFK-UHFFFAOYSA-N 0 3 420.273 4.427 20 0 HIADHN Cn1c(CNC2CCN(c3ccc(C(F)(F)F)cn3)CC2)nc2ccc(Cl)cc21 ZINC000478318891 893547273 /nfs/dbraw/zinc/54/72/73/893547273.db2.gz VCCJTRXWMBEHAK-UHFFFAOYSA-N 0 3 423.870 4.399 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N[C@@H](c3nccs3)c3ccccc3)cc2)CC1 ZINC000505042417 913781673 /nfs/dbraw/zinc/78/16/73/913781673.db2.gz SOUBVAFNICPCRD-JOCHJYFZSA-N 0 3 420.582 4.193 20 0 HIADHN Cc1ccc(-c2noc(CCCN[C@@H](c3cnn(C)c3)c3ccc(F)cc3)n2)cc1F ZINC000478336058 893572280 /nfs/dbraw/zinc/57/22/80/893572280.db2.gz XPQWWLTWDBJRSW-JOCHJYFZSA-N 0 3 423.467 4.369 20 0 HIADHN CN(CCCN1CCN(C)CC1)C(=O)N[C@H]1CCCCC[C@@H]1c1ccc(Cl)cc1 ZINC000505045141 913786669 /nfs/dbraw/zinc/78/66/69/913786669.db2.gz UIPUEXNLJHUYOA-YADHBBJMSA-N 0 3 421.029 4.035 20 0 HIADHN Cn1ccc(CNC(=O)N(CCN2CCCC2)Cc2ccc(Cl)c(Cl)c2)c1 ZINC000478390138 893668407 /nfs/dbraw/zinc/66/84/07/893668407.db2.gz IKUONVCPWVGSAW-UHFFFAOYSA-N 0 3 409.361 4.140 20 0 HIADHN CN(Cc1nc(-c2ccccc2)c[nH]1)C(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000478508827 893819556 /nfs/dbraw/zinc/81/95/56/893819556.db2.gz RNHWSMRAMYDUAP-FQEVSTJZSA-N 0 3 406.505 4.086 20 0 HIADHN Cc1coc(-c2cc(NC(=O)CCN3CCN(c4cccc(C)c4)CC3)ccc2C)n1 ZINC000478516302 893824134 /nfs/dbraw/zinc/82/41/34/893824134.db2.gz IXRDLGAOZPWCSF-UHFFFAOYSA-N 0 3 418.541 4.418 20 0 HIADHN COc1ccc(-c2nc(C)c(C(=O)NC[C@H](C)N3CCCC[C@H]3C)s2)cc1OC ZINC000478567012 893852477 /nfs/dbraw/zinc/85/24/77/893852477.db2.gz RFDUPIZONNIHMQ-CABCVRRESA-N 0 3 417.575 4.128 20 0 HIADHN COC(=O)c1ccc(OCc2ccccc2)c(NC(=O)c2cccc(CN(C)C)c2)c1 ZINC000478606950 893871583 /nfs/dbraw/zinc/87/15/83/893871583.db2.gz GJPOUZNZCAMETP-UHFFFAOYSA-N 0 3 418.493 4.366 20 0 HIADHN CCO[C@H]1C[C@H](N(C)C(=O)Nc2ccc(CCN3CCSCC3)cc2)C12CCC2 ZINC000478668745 893916608 /nfs/dbraw/zinc/91/66/08/893916608.db2.gz VYCPUIGEAIVYJE-SFTDATJTSA-N 0 3 417.619 4.089 20 0 HIADHN COc1ccc([C@@H](C)N(C)C(=O)[C@H]2CN(Cc3ccccc3)CCC2(F)F)cc1 ZINC000505120453 913827611 /nfs/dbraw/zinc/82/76/11/913827611.db2.gz OUKGINHMXOJJRG-DYESRHJHSA-N 0 3 402.485 4.372 20 0 HIADHN Cc1c(Br)cccc1CC(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000478749499 894024398 /nfs/dbraw/zinc/02/43/98/894024398.db2.gz WEOQROJMWFCBNI-QGZVFWFLSA-N 0 3 407.377 4.315 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)[C@@H](C)Cn3ccc4ccccc43)c(C)c2)CC1 ZINC000505121873 913828675 /nfs/dbraw/zinc/82/86/75/913828675.db2.gz ZJHFOMLMKQFCRM-FQEVSTJZSA-N 0 3 404.558 4.366 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2cc(Br)ccc2C)c1 ZINC000478788712 894065370 /nfs/dbraw/zinc/06/53/70/894065370.db2.gz PFYLLIAQRUSGLT-UHFFFAOYSA-N 0 3 420.351 4.362 20 0 HIADHN Cc1nc(-c2ccc(F)c(F)c2)sc1C(=O)NCCCCN1C[C@@H](C)O[C@H](C)C1 ZINC000478878316 894155622 /nfs/dbraw/zinc/15/56/22/894155622.db2.gz ZCHPULWSNJLLRO-ZIAGYGMSSA-N 0 3 423.529 4.016 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2ncc(-c3ccccc3)s2)c1 ZINC000478974416 894252254 /nfs/dbraw/zinc/25/22/54/894252254.db2.gz CBAZZCZZTNVTTR-UHFFFAOYSA-N 0 3 410.543 4.414 20 0 HIADHN CCS[C@@H]1CCC[C@H](N[C@H](C)c2cc(S(N)(=O)=O)c(Cl)cc2Cl)C1 ZINC000479058974 894318833 /nfs/dbraw/zinc/31/88/33/894318833.db2.gz KWYNZFPBNXTBML-GRYCIOLGSA-N 0 3 411.420 4.356 20 0 HIADHN C[C@H](CCc1ccc(O)cc1)N[C@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479058169 894318874 /nfs/dbraw/zinc/31/88/74/894318874.db2.gz JUKMQZZDPUHJFV-VXGBXAGGSA-N 0 3 417.358 4.018 20 0 HIADHN COc1cc2c(cc1OC)[C@H](NCc1cc(Br)c3c(c1)OCCO3)CC2 ZINC000479071252 894335076 /nfs/dbraw/zinc/33/50/76/894335076.db2.gz RQRHUJZLQIHWNF-MRXNPFEDSA-N 0 3 420.303 4.015 20 0 HIADHN CS(=O)(=O)Cc1ccccc1CN[C@@H]1CCCc2cc(Br)ccc21 ZINC000479074723 894340837 /nfs/dbraw/zinc/34/08/37/894340837.db2.gz AGIMQPOEEUQSIU-LJQANCHMSA-N 0 3 408.361 4.161 20 0 HIADHN C[C@H](NCC(C)(C)c1cccs1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479076475 894341866 /nfs/dbraw/zinc/34/18/66/894341866.db2.gz FCDIMKPUWAQEAU-JTQLQIEISA-N 0 3 407.388 4.331 20 0 HIADHN Cc1ccc(C[C@@H](C)N[C@H](C)c2cc(S(N)(=O)=O)c(Cl)cc2Cl)s1 ZINC000479078962 894343974 /nfs/dbraw/zinc/34/39/74/894343974.db2.gz OWGKFIXVIKGCTH-MWLCHTKSSA-N 0 3 407.388 4.293 20 0 HIADHN Cc1cc(C)c(S(N)(=O)=O)cc1[C@H](C)N[C@@H](C)c1ccc(-c2ccncc2)cc1 ZINC000479079493 894344915 /nfs/dbraw/zinc/34/49/15/894344915.db2.gz QCQIUJUTHVVSOJ-ROUUACIJSA-N 0 3 409.555 4.425 20 0 HIADHN CNS(=O)(=O)c1cccc([C@@H](C)N[C@@H]2CCCc3cc(Br)ccc32)c1 ZINC000479081585 894347052 /nfs/dbraw/zinc/34/70/52/894347052.db2.gz RGFQPNLQNYYHOP-BFUOFWGJSA-N 0 3 423.376 4.085 20 0 HIADHN C[C@@H](NC(=O)Nc1cccc2c1CN(c1nccs1)C2)[C@@H](c1ccccc1)N(C)C ZINC000479082261 894347742 /nfs/dbraw/zinc/34/77/42/894347742.db2.gz ASMSWDJUWMCICP-IERDGZPVSA-N 0 3 421.570 4.476 20 0 HIADHN Cc1c2ccccc2oc1[C@@H](C)NC(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000479232657 894495000 /nfs/dbraw/zinc/49/50/00/894495000.db2.gz VKNNGDNNOPXUCF-ZHALLVOQSA-N 0 3 413.562 4.333 20 0 HIADHN CCOc1cc(Br)ccc1NC(=O)N(CCN(C)C)Cc1ccco1 ZINC000479285924 894564774 /nfs/dbraw/zinc/56/47/74/894564774.db2.gz QPIWOKFJUVFHEQ-UHFFFAOYSA-N 0 3 410.312 4.037 20 0 HIADHN C[C@H](NCCc1cccc2cccnc21)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479348250 894643259 /nfs/dbraw/zinc/64/32/59/894643259.db2.gz JINCIOQUPWSDCX-LBPRGKRZSA-N 0 3 424.353 4.082 20 0 HIADHN CCS(=O)(=O)c1ccc(CN[C@@H]2CCCc3cc(Br)ccc32)cc1 ZINC000479427054 894739970 /nfs/dbraw/zinc/73/99/70/894739970.db2.gz WTGXJVUONZPZJH-LJQANCHMSA-N 0 3 408.361 4.410 20 0 HIADHN C[C@@H]1CCc2ccc(Br)cc2[C@@H](NC[C@@H]2CCCCS2(=O)=O)C1 ZINC000479441383 894756595 /nfs/dbraw/zinc/75/65/95/894756595.db2.gz UDDJITUKAKBXRB-SKDZVZGDSA-N 0 3 400.382 4.020 20 0 HIADHN CCN(CC)[C@H](C)CN[C@H](c1cccc(S(C)(=O)=O)c1)c1ccc(C)cc1C ZINC000479482627 894805610 /nfs/dbraw/zinc/80/56/10/894805610.db2.gz ZBVOLAANUJOTPP-AUSIDOKSSA-N 0 3 402.604 4.116 20 0 HIADHN Cc1ccc([C@H](CNC(=O)NCc2ncoc2-c2ccccc2)N2CCCC2)cc1 ZINC000479494360 894814455 /nfs/dbraw/zinc/81/44/55/894814455.db2.gz GKKAKGDYCSVFMK-QFIPXVFZSA-N 0 3 404.514 4.286 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N(C)Cc2nc(-c3ccccc3)c[nH]2)N2CCCC2)cc1 ZINC000479499189 894816668 /nfs/dbraw/zinc/81/66/68/894816668.db2.gz SYPOHUYGVCJHPC-HSZRJFAPSA-N 0 3 417.557 4.364 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(-c2ccc(C(F)(F)F)cc2)s1)C(=O)N1CCNC1=O ZINC000479502100 894818360 /nfs/dbraw/zinc/81/83/60/894818360.db2.gz MIQJTBUJPXQUQO-RYUDHWBXSA-N 0 3 411.449 4.025 20 0 HIADHN CCc1nc2c(s1)[C@H](N(C)C(=O)NC[C@H](c1ccc(C)cc1)N(C)C)CCC2 ZINC000479510395 894824746 /nfs/dbraw/zinc/82/47/46/894824746.db2.gz DTVLYNFSDJAVMU-RTBURBONSA-N 0 3 400.592 4.336 20 0 HIADHN O=C1Nc2ccccc2C12CCC(N[C@@H](CO)c1ccccc1OC(F)(F)F)CC2 ZINC000479542720 894845612 /nfs/dbraw/zinc/84/56/12/894845612.db2.gz KBVHKSGWMMBSIC-UARVQCNDSA-N 0 3 420.431 4.041 20 0 HIADHN CCc1nc2c(s1)[C@H](N(C)C(=O)NC[C@@H]1CCCN1Cc1ccccc1)CCC2 ZINC000479547169 894847772 /nfs/dbraw/zinc/84/77/72/894847772.db2.gz XWALPSCPQKXOSF-AZUAARDMSA-N 0 3 412.603 4.389 20 0 HIADHN COc1cc(NC(=O)Nc2cc(C)cc(N3CCN(C(C)C)CC3)c2)cc(OC)c1 ZINC000479564211 894860901 /nfs/dbraw/zinc/86/09/01/894860901.db2.gz FDTQGHGTDPVENC-UHFFFAOYSA-N 0 3 412.534 4.187 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)NCc1csc(-c2ccco2)n1 ZINC000479583251 894871997 /nfs/dbraw/zinc/87/19/97/894871997.db2.gz FKQVKELSUMGSND-QGZVFWFLSA-N 0 3 410.543 4.209 20 0 HIADHN C[C@H](OC[C@@H](O)CN1CCC[C@@H]1c1ccc2c(c1)OCO2)c1ccc(Cl)cc1 ZINC000479617292 894887881 /nfs/dbraw/zinc/88/78/81/894887881.db2.gz LOKIJIUPVNAQDT-RYGJVYDSSA-N 0 3 403.906 4.344 20 0 HIADHN Cc1nnc(-c2ccccc2C(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)o1 ZINC000479641143 894910838 /nfs/dbraw/zinc/91/08/38/894910838.db2.gz OTXUPWQICJRZEL-LJQANCHMSA-N 0 3 410.543 4.310 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3ccc(Br)cc3)CC2)C[C@@H](C)O1 ZINC000479685069 894970475 /nfs/dbraw/zinc/97/04/75/894970475.db2.gz KYCSACPVRWFNSP-HZPDHXFCSA-N 0 3 424.383 4.192 20 0 HIADHN CCc1nc2c(s1)[C@H](N(C)C(=O)N[C@@H]1C[C@@H](C)N(Cc3ccccc3)C1)CCC2 ZINC000479734015 895032283 /nfs/dbraw/zinc/03/22/83/895032283.db2.gz HLEKRPXYHDNIFU-YVWKXTFCSA-N 0 3 412.603 4.387 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)NCc2cc(Cl)sc2Cl)c1 ZINC000479755845 895056047 /nfs/dbraw/zinc/05/60/47/895056047.db2.gz ZELKCXCVJIDOHI-UHFFFAOYSA-N 0 3 416.374 4.337 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)N[C@H](C)c2ccc3ncsc3c2)c1 ZINC000479763450 895065456 /nfs/dbraw/zinc/06/54/56/895065456.db2.gz PHOXIYONXFYUMR-MRXNPFEDSA-N 0 3 412.559 4.139 20 0 HIADHN C[C@H](NC[C@H](c1cccs1)N1CCOCC1)c1ccc(F)cc1OC(F)F ZINC000479850350 895182590 /nfs/dbraw/zinc/18/25/90/895182590.db2.gz HIOFBSKZIFOMSA-XJKSGUPXSA-N 0 3 400.466 4.213 20 0 HIADHN C[C@@H](NC[C@H](c1cccs1)N1CCOCC1)c1cc(Br)ccc1F ZINC000479851197 895184531 /nfs/dbraw/zinc/18/45/31/895184531.db2.gz KMTKOENVLKDITN-CXAGYDPISA-N 0 3 413.356 4.374 20 0 HIADHN C[C@H](NC[C@@H](c1cccs1)N1CCOCC1)c1cc(Br)ccc1F ZINC000479851202 895184876 /nfs/dbraw/zinc/18/48/76/895184876.db2.gz KMTKOENVLKDITN-GUYCJALGSA-N 0 3 413.356 4.374 20 0 HIADHN C[C@@H](NC[C@H](c1ccco1)N1CCCC1)c1ccc(S(=O)(=O)C2CCCC2)cc1 ZINC000479864988 895202765 /nfs/dbraw/zinc/20/27/65/895202765.db2.gz XSEQNKPXWYMPRR-XMSQKQJNSA-N 0 3 416.587 4.484 20 0 HIADHN COc1cccc([C@@H](CN[C@H](C)c2nnn(-c3cccc(Cl)c3)c2C)N(C)C)c1 ZINC000479866445 895205881 /nfs/dbraw/zinc/20/58/81/895205881.db2.gz ZYWNVIWRSIEYSH-QVKFZJNVSA-N 0 3 413.953 4.191 20 0 HIADHN COc1cccc([C@@H](CN[C@@H](C)c2nnn(-c3cccc(Cl)c3)c2C)N(C)C)c1 ZINC000479866452 895206167 /nfs/dbraw/zinc/20/61/67/895206167.db2.gz ZYWNVIWRSIEYSH-YCRPNKLZSA-N 0 3 413.953 4.191 20 0 HIADHN Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)C(=O)N(CCN(C)C)CC1CCCCC1 ZINC000479881748 895224855 /nfs/dbraw/zinc/22/48/55/895224855.db2.gz DMTQFRYHQMHLLZ-HNNXBMFYSA-N 0 3 416.532 4.136 20 0 HIADHN FC(F)(F)Oc1ccc2c(c1)[C@H](NCc1ccccc1CN1CCOCC1)CC2 ZINC000479898041 895245301 /nfs/dbraw/zinc/24/53/01/895245301.db2.gz NZTXOEYVWLTIFX-OAQYLSRUSA-N 0 3 406.448 4.195 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3CCC[C@H](C(F)(F)F)[C@@H]3C)c(C)c2)CC1 ZINC000479966102 895319553 /nfs/dbraw/zinc/31/95/53/895319553.db2.gz QTUSEUHFWXNXJF-WMZOPIPTSA-N 0 3 412.500 4.332 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)[C@H]1C[C@H]1c1cccc2ccccc21 ZINC000479966503 895319817 /nfs/dbraw/zinc/31/98/17/895319817.db2.gz QPKNZCXYFGXHKS-UIOOFZCWSA-N 0 3 414.549 4.216 20 0 HIADHN COc1cccc([C@@H](CN[C@@H](C)c2nnn(-c3ccccc3)c2C)N2CCCC2)c1 ZINC000480082829 895440120 /nfs/dbraw/zinc/44/01/20/895440120.db2.gz GQRZCRHSIOGUOB-FDDCHVKYSA-N 0 3 405.546 4.072 20 0 HIADHN COc1cccc([C@@H](CN[C@H](C)c2nnn(-c3ccccc3)c2C)N2CCCC2)c1 ZINC000480082840 895440285 /nfs/dbraw/zinc/44/02/85/895440285.db2.gz GQRZCRHSIOGUOB-WZONZLPQSA-N 0 3 405.546 4.072 20 0 HIADHN CC1(C)CCC(CN[C@@H]2CCS(=O)(=O)c3ccc(Br)cc32)CC1 ZINC000480173346 895564719 /nfs/dbraw/zinc/56/47/19/895564719.db2.gz VZGSIAZNTSSKLP-MRXNPFEDSA-N 0 3 400.382 4.474 20 0 HIADHN CCc1ccc(CCN[C@@H]2CCS(=O)(=O)c3ccc(Br)cc32)cc1 ZINC000480179751 895573534 /nfs/dbraw/zinc/57/35/34/895573534.db2.gz KOQFSTXIPSJNDA-GOSISDBHSA-N 0 3 408.361 4.062 20 0 HIADHN CCS[C@@H]1CCC[C@H](N[C@@H]2CCS(=O)(=O)c3ccc(Br)cc32)C1 ZINC000480194634 895591042 /nfs/dbraw/zinc/59/10/42/895591042.db2.gz AVIQLOVKUJICAD-SQWLQELKSA-N 0 3 418.422 4.322 20 0 HIADHN CC[C@@H](CN[C@@H]1CCS(=O)(=O)c2ccc(Br)cc21)c1ccccc1 ZINC000480195876 895593006 /nfs/dbraw/zinc/59/30/06/895593006.db2.gz ONGZZXUJHIPCCR-KBXCAEBGSA-N 0 3 408.361 4.451 20 0 HIADHN CC(C)[C@@H]1CCC[C@H](N[C@H]2CCS(=O)(=O)c3ccc(Br)cc32)C1 ZINC000480256395 895665925 /nfs/dbraw/zinc/66/59/25/895665925.db2.gz AQUXUDOEGRGBBT-KMFMINBZSA-N 0 3 400.382 4.472 20 0 HIADHN COc1cc(F)c([C@H](C)NC[C@H](c2ccccc2Cl)N2CCOCC2)cc1OC ZINC000480272217 895680910 /nfs/dbraw/zinc/68/09/10/895680910.db2.gz BGCAFFMPXRVHPY-MGPUTAFESA-N 0 3 422.928 4.220 20 0 HIADHN CN(C)S(=O)(=O)c1ccccc1CN[C@H]1CCCc2c3ccccc3sc21 ZINC000480277120 895682473 /nfs/dbraw/zinc/68/24/73/895682473.db2.gz JGUUUPMNSNHBNL-SFHVURJKSA-N 0 3 400.569 4.319 20 0 HIADHN C[C@H](NCc1ccnc(N2CCCC2)c1)c1ccc(I)cc1 ZINC000480292696 895697907 /nfs/dbraw/zinc/69/79/07/895697907.db2.gz OCWQVKJHFBKXOR-AWEZNQCLSA-N 0 3 407.299 4.137 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)Nc2cc(C(F)(F)F)ccn2)N(C)C)cc1 ZINC000480296789 895703004 /nfs/dbraw/zinc/70/30/04/895703004.db2.gz SXPKFWVQIRGUSO-QGZVFWFLSA-N 0 3 410.440 4.312 20 0 HIADHN O=S1(=O)CC[C@@H](NC[C@@H]2CCCc3ccccc32)c2cc(Br)ccc21 ZINC000480327029 895728779 /nfs/dbraw/zinc/72/87/79/895728779.db2.gz LWJPAFDXVSCGCF-HNAYVOBHSA-N 0 3 420.372 4.377 20 0 HIADHN Cc1ccc(Oc2ccccc2NC(=O)N2CC[C@H](N3CCN(C)CC3)[C@H](C)C2)cc1 ZINC000480384509 895790351 /nfs/dbraw/zinc/79/03/51/895790351.db2.gz ZGBPDXRWXOGBGP-OFNKIYASSA-N 0 3 422.573 4.277 20 0 HIADHN Cc1cccc(Oc2ccccc2NC(=O)N2CC[C@@H](N3CCN(C)CC3)[C@H](C)C2)c1 ZINC000480408383 895809054 /nfs/dbraw/zinc/80/90/54/895809054.db2.gz VIXZZWRZCBEECQ-NFBKMPQASA-N 0 3 422.573 4.277 20 0 HIADHN Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)C(=O)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000480407491 895809327 /nfs/dbraw/zinc/80/93/27/895809327.db2.gz VURNOMLQQWKVMQ-BEFAXECRSA-N 0 3 422.495 4.119 20 0 HIADHN C[C@@H](O)[C@@](C)(CNCc1csc(-c2ccc3c(c2)OCO3)n1)Cc1ccccc1 ZINC000480448640 895837586 /nfs/dbraw/zinc/83/75/86/895837586.db2.gz YHMPCHWPJZAJOZ-WAIKUNEKSA-N 0 3 410.539 4.258 20 0 HIADHN COc1cc([C@@H](C)N[C@@H](CN2CCOCC2)c2ccc(C)cc2)ccc1OC(F)F ZINC000480453667 895841232 /nfs/dbraw/zinc/84/12/32/895841232.db2.gz FDFCKZJUGUESEB-XLIONFOSSA-N 0 3 420.500 4.329 20 0 HIADHN C[C@H](NCc1ccc(N2CCCC2)nc1)c1ccc(I)cc1 ZINC000480541288 895904499 /nfs/dbraw/zinc/90/44/99/895904499.db2.gz PFYFCAIASIDBHG-AWEZNQCLSA-N 0 3 407.299 4.137 20 0 HIADHN FC(F)(F)C1CCN(C2CC(Nc3cc(-c4ccccc4)nc4ncnn43)C2)CC1 ZINC000480555988 895917189 /nfs/dbraw/zinc/91/71/89/895917189.db2.gz OURBKJPECRRFBL-UHFFFAOYSA-N 0 3 416.451 4.009 20 0 HIADHN CCOC(=O)c1cc(NC2CC(N3CCC(C(F)(F)F)CC3)C2)ncc1Cl ZINC000480556086 895917250 /nfs/dbraw/zinc/91/72/50/895917250.db2.gz PYVPTQBMPLKSLE-UHFFFAOYSA-N 0 3 405.848 4.129 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(NC3CC([NH+]4CCC(C(F)(F)F)CC4)C3)nc2)n1 ZINC000480561953 895921911 /nfs/dbraw/zinc/92/19/11/895921911.db2.gz ZPYCIFWWTKJSNK-UHFFFAOYSA-N 0 3 421.467 4.024 20 0 HIADHN FC(F)(F)C1CCN(C2CC(Nc3nc4ccccc4nc3N3CCCC3)C2)CC1 ZINC000480564247 895924724 /nfs/dbraw/zinc/92/47/24/895924724.db2.gz RKPDUVVJTLSYGG-UHFFFAOYSA-N 0 3 419.495 4.447 20 0 HIADHN C[C@H](NCc1ccc(N2CCO[C@H](C)C2)nc1)c1ccc(OCC(F)(F)F)cc1 ZINC000480614620 895980448 /nfs/dbraw/zinc/98/04/48/895980448.db2.gz NQXJFADOCXRLIL-CVEARBPZSA-N 0 3 409.452 4.099 20 0 HIADHN CC(C)Oc1cccc([C@H](C)N[C@H](C)c2cccc(N3CCCS3(=O)=O)c2)c1 ZINC000480620694 895988309 /nfs/dbraw/zinc/98/83/09/895988309.db2.gz ZAOJUXLGQFVAQZ-MSOLQXFVSA-N 0 3 402.560 4.426 20 0 HIADHN CC(C)Sc1ccc([C@@H](C)NCc2ccc(C(=O)N3CCN(C)CC3)cc2)cc1 ZINC000480630814 895998803 /nfs/dbraw/zinc/99/88/03/895998803.db2.gz LSVCCFRXUKDWHX-LJQANCHMSA-N 0 3 411.615 4.426 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)[C@@H](C)c3c(F)cccc3F)CC2)c1 ZINC000480649668 896018273 /nfs/dbraw/zinc/01/82/73/896018273.db2.gz QGQYWACKCRBLKD-IBGZPJMESA-N 0 3 415.528 4.095 20 0 HIADHN CC[C@@H](NCc1ccc(N2CCCS2(=O)=O)c(F)c1)c1ccc(Cl)s1 ZINC000480678121 896041367 /nfs/dbraw/zinc/04/13/67/896041367.db2.gz SDPGDEGFKHGBRC-CQSZACIVSA-N 0 3 402.944 4.321 20 0 HIADHN CCOc1cccc(CN[C@H](C)c2ccc(S(=O)(=O)NCc3ccco3)cc2)c1 ZINC000480690176 896052688 /nfs/dbraw/zinc/05/26/88/896052688.db2.gz AHKXJDUTCUUOJT-QGZVFWFLSA-N 0 3 414.527 4.008 20 0 HIADHN CC[C@@H](NCc1ccc(N2CCN(CC)CC2)nc1)c1cc(Cl)ccc1OC ZINC000480699367 896060131 /nfs/dbraw/zinc/06/01/31/896060131.db2.gz PKVRJMKEKCGERL-HXUWFJFHSA-N 0 3 402.970 4.126 20 0 HIADHN CC(C)Oc1ccc([C@@H](C)NCc2ccc(N3CCCS3(=O)=O)c(F)c2)cc1 ZINC000480703983 896064922 /nfs/dbraw/zinc/06/49/22/896064922.db2.gz FUICPEIBDRENIN-MRXNPFEDSA-N 0 3 406.523 4.004 20 0 HIADHN C[C@@H](Oc1ccc(Cl)cc1Cl)[C@H](C)NCc1cccc(N2CCOCC2)n1 ZINC000480704128 896067317 /nfs/dbraw/zinc/06/73/17/896067317.db2.gz COJANORULODTMA-LSDHHAIUSA-N 0 3 410.345 4.171 20 0 HIADHN CCCOc1ccc([C@H](C)N[C@@H](C)c2ccc(S(=O)(=O)N(C)C)cc2)cc1OC ZINC000480737267 896097376 /nfs/dbraw/zinc/09/73/76/896097376.db2.gz CSNUGXJZDWIUGZ-IRXDYDNUSA-N 0 3 420.575 4.146 20 0 HIADHN COc1ccc([C@@H](C)N[C@@H](C)c2ccc(NC(=O)NC3CC3)cc2)cc1NC(C)=O ZINC000480739065 896099041 /nfs/dbraw/zinc/09/90/41/896099041.db2.gz RRAJAMWQMXNMTI-LSDHHAIUSA-N 0 3 410.518 4.349 20 0 HIADHN C[C@@H](NCCCCN1C(=O)NC2(CCCC2)C1=O)c1cc(Cl)sc1Cl ZINC000480758264 896120267 /nfs/dbraw/zinc/12/02/67/896120267.db2.gz MODMEVHZCAUANR-LLVKDONJSA-N 0 3 404.363 4.350 20 0 HIADHN CCN1CCN(c2ccc(CN[C@H](c3ccccc3)c3ccc(F)cc3)cn2)CC1 ZINC000480790762 896159439 /nfs/dbraw/zinc/15/94/39/896159439.db2.gz JEIAAVIVIZVYDB-RUZDIDTESA-N 0 3 404.533 4.242 20 0 HIADHN C[C@H](NCc1ccc(OCc2ccccc2F)nc1)c1ccc(-n2cncn2)cc1 ZINC000480884316 896239477 /nfs/dbraw/zinc/23/94/77/896239477.db2.gz XFYBUHGPIHJRGS-KRWDZBQOSA-N 0 3 403.461 4.231 20 0 HIADHN CC[C@H](NCc1cccc(NC(=O)c2ccncc2)c1)c1ccc2c(c1)OCCO2 ZINC000480902106 896256810 /nfs/dbraw/zinc/25/68/10/896256810.db2.gz AXIABNVFTUZEHP-NRFANRHFSA-N 0 3 403.482 4.346 20 0 HIADHN Fc1ccccc1COc1ccc(CN(C[C@@H]2CCCO2)[C@@H]2CCSC2)cn1 ZINC000480902981 896260029 /nfs/dbraw/zinc/26/00/29/896260029.db2.gz VUEQEANCWXSSGM-UXHICEINSA-N 0 3 402.535 4.286 20 0 HIADHN CCN(CC)c1ccc(CN[C@H](C)c2ccc(I)cc2)cn1 ZINC000480905046 896261041 /nfs/dbraw/zinc/26/10/41/896261041.db2.gz GYGGYYSZCYMJAJ-CQSZACIVSA-N 0 3 409.315 4.383 20 0 HIADHN COc1cc(CN[C@@H]2CCCc3nc(-c4ccccc4)sc32)ccc1OCCO ZINC000480913364 896272361 /nfs/dbraw/zinc/27/23/61/896272361.db2.gz XNLBWNUUJZPLII-GOSISDBHSA-N 0 3 410.539 4.357 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)NCc1csc(Br)c1)c1ccco1 ZINC000481092821 896413752 /nfs/dbraw/zinc/41/37/52/896413752.db2.gz NISLSNZVVCNJKD-YPMHNXCESA-N 0 3 400.342 4.032 20 0 HIADHN COCc1c(Br)cccc1NC(=O)c1cccc(CN2CCCC2)c1 ZINC000505404817 914069488 /nfs/dbraw/zinc/06/94/88/914069488.db2.gz JRRPXXFIMHPUCU-UHFFFAOYSA-N 0 3 403.320 4.444 20 0 HIADHN C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1NCc1nc2c3ccccc3oc2c(=O)[n-]1 ZINC000481189561 896538978 /nfs/dbraw/zinc/53/89/78/896538978.db2.gz KHFHDSNLVWYUDL-LPHOPBHVSA-N 0 3 402.498 4.082 20 0 HIADHN C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NCc1nc2c3ccccc3oc2c(=O)[n-]1 ZINC000481189561 896539001 /nfs/dbraw/zinc/53/90/01/896539001.db2.gz KHFHDSNLVWYUDL-LPHOPBHVSA-N 0 3 402.498 4.082 20 0 HIADHN C[C@@H](NCc1cccnc1N1CCN(C)CC1)c1cccc(OCc2ccccc2)c1 ZINC000481239703 896590058 /nfs/dbraw/zinc/59/00/58/896590058.db2.gz GJAJYTSKZMOOSL-OAQYLSRUSA-N 0 3 416.569 4.263 20 0 HIADHN CN1CCN(c2ncccc2CN[C@@H](Cc2cccc(F)c2)c2cccc(F)c2)CC1 ZINC000481246988 896599187 /nfs/dbraw/zinc/59/91/87/896599187.db2.gz PHAMNCIQFXYQKE-DEOSSOPVSA-N 0 3 422.523 4.185 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)NC[C@H]1CCO[C@@H]1c1ccccc1 ZINC000481265201 896614755 /nfs/dbraw/zinc/61/47/55/896614755.db2.gz LNMOVEQEHGRKGL-WXFUMESZSA-N 0 3 409.574 4.220 20 0 HIADHN CC[C@@H](NCc1ccc(S(=O)(=O)N2CCC[C@@H](C)C2)cc1)c1ccc(OC)cc1 ZINC000481301042 896645284 /nfs/dbraw/zinc/64/52/84/896645284.db2.gz XFBIWULRZXJKPI-WZONZLPQSA-N 0 3 416.587 4.357 20 0 HIADHN CC[C@@H](NCc1ccc(S(=O)(=O)N2CCC[C@H](C)C2)cc1)c1ccc(OC)cc1 ZINC000481301039 896645564 /nfs/dbraw/zinc/64/55/64/896645564.db2.gz XFBIWULRZXJKPI-FDDCHVKYSA-N 0 3 416.587 4.357 20 0 HIADHN Cc1c([C@H](C)NC2CCN(Cc3ccc(F)c(F)c3)CC2)nnn1-c1ccccc1 ZINC000481308742 896654503 /nfs/dbraw/zinc/65/45/03/896654503.db2.gz QFTIYOJSQNBZFZ-INIZCTEOSA-N 0 3 411.500 4.169 20 0 HIADHN C[C@@H]1CCCN(S(=O)(=O)c2ccc(CN[C@H]3CCc4cc(F)ccc43)cc2)C1 ZINC000481308232 896654965 /nfs/dbraw/zinc/65/49/65/896654965.db2.gz GBEKUWHHDJKYGK-ZHRRBRCNSA-N 0 3 402.535 4.023 20 0 HIADHN C[C@H](N[C@@H]1CCSc2c(F)cccc21)c1ccc(OCC(=O)NC2CC2)cc1 ZINC000481313712 896662216 /nfs/dbraw/zinc/66/22/16/896662216.db2.gz SUIURCQRWIXYEL-VBKZILBWSA-N 0 3 400.519 4.371 20 0 HIADHN C[C@H](NCc1ccc(N2CCc3ccccc3C2)nc1)c1ccc(-n2cncn2)cc1 ZINC000481317384 896670485 /nfs/dbraw/zinc/67/04/85/896670485.db2.gz IONPQMRMYREPPB-IBGZPJMESA-N 0 3 410.525 4.076 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)N[C@@H](C3CCCC3)C(F)(F)F)CC2)C[C@@H](C)O1 ZINC000481388715 896791509 /nfs/dbraw/zinc/79/15/09/896791509.db2.gz SIKCUYSAOCWGSL-MDZRGWNJSA-N 0 3 419.532 4.028 20 0 HIADHN CCSc1ccccc1[C@H](C)NCc1cccc(OCCN2CCOCC2)c1 ZINC000481404838 896811390 /nfs/dbraw/zinc/81/13/90/896811390.db2.gz ONSMXWHINBPGIS-IBGZPJMESA-N 0 3 400.588 4.360 20 0 HIADHN Cc1nc(C(C)(C)C)sc1[C@@H](C)NCc1cccc(OCCN2CCOCC2)c1 ZINC000481422701 896825546 /nfs/dbraw/zinc/82/55/46/896825546.db2.gz KXMQXWHCYTVKSU-QGZVFWFLSA-N 0 3 417.619 4.311 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)CCc3cc(Cl)cc(Cl)c3)CC2)C[C@H](C)O1 ZINC000481520532 896886465 /nfs/dbraw/zinc/88/64/65/896886465.db2.gz MACFBUVYQPVGIP-HOTGVXAUSA-N 0 3 413.389 4.274 20 0 HIADHN CC(C)NC(=O)Nc1ccc([C@H](C)NCc2cccc(NC(=O)[C@@H]3CCCO3)c2)cc1 ZINC000481535040 896895262 /nfs/dbraw/zinc/89/52/62/896895262.db2.gz PGVRMEKSFYWMOY-JTSKRJEESA-N 0 3 424.545 4.185 20 0 HIADHN CC(C)Oc1ccc([C@H](C)NCc2ccc(S(=O)(=O)N(C)C(C)C)cc2)cc1 ZINC000481543781 896905144 /nfs/dbraw/zinc/90/51/44/896905144.db2.gz LISXHWZPGOKXEK-SFHVURJKSA-N 0 3 404.576 4.354 20 0 HIADHN COc1cc([C@@H](C)NCc2ccc(S(=O)(=O)N(C)C(C)C)cc2)ccc1SC ZINC000481548815 896912659 /nfs/dbraw/zinc/91/26/59/896912659.db2.gz VTJXHGLWAOVGBH-MRXNPFEDSA-N 0 3 422.616 4.297 20 0 HIADHN C[C@H](NC[C@@H](O)COc1cccc(Cl)c1Cl)c1cccc(N2CCCC2=O)c1 ZINC000481551315 896918285 /nfs/dbraw/zinc/91/82/85/896918285.db2.gz GHCVGFAPLAOLNN-WMLDXEAASA-N 0 3 423.340 4.211 20 0 HIADHN COc1cc([C@H](C)NCc2cccc(CN3CCO[C@H](C)C3)c2)ccc1SC ZINC000481553267 896923764 /nfs/dbraw/zinc/92/37/64/896923764.db2.gz RXJASSLCOUEPLO-MSOLQXFVSA-N 0 3 400.588 4.489 20 0 HIADHN CC[C@@H](NC[C@H](O)COc1ccc2c(c1)CCC(=O)N2)c1ccc(Cl)cc1Cl ZINC000481556711 896927430 /nfs/dbraw/zinc/92/74/30/896927430.db2.gz JKHZSQVPEBNINC-HNAYVOBHSA-N 0 3 423.340 4.359 20 0 HIADHN COc1ccc([C@@H](C)NC[C@H](O)COc2cccc(Cl)c2Cl)c(OC)c1 ZINC000481556012 896929092 /nfs/dbraw/zinc/92/90/92/896929092.db2.gz HVHDMAGMHLBMDA-OLZOCXBDSA-N 0 3 400.302 4.101 20 0 HIADHN CC(C)N(C)S(=O)(=O)c1ccc(CN[C@H]2c3cccc(F)c3CC[C@@H]2C)cc1 ZINC000481560855 896935930 /nfs/dbraw/zinc/93/59/30/896935930.db2.gz XQKUFLBFPALSIM-KSFYIVLOSA-N 0 3 404.551 4.268 20 0 HIADHN C[C@@H](NCc1cccc(CN2CCO[C@@H](C)C2)c1)c1ccc(F)cc1OC(F)F ZINC000481561489 896938117 /nfs/dbraw/zinc/93/81/17/896938117.db2.gz ZRNZUEANHYRMNL-JKSUJKDBSA-N 0 3 408.464 4.499 20 0 HIADHN CC[C@@H](NCc1cccc(C(=O)NC[C@H]2CCCO2)c1)c1ccc(OC(F)F)cc1 ZINC000481562044 896938175 /nfs/dbraw/zinc/93/81/75/896938175.db2.gz KZWZJWSKELNUIG-NHCUHLMSSA-N 0 3 418.484 4.438 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)Nc2cc(Cl)cc(C(F)(F)F)c2)CC1 ZINC000481669987 897053666 /nfs/dbraw/zinc/05/36/66/897053666.db2.gz NXMIKXSNJZTVHF-UHFFFAOYSA-N 0 3 407.864 4.370 20 0 HIADHN Cc1ccc2nc(CNC3(c4ccc(Br)cc4)CCCC3)cc(=O)n2c1 ZINC000505462634 914133455 /nfs/dbraw/zinc/13/34/55/914133455.db2.gz SMNKVJZPQMMLAU-UHFFFAOYSA-N 0 3 412.331 4.325 20 0 HIADHN C[C@@H]1CCCN(S(=O)(=O)c2ccc(CN[C@@H](c3cccnc3)C3CCC3)cc2)C1 ZINC000481915637 897299099 /nfs/dbraw/zinc/29/90/99/897299099.db2.gz MSAZHHBFDJFROV-WZONZLPQSA-N 0 3 413.587 4.133 20 0 HIADHN COc1cc(F)c([C@@H](C)N[C@H]2CCN(c3cc(Cl)ccc3OC)C2)cc1OC ZINC000481933757 897317834 /nfs/dbraw/zinc/31/78/34/897317834.db2.gz IJNUKQRVPCEBBJ-HIFRSBDPSA-N 0 3 408.901 4.434 20 0 HIADHN COC(=O)c1ccccc1-c1ccc(CN2CCC(OC[C@H]3CCCCO3)CC2)o1 ZINC000481988344 897385072 /nfs/dbraw/zinc/38/50/72/897385072.db2.gz DYSLOEGUWRIAOD-HXUWFJFHSA-N 0 3 413.514 4.283 20 0 HIADHN CC1(C)CC[C@@H](NCc2ccc(N3CCCS3(=O)=O)c(F)c2)c2ccccc21 ZINC000481997665 897394104 /nfs/dbraw/zinc/39/41/04/897394104.db2.gz GKDIRXNTEPGUFO-HXUWFJFHSA-N 0 3 402.535 4.268 20 0 HIADHN COc1ccc([C@H](C)NCCC(=O)Nc2cccc(Cl)c2C)cc1NC(C)=O ZINC000482023953 897430774 /nfs/dbraw/zinc/43/07/74/897430774.db2.gz COPJOOFFZXNEAQ-AWEZNQCLSA-N 0 3 403.910 4.295 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N3CC[C@H](C(F)(F)F)C(C)(C)C3)cc2)CC1 ZINC000482029992 897440061 /nfs/dbraw/zinc/44/00/61/897440061.db2.gz FAMBIHYCJOYTKD-IBGZPJMESA-N 0 3 411.512 4.268 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)Nc1ccc(Cl)cc1-n1cccn1)c1ccco1 ZINC000482044861 897465813 /nfs/dbraw/zinc/46/58/13/897465813.db2.gz GDCPWMAKXZSTBQ-PBHICJAKSA-N 0 3 401.898 4.370 20 0 HIADHN CCC[C@@H](N[C@@H](C)c1ccc2c(c1)OCO2)C(=O)Nc1cccc(N2CCCC2)c1 ZINC000482047955 897470599 /nfs/dbraw/zinc/47/05/99/897470599.db2.gz WEGXYZQUIHTZHY-LAUBAEHRSA-N 0 3 409.530 4.474 20 0 HIADHN CC(=O)N1CCN(c2ccccc2CN[C@H](C)c2ccc(Br)s2)CC1 ZINC000482047444 897470862 /nfs/dbraw/zinc/47/08/62/897470862.db2.gz VSHCTIBMTWJSKZ-CQSZACIVSA-N 0 3 422.392 4.030 20 0 HIADHN Cc1onc(-c2ccncc2)c1C(=O)Nc1cc(C)cc(N2CCN(C(C)C)CC2)c1 ZINC000482048900 897472985 /nfs/dbraw/zinc/47/29/85/897472985.db2.gz ZNGCAANRAKKIHG-UHFFFAOYSA-N 0 3 419.529 4.136 20 0 HIADHN Cc1nn(Cc2ccc(Cl)cc2)c(C)c1C(=O)NC[C@@H](c1ccccc1)N(C)C ZINC000482086579 897528327 /nfs/dbraw/zinc/52/83/27/897528327.db2.gz BKSQEBATVOQHHU-NRFANRHFSA-N 0 3 410.949 4.234 20 0 HIADHN COc1ccc([C@H](C)N[C@H](C)CC(=O)Nc2cccc(N3CCCC3)c2)c(OC)c1 ZINC000482100166 897545920 /nfs/dbraw/zinc/54/59/20/897545920.db2.gz NSMDKBWFNJHSSZ-MSOLQXFVSA-N 0 3 411.546 4.372 20 0 HIADHN C[C@@H](C(=O)NCCCN1CCN(C)C[C@@H]1c1ccccc1)c1cc2ccccc2o1 ZINC000482101631 897549653 /nfs/dbraw/zinc/54/96/53/897549653.db2.gz HXSWRBCRQXWFNR-DENIHFKCSA-N 0 3 405.542 4.031 20 0 HIADHN COc1cc([C@H](C)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)ccc1OC(F)F ZINC000482124346 897581303 /nfs/dbraw/zinc/58/13/03/897581303.db2.gz ROLVCMSWIWCHFZ-LPHOPBHVSA-N 0 3 418.484 4.181 20 0 HIADHN Cc1cc(NC(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)n(-c2ccccc2C)n1 ZINC000482128331 897585488 /nfs/dbraw/zinc/58/54/88/897585488.db2.gz XYSABBYBTHSARQ-UHFFFAOYSA-N 0 3 417.557 4.272 20 0 HIADHN CCO[C@@H]1C[C@H](N[C@@H](C)C(=O)Nc2c(C)nn(-c3ccccc3)c2C)C1(CC)CC ZINC000482142247 897602271 /nfs/dbraw/zinc/60/22/71/897602271.db2.gz WFFBNFDQLFRDNQ-DZFGPLHGSA-N 0 3 412.578 4.390 20 0 HIADHN C[C@H]1C[C@@H](NCCC(=O)N2CCN(c3ccccc3)CC2)c2ccsc2S1 ZINC000482149822 897612308 /nfs/dbraw/zinc/61/23/08/897612308.db2.gz WNEXSTAABGYCIJ-QFBILLFUSA-N 0 3 401.601 4.002 20 0 HIADHN CC(C)(C)[C@@H](NCCCc1c(Cl)cccc1Cl)c1nc(-c2nc[nH]n2)no1 ZINC000482238490 897720016 /nfs/dbraw/zinc/72/00/16/897720016.db2.gz MHFFXSUFWBZHPP-AWEZNQCLSA-N 0 3 409.321 4.471 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)N1CCN(c2ccc3ccccc3n2)CC1 ZINC000482317094 897816401 /nfs/dbraw/zinc/81/64/01/897816401.db2.gz RIKMMUAVCIYUMY-UHFFFAOYSA-N 0 3 414.509 4.005 20 0 HIADHN COc1ccc([C@H](NC(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)C(F)(F)F)cc1 ZINC000482330045 897834131 /nfs/dbraw/zinc/83/41/31/897834131.db2.gz UGBARVDDXHNGPM-QUCCMNQESA-N 0 3 421.463 4.215 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)c2cc(-c3ccc(Cl)s3)on2)c1 ZINC000482345588 897855448 /nfs/dbraw/zinc/85/54/48/897855448.db2.gz RONWXRSPEBESAA-UHFFFAOYSA-N 0 3 419.934 4.269 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)c2ccc(CCC(F)(F)F)cc2)c1 ZINC000482370862 897893108 /nfs/dbraw/zinc/89/31/08/897893108.db2.gz VGFZQAQSAKXWKZ-UHFFFAOYSA-N 0 3 408.464 4.394 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)c2cc(C)sc2Br)c1 ZINC000482373373 897896541 /nfs/dbraw/zinc/89/65/41/897896541.db2.gz RZLDTZGFKSYYPA-UHFFFAOYSA-N 0 3 411.365 4.032 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Cc2csc(-c3ccc(C)cc3)n2)c1 ZINC000482400921 897939795 /nfs/dbraw/zinc/93/97/95/897939795.db2.gz OCHOEAJRAAPEFW-UHFFFAOYSA-N 0 3 423.582 4.260 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)c2cnc(-c3ccccc3F)s2)c1 ZINC000482418840 897968962 /nfs/dbraw/zinc/96/89/62/897968962.db2.gz UTYUHIDPSJRSSY-UHFFFAOYSA-N 0 3 413.518 4.162 20 0 HIADHN CC1(C)CN(Cc2ccc(-n3ccc(C(F)(F)F)n3)cc2)C[C@@]2(CCCOC2)O1 ZINC000482455687 898024687 /nfs/dbraw/zinc/02/46/87/898024687.db2.gz QNBGNYOHIHBSDZ-HXUWFJFHSA-N 0 3 409.452 4.051 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)Nc1cccc2c1CN(CC(F)(F)F)C2 ZINC000482504134 898086240 /nfs/dbraw/zinc/08/62/40/898086240.db2.gz HPCOOIROKZJVPY-UHFFFAOYSA-N 0 3 412.500 4.294 20 0 HIADHN CC(=O)N[C@@H](C)C1CCN(Cc2cccc(NC(=O)c3ccccc3Cl)c2)CC1 ZINC000482511599 898096275 /nfs/dbraw/zinc/09/62/75/898096275.db2.gz NPERSEUKXWWONA-INIZCTEOSA-N 0 3 413.949 4.329 20 0 HIADHN COC(=O)COc1ccc(CN[C@@H](c2cc(F)cc(Br)c2)C2CC2)cc1 ZINC000482511693 898096709 /nfs/dbraw/zinc/09/67/09/898096709.db2.gz SYWMRYHBUCKTJE-HXUWFJFHSA-N 0 3 422.294 4.381 20 0 HIADHN CCO[C@@H]1C[C@@H](NCc2cc(OC)c(OC)cc2SC)[C@H]1Oc1ccccc1 ZINC000482513180 898098396 /nfs/dbraw/zinc/09/83/96/898098396.db2.gz RZQOSVZPXWAFFZ-NQSCKRDGSA-N 0 3 403.544 4.140 20 0 HIADHN CC(=O)N[C@@H](C)C1CCN(Cc2cn(-c3ccccc3)nc2-c2cccs2)CC1 ZINC000482526635 898115175 /nfs/dbraw/zinc/11/51/75/898115175.db2.gz UBDMAAKEYODHHP-KRWDZBQOSA-N 0 3 408.571 4.337 20 0 HIADHN CCc1nc2c(s1)[C@H](N[C@H](C)c1cc(F)ccc1N1CCN(C)CC1)CCC2 ZINC000482529092 898116514 /nfs/dbraw/zinc/11/65/14/898116514.db2.gz APYLSIFSBQFYSS-CRAIPNDOSA-N 0 3 402.583 4.325 20 0 HIADHN Cn1c(CNC[C@@H](CO)Cc2ccc(C(F)(F)F)cc2)nc2ccc(Cl)cc21 ZINC000482576099 898172395 /nfs/dbraw/zinc/17/23/95/898172395.db2.gz CUWONCUYXMVLKI-AWEZNQCLSA-N 0 3 411.855 4.186 20 0 HIADHN Cc1ccc(-n2nc(C(=O)Nc3cc(CN(C)C)ccc3C)c3c2CCC3)c(F)c1 ZINC000482590087 898189551 /nfs/dbraw/zinc/18/95/51/898189551.db2.gz BZSFJCNGIRCHJV-UHFFFAOYSA-N 0 3 406.505 4.431 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)[C@@H]1CC(=O)N(c2cccc3ccccc32)C1 ZINC000482624347 898227910 /nfs/dbraw/zinc/22/79/10/898227910.db2.gz VLGHSHDZSBLVDR-HXUWFJFHSA-N 0 3 401.510 4.201 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)c1ccc2c(c1)C(=O)N(C1CCCCC1)C2=O ZINC000482632398 898235146 /nfs/dbraw/zinc/23/51/46/898235146.db2.gz QHZPFMVUSUBYDI-UHFFFAOYSA-N 0 3 419.525 4.238 20 0 HIADHN COCCC1(CNC(=O)NC[C@@H](c2cccc(OC)c2)N2CCCC2)CCCCC1 ZINC000482636520 898240978 /nfs/dbraw/zinc/24/09/78/898240978.db2.gz VWYZGRSWSCEMKF-QFIPXVFZSA-N 0 3 417.594 4.118 20 0 HIADHN CC[C@H](C)C(=O)Nc1cccc(CNC(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)c1 ZINC000482638444 898241573 /nfs/dbraw/zinc/24/15/73/898241573.db2.gz XDDYIFQILKKEMF-SVMVAKDDSA-N 0 3 410.562 4.162 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)c1ccc(CNC(=O)c2cccs2)cc1 ZINC000482638352 898242212 /nfs/dbraw/zinc/24/22/12/898242212.db2.gz ZRARKGCBNGCGMC-UHFFFAOYSA-N 0 3 407.539 4.300 20 0 HIADHN Cn1c(CNC[C@@H](c2ccc(Cl)cc2)N2CCOCC2)nc2ccc(Cl)cc21 ZINC000482688148 898287117 /nfs/dbraw/zinc/28/71/17/898287117.db2.gz BVAOVMGUYIKZSY-FQEVSTJZSA-N 0 3 419.356 4.043 20 0 HIADHN CN1C(=O)C[C@@H](NCc2ccc(OCc3cccnc3)cc2)[C@@H]1c1ccc(F)c(F)c1 ZINC000482698079 898297730 /nfs/dbraw/zinc/29/77/30/898297730.db2.gz YEQXINGJTQTELP-VWNXMTODSA-N 0 3 423.463 4.000 20 0 HIADHN O=C(Nc1cc(F)ccc1OCC(F)(F)F)N1CCN(C2CCCCC2)CC1 ZINC000482701963 898301905 /nfs/dbraw/zinc/30/19/05/898301905.db2.gz CAHGTTXUQPJRRB-UHFFFAOYSA-N 0 3 403.420 4.249 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)NCc1ccc(Br)s1)c1ccco1 ZINC000482705683 898305096 /nfs/dbraw/zinc/30/50/96/898305096.db2.gz IDYAJLRPUHBFCZ-YPMHNXCESA-N 0 3 400.342 4.032 20 0 HIADHN O=C1[C@H](N2CCC(Cc3cc(Cl)ccc3Cl)CC2)CCN1C1CCOCC1 ZINC000482888332 898505112 /nfs/dbraw/zinc/50/51/12/898505112.db2.gz JQDCLOSIFPRRSB-HXUWFJFHSA-N 0 3 411.373 4.028 20 0 HIADHN CC(C)C[C@H](C)Oc1cc(CN[C@@H](C)c2ccc(NS(C)(=O)=O)cc2)ccn1 ZINC000482888973 898505747 /nfs/dbraw/zinc/50/57/47/898505747.db2.gz NQKZEOQAYHJSAV-IRXDYDNUSA-N 0 3 405.564 4.117 20 0 HIADHN CN(C)C(=O)[C@@H](Cc1ccccc1)N[C@H]1CCCc2nc(-c3ccccc3)sc21 ZINC000482895235 898514548 /nfs/dbraw/zinc/51/45/48/898514548.db2.gz SLCKSZMSTAZRPW-PZJWPPBQSA-N 0 3 405.567 4.477 20 0 HIADHN O=C1NC2(CCCCC2)C(=O)N1Cc1ccccc1CN[C@H]1CCc2ccc(F)cc21 ZINC000482952480 898580793 /nfs/dbraw/zinc/58/07/93/898580793.db2.gz BVSWELQRJHVGLN-QFIPXVFZSA-N 0 3 421.516 4.358 20 0 HIADHN CCN1CCCC[C@H]1C(=O)N1CCC(c2nc(-c3ccccc3OC)cs2)CC1 ZINC000483043195 898712295 /nfs/dbraw/zinc/71/22/95/898712295.db2.gz DWBYEVFNFNMAGP-FQEVSTJZSA-N 0 3 413.587 4.399 20 0 HIADHN CCCC[C@@](C)(N[C@H]1CCN(C2CCOCC2)C1=O)c1cccc(Br)c1 ZINC000483082948 898768476 /nfs/dbraw/zinc/76/84/76/898768476.db2.gz BIRPZDUAXPNSAY-PZJWPPBQSA-N 0 3 423.395 4.224 20 0 HIADHN C[C@@H](NC(=O)c1ccc(C(=O)N(C)c2ccccc2)cc1)[C@@H](c1ccccc1)N(C)C ZINC000505576373 914282895 /nfs/dbraw/zinc/28/28/95/914282895.db2.gz XOOCKFHHQNZURQ-DVECYGJZSA-N 0 3 415.537 4.384 20 0 HIADHN CN(C(=O)c1ccc(-c2n[nH]c(C3CC3)n2)cc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000483140523 898820758 /nfs/dbraw/zinc/82/07/58/898820758.db2.gz HRKYVASGRUSUJI-JOCHJYFZSA-N 0 3 415.541 4.086 20 0 HIADHN COc1cc(F)c([C@H](C)N[C@H]2CCN(c3ccccc3OC(F)F)C2)cc1OC ZINC000483162023 898832369 /nfs/dbraw/zinc/83/23/69/898832369.db2.gz UTZUNUABCTWLBF-KBPBESRZSA-N 0 3 410.436 4.374 20 0 HIADHN Cc1ccc(NC(=O)N2CCN(C3CCCCC3)CC2)cc1NC(=O)C(C)(C)C ZINC000483356445 898993639 /nfs/dbraw/zinc/99/36/39/898993639.db2.gz NYWDUFIXTPZGPA-UHFFFAOYSA-N 0 3 400.567 4.462 20 0 HIADHN C[C@@H](NC(=O)c1cc2sc(N3CCCC3)nc2s1)[C@@H](c1ccccc1)N(C)C ZINC000505601946 914306066 /nfs/dbraw/zinc/30/60/66/914306066.db2.gz IYBZHMZWCMNNOM-KDOFPFPSSA-N 0 3 414.600 4.379 20 0 HIADHN COCc1nc(C(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)c(-c2ccccc2)s1 ZINC000505602529 914306279 /nfs/dbraw/zinc/30/62/79/914306279.db2.gz NCKYSIKLRORINP-IIBYNOLFSA-N 0 3 409.555 4.378 20 0 HIADHN CS[C@@H]1CN(C(=O)c2sc(-c3ccc(F)c(F)c3)nc2C)C[C@H]1N1CCCC1 ZINC000483393968 899029364 /nfs/dbraw/zinc/02/93/64/899029364.db2.gz IPBIBSVDSBDPMG-IAGOWNOFSA-N 0 3 423.554 4.049 20 0 HIADHN CS[C@H]1CN(C(=O)c2sc(-c3cccc(Cl)c3)nc2C)C[C@H]1N1CCCC1 ZINC000483398278 899031723 /nfs/dbraw/zinc/03/17/23/899031723.db2.gz XJHWELYZNLHERU-SJORKVTESA-N 0 3 422.019 4.424 20 0 HIADHN CCOc1cc(CN(C)Cc2ccccc2C)ccc1OCC(=O)N1CCCCC1 ZINC000505605203 914308131 /nfs/dbraw/zinc/30/81/31/914308131.db2.gz FPRFJSKCNFAGDS-UHFFFAOYSA-N 0 3 410.558 4.417 20 0 HIADHN CS[C@@H]1CN(C(=O)c2sc(-c3ccccc3C)nc2C)C[C@H]1N1CCCC1 ZINC000483409094 899040111 /nfs/dbraw/zinc/04/01/11/899040111.db2.gz OYHUFTBDJPTDSL-QZTJIDSGSA-N 0 3 401.601 4.079 20 0 HIADHN Cc1ccc2c(C(=O)Nc3ccccc3CN3CCC[C@H](C(N)=O)C3)csc2c1 ZINC000483427737 899057168 /nfs/dbraw/zinc/05/71/68/899057168.db2.gz AZWPECCESVUJKZ-KRWDZBQOSA-N 0 3 407.539 4.159 20 0 HIADHN C[C@H](NC(=O)C1(c2cccc(Br)c2)CC1)[C@@H](c1ccccc1)N(C)C ZINC000505606034 914310219 /nfs/dbraw/zinc/31/02/19/914310219.db2.gz JMIVBPXQHXMTSZ-KXBFYZLASA-N 0 3 401.348 4.288 20 0 HIADHN COc1cc(C)c(CN2CCC(c3noc(-c4ccccc4OC)n3)CC2)c(C)n1 ZINC000483437605 899072012 /nfs/dbraw/zinc/07/20/12/899072012.db2.gz XLBHTGBMCQBWQG-UHFFFAOYSA-N 0 3 408.502 4.145 20 0 HIADHN Cc1nc(COc2ccccc2C(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)cs1 ZINC000505614200 914318459 /nfs/dbraw/zinc/31/84/59/914318459.db2.gz TZDWGAFWLAYROO-ZHRRBRCNSA-N 0 3 409.555 4.452 20 0 HIADHN C[C@H](NC(=O)[C@@H]1CCO[C@H]1c1ccc(Cl)c(F)c1)[C@H](c1ccccc1)N(C)C ZINC000505615559 914318011 /nfs/dbraw/zinc/31/80/11/914318011.db2.gz VTSAEYWXTRCVST-XVSRIUFKSA-N 0 3 404.913 4.364 20 0 HIADHN O=C(CN1CCN(C2CCCCC2)CC1)N[C@H](Cc1ccccc1)c1ccccc1 ZINC000483492444 899148669 /nfs/dbraw/zinc/14/86/69/899148669.db2.gz UKBACDIYUQZJSS-RUZDIDTESA-N 0 3 405.586 4.037 20 0 HIADHN Cc1ccc2c(C(=O)Nc3ccc(C(=O)NCCN4CCCC4)cc3)csc2c1 ZINC000483532805 899193976 /nfs/dbraw/zinc/19/39/76/899193976.db2.gz OCQNCVKQUWCFJP-UHFFFAOYSA-N 0 3 407.539 4.288 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)CCc1ccc(F)cc1F ZINC000505626966 914325803 /nfs/dbraw/zinc/32/58/03/914325803.db2.gz YUMACQWFWFFMOQ-OAQYLSRUSA-N 0 3 424.495 4.488 20 0 HIADHN Cc1ccccc1[C@@H](NC(=O)N(C)C1CCN(CCc2ccccn2)CC1)C(C)C ZINC000483561936 899218495 /nfs/dbraw/zinc/21/84/95/899218495.db2.gz MOCOYLBXKKOCIL-DEOSSOPVSA-N 0 3 408.590 4.436 20 0 HIADHN Cc1ccccc1[C@@H](NC(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1)C(C)C ZINC000483601845 899253019 /nfs/dbraw/zinc/25/30/19/899253019.db2.gz OWVQPFYXHHNMGM-MZKRTTBSSA-N 0 3 401.595 4.223 20 0 HIADHN CCN(CC)[C@H](C(=O)N1CCC(n2cncc2C)CC1)c1cccc(C(F)(F)F)c1 ZINC000505638838 914339812 /nfs/dbraw/zinc/33/98/12/914339812.db2.gz UGHYKGGRDQWQOD-FQEVSTJZSA-N 0 3 422.495 4.457 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2cccc(Br)c2C)c1 ZINC000483686922 899345341 /nfs/dbraw/zinc/34/53/41/899345341.db2.gz QXKVSSOYHFRJIM-UHFFFAOYSA-N 0 3 420.351 4.362 20 0 HIADHN CO[C@H]1CCCC[C@H]1NCC(=O)N(Cc1ccccc1)c1nc2c(s1)CCCC2 ZINC000483709620 899365821 /nfs/dbraw/zinc/36/58/21/899365821.db2.gz LDJGAXSMVHEHEW-QUCCMNQESA-N 0 3 413.587 4.102 20 0 HIADHN CO[C@@H]1CCCC[C@H]1NCC(=O)N1N=C(c2cc3ccccc3o2)C[C@H]1c1ccco1 ZINC000483723542 899381828 /nfs/dbraw/zinc/38/18/28/899381828.db2.gz KTEHKBDQHFCWAA-SLYNCCJLSA-N 0 3 421.497 4.251 20 0 HIADHN O=C(Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)c1ccc2c(c1)CCCC2=O ZINC000483802912 899477279 /nfs/dbraw/zinc/47/72/79/899477279.db2.gz PBFZABGTTVDDKD-NRFANRHFSA-N 0 3 414.509 4.101 20 0 HIADHN CC(C)Cc1ccc([C@@H](CNC(=O)Nc2cccc(N3CCC3=O)c2)N(C)C)cc1 ZINC000483803727 899479008 /nfs/dbraw/zinc/47/90/08/899479008.db2.gz NQNQWYGPEYIENN-JOCHJYFZSA-N 0 3 408.546 4.046 20 0 HIADHN CC[C@@H](N[C@H](C)c1cccc(-n2ccnc2)c1)c1ccccc1OCC(=O)N(C)C ZINC000483816110 899494640 /nfs/dbraw/zinc/49/46/40/899494640.db2.gz DMBSNGYKMYTMJZ-XMSQKQJNSA-N 0 3 406.530 4.141 20 0 HIADHN CC[C@@H]1Oc2cc([C@H](C)N[C@H](C)c3ccc(NC(=O)NC4CC4)cc3)ccc2NC1=O ZINC000483848384 899529760 /nfs/dbraw/zinc/52/97/60/899529760.db2.gz KWRZGADCCOBWNF-WIEQDCTASA-N 0 3 422.529 4.492 20 0 HIADHN Cc1cccc(Oc2cc(CN[C@@H](C)c3ccc(-n4cnnn4)cc3)ccn2)c1C ZINC000483851744 899532751 /nfs/dbraw/zinc/53/27/51/899532751.db2.gz QLTQYYOEYKGKFA-SFHVURJKSA-N 0 3 400.486 4.317 20 0 HIADHN Cc1cc(NC(=O)c2ccc(F)cc2Cl)sc1C(=O)N(CCN(C)C)C1CC1 ZINC000505661502 914358945 /nfs/dbraw/zinc/35/89/45/914358945.db2.gz USBVRPOYOKNAFR-UHFFFAOYSA-N 0 3 423.941 4.268 20 0 HIADHN Cc1cc(NC(=O)c2ccccc2Cl)sc1C(=O)N(CCN(C)C)C1CC1 ZINC000505661356 914359414 /nfs/dbraw/zinc/35/94/14/914359414.db2.gz UHBCQZZZWLHYLV-UHFFFAOYSA-N 0 3 405.951 4.128 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N[C@H](c1ccc(Cl)cc1)[C@H]1C[C@@H]1C ZINC000483978368 899621114 /nfs/dbraw/zinc/62/11/14/899621114.db2.gz KOFPPYQSIPQTII-PAXLWEDBSA-N 0 3 413.949 4.162 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)NC[C@@H]2CCCC[C@H]2C(F)(F)F)CC1 ZINC000484049103 899682583 /nfs/dbraw/zinc/68/25/83/899682583.db2.gz SDMVTJAVTUTHEP-MAUKXSAKSA-N 0 3 401.473 4.254 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)Nc2nnc(/C=C\c3ccco3)s2)C1 ZINC000484092349 899723385 /nfs/dbraw/zinc/72/33/85/899723385.db2.gz BABAPADBGHWOBJ-WKPOEDDGSA-N 0 3 409.515 4.259 20 0 HIADHN O=C(C1CCN(CCOc2ccc(Cl)c(F)c2)CC1)N1CCc2ccccc21 ZINC000484093346 899724037 /nfs/dbraw/zinc/72/40/37/899724037.db2.gz KEZHNKCSCGRTNM-UHFFFAOYSA-N 0 3 402.897 4.159 20 0 HIADHN CCn1ncc2c1nc(-c1ccccc1)cc2C(=O)N1CCN(C2CCCCC2)CC1 ZINC000484124339 899745684 /nfs/dbraw/zinc/74/56/84/899745684.db2.gz YFAWZKUFBIHUSO-UHFFFAOYSA-N 0 3 417.557 4.209 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)Nc1nnc(/C=C/c2ccco2)s1 ZINC000484126570 899749057 /nfs/dbraw/zinc/74/90/57/899749057.db2.gz FRABEFAEXNLNRS-ZGKFYVQTSA-N 0 3 409.515 4.260 20 0 HIADHN Cc1c([C@@H](C)NC2CCN(c3ccc(C)cn3)CC2)nnn1-c1ccc(Cl)cc1 ZINC000484133165 899754441 /nfs/dbraw/zinc/75/44/41/899754441.db2.gz JKIJSCLRRJTDTH-MRXNPFEDSA-N 0 3 410.953 4.252 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N[C@@H](c1ccc(Cl)cc1)C1CCC1 ZINC000484153779 899774379 /nfs/dbraw/zinc/77/43/79/899774379.db2.gz APFDHKWMKSOIHF-OAQYLSRUSA-N 0 3 413.949 4.306 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)Nc2ccc(C(=O)N[C@H](C)CC)cc2)N(C)C)cc1 ZINC000505689810 914380289 /nfs/dbraw/zinc/38/02/89/914380289.db2.gz JPGLSPSNYCDWLM-VGOFRKELSA-N 0 3 410.562 4.202 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N[C@H](C)c1ccc(SC(C)C)cc1 ZINC000484183794 899800343 /nfs/dbraw/zinc/80/03/43/899800343.db2.gz AGONAXVJJFLNRI-QGZVFWFLSA-N 0 3 413.587 4.373 20 0 HIADHN COc1cc([C@H](C)NCc2ccc(C)cc2N2CCOCC2)ccc1OC(F)F ZINC000484291194 899856700 /nfs/dbraw/zinc/85/67/00/899856700.db2.gz ASBISVNDJHEIOI-INIZCTEOSA-N 0 3 406.473 4.292 20 0 HIADHN COc1cc([C@@H](C)N[C@H](C)c2ccc(-n3ccnc3C)cc2)ccc1S(C)(=O)=O ZINC000484306543 899866305 /nfs/dbraw/zinc/86/63/05/899866305.db2.gz XBKAJWCQGRQCKL-HZPDHXFCSA-N 0 3 413.543 4.005 20 0 HIADHN CC(C)[C@@](C)(N[C@@H]1CCN(CC(F)(F)F)C1=O)c1ccc(Br)cc1 ZINC000484343355 899893340 /nfs/dbraw/zinc/89/33/40/899893340.db2.gz RLCNOAHPQKXCNP-GDBMZVCRSA-N 0 3 407.274 4.073 20 0 HIADHN O=C1[C@@H]2CC[C@@H](c3ccccc3)N2C(=O)N1C[C@H]1CCCN(Cc2cccs2)C1 ZINC000484436145 899943811 /nfs/dbraw/zinc/94/38/11/899943811.db2.gz USTSODAEFBTJGZ-YYWHXJBOSA-N 0 3 409.555 4.128 20 0 HIADHN O[C@@H](CN[C@@H]1CCCc2nc(-c3ccccc3Br)sc21)C(F)F ZINC000484473924 899968193 /nfs/dbraw/zinc/96/81/93/899968193.db2.gz JIBIBCLCYPTKJE-YPMHNXCESA-N 0 3 403.292 4.166 20 0 HIADHN CC[C@@H](CN[C@@H](C)c1cccc(S(=O)(=O)N(C)C)c1)Oc1ccccc1Cl ZINC000484483707 899975646 /nfs/dbraw/zinc/97/56/46/899975646.db2.gz AQQDMPWLTUIWGU-RDJZCZTQSA-N 0 3 410.967 4.099 20 0 HIADHN CNS(=O)(=O)c1cccc([C@H](C)NCc2ccc(-c3ccc(OC)cc3)s2)c1 ZINC000484496710 899986941 /nfs/dbraw/zinc/98/69/41/899986941.db2.gz PGPXCUZITVLBOA-HNNXBMFYSA-N 0 3 416.568 4.183 20 0 HIADHN CC[C@H](NCc1ccccc1-n1nc(C)cc1C)c1ccccc1OCC(=O)N(C)C ZINC000484498507 899988174 /nfs/dbraw/zinc/98/81/74/899988174.db2.gz KQRGCCKEAUKFBQ-QFIPXVFZSA-N 0 3 420.557 4.197 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2ccc(F)c(Br)c2)c1 ZINC000484500195 899990985 /nfs/dbraw/zinc/99/09/85/899990985.db2.gz HPEMNUVANHZSNR-UHFFFAOYSA-N 0 3 424.314 4.193 20 0 HIADHN CN1CCC[C@H](N[C@H]2CCCc3nc(-c4ccccc4Br)sc32)C1=O ZINC000484506076 899996226 /nfs/dbraw/zinc/99/62/26/899996226.db2.gz UGVBROXSFFWYIU-HOCLYGCPSA-N 0 3 420.376 4.160 20 0 HIADHN Cc1c([C@H](C)N[C@H](C)Cc2ccncc2)nnn1-c1cccc(Br)c1 ZINC000484505509 899996310 /nfs/dbraw/zinc/99/63/10/899996310.db2.gz SURSFCNWLTYCTH-KGLIPLIRSA-N 0 3 400.324 4.015 20 0 HIADHN C[C@H](N[C@@H]1CCN(C(=O)CCc2ccccc2)C1)c1ccccc1OC(F)(F)F ZINC000484509089 900000515 /nfs/dbraw/zinc/00/05/15/900000515.db2.gz YTCJZTLFZJRDIF-FUHWJXTLSA-N 0 3 406.448 4.470 20 0 HIADHN O=[S@@](CCN[C@@H](Cn1cnc2ccccc21)c1ccc(F)cc1)c1ccccc1 ZINC000484557524 900033969 /nfs/dbraw/zinc/03/39/69/900033969.db2.gz VHKRFMWGFDJZPH-ZTOMLWHTSA-N 0 3 407.514 4.314 20 0 HIADHN Brc1cc2c(cc1CN[C@@H]1CCCC[C@H]1n1cccn1)OCCCO2 ZINC000484614604 900071150 /nfs/dbraw/zinc/07/11/50/900071150.db2.gz KKTKCNBCIURJNO-IAGOWNOFSA-N 0 3 406.324 4.080 20 0 HIADHN CCCOc1ccc(O[C@@H]2CCCC[C@H]2NCc2cc(-c3cnn(C)c3)no2)cc1 ZINC000484623875 900076210 /nfs/dbraw/zinc/07/62/10/900076210.db2.gz VFPCSSCPPQEBJM-FYYLOGMGSA-N 0 3 410.518 4.344 20 0 HIADHN Brc1ccc(-c2nccc(CN[C@@H]3CCCC[C@@H]3n3cccn3)n2)cc1 ZINC000484626354 900078799 /nfs/dbraw/zinc/07/87/99/900078799.db2.gz IRZOOIRZGMGNGK-MOPGFXCFSA-N 0 3 412.335 4.376 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)C[C@@H](c3ccccc3)C(F)(F)F)cc2)CC1 ZINC000484694586 900130529 /nfs/dbraw/zinc/13/05/29/900130529.db2.gz IVCCHDKIIBXNSW-NRFANRHFSA-N 0 3 419.491 4.499 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)NCc1ccc(OCc2ccccn2)cc1 ZINC000484767340 900182183 /nfs/dbraw/zinc/18/21/83/900182183.db2.gz VTSPWHCTBYWQFR-UHFFFAOYSA-N 0 3 410.562 4.068 20 0 HIADHN C[C@H]1Cc2ccccc2N1Cc1ccoc1C(=O)NC[C@@H](Cc1ccccc1)N(C)C ZINC000484919444 900294619 /nfs/dbraw/zinc/29/46/19/900294619.db2.gz UKRYSTPGILHZNK-WMZHIEFXSA-N 0 3 417.553 4.134 20 0 HIADHN C[C@H]1CC(C)(C)C[C@@](CO)(NCC(=O)Nc2c(Cl)cccc2C(F)(F)F)C1 ZINC000485056676 900385479 /nfs/dbraw/zinc/38/54/79/900385479.db2.gz CMKXRYZKHFSMGN-SGTLLEGYSA-N 0 3 406.876 4.464 20 0 HIADHN CC[C@H](C)NC(=O)[C@@H]1C[C@H](C)N(Cc2csc(N(C)C3CC3)n2)[C@@H]2CCCC[C@H]12 ZINC000485091333 900403020 /nfs/dbraw/zinc/40/30/20/900403020.db2.gz FYPMJIJERHKCFS-BQDHWQRKSA-N 0 3 418.651 4.426 20 0 HIADHN CNC(=O)[C@H]1Cc2ccccc2N1C(=O)C(Cc1c(C)cc(C)cc1C)C(F)(F)F ZINC000485134928 900436422 /nfs/dbraw/zinc/43/64/22/900436422.db2.gz PDSGJGRGFMAJAY-AZUAARDMSA-N 0 3 418.459 4.037 20 0 HIADHN CCOc1cc(CNC2(c3cccc(C)c3)CCCC2)nc2nc(C(F)(F)F)nn21 ZINC000485135201 900436875 /nfs/dbraw/zinc/43/68/75/900436875.db2.gz XAABJBNQXFQGDU-UHFFFAOYSA-N 0 3 419.451 4.409 20 0 HIADHN CCCCn1ncc(NC(=O)N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)c1C(C)C ZINC000485163492 900461897 /nfs/dbraw/zinc/46/18/97/900461897.db2.gz XYRGHUQIVFHOIO-KDURUIRLSA-N 0 3 419.614 4.160 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)N[C@H](c1ccc(F)cc1)C(F)(F)F ZINC000485208903 900498107 /nfs/dbraw/zinc/49/81/07/900498107.db2.gz OPRPXKREJXWIEI-GOSISDBHSA-N 0 3 415.406 4.342 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)Nc1cccc(Oc2ccncc2)c1 ZINC000485418083 900716058 /nfs/dbraw/zinc/71/60/58/900716058.db2.gz YJBAEUPWUXBJQA-UHFFFAOYSA-N 0 3 402.498 4.444 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)Cc2ccc(F)cc2Br)C1 ZINC000485456323 900750550 /nfs/dbraw/zinc/75/05/50/900750550.db2.gz RPOMLHHFFOQIGN-RDTXWAMCSA-N 0 3 405.311 4.082 20 0 HIADHN Cc1ccc(NC(=O)c2ccc(Br)c3c2OCCC3)c(CN(C)C)c1 ZINC000485547899 900822157 /nfs/dbraw/zinc/82/21/57/900822157.db2.gz HVBNVZNHOZIAOR-UHFFFAOYSA-N 0 3 403.320 4.396 20 0 HIADHN O=C(NCCN1CCCC1)c1ccc(NC(=O)c2ccc(Cl)c(Cl)c2)cc1 ZINC000485549013 900823471 /nfs/dbraw/zinc/82/34/71/900823471.db2.gz IWVRPRLKVSHCNT-UHFFFAOYSA-N 0 3 406.313 4.071 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)NC[C@@H](c3ccccc3)C(F)(F)F)cc2)CC1 ZINC000485606348 900866273 /nfs/dbraw/zinc/86/62/73/900866273.db2.gz FBOHKBCQAGBGBD-NRFANRHFSA-N 0 3 419.491 4.293 20 0 HIADHN COCCO[C@H]1COCC[C@@H]1NCc1ccc(-c2cccc(Cl)c2Cl)o1 ZINC000485697535 900946866 /nfs/dbraw/zinc/94/68/66/900946866.db2.gz PSKLFQVMELJFDG-WMZOPIPTSA-N 0 3 400.302 4.164 20 0 HIADHN CCOc1ccccc1Oc1ccc(CNC(=O)c2ccccc2CN(C)C)cn1 ZINC000485790229 901042666 /nfs/dbraw/zinc/04/26/66/901042666.db2.gz VIDBBWDMJGXUIF-UHFFFAOYSA-N 0 3 405.498 4.264 20 0 HIADHN COc1cc([C@H](C)NC(=O)c2ccccc2CN(C)C)ccc1OCc1ccncc1 ZINC000485801253 901051897 /nfs/dbraw/zinc/05/18/97/901051897.db2.gz IUKUQBFNQDGHLT-SFHVURJKSA-N 0 3 419.525 4.222 20 0 HIADHN CC[C@H](N[C@H](C)c1ccc(S(N)(=O)=O)cc1)c1cc(F)cc(Br)c1 ZINC000486095472 901282879 /nfs/dbraw/zinc/28/28/79/901282879.db2.gz NHNJTRYJHFAYEB-DIFFPNOSSA-N 0 3 415.328 4.038 20 0 HIADHN O=C(N[C@H]1CCN(Cc2ccccc2)C1)C1(c2cc(F)cc(Br)c2)CC1 ZINC000505881897 914527678 /nfs/dbraw/zinc/52/76/78/914527678.db2.gz VOVXCWTVMBEWAR-IBGZPJMESA-N 0 3 417.322 4.011 20 0 HIADHN C[C@@H](NC(=O)N1CCN(C2CCCCC2)CC1)c1noc(-c2ccc(Cl)cc2)n1 ZINC000486210906 901394487 /nfs/dbraw/zinc/39/44/87/901394487.db2.gz CUPJJDUFWLUHNO-OAHLLOKOSA-N 0 3 417.941 4.111 20 0 HIADHN C[C@H](NC(=O)NCC1(N2CCSCC2)CCCC1)c1ccc2ncsc2c1 ZINC000486262819 901445313 /nfs/dbraw/zinc/44/53/13/901445313.db2.gz YHUJVEUYPLNUKH-HNNXBMFYSA-N 0 3 404.605 4.018 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)c1nc2ccccc2cc1Cl ZINC000486269889 901452794 /nfs/dbraw/zinc/45/27/94/901452794.db2.gz WIAMKFMDSQGOOU-IBGZPJMESA-N 0 3 408.933 4.410 20 0 HIADHN CCCc1nc(C)c(NC(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)s1 ZINC000486322648 901499340 /nfs/dbraw/zinc/49/93/40/901499340.db2.gz KCVQLVMZSZXRAB-HOTGVXAUSA-N 0 3 408.612 4.147 20 0 HIADHN COCCN(CCN(C)C)C(=O)Nc1cccc(-c2ccc(Br)cc2)c1 ZINC000486368584 901535146 /nfs/dbraw/zinc/53/51/46/901535146.db2.gz FBYJHOAAXABQCE-UHFFFAOYSA-N 0 3 420.351 4.158 20 0 HIADHN Cc1cc(C)c2c(c1)CN(C(=O)Nc1ccc(CCN3CCSCC3)cc1)CC2 ZINC000486512489 901663581 /nfs/dbraw/zinc/66/35/81/901663581.db2.gz KOHQSDZRXKTDFQ-UHFFFAOYSA-N 0 3 409.599 4.485 20 0 HIADHN Cc1csc(Nc2ccc(C(=O)Nc3cccc(CN4CCC(O)CC4)c3)cc2)n1 ZINC000486563126 901708296 /nfs/dbraw/zinc/70/82/96/901708296.db2.gz GKYYSPUQNCGCAB-UHFFFAOYSA-N 0 3 422.554 4.404 20 0 HIADHN C[C@@H](Cc1cncc2ccccc21)C(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000486720524 901812866 /nfs/dbraw/zinc/81/28/66/901812866.db2.gz DLBARJLTTXNYFV-IBGZPJMESA-N 0 3 417.553 4.256 20 0 HIADHN CCOc1ncc(C(=O)N(CC)[C@@H]2CCN([C@H](C)c3ccccc3)C2)cc1Cl ZINC000486739280 901822910 /nfs/dbraw/zinc/82/29/10/901822910.db2.gz YWZNBMZNULTIQH-VQIMIIECSA-N 0 3 401.938 4.431 20 0 HIADHN CCN1CC[C@@H](NC(=O)c2ccccc2CN(C)C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000486829809 901881545 /nfs/dbraw/zinc/88/15/45/901881545.db2.gz YDLWPDWQOHIGSH-RTWAWAEBSA-N 0 3 403.929 4.106 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)Nc3ncc(Cc4cccc(C(F)(F)F)c4)s3)[C@H]2C1 ZINC000486858631 901903390 /nfs/dbraw/zinc/90/33/90/901903390.db2.gz BOPWLHDYAUWLEU-PBHICJAKSA-N 0 3 424.492 4.311 20 0 HIADHN C[C@@H](NC(=O)N(CCN(C)C)Cc1ccc(F)cc1F)c1ccc2ncsc2c1 ZINC000486888534 901934355 /nfs/dbraw/zinc/93/43/55/901934355.db2.gz SFZUOTLUMWIQCZ-CQSZACIVSA-N 0 3 418.513 4.409 20 0 HIADHN CN(C(=O)Nc1nnc(/C=C/c2ccco2)s1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000486898915 901943099 /nfs/dbraw/zinc/94/30/99/901943099.db2.gz HJNSZFIHZJEUPU-OAGJVSPASA-N 0 3 409.515 4.040 20 0 HIADHN C[C@@H](NC(=O)N(CCN(C)C)Cc1ccc(F)cc1)c1ccc2ncsc2c1 ZINC000486902342 901947145 /nfs/dbraw/zinc/94/71/45/901947145.db2.gz XKJXZAIPIVMBGJ-OAHLLOKOSA-N 0 3 400.523 4.270 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)Nc1nnc(/C=C\c2ccco2)s1 ZINC000486943686 901981223 /nfs/dbraw/zinc/98/12/23/901981223.db2.gz NGGYKCMUVWFXOT-MQNTZWLQSA-N 0 3 409.515 4.088 20 0 HIADHN CCOc1ccc(CNCc2cccc(-c3nc(C(=O)OC)cs3)c2)cc1F ZINC000487165684 902082990 /nfs/dbraw/zinc/08/29/90/902082990.db2.gz DYDXAYOTKBTUOH-UHFFFAOYSA-N 0 3 400.475 4.424 20 0 HIADHN CC[C@@H](Cc1ccccc1)N(C)Cc1nc(-c2cc(OC)c(OC)c(OC)c2)no1 ZINC000487358358 902161499 /nfs/dbraw/zinc/16/14/99/902161499.db2.gz COVOGPFINQXRJU-SFHVURJKSA-N 0 3 411.502 4.216 20 0 HIADHN COc1cc(-c2noc(CN3CCC[C@@H]3Cc3ccc(C)cc3)n2)cc(OC)c1OC ZINC000487406031 902188131 /nfs/dbraw/zinc/18/81/31/902188131.db2.gz DUDQVTYDJILEAN-LJQANCHMSA-N 0 3 423.513 4.278 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)Cc2ccc(F)c(Br)c2)c1 ZINC000487513007 902229830 /nfs/dbraw/zinc/22/98/30/902229830.db2.gz UYFYHQNXKPHULU-UHFFFAOYSA-N 0 3 407.327 4.030 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)CSCc2coc(-c3ccccc3)n2)c1 ZINC000487623972 902256450 /nfs/dbraw/zinc/25/64/50/902256450.db2.gz SGFUBFYEUYRCIC-UHFFFAOYSA-N 0 3 423.582 4.474 20 0 HIADHN CN(C(=O)c1cnc(-c2ccsc2)s1)C1CCN(CCc2ccccn2)CC1 ZINC000487702998 902301954 /nfs/dbraw/zinc/30/19/54/902301954.db2.gz NMMFPLNPZOGDLE-UHFFFAOYSA-N 0 3 412.584 4.046 20 0 HIADHN C[C@H](c1cccc(N2CCCS2(=O)=O)c1)N(C)Cc1ccc(Br)cc1 ZINC000487866782 902414633 /nfs/dbraw/zinc/41/46/33/902414633.db2.gz CANUEUYJHQPKCN-OAHLLOKOSA-N 0 3 423.376 4.182 20 0 HIADHN C[C@@H]1CCN(C(=O)c2ccccc2COC2CCOCC2)CCN1Cc1ccccc1 ZINC000487963118 902487653 /nfs/dbraw/zinc/48/76/53/902487653.db2.gz PSRKVLNRKGKQNS-OAQYLSRUSA-N 0 3 422.569 4.119 20 0 HIADHN CC[C@@H]1C[C@@H](C(=O)NC[C@H](c2ccc(C(F)(F)F)cc2)N(CC)CC)CCO1 ZINC000505969044 914631381 /nfs/dbraw/zinc/63/13/81/914631381.db2.gz AGOOGSMTDGQWLJ-QXAKKESOSA-N 0 3 400.485 4.410 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CC(C)(C)[C@H]1c1cccnc1)c1cccc(OC)c1 ZINC000488146414 902641165 /nfs/dbraw/zinc/64/11/65/902641165.db2.gz VJBXUKSQOHKIMY-FCHUYYIVSA-N 0 3 410.562 4.266 20 0 HIADHN Cc1ccc(Oc2ccc(NC(=O)N3CCN(C4CCOCC4)C[C@H]3C)cn2)cc1C ZINC000488371705 902785066 /nfs/dbraw/zinc/78/50/66/902785066.db2.gz JZAPGMCMLCPDEX-LJQANCHMSA-N 0 3 424.545 4.208 20 0 HIADHN Cc1ccc(NC(=O)N2CCN(C3CCOCC3)C[C@@H]2C)c(OCc2ccccc2)c1 ZINC000488372295 902785676 /nfs/dbraw/zinc/78/56/76/902785676.db2.gz TZWUZFPNPDAKFW-FQEVSTJZSA-N 0 3 423.557 4.291 20 0 HIADHN COc1ccccc1N1CCC(NCc2csc(-c3ccc4c(c3)OCO4)n2)CC1 ZINC000488450738 902831896 /nfs/dbraw/zinc/83/18/96/902831896.db2.gz NJLUUIHXQCGUKY-UHFFFAOYSA-N 0 3 423.538 4.306 20 0 HIADHN CCOc1c(Cl)cc(NC(=O)N2CCN(C3CCOCC3)C[C@H]2C)cc1Cl ZINC000488649751 902918459 /nfs/dbraw/zinc/91/84/59/902918459.db2.gz XFMTUIJTFBVZGN-CYBMUJFWSA-N 0 3 416.349 4.109 20 0 HIADHN CCC[N@H+](CC)Cc1ccc(C(=O)NCc2ccc([O-])c(Br)c2)cc1 ZINC000488676968 902939621 /nfs/dbraw/zinc/93/96/21/902939621.db2.gz PTAIEKIPRLWCGZ-UHFFFAOYSA-N 0 3 405.336 4.317 20 0 HIADHN CCC[N@@H+](CC)Cc1ccc(C(=O)NCc2ccc([O-])c(Br)c2)cc1 ZINC000488676968 902939630 /nfs/dbraw/zinc/93/96/30/902939630.db2.gz PTAIEKIPRLWCGZ-UHFFFAOYSA-N 0 3 405.336 4.317 20 0 HIADHN Cc1ccccc1[C@@H](C(C)C)N(C)CC(=O)N1CCC(NC(=O)c2ccccc2)CC1 ZINC000488829971 903028811 /nfs/dbraw/zinc/02/88/11/903028811.db2.gz OAEPSTUSTHISDW-RUZDIDTESA-N 0 3 421.585 4.045 20 0 HIADHN CC(C)C(=O)Nc1cccc(NC(=O)N(Cc2ccccc2)C2CCN(C)CC2)c1 ZINC000489019424 903124286 /nfs/dbraw/zinc/12/42/86/903124286.db2.gz WJOXWZFMSABSMA-UHFFFAOYSA-N 0 3 408.546 4.409 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)Nc2ccc(Cn3cccn3)cc2)CC1 ZINC000489019304 903124372 /nfs/dbraw/zinc/12/43/72/903124372.db2.gz VVPVBBKKRAZESU-UHFFFAOYSA-N 0 3 403.530 4.060 20 0 HIADHN COc1ccccc1[C@H](C)NC(=O)[C@@H](C)N[C@@H](COc1ccccc1F)C(C)(C)C ZINC000489029532 903134690 /nfs/dbraw/zinc/13/46/90/903134690.db2.gz ZICOFUKLCJFRCH-JKSBSHDWSA-N 0 3 416.537 4.483 20 0 HIADHN C[C@H]1CN(C2CCOCC2)CCN1C(=O)Nc1ccc(C(C)(C)C(F)(F)F)cc1 ZINC000489080984 903183825 /nfs/dbraw/zinc/18/38/25/903183825.db2.gz RPHDQHUVSFTURU-HNNXBMFYSA-N 0 3 413.484 4.244 20 0 HIADHN CC(C)CC[C@H]1CCC[C@H]1NC(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000489139357 903226971 /nfs/dbraw/zinc/22/69/71/903226971.db2.gz NDVFCSNMJFBLLL-AUSIDOKSSA-N 0 3 401.595 4.047 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)NCc1sccc1Br)c1ccco1 ZINC000489199165 903258619 /nfs/dbraw/zinc/25/86/19/903258619.db2.gz RNBFWFHEHJGHEU-AAEUAGOBSA-N 0 3 400.342 4.032 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)NCc2cc(Br)cs2)CC1 ZINC000489256854 903293698 /nfs/dbraw/zinc/29/36/98/903293698.db2.gz BVLJVSJFJWJNDJ-UHFFFAOYSA-N 0 3 422.392 4.317 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)NCc2csc(Br)c2)CC1 ZINC000489270624 903298749 /nfs/dbraw/zinc/29/87/49/903298749.db2.gz WVGMGHGBXISXNQ-UHFFFAOYSA-N 0 3 422.392 4.317 20 0 HIADHN COc1ccc(OC)c([C@@H](C)NC(=O)N(Cc2ccccc2)C2CCN(C)CC2)c1 ZINC000489321376 903329790 /nfs/dbraw/zinc/32/97/90/903329790.db2.gz FHEZURONBQSZFK-GOSISDBHSA-N 0 3 411.546 4.071 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)NCc2sccc2Br)CC1 ZINC000489393302 903362369 /nfs/dbraw/zinc/36/23/69/903362369.db2.gz OLHKRHZGZICWNG-UHFFFAOYSA-N 0 3 422.392 4.317 20 0 HIADHN Cc1cc(N2CCCCCC2)ccc1NC(=O)N1CCN(C2CCOCC2)C[C@H]1C ZINC000489459290 903396173 /nfs/dbraw/zinc/39/61/73/903396173.db2.gz RXSSFFGQCKFVAW-HXUWFJFHSA-N 0 3 414.594 4.092 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)NCC(C)(C)[NH2+][C@H](C)c3ccccc3)cc2)cc(=O)[n-]1 ZINC000489492953 903419832 /nfs/dbraw/zinc/41/98/32/903419832.db2.gz YMVJDRRFOXZPOY-MRXNPFEDSA-N 0 3 419.529 4.409 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N(C)Cc3ccc(OC)c(C)c3)c(C)c2)CC1 ZINC000489506734 903428719 /nfs/dbraw/zinc/42/87/19/903428719.db2.gz AUIYYRLNZGZLLD-UHFFFAOYSA-N 0 3 410.562 4.118 20 0 HIADHN Cc1ccc(C[NH+]2CCCC2)cc1[N-]S(=O)(=O)c1ccc2c(c1)CC(C)(C)O2 ZINC000489547973 903456425 /nfs/dbraw/zinc/45/64/25/903456425.db2.gz HSLVIVXRNRDTBN-UHFFFAOYSA-N 0 3 400.544 4.105 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)[C@H]3CCCC(F)(F)C3)c(OCC)c2)CC1 ZINC000506038613 914725779 /nfs/dbraw/zinc/72/57/79/914725779.db2.gz OFDWUILRNRLVQC-KRWDZBQOSA-N 0 3 409.521 4.381 20 0 HIADHN Cc1ccc(NC(=O)NC[C@@H]2CN(Cc3ccccc3)CCCO2)cc1OC(C)C ZINC000489587316 903479691 /nfs/dbraw/zinc/47/96/91/903479691.db2.gz DNFDQVBLKFGHHE-JOCHJYFZSA-N 0 3 411.546 4.195 20 0 HIADHN CC(C)CC[C@@H](NC(=O)NCc1ccccc1CN1CCC(O)CC1)C(C)(C)C ZINC000489589965 903481389 /nfs/dbraw/zinc/48/13/89/903481389.db2.gz VVDZMVANZOHTPK-JOCHJYFZSA-N 0 3 403.611 4.293 20 0 HIADHN C[C@H](NCCCS(=O)(=O)Cc1ccccc1)c1ccc(Br)c(F)c1 ZINC000489623574 903503421 /nfs/dbraw/zinc/50/34/21/903503421.db2.gz RCKPTUUFFCVZGJ-AWEZNQCLSA-N 0 3 414.340 4.244 20 0 HIADHN C[C@H](CNC(=O)N(Cc1ccccc1)C1CCN(C)CC1)Oc1cccc(Cl)c1 ZINC000489629076 903506313 /nfs/dbraw/zinc/50/63/13/903506313.db2.gz WRGZDZYNQWPOBQ-GOSISDBHSA-N 0 3 415.965 4.413 20 0 HIADHN Cc1ccc(C[C@H](C)C(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000489658115 903524209 /nfs/dbraw/zinc/52/42/09/903524209.db2.gz ZIWMZODQEMLKAG-NZQKXSOJSA-N 0 3 402.542 4.456 20 0 HIADHN CCCN(CC1CCCCC1)C(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000489760596 903585951 /nfs/dbraw/zinc/58/59/51/903585951.db2.gz QJQOAUJULKHHEB-UHFFFAOYSA-N 0 3 401.595 4.145 20 0 HIADHN CC(C)(NC(=O)NCc1ccccc1CN1CCC(O)CC1)c1cccc(Cl)c1 ZINC000489788660 903600475 /nfs/dbraw/zinc/60/04/75/903600475.db2.gz QQMLBSBVDYVIIY-UHFFFAOYSA-N 0 3 415.965 4.031 20 0 HIADHN CSCC[C@H](N[C@@H]1CCCc2nc(-c3ccc(F)cc3)sc21)C(=O)N(C)C ZINC000489912902 903670756 /nfs/dbraw/zinc/67/07/56/903670756.db2.gz XHVYJDQYWZDRPU-WBVHZDCISA-N 0 3 407.580 4.126 20 0 HIADHN CC1(C)CCC(CN2CCN(CC(=O)Nc3ccccc3C(F)(F)F)CC2)CC1 ZINC000506046446 914743071 /nfs/dbraw/zinc/74/30/71/914743071.db2.gz XMDWJSXOVMJZBI-UHFFFAOYSA-N 0 3 411.512 4.478 20 0 HIADHN c1ccc([C@H](NCC2(c3ccc4c(c3)OCO4)CCOCC2)c2ccccn2)cc1 ZINC000490173514 903810647 /nfs/dbraw/zinc/81/06/47/903810647.db2.gz VYUTVKLNAQDRBU-DEOSSOPVSA-N 0 3 402.494 4.238 20 0 HIADHN C[C@H](CN[C@@H](c1ccc(F)cc1)c1cccc(S(C)(=O)=O)c1)N1CCC[C@@H](C)C1 ZINC000490184768 903814510 /nfs/dbraw/zinc/81/45/10/903814510.db2.gz OEUPEBUKSFPWJR-PNCHPQGNSA-N 0 3 418.578 4.029 20 0 HIADHN COc1cccc(CO[C@@H](C)C(=O)NC[C@@H](c2ccccc2)N2CCC(C)CC2)c1 ZINC000490218676 903833793 /nfs/dbraw/zinc/83/37/93/903833793.db2.gz UEVQQOLYCDLSHY-RDPSFJRHSA-N 0 3 410.558 4.190 20 0 HIADHN CC[C@@H](CNC(=O)N[C@H](c1ccccc1)c1ccncc1)N1CCc2ccccc2C1 ZINC000490289957 903878675 /nfs/dbraw/zinc/87/86/75/903878675.db2.gz RHTLXEJFBSUTKU-LOSJGSFVSA-N 0 3 414.553 4.307 20 0 HIADHN COc1ccccc1-c1ncc(CNCCOc2cccc(Br)c2)cn1 ZINC000490514002 904062803 /nfs/dbraw/zinc/06/28/03/904062803.db2.gz SOSCKLZJTOCSJZ-UHFFFAOYSA-N 0 3 414.303 4.083 20 0 HIADHN CC(=O)c1ccc(SCC(=O)NC[C@@]2(C)CCCN2Cc2ccccc2)cc1F ZINC000490525700 904074155 /nfs/dbraw/zinc/07/41/55/904074155.db2.gz DLFGIJUCCSGKMP-HSZRJFAPSA-N 0 3 414.546 4.291 20 0 HIADHN O=C(CN1CCCC[C@@H]1[C@@H]1CNC(=O)C1)c1c2ccccc2[nH]c1-c1ccccc1 ZINC000490631938 904148120 /nfs/dbraw/zinc/14/81/20/904148120.db2.gz QCRJIEFFNZQEKA-GHTZIAJQSA-N 0 3 401.510 4.008 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2ccc(N3CCOCC3)cc2C)N2CCCC2)cc1 ZINC000490659691 904159754 /nfs/dbraw/zinc/15/97/54/904159754.db2.gz BGGVROJPMGAAFR-XMMPIXPASA-N 0 3 422.573 4.099 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)NCCc1coc(-c2ccc(C)cc2)n1)c1ccco1 ZINC000490684742 904172432 /nfs/dbraw/zinc/17/24/32/904172432.db2.gz PPLGTXLPFDYLLQ-PXNSSMCTSA-N 0 3 410.518 4.214 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)NCCc1coc(-c2ccc(C)cc2)n1)c1ccco1 ZINC000490684744 904172796 /nfs/dbraw/zinc/17/27/96/904172796.db2.gz PPLGTXLPFDYLLQ-XLIONFOSSA-N 0 3 410.518 4.214 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NC[C@@H]3CCCCC(F)(F)C3)c(C)c2)CC1 ZINC000490705422 904180844 /nfs/dbraw/zinc/18/08/44/904180844.db2.gz OENQAYDANQKYFD-GOSISDBHSA-N 0 3 408.537 4.474 20 0 HIADHN Cc1cc(C)n(-c2ccc(C(F)(F)F)cc2NC(=O)N2CC[C@@H]3CCN(C)C[C@@H]32)n1 ZINC000490764222 904216657 /nfs/dbraw/zinc/21/66/57/904216657.db2.gz SKYLSDOBFKAUPC-KXBFYZLASA-N 0 3 421.467 4.066 20 0 HIADHN CN(C)[C@H](CNC(=O)N[C@@H](c1c[nH]c2ccccc21)C(F)(F)F)c1ccccc1 ZINC000490764426 904217360 /nfs/dbraw/zinc/21/73/60/904217360.db2.gz TWHJKZUSLVPGMV-MOPGFXCFSA-N 0 3 404.436 4.373 20 0 HIADHN CC(C)(C)[C@@H]1C[C@H](NC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)CCO1 ZINC000490821171 904265834 /nfs/dbraw/zinc/26/58/34/904265834.db2.gz AUAYQSSZBPCSMP-LVCYWYKZSA-N 0 3 412.496 4.151 20 0 HIADHN CCC(C)(C)OCc1cccc(NC(=O)C(=O)NC[C@H](C)N2CCCC[C@@H]2C)c1C ZINC000490854522 904288315 /nfs/dbraw/zinc/28/83/15/904288315.db2.gz VENBUXQXSOLNJO-ROUUACIJSA-N 0 3 417.594 4.018 20 0 HIADHN Cc1cc(C)c(CC(C(=O)Nc2cc(OC(F)F)n(C)n2)C(F)(F)F)c(C)c1 ZINC000490987683 904352547 /nfs/dbraw/zinc/35/25/47/904352547.db2.gz KCEMXKRMOACTBL-CYBMUJFWSA-N 0 3 405.367 4.306 20 0 HIADHN CCc1ccc([C@@H](NCCN(CC)C(C)C)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000491006081 904365832 /nfs/dbraw/zinc/36/58/32/904365832.db2.gz LNTNTHHGPWJBAU-HSZRJFAPSA-N 0 3 402.604 4.062 20 0 HIADHN CCc1nc(CCN[C@H](c2ccc(C)cc2)c2cccc(S(C)(=O)=O)c2)cs1 ZINC000491058819 904403048 /nfs/dbraw/zinc/40/30/48/904403048.db2.gz YRWVEUAHQLTJGF-JOCHJYFZSA-N 0 3 414.596 4.339 20 0 HIADHN CCN(CC1CCN(c2ccccn2)CC1)C(=O)c1oc2ccccc2c1CN(C)C ZINC000491084124 904418311 /nfs/dbraw/zinc/41/83/11/904418311.db2.gz JSFYSXDKXTUCES-UHFFFAOYSA-N 0 3 420.557 4.268 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)N2CC(C)(C)[C@H]2c2cccnc2)N(C)C)cc1 ZINC000491082955 904418735 /nfs/dbraw/zinc/41/87/35/904418735.db2.gz XBVPJEGUFMXGHA-FCHUYYIVSA-N 0 3 410.562 4.264 20 0 HIADHN Cc1ccccc1[C@@H](NC(=O)N(CCN(C)C)Cc1ccc(F)c(F)c1)C1CC1 ZINC000491181537 904469064 /nfs/dbraw/zinc/46/90/64/904469064.db2.gz FBVMBFYGQKFAMX-QFIPXVFZSA-N 0 3 401.501 4.498 20 0 HIADHN O=C(Nc1ccccc1O)C1CCN(Cc2ccccc2OCc2cccnc2)CC1 ZINC000506126247 914814586 /nfs/dbraw/zinc/81/45/86/914814586.db2.gz RNSVBNVIUJBHIR-UHFFFAOYSA-N 0 3 417.509 4.217 20 0 HIADHN COc1ccccc1-c1ncc(CNCCc2nc3ccccc3n2C(F)F)cn1 ZINC000491246086 904499231 /nfs/dbraw/zinc/49/92/31/904499231.db2.gz BVGQCSFHCIMQBI-UHFFFAOYSA-N 0 3 409.440 4.229 20 0 HIADHN COc1ccccc1-c1ncc(CN[C@H]2CCN(c3ccc(F)c(Cl)c3)C2)cn1 ZINC000491273055 904515077 /nfs/dbraw/zinc/51/50/77/904515077.db2.gz UCVGTQNIHOMOTF-INIZCTEOSA-N 0 3 412.896 4.313 20 0 HIADHN CN(Cc1cn(-c2ccccc2)nc1-c1cccs1)C(=O)[C@H]1CCCN1C1CC1 ZINC000491286777 904519375 /nfs/dbraw/zinc/51/93/75/904519375.db2.gz WYYOXWCYDMPFDE-HXUWFJFHSA-N 0 3 406.555 4.186 20 0 HIADHN COc1cccc(CN2CCC[C@H](c3nnc4ccc(C(F)(F)F)cn43)C2)c1OC ZINC000506135665 914818500 /nfs/dbraw/zinc/81/85/00/914818500.db2.gz IBYHTCCXZCZJDB-HNNXBMFYSA-N 0 3 420.435 4.145 20 0 HIADHN Cc1ccc(NC(=O)c2cccc(CN(C)C)c2)cc1S(=O)(=O)C1CCCC1 ZINC000491293963 904522929 /nfs/dbraw/zinc/52/29/29/904522929.db2.gz JMPJADZFMQTWCU-UHFFFAOYSA-N 0 3 400.544 4.025 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)Nc3ccc(Br)c(C(F)(F)F)c3)[C@@H]2C1 ZINC000491297187 904524154 /nfs/dbraw/zinc/52/41/54/904524154.db2.gz SXLRYGIDSCZWAO-IINYFYTJSA-N 0 3 406.246 4.026 20 0 HIADHN COc1ccccc1-c1ncc(CN[C@@H]2CCN(C)[C@H]2c2ccc(Cl)cc2)cn1 ZINC000491309000 904528758 /nfs/dbraw/zinc/52/87/58/904528758.db2.gz IUZJOLMRRUCFCY-IRLDBZIGSA-N 0 3 408.933 4.341 20 0 HIADHN O=S1(=O)CC[C@@H](CN[C@H](c2ccc(Cl)cc2)c2ccc(OC(F)F)cc2)C1 ZINC000491316820 904534412 /nfs/dbraw/zinc/53/44/12/904534412.db2.gz MTIJAXMOFVCLAF-SCLBCKFNSA-N 0 3 415.889 4.055 20 0 HIADHN COc1ccc(CN2CCC[C@@H](c3nnc4ccc(C(F)(F)F)cn43)C2)cc1OC ZINC000506138563 914820036 /nfs/dbraw/zinc/82/00/36/914820036.db2.gz SLLBJPMUGDSBAP-OAHLLOKOSA-N 0 3 420.435 4.145 20 0 HIADHN O=C(NCc1ccccc1OC(F)F)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000506141448 914821097 /nfs/dbraw/zinc/82/10/97/914821097.db2.gz WSJXLDWFNTXINY-QGZVFWFLSA-N 0 3 410.411 4.062 20 0 HIADHN CC(=O)N1CCC(N[C@H](c2ccc(Br)cc2)c2ccccc2F)CC1 ZINC000491355818 904553425 /nfs/dbraw/zinc/55/34/25/904553425.db2.gz IGMFJXQZCIOCEM-HXUWFJFHSA-N 0 3 405.311 4.278 20 0 HIADHN COc1ccc(CN2CCC[C@H](c3nnc4ccc(C(F)(F)F)cn43)C2)cc1F ZINC000506149627 914824940 /nfs/dbraw/zinc/82/49/40/914824940.db2.gz ZPWWIBZBYCRMKO-AWEZNQCLSA-N 0 3 408.399 4.275 20 0 HIADHN c1csc(-c2noc(CCCN3CCN(C[C@@H]4C[C@@H]4c4ccccc4)CC3)n2)c1 ZINC000506158650 914828291 /nfs/dbraw/zinc/82/82/91/914828291.db2.gz AXDRAFWFTRQOBM-VQTJNVASSA-N 0 3 408.571 4.152 20 0 HIADHN Cn1c(=O)c(CNCc2ccc(-n3ccc(C(F)(F)F)n3)cc2)cc2ccccc21 ZINC000491512043 904631884 /nfs/dbraw/zinc/63/18/84/904631884.db2.gz LIRBISLJQZBPCV-UHFFFAOYSA-N 0 3 412.415 4.033 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)Nc2cc3c(cc2Cl)OCCO3)c1 ZINC000491823672 904702064 /nfs/dbraw/zinc/70/20/64/904702064.db2.gz FKRXPOBHOKDYKU-UHFFFAOYSA-N 0 3 403.910 4.015 20 0 HIADHN CCN(CC)C(=O)c1ccc(NC(=O)N(CCN(C)C)Cc2cccc(C)c2)cc1 ZINC000491826331 904702242 /nfs/dbraw/zinc/70/22/42/904702242.db2.gz YGGJFPDTTMSUHG-UHFFFAOYSA-N 0 3 410.562 4.073 20 0 HIADHN Cc1nn(-c2ccc(C)c(Cl)c2)c(C)c1CC(=O)NC[C@H](c1ccccc1)N(C)C ZINC000491835121 904707148 /nfs/dbraw/zinc/70/71/48/904707148.db2.gz MXLHZFDQTRZJAZ-HSZRJFAPSA-N 0 3 424.976 4.413 20 0 HIADHN COC[C@H](NCc1ccccc1CN1C[C@H](C)O[C@@H](C)C1)c1ccc(Cl)cc1 ZINC000491906975 904726469 /nfs/dbraw/zinc/72/64/69/904726469.db2.gz CBUUMSMWWMKATH-BSRJHKFKSA-N 0 3 402.966 4.427 20 0 HIADHN COC[C@H](NCc1ccccc1CN1C[C@@H](C)O[C@H](C)C1)c1ccc(Cl)cc1 ZINC000491906978 904726733 /nfs/dbraw/zinc/72/67/33/904726733.db2.gz CBUUMSMWWMKATH-PNCHPQGNSA-N 0 3 402.966 4.427 20 0 HIADHN Cc1cc(-c2nc3cc(F)ccc3n2C)ccc1NC(=O)N1CC[C@@H]2CCN(C)C[C@@H]21 ZINC000492067489 904785790 /nfs/dbraw/zinc/78/57/90/904785790.db2.gz MAJSSDXZPAPFIA-AOMKIAJQSA-N 0 3 421.520 4.246 20 0 HIADHN Cc1csc(Sc2ccc(NC(=O)N3CC[C@H]4CCN(C)C[C@@H]43)c(C)c2)n1 ZINC000492176682 904810147 /nfs/dbraw/zinc/81/01/47/904810147.db2.gz BTZKLUFAAHFPRR-QAPCUYQASA-N 0 3 402.589 4.469 20 0 HIADHN CCc1ccc([C@H](NC[C@](C)(O)[C@H](C)CC)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000492223270 904818122 /nfs/dbraw/zinc/81/81/22/904818122.db2.gz KPKHAVKBHBDWGT-VSDWSMLSSA-N 0 3 403.588 4.129 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)N[C@@H](c2ccccc2)c2cccnc2)CCN1Cc1ccccc1 ZINC000492489954 904858396 /nfs/dbraw/zinc/85/83/96/904858396.db2.gz NOUDKBRSVRTMFX-YGOYIFOWSA-N 0 3 400.526 4.133 20 0 HIADHN Cc1nc(COc2ccc(CN(C)Cc3ccc(OC(F)(F)F)cc3)cc2)no1 ZINC000506217566 914849890 /nfs/dbraw/zinc/84/98/90/914849890.db2.gz FOCJKRLKQUJWSR-UHFFFAOYSA-N 0 3 407.392 4.488 20 0 HIADHN COc1cccc([C@@H](CNc2ccc(C(=O)Nc3ccc(C)cc3)cn2)N(C)C)c1 ZINC000492898198 904945930 /nfs/dbraw/zinc/94/59/30/904945930.db2.gz ZXDDTLCWSRCUEQ-JOCHJYFZSA-N 0 3 404.514 4.366 20 0 HIADHN COc1cc(OC)cc(N2CC[C@H](CN[C@@H](c3ccccc3)c3ccccn3)C2)c1 ZINC000493011250 904987723 /nfs/dbraw/zinc/98/77/23/904987723.db2.gz UGVUBCNWULNIES-CLOONOSVSA-N 0 3 403.526 4.304 20 0 HIADHN NC(=O)CCN(Cc1ccccc1)Cc1cccc(NC(=O)c2ccc(Cl)cc2)c1 ZINC000506246064 914861710 /nfs/dbraw/zinc/86/17/10/914861710.db2.gz DUMLDZLYCXCVKK-UHFFFAOYSA-N 0 3 421.928 4.470 20 0 HIADHN Cc1ccc([C@@H](NCC2(CCO)CCCC2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000493051030 905002583 /nfs/dbraw/zinc/00/25/83/905002583.db2.gz CCVFHPVOQSWPLX-QHCPKHFHSA-N 0 3 415.599 4.329 20 0 HIADHN Cc1ccc([C@H](NCC2(O)CCCCCC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000493062506 905007105 /nfs/dbraw/zinc/00/71/05/905007105.db2.gz SYSAGXHROGDXLC-QFIPXVFZSA-N 0 3 401.572 4.163 20 0 HIADHN O=C(NCCc1cccc2[nH]ccc21)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000506251232 914863811 /nfs/dbraw/zinc/86/38/11/914863811.db2.gz WBBSYWCTEAMIII-QFIPXVFZSA-N 0 3 415.459 4.281 20 0 HIADHN Cc1ccc([C@H](NC[C@]2(C)CCCC[C@H]2O)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000493176851 905041695 /nfs/dbraw/zinc/04/16/95/905041695.db2.gz PIUJVDMZSXJPCL-SMIHKQSGSA-N 0 3 415.599 4.327 20 0 HIADHN CCc1ccc([C@H](NC[C@]2(C)CCCC[C@H]2O)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000493203597 905047862 /nfs/dbraw/zinc/04/78/62/905047862.db2.gz JHABFPCSFKAIOH-SGNDLWITSA-N 0 3 415.599 4.273 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](NCC2CCSCC2)c2ccc(F)c(F)c2)c1 ZINC000493224767 905056099 /nfs/dbraw/zinc/05/60/99/905056099.db2.gz FCHMNGMHERNCLO-FQEVSTJZSA-N 0 3 411.539 4.191 20 0 HIADHN CCc1ccc([C@@H](NC2CCN(C(=O)COC)CC2)c2ccccc2Cl)cc1 ZINC000493247085 905064637 /nfs/dbraw/zinc/06/46/37/905064637.db2.gz JTSQUYNIUVSZIL-HSZRJFAPSA-N 0 3 400.950 4.219 20 0 HIADHN COc1cc(CN(C)[C@H](C)c2ccc(F)cc2)ccc1OCC(=O)N1CCCC1 ZINC000506258878 914868734 /nfs/dbraw/zinc/86/87/34/914868734.db2.gz LIAVKLONGZOMAA-QGZVFWFLSA-N 0 3 400.494 4.029 20 0 HIADHN Cc1cn2c(n1)[C@@H](CN[C@H](c1ccc(C)cc1)c1cccc(S(C)(=O)=O)c1)CCC2 ZINC000493306744 905082630 /nfs/dbraw/zinc/08/26/30/905082630.db2.gz UDYNAHKAULCMPK-FYYLOGMGSA-N 0 3 423.582 4.160 20 0 HIADHN c1[nH]nc(-c2ccc3c(c2)OCCO3)c1CN1CCC(OCc2ccccc2)CC1 ZINC000506266874 914873202 /nfs/dbraw/zinc/87/32/02/914873202.db2.gz BFBDCLOFWNQJPU-UHFFFAOYSA-N 0 3 405.498 4.029 20 0 HIADHN CNS(=O)(=O)c1ccc([C@H](C)N[C@@H]2CCc3cc(Br)cc(C)c32)cc1 ZINC000493843987 905230895 /nfs/dbraw/zinc/23/08/95/905230895.db2.gz MOGJASOIEMSLJR-SCLBCKFNSA-N 0 3 423.376 4.004 20 0 HIADHN CCNC(=O)COc1cccc(CN[C@@H]2CCc3cc(Br)cc(C)c32)c1 ZINC000493917551 905267079 /nfs/dbraw/zinc/26/70/79/905267079.db2.gz SBIVDPCVBBZKSR-LJQANCHMSA-N 0 3 417.347 4.050 20 0 HIADHN CNS(=O)(=O)c1cccc([C@@H](C)N[C@@H]2CCc3cc(Br)cc(C)c32)c1 ZINC000493918511 905270382 /nfs/dbraw/zinc/27/03/82/905270382.db2.gz ZBOQRVWMYZIBFO-FZKQIMNGSA-N 0 3 423.376 4.004 20 0 HIADHN Cc1cccc(NC(=O)N(Cc2ccncc2)[C@H]2CCCN(Cc3ccccc3)C2)n1 ZINC000493923697 905276773 /nfs/dbraw/zinc/27/67/73/905276773.db2.gz DITWNCZEDHBXQQ-QHCPKHFHSA-N 0 3 415.541 4.484 20 0 HIADHN Cc1cc(Br)cc2c1[C@@H](NCc1cccc(OCC(=O)N(C)C)c1)CC2 ZINC000493945925 905297358 /nfs/dbraw/zinc/29/73/58/905297358.db2.gz VXOXLAJWHZMQPC-IBGZPJMESA-N 0 3 417.347 4.002 20 0 HIADHN CCN1CCN(c2ccc(N[C@H](C)C(=O)NC34CC5CC(CC(C5)C3)C4)c(C)c2)CC1 ZINC000493978690 905324121 /nfs/dbraw/zinc/32/41/21/905324121.db2.gz YICWZKISASRTQY-MWMKELGTSA-N 0 3 424.633 4.022 20 0 HIADHN Cc1cc(C[C@@H](C)N[C@H](c2ccc(Cl)cc2)c2cccc(S(C)(=O)=O)c2)[nH]n1 ZINC000493989321 905331048 /nfs/dbraw/zinc/33/10/48/905331048.db2.gz KPNFMJLNDCLWNN-SPLOXXLWSA-N 0 3 417.962 4.085 20 0 HIADHN Cc1cc(C[C@@H](C)N[C@H](c2ccc(Cl)cc2)c2cccc(S(C)(=O)=O)c2)n[nH]1 ZINC000493989321 905331070 /nfs/dbraw/zinc/33/10/70/905331070.db2.gz KPNFMJLNDCLWNN-SPLOXXLWSA-N 0 3 417.962 4.085 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](N[C@@H]2CCOC3(CCC3)C2)c2ccc(F)c(F)c2)c1 ZINC000493989587 905333285 /nfs/dbraw/zinc/33/32/85/905333285.db2.gz LYBXTYCHNOPAQH-UTKZUKDTSA-N 0 3 421.509 4.149 20 0 HIADHN Cc1cc(C(=O)N[C@H]2CCN(Cc3ccccc3)[C@H]2C)ccc1NC(=O)CC(C)C ZINC000493998516 905341536 /nfs/dbraw/zinc/34/15/36/905341536.db2.gz DODVWYFPMCRMEV-CVDCTZTESA-N 0 3 407.558 4.372 20 0 HIADHN C[C@H]1C[C@@H](N2CCOCC2)CN1Cc1c(-c2ccc(Cl)cc2)nc2sccn12 ZINC000512408216 921141327 /nfs/dbraw/zinc/14/13/27/921141327.db2.gz CJUUIIOSFZEIIN-MAUKXSAKSA-N 0 3 416.978 4.011 20 0 HIADHN C[C@H]1[C@H](NC(=O)Cc2csc(Cc3ccccc3)n2)CCN1Cc1ccccc1 ZINC000494019973 905360033 /nfs/dbraw/zinc/36/00/33/905360033.db2.gz WQGWVABRKKBHAX-PGRDOPGGSA-N 0 3 405.567 4.056 20 0 HIADHN CC(C)[C@@H]1OCCC[C@@H]1CN[C@H](c1ccc(F)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000494021427 905363392 /nfs/dbraw/zinc/36/33/92/905363392.db2.gz WLIKQYFZTRKKMD-PTUXOGIPSA-N 0 3 419.562 4.359 20 0 HIADHN CCCC(=O)NC[C@H]1CCCN(Cc2c(C)nn(Cc3ccc(Cl)cc3)c2C)C1 ZINC000512409776 921142130 /nfs/dbraw/zinc/14/21/30/921142130.db2.gz OXZCGMAIGWJXPL-HXUWFJFHSA-N 0 3 416.997 4.330 20 0 HIADHN O[C@@H](CN[C@@H](c1ccc(Cl)cc1)c1ccc(OC(F)F)cc1)C1CCOCC1 ZINC000494050802 905388218 /nfs/dbraw/zinc/38/82/18/905388218.db2.gz TWFSPTAKDYJCMW-PMACEKPBSA-N 0 3 411.876 4.408 20 0 HIADHN CC(C)CC(=O)Nc1ccc(C(=O)N[C@@H]2CCN(Cc3ccccc3)[C@H]2C)cc1F ZINC000494070295 905408760 /nfs/dbraw/zinc/40/87/60/905408760.db2.gz WISGXWMMGUYSHA-LAUBAEHRSA-N 0 3 411.521 4.203 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N[C@H](C)c2nc(C(F)(F)F)cs2)N(C)C)cc1 ZINC000494175635 905510962 /nfs/dbraw/zinc/51/09/62/905510962.db2.gz JMABFJHSVMAQSI-DOMZBBRYSA-N 0 3 414.497 4.387 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)N[C@H](C)c2nc(C(F)(F)F)cs2)N(C)C)cc1 ZINC000494175636 905511432 /nfs/dbraw/zinc/51/14/32/905511432.db2.gz JMABFJHSVMAQSI-IUODEOHRSA-N 0 3 414.497 4.387 20 0 HIADHN CCCc1ccc([C@H](NC(=O)N2CCN(C3CCOCC3)C[C@@H]2C)C(C)C)cc1 ZINC000494194598 905529350 /nfs/dbraw/zinc/52/93/50/905529350.db2.gz IRSNLLWIXGBMFL-WMZHIEFXSA-N 0 3 401.595 4.231 20 0 HIADHN O=C(Nc1ccccc1OC1CCCC1)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1CO ZINC000494203446 905536016 /nfs/dbraw/zinc/53/60/16/905536016.db2.gz CQKAYYFIWFFOSK-IFMALSPDSA-N 0 3 423.557 4.013 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N2CCC[C@@H]2CCCc2ccccc2)CC1 ZINC000494396758 905690837 /nfs/dbraw/zinc/69/08/37/905690837.db2.gz KDHUIKILXCDGDP-QHCPKHFHSA-N 0 3 401.595 4.073 20 0 HIADHN COc1cc(CN2CCC[C@H](CNC(=O)C(C)C)C2)ccc1OCc1ccccc1 ZINC000512449030 921168544 /nfs/dbraw/zinc/16/85/44/921168544.db2.gz ARPKMMFXFJMDGX-JOCHJYFZSA-N 0 3 410.558 4.258 20 0 HIADHN Cc1ccnc(-c2nnc([C@@H](C)[NH2+][C@H](C)CCc3ccc(OC(F)F)cc3)[n-]2)c1 ZINC000494429884 905716488 /nfs/dbraw/zinc/71/64/88/905716488.db2.gz YBVABVFOHWWZKX-HUUCEWRRSA-N 0 3 401.461 4.448 20 0 HIADHN C[C@H](N[C@H]1CCO[C@H]1c1ccc(Cl)cc1)C(=O)NC12CC3CC(CC(C3)C1)C2 ZINC000494466128 905748350 /nfs/dbraw/zinc/74/83/50/905748350.db2.gz OMPSBVRDDLYUSR-YMMYAYQSSA-N 0 3 402.966 4.233 20 0 HIADHN Cc1cccc(S(=O)(=O)CCCN[C@H]2CCO[C@@H]2c2ccc(Cl)c(F)c2)c1 ZINC000494477751 905759255 /nfs/dbraw/zinc/75/92/55/905759255.db2.gz ROBGSORAWDCIJZ-VQTJNVASSA-N 0 3 411.926 4.071 20 0 HIADHN COc1ccc(CN2CCC[C@H](CNC(=O)C(C)C)C2)cc1OCc1ccccc1 ZINC000512456819 921174430 /nfs/dbraw/zinc/17/44/30/921174430.db2.gz OSBAGPCZPQHKTK-JOCHJYFZSA-N 0 3 410.558 4.258 20 0 HIADHN CN(CC(=O)N(Cc1ccc(F)cc1)C12CC3CC(CC(C3)C1)C2)C[C@H]1CCOC1 ZINC000494564962 905838892 /nfs/dbraw/zinc/83/88/92/905838892.db2.gz MTZJXUGRYPEKCJ-WGSOPFKKSA-N 0 3 414.565 4.091 20 0 HIADHN FC(F)(F)c1ccc(Cn2cc(CNC[C@H](c3ccco3)N3CCCC3)cn2)cc1 ZINC000494584464 905850500 /nfs/dbraw/zinc/85/05/00/905850500.db2.gz HLGRYKPKAMPARS-HXUWFJFHSA-N 0 3 418.463 4.470 20 0 HIADHN Cc1cc(NC(=O)Nc2cc([C@@H]3C[C@@H]3C)[nH]n2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000494648147 905881434 /nfs/dbraw/zinc/88/14/34/905881434.db2.gz KKHGJRHGVMTDJA-KFKAGJAMSA-N 0 3 419.533 4.129 20 0 HIADHN COc1c(Cl)cc(NC(=O)c2ccc(CN3CCC(CO)CC3)cc2)cc1Cl ZINC000494667648 905892012 /nfs/dbraw/zinc/89/20/12/905892012.db2.gz ZZUWNYPFOQTBNG-UHFFFAOYSA-N 0 3 423.340 4.459 20 0 HIADHN CC1CCN(CCNC(=O)c2ccc(CSc3nc4ccccc4[nH]3)cc2)CC1 ZINC000512481256 921189447 /nfs/dbraw/zinc/18/94/47/921189447.db2.gz SZNJTDMGQLUZSI-UHFFFAOYSA-N 0 3 408.571 4.317 20 0 HIADHN C[C@@H](c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCN(C[C@H]2CCOC2)CC1 ZINC000494705411 905911652 /nfs/dbraw/zinc/91/16/52/905911652.db2.gz ZDKWOOAYJFHCTE-UONOGXRCSA-N 0 3 410.402 4.439 20 0 HIADHN CN(C)CCN(Cc1cccc(O)c1)C(=O)[C@H]1C[C@@H]1c1cccc(Cl)c1Cl ZINC000494781757 905982845 /nfs/dbraw/zinc/98/28/45/905982845.db2.gz XNKYUJKVPOENNB-MSOLQXFVSA-N 0 3 407.341 4.393 20 0 HIADHN CN(C)CCN(Cc1cccc(O)c1)C(=O)c1csc(-c2ccc(Cl)cc2)n1 ZINC000494783567 905984721 /nfs/dbraw/zinc/98/47/21/905984721.db2.gz RKHXRCMIDYHPAM-UHFFFAOYSA-N 0 3 415.946 4.373 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3ccccc3O[C@H](C)C(F)(F)F)cc2)CC1 ZINC000494794623 905997040 /nfs/dbraw/zinc/99/70/40/905997040.db2.gz YQNBHFDTGJSEGK-MRXNPFEDSA-N 0 3 421.463 4.410 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)c2cccc(COC3CCOCC3)c2)CC1 ZINC000494902872 906077600 /nfs/dbraw/zinc/07/76/00/906077600.db2.gz KGYALHSPJBZRTP-UHFFFAOYSA-N 0 3 422.569 4.119 20 0 HIADHN CC(C)Sc1ccc([C@H](C)NC(=O)N2CCN(C3CCOCC3)C[C@H]2C)cc1 ZINC000494922641 906095899 /nfs/dbraw/zinc/09/58/99/906095899.db2.gz XXLUMUDUSKMDBJ-MSOLQXFVSA-N 0 3 405.608 4.143 20 0 HIADHN CCN1CCC[C@@H](CN(C)C(=O)Nc2cccc(F)c2Cl)[C@@H]1c1cnn(C)c1 ZINC000494966914 906135256 /nfs/dbraw/zinc/13/52/56/906135256.db2.gz CEJISFZDSBPEAH-IFXJQAMLSA-N 0 3 407.921 4.150 20 0 HIADHN CO[C@@H]1CCC[C@@H]1CN[C@@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000494966801 906135585 /nfs/dbraw/zinc/13/55/85/906135585.db2.gz BHSGMXRFXDCTGC-UIFIKXQLSA-N 0 3 407.963 4.238 20 0 HIADHN C[C@H](NC(=O)N(Cc1ccccc1)C1CCN(C)CC1)[C@@H]1OCCc2sccc21 ZINC000494970568 906139759 /nfs/dbraw/zinc/13/97/59/906139759.db2.gz CZOXGWQAWYSIFY-JTSKRJEESA-N 0 3 413.587 4.056 20 0 HIADHN C[C@@H](CNC(=O)NCc1nc(-c2ccccc2F)cs1)N(C)Cc1ccccc1 ZINC000495007888 906167616 /nfs/dbraw/zinc/16/76/16/906167616.db2.gz PZZINSOIYANPEH-INIZCTEOSA-N 0 3 412.534 4.269 20 0 HIADHN COc1cc(C)c(NC(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)c(C)c1C ZINC000495006649 906167920 /nfs/dbraw/zinc/16/79/20/906167920.db2.gz GSTYKTHQSKKODR-UHFFFAOYSA-N 0 3 405.489 4.494 20 0 HIADHN COc1cc(C)c(NC(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)c(C)c1C ZINC000495008545 906168868 /nfs/dbraw/zinc/16/88/68/906168868.db2.gz MHFUAUVSCPKFSX-HDICACEKSA-N 0 3 417.594 4.364 20 0 HIADHN COc1cccc([C@H](CNC(=O)N[C@@H](C)CCCC(F)(F)F)N2CCCC2)c1 ZINC000495013326 906171351 /nfs/dbraw/zinc/17/13/51/906171351.db2.gz ASBPWICSZHIAEK-YJBOKZPZSA-N 0 3 401.473 4.252 20 0 HIADHN Cc1ccc(-c2c[nH]cc2C(=O)NCCCN2CCN(C)C[C@@H]2c2ccccc2)s1 ZINC000495036802 906192461 /nfs/dbraw/zinc/19/24/61/906192461.db2.gz OIKZQPNJGFRYOU-JOCHJYFZSA-N 0 3 422.598 4.160 20 0 HIADHN Cc1ccc([C@@H](NCCc2ccncc2C)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000495041577 906196821 /nfs/dbraw/zinc/19/68/21/906196821.db2.gz AMNATOOJPZHZRB-DEOSSOPVSA-N 0 3 408.567 4.332 20 0 HIADHN Cc1cnccc1CCN[C@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000495043138 906198423 /nfs/dbraw/zinc/19/84/23/906198423.db2.gz DIEDNZYKTRRCKF-JOCHJYFZSA-N 0 3 414.958 4.369 20 0 HIADHN FC(F)(F)c1cnc(OCCN[C@@H](c2nc[nH]n2)C2CCCCC2)c(Cl)c1 ZINC000495053007 906207226 /nfs/dbraw/zinc/20/72/26/906207226.db2.gz YUJWGDSFUIHZJB-CQSZACIVSA-N 0 3 403.836 4.162 20 0 HIADHN FC(F)(F)c1cnc(OCC[NH2+][C@@H](c2nnc[n-]2)C2CCCCC2)c(Cl)c1 ZINC000495053007 906207243 /nfs/dbraw/zinc/20/72/43/906207243.db2.gz YUJWGDSFUIHZJB-CQSZACIVSA-N 0 3 403.836 4.162 20 0 HIADHN CCc1ccc([C@H](NCCc2ccncc2C)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000495053355 906207445 /nfs/dbraw/zinc/20/74/45/906207445.db2.gz XLMRGACRCVTBCZ-DEOSSOPVSA-N 0 3 408.567 4.278 20 0 HIADHN Brc1ccccc1[C@H](N[C@@H]1CCO[C@]2(CCOC2)C1)c1ccccc1 ZINC000495063007 906214937 /nfs/dbraw/zinc/21/49/37/906214937.db2.gz GKRMKSJSRYSSBT-DUXKGJEZSA-N 0 3 402.332 4.466 20 0 HIADHN FC(F)(F)Oc1cccc(N2CC[C@@H](N[C@H](c3nc[nH]n3)C3CCCCC3)C2)c1 ZINC000495062164 906215148 /nfs/dbraw/zinc/21/51/48/906215148.db2.gz AIOGBBXOTGCIMR-QAPCUYQASA-N 0 3 409.456 4.193 20 0 HIADHN FC(F)(F)Oc1cccc(N2CC[C@H](N[C@H](c3nc[nH]n3)C3CCCCC3)C2)c1 ZINC000495062165 906215730 /nfs/dbraw/zinc/21/57/30/906215730.db2.gz AIOGBBXOTGCIMR-YJBOKZPZSA-N 0 3 409.456 4.193 20 0 HIADHN Cc1ccccc1NC(=O)C[C@@H](C)N[C@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O ZINC000495181159 906290926 /nfs/dbraw/zinc/29/09/26/906290926.db2.gz CFKHJSWTRZDHKL-KUHUBIRLSA-N 0 3 420.340 4.414 20 0 HIADHN CC(C)(C)[C@H](CN1CCc2ccccc2C1)NC(=O)N1CCCC2(CCOCC2)C1 ZINC000495231651 906323216 /nfs/dbraw/zinc/32/32/16/906323216.db2.gz IUPFCGIMFCKWDT-QFIPXVFZSA-N 0 3 413.606 4.062 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)Cc3cscc3Br)c2)CC1 ZINC000495365771 906407392 /nfs/dbraw/zinc/40/73/92/906407392.db2.gz MPXRFMAPEFPLJX-UHFFFAOYSA-N 0 3 422.392 4.222 20 0 HIADHN O=C(Nc1ccc(OC2CCC2)c(F)c1)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000495394439 906423670 /nfs/dbraw/zinc/42/36/70/906423670.db2.gz IXLOAVIYNMJANW-UHFFFAOYSA-N 0 3 412.505 4.214 20 0 HIADHN CCCNC(=O)[C@@H]1CCCN(Cc2ccc(OCc3ccc(F)cc3)c(OC)c2)C1 ZINC000512557080 921234856 /nfs/dbraw/zinc/23/48/56/921234856.db2.gz KZXISWFGLOJLHR-HXUWFJFHSA-N 0 3 414.521 4.152 20 0 HIADHN COc1ccc(OC)c(NC(=O)C[C@@H](C)N[C@H]2CCCOc3c(F)cccc32)c1 ZINC000495435513 906450650 /nfs/dbraw/zinc/45/06/50/906450650.db2.gz XOBLGXDFQDNOCS-KDOFPFPSSA-N 0 3 402.466 4.064 20 0 HIADHN O=C(Nc1cccc(-c2ccccc2)c1)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1CO ZINC000495580151 906508179 /nfs/dbraw/zinc/50/81/79/906508179.db2.gz ZGBFILKNOZNADQ-UKILVPOCSA-N 0 3 415.537 4.358 20 0 HIADHN CS[C@H]1CN(C(=O)c2csc(-c3ccc(Cl)cc3Cl)n2)C[C@H]1N(C)C ZINC000495728400 906534847 /nfs/dbraw/zinc/53/48/47/906534847.db2.gz NNNVLPRXDWMXPA-CABCVRRESA-N 0 3 416.399 4.235 20 0 HIADHN Cc1nc(Cc2ccc(F)cc2)sc1C(=O)N(CCN(C)C)Cc1ccccc1 ZINC000495916926 906577071 /nfs/dbraw/zinc/57/70/71/906577071.db2.gz BOFIMRLRNQMOPJ-UHFFFAOYSA-N 0 3 411.546 4.385 20 0 HIADHN Cc1noc(C)c1COc1ccc(CC(=O)N(CCN(C)C)Cc2ccccc2)cc1 ZINC000496028422 906600801 /nfs/dbraw/zinc/60/08/01/906600801.db2.gz LWMOZCKIYDLUNJ-UHFFFAOYSA-N 0 3 421.541 4.003 20 0 HIADHN COc1cccc(C[C@H](C)NC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)c1 ZINC000496260305 906640397 /nfs/dbraw/zinc/64/03/97/906640397.db2.gz BVMYJPRJSRWBID-JTSKRJEESA-N 0 3 420.475 4.197 20 0 HIADHN O=C(COc1ccc(Cl)cc1)NC1CCC(N[C@H]2COc3ccc(F)cc32)CC1 ZINC000512595221 921253551 /nfs/dbraw/zinc/25/35/51/921253551.db2.gz LLNLAVMGQKIURY-UHYCVJNDSA-N 0 3 418.896 4.009 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)c1cnn(-c2ccc(Cl)cc2)c1 ZINC000496270109 906644310 /nfs/dbraw/zinc/64/43/10/906644310.db2.gz CLWAPSGZCYTBIV-QFIPXVFZSA-N 0 3 423.948 4.047 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)c1csc(-c2ccc(F)cc2)n1 ZINC000496423894 906675675 /nfs/dbraw/zinc/67/56/75/906675675.db2.gz MIBGEWLCRDDPBY-UHFFFAOYSA-N 0 3 401.482 4.292 20 0 HIADHN CCN(CC)[C@H](C(=O)N[C@H](C)c1n[nH]c(C(C)C)n1)c1cccc(C(F)(F)F)c1 ZINC000496552993 906708398 /nfs/dbraw/zinc/70/83/98/906708398.db2.gz LNCUKXAXZOYGGD-CJNGLKHVSA-N 0 3 411.472 4.207 20 0 HIADHN CCN(CC)[C@@H](C(=O)N[C@@H](C)c1n[nH]c(C(C)C)n1)c1cccc(C(F)(F)F)c1 ZINC000496553000 906708704 /nfs/dbraw/zinc/70/87/04/906708704.db2.gz LNCUKXAXZOYGGD-XJKSGUPXSA-N 0 3 411.472 4.207 20 0 HIADHN O=C(c1ccc(C(F)(F)F)cn1)N(CCN1CCCC1)Cc1ccc(Cl)cc1 ZINC000496784652 906755648 /nfs/dbraw/zinc/75/56/48/906755648.db2.gz HUVNSTRZNQCERP-UHFFFAOYSA-N 0 3 411.855 4.492 20 0 HIADHN O=C(c1ccc(-c2ncon2)cc1)N(CCN1CCCC1)Cc1ccc(Cl)cc1 ZINC000496801662 906758210 /nfs/dbraw/zinc/75/82/10/906758210.db2.gz CMBYBGPJMYIGQR-UHFFFAOYSA-N 0 3 410.905 4.128 20 0 HIADHN CCN1CCC[C@H]1CNC(=O)[C@H](C)SCc1ncc(-c2ccc(Cl)cc2)o1 ZINC000497017347 906793502 /nfs/dbraw/zinc/79/35/02/906793502.db2.gz DKZRMFOKIRCDSE-YOEHRIQHSA-N 0 3 407.967 4.217 20 0 HIADHN COc1cc(CN2CCC[C@H](c3ccc(F)cc3)CC2)cc(Cl)c1OCC(N)=O ZINC000497135709 906811798 /nfs/dbraw/zinc/81/17/98/906811798.db2.gz YKFYSWOEUMWNQW-INIZCTEOSA-N 0 3 420.912 4.122 20 0 HIADHN CC(C)c1noc2nc(C3CC3)cc(C(=O)NC[C@H](Cc3ccccc3)N(C)C)c21 ZINC000497324147 906832794 /nfs/dbraw/zinc/83/27/94/906832794.db2.gz DOWQVHOHAVPPSF-SFHVURJKSA-N 0 3 406.530 4.126 20 0 HIADHN Cc1c(C(=O)N(Cc2ccco2)C2CCN(C)CC2)cnn1-c1ccc(Cl)cc1 ZINC000497356296 906848901 /nfs/dbraw/zinc/84/89/01/906848901.db2.gz VIEIWWVHSPNRSA-UHFFFAOYSA-N 0 3 412.921 4.164 20 0 HIADHN CN1C[C@@H](NC(=O)c2ccc(NC(=O)Nc3ccccc3)cc2)[C@@H](c2ccccc2)C1 ZINC000497388557 906874252 /nfs/dbraw/zinc/87/42/52/906874252.db2.gz UNBHLFMYOSHWAW-DHIUTWEWSA-N 0 3 414.509 4.158 20 0 HIADHN O=C(Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1)c1ncoc1C1CC1 ZINC000497401340 906881505 /nfs/dbraw/zinc/88/15/05/906881505.db2.gz ZMPGOWKKAAUJNI-UHFFFAOYSA-N 0 3 416.525 4.169 20 0 HIADHN C[C@H]1CN(C(=O)c2cc3sc4ccccc4c3s2)CC[C@H]1N1CCN(C)CC1 ZINC000497479215 906961114 /nfs/dbraw/zinc/96/11/14/906961114.db2.gz YUKZUXMMASIUPI-DOTOQJQBSA-N 0 3 413.612 4.214 20 0 HIADHN O=C(CC1(N2CCOCC2)CCCC1)N1CCc2ccccc2[C@H]1c1ccccc1 ZINC000512672378 921282895 /nfs/dbraw/zinc/28/28/95/921282895.db2.gz KDGFCRCNNYWFQS-RUZDIDTESA-N 0 3 404.554 4.196 20 0 HIADHN COc1ccccc1[C@H](NC(=O)N1CC[C@H]2CCN(C)C[C@H]21)c1ccccc1Cl ZINC000497498662 906984937 /nfs/dbraw/zinc/98/49/37/906984937.db2.gz AEQLMKCPUSDJIE-BSLALVQMSA-N 0 3 413.949 4.174 20 0 HIADHN COc1ccc(CNC(=O)C2CCN(Cc3ccc(Cl)c4cccnc34)CC2)cc1 ZINC000512687550 921287111 /nfs/dbraw/zinc/28/71/11/921287111.db2.gz UCPKCUGJHDTSFW-UHFFFAOYSA-N 0 3 423.944 4.425 20 0 HIADHN CN(C)C(=O)c1ccc(CN(C)CCCCCc2cc(-c3cccc(F)c3)no2)[nH]1 ZINC000512702036 921292481 /nfs/dbraw/zinc/29/24/81/921292481.db2.gz ZGMIEJUVNVHCND-UHFFFAOYSA-N 0 3 412.509 4.355 20 0 HIADHN C[C@H](NC(=O)N[C@@H](CN1CCc2ccccc2C1)C(C)(C)C)c1c(F)cncc1F ZINC000497607349 907086507 /nfs/dbraw/zinc/08/65/07/907086507.db2.gz ACXSYMPGDNRBQH-YWZLYKJASA-N 0 3 416.516 4.193 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)N(Cc1ccccc1)c1ccncc1 ZINC000497616587 907095102 /nfs/dbraw/zinc/09/51/02/907095102.db2.gz IYEGINCHBXCADZ-UHFFFAOYSA-N 0 3 414.553 4.217 20 0 HIADHN CC(C)Cn1ncc(NC(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)c1C1CC1 ZINC000497659239 907149661 /nfs/dbraw/zinc/14/96/61/907149661.db2.gz CHMIPJVHLOEWOE-LJQANCHMSA-N 0 3 403.958 4.494 20 0 HIADHN CC(C)(C)c1cnc(CNC(=O)N[C@@H](CN2CCc3ccccc3C2)C(C)(C)C)o1 ZINC000497659559 907152044 /nfs/dbraw/zinc/15/20/44/907152044.db2.gz JSCQNVZUEBIRBM-IBGZPJMESA-N 0 3 412.578 4.244 20 0 HIADHN CS[C@H]1CN(C(=O)Nc2cc(C)ccc2SCC(F)(F)F)C[C@@H]1N(C)C ZINC000497671543 907172194 /nfs/dbraw/zinc/17/21/94/907172194.db2.gz YSDSTTRJTYUHLC-ZFWWWQNUSA-N 0 3 407.527 4.159 20 0 HIADHN CCOc1cc(C[NH2+]C[C@@H](c2ccc(OC)cc2)N2CCCC2)cc(Cl)c1[O-] ZINC000497675082 907177571 /nfs/dbraw/zinc/17/75/71/907177571.db2.gz CQYBAADLRAIVHW-FQEVSTJZSA-N 0 3 404.938 4.380 20 0 HIADHN CC[C@@H](CNC(=O)Nc1cnn(CC(C)C)c1C1CC1)N1CCc2ccccc2C1 ZINC000497676254 907179201 /nfs/dbraw/zinc/17/92/01/907179201.db2.gz HLRBKNIGKLFOCX-NRFANRHFSA-N 0 3 409.578 4.375 20 0 HIADHN COc1cccc(C2=CCN(C(=O)Nc3ccc(CCN4CCSCC4)cc3)C2)c1 ZINC000497688218 907192458 /nfs/dbraw/zinc/19/24/58/907192458.db2.gz SAFMSINGOJTGBF-UHFFFAOYSA-N 0 3 423.582 4.218 20 0 HIADHN C[C@H](NC(=O)N[C@H]1CCN(Cc2ccccc2)[C@@H]1C)c1ncc(-c2ccccc2)o1 ZINC000497724190 907224187 /nfs/dbraw/zinc/22/41/87/907224187.db2.gz ADYZRXZANGGIIW-UEXGIBASSA-N 0 3 404.514 4.365 20 0 HIADHN Cc1noc(C)c1C[C@H](C)NC(=O)NC[C@H](c1ccc(CC(C)C)cc1)N(C)C ZINC000497732162 907229800 /nfs/dbraw/zinc/22/98/00/907229800.db2.gz WIHNRTACCINYCA-KSFYIVLOSA-N 0 3 400.567 4.023 20 0 HIADHN O=C(CCN(Cc1cccc(F)c1)C[C@H]1CCCO1)NCc1ccccc1Cl ZINC000497732126 907230280 /nfs/dbraw/zinc/23/02/80/907230280.db2.gz WBEVJOBMGXPQNU-HXUWFJFHSA-N 0 3 404.913 4.167 20 0 HIADHN CC(C)(C)[C@H](NC[C@H](O)COc1ccc2c(c1)CCC(=O)N2)c1cc2ccccc2o1 ZINC000497811679 907295299 /nfs/dbraw/zinc/29/52/99/907295299.db2.gz FRSCRASOJBGQIJ-MHECFPHRSA-N 0 3 422.525 4.434 20 0 HIADHN CCc1ccc([C@H](CNC(=O)c2cccc(Cn3nc(C)cc3C)c2)N(C)C)cc1 ZINC000497810102 907295426 /nfs/dbraw/zinc/29/54/26/907295426.db2.gz YMEWHHIIIOVBHM-DEOSSOPVSA-N 0 3 404.558 4.143 20 0 HIADHN C[C@H](NC(=O)N(Cc1ccccc1)C1CCN(C)CC1)c1nccn1-c1ccccc1 ZINC000512797754 921313071 /nfs/dbraw/zinc/31/30/71/921313071.db2.gz NYXBMIGJXJRXMW-FQEVSTJZSA-N 0 3 417.557 4.239 20 0 HIADHN Cc1ccc(-n2cc(CN3CCC(c4ccnn4CCO)CC3)c(C(C)(C)C)n2)cc1 ZINC000512801752 921314261 /nfs/dbraw/zinc/31/42/61/921314261.db2.gz NYXYXHCUCUPMHS-UHFFFAOYSA-N 0 3 421.589 4.047 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)[C@@H](c3ccccc3)C3CC3)CC2)c1 ZINC000497896636 907369038 /nfs/dbraw/zinc/36/90/38/907369038.db2.gz UNOYQTQSYZZJGR-VWLOTQADSA-N 0 3 405.586 4.207 20 0 HIADHN COc1ccc([C@@H](CNC(=O)Cc2ccc(OC(F)(F)F)cc2)N2CCCC2)cc1 ZINC000497992224 907472671 /nfs/dbraw/zinc/47/26/71/907472671.db2.gz ACQAGAXDROOASA-HXUWFJFHSA-N 0 3 422.447 4.090 20 0 HIADHN COc1ccc([C@H](CNC(=O)C[C@@H]2CCCc3cc(OC)ccc32)N2CCCC2)cc1 ZINC000497994546 907473974 /nfs/dbraw/zinc/47/39/74/907473974.db2.gz QQGAEFBHZAKOEE-OFVILXPXSA-N 0 3 422.569 4.467 20 0 HIADHN CCN(C(=O)c1cncc(Br)c1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000498007358 907495552 /nfs/dbraw/zinc/49/55/52/907495552.db2.gz AKFMOBSRUFOSQW-HNAYVOBHSA-N 0 3 402.336 4.142 20 0 HIADHN Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000498009881 907499728 /nfs/dbraw/zinc/49/97/28/907499728.db2.gz DNQVEOFERWJAOF-JOCHJYFZSA-N 0 3 422.573 4.167 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)N(CC(C)C)[C@H](C)c2ccccc2Cl)CC1 ZINC000498031274 907532895 /nfs/dbraw/zinc/53/28/95/907532895.db2.gz USLIZENPMHDLGD-WOJBJXKFSA-N 0 3 423.045 4.342 20 0 HIADHN Cc1nc(-c2ccc(F)cc2)sc1C(=O)NCCCN1CCc2ccccc2C1 ZINC000498044299 907552433 /nfs/dbraw/zinc/55/24/33/907552433.db2.gz BZMQEKBLRIDXNB-UHFFFAOYSA-N 0 3 409.530 4.436 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)[C@H]1C[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000498060820 907573031 /nfs/dbraw/zinc/57/30/31/907573031.db2.gz FDQYAHOIIRCAQX-SFTDATJTSA-N 0 3 402.460 4.374 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)N[C@@H](c1cccc(F)c1)c1ccccn1 ZINC000498222754 907753028 /nfs/dbraw/zinc/75/30/28/907753028.db2.gz XNMZOCIMQYAXLA-DEOSSOPVSA-N 0 3 418.516 4.058 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N[C@H](c2cccc(C)c2)c2ccccn2)N(C)C)cc1 ZINC000498253063 907790686 /nfs/dbraw/zinc/79/06/86/907790686.db2.gz OZKXEEOUKKKIEM-BJKOFHAPSA-N 0 3 402.542 4.390 20 0 HIADHN CC[C@@H](NCc1ccc(OCc2ccc(F)cc2)c(OC)c1)[C@@H](O)C(F)(F)F ZINC000498353211 907853715 /nfs/dbraw/zinc/85/37/15/907853715.db2.gz LQTPQMJPJACDGT-VQIMIIECSA-N 0 3 401.400 4.205 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)N[C@@H]2COc3c2ccc(Cl)c3Cl)cc1 ZINC000498412501 907888949 /nfs/dbraw/zinc/88/89/49/907888949.db2.gz AWWKSTICAWNNBI-DLBZAZTESA-N 0 3 424.328 4.038 20 0 HIADHN CN(C)CCN(C(=O)CCc1nc2ccccc2n1-c1ccccc1)C1CCCC1 ZINC000498451294 907916050 /nfs/dbraw/zinc/91/60/50/907916050.db2.gz GDGDKGAJFIFPDH-UHFFFAOYSA-N 0 3 404.558 4.291 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F ZINC000498485491 907955805 /nfs/dbraw/zinc/95/58/05/907955805.db2.gz SAMKYUZJPSUGJP-DLBZAZTESA-N 0 3 412.521 4.287 20 0 HIADHN CC(C)c1nc(C(=O)N(CCN(C)C)c2ccccc2)nn1-c1ccccc1Cl ZINC000498497175 907970877 /nfs/dbraw/zinc/97/08/77/907970877.db2.gz PMXGYHCKOQXQBT-UHFFFAOYSA-N 0 3 411.937 4.253 20 0 HIADHN CN(C)Cc1cccc(C(=O)Nc2nc3c(s2)CN(Cc2ccccc2)CC3)c1 ZINC000498599988 908049784 /nfs/dbraw/zinc/04/97/84/908049784.db2.gz LANQBMBNFTZYOY-UHFFFAOYSA-N 0 3 406.555 4.015 20 0 HIADHN Cc1ccccc1-c1cc(C(=O)N2CCN(C)CC[C@H]2C)c2cnn(C(C)C)c2n1 ZINC000498711289 908135972 /nfs/dbraw/zinc/13/59/72/908135972.db2.gz SUYSRUACMQPWLC-GOSISDBHSA-N 0 3 405.546 4.154 20 0 HIADHN CC[C@@H](C)n1ncc2c1nc(C)cc2C(=O)N(CCN(C)C)Cc1ccc(F)cc1 ZINC000498720249 908145170 /nfs/dbraw/zinc/14/51/70/908145170.db2.gz PDMSFKSQONAQPU-QGZVFWFLSA-N 0 3 411.525 4.054 20 0 HIADHN C[C@H]1[C@H](NC(=O)NCc2ccc(-c3cccnc3)cc2)CCN1Cc1ccccc1 ZINC000498719309 908145588 /nfs/dbraw/zinc/14/55/88/908145588.db2.gz QEJYWSZWGFIAJP-YADARESESA-N 0 3 400.526 4.211 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)c1csc(-c2ccccc2F)n1 ZINC000498725383 908152210 /nfs/dbraw/zinc/15/22/10/908152210.db2.gz VWGAOSNIGWDYTF-SFHVURJKSA-N 0 3 424.545 4.471 20 0 HIADHN CC(C)c1ccc(NC(=O)N2CCC[C@H](CN3CCN(c4ccccn4)CC3)C2)cc1 ZINC000498827189 908235286 /nfs/dbraw/zinc/23/52/86/908235286.db2.gz DCYLFIGGFGTOIQ-OAQYLSRUSA-N 0 3 421.589 4.271 20 0 HIADHN C[C@H](NC(=O)NCc1csc(CCc2ccccc2)n1)[C@@H](c1ccccc1)N(C)C ZINC000498907977 908316563 /nfs/dbraw/zinc/31/65/63/908316563.db2.gz PUEUYXVRSDTIKO-MBSDFSHPSA-N 0 3 422.598 4.419 20 0 HIADHN CCN1C[C@H](C)N(CC(=O)Nc2nc(-c3c(C)cc(C)cc3C)cs2)C[C@H]1C ZINC000498910053 908319173 /nfs/dbraw/zinc/31/91/73/908319173.db2.gz BRIGKSXMYFKJLY-MSOLQXFVSA-N 0 3 400.592 4.088 20 0 HIADHN CCc1ccccc1N(C(C)=O)c1nc(CN2C[C@H](C)N(CC)C[C@H]2C)cs1 ZINC000498913314 908321375 /nfs/dbraw/zinc/32/13/75/908321375.db2.gz GIGWOCWSOZHQSO-DLBZAZTESA-N 0 3 400.592 4.305 20 0 HIADHN FC(F)(F)c1cccc(-c2noc(CN3CCC[C@H](c4nc(C5CC5)n[nH]4)C3)n2)c1 ZINC000498915041 908324010 /nfs/dbraw/zinc/32/40/10/908324010.db2.gz KVMHMDRYPCFKSP-AWEZNQCLSA-N 0 3 418.423 4.131 20 0 HIADHN FC(F)(F)c1cccc(-c2noc(CN3CCC[C@H](c4n[nH]c(C5CC5)n4)C3)n2)c1 ZINC000498915041 908324025 /nfs/dbraw/zinc/32/40/25/908324025.db2.gz KVMHMDRYPCFKSP-AWEZNQCLSA-N 0 3 418.423 4.131 20 0 HIADHN CCN(Cc1ccc(OCc2ccccc2)cc1)C(=O)CN1C[C@H](C)N(CC)C[C@@H]1C ZINC000498927050 908335716 /nfs/dbraw/zinc/33/57/16/908335716.db2.gz TYZBKZLXYVTIIJ-VXKWHMMOSA-N 0 3 423.601 4.029 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)N[C@H](c1cccc(F)c1)c1ccccn1 ZINC000499086475 908449154 /nfs/dbraw/zinc/44/91/54/908449154.db2.gz ZAWKXZRUAIGLJO-BJKOFHAPSA-N 0 3 418.516 4.446 20 0 HIADHN COc1ccc(CCC(=O)NC[C@@H](c2ccc(C)cc2)N(C)C)cc1Br ZINC000499150557 908509321 /nfs/dbraw/zinc/50/93/21/908509321.db2.gz OFQWUJRLHVELOD-IBGZPJMESA-N 0 3 419.363 4.118 20 0 HIADHN Cc1cc(CSc2ncccc2C(=O)NC[C@H](c2ccc(C)cc2)N(C)C)no1 ZINC000499167488 908520051 /nfs/dbraw/zinc/52/00/51/908520051.db2.gz KYFGQZXTMQYGDR-HXUWFJFHSA-N 0 3 410.543 4.011 20 0 HIADHN CC[C@H](NC(=O)N[C@@H]1C[C@@H](C)N(Cc2ccccc2)C1)c1ccc(OC)c(OC)c1 ZINC000499186536 908540736 /nfs/dbraw/zinc/54/07/36/908540736.db2.gz HNBPCFFXBBOQHU-UIFIKXQLSA-N 0 3 411.546 4.117 20 0 HIADHN CC[C@H](NC(=O)N[C@H]1C[C@H](C)N(Cc2ccccc2)C1)c1ccc(OC)c(OC)c1 ZINC000499186539 908541518 /nfs/dbraw/zinc/54/15/18/908541518.db2.gz HNBPCFFXBBOQHU-YYWHXJBOSA-N 0 3 411.546 4.117 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)N2CCc3nc(-c4ccccc4Cl)sc3C2)CN1C1CC1 ZINC000499304446 908676573 /nfs/dbraw/zinc/67/65/73/908676573.db2.gz RLQCBOBQAYTKGQ-UONOGXRCSA-N 0 3 416.978 4.156 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)c1csc(-c2ccc(F)cc2)n1 ZINC000499360194 908729838 /nfs/dbraw/zinc/72/98/38/908729838.db2.gz VCZYMPUAXWVEFX-UHFFFAOYSA-N 0 3 401.482 4.292 20 0 HIADHN Cc1c(C(=O)N(C)C2CCN(Cc3ccccc3)CC2)cnn1-c1ccccc1F ZINC000499489144 908815004 /nfs/dbraw/zinc/81/50/04/908815004.db2.gz VDKVFWKRQCOFNK-UHFFFAOYSA-N 0 3 406.505 4.056 20 0 HIADHN COc1cccc2c1CC[C@H]2NC(=O)NC[C@@H](c1ccc(OC(C)C)cc1)N(C)C ZINC000499700182 908881084 /nfs/dbraw/zinc/88/10/84/908881084.db2.gz WCARSEIWCHQXJF-YADHBBJMSA-N 0 3 411.546 4.072 20 0 HIADHN C[C@@H]1CN(c2ccc(CNCc3cccc(OCc4ccc(F)cc4)c3)cn2)CCO1 ZINC000499705809 908882869 /nfs/dbraw/zinc/88/28/69/908882869.db2.gz MFJCPANESITAMW-LJQANCHMSA-N 0 3 421.516 4.315 20 0 HIADHN CCN1CCN(c2ccccc2CNCc2cc(F)c(F)cc2Br)CC1 ZINC000512977026 921449320 /nfs/dbraw/zinc/44/93/20/921449320.db2.gz FFOHIKMQIKIPQI-UHFFFAOYSA-N 0 3 424.333 4.159 20 0 HIADHN O=C(NC1CC[NH+](Cc2ccc(Cl)cc2)CC1)c1ccc(Br)c([O-])c1 ZINC000499750666 908898373 /nfs/dbraw/zinc/89/83/73/908898373.db2.gz OEYBFFQEJACJSX-UHFFFAOYSA-N 0 3 423.738 4.203 20 0 HIADHN CCCOc1ccc(CNC(=O)NC[C@@H](c2ccccc2)N2CCCC2)cc1OC ZINC000499760756 908901033 /nfs/dbraw/zinc/90/10/33/908901033.db2.gz WVKNNGUXFPCVNN-NRFANRHFSA-N 0 3 411.546 4.120 20 0 HIADHN O=C(NCc1ccc(OC2CCCC2)nc1)N[C@H](CN1CCCC1)c1ccccc1 ZINC000499801319 908935357 /nfs/dbraw/zinc/93/53/57/908935357.db2.gz OVJKLMDYXCXKOS-JOCHJYFZSA-N 0 3 408.546 4.039 20 0 HIADHN Cc1ccc(-c2noc(CCCN[C@H](CO)c3cccc(Cl)c3F)n2)cc1F ZINC000499933775 909040937 /nfs/dbraw/zinc/04/09/37/909040937.db2.gz FGINMBRICIEELN-QGZVFWFLSA-N 0 3 407.848 4.232 20 0 HIADHN Cc1cc(C[C@H](C)NC(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)n(-c2ccccc2)n1 ZINC000499957687 909399466 /nfs/dbraw/zinc/39/94/66/909399466.db2.gz NFOLNICGFPEUIW-VAXXYWNWSA-N 0 3 419.573 4.102 20 0 HIADHN C[C@@H]1C[C@@H]1c1ccc([C@H]2C[C@H]2C(=O)N(CCN(C)C)Cc2ccc(F)cc2F)o1 ZINC000499976327 909421735 /nfs/dbraw/zinc/42/17/35/909421735.db2.gz JRYFPKHSGGKVTG-GRGSLBFTSA-N 0 3 402.485 4.375 20 0 HIADHN COc1cc(Br)cc(NC(=O)NC[C@@H](c2cccs2)N2CCCC2)c1 ZINC000500066365 909534695 /nfs/dbraw/zinc/53/46/95/909534695.db2.gz VTSIUUSAWLPNKE-INIZCTEOSA-N 0 3 424.364 4.478 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)NCc1cccnc1Oc1cccc(F)c1 ZINC000500122593 909604799 /nfs/dbraw/zinc/60/47/99/909604799.db2.gz JEWPKVYSTMZJIJ-UHFFFAOYSA-N 0 3 422.504 4.286 20 0 HIADHN COc1cccc(C2(F)CCN(C[C@H](O)COCc3ccc(Cl)cc3)CC2)c1 ZINC000500151318 909628481 /nfs/dbraw/zinc/62/84/81/909628481.db2.gz FHLXTTJMMIKYDZ-FQEVSTJZSA-N 0 3 407.913 4.187 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CN1CCC[C@H](CNC(=O)c2ccccc2)C1 ZINC000513057975 921513864 /nfs/dbraw/zinc/51/38/64/921513864.db2.gz PUBXYFTWRKCOFZ-OAQYLSRUSA-N 0 3 402.542 4.131 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)[C@@H]3C[C@@H]3c3ccc([C@@H]4C[C@H]4C)o3)cc2)CC1 ZINC000500203637 909694200 /nfs/dbraw/zinc/69/42/00/909694200.db2.gz JBQDFDRTQWNMDX-HLRQEUIKSA-N 0 3 407.558 4.283 20 0 HIADHN CC(=O)Nc1ccc(OC[C@@H](O)CN(C)[C@H](c2ccccc2Cl)C(C)C)cc1 ZINC000500237485 909725211 /nfs/dbraw/zinc/72/52/11/909725211.db2.gz NSXHRQZFXZMTRF-AVRDEDQJSA-N 0 3 404.938 4.367 20 0 HIADHN Cc1cc(C(=O)NC2CCN(CCOc3ccc(C(F)(F)F)cc3)CC2)c(C)o1 ZINC000500266758 909748946 /nfs/dbraw/zinc/74/89/46/909748946.db2.gz BSOKLPHTRZBHGW-UHFFFAOYSA-N 0 3 410.436 4.188 20 0 HIADHN Cc1ccc(OCc2nc(CNCC3(N4CCSCC4)CCCC3)cs2)cc1 ZINC000500292985 909761319 /nfs/dbraw/zinc/76/13/19/909761319.db2.gz VHBBCMYGRDSRJA-UHFFFAOYSA-N 0 3 417.644 4.482 20 0 HIADHN CCc1nnc(NC(=O)[C@@H](C)[C@H](C)NCc2ccc(-c3cccc(F)c3F)o2)s1 ZINC000513069680 921524290 /nfs/dbraw/zinc/52/42/90/921524290.db2.gz PGMYGRMNMICRNP-RYUDHWBXSA-N 0 3 420.485 4.392 20 0 HIADHN CCc1nnc(NC(=O)[C@H](C)[C@H](C)NCc2ccc(-c3cccc(F)c3F)o2)s1 ZINC000513069676 921525035 /nfs/dbraw/zinc/52/50/35/921525035.db2.gz PGMYGRMNMICRNP-NEPJUHHUSA-N 0 3 420.485 4.392 20 0 HIADHN C[C@H](NC(=O)NCCCN1CCc2ccccc2C1)c1ccccc1OC(F)F ZINC000500386173 909827668 /nfs/dbraw/zinc/82/76/68/909827668.db2.gz UBGBRYIIXMXYBP-INIZCTEOSA-N 0 3 403.473 4.097 20 0 HIADHN c1cncc(-c2nc3sc4c(c3c(N3CCN(C5CCC5)CC3)n2)CCCC4)c1 ZINC000500409658 909840830 /nfs/dbraw/zinc/84/08/30/909840830.db2.gz PLEGFLRALGZAIN-UHFFFAOYSA-N 0 3 405.571 4.307 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)c2cccc(-c3cscn3)c2)cc1 ZINC000500409627 909841457 /nfs/dbraw/zinc/84/14/57/909841457.db2.gz MVBJTHGWGNEHSF-OAQYLSRUSA-N 0 3 407.539 4.386 20 0 HIADHN CCc1nnc(NC(=O)[C@@H](C)[C@@H](C)NCc2ccc(-c3ccc(F)cc3)o2)s1 ZINC000513075073 921528833 /nfs/dbraw/zinc/52/88/33/921528833.db2.gz JWXRJHSVJUIOPT-QWHCGFSZSA-N 0 3 402.495 4.253 20 0 HIADHN COc1ccc(C(=O)CCCC(=O)N[C@H]2CCN(Cc3ccccc3)[C@H](C)C2)cc1 ZINC000500494793 909890669 /nfs/dbraw/zinc/89/06/69/909890669.db2.gz ABSQLHWEXQBYAQ-KNQAVFIVSA-N 0 3 408.542 4.218 20 0 HIADHN Cc1ccc(NC(=O)C2CCN(Cc3ccccc3Oc3cccnc3)CC2)nc1 ZINC000500567109 909933547 /nfs/dbraw/zinc/93/35/47/909933547.db2.gz WWPCDNVULZGVSG-UHFFFAOYSA-N 0 3 402.498 4.428 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)CCCCc1ccc(Br)cc1 ZINC000500749643 910060652 /nfs/dbraw/zinc/06/06/52/910060652.db2.gz MLQQHKQFNHZOTN-UHFFFAOYSA-N 0 3 418.379 4.147 20 0 HIADHN Cc1cccc(COc2cccc(C(=O)N(CCN(C)C)Cc3ccccn3)c2)c1 ZINC000500756453 910062542 /nfs/dbraw/zinc/06/25/42/910062542.db2.gz DFSWBSWDFQEZOL-UHFFFAOYSA-N 0 3 403.526 4.173 20 0 HIADHN C[C@@H](Oc1ccccc1Cc1ccccc1)C(=O)N(CCN(C)C)Cc1ccccn1 ZINC000500776181 910073261 /nfs/dbraw/zinc/07/32/61/910073261.db2.gz QFBYQBWVLJRHPR-OAQYLSRUSA-N 0 3 417.553 4.030 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)c1csc(-c2ccc(Cl)cc2)n1 ZINC000500779068 910074658 /nfs/dbraw/zinc/07/46/58/910074658.db2.gz LIBHZJGBCGODDQ-UHFFFAOYSA-N 0 3 400.935 4.063 20 0 HIADHN COCc1cccc(CNC(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)c1 ZINC000500833984 910111322 /nfs/dbraw/zinc/11/13/22/910111322.db2.gz BFHQAGASUOKMCH-HXUWFJFHSA-N 0 3 401.576 4.167 20 0 HIADHN COc1cc([C@@H](C)NCc2ccc(-n3cncn3)cc2)ccc1OCc1ccncc1 ZINC000513104705 921552554 /nfs/dbraw/zinc/55/25/54/921552554.db2.gz MBKJSHBNZBCVGM-GOSISDBHSA-N 0 3 415.497 4.101 20 0 HIADHN CCc1nc(C(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)nn1-c1ccccc1Cl ZINC000500880327 910153678 /nfs/dbraw/zinc/15/36/78/910153678.db2.gz KNQHLDYZRSJLQM-WMZOPIPTSA-N 0 3 423.948 4.048 20 0 HIADHN C[C@H](NC(=O)N(CCN(C)C)Cc1ccccn1)[C@@H](C)c1ccccc1C(F)(F)F ZINC000500892442 910163805 /nfs/dbraw/zinc/16/38/05/910163805.db2.gz KBUZTLRXMPKRDJ-SJORKVTESA-N 0 3 422.495 4.366 20 0 HIADHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)CCc1ccc(F)cc1 ZINC000500992537 910221235 /nfs/dbraw/zinc/22/12/35/910221235.db2.gz YOWMPKHHZWRTIM-UHFFFAOYSA-N 0 3 407.327 4.111 20 0 HIADHN COc1cccc(CNC(=O)N[C@H]2CCN(Cc3ccccc3)C2)c1OC1CCCC1 ZINC000501043473 910257021 /nfs/dbraw/zinc/25/70/21/910257021.db2.gz FINUCKRSUGSGBR-NRFANRHFSA-N 0 3 423.557 4.090 20 0 HIADHN Cc1cccc([C@H](NC(=O)N[C@@H]2CCN(Cc3ccccc3)[C@H]2C)c2ccccn2)c1 ZINC000501090092 910290228 /nfs/dbraw/zinc/29/02/28/910290228.db2.gz RQRJDKPZQVKDAE-ZWSUVBHBSA-N 0 3 414.553 4.442 20 0 HIADHN CCCCOc1cc(CN2CCC3(C[C@H]3C(=O)N3CCCCC3)CC2)ccc1OC ZINC000501098108 910293357 /nfs/dbraw/zinc/29/33/57/910293357.db2.gz COJVPYSIRZEMNC-NRFANRHFSA-N 0 3 414.590 4.489 20 0 HIADHN CC(C)(C)OC(=O)c1cccc(CN2CCC[C@@H](c3nnc4n3CCCCC4)C2)c1 ZINC000501119796 910303610 /nfs/dbraw/zinc/30/36/10/910303610.db2.gz XGLXROOXBVFOSD-HXUWFJFHSA-N 0 3 410.562 4.339 20 0 HIADHN CCOc1cc(CN2CCC3(C[C@@H]3C(=O)N3CCCCC3)CC2)ccc1OC(F)F ZINC000501137264 910317228 /nfs/dbraw/zinc/31/72/28/910317228.db2.gz VNKZTGJDJXHFLW-GOSISDBHSA-N 0 3 422.516 4.301 20 0 HIADHN COCc1ccccc1/C=C(\C)CN[C@@H]1CCCN(Cc2ccc(F)cc2F)C1=O ZINC000513122971 921567392 /nfs/dbraw/zinc/56/73/92/921567392.db2.gz RENZCNNPZOLKMP-XUUSCSPLSA-N 0 3 414.496 4.295 20 0 HIADHN Cc1cc(-c2noc(CCC(=O)N(CCN(C)C)CC3CCCCC3)n2)ccc1F ZINC000501235258 910392612 /nfs/dbraw/zinc/39/26/12/910392612.db2.gz CLRMBOPRKUJWLB-UHFFFAOYSA-N 0 3 416.541 4.087 20 0 HIADHN Cc1cc(N(C)C)cc(C)c1NC(=O)N(CCN(C)C)Cc1ccc(F)c(F)c1 ZINC000501248249 910405724 /nfs/dbraw/zinc/40/57/24/910405724.db2.gz WBMAWJGVDKSGLS-UHFFFAOYSA-N 0 3 404.505 4.243 20 0 HIADHN CC[C@@H](CNC(=O)Nc1cccc(OC[C@H]2CCCO2)c1)N1CCc2ccccc2C1 ZINC000501333473 910474333 /nfs/dbraw/zinc/47/43/33/910474333.db2.gz OCNGOPUIFBWAJD-LADGPHEKSA-N 0 3 423.557 4.203 20 0 HIADHN Cc1oc(-c2ccco2)nc1CC(=O)NC[C@H](c1ccccc1)N1CCC(C)CC1 ZINC000501343488 910480198 /nfs/dbraw/zinc/48/01/98/910480198.db2.gz LYEXJTBOKOLPBW-OAQYLSRUSA-N 0 3 407.514 4.375 20 0 HIADHN CCN(CC)c1ncc(CN(Cc2cccc(OC)c2)C2CCC(O)CC2)s1 ZINC000513143201 921581039 /nfs/dbraw/zinc/58/10/39/921581039.db2.gz AVWOUCPFLZCJIG-UHFFFAOYSA-N 0 3 403.592 4.304 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)Nc1ccc(-c2ncco2)cc1 ZINC000501404174 910536298 /nfs/dbraw/zinc/53/62/98/910536298.db2.gz ZIESCXKVZCUVAZ-UHFFFAOYSA-N 0 3 400.429 4.216 20 0 HIADHN Cc1cc(NC(=O)c2cnn(CC(C)C)c2C)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000501510601 910623094 /nfs/dbraw/zinc/62/30/94/910623094.db2.gz NGSXGIAFRKOQCJ-OAQYLSRUSA-N 0 3 420.561 4.052 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1CCO[C@@H]1c1ccc(Cl)c(F)c1)[C@H](c1ccccc1)N(C)C ZINC000501564194 910673337 /nfs/dbraw/zinc/67/33/37/910673337.db2.gz ACUQNXFQLUCXCY-RKTMXUFFSA-N 0 3 419.928 4.300 20 0 HIADHN CC(C)[C@@](C)(NCc1ccc2c(c1)NC(=O)CO2)c1ccc(Br)cc1 ZINC000513182250 921605767 /nfs/dbraw/zinc/60/57/67/921605767.db2.gz FWSOQAPPGTZDFU-HXUWFJFHSA-N 0 3 403.320 4.441 20 0 HIADHN C[C@H](Cc1cncc2ccccc21)C(=O)N(CCN(C)C)Cc1ccc(F)cc1F ZINC000501763138 910819190 /nfs/dbraw/zinc/81/91/90/910819190.db2.gz NOBWYECYOIKWHA-QGZVFWFLSA-N 0 3 411.496 4.282 20 0 HIADHN CN(CCCCN1C(=O)c2ccccc2C1=O)Cc1ccccc1OC(F)(F)F ZINC000501793561 910846171 /nfs/dbraw/zinc/84/61/71/910846171.db2.gz ARMZTYLHXWIRRA-UHFFFAOYSA-N 0 3 406.404 4.093 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)N1CC=C(c2c[nH]c3ncccc23)CC1 ZINC000501809159 910859718 /nfs/dbraw/zinc/85/97/18/910859718.db2.gz HTRJRKVEBDUFQQ-QHCPKHFHSA-N 0 3 415.541 4.199 20 0 HIADHN Cc1ccccc1C1(C(=O)NC[C@H](C(C)C)N2CCc3ccccc3C2)CCOCC1 ZINC000501817189 910865850 /nfs/dbraw/zinc/86/58/50/910865850.db2.gz BSMPPRWYDKPFRT-RUZDIDTESA-N 0 3 420.597 4.242 20 0 HIADHN CC(C)[C@@H](CNC(=O)C1(c2ccc(F)cc2)CCOCC1)N1CCc2ccccc2C1 ZINC000501818918 910867199 /nfs/dbraw/zinc/86/71/99/910867199.db2.gz HMLNWYXKJKZQAH-XMMPIXPASA-N 0 3 424.560 4.073 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)c3ccc(-c4ccccc4)nc3C)cc2)CC1 ZINC000513191746 921613004 /nfs/dbraw/zinc/61/30/04/921613004.db2.gz VHQQWTGSVXFHGE-UHFFFAOYSA-N 0 3 414.553 4.447 20 0 HIADHN FC(F)(F)c1ccc(C[C@]2(NCc3cncn3Cc3ccccc3)CCOC2)cc1 ZINC000513196901 921616470 /nfs/dbraw/zinc/61/64/70/921616470.db2.gz RWMXYIRJIAEPNE-JOCHJYFZSA-N 0 3 415.459 4.442 20 0 HIADHN CC(C)[C@@H](NC(=O)N[C@H](CN1CCCC1)c1ccccc1)c1ccc2c(c1)OCCO2 ZINC000501853527 910886211 /nfs/dbraw/zinc/88/62/11/910886211.db2.gz UXZKQCKVAZXCDM-ZJSXRUAMSA-N 0 3 423.557 4.291 20 0 HIADHN CC(C)[C@@H](NC(=O)N[C@@H](CN1CCCC1)c1ccccc1)c1ccc2c(c1)OCCO2 ZINC000501853526 910886446 /nfs/dbraw/zinc/88/64/46/910886446.db2.gz UXZKQCKVAZXCDM-XUZZJYLKSA-N 0 3 423.557 4.291 20 0 HIADHN CCN(C(=O)[C@H](C)Oc1cccc(C(C)=O)c1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000501954015 910941237 /nfs/dbraw/zinc/94/12/37/910941237.db2.gz DCSONAVMYROUJL-GREBRCKQSA-N 0 3 408.542 4.341 20 0 HIADHN CCN(C(=O)[C@H](C)OCc1cccc(OC)c1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000501965288 910952022 /nfs/dbraw/zinc/95/20/22/910952022.db2.gz TWCVFWHRQQZTDO-ZRCGQRJVSA-N 0 3 410.558 4.284 20 0 HIADHN CSc1ccc(NC(=O)CN[C@@]2(Cc3ccc(C(F)(F)F)cc3)CCOC2)cc1 ZINC000513205476 921622871 /nfs/dbraw/zinc/62/28/71/921622871.db2.gz NOQHYLYKVQDDAH-HXUWFJFHSA-N 0 3 424.488 4.357 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)Nc1cn(C)nc1-c1ccccc1 ZINC000502207207 911151310 /nfs/dbraw/zinc/15/13/10/911151310.db2.gz KEPHSQFTGWWWPQ-UHFFFAOYSA-N 0 3 405.546 4.115 20 0 HIADHN CN(C)C(=O)Nc1ccc(Cl)c(C(=O)N[C@@H](CN2CCCC2)c2ccccc2)c1 ZINC000502224997 911173188 /nfs/dbraw/zinc/17/31/88/911173188.db2.gz FLIUOBVLVCRSJO-FQEVSTJZSA-N 0 3 414.937 4.000 20 0 HIADHN Cc1ccc(-c2noc(CCCN(CC(=O)N3CCCCCC3)C(C)C)n2)cc1F ZINC000513231880 921644988 /nfs/dbraw/zinc/64/49/88/921644988.db2.gz KRDVVWNUGACWMT-UHFFFAOYSA-N 0 3 416.541 4.230 20 0 HIADHN CC(C)(COc1ccc(C(F)(F)F)cn1)NCC(=O)Nc1ccccc1Cl ZINC000502285119 911239839 /nfs/dbraw/zinc/23/98/39/911239839.db2.gz CRACOWUWTBKJPV-UHFFFAOYSA-N 0 3 401.816 4.140 20 0 HIADHN Cc1ccccc1OCCCN1CCC[C@@H](c2n[nH]cc2NC(=O)C2CCCC2)C1 ZINC000502298068 911256431 /nfs/dbraw/zinc/25/64/31/911256431.db2.gz CZCBMBPKOFPKET-HXUWFJFHSA-N 0 3 410.562 4.495 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)c1ccccc1OCc1cscn1 ZINC000513234625 921647015 /nfs/dbraw/zinc/64/70/15/921647015.db2.gz ZRIDYYLNNWQELT-FQEVSTJZSA-N 0 3 407.539 4.117 20 0 HIADHN C[C@@H](NC(=O)N(Cc1ccco1)C1CCN(C)CC1)c1ccc(OC(F)F)cc1 ZINC000502308346 911272077 /nfs/dbraw/zinc/27/20/77/911272077.db2.gz GNRUSAUEOPVWHZ-OAHLLOKOSA-N 0 3 407.461 4.248 20 0 HIADHN COc1cc(C)c([C@H](C)NC(=O)NC[C@H](c2ccccc2)N2CCCC2)cc1OC ZINC000502308718 911272167 /nfs/dbraw/zinc/27/21/67/911272167.db2.gz ITYYXUNXYVQTCL-GHTZIAJQSA-N 0 3 411.546 4.210 20 0 HIADHN COc1cccc(NC(=O)C[C@H](C)N[C@H]2CCOc3c(Br)cccc32)c1 ZINC000502320725 911294248 /nfs/dbraw/zinc/29/42/48/911294248.db2.gz VKDQAZHPRRRYQR-UGSOOPFHSA-N 0 3 419.319 4.288 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)CN2C[C@H](C)C[C@@H]2c2ccccc2)cc1OC ZINC000513241908 921651364 /nfs/dbraw/zinc/65/13/64/921651364.db2.gz MXGOFWYXKNOUKY-BVYCBKJFSA-N 0 3 408.542 4.450 20 0 HIADHN Cc1nc2ccccc2nc1CN1CCC[C@@H](c2n[nH]cc2NC(=O)C2CCCC2)C1 ZINC000502337483 911316858 /nfs/dbraw/zinc/31/68/58/911316858.db2.gz KCAFXXHLXUMUSR-GOSISDBHSA-N 0 3 418.545 4.170 20 0 HIADHN C[C@@H]1CCCC[C@@H]1OCCN1CCC[C@@H](c2n[nH]cc2NC(=O)C2CCCC2)C1 ZINC000502339818 911319877 /nfs/dbraw/zinc/31/98/77/911319877.db2.gz OPOIZAFQXSJJMV-QFUCXCTJSA-N 0 3 402.583 4.313 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)CN2C[C@H](C)C[C@H]2c2ccccc2)cc1OC ZINC000513241909 921651997 /nfs/dbraw/zinc/65/19/97/921651997.db2.gz MXGOFWYXKNOUKY-COPCDDAFSA-N 0 3 408.542 4.450 20 0 HIADHN COc1cc(CN2CCC[C@@H](c3ncc4n3CCCC4)C2)c(SC)cc1OC ZINC000502345072 911324601 /nfs/dbraw/zinc/32/46/01/911324601.db2.gz XKFQPHKQABAVOT-MRXNPFEDSA-N 0 3 401.576 4.338 20 0 HIADHN C[C@H](SCC(=O)NC[C@@H]1CCCN1Cc1ccccc1)c1nc2ccccc2[nH]1 ZINC000513243396 921653370 /nfs/dbraw/zinc/65/33/70/921653370.db2.gz GUBOCXCCEOPDMO-HKUYNNGSSA-N 0 3 408.571 4.138 20 0 HIADHN Cc1nc(-c2ccccn2)sc1C(=O)N(CCCc1ccccc1)CCN(C)C ZINC000502376334 911361098 /nfs/dbraw/zinc/36/10/98/911361098.db2.gz DZOQQCAXWGTNMH-UHFFFAOYSA-N 0 3 408.571 4.150 20 0 HIADHN COc1cc(C)c(C[C@H](C)N[C@@H](CCO)c2ccccc2Br)cc1OC ZINC000502474877 911466414 /nfs/dbraw/zinc/46/64/14/911466414.db2.gz IIOSKXBSZRPDNK-KXBFYZLASA-N 0 3 422.363 4.419 20 0 HIADHN COc1cc(C)c(C[C@@H](C)N[C@H](CCO)c2ccccc2Br)cc1OC ZINC000502474875 911466568 /nfs/dbraw/zinc/46/65/68/911466568.db2.gz IIOSKXBSZRPDNK-DNVCBOLYSA-N 0 3 422.363 4.419 20 0 HIADHN CCOC(=O)c1c2c(sc1NC(=O)[C@H]1CCO[C@@H](CC)C1)C(C)(C)NC(C)(C)C2 ZINC000502519083 911523091 /nfs/dbraw/zinc/52/30/91/911523091.db2.gz MAODJOBHHUZJRS-KBPBESRZSA-N 0 3 422.591 4.228 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3ccc4nc(OC)ccc4c3)c(C)c2)CC1 ZINC000502538739 911544620 /nfs/dbraw/zinc/54/46/20/911544620.db2.gz QVHJVWAVJASKJW-UHFFFAOYSA-N 0 3 419.529 4.338 20 0 HIADHN CCN(CC)[C@H](CNC(=O)[C@H](C)c1c(C)nn(C)c1C)c1ccc(C(F)(F)F)cc1 ZINC000502545917 911551503 /nfs/dbraw/zinc/55/15/03/911551503.db2.gz YIOQKWCCBJFVCS-AUUYWEPGSA-N 0 3 424.511 4.359 20 0 HIADHN O=C(CN[C@@H]1CCCC[C@H]1OC(F)F)Nc1ccc(NC(=O)c2cccs2)cc1 ZINC000502547059 911554674 /nfs/dbraw/zinc/55/46/74/911554674.db2.gz OIQWJDGYYUGEOT-HZPDHXFCSA-N 0 3 423.485 4.079 20 0 HIADHN COc1ccc([C@H](CNC(=O)[C@@H]2C[C@@H]2c2ccc([C@H]3C[C@H]3C)o2)N2CCCC2)cc1 ZINC000502607559 911613739 /nfs/dbraw/zinc/61/37/39/911613739.db2.gz AQVNQUYUFNPLSY-UGTAXJHQSA-N 0 3 408.542 4.468 20 0 HIADHN COc1ccc([C@H](CNC(=O)[C@@H]2C[C@@H]2c2ccc([C@@H]3C[C@H]3C)o2)N2CCCC2)cc1 ZINC000502607557 911616697 /nfs/dbraw/zinc/61/66/97/911616697.db2.gz AQVNQUYUFNPLSY-OSKXVONFSA-N 0 3 408.542 4.468 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3ccc4c(c3)OC(C)(C)O4)c(C)c2)CC1 ZINC000502638286 911669081 /nfs/dbraw/zinc/66/90/81/911669081.db2.gz XOVBSPZWZSQURY-UHFFFAOYSA-N 0 3 410.518 4.288 20 0 HIADHN CCN(CC1CCS(=O)(=O)CC1)[C@@H]1CCSc2ccc(Br)cc21 ZINC000502693098 911729079 /nfs/dbraw/zinc/72/90/79/911729079.db2.gz HEORCTZCIJOKMX-MRXNPFEDSA-N 0 3 418.422 4.133 20 0 HIADHN COc1ccccc1C1(C(=O)N(C)C[C@@H]2CCN(C)[C@H]2c2cccnc2)CCCCC1 ZINC000502716956 911749224 /nfs/dbraw/zinc/74/92/24/911749224.db2.gz USXTVKRBFGQNHA-URXFXBBRSA-N 0 3 421.585 4.444 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)C1(c2ccc(Br)cc2)CC1 ZINC000513289385 921688033 /nfs/dbraw/zinc/68/80/33/921688033.db2.gz NSRSDGOHNOWXDN-FQEVSTJZSA-N 0 3 413.359 4.262 20 0 HIADHN Cc1ccc(C(=O)NC[C@H]2CCCN2Cc2ccccc2)cc1NC(=O)c1ccco1 ZINC000513295216 921691157 /nfs/dbraw/zinc/69/11/57/921691157.db2.gz WUHLDEMGOLYLAJ-OAQYLSRUSA-N 0 3 417.509 4.235 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)Cc3ccc(Br)cc3)c2)CC1 ZINC000502859773 911867672 /nfs/dbraw/zinc/86/76/72/911867672.db2.gz VXIAIQKHUOADSD-UHFFFAOYSA-N 0 3 416.363 4.161 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)CCc3nc4ccccc4s3)c2)CC1 ZINC000502881603 911882680 /nfs/dbraw/zinc/88/26/80/911882680.db2.gz PHECUCKXNGLHRT-UHFFFAOYSA-N 0 3 408.571 4.398 20 0 HIADHN Cc1nccn1CCCCN1CCC[C@@H]1c1ccc(I)cc1 ZINC000502889417 911885546 /nfs/dbraw/zinc/88/55/46/911885546.db2.gz WYUFBAOKCIQSPG-GOSISDBHSA-N 0 3 409.315 4.413 20 0 HIADHN CCO[C@@H](C)c1ncc(C(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)s1 ZINC000502904248 911892797 /nfs/dbraw/zinc/89/27/97/911892797.db2.gz NDUYRUYOMPFYSU-INIZCTEOSA-N 0 3 402.564 4.023 20 0 HIADHN Cc1nccn1CCCN(C)[C@@H](C)C(=O)Nc1ccc(Cl)cc1C(F)(F)F ZINC000503065601 912029528 /nfs/dbraw/zinc/02/95/28/912029528.db2.gz WYCSBZSCMLZNLV-LBPRGKRZSA-N 0 3 402.848 4.213 20 0 HIADHN O=C(COc1ccccc1OCc1ccccc1)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000503141281 912102684 /nfs/dbraw/zinc/10/26/84/912102684.db2.gz QALGDNLHTBEDKQ-QHCPKHFHSA-N 0 3 416.521 4.035 20 0 HIADHN CC1CCN([C@@H](CNC(=O)CSc2nccn2C(C)(C)C)c2ccccc2)CC1 ZINC000503163932 912135303 /nfs/dbraw/zinc/13/53/03/912135303.db2.gz XBXHPHKRJCKFPE-FQEVSTJZSA-N 0 3 414.619 4.320 20 0 HIADHN CC(C)Cc1ccc([C@H](CNC(=O)N2CCC(OCC3CC3)CC2)N(C)C)cc1 ZINC000513340282 921725589 /nfs/dbraw/zinc/72/55/89/921725589.db2.gz IOWXQEDQDKEJFY-QHCPKHFHSA-N 0 3 401.595 4.088 20 0 HIADHN COc1cc(NC(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)c(OC)cc1Cl ZINC000506294998 914890507 /nfs/dbraw/zinc/89/05/07/914890507.db2.gz MUGKVWAKKNODIW-GOEBONIOSA-N 0 3 403.910 4.314 20 0 HIADHN Cc1cc(NC(=O)C2CCN(Cc3cccc(OCc4ccccc4)c3)CC2)no1 ZINC000506311663 914899801 /nfs/dbraw/zinc/89/98/01/914899801.db2.gz FOLJLZWRVLSCHO-UHFFFAOYSA-N 0 3 405.498 4.413 20 0 HIADHN COc1ccc(-c2nn(Cc3ccccc3)cc2CN(C)C[C@H]2CCCO2)cc1OC ZINC000506432123 915034778 /nfs/dbraw/zinc/03/47/78/915034778.db2.gz JMMXMFBJSYHWEO-JOCHJYFZSA-N 0 3 421.541 4.226 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)Nc1cccc(CN2CCCCC2=O)c1 ZINC000506502308 915121631 /nfs/dbraw/zinc/12/16/31/915121631.db2.gz LAEGOUKDCQVNEW-QHCPKHFHSA-N 0 3 420.557 4.158 20 0 HIADHN COc1ccc(Br)c(NC(=O)N[C@@H](CN2CCCC2)c2ccccc2)c1 ZINC000506515564 915145669 /nfs/dbraw/zinc/14/56/69/915145669.db2.gz IATMZMPLIAVLPT-IBGZPJMESA-N 0 3 418.335 4.416 20 0 HIADHN CC[C@H](N[C@@H](C)C(=O)NC(=O)Nc1ccc(C)cc1C)c1ccc(OC)c(OC)c1 ZINC000506600798 915251317 /nfs/dbraw/zinc/25/13/17/915251317.db2.gz HJZJBCHNZOLPIX-WMZOPIPTSA-N 0 3 413.518 4.098 20 0 HIADHN Cc1n[nH]c(C)c1[C@H]1CCCN1C(=O)NC[C@@H](c1ccc(CC(C)C)cc1)N(C)C ZINC000513385267 921757016 /nfs/dbraw/zinc/75/70/16/921757016.db2.gz VKMZYJMMJWLQHO-YADHBBJMSA-N 0 3 411.594 4.374 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CN1CCC[C@H](c2nnc3n2CCCCC3)C1 ZINC000506625585 915286106 /nfs/dbraw/zinc/28/61/06/915286106.db2.gz UNDFDGWLAYLRRZ-QFIPXVFZSA-N 0 3 418.589 4.246 20 0 HIADHN CCOc1cc(CN2CCC[C@@H](c3nnc4n3CCCCC4)C2)ccc1OC(F)F ZINC000506631417 915299672 /nfs/dbraw/zinc/29/96/72/915299672.db2.gz IJHNPHRWTVTPOJ-QGZVFWFLSA-N 0 3 420.504 4.384 20 0 HIADHN CCCN(C(=O)NC[C@@H](C)c1c(C)noc1C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000506644905 915315605 /nfs/dbraw/zinc/31/56/05/915315605.db2.gz FLTRVBSGIVKGMX-GCJKJVERSA-N 0 3 412.578 4.481 20 0 HIADHN c1ccc(OCc2ccncc2)c(CN2CCC[C@H](c3nnc4n3CCCCC4)C2)c1 ZINC000506654137 915324553 /nfs/dbraw/zinc/32/45/53/915324553.db2.gz NHXXCELPRAFGNY-QFIPXVFZSA-N 0 3 417.557 4.358 20 0 HIADHN O=C(NC1CCN(Cc2ccc(-c3cccc(Br)c3)o2)CC1)C1CC1 ZINC000506662149 915337953 /nfs/dbraw/zinc/33/79/53/915337953.db2.gz LTPSUKZZTPBSEQ-UHFFFAOYSA-N 0 3 403.320 4.200 20 0 HIADHN Cc1noc([C@H]2CCCCN2C(=O)NC[C@@H](c2ccc(CC(C)C)cc2)N(C)C)n1 ZINC000513396169 921765094 /nfs/dbraw/zinc/76/50/94/921765094.db2.gz PHZIZFNELUKTAF-RTWAWAEBSA-N 0 3 413.566 4.116 20 0 HIADHN CCOc1ccc([C@H](NC(=O)N2CCCN(C)CC2)c2cccc(Cl)c2)cc1 ZINC000506697617 915374956 /nfs/dbraw/zinc/37/49/56/915374956.db2.gz IIHFBUJQWJBJIZ-NRFANRHFSA-N 0 3 401.938 4.175 20 0 HIADHN CCOc1ccc([C@H]2CCCN2Cc2ccccc2OCC(=O)NCC2CC2)cc1 ZINC000506707509 915386194 /nfs/dbraw/zinc/38/61/94/915386194.db2.gz MHGVRYXKZPSKGT-HSZRJFAPSA-N 0 3 408.542 4.327 20 0 HIADHN COC(=O)c1cc2c(o1)c(OC)ccc2CN1CCC(C(=O)Nc2ccccc2)CC1 ZINC000506719442 915399663 /nfs/dbraw/zinc/39/96/63/915399663.db2.gz NKLRULVNVSAZKB-UHFFFAOYSA-N 0 3 422.481 4.079 20 0 HIADHN O=C(NCc1ccccc1)C1CCN(Cc2ccccc2OCc2ccccn2)CC1 ZINC000506745590 915435807 /nfs/dbraw/zinc/43/58/07/915435807.db2.gz YIMVLYRGYSIFNI-UHFFFAOYSA-N 0 3 415.537 4.189 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)NCCCO[C@H]1CCCc2ccccc21 ZINC000506827197 915595614 /nfs/dbraw/zinc/59/56/14/915595614.db2.gz PVMZWTDOJPMGHJ-DEOSSOPVSA-N 0 3 409.574 4.244 20 0 HIADHN CC(C)Cn1ncc(C(=O)NC[C@@H](C(C)C)N2CCc3ccccc3C2)c1C1CC1 ZINC000506835002 915610992 /nfs/dbraw/zinc/61/09/92/915610992.db2.gz OFKYYWSTSGACAL-QHCPKHFHSA-N 0 3 408.590 4.229 20 0 HIADHN CCCCCNC(=O)C1CCN(Cc2c(C)nn(-c3ccc(F)cc3)c2C)CC1 ZINC000506863215 915651429 /nfs/dbraw/zinc/65/14/29/915651429.db2.gz VVHSZITWVMDZDP-UHFFFAOYSA-N 0 3 400.542 4.147 20 0 HIADHN COC(=O)c1c(C2CC2)csc1NC(=O)N(CCN(C)C)Cc1ccc(F)cc1 ZINC000506869821 915660358 /nfs/dbraw/zinc/66/03/58/915660358.db2.gz ZKIFPXLBBTVOBK-UHFFFAOYSA-N 0 3 419.522 4.147 20 0 HIADHN O=C(CN1CCC[C@@H]1c1cccs1)Nc1cccc(CN2CCSCC2)c1 ZINC000506916848 915717033 /nfs/dbraw/zinc/71/70/33/915717033.db2.gz KZXGSGKFOBWPGJ-LJQANCHMSA-N 0 3 401.601 4.073 20 0 HIADHN CC(C)N(CC(=O)Nc1cccc(CN2CCSCC2)c1)Cc1cccs1 ZINC000506940980 915745211 /nfs/dbraw/zinc/74/52/11/915745211.db2.gz YEHMJBXSBPBWOL-UHFFFAOYSA-N 0 3 403.617 4.146 20 0 HIADHN CC(C)(C)[C@H](NCC(=O)N1CCC(C(=O)N2CCCCCC2)CC1)c1ccccc1 ZINC000506995298 915808938 /nfs/dbraw/zinc/80/89/38/915808938.db2.gz RUSWGOWITAYQHD-HSZRJFAPSA-N 0 3 413.606 4.005 20 0 HIADHN CC(C)(C)[C@@H](NCC(=O)NCC1(c2ccccc2)CCOCC1)c1ccc(F)cc1 ZINC000507005788 915817994 /nfs/dbraw/zinc/81/79/94/915817994.db2.gz BCXBDWAITOAPSZ-QHCPKHFHSA-N 0 3 412.549 4.367 20 0 HIADHN CCCOc1cc(CN2CCC(C(=O)NCc3ccc(F)cc3)CC2)ccc1OC ZINC000507020596 915826864 /nfs/dbraw/zinc/82/68/64/915826864.db2.gz KGMXEZOJXQGBEE-UHFFFAOYSA-N 0 3 414.521 4.152 20 0 HIADHN CCCCNC(=O)C1CCN(Cc2ccc(OCc3cccs3)c(OC)c2)CC1 ZINC000507023064 915828046 /nfs/dbraw/zinc/82/80/46/915828046.db2.gz SALYYKOSKGUZMB-UHFFFAOYSA-N 0 3 416.587 4.464 20 0 HIADHN COc1ccc([C@H](C)NC(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)c(C)c1OC ZINC000513432194 921801444 /nfs/dbraw/zinc/80/14/44/921801444.db2.gz OWEIGWOKBFDFMI-HNAYVOBHSA-N 0 3 419.953 4.329 20 0 HIADHN CCCn1nccc1C1CCN(C(=O)NC[C@H](c2ccccc2)N2CCCC2)CC1 ZINC000507055089 915844633 /nfs/dbraw/zinc/84/46/33/915844633.db2.gz FZKFZQMGBSMSGM-HSZRJFAPSA-N 0 3 409.578 4.019 20 0 HIADHN COc1ccc([C@H](C)NC(=O)N(CCN(C)C)Cc2cccc(C)c2)c(C)c1OC ZINC000513433335 921802160 /nfs/dbraw/zinc/80/21/60/921802160.db2.gz XPQWIYZHNCEAEC-IBGZPJMESA-N 0 3 413.562 4.155 20 0 HIADHN O=C(Cc1coc(-c2ccccc2)n1)N1CCCN(CCCc2ccccc2)CC1 ZINC000507097274 915867639 /nfs/dbraw/zinc/86/76/39/915867639.db2.gz NYYSBHMRXOEEKN-UHFFFAOYSA-N 0 3 403.526 4.051 20 0 HIADHN O=C(COc1ccc(F)cc1Cl)N1CCCN(CCCc2ccccc2)CC1 ZINC000507118330 915876235 /nfs/dbraw/zinc/87/62/35/915876235.db2.gz MTUHNFQVMXVJMW-UHFFFAOYSA-N 0 3 404.913 4.025 20 0 HIADHN COc1ccc([C@H]2CCCN2C(=O)CN2CC[C@H](c3ccccc3C)C2)cc1OC ZINC000507218567 915970985 /nfs/dbraw/zinc/97/09/85/915970985.db2.gz LGOSAAXRUFFEMQ-RBBKRZOGSA-N 0 3 408.542 4.165 20 0 HIADHN Cc1ccc(NC(=O)[C@@H](C)N[C@H](C)c2ccc3n[nH]cc3c2)c(Br)c1 ZINC000507221275 915973949 /nfs/dbraw/zinc/97/39/49/915973949.db2.gz HSHGDSAFGCMGDZ-CHWSQXEVSA-N 0 3 401.308 4.312 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc2n[nH]cc2c1)C(=O)N(C)Cc1ccc(Br)cc1 ZINC000507227387 915982315 /nfs/dbraw/zinc/98/23/15/915982315.db2.gz HVXSWJVBBOQXPL-ZIAGYGMSSA-N 0 3 415.335 4.023 20 0 HIADHN O=C(N[C@H](c1nccs1)c1ccccc1)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000507322034 916084570 /nfs/dbraw/zinc/08/45/70/916084570.db2.gz ZBPOLQFLXJUVOW-SFTDATJTSA-N 0 3 406.555 4.196 20 0 HIADHN Cc1nc(-c2ccccc2Br)sc1[C@@H](C)N[C@@H]1CCCCNC1=O ZINC000507442416 916213506 /nfs/dbraw/zinc/21/35/06/916213506.db2.gz KICIRFIRPRIGLU-IAQYHMDHSA-N 0 3 408.365 4.200 20 0 HIADHN O=C(Nc1ccccc1)[C@H](NC1CCN(CCC(F)(F)F)CC1)c1ccccc1 ZINC000507487618 916254180 /nfs/dbraw/zinc/25/41/80/916254180.db2.gz RPHJEMUBNINFTJ-HXUWFJFHSA-N 0 3 405.464 4.373 20 0 HIADHN CC(=O)Nc1ccc(CCN[C@@H](C(=O)Nc2ccc(C)cc2)c2ccccc2)cc1 ZINC000507501222 916266640 /nfs/dbraw/zinc/26/66/40/916266640.db2.gz MNQPWKMLOSTOEK-XMMPIXPASA-N 0 3 401.510 4.466 20 0 HIADHN CCc1cccnc1[C@H](C)NCCC(=O)N(C)Cc1ccccc1Br ZINC000507517627 916280393 /nfs/dbraw/zinc/28/03/93/916280393.db2.gz YSVFHWRYFQPGDB-HNNXBMFYSA-N 0 3 404.352 4.106 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)Cc3ccc(C)s3)c(OCC)c2)CC1 ZINC000507591845 916345392 /nfs/dbraw/zinc/34/53/92/916345392.db2.gz AXAAYRQYAMLSTQ-UHFFFAOYSA-N 0 3 401.576 4.168 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)[C@H](C)c3cccc(F)c3)c(OCC)c2)CC1 ZINC000507609526 916366595 /nfs/dbraw/zinc/36/65/95/916366595.db2.gz ZTHPQQNVHALDKH-GOSISDBHSA-N 0 3 413.537 4.499 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3cc(C)n(CC)c3C)c(OCC)c2)CC1 ZINC000507609975 916367035 /nfs/dbraw/zinc/36/70/35/916367035.db2.gz GNRNCFACSKJIMQ-UHFFFAOYSA-N 0 3 412.578 4.308 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)[C@@H](C)c3ccsc3)c(OCC)c2)CC1 ZINC000507610378 916368225 /nfs/dbraw/zinc/36/82/25/916368225.db2.gz JGOUHTQWNIILPP-KRWDZBQOSA-N 0 3 401.576 4.421 20 0 HIADHN CCc1ccc([C@@H](NCC[C@@H]2CCCCO2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000507618091 916375900 /nfs/dbraw/zinc/37/59/00/916375900.db2.gz IADUQWGAWBMTHC-JTHBVZDNSA-N 0 3 401.572 4.291 20 0 HIADHN Cc1cc(C)n(-c2ccc(Cl)c(C(=O)N[C@H]3CCN([C@@H](C)c4ccccc4)C3)n2)n1 ZINC000507627903 916386155 /nfs/dbraw/zinc/38/61/55/916386155.db2.gz BWYZWNJDWGIOPG-HKUYNNGSSA-N 0 3 423.948 4.103 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)Cn2c3ccccc3nc2C(F)(F)F)C1 ZINC000507628231 916386832 /nfs/dbraw/zinc/38/68/32/916386832.db2.gz DIWCJWGCHJEESW-NVXWUHKLSA-N 0 3 416.447 4.007 20 0 HIADHN Cc1cc(CN(C)Cc2ccc3c(c2)oc(=O)n3C)cc(C)c1OCC(F)(F)F ZINC000507651328 916414314 /nfs/dbraw/zinc/41/43/14/916414314.db2.gz DQSYMRSFPIOKPW-UHFFFAOYSA-N 0 3 408.420 4.321 20 0 HIADHN O=C(c1cnn(-c2ccccc2)c1)c1nc(-c2cccc(CN3CCCCC3)c2)no1 ZINC000507706977 916493049 /nfs/dbraw/zinc/49/30/49/916493049.db2.gz IYYLGESZWHSFDX-UHFFFAOYSA-N 0 3 413.481 4.139 20 0 HIADHN Cn1ccnc1-c1cccc(NC(=O)[C@@H]2CN(Cc3ccccc3)CCC2(F)F)c1 ZINC000507719519 916513765 /nfs/dbraw/zinc/51/37/65/916513765.db2.gz SWERMPZYBLBNAN-FQEVSTJZSA-N 0 3 410.468 4.183 20 0 HIADHN CCOc1cc(CN2CCC(CCCN3CCOCC3)CC2)cc(Cl)c1OC ZINC000507724732 916519050 /nfs/dbraw/zinc/51/90/50/916519050.db2.gz ZBOXUBRJJGEEMT-UHFFFAOYSA-N 0 3 410.986 4.072 20 0 HIADHN CN1CCN(C(=O)c2ccc(CN[C@@H]3CCc4c3cc(Cl)cc4Cl)cc2)CC1 ZINC000507813748 916608020 /nfs/dbraw/zinc/60/80/20/916608020.db2.gz SPJTXGPVKFDRIQ-OAQYLSRUSA-N 0 3 418.368 4.158 20 0 HIADHN COc1cc(CN[C@@H]2CC(=O)N(C)[C@@H]2c2ccc(Cl)cc2)ccc1OC(F)F ZINC000507834477 916636694 /nfs/dbraw/zinc/63/66/94/916636694.db2.gz RJCJKTBXUKIADA-DNVCBOLYSA-N 0 3 410.848 4.012 20 0 HIADHN CC(C)(C)c1n[nH]cc1CNCc1ccccc1-c1ccc(Cn2cncn2)cc1 ZINC000507841538 916651236 /nfs/dbraw/zinc/65/12/36/916651236.db2.gz QMYFEOPTRPEYLY-UHFFFAOYSA-N 0 3 400.530 4.304 20 0 HIADHN Cc1nn(CC(=O)OC(C)C)c(C)c1CN1CC=C(c2c[nH]c3ccccc32)CC1 ZINC000507842444 916653280 /nfs/dbraw/zinc/65/32/80/916653280.db2.gz WXQCKLHSPBSUMK-UHFFFAOYSA-N 0 3 406.530 4.222 20 0 HIADHN Fc1ccc(-c2nnc3n2C[C@@H](NCc2ccccc2OC(F)(F)F)CC3)cc1 ZINC000507869440 916703991 /nfs/dbraw/zinc/70/39/91/916703991.db2.gz ZAVVHVQFGHUNTI-INIZCTEOSA-N 0 3 406.383 4.087 20 0 HIADHN CC(C)COc1cccc(OCC(=O)NC[C@H](c2cccs2)N2CCCC2)c1 ZINC000507914811 916791200 /nfs/dbraw/zinc/79/12/00/916791200.db2.gz QOJXLHMJQPBNME-HXUWFJFHSA-N 0 3 402.560 4.115 20 0 HIADHN Cc1c(CN2CCC(CNC(=O)c3cnn(C)c3)CC2)sc2c1cccc2Cl ZINC000507984245 916828297 /nfs/dbraw/zinc/82/82/97/916828297.db2.gz DSMNNUARGADZGK-UHFFFAOYSA-N 0 3 416.978 4.239 20 0 HIADHN Cc1ccc(NC(=O)C2CCN(Cc3ccccc3OCc3cccnc3)CC2)nc1 ZINC000508001932 916843109 /nfs/dbraw/zinc/84/31/09/916843109.db2.gz XLWVQIFFUPKNPX-UHFFFAOYSA-N 0 3 416.525 4.215 20 0 HIADHN Cc1cc(C)n2ncc(-c3noc([C@H]4CN(Cc5ccccc5)CCC4(F)F)n3)c2n1 ZINC000508039233 916869553 /nfs/dbraw/zinc/86/95/53/916869553.db2.gz QBOIIWSKOKGOOJ-GOSISDBHSA-N 0 3 424.455 4.021 20 0 HIADHN COCc1c2ccccc2oc1C(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000508057772 916883406 /nfs/dbraw/zinc/88/34/06/916883406.db2.gz KDAFKMWWVOYGDZ-UHFFFAOYSA-N 0 3 408.498 4.036 20 0 HIADHN CC(C)(C)c1ccccc1OCC(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000508063147 916886046 /nfs/dbraw/zinc/88/60/46/916886046.db2.gz NMDOLNXXEQASJE-UHFFFAOYSA-N 0 3 410.558 4.206 20 0 HIADHN O=C(CCc1ncc(-c2ccccc2)o1)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000508068447 916890234 /nfs/dbraw/zinc/89/02/34/916890234.db2.gz DWSFHEVLYXRMSF-UHFFFAOYSA-N 0 3 419.525 4.117 20 0 HIADHN COc1ccc2nc(C3CC3)cc(C(=O)N(C)[C@@H]3CCN(Cc4ccccc4)C3)c2c1 ZINC000508078086 916897920 /nfs/dbraw/zinc/89/79/20/916897920.db2.gz FCFLTWQYFAWPTK-HXUWFJFHSA-N 0 3 415.537 4.467 20 0 HIADHN O=C(Nc1ccc2oc(C(F)(F)F)nc2c1)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000508130174 916950575 /nfs/dbraw/zinc/95/05/75/916950575.db2.gz AFQMHKKJGVNNST-OAHLLOKOSA-N 0 3 404.392 4.243 20 0 HIADHN Cc1cc(C(=O)NC2CCN([C@H](C)c3ccncc3)CC2)c(C)cc1Br ZINC000508142343 916962434 /nfs/dbraw/zinc/96/24/34/916962434.db2.gz KLPHVDGBKBBHDO-MRXNPFEDSA-N 0 3 416.363 4.416 20 0 HIADHN COCc1c(Br)cccc1NC(=O)N(CCN(C)C)Cc1ccccc1 ZINC000508183399 917004959 /nfs/dbraw/zinc/00/49/59/917004959.db2.gz RMFLOIAXMDHUOC-UHFFFAOYSA-N 0 3 420.351 4.191 20 0 HIADHN Cc1ccc2[nH]c([C@@H]3CCCN(C(=O)[C@@H]4CCCN4Cc4ccccc4)C3)nc2c1 ZINC000508245659 917063273 /nfs/dbraw/zinc/06/32/73/917063273.db2.gz DNCSQWCTWBXCBX-OFNKIYASSA-N 0 3 402.542 4.242 20 0 HIADHN Cc1ccc2nc([C@@H]3CCCN(C(=O)[C@@H]4CCCN4Cc4ccccc4)C3)[nH]c2c1 ZINC000508245659 917063291 /nfs/dbraw/zinc/06/32/91/917063291.db2.gz DNCSQWCTWBXCBX-OFNKIYASSA-N 0 3 402.542 4.242 20 0 HIADHN Cc1ccc2[nH]c([C@@H]3CCCN(C(=O)[C@H]4CCCN4Cc4ccccc4)C3)nc2c1 ZINC000508245657 917063670 /nfs/dbraw/zinc/06/36/70/917063670.db2.gz DNCSQWCTWBXCBX-NFBKMPQASA-N 0 3 402.542 4.242 20 0 HIADHN Cc1ccc2nc([C@@H]3CCCN(C(=O)[C@H]4CCCN4Cc4ccccc4)C3)[nH]c2c1 ZINC000508245657 917063682 /nfs/dbraw/zinc/06/36/82/917063682.db2.gz DNCSQWCTWBXCBX-NFBKMPQASA-N 0 3 402.542 4.242 20 0 HIADHN COC(=O)CCSCc1cccc(NC(=O)Nc2cccc(CN(C)C)c2)c1 ZINC000508267041 917085514 /nfs/dbraw/zinc/08/55/14/917085514.db2.gz XUICJBLWQSKLKB-UHFFFAOYSA-N 0 3 401.532 4.189 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)N1CCC[C@@H]1/C=C/c1ccccc1 ZINC000508296482 917105745 /nfs/dbraw/zinc/10/57/45/917105745.db2.gz DBCILZRICARHPZ-JHUUHBRDSA-N 0 3 419.569 4.031 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1occ2c1CCOC2)c1ccc(C(F)(F)F)cc1 ZINC000508421504 917210319 /nfs/dbraw/zinc/21/03/19/917210319.db2.gz YVARJJKAHQYZSW-GOSISDBHSA-N 0 3 410.436 4.184 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)[C@H](C)Cc2cncc3ccccc32)c1 ZINC000508467935 917253290 /nfs/dbraw/zinc/25/32/90/917253290.db2.gz KBZCOWCNKSLFEB-LJQANCHMSA-N 0 3 405.542 4.012 20 0 HIADHN COCCSc1ccc([C@H](C)NC(=O)NC[C@H](c2ccccc2)N(C)C)cc1 ZINC000508547079 917325153 /nfs/dbraw/zinc/32/51/53/917325153.db2.gz AFROPYRXGNBXLT-LAUBAEHRSA-N 0 3 401.576 4.088 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)C1CCC(OC(F)F)CC1 ZINC000508550260 917326919 /nfs/dbraw/zinc/32/69/19/917326919.db2.gz HHVXSXRVHAIQPW-UHFFFAOYSA-N 0 3 422.438 4.394 20 0 HIADHN CN(CCc1ccc(F)cc1)C(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000508600797 917370252 /nfs/dbraw/zinc/37/02/52/917370252.db2.gz ZGCNTUOYIUNFJF-OAQYLSRUSA-N 0 3 408.439 4.281 20 0 HIADHN CCc1ccc(-c2nn(Cc3ccccc3)cc2CN2CCC(CC(N)=O)CC2)cc1 ZINC000508634176 917397454 /nfs/dbraw/zinc/39/74/54/917397454.db2.gz DYMGDIVYRVXHET-UHFFFAOYSA-N 0 3 416.569 4.248 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)NCCCc2c[nH]c3ccc(F)cc23)CC1 ZINC000508636296 917401379 /nfs/dbraw/zinc/40/13/79/917401379.db2.gz XZZSULOOZYIUFX-UHFFFAOYSA-N 0 3 412.509 4.139 20 0 HIADHN Fc1cc(Br)ccc1[C@@H](NCc1ccccc1Cn1cncn1)C1CC1 ZINC000508737905 917497085 /nfs/dbraw/zinc/49/70/85/917497085.db2.gz CRISYHGWMACRSH-FQEVSTJZSA-N 0 3 415.310 4.469 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)c2ccc([C@@H]3CCCOC3)cc2)cc1 ZINC000508827311 917580337 /nfs/dbraw/zinc/58/03/37/917580337.db2.gz JMSJBCVZOUCETG-ISKFKSNPSA-N 0 3 408.542 4.156 20 0 HIADHN C[C@@H](NC(=O)N(C)Cc1ccc(OCC(F)(F)F)cc1)[C@H](c1ccccc1)N(C)C ZINC000508861844 917614994 /nfs/dbraw/zinc/61/49/94/917614994.db2.gz IKWIXIMAVFGXJZ-OXQOHEQNSA-N 0 3 423.479 4.461 20 0 HIADHN C[C@H](NC(=O)N1CCO[C@@H](c2cccc(Cl)c2)C1)[C@@H](c1ccccc1)N(C)C ZINC000508878692 917631774 /nfs/dbraw/zinc/63/17/74/917631774.db2.gz IHNGJAICWGKSDX-DQLDELGASA-N 0 3 401.938 4.114 20 0 HIADHN COc1ccc(CN(C)C(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)cc1OC(F)F ZINC000508892328 917647817 /nfs/dbraw/zinc/64/78/17/917647817.db2.gz CGKXFQXIHGSMQI-YWZLYKJASA-N 0 3 421.488 4.129 20 0 HIADHN COc1cc(CN(C)C(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)ccc1SC ZINC000508907780 917665262 /nfs/dbraw/zinc/66/52/62/917665262.db2.gz QZTJXTYHNAZMMO-KKSFZXQISA-N 0 3 401.576 4.250 20 0 HIADHN O=C(N1CCc2cc(F)c(F)cc21)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000508924166 917683301 /nfs/dbraw/zinc/68/33/01/917683301.db2.gz DDLSDALXPJNTNW-FQEVSTJZSA-N 0 3 410.386 4.309 20 0 HIADHN COc1ccc([C@@H](C)NC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)cc1 ZINC000508996602 917750220 /nfs/dbraw/zinc/75/02/20/917750220.db2.gz ODJXHHYBJWUDEJ-IERDGZPVSA-N 0 3 406.448 4.327 20 0 HIADHN CN(Cc1ccc(OC[C@@H]2CCCO2)cc1)[C@H](CO)c1cccc(Br)c1 ZINC000509100465 917840230 /nfs/dbraw/zinc/84/02/30/917840230.db2.gz ZLVWTQUNYBPFOB-LEWJYISDSA-N 0 3 420.347 4.172 20 0 HIADHN O=C(Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)c1coc(C2CCCC2)n1 ZINC000509187751 917895335 /nfs/dbraw/zinc/89/53/35/917895335.db2.gz PZLJBRKHQNNQSE-IBGZPJMESA-N 0 3 405.502 4.228 20 0 HIADHN Cc1nc2sccn2c(=O)c1CCN1CCC[C@@H]1c1cccc(Br)c1 ZINC000509277391 917961917 /nfs/dbraw/zinc/96/19/17/917961917.db2.gz BGRFSSOBPTWGGC-QGZVFWFLSA-N 0 3 418.360 4.207 20 0 HIADHN COc1cc(CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)ccc1OC(C)C ZINC000509344990 918009647 /nfs/dbraw/zinc/00/96/47/918009647.db2.gz PTNBNJNSAVXCCD-UHFFFAOYSA-N 0 3 417.937 4.382 20 0 HIADHN COc1ccc(C(=O)CCN2CCC[C@@H](c3nc(-c4ccc(F)cc4)no3)C2)cc1 ZINC000509347874 918013233 /nfs/dbraw/zinc/01/32/33/918013233.db2.gz GKXPJFMCVRXNRM-GOSISDBHSA-N 0 3 409.461 4.337 20 0 HIADHN COc1cc(CN2CCC[C@H](C(=O)Nc3ccc(Cl)cn3)C2)ccc1OC(C)C ZINC000509355390 918019472 /nfs/dbraw/zinc/01/94/72/918019472.db2.gz DDKWLYXTZMAEIY-KRWDZBQOSA-N 0 3 417.937 4.382 20 0 HIADHN Cn1cnnc1C1CCN(Cc2cnc(-c3ccc(Br)cc3)s2)CC1 ZINC000509358314 918022863 /nfs/dbraw/zinc/02/28/63/918022863.db2.gz NYMNJVRYKBFWKD-UHFFFAOYSA-N 0 3 418.364 4.081 20 0 HIADHN Cc1noc([C@H]2CCCN(Cc3cn(Cc4ccccc4)nc3-c3cccnc3)C2)n1 ZINC000509360989 918026346 /nfs/dbraw/zinc/02/63/46/918026346.db2.gz YPNWHTKPOPUIAM-NRFANRHFSA-N 0 3 414.513 4.064 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)N[C@@H](c1nccs1)c1ccccc1 ZINC000509364998 918030333 /nfs/dbraw/zinc/03/03/33/918030333.db2.gz ILWLKNAFZFCZJN-NHCUHLMSSA-N 0 3 406.555 4.369 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)N[C@@H](c2nccs2)c2ccccc2)N(C)C)cc1 ZINC000509369775 918035341 /nfs/dbraw/zinc/03/53/41/918035341.db2.gz FQEOMIWLWURTME-NHCUHLMSSA-N 0 3 408.571 4.397 20 0 HIADHN COC(=O)CCn1nc(C)c(CN2CCC[C@@H]2Cc2c(F)cccc2Cl)c1C ZINC000509381127 918047939 /nfs/dbraw/zinc/04/79/39/918047939.db2.gz WTTRRHJSSMTEAB-MRXNPFEDSA-N 0 3 407.917 4.063 20 0 HIADHN O=C(N1CCO[C@@H](c2ccccc2)C1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000509421799 918083565 /nfs/dbraw/zinc/08/35/65/918083565.db2.gz IMLKHCKWEULBIR-IRLDBZIGSA-N 0 3 418.459 4.041 20 0 HIADHN FC(F)(F)c1ccc(-c2ccc(CNCCc3nnnn3-c3ccccc3)o2)cc1 ZINC000509431074 918090241 /nfs/dbraw/zinc/09/02/41/918090241.db2.gz TUNJDWDWZSDHBZ-UHFFFAOYSA-N 0 3 413.403 4.273 20 0 HIADHN Cn1cc(-c2ccc(CN[C@H]3CC(=O)N(C)[C@H]3c3ccc(Cl)c(F)c3)s2)cn1 ZINC000509479651 918126664 /nfs/dbraw/zinc/12/66/64/918126664.db2.gz ZQSJVFDJZVHXSU-PXNSSMCTSA-N 0 3 418.925 4.003 20 0 HIADHN O=C(NCCCCOCc1ccccc1)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000509504984 918152185 /nfs/dbraw/zinc/15/21/85/918152185.db2.gz DBSSJKPKPJUGQN-JOCHJYFZSA-N 0 3 416.512 4.257 20 0 HIADHN Cc1nn(C(C)(C)C)c(C)c1CN1CCC(C(=O)Nc2cc(Cl)ccc2O)CC1 ZINC000509518522 918168646 /nfs/dbraw/zinc/16/86/46/918168646.db2.gz GGBQLHNSKPHUMT-UHFFFAOYSA-N 0 3 418.969 4.465 20 0 HIADHN COc1ccccc1NC(=O)C1CCN(Cc2c[nH]nc2-c2ccc(F)cc2)CC1 ZINC000509524806 918173756 /nfs/dbraw/zinc/17/37/56/918173756.db2.gz IXNCBWRKFGIROR-UHFFFAOYSA-N 0 3 408.477 4.075 20 0 HIADHN CCCOc1ccc(CN2CCC(C(=O)N3CCC[C@H](C)C3)CC2)cc1OCC ZINC000509533383 918180905 /nfs/dbraw/zinc/18/09/05/918180905.db2.gz QVMNRYNLZXLNOE-IBGZPJMESA-N 0 3 402.579 4.345 20 0 HIADHN COCCSc1ccc([C@@H](C)NC(=O)N2CCN(CCC(C)(C)C)CC2)cc1 ZINC000509537761 918187192 /nfs/dbraw/zinc/18/71/92/918187192.db2.gz DMBGWTBOHKATNR-GOSISDBHSA-N 0 3 407.624 4.250 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N(C)Cc1ccc(Br)s1)c1ccco1 ZINC000509559246 918208832 /nfs/dbraw/zinc/20/88/32/918208832.db2.gz SZLQSFSNFLKLIH-GXTWGEPZSA-N 0 3 414.369 4.374 20 0 HIADHN C[C@H]1CCCN(C(=O)C2CCN(Cc3ccc(OCc4ccncc4)cc3)CC2)C1 ZINC000509564231 918214680 /nfs/dbraw/zinc/21/46/80/918214680.db2.gz LZQXEDKYRTYVMC-FQEVSTJZSA-N 0 3 407.558 4.131 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N1CCC[C@H]1c1cccc2c1OCCO2)c1ccco1 ZINC000509565669 918216509 /nfs/dbraw/zinc/21/65/09/918216509.db2.gz AVHJHTFISPDGAE-UHOSZYNNSA-N 0 3 413.518 4.027 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N(C)CCc1ccc(Br)cc1)c1ccco1 ZINC000509572219 918220906 /nfs/dbraw/zinc/22/09/06/918220906.db2.gz ULZXEDPGGPSJKP-YJBOKZPZSA-N 0 3 422.367 4.355 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)Nc1cc(Cl)ccc1F ZINC000509593337 918242702 /nfs/dbraw/zinc/24/27/02/918242702.db2.gz QIZOLZJSBNNUDM-UHFFFAOYSA-N 0 3 404.917 4.203 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N[C@@H](CO)c1c(Cl)cccc1Cl)c1ccco1 ZINC000509594333 918242892 /nfs/dbraw/zinc/24/28/92/918242892.db2.gz ZZYOPXALCFRSCQ-MAZHCROVSA-N 0 3 414.333 4.048 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N(C)Cc1cccc(Br)c1)c1ccco1 ZINC000509596594 918246777 /nfs/dbraw/zinc/24/67/77/918246777.db2.gz RZHYNYVHRCLURB-YOEHRIQHSA-N 0 3 408.340 4.313 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)Nc1cccc(Cl)c1F ZINC000509620844 918268015 /nfs/dbraw/zinc/26/80/15/918268015.db2.gz SBKLPFUUKROXRQ-UHFFFAOYSA-N 0 3 404.917 4.203 20 0 HIADHN O=C(N[C@H](C[C@@H]1CCOC1)c1ccccc1)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000509751276 918368718 /nfs/dbraw/zinc/36/87/18/918368718.db2.gz MXWBZDKXQAXLTA-ZTCOLXNVSA-N 0 3 407.558 4.291 20 0 HIADHN CC[C@H](CNC(=O)N[C@H](C[C@@H]1CCOC1)c1ccccc1)N1CCc2ccccc2C1 ZINC000509752890 918370788 /nfs/dbraw/zinc/37/07/88/918370788.db2.gz WDEPZRYHJPJRJH-BUUDZMLXSA-N 0 3 421.585 4.290 20 0 HIADHN CCCN(CCc1ccccn1)C(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000509797888 918403234 /nfs/dbraw/zinc/40/32/34/918403234.db2.gz DVLLREHTXRWPJE-NRFANRHFSA-N 0 3 401.501 4.020 20 0 HIADHN COc1cc2c(cc1OC)[C@@H](c1ccccc1)N(C(=O)[C@H](C)N1CCCCCC1)CC2 ZINC000509812512 918415295 /nfs/dbraw/zinc/41/52/95/918415295.db2.gz YLWSFDSFJOCMAS-UQBPGWFLSA-N 0 3 422.569 4.442 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)c1cscc1Br ZINC000509824526 918426386 /nfs/dbraw/zinc/42/63/86/918426386.db2.gz AWUAYZLOUFDRCA-UHFFFAOYSA-N 0 3 411.390 4.354 20 0 HIADHN COC(=O)CCSCc1cccc(NC(=O)N2CCN(CCC(C)(C)C)CC2)c1 ZINC000509841761 918444785 /nfs/dbraw/zinc/44/47/85/918444785.db2.gz YXXZAQLTHRNQOS-UHFFFAOYSA-N 0 3 421.607 4.069 20 0 HIADHN Cc1nn(Cc2ccc(C)cc2)c(C)c1CN[C@@H]1CCN(C(=O)Nc2ccccc2)C1 ZINC000509948669 918544119 /nfs/dbraw/zinc/54/41/19/918544119.db2.gz KIDIWYKJPBBKRX-HSZRJFAPSA-N 0 3 417.557 4.253 20 0 HIADHN CN(c1ccccc1)c1ccc(CN[C@H]2CCN(C(=O)Nc3ccccc3)C2)cn1 ZINC000510022994 918598875 /nfs/dbraw/zinc/59/88/75/918598875.db2.gz IDBHXMIBVZVAAX-NRFANRHFSA-N 0 3 401.514 4.246 20 0 HIADHN CC[C@@H](CNC(=O)Cc1ccc(Br)s1)N1CCc2ccccc2C1 ZINC000510090942 918656755 /nfs/dbraw/zinc/65/67/55/918656755.db2.gz UCMHRYSSHOBSKW-INIZCTEOSA-N 0 3 407.377 4.006 20 0 HIADHN CC[C@H](NCc1cc2c(c(Br)c1)OCO2)c1ccc(OC)c(OC)c1 ZINC000510205918 918755616 /nfs/dbraw/zinc/75/56/16/918755616.db2.gz ALMSKLVXTJABFK-HNNXBMFYSA-N 0 3 408.292 4.436 20 0 HIADHN Cc1cc2cccnc2c(NC(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)c1 ZINC000510273023 918800111 /nfs/dbraw/zinc/80/01/11/918800111.db2.gz SDNSWFQKHAGKDR-KDURUIRLSA-N 0 3 410.562 4.286 20 0 HIADHN Cc1cc2cccnc2c(NC(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)c1 ZINC000510273025 918800373 /nfs/dbraw/zinc/80/03/73/918800373.db2.gz SDNSWFQKHAGKDR-RTBURBONSA-N 0 3 410.562 4.286 20 0 HIADHN CC(C)(C)c1csc(CCNC(=O)[C@H]2CN(Cc3ccccc3)CCC2(F)F)n1 ZINC000510298130 918815035 /nfs/dbraw/zinc/81/50/35/918815035.db2.gz MUOQFZAXQHZLSU-QGZVFWFLSA-N 0 3 421.557 4.257 20 0 HIADHN C[C@@H](C(=O)NCC1(c2ccc(Cl)cc2Cl)CCOCC1)N1CCCCCC1 ZINC000510492604 918940972 /nfs/dbraw/zinc/94/09/72/918940972.db2.gz RCGJHFJZGLKFDK-INIZCTEOSA-N 0 3 413.389 4.422 20 0 HIADHN CCOc1cc(CN2CCC(N3CCO[C@H](C)C3)CC2)ccc1OCc1ccccc1 ZINC000510506918 918954492 /nfs/dbraw/zinc/95/44/92/918954492.db2.gz BXGQKZCPPKPXMV-OAQYLSRUSA-N 0 3 424.585 4.349 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)NCCc2ccc(Br)s2)C1 ZINC000510530936 918975884 /nfs/dbraw/zinc/97/58/84/918975884.db2.gz JXQQVTVKRFRKTI-GDBMZVCRSA-N 0 3 422.392 4.188 20 0 HIADHN Cc1ccc(-n2cc(CN3CCC(N4CCO[C@H](C)C4)CC3)c(C(C)(C)C)n2)cc1 ZINC000510534121 918980837 /nfs/dbraw/zinc/98/08/37/918980837.db2.gz OJGVRIFYOGCKCW-HXUWFJFHSA-N 0 3 410.606 4.163 20 0 HIADHN C[C@H]1CN(C2CCN(Cc3ccc(Oc4ccccc4F)c(F)c3)CC2)CCO1 ZINC000510556792 919000646 /nfs/dbraw/zinc/00/06/46/919000646.db2.gz AKNXPJUTHLGXPH-KRWDZBQOSA-N 0 3 402.485 4.442 20 0 HIADHN O=C(N[C@@H](c1nccs1)c1ccccc1)N1CCCN(Cc2ccccc2)CC1 ZINC000510581671 919024927 /nfs/dbraw/zinc/02/49/27/919024927.db2.gz ZKKFWUGIYJPDDB-OAQYLSRUSA-N 0 3 406.555 4.150 20 0 HIADHN C[C@H](NC(=O)NCc1ccc(-c2ccc3c(c2)C[C@H](C)O3)cc1)C1=CCN(C)CC1 ZINC000510605168 919046291 /nfs/dbraw/zinc/04/62/91/919046291.db2.gz ATMAGUBSOREMFR-ROUUACIJSA-N 0 3 405.542 4.127 20 0 HIADHN CCOC(=O)c1cnn(C2CCN(Cc3ccc(OC(F)(F)F)cc3)CC2)c1C ZINC000510634416 919074778 /nfs/dbraw/zinc/07/47/78/919074778.db2.gz RHXUOBBWSSATTQ-UHFFFAOYSA-N 0 3 411.424 4.104 20 0 HIADHN CC(C)[C@H]([NH2+][C@@H](C)CCc1ccc(C(F)(F)F)cc1)c1nc(-c2nc[n-]n2)no1 ZINC000510680848 919119541 /nfs/dbraw/zinc/11/95/41/919119541.db2.gz JFPUCIGHTNDHKS-WFASDCNBSA-N 0 3 408.428 4.182 20 0 HIADHN COc1ccc(-c2nc3c(s2)[C@@H](NCc2ccc4c(c2)oc(=O)n4C)CCC3)cc1 ZINC000510713979 919155242 /nfs/dbraw/zinc/15/52/42/919155242.db2.gz CUNYBEYAXDRPGP-KRWDZBQOSA-N 0 3 421.522 4.431 20 0 HIADHN Cc1cc(OC(F)F)c(C(=O)N(CCN(C)C)Cc2ccc(F)cc2F)s1 ZINC000510727823 919172153 /nfs/dbraw/zinc/17/21/53/919172153.db2.gz VIAHEYRYWQOBPU-UHFFFAOYSA-N 0 3 404.429 4.140 20 0 HIADHN Cc1cc(OC(F)F)c(C(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)s1 ZINC000510741985 919188561 /nfs/dbraw/zinc/18/85/61/919188561.db2.gz UJUAWCFBXVCUSE-UHFFFAOYSA-N 0 3 404.429 4.140 20 0 HIADHN O=C([C@H](Cc1ccccc1)N[C@@H]1CCc2ccc(Br)cc21)N1CCCC1 ZINC000510745604 919194802 /nfs/dbraw/zinc/19/48/02/919194802.db2.gz CRFAIXJHENEQFM-RTWAWAEBSA-N 0 3 413.359 4.260 20 0 HIADHN O=C([C@@H](Cc1ccccc1)N[C@H]1CCc2ccc(Br)cc21)N1CCCC1 ZINC000510745602 919195133 /nfs/dbraw/zinc/19/51/33/919195133.db2.gz CRFAIXJHENEQFM-LEWJYISDSA-N 0 3 413.359 4.260 20 0 HIADHN CC1(c2ccccc2)CCN(CC(=O)N2CCC(OCc3ccccc3)CC2)CC1 ZINC000510746256 919195392 /nfs/dbraw/zinc/19/53/92/919195392.db2.gz DWPXYZSBSSPLSE-UHFFFAOYSA-N 0 3 406.570 4.248 20 0 HIADHN COc1ccc([C@@H](NCC(=O)N(C)Cc2ccc(OC(F)F)cc2)C(C)C)cc1 ZINC000510748554 919200180 /nfs/dbraw/zinc/20/01/80/919200180.db2.gz QCBSJNCCVHNHMX-NRFANRHFSA-N 0 3 406.473 4.242 20 0 HIADHN COCCNC(=O)c1c[nH]nc1[C@@H]1CCCN(Cc2ccc(C3CCCCC3)cc2)C1 ZINC000510756156 919206432 /nfs/dbraw/zinc/20/64/32/919206432.db2.gz WNMKZXGKUURXSX-JOCHJYFZSA-N 0 3 424.589 4.213 20 0 HIADHN COC(=O)c1c(C)c(C)sc1NC(=O)CN[C@H](c1ccc(OC)cc1)C(C)C ZINC000510807682 919283094 /nfs/dbraw/zinc/28/30/94/919283094.db2.gz BOSXGIKHIQMFMI-IBGZPJMESA-N 0 3 404.532 4.086 20 0 HIADHN CCOc1cc2c(cc1CNC(=O)c1oc3ccccc3c1CN(C)C)O[C@H](C)C2 ZINC000510902535 919402642 /nfs/dbraw/zinc/40/26/42/919402642.db2.gz MWZLHMBBCFJMAS-OAHLLOKOSA-N 0 3 408.498 4.147 20 0 HIADHN O=C(Cc1ccccc1)N1CCC[C@H](N[C@H]2CCCc3nn(-c4ccccc4)cc32)C1 ZINC000510934362 919455850 /nfs/dbraw/zinc/45/58/50/919455850.db2.gz YGBLNHFSAYOXBK-URXFXBBRSA-N 0 3 414.553 4.073 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N[C@H](CC(F)(F)F)c2ccc(F)cc2)CC1 ZINC000510952843 919487406 /nfs/dbraw/zinc/48/74/06/919487406.db2.gz RKZGYWOAAJQAIU-GOSISDBHSA-N 0 3 419.463 4.008 20 0 HIADHN C[C@H](N[C@@H]1CCCc2nn(C)cc21)c1cccc(OCc2cn3ccccc3n2)c1 ZINC000511009422 919571294 /nfs/dbraw/zinc/57/12/94/919571294.db2.gz FPSGYQJWHWCXSD-HTAPYJJXSA-N 0 3 401.514 4.375 20 0 HIADHN Fc1cccc([C@@H](NCCc2nnnn2-c2ccccc2)c2cccc(Cl)c2)c1 ZINC000511010295 919573395 /nfs/dbraw/zinc/57/33/95/919573395.db2.gz JANYTJLIWZUWBF-QFIPXVFZSA-N 0 3 407.880 4.377 20 0 HIADHN COc1ccc([C@H](N[C@@H]2CCN(C(=O)COc3ccccc3)C2)c2ccccc2)cc1 ZINC000511051157 919645386 /nfs/dbraw/zinc/64/53/86/919645386.db2.gz USVFMVWHDGMSEH-ATIYNZHBSA-N 0 3 416.521 4.054 20 0 HIADHN C[C@@H]1CN(c2ccccc2NC(=O)N2CCCN(Cc3ccccc3)CC2)C[C@H](C)O1 ZINC000511054691 919649780 /nfs/dbraw/zinc/64/97/80/919649780.db2.gz PKLXLIIQIPVXBD-OYRHEFFESA-N 0 3 422.573 4.040 20 0 HIADHN C[C@H](CNC(=O)C1(c2ccc(C(C)(C)C)cc2)CCCCC1)CN1CCN(C)CC1 ZINC000511057327 919652362 /nfs/dbraw/zinc/65/23/62/919652362.db2.gz UARODBWQKCOMSA-OAQYLSRUSA-N 0 3 413.650 4.186 20 0 HIADHN Cc1ccc(C)c(-n2ccnc2SCC(=O)N(CC(C)C)C2CCN(C)CC2)c1 ZINC000511056494 919652415 /nfs/dbraw/zinc/65/24/15/919652415.db2.gz NMJMANREHJWKBG-UHFFFAOYSA-N 0 3 414.619 4.160 20 0 HIADHN COc1cccc(OC)c1OC[C@@H](O)CN1CCC([C@@H](F)c2ccccc2F)CC1 ZINC000511090280 919693750 /nfs/dbraw/zinc/69/37/50/919693750.db2.gz MLJONZFDFOAIJQ-HTAPYJJXSA-N 0 3 421.484 4.005 20 0 HIADHN CN(C)Cc1ccccc1CNC(=O)C1CCC(NC(=O)CC2CCCCC2)CC1 ZINC000511122973 919736041 /nfs/dbraw/zinc/73/60/41/919736041.db2.gz RKZRFKVSTPXJDJ-UHFFFAOYSA-N 0 3 413.606 4.010 20 0 HIADHN CN(C)C(=O)CC1CCN(Cc2cn(-c3ccccc3)nc2-c2ccccc2)CC1 ZINC000511217154 919826885 /nfs/dbraw/zinc/82/68/85/919826885.db2.gz WFLGUYRJPNECJQ-UHFFFAOYSA-N 0 3 402.542 4.230 20 0 HIADHN C[C@@H](NC(=O)Nc1ccc(Br)c(C(F)(F)F)c1)C1=CCN(C)CC1 ZINC000511231559 919835790 /nfs/dbraw/zinc/83/57/90/919835790.db2.gz IITXQNYYZHUQDE-SNVBAGLBSA-N 0 3 406.246 4.240 20 0 HIADHN C[C@H](NC(=O)N1CCc2ccccc2[C@@H](c2ccccc2)[C@@H]1C)C1=CCN(C)CC1 ZINC000511232291 919836647 /nfs/dbraw/zinc/83/66/47/919836647.db2.gz JZLHQIJKAGAXFX-ZYLNGJIFSA-N 0 3 403.570 4.425 20 0 HIADHN COc1cc(CN(C)C(=O)N[C@H](C)C2=CCN(C)CC2)ccc1OCc1ccccc1 ZINC000511276389 919873390 /nfs/dbraw/zinc/87/33/90/919873390.db2.gz ZIHMQJXRGWOSIU-LJQANCHMSA-N 0 3 423.557 4.066 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1NC(=O)N(CCN(C)C)Cc1ccc(F)cc1 ZINC000511282804 919877166 /nfs/dbraw/zinc/87/71/66/919877166.db2.gz UFWPSZCZWZZVKX-UHFFFAOYSA-N 0 3 409.509 4.224 20 0 HIADHN CCOc1c(Br)cc(Cl)cc1NC(=O)N[C@@H](C)C1=CCN(C)CC1 ZINC000511285721 919881747 /nfs/dbraw/zinc/88/17/47/919881747.db2.gz KEGYFJAFGAGGKJ-NSHDSACASA-N 0 3 416.747 4.273 20 0 HIADHN Cc1ccc([C@H](CN[C@@H](c2ccc(Cl)cc2)[C@@H]2CN(C)CCO2)N2CCCC2)o1 ZINC000511367141 919959364 /nfs/dbraw/zinc/95/93/64/919959364.db2.gz MSITVWDCVXBQGM-PMVMPFDFSA-N 0 3 417.981 4.040 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)N[C@H](C[C@H]1CCOC1)c1ccccc1 ZINC000511373122 919970528 /nfs/dbraw/zinc/97/05/28/919970528.db2.gz MTCBNAKHAYCMMF-AGILITTLSA-N 0 3 407.558 4.291 20 0 HIADHN CN(C(=O)N[C@H](C[C@H]1CCOC1)c1ccccc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000511398719 920011523 /nfs/dbraw/zinc/01/15/23/920011523.db2.gz NXRSXVCWFSSWCR-YFNKSVMNSA-N 0 3 407.558 4.070 20 0 HIADHN CC(=O)Nc1ccc(-c2csc(NC(=O)c3ccc(CN(C)C)cc3)n2)c(F)c1 ZINC000511503672 920118467 /nfs/dbraw/zinc/11/84/67/920118467.db2.gz IYEJKPOETIQMRE-UHFFFAOYSA-N 0 3 412.490 4.222 20 0 HIADHN O=C(CN[C@@H](c1cccc(OC(F)(F)F)c1)C1CC1)N1CCc2ccccc2C1 ZINC000511543019 920167386 /nfs/dbraw/zinc/16/73/86/920167386.db2.gz RCSFCVCMQXFURV-OAQYLSRUSA-N 0 3 404.432 4.211 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)N[C@H](CC(F)(F)F)c2ccc(F)cc2)o1 ZINC000511544092 920170928 /nfs/dbraw/zinc/17/09/28/920170928.db2.gz WTRMPHIIPYOARE-GOSISDBHSA-N 0 3 415.431 4.494 20 0 HIADHN COc1ccc(C[C@H](C)C(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)cc1OC ZINC000511551531 920185763 /nfs/dbraw/zinc/18/57/63/920185763.db2.gz LNPPFTKQQIVRTR-VQTJNVASSA-N 0 3 410.558 4.005 20 0 HIADHN CN(Cc1ccccc1)Cc1cccc(C(=O)NC[C@H](c2ccco2)N2CCCC2)c1 ZINC000511568386 920210334 /nfs/dbraw/zinc/21/03/34/920210334.db2.gz ZDMHOCXXAJHREI-XMMPIXPASA-N 0 3 417.553 4.479 20 0 HIADHN C[C@H](O)CN(Cc1nc(-c2ccc(Br)s2)no1)C1CCCCC1 ZINC000511593204 920238811 /nfs/dbraw/zinc/23/88/11/920238811.db2.gz NPHVEPYEBZIYAB-NSHDSACASA-N 0 3 400.342 4.076 20 0 HIADHN C[C@@H](N[C@@H](c1cccc(OC(F)(F)F)c1)C1CC1)C(=O)NCCc1cccs1 ZINC000511623846 920281929 /nfs/dbraw/zinc/28/19/29/920281929.db2.gz OJDRGGZDRBUBAB-FZKQIMNGSA-N 0 3 412.477 4.435 20 0 HIADHN CC(=O)NCC1CCN(Cc2cn(-c3ccccc3Cl)nc2C(C)(C)C)CC1 ZINC000511664899 920330719 /nfs/dbraw/zinc/33/07/19/920330719.db2.gz IAJPGVZSLZWXPK-UHFFFAOYSA-N 0 3 402.970 4.171 20 0 HIADHN O=C(Nc1nc(CN2CCCCCC2)cs1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000511667408 920333922 /nfs/dbraw/zinc/33/39/22/920333922.db2.gz YVEGTCYJZFECQH-FQEVSTJZSA-N 0 3 412.603 4.370 20 0 HIADHN O=C(CSC[C@H]1CCCCO1)N[C@@H]1CN(Cc2ccccc2)C[C@H]1c1ccccc1 ZINC000511742865 920418557 /nfs/dbraw/zinc/41/85/57/920418557.db2.gz MWVCQUWBWMDSFF-TZRRMPRUSA-N 0 3 424.610 4.073 20 0 HIADHN Fc1cc(-c2noc(CN3C[C@H](c4ccccc4)[C@@H]4COCC[C@H]43)n2)cc(F)c1F ZINC000511761409 920443209 /nfs/dbraw/zinc/44/32/09/920443209.db2.gz IMVUUSWRWCDZIR-JTDSTZFVSA-N 0 3 415.415 4.158 20 0 HIADHN CC(C)(C)[C@H](NC(=O)CN1C[C@H](c2ccccc2)[C@@H]2COCC[C@H]21)c1cccs1 ZINC000511765939 920451842 /nfs/dbraw/zinc/45/18/42/920451842.db2.gz YMMGCJZKVQVANQ-VLVHOKLOSA-N 0 3 412.599 4.456 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)N1CCc2c(ncn2-c2ccc(F)cc2)C1 ZINC000511769375 920457131 /nfs/dbraw/zinc/45/71/31/920457131.db2.gz DTFORWPVACSEPL-UHFFFAOYSA-N 0 3 418.472 4.018 20 0 HIADHN Brc1ccc2[nH]c(CN3C[C@H](c4ccccc4)[C@@H]4COCC[C@@H]43)nc2c1 ZINC000511775956 920464121 /nfs/dbraw/zinc/46/41/21/920464121.db2.gz JCCGHGDZQWQKEM-UWVAXJGDSA-N 0 3 412.331 4.330 20 0 HIADHN CCOc1ccccc1[C@H](CC)NC(=O)CN1C[C@H](c2ccccc2)[C@@H]2COCC[C@H]21 ZINC000511779066 920468568 /nfs/dbraw/zinc/46/85/68/920468568.db2.gz DVLPMHFTMKKASZ-NAVOZUGXSA-N 0 3 422.569 4.157 20 0 HIADHN C[C@H](c1cc2ccccc2o1)N(C)C(=O)CN1C[C@H](c2ccccc2)[C@H]2COCC[C@@H]21 ZINC000511781864 920472738 /nfs/dbraw/zinc/47/27/38/920472738.db2.gz UCRASNBDRBIWSK-HWHRFOGPSA-N 0 3 418.537 4.457 20 0 HIADHN C[C@H](c1cc2ccccc2o1)N(C)C(=O)CN1C[C@H](c2ccccc2)[C@H]2COCC[C@H]21 ZINC000511781866 920473091 /nfs/dbraw/zinc/47/30/91/920473091.db2.gz UCRASNBDRBIWSK-RLLPEYFOSA-N 0 3 418.537 4.457 20 0 HIADHN Nc1nc(CN2C[C@H](c3ccccc3)[C@@H]3COCC[C@@H]32)nc2sc3c(c21)CCCC3 ZINC000511786290 920479703 /nfs/dbraw/zinc/47/97/03/920479703.db2.gz MHZCTWLTFCJAEF-QYZOEREBSA-N 0 3 420.582 4.157 20 0 HIADHN Cn1c(CN[C@H]2CCC[C@@H]2c2cccc(C(F)(F)F)c2)nc2ccccc2c1=O ZINC000511806841 920501408 /nfs/dbraw/zinc/50/14/08/920501408.db2.gz BCRZZAJUBSKWBF-AEFFLSMTSA-N 0 3 401.432 4.378 20 0 HIADHN O=C(CN1C[C@H](c2ccccc2)[C@@H]2CCC[C@@H]21)Nc1ccccc1N1CCCC1=O ZINC000511830019 920531327 /nfs/dbraw/zinc/53/13/27/920531327.db2.gz NRQIZNXPXTYPBI-VWPQPMDRSA-N 0 3 403.526 4.020 20 0 HIADHN CCCN(CC)C(=O)c1ccc(C(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)cc1 ZINC000511828905 920531767 /nfs/dbraw/zinc/53/17/67/920531767.db2.gz GYVDQNPIQQAWRP-WMZHIEFXSA-N 0 3 407.558 4.124 20 0 HIADHN O=C(Cc1ccccc1Br)Nc1ccc(CCN2CCSCC2)cc1 ZINC000511879336 920613548 /nfs/dbraw/zinc/61/35/48/920613548.db2.gz PBJFREADSCSOPZ-UHFFFAOYSA-N 0 3 419.388 4.222 20 0 HIADHN Cc1cc(NC(=O)c2ccc(CN3CCC(CO)CC3)cc2)ccc1Br ZINC000511886306 920622701 /nfs/dbraw/zinc/62/27/01/920622701.db2.gz OIXZAUKGITVEHM-UHFFFAOYSA-N 0 3 417.347 4.214 20 0 HIADHN Cc1ccc2[nH]c3c(c2c1)C[C@H](NCc1ncc(I)s1)CC3 ZINC000511906159 920644325 /nfs/dbraw/zinc/64/43/25/920644325.db2.gz IIFVEDCCQMKWPH-LLVKDONJSA-N 0 3 423.323 4.185 20 0 HIADHN CN(C)Cc1cnc(CN[C@H](Cc2cccc(Br)c2)CC2CC2)s1 ZINC000511959735 920721992 /nfs/dbraw/zinc/72/19/92/920721992.db2.gz GRUCOFPEZQCOTA-KRWDZBQOSA-N 0 3 408.409 4.468 20 0 HIADHN COc1cc(F)c([C@@H](C)NC(=O)NC[C@@H](c2ccccc2)N2CCCC2)cc1OC ZINC000512024508 920800351 /nfs/dbraw/zinc/80/03/51/920800351.db2.gz FGUDEZMVYDACKI-UZLBHIALSA-N 0 3 415.509 4.040 20 0 HIADHN COc1ccc(CNC[C@@H](C)c2nc(-c3ccccc3)no2)c(Br)c1 ZINC000512054110 920822853 /nfs/dbraw/zinc/82/28/53/920822853.db2.gz TYCBHLZDPCMSMN-CYBMUJFWSA-N 0 3 402.292 4.401 20 0 HIADHN C[C@@H](CC(=O)Nc1cc(C(F)(F)F)ccc1Cl)N[C@H]1c2ccccc2C[C@H]1O ZINC000512084346 920847640 /nfs/dbraw/zinc/84/76/40/920847640.db2.gz OZXZGCIWIGPMRB-JVMOKEISSA-N 0 3 412.839 4.324 20 0 HIADHN C[C@H]1CN(Cc2ccc(CNCc3cscc3Br)cc2)C[C@H](C)O1 ZINC000512088942 920853117 /nfs/dbraw/zinc/85/31/17/920853117.db2.gz PXAKANIWIUSIJL-GJZGRUSLSA-N 0 3 409.393 4.410 20 0 HIADHN Cc1ccc(-c2cc(C(=O)N[C@H](C)C3=CCN(C)CC3)c3cnn(C(C)C)c3n2)s1 ZINC000512106731 920863859 /nfs/dbraw/zinc/86/38/59/920863859.db2.gz ACGSQEKSHGPZHG-MRXNPFEDSA-N 0 3 423.586 4.429 20 0 HIADHN CNS(=O)(=O)c1ccc([C@H](C)N[C@@H](C)c2cc(C)c(Br)s2)cc1 ZINC000512112612 920868545 /nfs/dbraw/zinc/86/85/45/920868545.db2.gz FFBBHLJYANGJLW-RYUDHWBXSA-N 0 3 417.394 4.139 20 0 HIADHN C[C@H](Cc1ccc(O)cc1)N[C@@H](c1ccc(F)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000512117772 920870396 /nfs/dbraw/zinc/87/03/96/920870396.db2.gz ZVDASJRZCRVFSV-MWTRTKDXSA-N 0 3 413.514 4.245 20 0 HIADHN Cc1nn(-c2ccccc2Cl)c2sc(C(=O)N[C@H](C)C3=CCN(C)CC3)cc12 ZINC000512123875 920874414 /nfs/dbraw/zinc/87/44/14/920874414.db2.gz OJDXDURKAWFXCA-CYBMUJFWSA-N 0 3 414.962 4.429 20 0 HIADHN Cc1cc(-c2cc(C(=O)N[C@H](C)C3=CCN(C)CC3)c3cnn(C(C)C)c3n2)c(C)o1 ZINC000512126923 920876592 /nfs/dbraw/zinc/87/65/92/920876592.db2.gz ILFLFBAICLCBJP-MRXNPFEDSA-N 0 3 421.545 4.269 20 0 HIADHN C[C@@H](NC(=O)c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1)C1=CCN(C)CC1 ZINC000512138827 920884883 /nfs/dbraw/zinc/88/48/83/920884883.db2.gz NFOSSOMZERGQTF-CQSZACIVSA-N 0 3 405.420 4.273 20 0 HIADHN Cc1cc(-c2cc(C(=O)N[C@H](C)C3=CCN(C)CC3)c3c(C)noc3n2)c(C)s1 ZINC000512139834 920885902 /nfs/dbraw/zinc/88/59/02/920885902.db2.gz TZUDWVMZUDBILU-CYBMUJFWSA-N 0 3 410.543 4.257 20 0 HIADHN Cc1cc2ncn(C[C@@H](O)CN[C@H](CCO)c3ccc(Cl)c(Cl)c3)c2cc1C ZINC000512194277 920938047 /nfs/dbraw/zinc/93/80/47/920938047.db2.gz HLAYPIUZNVKERI-QFBILLFUSA-N 0 3 422.356 4.034 20 0 HIADHN CCN(CC)C(=O)C1CCN(Cc2ccc(OC)c(OCc3ccccc3)c2)CC1 ZINC000512205370 920951989 /nfs/dbraw/zinc/95/19/89/920951989.db2.gz YJZSIJWILPUYGP-UHFFFAOYSA-N 0 3 410.558 4.355 20 0 HIADHN CCN(CC)C(=O)C1CCN(Cc2c(C)nn(Cc3ccccc3Cl)c2C)CC1 ZINC000512240913 920996986 /nfs/dbraw/zinc/99/69/86/920996986.db2.gz FKMVCYVMJXUFQK-UHFFFAOYSA-N 0 3 416.997 4.282 20 0 HIADHN O=C(Cc1cccc(F)c1)N1CCCN(Cc2cccc(-c3ccncc3)c2)CC1 ZINC000512266719 921022980 /nfs/dbraw/zinc/02/29/80/921022980.db2.gz CQUZNMPYHGBUSE-UHFFFAOYSA-N 0 3 403.501 4.165 20 0 HIADHN CCC[C@@]1(NCC(=O)N(Cc2ccccc2)c2nc3c(s2)CCCC3)CCOC1 ZINC000512267013 921023958 /nfs/dbraw/zinc/02/39/58/921023958.db2.gz DMYQICWATHRWJT-HSZRJFAPSA-N 0 3 413.587 4.104 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)C[C@H](C)NCc1cn(-c2ccccc2)nc1C ZINC000512323897 921074947 /nfs/dbraw/zinc/07/49/47/921074947.db2.gz ODHVUNIUCKXAJN-HNNXBMFYSA-N 0 3 412.921 4.350 20 0 HIADHN C[C@H](C(=O)Nc1ccc(CC(=O)N2CCCc3ccccc32)cc1)N1[C@H](C)CC[C@@H]1C ZINC000512349584 921094338 /nfs/dbraw/zinc/09/43/38/921094338.db2.gz YBCVWHGHHPZNFN-HSALFYBXSA-N 0 3 419.569 4.408 20 0 HIADHN CCOc1cc(CN2CC[C@H](c3cccc(F)c3)C2)ccc1O[C@H](C)C(=O)N(C)C ZINC000513460267 921824517 /nfs/dbraw/zinc/82/45/17/921824517.db2.gz DGDVAPCQNARUSQ-XLIONFOSSA-N 0 3 414.521 4.069 20 0 HIADHN Fc1cccc(Cl)c1COc1ccc(CN2CCC[C@@H](n3cncn3)C2)cc1 ZINC000513484382 921839887 /nfs/dbraw/zinc/83/98/87/921839887.db2.gz JUFQGWCQAZIROZ-QGZVFWFLSA-N 0 3 400.885 4.487 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)NCc1ccc(NC(=O)c2ccco2)cc1)c1ccco1 ZINC000513502709 921852496 /nfs/dbraw/zinc/85/24/96/921852496.db2.gz DKFXDZHKOPNLIH-LPHOPBHVSA-N 0 3 424.501 4.054 20 0 HIADHN COc1ccc(NC(=O)C[C@@H](C)NCc2ccc(-c3csc(C)n3)o2)c(OC)c1 ZINC000513581993 921913818 /nfs/dbraw/zinc/91/38/18/921913818.db2.gz FQKOANLPAUACPO-CYBMUJFWSA-N 0 3 415.515 4.236 20 0 HIADHN O=C(NC[C@H]1CCCN1Cc1ccccc1)c1ccc(OCc2ccncc2)cc1 ZINC000513591548 921922249 /nfs/dbraw/zinc/92/22/49/921922249.db2.gz HEHIXULOGYKQNC-HSZRJFAPSA-N 0 3 401.510 4.055 20 0 HIADHN Cc1ccc(-c2ccc(C(=O)Nc3cccc(CN4CCC(C(N)=O)CC4)c3)s2)o1 ZINC000513674284 921997078 /nfs/dbraw/zinc/99/70/78/921997078.db2.gz DYOQFHJPYXWELZ-UHFFFAOYSA-N 0 3 423.538 4.266 20 0 HIADHN COc1ccc([C@H](Cc2ccncc2)N[C@@H]2CC(=O)N(c3c(F)cccc3F)C2)cc1 ZINC000513685006 922005762 /nfs/dbraw/zinc/00/57/62/922005762.db2.gz WCNDPUQVPPSQSF-GCJKJVERSA-N 0 3 423.463 4.047 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)c1ccn(Cc2ccccc2)c1 ZINC000513744270 922066043 /nfs/dbraw/zinc/06/60/43/922066043.db2.gz IZKFURDTAHNPEU-UHFFFAOYSA-N 0 3 405.567 4.380 20 0 HIADHN O[C@H](COc1cccc2[nH]ccc21)CN1CCC(Oc2ccccc2Cl)CC1 ZINC000513786990 922112156 /nfs/dbraw/zinc/11/21/56/922112156.db2.gz RAUUDKINXYBBKC-INIZCTEOSA-N 0 3 400.906 4.104 20 0 HIADHN Fc1ccc(N2CCOCC2)c(CN[C@H]2CCc3c2cccc3Br)c1 ZINC000513871351 922200555 /nfs/dbraw/zinc/20/05/55/922200555.db2.gz PHIHMGBXXQIEGZ-IBGZPJMESA-N 0 3 405.311 4.202 20 0 HIADHN CC(C)CC(=O)Nc1cccc(CNC(=O)NC[C@@H](c2ccccc2)N2CCCC2)c1 ZINC000513915867 922239564 /nfs/dbraw/zinc/23/95/64/922239564.db2.gz YHGVGMJZZDYEFD-QHCPKHFHSA-N 0 3 422.573 4.308 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)Nc2cccc(C(F)F)c2)CC1 ZINC000513922903 922245414 /nfs/dbraw/zinc/24/54/14/922245414.db2.gz XHXZYCGDYZGAJJ-UHFFFAOYSA-N 0 3 402.489 4.083 20 0 HIADHN Cc1noc(C)c1[C@@H](C)CC(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000513929531 922251138 /nfs/dbraw/zinc/25/11/38/922251138.db2.gz IPDVIMOKRBQYKH-OXJNMPFZSA-N 0 3 407.518 4.067 20 0 HIADHN CSc1cc2c(cc1NC(=O)N[C@H]1CCN([C@H](C)c3ccccc3)C1)OCCO2 ZINC000513972397 922292015 /nfs/dbraw/zinc/29/20/15/922292015.db2.gz BPEZZEXYKGSBQN-WBVHZDCISA-N 0 3 413.543 4.137 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1cc2c(cc1SC)OCCO2)c1ccsc1 ZINC000513976195 922297336 /nfs/dbraw/zinc/29/73/36/922297336.db2.gz SBUAOPQXGIVZJB-MRXNPFEDSA-N 0 3 421.588 4.446 20 0 HIADHN CC(C)(C)O[C@H](C(=O)Nc1cccc(CN2CCC(CO)CC2)c1)c1ccccc1 ZINC000514009437 922333792 /nfs/dbraw/zinc/33/37/92/922333792.db2.gz FTOBSLAEVXOAKX-QHCPKHFHSA-N 0 3 410.558 4.386 20 0 HIADHN COc1ccc2cccc(CC(=O)N3CCC(CCN4C[C@H](C)O[C@@H](C)C4)CC3)c2c1 ZINC000514011275 922335573 /nfs/dbraw/zinc/33/55/73/922335573.db2.gz MIXDSKDUBIESCP-PMACEKPBSA-N 0 3 424.585 4.129 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)NCc2cc(Br)ccc2F)C1 ZINC000514044756 922365384 /nfs/dbraw/zinc/36/53/84/922365384.db2.gz PJPFZZXSVPPHRZ-KBXCAEBGSA-N 0 3 420.326 4.223 20 0 HIADHN CN1CCC(Oc2ccc(NCc3ccccc3OCc3ccncc3)cn2)CC1 ZINC000514065766 922390021 /nfs/dbraw/zinc/39/00/21/922390021.db2.gz CVUYKAMBFVDZFL-UHFFFAOYSA-N 0 3 404.514 4.141 20 0 HIADHN CC(C)[C@H](NC(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1)c1nc2ccccc2[nH]1 ZINC000514068683 922391570 /nfs/dbraw/zinc/39/15/70/922391570.db2.gz NWOQYQGQSYTPKH-JLMWRMLUSA-N 0 3 405.546 4.395 20 0 HIADHN C[C@H]1CN(c2ccc(CN[C@H](c3cccc(OC(F)(F)F)c3)C3CC3)cn2)CCO1 ZINC000514096417 922421302 /nfs/dbraw/zinc/42/13/02/922421302.db2.gz VVARJOBIBRLPTR-BTYIYWSLSA-N 0 3 421.463 4.446 20 0 HIADHN Cc1ccc(NC(=O)NC[C@@H]2CCCN(Cc3nc4ccccc4nc3C)C2)cc1 ZINC000514106419 922435088 /nfs/dbraw/zinc/43/50/88/922435088.db2.gz XYPGNLYEFDRLDU-IBGZPJMESA-N 0 3 403.530 4.280 20 0 HIADHN COc1ccccc1CN(CCC(=O)Nc1ccccc1SC)C[C@H]1CCCO1 ZINC000514113025 922445011 /nfs/dbraw/zinc/44/50/11/922445011.db2.gz MXIHVFRNXUHEHZ-LJQANCHMSA-N 0 3 414.571 4.427 20 0 HIADHN CCn1c2ccccc2nc1[C@H]1CCCN1C(=O)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000514150014 922486438 /nfs/dbraw/zinc/48/64/38/922486438.db2.gz VVIPBNFXOHITQL-NZQKXSOJSA-N 0 3 417.557 4.177 20 0 HIADHN O=C(N[C@H]1CCN(Cc2ccccc2)C1)N[C@@H]1CCCc2cc(OC(F)F)ccc21 ZINC000514159033 922496979 /nfs/dbraw/zinc/49/69/79/922496979.db2.gz ZAPUIERKEDLAIL-GHTZIAJQSA-N 0 3 415.484 4.239 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)N[C@H](C)c2cccc(N3CCCC3=O)c2)N(C)C)cc1 ZINC000514161840 922500243 /nfs/dbraw/zinc/50/02/43/922500243.db2.gz FYRAWKBBZMTVAV-WZONZLPQSA-N 0 3 422.573 4.039 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N[C@@H](c2ccccc2)c2ccccn2)C1 ZINC000514168383 922505697 /nfs/dbraw/zinc/50/56/97/922505697.db2.gz XOGFMKCSUVXSBB-CKUXNOBLSA-N 0 3 400.526 4.306 20 0 HIADHN COc1c(C)cc(CN(C)C(=O)NC[C@@H](c2cccs2)N2CCCC2)cc1C ZINC000514178857 922516325 /nfs/dbraw/zinc/51/63/25/922516325.db2.gz CEGPHXCLOQSNPF-IBGZPJMESA-N 0 3 401.576 4.352 20 0 HIADHN COc1cc(CNC(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)ccc1C ZINC000514179113 922516911 /nfs/dbraw/zinc/51/69/11/922516911.db2.gz FLZDDRQSQFJEBD-LJQANCHMSA-N 0 3 401.576 4.338 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N[C@@H](C)c2ccc(Br)cc2)N(C)C)cc1 ZINC000514181131 922520420 /nfs/dbraw/zinc/52/04/20/922520420.db2.gz ZUUAZXZYSHANMD-KXBFYZLASA-N 0 3 404.352 4.421 20 0 HIADHN COC1CCN(C2(CNC(=O)c3ccc(-c4ccc(C)o4)s3)CCCC2)CC1 ZINC000514213628 922549051 /nfs/dbraw/zinc/54/90/51/922549051.db2.gz JRQQEHYEULZGPJ-UHFFFAOYSA-N 0 3 402.560 4.470 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N[C@@H](C)c2ccc(OC(F)F)cc2)C1 ZINC000514214206 922549154 /nfs/dbraw/zinc/54/91/54/922549154.db2.gz LRFHIZNYHUFSKR-FRQCXROJSA-N 0 3 403.473 4.484 20 0 HIADHN O=C(Cc1coc2ccc3ccccc3c12)Nc1cccc(CN2CC[C@H](O)C2)c1 ZINC000562377865 945067387 /nfs/dbraw/zinc/06/73/87/945067387.db2.gz BBPGTFRIJKTHNT-NRFANRHFSA-N 0 3 400.478 4.334 20 0 HIADHN CN(C)[C@H](CNC(=O)NC[C@@H](c1ccccc1Cl)N1CCCC1)c1ccsc1 ZINC000514458362 922635837 /nfs/dbraw/zinc/63/58/37/922635837.db2.gz NQUNHZPMYNVVAS-UXHICEINSA-N 0 3 421.010 4.141 20 0 HIADHN CCc1ccc([C@H](CNC(=O)Nc2ccc(CC(=O)N(CC)CC)cc2)N(C)C)cc1 ZINC000514513284 922664403 /nfs/dbraw/zinc/66/44/03/922664403.db2.gz NQFRDBJOICPOPE-QHCPKHFHSA-N 0 3 424.589 4.084 20 0 HIADHN CN(C)C[C@H](NC(=O)c1ccc(-c2nc(C3CC3)no2)cc1)c1ccc(Cl)cc1 ZINC000514616321 922723056 /nfs/dbraw/zinc/72/30/56/922723056.db2.gz BBUTVSPGRWMGKS-IBGZPJMESA-N 0 3 410.905 4.300 20 0 HIADHN COc1cccc2c1CCC[C@H]2N[C@@H]1CCCN(Cc2ccc(F)cc2F)C1=O ZINC000514650630 922745461 /nfs/dbraw/zinc/74/54/61/922745461.db2.gz KPDMHBOOXHAEDV-NHCUHLMSSA-N 0 3 400.469 4.132 20 0 HIADHN CO[C@@H](C)c1nc(C)c(C(=O)NC[C@@H](c2ccc(CC(C)C)cc2)N(C)C)s1 ZINC000514749793 922781994 /nfs/dbraw/zinc/78/19/94/922781994.db2.gz CRVODDLNIQMCRE-LPHOPBHVSA-N 0 3 403.592 4.390 20 0 HIADHN COc1ccc([C@@H](Cc2ccccc2)NCc2ccc3c(c2)CCS3(=O)=O)cc1 ZINC000514761198 922791377 /nfs/dbraw/zinc/79/13/77/922791377.db2.gz IFLPBJNMTUKAAY-HSZRJFAPSA-N 0 3 407.535 4.099 20 0 HIADHN COc1cccc(-c2nn(C(C)(C)C)cc2CNCc2ccc3cnn(C)c3c2)c1 ZINC000514765719 922794105 /nfs/dbraw/zinc/79/41/05/922794105.db2.gz IAZQDASMIHPTSX-UHFFFAOYSA-N 0 3 403.530 4.490 20 0 HIADHN CSc1ccc([C@H](CNC(=O)[C@H]2C[C@@H]2c2cc(F)c(F)c(F)c2)N(C)C)cc1 ZINC000514786127 922802237 /nfs/dbraw/zinc/80/22/37/922802237.db2.gz WTMRELFRUOJIOB-GJYPPUQNSA-N 0 3 408.489 4.348 20 0 HIADHN C[C@H](Cn1cc(Br)cn1)N[C@@H](C)c1ccc(Br)cc1F ZINC000514821289 922814904 /nfs/dbraw/zinc/81/49/04/922814904.db2.gz XJMKHWNIGYROCI-ZJUUUORDSA-N 0 3 405.109 4.287 20 0 HIADHN Fc1cccc(C2(NCc3ccc(I)cc3)CCOCC2)c1 ZINC000514852044 922824355 /nfs/dbraw/zinc/82/43/55/922824355.db2.gz WGFSYMHVUSFHRZ-UHFFFAOYSA-N 0 3 411.258 4.226 20 0 HIADHN CCOCCC1(CNCc2cn(-c3ccccc3Br)nn2)CCCC1 ZINC000515096115 922907322 /nfs/dbraw/zinc/90/73/22/922907322.db2.gz AHNUWZMIFHJZDC-UHFFFAOYSA-N 0 3 407.356 4.106 20 0 HIADHN CC1CCN([C@H](CNC(=O)Nc2ccc3c(c2)CCC(=O)N3)c2cccs2)CC1 ZINC000515122134 922936322 /nfs/dbraw/zinc/93/63/22/922936322.db2.gz YQUWATDEFHSCFL-LJQANCHMSA-N 0 3 412.559 4.228 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCCCO[C@H](C)c3ccccc3)c(C)c2)CC1 ZINC000515385495 923075253 /nfs/dbraw/zinc/07/52/53/923075253.db2.gz VIOCJOZVFQNEPU-OAQYLSRUSA-N 0 3 424.589 4.426 20 0 HIADHN CCOC(=O)C1CCC(N(CC)C(=O)NC[C@H](c2cccs2)N2CCCC2)CC1 ZINC000515489888 923131083 /nfs/dbraw/zinc/13/10/83/923131083.db2.gz IHQUXTUFSQOFTE-CTWPCTMYSA-N 0 3 421.607 4.038 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)CCc3ccc(Cl)s3)CC2)c1 ZINC000515503175 923139465 /nfs/dbraw/zinc/13/94/65/923139465.db2.gz BPOYBPQQCVGZLG-UHFFFAOYSA-N 0 3 420.022 4.361 20 0 HIADHN O=C(Cc1ccc(Cl)cc1Cl)NCCCCN1CCN(c2ccccc2)CC1 ZINC000515598044 923206906 /nfs/dbraw/zinc/20/69/06/923206906.db2.gz NCUSLLPJRCQGKN-UHFFFAOYSA-N 0 3 420.384 4.255 20 0 HIADHN Cc1nc(-c2cccc(NC(=O)NC[C@H](c3ccc(OC(C)C)cc3)N(C)C)c2)no1 ZINC000515688960 923271911 /nfs/dbraw/zinc/27/19/11/923271911.db2.gz RJAZMRUDNDZYBV-OAQYLSRUSA-N 0 3 423.517 4.257 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)c1cc(F)c(F)cc1Br)c1ccco1 ZINC000515696294 923279429 /nfs/dbraw/zinc/27/94/29/923279429.db2.gz IQFQLTQUYZLSTP-ZUZCIYMTSA-N 0 3 401.251 4.180 20 0 HIADHN COc1ccc2ccccc2c1CNC(=O)N(CCN(C)C)Cc1ccc(F)cc1 ZINC000515802476 923360650 /nfs/dbraw/zinc/36/06/50/923360650.db2.gz QOYFBOOOPVONBD-UHFFFAOYSA-N 0 3 409.505 4.261 20 0 HIADHN COc1ccc([C@@H](CNC(=O)N[C@H](C)c2c(F)cccc2F)N2CCCC2)cc1 ZINC000515825736 923376729 /nfs/dbraw/zinc/37/67/29/923376729.db2.gz YCBVHYQMVVCQHZ-FOIQADDNSA-N 0 3 403.473 4.171 20 0 HIADHN O=C(CCc1cc2ccccc2o1)NCCCCN1CCN(Cc2ccccc2)CC1 ZINC000515833301 923381486 /nfs/dbraw/zinc/38/14/86/923381486.db2.gz WCDKETMXKYGTKK-UHFFFAOYSA-N 0 3 419.569 4.080 20 0 HIADHN O=C(NCCCCN1CCN(Cc2ccccc2)CC1)c1cc2ccccc2s1 ZINC000515833339 923381578 /nfs/dbraw/zinc/38/15/78/923381578.db2.gz YEWGZMGEIKCKDH-UHFFFAOYSA-N 0 3 407.583 4.229 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)N(Cc1cccc(F)c1)C1CC1 ZINC000515900976 923421720 /nfs/dbraw/zinc/42/17/20/923421720.db2.gz JOCKGLSLDQOUGE-UHFFFAOYSA-N 0 3 424.564 4.102 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)C(=O)Nc1ccc2oc3ccccc3c2c1 ZINC000515962854 923462859 /nfs/dbraw/zinc/46/28/59/923462859.db2.gz MCUJODDCQYTGSH-UHFFFAOYSA-N 0 3 415.493 4.115 20 0 HIADHN CC1CCN([C@@H](CNC(=O)Nc2nnc(-c3ccco3)s2)c2ccccc2)CC1 ZINC000516078319 923531682 /nfs/dbraw/zinc/53/16/82/923531682.db2.gz LMGKSKOELLKFCG-KRWDZBQOSA-N 0 3 411.531 4.393 20 0 HIADHN COc1ccc(OC)c([C@@H]2CCCN2C(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)c1 ZINC000516163567 923582089 /nfs/dbraw/zinc/58/20/89/923582089.db2.gz HYCYWMDKVUEKJZ-XQFWAAQXSA-N 0 3 423.557 4.386 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N2CC=C(c3c[nH]c4ncccc34)CC2)C1 ZINC000516165266 923583698 /nfs/dbraw/zinc/58/36/98/923583698.db2.gz VNCKFVSDTMEWDP-WIYYLYMNSA-N 0 3 415.541 4.197 20 0 HIADHN CCc1ccccc1NC(=O)CNC(=O)CN(Cc1ccccc1)C1CCCCC1 ZINC000516196347 923593223 /nfs/dbraw/zinc/59/32/23/923593223.db2.gz BOECJDKHWKYCCY-UHFFFAOYSA-N 0 3 407.558 4.139 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)c2cc(Cl)c3c(c2)OCCCO3)C1 ZINC000516204883 923597576 /nfs/dbraw/zinc/59/75/76/923597576.db2.gz JYQRCZKYDQLDSH-YJBOKZPZSA-N 0 3 400.906 4.067 20 0 HIADHN COc1ccc(C(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)cc1Br ZINC000516204845 923597766 /nfs/dbraw/zinc/59/77/66/923597766.db2.gz WJYKMZDBKSHKTR-WMLDXEAASA-N 0 3 403.320 4.023 20 0 HIADHN Cc1ccc(C(=O)C2CCN(C(=O)N[C@H](C)CN3C[C@H](C)C[C@H](C)C3)CC2)c(C)c1 ZINC000516242342 923623495 /nfs/dbraw/zinc/62/34/95/923623495.db2.gz FDMNNWHYXHEUJO-SVFBPWRDSA-N 0 3 413.606 4.274 20 0 HIADHN CCO[C@@H]1C[C@H](N[C@H](C)c2cc3cc(Br)ccc3o2)[C@@H]1n1cccn1 ZINC000516496791 923760692 /nfs/dbraw/zinc/76/06/92/923760692.db2.gz AJHSMTFAFNSGLE-VBRXXALCSA-N 0 3 404.308 4.461 20 0 HIADHN O=C(NCc1cc(F)cc(Br)c1)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000516556400 923794223 /nfs/dbraw/zinc/79/42/23/923794223.db2.gz CXKAZWGNEXVUIZ-IBGZPJMESA-N 0 3 420.326 4.052 20 0 HIADHN CC(C)[C@H](NC(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1)c1ccc2c(c1)OCCO2 ZINC000516578720 923799986 /nfs/dbraw/zinc/79/99/86/923799986.db2.gz LFOIOFTUUAGXKD-VNZMSGEBSA-N 0 3 423.557 4.290 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CNC(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000516578700 923800728 /nfs/dbraw/zinc/80/07/28/923800728.db2.gz JVZYGRBYUCXBBZ-SIKLNZKXSA-N 0 3 417.557 4.124 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1)c1cccc(OC(F)F)c1 ZINC000516578220 923800828 /nfs/dbraw/zinc/80/08/28/923800828.db2.gz WTFCDPYHFWRUOD-TXPKVOOTSA-N 0 3 403.473 4.484 20 0 HIADHN COCCCCN(Cc1ccccc1)C(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000516707834 923855719 /nfs/dbraw/zinc/85/57/19/923855719.db2.gz ALOFRYISLSNQFB-ZJSXRUAMSA-N 0 3 409.574 4.460 20 0 HIADHN COCCCCN(Cc1ccccc1)C(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000516707832 923855981 /nfs/dbraw/zinc/85/59/81/923855981.db2.gz ALOFRYISLSNQFB-URXFXBBRSA-N 0 3 409.574 4.460 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@@H](Nc2ccc(CN3CCN(CC)CC3)cc2)c2ccccc21 ZINC000516789232 923887489 /nfs/dbraw/zinc/88/74/89/923887489.db2.gz UJSKXOJFXFQVNV-JWQCQUIFSA-N 0 3 421.585 4.418 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1snnc1C1CC1)c1ccc(C(F)(F)F)cc1 ZINC000516919243 923939727 /nfs/dbraw/zinc/93/97/27/923939727.db2.gz FEYOGRRHLQWQRQ-HNNXBMFYSA-N 0 3 412.481 4.247 20 0 HIADHN CC(=O)c1ccc(NC(=O)CCN2CCC(c3noc4cc(F)ccc43)CC2)cc1 ZINC000517059087 923980685 /nfs/dbraw/zinc/98/06/85/923980685.db2.gz NSFYNEVJBXRAEG-UHFFFAOYSA-N 0 3 409.461 4.378 20 0 HIADHN COc1cccc(OC)c1OCCCCN1CCN([C@H](C)c2ccsc2)CC1 ZINC000517257680 924063616 /nfs/dbraw/zinc/06/36/16/924063616.db2.gz AISZPTSIMQDPED-GOSISDBHSA-N 0 3 404.576 4.303 20 0 HIADHN O=C(CN1CCC[C@H](Cc2ccccc2)C1)N1CCC[C@H]1c1ccc2c(c1)OCCO2 ZINC000517324700 924103823 /nfs/dbraw/zinc/10/38/23/924103823.db2.gz ZGCLHUNDAORIMH-GGAORHGYSA-N 0 3 420.553 4.076 20 0 HIADHN COc1cccc([C@H]2C[C@H]2C(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)c1 ZINC000517335815 924109705 /nfs/dbraw/zinc/10/97/05/924109705.db2.gz SCXYOERJIRLFFX-NHCUHLMSSA-N 0 3 420.475 4.408 20 0 HIADHN COC1CCN(C(C)(C)CNC(=O)CSCc2ccc(Cl)cc2Cl)CC1 ZINC000517409326 924162649 /nfs/dbraw/zinc/16/26/49/924162649.db2.gz UMVYZZDVBKPVMJ-UHFFFAOYSA-N 0 3 419.418 4.232 20 0 HIADHN COc1ccc(-c2ocnc2C(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)cc1 ZINC000517431384 924180356 /nfs/dbraw/zinc/18/03/56/924180356.db2.gz IQCODPFSQLWNGG-NRFANRHFSA-N 0 3 405.498 4.226 20 0 HIADHN Cc1cc(Br)cn2c(CN[C@H](C)c3ccc4c(c3)CCC(=O)N4)cnc12 ZINC000517439044 924188278 /nfs/dbraw/zinc/18/82/78/924188278.db2.gz QNBXNCFZVKMXQL-CYBMUJFWSA-N 0 3 413.319 4.141 20 0 HIADHN Cc1cc(Br)cn2c(CN[C@@H](C)c3ccc4c(c3)CCC(=O)N4)cnc12 ZINC000517439045 924188744 /nfs/dbraw/zinc/18/87/44/924188744.db2.gz QNBXNCFZVKMXQL-ZDUSSCGKSA-N 0 3 413.319 4.141 20 0 HIADHN COc1ccc([C@H](Cc2ccccc2)NCC(=O)Nc2cc(C(C)(C)C)nn2C)cc1 ZINC000517441963 924190102 /nfs/dbraw/zinc/19/01/02/924190102.db2.gz LESDSYDVIKUMJY-NRFANRHFSA-N 0 3 420.557 4.238 20 0 HIADHN COc1ccccc1[C@@H](NC(=O)NC[C@H](c1ccccc1)N(C)C)c1ccccc1 ZINC000517474746 924216340 /nfs/dbraw/zinc/21/63/40/924216340.db2.gz UWULWDDEORIBSB-VWNXMTODSA-N 0 3 403.526 4.387 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)NCc2ccccc2OCC(F)(F)F)C1 ZINC000517542948 924256020 /nfs/dbraw/zinc/25/60/20/924256020.db2.gz GWEQULQUIOODDO-QFBILLFUSA-N 0 3 421.463 4.262 20 0 HIADHN COc1ccc(Cl)cc1CN(C)C(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000517544479 924257304 /nfs/dbraw/zinc/25/73/04/924257304.db2.gz CTJLPUOGKWQTLS-JXFKEZNVSA-N 0 3 401.938 4.326 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@@H](C)NCc2cnc(-c3ccccc3)nc2)CC1 ZINC000517547123 924258062 /nfs/dbraw/zinc/25/80/62/924258062.db2.gz HJLJKCAUGDNHMV-LJQANCHMSA-N 0 3 419.548 4.275 20 0 HIADHN O=C(NCCc1ccccc1C(F)(F)F)N1CCCN(Cc2ccccc2)CC1 ZINC000517550182 924260171 /nfs/dbraw/zinc/26/01/71/924260171.db2.gz LGVLWIPCQYOQMD-UHFFFAOYSA-N 0 3 405.464 4.165 20 0 HIADHN Cc1cc(N2CCCC2)ccc1NC(=O)CN[C@@H](C)c1cccc(N2CCCC2)c1 ZINC000517602060 926711641 /nfs/dbraw/zinc/71/16/41/926711641.db2.gz DXSHTXDJLFEERT-FQEVSTJZSA-N 0 3 406.574 4.485 20 0 HIADHN Cc1c(C(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)cnn1-c1ccc(F)cc1F ZINC000517649588 926757647 /nfs/dbraw/zinc/75/76/47/926757647.db2.gz IYIQRIGQEAJYGW-DNVCBOLYSA-N 0 3 410.468 4.024 20 0 HIADHN CN1CCN(c2ccncc2NC(=O)c2ccc(SCc3ccccc3)cc2)CC1 ZINC000517650800 926759080 /nfs/dbraw/zinc/75/90/80/926759080.db2.gz FAPXAZORWPNOOB-UHFFFAOYSA-N 0 3 418.566 4.378 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)N[C@H](CC(F)(F)F)c1ccccc1 ZINC000517654792 926762117 /nfs/dbraw/zinc/76/21/17/926762117.db2.gz DUNXSYDHCMIGAS-OAQYLSRUSA-N 0 3 419.491 4.399 20 0 HIADHN CCOc1cc2c(cc1[C@@H]1C[C@@H]1C(=O)NC[C@H](C)N(C)Cc1ccccc1)O[C@H](C)C2 ZINC000517657610 926765311 /nfs/dbraw/zinc/76/53/11/926765311.db2.gz FOZABIIKOOUAJG-OXHIVJRSSA-N 0 3 422.569 4.149 20 0 HIADHN CN(C)CCN(C[C@H]1CCCO1)C(=O)c1cc2ccccc2n1Cc1ccccc1F ZINC000517868390 926869592 /nfs/dbraw/zinc/86/95/92/926869592.db2.gz NNSTXFQXPMTJMM-OAQYLSRUSA-N 0 3 423.532 4.012 20 0 HIADHN NC(=O)[C@@H](NCC(c1ccccc1)c1ccccc1)c1ccc(Br)cc1 ZINC000517934524 926895123 /nfs/dbraw/zinc/89/51/23/926895123.db2.gz XCNRNDBXSDGABQ-NRFANRHFSA-N 0 3 409.327 4.397 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)NC[C@@H]1CCCO[C@@H]1C(C)(C)C ZINC000518002922 926942936 /nfs/dbraw/zinc/94/29/36/926942936.db2.gz QFOFXKFSUDAMRQ-VXKWHMMOSA-N 0 3 403.611 4.034 20 0 HIADHN CC1CCN([C@@H](CNC(=O)NC[C@H]2CCOc3ccccc32)c2cccs2)CC1 ZINC000518211848 927082424 /nfs/dbraw/zinc/08/24/24/927082424.db2.gz GHRQBSHTPNMUOF-QUCCMNQESA-N 0 3 413.587 4.387 20 0 HIADHN Clc1ccccc1[C@H](CNCc1ccccc1Br)N1CCOCC1 ZINC000518267951 927126154 /nfs/dbraw/zinc/12/61/54/927126154.db2.gz AXMVWZPJFNRXBX-IBGZPJMESA-N 0 3 409.755 4.266 20 0 HIADHN Cc1ccc([C@H](CNC(=O)C2(c3ccc(C)cc3)CCOCC2)N2CCCC2)cc1 ZINC000518399064 927240935 /nfs/dbraw/zinc/24/09/35/927240935.db2.gz PQICQEWOCISCFZ-DEOSSOPVSA-N 0 3 406.570 4.305 20 0 HIADHN COc1cccc(C[C@@H]2CCCN2C(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)c1 ZINC000518403126 927244116 /nfs/dbraw/zinc/24/41/16/927244116.db2.gz HYYJJFLFGFEUHD-PMOQBDJRSA-N 0 3 407.558 4.247 20 0 HIADHN Cc1ccc(-n2nc(C(=O)NC[C@@H](c3ccccc3)N(C)C)c3c2CCCC3)cc1 ZINC000518644778 927400772 /nfs/dbraw/zinc/40/07/72/927400772.db2.gz MANYQOMTAYRMBS-QHCPKHFHSA-N 0 3 402.542 4.092 20 0 HIADHN CC(C)(C)c1csc(CNC(=O)NCC2(N3CCOC(C)(C)C3)CCCCC2)n1 ZINC000518717813 927452556 /nfs/dbraw/zinc/45/25/56/927452556.db2.gz LCBVDOTUMTYBCI-UHFFFAOYSA-N 0 3 422.639 4.054 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1ccc(C)c(C(=O)NC(C)C)c1)c1ccsc1 ZINC000518720198 927453762 /nfs/dbraw/zinc/45/37/62/927453762.db2.gz UOPQXBLEANQDMY-FQEVSTJZSA-N 0 3 416.591 4.399 20 0 HIADHN CCOc1ccc(Oc2ccccc2NC(=O)NC2CCN(CCOC)CC2)cc1 ZINC000518831615 927526776 /nfs/dbraw/zinc/52/67/76/927526776.db2.gz NHXHFIKDGDGDSP-UHFFFAOYSA-N 0 3 413.518 4.110 20 0 HIADHN COc1cc(CN(C)C(=O)NC[C@H](C)N(C)Cc2ccccc2)ccc1SC ZINC000518966308 927663092 /nfs/dbraw/zinc/66/30/92/927663092.db2.gz FYDTXJIETKKJAA-KRWDZBQOSA-N 0 3 401.576 4.079 20 0 HIADHN COc1ccc(CCNCc2nc(-c3cccc(Br)c3)c[nH]2)c(OC)c1 ZINC000518982626 927673981 /nfs/dbraw/zinc/67/39/81/927673981.db2.gz KYHYXPGOPWXZMM-UHFFFAOYSA-N 0 3 416.319 4.189 20 0 HIADHN COCCOc1ccc(C(F)(F)F)cc1NC(=O)CN(C)[C@H]1CCC[C@H](C)C1 ZINC000519001694 927682724 /nfs/dbraw/zinc/68/27/24/927682724.db2.gz NTGYLJMAMVACPN-HOCLYGCPSA-N 0 3 402.457 4.180 20 0 HIADHN CCN(CC)C(=O)c1ccc(C(=O)NC[C@H](c2ccccc2)N2CCC(C)CC2)cc1 ZINC000519107702 927777159 /nfs/dbraw/zinc/77/71/59/927777159.db2.gz DURHTTSUJZPKPP-XMMPIXPASA-N 0 3 421.585 4.372 20 0 HIADHN Cc1nn(-c2ccc(C)c(Cl)c2)c(C)c1CC(=O)N(CCN(C)C)CC(C)C ZINC000519148234 927805342 /nfs/dbraw/zinc/80/53/42/927805342.db2.gz DHZRYMYBLCJXSS-UHFFFAOYSA-N 0 3 404.986 4.040 20 0 HIADHN CC(C)n1ncc2cc(NC(=O)N(CCCc3ccccc3)CCN(C)C)cnc21 ZINC000519230714 927837705 /nfs/dbraw/zinc/83/77/05/927837705.db2.gz GDTDCXVVBHETLL-UHFFFAOYSA-N 0 3 408.550 4.041 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N1CCC[C@H]1Cc1cccc(F)c1 ZINC000519250841 927846859 /nfs/dbraw/zinc/84/68/59/927846859.db2.gz LZZGBJCCYVHDIY-VQTJNVASSA-N 0 3 401.551 4.441 20 0 HIADHN COc1ccc2oc([C@H](C)NC(=O)N[C@H]3CCN(Cc4ccccc4)C3)c(C)c2c1 ZINC000519294728 927867338 /nfs/dbraw/zinc/86/73/38/927867338.db2.gz JVBOFMIZGSBWCC-HKUYNNGSSA-N 0 3 407.514 4.385 20 0 HIADHN Cc1cccc(Oc2ccccc2CNC(=O)C(=O)Nc2cccc(CN(C)C)c2)c1 ZINC000519345844 927891735 /nfs/dbraw/zinc/89/17/35/927891735.db2.gz YLIOKOZFRCXOIC-UHFFFAOYSA-N 0 3 417.509 4.104 20 0 HIADHN CCOc1cc2c(cc1[C@@H]1C[C@@H]1NC(=O)c1cccc(CN3CCCC3)c1)O[C@H](C)C2 ZINC000519365315 927897671 /nfs/dbraw/zinc/89/76/71/927897671.db2.gz WOOIHFVVICEOKG-FHZYATBESA-N 0 3 420.553 4.290 20 0 HIADHN C[C@H](N[C@H]1CCN(C)[C@H]1c1ccc(Cl)cc1)C(=O)Nc1ccc(OC(F)F)cc1 ZINC000519725820 928057907 /nfs/dbraw/zinc/05/79/07/928057907.db2.gz QGZVQLJDDIKWMR-AGRHKRQWSA-N 0 3 423.891 4.303 20 0 HIADHN Cc1noc(C)c1COc1ccccc1C(=O)N[C@@H]1CCN(Cc2ccccc2)[C@H]1C ZINC000519787381 928074917 /nfs/dbraw/zinc/07/49/17/928074917.db2.gz FHRNSUHSQFMAJQ-FDDCHVKYSA-N 0 3 419.525 4.263 20 0 HIADHN CCn1ncc2c1nc(-c1ccccc1)cc2C(=O)N(CCN(C)C)c1ccccc1 ZINC000519898897 928134641 /nfs/dbraw/zinc/13/46/41/928134641.db2.gz FIQQEZLUSYVVSW-UHFFFAOYSA-N 0 3 413.525 4.327 20 0 HIADHN C[C@H](c1cccs1)N(CCOc1ccc(S(N)(=O)=O)cc1)Cc1ccccc1 ZINC000519904383 928140048 /nfs/dbraw/zinc/14/00/48/928140048.db2.gz ICJVRRIJAOXIHR-QGZVFWFLSA-N 0 3 416.568 4.038 20 0 HIADHN Cc1nccc(-c2cccc(NC(=O)c3ccc(N4CCN(C(C)C)CC4)cc3)c2)n1 ZINC000519944823 928178433 /nfs/dbraw/zinc/17/84/33/928178433.db2.gz OVYAHILPHIKNDE-UHFFFAOYSA-N 0 3 415.541 4.235 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)Cc2csc(Cc3ccc(F)cc3)n2)C1 ZINC000519945059 928178890 /nfs/dbraw/zinc/17/88/90/928178890.db2.gz UGLSEEJKWJZCFC-LAUBAEHRSA-N 0 3 423.557 4.367 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)Nc1cccc(OC[C@@H]2CCCO2)c1 ZINC000519971953 928198925 /nfs/dbraw/zinc/19/89/25/928198925.db2.gz ITLIJLFLDRPNIK-XZOQPEGZSA-N 0 3 409.530 4.203 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)c(C)c1 ZINC000519988326 928215777 /nfs/dbraw/zinc/21/57/77/928215777.db2.gz NJMPHHWUOJIJJR-SIKLNZKXSA-N 0 3 422.573 4.309 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)c(C)c1 ZINC000519989232 928215907 /nfs/dbraw/zinc/21/59/07/928215907.db2.gz JHDUUHIJKGCQDA-IPJJNNNSSA-N 0 3 422.573 4.480 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)N1CCC(Oc2ccc(C)c(C)c2)CC1 ZINC000520045417 928270474 /nfs/dbraw/zinc/27/04/74/928270474.db2.gz DKFNTSGRJUSEHR-UHFFFAOYSA-N 0 3 411.546 4.449 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1ccn(Cc2ccccc2)n1)c1cccc(OC)c1 ZINC000520050666 928276416 /nfs/dbraw/zinc/27/64/16/928276416.db2.gz VLHIRHAHPWJCJN-JOCHJYFZSA-N 0 3 421.545 4.145 20 0 HIADHN Cc1ccc(OCc2nc(CC(=O)NC[C@@H](c3ccc(C)cc3)N(C)C)cs2)cc1 ZINC000520065055 928289698 /nfs/dbraw/zinc/28/96/98/928289698.db2.gz YRGZYFBWBGWEPU-QFIPXVFZSA-N 0 3 423.582 4.301 20 0 HIADHN CCOc1cc(CNC(=O)NC[C@H](c2ccc(C)cc2)N(C)C)ccc1OC(F)F ZINC000520068024 928290915 /nfs/dbraw/zinc/29/09/15/928290915.db2.gz WJGJEPNPKGCRGL-GOSISDBHSA-N 0 3 421.488 4.097 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)Nc1ccn(Cc2ccccc2)n1 ZINC000520131466 928328818 /nfs/dbraw/zinc/32/88/18/928328818.db2.gz TXQHZLSSHWHFKC-UHFFFAOYSA-N 0 3 411.937 4.181 20 0 HIADHN C[C@H]1CN([C@H](CNCc2c[nH]nc2C(C)(C)C)c2c(F)cccc2Cl)CCO1 ZINC000520205348 928387546 /nfs/dbraw/zinc/38/75/46/928387546.db2.gz NRVJDIBAVSUJQZ-KBXCAEBGSA-N 0 3 408.949 4.051 20 0 HIADHN CN(C(=O)CCc1ncc(-c2ccc(Cl)cc2Cl)o1)[C@@H]1CN2CCC1CC2 ZINC000520371406 928526612 /nfs/dbraw/zinc/52/66/12/928526612.db2.gz SFHLLTSLTSFWBH-QGZVFWFLSA-N 0 3 408.329 4.134 20 0 HIADHN Cc1c([C@H](C)NC(=O)NC[C@@H](C)N(C)Cc2ccccc2)cnn1-c1ccc(F)cc1 ZINC000520377818 928531719 /nfs/dbraw/zinc/53/17/19/928531719.db2.gz QMTSVPKYSSFVHT-MSOLQXFVSA-N 0 3 423.536 4.201 20 0 HIADHN O=C(c1cccc(CN2CCC[C@@H](c3nnc4n3CCCCC4)C2)c1)N1CCCCC1 ZINC000520480028 928590325 /nfs/dbraw/zinc/59/03/25/928590325.db2.gz KDWWQNOMAVVWSC-JOCHJYFZSA-N 0 3 421.589 4.010 20 0 HIADHN O=C(Cc1coc(-c2ccc(Cl)cc2)n1)NC[C@H](c1ccccc1)N1CCCC1 ZINC000520494612 928598594 /nfs/dbraw/zinc/59/85/94/928598594.db2.gz YCUPMXNZSOILNP-OAQYLSRUSA-N 0 3 409.917 4.491 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)N[C@@H](CN2CCCC2)c2ccccc2)c(C)c1 ZINC000520600917 928665237 /nfs/dbraw/zinc/66/52/37/928665237.db2.gz UWBVTDWAPTXEMQ-CVDCTZTESA-N 0 3 422.573 4.482 20 0 HIADHN CCN(CC(=O)N1N=C(c2cccs2)C[C@@H]1c1ccco1)[C@@H]1CCOC(C)(C)C1 ZINC000520664804 928708871 /nfs/dbraw/zinc/70/88/71/928708871.db2.gz AFTZVASAOVWSEZ-SJLPKXTDSA-N 0 3 415.559 4.298 20 0 HIADHN CN(C(=O)Nc1ccccc1Br)C1CCN(CCc2ccccn2)CC1 ZINC000520670955 928715814 /nfs/dbraw/zinc/71/58/14/928715814.db2.gz UCKIRMQAGOTQIS-UHFFFAOYSA-N 0 3 417.351 4.015 20 0 HIADHN CC(C)C[C@H](CNc1nc2c(cnn2C(C)(C)C)c(=O)[nH]1)N[C@H](C)c1ccccc1 ZINC000520673779 928719958 /nfs/dbraw/zinc/71/99/58/928719958.db2.gz PBGMXBGRCCMYOR-SJLPKXTDSA-N 0 3 410.566 4.464 20 0 HIADHN O=C([C@H](Sc1ccc(F)cc1F)c1ccccc1)N1CC[C@H](N2CCCC2)C1 ZINC000520689100 928736825 /nfs/dbraw/zinc/73/68/25/928736825.db2.gz HMTISSMDEXWTMH-GHTZIAJQSA-N 0 3 402.510 4.495 20 0 HIADHN COc1cccc([C@@H]2C[C@H]2C(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)c1 ZINC000520705270 928752750 /nfs/dbraw/zinc/75/27/50/928752750.db2.gz QSAUKFJWUNLLDW-LEWJYISDSA-N 0 3 420.475 4.408 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N[C@@H](c2ccc(F)cc2)[C@H]2CCCO2)C1 ZINC000520756241 928803377 /nfs/dbraw/zinc/80/33/77/928803377.db2.gz MQAUGJCNQLMOCV-WIQPIVSASA-N 0 3 411.521 4.181 20 0 HIADHN Cc1sc2nc(C)nc(SCC(=O)NCCN3[C@H](C)CCC[C@@H]3C)c2c1C ZINC000520761910 928805355 /nfs/dbraw/zinc/80/53/55/928805355.db2.gz HMTKYXOFYWVKDL-BETUJISGSA-N 0 3 406.621 4.088 20 0 HIADHN Cn1c2ccccc2nc1[C@H]1CCCN1C(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000520813441 928830088 /nfs/dbraw/zinc/83/00/88/928830088.db2.gz GQRQQXNEXNYRCS-AUSIDOKSSA-N 0 3 420.532 4.288 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)NCc1cc(Br)cs1 ZINC000520820657 928832013 /nfs/dbraw/zinc/83/20/13/928832013.db2.gz QLVXJPKFBZVTJI-UHFFFAOYSA-N 0 3 424.408 4.217 20 0 HIADHN CCC(=O)Nc1ccc(Cl)c(NC(=O)N2CCN(CC3CCCCC3)CC2)c1 ZINC000520827888 928835240 /nfs/dbraw/zinc/83/52/40/928835240.db2.gz LPBQKEIWFHHEEN-UHFFFAOYSA-N 0 3 406.958 4.418 20 0 HIADHN CCOc1ccc([C@H](CNC(=O)CN(C)C(C)C)c2c[nH]c3ccccc32)cc1OC ZINC000520898686 928865328 /nfs/dbraw/zinc/86/53/28/928865328.db2.gz QASCLQNGBMSGGQ-FQEVSTJZSA-N 0 3 423.557 4.164 20 0 HIADHN Cc1cc(NC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)n(Cc2ccccc2)n1 ZINC000521008778 928923668 /nfs/dbraw/zinc/92/36/68/928923668.db2.gz DNKIXBADFLHWHZ-NRFANRHFSA-N 0 3 406.505 4.230 20 0 HIADHN CCN1CCN(c2ccc(NS(=O)(=O)c3ccc4ccccc4c3)c(C)c2)CC1 ZINC000521026589 928943546 /nfs/dbraw/zinc/94/35/46/928943546.db2.gz RUJTYYXIRPKHMX-UHFFFAOYSA-N 0 3 409.555 4.091 20 0 HIADHN CCCn1ccc2cc(NC(=O)N3CCC(CN4C[C@@H](C)O[C@@H](C)C4)CC3)ccc21 ZINC000521034037 928950081 /nfs/dbraw/zinc/95/00/81/928950081.db2.gz UOXBGLRMZYLVSD-KDURUIRLSA-N 0 3 412.578 4.404 20 0 HIADHN CCN1CCCC[C@@H]1CNC(=O)c1ccc(Cl)c(NC(=O)c2cccs2)c1 ZINC000521065594 928971197 /nfs/dbraw/zinc/97/11/97/928971197.db2.gz AJMXOZUWXOMUTC-OAHLLOKOSA-N 0 3 405.951 4.258 20 0 HIADHN CCOc1ncccc1-c1noc([C@@H]2CN(Cc3ccccc3)CCC2(F)F)n1 ZINC000521110934 929002636 /nfs/dbraw/zinc/00/26/36/929002636.db2.gz GLIJCKNVLMGGEX-KRWDZBQOSA-N 0 3 400.429 4.155 20 0 HIADHN COCCOc1cccc(C(=O)N(CCN2CCCC2)Cc2ccc(Cl)cc2)c1 ZINC000521138055 929018697 /nfs/dbraw/zinc/01/86/97/929018697.db2.gz CYOJHBXIPBXVNK-UHFFFAOYSA-N 0 3 416.949 4.103 20 0 HIADHN C[C@H](C(=O)N1CCC(c2ccc(O)cc2)CC1)N1CCC(Cc2ccccc2)CC1 ZINC000521164505 929038232 /nfs/dbraw/zinc/03/82/32/929038232.db2.gz VTVFOCFXCJRPMR-HXUWFJFHSA-N 0 3 406.570 4.441 20 0 HIADHN CC(C)Oc1ccccc1CNCCC(=O)N(C)Cc1ccccc1Br ZINC000521172919 929043468 /nfs/dbraw/zinc/04/34/68/929043468.db2.gz KQPXWKYFDQJWAZ-UHFFFAOYSA-N 0 3 419.363 4.375 20 0 HIADHN CC(C)n1ncc2c1nc(-c1ccco1)cc2C(=O)N(CCN(C)C)c1ccccc1 ZINC000521176221 929044118 /nfs/dbraw/zinc/04/41/18/929044118.db2.gz XNQULMBGOSHWOZ-UHFFFAOYSA-N 0 3 417.513 4.481 20 0 HIADHN CN(C)C[C@@H](NC(=O)N[C@@H](c1ccccc1)c1ccccn1)c1ccc(Cl)cc1 ZINC000521276169 929094993 /nfs/dbraw/zinc/09/49/93/929094993.db2.gz WPJZDNDBHHUBQG-YADHBBJMSA-N 0 3 408.933 4.427 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NC[C@H](C)COCc3ccccc3)c(C)c2)CC1 ZINC000521424080 929214875 /nfs/dbraw/zinc/21/48/75/929214875.db2.gz UPPWFZBKHVVJLS-FQEVSTJZSA-N 0 3 424.589 4.111 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3CCC(OCCC(C)C)CC3)c(C)c2)CC1 ZINC000521424643 929214960 /nfs/dbraw/zinc/21/49/60/929214960.db2.gz RDQDUJIMCLRJOZ-UHFFFAOYSA-N 0 3 416.610 4.196 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N(Cc2cccs2)C[C@H]2CCCO2)N(C)C)cc1 ZINC000521511025 929263890 /nfs/dbraw/zinc/26/38/90/929263890.db2.gz NKDMTRQMIZCRAC-TZIWHRDSSA-N 0 3 401.576 4.050 20 0 HIADHN CC(=O)c1ccc(-c2ccc(C(=O)N(CCN(C)C)Cc3ccccc3F)o2)cc1 ZINC000521587669 929312978 /nfs/dbraw/zinc/31/29/78/929312978.db2.gz GJCSKFVJSVJZAX-UHFFFAOYSA-N 0 3 408.473 4.492 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N(C)C[C@@H]1CCCOC1)c1ccc(C(F)(F)F)cc1 ZINC000521696084 929370669 /nfs/dbraw/zinc/37/06/69/929370669.db2.gz FCTKSXSHXXSTJR-LPHOPBHVSA-N 0 3 415.500 4.156 20 0 HIADHN CCCN(CC(=O)N(CC)Cc1ccc(OC)c(OC)c1)[C@H]1CCc2ccccc21 ZINC000521819908 929478244 /nfs/dbraw/zinc/47/82/44/929478244.db2.gz MMWPVRPBJNMKDL-QFIPXVFZSA-N 0 3 410.558 4.452 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)c1ccc(-c2ccco2)nc1C ZINC000521883364 929532608 /nfs/dbraw/zinc/53/26/08/929532608.db2.gz XLOFZYPZYUQQBK-FQEVSTJZSA-N 0 3 404.514 4.172 20 0 HIADHN C[C@@H](C(=O)N[C@@H]1CCCC[C@H]1C)N(C)CCCc1cc(-c2cccc(F)c2)n[nH]1 ZINC000521902746 929547825 /nfs/dbraw/zinc/54/78/25/929547825.db2.gz NBPQDJUOYBLGJR-LLGFUMIMSA-N 0 3 400.542 4.164 20 0 HIADHN CN(C(=O)Cc1csc(-c2ccc(Cl)cc2Cl)n1)[C@@H]1CCN(C2CC2)C1 ZINC000521932449 929573433 /nfs/dbraw/zinc/57/34/33/929573433.db2.gz QFVPHHNKPHYKRU-OAHLLOKOSA-N 0 3 410.370 4.355 20 0 HIADHN COCCN1CCC[C@@H]1CNC(=O)Nc1ccccc1Oc1ccccc1Cl ZINC000521953194 929587740 /nfs/dbraw/zinc/58/77/40/929587740.db2.gz UPYOJFCMMZJDGG-MRXNPFEDSA-N 0 3 403.910 4.365 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)N[C@@H](c1ccccc1)C(F)(F)F ZINC000521953868 929589653 /nfs/dbraw/zinc/58/96/53/929589653.db2.gz ZTMHWRSSZIYHDO-NRFANRHFSA-N 0 3 405.464 4.009 20 0 HIADHN CC(C)(C)C[C@@H]1CCCN1C(=O)NCCCCN1CCN(c2ccccc2)CC1 ZINC000521969713 929606349 /nfs/dbraw/zinc/60/63/49/929606349.db2.gz NHWGGDKOYSBXJQ-QFIPXVFZSA-N 0 3 400.611 4.199 20 0 HIADHN O=C(Nc1ccccc1-c1nc2ccccc2[nH]1)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000521979476 929609521 /nfs/dbraw/zinc/60/95/21/929609521.db2.gz XCGCTHVTPCWRMA-IBGZPJMESA-N 0 3 411.509 4.476 20 0 HIADHN CCN1CC[C@H](NCC(=O)Nc2c(C)cccc2C)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000522008810 929617143 /nfs/dbraw/zinc/61/71/43/929617143.db2.gz ZXRWWCJHRBWTMJ-AVRDEDQJSA-N 0 3 405.464 4.084 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)C[C@H]1OCCc2ccccc21 ZINC000524488385 929635253 /nfs/dbraw/zinc/63/52/53/929635253.db2.gz PZMFXGJPLNZKQH-OAQYLSRUSA-N 0 3 420.475 4.300 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)NCc2ccccc2OCC(F)(F)F)c1 ZINC000524516177 929661539 /nfs/dbraw/zinc/66/15/39/929661539.db2.gz UTNYWYMKJPJTCE-UHFFFAOYSA-N 0 3 423.479 4.210 20 0 HIADHN CCCCN(CCCC)S(=O)(=O)N(C)[C@@H]1CCN(Cc2ccccc2)[C@@H](C)C1 ZINC000524585839 929700241 /nfs/dbraw/zinc/70/02/41/929700241.db2.gz APTFGQCOCLRARO-RBBKRZOGSA-N 0 3 409.640 4.118 20 0 HIADHN CCCCN(CCCC)S(=O)(=O)N(C)[C@H]1CCN(Cc2ccccc2)[C@@H](C)C1 ZINC000524585840 929700408 /nfs/dbraw/zinc/70/04/08/929700408.db2.gz APTFGQCOCLRARO-UNMCSNQZSA-N 0 3 409.640 4.118 20 0 HIADHN CCc1ccccc1O[C@H](C(=O)NCC(C)(C)N1CCC(OC)CC1)c1ccccc1 ZINC000524611247 929720876 /nfs/dbraw/zinc/72/08/76/929720876.db2.gz HPIXUWUBADNJCH-DEOSSOPVSA-N 0 3 424.585 4.375 20 0 HIADHN COc1ccc2ccccc2c1CNC[C@@H](O)COc1ccc(C(F)(F)F)cc1 ZINC000524680700 929793238 /nfs/dbraw/zinc/79/32/38/929793238.db2.gz RDGDDQXDKFZIQS-QGZVFWFLSA-N 0 3 405.416 4.397 20 0 HIADHN Cc1noc(C)c1COc1ccc(CC(=O)NC[C@H](C)N(C)Cc2ccccc2)cc1 ZINC000524692193 929801390 /nfs/dbraw/zinc/80/13/90/929801390.db2.gz TURXWYOVMDZQAG-SFHVURJKSA-N 0 3 421.541 4.050 20 0 HIADHN CN(C(=O)[C@H](Oc1ccc(F)c(Cl)c1)c1ccccc1)[C@@H]1CCN(C2CC2)C1 ZINC000524694261 929801993 /nfs/dbraw/zinc/80/19/93/929801993.db2.gz FYAQTZRROCLTAR-DYESRHJHSA-N 0 3 402.897 4.294 20 0 HIADHN CC[C@H]1CCCCN1CCNC(=O)[C@@H](C)CC(=O)c1cccc(Br)c1 ZINC000524714020 929808304 /nfs/dbraw/zinc/80/83/04/929808304.db2.gz UGAOBRZEOLAHBQ-YJBOKZPZSA-N 0 3 409.368 4.039 20 0 HIADHN CC[C@H](Cc1ccccc1)N(C)CC(=O)N1CCC[C@H]1c1ccc(OC)cc1OC ZINC000524758180 929820956 /nfs/dbraw/zinc/82/09/56/929820956.db2.gz DZUJLGCBBBIVAM-OFNKIYASSA-N 0 3 410.558 4.320 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(F)cc2)CC1)c1ccc(C(F)(F)F)cc1 ZINC000524815581 929840625 /nfs/dbraw/zinc/84/06/25/929840625.db2.gz FUSFMQGSLJWIRP-UHFFFAOYSA-N 0 3 410.411 4.118 20 0 HIADHN C[C@H](SCc1ccccc1)C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000524818732 929842342 /nfs/dbraw/zinc/84/23/42/929842342.db2.gz FCTVEPHBWPXBPZ-SFHVURJKSA-N 0 3 416.562 4.107 20 0 HIADHN COc1ccc(C(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)cc1OC(F)F ZINC000524865703 929864470 /nfs/dbraw/zinc/86/44/70/929864470.db2.gz CHGZHSAQPZIDLZ-INIZCTEOSA-N 0 3 404.457 4.033 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)c1ccccc1OCc1ccncc1 ZINC000524865685 929864714 /nfs/dbraw/zinc/86/47/14/929864714.db2.gz BOAXGYZAQSOWAO-NRFANRHFSA-N 0 3 415.537 4.397 20 0 HIADHN CC(=O)c1cccc(OCCCC(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)c1 ZINC000524876812 929868203 /nfs/dbraw/zinc/86/82/03/929868203.db2.gz KVMMXALKTKSZAU-FQEVSTJZSA-N 0 3 408.542 4.171 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)[C@@H]1C[C@@H]1c1ccccc1OC(F)(F)F ZINC000524958094 929921062 /nfs/dbraw/zinc/92/10/62/929921062.db2.gz ACUGETGSNFTJLB-WOJBJXKFSA-N 0 3 418.459 4.253 20 0 HIADHN COc1ccc(C2(CNC(=O)c3cccc(CN(C)C)c3)CCCCC2)cc1OC ZINC000524979749 929944994 /nfs/dbraw/zinc/94/49/94/929944994.db2.gz XWCSQTHTYDMWLL-UHFFFAOYSA-N 0 3 410.558 4.397 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)C[C@H]2CCCc3ccccc32)cc1)[C@@H]1CCCN(C)C1 ZINC000525065777 930013602 /nfs/dbraw/zinc/01/36/02/930013602.db2.gz TUYUDZWJHDHPLZ-FYYLOGMGSA-N 0 3 419.569 4.302 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2[nH]c3ccccc3c2Cl)cc1)[C@H]1CCCN(C)C1 ZINC000525099236 930033762 /nfs/dbraw/zinc/03/37/62/930033762.db2.gz XFBHDBCCTUOHFI-KRWDZBQOSA-N 0 3 424.932 4.240 20 0 HIADHN CN(C(=O)c1cc(Br)ccc1OCc1ccccc1)[C@H]1CCCN(C)C1 ZINC000525101606 930035793 /nfs/dbraw/zinc/03/57/93/930035793.db2.gz AHZXZAAQZHNZIO-SFHVURJKSA-N 0 3 417.347 4.194 20 0 HIADHN Brc1ccc(C2(NCc3ccc4c(c3)OCCO4)CCOCC2)cc1 ZINC000525183476 930078908 /nfs/dbraw/zinc/07/89/08/930078908.db2.gz AMFIZNGLNURCPC-UHFFFAOYSA-N 0 3 404.304 4.016 20 0 HIADHN Cc1cccn2c(CNC3(c4ccc(Br)cc4)CCOCC3)cnc12 ZINC000525184093 930079752 /nfs/dbraw/zinc/07/97/52/930079752.db2.gz NRKZZGHGAKGILH-UHFFFAOYSA-N 0 3 400.320 4.201 20 0 HIADHN COc1cc(OC)c(OC)cc1CNC[C@@H](C)Oc1cccc(Br)c1 ZINC000525194824 930082771 /nfs/dbraw/zinc/08/27/71/930082771.db2.gz AOJCMMKGRGXXRG-CYBMUJFWSA-N 0 3 410.308 4.032 20 0 HIADHN C[C@H](CC(=O)c1cccc(Br)c1)C(=O)NCC(C)(C)N1CCC[C@H](C)C1 ZINC000525241152 930101670 /nfs/dbraw/zinc/10/16/70/930101670.db2.gz SJKFOMKIPVBOAC-JKSUJKDBSA-N 0 3 423.395 4.285 20 0 HIADHN CCN1CCCC[C@H]1C(=O)NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1 ZINC000525258310 930112972 /nfs/dbraw/zinc/11/29/72/930112972.db2.gz LMBOOTMLGZGRRO-QFIPXVFZSA-N 0 3 406.505 4.169 20 0 HIADHN CC[C@@H](C)[C@H]1CCCCN1CC(=O)N(C)CC(=O)Nc1ccccc1C(F)(F)F ZINC000525327765 930165209 /nfs/dbraw/zinc/16/52/09/930165209.db2.gz HIBKHFMTEOVZIQ-CRAIPNDOSA-N 0 3 413.484 4.003 20 0 HIADHN O=C(Cc1ccc(C(F)(F)F)cc1)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000525334403 930171183 /nfs/dbraw/zinc/17/11/83/930171183.db2.gz TYBKTCOBOHHMSF-UHFFFAOYSA-N 0 3 424.438 4.047 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2ccc(C)c(NC(=O)NC(C)(C)C)c2)N(C)C)cc1 ZINC000525371551 930202187 /nfs/dbraw/zinc/20/21/87/930202187.db2.gz YNYDNKHLWVYEKA-NRFANRHFSA-N 0 3 410.562 4.256 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2ccc(C)c(NC(=O)NC(C)(C)C)c2)N(C)C)cc1 ZINC000525371552 930202334 /nfs/dbraw/zinc/20/23/34/930202334.db2.gz YNYDNKHLWVYEKA-OAQYLSRUSA-N 0 3 410.562 4.256 20 0 HIADHN Cc1ccc(C(=O)NC[C@H](C)N(C)Cc2ccccc2)cc1NC(=O)NC(C)(C)C ZINC000525376299 930205987 /nfs/dbraw/zinc/20/59/87/930205987.db2.gz GDXXMSWUJWYSDH-SFHVURJKSA-N 0 3 410.562 4.165 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)c1cnn(-c2cccc(Cl)c2)c1 ZINC000525380630 930208338 /nfs/dbraw/zinc/20/83/38/930208338.db2.gz CJLAILBCAZSLGE-SFHVURJKSA-N 0 3 408.933 4.262 20 0 HIADHN CSc1ncc(C(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)n1-c1ccccc1 ZINC000525382403 930209225 /nfs/dbraw/zinc/20/92/25/930209225.db2.gz SUDUGRBVWVBPOO-LJQANCHMSA-N 0 3 420.582 4.331 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)NC[C@@H]1CCCO[C@@H]1C(C)(C)C ZINC000525394451 930215447 /nfs/dbraw/zinc/21/54/47/930215447.db2.gz QYPQOAATDXHJOB-HJNYFJLDSA-N 0 3 401.595 4.134 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)NCc1ccc(Br)s1 ZINC000525399412 930218428 /nfs/dbraw/zinc/21/84/28/930218428.db2.gz MRSQZHVXTGCUJU-HNNXBMFYSA-N 0 3 422.392 4.317 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1cccc(OC[C@@H]2CCCO2)c1 ZINC000525415277 930227896 /nfs/dbraw/zinc/22/78/96/930227896.db2.gz IYNKIJINALTCQQ-YKSBVNFPSA-N 0 3 423.557 4.373 20 0 HIADHN C[C@H](COc1ccc(F)cc1F)NC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C ZINC000525416266 930228858 /nfs/dbraw/zinc/22/88/58/930228858.db2.gz LMUORETUDYKCEF-QZTJIDSGSA-N 0 3 417.500 4.038 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)N[C@@H]1C[C@@H]1c1c(F)cccc1Cl ZINC000525445134 930243734 /nfs/dbraw/zinc/24/37/34/930243734.db2.gz APFWGONRIJCPQD-HNAYVOBHSA-N 0 3 407.892 4.248 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1ccc(NC(=O)C2CC2)cc1 ZINC000525448143 930246005 /nfs/dbraw/zinc/24/60/05/930246005.db2.gz PXKLLYBGLTVJSK-GOSISDBHSA-N 0 3 406.530 4.163 20 0 HIADHN CN(C)Cc1cccc(C(=O)NC2CCN(Cc3cccc(C(F)(F)F)c3)CC2)c1 ZINC000525490239 930277710 /nfs/dbraw/zinc/27/77/10/930277710.db2.gz LMSUGTATTBPZSL-UHFFFAOYSA-N 0 3 419.491 4.161 20 0 HIADHN CN(C)Cc1cccc(C(=O)Nc2ccc(F)c(NC(=O)Cc3ccccc3)c2)c1 ZINC000525490378 930277917 /nfs/dbraw/zinc/27/79/17/930277917.db2.gz SXNIBBZCGDMQGK-UHFFFAOYSA-N 0 3 405.473 4.321 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2cc(NC(=O)C(C)C)ccc2Cl)N(C)C)cc1 ZINC000525579870 930342438 /nfs/dbraw/zinc/34/24/38/930342438.db2.gz PWRXZUXJEFOQQO-FQEVSTJZSA-N 0 3 401.938 4.276 20 0 HIADHN Cc1ccc(CCCC(=O)Nc2ccc(C(=O)N(C)[C@H]3CCCN(C)C3)cc2)cc1 ZINC000525581162 930343554 /nfs/dbraw/zinc/34/35/54/930343554.db2.gz KRIGPBSSFIPGGS-QHCPKHFHSA-N 0 3 407.558 4.123 20 0 HIADHN CC1CCN([C@@H](CNC(=O)c2cc(N3CCCC3=O)ccc2F)c2ccccc2)CC1 ZINC000525582291 930344436 /nfs/dbraw/zinc/34/44/36/930344436.db2.gz ORRCFBOIRDOTDA-QHCPKHFHSA-N 0 3 423.532 4.156 20 0 HIADHN Cc1cccc([C@H]2CCCN2CC(=O)NCC2(c3ccccc3)CCOCC2)c1C ZINC000525639580 930378292 /nfs/dbraw/zinc/37/82/92/930378292.db2.gz PLUIQNDEVAUFTH-XMMPIXPASA-N 0 3 406.570 4.305 20 0 HIADHN Cn1nc(C(C)(C)C)cc1C(=O)N(CCN1CCCC1)Cc1ccc(Cl)cc1 ZINC000525649760 930382050 /nfs/dbraw/zinc/38/20/50/930382050.db2.gz UUERKFZXAYKFRZ-UHFFFAOYSA-N 0 3 402.970 4.109 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)N1CCSc2ccccc21)c1ccc(NC(=O)C2CC2)cc1 ZINC000525761769 930435035 /nfs/dbraw/zinc/43/50/35/930435035.db2.gz FCRCRRVTWIALAL-CVEARBPZSA-N 0 3 409.555 4.213 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N2CCO[C@H](c3ccccc3C)C2)N2CCCC2)cc1 ZINC000525809358 930451906 /nfs/dbraw/zinc/45/19/06/930451906.db2.gz HJBJGABPZIGGOO-RPWUZVMVSA-N 0 3 407.558 4.223 20 0 HIADHN C[C@@H](N[C@@H](CN1CCN(C)CC1)c1ccccc1)c1ccc(Br)cc1F ZINC000525857691 930469628 /nfs/dbraw/zinc/46/96/28/930469628.db2.gz SRMDYUCVMSRHHP-IERDGZPVSA-N 0 3 420.370 4.228 20 0 HIADHN C[C@@H](CN[C@H](C(N)=O)c1cccc(Br)c1)c1ccc(C(F)(F)F)cc1 ZINC000525952075 930492749 /nfs/dbraw/zinc/49/27/49/930492749.db2.gz HKEDTVIGDSDZTP-ZBEGNZNMSA-N 0 3 415.253 4.388 20 0 HIADHN C[C@H](NCc1ccc2c(c1)sc(=O)n2C)c1ccc(OCc2cccnc2)cc1 ZINC000525981968 930501380 /nfs/dbraw/zinc/50/13/80/930501380.db2.gz ZXGONZVWZARVKJ-INIZCTEOSA-N 0 3 405.523 4.425 20 0 HIADHN COc1ccc([C@H](C)N[C@@H]2CCCN(Cc3ccc(F)cc3F)C2=O)cc1Cl ZINC000526048018 930514871 /nfs/dbraw/zinc/51/48/71/930514871.db2.gz QGBIJBWKBHSMSA-ORAYPTAESA-N 0 3 408.876 4.469 20 0 HIADHN Cc1ccc([C@H](CCn2cncn2)NCc2ccc(N3CCCCCC3)nc2)cc1 ZINC000526107102 930536424 /nfs/dbraw/zinc/53/64/24/930536424.db2.gz VMKFZFDWXDJTAP-QHCPKHFHSA-N 0 3 404.562 4.283 20 0 HIADHN CCC(CC)[C@H](c1ccc(Cl)cc1)N(C)C(=O)NCCCCN1CCN(C)CC1 ZINC000526884967 930547866 /nfs/dbraw/zinc/54/78/66/930547866.db2.gz FSBMYAUTPNLZIE-JOCHJYFZSA-N 0 3 423.045 4.486 20 0 HIADHN O=C(Nc1cc(F)cc(NCC(F)(F)F)c1)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000526934758 930552010 /nfs/dbraw/zinc/55/20/10/930552010.db2.gz BQOUXANSMQSDEE-HNNXBMFYSA-N 0 3 410.415 4.046 20 0 HIADHN CC(C)c1nc2c([nH]1)C[C@H](C(=O)NC[C@@H](c1ccccc1Cl)N1CCCC1)CC2 ZINC000526967377 930559906 /nfs/dbraw/zinc/55/99/06/930559906.db2.gz GAMWCVKBLSPKBL-IERDGZPVSA-N 0 3 414.981 4.245 20 0 HIADHN CC(C)c1nc2c([nH]1)CC[C@@H](C(=O)NC[C@@H](c1ccccc1Cl)N1CCCC1)C2 ZINC000526967377 930559911 /nfs/dbraw/zinc/55/99/11/930559911.db2.gz GAMWCVKBLSPKBL-IERDGZPVSA-N 0 3 414.981 4.245 20 0 HIADHN C[NH+]1CCC(NC(=O)Nc2ccc(NC(=O)c3cc([O-])c4ccccc4c3)cc2)CC1 ZINC000527164727 930605190 /nfs/dbraw/zinc/60/51/90/930605190.db2.gz HPRJWGYDNLUMFA-UHFFFAOYSA-N 0 3 418.497 4.013 20 0 HIADHN C[C@H](NCC(=O)NCc1ccccc1Cn1cccn1)c1cc2ccccc2s1 ZINC000527484626 930666339 /nfs/dbraw/zinc/66/63/39/930666339.db2.gz SSIMEKMQSWGJBU-KRWDZBQOSA-N 0 3 404.539 4.113 20 0 HIADHN COc1ccc(CCNC(=O)[C@@H](C)N[C@@H](C)c2cc3ccccc3s2)cc1OC ZINC000527484811 930666397 /nfs/dbraw/zinc/66/63/97/930666397.db2.gz HSTVDYRSESDQPE-JKSUJKDBSA-N 0 3 412.555 4.317 20 0 HIADHN C[C@H](N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1)c1ccc2c(c1)CCC(=O)N2 ZINC000527487791 930666877 /nfs/dbraw/zinc/66/68/77/930666877.db2.gz BKTCROWAPQIMCH-MHECFPHRSA-N 0 3 413.521 4.472 20 0 HIADHN Cc1ccc(C)c(NC(=O)[C@H](N[C@H]2CCCC[C@H]2N2CCOCC2)c2ccccc2)c1 ZINC000530366633 930697106 /nfs/dbraw/zinc/69/71/06/930697106.db2.gz PTCJYDBURUFRKC-ICDZXHCJSA-N 0 3 421.585 4.216 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3cccc4c3OC(C)(C)C4)CC2)C[C@H](C)O1 ZINC000530448826 930712905 /nfs/dbraw/zinc/71/29/05/930712905.db2.gz FMHQGJZZDUVWPM-HDICACEKSA-N 0 3 415.578 4.143 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2ccc(NC(=O)c3ccco3)cc2)[C@@H]1c1ccccc1 ZINC000530462570 930719528 /nfs/dbraw/zinc/71/95/28/930719528.db2.gz LXJRISRHBJTSOQ-CTNGQTDRSA-N 0 3 404.470 4.099 20 0 HIADHN COc1cc(Cl)c(C)cc1NC(=O)CCNCc1cnc(-c2ccccc2)nc1 ZINC000530630980 930779159 /nfs/dbraw/zinc/77/91/59/930779159.db2.gz AVACLHYBQCZKLA-UHFFFAOYSA-N 0 3 410.905 4.232 20 0 HIADHN Cc1ncc(Cl)c(C(=O)N(CCN(C)Cc2ccccc2)Cc2ccccc2)n1 ZINC000530673730 930795578 /nfs/dbraw/zinc/79/55/78/930795578.db2.gz SUDYAKJVUYUEIX-UHFFFAOYSA-N 0 3 408.933 4.213 20 0 HIADHN CC(C)(C)[C@@H](CN1CCc2ccccc2C1)NC(=O)N1CCC[C@H]1c1ccccn1 ZINC000530709297 930803245 /nfs/dbraw/zinc/80/32/45/930803245.db2.gz DIMZGOOZLQHQDE-XZOQPEGZSA-N 0 3 406.574 4.401 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)c1ccnc(Oc2ccccc2)c1 ZINC000530781331 930822368 /nfs/dbraw/zinc/82/23/68/930822368.db2.gz WCBPYXAPWBRTFB-UHFFFAOYSA-N 0 3 403.482 4.083 20 0 HIADHN COc1cccc(-c2noc([C@@]3(C(F)(F)F)CCN(Cc4ccccc4)C3)n2)c1 ZINC000530879340 930847166 /nfs/dbraw/zinc/84/71/66/930847166.db2.gz AMTHLPJJMMEZSG-HXUWFJFHSA-N 0 3 403.404 4.451 20 0 HIADHN CSCc1cccc(NC(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)c1 ZINC000530945171 930863912 /nfs/dbraw/zinc/86/39/12/930863912.db2.gz XCAGKZPJRKEBAI-ROUUACIJSA-N 0 3 405.608 4.293 20 0 HIADHN COc1cc(CNCc2n[nH]c(-c3ccc(Br)cc3)n2)ccc1SC ZINC000531018319 930886214 /nfs/dbraw/zinc/88/62/14/930886214.db2.gz GPNNVWUJQPVCLU-UHFFFAOYSA-N 0 3 419.348 4.255 20 0 HIADHN C[C@@H](NC(=O)NC[C@H](c1ccccc1)N1CCCC1)c1cccc(N2CCCC2)c1 ZINC000531027880 930890182 /nfs/dbraw/zinc/89/01/82/930890182.db2.gz FBIGDZSCRDWWFN-HYBUGGRVSA-N 0 3 406.574 4.484 20 0 HIADHN CCN(C(=O)c1cccc(-c2nnc(C)o2)c1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000531047039 930896839 /nfs/dbraw/zinc/89/68/39/930896839.db2.gz PVQTZPOLTYVIPZ-VGOFRKELSA-N 0 3 404.514 4.343 20 0 HIADHN Cc1ccc([C@H](CNC(=O)CN[C@H](c2ccccc2)C(F)(F)F)N2CCCC2)cc1 ZINC000531049058 930897542 /nfs/dbraw/zinc/89/75/42/930897542.db2.gz LRJAPWZWTUVHAU-RBBKRZOGSA-N 0 3 419.491 4.141 20 0 HIADHN Cc1c(NC(=O)CC2(N3CCOCC3)CCCC2)cccc1C(=O)Nc1ccccc1 ZINC000531056002 930899916 /nfs/dbraw/zinc/89/99/16/930899916.db2.gz OBSLBOGWXAAXJE-UHFFFAOYSA-N 0 3 421.541 4.221 20 0 HIADHN Cn1c2ccccc2nc1-c1cccc(NC(=O)CC2(N3CCOCC3)CCCC2)c1 ZINC000531064849 930903667 /nfs/dbraw/zinc/90/36/67/930903667.db2.gz FKBZXCZJVUNZGJ-UHFFFAOYSA-N 0 3 418.541 4.214 20 0 HIADHN CN(C)Cc1ccc(-c2noc(-c3ccc(S(=O)(=O)C4CCCC4)cc3)n2)cc1 ZINC000531109847 930923128 /nfs/dbraw/zinc/92/31/28/930923128.db2.gz BDHJXEIEKISXFA-UHFFFAOYSA-N 0 3 411.527 4.182 20 0 HIADHN CN(C)Cc1ccc(-c2noc(C3CCN(C(=O)CCc4ccccc4)CC3)n2)cc1 ZINC000531109894 930923576 /nfs/dbraw/zinc/92/35/76/930923576.db2.gz ILTUFSVZYHVBLT-UHFFFAOYSA-N 0 3 418.541 4.137 20 0 HIADHN Cc1nn(Cc2ccc(C)cc2)c(C)c1CCC(=O)N(CCN(C)C)C1CCCC1 ZINC000531191829 930959854 /nfs/dbraw/zinc/95/98/54/930959854.db2.gz AVWHBNROYIBRDE-UHFFFAOYSA-N 0 3 410.606 4.122 20 0 HIADHN Brc1ccc(C[NH2+]Cc2nnc(-c3ccc(Br)cc3)[n-]2)cc1 ZINC000531256974 930984611 /nfs/dbraw/zinc/98/46/11/930984611.db2.gz DMEZUUFCJDNORQ-UHFFFAOYSA-N 0 3 422.124 4.287 20 0 HIADHN O=C(Nc1ccc(Cl)c(Br)c1)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000531279908 930998304 /nfs/dbraw/zinc/99/83/04/930998304.db2.gz HEQOHMMHCPWQBT-AWEZNQCLSA-N 0 3 408.727 4.348 20 0 HIADHN CCN(CC)[C@H](C(=O)NC[C@@H](C)Cn1ccnc1C)c1cccc(C(F)(F)F)c1 ZINC000531285123 931000770 /nfs/dbraw/zinc/00/07/70/931000770.db2.gz DAWDGTZFCYYMCJ-BEFAXECRSA-N 0 3 410.484 4.046 20 0 HIADHN COc1ccc(C(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)c(Br)c1 ZINC000531305471 931009401 /nfs/dbraw/zinc/00/94/01/931009401.db2.gz GAQJCMBTELDTHV-QGZVFWFLSA-N 0 3 417.347 4.194 20 0 HIADHN CN(C)Cc1ccc(-c2noc(COc3cccc(NC(=O)c4ccco4)c3)n2)cc1 ZINC000531348356 931026165 /nfs/dbraw/zinc/02/61/65/931026165.db2.gz ZOSBIGYVEZZQJD-UHFFFAOYSA-N 0 3 418.453 4.223 20 0 HIADHN Cc1ccc(C(=O)N2CCC[C@@H](c3nc(-c4ccc(CN(C)C)cc4)no3)C2)cc1 ZINC000531348580 931026678 /nfs/dbraw/zinc/02/66/78/931026678.db2.gz PTTPYFHNMBWYLS-OAQYLSRUSA-N 0 3 404.514 4.126 20 0 HIADHN COc1ccc(-c2nn(Cc3ccccc3)cc2CNCc2ccn(C)c2)cc1OC ZINC000531356032 931029700 /nfs/dbraw/zinc/02/97/00/931029700.db2.gz KZHMDOPMJQUVDT-UHFFFAOYSA-N 0 3 416.525 4.244 20 0 HIADHN CCOc1c(Br)cc(CNCc2ccn(C)c2)cc1Br ZINC000531356313 931029908 /nfs/dbraw/zinc/02/99/08/931029908.db2.gz MADLXLVKLYDBKB-UHFFFAOYSA-N 0 3 402.130 4.239 20 0 HIADHN COC(=O)c1cc2c(o1)c(OC)ccc2CNCc1csc(Br)c1 ZINC000531380635 931037921 /nfs/dbraw/zinc/03/79/21/931037921.db2.gz BCLSSHYWDIIAJP-UHFFFAOYSA-N 0 3 410.289 4.342 20 0 HIADHN CCCN(Cc1ccc(C)cc1)C(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000531399409 931044439 /nfs/dbraw/zinc/04/44/39/931044439.db2.gz FQJDZYIJBPKGJG-UHFFFAOYSA-N 0 3 409.574 4.074 20 0 HIADHN COc1ccc2oc(C(=O)N3CCC(CCN4C[C@@H](C)O[C@@H](C)C4)CC3)c(C)c2c1 ZINC000531417977 931049043 /nfs/dbraw/zinc/04/90/43/931049043.db2.gz VTLXLPBZWAXPHM-CALCHBBNSA-N 0 3 414.546 4.101 20 0 HIADHN CCNC(=O)COc1cccc(CNCc2ccc(-c3ccccc3OC)cc2)c1 ZINC000531445118 931059666 /nfs/dbraw/zinc/05/96/66/931059666.db2.gz GIXUIJLKQQBCAB-UHFFFAOYSA-N 0 3 404.510 4.167 20 0 HIADHN Brc1cccc(C2(NCc3cc(-c4cccnc4)n[nH]3)CCOCC2)c1 ZINC000531556445 931101999 /nfs/dbraw/zinc/10/19/99/931101999.db2.gz KYWCSUSNEGXFSC-UHFFFAOYSA-N 0 3 413.319 4.030 20 0 HIADHN CC(C)N1CCN([C@H]2CCN(C(=O)C3(c4ccc(Cl)cc4)CCCCC3)C2)CC1 ZINC000531578130 931108072 /nfs/dbraw/zinc/10/80/72/931108072.db2.gz FUNWEVNIJFVYON-QFIPXVFZSA-N 0 3 418.025 4.169 20 0 HIADHN CCCc1ccc([C@H](NC(=O)N2CC[C@@H](N3CCN(C(C)C)CC3)C2)C(C)C)cc1 ZINC000531584865 931110258 /nfs/dbraw/zinc/11/02/58/931110258.db2.gz OTQSYHPLTNQLJJ-DNQXCXABSA-N 0 3 414.638 4.146 20 0 HIADHN Cc1c(CSC(C)C)cccc1NC(=O)N1CC[C@H](N2CCN(C(C)C)CC2)C1 ZINC000531586791 931110628 /nfs/dbraw/zinc/11/06/28/931110628.db2.gz MXNLXGLPYWDIIL-NRFANRHFSA-N 0 3 418.651 4.269 20 0 HIADHN CC(C)NC(=O)Nc1ccc([C@H](C)NCc2ccc(OCC(F)(F)F)nc2)cc1 ZINC000531681775 931149577 /nfs/dbraw/zinc/14/95/77/931149577.db2.gz LJCCYCSQTZXXOK-AWEZNQCLSA-N 0 3 410.440 4.403 20 0 HIADHN Cc1nc(-c2cccnc2)sc1[C@@H](C)NCc1ccccc1CN1CCCC1=O ZINC000531686270 931151645 /nfs/dbraw/zinc/15/16/45/931151645.db2.gz HFYTZYFKDVZBDB-MRXNPFEDSA-N 0 3 406.555 4.487 20 0 HIADHN COc1ccc(OC)c(CN[C@@H](C)CC(=O)Nc2ccc(OC(F)(F)F)cc2)c1 ZINC000531687791 931153060 /nfs/dbraw/zinc/15/30/60/931153060.db2.gz MTYLROOMGQXBEP-ZDUSSCGKSA-N 0 3 412.408 4.109 20 0 HIADHN Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)NCc1ccc(N2CCOCC2)nc1 ZINC000531689255 931153892 /nfs/dbraw/zinc/15/38/92/931153892.db2.gz XUAIAQYOQMQKLY-OAHLLOKOSA-N 0 3 412.534 4.340 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(OCC(F)(F)F)cc1)c1ccc(S(C)(=O)=O)cc1 ZINC000531695055 931157967 /nfs/dbraw/zinc/15/79/67/931157967.db2.gz VJRXIMOCDOMSEI-UONOGXRCSA-N 0 3 401.450 4.443 20 0 HIADHN COc1cc([C@@H](C)NCc2ccc(CS(=O)(=O)NC(C)C)cc2)ccc1SC ZINC000531695606 931158381 /nfs/dbraw/zinc/15/83/81/931158381.db2.gz CDKJWMDLRGYLFH-MRXNPFEDSA-N 0 3 422.616 4.096 20 0 HIADHN CC(C)n1cc2ccc(NC(=O)CCCN3CCN(c4ccccc4)CC3)cc2n1 ZINC000531757322 931184844 /nfs/dbraw/zinc/18/48/44/931184844.db2.gz GAVYIWMTWOIFKR-UHFFFAOYSA-N 0 3 405.546 4.158 20 0 HIADHN CC(C)N1CCN([C@@H]2CCN(C(=O)c3cc4sc5ccccc5c4s3)C2)CC1 ZINC000531832521 931211898 /nfs/dbraw/zinc/21/18/98/931211898.db2.gz MGNGCWWUXWGZMV-MRXNPFEDSA-N 0 3 413.612 4.357 20 0 HIADHN CC[C@H](NCc1cccc(-n2cccn2)c1)c1ccccc1OCC(=O)N1CCCC1 ZINC000531857257 931223014 /nfs/dbraw/zinc/22/30/14/931223014.db2.gz YDCUVKDWXKHSAA-QHCPKHFHSA-N 0 3 418.541 4.114 20 0 HIADHN Cn1c(CNCCCC(=O)N2Cc3ccccc3C2)nc2cc(C(F)(F)F)ccc21 ZINC000531866524 931227663 /nfs/dbraw/zinc/22/76/63/931227663.db2.gz NLELGKDNOFDJTG-UHFFFAOYSA-N 0 3 416.447 4.004 20 0 HIADHN OCC[C@]1(CNCc2c(Cl)cccc2OCc2ccccc2Cl)CCOC1 ZINC000531883815 931234577 /nfs/dbraw/zinc/23/45/77/931234577.db2.gz IPNYUPCRAIDNGM-OAQYLSRUSA-N 0 3 410.341 4.451 20 0 HIADHN CCOc1ccc([C@H](CNC(=O)[C@@H](CC)N(C)C)c2c[nH]c3ccccc32)cc1OC ZINC000531932796 931250667 /nfs/dbraw/zinc/25/06/67/931250667.db2.gz MJOCMZPURAJJOR-SIKLNZKXSA-N 0 3 423.557 4.164 20 0 HIADHN C[C@H](NCc1cccc(NC(=O)c2ccncc2)c1)c1ccc2c(c1)CCC(=O)N2 ZINC000531938710 931254238 /nfs/dbraw/zinc/25/42/38/931254238.db2.gz XODNDDNMWVXEDD-INIZCTEOSA-N 0 3 400.482 4.069 20 0 HIADHN C[C@@H](CC(=O)Nc1cccc(Br)c1)NCc1cnn(-c2ccccc2)c1 ZINC000531943758 931257057 /nfs/dbraw/zinc/25/70/57/931257057.db2.gz LFJHXGLHDAWMBM-HNNXBMFYSA-N 0 3 413.319 4.142 20 0 HIADHN C[C@H](NC[C@H](c1cccc(F)c1)N1CCOCC1)c1sccc1Br ZINC000531952722 931261979 /nfs/dbraw/zinc/26/19/79/931261979.db2.gz POSIFPUCEAFIIM-SUMWQHHRSA-N 0 3 413.356 4.374 20 0 HIADHN Cc1nc(C(C)(C)C)sc1[C@H](C)NCc1ccc(C(=O)N2CCOCC2)cc1 ZINC000531954239 931262388 /nfs/dbraw/zinc/26/23/88/931262388.db2.gz KMTSFLQJCFEXBX-HNNXBMFYSA-N 0 3 401.576 4.072 20 0 HIADHN CCS(=O)(=O)Nc1ccc([C@H](C)N[C@@H](c2ccc(F)cc2)[C@@H]2CCCO2)cc1 ZINC000531962132 931266644 /nfs/dbraw/zinc/26/66/44/931266644.db2.gz NIZQATWCWBCDKG-JHVJFLLYSA-N 0 3 406.523 4.158 20 0 HIADHN CCS(=O)(=O)Nc1ccc([C@H](C)NCc2ccc(OC3CCCCC3)nc2)cc1 ZINC000531963117 931266759 /nfs/dbraw/zinc/26/67/59/931266759.db2.gz FOUHLPOUXXBKRG-KRWDZBQOSA-N 0 3 417.575 4.406 20 0 HIADHN C[C@@H](NCc1ccc(NC(=O)c2cccnc2)cc1)c1ccc2c(c1)CCC(=O)N2 ZINC000531964183 931267776 /nfs/dbraw/zinc/26/77/76/931267776.db2.gz ROFIBULURQADKQ-MRXNPFEDSA-N 0 3 400.482 4.069 20 0 HIADHN CCC[C@@H](N[C@H](C)c1ccc2c(c1)OCCCO2)C(=O)N1CCc2sccc2C1 ZINC000531965758 931268572 /nfs/dbraw/zinc/26/85/72/931268572.db2.gz SMYKFVCJJNRTRY-VQIMIIECSA-N 0 3 414.571 4.314 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)c1cncc(-c2ccc(N(C)C)cc2)c1 ZINC000532109724 931316383 /nfs/dbraw/zinc/31/63/83/931316383.db2.gz DHGWSPDILIXGPE-UHFFFAOYSA-N 0 3 404.514 4.137 20 0 HIADHN CC[C@@H](NCc1ccc(C(=O)N2CCOCC2)cc1)c1ccc(Br)cc1 ZINC000532115845 931318797 /nfs/dbraw/zinc/31/87/97/931318797.db2.gz DPZMMHLLRKCYRF-HXUWFJFHSA-N 0 3 417.347 4.162 20 0 HIADHN CCC(=O)N1CC[C@@H](NCc2cccc(NC(=O)c3ccc(Cl)cc3Cl)c2)C1 ZINC000532139510 931326645 /nfs/dbraw/zinc/32/66/45/931326645.db2.gz KLQUKROWEIBQFP-QGZVFWFLSA-N 0 3 420.340 4.346 20 0 HIADHN O[C@H](COC[C@H]1CCCO1)CN1CCC(=Cc2cc(Cl)ccc2Cl)CC1 ZINC000532165427 931334136 /nfs/dbraw/zinc/33/41/36/931334136.db2.gz ICMWJQROFADBKC-RBUKOAKNSA-N 0 3 400.346 4.029 20 0 HIADHN Cc1nc(-c2ccccc2F)sc1[C@@H](C)NCc1ccc(N2CCOCC2)nc1 ZINC000532200780 931347465 /nfs/dbraw/zinc/34/74/65/931347465.db2.gz HBIMXGFGOHPKOU-OAHLLOKOSA-N 0 3 412.534 4.340 20 0 HIADHN C[C@H](NC[C@H](c1ccc(F)cc1)N1CCOCC1)c1sccc1Br ZINC000532204374 931349550 /nfs/dbraw/zinc/34/95/50/931349550.db2.gz ZDXSDKFXAODORJ-SUMWQHHRSA-N 0 3 413.356 4.374 20 0 HIADHN C[C@H](NC[C@@H](O)COc1cccc(C(F)(F)F)c1)c1ccccc1OC(F)F ZINC000532207416 931351175 /nfs/dbraw/zinc/35/11/75/931351175.db2.gz JAXPIPLALKXKHT-GXTWGEPZSA-N 0 3 405.363 4.397 20 0 HIADHN C[C@H](CCNCc1cc(Br)ccc1OCc1ccccc1)[S@](C)=O ZINC000532207899 931351344 /nfs/dbraw/zinc/35/13/44/931351344.db2.gz PQXLYRXOGVBRSL-MYYSRTQBSA-N 0 3 410.377 4.275 20 0 HIADHN CC[C@@H](N[C@@H](CC)c1ccccc1OCC(=O)N(C)C)c1ccc2c(c1)OCCO2 ZINC000532211784 931354082 /nfs/dbraw/zinc/35/40/82/931354082.db2.gz IMMDSVBETBYTMR-UXHICEINSA-N 0 3 412.530 4.117 20 0 HIADHN CC(C)NS(=O)(=O)Cc1ccccc1CN[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000532214869 931356181 /nfs/dbraw/zinc/35/61/81/931356181.db2.gz YQUCTHVVVYCYGF-HNNXBMFYSA-N 0 3 414.493 4.384 20 0 HIADHN COc1cc(CNCc2c[nH]nc2-c2ccccc2F)cc(Br)c1OC ZINC000532294961 931388178 /nfs/dbraw/zinc/38/81/78/931388178.db2.gz FCPMSFQJSZZXSB-UHFFFAOYSA-N 0 3 420.282 4.285 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NCc2nnc3c(Cl)cc(C(F)(F)F)cn23)C1 ZINC000532296299 931389309 /nfs/dbraw/zinc/38/93/09/931389309.db2.gz VBXRIZXPPPVENT-BBRMVZONSA-N 0 3 423.870 4.327 20 0 HIADHN Cc1cc2occ(CC(=O)N3CC[C@@H](N4CCN(C(C)C)CC4)C3)c2cc1C(C)C ZINC000532342972 931402535 /nfs/dbraw/zinc/40/25/35/931402535.db2.gz BLPXMMQFLNYLGJ-OAQYLSRUSA-N 0 3 411.590 4.034 20 0 HIADHN CC(C)N1CCN([C@@H]2CCN(C(=O)c3ccccc3Sc3ccccc3)C2)CC1 ZINC000532347223 931403368 /nfs/dbraw/zinc/40/33/68/931403368.db2.gz AECIYXGLCCUROQ-HXUWFJFHSA-N 0 3 409.599 4.078 20 0 HIADHN Cc1ccc(Oc2ccccc2)c(NC(=O)N2CC[C@H](N3CCN(C(C)C)CC3)C2)c1 ZINC000532350920 931404684 /nfs/dbraw/zinc/40/46/84/931404684.db2.gz ZJODDZFNLNXHHI-NRFANRHFSA-N 0 3 422.573 4.420 20 0 HIADHN CC(C)NS(=O)(=O)Cc1ccc(CNCc2ccc(Cl)c3cccnc23)cc1 ZINC000532367045 931411362 /nfs/dbraw/zinc/41/13/62/931411362.db2.gz SGJJDYCSGAXENO-UHFFFAOYSA-N 0 3 417.962 4.006 20 0 HIADHN O=C(NC[C@H]1CCCN1Cc1ccccc1)N1CCC(Nc2ccc(F)cc2)CC1 ZINC000532445300 931437351 /nfs/dbraw/zinc/43/73/51/931437351.db2.gz VBNGRANKQFKEAA-HSZRJFAPSA-N 0 3 410.537 4.076 20 0 HIADHN Cc1ccc(C)c(Oc2ccc(CN[C@@H](C)c3ccc(-n4cnnn4)cc3)cn2)c1 ZINC000532459302 931444835 /nfs/dbraw/zinc/44/48/35/931444835.db2.gz MQOBAQIURDLQOP-SFHVURJKSA-N 0 3 400.486 4.317 20 0 HIADHN C[C@H]1CSc2ccc(Br)cc2[C@@H]1NCc1ccc2c(c1)nnn2C ZINC000532479126 931454838 /nfs/dbraw/zinc/45/48/38/931454838.db2.gz DSIJURNPQFVJRW-BBATYDOGSA-N 0 3 403.349 4.304 20 0 HIADHN CC(C)(CN[C@H]1CCc2ccccc21)S(=O)(=O)c1ccc(Br)cc1 ZINC000532500540 931463721 /nfs/dbraw/zinc/46/37/21/931463721.db2.gz NLGOSPUHSIRDRN-SFHVURJKSA-N 0 3 408.361 4.279 20 0 HIADHN CC(C)c1ccc(NC(=O)C[C@H](C)NCc2ccnc(OC3CCOCC3)c2)cc1 ZINC000532511538 931468801 /nfs/dbraw/zinc/46/88/01/931468801.db2.gz JPKTTZQOOZAUSN-SFHVURJKSA-N 0 3 411.546 4.270 20 0 HIADHN O=C(CCN1CCC[C@@H]1[C@@H](O)C(F)(F)F)Nc1ccccc1Oc1ccccc1 ZINC000532553285 931520776 /nfs/dbraw/zinc/52/07/76/931520776.db2.gz WIAKHIOSWJPHHQ-YLJYHZDGSA-N 0 3 408.420 4.195 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)N1c2ccccc2CC[C@@H]1C)c1ccc(NC(=O)NC2CC2)cc1 ZINC000532614620 931554542 /nfs/dbraw/zinc/55/45/42/931554542.db2.gz RINMUYSZFJQQGA-KSZLIROESA-N 0 3 420.557 4.378 20 0 HIADHN O=C(CN[C@@H](Cc1ccccc1)c1ccccc1)NC[C@H]1CCN(c2ccccc2)C1 ZINC000532642253 931564064 /nfs/dbraw/zinc/56/40/64/931564064.db2.gz PVPMWGANQSYMCV-BVAGGSTKSA-N 0 3 413.565 4.203 20 0 HIADHN O[C@@H](COc1ccc(Cl)cc1Cl)CN1CC=C(c2c[nH]c3ncccc23)CC1 ZINC000532643885 931565047 /nfs/dbraw/zinc/56/50/47/931565047.db2.gz DHHWZFAIZOCONP-MRXNPFEDSA-N 0 3 418.324 4.399 20 0 HIADHN O=C(CCN1CCC([C@H](O)C(F)(F)F)CC1)Nc1ccccc1-c1ccccc1 ZINC000532648236 931566912 /nfs/dbraw/zinc/56/69/12/931566912.db2.gz GQTAIUPFTMEGBU-NRFANRHFSA-N 0 3 406.448 4.317 20 0 HIADHN CC(=O)Nc1cccc(CNC2(c3cccc(Br)c3)CCOCC2)c1 ZINC000532651376 931568834 /nfs/dbraw/zinc/56/88/34/931568834.db2.gz MUSOHKHHSWDWOP-UHFFFAOYSA-N 0 3 403.320 4.203 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@@H](C)N[C@H](c2ccc(F)cc2)C2CCC2)cc1OC ZINC000532687620 931585300 /nfs/dbraw/zinc/58/53/00/931585300.db2.gz GTOINTXSZVFTET-MWTRTKDXSA-N 0 3 414.521 4.321 20 0 HIADHN C[C@@H]1CN(C[C@@H]2CCCN2Cc2cccc(C(=O)Nc3ccccc3)c2)C[C@@H](C)O1 ZINC000532929387 931700442 /nfs/dbraw/zinc/70/04/42/931700442.db2.gz LYNZKZOZZQKRDQ-REHUZNOOSA-N 0 3 407.558 4.013 20 0 HIADHN COc1ccc2cc(C(=O)Nc3ccnn3[C@H]3CCN(Cc4ccccc4)C3)[nH]c2c1 ZINC000532943240 931705642 /nfs/dbraw/zinc/70/56/42/931705642.db2.gz ZFRSRKLOTDOYHH-IBGZPJMESA-N 0 3 415.497 4.072 20 0 HIADHN C[C@H]1C[C@@H](c2ccc(F)cc2)CN1CC(=O)N1CCC(OCc2ccccc2)CC1 ZINC000532977021 931723399 /nfs/dbraw/zinc/72/33/99/931723399.db2.gz JLXHOXZFZBJYHV-SIKLNZKXSA-N 0 3 410.533 4.211 20 0 HIADHN CCOc1ccc(NC(=O)c2ccc(NC(=O)CN(CC3CC3)C(C)C)cc2)cc1 ZINC000533036481 931747689 /nfs/dbraw/zinc/74/76/89/931747689.db2.gz HRXSVVXFJPNYFD-UHFFFAOYSA-N 0 3 409.530 4.397 20 0 HIADHN Cc1ccc(CN(C(=O)CNC2(c3ccc(Cl)cc3)CCOCC2)C2CC2)cc1 ZINC000533063025 931760030 /nfs/dbraw/zinc/76/00/30/931760030.db2.gz ROXLPDZXVOZWGQ-UHFFFAOYSA-N 0 3 412.961 4.435 20 0 HIADHN COC(=O)c1sc2ccccc2c1CN1CCC[C@@H](c2nnc3ccccn32)C1 ZINC000533079026 931766649 /nfs/dbraw/zinc/76/66/49/931766649.db2.gz RRVGUHAUMYPIOD-OAHLLOKOSA-N 0 3 406.511 4.110 20 0 HIADHN CN(C)C(=O)Nc1ccc(Cl)c(C(=O)N(CCN2CCCC2)c2ccccc2)c1 ZINC000533106173 931772312 /nfs/dbraw/zinc/77/23/12/931772312.db2.gz AVULSRNVUHVKBD-UHFFFAOYSA-N 0 3 414.937 4.176 20 0 HIADHN NC(=O)c1csc(CNCc2ccccc2-c2ccc(Cn3ccnc3)cc2)c1 ZINC000533191244 931805364 /nfs/dbraw/zinc/80/53/64/931805364.db2.gz BPIHWHXPNQDOBF-UHFFFAOYSA-N 0 3 402.523 4.049 20 0 HIADHN Brc1ccc(-c2c[nH]c(CN[C@@H]3CCOC4(CCSCC4)C3)n2)cc1 ZINC000533226751 931814544 /nfs/dbraw/zinc/81/45/44/931814544.db2.gz YGLZCZCXMXBFNZ-MRXNPFEDSA-N 0 3 422.392 4.374 20 0 HIADHN Cc1cc(NC(=O)CO[C@@H]2CCC[C@H](C)C2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000533261242 931821441 /nfs/dbraw/zinc/82/14/41/931821441.db2.gz FWVXTVAAGUEXRY-VLCRHTCISA-N 0 3 410.562 4.172 20 0 HIADHN Cc1cc(NC(=O)CO[C@@H]2CCC[C@H](C)C2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000533261243 931821602 /nfs/dbraw/zinc/82/16/02/931821602.db2.gz FWVXTVAAGUEXRY-YUXAGFNASA-N 0 3 410.562 4.172 20 0 HIADHN CCN1CCCN(CC(=O)Nc2nc(-c3ccc(Cl)cc3Cl)cs2)CC1 ZINC000533264153 931823016 /nfs/dbraw/zinc/82/30/16/931823016.db2.gz LPNUDRQMYNEZPL-UHFFFAOYSA-N 0 3 413.374 4.083 20 0 HIADHN CCCN(CC(=O)Nc1ccc(Br)cc1C)[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000533293656 931830837 /nfs/dbraw/zinc/83/08/37/931830837.db2.gz YYLJNWROPWKCRI-ATZDWAIDSA-N 0 3 409.368 4.222 20 0 HIADHN COc1ccc(CCN(CC(=O)Nc2ccc(F)cc2F)CC(C)C)cc1OC ZINC000533299454 931832935 /nfs/dbraw/zinc/83/29/35/931832935.db2.gz BOMKATJMNQUYQB-UHFFFAOYSA-N 0 3 406.473 4.121 20 0 HIADHN C[C@@H](c1cccc(F)c1)N1CCC(C(=O)Nc2ccc(Br)cn2)CC1 ZINC000533354985 931847298 /nfs/dbraw/zinc/84/72/98/931847298.db2.gz QKXQEPATTDIGRS-ZDUSSCGKSA-N 0 3 406.299 4.395 20 0 HIADHN O[C@H](COc1ccccc1)CN1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1 ZINC000533365678 931849781 /nfs/dbraw/zinc/84/97/81/931849781.db2.gz NGSPHTPDMVQAFQ-MJGOQNOKSA-N 0 3 413.905 4.009 20 0 HIADHN COc1cc2c(cc1OC)CN(C(=O)CN[C@@H](c1ccccc1)C1CCCC1)CC2 ZINC000533384546 931854752 /nfs/dbraw/zinc/85/47/52/931854752.db2.gz GYDMGRVTEGDXRD-VWLOTQADSA-N 0 3 408.542 4.110 20 0 HIADHN CCCN(CC(=O)Nc1ccc2[nH]c(C(F)(F)F)nc2c1)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000533430087 931866518 /nfs/dbraw/zinc/86/65/18/931866518.db2.gz WHRPKAFTJPAXRV-MORSLUCNSA-N 0 3 424.467 4.046 20 0 HIADHN CCOC(=O)c1oc2ccccc2c1CN1CCC[C@@H](c2nnc3ccccn32)C1 ZINC000533538106 931897477 /nfs/dbraw/zinc/89/74/77/931897477.db2.gz KXKVZSUAXCZXKJ-MRXNPFEDSA-N 0 3 404.470 4.032 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)NCCOCc2ccc(Cl)cc2)CC1 ZINC000533609815 931922590 /nfs/dbraw/zinc/92/25/90/931922590.db2.gz CSSSKGXYLIIHNI-UHFFFAOYSA-N 0 3 415.965 4.163 20 0 HIADHN COc1ccc(C(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)cc1-c1ccccn1 ZINC000533643008 931940946 /nfs/dbraw/zinc/94/09/46/931940946.db2.gz GXVCYNNZBCXIEO-GHTZIAJQSA-N 0 3 401.510 4.323 20 0 HIADHN FC(F)(F)c1cnc(OCCNCc2cnc([C@H]3CCCO3)s2)c(Cl)c1 ZINC000533741607 932002656 /nfs/dbraw/zinc/00/26/56/932002656.db2.gz YSXISCIVJIAWBS-CYBMUJFWSA-N 0 3 407.845 4.230 20 0 HIADHN CN(C)[C@@H](CNC(=O)N1CCC[C@H](c2nc3ccccc3s2)C1)Cc1ccccc1 ZINC000533809690 932042084 /nfs/dbraw/zinc/04/20/84/932042084.db2.gz UGHZAHMZNDYERL-VQTJNVASSA-N 0 3 422.598 4.358 20 0 HIADHN Cc1nc(-c2ccccc2)sc1CNC(=O)NC[C@H](Cc1ccccc1)N(C)C ZINC000533811709 932043240 /nfs/dbraw/zinc/04/32/40/932043240.db2.gz RRKXFDDRMIFNLQ-FQEVSTJZSA-N 0 3 408.571 4.091 20 0 HIADHN CN(C(=O)c1ccn(-c2ccc(Cl)cc2)n1)C1CCN(Cc2ccccc2)CC1 ZINC000533875119 932075520 /nfs/dbraw/zinc/07/55/20/932075520.db2.gz ISYHXHVKPMWDFV-UHFFFAOYSA-N 0 3 408.933 4.262 20 0 HIADHN CN1CC[C@@H](NC(=O)c2ccc(NC(=O)c3cccs3)cc2)[C@H]1c1ccccc1 ZINC000534017284 932197931 /nfs/dbraw/zinc/19/79/31/932197931.db2.gz DEFALFMHLXEEKP-TZIWHRDSSA-N 0 3 405.523 4.176 20 0 HIADHN Cc1ccc(OCc2cccc(C(=O)N[C@H]3CCN(C)[C@H]3c3ccccc3)c2)cn1 ZINC000534016540 932198022 /nfs/dbraw/zinc/19/80/22/932198022.db2.gz FUIKRXRRJLWLAX-ZEQRLZLVSA-N 0 3 401.510 4.144 20 0 HIADHN CN1CC[C@@H](NC(=O)Cc2c[nH]c3cc(Br)ccc23)[C@@H]1c1ccccc1 ZINC000534017740 932199230 /nfs/dbraw/zinc/19/92/30/932199230.db2.gz CORXPLOCXNRZSQ-NQIIRXRSSA-N 0 3 412.331 4.035 20 0 HIADHN CN1CC[C@@H](NC(=O)CCc2ncc(-c3ccccc3Cl)o2)[C@H]1c1ccccc1 ZINC000534018312 932199408 /nfs/dbraw/zinc/19/94/08/932199408.db2.gz CGICVGDNUJYYLT-AUSIDOKSSA-N 0 3 409.917 4.489 20 0 HIADHN CCc1ccc(-c2nc(CC(=O)N[C@@H]3CCN(C)[C@@H]3c3ccccc3)cs2)cc1 ZINC000534018512 932200006 /nfs/dbraw/zinc/20/00/06/932200006.db2.gz IZZAUPFPSYMEJL-FYYLOGMGSA-N 0 3 405.567 4.477 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)c(C)c1CC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000534018909 932200739 /nfs/dbraw/zinc/20/07/39/932200739.db2.gz LYEVZNRUVZZLHP-VWNXMTODSA-N 0 3 422.960 4.247 20 0 HIADHN COC(=O)[C@H]1CCCC[C@@]1(C)NCC(=O)Nc1c(Cl)cc(Cl)cc1Cl ZINC000534019455 932201289 /nfs/dbraw/zinc/20/12/89/932201289.db2.gz QWFKWJUZRMDIDZ-PIGZYNQJSA-N 0 3 407.725 4.297 20 0 HIADHN CC(C)c1cc(C(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)c2cnn(C(C)C)c2n1 ZINC000534020737 932202036 /nfs/dbraw/zinc/20/20/36/932202036.db2.gz VRPOQVGCODIDGD-RBBKRZOGSA-N 0 3 405.546 4.311 20 0 HIADHN CCc1cc(N2CCC(N[C@@H]3CCc4c3c(Br)ccc4F)CC2)ncn1 ZINC000534059515 932237745 /nfs/dbraw/zinc/23/77/45/932237745.db2.gz STQBJLNQXQKGSX-GOSISDBHSA-N 0 3 419.342 4.187 20 0 HIADHN CN1CC[C@H](NC(=O)CCc2ncc(-c3ccc(Cl)cc3)o2)[C@@H]1c1ccccc1 ZINC000534107885 932282484 /nfs/dbraw/zinc/28/24/84/932282484.db2.gz YFCHQPSEOCSEGJ-CVDCTZTESA-N 0 3 409.917 4.489 20 0 HIADHN Clc1oc2ccccc2c1CNc1ccc2nc(CCN3CCOCC3)[nH]c2c1 ZINC000534133263 932295086 /nfs/dbraw/zinc/29/50/86/932295086.db2.gz CIXNXQLYNHTHSD-UHFFFAOYSA-N 0 3 410.905 4.449 20 0 HIADHN O=C(CC1CCC(c2ccccc2)CC1)N[C@H]1CCN(Cc2ccccc2)C[C@H]1CO ZINC000534183253 932319675 /nfs/dbraw/zinc/31/96/75/932319675.db2.gz BUUIDIWZHFIXTA-HWBSZQFVSA-N 0 3 420.597 4.350 20 0 HIADHN O=C(N[C@H]1CCN(Cc2ccccc2)C[C@H]1CO)c1cccc(OC2CCCCC2)c1 ZINC000534181964 932320309 /nfs/dbraw/zinc/32/03/09/932320309.db2.gz LJJNEYBAMZXUOM-DHLKQENFSA-N 0 3 422.569 4.011 20 0 HIADHN CC[C@H](C)CN(C)c1ccc(F)cc1CN1CCC(C(=O)NCC(F)(F)F)CC1 ZINC000534341637 932385991 /nfs/dbraw/zinc/38/59/91/932385991.db2.gz KKRRKEKCMFBWPD-HNNXBMFYSA-N 0 3 417.491 4.199 20 0 HIADHN O=C(CN[C@@H](C[C@@H]1CCOC1)c1ccccc1)Nc1ccc(Br)cc1 ZINC000534351755 932389589 /nfs/dbraw/zinc/38/95/89/932389589.db2.gz DXZOAQYPHBZMJJ-KXBFYZLASA-N 0 3 403.320 4.145 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)Nc3cccnc3-c3ccccc3)CC2)C[C@H](C)O1 ZINC000534376382 932404497 /nfs/dbraw/zinc/40/44/97/932404497.db2.gz DNGCFMXSIRHKKT-OALUTQOASA-N 0 3 408.546 4.102 20 0 HIADHN Cc1cnc(CCN(C)C[C@H](O)CO[C@@H](c2ccccc2)c2ccccc2C)s1 ZINC000534379836 932407676 /nfs/dbraw/zinc/40/76/76/932407676.db2.gz YXENZILFTWBECZ-URXFXBBRSA-N 0 3 410.583 4.401 20 0 HIADHN C[C@@H](C(=O)Nc1ccc(OCc2ccccc2)cc1)N1CC[C@H](C2CCOCC2)C1 ZINC000534380230 932407857 /nfs/dbraw/zinc/40/78/57/932407857.db2.gz FSHILGLRIRQBQK-UGKGYDQZSA-N 0 3 408.542 4.341 20 0 HIADHN Cc1cc(C)c(CC(C(=O)Nc2ccccc2OCCC(N)=O)C(F)(F)F)c(C)c1 ZINC000534389953 932414015 /nfs/dbraw/zinc/41/40/15/932414015.db2.gz QCUSGKAJQPJWMO-KRWDZBQOSA-N 0 3 422.447 4.226 20 0 HIADHN CC(C)C1CCC(N2CCN(C(=O)N[C@H](C)c3ccc([S@](C)=O)cc3)CC2)CC1 ZINC000534442511 932456929 /nfs/dbraw/zinc/45/69/29/932456929.db2.gz OJBQNZRTYAWREM-IMUFMHOHSA-N 0 3 419.635 4.027 20 0 HIADHN Cc1nc(C(C)C)sc1[C@@H](C)N(C)CCC(=O)Nc1ccc(C(N)=O)c(Cl)c1 ZINC000534477700 932510368 /nfs/dbraw/zinc/51/03/68/932510368.db2.gz MEJMITMKCGJCBD-CYBMUJFWSA-N 0 3 422.982 4.349 20 0 HIADHN COc1cc(Br)cc(C)c1NC(=O)NC[C@@H](Cc1ccccc1)N(C)C ZINC000534523061 932544486 /nfs/dbraw/zinc/54/44/86/932544486.db2.gz FJGUSEAMWXCDRI-QGZVFWFLSA-N 0 3 420.351 4.061 20 0 HIADHN O=C(Nc1cccc2c1CN(c1ccccn1)C2)N1CCN(CC2CCCCC2)CC1 ZINC000534598578 932584683 /nfs/dbraw/zinc/58/46/83/932584683.db2.gz SGSUWMJDMITZIN-UHFFFAOYSA-N 0 3 419.573 4.332 20 0 HIADHN CCOc1ccc([C@H](C)NC(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)cc1OCC ZINC000534658298 932627700 /nfs/dbraw/zinc/62/77/00/932627700.db2.gz BVEAPMLENPLLMF-WGGBDISSSA-N 0 3 411.546 4.290 20 0 HIADHN C[C@H](CO)CCCNC(=O)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000534717709 932685888 /nfs/dbraw/zinc/68/58/88/932685888.db2.gz VNFGLOQXLIXAHF-INIZCTEOSA-N 0 3 416.393 4.009 20 0 HIADHN COc1ccc(CN(C(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)[C@H](C)C2CC2)cc1 ZINC000534719571 932687708 /nfs/dbraw/zinc/68/77/08/932687708.db2.gz AEQFBVGJXVSWCY-DQMJNTIXSA-N 0 3 407.558 4.451 20 0 HIADHN CN1CC[C@@H](NC(=O)NC2(c3cccc(Br)c3)CC2)[C@@H]1c1ccccc1 ZINC000534724181 932693339 /nfs/dbraw/zinc/69/33/39/932693339.db2.gz SIBBIWSVVDYAIK-MOPGFXCFSA-N 0 3 414.347 4.183 20 0 HIADHN COc1ccc(C[C@@H](C)C(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000534729698 932697856 /nfs/dbraw/zinc/69/78/56/932697856.db2.gz YSNSWXAGDZDYMV-KNQAVFIVSA-N 0 3 418.541 4.156 20 0 HIADHN Cc1ccc(-c2ncco2)cc1NC(=O)N1CCC(CN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000534739324 932708542 /nfs/dbraw/zinc/70/85/42/932708542.db2.gz QPWQKFMMFJMEHS-ROUUACIJSA-N 0 3 412.534 4.003 20 0 HIADHN Clc1cc2c(c(Br)c1)CC[C@@H]2NCc1cccc(-n2cncn2)c1 ZINC000534792674 932773910 /nfs/dbraw/zinc/77/39/10/932773910.db2.gz ASTPERQUBNGHCB-SFHVURJKSA-N 0 3 403.711 4.460 20 0 HIADHN CC(C)CN(CCN(C)C)C(=O)Cc1csc(-c2cccc(C(F)(F)F)c2)n1 ZINC000534800276 932778068 /nfs/dbraw/zinc/77/80/68/932778068.db2.gz SZZOSAQDDZRSOX-UHFFFAOYSA-N 0 3 413.509 4.418 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)NC1CCC(F)(F)CC1 ZINC000534936079 932846197 /nfs/dbraw/zinc/84/61/97/932846197.db2.gz IGIYKVKZBVQMIR-UHFFFAOYSA-N 0 3 407.427 4.357 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NC1C[C@@H](C)O[C@H](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000535061884 932895590 /nfs/dbraw/zinc/89/55/90/932895590.db2.gz SYPGNVGLPRUPMJ-SPYBWZPUSA-N 0 3 415.500 4.344 20 0 HIADHN O=C(NCc1ccc(F)cc1)C1CCN(Cc2cnc(-c3ccccc3)s2)CC1 ZINC000535067520 932896374 /nfs/dbraw/zinc/89/63/74/932896374.db2.gz ZEIMYYYTGBEQEI-UHFFFAOYSA-N 0 3 409.530 4.478 20 0 HIADHN Cc1cc(C)c(CC(C(=O)Nc2ccc(CNC(N)=O)cc2)C(F)(F)F)c(C)c1 ZINC000535162220 932978568 /nfs/dbraw/zinc/97/85/68/932978568.db2.gz PSDOTYRXODWQJF-GOSISDBHSA-N 0 3 407.436 4.140 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N(C)[C@@H]1CCSC1)c1ccc(C(F)(F)F)cc1 ZINC000535219199 933023545 /nfs/dbraw/zinc/02/35/45/933023545.db2.gz IIZDSYGGYKGEKZ-IAGOWNOFSA-N 0 3 403.514 4.235 20 0 HIADHN Cc1nc(-c2cccc(C(F)(F)F)c2)[nH]c1C(=O)N(CCN(C)C)Cc1ccco1 ZINC000535289213 933051995 /nfs/dbraw/zinc/05/19/95/933051995.db2.gz PGZOBTHAHKSDNN-UHFFFAOYSA-N 0 3 420.435 4.201 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)Nc1cncc(Br)c1 ZINC000535298407 933058027 /nfs/dbraw/zinc/05/80/27/933058027.db2.gz KUODHHJCNYMPPC-UHFFFAOYSA-N 0 3 411.731 4.093 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1)c1nc2ccccc2n1C(F)F ZINC000535340425 933082353 /nfs/dbraw/zinc/08/23/53/933082353.db2.gz OCCRSJSOZDHAJD-POZUXBRTSA-N 0 3 413.472 4.237 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)[C@H]1CC(=O)N(C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000535374229 933099766 /nfs/dbraw/zinc/09/97/66/933099766.db2.gz VOOYVZFRGANGKM-HRAATJIYSA-N 0 3 417.912 4.007 20 0 HIADHN O=C(Nc1ccccc1O)C1CCN(CCOc2cc(Cl)cc(Cl)c2)CC1 ZINC000535374610 933100964 /nfs/dbraw/zinc/10/09/64/933100964.db2.gz PKRJFPRZEOYGMA-UHFFFAOYSA-N 0 3 409.313 4.429 20 0 HIADHN Cc1cc([C@H](NC(=O)N2CCC(CN3C[C@@H](C)O[C@H](C)C3)CC2)C2CC2)ccc1F ZINC000535414970 933124224 /nfs/dbraw/zinc/12/42/24/933124224.db2.gz KXUCJIAXDPBHLE-PMAPCBKXSA-N 0 3 417.569 4.116 20 0 HIADHN Cc1nnc(SCC(=O)Nc2cc(C)cc(CN(C)C)c2)n1-c1cc(C)ccc1C ZINC000535415549 933124954 /nfs/dbraw/zinc/12/49/54/933124954.db2.gz GETSAKNVNVEWJR-UHFFFAOYSA-N 0 3 423.586 4.293 20 0 HIADHN CN1CC[C@@H](NC(=O)CCc2cc(Br)ccc2F)[C@@H]1c1ccccc1 ZINC000535467273 933156580 /nfs/dbraw/zinc/15/65/80/933156580.db2.gz COTLJNRJAGHYNP-QUCCMNQESA-N 0 3 405.311 4.082 20 0 HIADHN Cc1cc(C(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)ccc1NC(=O)c1cccs1 ZINC000535470451 933160409 /nfs/dbraw/zinc/16/04/09/933160409.db2.gz WEBOZTFHNZDTHO-IRLDBZIGSA-N 0 3 419.550 4.484 20 0 HIADHN CC(C)Cn1ncc(NC(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)c1C(F)F ZINC000535535322 933228483 /nfs/dbraw/zinc/22/84/83/933228483.db2.gz LLSHIGKCQUCOQJ-KRWDZBQOSA-N 0 3 405.493 4.215 20 0 HIADHN COc1ccc(COCCCC(=O)N(Cc2ccccc2)C2CCN(C)CC2)cc1 ZINC000535599325 933261212 /nfs/dbraw/zinc/26/12/12/933261212.db2.gz SJFUUNMGHPMNMZ-UHFFFAOYSA-N 0 3 410.558 4.115 20 0 HIADHN O=C(Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)c1cccc([C@H]2CCOC2)c1 ZINC000535606908 933264641 /nfs/dbraw/zinc/26/46/41/933264641.db2.gz VWLBHZVKRMHCQQ-GOTSBHOMSA-N 0 3 416.525 4.086 20 0 HIADHN COc1ccc(C[C@@H](C)CN(C)CC(=O)Nc2ccccc2Br)cc1 ZINC000535615609 933269927 /nfs/dbraw/zinc/26/99/27/933269927.db2.gz DRLPOLRAJLXMBR-OAHLLOKOSA-N 0 3 405.336 4.207 20 0 HIADHN CN(C)CCN(Cc1cccc(O)c1)C(=O)[C@H]1C[C@@H]1c1ccccc1C(F)(F)F ZINC000535640201 933280531 /nfs/dbraw/zinc/28/05/31/933280531.db2.gz SEYVJDPJXJJCSK-MOPGFXCFSA-N 0 3 406.448 4.105 20 0 HIADHN CCNC(=O)c1cc(NC(=O)c2oc3ccccc3c2CN(C)C)nc2ccccc21 ZINC000535712010 933364490 /nfs/dbraw/zinc/36/44/90/933364490.db2.gz YAGPYCIUPYTDIO-UHFFFAOYSA-N 0 3 416.481 4.045 20 0 HIADHN CC[C@H](c1ccncc1)N(C)C[C@H](O)COc1ccc(Cl)cc1Br ZINC000535788666 933387786 /nfs/dbraw/zinc/38/77/86/933387786.db2.gz AFUMJHZLBFZLEU-DOTOQJQBSA-N 0 3 413.743 4.320 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(CN(Cc3ccccc3)C[C@H](C)O)c2)cc1 ZINC000535799751 933395117 /nfs/dbraw/zinc/39/51/17/933395117.db2.gz XAMXLJYUSBWEQN-IBGZPJMESA-N 0 3 404.510 4.331 20 0 HIADHN CCN(CC)[C@H](C(=O)N(C)CCCn1ccnc1C)c1cccc(C(F)(F)F)c1 ZINC000535837327 933423475 /nfs/dbraw/zinc/42/34/75/933423475.db2.gz QBKIYJIUYFWIIV-IBGZPJMESA-N 0 3 410.484 4.142 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1cccc(OC(C)C)n1 ZINC000535864273 933447411 /nfs/dbraw/zinc/44/74/11/933447411.db2.gz GMXMLZRHGQEMDM-FQEVSTJZSA-N 0 3 419.529 4.073 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)[C@H](C)C1CCOCC1)c1ccc(C(F)(F)F)cc1 ZINC000535882837 933463674 /nfs/dbraw/zinc/46/36/74/933463674.db2.gz LRNIKBBBIKXCGX-BEFAXECRSA-N 0 3 400.485 4.267 20 0 HIADHN C[C@H](Cc1cccc(Cl)c1)C(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000535911111 933486655 /nfs/dbraw/zinc/48/66/55/933486655.db2.gz LUUOXMYQNBOJBH-QGZVFWFLSA-N 0 3 400.950 4.362 20 0 HIADHN CCOc1cccc2cc([C@@H](C)NC(=O)NC[C@H](Cc3ccccc3)N(C)C)oc21 ZINC000536013079 933570411 /nfs/dbraw/zinc/57/04/11/933570411.db2.gz HSNNNWRERGQDHS-XLIONFOSSA-N 0 3 409.530 4.365 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)c2ccc(-n3nc(C)cc3C)cc2)cc1 ZINC000536094009 933644567 /nfs/dbraw/zinc/64/45/67/933644567.db2.gz CAWWUDKZXQKFHE-DEOSSOPVSA-N 0 3 418.541 4.065 20 0 HIADHN CC(=O)c1cccc(OCc2cc(C(=O)Nc3ccc(C)cc3CN(C)C)no2)c1 ZINC000536111855 933661988 /nfs/dbraw/zinc/66/19/88/933661988.db2.gz IBYKGRNKFUFJKC-UHFFFAOYSA-N 0 3 407.470 4.079 20 0 HIADHN C[C@@H](NCc1ccc([C@]2(C)NC(=O)NC2=O)cc1)c1cc2c(ccc3ccccc23)o1 ZINC000537293356 933700834 /nfs/dbraw/zinc/70/08/34/933700834.db2.gz ODJSTPXBBPPVQI-BZQUYTCOSA-N 0 3 413.477 4.491 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCC[C@@H]1[C@@H]1C[C@@H](C)CC[C@@H]1O)c1ccsc1 ZINC000537305498 933707007 /nfs/dbraw/zinc/70/70/07/933707007.db2.gz VWPAVGDTINIMSH-URZNZNTCSA-N 0 3 407.624 4.102 20 0 HIADHN C[C@H](N[C@H]1CCC[C@H](S(C)(=O)=O)C1)c1cc2cc(Br)ccc2o1 ZINC000537307068 933707882 /nfs/dbraw/zinc/70/78/82/933707882.db2.gz KMGKPYSESIQAPC-CQDKDKBSSA-N 0 3 400.338 4.202 20 0 HIADHN O=C1[C@H](N2CCN(C3CCCCC3)CC2)CCCN1Cc1cccc(C(F)(F)F)c1 ZINC000537362000 933737902 /nfs/dbraw/zinc/73/79/02/933737902.db2.gz CDFFQEGQSHXBIR-OAQYLSRUSA-N 0 3 423.523 4.147 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)c1coc(-c2ccccc2Cl)n1 ZINC000537427106 933771712 /nfs/dbraw/zinc/77/17/12/933771712.db2.gz YPNHBBBUUIERMM-UHFFFAOYSA-N 0 3 411.889 4.204 20 0 HIADHN CCNC(=O)[C@H](C)N[C@@H]1CCCc2nc(-c3ccccc3Br)sc21 ZINC000537519881 933799195 /nfs/dbraw/zinc/79/91/95/933799195.db2.gz KFXGZZVRBOJKBU-SMDDNHRTSA-N 0 3 408.365 4.064 20 0 HIADHN CN(Cc1ccccc1F)C(=O)CNC1(c2cccc(C(F)(F)F)c2)CCOCC1 ZINC000562495675 945090498 /nfs/dbraw/zinc/09/04/98/945090498.db2.gz FHXISVZCSALMAO-UHFFFAOYSA-N 0 3 424.438 4.098 20 0 HIADHN C[C@H](N[C@@H]1CCN(C)[C@H]1c1ccc(Cl)c(F)c1)C(=O)Nc1cc(F)ccc1F ZINC000562907297 945148364 /nfs/dbraw/zinc/14/83/64/945148364.db2.gz DZXZUJFYRLAMQI-JVMOKEISSA-N 0 3 411.855 4.119 20 0 HIADHN C[C@H](N[C@@H]1CCN(C)[C@@H]1c1ccc(Cl)c(F)c1)C(=O)Nc1cc(F)ccc1F ZINC000562907298 945148655 /nfs/dbraw/zinc/14/86/55/945148655.db2.gz DZXZUJFYRLAMQI-OWOPXTPDSA-N 0 3 411.855 4.119 20 0 HIADHN CCNC(=O)[C@@H](C)N[C@@H]1CCCc2nc(-c3ccc(Br)cc3)sc21 ZINC000537520717 938315414 /nfs/dbraw/zinc/31/54/14/938315414.db2.gz CNJWIDUGRNOWLJ-BXUZGUMPSA-N 0 3 408.365 4.064 20 0 HIADHN c1cn(Cc2ccccc2)c(CN2CCC[C@@H](c3n[nH]c(C4CCCCC4)n3)C2)n1 ZINC000537564344 938326010 /nfs/dbraw/zinc/32/60/10/938326010.db2.gz TVYZOOIVSVMHEE-OAQYLSRUSA-N 0 3 404.562 4.477 20 0 HIADHN O[C@H](COc1ccc2ccccc2c1)CN1CCC(n2ccc(C(F)(F)F)n2)CC1 ZINC000537610253 938332354 /nfs/dbraw/zinc/33/23/54/938332354.db2.gz MYEKZNPGPPYEOI-IBGZPJMESA-N 0 3 419.447 4.132 20 0 HIADHN COCCCOC1CCN(Cc2cn(C(C)(C)C)nc2-c2cccc(OC)c2)CC1 ZINC000537617268 938334931 /nfs/dbraw/zinc/33/49/31/938334931.db2.gz ZOVKCTIMHSHBNB-UHFFFAOYSA-N 0 3 415.578 4.331 20 0 HIADHN COc1ccc(CN2CCC[C@H](C(=O)N3CCCC3)C2)cc1OCc1ccccc1 ZINC000537628005 938339452 /nfs/dbraw/zinc/33/94/52/938339452.db2.gz YEULVEHXRUTANV-QFIPXVFZSA-N 0 3 408.542 4.109 20 0 HIADHN CNC(=O)c1ccc(CN(CCc2ccc(OC)c(OC)c2)Cc2ccsc2)cc1 ZINC000537648405 938345894 /nfs/dbraw/zinc/34/58/94/938345894.db2.gz IHZWDRNPXLWUIS-UHFFFAOYSA-N 0 3 424.566 4.370 20 0 HIADHN COc1cc(CN2CCCCC[C@@H]2/C=C\c2ccccc2)cc(OC)c1OCC(N)=O ZINC000537709815 938361321 /nfs/dbraw/zinc/36/13/21/938361321.db2.gz JQNUNDGCIBCHSI-BIGNBACZSA-N 0 3 424.541 4.026 20 0 HIADHN Cc1ccc(Cl)cc1NC(=O)C[C@@H](C)N[C@@H]1CC(=O)N(c2c(F)cccc2F)C1 ZINC000537765759 938372527 /nfs/dbraw/zinc/37/25/27/938372527.db2.gz STUCYHHLEFGVHO-UKRRQHHQSA-N 0 3 421.875 4.039 20 0 HIADHN Brc1ccc2c(c1)[C@@H](NCc1cccnc1-n1cccn1)CCS2 ZINC000537768564 938373211 /nfs/dbraw/zinc/37/32/11/938373211.db2.gz XJSJRXTWCCXJGE-INIZCTEOSA-N 0 3 401.333 4.357 20 0 HIADHN C[C@H](N[C@@H]1CCN(c2cnn(C)c2)C1=O)c1ccc(-c2ccc(Cl)cc2)s1 ZINC000537774095 938373876 /nfs/dbraw/zinc/37/38/76/938373876.db2.gz LNTBCAFYMZRURK-SUMWQHHRSA-N 0 3 400.935 4.258 20 0 HIADHN CCN1CCN(CCC(=O)N[C@@H](C)c2ccc(-c3ccc(Cl)cc3)s2)CC1 ZINC000537791165 938376589 /nfs/dbraw/zinc/37/65/89/938376589.db2.gz SEULCPATHCWQIX-INIZCTEOSA-N 0 3 405.995 4.273 20 0 HIADHN O=C(CC[C@H]1CCCCO1)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1 ZINC000537832179 938385947 /nfs/dbraw/zinc/38/59/47/938385947.db2.gz VOMLQOYFAVMMOQ-RUZDIDTESA-N 0 3 421.585 4.339 20 0 HIADHN O=C([C@@H]1CC12CCN(Cc1ccc(OCc3ccncc3)cc1)CC2)N1CCCCC1 ZINC000537847190 938388919 /nfs/dbraw/zinc/38/89/19/938388919.db2.gz RBZLWUFJZJZRPY-DEOSSOPVSA-N 0 3 419.569 4.275 20 0 HIADHN CC[C@](C)(NCCc1nc2sc3c(c2c(N)n1)CCCC3)c1nc(C)cs1 ZINC000537860169 938392505 /nfs/dbraw/zinc/39/25/05/938392505.db2.gz CZMHZTQRVWDOCS-FQEVSTJZSA-N 0 3 401.605 4.375 20 0 HIADHN COc1ccc([C@H](OC)[C@H](C)[NH2+]Cc2cc(Br)c([O-])c(OC)c2)cc1 ZINC000537864334 938393858 /nfs/dbraw/zinc/39/38/58/938393858.db2.gz WBVIUSPNCMUTRM-HXPMCKFVSA-N 0 3 410.308 4.038 20 0 HIADHN CSc1cc(CNC(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)ccn1 ZINC000537868467 938394966 /nfs/dbraw/zinc/39/49/66/938394966.db2.gz JCUJGLAHEMISMC-KRWDZBQOSA-N 0 3 404.605 4.137 20 0 HIADHN Cc1cccc(NC(=O)C[C@H](C)N[C@@H](CO)c2ccc(Br)cc2)c1C ZINC000537941879 938425420 /nfs/dbraw/zinc/42/54/20/938425420.db2.gz HLVCLVLJJMYZRM-LIRRHRJNSA-N 0 3 405.336 4.106 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)N[C@H](CO)c2ccc(Br)cc2)cc1 ZINC000537941549 938425722 /nfs/dbraw/zinc/42/57/22/938425722.db2.gz VCLSPADKFDDTCK-JLTOFOAXSA-N 0 3 400.320 4.327 20 0 HIADHN CC[C@H](N[C@H](C)c1ccc(NC(C)=O)cc1OC)[C@H](c1ccc(C)cc1)n1cncn1 ZINC000537948967 938428657 /nfs/dbraw/zinc/42/86/57/938428657.db2.gz NEUSXZLCJQLALV-UWSIMGETSA-N 0 3 421.545 4.272 20 0 HIADHN CSc1ccc([C@H](C)NC[C@@H](O)COc2ccccc2Br)cc1F ZINC000537955072 938431662 /nfs/dbraw/zinc/43/16/62/938431662.db2.gz GDFYWTBLQFMORV-GXTWGEPZSA-N 0 3 414.340 4.401 20 0 HIADHN COc1ccc(OC)c(NC(=O)C[C@@H](C)N[C@@H]2CC(C)(C)Oc3cc(F)ccc32)c1 ZINC000537961376 938435182 /nfs/dbraw/zinc/43/51/82/938435182.db2.gz IMPDNHBPQQFSGM-AUUYWEPGSA-N 0 3 416.493 4.452 20 0 HIADHN Cc1ccccc1NC(=O)C[C@H](C)N[C@@H](c1ccc(Cl)cc1)[C@H]1CN(C)CCO1 ZINC000537963372 938436061 /nfs/dbraw/zinc/43/60/61/938436061.db2.gz JMTKJMFQHHBPET-LXBDKUERSA-N 0 3 415.965 4.027 20 0 HIADHN COc1ccc([C@H](C)NC(=O)NC[C@@H](c2cccs2)N2CCCC2)c(C)c1OC ZINC000563308165 945174593 /nfs/dbraw/zinc/17/45/93/945174593.db2.gz PWQLORZVUULPDB-WMZOPIPTSA-N 0 3 417.575 4.271 20 0 HIADHN C[C@H](NCc1cc(Cl)c2c(c1)OCCCO2)c1cccc(N2CCOCC2)c1 ZINC000537973606 938443088 /nfs/dbraw/zinc/44/30/88/938443088.db2.gz SAMJOAQZTDUDGK-INIZCTEOSA-N 0 3 402.922 4.189 20 0 HIADHN COc1cc(CN[C@@H](C)c2ccc3c(c2)CCC(=O)N3)cc(Br)c1OC ZINC000537974496 938443516 /nfs/dbraw/zinc/44/35/16/938443516.db2.gz DUPKDZWIHUVLFR-LBPRGKRZSA-N 0 3 419.319 4.202 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(OCCN[C@@H](C)c3ccc(F)cn3)c2)cc1 ZINC000537979598 938445717 /nfs/dbraw/zinc/44/57/17/938445717.db2.gz NBOMSBGGEFIAQV-INIZCTEOSA-N 0 3 409.461 4.211 20 0 HIADHN O[C@H](CN[C@@H](Cc1ccccc1F)c1ccccc1Br)C1CCOCC1 ZINC000537985594 938449246 /nfs/dbraw/zinc/44/92/46/938449246.db2.gz BGTWGYRNSRVTKU-LEWJYISDSA-N 0 3 422.338 4.249 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(Cl)cc2)CC1)[C@@H]1C[C@H]1c1ccc(F)cc1 ZINC000537987323 938449951 /nfs/dbraw/zinc/44/99/51/938449951.db2.gz NSVRTZUVWDNOKI-FCHUYYIVSA-N 0 3 416.924 4.242 20 0 HIADHN CC(C)c1ccc([C@@H](C)NCc2ccccc2OCC(=O)NC[C@H]2CCCO2)cc1 ZINC000537988006 938450482 /nfs/dbraw/zinc/45/04/82/938450482.db2.gz TZJBYSOVJJJHFK-AUSIDOKSSA-N 0 3 410.558 4.335 20 0 HIADHN CCSc1ccc([C@H](C)NCc2ccc(S(=O)(=O)N3CCCC3)cc2)cc1 ZINC000537989678 938451290 /nfs/dbraw/zinc/45/12/90/938451290.db2.gz CLARCPDZKVSPGI-KRWDZBQOSA-N 0 3 404.601 4.434 20 0 HIADHN Cc1cc(C)c2c(c1)[C@@H](N[C@@H](C)c1ccc(S(=O)(=O)N(C)C)cc1)CCCO2 ZINC000537990715 938452205 /nfs/dbraw/zinc/45/22/05/938452205.db2.gz KBAXKHAVXQDQFX-UWJYYQICSA-N 0 3 402.560 4.118 20 0 HIADHN C[C@H](NCCOc1ccccc1-c1ccccc1)c1cccc(S(=O)(=O)N(C)C)c1 ZINC000537990633 938452385 /nfs/dbraw/zinc/45/23/85/938452385.db2.gz JNLFYLVCYNVPAG-IBGZPJMESA-N 0 3 424.566 4.334 20 0 HIADHN CC[C@H](NCc1ccc(S(=O)(=O)N(C)C)cc1)c1ccc2cc(OC)ccc2c1 ZINC000537992016 938453341 /nfs/dbraw/zinc/45/33/41/938453341.db2.gz WVDLBRVMUXISOI-QHCPKHFHSA-N 0 3 412.555 4.340 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3ccccc3COC(C)(C)C)CC2)C[C@@H](C)O1 ZINC000538019679 938465248 /nfs/dbraw/zinc/46/52/48/938465248.db2.gz FTBWUBCVJRPEFM-WOJBJXKFSA-N 0 3 416.606 4.353 20 0 HIADHN CCCN1c2ccc(NC(=O)NC[C@@H](c3ccccc3)N3CCCC3)cc2CCC1=O ZINC000538031535 938473316 /nfs/dbraw/zinc/47/33/16/938473316.db2.gz MJDLBTWCAJWVJL-QHCPKHFHSA-N 0 3 420.557 4.334 20 0 HIADHN CN1CC[C@H](NC(=O)N[C@@H]2CCO[C@@H]2c2ccc(Cl)c(F)c2)[C@@H]1c1ccccc1 ZINC000538043133 938479223 /nfs/dbraw/zinc/47/92/23/938479223.db2.gz BGOZXQGVQMEOCQ-JSXRDJHFSA-N 0 3 417.912 4.054 20 0 HIADHN CNS(=O)(=O)c1cccc(CN[C@H](c2cccc(C(F)(F)F)c2)C(C)C)c1 ZINC000538060921 938490462 /nfs/dbraw/zinc/49/04/62/938490462.db2.gz ZCGATSBDPXFIDK-SFHVURJKSA-N 0 3 400.466 4.100 20 0 HIADHN Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)N[C@@H](C)c1ccc(S(N)(=O)=O)cc1 ZINC000538101028 938502318 /nfs/dbraw/zinc/50/23/18/938502318.db2.gz ZRZMWXCCGREQEE-LSDHHAIUSA-N 0 3 415.584 4.486 20 0 HIADHN CCC(=O)Nc1ccc(S(=O)(=O)[N-]c2ccc(C[N@@H+]3CCCC[C@H]3C)cc2)cc1 ZINC000538133236 938515815 /nfs/dbraw/zinc/51/58/15/938515815.db2.gz JWGLSAAVGLKFSK-QGZVFWFLSA-N 0 3 415.559 4.210 20 0 HIADHN CCC(=O)Nc1ccc(S(=O)(=O)[N-]c2ccc(C[N@H+]3CCCC[C@H]3C)cc2)cc1 ZINC000538133236 938515821 /nfs/dbraw/zinc/51/58/21/938515821.db2.gz JWGLSAAVGLKFSK-QGZVFWFLSA-N 0 3 415.559 4.210 20 0 HIADHN CC(C)[C@H](NCC(=O)N(C)Cc1ccc(Cl)s1)c1ccc2c(c1)OCCO2 ZINC000538140426 938518111 /nfs/dbraw/zinc/51/81/11/938518111.db2.gz LIINZGXPRQCAMP-FQEVSTJZSA-N 0 3 408.951 4.118 20 0 HIADHN c1ccc(-c2nc3ccccn3c2CN[C@@H](CN2CCOCC2)c2ccccc2)cc1 ZINC000538141324 938518326 /nfs/dbraw/zinc/51/83/26/938518326.db2.gz MSOTUHMEFLDVFX-QHCPKHFHSA-N 0 3 412.537 4.164 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(Br)cc1)C(=O)Nc1ccc2c(c1)OCCCO2 ZINC000538142402 938518704 /nfs/dbraw/zinc/51/87/04/938518704.db2.gz AJDHSJNGAXLJFH-ZIAGYGMSSA-N 0 3 419.319 4.288 20 0 HIADHN CC[C@H](NCc1cccc(Br)c1C)c1ccccc1OCC(=O)N(C)C ZINC000538149482 938522328 /nfs/dbraw/zinc/52/23/28/938522328.db2.gz AMRJTPUVISCICA-IBGZPJMESA-N 0 3 419.363 4.465 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(NC(=O)c2ccncc2)cc1)C(=O)NC1CCC(C)CC1 ZINC000538187874 938543825 /nfs/dbraw/zinc/54/38/25/938543825.db2.gz JTXFSWVIVQXINL-KQNFGGRRSA-N 0 3 408.546 4.068 20 0 HIADHN Cc1ccccc1[C@@H](NCC(=O)NCc1ccccc1CN1CCCC1=O)C(C)(C)C ZINC000538191503 938546737 /nfs/dbraw/zinc/54/67/37/938546737.db2.gz ONZZMMIWCCWBNX-RUZDIDTESA-N 0 3 421.585 4.111 20 0 HIADHN Cc1cc(NC(=O)CN[C@H](c2ccccc2)[C@H]2CCOC2)ccc1Br ZINC000538197054 938550168 /nfs/dbraw/zinc/55/01/68/938550168.db2.gz KGQSFCROURLSJY-OXJNMPFZSA-N 0 3 403.320 4.063 20 0 HIADHN O=C(CN[C@@H](c1ccc(Cl)cc1)C1CCC1)NC[C@@H]1CCN(c2ccccc2)C1 ZINC000538206643 938554098 /nfs/dbraw/zinc/55/40/98/938554098.db2.gz PXAPCBVPUXPSMU-MHECFPHRSA-N 0 3 411.977 4.414 20 0 HIADHN COC(=O)C1CCN(C(=O)CN[C@@H](C)c2ccccc2-c2ccc(Cl)cc2)CC1 ZINC000538215191 938558954 /nfs/dbraw/zinc/55/89/54/938558954.db2.gz OJHGLEVUZHRUDH-INIZCTEOSA-N 0 3 414.933 4.069 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CNC(=O)CN[C@@H](C)c1cc(C)cc(C)c1 ZINC000538216042 938559668 /nfs/dbraw/zinc/55/96/68/938559668.db2.gz BRUNPYOFSNLZKH-IBGZPJMESA-N 0 3 404.558 4.132 20 0 HIADHN COc1cc(Cl)c(C)cc1NC(=O)CN[C@@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000538225784 938564970 /nfs/dbraw/zinc/56/49/70/938564970.db2.gz WLMQNZOMDIFXLY-LPHOPBHVSA-N 0 3 402.922 4.353 20 0 HIADHN C[C@H](C1CCCCC1)N(C)CC(=O)N(C)CC(=O)Nc1ccccc1C(F)(F)F ZINC000563453386 945187476 /nfs/dbraw/zinc/18/74/76/945187476.db2.gz CSVCTOFXNAUTRM-OAHLLOKOSA-N 0 3 413.484 4.003 20 0 HIADHN C[C@H](N[C@@H](C)c1cccc(N2CCCC2)c1)C(=O)Nc1ccc2c(c1)OCCCO2 ZINC000538279143 938582189 /nfs/dbraw/zinc/58/21/89/938582189.db2.gz KBUYTQHGJCSRDQ-ROUUACIJSA-N 0 3 409.530 4.126 20 0 HIADHN COc1ccc(CN(C(=O)CN[C@@H](C)c2cccc(N3CCCC3)c2)C2CC2)cc1 ZINC000538280622 938582401 /nfs/dbraw/zinc/58/24/01/938582401.db2.gz VJWLXBGBMKMRED-IBGZPJMESA-N 0 3 407.558 4.137 20 0 HIADHN CC(C)(C)[C@@H](COc1ccccc1F)NCC(=O)N1CCC[C@H](C(F)(F)F)C1 ZINC000538390688 938609575 /nfs/dbraw/zinc/60/95/75/938609575.db2.gz UOCNADRNWNCXGZ-WMLDXEAASA-N 0 3 404.448 4.010 20 0 HIADHN COc1ccc([C@H]2CCCN2C(=O)CN[C@@H](c2ccccc2C)C2CC2)cc1OC ZINC000538392727 938609610 /nfs/dbraw/zinc/60/96/10/938609610.db2.gz KGMLXIFFLSZQCC-PXDATVDWSA-N 0 3 408.542 4.417 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)CN[C@@H](c2ccccc2C)C2CC2)cc1OC ZINC000538392728 938610179 /nfs/dbraw/zinc/61/01/79/938610179.db2.gz KGMLXIFFLSZQCC-SQJMNOBHSA-N 0 3 408.542 4.417 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)c1cc(OC(F)F)cc(OC(F)F)c1 ZINC000538415753 938615550 /nfs/dbraw/zinc/61/55/50/938615550.db2.gz UMTSOPBBPTYEGM-UHFFFAOYSA-N 0 3 414.399 4.093 20 0 HIADHN CCOC(=O)COc1ccc(CNC2(c3cccc(Br)c3)CC2)cc1 ZINC000538416831 938615584 /nfs/dbraw/zinc/61/55/84/938615584.db2.gz IBLHFIRHOUKCCQ-UHFFFAOYSA-N 0 3 404.304 4.170 20 0 HIADHN CC(C)C[C@@H]1C[C@H](NC(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)CCO1 ZINC000538518119 938639875 /nfs/dbraw/zinc/63/98/75/938639875.db2.gz LDJYJGWRZVUCIZ-AQNXPRMDSA-N 0 3 407.624 4.414 20 0 HIADHN O=C1[C@H](NCc2cccc3[nH]ccc32)CCCN1Cc1cccc(C(F)(F)F)c1 ZINC000538534044 938643420 /nfs/dbraw/zinc/64/34/20/938643420.db2.gz MFIZGUGHOFHMIS-HXUWFJFHSA-N 0 3 401.432 4.468 20 0 HIADHN CN(C)[C@H](CNC(=O)Nc1ccc2nc(-c3ccccn3)oc2c1)c1ccccc1 ZINC000538625261 938665236 /nfs/dbraw/zinc/66/52/36/938665236.db2.gz ORMJNGPORXZFIG-HXUWFJFHSA-N 0 3 401.470 4.314 20 0 HIADHN COCCC[C@@H](C)C(=O)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000538654457 938674623 /nfs/dbraw/zinc/67/46/23/938674623.db2.gz ISKCRLNJGVJQSR-MRXNPFEDSA-N 0 3 401.378 4.481 20 0 HIADHN C[C@@H](c1ccccc1)N(C)C(=O)CN1CCC[C@@H](c2nc(C3CCCCC3)n[nH]2)C1 ZINC000538664894 938678804 /nfs/dbraw/zinc/67/88/04/938678804.db2.gz CGSYUXZMBCHGFS-GHTZIAJQSA-N 0 3 409.578 4.251 20 0 HIADHN C[C@@H](c1ccccc1)N(C)C(=O)CN1CCC[C@@H](c2n[nH]c(C3CCCCC3)n2)C1 ZINC000538664894 938678805 /nfs/dbraw/zinc/67/88/05/938678805.db2.gz CGSYUXZMBCHGFS-GHTZIAJQSA-N 0 3 409.578 4.251 20 0 HIADHN CCOc1cc(CN2CC[C@@H]2Cc2ccccc2)ccc1OCC(=O)N1CCCCC1 ZINC000538722376 938691242 /nfs/dbraw/zinc/69/12/42/938691242.db2.gz MVNSXLLSDMJPSG-HSZRJFAPSA-N 0 3 422.569 4.294 20 0 HIADHN CCCOc1c(Br)cc(CN2CC[C@@H](C3CCOCC3)C2)cc1OC ZINC000538723939 938691918 /nfs/dbraw/zinc/69/19/18/938691918.db2.gz HPMLXYHXDGWJGD-QGZVFWFLSA-N 0 3 412.368 4.495 20 0 HIADHN CN(Cc1c[nH]nc1-c1ccc(Cl)cc1)C[C@H](c1cccs1)N1CCOCC1 ZINC000538734319 938696452 /nfs/dbraw/zinc/69/64/52/938696452.db2.gz QXSOQJYBEOPSSY-LJQANCHMSA-N 0 3 416.978 4.297 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)c1cnn(-c2ccccc2)c1C(F)(F)F ZINC000563476991 945196860 /nfs/dbraw/zinc/19/68/60/945196860.db2.gz RTIVTNJJGOUVQZ-MRXNPFEDSA-N 0 3 416.447 4.141 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)c(C)c1CN1CCC(CN2CCCCC2=O)CC1 ZINC000538738102 938697636 /nfs/dbraw/zinc/69/76/36/938697636.db2.gz YWIQBJRURYUUAM-UHFFFAOYSA-N 0 3 414.981 4.367 20 0 HIADHN COC(=O)CCn1nc(C)c(CN2CCC(c3ccccc3C(F)(F)F)CC2)c1C ZINC000538749718 938700772 /nfs/dbraw/zinc/70/07/72/938700772.db2.gz BYYRAWOQYALRNB-UHFFFAOYSA-N 0 3 423.479 4.461 20 0 HIADHN CNS(=O)(=O)c1cccc([C@@H](C)N[C@H]2CCCc3ccc(Br)cc32)c1 ZINC000538868640 938728592 /nfs/dbraw/zinc/72/85/92/938728592.db2.gz BXPJYWXMDAJLBG-YJYMSZOUSA-N 0 3 423.376 4.085 20 0 HIADHN CS(=O)(=O)Cc1cccc(CN[C@H]2CCCc3ccc(Br)cc32)c1 ZINC000538869323 938728726 /nfs/dbraw/zinc/72/87/26/938728726.db2.gz OGNKUXMMIQZLLJ-IBGZPJMESA-N 0 3 408.361 4.161 20 0 HIADHN COCCn1ccc2ccc(NC(=O)N(C)[C@H]3CCN(Cc4ccccc4)C3)cc21 ZINC000538900448 938733430 /nfs/dbraw/zinc/73/34/30/938733430.db2.gz CIICVTXRYZBLLM-QFIPXVFZSA-N 0 3 406.530 4.026 20 0 HIADHN COCCn1ccc2ccc(NC(=O)N[C@@H]3CCN([C@@H](C)c4ccccc4)C3)cc21 ZINC000538906473 938735521 /nfs/dbraw/zinc/73/55/21/938735521.db2.gz ODRAIJNBRBMNER-PGRDOPGGSA-N 0 3 406.530 4.245 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(N3CCC(CC[N@@H+](CC)CC4CC4)CC3)nc2)n1 ZINC000538925321 938738555 /nfs/dbraw/zinc/73/85/55/938738555.db2.gz TVHWTEJGFNGQLL-UHFFFAOYSA-N 0 3 409.578 4.145 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(N3CCC(CC[N@H+](CC)CC4CC4)CC3)nc2)n1 ZINC000538925321 938738558 /nfs/dbraw/zinc/73/85/58/938738558.db2.gz TVHWTEJGFNGQLL-UHFFFAOYSA-N 0 3 409.578 4.145 20 0 HIADHN C[C@@H](CC(=O)Nc1ccc2oc(=O)n(CCN(C)C)c2c1)Cc1ccc(Cl)cc1 ZINC000538955756 938748562 /nfs/dbraw/zinc/74/85/62/938748562.db2.gz LWTDKKIQZWTDIY-OAHLLOKOSA-N 0 3 415.921 4.017 20 0 HIADHN CC[C@H](NCc1ccc(CS(=O)(=O)NC(C)C)cc1)c1cc(C)ccc1OC ZINC000538987004 938760380 /nfs/dbraw/zinc/76/03/80/938760380.db2.gz NFMCVEWURFNEEK-NRFANRHFSA-N 0 3 404.576 4.072 20 0 HIADHN C[C@@H](CN[C@@H](C)c1ccc(-n2cncn2)cc1Cl)c1nc(-c2ccccc2)no1 ZINC000539052050 938784214 /nfs/dbraw/zinc/78/42/14/938784214.db2.gz DUIHWIADVQTJAM-GJZGRUSLSA-N 0 3 408.893 4.425 20 0 HIADHN COc1ccc([C@@H](C)[NH2+]Cc2nnc(-c3ccc(Br)cc3)[n-]2)cc1OC ZINC000539054203 938785009 /nfs/dbraw/zinc/78/50/09/938785009.db2.gz DUMZCYAWYHADDU-GFCCVEGCSA-N 0 3 417.307 4.102 20 0 HIADHN CC[C@@H]([NH2+]Cc1nnc(-c2ccc(Br)cc2)[n-]1)c1ccc(OC)cc1 ZINC000539056371 938785902 /nfs/dbraw/zinc/78/59/02/938785902.db2.gz IRMJVSVHMPJCGM-QGZVFWFLSA-N 0 3 401.308 4.484 20 0 HIADHN CC[C@@H](NCc1nnc(-c2ccc(Br)cc2)[nH]1)c1ccc(OC)cc1 ZINC000539056371 938785906 /nfs/dbraw/zinc/78/59/06/938785906.db2.gz IRMJVSVHMPJCGM-QGZVFWFLSA-N 0 3 401.308 4.484 20 0 HIADHN C[C@@H](CC(=O)N(C)Cc1cccc(Cl)c1)NCc1cccc2c1OCCCO2 ZINC000539057620 938786674 /nfs/dbraw/zinc/78/66/74/938786674.db2.gz CTSBQKSXKJYXPX-INIZCTEOSA-N 0 3 402.922 4.028 20 0 HIADHN C[C@H](NCc1ccccc1OCc1ccccc1)c1ccc(NS(C)(=O)=O)cc1 ZINC000539066927 938791012 /nfs/dbraw/zinc/79/10/12/938791012.db2.gz MKQWISXULHZXGN-SFHVURJKSA-N 0 3 410.539 4.488 20 0 HIADHN Cc1c([C@@H](C)NCCCc2nc(-c3ccncc3)cs2)nnn1-c1ccccc1 ZINC000539082872 938798929 /nfs/dbraw/zinc/79/89/29/938798929.db2.gz BZJCSWUHKPTNCL-MRXNPFEDSA-N 0 3 404.543 4.378 20 0 HIADHN COCCOc1ccc([C@H](C)N[C@H](c2ccc3c(c2)OCCO3)C2CC2)cc1OC ZINC000539089749 938800375 /nfs/dbraw/zinc/80/03/75/938800375.db2.gz GIOPXHPZBPYTTA-FYSMJZIKSA-N 0 3 413.514 4.294 20 0 HIADHN C[C@@H](NCc1cccc(C(=O)NCc2ccco2)c1)c1ccc(-n2cccn2)cc1 ZINC000539090233 938800738 /nfs/dbraw/zinc/80/07/38/938800738.db2.gz KWVGKYFIUSLNHR-GOSISDBHSA-N 0 3 400.482 4.246 20 0 HIADHN C[C@@H]1CC[C@@H](NCc2ccccc2OCC(=O)NC[C@@H]2CCCO2)c2ccccc21 ZINC000539091759 938801408 /nfs/dbraw/zinc/80/14/08/938801408.db2.gz WHSJMAIGKCQACS-QMHWCDLVSA-N 0 3 408.542 4.089 20 0 HIADHN COc1cc(CN[C@@H]2CCCCc3ccc(Cl)cc32)ccc1OCC(=O)N(C)C ZINC000539092578 938801656 /nfs/dbraw/zinc/80/16/56/938801656.db2.gz BSBDZFIXUJTOHS-HXUWFJFHSA-N 0 3 416.949 4.373 20 0 HIADHN CC[C@H](NCc1ccc(C(=O)N2C[C@@H](C)O[C@@H](C)C2)cc1)c1cc(C)ccc1OC ZINC000539093668 938801869 /nfs/dbraw/zinc/80/18/69/938801869.db2.gz PLAGBVHTKVFLSQ-YYDVJCTNSA-N 0 3 410.558 4.494 20 0 HIADHN C[C@@H](NCCCNC(=O)C1CCC1)c1ccc(Br)cc1Br ZINC000539122675 938806308 /nfs/dbraw/zinc/80/63/08/938806308.db2.gz SVWNKJXDOIPMQY-LLVKDONJSA-N 0 3 418.173 4.169 20 0 HIADHN CCCN1c2ccc(NC(=O)N[C@H]3C[C@H](C)N(Cc4ccccc4)C3)cc2CCC1=O ZINC000539130781 938808145 /nfs/dbraw/zinc/80/81/45/938808145.db2.gz OKGPDALXNACYPD-AVRDEDQJSA-N 0 3 420.557 4.160 20 0 HIADHN CCCN1c2ccc(NC(=O)N[C@H]3CCCN(Cc4ccccc4)C3)cc2CCC1=O ZINC000539132526 938808393 /nfs/dbraw/zinc/80/83/93/938808393.db2.gz TVPVZRHZNSCRBB-QFIPXVFZSA-N 0 3 420.557 4.162 20 0 HIADHN CNS(=O)(=O)c1cccc(CN[C@@H](c2ccc(C(F)(F)F)cc2)C(C)C)c1 ZINC000539162743 938814234 /nfs/dbraw/zinc/81/42/34/938814234.db2.gz HBTVTSJBIPXKHA-GOSISDBHSA-N 0 3 400.466 4.100 20 0 HIADHN COc1cc(OC)cc(N2CC[C@@H](N[C@@H](C)c3nc4ccc(Cl)cc4n3C)C2)c1 ZINC000539214099 938819655 /nfs/dbraw/zinc/81/96/55/938819655.db2.gz YHKPFPLHJYCOHP-GOEBONIOSA-N 0 3 414.937 4.173 20 0 HIADHN CCOc1ccc([C@@H](C)NC(=O)CCCN[C@@H](C)c2nc3ccccc3n2C)cc1 ZINC000539216253 938819775 /nfs/dbraw/zinc/81/97/75/938819775.db2.gz BIYFCKSKSDESQH-MSOLQXFVSA-N 0 3 408.546 4.280 20 0 HIADHN COc1cc(CN[C@@H](c2ccc(Cl)cc2)C2CC2)ccc1OCC(=O)N(C)C ZINC000539214862 938819831 /nfs/dbraw/zinc/81/98/31/938819831.db2.gz XVVKFFLJCZHTRY-JOCHJYFZSA-N 0 3 402.922 4.057 20 0 HIADHN COc1ccc(OCCN[C@H](CN2CCCC2=O)c2cccc(C(F)(F)F)c2)cc1 ZINC000539221352 938820770 /nfs/dbraw/zinc/82/07/70/938820770.db2.gz ZQRYJWREOGDQJK-HXUWFJFHSA-N 0 3 422.447 4.046 20 0 HIADHN CC(C)c1ccc([C@H](NCC(=O)NCc2cccc(C(=O)NC3CC3)c2)C(C)C)cc1 ZINC000539241954 938824006 /nfs/dbraw/zinc/82/40/06/938824006.db2.gz OMBRIPAKWZEXPR-RUZDIDTESA-N 0 3 421.585 4.305 20 0 HIADHN Cc1ccccc1[C@@H](NCC(=O)N1CCC(C(=O)Nc2ccccc2)CC1)C(C)C ZINC000539261499 938829195 /nfs/dbraw/zinc/82/91/95/938829195.db2.gz QQQXHTWHBJLIAF-DEOSSOPVSA-N 0 3 407.558 4.159 20 0 HIADHN O=S(=O)(CCN[C@H](c1ccc(Br)cc1)C1CCC1)c1ccccc1 ZINC000539278576 938832074 /nfs/dbraw/zinc/83/20/74/938832074.db2.gz CMPZGEAQSDWSRM-IBGZPJMESA-N 0 3 408.361 4.354 20 0 HIADHN Cc1ccc2nc(CN[C@@H](c3ccc(Br)cc3)C3CCC3)cc(=O)n2c1 ZINC000539279355 938832363 /nfs/dbraw/zinc/83/23/63/938832363.db2.gz NBDCGRIKLDTHND-OAQYLSRUSA-N 0 3 412.331 4.396 20 0 HIADHN CCOc1ccc([C@@H]2CCCN2C(=O)CN[C@@H](CC)c2ccc3c(c2)OCCO3)cc1 ZINC000539279847 938832751 /nfs/dbraw/zinc/83/27/51/938832751.db2.gz LZMDVACRSQFENG-VXKWHMMOSA-N 0 3 424.541 4.261 20 0 HIADHN C[C@H](NC(=O)CN[C@@H](c1ccccc1)[C@H]1CCOC1)c1ccc(OC(F)(F)F)cc1 ZINC000539290371 938834385 /nfs/dbraw/zinc/83/43/85/938834385.db2.gz ZNOGULJRBIXNAQ-XERREHJYSA-N 0 3 422.447 4.130 20 0 HIADHN C[C@H](NC[C@H]1CC[C@H](C(=O)N(C)C)O1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000539295693 938835674 /nfs/dbraw/zinc/83/56/74/938835674.db2.gz QQYHFYZRCYDCQH-COLVAYQJSA-N 0 3 412.374 4.011 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(NC(=O)c2ccncc2)cc1)C(=O)NCCC1=CCCCC1 ZINC000539298309 938836245 /nfs/dbraw/zinc/83/62/45/938836245.db2.gz ORVGMPYXQKPQTF-RBUKOAKNSA-N 0 3 420.557 4.380 20 0 HIADHN COc1ccc(NC(=O)[C@@H](C)N[C@@H](C)c2ccc(NC(=O)c3ccncc3)cc2)cc1 ZINC000539299941 938836449 /nfs/dbraw/zinc/83/64/49/938836449.db2.gz OJVJYOXLPRZRHI-DLBZAZTESA-N 0 3 418.497 4.020 20 0 HIADHN COC(=O)c1ccc(CNC(=O)[C@@H](C)N[C@H](C)c2ccc(SC(C)C)cc2)cc1 ZINC000539300415 938836749 /nfs/dbraw/zinc/83/67/49/938836749.db2.gz GICCQRHOLOXXAD-IAGOWNOFSA-N 0 3 414.571 4.329 20 0 HIADHN CC(C)(C)[C@@H](NCC(=O)NCC(=O)c1cccs1)c1cccc(C(F)(F)F)c1 ZINC000539302016 938837049 /nfs/dbraw/zinc/83/70/49/938837049.db2.gz WUPZNHNQXQNOBX-SFHVURJKSA-N 0 3 412.477 4.443 20 0 HIADHN CC(C)[C@H](NCCC(=O)Nc1ccc(N2CCCC2=O)cc1)c1ccc(F)cc1F ZINC000539325001 938841558 /nfs/dbraw/zinc/84/15/58/938841558.db2.gz FFEBLDJVCMRMOG-QHCPKHFHSA-N 0 3 415.484 4.407 20 0 HIADHN O=C(CN[C@@H](C[C@@H]1CCOC1)c1ccccc1)Nc1ccc2c(c1)OC1(CCCC1)O2 ZINC000539325260 938841706 /nfs/dbraw/zinc/84/17/06/938841706.db2.gz GLTOUYMPYHCOGN-RXVVDRJESA-N 0 3 422.525 4.424 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)N(C)Cc1nc2ccccc2s1)c1ccc(-n2cccn2)cc1 ZINC000539336349 938844169 /nfs/dbraw/zinc/84/41/69/938844169.db2.gz IGEQCDLPRAQBJD-SJORKVTESA-N 0 3 419.554 4.180 20 0 HIADHN C[C@@H](NCC(=O)N(Cc1ccccc1)[C@@H](C)C1CC1)c1ccc(-n2cccn2)cc1 ZINC000539337340 938844405 /nfs/dbraw/zinc/84/44/05/938844405.db2.gz POBNEELEIANEES-UXHICEINSA-N 0 3 402.542 4.350 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)Nc1ccccc1Br)c1ccc(-n2cccn2)cc1 ZINC000539337129 938844467 /nfs/dbraw/zinc/84/44/67/938844467.db2.gz ONDQJTQXAJVIBB-CABCVRRESA-N 0 3 413.319 4.313 20 0 HIADHN CC[C@@H](NCC(=O)Nc1cccc(CN2CCSCC2)c1)c1cc(F)ccc1F ZINC000539360634 938848381 /nfs/dbraw/zinc/84/83/81/938848381.db2.gz NABCJJBWPQIKRI-OAQYLSRUSA-N 0 3 419.541 4.193 20 0 HIADHN Cc1cc(NC(=O)c2cc(=O)[nH]c(C(C)C)c2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000539370081 938850100 /nfs/dbraw/zinc/85/01/00/938850100.db2.gz DAVVVQATMHEWSQ-HXUWFJFHSA-N 0 3 419.529 4.115 20 0 HIADHN Cc1ccc(NC(=O)NC(=O)[C@@H](C)N[C@H](C)c2cccc(N3CCCC3)c2)c(C)c1 ZINC000539379319 938851867 /nfs/dbraw/zinc/85/18/67/938851867.db2.gz QBIXOHMIFRWFLO-RTBURBONSA-N 0 3 408.546 4.291 20 0 HIADHN CC[C@H](NCc1csc(-c2c(C)c(C)nn(C)c2=O)n1)C(C)(C)c1ccccc1 ZINC000539424889 938858739 /nfs/dbraw/zinc/85/87/39/938858739.db2.gz PQRCQTKVYYDQOW-IBGZPJMESA-N 0 3 410.587 4.367 20 0 HIADHN COc1ccc([C@H](Cc2ccncc2)NCc2cc(F)ccc2N2CCOCC2)cc1 ZINC000563523870 945210257 /nfs/dbraw/zinc/21/02/57/945210257.db2.gz XIZPEHBKJGWLIK-DEOSSOPVSA-N 0 3 421.516 4.140 20 0 HIADHN COc1cccc(-c2nn(C(C)(C)C)cc2CNCc2ccnc(-n3cccn3)c2)c1 ZINC000539447873 938862129 /nfs/dbraw/zinc/86/21/29/938862129.db2.gz KLVNEBZOPPCXAH-UHFFFAOYSA-N 0 3 416.529 4.184 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)c1nnc(C(C)(C)C)s1 ZINC000539448022 938862178 /nfs/dbraw/zinc/86/21/78/938862178.db2.gz MHAOACFIHWPXND-UHFFFAOYSA-N 0 3 414.497 4.058 20 0 HIADHN CC(C)N(CCCn1ccnc1)CC(=O)Nc1ccc(Cl)cc1C(F)(F)F ZINC000539451772 938862723 /nfs/dbraw/zinc/86/27/23/938862723.db2.gz WOEGXVMHIHHRMX-UHFFFAOYSA-N 0 3 402.848 4.295 20 0 HIADHN COC(=O)[C@H]1CCCC[C@]1(C)NCc1ccnc(-c2ccc(Br)cc2)n1 ZINC000539479090 938866450 /nfs/dbraw/zinc/86/64/50/938866450.db2.gz FBUOSMLWVIOCCQ-XLIONFOSSA-N 0 3 418.335 4.118 20 0 HIADHN C[C@H](c1cc2ccccc2o1)N(C)C(=O)CN[C@H](c1ccc2c(c1)OCCO2)C1CC1 ZINC000539493267 938868248 /nfs/dbraw/zinc/86/82/48/938868248.db2.gz QRBCSXRVXICCAF-CPJLOUKISA-N 0 3 420.509 4.464 20 0 HIADHN COCCNS(=O)(=O)c1ccc(CN[C@H](CC(C)(C)C)c2ccc(F)cc2)cc1 ZINC000539499111 938869103 /nfs/dbraw/zinc/86/91/03/938869103.db2.gz BMBUGMVJYUEXJX-OAQYLSRUSA-N 0 3 422.566 4.018 20 0 HIADHN COc1cc(CN[C@@H]2CCN(C(C)=O)c3ccccc32)ccc1OCc1ccncc1 ZINC000539528802 938874053 /nfs/dbraw/zinc/87/40/53/938874053.db2.gz IQTQSRMKJWVVRD-JOCHJYFZSA-N 0 3 417.509 4.257 20 0 HIADHN CCN1CCN(c2ccccc2N[C@H](C)c2ccc(OCc3nccn3C)cc2)CC1 ZINC000539646330 938893009 /nfs/dbraw/zinc/89/30/09/938893009.db2.gz LSVWKFKKFIYWBJ-HXUWFJFHSA-N 0 3 419.573 4.314 20 0 HIADHN CC1CCN([C@@H](CNC(=O)N2CCCC[C@H]2c2ccnn2C)c2ccccc2)CC1 ZINC000539712707 938909518 /nfs/dbraw/zinc/90/95/18/938909518.db2.gz MJUJVOKJRCQXDJ-GOTSBHOMSA-N 0 3 409.578 4.130 20 0 HIADHN O=C(CCN1CCC(C(=O)Nc2ccccc2Br)CC1)c1ccccc1 ZINC000539719615 938912112 /nfs/dbraw/zinc/91/21/12/938912112.db2.gz RAERTABAEPFKEB-UHFFFAOYSA-N 0 3 415.331 4.373 20 0 HIADHN C[C@@H](NC(=O)CN1CCC[C@@H](c2n[nH]c(C3CCCCC3)n2)C1)c1ccc(F)cc1 ZINC000539763714 938928205 /nfs/dbraw/zinc/92/82/05/938928205.db2.gz XONPUKSWGMOVDO-VQIMIIECSA-N 0 3 413.541 4.048 20 0 HIADHN Cc1cccc(NC2CCN(Cc3ccccc3OCC(=O)N3CCCC3)CC2)c1 ZINC000539819155 938942979 /nfs/dbraw/zinc/94/29/79/938942979.db2.gz ZLTRFAAGXFHYSB-UHFFFAOYSA-N 0 3 407.558 4.073 20 0 HIADHN CCO[C@@H]1C[C@H](O)C12CCN(Cc1ccc(OCc3cccs3)c(OC)c1)CC2 ZINC000539819819 938943006 /nfs/dbraw/zinc/94/30/06/938943006.db2.gz VSKYCOFRYMTCNP-FCHUYYIVSA-N 0 3 417.571 4.088 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)c3cc4ccc(C(F)(F)F)cc4[nH]3)CC2)C[C@H](C)O1 ZINC000539841235 938954761 /nfs/dbraw/zinc/95/47/61/938954761.db2.gz MGWKOPPKDDSFED-GJZGRUSLSA-N 0 3 423.479 4.148 20 0 HIADHN COc1c(Br)cc(CN(C)CCc2nccs2)cc1Br ZINC000539863003 938960896 /nfs/dbraw/zinc/96/08/96/938960896.db2.gz SOPLKSHXPABQMP-UHFFFAOYSA-N 0 3 420.170 4.351 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)CCc2c[nH]c3c2cccc3C)cc1 ZINC000539931001 938978644 /nfs/dbraw/zinc/97/86/44/938978644.db2.gz HDVICTRJIABAFZ-QHCPKHFHSA-N 0 3 405.542 4.371 20 0 HIADHN COC(=O)COc1c(C)cc(CNc2ccccc2CN2CCSCC2)cc1C ZINC000539936052 938979222 /nfs/dbraw/zinc/97/92/22/938979222.db2.gz SYTUSLMTXOYEOF-UHFFFAOYSA-N 0 3 414.571 4.016 20 0 HIADHN O=C(Nc1nccs1)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1 ZINC000539952424 938980954 /nfs/dbraw/zinc/98/09/54/938980954.db2.gz BRLYVVUMRNQCOH-UHFFFAOYSA-N 0 3 407.543 4.152 20 0 HIADHN COCCn1ccc2ccc(NC(=O)NC[C@H]3CCCN3Cc3ccccc3)cc21 ZINC000540001926 939034987 /nfs/dbraw/zinc/03/49/87/939034987.db2.gz QAJASBUZHGLQFS-JOCHJYFZSA-N 0 3 406.530 4.074 20 0 HIADHN COc1cc(CNCc2cn(C)nc2-c2ccccc2)cc(Br)c1OC ZINC000540071791 939058441 /nfs/dbraw/zinc/05/84/41/939058441.db2.gz SKIOUALYNXGKPO-UHFFFAOYSA-N 0 3 416.319 4.157 20 0 HIADHN CC(C)Cn1cc(NC(=O)NC[C@H](c2ccccc2)N2CCCC2)c(C(F)F)n1 ZINC000540115398 939078008 /nfs/dbraw/zinc/07/80/08/939078008.db2.gz WILYTFGDSVCBHW-GOSISDBHSA-N 0 3 405.493 4.435 20 0 HIADHN Cc1c([C@H](C)N[C@H]2CCO[C@H](C(C)C)C2)nnn1-c1cccc(Br)c1 ZINC000540137378 939086799 /nfs/dbraw/zinc/08/67/99/939086799.db2.gz BRUYMESWROAOCH-OWQGQXMQSA-N 0 3 407.356 4.192 20 0 HIADHN CCN(CC)C(=O)Nc1ccc([C@@H](C)NCc2ccc(C(=O)OC)c(OC)c2)cc1 ZINC000540140177 939088043 /nfs/dbraw/zinc/08/80/43/939088043.db2.gz IRRYDRHLUPGBEW-MRXNPFEDSA-N 0 3 413.518 4.206 20 0 HIADHN C[C@H](N[C@H]1CCN(C)[C@@H]1c1ccc(F)c(F)c1)c1ccc(-n2cncn2)cc1Cl ZINC000540144512 939089889 /nfs/dbraw/zinc/08/98/89/939089889.db2.gz YZOLBGQQZZYYOZ-SKOKVVANSA-N 0 3 417.891 4.295 20 0 HIADHN Cc1ccc([C@@H](Cn2ccnc2)N[C@@H](C)c2cccc(N3CCOCC3)c2)c(C)c1 ZINC000540146204 939090663 /nfs/dbraw/zinc/09/06/63/939090663.db2.gz AZSHOASQYCHMLH-SQJMNOBHSA-N 0 3 404.558 4.429 20 0 HIADHN OCC1(CN[C@H](Cc2ccccc2F)c2ccccc2Br)CCOCC1 ZINC000540146538 939091409 /nfs/dbraw/zinc/09/14/09/939091409.db2.gz HWTJXCCOTDEQFM-HXUWFJFHSA-N 0 3 422.338 4.251 20 0 HIADHN Cc1ccc(-c2nc3c(s2)[C@H](N[C@H]2CCN(CC(F)(F)F)C2=O)CCC3)cc1 ZINC000540174632 939104693 /nfs/dbraw/zinc/10/46/93/939104693.db2.gz MQECGLQQRNASEG-ZBFHGGJFSA-N 0 3 409.477 4.249 20 0 HIADHN O=C(CCCN[C@@H]1CCc2c1c(Br)ccc2F)N1Cc2ccccc2C1 ZINC000540178864 939106957 /nfs/dbraw/zinc/10/69/57/939106957.db2.gz PQGNPWNUNAPQSJ-LJQANCHMSA-N 0 3 417.322 4.488 20 0 HIADHN CC[C@H](N[C@H](c1cccc(S(C)(=O)=O)c1)c1cc(F)ccc1F)C1CCOCC1 ZINC000540188402 939113595 /nfs/dbraw/zinc/11/35/95/939113595.db2.gz JIBOBIUBDHEVGP-FCHUYYIVSA-N 0 3 423.525 4.253 20 0 HIADHN CCOc1ccc([C@@H](C)N[C@@H](C)c2ccc(NS(C)(=O)=O)cc2)cc1OCC ZINC000540190208 939115005 /nfs/dbraw/zinc/11/50/05/939115005.db2.gz GVGHLKMWUWMPPP-JKSUJKDBSA-N 0 3 406.548 4.267 20 0 HIADHN CC(C)C(=O)Nc1ccc(CN[C@H](C)c2ccc(OCc3nccn3C)cc2)cc1 ZINC000540192167 939116888 /nfs/dbraw/zinc/11/68/88/939116888.db2.gz BJCNDPRHZLOIHI-GOSISDBHSA-N 0 3 406.530 4.444 20 0 HIADHN CCN1CCCN(C(=O)Nc2c(C)c(C)nn2-c2ccc(Cl)c(Cl)c2)CC1 ZINC000540246815 939165036 /nfs/dbraw/zinc/16/50/36/939165036.db2.gz ITPPUQQLYNCXKV-UHFFFAOYSA-N 0 3 410.349 4.355 20 0 HIADHN CO[C@@H](c1ccc(Br)cc1)[C@H](C)NC(=O)c1cccc(CN(C)C)c1 ZINC000540256484 939173960 /nfs/dbraw/zinc/17/39/60/939173960.db2.gz LQTZKAGANRGHHQ-IFXJQAMLSA-N 0 3 405.336 4.017 20 0 HIADHN CCc1cnccc1[C@H](C)NC(=O)N(CCN(C)C)Cc1ccc(C(F)(F)F)cc1 ZINC000540306728 939188516 /nfs/dbraw/zinc/18/85/16/939188516.db2.gz CCOYNFAQVRAERX-INIZCTEOSA-N 0 3 422.495 4.497 20 0 HIADHN CN(CCN[C@@H](c1cccc(C(F)(F)F)c1)C1CC1)S(=O)(=O)c1cccs1 ZINC000540317087 939192164 /nfs/dbraw/zinc/19/21/64/939192164.db2.gz ZLAIAEVBYUZVCA-QGZVFWFLSA-N 0 3 418.506 4.128 20 0 HIADHN O=C1CCCN1C[C@@H](NCc1c(-c2ccccc2)nc2ccccn21)c1ccccc1 ZINC000540319703 939192544 /nfs/dbraw/zinc/19/25/44/939192544.db2.gz RSRDCRUYVZWCBY-JOCHJYFZSA-N 0 3 410.521 4.455 20 0 HIADHN O=C1CCCN1C[C@H](NCCOc1ccc(F)cc1)c1cccc(C(F)(F)F)c1 ZINC000540322895 939194355 /nfs/dbraw/zinc/19/43/55/939194355.db2.gz SKWHZINNAAUOMV-IBGZPJMESA-N 0 3 410.411 4.177 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(OCc2cccnc2)cc1)C(=O)Nc1ccc2c(c1)OCO2 ZINC000540325428 939195242 /nfs/dbraw/zinc/19/52/42/939195242.db2.gz HHXXNSDKOKISPY-IAGOWNOFSA-N 0 3 419.481 4.067 20 0 HIADHN CC(C)C[C@@H](NCC(=O)N1CCC(C(=O)Nc2ccccc2)CC1)c1ccccc1 ZINC000540342777 939200668 /nfs/dbraw/zinc/20/06/68/939200668.db2.gz IRGJIAUHEKTVOW-HSZRJFAPSA-N 0 3 407.558 4.241 20 0 HIADHN C[C@@H](N[C@@H](C)c1cccc(OCc2ccccn2)c1)C(=O)N1CCc2ccccc2C1 ZINC000540353639 939204808 /nfs/dbraw/zinc/20/48/08/939204808.db2.gz ZECWUDOAPCDIJT-VQTJNVASSA-N 0 3 415.537 4.285 20 0 HIADHN C[C@H](NCC(=O)N1CC[C@H](C)Sc2ccccc21)c1ccccc1-n1cccn1 ZINC000540361252 939209108 /nfs/dbraw/zinc/20/91/08/939209108.db2.gz UVBAOTTVTVUZAT-ROUUACIJSA-N 0 3 406.555 4.440 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)N(C)Cc1cccc(F)c1)c1ccc(OCC(F)(F)F)cc1 ZINC000540361528 939210192 /nfs/dbraw/zinc/21/01/92/939210192.db2.gz IBTROCROJDMZRI-CABCVRRESA-N 0 3 412.427 4.465 20 0 HIADHN CCOc1ccc2nc(NC(=O)CN[C@@H](c3ccccc3)[C@H]3CCOC3)sc2c1 ZINC000540388289 939225300 /nfs/dbraw/zinc/22/53/00/939225300.db2.gz PRLGZAAZJGIMNE-KKSFZXQISA-N 0 3 411.527 4.001 20 0 HIADHN O=C(CN[C@H](c1ccccc1)[C@@H]1CCOC1)N[C@@H](Cc1ccccc1)c1ccccc1 ZINC000540389977 939226767 /nfs/dbraw/zinc/22/67/67/939226767.db2.gz LBASRISBVQEWOY-CMTIAEDTSA-N 0 3 414.549 4.454 20 0 HIADHN O=C(CN[C@H](c1ccccc1)[C@@H]1CCOC1)Nc1cc(C2CC2)nn1-c1ccccc1 ZINC000540389552 939227820 /nfs/dbraw/zinc/22/78/20/939227820.db2.gz OEWMQPLDNPMQRX-CJFMBICVSA-N 0 3 416.525 4.056 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)N[C@H]2CCO[C@H]2c2ccc(Cl)cc2)CC1 ZINC000540391688 939230036 /nfs/dbraw/zinc/23/00/36/939230036.db2.gz IQHQXSKZKVRSBI-SFTDATJTSA-N 0 3 417.937 4.069 20 0 HIADHN CN(C(=O)N[C@@H]1CCO[C@@H]1c1ccc(Cl)cc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000540393268 939231982 /nfs/dbraw/zinc/23/19/82/939231982.db2.gz ROVVPXGUIXFSTH-YPAWHYETSA-N 0 3 413.949 4.086 20 0 HIADHN CN(Cc1c(F)cccc1Cl)C(=O)CN[C@H](C[C@H]1CCOC1)c1ccccc1 ZINC000540433873 939247644 /nfs/dbraw/zinc/24/76/44/939247644.db2.gz AAIRSLQGDKPWBN-IIBYNOLFSA-N 0 3 404.913 4.195 20 0 HIADHN CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H](Cc2ccccc2)c2ccccc2F)cc1 ZINC000540458352 939259578 /nfs/dbraw/zinc/25/95/78/939259578.db2.gz OBNDMCPRAVRMBN-BWKNWUBXSA-N 0 3 422.500 4.097 20 0 HIADHN Cc1cc(NC(=O)CN[C@H](c2ccccc2C)C(C)(C)C)n(-c2nc(C)cc(C)n2)n1 ZINC000540459619 939260260 /nfs/dbraw/zinc/26/02/60/939260260.db2.gz NWLOSLXDGMLEPT-JOCHJYFZSA-N 0 3 420.561 4.211 20 0 HIADHN COc1cc(N[C@H]2CCCN(Cc3cn(C)nc3-c3cccs3)C2)cc(OC)c1 ZINC000540503843 939280034 /nfs/dbraw/zinc/28/00/34/939280034.db2.gz QAWYEFIJVQTAJE-KRWDZBQOSA-N 0 3 412.559 4.242 20 0 HIADHN COc1ccc(CNC(=O)[C@H](C)N[C@H](c2ccc(Cl)cc2)[C@@H]2C[C@@H]2C)cc1OC ZINC000540523169 939286616 /nfs/dbraw/zinc/28/66/16/939286616.db2.gz LWSIBLGFRFGBLI-RMVFTWNNSA-N 0 3 416.949 4.349 20 0 HIADHN COc1ccc([C@H](NCCN2c3cccc4cccc(c34)S2(=O)=O)C2CC2)cc1 ZINC000540588770 939312299 /nfs/dbraw/zinc/31/22/99/939312299.db2.gz FXVGXEHCGORCEQ-HSZRJFAPSA-N 0 3 408.523 4.098 20 0 HIADHN C[C@H](NC(=O)CN[C@H](c1ccc2c(c1)OCCO2)C1CC1)c1ccccc1Cl ZINC000540589833 939312799 /nfs/dbraw/zinc/31/27/99/939312799.db2.gz BDXZCBJMWAHDOQ-FPTDNZKUSA-N 0 3 400.906 4.029 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)Nc2ccnc(OCC(F)(F)F)c2)CC1 ZINC000540685884 939338886 /nfs/dbraw/zinc/33/88/86/939338886.db2.gz SPWFXSAPNALEJN-UHFFFAOYSA-N 0 3 422.451 4.151 20 0 HIADHN COc1ccc(NC(=O)C[C@H](C)N[C@@H]2CCCOc3cc(F)ccc32)c(OC)c1 ZINC000540778590 939369193 /nfs/dbraw/zinc/36/91/93/939369193.db2.gz LRXKHIJNKIIBIK-KBXCAEBGSA-N 0 3 402.466 4.064 20 0 HIADHN C[C@@H]1CN(Cc2ccccn2)CC[C@H]1Nc1cccc(I)c1 ZINC000540818212 939382922 /nfs/dbraw/zinc/38/29/22/939382922.db2.gz JFRFEYFVPNEDHO-RDTXWAMCSA-N 0 3 407.299 4.009 20 0 HIADHN CC(=O)N(c1nc(CNCCN2CCCC2)cs1)c1ccc(C(F)(F)F)cc1 ZINC000540888164 939410282 /nfs/dbraw/zinc/41/02/82/939410282.db2.gz YVIKREGGVNWRIH-UHFFFAOYSA-N 0 3 412.481 4.032 20 0 HIADHN CC(C)NS(=O)(=O)Cc1ccccc1CN[C@@H](c1ccc(F)c(F)c1)C(C)C ZINC000540987265 939425189 /nfs/dbraw/zinc/42/51/89/939425189.db2.gz WEKSTXZZAYJAKS-OAQYLSRUSA-N 0 3 410.530 4.280 20 0 HIADHN COc1cc(CN[C@@H](C)c2ccc(NC(C)=O)cc2)cc(Br)c1OC ZINC000540988102 939425728 /nfs/dbraw/zinc/42/57/28/939425728.db2.gz GERPINQTNBCDAJ-LBPRGKRZSA-N 0 3 407.308 4.276 20 0 HIADHN COc1cc(C)c(CN2CCC[C@H](c3nnc4ccc(C(F)(F)F)cn43)C2)c(C)n1 ZINC000540998787 939428150 /nfs/dbraw/zinc/42/81/50/939428150.db2.gz JJVZXBDAECDINT-HNNXBMFYSA-N 0 3 419.451 4.148 20 0 HIADHN O=C(c1ccc(Oc2ccccc2)nc1)N1CCN(c2ccnc3ccccc32)CC1 ZINC000563691783 945252582 /nfs/dbraw/zinc/25/25/82/945252582.db2.gz RUGNJSRJHNWHEI-UHFFFAOYSA-N 0 3 410.477 4.385 20 0 HIADHN CCN(CC)C(=O)CCC1CCN(CC(=O)N(CC)[C@@H](C)c2ccc(F)cc2)CC1 ZINC000541085177 939454176 /nfs/dbraw/zinc/45/41/76/939454176.db2.gz QTPRSZOVMSLONB-IBGZPJMESA-N 0 3 419.585 4.096 20 0 HIADHN CCN(CC)C(=O)CCC1CCN([C@H](C(=O)N2CCCCC2)c2ccccc2)CC1 ZINC000541086311 939455204 /nfs/dbraw/zinc/45/52/04/939455204.db2.gz VWLIJYANBURECY-DEOSSOPVSA-N 0 3 413.606 4.101 20 0 HIADHN Cc1cc(C(C)(C)C)ccc1OC[C@H](O)CN[C@@H](C)c1ccc([S@@](C)=O)cc1 ZINC000541117882 939466725 /nfs/dbraw/zinc/46/67/25/939466725.db2.gz RFDGMZKWUVZJRQ-AZVSZNIFSA-N 0 3 403.588 4.120 20 0 HIADHN Cn1ccnc1COc1ccc(CN2CCC[C@@H](n3ccc(C(F)(F)F)n3)C2)cc1 ZINC000541127739 939470501 /nfs/dbraw/zinc/47/05/01/939470501.db2.gz ORTAWPYBPFKZOI-QGZVFWFLSA-N 0 3 419.451 4.052 20 0 HIADHN CN(Cc1ccc(Cl)c(Cl)c1)C(=O)CN1CCC(CCCn2ccnc2)CC1 ZINC000541202845 939485448 /nfs/dbraw/zinc/48/54/48/939485448.db2.gz NWCBSNDISIOMAG-UHFFFAOYSA-N 0 3 423.388 4.341 20 0 HIADHN COC(=O)c1cccc(NC(=O)C[C@H](C)N[C@@H](c2nc3ccccc3[nH]2)C(C)C)c1 ZINC000541217965 939486080 /nfs/dbraw/zinc/48/60/80/939486080.db2.gz IMDJVIIIGQUSMH-YCRPNKLZSA-N 0 3 408.502 4.054 20 0 HIADHN Cc1noc(C2CCC(NCc3cn(-c4ccc(Cl)c(Cl)c4)nn3)CC2)n1 ZINC000541382669 939501783 /nfs/dbraw/zinc/50/17/83/939501783.db2.gz AJPAASBCLUGESS-UHFFFAOYSA-N 0 3 407.305 4.082 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)[C@H]2CCn3c(cnc3C3CCCCC3)C2)C1 ZINC000541395236 939504365 /nfs/dbraw/zinc/50/43/65/939504365.db2.gz AJDMVHMIDWEMCD-WTIAFYNJSA-N 0 3 420.601 4.445 20 0 HIADHN CC(C)(C)CCN1CCN(C(=O)[C@H]2CCn3c(cnc3C3CCCCC3)C2)CC1 ZINC000541397469 939505334 /nfs/dbraw/zinc/50/53/34/939505334.db2.gz ILBVXXUHXPQWOG-FQEVSTJZSA-N 0 3 400.611 4.074 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)[C@@H]1CCn2c(cnc2C2CCCCC2)C1 ZINC000541398323 939505430 /nfs/dbraw/zinc/50/54/30/939505430.db2.gz IAWSRXFABSRCMJ-JOCHJYFZSA-N 0 3 420.601 4.058 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3cc(C)n([C@@H](C)C4CC4)n3)c(C)c2)CC1 ZINC000541461473 939524281 /nfs/dbraw/zinc/52/42/81/939524281.db2.gz OFSWNZPWFHYRAZ-SFHVURJKSA-N 0 3 410.566 4.257 20 0 HIADHN CC(C)Oc1c(F)cc(NC(=O)N(CCN(C)C)Cc2cccc(F)c2)cc1F ZINC000541464058 939525649 /nfs/dbraw/zinc/52/56/49/939525649.db2.gz SMSJDYCMGIODDR-UHFFFAOYSA-N 0 3 409.452 4.487 20 0 HIADHN CCc1ccc([C@H](CN2CCOCC2)NCc2ccc(OC)c(OC(F)F)c2)cc1 ZINC000541548695 939551743 /nfs/dbraw/zinc/55/17/43/939551743.db2.gz MLRVTKSRSUBXHZ-FQEVSTJZSA-N 0 3 420.500 4.022 20 0 HIADHN Cc1c([C@H](C)NCC[C@H]2CCO[C@@H](C)C2)nnn1-c1cccc(Br)c1 ZINC000541558143 939554975 /nfs/dbraw/zinc/55/49/75/939554975.db2.gz MGHRVMJISRXCLP-DZKIICNBSA-N 0 3 407.356 4.194 20 0 HIADHN CCOC(=O)c1ccc(N2CC(N[C@@H](C)c3sc(-c4ccccc4)nc3C)C2)nc1 ZINC000541569814 939557569 /nfs/dbraw/zinc/55/75/69/939557569.db2.gz AHHFOUNVGVBGTQ-HNNXBMFYSA-N 0 3 422.554 4.230 20 0 HIADHN COC[C@H](NCC(=O)N(Cc1ccccc1)c1nc2c(ccc(C)c2C)s1)C1CC1 ZINC000541617502 939572237 /nfs/dbraw/zinc/57/22/37/939572237.db2.gz OMMSBBHXWUHLCZ-FQEVSTJZSA-N 0 3 423.582 4.461 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N[C@H]2CCO[C@@H](c3ccc(F)cc3)C2)C1 ZINC000541619778 939572312 /nfs/dbraw/zinc/57/23/12/939572312.db2.gz WVIGHZSNVFMZLF-LMDOGRNLSA-N 0 3 411.521 4.181 20 0 HIADHN COC[C@H](NCC(=O)Nc1nc(-c2ccc(Cl)cc2Cl)cs1)C1CC1 ZINC000541620439 939573144 /nfs/dbraw/zinc/57/31/44/939573144.db2.gz OZXVUTXNTRLMRB-AWEZNQCLSA-N 0 3 400.331 4.070 20 0 HIADHN COc1cc2c(cc1OC)CN(C(=O)CN[C@H](CC(C)C)c1cccs1)CC2 ZINC000541627675 939574763 /nfs/dbraw/zinc/57/47/63/939574763.db2.gz VKCFJCSOWLTXDG-GOSISDBHSA-N 0 3 402.560 4.027 20 0 HIADHN Cc1ccc(Oc2ccccc2NC(=O)CN[C@H](CC(N)=O)C2CCCCC2)cc1 ZINC000541628740 939575435 /nfs/dbraw/zinc/57/54/35/939575435.db2.gz SSVWVSMDSYMPGR-OAQYLSRUSA-N 0 3 409.530 4.140 20 0 HIADHN CC(C)(NCC(=O)N1CCC[C@H]1c1ccc2c(c1)OCCCO2)c1cccs1 ZINC000541643348 939583868 /nfs/dbraw/zinc/58/38/68/939583868.db2.gz UNGWSXBSRQFOKG-KRWDZBQOSA-N 0 3 400.544 4.098 20 0 HIADHN C[C@@H]1N(CC(=O)Nc2cccc(CSc3ccccn3)c2)CCC12CCOCC2 ZINC000541717932 939613111 /nfs/dbraw/zinc/61/31/11/939613111.db2.gz JHRFBJHFGGLJOB-SFHVURJKSA-N 0 3 411.571 4.203 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@H]2CCCC[C@H]2NCc2ccc(F)c(CN(C)C)c2)cc1 ZINC000541732216 939616109 /nfs/dbraw/zinc/61/61/09/939616109.db2.gz HWMIEEMFCQTEJJ-PKTZIBPZSA-N 0 3 418.578 4.070 20 0 HIADHN CC(C)[C@@H](NCc1ccc(C(=O)N2CCN(C)CC2)cc1)c1ccc(Cl)cc1F ZINC000541916297 939652677 /nfs/dbraw/zinc/65/26/77/939652677.db2.gz FLOVWCIZCKOFHR-JOCHJYFZSA-N 0 3 417.956 4.354 20 0 HIADHN Cc1nn(-c2ccccc2)cc1NC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C ZINC000541924184 939655182 /nfs/dbraw/zinc/65/51/82/939655182.db2.gz ATXBRESEELAEAA-IBGZPJMESA-N 0 3 403.530 4.309 20 0 HIADHN CCOc1ccccc1[C@@H](CC)NC(=O)CN[C@@H](C)c1ccc(-n2ccnc2C)cc1 ZINC000541958856 939662525 /nfs/dbraw/zinc/66/25/25/939662525.db2.gz SWGCBWVCUIEGER-FDDCHVKYSA-N 0 3 420.557 4.498 20 0 HIADHN CC(C)[C@@H]1C[C@H](CC(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)CCO1 ZINC000541959436 939662671 /nfs/dbraw/zinc/66/26/71/939662671.db2.gz ZSAYLEZIGJGNCO-VSKRKVRLSA-N 0 3 410.562 4.110 20 0 HIADHN COc1ccc([C@@H](NC(=O)CN[C@@H](C)c2ccc(-n3ccnc3C)cc2)C(C)C)cc1 ZINC000541956676 939662682 /nfs/dbraw/zinc/66/26/82/939662682.db2.gz VXHHNRYGKDNOAU-BVZFJXPGSA-N 0 3 420.557 4.353 20 0 HIADHN CC[C@@H]1C[C@@H](CC(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)CCO1 ZINC000541959442 939663320 /nfs/dbraw/zinc/66/33/20/939663320.db2.gz ZWFFWDGTXCVCGZ-FDFHNCONSA-N 0 3 410.562 4.172 20 0 HIADHN Cc1ccccc1[C@H](CO)NC[C@H](O)CO[C@H](c1ccccc1)c1ccccc1C ZINC000541982235 939669638 /nfs/dbraw/zinc/66/96/38/939669638.db2.gz IAJBMGJBLGFRIE-UCGXPXSYSA-N 0 3 405.538 4.094 20 0 HIADHN Cc1ccc([C@H](OC[C@H](O)CN[C@@H](CO)c2ccccc2C)c2ccccc2)cc1 ZINC000541983611 939669681 /nfs/dbraw/zinc/66/96/81/939669681.db2.gz KYRZLADFVHVMPT-DMTNHVFBSA-N 0 3 405.538 4.094 20 0 HIADHN CS[C@H]1CN(C(=O)c2nc(-c3ccc(Cl)c(Cl)c3)oc2C)C[C@@H]1N(C)C ZINC000541991234 939672261 /nfs/dbraw/zinc/67/22/61/939672261.db2.gz IXDHLWPQOUGLTF-GJZGRUSLSA-N 0 3 414.358 4.074 20 0 HIADHN Cc1c2cccc(Br)c2oc1C(=O)N(CCN(C)C)Cc1ccco1 ZINC000541997935 939674936 /nfs/dbraw/zinc/67/49/36/939674936.db2.gz BRXQSCHRGQBFAB-UHFFFAOYSA-N 0 3 405.292 4.301 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCC(CCCn2ccnc2)CC1)c1ccsc1 ZINC000542108953 939716783 /nfs/dbraw/zinc/71/67/83/939716783.db2.gz FZTKBSNZAPUYHX-OAQYLSRUSA-N 0 3 417.623 4.230 20 0 HIADHN C[C@@H](N[C@H]1CCCN(Cc2nccn2C)C1=O)c1ccc(-c2ccccc2F)s1 ZINC000542159661 939737328 /nfs/dbraw/zinc/73/73/28/939737328.db2.gz BTXALVAWXAHUBC-QAPCUYQASA-N 0 3 412.534 4.130 20 0 HIADHN Cc1nc2c(s1)[C@@H](N(C)C[C@H](O)COc1ccccc1C(F)(F)F)CCC2 ZINC000542212003 939757946 /nfs/dbraw/zinc/75/79/46/939757946.db2.gz BDHQAUAQTIAWOG-BBRMVZONSA-N 0 3 400.466 4.219 20 0 HIADHN COc1cc(CN[C@H](C)C[S@](C)=O)ccc1OCc1cccc(C(F)(F)F)c1 ZINC000542298913 939789783 /nfs/dbraw/zinc/78/97/83/939789783.db2.gz RHMXFCJHUOBPMR-SUMNFNSASA-N 0 3 415.477 4.150 20 0 HIADHN CCCc1c(C(=O)Nc2ccc(CN3CCN(CC)CC3)cc2)cnn1C1CCCC1 ZINC000542329856 939801711 /nfs/dbraw/zinc/80/17/11/939801711.db2.gz NHISHFHYRSUZGW-UHFFFAOYSA-N 0 3 423.605 4.341 20 0 HIADHN COc1ccc([C@H](CNC(=O)Nc2ccccc2-n2nccc2C)N2CCCC2)cc1 ZINC000542422499 939819531 /nfs/dbraw/zinc/81/95/31/939819531.db2.gz SEHOVVDDTPPPID-QHCPKHFHSA-N 0 3 419.529 4.148 20 0 HIADHN c1csc(-c2nn(-c3ccccc3)cc2CN2CCOCC3(CCOCC3)C2)c1 ZINC000542463676 939827587 /nfs/dbraw/zinc/82/75/87/939827587.db2.gz IVQUSLSAJRMRKY-UHFFFAOYSA-N 0 3 409.555 4.230 20 0 HIADHN COc1ccc([C@H](CN[C@@H](c2ccc(F)cc2)c2cccnc2)N(C)C)cc1OC ZINC000542475501 939829461 /nfs/dbraw/zinc/82/94/61/939829461.db2.gz XNNSNEWQIIDWGG-URXFXBBRSA-N 0 3 409.505 4.220 20 0 HIADHN Cc1ccc([C@H](CN[C@@H](c2ccc(F)cc2)c2cccnc2)N2CCOCC2)cc1 ZINC000542477135 939829894 /nfs/dbraw/zinc/82/98/94/939829894.db2.gz DOTAZKYPLQZGFP-DQEYMECFSA-N 0 3 405.517 4.282 20 0 HIADHN CCN1CCN(Cc2ccccc2CN[C@@H](c2ccc(F)cc2)c2ccccn2)CC1 ZINC000542480165 939830433 /nfs/dbraw/zinc/83/04/33/939830433.db2.gz WPPCRYKLWPFCRK-SANMLTNESA-N 0 3 418.560 4.237 20 0 HIADHN CCN1CCN(Cc2ccccc2CN[C@H](c2ccc(F)cc2)c2ccccn2)CC1 ZINC000542480164 939830568 /nfs/dbraw/zinc/83/05/68/939830568.db2.gz WPPCRYKLWPFCRK-AREMUKBSSA-N 0 3 418.560 4.237 20 0 HIADHN C[C@@H]1C[C@H](CCN[C@@H](c2ccc(F)cc2)c2cccc(S(C)(=O)=O)c2)CCO1 ZINC000542486429 939831842 /nfs/dbraw/zinc/83/18/42/939831842.db2.gz IUJGBJLWCDHYPL-YVHKJVDXSA-N 0 3 405.535 4.113 20 0 HIADHN CC(C)([C@@H](NCC(=O)Nc1ccccc1F)c1ccc(F)c(F)c1)N1CCCC1 ZINC000542517970 939835854 /nfs/dbraw/zinc/83/58/54/939835854.db2.gz MDRRYDXSCHKODQ-NRFANRHFSA-N 0 3 405.464 4.248 20 0 HIADHN COc1ccc(CN(C)C(=O)CN[C@H](Cc2ccccc2)c2cccs2)cc1OC ZINC000542520402 939836475 /nfs/dbraw/zinc/83/64/75/939836475.db2.gz ALQWLUCXNQJIFP-HXUWFJFHSA-N 0 3 424.566 4.297 20 0 HIADHN COc1ccc([C@@H]2CCCN2C[C@@H](O)COc2cc(C)ccc2Cl)cc1OC ZINC000542520025 939836610 /nfs/dbraw/zinc/83/66/10/939836610.db2.gz GDZPERBMWYFKIC-MJGOQNOKSA-N 0 3 405.922 4.242 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@H]1CCO[C@H](c2ccc(F)cc2)C1)c1ccsc1 ZINC000542537763 939840057 /nfs/dbraw/zinc/84/00/57/939840057.db2.gz NAZPTZVDCIDPED-HBMCJLEFSA-N 0 3 419.566 4.490 20 0 HIADHN Cc1c([C@H](C)NCCCS(=O)(=O)c2ccc(C)cc2)cnn1-c1ccc(F)cc1 ZINC000542538296 939840316 /nfs/dbraw/zinc/84/03/16/939840316.db2.gz ATIAYOOYWQCJSO-KRWDZBQOSA-N 0 3 415.534 4.143 20 0 HIADHN CCOc1ccc(-c2nc(CN[C@@H](CC(N)=O)C3CCCCC3)cs2)cc1OC ZINC000542560294 939843952 /nfs/dbraw/zinc/84/39/52/939843952.db2.gz CVYYXBFHWDSFSN-SFHVURJKSA-N 0 3 417.575 4.131 20 0 HIADHN Cc1csc([C@H](C)CNC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)n1 ZINC000542582283 939846083 /nfs/dbraw/zinc/84/60/83/939846083.db2.gz SFUVAHXECAFPNM-AUUYWEPGSA-N 0 3 411.493 4.126 20 0 HIADHN Cc1c([C@H](C)NC[C@@H](O)COc2ccc(C(C)(C)c3ccccc3)cc2)cnn1C ZINC000542591717 939847059 /nfs/dbraw/zinc/84/70/59/939847059.db2.gz YLWJFLZTJVKPHT-PGRDOPGGSA-N 0 3 407.558 4.145 20 0 HIADHN C[C@H](N[C@@H](C)[C@H]1COc2ccccc21)C(=O)NC(c1ccccc1)c1ccccc1 ZINC000542629234 939850286 /nfs/dbraw/zinc/85/02/86/939850286.db2.gz YEVCHPNCBADWIZ-SFYKDHMMSA-N 0 3 400.522 4.435 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@H]2NCc2ccc(-n3cccn3)cc2)cc1 ZINC000542672226 939853193 /nfs/dbraw/zinc/85/31/93/939853193.db2.gz XCEVTQWCSORHGZ-DHIUTWEWSA-N 0 3 409.555 4.055 20 0 HIADHN Cc1ccc(S(=O)(=O)C[C@H](C)NCCc2csc(-c3ccccc3)n2)cc1 ZINC000542675043 939853300 /nfs/dbraw/zinc/85/33/00/939853300.db2.gz YQFUZIRNQSMDEK-KRWDZBQOSA-N 0 3 400.569 4.113 20 0 HIADHN CCN(Cc1ccc(C(=O)N(C)C)cc1)Cc1ccc(OCC(F)(F)F)c(F)c1 ZINC000542703326 939855511 /nfs/dbraw/zinc/85/55/11/939855511.db2.gz KNBYUKIBSWGMNW-UHFFFAOYSA-N 0 3 412.427 4.491 20 0 HIADHN C[C@@H]1N(C(=O)N[C@@H](CN2CCc3ccccc3C2)C(C)(C)C)CCC12CCOCC2 ZINC000542744467 939858577 /nfs/dbraw/zinc/85/85/77/939858577.db2.gz DGUYCPMLLJUIEW-UGKGYDQZSA-N 0 3 413.606 4.060 20 0 HIADHN CS[C@H]1CN(C(=O)c2oc3ccc(Br)cc3c2C)C[C@H]1N1CCCC1 ZINC000542772947 939860129 /nfs/dbraw/zinc/86/01/29/939860129.db2.gz JRCVGFPGYXSKDA-WBVHZDCISA-N 0 3 423.376 4.156 20 0 HIADHN C[C@@H]1[C@H](NC(=O)Nc2ccc(OC[C@@H]3CCCO3)cc2)CCN1Cc1ccccc1 ZINC000563744673 945278142 /nfs/dbraw/zinc/27/81/42/945278142.db2.gz OTCHQNJUCMHEFR-YFXJRYMSSA-N 0 3 409.530 4.029 20 0 HIADHN CC(=O)c1ccc(NC(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)cc1Cl ZINC000543037541 939900157 /nfs/dbraw/zinc/90/01/57/939900157.db2.gz SEJFUXILDMVJQA-IYBDPMFKSA-N 0 3 421.969 4.286 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N2CCC(c3ccc(C)nc3)CC2)N2CCCC2)cc1 ZINC000543040185 939902616 /nfs/dbraw/zinc/90/26/16/939902616.db2.gz GWZICMAECRVQRG-XMMPIXPASA-N 0 3 406.574 4.425 20 0 HIADHN CCOC(=O)C1CCN(C(=O)C[C@H](C)N[C@H](C)c2cccc(Cl)c2Cl)CC1 ZINC000543066972 939919985 /nfs/dbraw/zinc/91/99/85/939919985.db2.gz NOLHKLNUMZXVQL-UONOGXRCSA-N 0 3 415.361 4.224 20 0 HIADHN CNS(=O)(=O)c1cccc([C@@H](C)N[C@@H]2CCCc3c(Br)cccc32)c1 ZINC000543078838 939930171 /nfs/dbraw/zinc/93/01/71/939930171.db2.gz CEUBOUWZMDWYPI-BFUOFWGJSA-N 0 3 423.376 4.085 20 0 HIADHN COC(=O)COc1ccc(CN2CCC(c3nc4cc(Cl)ccc4o3)CC2)cc1 ZINC000543083915 939933313 /nfs/dbraw/zinc/93/33/13/939933313.db2.gz YYNQUGQILOEXJK-UHFFFAOYSA-N 0 3 414.889 4.413 20 0 HIADHN COc1cc(CN[C@H](C)C[S@](C)=O)ccc1OCc1ccc(Cl)cc1Cl ZINC000543226935 940001346 /nfs/dbraw/zinc/00/13/46/940001346.db2.gz QUSMFHGDLXINEO-SRGMZFCMSA-N 0 3 416.370 4.438 20 0 HIADHN Cc1nn(-c2ccncc2)cc1CNCc1ccc(NC(=O)c2ccc(F)cc2)cc1 ZINC000543239871 940005419 /nfs/dbraw/zinc/00/54/19/940005419.db2.gz OHIUGNIOGXIPBJ-UHFFFAOYSA-N 0 3 415.472 4.257 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(CN3CCC(O)CC3)c2)cc1OC1CCCC1 ZINC000543280785 940016878 /nfs/dbraw/zinc/01/68/78/940016878.db2.gz YHWOOEPJQRDMFH-UHFFFAOYSA-N 0 3 424.541 4.226 20 0 HIADHN Cc1nn(-c2ccncc2)cc1CN1CCC([C@H]2C(=O)Nc3cc(Cl)ccc32)CC1 ZINC000543393387 940050363 /nfs/dbraw/zinc/05/03/63/940050363.db2.gz CKPHKYXFWPPIJA-JOCHJYFZSA-N 0 3 421.932 4.177 20 0 HIADHN COc1cc(OC)cc(N2CC[C@H](CN[C@H](c3ccccc3)c3ccc(F)cn3)C2)c1 ZINC000543404910 940054148 /nfs/dbraw/zinc/05/41/48/940054148.db2.gz LQDVMPYEDREIPL-IQGLISFBSA-N 0 3 421.516 4.443 20 0 HIADHN Cc1ccc(-n2cc(CN3CCC(OC[C@H]4CCOC4)CC3)c(C(C)(C)C)n2)cc1 ZINC000543414565 940058010 /nfs/dbraw/zinc/05/80/10/940058010.db2.gz HBWZDPRULFGKHA-FQEVSTJZSA-N 0 3 411.590 4.496 20 0 HIADHN CC[C@H](N[C@H]1CCCN(Cc2ccccn2)C1=O)c1ccc2cc(OC)ccc2c1 ZINC000543427001 940061189 /nfs/dbraw/zinc/06/11/89/940061189.db2.gz PTQOAYWEZXAODF-ZEQRLZLVSA-N 0 3 403.526 4.475 20 0 HIADHN CC[C@@H](N[C@H]1CCCN(Cc2ccccn2)C1=O)c1cccc(Br)c1 ZINC000543427041 940061491 /nfs/dbraw/zinc/06/14/91/940061491.db2.gz QNXSPPWLUOLMQT-MOPGFXCFSA-N 0 3 402.336 4.076 20 0 HIADHN OC[C@@]1(Cc2ccc(F)cc2)CCN(CCc2cc(Cl)c3c(c2)OCCCO3)C1 ZINC000563769989 945293307 /nfs/dbraw/zinc/29/33/07/945293307.db2.gz HQUOPLBKMYDLEY-HSZRJFAPSA-N 0 3 419.924 4.110 20 0 HIADHN COC(=O)c1cc(CN[C@@H](Cc2ccccc2)c2cccs2)cc(C(=O)OC)c1 ZINC000543454451 940067594 /nfs/dbraw/zinc/06/75/94/940067594.db2.gz KMMRDORWOWXXCX-FQEVSTJZSA-N 0 3 409.507 4.395 20 0 HIADHN C[C@@H](N[C@@H](CC(N)=O)C1CCCCC1)C(=O)Nc1ccccc1Oc1ccccc1 ZINC000543495022 940083915 /nfs/dbraw/zinc/08/39/15/940083915.db2.gz BYYGCPKSTQITND-UTKZUKDTSA-N 0 3 409.530 4.220 20 0 HIADHN CC(=O)c1cccc(OC[C@H](O)CN[C@@H](C)c2sc(-c3ccccc3)nc2C)c1 ZINC000543520169 940094955 /nfs/dbraw/zinc/09/49/55/940094955.db2.gz UFSIGJJSLPQNLO-MGPUTAFESA-N 0 3 410.539 4.412 20 0 HIADHN Cc1ccc(NC(=O)[C@H](C)N[C@@H](C)[C@H]2COc3ccccc32)c(Br)c1 ZINC000543558186 940107461 /nfs/dbraw/zinc/10/74/61/940107461.db2.gz BTGFIGVRCMURKL-OFQRWUPVSA-N 0 3 403.320 4.239 20 0 HIADHN CCOc1ccc(CN(C)C(=O)CN(C)[C@H]2CCO[C@@H](c3ccc(F)cc3)C2)cc1 ZINC000543559842 940108496 /nfs/dbraw/zinc/10/84/96/940108496.db2.gz UGWHFUWHCVAHRX-JTHBVZDNSA-N 0 3 414.521 4.035 20 0 HIADHN CN(Cc1ccc(Cl)s1)C(=O)CN(C)[C@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000543560970 940109254 /nfs/dbraw/zinc/10/92/54/940109254.db2.gz RNWOTVVIGTULQC-FUHWJXTLSA-N 0 3 410.942 4.351 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@H]2CCCC[C@@H]2NCc2cn(C)nc2-c2ccccc2)cc1 ZINC000543598244 940125702 /nfs/dbraw/zinc/12/57/02/940125702.db2.gz UZEAFZWUBCRKQT-GOTSBHOMSA-N 0 3 423.582 4.270 20 0 HIADHN C[C@H](N[C@H]1CCN(c2cnn(C)c2)C1=O)c1ccc(-c2ccc(Cl)cc2F)s1 ZINC000543599894 940126115 /nfs/dbraw/zinc/12/61/15/940126115.db2.gz JUACIGQJWPJMQQ-SJCJKPOMSA-N 0 3 418.925 4.397 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@@H]2NC[C@H](c2ccsc2)N(C)C)cc1 ZINC000543607944 940129338 /nfs/dbraw/zinc/12/93/38/940129338.db2.gz LWYUARQXRPTWSS-PWRODBHTSA-N 0 3 406.617 4.034 20 0 HIADHN Cc1cccn2cc(CNC3CCN(Cc4ccccc4Br)CC3)nc12 ZINC000543770687 940180946 /nfs/dbraw/zinc/18/09/46/940180946.db2.gz LZDHOUQFFOCSJC-UHFFFAOYSA-N 0 3 413.363 4.159 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)NCC(=O)Nc2ccc(OC(F)F)cc2)cc1 ZINC000543814119 940195927 /nfs/dbraw/zinc/19/59/27/940195927.db2.gz ZXBKQXWUXLGXJP-AWEZNQCLSA-N 0 3 400.429 4.071 20 0 HIADHN Cc1cc(-c2nc3cc(F)ccc3n2C)ccc1NC(=O)N(CCN(C)C)C(C)C ZINC000543831385 940202374 /nfs/dbraw/zinc/20/23/74/940202374.db2.gz MRNOHOFUHVXDQE-UHFFFAOYSA-N 0 3 411.525 4.492 20 0 HIADHN C[C@@H](N[C@@H]1CCCN(Cc2nccn2C)C1=O)c1ccc(-c2ccc(F)cc2)s1 ZINC000544014059 940299315 /nfs/dbraw/zinc/29/93/15/940299315.db2.gz JNAAZCFSGQOMEN-CRAIPNDOSA-N 0 3 412.534 4.130 20 0 HIADHN Cc1ccc(CN(CCO)Cc2cn(Cc3ccccc3)nc2-c2cccnc2)cc1 ZINC000544034003 940305945 /nfs/dbraw/zinc/30/59/45/940305945.db2.gz CKKLILUAEDYRHP-UHFFFAOYSA-N 0 3 412.537 4.296 20 0 HIADHN Clc1ccc(-n2cc(CNCC3(c4ccccc4)CCOCC3)nn2)cc1Cl ZINC000544183067 940346673 /nfs/dbraw/zinc/34/66/73/940346673.db2.gz FEUUTKSOXYSFJN-UHFFFAOYSA-N 0 3 417.340 4.412 20 0 HIADHN CN(C)Cc1ccccc1CNC(=O)c1ncoc1-c1cccc(C(F)(F)F)c1 ZINC000544231511 940362231 /nfs/dbraw/zinc/36/22/31/940362231.db2.gz WWCZCJFCIMNNBA-UHFFFAOYSA-N 0 3 403.404 4.352 20 0 HIADHN CCCc1c(NC(=O)[C@H]2CCCN(Cc3cccnc3)C2)cnn1-c1cccc(F)c1 ZINC000544294846 940382316 /nfs/dbraw/zinc/38/23/16/940382316.db2.gz IQTOOZFMJXGUFW-IBGZPJMESA-N 0 3 421.520 4.210 20 0 HIADHN Cc1nn(-c2ccncc2)cc1CN(CCCO)Cc1ccc(Cl)c(Cl)c1 ZINC000544352153 940397702 /nfs/dbraw/zinc/39/77/02/940397702.db2.gz WENWOARZLUENMG-UHFFFAOYSA-N 0 3 405.329 4.267 20 0 HIADHN Fc1ccc([C@H](NCC2(c3ccc4c(c3)OCO4)CCOCC2)c2ccccc2)nc1 ZINC000544367627 940403152 /nfs/dbraw/zinc/40/31/52/940403152.db2.gz FJIGLFPDYJYOGG-XMMPIXPASA-N 0 3 420.484 4.377 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2CN2CCC(OC[C@@H]3CCOC3)CC2)o1 ZINC000544372299 940404939 /nfs/dbraw/zinc/40/49/39/940404939.db2.gz YYEGKVHEDAIDFC-HXUWFJFHSA-N 0 3 421.541 4.458 20 0 HIADHN O=C(Nc1cc(Cl)ccc1[O-])C1CC[NH+](CCCOCc2ccccc2)CC1 ZINC000544403074 940413484 /nfs/dbraw/zinc/41/34/84/940413484.db2.gz QXMFHDTXGKBMHC-UHFFFAOYSA-N 0 3 402.922 4.303 20 0 HIADHN COc1cc(-c2noc(CN[C@@H]3C[C@@H](C)CC[C@H]3C(C)C)n2)cc(OC)c1OC ZINC000544434912 940429631 /nfs/dbraw/zinc/42/96/31/940429631.db2.gz DRFVSAQFRASRKB-BHYGNILZSA-N 0 3 403.523 4.313 20 0 HIADHN CC(C)C[C@@H](NCC(=O)Nc1cc(Cl)ccc1-n1cncn1)c1cccs1 ZINC000544448445 940435276 /nfs/dbraw/zinc/43/52/76/940435276.db2.gz ULDUWAOQJBXSIZ-MRXNPFEDSA-N 0 3 403.939 4.298 20 0 HIADHN C[C@H](N[C@@H](CC(N)=O)C1CCCCC1)C(=O)Nc1ccc(OCc2ccccc2)cc1 ZINC000544460618 940440342 /nfs/dbraw/zinc/44/03/42/940440342.db2.gz ROVWSMXLOHTTNX-MBSDFSHPSA-N 0 3 423.557 4.007 20 0 HIADHN CC[C@H](NCC(=O)N1N=C(c2ccc(Cl)cc2)C[C@@H]1c1ccco1)[C@H]1CCCO1 ZINC000544462433 940441590 /nfs/dbraw/zinc/44/15/90/940441590.db2.gz VMRGPMIOLYFXOE-DFQSSKMNSA-N 0 3 415.921 4.158 20 0 HIADHN C[C@H](C(=O)Nc1ccc(OCc2ccccc2)cc1)N1CCC2(CCOCC2)[C@@H]1C ZINC000544546647 940476087 /nfs/dbraw/zinc/47/60/87/940476087.db2.gz BUTTZILXYGIQII-UXHICEINSA-N 0 3 408.542 4.484 20 0 HIADHN C[C@H](C(=O)Nc1ccc(OCc2ccccc2)cc1)N1CCC2(CCOCC2)[C@H]1C ZINC000544546653 940476149 /nfs/dbraw/zinc/47/61/49/940476149.db2.gz BUTTZILXYGIQII-WOJBJXKFSA-N 0 3 408.542 4.484 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@H]2NCc2ccc(Cn3cccn3)cc2)cc1 ZINC000544583126 940484537 /nfs/dbraw/zinc/48/45/37/940484537.db2.gz UXJIPULZGMDSOY-DNQXCXABSA-N 0 3 423.582 4.115 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2csc(-c3ccccn3)n2)N2CCCC2)cc1 ZINC000544595885 940486669 /nfs/dbraw/zinc/48/66/69/940486669.db2.gz HJKZDYASKWXVTO-LJQANCHMSA-N 0 3 407.543 4.472 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)N[C@@H]2CCO[C@H](c3ccc(F)cc3)C2)c1 ZINC000544651862 940498829 /nfs/dbraw/zinc/49/88/29/940498829.db2.gz KXNKBNVCTKVBBY-PKTZIBPZSA-N 0 3 413.537 4.128 20 0 HIADHN CS[C@H]1CN(C(=O)c2c(C)onc2-c2c(F)cccc2Cl)C[C@H]1N1CCCC1 ZINC000544684967 940502269 /nfs/dbraw/zinc/50/22/69/940502269.db2.gz RDMSQLMXEOMCPY-CVEARBPZSA-N 0 3 423.941 4.094 20 0 HIADHN O=C(NCc1nc2ccccc2n1C1CC1)N[C@H](CN1CCCC1)c1ccccc1 ZINC000544701740 940504574 /nfs/dbraw/zinc/50/45/74/940504574.db2.gz REBQQFXSURESTG-OAQYLSRUSA-N 0 3 403.530 4.008 20 0 HIADHN COc1ccc(C(=O)CC(C)(C)CC(=O)N2CCC[C@@H]2CN2CCCCC2)cc1 ZINC000544734725 940508941 /nfs/dbraw/zinc/50/89/41/940508941.db2.gz DTFKVJLVVRQXBZ-HXUWFJFHSA-N 0 3 400.563 4.161 20 0 HIADHN CS[C@H]1CN(C(=O)Nc2ccc(OC(C)C)cc2C(F)(F)F)C[C@@H]1N(C)C ZINC000544790973 940514405 /nfs/dbraw/zinc/51/44/05/940514405.db2.gz OYOOSNBKHVPXEA-HOTGVXAUSA-N 0 3 405.486 4.002 20 0 HIADHN COC(=O)c1cn(C2CCN(Cc3ccc(-c4ccccc4Cl)s3)CC2)nn1 ZINC000544929111 940526292 /nfs/dbraw/zinc/52/62/92/940526292.db2.gz OPCTZDIIFLLLRV-UHFFFAOYSA-N 0 3 416.934 4.284 20 0 HIADHN Cc1cc(-c2noc([C@H]3CCCN(Cc4cccc(F)c4)C3)n2)ccc1-n1cncn1 ZINC000545010982 940533241 /nfs/dbraw/zinc/53/32/41/940533241.db2.gz IQUBYWDVZBTSHE-IBGZPJMESA-N 0 3 418.476 4.144 20 0 HIADHN COc1cc(C)c(Br)cc1NC(=O)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000545204678 940555701 /nfs/dbraw/zinc/55/57/01/940555701.db2.gz ZVJUVCMPEDHSNO-MRXNPFEDSA-N 0 3 418.335 4.012 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N[C@@H]1CCOC(C)(C)C1)c1ccc(C(F)(F)F)cc1 ZINC000545236776 940557824 /nfs/dbraw/zinc/55/78/24/940557824.db2.gz OCFMVLPWFVPQAU-MSOLQXFVSA-N 0 3 415.500 4.345 20 0 HIADHN C[C@H](CCN1C(=O)c2ccccc2C1=O)N[C@@H](CC(F)(F)F)c1ccc(F)cc1 ZINC000545302460 940560733 /nfs/dbraw/zinc/56/07/33/940560733.db2.gz PMFGWNGCIRAZIQ-ACJLOTCBSA-N 0 3 408.395 4.484 20 0 HIADHN c1csc(-c2nn(-c3ccccc3)cc2CN2CCOC3(CCOCC3)CC2)c1 ZINC000545304635 940561000 /nfs/dbraw/zinc/56/10/00/940561000.db2.gz ZSYLRMRGHBQHLY-UHFFFAOYSA-N 0 3 409.555 4.372 20 0 HIADHN CCC(CC)(C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1)c1ccc(OC)c(OC)c1 ZINC000545443526 940570201 /nfs/dbraw/zinc/57/02/01/940570201.db2.gz ZNUNXLYVRJZBLN-NFBKMPQASA-N 0 3 410.558 4.323 20 0 HIADHN CC(C)[C@@H](Cc1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1)c1ccccc1 ZINC000545654647 940579100 /nfs/dbraw/zinc/57/91/00/940579100.db2.gz QRJORTYJYSNOAJ-OAQYLSRUSA-N 0 3 405.546 4.256 20 0 HIADHN C[C@@H](CCCc1ccccc1)c1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1 ZINC000545656079 940579116 /nfs/dbraw/zinc/57/91/16/940579116.db2.gz GLVGZSJJECTZBU-IBGZPJMESA-N 0 3 405.546 4.400 20 0 HIADHN CN(C)C[C@H](NC(=O)Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(Cl)cc1 ZINC000563977822 945334320 /nfs/dbraw/zinc/33/43/20/945334320.db2.gz LFUCTRIJJBLIDR-FQEVSTJZSA-N 0 3 414.937 4.000 20 0 HIADHN COc1ccc(C[C@H](C)N[C@@H](c2nc(-c3ccncc3)no2)C(C)C)c(C)c1OC ZINC000563984443 945335312 /nfs/dbraw/zinc/33/53/12/945335312.db2.gz MIVVKMMIIMSSPO-MGPUTAFESA-N 0 3 410.518 4.375 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)c2cc(C)n(Cc3ccncc3)c2C)N(C)C)cc1 ZINC000545872840 940646825 /nfs/dbraw/zinc/64/68/25/940646825.db2.gz ALGSHMFTJFSURS-XMMPIXPASA-N 0 3 404.558 4.143 20 0 HIADHN COc1cccc(-c2nn(C(C)(C)C)cc2CN2CCOC3(CCOCC3)CC2)c1 ZINC000546010779 940674113 /nfs/dbraw/zinc/67/41/13/940674113.db2.gz XZSJLXMQJYFADE-UHFFFAOYSA-N 0 3 413.562 4.085 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3ccc(OC)c4cccnc34)c(C)c2)CC1 ZINC000546037517 940678860 /nfs/dbraw/zinc/67/88/60/940678860.db2.gz BQPLAQOMMFHGFY-UHFFFAOYSA-N 0 3 419.529 4.338 20 0 HIADHN CN(C)c1ccncc1CNCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1 ZINC000546056039 940684114 /nfs/dbraw/zinc/68/41/14/940684114.db2.gz VOMAGAYVILSQCD-UHFFFAOYSA-N 0 3 401.489 4.429 20 0 HIADHN CCO[C@@H]1C[C@@H](NCc2cnc(-c3ccc(Br)cc3)s2)[C@]12CCCO2 ZINC000546058990 940684964 /nfs/dbraw/zinc/68/49/64/940684964.db2.gz JVVDELHBHPWWNF-ZHALLVOQSA-N 0 3 423.376 4.389 20 0 HIADHN COc1ccccc1Oc1ccc(NC(=O)N2C[C@H](SC)[C@@H](N(C)C)C2)cc1F ZINC000546131457 940708352 /nfs/dbraw/zinc/70/83/52/940708352.db2.gz CVVGXNGJRWXPQY-JXFKEZNVSA-N 0 3 419.522 4.136 20 0 HIADHN CCN1c2ccc(NC(=O)N(Cc3ccccc3)C3CCN(C)CC3)cc2CCC1=O ZINC000546138829 940710519 /nfs/dbraw/zinc/71/05/19/940710519.db2.gz ZVBMDLSPQHZBCD-UHFFFAOYSA-N 0 3 420.557 4.114 20 0 HIADHN COc1ccccc1C1(CNC(=O)N(Cc2ccco2)C2CCN(C)CC2)CCC1 ZINC000546154834 940715806 /nfs/dbraw/zinc/71/58/06/940715806.db2.gz OTQGJHJYZYZYGH-UHFFFAOYSA-N 0 3 411.546 4.016 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)NCCC[C@H]1CCCCO1 ZINC000546193020 940726001 /nfs/dbraw/zinc/72/60/01/940726001.db2.gz SYFLAFOTLURQLZ-LJQANCHMSA-N 0 3 415.500 4.128 20 0 HIADHN CC[C@H](CC(F)(F)F)NC(=O)Nc1cc(C)nn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000546216744 940732253 /nfs/dbraw/zinc/73/22/53/940732253.db2.gz GRVKMXXIVNCVSE-QZTJIDSGSA-N 0 3 423.483 4.491 20 0 HIADHN Cc1cc(Br)cn2cc(CCN[C@@H](C)c3nc4ccccc4n3C)nc12 ZINC000546223714 940734247 /nfs/dbraw/zinc/73/42/47/940734247.db2.gz ICFNSQPCXZMGHR-AWEZNQCLSA-N 0 3 412.335 4.185 20 0 HIADHN CCN(CC(=O)Nc1ccc(N2CCCC2)cc1C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000546225743 940734986 /nfs/dbraw/zinc/73/49/86/940734986.db2.gz VQLAKRVKTOAMSR-XMMPIXPASA-N 0 3 420.601 4.130 20 0 HIADHN COc1cccc(Cc2noc([C@]3(C(F)(F)F)CCN(Cc4ccccc4)C3)n2)c1 ZINC000546286888 940764949 /nfs/dbraw/zinc/76/49/49/940764949.db2.gz CAVHLUZTCNIFHU-NRFANRHFSA-N 0 3 417.431 4.375 20 0 HIADHN CC[C@H](Oc1ccccc1C)c1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1 ZINC000546357152 940800820 /nfs/dbraw/zinc/80/08/20/940800820.db2.gz UNNVZSXSYSPAHZ-IBGZPJMESA-N 0 3 407.518 4.112 20 0 HIADHN C[C@H](NCCCS(=O)(=O)c1ccccc1)c1cccc(OCc2ccccn2)c1 ZINC000546629009 940862767 /nfs/dbraw/zinc/86/27/67/940862767.db2.gz YGPCWYCPHNFAPL-IBGZPJMESA-N 0 3 410.539 4.175 20 0 HIADHN O=C(Nc1cccc(CN2CCOC3(CCOCC3)CC2)c1)c1ccc(Cl)cc1 ZINC000546718011 940872575 /nfs/dbraw/zinc/87/25/75/940872575.db2.gz DPCZIPLDBZZOGJ-UHFFFAOYSA-N 0 3 414.933 4.364 20 0 HIADHN C[C@H](CNC(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1)c1nccs1 ZINC000546746098 940875520 /nfs/dbraw/zinc/87/55/20/940875520.db2.gz FGSSMSQDHOXUHC-CQSZACIVSA-N 0 3 414.497 4.039 20 0 HIADHN COc1ccc(C(=O)CCCCC(=O)NC2CCN([C@H](C)c3ccncc3)CC2)cc1 ZINC000546830328 940889884 /nfs/dbraw/zinc/88/98/84/940889884.db2.gz YQASUIQBWREASE-LJQANCHMSA-N 0 3 423.557 4.175 20 0 HIADHN COC(=O)[C@H](C)Cc1ccc(NC(=O)N(Cc2ccccc2)C2CCN(C)CC2)cc1 ZINC000546845512 940893864 /nfs/dbraw/zinc/89/38/64/940893864.db2.gz DSCMKIYILFPVOR-LJQANCHMSA-N 0 3 423.557 4.167 20 0 HIADHN Cc1ccc(C(=O)CCCCC(=O)NC2CCN([C@@H](C)c3ccncc3)CC2)cc1 ZINC000546857859 940896332 /nfs/dbraw/zinc/89/63/32/940896332.db2.gz UATISTCTHJHXMV-FQEVSTJZSA-N 0 3 407.558 4.475 20 0 HIADHN CSc1ccc([C@@H](C)NC(=O)NC[C@@H]2CN(Cc3ccccc3)CCCO2)cc1 ZINC000546882475 940900466 /nfs/dbraw/zinc/90/04/66/940900466.db2.gz DDDYRQLABMEFTA-WIYYLYMNSA-N 0 3 413.587 4.060 20 0 HIADHN C[C@@H](N[C@@H](Cc1ccc(Cl)cc1)C(N)=O)c1cccc(OCc2ccccn2)c1 ZINC000546886097 940901223 /nfs/dbraw/zinc/90/12/23/940901223.db2.gz AJTJLKLIRGTRLQ-ZHRRBRCNSA-N 0 3 409.917 4.061 20 0 HIADHN CCN(C(=O)c1cccc(OCc2cccnc2)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000546893596 940904603 /nfs/dbraw/zinc/90/46/03/940904603.db2.gz XRMRVSPLCFKFGG-XMMPIXPASA-N 0 3 415.537 4.397 20 0 HIADHN CCO[C@H]1COCC[C@H]1NCc1cn(-c2ccc(Br)cc2)nc1C(C)C ZINC000546963408 940929825 /nfs/dbraw/zinc/92/98/25/940929825.db2.gz IKVJGQBBLCDHRD-MOPGFXCFSA-N 0 3 422.367 4.042 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(/C=C\c4ccc(Cl)s4)n3)cn2)CC1 ZINC000547070478 940983133 /nfs/dbraw/zinc/98/31/33/940983133.db2.gz NNSWZGWNIWUYLI-YVMONPNESA-N 0 3 401.923 4.159 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(CC4CCC(C(F)(F)F)CC4)n3)cn2)CC1 ZINC000547072500 940984358 /nfs/dbraw/zinc/98/43/58/940984358.db2.gz QOEJLUIKTWMFFK-UHFFFAOYSA-N 0 3 423.483 4.185 20 0 HIADHN COc1c(-c2noc([C@H]3CCCN(Cc4cccnc4)C3)n2)cnc2ccccc21 ZINC000547138904 941009197 /nfs/dbraw/zinc/00/91/97/941009197.db2.gz OOXZASBHMFAGPW-KRWDZBQOSA-N 0 3 401.470 4.068 20 0 HIADHN CC(C)(CNC(=O)[C@@H]1CCCN(Cc2cccnc2)C1)c1cccc(Cl)c1F ZINC000547426027 941061944 /nfs/dbraw/zinc/06/19/44/941061944.db2.gz AAQRTKCKFQGKQL-QGZVFWFLSA-N 0 3 403.929 4.180 20 0 HIADHN CN(C)[C@H](CNC(=O)CN(Cc1cccs1)Cc1cccs1)c1ccccc1 ZINC000547786120 941075904 /nfs/dbraw/zinc/07/59/04/941075904.db2.gz MTDACVLPUMGBPS-OAQYLSRUSA-N 0 3 413.612 4.231 20 0 HIADHN CCN(C(=O)Nc1cnc2c(cnn2C(C)C)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000547786326 941075961 /nfs/dbraw/zinc/07/59/61/941075961.db2.gz UMROOHOCPIFIFJ-NRFANRHFSA-N 0 3 406.534 4.141 20 0 HIADHN COCCOc1ccc(C(F)(F)F)cc1NC(=O)CN(C)[C@@H]1CCCC[C@@H]1C ZINC000548403126 941100007 /nfs/dbraw/zinc/10/00/07/941100007.db2.gz PQLIFUNPSDEYHX-WMLDXEAASA-N 0 3 402.457 4.180 20 0 HIADHN COc1ccc(NC(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)c2ncccc12 ZINC000548431080 941102970 /nfs/dbraw/zinc/10/29/70/941102970.db2.gz INBLLNYZBIHKCC-SFHVURJKSA-N 0 3 404.514 4.372 20 0 HIADHN O=C(CCNCc1ccccc1OCC1CC1)Nc1ccc(Br)cc1 ZINC000548834310 941125964 /nfs/dbraw/zinc/12/59/64/941125964.db2.gz RBMDKKMVVAJURJ-UHFFFAOYSA-N 0 3 403.320 4.356 20 0 HIADHN O=C(Nc1c[nH]nc1[C@H]1CCCN(C[C@H]2CCC3(CCCC3)O2)C1)c1ccccc1 ZINC000548916770 941129106 /nfs/dbraw/zinc/12/91/06/941129106.db2.gz MRTQRQPEWLBDLM-VQTJNVASSA-N 0 3 408.546 4.333 20 0 HIADHN COc1cc(CN[C@H](CN(C)C)c2ccc(Cl)cc2)cc(Br)c1O ZINC000548991211 941139628 /nfs/dbraw/zinc/13/96/28/941139628.db2.gz DMJHAUCLSOACOJ-MRXNPFEDSA-N 0 3 413.743 4.209 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)Nc1ncc(C(F)(F)F)s1 ZINC000548995853 941140332 /nfs/dbraw/zinc/14/03/32/941140332.db2.gz QCCWBQPXWVSSNP-UHFFFAOYSA-N 0 3 408.396 4.036 20 0 HIADHN C[C@@H]1CC(CCNC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)C[C@@H](C)O1 ZINC000549020754 941144276 /nfs/dbraw/zinc/14/42/76/941144276.db2.gz MXBMMFZGBLUDKV-CBGDNZLLSA-N 0 3 412.496 4.151 20 0 HIADHN Cc1nc2c(cccc2C(=O)N2CCN(C3c4ccccc4-c4ccccc43)CC2)[nH]1 ZINC000549038893 941147263 /nfs/dbraw/zinc/14/72/63/941147263.db2.gz CWFDZDRVMFGEPC-UHFFFAOYSA-N 0 3 408.505 4.399 20 0 HIADHN CN(C)C[C@H](NC(=O)NCc1coc(-c2cccs2)n1)c1ccc(Cl)cc1 ZINC000549104185 941159420 /nfs/dbraw/zinc/15/94/20/941159420.db2.gz QNCXYCJMAJMCKE-INIZCTEOSA-N 0 3 404.923 4.159 20 0 HIADHN CCN1CC[C@@H](NCC(=O)Nc2cccc(Cl)c2)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000549116264 941161571 /nfs/dbraw/zinc/16/15/71/941161571.db2.gz MQFRCMZPHMLZQV-YLJYHZDGSA-N 0 3 411.855 4.121 20 0 HIADHN Cc1ccc(-c2cncc(F)c2)cc1NC(=O)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000549145533 941165201 /nfs/dbraw/zinc/16/52/01/941165201.db2.gz ZCHLVRFTYYOSFY-HXUWFJFHSA-N 0 3 404.489 4.442 20 0 HIADHN Cc1nc(-c2ccc(C)cc2NC(=O)CN2[C@@H]3CC[C@H]2C[C@@H](c2ccccc2)C3)n[nH]1 ZINC000549159856 941167040 /nfs/dbraw/zinc/16/70/40/941167040.db2.gz RYMXPNGXSAUQQW-WKCHPHFGSA-N 0 3 415.541 4.438 20 0 HIADHN CN(C)C[C@@H](NC(=O)NCc1ccsc1Br)c1ccc(Cl)cc1 ZINC000549181878 941169117 /nfs/dbraw/zinc/16/91/17/941169117.db2.gz CYYBLFAYAGTGIB-CQSZACIVSA-N 0 3 416.772 4.266 20 0 HIADHN COc1ccc(OC(F)F)c(NC(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)c1 ZINC000549197109 941170416 /nfs/dbraw/zinc/17/04/16/941170416.db2.gz NYMWWUIHMMXUQV-INIZCTEOSA-N 0 3 413.852 4.374 20 0 HIADHN CCN1CCN(Cc2ccc(NCc3ccc(C)cc3-c3cnn(C)c3)cc2)CC1 ZINC000549247508 941173869 /nfs/dbraw/zinc/17/38/69/941173869.db2.gz ZYDGGKSTXUDGLW-UHFFFAOYSA-N 0 3 403.574 4.145 20 0 HIADHN CN(C(=O)Nc1ccc2nnc(C3CCC3)n2c1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000549287664 941177079 /nfs/dbraw/zinc/17/70/79/941177079.db2.gz LAPHNENCMOABJA-NRFANRHFSA-N 0 3 418.545 4.125 20 0 HIADHN Cc1ccc2nc(CN(C)[C@H]3CCCN(Cc4cn5cc(C)ccc5n4)CC3)cn2c1 ZINC000549398008 941185931 /nfs/dbraw/zinc/18/59/31/941185931.db2.gz SRHHFGGMJNGJJO-QHCPKHFHSA-N 0 3 416.573 4.085 20 0 HIADHN Cc1nn(-c2ccccn2)c(C)c1CNc1ccc(CN2CCSCC2)cc1C ZINC000549406952 941186880 /nfs/dbraw/zinc/18/68/80/941186880.db2.gz UZMHKEIGVAEPSE-UHFFFAOYSA-N 0 3 407.587 4.353 20 0 HIADHN CC(C)[C@@H](NCC(=O)N1CCO[C@H](c2ccc(F)cc2)C1)c1ccc(Cl)cc1 ZINC000549466637 941192843 /nfs/dbraw/zinc/19/28/43/941192843.db2.gz XOMTYKZCIIQXHY-RBBKRZOGSA-N 0 3 404.913 4.366 20 0 HIADHN CCN1CC[C@H](NCC(=O)Nc2c(F)cccc2F)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000549471411 941193351 /nfs/dbraw/zinc/19/33/51/941193351.db2.gz IUXUYPAKUYUPHG-PXNSSMCTSA-N 0 3 411.855 4.121 20 0 HIADHN CCN1CC[C@@H](NCc2ccc(C(F)(F)F)cn2)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000549471669 941193473 /nfs/dbraw/zinc/19/34/73/941193473.db2.gz OADSEVGPRQAEIY-SJLPKXTDSA-N 0 3 403.370 4.443 20 0 HIADHN COc1cccc([C@@H]2[C@H](NCC(=O)Nc3ccccc3C(C)C)CCN2C2CC2)c1 ZINC000549477723 941194657 /nfs/dbraw/zinc/19/46/57/941194657.db2.gz MWQNDJJGWPNVIW-ILBGXUMGSA-N 0 3 407.558 4.325 20 0 HIADHN COc1cccc([C@@H]2[C@@H](NCC(=O)Nc3ccccc3C(C)C)CCN2C2CC2)c1 ZINC000549477725 941194779 /nfs/dbraw/zinc/19/47/79/941194779.db2.gz MWQNDJJGWPNVIW-UKILVPOCSA-N 0 3 407.558 4.325 20 0 HIADHN Cc1oc(-c2ccsc2)nc1CC(=O)N[C@H](CN(C)C)c1ccc(Cl)cc1 ZINC000549617852 941201496 /nfs/dbraw/zinc/20/14/96/941201496.db2.gz NPKXFGOYFXMDJU-GOSISDBHSA-N 0 3 403.935 4.327 20 0 HIADHN CN(C)C[C@H](NC(=O)c1ccc(OCc2ccncc2)cc1)c1ccc(Cl)cc1 ZINC000549616405 941201512 /nfs/dbraw/zinc/20/15/12/941201512.db2.gz IGCMQHNQSNOJQG-QFIPXVFZSA-N 0 3 409.917 4.347 20 0 HIADHN CC[C@H](C)c1nnc(N2CCN(C3CCC(C(C)C)CC3)CC2)n1C[C@H]1CCOC1 ZINC000549652261 941203068 /nfs/dbraw/zinc/20/30/68/941203068.db2.gz WZIOPCHCTZYQHW-QINBWVTOSA-N 0 3 417.642 4.165 20 0 HIADHN COc1ccc(CNc2ccc(C(=O)NCCN3CCCC3)cc2)c2ccccc12 ZINC000549681454 941204291 /nfs/dbraw/zinc/20/42/91/941204291.db2.gz KCSFKOXJYWQXLY-UHFFFAOYSA-N 0 3 403.526 4.286 20 0 HIADHN C[C@H](NCc1c(F)ccc(Br)c1F)C1CCN(CC(F)(F)F)CC1 ZINC000549687067 941204578 /nfs/dbraw/zinc/20/45/78/941204578.db2.gz MSEDMWRCWYQXMC-JTQLQIEISA-N 0 3 415.244 4.480 20 0 HIADHN CCOCCCn1c(C2CC2)nnc1N1CCN(Cc2cccc3ccccc32)CC1 ZINC000549754734 941206531 /nfs/dbraw/zinc/20/65/31/941206531.db2.gz ZSZWOLHAXJYPOJ-UHFFFAOYSA-N 0 3 419.573 4.058 20 0 HIADHN C[C@H]1C[C@H](NS(=O)(=O)Cc2ccc(C(F)F)cc2)CCN1Cc1ccccc1 ZINC000549782410 941207238 /nfs/dbraw/zinc/20/72/38/941207238.db2.gz PUQTXQISFXMMQI-OXJNMPFZSA-N 0 3 408.514 4.097 20 0 HIADHN Fc1ccc(CC2(NCc3ccn(-c4ccc(F)cc4F)n3)CCOCC2)cc1 ZINC000549797529 941207701 /nfs/dbraw/zinc/20/77/01/941207701.db2.gz OQCIQMCKQICTAE-UHFFFAOYSA-N 0 3 401.432 4.171 20 0 HIADHN O=C(NCCN1CCCC1)c1ccc(NCc2ccc(F)cc2C(F)(F)F)cc1 ZINC000550064814 941277826 /nfs/dbraw/zinc/27/78/26/941277826.db2.gz QPBPJMZPVZZFIG-UHFFFAOYSA-N 0 3 409.427 4.282 20 0 HIADHN OC1CCN(Cc2ccccc2N[C@@H]2CCc3cccc(Br)c3C2)CC1 ZINC000550139194 941288893 /nfs/dbraw/zinc/28/88/93/941288893.db2.gz KUNWCMCGEMCQEQ-GOSISDBHSA-N 0 3 415.375 4.375 20 0 HIADHN CN(C)[C@H](CNC(=O)Nc1ccc(-c2noc(C(F)F)n2)cc1)c1ccccc1 ZINC000550196223 941296782 /nfs/dbraw/zinc/29/67/82/941296782.db2.gz AQIGIMBOSIWYCJ-MRXNPFEDSA-N 0 3 401.417 4.099 20 0 HIADHN C[C@H](c1ccccc1)N1CCC(NS(=O)(=O)Cc2ccc(F)c(Cl)c2)CC1 ZINC000550208968 941298665 /nfs/dbraw/zinc/29/86/65/941298665.db2.gz DFSIUYHQSWYOJJ-OAHLLOKOSA-N 0 3 410.942 4.124 20 0 HIADHN Cc1ccccc1C(C)(C)NCC(=O)Nc1nc(CN2CCC(C)CC2)cs1 ZINC000550262324 941305104 /nfs/dbraw/zinc/30/51/04/941305104.db2.gz DUXMWIKCVAQFJP-UHFFFAOYSA-N 0 3 400.592 4.147 20 0 HIADHN CCO[C@@H]1C[C@H](NCc2cn(-c3ccccc3)nc2-c2cccs2)[C@@H]1n1cccn1 ZINC000550325516 941315379 /nfs/dbraw/zinc/31/53/79/941315379.db2.gz GVPUCGCRHIRFII-MZKRTTBSSA-N 0 3 419.554 4.306 20 0 HIADHN Cn1c(CNC2(Cc3ccc(F)cc3Cl)CCOCC2)nnc1-c1ccccc1 ZINC000550409403 941323327 /nfs/dbraw/zinc/32/33/27/941323327.db2.gz FCDFDBRNYAQNMA-UHFFFAOYSA-N 0 3 414.912 4.156 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)c1cnc2c(F)ccc(F)c2c1 ZINC000550571885 941340595 /nfs/dbraw/zinc/34/05/95/941340595.db2.gz GUCWDWHRQDWINM-GOSISDBHSA-N 0 3 410.468 4.035 20 0 HIADHN C[C@H](NCc1ccccc1OCC(=O)NC[C@@H]1CCCO1)c1cccc(C2CC2)c1 ZINC000550618714 941346537 /nfs/dbraw/zinc/34/65/37/941346537.db2.gz FVSKDMBSEZUUMA-MBSDFSHPSA-N 0 3 408.542 4.089 20 0 HIADHN Cc1cc(CN[C@H]2CCCc3cc(S(N)(=O)=O)ccc32)ccc1-c1ccccc1 ZINC000550793964 941367448 /nfs/dbraw/zinc/36/74/48/941367448.db2.gz CWVLZMMROGGZKQ-DEOSSOPVSA-N 0 3 406.551 4.477 20 0 HIADHN COc1ccc([C@H](C)N[C@@H]2CCCN([C@@H](C)c3ccccc3F)C2=O)cc1OC ZINC000550860569 941375372 /nfs/dbraw/zinc/37/53/72/941375372.db2.gz MCYISOQYKXQWTH-TWOQFEAHSA-N 0 3 400.494 4.246 20 0 HIADHN Brc1ccc(C2(CN[C@H](c3nnc[nH]3)c3cccnc3)CCCC2)cc1 ZINC000550891763 941379716 /nfs/dbraw/zinc/37/97/16/941379716.db2.gz NRWHUBSAECIKOE-SFHVURJKSA-N 0 3 412.335 4.153 20 0 HIADHN COc1cc2c(cc1OC)[C@H](N[C@H]1CCCN([C@@H](C)c3ccc(F)cc3)C1=O)CC2 ZINC000550894401 941380225 /nfs/dbraw/zinc/38/02/25/941380225.db2.gz FAAZPSGGJLRUBF-RVHYNSKXSA-N 0 3 412.505 4.172 20 0 HIADHN CN(C)Cc1cccc(NC(=O)N[C@H](c2cncc(Br)c2)C2CC2)c1 ZINC000551019513 941396057 /nfs/dbraw/zinc/39/60/57/941396057.db2.gz KYJAXSHTTBVHTD-SFHVURJKSA-N 0 3 403.324 4.179 20 0 HIADHN COc1cccc(-c2nc(CN[C@H]3CCN(C)[C@H]3c3ccccc3)cs2)c1OC ZINC000551069868 941404480 /nfs/dbraw/zinc/40/44/80/941404480.db2.gz WMZDYNIYGSBCDX-FPOVZHCZSA-N 0 3 409.555 4.362 20 0 HIADHN Cc1cc(CNc2ccc(C(=O)N(C)[C@@H]3CCCN(C)C3)cc2)cc2cccnc12 ZINC000551091584 941408414 /nfs/dbraw/zinc/40/84/14/941408414.db2.gz YBCRDLBHFGFFHX-HSZRJFAPSA-N 0 3 402.542 4.322 20 0 HIADHN C[C@@H](N[C@H]1CCCc2cc(S(N)(=O)=O)ccc21)c1ccc(Oc2cccnc2)cc1 ZINC000551198306 941426560 /nfs/dbraw/zinc/42/65/60/941426560.db2.gz MGIHMNXLIPOBOS-MWTRTKDXSA-N 0 3 423.538 4.250 20 0 HIADHN CC(C)Cn1ncc(C(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)c1C(F)F ZINC000551223716 941430343 /nfs/dbraw/zinc/43/03/43/941430343.db2.gz IZLLUZDHZYAREP-QGZVFWFLSA-N 0 3 404.505 4.213 20 0 HIADHN C[C@@H](NCc1cccc(OCc2ccccc2)c1)c1cccc(NS(C)(=O)=O)c1 ZINC000551241493 941434038 /nfs/dbraw/zinc/43/40/38/941434038.db2.gz MIRMWGBCOPFIEV-GOSISDBHSA-N 0 3 410.539 4.488 20 0 HIADHN CN(C(=O)c1ccc(NCc2cccc(OC(F)F)c2)cc1)[C@@H]1CCCN(C)C1 ZINC000551446262 941480688 /nfs/dbraw/zinc/48/06/88/941480688.db2.gz JFBYHEAEEOQZLB-LJQANCHMSA-N 0 3 403.473 4.066 20 0 HIADHN CN(C(=O)c1ccc(NCc2cccc(OC(F)(F)F)c2)cc1)[C@H]1CCCN(C)C1 ZINC000551446571 941480778 /nfs/dbraw/zinc/48/07/78/941480778.db2.gz UPULMFUMJAIZDO-IBGZPJMESA-N 0 3 421.463 4.364 20 0 HIADHN COc1nc2ccccc2cc1CNc1ccc(C(=O)N(C)[C@H]2CCCN(C)C2)cc1 ZINC000551451512 941482137 /nfs/dbraw/zinc/48/21/37/941482137.db2.gz MWBBORVEIUWMIT-QFIPXVFZSA-N 0 3 418.541 4.022 20 0 HIADHN CN(C(=O)c1ccc(NCc2cccc(C(F)(F)F)c2)cc1)[C@H]1CCCN(C)C1 ZINC000551452437 941482794 /nfs/dbraw/zinc/48/27/94/941482794.db2.gz QPFQNFIHPXPJMG-FQEVSTJZSA-N 0 3 405.464 4.484 20 0 HIADHN CCCCO[C@H]1C[C@@H](NCc2cc(C(F)(F)F)cc(S(C)(=O)=O)c2)C1(C)C ZINC000551517103 941493084 /nfs/dbraw/zinc/49/30/84/941493084.db2.gz DZDGDRGMPCIUTM-SJORKVTESA-N 0 3 407.498 4.182 20 0 HIADHN CC(C)Oc1ccc([C@@H](C)NCc2ccnc(N3CCN(C)CC3)c2)cc1Cl ZINC000551534385 941497259 /nfs/dbraw/zinc/49/72/59/941497259.db2.gz NODCGWPIHJOTGQ-QGZVFWFLSA-N 0 3 402.970 4.125 20 0 HIADHN CCOc1ccc(CN[C@H](CCn2cncn2)c2ccc(OC)cc2)cc1Cl ZINC000551569541 941503966 /nfs/dbraw/zinc/50/39/66/941503966.db2.gz FOQJCIGIYMOEMJ-HXUWFJFHSA-N 0 3 400.910 4.260 20 0 HIADHN CC(C)N1CCN([C@@H]2CCN(C(=O)c3csc(-c4ccc(Cl)cc4)c3)C2)CC1 ZINC000551591494 941508186 /nfs/dbraw/zinc/50/81/86/941508186.db2.gz OSDGDDYROHEDOA-HXUWFJFHSA-N 0 3 418.006 4.309 20 0 HIADHN COCC[C@H](N[C@H]1CCCN(CC(F)(F)F)C1=O)c1ccc(Cl)c(Cl)c1 ZINC000551724179 941533833 /nfs/dbraw/zinc/53/38/33/941533833.db2.gz MRGPADGYGLMKPE-GJZGRUSLSA-N 0 3 413.267 4.214 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)[C@@H]2C[C@H]2c2cccc(C(F)(F)F)c2)cc1 ZINC000551794282 941545985 /nfs/dbraw/zinc/54/59/85/941545985.db2.gz QGOKZURWZJJKFW-ZCNNSNEGSA-N 0 3 406.448 4.237 20 0 HIADHN C[C@H](NC[C@H]1CC[C@@H](c2nc(C3CC3)no2)O1)c1nc2ccc(Cl)cc2n1C ZINC000552075135 941580294 /nfs/dbraw/zinc/58/02/94/941580294.db2.gz KTAHLFOBVUDLPR-KHIZAZIESA-N 0 3 401.898 4.058 20 0 HIADHN COCCCOc1cccc(NC(=O)[C@@H]2CN(Cc3ccccc3)CCC2(F)F)c1 ZINC000552076907 941580648 /nfs/dbraw/zinc/58/06/48/941580648.db2.gz MRYXDNOKWGCKIP-NRFANRHFSA-N 0 3 418.484 4.198 20 0 HIADHN c1c(CN2CCC(O[C@H]3CCOC3)CC2)c(-c2ccccc2)nn1Cc1ccccc1 ZINC000552078255 941580715 /nfs/dbraw/zinc/58/07/15/941580715.db2.gz ONOKNLLFJJXHIL-VWLOTQADSA-N 0 3 417.553 4.368 20 0 HIADHN c1c(CN2CCC(O[C@@H]3CCOC3)CC2)c(-c2ccccc2)nn1-c1ccccc1 ZINC000552080275 941581151 /nfs/dbraw/zinc/58/11/51/941581151.db2.gz ZBIGLIBMWHMYQS-XMMPIXPASA-N 0 3 403.526 4.309 20 0 HIADHN CNC(=O)COc1cccc(CN[C@@H](C)c2cccc(OCc3ccccc3)c2)c1 ZINC000552086427 941582243 /nfs/dbraw/zinc/58/22/43/941582243.db2.gz GVWLCFMEVHTXRE-IBGZPJMESA-N 0 3 404.510 4.241 20 0 HIADHN FC(F)(F)[C@@H](CN[C@H]1CCCc2nc(-c3ccccc3)sc21)N1CCOCC1 ZINC000552097195 941583981 /nfs/dbraw/zinc/58/39/81/941583981.db2.gz WFXPDFWJBJEIPQ-DOTOQJQBSA-N 0 3 411.493 4.040 20 0 HIADHN C[C@H](NC[C@@H](N1CCOCC1)C(F)(F)F)c1ccc(SCC(F)(F)F)cc1 ZINC000552100790 941585284 /nfs/dbraw/zinc/58/52/84/941585284.db2.gz VTBAZNUDYDUODO-SWLSCSKDSA-N 0 3 416.431 4.255 20 0 HIADHN COc1cccc(NC(=O)C[C@@H](C)N[C@@H](CCO)c2ccc(Cl)c(Cl)c2)c1 ZINC000552100725 941585326 /nfs/dbraw/zinc/58/53/26/941585326.db2.gz SLVIKSRNRVMRJY-YJYMSZOUSA-N 0 3 411.329 4.432 20 0 HIADHN CN(CCCN(C)C(=O)c1cn(-c2ccccc2)nc1C(C)(C)C)Cc1ccncc1 ZINC000552112340 941586955 /nfs/dbraw/zinc/58/69/55/941586955.db2.gz ZGCCGKLLHKEYKE-UHFFFAOYSA-N 0 3 419.573 4.159 20 0 HIADHN O=C([C@H]1CN(Cc2ccccc2)CCC1(F)F)N1CCc2ccc(F)c(F)c2C1 ZINC000552127030 941589829 /nfs/dbraw/zinc/58/98/29/941589829.db2.gz OPAYOIJCFREXBJ-GOSISDBHSA-N 0 3 406.423 4.007 20 0 HIADHN Cc1ccccc1-c1cc(C(=O)N2[C@@H]3CC[C@H]2CCN(C)C3)c2cnn(C(C)C)c2n1 ZINC000552143690 941593284 /nfs/dbraw/zinc/59/32/84/941593284.db2.gz DBJPQXZCAKMQRO-RBUKOAKNSA-N 0 3 417.557 4.296 20 0 HIADHN O=C(c1cnc(OCC2CC2)c(Cl)c1)N1CCN(c2ccnc3ccccc32)CC1 ZINC000552147456 941593713 /nfs/dbraw/zinc/59/37/13/941593713.db2.gz FVNXKJRGNBUFAB-UHFFFAOYSA-N 0 3 422.916 4.034 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)[C@H]1C[C@H]1c1cc(Cl)cc(Cl)c1 ZINC000552200467 941601006 /nfs/dbraw/zinc/60/10/06/941601006.db2.gz FKMBUWIUNLNJRM-UFYCRDLUSA-N 0 3 405.325 4.302 20 0 HIADHN COc1cc2c(cc1F)CC[C@H]2NC(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000552211006 941603554 /nfs/dbraw/zinc/60/35/54/941603554.db2.gz FOGWIRNWPMHFAK-AZUAARDMSA-N 0 3 418.459 4.095 20 0 HIADHN C[C@H](NC[C@@H](c1ccc(Cl)cc1)N(C)CCC(F)(F)F)c1ccc(=O)[nH]n1 ZINC000552266700 941617749 /nfs/dbraw/zinc/61/77/49/941617749.db2.gz ZMWPRGDUGHPKCN-LRDDRELGSA-N 0 3 402.848 4.112 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)c2cccc3cccc(Br)c32)CC1 ZINC000552284210 941622062 /nfs/dbraw/zinc/62/20/62/941622062.db2.gz TUKLUQUNVVZDTJ-UHFFFAOYSA-N 0 3 419.363 4.222 20 0 HIADHN COc1cc([C@@H](C)NCCn2ccc3cc(Cl)ccc32)ccc1S(C)(=O)=O ZINC000552317374 941630089 /nfs/dbraw/zinc/63/00/89/941630089.db2.gz ABGOCHCPVKVQIY-CQSZACIVSA-N 0 3 406.935 4.058 20 0 HIADHN NC(=O)[C@@H](NCCCCOc1ccc(Cl)cc1)c1ccc(Br)cc1 ZINC000552389067 941653070 /nfs/dbraw/zinc/65/30/70/941653070.db2.gz KQQWWEVGYPUQQZ-KRWDZBQOSA-N 0 3 411.727 4.078 20 0 HIADHN Cn1cc(-c2ncc(CN3CCC(c4ccc(OC(F)(F)F)cc4)CC3)cn2)cn1 ZINC000552412633 941662122 /nfs/dbraw/zinc/66/21/22/941662122.db2.gz JACSSQWTQWKFEC-UHFFFAOYSA-N 0 3 417.435 4.155 20 0 HIADHN Cc1cccc(-c2nn(-c3ccccc3)cc2C(=O)N2[C@@H]3CC[C@H]2CCN(C)C3)c1 ZINC000552420531 941665459 /nfs/dbraw/zinc/66/54/59/941665459.db2.gz HWLGZLFTHMGJSX-FCHUYYIVSA-N 0 3 400.526 4.156 20 0 HIADHN CCS(=O)(=O)c1ccc([C@@H](C)NCCc2nc(-c3cccc(Cl)c3)no2)cc1 ZINC000552570901 941709291 /nfs/dbraw/zinc/70/92/91/941709291.db2.gz IDOFBELGYXMEHX-CQSZACIVSA-N 0 3 419.934 4.077 20 0 HIADHN CC(C)c1nc(C2CCN(C(=O)[C@H](C)N3CCC(Cc4ccccc4)CC3)CC2)no1 ZINC000552609055 941721445 /nfs/dbraw/zinc/72/14/45/941721445.db2.gz OJHGQTXVDOKBJE-IBGZPJMESA-N 0 3 424.589 4.242 20 0 HIADHN CO[C@H](c1ccc(F)cc1)[C@H](C)NC(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000552775706 941758547 /nfs/dbraw/zinc/75/85/47/941758547.db2.gz POLRVJVSAGWTPA-MBSDFSHPSA-N 0 3 413.537 4.208 20 0 HIADHN CC[C@@H]1C[C@H](C(=O)N(Cc2ccncc2)[C@H]2CCCN(Cc3ccccc3)C2)CCO1 ZINC000552850306 941788092 /nfs/dbraw/zinc/78/80/92/941788092.db2.gz XOZJOICLZXZVIG-DSNGMDLFSA-N 0 3 421.585 4.280 20 0 HIADHN O=C(Nc1nnc(SCc2ccccc2)s1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000552916621 941802583 /nfs/dbraw/zinc/80/25/83/941802583.db2.gz YIXLCDWUHAQVOD-GOSISDBHSA-N 0 3 410.568 4.291 20 0 HIADHN Cc1c(C)c(NC(=O)c2ccc3cncn3c2)ccc1NC(=O)c1ccc2cncn2c1 ZINC000552955095 941807380 /nfs/dbraw/zinc/80/73/80/941807380.db2.gz MWCCVTSWYXZAQZ-UHFFFAOYSA-N 0 3 424.464 4.103 20 0 HIADHN CC(C)CN(C(=O)c1ccc2c(c1)nc(Cc1cccs1)n2C)C1CCN(C)CC1 ZINC000552988274 941812625 /nfs/dbraw/zinc/81/26/25/941812625.db2.gz RZFFKFPXUSNIGL-UHFFFAOYSA-N 0 3 424.614 4.418 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)c1c(F)ccc(OC)c1OC)c1ccc(Cl)cc1 ZINC000553030620 941820615 /nfs/dbraw/zinc/82/06/15/941820615.db2.gz ZKBREIYTZVFVPI-KRWDZBQOSA-N 0 3 408.901 4.309 20 0 HIADHN O=C(CCN[C@H]1CCSc2c(F)cccc21)Nc1ccc(N2CCCC2=O)cc1 ZINC000553061058 941826359 /nfs/dbraw/zinc/82/63/59/941826359.db2.gz RPWJIJFYCMKSCZ-IBGZPJMESA-N 0 3 413.518 4.108 20 0 HIADHN Cc1cc(NC(=O)c2cccc(F)c2)sc1C(=O)N1C[C@@H](N2CCCC2)C[C@@H]1C ZINC000553102415 941833110 /nfs/dbraw/zinc/83/31/10/941833110.db2.gz PAQWRSUWBJMRGY-YJBOKZPZSA-N 0 3 415.534 4.147 20 0 HIADHN CS(=O)(=O)c1ccc(NC2CCN(C3CCCCC3)CC2)c(C(F)(F)F)c1 ZINC000553151004 941841131 /nfs/dbraw/zinc/84/11/31/941841131.db2.gz RJJJHQQDFDCTAK-UHFFFAOYSA-N 0 3 404.498 4.318 20 0 HIADHN O=C(CCSc1cccc(Cl)c1)NCc1ccccc1CN1CCC(O)CC1 ZINC000553158446 941842158 /nfs/dbraw/zinc/84/21/58/941842158.db2.gz YGSRQPYBHALYTE-UHFFFAOYSA-N 0 3 418.990 4.095 20 0 HIADHN C[C@@H](C(=O)N(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1)C(C)(F)F ZINC000553196100 941847326 /nfs/dbraw/zinc/84/73/26/941847326.db2.gz CTAWYTMNHGWZSR-RXVVDRJESA-N 0 3 401.501 4.366 20 0 HIADHN Cc1cc(NC(=O)CCN2CCN(c3ccccc3)CC2)ccc1-c1ccncc1 ZINC000553219671 941851997 /nfs/dbraw/zinc/85/19/97/941851997.db2.gz HCSYJYIKMLDWLF-UHFFFAOYSA-N 0 3 400.526 4.208 20 0 HIADHN CC(C)c1ccc2occ(C(=O)N[C@@H]3CCN(Cc4ccccc4)C[C@H]3CO)c2c1 ZINC000553434665 941884305 /nfs/dbraw/zinc/88/43/05/941884305.db2.gz MKTQSOYCDKGQJA-NZQKXSOJSA-N 0 3 406.526 4.169 20 0 HIADHN Cc1ccc(-n2nc(C(=O)N3CCN(C4CCC4)C[C@H](C)C3)c3c2CCCC3)cc1 ZINC000553525379 941902358 /nfs/dbraw/zinc/90/23/58/941902358.db2.gz AXBSONPJIQJOHG-IBGZPJMESA-N 0 3 406.574 4.006 20 0 HIADHN Cc1sc2nc(C)nc(SCC(=O)N3CCN(C4CCC4)C[C@@H](C)C3)c2c1C ZINC000553526323 941903157 /nfs/dbraw/zinc/90/31/57/941903157.db2.gz SCCBTZOFZAYRAV-CYBMUJFWSA-N 0 3 418.632 4.041 20 0 HIADHN COc1cc(Cl)c(C)cc1NC(=O)CCNCc1cnc(-c2ccncc2)s1 ZINC000553538442 941904566 /nfs/dbraw/zinc/90/45/66/941904566.db2.gz YSIDYIBDMFQLRW-UHFFFAOYSA-N 0 3 416.934 4.294 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)Nc1cccc(Br)c1 ZINC000553548195 941906472 /nfs/dbraw/zinc/90/64/72/941906472.db2.gz GQGZCLHWTAWTDZ-UHFFFAOYSA-N 0 3 404.352 4.477 20 0 HIADHN COc1ccc([C@H](CNC(=O)[C@H](C)Cc2cncc3ccccc32)N2CCCC2)cc1 ZINC000553626272 941924526 /nfs/dbraw/zinc/92/45/26/941924526.db2.gz VNLXHXGJWCEVRZ-CLOONOSVSA-N 0 3 417.553 4.375 20 0 HIADHN CC[C@H](C)Oc1cccc(NC(=O)N2CCC(CN3C[C@@H](C)O[C@H](C)C3)CC2)c1 ZINC000553654346 941935054 /nfs/dbraw/zinc/93/50/54/941935054.db2.gz KJAFCPJAHCRYRC-IPMKNSEASA-N 0 3 403.567 4.217 20 0 HIADHN C[C@@H]1C[C@@H]1N1CCN(C(=O)c2ccc(Br)cc2C(F)(F)F)C[C@@H](C)C1 ZINC000553781486 941967094 /nfs/dbraw/zinc/96/70/94/941967094.db2.gz AAMWFNZBOBUXAJ-OZVIIMIRSA-N 0 3 419.285 4.270 20 0 HIADHN CC[C@@H](c1ccccc1)N(CC)CC(=O)NC1CCN(C(=O)C2CCCCC2)CC1 ZINC000553845233 941982718 /nfs/dbraw/zinc/98/27/18/941982718.db2.gz VDIZKWITVODKPY-QHCPKHFHSA-N 0 3 413.606 4.147 20 0 HIADHN Cc1nn(Cc2ccc(Cl)cc2)c(C)c1CN1CC[C@@H](OCc2ccncc2)C1 ZINC000553897218 941993625 /nfs/dbraw/zinc/99/36/25/941993625.db2.gz CGFBUIGVBKMZBV-JOCHJYFZSA-N 0 3 410.949 4.388 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)Nc1cccc(C(=O)N(CC)CC)c1)c1ccco1 ZINC000554112012 942038556 /nfs/dbraw/zinc/03/85/56/942038556.db2.gz FTWIIDNYNGYRPI-VQIMIIECSA-N 0 3 400.523 4.013 20 0 HIADHN C[C@H](NC[C@@H](CO)c1cccnc1)c1ccc(Br)cc1Br ZINC000554116824 942040826 /nfs/dbraw/zinc/04/08/26/942040826.db2.gz XEGHZFOHZAAJSZ-AAEUAGOBSA-N 0 3 414.141 4.033 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)N[C@H]1CCCC12CCOCC2)c1ccc(Cl)cc1 ZINC000554164693 942053512 /nfs/dbraw/zinc/05/35/12/942053512.db2.gz FWMLRFKBQDLJNW-PMACEKPBSA-N 0 3 407.986 4.371 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)N[C@@H]1CCCC12CCOCC2)c1ccc(Cl)cc1 ZINC000554164695 942054184 /nfs/dbraw/zinc/05/41/84/942054184.db2.gz FWMLRFKBQDLJNW-VQTJNVASSA-N 0 3 407.986 4.371 20 0 HIADHN C[C@H](NC(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F)[C@H]1OCCc2sccc21 ZINC000554208373 942066838 /nfs/dbraw/zinc/06/68/38/942066838.db2.gz HREFLFAEFSYOGS-ZAAXVRCTSA-N 0 3 420.525 4.024 20 0 HIADHN Cc1noc([C@H]2CCCCN2C(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)n1 ZINC000554213489 942069549 /nfs/dbraw/zinc/06/95/49/942069549.db2.gz FCNJRQJZWHSOFP-MSOLQXFVSA-N 0 3 417.579 4.149 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)Nc2cnn(Cc3ccccc3)c2)N(C)C)cc1 ZINC000554245801 942077568 /nfs/dbraw/zinc/07/75/68/942077568.db2.gz PYVWCZLOEGXUJD-QHCPKHFHSA-N 0 3 421.545 4.143 20 0 HIADHN Cc1nc(-c2ccc(CNC(=O)N[C@@H](CN(C)C)c3ccc(F)cc3)s2)cs1 ZINC000554275361 942087204 /nfs/dbraw/zinc/08/72/04/942087204.db2.gz UKBLRRJELBKUHW-KRWDZBQOSA-N 0 3 418.563 4.421 20 0 HIADHN O=C([C@@H]1CCN(Cc2c(-c3ccc(Cl)cc3)nc3sccn23)C1)N1CCCC1 ZINC000554288942 942092505 /nfs/dbraw/zinc/09/25/05/942092505.db2.gz CVRZJLYRQVXANV-MRXNPFEDSA-N 0 3 414.962 4.161 20 0 HIADHN COc1ccc(CN2CC[C@@H](N[C@H](C)c3cc4ccccc4s3)C2=O)c(OC)c1 ZINC000554355854 942111593 /nfs/dbraw/zinc/11/15/93/942111593.db2.gz JQHMIAYISZZLFG-DNVCBOLYSA-N 0 3 410.539 4.370 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)Nc1ccc(OC2CCOCC2)c(C)c1)c1ccco1 ZINC000554464471 942152193 /nfs/dbraw/zinc/15/21/93/942152193.db2.gz JWMSGYZICPPUQW-XLIONFOSSA-N 0 3 415.534 4.397 20 0 HIADHN CSc1ccc([C@H](CNC(=O)Cc2cccc(Br)c2)N(C)C)cc1 ZINC000554707549 942206110 /nfs/dbraw/zinc/20/61/10/942206110.db2.gz LZPPMBAFAANLDY-SFHVURJKSA-N 0 3 407.377 4.133 20 0 HIADHN Cc1nc(COc2cccc(C(=O)N[C@H](C)CN(C)Cc3ccccc3)c2)cs1 ZINC000554723446 942211949 /nfs/dbraw/zinc/21/19/49/942211949.db2.gz FAVOGIQDYGQGNI-QGZVFWFLSA-N 0 3 409.555 4.281 20 0 HIADHN COc1ccc(NC(=O)N[C@@H]2CCN(Cc3ccccc3)[C@@H]2C)c(Br)c1 ZINC000554748866 942220017 /nfs/dbraw/zinc/22/00/17/942220017.db2.gz LEENRRPUKAZNPL-RDTXWAMCSA-N 0 3 418.335 4.242 20 0 HIADHN CCCN(C(=O)NCc1nc2ccccc2n1C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000554813679 942256631 /nfs/dbraw/zinc/25/66/31/942256631.db2.gz ZFBFPDAYFCOQPM-NRFANRHFSA-N 0 3 419.573 4.160 20 0 HIADHN CCCC(=O)NC[C@H]1CCCN(CCCC(=O)c2ccc(Br)cc2)C1 ZINC000554853178 942290213 /nfs/dbraw/zinc/29/02/13/942290213.db2.gz MJLKZONQGFHMPX-MRXNPFEDSA-N 0 3 409.368 4.040 20 0 HIADHN C/C=C/c1ccc(OC[C@@H](O)CNCc2ccc(F)cc2C(F)(F)F)c(OC)c1 ZINC000554863372 942298239 /nfs/dbraw/zinc/29/82/39/942298239.db2.gz RCXCRNYPPBTOMG-IDOMTICXSA-N 0 3 413.411 4.416 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)c(Cl)c1 ZINC000554905356 942313916 /nfs/dbraw/zinc/31/39/16/942313916.db2.gz GQVJUFIGBLQIQV-GOSISDBHSA-N 0 3 409.317 4.376 20 0 HIADHN COCc1cc(OC[C@H]2CN(Cc3ccccc3)CCCO2)c2cc(F)ccc2n1 ZINC000554958665 942334287 /nfs/dbraw/zinc/33/42/87/942334287.db2.gz SHNVZLYGQADFKC-OAQYLSRUSA-N 0 3 410.489 4.190 20 0 HIADHN COc1cnc2ccccc2c1C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000554969192 942337753 /nfs/dbraw/zinc/33/77/53/942337753.db2.gz GNIFJERNBYGFKU-UHFFFAOYSA-N 0 3 407.539 4.087 20 0 HIADHN Cc1ccc(-c2ccnn2C)cc1NC(=O)N[C@@H](CN(C)C)c1ccc(Cl)cc1 ZINC000554987183 942344536 /nfs/dbraw/zinc/34/45/36/942344536.db2.gz HDJBSFXCIOGQAM-FQEVSTJZSA-N 0 3 411.937 4.473 20 0 HIADHN COc1ccc([C@@H](Cc2ccccc2)NCc2ccc(CS(C)(=O)=O)cc2)cc1 ZINC000554997569 942349308 /nfs/dbraw/zinc/34/93/08/942349308.db2.gz NCDQWYOXFJOFMY-XMMPIXPASA-N 0 3 409.551 4.313 20 0 HIADHN NS(=O)(=O)c1ccc2c(c1)[C@H](N[C@@H](c1cccc(C(F)(F)F)c1)C1CC1)CCC2 ZINC000555002731 942350852 /nfs/dbraw/zinc/35/08/52/942350852.db2.gz LFIKOQJTJCYOSH-WOJBJXKFSA-N 0 3 424.488 4.471 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3c4c(cc5c3CCC5)CCC4)CC2)C[C@H](C)O1 ZINC000555010369 942354483 /nfs/dbraw/zinc/35/44/83/942354483.db2.gz NKBLYLOMFBRHJG-HDICACEKSA-N 0 3 411.590 4.017 20 0 HIADHN Cc1ccc(Cc2ccccn2)cc1NC(=O)NCC1(N2CCSCC2)CCCC1 ZINC000555048489 942369440 /nfs/dbraw/zinc/36/94/40/942369440.db2.gz KPOUCTANEYJYAY-UHFFFAOYSA-N 0 3 424.614 4.464 20 0 HIADHN O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)c1cscc1-c1ccccc1 ZINC000555093471 942383735 /nfs/dbraw/zinc/38/37/35/942383735.db2.gz DAQAMAHWRSRWAC-OAQYLSRUSA-N 0 3 406.551 4.436 20 0 HIADHN CCOc1cc(CN2CC3(CCC3)[C@H]2C2CC2)ccc1OCC(=O)N1CCCCC1 ZINC000555098272 942385553 /nfs/dbraw/zinc/38/55/53/942385553.db2.gz FBXKJLOVGNGGCT-XMMPIXPASA-N 0 3 412.574 4.241 20 0 HIADHN CCn1c(CN[C@@H]2CCN(C3CC3)[C@H]2c2cccc(OC)c2)nc2cc(F)ccc21 ZINC000555128244 942394388 /nfs/dbraw/zinc/39/43/88/942394388.db2.gz FJSUCPZSXDNJBV-YKSBVNFPSA-N 0 3 408.521 4.272 20 0 HIADHN COc1cccc([C@@H]2[C@H](NCC(=O)Nc3c(C)cc(C)cc3C)CCN2C2CC2)c1 ZINC000555130082 942395109 /nfs/dbraw/zinc/39/51/09/942395109.db2.gz QIBOEEYBQFXZIC-RCZVLFRGSA-N 0 3 407.558 4.127 20 0 HIADHN CCN1CC[C@@H](NCC(=O)Nc2ccccc2Cl)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000555132355 942396574 /nfs/dbraw/zinc/39/65/74/942396574.db2.gz KGDMQZLYVURTIP-YLJYHZDGSA-N 0 3 411.855 4.121 20 0 HIADHN CN(C)C[C@H](NC(=O)N[C@H]1C[C@@H]1c1ccccc1OC(F)F)c1ccc(Cl)cc1 ZINC000555205664 942431811 /nfs/dbraw/zinc/43/18/11/942431811.db2.gz IQVSOBPRVOFEMV-SQNIBIBYSA-N 0 3 423.891 4.399 20 0 HIADHN CN(C)C[C@@H](NC(=O)c1cc2c(C(F)F)nn(C)c2s1)c1ccc(Cl)cc1 ZINC000555231986 942439055 /nfs/dbraw/zinc/43/90/55/942439055.db2.gz JQFLNUVFOQKZIV-CYBMUJFWSA-N 0 3 412.893 4.259 20 0 HIADHN Cc1cc(NC(=O)c2c[nH]c(=O)c3ccccc23)cc(N2CCN(C(C)C)CC2)c1 ZINC000555418525 942524244 /nfs/dbraw/zinc/52/42/44/942524244.db2.gz JJKOTEZRBNVUKS-UHFFFAOYSA-N 0 3 404.514 4.032 20 0 HIADHN CC1CCN([C@H](CNC(=O)c2ccc3c(c2)NC(=O)C3(C)C)c2ccccc2)CC1 ZINC000555422419 942525244 /nfs/dbraw/zinc/52/52/44/942525244.db2.gz ZMLUDVIMXBEHJC-JOCHJYFZSA-N 0 3 405.542 4.119 20 0 HIADHN O=C(NCCN1CCCC1)c1ccc(NCc2cccc(OC(F)(F)F)c2)cc1 ZINC000555505387 942609457 /nfs/dbraw/zinc/60/94/57/942609457.db2.gz DHNWBICNYXTFPH-UHFFFAOYSA-N 0 3 407.436 4.023 20 0 HIADHN O=C(Nc1ccc(OC[C@H](O)CN2CCc3ccccc3C2)cc1)C1CCCCC1 ZINC000555564002 942645008 /nfs/dbraw/zinc/64/50/08/942645008.db2.gz WJZKADWNFXRYGK-HSZRJFAPSA-N 0 3 408.542 4.003 20 0 HIADHN Cc1nc(-c2ccc(CNC(=O)N(CCN(C)C)Cc3ccccc3)s2)cs1 ZINC000555635075 942681989 /nfs/dbraw/zinc/68/19/89/942681989.db2.gz XKYNCNQCFFXLCC-UHFFFAOYSA-N 0 3 414.600 4.453 20 0 HIADHN CC[C@@H](NCc1ccc(NC(=O)c2cccnc2)cc1)c1ccc(C(=O)OC)cc1 ZINC000556076280 942802073 /nfs/dbraw/zinc/80/20/73/942802073.db2.gz JQXSXZQNZILVDY-JOCHJYFZSA-N 0 3 403.482 4.361 20 0 HIADHN CCOc1ccccc1[C@H](CC(C)C)N[C@H]1CCCc2cc(S(N)(=O)=O)ccc21 ZINC000556078865 942802112 /nfs/dbraw/zinc/80/21/12/942802112.db2.gz ANLXTCVMANQFOD-VXKWHMMOSA-N 0 3 416.587 4.487 20 0 HIADHN C[C@H](N[C@@H]1CCCc2cc(S(N)(=O)=O)ccc21)c1ccc(-c2ccncc2)cc1 ZINC000556079413 942802185 /nfs/dbraw/zinc/80/21/85/942802185.db2.gz MKKMDKNGFYBDEJ-QMHKHESXSA-N 0 3 407.539 4.124 20 0 HIADHN FC(F)(F)c1cnc(N2CC[C@@H](NCc3ccnn3-c3ccccc3)C2)c(Cl)c1 ZINC000556092894 942804080 /nfs/dbraw/zinc/80/40/80/942804080.db2.gz XTVUWYLXLNFKHL-OAHLLOKOSA-N 0 3 421.854 4.308 20 0 HIADHN CN1CC[C@H](CN[C@@H](c2nc[nH]n2)c2ccc(F)cc2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000556118777 942807316 /nfs/dbraw/zinc/80/73/16/942807316.db2.gz LAIMHLIIQPAMQA-YSGRDPCXSA-N 0 3 417.891 4.108 20 0 HIADHN COc1ccc2c(c1F)CC[C@@H]2N[C@H]1CCCN([C@H](C)c2ccccc2F)C1=O ZINC000556225712 942821267 /nfs/dbraw/zinc/82/12/67/942821267.db2.gz ZIVQFCXINMPALN-UAOJZALGSA-N 0 3 400.469 4.303 20 0 HIADHN C[C@H](N[C@H]1CCCN([C@@H](C)c2ccc(F)cc2)C1=O)c1ccc(-n2ccnc2)cc1 ZINC000556241186 942825172 /nfs/dbraw/zinc/82/51/72/942825172.db2.gz QVGOZMAHYQEPQR-BSRJHKFKSA-N 0 3 406.505 4.414 20 0 HIADHN C[C@@]1(C2CC2)NC(=O)N(c2cccc(CN[C@@H]3CCCCc4ccccc43)c2)C1=O ZINC000556292081 942834116 /nfs/dbraw/zinc/83/41/16/942834116.db2.gz NVZJWERZGOZCBC-RDGATRHJSA-N 0 3 403.526 4.469 20 0 HIADHN C[C@H](c1ccccc1)n1cnnc1SC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000556324698 942841333 /nfs/dbraw/zinc/84/13/33/942841333.db2.gz QELQAPNOPRESLF-KNQAVFIVSA-N 0 3 408.571 4.271 20 0 HIADHN CN(C(=O)c1ccc(NCc2c(F)cccc2N2CCCC2)cc1)[C@@H]1CCCN(C)C1 ZINC000556337379 942844762 /nfs/dbraw/zinc/84/47/62/942844762.db2.gz NTPKOHNGAHMEJB-OAQYLSRUSA-N 0 3 424.564 4.204 20 0 HIADHN Cn1nccc1-c1ccccc1CN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1 ZINC000556862798 942943637 /nfs/dbraw/zinc/94/36/37/942943637.db2.gz BILOOVGNZHXHQR-HSZRJFAPSA-N 0 3 416.569 4.191 20 0 HIADHN C[C@@H](NCc1cccc(Cn2cnc3ccccc32)c1)c1ccc2c(c1)OCC(=O)N2 ZINC000556869799 942944831 /nfs/dbraw/zinc/94/48/31/942944831.db2.gz BGTTWIIRTBJUQO-QGZVFWFLSA-N 0 3 412.493 4.266 20 0 HIADHN CO[C@@H]1C[C@H](c2ccccc2)CC[C@@H]1NCC(=O)Nc1nc(-c2ccco2)cs1 ZINC000556875383 942947977 /nfs/dbraw/zinc/94/79/77/942947977.db2.gz AKBOKXCJTULEOO-FUHIMQAGSA-N 0 3 411.527 4.283 20 0 HIADHN CO[C@@H]1C[C@@H](c2ccccc2)CC[C@H]1NCC(=O)N(C)c1nc2ccccc2s1 ZINC000556881468 942949103 /nfs/dbraw/zinc/94/91/03/942949103.db2.gz SOBHVRPKMGZHJI-NLWGTHIKSA-N 0 3 409.555 4.200 20 0 HIADHN CNC(=O)COc1cccc(CN[C@H](C)c2sc(-c3ccc(F)cc3)nc2C)c1 ZINC000556898106 942957756 /nfs/dbraw/zinc/95/77/56/942957756.db2.gz ULLXBVFWKBUUPZ-CQSZACIVSA-N 0 3 413.518 4.233 20 0 HIADHN Cc1nc(-c2cccs2)sc1C(=O)N(C)CCCN(C)Cc1ccncc1 ZINC000556933797 942972961 /nfs/dbraw/zinc/97/29/61/942972961.db2.gz NWBNASUXUHLUHD-UHFFFAOYSA-N 0 3 400.573 4.169 20 0 HIADHN COc1cc(C(=O)N2[C@@H]3CC[C@H]2CCN(C)C3)ccc1OCc1ccccc1Cl ZINC000556965414 942982261 /nfs/dbraw/zinc/98/22/61/942982261.db2.gz AXOULPLEHHIHJN-RBUKOAKNSA-N 0 3 414.933 4.236 20 0 HIADHN O=c1ccccn1Cc1ccc(CN[C@@H]2CCCOc3cc4c(cc32)CCC4)cc1 ZINC000557256314 943061923 /nfs/dbraw/zinc/06/19/23/943061923.db2.gz YBHVBKCQUHQFGZ-XMMPIXPASA-N 0 3 400.522 4.389 20 0 HIADHN CS(=O)(=O)Cc1cccc(CN[C@@H](c2cccc(OC(F)(F)F)c2)C2CC2)c1 ZINC000557393570 943100000 /nfs/dbraw/zinc/10/00/00/943100000.db2.gz UJAGLZCAWARNJQ-LJQANCHMSA-N 0 3 413.461 4.371 20 0 HIADHN COCCCOc1ccc(NC(=O)c2oc3ccccc3c2CN(C)C)cc1OC ZINC000557468045 943146924 /nfs/dbraw/zinc/14/69/24/943146924.db2.gz BSUKYVXSIRBVBG-UHFFFAOYSA-N 0 3 412.486 4.171 20 0 HIADHN COc1cc(Cl)ccc1CNC(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000557507772 943175467 /nfs/dbraw/zinc/17/54/67/943175467.db2.gz CIGVFZCISXNNAV-UHFFFAOYSA-N 0 3 419.978 4.262 20 0 HIADHN O=S(=O)(Cc1ccc2ccccc2c1)NCC1CCN(Cc2cccs2)CC1 ZINC000557520562 943187175 /nfs/dbraw/zinc/18/71/75/943187175.db2.gz BGEBNHOKKRURPQ-UHFFFAOYSA-N 0 3 414.596 4.233 20 0 HIADHN COC(=O)c1cccc(CNCc2ccc(Br)c(Br)c2)c1 ZINC000557524897 943191558 /nfs/dbraw/zinc/19/15/58/943191558.db2.gz GDOZLWFUTARAFD-UHFFFAOYSA-N 0 3 413.109 4.288 20 0 HIADHN COC(=O)c1ccc(CNC(=O)[C@@H](C)N[C@@H](c2ccc(Cl)cc2)C(C)C)cc1 ZINC000557655098 943249326 /nfs/dbraw/zinc/24/93/26/943249326.db2.gz XAXDWVMUYXLIRK-FOIQADDNSA-N 0 3 402.922 4.118 20 0 HIADHN Cc1cc(Br)cc2cc(C(=O)N3CCN(C4CCC4)C[C@@H](C)C3)oc21 ZINC000557833566 943307419 /nfs/dbraw/zinc/30/74/19/943307419.db2.gz MXCZYBSCJATUAO-CYBMUJFWSA-N 0 3 405.336 4.450 20 0 HIADHN Cc1nc(Cc2ccc(F)cc2)sc1C(=O)N1CCN(C2CCC2)C[C@H](C)C1 ZINC000557837171 943308940 /nfs/dbraw/zinc/30/89/40/943308940.db2.gz GIKGKCAIIKRQQN-HNNXBMFYSA-N 0 3 401.551 4.128 20 0 HIADHN Cc1ccc(NC(=O)C2CC2)cc1NC(=O)N[C@H]1CCN(Cc2ccccc2)[C@H]1C ZINC000557885828 943320619 /nfs/dbraw/zinc/32/06/19/943320619.db2.gz VQLSARQVHZIUMS-UWJYYQICSA-N 0 3 406.530 4.128 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)c1cnn(-c2ccc(Cl)cc2)c1C)c1ccco1 ZINC000557912669 943327518 /nfs/dbraw/zinc/32/75/18/943327518.db2.gz WYHJGRRHYDEQLG-IFXJQAMLSA-N 0 3 400.910 4.286 20 0 HIADHN CN(C)C[C@H](NC(=O)c1cccc(C(=O)Nc2ccccc2)c1)c1ccc(F)cc1 ZINC000557924201 943330556 /nfs/dbraw/zinc/33/05/56/943330556.db2.gz PBAYYKBQRIYUHA-QFIPXVFZSA-N 0 3 405.473 4.111 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)[C@H]2C[C@H]2c2cccc(F)c2F)N(C)C)cc1 ZINC000557934188 943333180 /nfs/dbraw/zinc/33/31/80/943333180.db2.gz DDFZRBOKQCIFQY-ZJOUEHCJSA-N 0 3 402.485 4.275 20 0 HIADHN O=C(NCc1c(F)cccc1N1CCCC1)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000558105974 943380936 /nfs/dbraw/zinc/38/09/36/943380936.db2.gz UAKXFZIDOCEZMV-QHCPKHFHSA-N 0 3 410.537 4.062 20 0 HIADHN CN(C)Cc1cccc(NC(=O)N2CCO[C@@H](c3cccc(OC(F)(F)F)c3)C2)c1 ZINC000558142191 943395037 /nfs/dbraw/zinc/39/50/37/943395037.db2.gz MNJSISNCDYKSFW-LJQANCHMSA-N 0 3 423.435 4.252 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)Nc2ccccc2N2CCCC2)N(C)C)cc1 ZINC000558272324 943473046 /nfs/dbraw/zinc/47/30/46/943473046.db2.gz FZXSCCRJSYBMRV-QHCPKHFHSA-N 0 3 410.562 4.498 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1cccc(OC[C@@H]2CCCO2)c1)c1ccco1 ZINC000558277058 943477013 /nfs/dbraw/zinc/47/70/13/943477013.db2.gz JLCDMEMKMWDTTK-VDGAXYAQSA-N 0 3 401.507 4.088 20 0 HIADHN CC(C)Cc1ccc([C@@H](CNC(=O)Nc2cccc(C(=O)N(C)C)c2)N(C)C)cc1 ZINC000558276742 943477580 /nfs/dbraw/zinc/47/75/80/943477580.db2.gz FHTUSKYGAREJMW-JOCHJYFZSA-N 0 3 410.562 4.011 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)Nc1ccc(Cl)c(C(=O)NC2CC2)c1)c1ccco1 ZINC000558299026 943491542 /nfs/dbraw/zinc/49/15/42/943491542.db2.gz CEDDSXUABBVHIP-ACJLOTCBSA-N 0 3 418.925 4.076 20 0 HIADHN COc1ccc(NC(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)c(Br)c1 ZINC000558352312 943520961 /nfs/dbraw/zinc/52/09/61/943520961.db2.gz FIZDYFFJCODOTK-FZKQIMNGSA-N 0 3 406.324 4.271 20 0 HIADHN Fc1ccc(-n2cc(CN3C[C@H](c4ccccc4)[C@@H]4COCC[C@@H]43)nn2)c(Cl)c1 ZINC000558412316 943552703 /nfs/dbraw/zinc/55/27/03/943552703.db2.gz VYJXHYSOJWIPFE-DYXWJJEUSA-N 0 3 412.896 4.064 20 0 HIADHN Cn1cc(-c2ccc(CN3CC[C@@H](Oc4ccc(C(F)(F)F)cn4)C3)s2)cn1 ZINC000558422978 943556192 /nfs/dbraw/zinc/55/61/92/943556192.db2.gz ZCLTZORKKGYWBV-OAHLLOKOSA-N 0 3 408.449 4.216 20 0 HIADHN O=C(Nc1ncc(C(F)(F)F)s1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000558790456 943664341 /nfs/dbraw/zinc/66/43/41/943664341.db2.gz DHLMBLVGFCTIAN-UHFFFAOYSA-N 0 3 416.391 4.089 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2ccc3nnc(C(C)C)n3c2)N2CCCC2)cc1 ZINC000558801773 943669514 /nfs/dbraw/zinc/66/95/14/943669514.db2.gz GRVKRJFWQQTMLH-HXUWFJFHSA-N 0 3 406.534 4.120 20 0 HIADHN CC(C)N1CC[C@@H](NCc2cc(-c3cnn(C)c3)no2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000558826851 943681430 /nfs/dbraw/zinc/68/14/30/943681430.db2.gz MQHSOVCXBWGARU-CTNGQTDRSA-N 0 3 417.916 4.181 20 0 HIADHN CO[C@@H](C[N@H+](C)Cc1cccc([N-]S(=O)(=O)c2ccccc2)c1)c1ccccc1 ZINC000558833114 943685248 /nfs/dbraw/zinc/68/52/48/943685248.db2.gz XVSPHFQCBNQMJM-QHCPKHFHSA-N 0 3 410.539 4.307 20 0 HIADHN CO[C@@H](C[N@@H+](C)Cc1cccc([N-]S(=O)(=O)c2ccccc2)c1)c1ccccc1 ZINC000558833114 943685252 /nfs/dbraw/zinc/68/52/52/943685252.db2.gz XVSPHFQCBNQMJM-QHCPKHFHSA-N 0 3 410.539 4.307 20 0 HIADHN COc1ccc(NC(=O)CN[C@@H](c2cccc(C(F)(F)F)c2)C2CC2)cc1OC ZINC000558864055 943707304 /nfs/dbraw/zinc/70/73/04/943707304.db2.gz LISGVJSVJKGWSN-HXUWFJFHSA-N 0 3 408.420 4.402 20 0 HIADHN CC(C)N1CC[C@H](N[C@@H](C)C(=O)Nc2cc(F)ccc2F)[C@@H]1c1ccc(F)c(F)c1 ZINC000558890975 943723016 /nfs/dbraw/zinc/72/30/16/943723016.db2.gz BNVAYLHLZPDUKJ-LPLGYCIKSA-N 0 3 423.454 4.384 20 0 HIADHN CC(C)OCc1ccccc1CNC(=O)N[C@H](CN(C)C)c1ccc(Cl)cc1 ZINC000558894876 943727095 /nfs/dbraw/zinc/72/70/95/943727095.db2.gz DYHQQEUEFZVYNO-OAQYLSRUSA-N 0 3 403.954 4.367 20 0 HIADHN CC(C)N1CC[C@H](NCC(=O)N(C2CC2)C2CCCC2)[C@H]1c1ccc(F)c(F)c1 ZINC000558895646 943729014 /nfs/dbraw/zinc/72/90/14/943729014.db2.gz KRHHXHUKXACIDY-JTHBVZDNSA-N 0 3 405.533 4.012 20 0 HIADHN COc1cccc([C@@H]2[C@H](N[C@H](C)C(=O)Nc3ccc(C)cc3F)CCN2C2CC2)c1 ZINC000558896435 943731454 /nfs/dbraw/zinc/73/14/54/943731454.db2.gz SRIFWXCISAGFSS-ZGNKEGEESA-N 0 3 411.521 4.037 20 0 HIADHN CCN1CC[C@@H](NCC(=O)Nc2cccc(C(C)=O)c2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000558896844 943731555 /nfs/dbraw/zinc/73/15/55/943731555.db2.gz OBDDWNYLALOVHG-IRLDBZIGSA-N 0 3 417.912 4.045 20 0 HIADHN CCc1ccccc1NC(=O)CN[C@H]1CCN(CC)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000558897142 943732612 /nfs/dbraw/zinc/73/26/12/943732612.db2.gz PFZFXMSDRSUFKJ-RBBKRZOGSA-N 0 3 403.929 4.405 20 0 HIADHN CCCC(=O)Nc1ccc(CNC(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)cc1 ZINC000558899723 943733416 /nfs/dbraw/zinc/73/34/16/943733416.db2.gz YAUJRKINJOXOFX-HXUWFJFHSA-N 0 3 416.953 4.181 20 0 HIADHN CCN1CC[C@H](N[C@@H](C)C(=O)Nc2cccc(C)c2C)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000558899300 943733542 /nfs/dbraw/zinc/73/35/42/943733542.db2.gz AQASSLKYDJQFGL-GJULWVSJSA-N 0 3 419.491 4.473 20 0 HIADHN CCN1CC[C@H](N[C@@H](C)C(=O)Nc2cccc(C)c2C)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000558899304 943734109 /nfs/dbraw/zinc/73/41/09/943734109.db2.gz AQASSLKYDJQFGL-LVWPNOBMSA-N 0 3 419.491 4.473 20 0 HIADHN CSc1cc(C(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)ccc1NC(C)=O ZINC000558971572 943776157 /nfs/dbraw/zinc/77/61/57/943776157.db2.gz KMEOYBIZGFYGFB-SFHVURJKSA-N 0 3 405.951 4.053 20 0 HIADHN COc1ccc(C(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)cc1-c1ccccn1 ZINC000558972972 943777769 /nfs/dbraw/zinc/77/77/69/943777769.db2.gz PRINCWNGODIQSR-NRFANRHFSA-N 0 3 409.917 4.443 20 0 HIADHN Cc1ccc(CN2CCCC[C@H]2CNC(=O)c2ccccc2)c(-c2cnn(C)c2)c1 ZINC000559068396 943823342 /nfs/dbraw/zinc/82/33/42/943823342.db2.gz REDFJGFZHKHHTO-QHCPKHFHSA-N 0 3 402.542 4.180 20 0 HIADHN COCCCn1nccc1CN1CCC(C)(c2ccc(Br)cc2)CC1 ZINC000559072648 943825604 /nfs/dbraw/zinc/82/56/04/943825604.db2.gz IRCDBAHLIINOAK-UHFFFAOYSA-N 0 3 406.368 4.236 20 0 HIADHN COc1ccc(CNCc2cccc(N3CCOCC3)c2)cc1OCc1ccccc1 ZINC000559308671 943893931 /nfs/dbraw/zinc/89/39/31/943893931.db2.gz SEXBWANHAOFMIC-UHFFFAOYSA-N 0 3 418.537 4.401 20 0 HIADHN C[C@H](c1ccccc1F)N1CCC[C@H](NCc2ccc(OCC(F)F)cc2)C1=O ZINC000559323625 943896491 /nfs/dbraw/zinc/89/64/91/943896491.db2.gz ZDBFTRSNYXZXGK-QRWLVFNGSA-N 0 3 406.448 4.311 20 0 HIADHN COc1cccc(Br)c1OC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000559636618 944021692 /nfs/dbraw/zinc/02/16/92/944021692.db2.gz NYDIENHMOPXPAY-KRWDZBQOSA-N 0 3 406.320 4.128 20 0 HIADHN CC[C@@H](NCc1cc(Cl)ccc1N1CCOCC1)c1ccc(C(=O)OC)cc1 ZINC000559846541 944066440 /nfs/dbraw/zinc/06/64/40/944066440.db2.gz ZLGWFTAYPCFJEW-HXUWFJFHSA-N 0 3 402.922 4.204 20 0 HIADHN COCCOc1ccc([C@@H](C)N[C@H](C)c2ccc(-n3cccn3)c(F)c2)cc1OC ZINC000559877054 944072185 /nfs/dbraw/zinc/07/21/85/944072185.db2.gz FAENORYDCUGGBB-IAGOWNOFSA-N 0 3 413.493 4.457 20 0 HIADHN C[C@H](c1ccccc1F)N1CCC[C@H](N[C@@H](C)c2ccc3c(c2)C(C)(C)C(=O)N3)C1=O ZINC000559878651 944072731 /nfs/dbraw/zinc/07/27/31/944072731.db2.gz NAADDFAOPIBJFR-DMPWYTOCSA-N 0 3 423.532 4.458 20 0 HIADHN COC1(CCN[C@H](c2ccc(Cl)cc2)c2cccc(S(C)(=O)=O)c2)CCC1 ZINC000559880332 944073598 /nfs/dbraw/zinc/07/35/98/944073598.db2.gz JDAQLZFPGZPRJH-HXUWFJFHSA-N 0 3 407.963 4.382 20 0 HIADHN CCS(=O)(=O)Nc1ccc([C@@H](C)NCc2ccc(OC(F)F)c(F)c2)cc1 ZINC000559897968 944079123 /nfs/dbraw/zinc/07/91/23/944079123.db2.gz UGUBGXSONJAWED-GFCCVEGCSA-N 0 3 402.438 4.040 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2cc(F)c3ccccc3c2)cc1)[C@@H]1CCCN(C)C1 ZINC000559981137 944109199 /nfs/dbraw/zinc/10/91/99/944109199.db2.gz GCKMETGSCNQDEH-OAQYLSRUSA-N 0 3 419.500 4.397 20 0 HIADHN CC[C@@H]1CCCN1CC(=O)NC[C@@H](c1c[nH]c2ccccc21)c1ccc(OC)cc1 ZINC000559986043 944112302 /nfs/dbraw/zinc/11/23/02/944112302.db2.gz LBVAKNMKABIPOK-DENIHFKCSA-N 0 3 405.542 4.299 20 0 HIADHN COc1ccc2nc(CNc3ccc(C(=O)N(C)[C@H]4CCCN(C)C4)cc3)sc2c1 ZINC000559996430 944119103 /nfs/dbraw/zinc/11/91/03/944119103.db2.gz HDWXZEQCHKBAHO-SFHVURJKSA-N 0 3 424.570 4.083 20 0 HIADHN COc1cccc(Cl)c1CNc1ccc(C(=O)N(C)[C@@H]2CCCN(C)C2)cc1 ZINC000559999405 944122582 /nfs/dbraw/zinc/12/25/82/944122582.db2.gz UTOOMZSLTPMVBH-GOSISDBHSA-N 0 3 401.938 4.127 20 0 HIADHN Cc1nc2ccc(CNc3ccc(C(=O)N(C)[C@H]4CCCN(C)C4)cc3)cc2s1 ZINC000559999398 944122776 /nfs/dbraw/zinc/12/27/76/944122776.db2.gz UHBHMLZXUVPLQT-FQEVSTJZSA-N 0 3 408.571 4.383 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@H](C)NCc2ccc(C(F)(F)F)cn2)CC1 ZINC000560164600 944184509 /nfs/dbraw/zinc/18/45/09/944184509.db2.gz IWICCUFECZXJIP-HNNXBMFYSA-N 0 3 410.459 4.232 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)[C@@H](C)Cc2ccc(Br)cc2)cc1 ZINC000560248168 944206715 /nfs/dbraw/zinc/20/67/15/944206715.db2.gz CGVCWBIQHISFNV-YWZLYKJASA-N 0 3 419.363 4.055 20 0 HIADHN Cc1c([C@H](C)N[C@@H](CO)C[C@H](O)C(C)(C)C)cnn1-c1ccc(Cl)cc1Cl ZINC000560267437 944213420 /nfs/dbraw/zinc/21/34/20/944213420.db2.gz CRHGXOSCHHLKQC-HGQUKEQDSA-N 0 3 414.377 4.296 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc2c(c1)OCC(=O)N2)c1cccc(OCc2ccccn2)c1 ZINC000560522826 944241188 /nfs/dbraw/zinc/24/11/88/944241188.db2.gz KOSSXEMPELUGKO-IAGOWNOFSA-N 0 3 403.482 4.403 20 0 HIADHN C[C@H](NC[C@H]1CC[C@@H](c2nc(C3CC3)no2)O1)c1ccc(Br)cc1F ZINC000560557030 944253405 /nfs/dbraw/zinc/25/34/05/944253405.db2.gz JGTGIPURWOAFJU-WNMQOVRZSA-N 0 3 410.287 4.420 20 0 HIADHN CO[C@@H]1C[C@H](c2ccccc2)CC[C@H]1N[C@H](C)CS(=O)(=O)c1ccc(C)cc1 ZINC000560576548 944260071 /nfs/dbraw/zinc/26/00/71/944260071.db2.gz ZZTUECREKKCSLY-KPUOSGPGSA-N 0 3 401.572 4.098 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)c2cnn(-c3ccccc3C)c2C)cc1 ZINC000560700157 944299960 /nfs/dbraw/zinc/29/99/60/944299960.db2.gz LFBWEEDHMNBSBG-QHCPKHFHSA-N 0 3 418.541 4.065 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)c1cc2nccnc2cc1F)c1ccc(Cl)cc1 ZINC000560707527 944301972 /nfs/dbraw/zinc/30/19/72/944301972.db2.gz SHHGCOQGDFRACR-FQEVSTJZSA-N 0 3 400.885 4.235 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)c1cnc(-c2ncccn2)s1)c1ccc(Cl)cc1 ZINC000560712496 944305842 /nfs/dbraw/zinc/30/58/42/944305842.db2.gz WAXIVHPUOMVVTP-INIZCTEOSA-N 0 3 415.950 4.066 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)Nc1ccc(OCc2ccncc2)cc1 ZINC000560728606 944313021 /nfs/dbraw/zinc/31/30/21/944313021.db2.gz QICDWMMHLBWEDS-UHFFFAOYSA-N 0 3 422.504 4.395 20 0 HIADHN Cc1c2cccc(Cl)c2sc1CNCc1cccnc1N1CCN(C)CC1 ZINC000561042096 944412492 /nfs/dbraw/zinc/41/24/92/944412492.db2.gz UXOOIVIAQOXJIU-UHFFFAOYSA-N 0 3 400.979 4.300 20 0 HIADHN Cc1ccc(CC(=O)N(Cc2ccncc2)[C@H]2CCCN(Cc3ccccc3)C2)o1 ZINC000561075650 944430895 /nfs/dbraw/zinc/43/08/95/944430895.db2.gz TZACGLGIQGKMCH-QHCPKHFHSA-N 0 3 403.526 4.219 20 0 HIADHN FC(F)(F)COc1ccc(CNC2(c3ccc4c(c3)OCCO4)CCCC2)cn1 ZINC000561079068 944433712 /nfs/dbraw/zinc/43/37/12/944433712.db2.gz UPNBPBJBTBJZEI-UHFFFAOYSA-N 0 3 408.420 4.353 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)N[C@@H]1CCC[C@@H](C)[C@H]1C)c1ccc(NC(=O)c2ccncc2)cc1 ZINC000561157402 944486756 /nfs/dbraw/zinc/48/67/56/944486756.db2.gz NSXPPDBCIGIJSI-YHSXXIMFSA-N 0 3 422.573 4.314 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)c1cc(CNC(=O)C(C)(C)C)ccc1Cl ZINC000561262890 944532477 /nfs/dbraw/zinc/53/24/77/944532477.db2.gz YLWRCSWGMQAZIM-UHFFFAOYSA-N 0 3 422.013 4.340 20 0 HIADHN C[C@H](N[C@@H](c1ccc2c(c1)OCCO2)C1CC1)C(=O)Nc1cc(Cl)ccc1F ZINC000561402578 944581851 /nfs/dbraw/zinc/58/18/51/944581851.db2.gz RSYKWYRKPMGKOI-FKIZINRSSA-N 0 3 404.869 4.318 20 0 HIADHN CC(C)Oc1ccc([C@@H](C)NCc2ccccc2CS(=O)(=O)N2CCCC2)cc1 ZINC000561492146 944631889 /nfs/dbraw/zinc/63/18/89/944631889.db2.gz FYDTYZYHDCHRHL-LJQANCHMSA-N 0 3 416.587 4.250 20 0 HIADHN Cc1c2ccc(F)cc2sc1C(=O)Nc1ccc2oc(=O)n(CCN(C)C)c2c1 ZINC000561573123 944682172 /nfs/dbraw/zinc/68/21/72/944682172.db2.gz XWONCAARGNUQOP-UHFFFAOYSA-N 0 3 413.474 4.071 20 0 HIADHN CCOc1cc(C[NH2+]CCc2cccc3cccnc32)cc(Br)c1[O-] ZINC000561591832 944693708 /nfs/dbraw/zinc/69/37/08/944693708.db2.gz AEVQFWHRANZLKZ-UHFFFAOYSA-N 0 3 401.304 4.434 20 0 HIADHN C[C@@H](NC(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F)c1nccn1-c1ccccc1 ZINC000561641494 944723492 /nfs/dbraw/zinc/72/34/92/944723492.db2.gz ORTPNSQQCAVXKL-NQIIRXRSSA-N 0 3 424.495 4.207 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)c2sccc2Br)N(C)C)cc1 ZINC000561651474 944729005 /nfs/dbraw/zinc/72/90/05/944729005.db2.gz BJSPTKVCBFCKIS-INIZCTEOSA-N 0 3 411.365 4.331 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)c2cc(-c3cnn(C)c3)ccc2F)N(C)C)cc1 ZINC000561651078 944729190 /nfs/dbraw/zinc/72/91/90/944729190.db2.gz GICYEMCHJMXJQM-HSZRJFAPSA-N 0 3 424.520 4.046 20 0 HIADHN Cc1oc(-c2cccc(C(F)(F)F)c2)nc1C(=O)N1CCN([C@@H]2C[C@H]2C)C[C@H](C)C1 ZINC000561746509 944775212 /nfs/dbraw/zinc/77/52/12/944775212.db2.gz KUJJKLZJRSQVNV-PMUMKWKESA-N 0 3 421.463 4.471 20 0 HIADHN CCN(CCN1CCCCCC1)C(=O)c1sc(NC(=O)c2ccco2)cc1C ZINC000561775336 944792570 /nfs/dbraw/zinc/79/25/70/944792570.db2.gz IFAJPJQAVBAWLR-UHFFFAOYSA-N 0 3 403.548 4.240 20 0 HIADHN CCC[C@@H]1C[C@@H](C(=O)Nc2ccc(N3CCN(CCC)CC3)cc2OCC)CCO1 ZINC000561796552 944800204 /nfs/dbraw/zinc/80/02/04/944800204.db2.gz AHLGOSZQDXJYQZ-PZJWPPBQSA-N 0 3 417.594 4.151 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3ccc(Oc4cccnc4)cc3)CC2)C[C@@H](C)O1 ZINC000561817916 944810461 /nfs/dbraw/zinc/81/04/61/944810461.db2.gz WSYBLSIFBXMAJH-RTBURBONSA-N 0 3 424.545 4.227 20 0 HIADHN O=C(C1CCN(Cc2cccc(SCc3ccccc3)c2)CC1)N1CCOCC1 ZINC000561848738 944820077 /nfs/dbraw/zinc/82/00/77/944820077.db2.gz OCLNSFGWGKRCFA-UHFFFAOYSA-N 0 3 410.583 4.050 20 0 HIADHN Cc1noc(C)c1CO[C@H]1CCN(Cc2ccc(-n3ccc(C(F)(F)F)n3)cc2)C1 ZINC000561980834 944885507 /nfs/dbraw/zinc/88/55/07/944885507.db2.gz ZKRXOFAPXIZSDL-SFHVURJKSA-N 0 3 420.435 4.287 20 0 HIADHN CC(=O)Nc1ccc(F)c(NC(=O)NC[C@@H](c2ccc(CC(C)C)cc2)N(C)C)c1 ZINC000562106991 944943852 /nfs/dbraw/zinc/94/38/52/944943852.db2.gz LRFZBTXPBSSQDX-QFIPXVFZSA-N 0 3 414.525 4.407 20 0 HIADHN Cc1ccc(NC(=O)N[C@H](CN(C)C)c2ccc(F)cc2)c(OC[C@H]2CCCO2)c1 ZINC000562155415 944984468 /nfs/dbraw/zinc/98/44/68/944984468.db2.gz BFEBTNRLFQTFIH-TZIWHRDSSA-N 0 3 415.509 4.116 20 0 HIADHN Fc1ccc(-c2noc(CN3CCC[C@H](c4nc(C5CCCCC5)n[nH]4)C3)n2)cc1 ZINC000562159530 944989172 /nfs/dbraw/zinc/98/91/72/944989172.db2.gz SNDDPMGENQIQET-KRWDZBQOSA-N 0 3 410.497 4.421 20 0 HIADHN Fc1ccc(-c2noc(CN3CCC[C@H](c4n[nH]c(C5CCCCC5)n4)C3)n2)cc1 ZINC000562159530 944989182 /nfs/dbraw/zinc/98/91/82/944989182.db2.gz SNDDPMGENQIQET-KRWDZBQOSA-N 0 3 410.497 4.421 20 0 HIADHN CN(C)C[C@H](NC(=O)Nc1ccc(OCc2ccncc2)cc1)c1ccc(F)cc1 ZINC000562163395 944991140 /nfs/dbraw/zinc/99/11/40/944991140.db2.gz GNSHQOIZKNCSOC-QFIPXVFZSA-N 0 3 408.477 4.224 20 0 HIADHN CN(C)C[C@H](NC(=O)Nc1cnn(Cc2ccc(Cl)cc2)c1)c1ccc(F)cc1 ZINC000562185360 945008166 /nfs/dbraw/zinc/00/81/66/945008166.db2.gz IEZVXKBAIZLHOE-FQEVSTJZSA-N 0 3 415.900 4.148 20 0 HIADHN CC(C)c1nc2ccc(NC(=O)NC[C@]3(O)CCN(Cc4ccccc4)C3)cc2s1 ZINC000562190188 945012518 /nfs/dbraw/zinc/01/25/18/945012518.db2.gz QZQNZYQFYLDQTF-HSZRJFAPSA-N 0 3 424.570 4.178 20 0 HIADHN C[C@H](CNC(=O)Nc1ccc(OCc2ccncc2)cc1)N(C)Cc1ccccc1 ZINC000562208181 945019360 /nfs/dbraw/zinc/01/93/60/945019360.db2.gz KMPZCKCNIFLZFX-LJQANCHMSA-N 0 3 404.514 4.303 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)Nc1cccc(C[S@@](=O)C(C)(C)C)c1 ZINC000562218906 945026692 /nfs/dbraw/zinc/02/66/92/945026692.db2.gz XNPRFDRGUPYQLZ-MUUNZHRXSA-N 0 3 407.624 4.464 20 0 HIADHN Cc1noc(C)c1COc1ccccc1C(=O)N[C@H](C)CN(C)Cc1ccccc1 ZINC000564121118 945386996 /nfs/dbraw/zinc/38/69/96/945386996.db2.gz WWOHHEDCIHFJSA-QGZVFWFLSA-N 0 3 407.514 4.121 20 0 HIADHN CN(C)C(=O)c1ccc(CN[C@@H]2CCCc3c4cc(Br)ccc4[nH]c32)[nH]1 ZINC000564126907 945390953 /nfs/dbraw/zinc/39/09/53/945390953.db2.gz ICDLBNXHFIPZMJ-QGZVFWFLSA-N 0 3 415.335 4.128 20 0 HIADHN O=S(=O)(c1ccc(CN[C@@H]2CCCc3c4ccccc4[nH]c32)cc1)N1CCCC1 ZINC000564145468 945399411 /nfs/dbraw/zinc/39/94/11/945399411.db2.gz WMAAVIDZBSVJQB-JOCHJYFZSA-N 0 3 409.555 4.120 20 0 HIADHN CC(C)N1CC[C@@H](NCC(=O)N(C)[C@H](C)c2ccccc2)[C@@H]1c1ccc(F)c(F)c1 ZINC000564232137 945446828 /nfs/dbraw/zinc/44/68/28/945446828.db2.gz UWIZCYCKCVOXTN-BSDZUQITSA-N 0 3 415.528 4.298 20 0 HIADHN COc1ccc(SCCC(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)cc1OC ZINC000564231227 945447257 /nfs/dbraw/zinc/44/72/57/945447257.db2.gz OEUTZLWJIDTZFG-SFHVURJKSA-N 0 3 422.978 4.259 20 0 HIADHN COc1cc(Br)c(CN[C@@H]2CCN(C)[C@@H]2c2ccccc2)cc1OC ZINC000564256048 945474614 /nfs/dbraw/zinc/47/46/14/945474614.db2.gz MHJYVVUVCSDZPZ-YLJYHZDGSA-N 0 3 405.336 4.001 20 0 HIADHN CCCc1nc(-c2noc([C@]3(C(F)(F)F)CCN(Cc4ccccc4)C3)n2)co1 ZINC000564286230 945497875 /nfs/dbraw/zinc/49/78/75/945497875.db2.gz OCNMSEHRLFKDTB-IBGZPJMESA-N 0 3 406.408 4.383 20 0 HIADHN COc1cc(C)c(CNCc2cccc(-c3nc(CC(F)(F)F)no3)c2)cc1OC ZINC000564413021 945564109 /nfs/dbraw/zinc/56/41/09/945564109.db2.gz COBAWWRZPMKQFO-UHFFFAOYSA-N 0 3 421.419 4.457 20 0 HIADHN Clc1ccc([C@H](Cc2cccnc2)NCc2ccc(Cn3cncn3)cc2)cc1 ZINC000564434389 945582824 /nfs/dbraw/zinc/58/28/24/945582824.db2.gz VAKOWCZUHCMATG-QHCPKHFHSA-N 0 3 403.917 4.448 20 0 HIADHN Cc1c([C@@H](C)NCc2ccc(Cn3cncn3)cc2)cnn1-c1cccc(Cl)c1 ZINC000564438009 945587194 /nfs/dbraw/zinc/58/71/94/945587194.db2.gz GXGHXWDZCJPZLR-MRXNPFEDSA-N 0 3 406.921 4.325 20 0 HIADHN C[C@H](NCc1ccccc1Cn1ccnc1)c1ccc(S(=O)(=O)C2CCCC2)cc1 ZINC000564439664 945588929 /nfs/dbraw/zinc/58/89/29/945588929.db2.gz TWMHSSLOILNNQT-IBGZPJMESA-N 0 3 423.582 4.499 20 0 HIADHN COC(=O)[C@H](C)Cc1ccc(NC(=O)NC[C@@H](c2cccs2)N2CCCC2)cc1 ZINC000564455788 945600343 /nfs/dbraw/zinc/60/03/43/945600343.db2.gz WCJLSHQCBHUPQG-APWZRJJASA-N 0 3 415.559 4.058 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)CCCCc2nc3ccccc3s2)cc1 ZINC000564478265 945612491 /nfs/dbraw/zinc/61/24/91/945612491.db2.gz ZBJMWANKGHHPLP-FQEVSTJZSA-N 0 3 411.571 4.437 20 0 HIADHN CCO[C@@H]1C[C@@H](NCC(=O)Nc2c(C)nn(-c3ccc(C)cc3)c2C)C12CCCC2 ZINC000564496772 945625096 /nfs/dbraw/zinc/62/50/96/945625096.db2.gz NEQSJXNIPRDZEJ-NHCUHLMSSA-N 0 3 410.562 4.063 20 0 HIADHN CSc1ccc([C@@H](CNC(=O)c2cnn(-c3ccccc3F)c2C)N(C)C)cc1 ZINC000564682017 945727419 /nfs/dbraw/zinc/72/74/19/945727419.db2.gz BXJSVKAHXPCXMB-OAQYLSRUSA-N 0 3 412.534 4.074 20 0 HIADHN CO[C@H](C)[C@@H](C)N[C@@H](C)C(=O)N1N=C(c2ccc(Cl)cc2)C[C@@H]1c1ccco1 ZINC000565109949 945775396 /nfs/dbraw/zinc/77/53/96/945775396.db2.gz UQKNZWADXORXEN-NXEZDXNNSA-N 0 3 403.910 4.012 20 0 HIADHN Cc1nn(CC(=O)OC(C)C)c(C)c1CN[C@@H](C)c1ccc(Oc2cccnc2)cc1 ZINC000565508357 945842256 /nfs/dbraw/zinc/84/22/56/945842256.db2.gz OBPIXUDCSLNPOX-KRWDZBQOSA-N 0 3 422.529 4.490 20 0 HIADHN Cc1sc(NC(=O)c2ccccc2CN(C)C)nc1-c1ccc2c(c1)CCC(=O)N2 ZINC000565516467 945844839 /nfs/dbraw/zinc/84/48/39/945844839.db2.gz KUYVHOYXVYQWSP-UHFFFAOYSA-N 0 3 420.538 4.317 20 0 HIADHN CSc1ccc([C@@H](CNC(=O)Cc2cscc2Br)N(C)C)cc1 ZINC000565532741 945845727 /nfs/dbraw/zinc/84/57/27/945845727.db2.gz ZKJKYGUENXTBEP-MRXNPFEDSA-N 0 3 413.406 4.194 20 0 HIADHN O=C(NCc1ccsc1Br)NC[C@H](c1cccs1)N1CCCC1 ZINC000565706296 945870969 /nfs/dbraw/zinc/87/09/69/945870969.db2.gz TXQXINCFSCAQJU-CYBMUJFWSA-N 0 3 414.394 4.208 20 0 HIADHN CC(C)N(C)c1ccc(CNC2(c3cccc(Br)c3)CCOCC2)cn1 ZINC000565867624 945899930 /nfs/dbraw/zinc/89/99/30/945899930.db2.gz TVNNBQIAVRHOHZ-UHFFFAOYSA-N 0 3 418.379 4.484 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@H](NCc2ccc(C(=O)N(CC)CC)cc2)c2ccccc21 ZINC000566392766 946019962 /nfs/dbraw/zinc/01/99/62/946019962.db2.gz ROJIVAUPEWWXNU-PKTZIBPZSA-N 0 3 408.542 4.440 20 0 HIADHN CN(C)C[C@H](NC(=O)[C@@H]1CCn2c(cnc2C2CCCCC2)C1)c1ccc(F)cc1 ZINC000566523310 946028945 /nfs/dbraw/zinc/02/89/45/946028945.db2.gz NJSDCAXDNIDFBC-KNQAVFIVSA-N 0 3 412.553 4.051 20 0 HIADHN Cc1ccc(CC(=O)N(Cc2ccccc2Br)C2CCN(C)CC2)o1 ZINC000566770981 946096446 /nfs/dbraw/zinc/09/64/46/946096446.db2.gz MOOQUWFSYSZJAK-UHFFFAOYSA-N 0 3 405.336 4.016 20 0 HIADHN COCCCN(C(=O)c1csc(-c2ccccc2Cl)n1)C1CCN(C)CC1 ZINC000566802953 946101540 /nfs/dbraw/zinc/10/15/40/946101540.db2.gz DEJZUGGAFPHSCC-UHFFFAOYSA-N 0 3 407.967 4.036 20 0 HIADHN O=C(NCCN1CCCC1)c1ccc(NCc2cc(Cl)cc3cccnc32)cc1 ZINC000566927712 946168391 /nfs/dbraw/zinc/16/83/91/946168391.db2.gz NAJFGBPGZXCXEU-UHFFFAOYSA-N 0 3 408.933 4.326 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)N[C@H](C)c2ccccc2OC(C)C)c1 ZINC000566949070 946188968 /nfs/dbraw/zinc/18/89/68/946188968.db2.gz OKQXYJSGFLRNSV-LJQANCHMSA-N 0 3 413.562 4.317 20 0 HIADHN O=C(CCCSc1ccc(Cl)cc1)Nc1cccc(CN2CC[C@H](O)C2)c1 ZINC000567069845 946232492 /nfs/dbraw/zinc/23/24/92/946232492.db2.gz ZFAUWYZEBJAROP-IBGZPJMESA-N 0 3 404.963 4.418 20 0 HIADHN O=C(CCc1ccc(Cl)s1)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000567285384 946292772 /nfs/dbraw/zinc/29/27/72/946292772.db2.gz VDUKMQPVPGQDMK-UHFFFAOYSA-N 0 3 410.942 4.133 20 0 HIADHN CN(C(=O)c1ccc(NCc2ccccc2C(F)(F)F)cc1)[C@@H]1CCCN(C)C1 ZINC000567359891 946315856 /nfs/dbraw/zinc/31/58/56/946315856.db2.gz CFVIYNLRSRRQJK-LJQANCHMSA-N 0 3 405.464 4.484 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)c1nn(-c2ccccc2Cl)cc1C)c1ccco1 ZINC000567420788 946333082 /nfs/dbraw/zinc/33/30/82/946333082.db2.gz ZRJHQUSBGGSNQV-NVXWUHKLSA-N 0 3 400.910 4.286 20 0 HIADHN Brc1cncc(Br)c1CNC[C@H]1CCOc2ccccc21 ZINC000567435034 946339907 /nfs/dbraw/zinc/33/99/07/946339907.db2.gz VFOBFIRYJKXKAW-LLVKDONJSA-N 0 3 412.125 4.263 20 0 HIADHN COc1ccc2oc([C@@H](C)N[C@@H]3CCCc4cc(S(N)(=O)=O)ccc43)c(C)c2c1 ZINC000567574028 946379343 /nfs/dbraw/zinc/37/93/43/946379343.db2.gz YNABQOXXDJKHBF-JLTOFOAXSA-N 0 3 414.527 4.125 20 0 HIADHN C[C@H](NC[C@@H](Cc1ccccc1)C(F)(F)F)c1cccc(S(=O)(=O)N(C)C)c1 ZINC000567576762 946379701 /nfs/dbraw/zinc/37/97/01/946379701.db2.gz STCGDGNXKJLHGS-MAUKXSAKSA-N 0 3 414.493 4.009 20 0 HIADHN Cc1ccccc1[C@H](CC(F)(F)F)NC(=O)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000567604519 946383059 /nfs/dbraw/zinc/38/30/59/946383059.db2.gz XUKFSQGTHPSUSG-QUCCMNQESA-N 0 3 405.464 4.412 20 0 HIADHN CN(C)CCN(C(=O)Nc1ccc(-n2ccc(C(F)(F)F)n2)cc1)C1CCCC1 ZINC000567800102 946415999 /nfs/dbraw/zinc/41/59/99/946415999.db2.gz VAKPPBPTEBQWLQ-UHFFFAOYSA-N 0 3 409.456 4.229 20 0 HIADHN C[C@@H]1CN(C(=O)CCCC(=O)c2ccc(Br)cc2)CCN(C2CCC2)C1 ZINC000568135209 946476531 /nfs/dbraw/zinc/47/65/31/946476531.db2.gz SOQAMVQNFGIBQT-INIZCTEOSA-N 0 3 421.379 4.135 20 0 HIADHN C[C@H]1[C@H](NC(=O)c2cnn(C(C)(C)C)c2C(F)(F)F)CCN1Cc1ccccc1 ZINC000568313915 946500595 /nfs/dbraw/zinc/50/05/95/946500595.db2.gz IAMGMSBXLRPKRJ-WMLDXEAASA-N 0 3 408.468 4.050 20 0 HIADHN CC(=O)Nc1cccc([C@H](C)NCCC(=O)Nc2cccc(Br)c2)c1 ZINC000568326585 946507836 /nfs/dbraw/zinc/50/78/36/946507836.db2.gz KDAMILWXSZVKTJ-ZDUSSCGKSA-N 0 3 404.308 4.087 20 0 HIADHN CN1CCN(C[C@H](Nc2ncnc3sc4ccccc4c32)c2ccccc2)CC1 ZINC000568351229 946523307 /nfs/dbraw/zinc/52/33/07/946523307.db2.gz YRTACNGOTRAYSN-IBGZPJMESA-N 0 3 403.555 4.245 20 0 HIADHN COc1ccc(CNCc2cc(Br)c(OC)c(OC)c2)c(C)c1OC ZINC000568438690 946547334 /nfs/dbraw/zinc/54/73/34/946547334.db2.gz FLIZWMFCTVSINX-UHFFFAOYSA-N 0 3 410.308 4.082 20 0 HIADHN COC(=O)C12CCC(C(=O)NC[C@@H](c3ccc(CC(C)C)cc3)N(C)C)(CC1)CC2 ZINC000568895854 946739579 /nfs/dbraw/zinc/73/95/79/946739579.db2.gz SBFLDRXSNMSZBB-ANYOXOOPSA-N 0 3 414.590 4.118 20 0 HIADHN CCCN(C)[C@H](CNC(=O)N1CCC[C@H]1C1CCOCC1)c1ccc(Cl)cc1 ZINC000569033838 946803458 /nfs/dbraw/zinc/80/34/58/946803458.db2.gz HYHBEGHABDQRCU-LEWJYISDSA-N 0 3 407.986 4.324 20 0 HIADHN CC(C)Cc1ccc([C@H](CNC(=O)c2ccc(-c3ccccn3)[nH]c2=O)N(C)C)cc1 ZINC000569044126 946807511 /nfs/dbraw/zinc/80/75/11/946807511.db2.gz UAEFLJLAUHEYMY-QHCPKHFHSA-N 0 3 418.541 4.080 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)N[C@H]2c3ccccc3CC23CCOCC3)CN1Cc1ccccc1 ZINC000569048680 946809047 /nfs/dbraw/zinc/80/90/47/946809047.db2.gz PRKIARVEKWTJKB-UCFCWBNQSA-N 0 3 419.569 4.043 20 0 HIADHN Cc1cnccc1OC1CCN(C[C@H](O)CO[C@H](C)c2ccc(Cl)cc2)CC1 ZINC000569055020 946811962 /nfs/dbraw/zinc/81/19/62/946811962.db2.gz WNIFSOSYGQJYNJ-XLIONFOSSA-N 0 3 404.938 4.025 20 0 HIADHN O=C(Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1)[C@H]1CCCSC1 ZINC000569176413 946833396 /nfs/dbraw/zinc/83/33/96/946833396.db2.gz QYTQGRHQCPBFCC-NRFANRHFSA-N 0 3 409.599 4.133 20 0 HIADHN CCN(C[C@@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)Cc1ccc(C(F)F)cc1 ZINC000569242446 946840099 /nfs/dbraw/zinc/84/00/99/946840099.db2.gz UWSZFPGTXBTLRE-HXUWFJFHSA-N 0 3 422.541 4.298 20 0 HIADHN CCN1CC[C@H](NCc2cnn(C)c2C(F)(F)F)[C@H]1c1ccc(Cl)c(F)c1 ZINC000569359149 946860555 /nfs/dbraw/zinc/86/05/55/946860555.db2.gz DINBGQSHFMQUOM-JKSUJKDBSA-N 0 3 404.839 4.157 20 0 HIADHN COc1ccc([C@@H](NC(=O)CN[C@@H]2c3ccccc3CC23CCOCC3)C(C)C)cc1 ZINC000569427879 946874318 /nfs/dbraw/zinc/87/43/18/946874318.db2.gz RJMNJECQUXSXQQ-LOSJGSFVSA-N 0 3 422.569 4.192 20 0 HIADHN COCCCN(C(=O)CSc1cc(Cl)ccc1Cl)C1CCN(C)CC1 ZINC000569519308 946885394 /nfs/dbraw/zinc/88/53/94/946885394.db2.gz CUMQULGRLZIKLR-UHFFFAOYSA-N 0 3 405.391 4.045 20 0 HIADHN CCOc1cc(CNCc2ccccc2Cn2ccnc2)cc(Br)c1O ZINC000569522411 946885570 /nfs/dbraw/zinc/88/55/70/946885570.db2.gz MJNIDBOQQRBKLT-UHFFFAOYSA-N 0 3 416.319 4.088 20 0 HIADHN COc1cc(Cl)c(NC(=O)CCCN2CCN(c3ccccc3)CC2)cc1C ZINC000569737654 946964349 /nfs/dbraw/zinc/96/43/49/946964349.db2.gz PUMABWDASKPTQW-UHFFFAOYSA-N 0 3 401.938 4.198 20 0 HIADHN C[C@H](CN1CCN(Cc2nc3sc4c(c3c(=O)[nH]2)CCCC4)CC1)c1ccccc1 ZINC000569848806 947018420 /nfs/dbraw/zinc/01/84/20/947018420.db2.gz YIOLCCBDGVWGRI-QGZVFWFLSA-N 0 3 422.598 4.197 20 0 HIADHN COc1ccccc1CNC[C@@H](O)COC(c1ccc(F)cc1)c1ccc(F)cc1 ZINC000569871912 947027120 /nfs/dbraw/zinc/02/71/20/947027120.db2.gz VBZIIPVQMLHMOK-JOCHJYFZSA-N 0 3 413.464 4.230 20 0 HIADHN CCO[C@H](C)c1nc(CN(C)C(=O)N[C@H]2CCN(Cc3ccccc3)[C@@H]2C)cs1 ZINC000569956582 947052337 /nfs/dbraw/zinc/05/23/37/947052337.db2.gz UPOUPHGECJRMMF-HLIPFELVSA-N 0 3 416.591 4.045 20 0 HIADHN CCOc1c(Cl)cc(CN(Cc2ccccc2)C[C@]2(O)CCO[C@@H]2C)cc1OC ZINC000569968637 947056374 /nfs/dbraw/zinc/05/63/74/947056374.db2.gz IWIFEFPXEQREOW-UZUQRXQVSA-N 0 3 419.949 4.289 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)c1cc(COC(C)(C)C)on1)c1ccc(Cl)cc1 ZINC000570184500 947123764 /nfs/dbraw/zinc/12/37/64/947123764.db2.gz HUBMBVFBHBXAEZ-IBGZPJMESA-N 0 3 407.942 4.456 20 0 HIADHN CN(C)C[C@@H](NC(=O)Nc1ccnc(Sc2ccccn2)c1)c1ccc(F)cc1 ZINC000570234906 947158557 /nfs/dbraw/zinc/15/85/57/947158557.db2.gz YPQDVNMHCXUVHO-GOSISDBHSA-N 0 3 411.506 4.191 20 0 HIADHN CC(C)Cc1ccc([C@H](CNC(=O)N[C@@H](C)c2ccc3c(c2)CC(=O)N3)N(C)C)cc1 ZINC000570304620 947187045 /nfs/dbraw/zinc/18/70/45/947187045.db2.gz GTWYTSMGPODPSD-SBUREZEXSA-N 0 3 422.573 4.043 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)c1ccc(COc2ccc(F)cc2)o1)c1ccco1 ZINC000570476511 947259657 /nfs/dbraw/zinc/25/96/57/947259657.db2.gz JTCZNHLLEMCTIQ-BEFAXECRSA-N 0 3 400.450 4.450 20 0 HIADHN CN(C(=O)c1ccc(NCc2ccccc2Br)cc1)[C@H]1CCCN(C)C1 ZINC000570552134 947290862 /nfs/dbraw/zinc/29/08/62/947290862.db2.gz JSUQLDLZIHVXEP-IBGZPJMESA-N 0 3 416.363 4.227 20 0 HIADHN Cc1nc2ccccn2c(=O)c1CCN1CCC[C@@H]1c1cccc(Br)c1 ZINC000570647081 947321907 /nfs/dbraw/zinc/32/19/07/947321907.db2.gz FBCNJHLLKXQWLN-LJQANCHMSA-N 0 3 412.331 4.145 20 0 HIADHN CSc1ccc([C@@H](CNC(=O)C2(c3ccc(F)cc3)CCOCC2)N(C)C)cc1 ZINC000570719199 947334137 /nfs/dbraw/zinc/33/41/37/947334137.db2.gz OBBWRARLVRKOKK-OAQYLSRUSA-N 0 3 416.562 4.015 20 0 HIADHN c1[nH]nc(-c2ccc3c(c2)OCO3)c1CN(CCc1ccccc1)Cc1cccnc1 ZINC000570729932 947337502 /nfs/dbraw/zinc/33/75/02/947337502.db2.gz PDOLJGZNVCGKMU-UHFFFAOYSA-N 0 3 412.493 4.445 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1cc2[nH]ccc2c(C(=O)OC)c1)c1ccsc1 ZINC000570757401 947347956 /nfs/dbraw/zinc/34/79/56/947347956.db2.gz FGVWRJPFVBOWKY-LJQANCHMSA-N 0 3 414.531 4.221 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)C1(c2cc(F)cc(Br)c2)CC1)c1ccco1 ZINC000570958311 947398717 /nfs/dbraw/zinc/39/87/17/947398717.db2.gz RLEVJRCMUIVXEZ-SUMWQHHRSA-N 0 3 423.326 4.458 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1ccc(-n2cccn2)c(Cl)c1)c1ccco1 ZINC000571114813 947509737 /nfs/dbraw/zinc/50/97/37/947509737.db2.gz OJMOWMWLDUWCMO-YOEHRIQHSA-N 0 3 401.898 4.370 20 0 HIADHN CC(C)[C@@]1(CO)CCCN(Cc2ccnc(-c3ccc(Br)cc3)n2)C1 ZINC000571173439 947532244 /nfs/dbraw/zinc/53/22/44/947532244.db2.gz WJZOGWHOAQLLSA-FQEVSTJZSA-N 0 3 404.352 4.137 20 0 HIADHN Cc1nnc(-c2cccc(C(=O)NC[C@@H](c3ccc(CC(C)C)cc3)N(C)C)c2)o1 ZINC000571195637 947541399 /nfs/dbraw/zinc/54/13/99/947541399.db2.gz CRICQYCJOFDPIE-QFIPXVFZSA-N 0 3 406.530 4.276 20 0 HIADHN COc1ccc(-c2nn(Cc3ccccc3)cc2CN(C)C[C@@H](C)OC)cc1OC ZINC000571364512 947623804 /nfs/dbraw/zinc/62/38/04/947623804.db2.gz ADZKQWCLGHLNDJ-GOSISDBHSA-N 0 3 409.530 4.082 20 0 HIADHN O=C1CC[C@@H]2CN([C@H]3CCCc4ccc(Br)cc43)CC[C@H]2N1C1CC1 ZINC000571389942 947634074 /nfs/dbraw/zinc/63/40/74/947634074.db2.gz BQZXEYVANISSPR-YSGRDPCXSA-N 0 3 403.364 4.302 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)c2cc(F)c(F)cc2Br)CCN1Cc1ccccc1 ZINC000571474415 947664208 /nfs/dbraw/zinc/66/42/08/947664208.db2.gz FBKNZBGXIPIGTO-XIKOKIGWSA-N 0 3 409.274 4.120 20 0 HIADHN CO[C@@H]1C[C@H](c2ccccc2)CC[C@H]1N[C@H](C)C(=O)Nc1ccc(-c2c[nH]cn2)cc1 ZINC000571588821 947717673 /nfs/dbraw/zinc/71/76/73/947717673.db2.gz VIGBESNQBUQXOV-PWFRSZSWSA-N 0 3 418.541 4.345 20 0 HIADHN CN(C)C[C@@H](NC(=O)Nc1ccc(F)cc1-c1cnn(C)c1)c1ccc(Cl)cc1 ZINC000571898443 947808324 /nfs/dbraw/zinc/80/83/24/947808324.db2.gz MPRWQHIMWWRUAC-HXUWFJFHSA-N 0 3 415.900 4.304 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@@H](C)N[C@@H](C)c2ccc(C(F)(F)F)cc2)cc1OC ZINC000571963014 947823264 /nfs/dbraw/zinc/82/32/64/947823264.db2.gz MPNVJJRBOOSLAR-LSDHHAIUSA-N 0 3 424.463 4.420 20 0 HIADHN CN1CC[C@@H](NCC(=O)NC2(c3ccccc3)CCC2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000572207744 947864877 /nfs/dbraw/zinc/86/48/77/947864877.db2.gz KJLYMTXRYYRADE-IFMALSPDSA-N 0 3 415.940 4.010 20 0 HIADHN CN1CC[C@H](N[C@H]2CCN(c3ccccc3Cl)C2=O)[C@H]1c1ccc(Cl)cc1 ZINC000572289706 947876686 /nfs/dbraw/zinc/87/66/86/947876686.db2.gz NAKPIYIKHXAESJ-CMKODMSKSA-N 0 3 404.341 4.134 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1ccc(Oc2cccnc2)nc1 ZINC000572292445 947877354 /nfs/dbraw/zinc/87/73/54/947877354.db2.gz GJKKOORHEBSUJT-IBGZPJMESA-N 0 3 417.513 4.397 20 0 HIADHN CN(C)C[C@H](NC(=O)NCc1c(F)cccc1OC(F)F)c1ccc(Cl)cc1 ZINC000572305578 947879355 /nfs/dbraw/zinc/87/93/55/947879355.db2.gz SIMZPDBLTDNSKW-INIZCTEOSA-N 0 3 415.843 4.183 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)Nc1ccc(CN(C(C)=O)C(C)C)cc1 ZINC000572747851 948000675 /nfs/dbraw/zinc/00/06/75/948000675.db2.gz KCOPJGLVRVUGQJ-UHFFFAOYSA-N 0 3 402.583 4.173 20 0 HIADHN CCn1cc(C(=O)NC[C@@H](c2ccc(CC(C)C)cc2)N(C)C)c(C(F)(F)F)n1 ZINC000573312109 948155756 /nfs/dbraw/zinc/15/57/56/948155756.db2.gz DLWRVXWLBRAKLJ-SFHVURJKSA-N 0 3 410.484 4.153 20 0 HIADHN Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C ZINC000573350329 948162445 /nfs/dbraw/zinc/16/24/45/948162445.db2.gz RCFZRKXTQRKVOH-FDDCHVKYSA-N 0 3 422.573 4.480 20 0 HIADHN C[C@@H]1[C@H](NC(=O)N(Cc2ccccc2)CC2CCOCC2)CCN1Cc1ccccc1 ZINC000573398850 948183875 /nfs/dbraw/zinc/18/38/75/948183875.db2.gz VJIDDSQLJQZDDG-PXDATVDWSA-N 0 3 421.585 4.288 20 0 HIADHN Cc1cc(NC(=O)NC[C@@H](c2cccs2)N2CCCC2)nn1C1CCCCC1 ZINC000573689923 948271813 /nfs/dbraw/zinc/27/18/13/948271813.db2.gz SVWBUXHYPGGSLC-SFHVURJKSA-N 0 3 401.580 4.717 20 0 HIADHN COc1ccc(CCC(=O)NC[C@H](c2ccc(SC)cc2)N(C)C)cc1Cl ZINC000573837962 948308223 /nfs/dbraw/zinc/30/82/23/948308223.db2.gz ZJUNAEQXDUEJGZ-LJQANCHMSA-N 0 3 406.979 4.422 20 0 HIADHN COc1coc(CN[C@H]2CCN(C(C)(C)C)[C@@H]2c2ccc(Cl)c(F)c2)cc1=O ZINC000574341603 948415768 /nfs/dbraw/zinc/41/57/68/948415768.db2.gz CSOIYIXVMCSCGU-FXAWDEMLSA-N 0 3 408.901 4.145 20 0 HIADHN C[C@H](NC[C@@H](c1ccc(Cl)cc1)N1CCOCC1)c1ccc(Br)cn1 ZINC000574456542 948447684 /nfs/dbraw/zinc/44/76/84/948447684.db2.gz ZBNUCNQZBJKJEN-LIRRHRJNSA-N 0 3 424.770 4.222 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N1CCC(OCC2CCCCC2)CC1)c1ccco1 ZINC000574783311 948525023 /nfs/dbraw/zinc/52/50/23/948525023.db2.gz QCHFWQXOKNALNT-GHTZIAJQSA-N 0 3 405.583 4.480 20 0 HIADHN COc1cc(CN2CC[C@H](C(F)(F)F)[C@H](CO)C2)c(-c2ccccc2)cc1OC ZINC000574844525 948542290 /nfs/dbraw/zinc/54/22/90/948542290.db2.gz LWANTBDRRBGNRU-HKUYNNGSSA-N 0 3 409.448 4.364 20 0 HIADHN CN(CCC(=O)Nc1cccc(Br)c1)C[C@H]1OCCc2ccccc21 ZINC000575093285 948590894 /nfs/dbraw/zinc/59/08/94/948590894.db2.gz MVMICUTVNWEFOO-LJQANCHMSA-N 0 3 403.320 4.024 20 0 HIADHN COc1ccccc1COC1CCN(Cc2c(C)nn(-c3ccccn3)c2C)CC1 ZINC000575333830 948648022 /nfs/dbraw/zinc/64/80/22/948648022.db2.gz AIWHIXOZSRKNSU-UHFFFAOYSA-N 0 3 406.530 4.074 20 0 HIADHN CC[C@H](N[C@H]1CCCc2cc(S(N)(=O)=O)ccc21)c1ccccc1OC(F)F ZINC000575360086 948653572 /nfs/dbraw/zinc/65/35/72/948653572.db2.gz PTGVBIIUZAAYAL-ROUUACIJSA-N 0 3 410.486 4.054 20 0 HIADHN O=C(CCNCc1ccc(-c2ccccc2)o1)Nc1ccc(N2CCCC2=O)cc1 ZINC000575843398 948740061 /nfs/dbraw/zinc/74/00/61/948740061.db2.gz NPTPEKLPIPGWHY-UHFFFAOYSA-N 0 3 403.482 4.192 20 0 HIADHN O[C@H](COc1ccc(-c2ccccc2)cc1)CN1CCC(F)(c2cccnc2)CC1 ZINC000575904342 948764739 /nfs/dbraw/zinc/76/47/39/948764739.db2.gz HPSSMKGVUVCBLH-QHCPKHFHSA-N 0 3 406.501 4.449 20 0 HIADHN CC[C@@H]1c2ccsc2CCN1C(=O)CN[C@@H]1c2ccccc2CC12CCOCC2 ZINC000575958245 948802143 /nfs/dbraw/zinc/80/21/43/948802143.db2.gz HPJDCQUBCAAMKL-NFBKMPQASA-N 0 3 410.583 4.268 20 0 HIADHN O=C(C[C@H]1CCCC[C@@H]1O)N(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000575976019 948805308 /nfs/dbraw/zinc/80/53/08/948805308.db2.gz NQLDYVLRSYUWNT-SDHSZQHLSA-N 0 3 421.585 4.016 20 0 HIADHN O=C(C[C@H]1CCCC[C@@H]1O)N(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000575976018 948805589 /nfs/dbraw/zinc/80/55/89/948805589.db2.gz NQLDYVLRSYUWNT-DSITVLBTSA-N 0 3 421.585 4.016 20 0 HIADHN O[C@H](CN[C@H]1CCSc2c(F)cccc21)COc1ccccc1C(F)(F)F ZINC000576068899 948818904 /nfs/dbraw/zinc/81/89/04/948818904.db2.gz XHVDYFMWFDCYGP-WBMJQRKESA-N 0 3 401.425 4.411 20 0 HIADHN CC(C)c1ccc(-c2cc(C(F)(F)N3CC[C@@H]4NCCO[C@H]4C3)c(Cl)nn2)cc1 ZINC001164389308 718826233 /nfs/dbraw/zinc/82/62/33/718826233.db2.gz HIQXMGYGKHGPEP-HKUYNNGSSA-N 0 3 422.907 4.032 20 0 HIADHN Clc1ccc2c(c1)nc(Cl)nc2N1CC[C@H]2[C@H]1CCN2Cc1cccnc1 ZINC001164726895 720381287 /nfs/dbraw/zinc/38/12/87/720381287.db2.gz PVCBEQYCDNNEHX-ZWKOTPCHSA-N 0 3 400.313 4.185 20 0 HIADHN FC(F)c1nc2ccc(Cl)cc2c(N2CC[C@@H]3[C@H]2CCN3Cc2cccnc2)n1 ZINC001164724339 720470897 /nfs/dbraw/zinc/47/08/97/720470897.db2.gz FCLZPQUNFIHBCA-QZTJIDSGSA-N 0 3 415.875 4.469 20 0 HIADHN Cc1cc(-c2ccccc2F)nnc1N1CCN2C[C@H](Oc3cccc(F)c3)C[C@@H]2C1 ZINC001164904674 721564642 /nfs/dbraw/zinc/56/46/42/721564642.db2.gz FDOJKWHRUGKMKI-UYAOXDASSA-N 0 3 422.479 4.072 20 0 HIADHN Cc1cncc(COC[C@]23CCC[C@@H]2CN(c2ccc(CN(C)C4CC4)cn2)C3)c1 ZINC001164797804 721601638 /nfs/dbraw/zinc/60/16/38/721601638.db2.gz CFOLESKVNGDPNL-RCZVLFRGSA-N 0 3 406.574 4.203 20 0 HIADHN Clc1ccc2c(c1)nccc2N1CCN(c2ncccc2CN2CCCC2)CC1 ZINC001165044538 721940043 /nfs/dbraw/zinc/94/00/43/721940043.db2.gz MNEWBSDNYKKVJB-UHFFFAOYSA-N 0 3 407.949 4.206 20 0 HIADHN Clc1cccc2c1ccnc2N1CC[C@H]2CN(Cc3cccnc3)CCO[C@@H]2C1 ZINC001164974898 722114719 /nfs/dbraw/zinc/11/47/19/722114719.db2.gz IVHDKVDGEPXQRX-PGRDOPGGSA-N 0 3 408.933 4.011 20 0 HIADHN Cc1ccc2c(c1)cc(Cl)nc2N1CC[C@H]2CN(Cc3cccnc3)CCO[C@@H]2C1 ZINC001164974251 722132046 /nfs/dbraw/zinc/13/20/46/722132046.db2.gz CSEBULPFGCCLCQ-SIKLNZKXSA-N 0 3 422.960 4.319 20 0 HIADHN Cc1cc(N2CC[C@@H]3CN(Cc4cccnc4)CCO[C@@H]3C2)nc2c(Cl)cccc12 ZINC001164984655 722132976 /nfs/dbraw/zinc/13/29/76/722132976.db2.gz YGGYPQNWHBOKRV-DENIHFKCSA-N 0 3 422.960 4.319 20 0 HIADHN Cc1ccc2c(C)cc(N3CC[C@H]4CN(Cc5cccnc5)CCO[C@@H]4C3)nc2c1C ZINC001164982769 722144041 /nfs/dbraw/zinc/14/40/41/722144041.db2.gz SHXUQSRFTJICBL-LADGPHEKSA-N 0 3 416.569 4.282 20 0 HIADHN CCn1ccnc1[C@H]1CCCCN1C(=O)[C@@H](C)N1CCC(Cc2ccccc2)CC1 ZINC000435991574 861271706 /nfs/dbraw/zinc/27/17/06/861271706.db2.gz JJDSZAWOEXMCNZ-NFBKMPQASA-N 0 3 408.590 4.300 20 0 HIADHN CC(C)CNC(=O)c1ccc(NC(=O)N(CCN(C)C)C2CCCC2)cc1Cl ZINC000436006403 861293615 /nfs/dbraw/zinc/29/36/15/861293615.db2.gz UCZLNFDWCBPLFU-UHFFFAOYSA-N 0 3 408.974 4.064 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)N(CCN(C)C)C2CCCC2)c(C(F)(F)F)c1 ZINC000436010941 861300631 /nfs/dbraw/zinc/30/06/31/861300631.db2.gz HKNLEVVDSVYWIN-UHFFFAOYSA-N 0 3 400.445 4.002 20 0 HIADHN CC[C@H](C)[C@H](NC(=O)Nc1ccc(N2CCN(CC)CC2)cc1C)C(F)(F)F ZINC000436093029 861374334 /nfs/dbraw/zinc/37/43/34/861374334.db2.gz YENYMDWFKJGAKH-KSSFIOAISA-N 0 3 400.489 4.235 20 0 HIADHN CS[C@@H]1CN(C(=O)c2c(C)onc2-c2ccc(Cl)c(Cl)c2)C[C@@H]1N(C)C ZINC000436152629 861451161 /nfs/dbraw/zinc/45/11/61/861451161.db2.gz WYUSGWVHRLPUAI-LSDHHAIUSA-N 0 3 414.358 4.074 20 0 HIADHN CS[C@H]1CN(C(=O)c2c(C)onc2-c2ccc(Cl)cc2Cl)C[C@H]1N(C)C ZINC000436153232 861453474 /nfs/dbraw/zinc/45/34/74/861453474.db2.gz XIKRDOLYSSIXAX-CABCVRRESA-N 0 3 414.358 4.074 20 0 HIADHN COc1ccc([C@@H](CNC(=S)Nc2ccc(OC(F)F)cc2)N2CCCC2)cc1 ZINC000006336008 845191196 /nfs/dbraw/zinc/19/11/96/845191196.db2.gz NFWADXVVLDODKM-LJQANCHMSA-N 0 3 421.513 4.420 20 0 HIADHN CN(C)Cc1ccccc1CNC(=O)COc1ccc(OCc2ccccc2)cc1 ZINC000006992683 845232313 /nfs/dbraw/zinc/23/23/13/845232313.db2.gz UICUIYQMSUJCOG-UHFFFAOYSA-N 0 3 404.510 4.022 20 0 HIADHN O=C1C[C@@H](NCc2c[nH]nc2-c2ccsc2)CN1c1cccc(C(F)(F)F)c1 ZINC000436286910 861593404 /nfs/dbraw/zinc/59/34/04/861593404.db2.gz RPHKMHVSOPFOFY-OAHLLOKOSA-N 0 3 406.433 4.052 20 0 HIADHN CCCCOc1ccc(C(=O)Nc2ccc(N3CCN(CC)CC3)cc2)cc1OC ZINC000011946751 845842906 /nfs/dbraw/zinc/84/29/06/845842906.db2.gz VRTMYOIQUWFMTE-UHFFFAOYSA-N 0 3 411.546 4.268 20 0 HIADHN COc1cccc([C@@H](CNC(=O)CCc2nc3ccccc3s2)N2CCCC2)c1 ZINC000017909205 846276212 /nfs/dbraw/zinc/27/62/12/846276212.db2.gz WTHRNQNOSDNIHQ-HXUWFJFHSA-N 0 3 409.555 4.191 20 0 HIADHN CC1CCN([C@@H](CNC(=O)c2cccc(N3CCCC3=O)c2)c2cccs2)CC1 ZINC000018186154 846307702 /nfs/dbraw/zinc/30/77/02/846307702.db2.gz HBKCGCXGBNQSLR-FQEVSTJZSA-N 0 3 411.571 4.078 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Cc3coc4cc5c(cc34)CCC5)cc2)CC1 ZINC000018892027 846344946 /nfs/dbraw/zinc/34/49/46/846344946.db2.gz GPYPHTNQJKIQTP-UHFFFAOYSA-N 0 3 403.526 4.245 20 0 HIADHN CCn1c(SCC(=O)C(C#N)c2nc(C)cs2)nnc1-c1cccc(Cl)c1 ZINC000020077372 846379488 /nfs/dbraw/zinc/37/94/88/846379488.db2.gz LVVCMPAUWYWMQH-CQSZACIVSA-N 0 3 417.947 4.352 20 0 HIADHN COc1ccc([C@@H](CNC(=O)Cc2nc(-c3ccccc3)oc2C)N2CCCC2)cc1 ZINC000022529462 846582844 /nfs/dbraw/zinc/58/28/44/846582844.db2.gz PLEXSOHJJJCYDC-HSZRJFAPSA-N 0 3 419.525 4.154 20 0 HIADHN O=c1[nH]c(CN2CCN(Cc3cccc4ccccc43)CC2)nc2cc(Cl)ccc21 ZINC000022788857 846620957 /nfs/dbraw/zinc/62/09/57/846620957.db2.gz AAGYWELFZZTXNC-UHFFFAOYSA-N 0 3 418.928 4.460 20 0 HIADHN C[C@H](N[C@H](CCCc1ccccc1)c1ccccc1)C(=O)Nc1ccc(C(N)=O)cc1 ZINC000022819107 846625346 /nfs/dbraw/zinc/62/53/46/846625346.db2.gz VDFAMVLXSQFLMW-YADARESESA-N 0 3 415.537 4.466 20 0 HIADHN Cc1ccc(CN2CCCN(CC(=O)Nc3cc(Cl)ccc3Cl)CC2)cc1 ZINC000022830941 846626465 /nfs/dbraw/zinc/62/64/65/846626465.db2.gz YAVVGPFLMTXHTJ-UHFFFAOYSA-N 0 3 406.357 4.448 20 0 HIADHN CCOc1ccc(OC[C@@H](O)CN2CCC(c3nc4ccccc4s3)CC2)cc1 ZINC000023410244 846696269 /nfs/dbraw/zinc/69/62/69/846696269.db2.gz QSARVYJAAZALEJ-SFHVURJKSA-N 0 3 412.555 4.314 20 0 HIADHN O=C(CCC(=O)c1ccc2c(c1)CCC2)NCc1ccccc1CN1CCCCC1 ZINC000024182569 846797923 /nfs/dbraw/zinc/79/79/23/846797923.db2.gz JEWIQMUVRXRKKG-UHFFFAOYSA-N 0 3 404.554 4.441 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3ccc(-n4nc(C)cc4C)cc3)c(C)c2)CC1 ZINC000025185731 846939052 /nfs/dbraw/zinc/93/90/52/846939052.db2.gz GUHVNKVLQOAXNX-UHFFFAOYSA-N 0 3 417.557 4.192 20 0 HIADHN COc1ccc([C@H]2CCCN2C[C@@H](O)COc2cccc3ccccc32)c(OC)c1 ZINC000025301219 846956732 /nfs/dbraw/zinc/95/67/32/846956732.db2.gz IVLIBZBRVCYRBP-AUSIDOKSSA-N 0 3 407.510 4.434 20 0 HIADHN COC(=O)c1ccc(CN(C)CCC(=O)N[C@H](c2cccs2)c2ccccc2)cc1 ZINC000026321413 847125023 /nfs/dbraw/zinc/12/50/23/847125023.db2.gz NLAAFQMNKWSQOS-QHCPKHFHSA-N 0 3 422.550 4.262 20 0 HIADHN Fc1ccc(Cn2cc(CN[C@@H]3CCO[C@@H]3c3ccc(Cl)c(F)c3)cn2)cc1 ZINC000436408801 861758740 /nfs/dbraw/zinc/75/87/40/861758740.db2.gz LFTJZUVCTNPJMF-NHCUHLMSSA-N 0 3 403.860 4.483 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)c3cccc4ccccc43)CC2)c1 ZINC000026964028 847227470 /nfs/dbraw/zinc/22/74/70/847227470.db2.gz LZUIIJYCPXXBOY-UHFFFAOYSA-N 0 3 401.554 4.480 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cc(C)n(CC(F)(F)F)c3C)c(C)c2)CC1 ZINC000027109210 847249450 /nfs/dbraw/zinc/24/94/50/847249450.db2.gz OQZUCJDALULMQB-UHFFFAOYSA-N 0 3 422.495 4.370 20 0 HIADHN COc1cc(C(=O)NC[C@H](Cc2ccccc2)N(C)C)ccc1OCc1ccccc1 ZINC000027145171 847256662 /nfs/dbraw/zinc/25/66/62/847256662.db2.gz KDOCKCMIMYWQSD-QHCPKHFHSA-N 0 3 418.537 4.177 20 0 HIADHN Cc1ccccc1CN1CCCN(C(=O)c2ccc(N3CCCCCC3)nc2)CC1 ZINC000027390547 847295401 /nfs/dbraw/zinc/29/54/01/847295401.db2.gz KIICLNOOEQVLJM-UHFFFAOYSA-N 0 3 406.574 4.119 20 0 HIADHN CCCOc1c(Cl)cc(C(=O)NC[C@@H](Cc2ccccc2)N(C)C)cc1OC ZINC000027581341 847323302 /nfs/dbraw/zinc/32/33/02/847323302.db2.gz HTLNBRHCPCRBFY-GOSISDBHSA-N 0 3 404.938 4.040 20 0 HIADHN C[C@@H](CN1CCCCC1)NC(=O)c1cnn(-c2ccc(Cl)cc2)c1C(F)(F)F ZINC000027763244 847348748 /nfs/dbraw/zinc/34/87/48/847348748.db2.gz GFDSOIPDBFOGKI-ZDUSSCGKSA-N 0 3 414.859 4.149 20 0 HIADHN Cc1cc2oc(=O)cc(CN3CCC(C(=O)NCC(F)(F)F)CC3)c2cc1C(C)C ZINC000027778798 847350812 /nfs/dbraw/zinc/35/08/12/847350812.db2.gz WWCYOOSPSBVASF-UHFFFAOYSA-N 0 3 424.463 4.115 20 0 HIADHN O=C(NC1CCN(CCc2ccccc2)CC1)c1ccccc1C(=O)c1ccccc1 ZINC000027930252 847365220 /nfs/dbraw/zinc/36/52/20/847365220.db2.gz UOLAGHHXJQGZGY-UHFFFAOYSA-N 0 3 412.533 4.355 20 0 HIADHN O=C(Nc1nc(CN2CCCCC2)cs1)c1cc(-c2ccccc2Cl)n[nH]1 ZINC000028933596 847480727 /nfs/dbraw/zinc/48/07/27/847480727.db2.gz DXQBIRPJRTVZPG-UHFFFAOYSA-N 0 3 401.923 4.425 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Cc3cccc(C(F)(F)F)c3)c(C)c2)CC1 ZINC000029375245 847554633 /nfs/dbraw/zinc/55/46/33/847554633.db2.gz VSLXTIAFKXZVGA-UHFFFAOYSA-N 0 3 405.464 4.337 20 0 HIADHN CC(C)CCSc1nc2ccccc2n1CN1CCC(NC(=O)C2CC2)CC1 ZINC000029582735 847583223 /nfs/dbraw/zinc/58/32/23/847583223.db2.gz RFZYHSHIGJWDED-UHFFFAOYSA-N 0 3 400.592 4.123 20 0 HIADHN Cc1noc(C)c1COc1cccc(C(=O)NCCCN2CCc3ccccc3C2)c1 ZINC000029837646 847629417 /nfs/dbraw/zinc/62/94/17/847629417.db2.gz WFYMSQXOKRSPIO-UHFFFAOYSA-N 0 3 419.525 4.049 20 0 HIADHN O=C(CC1(N2CCOCC2)CCCC1)N[C@H](c1ccc(F)c(Cl)c1)C(F)(F)F ZINC000436463829 861814028 /nfs/dbraw/zinc/81/40/28/861814028.db2.gz APNDTAZCRVERCC-QGZVFWFLSA-N 0 3 422.850 4.234 20 0 HIADHN Cc1ccccc1CN1CCCN(CC(=O)Nc2ccccc2C(F)(F)F)CC1 ZINC000030153759 847683430 /nfs/dbraw/zinc/68/34/30/847683430.db2.gz UHRAZESRJNDBQK-UHFFFAOYSA-N 0 3 405.464 4.160 20 0 HIADHN O=C(NC1CCN(Cc2cn(-c3ccccc3)nc2-c2ccccc2)CC1)C1CC1 ZINC000030283068 847697514 /nfs/dbraw/zinc/69/75/14/847697514.db2.gz YUQUYNCMYSMGLI-UHFFFAOYSA-N 0 3 400.526 4.030 20 0 HIADHN COc1cc2c(cc1OC)[C@@H](c1cccs1)N(C[C@@H](O)Cc1ccccc1)CC2 ZINC000436483158 861819717 /nfs/dbraw/zinc/81/97/17/861819717.db2.gz JRUCEUSQJRONEO-CYFREDJKSA-N 0 3 409.551 4.316 20 0 HIADHN CC(=O)Nc1ccc(OC[C@H](O)CN(Cc2ccccc2)Cc2ccccc2)cc1 ZINC000030529754 847729355 /nfs/dbraw/zinc/72/93/55/847729355.db2.gz YHVVCCVTEQKEAR-XMMPIXPASA-N 0 3 404.510 4.087 20 0 HIADHN CNC(=O)c1ccc(CN(C)C[C@@H](O)COc2cc(C)c(Cl)cc2C(C)C)cc1 ZINC000030533962 847730408 /nfs/dbraw/zinc/73/04/08/847730408.db2.gz JPSPFSTZBKHFJF-LJQANCHMSA-N 0 3 418.965 4.003 20 0 HIADHN CC(C)(CNC(=O)Cc1csc(Cc2ccccc2)n1)N1CCc2ccccc2C1 ZINC000030637282 847749905 /nfs/dbraw/zinc/74/99/05/847749905.db2.gz PNMKNZKOLOASPK-UHFFFAOYSA-N 0 3 419.594 4.230 20 0 HIADHN CNC(=O)c1ccc(CNCc2cn(-c3ccccc3)nc2-c2ccc(F)cc2)cc1 ZINC000030671985 847756447 /nfs/dbraw/zinc/75/64/47/847756447.db2.gz KSFSKMNPKIKDGM-UHFFFAOYSA-N 0 3 414.484 4.328 20 0 HIADHN O=C(NCCc1ccc(C(F)(F)F)cc1)NC[C@@H](c1cccs1)N1CCCC1 ZINC000030989154 847805942 /nfs/dbraw/zinc/80/59/42/847805942.db2.gz IBINCHDTLOWGFT-KRWDZBQOSA-N 0 3 411.493 4.446 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@@H](C)c1cc(OC)ccc1OC)c1ccsc1 ZINC000031193929 847839958 /nfs/dbraw/zinc/83/99/58/847839958.db2.gz MFBHIWQZOJMKNG-HNAYVOBHSA-N 0 3 405.564 4.209 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCc1cccnc1OC1CCCC1)c1ccsc1 ZINC000031195517 847840799 /nfs/dbraw/zinc/84/07/99/847840799.db2.gz HNJUZOQTAWAMIJ-HXUWFJFHSA-N 0 3 416.591 4.347 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)CCC(=O)c3ccc(Cl)cc3)c(C)c2)CC1 ZINC000031522558 847899965 /nfs/dbraw/zinc/89/99/65/847899965.db2.gz NTUQHYAEZBKNGB-UHFFFAOYSA-N 0 3 413.949 4.392 20 0 HIADHN C[C@@H](C1CC1)N(CC(=O)N(Cc1cccs1)c1ccc2c(c1)OCCO2)C1CC1 ZINC000031654899 847923951 /nfs/dbraw/zinc/92/39/51/847923951.db2.gz LIXYVDFFAQBLPV-INIZCTEOSA-N 0 3 412.555 4.315 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1ccccc1OC[C@H]1CCCO1)c1ccsc1 ZINC000031984373 847974997 /nfs/dbraw/zinc/97/49/97/847974997.db2.gz YWYOQRYVITXENP-QUCCMNQESA-N 0 3 402.560 4.119 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1[nH]c(C)c(C(=O)OC(C)C)c1C)c1ccsc1 ZINC000031987001 847975942 /nfs/dbraw/zinc/97/59/42/847975942.db2.gz AZHPQAJPZUDXHV-KRWDZBQOSA-N 0 3 405.564 4.071 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Cn1c2ccccc2nc1C(F)(F)F)c1ccsc1 ZINC000031988691 847975983 /nfs/dbraw/zinc/97/59/83/847975983.db2.gz KPORCFXYTCFQFG-QGZVFWFLSA-N 0 3 424.492 4.316 20 0 HIADHN C[C@@H](CN1CCCCC1)NC(=O)c1cccnc1Oc1ccc(Br)cc1 ZINC000032247158 847994069 /nfs/dbraw/zinc/99/40/69/847994069.db2.gz GPOVMHIDDIFRIV-HNNXBMFYSA-N 0 3 418.335 4.241 20 0 HIADHN COc1ccc(-c2nc(C)c(C(=O)NC[C@H](Cc3ccccc3)N(C)C)s2)cc1 ZINC000032245749 847994189 /nfs/dbraw/zinc/99/41/89/847994189.db2.gz DQPAHMNNQSFDSQ-IBGZPJMESA-N 0 3 409.555 4.030 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)c1cccnc1Sc1ccccc1 ZINC000032401101 848020339 /nfs/dbraw/zinc/02/03/39/848020339.db2.gz IRYZBBGVKOMTMQ-UHFFFAOYSA-N 0 3 403.551 4.411 20 0 HIADHN O=C(CCCc1ncc(-c2ccccc2)o1)N1CCCN(Cc2ccccc2)CC1 ZINC000033226793 848128623 /nfs/dbraw/zinc/12/86/23/848128623.db2.gz QDRDUJXIMHDOOL-UHFFFAOYSA-N 0 3 403.526 4.399 20 0 HIADHN C[C@H](Oc1ccc(Br)cc1)C(=O)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000036883709 848171920 /nfs/dbraw/zinc/17/19/20/848171920.db2.gz OSRAZGJCVKQBAL-JXFKEZNVSA-N 0 3 417.347 4.170 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1ccc(CSc2nccn2C)o1)c1ccsc1 ZINC000041427939 848214536 /nfs/dbraw/zinc/21/45/36/848214536.db2.gz JUJCJPWXGHVCRO-KRWDZBQOSA-N 0 3 418.588 4.180 20 0 HIADHN CCN(CC)[C@H](CNC(=O)C[C@H]1c2ccccc2C=CN1C(C)=O)c1ccsc1 ZINC000041441271 848215589 /nfs/dbraw/zinc/21/55/89/848215589.db2.gz XBHJQPVKDRGIIV-FCHUYYIVSA-N 0 3 411.571 4.211 20 0 HIADHN CSCC[C@H](NC(=O)c1ccccc1)C(=O)C(C#N)c1nc2ccccc2s1 ZINC000041503766 848222781 /nfs/dbraw/zinc/22/27/81/848222781.db2.gz KDXRCGAVIKNCGS-RDJZCZTQSA-N 0 3 409.536 4.024 20 0 HIADHN COc1cc(CN[C@@H](C)c2ccc(SC)cc2)ccc1OCC(=O)N1CCCC1 ZINC000042202598 848300224 /nfs/dbraw/zinc/30/02/24/848300224.db2.gz FAJZDKOECFQJCS-KRWDZBQOSA-N 0 3 414.571 4.269 20 0 HIADHN O=C(COc1ccccc1CNCCOc1ccc2ccccc2c1)N1CCCC1 ZINC000042202672 848300259 /nfs/dbraw/zinc/30/02/59/848300259.db2.gz VWQCHWPQAAJXRH-UHFFFAOYSA-N 0 3 404.510 4.010 20 0 HIADHN COc1cc(-c2noc([C@H]3CN(Cc4ccccc4)CCC3(F)F)n2)ccc1O ZINC000436680918 861892436 /nfs/dbraw/zinc/89/24/36/861892436.db2.gz LUSDGXVPSAYVFC-MRXNPFEDSA-N 0 3 401.413 4.076 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N(C)Cc3cccc(Cl)c3)c(C)c2)CC1 ZINC000043522957 848435913 /nfs/dbraw/zinc/43/59/13/848435913.db2.gz QVEDYGXBVHCVQE-UHFFFAOYSA-N 0 3 400.954 4.454 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N(C)Cc3ccc(F)c(F)c3)c(C)c2)CC1 ZINC000043522514 848435995 /nfs/dbraw/zinc/43/59/95/848435995.db2.gz GNVDJUZGDDOZHD-UHFFFAOYSA-N 0 3 402.489 4.079 20 0 HIADHN CC(=O)Nc1cccc(NC(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)c1 ZINC000043656375 848447061 /nfs/dbraw/zinc/44/70/61/848447061.db2.gz YZPVHJYFPQTMER-IBGZPJMESA-N 0 3 400.548 4.301 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1ccccc1N1CCCC1=O)c1ccsc1 ZINC000043852252 848478829 /nfs/dbraw/zinc/47/88/29/848478829.db2.gz PIEYGNFGEZKDAK-LJQANCHMSA-N 0 3 400.548 4.080 20 0 HIADHN Cc1cc([C@H](C)[NH2+]C2CCN(C(=O)c3ccccc3[O-])CC2)sc1Br ZINC000436720998 861908371 /nfs/dbraw/zinc/90/83/71/861908371.db2.gz KTZDNPPBHMCHSI-ZDUSSCGKSA-N 0 3 423.376 4.480 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1ccc(C(=O)N2CCCC2)cc1)c1ccsc1 ZINC000044014069 848499544 /nfs/dbraw/zinc/49/95/44/848499544.db2.gz TVUQUGCSIUVHOL-FQEVSTJZSA-N 0 3 414.575 4.189 20 0 HIADHN CN(C)C[C@H]1CCc2ccccc2N1C(=O)c1cnc(-c2ccc3c(c2)OCO3)s1 ZINC000436724337 861910150 /nfs/dbraw/zinc/91/01/50/861910150.db2.gz NPUIORHZDSUWOT-QGZVFWFLSA-N 0 3 421.522 4.062 20 0 HIADHN C[C@@H](c1ccccc1Cl)N1CCN(C(=O)Nc2cccc(CN(C)C)c2)CC1 ZINC000044277002 848539422 /nfs/dbraw/zinc/53/94/22/848539422.db2.gz PNICAXDAXJFSRG-KRWDZBQOSA-N 0 3 400.954 4.312 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)c1cccc(OCc2cccnc2)c1 ZINC000044315089 848544474 /nfs/dbraw/zinc/54/44/74/848544474.db2.gz BDCGEPRZPQBGSU-NRFANRHFSA-N 0 3 407.539 4.289 20 0 HIADHN O=C(Nc1ccc(C[NH+]2CCCCCC2)cc1)[C@@H]1CCCN1C(=O)c1ccccc1[O-] ZINC000436740707 861924173 /nfs/dbraw/zinc/92/41/73/861924173.db2.gz ZJRPIFUONBABHP-QFIPXVFZSA-N 0 3 421.541 4.012 20 0 HIADHN CN(C)Cc1cccc(NC(=O)NCc2ccc(N3CCc4ccccc4C3)nc2)c1 ZINC000046205383 848802098 /nfs/dbraw/zinc/80/20/98/848802098.db2.gz QPUUHQADQMRHKO-UHFFFAOYSA-N 0 3 415.541 4.028 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N(C)CC(=O)Nc1cccc(C)c1C)c1ccsc1 ZINC000046252772 848812266 /nfs/dbraw/zinc/81/22/66/848812266.db2.gz OVFDSJNAKATLJF-HXUWFJFHSA-N 0 3 416.591 4.028 20 0 HIADHN COc1cc2c(cc1OC)[C@@H](c1ccccc1)N(CCC(=O)N1CCCCC1)CC2 ZINC000046502747 848862170 /nfs/dbraw/zinc/86/21/70/848862170.db2.gz GCXFASROCFOABT-RUZDIDTESA-N 0 3 408.542 4.054 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3sc(-c4ccc(C)o4)nc3C)cc2)CC1 ZINC000046691782 848912322 /nfs/dbraw/zinc/91/23/22/848912322.db2.gz SWKJFKJUWFQZCB-UHFFFAOYSA-N 0 3 410.543 4.414 20 0 HIADHN Cc1cc(C)n(-c2ccc(CC(=O)NC[C@@H](c3cccs3)N3CCCC3)cc2)n1 ZINC000046765706 848930630 /nfs/dbraw/zinc/93/06/30/848930630.db2.gz XRYLZTCLLYGHJX-NRFANRHFSA-N 0 3 408.571 4.046 20 0 HIADHN C[C@H]1CCCCN1CCNC(=O)c1cnn(-c2ccc(Cl)cc2)c1C(F)(F)F ZINC000046857795 848949137 /nfs/dbraw/zinc/94/91/37/848949137.db2.gz ZLYGNCGBTKZNFJ-ZDUSSCGKSA-N 0 3 414.859 4.149 20 0 HIADHN C[C@@H]1CCCCN1CCNC(=O)c1cnn(-c2ccc(Cl)cc2)c1C(F)(F)F ZINC000046857793 848949510 /nfs/dbraw/zinc/94/95/10/848949510.db2.gz ZLYGNCGBTKZNFJ-CYBMUJFWSA-N 0 3 414.859 4.149 20 0 HIADHN CC(C)(C)NC(=O)c1cccc(NC(=O)NC[C@@H](c2cccs2)N2CCCC2)c1 ZINC000047586446 849078675 /nfs/dbraw/zinc/07/86/75/849078675.db2.gz TVDVRZRTSHAGGT-SFHVURJKSA-N 0 3 414.575 4.235 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)Nc1cccc(OCc2cccnc2)c1 ZINC000047585532 849078846 /nfs/dbraw/zinc/07/88/46/849078846.db2.gz WUXDFAHLBWFVKL-UHFFFAOYSA-N 0 3 404.514 4.256 20 0 HIADHN CC(C)(C)NC(=O)c1cccc(NC(=O)NC[C@H](c2ccccc2)N2CCCC2)c1 ZINC000047586444 849079037 /nfs/dbraw/zinc/07/90/37/849079037.db2.gz BIPMMTHGXLMFQS-OAQYLSRUSA-N 0 3 408.546 4.174 20 0 HIADHN COc1ccc(CN[C@H](C)c2ccc3c(c2)CCC(=O)N3)cc1OCc1cccnc1 ZINC000047826854 849123824 /nfs/dbraw/zinc/12/38/24/849123824.db2.gz OLPLRTXADLEZDK-QGZVFWFLSA-N 0 3 417.509 4.405 20 0 HIADHN O=C(NCc1csc(Br)c1)NC[C@@H](c1cccs1)N1CCCC1 ZINC000047956420 849143552 /nfs/dbraw/zinc/14/35/52/849143552.db2.gz GWQBOLRWXNXBBW-ZDUSSCGKSA-N 0 3 414.394 4.208 20 0 HIADHN COc1cc(C(C)=O)ccc1OC[C@@H](O)CN(Cc1cccc(Cl)c1)C(C)C ZINC000047959202 849144634 /nfs/dbraw/zinc/14/46/34/849144634.db2.gz AADMFDCOFLNDBT-FQEVSTJZSA-N 0 3 405.922 4.202 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1ccc(C(=O)NC(C)C)cc1)c1ccsc1 ZINC000048106739 849167997 /nfs/dbraw/zinc/16/79/97/849167997.db2.gz JDRWZIBXHUFITO-IBGZPJMESA-N 0 3 402.564 4.091 20 0 HIADHN COC(=O)c1cc(NC(=O)NC[C@@H](c2cccs2)N2CCCC2)ccc1Cl ZINC000048128026 849173295 /nfs/dbraw/zinc/17/32/95/849173295.db2.gz RIWVLGOFPKSUMI-INIZCTEOSA-N 0 3 407.923 4.147 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)[C@H](C)Sc2ccc(NC(C)=O)cc2)N(C)C)cc1 ZINC000048184800 849186684 /nfs/dbraw/zinc/18/66/84/849186684.db2.gz ZBGDSLRYPWVDDX-KSFYIVLOSA-N 0 3 413.587 4.107 20 0 HIADHN CC(=O)Nc1ccc(S[C@@H](C)C(=O)NC[C@H](c2ccccc2)N2CCCC2)cc1 ZINC000048185618 849187346 /nfs/dbraw/zinc/18/73/46/849187346.db2.gz JODSBDFBUHCQKX-HTAPYJJXSA-N 0 3 411.571 4.079 20 0 HIADHN CCC(=O)Nc1ccc(NC(=O)NC[C@H](c2cccc(OC)c2)N2CCCC2)cc1 ZINC000048390453 849216581 /nfs/dbraw/zinc/21/65/81/849216581.db2.gz ACHSCYIPBKGEPF-OAQYLSRUSA-N 0 3 410.518 4.002 20 0 HIADHN COCCOc1cccc(CNCc2cn(-c3ccccc3)nc2-c2ccncc2)c1 ZINC000048744961 849261572 /nfs/dbraw/zinc/26/15/72/849261572.db2.gz NPLTZMIUTCXHKK-UHFFFAOYSA-N 0 3 414.509 4.249 20 0 HIADHN CC[C@H](NCc1ccc(-n2ccnc2)cc1)c1ccccc1OCC(=O)N1CCCC1 ZINC000048750466 849263881 /nfs/dbraw/zinc/26/38/81/849263881.db2.gz FWEUFZDLMQVKFD-QHCPKHFHSA-N 0 3 418.541 4.114 20 0 HIADHN Cc1nccn1-c1ccc(CNCc2cccc(OCc3cccc(C#N)c3)c2)cn1 ZINC000048782561 849268448 /nfs/dbraw/zinc/26/84/48/849268448.db2.gz TVPNBVTVGMJQDU-UHFFFAOYSA-N 0 3 409.493 4.316 20 0 HIADHN CCCCCCNC(=O)C(C#N)C(=O)Cc1c(C)nn(-c2ccc(Cl)cc2)c1C ZINC000049229471 849298871 /nfs/dbraw/zinc/29/88/71/849298871.db2.gz AEUIPYAXGMGNAJ-FQEVSTJZSA-N 0 3 414.937 4.090 20 0 HIADHN Cc1cc(Cl)c2c(c1)[C@H]([NH2+]C1CCN(C(=O)c3ccccc3[O-])CC1)CCCO2 ZINC000436825990 862007176 /nfs/dbraw/zinc/00/71/76/862007176.db2.gz GCSQHIHWADCHGZ-HXUWFJFHSA-N 0 3 414.933 4.462 20 0 HIADHN CC(C)OCCCNC(=O)C1CCN(Cc2ccc(SC(F)F)cc2)CC1 ZINC000050031157 849343074 /nfs/dbraw/zinc/34/30/74/849343074.db2.gz KGBAXVOERZATKV-UHFFFAOYSA-N 0 3 400.535 4.145 20 0 HIADHN C[C@H]([NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1)c1ccc(Br)c(F)c1 ZINC000436829041 862009166 /nfs/dbraw/zinc/00/91/66/862009166.db2.gz OEEXUNIHLZFYRL-ZDUSSCGKSA-N 0 3 421.310 4.249 20 0 HIADHN Cc1nc(-c2cccnc2)sc1[C@@H](C)[NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1 ZINC000436831809 862012477 /nfs/dbraw/zinc/01/24/77/862012477.db2.gz TZRLLANKLWKIES-OAHLLOKOSA-N 0 3 422.554 4.175 20 0 HIADHN O=C(c1ccccc1[O-])N1CCC([NH2+][C@H]2CCc3c2cccc3Br)CC1 ZINC000436835075 862014228 /nfs/dbraw/zinc/01/42/28/862014228.db2.gz TXHRWXIEMMYNLR-IBGZPJMESA-N 0 3 415.331 4.036 20 0 HIADHN O=C(NC1CCN(Cc2ccc(OCc3cccnc3)cc2)CC1)C1CCCCC1 ZINC000050963017 849423149 /nfs/dbraw/zinc/42/31/49/849423149.db2.gz MJYUMSHSCJCGEK-UHFFFAOYSA-N 0 3 407.558 4.322 20 0 HIADHN O=C(Nc1ccccc1)NC1CCN(Cc2ccc(OCc3cccnc3)cc2)CC1 ZINC000050961356 849423181 /nfs/dbraw/zinc/42/31/81/849423181.db2.gz RSBLYFYYUAMSSS-UHFFFAOYSA-N 0 3 416.525 4.447 20 0 HIADHN Cc1ccc(C(=O)NC2CCN(Cc3cccc(OCC(F)(F)F)c3)CC2)s1 ZINC000051098062 849432283 /nfs/dbraw/zinc/43/22/83/849432283.db2.gz GVIBSBWOTMTMIP-UHFFFAOYSA-N 0 3 412.477 4.392 20 0 HIADHN Cc1cc2ncn(C[C@@H](O)CN3CCC[C@@H]3c3nc4ccccc4s3)c2cc1C ZINC000051117917 849433192 /nfs/dbraw/zinc/43/31/92/849433192.db2.gz WLECEMGLMPGSRK-FXAWDEMLSA-N 0 3 406.555 4.461 20 0 HIADHN C[C@H](C(=O)NCCc1c[nH]c2ccccc12)N(C)C[C@@H]1CCCO[C@@H]1c1ccccc1 ZINC000051132454 849434360 /nfs/dbraw/zinc/43/43/60/849434360.db2.gz NPHWPBWCPZRSMF-RZTXVSJASA-N 0 3 419.569 4.315 20 0 HIADHN C[C@H](C(=O)NCc1ccc(Cl)cc1)N(C)C[C@@H]1CCCO[C@@H]1c1ccccc1 ZINC000051132848 849434570 /nfs/dbraw/zinc/43/45/70/849434570.db2.gz TTXPRIHHUNHZIJ-PIPMEXSNSA-N 0 3 400.950 4.444 20 0 HIADHN N#CC(C(=O)CCCNc1ccc([N+](=O)[O-])cc1)c1nc2ccccc2n1C(F)F ZINC000051655916 849498863 /nfs/dbraw/zinc/49/88/63/849498863.db2.gz FLXXPXAHMVACFR-OAHLLOKOSA-N 0 3 413.384 4.408 20 0 HIADHN Cc1ccccc1[C@@H]1CCCN1CC(=O)N1CCC(C(=O)Nc2ccccc2)CC1 ZINC000052211705 849560608 /nfs/dbraw/zinc/56/06/08/849560608.db2.gz MVXZPSMZQWZPPK-QHCPKHFHSA-N 0 3 405.542 4.009 20 0 HIADHN CN(C)[C@H](CNC(=O)N(CCc1ccccc1)Cc1cccnc1)Cc1ccccc1 ZINC000052499439 849588934 /nfs/dbraw/zinc/58/89/34/849588934.db2.gz QDHADNIAQCHLBV-VWLOTQADSA-N 0 3 416.569 4.009 20 0 HIADHN CC[C@H](CNC(=O)c1cccc(NC(=O)c2ccco2)c1)N1CCc2ccccc2C1 ZINC000052591751 849600243 /nfs/dbraw/zinc/60/02/43/849600243.db2.gz JQNVTDNEVPHGFE-JOCHJYFZSA-N 0 3 417.509 4.099 20 0 HIADHN Cc1ccccc1CN1CCCN(C(=O)c2cccc(NC(=O)c3ccco3)c2)CC1 ZINC000052777239 849627524 /nfs/dbraw/zinc/62/75/24/849627524.db2.gz IEGUOKFMTCDRBD-UHFFFAOYSA-N 0 3 417.509 4.188 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)c3c[nH]cc3-c3ccccc3)CC2)c1 ZINC000052903738 849641181 /nfs/dbraw/zinc/64/11/81/849641181.db2.gz VVHXLMYBLADYIS-UHFFFAOYSA-N 0 3 416.569 4.322 20 0 HIADHN O=C(NC1CCN(Cc2ccccc2)CC1)c1ccnc(OCc2ccccc2)c1 ZINC000053027980 849657466 /nfs/dbraw/zinc/65/74/66/849657466.db2.gz OMWOBSGFKUZHMQ-UHFFFAOYSA-N 0 3 401.510 4.055 20 0 HIADHN Cc1cc(C(=O)N(CC(C)C)C2CCN(C)CC2)cc(C)c1OCc1cccnc1 ZINC000053232715 849682673 /nfs/dbraw/zinc/68/26/73/849682673.db2.gz MEMQZWMFAVAIBC-UHFFFAOYSA-N 0 3 409.574 4.470 20 0 HIADHN CN(Cc1ccc(OC(F)F)cc1)C(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000053548282 849730682 /nfs/dbraw/zinc/73/06/82/849730682.db2.gz IWSVBEBKUUHHFZ-QGZVFWFLSA-N 0 3 409.502 4.328 20 0 HIADHN CC(C)(C)[C@H](NCc1cc(=O)n2cc(Br)ccc2n1)c1ccccc1 ZINC000053618071 849738011 /nfs/dbraw/zinc/73/80/11/849738011.db2.gz NWQBFHNKWDECFW-LJQANCHMSA-N 0 3 400.320 4.334 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)c2cccc(OCc3cccnc3)c2)C1 ZINC000054223013 849829110 /nfs/dbraw/zinc/82/91/10/849829110.db2.gz KXEUIAZRDQUGAP-CVDCTZTESA-N 0 3 401.510 4.226 20 0 HIADHN Cc1ccc(C(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)cc1NC(=O)c1ccco1 ZINC000054226080 849829181 /nfs/dbraw/zinc/82/91/81/849829181.db2.gz HQKDKNYBRGKHSW-RXVVDRJESA-N 0 3 417.509 4.406 20 0 HIADHN COc1ccc(Br)c(C(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)c1 ZINC000054227209 849829314 /nfs/dbraw/zinc/82/93/14/849829314.db2.gz JGFGMWXLQNQENC-HOCLYGCPSA-N 0 3 403.320 4.023 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)Nc2nc(CN3CCCCC3)cs2)C1 ZINC000054382556 849855624 /nfs/dbraw/zinc/85/56/24/849855624.db2.gz LRZADKCORQDZEV-MJGOQNOKSA-N 0 3 413.591 4.086 20 0 HIADHN Cc1ccc(C(=O)C2CCN(C[C@@H](O)COCc3ccccc3Cl)CC2)cc1 ZINC000054421726 849863936 /nfs/dbraw/zinc/86/39/36/849863936.db2.gz CDHYOVKSYYIZIV-OAQYLSRUSA-N 0 3 401.934 4.121 20 0 HIADHN CN(CCNC(=O)Nc1cccc(NC(=O)c2ccccc2)c1)Cc1ccccc1 ZINC000054431629 849866323 /nfs/dbraw/zinc/86/63/23/849866323.db2.gz XBIDOSXKAKSKTF-UHFFFAOYSA-N 0 3 402.498 4.192 20 0 HIADHN CC[C@@H](C)NC(=O)c1ccc(NC(=O)NC[C@@H](c2cccs2)N2CCCC2)cc1 ZINC000054478314 849876047 /nfs/dbraw/zinc/87/60/47/849876047.db2.gz QHDTZAVLWYLVBK-APWZRJJASA-N 0 3 414.575 4.235 20 0 HIADHN CC(=O)Nc1ccc([O-])c(C(=O)NCc2ccccc2-c2ccc(C[NH+](C)C)cc2)c1 ZINC000055190346 849984153 /nfs/dbraw/zinc/98/41/53/849984153.db2.gz HOPYQQRFBULVBB-UHFFFAOYSA-N 0 3 417.509 4.009 20 0 HIADHN CCN1CCN(c2ccc(N[C@@H](C)C(=O)N[C@@H](C)c3ccccc3C)c(C)c2)CC1 ZINC000056170380 850269832 /nfs/dbraw/zinc/26/98/32/850269832.db2.gz FIVYMTMTKGNNSL-SFTDATJTSA-N 0 3 408.590 4.123 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)NCc1ccccc1)c1ccc(NC(=O)c2ccc(F)cc2)cc1 ZINC000056207208 850284001 /nfs/dbraw/zinc/28/40/01/850284001.db2.gz GFKKRYDRAPSQGV-MSOLQXFVSA-N 0 3 419.500 4.434 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)N[C@H](C)c2ccc(Br)cc2)o1 ZINC000056795022 850486319 /nfs/dbraw/zinc/48/63/19/850486319.db2.gz HBIARZGQKVZIBM-OAHLLOKOSA-N 0 3 408.340 4.185 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)N[C@@H]1CCOc2c(Cl)cccc21 ZINC000056804644 850488990 /nfs/dbraw/zinc/48/89/90/850488990.db2.gz WFHYACLGRHBOET-SJORKVTESA-N 0 3 405.951 4.361 20 0 HIADHN C=CCSc1nc2ccccc2n1CN1CCC(NC(=O)c2ccsc2)CC1 ZINC000057106788 850549054 /nfs/dbraw/zinc/54/90/54/850549054.db2.gz DCYSRGDZHQEHPZ-UHFFFAOYSA-N 0 3 412.584 4.228 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)C2(c3ccc(Cl)cc3)CCOCC2)C1 ZINC000057263709 850594560 /nfs/dbraw/zinc/59/45/60/850594560.db2.gz MRUXLPMBNDEYNL-AVRDEDQJSA-N 0 3 412.961 4.340 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)Nc2nnc(-c3ccsc3)s2)N(C)C)cc1 ZINC000057788887 850716805 /nfs/dbraw/zinc/71/68/05/850716805.db2.gz FNZMHEDELHCYSL-MRXNPFEDSA-N 0 3 401.561 4.253 20 0 HIADHN Cc1cc(NC(=O)NC[C@H](c2ccccc2)N(C)C)ccc1NC(=O)c1ccco1 ZINC000057791371 850717020 /nfs/dbraw/zinc/71/70/20/850717020.db2.gz KRSWVRRJLAVXKS-HXUWFJFHSA-N 0 3 406.486 4.265 20 0 HIADHN Cc1c2cc(F)ccc2sc1C(=O)Nc1ccc2oc(=O)n(CCN(C)C)c2c1 ZINC000058740419 850908531 /nfs/dbraw/zinc/90/85/31/850908531.db2.gz MHKMASUBVQTSQG-UHFFFAOYSA-N 0 3 413.474 4.071 20 0 HIADHN CCN(CC)[C@H](CNC(=O)C[C@H](NC(C)=O)c1ccc(Cl)cc1)c1ccsc1 ZINC000058954500 850968571 /nfs/dbraw/zinc/96/85/71/850968571.db2.gz UOQIKABTQMYVCY-VQTJNVASSA-N 0 3 421.994 4.168 20 0 HIADHN CCCc1noc2nc(C3CC3)cc(C(=O)N(CCN(C)C)Cc3ccc(F)cc3)c12 ZINC000059000856 850976712 /nfs/dbraw/zinc/97/67/12/850976712.db2.gz ZDJBTEBGRCTHMW-UHFFFAOYSA-N 0 3 424.520 4.396 20 0 HIADHN Cc1ccc(C(=O)N(CCN(C)C)Cc2ccc(F)cc2)cc1NC(=O)c1ccco1 ZINC000059002713 850976819 /nfs/dbraw/zinc/97/68/19/850976819.db2.gz ATOFYEDFMRPEQK-UHFFFAOYSA-N 0 3 423.488 4.183 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Cn2c3ccccc3nc2SC(F)F)N(C)C)cc1 ZINC000060155996 851047334 /nfs/dbraw/zinc/04/73/34/851047334.db2.gz BOBWIJVZOTXIIK-SFHVURJKSA-N 0 3 418.513 4.079 20 0 HIADHN CN(C)CCN(C(=O)C[C@H](NC(=O)c1ccccc1)c1ccccc1)c1ccccc1 ZINC000060208823 851051983 /nfs/dbraw/zinc/05/19/83/851051983.db2.gz OXTCPNLOFPSRBL-DEOSSOPVSA-N 0 3 415.537 4.143 20 0 HIADHN COc1cc(Br)ccc1CN[C@H](CCn1cncn1)c1ccc(C)cc1 ZINC000437020412 862202121 /nfs/dbraw/zinc/20/21/21/862202121.db2.gz VTTYKZZVJFWIBE-LJQANCHMSA-N 0 3 415.335 4.279 20 0 HIADHN Cc1cc(C)c(NC(=S)NCc2ccc(CN3CCN(C)CC3)cc2)c(Cl)c1 ZINC000060432808 851097984 /nfs/dbraw/zinc/09/79/84/851097984.db2.gz YJQMHLCNUYHHRM-UHFFFAOYSA-N 0 3 417.022 4.191 20 0 HIADHN Cc1sc2ncnc(Sc3ccccc3C(=O)N[C@@H]3CCN(C4CC4)C3)c2c1C ZINC000060470415 851110639 /nfs/dbraw/zinc/11/06/39/851110639.db2.gz WVDDEYSCDMZDBH-OAHLLOKOSA-N 0 3 424.595 4.426 20 0 HIADHN COc1cc(CN(C)C(=O)NC[C@H](c2ccccc2)N2CCCC2)ccc1SC ZINC000060529348 851134645 /nfs/dbraw/zinc/13/46/45/851134645.db2.gz XQAKEDDCEYFACW-HXUWFJFHSA-N 0 3 413.587 4.396 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)c3ccc(-c4ccccc4F)o3)cc2)CC1 ZINC000060551570 851144372 /nfs/dbraw/zinc/14/43/72/851144372.db2.gz FZLANLCEVCLGCX-UHFFFAOYSA-N 0 3 407.489 4.476 20 0 HIADHN CC(C)(C)N1CCCN(C(=O)C(=O)Nc2ccccc2Sc2ccccc2)CC1 ZINC000060690504 851192473 /nfs/dbraw/zinc/19/24/73/851192473.db2.gz CDQMEMPGIZDFAC-UHFFFAOYSA-N 0 3 411.571 4.109 20 0 HIADHN C[C@H](Oc1ccccc1Cl)C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000061288082 851339469 /nfs/dbraw/zinc/33/94/69/851339469.db2.gz QSSQTUQOKYKPGQ-INIZCTEOSA-N 0 3 404.963 4.337 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1cnc2c(cnn2C(C)C)c1)c1ccsc1 ZINC000061352624 851355678 /nfs/dbraw/zinc/35/56/78/851355678.db2.gz HPLJLYIRMUKDMV-SFHVURJKSA-N 0 3 400.552 4.278 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2ccc(CC(=O)NC(C)C)cc2)N2CCCC2)cc1 ZINC000061749750 851438562 /nfs/dbraw/zinc/43/85/62/851438562.db2.gz ROUOJZJLJNNECK-QHCPKHFHSA-N 0 3 422.573 4.021 20 0 HIADHN O=C(NCc1cc(-c2ccccc2)no1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000061791407 851454053 /nfs/dbraw/zinc/45/40/53/851454053.db2.gz LSQYUKOXGBLORN-UHFFFAOYSA-N 0 3 422.554 4.255 20 0 HIADHN COc1ccc([C@@H](C)NC(=O)Nc2ccc(CCN3CCSCC3)cc2)cc1F ZINC000061793092 851455604 /nfs/dbraw/zinc/45/56/04/851455604.db2.gz JYMCPHBFZBQNEX-MRXNPFEDSA-N 0 3 417.550 4.308 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)C(=O)Nc1cccc(Cl)c1Cl)c1ccccc1 ZINC000061878779 851467667 /nfs/dbraw/zinc/46/76/67/851467667.db2.gz WPHRPWYFGZNJMX-KRWDZBQOSA-N 0 3 408.329 4.131 20 0 HIADHN C[C@H](NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1)c1ccc(NC(=O)C2CC2)cc1 ZINC000061973556 851484606 /nfs/dbraw/zinc/48/46/06/851484606.db2.gz VLOFQVDLIHDEDP-MBSDFSHPSA-N 0 3 420.557 4.060 20 0 HIADHN COc1ccc(C2(CN[C@H](C(=O)N3CCCCC3)c3ccccc3)CCOCC2)cc1 ZINC000062242563 851514216 /nfs/dbraw/zinc/51/42/16/851514216.db2.gz KRVJRCRFAGZYTM-DEOSSOPVSA-N 0 3 422.569 4.087 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)Nc1ccccc1N1CCCC1=O ZINC000062379768 851535317 /nfs/dbraw/zinc/53/53/17/851535317.db2.gz CCKIKXYFVMYDRX-UHFFFAOYSA-N 0 3 414.937 4.063 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)Nc1cccc(NC(=O)C2CC2)c1 ZINC000062385602 851538097 /nfs/dbraw/zinc/53/80/97/851538097.db2.gz PKBKOIWHFBUZBP-UHFFFAOYSA-N 0 3 414.937 4.284 20 0 HIADHN CC(C)C(=O)Nc1cccc(NC(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)c1 ZINC000062385418 851538249 /nfs/dbraw/zinc/53/82/49/851538249.db2.gz WZVQCSNYXBQFMN-UHFFFAOYSA-N 0 3 418.488 4.155 20 0 HIADHN CCCOC(=O)c1ccc(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2F)cc1 ZINC000062390389 851539325 /nfs/dbraw/zinc/53/93/25/851539325.db2.gz AKPCODCOEVVUDK-UHFFFAOYSA-N 0 3 419.472 4.127 20 0 HIADHN CCC(=O)Nc1ccc(C)c(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2F)c1 ZINC000062392288 851539766 /nfs/dbraw/zinc/53/97/66/851539766.db2.gz GVMREPNTPJXLFA-UHFFFAOYSA-N 0 3 418.488 4.217 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)Nc1ccc(OCc2ccccc2)nc1 ZINC000062400917 851541928 /nfs/dbraw/zinc/54/19/28/851541928.db2.gz OUNWZWFGQMVANN-UHFFFAOYSA-N 0 3 422.504 4.395 20 0 HIADHN CCCC(=O)Nc1cccc(NC(=O)N(CCN(C)C)Cc2cccc(F)c2)c1C ZINC000062411195 851546387 /nfs/dbraw/zinc/54/63/87/851546387.db2.gz ATOHTZYZKISYCC-UHFFFAOYSA-N 0 3 414.525 4.468 20 0 HIADHN C[C@H](NC(=O)N(CCN(C)C)Cc1cccc(F)c1)c1ccc(Br)cc1 ZINC000062474718 851559169 /nfs/dbraw/zinc/55/91/69/851559169.db2.gz KMZUIHZGHQYBEJ-HNNXBMFYSA-N 0 3 422.342 4.423 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)NCc1ccccc1OC(F)F ZINC000062477332 851559955 /nfs/dbraw/zinc/55/99/55/851559955.db2.gz DLLZLHJSRMIIFM-UHFFFAOYSA-N 0 3 411.880 4.215 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)NCC1(c2ccccc2)CCC1 ZINC000062477113 851560179 /nfs/dbraw/zinc/56/01/79/851560179.db2.gz IDXRUIZCRQGTNF-UHFFFAOYSA-N 0 3 401.501 4.160 20 0 HIADHN CC(=O)Nc1cccc([C@@H](C)NC(=O)N(CCN(C)C)Cc2cccc(Cl)c2)c1 ZINC000062484364 851562985 /nfs/dbraw/zinc/56/29/85/851562985.db2.gz OWEJQVANQFEZBO-MRXNPFEDSA-N 0 3 416.953 4.133 20 0 HIADHN Cc1nccc(-c2cccc(NC(=S)NC3CCN(Cc4ccccc4)CC3)c2)n1 ZINC000063149019 851622317 /nfs/dbraw/zinc/62/23/17/851622317.db2.gz PTNQKEMHYWWIHJ-UHFFFAOYSA-N 0 3 417.582 4.403 20 0 HIADHN COc1ccc(S(=O)(=O)NCC2CCN(Cc3ccccc3)CC2)c2ccccc12 ZINC000063182168 851629134 /nfs/dbraw/zinc/62/91/34/851629134.db2.gz CENZCUUXDAAQGO-UHFFFAOYSA-N 0 3 424.566 4.039 20 0 HIADHN CCOc1ccc([C@@H](CNC(=O)CN(C)C(C)C)c2c[nH]c3ccccc32)cc1OC ZINC000063465168 851695715 /nfs/dbraw/zinc/69/57/15/851695715.db2.gz QASCLQNGBMSGGQ-HXUWFJFHSA-N 0 3 423.557 4.164 20 0 HIADHN CC(=O)NCc1ccc(-c2csc(NC3CCN(Cc4ccccc4)CC3)n2)o1 ZINC000063630533 851729661 /nfs/dbraw/zinc/72/96/61/851729661.db2.gz AJBVAUJOKZNRPL-UHFFFAOYSA-N 0 3 410.543 4.116 20 0 HIADHN CCN(CC)CC(=O)NCCc1cn(-c2ccccc2)nc1-c1ccc(Cl)cc1 ZINC000063700346 851742921 /nfs/dbraw/zinc/74/29/21/851742921.db2.gz KPPCIFROABNNJW-UHFFFAOYSA-N 0 3 410.949 4.193 20 0 HIADHN Cc1ccccc1-n1ncc(C(=O)N2CCCN(C(C)(C)C)CC2)c1C(F)(F)F ZINC000063724125 851749157 /nfs/dbraw/zinc/74/91/57/851749157.db2.gz HKOMUQPGDXKSNG-UHFFFAOYSA-N 0 3 408.468 4.146 20 0 HIADHN Cc1c(Cl)cccc1-n1ccnc1SCC(=O)N1CCCN(C(C)(C)C)CC1 ZINC000063725554 851749339 /nfs/dbraw/zinc/74/93/39/851749339.db2.gz RCGOQKQEYRFTQV-UHFFFAOYSA-N 0 3 421.010 4.259 20 0 HIADHN NC(=O)c1ccsc1NC(=O)CCN1CC=C(c2cccc3ccccc32)CC1 ZINC000063762551 851757532 /nfs/dbraw/zinc/75/75/32/851757532.db2.gz VBTDXNAGUWOQBF-UHFFFAOYSA-N 0 3 405.523 4.118 20 0 HIADHN C[C@@H]1CCCN(C(=O)CN(C)CCCCCc2cc(-c3cccc(F)c3)no2)C1 ZINC000063763795 851757658 /nfs/dbraw/zinc/75/76/58/851757658.db2.gz AJRCNDKNHZCTLH-GOSISDBHSA-N 0 3 401.526 4.384 20 0 HIADHN O=C(c1cccc(CN2CCCC2)c1)N1CCCN(Cc2ccc(Cl)cc2)CC1 ZINC000063916152 851793654 /nfs/dbraw/zinc/79/36/54/851793654.db2.gz RMAMPSBPWUMEIH-UHFFFAOYSA-N 0 3 411.977 4.284 20 0 HIADHN O=C(Nc1ccc(=O)n(Cc2ccccc2Cl)c1)c1cccc(CN2CCCC2)c1 ZINC000064027205 851817748 /nfs/dbraw/zinc/81/77/48/851817748.db2.gz GTRIDCVNTSPPPU-UHFFFAOYSA-N 0 3 421.928 4.398 20 0 HIADHN CCN(Cc1cccs1)C[C@H](O)COc1ccc(Cl)cc1Br ZINC000064138588 851834831 /nfs/dbraw/zinc/83/48/31/851834831.db2.gz AATIZENBQRTNNK-ZDUSSCGKSA-N 0 3 404.757 4.426 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)Nc1ccc(N(C)C)cc1 ZINC000064519077 851917224 /nfs/dbraw/zinc/91/72/24/851917224.db2.gz HJPUHQCAHSSHTP-UHFFFAOYSA-N 0 3 408.468 4.367 20 0 HIADHN C[C@H](NC(=O)C1CCCCC1)C(=O)C(C#N)c1nc(-c2c(F)cccc2F)cs1 ZINC000064715430 851964991 /nfs/dbraw/zinc/96/49/91/851964991.db2.gz INROUDMDJLRSKT-GXTWGEPZSA-N 0 3 417.481 4.350 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)c1cc(-c2cccc(Cl)c2)on1 ZINC000064743386 851974308 /nfs/dbraw/zinc/97/43/08/851974308.db2.gz BLOCUNNGFOOWEO-UHFFFAOYSA-N 0 3 401.869 4.338 20 0 HIADHN C[C@@H](Cc1ccsc1)NC(=O)N(CCN(C)C)Cc1ccc(C(F)(F)F)cc1 ZINC000064758887 851979031 /nfs/dbraw/zinc/97/90/31/851979031.db2.gz SRFBBIRRWCMKNK-HNNXBMFYSA-N 0 3 413.509 4.471 20 0 HIADHN Cc1c(C(=O)NCCN(C)Cc2ccccc2)cnn1-c1cccc(C(F)(F)F)c1 ZINC000064805014 851986665 /nfs/dbraw/zinc/98/66/65/851986665.db2.gz IIIUOUUWQTZYSP-UHFFFAOYSA-N 0 3 416.447 4.061 20 0 HIADHN CCOc1ccc(NC(=O)c2ccc(NC(=O)CN(C)C(C3CC3)C3CC3)cc2)cc1 ZINC000065243448 852093143 /nfs/dbraw/zinc/09/31/43/852093143.db2.gz HTAVGTVTFZNCPI-UHFFFAOYSA-N 0 3 421.541 4.397 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCCc1c[nH]c2cc(F)ccc12)c1ccsc1 ZINC000065285741 852099953 /nfs/dbraw/zinc/09/99/53/852099953.db2.gz NREAMVBXUGYZEJ-FQEVSTJZSA-N 0 3 402.539 4.293 20 0 HIADHN CC[C@@H](C)NC(=O)c1ccc(NC(=O)NC[C@H](c2ccc(C)cc2)N(C)C)c(C)c1 ZINC000065419771 852126786 /nfs/dbraw/zinc/12/67/86/852126786.db2.gz GHKJBPINBXNQNP-XMSQKQJNSA-N 0 3 410.562 4.256 20 0 HIADHN CCN(CC)C(=O)c1ccc(NC(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)cc1 ZINC000065438371 852132781 /nfs/dbraw/zinc/13/27/81/852132781.db2.gz IVZLFEATRYMNFN-XMSQKQJNSA-N 0 3 408.546 4.126 20 0 HIADHN COc1cc(CN(C)C(=O)NC[C@@H](c2ccc(C)cc2)N(C)C)ccc1OC(F)F ZINC000065469072 852144888 /nfs/dbraw/zinc/14/48/88/852144888.db2.gz GXDWCRUKSGVICP-SFHVURJKSA-N 0 3 421.488 4.049 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)Nc1cccc(N2CCCC2)c1 ZINC000065478079 852150151 /nfs/dbraw/zinc/15/01/51/852150151.db2.gz JRFBJNGSYJSHGA-UHFFFAOYSA-N 0 3 421.589 4.011 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)NCc2ccc(N3CCCCCC3)nc2)C1 ZINC000065522979 852167918 /nfs/dbraw/zinc/16/79/18/852167918.db2.gz AYDLCCGCYKSGOQ-REWPJTCUSA-N 0 3 421.589 4.097 20 0 HIADHN Cc1ccc([C@@H](C)NC(=O)NCCCCN2CCN(c3cccc(C)c3)CC2)s1 ZINC000065528048 852169278 /nfs/dbraw/zinc/16/92/78/852169278.db2.gz MRGCDYFPTGWRJB-HXUWFJFHSA-N 0 3 414.619 4.328 20 0 HIADHN CCCCO[C@H](C)C(=O)Nc1sc2c(c1C(=O)OCC)CC(C)(C)NC2(C)C ZINC000065529658 852169518 /nfs/dbraw/zinc/16/95/18/852169518.db2.gz AFWOEIGIEBFIGT-CYBMUJFWSA-N 0 3 410.580 4.228 20 0 HIADHN CCN(CC)c1ccc(/C=[NH+]/C[C@H](c2ccc(Cl)cc2)N2CCOCC2)c([O-])c1 ZINC000065691476 852220977 /nfs/dbraw/zinc/22/09/77/852220977.db2.gz MWCJGPNNJCALMF-NJRDNMGOSA-N 0 3 415.965 4.384 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCc1nc(C)cs1)c1ccc(C(F)(F)F)cc1 ZINC000065696515 852223365 /nfs/dbraw/zinc/22/33/65/852223365.db2.gz HWVNYYGOYDGKLT-INIZCTEOSA-N 0 3 414.497 4.353 20 0 HIADHN COCCCCN(Cc1ccccc1)C(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000065896772 852307659 /nfs/dbraw/zinc/30/76/59/852307659.db2.gz SHWACNSHSGPIIO-QHCPKHFHSA-N 0 3 412.549 4.493 20 0 HIADHN COc1ccc2oc(C(=O)N(CCN(C)C)Cc3ccc(F)cc3F)c(C)c2c1 ZINC000065937978 852326145 /nfs/dbraw/zinc/32/61/45/852326145.db2.gz OKYQWKVXNIADAS-UHFFFAOYSA-N 0 3 402.441 4.232 20 0 HIADHN Cc1oc(-c2cccs2)nc1C(=O)N(CCN(C)C)Cc1ccc(F)cc1F ZINC000065937610 852326280 /nfs/dbraw/zinc/32/62/80/852326280.db2.gz KKXQVXIGSHRIQZ-UHFFFAOYSA-N 0 3 405.470 4.194 20 0 HIADHN Cc1nc2ccccc2c(C)c1CC(=O)N(CCN(C)C)Cc1ccc(F)cc1F ZINC000065937384 852326453 /nfs/dbraw/zinc/32/64/53/852326453.db2.gz ALUICUFHEPWNMU-UHFFFAOYSA-N 0 3 411.496 4.263 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)CCc1ccc(-c2ccccc2)[nH]1 ZINC000065937472 852326485 /nfs/dbraw/zinc/32/64/85/852326485.db2.gz CPUWMQDILZKSNC-UHFFFAOYSA-N 0 3 411.496 4.483 20 0 HIADHN COc1ccc(S[C@H](C)C(=O)N(CCN(C)C)Cc2ccc(F)cc2F)cc1 ZINC000065937549 852326831 /nfs/dbraw/zinc/32/68/31/852326831.db2.gz HWEQZHPBLITGTJ-OAHLLOKOSA-N 0 3 408.514 4.044 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)c1cnc(-c2ccccc2F)s1 ZINC000065937418 852326977 /nfs/dbraw/zinc/32/69/77/852326977.db2.gz SXNKXECTNYVZNE-UHFFFAOYSA-N 0 3 419.472 4.431 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)c1cccc(NC(=O)OC(C)(C)C)c1 ZINC000065940091 852329836 /nfs/dbraw/zinc/32/98/36/852329836.db2.gz FSGPTTMRXDXKNY-UHFFFAOYSA-N 0 3 415.509 4.377 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)Nc1ccc(-n2cccn2)c(F)c1 ZINC000065984021 852339918 /nfs/dbraw/zinc/33/99/18/852339918.db2.gz ZFZSWECIOYSLAD-UHFFFAOYSA-N 0 3 415.900 4.261 20 0 HIADHN COc1ccc(/C=C/C(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)cc1OC ZINC000069210914 852388981 /nfs/dbraw/zinc/38/89/81/852388981.db2.gz QWNSYSHRIWDLRM-QRBZPYHOSA-N 0 3 414.571 4.368 20 0 HIADHN Cc1ccc(C(=O)NC[C@H](c2ccccc2)N2CCCC2)cc1NC(=O)c1ccco1 ZINC000069251114 852389875 /nfs/dbraw/zinc/38/98/75/852389875.db2.gz DKJUXSKFTJNJMV-JOCHJYFZSA-N 0 3 417.509 4.407 20 0 HIADHN O=C(COCc1ccccc1)Nc1ccc(N2CCN(Cc3ccccc3)CC2)cc1 ZINC000069707294 852400677 /nfs/dbraw/zinc/40/06/77/852400677.db2.gz JHMLJHJNAUTWDI-UHFFFAOYSA-N 0 3 415.537 4.164 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3CCc4c(F)ccc(F)c4C3)c(C)c2)CC1 ZINC000437165672 862359094 /nfs/dbraw/zinc/35/90/94/862359094.db2.gz VTRHZCKCHYRRTG-UHFFFAOYSA-N 0 3 414.500 4.005 20 0 HIADHN CC[C@@H](C)c1ccc([C@H](NCC(=O)NC2CCC3(CC2)OCCO3)C(C)C)cc1 ZINC000072016022 852466477 /nfs/dbraw/zinc/46/64/77/852466477.db2.gz MDWKAOVGMASROF-WZONZLPQSA-N 0 3 402.579 4.289 20 0 HIADHN COCCOc1c(Cl)cccc1NC(=O)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000072041852 852482236 /nfs/dbraw/zinc/48/22/36/852482236.db2.gz BHZMVKQIAQOFLW-FQEVSTJZSA-N 0 3 417.937 4.324 20 0 HIADHN CN(C(=O)Cc1ccc(-c2ccccc2)cc1)C1CCN(CCc2ccccn2)CC1 ZINC000072054318 852488826 /nfs/dbraw/zinc/48/88/26/852488826.db2.gz OBMHAEZFCUIFLZ-UHFFFAOYSA-N 0 3 413.565 4.457 20 0 HIADHN Cc1occc1C(=O)NC1CCN(CCCOc2cccc(C(F)(F)F)c2)CC1 ZINC000072093016 852506786 /nfs/dbraw/zinc/50/67/86/852506786.db2.gz WCQCPKOMZVTILI-UHFFFAOYSA-N 0 3 410.436 4.270 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1sc(C)cc1OC(F)F)c1cccc(OC)c1 ZINC000079309391 852542140 /nfs/dbraw/zinc/54/21/40/852542140.db2.gz RGNQDBDLLPKFOU-INIZCTEOSA-N 0 3 412.502 4.479 20 0 HIADHN C[C@@H](NC(=O)N[C@H](CN1CCCC1)c1ccccc1)c1ccc(OC(F)F)cc1 ZINC000097204867 852588948 /nfs/dbraw/zinc/58/89/48/852588948.db2.gz ZIRSSAWPGMMPTN-OXQOHEQNSA-N 0 3 403.473 4.485 20 0 HIADHN CCN1CCN(Cc2ccc(CNCc3csc(-c4ccc(F)cc4)n3)cc2)CC1 ZINC000097357257 852604575 /nfs/dbraw/zinc/60/45/75/852604575.db2.gz XLFIUOUKXVPMMO-UHFFFAOYSA-N 0 3 424.589 4.377 20 0 HIADHN Cc1ccc(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1NC(=O)c1ccccc1 ZINC000106062335 852750076 /nfs/dbraw/zinc/75/00/76/852750076.db2.gz AIWUIDCNMWAUSM-QHCPKHFHSA-N 0 3 413.521 4.252 20 0 HIADHN COc1cccc(CO[C@@H](C)C(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)c1 ZINC000106287015 852767999 /nfs/dbraw/zinc/76/79/99/852767999.db2.gz ZJGJOORMPFNDQW-RXVVDRJESA-N 0 3 416.587 4.251 20 0 HIADHN CN(C)[C@@H](CNC(=O)CCSc1ccccc1Br)c1ccccc1 ZINC000107535844 852773817 /nfs/dbraw/zinc/77/38/17/852773817.db2.gz MHBLLJLTIUGYMI-KRWDZBQOSA-N 0 3 407.377 4.350 20 0 HIADHN CCOc1cccc2cc([C@H](C)NC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)oc21 ZINC000107708925 852788101 /nfs/dbraw/zinc/78/81/01/852788101.db2.gz LXEDRLGZTFFJQL-FXAWDEMLSA-N 0 3 407.514 4.466 20 0 HIADHN O=C(Nc1ccc(OCc2ccccc2)nc1)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000108120788 852824152 /nfs/dbraw/zinc/82/41/52/852824152.db2.gz SICCBPVAQNVBHL-JOCHJYFZSA-N 0 3 402.498 4.057 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)/C=C/c3nc4ccccc4s3)cc2)CC1 ZINC000108477442 852854676 /nfs/dbraw/zinc/85/46/76/852854676.db2.gz LEDQMNXPZGOJKS-VAWYXSNFSA-N 0 3 406.555 4.086 20 0 HIADHN CN(CCNC(=O)c1cccnc1SCc1ccc(F)cc1)Cc1ccccc1 ZINC000108871615 852888044 /nfs/dbraw/zinc/88/80/44/852888044.db2.gz XNOSDOFTXWKCAQ-UHFFFAOYSA-N 0 3 409.530 4.375 20 0 HIADHN COc1ccc2[nH]cc(C3CCN(Cc4cc(=O)n5cc(Cl)ccc5n4)CC3)c2c1 ZINC000108971063 852901845 /nfs/dbraw/zinc/90/18/45/852901845.db2.gz OYRKKXCWHSOJGI-UHFFFAOYSA-N 0 3 422.916 4.217 20 0 HIADHN O=C(Cc1cn(-c2ccccc2)nc1-c1ccc(Cl)cc1)N[C@@H]1CCN(C2CC2)C1 ZINC000109029128 852911343 /nfs/dbraw/zinc/91/13/43/852911343.db2.gz OYCYCONIZBAQBR-HXUWFJFHSA-N 0 3 420.944 4.088 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2ccccc2NC(=O)c2ccccc2)N(C)C)cc1 ZINC000109289382 852947367 /nfs/dbraw/zinc/94/73/67/852947367.db2.gz QRCCMTLRUSOJFK-HSZRJFAPSA-N 0 3 401.510 4.280 20 0 HIADHN Cc1noc(C)c1COc1cccc(C(=O)NC[C@@H](c2ccc(C)cc2)N(C)C)c1 ZINC000109288734 852947646 /nfs/dbraw/zinc/94/76/46/852947646.db2.gz XHCAYUAUQXNMRV-QHCPKHFHSA-N 0 3 407.514 4.212 20 0 HIADHN CCN(Cc1ccc(OC)c(OC)c1)C(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000109338681 852954958 /nfs/dbraw/zinc/95/49/58/852954958.db2.gz BSRXIMBQXRPAGB-FQEVSTJZSA-N 0 3 414.521 4.104 20 0 HIADHN Cc1cc(C)n(-c2cccc(NC(=O)[C@H]3CCCN(Cc4cccc(F)c4)C3)c2)n1 ZINC000109339350 852955774 /nfs/dbraw/zinc/95/57/74/852955774.db2.gz IPPVKVLATIHSBP-FQEVSTJZSA-N 0 3 406.505 4.479 20 0 HIADHN O=C(NC1CCCCC1)NC1CCN(Cc2ccc(OCc3ccccn3)cc2)CC1 ZINC000109356384 852958046 /nfs/dbraw/zinc/95/80/46/852958046.db2.gz LCCKIHCEJKBOSS-UHFFFAOYSA-N 0 3 422.573 4.257 20 0 HIADHN COCCOc1ccc(NC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)cc1 ZINC000109547887 852982999 /nfs/dbraw/zinc/98/29/99/852982999.db2.gz BHUVQMWYRYIWTB-OAQYLSRUSA-N 0 3 422.447 4.105 20 0 HIADHN Cc1ccc(C(=O)NC2CCN(CCOc3ccc(Br)cc3)CC2)s1 ZINC000109604308 852991067 /nfs/dbraw/zinc/99/10/67/852991067.db2.gz PIUBABMHZFMZDA-UHFFFAOYSA-N 0 3 423.376 4.092 20 0 HIADHN CN(C(=O)c1ccc2[nH]c3c(c2c1)CCCC3)C1CCN(CCc2ccccn2)CC1 ZINC000109794862 853016247 /nfs/dbraw/zinc/01/62/47/853016247.db2.gz RLCDDFRPVQAKTI-UHFFFAOYSA-N 0 3 416.569 4.221 20 0 HIADHN CN(C(=O)c1cnc(-c2ccccc2F)s1)C1CCN(CCc2ccccn2)CC1 ZINC000109809205 853017446 /nfs/dbraw/zinc/01/74/46/853017446.db2.gz LCVADVHAXBBQGV-UHFFFAOYSA-N 0 3 424.545 4.123 20 0 HIADHN Cc1cc(Sc2ncccn2)ccc1NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000110075849 853056745 /nfs/dbraw/zinc/05/67/45/853056745.db2.gz AMYDJVBAJMITAM-LJQANCHMSA-N 0 3 419.554 4.332 20 0 HIADHN Cc1c(C(=O)N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)sc2cccc(F)c12 ZINC000110408484 853096499 /nfs/dbraw/zinc/09/64/99/853096499.db2.gz ICVAUBJMPQWUTH-GASCZTMLSA-N 0 3 404.551 4.310 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)CCc3ccc(Cl)cc3Cl)CC2)C[C@H](C)O1 ZINC000110453827 853101180 /nfs/dbraw/zinc/10/11/80/853101180.db2.gz JSJOQSRKJXAHOB-IYBDPMFKSA-N 0 3 413.389 4.274 20 0 HIADHN COc1ccc2cc([C@H](C)C(=O)N3CCC(CN4C[C@@H](C)O[C@H](C)C4)CC3)ccc2c1 ZINC000110454946 853102338 /nfs/dbraw/zinc/10/23/38/853102338.db2.gz YLBCDOILDGUPPS-AQNXPRMDSA-N 0 3 424.585 4.300 20 0 HIADHN C[C@H](CNc1nc(C2CC2)nc2scc(-c3ccccc3)c21)N1CCN(C)CC1 ZINC000110670268 853135630 /nfs/dbraw/zinc/13/56/30/853135630.db2.gz XRQQSMCQYRYASI-MRXNPFEDSA-N 0 3 407.587 4.284 20 0 HIADHN COc1cc(C(=O)N(C)CCN2CCCC2)ccc1OCc1ccccc1Cl ZINC000110915417 853167144 /nfs/dbraw/zinc/16/71/44/853167144.db2.gz ALFSRWSJLTVXHH-UHFFFAOYSA-N 0 3 402.922 4.095 20 0 HIADHN CN(C)C(=O)Sc1ccccc1NC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000111011795 853187306 /nfs/dbraw/zinc/18/73/06/853187306.db2.gz CXSWFEHVXKQOBM-KRWDZBQOSA-N 0 3 415.534 4.450 20 0 HIADHN COc1ccc(C)cc1NC(=O)[C@H](C)N(C)CCCc1cc(-c2ccc(F)cc2)n[nH]1 ZINC000111178137 853217822 /nfs/dbraw/zinc/21/78/22/853217822.db2.gz RTBKNPLDMSQDLA-KRWDZBQOSA-N 0 3 424.520 4.424 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(NCc3ccccc3C[N@@H+]3CCC[C@@H](C)C3)nc2)n1 ZINC000111221854 853226826 /nfs/dbraw/zinc/22/68/26/853226826.db2.gz WMSRSMDFZJVTFN-GOSISDBHSA-N 0 3 417.557 4.238 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(NCc3ccccc3C[N@H+]3CCC[C@@H](C)C3)nc2)n1 ZINC000111221854 853226838 /nfs/dbraw/zinc/22/68/38/853226838.db2.gz WMSRSMDFZJVTFN-GOSISDBHSA-N 0 3 417.557 4.238 20 0 HIADHN CCN(C(=O)c1ccc2c(c1)NC(=O)[C@H](C)S2)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000115678242 853259587 /nfs/dbraw/zinc/25/95/87/853259587.db2.gz CQMZLAWKHKPLPJ-ZWOKBUDYSA-N 0 3 423.582 4.417 20 0 HIADHN CCCN(C(=O)c1ccc(Cn2cccn2)cc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000116557298 853315109 /nfs/dbraw/zinc/31/51/09/853315109.db2.gz CAMYIELUQBPVJY-RUZDIDTESA-N 0 3 416.569 4.448 20 0 HIADHN Cn1ccnc1[C@H](NC(=O)c1cccc(CN2CCCC2)c1)c1ccc(Cl)cc1 ZINC000139235576 853406576 /nfs/dbraw/zinc/40/65/76/853406576.db2.gz SVHZGOMDIWNXRP-OAQYLSRUSA-N 0 3 408.933 4.189 20 0 HIADHN C[C@@H]1CN(c2ccc(NC(=O)c3cccc(CN4CCCC4)c3)cc2F)C[C@H](C)O1 ZINC000139282523 853407349 /nfs/dbraw/zinc/40/73/49/853407349.db2.gz ITKMYMBLLAWAMP-HDICACEKSA-N 0 3 411.521 4.287 20 0 HIADHN C[C@@H]1CN(c2ccc(NC(=O)c3cccc(CN4CCCC4)c3)cc2F)C[C@@H](C)O1 ZINC000139282657 853407363 /nfs/dbraw/zinc/40/73/63/853407363.db2.gz ITKMYMBLLAWAMP-QZTJIDSGSA-N 0 3 411.521 4.287 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(Cl)c1CNC1CCN(C(=O)C(C)(C)C)CC1 ZINC000139569049 853414152 /nfs/dbraw/zinc/41/41/52/853414152.db2.gz IFZSBRZAZNEELR-UHFFFAOYSA-N 0 3 406.933 4.100 20 0 HIADHN C[C@@H](CCc1ccc(O)cc1)NC(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000139931994 853427259 /nfs/dbraw/zinc/42/72/59/853427259.db2.gz GMIJTOHIJRKODS-SFHVURJKSA-N 0 3 413.587 4.126 20 0 HIADHN Cc1cc(C)c(NC(=O)[C@@H](C)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c(Cl)c1 ZINC000140190668 853437633 /nfs/dbraw/zinc/43/76/33/853437633.db2.gz WPFAAYSOLYIJJE-ZWKOTPCHSA-N 0 3 415.965 4.471 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(N2CCOCC2)cc1)C(=O)Nc1ccc2ccccc2c1 ZINC000140202623 853437716 /nfs/dbraw/zinc/43/77/16/853437716.db2.gz ZWYVDJLTZIUBIN-RBUKOAKNSA-N 0 3 403.526 4.354 20 0 HIADHN C[C@H](NC1(CNS(=O)(=O)c2cccc3ccccc32)CCOCC1)c1ccccc1 ZINC000437246204 862465074 /nfs/dbraw/zinc/46/50/74/862465074.db2.gz MLDKMSOUHXBYCJ-IBGZPJMESA-N 0 3 424.566 4.018 20 0 HIADHN COCCN1CCC(NC(=O)N[C@@H](C)c2ccc(Oc3ccccc3)c(F)c2)CC1 ZINC000140448681 853445080 /nfs/dbraw/zinc/44/50/80/853445080.db2.gz ZTGNZTHQPXTZOU-KRWDZBQOSA-N 0 3 415.509 4.089 20 0 HIADHN COc1ccccc1N1CCC(N[C@@H](C(=O)N2CCCCC2)c2ccccc2)CC1 ZINC000146708736 853575816 /nfs/dbraw/zinc/57/58/16/853575816.db2.gz BAKGQLZMFZIIQX-XMMPIXPASA-N 0 3 407.558 4.007 20 0 HIADHN N#CC(C(=O)Nc1ccccc1Cl)C(=O)c1ccnc(OCc2ccccc2)c1 ZINC000150156156 853639515 /nfs/dbraw/zinc/63/95/15/853639515.db2.gz BMNPKWNXMMRODE-KRWDZBQOSA-N 0 3 405.841 4.275 20 0 HIADHN C[C@@H](SCC(=O)N(Cc1ccco1)C1CCN(C)CC1)c1nc2ccccc2[nH]1 ZINC000195540901 853674951 /nfs/dbraw/zinc/67/49/51/853674951.db2.gz QDKUHAUSFVFPJT-MRXNPFEDSA-N 0 3 412.559 4.073 20 0 HIADHN COCCOc1ccc(NC(=O)N[C@@H](CN2CCCC2)c2ccccc2)cc1Cl ZINC000195581672 853694647 /nfs/dbraw/zinc/69/46/47/853694647.db2.gz LYWSSFWYUGHJFM-FQEVSTJZSA-N 0 3 417.937 4.324 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)N[C@@H](CN2CCCC2)c2ccccc2)cc1 ZINC000195612955 853714209 /nfs/dbraw/zinc/71/42/09/853714209.db2.gz KFTZNROETGSZMY-AVRDEDQJSA-N 0 3 408.546 4.174 20 0 HIADHN Cc1ccc(N2CCC(C(=O)Nc3ccccc3-c3nnc(C(C)C)[nH]3)CC2)nc1 ZINC000195628279 853724813 /nfs/dbraw/zinc/72/48/13/853724813.db2.gz MUWYXCBEDHLAKP-UHFFFAOYSA-N 0 3 404.518 4.154 20 0 HIADHN O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)N1CCC[C@@H](c2nc3ccccc3o2)C1 ZINC000195648560 853737035 /nfs/dbraw/zinc/73/70/35/853737035.db2.gz ZAVMLGCAMYBAFK-NHCUHLMSSA-N 0 3 418.541 4.381 20 0 HIADHN COc1ccc2[nH]cc(C3CCN([C@@H](C)C(=O)N4CCc5ccccc5C4)CC3)c2c1 ZINC000195653865 853739606 /nfs/dbraw/zinc/73/96/06/853739606.db2.gz IZJBECKDKHGTEH-SFHVURJKSA-N 0 3 417.553 4.329 20 0 HIADHN CCOc1ccc([C@H]2CCCN2C(=O)CN[C@@H](c2ccc(OC)cc2)C2CC2)cc1 ZINC000195667947 853747437 /nfs/dbraw/zinc/74/74/37/853747437.db2.gz QKOLFYPRNJOCCA-ILBGXUMGSA-N 0 3 408.542 4.498 20 0 HIADHN COCCN1CCC(NC(=O)c2cc(F)ccc2-c2cccc(C(F)(F)F)c2)CC1 ZINC000195686599 853757723 /nfs/dbraw/zinc/75/77/23/853757723.db2.gz QMGDRNQQFDXODF-UHFFFAOYSA-N 0 3 424.438 4.352 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(S(=O)(=O)N(C)C)cc1)c1ccc(C(F)(F)F)cc1 ZINC000195702195 853768460 /nfs/dbraw/zinc/76/84/60/853768460.db2.gz CDNQACFENYNPQB-KBPBESRZSA-N 0 3 400.466 4.368 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)/C=C\c2ccc(OCc3cccnc3)cc2)N(C)C)cc1 ZINC000208032168 853805579 /nfs/dbraw/zinc/80/55/79/853805579.db2.gz XXVJLRFXZSEERX-PBWBSBDWSA-N 0 3 415.537 4.401 20 0 HIADHN CC(=O)NC1CCN(Cc2cn(-c3ccccc3)nc2-c2ccc(C)c(C)c2)CC1 ZINC000215897402 853839374 /nfs/dbraw/zinc/83/93/74/853839374.db2.gz KKDRLXAHQQNYBH-UHFFFAOYSA-N 0 3 402.542 4.257 20 0 HIADHN O=C(NCc1ccc(F)cc1)C1CCN(CCOc2ccccc2C(F)(F)F)CC1 ZINC000215891057 853839801 /nfs/dbraw/zinc/83/98/01/853839801.db2.gz FFUOQSWTGJBMSD-UHFFFAOYSA-N 0 3 424.438 4.252 20 0 HIADHN CN(C)Cc1ccccc1CNC(=O)c1cnn(-c2ccccc2F)c1C(F)(F)F ZINC000219416018 853868595 /nfs/dbraw/zinc/86/85/95/853868595.db2.gz VDSDLHQGUPCDNC-UHFFFAOYSA-N 0 3 420.410 4.022 20 0 HIADHN CCC[C@@](C)(O)CNCc1cc(Br)cc(Br)c1OCC ZINC000226252983 853880298 /nfs/dbraw/zinc/88/02/98/853880298.db2.gz BYLFXWLIRDUGTK-OAHLLOKOSA-N 0 3 409.162 4.251 20 0 HIADHN c1cnn(-c2ccccc2CNCc2cn(-c3ccccc3)nc2-c2cccnc2)c1 ZINC000236582974 853899585 /nfs/dbraw/zinc/89/95/85/853899585.db2.gz FOHNOEJQLHNBCN-UHFFFAOYSA-N 0 3 406.493 4.410 20 0 HIADHN Brc1cccc(-c2c[nH]c(CNC[C@H]3CCN(c4ccccc4)C3)n2)c1 ZINC000236662650 853909519 /nfs/dbraw/zinc/90/95/19/853909519.db2.gz GRUJCTISAUJBJU-MRXNPFEDSA-N 0 3 411.347 4.455 20 0 HIADHN CC(C)n1ncc2cc(CNCCc3cc(Cl)c4c(c3)OCCO4)c(Cl)nc21 ZINC000236841183 853927993 /nfs/dbraw/zinc/92/79/93/853927993.db2.gz QCLMZRLWAVWDLQ-UHFFFAOYSA-N 0 3 421.328 4.423 20 0 HIADHN CCC[C@@H](NCc1ccc(-n2cccn2)cc1)C(=O)Nc1cccc(N2CCCC2)c1 ZINC000236924771 853938361 /nfs/dbraw/zinc/93/83/61/853938361.db2.gz NZRZRWDCTQIUNV-XMMPIXPASA-N 0 3 417.557 4.370 20 0 HIADHN CCOc1ccc(Oc2c(CNCCn3ccnc3)c(C)nn2-c2ccccc2)cc1 ZINC000236975990 853945451 /nfs/dbraw/zinc/94/54/51/853945451.db2.gz BXVSQVIFAYAAAJ-UHFFFAOYSA-N 0 3 417.513 4.358 20 0 HIADHN CCC[C@H](NCc1ccc(-n2ccnc2)cc1)C(=O)Nc1cccc(N2CCCC2)c1 ZINC000237039615 853955365 /nfs/dbraw/zinc/95/53/65/853955365.db2.gz WMIJVVSMZLFGAI-DEOSSOPVSA-N 0 3 417.557 4.370 20 0 HIADHN COc1cc(CNC(C)(C)c2cccc(Cl)c2)ccc1OCC(=O)N1CCCC1 ZINC000237100421 853963817 /nfs/dbraw/zinc/96/38/17/853963817.db2.gz KNLHMJOTSZCVPE-UHFFFAOYSA-N 0 3 416.949 4.375 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)C[C@@H](C)NCc1cc2c(cc1OC)C[C@H](C)O2 ZINC000237130250 853969879 /nfs/dbraw/zinc/96/98/79/853969879.db2.gz ILYONWNHYRUHAC-KGLIPLIRSA-N 0 3 418.921 4.188 20 0 HIADHN COc1cccc(CNCCC(=O)Nc2ccc(Br)cc2)c1OC(C)C ZINC000237192258 853978397 /nfs/dbraw/zinc/97/83/97/853978397.db2.gz KOBVMGXHDDZMMM-UHFFFAOYSA-N 0 3 421.335 4.363 20 0 HIADHN COCCOc1ccc(CNCc2cccc(NC(=O)c3cccc(F)c3)c2)cc1 ZINC000237212298 853983073 /nfs/dbraw/zinc/98/30/73/853983073.db2.gz YSIKBWJKEFBFFG-UHFFFAOYSA-N 0 3 408.473 4.393 20 0 HIADHN CNC(=O)c1ccc(CNCc2ccc(-n3nc(C)cc3C)cc2C(F)(F)F)cc1 ZINC000237224171 853986534 /nfs/dbraw/zinc/98/65/34/853986534.db2.gz CQRALZOOEBVBEE-UHFFFAOYSA-N 0 3 416.447 4.157 20 0 HIADHN COc1cc(CNCc2cn(C)nc2-c2cccnc2)ccc1OCc1ccccc1 ZINC000237227283 853986892 /nfs/dbraw/zinc/98/68/92/853986892.db2.gz ANLNEWKBCWMJPO-UHFFFAOYSA-N 0 3 414.509 4.360 20 0 HIADHN COCCOc1cccc(CN[C@@H](C)c2ccc(NC(=O)c3ccncc3)cc2)c1 ZINC000237244106 853989565 /nfs/dbraw/zinc/98/95/65/853989565.db2.gz UGHSSAIGKHPOGA-SFHVURJKSA-N 0 3 405.498 4.210 20 0 HIADHN COc1cccc([C@@H](O)CNCc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)c1 ZINC000237299100 854001437 /nfs/dbraw/zinc/00/14/37/854001437.db2.gz QCFNMLBQTFUZBJ-NRFANRHFSA-N 0 3 412.417 4.358 20 0 HIADHN COc1cccc([C@@H](O)CNCc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)c1 ZINC000237299530 854001443 /nfs/dbraw/zinc/00/14/43/854001443.db2.gz GIEPTWVCEDYVJQ-IBGZPJMESA-N 0 3 402.834 4.340 20 0 HIADHN COc1cc(CNCc2ccc(F)c(CN(C)C)c2)ccc1OCc1ccncc1 ZINC000237315570 854004577 /nfs/dbraw/zinc/00/45/77/854004577.db2.gz SASNPPOQVJNGHK-UHFFFAOYSA-N 0 3 409.505 4.160 20 0 HIADHN COc1cc(CN[C@@H](C)c2cccc(N3CCOC3=O)c2)ccc1OCC(F)(F)F ZINC000237323307 854006878 /nfs/dbraw/zinc/00/68/78/854006878.db2.gz PHZZQXNJSZOUEZ-AWEZNQCLSA-N 0 3 424.419 4.444 20 0 HIADHN COc1ccc(CN[C@H](C)c2ccc(OCc3ccncc3)c(OC)c2)cc1C#N ZINC000237343455 854009237 /nfs/dbraw/zinc/00/92/37/854009237.db2.gz KGXIHNQIOFWPQL-QGZVFWFLSA-N 0 3 403.482 4.400 20 0 HIADHN COc1cc(CN[C@@H](Cc2ccccc2)c2ccccc2)cc(Cl)c1OCC(N)=O ZINC000237340573 854009362 /nfs/dbraw/zinc/00/93/62/854009362.db2.gz SRMUTLBOMBHCGE-NRFANRHFSA-N 0 3 424.928 4.286 20 0 HIADHN COc1cc(CN[C@@H]2CCc3c2cccc3Cl)ccc1OCC(=O)N1CCCC1 ZINC000237358172 854013575 /nfs/dbraw/zinc/01/35/75/854013575.db2.gz UJODEUSNRGEBRA-HXUWFJFHSA-N 0 3 414.933 4.127 20 0 HIADHN COc1cccc(CNCCc2nc(-c3cccc(Cl)c3)no2)c1OC(F)F ZINC000237376494 854017715 /nfs/dbraw/zinc/01/77/15/854017715.db2.gz PIWZBTFNIAIKEN-UHFFFAOYSA-N 0 3 409.820 4.332 20 0 HIADHN COc1cc(CNCC2=Cc3cc(Br)ccc3OC2)cc(OC)c1OC ZINC000237380685 854018500 /nfs/dbraw/zinc/01/85/00/854018500.db2.gz PVKDSTOCMUCVEE-UHFFFAOYSA-N 0 3 420.303 4.041 20 0 HIADHN COc1cccc(CNCc2ccccc2CN2C[C@@H](C)O[C@@H](C)C2)c1OC(F)F ZINC000237388483 854020141 /nfs/dbraw/zinc/02/01/41/854020141.db2.gz QDQZEQSWMCUKPM-CALCHBBNSA-N 0 3 420.500 4.196 20 0 HIADHN COc1ccc(OC)c(NC(=O)C[C@@H](C)N[C@H]2CCOc3c(Cl)cccc32)c1 ZINC000237398032 854022848 /nfs/dbraw/zinc/02/28/48/854022848.db2.gz FWOQTBOABKGERA-DYVFJYSZSA-N 0 3 404.894 4.188 20 0 HIADHN COc1ccc(OCc2ccccn2)c(CNCCc2nc(C(F)(F)F)cs2)c1 ZINC000237435449 854032408 /nfs/dbraw/zinc/03/24/08/854032408.db2.gz LHCKUGWSHYBQMI-UHFFFAOYSA-N 0 3 423.460 4.477 20 0 HIADHN COc1ccc([C@@H](CNCc2cc(C(F)(F)F)ccc2F)N2CCOCC2)cc1 ZINC000237494459 854045466 /nfs/dbraw/zinc/04/54/66/854045466.db2.gz KFXWSPJBUHIXAC-HXUWFJFHSA-N 0 3 412.427 4.016 20 0 HIADHN Cc1nn(-c2cccc(C(F)(F)F)c2)c(Cl)c1CNC[C@@H](C)Cn1ccnc1 ZINC000237571587 854056147 /nfs/dbraw/zinc/05/61/47/854056147.db2.gz SJRRTTFTLLCNLV-CYBMUJFWSA-N 0 3 411.859 4.475 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2CNCc2cc(Br)ccc2F)C[C@H](C)O1 ZINC000237620355 854063946 /nfs/dbraw/zinc/06/39/46/854063946.db2.gz DJGAHCLLEYGUJV-IYBDPMFKSA-N 0 3 421.354 4.487 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CNCc1ccc(Cn2ccccc2=O)cc1 ZINC000237639021 854065888 /nfs/dbraw/zinc/06/58/88/854065888.db2.gz HWIIWYCNSNAMIW-UHFFFAOYSA-N 0 3 412.537 4.048 20 0 HIADHN Cc1nn(Cc2ccccc2)c(Cl)c1CNC[C@@H](c1ccccc1)N1CCOCC1 ZINC000237658921 854070121 /nfs/dbraw/zinc/07/01/21/854070121.db2.gz OWVWLELMHJZFLF-QHCPKHFHSA-N 0 3 424.976 4.056 20 0 HIADHN Cc1cccn2cc(COc3ccc(CN[C@@H](C)C(=O)N4CCCC[C@H]4C)cc3)nc12 ZINC000237661255 854070955 /nfs/dbraw/zinc/07/09/55/854070955.db2.gz LSJFPOUMVHRZHI-UXHICEINSA-N 0 3 420.557 4.101 20 0 HIADHN Cn1nncc1CNC[C@@H](c1ccc(Cl)c(Cl)c1)N1CCc2sccc2C1 ZINC000237684079 854075061 /nfs/dbraw/zinc/07/50/61/854075061.db2.gz MNAPYBVOZMHKNP-SFHVURJKSA-N 0 3 422.385 4.073 20 0 HIADHN Cn1nncc1CNC[C@H](c1ccc(Cl)cc1Cl)N1CCc2sccc2C1 ZINC000237684027 854075178 /nfs/dbraw/zinc/07/51/78/854075178.db2.gz PSPWDHFUJDLOLE-GOSISDBHSA-N 0 3 422.385 4.073 20 0 HIADHN C[C@](O)(CNCc1cc(Cl)ccc1OC[C@H]1CCCO1)c1ccc(F)cc1F ZINC000237734783 854085540 /nfs/dbraw/zinc/08/55/40/854085540.db2.gz NJYSNMGGILQKOO-UTKZUKDTSA-N 0 3 411.876 4.173 20 0 HIADHN Cc1ccc(CNCC(C)(C)S(=O)(=O)c2ccc(Br)cc2)s1 ZINC000237732196 854085652 /nfs/dbraw/zinc/08/56/52/854085652.db2.gz DMKCFXPIVQSISO-UHFFFAOYSA-N 0 3 402.379 4.161 20 0 HIADHN Cc1nn(C)c(Cl)c1CNC[C@@H](c1ccccc1)N1CCc2sccc2C1 ZINC000237739686 854086652 /nfs/dbraw/zinc/08/66/52/854086652.db2.gz QSQXIAWSBRNECB-IBGZPJMESA-N 0 3 400.979 4.333 20 0 HIADHN FC(F)(F)c1ccn(-c2ccc(CNCc3ccc(N4CCCC4)nc3)cc2)n1 ZINC000237756462 854089995 /nfs/dbraw/zinc/08/99/95/854089995.db2.gz QKCXRZSTVWJVNI-UHFFFAOYSA-N 0 3 401.436 4.176 20 0 HIADHN NC(=O)c1cccc(CCNCc2csc(-c3cccc(Br)c3)n2)c1 ZINC000237757397 854090185 /nfs/dbraw/zinc/09/01/85/854090185.db2.gz RMLPWDGGAZIPFD-UHFFFAOYSA-N 0 3 416.344 4.004 20 0 HIADHN Cc1cc([C@@](C)(O)CNCc2cc(Br)ccc2OC(F)F)c(C)o1 ZINC000237800668 854099789 /nfs/dbraw/zinc/09/97/89/854099789.db2.gz LOJYGXZDJXHWBV-KRWDZBQOSA-N 0 3 404.251 4.258 20 0 HIADHN Cc1nn(-c2cccc(C(F)(F)F)c2)c(Cl)c1CNC[C@H]1CCC[C@H](O)C1 ZINC000237809939 854102322 /nfs/dbraw/zinc/10/23/22/854102322.db2.gz JGARQMRDQZQMIN-BBRMVZONSA-N 0 3 401.860 4.494 20 0 HIADHN Cc1ccc(C(=O)NCCNCc2cc3ccccc3nc2N2CCCCC2)cc1 ZINC000237848549 854107312 /nfs/dbraw/zinc/10/73/12/854107312.db2.gz LVUGKZHVCVYJPO-UHFFFAOYSA-N 0 3 402.542 4.053 20 0 HIADHN Cc1nn(Cc2ccc(C)cc2)c(Cl)c1CNC[C@H]1CCN(CC(F)(F)F)C1 ZINC000237857875 854109360 /nfs/dbraw/zinc/10/93/60/854109360.db2.gz AFLWLWUDGQKSCN-QGZVFWFLSA-N 0 3 414.903 4.175 20 0 HIADHN Cc1nn(-c2ccccc2)c(Cl)c1CNCCCCN1C(=O)c2ccccc2C1=O ZINC000237873595 854112692 /nfs/dbraw/zinc/11/26/92/854112692.db2.gz YWKCHPAUBDYNED-UHFFFAOYSA-N 0 3 422.916 4.000 20 0 HIADHN Cc1cccc(-c2nn(-c3ccc(F)cc3)cc2CNCc2ccc(C(N)=O)cc2)c1 ZINC000237883663 854114555 /nfs/dbraw/zinc/11/45/55/854114555.db2.gz IFHWPJPRKJOWPN-UHFFFAOYSA-N 0 3 414.484 4.376 20 0 HIADHN NC(=O)Nc1ccc(CNCc2cn(Cc3ccccc3)nc2-c2ccccc2)cc1 ZINC000237904222 854117707 /nfs/dbraw/zinc/11/77/07/854117707.db2.gz HGWCXDRSEASLRV-UHFFFAOYSA-N 0 3 411.509 4.379 20 0 HIADHN FC(F)Oc1ccc(N2CCC[C@H](NCc3c(Cl)nc4ccccn43)C2)cc1 ZINC000237916605 854119178 /nfs/dbraw/zinc/11/91/78/854119178.db2.gz XBWNICBCTLZTMQ-AWEZNQCLSA-N 0 3 406.864 4.348 20 0 HIADHN Cc1ccc([C@@H](CNCC2=Cc3cc(Cl)cc(Cl)c3OC2)N2CCOCC2)o1 ZINC000237970020 854127661 /nfs/dbraw/zinc/12/76/61/854127661.db2.gz ITRODBMWYYMOPW-LJQANCHMSA-N 0 3 423.340 4.334 20 0 HIADHN OCc1ccc(CNC[C@H](c2ccc(Cl)cc2)N2CCc3sccc3C2)o1 ZINC000237991300 854129584 /nfs/dbraw/zinc/12/95/84/854129584.db2.gz XMCYJECCUJDQBG-HXUWFJFHSA-N 0 3 402.947 4.376 20 0 HIADHN CCCCOc1ccc(C(=O)N(Cc2ccco2)C2CCN(C)CC2)cc1OC ZINC000248112992 854179706 /nfs/dbraw/zinc/17/97/06/854179706.db2.gz HVJSGWLNMFNTRL-UHFFFAOYSA-N 0 3 400.519 4.204 20 0 HIADHN Cc1cc2ncn(C[C@H](O)CN3CCC[C@H]3c3nc4ccccc4s3)c2cc1C ZINC000250930068 854196355 /nfs/dbraw/zinc/19/63/55/854196355.db2.gz WLECEMGLMPGSRK-XLIONFOSSA-N 0 3 406.555 4.461 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)N2CCC(OC3CCCCC3)CC2)N(C)C)cc1 ZINC000261384969 854243029 /nfs/dbraw/zinc/24/30/29/854243029.db2.gz VAGJRZPKZILAMR-HSZRJFAPSA-N 0 3 401.595 4.375 20 0 HIADHN C[C@@H]1CCN(CC(=O)N[C@H](c2ccccc2)c2ccc3[nH]c(C(F)(F)F)nc3c2)C1 ZINC000261399844 854247930 /nfs/dbraw/zinc/24/79/30/854247930.db2.gz VSCDIPQZHDVHJO-JLTOFOAXSA-N 0 3 416.447 4.129 20 0 HIADHN C[C@@H]1CCN(CC(=O)N[C@H](c2ccccc2)c2ccc3nc(C(F)(F)F)[nH]c3c2)C1 ZINC000261399844 854247937 /nfs/dbraw/zinc/24/79/37/854247937.db2.gz VSCDIPQZHDVHJO-JLTOFOAXSA-N 0 3 416.447 4.129 20 0 HIADHN C[C@H]1CCN(CC(=O)N[C@H](c2ccccc2)c2ccc3[nH]c(C(F)(F)F)nc3c2)C1 ZINC000261399845 854248217 /nfs/dbraw/zinc/24/82/17/854248217.db2.gz VSCDIPQZHDVHJO-VBKZILBWSA-N 0 3 416.447 4.129 20 0 HIADHN C[C@H]1CCN(CC(=O)N[C@H](c2ccccc2)c2ccc3nc(C(F)(F)F)[nH]c3c2)C1 ZINC000261399845 854248226 /nfs/dbraw/zinc/24/82/26/854248226.db2.gz VSCDIPQZHDVHJO-VBKZILBWSA-N 0 3 416.447 4.129 20 0 HIADHN CCN(C(=O)c1ccc(Br)cn1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000261400967 854249373 /nfs/dbraw/zinc/24/93/73/854249373.db2.gz GKBKADJQNZSJHD-MAUKXSAKSA-N 0 3 402.336 4.142 20 0 HIADHN Cc1nn(C)c2ncc(CN3CCC[C@@H](c4nc(-c5ccc(Cl)cc5)no4)C3)cc12 ZINC000261417343 854255534 /nfs/dbraw/zinc/25/55/34/854255534.db2.gz WVZNVMLBLQFGJB-QGZVFWFLSA-N 0 3 422.920 4.360 20 0 HIADHN COc1ccccc1[C@@H](CNc1nc(-c2ccncc2)nc(C)c1C)N1CCCC1 ZINC000301167968 854317966 /nfs/dbraw/zinc/31/79/66/854317966.db2.gz INRQMSROWBWMOR-OAQYLSRUSA-N 0 3 403.530 4.413 20 0 HIADHN FC(F)(F)c1cc(NC[C@@H](c2ccco2)N2CCCC2)nc(-c2ccncc2)n1 ZINC000301299296 854351258 /nfs/dbraw/zinc/35/12/58/854351258.db2.gz UCZXDFFSNHRGOE-HNNXBMFYSA-N 0 3 403.408 4.399 20 0 HIADHN CC1CCN([C@@H](CNC(=O)/C=C/c2cnc3ccccc3n2)c2cccs2)CC1 ZINC000301383986 854377434 /nfs/dbraw/zinc/37/74/34/854377434.db2.gz DUEDGOSNFHYDAS-SHBDEGQCSA-N 0 3 406.555 4.294 20 0 HIADHN Cc1nc(-c2ccc(N[C@@H]3CC[N@H+](Cc4ccccc4)[C@@H](C)C3)nc2)[n-]c(=O)c1C ZINC000301573215 854422682 /nfs/dbraw/zinc/42/26/82/854422682.db2.gz YWICWFKOFCSYOF-HRAATJIYSA-N 0 3 403.530 4.326 20 0 HIADHN Cc1nc(-c2ccc(N[C@@H]3CC[N@@H+](Cc4ccccc4)[C@@H](C)C3)nc2)[n-]c(=O)c1C ZINC000301573215 854422685 /nfs/dbraw/zinc/42/26/85/854422685.db2.gz YWICWFKOFCSYOF-HRAATJIYSA-N 0 3 403.530 4.326 20 0 HIADHN C[C@H](NCC(=O)N(C)CC(=O)Nc1ccccc1Cl)c1cccc2ccccc21 ZINC000301577791 854423633 /nfs/dbraw/zinc/42/36/33/854423633.db2.gz BBXMGCXWMPASSE-INIZCTEOSA-N 0 3 409.917 4.241 20 0 HIADHN Cc1c2nnc(C(F)(F)F)n2nc(NC[C@@H](c2cccs2)N2CCCC2)c1C ZINC000301731997 854454245 /nfs/dbraw/zinc/45/42/45/854454245.db2.gz FHMNAGWCSZSQOX-ZDUSSCGKSA-N 0 3 410.469 4.070 20 0 HIADHN CC(=O)c1ccc(S(C)(=O)=O)c(NCc2cccc(CN3CCCCCC3)c2)c1 ZINC000302111679 854532279 /nfs/dbraw/zinc/53/22/79/854532279.db2.gz UQDMIAFFRVNJBV-UHFFFAOYSA-N 0 3 414.571 4.281 20 0 HIADHN Cc1nc2ccc(Br)cc2c(N2CCCN(C(=O)C3CC3)CC2)c1C ZINC000302494044 854575963 /nfs/dbraw/zinc/57/59/63/854575963.db2.gz ASRBMUBFFLDEMT-UHFFFAOYSA-N 0 3 402.336 4.063 20 0 HIADHN CCCN(CC(=O)N(Cc1cccs1)c1ccc2c(c1)OCCO2)CC1CC1 ZINC000302833556 854648273 /nfs/dbraw/zinc/64/82/73/854648273.db2.gz OSWOYDBXKYKPHZ-UHFFFAOYSA-N 0 3 400.544 4.175 20 0 HIADHN CN(C)[C@@H](CNC(=O)N1CCC(c2nc3ccccc3s2)CC1)c1ccccc1 ZINC000302889058 854667289 /nfs/dbraw/zinc/66/72/89/854667289.db2.gz BQUMXMZXIBHYOO-FQEVSTJZSA-N 0 3 408.571 4.488 20 0 HIADHN O=C(NCc1ccc(Br)c(F)c1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000302941911 854689562 /nfs/dbraw/zinc/68/95/62/854689562.db2.gz BHZYJADZXLZPTD-MRXNPFEDSA-N 0 3 423.301 4.256 20 0 HIADHN Cc1c(C(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)cnn1Cc1ccccc1 ZINC000302980483 854707497 /nfs/dbraw/zinc/70/74/97/854707497.db2.gz CXNYSGJBYVXYDM-DEOSSOPVSA-N 0 3 402.542 4.115 20 0 HIADHN CCn1cc(CC(=O)NC[C@H](c2ccc(OC)cc2)N2CCCC2)c2ccccc21 ZINC000303067676 854746164 /nfs/dbraw/zinc/74/61/64/854746164.db2.gz WFOUTYQXJDCPBZ-XMMPIXPASA-N 0 3 405.542 4.166 20 0 HIADHN CC1CCN([C@H](CNC(=O)[C@@H]2CCCN2C(=O)CC(C)(C)C)c2ccccc2)CC1 ZINC000303066390 854746296 /nfs/dbraw/zinc/74/62/96/854746296.db2.gz VYYSPVUKVMLVCB-FCHUYYIVSA-N 0 3 413.606 4.003 20 0 HIADHN CN(C[C@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)c1cc(Cl)ccc1Cl ZINC000437331150 862600820 /nfs/dbraw/zinc/60/08/20/862600820.db2.gz WDCIAXAAMIQZLU-MRXNPFEDSA-N 0 3 413.370 4.136 20 0 HIADHN O=C(CCc1ccccc1OC(F)(F)F)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000303186810 854808055 /nfs/dbraw/zinc/80/80/55/854808055.db2.gz LVLACTDBYWZQKJ-LJQANCHMSA-N 0 3 406.448 4.299 20 0 HIADHN O=C(NC[C@H]1CCCCN1C(=O)c1cccc(CN2CCCC2)c1)Nc1ccccc1 ZINC000303204115 854815013 /nfs/dbraw/zinc/81/50/13/854815013.db2.gz YGEIEMZSRGMMFC-HSZRJFAPSA-N 0 3 420.557 4.099 20 0 HIADHN COc1ccc(OC)c(CNC[C@H](c2c(F)cccc2Cl)N2CCO[C@H](C)C2)c1 ZINC000303225172 854825043 /nfs/dbraw/zinc/82/50/43/854825043.db2.gz WKGDOZJGBBFXCT-FOIQADDNSA-N 0 3 422.928 4.048 20 0 HIADHN CC(C)COc1ccc(CC(=O)Nc2ccc(CCN3CCSCC3)cc2)cc1 ZINC000303262283 854840403 /nfs/dbraw/zinc/84/04/03/854840403.db2.gz DFPSJZJXBUNJID-UHFFFAOYSA-N 0 3 412.599 4.494 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)C[C@@H](C)Cc3ccccc3OC)c(C)c2)CC1 ZINC000303311616 854866021 /nfs/dbraw/zinc/86/60/21/854866021.db2.gz PAIJCCAXWOICPO-IBGZPJMESA-N 0 3 409.574 4.353 20 0 HIADHN Cc1nn(Cc2ccc(C)cc2)c(C)c1CCC(=O)Nc1cccc(CN(C)C)c1 ZINC000303317427 854869353 /nfs/dbraw/zinc/86/93/53/854869353.db2.gz QNHZSDMRUXTDSZ-UHFFFAOYSA-N 0 3 404.558 4.490 20 0 HIADHN COc1ccccc1C[C@H](C)CC(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000303350956 854887163 /nfs/dbraw/zinc/88/71/63/854887163.db2.gz XPPMCWIKOVWIJN-IBGZPJMESA-N 0 3 412.599 4.494 20 0 HIADHN O=C(NC[C@H](O)c1ccc2ccccc2c1)NC[C@H](c1cccs1)N1CCCC1 ZINC000303354309 854888891 /nfs/dbraw/zinc/88/88/91/854888891.db2.gz GJEAOHROKUWUGD-RTWAWAEBSA-N 0 3 409.555 4.071 20 0 HIADHN CCCO[C@H]1CCCN(CC(=O)N2CCCCC[C@H]2c2ccc(OC)cc2)CC1 ZINC000303407720 854912002 /nfs/dbraw/zinc/91/20/02/854912002.db2.gz SYAPVRAEBBGNJC-GOTSBHOMSA-N 0 3 402.579 4.420 20 0 HIADHN CCCO[C@@H]1CCCN(CC(=O)N2CCCCC[C@H]2c2ccc(OC)cc2)CC1 ZINC000303407721 854912545 /nfs/dbraw/zinc/91/25/45/854912545.db2.gz SYAPVRAEBBGNJC-PKTZIBPZSA-N 0 3 402.579 4.420 20 0 HIADHN CCCO[C@H]1CCCN([C@H](C)C(=O)N(C)Cc2ccc3cc(OC)ccc3c2)CC1 ZINC000303417201 854918785 /nfs/dbraw/zinc/91/87/85/854918785.db2.gz WXMAODYLBUOKED-XXBNENTESA-N 0 3 412.574 4.476 20 0 HIADHN C[C@H](CNC(=O)c1ccc(NC(=O)c2ccccc2)cc1)N(C)Cc1ccccc1 ZINC000303422627 854924922 /nfs/dbraw/zinc/92/49/22/854924922.db2.gz DCEFFVFSYUXOJU-LJQANCHMSA-N 0 3 401.510 4.189 20 0 HIADHN C[C@@H](CNC(=O)c1ccc(NC(=O)c2ccccc2)cc1)N(C)Cc1ccccc1 ZINC000303422625 854925111 /nfs/dbraw/zinc/92/51/11/854925111.db2.gz DCEFFVFSYUXOJU-IBGZPJMESA-N 0 3 401.510 4.189 20 0 HIADHN O=C(NC[C@@H](O)c1ccc2ccccc2c1)NC[C@H](c1ccccc1)N1CCCC1 ZINC000303431930 854932688 /nfs/dbraw/zinc/93/26/88/854932688.db2.gz XANCLOLBKNKWMA-DNQXCXABSA-N 0 3 403.526 4.010 20 0 HIADHN COc1ccc([C@H]2CCCN2C(=O)NC[C@H](C)N(C)Cc2ccccc2)c(OC)c1 ZINC000303434828 854935534 /nfs/dbraw/zinc/93/55/34/854935534.db2.gz DEPVXNTWYLEERR-PGRDOPGGSA-N 0 3 411.546 4.071 20 0 HIADHN Cc1ccc(-c2nc(CCNC(=O)NC[C@@H](C)N(C)Cc3ccccc3)co2)cc1 ZINC000303435931 854936440 /nfs/dbraw/zinc/93/64/40/854936440.db2.gz DLQNPMYTDAMTLW-LJQANCHMSA-N 0 3 406.530 4.012 20 0 HIADHN CCN1CCN(Cc2ccc(CNC(=O)N(C)[C@H](c3ccccc3)C(C)C)cc2)CC1 ZINC000303452512 854952600 /nfs/dbraw/zinc/95/26/00/854952600.db2.gz CZVLDRZUXPCVQO-VWLOTQADSA-N 0 3 422.617 4.363 20 0 HIADHN CCc1noc2ncc(C(=O)N(CCN3CCCC3)Cc3ccc(Cl)cc3)cc12 ZINC000303455678 854955493 /nfs/dbraw/zinc/95/54/93/854955493.db2.gz GBWWGHUMHYETFP-UHFFFAOYSA-N 0 3 412.921 4.177 20 0 HIADHN O=C(NC[C@H](O)c1ccc(Cl)cc1Cl)N[C@H](CN1CCCC1)c1ccccc1 ZINC000303456589 854956433 /nfs/dbraw/zinc/95/64/33/854956433.db2.gz KESSQBGDFJVIAV-UXHICEINSA-N 0 3 422.356 4.163 20 0 HIADHN C[C@@H](SCC(=O)N(CCN(C)C)Cc1cccc(F)c1)c1nc2ccccc2[nH]1 ZINC000303489249 854980759 /nfs/dbraw/zinc/98/07/59/854980759.db2.gz KKVAFANLADJENZ-MRXNPFEDSA-N 0 3 414.550 4.087 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Cc1coc(-c2ccc(F)cc2)n1)c1ccsc1 ZINC000303497812 854987260 /nfs/dbraw/zinc/98/72/60/854987260.db2.gz BFACXZNUABPXLU-IBGZPJMESA-N 0 3 401.507 4.284 20 0 HIADHN Cc1ccc(C)c(NC(=O)[C@@H](c2ccccc2)N2CCC[C@H](CN3CCOCC3)C2)c1 ZINC000303499055 854988178 /nfs/dbraw/zinc/98/81/78/854988178.db2.gz YBLPVWRSFUKHJH-RCZVLFRGSA-N 0 3 421.585 4.027 20 0 HIADHN CC[C@H](Sc1ccccc1)C(=O)NCc1ccccc1CN1CCN(CC)CC1 ZINC000303534407 855020859 /nfs/dbraw/zinc/02/08/59/855020859.db2.gz XGHSQXKSTQWKCX-QHCPKHFHSA-N 0 3 411.615 4.011 20 0 HIADHN C[NH+](C)Cc1c2ccccc2oc1C(=O)[N-]c1nnc(Cc2ccccc2F)s1 ZINC000303542556 855027795 /nfs/dbraw/zinc/02/77/95/855027795.db2.gz KCGJKAXXYOAEII-UHFFFAOYSA-N 0 3 410.474 4.328 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3ccc(Br)cc3C)cc2)CC1 ZINC000303575127 855050242 /nfs/dbraw/zinc/05/02/42/855050242.db2.gz PPUYXVQLVITMNX-UHFFFAOYSA-N 0 3 402.336 4.152 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)NCc1ccc(Br)c(F)c1 ZINC000303583150 855056798 /nfs/dbraw/zinc/05/67/98/855056798.db2.gz RSGXVGPPXNXXTE-UHFFFAOYSA-N 0 3 405.267 4.326 20 0 HIADHN C[C@@H](NC(=O)c1oc2ccccc2c1CN(C)C)c1ccc(N2CCCC2=O)cc1 ZINC000303588243 855061948 /nfs/dbraw/zinc/06/19/48/855061948.db2.gz UEXHKCIJNWXVGA-MRXNPFEDSA-N 0 3 405.498 4.112 20 0 HIADHN O=C(/C=C/c1cccc(F)c1)NC1CCN(CCOc2ccc(Cl)cc2)CC1 ZINC000303674971 855124580 /nfs/dbraw/zinc/12/45/80/855124580.db2.gz HMAOCJULOYAGJG-RUDMXATFSA-N 0 3 402.897 4.152 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N[C@H](C)c3cccc(C(F)(F)F)c3)cc2)CC1 ZINC000303687023 855133009 /nfs/dbraw/zinc/13/30/09/855133009.db2.gz KRRKLJRYMIDXPO-MRXNPFEDSA-N 0 3 405.464 4.338 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)CCN1CCC[C@@H](C(=O)c2ccc(F)cc2)C1 ZINC000303745198 855167524 /nfs/dbraw/zinc/16/75/24/855167524.db2.gz JSVHCBCNJVLPCS-MRXNPFEDSA-N 0 3 418.896 4.411 20 0 HIADHN CC[C@@H](NC(=O)c1ccc(N2CCN(C(C)C)CC2)cc1)c1ccc(F)cc1F ZINC000303769284 855186568 /nfs/dbraw/zinc/18/65/68/855186568.db2.gz QJWBZQDRJYEZSB-JOCHJYFZSA-N 0 3 401.501 4.376 20 0 HIADHN CN(C)Cc1cccc(C(=O)N2CCN(C(c3ccccc3)c3ccccc3)CC2)c1 ZINC000303803102 855207561 /nfs/dbraw/zinc/20/75/61/855207561.db2.gz BEMQINYVVBQFKJ-UHFFFAOYSA-N 0 3 413.565 4.296 20 0 HIADHN Cc1cc(Cl)ccc1S(=O)(=O)N(C)[C@@H]1CCN(Cc2ccccc2)[C@H](C)C1 ZINC000303803731 855208194 /nfs/dbraw/zinc/20/81/94/855208194.db2.gz MCEKWMVROVOLOL-YLJYHZDGSA-N 0 3 406.979 4.322 20 0 HIADHN COCCN1CCC(NC(=O)c2ccc(Oc3cccc(Cl)c3Cl)nc2)CC1 ZINC000303859881 855255916 /nfs/dbraw/zinc/25/59/16/855255916.db2.gz HASYQFMTHWBQPE-UHFFFAOYSA-N 0 3 424.328 4.021 20 0 HIADHN Cc1[nH]c2ccc(C(=O)Nc3ccc(C(=O)N(C)[C@@H]4CCCN(C)C4)cc3)cc2c1C ZINC000303883062 855268366 /nfs/dbraw/zinc/26/83/66/855268366.db2.gz JOQASPPWFXDTTL-OAQYLSRUSA-N 0 3 418.541 4.203 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)NCc1ccnc(OC2CCCC2)c1 ZINC000303884619 855269822 /nfs/dbraw/zinc/26/98/22/855269822.db2.gz RJQPYNPIOGUNHF-HXUWFJFHSA-N 0 3 422.573 4.209 20 0 HIADHN CN(C(=O)c1cn(-c2ccccc2)nc1-c1ccc(Cl)cc1)[C@@H]1CCCN(C)C1 ZINC000303895982 855275520 /nfs/dbraw/zinc/27/55/20/855275520.db2.gz KTAAUXWKGJFPEL-HXUWFJFHSA-N 0 3 408.933 4.359 20 0 HIADHN CN(C)Cc1cccc(C(=O)Nc2ccc(CC(=O)N3CCc4ccccc43)cc2)c1 ZINC000303942578 855307954 /nfs/dbraw/zinc/30/79/54/855307954.db2.gz XPDMETDKPAWYOG-UHFFFAOYSA-N 0 3 413.521 4.132 20 0 HIADHN C[C@@H]1C[C@H]1C(=O)Nc1cccc(C(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)c1 ZINC000303950385 855313292 /nfs/dbraw/zinc/31/32/92/855313292.db2.gz ZUIPORLBZPFUDS-DNVFCKCGSA-N 0 3 405.542 4.018 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)[C@@]2(C)CCCc3ccccc32)cc1)[C@@H]1CCCN(C)C1 ZINC000303960706 855322532 /nfs/dbraw/zinc/32/25/32/855322532.db2.gz WNHCGRDEVADICF-GJZUVCINSA-N 0 3 419.569 4.086 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCN(C(=O)c2cc(F)ccc2Br)C1 ZINC000323922716 855397585 /nfs/dbraw/zinc/39/75/85/855397585.db2.gz OBGOWYBTJYQMAV-OAHLLOKOSA-N 0 3 405.311 4.182 20 0 HIADHN O=C1CC2(CCN(CCc3ccccc3)CC2)Oc2ccc(Br)cc21 ZINC000327841918 855420565 /nfs/dbraw/zinc/42/05/65/855420565.db2.gz HJPZUFICIKOQOA-UHFFFAOYSA-N 0 3 400.316 4.492 20 0 HIADHN O[C@H](CNCc1cc(Br)cc2c1OCC2)c1cccc(C(F)(F)F)c1 ZINC000327953666 855421948 /nfs/dbraw/zinc/42/19/48/855421948.db2.gz KRRASVHIFRJXGC-MRXNPFEDSA-N 0 3 416.237 4.226 20 0 HIADHN CC(C)(C)OC(=O)NC[C@@H](NCc1ccc(Br)cn1)C1CCCCC1 ZINC000380749202 855428726 /nfs/dbraw/zinc/42/87/26/855428726.db2.gz ZBKYBAMGWZXYHR-QGZVFWFLSA-N 0 3 412.372 4.407 20 0 HIADHN CCOc1c(Br)cc(Br)cc1CNC[C@](C)(O)C(C)C ZINC000380464696 855428967 /nfs/dbraw/zinc/42/89/67/855428967.db2.gz PWQRKGIZVQBGCG-HNNXBMFYSA-N 0 3 409.162 4.107 20 0 HIADHN CC(C)(C)OC(=O)N1CCC[C@@H](CNCc2cccc(F)c2Br)C1 ZINC000382789089 855434789 /nfs/dbraw/zinc/43/47/89/855434789.db2.gz XEPWXSQWEPOIMQ-ZDUSSCGKSA-N 0 3 401.320 4.325 20 0 HIADHN COc1ccc(Br)cc1C(=O)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000393004656 855468095 /nfs/dbraw/zinc/46/80/95/855468095.db2.gz PRDVKOBFXOVMFM-SFHVURJKSA-N 0 3 403.320 4.025 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)c2cccc(Br)c2Cl)CN1Cc1ccccc1 ZINC000398139995 855476591 /nfs/dbraw/zinc/47/65/91/855476591.db2.gz NYGBQPYSKFTDGS-HIFRSBDPSA-N 0 3 407.739 4.495 20 0 HIADHN CCC(=O)c1ccc(OCCCCC(=O)N2C[C@@H](N(C)C)Cc3ccccc32)cc1 ZINC000409540982 855533039 /nfs/dbraw/zinc/53/30/39/855533039.db2.gz LZXSWRMOCXIXDP-NRFANRHFSA-N 0 3 408.542 4.348 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)[C@@H]1CCCc2nn(C)cc21)c1ccc(C(F)(F)F)cc1 ZINC000409572086 855546050 /nfs/dbraw/zinc/54/60/50/855546050.db2.gz AVQKHEFSZZVZLB-XLIONFOSSA-N 0 3 422.495 4.058 20 0 HIADHN Cc1cc(F)cc2c1CN(C(=O)NC1CC(N3CCC(C(F)(F)F)CC3)C1)CC2 ZINC000409603489 855560594 /nfs/dbraw/zinc/56/05/94/855560594.db2.gz WPVLYKTWNJCFKW-UHFFFAOYSA-N 0 3 413.459 4.007 20 0 HIADHN CC(C)(Cc1nc2ccccc2[nH]1)C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000409609378 855562959 /nfs/dbraw/zinc/56/29/59/855562959.db2.gz XSRCYBPPTAOTKI-UHFFFAOYSA-N 0 3 422.598 4.362 20 0 HIADHN Cc1ccc([C@H](CNC(=O)C(C)(C)Cc2nc3ccccc3[nH]2)N2CCCC2)cc1 ZINC000409608878 855563022 /nfs/dbraw/zinc/56/30/22/855563022.db2.gz RWJJZHXFCMHXIG-QFIPXVFZSA-N 0 3 404.558 4.393 20 0 HIADHN C[C@@H](NC(=O)Nc1cccc(CN(C)C)c1)[C@@H](OC1CCOCC1)c1ccccc1 ZINC000437383178 862695448 /nfs/dbraw/zinc/69/54/48/862695448.db2.gz GLSCKNCXPVRDMG-WZONZLPQSA-N 0 3 411.546 4.195 20 0 HIADHN C[C@H](NC(=O)Nc1cccc(CN(C)C)c1)[C@H](OC1CCOCC1)c1ccccc1 ZINC000437383174 862696313 /nfs/dbraw/zinc/69/63/13/862696313.db2.gz GLSCKNCXPVRDMG-MBSDFSHPSA-N 0 3 411.546 4.195 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)c1cc2sc(N(C)C)nc2s1 ZINC000409701434 855609927 /nfs/dbraw/zinc/60/99/27/855609927.db2.gz ZVTRARIJZXZLSN-UHFFFAOYSA-N 0 3 416.616 4.060 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)[C@@H]2CCO[C@H]2c2ccc(Cl)c(F)c2)CN1Cc1ccccc1 ZINC000409814194 855667929 /nfs/dbraw/zinc/66/79/29/855667929.db2.gz SQQNNMROVPBLJD-KBZIOIMTSA-N 0 3 416.924 4.336 20 0 HIADHN COCC1(CN[C@H](C(=O)Nc2ccc(OC)c(Cl)c2)c2ccccc2)CCC1 ZINC000409844965 855684609 /nfs/dbraw/zinc/68/46/09/855684609.db2.gz OMNKTQVAIZNCHW-FQEVSTJZSA-N 0 3 402.922 4.435 20 0 HIADHN Cc1cc(NC(=O)[C@@H]2CCCC(F)(F)C2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000409980860 855759919 /nfs/dbraw/zinc/75/99/19/855759919.db2.gz PWCMROHAWOCBPG-RTBURBONSA-N 0 3 402.489 4.403 20 0 HIADHN C[C@@H](C(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1)c1ccc(C(F)(F)F)cc1 ZINC000409994998 855768658 /nfs/dbraw/zinc/76/86/58/855768658.db2.gz XUEUVRZNTBGKFW-UTKZUKDTSA-N 0 3 420.475 4.216 20 0 HIADHN CSc1ccccc1[C@@H](C)NC(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000410090496 855814408 /nfs/dbraw/zinc/81/44/08/855814408.db2.gz YRLHDDSDQOWAEH-FGTMMUONSA-N 0 3 405.608 4.000 20 0 HIADHN CN(C)C(=O)COc1cccc(CN[C@H](Cc2cccnc2)c2cccc(Cl)c2)c1 ZINC000425937799 856008774 /nfs/dbraw/zinc/00/87/74/856008774.db2.gz TXOFLUBBSRGVRN-HSZRJFAPSA-N 0 3 423.944 4.276 20 0 HIADHN O=S(=O)(CCCN[C@@H](Cc1cccnc1)c1cccc(Cl)c1)c1ccccc1 ZINC000425937419 856008925 /nfs/dbraw/zinc/00/89/25/856008925.db2.gz MAAGLKWWTHBKDG-QFIPXVFZSA-N 0 3 414.958 4.472 20 0 HIADHN Cc1cc(CN2CCC(Oc3cnccn3)CC2)cc(C)c1OCc1ccccn1 ZINC000425973760 856024332 /nfs/dbraw/zinc/02/43/32/856024332.db2.gz ABCBVVBELKQMEI-UHFFFAOYSA-N 0 3 404.514 4.111 20 0 HIADHN COC[C@H](c1ccc(Cl)cc1)N(C)C(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000425977894 856027749 /nfs/dbraw/zinc/02/77/49/856027749.db2.gz NEQOMHXJFVSUCE-NJYVYQBISA-N 0 3 401.938 4.114 20 0 HIADHN CCc1nc(C)c(CNC(=O)N2CCN(Cc3ccccc3)C3(CCCCC3)C2)o1 ZINC000426007237 856043990 /nfs/dbraw/zinc/04/39/90/856043990.db2.gz IZJOPXVXXWDTPS-UHFFFAOYSA-N 0 3 410.562 4.276 20 0 HIADHN CS(=O)(=O)Cc1ccccc1CN[C@H](Cc1cccnc1)c1cccc(Cl)c1 ZINC000426015061 856048227 /nfs/dbraw/zinc/04/82/27/856048227.db2.gz FFXZFUXAMPCBJP-JOCHJYFZSA-N 0 3 414.958 4.353 20 0 HIADHN COc1ccc(NC(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)c2cccnc12 ZINC000426104853 856110016 /nfs/dbraw/zinc/11/00/16/856110016.db2.gz ZHPWDHBYGDENAI-SFHVURJKSA-N 0 3 404.514 4.372 20 0 HIADHN Cc1ncc([C@H](C)N[C@@H](Cc2ccc(F)cc2)[C@@H]2COc3ccccc3O2)c(C)n1 ZINC000426313707 856240000 /nfs/dbraw/zinc/24/00/00/856240000.db2.gz NSLAAWICTYJVKQ-SWDVRCMSSA-N 0 3 407.489 4.334 20 0 HIADHN C[C@H](N[C@@H]1c2cccc(Br)c2CC1(C)C)c1ccc(S(N)(=O)=O)cc1 ZINC000426323422 856245286 /nfs/dbraw/zinc/24/52/86/856245286.db2.gz NBVACIGJFYFSMI-KPZWWZAWSA-N 0 3 423.376 4.071 20 0 HIADHN CS(=O)(=O)[C@@H]1CCCC[C@H]1N[C@@H]1CCc2c1cc(Cl)cc2Br ZINC000426330107 856248780 /nfs/dbraw/zinc/24/87/80/856248780.db2.gz KVTVNHCSYIKGDK-BZUAXINKSA-N 0 3 406.773 4.035 20 0 HIADHN CC(C)(C)N1C[C@@H](c2nc(C(C)(C)NC(=O)c3ccccc3)no2)[C@H](C(F)(F)F)C1 ZINC000426576397 856356361 /nfs/dbraw/zinc/35/63/61/856356361.db2.gz KCYKHVLVJCMVKU-HUUCEWRRSA-N 0 3 424.467 4.111 20 0 HIADHN COC[C@H](NC(=O)N(Cc1ccccc1)C1CCN(C)CC1)c1ccc(Cl)cc1 ZINC000426593263 856364008 /nfs/dbraw/zinc/36/40/08/856364008.db2.gz LXPRGBMFAAWSEE-QFIPXVFZSA-N 0 3 415.965 4.334 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)c3c[nH]cc3-c3ccccc3F)CC2)C[C@H](C)O1 ZINC000426667771 856403190 /nfs/dbraw/zinc/40/31/90/856403190.db2.gz ZTJWBSFCVKGDAR-ROUUACIJSA-N 0 3 413.537 4.172 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)CCCCC(=O)c2ccc(F)cc2)CC1 ZINC000426850264 856511803 /nfs/dbraw/zinc/51/18/03/856511803.db2.gz HYSCWDIGXGENDR-UHFFFAOYSA-N 0 3 400.494 4.285 20 0 HIADHN O=C(NCc1nc(-c2ccccc2F)cs1)N1CCN(C2CCCCC2)CC1 ZINC000426896638 856531807 /nfs/dbraw/zinc/53/18/07/856531807.db2.gz MJNHRZGMRQOLOI-UHFFFAOYSA-N 0 3 402.539 4.109 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@@H]2C[C@H]2c2ccc(Cl)s2)cc1 ZINC000426926518 856545534 /nfs/dbraw/zinc/54/55/34/856545534.db2.gz YZTGTCJIXKKEOZ-KZNAEPCWSA-N 0 3 404.963 4.467 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)[C@@H]2C[C@H]2c2ccc(Cl)s2)cc1 ZINC000426926516 856545659 /nfs/dbraw/zinc/54/56/59/856545659.db2.gz YZTGTCJIXKKEOZ-KURKYZTESA-N 0 3 404.963 4.467 20 0 HIADHN CN1CC[C@H](NC(=O)c2cc3ccccc3n2CC(F)(F)F)[C@@H]1c1ccccc1 ZINC000426973318 856571324 /nfs/dbraw/zinc/57/13/24/856571324.db2.gz RVGDMQLHQQTPOI-PXNSSMCTSA-N 0 3 401.432 4.379 20 0 HIADHN CCc1oc(C(=O)OC)cc1CN1CCC[C@@H](c2nc(-c3ccc(F)cc3)no2)C1 ZINC000427017916 856597639 /nfs/dbraw/zinc/59/76/39/856597639.db2.gz XZLNTSOUJOQOES-OAHLLOKOSA-N 0 3 413.449 4.197 20 0 HIADHN Cc1ccc(-c2cc(C(=O)N3CCC(CCN4C[C@@H](C)O[C@H](C)C4)CC3)[nH]n2)c(C)c1 ZINC000427156311 856676462 /nfs/dbraw/zinc/67/64/62/856676462.db2.gz XWFTXFOESMADOE-WOJBJXKFSA-N 0 3 424.589 4.045 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Cc1csc(Cc2cccc(Cl)c2)n1 ZINC000427168674 856687519 /nfs/dbraw/zinc/68/75/19/856687519.db2.gz ABBFDAHYOZIHJH-UHFFFAOYSA-N 0 3 417.962 4.113 20 0 HIADHN O=C(N[C@H]1CCOC2(CCCCC2)C1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000427266810 856744489 /nfs/dbraw/zinc/74/44/89/856744489.db2.gz VGHUXUHDHRLMGB-UGKGYDQZSA-N 0 3 424.507 4.439 20 0 HIADHN COc1ccc(CCC(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)cc1Cl ZINC000427292512 856756152 /nfs/dbraw/zinc/75/61/52/856756152.db2.gz QWCQDQHLNMQVAD-HDICACEKSA-N 0 3 422.997 4.019 20 0 HIADHN Cc1nc2cc(F)ccc2cc1C(=O)N1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000427298283 856758394 /nfs/dbraw/zinc/75/83/94/856758394.db2.gz AZJQYZWNBFRGFC-IRXDYDNUSA-N 0 3 413.537 4.034 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)[C@@H]3C[C@@H]3c3cccc(Cl)c3)CC2)C[C@H](C)O1 ZINC000427318575 856767843 /nfs/dbraw/zinc/76/78/43/856767843.db2.gz ADAKEULEMHUHJY-WOSNLTMFSA-N 0 3 404.982 4.181 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3cc4ccc(Cl)cc4[nH]3)CC2)C[C@@H](C)O1 ZINC000427329596 856775537 /nfs/dbraw/zinc/77/55/37/856775537.db2.gz LBTWAMJTPIAGNR-HZPDHXFCSA-N 0 3 403.954 4.173 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)Cc1ccc(F)c(F)c1 ZINC000427365887 856797167 /nfs/dbraw/zinc/79/71/67/856797167.db2.gz KDYPVGGCFMZSMX-UHFFFAOYSA-N 0 3 400.391 4.117 20 0 HIADHN C[C@@H](NC1CCN([C@@H](C)c2ccncc2)CC1)c1ncc(Br)cc1F ZINC000427525420 856849377 /nfs/dbraw/zinc/84/93/77/856849377.db2.gz QZMWPARWPGSDGT-KGLIPLIRSA-N 0 3 407.331 4.254 20 0 HIADHN FC(F)(F)c1cnc2c(c1)[C@@H](NCc1cccc(CN3CCOCC3)c1)CCC2 ZINC000427563024 856866754 /nfs/dbraw/zinc/86/67/54/856866754.db2.gz KHBZZPYLLMBTFI-FQEVSTJZSA-N 0 3 405.464 4.100 20 0 HIADHN C[C@@H](NCC(C)(C)N1CCc2ccccc2C1)c1ncc(Br)cc1F ZINC000427615893 856888345 /nfs/dbraw/zinc/88/83/45/856888345.db2.gz RAYLZDKBKHNELS-CQSZACIVSA-N 0 3 406.343 4.471 20 0 HIADHN Cc1ccc(-c2cc(C(=O)NC3CCN([C@@H](C)c4ccncc4)CC3)[nH]n2)c(C)c1 ZINC000427619906 856890484 /nfs/dbraw/zinc/89/04/84/856890484.db2.gz CHPNCRYLFFDKFC-SFHVURJKSA-N 0 3 403.530 4.044 20 0 HIADHN O=C(CCc1ccccc1)N1CC[C@H](N[C@H]2CCCc3ncc(C(F)(F)F)cc32)C1 ZINC000427698464 856913868 /nfs/dbraw/zinc/91/38/68/856913868.db2.gz TVUSUGABDANGOU-RXVVDRJESA-N 0 3 417.475 4.301 20 0 HIADHN C[C@@H]1CCN(C(=O)CCCc2nnc(-c3ccccc3)o2)CCN1Cc1ccccc1 ZINC000437494121 862851501 /nfs/dbraw/zinc/85/15/01/862851501.db2.gz JXRWMAMEADLVQK-HXUWFJFHSA-N 0 3 418.541 4.182 20 0 HIADHN COCC1(CN[C@H](C(=O)Nc2ccc(C)c(Cl)c2)c2ccccc2)CCOCC1 ZINC000427836702 856975481 /nfs/dbraw/zinc/97/54/81/856975481.db2.gz YOECARNUZCTLHJ-NRFANRHFSA-N 0 3 416.949 4.361 20 0 HIADHN C[C@H](N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1=O)[C@@H]1OCCc2sccc21 ZINC000427866871 856987367 /nfs/dbraw/zinc/98/73/67/856987367.db2.gz SUQNNQZSVJFOBG-IXDGSTSKSA-N 0 3 422.497 4.137 20 0 HIADHN CO[C@@H](C)c1nc(CN2CCCN(CCCOc3ccc(C)c(C)c3)CC2)cs1 ZINC000437509833 862859558 /nfs/dbraw/zinc/85/95/58/862859558.db2.gz XJQYMSZSVFKGGD-FQEVSTJZSA-N 0 3 417.619 4.444 20 0 HIADHN Cn1ccnc1C[C@@H]1CCCN(Cc2cnn(Cc3ccc(C(F)(F)F)cc3)c2)C1 ZINC000428076834 857063778 /nfs/dbraw/zinc/06/37/78/857063778.db2.gz NVOFYPOJJNRTLT-SFHVURJKSA-N 0 3 417.479 4.138 20 0 HIADHN COc1ccc(NC(=O)C2(NCc3ccc(OC(F)F)cc3)CCCC2)cc1OC ZINC000428374243 857181664 /nfs/dbraw/zinc/18/16/64/857181664.db2.gz ATVNYSYGFRCNRP-UHFFFAOYSA-N 0 3 420.456 4.346 20 0 HIADHN CCCc1nc(C)c(CN2CCC[C@@H](c3nnc4ccc(C(F)(F)F)cn43)C2)o1 ZINC000428380438 857183542 /nfs/dbraw/zinc/18/35/42/857183542.db2.gz CVDLNLSNFKMQDY-CQSZACIVSA-N 0 3 407.440 4.377 20 0 HIADHN c1c(CN2CCC[C@@H](OCC3CC3)C2)c(-c2cccnc2)nn1Cc1ccccc1 ZINC000428388141 857187083 /nfs/dbraw/zinc/18/70/83/857187083.db2.gz VQYDYTPJDABOIC-XMMPIXPASA-N 0 3 402.542 4.384 20 0 HIADHN COc1cc(CN2CC[C@H](O)[C@H](C)C2)ccc1OCc1ccc(Br)cc1 ZINC000428473628 857213858 /nfs/dbraw/zinc/21/38/58/857213858.db2.gz NMZCSFCIGJLHDM-BEFAXECRSA-N 0 3 420.347 4.239 20 0 HIADHN CC(C)COc1ccc(CN(C)[C@H](C)c2cccc(N3CCCS3(=O)=O)c2)cc1 ZINC000428477686 857218193 /nfs/dbraw/zinc/21/81/93/857218193.db2.gz HAERPMDJSBKPHT-LJQANCHMSA-N 0 3 416.587 4.454 20 0 HIADHN C[C@H](c1cccc(N2CCCS2(=O)=O)c1)N(C)C/C=C/c1ccc(F)cc1F ZINC000428481409 857219969 /nfs/dbraw/zinc/21/99/69/857219969.db2.gz NJPIYOMPFDOJEQ-IEXSPKMKSA-N 0 3 406.498 4.211 20 0 HIADHN O=C(NCC(F)(F)F)[C@@H]1CCN(Cc2ccc(-c3nc4ccccc4s3)o2)C1 ZINC000428485547 857222845 /nfs/dbraw/zinc/22/28/45/857222845.db2.gz SBXJQYHABKRNCA-GFCCVEGCSA-N 0 3 409.433 4.057 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)c1cc2c(s1)-c1ccccc1OC2 ZINC000428527095 857241406 /nfs/dbraw/zinc/24/14/06/857241406.db2.gz APTYBSWUEYWEFE-SFHVURJKSA-N 0 3 406.507 4.126 20 0 HIADHN Cc1onc(-c2cccc(Cl)c2)c1C(=O)Nc1cccc(CN2CC[C@@H](O)C2)c1 ZINC000428536176 857249674 /nfs/dbraw/zinc/24/96/74/857249674.db2.gz RDUJABTUCXTRIP-LJQANCHMSA-N 0 3 411.889 4.122 20 0 HIADHN C[C@@H](Cc1ccc(Cl)cc1Cl)C(=O)Nc1cccc(CN2CC[C@H](O)C2)c1 ZINC000428547299 857258881 /nfs/dbraw/zinc/25/88/81/857258881.db2.gz YPOUACZIRIAWTB-LIRRHRJNSA-N 0 3 407.341 4.377 20 0 HIADHN O=C(Cc1cc2c(ccc3ccccc23)o1)Nc1cccc(CN2CC[C@H](O)C2)c1 ZINC000428552462 857261939 /nfs/dbraw/zinc/26/19/39/857261939.db2.gz MPEQMHYELKKYHL-FQEVSTJZSA-N 0 3 400.478 4.334 20 0 HIADHN O=C(CCCc1cccc(C(F)(F)F)c1)Nc1cccc(CN2CC[C@H](O)C2)c1 ZINC000428555560 857263557 /nfs/dbraw/zinc/26/35/57/857263557.db2.gz YORVEDWBJPFCNS-FQEVSTJZSA-N 0 3 406.448 4.233 20 0 HIADHN CC[C@@H](NC(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1)c1cc(F)ccc1F ZINC000428584409 857272076 /nfs/dbraw/zinc/27/20/76/857272076.db2.gz VKSQOVKABYIYDH-SIKLNZKXSA-N 0 3 417.500 4.006 20 0 HIADHN CC[C@@H](NC(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1)c1cc(F)ccc1F ZINC000428584402 857272228 /nfs/dbraw/zinc/27/22/28/857272228.db2.gz VKSQOVKABYIYDH-DENIHFKCSA-N 0 3 417.500 4.006 20 0 HIADHN CCOC(=O)Cn1nc(C)c(CN2CC=C(c3c(C)[nH]c4ccccc43)CC2)c1C ZINC000437579223 862896104 /nfs/dbraw/zinc/89/61/04/862896104.db2.gz NVSIQGLDNNZVIC-UHFFFAOYSA-N 0 3 406.530 4.142 20 0 HIADHN Cc1cccc(NC(=O)CN2CCN([C@H]3CC[C@](C)(c4ccccc4)C3)CC2)c1C ZINC000437580065 862897290 /nfs/dbraw/zinc/89/72/90/862897290.db2.gz OXEIAXWZHBYNAD-OZXSUGGESA-N 0 3 405.586 4.370 20 0 HIADHN C[C@H](NC(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1)c1cc2ccccc2o1 ZINC000428760502 857323361 /nfs/dbraw/zinc/32/33/61/857323361.db2.gz SVCXPSJMIYWUAE-GHTZIAJQSA-N 0 3 407.514 4.084 20 0 HIADHN COC(=O)c1occc1CN(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000428795653 857344754 /nfs/dbraw/zinc/34/47/54/857344754.db2.gz SFKDWSXSYZUXMY-QHCPKHFHSA-N 0 3 419.525 4.128 20 0 HIADHN COCc1nc(CN(Cc2ccncc2)[C@@H]2CCCN(Cc3ccccc3)C2)cs1 ZINC000428797258 857347079 /nfs/dbraw/zinc/34/70/79/857347079.db2.gz PRKKKWUFOOGLJK-HSZRJFAPSA-N 0 3 422.598 4.351 20 0 HIADHN c1nc2ccccn2c1CN(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000428808262 857353769 /nfs/dbraw/zinc/35/37/69/857353769.db2.gz SMRLPYCQDCANHH-XMMPIXPASA-N 0 3 411.553 4.396 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)NCC(C)(C)c3ccc(F)cc3)CC2)C[C@H](C)O1 ZINC000428830320 857364188 /nfs/dbraw/zinc/36/41/88/857364188.db2.gz RMUHLCGTMAKDJC-OALUTQOASA-N 0 3 419.585 4.024 20 0 HIADHN O=C(NCCCNCc1nc2ccc(F)cc2s1)c1cccc(Br)c1 ZINC000428887384 857391442 /nfs/dbraw/zinc/39/14/42/857391442.db2.gz LFBOZZCVDWMVGH-UHFFFAOYSA-N 0 3 422.323 4.108 20 0 HIADHN CC(C)N(C)c1cccc(NC(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)c1 ZINC000428887826 857392195 /nfs/dbraw/zinc/39/21/95/857392195.db2.gz PPKSYZBMEPMLPT-PMACEKPBSA-N 0 3 416.610 4.274 20 0 HIADHN CCc1ccccc1NC(=O)CN1CCN([C@H]2CC[C@@](C)(c3ccccc3)C2)CC1 ZINC000437593684 862907865 /nfs/dbraw/zinc/90/78/65/862907865.db2.gz UQCJXDULJLZLIJ-JYFHCDHNSA-N 0 3 405.586 4.316 20 0 HIADHN CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)C(=O)c1ccc(-c2ccc(F)cc2)s1 ZINC000428980260 857442909 /nfs/dbraw/zinc/44/29/09/857442909.db2.gz UWBVGAOLXRYTTI-DEOSSOPVSA-N 0 3 424.541 4.263 20 0 HIADHN CO[C@H](CN[C@@H](CO)c1ccc(Br)c(F)c1)c1ccc(Cl)cc1 ZINC000428992631 857447303 /nfs/dbraw/zinc/44/73/03/857447303.db2.gz KLRHICJKYBPNQO-DLBZAZTESA-N 0 3 402.691 4.252 20 0 HIADHN OC[C@H](NCCOc1ccc(F)cc1Cl)c1ccc(Br)c(F)c1 ZINC000428994542 857448634 /nfs/dbraw/zinc/44/86/34/857448634.db2.gz NEAWDTFCVXOHOV-HNNXBMFYSA-N 0 3 406.654 4.083 20 0 HIADHN CN(Cc1ccc2ccccc2c1)C(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000429021143 857461758 /nfs/dbraw/zinc/46/17/58/857461758.db2.gz PIQNTWIGMGICSY-VWLOTQADSA-N 0 3 417.553 4.272 20 0 HIADHN Cc1cc(N2CCCC2)ccc1NC(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000429037853 857468406 /nfs/dbraw/zinc/46/84/06/857468406.db2.gz ZGYZCZFOZMLZKD-QHCPKHFHSA-N 0 3 422.573 4.008 20 0 HIADHN CC(C)[C@@H](c1ccccc1)N(C)C(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000429036690 857468834 /nfs/dbraw/zinc/46/88/34/857468834.db2.gz UEXBOWAMFFJYJO-RPWUZVMVSA-N 0 3 409.574 4.316 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3cccc(N4CCCC4)c3)CC2)C[C@@H](C)O1 ZINC000429042523 857471918 /nfs/dbraw/zinc/47/19/18/857471918.db2.gz CEIYEMBPNHKBQN-WOJBJXKFSA-N 0 3 414.594 4.030 20 0 HIADHN Cc1cc(-c2cc(C(=O)N[C@H]3C[C@H](C)N(C4CC4)C3)c3c(C)noc3n2)c(C)s1 ZINC000429047164 857474284 /nfs/dbraw/zinc/47/42/84/857474284.db2.gz OVCOXLSJVMGIPM-NHYWBVRUSA-N 0 3 410.543 4.232 20 0 HIADHN CC(C)OCc1cccc(NC(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)c1 ZINC000429046158 857474750 /nfs/dbraw/zinc/47/47/50/857474750.db2.gz MCYSSHGBCMOLPM-PMACEKPBSA-N 0 3 417.594 4.355 20 0 HIADHN Cc1cc(-c2cc(C(=O)N[C@H]3C[C@@H](C)N(C4CC4)C3)c3c(C)noc3n2)c(C)s1 ZINC000429047162 857474758 /nfs/dbraw/zinc/47/47/58/857474758.db2.gz OVCOXLSJVMGIPM-ABAIWWIYSA-N 0 3 410.543 4.232 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N[C@@H](C)c2cccc(N3CCCC3)c2)C1 ZINC000429080713 857499155 /nfs/dbraw/zinc/49/91/55/857499155.db2.gz ONLBZMDUDUNMDA-MZKRTTBSSA-N 0 3 406.574 4.483 20 0 HIADHN CN(CCNC(=O)Nc1cccc(NC(=O)C2CCCCC2)c1)Cc1ccccc1 ZINC000429217560 857559703 /nfs/dbraw/zinc/55/97/03/857559703.db2.gz WTQZUEMAMGEQIX-UHFFFAOYSA-N 0 3 408.546 4.459 20 0 HIADHN C[C@H](NC(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1)c1ccc(Cl)cc1 ZINC000429218898 857560947 /nfs/dbraw/zinc/56/09/47/857560947.db2.gz ZWWPQRJZRVLXOV-KSZLIROESA-N 0 3 407.986 4.322 20 0 HIADHN CCCn1ccnc1CCCN(C)CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 ZINC000429236001 857567571 /nfs/dbraw/zinc/56/75/71/857567571.db2.gz GWYUBDVUAWRFRW-UHFFFAOYSA-N 0 3 416.875 4.468 20 0 HIADHN O=C(CN[C@@H]1Cc2cccc(O)c2C1)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 ZINC000429297823 857596492 /nfs/dbraw/zinc/59/64/92/857596492.db2.gz UTKLPUJFHFTFJS-DNVCBOLYSA-N 0 3 405.325 4.120 20 0 HIADHN FC(F)(F)Cn1nnnc1CN[C@@H]1CCCCC[C@H]1c1ccccc1C(F)(F)F ZINC000429328463 857604868 /nfs/dbraw/zinc/60/48/68/857604868.db2.gz JCXCMYSOWJPRIP-DZGCQCFKSA-N 0 3 421.389 4.460 20 0 HIADHN Cc1nc(C(=O)NC[C@H]2CN(Cc3ccccc3)CCCO2)c(-c2ccccc2)s1 ZINC000429342528 857610846 /nfs/dbraw/zinc/61/08/46/857610846.db2.gz ZQVQVYMIKMWGRG-NRFANRHFSA-N 0 3 421.566 4.139 20 0 HIADHN Cc1ccc(S(=O)(=O)c2ccc(CN3CCN(C4CCC4)C[C@H](C)C3)cc2)cc1 ZINC000429395542 857640034 /nfs/dbraw/zinc/64/00/34/857640034.db2.gz UASYVDODRRQMSZ-HXUWFJFHSA-N 0 3 412.599 4.134 20 0 HIADHN O=C(c1cccc(CN[C@@H](Cc2ccccc2F)c2ccccc2)c1)N1CCOCC1 ZINC000429421137 857657572 /nfs/dbraw/zinc/65/75/72/857657572.db2.gz DLZQNRRFRGJJSR-VWLOTQADSA-N 0 3 418.512 4.372 20 0 HIADHN Cc1cc([C@H](NC[C@H]2CN(Cc3ccccc3)CCCO2)c2cccnc2)ccc1F ZINC000429439079 857668536 /nfs/dbraw/zinc/66/85/36/857668536.db2.gz ARFVGESDZPPRBC-AHWVRZQESA-N 0 3 419.544 4.499 20 0 HIADHN CCO[C@@H]1C[C@@H](NC(=O)N(Cc2ccco2)C2CCN(C)CC2)C12CCCCC2 ZINC000429463414 857684140 /nfs/dbraw/zinc/68/41/40/857684140.db2.gz BPNNMYYKGUBGNI-NHCUHLMSSA-N 0 3 403.567 4.013 20 0 HIADHN Cc1noc(C[C@@H](N[C@@H](C)c2ccc(NC(=O)NC3CC3)cc2)c2ccccc2)n1 ZINC000429474818 857687878 /nfs/dbraw/zinc/68/78/78/857687878.db2.gz RXALJQARXXZZOS-YCRPNKLZSA-N 0 3 405.502 4.297 20 0 HIADHN Cc1noc(C[C@@H](N[C@@H](C)c2ccc(OCc3nccn3C)cc2)c2ccccc2)n1 ZINC000429478479 857688708 /nfs/dbraw/zinc/68/87/08/857688708.db2.gz YNZBLEPQIDJVTI-HTAPYJJXSA-N 0 3 417.513 4.325 20 0 HIADHN Cc1noc(C[C@@H](N[C@H](C)c2ccc(OCc3nccn3C)cc2)c2ccccc2)n1 ZINC000429478481 857689047 /nfs/dbraw/zinc/68/90/47/857689047.db2.gz YNZBLEPQIDJVTI-VGOFRKELSA-N 0 3 417.513 4.325 20 0 HIADHN CC[C@H](NC(=O)N1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1)c1ccc(F)cc1F ZINC000429486143 857691519 /nfs/dbraw/zinc/69/15/19/857691519.db2.gz DTNNTZKEMGFERU-HOIFWPIMSA-N 0 3 423.548 4.337 20 0 HIADHN CC[C@H](NC(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1)c1ccc(F)cc1F ZINC000429486149 857691529 /nfs/dbraw/zinc/69/15/29/857691529.db2.gz DTNNTZKEMGFERU-JKSBSHDWSA-N 0 3 423.548 4.337 20 0 HIADHN CC(C)(C)[C@@H](CN1CCc2ccccc2C1)NC(=O)N1CCCC[C@@H]1c1ncc[nH]1 ZINC000429499677 857699454 /nfs/dbraw/zinc/69/94/54/857699454.db2.gz UHOOMLRFOXRCJZ-NHCUHLMSSA-N 0 3 409.578 4.119 20 0 HIADHN COC1(C[C@@H](C)N[C@H](c2ccc(F)cc2)c2cccc(S(C)(=O)=O)c2)CCC1 ZINC000429526013 857718058 /nfs/dbraw/zinc/71/80/58/857718058.db2.gz HTQICUMAOPATGR-IIBYNOLFSA-N 0 3 405.535 4.256 20 0 HIADHN O=C(Nc1ccnn1Cc1ccc(F)cc1)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000429573929 857759260 /nfs/dbraw/zinc/75/92/60/857759260.db2.gz OHZVMGUYCNTESL-NRFANRHFSA-N 0 3 407.493 4.029 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)Nc2ccnn2Cc2ccc(F)cc2)C1 ZINC000429597350 857778461 /nfs/dbraw/zinc/77/84/61/857778461.db2.gz MUCSFKGNQXLKLM-LAUBAEHRSA-N 0 3 407.493 4.028 20 0 HIADHN CC(C)Oc1cc(F)ccc1NC(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000429601147 857784436 /nfs/dbraw/zinc/78/44/36/857784436.db2.gz KMNJOYFNILGINA-HXUWFJFHSA-N 0 3 415.509 4.026 20 0 HIADHN Cc1c(Cl)cc(F)c(NC(=O)NC[C@@H]2CN(Cc3ccccc3)CCCO2)c1F ZINC000429614612 857796008 /nfs/dbraw/zinc/79/60/08/857796008.db2.gz YBYVYMVUYHQBFW-MRXNPFEDSA-N 0 3 423.891 4.339 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1ncc(F)cc1F)c1ccc(C(F)(F)F)cc1 ZINC000429647651 857816808 /nfs/dbraw/zinc/81/68/08/857816808.db2.gz ROLLWXATSFDACB-MRXNPFEDSA-N 0 3 401.379 4.192 20 0 HIADHN c1cc2n(c1)CCN(C[C@H]1CN(Cc3ccccc3)CCCO1)[C@H]2c1ccccc1 ZINC000429684458 857833660 /nfs/dbraw/zinc/83/36/60/857833660.db2.gz MQHFAYPFRKDIPP-RSXGOPAZSA-N 0 3 401.554 4.184 20 0 HIADHN Clc1ccccc1[C@@H]1CN(C[C@@H]2CN(Cc3ccccc3)CCCO2)CCO1 ZINC000429685735 857834717 /nfs/dbraw/zinc/83/47/17/857834717.db2.gz XOKHXKRZDYTXHN-REWPJTCUSA-N 0 3 400.950 4.004 20 0 HIADHN FC(F)(F)C1(C(F)(F)F)CCN(C[C@@H]2CN(Cc3ccccc3)CCCO2)C1 ZINC000429692841 857836895 /nfs/dbraw/zinc/83/68/95/857836895.db2.gz WSOAMGUXYFZINM-INIZCTEOSA-N 0 3 410.402 4.094 20 0 HIADHN CC(C)(C)Oc1ccccc1NC(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000429744681 857865597 /nfs/dbraw/zinc/86/55/97/857865597.db2.gz RHJFUYQJOYMEFD-HXUWFJFHSA-N 0 3 411.546 4.277 20 0 HIADHN Cc1nnc(SC[C@H]2CN(Cc3ccccc3)CCCO2)n1-c1ccccc1C ZINC000430102532 858032854 /nfs/dbraw/zinc/03/28/54/858032854.db2.gz QSLCUKSZWDONIE-OAQYLSRUSA-N 0 3 408.571 4.267 20 0 HIADHN CN(CCSc1nnc(-c2cccs2)n1C[C@H]1CCCO1)Cc1ccccc1 ZINC000430118812 858040039 /nfs/dbraw/zinc/04/00/39/858040039.db2.gz JOZIXNJCAZZHRN-GOSISDBHSA-N 0 3 414.600 4.410 20 0 HIADHN CC(C)c1ccc2c(c1)[C@@H](NC(=O)NCc1ccccc1CN1CCC(O)CC1)CC2 ZINC000430199924 858079231 /nfs/dbraw/zinc/07/92/31/858079231.db2.gz SNPABABSYPHEAI-VWLOTQADSA-N 0 3 421.585 4.253 20 0 HIADHN C[C@@H]1CN(CCC(=O)Nc2ccccc2-c2ccccc2)C[C@@]2(CCO[C@H](C)C2)O1 ZINC000430278483 858106342 /nfs/dbraw/zinc/10/63/42/858106342.db2.gz QDQRXESXMACRHG-FHAGJXEFSA-N 0 3 408.542 4.341 20 0 HIADHN CN(C(=O)[C@@H]1CCN(Cc2ccc(Br)c3cccnc23)C1)c1ccccc1 ZINC000430290633 858110959 /nfs/dbraw/zinc/11/09/59/858110959.db2.gz CSSXMQJSKYVTDQ-QGZVFWFLSA-N 0 3 424.342 4.482 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1cc2sccc2[nH]1 ZINC000430294493 858111447 /nfs/dbraw/zinc/11/14/47/858111447.db2.gz OZBPTTBCNRQIEQ-QGZVFWFLSA-N 0 3 405.527 4.434 20 0 HIADHN CN(C(=O)[C@H]1CCN(Cc2cc(Br)cc3cccnc32)C1)c1ccccc1 ZINC000430343890 858128230 /nfs/dbraw/zinc/12/82/30/858128230.db2.gz NXCVTJJIHPYZMC-KRWDZBQOSA-N 0 3 424.342 4.482 20 0 HIADHN CCn1ccnc1[C@@H]1CCCCN1C(=O)NC[C@H](c1ccc(C)cc1)N1CCCC1 ZINC000430543507 858212523 /nfs/dbraw/zinc/21/25/23/858212523.db2.gz YQBSNUYUOXJJIA-FCHUYYIVSA-N 0 3 409.578 4.285 20 0 HIADHN CN(C(=O)c1cccc(C(F)(F)F)c1F)C1CCN(CCc2ccccn2)CC1 ZINC000430759454 858292739 /nfs/dbraw/zinc/29/27/39/858292739.db2.gz DQDGSQULOQXSIN-UHFFFAOYSA-N 0 3 409.427 4.019 20 0 HIADHN COc1ccccc1-n1nccc1CNc1ccc(CN2CCSCC2)cc1C ZINC000430766768 858296855 /nfs/dbraw/zinc/29/68/55/858296855.db2.gz YRCUWUQFUFAYBZ-UHFFFAOYSA-N 0 3 408.571 4.350 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Cc3c[nH]c4cccc(Cl)c34)c(C)c2)CC1 ZINC000430874371 858349903 /nfs/dbraw/zinc/34/99/03/858349903.db2.gz ZSCNYAUJKGDOCF-UHFFFAOYSA-N 0 3 410.949 4.453 20 0 HIADHN C[C@H]1CCN(C(=O)NCc2c(F)cc(F)c(F)c2F)CCN1Cc1ccccc1 ZINC000430935524 858374643 /nfs/dbraw/zinc/37/46/43/858374643.db2.gz QJURIKNJWCIVPC-AWEZNQCLSA-N 0 3 409.427 4.049 20 0 HIADHN O=C1[C@@H]2C[C@@H](C3CCCCC3)CN2C(=O)N1C[C@@H](c1cccs1)N1CCCC1 ZINC000430976861 858388669 /nfs/dbraw/zinc/38/86/69/858388669.db2.gz UIJFCPMVAYAQMJ-QYZOEREBSA-N 0 3 401.576 4.118 20 0 HIADHN CC(C)C(=O)Nc1cccc(NC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)c1 ZINC000437676387 863018077 /nfs/dbraw/zinc/01/80/77/863018077.db2.gz BEPVFYOXFAOEKE-IBGZPJMESA-N 0 3 408.546 4.409 20 0 HIADHN COCCCOc1cccc(NC(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)c1 ZINC000431102992 858447034 /nfs/dbraw/zinc/44/70/34/858447034.db2.gz NWQRYLXQNYVUHW-FQEVSTJZSA-N 0 3 411.546 4.230 20 0 HIADHN CCc1noc(-c2ccc(C)c(NC(=O)NC[C@H](c3ccc(C)cc3)N(C)C)c2)n1 ZINC000431111527 858451284 /nfs/dbraw/zinc/45/12/84/858451284.db2.gz XRYGDJRQWKWAGG-HXUWFJFHSA-N 0 3 407.518 4.340 20 0 HIADHN CCCN(C(=O)c1cccs1)C1CCN(CCOc2ccc(OC)cc2)CC1 ZINC000431145589 858469817 /nfs/dbraw/zinc/46/98/17/858469817.db2.gz YUNMWUCAQOWASJ-UHFFFAOYSA-N 0 3 402.560 4.152 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3ccc4nc(C5CC5)oc4c3)CC2)C[C@@H](C)O1 ZINC000431154411 858473835 /nfs/dbraw/zinc/47/38/35/858473835.db2.gz VNHWISATLAHCSW-HZPDHXFCSA-N 0 3 412.534 4.058 20 0 HIADHN COc1cnccc1N1CCN(C(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)CC1 ZINC000431420891 858606396 /nfs/dbraw/zinc/60/63/96/858606396.db2.gz VCJKEAYFRCNMBH-UHFFFAOYSA-N 0 3 414.815 4.117 20 0 HIADHN CCOc1cccc2[nH]cc(CC(=O)NC[C@@H](CC)N3CCc4ccccc4C3)c21 ZINC000437719990 863050393 /nfs/dbraw/zinc/05/03/93/863050393.db2.gz FTAPLUSRJYAPFF-OAQYLSRUSA-N 0 3 405.542 4.062 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)c3c(Cl)cc(F)cc3Cl)CC2)C[C@@H](C)O1 ZINC000431621030 858694271 /nfs/dbraw/zinc/69/42/71/858694271.db2.gz BENUBFVUBPEQCC-CHWSQXEVSA-N 0 3 403.325 4.094 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CC(C)(C)[C@@H]1c1ccncc1)c1cccc(OC)c1 ZINC000431775109 858806107 /nfs/dbraw/zinc/80/61/07/858806107.db2.gz HQQMVNPCCMSQGW-VXKWHMMOSA-N 0 3 410.562 4.266 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)c2ccc3c(ccn3Cc3ccccc3)c2)C[C@@H](C)O1 ZINC000431837977 858834496 /nfs/dbraw/zinc/83/44/96/858834496.db2.gz OLAOMPROJHTAFS-NHCUHLMSSA-N 0 3 419.569 4.309 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NC(C)(C)c1ncc(C)s1)c1cccc(OC)c1 ZINC000431876404 858851673 /nfs/dbraw/zinc/85/16/73/858851673.db2.gz VORVGBXDLUYKSS-SFHVURJKSA-N 0 3 404.580 4.078 20 0 HIADHN CCOc1ccccc1NC(=O)CCN(CC(=O)Nc1ccc(F)cc1)C(C)(C)C ZINC000432025543 858937029 /nfs/dbraw/zinc/93/70/29/858937029.db2.gz JUHLACWIUFMVMY-UHFFFAOYSA-N 0 3 415.509 4.292 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Cc3cscc3Br)c(C)c2)CC1 ZINC000432030311 858939064 /nfs/dbraw/zinc/93/90/64/858939064.db2.gz DEEBWIXZTHDJQN-UHFFFAOYSA-N 0 3 422.392 4.142 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)N[C@@H](c3ccc(F)cc3)C(F)(F)F)CC2)c1 ZINC000467554220 881376516 /nfs/dbraw/zinc/37/65/16/881376516.db2.gz OCGYLTIVBXJEOB-NRFANRHFSA-N 0 3 423.454 4.066 20 0 HIADHN Cc1cc(NC(=O)N(C)Cc2cnccc2C)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000432278056 859081671 /nfs/dbraw/zinc/08/16/71/859081671.db2.gz WRIBFKOJOUPXIG-JOCHJYFZSA-N 0 3 418.545 4.006 20 0 HIADHN CCCN(C(=O)NCc1ccc2c(c1)COC2)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000432491634 859190664 /nfs/dbraw/zinc/19/06/64/859190664.db2.gz CYGWZUBCIQOUCX-DEOSSOPVSA-N 0 3 407.558 4.303 20 0 HIADHN CN(C(=O)c1cncc(-c2ccc3c(c2)CCO3)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000432757657 859337529 /nfs/dbraw/zinc/33/75/29/859337529.db2.gz KREMCAQGQMYWCX-DEOSSOPVSA-N 0 3 413.521 4.030 20 0 HIADHN Cc1ccc(-c2cncc(C(=O)N3CCC(CCN4C[C@@H](C)O[C@H](C)C4)CC3)c2)cc1 ZINC000467602028 881409879 /nfs/dbraw/zinc/40/98/79/881409879.db2.gz MVTXQNVPWFMEPE-NHCUHLMSSA-N 0 3 421.585 4.409 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)N[C@H](c1ccccc1)C(F)F ZINC000432768114 859347668 /nfs/dbraw/zinc/34/76/68/859347668.db2.gz MZOWGJFBJZDKKA-LJQANCHMSA-N 0 3 405.514 4.406 20 0 HIADHN O[C@@H](COCC(F)(F)F)CN(Cc1ccccc1Br)C1CCCC1 ZINC000432773429 859354008 /nfs/dbraw/zinc/35/40/08/859354008.db2.gz GDBFECSYFMFUND-OAHLLOKOSA-N 0 3 410.274 4.134 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2CN(C)CCCNC(=O)C2CCC2)o1 ZINC000432801682 859367639 /nfs/dbraw/zinc/36/76/39/859367639.db2.gz XTNOWHMNZYGCJX-UHFFFAOYSA-N 0 3 406.530 4.179 20 0 HIADHN O=S1(=O)CCCN1[C@@H]1CCCN(c2ccnc3ccc(Oc4ccccc4)cc32)C1 ZINC000432922765 859432269 /nfs/dbraw/zinc/43/22/69/859432269.db2.gz BLVDGOIEPLZHHX-GOSISDBHSA-N 0 3 423.538 4.031 20 0 HIADHN CN(C)[C@@H]1CCOc2c(Nc3cc(C(F)(F)F)nc(-c4cccnc4)n3)cccc21 ZINC000432945629 859441031 /nfs/dbraw/zinc/44/10/31/859441031.db2.gz TYLHXJSOHDDVPI-MRXNPFEDSA-N 0 3 415.419 4.686 20 0 HIADHN CCc1nc(-c2ccc(C(=O)N(CC)[C@@H]3CCN([C@H](C)c4ccccc4)C3)cc2)n[nH]1 ZINC000433018347 859480653 /nfs/dbraw/zinc/48/06/53/859480653.db2.gz DMYQGSJRUVFHII-XMSQKQJNSA-N 0 3 417.557 4.332 20 0 HIADHN COC(=O)c1ccccc1-c1ccc(CNC[C@]2(CO)C[C@@H]2c2ccc(F)cc2)o1 ZINC000433045425 859496996 /nfs/dbraw/zinc/49/69/96/859496996.db2.gz QOJXRRBYXNSIBF-QPPBQGQZSA-N 0 3 409.457 4.128 20 0 HIADHN CCCc1c(NC(=O)N(CCN(C)C)Cc2ccccn2)cnn1-c1ccc(C)cc1 ZINC000433118126 859527639 /nfs/dbraw/zinc/52/76/39/859527639.db2.gz QRNVRNVMEZSBHL-UHFFFAOYSA-N 0 3 420.561 4.124 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)[C@H]1C[C@H]1c1cc(F)c(F)c(F)c1 ZINC000467635510 881433569 /nfs/dbraw/zinc/43/35/69/881433569.db2.gz YTVLIGNUGXYCPK-OALUTQOASA-N 0 3 418.459 4.050 20 0 HIADHN COc1ccc(OCCCN2CCC(c3nc(-c4ccccc4OC)no3)CC2)cc1 ZINC000433158426 859546211 /nfs/dbraw/zinc/54/62/11/859546211.db2.gz ATMHPAHSQWGYAD-UHFFFAOYSA-N 0 3 423.513 4.402 20 0 HIADHN COc1ccccc1OCCN1CCC(c2nc(-c3ccccc3OC)no2)CC1 ZINC000433175214 859555543 /nfs/dbraw/zinc/55/55/43/859555543.db2.gz PBKGRSYLVFAFRX-UHFFFAOYSA-N 0 3 409.486 4.012 20 0 HIADHN CN(C)Cc1ccccc1C(=O)Nc1cccc(OCC(=O)Nc2ccccc2)c1 ZINC000433303923 859626956 /nfs/dbraw/zinc/62/69/56/859626956.db2.gz LWNXCFZKAUSJAO-UHFFFAOYSA-N 0 3 403.482 4.018 20 0 HIADHN C[C@H]1CN([C@@H](CNCc2ccc(-c3cc[nH]n3)o2)c2c(F)cccc2Cl)CCO1 ZINC000433328401 859645508 /nfs/dbraw/zinc/64/55/08/859645508.db2.gz RYGRMEMAMMHMLN-LIRRHRJNSA-N 0 3 418.900 4.014 20 0 HIADHN C[C@@H](NC(=O)NC[C@@H]1CCCCN1C1CC1)c1cccc(OCc2ccccn2)c1 ZINC000433553296 859773073 /nfs/dbraw/zinc/77/30/73/859773073.db2.gz DYNFYIQSMLXQDP-GCJKJVERSA-N 0 3 408.546 4.038 20 0 HIADHN CSC1(CNC(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)CCC1 ZINC000433566867 859782799 /nfs/dbraw/zinc/78/27/99/859782799.db2.gz XUSRLGILUGDCFK-LJQANCHMSA-N 0 3 413.591 4.046 20 0 HIADHN CC(=O)Nc1ccc(C(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)cc1F ZINC000433588183 859798051 /nfs/dbraw/zinc/79/80/51/859798051.db2.gz USBPFBVTAQEVNH-IBGZPJMESA-N 0 3 403.523 4.049 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)Nc3ccc4cc[nH]c4c3)CC2)c1 ZINC000433621126 859814356 /nfs/dbraw/zinc/81/43/56/859814356.db2.gz FRUMBLMHHHNTEC-UHFFFAOYSA-N 0 3 405.546 4.200 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)N[C@H](c1cc(F)ccc1F)C(F)F ZINC000433647219 859822918 /nfs/dbraw/zinc/82/29/18/859822918.db2.gz CDRXCIBZCJJURH-RTBURBONSA-N 0 3 409.427 4.407 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)N[C@H](c1cc(F)ccc1F)C(F)F ZINC000433648569 859824207 /nfs/dbraw/zinc/82/42/07/859824207.db2.gz JCQVVZIVXVQXIC-MRXNPFEDSA-N 0 3 403.445 4.106 20 0 HIADHN CCNC(=O)Nc1cccc(NC(=O)NC[C@H](c2cccs2)N2CCCC2)c1C ZINC000433728880 859858959 /nfs/dbraw/zinc/85/89/59/859858959.db2.gz NZPNQKGWBPZAEV-GOSISDBHSA-N 0 3 415.563 4.157 20 0 HIADHN CC(C)(C)OC(=O)CCC(=O)N[C@H](c1ccc(F)c(F)c1)C(C)(C)N1CCCC1 ZINC000433870510 859944371 /nfs/dbraw/zinc/94/43/71/859944371.db2.gz QYFUCCXSSUWOTL-HXUWFJFHSA-N 0 3 410.505 4.118 20 0 HIADHN CC(C)C(=O)Nc1ccc(Cl)c(C(=O)N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)c1 ZINC000467689629 881482058 /nfs/dbraw/zinc/48/20/58/881482058.db2.gz WLBJTVSZKYZERL-APWZRJJASA-N 0 3 413.949 4.327 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)NC[C@@H]1CCCN(c2ccccc2)C1 ZINC000433914857 859967080 /nfs/dbraw/zinc/96/70/80/859967080.db2.gz KQUXZXJWZLSIEU-URXFXBBRSA-N 0 3 406.574 4.039 20 0 HIADHN O=C(NC[C@@H]1CCCN(c2ccccc2)C1)N[C@H](CN1CCCC1)c1ccccc1 ZINC000433936110 859984362 /nfs/dbraw/zinc/98/43/62/859984362.db2.gz GWZFJFDDCGHKMW-XUZZJYLKSA-N 0 3 406.574 4.039 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)c2cn(C)nc2-c2ccccc2Cl)CN1Cc1ccccc1 ZINC000467693700 881487314 /nfs/dbraw/zinc/48/73/14/881487314.db2.gz BQPCMKPWGWHIMI-SJLPKXTDSA-N 0 3 408.933 4.133 20 0 HIADHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(C)c(NC(=O)Nc2ccccc2)c1 ZINC000434030485 860050890 /nfs/dbraw/zinc/05/08/90/860050890.db2.gz IFFIJBUAGHLWCV-RTWAWAEBSA-N 0 3 406.530 4.338 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)N(CCCO)Cc2cccc(Cl)c2)C1 ZINC000434037722 860056094 /nfs/dbraw/zinc/05/60/94/860056094.db2.gz SEFRZMPKJCRQRN-PGRDOPGGSA-N 0 3 415.965 4.070 20 0 HIADHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(SCc2csc(C)n2)cc1 ZINC000434045879 860061266 /nfs/dbraw/zinc/06/12/66/860061266.db2.gz IDZYQHODNUPUFJ-MOPGFXCFSA-N 0 3 401.601 4.443 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)c2ccc(OCc3ccccn3)cc2)CN1Cc1ccccc1 ZINC000467700726 881495887 /nfs/dbraw/zinc/49/58/87/881495887.db2.gz NHXCZAITRLILJZ-WMZHIEFXSA-N 0 3 401.510 4.053 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2cccc(-c3noc(C4CC4)n3)c2)N(C)C)cc1 ZINC000434055197 860068156 /nfs/dbraw/zinc/06/81/56/860068156.db2.gz YAZRKZCUSPROSX-FQEVSTJZSA-N 0 3 405.502 4.347 20 0 HIADHN Cc1c(C2CC2)nc2ccc(Br)cc2c1C(=O)N[C@@H]1CCN(C2CC2)C1 ZINC000434197772 860184592 /nfs/dbraw/zinc/18/45/92/860184592.db2.gz SFNVQCYHLYEZIX-OAHLLOKOSA-N 0 3 414.347 4.150 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)c1ccc(-c2nc(C3CC3)no2)cc1 ZINC000434217999 860203057 /nfs/dbraw/zinc/20/30/57/860203057.db2.gz OSHIGDMQODPWAP-OAQYLSRUSA-N 0 3 402.498 4.181 20 0 HIADHN CCn1nccc1C1CCN(C(=O)NC[C@H](c2ccccc2)N2CCC(C)CC2)CC1 ZINC000434268266 860242177 /nfs/dbraw/zinc/24/21/77/860242177.db2.gz HZAPSUXPZOYAAL-XMMPIXPASA-N 0 3 423.605 4.265 20 0 HIADHN C[C@H]1CN(C2CC2)C[C@@H]1NC(=O)c1cc(-c2ccc(F)cc2)nc2onc(C3CC3)c21 ZINC000467718116 881517402 /nfs/dbraw/zinc/51/74/02/881517402.db2.gz LBOYXXDXASIYEH-RBZFPXEDSA-N 0 3 420.488 4.119 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)CO[C@H]1CCCC[C@@H]1C ZINC000434319564 860279427 /nfs/dbraw/zinc/27/94/27/860279427.db2.gz YLDOSWGLGXMQIC-BWAGFHJFSA-N 0 3 410.562 4.172 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)Cc1cc(F)ccc1F ZINC000434321192 860281098 /nfs/dbraw/zinc/28/10/98/860281098.db2.gz KUTMOTPGEFTWDB-HXUWFJFHSA-N 0 3 410.468 4.098 20 0 HIADHN CCO[C@H](CC(=O)Nc1c(C)cnn1[C@@H]1CCN(Cc2ccccc2)C1)C1=CCCC1 ZINC000434333118 860295064 /nfs/dbraw/zinc/29/50/64/860295064.db2.gz DKJDYFMTLLGDOU-DHIUTWEWSA-N 0 3 422.573 4.483 20 0 HIADHN O=C(NCc1nc(-c2cc3ccccc3o2)cs1)NC[C@H]1CCCCN1C1CC1 ZINC000434333633 860295588 /nfs/dbraw/zinc/29/55/88/860295588.db2.gz MZSHIVDQZVRPNC-QGZVFWFLSA-N 0 3 410.543 4.372 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)[C@H](C)Oc1ccc(C)cc1 ZINC000434334876 860296590 /nfs/dbraw/zinc/29/65/90/860296590.db2.gz SNTWZJJXLWPLGF-UNMCSNQZSA-N 0 3 418.541 4.353 20 0 HIADHN CCn1c(C)cc(C(=O)Nc2c(C)cnn2[C@H]2CCN(Cc3ccccc3)C2)c1C ZINC000434413042 860339949 /nfs/dbraw/zinc/33/99/49/860339949.db2.gz SWUATRNTXCOURM-NRFANRHFSA-N 0 3 405.546 4.329 20 0 HIADHN Cc1ccn(C2CCN(CCC(=O)Nc3ccccc3C(=O)c3ccccc3)CC2)n1 ZINC000434506769 860379061 /nfs/dbraw/zinc/37/90/61/860379061.db2.gz FAZGOUNHIJCNKR-UHFFFAOYSA-N 0 3 416.525 4.088 20 0 HIADHN CC(C)[C@H](NC(=O)CN1CCC(c2ncc3n2CCCC3)CC1)c1ccc(F)cc1 ZINC000434683407 860458177 /nfs/dbraw/zinc/45/81/77/860458177.db2.gz GJQXTKQPZATQGT-QHCPKHFHSA-N 0 3 412.553 4.051 20 0 HIADHN COC(=O)c1ccc(-c2nc(CN3CCC(c4ncc5n4CCCC5)CC3)co2)cc1 ZINC000434686205 860460786 /nfs/dbraw/zinc/46/07/86/860460786.db2.gz ULPNEFFWCRWRDE-UHFFFAOYSA-N 0 3 420.513 4.041 20 0 HIADHN CC(C)c1ccc([C@H](NC(=O)CN(C)C2CCN(c3cnccn3)CC2)C(C)C)cc1 ZINC000434736897 860476356 /nfs/dbraw/zinc/47/63/56/860476356.db2.gz NKUOGMCHXNDBNF-RUZDIDTESA-N 0 3 423.605 4.014 20 0 HIADHN CCn1nccc1C1CCN(C[C@@H](O)COc2ccc(-c3ccccc3)cc2)CC1 ZINC000434758101 860482885 /nfs/dbraw/zinc/48/28/85/860482885.db2.gz PESJIMAICBXEFG-HSZRJFAPSA-N 0 3 405.542 4.189 20 0 HIADHN CCn1nccc1C1CCN(C[C@H](O)COc2ccc(Oc3ccccc3)cc2)CC1 ZINC000434790025 860494953 /nfs/dbraw/zinc/49/49/53/860494953.db2.gz PXXOBBLLUPRLQM-NRFANRHFSA-N 0 3 421.541 4.315 20 0 HIADHN CC(=O)N(c1nc(CNC[C@H]2CCCCN2C2CC2)cs1)c1ccc(F)cc1 ZINC000434796260 860497726 /nfs/dbraw/zinc/49/77/26/860497726.db2.gz UBJNPQOUGSPHDV-HXUWFJFHSA-N 0 3 402.539 4.073 20 0 HIADHN CSc1nc(-c2ccco2)nc(C)c1C(=O)N[C@H]1C[C@H](C)N(Cc2ccccc2)C1 ZINC000467751274 881559194 /nfs/dbraw/zinc/55/91/94/881559194.db2.gz AQMNYZCQIYZIGZ-YJBOKZPZSA-N 0 3 422.554 4.160 20 0 HIADHN COc1ccc([C@@H](CNC(=O)CCc2ccc(Cl)c(OC)c2)N2CCCC2)cc1 ZINC000435047336 860614108 /nfs/dbraw/zinc/61/41/08/860614108.db2.gz FYOXLAQZONDAMH-OAQYLSRUSA-N 0 3 416.949 4.243 20 0 HIADHN COc1cccc([C@@H](CNC(=O)CCc2ccc(Cl)c(OC)c2)N2CCCC2)c1 ZINC000435053366 860617123 /nfs/dbraw/zinc/61/71/23/860617123.db2.gz PVJZNPHXSYAGGK-OAQYLSRUSA-N 0 3 416.949 4.243 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1ccc(C(C)C)nc1 ZINC000435271253 860710499 /nfs/dbraw/zinc/71/04/99/860710499.db2.gz VMPVIHGBJJSUKL-OAQYLSRUSA-N 0 3 403.530 4.409 20 0 HIADHN Cc1cc(NC(=O)c2ncccc2OC(C)C)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435272123 860711603 /nfs/dbraw/zinc/71/16/03/860711603.db2.gz ZKGGFKHAWFSWFS-HXUWFJFHSA-N 0 3 419.529 4.073 20 0 HIADHN Cc1cc(NC(=O)CCOc2ccccc2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435277555 860714290 /nfs/dbraw/zinc/71/42/90/860714290.db2.gz DBMCFVPGSUYDGB-OAQYLSRUSA-N 0 3 404.514 4.046 20 0 HIADHN Cc1cc(NC(=O)COc2ccc(Cl)cc2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435282390 860717086 /nfs/dbraw/zinc/71/70/86/860717086.db2.gz UQDWTLQPBBFRQR-FQEVSTJZSA-N 0 3 424.932 4.309 20 0 HIADHN COc1ccc(C(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)c(C)c1 ZINC000435283500 860717884 /nfs/dbraw/zinc/71/78/84/860717884.db2.gz YGTUVJLQZVAPRK-HXUWFJFHSA-N 0 3 404.514 4.208 20 0 HIADHN COc1cccc(F)c1C(=O)Nc1cc(C)nn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435290084 860721337 /nfs/dbraw/zinc/72/13/37/860721337.db2.gz JQKOIWLXBBBNPX-GOSISDBHSA-N 0 3 408.477 4.039 20 0 HIADHN Cc1cc(NC(=O)C2=Cc3ccccc3OC2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435291730 860722173 /nfs/dbraw/zinc/72/21/73/860722173.db2.gz VVDBGSFPYHXADQ-JOCHJYFZSA-N 0 3 414.509 4.053 20 0 HIADHN CCO[C@@H](C(=O)Nc1cc(C)nn1[C@H]1CCN(Cc2ccccc2)C1)c1ccccc1 ZINC000435293273 860722983 /nfs/dbraw/zinc/72/29/83/860722983.db2.gz WYNCBZZFNNHZIC-LADGPHEKSA-N 0 3 418.541 4.355 20 0 HIADHN CCCc1nc(C)c(C(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)s1 ZINC000435369843 860766738 /nfs/dbraw/zinc/76/67/38/860766738.db2.gz NAIHKUWLJPHNNS-SFHVURJKSA-N 0 3 409.559 4.300 20 0 HIADHN C[C@H](Cc1ccccc1F)C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435370918 860768254 /nfs/dbraw/zinc/76/82/54/860768254.db2.gz ROXQMZIGRJEVIS-NQIIRXRSSA-N 0 3 406.505 4.287 20 0 HIADHN O=C(Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)c1ccc(OC(F)F)cc1 ZINC000435370583 860768332 /nfs/dbraw/zinc/76/83/32/860768332.db2.gz PMAZHNDYJWBPHK-SFHVURJKSA-N 0 3 412.440 4.184 20 0 HIADHN O=C(CCCOc1ccccc1F)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435371866 860769092 /nfs/dbraw/zinc/76/90/92/860769092.db2.gz XPIXEIWLWMTJOU-FQEVSTJZSA-N 0 3 422.504 4.267 20 0 HIADHN C[C@H](Oc1cccc(Cl)c1)C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435371722 860769395 /nfs/dbraw/zinc/76/93/95/860769395.db2.gz XBKHEQWLNBWPFN-FXAWDEMLSA-N 0 3 424.932 4.390 20 0 HIADHN Cc1c(C(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)oc2c1C(=O)CCC2 ZINC000435371063 860769699 /nfs/dbraw/zinc/76/96/99/860769699.db2.gz SBFPYAHAICBGDY-GOSISDBHSA-N 0 3 418.497 4.003 20 0 HIADHN O=C(CCCOc1ccccc1F)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435371867 860769717 /nfs/dbraw/zinc/76/97/17/860769717.db2.gz XPIXEIWLWMTJOU-HXUWFJFHSA-N 0 3 422.504 4.267 20 0 HIADHN CCC(CC)c1cc(C(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)on1 ZINC000435373043 860770495 /nfs/dbraw/zinc/77/04/95/860770495.db2.gz LMSZYHSGYACDGH-LJQANCHMSA-N 0 3 407.518 4.474 20 0 HIADHN O=C(Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)[C@@H]1SCCc2sccc21 ZINC000435373250 860771598 /nfs/dbraw/zinc/77/15/98/860771598.db2.gz UPELUHQKIGSCLX-LAUBAEHRSA-N 0 3 424.595 4.361 20 0 HIADHN COc1cc(Cl)ccc1C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435376518 860773782 /nfs/dbraw/zinc/77/37/82/860773782.db2.gz QZUIXJFAQCHWFY-GOSISDBHSA-N 0 3 410.905 4.244 20 0 HIADHN O=C(COc1ccccc1Cl)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435375503 860774224 /nfs/dbraw/zinc/77/42/24/860774224.db2.gz MRKJAZJGJYFESE-SFHVURJKSA-N 0 3 410.905 4.001 20 0 HIADHN O=C(Cc1ccc2c(c1)CCC2)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435379644 860775668 /nfs/dbraw/zinc/77/56/68/860775668.db2.gz MZVQTKRZDDQCPI-HSZRJFAPSA-N 0 3 400.526 4.000 20 0 HIADHN CC(C)Oc1ccccc1CC(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435380387 860777071 /nfs/dbraw/zinc/77/70/71/860777071.db2.gz QVDBQBNAPOQWJI-QFIPXVFZSA-N 0 3 418.541 4.299 20 0 HIADHN Cc1nc(CCCC(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)cs1 ZINC000435380310 860777243 /nfs/dbraw/zinc/77/72/43/860777243.db2.gz NJMQIRKAGPLXFT-FQEVSTJZSA-N 0 3 409.559 4.056 20 0 HIADHN O=C(NC[C@H]1CCCCN1Cc1cccc(Cl)c1)N1CCC(c2cnc[nH]2)CC1 ZINC000435501270 860824301 /nfs/dbraw/zinc/82/43/01/860824301.db2.gz OVTXETKLILPARV-HXUWFJFHSA-N 0 3 415.969 4.007 20 0 HIADHN Cc1cc(NC(=O)N(C)Cc2ccc(F)cc2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435513283 860831408 /nfs/dbraw/zinc/83/14/08/860831408.db2.gz CWSWBICNGSVCQP-JOCHJYFZSA-N 0 3 421.520 4.442 20 0 HIADHN Cc1cc(NC(=O)N[C@H]2CCCc3occc32)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435513935 860832850 /nfs/dbraw/zinc/83/28/50/860832850.db2.gz APMVVZNVLORWSK-FPOVZHCZSA-N 0 3 419.529 4.431 20 0 HIADHN Cc1cc(NC(=O)N[C@H]2CCCc3occc32)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435513932 860832945 /nfs/dbraw/zinc/83/29/45/860832945.db2.gz APMVVZNVLORWSK-CTNGQTDRSA-N 0 3 419.529 4.431 20 0 HIADHN Cc1cc(NC(=O)NCc2ccc(F)c(C)c2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435526205 860842501 /nfs/dbraw/zinc/84/25/01/860842501.db2.gz HBYNDNXKIGFHMT-OAQYLSRUSA-N 0 3 421.520 4.408 20 0 HIADHN Cc1cc(NC(=O)N2C[C@@H]3CCCC[C@H]3C2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435533042 860848560 /nfs/dbraw/zinc/84/85/60/860848560.db2.gz HBFPRVLXOKODNW-FDFHNCONSA-N 0 3 407.562 4.292 20 0 HIADHN Cc1c(NC(=O)N(CCN(C)C)Cc2cccc(F)c2)cnn1-c1ccccc1F ZINC000435542448 860856164 /nfs/dbraw/zinc/85/61/64/860856164.db2.gz PLZRPQXZVXKRAR-UHFFFAOYSA-N 0 3 413.472 4.055 20 0 HIADHN Cc1sc(NC(=O)c2cccc(CN(C)C)c2)nc1-c1ccc2c(c1)CCC(=O)N2 ZINC000467770164 881588041 /nfs/dbraw/zinc/58/80/41/881588041.db2.gz KYYFWDWZIMOLLZ-UHFFFAOYSA-N 0 3 420.538 4.317 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N2CC=C(c3ccc(Cl)cc3)CC2)CC1 ZINC000435561261 860883097 /nfs/dbraw/zinc/88/30/97/860883097.db2.gz SBGYIEVKBXYBHC-UHFFFAOYSA-N 0 3 405.970 4.028 20 0 HIADHN Cc1c(NC(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)cnn1-c1ccccc1 ZINC000435562373 860884076 /nfs/dbraw/zinc/88/40/76/860884076.db2.gz FCKGFFBFTAPWCH-JOCHJYFZSA-N 0 3 403.530 4.309 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)N1CC2(CCCC2)c2ccccc21 ZINC000435574813 860892161 /nfs/dbraw/zinc/89/21/61/860892161.db2.gz PAHGAMRTQOBYTC-UHFFFAOYSA-N 0 3 419.569 4.185 20 0 HIADHN O=C(Cc1cccc2cccnc21)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435633691 860927645 /nfs/dbraw/zinc/92/76/45/860927645.db2.gz APZMPAUJEBLZBL-QFIPXVFZSA-N 0 3 411.509 4.060 20 0 HIADHN NC(=O)[C@@H](Cc1ccc(C(F)(F)F)cc1)N[C@@H]1C[C@H]1c1ccc(Cl)c(F)c1 ZINC000435671820 860952364 /nfs/dbraw/zinc/95/23/64/860952364.db2.gz FYDXBRGCLJWZRH-IAOVAPTHSA-N 0 3 400.803 4.040 20 0 HIADHN Cc1cc(NC(=O)[C@H](C)Sc2ccccn2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435689548 860972415 /nfs/dbraw/zinc/97/24/15/860972415.db2.gz AZVHQVXAIKHAQZ-ICSRJNTNSA-N 0 3 421.570 4.153 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N[C@@H]3C[C@H]3c3c(F)cccc3F)c(C)c2)CC1 ZINC000435728888 861012261 /nfs/dbraw/zinc/01/22/61/861012261.db2.gz RHKYVSOHOFQWNI-DYESRHJHSA-N 0 3 414.500 4.093 20 0 HIADHN CN(c1ccccc1)c1ccc(CNCc2ccc(Cn3ccccc3=O)cc2)cn1 ZINC000435782599 861056383 /nfs/dbraw/zinc/05/63/83/861056383.db2.gz PZKMBVLNMIKFKM-UHFFFAOYSA-N 0 3 410.521 4.349 20 0 HIADHN Cc1ccc(NC(=O)[C@H](N[C@H]2CC[C@@H](C(=O)N3CCCCC3)C2)c2ccccc2)cc1 ZINC000435790526 861062334 /nfs/dbraw/zinc/06/23/34/861062334.db2.gz JNDGOUGLULZVAR-YFNKSVMNSA-N 0 3 419.569 4.446 20 0 HIADHN C[C@H](N[C@H](Cc1ccc(C(F)(F)F)cc1)C(N)=O)c1ccc(Br)cc1 ZINC000435885883 861144146 /nfs/dbraw/zinc/14/41/46/861144146.db2.gz PGEDNWNBFRBHRY-MEDUHNTESA-N 0 3 415.253 4.215 20 0 HIADHN COc1ccccc1[C@H](C)NC(=O)[C@@H](C)N[C@@H](C)c1ccc(Br)cc1 ZINC000435886932 861144349 /nfs/dbraw/zinc/14/43/49/861144349.db2.gz DECZLVFSEXKFGA-SOUVJXGZSA-N 0 3 405.336 4.374 20 0 HIADHN Cc1ccc([C@H](NCCc2cccc(OC(F)(F)F)c2)[C@@H](C)S(C)(=O)=O)cc1 ZINC000435906740 861167740 /nfs/dbraw/zinc/16/77/40/861167740.db2.gz HVSZUJZYBXSNLH-DNVCBOLYSA-N 0 3 415.477 4.200 20 0 HIADHN C[C@@H](Oc1cccc2ccccc21)C(=O)Nc1ccc(OC2CCN(C)CC2)nc1 ZINC000435916882 861176655 /nfs/dbraw/zinc/17/66/55/861176655.db2.gz KGXDUTBOWYNCDK-QGZVFWFLSA-N 0 3 405.498 4.114 20 0 HIADHN C[C@H](Oc1cccc2ccccc21)C(=O)Nc1ccc(OC2CCN(C)CC2)nc1 ZINC000435916880 861177514 /nfs/dbraw/zinc/17/75/14/861177514.db2.gz KGXDUTBOWYNCDK-KRWDZBQOSA-N 0 3 405.498 4.114 20 0 HIADHN CC(C)CNC(=O)c1ccc(NC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)cc1 ZINC000437821470 863163387 /nfs/dbraw/zinc/16/33/87/863163387.db2.gz LYSRVXKCYFPTKL-HXUWFJFHSA-N 0 3 422.573 4.201 20 0 HIADHN C[C@H]1CN(C2CC2)C[C@H]1NC(=O)c1ccccc1-c1nc(-c2cccc(Cl)c2)no1 ZINC000467811400 881638798 /nfs/dbraw/zinc/63/87/98/881638798.db2.gz KMYPTDUCJRQWSH-VBKZILBWSA-N 0 3 422.916 4.270 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)c(Cl)c1 ZINC000437956807 863328882 /nfs/dbraw/zinc/32/88/82/863328882.db2.gz TWNHVIWPSOYMBV-INIZCTEOSA-N 0 3 414.937 4.427 20 0 HIADHN CSc1ccc(CCNC(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)cc1 ZINC000437985919 863350100 /nfs/dbraw/zinc/35/01/00/863350100.db2.gz LANRAKSTZLIXDN-UHFFFAOYSA-N 0 3 407.530 4.003 20 0 HIADHN Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)NC[C@H](C)CN1CCN(C)CC1 ZINC000437990798 863353279 /nfs/dbraw/zinc/35/32/79/863353279.db2.gz XKZIMPGXUOFYIV-PZJWPPBQSA-N 0 3 424.589 4.140 20 0 HIADHN C[C@@H]1CCCCN1CCNC(=O)c1cc(COc2c(Cl)cccc2Cl)on1 ZINC000467824382 881655648 /nfs/dbraw/zinc/65/56/48/881655648.db2.gz KSIUWYFJHICYDL-CYBMUJFWSA-N 0 3 412.317 4.165 20 0 HIADHN CCC(CC)c1cc(CNC(=O)Nc2ccc(CCN3CCSCC3)cc2)on1 ZINC000438100000 863508802 /nfs/dbraw/zinc/50/88/02/863508802.db2.gz XXKBVWZUIIWUMZ-UHFFFAOYSA-N 0 3 416.591 4.491 20 0 HIADHN Cc1nc2ccccc2n1C[C@@H]1CCCN1Cc1cnn(Cc2ccc(F)cc2)c1 ZINC000438105609 863520772 /nfs/dbraw/zinc/52/07/72/863520772.db2.gz QDPUSNQRIORJRI-QFIPXVFZSA-N 0 3 403.505 4.393 20 0 HIADHN O=C(Nc1ccc(Oc2cccc(C(F)(F)F)n2)cc1)N1CC[C@H](N2CC=CC2)C1 ZINC000438175810 863598959 /nfs/dbraw/zinc/59/89/59/863598959.db2.gz JSCODUPUORWPCL-INIZCTEOSA-N 0 3 418.419 4.371 20 0 HIADHN O=C(Nc1ccc(Oc2cccc(C(F)(F)F)n2)cc1)N1CC[C@@H](N2CC=CC2)C1 ZINC000438175811 863599351 /nfs/dbraw/zinc/59/93/51/863599351.db2.gz JSCODUPUORWPCL-MRXNPFEDSA-N 0 3 418.419 4.371 20 0 HIADHN CCOC(=O)c1sc(NC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)cc1C ZINC000438175642 863599416 /nfs/dbraw/zinc/59/94/16/863599416.db2.gz HGDDSCXQLLTVBZ-KRWDZBQOSA-N 0 3 415.559 4.362 20 0 HIADHN CN(C)CCN(C(=O)Nc1cccc(C(=O)N2CCc3ccccc32)c1)C1CCCC1 ZINC000467839977 881677720 /nfs/dbraw/zinc/67/77/20/881677720.db2.gz GBYPNLMLCOAVLR-UHFFFAOYSA-N 0 3 420.557 4.228 20 0 HIADHN COc1cccc([C@@H](CNC(=O)N[C@H]2C[C@H](c3cccc(F)c3)C2)N2CCCC2)c1 ZINC000438195747 863622618 /nfs/dbraw/zinc/62/26/18/863622618.db2.gz DQKYBLHKTFWGPL-KJXAQDMKSA-N 0 3 411.521 4.217 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)N[C@H]1C[C@H](c2cc(F)cc(F)c2)C1 ZINC000438203897 863632746 /nfs/dbraw/zinc/63/27/46/863632746.db2.gz UBVQOTMESCJXOF-SNRMKQJTSA-N 0 3 405.514 4.409 20 0 HIADHN CCCn1ccc2ccc(NC(=O)N3CCC(CN4C[C@@H](C)O[C@@H](C)C4)CC3)cc21 ZINC000438282639 863755683 /nfs/dbraw/zinc/75/56/83/863755683.db2.gz NJJYSXNUNOXHPX-KDURUIRLSA-N 0 3 412.578 4.404 20 0 HIADHN C[C@@H]1CN(Cc2csc(-c3ccc(C(F)(F)F)cc3)n2)CCN1CC(C)(C)O ZINC000438340897 863812193 /nfs/dbraw/zinc/81/21/93/863812193.db2.gz MEWOXDOVWAJAER-CQSZACIVSA-N 0 3 413.509 4.106 20 0 HIADHN COc1ccc(Oc2ccc(NC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)cn2)cc1 ZINC000438442030 863868299 /nfs/dbraw/zinc/86/82/99/863868299.db2.gz BTKPRMOFWFAINT-HXUWFJFHSA-N 0 3 418.497 4.279 20 0 HIADHN Cc1cc(NC(=O)N2CCC(CN3C[C@H](C)O[C@@H](C)C3)CC2)ccc1OC(C)C ZINC000438444044 863870516 /nfs/dbraw/zinc/87/05/16/863870516.db2.gz IENUGUYPNWKTJD-OALUTQOASA-N 0 3 403.567 4.135 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)[C@H]1C[C@@H]1c1ccccc1OC(F)(F)F ZINC000438455564 863879934 /nfs/dbraw/zinc/87/99/34/863879934.db2.gz CMEWKZVDUZWSAZ-SJORKVTESA-N 0 3 412.477 4.341 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)CCc1ncc(-c2ccccc2F)o1 ZINC000438462114 863885289 /nfs/dbraw/zinc/88/52/89/863885289.db2.gz HYIDHWMELZOVHX-UHFFFAOYSA-N 0 3 401.507 4.065 20 0 HIADHN C[C@H](CNC(=O)Nc1cccc(CSC2CCCCC2)c1)CN1CCN(C)CC1 ZINC000438506819 863929115 /nfs/dbraw/zinc/92/91/15/863929115.db2.gz HMRLVCNUFRUNFH-LJQANCHMSA-N 0 3 418.651 4.258 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)NC[C@H]3CCC[C@@H](C(F)(F)F)C3)cc2)CC1 ZINC000438531965 863957929 /nfs/dbraw/zinc/95/79/29/863957929.db2.gz JISDREWJRFUDTK-PKOBYXMFSA-N 0 3 411.512 4.316 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)c1ccc(NC(=O)c2ccccc2)cc1 ZINC000438538598 863964217 /nfs/dbraw/zinc/96/42/17/863964217.db2.gz CMWUTYYIPAEYTA-UHFFFAOYSA-N 0 3 407.539 4.204 20 0 HIADHN COc1ccc(C)cc1NC(=O)[C@@H](C)N1CCN(C2CCC(C(C)C)CC2)CC1 ZINC000438562669 863994564 /nfs/dbraw/zinc/99/45/64/863994564.db2.gz QZWUQQZZXGNVAO-QNGMFEMESA-N 0 3 401.595 4.163 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)NC1CCC2(CCOCC2)CC1 ZINC000438602863 864029558 /nfs/dbraw/zinc/02/95/58/864029558.db2.gz YQQGRAGXNCNJRC-UHFFFAOYSA-N 0 3 417.619 4.139 20 0 HIADHN CN(C)CCN(C[C@@H]1CCCO1)C(=O)Nc1ccc(Oc2ccc(Cl)cn2)cc1 ZINC000438632666 864062051 /nfs/dbraw/zinc/06/20/51/864062051.db2.gz LTRKDQWFGGQNDA-IBGZPJMESA-N 0 3 418.925 4.102 20 0 HIADHN CN(C)CCN(C[C@H]1CCCO1)C(=O)Nc1ccc2nc(C(C)(C)C)sc2c1 ZINC000438655683 864097457 /nfs/dbraw/zinc/09/74/57/864097457.db2.gz ZLRNBIJKRXAQDR-MRXNPFEDSA-N 0 3 404.580 4.168 20 0 HIADHN CCN(C(=O)C(=O)Nc1cc(F)cc(Cl)c1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000438655644 864098392 /nfs/dbraw/zinc/09/83/92/864098392.db2.gz NKVZNSHBRQOBDW-MGPUTAFESA-N 0 3 417.912 4.102 20 0 HIADHN Cc1cc(NC(=O)N(Cc2ccccc2)C2CCN(C)CC2)ccc1C(=O)NC(C)C ZINC000438662699 864111008 /nfs/dbraw/zinc/11/10/08/864111008.db2.gz YJJFMYKOJLSLQM-UHFFFAOYSA-N 0 3 422.573 4.262 20 0 HIADHN CCN(C(=O)C(=O)Nc1ccccc1SC)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000438666547 864121388 /nfs/dbraw/zinc/12/13/88/864121388.db2.gz ICSBYYDJJACVQU-HKUYNNGSSA-N 0 3 411.571 4.031 20 0 HIADHN CCN(C(=O)C(=O)Nc1ccc(OC(C)C)cc1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000438668624 864126773 /nfs/dbraw/zinc/12/67/73/864126773.db2.gz YSDPUSKYBOERDW-DENIHFKCSA-N 0 3 423.557 4.096 20 0 HIADHN COc1ccc([C@@H](CNC(=O)Nc2ccc(F)cc2OC(F)F)N2CCCC2)cc1 ZINC000438691313 864158301 /nfs/dbraw/zinc/15/83/01/864158301.db2.gz FPAKHXSLGKDKOI-GOSISDBHSA-N 0 3 423.435 4.394 20 0 HIADHN CSc1cc(C(=O)N(Cc2ccccc2)C2CCN(C)CC2)ccc1NC(C)=O ZINC000438713686 864197000 /nfs/dbraw/zinc/19/70/00/864197000.db2.gz KTALOZVMFOCSTP-UHFFFAOYSA-N 0 3 411.571 4.104 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Nc1ccccc1CC(=O)OC(C)(C)C ZINC000438775862 864271142 /nfs/dbraw/zinc/27/11/42/864271142.db2.gz HPRUZOINFAECDW-UHFFFAOYSA-N 0 3 417.575 4.228 20 0 HIADHN COc1ccc(OC)c([C@@H](C)NCCC(=O)Nc2cc(OC)c(Cl)cc2OC)c1 ZINC000438784218 864278984 /nfs/dbraw/zinc/27/89/84/864278984.db2.gz RUYAGJQVWSUYLM-CYBMUJFWSA-N 0 3 422.909 4.054 20 0 HIADHN COc1cc(CN(C)C[C@H](O)CO[C@@H](c2ccccc2)c2ccc(C)cc2)ccc1O ZINC000438792052 864284477 /nfs/dbraw/zinc/28/44/77/864284477.db2.gz OFXAKWZVQUAJDK-OZXSUGGESA-N 0 3 421.537 4.308 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)Nc1cc(-c2ccccc2)ns1 ZINC000438882526 864367631 /nfs/dbraw/zinc/36/76/31/864367631.db2.gz NFCCOIJCYCXESX-UHFFFAOYSA-N 0 3 422.554 4.089 20 0 HIADHN COc1ccc([C@H](CNC(=O)[C@@H]2C[C@]23CCCc2ccccc23)N2CCCC2)cc1 ZINC000438917699 864396528 /nfs/dbraw/zinc/39/65/28/864396528.db2.gz MNCJIQNISYPEAP-GNKBHMEESA-N 0 3 404.554 4.243 20 0 HIADHN Cc1cc(Br)ccc1NC(=O)CN1CCCC[C@@H]1[C@@H]1CCCC[C@H]1O ZINC000439006049 864460585 /nfs/dbraw/zinc/46/05/85/864460585.db2.gz FVYVBDXXEQNERO-QXAKKESOSA-N 0 3 409.368 4.102 20 0 HIADHN COc1cccc([C@@H](CNC(=O)Cc2cccc(OC(F)(F)F)c2)N2CCCC2)c1 ZINC000439024757 864478864 /nfs/dbraw/zinc/47/88/64/864478864.db2.gz DPAODVUMBRYINB-HXUWFJFHSA-N 0 3 422.447 4.090 20 0 HIADHN CC1CCN([C@H](CNC(=O)N2CCC([C@@H]3CCCO3)CC2)c2cccs2)CC1 ZINC000439112593 864550319 /nfs/dbraw/zinc/55/03/19/864550319.db2.gz BRGKDMQMJWCXHW-UXHICEINSA-N 0 3 405.608 4.122 20 0 HIADHN CCNC(=O)COc1cccc(CN[C@@H](c2ccc(Br)s2)C2CC2)c1 ZINC000439129468 864564455 /nfs/dbraw/zinc/56/44/55/864564455.db2.gz CCPVODSGQLFEMB-LJQANCHMSA-N 0 3 423.376 4.266 20 0 HIADHN CS(=O)(=O)Cc1ccccc1CN[C@H](c1ccc(Br)s1)C1CC1 ZINC000439139332 864572625 /nfs/dbraw/zinc/57/26/25/864572625.db2.gz WWQMHJSTHGJCHX-KRWDZBQOSA-N 0 3 414.390 4.296 20 0 HIADHN Cc1ccsc1[C@@H]1C[C@@H]1C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000439286679 864705846 /nfs/dbraw/zinc/70/58/46/864705846.db2.gz NUTXWGYSGYBVKZ-ZCNNSNEGSA-N 0 3 406.555 4.442 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@H]2CNC(=O)N(CCN(C)C)Cc2cccs2)cc1 ZINC000439330240 864767709 /nfs/dbraw/zinc/76/77/09/864767709.db2.gz YFDBDTKVGOIRPF-UNMCSNQZSA-N 0 3 415.603 4.298 20 0 HIADHN CN(C)[C@H](CNCc1cc(Cl)ccc1OC[C@@H]1CCCO1)c1ccc(F)cc1 ZINC000439478422 864845860 /nfs/dbraw/zinc/84/58/60/864845860.db2.gz MRNMWWFEAVHKSE-LEWJYISDSA-N 0 3 406.929 4.429 20 0 HIADHN C[C@@H](C(=O)Nc1ccc(CCn2cc(Br)cn2)cc1)N1[C@H](C)CC[C@H]1C ZINC000439480944 864846315 /nfs/dbraw/zinc/84/63/15/864846315.db2.gz WXFRHEZOIDQEAD-OAGGEKHMSA-N 0 3 419.367 4.088 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(C(F)(F)F)cc1)C(=O)N(C)C[C@@H]1COc2ccccc2O1 ZINC000439543317 864871466 /nfs/dbraw/zinc/87/14/66/864871466.db2.gz DOUNLMLQZRSSEL-RLFYNMQTSA-N 0 3 422.447 4.043 20 0 HIADHN CC(C)N(CCN(C)C)C(=O)c1csc(-c2cc(Br)cs2)n1 ZINC000439610185 864932375 /nfs/dbraw/zinc/93/23/75/864932375.db2.gz ABTTZSWPEPTJFE-UHFFFAOYSA-N 0 3 402.383 4.046 20 0 HIADHN Cc1cccc(C(NC(=O)N2CCN(CC3CCOCC3)CC2)c2cccc(C)c2)c1 ZINC000439643001 864969187 /nfs/dbraw/zinc/96/91/87/864969187.db2.gz IONFXPVRSFEGOQ-UHFFFAOYSA-N 0 3 421.585 4.147 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)Nc1cnccc1-c1cccc(F)c1 ZINC000439685830 865021067 /nfs/dbraw/zinc/02/10/67/865021067.db2.gz HATKMEVSBSYUOU-UHFFFAOYSA-N 0 3 418.516 4.429 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)Cc2csc(-c3ccccc3)n2)CC1 ZINC000439734349 865065548 /nfs/dbraw/zinc/06/55/48/865065548.db2.gz PSEGOZCCNNOWIV-QGZVFWFLSA-N 0 3 406.555 4.089 20 0 HIADHN Cc1ccc(Cl)c(O[C@@H](C)C(=O)NC2CCN([C@H](C)c3ccncc3)CC2)c1 ZINC000439733093 865066129 /nfs/dbraw/zinc/06/61/29/865066129.db2.gz MVENCHCCWHYOIP-SJORKVTESA-N 0 3 401.938 4.153 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)CCCOc2ccc3c(c2)CCC3)CC1 ZINC000439764020 865088315 /nfs/dbraw/zinc/08/83/15/865088315.db2.gz XANRJCNXORLJDO-LJQANCHMSA-N 0 3 407.558 4.071 20 0 HIADHN CCCCOc1ccc(C(=O)NC2CCN([C@H](C)c3ccncc3)CC2)cc1OC ZINC000439764036 865089425 /nfs/dbraw/zinc/08/94/25/865089425.db2.gz BFIVVENQVYMUTE-GOSISDBHSA-N 0 3 411.546 4.225 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)CCOc2cccc(Cl)c2Cl)CC1 ZINC000439764769 865090229 /nfs/dbraw/zinc/09/02/29/865090229.db2.gz IGROFSRSIOVFAC-OAHLLOKOSA-N 0 3 422.356 4.499 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)Cc2coc(-c3ccc(Cl)cc3)n2)CC1 ZINC000439765536 865090391 /nfs/dbraw/zinc/09/03/91/865090391.db2.gz LNIZBSBWSCVMPO-INIZCTEOSA-N 0 3 424.932 4.274 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)Cc2csc(-c3cccs3)n2)CC1 ZINC000439764384 865090843 /nfs/dbraw/zinc/09/08/43/865090843.db2.gz FAKOZNGDRWOXLF-HNNXBMFYSA-N 0 3 412.584 4.151 20 0 HIADHN COc1ccc2c(c1)CCC[C@@H]2CC(=O)NC1CCN([C@@H](C)c2ccncc2)CC1 ZINC000439767582 865091967 /nfs/dbraw/zinc/09/19/67/865091967.db2.gz KQHUYXDGEMANFE-GHTZIAJQSA-N 0 3 407.558 4.242 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)C(=O)Nc1ccccc1NC(C)(C)C)c1ccccc1 ZINC000439769257 865094402 /nfs/dbraw/zinc/09/44/02/865094402.db2.gz NSMLYHLBRIATMJ-NRFANRHFSA-N 0 3 410.562 4.035 20 0 HIADHN Cc1ncsc1CN(C)C[C@H]1CCN(C(=O)Nc2ccc(F)c(C3CC3)c2)C1 ZINC000439789782 865109790 /nfs/dbraw/zinc/10/97/90/865109790.db2.gz GJDPVYQVDNHLBH-OAHLLOKOSA-N 0 3 402.539 4.454 20 0 HIADHN CCN(C(=O)c1ccc(-c2n[nH]c(C)n2)cc1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000467990298 881836551 /nfs/dbraw/zinc/83/65/51/881836551.db2.gz KJTHMNJUQGNGOI-HTAPYJJXSA-N 0 3 403.530 4.078 20 0 HIADHN Cc1ccc(-c2ccnn2C)cc1NC(=O)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000439954513 865247412 /nfs/dbraw/zinc/24/74/12/865247412.db2.gz UMQDOLOMOCBWNM-QHCPKHFHSA-N 0 3 403.530 4.354 20 0 HIADHN Cc1ccc(-c2ccnn2C)cc1NC(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000439968833 865260372 /nfs/dbraw/zinc/26/03/72/865260372.db2.gz PTUWSXRQUDADQX-GHTZIAJQSA-N 0 3 403.530 4.353 20 0 HIADHN COc1ccc2c(c1)[C@@H](N[C@@H](C)CC(=O)Nc1cccc(Br)c1)CCO2 ZINC000468026640 881860755 /nfs/dbraw/zinc/86/07/55/881860755.db2.gz PBCPGGYYDXIHLU-UGSOOPFHSA-N 0 3 419.319 4.288 20 0 HIADHN CC(C)N(CCN(C)C)C(=O)N[C@H]1c2cc(Br)ccc2SC[C@H]1C ZINC000440223653 865459379 /nfs/dbraw/zinc/45/93/79/865459379.db2.gz CRKUIXXHGIQZAK-CXAGYDPISA-N 0 3 414.413 4.214 20 0 HIADHN CC(C)N(CCN(C)C)C(=O)N[C@@H]1c2cc(Br)ccc2SC[C@@H]1C ZINC000440223655 865460568 /nfs/dbraw/zinc/46/05/68/865460568.db2.gz CRKUIXXHGIQZAK-GUYCJALGSA-N 0 3 414.413 4.214 20 0 HIADHN COc1ccc(-c2nc(C)c([C@@H](C)NC(=O)N(CCN(C)C)C(C)C)s2)cc1 ZINC000440226310 865462836 /nfs/dbraw/zinc/46/28/36/865462836.db2.gz IHAVQFYYKONCGE-MRXNPFEDSA-N 0 3 404.580 4.170 20 0 HIADHN C[C@@H](CSCc1ccccc1)C(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000440278409 865527435 /nfs/dbraw/zinc/52/74/35/865527435.db2.gz DMVMGQKPLGOEBG-PWRODBHTSA-N 0 3 418.647 4.294 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)c2ccccc2NCc2cccnc2)CC1 ZINC000440307610 865569511 /nfs/dbraw/zinc/56/95/11/865569511.db2.gz VQGCZDQUJRDSLI-LJQANCHMSA-N 0 3 415.541 4.044 20 0 HIADHN COc1ccc(SCCCC(=O)Nc2ccc(OC3CCN(C)CC3)nc2)cc1 ZINC000440411244 865706056 /nfs/dbraw/zinc/70/60/56/865706056.db2.gz YOHAUMSNCIBUNO-UHFFFAOYSA-N 0 3 415.559 4.074 20 0 HIADHN CN(CC(=O)N(Cc1ccccc1)C(C)(C)C)C1CCN(C(=O)c2ccccc2)CC1 ZINC000440451650 865755128 /nfs/dbraw/zinc/75/51/28/865755128.db2.gz LZGQGTMBHSPRJP-UHFFFAOYSA-N 0 3 421.585 4.050 20 0 HIADHN O=C(NC[C@]1(O)CCN(Cc2ccccc2)C1)c1cc2sc3ccccc3c2s1 ZINC000440512585 865801556 /nfs/dbraw/zinc/80/15/56/865801556.db2.gz ATQHFDQSONYDNC-HSZRJFAPSA-N 0 3 422.575 4.483 20 0 HIADHN CN(C)Cc1cccc(NC(=O)Nc2ccc(OCc3noc(C4CC4)n3)cc2)c1 ZINC000440585184 865826785 /nfs/dbraw/zinc/82/67/85/865826785.db2.gz RBVOBFQCOAXBIL-UHFFFAOYSA-N 0 3 407.474 4.232 20 0 HIADHN FC(F)(F)c1cc(CNCCCOc2ncc(C(F)(F)F)cc2Cl)[nH]n1 ZINC000440620802 865843061 /nfs/dbraw/zinc/84/30/61/865843061.db2.gz BWUZFHPUUCRSGO-UHFFFAOYSA-N 0 3 402.726 4.054 20 0 HIADHN C[C@@H](CCC(=O)N1CCC[C@@H](CN2CCN(c3ccccn3)CC2)C1)c1ccccc1 ZINC000440776101 865903714 /nfs/dbraw/zinc/90/37/14/865903714.db2.gz BEQCAFGLVIRKHJ-GOTSBHOMSA-N 0 3 420.601 4.026 20 0 HIADHN CC1(C)CN([C@@H](CNCc2cc(C(F)(F)F)n[nH]2)c2ccc(Cl)cc2)CCO1 ZINC000440830606 865945388 /nfs/dbraw/zinc/94/53/88/865945388.db2.gz LIMVZTPVIMIYJW-INIZCTEOSA-N 0 3 416.875 4.024 20 0 HIADHN COc1ccc(NC(=O)C2(NCCO[C@@H]3CCCC[C@@H]3C)CCCC2)cc1OC ZINC000440890041 865983644 /nfs/dbraw/zinc/98/36/44/865983644.db2.gz IOTKURUWEQBCSK-PKOBYXMFSA-N 0 3 404.551 4.140 20 0 HIADHN COc1cc2[nH]c(CCCNC(=O)Nc3cccc(CN(C)C)c3)cc2c(OC)c1 ZINC000440917448 866012786 /nfs/dbraw/zinc/01/27/86/866012786.db2.gz MTMNSUBOASOHMN-UHFFFAOYSA-N 0 3 410.518 4.001 20 0 HIADHN C[C@H]1C[C@H](NC(=O)c2ccc(Oc3ccc(C(F)(F)F)cn3)cc2)CN1C1CC1 ZINC000440919016 866013770 /nfs/dbraw/zinc/01/37/70/866013770.db2.gz PFCFPTOIKMBZBB-BBRMVZONSA-N 0 3 405.420 4.248 20 0 HIADHN O=C(CCN1CCc2ccccc2[C@@H]1CO)Nc1ccccc1Oc1ccccc1 ZINC000440918901 866014150 /nfs/dbraw/zinc/01/41/50/866014150.db2.gz QFRUDHUKQWRBND-QHCPKHFHSA-N 0 3 402.494 4.399 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)c2ccc(Oc3ccc(C(F)(F)F)cn3)cc2)CN1C1CC1 ZINC000440919018 866014533 /nfs/dbraw/zinc/01/45/33/866014533.db2.gz PFCFPTOIKMBZBB-CJNGLKHVSA-N 0 3 405.420 4.248 20 0 HIADHN C[C@H]1C[C@H](NC(=O)c2ccc(CSc3nc4ccccc4[nH]3)cc2)CN1C1CC1 ZINC000440931035 866028219 /nfs/dbraw/zinc/02/82/19/866028219.db2.gz IIVZXVHYYPOUCP-YJBOKZPZSA-N 0 3 406.555 4.210 20 0 HIADHN CSc1ccccc1[C@H](C)NC(=O)N1CCC(CN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000441008452 866079168 /nfs/dbraw/zinc/07/91/68/866079168.db2.gz YRLHDDSDQOWAEH-BZSNNMDCSA-N 0 3 405.608 4.000 20 0 HIADHN CNC(=O)Cc1nc(CN2CCc3ccccc3[C@H](c3ccccc3)[C@@H]2C)cs1 ZINC000441063892 866146848 /nfs/dbraw/zinc/14/68/48/866146848.db2.gz HJGPLGBLAFEVQX-XDHUDOTRSA-N 0 3 405.567 4.010 20 0 HIADHN COc1cc(CNCc2cccc(N3CCC3=O)c2)c(-c2ccccc2)cc1OC ZINC000441205407 866276322 /nfs/dbraw/zinc/27/63/22/866276322.db2.gz UMQPTWJKZNDCMW-UHFFFAOYSA-N 0 3 402.494 4.397 20 0 HIADHN O=C(NCCN1CCc2ccccc2C1)N1CCC[C@@H]1c1nc2ccc(Cl)cc2[nH]1 ZINC000441270788 866344980 /nfs/dbraw/zinc/34/49/80/866344980.db2.gz VCIBSKOUPRIRBB-OAQYLSRUSA-N 0 3 423.948 4.121 20 0 HIADHN O=C(NC1CCN(Cc2ccccc2)CC1)c1cc(F)c(F)cc1Br ZINC000441306910 866378856 /nfs/dbraw/zinc/37/88/56/866378856.db2.gz CYHARGYZHCFLAH-UHFFFAOYSA-N 0 3 409.274 4.122 20 0 HIADHN CCOc1cc(CN[C@@H]2C(=O)NCC[C@@H]2C)ccc1OCc1c(F)cccc1Cl ZINC000441325132 866395687 /nfs/dbraw/zinc/39/56/87/866395687.db2.gz BMFKQFQWYIASBD-QKKBWIMNSA-N 0 3 420.912 4.071 20 0 HIADHN O=C(CN1CC[C@@H](COCc2ccccc2)C1)N1CCC(Cc2ccccc2)CC1 ZINC000441334078 866405439 /nfs/dbraw/zinc/40/54/39/866405439.db2.gz BXDYVBCIIXLKBO-RUZDIDTESA-N 0 3 406.570 4.006 20 0 HIADHN CC(C)(C)N(Cc1cccc(F)c1)C(=O)CN1CC[C@@H](COCc2ccccc2)C1 ZINC000441359996 866429553 /nfs/dbraw/zinc/42/95/53/866429553.db2.gz QKGGWEARZVAPDG-JOCHJYFZSA-N 0 3 412.549 4.492 20 0 HIADHN C[C@H](C(=O)N[C@@H](C)c1ccc(Cl)cc1)N1CC[C@@H](COCc2ccccc2)C1 ZINC000441371326 866438432 /nfs/dbraw/zinc/43/84/32/866438432.db2.gz TUDRNLNBGSUYLN-NLWGTHIKSA-N 0 3 400.950 4.444 20 0 HIADHN COc1ccc(CCN(Cc2ccccc2)C(=O)N[C@H]2C[C@H](C)N(C3CC3)C2)cc1 ZINC000441382214 866454014 /nfs/dbraw/zinc/45/40/14/866454014.db2.gz KABOFSRYQKQLJY-UGKGYDQZSA-N 0 3 407.558 4.075 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)N(C)[C@H](C)c3nc4ccccc4s3)CC2)c1 ZINC000468145958 882004513 /nfs/dbraw/zinc/00/45/13/882004513.db2.gz NDCOAGHCKWXJHG-LJQANCHMSA-N 0 3 422.598 4.336 20 0 HIADHN C[C@@H](NC(=O)C(=O)Nc1cccc(C(F)F)c1Cl)[C@H](c1ccccc1)N(C)C ZINC000441707786 866815436 /nfs/dbraw/zinc/81/54/36/866815436.db2.gz ZPHDCIUYJNPCDW-SJKOYZFVSA-N 0 3 409.864 4.024 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)Nc1ccc(N2CCCC[C@H]2C)cc1C ZINC000441835230 866894336 /nfs/dbraw/zinc/89/43/36/866894336.db2.gz GVPOVHKSEPGUCW-LJQANCHMSA-N 0 3 422.573 4.321 20 0 HIADHN Cc1nn(C(C)(C)C)cc1[C@@H](C)NC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000468159182 882024326 /nfs/dbraw/zinc/02/43/26/882024326.db2.gz KZLSXIVZTARLAN-NQIIRXRSSA-N 0 3 411.594 4.314 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)N[C@@H]3CCCc4sc(-c5ccc(F)cc5)nc43)[C@H]2C1 ZINC000468166644 882042654 /nfs/dbraw/zinc/04/26/54/882042654.db2.gz ZLLLHAVODGXPEK-OLMNPRSZSA-N 0 3 414.550 4.062 20 0 HIADHN Cc1nc(NC(=O)N(CCN(C)C)Cc2ccccn2)sc1Cc1ccc(C)cc1 ZINC000441950307 867015921 /nfs/dbraw/zinc/01/59/21/867015921.db2.gz MFURZPNEBNBGNG-UHFFFAOYSA-N 0 3 423.586 4.341 20 0 HIADHN Cc1nc(-c2ccc(C(=O)N3CCC(CN4C[C@@H](C)O[C@H](C)C4)CC3)cc2)cs1 ZINC000442019427 867070543 /nfs/dbraw/zinc/07/05/43/867070543.db2.gz OVMWRDVENMJKDJ-IAGOWNOFSA-N 0 3 413.587 4.080 20 0 HIADHN CC[C@H](C)[C@H](NC(=O)C(=O)Nc1cccc(CN(C)C)c1)c1ccc(Cl)cc1 ZINC000442144322 867165808 /nfs/dbraw/zinc/16/58/08/867165808.db2.gz HWJOKBREBHZPTB-YWZLYKJASA-N 0 3 401.938 4.244 20 0 HIADHN Cc1cc(NC(=O)c2ccc3c(n2)CCCC3)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000442319146 867324524 /nfs/dbraw/zinc/32/45/24/867324524.db2.gz DFEPFZUFRCXDEI-NRFANRHFSA-N 0 3 415.541 4.165 20 0 HIADHN C[C@@H](NC(=O)C(=O)Nc1ccc([C@H](C)Sc2ccccc2)cc1)C1=CCN(C)CC1 ZINC000442332668 867331228 /nfs/dbraw/zinc/33/12/28/867331228.db2.gz BEHPTNGWDZTVEG-MSOLQXFVSA-N 0 3 423.582 4.245 20 0 HIADHN O=C(c1cnn2c1CCCC2)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000442332264 867331746 /nfs/dbraw/zinc/33/17/46/867331746.db2.gz AVEAYBNZNRVJOE-UHFFFAOYSA-N 0 3 421.372 4.264 20 0 HIADHN COCCC[C@H](NCc1cccc(N2CCC2=O)c1)c1ccc(Br)cc1 ZINC000442798015 867679891 /nfs/dbraw/zinc/67/98/91/867679891.db2.gz IRHMLZWURSDETJ-FQEVSTJZSA-N 0 3 417.347 4.443 20 0 HIADHN CN(CCc1ccccn1)Cc1cccc(Br)c1OC[C@H]1CCCO1 ZINC000442883250 867715149 /nfs/dbraw/zinc/71/51/49/867715149.db2.gz GZAUOXJFLYSUIY-GOSISDBHSA-N 0 3 405.336 4.076 20 0 HIADHN Cc1nn2c(CNCCN3CCc4c(Cl)cccc4C3)c(C(C)C)nc2s1 ZINC000443013105 867792768 /nfs/dbraw/zinc/79/27/68/867792768.db2.gz JZGQSFSXISVWKC-UHFFFAOYSA-N 0 3 403.983 4.024 20 0 HIADHN CCOc1cc(CN2CC[C@@H](OC)C[C@@H]2C)ccc1OCC(=O)N(C(C)C)C(C)C ZINC000443077131 867813295 /nfs/dbraw/zinc/81/32/95/867813295.db2.gz ZIEDAKVYPMIJBT-PZJWPPBQSA-N 0 3 420.594 4.109 20 0 HIADHN C[C@@H](CC(=O)Nc1ccc(F)cc1)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1 ZINC000443091518 867816747 /nfs/dbraw/zinc/81/67/47/867816747.db2.gz DSJRHEIHGIMGGL-FDDCHVKYSA-N 0 3 419.500 4.382 20 0 HIADHN CCC[C@H](NCc1cccc(NC(=O)CCN2CCOCC2)c1)c1ccsc1 ZINC000443093210 867817666 /nfs/dbraw/zinc/81/76/66/867817666.db2.gz MEHPMSOPCVTVDM-NRFANRHFSA-N 0 3 401.576 4.040 20 0 HIADHN C[C@H](CC(=O)Nc1cccc(F)c1)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1 ZINC000443108967 867822890 /nfs/dbraw/zinc/82/28/90/867822890.db2.gz XDXNPSXVIAUKNM-WZONZLPQSA-N 0 3 419.500 4.382 20 0 HIADHN O=C(C/C=C\c1cccc(F)c1)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000443337248 867909962 /nfs/dbraw/zinc/90/99/62/867909962.db2.gz TWSAFZSIXOIBOA-RQOWECAXSA-N 0 3 400.469 4.028 20 0 HIADHN C[C@@H](CC(=O)NC1CCN(CCOc2ccc(F)cc2)CC1)Cc1cccc(F)c1 ZINC000443340077 867911740 /nfs/dbraw/zinc/91/17/40/867911740.db2.gz FRBIGEYGKRNMCL-GOSISDBHSA-N 0 3 416.512 4.193 20 0 HIADHN CC1CCN([C@@H](CNC(=O)c2ccc(O[C@H]3CCOC3)cc2)c2cccs2)CC1 ZINC000468246781 882149655 /nfs/dbraw/zinc/14/96/55/882149655.db2.gz KIGBSVXXDCXWLW-SFTDATJTSA-N 0 3 414.571 4.119 20 0 HIADHN C[C@H]1CN(CCCCNC(=O)CCc2ccc(-c3ccccc3F)o2)C[C@H](C)O1 ZINC000443651023 868244409 /nfs/dbraw/zinc/24/44/09/868244409.db2.gz IRJNIRDBEIGBHN-ROUUACIJSA-N 0 3 402.510 4.024 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)CCOc2ccccc2-c2ccccc2)C[C@H](C)O1 ZINC000443670773 868276464 /nfs/dbraw/zinc/27/64/64/868276464.db2.gz ALPQFHIUOPJXND-OYRHEFFESA-N 0 3 410.558 4.128 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)c2ccc(Oc3ccc(F)cc3F)cc2)C[C@@H](C)O1 ZINC000443677673 868284378 /nfs/dbraw/zinc/28/43/78/868284378.db2.gz TYTPBLAFNUQDNJ-IAGOWNOFSA-N 0 3 418.484 4.376 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)COc2cc(Cl)c(Cl)cc2Cl)C[C@H](C)O1 ZINC000443677511 868285207 /nfs/dbraw/zinc/28/52/07/868285207.db2.gz XXRUCVLBZOSFPO-BETUJISGSA-N 0 3 423.768 4.031 20 0 HIADHN Cc1ccccc1[C@H]([C@@H](C)NC(=O)C(=O)Nc1cc(Cl)ccc1Cl)N(C)C ZINC000443836750 868368392 /nfs/dbraw/zinc/36/83/92/868368392.db2.gz HMZPXANDWUPSLY-ACJLOTCBSA-N 0 3 408.329 4.048 20 0 HIADHN CSc1ccc(NC(=O)C(=O)N[C@@H](C)[C@H](c2ccccc2C)N(C)C)cc1Cl ZINC000443846998 868377731 /nfs/dbraw/zinc/37/77/31/868377731.db2.gz ZAEZVBRSDKNVNC-IFXJQAMLSA-N 0 3 419.978 4.116 20 0 HIADHN Cc1cc(Cl)c(NC(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@H]2CO)cc1Cl ZINC000443942505 868478858 /nfs/dbraw/zinc/47/88/58/868478858.db2.gz QLDCJHDDQYVWCR-QFBILLFUSA-N 0 3 422.356 4.306 20 0 HIADHN FC(F)(F)c1ncc(CN[C@H]2CCN(c3ccc(Br)cc3)C2)s1 ZINC000443977619 868506316 /nfs/dbraw/zinc/50/63/16/868506316.db2.gz IYIJLUGJTORXLR-NSHDSACASA-N 0 3 406.271 4.293 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N(C)CC3(c4ccccc4)CC3)c(C)c2)CC1 ZINC000444048457 868587294 /nfs/dbraw/zinc/58/72/94/868587294.db2.gz BQTOVVMVASDGQZ-UHFFFAOYSA-N 0 3 406.574 4.332 20 0 HIADHN CCN(CC)C(=O)[C@@H]1CCCN1CCC(=O)Nc1ccc(Oc2ccccc2)cc1 ZINC000444120798 868629506 /nfs/dbraw/zinc/62/95/06/868629506.db2.gz XGGNFWXPAWIUHI-QFIPXVFZSA-N 0 3 409.530 4.140 20 0 HIADHN COc1cc(NC(=O)CCN2CCSC[C@H]2c2ccccc2)c(OC)cc1Cl ZINC000444157799 868640776 /nfs/dbraw/zinc/64/07/76/868640776.db2.gz OROZLRKKMKHJRQ-SFHVURJKSA-N 0 3 420.962 4.476 20 0 HIADHN CCCN(CC(=O)Nc1ccc2c(c1)OC1(CCCC1)O2)[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000444227298 868677663 /nfs/dbraw/zinc/67/76/63/868677663.db2.gz UOILLGSKSSIOKF-ZPMCFJSWSA-N 0 3 414.546 4.192 20 0 HIADHN CCCN(CC(=O)Nc1c(C)nn(-c2ccc(C)cc2)c1C)[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC000444232244 868680198 /nfs/dbraw/zinc/68/01/98/868680198.db2.gz OVAIOYOFLZWFJK-ZTCOLXNVSA-N 0 3 424.589 4.262 20 0 HIADHN COC(=O)c1ccc2c(c1)nc(CN(C)[C@H]1CCC[C@@H]1c1ccc(C)cc1)[nH]c2=O ZINC000444236502 868686123 /nfs/dbraw/zinc/68/61/23/868686123.db2.gz IHLHXCSLJBBBEX-NQIIRXRSSA-N 0 3 405.498 4.199 20 0 HIADHN CN(CCC(=O)Nc1ccccc1C(=O)c1ccccc1)[C@H](CCO)c1ccccc1 ZINC000444239273 868689480 /nfs/dbraw/zinc/68/94/80/868689480.db2.gz KFXYNFRLNKBHOR-XMMPIXPASA-N 0 3 416.521 4.302 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1noc2c1CCCCC2 ZINC000444254564 868700402 /nfs/dbraw/zinc/70/04/02/868700402.db2.gz XTYCBQXIOAQINJ-LJQANCHMSA-N 0 3 419.529 4.148 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)[C@H]1C[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000444448132 868831845 /nfs/dbraw/zinc/83/18/45/868831845.db2.gz BJFCWMSLSVGWSV-SFTDATJTSA-N 0 3 418.459 4.404 20 0 HIADHN Cc1cc(OCCCC(=O)Nc2cccc(CN3CCC(O)CC3)c2)ccc1Cl ZINC000444454091 868833628 /nfs/dbraw/zinc/83/36/28/868833628.db2.gz MKQUBIICSBDRFH-UHFFFAOYSA-N 0 3 416.949 4.403 20 0 HIADHN Cc1ccc(C(C)C)cc1O[C@H](C)C(=O)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000444460012 868836673 /nfs/dbraw/zinc/83/66/73/868836673.db2.gz IVXLOXJEYKTLPZ-LJQANCHMSA-N 0 3 410.558 4.481 20 0 HIADHN CC(C)[C@H]1CC[C@@H](C)C[C@H]1OCC(=O)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000444461104 868836916 /nfs/dbraw/zinc/83/69/16/868836916.db2.gz ONECUYXFJGOGCJ-SXSPYAJSSA-N 0 3 402.579 4.059 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1cc(-c2ccc(Cl)cc2)[nH]n1 ZINC000444540142 868873782 /nfs/dbraw/zinc/87/37/82/868873782.db2.gz GMRXCLMYOOGUGQ-UHFFFAOYSA-N 0 3 424.932 4.187 20 0 HIADHN O=C(Cc1ccc(C(F)(F)F)cc1)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000444540272 868873964 /nfs/dbraw/zinc/87/39/64/868873964.db2.gz GKEMFBVVRJBFSF-UHFFFAOYSA-N 0 3 406.448 4.091 20 0 HIADHN Cc1sc(-c2ccco2)nc1C(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000444547802 868877580 /nfs/dbraw/zinc/87/75/80/868877580.db2.gz NPKIDGKTCVSNQE-UHFFFAOYSA-N 0 3 411.527 4.168 20 0 HIADHN CC(C)COc1ccc(CC(=O)Nc2cccc(CN3CCC(CO)CC3)c2)cc1 ZINC000444562827 868883140 /nfs/dbraw/zinc/88/31/40/868883140.db2.gz WYVSXWURZNZAHY-UHFFFAOYSA-N 0 3 410.558 4.107 20 0 HIADHN CC1(C)CCCN(CCNC(=O)c2oc3ccccc3c2CSc2ncccn2)C1 ZINC000444611504 868905874 /nfs/dbraw/zinc/90/58/74/868905874.db2.gz RDJHKOHBMCAVAZ-UHFFFAOYSA-N 0 3 424.570 4.367 20 0 HIADHN C[C@H](N[C@H]1CC(C)(C)OC1(C)C)C(=O)Nc1ccc(NC(=O)c2cccs2)cc1 ZINC000444644632 868929411 /nfs/dbraw/zinc/92/94/11/868929411.db2.gz WMHDXYAYDUVZGI-KSSFIOAISA-N 0 3 415.559 4.263 20 0 HIADHN Cn1ccnc1[C@H]1CCCN(Cc2ccnc(-c3ccc(Br)cc3)n2)C1 ZINC000444806285 869019622 /nfs/dbraw/zinc/01/96/22/869019622.db2.gz XCUVVUICTQHENT-INIZCTEOSA-N 0 3 412.335 4.019 20 0 HIADHN CN(CC1(c2ccccc2)CC1)C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000444832913 869040077 /nfs/dbraw/zinc/04/00/77/869040077.db2.gz FDGIRMZFHZVICS-UHFFFAOYSA-N 0 3 409.599 4.473 20 0 HIADHN Cc1cc2cc[nH]c2cc1NC(=O)NCCCCN1CCN(c2ccccc2)CC1 ZINC000444971755 869134442 /nfs/dbraw/zinc/13/44/42/869134442.db2.gz ZORQBDKQIZGHHU-UHFFFAOYSA-N 0 3 405.546 4.200 20 0 HIADHN C[C@@H](NC(=O)NCCCN1CCc2ccccc2C1)c1cccc(N2CCCC2)c1 ZINC000445487499 869557080 /nfs/dbraw/zinc/55/70/80/869557080.db2.gz FPDHWNYPMYHVPW-HXUWFJFHSA-N 0 3 406.574 4.095 20 0 HIADHN CN(Cc1ccccc1)Cc1cccc(-c2nc(-c3cnc(C4CC4)nc3N)no2)c1 ZINC000445602577 869667415 /nfs/dbraw/zinc/66/74/15/869667415.db2.gz WYHNIDLAZXLDQZ-UHFFFAOYSA-N 0 3 412.497 4.285 20 0 HIADHN NC(=O)[C@@H]1CCCC[C@H]1NCC(=O)Nc1ccccc1Sc1ccc(Cl)cc1 ZINC000445788032 869824948 /nfs/dbraw/zinc/82/49/48/869824948.db2.gz WSUOKXNIRQYMKV-IAGOWNOFSA-N 0 3 417.962 4.063 20 0 HIADHN O=C(c1c(F)cc(Br)cc1F)N1C[C@H]2CCCN2Cc2ccccc21 ZINC000445812083 869835845 /nfs/dbraw/zinc/83/58/45/869835845.db2.gz UENOHWFRYWLHJF-CQSZACIVSA-N 0 3 407.258 4.352 20 0 HIADHN C[C@H](NC(=O)CN1[C@H](C)CC[C@@H]1C)c1cccc(NC(=O)Cc2ccccc2F)c1 ZINC000468414289 882358584 /nfs/dbraw/zinc/35/85/84/882358584.db2.gz HLYRZJKUUMVQKW-KSZLIROESA-N 0 3 411.521 4.057 20 0 HIADHN CC1(C)CCCCN(CC(=O)N(Cc2nnc(-c3ccccc3Cl)o2)C2CC2)C1 ZINC000446070242 870024994 /nfs/dbraw/zinc/02/49/94/870024994.db2.gz YJZXUDKRGDPLGF-UHFFFAOYSA-N 0 3 416.953 4.393 20 0 HIADHN CC(C)Cn1ccc2c1cccc2C(=O)N(C)C[C@@]1(O)CCN(Cc2ccccc2)C1 ZINC000446329185 870244867 /nfs/dbraw/zinc/24/48/67/870244867.db2.gz FIVUKVZBBKORQD-SANMLTNESA-N 0 3 419.569 4.006 20 0 HIADHN Cc1sc(C(=O)NCCCCN2C[C@@H](C)O[C@H](C)C2)cc1-c1ccc(F)cc1 ZINC000446384585 870290815 /nfs/dbraw/zinc/29/08/15/870290815.db2.gz APBZZMFVTSHOAH-HZPDHXFCSA-N 0 3 404.551 4.482 20 0 HIADHN C[C@H]1CN(CCCCNC(=O)CCCc2cc(Cl)sc2Cl)C[C@H](C)O1 ZINC000446386618 870291824 /nfs/dbraw/zinc/29/18/24/870291824.db2.gz PQSPEDOOXZPQEJ-KBPBESRZSA-N 0 3 407.407 4.383 20 0 HIADHN CN1CCCC(C)(C)[C@H]1CNC(=O)c1oc2ccccc2c1CSc1ncccn1 ZINC000468458399 882397431 /nfs/dbraw/zinc/39/74/31/882397431.db2.gz LPGPWUUHZFNNIC-LJQANCHMSA-N 0 3 424.570 4.365 20 0 HIADHN CN(C)CCN(C[C@@H]1CCCO1)C(=O)Nc1cccnc1-c1ccc(Cl)s1 ZINC000446576277 870486479 /nfs/dbraw/zinc/48/64/79/870486479.db2.gz FRHXEIJLHZMVEF-AWEZNQCLSA-N 0 3 408.955 4.038 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)Nc1cccnc1-c1ccc(Cl)s1 ZINC000446586132 870494668 /nfs/dbraw/zinc/49/46/68/870494668.db2.gz MRGRNTVSGQXKRP-UHFFFAOYSA-N 0 3 415.950 4.454 20 0 HIADHN CN1CCCC(C)(C)[C@H]1CNC(=O)c1cc(Br)sc1Br ZINC000468472129 882428594 /nfs/dbraw/zinc/42/85/94/882428594.db2.gz IQWSKVVXQSNQRH-SNVBAGLBSA-N 0 3 424.202 4.123 20 0 HIADHN COc1ccc([C@H](CCn2cncn2)NCc2ccc(F)cc2C(F)(F)F)cc1 ZINC000446741932 870649457 /nfs/dbraw/zinc/64/94/57/870649457.db2.gz CVLUPNHCABKQGX-IBGZPJMESA-N 0 3 408.399 4.366 20 0 HIADHN C[C@H](NCc1ccccc1OCC(=O)NC[C@@H]1CCCO1)c1cc2ccccc2s1 ZINC000446757270 870668048 /nfs/dbraw/zinc/66/80/48/870668048.db2.gz SPBHGEJHFRLSLV-PXNSSMCTSA-N 0 3 424.566 4.426 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3cccc(OCc4ccccn4)c3)cc2)CC1 ZINC000468477410 882437082 /nfs/dbraw/zinc/43/70/82/882437082.db2.gz GRNRIPZAAICPGB-UHFFFAOYSA-N 0 3 416.525 4.055 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1cccc(NC(=O)c2ccccc2)c1 ZINC000446839161 870756181 /nfs/dbraw/zinc/75/61/81/870756181.db2.gz PYIRDMKFPYIHRP-UHFFFAOYSA-N 0 3 406.486 4.128 20 0 HIADHN FC(F)(F)Oc1cccc(C2(NCc3ccc4c(c3)OCCO4)CCOCC2)c1 ZINC000446838330 870756323 /nfs/dbraw/zinc/75/63/23/870756323.db2.gz HEEUWFUHFNHFRA-UHFFFAOYSA-N 0 3 409.404 4.152 20 0 HIADHN COc1cc(CNC2(c3cccc(C(F)(F)F)c3)CCOCC2)cc2c1OCCO2 ZINC000446838394 870756535 /nfs/dbraw/zinc/75/65/35/870756535.db2.gz HYBWCMCCQXJLAV-UHFFFAOYSA-N 0 3 423.431 4.281 20 0 HIADHN Cc1ccc(C(=O)Nc2ccccc2)cc1NC(=O)N(CCN(C)C)Cc1ccco1 ZINC000446846296 870765472 /nfs/dbraw/zinc/76/54/72/870765472.db2.gz XQPGWABJRAMKBG-UHFFFAOYSA-N 0 3 420.513 4.436 20 0 HIADHN CCOC(=O)c1nnc(C2CC[NH+](Cc3ccc(-c4ccccc4F)s3)CC2)[n-]1 ZINC000446855374 870777044 /nfs/dbraw/zinc/77/70/44/870777044.db2.gz IDPADLUHIHLPOS-UHFFFAOYSA-N 0 3 414.506 4.229 20 0 HIADHN Cc1c(NC(=O)N(CCN(C)C)Cc2ccco2)cccc1C(=O)Nc1ccccc1 ZINC000446900530 870819763 /nfs/dbraw/zinc/81/97/63/870819763.db2.gz ZFKYRHVRYFGLNP-UHFFFAOYSA-N 0 3 420.513 4.436 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)Nc1cc(-c2cc(F)cc(F)c2)nn1C ZINC000446982639 870876784 /nfs/dbraw/zinc/87/67/84/870876784.db2.gz GFPYGEITIHDFTK-UHFFFAOYSA-N 0 3 410.424 4.425 20 0 HIADHN Cc1nc(-c2ccc(C)c(NC(=O)N3CCCN(Cc4ccccc4)C[C@H]3C)c2)n[nH]1 ZINC000447051995 870930892 /nfs/dbraw/zinc/93/08/92/870930892.db2.gz ZUHUKLSIFZYFRL-GOSISDBHSA-N 0 3 418.545 4.217 20 0 HIADHN CN1CCCC(C)(C)[C@@H]1CNC(=O)CSc1nnc(-c2ccc3ccccc3c2)o1 ZINC000468492003 882471895 /nfs/dbraw/zinc/47/18/95/882471895.db2.gz LATRBAVWPCPSHQ-IBGZPJMESA-N 0 3 424.570 4.219 20 0 HIADHN O=C(NCC1(c2c(Cl)cccc2Cl)CCC1)[C@H]1CCCN1C1CCOCC1 ZINC000447183614 871076101 /nfs/dbraw/zinc/07/61/01/871076101.db2.gz LTNOZBPPGKYYII-GOSISDBHSA-N 0 3 411.373 4.175 20 0 HIADHN Cc1ccc([C@@H](C)NC(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)cc1F ZINC000447224793 871109830 /nfs/dbraw/zinc/10/98/30/871109830.db2.gz YGCORLOBRDLVPM-CEXWTWQISA-N 0 3 405.558 4.116 20 0 HIADHN C[C@H](NC(=O)N(CCN(C)C)Cc1ccco1)c1ccc(OCC(F)(F)F)cc1 ZINC000447337126 871231649 /nfs/dbraw/zinc/23/16/49/871231649.db2.gz CGPIAHQWICHGBX-HNNXBMFYSA-N 0 3 413.440 4.055 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)N[C@@H]1CCCc2cc(OC(F)F)ccc21 ZINC000447382041 871289086 /nfs/dbraw/zinc/28/90/86/871289086.db2.gz IACWCWXPMKRAFE-LJQANCHMSA-N 0 3 407.461 4.032 20 0 HIADHN C[C@H]1CN(c2cccc3cnccc32)CCN1CCC(=O)Nc1ccccc1Cl ZINC000447384420 871292596 /nfs/dbraw/zinc/29/25/96/871292596.db2.gz MJACSRQBRDAXLL-KRWDZBQOSA-N 0 3 408.933 4.428 20 0 HIADHN C[C@@H](C(=O)Nc1ccc(-c2c[nH]cn2)cc1)N1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC000468501614 882496198 /nfs/dbraw/zinc/49/61/98/882496198.db2.gz QZJJUTBVGADCAB-UXHICEINSA-N 0 3 417.557 4.000 20 0 HIADHN C[C@@H]1CN(c2cccc3cnccc32)CCN1CCCc1nc(-c2ccccc2)no1 ZINC000447392338 871305227 /nfs/dbraw/zinc/30/52/27/871305227.db2.gz BSYJRHAHOXPTRO-LJQANCHMSA-N 0 3 413.525 4.428 20 0 HIADHN C[C@H](C(=O)Nc1ccc(-c2c[nH]cn2)cc1)N1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC000468501616 882497508 /nfs/dbraw/zinc/49/75/08/882497508.db2.gz QZJJUTBVGADCAB-WOJBJXKFSA-N 0 3 417.557 4.000 20 0 HIADHN C[C@@H]1CN(c2cccc3cnccc32)CCN1CCCc1nc(-c2cccs2)no1 ZINC000447400948 871310330 /nfs/dbraw/zinc/31/03/30/871310330.db2.gz TZBMHRKJFANNQX-QGZVFWFLSA-N 0 3 419.554 4.490 20 0 HIADHN C[C@@H](c1ccc(C(F)(F)F)cc1)N(C)C(=O)CCN1CCN(c2ccccc2)CC1 ZINC000468504937 882504460 /nfs/dbraw/zinc/50/44/60/882504460.db2.gz CKDIURRYEISIPU-SFHVURJKSA-N 0 3 419.491 4.437 20 0 HIADHN C[C@@H](N[C@H](C)c1cccc(N2CCCS2(=O)=O)c1)c1ccc(Br)cc1 ZINC000447561183 871450041 /nfs/dbraw/zinc/45/00/41/871450041.db2.gz YAEIDTSPUFGQQC-HUUCEWRRSA-N 0 3 423.376 4.401 20 0 HIADHN CCOc1ccc([C@H](CC)NCc2ccc(C)c(S(C)(=O)=O)c2)cc1OCC ZINC000447576282 871475779 /nfs/dbraw/zinc/47/57/79/871475779.db2.gz ARYGXTHDVKSXQK-IBGZPJMESA-N 0 3 405.560 4.437 20 0 HIADHN Cc1ccc(CN[C@H]2C[C@@H](C)c3c2cccc3Br)cc1S(C)(=O)=O ZINC000447582729 871486917 /nfs/dbraw/zinc/48/69/17/871486917.db2.gz YBMCFTDMMATGKA-DYVFJYSZSA-N 0 3 408.361 4.499 20 0 HIADHN CCCNc1ccc(CN[C@H](C)c2ccc(S(=O)(=O)N(CC)CC)cc2)cc1 ZINC000447599425 871506326 /nfs/dbraw/zinc/50/63/26/871506326.db2.gz XRHIDJOILACTBS-GOSISDBHSA-N 0 3 403.592 4.390 20 0 HIADHN CCCNc1ccc(CN[C@@H](C)c2ccc(S(=O)(=O)N(CC)CC)cc2)cc1 ZINC000447599426 871507069 /nfs/dbraw/zinc/50/70/69/871507069.db2.gz XRHIDJOILACTBS-SFHVURJKSA-N 0 3 403.592 4.390 20 0 HIADHN OC[C@@H](CN[C@H](c1ccc(F)cc1)c1cccnc1)Cc1cc(F)c(F)c(F)c1 ZINC000447607255 871517130 /nfs/dbraw/zinc/51/71/30/871517130.db2.gz QWRQDHRKJQEDRD-IVZQSRNASA-N 0 3 404.407 4.168 20 0 HIADHN CCOc1ccc([C@@H](N[C@H]2CCCN(CC(F)(F)F)C2=O)C(C)C)cc1OCC ZINC000447886676 871800640 /nfs/dbraw/zinc/80/06/40/871800640.db2.gz ULVIGGQKWBVOEI-LPHOPBHVSA-N 0 3 416.484 4.324 20 0 HIADHN O=C1[C@H](N[C@@H](c2ccccc2)[C@@H]2CCCc3ccccc32)CCN1C1CCOCC1 ZINC000447888380 871802084 /nfs/dbraw/zinc/80/20/84/871802084.db2.gz JUIIXVGQXJTSJF-SDHSZQHLSA-N 0 3 404.554 4.217 20 0 HIADHN CO[C@H]1CCOc2c(NC(=O)NC[C@H]3CCCCN3Cc3ccccc3)cccc21 ZINC000448048524 871879743 /nfs/dbraw/zinc/87/97/43/871879743.db2.gz KRZUUFHNCCMQOF-KNQAVFIVSA-N 0 3 409.530 4.333 20 0 HIADHN Fc1cccc(-c2noc([C@H]3CCCN(Cc4ccnn4-c4ccccc4)C3)n2)c1 ZINC000448342776 872288320 /nfs/dbraw/zinc/28/83/20/872288320.db2.gz GXZGIGUKGGQIKC-SFHVURJKSA-N 0 3 403.461 4.441 20 0 HIADHN COCCN(Cc1cnn(Cc2ccc(C(F)(F)F)cc2)c1)[C@H]1CCCSC1 ZINC000448368010 872319374 /nfs/dbraw/zinc/31/93/74/872319374.db2.gz UBQYERNSOZREBZ-IBGZPJMESA-N 0 3 413.509 4.294 20 0 HIADHN CCCCn1ncc(NC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)c1C ZINC000448458670 872413582 /nfs/dbraw/zinc/41/35/82/872413582.db2.gz IBBMBVQEXBJPGY-HXUWFJFHSA-N 0 3 408.468 4.385 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N2CCCC[C@@H]2c2nnc(C3CCC3)o2)C1 ZINC000460114999 872580845 /nfs/dbraw/zinc/58/08/45/872580845.db2.gz LWMYPMQMDQHHFX-JRGCBEDISA-N 0 3 423.561 4.409 20 0 HIADHN CCN(C(=O)Nc1cccc(NC(=O)C(C)C)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000460122874 872597094 /nfs/dbraw/zinc/59/70/94/872597094.db2.gz GMAGMDBHRCOFDL-QFIPXVFZSA-N 0 3 408.546 4.409 20 0 HIADHN CCCN(CCN1CCN(CC)CC1)C(=O)N[C@H](CC(C)(C)C)c1ccccc1 ZINC000460127023 872604898 /nfs/dbraw/zinc/60/48/98/872604898.db2.gz BCZLUQLVXUZEAE-JOCHJYFZSA-N 0 3 402.627 4.223 20 0 HIADHN CCN(C(=O)Nc1cccc(-c2nccn2C)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000460128616 872608741 /nfs/dbraw/zinc/60/87/41/872608741.db2.gz GIWIHOWDKMVZDM-QFIPXVFZSA-N 0 3 403.530 4.215 20 0 HIADHN CCN(C(=O)Nc1cnn(Cc2ccccc2)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000460130388 872610969 /nfs/dbraw/zinc/61/09/69/872610969.db2.gz FELUBSKOGVVKLP-HSZRJFAPSA-N 0 3 403.530 4.060 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)c2nc(C(C)C)n(-c3ccccc3F)n2)c1 ZINC000460148189 872662541 /nfs/dbraw/zinc/66/25/41/872662541.db2.gz COCACIKAKJHSIM-UHFFFAOYSA-N 0 3 423.536 4.042 20 0 HIADHN COc1cccc(F)c1[C@@H](C)NC(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000460479326 873164822 /nfs/dbraw/zinc/16/48/22/873164822.db2.gz KEUFQRGGDDIDHC-QVKFZJNVSA-N 0 3 424.438 4.466 20 0 HIADHN CC(C)C1(CNC(=O)N(Cc2ccccc2Br)C2CCN(C)CC2)CC1 ZINC000460484178 873171052 /nfs/dbraw/zinc/17/10/52/873171052.db2.gz DFRMUIGOLILJBS-UHFFFAOYSA-N 0 3 422.411 4.491 20 0 HIADHN CC(C)Cn1c(Cc2ccccn2)nnc1N1C[C@@H](C)N(Cc2ccccc2)C[C@@H]1C ZINC000460604032 873346035 /nfs/dbraw/zinc/34/60/35/873346035.db2.gz TYTWXLGPFZCPRC-RTWAWAEBSA-N 0 3 418.589 4.019 20 0 HIADHN CCOC(=O)c1csc(CCNCc2cc3ccccc3nc2N2CCCCC2)n1 ZINC000468614818 882726141 /nfs/dbraw/zinc/72/61/41/882726141.db2.gz GDXTVPUIYSYLSP-UHFFFAOYSA-N 0 3 424.570 4.191 20 0 HIADHN CC1CCN(CCNC(=O)c2ccc(Oc3cccc(Cl)c3Cl)nn2)CC1 ZINC000460715158 873509066 /nfs/dbraw/zinc/50/90/66/873509066.db2.gz KZYSNROVRUAEKE-UHFFFAOYSA-N 0 3 409.317 4.037 20 0 HIADHN C[C@H](CN1CCCCC1)NC(=O)c1ccc(Oc2cccc(Cl)c2Cl)nn1 ZINC000460730142 873541248 /nfs/dbraw/zinc/54/12/48/873541248.db2.gz ZPZOYSPUQYFNOO-CYBMUJFWSA-N 0 3 409.317 4.180 20 0 HIADHN CC1CCN([C@H](CNC(=O)[C@@H]2C[C@@H]2c2ccc3c(c2)OCCO3)c2ccccc2)CC1 ZINC000460967216 873863629 /nfs/dbraw/zinc/86/36/29/873863629.db2.gz YQHCWOFLXPETAK-DNVJHFABSA-N 0 3 420.553 4.151 20 0 HIADHN CCN(C(=O)c1cccc(OCCCOC)c1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000460971261 873866675 /nfs/dbraw/zinc/86/66/75/873866675.db2.gz SZHZVNVZVPYGTE-NZQKXSOJSA-N 0 3 410.558 4.400 20 0 HIADHN O=C(N[C@H]1c2ccccc2CC12CCOCC2)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000461035978 873897269 /nfs/dbraw/zinc/89/72/69/873897269.db2.gz DLJKXOXSQTZLSF-QPPBQGQZSA-N 0 3 422.544 4.248 20 0 HIADHN CC(C)c1ccc2c(c1)[C@H](NCc1ccc(N3CCCS3(=O)=O)cc1)CCCO2 ZINC000461085490 873997662 /nfs/dbraw/zinc/99/76/62/873997662.db2.gz OTFORTNZHNINEH-JOCHJYFZSA-N 0 3 414.571 4.353 20 0 HIADHN Fc1ccc(Br)cc1-c1nnc(N2CC[C@@H](N3CCCCC3)C2)s1 ZINC000468706823 882823042 /nfs/dbraw/zinc/82/30/42/882823042.db2.gz QCKLBCVNXOHKBA-CYBMUJFWSA-N 0 3 411.344 4.171 20 0 HIADHN CCc1ccc(C(=O)CCC(=O)N2C[C@@H]3CCN(Cc4ccccc4)C[C@@H]3C2)cc1 ZINC000461424134 874455777 /nfs/dbraw/zinc/45/57/77/874455777.db2.gz HHRJEKCWTFMYOU-BJKOFHAPSA-N 0 3 404.554 4.192 20 0 HIADHN CCCc1c(C(=O)N2C[C@H]3CN(Cc4ccccc4)CC[C@@H]3C2)[nH]c(C)c1C(C)=O ZINC000461443856 874498276 /nfs/dbraw/zinc/49/82/76/874498276.db2.gz CAICHQJOYZBBQB-NHCUHLMSSA-N 0 3 407.558 4.072 20 0 HIADHN C[C@H](CC(=O)N1C[C@@H]2CCN(Cc3ccccc3)C[C@@H]2C1)C(=O)c1cccc(F)c1 ZINC000461446981 874504901 /nfs/dbraw/zinc/50/49/01/874504901.db2.gz FXBCKXVCEUVYEM-BVYCBKJFSA-N 0 3 408.517 4.015 20 0 HIADHN C[C@@H]1CCN(C(=O)CN[C@H](c2ccccc2)C(F)(F)F)CCN1Cc1ccccc1 ZINC000468800531 882865103 /nfs/dbraw/zinc/86/51/03/882865103.db2.gz BYGJXYUGPQERTC-XMSQKQJNSA-N 0 3 419.491 4.003 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1sc(C(F)(F)F)nc1C)c1cccc(OC)c1 ZINC000461795859 874910366 /nfs/dbraw/zinc/91/03/66/874910366.db2.gz KZBVDAGLOPAYKS-HNNXBMFYSA-N 0 3 415.481 4.292 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)c3cc(-c4ccccc4)ns3)cc2)CC1 ZINC000461877057 875030218 /nfs/dbraw/zinc/03/02/18/875030218.db2.gz KZNSSOVSMBTODK-UHFFFAOYSA-N 0 3 406.555 4.200 20 0 HIADHN O=C(CCc1nnc(-c2ccc(Cl)cc2)o1)N[C@H](CN1CCCC1)c1ccccc1 ZINC000462025690 875140909 /nfs/dbraw/zinc/14/09/09/875140909.db2.gz KFJOIIKBUNNDAH-HXUWFJFHSA-N 0 3 424.932 4.276 20 0 HIADHN C[C@@H](C(=O)Nc1ccc(OC2CCN(C)CC2)nc1)c1ccc(C(F)(F)F)cc1 ZINC000462124099 875226293 /nfs/dbraw/zinc/22/62/93/875226293.db2.gz YSYOBXOFMXBGRM-CQSZACIVSA-N 0 3 407.436 4.316 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCc1ncc(-c2ccccc2)cn1)c1ccsc1 ZINC000462130524 875232169 /nfs/dbraw/zinc/23/21/69/875232169.db2.gz OCYDXKZZUFNECC-HXUWFJFHSA-N 0 3 409.559 4.087 20 0 HIADHN CC(=O)c1ccc(-c2ccc(C(=O)N[C@H]3CN(Cc4ccccc4)C[C@@H]3C)o2)cc1 ZINC000462160574 875255430 /nfs/dbraw/zinc/25/54/30/875255430.db2.gz VZUFHHWBXPQDSO-JTSKRJEESA-N 0 3 402.494 4.400 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)CSCc1coc(-c2ccccc2)n1 ZINC000462173469 875270309 /nfs/dbraw/zinc/27/03/09/875270309.db2.gz CSBRVRNMYBPSCF-XMSQKQJNSA-N 0 3 421.566 4.212 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C)c1ncc(-c2ccccc2)o1 ZINC000462226231 875334364 /nfs/dbraw/zinc/33/43/64/875334364.db2.gz QNISYNZDDXLVMH-BBTUJRGHSA-N 0 3 404.514 4.222 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)Nc1cccc(OCc2cccnc2)c1 ZINC000462241603 875357257 /nfs/dbraw/zinc/35/72/57/875357257.db2.gz AIRVYAZBNJIQTL-DVECYGJZSA-N 0 3 416.525 4.303 20 0 HIADHN COc1ccc(Br)c(NC(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)c1 ZINC000462253588 875374790 /nfs/dbraw/zinc/37/47/90/875374790.db2.gz IEHBOGPSKOFJHJ-LIRRHRJNSA-N 0 3 418.335 4.100 20 0 HIADHN COc1ccc(NC(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)c(Br)c1 ZINC000462263143 875388755 /nfs/dbraw/zinc/38/87/55/875388755.db2.gz WGWQUOZBCDEQAC-KUHUBIRLSA-N 0 3 418.335 4.100 20 0 HIADHN Cc1cc(N2CCSCC2)ccc1NC(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C ZINC000462271190 875399286 /nfs/dbraw/zinc/39/92/86/875399286.db2.gz WNGSMYGNEXYASQ-WMZHIEFXSA-N 0 3 424.614 4.190 20 0 HIADHN Cc1ccnc(Oc2ccc(NC(=O)N[C@@H]3CN(Cc4ccccc4)C[C@H]3C)cc2)n1 ZINC000462277143 875404878 /nfs/dbraw/zinc/40/48/78/875404878.db2.gz JWAHEWLZBQFHOB-VGOFRKELSA-N 0 3 417.513 4.219 20 0 HIADHN CC(C)(C)[C@@H](Cc1ccccc1C(F)(F)F)NC(=O)N1CC[C@@H](N2CC=CC2)C1 ZINC000462305814 875426260 /nfs/dbraw/zinc/42/62/60/875426260.db2.gz MZEXWVQPKHPDAZ-IEBWSBKVSA-N 0 3 409.496 4.318 20 0 HIADHN CCN(CC)[C@H](CNC(=O)CCc1cncc2ccccc21)c1cccc(OC)c1 ZINC000462428823 875535647 /nfs/dbraw/zinc/53/56/47/875535647.db2.gz OQSIISRHJGQNOA-XMMPIXPASA-N 0 3 405.542 4.375 20 0 HIADHN COc1ccc([C@H](CNC(=O)NCc2ccc(C(F)F)cc2)N2CCCC2)cc1 ZINC000462526976 875644689 /nfs/dbraw/zinc/64/46/89/875644689.db2.gz OAKLAQBCRSPDBA-FQEVSTJZSA-N 0 3 403.473 4.269 20 0 HIADHN CCOC(=O)[C@@](C)(CN[C@@H](C)C(=O)Nc1cccc(Cl)c1C)c1ccccc1 ZINC000468903185 882957641 /nfs/dbraw/zinc/95/76/41/882957641.db2.gz HRDMVWUBYWYXGT-AOMKIAJQSA-N 0 3 402.922 4.086 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Nc1ccc(OCC2CCOCC2)cc1 ZINC000462685851 875778320 /nfs/dbraw/zinc/77/83/20/875778320.db2.gz VZHBMAUZGMGOSC-NTKDMRAZSA-N 0 3 423.557 4.134 20 0 HIADHN C[C@@H]1C[C@@H](NCc2ccc(-n3ccc(C(F)(F)F)n3)cc2)C(=O)N1c1ccccc1 ZINC000462737756 875810001 /nfs/dbraw/zinc/81/00/01/875810001.db2.gz WNHARKFVSWOHFE-DNVCBOLYSA-N 0 3 414.431 4.175 20 0 HIADHN COC(=O)c1cc(CN[C@H](C)c2sc(-c3ccc(OC)cc3)nc2C)n(C)c1C ZINC000462785541 875838646 /nfs/dbraw/zinc/83/86/46/875838646.db2.gz PBBVVHNJROGESL-CYBMUJFWSA-N 0 3 413.543 4.411 20 0 HIADHN CC(C)(C)OC(=O)c1ccc(CN2CCC(C(=O)NCc3ccccc3)CC2)cc1 ZINC000462793453 875844690 /nfs/dbraw/zinc/84/46/90/875844690.db2.gz ZHQVGASCVNXFFY-UHFFFAOYSA-N 0 3 408.542 4.170 20 0 HIADHN CC(C)(C)OC(=O)c1ccc(CN2CCC(NC(=O)CC3CCCC3)CC2)cc1 ZINC000462797319 875847309 /nfs/dbraw/zinc/84/73/09/875847309.db2.gz DQADONYZABFWOE-UHFFFAOYSA-N 0 3 400.563 4.303 20 0 HIADHN CO[C@@](C)(CN[C@H](c1cccc(S(C)(=O)=O)c1)c1ccc(C)cc1C)C1CC1 ZINC000462802922 875851443 /nfs/dbraw/zinc/85/14/43/875851443.db2.gz IQIQPEDBCQFYPN-PKTZIBPZSA-N 0 3 401.572 4.201 20 0 HIADHN C[C@@H](CS(=O)(=O)c1ccccc1)N[C@H]1C[C@H](c2ccc(Br)cc2)C1 ZINC000462815098 875857284 /nfs/dbraw/zinc/85/72/84/875857284.db2.gz CCNIORCNZXGCMJ-ZVZYQTTQSA-N 0 3 408.361 4.147 20 0 HIADHN C[C@H](NC[C@@H]1C[C@H](O)CN1Cc1ccccc1)c1csc(-c2ccccc2F)n1 ZINC000462822328 875860450 /nfs/dbraw/zinc/86/04/50/875860450.db2.gz OMQOARLTTOJHLU-WDSOQIARSA-N 0 3 411.546 4.235 20 0 HIADHN COC(=O)[C@H]1CC12CCN(c1c(C)c(C)nc3ccc(Br)cc31)CC2 ZINC000462839625 875873616 /nfs/dbraw/zinc/87/36/16/875873616.db2.gz NZHJIMJMXMOIFS-MRXNPFEDSA-N 0 3 403.320 4.394 20 0 HIADHN Cn1c(CNC[C@H]2CCN(c3ccccc3F)C2)nc2cc(C(F)(F)F)ccc21 ZINC000462910473 875935459 /nfs/dbraw/zinc/93/54/59/875935459.db2.gz JZGLFASWBBXQKJ-CQSZACIVSA-N 0 3 406.427 4.347 20 0 HIADHN COc1ccc([C@@H](Nc2ccnc3ccccc32)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000462943255 875964842 /nfs/dbraw/zinc/96/48/42/875964842.db2.gz HHTPOQDMFSUSQR-XMMPIXPASA-N 0 3 418.518 4.270 20 0 HIADHN COC(=O)CCCN1CCC(Nc2cccc(COc3cccc(F)c3)c2)CC1 ZINC000462958167 875973086 /nfs/dbraw/zinc/97/30/86/875973086.db2.gz UABHYDNFAPFCDY-UHFFFAOYSA-N 0 3 400.494 4.234 20 0 HIADHN CCCC1(C(=O)NC2CCN(CCOc3ccc(Br)cc3)CC2)CCC1 ZINC000468923595 882984348 /nfs/dbraw/zinc/98/43/48/882984348.db2.gz KWFYPEQLFBOUFJ-UHFFFAOYSA-N 0 3 423.395 4.379 20 0 HIADHN CN(C)Cc1cccc(NC(=O)[C@H](c2ccc(Cl)cc2Cl)N2CCOCC2)c1 ZINC000463089291 876121596 /nfs/dbraw/zinc/12/15/96/876121596.db2.gz DMQZBMIARAVZJY-FQEVSTJZSA-N 0 3 422.356 4.067 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)c2cc(NC(=O)C(C)(C)C)ccc2F)C1 ZINC000463155847 876209337 /nfs/dbraw/zinc/20/93/37/876209337.db2.gz KJDJJCRUWYMVSX-VQIMIIECSA-N 0 3 411.521 4.376 20 0 HIADHN O=C(c1ccccc1Cl)N1CCC(NCc2nccn2CCc2ccccc2)CC1 ZINC000463191719 876250918 /nfs/dbraw/zinc/25/09/18/876250918.db2.gz NSHLKQGJXKBDRQ-UHFFFAOYSA-N 0 3 422.960 4.174 20 0 HIADHN C[C@@H]1CC[C@H](O)[C@@H]([C@H]2CCCCN2Cc2csc(-c3ccc(C(N)=O)cc3)n2)C1 ZINC000463196059 876256701 /nfs/dbraw/zinc/25/67/01/876256701.db2.gz ARUIQJMLZSAONC-DOVSJBTNSA-N 0 3 413.587 4.061 20 0 HIADHN C[C@@H]1CC[C@H](O)[C@H]([C@@H]2CCCCN2Cc2nc(-c3cc(F)c(F)c(F)c3)no2)C1 ZINC000463198834 876259133 /nfs/dbraw/zinc/25/91/33/876259133.db2.gz FPATXOSJFVKJNP-GLFJAGTFSA-N 0 3 409.452 4.306 20 0 HIADHN Cc1ccc(-c2nc(CCNC(=O)N[C@@H]3CN(Cc4ccccc4)C[C@H]3C)co2)cc1 ZINC000463204729 876266200 /nfs/dbraw/zinc/26/62/00/876266200.db2.gz OEYCZXXOOONGEC-AUSIDOKSSA-N 0 3 418.541 4.012 20 0 HIADHN CCOc1ccc(NC(=O)CN2CCCC[C@@H]2[C@@H]2C[C@H](C)CC[C@H]2O)cc1OCC ZINC000463205885 876266469 /nfs/dbraw/zinc/26/64/69/876266469.db2.gz VSZCCMAHOGGDBS-GFOJFJKKSA-N 0 3 418.578 4.074 20 0 HIADHN CCOc1ccccc1[C@H](CC)NC(=O)CN1CCCC[C@@H]1[C@@H]1CCCC[C@H]1O ZINC000463213769 876273332 /nfs/dbraw/zinc/27/33/32/876273332.db2.gz NXVSXWYCHWEZIN-FNAHDJPLSA-N 0 3 402.579 4.058 20 0 HIADHN C[C@@H](Cn1cc(Br)cn1)NCc1ccc(Oc2cccc(F)c2)nc1 ZINC000468947044 883013213 /nfs/dbraw/zinc/01/32/13/883013213.db2.gz LJCNHNZBOIZONS-ZDUSSCGKSA-N 0 3 405.271 4.150 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)N[C@H]1CCO[C@@H](c2ccccc2)C1 ZINC000463255927 876312393 /nfs/dbraw/zinc/31/23/93/876312393.db2.gz CSYKHBWEBOOJPV-BJKOFHAPSA-N 0 3 409.574 4.113 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)NCc1ccc(-c2cccnc2)cc1 ZINC000463266225 876324778 /nfs/dbraw/zinc/32/47/78/876324778.db2.gz LPGAZNBGSBBZKT-CYFREDJKSA-N 0 3 400.526 4.068 20 0 HIADHN C[C@@H](CC(=O)OC(C)(C)C)NCc1cc(Br)cc(Br)c1N ZINC000463296255 876357062 /nfs/dbraw/zinc/35/70/62/876357062.db2.gz CUVNIYOMKXMLBQ-VIFPVBQESA-N 0 3 422.161 4.004 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)cc1C(=O)N[C@H](CN1CCCC1)c1ccccc1 ZINC000463296459 876357177 /nfs/dbraw/zinc/35/71/77/876357177.db2.gz UWXYPKOUBDOZFM-JOCHJYFZSA-N 0 3 408.933 4.401 20 0 HIADHN CO[C@@H](CN[C@H](C)c1ccc(Br)cc1OCCCO)c1ccccc1 ZINC000463359511 876413293 /nfs/dbraw/zinc/41/32/93/876413293.db2.gz QQVBDGZQOBSAHD-QRWLVFNGSA-N 0 3 408.336 4.249 20 0 HIADHN Cc1ccc(C(=O)CCN[C@@H](C)c2ccc(Br)cc2OCCCO)cc1 ZINC000463374553 876429730 /nfs/dbraw/zinc/42/97/30/876429730.db2.gz ICQOFXDQUXJTGC-INIZCTEOSA-N 0 3 420.347 4.442 20 0 HIADHN OC[C@@]1(Cc2ccccc2)CCCN(C[C@@H](O)COc2ccc(Cl)cc2Cl)C1 ZINC000463434069 876489511 /nfs/dbraw/zinc/48/95/11/876489511.db2.gz CJSWSACVRFQFNV-DENIHFKCSA-N 0 3 424.368 4.050 20 0 HIADHN COc1cc(-c2nnc(CN[C@H]3CCCCC34CCCC4)o2)cc(OC)c1OC ZINC000463441383 876498872 /nfs/dbraw/zinc/49/88/72/876498872.db2.gz QWLAEMRZTQNNGA-SFHVURJKSA-N 0 3 401.507 4.355 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2c[nH]nc2-c2cccc(OC(F)F)c2)N(C)C)cc1 ZINC000463510169 876572940 /nfs/dbraw/zinc/57/29/40/876572940.db2.gz ASTQWKXRVTTYIK-IBGZPJMESA-N 0 3 414.456 4.019 20 0 HIADHN Cc1nc(-c2cccc(C(=O)N3CCC(CN4C[C@@H](C)O[C@H](C)C4)CC3)c2)cs1 ZINC000463560118 876646607 /nfs/dbraw/zinc/64/66/07/876646607.db2.gz PNJQCGWTHODATO-IAGOWNOFSA-N 0 3 413.587 4.080 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)c1ccc(F)c(Br)c1 ZINC000463576348 876671325 /nfs/dbraw/zinc/67/13/25/876671325.db2.gz HHEGWAXBYIGHDU-UHFFFAOYSA-N 0 3 423.351 4.432 20 0 HIADHN NC(=O)[C@H]1CCCN(Cc2ccccc2NC(=O)C2CCC(c3ccccc3)CC2)C1 ZINC000463643871 876762665 /nfs/dbraw/zinc/76/26/65/876762665.db2.gz NEALIJLBHQZPOF-BBHUYCHWSA-N 0 3 419.569 4.296 20 0 HIADHN COc1ccc(Cn2nc(C)c(CNCc3cccc(Cn4ccnc4)c3)c2C)cc1 ZINC000463740864 876861956 /nfs/dbraw/zinc/86/19/56/876861956.db2.gz WNDYWAHDZKRXFI-UHFFFAOYSA-N 0 3 415.541 4.091 20 0 HIADHN CN(C)[C@@H]1Cc2ccccc2N(C(=O)c2cc3cc(C(F)(F)F)ccc3n2C)C1 ZINC000463745305 876867934 /nfs/dbraw/zinc/86/79/34/876867934.db2.gz KSDUFPVVNMZHAN-QGZVFWFLSA-N 0 3 401.432 4.330 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)[C@@H]1C[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000463769029 876890680 /nfs/dbraw/zinc/89/06/80/876890680.db2.gz MSGDGBSSLQJSRB-ATZDWAIDSA-N 0 3 402.460 4.330 20 0 HIADHN C[C@@H]1CCN(C(=O)[C@@H]2C[C@@H]2c2cc(F)c(F)c(F)c2)CCN1Cc1ccccc1 ZINC000463769771 876891723 /nfs/dbraw/zinc/89/17/23/876891723.db2.gz PLMHAORDFMGNJH-ATZDWAIDSA-N 0 3 402.460 4.330 20 0 HIADHN Cn1cc(N2CCC[C@H](N[C@@H](Cc3ccc(Cl)cc3)c3ccccc3)C2=O)cn1 ZINC000463885304 877005789 /nfs/dbraw/zinc/00/57/89/877005789.db2.gz AIPULCAOEVULOL-VXKWHMMOSA-N 0 3 408.933 4.143 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)NCCc1c[nH]c2ccc(Cl)cc12 ZINC000463900878 877021973 /nfs/dbraw/zinc/02/19/73/877021973.db2.gz AXRQDKHIMYQJEX-UHFFFAOYSA-N 0 3 424.976 4.082 20 0 HIADHN COc1ccc([C@H](CNC(=O)N[C@@H](c2nc(C)cs2)C2CC2)N2CCCC2)cc1 ZINC000463956015 877077924 /nfs/dbraw/zinc/07/79/24/877077924.db2.gz SSWKZWSJKCNEBN-VQTJNVASSA-N 0 3 414.575 4.048 20 0 HIADHN COc1ccc([C@H](CNC(=O)NC[C@H](C)c2ccc(F)cc2F)N2CCCC2)cc1 ZINC000463959205 877083224 /nfs/dbraw/zinc/08/32/24/877083224.db2.gz SPOAROXVVDESEO-AOMKIAJQSA-N 0 3 417.500 4.213 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)N3CC[C@@H](CSc4ccccc4)C3)CC2)c1 ZINC000469026926 883094677 /nfs/dbraw/zinc/09/46/77/883094677.db2.gz SUUDKJMMAKUVGQ-JOCHJYFZSA-N 0 3 423.626 4.148 20 0 HIADHN CCO[C@H](C)c1nc(CN(C)C(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)cs1 ZINC000463977083 877104951 /nfs/dbraw/zinc/10/49/51/877104951.db2.gz WSVNZLPJPYTXDX-AEFFLSMTSA-N 0 3 419.566 4.250 20 0 HIADHN Cc1c(C(=O)N(C)[C@@H]2CCCN(C)C2)c2cc(Br)ccc2nc1C1CC1 ZINC000464056362 877201846 /nfs/dbraw/zinc/20/18/46/877201846.db2.gz YATHSDOQTXOWME-MRXNPFEDSA-N 0 3 416.363 4.349 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N[C@@H](C)c1cn(C(C)(C)C)nc1C)c1ccsc1 ZINC000464136540 877298888 /nfs/dbraw/zinc/29/88/88/877298888.db2.gz BNMLDSLDFONCRL-KXBFYZLASA-N 0 3 405.612 4.451 20 0 HIADHN Cc1nn(C(C)(C)C)cc1[C@H](C)NC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C ZINC000464144476 877311016 /nfs/dbraw/zinc/31/10/16/877311016.db2.gz DSYVESLAZVDYTA-MOPGFXCFSA-N 0 3 411.594 4.314 20 0 HIADHN Cc1nn(C(C)(C)C)cc1[C@@H](C)NC(=O)NC[C@H]1CCCCN1Cc1ccccc1 ZINC000464146181 877313839 /nfs/dbraw/zinc/31/38/39/877313839.db2.gz NLQAYXSBPWESSH-WIYYLYMNSA-N 0 3 411.594 4.361 20 0 HIADHN CC[C@H](C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(OC)cc1 ZINC000464208029 877378584 /nfs/dbraw/zinc/37/85/84/877378584.db2.gz UEQGCFNHMSUTOI-GGAORHGYSA-N 0 3 418.541 4.471 20 0 HIADHN C[C@H]1C[C@@H](c2ccccc2F)N(C(=O)CCCN2CCN(c3ccccc3)CC2)C1 ZINC000464229731 877405747 /nfs/dbraw/zinc/40/57/47/877405747.db2.gz FHCCXHMFOIGSIX-RDPSFJRHSA-N 0 3 409.549 4.338 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N(C)CCc1cccc(Br)c1)c1ccco1 ZINC000464392259 877593300 /nfs/dbraw/zinc/59/33/00/877593300.db2.gz HIIYYZSZLOISOV-YJBOKZPZSA-N 0 3 422.367 4.355 20 0 HIADHN Cc1cccc(S(=O)(=O)CCCN[C@@H](C)c2ccc(OCC3CC3)c(F)c2)c1 ZINC000464481741 877700851 /nfs/dbraw/zinc/70/08/51/877700851.db2.gz RAGAPOFLSLSKEA-KRWDZBQOSA-N 0 3 405.535 4.438 20 0 HIADHN COc1ccccc1S(=O)(=O)CCCN[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000464487555 877707300 /nfs/dbraw/zinc/70/73/00/877707300.db2.gz OVKQUZPHHHIYNI-AWEZNQCLSA-N 0 3 401.450 4.229 20 0 HIADHN Cc1ccc(-c2noc(CCCN3CCC[C@@H](CC(=O)OC(C)C)C3)n2)cc1F ZINC000464494005 877712396 /nfs/dbraw/zinc/71/23/96/877712396.db2.gz IIXYCUYHKAUNGO-KRWDZBQOSA-N 0 3 403.498 4.170 20 0 HIADHN CCN(C(=O)N[C@@H]1CCOc2c(F)ccc(F)c21)[C@H]1CCN(Cc2ccccc2)C1 ZINC000464507764 877730400 /nfs/dbraw/zinc/73/04/00/877730400.db2.gz CQABBKHZCMOGHP-FXAWDEMLSA-N 0 3 415.484 4.094 20 0 HIADHN CN(C)C[C@H](NC(=O)N[C@@H]1CCOc2c(F)ccc(F)c21)c1ccc(Cl)cc1 ZINC000464508228 877731714 /nfs/dbraw/zinc/73/17/14/877731714.db2.gz DWXOFTBOBRKHRC-SJORKVTESA-N 0 3 409.864 4.044 20 0 HIADHN CC(C)CN(C(=O)C1(Cc2ccc(OC(F)(F)F)cc2)CC1)C1CCN(C)CC1 ZINC000464570080 877790871 /nfs/dbraw/zinc/79/08/71/877790871.db2.gz ADHLXZXWHLDNOI-UHFFFAOYSA-N 0 3 412.496 4.487 20 0 HIADHN COC(=O)c1cc(F)ccc1CN(CCCOc1ccccc1)C1CCOCC1 ZINC000464577144 877801126 /nfs/dbraw/zinc/80/11/26/877801126.db2.gz OIPIODLXLDUBDO-UHFFFAOYSA-N 0 3 401.478 4.062 20 0 HIADHN CCCN(CCc1cccs1)CC(=O)N1CCC[C@@H]1c1ccc(OC)cc1OC ZINC000464588647 877813308 /nfs/dbraw/zinc/81/33/08/877813308.db2.gz WPLFDKBGLLAXFX-OAQYLSRUSA-N 0 3 416.587 4.384 20 0 HIADHN C[C@H](c1ccccc1)N(C)C(=O)CN(CCCOc1ccccc1)C1CCOCC1 ZINC000464594615 877821666 /nfs/dbraw/zinc/82/16/66/877821666.db2.gz QXQFFHNZEMDLKY-OAQYLSRUSA-N 0 3 410.558 4.156 20 0 HIADHN CCN(Cc1ccccc1)c1ccc(C(=O)N(CCCOC)C2CCN(C)CC2)cc1 ZINC000464714182 877941020 /nfs/dbraw/zinc/94/10/20/877941020.db2.gz BHGRANSIAVRGPT-UHFFFAOYSA-N 0 3 423.601 4.286 20 0 HIADHN COCCCN(C(=O)c1cc(C2CC2)nc2c(C)cc(C)cc12)C1CCN(C)CC1 ZINC000464719176 877945382 /nfs/dbraw/zinc/94/53/82/877945382.db2.gz INSFABGHMWDZIB-UHFFFAOYSA-N 0 3 409.574 4.302 20 0 HIADHN COCCCN(C(=O)c1ccc(-c2ccc(OC)cc2)cc1F)C1CCN(C)CC1 ZINC000464724614 877955125 /nfs/dbraw/zinc/95/51/25/877955125.db2.gz SWMDYYIDYKVADW-UHFFFAOYSA-N 0 3 414.521 4.074 20 0 HIADHN Cc1nsc(N2CCCN(CC/C=C/c3ccc(Br)cc3)CC2)n1 ZINC000464760899 878003059 /nfs/dbraw/zinc/00/30/59/878003059.db2.gz BOWUKACYSHLTDS-GORDUTHDSA-N 0 3 407.381 4.225 20 0 HIADHN CCS[C@@H]1CC[C@H](N(C)CC(=O)N[C@@H](c2ccc3c(c2)OCCCO3)C(C)C)C1 ZINC000464766542 878010634 /nfs/dbraw/zinc/01/06/34/878010634.db2.gz ALKSAJHDZNHPTI-YCRNBWNJSA-N 0 3 420.619 4.267 20 0 HIADHN CCN(Cc1nc2c3ccccc3oc2c(=O)[nH]1)CC1CCN(c2ccccn2)CC1 ZINC000464805873 878051939 /nfs/dbraw/zinc/05/19/39/878051939.db2.gz NUYCPXZANREUJV-UHFFFAOYSA-N 0 3 417.513 4.215 20 0 HIADHN C[C@H]1CCCN1CC(=O)N[C@@H](c1ccccc1)c1ccc2[nH]c(C(F)(F)F)nc2c1 ZINC000464840380 878108232 /nfs/dbraw/zinc/10/82/32/878108232.db2.gz UODXDGWEBKBQSB-XOBRGWDASA-N 0 3 416.447 4.272 20 0 HIADHN C[C@H]1CCCN1CC(=O)N[C@@H](c1ccccc1)c1ccc2nc(C(F)(F)F)[nH]c2c1 ZINC000464840380 878108249 /nfs/dbraw/zinc/10/82/49/878108249.db2.gz UODXDGWEBKBQSB-XOBRGWDASA-N 0 3 416.447 4.272 20 0 HIADHN COc1ccccc1NC(=O)c1ccc(NC(=O)[C@H](C)N2C[C@@H]3CCC[C@@H]3C2)cc1 ZINC000464885996 878183457 /nfs/dbraw/zinc/18/34/57/878183457.db2.gz ADDYXMFRIZZWGJ-YTQUADARSA-N 0 3 407.514 4.006 20 0 HIADHN CSCc1nc2ccccc2n1CC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC000464894119 878199578 /nfs/dbraw/zinc/19/95/78/878199578.db2.gz NPPFMHBYGKHRDP-LJQANCHMSA-N 0 3 422.598 4.022 20 0 HIADHN CC[C@@H](C)n1ncc2c1nc(C)cc2C(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC000464897018 878203850 /nfs/dbraw/zinc/20/38/50/878203850.db2.gz VJBPRZXTTJKLTH-WOJBJXKFSA-N 0 3 419.573 4.447 20 0 HIADHN Cc1cc(C(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)c(C)n1Cc1ccccn1 ZINC000464904362 878218784 /nfs/dbraw/zinc/21/87/84/878218784.db2.gz ZAIZUPGLZXXAHQ-FQEVSTJZSA-N 0 3 416.569 4.285 20 0 HIADHN COc1cccc(C(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)c1OC(F)F ZINC000464909867 878226944 /nfs/dbraw/zinc/22/69/44/878226944.db2.gz NCAMOIMGXPQKEL-MRXNPFEDSA-N 0 3 404.457 4.033 20 0 HIADHN Cc1nc(-c2cccc(NC(=O)NC[C@H](c3cccs3)N3CCC(C)CC3)c2)n[nH]1 ZINC000503359148 912334057 /nfs/dbraw/zinc/33/40/57/912334057.db2.gz JSUORPLPQIUTSU-LJQANCHMSA-N 0 3 424.574 4.436 20 0 HIADHN Cc1nn(-c2ccc(Br)cc2)c(C)c1CNCCCC(=O)OC(C)(C)C ZINC000465061444 878423254 /nfs/dbraw/zinc/42/32/54/878423254.db2.gz XXNYJNNMZUTBKT-UHFFFAOYSA-N 0 3 422.367 4.463 20 0 HIADHN Cc1ccc(OC(F)F)c(CNC(=O)N(CCN(C)C)Cc2ccccc2F)c1 ZINC000465229205 878645534 /nfs/dbraw/zinc/64/55/34/878645534.db2.gz UMICKUPJTMQKEI-UHFFFAOYSA-N 0 3 409.452 4.009 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)NCc2ccc(-c3ccco3)cc2F)cc1 ZINC000503390463 912372860 /nfs/dbraw/zinc/37/28/60/912372860.db2.gz LUEVWYSVFJEEOR-OAQYLSRUSA-N 0 3 411.477 4.196 20 0 HIADHN C[C@H](NC(=O)NC[C@@H](c1cccs1)N1CCCC1)c1nc(C2CCCCC2)no1 ZINC000465419009 878848974 /nfs/dbraw/zinc/84/89/74/878848974.db2.gz AAHNGNKMVAIXGW-RDJZCZTQSA-N 0 3 417.579 4.376 20 0 HIADHN CCO[C@@H](C)c1nc(CN(C)C(=O)NC[C@H](c2cccs2)N2CCCC2)cs1 ZINC000465430052 878861287 /nfs/dbraw/zinc/86/12/87/878861287.db2.gz XZORXXWWHYGZFA-DOTOQJQBSA-N 0 3 422.620 4.281 20 0 HIADHN Cc1ccccc1[C@@H]1CN(C(=O)NC[C@H](c2cccs2)N2CCCC2)[C@H](C)CO1 ZINC000465433452 878864569 /nfs/dbraw/zinc/86/45/69/878864569.db2.gz MYFASATZEHTUMR-NRSPTQNISA-N 0 3 413.587 4.365 20 0 HIADHN COc1ccc([C@@H](C)CCNC(=O)NC[C@@H](c2cccs2)N2CCCC2)cc1 ZINC000465433612 878865080 /nfs/dbraw/zinc/86/50/80/878865080.db2.gz NXKLAMUZKNOQLY-PXNSSMCTSA-N 0 3 401.576 4.387 20 0 HIADHN C[C@@H](NC(=O)NC[C@@H](c1ccccc1)N1CCCC1)c1cccc(-n2cccn2)c1 ZINC000465447658 878879307 /nfs/dbraw/zinc/87/93/07/878879307.db2.gz ZECCVAABYXIHBL-XXBNENTESA-N 0 3 403.530 4.070 20 0 HIADHN Cc1ccc(CCN(C[C@H]2CCCO2)C(=O)NC[C@@H](c2ccccc2)N(C)C)cc1 ZINC000465454149 878885118 /nfs/dbraw/zinc/88/51/18/878885118.db2.gz LYTCAXXKKXUOTK-RPWUZVMVSA-N 0 3 409.574 4.031 20 0 HIADHN Cc1nc2ccccc2n1CCCNC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC000465464435 878897928 /nfs/dbraw/zinc/89/79/28/878897928.db2.gz CTOJWTYJJNCGHX-HXUWFJFHSA-N 0 3 419.573 4.041 20 0 HIADHN COc1cccc([C@@H](CNC(=O)N[C@@H](C)c2c(F)cccc2OC)N2CCCC2)c1 ZINC000465467144 878902572 /nfs/dbraw/zinc/90/25/72/878902572.db2.gz OBEVYXXZIAZYNA-OXJNMPFZSA-N 0 3 415.509 4.040 20 0 HIADHN CN(C)CCN(C[C@H]1CCCO1)C(=O)N[C@@H](c1ccccc1)c1ccc(Cl)cc1 ZINC000465471681 878907922 /nfs/dbraw/zinc/90/79/22/878907922.db2.gz GHNZRFFGPYFTTH-YADHBBJMSA-N 0 3 415.965 4.182 20 0 HIADHN COc1ccc([C@H](NC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)C2CC2)cc1 ZINC000465475063 878912045 /nfs/dbraw/zinc/91/20/45/878912045.db2.gz VAQRNOWYDXQVJM-NTKDMRAZSA-N 0 3 407.558 4.452 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)NCc1cc(Cl)ccc1OC(F)F ZINC000465526461 878977969 /nfs/dbraw/zinc/97/79/69/878977969.db2.gz FTEOASKLBKKWAR-UHFFFAOYSA-N 0 3 423.891 4.189 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N(Cc1cc[nH]n1)Cc1ccccc1)c1ccsc1 ZINC000465527394 878979798 /nfs/dbraw/zinc/97/97/98/878979798.db2.gz NDMPZMLVFPVBIO-NRFANRHFSA-N 0 3 411.575 4.266 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N(Cc1cc[nH]n1)Cc1ccccc1)c1ccsc1 ZINC000465527396 878979996 /nfs/dbraw/zinc/97/99/96/878979996.db2.gz NDMPZMLVFPVBIO-OAQYLSRUSA-N 0 3 411.575 4.266 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NC[C@@H]1CCO[C@H]1c1ccccc1)c1ccsc1 ZINC000465528795 878983987 /nfs/dbraw/zinc/98/39/87/878983987.db2.gz UNHDZNIVBLREPD-TYPHKJRUSA-N 0 3 401.576 4.208 20 0 HIADHN Cc1ccc([C@H]2OCCC[C@@H]2CNC(=O)NCCCN2CCc3ccccc3C2)cc1 ZINC000465535225 878994915 /nfs/dbraw/zinc/99/49/15/878994915.db2.gz XBFVECNSBQHNLM-ILBGXUMGSA-N 0 3 421.585 4.210 20 0 HIADHN Brc1ccc2[nH]c(CN3CCC[C@H](c4ncc5n4CCCC5)C3)nc2c1 ZINC000503417627 912406512 /nfs/dbraw/zinc/40/65/12/912406512.db2.gz VXHFXJYKYSQEBH-AWEZNQCLSA-N 0 3 414.351 4.238 20 0 HIADHN Brc1ccc2nc(CN3CCC[C@H](c4ncc5n4CCCC5)C3)[nH]c2c1 ZINC000503417627 912406518 /nfs/dbraw/zinc/40/65/18/912406518.db2.gz VXHFXJYKYSQEBH-AWEZNQCLSA-N 0 3 414.351 4.238 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)N3Cc4ccccc4C[C@H]3C)CC2)c1 ZINC000465553085 879018460 /nfs/dbraw/zinc/01/84/60/879018460.db2.gz YPSHRQYOHHTXRS-JOCHJYFZSA-N 0 3 420.601 4.054 20 0 HIADHN C[C@H](NC(=O)N[C@@H](CN1CCCC1)c1ccccc1)c1ccc(-n2cccn2)cc1 ZINC000465588071 879068733 /nfs/dbraw/zinc/06/87/33/879068733.db2.gz BKIJGYMLEZPDBQ-CVDCTZTESA-N 0 3 403.530 4.070 20 0 HIADHN CC[C@@H](Cc1ccccc1)N(C)C(=O)NCCCN1CCN(C)C[C@H]1c1ccccc1 ZINC000465610604 879105501 /nfs/dbraw/zinc/10/55/01/879105501.db2.gz WOEFEYANHSHHTM-DQEYMECFSA-N 0 3 422.617 4.028 20 0 HIADHN C[C@H](NC(=O)N[C@H](CN1CCCC1)c1ccccc1)c1nc(-c2cccc(F)c2)no1 ZINC000465611306 879107832 /nfs/dbraw/zinc/10/78/32/879107832.db2.gz XBFVKTSILVMFHM-OXJNMPFZSA-N 0 3 423.492 4.073 20 0 HIADHN CC[C@@H](Cc1ccccc1)N(C)C(=O)NCCCCN1CCN(c2ccccc2)CC1 ZINC000465666392 879201105 /nfs/dbraw/zinc/20/11/05/879201105.db2.gz QMMYQNZMSUIBRZ-DEOSSOPVSA-N 0 3 422.617 4.252 20 0 HIADHN C[C@@H]1CCN(C(=O)NCc2cc(-c3ccccc3)no2)CCN1Cc1ccccc1 ZINC000465678073 879219777 /nfs/dbraw/zinc/21/97/77/879219777.db2.gz ZWZYWCJJNCJWLI-LJQANCHMSA-N 0 3 404.514 4.148 20 0 HIADHN O=C(NCc1ccc(-c2cccnc2)cc1)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000465701902 879264868 /nfs/dbraw/zinc/26/48/68/879264868.db2.gz YPFJNPAIWCKIKW-DEOSSOPVSA-N 0 3 400.526 4.212 20 0 HIADHN O=C(NCC1(c2cccc(C(F)(F)F)c2)CCCC1)N1CC[C@H](N2CC=CC2)C1 ZINC000465743573 879330955 /nfs/dbraw/zinc/33/09/55/879330955.db2.gz ILMPIFMQDIRGTA-IBGZPJMESA-N 0 3 407.480 4.173 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)NCc2ccc(-c3cccnc3)cc2)C1 ZINC000465764831 879361393 /nfs/dbraw/zinc/36/13/93/879361393.db2.gz XQZKXDWAIMURJM-DVECYGJZSA-N 0 3 400.526 4.383 20 0 HIADHN CO[C@H](CNC(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1)c1ccc(Cl)cc1 ZINC000465766042 879362322 /nfs/dbraw/zinc/36/23/22/879362322.db2.gz XIMNEVGKAUERHT-MAODMQOUSA-N 0 3 401.938 4.162 20 0 HIADHN C[C@H]1CCN(C(=O)NCCc2ccc3ccccc3n2)CCN1Cc1ccccc1 ZINC000465784646 879390528 /nfs/dbraw/zinc/39/05/28/879390528.db2.gz NTYUXFMJFBRVOE-FQEVSTJZSA-N 0 3 402.542 4.083 20 0 HIADHN C[C@@H](NC(=O)NC[C@H]1CCCCN1Cc1ccccc1)c1ccc(-n2cccn2)cc1 ZINC000465790701 879399059 /nfs/dbraw/zinc/39/90/59/879399059.db2.gz RQGQSOKRAYVFCU-HYBUGGRVSA-N 0 3 417.557 4.287 20 0 HIADHN Cc1ccc([C@H](CNC(=O)NC[C@H]2CCO[C@@H]2c2ccccc2)N2CCCC2)cc1 ZINC000465820276 879446483 /nfs/dbraw/zinc/44/64/83/879446483.db2.gz RNUIASLNAMAPGC-TZRRMPRUSA-N 0 3 407.558 4.209 20 0 HIADHN COc1ccc(-c2nc(C)c(C(=O)N(CCN(C)C)c3ccccc3)s2)c(F)c1 ZINC000503443880 912461472 /nfs/dbraw/zinc/46/14/72/912461472.db2.gz ZMLKGLMKUUQEAK-UHFFFAOYSA-N 0 3 413.518 4.475 20 0 HIADHN C[C@H]1CCN(C(=O)NCc2ccc(Br)cc2)CCN1Cc1ccccc1 ZINC000465861295 879509357 /nfs/dbraw/zinc/50/93/57/879509357.db2.gz GXXDJYKJDHLJLZ-KRWDZBQOSA-N 0 3 416.363 4.255 20 0 HIADHN CN(C)CCN(C[C@@H]1CCCO1)C(=O)N[C@H](c1ccc(Cl)cc1)C1CCCC1 ZINC000465890267 879545993 /nfs/dbraw/zinc/54/59/93/879545993.db2.gz LMWAQTIUMDHMLY-SFTDATJTSA-N 0 3 407.986 4.324 20 0 HIADHN C[C@H](NC(=O)NC[C@H]1CCCN1Cc1ccccc1)c1nc(C2CCCCC2)no1 ZINC000465921830 879585047 /nfs/dbraw/zinc/58/50/47/879585047.db2.gz ANTNSPKJQCUTGK-FXAWDEMLSA-N 0 3 411.550 4.142 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)N[C@H](c2oc3ccccc3c2C)C(C)C)CC1 ZINC000465923934 879586126 /nfs/dbraw/zinc/58/61/26/879586126.db2.gz RXBIZYCHCVKDCK-AVRDEDQJSA-N 0 3 414.594 4.011 20 0 HIADHN Cc1c2ccccc2oc1[C@H](NC(=O)N(CCN(C)C)C[C@@H]1CCCO1)C(C)C ZINC000465924707 879588255 /nfs/dbraw/zinc/58/82/55/879588255.db2.gz SLDPYRJKNQPKPL-GHTZIAJQSA-N 0 3 401.551 4.191 20 0 HIADHN CC(C)[C@@H](CNC(=O)N1CC[C@H](N2CC=CC2)C1)Cc1ccc(Cl)cc1Cl ZINC000465925126 879588661 /nfs/dbraw/zinc/58/86/61/879588661.db2.gz NZJAYNXUTJDSNV-MJGOQNOKSA-N 0 3 410.389 4.464 20 0 HIADHN Cc1cccc2c(CCNC(=O)N3CC[C@H](C)N(Cc4ccccc4)CC3)c[nH]c21 ZINC000466006100 879685092 /nfs/dbraw/zinc/68/50/92/879685092.db2.gz HFTSCZFEYBMTRN-FQEVSTJZSA-N 0 3 404.558 4.325 20 0 HIADHN COc1ccccc1C[C@H](C)N(Cc1ccccc1)C(=O)N[C@H]1CCN(C2CC2)C1 ZINC000466021115 879706666 /nfs/dbraw/zinc/70/66/66/879706666.db2.gz WWOPGDGKHRTVMA-UGKGYDQZSA-N 0 3 407.558 4.075 20 0 HIADHN COc1cccc([C@@H](NC(=O)N2CCN(C)CC[C@H]2C)c2ccccc2Cl)c1 ZINC000466041225 879729821 /nfs/dbraw/zinc/72/98/21/879729821.db2.gz OPUSVGKWQGFXHA-IIBYNOLFSA-N 0 3 401.938 4.174 20 0 HIADHN COc1ccc([C@H](C)CCNC(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)cc1 ZINC000466043920 879733665 /nfs/dbraw/zinc/73/36/65/879733665.db2.gz VNMSOCSMKYKKIX-QGZVFWFLSA-N 0 3 419.516 4.240 20 0 HIADHN COc1ccc([C@@H](C)CCNC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)cc1 ZINC000466055977 879748776 /nfs/dbraw/zinc/74/87/76/879748776.db2.gz ODAYVOHMYVEHJU-SFTDATJTSA-N 0 3 409.574 4.495 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NC[C@@H]3CCO[C@H]3c3ccccc3)c(C)c2)CC1 ZINC000466065790 879765454 /nfs/dbraw/zinc/76/54/54/879765454.db2.gz TZZCZZBZKCIFKU-URXFXBBRSA-N 0 3 422.573 4.036 20 0 HIADHN CO[C@@H](CNC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C)c1ccc(Cl)cc1 ZINC000466081050 879800167 /nfs/dbraw/zinc/80/01/67/879800167.db2.gz HMWUXHXDAGKUOA-GCJKJVERSA-N 0 3 415.965 4.334 20 0 HIADHN C[C@@H](NC(=O)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1)[C@@H]1CCOC1 ZINC000466118471 879831906 /nfs/dbraw/zinc/83/19/06/879831906.db2.gz SODPCDAWBUZMTA-NVXWUHKLSA-N 0 3 414.377 4.026 20 0 HIADHN Cc1cccc(C)c1Oc1ccccc1NC(=O)NC[C@@H](C)CN1CCN(C)CC1 ZINC000466130081 879842167 /nfs/dbraw/zinc/84/21/67/879842167.db2.gz IDACFJVHCIEWKR-GOSISDBHSA-N 0 3 410.562 4.101 20 0 HIADHN Cc1cc(Sc2ccccc2)ccc1NC(=O)NC[C@@H](C)CN1CCN(C)CC1 ZINC000466133996 879845864 /nfs/dbraw/zinc/84/58/64/879845864.db2.gz GKMTXQJWZVEMSH-GOSISDBHSA-N 0 3 412.603 4.151 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)N[C@H](c2ccccc2)c2ccccn2)CN1Cc1ccccc1 ZINC000466140084 879850198 /nfs/dbraw/zinc/85/01/98/879850198.db2.gz FRKRSWDEVBBBTF-WNOPAQSVSA-N 0 3 400.526 4.133 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)N2CCC[C@@H]2c2ccc(C(C)(C)C)cc2)CC1 ZINC000466146049 879854701 /nfs/dbraw/zinc/85/47/01/879854701.db2.gz ZYVCEGRDMCNTLI-NFBKMPQASA-N 0 3 414.638 4.104 20 0 HIADHN C[C@@H](CNC(=O)Nc1ccc(Oc2ccccc2Cl)cc1)CN1CCN(C)CC1 ZINC000466147995 879855887 /nfs/dbraw/zinc/85/58/87/879855887.db2.gz QXTGNULCYVLVST-KRWDZBQOSA-N 0 3 416.953 4.137 20 0 HIADHN C[C@H](CNC(=O)N(CCN(C)C)Cc1ccc(F)cc1)Oc1ccccc1Cl ZINC000466164750 879867007 /nfs/dbraw/zinc/86/70/07/879867007.db2.gz MPSMHUKJNKKPLC-MRXNPFEDSA-N 0 3 407.917 4.020 20 0 HIADHN COc1ccc([C@H](CNC(=O)Nc2ccccc2OC(F)F)N2CCCC2)cc1 ZINC000503489400 912531520 /nfs/dbraw/zinc/53/15/20/912531520.db2.gz CINAJNNGSDQKQL-SFHVURJKSA-N 0 3 405.445 4.255 20 0 HIADHN Cc1ccc(-c2n[nH]cc2CNCc2ccc(I)c(C)c2)o1 ZINC000466362849 880120513 /nfs/dbraw/zinc/12/05/13/880120513.db2.gz DQFDDKWPUWMSFA-UHFFFAOYSA-N 0 3 407.255 4.181 20 0 HIADHN COc1ccc([C@H](CNC(=O)Nc2cc(Cl)ccc2OC)N2CCCC2)cc1 ZINC000503492196 912537993 /nfs/dbraw/zinc/53/79/93/912537993.db2.gz VCFRUQCACVWWEU-IBGZPJMESA-N 0 3 403.910 4.316 20 0 HIADHN COc1cc(CNCc2cc3cc(Br)ccc3[nH]2)cc2c1OCCO2 ZINC000466447034 880224780 /nfs/dbraw/zinc/22/47/80/880224780.db2.gz WBWCSNCOHZCKNV-UHFFFAOYSA-N 0 3 403.276 4.000 20 0 HIADHN COCCOc1ccc(CNCc2cc3cc(Br)ccc3[nH]2)cc1OC ZINC000466457129 880236567 /nfs/dbraw/zinc/23/65/67/880236567.db2.gz JNQBUOTVGIDWEA-UHFFFAOYSA-N 0 3 419.319 4.254 20 0 HIADHN Cc1oc2ccccc2c1CNCc1ccc(OCCN2CCOCC2)c(Cl)c1 ZINC000466465532 880247615 /nfs/dbraw/zinc/24/76/15/880247615.db2.gz QEJHGWXFMYFEPP-UHFFFAOYSA-N 0 3 414.933 4.395 20 0 HIADHN CCOc1cc(CNCc2c(C)oc3ccccc32)ccc1O[C@H](C)C(=O)N(C)C ZINC000466474423 880257384 /nfs/dbraw/zinc/25/73/84/880257384.db2.gz OTRBZQUGDTZZJH-QGZVFWFLSA-N 0 3 410.514 4.285 20 0 HIADHN Cc1nn(C)c(OCC(F)(F)F)c1CNC1CC(c2ccc(F)c(Cl)c2)C1 ZINC000466479550 880261450 /nfs/dbraw/zinc/26/14/50/880261450.db2.gz XVIVAINKYXZQIG-UHFFFAOYSA-N 0 3 405.823 4.498 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)N(Cc2cccs2)C[C@@H]2CCCO2)CN1Cc1ccccc1 ZINC000466516748 880290463 /nfs/dbraw/zinc/29/04/63/880290463.db2.gz SIZAVIJRCWWOIN-NRSPTQNISA-N 0 3 413.587 4.102 20 0 HIADHN CC(C)CC(=O)Nc1ccc(NC(=O)N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)cc1 ZINC000466518148 880292650 /nfs/dbraw/zinc/29/26/50/880292650.db2.gz LKVMINTXVVFLIM-XMSQKQJNSA-N 0 3 408.546 4.456 20 0 HIADHN COc1cc(CN(C)C(=O)N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)ccc1SC ZINC000466524536 880301302 /nfs/dbraw/zinc/30/13/02/880301302.db2.gz DRHQPWXJJMTZHU-XLIONFOSSA-N 0 3 413.587 4.222 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)NCc2ccc(-c3ccncc3)cc2)CN1Cc1ccccc1 ZINC000466534513 880309208 /nfs/dbraw/zinc/30/92/08/880309208.db2.gz QKKPTRMAYWFRPE-NTKDMRAZSA-N 0 3 400.526 4.211 20 0 HIADHN COc1ccc([C@@H](CNC(=O)Nc2ccccc2N2CCCC2)N2CCCC2)cc1 ZINC000503505944 912553765 /nfs/dbraw/zinc/55/37/65/912553765.db2.gz WUPAMQAYGJQNBO-HSZRJFAPSA-N 0 3 408.546 4.254 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CCC[C@@H]1c1ccc(COC)o1)c1ccsc1 ZINC000466574293 880350167 /nfs/dbraw/zinc/35/01/67/880350167.db2.gz PCSVKLMSRYHJNY-MOPGFXCFSA-N 0 3 405.564 4.417 20 0 HIADHN CCc1c(NC(=O)N(CCN(C)C)Cc2cccc(F)c2)cnn1-c1ccccc1 ZINC000466695351 880487131 /nfs/dbraw/zinc/48/71/31/880487131.db2.gz IRJDYRJIXFOPSD-UHFFFAOYSA-N 0 3 409.509 4.170 20 0 HIADHN CCCN1CCC[C@H]1C(=O)NC[C@@H](c1c[nH]c2ccccc21)c1ccc(OC)cc1 ZINC000503526990 912577103 /nfs/dbraw/zinc/57/71/03/912577103.db2.gz IPIRRPFYVDYGHY-QPPBQGQZSA-N 0 3 405.542 4.299 20 0 HIADHN C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)N1CCC(c2nc3cc(Cl)ccc3s2)CC1 ZINC000466750333 880531167 /nfs/dbraw/zinc/53/11/67/880531167.db2.gz CNPCWGAYNQZFFF-ACJLOTCBSA-N 0 3 418.994 4.321 20 0 HIADHN C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)N1CCC(c2nc3cc(Cl)ccc3s2)CC1 ZINC000466750334 880531239 /nfs/dbraw/zinc/53/12/39/880531239.db2.gz CNPCWGAYNQZFFF-FZKQIMNGSA-N 0 3 418.994 4.321 20 0 HIADHN Cc1c(-c2cc(CN(Cc3ccc4c(c3)OCO4)C3(C)CCCC3)on2)cnn1C ZINC000466800299 880578962 /nfs/dbraw/zinc/57/89/62/880578962.db2.gz BURLTRMWTOXFJA-UHFFFAOYSA-N 0 3 408.502 4.447 20 0 HIADHN CCN(C(=O)c1ccn(-c2ccc(F)cc2F)n1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000466814159 880589649 /nfs/dbraw/zinc/58/96/49/880589649.db2.gz GPGFGEJGYZUYMN-YLJYHZDGSA-N 0 3 424.495 4.448 20 0 HIADHN CN(Cc1cc(Cl)cn1C)C(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000466844646 880612999 /nfs/dbraw/zinc/61/29/99/880612999.db2.gz WXDAEXBERLPFIY-IBGZPJMESA-N 0 3 413.871 4.092 20 0 HIADHN Cc1ccc(C[C@@H](CO)NCc2cccc(Br)c2OC(F)F)cc1 ZINC000466897045 880663893 /nfs/dbraw/zinc/66/38/93/880663893.db2.gz WBOHMOQWMXSSAI-HNNXBMFYSA-N 0 3 400.263 4.052 20 0 HIADHN O=C1c2ccccc2CCN1CCNCc1cc2ccccc2nc1N1CCCCC1 ZINC000466905522 880671088 /nfs/dbraw/zinc/67/10/88/880671088.db2.gz UEUJORCQMYRUMF-UHFFFAOYSA-N 0 3 414.553 4.013 20 0 HIADHN Cc1noc(C2CC2)c1NC(=O)N(CCN(C)C)Cc1ccc(C(F)(F)F)cc1 ZINC000466922302 880691403 /nfs/dbraw/zinc/69/14/03/880691403.db2.gz WNGCPSTUQMBCMN-UHFFFAOYSA-N 0 3 410.440 4.475 20 0 HIADHN CC1CCN([C@@H](CNC(=O)Nc2cccnc2-c2cnn(C)c2)c2ccccc2)CC1 ZINC000466946544 880720648 /nfs/dbraw/zinc/72/06/48/880720648.db2.gz LJTSGUIRXQQDPW-QFIPXVFZSA-N 0 3 418.545 4.077 20 0 HIADHN CCN(CC)[C@H](CNC(=O)C(C)(C)c1ccc(OC)c(OC)c1)c1ccsc1 ZINC000466984080 880793261 /nfs/dbraw/zinc/79/32/61/880793261.db2.gz LROSOCCHXJVWSX-GOSISDBHSA-N 0 3 404.576 4.242 20 0 HIADHN COCc1ccc([C@H]2CCCN2CCC(=O)Nc2c(C)nn(-c3ccccc3)c2C)o1 ZINC000467018323 880821237 /nfs/dbraw/zinc/82/12/37/880821237.db2.gz HOXWOOGQCCIWBZ-OAQYLSRUSA-N 0 3 422.529 4.394 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)C2(c3ccc(Cl)cc3)CCOCC2)CN1Cc1ccccc1 ZINC000467024633 880825848 /nfs/dbraw/zinc/82/58/48/880825848.db2.gz PLIPQYCEQMLARQ-GCJKJVERSA-N 0 3 412.961 4.167 20 0 HIADHN C[C@H]1C[C@H](NC(=O)c2cnn(-c3ccccc3)c2C2CC2)CN1Cc1ccccc1 ZINC000467028158 880827855 /nfs/dbraw/zinc/82/78/55/880827855.db2.gz GMASABGNJADHPC-RXVVDRJESA-N 0 3 400.526 4.143 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)c2cnn(-c3ccccc3)c2C2CC2)CN1Cc1ccccc1 ZINC000467028156 880827863 /nfs/dbraw/zinc/82/78/63/880827863.db2.gz GMASABGNJADHPC-GHTZIAJQSA-N 0 3 400.526 4.143 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)Cc2csc(-c3cccc(F)c3)n2)CN1Cc1ccccc1 ZINC000467029660 880828905 /nfs/dbraw/zinc/82/89/05/880828905.db2.gz AFYVLTPXGRAQJM-UZLBHIALSA-N 0 3 409.530 4.271 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)CCc2cc(Br)cs2)CN1Cc1ccccc1 ZINC000467044736 880839936 /nfs/dbraw/zinc/83/99/36/880839936.db2.gz IDAQBVXGXAIOKS-RHSMWYFYSA-N 0 3 407.377 4.222 20 0 HIADHN Cc1cccc(-c2nc(CC(=O)N[C@H]3C[C@@H](C)N(Cc4ccccc4)C3)cs2)c1 ZINC000467054366 880844431 /nfs/dbraw/zinc/84/44/31/880844431.db2.gz SFRCJNZKQDSLBO-NQIIRXRSSA-N 0 3 405.567 4.440 20 0 HIADHN CN(C(=O)NCc1csc(-c2ccc(C(F)(F)F)cc2)n1)[C@@H]1CCN(C2CC2)C1 ZINC000467060730 880847038 /nfs/dbraw/zinc/84/70/38/880847038.db2.gz ZIBWSXPDKFXJIY-QGZVFWFLSA-N 0 3 424.492 4.207 20 0 HIADHN CCN(CC)[C@H](CNC(=O)[C@@H]1CCCc2n[nH]cc21)c1ccc(C(F)(F)F)cc1 ZINC000467107646 880866952 /nfs/dbraw/zinc/86/69/52/880866952.db2.gz SNGUMJLNYVHDLR-VQIMIIECSA-N 0 3 408.468 4.048 20 0 HIADHN Cc1cc(N2CCSCC2)ccc1NC(=O)N[C@H]1C[C@@H](C)N(Cc2ccccc2)C1 ZINC000467108823 880867728 /nfs/dbraw/zinc/86/77/28/880867728.db2.gz DLGFLDNVGXBNBX-CTNGQTDRSA-N 0 3 424.614 4.333 20 0 HIADHN COCCOc1c(Cl)cccc1NC(=O)N[C@@H]1C[C@@H](C)N(Cc2ccccc2)C1 ZINC000467113085 880871877 /nfs/dbraw/zinc/87/18/77/880871877.db2.gz OYFGHMQVOIJQIE-SJLPKXTDSA-N 0 3 417.937 4.150 20 0 HIADHN COC(=O)COc1ccc([C@H](C)NCc2ccc(C(=O)Nc3ccccc3)cc2)cc1 ZINC000467183128 880909094 /nfs/dbraw/zinc/90/90/94/880909094.db2.gz WITVHXANZWIEFZ-SFHVURJKSA-N 0 3 418.493 4.342 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(OC(F)(F)F)cc2)CC1)C1CCCCC1 ZINC000467195302 880925435 /nfs/dbraw/zinc/92/54/35/880925435.db2.gz LAUFDPKXWISDIA-UHFFFAOYSA-N 0 3 414.468 4.125 20 0 HIADHN COc1cc(-c2noc(CN3CCC[C@@]3(C)Cc3ccccc3)n2)cc(OC)c1OC ZINC000467214758 880944025 /nfs/dbraw/zinc/94/40/25/880944025.db2.gz FJCZCDFASGYZDE-DEOSSOPVSA-N 0 3 423.513 4.360 20 0 HIADHN Cc1nnc(-c2ccc(C(=O)NC[C@H](c3cccs3)N3CCC(C)CC3)cc2)o1 ZINC000467247469 880973198 /nfs/dbraw/zinc/97/31/98/880973198.db2.gz GTQZUZGIWFHXES-LJQANCHMSA-N 0 3 410.543 4.310 20 0 HIADHN Cc1nc(-c2ccc(C(=O)NC[C@H](c3cccs3)N3CCC(C)CC3)cc2)n[nH]1 ZINC000467250466 880977896 /nfs/dbraw/zinc/97/78/96/880977896.db2.gz UFXBATPKNIMRPA-LJQANCHMSA-N 0 3 409.559 4.045 20 0 HIADHN Cc1ccc(-c2cncc(C(=O)N3CCC(CN4C[C@@H](C)O[C@H](C)C4)CC3)c2)cc1 ZINC000467254975 880987441 /nfs/dbraw/zinc/98/74/41/880987441.db2.gz WYOQKNPPORLMBA-WOJBJXKFSA-N 0 3 407.558 4.018 20 0 HIADHN COCC[C@H]1CCCCN(CC(=O)Nc2cccc(CSc3ccccn3)c2)C1 ZINC000467274362 881017078 /nfs/dbraw/zinc/01/70/78/881017078.db2.gz WOWPPNQCENFOJD-LJQANCHMSA-N 0 3 413.587 4.451 20 0 HIADHN CCN(Cc1ccccn1)C[C@H](O)COC(c1ccc(F)cc1)c1ccc(F)cc1 ZINC000467279894 881024540 /nfs/dbraw/zinc/02/45/40/881024540.db2.gz UQTPDHYQMMNYOE-QHCPKHFHSA-N 0 3 412.480 4.349 20 0 HIADHN COc1cc(C)nc(CN(Cc2cccc(Br)c2)C2CCOCC2)c1 ZINC000467301625 881051662 /nfs/dbraw/zinc/05/16/62/881051662.db2.gz PAQPEODJLFWJFP-UHFFFAOYSA-N 0 3 405.336 4.342 20 0 HIADHN CN(C)c1ncc(CN(Cc2cccc(Br)c2)C2CCOCC2)s1 ZINC000467365727 881136493 /nfs/dbraw/zinc/13/64/93/881136493.db2.gz KYHPGCYFEBOZRX-UHFFFAOYSA-N 0 3 410.381 4.153 20 0 HIADHN C[C@H](NC[C@H](O)COc1cccc(Cl)c1Cl)c1ccnn1-c1ccccc1 ZINC000467382990 881163531 /nfs/dbraw/zinc/16/35/31/881163531.db2.gz CMCIXBUOTJPFPL-HOCLYGCPSA-N 0 3 406.313 4.270 20 0 HIADHN COc1cc2c(cc1F)CC[C@@H]2NC[C@@H](O)COc1cccc(Cl)c1Cl ZINC000467384886 881165324 /nfs/dbraw/zinc/16/53/24/881165324.db2.gz KPLGPYPROQCFSJ-WBMJQRKESA-N 0 3 400.277 4.158 20 0 HIADHN CCCCOc1ccc(CN[C@@H](C)c2ccc(S(=O)(=O)NC)cc2)cc1Cl ZINC000467386438 881167759 /nfs/dbraw/zinc/16/77/59/881167759.db2.gz WONRCMVFFMOGIN-HNNXBMFYSA-N 0 3 410.967 4.278 20 0 HIADHN CC1(c2ccccc2)CC(N[C@H]2CCS(=O)(=O)c3ccc(Br)cc32)C1 ZINC000467417663 881206726 /nfs/dbraw/zinc/20/67/26/881206726.db2.gz KBTFQCXESWDBAK-IPCDKGFNSA-N 0 3 420.372 4.378 20 0 HIADHN Cn1c2ccc(C(=O)N(Cc3ccccc3)C3CCN(C)CC3)cc2nc1C(F)F ZINC000467429453 881223183 /nfs/dbraw/zinc/22/31/83/881223183.db2.gz LIYWDUCVZBTFID-UHFFFAOYSA-N 0 3 412.484 4.248 20 0 HIADHN CCN(CC)C(=O)Nc1ccc([C@H](C)N[C@@H]2CC(=O)N(Cc3ccccc3)[C@@H]2C)cc1 ZINC000467433692 881230814 /nfs/dbraw/zinc/23/08/14/881230814.db2.gz KKOOXIZASPJQHV-YCRNBWNJSA-N 0 3 422.573 4.401 20 0 HIADHN COc1cc([C@H](C)N[C@H]2CC(=O)N(Cc3ccccc3)[C@@H]2C)ccc1OC(F)F ZINC000467444982 881248625 /nfs/dbraw/zinc/24/86/25/881248625.db2.gz YBZIHCWTAGPHRR-DAYGRLMNSA-N 0 3 404.457 4.137 20 0 HIADHN CCc1noc(-c2ccc(C)c(NC(=O)N[C@@H]3C[C@H](C)N(Cc4ccccc4)C3)c2)n1 ZINC000467458231 881265656 /nfs/dbraw/zinc/26/56/56/881265656.db2.gz FWYQNDFRPBFMOF-FXAWDEMLSA-N 0 3 419.529 4.392 20 0 HIADHN Cc1cc(NC(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)ccc1OC1CCOCC1 ZINC000467466193 881280910 /nfs/dbraw/zinc/28/09/10/881280910.db2.gz BZLNHDQDEHSVBK-SIKLNZKXSA-N 0 3 423.557 4.337 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)[C@@H]1C[C@@H]1c1ccc(F)cc1 ZINC000467476094 881294669 /nfs/dbraw/zinc/29/46/69/881294669.db2.gz NASYOAHUBYKCEC-YPAWHYETSA-N 0 3 404.489 4.211 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@@H](C)N[C@H](C)c2ccc(SC)cc2)cc1OC ZINC000503581682 912666067 /nfs/dbraw/zinc/66/60/67/912666067.db2.gz QCNWGIJUAKIWAW-HZPDHXFCSA-N 0 3 402.560 4.123 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)c1ccccc1Cc1ccccc1 ZINC000467498068 881313671 /nfs/dbraw/zinc/31/36/71/881313671.db2.gz AYMRDDZCRLMBML-UHFFFAOYSA-N 0 3 414.549 4.164 20 0 HIADHN CC(C)c1cc(C(=O)NCc2ccccc2CN2CCC(O)CC2)c2ccccc2n1 ZINC000467498705 881315504 /nfs/dbraw/zinc/31/55/04/881315504.db2.gz KRNJPBNWAJRKDZ-UHFFFAOYSA-N 0 3 417.553 4.245 20 0 HIADHN Cc1nc(-c2ccsc2)ccc1C(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000467502551 881318499 /nfs/dbraw/zinc/31/84/99/881318499.db2.gz CZILYSXEQWLZHF-UHFFFAOYSA-N 0 3 421.566 4.005 20 0 HIADHN COc1ccc([C@H](N[C@@H](C)Cn2cccn2)c2ccccc2)cc1Br ZINC000469063500 883140015 /nfs/dbraw/zinc/14/00/15/883140015.db2.gz UHXTZJSOLKVAGP-MGPUTAFESA-N 0 3 400.320 4.422 20 0 HIADHN COC(=O)[C@@](C)(CN[C@H](C)C(=O)Nc1ccc(Cl)cc1Cl)c1ccccc1 ZINC000469066448 883143791 /nfs/dbraw/zinc/14/37/91/883143791.db2.gz SUBDVDJGPGIJFP-XCLFUZPHSA-N 0 3 409.313 4.041 20 0 HIADHN COc1cc(C)c([C@H](C)N[C@@H]2CCCN(Cc3ccc(F)cc3F)C2=O)cc1OC ZINC000469103774 883194631 /nfs/dbraw/zinc/19/46/31/883194631.db2.gz VGRCKUCOBXZWHS-MGPUTAFESA-N 0 3 418.484 4.132 20 0 HIADHN COc1cc(C)c([C@H](C)N[C@H]2CCCN(Cc3ccc(F)cc3F)C2=O)cc1OC ZINC000469103809 883195034 /nfs/dbraw/zinc/19/50/34/883195034.db2.gz VGRCKUCOBXZWHS-YWZLYKJASA-N 0 3 418.484 4.132 20 0 HIADHN Cc1nn(CC(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)cc1-c1ccccc1 ZINC000469147391 883242665 /nfs/dbraw/zinc/24/26/65/883242665.db2.gz ZMCOIMKWWNUJNY-XMMPIXPASA-N 0 3 402.542 4.120 20 0 HIADHN COc1cccc([C@@H](C)CCCC(=O)NC[C@H]2CN(Cc3ccccc3)CCCO2)c1 ZINC000469234521 883334009 /nfs/dbraw/zinc/33/40/09/883334009.db2.gz SVFRQDURCGBDCN-OFVILXPXSA-N 0 3 424.585 4.376 20 0 HIADHN Cc1cc(Oc2ccc(NC(=O)c3ccc(N4CCN(C(C)C)CC4)cc3)cc2)n[nH]1 ZINC000469319047 883423304 /nfs/dbraw/zinc/42/33/04/883423304.db2.gz ZBOQTAPFXUYBRO-UHFFFAOYSA-N 0 3 419.529 4.293 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)N[C@H](C)c1ccc2c(c1)CCC(=O)N2 ZINC000469423647 883601733 /nfs/dbraw/zinc/60/17/33/883601733.db2.gz CNFBTANFPLTPDA-WZONZLPQSA-N 0 3 422.573 4.088 20 0 HIADHN Cc1ccc(F)c(C(=O)NC[C@@H]2CCCN2Cc2ccccc2)c1Br ZINC000469424032 883602118 /nfs/dbraw/zinc/60/21/18/883602118.db2.gz ICTHTFJOEFBDDZ-INIZCTEOSA-N 0 3 405.311 4.291 20 0 HIADHN Cc1csc([C@H](NC(=O)N[C@@H](CN(C)Cc2ccccc2)C(C)C)C2CC2)n1 ZINC000469439957 883630137 /nfs/dbraw/zinc/63/01/37/883630137.db2.gz CSLGHORKVONIJM-VQTJNVASSA-N 0 3 400.592 4.358 20 0 HIADHN Cc1nc(-c2ccccc2)sc1[C@H](C)N(C)CCc1nnnn1-c1ccccc1 ZINC000469449105 883647948 /nfs/dbraw/zinc/64/79/48/883647948.db2.gz XXRIKHUBZHRENF-KRWDZBQOSA-N 0 3 404.543 4.330 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)Nc1ccc(CN2CCCC2=O)cc1 ZINC000469452497 883653595 /nfs/dbraw/zinc/65/35/95/883653595.db2.gz NZHBUWYHRWIPRK-HSZRJFAPSA-N 0 3 422.573 4.087 20 0 HIADHN COc1cc(NC(=O)CCN2CC[C@H](c3c(F)cccc3F)C2)c(OC)cc1Cl ZINC000469452821 883656182 /nfs/dbraw/zinc/65/61/82/883656182.db2.gz ROMPGJBUAQGZTA-ZDUSSCGKSA-N 0 3 424.875 4.454 20 0 HIADHN CC(C)NC(=O)c1ccc(NC(=O)N[C@@H](CN(C)Cc2ccccc2)C(C)C)cc1 ZINC000469469630 883692940 /nfs/dbraw/zinc/69/29/40/883692940.db2.gz YOVSZAQLLNGVCC-QFIPXVFZSA-N 0 3 410.562 4.103 20 0 HIADHN CCN(CC)C(=O)c1ccc(C(=O)N[C@@H](CN(C)Cc2ccccc2)C(C)C)cc1 ZINC000469478799 883711317 /nfs/dbraw/zinc/71/13/17/883711317.db2.gz XIZJYUFRXGNVHX-QHCPKHFHSA-N 0 3 409.574 4.055 20 0 HIADHN CC(C)n1c2ccccc2nc1[C@@H]1CCCN(Cc2cc(-c3cnn(C)c3)no2)C1 ZINC000469518667 883783771 /nfs/dbraw/zinc/78/37/71/883783771.db2.gz HTUFEKAFEIORBA-QGZVFWFLSA-N 0 3 404.518 4.385 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N[C@H](C)c3nc4ccccc4n3C(C)C)cc2)CC1 ZINC000469551223 883810505 /nfs/dbraw/zinc/81/05/05/883810505.db2.gz DMHPORKPUZVJTL-LJQANCHMSA-N 0 3 419.573 4.250 20 0 HIADHN O=C(CC1(N2CCOCC2)CCCC1)NCC1(c2cccc(C(F)(F)F)c2)CCC1 ZINC000469611323 883834363 /nfs/dbraw/zinc/83/43/63/883834363.db2.gz MSPZSMQBSIFBIX-UHFFFAOYSA-N 0 3 424.507 4.278 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)Nc1ccccc1O[C@@H]1CCOC1 ZINC000469661240 883855566 /nfs/dbraw/zinc/85/55/66/883855566.db2.gz MAKHTGLSTFOHPB-IFMALSPDSA-N 0 3 411.546 4.132 20 0 HIADHN CCn1cnnc1-c1ccccc1NC(=O)N[C@@H](CN(C)Cc1ccccc1)C(C)C ZINC000469679740 883866790 /nfs/dbraw/zinc/86/67/90/883866790.db2.gz JRNXSQJPVAFARI-QFIPXVFZSA-N 0 3 420.561 4.243 20 0 HIADHN Fc1ccc(-c2noc([C@@H]3CCCN(CCOCC(F)(F)C(F)(F)F)C3)n2)cc1 ZINC000469718209 883884454 /nfs/dbraw/zinc/88/44/54/883884454.db2.gz QIKYWVABTZIIBD-CYBMUJFWSA-N 0 3 423.357 4.269 20 0 HIADHN O=C(CCN1CC[C@H](Oc2ccncc2)C1)Nc1ccccc1Oc1ccccc1 ZINC000469738889 883895096 /nfs/dbraw/zinc/89/50/96/883895096.db2.gz BBLAZBZBZDUCBU-NRFANRHFSA-N 0 3 403.482 4.356 20 0 HIADHN CCc1nc(C)c([C@@H](C)N(C)C(=O)CCN2CCN(c3cccc(C)c3)CC2)s1 ZINC000469744027 883899962 /nfs/dbraw/zinc/89/99/62/883899962.db2.gz FRJMIGIBEUVRAB-LJQANCHMSA-N 0 3 414.619 4.054 20 0 HIADHN COc1cc(Br)ccc1[C@H](C)NC[C@@H](O)COc1cccc2[nH]ccc21 ZINC000469751334 883911633 /nfs/dbraw/zinc/91/16/33/883911633.db2.gz INOWYSSTXQOBQN-DZGCQCFKSA-N 0 3 419.319 4.030 20 0 HIADHN C[C@@H](N[C@H]1CCN(c2ccccc2C(F)(F)F)C1=O)c1cccc(-n2ccnc2)c1 ZINC000469767115 883937316 /nfs/dbraw/zinc/93/73/16/883937316.db2.gz YJVGQEQWLJLERH-BEFAXECRSA-N 0 3 414.431 4.347 20 0 HIADHN CCS[C@@H]1CCCC[C@H]1NCC(=O)Nc1c(F)cc(F)cc1Br ZINC000469773679 883948639 /nfs/dbraw/zinc/94/86/39/883948639.db2.gz AFDJNEIUPPFUDL-ZIAGYGMSSA-N 0 3 407.324 4.320 20 0 HIADHN CCc1nc2ccccc2n1C1CCN(CCOCC(F)(F)C(F)(F)F)CC1 ZINC000469782500 883957286 /nfs/dbraw/zinc/95/72/86/883957286.db2.gz ZNUHUZRUNUHDRW-UHFFFAOYSA-N 0 3 405.411 4.450 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 ZINC000503668944 912776444 /nfs/dbraw/zinc/77/64/44/912776444.db2.gz ZJTPWBWQIPEPLV-UHFFFAOYSA-N 0 3 400.832 4.350 20 0 HIADHN O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)C1(c2ccc(F)cc2)CCCC1 ZINC000469841851 884024657 /nfs/dbraw/zinc/02/46/57/884024657.db2.gz MBOAUAXPWIVHCK-HSZRJFAPSA-N 0 3 410.533 4.045 20 0 HIADHN O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)[C@H]1C[C@@H]1c1cccc2ccccc21 ZINC000469848695 884031954 /nfs/dbraw/zinc/03/19/54/884031954.db2.gz MKQYSJZQXVJJQL-RCXJIHSJSA-N 0 3 414.549 4.351 20 0 HIADHN Cc1cc(CCCC(=O)NC[C@@H]2CN(Cc3ccccc3)CCCO2)c(C)s1 ZINC000469867111 884057800 /nfs/dbraw/zinc/05/78/00/884057800.db2.gz SYDYRQSFYLEGSG-JOCHJYFZSA-N 0 3 400.588 4.095 20 0 HIADHN O=C(CCN1CCN(c2ccccc2)CC1)N[C@@H](Cc1ccccc1)c1cccs1 ZINC000469911756 884102923 /nfs/dbraw/zinc/10/29/23/884102923.db2.gz YRDPAALWYMBKOM-QHCPKHFHSA-N 0 3 419.594 4.360 20 0 HIADHN O=C(N[C@@H](C1CCCC1)C(F)(F)F)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000469922293 884113041 /nfs/dbraw/zinc/11/30/41/884113041.db2.gz ZMTCAAIRTWZMBU-NRXISQOPSA-N 0 3 415.422 4.212 20 0 HIADHN CCc1c(C(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)cnn1-c1ccccc1OC ZINC000469924264 884116438 /nfs/dbraw/zinc/11/64/38/884116438.db2.gz CLHDGLNSIFTFRR-ICSRJNTNSA-N 0 3 418.541 4.009 20 0 HIADHN CCCn1ccnc1CCCN(C)C(=O)[C@@H](C)N1CCC(Cc2ccccc2)CC1 ZINC000469946994 884145548 /nfs/dbraw/zinc/14/55/48/884145548.db2.gz GXDJCDCPLSFRPZ-OAQYLSRUSA-N 0 3 410.606 4.027 20 0 HIADHN C[C@H]1CN(C(=O)NCC(C)(C)N2CCc3ccccc3C2)C[C@@H](c2ccsc2)O1 ZINC000470040589 884282326 /nfs/dbraw/zinc/28/23/26/884282326.db2.gz DTANOCKXPWUGSF-UWJYYQICSA-N 0 3 413.587 4.056 20 0 HIADHN Cc1ccc([C@H]2OCCC[C@H]2NC(=O)N(CCN(C)C)Cc2cccc(F)c2)cc1 ZINC000470048709 884292129 /nfs/dbraw/zinc/29/21/29/884292129.db2.gz CZPKUDZXHBGBGM-DHIUTWEWSA-N 0 3 413.537 4.128 20 0 HIADHN COc1cccc(C[C@H](NCC(=O)N[C@H]2CCOc3ccccc32)c2ccccc2)c1 ZINC000503858813 912844584 /nfs/dbraw/zinc/84/45/84/912844584.db2.gz LQJFZZJRKWSAPJ-ZEQRLZLVSA-N 0 3 416.521 4.209 20 0 HIADHN CC(C)[C@@H]1CCC[C@H](NC(=O)N(C)C2CCN(CCc3ccccn3)CC2)CC1 ZINC000470292977 884668637 /nfs/dbraw/zinc/66/86/37/884668637.db2.gz MFBDDDJHGFHPQS-IRLDBZIGSA-N 0 3 400.611 4.335 20 0 HIADHN Cc1ccc([C@@H](Cc2ccccc2Br)N[C@@H](C)C(=O)NCCF)cc1 ZINC000503883264 912849674 /nfs/dbraw/zinc/84/96/74/912849674.db2.gz CRLXDEJZFUEEJA-HNAYVOBHSA-N 0 3 407.327 4.105 20 0 HIADHN Cc1cc(SC2CCCCC2)ccc1NC(=O)N1CCCN([C@@H](C)CO)CC1 ZINC000470353605 884746877 /nfs/dbraw/zinc/74/68/77/884746877.db2.gz MJNDVQACCABALK-SFHVURJKSA-N 0 3 405.608 4.340 20 0 HIADHN C[C@H]1CCC[C@@H]1CC(=O)NC1CCN(CCOc2ccc(Br)cc2)CC1 ZINC000470360156 884752206 /nfs/dbraw/zinc/75/22/06/884752206.db2.gz YFGXRYVTBSJDJB-DLBZAZTESA-N 0 3 423.395 4.235 20 0 HIADHN C[C@H](CO)N1CCCN(C(=O)Nc2ccc(Sc3ccc(Cl)cc3)cc2)CC1 ZINC000470359837 884753062 /nfs/dbraw/zinc/75/30/62/884753062.db2.gz UPLBYSCEJWEHTO-MRXNPFEDSA-N 0 3 419.978 4.412 20 0 HIADHN C[C@@H](CO)N1CCCN(C(=O)Nc2cccc(CSCc3ccccc3)c2)CC1 ZINC000470368342 884762747 /nfs/dbraw/zinc/76/27/47/884762747.db2.gz YTAKUNLLIXIELZ-IBGZPJMESA-N 0 3 413.587 4.040 20 0 HIADHN O=C(CN[C@@H]1CCCc2c(Br)cccc21)N[C@@H]1CCOc2ccccc21 ZINC000503910564 912861808 /nfs/dbraw/zinc/86/18/08/912861808.db2.gz MNQWEDWYHUACPR-RTBURBONSA-N 0 3 415.331 4.056 20 0 HIADHN CCCOc1cc(F)ccc1NC(=O)N(C)C1CCN(CCc2ccccn2)CC1 ZINC000470426046 884827743 /nfs/dbraw/zinc/82/77/43/884827743.db2.gz BVVKGBQMFMNPNC-UHFFFAOYSA-N 0 3 414.525 4.180 20 0 HIADHN Cc1ccc(NC(=O)C[C@@H](C)N[C@H](Cn2ccccc2=O)c2ccccc2)c(C)c1 ZINC000503927411 912868235 /nfs/dbraw/zinc/86/82/35/912868235.db2.gz PQUDFDJTWNRUSF-NFBKMPQASA-N 0 3 403.526 4.213 20 0 HIADHN Cc1c(C(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)cnn1-c1ccccc1C ZINC000470656417 885078263 /nfs/dbraw/zinc/07/82/63/885078263.db2.gz NERMIODQIORKMD-QFIPXVFZSA-N 0 3 402.542 4.226 20 0 HIADHN CN(C(=O)c1cc(-c2ccccc2Cl)n[nH]1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470661276 885086409 /nfs/dbraw/zinc/08/64/09/885086409.db2.gz FAKOKUFIFQFIEG-GOSISDBHSA-N 0 3 408.933 4.467 20 0 HIADHN CN(Cc1nc(C(F)(F)F)cs1)C(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000470666393 885094364 /nfs/dbraw/zinc/09/43/64/885094364.db2.gz ISXNKADBFITJON-AWEZNQCLSA-N 0 3 415.456 4.172 20 0 HIADHN CN(C(=O)c1cc(F)cc(Br)c1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470673375 885102760 /nfs/dbraw/zinc/10/27/60/885102760.db2.gz FXTAJJRASUVUHM-LJQANCHMSA-N 0 3 405.311 4.325 20 0 HIADHN CN(C(=O)Cc1ccc(Br)s1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470679914 885110554 /nfs/dbraw/zinc/11/05/54/885110554.db2.gz BZZUIXSELMXKPA-MRXNPFEDSA-N 0 3 407.377 4.176 20 0 HIADHN CN(C(=O)CCc1ccc(OC(F)F)cc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470678205 885110716 /nfs/dbraw/zinc/11/07/16/885110716.db2.gz MZCJJBGLIZMYDL-HXUWFJFHSA-N 0 3 402.485 4.344 20 0 HIADHN CN(C(=O)NCc1cccc(OCC(F)F)c1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470720008 885164664 /nfs/dbraw/zinc/16/46/64/885164664.db2.gz NXNUHAWSJKNAEG-HXUWFJFHSA-N 0 3 417.500 4.137 20 0 HIADHN CN(CCOc1ccc(C(F)(F)F)cc1)C(=O)c1cccc(CN2CCCC2)c1 ZINC000470721664 885166992 /nfs/dbraw/zinc/16/69/92/885166992.db2.gz CXNGEOUXRXIAKV-UHFFFAOYSA-N 0 3 406.448 4.452 20 0 HIADHN CN(C(=O)N[C@H](c1ccccc1)[C@@H]1CCCO1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470726644 885177417 /nfs/dbraw/zinc/17/74/17/885177417.db2.gz NYPNUBSVANMMGS-KMDXXIMOSA-N 0 3 407.558 4.213 20 0 HIADHN COCC[C@H](NC(=O)NC[C@H](c1cccs1)N1CCC(C)CC1)c1ccco1 ZINC000503999075 912905792 /nfs/dbraw/zinc/90/57/92/912905792.db2.gz IIEDTSFHKWKSGO-ZWKOTPCHSA-N 0 3 405.564 4.191 20 0 HIADHN COCC[C@@H](NC(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1)c1ccco1 ZINC000503999072 912905939 /nfs/dbraw/zinc/90/59/39/912905939.db2.gz IIEDTSFHKWKSGO-MSOLQXFVSA-N 0 3 405.564 4.191 20 0 HIADHN CN(C(=O)NCc1ccc(OC(F)F)cc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470744916 885207480 /nfs/dbraw/zinc/20/74/80/885207480.db2.gz NGNKDMITIYYITG-LJQANCHMSA-N 0 3 403.473 4.094 20 0 HIADHN CN(Cc1cc(Br)cs1)C[C@@H]1C[C@H](F)CN1Cc1nccs1 ZINC000470809922 885296795 /nfs/dbraw/zinc/29/67/95/885296795.db2.gz AMKGUXJEAZROPQ-STQMWFEESA-N 0 3 404.374 4.012 20 0 HIADHN CCC(CC)[C@H](c1ccc(Cl)cc1)N(C)CC(=O)N1CCC(C(=O)OC)CC1 ZINC000470929445 885434236 /nfs/dbraw/zinc/43/42/36/885434236.db2.gz DPSPGEVEORIWHF-OAQYLSRUSA-N 0 3 408.970 4.161 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)Cc2csc3nc(-c4ccccc4)cn23)o1 ZINC000470968619 885469749 /nfs/dbraw/zinc/46/97/49/885469749.db2.gz PZXGABLYXGGGGY-UHFFFAOYSA-N 0 3 422.554 4.097 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1ccc2oc(C)nc2c1 ZINC000471048728 885561276 /nfs/dbraw/zinc/56/12/76/885561276.db2.gz WJMNCUXZROKGMP-FQEVSTJZSA-N 0 3 415.497 4.340 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)NCc1nnc(-c2ccccc2)s1 ZINC000471070340 885589030 /nfs/dbraw/zinc/58/90/30/885589030.db2.gz UCXMZDRTLYZMSX-GOSISDBHSA-N 0 3 421.570 4.011 20 0 HIADHN C[C@H](NC(=O)C1(c2cccc(Cl)c2)CCOCC1)[C@@H](c1ccccc1)N(C)C ZINC000471129814 885668604 /nfs/dbraw/zinc/66/86/04/885668604.db2.gz QUIWWNDENPBMSG-UWJYYQICSA-N 0 3 400.950 4.196 20 0 HIADHN Cc1cc(CSc2ncccc2C(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)no1 ZINC000471139425 885681226 /nfs/dbraw/zinc/68/12/26/885681226.db2.gz HDPZJWLLIBRQBU-JXFKEZNVSA-N 0 3 410.543 4.092 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3ccc(F)c(F)c3)c(OCC)c2)CC1 ZINC000471170281 885728487 /nfs/dbraw/zinc/72/84/87/885728487.db2.gz QWGGARBDQJRZNW-UHFFFAOYSA-N 0 3 403.473 4.148 20 0 HIADHN C[C@H]1[C@@H](C(F)(F)F)CCN1C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000471246776 885823115 /nfs/dbraw/zinc/82/31/15/885823115.db2.gz WPMBTZBRVYSQGV-YOEHRIQHSA-N 0 3 401.498 4.083 20 0 HIADHN Cc1c(NC(=O)N[C@@H](CN2CCCC2)c2ccccc2)cccc1NC(=O)N(C)C ZINC000471359638 885984967 /nfs/dbraw/zinc/98/49/67/885984967.db2.gz DBCRXQSWBAKCLF-NRFANRHFSA-N 0 3 409.534 4.047 20 0 HIADHN Cc1ccc(F)cc1-c1nnc(NC(=O)N(CCN(C)C)Cc2ccccc2)s1 ZINC000471370315 886008378 /nfs/dbraw/zinc/00/83/78/886008378.db2.gz LEXNWPRTOREFQL-UHFFFAOYSA-N 0 3 413.522 4.248 20 0 HIADHN O=C(CCN1CCc2ccccc2C1)Nc1ccccc1NC(=O)Cc1cccs1 ZINC000471380193 886026191 /nfs/dbraw/zinc/02/61/91/886026191.db2.gz DSSWQEMGOBYCQM-UHFFFAOYSA-N 0 3 419.550 4.316 20 0 HIADHN C[C@@H](NC(=O)N(CCCc1ccccc1)CCN(C)C)c1ccccc1-n1cccn1 ZINC000471493834 886194421 /nfs/dbraw/zinc/19/44/21/886194421.db2.gz UCSFXOUKGCLTLY-OAQYLSRUSA-N 0 3 419.573 4.139 20 0 HIADHN Cc1cc(NC(=O)C(C)(C)C)sc1C(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C ZINC000471528072 886231060 /nfs/dbraw/zinc/23/10/60/886231060.db2.gz DEXNSGNJDANQOM-YJBOKZPZSA-N 0 3 401.576 4.462 20 0 HIADHN C[C@H](NC(=O)CCc1nnc(-c2ccc(Cl)cc2)o1)[C@@H](c1ccccc1)N(C)C ZINC000471541242 886247614 /nfs/dbraw/zinc/24/76/14/886247614.db2.gz KVRMTNRCIDKKGH-BTYIYWSLSA-N 0 3 412.921 4.130 20 0 HIADHN Cc1c(I)cccc1C(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C ZINC000471545504 886253352 /nfs/dbraw/zinc/25/33/52/886253352.db2.gz GHUPCTFETANHJW-KBXCAEBGSA-N 0 3 422.310 4.021 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CC[C@H](C(F)(F)F)[C@@H]1C)c1cccc(OC)c1 ZINC000471546005 886253607 /nfs/dbraw/zinc/25/36/07/886253607.db2.gz HSCIEVWZSMYKOS-JCGIZDLHSA-N 0 3 401.473 4.060 20 0 HIADHN C[C@@H](NC(=O)Cc1csc2nc(-c3ccccc3)cn12)[C@@H](c1ccccc1)N(C)C ZINC000471552142 886258827 /nfs/dbraw/zinc/25/88/27/886258827.db2.gz QJZJZCSLQKKXBQ-HXOBKFHXSA-N 0 3 418.566 4.413 20 0 HIADHN C[C@@H](NC(=O)CSCc1coc(-c2ccccc2)n1)[C@@H](c1ccccc1)N(C)C ZINC000471557109 886266145 /nfs/dbraw/zinc/26/61/45/886266145.db2.gz WIRYSNJNARCRSG-VGSWGCGISA-N 0 3 409.555 4.382 20 0 HIADHN Cc1ccc(I)c(C(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)c1 ZINC000471569381 886280213 /nfs/dbraw/zinc/28/02/13/886280213.db2.gz GUYQRTCBQVBZBR-KDOFPFPSSA-N 0 3 422.310 4.021 20 0 HIADHN C[C@H](CCCCN1C(=O)c2ccccc2C1=O)NCc1coc(-c2ccccc2)n1 ZINC000471598595 886313620 /nfs/dbraw/zinc/31/36/20/886313620.db2.gz XRPVWUPHQPGGCS-QGZVFWFLSA-N 0 3 403.482 4.286 20 0 HIADHN COc1cccc([C@@H](CNC(=O)CCc2cnc3ccccc3c2)N2CCCC2)c1 ZINC000471604556 886318045 /nfs/dbraw/zinc/31/80/45/886318045.db2.gz XRSKODMSJAQCBX-XMMPIXPASA-N 0 3 403.526 4.129 20 0 HIADHN O=C(NCCc1ccc2ccccc2c1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000471664947 886376601 /nfs/dbraw/zinc/37/66/01/886376601.db2.gz OYQMSCJFUZHVNI-UHFFFAOYSA-N 0 3 419.491 4.487 20 0 HIADHN COCCC[C@H](Cc1ccccc1)NC(=O)N[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000471727773 886443954 /nfs/dbraw/zinc/44/39/54/886443954.db2.gz PSZGPMQTLAASJS-HUVFLSCGSA-N 0 3 409.574 4.159 20 0 HIADHN CCOc1cccc([C@H](C)NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)c1 ZINC000471759525 886491011 /nfs/dbraw/zinc/49/10/11/886491011.db2.gz NKODRTQBIDACPK-NNGSBXSVSA-N 0 3 413.484 4.251 20 0 HIADHN O=C(NCc1ccc2ccccc2c1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000471809856 886547191 /nfs/dbraw/zinc/54/71/91/886547191.db2.gz JJCXELGCBIEKNW-UHFFFAOYSA-N 0 3 405.464 4.444 20 0 HIADHN C[C@H](NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1)C(C)(C)c1ccccc1 ZINC000471828157 886576835 /nfs/dbraw/zinc/57/68/35/886576835.db2.gz UJJDODXSEIKXRG-MNNVXMFVSA-N 0 3 411.512 4.457 20 0 HIADHN Cc1cn([C@H](C)c2ccccc2)nc1NC(=O)NC[C@@H](C)N(C)Cc1ccccc1 ZINC000471835480 886591371 /nfs/dbraw/zinc/59/13/71/886591371.db2.gz OPKDHTKDXCSKPP-WOJBJXKFSA-N 0 3 405.546 4.443 20 0 HIADHN CC[C@H](NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1nc(C)cs1 ZINC000471840967 886601788 /nfs/dbraw/zinc/60/17/88/886601788.db2.gz VTWBQDYZPIXBHG-NRXISQOPSA-N 0 3 404.502 4.007 20 0 HIADHN COc1cc(F)c(NC(=O)NC[C@@H](C(C)C)N2CCc3ccccc3C2)cc1OC ZINC000504178050 913061738 /nfs/dbraw/zinc/06/17/38/913061738.db2.gz MOXCXRPKOXJGSA-FQEVSTJZSA-N 0 3 415.509 4.047 20 0 HIADHN COc1ccc(NC(=O)[C@H](C)N[C@@H]2C[C@H](OCc3ccccc3)C2(C)C)c(OC)c1 ZINC000471855398 886626068 /nfs/dbraw/zinc/62/60/68/886626068.db2.gz GBSSDBWOHNTOGC-USCONSEESA-N 0 3 412.530 4.004 20 0 HIADHN CN(Cc1cccc(C(F)(F)F)c1)C1CCN(C(=O)C(=O)c2ccccc2)CC1 ZINC000471883638 886664438 /nfs/dbraw/zinc/66/44/38/886664438.db2.gz FNFVVLJFYCDSEP-UHFFFAOYSA-N 0 3 404.432 4.011 20 0 HIADHN Cc1ccc(C[C@@H](C)NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)s1 ZINC000471913815 886699384 /nfs/dbraw/zinc/69/93/84/886699384.db2.gz ZBHNOKXSPQVQFG-UWTIGNOOSA-N 0 3 403.514 4.092 20 0 HIADHN Cc1cn([C@@H](C)c2ccccc2)nc1NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000471914371 886701078 /nfs/dbraw/zinc/70/10/78/886701078.db2.gz HLPIZOBRDZMGPI-SIKLNZKXSA-N 0 3 403.530 4.197 20 0 HIADHN Cc1ccc([C@@H](NC(=O)N(CCN(C)C)Cc2ccccn2)c2ccccc2)cc1 ZINC000504190135 913072710 /nfs/dbraw/zinc/07/27/10/913072710.db2.gz MCTOULBSPFRAHV-DEOSSOPVSA-N 0 3 402.542 4.253 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2cc(F)c(Br)cc2F)[C@@H]1c1ccccc1 ZINC000471933515 886728299 /nfs/dbraw/zinc/72/82/99/886728299.db2.gz SOPXQEVCYYHMMU-WBVHZDCISA-N 0 3 410.262 4.294 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2cccc3c2CN(c2ccccn2)C3)[C@H]1c1ccccc1 ZINC000471939710 886738004 /nfs/dbraw/zinc/73/80/04/886738004.db2.gz LLVKDODHTBBJHE-ISKFKSNPSA-N 0 3 413.525 4.169 20 0 HIADHN CC1CCN([C@@H](CNC(=O)Nc2ccc(C(F)(F)F)nn2)c2ccccc2)CC1 ZINC000471975711 886806104 /nfs/dbraw/zinc/80/61/04/886806104.db2.gz CQARZPCTXLUFKF-INIZCTEOSA-N 0 3 407.440 4.090 20 0 HIADHN Cc1ccnc(Oc2ccc(NC(=O)N[C@H]3CCN(C)[C@@H]3c3ccccc3)cc2)n1 ZINC000471986622 886814478 /nfs/dbraw/zinc/81/44/78/886814478.db2.gz YJYGLBDGZXWHCZ-LEWJYISDSA-N 0 3 403.486 4.144 20 0 HIADHN CCC(CC)[C@H](c1ccc(Cl)cc1)N(C)C(=O)NC[C@H](C)CN1CCN(C)CC1 ZINC000471993362 886819871 /nfs/dbraw/zinc/81/98/71/886819871.db2.gz TUJCSNKXTAIPOU-PGRDOPGGSA-N 0 3 423.045 4.342 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)CCc3cc4ccccc4[nH]c3=O)c2)CC1 ZINC000504208590 913086056 /nfs/dbraw/zinc/08/60/56/913086056.db2.gz WXYRFMGQOOIUMJ-UHFFFAOYSA-N 0 3 418.541 4.042 20 0 HIADHN Cc1ncc(C(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)c(Cl)c1Cl ZINC000504207745 913086569 /nfs/dbraw/zinc/08/65/69/913086569.db2.gz LNMQTNIMBUXONZ-UHFFFAOYSA-N 0 3 407.345 4.480 20 0 HIADHN Cc1nn(C)c(OCC(F)(F)F)c1CN[C@H]1C[C@@H](OCc2ccccc2)C1(C)C ZINC000472041881 886858876 /nfs/dbraw/zinc/85/88/76/886858876.db2.gz OQHBYNJPPCCBIV-ZWKOTPCHSA-N 0 3 411.468 4.143 20 0 HIADHN C[C@H](CCN1CCN(C)CC1)NC(=O)c1ccccc1-c1ccc(C(F)(F)F)cc1 ZINC000472120595 886906502 /nfs/dbraw/zinc/90/65/02/886906502.db2.gz RYVYVFBKRBDTLA-QGZVFWFLSA-N 0 3 419.491 4.128 20 0 HIADHN COc1ccc(OC)c([C@@H]2C[C@H]2C(=O)NC[C@H](C(C)C)N2CCc3ccccc3C2)c1 ZINC000472121569 886909618 /nfs/dbraw/zinc/90/96/18/886909618.db2.gz DUPYMEPOUWZXFY-QPTUXGOLSA-N 0 3 422.569 4.006 20 0 HIADHN C[C@H](NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1cccc(F)c1F ZINC000472138171 886931852 /nfs/dbraw/zinc/93/18/52/886931852.db2.gz JZZLHNPPBIYYKF-XGNXJENSSA-N 0 3 405.411 4.130 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N[C@H]1CCCc2sccc21 ZINC000472170388 886969235 /nfs/dbraw/zinc/96/92/35/886969235.db2.gz IVIYTHJCQDDPNN-XUJLQICISA-N 0 3 401.498 4.230 20 0 HIADHN Cc1ccc([C@H](NC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)c2ccccn2)cc1 ZINC000472174816 886973675 /nfs/dbraw/zinc/97/36/75/886973675.db2.gz RADCWKXLDRPLMF-AMDXRBSFSA-N 0 3 414.553 4.299 20 0 HIADHN CSc1ccccc1NC(=O)CCN1CCCC[C@@H]1CNC(=O)c1ccccc1 ZINC000472275150 887090008 /nfs/dbraw/zinc/09/00/08/887090008.db2.gz ISBOUSJCKPRIEH-LJQANCHMSA-N 0 3 411.571 4.022 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)NCc1ccccc1Oc1ccccc1 ZINC000504248671 913114278 /nfs/dbraw/zinc/11/42/78/913114278.db2.gz ZCNKULKHITZIOS-UHFFFAOYSA-N 0 3 404.514 4.147 20 0 HIADHN CC(=O)N(Cc1ccc(NC(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)cc1)C(C)C ZINC000472309674 887137472 /nfs/dbraw/zinc/13/74/72/887137472.db2.gz DKKKDWOOBIMSKP-XZOQPEGZSA-N 0 3 408.546 4.010 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2ccc(-c3noc(C(F)F)n3)cc2)[C@H]1c1ccccc1 ZINC000472315240 887146318 /nfs/dbraw/zinc/14/63/18/887146318.db2.gz SHGKNIRYULVGKV-IAGOWNOFSA-N 0 3 413.428 4.241 20 0 HIADHN CCOCCOc1c(Cl)cccc1NC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000472321270 887154301 /nfs/dbraw/zinc/15/43/01/887154301.db2.gz YLGDTKFYAURBOB-AZUAARDMSA-N 0 3 417.937 4.322 20 0 HIADHN COc1ccc(Br)c(NC(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)c1 ZINC000472333155 887166152 /nfs/dbraw/zinc/16/61/52/887166152.db2.gz BEEXTLMQFXSPID-AEFFLSMTSA-N 0 3 404.308 4.025 20 0 HIADHN Cc1nc(-c2ccccc2)sc1[C@H](C)NC(=O)N(CCN(C)C)Cc1ccccn1 ZINC000504263546 913125092 /nfs/dbraw/zinc/12/50/92/913125092.db2.gz BIRNZPCFXBVTTN-SFHVURJKSA-N 0 3 423.586 4.348 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N1CCc2ccc(Cl)cc21 ZINC000472445614 887297330 /nfs/dbraw/zinc/29/73/30/887297330.db2.gz GOZYDFBBTJDAOY-UHFFFAOYSA-N 0 3 401.860 4.217 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N1CCC[C@H]1c1cccs1 ZINC000472453698 887307660 /nfs/dbraw/zinc/30/76/60/887307660.db2.gz MSZVYSLPHUHDIU-GPANFISMSA-N 0 3 401.498 4.400 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N1CCC[C@H]1c1ccsc1 ZINC000472454677 887309049 /nfs/dbraw/zinc/30/90/49/887309049.db2.gz PAYZWWXPSXFHCK-JCYILVPMSA-N 0 3 401.498 4.400 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N(Cc1cccc(F)c1)C1CC1 ZINC000472456680 887310925 /nfs/dbraw/zinc/31/09/25/887310925.db2.gz SQXHSDBSNNUCCR-UHFFFAOYSA-N 0 3 413.459 4.305 20 0 HIADHN Cc1ccccc1CN(C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1)C1CC1 ZINC000472456415 887311214 /nfs/dbraw/zinc/31/12/14/887311214.db2.gz XDBBGFSPCVPMNV-UHFFFAOYSA-N 0 3 409.496 4.474 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N(Cc1ccccc1)CC(F)F ZINC000472459502 887316729 /nfs/dbraw/zinc/31/67/29/887316729.db2.gz NBZNRTMZVNUFOA-UHFFFAOYSA-N 0 3 419.438 4.269 20 0 HIADHN CCS[C@H]1CC[C@H](N(C)C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)C1 ZINC000472461020 887319781 /nfs/dbraw/zinc/31/97/81/887319781.db2.gz WIMKGIUAFUDINI-XGHPGWEVSA-N 0 3 407.546 4.107 20 0 HIADHN COCCC[C@@H](Cc1ccccc1)NC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC000472465031 887324179 /nfs/dbraw/zinc/32/41/79/887324179.db2.gz UCSXSDMJNSLRKW-RDGATRHJSA-N 0 3 423.601 4.330 20 0 HIADHN CN(CCCCc1ccccc1)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472466856 887328110 /nfs/dbraw/zinc/32/81/10/887328110.db2.gz ORZJVUYDSCJCIX-UHFFFAOYSA-N 0 3 411.512 4.456 20 0 HIADHN Cc1ccc([C@H](NC(=O)N(Cc2ccco2)C2CCN(C)CC2)c2ccccn2)cc1 ZINC000472483252 887348771 /nfs/dbraw/zinc/34/87/71/887348771.db2.gz ZLHITJIZCOITRQ-DEOSSOPVSA-N 0 3 418.541 4.378 20 0 HIADHN Cc1ccc([C@H](NC(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)c2ccccn2)cc1 ZINC000472490762 887356676 /nfs/dbraw/zinc/35/66/76/887356676.db2.gz ZSZWQCUTMDPSRO-ZCYQVOJMSA-N 0 3 414.553 4.395 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1nn(-c2ccccc2)cc1C)c1cccc(OC)c1 ZINC000472525074 887394731 /nfs/dbraw/zinc/39/47/31/887394731.db2.gz WLYOPQYWHIFERM-QFIPXVFZSA-N 0 3 406.530 4.002 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)NCC[C@@H](C)[N@H+](C)Cc3ccccc3)cc2)cc(=O)[n-]1 ZINC000472681530 887536145 /nfs/dbraw/zinc/53/61/45/887536145.db2.gz DLGYVPKXTCGOLH-QGZVFWFLSA-N 0 3 419.529 4.190 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)NCC[C@@H](C)[N@@H+](C)Cc3ccccc3)cc2)cc(=O)[n-]1 ZINC000472681530 887536148 /nfs/dbraw/zinc/53/61/48/887536148.db2.gz DLGYVPKXTCGOLH-QGZVFWFLSA-N 0 3 419.529 4.190 20 0 HIADHN CN(C(=O)Nc1ccc(C(=O)NC(C)(C)C)cc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000472750035 887595724 /nfs/dbraw/zinc/59/57/24/887595724.db2.gz KYZGJLJIPJRLQN-JOCHJYFZSA-N 0 3 422.573 4.343 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)Nc1ccc(OCc2ccccn2)c(F)c1 ZINC000472923562 887770827 /nfs/dbraw/zinc/77/08/27/887770827.db2.gz JNBWQZZRSIKOKI-UHFFFAOYSA-N 0 3 422.504 4.395 20 0 HIADHN CN(C)[C@@H](CNC(=O)Nc1ccc(OCc2ccccn2)c(F)c1)Cc1ccccc1 ZINC000472923983 887770915 /nfs/dbraw/zinc/77/09/15/887770915.db2.gz KEWTWYNNVVVFBB-OAQYLSRUSA-N 0 3 422.504 4.094 20 0 HIADHN CC[C@H](C)c1ccc([C@H](NC(=O)N[C@H](C)CCN2CCN(C)CC2)C(C)C)cc1 ZINC000472943787 887792048 /nfs/dbraw/zinc/79/20/48/887792048.db2.gz XMPHQFNNJJQFAR-MIZPHKNDSA-N 0 3 402.627 4.222 20 0 HIADHN COc1cccc([C@@H](CNC(=O)C[C@H](c2cccs2)n2cccc2)N2CCCC2)c1 ZINC000473291298 888045302 /nfs/dbraw/zinc/04/53/02/888045302.db2.gz DRNAPWXWGFNJFR-FGZHOGPDSA-N 0 3 423.582 4.491 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)c3scnc3C(C)(C)C)CC2)c1 ZINC000473478135 888201191 /nfs/dbraw/zinc/20/11/91/888201191.db2.gz CQUDDUKZLPSUGC-UHFFFAOYSA-N 0 3 414.619 4.081 20 0 HIADHN Cc1ccc(Oc2ccccc2NC(=O)NC(C)(C)CCN2CCN(C)CC2)cc1 ZINC000473501770 888228246 /nfs/dbraw/zinc/22/82/46/888228246.db2.gz HJWPVIREMBMBTM-UHFFFAOYSA-N 0 3 410.562 4.325 20 0 HIADHN Cc1oc(-c2ccccc2)nc1C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473509857 888239425 /nfs/dbraw/zinc/23/94/25/888239425.db2.gz DNSMUAJVMUCHIP-UHFFFAOYSA-N 0 3 407.436 4.185 20 0 HIADHN Cc1cc(C)c(C)c(OCCC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)c1 ZINC000473518219 888250519 /nfs/dbraw/zinc/25/05/19/888250519.db2.gz CUMZAPZTBYDZRZ-UHFFFAOYSA-N 0 3 412.496 4.302 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)[C@H]1C[C@@H]1c1ccccc1Cl ZINC000473519186 888252147 /nfs/dbraw/zinc/25/21/47/888252147.db2.gz BCSYOGHHEKLVNN-MMADZMRASA-N 0 3 400.872 4.365 20 0 HIADHN C[C@H](SCc1ccccc1)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473519971 888254017 /nfs/dbraw/zinc/25/40/17/888254017.db2.gz CCCHWICZGKQZTK-NNGSBXSVSA-N 0 3 400.510 4.230 20 0 HIADHN C[C@@H]1CCc2sc(C(=O)NC3CC(N4CCC(C(F)(F)F)CC4)C3)cc2C1 ZINC000473522375 888257211 /nfs/dbraw/zinc/25/72/11/888257211.db2.gz FWXVOGHBKKXWME-UWTIGNOOSA-N 0 3 400.510 4.408 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1ccc(OCC(F)(F)F)cc1 ZINC000473522037 888257436 /nfs/dbraw/zinc/25/74/36/888257436.db2.gz GMMRLTFNXNBJTH-UHFFFAOYSA-N 0 3 424.385 4.163 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)C1(Cc2cccc(F)c2)CCC1 ZINC000473522718 888258173 /nfs/dbraw/zinc/25/81/73/888258173.db2.gz UCQJNAFWRPCZAB-UHFFFAOYSA-N 0 3 412.471 4.460 20 0 HIADHN CCCOc1cc(OC)ccc1C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473522768 888258278 /nfs/dbraw/zinc/25/82/78/888258278.db2.gz UJEKQNNMPAZQRZ-UHFFFAOYSA-N 0 3 414.468 4.019 20 0 HIADHN CSc1ccc(O[C@@H](C)C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cc1 ZINC000473525547 888262329 /nfs/dbraw/zinc/26/23/29/888262329.db2.gz QGWMOWCCQPWREN-JEYLPNPQSA-N 0 3 416.509 4.097 20 0 HIADHN O=C(CCCc1c[nH]c2ccccc12)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473535689 888272768 /nfs/dbraw/zinc/27/27/68/888272768.db2.gz YDBZQNYPLCKSJN-UHFFFAOYSA-N 0 3 407.480 4.412 20 0 HIADHN CC(C)(C)[C@H](CN1CCc2ccccc2C1)NC(=O)c1occc1Br ZINC000473596636 888341069 /nfs/dbraw/zinc/34/10/69/888341069.db2.gz CLLQDCPKZKTQFR-KRWDZBQOSA-N 0 3 405.336 4.245 20 0 HIADHN C[C@@H]1[C@@H](C(=O)Nc2ccc(CCN3CCSCC3)cc2)CCN1c1ccccc1 ZINC000473609400 888350408 /nfs/dbraw/zinc/35/04/08/888350408.db2.gz VZAATEPJJPHJRI-XXBNENTESA-N 0 3 409.599 4.131 20 0 HIADHN C[C@H](NC(=O)N(Cc1cccc(Br)c1)CC1CC1)C1=CCN(C)CC1 ZINC000473646338 888393201 /nfs/dbraw/zinc/39/32/01/888393201.db2.gz HYVWVVBIGYKQOD-HNNXBMFYSA-N 0 3 406.368 4.021 20 0 HIADHN Cc1nc(CNC(=O)N2CCN(C3CCCC3)CC2)oc1-c1ccc(Cl)cc1 ZINC000473674701 888436355 /nfs/dbraw/zinc/43/63/55/888436355.db2.gz JAAJLEIPEFIEPM-UHFFFAOYSA-N 0 3 402.926 4.073 20 0 HIADHN Cc1cccc(COc2cccc(NC(=O)NC(C)(C)CCN3CCN(C)CC3)c2)c1 ZINC000473673799 888436403 /nfs/dbraw/zinc/43/64/03/888436403.db2.gz GIUNHLOEJXPLHL-UHFFFAOYSA-N 0 3 424.589 4.112 20 0 HIADHN CCCc1ccc(-c2ccc(NC(=O)N[C@H](C)CCN3CCN(C)CC3)cc2)cc1 ZINC000473710968 888486911 /nfs/dbraw/zinc/48/69/11/888486911.db2.gz RDSDALYKPUUWCX-HXUWFJFHSA-N 0 3 408.590 4.454 20 0 HIADHN CCN(C(=O)Nc1nnc(C(F)(F)F)s1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000473737483 888518475 /nfs/dbraw/zinc/51/84/75/888518475.db2.gz BSYKWMWZMVVOJP-TZMCWYRMSA-N 0 3 413.469 4.246 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@H]3CCSc4c(F)cccc43)c2)CC1 ZINC000473808381 888632425 /nfs/dbraw/zinc/63/24/25/888632425.db2.gz OKAXRHOQCIODSW-FQEVSTJZSA-N 0 3 414.550 4.326 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)NCc3ccccc3C(F)(F)F)c2)CC1 ZINC000473816797 888643464 /nfs/dbraw/zinc/64/34/64/888643464.db2.gz IKLLZQJEHDMFFF-UHFFFAOYSA-N 0 3 406.452 4.169 20 0 HIADHN Cc1c(NC(=O)NCc2ccccc2CN2CCC(O)CC2)cccc1C(F)(F)F ZINC000473818898 888648857 /nfs/dbraw/zinc/64/88/57/888648857.db2.gz FEELVYWYZRTBAI-UHFFFAOYSA-N 0 3 421.463 4.292 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)NCCCCCOC3CCCCC3)c2)CC1 ZINC000473823491 888655454 /nfs/dbraw/zinc/65/54/54/888655454.db2.gz WVGYAFUFZJAJSS-UHFFFAOYSA-N 0 3 416.610 4.470 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CCC[C@H]3Cc3ccccc3OC)c2)CC1 ZINC000473828608 888661600 /nfs/dbraw/zinc/66/16/00/888661600.db2.gz XTXNRLNUYWRPHH-QHCPKHFHSA-N 0 3 422.573 4.076 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)Nc3ccc(NC(=O)CC(C)C)cc3)c2)CC1 ZINC000473831728 888667344 /nfs/dbraw/zinc/66/73/44/888667344.db2.gz ULDRUSPMBRLWNM-UHFFFAOYSA-N 0 3 423.561 4.457 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N(Cc3ccco3)Cc3cccnc3)c2)CC1 ZINC000473838424 888678830 /nfs/dbraw/zinc/67/88/30/888678830.db2.gz VQQQLMHAEKBLSN-UHFFFAOYSA-N 0 3 419.529 4.051 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)C2(Cc3ccc(C(F)(F)F)cc3)CC2)CC1 ZINC000473853708 888704082 /nfs/dbraw/zinc/70/40/82/888704082.db2.gz XBHNEQPOYJBBQA-UHFFFAOYSA-N 0 3 412.496 4.034 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@H](C)c1noc(-c2ccccc2)n1)c1ccsc1 ZINC000473873275 888735196 /nfs/dbraw/zinc/73/51/96/888735196.db2.gz CQKWMXMZOMALKP-CRAIPNDOSA-N 0 3 413.547 4.241 20 0 HIADHN C[C@H](NC(=O)NC[C@@H](c1ccccc1)N1CCCC1)c1ccc(Br)cn1 ZINC000473967427 888835512 /nfs/dbraw/zinc/83/55/12/888835512.db2.gz YLULORIHDIVEMF-KXBFYZLASA-N 0 3 417.351 4.041 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N[C@@H]1C[C@H]1c1ccc(OC(F)F)cc1 ZINC000473980047 888844000 /nfs/dbraw/zinc/84/40/00/888844000.db2.gz CSZMOZVQFGJDNL-RCCFBDPRSA-N 0 3 421.513 4.342 20 0 HIADHN O=C(Nc1ccccc1-c1ccccc1)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1CO ZINC000473993276 888853830 /nfs/dbraw/zinc/85/38/30/888853830.db2.gz SDELKPYIRSNAMW-LADGPHEKSA-N 0 3 415.537 4.358 20 0 HIADHN O=C1[C@@H](NCc2cc(-n3ccnc3)cs2)CCN1c1ccc(Cl)cc1Cl ZINC000474007512 888864906 /nfs/dbraw/zinc/86/49/06/888864906.db2.gz JBYALIPWCXHLDV-INIZCTEOSA-N 0 3 407.326 4.136 20 0 HIADHN COc1ccc2nc(CNC(C)(C)COc3ncccc3Br)sc2c1 ZINC000474006868 888865322 /nfs/dbraw/zinc/86/53/22/888865322.db2.gz CGNZSVMKYFSMED-UHFFFAOYSA-N 0 3 422.348 4.410 20 0 HIADHN Cn1cnc2cc(CN[C@@H]3CCCN(c4ccc(Cl)cc4Cl)C3=O)ccc21 ZINC000474008357 888866135 /nfs/dbraw/zinc/86/61/35/888866135.db2.gz IPSIWMAUKBXYCN-MRXNPFEDSA-N 0 3 403.313 4.165 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)N1CCSC[C@H]1c1nccs1 ZINC000474020204 888872963 /nfs/dbraw/zinc/87/29/63/888872963.db2.gz XFAPBQOUAMRURJ-MOPGFXCFSA-N 0 3 418.632 4.099 20 0 HIADHN Cc1cccc(C(NC(=O)NC(C)(C)CCN2CCN(C)CC2)c2cccc(C)c2)c1 ZINC000474052226 888890574 /nfs/dbraw/zinc/89/05/74/888890574.db2.gz JQTSWVXEQOHGTA-UHFFFAOYSA-N 0 3 422.617 4.108 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N[C@@H](CO)c2c(Cl)cccc2Cl)C1 ZINC000474180204 889019243 /nfs/dbraw/zinc/01/92/43/889019243.db2.gz CVIWDFUNNYBILS-ALKREAHSSA-N 0 3 422.356 4.162 20 0 HIADHN Cc1ccc(-c2cc(C(=O)NC3CCN([C@H](C)c4ccncc4)CC3)[nH]n2)cc1C ZINC000474250742 889102837 /nfs/dbraw/zinc/10/28/37/889102837.db2.gz MQJHPSVKTULIAC-GOSISDBHSA-N 0 3 403.530 4.044 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1NC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000474330344 889202203 /nfs/dbraw/zinc/20/22/03/889202203.db2.gz LRIFEQQFVSCVHN-JOCHJYFZSA-N 0 3 403.530 4.227 20 0 HIADHN Cc1nc2ccccc2n1C1CCN(C(=O)NC[C@H](C)N(C)Cc2ccccc2)CC1 ZINC000474342183 889215686 /nfs/dbraw/zinc/21/56/86/889215686.db2.gz SZWKVQZBMHHLIB-IBGZPJMESA-N 0 3 419.573 4.212 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)C/C=C/c3ccc(F)cc3)CC2)c1 ZINC000474348304 889224600 /nfs/dbraw/zinc/22/46/00/889224600.db2.gz GHHQSKQMQLTDCO-FNORWQNLSA-N 0 3 409.549 4.256 20 0 HIADHN Cc1ccc(SC[C@@H](C)NC(=O)N(Cc2ccco2)C2CCN(C)CC2)cc1 ZINC000474355013 889233025 /nfs/dbraw/zinc/23/30/25/889233025.db2.gz SAWFSRDAAPKBFV-GOSISDBHSA-N 0 3 401.576 4.375 20 0 HIADHN COc1ccc2nc(CNCc3ccccc3CN3C[C@H](C)O[C@@H](C)C3)sc2c1 ZINC000474368050 889246113 /nfs/dbraw/zinc/24/61/13/889246113.db2.gz IZXDOVQQMOURTJ-IRXDYDNUSA-N 0 3 411.571 4.204 20 0 HIADHN CCc1onc(-c2ccc(Br)cc2)c1C(=O)NC1CCN(C2CC2)CC1 ZINC000474406362 889272834 /nfs/dbraw/zinc/27/28/34/889272834.db2.gz AIPVUYXZZVNNBK-UHFFFAOYSA-N 0 3 418.335 4.023 20 0 HIADHN CC(C)[C@H](N[C@H]1CCN([C@H](C(=O)OC(C)(C)C)c2ccccc2)C1=O)c1cccnc1 ZINC000474428740 889294900 /nfs/dbraw/zinc/29/49/00/889294900.db2.gz DZZJDNWSFQHIQQ-FKBYEOEOSA-N 0 3 423.557 4.052 20 0 HIADHN COCc1c(Br)cccc1NC(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C ZINC000474431810 889297565 /nfs/dbraw/zinc/29/75/65/889297565.db2.gz LFOIESUNHRGUKS-IFXJQAMLSA-N 0 3 420.351 4.408 20 0 HIADHN O=C(N1CCC(OC2CCCC2)CC1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000504574195 913340255 /nfs/dbraw/zinc/34/02/55/913340255.db2.gz AOMIBTFFUBJFAN-QFIPXVFZSA-N 0 3 424.507 4.391 20 0 HIADHN CCCCn1cc(C(=O)Nc2c(C)cnn2[C@H]2CCN(Cc3ccccc3)C2)c(C)n1 ZINC000474519238 889387416 /nfs/dbraw/zinc/38/74/16/889387416.db2.gz KHNHPOHJDXLPPC-NRFANRHFSA-N 0 3 420.561 4.196 20 0 HIADHN O=C(CC1(CSc2ccccc2)CC1)NCc1ccccc1CN1CCC(O)CC1 ZINC000474549817 889426113 /nfs/dbraw/zinc/42/61/13/889426113.db2.gz YVFPLKOYQYFEAI-UHFFFAOYSA-N 0 3 424.610 4.222 20 0 HIADHN C[C@@H](Sc1nnnn1CCN(C)C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000504585770 913347795 /nfs/dbraw/zinc/34/77/95/913347795.db2.gz PKKOKXSTFGLOPP-SECBINFHSA-N 0 3 413.391 4.126 20 0 HIADHN C[C@H]1CCC[C@H](C)N1CCNC(=O)c1ccc(NC(=O)Nc2ccccc2)s1 ZINC000474611240 889475502 /nfs/dbraw/zinc/47/55/02/889475502.db2.gz FORWYQNKJVPDHJ-HOTGVXAUSA-N 0 3 400.548 4.385 20 0 HIADHN CN(C(=O)Nc1cccc(OCc2cscn2)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000474611432 889477061 /nfs/dbraw/zinc/47/70/61/889477061.db2.gz IHGCAJNZPPZABZ-NRFANRHFSA-N 0 3 422.554 4.460 20 0 HIADHN Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000474617000 889480387 /nfs/dbraw/zinc/48/03/87/889480387.db2.gz UHRGDXAWYKUAGV-JOCHJYFZSA-N 0 3 422.573 4.119 20 0 HIADHN O=C(NCCNCc1ccc(Br)cc1C(F)(F)F)c1ccccc1F ZINC000474620357 889484487 /nfs/dbraw/zinc/48/44/87/889484487.db2.gz NXKYNTUXHUHRNV-UHFFFAOYSA-N 0 3 419.216 4.127 20 0 HIADHN COc1ccc(NC(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)c(C(F)(F)F)c1 ZINC000474740611 889596170 /nfs/dbraw/zinc/59/61/70/889596170.db2.gz YWEBHIVUYBGJIX-INIZCTEOSA-N 0 3 407.436 4.452 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N[C@H]1CCCc2ccc(F)cc21 ZINC000474746633 889602390 /nfs/dbraw/zinc/60/23/90/889602390.db2.gz DOJBNCRSYLIKAK-TVPLGVNVSA-N 0 3 413.459 4.308 20 0 HIADHN COC(=O)C[C@@H]1CC[C@H](N[C@H](c2cccc(OC)c2)c2cc(F)ccc2OC)[C@@H]1C ZINC000474808505 889661872 /nfs/dbraw/zinc/66/18/72/889661872.db2.gz JZAHOOCTVKQOGW-FFXYLKCDSA-N 0 3 415.505 4.500 20 0 HIADHN COc1ccc([C@@H](NCCCc2ccc(C)nc2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000474811164 889664028 /nfs/dbraw/zinc/66/40/28/889664028.db2.gz NHHFLOCJWWBCJX-XMMPIXPASA-N 0 3 424.566 4.114 20 0 HIADHN CCc1ccccc1O[C@@H](C(=O)NC1CCN(CCOC(C)C)CC1)c1ccccc1 ZINC000474872529 889726430 /nfs/dbraw/zinc/72/64/30/889726430.db2.gz JUTNJBZBXABHHS-RUZDIDTESA-N 0 3 424.585 4.375 20 0 HIADHN CC(C)C[C@H]([NH2+][C@@H](C)C1CCC(C(F)(F)F)CC1)c1nc(-c2nc[n-]n2)no1 ZINC000474884503 889740680 /nfs/dbraw/zinc/74/06/80/889740680.db2.gz AEDAXWPIQHFZPT-ABXWRUBCSA-N 0 3 400.449 4.289 20 0 HIADHN C[C@@H](Sc1ccccn1)C(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1 ZINC000474928944 889787522 /nfs/dbraw/zinc/78/75/22/889787522.db2.gz NGJXQNGPOXUWPO-OAHLLOKOSA-N 0 3 411.493 4.171 20 0 HIADHN Cc1cc(F)c(Br)cc1NC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000474949008 889805095 /nfs/dbraw/zinc/80/50/95/889805095.db2.gz ZIPHNCJBHMOYOZ-WMZOPIPTSA-N 0 3 406.299 4.464 20 0 HIADHN CCN(CC)C(=O)c1ccc(NC(=O)N(CC)[C@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000475003660 889855753 /nfs/dbraw/zinc/85/57/53/889855753.db2.gz XBDNJMDOSVKCAF-QHCPKHFHSA-N 0 3 422.573 4.297 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)C/C=C\c2ccc(F)cc2)cc1)[C@H]1CCCN(C)C1 ZINC000475008233 889860900 /nfs/dbraw/zinc/86/09/00/889860900.db2.gz KQSJMBARSTUODJ-VYUBKGOISA-N 0 3 409.505 4.034 20 0 HIADHN CCN(C(=O)Nc1cccc(C(=O)N2CCCC2)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475010021 889863902 /nfs/dbraw/zinc/86/39/02/889863902.db2.gz UMJKEBSPQQLUIO-HSZRJFAPSA-N 0 3 420.557 4.051 20 0 HIADHN CN(C(=O)N[C@@H](c1ccccc1)c1ccccn1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475009979 889864183 /nfs/dbraw/zinc/86/41/83/889864183.db2.gz RGAFULAEPMIAOF-VWNXMTODSA-N 0 3 400.526 4.087 20 0 HIADHN CCN(C(=O)Nc1cc(C)n(-c2ccccc2)n1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475011764 889865277 /nfs/dbraw/zinc/86/52/77/889865277.db2.gz BCLOYVLTJMXXBW-QFIPXVFZSA-N 0 3 403.530 4.309 20 0 HIADHN CN(C(=O)NCc1ccc(Br)c(F)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475103850 889953006 /nfs/dbraw/zinc/95/30/06/889953006.db2.gz ZXLPBZAIRYSTHQ-KRWDZBQOSA-N 0 3 420.326 4.004 20 0 HIADHN CN(C(=O)NC[C@@H]1CCCO[C@H]1c1ccccc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475127329 889988139 /nfs/dbraw/zinc/98/81/39/889988139.db2.gz BFDQUHKGMZLXJB-HJOGWXRNSA-N 0 3 407.558 4.070 20 0 HIADHN CCN(C(=O)N[C@@H](C)c1noc(-c2ccccc2)n1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475161334 890025002 /nfs/dbraw/zinc/02/50/02/890025002.db2.gz HWFKIQNJCGZCKP-GHTZIAJQSA-N 0 3 419.529 4.104 20 0 HIADHN CCN(C(=O)N[C@H](c1ccccc1)[C@H]1CCOC1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475172773 890039727 /nfs/dbraw/zinc/03/97/27/890039727.db2.gz GFCADHZGTVAJJI-RBZQAINGSA-N 0 3 407.558 4.070 20 0 HIADHN CCN(C(=O)NCCc1ccc2ccccc2n1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475177655 890047700 /nfs/dbraw/zinc/04/77/00/890047700.db2.gz OTDPTFSYOFTGEX-QHCPKHFHSA-N 0 3 402.542 4.083 20 0 HIADHN CCN(C(=O)NCc1ccc(OC(C)(C)C)nc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475178601 890048695 /nfs/dbraw/zinc/04/86/95/890048695.db2.gz RKMHCFWQJXQYMH-NRFANRHFSA-N 0 3 410.562 4.065 20 0 HIADHN CC(C)[C@@](C)(NCc1cnc(-c2cnn(C)c2)nc1)c1ccc(Br)cc1 ZINC000475216570 890086266 /nfs/dbraw/zinc/08/62/66/890086266.db2.gz OUWVLJWZATYOFF-HXUWFJFHSA-N 0 3 414.351 4.301 20 0 HIADHN CCN(C(=O)Nc1csc(-c2ccccn2)n1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475221635 890090837 /nfs/dbraw/zinc/09/08/37/890090837.db2.gz XBQVSEKHIIWGBK-GOSISDBHSA-N 0 3 407.543 4.333 20 0 HIADHN C[C@@H](Oc1cccnc1NC(=O)N(CCN(C)C)Cc1ccccn1)c1ccccc1 ZINC000475266955 890161310 /nfs/dbraw/zinc/16/13/10/890161310.db2.gz GRSYSQAZVKXFAD-LJQANCHMSA-N 0 3 419.529 4.212 20 0 HIADHN COc1ccc([C@H](CNC(=O)[C@H](C)c2cn(C)c3ccccc23)N2CCCC2)cc1 ZINC000475285392 890185538 /nfs/dbraw/zinc/18/55/38/890185538.db2.gz GTTSKPNLGXQEOI-KOSHJBKYSA-N 0 3 405.542 4.244 20 0 HIADHN C[C@H](NC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1)c1cccc(N2CCCC2)c1 ZINC000475289863 890190382 /nfs/dbraw/zinc/19/03/82/890190382.db2.gz CXLXGZGGNKMBLR-GBXCKJPGSA-N 0 3 406.574 4.264 20 0 HIADHN CC(=O)Nc1cc(C(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)cc(C(F)(F)F)c1 ZINC000475307438 890218752 /nfs/dbraw/zinc/21/87/52/890218752.db2.gz CSABGRDNSLXMEO-FQEVSTJZSA-N 0 3 419.447 4.010 20 0 HIADHN CO[C@@H]1CCC[C@@H](CC(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)C1 ZINC000475312592 890226795 /nfs/dbraw/zinc/22/67/95/890226795.db2.gz BYHGABPYQCKCCU-IEBWSBKVSA-N 0 3 400.485 4.191 20 0 HIADHN CCOc1c(Cl)cc(C(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)cc1OC ZINC000475322795 890241733 /nfs/dbraw/zinc/24/17/33/890241733.db2.gz SIKWBLZTGUGMLG-GOSISDBHSA-N 0 3 402.922 4.094 20 0 HIADHN C[C@H](CCN1CCCN(c2nnc(C(F)(F)F)s2)CC1)OCc1ccccc1 ZINC000475323561 890243883 /nfs/dbraw/zinc/24/38/83/890243883.db2.gz FVDSVVQGVBTFHK-OAHLLOKOSA-N 0 3 414.497 4.064 20 0 HIADHN C[C@@H]1C(=O)CC[C@H]1CC(=O)N1CCC(N(C)Cc2cccc(C(F)(F)F)c2)CC1 ZINC000475329382 890248485 /nfs/dbraw/zinc/24/84/85/890248485.db2.gz UDALWMNJPUOSQL-RDJZCZTQSA-N 0 3 410.480 4.134 20 0 HIADHN CCOc1c(Br)cc(CNCc2ncccc2O)cc1Br ZINC000475343449 890265895 /nfs/dbraw/zinc/26/58/95/890265895.db2.gz SQOSCYJMBHZTGL-UHFFFAOYSA-N 0 3 416.113 4.001 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)C(C)(C)c3cccc(Cl)c3F)CC2)C[C@@H](C)O1 ZINC000475344912 890267921 /nfs/dbraw/zinc/26/79/21/890267921.db2.gz YHUROLFKEIPOSM-HZPDHXFCSA-N 0 3 410.961 4.105 20 0 HIADHN COC(=O)[C@@H]1CCN(Cc2cn(Cc3ccccc3)nc2-c2ccccc2)C[C@H]1C ZINC000475370544 890301241 /nfs/dbraw/zinc/30/12/41/890301241.db2.gz NTDWOCRAJDTXBA-AUSIDOKSSA-N 0 3 403.526 4.229 20 0 HIADHN COC(=O)[C@H]1CCN(Cc2cccc(NC(=O)c3ccc(Cl)cc3)c2)C[C@@H]1C ZINC000475376147 890306004 /nfs/dbraw/zinc/30/60/04/890306004.db2.gz WBYXZOVLLJCCPW-YWZLYKJASA-N 0 3 400.906 4.223 20 0 HIADHN COc1ccc(CN(CCc2ccccn2)Cc2cc3c(c(OC)c2)OCO3)cc1 ZINC000475560664 890488149 /nfs/dbraw/zinc/48/81/49/890488149.db2.gz OJKLYLZJSBCCKU-UHFFFAOYSA-N 0 3 406.482 4.072 20 0 HIADHN C[C@H](CC(=O)Nc1ccccc1)N[C@@H](CO)c1ccc(Cl)cc1C(F)(F)F ZINC000475638461 890579577 /nfs/dbraw/zinc/57/95/77/890579577.db2.gz PECYSAVIIMIIPJ-PXAZEXFGSA-N 0 3 400.828 4.399 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)Nc2cccc(COCc3ccco3)c2)CC1 ZINC000475644477 890587182 /nfs/dbraw/zinc/58/71/82/890587182.db2.gz LIJAXSGYSRVAAW-UHFFFAOYSA-N 0 3 415.534 4.007 20 0 HIADHN Cc1cc(NC(=O)NC2CCN(CCOC(C)C)CC2)ccc1Oc1cccnc1 ZINC000475647235 890589605 /nfs/dbraw/zinc/58/96/05/890589605.db2.gz LKUHHUZVBANPAN-UHFFFAOYSA-N 0 3 412.534 4.193 20 0 HIADHN CCN(C(=O)c1ccc(OCCCOC)cc1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000475656978 890602593 /nfs/dbraw/zinc/60/25/93/890602593.db2.gz RRKXBGPWUOOPOF-OFNKIYASSA-N 0 3 410.558 4.400 20 0 HIADHN CCc1nnc(-c2ccc(NC(=O)N(C)[C@H]3CCCN(Cc4ccccc4)C3)cc2)o1 ZINC000475683424 890625617 /nfs/dbraw/zinc/62/56/17/890625617.db2.gz CKRKJEJUJPZVIU-NRFANRHFSA-N 0 3 419.529 4.427 20 0 HIADHN C[C@@H](c1ccc([S@](C)=O)cc1)N(C)CCc1nc(-c2cccc(Cl)c2)no1 ZINC000475725742 890663456 /nfs/dbraw/zinc/66/34/56/890663456.db2.gz DBBYACQSILGDSO-PWFNWSNSSA-N 0 3 403.935 4.363 20 0 HIADHN Cc1cccn2c(=O)cc(CN(Cc3cccc(Br)c3)CC3CC3)nc12 ZINC000475738506 890681057 /nfs/dbraw/zinc/68/10/57/890681057.db2.gz QRFBRICFOWEHCZ-UHFFFAOYSA-N 0 3 412.331 4.178 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1oc(CC(C)C)nc1C ZINC000475913264 890841139 /nfs/dbraw/zinc/84/11/39/890841139.db2.gz VYWWTFVPGGQKAQ-FQEVSTJZSA-N 0 3 421.545 4.386 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)N[C@@H](C)c2ccc(-c3cccnc3)cc2)o1 ZINC000475933411 890857776 /nfs/dbraw/zinc/85/77/76/890857776.db2.gz RWUKIQJJCAFMRQ-IBGZPJMESA-N 0 3 406.530 4.484 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)NCc2ccc(Oc3ccccc3)cc2)CC1 ZINC000476029507 890962368 /nfs/dbraw/zinc/96/23/68/890962368.db2.gz FTFVLUXZJAHIBE-UHFFFAOYSA-N 0 3 411.546 4.168 20 0 HIADHN CC[C@H](NC(=O)N[C@H](CN1CCc2ccccc2C1)C(C)(C)C)c1nccs1 ZINC000476037219 890968808 /nfs/dbraw/zinc/96/88/08/890968808.db2.gz YXGQWBYRJMOVLT-RBUKOAKNSA-N 0 3 400.592 4.366 20 0 HIADHN Cc1csc([C@@H](C)NC(=O)N[C@@H](CN2CCc3ccccc3C2)C(C)(C)C)n1 ZINC000476054685 890983588 /nfs/dbraw/zinc/98/35/88/890983588.db2.gz KHLXBFFTEOIDGQ-APWZRJJASA-N 0 3 400.592 4.285 20 0 HIADHN CC(C)Cc1ccc([C@H](CNC(=O)Nc2cnn(CC(F)(F)F)c2)N(C)C)cc1 ZINC000476149834 891075047 /nfs/dbraw/zinc/07/50/47/891075047.db2.gz KUZBDQSVFQNZBL-SFHVURJKSA-N 0 3 411.472 4.068 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)Nc1cccc2c1CN(CC(F)(F)F)C2 ZINC000476369363 891280210 /nfs/dbraw/zinc/28/02/10/891280210.db2.gz YJTZUPBWSSJGBZ-UHFFFAOYSA-N 0 3 420.479 4.160 20 0 HIADHN CN(C)CCN(Cc1cccc(O)c1)C(=O)c1ccc2nc(-c3ccccc3)oc2c1 ZINC000476374720 891289277 /nfs/dbraw/zinc/28/92/77/891289277.db2.gz QEWBUPHSYVIRKS-UHFFFAOYSA-N 0 3 415.493 4.404 20 0 HIADHN CC[C@@H]1CCCCN1CCNC(=O)c1cn(C2CC2)c2cc(Cl)c(F)cc2c1=O ZINC000476425237 891337189 /nfs/dbraw/zinc/33/71/89/891337189.db2.gz UMMZMHGYERKJBC-CQSZACIVSA-N 0 3 419.928 4.123 20 0 HIADHN CCc1oc2ccccc2c1CN(C)C(=O)NC1CCN(CCOC(C)C)CC1 ZINC000476445747 891357820 /nfs/dbraw/zinc/35/78/20/891357820.db2.gz CIDPEXKPWOTLHQ-UHFFFAOYSA-N 0 3 401.551 4.026 20 0 HIADHN CCc1ccc([C@H]2CCCCCN2C(=O)NC2CCN(CCOC(C)C)CC2)o1 ZINC000476453252 891364345 /nfs/dbraw/zinc/36/43/45/891364345.db2.gz SPEUFMWUVZAVOQ-OAQYLSRUSA-N 0 3 405.583 4.358 20 0 HIADHN Cc1ccc([C@H]2CCC[C@H]2N(C)C(=O)NC2CCN(CCOC(C)C)CC2)cc1 ZINC000476456253 891367521 /nfs/dbraw/zinc/36/75/21/891367521.db2.gz YWDKEHQZXFVELN-DHIUTWEWSA-N 0 3 401.595 4.162 20 0 HIADHN COc1cccc([C@@H](CNC(=O)NCc2nc(C(C)C)c(C)s2)N2CCCC2)c1 ZINC000476623872 891559039 /nfs/dbraw/zinc/55/90/39/891559039.db2.gz ICCDZGPCAATQLN-LJQANCHMSA-N 0 3 416.591 4.220 20 0 HIADHN CN(C(=O)NCC1(c2cccc(C(F)(F)F)c2)CCCC1)[C@H]1CCN(C2CC2)C1 ZINC000476709042 891669030 /nfs/dbraw/zinc/66/90/30/891669030.db2.gz MTCSBHNARNQRJV-IBGZPJMESA-N 0 3 409.496 4.395 20 0 HIADHN COc1ccc(OC)c([C@@H]2CCCN2C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000504883842 913614425 /nfs/dbraw/zinc/61/44/25/913614425.db2.gz WUVLWTUQAMPIKN-REWPJTCUSA-N 0 3 423.557 4.215 20 0 HIADHN O[C@H](COc1ccc(Cl)cc1Cl)CN1CCC(OCc2ccccc2)CC1 ZINC000477147311 892072537 /nfs/dbraw/zinc/07/25/37/892072537.db2.gz DQRRLZCAURSSFF-SFHVURJKSA-N 0 3 410.341 4.414 20 0 HIADHN O[C@@H](COc1ccc(Cl)cc1Cl)CN1CCC(OCc2ccccc2)CC1 ZINC000477147310 892073387 /nfs/dbraw/zinc/07/33/87/892073387.db2.gz DQRRLZCAURSSFF-GOSISDBHSA-N 0 3 410.341 4.414 20 0 HIADHN CCc1onc(-c2ccccc2)c1C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000477161813 892083303 /nfs/dbraw/zinc/08/33/03/892083303.db2.gz JEQLJBYWPDDJCX-UHFFFAOYSA-N 0 3 421.463 4.439 20 0 HIADHN Cc1nc([C@H](C)N2CCC[C@H](CN3CCOCC3)C2)oc1-c1ccc(Cl)cc1 ZINC000477290800 892251522 /nfs/dbraw/zinc/25/15/22/892251522.db2.gz JEQWIIRLGVFYMW-ZWKOTPCHSA-N 0 3 403.954 4.409 20 0 HIADHN CCn1ncc2ccc(NC(=O)NC[C@H](c3cccc(OC)c3)N3CCCC3)cc21 ZINC000477401575 892355672 /nfs/dbraw/zinc/35/56/72/892355672.db2.gz ABKWEEWVALHIRL-JOCHJYFZSA-N 0 3 407.518 4.023 20 0 HIADHN O=C(Nc1cccc(OC[C@@H]2CCCO2)c1)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000504925914 913662625 /nfs/dbraw/zinc/66/26/25/913662625.db2.gz SQLNTOZQEVBDMG-GGAORHGYSA-N 0 3 409.530 4.031 20 0 HIADHN CCN(C(=O)c1ccncc1Br)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000477467929 892443128 /nfs/dbraw/zinc/44/31/28/892443128.db2.gz ANTNNJSJODLZCK-RDJZCZTQSA-N 0 3 402.336 4.142 20 0 HIADHN CN(C)Cc1ccc(S(=O)(=O)N[C@H]2CCOc3c(-c4ccccc4)cccc32)cc1 ZINC000477512052 892524898 /nfs/dbraw/zinc/52/48/98/892524898.db2.gz BUTXJQNNMTZXOK-QHCPKHFHSA-N 0 3 422.550 4.217 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)NCc1ccc(F)cc1C(F)(F)F)c1ccco1 ZINC000477608069 892693112 /nfs/dbraw/zinc/69/31/12/892693112.db2.gz BBFRYVTZVACTHU-BLLLJJGKSA-N 0 3 401.404 4.366 20 0 HIADHN O=C(CNC1(c2ccccc2)CCCCC1)NCC1(c2ccccc2)CCOCC1 ZINC000477631498 892748997 /nfs/dbraw/zinc/74/89/97/892748997.db2.gz BLLIUEQZMDXZJB-UHFFFAOYSA-N 0 3 406.570 4.300 20 0 HIADHN CCc1cccc2c(CCNC(=O)N(CCN(C)C)Cc3ccc(F)cc3)c[nH]c21 ZINC000477643811 892767027 /nfs/dbraw/zinc/76/70/27/892767027.db2.gz ITPLCVIGTKBLRC-UHFFFAOYSA-N 0 3 410.537 4.185 20 0 HIADHN CS(=O)(=O)c1ccc(Cl)c(NC(=O)CNC2(c3ccccc3)CCCCC2)c1 ZINC000477643908 892767843 /nfs/dbraw/zinc/76/78/43/892767843.db2.gz LIIXUBNJCJJNGD-UHFFFAOYSA-N 0 3 420.962 4.131 20 0 HIADHN CCN(C[C@H]1CCN([C@H](C)C(=O)N(Cc2ccccc2)C(C)C)C1)CC(F)(F)F ZINC000477723496 892826993 /nfs/dbraw/zinc/82/69/93/892826993.db2.gz JQTQJMYWBGEGLJ-UYAOXDASSA-N 0 3 413.528 4.018 20 0 HIADHN CCN(C[C@@H]1CCN([C@H](C)C(=O)N2CCC[C@H]2c2cccs2)C1)CC(F)(F)F ZINC000477724236 892827180 /nfs/dbraw/zinc/82/71/80/892827180.db2.gz LOLDCQMLKIMKRQ-IKGGRYGDSA-N 0 3 417.541 4.006 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1c[nH]nc1-c1cccc(Cl)c1 ZINC000477725953 892828035 /nfs/dbraw/zinc/82/80/35/892828035.db2.gz OKBPUZOFERRXEP-UHFFFAOYSA-N 0 3 424.932 4.187 20 0 HIADHN Cc1nc(CC(C)C)c(C(=O)Nc2cccc(CN3CCC(CO)CC3)c2)s1 ZINC000477735443 892833605 /nfs/dbraw/zinc/83/36/05/892833605.db2.gz CZJIBLCOUAAQSR-UHFFFAOYSA-N 0 3 401.576 4.107 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1cc(F)cc(C(F)(F)F)c1 ZINC000477741554 892836932 /nfs/dbraw/zinc/83/69/32/892836932.db2.gz ORSKQFRVMACQAK-UHFFFAOYSA-N 0 3 410.411 4.301 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)[C@H]1C[C@@]12CCCc1ccccc12 ZINC000477751902 892844129 /nfs/dbraw/zinc/84/41/29/892844129.db2.gz UICIKTBIHQJNHC-AOYPEHQESA-N 0 3 404.554 4.124 20 0 HIADHN Cc1ccc(COc2ccc(C[C@H](C)NC(=O)N(C)[C@@H]3CCN(C4CC4)C3)cc2)cc1 ZINC000477764677 892852940 /nfs/dbraw/zinc/85/29/40/892852940.db2.gz SYUKXVDSEVMUST-GBXCKJPGSA-N 0 3 421.585 4.383 20 0 HIADHN CN(Cc1nc(-c2ccccc2)c[nH]1)C(=O)N[C@H](CN1CCCC1)c1ccccc1 ZINC000477838906 892898266 /nfs/dbraw/zinc/89/82/66/892898266.db2.gz VPNOMXFJLIDTTO-JOCHJYFZSA-N 0 3 403.530 4.055 20 0 HIADHN C[C@@H](NC(=O)N[C@@H](C)c1nc2ccccc2n1C(F)F)[C@@H](c1ccccc1)N(C)C ZINC000477877580 892937669 /nfs/dbraw/zinc/93/76/69/892937669.db2.gz KQXMHFMPDNOMRK-VCBZYWHSSA-N 0 3 415.488 4.483 20 0 HIADHN CCOC[C@H]1CCN(C(=O)NC[C@@H](c2ccc(C(F)(F)F)cc2)N(CC)CC)C1 ZINC000477922652 893009224 /nfs/dbraw/zinc/00/92/24/893009224.db2.gz ZKOAFJQZXSPYSC-LPHOPBHVSA-N 0 3 415.500 4.156 20 0 HIADHN COc1cc(F)c([C@@H](C)NCCCOc2ccc(C(F)(F)F)cn2)cc1OC ZINC000477941322 893030845 /nfs/dbraw/zinc/03/08/45/893030845.db2.gz ICRDDFIJAKTGRZ-GFCCVEGCSA-N 0 3 402.388 4.376 20 0 HIADHN CCCN(C(=O)Cc1c(C)nn(C(F)F)c1C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000505005992 913748512 /nfs/dbraw/zinc/74/85/12/913748512.db2.gz PJWPVIORPKBZLN-HXUWFJFHSA-N 0 3 418.532 4.341 20 0 HIADHN CC(C)CCn1ccc(NC(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)n1 ZINC000478144225 893314497 /nfs/dbraw/zinc/31/44/97/893314497.db2.gz KMEFZRSJLAOZNS-HXUWFJFHSA-N 0 3 401.555 4.141 20 0 HIADHN C[C@H](CNC(=O)C(=O)Nc1ccc2c(c1)oc1ccccc12)N(C)Cc1ccccc1 ZINC000478277828 893478580 /nfs/dbraw/zinc/47/85/80/893478580.db2.gz QCZHHBUXHPHOGH-QGZVFWFLSA-N 0 3 415.493 4.161 20 0 HIADHN CC(C)c1ccc(-c2noc(CCC(=O)N[C@@H]3CN(C)C[C@H]3c3ccccc3)n2)cc1 ZINC000478396121 893677484 /nfs/dbraw/zinc/67/74/84/893677484.db2.gz COGJPKCESILFIR-FCHUYYIVSA-N 0 3 418.541 4.007 20 0 HIADHN COc1ccccc1C[C@H](NC(=O)N(Cc1ccco1)C1CCN(C)CC1)C(C)C ZINC000478404602 893689355 /nfs/dbraw/zinc/68/93/55/893689355.db2.gz YHPVNRLPDKBRIK-QFIPXVFZSA-N 0 3 413.562 4.161 20 0 HIADHN CCCN(CCN(C)C)C(=O)c1csc(-c2cc(Br)cs2)n1 ZINC000478516465 893823770 /nfs/dbraw/zinc/82/37/70/893823770.db2.gz XYWVFPYPGNCHEB-UHFFFAOYSA-N 0 3 402.383 4.048 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)N1CCOC2(C1)CCCCCC2 ZINC000478665687 893913002 /nfs/dbraw/zinc/91/30/02/893913002.db2.gz KNZWSNRHWLSBQW-UHFFFAOYSA-N 0 3 417.619 4.235 20 0 HIADHN C[C@H](NC(=O)NCc1ccnc(OCc2ccccc2)c1)[C@@H](c1ccccc1)N(C)C ZINC000478770994 894046387 /nfs/dbraw/zinc/04/63/87/894046387.db2.gz OKUZBNHSTXVBNQ-CYFREDJKSA-N 0 3 418.541 4.151 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)N[C@@H](C)c2cccc(OC(C)C)c2)c1 ZINC000478793212 894068182 /nfs/dbraw/zinc/06/81/82/894068182.db2.gz FLZIAMSUQIMIMY-IBGZPJMESA-N 0 3 413.562 4.317 20 0 HIADHN CC(C)[C@H](CN[C@@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl)c1cccnc1 ZINC000479070176 894334213 /nfs/dbraw/zinc/33/42/13/894334213.db2.gz ZSUQDBSHGYZALL-WFASDCNBSA-N 0 3 416.374 4.126 20 0 HIADHN CC(C)[C@@H](CN[C@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl)c1cccnc1 ZINC000479070174 894334370 /nfs/dbraw/zinc/33/43/70/894334370.db2.gz ZSUQDBSHGYZALL-IUODEOHRSA-N 0 3 416.374 4.126 20 0 HIADHN CC[NH+](CC)Cc1ccc([N-]S(=O)(=O)c2ccc(CC(F)(F)F)cc2)cc1 ZINC000479113036 894381124 /nfs/dbraw/zinc/38/11/24/894381124.db2.gz BVBSIGCHDFYATR-UHFFFAOYSA-N 0 3 400.466 4.434 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)Nc1cccc2c1CN(c1nccs1)C2 ZINC000479126843 894394225 /nfs/dbraw/zinc/39/42/25/894394225.db2.gz DLYJFKPVSLFVSI-UHFFFAOYSA-N 0 3 413.591 4.393 20 0 HIADHN CC[C@@H](C)n1nc(C(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)cc1C ZINC000479168933 894437011 /nfs/dbraw/zinc/43/70/11/894437011.db2.gz REQKRJFKNWZHRV-WIYYLYMNSA-N 0 3 420.561 4.367 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)N[C@H]2C[C@H]2c2c(F)cccc2Cl)c1 ZINC000479316963 894605194 /nfs/dbraw/zinc/60/51/94/894605194.db2.gz LXSCHYFBAUHMJR-XLIONFOSSA-N 0 3 419.928 4.117 20 0 HIADHN C[C@H](CCc1ccccc1)N[C@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479333294 894625872 /nfs/dbraw/zinc/62/58/72/894625872.db2.gz WMGRTRZEAHZNQO-CHWSQXEVSA-N 0 3 401.359 4.313 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)N[C@@H](C)c2ncc(-c3ccccc3)o2)c1 ZINC000479333666 894628198 /nfs/dbraw/zinc/62/81/98/894628198.db2.gz WYYZQZVTBHHHOR-SFHVURJKSA-N 0 3 422.529 4.185 20 0 HIADHN COCCOc1ccc([C@H](C)N[C@H]2CCc3cc(OC)c(OC)cc32)cc1OC ZINC000479344769 894638924 /nfs/dbraw/zinc/63/89/24/894638924.db2.gz DBSMFKCRVQILMZ-KXBFYZLASA-N 0 3 401.503 4.076 20 0 HIADHN Cn1cc2c(n1)CCC[C@@H]2NCc1ccc(NC(=O)CCCOc2ccccc2)cc1 ZINC000479357734 894657012 /nfs/dbraw/zinc/65/70/12/894657012.db2.gz IZXSNNNMSKIJND-QHCPKHFHSA-N 0 3 418.541 4.385 20 0 HIADHN CC[C@H]1CCCN(C(C)(C)CNCc2cccc(Cl)c2S(=O)(=O)CC)C1 ZINC000479387670 894689345 /nfs/dbraw/zinc/68/93/45/894689345.db2.gz RMFJVFYOERBLBD-INIZCTEOSA-N 0 3 401.016 4.124 20 0 HIADHN O[C@@H](COC(c1ccccc1)c1ccccc1)CN1CCC[C@@H](c2nccs2)C1 ZINC000505233467 913895621 /nfs/dbraw/zinc/89/56/21/913895621.db2.gz NYOWFFHTPPKCFL-FGZHOGPDSA-N 0 3 408.567 4.490 20 0 HIADHN O[C@H](COC(c1ccccc1)c1ccccc1)CN1CCC[C@@H](c2nccs2)C1 ZINC000505233469 913895802 /nfs/dbraw/zinc/89/58/02/913895802.db2.gz NYOWFFHTPPKCFL-YADHBBJMSA-N 0 3 408.567 4.490 20 0 HIADHN COC(=O)c1csc(-c2cccc(CN[C@@H]3CCc4cc(OC)c(OC)cc43)c2)n1 ZINC000479439570 894755415 /nfs/dbraw/zinc/75/54/15/894755415.db2.gz SPUHHOJBEIDNOW-GOSISDBHSA-N 0 3 424.522 4.391 20 0 HIADHN C[C@@H](CCCC(F)(F)F)N[C@@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479459510 894782138 /nfs/dbraw/zinc/78/21/38/894782138.db2.gz WQEWVJOYLBMMMX-IUCAKERBSA-N 0 3 407.285 4.413 20 0 HIADHN Fc1ccc([C@H](NCCCCn2cc(Br)cn2)c2ccccc2)nc1 ZINC000479466734 894789969 /nfs/dbraw/zinc/78/99/69/894789969.db2.gz SPJTWTQJEPKVPV-LJQANCHMSA-N 0 3 403.299 4.339 20 0 HIADHN COc1ccc([C@@H](NC[C@H]2CCCN(C(C)=O)C2)c2ccccc2Cl)cc1OC ZINC000479468707 894792500 /nfs/dbraw/zinc/79/25/00/894792500.db2.gz CNZNOOACEYAPGN-UZUQRXQVSA-N 0 3 416.949 4.295 20 0 HIADHN COc1ccc(CN2CCCN(Cc3ccccc3OCc3cccnc3)CC2)cc1 ZINC000505254641 913908871 /nfs/dbraw/zinc/90/88/71/913908871.db2.gz OFTWOOKKPFEOEY-UHFFFAOYSA-N 0 3 417.553 4.377 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)Nc2cccc(-c3cc[nH]n3)c2)N(C)C)cc1 ZINC000479544095 894845703 /nfs/dbraw/zinc/84/57/03/894845703.db2.gz KDJNJEBQIFZBNW-QFIPXVFZSA-N 0 3 407.518 4.288 20 0 HIADHN O=S1(=O)CCCN1c1ccc(CNCc2ccc(-c3ccccc3)cc2)cc1F ZINC000479585214 894872173 /nfs/dbraw/zinc/87/21/73/894872173.db2.gz CRHPZPVKYPMAGV-UHFFFAOYSA-N 0 3 410.514 4.322 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)NC[C@@H]2CCCC[C@H]2C(F)(F)F)c1 ZINC000479708832 895004484 /nfs/dbraw/zinc/00/44/84/895004484.db2.gz XBMDXLSPQNEZCZ-PKOBYXMFSA-N 0 3 415.500 4.137 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)NC[C@H]2CCCC[C@@H]2C(F)(F)F)c1 ZINC000479708830 895004890 /nfs/dbraw/zinc/00/48/90/895004890.db2.gz XBMDXLSPQNEZCZ-MJGOQNOKSA-N 0 3 415.500 4.137 20 0 HIADHN Cc1sc2ncnc(Sc3ccccc3C(=O)N[C@H]3CCN(C4CC4)C3)c2c1C ZINC000479731974 895031788 /nfs/dbraw/zinc/03/17/88/895031788.db2.gz WVDDEYSCDMZDBH-HNNXBMFYSA-N 0 3 424.595 4.426 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)NCCc1ccc(-n2nc(C)cc2C)cc1)c1ccco1 ZINC000479758365 895059161 /nfs/dbraw/zinc/05/91/61/895059161.db2.gz LBLURZKCBOBRGO-VGSWGCGISA-N 0 3 423.561 4.053 20 0 HIADHN CCN(C(=O)c1cc(OCC(F)F)ccn1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000479839536 895167837 /nfs/dbraw/zinc/16/78/37/895167837.db2.gz OVTZCZOPTAAHMS-SJLPKXTDSA-N 0 3 403.473 4.023 20 0 HIADHN CCN(C(=O)c1cc(OCC(F)F)ccn1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000479839538 895168511 /nfs/dbraw/zinc/16/85/11/895168511.db2.gz OVTZCZOPTAAHMS-WMZOPIPTSA-N 0 3 403.473 4.023 20 0 HIADHN COc1cc(OC)c([C@H](C)NC[C@H](c2cccs2)N2CCOCC2)cc1Cl ZINC000479849176 895181550 /nfs/dbraw/zinc/18/15/50/895181550.db2.gz HJMHCBQDLVAGBB-WMLDXEAASA-N 0 3 410.967 4.143 20 0 HIADHN C[C@@H](NC[C@H](c1cccs1)N1CCOCC1)c1ccc(F)cc1Br ZINC000479851049 895184854 /nfs/dbraw/zinc/18/48/54/895184854.db2.gz NAWSGZLWXOJXIW-CXAGYDPISA-N 0 3 413.356 4.374 20 0 HIADHN CS(=O)(=O)CCCCCNCc1csc(-c2ccc(C(F)(F)F)cc2)n1 ZINC000479863729 895201966 /nfs/dbraw/zinc/20/19/66/895201966.db2.gz MYAOZMBOVPEQJW-UHFFFAOYSA-N 0 3 406.495 4.133 20 0 HIADHN Cc1c([C@@H](C)NCc2ccccc2CN2CCOCC2)cnn1-c1cc(C)ccc1C ZINC000479871302 895211798 /nfs/dbraw/zinc/21/17/98/895211798.db2.gz FBKSVORULSKYHC-OAQYLSRUSA-N 0 3 418.585 4.481 20 0 HIADHN Cc1c([C@H](C)NCc2ccccc2CN2CCOCC2)cnn1-c1cc(C)ccc1C ZINC000479871301 895212384 /nfs/dbraw/zinc/21/23/84/895212384.db2.gz FBKSVORULSKYHC-NRFANRHFSA-N 0 3 418.585 4.481 20 0 HIADHN COc1ccccc1[C@H](CN[C@@H](C)c1cc(OC)c(OC)cc1F)N1CCCC1 ZINC000479875485 895217671 /nfs/dbraw/zinc/21/76/71/895217671.db2.gz QTLRZSFTAVGIDG-JXFKEZNVSA-N 0 3 402.510 4.339 20 0 HIADHN FC(F)(F)Oc1ccc2c(c1)[C@@H](NCc1ccccc1CN1CCOCC1)CC2 ZINC000479898040 895244807 /nfs/dbraw/zinc/24/48/07/895244807.db2.gz NZTXOEYVWLTIFX-NRFANRHFSA-N 0 3 406.448 4.195 20 0 HIADHN CC[C@H](C)n1ncc(C(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)c1C ZINC000479901556 895248495 /nfs/dbraw/zinc/24/84/95/895248495.db2.gz MGQIOLUBYGYUGT-HNNXBMFYSA-N 0 3 410.484 4.385 20 0 HIADHN CC(C)COC[C@H](NC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1)c1ccco1 ZINC000505292645 913950373 /nfs/dbraw/zinc/95/03/73/913950373.db2.gz XSGLLHSVSBHLAS-CTNGQTDRSA-N 0 3 402.510 4.161 20 0 HIADHN COc1cc(OC2CC2)ccc1C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000479942793 895295915 /nfs/dbraw/zinc/29/59/15/895295915.db2.gz UMUWLXDUEJIVLH-UHFFFAOYSA-N 0 3 412.555 4.080 20 0 HIADHN CC[C@@H](c1ccccc1)[C@@H]1CCCN1Cc1nc2cc(C(=O)OC)ccc2c(=O)[nH]1 ZINC000480041635 895390628 /nfs/dbraw/zinc/39/06/28/895390628.db2.gz FHZLHVGYUNENSB-RXVVDRJESA-N 0 3 405.498 4.280 20 0 HIADHN C[C@@H](NCCCN1C(=O)NC2(CCCC2)C1=O)c1cc(F)c(Cl)cc1Cl ZINC000480133491 895510865 /nfs/dbraw/zinc/51/08/65/895510865.db2.gz CABXURDUMVKCQU-LLVKDONJSA-N 0 3 402.297 4.038 20 0 HIADHN CC(C)[C@H](N[C@H](C)c1ccc(S(C)(=O)=O)c(F)c1)c1ccc2c(c1)OCCO2 ZINC000480160951 895546977 /nfs/dbraw/zinc/54/69/77/895546977.db2.gz DYAWDITUQXORQN-SZNDQCEHSA-N 0 3 407.507 4.048 20 0 HIADHN C[C@@H](NCCCn1cnc2ccccc21)c1ccccc1I ZINC000480166545 895556395 /nfs/dbraw/zinc/55/63/95/895556395.db2.gz PCWBAGOLBAPJIJ-CQSZACIVSA-N 0 3 405.283 4.382 20 0 HIADHN C[C@@H](CN[C@@H]1CCS(=O)(=O)c2ccc(Br)cc21)Cc1cccs1 ZINC000480189758 895585521 /nfs/dbraw/zinc/58/55/21/895585521.db2.gz JTKCYQQIJBBWGZ-MLGOLLRUSA-N 0 3 414.390 4.198 20 0 HIADHN Cc1ccccc1C[C@H](C)N[C@H]1CCS(=O)(=O)c2ccc(Br)cc21 ZINC000480190090 895588075 /nfs/dbraw/zinc/58/80/75/895588075.db2.gz CYHMTVDBIBBPLG-KSSFIOAISA-N 0 3 408.361 4.197 20 0 HIADHN CC(C)CC1(CN[C@H]2CCS(=O)(=O)c3ccc(Br)cc32)CCC1 ZINC000480207423 895609244 /nfs/dbraw/zinc/60/92/44/895609244.db2.gz DPQZYHCKEOITPR-INIZCTEOSA-N 0 3 400.382 4.474 20 0 HIADHN O=S1(=O)CC[C@H](NCC2(Cc3ccccc3)CC2)c2cc(Br)ccc21 ZINC000480212346 895616016 /nfs/dbraw/zinc/61/60/16/895616016.db2.gz GWOXTIOTOJPIOO-SFHVURJKSA-N 0 3 420.372 4.280 20 0 HIADHN C[C@@H](NCC1(C(N)=O)CCOCC1)c1ccc(Oc2ccc(F)cc2)cc1Cl ZINC000480221840 895626983 /nfs/dbraw/zinc/62/69/83/895626983.db2.gz IWSADPLTBRKSDR-CQSZACIVSA-N 0 3 406.885 4.204 20 0 HIADHN COC[C@H](NC[C@@H](c1ccccc1)N1CCOCC1)c1cccc(C(F)(F)F)c1 ZINC000480249893 895661265 /nfs/dbraw/zinc/66/12/65/895661265.db2.gz QNXNFWWQDNOQRQ-SFTDATJTSA-N 0 3 408.464 4.056 20 0 HIADHN CN(C)S(=O)(=O)c1ccccc1CN[C@@H]1CCCc2c3ccccc3sc21 ZINC000480277118 895682437 /nfs/dbraw/zinc/68/24/37/895682437.db2.gz JGUUUPMNSNHBNL-GOSISDBHSA-N 0 3 400.569 4.319 20 0 HIADHN COc1ccc([C@H](C)NC[C@@H](c2ccccc2Cl)N2CCOCC2)c(OC)c1 ZINC000480276107 895682877 /nfs/dbraw/zinc/68/28/77/895682877.db2.gz RWHFSSNMJABHPS-KKSFZXQISA-N 0 3 404.938 4.081 20 0 HIADHN COCCN(C)c1ccc(CNCc2ccc(-c3ccc4c(c3)C[C@H](C)O4)cc2)cn1 ZINC000480280704 895686389 /nfs/dbraw/zinc/68/63/89/895686389.db2.gz GUBSOWDJOKXGTL-IBGZPJMESA-N 0 3 417.553 4.444 20 0 HIADHN COCCN(C)c1ccc(CNCc2ccc(-c3ccc4c(c3)C[C@@H](C)O4)cc2)cn1 ZINC000480280706 895686799 /nfs/dbraw/zinc/68/67/99/895686799.db2.gz GUBSOWDJOKXGTL-LJQANCHMSA-N 0 3 417.553 4.444 20 0 HIADHN Cc1cc(Br)cn2cc(CCNCc3ccc(Br)o3)nc12 ZINC000480290641 895695717 /nfs/dbraw/zinc/69/57/17/895695717.db2.gz HPGNRPGHFHKYDI-UHFFFAOYSA-N 0 3 413.113 4.093 20 0 HIADHN O=S1(=O)CC[C@@H](NCCc2cccc(Cl)c2)c2cc(Br)ccc21 ZINC000480332392 895735684 /nfs/dbraw/zinc/73/56/84/895735684.db2.gz KOJTXZVHKUGGAH-MRXNPFEDSA-N 0 3 414.752 4.153 20 0 HIADHN CCc1ccc([C@H](CNC(=O)[C@H](C)c2c(C)nn(CC(F)(F)F)c2C)N(C)C)cc1 ZINC000480399488 895803210 /nfs/dbraw/zinc/80/32/10/895803210.db2.gz XFQIZCQVRZPJLM-KUHUBIRLSA-N 0 3 424.511 4.147 20 0 HIADHN CCN(CC)C(=O)Nc1ccc([C@@H](C)N[C@H](CN2CCOCC2)c2ccccc2)cc1 ZINC000480445779 895833974 /nfs/dbraw/zinc/83/39/74/895833974.db2.gz HDDHUDRSVAKRMB-HYBUGGRVSA-N 0 3 424.589 4.284 20 0 HIADHN Cc1ccc([C@@H](CN2CCOCC2)N[C@H](C)c2ccc(NC(=O)NC3CC3)cc2)cc1 ZINC000480453961 895841154 /nfs/dbraw/zinc/84/11/54/895841154.db2.gz GAEAJHMVDCEPOT-NTKDMRAZSA-N 0 3 422.573 4.003 20 0 HIADHN Cc1ccc([C@@H](CN2CCOCC2)N[C@@H](C)c2ccc(NC(=O)NC3CC3)cc2)cc1 ZINC000480453962 895841263 /nfs/dbraw/zinc/84/12/63/895841263.db2.gz GAEAJHMVDCEPOT-YADARESESA-N 0 3 422.573 4.003 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CN[C@H](C)c1cccc(N2CCOCC2)c1 ZINC000480474484 895855348 /nfs/dbraw/zinc/85/53/48/895855348.db2.gz VTLOAQKEHIIUDI-LJQANCHMSA-N 0 3 404.558 4.236 20 0 HIADHN Clc1cc(CNCc2ccc(C3CC3)cc2)ccc1OCCN1CCOCC1 ZINC000480479662 895859193 /nfs/dbraw/zinc/85/91/93/895859193.db2.gz ICDWRRQYAUWVME-UHFFFAOYSA-N 0 3 400.950 4.218 20 0 HIADHN C[C@H](NCc1cccnc1N1CCOCC1)[C@H](C)Oc1ccc(Cl)cc1Cl ZINC000480533930 895895975 /nfs/dbraw/zinc/89/59/75/895895975.db2.gz CYUCYLUPSZVMJH-GJZGRUSLSA-N 0 3 410.345 4.171 20 0 HIADHN COc1cc(CN[C@@H](C)c2cccc(N3CCOCC3)c2)ccc1OCC(F)(F)F ZINC000480543258 895905686 /nfs/dbraw/zinc/90/56/86/895905686.db2.gz VJNSBZVFWVVPLF-INIZCTEOSA-N 0 3 424.463 4.324 20 0 HIADHN Cc1ccc(C(=O)CCN2CCC(C(=O)Nc3cc(Cl)ccc3O)CC2)cc1 ZINC000480585744 895948396 /nfs/dbraw/zinc/94/83/96/895948396.db2.gz WZCXLVFCCJWYOB-UHFFFAOYSA-N 0 3 400.906 4.278 20 0 HIADHN COc1cc([C@H](C)NCc2ccc(N3C[C@@H](C)O[C@@H](C)C3)nc2)ccc1SC ZINC000480599725 895962863 /nfs/dbraw/zinc/96/28/63/895962863.db2.gz COLJXDXDDJPBGS-BBWFWOEESA-N 0 3 401.576 4.277 20 0 HIADHN C[C@@H]1CN(c2ccc(CN[C@@H]3CCc4cc(Br)ccc43)cn2)C[C@@H](C)O1 ZINC000480609600 895974782 /nfs/dbraw/zinc/97/47/82/895974782.db2.gz HUHPAWFEPSIWFO-STXHMFSFSA-N 0 3 416.363 4.235 20 0 HIADHN C[C@@H](NCc1ccc(N2CCO[C@@H](C)C2)nc1)c1ccc(OCC(F)(F)F)cc1 ZINC000480614625 895980729 /nfs/dbraw/zinc/98/07/29/895980729.db2.gz NQXJFADOCXRLIL-JKSUJKDBSA-N 0 3 409.452 4.099 20 0 HIADHN CCNC(=O)c1ccc(CN[C@@H](CCCOC)c2ccc(Br)cc2)cc1 ZINC000480616081 895982060 /nfs/dbraw/zinc/98/20/60/895982060.db2.gz WAAXOMBZTNSQLV-FQEVSTJZSA-N 0 3 419.363 4.456 20 0 HIADHN CC(C)Oc1cccc([C@@H](C)N[C@@H](C)c2cccc(N3CCCS3(=O)=O)c2)c1 ZINC000480620700 895988224 /nfs/dbraw/zinc/98/82/24/895988224.db2.gz ZAOJUXLGQFVAQZ-ZWKOTPCHSA-N 0 3 402.560 4.426 20 0 HIADHN Fc1cccc(-c2ccc(CNC[C@H](c3cccs3)N3CCOCC3)o2)c1F ZINC000480674103 896038599 /nfs/dbraw/zinc/03/85/99/896038599.db2.gz TXHYDALRJZGEKN-GOSISDBHSA-N 0 3 404.482 4.449 20 0 HIADHN CC(C)[C@H](NCc1ccc(N2CCCS2(=O)=O)c(F)c1)c1ccc(F)c(F)c1 ZINC000480690918 896053088 /nfs/dbraw/zinc/05/30/88/896053088.db2.gz DARQELDOISKCJQ-FQEVSTJZSA-N 0 3 412.477 4.131 20 0 HIADHN CCOc1cccc(CN[C@@H](C)c2ccc(S(=O)(=O)NCc3ccco3)cc2)c1 ZINC000480690175 896053243 /nfs/dbraw/zinc/05/32/43/896053243.db2.gz AHKXJDUTCUUOJT-KRWDZBQOSA-N 0 3 414.527 4.008 20 0 HIADHN CCN1CCN(c2c(C)c(C)nc3ccc(Br)cc32)C[C@@H]1c1ncc[nH]1 ZINC000480692536 896054765 /nfs/dbraw/zinc/05/47/65/896054765.db2.gz IODLASLGTHSRGZ-GOSISDBHSA-N 0 3 414.351 4.220 20 0 HIADHN O=S1(=O)CCCN1c1ccc(CN[C@@H]2CCCc3c(Cl)cccc32)cc1F ZINC000480721989 896083064 /nfs/dbraw/zinc/08/30/64/896083064.db2.gz WRRHGLLQHPNQTC-LJQANCHMSA-N 0 3 408.926 4.186 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1ccc(-c2n[nH]c(C3CC3)n2)cc1)c1ccsc1 ZINC000480725322 896087117 /nfs/dbraw/zinc/08/71/17/896087117.db2.gz FMDRHGZMPPZNCJ-LJQANCHMSA-N 0 3 409.559 4.224 20 0 HIADHN CCCOc1ccc([C@@H](C)N[C@H](C)c2ccc(S(=O)(=O)N(C)C)cc2)cc1OC ZINC000480737266 896096613 /nfs/dbraw/zinc/09/66/13/896096613.db2.gz CSNUGXJZDWIUGZ-IAGOWNOFSA-N 0 3 420.575 4.146 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)Nc1ccc2c(c1)CCC(=O)N2CCC ZINC000480736057 896096842 /nfs/dbraw/zinc/09/68/42/896096842.db2.gz QOVGXCPTEDHKDC-UHFFFAOYSA-N 0 3 400.567 4.106 20 0 HIADHN CCN(C)C(=O)CN[C@H]1CCCc2nc(-c3ccc(Br)cc3)sc21 ZINC000480741149 896103280 /nfs/dbraw/zinc/10/32/80/896103280.db2.gz MVVWYASSBGMZTM-AWEZNQCLSA-N 0 3 408.365 4.018 20 0 HIADHN CCCOc1ccc([C@@H](C)N[C@@H](C)c2cccc(NS(C)(=O)=O)c2)cc1OC ZINC000480742678 896104823 /nfs/dbraw/zinc/10/48/23/896104823.db2.gz RVZQMJNZRYLETL-JKSUJKDBSA-N 0 3 406.548 4.267 20 0 HIADHN C[C@H](N[C@@H](C)c1cccc(NC(=O)c2ccccc2)c1)c1ccc(-n2cnnn2)cc1 ZINC000480753320 896115970 /nfs/dbraw/zinc/11/59/70/896115970.db2.gz IKDPASHLVJGIKF-ROUUACIJSA-N 0 3 412.497 4.326 20 0 HIADHN C[C@@H](N[C@@H](c1ccccc1)C(C)(C)C)c1cccc(S(=O)(=O)N2CCOCC2)c1 ZINC000480770417 896134106 /nfs/dbraw/zinc/13/41/06/896134106.db2.gz RSTUUZAWRZHICB-GCJKJVERSA-N 0 3 416.587 4.146 20 0 HIADHN COc1ccc(NC(=O)C2(NCCC(=O)c3ccc(C)cc3)CCCC2)cc1OC ZINC000480873502 896234343 /nfs/dbraw/zinc/23/43/43/896234343.db2.gz KUWYUYLLZXULMO-UHFFFAOYSA-N 0 3 410.514 4.126 20 0 HIADHN C[C@H](NCc1cccc(NC(=O)c2ccccn2)c1)c1cccc(N2CCOCC2)c1 ZINC000480901746 896256517 /nfs/dbraw/zinc/25/65/17/896256517.db2.gz ADXLMOYABDORMF-IBGZPJMESA-N 0 3 416.525 4.021 20 0 HIADHN COc1cccc([C@@H](C)N[C@@H](C)c2ccc(S(=O)(=O)N3CCCCC3)cc2)c1 ZINC000480909025 896266532 /nfs/dbraw/zinc/26/65/32/896266532.db2.gz GVHIGWIXGLAGIN-ZWKOTPCHSA-N 0 3 402.560 4.282 20 0 HIADHN C[C@H]1CC[C@@H](NCc2cccc(NC(=O)CCN3CCOCC3)c2)c2ccccc21 ZINC000480912377 896270711 /nfs/dbraw/zinc/27/07/11/896270711.db2.gz MWPGFEBZXYXSPU-YADARESESA-N 0 3 407.558 4.076 20 0 HIADHN C[C@@H](NCc1cccc(Cn2cccn2)c1)c1ccc(S(=O)(=O)C2CCCC2)cc1 ZINC000480915595 896273473 /nfs/dbraw/zinc/27/34/73/896273473.db2.gz ZDBMWSGKASNSAZ-LJQANCHMSA-N 0 3 423.582 4.499 20 0 HIADHN CCS[C@@H]1CCCCN(C(=O)Nc2ccc(N3CCN(CC)CC3)cc2C)C1 ZINC000480921889 896280478 /nfs/dbraw/zinc/28/04/78/896280478.db2.gz QTFLLROEOYCWFQ-HXUWFJFHSA-N 0 3 404.624 4.276 20 0 HIADHN Cc1cc(NC(=O)N(CC2CC2)CC2CC2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000481003754 896334726 /nfs/dbraw/zinc/33/47/26/896334726.db2.gz LBUMWRRUPVOLPK-JOCHJYFZSA-N 0 3 407.562 4.292 20 0 HIADHN CSCCCCCNC(=O)Nc1cc(C)nn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000481014766 896344781 /nfs/dbraw/zinc/34/47/81/896344781.db2.gz ZLNWPZBCBVEZBE-FQEVSTJZSA-N 0 3 415.607 4.293 20 0 HIADHN CNS(=O)(=O)c1cccc(CN[C@@H](Cc2ccccc2)c2sccc2C)c1 ZINC000481027524 896355620 /nfs/dbraw/zinc/35/56/20/896355620.db2.gz VVRHIQLHEUIPEU-FQEVSTJZSA-N 0 3 400.569 4.038 20 0 HIADHN CC[C@@H](c1ccccc1OC)N(C)C(=O)NCC1(N2CCSCC2)CCCC1 ZINC000481100664 896424111 /nfs/dbraw/zinc/42/41/11/896424111.db2.gz FHLRDHTZHXPTPW-IBGZPJMESA-N 0 3 405.608 4.149 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)NCc1cc(Br)cs1)c1ccco1 ZINC000481123320 896449869 /nfs/dbraw/zinc/44/98/69/896449869.db2.gz XFQFVEGEQVRMAA-SMDDNHRTSA-N 0 3 400.342 4.032 20 0 HIADHN COc1ccc2ccccc2c1-c1cc(CN2CCN(CC3CCOCC3)CC2)on1 ZINC000481147372 896474503 /nfs/dbraw/zinc/47/45/03/896474503.db2.gz UZCDTJDJKSMHJI-UHFFFAOYSA-N 0 3 421.541 4.048 20 0 HIADHN CNS(=O)(=O)c1ccc([C@H](C)N[C@H](C)c2ccc(SCC(F)F)cc2)cc1 ZINC000481182914 896526648 /nfs/dbraw/zinc/52/66/48/896526648.db2.gz QNLBYPKKDCCEPG-KGLIPLIRSA-N 0 3 414.543 4.364 20 0 HIADHN COc1ccc(Cl)cc1[C@H](CC(C)C)NCc1cccnc1N1CCN(C)CC1 ZINC000481217071 896570158 /nfs/dbraw/zinc/57/01/58/896570158.db2.gz DIGLNXARFVTFSA-NRFANRHFSA-N 0 3 416.997 4.372 20 0 HIADHN Cc1nn(-c2ccccc2C)c2sc(C(=O)N3CCC[C@H]3CN3CCCC3)cc12 ZINC000481220043 896571952 /nfs/dbraw/zinc/57/19/52/896571952.db2.gz UBUVXENOPRGEGJ-SFHVURJKSA-N 0 3 408.571 4.404 20 0 HIADHN C[C@@H](NCc1cccnc1N1CCN(C)CC1)c1ccc(SCC(F)(F)F)cc1 ZINC000481247663 896599137 /nfs/dbraw/zinc/59/91/37/896599137.db2.gz UHNJHNHLLKVSFO-MRXNPFEDSA-N 0 3 424.536 4.339 20 0 HIADHN COc1ccc([C@H](CNC(=O)Nc2ccc(OCC(F)F)cc2)N2CCCC2)cc1 ZINC000481251972 896602921 /nfs/dbraw/zinc/60/29/21/896602921.db2.gz MUZAGXIJGNVEMK-FQEVSTJZSA-N 0 3 419.472 4.298 20 0 HIADHN O=C(CN[C@H](CC1CCC1)c1ccccc1)Nc1cc(Cl)ccc1-n1cncn1 ZINC000481252531 896603811 /nfs/dbraw/zinc/60/38/11/896603811.db2.gz GKXPECDLTATTGR-LJQANCHMSA-N 0 3 409.921 4.380 20 0 HIADHN CC(C)CN(C(=O)NCCCCN1CCN(c2ccccc2)CC1)C1CCCC1 ZINC000481265771 896615190 /nfs/dbraw/zinc/61/51/90/896615190.db2.gz BVOGOOFZJUVJOT-UHFFFAOYSA-N 0 3 400.611 4.199 20 0 HIADHN Cc1nc2c(s1)[C@@H](NCc1ccc(S(=O)(=O)N3CCC[C@@H](C)C3)cc1)CCC2 ZINC000481303047 896648690 /nfs/dbraw/zinc/64/86/90/896648690.db2.gz FOJFHOGNWHYGDL-BEFAXECRSA-N 0 3 419.616 4.039 20 0 HIADHN CCOc1c(Cl)cc(CN[C@@H](C)c2cccc(N3CCOCC3)c2)cc1OC ZINC000481303441 896649067 /nfs/dbraw/zinc/64/90/67/896649067.db2.gz BFLQRJODDICUSA-INIZCTEOSA-N 0 3 404.938 4.435 20 0 HIADHN Cc1nc(-c2cccnc2)sc1[C@H](C)NCc1cccc(CN2CCOCC2)c1 ZINC000481306899 896652844 /nfs/dbraw/zinc/65/28/44/896652844.db2.gz BXFQYQIBBMTREV-KRWDZBQOSA-N 0 3 408.571 4.197 20 0 HIADHN COc1cccc([C@H](C)NCc2ccnc(N3CCN(c4ccc(F)cc4)CC3)c2)c1 ZINC000481314283 896662692 /nfs/dbraw/zinc/66/26/92/896662692.db2.gz BSUUMDCBSYWVFS-IBGZPJMESA-N 0 3 420.532 4.407 20 0 HIADHN C[C@@H](NC1CCN(Cc2ccncc2)CC1)c1ccccc1I ZINC000481318511 896669457 /nfs/dbraw/zinc/66/94/57/896669457.db2.gz VTUFNXPYPHLEOM-OAHLLOKOSA-N 0 3 421.326 4.001 20 0 HIADHN C[C@@H](N[C@@H](C)c1cccc(OCc2ccccn2)c1)c1ccc(-n2cnnn2)cc1 ZINC000481330796 896690715 /nfs/dbraw/zinc/69/07/15/896690715.db2.gz GSLKIBGZROAOKL-MSOLQXFVSA-N 0 3 400.486 4.048 20 0 HIADHN CC[C@@H](N[C@@H]1CCc2ccc(OC)cc21)c1ccccc1OCC(=O)N1CCCC1 ZINC000481336062 896697581 /nfs/dbraw/zinc/69/75/81/896697581.db2.gz MEXWEJCGGRSZGB-DHIUTWEWSA-N 0 3 408.542 4.425 20 0 HIADHN Cc1cc(C)c2c(c1)[C@H](NCc1cccc(OCCN3CCOCC3)c1)CCCO2 ZINC000481409203 896814724 /nfs/dbraw/zinc/81/47/24/896814724.db2.gz AQZFVCHZALNKIU-XMMPIXPASA-N 0 3 410.558 4.018 20 0 HIADHN Clc1cccc2c1SCC[C@@H]2NCc1cccc(OCCN2CCOCC2)c1 ZINC000481421852 896823832 /nfs/dbraw/zinc/82/38/32/896823832.db2.gz RHHZLLLWNAPXKT-NRFANRHFSA-N 0 3 418.990 4.378 20 0 HIADHN Cc1cc2c(cc1C)[C@@H](NCc1cccc(OCCN3CCOCC3)c1)CCCO2 ZINC000481421054 896824257 /nfs/dbraw/zinc/82/42/57/896824257.db2.gz HNHBCDSKUYVKAD-DEOSSOPVSA-N 0 3 410.558 4.018 20 0 HIADHN Cc1noc(-c2ccccc2)c1NC(=O)N(C)C1CCN(CCc2ccccn2)CC1 ZINC000481484867 896867181 /nfs/dbraw/zinc/86/71/81/896867181.db2.gz XGRADFICRNAZEJ-UHFFFAOYSA-N 0 3 419.529 4.216 20 0 HIADHN C[C@@H](NCc1ccc(Oc2cccnc2)c(F)c1)c1ccc(NS(C)(=O)=O)cc1 ZINC000481559303 896933172 /nfs/dbraw/zinc/93/31/72/896933172.db2.gz SSMZCHUCTZTHQY-OAHLLOKOSA-N 0 3 415.490 4.235 20 0 HIADHN COc1ccc(C2(CN[C@H](C)c3nnn(-c4ccc(C)cc4)c3C)CCOCC2)cc1 ZINC000481560757 896936160 /nfs/dbraw/zinc/93/61/60/896936160.db2.gz WIMKFRQQVPCGHD-LJQANCHMSA-N 0 3 420.557 4.292 20 0 HIADHN O[C@H](CN[C@H]1CCSc2ccc(F)cc21)COc1ccc(C(F)(F)F)cc1 ZINC000481565778 896944056 /nfs/dbraw/zinc/94/40/56/896944056.db2.gz QXUUBHANSCWGAC-PBHICJAKSA-N 0 3 401.425 4.411 20 0 HIADHN Cc1cc(NC(=O)c2cnc3c(cnn3C(C)C)c2)cc(N2CCN(C(C)C)CC2)c1 ZINC000481667986 897052303 /nfs/dbraw/zinc/05/23/03/897052303.db2.gz SRPNELSHEWHTMM-UHFFFAOYSA-N 0 3 420.561 4.103 20 0 HIADHN CCCC[C@H](N[C@@H]1C[C@H]1c1ccc(Br)s1)C(=O)Nc1cc(C)on1 ZINC000481684821 897069304 /nfs/dbraw/zinc/06/93/04/897069304.db2.gz IFAAXWLPJIXBBI-FRRDWIJNSA-N 0 3 412.353 4.450 20 0 HIADHN CCOCCOc1ccc(Cl)cc1NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000481690874 897075031 /nfs/dbraw/zinc/07/50/31/897075031.db2.gz ZOPMLBOREHMBBK-LJQANCHMSA-N 0 3 417.937 4.151 20 0 HIADHN CC[C@H](CN(CC)[C@H](C)C(=O)Nc1cc(NC(C)=O)ccc1OC)c1ccccc1 ZINC000481696770 897084450 /nfs/dbraw/zinc/08/44/50/897084450.db2.gz VIYIWKDOAGMMPL-IEBWSBKVSA-N 0 3 411.546 4.496 20 0 HIADHN CC(C)C[C@@H]1OCCC[C@H]1NCC(=O)N1N=C(c2cccs2)C[C@H]1c1ccco1 ZINC000481721248 897115860 /nfs/dbraw/zinc/11/58/60/897115860.db2.gz HKPGOHWICMOAJC-KPFFTGBYSA-N 0 3 415.559 4.202 20 0 HIADHN COc1ccc([C@H](CNC(=O)Nc2cc(F)c(OC)cc2C)N2CCCC2)cc1 ZINC000481725456 897119839 /nfs/dbraw/zinc/11/98/39/897119839.db2.gz KMJCMXPUZAEUPR-FQEVSTJZSA-N 0 3 401.482 4.110 20 0 HIADHN OC[C@@H](CNCc1c(Cl)cccc1OCc1ccccc1Cl)[C@@H]1CCOC1 ZINC000481815887 897189216 /nfs/dbraw/zinc/18/92/16/897189216.db2.gz PWDIZMFUWSRMIS-NVXWUHKLSA-N 0 3 410.341 4.307 20 0 HIADHN CN1C[C@H](NC(=O)Cc2csc(-c3ccc(Cl)cc3)n2)[C@@H](c2ccccc2)C1 ZINC000481847125 897214349 /nfs/dbraw/zinc/21/43/49/897214349.db2.gz MMHYTIRFLLJCGQ-UXHICEINSA-N 0 3 411.958 4.220 20 0 HIADHN CN(C(=O)c1ccc(-c2cncnc2)cc1F)C1CCN(Cc2ccccc2)CC1 ZINC000481896093 897274308 /nfs/dbraw/zinc/27/43/08/897274308.db2.gz RTFQFMQJZLVOIX-UHFFFAOYSA-N 0 3 404.489 4.019 20 0 HIADHN CCN(C(=O)c1ccc(-c2cncnc2)cc1F)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000481901264 897280244 /nfs/dbraw/zinc/28/02/44/897280244.db2.gz DNOZFWHEEKPGOI-OAQYLSRUSA-N 0 3 404.489 4.019 20 0 HIADHN CC[C@@H](N[C@@H](CC)c1ccc(OC)cc1)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000481912020 897294248 /nfs/dbraw/zinc/29/42/48/897294248.db2.gz IAOKLHOEHWHJKY-RBUKOAKNSA-N 0 3 410.967 4.449 20 0 HIADHN COc1ccc(-c2ccncc2)cc1CN1CCC[C@H](C(=O)Nc2cccc(C)n2)C1 ZINC000481911338 897294474 /nfs/dbraw/zinc/29/44/74/897294474.db2.gz DXRQURBQARRWGN-NRFANRHFSA-N 0 3 416.525 4.311 20 0 HIADHN CCCCCNC(=O)C1CCN(Cc2ccc(-c3ccc(C(=O)OC)cc3)o2)CC1 ZINC000481915602 897299294 /nfs/dbraw/zinc/29/92/94/897299294.db2.gz MPRBIIXKYHAJNC-UHFFFAOYSA-N 0 3 412.530 4.252 20 0 HIADHN COc1cc(F)c([C@@H](C)NC[C@@H](c2ccc(Cl)cc2)N2CCOCC2)cc1OC ZINC000481957340 897347374 /nfs/dbraw/zinc/34/73/74/897347374.db2.gz FZZVIBVORMHHPH-QRWLVFNGSA-N 0 3 422.928 4.220 20 0 HIADHN Cc1cc(C)cc(-c2nnc(NC(=O)N(CCN(C)C)Cc3cccs3)s2)c1 ZINC000481978746 897372804 /nfs/dbraw/zinc/37/28/04/897372804.db2.gz FLLZCEROYIGHMF-UHFFFAOYSA-N 0 3 415.588 4.479 20 0 HIADHN C[C@@H](Cc1ccccc1C(F)(F)F)N[C@H](c1nc(-c2nc[nH]n2)no1)C(C)(C)C ZINC000482001845 897398947 /nfs/dbraw/zinc/39/89/47/897398947.db2.gz YCMRLJMTTMJUFH-SMDDNHRTSA-N 0 3 408.428 4.182 20 0 HIADHN CC[C@@H](NCc1c(C)c2ccccc2n1C)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000482003029 897399203 /nfs/dbraw/zinc/39/92/03/897399203.db2.gz RJKGIIRGRZQKTC-GOSISDBHSA-N 0 3 419.978 4.289 20 0 HIADHN COc1ccc(CN[C@@H](C)c2cccc(N3CCOCC3)c2)cc1Br ZINC000482015766 897416529 /nfs/dbraw/zinc/41/65/29/897416529.db2.gz KGMHSCLONFCYDZ-HNNXBMFYSA-N 0 3 405.336 4.145 20 0 HIADHN Cc1cc(NC(=O)c2nc(C(C)C)ncc2Cl)cc(N2CCN(C(C)C)CC2)c1 ZINC000482032253 897443369 /nfs/dbraw/zinc/44/33/69/897443369.db2.gz ODNLNNLOGRQLQZ-UHFFFAOYSA-N 0 3 415.969 4.345 20 0 HIADHN CCN(CC)C(=O)Nc1ccc([C@H](C)N[C@@H]2CC(=O)N(c3cccc(OC)c3)C2)cc1 ZINC000482032002 897443676 /nfs/dbraw/zinc/44/36/76/897443676.db2.gz ZMPMELJYWSDHFN-FXAWDEMLSA-N 0 3 424.545 4.025 20 0 HIADHN CC(=O)N1CCN(c2ccccc2CN[C@H](C)c2ccc(OC(F)(F)F)cc2)CC1 ZINC000482037814 897455113 /nfs/dbraw/zinc/45/51/13/897455113.db2.gz XJZOUQQMGZAWOT-MRXNPFEDSA-N 0 3 421.463 4.105 20 0 HIADHN Cc1c(C(=O)Nc2cc(C)cc(N3CCN(C(C)C)CC3)c2)oc2c1C(=O)CCC2 ZINC000482040998 897458789 /nfs/dbraw/zinc/45/87/89/897458789.db2.gz VYBXUWZUGMIPOW-UHFFFAOYSA-N 0 3 409.530 4.198 20 0 HIADHN CC[C@H](C)n1ncc(NC(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)c1C ZINC000482100705 897547364 /nfs/dbraw/zinc/54/73/64/897547364.db2.gz IRBYYLDCHQKPTP-KKSFZXQISA-N 0 3 401.555 4.374 20 0 HIADHN CCS(=O)(=O)Nc1ccc([C@H](C)NCc2ccc(Oc3ccccc3)nc2)cc1 ZINC000482115156 897566851 /nfs/dbraw/zinc/56/68/51/897566851.db2.gz QCUSFWHZDBSNIV-KRWDZBQOSA-N 0 3 411.527 4.486 20 0 HIADHN CCN(CC)C(=O)Nc1ccc([C@H](C)NCc2ccc(OC)c(NC(C)=O)c2)cc1 ZINC000482118298 897571308 /nfs/dbraw/zinc/57/13/08/897571308.db2.gz DSJYNCNXSVCAKC-INIZCTEOSA-N 0 3 412.534 4.378 20 0 HIADHN COC(=O)c1ccc(COc2ccc(CNCc3sccc3C)cc2OC)o1 ZINC000482197329 897673156 /nfs/dbraw/zinc/67/31/56/897673156.db2.gz GHQFBAHYBUELBC-UHFFFAOYSA-N 0 3 401.484 4.314 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)N[C@@H](C3CCCCC3)C(F)(F)F)CC2)C[C@H](C)O1 ZINC000482265734 897751181 /nfs/dbraw/zinc/75/11/81/897751181.db2.gz HAGQLTPIZZERDE-FCEWJHQRSA-N 0 3 419.532 4.028 20 0 HIADHN OC1(Cc2ccc(F)cc2)CCN(Cc2ccccc2OCc2cccnc2)CC1 ZINC000482300563 897796924 /nfs/dbraw/zinc/79/69/24/897796924.db2.gz WVZQCXLEKPRGJQ-UHFFFAOYSA-N 0 3 406.501 4.369 20 0 HIADHN C[C@@H](C(=O)Nc1ccc(C(=O)N(C)[C@@H]2CCCN(C)C2)cc1)c1cc2ccccc2o1 ZINC000482318223 897816334 /nfs/dbraw/zinc/81/63/34/897816334.db2.gz SBEFDVCLVZTAMZ-DYESRHJHSA-N 0 3 419.525 4.341 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)N[C@@H](c1ccc(Cl)cc1)C(F)(F)F ZINC000482331522 897835621 /nfs/dbraw/zinc/83/56/21/897835621.db2.gz NVZKIZDUKZFQRJ-INIZCTEOSA-N 0 3 403.832 4.310 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)c2ccc(-c3ccc(C(C)=O)cc3)o2)c1 ZINC000482386173 897916725 /nfs/dbraw/zinc/91/67/25/897916725.db2.gz BERGFTCXIQRXHT-UHFFFAOYSA-N 0 3 420.509 4.362 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Cc2csc(-c3cccs3)n2)c1 ZINC000482403625 897944609 /nfs/dbraw/zinc/94/46/09/897944609.db2.gz IWVRLNHZWRSZHR-UHFFFAOYSA-N 0 3 415.584 4.013 20 0 HIADHN COc1ccc(CN[C@@H](C)c2cccc(NS(C)(=O)=O)c2)cc1OC1CCCC1 ZINC000482443733 898006601 /nfs/dbraw/zinc/00/66/01/898006601.db2.gz ZNOQCRQZPQJCQV-INIZCTEOSA-N 0 3 418.559 4.239 20 0 HIADHN CCc1cccc(CC(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000505522397 914214156 /nfs/dbraw/zinc/21/41/56/914214156.db2.gz CNSYRJUKRIQFJJ-HSZRJFAPSA-N 0 3 402.542 4.382 20 0 HIADHN Cc1c(C(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)cnn1-c1ccccc1Cl ZINC000482486517 898067206 /nfs/dbraw/zinc/06/72/06/898067206.db2.gz VXUPJZGFQOKSAX-APWZRJJASA-N 0 3 408.933 4.399 20 0 HIADHN C[C@@H](CN1CCC(c2nnc3n2CCCC3)CC1)c1cccc(Br)c1 ZINC000482496117 898076148 /nfs/dbraw/zinc/07/61/48/898076148.db2.gz NARPMNTZOWURDV-HNNXBMFYSA-N 0 3 403.368 4.360 20 0 HIADHN CC[C@H](N[C@H](C)c1cc(F)ccc1N1CCN(C)CC1)c1ccc(OC)c(OC)c1 ZINC000482536916 898123776 /nfs/dbraw/zinc/12/37/76/898123776.db2.gz QNPXJAWBUYHZPY-UTKZUKDTSA-N 0 3 415.553 4.397 20 0 HIADHN CCN1CCN(c2ccccc2NCc2ccc(OCC(F)(F)F)c(OC)c2)CC1 ZINC000482536331 898124007 /nfs/dbraw/zinc/12/40/07/898124007.db2.gz XLDJZXXLBBVZGZ-UHFFFAOYSA-N 0 3 423.479 4.390 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc2c(c1)C(C)(C)C(=O)N2)c1cc(F)ccc1N1CCN(C)CC1 ZINC000482564071 898156102 /nfs/dbraw/zinc/15/61/02/898156102.db2.gz HEGKYDCGCZZZIR-DLBZAZTESA-N 0 3 424.564 4.219 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)NCc1cccc(NC(=O)[C@@H](C)CC)c1 ZINC000482571862 898167393 /nfs/dbraw/zinc/16/73/93/898167393.db2.gz DSHTZJFREUJVGF-IBGZPJMESA-N 0 3 402.583 4.079 20 0 HIADHN Cc1cc(C)nc(-n2cc(C(=O)Nc3cc(CN(C)C)ccc3C)c(C(C)C)n2)n1 ZINC000482589007 898187644 /nfs/dbraw/zinc/18/76/44/898187644.db2.gz RYYHNHVXGCGZGA-UHFFFAOYSA-N 0 3 406.534 4.025 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)[C@H](C)NC(=O)c1cccc(Cl)c1Cl ZINC000482589964 898189350 /nfs/dbraw/zinc/18/93/50/898189350.db2.gz BJOFFTJEPSDCPA-ZDUSSCGKSA-N 0 3 408.329 4.120 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)[C@@H](NC(=O)c1ccccc1)c1ccccc1 ZINC000482591104 898191119 /nfs/dbraw/zinc/19/11/19/898191119.db2.gz ZDMQEQLFCAMJRB-QHCPKHFHSA-N 0 3 401.510 4.166 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)CCCCCNC(=O)NC1CCCCC1 ZINC000482595140 898194686 /nfs/dbraw/zinc/19/46/86/898194686.db2.gz UKONPUXJSOOUQS-UHFFFAOYSA-N 0 3 402.583 4.187 20 0 HIADHN Cc1ccc(CNC(=O)N[C@H](CC(C)C)C(=O)Nc2cc(CN(C)C)ccc2C)cc1 ZINC000482597164 898198175 /nfs/dbraw/zinc/19/81/75/898198175.db2.gz LQCHSHYIDMMZKD-HSZRJFAPSA-N 0 3 424.589 4.218 20 0 HIADHN Cc1noc(C)c1COc1ccc(CC(=O)Nc2cc(CN(C)C)ccc2C)cc1 ZINC000482597954 898200302 /nfs/dbraw/zinc/20/03/02/898200302.db2.gz PODUJMBDSLZQDU-UHFFFAOYSA-N 0 3 407.514 4.422 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)CSc1nncn1-c1cccc(Cl)c1 ZINC000482616274 898217973 /nfs/dbraw/zinc/21/79/73/898217973.db2.gz FYGDCPGTRZZTFX-UHFFFAOYSA-N 0 3 415.950 4.022 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)c1ccn(-c2cccc(Br)c2)n1 ZINC000482626404 898230243 /nfs/dbraw/zinc/23/02/43/898230243.db2.gz ATOAPHTYZSVOSF-UHFFFAOYSA-N 0 3 413.319 4.257 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1ccccc1 ZINC000482630382 898233218 /nfs/dbraw/zinc/23/32/18/898233218.db2.gz PUBMNOIFRGLNKK-XWGVYQGASA-N 0 3 419.569 4.469 20 0 HIADHN Cc1c([C@H](C)NC(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)cnn1-c1ccc(F)cc1 ZINC000482667058 898270227 /nfs/dbraw/zinc/27/02/27/898270227.db2.gz BDXPSWFLSKZFIS-QQMNAOGKSA-N 0 3 423.536 4.371 20 0 HIADHN CN1C(=O)C[C@H](NCc2ccc(OCc3ccccn3)cc2)[C@@H]1c1ccc(F)c(F)c1 ZINC000482688313 898287497 /nfs/dbraw/zinc/28/74/97/898287497.db2.gz CPWKYSHBKVJWOY-UPVQGACJSA-N 0 3 423.463 4.000 20 0 HIADHN CN1C(=O)C[C@@H](NCc2ccc(OCc3cccnc3)cc2)[C@H]1c1ccc(F)c(F)c1 ZINC000482698074 898298007 /nfs/dbraw/zinc/29/80/07/898298007.db2.gz YEQXINGJTQTELP-ISKFKSNPSA-N 0 3 423.463 4.000 20 0 HIADHN CCc1ccnc(-c2noc([C@@]3(C(F)(F)F)CCN(Cc4ccccc4)C3)n2)c1 ZINC000482779607 898387187 /nfs/dbraw/zinc/38/71/87/898387187.db2.gz GXIZHZQHHZAQQF-HXUWFJFHSA-N 0 3 402.420 4.400 20 0 HIADHN Cc1cc(C(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)nn1-c1ccc(F)cc1F ZINC000505552333 914254622 /nfs/dbraw/zinc/25/46/22/914254622.db2.gz YPOYJZXYBVWDLV-SFHVURJKSA-N 0 3 424.495 4.196 20 0 HIADHN CN(C)C(=O)[C@H](Cc1ccccc1)N[C@@H]1CCCc2nc(-c3ccccc3)sc21 ZINC000482895233 898513660 /nfs/dbraw/zinc/51/36/60/898513660.db2.gz SLCKSZMSTAZRPW-CTNGQTDRSA-N 0 3 405.567 4.477 20 0 HIADHN C[C@H](NCc1cccc(NC(=O)NCc2ccncc2)c1)c1ccc2c(c1)COC2 ZINC000482959353 898589375 /nfs/dbraw/zinc/58/93/75/898589375.db2.gz LDRSNBJICFUAFJ-KRWDZBQOSA-N 0 3 402.498 4.284 20 0 HIADHN C[C@@H](OC[C@@H](O)CN[C@@H](C)c1ccc(Br)cn1)c1ccc(Cl)cc1 ZINC000482961251 898591199 /nfs/dbraw/zinc/59/11/99/898591199.db2.gz OEPBHHTWKRBAEC-AHIWAGSCSA-N 0 3 413.743 4.287 20 0 HIADHN COc1ccc([C@@H](C)NCc2ccccc2CN2C(=O)NC3(CCCCC3)C2=O)cc1 ZINC000482976653 898612563 /nfs/dbraw/zinc/61/25/63/898612563.db2.gz XLKHRZRYCJPXEK-GOSISDBHSA-N 0 3 421.541 4.301 20 0 HIADHN C[C@H](NC(=O)c1ccc(C(=O)N(C)c2ccccc2)cc1)[C@@H](c1ccccc1)N(C)C ZINC000505576365 914282586 /nfs/dbraw/zinc/28/25/86/914282586.db2.gz XOOCKFHHQNZURQ-CYFREDJKSA-N 0 3 415.537 4.384 20 0 HIADHN Cc1ccc(C[C@H](N[C@@H](C)c2ccc(NS(C)(=O)=O)cc2)c2ccccn2)cc1 ZINC000483134885 898816305 /nfs/dbraw/zinc/81/63/05/898816305.db2.gz NJVCIOXFULJTNB-MBSDFSHPSA-N 0 3 409.555 4.396 20 0 HIADHN COCC[C@@](C)(O)CN[C@H](Cc1ccccc1F)c1ccccc1Br ZINC000483138643 898818777 /nfs/dbraw/zinc/81/87/77/898818777.db2.gz WQBSCMZEFJKYLT-WOJBJXKFSA-N 0 3 410.327 4.249 20 0 HIADHN O=C(Nc1ccc2c(c1)OCO2)C1CCN(Cc2ccc(OCC3CC3)cc2)CC1 ZINC000483144393 898822865 /nfs/dbraw/zinc/82/28/65/898822865.db2.gz NFMUWQXARDIBDJ-UHFFFAOYSA-N 0 3 408.498 4.055 20 0 HIADHN COc1ccc(S(=O)(=O)[N-]c2cccc(C[NH2+][C@@H](C)c3cccs3)c2)cc1 ZINC000483144450 898824016 /nfs/dbraw/zinc/82/40/16/898824016.db2.gz ZFJNWRPWOKGICY-HNNXBMFYSA-N 0 3 402.541 4.408 20 0 HIADHN CC[C@H]1CN(CCC(=O)Nc2ccccc2Oc2ccccc2)C[C@@]2(CCOC2)O1 ZINC000483163117 898833534 /nfs/dbraw/zinc/83/35/34/898833534.db2.gz XUFILEGHIPOFSQ-YADARESESA-N 0 3 410.514 4.077 20 0 HIADHN CCC1(C(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)CCN(C(=O)c2ccccc2)CC1 ZINC000505585123 914290664 /nfs/dbraw/zinc/29/06/64/914290664.db2.gz DBFSDDIEUVTGEF-NZQKXSOJSA-N 0 3 421.585 4.127 20 0 HIADHN CCC1(C(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)CCN(C(=O)c2ccccc2)CC1 ZINC000505585122 914291662 /nfs/dbraw/zinc/29/16/62/914291662.db2.gz DBFSDDIEUVTGEF-NFBKMPQASA-N 0 3 421.585 4.127 20 0 HIADHN C[C@H](NC(=O)c1cn(C)nc1-c1ccc(Cl)s1)[C@H](c1ccccc1)N(C)C ZINC000505585643 914293610 /nfs/dbraw/zinc/29/36/10/914293610.db2.gz GBGMGRPQMZZVEZ-ORAYPTAESA-N 0 3 402.951 4.223 20 0 HIADHN OC[C@@H](NC[C@@H](O)CC1CCCC1)c1ccc(Br)cc1C(F)(F)F ZINC000483271582 898910240 /nfs/dbraw/zinc/91/02/40/898910240.db2.gz PUEQQISWDRAUAD-XJKSGUPXSA-N 0 3 410.274 4.032 20 0 HIADHN COc1ccc(-c2csc(NC(=O)CN(CC3CC3)C3CCC3)n2)c(OC)c1 ZINC000483292785 898926703 /nfs/dbraw/zinc/92/67/03/898926703.db2.gz FRXMIQWJCGPAFB-UHFFFAOYSA-N 0 3 401.532 4.030 20 0 HIADHN C[C@H](NC(=O)c1cc(OC(F)F)cc(OC(F)F)c1)[C@@H](c1ccccc1)N(C)C ZINC000505592938 914299288 /nfs/dbraw/zinc/29/92/88/914299288.db2.gz WBTFRUBNHUGZSE-SJCJKPOMSA-N 0 3 414.399 4.311 20 0 HIADHN C[C@H](NC(=O)c1cc2sc(N3CCCC3)nc2s1)[C@@H](c1ccccc1)N(C)C ZINC000505601947 914307306 /nfs/dbraw/zinc/30/73/06/914307306.db2.gz IYBZHMZWCMNNOM-KSSFIOAISA-N 0 3 414.600 4.379 20 0 HIADHN CO[C@H](c1ccccc1Cl)[C@H](C)NC(=O)N(Cc1ccco1)C1CCN(C)CC1 ZINC000483418505 899048978 /nfs/dbraw/zinc/04/89/78/899048978.db2.gz NZBMTEJURBCJRF-KKSFZXQISA-N 0 3 419.953 4.315 20 0 HIADHN C[C@@H](NC(=O)CCCc1nc(-c2ccc(F)cc2)no1)[C@@H](c1ccccc1)N(C)C ZINC000505606421 914310055 /nfs/dbraw/zinc/31/00/55/914310055.db2.gz HIHRXNVGMOORLH-ZHRRBRCNSA-N 0 3 410.493 4.006 20 0 HIADHN O=C1CCCN1[C@@H]1CCN(Cc2cn(-c3ccccc3)nc2-c2cccc(Cl)c2)C1 ZINC000483444673 899079119 /nfs/dbraw/zinc/07/91/19/899079119.db2.gz WULYGEWETUQIMR-JOCHJYFZSA-N 0 3 420.944 4.389 20 0 HIADHN C[C@@H](NC(=O)c1cnn(-c2ccccc2)c1C(F)(F)F)[C@H](c1ccccc1)N(C)C ZINC000505615406 914318488 /nfs/dbraw/zinc/31/84/88/914318488.db2.gz XNZRRLVSLMULGY-DNVCBOLYSA-N 0 3 416.447 4.312 20 0 HIADHN CC(C)(O)C(C)(C)NCC(=O)Nc1ccc(Oc2ccc(Br)cc2)cc1 ZINC000505612420 914315731 /nfs/dbraw/zinc/31/57/31/914315731.db2.gz OLUJTGGPAQTKMX-UHFFFAOYSA-N 0 3 421.335 4.319 20 0 HIADHN COc1ccc(-c2cnc(CCC(=O)N[C@H](C)[C@@H](c3ccccc3)N(C)C)o2)cc1 ZINC000505615866 914320171 /nfs/dbraw/zinc/32/01/71/914320171.db2.gz YZKLSJXMKNMFLG-OSPHWJPCSA-N 0 3 407.514 4.090 20 0 HIADHN COc1cc(CN[C@H](C)c2ccc(OCc3nccn3C)cc2)c2ccccc2n1 ZINC000483541771 899203522 /nfs/dbraw/zinc/20/35/22/899203522.db2.gz HXXDKYLCSRIDNP-QGZVFWFLSA-N 0 3 402.498 4.407 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1ccc(N(C)C)cc1F ZINC000505625591 914325468 /nfs/dbraw/zinc/32/54/68/914325468.db2.gz LQCIBEWAFDUXDX-FQEVSTJZSA-N 0 3 421.520 4.096 20 0 HIADHN Cc1ccccc1[C@H](NC(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1)C(C)C ZINC000483601847 899252793 /nfs/dbraw/zinc/25/27/93/899252793.db2.gz OWVQPFYXHHNMGM-TXTKFYIRSA-N 0 3 401.595 4.223 20 0 HIADHN COc1cc(C(=O)N(CCN(C)C)C2CC2)ccc1OCc1ccccc1Cl ZINC000505628855 914329621 /nfs/dbraw/zinc/32/96/21/914329621.db2.gz CBHCLYUOELHMKI-UHFFFAOYSA-N 0 3 402.922 4.094 20 0 HIADHN C[C@@](CO)(CNCc1nc(-c2cccc(Br)c2)c[nH]1)Cc1ccccc1 ZINC000483647724 899304232 /nfs/dbraw/zinc/30/42/32/899304232.db2.gz NAAIGGRGRHILLC-NRFANRHFSA-N 0 3 414.347 4.170 20 0 HIADHN C[C@H](NCCc1ccc(S(=O)(=O)N2CCCCC2)s1)c1cc(F)ccc1F ZINC000483648558 899304795 /nfs/dbraw/zinc/30/47/95/899304795.db2.gz OEGJSYWDFUIULW-AWEZNQCLSA-N 0 3 414.543 4.094 20 0 HIADHN COc1ccc2[nH]c3c(c2c1)C[C@@H](N[C@@H](C)c1nc(-c2ccccc2OC)no1)CC3 ZINC000483656480 899315910 /nfs/dbraw/zinc/31/59/10/899315910.db2.gz QVRXHDOZTNJMGR-GJZGRUSLSA-N 0 3 418.497 4.443 20 0 HIADHN C[C@@H](NC(=O)c1cccc(C(=O)N(C)c2ccccc2)c1)[C@H](c1ccccc1)N(C)C ZINC000505635297 914335798 /nfs/dbraw/zinc/33/57/98/914335798.db2.gz SEOJJVBOIFXTDK-NTKDMRAZSA-N 0 3 415.537 4.384 20 0 HIADHN CCN(C(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F)c1ccc(OC)c(OC)c1 ZINC000505636884 914338018 /nfs/dbraw/zinc/33/80/18/914338018.db2.gz PWALNHSQXVAGIJ-IBGZPJMESA-N 0 3 418.484 4.214 20 0 HIADHN COc1ccccc1[C@H](CC(C)C)N[C@H](C)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000483709466 899364849 /nfs/dbraw/zinc/36/48/49/899364849.db2.gz JTAWLJLDKDLMOZ-UTKZUKDTSA-N 0 3 404.576 4.384 20 0 HIADHN Cc1nn(Cc2ccccc2Cl)c2sc(C(=O)N(CCN(C)C)C3CC3)cc12 ZINC000505641095 914341742 /nfs/dbraw/zinc/34/17/42/914341742.db2.gz YDAUUBKTFCDYPO-UHFFFAOYSA-N 0 3 416.978 4.274 20 0 HIADHN C[C@@H](N[C@@H]1CCCN(c2ccccc2Cl)C1=O)c1cccc(N2CCOCC2)c1 ZINC000483735071 899396510 /nfs/dbraw/zinc/39/65/10/899396510.db2.gz XGRSFCJHIPTJSO-DYESRHJHSA-N 0 3 413.949 4.023 20 0 HIADHN CC(C)(C)Oc1ccc(C(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)nc1 ZINC000483794157 899464675 /nfs/dbraw/zinc/46/46/75/899464675.db2.gz BPIVCQNRPUEUSW-IBGZPJMESA-N 0 3 419.529 4.155 20 0 HIADHN Cc1ccc(NC(=O)N2CCC(CN3C[C@@H](C)O[C@H](C)C3)CC2)cc1-c1ncco1 ZINC000483801476 899475348 /nfs/dbraw/zinc/47/53/48/899475348.db2.gz QUKQRTGXLZRHAO-QZTJIDSGSA-N 0 3 412.534 4.003 20 0 HIADHN CC[C@H](NCc1ccc(-c2cccnc2)cc1)c1ccccc1OCC(=O)N(C)C ZINC000483861144 899545100 /nfs/dbraw/zinc/54/51/00/899545100.db2.gz IVRJEUUOBCUGRG-QHCPKHFHSA-N 0 3 403.526 4.457 20 0 HIADHN COCCCOc1ccccc1NC(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000505665104 914362912 /nfs/dbraw/zinc/36/29/12/914362912.db2.gz USFFLGCEYKHUHE-GOSISDBHSA-N 0 3 403.548 4.122 20 0 HIADHN COc1ccc2c(c1)[C@H](N(CCC(=O)Nc1cccnc1)Cc1ccccc1)CCO2 ZINC000483963932 899610050 /nfs/dbraw/zinc/61/00/50/899610050.db2.gz UMGJZLAXTIONKC-HSZRJFAPSA-N 0 3 417.509 4.445 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2ccc(C)c(OC(F)F)c2)c1 ZINC000483999437 899638760 /nfs/dbraw/zinc/63/87/60/899638760.db2.gz HYCTYYVFKQKYSE-UHFFFAOYSA-N 0 3 407.461 4.201 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)Nc2nnc(/C=C/c3ccco3)s2)C1 ZINC000484092347 899722488 /nfs/dbraw/zinc/72/24/88/899722488.db2.gz BABAPADBGHWOBJ-FKLRVFMWSA-N 0 3 409.515 4.259 20 0 HIADHN O=C(c1cccc(OCc2cn3ccccc3n2)c1)N1CCN(C2CCCCC2)CC1 ZINC000484116724 899740717 /nfs/dbraw/zinc/74/07/17/899740717.db2.gz QPXAAFMEZHRZEN-UHFFFAOYSA-N 0 3 418.541 4.004 20 0 HIADHN C[C@@H](NCc1ccc(-c2ccncc2)cc1)c1cccc(N2CCCS2(=O)=O)c1 ZINC000484127702 899748765 /nfs/dbraw/zinc/74/87/65/899748765.db2.gz IPOOWNHRIQXYMK-GOSISDBHSA-N 0 3 407.539 4.139 20 0 HIADHN Fc1ccc(N2CCOCC2)c(CN[C@H]2CCc3cc(Br)ccc32)c1 ZINC000484134566 899755440 /nfs/dbraw/zinc/75/54/40/899755440.db2.gz BTVSLRXBUSDRGI-IBGZPJMESA-N 0 3 405.311 4.202 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1ccnc(C2CC2)n1)c1ccc(C(F)(F)F)cc1 ZINC000484144329 899765166 /nfs/dbraw/zinc/76/51/66/899765166.db2.gz ZZRUXSUVPIIFQX-SFHVURJKSA-N 0 3 406.452 4.186 20 0 HIADHN CCN(Cc1ccc2ccccc2c1)C(=O)C(=O)Nc1cc(CN(C)C)ccc1C ZINC000484183279 899799412 /nfs/dbraw/zinc/79/94/12/899799412.db2.gz YFKIGERXQOSWJD-UHFFFAOYSA-N 0 3 403.526 4.197 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N[C@H]1CCSc2ccc(Cl)cc21 ZINC000484199557 899810393 /nfs/dbraw/zinc/81/03/93/899810393.db2.gz QKRMTWWOCPQMGP-KRWDZBQOSA-N 0 3 417.962 4.002 20 0 HIADHN CSc1cccc(N(C(=O)[C@@H](C)Oc2ccc(F)cc2)C2CCN(C)CC2)c1 ZINC000484278642 899847233 /nfs/dbraw/zinc/84/72/33/899847233.db2.gz FBXJKCUNPRFYKB-MRXNPFEDSA-N 0 3 402.535 4.442 20 0 HIADHN Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)N[C@@H](C(=O)N1CCOCC1)C(C)C ZINC000484302186 899863673 /nfs/dbraw/zinc/86/36/73/899863673.db2.gz PCDZJMIMUKXETM-RDTXWAMCSA-N 0 3 421.994 4.306 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)N1CCN(Cc2ccccc2Cl)CC1 ZINC000484302912 899865382 /nfs/dbraw/zinc/86/53/82/899865382.db2.gz BDJRUWSCPSDSCA-UHFFFAOYSA-N 0 3 411.933 4.106 20 0 HIADHN CC(C)(NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(Br)cc1 ZINC000505698263 914387590 /nfs/dbraw/zinc/38/75/90/914387590.db2.gz UHQKLGZZJNCTSI-LJQANCHMSA-N 0 3 416.363 4.258 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2nc(Cc3ccccc3)cs2)c1 ZINC000484349191 899897841 /nfs/dbraw/zinc/89/78/41/899897841.db2.gz YYZYBMWJYKVDHQ-UHFFFAOYSA-N 0 3 424.570 4.338 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)N[C@@H](CC(C)(C)C)C(F)(F)F)c1 ZINC000484353874 899903309 /nfs/dbraw/zinc/90/33/09/899903309.db2.gz UOUWVBSCFKCFMO-KRWDZBQOSA-N 0 3 403.489 4.136 20 0 HIADHN CSc1cccc(N(C(=O)c2ccn(-c3ccc(F)cc3)n2)C2CCN(C)CC2)c1 ZINC000484406153 899929384 /nfs/dbraw/zinc/92/93/84/899929384.db2.gz PRMVDVLLPYFFSS-UHFFFAOYSA-N 0 3 424.545 4.474 20 0 HIADHN O[C@@]1(CN[C@H](Cc2ccccc2F)c2ccccc2Br)CCSC1 ZINC000484473203 899966319 /nfs/dbraw/zinc/96/63/19/899966319.db2.gz MBGHRBUFRJCXHB-RTBURBONSA-N 0 3 410.352 4.330 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(-c2cccnc2)cc1)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000484473165 899966618 /nfs/dbraw/zinc/96/66/18/899966618.db2.gz MCEGFIPDUUHFOM-ZWKOTPCHSA-N 0 3 409.555 4.411 20 0 HIADHN CN1CCC[C@@H](N[C@H]2CCCc3nc(-c4ccc(Br)cc4)sc32)C1=O ZINC000484479813 899971637 /nfs/dbraw/zinc/97/16/37/899971637.db2.gz ZMYBZNLNFGCGFK-GOEBONIOSA-N 0 3 420.376 4.160 20 0 HIADHN CC[C@@H](NCc1ccccc1-n1nc(C)cc1C)c1ccccc1OCC(=O)N(C)C ZINC000484498503 899988535 /nfs/dbraw/zinc/98/85/35/899988535.db2.gz KQRGCCKEAUKFBQ-JOCHJYFZSA-N 0 3 420.557 4.197 20 0 HIADHN CC(C)([C@H](NCC[S@@](=O)c1ccccc1)c1ccc(F)c(F)c1)N1CCCC1 ZINC000484528845 900015632 /nfs/dbraw/zinc/01/56/32/900015632.db2.gz CQUQVJLDHLDWDY-LYZGTLIUSA-N 0 3 406.542 4.278 20 0 HIADHN Brc1cc2c(cc1CN[C@@H]1CCCC[C@@H]1n1cccn1)OCCCO2 ZINC000484614608 900070795 /nfs/dbraw/zinc/07/07/95/900070795.db2.gz KKTKCNBCIURJNO-SJORKVTESA-N 0 3 406.324 4.080 20 0 HIADHN CCc1nnc(C2CCN([C@H](C)c3nc(-c4cccc(C(F)(F)F)c4)no3)CC2)[nH]1 ZINC000484731961 900159201 /nfs/dbraw/zinc/15/92/01/900159201.db2.gz XHQYDPDZEZFAPR-GFCCVEGCSA-N 0 3 420.439 4.377 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CC[C@H](C(F)(F)F)C(C)(C)C3)c2)CC1 ZINC000484765294 900179416 /nfs/dbraw/zinc/17/94/16/900179416.db2.gz VNRFHZCHWOLDIV-SFHVURJKSA-N 0 3 412.500 4.271 20 0 HIADHN COc1ccc([C@H](NCCCc2ccccc2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000484778166 900189121 /nfs/dbraw/zinc/18/91/21/900189121.db2.gz DNUCAZNNZHICOR-DEOSSOPVSA-N 0 3 409.551 4.411 20 0 HIADHN COc1ccc([C@@H](NCCCc2ccccc2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000484778168 900189139 /nfs/dbraw/zinc/18/91/39/900189139.db2.gz DNUCAZNNZHICOR-XMMPIXPASA-N 0 3 409.551 4.411 20 0 HIADHN CN(CCNc1cc(C(F)(F)F)nc(-c2cccnc2)n1)Cc1ccc(F)cc1 ZINC000484827209 900230524 /nfs/dbraw/zinc/23/05/24/900230524.db2.gz FDJFVYNTTLQNRY-UHFFFAOYSA-N 0 3 405.399 4.240 20 0 HIADHN CN(C(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1)c1cnc2ccccc2n1 ZINC000484873424 900260822 /nfs/dbraw/zinc/26/08/22/900260822.db2.gz AUSMJBPEZJVBDP-OAQYLSRUSA-N 0 3 414.431 4.047 20 0 HIADHN Cn1c2ccccc2c(Cl)c1C(=O)NCC1(N2CCSCC2)CCCCC1 ZINC000484912465 900289489 /nfs/dbraw/zinc/28/94/89/900289489.db2.gz YDRSSDIDXLXLTH-UHFFFAOYSA-N 0 3 405.995 4.313 20 0 HIADHN Cc1ccccc1C1(CNC(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)CCOCC1 ZINC000484932492 900304581 /nfs/dbraw/zinc/30/45/81/900304581.db2.gz DPBBTJJKOBPYDM-NFBKMPQASA-N 0 3 409.574 4.034 20 0 HIADHN CCCOc1cn(-c2ccccc2)nc1C(=O)NC[C@H](c1ccccc1)N1CCCC1 ZINC000484957197 900321885 /nfs/dbraw/zinc/32/18/85/900321885.db2.gz FLNWBJJPGVROFE-JOCHJYFZSA-N 0 3 418.541 4.228 20 0 HIADHN COc1ccc(-c2nc(CN[C@@]3(CO)C[C@H](C)CC(C)(C)C3)cs2)c(OC)c1 ZINC000485066076 900390726 /nfs/dbraw/zinc/39/07/26/900390726.db2.gz FSXBEFLSXZZYSV-QRQCRPRQSA-N 0 3 404.576 4.494 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1ccc(F)cc1OCCC(F)(F)F ZINC000505780299 914446780 /nfs/dbraw/zinc/44/67/80/914446780.db2.gz YZIIPJAZYOVONU-UHFFFAOYSA-N 0 3 417.403 4.346 20 0 HIADHN CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)Nc1cc(F)ccc1OCC1CC1 ZINC000485286759 900564965 /nfs/dbraw/zinc/56/49/65/900564965.db2.gz GLYKZBUKYPUJDK-AVRDEDQJSA-N 0 3 412.509 4.166 20 0 HIADHN CC[C@H](C)n1ncc(NC(=O)NC[C@@H](c2cccc(OC)c2)N(CC)CC)c1C ZINC000485350950 900644350 /nfs/dbraw/zinc/64/43/50/900644350.db2.gz QVDLVFPDDAVXRJ-KKSFZXQISA-N 0 3 401.555 4.376 20 0 HIADHN Cc1nc(-c2ccc(Br)cc2)sc1[C@H](C)N[C@H]1CCCN(C)C1=O ZINC000485390281 900685446 /nfs/dbraw/zinc/68/54/46/900685446.db2.gz YEOYWEMEBHADAD-NHYWBVRUSA-N 0 3 408.365 4.152 20 0 HIADHN C[C@@H](NC(=O)NCc1nc2cc(Cl)ccc2s1)[C@@H](c1ccccc1)N(C)C ZINC000485399544 900697603 /nfs/dbraw/zinc/69/76/03/900697603.db2.gz GQNWFPRWCDHAPT-YJYMSZOUSA-N 0 3 402.951 4.440 20 0 HIADHN CC(C)CC(=O)Nc1cccc(CNC(=O)N[C@H]2CCN(Cc3ccccc3)[C@@H]2C)c1 ZINC000485408813 900706196 /nfs/dbraw/zinc/70/61/96/900706196.db2.gz VNHRLZJIUFCEDG-XXBNENTESA-N 0 3 422.573 4.133 20 0 HIADHN C[C@@H](c1ccc([S@](C)=O)cc1)N(C)CCC(=O)Nc1ccccc1C(F)(F)F ZINC000485413500 900712947 /nfs/dbraw/zinc/71/29/47/900712947.db2.gz YQFMXTGDKZJFTO-POXGOYDTSA-N 0 3 412.477 4.464 20 0 HIADHN O=C(Nc1ccc(C(=O)NCCN2CCCC2)cc1)c1ccc(-c2ccc(F)cc2)o1 ZINC000485492468 900782932 /nfs/dbraw/zinc/78/29/32/900782932.db2.gz DGXDXDWWSFZKPS-UHFFFAOYSA-N 0 3 421.472 4.164 20 0 HIADHN O=C(Nc1ccc(C(=O)NCCN2CCCC2)cc1)c1cc(Cl)sc1Cl ZINC000485523810 900806447 /nfs/dbraw/zinc/80/64/47/900806447.db2.gz CILFMYKXHJODEM-UHFFFAOYSA-N 0 3 412.342 4.133 20 0 HIADHN C[C@H]1CN(C2CCOCC2)CCN1C(=O)NCCC(c1ccccc1)c1ccccc1 ZINC000485579636 900846426 /nfs/dbraw/zinc/84/64/26/900846426.db2.gz FUURNCHXDYHCKV-NRFANRHFSA-N 0 3 421.585 4.103 20 0 HIADHN O=C(NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)N[C@@H]1CCCc2cn[nH]c21 ZINC000485598495 900858349 /nfs/dbraw/zinc/85/83/49/900858349.db2.gz GTHLVHJAXVCVTJ-GOSISDBHSA-N 0 3 422.360 4.058 20 0 HIADHN CCOc1cc(CN2CC[C@@H](c3ccccc3)[C@H](C)C2)nc2nc(C(F)(F)F)nn21 ZINC000485691511 900941840 /nfs/dbraw/zinc/94/18/40/900941840.db2.gz XZGWJMHKSAXICT-RHSMWYFYSA-N 0 3 419.451 4.167 20 0 HIADHN CCOc1cc(CN2CC[C@H](c3ccccc3)[C@H](C)C2)nc2nc(C(F)(F)F)nn21 ZINC000485691509 900942464 /nfs/dbraw/zinc/94/24/64/900942464.db2.gz XZGWJMHKSAXICT-PBHICJAKSA-N 0 3 419.451 4.167 20 0 HIADHN CCCN(Cc1nc2ccc(Br)cc2n1C)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000485819385 901068012 /nfs/dbraw/zinc/06/80/12/901068012.db2.gz XKMSURCPGAREPV-ZMYBRWDISA-N 0 3 406.368 4.361 20 0 HIADHN C[C@H]1CCCCCN1CC(=O)N(Cc1nnc(-c2ccccc2Cl)o1)C1CC1 ZINC000485885681 901121070 /nfs/dbraw/zinc/12/10/70/901121070.db2.gz VXALPUJYUCAPKE-HNNXBMFYSA-N 0 3 402.926 4.146 20 0 HIADHN C[C@@H]1CC(=O)CC[C@H]1C(=O)N1CCC(N(C)Cc2cccc(C(F)(F)F)c2)CC1 ZINC000485945810 901165943 /nfs/dbraw/zinc/16/59/43/901165943.db2.gz QPKUDXTXVYRRBK-FOIQADDNSA-N 0 3 410.480 4.134 20 0 HIADHN Cc1nc2sc3c(c2c(N(C)C[C@@H]2CCN(C)[C@H]2c2cccnc2)n1)CCCC3 ZINC000486031825 901235837 /nfs/dbraw/zinc/23/58/37/901235837.db2.gz UXOGEWCIAPKXQH-UWJYYQICSA-N 0 3 407.587 4.403 20 0 HIADHN CCCN(C(=O)c1ccc2c(c1)SCC(=O)N2)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000486032084 901236188 /nfs/dbraw/zinc/23/61/88/901236188.db2.gz WBFPYUHDJJKEDN-HXUWFJFHSA-N 0 3 423.582 4.248 20 0 HIADHN C[C@H](NC[C@H](c1ccccc1)C(F)(F)F)c1cccc(N2CCCS2(=O)=O)c1 ZINC000486069832 901261966 /nfs/dbraw/zinc/26/19/66/901261966.db2.gz OCWTUWPYBUNJSS-HNAYVOBHSA-N 0 3 412.477 4.223 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)c2ccc(-c3noc(C(F)F)n3)cc2)C1 ZINC000486222965 901405174 /nfs/dbraw/zinc/40/51/74/901405174.db2.gz ZLVIDSPAMFIEAA-KBXCAEBGSA-N 0 3 412.440 4.240 20 0 HIADHN O=C(Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)[C@@H]1[C@@H](c2ccccc2)C1(F)F ZINC000486302814 901482431 /nfs/dbraw/zinc/48/24/31/901482431.db2.gz GCAYEKRFFHKWGH-NNWRFLSQSA-N 0 3 422.479 4.318 20 0 HIADHN COc1ccc(CNC(=O)N(Cc2ccccc2)C2CCN(C)CC2)cc1Cl ZINC000486305058 901485810 /nfs/dbraw/zinc/48/58/10/901485810.db2.gz SHADMDJXMSRIHM-UHFFFAOYSA-N 0 3 401.938 4.155 20 0 HIADHN C[C@@H](CNC(=O)N(Cc1ccccc1)C1CCN(C)CC1)Oc1ccccc1Cl ZINC000486414305 901573487 /nfs/dbraw/zinc/57/34/87/901573487.db2.gz WATWYIUUZCAZSK-SFHVURJKSA-N 0 3 415.965 4.413 20 0 HIADHN C[C@H](CNC(=O)N(Cc1ccccc1)C1CCN(C)CC1)Oc1ccccc1Cl ZINC000486414303 901573900 /nfs/dbraw/zinc/57/39/00/901573900.db2.gz WATWYIUUZCAZSK-GOSISDBHSA-N 0 3 415.965 4.413 20 0 HIADHN Cc1ccc(F)c(C(=O)Nc2ccc(OC3CCN(C)CC3)nc2)c1Br ZINC000486436595 901594549 /nfs/dbraw/zinc/59/45/49/901594549.db2.gz SKYUWZHMOYXQAO-UHFFFAOYSA-N 0 3 422.298 4.017 20 0 HIADHN Brc1ccccc1CN1C[C@H]2CCC[C@@]2(c2nc(CC3CC3)no2)C1 ZINC000486443843 901602107 /nfs/dbraw/zinc/60/21/07/901602107.db2.gz IGDDFSDFYKXHAN-OXQOHEQNSA-N 0 3 402.336 4.338 20 0 HIADHN Fc1cccc2[nH]c(CN3C[C@H]4CCC[C@@]4(c4nc(-c5cccnc5)no4)C3)cc21 ZINC000486455045 901613559 /nfs/dbraw/zinc/61/35/59/901613559.db2.gz AQAFXFBIGCIFPQ-WAIKUNEKSA-N 0 3 403.461 4.306 20 0 HIADHN C[S@](=O)c1ccc(CN2C[C@H]3CCC[C@@]3(c3nc(-c4ccccc4)no3)C2)cc1 ZINC000486464404 901624312 /nfs/dbraw/zinc/62/43/12/901624312.db2.gz GCINVLFHNRGPCU-CERFGUIQSA-N 0 3 407.539 4.028 20 0 HIADHN Cc1nn(C)c(C)c1[C@H](C)C(=O)N[C@@H](c1ccc(F)c(F)c1)C(C)(C)N1CCCC1 ZINC000486584705 901725004 /nfs/dbraw/zinc/72/50/04/901725004.db2.gz IBCNCDRXSHMUNE-QKKBWIMNSA-N 0 3 418.532 4.151 20 0 HIADHN CCCN(CCC)C(=O)c1cccc(C(=O)NC[C@H](c2ccc(C)cc2)N(C)C)c1 ZINC000486697373 901800148 /nfs/dbraw/zinc/80/01/48/901800148.db2.gz FMAYFBSFIKVPDI-HSZRJFAPSA-N 0 3 409.574 4.290 20 0 HIADHN CN(C)Cc1ccccc1C(=O)NCCCOc1ncc(C(F)(F)F)cc1Cl ZINC000486793700 901857885 /nfs/dbraw/zinc/85/78/85/901857885.db2.gz JSACCFHIKBOEGL-UHFFFAOYSA-N 0 3 415.843 4.014 20 0 HIADHN COCCSCCCN1CCc2cc(OC)c(OC)cc2[C@H]1c1cccs1 ZINC000486811321 901868989 /nfs/dbraw/zinc/86/89/89/901868989.db2.gz LNPLFGIFILHLKY-NRFANRHFSA-N 0 3 407.601 4.483 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N2C[C@H](c3ccccc3)[C@@H]3CCCC[C@@H]32)CC1 ZINC000486878531 901924315 /nfs/dbraw/zinc/92/43/15/901924315.db2.gz ITAMWDRBKYPUDD-VXNXHJTFSA-N 0 3 413.606 4.244 20 0 HIADHN CCCOc1cn(-c2ccccc2)nc1C(=O)N(CCN(C)C)Cc1ccccc1F ZINC000487007728 902011064 /nfs/dbraw/zinc/01/10/64/902011064.db2.gz CHIAZPZUUPFLIB-UHFFFAOYSA-N 0 3 424.520 4.004 20 0 HIADHN Cc1ccc(CNCc2ccc(-c3ccc(Br)cc3)s2)c(=O)n1C ZINC000487171290 902084400 /nfs/dbraw/zinc/08/44/00/902084400.db2.gz ILYRRXNGTDOWIH-UHFFFAOYSA-N 0 3 403.345 4.475 20 0 HIADHN FC(F)(F)c1cnc(N2CC[C@H](NCc3scnc3C3CC3)C2)c(Cl)c1 ZINC000487313753 902148381 /nfs/dbraw/zinc/14/83/81/902148381.db2.gz BKYSTGBVFSMOME-LBPRGKRZSA-N 0 3 402.873 4.456 20 0 HIADHN Cc1nc(-c2ccc(C)cc2NC(=O)CN[C@H](c2ccc(F)cc2)C2CCC2)n[nH]1 ZINC000487366949 902163292 /nfs/dbraw/zinc/16/32/92/902163292.db2.gz RHTKBJWZLBZUCJ-QFIPXVFZSA-N 0 3 407.493 4.297 20 0 HIADHN CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)N1CCC(Cc2ccccc2)CC1 ZINC000487368989 902164885 /nfs/dbraw/zinc/16/48/85/902164885.db2.gz CHNJQXPDKJVPOL-ZEQRLZLVSA-N 0 3 406.574 4.081 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1Cc1nc(-c2cc(F)c(F)c(F)c2)no1 ZINC000487408382 902189634 /nfs/dbraw/zinc/18/96/34/902189634.db2.gz CGAQNVHBDYNESF-HNNXBMFYSA-N 0 3 416.447 4.250 20 0 HIADHN Cc1nc(-c2ccc(C)cc2NC(=O)CN2CCC[C@@H]2CCc2ccccc2)n[nH]1 ZINC000487418321 902201119 /nfs/dbraw/zinc/20/11/19/902201119.db2.gz XLLNCSDUNXQKMR-HXUWFJFHSA-N 0 3 403.530 4.124 20 0 HIADHN CCN(C(=O)c1cc2c(cc1F)NC(=O)CC2)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000488099036 902601926 /nfs/dbraw/zinc/60/19/26/902601926.db2.gz PURHCISXNZXXDQ-LPHOPBHVSA-N 0 3 409.505 4.008 20 0 HIADHN Brc1ccc(CC2(NCc3nnc4n3CCCC4)CCCCC2)cc1 ZINC000488130394 902628651 /nfs/dbraw/zinc/62/86/51/902628651.db2.gz PIXGGNBZUNLHNK-UHFFFAOYSA-N 0 3 403.368 4.412 20 0 HIADHN Cc1ccc(NC(=O)C2(CNC(=O)c3cccc(CN(C)C)c3)CCCC2)cc1C ZINC000488256771 902730539 /nfs/dbraw/zinc/73/05/39/902730539.db2.gz ATVSUPMUIGUCOT-UHFFFAOYSA-N 0 3 407.558 4.294 20 0 HIADHN C[C@@H](NC(=O)N[C@H](CC1CC1)c1cc(F)cc(Br)c1)C1=CCN(C)CC1 ZINC000488508984 902862147 /nfs/dbraw/zinc/86/21/47/902862147.db2.gz CCUHXGKZMYYUHR-BFUOFWGJSA-N 0 3 424.358 4.379 20 0 HIADHN CN(CCCc1cc(-c2ccc(F)cc2)n[nH]1)[C@H]1CCN(c2ccccc2F)C1=O ZINC000488590555 902892360 /nfs/dbraw/zinc/89/23/60/902892360.db2.gz DVAJUSWHWJYDPT-QFIPXVFZSA-N 0 3 410.468 4.025 20 0 HIADHN COc1ccc(C2(C(=O)Nc3cccc(CN4CCC(O)CC4)c3)CCCCC2)cc1 ZINC000488672717 902932627 /nfs/dbraw/zinc/93/26/27/902932627.db2.gz FCNZADUAHBOZNN-UHFFFAOYSA-N 0 3 422.569 4.493 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)c1ccc(Oc2cccnc2)cc1 ZINC000488705383 902954556 /nfs/dbraw/zinc/95/45/56/902954556.db2.gz WREUFHOFCUCQAL-UHFFFAOYSA-N 0 3 403.482 4.083 20 0 HIADHN COCCN(C(=O)c1ccc(N2CCN(C(C)C)CC2)cc1)[C@@H](C)c1ccccc1 ZINC000488823154 903025067 /nfs/dbraw/zinc/02/50/67/903025067.db2.gz DJZRRDCRPFKKCP-NRFANRHFSA-N 0 3 409.574 4.067 20 0 HIADHN Cc1c(COC(C)(C)C)cccc1NC(=O)N1CCN(C2CCOCC2)C[C@@H]1C ZINC000488893715 903062970 /nfs/dbraw/zinc/06/29/70/903062970.db2.gz HIRJPFDNAJMALG-KRWDZBQOSA-N 0 3 403.567 4.027 20 0 HIADHN CCOC1(C)CCN(C(=O)N[C@@H](CN2CCc3ccccc3C2)C(C)(C)C)CC1 ZINC000489046492 903152444 /nfs/dbraw/zinc/15/24/44/903152444.db2.gz RVNYPUMAGDZHNO-NRFANRHFSA-N 0 3 401.595 4.060 20 0 HIADHN CC[C@@H](C)[C@@](C)(O)CNCc1cc(Br)cc(Br)c1OC ZINC000489062561 903165063 /nfs/dbraw/zinc/16/50/63/903165063.db2.gz GNQGOFIOLCYAAL-BMIGLBTASA-N 0 3 409.162 4.107 20 0 HIADHN O[C@@H](COc1cccc2[nH]ccc21)CN1CCC[C@@H](c2nc3c(s2)CCCC3)C1 ZINC000489108094 903201083 /nfs/dbraw/zinc/20/10/83/903201083.db2.gz ZBWXDZBRWHWCFT-IAGOWNOFSA-N 0 3 411.571 4.123 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2ccc(C)c(C(=O)N(C)C(C)C)c2)N(C)C)cc1 ZINC000489130241 903219249 /nfs/dbraw/zinc/21/92/49/903219249.db2.gz NXIIYIIFHSTUKJ-JOCHJYFZSA-N 0 3 410.562 4.208 20 0 HIADHN Cc1cccc2[nH]cc(CCNC(=O)N(Cc3ccccc3)C3CCN(C)CC3)c21 ZINC000489152328 903234533 /nfs/dbraw/zinc/23/45/33/903234533.db2.gz XUNAEYLEOOXAQT-UHFFFAOYSA-N 0 3 404.558 4.325 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)NCc1ccc(Br)c(F)c1)c1ccco1 ZINC000489177245 903245169 /nfs/dbraw/zinc/24/51/69/903245169.db2.gz QNHFKHTYGZXYQA-BLLLJJGKSA-N 0 3 412.303 4.110 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)N[C@H](c1ccccc1)C1CCCC1 ZINC000489270609 903298271 /nfs/dbraw/zinc/29/82/71/903298271.db2.gz OCBMCXCYIURZCV-RUZDIDTESA-N 0 3 421.585 4.374 20 0 HIADHN Cc1cc(N2CCCCCC2)ccc1NC(=O)N1CCN(C2CCOCC2)C[C@@H]1C ZINC000489418892 903375650 /nfs/dbraw/zinc/37/56/50/903375650.db2.gz RXSSFFGQCKFVAW-FQEVSTJZSA-N 0 3 414.594 4.092 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3cnn(-c4ccccc4)c3C(C)C)cc2)CC1 ZINC000489444705 903386976 /nfs/dbraw/zinc/38/69/76/903386976.db2.gz FNMUOGJEUOAGPZ-UHFFFAOYSA-N 0 3 417.557 4.390 20 0 HIADHN CO[C@@H](CNC(=O)N(Cc1ccccc1)C1CCN(C)CC1)c1ccc(Cl)cc1 ZINC000489507710 903430230 /nfs/dbraw/zinc/43/02/30/903430230.db2.gz JDBQOQCXTORLKW-QFIPXVFZSA-N 0 3 415.965 4.334 20 0 HIADHN Cc1cc(C(C)(C)C)cc2c1OCCC[C@@H]2NCc1cccnc1N1CCN(C)CC1 ZINC000489558045 903464885 /nfs/dbraw/zinc/46/48/85/903464885.db2.gz NKMPRXVPPAVVDO-QHCPKHFHSA-N 0 3 422.617 4.443 20 0 HIADHN Cc1ccc(NC(=O)NC[C@H]2CN(Cc3ccccc3)CCCO2)cc1OC(C)C ZINC000489587318 903479759 /nfs/dbraw/zinc/47/97/59/903479759.db2.gz DNFDQVBLKFGHHE-QFIPXVFZSA-N 0 3 411.546 4.195 20 0 HIADHN Cc1ccccc1[C@@H](NC(=O)NCCCCN1CCN(c2ccccc2)CC1)C1CC1 ZINC000489619256 903500961 /nfs/dbraw/zinc/50/09/61/903500961.db2.gz HABPDGDAOYHSAT-VWLOTQADSA-N 0 3 420.601 4.348 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1cc(-c2ccsc2)nn1C ZINC000489710771 903553132 /nfs/dbraw/zinc/55/31/32/903553132.db2.gz FQJNUQHPYYVWHS-KRWDZBQOSA-N 0 3 409.559 4.277 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3cc(-c4ccsc4)nn3C)c(C)c2)CC1 ZINC000489722227 903558623 /nfs/dbraw/zinc/55/86/23/903558623.db2.gz RQDFBWZIZRQAGK-UHFFFAOYSA-N 0 3 424.574 4.243 20 0 HIADHN CCc1ccc([C@H](NC(=O)NCc2ccccc2CN2CCC(O)CC2)C(C)C)cc1 ZINC000489755986 903582410 /nfs/dbraw/zinc/58/24/10/903582410.db2.gz DMSDKXXFMIUEIL-RUZDIDTESA-N 0 3 423.601 4.402 20 0 HIADHN CC(C)c1ccc([C@H](NC(=O)N2CC[C@@H](N3CCN(C)CC3)[C@@H](C)C2)C(C)C)cc1 ZINC000489867542 903640282 /nfs/dbraw/zinc/64/02/82/903640282.db2.gz AXJJDRKMSMELJP-TUACAJSNSA-N 0 3 414.638 4.175 20 0 HIADHN Cc1cccc2c1[C@H](C)C[C@@H]2CC(=O)Nc1ccccc1CN1CCC[C@@H](C(N)=O)C1 ZINC000489909158 903666772 /nfs/dbraw/zinc/66/67/72/903666772.db2.gz GRQSDDFJRRSULD-HMXCVIKNSA-N 0 3 419.569 4.312 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)NC[C@H]1SCCc2ccccc21 ZINC000489929038 903683263 /nfs/dbraw/zinc/68/32/63/903683263.db2.gz YFVKEFXCMGNGIM-UYAOXDASSA-N 0 3 401.601 4.215 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)NC[C@@H]1SCCc2ccccc21 ZINC000489929036 903683426 /nfs/dbraw/zinc/68/34/26/903683426.db2.gz YFVKEFXCMGNGIM-ICSRJNTNSA-N 0 3 401.601 4.215 20 0 HIADHN Cc1cc(CC(C)(C)NC(=O)N[C@H](C)C2=CCN(C)CC2)ccc1Br ZINC000489978217 903709470 /nfs/dbraw/zinc/70/94/70/903709470.db2.gz BWUITMVBUTXIOB-OAHLLOKOSA-N 0 3 408.384 4.028 20 0 HIADHN C[C@H](NC(=O)N[C@H]1c2cc(Br)ccc2CC1(C)C)C1=CCN(C)CC1 ZINC000489998947 903717533 /nfs/dbraw/zinc/71/75/33/903717533.db2.gz QSDWPWHPQVSEQP-UGSOOPFHSA-N 0 3 406.368 4.022 20 0 HIADHN CCCN(CCC(=O)N1CCc2ccccc2C1)[C@@H](C)C(=O)Nc1ccccc1C ZINC000490025651 903730117 /nfs/dbraw/zinc/73/01/17/903730117.db2.gz IEXGIRCFVSFAHL-FQEVSTJZSA-N 0 3 407.558 4.009 20 0 HIADHN Cc1ccc([C@@H]2C[C@@H](C)N(CC(=O)N3CCC(C(=O)Nc4ccccc4)CC3)C2)cc1 ZINC000490079189 903761000 /nfs/dbraw/zinc/76/10/00/903761000.db2.gz JUEFVEUGORFFEW-NFBKMPQASA-N 0 3 419.569 4.050 20 0 HIADHN Cc1ccc([C@H](NC[C@@H](CC(C)C)N(C)C)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000490139047 903787646 /nfs/dbraw/zinc/78/76/46/903787646.db2.gz YEEUBMXXMVOWBQ-ZJSXRUAMSA-N 0 3 416.631 4.362 20 0 HIADHN Cc1ccc([C@@H](NC[C@@H](CC(C)C)N(C)C)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000490139038 903787996 /nfs/dbraw/zinc/78/79/96/903787996.db2.gz YEEUBMXXMVOWBQ-QPPBQGQZSA-N 0 3 416.631 4.362 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)Nc1ccc(Oc2ccccc2F)nc1 ZINC000490160258 903801458 /nfs/dbraw/zinc/80/14/58/903801458.db2.gz XOIICAONXCAZBB-UHFFFAOYSA-N 0 3 409.465 4.004 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)Nc2ccc(Oc3ccccc3F)nc2)CC1 ZINC000490194597 903819721 /nfs/dbraw/zinc/81/97/21/903819721.db2.gz NQBZVZUMVORYJH-UHFFFAOYSA-N 0 3 416.497 4.024 20 0 HIADHN COc1cccc(CO[C@@H](C)C(=O)NC[C@H](c2ccccc2)N2CCC(C)CC2)c1 ZINC000490218674 903833962 /nfs/dbraw/zinc/83/39/62/903833962.db2.gz UEVQQOLYCDLSHY-GBXCKJPGSA-N 0 3 410.558 4.190 20 0 HIADHN CCNC(=O)Nc1ccc(C)c(NC(=O)NC[C@@H](c2cccs2)N2CCCC2)c1 ZINC000490320960 903901992 /nfs/dbraw/zinc/90/19/92/903901992.db2.gz IATBTJWINSXRGN-SFHVURJKSA-N 0 3 415.563 4.157 20 0 HIADHN CCNC(=O)Nc1ccc(C)c(NC(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)c1 ZINC000490352898 903945772 /nfs/dbraw/zinc/94/57/72/903945772.db2.gz KHQBLBKOOWKMIX-LJQANCHMSA-N 0 3 423.561 4.265 20 0 HIADHN Fc1ccc(Br)c2c1CC[C@@H]2NCCCn1cc(Br)cn1 ZINC000490375235 903968262 /nfs/dbraw/zinc/96/82/62/903968262.db2.gz VFTGEOSNAIRZPU-AWEZNQCLSA-N 0 3 417.120 4.214 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NC[C@H]3CCCCC(F)(F)C3)c(C)c2)CC1 ZINC000490705423 904181352 /nfs/dbraw/zinc/18/13/52/904181352.db2.gz OENQAYDANQKYFD-SFHVURJKSA-N 0 3 408.537 4.474 20 0 HIADHN Cc1ccc(-c2nc(CCNC(=O)N[C@@H]3CCN(Cc4ccccc4)[C@H]3C)co2)cc1 ZINC000490715967 904189054 /nfs/dbraw/zinc/18/90/54/904189054.db2.gz FWYUDSXHZJCPFE-WMZHIEFXSA-N 0 3 418.541 4.155 20 0 HIADHN COc1ccccc1-c1ncc(CNCCc2coc(-c3ccc(C)cc3)n2)cn1 ZINC000490758977 904214051 /nfs/dbraw/zinc/21/40/51/904214051.db2.gz NWSZRIRTWTVULH-UHFFFAOYSA-N 0 3 400.482 4.448 20 0 HIADHN Cc1cc(C)n(-c2ccc(C(F)(F)F)cc2NC(=O)N2CC[C@H]3CCN(C)C[C@H]32)n1 ZINC000490764217 904216595 /nfs/dbraw/zinc/21/65/95/904216595.db2.gz SKYLSDOBFKAUPC-DNVCBOLYSA-N 0 3 421.467 4.066 20 0 HIADHN CN(C)C[C@H](NC(=O)N[C@H](c1c[nH]c2ccccc21)C(F)(F)F)c1ccccc1 ZINC000490787534 904234331 /nfs/dbraw/zinc/23/43/31/904234331.db2.gz AHKUWWDVYVDAOP-RBUKOAKNSA-N 0 3 404.436 4.373 20 0 HIADHN C[C@H](CNCc1cnnn1Cc1ccccc1)Sc1ccc(Br)cc1 ZINC000490895561 904306823 /nfs/dbraw/zinc/30/68/23/904306823.db2.gz URDVTZMIZHYJQT-OAHLLOKOSA-N 0 3 417.376 4.359 20 0 HIADHN CN(CCNC(=O)N1CCCC[C@H]1c1nc(-c2ccccc2)no1)Cc1ccccc1 ZINC000490931295 904324093 /nfs/dbraw/zinc/32/40/93/904324093.db2.gz DXXUNKQPJBLRJX-NRFANRHFSA-N 0 3 419.529 4.105 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)NCc2cc(-c3ccccc3)on2)N(C)C)cc1 ZINC000490986217 904351516 /nfs/dbraw/zinc/35/15/16/904351516.db2.gz DKHPSWQTNJNGCS-JOCHJYFZSA-N 0 3 422.529 4.231 20 0 HIADHN CN(C)C(=O)C1CCN(Cc2cn(-c3ccccc3)nc2-c2ccc(Cl)cc2)CC1 ZINC000506112288 914808477 /nfs/dbraw/zinc/80/84/77/914808477.db2.gz GWIFZXPBTPIRDX-UHFFFAOYSA-N 0 3 422.960 4.493 20 0 HIADHN CSc1cccc([C@@H](N[C@@H](C)CN2CCN(C)CC2)c2cc(F)ccc2F)c1 ZINC000491019381 904372187 /nfs/dbraw/zinc/37/21/87/904372187.db2.gz KTKQEQUOIKZYCP-KSFYIVLOSA-N 0 3 405.558 4.002 20 0 HIADHN CCOc1ccc([C@H](NC[C@@H](C)N2CCN(C)CC2)c2ccccc2Cl)cc1 ZINC000491026862 904378081 /nfs/dbraw/zinc/37/80/81/904378081.db2.gz ZGIUYTLSCAZSDZ-JPYJTQIMSA-N 0 3 401.982 4.054 20 0 HIADHN COCCN1CCC[C@H]1CN[C@H](c1ccc(OC)c(OC)c1)c1ccccc1Cl ZINC000491027460 904379838 /nfs/dbraw/zinc/37/98/38/904379838.db2.gz BABDXGJCLLDYAD-FDDCHVKYSA-N 0 3 418.965 4.147 20 0 HIADHN CCN(CC)C[C@@H](C)N[C@@H](c1cccc(S(C)(=O)=O)c1)c1ccc(C)cc1C ZINC000491035353 904387600 /nfs/dbraw/zinc/38/76/00/904387600.db2.gz JJNVVBUCEQUTDN-XXBNENTESA-N 0 3 402.604 4.116 20 0 HIADHN CSc1cccc([C@@H](NC[C@@H](C)N2CCN(C)CC2)c2cc(F)ccc2F)c1 ZINC000491036728 904389726 /nfs/dbraw/zinc/38/97/26/904389726.db2.gz ZFZHGITYTADRPI-OPAMFIHVSA-N 0 3 405.558 4.002 20 0 HIADHN CC[C@@H](C)N(C)CCN[C@@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000491050965 904395640 /nfs/dbraw/zinc/39/56/40/904395640.db2.gz IKNXKYNMIJFFCD-IERDGZPVSA-N 0 3 408.995 4.153 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1 ZINC000491073587 904411177 /nfs/dbraw/zinc/41/11/77/904411177.db2.gz DVJICLNKRBZJPT-FQEVSTJZSA-N 0 3 416.569 4.155 20 0 HIADHN Cc1nn(-c2ccc(F)cc2F)c(C)c1CN1CCC[C@@H](c2nnc3ccccn32)C1 ZINC000506129203 914815096 /nfs/dbraw/zinc/81/50/96/914815096.db2.gz SOGMVYWDIRLCMZ-QGZVFWFLSA-N 0 3 422.483 4.190 20 0 HIADHN CCN1CC[C@@H](NCc2cnnn2Cc2ccccc2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000491271198 904512953 /nfs/dbraw/zinc/51/29/53/904512953.db2.gz LZEZVMGITMMQLQ-YADHBBJMSA-N 0 3 413.928 4.044 20 0 HIADHN CN(Cc1cn(-c2ccccc2)nc1-c1cccs1)C(=O)[C@@H]1CCCN1C1CC1 ZINC000491286776 904518585 /nfs/dbraw/zinc/51/85/85/904518585.db2.gz WYYOXWCYDMPFDE-FQEVSTJZSA-N 0 3 406.555 4.186 20 0 HIADHN COc1ccc(OC)c(CN2CCC[C@H](c3nnc4ccc(C(F)(F)F)cn43)C2)c1 ZINC000506136987 914819035 /nfs/dbraw/zinc/81/90/35/914819035.db2.gz NDAQJIXAPNHGJF-AWEZNQCLSA-N 0 3 420.435 4.145 20 0 HIADHN COc1ccccc1-c1ncc(CN[C@@H]2CCN(C)[C@@H]2c2ccc(Cl)cc2)cn1 ZINC000491308995 904529050 /nfs/dbraw/zinc/52/90/50/904529050.db2.gz IUZJOLMRRUCFCY-IFMALSPDSA-N 0 3 408.933 4.341 20 0 HIADHN COc1ccccc1-c1ncc(CN[C@H]2CCN(C)[C@H]2c2ccc(Cl)cc2)cn1 ZINC000491309002 904529140 /nfs/dbraw/zinc/52/91/40/904529140.db2.gz IUZJOLMRRUCFCY-UNMCSNQZSA-N 0 3 408.933 4.341 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)Nc3ccc(Cc4nc5ccccc5s4)cc3)[C@@H]2C1 ZINC000491316250 904534332 /nfs/dbraw/zinc/53/43/32/904534332.db2.gz LCJKAKWMFQDIIO-FXAWDEMLSA-N 0 3 406.555 4.445 20 0 HIADHN NS(=O)(=O)c1ccc(CCN[C@@H](c2cccc(F)c2)c2cccc(Cl)c2)cc1 ZINC000491331687 904541064 /nfs/dbraw/zinc/54/10/64/904541064.db2.gz YWRXFEXHHNWQCK-OAQYLSRUSA-N 0 3 418.921 4.048 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](NCCc2ccc(F)cc2)c2ccc(F)cc2)c1 ZINC000491341572 904546133 /nfs/dbraw/zinc/54/61/33/904546133.db2.gz DUPCADANEIVFSB-JOCHJYFZSA-N 0 3 401.478 4.290 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](NCCc2ccc(F)cc2)c2ccc(F)cc2)c1 ZINC000491341573 904546428 /nfs/dbraw/zinc/54/64/28/904546428.db2.gz DUPCADANEIVFSB-QFIPXVFZSA-N 0 3 401.478 4.290 20 0 HIADHN Cc1ccc([C@@H](NC[C@@H](c2ccccc2)N(C)C)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000491343598 904548484 /nfs/dbraw/zinc/54/84/84/904548484.db2.gz PKTPCFMSDIGBNK-LOSJGSFVSA-N 0 3 422.594 4.380 20 0 HIADHN CC(C)N(CCN[C@H](c1cccc(S(C)(=O)=O)c1)c1cc(F)ccc1F)C(C)C ZINC000491356456 904553448 /nfs/dbraw/zinc/55/34/48/904553448.db2.gz NFKAZBRVKRJBDA-JOCHJYFZSA-N 0 3 424.557 4.166 20 0 HIADHN COc1ccc([C@@H](NCc2ccccc2CN2CCOCC2)c2ccccc2)cc1 ZINC000491421551 904586503 /nfs/dbraw/zinc/58/65/03/904586503.db2.gz FKTATNXNWVOALU-SANMLTNESA-N 0 3 402.538 4.407 20 0 HIADHN CN(C)C1(CN[C@@H](c2ccc(F)cc2)c2cccc(S(C)(=O)=O)c2)CCCCC1 ZINC000491425020 904589996 /nfs/dbraw/zinc/58/99/96/904589996.db2.gz YTCLOQAHYGPNNW-QFIPXVFZSA-N 0 3 418.578 4.173 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)Nc2cc(F)c(OC(F)F)cc2F)CN1Cc1ccccc1 ZINC000491472752 904615199 /nfs/dbraw/zinc/61/51/99/904615199.db2.gz XQTYAWXDLGPEIW-GXTWGEPZSA-N 0 3 411.399 4.351 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)Nc2ccc(C(=O)NCC(C)C)cc2C)c1 ZINC000491489640 904619887 /nfs/dbraw/zinc/61/98/87/904619887.db2.gz BLDLEUHIVDFUES-UHFFFAOYSA-N 0 3 424.589 4.285 20 0 HIADHN COc1ccc(NC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)c(OC)c1 ZINC000491522613 904636078 /nfs/dbraw/zinc/63/60/78/904636078.db2.gz XPGSNSIHSAFPLD-HXUWFJFHSA-N 0 3 408.420 4.097 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)Nc2ccc(OC[C@H]3CCCO3)cc2)c1 ZINC000491522829 904636299 /nfs/dbraw/zinc/63/62/99/904636299.db2.gz AVULMDBHYLDBMA-HSZRJFAPSA-N 0 3 411.546 4.149 20 0 HIADHN O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCC[C@@H](c2nc3ccc(F)cc3o2)C1 ZINC000506166774 914830525 /nfs/dbraw/zinc/83/05/25/914830525.db2.gz QDLGFTWSENALSW-QUCCMNQESA-N 0 3 422.504 4.130 20 0 HIADHN COCCOc1ccc(NC(=O)N(CCN(C)C)Cc2cccc(C)c2)cc1Cl ZINC000491555789 904649526 /nfs/dbraw/zinc/64/95/26/904649526.db2.gz CSQGKTFNDLIGSR-UHFFFAOYSA-N 0 3 419.953 4.269 20 0 HIADHN CN(C)[C@@H](CNC(=O)N(Cc1csc(Br)c1)C1CC1)c1ccccc1 ZINC000506169632 914831230 /nfs/dbraw/zinc/83/12/30/914831230.db2.gz BADMVEOYWICQSX-KRWDZBQOSA-N 0 3 422.392 4.488 20 0 HIADHN Cn1cc(CN[C@@H](Cc2ccc(F)cc2)[C@H]2COc3ccccc3O2)c(C(F)F)n1 ZINC000492004987 904759774 /nfs/dbraw/zinc/75/97/74/904759774.db2.gz XZGHJTZQRCEUEF-FXAWDEMLSA-N 0 3 417.431 4.038 20 0 HIADHN NC(=O)[C@@H]1CCCN1CCCNC(c1ccccc1Cl)c1ccccc1Cl ZINC000492198776 904814102 /nfs/dbraw/zinc/81/41/02/904814102.db2.gz ZGQZHOFPCMXDBR-IBGZPJMESA-N 0 3 406.357 4.012 20 0 HIADHN CCc1ccc([C@H](NC[C@@](C)(O)[C@H](C)CC)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000492223267 904818032 /nfs/dbraw/zinc/81/80/32/904818032.db2.gz KPKHAVKBHBDWGT-MQNAVGNWSA-N 0 3 403.588 4.129 20 0 HIADHN O[C@@H](CO[C@@H]1CCCc2ccccc21)CN1CCC2(CC1)OCCc1ccsc12 ZINC000492379658 904842208 /nfs/dbraw/zinc/84/22/08/904842208.db2.gz YLZUFRWFZDKUOB-IFMALSPDSA-N 0 3 413.583 4.067 20 0 HIADHN FC(F)(F)c1ccn(C2CCN(CCOc3ccc(Br)cc3)CC2)n1 ZINC000492556718 904867309 /nfs/dbraw/zinc/86/73/09/904867309.db2.gz GGNCDRAKASYSMW-UHFFFAOYSA-N 0 3 418.257 4.380 20 0 HIADHN CCCN(C)[C@H](CNC(=O)C(=O)Nc1ccc2ncccc2c1)c1ccc(Cl)cc1 ZINC000506231912 914855063 /nfs/dbraw/zinc/85/50/63/914855063.db2.gz KRZGKMXKVWBGLJ-OAQYLSRUSA-N 0 3 424.932 4.026 20 0 HIADHN COc1cccc([C@@H](CNc2ccc(C(=O)N3CCc4ccccc43)cn2)N(C)C)c1 ZINC000492893978 904942540 /nfs/dbraw/zinc/94/25/40/904942540.db2.gz PTERDSZEEFFTPL-HSZRJFAPSA-N 0 3 416.525 4.008 20 0 HIADHN COc1cc(OC)cc(Oc2ccc(CN3CCC(C(=O)N4CCCC4)CC3)cc2)c1 ZINC000506248073 914862699 /nfs/dbraw/zinc/86/26/99/914862699.db2.gz MVAXIVMWHYIOBZ-UHFFFAOYSA-N 0 3 424.541 4.331 20 0 HIADHN CCc1ccc([C@H](N[C@H]2C[C@@H](OC)C2(C)C)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000493011007 904989445 /nfs/dbraw/zinc/98/94/45/904989445.db2.gz SEQRPGCNPZFLSR-BDTNDASRSA-N 0 3 401.572 4.145 20 0 HIADHN COC(=O)c1scc(-c2ccc(C)cc2)c1NC(=O)N1CC[C@@H]2CCN(C)C[C@@H]21 ZINC000493157095 905035317 /nfs/dbraw/zinc/03/53/17/905035317.db2.gz XWJWAFQKUKNTJT-WMZOPIPTSA-N 0 3 413.543 4.068 20 0 HIADHN CC[C@H]1CCCCN1CCN[C@@H](c1ccc(C)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000493178424 905040477 /nfs/dbraw/zinc/04/04/77/905040477.db2.gz SRZUJYIJKOWIFV-UPVQGACJSA-N 0 3 414.615 4.342 20 0 HIADHN CCCN(CC)CCN[C@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000493200217 905046263 /nfs/dbraw/zinc/04/62/63/905046263.db2.gz BYWFGZIBSXUKSM-OAQYLSRUSA-N 0 3 408.995 4.154 20 0 HIADHN CC(C)(CCCO)CN[C@@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000493247561 905068020 /nfs/dbraw/zinc/06/80/20/905068020.db2.gz LODLLBSZJMDOAK-FQEVSTJZSA-N 0 3 409.979 4.221 20 0 HIADHN CC(C)C[C@@H](CCO)CN[C@@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000493251692 905070042 /nfs/dbraw/zinc/07/00/42/905070042.db2.gz VENHOQSFZVCXAH-VGSWGCGISA-N 0 3 424.006 4.467 20 0 HIADHN Fc1cc(Br)ccc1[C@H](NCCCO[C@H]1CCOC1)c1ccccc1 ZINC000493279078 905076450 /nfs/dbraw/zinc/07/64/50/905076450.db2.gz XBVQJFLMDKHMKA-FXAWDEMLSA-N 0 3 408.311 4.463 20 0 HIADHN Cc1cccc2sc(N(Cc3ccccc3)C(=O)CN[C@@H]3CCC[C@@]3(C)CO)nc21 ZINC000493413429 905115366 /nfs/dbraw/zinc/11/53/66/905115366.db2.gz PADDSKLCMUPZTH-YKSBVNFPSA-N 0 3 423.582 4.279 20 0 HIADHN Cc1ccccc1-c1cc(C(=O)N2CC[C@@H]3CCN(C)C[C@@H]32)c2cnn(C(C)C)c2n1 ZINC000493469432 905132315 /nfs/dbraw/zinc/13/23/15/905132315.db2.gz ZYRXAPBOULCWJH-MBSDFSHPSA-N 0 3 417.557 4.154 20 0 HIADHN Cc1ccc(-c2cc(C(=O)N3CC[C@H]4CCN(C)C[C@@H]43)c3cnn(C(C)C)c3n2)cc1 ZINC000493533791 905150375 /nfs/dbraw/zinc/15/03/75/905150375.db2.gz DCJDWLBAWTZGDW-XXBNENTESA-N 0 3 417.557 4.154 20 0 HIADHN COc1cc(C(=O)N2CC[C@@H]3CCN(C)C[C@H]32)ccc1OCc1ccc(Cl)cc1 ZINC000493550911 905159062 /nfs/dbraw/zinc/15/90/62/905159062.db2.gz JEOYADMARQEDHO-FXAWDEMLSA-N 0 3 414.933 4.094 20 0 HIADHN COc1cc(-c2noc(CN[C@@H]3CCC[C@@H]3CCC(C)C)n2)cc(OC)c1OC ZINC000493570621 905163341 /nfs/dbraw/zinc/16/33/41/905163341.db2.gz ABXJPWKUWILUBL-NVXWUHKLSA-N 0 3 403.523 4.457 20 0 HIADHN COc1ccc(OCCN2CCC[C@H](c3nnc4ccc(C(F)(F)F)cn43)C2)cc1 ZINC000493602032 905171141 /nfs/dbraw/zinc/17/11/41/905171141.db2.gz FUDXQAJKUKEOSM-HNNXBMFYSA-N 0 3 420.435 4.015 20 0 HIADHN COc1ccccc1OCCN1CCC[C@@H](c2nnc3ccc(C(F)(F)F)cn32)C1 ZINC000493765885 905214363 /nfs/dbraw/zinc/21/43/63/905214363.db2.gz IELKLRVNUPAUNE-OAHLLOKOSA-N 0 3 420.435 4.015 20 0 HIADHN Fc1cccc(OCCN2CCC[C@H](c3nnc4ccc(C(F)(F)F)cn43)C2)c1 ZINC000493873949 905237338 /nfs/dbraw/zinc/23/73/38/905237338.db2.gz NNBIEIMVWNVMOS-AWEZNQCLSA-N 0 3 408.399 4.146 20 0 HIADHN COCCSc1ccc([C@@H](C)NC(=O)N[C@@H](CN(C)C)c2ccc(F)cc2)cc1 ZINC000493939520 905291713 /nfs/dbraw/zinc/29/17/13/905291713.db2.gz FJKSJCKDRAWMGX-IERDGZPVSA-N 0 3 419.566 4.227 20 0 HIADHN Cc1cc(NC(=O)N2CC[C@@H]3CCN(C)C[C@@H]32)nn1-c1ccc(Cl)c(Cl)c1 ZINC000493984639 905327107 /nfs/dbraw/zinc/32/71/07/905327107.db2.gz UHZIKNPABFYSQR-GUYCJALGSA-N 0 3 408.333 4.045 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](N[C@H]2CCOC3(CCC3)C2)c2ccc(F)c(F)c2)c1 ZINC000493989586 905333986 /nfs/dbraw/zinc/33/39/86/905333986.db2.gz LYBXTYCHNOPAQH-LAUBAEHRSA-N 0 3 421.509 4.149 20 0 HIADHN CCN1CCN(c2ccc(N[C@@H](C)C(=O)N(Cc3ccccc3)C(C)C)c(C)c2)CC1 ZINC000493995831 905336430 /nfs/dbraw/zinc/33/64/30/905336430.db2.gz GRAVGXLFLBPCEA-QFIPXVFZSA-N 0 3 422.617 4.375 20 0 HIADHN C[C@H]1[C@@H](NC(=O)c2cccc(CSc3nccn3C)c2)CCN1Cc1ccccc1 ZINC000493997760 905339724 /nfs/dbraw/zinc/33/97/24/905339724.db2.gz BCVLNVPQRQHFJB-AVRDEDQJSA-N 0 3 420.582 4.105 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](NC[C@H]2[C@@H]3c4ccccc4C[C@H]23)c2ccc(F)cc2)c1 ZINC000493997271 905339868 /nfs/dbraw/zinc/33/98/68/905339868.db2.gz UTAJHBGXHXEWOK-ZGFBMJKBSA-N 0 3 421.537 4.494 20 0 HIADHN CCOc1cc(CN2CCC[C@@H](CNC(=O)C(C)C)C2)ccc1OCC(F)(F)F ZINC000512403519 921138319 /nfs/dbraw/zinc/13/83/19/921138319.db2.gz LXQYTEAZDDFENN-KRWDZBQOSA-N 0 3 416.484 4.011 20 0 HIADHN C[C@H]1[C@H](NC(=O)c2ccc(NC(=O)c3cccs3)cc2)CCN1Cc1ccccc1 ZINC000493999111 905342805 /nfs/dbraw/zinc/34/28/05/905342805.db2.gz HECZEJYLVFYJEW-LAUBAEHRSA-N 0 3 419.550 4.393 20 0 HIADHN C[C@H]1[C@@H](NC(=O)c2[nH]c3ccccc3c2Br)CCN1Cc1ccccc1 ZINC000494006867 905348275 /nfs/dbraw/zinc/34/82/75/905348275.db2.gz MEZQWPKZQRIAKF-YOEHRIQHSA-N 0 3 412.331 4.323 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)C2(c3ccccc3Cl)CCOCC2)CCN1Cc1ccccc1 ZINC000494017692 905355509 /nfs/dbraw/zinc/35/55/09/905355509.db2.gz NNLFHDGWBQNMHO-GCJKJVERSA-N 0 3 412.961 4.167 20 0 HIADHN C[C@H](O)CC(C)(C)CN[C@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000494021784 905364370 /nfs/dbraw/zinc/36/43/70/905364370.db2.gz ZVNMNVCJWIIXME-MGPUTAFESA-N 0 3 409.979 4.220 20 0 HIADHN CSc1nc(-c2ccco2)nc(C)c1C(=O)N[C@H]1CCN(Cc2ccccc2)[C@H]1C ZINC000494025535 905365173 /nfs/dbraw/zinc/36/51/73/905365173.db2.gz CMELWKFVXBLQIQ-WMZOPIPTSA-N 0 3 422.554 4.160 20 0 HIADHN CCc1ccc([C@@H](NCCCc2nccs2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000494028203 905369434 /nfs/dbraw/zinc/36/94/34/905369434.db2.gz KLBYENSASQXJQV-JOCHJYFZSA-N 0 3 414.596 4.421 20 0 HIADHN C[C@@H]1[C@H](NC(=O)c2cccc(NC(=O)c3cccs3)c2)CCN1Cc1ccccc1 ZINC000494037878 905377543 /nfs/dbraw/zinc/37/75/43/905377543.db2.gz LZOQODQFFZWQLJ-DYESRHJHSA-N 0 3 419.550 4.393 20 0 HIADHN C[C@H]1[C@H](NC(=O)c2cccc(NC(=O)c3cccs3)c2)CCN1Cc1ccccc1 ZINC000494037879 905378325 /nfs/dbraw/zinc/37/83/25/905378325.db2.gz LZOQODQFFZWQLJ-LAUBAEHRSA-N 0 3 419.550 4.393 20 0 HIADHN COc1ccc([C@@H](NCCc2cccc(C(N)=O)c2)c2ccccc2Cl)cc1OC ZINC000494075474 905411197 /nfs/dbraw/zinc/41/11/97/905411197.db2.gz PEAFVHFPBSAEPU-HSZRJFAPSA-N 0 3 424.928 4.378 20 0 HIADHN Cc1nn(-c2ccccc2)cc1CN1CCC[C@H](CNC(=O)Nc2cccc(F)c2)C1 ZINC000512427924 921155081 /nfs/dbraw/zinc/15/50/81/921155081.db2.gz OKAWFPHPWSEZSQ-LJQANCHMSA-N 0 3 421.520 4.354 20 0 HIADHN Cc1nc2ccc(CNCc3ccc(C(=O)N4C[C@H](C)O[C@@H](C)C4)cc3)cc2s1 ZINC000494314616 905629424 /nfs/dbraw/zinc/62/94/24/905629424.db2.gz PZOWUCLOIMQYHF-HOTGVXAUSA-N 0 3 409.555 4.144 20 0 HIADHN O=C(Nc1cnn(-c2ncc(Cl)cc2Cl)c1)N1CCN(C2CCCCC2)CC1 ZINC000494354317 905658607 /nfs/dbraw/zinc/65/86/07/905658607.db2.gz WYNXXTMLXZGXFT-UHFFFAOYSA-N 0 3 423.348 4.056 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cc(F)cc2nc(C)c(C)nc21)c1ccsc1 ZINC000494360397 905662207 /nfs/dbraw/zinc/66/22/07/905662207.db2.gz PXHGPZYKLJIMPX-IBGZPJMESA-N 0 3 400.523 4.260 20 0 HIADHN Clc1cc(CNCc2ccccc2CN2CCOCC2)ccc1Br ZINC000494375798 905674183 /nfs/dbraw/zinc/67/41/83/905674183.db2.gz RJFPRZIIBCIWNC-UHFFFAOYSA-N 0 3 409.755 4.225 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](NCCCc2ccccn2)c2ccc(F)c(F)c2)c1 ZINC000494441302 905725357 /nfs/dbraw/zinc/72/53/57/905725357.db2.gz WYJBJEPKGRQGAJ-QFIPXVFZSA-N 0 3 416.493 4.075 20 0 HIADHN CCS(=O)(=O)c1ccc(CN[C@H]2CCc3cc(Br)cc(C)c32)cc1 ZINC000494481911 905763707 /nfs/dbraw/zinc/76/37/07/905763707.db2.gz CSKAXEUUHFPUEM-SFHVURJKSA-N 0 3 408.361 4.328 20 0 HIADHN CC(C)CNC(=O)c1cccc(CN[C@H]2CCO[C@H]2c2ccc(Cl)c(F)c2)c1 ZINC000494490142 905775532 /nfs/dbraw/zinc/77/55/32/905775532.db2.gz XQZYLZFRADKQQD-SFTDATJTSA-N 0 3 404.913 4.485 20 0 HIADHN O=C1[C@H](N[C@@H]2CCO[C@H]2c2ccc(Cl)c(F)c2)CCCN1c1ccccc1F ZINC000494492198 905777309 /nfs/dbraw/zinc/77/73/09/905777309.db2.gz HFVRCVGYAKRXBY-GGPKGHCWSA-N 0 3 406.860 4.233 20 0 HIADHN Cc1ccc(S(=O)(=O)CCCN[C@@H]2CCO[C@@H]2c2ccc(Cl)c(F)c2)cc1 ZINC000494496787 905784369 /nfs/dbraw/zinc/78/43/69/905784369.db2.gz PRCRBGYOIHRRSP-WOJBJXKFSA-N 0 3 411.926 4.071 20 0 HIADHN COc1ccc(N(C(=O)c2ccc(CN3CCC(CO)CC3)cc2)[C@@H](C)C2CC2)cc1 ZINC000494496525 905784569 /nfs/dbraw/zinc/78/45/69/905784569.db2.gz YGNOXXPYHHUWEJ-IBGZPJMESA-N 0 3 422.569 4.345 20 0 HIADHN CCCC(=O)NC[C@@H]1CCCN(Cc2cn(-c3ccccc3)nc2-c2cccnc2)C1 ZINC000512470262 921182702 /nfs/dbraw/zinc/18/27/02/921182702.db2.gz WWMSDKSBMUZASO-FQEVSTJZSA-N 0 3 417.557 4.063 20 0 HIADHN CN(C)Cc1ccc(CNCc2cnn(Cc3ccc(C(F)(F)F)cc3)c2)cc1F ZINC000494565890 905839796 /nfs/dbraw/zinc/83/97/96/905839796.db2.gz ZNCMPKJRQNPVAQ-UHFFFAOYSA-N 0 3 420.454 4.441 20 0 HIADHN CCN(Cc1ccc(OCc2cccs2)c(OC)c1)C(=O)[C@@H]1CCCN1C1CC1 ZINC000494583013 905849074 /nfs/dbraw/zinc/84/90/74/905849074.db2.gz COKGVNRAMGAAOZ-FQEVSTJZSA-N 0 3 414.571 4.311 20 0 HIADHN CCSc1ccc([C@@H](C)NC(=O)N[C@H](CN(C)C)c2ccc(OC)cc2)cc1 ZINC000494599681 905856229 /nfs/dbraw/zinc/85/62/29/905856229.db2.gz HRORIEYCWXUAIC-IIBYNOLFSA-N 0 3 401.576 4.470 20 0 HIADHN CCc1c(NC(=O)Nc2cccc(N3CCN(CC)CC3)c2)cnn1CCC(C)C ZINC000494611134 905862005 /nfs/dbraw/zinc/86/20/05/905862005.db2.gz IAROBTCWMAHYSS-UHFFFAOYSA-N 0 3 412.582 4.278 20 0 HIADHN CC(C)[C@H](NCCC=Cc1ccc(Br)cc1)c1nc(-c2nc[nH]n2)no1 ZINC000494690121 905901823 /nfs/dbraw/zinc/90/18/23/905901823.db2.gz ZIRFSPYYGKJBCJ-UJAVWCLSSA-N 0 3 417.311 4.007 20 0 HIADHN C[C@H](NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1)c1nc(C(F)(F)F)cs1 ZINC000494704755 905909334 /nfs/dbraw/zinc/90/93/34/905909334.db2.gz WRUFQRGDOJPQLH-ZFWWWQNUSA-N 0 3 412.481 4.187 20 0 HIADHN C[C@@H](NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1)c1nc(C(F)(F)F)cs1 ZINC000494704753 905910133 /nfs/dbraw/zinc/91/01/33/905910133.db2.gz WRUFQRGDOJPQLH-HIFRSBDPSA-N 0 3 412.481 4.187 20 0 HIADHN CC(C)[C@@H](O)C(C)(C)CN[C@@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000494711370 905914317 /nfs/dbraw/zinc/91/43/17/905914317.db2.gz BDGCNOHDLSEDBO-LEWJYISDSA-N 0 3 424.006 4.466 20 0 HIADHN CCc1ccc([C@@H](NCC(C)(C)[C@@H](O)C(C)C)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000494716314 905918739 /nfs/dbraw/zinc/91/87/39/905918739.db2.gz WIOPLKOWIAGYSV-PKTZIBPZSA-N 0 3 417.615 4.375 20 0 HIADHN C[C@H](NC(=O)N[C@@H](CN1CCCC1)c1ccccc1)c1nc(C(F)(F)F)cs1 ZINC000494717058 905919792 /nfs/dbraw/zinc/91/97/92/905919792.db2.gz AXKSZHYPPSUIID-ZFWWWQNUSA-N 0 3 412.481 4.359 20 0 HIADHN C[C@@H](CC(=O)N(CCN(C)C)Cc1cccc(O)c1)c1ccc(C(F)(F)F)cc1 ZINC000494781750 905982766 /nfs/dbraw/zinc/98/27/66/905982766.db2.gz XMOMKLONNKIZQM-INIZCTEOSA-N 0 3 408.464 4.495 20 0 HIADHN C[C@H](NC(=O)N1CCN(C2CCOCC2)C[C@H]1C)c1ccccc1Oc1ccccc1 ZINC000494902891 906077632 /nfs/dbraw/zinc/07/76/32/906077632.db2.gz KKRHZDBMAUYPHQ-UXHICEINSA-N 0 3 423.557 4.435 20 0 HIADHN O=C(Nc1cccc(CN[C@H](C[C@@H]2CCOC2)c2ccc(F)cc2)c1)[C@@H]1CCCO1 ZINC000494901979 906078346 /nfs/dbraw/zinc/07/83/46/906078346.db2.gz HIJILTHKFKRJRT-NMNUPHIUSA-N 0 3 412.505 4.201 20 0 HIADHN C[C@@H](N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1)c1ccc(C(=O)N(C)C)cc1 ZINC000494929503 906101387 /nfs/dbraw/zinc/10/13/87/906101387.db2.gz ITZFCLFSISNREP-DVECYGJZSA-N 0 3 415.537 4.289 20 0 HIADHN CCN(C(=O)N[C@H](C)[C@@H]1OCCc2sccc21)[C@H]1CCN(Cc2ccccc2)C1 ZINC000494952345 906123680 /nfs/dbraw/zinc/12/36/80/906123680.db2.gz OVZOHHQUWVEIAI-LZNRXBQRSA-N 0 3 413.587 4.056 20 0 HIADHN CCN(C(=O)N[C@H](C)[C@H]1OCCc2sccc21)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000494952349 906124128 /nfs/dbraw/zinc/12/41/28/906124128.db2.gz OVZOHHQUWVEIAI-SFGWALBWSA-N 0 3 413.587 4.056 20 0 HIADHN C[C@@H](NC(=O)N(CCN(C)C)Cc1cccc(Cl)c1)[C@H]1OCCc2sccc21 ZINC000494962288 906131821 /nfs/dbraw/zinc/13/18/21/906131821.db2.gz XEANFQPFPIECTP-FOIQADDNSA-N 0 3 421.994 4.177 20 0 HIADHN CCc1ccc([C@H](NCC(CC)(CC)CO)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000494989539 906153707 /nfs/dbraw/zinc/15/37/07/906153707.db2.gz UDDIGEMXTRZJPM-QFIPXVFZSA-N 0 3 403.588 4.130 20 0 HIADHN Cc1noc(C)c1[C@H](C)CN[C@@H](c1ccc(C)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000494990954 906155489 /nfs/dbraw/zinc/15/54/89/906155489.db2.gz YGPQGHHQZOLRAY-MWTRTKDXSA-N 0 3 412.555 4.486 20 0 HIADHN O=C(Nc1ccc(Oc2cccnc2)cc1)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000495005943 906166412 /nfs/dbraw/zinc/16/64/12/906166412.db2.gz KMKKBQCAMLESLJ-UHFFFAOYSA-N 0 3 417.509 4.331 20 0 HIADHN CCN1CCN(Cc2ccc(CNC(=O)c3c[nH]cc3-c3ccc(C)s3)cc2)CC1 ZINC000495035633 906190466 /nfs/dbraw/zinc/19/04/66/906190466.db2.gz JJCLFKGKDHHMHF-UHFFFAOYSA-N 0 3 422.598 4.119 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)c3c[nH]cc3-c3ccc(C)s3)cc2)CC1 ZINC000495038413 906194679 /nfs/dbraw/zinc/19/46/79/906194679.db2.gz AEQRNGSQTXCSSQ-UHFFFAOYSA-N 0 3 408.571 4.441 20 0 HIADHN CC(C)C(=O)NCCCN[C@H](c1cccc(F)c1)c1cccc(Br)c1 ZINC000495053079 906207635 /nfs/dbraw/zinc/20/76/35/906207635.db2.gz WMARUFQNYWMVAQ-IBGZPJMESA-N 0 3 407.327 4.430 20 0 HIADHN Brc1ccccc1[C@H](N[C@H]1CCO[C@@]2(CCOC2)C1)c1ccccc1 ZINC000495063021 906214782 /nfs/dbraw/zinc/21/47/82/906214782.db2.gz GKRMKSJSRYSSBT-WMQCIHAUSA-N 0 3 402.332 4.466 20 0 HIADHN Fc1ccc([C@@H](C[C@@H]2CCOC2)NCc2ccnc(OC3CCOCC3)c2)cc1 ZINC000495079309 906225611 /nfs/dbraw/zinc/22/56/11/906225611.db2.gz NLTRKSNHQHKYCA-PGRDOPGGSA-N 0 3 400.494 4.036 20 0 HIADHN Cc1cccc(-c2cncc(C(=O)N3CCC(CN4C[C@@H](C)O[C@@H](C)C4)CC3)c2)c1 ZINC000495199322 906303757 /nfs/dbraw/zinc/30/37/57/906303757.db2.gz BYUNTBWRJJIRDZ-BGYRXZFFSA-N 0 3 407.558 4.018 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)Nc1ccn(-c2ccccc2Cl)n1 ZINC000495246061 906333562 /nfs/dbraw/zinc/33/35/62/906333562.db2.gz GCVYFZHNOGKSQC-UHFFFAOYSA-N 0 3 415.900 4.261 20 0 HIADHN COc1cc(OC)cc(Oc2cccc(CNCc3cnc4n[nH]c(C)c4c3)c2)c1 ZINC000512569733 921242495 /nfs/dbraw/zinc/24/24/95/921242495.db2.gz QGTHHQXAWMQCKM-UHFFFAOYSA-N 0 3 404.470 4.366 20 0 HIADHN COc1ccc(CCC(=O)N2CCCN(Cc3cc(C)nc4ccccc34)CC2)cc1 ZINC000512578790 921247306 /nfs/dbraw/zinc/24/73/06/921247306.db2.gz RGYGHFBXRMEHRF-UHFFFAOYSA-N 0 3 417.553 4.219 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)[C@@H]1C[C@H]1c1cccc(Br)c1 ZINC000495999878 906595061 /nfs/dbraw/zinc/59/50/61/906595061.db2.gz MIGUFUQJQNKFNB-VQTJNVASSA-N 0 3 401.348 4.143 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)[C@@H](C)Sc1ccc(OC)cc1 ZINC000496228468 906634761 /nfs/dbraw/zinc/63/47/61/906634761.db2.gz ZDIOCBNFZFYPGL-QUCCMNQESA-N 0 3 413.587 4.084 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)c1cc(F)ccc1Br ZINC000496261979 906639947 /nfs/dbraw/zinc/63/99/47/906639947.db2.gz JRTMBCWJDILRAN-QGZVFWFLSA-N 0 3 420.326 4.110 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)CCC(=O)c1cc(C)sc1C ZINC000496261344 906640597 /nfs/dbraw/zinc/64/05/97/906640597.db2.gz HYGJJNHVNVFVKR-HXUWFJFHSA-N 0 3 413.587 4.236 20 0 HIADHN CCCN(CCN(C)C)C(=O)c1nc(C(C)C)n(-c2c(Cl)cccc2Cl)n1 ZINC000496306529 906652914 /nfs/dbraw/zinc/65/29/14/906652914.db2.gz SEYKSGCZEPLPRD-UHFFFAOYSA-N 0 3 412.365 4.111 20 0 HIADHN CN(C)[C@H](CNC(=O)CSCc1cc(-c2cccs2)on1)c1ccccc1 ZINC000497367483 906856737 /nfs/dbraw/zinc/85/67/37/906856737.db2.gz PZELFWMRKCZKFO-QGZVFWFLSA-N 0 3 401.557 4.055 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)N[C@@H](c3ccc(F)cc3)c3ccccc3Cl)[C@H]2C1 ZINC000497372080 906860982 /nfs/dbraw/zinc/86/09/82/906860982.db2.gz ZGOPREPFVVEVOD-NQERJWCQSA-N 0 3 401.913 4.304 20 0 HIADHN COc1cc([C@H](C)NC(=O)N2CC[C@H]3CCN(C)C[C@H]32)ccc1OCc1ccccc1 ZINC000497375716 906864488 /nfs/dbraw/zinc/86/44/88/906864488.db2.gz CABYOJXXVAOOCK-CZTZKLFOSA-N 0 3 423.557 4.071 20 0 HIADHN Cc1sc(CNC(=O)N2CC[C@H]3CCN(C)C[C@@H]32)nc1-c1ccc(Cl)cc1 ZINC000497377454 906865734 /nfs/dbraw/zinc/86/57/34/906865734.db2.gz WDVKJVMCUBOWJR-PBHICJAKSA-N 0 3 404.967 4.008 20 0 HIADHN CN(C)[C@@H](CNC(=O)c1cnn(-c2ccc(Cl)cc2Cl)c1)c1ccccc1 ZINC000497378862 906867382 /nfs/dbraw/zinc/86/73/82/906867382.db2.gz QECKEBJMAOTJFD-IBGZPJMESA-N 0 3 403.313 4.212 20 0 HIADHN C/C=C\c1ccc(NC(=O)N2CCC[C@H](CN3CCN(c4ccccn4)CC3)C2)cc1 ZINC000497383831 906870445 /nfs/dbraw/zinc/87/04/45/906870445.db2.gz GFUQFXWGGHQXKS-DDSZZFJNSA-N 0 3 419.573 4.181 20 0 HIADHN Cc1cccc(-n2ncc(C(=O)NC[C@H](c3ccccc3)N(C)C)c2C(F)(F)F)c1 ZINC000497385296 906871586 /nfs/dbraw/zinc/87/15/86/906871586.db2.gz LXYZWOIHNIGLON-LJQANCHMSA-N 0 3 416.447 4.232 20 0 HIADHN CC(C)c1ccc(-c2noc(CCC(=O)NC[C@H](c3ccccc3)N(C)C)n2)cc1 ZINC000497391464 906875543 /nfs/dbraw/zinc/87/55/43/906875543.db2.gz UIWKXZUJSKYMEK-OAQYLSRUSA-N 0 3 406.530 4.212 20 0 HIADHN Cc1cc(C(=O)N[C@@H]2CN(C)C[C@@H]2c2ccccc2)ccc1NC(=O)c1cccs1 ZINC000497416822 906891640 /nfs/dbraw/zinc/89/16/40/906891640.db2.gz LLOALBYXTNYFGT-TZIWHRDSSA-N 0 3 419.550 4.136 20 0 HIADHN O=C(NC[C@@]1(O)CCN(Cc2ccccc2)C1)Nc1cc(C(F)F)ccc1Cl ZINC000497424934 906897003 /nfs/dbraw/zinc/89/70/03/906897003.db2.gz DRDKGPIAMWMRMS-FQEVSTJZSA-N 0 3 409.864 4.036 20 0 HIADHN COc1cccc([C@H](NC(=O)N2CC[C@H]3CCN(C)C[C@H]32)c2ccccc2Cl)c1 ZINC000497503591 906991125 /nfs/dbraw/zinc/99/11/25/906991125.db2.gz LGDOEDHLHHBJNV-HVETUWLQSA-N 0 3 413.949 4.174 20 0 HIADHN O=C(c1ccco1)N1CCC(N[C@@H](c2cc3ccccc3o2)c2cccnc2)CC1 ZINC000497519167 907008913 /nfs/dbraw/zinc/00/89/13/907008913.db2.gz NKXVZEOVNYJVPV-HSZRJFAPSA-N 0 3 401.466 4.405 20 0 HIADHN Cc1sc(CNC(=O)[C@@H]2CN(Cc3ccccc3)CCC2(F)F)nc1C(C)C ZINC000512687791 921287217 /nfs/dbraw/zinc/28/72/17/921287217.db2.gz XEYHCJILQBXQDM-KRWDZBQOSA-N 0 3 407.530 4.349 20 0 HIADHN O[C@@H](COc1ccc(Cl)cc1Cl)CN(Cc1cccs1)C[C@@H]1CCCO1 ZINC000497590201 907071472 /nfs/dbraw/zinc/07/14/72/907071472.db2.gz BVTFDONEPODFGR-CVEARBPZSA-N 0 3 416.370 4.476 20 0 HIADHN CCOc1ccc(OC[C@@H](O)CN2CC=C(c3c[nH]c4ccc(OC)cc43)CC2)cc1 ZINC000497597259 907075970 /nfs/dbraw/zinc/07/59/70/907075970.db2.gz YHYZQQSAMCWICI-IBGZPJMESA-N 0 3 422.525 4.104 20 0 HIADHN Cc1ccc(C(=O)NC2CCN(CCOc3cccc(Br)c3)CC2)s1 ZINC000497610299 907089907 /nfs/dbraw/zinc/08/99/07/907089907.db2.gz JJJIKDYITGAISA-UHFFFAOYSA-N 0 3 423.376 4.092 20 0 HIADHN Cc1noc(C)c1C(C)(C)NC(=O)N[C@H](CN1CCc2ccccc2C1)C(C)(C)C ZINC000497619310 907099349 /nfs/dbraw/zinc/09/93/49/907099349.db2.gz WXHGPIQPJYUDKM-HXUWFJFHSA-N 0 3 412.578 4.299 20 0 HIADHN Cc1ccc(C[C@H](NC(=O)N[C@H](CN(C)C)c2ccc(F)cc2)c2ccccn2)cc1 ZINC000497635199 907118688 /nfs/dbraw/zinc/11/86/88/907118688.db2.gz XYSAHUQKLDXZSO-BJKOFHAPSA-N 0 3 420.532 4.415 20 0 HIADHN CC1CCN([C@H](CNc2ncc(C(=O)N(C)C)cc2Cl)c2ccccc2)CC1 ZINC000497637312 907120653 /nfs/dbraw/zinc/12/06/53/907120653.db2.gz IEMIHHMSJIJAOC-HXUWFJFHSA-N 0 3 400.954 4.322 20 0 HIADHN CC(C)Cn1ncc(NC(=O)N(CCN(C)C)Cc2cccc(F)c2)c1C1CC1 ZINC000497655711 907146264 /nfs/dbraw/zinc/14/62/64/907146264.db2.gz DVBJVCGRFCXHSZ-UHFFFAOYSA-N 0 3 401.530 4.151 20 0 HIADHN COc1cccc(C[C@H](C)NC(=O)N(CCN(C)C)Cc2cccc(Cl)c2)c1 ZINC000497696729 907200847 /nfs/dbraw/zinc/20/08/47/907200847.db2.gz MVZNBTMAPYYWGU-KRWDZBQOSA-N 0 3 403.954 4.053 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)N[C@H](C)c2ncc(-c3ccccc3)o2)cc1 ZINC000497697520 907201148 /nfs/dbraw/zinc/20/11/48/907201148.db2.gz QPNHIFXKJFGSCQ-OXQOHEQNSA-N 0 3 408.502 4.013 20 0 HIADHN COc1cc(C)c(CN(C)C[C@H](O)CO[C@H](C)c2ccc(Cl)cc2)cc1OC ZINC000497706081 907210483 /nfs/dbraw/zinc/21/04/83/907210483.db2.gz LDBXIMQLIALILC-UZLBHIALSA-N 0 3 407.938 4.236 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1ccc(-n2nccc2C)cc1)c1cccc(OC)c1 ZINC000497752947 907244307 /nfs/dbraw/zinc/24/43/07/907244307.db2.gz JVUHCDFOWRGVRQ-HSZRJFAPSA-N 0 3 406.530 4.002 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)C1(c2ccc(OC)cc2)CCC1)c1cccc(OC)c1 ZINC000497754206 907244532 /nfs/dbraw/zinc/24/45/32/907244532.db2.gz ZONDYWFQHFUDSH-QHCPKHFHSA-N 0 3 410.558 4.325 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Cc1cn(CC)c2ccccc12)c1cccc(OC)c1 ZINC000497753949 907244682 /nfs/dbraw/zinc/24/46/82/907244682.db2.gz WCEWAXFYQHKDCX-DEOSSOPVSA-N 0 3 407.558 4.412 20 0 HIADHN CC(C)c1noc2nc(C3CC3)cc(C(=O)N[C@@H]3CN(C)C[C@@H]3c3ccccc3)c21 ZINC000497806026 907292059 /nfs/dbraw/zinc/29/20/59/907292059.db2.gz WMZUKYXDYGNOIP-UYAOXDASSA-N 0 3 404.514 4.051 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)NC[C@H]2CCCO[C@H]2C(C)(C)C)N(C)C)cc1 ZINC000497823282 907304781 /nfs/dbraw/zinc/30/47/81/907304781.db2.gz PUKXUUJSRNDGHS-BAGYTPMASA-N 0 3 419.610 4.217 20 0 HIADHN C[C@@H](CCn1cccn1)N[C@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000497851957 907332474 /nfs/dbraw/zinc/33/24/74/907332474.db2.gz GXYDKXGNOBGHCL-HRAATJIYSA-N 0 3 417.962 4.098 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)N2CC[C@@H](C(F)(F)F)[C@H]2C)N(C)C)cc1 ZINC000512809808 921316499 /nfs/dbraw/zinc/31/64/99/921316499.db2.gz WGFIKCZTWMTPFE-OLMNPRSZSA-N 0 3 401.473 4.059 20 0 HIADHN CCN(C(=O)c1cnn(Cc2ccccc2)c1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000497950115 907418083 /nfs/dbraw/zinc/41/80/83/907418083.db2.gz HCPYFSINQHXHAD-YKSBVNFPSA-N 0 3 402.542 4.229 20 0 HIADHN Cc1ccc(C2CCN(C(=O)NC[C@@H](c3ccc(OC(C)C)cc3)N(C)C)CC2)cn1 ZINC000512822272 921326226 /nfs/dbraw/zinc/32/62/26/921326226.db2.gz UNZAZWOWPHDXRI-DEOSSOPVSA-N 0 3 424.589 4.369 20 0 HIADHN C[C@H](NC(=O)CC1CCCCC1)C(=O)NC[C@H](c1cccs1)N1CCC(C)CC1 ZINC000497993399 907471596 /nfs/dbraw/zinc/47/15/96/907471596.db2.gz NRIDPKUFUJUDAR-AZUAARDMSA-N 0 3 419.635 4.112 20 0 HIADHN CN(C)Cc1ccccc1C(=O)Nc1nc2c(s1)CN(Cc1ccccc1)CC2 ZINC000497998234 907479488 /nfs/dbraw/zinc/47/94/88/907479488.db2.gz PVLGTTHSPMAJJG-UHFFFAOYSA-N 0 3 406.555 4.015 20 0 HIADHN CN(C)Cc1cccc(C(=O)N2CC[C@H](Cc3ccc(Br)cc3)C2)c1 ZINC000498040492 907546487 /nfs/dbraw/zinc/54/64/87/907546487.db2.gz DHPCUKAXQXBVTC-GOSISDBHSA-N 0 3 401.348 4.216 20 0 HIADHN Cc1csc([C@@H](NC(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)C2CC2)n1 ZINC000498046736 907557351 /nfs/dbraw/zinc/55/73/51/907557351.db2.gz MFSDPHLMEWMFMW-PMACEKPBSA-N 0 3 416.591 4.292 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)C1(c2cccc(Br)c2)CC1 ZINC000498053692 907565402 /nfs/dbraw/zinc/56/54/02/907565402.db2.gz JFXQROZEOMPMDB-UHFFFAOYSA-N 0 3 413.359 4.045 20 0 HIADHN C[C@H](Oc1ccc(F)cc1Cl)C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000498088286 907597000 /nfs/dbraw/zinc/59/70/00/907597000.db2.gz JMEQHUJUXXTXOI-HNNXBMFYSA-N 0 3 422.953 4.476 20 0 HIADHN CCOC1CC2(C1)CCN([C@H](C)C(=O)N(C)Cc1ccc3cc(OC)ccc3c1)C2 ZINC000512835557 921338474 /nfs/dbraw/zinc/33/84/74/921338474.db2.gz XIVDFVDUQSGGPY-HYCNBMAASA-N 0 3 410.558 4.086 20 0 HIADHN C[C@H](Cc1ccc(Br)cc1)C(=O)N(Cc1ccco1)C1CCN(C)CC1 ZINC000498126718 907642633 /nfs/dbraw/zinc/64/26/33/907642633.db2.gz VLWMTIDMXALLJF-MRXNPFEDSA-N 0 3 419.363 4.344 20 0 HIADHN CSc1ccccc1C(=O)N(CCN(C)C)Cc1ccc(Br)cc1 ZINC000498127731 907645421 /nfs/dbraw/zinc/64/54/21/907645421.db2.gz VKWODRIZRSDFGK-UHFFFAOYSA-N 0 3 407.377 4.375 20 0 HIADHN COCCc1ccc(Oc2ccc(NC(=O)N[C@H](C)C3=CCN(C)CC3)cc2)cc1 ZINC000512843756 921346925 /nfs/dbraw/zinc/34/69/25/921346925.db2.gz FIIKTSXQJBVNEB-GOSISDBHSA-N 0 3 409.530 4.440 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)N[C@@H](c1cccc(F)c1)c1ccccn1 ZINC000498237010 907770269 /nfs/dbraw/zinc/77/02/69/907770269.db2.gz BUKUKINPLGVKFM-ZEQRLZLVSA-N 0 3 418.516 4.446 20 0 HIADHN CC1CCC(N2CCN(C(=O)c3ccc(-c4noc(C(F)F)n4)cc3)CC2)CC1 ZINC000498344639 907849852 /nfs/dbraw/zinc/84/98/52/907849852.db2.gz JYMNROCDYKUALR-UHFFFAOYSA-N 0 3 404.461 4.011 20 0 HIADHN CCC(CC)[C@H]1C[C@H](NC(=O)N(CCN(C)C)Cc2ccc(F)cc2F)CCO1 ZINC000498391372 907876215 /nfs/dbraw/zinc/87/62/15/907876215.db2.gz XJSHDLRQGAKDJD-TZIWHRDSSA-N 0 3 411.537 4.022 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)[C@@H]1C[C@@H]1c1ccccc1C(F)(F)F ZINC000498485502 907956008 /nfs/dbraw/zinc/95/60/08/907956008.db2.gz SAMKYUZJPSUGJP-IAGOWNOFSA-N 0 3 412.521 4.287 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)NCc1ccccc1N1CCCCC1 ZINC000498498732 907972644 /nfs/dbraw/zinc/97/26/44/907972644.db2.gz YZXMXCVUCPHZLD-UHFFFAOYSA-N 0 3 412.553 4.089 20 0 HIADHN CN(C)C[C@@H](NC(=O)NCc1cc(F)c(C(F)(F)F)cc1F)c1ccc(F)cc1 ZINC000512871555 921370420 /nfs/dbraw/zinc/37/04/20/921370420.db2.gz FRBWHCQFEZUYAM-QGZVFWFLSA-N 0 3 419.369 4.225 20 0 HIADHN C[C@@H](c1ccc(F)c(Cl)c1)N1CCC[C@H](CN2CCN(c3ccccn3)CC2)C1 ZINC000498559975 908020783 /nfs/dbraw/zinc/02/07/83/908020783.db2.gz LIXXFPGDLXPGGZ-RBUKOAKNSA-N 0 3 416.972 4.469 20 0 HIADHN COc1ccccc1[C@H]1CC[C@H](C)CN1C(=O)NC1CCN(CCOC(C)C)CC1 ZINC000498595728 908045282 /nfs/dbraw/zinc/04/52/82/908045282.db2.gz YHXAGWFGICNPRC-SIKLNZKXSA-N 0 3 417.594 4.067 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)N[C@@H](C)c2ccc(-c3cccnc3)cc2)cc1 ZINC000498608224 908057280 /nfs/dbraw/zinc/05/72/80/908057280.db2.gz UHCHXPDICADXMZ-MHECFPHRSA-N 0 3 418.541 4.420 20 0 HIADHN C[C@H](NC(=O)N[C@H]1CCN(Cc2ccccc2)[C@H]1C)c1nc(C2CCCCC2)no1 ZINC000498705025 908129503 /nfs/dbraw/zinc/12/95/03/908129503.db2.gz CDCOFXURSSMVIM-ZWOKBUDYSA-N 0 3 411.550 4.141 20 0 HIADHN COc1cccc(-c2nn(-c3ccc(C)cc3)cc2C(=O)N2CCN(C)CC[C@H]2C)c1 ZINC000498707293 908132851 /nfs/dbraw/zinc/13/28/51/908132851.db2.gz NJGQRBMAKVIPHB-LJQANCHMSA-N 0 3 418.541 4.023 20 0 HIADHN CC[C@@H](NC(=O)N[C@H](CN(C)C)c1ccc(F)cc1)c1nc(C(F)(F)F)cs1 ZINC000498713441 908138894 /nfs/dbraw/zinc/13/88/94/908138894.db2.gz IQYWTFWCXSRMAY-ZIAGYGMSSA-N 0 3 418.460 4.354 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@@H]2CNC(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)cc1 ZINC000498726875 908153270 /nfs/dbraw/zinc/15/32/70/908153270.db2.gz GLZURFPKVDAIDE-UQAQOTMJSA-N 0 3 409.574 4.453 20 0 HIADHN C[C@@H](CCn1cccn1)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1 ZINC000498753977 908178885 /nfs/dbraw/zinc/17/88/85/908178885.db2.gz PCPIHHDGJRCIOK-QFIPXVFZSA-N 0 3 403.574 4.139 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)N[C@@H]2CCCOc3c(F)cccc32)CC1 ZINC000498828552 908235519 /nfs/dbraw/zinc/23/55/19/908235519.db2.gz BLDSEDKKSLYJGQ-JOCHJYFZSA-N 0 3 411.521 4.345 20 0 HIADHN COc1ccc(COc2cccc(F)c2)cc1NC(=O)N[C@@H](C)C1=CCN(C)CC1 ZINC000512907178 921398702 /nfs/dbraw/zinc/39/87/02/921398702.db2.gz NIZKOJOGKOQGHJ-INIZCTEOSA-N 0 3 413.493 4.185 20 0 HIADHN C[C@@H](C(=O)Nc1ccc(Cl)c(Cl)c1)N1CCC[C@H](c2n[nH]c(C3CC3)n2)C1 ZINC000498904942 908312381 /nfs/dbraw/zinc/31/23/81/908312381.db2.gz LZCKCQUTIMWHMK-AAEUAGOBSA-N 0 3 408.333 4.196 20 0 HIADHN O=C(Nc1ccc(F)cc1)[C@@H](c1ccccc1)N1CCC[C@H](c2nc(C3CC3)n[nH]2)C1 ZINC000498904726 908313118 /nfs/dbraw/zinc/31/31/18/908313118.db2.gz KDYQOAZGEQOHCB-GHTZIAJQSA-N 0 3 419.504 4.381 20 0 HIADHN O=C(Nc1ccc(F)cc1)[C@@H](c1ccccc1)N1CCC[C@H](c2n[nH]c(C3CC3)n2)C1 ZINC000498904726 908313131 /nfs/dbraw/zinc/31/31/31/908313131.db2.gz KDYQOAZGEQOHCB-GHTZIAJQSA-N 0 3 419.504 4.381 20 0 HIADHN O=C(Nc1ccc(F)cc1)[C@H](c1ccccc1)N1CCC[C@H](c2nc(C3CC3)n[nH]2)C1 ZINC000498904728 908313397 /nfs/dbraw/zinc/31/33/97/908313397.db2.gz KDYQOAZGEQOHCB-RXVVDRJESA-N 0 3 419.504 4.381 20 0 HIADHN O=C(Nc1ccc(F)cc1)[C@H](c1ccccc1)N1CCC[C@H](c2n[nH]c(C3CC3)n2)C1 ZINC000498904728 908313406 /nfs/dbraw/zinc/31/34/06/908313406.db2.gz KDYQOAZGEQOHCB-RXVVDRJESA-N 0 3 419.504 4.381 20 0 HIADHN C[C@H](NC(=O)CN1CCC[C@@H](c2n[nH]c(C3CC3)n2)C1)c1ccc(Cl)c(Cl)c1 ZINC000498918846 908328885 /nfs/dbraw/zinc/32/88/85/908328885.db2.gz PFWKSLUNAFSGGM-SWLSCSKDSA-N 0 3 422.360 4.046 20 0 HIADHN COC(=O)c1sc2cccc(F)c2c1CN1CCC[C@H](c2nc(C3CC3)n[nH]2)C1 ZINC000498922293 908332563 /nfs/dbraw/zinc/33/25/63/908332563.db2.gz KZHLQXVDRXTOLR-ZDUSSCGKSA-N 0 3 414.506 4.202 20 0 HIADHN COC(=O)c1sc2cccc(F)c2c1CN1CCC[C@H](c2n[nH]c(C3CC3)n2)C1 ZINC000498922293 908332577 /nfs/dbraw/zinc/33/25/77/908332577.db2.gz KZHLQXVDRXTOLR-ZDUSSCGKSA-N 0 3 414.506 4.202 20 0 HIADHN CCN1C[C@H](C)N(Cc2csc(N(C(C)=O)c3ccc(Cl)cc3)n2)C[C@H]1C ZINC000498940293 908348486 /nfs/dbraw/zinc/34/84/86/908348486.db2.gz XLJXEASPMKXPGF-CABCVRRESA-N 0 3 406.983 4.396 20 0 HIADHN CC[C@H](C)Sc1ccc(NC(=O)C(=O)NC[C@@H](C)N2CCC[C@H](C)C2)c(C)c1 ZINC000498948028 908351119 /nfs/dbraw/zinc/35/11/19/908351119.db2.gz AQDWFZNGESKBEN-JQHSSLGASA-N 0 3 405.608 4.061 20 0 HIADHN FC(F)(F)c1cccc([C@H]2CCC[C@H]2NCc2cn(Cc3cccnc3)nn2)c1 ZINC000512913318 921406188 /nfs/dbraw/zinc/40/61/88/921406188.db2.gz NQQUDSYKJAXEGX-WOJBJXKFSA-N 0 3 401.436 4.166 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)N[C@H](c2cccc(F)c2)c2ccccn2)CN1Cc1ccccc1 ZINC000499025390 908400434 /nfs/dbraw/zinc/40/04/34/908400434.db2.gz GTUSGFHACWELIB-RVSNTGDXSA-N 0 3 418.516 4.272 20 0 HIADHN COc1ccc([C@@H](CO)N(C)CCOc2ccc(Cl)cc2Br)cc1 ZINC000499049783 908420981 /nfs/dbraw/zinc/42/09/81/908420981.db2.gz SKCRFLVAEKGVDR-QGZVFWFLSA-N 0 3 414.727 4.155 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)N2CC[C@@H](C(F)(F)F)C2(C)C)N(C)C)cc1 ZINC000512918662 921411936 /nfs/dbraw/zinc/41/19/36/921411936.db2.gz ROJKXJJVRXHPIW-QZTJIDSGSA-N 0 3 415.500 4.449 20 0 HIADHN C[C@H]1CC[C@H](c2ccccc2)N(C(=O)NCc2ccccc2CN2CCC(O)CC2)C1 ZINC000499110004 908468790 /nfs/dbraw/zinc/46/87/90/908468790.db2.gz ITIYPOFKDYWCCX-NBGIEHNGSA-N 0 3 421.585 4.326 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)CSCc2coc(-c3ccccc3)n2)N(C)C)cc1 ZINC000499136561 908493410 /nfs/dbraw/zinc/49/34/10/908493410.db2.gz XCGVCGOCGVSACM-OAQYLSRUSA-N 0 3 409.555 4.302 20 0 HIADHN Cc1ccc([C@H](CNC(=O)CCc2nc(-c3ccc(Cl)cc3)no2)N(C)C)cc1 ZINC000499140782 908497555 /nfs/dbraw/zinc/49/75/55/908497555.db2.gz GGVDFPQLKGHEPJ-IBGZPJMESA-N 0 3 412.921 4.050 20 0 HIADHN Cc1cc(C)n(Cc2cccc(C(=O)N(CCN(C)C)Cc3cccc(Cl)c3)c2)n1 ZINC000499250660 908625666 /nfs/dbraw/zinc/62/56/66/908625666.db2.gz WDDIVXRAABNWRC-UHFFFAOYSA-N 0 3 424.976 4.406 20 0 HIADHN CC(C)(C)[C@@H]1CCN(Cc2cn(Cc3ccccc3)nc2-c2cccnc2)C[C@@H]1O ZINC000499254394 908629990 /nfs/dbraw/zinc/62/99/90/908629990.db2.gz KRXJXHTVKHEAAA-PKTZIBPZSA-N 0 3 404.558 4.222 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)NCCc2csc(C(C)(C)C)n2)c1 ZINC000499336378 908711678 /nfs/dbraw/zinc/71/16/78/908711678.db2.gz VXHJRQNBXNVTIN-UHFFFAOYSA-N 0 3 402.608 4.065 20 0 HIADHN C[C@@H](C(=O)Nc1ccc(OC2CCN(C)CC2)nc1)c1ccc(Br)cc1 ZINC000499340982 908716268 /nfs/dbraw/zinc/71/62/68/908716268.db2.gz CMABHWIPRGEWSA-CQSZACIVSA-N 0 3 418.335 4.059 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)c1ccc(C(F)(F)F)nc1 ZINC000499358284 908726554 /nfs/dbraw/zinc/72/65/54/908726554.db2.gz QIXLPUNDOBWYAB-UHFFFAOYSA-N 0 3 419.369 4.323 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2ccc(OC[C@H]3CCCO3)cc2)N2CCCC2)cc1 ZINC000499395711 908756694 /nfs/dbraw/zinc/75/66/94/908756694.db2.gz BPXOAPRNOHNHAL-DNQXCXABSA-N 0 3 408.542 4.120 20 0 HIADHN C[C@H](NC(=O)Nc1ccc(CCN2CCSCC2)cc1)c1cccc(F)c1F ZINC000499569891 908843486 /nfs/dbraw/zinc/84/34/86/908843486.db2.gz OHIZVAWRZBBGRY-HNNXBMFYSA-N 0 3 405.514 4.439 20 0 HIADHN Cc1nn(-c2ccccc2)c(Oc2cccc(F)c2)c1CN[C@H]1CCc2c[nH]nc2C1 ZINC000499678573 908874403 /nfs/dbraw/zinc/87/44/03/908874403.db2.gz AYRGZWFHXXFZJU-IBGZPJMESA-N 0 3 417.488 4.482 20 0 HIADHN CSC[C@@H](CCO)NCc1c(C)nn(-c2ccccc2)c1Oc1ccc(F)cc1 ZINC000499706494 908883675 /nfs/dbraw/zinc/88/36/75/908883675.db2.gz NZVIVXALHORXDP-GOSISDBHSA-N 0 3 415.534 4.316 20 0 HIADHN O=C(NCc1cccnc1OC1CCCC1)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000499760811 908901224 /nfs/dbraw/zinc/90/12/24/908901224.db2.gz XEAXIXJAMKXREH-QFIPXVFZSA-N 0 3 408.546 4.039 20 0 HIADHN CCCOc1ccc(CNC(=O)N[C@H](CN2CCCC2)c2ccccc2)cc1OC ZINC000499785387 908919528 /nfs/dbraw/zinc/91/95/28/908919528.db2.gz JBEKACNXPNRFLZ-OAQYLSRUSA-N 0 3 411.546 4.120 20 0 HIADHN C[C@@H]1C[C@@H]1c1ccc([C@@H]2C[C@H]2C(=O)NCCCN2CCN(C)C[C@H]2c2ccccc2)o1 ZINC000499848125 908981775 /nfs/dbraw/zinc/98/17/75/908981775.db2.gz GDGUIXSYFAAZST-FHGIMWBPSA-N 0 3 421.585 4.002 20 0 HIADHN COCCCOc1cccc(CN2CCC(C(=O)Nc3cccc(F)c3)CC2)c1 ZINC000513032487 921491674 /nfs/dbraw/zinc/49/16/74/921491674.db2.gz MEWMMTANWRKZIQ-UHFFFAOYSA-N 0 3 400.494 4.092 20 0 HIADHN COc1cc(CN2CCC(C(=O)Nc3cccc(F)c3)CC2)ccc1OC(F)F ZINC000513032685 921492003 /nfs/dbraw/zinc/49/20/03/921492003.db2.gz NUPHTMZPEWUFGJ-UHFFFAOYSA-N 0 3 408.420 4.286 20 0 HIADHN O=C(NC[C@H]1CCCN(Cc2ccc(OCc3ccncc3)cc2)C1)c1ccccc1 ZINC000513038574 921496328 /nfs/dbraw/zinc/49/63/28/921496328.db2.gz ZFTABPRDQWDTOV-HSZRJFAPSA-N 0 3 415.537 4.303 20 0 HIADHN COc1cc(CNCCn2cc(Br)cn2)ccc1OCc1cccs1 ZINC000513038249 921496708 /nfs/dbraw/zinc/49/67/08/921496708.db2.gz XFALGEOPXRFIIW-UHFFFAOYSA-N 0 3 422.348 4.085 20 0 HIADHN CCN(C(=O)c1nnn(-c2ccc(C)cc2)c1C)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000500011120 909465846 /nfs/dbraw/zinc/46/58/46/909465846.db2.gz YEUQYXKYIXVRNH-WMZHIEFXSA-N 0 3 417.557 4.182 20 0 HIADHN CCc1nnc(NC(=O)[C@@H](C)[C@H](C)NCc2ccccc2OC2CCCC2)s1 ZINC000513039993 921498066 /nfs/dbraw/zinc/49/80/66/921498066.db2.gz FFWVUZPBSPQXFJ-GJZGRUSLSA-N 0 3 402.564 4.175 20 0 HIADHN CCCc1noc2nc(CC)cc(C(=O)NC3CCN(Cc4ccccc4)CC3)c12 ZINC000500019712 909474288 /nfs/dbraw/zinc/47/42/88/909474288.db2.gz OQFWRIFZQFHFMG-UHFFFAOYSA-N 0 3 406.530 4.132 20 0 HIADHN CC(C)[C@H]1CC[C@@H](C)C[C@@H]1OCC(=O)N(C)C1CCN(CCc2ccccn2)CC1 ZINC000500063105 909529696 /nfs/dbraw/zinc/52/96/96/909529696.db2.gz LZZSZDYPRSCMPQ-HUVFLSCGSA-N 0 3 415.622 4.024 20 0 HIADHN C[C@@H]1C[C@@H]1c1ccc([C@@H]2C[C@@H]2C(=O)NCCCCN2CCN(c3ccccc3)CC2)o1 ZINC000500068478 909538636 /nfs/dbraw/zinc/53/86/36/909538636.db2.gz WQWMUSSHZHCFHB-PNJWGLBASA-N 0 3 421.585 4.225 20 0 HIADHN CCc1nnc(NC(=O)[C@H](C)[C@@H](C)NCc2cc(C)c(C)cc2OC(F)F)s1 ZINC000513046130 921504048 /nfs/dbraw/zinc/50/40/48/921504048.db2.gz JJVINOGMCUHPIL-CHWSQXEVSA-N 0 3 412.506 4.072 20 0 HIADHN Cc1noc(Cl)c1CCC(=O)N(CCN(C)C)Cc1ccc(C(F)(F)F)cc1 ZINC000500095820 909572975 /nfs/dbraw/zinc/57/29/75/909572975.db2.gz FEBQLLMYEKLLLN-UHFFFAOYSA-N 0 3 417.859 4.178 20 0 HIADHN Cc1ccc([C@H](Cn2ccnc2)NC(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)c(C)c1 ZINC000500099602 909577816 /nfs/dbraw/zinc/57/78/16/909577816.db2.gz BNHIZAIWXPHWPV-QDSKXPNFSA-N 0 3 419.573 4.232 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)N[C@@H]2CC(C)(C)Oc3cc(F)ccc32)cc1 ZINC000500131561 909611517 /nfs/dbraw/zinc/61/15/17/909611517.db2.gz NBHMEARIFBVHEG-WOJBJXKFSA-N 0 3 415.509 4.039 20 0 HIADHN Cc1cc2cc(CNCc3ccc(OCCN4CCOCC4)c(Cl)c3)ccc2[nH]1 ZINC000513061635 921518302 /nfs/dbraw/zinc/51/83/02/921518302.db2.gz BZVCCKCYMTXIMO-UHFFFAOYSA-N 0 3 413.949 4.131 20 0 HIADHN C[C@@H]1C[C@@H]1c1ccc([C@H]2C[C@@H]2C(=O)N(C)C2CCN(CCc3ccccn3)CC2)o1 ZINC000500330847 909790551 /nfs/dbraw/zinc/79/05/51/909790551.db2.gz CIQVFXURLRMQSR-MNAPGUCWSA-N 0 3 407.558 4.067 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)CCc2c[nH]c3cc(C)ccc23)cc1 ZINC000500387933 909828770 /nfs/dbraw/zinc/82/87/70/909828770.db2.gz HSJLXHUHZUZNTE-DEOSSOPVSA-N 0 3 405.542 4.371 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)c2cc(C(C)C)n(C(C)(C)C)n2)cc1 ZINC000500422405 909846410 /nfs/dbraw/zinc/84/64/10/909846410.db2.gz ITHFBVZOOPNPLE-OAQYLSRUSA-N 0 3 412.578 4.337 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)c2ccc(OCC(F)(F)F)cc2)cc1 ZINC000500420939 909847037 /nfs/dbraw/zinc/84/70/37/909847037.db2.gz NBGZNFTZLLYSLZ-HXUWFJFHSA-N 0 3 422.447 4.203 20 0 HIADHN O=C(NC[C@H]1CCCN(Cc2c[nH]nc2-c2ccc(Cl)cc2)C1)c1ccccc1 ZINC000513076155 921529024 /nfs/dbraw/zinc/52/90/24/921529024.db2.gz NRFYQMAXSGJNAL-QGZVFWFLSA-N 0 3 408.933 4.372 20 0 HIADHN Cc1ccc([C@H](CN2CCOCC2)NCc2ccc(OCc3ccccn3)cc2)cc1 ZINC000500536081 909913248 /nfs/dbraw/zinc/91/32/48/909913248.db2.gz RGIDHULUATUQAR-SANMLTNESA-N 0 3 417.553 4.132 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)N[C@@H](c2ccc(C)cc2)C2CC2)CC1 ZINC000500622404 909973011 /nfs/dbraw/zinc/97/30/11/909973011.db2.gz VKPRJCCEABXPDZ-VWLOTQADSA-N 0 3 420.601 4.083 20 0 HIADHN CCC[C@H](NC(=O)NCc1ccc(CN2CCN(CC)CC2)cc1)c1ccccc1 ZINC000500661624 910002028 /nfs/dbraw/zinc/00/20/28/910002028.db2.gz HPCIMNIVWYERRB-DEOSSOPVSA-N 0 3 408.590 4.165 20 0 HIADHN C[C@@H](NC(=O)C(=O)Nc1cc(C(F)F)ccc1Cl)[C@H](c1ccccc1)N(C)C ZINC000500689512 910023816 /nfs/dbraw/zinc/02/38/16/910023816.db2.gz WYOLEVOFLHNRAJ-SJKOYZFVSA-N 0 3 409.864 4.024 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCC1(C)CCOCC1)c1ccc(C(F)(F)F)cc1 ZINC000500768737 910069892 /nfs/dbraw/zinc/06/98/92/910069892.db2.gz HSQNPJUSJICAOU-GOSISDBHSA-N 0 3 415.500 4.204 20 0 HIADHN COc1ccccc1COC1CCN(Cc2ccc(OC)c(OC(F)F)c2)CC1 ZINC000500783351 910076326 /nfs/dbraw/zinc/07/63/26/910076326.db2.gz JLFRVAQLBZMIBX-UHFFFAOYSA-N 0 3 407.457 4.486 20 0 HIADHN Fc1ccc(-c2noc([C@H]3CCCN(Cc4cccc5c4OCCCO5)C3)n2)cc1 ZINC000513107447 921554785 /nfs/dbraw/zinc/55/47/85/921554785.db2.gz VYGKBMJCFBLSLV-SFHVURJKSA-N 0 3 409.461 4.417 20 0 HIADHN COc1ccc(-c2n[nH]cc2CN2CCC(C(=O)Nc3ccc(F)cc3)CC2)cc1 ZINC000513112362 921558365 /nfs/dbraw/zinc/55/83/65/921558365.db2.gz YAWCSAODXDPTNL-UHFFFAOYSA-N 0 3 408.477 4.075 20 0 HIADHN O=C(c1cccc(CN2CCCC2)c1)N1CCN(c2ccc(C(F)(F)F)cc2)CC1 ZINC000501170833 910340507 /nfs/dbraw/zinc/34/05/07/910340507.db2.gz NWYUOLQPOPQDJK-UHFFFAOYSA-N 0 3 417.475 4.264 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2cccc(NC(=O)c3ccoc3)c2)N(C)C)cc1 ZINC000501182371 910348941 /nfs/dbraw/zinc/34/89/41/910348941.db2.gz RHQJGJNOWHGREF-NRFANRHFSA-N 0 3 406.486 4.265 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3c(C)cc(N(C)C)cc3C)c(C)c2)CC1 ZINC000501199971 910363644 /nfs/dbraw/zinc/36/36/44/910363644.db2.gz YSUNGCROSUEFKD-UHFFFAOYSA-N 0 3 409.578 4.464 20 0 HIADHN C[C@H](Cn1cccn1)NCC(=O)Nc1ccccc1Sc1ccc(Cl)cc1 ZINC000501277145 910439876 /nfs/dbraw/zinc/43/98/76/910439876.db2.gz MKOFCDKFMAGMMT-OAHLLOKOSA-N 0 3 400.935 4.305 20 0 HIADHN CN(CCN(Cc1ccccc1)C(=O)NCC1(C)CCOCC1)Cc1ccccc1 ZINC000501331534 910472504 /nfs/dbraw/zinc/47/25/04/910472504.db2.gz JPBDEOHGZUAWJM-UHFFFAOYSA-N 0 3 409.574 4.147 20 0 HIADHN CC1CCN([C@H](CNC(=O)C2(c3ccc(F)cc3)CCOCC2)c2ccccc2)CC1 ZINC000501344762 910482319 /nfs/dbraw/zinc/48/23/19/910482319.db2.gz RQHFXSGGCDWCQK-XMMPIXPASA-N 0 3 424.560 4.463 20 0 HIADHN Cc1c(NC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)cnn1CC(C)C ZINC000501349085 910485351 /nfs/dbraw/zinc/48/53/51/910485351.db2.gz AECXDIUJWMNOLV-HXUWFJFHSA-N 0 3 408.468 4.241 20 0 HIADHN CC[C@H](CNC(=O)Nc1cccc(C(=O)N(CC)CC)c1)N1CCc2ccccc2C1 ZINC000501353506 910489623 /nfs/dbraw/zinc/48/96/23/910489623.db2.gz QWEXXTWFDPVSEH-HSZRJFAPSA-N 0 3 422.573 4.127 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)Nc1ccc(-c2ncco2)cc1 ZINC000501370626 910498277 /nfs/dbraw/zinc/49/82/77/910498277.db2.gz HOUVQZYVSRPPIX-UHFFFAOYSA-N 0 3 400.429 4.216 20 0 HIADHN CCC(CC)C(=O)N1CCC(NCc2c(F)ccc(Br)c2F)CC1 ZINC000501445002 910571885 /nfs/dbraw/zinc/57/18/85/910571885.db2.gz CEKLBNSCQZTEKJ-UHFFFAOYSA-N 0 3 403.311 4.244 20 0 HIADHN CC1CCN([C@H](CNC(=O)NC[C@H](c2ccsc2)N(C)C)c2cccs2)CC1 ZINC000501520899 910629929 /nfs/dbraw/zinc/62/99/29/910629929.db2.gz XPSNYYUGRQNFKW-RTBURBONSA-N 0 3 420.648 4.185 20 0 HIADHN CN(C)[C@@H](CNC(=O)N1CCN(Cc2cccc3ccccc32)CC1)c1ccsc1 ZINC000501519837 910630934 /nfs/dbraw/zinc/63/09/34/910630934.db2.gz VFBXWNWMABYELE-QHCPKHFHSA-N 0 3 422.598 4.031 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)N[C@@H]2CCCOc3cc(Cl)ccc32)cc1 ZINC000501555164 910657761 /nfs/dbraw/zinc/65/77/61/910657761.db2.gz NNOYDCFZFHESJH-WOJBJXKFSA-N 0 3 417.937 4.164 20 0 HIADHN CCCn1nccc1C1CCN(C[C@@H](O)COc2cc(Cl)ccc2Cl)CC1 ZINC000501562082 910669785 /nfs/dbraw/zinc/66/97/85/910669785.db2.gz VHUJBUYJPKQZAR-QGZVFWFLSA-N 0 3 412.361 4.219 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N[C@H]1CCO[C@@H]1c1ccc(Cl)cc1)c1ccco1 ZINC000501562397 910670679 /nfs/dbraw/zinc/67/06/79/910670679.db2.gz ASTSNZAUIXIDQO-FEUVXWNVSA-N 0 3 405.926 4.192 20 0 HIADHN CC(C)[C@@H](NC(=O)NCCCN1CCc2ccccc2C1)c1nc2ccccc2[nH]1 ZINC000501707695 910774992 /nfs/dbraw/zinc/77/49/92/910774992.db2.gz DJWWPACESJMJGJ-JOCHJYFZSA-N 0 3 405.546 4.008 20 0 HIADHN Fc1cc(CN[C@@]2(Cc3ccc(C(F)(F)F)cc3)CCOC2)c2c(c1)COCO2 ZINC000513179230 921604579 /nfs/dbraw/zinc/60/45/79/921604579.db2.gz VXNHEZAIBGDYQD-HXUWFJFHSA-N 0 3 411.395 4.202 20 0 HIADHN CC(=O)c1cccc(O[C@H](C)C(=O)N[C@H](CN2CCc3ccccc3C2)C(C)(C)C)c1 ZINC000501763550 910818974 /nfs/dbraw/zinc/81/89/74/910818974.db2.gz CDKKRZARCVCIMN-NTKDMRAZSA-N 0 3 422.569 4.246 20 0 HIADHN NC(=O)C1CCN(Cc2cccc(NC(=O)c3occc3-c3ccc(F)cc3)c2)CC1 ZINC000501777568 910832704 /nfs/dbraw/zinc/83/27/04/910832704.db2.gz FHBFAXUDLQUGJV-UHFFFAOYSA-N 0 3 421.472 4.035 20 0 HIADHN CCN(Cc1ccccc1NC(=O)N[C@@H](CN1CCCC1)c1ccccc1)C(C)=O ZINC000501783966 910837686 /nfs/dbraw/zinc/83/76/86/910837686.db2.gz GWZCDJJSSQKZKK-QHCPKHFHSA-N 0 3 408.546 4.014 20 0 HIADHN CCN(CC)C(=O)c1ccc(NC(=O)N[C@@H](CN2CCCC2)c2ccccc2)cc1 ZINC000501801753 910851996 /nfs/dbraw/zinc/85/19/96/910851996.db2.gz GGQODDSVCOWRMF-QFIPXVFZSA-N 0 3 408.546 4.127 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)N(Cc1cccs1)C[C@H]1CCCO1 ZINC000501807093 910857874 /nfs/dbraw/zinc/85/78/74/910857874.db2.gz ZWSDGZXFCWTPQQ-IRLDBZIGSA-N 0 3 413.587 4.276 20 0 HIADHN CCc1ccccc1NC(=O)CN[C@@]1(Cc2ccc(C(F)(F)F)cc2)CCOC1 ZINC000513195347 921614407 /nfs/dbraw/zinc/61/44/07/921614407.db2.gz AQYXAHVUOFBKKS-OAQYLSRUSA-N 0 3 406.448 4.198 20 0 HIADHN CCN(C(=O)[C@H](C)Oc1cccc(C(C)=O)c1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000501954016 910941665 /nfs/dbraw/zinc/94/16/65/910941665.db2.gz DCSONAVMYROUJL-LEDOBFOHSA-N 0 3 408.542 4.341 20 0 HIADHN CCN(C(=O)c1cnc2c(cnn2CC(C)C)c1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000501962426 910949862 /nfs/dbraw/zinc/94/98/62/910949862.db2.gz PQIDTUPUFQCUES-CVDCTZTESA-N 0 3 419.573 4.385 20 0 HIADHN CCN(C(=O)[C@H](C)OCc1cccc(OC)c1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000501965286 910951858 /nfs/dbraw/zinc/95/18/58/910951858.db2.gz TWCVFWHRQQZTDO-QTEQDKRBSA-N 0 3 410.558 4.284 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)Cc1c[nH]c2ccccc12 ZINC000502009248 910975353 /nfs/dbraw/zinc/97/53/53/910975353.db2.gz KUDRGNLMWBMHAR-UHFFFAOYSA-N 0 3 403.448 4.320 20 0 HIADHN C[C@H](Cc1cncc2ccccc21)C(=O)NC1CCN([C@H](C)c2ccncc2)CC1 ZINC000502008531 910975741 /nfs/dbraw/zinc/97/57/41/910975741.db2.gz IMVBJKAOVFVBCP-RTBURBONSA-N 0 3 402.542 4.150 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)C[C@@H](c2cccs2)n2cccc2)CC1 ZINC000502013140 910976988 /nfs/dbraw/zinc/97/69/88/910976988.db2.gz YTRKFJWDYSVHNA-RXVVDRJESA-N 0 3 408.571 4.266 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)C[C@@H](c2cccs2)n2cccc2)CC1 ZINC000502013139 910977169 /nfs/dbraw/zinc/97/71/69/910977169.db2.gz YTRKFJWDYSVHNA-NQIIRXRSSA-N 0 3 408.571 4.266 20 0 HIADHN C[C@@H](NC[C@@H]1CN(C(=O)c2ccccc2)[C@H]2CCN1C2)c1cccc(Cl)c1Cl ZINC000502038355 910992346 /nfs/dbraw/zinc/99/23/46/910992346.db2.gz WWAVRKOCKXKQEI-BPQIPLTHSA-N 0 3 418.368 4.243 20 0 HIADHN C[C@@H](CCc1ccc(Br)cc1)N[C@H](C(=O)NC1CC1)c1ccccc1 ZINC000513209990 921626525 /nfs/dbraw/zinc/62/65/25/921626525.db2.gz MSYFFUSZSGNQLK-YWZLYKJASA-N 0 3 401.348 4.380 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)[C@H]1C[C@@H]1c1ccc(Br)cc1 ZINC000513224467 921638641 /nfs/dbraw/zinc/63/86/41/921638641.db2.gz SYEXVXMNCUCYSE-HBMCJLEFSA-N 0 3 413.359 4.333 20 0 HIADHN O=C(COc1ccc(Oc2ccccn2)cc1)NC[C@H]1CCCN1Cc1ccccc1 ZINC000513226444 921640669 /nfs/dbraw/zinc/64/06/69/921640669.db2.gz JAZOGWZDJNSQBM-OAQYLSRUSA-N 0 3 417.509 4.034 20 0 HIADHN COc1cc(C)c(C[C@H](C)N[C@H](CCSC)c2nnc3ccccn32)cc1OC ZINC000502280617 911230764 /nfs/dbraw/zinc/23/07/64/911230764.db2.gz WKNACZHTKZDSFL-FUHWJXTLSA-N 0 3 414.575 4.070 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)Cc2ccc(OCc3ccccn3)cc2)N(C)C)cc1 ZINC000502286690 911242045 /nfs/dbraw/zinc/24/20/45/911242045.db2.gz XYIBMNUDGNBWMV-RUZDIDTESA-N 0 3 417.553 4.185 20 0 HIADHN Cc1sc(NC(=O)CNC(C)(C)COc2ncccc2C(F)(F)F)c(C)c1C ZINC000502299359 911258286 /nfs/dbraw/zinc/25/82/86/911258286.db2.gz WXQBHBONVCROIQ-UHFFFAOYSA-N 0 3 415.481 4.473 20 0 HIADHN Cc1ccc([C@H](C)N(C)C(=O)NCCCN2CCN(C)C[C@H]2c2ccccc2)cc1 ZINC000502347033 911328282 /nfs/dbraw/zinc/32/82/82/911328282.db2.gz STVOXOIAFMDASN-URXFXBBRSA-N 0 3 408.590 4.076 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)N[C@H]2CCOc3c(F)cccc32)N(C)C)cc1 ZINC000502397203 911382095 /nfs/dbraw/zinc/38/20/95/911382095.db2.gz DTGGSOIUHPNYGZ-LEWJYISDSA-N 0 3 415.509 4.039 20 0 HIADHN COCc1cc(CNC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)ccc1F ZINC000502409979 911391530 /nfs/dbraw/zinc/39/15/30/911391530.db2.gz UIYCQTQTLSYBPN-OAQYLSRUSA-N 0 3 424.438 4.043 20 0 HIADHN COc1ccc([C@H]2CCCN2C(=O)CN[C@H](c2ccc(F)cc2)C(C)C)c(OC)c1 ZINC000502508402 911513600 /nfs/dbraw/zinc/51/36/00/911513600.db2.gz IGUOOGJLFJPGLO-QPPBQGQZSA-N 0 3 414.521 4.493 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CNC(=O)CN[C@@H](c1ccc(F)cc1)C(C)C ZINC000502534229 911538977 /nfs/dbraw/zinc/53/89/77/911538977.db2.gz AKKVRHYAPFLFSI-XMMPIXPASA-N 0 3 408.521 4.231 20 0 HIADHN O=C(c1cccc(CN[C@@]2(Cc3ccc(Cl)cc3)CCOC2)c1)N1CCCCC1 ZINC000502550383 911556516 /nfs/dbraw/zinc/55/65/16/911556516.db2.gz IUXIWEUPCZCWGW-XMMPIXPASA-N 0 3 412.961 4.458 20 0 HIADHN COc1ccc(NC(=O)[C@@H](c2ccccc2)N(C)CC2CCOCC2)cc1Cl ZINC000502554019 911561395 /nfs/dbraw/zinc/56/13/95/911561395.db2.gz NKZWVUIPCJZEEJ-OAQYLSRUSA-N 0 3 402.922 4.387 20 0 HIADHN O=S1(=O)CC[C@H](NC[C@@H]2CCCC(F)(F)C2)c2cc(Br)ccc21 ZINC000502573049 911578781 /nfs/dbraw/zinc/57/87/81/911578781.db2.gz CTJRKJZKEPMCLD-RISCZKNCSA-N 0 3 408.308 4.083 20 0 HIADHN O=C(NC1CCN(Cc2ccccc2)CC1)c1cnc(-c2ccc(F)c(F)c2)s1 ZINC000502646668 911686027 /nfs/dbraw/zinc/68/60/27/911686027.db2.gz HJMIBWPNUPYTTB-UHFFFAOYSA-N 0 3 413.493 4.483 20 0 HIADHN C[C@H](NC(=O)NC[C@H](c1ccccc1)N1CCCC1)c1ccc(NC(=O)C2CC2)cc1 ZINC000502650430 911690494 /nfs/dbraw/zinc/69/04/94/911690494.db2.gz OLLLMOWPYUAIGD-FDDCHVKYSA-N 0 3 420.557 4.232 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)Nc1ccc(OCC2CC2)cc1 ZINC000502797044 911818005 /nfs/dbraw/zinc/81/80/05/911818005.db2.gz BMHURWVYSFITGQ-UHFFFAOYSA-N 0 3 422.573 4.199 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)CCCc3nc4ccccc4[nH]3)c2)CC1 ZINC000502871195 911875645 /nfs/dbraw/zinc/87/56/45/911875645.db2.gz VPKDTBMNHSXJCH-UHFFFAOYSA-N 0 3 405.546 4.055 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)Cc3csc(C(C)(C)C)n3)c2)CC1 ZINC000502870280 911875798 /nfs/dbraw/zinc/87/57/98/911875798.db2.gz PVLJLTAQRWWLSZ-UHFFFAOYSA-N 0 3 400.592 4.152 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)Cc3ccc(Br)s3)c2)CC1 ZINC000502892076 911886706 /nfs/dbraw/zinc/88/67/06/911886706.db2.gz IFBKOYWRQSSNPJ-UHFFFAOYSA-N 0 3 422.392 4.222 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cnn(Cc2ccccc2)c1C)c1cccc(OC)c1 ZINC000513314080 921705986 /nfs/dbraw/zinc/70/59/86/921705986.db2.gz AQLXEMNDQWHRNF-XMMPIXPASA-N 0 3 420.557 4.061 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)N[C@H](c1ccccc1)c1ccncc1 ZINC000503014048 911987384 /nfs/dbraw/zinc/98/73/84/911987384.db2.gz GRUZXFSXDZCYAG-BJKOFHAPSA-N 0 3 400.526 4.307 20 0 HIADHN Cc1nc(CCN2CCN(CCc3csc(C)n3)C3(CCCCC3)C2)cs1 ZINC000503074392 912044074 /nfs/dbraw/zinc/04/40/74/912044074.db2.gz JVLUNDYCLZDNBD-UHFFFAOYSA-N 0 3 404.649 4.322 20 0 HIADHN Cc1cnc([C@@H](NC(=O)[C@@H]2CN(Cc3ccccc3)CCC2(F)F)C2CC2)s1 ZINC000513333800 921719886 /nfs/dbraw/zinc/71/98/86/921719886.db2.gz QFGDOVDMGKKWPQ-ROUUACIJSA-N 0 3 405.514 4.176 20 0 HIADHN Cc1cnc([C@@H](NC(=O)[C@H]2CN(Cc3ccccc3)CCC2(F)F)C2CC2)s1 ZINC000513333797 921720386 /nfs/dbraw/zinc/72/03/86/921720386.db2.gz QFGDOVDMGKKWPQ-MSOLQXFVSA-N 0 3 405.514 4.176 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCCC1)c1ccc([C@H]2CCCOC2)cc1 ZINC000503125476 912087052 /nfs/dbraw/zinc/08/70/52/912087052.db2.gz IYWXWAICYSTYNM-NRFANRHFSA-N 0 3 402.604 4.062 20 0 HIADHN COc1cccc([C@@H](CNC(=O)NCCc2ccc(F)cc2Cl)N2CCCC2)c1 ZINC000503157730 912125079 /nfs/dbraw/zinc/12/50/79/912125079.db2.gz PXNMPJMIMTVKJM-OAQYLSRUSA-N 0 3 419.928 4.167 20 0 HIADHN O[C@@H](Cc1ccc(C(F)(F)F)cc1)CN1CCC[C@@H]1c1nnc(-c2ccccc2)[nH]1 ZINC000503168078 912139921 /nfs/dbraw/zinc/13/99/21/912139921.db2.gz BLUXUXLBMSLOLD-RBUKOAKNSA-N 0 3 416.447 4.231 20 0 HIADHN O[C@H](COc1ccc(Cl)cc1Br)CN1CCC[C@@H]1c1ccncc1 ZINC000503168868 912142471 /nfs/dbraw/zinc/14/24/71/912142471.db2.gz ZFKJSTXLHHGIGZ-DOTOQJQBSA-N 0 3 411.727 4.074 20 0 HIADHN O[C@@H](COc1ccc(Cl)cc1Br)CN1CCC[C@H]1c1ccncc1 ZINC000503168871 912142644 /nfs/dbraw/zinc/14/26/44/912142644.db2.gz ZFKJSTXLHHGIGZ-WBVHZDCISA-N 0 3 411.727 4.074 20 0 HIADHN CN(C)Cc1cccc(NC(=O)c2cnn(-c3ncccc3Cl)c2C(F)F)c1 ZINC000503230296 912210888 /nfs/dbraw/zinc/21/08/88/912210888.db2.gz BRDKCMGHQCAJQJ-UHFFFAOYSA-N 0 3 405.836 4.172 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)Nc2ccccc2C(=O)N2CCCCC2)C1 ZINC000506293573 914889057 /nfs/dbraw/zinc/88/90/57/914889057.db2.gz GZMUNRKSDWKQCX-CTNGQTDRSA-N 0 3 420.557 4.270 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)Nc2cccc(Cl)c2-n2cccn2)C1 ZINC000506295816 914890342 /nfs/dbraw/zinc/89/03/42/914890342.db2.gz UQFGBGVLMQMYIB-FUHWJXTLSA-N 0 3 409.921 4.483 20 0 HIADHN COc1cc(NC(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)c(OC)cc1Cl ZINC000506294997 914890758 /nfs/dbraw/zinc/89/07/58/914890758.db2.gz MUGKVWAKKNODIW-GDBMZVCRSA-N 0 3 403.910 4.314 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)Nc2ccc(NC(=O)c3ccco3)cc2)C1 ZINC000506306601 914897615 /nfs/dbraw/zinc/89/76/15/914897615.db2.gz ADHAPCIJPDROKM-LAUBAEHRSA-N 0 3 418.497 4.489 20 0 HIADHN CCOc1cc2c(cc1NC(=O)N[C@@H]1CCN([C@@H](C)c3ccccc3)C1)O[C@H](C)C2 ZINC000506309662 914899179 /nfs/dbraw/zinc/89/91/79/914899179.db2.gz NQOYFQHRUQUHQD-FUHIMQAGSA-N 0 3 409.530 4.366 20 0 HIADHN COc1cc(OC)c(NC(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)cc1Cl ZINC000506312741 914904106 /nfs/dbraw/zinc/90/41/06/914904106.db2.gz QFSOHYYNLLIQTQ-ZBFHGGJFSA-N 0 3 403.910 4.314 20 0 HIADHN Cc1cccc(C2(NCC(=O)NCC3(c4ccccc4)CCOCC3)CCCC2)c1 ZINC000506485337 915091395 /nfs/dbraw/zinc/09/13/95/915091395.db2.gz HRXAOCOCBJIBFE-UHFFFAOYSA-N 0 3 406.570 4.219 20 0 HIADHN CCN(CCc1nccs1)C(=O)NC[C@@H](c1ccc(CC(C)C)cc1)N(C)C ZINC000513377897 921751969 /nfs/dbraw/zinc/75/19/69/921751969.db2.gz MYJCNWAWGMMFFP-FQEVSTJZSA-N 0 3 402.608 4.219 20 0 HIADHN CC[C@H](N[C@H](C)C(=O)N1CCSc2ccccc21)c1ccc(OC)c(OC)c1 ZINC000506601901 915254219 /nfs/dbraw/zinc/25/42/19/915254219.db2.gz MQJZWRDBETVGGY-WBVHZDCISA-N 0 3 400.544 4.272 20 0 HIADHN CN(C)[C@@H](CNC(=O)Nc1ccc(C(=O)Nc2ccccc2)cc1)c1ccccc1 ZINC000506637073 915305864 /nfs/dbraw/zinc/30/58/64/915305864.db2.gz RILLTLIPDDFJJC-QFIPXVFZSA-N 0 3 402.498 4.363 20 0 HIADHN c1ccc(OCc2cccnc2)c(CN2CCC[C@H](c3nnc4n3CCCCC4)C2)c1 ZINC000506689398 915365989 /nfs/dbraw/zinc/36/59/89/915365989.db2.gz KLRUOQJBISVNBX-QFIPXVFZSA-N 0 3 417.557 4.358 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(C)c1CN1CCC(C(=O)NCc2ccccc2)CC1 ZINC000506722662 915404595 /nfs/dbraw/zinc/40/45/95/915404595.db2.gz ZBKPXVMJCYEDBE-UHFFFAOYSA-N 0 3 420.532 4.157 20 0 HIADHN C[C@H](CNC(=O)N(CCN(C)C)Cc1ccc(C(F)(F)F)cc1)Oc1ccccc1 ZINC000506797452 915533543 /nfs/dbraw/zinc/53/35/43/915533543.db2.gz OZIHKLNESFGEST-QGZVFWFLSA-N 0 3 423.479 4.246 20 0 HIADHN COC(=O)c1c(C2CC2)csc1NC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000506851405 915634196 /nfs/dbraw/zinc/63/41/96/915634196.db2.gz OIPFUMCNXDLVQA-QGZVFWFLSA-N 0 3 413.543 4.150 20 0 HIADHN COc1ccc([C@H]2CCCCCN2C(=O)CN[C@@H](C)c2ccc3n[nH]cc3c2)cc1 ZINC000513421053 921788909 /nfs/dbraw/zinc/78/89/09/921788909.db2.gz SRANKAMHFXMPRW-GAJHUEQPSA-N 0 3 406.530 4.366 20 0 HIADHN Cc1cc(NC(=O)c2ccncc2C(F)(F)F)cc(N2CCN(C(C)C)CC2)c1 ZINC000506934246 915737784 /nfs/dbraw/zinc/73/77/84/915737784.db2.gz VSVGCRAZUKXQRN-UHFFFAOYSA-N 0 3 406.452 4.192 20 0 HIADHN COC(=O)c1cc(Cl)ccc1NC(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000506938191 915742601 /nfs/dbraw/zinc/74/26/01/915742601.db2.gz GYQXMXZGBVKYFU-UHFFFAOYSA-N 0 3 415.921 4.255 20 0 HIADHN CC(C)(C)[C@@H](NCC(=O)N1CCC(C(=O)N2CCCCCC2)CC1)c1ccccc1 ZINC000506995299 915809210 /nfs/dbraw/zinc/80/92/10/915809210.db2.gz RUSWGOWITAYQHD-QHCPKHFHSA-N 0 3 413.606 4.005 20 0 HIADHN COc1cc(CN2CCC(C(=O)NCc3ccc(F)cc3)CC2)ccc1OC(C)C ZINC000507006151 915817819 /nfs/dbraw/zinc/81/78/19/915817819.db2.gz CFADWGVFELXKPA-UHFFFAOYSA-N 0 3 414.521 4.150 20 0 HIADHN COc1cc(CN(Cc2cccs2)C(C)C)ccc1OCC(=O)N1CCCC1 ZINC000507018831 915825233 /nfs/dbraw/zinc/82/52/33/915825233.db2.gz ADCWGFRICPPMOO-UHFFFAOYSA-N 0 3 402.560 4.169 20 0 HIADHN Cc1cc(NC(=O)CN[C@@H](c2ccc(F)cc2)C(C)(C)C)n(-c2nc(C)cc(C)n2)n1 ZINC000507027645 915830341 /nfs/dbraw/zinc/83/03/41/915830341.db2.gz WPWBBBWGIVHQFV-NRFANRHFSA-N 0 3 424.524 4.042 20 0 HIADHN COc1ccc(-c2nc(C)c([C@@H](C)NC(=O)N(C)[C@H]3CCN(C4CC4)C3)s2)cc1 ZINC000507059530 915846315 /nfs/dbraw/zinc/84/63/15/915846315.db2.gz KQYADMZZKNVEDA-QAPCUYQASA-N 0 3 414.575 4.066 20 0 HIADHN O=c1[nH]c(CN2CCN(CC(c3ccccc3)c3ccccc3)CC2)nc2ccccc21 ZINC000507073211 915853919 /nfs/dbraw/zinc/85/39/19/915853919.db2.gz YCZUIMKCZBMNHB-UHFFFAOYSA-N 0 3 424.548 4.285 20 0 HIADHN CCCn1nccc1C1CCN(C(=O)NC[C@@H](CC)N2CCc3ccccc3C2)CC1 ZINC000507118310 915876708 /nfs/dbraw/zinc/87/67/08/915876708.db2.gz MODGEALZLAFOJS-HSZRJFAPSA-N 0 3 423.605 4.019 20 0 HIADHN Cc1ccccc1C(=O)NC1CCN(Cc2c[nH]nc2-c2cccc(Cl)c2)CC1 ZINC000507133783 915883091 /nfs/dbraw/zinc/88/30/91/915883091.db2.gz FDZRHJAHIHHQAV-UHFFFAOYSA-N 0 3 408.933 4.433 20 0 HIADHN O=C(N1CCCN(CCCc2ccccc2)CC1)C1(c2ccc(F)cc2)CCOCC1 ZINC000507140138 915886047 /nfs/dbraw/zinc/88/60/47/915886047.db2.gz SJKSISMCVLSDEK-UHFFFAOYSA-N 0 3 424.560 4.041 20 0 HIADHN COC(=O)CCn1nc(C)c(CN(Cc2cccc(Br)c2)C(C)C)c1C ZINC000507166100 915905364 /nfs/dbraw/zinc/90/53/64/915905364.db2.gz CKBWQGXBGWZYHX-UHFFFAOYSA-N 0 3 422.367 4.236 20 0 HIADHN COc1cc(-c2nnc(CN3CC[C@@H](c4ccccc4C)C3)o2)cc(OC)c1OC ZINC000507165498 915906027 /nfs/dbraw/zinc/90/60/27/915906027.db2.gz QNNXEAWKPQXWOL-MRXNPFEDSA-N 0 3 409.486 4.060 20 0 HIADHN Cc1ccc(-c2n[nH]cc2CN2CCC(C(=O)NCc3ccc(C)c(F)c3)CC2)cc1 ZINC000507189716 915938306 /nfs/dbraw/zinc/93/83/06/915938306.db2.gz WLKIQMPEQUEFOR-UHFFFAOYSA-N 0 3 420.532 4.361 20 0 HIADHN COCCOc1cc(C)ccc1NC(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000507190454 915939294 /nfs/dbraw/zinc/93/92/94/915939294.db2.gz ZQFXXGNFQPNVSC-LJQANCHMSA-N 0 3 418.484 4.116 20 0 HIADHN Cc1cc(C(=O)N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)c(C)cc1Br ZINC000507291209 916059632 /nfs/dbraw/zinc/05/96/32/916059632.db2.gz VRTMSVNKSDAWMR-CALCHBBNSA-N 0 3 423.395 4.027 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@H](C)N(C)CCc2cccc3ccccc32)cc1OC ZINC000507307519 916069253 /nfs/dbraw/zinc/06/92/53/916069253.db2.gz UQVURYFTLQQXLW-IBGZPJMESA-N 0 3 420.553 4.378 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@@H](C)N(C)CCc2cccc3ccccc32)cc1OC ZINC000507307520 916069581 /nfs/dbraw/zinc/06/95/81/916069581.db2.gz UQVURYFTLQQXLW-LJQANCHMSA-N 0 3 420.553 4.378 20 0 HIADHN CCOC(=O)CC1CCN(Cc2cccc(NC(=O)c3ccc(OC)cc3)c2)CC1 ZINC000507309983 916071069 /nfs/dbraw/zinc/07/10/69/916071069.db2.gz FYUMFZFADLHEGN-UHFFFAOYSA-N 0 3 410.514 4.113 20 0 HIADHN O=C(N[C@H]1CCCN(Cc2ccccc2)C1)N1CCO[C@@H](c2ccccc2Cl)C1 ZINC000507317408 916077759 /nfs/dbraw/zinc/07/77/59/916077759.db2.gz JVDRSSYPXXNYSX-SIKLNZKXSA-N 0 3 413.949 4.088 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N2CCO[C@H](c3ccccc3Cl)C2)C1 ZINC000507343420 916098850 /nfs/dbraw/zinc/09/88/50/916098850.db2.gz XBLHBWFCFIPJAA-JUXOCIIHSA-N 0 3 413.949 4.258 20 0 HIADHN CCc1cccnc1[C@H](C)NCc1cc(C(F)(F)F)ccc1N1CCN(C)CC1 ZINC000507458086 916226187 /nfs/dbraw/zinc/22/61/87/916226187.db2.gz CLUBSMRVTDJVLB-INIZCTEOSA-N 0 3 406.496 4.265 20 0 HIADHN COCCSc1ccc([C@H](C)N[C@H](C)C(=O)NCc2ccccc2Cl)cc1 ZINC000507464278 916230577 /nfs/dbraw/zinc/23/05/77/916230577.db2.gz MQRPSUFFEBTNCT-JKSUJKDBSA-N 0 3 406.979 4.434 20 0 HIADHN CN(Cc1ccccc1-c1ccnn1C)[C@@H]1c2cc(Cl)cc(Cl)c2C[C@@H]1O ZINC000507531033 916289634 /nfs/dbraw/zinc/28/96/34/916289634.db2.gz LUGKTILNEQQSQO-LEWJYISDSA-N 0 3 402.325 4.484 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3cc4ccccc4[nH]3)c(OCC)c2)CC1 ZINC000507609362 916366569 /nfs/dbraw/zinc/36/65/69/916366569.db2.gz YWBVLXVASFPLRX-UHFFFAOYSA-N 0 3 406.530 4.351 20 0 HIADHN CCCN(CC(=O)Nc1cccc(C)c1C)C1CCN(C(=O)c2ccccc2)CC1 ZINC000507609157 916366930 /nfs/dbraw/zinc/36/69/30/916366930.db2.gz OITRPUOCUDSBSX-UHFFFAOYSA-N 0 3 407.558 4.259 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)c2cc3cc(Br)ccc3[nH]2)C1 ZINC000507614818 916371864 /nfs/dbraw/zinc/37/18/64/916371864.db2.gz WSLQOOCLEOKAAL-KBXCAEBGSA-N 0 3 412.331 4.496 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)c2nn(-c3ccccc3F)c3c2CCC3)C1 ZINC000507619339 916377166 /nfs/dbraw/zinc/37/71/66/916377166.db2.gz GLEVHMWRXLTTFX-PKOBYXMFSA-N 0 3 418.516 4.065 20 0 HIADHN CC(C)(C)[C@H](CN1CCc2ccccc2C1)NC(=O)C1CCC(OC(F)F)CC1 ZINC000507688301 916458220 /nfs/dbraw/zinc/45/82/20/916458220.db2.gz NGDXWYVIXBQBEE-UUKMXZOPSA-N 0 3 408.533 4.374 20 0 HIADHN CC[C@@H](C)N(CC(=O)N1CCC[C@@H]1c1ccc2c(c1)OCCO2)Cc1ccccc1 ZINC000507724325 916518114 /nfs/dbraw/zinc/51/81/14/916518114.db2.gz IFSDIVCLAPEZCI-DENIHFKCSA-N 0 3 408.542 4.422 20 0 HIADHN CC[C@@H]1CN(c2nnc(-c3cccc4cccnc43)n2C)CCN1Cc1ccccc1 ZINC000507777409 916563462 /nfs/dbraw/zinc/56/34/62/916563462.db2.gz HMDVTOIFWZJMOX-OAQYLSRUSA-N 0 3 412.541 4.131 20 0 HIADHN Cc1sc(Br)c(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)c1C ZINC000507901414 916764229 /nfs/dbraw/zinc/76/42/29/916764229.db2.gz FUJFVCOGBREHOJ-BLLLJJGKSA-N 0 3 407.377 4.378 20 0 HIADHN Cc1nccn1CCCN(C)CC(=O)N(Cc1ccc(F)cc1)C1CCCCC1 ZINC000507921475 916800643 /nfs/dbraw/zinc/80/06/43/916800643.db2.gz ISZQSWPTYSFQGF-UHFFFAOYSA-N 0 3 400.542 4.014 20 0 HIADHN FC(F)Cn1cc(CN2CCC[C@@H](c3nc(-c4ccc(Cl)cc4)no3)C2)cn1 ZINC000508161896 916983753 /nfs/dbraw/zinc/98/37/53/916983753.db2.gz LRYIXISFXVPYHD-OAHLLOKOSA-N 0 3 407.852 4.231 20 0 HIADHN COc1ccc(NC(=O)C[C@H](C)NCc2cc(Cl)c3c(c2)OCCCO3)cc1 ZINC000508323846 917128413 /nfs/dbraw/zinc/12/84/13/917128413.db2.gz BPZISOYIZXLUBF-AWEZNQCLSA-N 0 3 404.894 4.017 20 0 HIADHN Cc1cc(NC(=O)c2cccc(F)c2)sc1C(=O)N[C@H](C)CN1CCC[C@H](C)C1 ZINC000508336983 917141091 /nfs/dbraw/zinc/14/10/91/917141091.db2.gz BNOREOJFFYDTPZ-GOEBONIOSA-N 0 3 417.550 4.298 20 0 HIADHN CCCN(C(=O)c1cc(C)nc2onc(C)c21)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000508459300 917243192 /nfs/dbraw/zinc/24/31/92/917243192.db2.gz UPWSVSQPNFOJGZ-HXUWFJFHSA-N 0 3 406.530 4.356 20 0 HIADHN Cc1nc2ccccc2n1CCC(=O)Nc1cc(C)cc(N2CCN(C(C)C)CC2)c1 ZINC000508468701 917252870 /nfs/dbraw/zinc/25/28/70/917252870.db2.gz NCHATVKMDIQAIU-UHFFFAOYSA-N 0 3 419.573 4.212 20 0 HIADHN CC(C)n1c2ccccc2nc1[C@H]1CCCN(Cc2ccc3c(c2)NC(=O)CO3)C1 ZINC000508558655 917333855 /nfs/dbraw/zinc/33/38/55/917333855.db2.gz BPZPPGCXMSWMKQ-SFHVURJKSA-N 0 3 404.514 4.328 20 0 HIADHN COCCSc1ccc([C@H](C)NC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000508562754 917338654 /nfs/dbraw/zinc/33/86/54/917338654.db2.gz WYWOFCJUVFUNIS-GHTZIAJQSA-N 0 3 413.587 4.060 20 0 HIADHN CC(C)Oc1ncccc1-c1noc(-c2ccc(N3CCN(C(C)C)CC3)cc2)n1 ZINC000508586004 917357797 /nfs/dbraw/zinc/35/77/97/917357797.db2.gz GCBUHZCKLMBFLU-UHFFFAOYSA-N 0 3 407.518 4.116 20 0 HIADHN CN(C(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1)C1Cc2ccccc2C1 ZINC000508604990 917375519 /nfs/dbraw/zinc/37/55/19/917375519.db2.gz QHMBPLYVAWRIPM-JOCHJYFZSA-N 0 3 402.460 4.067 20 0 HIADHN CCC(CC)(C(=O)NC[C@@H](C)CN1CCN(C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000508621211 917388258 /nfs/dbraw/zinc/38/82/58/917388258.db2.gz SDRGWZZQTSRKKM-MRXNPFEDSA-N 0 3 414.421 4.051 20 0 HIADHN Fc1cc(Br)cc2c1CC[C@H]2NCc1ccccc1Cn1cncn1 ZINC000508723524 917486624 /nfs/dbraw/zinc/48/66/24/917486624.db2.gz JPLVCAYQZQXTQX-LJQANCHMSA-N 0 3 401.283 4.005 20 0 HIADHN Fc1ccc(COc2cccc(CNCc3ccccc3Cn3cncn3)c2)cc1 ZINC000508734239 917494628 /nfs/dbraw/zinc/49/46/28/917494628.db2.gz QABFRUITLXRZBJ-UHFFFAOYSA-N 0 3 402.473 4.334 20 0 HIADHN CCC[C@@H]1CN(c2nnc(COCc3ccccc3)n2C)CCN1Cc1ccccc1 ZINC000508747979 917506780 /nfs/dbraw/zinc/50/67/80/917506780.db2.gz MBVUUDVSEIYPDG-HSZRJFAPSA-N 0 3 419.573 4.023 20 0 HIADHN C[C@@H](NC(=O)N(CCN(C)Cc1ccccc1)Cc1ccccc1)[C@H]1CCCOC1 ZINC000508756199 917511697 /nfs/dbraw/zinc/51/16/97/917511697.db2.gz SSKWUMCPTIJBSE-QPPBQGQZSA-N 0 3 409.574 4.145 20 0 HIADHN CCOc1ccc(NC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)cc1OC ZINC000508771297 917526203 /nfs/dbraw/zinc/52/62/03/917526203.db2.gz XEOCKXMQPNPPKZ-OAQYLSRUSA-N 0 3 422.447 4.487 20 0 HIADHN Cc1ccc(CNC(=O)C2CCN(Cc3ccc(OC[C@@H]4CCCO4)cc3)CC2)cc1 ZINC000508853833 917608521 /nfs/dbraw/zinc/60/85/21/917608521.db2.gz GCOSZLOBRBBPFM-VWLOTQADSA-N 0 3 422.569 4.081 20 0 HIADHN C[C@H](NC(=O)Nc1ccc(Cl)c(C(=O)NC2CC2)c1)[C@H](c1ccccc1)N(C)C ZINC000508878174 917630768 /nfs/dbraw/zinc/63/07/68/917630768.db2.gz GRRXMTZXTFBZML-VBKZILBWSA-N 0 3 414.937 4.045 20 0 HIADHN C[C@@H](NC(=O)N(CCO)Cc1ccc(Cl)c(Cl)c1)[C@@H](c1ccccc1)N(C)C ZINC000508893937 917649560 /nfs/dbraw/zinc/64/95/60/917649560.db2.gz JPYAXTCPYMWASE-QRWLVFNGSA-N 0 3 424.372 4.189 20 0 HIADHN C[C@@H](NC(=O)Nc1ccccc1N1C[C@@H](C)O[C@@H](C)C1)[C@@H](c1ccccc1)N(C)C ZINC000508895264 917651477 /nfs/dbraw/zinc/65/14/77/917651477.db2.gz LFKYKZVBHFWNHZ-KCESLBEFSA-N 0 3 410.562 4.113 20 0 HIADHN C[C@H](NC(=O)N[C@@H](CO)c1c(Cl)cccc1Cl)[C@H](c1ccccc1)N(C)C ZINC000508898875 917654672 /nfs/dbraw/zinc/65/46/72/917654672.db2.gz RXBPXHBKHJGOTQ-SOVGHPHASA-N 0 3 410.345 4.017 20 0 HIADHN C[C@@H](NC(=O)Nc1ccccc1I)[C@@H](c1ccccc1)N(C)C ZINC000508898205 917654796 /nfs/dbraw/zinc/65/47/96/917654796.db2.gz KZOIUAJOAFIKGM-DYVFJYSZSA-N 0 3 423.298 4.104 20 0 HIADHN COC[C@H](c1ccc(Cl)cc1)N(C)C(=O)N[C@H](C)[C@H](c1ccccc1)N(C)C ZINC000508899775 917654896 /nfs/dbraw/zinc/65/48/96/917654896.db2.gz QMDLKCKCYXTGRN-MAODMQOUSA-N 0 3 403.954 4.360 20 0 HIADHN C[C@H](NC(=O)N1CCC(c2nc3ccccc3[nH]2)CC1)[C@@H](c1ccccc1)N(C)C ZINC000508902442 917658419 /nfs/dbraw/zinc/65/84/19/917658419.db2.gz WKFDZGHZBNZIPJ-JTSKRJEESA-N 0 3 405.546 4.143 20 0 HIADHN COc1ccc(NC(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)cc1N1CCCCC1=O ZINC000508925658 917684321 /nfs/dbraw/zinc/68/43/21/917684321.db2.gz SWBCOUVRDUOBEO-HXOBKFHXSA-N 0 3 424.545 4.025 20 0 HIADHN O=C(Nc1cccc(-n2ccnc2)c1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000508945799 917703423 /nfs/dbraw/zinc/70/34/23/917703423.db2.gz FCKPEXLHKGXSMT-OAQYLSRUSA-N 0 3 414.431 4.265 20 0 HIADHN COc1cccc([C@H](C)NC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)c1 ZINC000509003361 917758298 /nfs/dbraw/zinc/75/82/98/917758298.db2.gz WWQJGGZYCUCEEG-KKSFZXQISA-N 0 3 406.448 4.327 20 0 HIADHN Cc1ccc(S(=O)(=O)N[C@@H](CCN(C)[C@H](C)c2ccccn2)c2ccccc2)cc1 ZINC000509020182 917775545 /nfs/dbraw/zinc/77/55/45/917775545.db2.gz CJJYWDLUMVMBCE-YKSBVNFPSA-N 0 3 423.582 4.493 20 0 HIADHN CCCN(C)[C@H](CNC(=O)N(Cc1cccnc1)C1CC1)c1ccc(Cl)cc1 ZINC000509027389 917782026 /nfs/dbraw/zinc/78/20/26/917782026.db2.gz AHOZJOCIHDTVSN-OAQYLSRUSA-N 0 3 400.954 4.492 20 0 HIADHN COc1c(C)cnc(CN2CCC(N(C)Cc3csc(C4CC4)n3)CC2)c1C ZINC000509082864 917826888 /nfs/dbraw/zinc/82/68/88/917826888.db2.gz XHGGJVDFJKIEPD-UHFFFAOYSA-N 0 3 400.592 4.137 20 0 HIADHN O=C(N[C@@H](c1nccs1)c1ccccc1)N[C@H](CN1CCCC1)c1ccccc1 ZINC000509346980 918013635 /nfs/dbraw/zinc/01/36/35/918013635.db2.gz ZWXJJSNXXLIOGQ-NHCUHLMSSA-N 0 3 406.555 4.369 20 0 HIADHN CSc1cccc(F)c1CNC(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000509352763 918017385 /nfs/dbraw/zinc/01/73/85/918017385.db2.gz BXSIEJOICIEIBR-UHFFFAOYSA-N 0 3 401.551 4.354 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)N[C@@H](c1nccs1)c1ccccc1 ZINC000509364995 918030315 /nfs/dbraw/zinc/03/03/15/918030315.db2.gz ILWLKNAFZFCZJN-LEWJYISDSA-N 0 3 406.555 4.369 20 0 HIADHN CCOc1ccccc1CN(C)C(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000509404559 918068648 /nfs/dbraw/zinc/06/86/48/918068648.db2.gz OCGOVAXSJSVKOT-QFIPXVFZSA-N 0 3 420.475 4.498 20 0 HIADHN COCCCOc1cccc(CN2CCC[C@H](C(=O)Nc3ccc(Cl)cn3)C2)c1 ZINC000509404759 918069086 /nfs/dbraw/zinc/06/90/86/918069086.db2.gz SGWUSJYEDJEYHH-SFHVURJKSA-N 0 3 417.937 4.001 20 0 HIADHN CS(=O)(=O)C1(CNCc2ccc(-c3ccccc3Br)cc2)CCC1 ZINC000509441846 918096786 /nfs/dbraw/zinc/09/67/86/918096786.db2.gz ZVAWMTVKKJWJPD-UHFFFAOYSA-N 0 3 408.361 4.173 20 0 HIADHN COc1cc(CNCc2ccc(-c3cnn(C)c3)s2)cc(Br)c1OC ZINC000509458600 918109401 /nfs/dbraw/zinc/10/94/01/918109401.db2.gz ATNJECILYSUBQX-UHFFFAOYSA-N 0 3 422.348 4.218 20 0 HIADHN O=C(Nc1cc(Cl)ccc1O)C1CCN(Cc2c[nH]nc2-c2cccs2)CC1 ZINC000509530517 918177391 /nfs/dbraw/zinc/17/73/91/918177391.db2.gz ZLXLOSYYTPTERD-UHFFFAOYSA-N 0 3 416.934 4.348 20 0 HIADHN COc1ccccc1NC(=O)C1CCN(Cc2ccc(OC(F)F)c(OC)c2)CC1 ZINC000509549001 918199568 /nfs/dbraw/zinc/19/95/68/918199568.db2.gz LLMTYIBHDYMEMV-UHFFFAOYSA-N 0 3 420.456 4.156 20 0 HIADHN Cc1nn(Cc2ccc(C)cc2)c(C)c1CN1CCC(C(=O)N2CCC[C@@H](C)C2)CC1 ZINC000509554508 918205165 /nfs/dbraw/zinc/20/51/65/918205165.db2.gz HDAPZFDRLPMWTR-HXUWFJFHSA-N 0 3 422.617 4.327 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N(C)Cc1ccc(Br)s1)c1ccco1 ZINC000509559249 918209107 /nfs/dbraw/zinc/20/91/07/918209107.db2.gz SZLQSFSNFLKLIH-JSGCOSHPSA-N 0 3 414.369 4.374 20 0 HIADHN COc1cc(CN2CCC(C(=O)N(C)C(C)C)CC2)ccc1OCc1ccccc1 ZINC000509559086 918209545 /nfs/dbraw/zinc/20/95/45/918209545.db2.gz QGAJLIFMSGXNHR-UHFFFAOYSA-N 0 3 410.558 4.353 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)N1CCC(Oc2ccc(F)cc2)CC1)c1ccco1 ZINC000509561748 918211073 /nfs/dbraw/zinc/21/10/73/918211073.db2.gz ZCBCEFFSQQIIOM-OXQOHEQNSA-N 0 3 403.498 4.101 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)N1CCC(C(F)(F)F)(C(F)(F)F)C1)c1ccco1 ZINC000509567831 918217331 /nfs/dbraw/zinc/21/73/31/918217331.db2.gz KUZKDLSVMSCNAR-VXGBXAGGSA-N 0 3 415.378 4.235 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N(C)Cc1ccc(Br)cc1)c1ccco1 ZINC000509576068 918224960 /nfs/dbraw/zinc/22/49/60/918224960.db2.gz CPTRVPIZJRITGD-WMLDXEAASA-N 0 3 408.340 4.313 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N1C[C@@H](C)O[C@H](c2ccc(F)cc2)C1)c1ccco1 ZINC000509594017 918242298 /nfs/dbraw/zinc/24/22/98/918242298.db2.gz YZCSRIOTRXZVOL-HXQKEGBBSA-N 0 3 403.498 4.020 20 0 HIADHN CCOc1ccc(C2=CCN(C(=O)c3ccc(N4CCN(CC)CC4)cc3)CC2)cc1 ZINC000509598039 918247565 /nfs/dbraw/zinc/24/75/65/918247565.db2.gz DRCOIMXBCIKNAT-UHFFFAOYSA-N 0 3 419.569 4.157 20 0 HIADHN CCOc1cc(CNCc2ccnc(N3CCCC3)c2)ccc1OCC(F)(F)F ZINC000509603545 918254330 /nfs/dbraw/zinc/25/43/30/918254330.db2.gz WCUIJZOXKWYTGP-UHFFFAOYSA-N 0 3 409.452 4.311 20 0 HIADHN C[C@@H](NC(=O)c1oc2ccccc2c1CN(C)C)c1ccc(NC(=O)C2CC2)cc1 ZINC000509675608 918307796 /nfs/dbraw/zinc/30/77/96/918307796.db2.gz NUURYKBJUCHLBZ-OAHLLOKOSA-N 0 3 405.498 4.334 20 0 HIADHN CC(C)(CNC(=O)N[C@@H](C[C@H]1CCOC1)c1ccccc1)N1CCc2ccccc2C1 ZINC000509760731 918374921 /nfs/dbraw/zinc/37/49/21/918374921.db2.gz HITOAQIBEYWOQJ-YKSBVNFPSA-N 0 3 421.585 4.290 20 0 HIADHN CCCN(CCc1ccccn1)C(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000509797889 918402422 /nfs/dbraw/zinc/40/24/22/918402422.db2.gz DVLLREHTXRWPJE-OAQYLSRUSA-N 0 3 401.501 4.020 20 0 HIADHN C[C@@H]([N-]S(=O)(=O)c1cc(Cl)ccc1C(F)(F)F)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000509972088 918561924 /nfs/dbraw/zinc/56/19/24/918561924.db2.gz VUMOGJDPKWDZDC-OLZOCXBDSA-N 0 3 424.916 4.290 20 0 HIADHN C[C@@H]([N-]S(=O)(=O)c1cc(Cl)ccc1C(F)(F)F)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000509972088 918561940 /nfs/dbraw/zinc/56/19/40/918561940.db2.gz VUMOGJDPKWDZDC-OLZOCXBDSA-N 0 3 424.916 4.290 20 0 HIADHN Cc1ccc(-c2ncc(CN[C@H]3CCCN(C(=O)Cc4ccccc4)C3)s2)cc1 ZINC000509977435 918566417 /nfs/dbraw/zinc/56/64/17/918566417.db2.gz NYNYESRNLLVMLH-NRFANRHFSA-N 0 3 405.567 4.442 20 0 HIADHN CC[C@H](NCC(=O)N1CCC(Cc2ccccc2)CC1)c1ccc(OC)c(OC)c1 ZINC000510244000 918780056 /nfs/dbraw/zinc/78/00/56/918780056.db2.gz QOKVIDWCLVSANZ-QFIPXVFZSA-N 0 3 410.558 4.226 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3CCC(C)=C(c4ccco4)C3)c(C)c2)CC1 ZINC000510303361 918818555 /nfs/dbraw/zinc/81/85/55/918818555.db2.gz HQRDQOZCMUYKRR-UHFFFAOYSA-N 0 3 408.546 4.441 20 0 HIADHN CCc1cccc2c1OCC[C@H]2NC(=O)NC[C@H](c1ccc(OC)cc1)N1CCCC1 ZINC000510355297 918848828 /nfs/dbraw/zinc/84/88/28/918848828.db2.gz AWAMZGYSRCGISR-DHIUTWEWSA-N 0 3 423.557 4.218 20 0 HIADHN CCc1cccc2c1OCC[C@H]2NC(=O)NC[C@@H](c1ccc(OC)cc1)N1CCCC1 ZINC000510355300 918849907 /nfs/dbraw/zinc/84/99/07/918849907.db2.gz AWAMZGYSRCGISR-PKTZIBPZSA-N 0 3 423.557 4.218 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)N1CCN(Cc2cccc(Cl)c2)CC1 ZINC000510362541 918854526 /nfs/dbraw/zinc/85/45/26/918854526.db2.gz NEHUGPJDCYQTBB-UHFFFAOYSA-N 0 3 411.933 4.106 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N(Cc3ccc([C@@H]4C[C@H]4C)o3)C3CC3)cc2)CC1 ZINC000510383152 918864623 /nfs/dbraw/zinc/86/46/23/918864623.db2.gz CCTHWLWNRFEVBL-WZONZLPQSA-N 0 3 407.558 4.350 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N3CCC[C@H]3c3nc4ccccc4s3)cc2)CC1 ZINC000510382671 918864791 /nfs/dbraw/zinc/86/47/91/918864791.db2.gz RAVPWTIRDJQKQW-NRFANRHFSA-N 0 3 420.582 4.416 20 0 HIADHN CCCN(CCC)C(=O)c1ccc(NC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000510427147 918890597 /nfs/dbraw/zinc/89/05/97/918890597.db2.gz IPJSACMMJDACMX-HSZRJFAPSA-N 0 3 422.573 4.345 20 0 HIADHN CCCCN(C)C(=O)C1CCN(Cc2c(C)nn(-c3ccc(F)cc3)c2C)CC1 ZINC000510434727 918895205 /nfs/dbraw/zinc/89/52/05/918895205.db2.gz GCLIBBUNHRWGFS-UHFFFAOYSA-N 0 3 400.542 4.099 20 0 HIADHN CC(C)(C)NC(=O)c1cccc(NC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000510459735 918916655 /nfs/dbraw/zinc/91/66/55/918916655.db2.gz JPIYFPQHDJJBSQ-OAQYLSRUSA-N 0 3 408.546 4.001 20 0 HIADHN CC[C@H](CNC(=O)Nc1cccc(C(=O)NC(C)(C)C)c1)N1CCc2ccccc2C1 ZINC000510494728 918942370 /nfs/dbraw/zinc/94/23/70/918942370.db2.gz ATFVVORTXLEZPJ-JOCHJYFZSA-N 0 3 422.573 4.173 20 0 HIADHN CCN1CCN([C@H]2CCN([C@@H](C)c3ncc(-c4ccc(Cl)cc4Cl)o3)C2)CC1 ZINC000510496910 918945403 /nfs/dbraw/zinc/94/54/03/918945403.db2.gz RVYHRSLAQGEWDZ-RDJZCZTQSA-N 0 3 423.388 4.421 20 0 HIADHN CCOc1ccc([C@H](NC(=O)N[C@@H](C)C2=CCN(C)CC2)C(C)C)cc1OCC ZINC000510499592 918947323 /nfs/dbraw/zinc/94/73/23/918947323.db2.gz HCJYKOLYNMPJDQ-HTAPYJJXSA-N 0 3 403.567 4.131 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)NCCc2ccc(Br)s2)C1 ZINC000510530937 918975406 /nfs/dbraw/zinc/97/54/06/918975406.db2.gz JXQQVTVKRFRKTI-GOEBONIOSA-N 0 3 422.392 4.188 20 0 HIADHN C[C@@H]1CN(C2CCN(Cc3cc(Br)cc(C(F)(F)F)c3)CC2)CCO1 ZINC000510533520 918978349 /nfs/dbraw/zinc/97/83/49/918978349.db2.gz LCVGZIUSEPSYDW-CYBMUJFWSA-N 0 3 421.301 4.153 20 0 HIADHN Cc1ccc(-n2cc(CN3CCC(N4CCO[C@@H](C)C4)CC3)c(C(C)(C)C)n2)cc1 ZINC000510534120 918978964 /nfs/dbraw/zinc/97/89/64/918978964.db2.gz OJGVRIFYOGCKCW-FQEVSTJZSA-N 0 3 410.606 4.163 20 0 HIADHN Cc1cccc(NC(=O)Nc2cccc(CNC(=O)N[C@H](C)C3=CCN(C)CC3)c2)c1 ZINC000510541636 918986769 /nfs/dbraw/zinc/98/67/69/918986769.db2.gz SNCLLRPFNLNZAV-GOSISDBHSA-N 0 3 421.545 4.089 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)Nc1ccc(OC[C@H]2CCCO2)cc1 ZINC000510566980 919009140 /nfs/dbraw/zinc/00/91/40/919009140.db2.gz XOERDDZPUOJJJP-PKTZIBPZSA-N 0 3 409.530 4.203 20 0 HIADHN COc1c(C)ccc(NC(=O)NCCCCN2CCN(c3ccccc3)CC2)c1C ZINC000510584988 919028216 /nfs/dbraw/zinc/02/82/16/919028216.db2.gz QSMIDRXQJBWOHI-UHFFFAOYSA-N 0 3 410.562 4.036 20 0 HIADHN Cc1cc(Br)cc(C)c1N1CCC[C@@H](N2CC[C@]3(C2)CCCOC3)C1=O ZINC000510615528 919056521 /nfs/dbraw/zinc/05/65/21/919056521.db2.gz CHRCAXORIOVFDW-NQIIRXRSSA-N 0 3 421.379 4.064 20 0 HIADHN CC(C)[C@H](NCC(=O)Nc1ccccc1C(F)(F)F)c1ccc2c(c1)OCCO2 ZINC000510660720 919101146 /nfs/dbraw/zinc/10/11/46/919101146.db2.gz HLCIJKINNSPIGH-FQEVSTJZSA-N 0 3 408.420 4.402 20 0 HIADHN Cc1cc(OCCC[C@@H](C)[NH2+][C@H](c2nc(-c3nc[n-]n3)no2)C(C)C)ccc1Cl ZINC000510677226 919117915 /nfs/dbraw/zinc/11/79/15/919117915.db2.gz AGADUUDQEMDOMI-PBHICJAKSA-N 0 3 418.929 4.351 20 0 HIADHN Cc1cc(N2CCCC2)ccc1NC(=O)CN[C@H](c1ccc2c(c1)OCCO2)C(C)C ZINC000510687710 919125590 /nfs/dbraw/zinc/12/55/90/919125590.db2.gz ZOLYYWGNVMRSFF-VWLOTQADSA-N 0 3 423.557 4.292 20 0 HIADHN C[C@@H](NC(=O)[C@@H](C)SCc1ncc(-c2ccc(Cl)cc2)o1)C1=CCN(C)CC1 ZINC000510774159 919233337 /nfs/dbraw/zinc/23/33/37/919233337.db2.gz ZYNWCXNVGKLJEG-HUUCEWRRSA-N 0 3 419.978 4.383 20 0 HIADHN Cn1nnc2cc(CN3CCC[C@@H](Cc4nc(C5CCCCCC5)no4)C3)ccc21 ZINC000510795240 919265719 /nfs/dbraw/zinc/26/57/19/919265719.db2.gz DMVDDVNTKNZLGH-KRWDZBQOSA-N 0 3 408.550 4.244 20 0 HIADHN C[C@@H](NC(=O)c1nn(-c2ccc(Cl)cc2Cl)c2c1CCC2)C1=CCN(C)CC1 ZINC000510799303 919269945 /nfs/dbraw/zinc/26/99/45/919269945.db2.gz NQEPTZFBHDOGDF-CYBMUJFWSA-N 0 3 419.356 4.048 20 0 HIADHN Clc1ccc(-c2nc3sccn3c2CN2CCC(Cn3ccnn3)CC2)cc1 ZINC000510812859 919286916 /nfs/dbraw/zinc/28/69/16/919286916.db2.gz HBUKZNJSVGEQKX-UHFFFAOYSA-N 0 3 412.950 4.220 20 0 HIADHN COc1ccc(C[C@@H](NCC(=O)NCc2ccccc2F)c2ccc(OC)cc2)cc1 ZINC000510817393 919293929 /nfs/dbraw/zinc/29/39/29/919293929.db2.gz XFUHYFHSMFHTEL-XMMPIXPASA-N 0 3 422.500 4.033 20 0 HIADHN COCCOc1cc(C)ccc1NC(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000510819455 919297136 /nfs/dbraw/zinc/29/71/36/919297136.db2.gz CSEFNHAKFHKNGQ-GOSISDBHSA-N 0 3 403.548 4.040 20 0 HIADHN Cc1c(C(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)cnn1C1CCCCC1 ZINC000510854483 919344310 /nfs/dbraw/zinc/34/43/10/919344310.db2.gz YUQHXMRRQDVMQI-RTBURBONSA-N 0 3 416.610 4.048 20 0 HIADHN O=C(N[C@H](c1ccccc1)c1ccncc1)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000510857644 919347945 /nfs/dbraw/zinc/34/79/45/919347945.db2.gz PZUBUDFMJPOZQN-XZOQPEGZSA-N 0 3 421.491 4.445 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N[C@@H]1CCc2cc(F)c(OC)cc21)c1ccsc1 ZINC000510860582 919351724 /nfs/dbraw/zinc/35/17/24/919351724.db2.gz LPXUPLWWQNXFOQ-MOPGFXCFSA-N 0 3 405.539 4.265 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@H]1CCc2cc(F)c(OC)cc21)c1ccsc1 ZINC000510860586 919351985 /nfs/dbraw/zinc/35/19/85/919351985.db2.gz LPXUPLWWQNXFOQ-RBUKOAKNSA-N 0 3 405.539 4.265 20 0 HIADHN COc1ccc([C@H](CNC(=O)Nc2ccc(-c3csnn3)cc2)N2CCCC2)cc1 ZINC000510872986 919366262 /nfs/dbraw/zinc/36/62/62/919366262.db2.gz CCTSMAHBTCJSFU-NRFANRHFSA-N 0 3 423.542 4.172 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)N1CCC(c2nc3ccccc3[nH]2)CC1 ZINC000510908653 919412266 /nfs/dbraw/zinc/41/22/66/919412266.db2.gz NFGKRZDTUPGDBN-UHFFFAOYSA-N 0 3 402.498 4.391 20 0 HIADHN CC(C)N(CC(=O)Nc1ccccc1C(F)(F)F)C(=O)[C@@H](C)N1CCCCCC1 ZINC000510926019 919443316 /nfs/dbraw/zinc/44/33/16/919443316.db2.gz WMHYHWXLQBOPJQ-MRXNPFEDSA-N 0 3 413.484 4.145 20 0 HIADHN Cc1c([C@H](C)N[C@@H]2CCN(C(=O)Nc3ccccc3)C2)cnn1-c1ccc(F)cc1 ZINC000510946218 919475155 /nfs/dbraw/zinc/47/51/55/919475155.db2.gz VFYYGXGWIFFGAY-OXJNMPFZSA-N 0 3 407.493 4.277 20 0 HIADHN O=C(Nc1ccccc1)N1CC[C@@H](N[C@@H]2CCCc3nn(-c4ccccc4)cc32)C1 ZINC000510987532 919541020 /nfs/dbraw/zinc/54/10/20/919541020.db2.gz SGMVHJJAZCXDGE-DENIHFKCSA-N 0 3 401.514 4.146 20 0 HIADHN C[C@@H](N[C@@H]1CCCc2nn(C)cc21)c1cccc(OCc2cn3ccccc3n2)c1 ZINC000511009426 919571145 /nfs/dbraw/zinc/57/11/45/919571145.db2.gz FPSGYQJWHWCXSD-VGOFRKELSA-N 0 3 401.514 4.375 20 0 HIADHN COc1ccc2oc([C@@H](C)N[C@@H]3CCN(C(=O)COc4ccccc4)C3)c(C)c2c1 ZINC000511009391 919571507 /nfs/dbraw/zinc/57/15/07/919571507.db2.gz FNEDUBBCXSBYLT-QZTJIDSGSA-N 0 3 408.498 4.080 20 0 HIADHN CC[C@@H](C)n1ncc2c1nc(C)cc2C(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000511087065 919688356 /nfs/dbraw/zinc/68/83/56/919688356.db2.gz XGEBQWYKBHAVLN-APWZRJJASA-N 0 3 411.575 4.339 20 0 HIADHN CCc1ccc([C@H](CNC(=O)c2cc(C)nc3c2cnn3[C@H](C)CC)N(C)C)cc1 ZINC000511091473 919695376 /nfs/dbraw/zinc/69/53/76/919695376.db2.gz PWWFVAGWSBPKKW-VGSWGCGISA-N 0 3 407.562 4.306 20 0 HIADHN CC1(c2nc3ccccc3s2)CCN(CCC(=O)NCC(=O)c2ccccc2)CC1 ZINC000511120112 919731392 /nfs/dbraw/zinc/73/13/92/919731392.db2.gz HFVITOZUKFBQAR-UHFFFAOYSA-N 0 3 421.566 4.039 20 0 HIADHN CN(C(=O)Nc1cc(F)c(Br)cc1F)[C@H]1CCN(Cc2ccccc2)C1 ZINC000511133221 919749760 /nfs/dbraw/zinc/74/97/60/919749760.db2.gz XFFSLDOTQLDBMU-AWEZNQCLSA-N 0 3 424.289 4.466 20 0 HIADHN Cc1csc2nc(CN(Cc3ccccc3C(F)(F)F)CC3CC3)cc(=O)n12 ZINC000511134619 919750438 /nfs/dbraw/zinc/75/04/38/919750438.db2.gz BNYGOAKCYVCUPG-UHFFFAOYSA-N 0 3 407.461 4.495 20 0 HIADHN Cc1cc(OC[C@H](O)CN2CCC[C@H](c3ccnn3C)C2)c(C(C)C)cc1Cl ZINC000511137884 919754257 /nfs/dbraw/zinc/75/42/57/919754257.db2.gz QQEVVOCWGHTMSH-ZWKOTPCHSA-N 0 3 405.970 4.125 20 0 HIADHN O=C(CCN1CCC(Sc2ccc(Cl)cc2)CC1)NCC(=O)c1ccccc1 ZINC000511150223 919771142 /nfs/dbraw/zinc/77/11/42/919771142.db2.gz MJOYUPXRSDJIAE-UHFFFAOYSA-N 0 3 416.974 4.286 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)Nc1ccc(NC(=O)c2ccco2)cc1 ZINC000511174751 919796068 /nfs/dbraw/zinc/79/60/68/919796068.db2.gz WMVQNDBMDOJODY-UHFFFAOYSA-N 0 3 424.476 4.267 20 0 HIADHN CC(C)(C)c1ccc2c(c1)CN(CCC(=O)Nc1ccc(C(N)=O)c(Cl)c1)CC2 ZINC000511184189 919805198 /nfs/dbraw/zinc/80/51/98/919805198.db2.gz NPSVFPYVPVHBQK-UHFFFAOYSA-N 0 3 413.949 4.123 20 0 HIADHN CC(C)Sc1ccc(CN2CCC(OCCN3C[C@@H](C)O[C@@H](C)C3)CC2)cc1 ZINC000511206048 919818373 /nfs/dbraw/zinc/81/83/73/919818373.db2.gz YCDGRAMHZNZNHO-BGYRXZFFSA-N 0 3 406.636 4.277 20 0 HIADHN CC[C@@H](C)n1ncc2c1nc(C)cc2C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000511207405 919819388 /nfs/dbraw/zinc/81/93/88/919819388.db2.gz NZOJXKWDZUFYIY-UYAOXDASSA-N 0 3 405.546 4.105 20 0 HIADHN COc1ccc(-c2nc(C)c([C@H](C)NC(=O)N[C@@H](C)C3=CCN(C)CC3)s2)cc1 ZINC000511275462 919871527 /nfs/dbraw/zinc/87/15/27/919871527.db2.gz VXYQSACNSNJZNC-HOCLYGCPSA-N 0 3 414.575 4.138 20 0 HIADHN COc1ccc(-c2nc(C)c([C@@H](C)NC(=O)N[C@H](C)C3=CCN(C)CC3)s2)cc1 ZINC000511275460 919871698 /nfs/dbraw/zinc/87/16/98/919871698.db2.gz VXYQSACNSNJZNC-GDBMZVCRSA-N 0 3 414.575 4.138 20 0 HIADHN CCN(C(=O)Cc1ccc(NC(=O)N[C@@H](C)C2=CCN(C)CC2)cc1)c1ccccc1 ZINC000511276299 919873447 /nfs/dbraw/zinc/87/34/47/919873447.db2.gz YPSFANFDWIIUDV-IBGZPJMESA-N 0 3 420.557 4.054 20 0 HIADHN CCOc1c(Br)cc(Cl)cc1NC(=O)N[C@H](C)C1=CCN(C)CC1 ZINC000511285720 919882128 /nfs/dbraw/zinc/88/21/28/919882128.db2.gz KEGYFJAFGAGGKJ-LLVKDONJSA-N 0 3 416.747 4.273 20 0 HIADHN Cc1ccc(-c2nnc3n2CCCCC3)cc1NC(=O)c1ccc(CN(C)C)cc1 ZINC000511373339 919971196 /nfs/dbraw/zinc/97/11/96/919971196.db2.gz OMEKWQKJLPGRDJ-UHFFFAOYSA-N 0 3 403.530 4.294 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N[C@@H](C[C@H]2CCOC2)c2ccccc2)N(C)C)cc1 ZINC000511382556 919986285 /nfs/dbraw/zinc/98/62/85/919986285.db2.gz LASQGGBWEFGUOB-QDSKXPNFSA-N 0 3 409.574 4.319 20 0 HIADHN CN(C)CCN(CC1CCCCC1)C(=O)N[C@H](C[C@H]1CCOC1)c1ccccc1 ZINC000511390456 919997914 /nfs/dbraw/zinc/99/79/14/919997914.db2.gz IQGBWCHEUPOTMR-FYYLOGMGSA-N 0 3 401.595 4.308 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)N[C@H](C[C@H]1CCOC1)c1ccccc1 ZINC000511392411 920000911 /nfs/dbraw/zinc/00/09/11/920000911.db2.gz UQPRMGGEGKWSDG-GZGNHOFSSA-N 0 3 421.585 4.460 20 0 HIADHN CN(C(=O)N[C@H](C[C@@H]1CCOC1)c1ccccc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000511398718 920012310 /nfs/dbraw/zinc/01/23/10/920012310.db2.gz NXRSXVCWFSSWCR-QPTUXGOLSA-N 0 3 407.558 4.070 20 0 HIADHN CCOc1ccc(NC(=O)NCCCCN2CCN(Cc3ccccc3)CC2)c(C)c1 ZINC000511465198 920076078 /nfs/dbraw/zinc/07/60/78/920076078.db2.gz PZFSWNBHDXSQMK-UHFFFAOYSA-N 0 3 424.589 4.113 20 0 HIADHN CC(=O)c1c(C)[nH]c(C(=O)Nc2ccc(CCN3CCSCC3)cc2)c1C(C)C ZINC000511496375 920105918 /nfs/dbraw/zinc/10/59/18/920105918.db2.gz HNBMQAQEYTZDDB-UHFFFAOYSA-N 0 3 413.587 4.493 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Cc2ccc(Br)s2)N2CCCC2)cc1 ZINC000511556854 920192707 /nfs/dbraw/zinc/19/27/07/920192707.db2.gz UUPXDYUPZUOVCP-QGZVFWFLSA-N 0 3 407.377 4.315 20 0 HIADHN O=C(CN[C@H](c1cccc(OC(F)(F)F)c1)C1CC1)N[C@@H]1CCOc2ccccc21 ZINC000511584077 920230371 /nfs/dbraw/zinc/23/03/71/920230371.db2.gz GSQKATPXDQVJEQ-NQIIRXRSSA-N 0 3 420.431 4.266 20 0 HIADHN C[C@H]1CCCN(Cc2csc(NC(=O)[C@@H]3CCCN(Cc4ccccc4)C3)n2)C1 ZINC000511646290 920312175 /nfs/dbraw/zinc/31/21/75/920312175.db2.gz JQXBBYZMXGUYDH-AZUAARDMSA-N 0 3 412.603 4.226 20 0 HIADHN O=C(CCN1CC[C@@H](C(F)(F)F)[C@H](CO)C1)Nc1ccc(Oc2ccccc2)cc1 ZINC000511662842 920328415 /nfs/dbraw/zinc/32/84/15/920328415.db2.gz BVIHNEMWRIUCNR-OXJNMPFZSA-N 0 3 422.447 4.300 20 0 HIADHN COc1ccccc1NC(=O)C1CCN(Cc2ccc(OCC(F)(F)F)cc2)CC1 ZINC000511689281 920352529 /nfs/dbraw/zinc/35/25/29/920352529.db2.gz YNRKTWSIIRIIPS-UHFFFAOYSA-N 0 3 422.447 4.487 20 0 HIADHN O=C(CSCc1cccnc1)N[C@@H]1CN(Cc2ccccc2)C[C@H]1c1ccccc1 ZINC000511739017 920410918 /nfs/dbraw/zinc/41/09/18/920410918.db2.gz BPGVLEZCCSHXCE-BJKOFHAPSA-N 0 3 417.578 4.099 20 0 HIADHN Fc1cc(-c2noc(CN3C[C@H](c4ccccc4)[C@@H]4COCC[C@@H]43)n2)cc(F)c1F ZINC000511761407 920442669 /nfs/dbraw/zinc/44/26/69/920442669.db2.gz IMVUUSWRWCDZIR-GJYPPUQNSA-N 0 3 415.415 4.158 20 0 HIADHN CC(C)(C)[C@H](NC(=O)CN1C[C@H](c2ccccc2)[C@@H]2COCC[C@@H]21)c1cccs1 ZINC000511765938 920450883 /nfs/dbraw/zinc/45/08/83/920450883.db2.gz YMMGCJZKVQVANQ-QTDGGUCWSA-N 0 3 412.599 4.456 20 0 HIADHN Nc1nc(CN2C[C@H](c3ccccc3)[C@H]3COCC[C@@H]32)nc2sc3c(c21)CCCC3 ZINC000511786289 920479554 /nfs/dbraw/zinc/47/95/54/920479554.db2.gz MHZCTWLTFCJAEF-QRVBRYPASA-N 0 3 420.582 4.157 20 0 HIADHN O=C(CN1C[C@H](c2ccccc2)[C@H]2CCC[C@@H]21)Nc1ccccc1N1CCCC1=O ZINC000511830017 920532336 /nfs/dbraw/zinc/53/23/36/920532336.db2.gz NRQIZNXPXTYPBI-SJBKTWHCSA-N 0 3 403.526 4.020 20 0 HIADHN O=C(CN1C[C@H](c2ccccc2)[C@H]2CCC[C@@H]21)Nc1cccc(N2CCCC2=O)c1 ZINC000511839764 920553061 /nfs/dbraw/zinc/55/30/61/920553061.db2.gz WMWLNNODEJLXTK-ZLNRFVROSA-N 0 3 403.526 4.020 20 0 HIADHN O=C(NC1CCN(Cc2cccc(OCc3ccccn3)c2)CC1)c1ccsc1 ZINC000511870048 920598148 /nfs/dbraw/zinc/59/81/48/920598148.db2.gz BQUPZGDUGQPJLA-UHFFFAOYSA-N 0 3 407.539 4.117 20 0 HIADHN Cc1nn(C)c(=O)c(-c2nc(CN3C[C@H](c4ccccc4)[C@@H]4CCC[C@H]43)cs2)c1C ZINC000511869721 920598556 /nfs/dbraw/zinc/59/85/56/920598556.db2.gz AGHWWDQLKYXUOQ-PWRODBHTSA-N 0 3 420.582 4.289 20 0 HIADHN CCn1ccnc1[C@H]1OCCC[C@@H]1NCc1cnn(-c2ccc(C(F)(F)F)cc2)c1 ZINC000511909835 920648343 /nfs/dbraw/zinc/64/83/43/920648343.db2.gz GOIDFBVROCUXHR-OALUTQOASA-N 0 3 419.451 4.117 20 0 HIADHN CSc1nnc(CCCNCc2cscc2Br)n1CC(C)C ZINC000511991394 920761462 /nfs/dbraw/zinc/76/14/62/920761462.db2.gz QZGUKGBUTDFQKB-UHFFFAOYSA-N 0 3 403.415 4.202 20 0 HIADHN Cc1cc([C@@H](C)NCc2ccccc2CS(C)(=O)=O)sc1Br ZINC000512010109 920781122 /nfs/dbraw/zinc/78/11/22/920781122.db2.gz RPBONHLPUMDGPQ-GFCCVEGCSA-N 0 3 402.379 4.214 20 0 HIADHN C[C@@H]1CC[C@@H](C)N1CC(=O)N1CCC[C@H](Cc2nc(C3CCCCCC3)no2)C1 ZINC000512022988 920797624 /nfs/dbraw/zinc/79/76/24/920797624.db2.gz DIUMJXHDLUXCOA-GUDVDZBRSA-N 0 3 402.583 4.161 20 0 HIADHN CCCOc1ccc(O[C@H]2CCCC[C@@H]2NCc2ncc(CN(C)C)s2)cc1 ZINC000512032275 920804498 /nfs/dbraw/zinc/80/44/98/920804498.db2.gz TYWUYWBTEJGBKZ-SFTDATJTSA-N 0 3 403.592 4.473 20 0 HIADHN CCN1CCCC[C@H]1C(=O)N1CCC[C@H](Cc2nc(C3CCCCCC3)no2)C1 ZINC000512055951 920825771 /nfs/dbraw/zinc/82/57/71/920825771.db2.gz HAQTXMWUTHJXGP-QUCCMNQESA-N 0 3 402.583 4.163 20 0 HIADHN Cc1nn(C)c(C)c1CN[C@H](C)CC(=O)Nc1cc(C(F)(F)F)ccc1Cl ZINC000512085683 920848880 /nfs/dbraw/zinc/84/88/80/920848880.db2.gz XPRXWVDUAYGJQM-SNVBAGLBSA-N 0 3 402.848 4.216 20 0 HIADHN CCCNC(=O)Nc1ccc(CC(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)cc1 ZINC000512096192 920857709 /nfs/dbraw/zinc/85/77/09/920857709.db2.gz WSSPNZVNUVREQN-HSZRJFAPSA-N 0 3 422.573 4.022 20 0 HIADHN COc1cccc(N2CC[C@@H](NCc3cnn(-c4ccc(C(F)(F)F)cc4)c3)C2)c1 ZINC000512096734 920858009 /nfs/dbraw/zinc/85/80/09/920858009.db2.gz ADGFXUIWBCCNIM-GOSISDBHSA-N 0 3 416.447 4.268 20 0 HIADHN CNS(=O)(=O)c1ccc([C@H](C)N[C@H](C)c2cc(C)c(Br)s2)cc1 ZINC000512112611 920868338 /nfs/dbraw/zinc/86/83/38/920868338.db2.gz FFBBHLJYANGJLW-NWDGAFQWSA-N 0 3 417.394 4.139 20 0 HIADHN Cc1nn(-c2ccc(Cl)c(Cl)c2)c(C)c1CC(=O)N[C@@H](C)C1=CCN(C)CC1 ZINC000512126760 920876746 /nfs/dbraw/zinc/87/67/46/920876746.db2.gz GEDLDEUDIMYZRP-ZDUSSCGKSA-N 0 3 421.372 4.105 20 0 HIADHN C[C@H](NC(=O)c1cn(Cc2ccccc2)nc1-c1cccs1)C1=CCN(C)CC1 ZINC000512141532 920886555 /nfs/dbraw/zinc/88/65/55/920886555.db2.gz ATQUZFUVHIDUPY-KRWDZBQOSA-N 0 3 406.555 4.040 20 0 HIADHN O=C(CN1CCC[C@@]2(CC=CCC2)C1)NCc1cccc(COCc2ccco2)c1 ZINC000512156409 920896099 /nfs/dbraw/zinc/89/60/99/920896099.db2.gz ZJDOVMUIULEXEU-VWLOTQADSA-N 0 3 408.542 4.435 20 0 HIADHN Cc1c(C(=O)Nc2cccc(CN3CCC(CO)CC3)c2)cnn1C1CCCCC1 ZINC000512169161 920907301 /nfs/dbraw/zinc/90/73/01/920907301.db2.gz FTTCQECSBXVCFL-UHFFFAOYSA-N 0 3 410.562 4.153 20 0 HIADHN OCC[C@H](NC[C@H](O)COCc1ccccc1Cl)c1ccc(Cl)c(Cl)c1 ZINC000512192811 920935284 /nfs/dbraw/zinc/93/52/84/920935284.db2.gz FLTBFHRJWMJCBV-KXBFYZLASA-N 0 3 418.748 4.238 20 0 HIADHN C[C@H]1Cc2cc(-c3ccc(CNCc4ccc5c(c4)oc(=O)n5C)cc3)ccc2O1 ZINC000512194900 920939981 /nfs/dbraw/zinc/93/99/81/920939981.db2.gz LNPXAWSUHHCXAQ-INIZCTEOSA-N 0 3 400.478 4.412 20 0 HIADHN O=S(=O)(CCCN[C@@H](CCO)c1ccc(Cl)c(Cl)c1)c1ccc(F)cc1 ZINC000512199019 920945378 /nfs/dbraw/zinc/94/53/78/920945378.db2.gz CJQKOLUYIPKAKL-SFHVURJKSA-N 0 3 420.333 4.010 20 0 HIADHN FC(F)(F)c1ccc(CN2CC[C@@H](NCc3cn4cc(Cl)ccc4n3)C2)cc1 ZINC000512242946 920999208 /nfs/dbraw/zinc/99/92/08/920999208.db2.gz NQGCANXDSKKFAN-QGZVFWFLSA-N 0 3 408.855 4.371 20 0 HIADHN CCCN(CC(=O)Nc1ccc(Cl)cc1)C1CCN(c2cc(C)nc(C)n2)CC1 ZINC000512277668 921033339 /nfs/dbraw/zinc/03/33/39/921033339.db2.gz HLMKBBBUGBFJTG-UHFFFAOYSA-N 0 3 415.969 4.066 20 0 HIADHN CCCN(CC(=O)Nc1c(C)cc(C)cc1C)C1CCN(c2cc(C)nc(C)n2)CC1 ZINC000512281914 921037162 /nfs/dbraw/zinc/03/71/62/921037162.db2.gz KPSAJNBTKDJHGO-UHFFFAOYSA-N 0 3 423.605 4.338 20 0 HIADHN CS(=O)(=O)CC1(CN[C@H](c2ccccc2)c2ccc(Br)cc2)CCC1 ZINC000512307398 921060953 /nfs/dbraw/zinc/06/09/53/921060953.db2.gz CAUCZPKASWJWAH-LJQANCHMSA-N 0 3 422.388 4.343 20 0 HIADHN CN(CC(=O)N1CCC[C@H]1c1ccc2c(c1)OCCCO2)[C@H]1CCc2ccccc2C1 ZINC000512323098 921073984 /nfs/dbraw/zinc/07/39/84/921073984.db2.gz LLNZIXHMLUNRPH-GOTSBHOMSA-N 0 3 420.553 4.001 20 0 HIADHN C[C@H](C(=O)Nc1ccc(CC(=O)N2CCCc3ccccc32)cc1)N1[C@H](C)CC[C@H]1C ZINC000512349585 921093571 /nfs/dbraw/zinc/09/35/71/921093571.db2.gz YBCVWHGHHPZNFN-VAMGGRTRSA-N 0 3 419.569 4.408 20 0 HIADHN CCCn1c(SC[C@H](O)CN2CCc3ccccc3C2)nnc1-c1cccc(C)c1 ZINC000513478029 921835658 /nfs/dbraw/zinc/83/56/58/921835658.db2.gz AXFHUPYWLDJJCE-JOCHJYFZSA-N 0 3 422.598 4.175 20 0 HIADHN O=C(NCc1coc(-c2ccccc2)n1)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000513479307 921836866 /nfs/dbraw/zinc/83/68/66/921836866.db2.gz KKIUNULPGWADRW-HXUWFJFHSA-N 0 3 411.452 4.115 20 0 HIADHN CC(C)[C@H](NC1CCN(Cc2c(F)cccc2Cl)CC1)c1nnc2ccccn21 ZINC000513484711 921840013 /nfs/dbraw/zinc/84/00/13/921840013.db2.gz OSSJWCVETCBNJE-NRFANRHFSA-N 0 3 415.944 4.473 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)Cc1csc(-c2cccs2)n1 ZINC000513487403 921840974 /nfs/dbraw/zinc/84/09/74/921840974.db2.gz CUAHMULMTJMAFG-UHFFFAOYSA-N 0 3 403.548 4.144 20 0 HIADHN C[C@@H]1CN(Cc2ccc(CN[C@H](Cc3ccccn3)c3cccnc3)cc2)C[C@H](C)O1 ZINC000513500356 921850150 /nfs/dbraw/zinc/85/01/50/921850150.db2.gz MCNMPNBCFVRFCV-YZIHRLCOSA-N 0 3 416.569 4.159 20 0 HIADHN O=C1COc2ccc(CN3CCC(c4ccc(Br)cc4)CC3)cc2N1 ZINC000513513305 921860359 /nfs/dbraw/zinc/86/03/59/921860359.db2.gz DWGIVCOELZYAOY-UHFFFAOYSA-N 0 3 401.304 4.160 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2ccccc2Oc2cnn(C)c2)N2CCCC2)cc1 ZINC000513557007 921893093 /nfs/dbraw/zinc/89/30/93/921893093.db2.gz QURLWRDIHPCWHS-QFIPXVFZSA-N 0 3 404.514 4.088 20 0 HIADHN CS(=O)(=O)c1ccc2c(c1)CCN(CC(c1ccccc1)c1ccccc1)CC2 ZINC000513569523 921901594 /nfs/dbraw/zinc/90/15/94/921901594.db2.gz SYGHHGVJRWUKAR-UHFFFAOYSA-N 0 3 405.563 4.323 20 0 HIADHN Cc1nc([C@@H]2CCCOC2)sc1C(=O)N[C@H](CN(C)C)c1ccc(Cl)cc1 ZINC000513574366 921906723 /nfs/dbraw/zinc/90/67/23/921906723.db2.gz WIIBRTNFPOCHDC-NVXWUHKLSA-N 0 3 407.967 4.032 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCc3c(F)cccc3SC)c(C)c2)CC1 ZINC000513596123 921926948 /nfs/dbraw/zinc/92/69/48/921926948.db2.gz XECCZFCZAHAJOE-UHFFFAOYSA-N 0 3 416.566 4.320 20 0 HIADHN c1ccc(COc2ccc(CNC[C@@H]3COCCO3)c(OCc3ccccc3)c2)cc1 ZINC000513627212 921954596 /nfs/dbraw/zinc/95/45/96/921954596.db2.gz MVXDVVHJXYVMOC-RUZDIDTESA-N 0 3 419.521 4.350 20 0 HIADHN CCc1csc(CC(=O)N[C@@H](c2ccc(F)c(F)c2)C(C)(C)N2CCCC2)n1 ZINC000513647784 921970009 /nfs/dbraw/zinc/97/00/09/921970009.db2.gz KOMFKSIHSOKNQI-FQEVSTJZSA-N 0 3 407.530 4.258 20 0 HIADHN CCCN(C(=O)NCc1nccc(C(F)F)n1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000513668587 921992266 /nfs/dbraw/zinc/99/22/66/921992266.db2.gz ANDNAKLWNDKJHZ-GOSISDBHSA-N 0 3 417.504 4.000 20 0 HIADHN COc1cc(CN2CCC[C@H](c3nnc4n3CCC4)C2)ccc1OCc1ccccc1 ZINC000513678649 922000752 /nfs/dbraw/zinc/00/07/52/922000752.db2.gz QKHFOXBEUMAGPO-NRFANRHFSA-N 0 3 418.541 4.192 20 0 HIADHN COc1ccccc1[C@@H](C)N(C)C(=O)CN[C@H]1CCC[C@H]1Oc1cc(F)cc(F)c1 ZINC000513734053 922054703 /nfs/dbraw/zinc/05/47/03/922054703.db2.gz ZLDDSLFIIMRTLS-UPKQVVFYSA-N 0 3 418.484 4.083 20 0 HIADHN Cc1noc(C)c1[C@@H](C)CC(=O)N(CCN(C)C)Cc1ccc(C(F)(F)F)cc1 ZINC000513853818 922179005 /nfs/dbraw/zinc/17/90/05/922179005.db2.gz FBCFXQXSFCZURE-AWEZNQCLSA-N 0 3 411.468 4.394 20 0 HIADHN C[C@H](NC(=O)NC[C@H](c1ccccc1)N1CCCC1)c1cccc(N2CCCC2=O)c1 ZINC000513889251 922217721 /nfs/dbraw/zinc/21/77/21/922217721.db2.gz PLLONRXODLATPX-WMZHIEFXSA-N 0 3 420.557 4.011 20 0 HIADHN CCN1CCN(Cc2ccc(CNC(=O)Nc3cccc(C(F)F)c3)cc2)CC1 ZINC000513921467 922243568 /nfs/dbraw/zinc/24/35/68/922243568.db2.gz CFTFPPQBJUUOKS-UHFFFAOYSA-N 0 3 402.489 4.083 20 0 HIADHN COc1cc(Cl)c(C(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)cc1OC ZINC000513946055 922264983 /nfs/dbraw/zinc/26/49/83/922264983.db2.gz GJVJNMUWSPGMHW-INIZCTEOSA-N 0 3 402.922 4.094 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCc1ccc(C)nc1)c1ccc(C(F)(F)F)cc1 ZINC000514075653 922399331 /nfs/dbraw/zinc/39/93/31/922399331.db2.gz JUYKWYPHGVMPRG-LJQANCHMSA-N 0 3 408.468 4.291 20 0 HIADHN CO[C@@H](CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1)c1ccc(Cl)cc1 ZINC000514080580 922404325 /nfs/dbraw/zinc/40/43/25/922404325.db2.gz UMMYTIHGZMBYEF-FQEVSTJZSA-N 0 3 405.901 4.453 20 0 HIADHN CN(CCCc1cc(-c2ccccc2)no1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000514148587 922483863 /nfs/dbraw/zinc/48/38/63/922483863.db2.gz GDPNGKNHDABVRR-QFIPXVFZSA-N 0 3 418.541 4.190 20 0 HIADHN Cc1ccccc1C[C@H]1CCCN1CC(=O)N1CCC[C@H]1c1ccc2c(c1)OCCO2 ZINC000514185712 922523617 /nfs/dbraw/zinc/52/36/17/922523617.db2.gz KITPFIDIOLBNKX-PKTZIBPZSA-N 0 3 420.553 4.137 20 0 HIADHN COc1ccc(OC)c([C@H]2CCCN2C(=O)CN2CCC[C@@H]2Cc2ccccc2C)c1 ZINC000514187655 922527818 /nfs/dbraw/zinc/52/78/18/922527818.db2.gz ZCAIDHWRQVADHS-ZJSXRUAMSA-N 0 3 422.569 4.383 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)NCC1(c2ccc(F)cc2)CCC1 ZINC000514193595 922533826 /nfs/dbraw/zinc/53/38/26/922533826.db2.gz RIMWFJWCMAYHNR-IBGZPJMESA-N 0 3 401.551 4.445 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)NCc2cccc(NC(=O)CC(C)C)c2)N(C)C)cc1 ZINC000514196944 922535191 /nfs/dbraw/zinc/53/51/91/922535191.db2.gz GCHAMIUWIYFLFP-HSZRJFAPSA-N 0 3 424.589 4.336 20 0 HIADHN COc1cccc([C@@H](CNC(=O)NCc2ccc(C(F)(F)F)cc2)N2CCCC2)c1 ZINC000514197260 922536104 /nfs/dbraw/zinc/53/61/04/922536104.db2.gz LGGZZLFVGQRXBO-HXUWFJFHSA-N 0 3 421.463 4.350 20 0 HIADHN COc1cccc([C@H](CNC(=O)NCCc2cccc(Cl)c2)N2CCCC2)c1 ZINC000514458101 922635775 /nfs/dbraw/zinc/63/57/75/922635775.db2.gz CVSJLKJXBUHKDK-NRFANRHFSA-N 0 3 401.938 4.027 20 0 HIADHN C[C@@H](N[C@@H]1CCCc2cc(S(N)(=O)=O)ccc21)c1ccc(-c2cccnc2)cc1 ZINC000514619440 922725298 /nfs/dbraw/zinc/72/52/98/922725298.db2.gz YYLDWZIMLCVCBL-WAIKUNEKSA-N 0 3 407.539 4.124 20 0 HIADHN C[C@H](N[C@@H]1CCCc2cc(S(N)(=O)=O)ccc21)c1ccc(-c2cccnc2)cc1 ZINC000514619439 922725907 /nfs/dbraw/zinc/72/59/07/922725907.db2.gz YYLDWZIMLCVCBL-QMHKHESXSA-N 0 3 407.539 4.124 20 0 HIADHN COc1cccc2c1CCC[C@@H]2N[C@@H]1CCCN(Cc2ccc(F)cc2F)C1=O ZINC000514650629 922745394 /nfs/dbraw/zinc/74/53/94/922745394.db2.gz KPDMHBOOXHAEDV-LEWJYISDSA-N 0 3 400.469 4.132 20 0 HIADHN OC[C@@]1(Cc2ccc(F)cc2)CCN(Cc2ccc(OCC(F)(F)F)c(F)c2)C1 ZINC000514758240 922786335 /nfs/dbraw/zinc/78/63/35/922786335.db2.gz JCQFJRVSSISRLH-HXUWFJFHSA-N 0 3 415.402 4.333 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)c1ccc(C)c(NC(=O)NC(C)(C)C)c1)c1ccco1 ZINC000514962435 922855227 /nfs/dbraw/zinc/85/52/27/922855227.db2.gz HJAPBVFYXAONKX-LPHOPBHVSA-N 0 3 414.550 4.367 20 0 HIADHN CCOc1ccccc1NC(=O)[C@H](C)N[C@@H]1CCN(C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000514976640 922862229 /nfs/dbraw/zinc/86/22/29/922862229.db2.gz WJDZEBWUXSOODW-UQIDSAAFSA-N 0 3 419.928 4.240 20 0 HIADHN CC(C)N(Cc1ccccc1)C(=O)[C@H](C)N[C@H]1CCN(C)[C@@H]1c1ccc(F)c(F)c1 ZINC000515017678 922880405 /nfs/dbraw/zinc/88/04/05/922880405.db2.gz CUMHYCNFKMPSBK-PDIWNELESA-N 0 3 415.528 4.125 20 0 HIADHN O=C(Cc1csc(Cc2ccccc2)n1)N[C@H](CN1CCCC1)c1ccccc1 ZINC000515079593 922896378 /nfs/dbraw/zinc/89/63/78/922896378.db2.gz ZLIQJFGUDLMNPD-JOCHJYFZSA-N 0 3 405.567 4.230 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N(C)Cc3nc4ccccc4s3)c(C)c2)CC1 ZINC000515233458 923006689 /nfs/dbraw/zinc/00/66/89/923006689.db2.gz FXARTGHFPMZWGM-UHFFFAOYSA-N 0 3 423.586 4.411 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1nnc(-c2ccccc2)s1)c1ccsc1 ZINC000515385455 923074928 /nfs/dbraw/zinc/07/49/28/923074928.db2.gz RZENIFXOMLWNKX-MRXNPFEDSA-N 0 3 401.561 4.471 20 0 HIADHN O=C(Cc1noc(C2CCN(C3CC3)CC2)n1)Nc1ccccc1Oc1ccccc1 ZINC000515492370 923132917 /nfs/dbraw/zinc/13/29/17/923132917.db2.gz FYHBGURBGIJSDN-UHFFFAOYSA-N 0 3 418.497 4.385 20 0 HIADHN Cc1cc(C)n(-c2ccc(CCN[C@@H](C(=O)N3CCCCC3)c3ccccc3)cc2)n1 ZINC000515518560 923149529 /nfs/dbraw/zinc/14/95/29/923149529.db2.gz KUUOUVPSDMYZKM-RUZDIDTESA-N 0 3 416.569 4.375 20 0 HIADHN COc1cccc([C@H](CNc2ncnc3ccc(Br)cc32)N(C)C)c1 ZINC000515578640 923194280 /nfs/dbraw/zinc/19/42/80/923194280.db2.gz BBPDEQCTSPMUIZ-SFHVURJKSA-N 0 3 401.308 4.116 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)N3CCC[C@H]3C3CCCC3)CC2)c1 ZINC000515803872 923360087 /nfs/dbraw/zinc/36/00/87/923360087.db2.gz VQVOUECZOPWCBQ-DEOSSOPVSA-N 0 3 412.622 4.261 20 0 HIADHN Cc1ccc(C(=O)Nc2cccc(CNC(=O)N3CCN(C4CCCC4)CC3)c2)cc1 ZINC000515821101 923373183 /nfs/dbraw/zinc/37/31/83/923373183.db2.gz KHPBLCSKMLDKOU-UHFFFAOYSA-N 0 3 420.557 4.017 20 0 HIADHN COc1ccc([C@@H](CNC(=O)N[C@@H](C)c2c(F)cccc2F)N2CCCC2)cc1 ZINC000515825737 923376255 /nfs/dbraw/zinc/37/62/55/923376255.db2.gz YCBVHYQMVVCQHZ-MGPUTAFESA-N 0 3 403.473 4.171 20 0 HIADHN CC1CCN([C@@H](CNC(=O)c2ccc(Cn3ccnc3)cc2)c2ccccc2)CC1 ZINC000515987490 923482297 /nfs/dbraw/zinc/48/22/97/923482297.db2.gz ICFCSYGIYAZGGB-DEOSSOPVSA-N 0 3 402.542 4.134 20 0 HIADHN CC1CCN([C@H](CNC(=O)c2cccc(N3CCCC3=O)c2)c2ccccc2)CC1 ZINC000515987337 923482312 /nfs/dbraw/zinc/48/23/12/923482312.db2.gz FQTONTRJQLZRQW-HSZRJFAPSA-N 0 3 405.542 4.016 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)C[C@H](C)c3ccc(F)cc3)CC2)c1 ZINC000515997702 923488953 /nfs/dbraw/zinc/48/89/53/923488953.db2.gz VRBDEKSMRNYJPJ-NRFANRHFSA-N 0 3 411.565 4.346 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)N2CC=C(c3c[nH]c4ncccc34)CC2)C1 ZINC000516165265 923583250 /nfs/dbraw/zinc/58/32/50/923583250.db2.gz VNCKFVSDTMEWDP-GHTZIAJQSA-N 0 3 415.541 4.197 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)NCCc2c(Cl)cccc2Cl)CC1 ZINC000516168069 923583961 /nfs/dbraw/zinc/58/39/61/923583961.db2.gz CNBPCEGHBUIIST-UHFFFAOYSA-N 0 3 410.345 4.435 20 0 HIADHN COc1ccc(NC(=O)N[C@@H](CN(C)C)c2ccc(F)cc2)cc1Br ZINC000516168857 923584516 /nfs/dbraw/zinc/58/45/16/923584516.db2.gz KBJBYQCEJLKEEC-INIZCTEOSA-N 0 3 410.287 4.021 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)NCc2cc(F)cc(Br)c2)C1 ZINC000516165069 923584882 /nfs/dbraw/zinc/58/48/82/923584882.db2.gz LWOYMHXKGUFDKP-LIRRHRJNSA-N 0 3 420.326 4.223 20 0 HIADHN COc1cccc(CNC[C@H](c2ccc(Cl)cc2)N(C)CCC(F)(F)F)n1 ZINC000516266224 923636537 /nfs/dbraw/zinc/63/65/37/923636537.db2.gz WVYRXMYJLFLFLP-QGZVFWFLSA-N 0 3 401.860 4.459 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)c1cccc(-n2nccc2C(F)(F)F)c1)c1ccco1 ZINC000516335066 923671603 /nfs/dbraw/zinc/67/16/03/923671603.db2.gz ZGMMPOREUCGOQO-YOEHRIQHSA-N 0 3 420.435 4.343 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N[C@@H](C)c2ccccc2OC(F)F)C1 ZINC000516579724 923800422 /nfs/dbraw/zinc/80/04/22/923800422.db2.gz MPDIQKIYHZYRKE-JZXOWHBKSA-N 0 3 403.473 4.484 20 0 HIADHN O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)N(Cc1ccccc1)C[C@@H]1CCCO1 ZINC000516590060 923804881 /nfs/dbraw/zinc/80/48/81/923804881.db2.gz KSTLCBXRCGXATL-RPWUZVMVSA-N 0 3 407.558 4.042 20 0 HIADHN CC[C@H](NCc1cccc(NC(=O)c2ccncc2)c1)c1ccc(C(=O)OC)cc1 ZINC000516669475 923836368 /nfs/dbraw/zinc/83/63/68/923836368.db2.gz SCIGEWIGYQWMQC-QFIPXVFZSA-N 0 3 403.482 4.361 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)NC[C@@H]2CCCO[C@@H]2c2ccccc2)CC1 ZINC000516715986 923859679 /nfs/dbraw/zinc/85/96/79/923859679.db2.gz VCDQPOAMGQRDIQ-NZQKXSOJSA-N 0 3 411.546 4.053 20 0 HIADHN Cc1cc(Sc2ccccc2)ccc1NC(=O)C(=O)N[C@H](C)CN1CCCCC1 ZINC000516743773 923871303 /nfs/dbraw/zinc/87/13/03/923871303.db2.gz JMEZEJGLLKPVMK-GOSISDBHSA-N 0 3 411.571 4.075 20 0 HIADHN C[C@H]1[C@H](NC(=O)c2ccc(-c3nc(C4CC4)no3)cc2)CCN1Cc1ccccc1 ZINC000517021849 923966445 /nfs/dbraw/zinc/96/64/45/923966445.db2.gz YYUJSYAYBIDNAC-HRAATJIYSA-N 0 3 402.498 4.007 20 0 HIADHN CC(C)[C@@H](NC[C@H](O)CS(=O)(=O)c1cccs1)c1ccc(C(C)(C)C)cc1 ZINC000517045620 923971694 /nfs/dbraw/zinc/97/16/94/923971694.db2.gz FFRJKFGWNJLJGW-AZUAARDMSA-N 0 3 409.617 4.167 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)CCc2nc3ccccc3s2)N(C)C)cc1 ZINC000517048957 923974617 /nfs/dbraw/zinc/97/46/17/923974617.db2.gz ZPGGTMSBCRGARD-HXUWFJFHSA-N 0 3 411.571 4.435 20 0 HIADHN C[C@@H](CNC(=O)CSc1nnc(-c2ccc3ccccc3c2)o1)N1CCC[C@@H](C)C1 ZINC000517090330 923991510 /nfs/dbraw/zinc/99/15/10/923991510.db2.gz LUNUKTACYPPYCR-SJORKVTESA-N 0 3 424.570 4.219 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCCc1nc(C(C)(C)C)cs1)c1ccsc1 ZINC000517090650 923991691 /nfs/dbraw/zinc/99/16/91/923991691.db2.gz OKTZLIBCTFMCQI-INIZCTEOSA-N 0 3 408.637 4.427 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)N1CCn2cccc2[C@H]1c1ccccc1 ZINC000517111653 924003873 /nfs/dbraw/zinc/00/38/73/924003873.db2.gz WFOWCCRTMPZMNI-JWQCQUIFSA-N 0 3 414.553 4.440 20 0 HIADHN CC[C@H](NC(=O)NC[C@@H](c1cccc(OC)c1)N1CCCC1)c1nc(C)cs1 ZINC000517136872 924019782 /nfs/dbraw/zinc/01/97/82/924019782.db2.gz TZFRYPWFYPQNRG-OALUTQOASA-N 0 3 402.564 4.048 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)N(Cc2cccs2)C[C@H]2CCCO2)CCN1Cc1ccccc1 ZINC000517255493 924063906 /nfs/dbraw/zinc/06/39/06/924063906.db2.gz LUKITIPFQJFXKE-UZKOGDIHSA-N 0 3 413.587 4.102 20 0 HIADHN COCCOc1ccc(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2)cc1Cl ZINC000517324888 924103642 /nfs/dbraw/zinc/10/36/42/924103642.db2.gz IFZKSOSCIWBTGK-UHFFFAOYSA-N 0 3 423.916 4.100 20 0 HIADHN C[C@H](NC(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1)c1nc(C(C)(C)C)cs1 ZINC000517373118 924141945 /nfs/dbraw/zinc/14/19/45/924141945.db2.gz HSZXZFXCKAXSTO-ZACQAIPSSA-N 0 3 422.639 4.032 20 0 HIADHN CC(C)Sc1ccc(Cl)cc1NC(=O)C(=O)NCCN1[C@@H](C)CCC[C@@H]1C ZINC000517423356 924173886 /nfs/dbraw/zinc/17/38/86/924173886.db2.gz VSWLTXKCFSSNBV-GJZGRUSLSA-N 0 3 411.999 4.158 20 0 HIADHN CN(C[C@H](O)COc1ccccc1)[C@H]1CCSc2ccc(Br)cc21 ZINC000517526748 924246380 /nfs/dbraw/zinc/24/63/80/924246380.db2.gz BZZOTLFWSYMUSR-YJBOKZPZSA-N 0 3 408.361 4.358 20 0 HIADHN O=C(COc1ccccc1CNCCOc1cccc(Cl)c1Cl)N1CCCC1 ZINC000517534267 924250734 /nfs/dbraw/zinc/25/07/34/924250734.db2.gz INIPSAAAHGDEFM-UHFFFAOYSA-N 0 3 423.340 4.163 20 0 HIADHN COc1cc(Br)c(CNC[C@@H](C)N2CCc3ccccc32)cc1OC ZINC000517550024 924260091 /nfs/dbraw/zinc/26/00/91/924260091.db2.gz MIDYVZRFUBUUSI-CQSZACIVSA-N 0 3 405.336 4.007 20 0 HIADHN C[C@H]1CCCCN1C(=O)CN(C)CCCCCc1cc(-c2cccc(F)c2)n[nH]1 ZINC000517600163 926709147 /nfs/dbraw/zinc/70/91/47/926709147.db2.gz PJYQEQDTUFGLGI-SFHVURJKSA-N 0 3 400.542 4.261 20 0 HIADHN CN(Cc1csc(Br)c1)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000517776674 926831994 /nfs/dbraw/zinc/83/19/94/926831994.db2.gz LXTQKMCOYGPVHB-QGZVFWFLSA-N 0 3 422.392 4.317 20 0 HIADHN O=C(NC[C@H]1CCCO[C@H]1c1ccccc1)N1CCCN(Cc2ccccc2)CC1 ZINC000517804987 926844426 /nfs/dbraw/zinc/84/44/26/926844426.db2.gz USJYEPAJVOQGOX-RPWUZVMVSA-N 0 3 407.558 4.072 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)c1ccc(OC)c(OC2CCCC2)c1)c1ccco1 ZINC000517992889 926935361 /nfs/dbraw/zinc/93/53/61/926935361.db2.gz RNMCUSYSPZNNSJ-LPHOPBHVSA-N 0 3 400.519 4.469 20 0 HIADHN C[C@H](NC(=O)N(CCN(C)C)Cc1ccc(F)cc1)c1nc(C(C)(C)C)cs1 ZINC000518030962 926968022 /nfs/dbraw/zinc/96/80/22/926968022.db2.gz ZDNNIJLSMXXNAM-HNNXBMFYSA-N 0 3 406.571 4.414 20 0 HIADHN Cc1cc(NC(=O)NC[C@@H](c2ccccc2)N2CCCC2)ccc1C(=O)NC(C)C ZINC000518223039 927088618 /nfs/dbraw/zinc/08/86/18/927088618.db2.gz LHGUWZWTJDXFQU-QFIPXVFZSA-N 0 3 408.546 4.092 20 0 HIADHN CSc1ccc([C@@H](CNCc2cnc(C)nc2)N2CCc3sccc3C2)cc1 ZINC000518266271 927124459 /nfs/dbraw/zinc/12/44/59/927124459.db2.gz UBBRMMLVDIXZMI-OAQYLSRUSA-N 0 3 410.612 4.458 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3ccc4oc(C5CC5)nc4c3)CC2)C[C@H](C)O1 ZINC000518313292 927175094 /nfs/dbraw/zinc/17/50/94/927175094.db2.gz GEEVXRADYOPREB-IYBDPMFKSA-N 0 3 412.534 4.058 20 0 HIADHN Cc1ccc(-c2noc([C@H](C)NC[C@@H]3CN(Cc4ccccc4)CCCO3)n2)cc1F ZINC000518348987 927211820 /nfs/dbraw/zinc/21/18/20/927211820.db2.gz KCXWJXRVSMSCLE-GHTZIAJQSA-N 0 3 424.520 4.126 20 0 HIADHN C[C@H](C(=O)NC[C@H]1CCN(c2ccc(F)cc2)C1)N1CCC(Cc2ccccc2)CC1 ZINC000518385891 927234013 /nfs/dbraw/zinc/23/40/13/927234013.db2.gz FKIVTSPXOSMWFV-NFBKMPQASA-N 0 3 423.576 4.111 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N(Cc2ccccc2)C[C@H]2CCCO2)C1 ZINC000518406783 927247470 /nfs/dbraw/zinc/24/74/70/927247470.db2.gz CMFIVKBFOGCWRW-AGILITTLSA-N 0 3 407.558 4.213 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N(C)CCOc2ccccc2Cl)C1 ZINC000518406994 927248026 /nfs/dbraw/zinc/24/80/26/927248026.db2.gz UFHXOLCPBSSYLF-MJGOQNOKSA-N 0 3 401.938 4.196 20 0 HIADHN Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)N[C@H](C)CN(C)Cc1ccccc1 ZINC000518433773 927266928 /nfs/dbraw/zinc/26/69/28/927266928.db2.gz WVVNLMRWOXAKDV-LJQANCHMSA-N 0 3 410.562 4.023 20 0 HIADHN OC[C@]1(CNCc2cc(Br)ccc2OC(F)F)C[C@@H]1c1ccccc1 ZINC000518445219 927277576 /nfs/dbraw/zinc/27/75/76/927277576.db2.gz CRPXFHWCMYVYOF-VQIMIIECSA-N 0 3 412.274 4.306 20 0 HIADHN CN(Cc1ccccc1Br)C(=O)CCNCc1ccc(Cl)c(F)c1 ZINC000518452952 927285858 /nfs/dbraw/zinc/28/58/58/927285858.db2.gz VJTLJCYOVPJDOZ-UHFFFAOYSA-N 0 3 413.718 4.380 20 0 HIADHN Cc1noc(-c2ccc(C)c(NC(=O)N[C@H]3CCN([C@@H](C)c4ccccc4)C3)c2)n1 ZINC000518474198 927297240 /nfs/dbraw/zinc/29/72/40/927297240.db2.gz ZVFBSKZPYUXPOO-JXFKEZNVSA-N 0 3 405.502 4.310 20 0 HIADHN COc1cccc(OC)c1OC[C@@H](O)CN(C)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000518512211 927318746 /nfs/dbraw/zinc/31/87/46/927318746.db2.gz MQBIMOUKHXLAJO-PBHICJAKSA-N 0 3 413.436 4.155 20 0 HIADHN C[C@H](C(=O)Nc1cccc(N2CCCC2=O)c1)N1CCC[C@@H](Cc2ccccc2)C1 ZINC000518514980 927319828 /nfs/dbraw/zinc/31/98/28/927319828.db2.gz HHWHMTFHJIBJHL-CTNGQTDRSA-N 0 3 405.542 4.095 20 0 HIADHN COC(=O)c1cc(C)nc(NC[C@@H]2CCCN(C)[C@@H]2c2ccc(C(F)(F)F)cc2)n1 ZINC000518809210 927506926 /nfs/dbraw/zinc/50/69/26/927506926.db2.gz JKQDEECJCQFOCK-MAUKXSAKSA-N 0 3 422.451 4.085 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)c(Cl)c1 ZINC000518812473 927507714 /nfs/dbraw/zinc/50/77/14/927507714.db2.gz PQISZFACFSWQEB-KDOFPFPSSA-N 0 3 400.910 4.255 20 0 HIADHN Cc1ccc(NC(=O)[C@H]2CSCN2C(=O)c2cccc(CN3CCCC3)c2)cc1C ZINC000518822038 927517977 /nfs/dbraw/zinc/51/79/77/927517977.db2.gz UHAXRVWDBCKBRW-JOCHJYFZSA-N 0 3 423.582 4.053 20 0 HIADHN Cc1ccc(NC(=O)[C@@H]2CSCN2C(=O)c2cccc(CN3CCCC3)c2)cc1C ZINC000518822039 927518514 /nfs/dbraw/zinc/51/85/14/927518514.db2.gz UHAXRVWDBCKBRW-QFIPXVFZSA-N 0 3 423.582 4.053 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)NCC1(Sc2ccccc2)CC1 ZINC000518860829 927566207 /nfs/dbraw/zinc/56/62/07/927566207.db2.gz NVXLXBHHWUWQSZ-UHFFFAOYSA-N 0 3 401.551 4.224 20 0 HIADHN C[C@H](c1nc2ccccc2s1)N(C)C(=O)CCCN1CCN(c2ccccc2)CC1 ZINC000518903838 927613863 /nfs/dbraw/zinc/61/38/63/927613863.db2.gz YIKWXEWVJSKLAG-LJQANCHMSA-N 0 3 422.598 4.418 20 0 HIADHN C[C@@H](CNC(=O)N1CCC(Oc2ccc(F)cc2F)CC1)N(C)Cc1ccccc1 ZINC000518968055 927663291 /nfs/dbraw/zinc/66/32/91/927663291.db2.gz AJNYMSSVVFJFPU-KRWDZBQOSA-N 0 3 417.500 4.038 20 0 HIADHN C[C@H](NC(=O)C(=O)Nc1cccc(-c2ccccc2)c1)[C@@H](c1ccccc1)N(C)C ZINC000519007438 927686694 /nfs/dbraw/zinc/68/66/94/927686694.db2.gz SQGGHGTZAVANRL-MBSDFSHPSA-N 0 3 401.510 4.100 20 0 HIADHN COc1ccc([C@H](Cc2ccc(F)cc2)N[C@H](C)C(=O)NCCc2ccccc2)cc1 ZINC000519064326 927743319 /nfs/dbraw/zinc/74/33/19/927743319.db2.gz WCSMVBIRHIQBAI-CLOONOSVSA-N 0 3 420.528 4.455 20 0 HIADHN COCCN(CCN(C)C)C(=O)N[C@H](c1ccccc1)c1ccc(Cl)c(Cl)c1 ZINC000519175809 927812611 /nfs/dbraw/zinc/81/26/11/927812611.db2.gz GFQYKAJPOVBZCD-HXUWFJFHSA-N 0 3 424.372 4.302 20 0 HIADHN C[C@@H](O)CN(CC(=O)N1N=C(c2ccco2)C[C@H]1c1cccs1)C1CCCCC1 ZINC000519201636 927824596 /nfs/dbraw/zinc/82/45/96/927824596.db2.gz RMZHCAIVXKUIEE-APWZRJJASA-N 0 3 415.559 4.034 20 0 HIADHN COCCOc1c(Cl)cccc1NC(=O)NC[C@@H](c1ccc(C)cc1)N(C)C ZINC000519259462 927851183 /nfs/dbraw/zinc/85/11/83/927851183.db2.gz OIFPTBSCWLOPBY-IBGZPJMESA-N 0 3 405.926 4.098 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2ccccc2C(=O)N2CCCCC2)N(C)C)cc1 ZINC000519262057 927854166 /nfs/dbraw/zinc/85/41/66/927854166.db2.gz QPZVVPAAWZDMBG-JOCHJYFZSA-N 0 3 408.546 4.046 20 0 HIADHN COc1ccccc1OCc1ccc(C(=O)NC[C@H](c2ccc(C)cc2)N(C)C)o1 ZINC000519278538 927860587 /nfs/dbraw/zinc/86/05/87/927860587.db2.gz LOUXCGHTGCKAPQ-HXUWFJFHSA-N 0 3 408.498 4.208 20 0 HIADHN CCOc1cc2c(cc1[C@@H]1C[C@H]1NC(=O)c1cccc(CN3CCCC3)c1)O[C@@H](C)C2 ZINC000519365318 927897524 /nfs/dbraw/zinc/89/75/24/927897524.db2.gz WOOIHFVVICEOKG-JWNTYJGQSA-N 0 3 420.553 4.290 20 0 HIADHN COc1ccccc1[C@@H](NC(=O)N[C@H]1CCN(Cc2ccccc2)C1)c1ccccc1 ZINC000519440468 927950115 /nfs/dbraw/zinc/95/01/15/927950115.db2.gz IJYVZGNZFPDNRR-DHLKQENFSA-N 0 3 415.537 4.358 20 0 HIADHN COc1ccc(C)cc1NC(=O)[C@H](C)N[C@@H]1CCN(C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000519481341 927979314 /nfs/dbraw/zinc/97/93/14/927979314.db2.gz IQROQBHCCJIEAU-HLLQZAQXSA-N 0 3 419.928 4.158 20 0 HIADHN C[C@H](N[C@@H]1c2ccccc2CC12CCOCC2)C(=O)NC12CC3CC(CC(C3)C1)C2 ZINC000519482948 927979421 /nfs/dbraw/zinc/97/94/21/927979421.db2.gz GOKKSPNUQLDELI-LJVXEDPOSA-N 0 3 408.586 4.144 20 0 HIADHN Cc1c(NC(=O)N[C@@H]2CCN(Cc3ccccc3)[C@@H]2C)cnn1-c1ccccc1F ZINC000519551906 928010722 /nfs/dbraw/zinc/01/07/22/928010722.db2.gz CSJGWTAJPHQPAY-OXQOHEQNSA-N 0 3 407.493 4.104 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)N1CC[C@H](n2cc(Cl)cn2)C1)c1ccc(Cl)cc1 ZINC000519758269 928067529 /nfs/dbraw/zinc/06/75/29/928067529.db2.gz YYGCHEDSIBFDFA-OALUTQOASA-N 0 3 424.376 4.229 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCc1nccs1)c1ccc(C(F)(F)F)cc1 ZINC000519949852 928183533 /nfs/dbraw/zinc/18/35/33/928183533.db2.gz MCXZUNMSTOQSIV-OAHLLOKOSA-N 0 3 400.470 4.044 20 0 HIADHN Cc1cc(C(=O)N2CCCC[C@@H]2C)ccc1NC(=O)NC[C@@H](c1ccccc1)N(C)C ZINC000520049639 928273609 /nfs/dbraw/zinc/27/36/09/928273609.db2.gz CFNZQPVTAGDSTM-CVDCTZTESA-N 0 3 422.573 4.434 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2nn(-c3ccc(C)cc3)c3c2CCC3)N(C)C)cc1 ZINC000520061224 928285974 /nfs/dbraw/zinc/28/59/74/928285974.db2.gz IMRBPIQRCAEMOU-QHCPKHFHSA-N 0 3 402.542 4.011 20 0 HIADHN CCOc1ccc([C@@H](C)NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)cc1OC ZINC000520093203 928304804 /nfs/dbraw/zinc/30/48/04/928304804.db2.gz ONIFYVXOHNWPIM-YLJYHZDGSA-N 0 3 414.521 4.322 20 0 HIADHN CC(C)n1ncc2c1nc(C1CC1)cc2C(=O)N(CCN(C)C)Cc1ccccc1F ZINC000520110063 928316298 /nfs/dbraw/zinc/31/62/98/928316298.db2.gz JHZICNBMLPLFAJ-UHFFFAOYSA-N 0 3 423.536 4.233 20 0 HIADHN COc1ccc([C@@H](NC(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)C(C)C)cc1 ZINC000520127318 928325851 /nfs/dbraw/zinc/32/58/51/928325851.db2.gz ASLQXMYMDHAICW-QFIPXVFZSA-N 0 3 419.516 4.444 20 0 HIADHN CCOc1ccc(NC(=O)N(CCN(C)C)Cc2cccc(Cl)c2)cc1OC ZINC000520131005 928328019 /nfs/dbraw/zinc/32/80/19/928328019.db2.gz DFEWEOFFGBPJKP-UHFFFAOYSA-N 0 3 405.926 4.343 20 0 HIADHN CC[C@@H](c1ccccc1)N(CC)CC(=O)N1CCC(C(=O)N2CCCCCC2)CC1 ZINC000520174406 928364285 /nfs/dbraw/zinc/36/42/85/928364285.db2.gz IEWSZEBXNKFWHI-QHCPKHFHSA-N 0 3 413.606 4.101 20 0 HIADHN CC(C)(C)OCCNC(=O)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000520204587 928388014 /nfs/dbraw/zinc/38/80/14/928388014.db2.gz FLEOMTPEUMFQBQ-UHFFFAOYSA-N 0 3 416.393 4.416 20 0 HIADHN Fc1cccc([C@@H](CNCc2cc(Cl)ccc2OC(F)F)N2CCOCC2)c1 ZINC000520217985 928396028 /nfs/dbraw/zinc/39/60/28/928396028.db2.gz SOYMXNXIHRUKMB-GOSISDBHSA-N 0 3 414.855 4.244 20 0 HIADHN O=C1C[C@H](NCc2cccc(OCc3ccccn3)c2)CN1c1ccccc1Cl ZINC000520227191 928400476 /nfs/dbraw/zinc/40/04/76/928400476.db2.gz JZMALKXKBDZRIA-IBGZPJMESA-N 0 3 407.901 4.209 20 0 HIADHN COc1ccccc1CCNC(=O)CNC/C(C)=C/c1cccc(C(F)(F)F)c1 ZINC000520280195 928442709 /nfs/dbraw/zinc/44/27/09/928442709.db2.gz POKDSIKMQSPVHE-FOWTUZBSSA-N 0 3 406.448 4.066 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N(C)Cc2cnn(-c3ccccc3)c2)N2CCCC2)cc1 ZINC000520296733 928458343 /nfs/dbraw/zinc/45/83/43/928458343.db2.gz IDYJYIVVBVUKBC-XMMPIXPASA-N 0 3 417.557 4.159 20 0 HIADHN CCN1CCCC[C@@H]1CNC(=O)c1ccc(COc2cccc(Br)c2)o1 ZINC000520312305 928473592 /nfs/dbraw/zinc/47/35/92/928473592.db2.gz XNBASRMEFFOPLE-MRXNPFEDSA-N 0 3 421.335 4.225 20 0 HIADHN Cc1ccc(OCc2nc(CC(=O)NC[C@@H](C)N(C)Cc3ccccc3)cs2)cc1 ZINC000520326968 928491151 /nfs/dbraw/zinc/49/11/51/928491151.db2.gz YMBFJWRKBNYIDB-LJQANCHMSA-N 0 3 423.582 4.210 20 0 HIADHN COc1cc(C)c([C@H](C)NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)cc1OC ZINC000520348535 928511436 /nfs/dbraw/zinc/51/14/36/928511436.db2.gz ZLRIUPWPMNRBGN-PKOBYXMFSA-N 0 3 414.521 4.241 20 0 HIADHN CC(=O)Nc1cc(C(=O)N(CCN2CCCC2)Cc2ccc(Cl)cc2)ccc1C ZINC000520353518 928514466 /nfs/dbraw/zinc/51/44/66/928514466.db2.gz MJKKJJDOPFTYSA-UHFFFAOYSA-N 0 3 413.949 4.345 20 0 HIADHN CN(C(=O)c1cccnc1Nc1ccc(Cl)c(Cl)c1)[C@H]1CCN(C2CC2)C1 ZINC000520368738 928524892 /nfs/dbraw/zinc/52/48/92/928524892.db2.gz JGYNARFOFUFCLT-HNNXBMFYSA-N 0 3 405.329 4.441 20 0 HIADHN CN(C(=O)CCc1ncc(-c2ccc(Cl)cc2Cl)o1)[C@H]1CN2CCC1CC2 ZINC000520371405 928526325 /nfs/dbraw/zinc/52/63/25/928526325.db2.gz SFHLLTSLTSFWBH-KRWDZBQOSA-N 0 3 408.329 4.134 20 0 HIADHN O=C(Cc1coc(-c2ccc(Cl)cc2)n1)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000520494611 928598210 /nfs/dbraw/zinc/59/82/10/928598210.db2.gz YCUPMXNZSOILNP-NRFANRHFSA-N 0 3 409.917 4.491 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)NC[C@H](c2ccccc2)N2CCCC2)c(C)c1 ZINC000520597846 928661962 /nfs/dbraw/zinc/66/19/62/928661962.db2.gz HQGIOBUGUAIJDI-WMZHIEFXSA-N 0 3 422.573 4.482 20 0 HIADHN COc1ccc2c(c1F)CC[C@@H]2N[C@H]1CCCN([C@H](C)c2ccc(F)cc2)C1=O ZINC000520601744 928667017 /nfs/dbraw/zinc/66/70/17/928667017.db2.gz NWCSSBUIZDQIRW-UAOJZALGSA-N 0 3 400.469 4.303 20 0 HIADHN COc1cccc([C@H]2C[C@@H]2C(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)c1 ZINC000520705272 928752135 /nfs/dbraw/zinc/75/21/35/928752135.db2.gz QSAUKFJWUNLLDW-RTWAWAEBSA-N 0 3 420.475 4.408 20 0 HIADHN Cc1nn(Cc2ccc(C)cc2)c(C)c1CCC(=O)NCc1ccccc1CN(C)C ZINC000520738587 928786418 /nfs/dbraw/zinc/78/64/18/928786418.db2.gz RFYSISLJPQYJPB-UHFFFAOYSA-N 0 3 418.585 4.167 20 0 HIADHN CC(C)C(=O)Nc1cccc(NC(=O)N(CCCc2ccccc2)CCN(C)C)c1 ZINC000520781027 928814800 /nfs/dbraw/zinc/81/48/00/928814800.db2.gz KMKMBRHXYNGJBB-UHFFFAOYSA-N 0 3 410.562 4.309 20 0 HIADHN CCC[C@H](CNC(=O)CN(C)C[C@H]1CCCOC1)c1ccc(Cl)cc1Cl ZINC000520783838 928815586 /nfs/dbraw/zinc/81/55/86/928815586.db2.gz VDNNXYVLKOPHFC-HZPDHXFCSA-N 0 3 401.378 4.352 20 0 HIADHN CCC[C@@H](CNC(=O)CN(C)C[C@@H]1CCCOC1)c1ccc(Cl)cc1Cl ZINC000520783837 928815764 /nfs/dbraw/zinc/81/57/64/928815764.db2.gz VDNNXYVLKOPHFC-HOTGVXAUSA-N 0 3 401.378 4.352 20 0 HIADHN COCCOc1c(Cl)cccc1NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000520807161 928827608 /nfs/dbraw/zinc/82/76/08/928827608.db2.gz PJQPSNDJYIYTOM-SFHVURJKSA-N 0 3 417.937 4.151 20 0 HIADHN CCCO[C@H]1CCCN(C(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)CC1 ZINC000520825123 928834153 /nfs/dbraw/zinc/83/41/53/928834153.db2.gz XWAQUINOKSXQDO-PZJWPPBQSA-N 0 3 412.496 4.249 20 0 HIADHN CC[C@@H](C)C(=O)Nc1cccc(CNC(=O)NC[C@H](c2ccc(C)cc2)N(C)C)c1 ZINC000520892746 928862852 /nfs/dbraw/zinc/86/28/52/928862852.db2.gz MYNXUWDCUVUEBU-XMSQKQJNSA-N 0 3 410.562 4.082 20 0 HIADHN COc1ccc(CN[C@H]2CC(=O)N(c3ccccc3Cl)C2)cc1Br ZINC000520973250 928897610 /nfs/dbraw/zinc/89/76/10/928897610.db2.gz SFSDCELZOMNCPR-ZDUSSCGKSA-N 0 3 409.711 4.006 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)c1ccc(NC(=O)c2ccccc2)cc1 ZINC000521000186 928916499 /nfs/dbraw/zinc/91/64/99/928916499.db2.gz WJQRLTQNPDHICO-UHFFFAOYSA-N 0 3 419.500 4.282 20 0 HIADHN COCCCCN(Cc1ccccc1)C(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000521013615 928931167 /nfs/dbraw/zinc/93/11/67/928931167.db2.gz SHWACNSHSGPIIO-HSZRJFAPSA-N 0 3 412.549 4.493 20 0 HIADHN CC(C)(C)OCc1cccc(CNC(=O)CCCN2CCN(c3ccccc3)CC2)c1 ZINC000521095666 928991930 /nfs/dbraw/zinc/99/19/30/928991930.db2.gz MMQMFDDRYQBTPA-UHFFFAOYSA-N 0 3 423.601 4.220 20 0 HIADHN Cc1ccc(C2(C(=O)N3CCCN(CCCc4ccccc4)CC3)CCOCC2)cc1 ZINC000521118661 929006261 /nfs/dbraw/zinc/00/62/61/929006261.db2.gz HMTANYPPMGAYTR-UHFFFAOYSA-N 0 3 420.597 4.210 20 0 HIADHN CCN1CCCC[C@H]1CNC(=O)c1ccc(-c2nnc(-c3ccc(C)cc3)o2)cc1 ZINC000521130028 929013379 /nfs/dbraw/zinc/01/33/79/929013379.db2.gz ZWLIXSFKWUWEFW-NRFANRHFSA-N 0 3 404.514 4.316 20 0 HIADHN CN(C(=O)CCc1c2cc(F)ccc2[nH]c1-c1ccccc1)[C@H]1CN2CCC1CC2 ZINC000521156483 929030076 /nfs/dbraw/zinc/03/00/76/929030076.db2.gz QNWBJHZJSWAUCG-QHCPKHFHSA-N 0 3 405.517 4.459 20 0 HIADHN Cc1ccc(NC(=O)NC[C@H](c2cccs2)N2CCCC2)cc1C(=O)NC(C)C ZINC000521303789 929113116 /nfs/dbraw/zinc/11/31/16/929113116.db2.gz LDIGMKZOQCRVCR-LJQANCHMSA-N 0 3 414.575 4.153 20 0 HIADHN O=C(Nc1ccc(-c2nnc3n2CCCC3)cc1)c1cccc(CN2CCCC2)c1 ZINC000521329791 929145273 /nfs/dbraw/zinc/14/52/73/929145273.db2.gz NQBHCZMVINGZJJ-UHFFFAOYSA-N 0 3 401.514 4.130 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)c1c(Cl)c2ccccc2n1C ZINC000521350541 929170869 /nfs/dbraw/zinc/17/08/69/929170869.db2.gz YZETVUMYASNKLF-SFHVURJKSA-N 0 3 410.949 4.353 20 0 HIADHN O=C(CN[C@@H](c1cccc(C(F)(F)F)c1)C1CCOCC1)NCc1ccc(F)cc1 ZINC000521474143 929238034 /nfs/dbraw/zinc/23/80/34/929238034.db2.gz OIOJHOWWPJFLGL-OAQYLSRUSA-N 0 3 424.438 4.218 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N(Cc2cccs2)C[C@H]2CCCO2)N(C)C)cc1 ZINC000521511022 929264185 /nfs/dbraw/zinc/26/41/85/929264185.db2.gz NKDMTRQMIZCRAC-CTNGQTDRSA-N 0 3 401.576 4.050 20 0 HIADHN Cc1ncc(CN2CCC[C@H](c3nc(C(F)(F)F)cn3C)C2)n1-c1ccccc1 ZINC000521511803 929264918 /nfs/dbraw/zinc/26/49/18/929264918.db2.gz CPEPTWPTXOLCOQ-INIZCTEOSA-N 0 3 403.452 4.313 20 0 HIADHN NC(=O)[C@H](NCCCc1cccc(C(F)(F)F)c1)c1ccc(Br)cc1 ZINC000521535326 929281170 /nfs/dbraw/zinc/28/11/70/929281170.db2.gz ABNXIJXZUPAMCE-MRXNPFEDSA-N 0 3 415.253 4.217 20 0 HIADHN CCOc1ccc(CNC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)cc1F ZINC000521574311 929304964 /nfs/dbraw/zinc/30/49/64/929304964.db2.gz BPFSQENSOYTSFB-NRFANRHFSA-N 0 3 424.438 4.295 20 0 HIADHN COc1ccc([C@@H](NC(=O)N(CCN(C)C)Cc2ccc(F)cc2F)C(C)C)cc1 ZINC000521679302 929361694 /nfs/dbraw/zinc/36/16/94/929361694.db2.gz PDCNMSABVYSSTJ-QFIPXVFZSA-N 0 3 419.516 4.444 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N(C)C[C@H]1CCCOC1)c1ccc(C(F)(F)F)cc1 ZINC000521696081 929371406 /nfs/dbraw/zinc/37/14/06/929371406.db2.gz FCTKSXSHXXSTJR-APWZRJJASA-N 0 3 415.500 4.156 20 0 HIADHN CN(C)[C@H](CNC(=O)CCCCOc1ccc(Br)cc1)c1ccccc1 ZINC000521751194 929412983 /nfs/dbraw/zinc/41/29/83/929412983.db2.gz VFXLUOJHPXXBPU-HXUWFJFHSA-N 0 3 419.363 4.417 20 0 HIADHN Cc1nn(C)c2nc(-c3cccs3)cc(C(=O)N(CCN(C)C)c3ccccc3)c12 ZINC000521791657 929450031 /nfs/dbraw/zinc/45/00/31/929450031.db2.gz WIGWAOXPGDEELO-UHFFFAOYSA-N 0 3 419.554 4.214 20 0 HIADHN CC(=O)Nc1ccc(OC[C@@H](O)CN(Cc2ccccc2)Cc2ccc(F)cc2)cc1 ZINC000521815715 929473449 /nfs/dbraw/zinc/47/34/49/929473449.db2.gz WAJUWEGYLZPXCA-DEOSSOPVSA-N 0 3 422.500 4.226 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3cccc(OC4CCCC4)c3)CC2)C[C@@H](C)O1 ZINC000521880111 929530422 /nfs/dbraw/zinc/53/04/22/929530422.db2.gz FSJYRVXBVCVVOX-RTBURBONSA-N 0 3 415.578 4.361 20 0 HIADHN COCCSc1ccc([C@H](C)N[C@H](C)C(=O)N(C)Cc2cccc(F)c2)cc1 ZINC000521881792 929530990 /nfs/dbraw/zinc/53/09/90/929530990.db2.gz VRQARHSBGDDOFK-DLBZAZTESA-N 0 3 404.551 4.262 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)c1ccc(-c2ccco2)nc1C ZINC000521883365 929533249 /nfs/dbraw/zinc/53/32/49/929533249.db2.gz XLOFZYPZYUQQBK-HXUWFJFHSA-N 0 3 404.514 4.172 20 0 HIADHN COc1ccc(CN2CCC[C@@H](CNC(=O)CC(F)(F)F)C2)cc1OCC(C)C ZINC000521942080 929579072 /nfs/dbraw/zinc/57/90/72/929579072.db2.gz VMBLKXBBHBQJCV-KRWDZBQOSA-N 0 3 416.484 4.011 20 0 HIADHN COc1ccc(CN2CCC[C@H](CNC(=O)CC(F)(F)F)C2)cc1OCC(C)C ZINC000521942081 929579250 /nfs/dbraw/zinc/57/92/50/929579250.db2.gz VMBLKXBBHBQJCV-QGZVFWFLSA-N 0 3 416.484 4.011 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)N[C@H](c1ccccc1)C(F)(F)F ZINC000521953869 929588842 /nfs/dbraw/zinc/58/88/42/929588842.db2.gz ZTMHWRSSZIYHDO-OAQYLSRUSA-N 0 3 405.464 4.009 20 0 HIADHN CN(C)[C@H](CNC(=O)c1n[nH]c2ccc(Br)cc21)c1ccccc1Cl ZINC000521963154 929599753 /nfs/dbraw/zinc/59/97/53/929599753.db2.gz JBJHWMDTAOHKLK-MRXNPFEDSA-N 0 3 421.726 4.012 20 0 HIADHN CCN1CC[C@@H](NCC(=O)Nc2c(C)cccc2C)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000522008813 929616973 /nfs/dbraw/zinc/61/69/73/929616973.db2.gz ZXRWWCJHRBWTMJ-XMSQKQJNSA-N 0 3 405.464 4.084 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)N[C@@H]1C[C@H]1c1cccc(Br)c1 ZINC000522057732 929625118 /nfs/dbraw/zinc/62/51/18/929625118.db2.gz UKEZTKFDFYKRQL-ZWKOTPCHSA-N 0 3 422.392 4.140 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@H](C)N2CCC[C@@H](Cc3ccccc3)C2)cc1OC ZINC000524485767 929634178 /nfs/dbraw/zinc/63/41/78/929634178.db2.gz JAMSGIDUEPWXJH-FPOVZHCZSA-N 0 3 410.558 4.005 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N2CCC(c3c[nH]c4ncccc34)CC2)N(C)C)cc1 ZINC000524518722 929662407 /nfs/dbraw/zinc/66/24/07/929662407.db2.gz PPEIKGABIMHOCC-QFIPXVFZSA-N 0 3 405.546 4.063 20 0 HIADHN CN(CCN1CCN(C(=O)Nc2cccc3ccccc32)CC1)Cc1ccccc1 ZINC000524555143 929684411 /nfs/dbraw/zinc/68/44/11/929684411.db2.gz AYZSTPWUAURNGK-UHFFFAOYSA-N 0 3 402.542 4.121 20 0 HIADHN COCCN1CC[C@H](NC(=O)N[C@@H](C)c2ccccc2-c2ccc(Cl)cc2)C1 ZINC000524605417 929716364 /nfs/dbraw/zinc/71/63/64/929716364.db2.gz YJKSMMAZALFOGS-LPHOPBHVSA-N 0 3 401.938 4.088 20 0 HIADHN CCc1ccccc1O[C@@H](C(=O)NCC(C)(C)N1CCC(OC)CC1)c1ccccc1 ZINC000524611248 929721993 /nfs/dbraw/zinc/72/19/93/929721993.db2.gz HPIXUWUBADNJCH-XMMPIXPASA-N 0 3 424.585 4.375 20 0 HIADHN COc1ccccc1[C@H](NC(=O)NCCN(C)Cc1ccccc1)c1ccccc1 ZINC000524614693 929724321 /nfs/dbraw/zinc/72/43/21/929724321.db2.gz UDDQMSBFCMPUKE-XMMPIXPASA-N 0 3 403.526 4.216 20 0 HIADHN CN(C)CCN(C(=O)Cc1ccc(NC(=O)CC(C)(C)C)cc1)C1CCCCC1 ZINC000524647763 929761197 /nfs/dbraw/zinc/76/11/97/929761197.db2.gz SPMDYGXUNRGBEL-UHFFFAOYSA-N 0 3 401.595 4.327 20 0 HIADHN CCCN(C(=O)c1cc2c([nH]c1=O)CCCC2)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000524688815 929800749 /nfs/dbraw/zinc/80/07/49/929800749.db2.gz AZFVJUBXBTURJJ-NRFANRHFSA-N 0 3 407.558 4.183 20 0 HIADHN C[C@H]1CCN(C(=O)c2ccccc2OCc2ccncc2)CCN1Cc1ccccc1 ZINC000524711016 929806878 /nfs/dbraw/zinc/80/68/78/929806878.db2.gz LDMHUUCGCRBHJI-NRFANRHFSA-N 0 3 415.537 4.397 20 0 HIADHN C[C@H](NC(=O)NCC1(N2CCSCC2)CCCC1)c1ncc(-c2ccccc2)o1 ZINC000524802539 929835696 /nfs/dbraw/zinc/83/56/96/929835696.db2.gz APJFBUKGEJCQNT-KRWDZBQOSA-N 0 3 414.575 4.063 20 0 HIADHN Cc1cc(C)cc(C2(C(=O)NC3CCN(CCOc4ccc(F)cc4)CC3)CC2)c1 ZINC000524816006 929841580 /nfs/dbraw/zinc/84/15/80/929841580.db2.gz KDHKPKMYGSVQGS-UHFFFAOYSA-N 0 3 410.533 4.134 20 0 HIADHN CC(=O)c1ccc(OCCCC(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)cc1 ZINC000524864921 929863970 /nfs/dbraw/zinc/86/39/70/929863970.db2.gz IDRSKCATIAUCGE-FQEVSTJZSA-N 0 3 408.542 4.171 20 0 HIADHN COc1ccc(CC[C@H](C)NC(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)cc1 ZINC000524882175 929870980 /nfs/dbraw/zinc/87/09/80/929870980.db2.gz IWAQSBDNNVSHMA-SFTDATJTSA-N 0 3 409.574 4.322 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)[C@H]1C[C@@H]1c1ccccc1OC(F)(F)F ZINC000524958092 929920647 /nfs/dbraw/zinc/92/06/47/929920647.db2.gz ACUGETGSNFTJLB-UXHICEINSA-N 0 3 418.459 4.253 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)[C@H]1C[C@H]1c1ccccc1OC(F)(F)F ZINC000524958091 929920812 /nfs/dbraw/zinc/92/08/12/929920812.db2.gz ACUGETGSNFTJLB-PMACEKPBSA-N 0 3 418.459 4.253 20 0 HIADHN Cc1cccc(NC2CCN(C(=O)CCCN3CCN(c4ccccc4)CC3)CC2)c1 ZINC000524973676 929938043 /nfs/dbraw/zinc/93/80/43/929938043.db2.gz VXBQOTKYHPCTFC-UHFFFAOYSA-N 0 3 420.601 4.000 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N2CCC(Nc3cccc(C)c3)CC2)N(C)C)cc1 ZINC000524992676 929959731 /nfs/dbraw/zinc/95/97/31/929959731.db2.gz PNZHCBHJVDEIFW-DEOSSOPVSA-N 0 3 408.590 4.446 20 0 HIADHN CN(C(=O)c1ccc(COc2ccccc2Br)cc1)[C@@H]1CCCN(C)C1 ZINC000525010555 929972105 /nfs/dbraw/zinc/97/21/05/929972105.db2.gz XMEDWQBQCZYBEI-GOSISDBHSA-N 0 3 417.347 4.194 20 0 HIADHN C[C@@H]1CN(C(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)C[C@H](c2ccc(F)cc2)O1 ZINC000525095994 930032003 /nfs/dbraw/zinc/03/20/03/930032003.db2.gz OKAWYIPHCORQAH-HCLVMJGWSA-N 0 3 414.496 4.165 20 0 HIADHN CCc1nc(C)c([C@@H](C)N(C)CCC(=O)Nc2ccc(N3CCCC3=O)cc2)s1 ZINC000525121338 930048004 /nfs/dbraw/zinc/04/80/04/930048004.db2.gz IQOWBPURTOLINF-MRXNPFEDSA-N 0 3 414.575 4.162 20 0 HIADHN COc1ccc(OC)c([C@@H]2CCCN2C(=O)CN2CC[C@@H](c3ccccc3)[C@@H](C)C2)c1 ZINC000525122300 930048790 /nfs/dbraw/zinc/04/87/90/930048790.db2.gz DKNNKMBDMFZDJO-KWOQKUFVSA-N 0 3 422.569 4.493 20 0 HIADHN CCN(Cc1ccc(OC)c(OC)c1)C(=O)CN1CC[C@H](c2ccccc2)[C@@H](C)C1 ZINC000525122239 930049059 /nfs/dbraw/zinc/04/90/59/930049059.db2.gz BRDIZYVJZGOWHZ-UGKGYDQZSA-N 0 3 410.558 4.178 20 0 HIADHN NC(=O)c1ccc(CNC2(c3ccc(OCc4ccccc4)cc3)CCOCC2)cc1 ZINC000525184064 930079815 /nfs/dbraw/zinc/07/98/15/930079815.db2.gz IZGXRRIDYZZFKT-UHFFFAOYSA-N 0 3 416.521 4.160 20 0 HIADHN Cc1c(C(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)cnn1-c1ccc(F)cc1F ZINC000525224510 930093152 /nfs/dbraw/zinc/09/31/52/930093152.db2.gz AEKNAZLHTHWCLU-KRWDZBQOSA-N 0 3 424.495 4.196 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)NCC2(c3cccc(Cl)c3)CC2)CC1 ZINC000525318103 930157403 /nfs/dbraw/zinc/15/74/03/930157403.db2.gz WBKGRQVGENLUKE-UHFFFAOYSA-N 0 3 401.938 4.271 20 0 HIADHN COc1ccc(C(=O)NC2CCN(CCOc3ccc(F)cc3)CC2)c2ccccc12 ZINC000525352043 930190552 /nfs/dbraw/zinc/19/05/52/930190552.db2.gz YNNFXRGYNVCNPK-UHFFFAOYSA-N 0 3 422.500 4.261 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)Cc1ccc(Br)cc1 ZINC000525385321 930210930 /nfs/dbraw/zinc/21/09/30/930210930.db2.gz TXDJPACRMPPEPP-QGZVFWFLSA-N 0 3 401.348 4.115 20 0 HIADHN CSC[C@@H](CCO)NCc1cc(Br)ccc1OCc1ccccc1 ZINC000525402727 930220527 /nfs/dbraw/zinc/22/05/27/930220527.db2.gz YVOARFMPECQFTL-GOSISDBHSA-N 0 3 410.377 4.232 20 0 HIADHN Cc1ccc(-c2nnco2)cc1NC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C ZINC000525410722 930224810 /nfs/dbraw/zinc/22/48/10/930224810.db2.gz KRAGWIWSWBBALT-GOSISDBHSA-N 0 3 405.502 4.173 20 0 HIADHN Cc1ccc(-c2nnco2)cc1NC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C ZINC000525410965 930224837 /nfs/dbraw/zinc/22/48/37/930224837.db2.gz KRAGWIWSWBBALT-SFHVURJKSA-N 0 3 405.502 4.173 20 0 HIADHN CCCN(Cc1cc(OC)c(OC)cc1Br)[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000525410854 930224875 /nfs/dbraw/zinc/22/48/75/930224875.db2.gz MIZXWTAVGIGUEX-NIKGAXFTSA-N 0 3 412.368 4.492 20 0 HIADHN C[C@H](CN1CCC[C@@H](C)C1)NC(=O)C(=O)Nc1cccc(CSC2CCCC2)c1 ZINC000525434779 930238296 /nfs/dbraw/zinc/23/82/96/930238296.db2.gz TZBPBBTXRMNYTP-QZTJIDSGSA-N 0 3 417.619 4.038 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1ccc(NC(=O)C2CC2)cc1 ZINC000525448144 930246024 /nfs/dbraw/zinc/24/60/24/930246024.db2.gz PXKLLYBGLTVJSK-SFHVURJKSA-N 0 3 406.530 4.163 20 0 HIADHN CC(C)COc1ccc(C(=O)Nc2ccc(C(=O)N(C)[C@H]3CCCN(C)C3)cc2)cc1 ZINC000525579586 930342529 /nfs/dbraw/zinc/34/25/29/930342529.db2.gz ATKHSFMUSRLJLP-QFIPXVFZSA-N 0 3 423.557 4.140 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2cc3ccccc3s2)cc1)[C@H]1CCCN(C)C1 ZINC000525581407 930343663 /nfs/dbraw/zinc/34/36/63/930343663.db2.gz XTRJPZVPFJTRRP-IBGZPJMESA-N 0 3 407.539 4.320 20 0 HIADHN Cc1c2cccc(C)c2oc1C(=O)Nc1ccc(C(=O)N(C)[C@H]2CCCN(C)C2)cc1 ZINC000525581798 930344268 /nfs/dbraw/zinc/34/42/68/930344268.db2.gz QRRAFBNZXUBFSO-FQEVSTJZSA-N 0 3 419.525 4.468 20 0 HIADHN COc1cc(CN[C@H](c2ccc(Cl)cc2)[C@H]2C[C@H]2C)cc(Cl)c1OCC(N)=O ZINC000525695719 930407046 /nfs/dbraw/zinc/40/70/46/930407046.db2.gz LAEVGEXAVBCNRX-ADYAMRHXSA-N 0 3 423.340 4.353 20 0 HIADHN CCOc1cc(CN[C@H](CC)c2ccncc2)ccc1OCC(=O)N1CCCCC1 ZINC000525697381 930408049 /nfs/dbraw/zinc/40/80/49/930408049.db2.gz QZUKJPPUEBOIDX-OAQYLSRUSA-N 0 3 411.546 4.113 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)cc1CN[C@@H](C)[C@H]1CN(Cc2ccccc2)CCO1 ZINC000525697255 930408210 /nfs/dbraw/zinc/40/82/10/930408210.db2.gz TWTCQIKJUNVETJ-YADARESESA-N 0 3 424.976 4.213 20 0 HIADHN Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)N[C@@H]1CCCN(c2cnn(C)c2)C1=O ZINC000525756837 930432205 /nfs/dbraw/zinc/43/22/05/930432205.db2.gz KISDGSKARMITDO-DNVCBOLYSA-N 0 3 409.559 4.007 20 0 HIADHN Cc1nnc(-c2cccc(C(=O)NC[C@@H](c3cccs3)N3CCC(C)CC3)c2)o1 ZINC000525821829 930456740 /nfs/dbraw/zinc/45/67/40/930456740.db2.gz XMNLSOBZRWSUKV-IBGZPJMESA-N 0 3 410.543 4.310 20 0 HIADHN C[C@H](NC(=O)C(=O)Nc1ccc2oc3ccccc3c2c1)[C@@H](c1ccccc1)N(C)C ZINC000525905194 930480468 /nfs/dbraw/zinc/48/04/68/930480468.db2.gz NXNXZGWKJPTCGE-HJPURHCSSA-N 0 3 415.493 4.332 20 0 HIADHN C[C@@H](CN[C@@H](C(N)=O)c1cccc(Br)c1)c1ccc(C(F)(F)F)cc1 ZINC000525952074 930492369 /nfs/dbraw/zinc/49/23/69/930492369.db2.gz HKEDTVIGDSDZTP-MEDUHNTESA-N 0 3 415.253 4.388 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(S(C)(=O)=O)cc1)c1ccc(OCc2cccnc2)cc1 ZINC000525953218 930493682 /nfs/dbraw/zinc/49/36/82/930493682.db2.gz WLBWEEXNKLILCL-MSOLQXFVSA-N 0 3 410.539 4.476 20 0 HIADHN COc1ccc2c(c1)CCC[C@H]2N[C@H]1CCCN(Cc2ccc(F)cc2F)C1=O ZINC000526047975 930515274 /nfs/dbraw/zinc/51/52/74/930515274.db2.gz DRGWIMKKULWLPX-YADHBBJMSA-N 0 3 400.469 4.132 20 0 HIADHN O=C1[C@@H](N[C@H](c2cccnc2)C2CC2)CCCN1Cc1cccc(C(F)(F)F)c1 ZINC000526083841 930523965 /nfs/dbraw/zinc/52/39/65/930523965.db2.gz IMUMYNFMQKHULE-PMACEKPBSA-N 0 3 403.448 4.332 20 0 HIADHN Cc1ccc2c(CCNC(=O)N(CCN(C)C)Cc3ccc(F)c(F)c3)c[nH]c2c1 ZINC000527131549 930597923 /nfs/dbraw/zinc/59/79/23/930597923.db2.gz KOIJIKGBAWNSGV-UHFFFAOYSA-N 0 3 414.500 4.070 20 0 HIADHN Cc1ccccc1[C@@H]([C@@H](C)NC(=O)C(=O)Nc1cccc(Cl)c1Cl)N(C)C ZINC000527206857 930612575 /nfs/dbraw/zinc/61/25/75/930612575.db2.gz FQLBUUUZAUYCKD-FZKQIMNGSA-N 0 3 408.329 4.048 20 0 HIADHN C[C@@H](NCC(=O)NCc1ccccc1Cn1cccn1)c1cc2ccccc2s1 ZINC000527484627 930666853 /nfs/dbraw/zinc/66/68/53/930666853.db2.gz SSIMEKMQSWGJBU-QGZVFWFLSA-N 0 3 404.539 4.113 20 0 HIADHN COc1cc(CNCc2ccc3c(c2)sc(=O)n3C)ccc1OCc1ccccc1 ZINC000527514109 930672291 /nfs/dbraw/zinc/67/22/91/930672291.db2.gz DBEBKKDJPPSMGF-UHFFFAOYSA-N 0 3 420.534 4.477 20 0 HIADHN Cc1ccc(NC(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)c(OC[C@H]2CCCO2)c1 ZINC000530357005 930692597 /nfs/dbraw/zinc/69/25/97/930692597.db2.gz AQQUGBRVOSPPOT-KJXAQDMKSA-N 0 3 409.530 4.120 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)Nc3cccc4c3OC(C)(C)C4)CC2)C[C@H](C)O1 ZINC000530448828 930712532 /nfs/dbraw/zinc/71/25/32/930712532.db2.gz FMHQGJZZDUVWPM-ROUUACIJSA-N 0 3 415.578 4.143 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2ccc(NC(=O)c3ccco3)cc2)[C@H]1c1ccccc1 ZINC000530462577 930719713 /nfs/dbraw/zinc/71/97/13/930719713.db2.gz LXJRISRHBJTSOQ-TZIWHRDSSA-N 0 3 404.470 4.099 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2cccc(OCc3cccnc3)c2)[C@@H]1c1ccccc1 ZINC000530515370 930734940 /nfs/dbraw/zinc/73/49/40/930734940.db2.gz DTINRNCOYGXBDV-PKTZIBPZSA-N 0 3 402.498 4.228 20 0 HIADHN O=C(NCCCc1ccc(Cl)cc1Cl)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000530589858 930761516 /nfs/dbraw/zinc/76/15/16/930761516.db2.gz GTCCFSLWPMSUQL-GOSISDBHSA-N 0 3 406.357 4.349 20 0 HIADHN CCN(C[C@@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)c1cccc2ccc(C)nc21 ZINC000530770892 930820007 /nfs/dbraw/zinc/82/00/07/930820007.db2.gz KNGWMIDOVQKGOJ-OAQYLSRUSA-N 0 3 423.582 4.076 20 0 HIADHN O=C(CC1(N2CCOCC2)CCCC1)NCc1ccc(OC2CCCCC2)cc1 ZINC000530809906 930829327 /nfs/dbraw/zinc/82/93/27/930829327.db2.gz GHVZNMNHUGLOHX-UHFFFAOYSA-N 0 3 400.563 4.049 20 0 HIADHN CN(C(=O)NCCc1ccc(OC(F)F)cc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000530827118 930833124 /nfs/dbraw/zinc/83/31/24/930833124.db2.gz OHSSCZKYJQYXQH-FQEVSTJZSA-N 0 3 417.500 4.137 20 0 HIADHN COc1cccc(OC)c1OC1CCN(CCCc2nc(-c3ccccc3)no2)CC1 ZINC000530867651 930844380 /nfs/dbraw/zinc/84/43/80/930844380.db2.gz VHIDAHCALCHLSP-UHFFFAOYSA-N 0 3 423.513 4.230 20 0 HIADHN CN(C[C@H](O)COC[C@@H]1CCCO1)[C@H](c1ccc(F)cc1)c1ccc(Cl)cc1 ZINC000530901574 930854247 /nfs/dbraw/zinc/85/42/47/930854247.db2.gz QOEKLQRUMGTWBD-FKBYEOEOSA-N 0 3 407.913 4.057 20 0 HIADHN CCCC(=O)Nc1cccc(CNCc2ccc(OC)c3oc(C(=O)OC)cc32)c1 ZINC000530904318 930855160 /nfs/dbraw/zinc/85/51/60/930855160.db2.gz NJTAKHVMHYEZGX-UHFFFAOYSA-N 0 3 410.470 4.256 20 0 HIADHN COC(=O)c1cc2c(o1)c(OC)ccc2CNCc1ccc(OC)c(OC(F)F)c1 ZINC000530904457 930855379 /nfs/dbraw/zinc/85/53/79/930855379.db2.gz OQSFPDVENAOHCE-UHFFFAOYSA-N 0 3 421.396 4.128 20 0 HIADHN O=C(Nc1cc(CCc2ccccc2)ccn1)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000530991555 930878381 /nfs/dbraw/zinc/87/83/81/930878381.db2.gz WCEMPOUKGRKNAO-QHCPKHFHSA-N 0 3 400.526 4.113 20 0 HIADHN CC(C)C1CCC(N2CCN(C(=O)N[C@@H](c3nccn3C)c3ccccc3)CC2)CC1 ZINC000530996896 930879935 /nfs/dbraw/zinc/87/99/35/930879935.db2.gz NTJAWMXPMUYOIJ-IQWMQGJTSA-N 0 3 423.605 4.052 20 0 HIADHN CN(C)Cc1ccc(-c2noc(Cc3csc(-c4ccc5c(c4)OCO5)n3)n2)cc1 ZINC000531110242 930922917 /nfs/dbraw/zinc/92/29/17/930922917.db2.gz BVKQOQYQMVIJHU-UHFFFAOYSA-N 0 3 420.494 4.241 20 0 HIADHN Cc1ccc2[nH]c([C@H]3CCCN(C(=O)c4ccc(Nc5ccncc5)cc4)C3)nc2c1 ZINC000531112519 930924523 /nfs/dbraw/zinc/92/45/23/930924523.db2.gz AIBBRRGNNOYJDK-IBGZPJMESA-N 0 3 411.509 4.452 20 0 HIADHN Cc1ccc2nc([C@H]3CCCN(C(=O)c4ccc(Nc5ccncc5)cc4)C3)[nH]c2c1 ZINC000531112519 930924533 /nfs/dbraw/zinc/92/45/33/930924533.db2.gz AIBBRRGNNOYJDK-IBGZPJMESA-N 0 3 411.509 4.452 20 0 HIADHN O=C(Nc1cc(Cc2ccccc2)ccc1O)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000531113174 930926985 /nfs/dbraw/zinc/92/69/85/930926985.db2.gz XFANENLAMWIILN-JOCHJYFZSA-N 0 3 401.510 4.229 20 0 HIADHN CC[C@H](C(=O)Nc1ccc(=O)n(Cc2ccc(Cl)c(Cl)c2)c1)N(CC)CC ZINC000531287350 931002138 /nfs/dbraw/zinc/00/21/38/931002138.db2.gz QNHINNWPEISGLD-GOSISDBHSA-N 0 3 410.345 4.262 20 0 HIADHN CN(C(=O)Nc1ccn(Cc2ccccc2)n1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000531314510 931013046 /nfs/dbraw/zinc/01/30/46/931013046.db2.gz YYQAUNKQCMUHFB-JOCHJYFZSA-N 0 3 403.530 4.060 20 0 HIADHN Cc1nn(CC(C)C)c(C)c1CCC(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000531395958 931042905 /nfs/dbraw/zinc/04/29/05/931042905.db2.gz QBSYQHQFUHIWAI-UHFFFAOYSA-N 0 3 410.606 4.212 20 0 HIADHN Cc1noc(-c2ccc(C)c(NC(=O)N(Cc3ccccc3)C3CCN(C)CC3)c2)n1 ZINC000531457005 931065253 /nfs/dbraw/zinc/06/52/53/931065253.db2.gz OPBOCYXAJKOKNW-UHFFFAOYSA-N 0 3 419.529 4.482 20 0 HIADHN CC(C)Oc1cccc(C[NH2+]Cc2nnc(-c3ccc(Br)cc3)[n-]2)c1 ZINC000531496081 931079129 /nfs/dbraw/zinc/07/91/29/931079129.db2.gz YIWFQSPMVOYIID-UHFFFAOYSA-N 0 3 401.308 4.311 20 0 HIADHN O=C(NCCc1nc2cc(Cl)ccc2s1)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000531500115 931080138 /nfs/dbraw/zinc/08/01/38/931080138.db2.gz KYURMLYFHPVOOF-QGZVFWFLSA-N 0 3 414.962 4.066 20 0 HIADHN CC(C)(C)c1nn(-c2ccccc2)cc1CNCc1ccccc1CN1CCOCC1 ZINC000531563800 931104421 /nfs/dbraw/zinc/10/44/21/931104421.db2.gz HGYDPDMLCWQVOT-UHFFFAOYSA-N 0 3 418.585 4.292 20 0 HIADHN Cc1cccc2c1CC[C@H]2NCc1ccc(OCCN2CCOCC2)c(Cl)c1 ZINC000531582073 931109218 /nfs/dbraw/zinc/10/92/18/931109218.db2.gz ULRARHKUXUPXGX-JOCHJYFZSA-N 0 3 400.950 4.137 20 0 HIADHN CCCn1nc(C)c(CNC[C@@H](c2c(F)cccc2Cl)N2CCO[C@@H](C)C2)c1C ZINC000531596552 931115723 /nfs/dbraw/zinc/11/57/23/931115723.db2.gz WYCCYZPTOTYBJB-BTYIYWSLSA-N 0 3 422.976 4.254 20 0 HIADHN C[C@@H](CCS(C)(=O)=O)NCc1cn(-c2ccccc2)nc1-c1cc2ccccc2o1 ZINC000531630853 931133596 /nfs/dbraw/zinc/13/35/96/931133596.db2.gz YDFDCCZVQRQPAJ-KRWDZBQOSA-N 0 3 423.538 4.198 20 0 HIADHN O=C(NCCCOc1ccc2ccccc2c1)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000531641513 931135654 /nfs/dbraw/zinc/13/56/54/931135654.db2.gz LQFHTCYUSKTKJO-HSZRJFAPSA-N 0 3 403.526 4.032 20 0 HIADHN C[C@H](c1ccc(F)c(F)c1)N(C)C(=O)CN(Cc1ccccc1)CC1CCOCC1 ZINC000531650887 931140169 /nfs/dbraw/zinc/14/01/69/931140169.db2.gz MNXWOKKVLUYLTB-GOSISDBHSA-N 0 3 416.512 4.413 20 0 HIADHN CC[C@@H](N[C@@H](C)c1cc(OC)c(OC)cc1C)c1ccccc1OCC(=O)N(C)C ZINC000531700199 931163957 /nfs/dbraw/zinc/16/39/57/931163957.db2.gz QDEWIHHLFQZPRI-FXAWDEMLSA-N 0 3 414.546 4.281 20 0 HIADHN COc1ccc(NC(=O)C[C@H](C)N[C@@H](c2ccc(F)cc2)[C@H]2CCCO2)c(OC)c1 ZINC000531706787 931167291 /nfs/dbraw/zinc/16/72/91/931167291.db2.gz HXGOLXJTQDSJFO-NQKDMWHGSA-N 0 3 416.493 4.070 20 0 HIADHN CC[C@@H](N[C@@H](C)c1cccc(S(=O)(=O)N(C)C)c1)c1ccc(OC(F)F)cc1 ZINC000531710177 931169008 /nfs/dbraw/zinc/16/90/08/931169008.db2.gz NHZBDXMORUTZCF-IFXJQAMLSA-N 0 3 412.502 4.340 20 0 HIADHN CN1CCN(C[C@H](N[C@@H]2CCSc3ccc(Cl)cc32)c2ccccc2)CC1 ZINC000531710118 931169265 /nfs/dbraw/zinc/16/92/65/931169265.db2.gz KKHSZGILHXDBGF-RTWAWAEBSA-N 0 3 402.007 4.455 20 0 HIADHN O=C(NC1CCCCC1)N1CCC(NCc2ccc(F)cc2Br)CC1 ZINC000531753175 931183242 /nfs/dbraw/zinc/18/32/42/931183242.db2.gz PAAAPYIUDYNYRX-UHFFFAOYSA-N 0 3 412.347 4.185 20 0 HIADHN O=C([C@H]1CCCN(Cc2cccnc2)C1)N(CCc1ccccc1F)C1CCCC1 ZINC000531895371 931235929 /nfs/dbraw/zinc/23/59/29/931235929.db2.gz VRTXIHLXAVAQOA-QFIPXVFZSA-N 0 3 409.549 4.447 20 0 HIADHN FC(F)(F)Cn1cc(CNC2(c3ccc(Br)cc3)CCOCC2)cn1 ZINC000531910880 931244052 /nfs/dbraw/zinc/24/40/52/931244052.db2.gz UEYAVWCZIOKCFQ-UHFFFAOYSA-N 0 3 418.257 4.003 20 0 HIADHN Cc1nc([C@@H](C)N2CC[C@H](N3CCN(C(C)C)CC3)C2)oc1-c1ccc(Cl)cc1 ZINC000531912600 931244579 /nfs/dbraw/zinc/24/45/79/931244579.db2.gz KSRHYWAFFZAOLE-NQIIRXRSSA-N 0 3 416.997 4.465 20 0 HIADHN COc1cc(OC)c([C@@H](C)NC[C@H](c2cccs2)N2CCN(C)CC2)cc1Cl ZINC000531932573 931251245 /nfs/dbraw/zinc/25/12/45/931251245.db2.gz UEWOQBBVAJPYHR-CRAIPNDOSA-N 0 3 424.010 4.058 20 0 HIADHN CCC(=O)Nc1cccc(CN[C@H](C)CC(=O)N(C)Cc2ccccc2Cl)c1 ZINC000531937681 931254204 /nfs/dbraw/zinc/25/42/04/931254204.db2.gz RATCZLFLFSTYRZ-MRXNPFEDSA-N 0 3 401.938 4.215 20 0 HIADHN C[C@H](CC(=O)N(C)Cc1cccc(Cl)c1)NCc1cnn(Cc2ccccc2)c1 ZINC000531941334 931255199 /nfs/dbraw/zinc/25/51/99/931255199.db2.gz HJFARKIRDPGASQ-GOSISDBHSA-N 0 3 410.949 4.112 20 0 HIADHN C[C@H]1C[C@@H](NCc2ccc(N3CCOCC3)nc2)c2cccc(Br)c21 ZINC000531945272 931257807 /nfs/dbraw/zinc/25/78/07/931257807.db2.gz UFDOVOWSTVYIMW-KBXCAEBGSA-N 0 3 402.336 4.019 20 0 HIADHN CC(C)C[C@H](N[C@H](C)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccccc1 ZINC000531947485 931259887 /nfs/dbraw/zinc/25/98/87/931259887.db2.gz OXPNCHXMNMXRMT-XXBNENTESA-N 0 3 416.587 4.146 20 0 HIADHN CSc1ccc([C@H](C)NCc2ccc(CS(=O)(=O)NC(C)C)cc2)cc1F ZINC000531951838 931261672 /nfs/dbraw/zinc/26/16/72/931261672.db2.gz NZRJDUHSIOGJEO-HNNXBMFYSA-N 0 3 410.580 4.226 20 0 HIADHN CC[C@H](NCc1ccc(C(=O)N2CCOCC2)cc1)c1cccc(Br)c1 ZINC000531954472 931262818 /nfs/dbraw/zinc/26/28/18/931262818.db2.gz QTTMVUFZYCALKR-FQEVSTJZSA-N 0 3 417.347 4.162 20 0 HIADHN CNC(=O)c1cccc(CN[C@H](Cc2ccc(OC)cc2)c2ccc(OC)cc2)c1 ZINC000531956009 931263381 /nfs/dbraw/zinc/26/33/81/931263381.db2.gz XDUQZTPPHYMAEN-XMMPIXPASA-N 0 3 404.510 4.137 20 0 HIADHN C[C@H](N[C@H](CN1CCN(C)CC1)c1ccccc1)c1ccccc1Br ZINC000531965889 931268327 /nfs/dbraw/zinc/26/83/27/931268327.db2.gz RKZKSHNUMFFANM-LAUBAEHRSA-N 0 3 402.380 4.088 20 0 HIADHN C[C@@H](N[C@@H](CN1CCN(C)CC1)c1ccccc1)c1ccc(F)cc1Br ZINC000531965884 931268477 /nfs/dbraw/zinc/26/84/77/931268477.db2.gz RCDCTZZCKAZMST-IERDGZPVSA-N 0 3 420.370 4.228 20 0 HIADHN COc1ccc(OC)c(NC(=O)C[C@H](C)NCc2ccc(C)cc2OC(C)C)c1 ZINC000531992555 931279273 /nfs/dbraw/zinc/27/92/73/931279273.db2.gz NRAHZJRZDIMCKI-KRWDZBQOSA-N 0 3 400.519 4.306 20 0 HIADHN C[C@H](NCc1ccc(N2CCCC2)nc1)c1ccc(NC(=O)c2ccncc2)cc1 ZINC000532077199 931303885 /nfs/dbraw/zinc/30/38/85/931303885.db2.gz XFYXYMCGQMXJRO-SFHVURJKSA-N 0 3 401.514 4.180 20 0 HIADHN CCOc1cccc([C@@H](C)NCc2ccc(OCCN3CCOCC3)c(Cl)c2)c1 ZINC000532093901 931309761 /nfs/dbraw/zinc/30/97/61/931309761.db2.gz OXBRXNVASHWGHL-GOSISDBHSA-N 0 3 418.965 4.301 20 0 HIADHN CC(C)N1CCN([C@@H]2CCN(C(=O)C3(c4cccc(Cl)c4)CCCCC3)C2)CC1 ZINC000532093875 931310074 /nfs/dbraw/zinc/31/00/74/931310074.db2.gz MOXUREMRNLXIGK-JOCHJYFZSA-N 0 3 418.025 4.169 20 0 HIADHN C[C@H]1C[C@H](c2ccccc2)CN1CC(=O)NCc1cccc(COCc2ccco2)c1 ZINC000532159886 931333365 /nfs/dbraw/zinc/33/33/65/931333365.db2.gz NZAWKACBWQYSGG-RDPSFJRHSA-N 0 3 418.537 4.491 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1c[nH]nc1-c1ccccc1Cl ZINC000532163869 931333880 /nfs/dbraw/zinc/33/38/80/931333880.db2.gz DIJXEOPYRAEDBA-UHFFFAOYSA-N 0 3 424.932 4.187 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@H](C)N[C@H](C)c2ccc(OC)c(F)c2)cc1 ZINC000532186783 931341190 /nfs/dbraw/zinc/34/11/90/931341190.db2.gz UMCUDQBCYYBUKZ-JKSUJKDBSA-N 0 3 408.539 4.277 20 0 HIADHN CCc1nc2c(s1)[C@H](N[C@H](C)c1ccc(S(=O)(=O)N(CC)CC)cc1)CCC2 ZINC000532203035 931348186 /nfs/dbraw/zinc/34/81/86/931348186.db2.gz CJERPEDPSVAVMN-CRAIPNDOSA-N 0 3 421.632 4.464 20 0 HIADHN C[C@H](NCc1ccc(-n2cnc3ccccc32)cc1)c1cccc(NS(C)(=O)=O)c1 ZINC000532205270 931349447 /nfs/dbraw/zinc/34/94/47/931349447.db2.gz GBJLAKYGBMVPAG-KRWDZBQOSA-N 0 3 420.538 4.248 20 0 HIADHN C[C@@H](NCc1ccc(C(=O)N2CCOCC2)cc1)c1ccc(SCC(F)F)cc1 ZINC000532209456 931351801 /nfs/dbraw/zinc/35/18/01/931351801.db2.gz IJSAHDQTSCADGW-MRXNPFEDSA-N 0 3 420.525 4.367 20 0 HIADHN Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)NCCNS(=O)(=O)c1ccccc1 ZINC000532208604 931351812 /nfs/dbraw/zinc/35/18/12/931351812.db2.gz ASSDRVIGEAHKON-MRXNPFEDSA-N 0 3 415.584 4.056 20 0 HIADHN C[C@@H](NCc1ccc(C(=O)N2CCOCC2)cc1)c1ccc(-c2ccncc2)cc1 ZINC000532209731 931352935 /nfs/dbraw/zinc/35/29/35/931352935.db2.gz REVFTBDPXKDBGW-LJQANCHMSA-N 0 3 401.510 4.072 20 0 HIADHN COc1cccc(COc2cccc(Cl)c2CN[C@@H]2CCC[C@H](C(N)=O)C2)c1 ZINC000532210318 931353118 /nfs/dbraw/zinc/35/31/18/931353118.db2.gz VADFEPRBZVYIOS-DLBZAZTESA-N 0 3 402.922 4.061 20 0 HIADHN COc1cccc(CN[C@H](C)CC(=O)Nc2ccc(OC(F)(F)F)cc2)c1OC ZINC000532210829 931354295 /nfs/dbraw/zinc/35/42/95/931354295.db2.gz JSVJUHRENGXNOS-CYBMUJFWSA-N 0 3 412.408 4.109 20 0 HIADHN CC[C@@H](N[C@@H](CN1CCN(C)CC1)c1ccccc1)c1cc(Cl)ccc1OC ZINC000532221228 931359385 /nfs/dbraw/zinc/35/93/85/931359385.db2.gz DOKGDEJRDQIBTN-YADHBBJMSA-N 0 3 401.982 4.378 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccnc2)C1)N1CCc2c(Cl)cc(Cl)cc2C1 ZINC000532244861 931370316 /nfs/dbraw/zinc/37/03/16/931370316.db2.gz DSADLBPHORQDPB-MRXNPFEDSA-N 0 3 404.341 4.185 20 0 HIADHN CCCN1CCN(c2ccccc2CNCc2coc(-c3ccc(C)cc3)n2)CC1 ZINC000532294675 931388657 /nfs/dbraw/zinc/38/86/57/931388657.db2.gz SBGLMPRMXFXFFK-UHFFFAOYSA-N 0 3 404.558 4.472 20 0 HIADHN COc1ccc(OCc2ccccn2)c(CN[C@H]2CCN(c3ncccc3Cl)C2)c1 ZINC000532321911 931396391 /nfs/dbraw/zinc/39/63/91/931396391.db2.gz WIWALLRLSWQSJA-SFHVURJKSA-N 0 3 424.932 4.086 20 0 HIADHN Cc1cc2occ(CC(=O)N3CC[C@H](N4CCN(C(C)C)CC4)C3)c2cc1C(C)C ZINC000532342971 931402409 /nfs/dbraw/zinc/40/24/09/931402409.db2.gz BLPXMMQFLNYLGJ-NRFANRHFSA-N 0 3 411.590 4.034 20 0 HIADHN CC(C)N1CCN([C@H]2CCN(C(=O)c3ccccc3Sc3ccccc3)C2)CC1 ZINC000532347222 931403713 /nfs/dbraw/zinc/40/37/13/931403713.db2.gz AECIYXGLCCUROQ-FQEVSTJZSA-N 0 3 409.599 4.078 20 0 HIADHN Cn1c(CNCCc2nc(-c3ccccn3)cs2)nc2cc(C(F)(F)F)ccc21 ZINC000532376090 931414924 /nfs/dbraw/zinc/41/49/24/931414924.db2.gz XUZFFTLBSQYMBN-UHFFFAOYSA-N 0 3 417.460 4.443 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(OCCNCc3cnc(C4CC4)s3)c2)cc1 ZINC000532393990 931421702 /nfs/dbraw/zinc/42/17/02/931421702.db2.gz JELRQNVDBGCCIR-UHFFFAOYSA-N 0 3 423.538 4.450 20 0 HIADHN COc1cc(C(=O)N(C)[C@@H]2CCN(C3CC3)C2)ccc1OCc1ccc(Cl)cc1 ZINC000532403674 931423538 /nfs/dbraw/zinc/42/35/38/931423538.db2.gz YYEGCOXOQULOBX-HXUWFJFHSA-N 0 3 414.933 4.236 20 0 HIADHN O=C1CCCN1Cc1ccccc1CN[C@@H]1CCc2ccc(OC(F)(F)F)cc21 ZINC000532449941 931439684 /nfs/dbraw/zinc/43/96/84/931439684.db2.gz IKZHNEBEPBGZAU-HXUWFJFHSA-N 0 3 404.432 4.485 20 0 HIADHN C[C@@H](NCc1ccc(N2CCN(C)CC2)nc1)c1ccc(OCc2ccccc2)cc1 ZINC000532451536 931439760 /nfs/dbraw/zinc/43/97/60/931439760.db2.gz DYDSHLBZTYLYBT-OAQYLSRUSA-N 0 3 416.569 4.263 20 0 HIADHN Cc1nc(Cc2ccccc2)sc1[C@@H](C)NCc1ccc(N2CCN(C)CC2)nc1 ZINC000532453764 931441268 /nfs/dbraw/zinc/44/12/68/931441268.db2.gz MWDDHROYTSGHAE-GOSISDBHSA-N 0 3 421.614 4.040 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1cnc(C2CC2)s1 ZINC000532456495 931443638 /nfs/dbraw/zinc/44/36/38/931443638.db2.gz XGMFFXQEKFJFRG-SFHVURJKSA-N 0 3 407.543 4.225 20 0 HIADHN CCSc1ccccc1[C@@H](C)NCc1ccc(CS(=O)(=O)NC(C)C)cc1 ZINC000532467759 931448280 /nfs/dbraw/zinc/44/82/80/931448280.db2.gz ICXQORUZZAKLHY-QGZVFWFLSA-N 0 3 406.617 4.477 20 0 HIADHN CCCCOc1ccc([C@H](C)N[C@@H](C)c2ccc(S(=O)(=O)NC)cc2)cc1OC ZINC000532471940 931450351 /nfs/dbraw/zinc/45/03/51/931450351.db2.gz PIIFVLPCUUUYLM-IRXDYDNUSA-N 0 3 420.575 4.194 20 0 HIADHN C[C@@H](N[C@H](CN1CCN(C)CC1)c1ccccc1)c1ccc(F)cc1OC(F)F ZINC000532497428 931462014 /nfs/dbraw/zinc/46/20/14/931462014.db2.gz XEHPVDUJZLNLKY-OXQOHEQNSA-N 0 3 407.480 4.066 20 0 HIADHN Cc1ccc(CN[C@@H](C)Cn2cc(Br)cn2)c(OCC(F)(F)F)c1 ZINC000532544621 931517130 /nfs/dbraw/zinc/51/71/30/931517130.db2.gz FDXLXSHVKRRDJQ-LBPRGKRZSA-N 0 3 406.246 4.073 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)CN2C[C@@H](c3ccccc3)C[C@@H]2C)cc1OC ZINC000532582844 931541062 /nfs/dbraw/zinc/54/10/62/931541062.db2.gz YYAAPHGKCWUFHR-NYVOZVTQSA-N 0 3 408.542 4.245 20 0 HIADHN COC1CCC(N(C)CC(=O)Nc2cc(-c3ccccc3)nn2-c2ccccc2)CC1 ZINC000532582700 931541570 /nfs/dbraw/zinc/54/15/70/931541570.db2.gz YDUNVIKNJAEFEW-UHFFFAOYSA-N 0 3 418.541 4.367 20 0 HIADHN COc1ccc(Br)c(CNCCc2nc(-c3ccncc3)cs2)c1 ZINC000532672390 931579128 /nfs/dbraw/zinc/57/91/28/931579128.db2.gz YSUONQONMMABAK-UHFFFAOYSA-N 0 3 404.333 4.309 20 0 HIADHN CCCCN(CC/C=C\c1ccc(Br)cc1)[C@@H]1CCS(=O)(=O)C1 ZINC000532712200 931603158 /nfs/dbraw/zinc/60/31/58/931603158.db2.gz DARYMKXKJBEKIA-WLPBJKJWSA-N 0 3 400.382 4.142 20 0 HIADHN CN1CCN(Cc2ccc(NCc3ccccc3OCc3cccnc3)cc2)CC1 ZINC000532730607 931615166 /nfs/dbraw/zinc/61/51/66/931615166.db2.gz WVYUWQQUTFMWSV-UHFFFAOYSA-N 0 3 402.542 4.020 20 0 HIADHN COc1ccc(NC(=O)CCN2CCC[C@@H](c3nc(C(F)(F)F)cs3)C2)cc1 ZINC000532742081 931619188 /nfs/dbraw/zinc/61/91/88/931619188.db2.gz PWUPDCONIHHNEX-CYBMUJFWSA-N 0 3 413.465 4.379 20 0 HIADHN CC(C)(NCc1ccc(-n2ccc(C(F)(F)F)n2)cc1)C(=O)NCC1CCCC1 ZINC000532765860 931626870 /nfs/dbraw/zinc/62/68/70/931626870.db2.gz XPHWJZHSXHORRD-UHFFFAOYSA-N 0 3 408.468 4.066 20 0 HIADHN CCN(C(=O)c1cnc2c(C)cc(F)cc2c1O)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000532863926 931671318 /nfs/dbraw/zinc/67/13/18/931671318.db2.gz IWYCQHUEDFPHOM-PXNSSMCTSA-N 0 3 421.516 4.273 20 0 HIADHN CCCO[C@@H]1CCCN([C@@H](C)C(=O)N(C)Cc2ccc(Br)cc2)CC1 ZINC000532961014 931715407 /nfs/dbraw/zinc/71/54/07/931715407.db2.gz WYFZDIWAHXOXFC-QFBILLFUSA-N 0 3 411.384 4.077 20 0 HIADHN CCCO[C@H]1CCCN([C@H](C)C(=O)N(C)Cc2ccc(Br)cc2)CC1 ZINC000532961012 931716084 /nfs/dbraw/zinc/71/60/84/931716084.db2.gz WYFZDIWAHXOXFC-APWZRJJASA-N 0 3 411.384 4.077 20 0 HIADHN CC1CCC(N2CCN(Cc3nc(=O)c4c(-c5ccco5)csc4[nH]3)CC2)CC1 ZINC000532978141 931723979 /nfs/dbraw/zinc/72/39/79/931723979.db2.gz LRWDCLZYRDGCIP-UHFFFAOYSA-N 0 3 412.559 4.353 20 0 HIADHN C[C@@H]1C[C@H](c2ccccc2)CN1CC(=O)Nc1cccc(CN2CCSCC2)c1 ZINC000532977951 931724290 /nfs/dbraw/zinc/72/42/90/931724290.db2.gz XXSDKFSZELPPDC-KNQAVFIVSA-N 0 3 409.599 4.052 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CNCCOc1ncccc1C(F)(F)F ZINC000533007498 931733957 /nfs/dbraw/zinc/73/39/57/931733957.db2.gz AIQLRWPCUZNGQV-UHFFFAOYSA-N 0 3 404.436 4.131 20 0 HIADHN C[C@H](N[C@@H](c1ccc(F)cc1)C1CCC1)C(=O)Nc1ccc(N2CCCC2=O)cc1 ZINC000533054876 931756151 /nfs/dbraw/zinc/75/61/51/931756151.db2.gz YDYUVASEXNJOMX-QMHKHESXSA-N 0 3 409.505 4.411 20 0 HIADHN CN(Cc1cc(Cl)cc(Cl)c1)C(=O)CNC1(c2ccccc2)CCOCC1 ZINC000533059853 931757891 /nfs/dbraw/zinc/75/78/91/931757891.db2.gz QQTQIOQTMRUALD-UHFFFAOYSA-N 0 3 407.341 4.247 20 0 HIADHN CCN(CC(=O)NC1CCCCCC1)C1CCN(c2cc(C)nc(C(C)C)n2)CC1 ZINC000533073173 931763925 /nfs/dbraw/zinc/76/39/25/931763925.db2.gz DNCRZASIUPQYBA-UHFFFAOYSA-N 0 3 415.626 4.038 20 0 HIADHN CN(C)Cc1ccc(-c2noc(Cc3ccc(OCc4ccccn4)cc3)n2)cc1 ZINC000533095922 931769884 /nfs/dbraw/zinc/76/98/84/931769884.db2.gz ZOGOMRJGBDTLKM-UHFFFAOYSA-N 0 3 400.482 4.363 20 0 HIADHN COc1ncc(CN(C)CCCc2cc(-c3ccc(F)cc3)n(C)n2)cc1Cl ZINC000533098756 931769971 /nfs/dbraw/zinc/76/99/71/931769971.db2.gz UAECNRRAVPLKKF-UHFFFAOYSA-N 0 3 402.901 4.348 20 0 HIADHN COc1ccc(NC(=O)[C@H](N[C@@H]2[C@@H]3CCO[C@@H]3C23CCCC3)c2ccccc2)cc1 ZINC000533177150 931802485 /nfs/dbraw/zinc/80/24/85/931802485.db2.gz WSPMHXAQFCXHSA-AFXVXQJMSA-N 0 3 406.526 4.312 20 0 HIADHN C[C@@]1(n2cc(CNC3(c4ccc(Cl)cc4)CCCCC3)cn2)CCS(=O)(=O)C1 ZINC000533191274 931805458 /nfs/dbraw/zinc/80/54/58/931805458.db2.gz HUMYPXWCZRLOQE-HXUWFJFHSA-N 0 3 421.994 4.019 20 0 HIADHN CN(C)[C@H]1CCCN(Cc2nc(=O)c3c(-c4ccccc4Cl)csc3[nH]2)C1 ZINC000533276009 931825079 /nfs/dbraw/zinc/82/50/79/931825079.db2.gz UFMGXSDKMLNVOP-ZDUSSCGKSA-N 0 3 402.951 4.243 20 0 HIADHN CCCN(CC(=O)Nc1cc(C2CC2)nn1-c1ccccc1)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000533294042 931831504 /nfs/dbraw/zinc/83/15/04/931831504.db2.gz GDTNSFXAJUFKDS-WUMKDDEVSA-N 0 3 422.573 4.214 20 0 HIADHN COC(=O)[C@H]1CC12CCN(Cc1cc(Cl)ccc1OCc1cccnc1)CC2 ZINC000533296413 931832312 /nfs/dbraw/zinc/83/23/12/931832312.db2.gz UOVZHNIVTQCCLW-LJQANCHMSA-N 0 3 400.906 4.089 20 0 HIADHN COc1cc(Cl)c(C)cc1NC(=O)[C@H](C)N1CCN(C2CCC(C)CC2)CC1 ZINC000533298139 931832384 /nfs/dbraw/zinc/83/23/84/931832384.db2.gz HUPWYWQWVCSLCD-NXYGQSRBSA-N 0 3 407.986 4.180 20 0 HIADHN CN(CC(=O)Nc1ccccc1Cl)C(=O)CN[C@@H](c1ccccc1)C(C)(C)C ZINC000533351640 931845920 /nfs/dbraw/zinc/84/59/20/931845920.db2.gz MWZOKHQGKGPNKD-NRFANRHFSA-N 0 3 401.938 4.114 20 0 HIADHN Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)N[C@@H]1CCCN(CC(F)(F)F)C1=O ZINC000533448983 931872649 /nfs/dbraw/zinc/87/26/49/931872649.db2.gz MDRZWUBIVNSODX-IAQYHMDHSA-N 0 3 415.456 4.462 20 0 HIADHN COc1ccc([C@@H](Cc2ccccc2C)NCc2cnc3cnccn23)cc1OC ZINC000533466600 931876574 /nfs/dbraw/zinc/87/65/74/931876574.db2.gz YCOSHXRWFOXAQO-OAQYLSRUSA-N 0 3 402.498 4.129 20 0 HIADHN O=C1c2ccccc2C(=O)N1CCCN1CCC(c2nc3cc(Cl)ccc3o2)CC1 ZINC000533491835 931883783 /nfs/dbraw/zinc/88/37/83/931883783.db2.gz ZQXAOTWNXZPFRE-UHFFFAOYSA-N 0 3 423.900 4.347 20 0 HIADHN Fc1cccc(-c2noc([C@@H]3CCCN(Cc4cnn(-c5ccccc5)c4)C3)n2)c1 ZINC000533507220 931887814 /nfs/dbraw/zinc/88/78/14/931887814.db2.gz LFQOIKGVUNRMHG-LJQANCHMSA-N 0 3 403.461 4.441 20 0 HIADHN CC(=O)Nc1ccc(OC[C@@H](O)CN2CCCC[C@H]2c2cc3ccccc3[nH]2)cc1 ZINC000533521388 931893234 /nfs/dbraw/zinc/89/32/34/931893234.db2.gz CSSLRKOCCQNPML-RDPSFJRHSA-N 0 3 407.514 4.093 20 0 HIADHN CC(C)N(CC(=O)Nc1cc(C2CCCC2)nn1-c1ccccc1)C1CCOCC1 ZINC000533531787 931895479 /nfs/dbraw/zinc/89/54/79/931895479.db2.gz GBIAMXNFHSIKPM-UHFFFAOYSA-N 0 3 410.562 4.358 20 0 HIADHN Cc1nc(CN[C@H]2CCCC[C@@H](N3C(=O)c4ccccc4C3=O)C2)nc2ccccc12 ZINC000533548207 931898280 /nfs/dbraw/zinc/89/82/80/931898280.db2.gz GEKQBAIYODMUEP-ZWKOTPCHSA-N 0 3 414.509 4.025 20 0 HIADHN Cc1nc(C(C)C)sc1[C@@H](C)N(C)C(=O)CCN1CCN(c2ccccc2)CC1 ZINC000533745379 932005633 /nfs/dbraw/zinc/00/56/33/932005633.db2.gz UMTFMTDUGDWYTO-LJQANCHMSA-N 0 3 414.619 4.307 20 0 HIADHN Cc1nc2ccccc2n1C[C@H]1CCCN1C(=O)c1ccc(Nc2ccncc2)cc1 ZINC000533750943 932007938 /nfs/dbraw/zinc/00/79/38/932007938.db2.gz APVAFEQKKQDYBM-JOCHJYFZSA-N 0 3 411.509 4.210 20 0 HIADHN C[C@@H](CC(=O)Nc1cccc(N2CCCC2)c1)NCc1cnc([C@H]2CCCO2)s1 ZINC000533753827 932010810 /nfs/dbraw/zinc/01/08/10/932010810.db2.gz CPCHRFZNXZZQSN-OXJNMPFZSA-N 0 3 414.575 4.102 20 0 HIADHN CN(C)CCn1cc(NC(=O)CCCCc2ccc(Cl)c(Cl)c2)ccc1=O ZINC000533779511 932029939 /nfs/dbraw/zinc/02/99/39/932029939.db2.gz VYFKCRVCNQEEIO-UHFFFAOYSA-N 0 3 410.345 4.068 20 0 HIADHN CN(C)[C@H](CNC(=O)N1CCC(c2nc3ccccc3s2)CC1)Cc1ccccc1 ZINC000533809445 932042146 /nfs/dbraw/zinc/04/21/46/932042146.db2.gz NYOCNZSVDBOWSB-FQEVSTJZSA-N 0 3 422.598 4.358 20 0 HIADHN CC[C@@](C)(COc1ncccc1Cl)NCC(=O)Nc1cc(Cl)ccc1F ZINC000533828358 932048345 /nfs/dbraw/zinc/04/83/45/932048345.db2.gz STCZOKHYTAIZMF-SFHVURJKSA-N 0 3 400.281 4.303 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)c2cc(I)ccc2F)c1 ZINC000533973629 932151689 /nfs/dbraw/zinc/15/16/89/932151689.db2.gz OPOIMPBPTQDEEW-UHFFFAOYSA-N 0 3 412.246 4.053 20 0 HIADHN Cc1nc(C)n(-c2ccccc2NC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)n1 ZINC000534015630 932197556 /nfs/dbraw/zinc/19/75/56/932197556.db2.gz TYPFGLSWYSVZQM-GOSISDBHSA-N 0 3 418.545 4.012 20 0 HIADHN Cc1ccc(OCc2cccc(C(=O)N[C@H]3CCN(C)[C@@H]3c3ccccc3)c2)cn1 ZINC000534016537 932197983 /nfs/dbraw/zinc/19/79/83/932197983.db2.gz FUIKRXRRJLWLAX-BJKOFHAPSA-N 0 3 401.510 4.144 20 0 HIADHN CCc1ccc(-c2nc(CC(=O)N[C@H]3CCN(C)[C@H]3c3ccccc3)cs2)cc1 ZINC000534018514 932199314 /nfs/dbraw/zinc/19/93/14/932199314.db2.gz IZZAUPFPSYMEJL-GMAHTHKFSA-N 0 3 405.567 4.477 20 0 HIADHN O=C(c1ccc(CN[C@@H]2CCc3c2cc(Cl)cc3Cl)cc1)N1CCOCC1 ZINC000534058540 932236803 /nfs/dbraw/zinc/23/68/03/932236803.db2.gz DKTMOIWSBXPDDK-HXUWFJFHSA-N 0 3 405.325 4.243 20 0 HIADHN O[C@H]1C[C@H](CNCc2ccc(-c3nc4ccccc4s3)o2)N(Cc2ccccc2)C1 ZINC000534083634 932262461 /nfs/dbraw/zinc/26/24/61/932262461.db2.gz JZUZVJMZUBVIGH-MOPGFXCFSA-N 0 3 419.550 4.281 20 0 HIADHN O=C(N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1CO)c1cccc(OC2CCCCC2)c1 ZINC000534181965 932319746 /nfs/dbraw/zinc/31/97/46/932319746.db2.gz LJJNEYBAMZXUOM-RCZVLFRGSA-N 0 3 422.569 4.011 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(CNCc3ccc(CN(C)C)c(F)c3)c2)cc1 ZINC000534239808 932358748 /nfs/dbraw/zinc/35/87/48/932358748.db2.gz BTCOTXJNEYHWRU-UHFFFAOYSA-N 0 3 421.516 4.438 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)[C@@H]2CC(=O)N(C)[C@H]2c2ccc(Cl)c(F)c2)c1 ZINC000534285269 932375534 /nfs/dbraw/zinc/37/55/34/932375534.db2.gz ILVQJZXHBANBBZ-UTKZUKDTSA-N 0 3 417.912 4.007 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)c2cc(-c3ccccn3)ccc2Cl)CC1 ZINC000534362301 932395837 /nfs/dbraw/zinc/39/58/37/932395837.db2.gz ASWOBKLGPCUVMJ-UHFFFAOYSA-N 0 3 401.938 4.021 20 0 HIADHN Cc1cnc(CCN(C)C(=O)NC[C@H](c2ccccc2)N2CCC(C)CC2)s1 ZINC000534383161 932409919 /nfs/dbraw/zinc/40/99/19/932409919.db2.gz GYTQPHBHULVZTQ-HXUWFJFHSA-N 0 3 400.592 4.109 20 0 HIADHN Cc1cc(C)c(CC(C(=O)Nc2cccc3c2oc(=O)n3C)C(F)(F)F)c(C)c1 ZINC000534465391 932483157 /nfs/dbraw/zinc/48/31/57/932483157.db2.gz PULRRZJNQAYJQW-HNNXBMFYSA-N 0 3 406.404 4.416 20 0 HIADHN Cc1ccc2c(c1)[nH]cc2C1=CCN(C(=O)NC[C@@H](Cc2ccccc2)N(C)C)CC1 ZINC000534522560 932544594 /nfs/dbraw/zinc/54/45/94/932544594.db2.gz POYHQNCXUFMIEN-JOCHJYFZSA-N 0 3 416.569 4.448 20 0 HIADHN O=C(N1CC=C(C(F)(F)F)CC1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000534538943 932552340 /nfs/dbraw/zinc/55/23/40/932552340.db2.gz CWLPPSGWTZFJMN-KRWDZBQOSA-N 0 3 406.370 4.162 20 0 HIADHN CC(C)n1cnnc1[C@@H]1CCCN(Cc2cccc(C(=O)Nc3ccccc3)c2)C1 ZINC000534542881 932554879 /nfs/dbraw/zinc/55/48/79/932554879.db2.gz VORXYUBKKLHXGG-OAQYLSRUSA-N 0 3 403.530 4.491 20 0 HIADHN Cc1ccc(-c2nc(C(=O)N(CCCc3ccccc3)CCN(C)C)cs2)n1C ZINC000534610258 932593791 /nfs/dbraw/zinc/59/37/91/932593791.db2.gz MCPBCTXCOKFYTA-UHFFFAOYSA-N 0 3 410.587 4.094 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)c1cc(Br)cc2cccnc21 ZINC000534633309 932610237 /nfs/dbraw/zinc/61/02/37/932610237.db2.gz POCAREGQZCEQEO-UHFFFAOYSA-N 0 3 414.303 4.320 20 0 HIADHN CN1CC[C@H](NC(=O)c2ccccc2-c2nc(C(C)(C)C)no2)[C@@H]1c1ccccc1 ZINC000534753687 932730779 /nfs/dbraw/zinc/73/07/79/932730779.db2.gz GGBUITGOZLBSIL-PMACEKPBSA-N 0 3 404.514 4.209 20 0 HIADHN CN(C)CCN(Cc1cccc(O)c1)C(=O)c1ccc(Cl)c(Br)c1 ZINC000534922916 932840253 /nfs/dbraw/zinc/84/02/53/932840253.db2.gz CMAXTAQYOLYXBA-UHFFFAOYSA-N 0 3 411.727 4.012 20 0 HIADHN C[C@H](CCc1ccc(O)cc1)NC(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000534927951 932842780 /nfs/dbraw/zinc/84/27/80/932842780.db2.gz VQSDHSVADNUSKX-VGSWGCGISA-N 0 3 420.475 4.284 20 0 HIADHN CN1CC[C@H](CNCc2nccn2CC(F)(F)F)[C@H]1c1ccc(Cl)c(F)c1 ZINC000534970657 932868944 /nfs/dbraw/zinc/86/89/44/932868944.db2.gz GSUGWGDBZKXHSQ-CXAGYDPISA-N 0 3 404.839 4.021 20 0 HIADHN CN1CC[C@@H](CNCc2nccn2CC(F)(F)F)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000534970659 932869035 /nfs/dbraw/zinc/86/90/35/932869035.db2.gz GSUGWGDBZKXHSQ-GUYCJALGSA-N 0 3 404.839 4.021 20 0 HIADHN CCOc1cc(CN(Cc2ccccc2)C[C@@H](C)O)cc(Br)c1OC ZINC000535081297 932899454 /nfs/dbraw/zinc/89/94/54/932899454.db2.gz VMVFOVSRPHZRFC-OAHLLOKOSA-N 0 3 408.336 4.239 20 0 HIADHN COc1ccc(CC[C@@H]2CCCCN2Cc2cnc(N3CCCC3)nc2)cc1OC ZINC000535083420 932900885 /nfs/dbraw/zinc/90/08/85/932900885.db2.gz AHWPKMPYDLXNBN-NRFANRHFSA-N 0 3 410.562 4.081 20 0 HIADHN COc1ccc(CC[C@H]2CCCCN2Cc2cnc(N3CCCC3)nc2)cc1OC ZINC000535083442 932901500 /nfs/dbraw/zinc/90/15/00/932901500.db2.gz AHWPKMPYDLXNBN-OAQYLSRUSA-N 0 3 410.562 4.081 20 0 HIADHN COc1ccc(C(=O)NC[C@@H]2CCCN2Cc2ccccc2)cc1-c1ccccn1 ZINC000535098738 932914769 /nfs/dbraw/zinc/91/47/69/932914769.db2.gz FULFCWABCZEOQC-NRFANRHFSA-N 0 3 401.510 4.152 20 0 HIADHN CC[C@@H](NCc1ccc(OC)c(OC)c1Cl)[C@@H](c1ccc(C)cc1)n1cncn1 ZINC000535185806 933001736 /nfs/dbraw/zinc/00/17/36/933001736.db2.gz MNBQVXIERAFDIF-WIYYLYMNSA-N 0 3 414.937 4.415 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N(C)[C@H]1CCSC1)c1ccc(C(F)(F)F)cc1 ZINC000535219174 933023448 /nfs/dbraw/zinc/02/34/48/933023448.db2.gz IIZDSYGGYKGEKZ-DLBZAZTESA-N 0 3 403.514 4.235 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)c3ccccc3CCC(F)(F)F)CC2)C[C@@H](C)O1 ZINC000535340576 933081804 /nfs/dbraw/zinc/08/18/04/933081804.db2.gz PEUSHXUTRVGEOS-IAGOWNOFSA-N 0 3 412.496 4.143 20 0 HIADHN CC(C)Cn1ncc(C(=O)NC[C@@H]2CCCN(C)[C@@H]2c2cccs2)c1C(F)F ZINC000535388212 933108593 /nfs/dbraw/zinc/10/85/93/933108593.db2.gz LLOKFOKFECLTIH-YOEHRIQHSA-N 0 3 410.534 4.351 20 0 HIADHN C[C@@H]1CCN(C(=O)[C@H](OC2CCOCC2)c2ccccc2)CCN1Cc1ccccc1 ZINC000535405676 933120066 /nfs/dbraw/zinc/12/00/66/933120066.db2.gz DWEKUCPCQTVTFM-PXDATVDWSA-N 0 3 422.569 4.046 20 0 HIADHN CCOc1ccc(F)c(NC(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)c1F ZINC000535493968 933181600 /nfs/dbraw/zinc/18/16/00/933181600.db2.gz CUPQGBBDANPCSN-INIZCTEOSA-N 0 3 403.473 4.492 20 0 HIADHN CN(C)CCN(Cc1cccc(O)c1)C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F ZINC000535640209 933280681 /nfs/dbraw/zinc/28/06/81/933280681.db2.gz SEYVJDPJXJJCSK-RBUKOAKNSA-N 0 3 406.448 4.105 20 0 HIADHN Cc1ccc2[nH]c([C@@H]3CCCN([C@@H](C)C(=O)N(C)Cc4cccc(F)c4)C3)nc2c1 ZINC000535666581 933312493 /nfs/dbraw/zinc/31/24/93/933312493.db2.gz VVWBNTIGKLLOBB-PKOBYXMFSA-N 0 3 408.521 4.237 20 0 HIADHN Cc1ccc2nc([C@@H]3CCCN([C@@H](C)C(=O)N(C)Cc4cccc(F)c4)C3)[nH]c2c1 ZINC000535666581 933312506 /nfs/dbraw/zinc/31/25/06/933312506.db2.gz VVWBNTIGKLLOBB-PKOBYXMFSA-N 0 3 408.521 4.237 20 0 HIADHN CC[C@@H](C)n1ncc(NC(=O)N(C)C2CCN(CCc3ccccn3)CC2)c1C1CC1 ZINC000535698169 933351939 /nfs/dbraw/zinc/35/19/39/933351939.db2.gz DHFJMXOHRLQLBI-GOSISDBHSA-N 0 3 424.593 4.297 20 0 HIADHN O=C(NCC(F)(F)F)C1CCN(Cc2ccc(-c3ccc(Cl)cc3)o2)CC1 ZINC000535795414 933392710 /nfs/dbraw/zinc/39/27/10/933392710.db2.gz APHAOHJLXWQBJW-UHFFFAOYSA-N 0 3 400.828 4.491 20 0 HIADHN O=C(Nc1cccc(CN2CCC(Cn3ccnn3)CC2)c1)c1ccccc1Cl ZINC000535812838 933408590 /nfs/dbraw/zinc/40/85/90/933408590.db2.gz QKYHMWKAEXFGJQ-UHFFFAOYSA-N 0 3 409.921 4.096 20 0 HIADHN Cc1ccc(C(=O)NC2CCN(Cc3ccc(OC[C@H]4CCCO4)cc3)CC2)s1 ZINC000535818166 933411759 /nfs/dbraw/zinc/41/17/59/933411759.db2.gz SSILREOPQYWWOY-OAQYLSRUSA-N 0 3 414.571 4.009 20 0 HIADHN CC(C)[C@H](Oc1cccc(Cl)c1)C(=O)NC1CCN([C@H](C)c2ccncc2)CC1 ZINC000535836749 933423514 /nfs/dbraw/zinc/42/35/14/933423514.db2.gz SVFIUXKPNFYNFG-VGSWGCGISA-N 0 3 415.965 4.480 20 0 HIADHN CCN1CCN(c2ccccc2NCc2ccccc2OCc2ccncc2)CC1 ZINC000535845339 933427509 /nfs/dbraw/zinc/42/75/09/933427509.db2.gz VRZNXNZOYOKZNA-UHFFFAOYSA-N 0 3 402.542 4.415 20 0 HIADHN CC(C)[C@H](C(=O)Nc1ccc(C(=O)NCCN2CCCC2)cc1)c1ccc(F)cc1 ZINC000535916182 933490161 /nfs/dbraw/zinc/49/01/61/933490161.db2.gz SYOSKUGONXPYOD-QFIPXVFZSA-N 0 3 411.521 4.030 20 0 HIADHN FC(F)(F)c1ccc(CN2CC[C@H](NCc3cnc([C@H]4CCCO4)s3)C2)cc1 ZINC000535944719 933511220 /nfs/dbraw/zinc/51/12/20/933511220.db2.gz VPTJOKHCQQXCGT-FUHWJXTLSA-N 0 3 411.493 4.378 20 0 HIADHN CN(C)[C@@H](CNC(=O)Nc1cccc(C[S@@](=O)C(C)(C)C)c1)Cc1ccccc1 ZINC000536016977 933573177 /nfs/dbraw/zinc/57/31/77/933573177.db2.gz GNRPYKHUIKNWDA-ONOMSOESSA-N 0 3 415.603 4.028 20 0 HIADHN CN1CCC[C@H](CNC(=O)c2ccn(-c3ccc(Cl)cc3)n2)[C@H]1c1cccs1 ZINC000536046583 933592991 /nfs/dbraw/zinc/59/29/91/933592991.db2.gz XEPPUWJNQXWXOE-QRWLVFNGSA-N 0 3 414.962 4.400 20 0 HIADHN C[C@H](N[C@H](c1ccc2c(c1)OCCO2)C1CC1)C(=O)N1CCC[C@@H]1c1cccs1 ZINC000537289812 933700020 /nfs/dbraw/zinc/70/00/20/933700020.db2.gz JPVJNMTWSLGOSN-REDKUUPNSA-N 0 3 412.555 4.312 20 0 HIADHN C[C@H](NCc1ccc([C@]2(C)NC(=O)NC2=O)cc1)c1cc2c(ccc3ccccc23)o1 ZINC000537293357 933701212 /nfs/dbraw/zinc/70/12/12/933701212.db2.gz ODJSTPXBBPPVQI-MQNRADLISA-N 0 3 413.477 4.491 20 0 HIADHN Cc1cc(C(=O)N(Cc2ccco2)C2CCN(C)CC2)nn1-c1ccccc1Cl ZINC000537349890 933730525 /nfs/dbraw/zinc/73/05/25/933730525.db2.gz TUFLIFOAENTVCT-UHFFFAOYSA-N 0 3 412.921 4.164 20 0 HIADHN C[C@H](NCCOCc1ccc(Cl)cc1Cl)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000537356207 933733134 /nfs/dbraw/zinc/73/31/34/933733134.db2.gz FCXURADTFLZWAM-LBPRGKRZSA-N 0 3 420.333 4.403 20 0 HIADHN CCN1CCN(Cc2ccc(N[C@H](C)c3nnn(-c4ccc(F)cc4)c3C)cc2)CC1 ZINC000537436782 933775916 /nfs/dbraw/zinc/77/59/16/933775916.db2.gz IJRSDSJJPGBBGE-GOSISDBHSA-N 0 3 422.552 4.025 20 0 HIADHN CSc1ccc([C@H](CNC(=O)Cc2ccc(Br)cc2)N(C)C)cc1 ZINC000562890550 945140837 /nfs/dbraw/zinc/14/08/37/945140837.db2.gz XMRJWLCSQJSBHM-SFHVURJKSA-N 0 3 407.377 4.133 20 0 HIADHN CC(C)N1CC[C@@H](NC(=O)c2cccc(CN(C)C)c2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000537521197 938315309 /nfs/dbraw/zinc/31/53/09/938315309.db2.gz MSKKWWKDDAWXJF-YADHBBJMSA-N 0 3 417.956 4.495 20 0 HIADHN CC(C)N1CC[C@@H](NC(=O)c2cccc(CN(C)C)c2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000537521195 938315404 /nfs/dbraw/zinc/31/54/04/938315404.db2.gz MSKKWWKDDAWXJF-FGZHOGPDSA-N 0 3 417.956 4.495 20 0 HIADHN COc1cc(CN2CCCC[C@H]2CCc2ccccc2)cc(Cl)c1OCC(N)=O ZINC000537627954 938339060 /nfs/dbraw/zinc/33/90/60/938339060.db2.gz UXVJUAVUQLGDBR-IBGZPJMESA-N 0 3 416.949 4.200 20 0 HIADHN CCn1c2ccccc2c2cc(CN3CCC(N(C)S(=O)(=O)CC)CC3)ccc21 ZINC000537627867 938339298 /nfs/dbraw/zinc/33/92/98/938339298.db2.gz NCAXTYPCHLLOII-UHFFFAOYSA-N 0 3 413.587 4.060 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(C)c1CN1CCC[C@@H](CNC(=O)C(C)(C)C)C1 ZINC000537629524 938340536 /nfs/dbraw/zinc/34/05/36/938340536.db2.gz LJLLZMADAQXEIY-SFHVURJKSA-N 0 3 400.542 4.003 20 0 HIADHN COc1cc(CN2CCCC[C@@H]2CN2CCOCC2)ccc1OCc1cccs1 ZINC000537636787 938342344 /nfs/dbraw/zinc/34/23/44/938342344.db2.gz VTFNHWWAQDBFGE-HXUWFJFHSA-N 0 3 416.587 4.022 20 0 HIADHN CN(C)C(=O)COc1ccccc1CN1CCC[C@@H](COc2ccccc2Cl)C1 ZINC000537661498 938348850 /nfs/dbraw/zinc/34/88/50/938348850.db2.gz SBUFQDUMWNQGNK-GOSISDBHSA-N 0 3 416.949 4.098 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NC1CCC(C(=O)OC(C)(C)C)CC1)c1ccsc1 ZINC000537673138 938350927 /nfs/dbraw/zinc/35/09/27/938350927.db2.gz CPLBEAZWUKQVBO-KVZIAJEVSA-N 0 3 423.623 4.331 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)NC1CCC(C(=O)OC(C)(C)C)CC1 ZINC000537706522 938360511 /nfs/dbraw/zinc/36/05/11/938360511.db2.gz QNSSYOJNZQDDNN-UHFFFAOYSA-N 0 3 400.519 4.125 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)[C@H]2C[C@H]2c2c(F)cccc2F)cc1 ZINC000537731498 938365251 /nfs/dbraw/zinc/36/52/51/938365251.db2.gz UQTYWHKUDXZTCL-LQWHRVPQSA-N 0 3 400.469 4.030 20 0 HIADHN Cc1ccc(Cl)cc1NC(=O)C[C@H](C)N[C@@H]1CC(=O)N(c2c(F)cccc2F)C1 ZINC000537765757 938372580 /nfs/dbraw/zinc/37/25/80/938372580.db2.gz STUCYHHLEFGVHO-DZGCQCFKSA-N 0 3 421.875 4.039 20 0 HIADHN COCCc1nc(C)c([C@@H](C)N[C@H](C)c2ccc(NC(=O)NC3CC3)cc2)s1 ZINC000537765372 938372711 /nfs/dbraw/zinc/37/27/11/938372711.db2.gz OIAAIQCDMWAAGN-ZIAGYGMSSA-N 0 3 402.564 4.336 20 0 HIADHN CC(C)CN(C(=O)c1cc(OCC(F)(F)F)c2ccccc2n1)C1CCN(C)CC1 ZINC000537897684 938403977 /nfs/dbraw/zinc/40/39/77/938403977.db2.gz ZPNZHUHHBBSDKP-UHFFFAOYSA-N 0 3 423.479 4.368 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1ccnc(OC2CCCCC2)c1 ZINC000537932181 938419660 /nfs/dbraw/zinc/41/96/60/938419660.db2.gz XIYVPMYCWPBSCF-UHFFFAOYSA-N 0 3 423.557 4.250 20 0 HIADHN CC1CCN(S(=O)(=O)Cc2ccccc2CN[C@H]2CCc3c2cccc3F)CC1 ZINC000537950175 938429378 /nfs/dbraw/zinc/42/93/78/938429378.db2.gz LHPYGZIJPQZYJK-QHCPKHFHSA-N 0 3 416.562 4.165 20 0 HIADHN CSc1ccc([C@@H](C)NC[C@@H](O)COc2ccccc2Br)cc1F ZINC000537955075 938431548 /nfs/dbraw/zinc/43/15/48/938431548.db2.gz GDFYWTBLQFMORV-TZMCWYRMSA-N 0 3 414.340 4.401 20 0 HIADHN Cc1c([C@H](C)NCCC[C@H]2CCCC[C@H]2O)nnn1-c1cccc(Br)c1 ZINC000537957925 938433189 /nfs/dbraw/zinc/43/31/89/938433189.db2.gz YYWWSTXTLILCHW-ZSZQSSIHSA-N 0 3 421.383 4.320 20 0 HIADHN CS(=O)(=O)Nc1cccc(CN[C@@H]2CCCc3nc(-c4ccccc4)sc32)c1 ZINC000537965503 938438170 /nfs/dbraw/zinc/43/81/70/938438170.db2.gz ORYJRVRPBOHGPY-GOSISDBHSA-N 0 3 413.568 4.349 20 0 HIADHN C[C@@H](N[C@H]1CCc2c1cccc2Br)c1cccc(NS(C)(=O)=O)c1 ZINC000537976008 938444196 /nfs/dbraw/zinc/44/41/96/938444196.db2.gz JDQXYFNKPMGQAS-XIKOKIGWSA-N 0 3 409.349 4.159 20 0 HIADHN O=C1[C@@H](N[C@H]2CCCc3nc(-c4ccc(F)cc4)sc32)CCN1CC(F)(F)F ZINC000537978016 938445460 /nfs/dbraw/zinc/44/54/60/938445460.db2.gz DIUODQSWBWBMHX-ZFWWWQNUSA-N 0 3 413.440 4.079 20 0 HIADHN O[C@@H](CN[C@H](Cc1ccccc1F)c1ccccc1Br)C1CCOCC1 ZINC000537985602 938448947 /nfs/dbraw/zinc/44/89/47/938448947.db2.gz BGTWGYRNSRVTKU-RTWAWAEBSA-N 0 3 422.338 4.249 20 0 HIADHN C[C@H]1C[C@H](NCc2ccc(S(=O)(=O)N(C)C)cc2)c2cccc(Br)c21 ZINC000537987848 938449693 /nfs/dbraw/zinc/44/96/93/938449693.db2.gz QVVWETPZHGZRBA-UGSOOPFHSA-N 0 3 423.376 4.038 20 0 HIADHN CC[C@@H](N[C@H](C)c1ccc(S(=O)(=O)N(C)C)cc1)c1ccc(OC(F)F)cc1 ZINC000537991277 938452090 /nfs/dbraw/zinc/45/20/90/938452090.db2.gz QSBLUVUJDQCJMC-AUUYWEPGSA-N 0 3 412.502 4.340 20 0 HIADHN C[C@@H](NCc1ccccc1OCC(=O)NC[C@@H]1CCCO1)c1ccc2c(c1)CCCC2 ZINC000537991855 938452970 /nfs/dbraw/zinc/45/29/70/938452970.db2.gz TWUIYPUTDHAKRY-DVECYGJZSA-N 0 3 422.569 4.090 20 0 HIADHN C[C@H](NCc1ccccc1OCC(=O)NC[C@H]1CCCO1)c1ccc2c(c1)CCCC2 ZINC000537991868 938453325 /nfs/dbraw/zinc/45/33/25/938453325.db2.gz TWUIYPUTDHAKRY-YADARESESA-N 0 3 422.569 4.090 20 0 HIADHN CCCCn1cc(CNC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)c(C)n1 ZINC000537998004 938456882 /nfs/dbraw/zinc/45/68/82/938456882.db2.gz MSBJADQDOMTVGY-NRFANRHFSA-N 0 3 422.495 4.062 20 0 HIADHN Clc1ccc(N2CC[C@@H](NCc3cn4ccc(Br)cc4n3)C2)cc1 ZINC000563316844 945177394 /nfs/dbraw/zinc/17/73/94/945177394.db2.gz XHBVMAJGQUWDEA-OAHLLOKOSA-N 0 3 405.727 4.119 20 0 HIADHN CN1CCC[C@@H](CNC(=O)c2cnc(Oc3ccccc3)cn2)[C@@H]1c1cccs1 ZINC000538036002 938476080 /nfs/dbraw/zinc/47/60/80/938476080.db2.gz WJWXNMDYMUHWEF-HRAATJIYSA-N 0 3 408.527 4.143 20 0 HIADHN C[C@H](NC[C@@H](c1ccc(F)cc1)N1CCOCC1)c1nc2ccc(Cl)cc2n1C ZINC000538061175 938491221 /nfs/dbraw/zinc/49/12/21/938491221.db2.gz DYGRBKOOCRBHNN-BTYIYWSLSA-N 0 3 416.928 4.090 20 0 HIADHN CCN1CCCN(C(=O)Nc2ccc(NC(=O)c3ccoc3)cc2C(F)(F)F)CC1 ZINC000538082783 938498232 /nfs/dbraw/zinc/49/82/32/938498232.db2.gz VTDKWNPGCJYMQZ-UHFFFAOYSA-N 0 3 424.423 4.110 20 0 HIADHN C[C@@H](NCCSCc1cccc2ccccc21)c1cccc(S(N)(=O)=O)c1 ZINC000538100029 938502108 /nfs/dbraw/zinc/50/21/08/938502108.db2.gz KCMOQPQNEJBATG-MRXNPFEDSA-N 0 3 400.569 4.071 20 0 HIADHN Cc1c(Br)cccc1CN[C@@H](C)c1ccc(OCC(=O)NC2CC2)cc1 ZINC000538123123 938509876 /nfs/dbraw/zinc/50/98/76/938509876.db2.gz FKBNDJUHFCQRDM-HNNXBMFYSA-N 0 3 417.347 4.266 20 0 HIADHN CC[C@@H](NCC(=O)N1CCC[C@@H]1c1ccc(OC)c(OC)c1)c1ccc(OC)cc1 ZINC000538141369 938517686 /nfs/dbraw/zinc/51/76/86/938517686.db2.gz NGYLUNFYCZGCTQ-NHCUHLMSSA-N 0 3 412.530 4.117 20 0 HIADHN COc1cc([C@@H](C)NCC[S@](=O)c2ccccc2)ccc1OCc1ccncc1 ZINC000538154270 938525255 /nfs/dbraw/zinc/52/52/55/938525255.db2.gz BKSCPIPEYCAFIF-LBEKAKSKSA-N 0 3 410.539 4.128 20 0 HIADHN COc1ccc(C[C@H](NCC(=O)N[C@H](C)c2ccccc2)c2ccccc2)cc1OC ZINC000538159514 938529325 /nfs/dbraw/zinc/52/93/25/938529325.db2.gz IFYBSYDYNYXLSP-XXBNENTESA-N 0 3 418.537 4.455 20 0 HIADHN C[C@@H](N[C@H](C)c1ccccc1-n1cccn1)C(=O)Nc1ccc(OC(F)(F)F)cc1 ZINC000538160472 938529544 /nfs/dbraw/zinc/52/95/44/938529544.db2.gz ZRDHYEZKYSQSIS-HUUCEWRRSA-N 0 3 418.419 4.449 20 0 HIADHN C[C@@H](NCC(=O)N1CCC(Cc2ccccc2)CC1)c1ccccc1-n1cccn1 ZINC000538160450 938529754 /nfs/dbraw/zinc/52/97/54/938529754.db2.gz YIAJOBQTXDDNQY-HXUWFJFHSA-N 0 3 402.542 4.004 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(OCC(F)(F)F)cc1)C(=O)Nc1ccc2c(c1)OCCO2 ZINC000538163690 938530866 /nfs/dbraw/zinc/53/08/66/938530866.db2.gz QLRSRGLYFFSOPY-ZIAGYGMSSA-N 0 3 424.419 4.077 20 0 HIADHN COc1ccc([C@H](Cc2ccccc2C)NCC(=O)N2CCC[C@H](C)C2)cc1OC ZINC000538174897 938535643 /nfs/dbraw/zinc/53/56/43/938535643.db2.gz HRHUCNVKAIXUTG-AVRDEDQJSA-N 0 3 410.558 4.144 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)N[C@@H]1CCCC[C@@H]1C)c1ccc(NC(=O)c2ccncc2)cc1 ZINC000538191688 938547450 /nfs/dbraw/zinc/54/74/50/938547450.db2.gz WNUMVLLZVSSRKC-RQXXJAGISA-N 0 3 408.546 4.068 20 0 HIADHN Cc1cc(NC(=O)CN[C@H](c2ccccc2)[C@@H]2CCOC2)ccc1Br ZINC000538197055 938550359 /nfs/dbraw/zinc/55/03/59/938550359.db2.gz KGQSFCROURLSJY-OXQOHEQNSA-N 0 3 403.320 4.063 20 0 HIADHN Cc1n[nH]c(C)c1[C@H]1CCCN1C(=O)N[C@H](CN1CCc2ccccc2C1)C(C)(C)C ZINC000538215531 938559139 /nfs/dbraw/zinc/55/91/39/938559139.db2.gz YUGDNBKQPCWPLQ-FGZHOGPDSA-N 0 3 423.605 4.346 20 0 HIADHN CC(C)[C@@H](NCc1cccc(S(=O)(=O)N(C)C)c1)c1ccc(C(F)(F)F)cc1 ZINC000538226327 938564858 /nfs/dbraw/zinc/56/48/58/938564858.db2.gz NRRYTDSIDGVVDA-LJQANCHMSA-N 0 3 414.493 4.443 20 0 HIADHN C[C@@H](NCC(=O)N[C@H](C)c1ccc(Cl)cc1Cl)c1ccc(-n2ccnn2)cc1 ZINC000538233615 938568073 /nfs/dbraw/zinc/56/80/73/938568073.db2.gz UXJDDDTVABRHJY-ZIAGYGMSSA-N 0 3 418.328 4.102 20 0 HIADHN C[C@H](CCCc1ccccc1)C(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000538287820 938583596 /nfs/dbraw/zinc/58/35/96/938583596.db2.gz ROQVJVBZGNXHIH-YPAWHYETSA-N 0 3 400.607 4.383 20 0 HIADHN CSc1ccc(C)c(NC(=O)NCCCN2CCN(C)C[C@H]2c2ccccc2)c1 ZINC000538325403 938593585 /nfs/dbraw/zinc/59/35/85/938593585.db2.gz XBEHOJTYQFYUSY-QFIPXVFZSA-N 0 3 412.603 4.217 20 0 HIADHN CN(CC[C@H]1CCCCN1C)C(=O)Nc1ccc(Cl)cc1C(=O)c1ccc[nH]1 ZINC000538352280 938601364 /nfs/dbraw/zinc/60/13/64/938601364.db2.gz UZRWRRQJBCHRDQ-MRXNPFEDSA-N 0 3 402.926 4.237 20 0 HIADHN COc1ccc([C@H](N[C@@H](C)C(=O)N(C)Cc2nc3ccccc3s2)C2CC2)cc1 ZINC000538389275 938609004 /nfs/dbraw/zinc/60/90/04/938609004.db2.gz CYVDGLHJHLPKSK-OYHNWAKOSA-N 0 3 409.555 4.393 20 0 HIADHN CC[C@H]1c2ccsc2CCN1C(=O)CN[C@H](c1ccc2c(c1)OCCO2)C1CC1 ZINC000538390183 938609083 /nfs/dbraw/zinc/60/90/83/938609083.db2.gz ODKNVKGCCBJTOP-MBSDFSHPSA-N 0 3 412.555 4.096 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)CN[C@H](c2ccccc2C)C2CC2)cc1OC ZINC000538392726 938609525 /nfs/dbraw/zinc/60/95/25/938609525.db2.gz KGMLXIFFLSZQCC-OFVILXPXSA-N 0 3 408.542 4.417 20 0 HIADHN C[C@@H](N[C@H](c1ccc2c(c1)OCCO2)C1CC1)C(=O)N1CCSc2ccccc21 ZINC000538390643 938609593 /nfs/dbraw/zinc/60/95/93/938609593.db2.gz WGHRUVBFCUMXJZ-QRQCRPRQSA-N 0 3 410.539 4.026 20 0 HIADHN COc1ccc(CNC2(c3ccccc3)CCOCC2)cc1OCc1cccnc1 ZINC000538399375 938611399 /nfs/dbraw/zinc/61/13/99/938611399.db2.gz UNNQBFNSYPQLEM-UHFFFAOYSA-N 0 3 404.510 4.465 20 0 HIADHN C[C@@H](NCCOCc1ccc(Cl)cc1Cl)c1ccc(S(C)(=O)=O)cc1 ZINC000538456344 938626199 /nfs/dbraw/zinc/62/61/99/938626199.db2.gz RFGQBBCQQVXMOI-CYBMUJFWSA-N 0 3 402.343 4.264 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)c1ccc(Br)cc1C(F)(F)F ZINC000538458775 938627039 /nfs/dbraw/zinc/62/70/39/938627039.db2.gz OOCWHOHATBILBD-UHFFFAOYSA-N 0 3 419.241 4.265 20 0 HIADHN COc1cc(OC)c(CNC[C@H]2CCN(C)[C@@H]2c2ccc(Cl)c(F)c2)c(OC)c1 ZINC000538463706 938627936 /nfs/dbraw/zinc/62/79/36/938627936.db2.gz FHBMBULTCGJDPP-IVZQSRNASA-N 0 3 422.928 4.288 20 0 HIADHN CCN1CCN(c2ccc(N[C@@H](C)c3ccc(OC)c(NC(C)=O)c3)c(C)c2)CC1 ZINC000538508407 938638131 /nfs/dbraw/zinc/63/81/31/938638131.db2.gz LGBPQMMPAPZBFB-SFHVURJKSA-N 0 3 410.562 4.277 20 0 HIADHN C[C@@H](N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1)c1ccc2c(c1)OCCO2 ZINC000538552935 938647683 /nfs/dbraw/zinc/64/76/83/938647683.db2.gz ZRPQYKIIDAKTRL-AUSIDOKSSA-N 0 3 416.521 4.036 20 0 HIADHN Cc1nc2c(s1)[C@@H](N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1)CCC2 ZINC000538554267 938647693 /nfs/dbraw/zinc/64/76/93/938647693.db2.gz QXLVMNIIINBMGL-FCHUYYIVSA-N 0 3 405.567 4.346 20 0 HIADHN COc1ccc([C@H](C)N[C@@H](Cc2ccccc2)C(=O)NCc2ccccc2)cc1OC ZINC000538553337 938647795 /nfs/dbraw/zinc/64/77/95/938647795.db2.gz DEMRTPDYVCIAGS-CVDCTZTESA-N 0 3 418.537 4.282 20 0 HIADHN Cc1ccc(C)c(NC(=O)Cc2nc(CN3CCC[C@H]3C3CCOCC3)cs2)c1 ZINC000538627293 938666388 /nfs/dbraw/zinc/66/63/88/938666388.db2.gz KAQCLYAKKVYWFP-NRFANRHFSA-N 0 3 413.587 4.332 20 0 HIADHN COc1ccc([C@@H](C)Nc2ccc3c(c2)C(=O)N(C)CC3)cc1CN1CCCCC1 ZINC000538640493 938670272 /nfs/dbraw/zinc/67/02/72/938670272.db2.gz OLDACTKURDBNPB-GOSISDBHSA-N 0 3 407.558 4.482 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)N[C@@H]2CCCOc3cc(F)ccc32)CC1 ZINC000538666931 938680527 /nfs/dbraw/zinc/68/05/27/938680527.db2.gz DCMIQRAUSFYIBK-JOCHJYFZSA-N 0 3 411.521 4.345 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)N[C@H]2CCCOc3cc(F)ccc32)CC1 ZINC000538666934 938680707 /nfs/dbraw/zinc/68/07/07/938680707.db2.gz DCMIQRAUSFYIBK-QFIPXVFZSA-N 0 3 411.521 4.345 20 0 HIADHN COCCOc1cc2c(cc1CN1CC[C@H](CSc3ccccc3)C1)OCO2 ZINC000538721019 938690572 /nfs/dbraw/zinc/69/05/72/938690572.db2.gz KIWSTBWAWKWNLH-KRWDZBQOSA-N 0 3 401.528 4.055 20 0 HIADHN C[C@H]1Oc2ccc(C(=O)C3CCN(Cc4ccnc5ccccc45)CC3)cc2NC1=O ZINC000538739714 938698330 /nfs/dbraw/zinc/69/83/30/938698330.db2.gz SGXUEAOGJWYAAM-MRXNPFEDSA-N 0 3 415.493 4.049 20 0 HIADHN COC[C@@H](NC(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1)c1ccccc1 ZINC000538828499 938721171 /nfs/dbraw/zinc/72/11/71/938721171.db2.gz JDEFEGXTYBYVLU-HXUWFJFHSA-N 0 3 423.479 4.166 20 0 HIADHN CS(=O)(=O)Cc1ccc(CN[C@@H]2CCCc3ccc(Br)cc32)cc1 ZINC000538867821 938728431 /nfs/dbraw/zinc/72/84/31/938728431.db2.gz SZINEGJVBJFMFR-LJQANCHMSA-N 0 3 408.361 4.161 20 0 HIADHN Cc1ccc(NC(=O)[C@H](N[C@H]2CCO[C@@]3(CCOC3)C2)c2ccccc2)cc1Cl ZINC000538877077 938729772 /nfs/dbraw/zinc/72/97/72/938729772.db2.gz JRYLRSVTEATFRB-WPYKKVEZSA-N 0 3 414.933 4.256 20 0 HIADHN COc1ccc(CN(CC(=O)Nc2c(C)n[nH]c2C)[C@@H]2CCCC[C@@H]2C)cc1OC ZINC000538955473 938748502 /nfs/dbraw/zinc/74/85/02/938748502.db2.gz HEOQVIJRVNWNOQ-HNAYVOBHSA-N 0 3 414.550 4.063 20 0 HIADHN FC(F)(F)c1ccc(O[C@H]2CCN(CCCc3nc(-c4ccccc4)no3)C2)nc1 ZINC000538959177 938750420 /nfs/dbraw/zinc/75/04/20/938750420.db2.gz OASHBTHONBEOFY-KRWDZBQOSA-N 0 3 418.419 4.236 20 0 HIADHN C[C@@H](NCCCNC(=O)c1ccc(Br)cc1)c1nc2c(s1)CCCC2 ZINC000538983561 938759389 /nfs/dbraw/zinc/75/93/89/938759389.db2.gz DCCYDVGYXXVYRX-CYBMUJFWSA-N 0 3 422.392 4.255 20 0 HIADHN C[C@@H](N[C@@H](C)Cn1ncc2ccccc2c1=O)c1ccc(F)c(Br)c1 ZINC000539044231 938780523 /nfs/dbraw/zinc/78/05/23/938780523.db2.gz VVRVXEOCMBWXHN-QWHCGFSZSA-N 0 3 404.283 4.037 20 0 HIADHN C[C@H](N[C@H]1CC(=O)N(C)[C@@H]1c1ccc(Cl)cc1)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000539049415 938782337 /nfs/dbraw/zinc/78/23/37/938782337.db2.gz QLGZXMVIPCRYAC-JBZDTAIVSA-N 0 3 411.933 4.192 20 0 HIADHN C[C@@H](NCCOc1ccc(C(F)(F)F)cn1)c1ccc(-n2cncn2)cc1Cl ZINC000539061084 938788013 /nfs/dbraw/zinc/78/80/13/938788013.db2.gz YKYXALZAYUMKJH-GFCCVEGCSA-N 0 3 411.815 4.064 20 0 HIADHN Cc1ccc2c(c1)OCCC[C@H]2NC[C@H](O)COc1ccccc1Br ZINC000539064413 938789832 /nfs/dbraw/zinc/78/98/32/938789832.db2.gz APWIRTJNSTTXTB-MAUKXSAKSA-N 0 3 406.320 4.001 20 0 HIADHN COc1cc(OC)c([C@H](C)NC[C@H](c2ccc(OC)c(OC)c2)N(C)C)cc1Cl ZINC000539072233 938793765 /nfs/dbraw/zinc/79/37/65/938793765.db2.gz OOHYPFJWBAQWNM-KBXCAEBGSA-N 0 3 422.953 4.328 20 0 HIADHN COc1ccc([C@@H](C)NCCc2nc(-c3cccc(Cl)c3)no2)cc1NC(C)=O ZINC000539083065 938798938 /nfs/dbraw/zinc/79/89/38/938798938.db2.gz LRYCVLXSLYLVOA-CYBMUJFWSA-N 0 3 414.893 4.250 20 0 HIADHN Clc1cc(Br)cc2c1CC[C@@H]2NCc1ccc(-n2cncn2)cc1 ZINC000539087184 938800148 /nfs/dbraw/zinc/80/01/48/938800148.db2.gz FKBONXOABQBSQH-SFHVURJKSA-N 0 3 403.711 4.460 20 0 HIADHN O=C1c2ccccc2C(=O)N1[C@@H]1CCCC[C@@H](NCc2coc(-c3ccccc3)n2)C1 ZINC000539087083 938800152 /nfs/dbraw/zinc/80/01/52/938800152.db2.gz QWJMJFIZFCGKAI-UYAOXDASSA-N 0 3 415.493 4.429 20 0 HIADHN C[C@@H](CC(=O)N1CCCCCC1)N[C@@H](Cc1ccccc1)C(=O)N(C)c1ccccc1 ZINC000539089172 938800529 /nfs/dbraw/zinc/80/05/29/938800529.db2.gz MUEWPBYZFPOBEI-URXFXBBRSA-N 0 3 421.585 4.032 20 0 HIADHN C[C@H](N[C@@H](C)c1cccc(-c2ccncc2)c1)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000539090775 938801044 /nfs/dbraw/zinc/80/10/44/938801044.db2.gz BUPDDAVWHNHTTI-ROUUACIJSA-N 0 3 409.555 4.411 20 0 HIADHN CCN1CCN([C@@H](C)CNC(=O)c2ccc(Sc3ccc(Cl)cc3)cc2)CC1 ZINC000539119612 938805444 /nfs/dbraw/zinc/80/54/44/938805444.db2.gz GFZHMYDERQXKRK-KRWDZBQOSA-N 0 3 418.006 4.247 20 0 HIADHN CCN1CCCN(C(=O)Nc2ccc(Oc3cccc(C(F)(F)F)n3)cc2)CC1 ZINC000539150210 938811531 /nfs/dbraw/zinc/81/15/31/938811531.db2.gz RJDFSCTVSZGSFW-UHFFFAOYSA-N 0 3 408.424 4.452 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Nc1ccc(F)cc1OCC(F)F ZINC000539152734 938812236 /nfs/dbraw/zinc/81/22/36/938812236.db2.gz MJLFHLHZMGTTEJ-UHFFFAOYSA-N 0 3 401.454 4.127 20 0 HIADHN C[C@H](N[C@H]1CCO[C@@H]1c1ccc(Cl)c(F)c1)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000539195556 938817925 /nfs/dbraw/zinc/81/79/25/938817925.db2.gz BFBZZNJSRGPWHH-WOVYWWTOSA-N 0 3 415.889 4.203 20 0 HIADHN CC(C)[C@@H](NCc1ccccc1CS(=O)(=O)N1CCC(C)CC1)c1cccnc1 ZINC000539214836 938819861 /nfs/dbraw/zinc/81/98/61/938819861.db2.gz WSSVGQYLGHTCTA-HSZRJFAPSA-N 0 3 415.603 4.130 20 0 HIADHN CN(CCN[C@@H](CN1CCCC1=O)c1cccc(C(F)(F)F)c1)c1ccccc1 ZINC000539223306 938821099 /nfs/dbraw/zinc/82/10/99/938821099.db2.gz YPDDUMOCHJEFBA-FQEVSTJZSA-N 0 3 405.464 4.095 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(OCc2cccnc2)cc1)C(=O)N1CCc2sccc2C1 ZINC000539226379 938821782 /nfs/dbraw/zinc/82/17/82/938821782.db2.gz NGFGRVCUKNSWOM-QZTJIDSGSA-N 0 3 421.566 4.346 20 0 HIADHN CC[C@H](NCC(=O)N(C)Cc1ccccc1Br)c1ccc(OC)cc1 ZINC000539242966 938824494 /nfs/dbraw/zinc/82/44/94/938824494.db2.gz CYXJULMWBBDHAH-IBGZPJMESA-N 0 3 405.336 4.157 20 0 HIADHN COc1ccc([C@@H](NC2CCN(C(=O)N(C)C)CC2)c2ccccc2Cl)cc1 ZINC000539260370 938828963 /nfs/dbraw/zinc/82/89/63/938828963.db2.gz BFHCDQBZLVJGAS-OAQYLSRUSA-N 0 3 401.938 4.174 20 0 HIADHN COc1ccc([C@@H](Cc2ccc(F)cc2)NCC(=O)N2CCc3sccc3C2)cc1 ZINC000539273865 938831429 /nfs/dbraw/zinc/83/14/29/938831429.db2.gz JJOYRUNLDGGNBF-JOCHJYFZSA-N 0 3 424.541 4.354 20 0 HIADHN C[C@@H](NCC(=O)N(C)[C@@H](C)c1cc2ccccc2o1)c1cccc(-n2cccn2)c1 ZINC000539286543 938833845 /nfs/dbraw/zinc/83/38/45/938833845.db2.gz LZLSVGSYALOEAR-MSOLQXFVSA-N 0 3 402.498 4.489 20 0 HIADHN C[C@@H](NCC(=O)Nc1ccc(OC(F)(F)F)cc1)c1cccc(-n2cccn2)c1 ZINC000539288427 938834190 /nfs/dbraw/zinc/83/41/90/938834190.db2.gz IOJUUZANQXIFQI-CQSZACIVSA-N 0 3 404.392 4.060 20 0 HIADHN COc1ccc(NC(=O)[C@@H](C)N[C@H](C)c2ccc(NC(=O)c3ccncc3)cc2)cc1 ZINC000539299944 938836509 /nfs/dbraw/zinc/83/65/09/938836509.db2.gz OJVJYOXLPRZRHI-IAGOWNOFSA-N 0 3 418.497 4.020 20 0 HIADHN COc1cc(C(C)=O)ccc1OC[C@@H](O)CNC(C)(c1ccccc1)c1ccccc1 ZINC000539307078 938838021 /nfs/dbraw/zinc/83/80/21/938838021.db2.gz OGAGGQIQMJLYJY-QHCPKHFHSA-N 0 3 419.521 4.191 20 0 HIADHN C[C@@H](NC[C@H](O)COc1cccc2ccccc21)c1cccc(N2CCCC2=O)c1 ZINC000539313998 938839509 /nfs/dbraw/zinc/83/95/09/938839509.db2.gz STYJNENOHOIBHS-GCJKJVERSA-N 0 3 404.510 4.057 20 0 HIADHN O[C@H](CN[C@H](COc1ccccc1)c1ccccc1)COc1cccc2[nH]ccc21 ZINC000539320382 938840771 /nfs/dbraw/zinc/84/07/71/938840771.db2.gz RUKYEZOWVQRDPO-HYBUGGRVSA-N 0 3 402.494 4.318 20 0 HIADHN CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H](c2ccccc2F)C2CCCC2)cc1 ZINC000539325816 938841980 /nfs/dbraw/zinc/84/19/80/938841980.db2.gz PISBDRHZHOMXGD-AUSIDOKSSA-N 0 3 400.494 4.045 20 0 HIADHN COc1cc(C(C)=O)ccc1OC[C@H](O)CN[C@@H](c1ccccc1F)C1CCCC1 ZINC000539325708 938842014 /nfs/dbraw/zinc/84/20/14/938842014.db2.gz OXVHYWJECNRAJR-NTKDMRAZSA-N 0 3 415.505 4.298 20 0 HIADHN COc1cc(OC)cc(N2CC[C@H](N[C@@H](C)c3ccc(-c4cccnc4)cc3)C2=O)c1 ZINC000539334727 938843480 /nfs/dbraw/zinc/84/34/80/938843480.db2.gz HKTZHKIXAMMVRM-XDHUDOTRSA-N 0 3 417.509 4.222 20 0 HIADHN COc1cc(OC)cc(N2CC[C@H](N[C@H](C)c3ccc(-c4cccnc4)cc3)C2=O)c1 ZINC000539334726 938843558 /nfs/dbraw/zinc/84/35/58/938843558.db2.gz HKTZHKIXAMMVRM-OSPHWJPCSA-N 0 3 417.509 4.222 20 0 HIADHN O=C(CN[C@@H](C[C@@H]1CCOC1)c1ccccc1)Nc1ccc(OC(F)(F)F)cc1 ZINC000539334871 938843763 /nfs/dbraw/zinc/84/37/63/938843763.db2.gz NPVZPLUJGLHAKJ-KXBFYZLASA-N 0 3 408.420 4.281 20 0 HIADHN C[C@H](NCC(=O)Nc1ccc(OC(F)(F)F)cc1)c1ccc(-n2cccn2)cc1 ZINC000539338897 938844584 /nfs/dbraw/zinc/84/45/84/938844584.db2.gz TWBUXISHFNLPRC-AWEZNQCLSA-N 0 3 404.392 4.060 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)N[C@@H](C)C(=O)Nc2nc3ccccc3s2)cc1 ZINC000539363608 938849076 /nfs/dbraw/zinc/84/90/76/938849076.db2.gz PYIPCZICRSAIQU-GJZGRUSLSA-N 0 3 405.527 4.468 20 0 HIADHN COc1cc(NC(=O)CN[C@H](c2ccc(Cl)cc2)[C@@H]2C[C@H]2C)cc(OC)c1OC ZINC000539421185 938857808 /nfs/dbraw/zinc/85/78/08/938857808.db2.gz DIUSVRVYVQDCPI-QKAVXHIFSA-N 0 3 418.921 4.291 20 0 HIADHN Cc1cc(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2)nn1-c1ccc(C)cc1 ZINC000539424977 938858673 /nfs/dbraw/zinc/85/86/73/938858673.db2.gz QGGPNHDEFUSAPG-UHFFFAOYSA-N 0 3 409.509 4.224 20 0 HIADHN Cc1cccc(C)c1CNCc1ccnc(N2CCN(c3ccc(F)cc3)CC2)c1 ZINC000539427952 938859223 /nfs/dbraw/zinc/85/92/23/938859223.db2.gz CXCXAWGNELRMFP-UHFFFAOYSA-N 0 3 404.533 4.454 20 0 HIADHN C[C@H](c1cc2ccccc2o1)N(C)C(=O)CN[C@@H](c1ccc2c(c1)OCCO2)C1CC1 ZINC000539493272 938868196 /nfs/dbraw/zinc/86/81/96/938868196.db2.gz QRBCSXRVXICCAF-PUAOIOHZSA-N 0 3 420.509 4.464 20 0 HIADHN CCO[C@@H]1C[C@H](N[C@@H](c2ccc(C)cc2)c2cccc(S(C)(=O)=O)c2)C12CCC2 ZINC000539494866 938868576 /nfs/dbraw/zinc/86/85/76/938868576.db2.gz SGLVQCNJTVFBHK-ZRBLBEILSA-N 0 3 413.583 4.425 20 0 HIADHN COc1ccc(-c2ccc(CNCc3c(C)nn(CC(=O)OC(C)C)c3C)cc2)cc1 ZINC000539500338 938869558 /nfs/dbraw/zinc/86/95/58/938869558.db2.gz BZIBMQRDZQQEPF-UHFFFAOYSA-N 0 3 421.541 4.417 20 0 HIADHN CC(C)(C)C[C@@H](NC[C@@H](O)CS(=O)(=O)c1cccs1)c1ccc(Cl)cc1 ZINC000539506851 938870413 /nfs/dbraw/zinc/87/04/13/938870413.db2.gz FONDONQXVAXPNJ-IAGOWNOFSA-N 0 3 416.008 4.303 20 0 HIADHN COc1cc(CN[C@H]2CCN(C(C)=O)c3ccccc32)ccc1OCc1ccncc1 ZINC000539528808 938874048 /nfs/dbraw/zinc/87/40/48/938874048.db2.gz IQTQSRMKJWVVRD-QFIPXVFZSA-N 0 3 417.509 4.257 20 0 HIADHN CC(C)COC1CCN([C@@H]2CCCN(Cc3cccc(C(F)(F)F)c3)C2=O)CC1 ZINC000539589074 938884245 /nfs/dbraw/zinc/88/42/45/938884245.db2.gz YEIFXMKTJAPDTK-HXUWFJFHSA-N 0 3 412.496 4.333 20 0 HIADHN COc1ccc(OC)c(NC(=O)C[C@H](C)NC2(c3ccc(F)cc3F)CCC2)c1 ZINC000539646484 938893367 /nfs/dbraw/zinc/89/33/67/938893367.db2.gz RUPMWPUIGGOZGP-AWEZNQCLSA-N 0 3 404.457 4.368 20 0 HIADHN CCn1c(CSc2ccccc2OC)nnc1N1CCN(CCC(C)(C)C)CC1 ZINC000563552489 945213228 /nfs/dbraw/zinc/21/32/28/945213228.db2.gz SKIRKKKDJOVAQF-UHFFFAOYSA-N 0 3 417.623 4.157 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N(C)Cc2cc(F)c(F)c(F)c2)N2CCCC2)cc1 ZINC000539730665 938915241 /nfs/dbraw/zinc/91/52/41/938915241.db2.gz CZFMOILFWPAOQI-HXUWFJFHSA-N 0 3 405.464 4.391 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](NCC(C2CC2)C2CC2)c2ccc(F)cc2F)c1 ZINC000539812741 938939612 /nfs/dbraw/zinc/93/96/12/938939612.db2.gz IMCQOKIKMPHHRU-JOCHJYFZSA-N 0 3 405.510 4.484 20 0 HIADHN COc1cc(CN2CCC[C@](C)(O)C2)ccc1OCCOc1ccccc1Cl ZINC000539819021 938943185 /nfs/dbraw/zinc/94/31/85/938943185.db2.gz VUMXJXXAQDDCLF-QFIPXVFZSA-N 0 3 405.922 4.153 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)c3cc4ccc(C(F)(F)F)cc4[nH]3)CC2)C[C@H](C)O1 ZINC000539841229 938955143 /nfs/dbraw/zinc/95/51/43/938955143.db2.gz MGWKOPPKDDSFED-GASCZTMLSA-N 0 3 423.479 4.148 20 0 HIADHN CC(C)(C)OC(=O)C1CCC(NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)CC1 ZINC000539908942 938975716 /nfs/dbraw/zinc/97/57/16/938975716.db2.gz YCYZZCSJSHKZFD-OBXNSHGQSA-N 0 3 418.553 4.054 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCC(Cc2cccnc2)CC1)c1ccsc1 ZINC000539949069 938980668 /nfs/dbraw/zinc/98/06/68/938980668.db2.gz QYEWDLYOFSECPF-OAQYLSRUSA-N 0 3 400.592 4.190 20 0 HIADHN Brc1cc(CN[C@H](c2ccccc2)[C@H]2CCOC2)cc2c1OCCO2 ZINC000540067488 939057228 /nfs/dbraw/zinc/05/72/28/939057228.db2.gz CDTRDSASFIWPLX-QFBILLFUSA-N 0 3 404.304 4.088 20 0 HIADHN C[C@@H](NCCCNC(=O)c1cccc(Br)c1)c1nc2c(s1)CCCC2 ZINC000540084036 939063842 /nfs/dbraw/zinc/06/38/42/939063842.db2.gz XEDQHJGQMGJVNX-CYBMUJFWSA-N 0 3 422.392 4.255 20 0 HIADHN CC(C)Cn1cc(NC(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)c(C(F)F)n1 ZINC000540110450 939075685 /nfs/dbraw/zinc/07/56/85/939075685.db2.gz FSUAHNBYXRNWOU-QGZVFWFLSA-N 0 3 405.493 4.215 20 0 HIADHN C[C@H](N[C@@H]1CCN(C)[C@@H]1c1ccc(F)c(F)c1)c1ccc(-n2cncn2)cc1Cl ZINC000540144508 939089796 /nfs/dbraw/zinc/08/97/96/939089796.db2.gz YZOLBGQQZZYYOZ-JDORSLCVSA-N 0 3 417.891 4.295 20 0 HIADHN Cc1ccc([C@H](Cn2ccnc2)N[C@@H](C)c2cccc(N3CCOCC3)c2)c(C)c1 ZINC000540146200 939090581 /nfs/dbraw/zinc/09/05/81/939090581.db2.gz AZSHOASQYCHMLH-OFVILXPXSA-N 0 3 404.558 4.429 20 0 HIADHN Cc1cc(S(=O)(=O)NCCN[C@@H](C)c2cccc(-c3ccncc3)c2)c(C)s1 ZINC000540149157 939092069 /nfs/dbraw/zinc/09/20/69/939092069.db2.gz JJGQBWYMXOKJCZ-INIZCTEOSA-N 0 3 415.584 4.056 20 0 HIADHN COc1ccc(C[C@@H](N[C@H]2CCN(C(C)=O)C2)c2cc(Cl)ccc2Cl)cc1 ZINC000540161718 939097404 /nfs/dbraw/zinc/09/74/04/939097404.db2.gz VJSFXDSTWGQKMA-LAUBAEHRSA-N 0 3 407.341 4.496 20 0 HIADHN CC(C)C[C@H](N[C@H](C)c1ccc2c(c1)C(C)(C)C(=O)N2)C(=O)Nc1nccs1 ZINC000540165865 939099135 /nfs/dbraw/zinc/09/91/35/939099135.db2.gz ZHALOFHWFAKEED-DYVFJYSZSA-N 0 3 400.548 4.077 20 0 HIADHN COc1ccc([C@@H](CCC(C)C)NCc2ccc(S(=O)(=O)N(C)C)cc2)cc1 ZINC000540190973 939116116 /nfs/dbraw/zinc/11/61/16/939116116.db2.gz VRYVNOHRCZFLBE-JOCHJYFZSA-N 0 3 404.576 4.213 20 0 HIADHN COc1ccc2c(c1)[C@H](NCc1ccc(S(=O)(=O)N3CCCCC3)cc1)CCC2 ZINC000540195487 939119597 /nfs/dbraw/zinc/11/95/97/939119597.db2.gz WFSUBHKWVCCDSH-HSZRJFAPSA-N 0 3 414.571 4.037 20 0 HIADHN Cc1ccccc1NC(=O)C[C@H](C)N[C@@H]1CC(=O)N(c2cccc(C(F)(F)F)c2)C1 ZINC000540223636 939140141 /nfs/dbraw/zinc/14/01/41/939140141.db2.gz ONHPKFRWTOQVDW-DOTOQJQBSA-N 0 3 419.447 4.126 20 0 HIADHN CCCN1C(=O)CCc2cc(NC(=O)[C@H]3CCCN(Cc4cccc(F)c4)C3)ccc21 ZINC000540249132 939166706 /nfs/dbraw/zinc/16/67/06/939166706.db2.gz UGQZOFAXGLAYPI-FQEVSTJZSA-N 0 3 423.532 4.366 20 0 HIADHN CCN1CCCN(C(=O)Nc2ccc(Cl)cc2-c2nc(CC(C)C)no2)CC1 ZINC000540252137 939168886 /nfs/dbraw/zinc/16/88/86/939168886.db2.gz MHFYNRHBEXNICJ-UHFFFAOYSA-N 0 3 405.930 4.148 20 0 HIADHN CCn1c2ccccc2c2cc(NC(=O)[C@H](C)N(C)CCCn3ccnc3)ccc21 ZINC000540321506 939193797 /nfs/dbraw/zinc/19/37/97/939193797.db2.gz UVQHVIXBRQNVCQ-SFHVURJKSA-N 0 3 403.530 4.360 20 0 HIADHN CC[C@H](NCC(=O)N(CC)Cc1ccc(OC)c(OC)c1)c1ccc(Cl)cc1 ZINC000540330142 939196968 /nfs/dbraw/zinc/19/69/68/939196968.db2.gz DRJZQLYIXFZQEY-IBGZPJMESA-N 0 3 404.938 4.447 20 0 HIADHN CC(C)[N@@H+](Cc1ccc([N-]S(=O)(=O)c2ccccc2)cc1)C[C@@H]1CCCCO1 ZINC000540330835 939197015 /nfs/dbraw/zinc/19/70/15/939197015.db2.gz LIPFXTPGQUPYFK-NRFANRHFSA-N 0 3 402.560 4.267 20 0 HIADHN CC(C)[N@H+](Cc1ccc([N-]S(=O)(=O)c2ccccc2)cc1)C[C@@H]1CCCCO1 ZINC000540330835 939197016 /nfs/dbraw/zinc/19/70/16/939197016.db2.gz LIPFXTPGQUPYFK-NRFANRHFSA-N 0 3 402.560 4.267 20 0 HIADHN CC(C)(C)C[C@@H](NCC(=O)N1CCC(NC(=O)c2ccccc2)CC1)c1ccccc1 ZINC000540351590 939203903 /nfs/dbraw/zinc/20/39/03/939203903.db2.gz KYUGXOGSHAZCOH-HSZRJFAPSA-N 0 3 421.585 4.175 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(OCC(F)(F)F)cc1)C(=O)N(C)Cc1cccc(F)c1 ZINC000540361531 939210170 /nfs/dbraw/zinc/21/01/70/939210170.db2.gz IBTROCROJDMZRI-LSDHHAIUSA-N 0 3 412.427 4.465 20 0 HIADHN CS(=O)(=O)c1ccc(OCCCN[C@H](CC(F)(F)F)c2ccc(F)cc2)cc1 ZINC000540380543 939220076 /nfs/dbraw/zinc/22/00/76/939220076.db2.gz VBIILXNDKUSNRK-GOSISDBHSA-N 0 3 419.440 4.281 20 0 HIADHN C[C@@H](N[C@@H](C)c1cccc(-n2cccn2)c1)C(=O)Nc1ccc(Br)cc1 ZINC000540388640 939225617 /nfs/dbraw/zinc/22/56/17/939225617.db2.gz RYIGVUZRNHHLBY-LSDHHAIUSA-N 0 3 413.319 4.313 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)N[C@@H]1CCO[C@@H]1c1ccc(Cl)cc1 ZINC000540390999 939229962 /nfs/dbraw/zinc/22/99/62/939229962.db2.gz POZFUQCHZUCJII-NHCUHLMSSA-N 0 3 419.928 4.083 20 0 HIADHN COc1ccc(OC)c([C@H]2CCCN2C(=O)CNC2(c3ccccc3)CCCC2)c1 ZINC000540394624 939232379 /nfs/dbraw/zinc/23/23/79/939232379.db2.gz ZVSXRXJZJVVVKA-JOCHJYFZSA-N 0 3 408.542 4.426 20 0 HIADHN CN(Cc1ccc(Cl)c(Cl)c1)C(=O)CN[C@@H](c1ccccc1)[C@H]1CCOC1 ZINC000540395390 939233032 /nfs/dbraw/zinc/23/30/32/939233032.db2.gz UZYZOBJVLXGAOK-UWJYYQICSA-N 0 3 407.341 4.319 20 0 HIADHN O=C(CN[C@@H](c1ccc(F)cc1)C1CCCC1)NC[C@@H]1CCN(c2ccccc2)C1 ZINC000540408312 939238250 /nfs/dbraw/zinc/23/82/50/939238250.db2.gz GMLLKCRDAUMBQW-UQBPGWFLSA-N 0 3 409.549 4.289 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(-n2ccnn2)cc1)C(=O)Nc1cc(Cl)ccc1Cl ZINC000540429485 939245759 /nfs/dbraw/zinc/24/57/59/939245759.db2.gz IXERQSRVTFMZIM-CHWSQXEVSA-N 0 3 404.301 4.252 20 0 HIADHN Cc1cccc(OCCNC(=O)[C@H](C)N[C@H](C)c2ccc(-c3cccnc3)cc2)c1 ZINC000540433050 939246705 /nfs/dbraw/zinc/24/67/05/939246705.db2.gz PRZWFSLODKEGAS-UXHICEINSA-N 0 3 403.526 4.291 20 0 HIADHN CN(Cc1c(F)cccc1Cl)C(=O)CN[C@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000540433871 939247256 /nfs/dbraw/zinc/24/72/56/939247256.db2.gz AAIRSLQGDKPWBN-HRAATJIYSA-N 0 3 404.913 4.195 20 0 HIADHN CC(C)[C@H](NC(=O)CN[C@H](c1cccs1)C1CC1)c1ccc2c(c1)OCCCO2 ZINC000540466552 939263963 /nfs/dbraw/zinc/26/39/63/939263963.db2.gz KIPNHRHCELFMLF-GOTSBHOMSA-N 0 3 414.571 4.464 20 0 HIADHN COc1cc(Cl)c(C)cc1NC(=O)CN[C@H](C)c1ccc(-n2ccnc2C)cc1 ZINC000540468045 939264515 /nfs/dbraw/zinc/26/45/15/939264515.db2.gz GQTZLURDIVXWKO-OAHLLOKOSA-N 0 3 412.921 4.440 20 0 HIADHN Cc1nc(C2CCCCC2)sc1C(=O)N1CCC(CN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000540470206 939265617 /nfs/dbraw/zinc/26/56/17/939265617.db2.gz KKZZTCKYZYAQLM-IRXDYDNUSA-N 0 3 419.635 4.461 20 0 HIADHN C[C@H](NCC(=O)N[C@@H](c1nccs1)c1ccccc1)c1cccc(N2CCCC2)c1 ZINC000540477295 939268058 /nfs/dbraw/zinc/26/80/58/939268058.db2.gz LRNOZRVNXPHJEP-FDDCHVKYSA-N 0 3 420.582 4.300 20 0 HIADHN C[C@@H]1C[C@H]1[C@H](NCC(=O)Nc1nc(CN2CCCC2)cs1)c1ccc(Cl)cc1 ZINC000540519136 939285526 /nfs/dbraw/zinc/28/55/26/939285526.db2.gz BDWUPODCHQNRFI-LXGCGDOSSA-N 0 3 418.994 4.318 20 0 HIADHN C[C@@H]1CN([C@H](CNCc2cn(C)nc2C(C)(C)C)c2c(F)cccc2Cl)CCO1 ZINC000540530624 939291990 /nfs/dbraw/zinc/29/19/90/939291990.db2.gz GNUBAPAFXJPWFS-DNVCBOLYSA-N 0 3 422.976 4.062 20 0 HIADHN C[C@H]1CN([C@H](CNCc2cn(C)nc2C(C)(C)C)c2c(F)cccc2Cl)CCO1 ZINC000540530625 939292487 /nfs/dbraw/zinc/29/24/87/939292487.db2.gz GNUBAPAFXJPWFS-HNAYVOBHSA-N 0 3 422.976 4.062 20 0 HIADHN CCc1ccccc1NC(=O)CN(C)C(=O)[C@H](C)N[C@H](c1ccccc1C)C1CC1 ZINC000540591739 939312690 /nfs/dbraw/zinc/31/26/90/939312690.db2.gz YECYYXYELQBBBR-UUOWRZLLSA-N 0 3 407.558 4.084 20 0 HIADHN CCN(C(=O)CN[C@@H](c1ccc2c(c1)OCCO2)C1CC1)[C@@H](C)c1ccc(F)cc1 ZINC000540590237 939312975 /nfs/dbraw/zinc/31/29/75/939312975.db2.gz DFKKPWXGNXNSOU-UPCLLVRISA-N 0 3 412.505 4.247 20 0 HIADHN O=C(NCc1ccco1)c1cccc(CN[C@@H](c2ccc3c(c2)OCCO3)C2CC2)c1 ZINC000540591124 939313095 /nfs/dbraw/zinc/31/30/95/939313095.db2.gz AQTZUECRWQGREE-XMMPIXPASA-N 0 3 418.493 4.222 20 0 HIADHN CCc1c2cc(C)ccc2oc1[C@@H](C)NCc1ccc([C@@]2(C)NC(=O)NC2=O)cc1 ZINC000540593641 939313352 /nfs/dbraw/zinc/31/33/52/939313352.db2.gz IHKHCFWFLPFUIU-OYLFLEFRSA-N 0 3 405.498 4.209 20 0 HIADHN COc1cccc2cc([C@H](C)NCc3cccc(OCCN4CCOCC4)c3)oc21 ZINC000540598473 939316030 /nfs/dbraw/zinc/31/60/30/939316030.db2.gz MLUARQXQIGKAAS-SFHVURJKSA-N 0 3 410.514 4.003 20 0 HIADHN CC[C@@H](NCc1c(C(C)C)nc2sc(C)nn12)[C@H](c1ccc(C)cc1)n1cncn1 ZINC000540627680 939323154 /nfs/dbraw/zinc/32/31/54/939323154.db2.gz CYAYVEHAORTAKY-NQIIRXRSSA-N 0 3 423.590 4.280 20 0 HIADHN CC[C@H](NCc1c(C(C)C)nc2sc(C)nn12)[C@H](c1ccc(C)cc1)n1cncn1 ZINC000540627681 939323327 /nfs/dbraw/zinc/32/33/27/939323327.db2.gz CYAYVEHAORTAKY-RXVVDRJESA-N 0 3 423.590 4.280 20 0 HIADHN Cc1cc(C(=O)NCCCCN2CCN(c3ccccc3)CC2)nn1C1CCCCC1 ZINC000540688795 939339618 /nfs/dbraw/zinc/33/96/18/939339618.db2.gz PEWFLMAUCHEJAC-UHFFFAOYSA-N 0 3 423.605 4.029 20 0 HIADHN COc1ccc(-c2nc3c(s2)[C@H](N[C@@H](C)C(=O)NCc2ccccc2)CCC3)cc1 ZINC000540727925 939350235 /nfs/dbraw/zinc/35/02/35/939350235.db2.gz SXXXJJWIXIHFAH-OXJNMPFZSA-N 0 3 421.566 4.491 20 0 HIADHN COCCNC(=O)[C@H](Cc1ccccc1)N[C@@H](C)c1sc(-c2ccccc2)nc1C ZINC000540746290 939356840 /nfs/dbraw/zinc/35/68/40/939356840.db2.gz VWPMBCUYKSYMMN-UWJYYQICSA-N 0 3 423.582 4.143 20 0 HIADHN COc1ccc(OC)c(NC(=O)C[C@H](C)N[C@H]2CCCOc3cc(F)ccc32)c1 ZINC000540780126 939370084 /nfs/dbraw/zinc/37/00/84/939370084.db2.gz WHUAUHMYIHQFFD-KSSFIOAISA-N 0 3 402.466 4.064 20 0 HIADHN O=C([C@H]1CCCN1Cc1ccccc1)N1CCC[C@@H](c2nnc(C3CCCCC3)[nH]2)C1 ZINC000540850772 939393827 /nfs/dbraw/zinc/39/38/27/939393827.db2.gz OICHVJDGPCYNDC-FGZHOGPDSA-N 0 3 421.589 4.223 20 0 HIADHN COC(=O)c1oc([C@H](C)N2CCC[C@@H](c3nnc(C4CCCCC4)[nH]3)C2)cc1C ZINC000540865284 939402321 /nfs/dbraw/zinc/40/23/21/939402321.db2.gz MYAOQAOKHADUBI-DOTOQJQBSA-N 0 3 400.523 4.481 20 0 HIADHN CSC[C@@H](NCc1ccnc(N2CCN(C)CC2)c1)c1ccc(C(F)(F)F)cc1 ZINC000540986271 939425202 /nfs/dbraw/zinc/42/52/02/939425202.db2.gz CYUMSMGWIGFMPL-LJQANCHMSA-N 0 3 424.536 4.046 20 0 HIADHN COc1ccc(CN(C(=O)CN[C@@H](C)c2ccc(-n3ccnc3C)cc2)C2CC2)cc1 ZINC000541027039 939434414 /nfs/dbraw/zinc/43/44/14/939434414.db2.gz NKJTWZKUDWIXIO-SFHVURJKSA-N 0 3 418.541 4.031 20 0 HIADHN CCN(C(=O)Cc1ccc(NC(=O)N(CCN(C)C)C(C)C)cc1)c1ccccc1 ZINC000541040680 939438680 /nfs/dbraw/zinc/43/86/80/939438680.db2.gz FOPTXQLTCOFUPE-UHFFFAOYSA-N 0 3 410.562 4.086 20 0 HIADHN CC(C)[C@@H](NCc1ccc(S(=O)(=O)C(C)C)cc1)c1ccc2c(c1)OCCO2 ZINC000541058144 939444960 /nfs/dbraw/zinc/44/49/60/939444960.db2.gz UHMOINRXGSRNQS-JOCHJYFZSA-N 0 3 403.544 4.127 20 0 HIADHN COC(=O)c1ccccc1OCCN1CCC[C@H](c2nc(C(F)(F)F)cs2)C1 ZINC000541070844 939449989 /nfs/dbraw/zinc/44/99/89/939449989.db2.gz XRENQACTUQYOCM-ZDUSSCGKSA-N 0 3 414.449 4.207 20 0 HIADHN Cc1cc2cc(C(=O)NCCCCN3C[C@@H](C)O[C@@H](C)C3)oc2c(Br)c1 ZINC000541092464 939456889 /nfs/dbraw/zinc/45/68/89/939456889.db2.gz KFXPXNQRCJNSMH-GASCZTMLSA-N 0 3 423.351 4.123 20 0 HIADHN Cc1cc(C(C)(C)C)ccc1OC[C@H](O)CN[C@H](C)c1ccc([S@](C)=O)cc1 ZINC000541117883 939466989 /nfs/dbraw/zinc/46/69/89/939466989.db2.gz RFDGMZKWUVZJRQ-KJFKMWBDSA-N 0 3 403.588 4.120 20 0 HIADHN CC(C)c1ccccc1OC[C@H](O)CN1CCC[C@H](n2ccc(C(F)(F)F)n2)C1 ZINC000541127751 939470755 /nfs/dbraw/zinc/47/07/55/939470755.db2.gz OURGMEGMURQWPT-DLBZAZTESA-N 0 3 411.468 4.102 20 0 HIADHN CCN(Cc1ccc(OC)c(OC)c1)C(=O)CN[C@H](c1ccc(Cl)cc1)C1CC1 ZINC000541203194 939485411 /nfs/dbraw/zinc/48/54/11/939485411.db2.gz VVSBQRNUYDCDHZ-QHCPKHFHSA-N 0 3 416.949 4.447 20 0 HIADHN COc1ccc(F)cc1[C@H](C)N[C@H](C)CC(=O)Nc1ccc(NC(=O)C2CC2)cc1 ZINC000541212647 939485933 /nfs/dbraw/zinc/48/59/33/939485933.db2.gz VDACXGJELRAWRY-CABCVRRESA-N 0 3 413.493 4.251 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3ccc(-c4cccs4)o3)CC2)C[C@H](C)O1 ZINC000541252995 939487722 /nfs/dbraw/zinc/48/77/22/939487722.db2.gz NEKQFCWJVLIBTP-CALCHBBNSA-N 0 3 402.560 4.360 20 0 HIADHN COc1cc(Br)ccc1CCCN1CCN(CCc2cccs2)CC1 ZINC000541281435 939489140 /nfs/dbraw/zinc/48/91/40/939489140.db2.gz CZEMJSXAPZBKQH-UHFFFAOYSA-N 0 3 423.420 4.312 20 0 HIADHN O=C([C@@H](NCCCc1nc(-c2ccc(F)cc2)no1)c1ccccc1)N1CCCCC1 ZINC000541283629 939489251 /nfs/dbraw/zinc/48/92/51/939489251.db2.gz XFCIIQDGRXAPLY-QFIPXVFZSA-N 0 3 422.504 4.152 20 0 HIADHN C[C@H](NC[C@H](O)COc1ccccc1C(F)(F)F)c1ccccc1OC(F)F ZINC000541325321 939491003 /nfs/dbraw/zinc/49/10/03/939491003.db2.gz KIIDWRSKXJILGT-STQMWFEESA-N 0 3 405.363 4.397 20 0 HIADHN COCC[C@H](Cc1ccco1)NCc1nc(-c2cccc(Br)c2)c[nH]1 ZINC000541379461 939500757 /nfs/dbraw/zinc/50/07/57/939500757.db2.gz NVBVWMZDPGMQBI-MRXNPFEDSA-N 0 3 404.308 4.170 20 0 HIADHN CN(C)[C@@H](CNC(=O)c1ncoc1-c1cccc(C(F)(F)F)c1)c1ccccc1 ZINC000541406856 939507679 /nfs/dbraw/zinc/50/76/79/939507679.db2.gz YSPGRGRXVXWWDD-KRWDZBQOSA-N 0 3 403.404 4.393 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1cc(C)n([C@@H](C)C2CC2)n1)c1cccc(OC)c1 ZINC000541462324 939525063 /nfs/dbraw/zinc/52/50/63/939525063.db2.gz HMQFAXBRONVFDP-LAUBAEHRSA-N 0 3 413.566 4.376 20 0 HIADHN Cc1cc([C@@H](NC[C@H](c2ccc(F)cc2)N2CCOCC2)c2cccnc2)ccc1F ZINC000541550327 939552089 /nfs/dbraw/zinc/55/20/89/939552089.db2.gz RRAOVTPGKAMBND-JWQCQUIFSA-N 0 3 423.507 4.421 20 0 HIADHN O=C(CN[C@@H](Cc1ccccc1)c1cccs1)Nc1ccc2c(c1)OCCCO2 ZINC000541596193 939562852 /nfs/dbraw/zinc/56/28/52/939562852.db2.gz LJDIFBCPFRBWBJ-IBGZPJMESA-N 0 3 408.523 4.422 20 0 HIADHN CCCCSc1ccc(Cl)cc1C(=O)N1CC[C@@H](N2CCN(C)CC2)[C@@H](C)C1 ZINC000541720487 939614367 /nfs/dbraw/zinc/61/43/67/939614367.db2.gz LSDUMGVLSPONJS-FXAWDEMLSA-N 0 3 424.054 4.330 20 0 HIADHN C[C@@H](CS(=O)(=O)c1ccccc1)N[C@@H]1CCN(c2ccc(Cl)c(Cl)c2)C1 ZINC000541740564 939618484 /nfs/dbraw/zinc/61/84/84/939618484.db2.gz KCTZLNFHFFEQNK-LSDHHAIUSA-N 0 3 413.370 4.024 20 0 HIADHN OC[C@H](CN[C@@H](c1ccccc1)c1cncnc1)Cc1ccccc1C(F)(F)F ZINC000541743339 939618918 /nfs/dbraw/zinc/61/89/18/939618918.db2.gz IGTXCUJLVIGJOT-KKSFZXQISA-N 0 3 401.432 4.026 20 0 HIADHN Cc1ccc(S(=O)(=O)C[C@@H](C)NC2CCN(Cc3ccc(Cl)cc3)CC2)cc1 ZINC000541746088 939619323 /nfs/dbraw/zinc/61/93/23/939619323.db2.gz UOAAWDWNXSSVHN-GOSISDBHSA-N 0 3 421.006 4.065 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(N[C@H](c2ccn(C)n2)c2ccc(Cl)cc2)CC1 ZINC000541779543 939628383 /nfs/dbraw/zinc/62/83/83/939628383.db2.gz WOQRQGYYJNCEHC-HXOBKFHXSA-N 0 3 409.965 4.373 20 0 HIADHN COc1ccccc1COC1CCN(Cc2ccc(OC[C@H]3CCCO3)cc2)CC1 ZINC000541853477 939647158 /nfs/dbraw/zinc/64/71/58/939647158.db2.gz NBANKAZTKDIJHW-XMMPIXPASA-N 0 3 411.542 4.434 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)c2cnn(-c3ccc(C)cc3)c2C)cc1 ZINC000541856801 939647639 /nfs/dbraw/zinc/64/76/39/939647639.db2.gz JMIBACPCVAQRTF-XMMPIXPASA-N 0 3 418.541 4.065 20 0 HIADHN COc1cccc(C(=O)NCCN[C@@H](CSC)c2ccc(C(F)(F)F)cc2)c1 ZINC000541914772 939652384 /nfs/dbraw/zinc/65/23/84/939652384.db2.gz JUTBNDQVLWQXCN-SFHVURJKSA-N 0 3 412.477 4.138 20 0 HIADHN CC(C)[C@H](NCc1ccc(C(=O)N2CCN(C)CC2)cc1)c1ccc(Cl)cc1F ZINC000541916298 939652769 /nfs/dbraw/zinc/65/27/69/939652769.db2.gz FLOVWCIZCKOFHR-QFIPXVFZSA-N 0 3 417.956 4.354 20 0 HIADHN COc1ccccc1[C@H](C)NC(=O)[C@@H](C)N[C@@H](C)c1ccc(-n2ccnc2C)cc1 ZINC000541955961 939661710 /nfs/dbraw/zinc/66/17/10/939661710.db2.gz YYMIDHOUOAWRJP-OKZBNKHCSA-N 0 3 406.530 4.106 20 0 HIADHN CC(C)[C@@H]1C[C@@H](CC(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)CCO1 ZINC000541959434 939662498 /nfs/dbraw/zinc/66/24/98/939662498.db2.gz ZSAYLEZIGJGNCO-FKBYEOEOSA-N 0 3 410.562 4.110 20 0 HIADHN CCOc1ccccc1[C@H](CC)NC(=O)CN[C@H](C)c1ccc(-n2ccnc2C)cc1 ZINC000541958857 939662793 /nfs/dbraw/zinc/66/27/93/939662793.db2.gz SWGCBWVCUIEGER-JPYJTQIMSA-N 0 3 420.557 4.498 20 0 HIADHN Cc1ccc([C@H](OC[C@H](O)CN[C@H](CO)c2ccccc2C)c2ccccc2)cc1 ZINC000541983615 939669709 /nfs/dbraw/zinc/66/97/09/939669709.db2.gz KYRZLADFVHVMPT-LGPLSSKUSA-N 0 3 405.538 4.094 20 0 HIADHN O[C@H](CN[C@@H](Cc1ccc(Cl)cc1)c1ccccn1)COCc1cccs1 ZINC000542123325 939722052 /nfs/dbraw/zinc/72/20/52/939722052.db2.gz NVZXIILHBWCRTE-NQIIRXRSSA-N 0 3 402.947 4.248 20 0 HIADHN O=C(c1ccc(F)c(F)c1)c1ccccc1C(=O)N1CCCN(C2CCCC2)CC1 ZINC000542136126 939726378 /nfs/dbraw/zinc/72/63/78/939726378.db2.gz UCVTUJVPHMPSNC-UHFFFAOYSA-N 0 3 412.480 4.286 20 0 HIADHN CC(C)n1ccc(C[C@H](C)N[C@H](c2ccccc2)c2cccc(S(C)(=O)=O)c2)n1 ZINC000542137177 939726852 /nfs/dbraw/zinc/72/68/52/939726852.db2.gz YYDMXGJDKLECBP-FDDCHVKYSA-N 0 3 411.571 4.178 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)CCc2cc(F)ccc2Br)CC1 ZINC000542194671 939752664 /nfs/dbraw/zinc/75/26/64/939752664.db2.gz SFYUHUGFFRUVCO-UHFFFAOYSA-N 0 3 423.326 4.237 20 0 HIADHN CC(C)c1ccc([C@@H](C)N2CCC(N(CC(F)(F)F)S(C)(=O)=O)CC2)cc1 ZINC000542279720 939783650 /nfs/dbraw/zinc/78/36/50/939783650.db2.gz BEWJAKMSAQGUJY-OAHLLOKOSA-N 0 3 406.514 4.159 20 0 HIADHN C[C@H](CN(C)C[C@H](O)COc1ccc(Cl)cc1Br)c1nccs1 ZINC000542307311 939793804 /nfs/dbraw/zinc/79/38/04/939793804.db2.gz PZJGMRMTEMKGGW-YPMHNXCESA-N 0 3 419.772 4.034 20 0 HIADHN COc1ccc([C@H]2CCCN2C(=O)CN2CC[C@H](c3cccc(C)c3)C2)cc1OC ZINC000542318938 939799008 /nfs/dbraw/zinc/79/90/08/939799008.db2.gz BRAJJHDWFNAWPZ-FCHUYYIVSA-N 0 3 408.542 4.165 20 0 HIADHN CO[C@H](C)c1nc(CN2CCCN(Cc3cc(C)c4ncccc4c3)CC2)cs1 ZINC000542464724 939827583 /nfs/dbraw/zinc/82/75/83/939827583.db2.gz GDPUTXMMMPUIDI-GOSISDBHSA-N 0 3 410.587 4.415 20 0 HIADHN COc1ccc([C@@H](CN[C@H](c2ccc(F)cc2)c2cccnc2)N(C)C)cc1OC ZINC000542475503 939829361 /nfs/dbraw/zinc/82/93/61/939829361.db2.gz XNNSNEWQIIDWGG-ZJSXRUAMSA-N 0 3 409.505 4.220 20 0 HIADHN C[C@H](N[C@H]1CCCN(Cc2ccccn2)C1=O)c1ccc(SCC(F)F)cc1 ZINC000542501249 939833558 /nfs/dbraw/zinc/83/35/58/939833558.db2.gz RPZZKDDFCAWDCA-KXBFYZLASA-N 0 3 405.514 4.281 20 0 HIADHN CC(C)([C@H](NCC(=O)Nc1ccccc1F)c1ccc(F)c(F)c1)N1CCCC1 ZINC000542517977 939835836 /nfs/dbraw/zinc/83/58/36/939835836.db2.gz MDRRYDXSCHKODQ-OAQYLSRUSA-N 0 3 405.464 4.248 20 0 HIADHN CC[C@H](C)[C@@H](C)NCc1nc2c(Br)cc(Br)cc2c(=O)[nH]1 ZINC000542543868 939841449 /nfs/dbraw/zinc/84/14/49/939841449.db2.gz HWYQDNTURYAKHZ-DTWKUNHWSA-N 0 3 417.145 4.385 20 0 HIADHN C[C@H]1N(C(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)CCC12CCOCC2 ZINC000542554597 939842693 /nfs/dbraw/zinc/84/26/93/939842693.db2.gz OXUUTWIEGSDWHC-RTBURBONSA-N 0 3 405.608 4.122 20 0 HIADHN C[C@H](c1ccccc1C(F)(F)F)[C@H](C)NCC(=O)N1CCC(c2ccccc2)=N1 ZINC000542564723 939844454 /nfs/dbraw/zinc/84/44/54/939844454.db2.gz XIOYBKYUKPFSAT-HOTGVXAUSA-N 0 3 403.448 4.424 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3C[C@@H](C)C[C@@H]3c3cccnc3)c(C)c2)CC1 ZINC000542601390 939847536 /nfs/dbraw/zinc/84/75/36/939847536.db2.gz UFCMLYBRZMIEGR-FDDCHVKYSA-N 0 3 407.562 4.147 20 0 HIADHN COC(=O)C1CCN(C(=O)CN[C@@H](C)c2ccc(-c3ccc(Cl)cc3)s2)CC1 ZINC000542618184 939849144 /nfs/dbraw/zinc/84/91/44/939849144.db2.gz HXKOMYGYUWDNSR-AWEZNQCLSA-N 0 3 420.962 4.131 20 0 HIADHN C[C@H](NCC(=O)N[C@@H](Cc1ccccc1)c1ccccc1)[C@@H]1COc2ccccc21 ZINC000542628142 939850306 /nfs/dbraw/zinc/85/03/06/939850306.db2.gz GMCBKSPQHFEQAC-IGKWTDBASA-N 0 3 400.522 4.241 20 0 HIADHN CCN(Cc1cccc(F)c1)C(=O)CN(C)[C@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000542628146 939850359 /nfs/dbraw/zinc/85/03/59/939850359.db2.gz OMGKKESJXYFIQI-VXKWHMMOSA-N 0 3 402.485 4.165 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)C(=O)Nc1cccc(C(F)F)c1Cl)c1ccccc1 ZINC000542631417 939850478 /nfs/dbraw/zinc/85/04/78/939850478.db2.gz DXSGNXMRWQZZHM-KRWDZBQOSA-N 0 3 423.891 4.415 20 0 HIADHN Clc1cccc2c1CCC[C@H]2NCc1ccccc1OCCN1CCOCC1 ZINC000542677235 939853474 /nfs/dbraw/zinc/85/34/74/939853474.db2.gz GECBQLYBKYHRCH-JOCHJYFZSA-N 0 3 400.950 4.218 20 0 HIADHN CCOC(=O)c1nn(-c2ccccc2)cc1CN[C@@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000542689883 939854462 /nfs/dbraw/zinc/85/44/62/939854462.db2.gz YUMSVCAHAOXNLW-IRLDBZIGSA-N 0 3 423.488 4.198 20 0 HIADHN Cc1cc(NC(=O)[C@H]2CCCN(Cc3cccnc3)C2)cnc1N1CCCC[C@@H]1C ZINC000542816292 939861278 /nfs/dbraw/zinc/86/12/78/939861278.db2.gz PUJCCBNKMKVGLS-FPOVZHCZSA-N 0 3 407.562 4.015 20 0 HIADHN CC(=O)Nc1ccc([C@H](C)NCc2cc(Br)c3c(c2)OCCO3)cc1 ZINC000542848216 939862905 /nfs/dbraw/zinc/86/29/05/939862905.db2.gz YLCMNQZSGVXYAX-LBPRGKRZSA-N 0 3 405.292 4.030 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)NCC(=O)Nc2nc(-c3ccco3)cs2)cc1 ZINC000542883295 939865126 /nfs/dbraw/zinc/86/51/26/939865126.db2.gz PEDRWGTXOPROAG-CQSZACIVSA-N 0 3 407.499 4.187 20 0 HIADHN CNS(=O)(=O)c1cccc([C@H](C)N[C@H]2CCCc3c(Br)cccc32)c1 ZINC000543078840 939929880 /nfs/dbraw/zinc/92/98/80/939929880.db2.gz CEUBOUWZMDWYPI-DJJJIMSYSA-N 0 3 423.376 4.085 20 0 HIADHN COc1ccc([C@H]2CCCN2C(=O)CN2CC[C@H](c3ccc(C)cc3)C2)cc1OC ZINC000543254157 940009638 /nfs/dbraw/zinc/00/96/38/940009638.db2.gz UCPJFUHGQNDKRL-FCHUYYIVSA-N 0 3 408.542 4.165 20 0 HIADHN Cc1cc(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2F)nn1[C@H](C)C1CC1 ZINC000543319736 940028713 /nfs/dbraw/zinc/02/87/13/940028713.db2.gz WZZFCZGDSSFUFB-OAHLLOKOSA-N 0 3 405.493 4.036 20 0 HIADHN CCS(=O)(=O)c1ccc(CN[C@H]2CCCc3c(Br)cccc32)cc1 ZINC000563766332 945290880 /nfs/dbraw/zinc/29/08/80/945290880.db2.gz LOVGYZVRPTYXGU-IBGZPJMESA-N 0 3 408.361 4.410 20 0 HIADHN C[C@H](C[S@@](C)=O)NCc1cn(Cc2ccccc2)nc1-c1cc2ccccc2o1 ZINC000543410486 940056781 /nfs/dbraw/zinc/05/67/81/940056781.db2.gz SFRHGYRJSVUQOX-CQGGRAHPSA-N 0 3 407.539 4.201 20 0 HIADHN Cc1csc([C@H](C)CNC(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)n1 ZINC000543483868 940079003 /nfs/dbraw/zinc/07/90/03/940079003.db2.gz AJHVIXZIBNEXJR-NVXWUHKLSA-N 0 3 406.621 4.389 20 0 HIADHN CC(C)C[C@H](N[C@@H](C)C(=O)N[C@@H](C)c1ccc2c(c1)OCCO2)c1cccs1 ZINC000543485938 940080077 /nfs/dbraw/zinc/08/00/77/940080077.db2.gz PNPOUFPMDDKQIO-BQFCYCMXSA-N 0 3 402.560 4.462 20 0 HIADHN C[C@@H](N[C@H](CC(N)=O)C1CCCCC1)C(=O)Nc1ccccc1Oc1ccccc1 ZINC000543495016 940083787 /nfs/dbraw/zinc/08/37/87/940083787.db2.gz BYYGCPKSTQITND-DYESRHJHSA-N 0 3 409.530 4.220 20 0 HIADHN C[C@H](N[C@H](CC(N)=O)C1CCCCC1)C(=O)Nc1ccccc1Oc1ccccc1 ZINC000543495019 940084036 /nfs/dbraw/zinc/08/40/36/940084036.db2.gz BYYGCPKSTQITND-LAUBAEHRSA-N 0 3 409.530 4.220 20 0 HIADHN Cc1ccc(NC(=O)CN[C@H](C)[C@H]2Oc3ccccc3[C@H]2C)c(Br)c1 ZINC000543549941 940105647 /nfs/dbraw/zinc/10/56/47/940105647.db2.gz ZJPPHAHDRMAZEN-JZKQVHKSSA-N 0 3 403.320 4.239 20 0 HIADHN Cc1cc(NC(=O)[C@H](C)N[C@H](C)[C@H]2COc3ccccc32)ccc1Br ZINC000543552355 940106349 /nfs/dbraw/zinc/10/63/49/940106349.db2.gz UUNBEFHOAQQZQK-JKIFEVAISA-N 0 3 403.320 4.239 20 0 HIADHN CCCOc1ccc(CNC(=O)CN(C)[C@H]2CCO[C@H](c3ccc(F)cc3)C2)cc1 ZINC000543555805 940106684 /nfs/dbraw/zinc/10/66/84/940106684.db2.gz XIHHBYPHMDZYDR-GMAHTHKFSA-N 0 3 414.521 4.083 20 0 HIADHN CN(Cc1ccc(Cl)s1)C(=O)CN(C)[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000543560971 940109463 /nfs/dbraw/zinc/10/94/63/940109463.db2.gz RNWOTVVIGTULQC-SJLPKXTDSA-N 0 3 410.942 4.351 20 0 HIADHN O=C(CCNCc1ccc(OC(F)F)c(F)c1)Nc1ccc(Br)cc1 ZINC000543621182 940136664 /nfs/dbraw/zinc/13/66/64/940136664.db2.gz HEJOBMMEVUXBQE-UHFFFAOYSA-N 0 3 417.225 4.308 20 0 HIADHN C[C@H](C(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1CO)c1ccc(Cl)c(Cl)c1 ZINC000543707360 940166696 /nfs/dbraw/zinc/16/66/96/940166696.db2.gz OLZDWTWBNGIYPK-UQASEVPWSA-N 0 3 421.368 4.096 20 0 HIADHN COc1ccc(-c2nsc(NC(=O)N[C@@H]3CCN([C@@H](C)c4ccccc4)C3)n2)cc1 ZINC000563782576 945300454 /nfs/dbraw/zinc/30/04/54/945300454.db2.gz FMAWFJBUNGUTIS-MAUKXSAKSA-N 0 3 423.542 4.171 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)N[C@H](c1c(F)cccc1F)C(F)(F)F ZINC000543737237 940173029 /nfs/dbraw/zinc/17/30/29/940173029.db2.gz IZTOWHIJRHECIW-QGZVFWFLSA-N 0 3 417.378 4.460 20 0 HIADHN C[C@H](Cc1ccccc1C(F)(F)F)NC(=O)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000543744036 940173649 /nfs/dbraw/zinc/17/36/49/940173649.db2.gz WOMXOZNXXHJLRG-APWZRJJASA-N 0 3 405.464 4.060 20 0 HIADHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1nc(-c2cccc(C(F)(F)F)c2)oc1C ZINC000543853392 940209565 /nfs/dbraw/zinc/20/95/65/940209565.db2.gz ROFXXHQEQGYUDX-SJORKVTESA-N 0 3 407.436 4.368 20 0 HIADHN C[C@@H](NCCS(=O)(=O)c1ccc(C(C)(C)C)cc1)c1cccc(-n2ccnc2)c1 ZINC000543869403 940217541 /nfs/dbraw/zinc/21/75/41/940217541.db2.gz NWYCAXDKASTGOD-GOSISDBHSA-N 0 3 411.571 4.294 20 0 HIADHN CC(C)(C)OC(=O)C1CCC(NCc2cn(-c3ccc(F)c(Cl)c3)nn2)CC1 ZINC000544004343 940294103 /nfs/dbraw/zinc/29/41/03/940294103.db2.gz JQRGNWXQZDEXOX-UHFFFAOYSA-N 0 3 408.905 4.050 20 0 HIADHN CC(C)Cc1ccc([C@H](CNC(=O)c2ccc(-c3ccco3)[nH]c2=O)N(C)C)cc1 ZINC000563837257 945309798 /nfs/dbraw/zinc/30/97/98/945309798.db2.gz UIJPNALTEGZXHA-NRFANRHFSA-N 0 3 407.514 4.278 20 0 HIADHN C[C@H]1C[C@@H](c2ccccc2)CCN1C(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000544110081 940329039 /nfs/dbraw/zinc/32/90/39/940329039.db2.gz KBRSKJSVWXDVAR-UNMCSNQZSA-N 0 3 421.585 4.121 20 0 HIADHN C[C@@H](CNC(=O)[C@H]1CCn2c(cnc2C2CCCCC2)C1)N(C)Cc1ccccc1 ZINC000544224928 940360244 /nfs/dbraw/zinc/36/02/44/940360244.db2.gz NIAGNQBPKXVCMO-UGKGYDQZSA-N 0 3 408.590 4.130 20 0 HIADHN Cc1nc(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2F)sc1C(F)(F)F ZINC000563863114 945317249 /nfs/dbraw/zinc/31/72/49/945317249.db2.gz PGRRBCAKBIWJON-UHFFFAOYSA-N 0 3 422.423 4.344 20 0 HIADHN CCN1CCCN(C(=O)Nc2nc(Cc3ccccc3Br)cs2)CC1 ZINC000544269062 940373897 /nfs/dbraw/zinc/37/38/97/940373897.db2.gz SCDTUEOFYZUTAT-UHFFFAOYSA-N 0 3 423.380 4.056 20 0 HIADHN Cn1cc(N2CCC[C@@H](N[C@@H](c3ccc(F)cc3)c3cnc4ccccc4c3)C2)cn1 ZINC000544359262 940400169 /nfs/dbraw/zinc/40/01/69/940400169.db2.gz HMHMGIQQKZRFOW-RDGATRHJSA-N 0 3 415.516 4.455 20 0 HIADHN CC(C)[C@H](CN[C@H](c1ccc(F)cc1)c1cnccn1)N1CCc2ccccc2C1 ZINC000544358841 940400709 /nfs/dbraw/zinc/40/07/09/940400709.db2.gz COFBKFNFVUZMDK-LOSJGSFVSA-N 0 3 404.533 4.378 20 0 HIADHN Fc1ccc(-c2noc(CCCNCc3cc(F)ccc3Br)n2)cc1 ZINC000544368645 940403785 /nfs/dbraw/zinc/40/37/85/940403785.db2.gz PAEKRCHGJHIXRD-UHFFFAOYSA-N 0 3 408.246 4.500 20 0 HIADHN Cc1cc(OCc2nc(-c3ccc(N4CCCN(C)CC4)nc3)no2)ccc1C(C)C ZINC000544396377 940411533 /nfs/dbraw/zinc/41/15/33/940411533.db2.gz DARBWLROMBLLNQ-UHFFFAOYSA-N 0 3 421.545 4.284 20 0 HIADHN Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)NC[C@@H](O)COc1cccc2ccccc21 ZINC000544420854 940420320 /nfs/dbraw/zinc/42/03/20/940420320.db2.gz FEAAOMITYRGJKY-KBXCAEBGSA-N 0 3 421.463 4.306 20 0 HIADHN COC[C@@H](NCC(=O)N(Cc1ccccc1)c1nc2c(cccc2C)s1)C1CC1 ZINC000544442083 940432670 /nfs/dbraw/zinc/43/26/70/940432670.db2.gz BWPSVPMKCBQSSM-LJQANCHMSA-N 0 3 409.555 4.153 20 0 HIADHN CC(C)N1CC[C@H](N[C@@H](C)C(=O)N2CCc3ccccc32)[C@@H]1c1ccc(F)c(F)c1 ZINC000563901094 945320182 /nfs/dbraw/zinc/32/01/82/945320182.db2.gz QABVMMNXEXAHAK-YROCYRMSSA-N 0 3 413.512 4.056 20 0 HIADHN C[C@H](Cc1c(F)cccc1F)NC(=O)CN(C)[C@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000544527551 940472111 /nfs/dbraw/zinc/47/21/11/940472111.db2.gz AGZGEDMVKVPBDZ-FXCLAUTBSA-N 0 3 420.475 4.003 20 0 HIADHN CN(CC(=O)N1CCc2[nH]c3ccccc3c2C1)[C@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000544529602 940472617 /nfs/dbraw/zinc/47/26/17/940472617.db2.gz OCHOQPVVULFCNJ-CYFREDJKSA-N 0 3 421.516 4.044 20 0 HIADHN C[C@@H]1N(CC(=O)N[C@H](c2ccccc2)c2cccc(Cl)c2)CCC12CCOCC2 ZINC000544547193 940476470 /nfs/dbraw/zinc/47/64/70/940476470.db2.gz LUEPXXLKPCVKJR-FDDCHVKYSA-N 0 3 412.961 4.437 20 0 HIADHN C[C@H](CNC(=O)N(C)[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1)N(C)Cc1ccccc1 ZINC000544661620 940499727 /nfs/dbraw/zinc/49/97/27/940499727.db2.gz SCDKSCWRIPAZPK-SXSPYAJSSA-N 0 3 413.537 4.208 20 0 HIADHN CC(C)(CNC(=O)NCc1nc2ccccc2n1C1CC1)N1CCc2ccccc2C1 ZINC000544805042 940516028 /nfs/dbraw/zinc/51/60/28/940516028.db2.gz ZVGGGEUIXPKEOT-UHFFFAOYSA-N 0 3 417.557 4.007 20 0 HIADHN CCN(C(=O)CCCc1nnc(-c2ccccc2)o1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000544850942 940519138 /nfs/dbraw/zinc/51/91/38/940519138.db2.gz HIJWEXQSTPEATE-QFIPXVFZSA-N 0 3 418.541 4.182 20 0 HIADHN Cc1cccc(C)c1[C@H](C)NCC(=O)N1CCC[C@H]1c1ccc2c(c1)OCCCO2 ZINC000544895018 940522674 /nfs/dbraw/zinc/52/26/74/940522674.db2.gz BORXEPZTFWQTKV-FPOVZHCZSA-N 0 3 408.542 4.479 20 0 HIADHN CC(=O)Nc1ccc(OC[C@@H](O)CNC(c2ccccc2C)c2ccccc2C)cc1 ZINC000544895579 940522882 /nfs/dbraw/zinc/52/28/82/940522882.db2.gz HMXVCAFSVOKJNF-QFIPXVFZSA-N 0 3 418.537 4.381 20 0 HIADHN O=C(Nc1cccc(-c2noc([C@H]3CCCN(Cc4cccnc4)C3)n2)c1)C1CCC1 ZINC000544947527 940527195 /nfs/dbraw/zinc/52/71/95/940527195.db2.gz UEGMFKYQJINTKH-FQEVSTJZSA-N 0 3 417.513 4.250 20 0 HIADHN Brc1cncc(-c2noc(-c3ccc(CN4CCSCC4)cc3)n2)c1 ZINC000545031025 940535158 /nfs/dbraw/zinc/53/51/58/940535158.db2.gz WNZUNSRACPIXAX-UHFFFAOYSA-N 0 3 417.332 4.110 20 0 HIADHN Fc1cccc(CN2CCC[C@H](c3nc(-c4cccnc4OCC(F)F)no3)C2)c1 ZINC000545135455 940547328 /nfs/dbraw/zinc/54/73/28/940547328.db2.gz IHQZGCMKCJMESM-HNNXBMFYSA-N 0 3 418.419 4.294 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@H]1CCOC(C)(C)C1)c1ccc(C(F)(F)F)cc1 ZINC000545236779 940557942 /nfs/dbraw/zinc/55/79/42/940557942.db2.gz OCFMVLPWFVPQAU-ZWKOTPCHSA-N 0 3 415.500 4.345 20 0 HIADHN CCc1cc(C(=O)NC[C@@H](c2ccc(C(F)(F)F)cc2)N(CC)CC)c(C)nn1 ZINC000545395193 940568084 /nfs/dbraw/zinc/56/80/84/940568084.db2.gz PZXAHRSDDAFCQK-IBGZPJMESA-N 0 3 408.468 4.179 20 0 HIADHN CCN1c2ccc(NC(=O)N(C)[C@H]3CCCN(Cc4ccccc4)C3)cc2CCC1=O ZINC000545431753 940569592 /nfs/dbraw/zinc/56/95/92/940569592.db2.gz MPDVOVSJZZGGTN-QFIPXVFZSA-N 0 3 420.557 4.114 20 0 HIADHN CCN1c2ccc(NC(=O)N(C)[C@@H]3CCCN(Cc4ccccc4)C3)cc2CCC1=O ZINC000545431751 940569654 /nfs/dbraw/zinc/56/96/54/940569654.db2.gz MPDVOVSJZZGGTN-JOCHJYFZSA-N 0 3 420.557 4.114 20 0 HIADHN Cc1csc([C@@H](C)NC2CCN(C(=O)c3ccc(Br)cc3C)CC2)n1 ZINC000545460541 940570913 /nfs/dbraw/zinc/57/09/13/940570913.db2.gz KFOVOKXGSUTNRG-CQSZACIVSA-N 0 3 422.392 4.478 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](NCCC[C@H]2CCCCO2)c2ccc(F)c(F)c2)c1 ZINC000545459783 940570929 /nfs/dbraw/zinc/57/09/29/940570929.db2.gz AQPHLVRMZPGNPK-XMSQKQJNSA-N 0 3 423.525 4.397 20 0 HIADHN CCN(C(=O)c1cccc(Oc2cnccn2)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000545475966 940571402 /nfs/dbraw/zinc/57/14/02/940571402.db2.gz WBWHBIJURVDEQR-NRFANRHFSA-N 0 3 402.498 4.006 20 0 HIADHN CCN(CC(=O)Nc1ccccc1C(F)(F)F)[C@H]1CCN(Cc2ccccc2)C1 ZINC000545518862 940572818 /nfs/dbraw/zinc/57/28/18/940572818.db2.gz BFUVYOOZMLQNIO-SFHVURJKSA-N 0 3 405.464 4.240 20 0 HIADHN COCCC(C)(C)CN[C@H](c1cccc(S(C)(=O)=O)c1)c1ccc(F)c(F)c1 ZINC000545518558 940572857 /nfs/dbraw/zinc/57/28/57/940572857.db2.gz NICNEGVXEMNVBM-HXUWFJFHSA-N 0 3 411.514 4.110 20 0 HIADHN c1cncc(CN2CCC[C@H](c3nc(-c4ccc(OC5CCCC5)nc4)no3)C2)c1 ZINC000545794681 940598320 /nfs/dbraw/zinc/59/83/20/940598320.db2.gz JANAMJXNMAOBAK-IBGZPJMESA-N 0 3 405.502 4.228 20 0 HIADHN O=C(N(CCN1CCCC1)c1ccccc1)C1(c2cncc(Br)c2)CC1 ZINC000545979770 940669680 /nfs/dbraw/zinc/66/96/80/940669680.db2.gz CKTFNNDCRFPYGT-UHFFFAOYSA-N 0 3 414.347 4.005 20 0 HIADHN COc1ccc(NC(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)c2ncccc12 ZINC000546036691 940678737 /nfs/dbraw/zinc/67/87/37/940678737.db2.gz IFUZVHFXXCOEKT-UHFFFAOYSA-N 0 3 414.456 4.117 20 0 HIADHN CS[C@H]1CN(C(=O)Nc2cccc(Cl)c2SCC(F)F)C[C@@H]1N(C)C ZINC000546130052 940708044 /nfs/dbraw/zinc/70/80/44/940708044.db2.gz JIDJZLDIBFZXCQ-STQMWFEESA-N 0 3 409.955 4.207 20 0 HIADHN C[C@@H]1CN(c2ccc(CN[C@H](Cc3cccnc3)c3ccc(Cl)cc3)cn2)CCO1 ZINC000546164283 940719538 /nfs/dbraw/zinc/71/95/38/940719538.db2.gz FWKLVXYWJMVNJD-WZONZLPQSA-N 0 3 422.960 4.429 20 0 HIADHN COc1ccc(CN[C@@H]2CCO[C@@H](c3ccc(F)cc3)C2)c(Br)c1O ZINC000546176336 940721711 /nfs/dbraw/zinc/72/17/11/940721711.db2.gz BGFXSHSQUWSARJ-NVXWUHKLSA-N 0 3 410.283 4.312 20 0 HIADHN COc1ccc(CN[C@H]2CCO[C@H](c3ccc(F)cc3)C2)c(Br)c1O ZINC000546176338 940721793 /nfs/dbraw/zinc/72/17/93/940721793.db2.gz BGFXSHSQUWSARJ-RDJZCZTQSA-N 0 3 410.283 4.312 20 0 HIADHN COc1ccc(CN[C@H]2CCO[C@@H](c3ccc(F)cc3)C2)c(Br)c1O ZINC000546176306 940721974 /nfs/dbraw/zinc/72/19/74/940721974.db2.gz BGFXSHSQUWSARJ-DOTOQJQBSA-N 0 3 410.283 4.312 20 0 HIADHN NC(=O)[C@@H](Cc1ccc(Cl)cc1)NCc1ccccc1COCc1ccccc1 ZINC000546182236 940723159 /nfs/dbraw/zinc/72/31/59/940723159.db2.gz DIVRNJZACZJOQK-HSZRJFAPSA-N 0 3 408.929 4.243 20 0 HIADHN CCCN(C(=O)NCCC[C@H]1CCCCO1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000546203692 940728980 /nfs/dbraw/zinc/72/89/80/940728980.db2.gz NLYBYHDISIEBKI-XZOQPEGZSA-N 0 3 401.595 4.422 20 0 HIADHN CCCc1c(NC(=O)c2cccc(CN3CCCC3)c2)cnn1-c1cc(C)ccn1 ZINC000546205075 940729510 /nfs/dbraw/zinc/72/95/10/940729510.db2.gz BYQUNISKBDHVJE-UHFFFAOYSA-N 0 3 403.530 4.376 20 0 HIADHN COCCC(C)(C)CN[C@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000546225655 940735159 /nfs/dbraw/zinc/73/51/59/940735159.db2.gz UQLNFJVTYRYCSY-HXUWFJFHSA-N 0 3 409.979 4.485 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(C4(c5ccccc5)CCCC4)n3)cn2)CC1 ZINC000546357702 940800836 /nfs/dbraw/zinc/80/08/36/940800836.db2.gz ZFSMFTAYVDQNQB-UHFFFAOYSA-N 0 3 403.530 4.134 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(C4(Cc5ccc(Cl)cc5)CC4)n3)cn2)CC1 ZINC000546370190 940803858 /nfs/dbraw/zinc/80/38/58/940803858.db2.gz YWBTXOVEVVGGBZ-UHFFFAOYSA-N 0 3 423.948 4.201 20 0 HIADHN CN(C)C[C@H](NC(=O)c1ccc(COc2ccc(F)cc2)o1)c1ccc(F)cc1 ZINC000564022008 945352168 /nfs/dbraw/zinc/35/21/68/945352168.db2.gz BLISPRHHQNTXAZ-FQEVSTJZSA-N 0 3 400.425 4.170 20 0 HIADHN CC(C)CC(=O)Nc1ccc(Cl)c(C(=O)N[C@H](CN(C)C)c2ccc(F)cc2)c1 ZINC000564021377 945352700 /nfs/dbraw/zinc/35/27/00/945352700.db2.gz IHZYHFYSEOBIKQ-HXUWFJFHSA-N 0 3 419.928 4.496 20 0 HIADHN CCN1CCN([C@@H](C)CNC(=O)c2cc(Cl)ccc2Sc2ccccc2)CC1 ZINC000546797890 940885218 /nfs/dbraw/zinc/88/52/18/940885218.db2.gz MHLJGWJLHMCXOI-KRWDZBQOSA-N 0 3 418.006 4.247 20 0 HIADHN Cc1ccc(C(=O)CCCCC(=O)NC2CCN([C@H](C)c3ccncc3)CC2)cc1 ZINC000546857861 940896361 /nfs/dbraw/zinc/89/63/61/940896361.db2.gz UATISTCTHJHXMV-HXUWFJFHSA-N 0 3 407.558 4.475 20 0 HIADHN CS(=O)(=O)Cc1cccc(CN[C@H](Cc2cccnc2)c2ccc(Cl)cc2)c1 ZINC000546873610 940899177 /nfs/dbraw/zinc/89/91/77/940899177.db2.gz RMDKOQFBPBEPDU-JOCHJYFZSA-N 0 3 414.958 4.353 20 0 HIADHN C[C@H](N[C@H](Cc1ccc(Cl)cc1)C(N)=O)c1cccc(OCc2ccccn2)c1 ZINC000546886095 940901870 /nfs/dbraw/zinc/90/18/70/940901870.db2.gz AJTJLKLIRGTRLQ-KSFYIVLOSA-N 0 3 409.917 4.061 20 0 HIADHN Fc1ccc2[nH]cc(Cc3noc(-c4ccc(CN5CCSCC5)cc4)n3)c2c1 ZINC000547163479 941017159 /nfs/dbraw/zinc/01/71/59/941017159.db2.gz CSRRPBXZICMGSU-UHFFFAOYSA-N 0 3 408.502 4.497 20 0 HIADHN Cc1cc(Cl)c2ccccc2c1NC(=O)N1CC[C@H](N2CCN(C(C)C)CC2)C1 ZINC000547321794 941056039 /nfs/dbraw/zinc/05/60/39/941056039.db2.gz YOSDFODIXCEKMS-SFHVURJKSA-N 0 3 414.981 4.434 20 0 HIADHN Cc1c(CN2CCSCC2)cccc1N[C@H](C)Cn1cc(Br)cn1 ZINC000547421336 941061547 /nfs/dbraw/zinc/06/15/47/941061547.db2.gz GUVIJXGRUMRAEX-CQSZACIVSA-N 0 3 409.397 4.003 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1ccc(C#N)c(Cl)c1 ZINC000547636074 941069779 /nfs/dbraw/zinc/06/97/79/941069779.db2.gz AOCXIEPVDJNVHR-FQEVSTJZSA-N 0 3 419.916 4.416 20 0 HIADHN CN1CCN(C[C@H](N[C@H]2CCCc3ncc(C(F)(F)F)cc32)c2ccccc2)CC1 ZINC000547654104 941070625 /nfs/dbraw/zinc/07/06/25/941070625.db2.gz STLDFQARWKOBPY-VXKWHMMOSA-N 0 3 418.507 4.056 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N[C@@H]1CCOc2ccc(F)cc21)c1cccc(OC)c1 ZINC000547699807 941072449 /nfs/dbraw/zinc/07/24/49/941072449.db2.gz SVYZTXKSPWFIDK-RTWAWAEBSA-N 0 3 415.509 4.040 20 0 HIADHN Cc1ccnc2c1cccc2S(=O)(=O)N(C)[C@H]1CCN(Cc2ccccc2)[C@@H](C)C1 ZINC000547966469 941081187 /nfs/dbraw/zinc/08/11/87/941081187.db2.gz PMTCHMYPWVGPMX-FPOVZHCZSA-N 0 3 423.582 4.217 20 0 HIADHN CN1CCN(C[C@@H](NCc2cc(Cl)cc(C(F)(F)F)c2)c2ccccc2)CC1 ZINC000548032386 941083618 /nfs/dbraw/zinc/08/36/18/941083618.db2.gz GBDLDRINRNCNPM-HXUWFJFHSA-N 0 3 411.899 4.437 20 0 HIADHN C[C@@H](CN[C@@H]1CCS(=O)(=O)c2ccc(Br)cc21)C1CCCCC1 ZINC000548155974 941089754 /nfs/dbraw/zinc/08/97/54/941089754.db2.gz YWJDHFJEPMQQGS-SUMWQHHRSA-N 0 3 400.382 4.474 20 0 HIADHN C[C@H](NCc1ccc(N2CCCS2(=O)=O)c(F)c1)c1ccccc1C(F)(F)F ZINC000548159048 941090011 /nfs/dbraw/zinc/09/00/11/941090011.db2.gz BNFDEKNLTKIGCW-ZDUSSCGKSA-N 0 3 416.440 4.235 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccnc2)C1)N1C[C@H](c2ccccc2)[C@H]2CCCC[C@@H]21 ZINC000548253302 941092426 /nfs/dbraw/zinc/09/24/26/941092426.db2.gz HAYGXTYWUXBFQI-VPBXCIAMSA-N 0 3 403.570 4.478 20 0 HIADHN C[C@H](C(=O)Nc1ccc(Oc2ccc(S(C)(=O)=O)cc2)cc1)N1[C@H](C)CC[C@@H]1C ZINC000548372863 941098204 /nfs/dbraw/zinc/09/82/04/941098204.db2.gz DZCDCPMESZBHNE-IXDOHACOSA-N 0 3 416.543 4.082 20 0 HIADHN COc1ccc([C@H](CNC(=O)N[C@@H](C(C)(C)C)C(F)(F)F)N2CCCC2)cc1 ZINC000548510296 941111303 /nfs/dbraw/zinc/11/13/03/941111303.db2.gz DEDFTNAQQAFWOS-IRXDYDNUSA-N 0 3 401.473 4.108 20 0 HIADHN O=C(NCC1(c2ccc(Cl)cc2Cl)CCOCC1)[C@@H](C1CC1)N1CCCC1 ZINC000548508400 941111337 /nfs/dbraw/zinc/11/13/37/941111337.db2.gz DUUARGXEVKNGPQ-LJQANCHMSA-N 0 3 411.373 4.032 20 0 HIADHN CC(C)([C@H](NC(=O)CCc1ccccc1O)c1ccc(F)c(F)c1)N1CCCC1 ZINC000548605986 941114072 /nfs/dbraw/zinc/11/40/72/941114072.db2.gz RXSHZDDFHZQWJG-JOCHJYFZSA-N 0 3 402.485 4.335 20 0 HIADHN COc1ccc(NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)c2ncccc12 ZINC000548723862 941121614 /nfs/dbraw/zinc/12/16/14/941121614.db2.gz SLFIWQSLPPVAGT-UHFFFAOYSA-N 0 3 422.451 4.170 20 0 HIADHN O=C([C@H]1CCCN(Cc2cccnc2)C1)N1CC[C@@H](C(F)(F)F)c2ccccc21 ZINC000548773546 941123243 /nfs/dbraw/zinc/12/32/43/941123243.db2.gz NYYCAKUHPGDZHI-PKOBYXMFSA-N 0 3 403.448 4.376 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccnc2)C1)N1CC[C@@H](C(F)(F)F)c2ccccc21 ZINC000548773544 941123271 /nfs/dbraw/zinc/12/32/71/941123271.db2.gz NYYCAKUHPGDZHI-IEBWSBKVSA-N 0 3 403.448 4.376 20 0 HIADHN COc1cccc(OC)c1OC[C@@H](O)CNC(c1cccc(C)c1)c1cccc(C)c1 ZINC000548770310 941123289 /nfs/dbraw/zinc/12/32/89/941123289.db2.gz NXLBOZHZYMIXJQ-QFIPXVFZSA-N 0 3 421.537 4.440 20 0 HIADHN COc1ccc2ccccc2c1-c1cc(CN2CCC[C@@H](c3ccnc(N)n3)C2)on1 ZINC000548931935 941130659 /nfs/dbraw/zinc/13/06/59/941130659.db2.gz IIMSHMOZOIYATC-QGZVFWFLSA-N 0 3 415.497 4.255 20 0 HIADHN COc1cc(CNC[C@@H](O)COc2ccccc2Cl)ccc1OC1CCCC1 ZINC000548950661 941132713 /nfs/dbraw/zinc/13/27/13/941132713.db2.gz SMCRRGOKJNNBCL-QGZVFWFLSA-N 0 3 405.922 4.200 20 0 HIADHN CCC(=O)Nc1ccc(C)c(NC(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)c1 ZINC000548954625 941133555 /nfs/dbraw/zinc/13/35/55/941133555.db2.gz NCKOARQEHIEKEU-LJQANCHMSA-N 0 3 402.926 4.421 20 0 HIADHN Cc1c(NC(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)cnn1-c1ccccc1F ZINC000548957825 941134151 /nfs/dbraw/zinc/13/41/51/941134151.db2.gz UCVHHKVGFLPSMY-LJQANCHMSA-N 0 3 415.900 4.398 20 0 HIADHN CC(=O)Nc1ccc(Cl)c(NC(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)c1 ZINC000548973726 941137042 /nfs/dbraw/zinc/13/70/42/941137042.db2.gz GFSGBHCUTBWVFC-SFHVURJKSA-N 0 3 409.317 4.376 20 0 HIADHN CN(C)[C@H](CNC(=O)Nc1ccc(NC(=O)CC(F)(F)F)cc1)c1ccccc1 ZINC000549057545 941149934 /nfs/dbraw/zinc/14/99/34/941149934.db2.gz GSYCNMPCRLNSPV-QGZVFWFLSA-N 0 3 408.424 4.002 20 0 HIADHN CCOc1ccccc1NC(=O)CN[C@H]1CCN(CC)[C@H]1c1ccc(Cl)c(F)c1 ZINC000549111306 941160792 /nfs/dbraw/zinc/16/07/92/941160792.db2.gz PCIUABXBEQWARJ-UGKGYDQZSA-N 0 3 419.928 4.241 20 0 HIADHN CCc1ccccc1NC(=O)CN[C@@H]1CCN(C(C)C)[C@H]1c1ccc(F)c(F)c1 ZINC000549114030 941161137 /nfs/dbraw/zinc/16/11/37/941161137.db2.gz PLMPYGPDWUGPPZ-GGAORHGYSA-N 0 3 401.501 4.279 20 0 HIADHN Cc1ccc(NC(=O)CN[C@@H]2CCN(C(C)C)[C@H]2c2ccc(F)c(F)c2)c(F)c1 ZINC000549114130 941161177 /nfs/dbraw/zinc/16/11/77/941161177.db2.gz ULCCMXQRUKCTFV-IRLDBZIGSA-N 0 3 405.464 4.164 20 0 HIADHN COc1cccc([C@@H]2[C@H](NCC(=O)Nc3ccc(C)cc3Cl)CCN2C2CC2)c1 ZINC000549118292 941161914 /nfs/dbraw/zinc/16/19/14/941161914.db2.gz RWKQADKITMWFNQ-FYYLOGMGSA-N 0 3 413.949 4.163 20 0 HIADHN CCCCCn1cc(CNC(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)c(C)n1 ZINC000549122889 941162428 /nfs/dbraw/zinc/16/24/28/941162428.db2.gz TXPYRFBELMRGET-FQEVSTJZSA-N 0 3 405.974 4.137 20 0 HIADHN CN(C)C[C@@H](NC(=O)NCC1CCN(c2ccccc2)CC1)c1ccc(Cl)cc1 ZINC000549195826 941170351 /nfs/dbraw/zinc/17/03/51/941170351.db2.gz ADCGVOMWUYWYBN-JOCHJYFZSA-N 0 3 414.981 4.159 20 0 HIADHN CN(C)CCN(CC1CCCCC1)C(=O)CCc1nnc(-c2cc3ccccc3o2)o1 ZINC000549231366 941172594 /nfs/dbraw/zinc/17/25/94/941172594.db2.gz YXVMGQLDGFIMTF-UHFFFAOYSA-N 0 3 424.545 4.386 20 0 HIADHN C[C@@]1(CNS(=O)(=O)Cc2ccc(C(F)F)cc2)CCCN1Cc1ccccc1 ZINC000549405799 941186782 /nfs/dbraw/zinc/18/67/82/941186782.db2.gz LIEFAENGDRUFIM-NRFANRHFSA-N 0 3 408.514 4.098 20 0 HIADHN CC(C)N1CC[C@@H](N[C@@H](C)C(=O)Nc2ccc(Cl)cn2)[C@@H]1c1ccc(F)c(F)c1 ZINC000549468439 941192968 /nfs/dbraw/zinc/19/29/68/941192968.db2.gz KSADBWQZIKCSPG-VIZZQPHQSA-N 0 3 422.907 4.154 20 0 HIADHN CCN1CC[C@H](NCC(=O)Nc2cccc(SC)c2)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000549472356 941193591 /nfs/dbraw/zinc/19/35/91/941193591.db2.gz MZKYJMFZFJMZFM-GHTZIAJQSA-N 0 3 423.504 4.189 20 0 HIADHN CCN1CC[C@H](N[C@H](C)C(=O)Nc2ccc(C)cc2C)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000549476060 941194305 /nfs/dbraw/zinc/19/43/05/941194305.db2.gz HPJMTZVLHARJHI-UPKQVVFYSA-N 0 3 419.491 4.473 20 0 HIADHN CCN1CC[C@H](NCC(=O)Nc2cc(C)ccc2C)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000549476160 941194325 /nfs/dbraw/zinc/19/43/25/941194325.db2.gz JLZKLLWHSLRJMH-PGRDOPGGSA-N 0 3 405.464 4.084 20 0 HIADHN COc1cccc([C@H]2[C@@H](NCC(=O)Nc3ccccc3C(C)C)CCN2C2CC2)c1 ZINC000549477726 941194844 /nfs/dbraw/zinc/19/48/44/941194844.db2.gz MWQNDJJGWPNVIW-ZCYQVOJMSA-N 0 3 407.558 4.325 20 0 HIADHN CN(CC(F)(F)F)C(=O)CN[C@H]1CCN(C(C)(C)C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000549479068 941194896 /nfs/dbraw/zinc/19/48/96/941194896.db2.gz XGRMHHNIEUVNCY-RDJZCZTQSA-N 0 3 423.882 4.003 20 0 HIADHN C[C@H](c1ccc(F)cc1)N1CC[C@@H](N2CCC(c3c[nH]c4ncccc34)CC2)C1=O ZINC000549526845 941198112 /nfs/dbraw/zinc/19/81/12/941198112.db2.gz ATIQIZVBMKOZSQ-OPAMFIHVSA-N 0 3 406.505 4.244 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@H](N[C@@H](CN2CCOCC2)c2ccc(C)cc2)c2ccccc21 ZINC000549527866 941198124 /nfs/dbraw/zinc/19/81/24/941198124.db2.gz OXFPFFIXZGZIEU-DSITVLBTSA-N 0 3 422.569 4.140 20 0 HIADHN c1ccc(CN2CCN(c3nnc(C4CCOCC4)s3)CC23CCCCC3)cc1 ZINC000549528133 941198170 /nfs/dbraw/zinc/19/81/70/941198170.db2.gz STQNWUMHSLTPAC-UHFFFAOYSA-N 0 3 412.603 4.457 20 0 HIADHN CC[C@@H](C)c1nnc(N2CCN(C3CCC(C(C)C)CC3)CC2)n1C[C@@H]1CCOC1 ZINC000549652258 941203040 /nfs/dbraw/zinc/20/30/40/941203040.db2.gz WZIOPCHCTZYQHW-GEOZSUPMSA-N 0 3 417.642 4.165 20 0 HIADHN CC[C@@H](C)c1nnc(N2CCN(C3CCC(C(C)C)CC3)CC2)n1C[C@H]1CCOC1 ZINC000549652259 941203072 /nfs/dbraw/zinc/20/30/72/941203072.db2.gz WZIOPCHCTZYQHW-JTVPBKEVSA-N 0 3 417.642 4.165 20 0 HIADHN CCc1nc2cc(CNCc3ccc(O[C@H](C)C(=O)OC)cc3)ccc2n1C1CC1 ZINC000549809359 941208070 /nfs/dbraw/zinc/20/80/70/941208070.db2.gz OHJKPLLSBRCTJB-MRXNPFEDSA-N 0 3 407.514 4.164 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)[C@H](C)Cc2cnc3ccccc3n2)N2CCCC2)cc1 ZINC000549886721 941228412 /nfs/dbraw/zinc/22/84/12/941228412.db2.gz XRFNVEJFRFCBNN-NTKDMRAZSA-N 0 3 402.542 4.070 20 0 HIADHN CC(=O)c1ccc2c(c1)CCN(C[C@@H](O)CO[C@@H](C)c1ccc(Cl)cc1)CC2 ZINC000549970623 941255146 /nfs/dbraw/zinc/25/51/46/941255146.db2.gz JPXURRLWAGICPC-GAJHUEQPSA-N 0 3 401.934 4.082 20 0 HIADHN Fc1ccc(-c2nc(CCNCc3c(Cl)cccc3N3CCOCC3)co2)cc1 ZINC000550123771 941287141 /nfs/dbraw/zinc/28/71/41/941287141.db2.gz ZBFJACWXLPCZHB-UHFFFAOYSA-N 0 3 415.896 4.303 20 0 HIADHN COc1cc(C[NH2+]C2(Cc3cccc(F)c3)CCOCC2)cc(Br)c1[O-] ZINC000550274940 941307868 /nfs/dbraw/zinc/30/78/68/941307868.db2.gz IKWVTZFPZCOQEY-UHFFFAOYSA-N 0 3 424.310 4.184 20 0 HIADHN C[C@H](c1ccc(F)cc1)N1CCC[C@H](NCc2ccc(Oc3cnccn3)cc2)C1=O ZINC000550292751 941310189 /nfs/dbraw/zinc/31/01/89/941310189.db2.gz CBUKGHXVVDRHJT-VGSWGCGISA-N 0 3 420.488 4.250 20 0 HIADHN CC[C@H](N[C@H]1CCCN([C@@H](C)c2ccccc2F)C1=O)c1ccc2c(c1)OCCO2 ZINC000550860519 941375305 /nfs/dbraw/zinc/37/53/05/941375305.db2.gz KULLQLKOTAIAGZ-NDXORKPFSA-N 0 3 412.505 4.390 20 0 HIADHN COc1ccc([C@H](C)NCCCS(=O)(=O)c2ccc(Cl)cc2)c(C)c1OC ZINC000550938776 941383788 /nfs/dbraw/zinc/38/37/88/941383788.db2.gz HFCSHTXKTKVHPP-HNNXBMFYSA-N 0 3 411.951 4.180 20 0 HIADHN CCO[C@@H]1C[C@H](N[C@H]2CCSc3ccc(Br)cc32)[C@@H]1n1cccn1 ZINC000550947137 941384370 /nfs/dbraw/zinc/38/43/70/941384370.db2.gz XECLUZODOLGARR-CUSZFKRNSA-N 0 3 408.365 4.191 20 0 HIADHN CSc1cccc(N(C(=O)c2cccc(OCC(F)F)n2)C2CCN(C)CC2)c1 ZINC000550977548 941389714 /nfs/dbraw/zinc/38/97/14/941389714.db2.gz GKOPDNHCGWPIKK-UHFFFAOYSA-N 0 3 421.513 4.188 20 0 HIADHN O[C@H](CNCc1ccccc1OCC(F)(F)F)COc1cccc2ccccc21 ZINC000551000255 941392690 /nfs/dbraw/zinc/39/26/90/941392690.db2.gz KGEFSIRXFXLBJE-GOSISDBHSA-N 0 3 405.416 4.310 20 0 HIADHN CN(C(=O)C(C)(C)c1csc(-c2c(F)cccc2F)n1)[C@H]1CCN(C2CC2)C1 ZINC000551015084 941395275 /nfs/dbraw/zinc/39/52/75/941395275.db2.gz VAWLOBFJOKOCJL-AWEZNQCLSA-N 0 3 405.514 4.061 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)Nc2ccc(Oc3cccnc3)nc2)CN1Cc1ccccc1 ZINC000551026847 941396740 /nfs/dbraw/zinc/39/67/40/941396740.db2.gz CMCWIGZNGYQNTE-YLJYHZDGSA-N 0 3 403.486 4.053 20 0 HIADHN Fc1ccc([C@H](NC[C@@H]2CCCCN2Cc2cccc(Cl)c2)c2nnc[nH]2)cc1 ZINC000551050351 941400776 /nfs/dbraw/zinc/40/07/76/941400776.db2.gz FXCMCKWHMHSMBG-SFTDATJTSA-N 0 3 413.928 4.331 20 0 HIADHN Cc1c(Cl)cccc1NC(=O)[C@H](C)N[C@@H]1CCN(C)[C@@H]1c1ccc(F)c(F)c1 ZINC000551093614 941408922 /nfs/dbraw/zinc/40/89/22/941408922.db2.gz PMKKZFMEXGXXHD-CJMONDIMSA-N 0 3 407.892 4.289 20 0 HIADHN Cc1c(Cl)cccc1NC(=O)[C@H](C)N[C@H]1CCN(C)[C@@H]1c1ccc(F)c(F)c1 ZINC000551093633 941409013 /nfs/dbraw/zinc/40/90/13/941409013.db2.gz PMKKZFMEXGXXHD-QTJFZDIUSA-N 0 3 407.892 4.289 20 0 HIADHN C[C@H](N[C@H]1CCCN([C@@H](C)c2ccc(F)cc2)C1=O)c1ccc(-n2cccn2)cc1 ZINC000551274793 941441474 /nfs/dbraw/zinc/44/14/74/941441474.db2.gz NFTBDBWZAJZLQO-BSRJHKFKSA-N 0 3 406.505 4.414 20 0 HIADHN Fc1ccc([C@@H](N[C@H]2C[C@H](c3ccc(F)c(Br)c3)C2)c2c[nH]nn2)cc1 ZINC000551305498 941447695 /nfs/dbraw/zinc/44/76/95/941447695.db2.gz YGRCFNJCUCTSQT-ZXYWRSMDSA-N 0 3 419.273 4.471 20 0 HIADHN CCCN(Cc1nnc(-c2cc(C)oc2C)o1)C1CCN(C(=O)c2ccccc2)CC1 ZINC000551415490 941474209 /nfs/dbraw/zinc/47/42/09/941474209.db2.gz SALYHNQSOGDKCI-UHFFFAOYSA-N 0 3 422.529 4.463 20 0 HIADHN Cc1ccc([C@H](NC[C@@H]2CN(Cc3ccccc3)CCCO2)c2ccccn2)cc1 ZINC000551448652 941481513 /nfs/dbraw/zinc/48/15/13/941481513.db2.gz WOIOEVBFXJSMCP-RSXGOPAZSA-N 0 3 401.554 4.360 20 0 HIADHN CC(C)(C)N1C[C@@H](C(=O)N2CCC[C@@H]2CC(=O)c2cccs2)[C@H](C(F)(F)F)C1 ZINC000551468929 941486140 /nfs/dbraw/zinc/48/61/40/941486140.db2.gz YFLOSEGOZXOUIZ-RBSFLKMASA-N 0 3 416.509 4.221 20 0 HIADHN COc1ncc([C@H](C)N[C@@H](C)c2cc(F)ccc2N2CCN(C)CC2)cc1Cl ZINC000551530206 941495838 /nfs/dbraw/zinc/49/58/38/941495838.db2.gz OZEOGWWUDOGIOW-GJZGRUSLSA-N 0 3 406.933 4.046 20 0 HIADHN COc1ncc([C@H](C)NC[C@H](O)COc2cccc(Cl)c2Cl)cc1Cl ZINC000551529990 941495956 /nfs/dbraw/zinc/49/59/56/941495956.db2.gz LFWJWIUDBMAMQN-JQWIXIFHSA-N 0 3 405.709 4.141 20 0 HIADHN C[C@H](CC(=O)Nc1cccc(C(F)(F)F)c1)NCc1ccnc(OC(F)F)c1 ZINC000551565268 941502396 /nfs/dbraw/zinc/50/23/96/941502396.db2.gz SPQZFILNCARCTG-LLVKDONJSA-N 0 3 403.351 4.209 20 0 HIADHN CN1CCN(c2cc(CNCc3ccc(-c4ccc(Cl)cc4)cc3)ccn2)CC1 ZINC000551577251 941505496 /nfs/dbraw/zinc/50/54/96/941505496.db2.gz ZXSJRFKIBXRXGD-UHFFFAOYSA-N 0 3 406.961 4.444 20 0 HIADHN O=C(N[C@H](CCCO)c1ccccc1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000551680695 941525837 /nfs/dbraw/zinc/52/58/37/941525837.db2.gz UITFETXFACKNMJ-IFMALSPDSA-N 0 3 420.475 4.071 20 0 HIADHN CC(C)CO[C@@H]1C[C@@H](NCc2cc(C(F)(F)F)cc(S(C)(=O)=O)c2)C1(C)C ZINC000551781147 941544304 /nfs/dbraw/zinc/54/43/04/941544304.db2.gz WOHOAHICVCVHKX-IAGOWNOFSA-N 0 3 407.498 4.038 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)c2sc(-c3cccs3)nc2C)cc1 ZINC000551793198 941546087 /nfs/dbraw/zinc/54/60/87/941546087.db2.gz HYVJTKPANUVOON-MRXNPFEDSA-N 0 3 401.557 4.221 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)c2cccc(COc3ccc(C)nc3)c2)cc1 ZINC000551793711 941546275 /nfs/dbraw/zinc/54/62/75/941546275.db2.gz GPVXKKGSDSUZHW-XMMPIXPASA-N 0 3 419.525 4.010 20 0 HIADHN CCOCCCNC(=O)C1CCN(Cc2cnc(-c3ccc(Cl)cc3)s2)CC1 ZINC000551804582 941548187 /nfs/dbraw/zinc/54/81/87/941548187.db2.gz BOSKLVNEGSBLRK-UHFFFAOYSA-N 0 3 421.994 4.218 20 0 HIADHN COC(=O)[C@@H](C)Oc1ccc(CN[C@@H](c2cncc(Br)c2)C2CC2)cc1 ZINC000551811837 941550057 /nfs/dbraw/zinc/55/00/57/941550057.db2.gz HYVMANMLGRDJCN-BFUOFWGJSA-N 0 3 419.319 4.025 20 0 HIADHN C[C@H](N[C@@H](CO)C[C@@H](O)C(C)(C)C)c1ccc(Br)cc1C(F)(F)F ZINC000551816287 941551629 /nfs/dbraw/zinc/55/16/29/941551629.db2.gz IOLPETMVGRVIII-JVLSTEMRSA-N 0 3 412.290 4.277 20 0 HIADHN CC1(C)C[C@@H](NCc2cccc(N3C(=O)N[C@@](C)(C4CC4)C3=O)c2)c2ccccc21 ZINC000551818092 941552221 /nfs/dbraw/zinc/55/22/21/941552221.db2.gz SYDQPQQAZQBMAQ-BWKNWUBXSA-N 0 3 403.526 4.424 20 0 HIADHN CN(C)c1noc([C@H]2CCCN(Cc3cnc(-c4ccc(Cl)cc4)s3)C2)n1 ZINC000551820949 941552885 /nfs/dbraw/zinc/55/28/85/941552885.db2.gz GBJTXITVGDUYKL-AWEZNQCLSA-N 0 3 403.939 4.292 20 0 HIADHN CCOc1cc(CN(Cc2ccccc2C)C2CC2)ccc1O[C@@H](C)C(=O)N(C)C ZINC000551930986 941562241 /nfs/dbraw/zinc/56/22/41/941562241.db2.gz VTRLSBXXXFCAJN-IBGZPJMESA-N 0 3 410.558 4.414 20 0 HIADHN O[C@@H](CN[C@@H]1CCCOc2ccc(F)cc21)COc1cc(Cl)ccc1Cl ZINC000552029156 941570672 /nfs/dbraw/zinc/57/06/72/941570672.db2.gz LDOQXNXQKPCTJE-WMLDXEAASA-N 0 3 400.277 4.376 20 0 HIADHN C[C@@H](CC(=O)Nc1cccc(C(F)(F)F)c1)N[C@H](CC(=O)N(C)C)c1ccccc1 ZINC000552073628 941579594 /nfs/dbraw/zinc/57/95/94/941579594.db2.gz LJZQTADXXIJELX-HNAYVOBHSA-N 0 3 421.463 4.232 20 0 HIADHN COc1ccc([C@H](C)NC[C@H]2CC[C@@H](c3nc(C4CC4)no3)O2)c(Br)c1 ZINC000552091229 941583016 /nfs/dbraw/zinc/58/30/16/941583016.db2.gz GAYKETDVMYWWCX-KHIZAZIESA-N 0 3 422.323 4.289 20 0 HIADHN CNC(=O)COc1cccc(CN[C@@H](Cc2ccc(F)cc2)c2ccc(OC)cc2)c1 ZINC000552090195 941583025 /nfs/dbraw/zinc/58/30/25/941583025.db2.gz DKPXEHOXYKOEGR-DEOSSOPVSA-N 0 3 422.500 4.033 20 0 HIADHN CS(=O)(=O)C1(CN[C@H]2CCCc3nc(-c4ccc(F)cc4)sc32)CCCC1 ZINC000552098811 941584860 /nfs/dbraw/zinc/58/48/60/941584860.db2.gz PBXTYQGNKQBHFB-INIZCTEOSA-N 0 3 408.564 4.274 20 0 HIADHN FC(F)Cn1cc(CNCCOc2ccc3cc(Br)ccc3c2)cn1 ZINC000552102441 941585364 /nfs/dbraw/zinc/58/53/64/941585364.db2.gz MTPWGOXUDCIQAO-UHFFFAOYSA-N 0 3 410.262 4.233 20 0 HIADHN CC(=O)c1cc(Br)ccc1OCC(=O)Nc1cc(C)cc(CN(C)C)c1 ZINC000552132804 941591195 /nfs/dbraw/zinc/59/11/95/941591195.db2.gz JKPSSAARKQUYED-UHFFFAOYSA-N 0 3 419.319 4.039 20 0 HIADHN COc1cccc([C@@H](CNC(=O)CCc2ccc3ccccc3n2)N2CCCC2)c1 ZINC000552196092 941599767 /nfs/dbraw/zinc/59/97/67/941599767.db2.gz RIAZKVUTXWISRX-XMMPIXPASA-N 0 3 403.526 4.129 20 0 HIADHN O[C@@H](CN[C@H]1CCOc2c(Cl)cccc21)COc1c(Cl)cccc1Cl ZINC000552226747 941608529 /nfs/dbraw/zinc/60/85/29/941608529.db2.gz OLZAUMDKFKOTSG-ZBEGNZNMSA-N 0 3 402.705 4.500 20 0 HIADHN CC[C@H](N[C@@H](C)c1cccc(S(=O)(=O)NC)c1)c1ccc(OC(F)(F)F)cc1 ZINC000552247638 941613440 /nfs/dbraw/zinc/61/34/40/941613440.db2.gz WBFFWFVVZPHMAP-UGSOOPFHSA-N 0 3 416.465 4.295 20 0 HIADHN CO[C@@H]1C[C@H](c2ccccc2)CC[C@@H]1N[C@H](C)C(=O)Nc1ccc2c(c1)OCCCO2 ZINC000552270792 941619384 /nfs/dbraw/zinc/61/93/84/941619384.db2.gz CJXGEJGQWRKENJ-HCOVKFPFSA-N 0 3 424.541 4.116 20 0 HIADHN C[C@@H]1CSc2ccc(Br)cc2[C@@H]1NCC1(S(C)(=O)=O)CCCC1 ZINC000552338646 941638050 /nfs/dbraw/zinc/63/80/50/941638050.db2.gz LAWKOKPWSYDCPC-MLGOLLRUSA-N 0 3 418.422 4.179 20 0 HIADHN C[C@H](Cn1cc(Br)cn1)N[C@H](CCO)c1ccc(Cl)c(Cl)c1 ZINC000552342552 941638733 /nfs/dbraw/zinc/63/87/33/941638733.db2.gz OCSKAONNQOPKKU-MEBBXXQBSA-N 0 3 407.139 4.054 20 0 HIADHN C[C@@H](Cn1cc(Br)cn1)N[C@H](CCO)c1ccc(Cl)c(Cl)c1 ZINC000552342553 941638843 /nfs/dbraw/zinc/63/88/43/941638843.db2.gz OCSKAONNQOPKKU-ZUZCIYMTSA-N 0 3 407.139 4.054 20 0 HIADHN CCN(CC(F)(F)F)C(=O)[C@@H]1CCCN(Cc2cc(C)ccc2OC(F)F)C1 ZINC000552346572 941639785 /nfs/dbraw/zinc/63/97/85/941639785.db2.gz SZXMXORADUVBCI-CQSZACIVSA-N 0 3 408.411 4.219 20 0 HIADHN CN(CCCN(C)C(=O)c1csc(-c2ccccc2Cl)n1)Cc1ccncc1 ZINC000552360864 941644014 /nfs/dbraw/zinc/64/40/14/941644014.db2.gz VZYSWUQVQRRVHT-UHFFFAOYSA-N 0 3 414.962 4.453 20 0 HIADHN O=C(CCCOc1cccc(Cl)c1Cl)Nc1cccc(CN2CC[C@@H](O)C2)c1 ZINC000552514399 941691472 /nfs/dbraw/zinc/69/14/72/941691472.db2.gz BLTVRIIUAWKGPH-QGZVFWFLSA-N 0 3 423.340 4.358 20 0 HIADHN Cc1cc(Br)ccc1NC(=O)CN[C@@H](C)c1ccccc1-n1cccn1 ZINC000552536497 941700906 /nfs/dbraw/zinc/70/09/06/941700906.db2.gz HODMSHUKYXEFTC-HNNXBMFYSA-N 0 3 413.319 4.233 20 0 HIADHN CCCN(C)[C@H](CNC(=O)c1cc(OC)c(OC)c(OC)c1)c1ccc(Cl)cc1 ZINC000552584803 941714711 /nfs/dbraw/zinc/71/47/11/941714711.db2.gz VPNKHOCGBZNRHO-GOSISDBHSA-N 0 3 420.937 4.179 20 0 HIADHN COc1cc(CN2CCCN(Cc3ccc(C(F)(F)F)cc3)CC2)cc(OC)c1O ZINC000552670055 941733271 /nfs/dbraw/zinc/73/32/71/941733271.db2.gz PETHCXCCCRLZHU-UHFFFAOYSA-N 0 3 424.463 4.136 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Cn1cnc2ccccc21)c1ccc(C(F)(F)F)cc1 ZINC000552687143 941737937 /nfs/dbraw/zinc/73/79/37/941737937.db2.gz ZQTGTLQGEZFWIJ-FQEVSTJZSA-N 0 3 418.463 4.254 20 0 HIADHN COc1ccc(Cn2cc(NC(=O)c3oc4ccccc4c3CN(C)C)cn2)cc1 ZINC000552804566 941768717 /nfs/dbraw/zinc/76/87/17/941768717.db2.gz JGJUMAFHUXQITM-UHFFFAOYSA-N 0 3 404.470 4.000 20 0 HIADHN CCOc1ccc(CN(CCCn2ccnc2)Cc2c(C)nc3ccccn32)cc1 ZINC000552858744 941790009 /nfs/dbraw/zinc/79/00/09/941790009.db2.gz KPVIIZASYVYUQZ-UHFFFAOYSA-N 0 3 403.530 4.330 20 0 HIADHN CCS(=O)(=O)c1ccc([C@@H](C)NCCc2nc(-c3ccc(Cl)cc3)no2)cc1 ZINC000552904742 941800855 /nfs/dbraw/zinc/80/08/55/941800855.db2.gz VESUGCCOUJQKFQ-CQSZACIVSA-N 0 3 419.934 4.077 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(-n2cccn2)cc1)C(=O)Nc1ccccc1OC(F)F ZINC000553034433 941820848 /nfs/dbraw/zinc/82/08/48/941820848.db2.gz HDZAYHBEQIFTFE-GJZGRUSLSA-N 0 3 400.429 4.152 20 0 HIADHN C[C@H](N[C@@H](C)c1cccc(N2CCCC2)c1)C(=O)Nc1ccc(N2CCCC2=O)cc1 ZINC000553076114 941828861 /nfs/dbraw/zinc/82/88/61/941828861.db2.gz DWODYYKXAYXSRH-OALUTQOASA-N 0 3 420.557 4.091 20 0 HIADHN O=C([C@@H]1CCCC[C@H]1C(F)(F)F)N1CCC[C@@H](c2n[nH]cc2CN2CCCC2)C1 ZINC000553180832 941845429 /nfs/dbraw/zinc/84/54/29/941845429.db2.gz JYLHIRYLTVKVOB-KBAYOESNSA-N 0 3 412.500 4.080 20 0 HIADHN O=C(COc1ccsc1)N(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000553196333 941847543 /nfs/dbraw/zinc/84/75/43/941847543.db2.gz KHJQZOXHUBOIAH-JOCHJYFZSA-N 0 3 421.566 4.215 20 0 HIADHN Cc1ccc(C(=O)N(Cc2ccncc2)[C@H]2CCCN(Cc3ccccc3)C2)cc1O ZINC000553196616 941847896 /nfs/dbraw/zinc/84/78/96/941847896.db2.gz WJFBQHGWERTOOD-DEOSSOPVSA-N 0 3 415.537 4.403 20 0 HIADHN CCc1ccc([C@H](CNC(=O)Nc2cccc(Cl)c2OCCOC)N(C)C)cc1 ZINC000553238339 941854738 /nfs/dbraw/zinc/85/47/38/941854738.db2.gz BTTPJMXYCYZLON-FQEVSTJZSA-N 0 3 419.953 4.352 20 0 HIADHN Cc1cc2cc(C(=O)N3CCN(C4CCC4)C[C@@H](C)C3)oc2c(Br)c1 ZINC000553524375 941902564 /nfs/dbraw/zinc/90/25/64/941902564.db2.gz INCOYAIAJLUNLL-CQSZACIVSA-N 0 3 405.336 4.450 20 0 HIADHN CC[C@H](NC(=O)N[C@@H](CN1CCCC1)c1ccccc1)c1ccc(OC)c(OC)c1 ZINC000553734421 941954754 /nfs/dbraw/zinc/95/47/54/941954754.db2.gz YFTHGOXWDLFULO-SFTDATJTSA-N 0 3 411.546 4.291 20 0 HIADHN Cc1nn(-c2ccccc2C)c2sc(C(=O)N3CC[C@H](N4CCCC4)[C@@H]3C)cc12 ZINC000553774392 941964908 /nfs/dbraw/zinc/96/49/08/941964908.db2.gz KZMAKQMFVUWPAJ-PXNSSMCTSA-N 0 3 408.571 4.403 20 0 HIADHN Cc1cc(C(=O)N2CCN([C@@H]3C[C@@H]3C)C[C@H](C)C2)nn1-c1ccc(Cl)c(Cl)c1 ZINC000553782639 941967857 /nfs/dbraw/zinc/96/78/57/941967857.db2.gz CRFKZRIZZBJEFL-PJSUUKDQSA-N 0 3 421.372 4.290 20 0 HIADHN Cc1cccc(C(=O)Nc2ccccc2C(=O)N2CCN([C@@H]3C[C@H]3C)C[C@@H](C)C2)c1 ZINC000553783179 941967982 /nfs/dbraw/zinc/96/79/82/941967982.db2.gz NVQYSWPJHNBPNE-DNVFCKCGSA-N 0 3 405.542 4.050 20 0 HIADHN O=c1cc(CN2CCC(c3c[nH]c4ccc(F)cc43)CC2)nc2ccc(Cl)cn12 ZINC000553991874 942015034 /nfs/dbraw/zinc/01/50/34/942015034.db2.gz MODWIRFDOBOOPS-UHFFFAOYSA-N 0 3 410.880 4.348 20 0 HIADHN Cc1ccnn1-c1ccc(C(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)cc1 ZINC000554015039 942019261 /nfs/dbraw/zinc/01/92/61/942019261.db2.gz HXIMKTDPRRATCQ-HSZRJFAPSA-N 0 3 406.530 4.001 20 0 HIADHN CCOc1cc2c(cc1NC(=O)NC[C@H](N[C@@H](C)CC)c1ccco1)O[C@@H](C)C2 ZINC000554068048 942028898 /nfs/dbraw/zinc/02/88/98/942028898.db2.gz SFMGQVUUXJQJSO-MPGHIAIKSA-N 0 3 401.507 4.253 20 0 HIADHN C[C@H]1C[C@H](N[C@@H]2CCCN(S(=O)(=O)c3cccs3)C2)c2ccsc2S1 ZINC000554089037 942034434 /nfs/dbraw/zinc/03/44/34/942034434.db2.gz PBKGJLWQQRPUIS-GUTXKFCHSA-N 0 3 414.643 4.178 20 0 HIADHN O=C(CCC(F)(F)F)N1CCC[C@@H](N[C@H]2CCCOc3cc(Cl)ccc32)C1 ZINC000554094623 942035001 /nfs/dbraw/zinc/03/50/01/942035001.db2.gz HTELFUUIGTWWQJ-ZBFHGGJFSA-N 0 3 404.860 4.477 20 0 HIADHN COc1ccc([C@@H](NC2CCC(NC(C)=O)CC2)c2ccccc2Cl)cc1OC ZINC000554117933 942041206 /nfs/dbraw/zinc/04/12/06/942041206.db2.gz LURAZLJPXDEDIW-QPFKGPCDSA-N 0 3 416.949 4.484 20 0 HIADHN Cc1ccccc1-n1ncc(C(=O)N2CCN([C@@H]3C[C@@H]3C)C[C@H](C)C2)c1C(F)(F)F ZINC000554128514 942043569 /nfs/dbraw/zinc/04/35/69/942043569.db2.gz MGTLCURHHZGVAC-URLQWDBASA-N 0 3 420.479 4.002 20 0 HIADHN Cc1ccccc1-n1ncc(C(=O)N2CCN([C@@H]3C[C@H]3C)C[C@H](C)C2)c1C(F)(F)F ZINC000554128515 942043983 /nfs/dbraw/zinc/04/39/83/942043983.db2.gz MGTLCURHHZGVAC-ZSZQSSIHSA-N 0 3 420.479 4.002 20 0 HIADHN O=C([C@H]1CCN(Cc2c(-c3ccc(Cl)cc3)nc3sccn23)C1)N1CCCC1 ZINC000554288941 942091511 /nfs/dbraw/zinc/09/15/11/942091511.db2.gz CVRZJLYRQVXANV-INIZCTEOSA-N 0 3 414.962 4.161 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)Nc2ccccc2OC(F)F)N(C)C)cc1 ZINC000554348806 942110123 /nfs/dbraw/zinc/11/01/23/942110123.db2.gz MINKDNMGHCGHQE-SFHVURJKSA-N 0 3 407.461 4.500 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)Nc1ccc(-n2nc(C)cc2C)c(F)c1)c1ccco1 ZINC000554409858 942131728 /nfs/dbraw/zinc/13/17/28/942131728.db2.gz UBBRAGYUZVPHQR-AUUYWEPGSA-N 0 3 413.497 4.472 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)Nc1cccc(NC(=O)c2ccoc2)c1)c1ccco1 ZINC000554428681 942140321 /nfs/dbraw/zinc/14/03/21/942140321.db2.gz XRTTVTGXAHYXDY-DNVCBOLYSA-N 0 3 410.474 4.376 20 0 HIADHN C[C@H](NC(=O)Nc1ccc(OCc2ccncc2)cc1)[C@H](c1ccccc1)N(C)C ZINC000554440702 942143482 /nfs/dbraw/zinc/14/34/82/942143482.db2.gz CGEFPHMGYYCDLN-FDDCHVKYSA-N 0 3 404.514 4.474 20 0 HIADHN Cc1ccc(-c2nnco2)cc1NC(=O)NC[C@H](c1ccc(OC(C)C)cc1)N(C)C ZINC000554446436 942146658 /nfs/dbraw/zinc/14/66/58/942146658.db2.gz HPSPWVDYLDVMCE-OAQYLSRUSA-N 0 3 423.517 4.257 20 0 HIADHN CN(C)C[C@@H](NC(=O)Nc1ccc(-c2noc(C(F)F)n2)cc1)c1ccc(F)cc1 ZINC000554461737 942151810 /nfs/dbraw/zinc/15/18/10/942151810.db2.gz OCEKQWXMHCZTDL-MRXNPFEDSA-N 0 3 419.407 4.238 20 0 HIADHN COc1ccc(-c2ocnc2C(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)cc1 ZINC000554781270 942234271 /nfs/dbraw/zinc/23/42/71/942234271.db2.gz ROLYSHMGGUVMLI-NRFANRHFSA-N 0 3 423.513 4.170 20 0 HIADHN O=C(CN1[C@@H]2CC[C@H]1C[C@@H](c1ccccc1)C2)NCC1(c2ccccc2)CCOCC1 ZINC000554837784 942274925 /nfs/dbraw/zinc/27/49/25/942274925.db2.gz VFGSXNIZBIVGDF-RHHYMUMYSA-N 0 3 418.581 4.262 20 0 HIADHN COC(=O)c1cc(CNCc2cn(-c3ccccc3)nc2-c2ccc(F)cc2)cn1C ZINC000554858230 942292492 /nfs/dbraw/zinc/29/24/92/942292492.db2.gz JFJMCOLCVALGJD-UHFFFAOYSA-N 0 3 418.472 4.093 20 0 HIADHN C/C=C\c1ccc(OC[C@@H](O)CNCc2ccc(F)cc2C(F)(F)F)c(OC)c1 ZINC000554863373 942297495 /nfs/dbraw/zinc/29/74/95/942297495.db2.gz RCXCRNYPPBTOMG-LIMHQNJXSA-N 0 3 413.411 4.416 20 0 HIADHN CC(C)C(=O)Nc1ccc(NC(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)cc1 ZINC000554872340 942302947 /nfs/dbraw/zinc/30/29/47/942302947.db2.gz PJMQXZZWNIKWMN-LJQANCHMSA-N 0 3 402.926 4.359 20 0 HIADHN CC(C)(C)[C@@H](CN1CCc2ccccc2C1)NC(=O)c1ncsc1C(F)(F)F ZINC000554874812 942303415 /nfs/dbraw/zinc/30/34/15/942303415.db2.gz WLDIFYBAZICMPR-OAHLLOKOSA-N 0 3 411.493 4.365 20 0 HIADHN Cc1ccc(CNCc2ccc(C)cc2-c2ccnn2C)c(OC[C@H]2CCOC2)c1 ZINC000554922282 942320593 /nfs/dbraw/zinc/32/05/93/942320593.db2.gz CLFCZCIARCQQKG-FQEVSTJZSA-N 0 3 405.542 4.409 20 0 HIADHN Cc1ccc([C@H](OC[C@H](O)CN2CC3(CCC3)[C@H]2[C@H]2CCCO2)c2ccccc2)cc1 ZINC000554959857 942334004 /nfs/dbraw/zinc/33/40/04/942334004.db2.gz JJVVKNHYTVYOAS-VEYUFSJPSA-N 0 3 421.581 4.495 20 0 HIADHN COc1cc(Cl)c(C)cc1NC(=O)CCNCc1cc(O)cc(C(F)(F)F)c1 ZINC000554971140 942338708 /nfs/dbraw/zinc/33/87/08/942338708.db2.gz LQXYCLZPGROSFT-UHFFFAOYSA-N 0 3 416.827 4.500 20 0 HIADHN COc1ccc(C[C@](C)(O)CNCc2cc(Cl)cc(Cl)c2OC)cc1OC ZINC000554980508 942342053 /nfs/dbraw/zinc/34/20/53/942342053.db2.gz FEMVBUWMCVHDFI-FQEVSTJZSA-N 0 3 414.329 4.103 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3ccc(-c4ccccn4)cc3)CC2)C[C@@H](C)O1 ZINC000555013597 942356557 /nfs/dbraw/zinc/35/65/57/942356557.db2.gz UENNTSWOYPXXEK-RTBURBONSA-N 0 3 408.546 4.102 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)Nc1ccc(OC(F)F)cc1F ZINC000555015657 942357347 /nfs/dbraw/zinc/35/73/47/942357347.db2.gz FWOOUPRQJWINGP-UHFFFAOYSA-N 0 3 417.378 4.301 20 0 HIADHN COc1ccc(-c2ccc(C)c(NC(=O)N(CCN(C)C)Cc3ccco3)c2)cn1 ZINC000555049587 942370034 /nfs/dbraw/zinc/37/00/34/942370034.db2.gz ZORVXWFFAIZEBS-UHFFFAOYSA-N 0 3 408.502 4.254 20 0 HIADHN COC(=O)c1cccc(CN[C@H]2CCN(C(C)(C)C)[C@@H]2c2ccc(Cl)c(F)c2)n1 ZINC000555127115 942394165 /nfs/dbraw/zinc/39/41/65/942394165.db2.gz AMOVQDYTVNAAGF-AZUAARDMSA-N 0 3 419.928 4.364 20 0 HIADHN CCOCCCn1c(-c2ccc3ccccc3c2)nnc1N1CCN(CC2CC2)CC1 ZINC000555307428 942470628 /nfs/dbraw/zinc/47/06/28/942470628.db2.gz UVWUKMMODQCICL-UHFFFAOYSA-N 0 3 419.573 4.057 20 0 HIADHN CC[C@H](C)c1nnc(N2CCN(Cc3ccccc3)[C@@H](CC)C2)n1C[C@@H]1CCCO1 ZINC000555400932 942516525 /nfs/dbraw/zinc/51/65/25/942516525.db2.gz TZIVJQYJBRZZBO-BVSLBCMMSA-N 0 3 411.594 4.071 20 0 HIADHN CSCc1cnc(CNC[C@H]2CCN(c3cccc(Br)c3)C2)s1 ZINC000555529566 942628193 /nfs/dbraw/zinc/62/81/93/942628193.db2.gz DKFMHRUMEPWTQE-CYBMUJFWSA-N 0 3 412.422 4.385 20 0 HIADHN CSCc1cnc(CNC[C@H]2CCN(c3ccc(Br)cc3)C2)s1 ZINC000555529179 942628924 /nfs/dbraw/zinc/62/89/24/942628924.db2.gz DKHXIRJXKADABQ-CYBMUJFWSA-N 0 3 412.422 4.385 20 0 HIADHN Cn1c(CNC2(Cc3ccc(F)cc3)CCOCC2)nnc1-c1ccc(Cl)cc1 ZINC000555567407 942646264 /nfs/dbraw/zinc/64/62/64/942646264.db2.gz DNUQIJPRZIBZOY-UHFFFAOYSA-N 0 3 414.912 4.156 20 0 HIADHN Brc1cccc(N2CC[C@@H](NCc3conc3Cc3ccccc3)C2)c1 ZINC000555584582 942655469 /nfs/dbraw/zinc/65/54/69/942655469.db2.gz YPWVEETXOMOIHZ-LJQANCHMSA-N 0 3 412.331 4.396 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)C3(Oc4ccc(Cl)cc4)CC3)c(C)c2)CC1 ZINC000555842294 942749018 /nfs/dbraw/zinc/74/90/18/942749018.db2.gz CHRCPDJNLOWNGN-UHFFFAOYSA-N 0 3 413.949 4.340 20 0 HIADHN CC(C)CN(C(=O)c1cc(CNC(=O)C(C)(C)C)ccc1Cl)C1CCN(C)CC1 ZINC000555866861 942758101 /nfs/dbraw/zinc/75/81/01/942758101.db2.gz LFQCMIHITOPUIL-UHFFFAOYSA-N 0 3 422.013 4.195 20 0 HIADHN Fc1ccc([C@@H](NCC2(c3ccc4c(c3)OCO4)CCCCC2)c2nnc[nH]2)cc1 ZINC000556061168 942799098 /nfs/dbraw/zinc/79/90/98/942799098.db2.gz RXUGARLDQGOYCA-OAQYLSRUSA-N 0 3 408.477 4.254 20 0 HIADHN Clc1cccc(CN2CCCC[C@H]2CN[C@@H](c2cccs2)c2nnc[nH]2)c1 ZINC000556094473 942804619 /nfs/dbraw/zinc/80/46/19/942804619.db2.gz XZDQGBPESBZIPG-HKUYNNGSSA-N 0 3 401.967 4.253 20 0 HIADHN C[C@H](N[C@@H](C[C@H]1CCOC1)c1ccccc1)C(=O)N(C)Cc1nc2ccccc2s1 ZINC000556094028 942804666 /nfs/dbraw/zinc/80/46/66/942804666.db2.gz VJEQXRBOLYFJKR-UEXGIBASSA-N 0 3 423.582 4.401 20 0 HIADHN C[C@H](N[C@@H]1CCCN([C@@H](C)c2ccccc2F)C1=O)c1ccc2c(c1)OCCCO2 ZINC000556223971 942821417 /nfs/dbraw/zinc/82/14/17/942821417.db2.gz LVXLXFPQFFMKJK-XGHQBKJUSA-N 0 3 412.505 4.390 20 0 HIADHN C[C@H](Cn1cc(Br)ccc1=O)N[C@H]1CCCOc2c(Cl)cccc21 ZINC000556257694 942827548 /nfs/dbraw/zinc/82/75/48/942827548.db2.gz JZXAJMAPMVDNRT-WBMJQRKESA-N 0 3 411.727 4.156 20 0 HIADHN C[C@@H]1CC[C@H](NCc2cc(Br)ccc2OC(F)F)[C@@H](n2cncn2)C1 ZINC000556260613 942828167 /nfs/dbraw/zinc/82/81/67/942828167.db2.gz FQKVZVGHHHUSGB-UGFHNGPFSA-N 0 3 415.282 4.162 20 0 HIADHN C[C@H](Cn1ncc2ccccc2c1=O)NCc1cnc(-c2ccc(Cl)cc2)s1 ZINC000556415831 942860822 /nfs/dbraw/zinc/86/08/22/942860822.db2.gz GXABNGYQBYVYRG-CQSZACIVSA-N 0 3 410.930 4.352 20 0 HIADHN C[C@H]1C[C@H](NC(=O)N(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)CN1C1CC1 ZINC000556454581 942872506 /nfs/dbraw/zinc/87/25/06/942872506.db2.gz QVHRMMWUOJGBOB-NHYWBVRUSA-N 0 3 423.401 4.491 20 0 HIADHN Cc1ccc2c(c1)[C@@H](NCc1cccc(N3C(=O)N[C@](C)(C4CC4)C3=O)c1)CCC2 ZINC000556609893 942914019 /nfs/dbraw/zinc/91/40/19/942914019.db2.gz BUCLPTNYQCIKQQ-WIOPSUGQSA-N 0 3 403.526 4.387 20 0 HIADHN Cc1ccc(Br)c(C)c1C(=O)NC1CCN([C@@H](C)c2ccncc2)CC1 ZINC000556678720 942929928 /nfs/dbraw/zinc/92/99/28/942929928.db2.gz BCODAFIJIKSYIM-INIZCTEOSA-N 0 3 416.363 4.416 20 0 HIADHN COc1cc(CN[C@@H](C)c2ccccc2-n2ccnn2)ccc1OCC(F)(F)F ZINC000556865332 942943586 /nfs/dbraw/zinc/94/35/86/942943586.db2.gz FKNVQJMBUWHNJX-AWEZNQCLSA-N 0 3 406.408 4.068 20 0 HIADHN CCOc1cc(CN2CC[C@@H](c3ccccc3F)C2)ccc1O[C@@H](C)C(=O)N(C)C ZINC000556883743 942950163 /nfs/dbraw/zinc/95/01/63/942950163.db2.gz XEPSFRHENOMXLN-PKOBYXMFSA-N 0 3 414.521 4.069 20 0 HIADHN CC[C@@H](NCc1ccc2[nH]c(C)cc2c1)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000556897448 942956646 /nfs/dbraw/zinc/95/66/46/942956646.db2.gz LSIDJSJPMQPURI-GOSISDBHSA-N 0 3 405.951 4.279 20 0 HIADHN CNC(=O)COc1cccc(CN[C@@H]2CC(C)(C)c3ccc(Br)cc32)c1 ZINC000556898928 942957934 /nfs/dbraw/zinc/95/79/34/942957934.db2.gz PXTVSEYFWICRIV-LJQANCHMSA-N 0 3 417.347 4.086 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)c1cccc(C(=O)Nc2ccccc2)c1 ZINC000556902555 942958819 /nfs/dbraw/zinc/95/88/19/942958819.db2.gz SXYZGIIRNDXPQT-UHFFFAOYSA-N 0 3 407.539 4.204 20 0 HIADHN Cc1nc(-c2ccccc2F)sc1[C@H](C)NC[C@H](N1CCOCC1)C(F)(F)F ZINC000556924831 942968495 /nfs/dbraw/zinc/96/84/95/942968495.db2.gz WPJYCXIHFOESIZ-LRDDRELGSA-N 0 3 417.472 4.171 20 0 HIADHN CC(C)c1noc2nc(C3CC3)cc(C(=O)N(C)CCCN(C)Cc3ccncc3)c21 ZINC000556934391 942972921 /nfs/dbraw/zinc/97/29/21/942972921.db2.gz UTCGKYGJODXEDQ-UHFFFAOYSA-N 0 3 421.545 4.213 20 0 HIADHN Cc1nc(NC(=O)Nc2cccc(N3CCN(CCc4ccccc4)CC3)c2)oc1C ZINC000557097920 943020252 /nfs/dbraw/zinc/02/02/52/943020252.db2.gz UROSNPDJSUCOPW-UHFFFAOYSA-N 0 3 419.529 4.300 20 0 HIADHN CCOc1ccc(-c2nc(CC)c(C(=O)N3C[C@@H](N4CCCC4)C[C@@H]3C)s2)cc1 ZINC000557128089 943026256 /nfs/dbraw/zinc/02/62/56/943026256.db2.gz VLIDSGMRMFGAES-WMZOPIPTSA-N 0 3 413.587 4.470 20 0 HIADHN COc1ccc([C@H](Cc2ccc(F)cc2)N[C@@H](C)C(=O)NCc2ccccc2)cc1 ZINC000557513043 943181210 /nfs/dbraw/zinc/18/12/10/943181210.db2.gz XSTFBNKAORMRJE-UUOWRZLLSA-N 0 3 406.501 4.413 20 0 HIADHN Cc1nc(COc2ccc(Cl)cc2)sc1C(=O)N1C[C@@H](N2CCCC2)C[C@H]1C ZINC000557599701 943225998 /nfs/dbraw/zinc/22/59/98/943225998.db2.gz HZZCRTHLRZVZRN-PBHICJAKSA-N 0 3 419.978 4.383 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)CCc1nnc(-c2cc3ccccc3o2)o1 ZINC000557624549 943236578 /nfs/dbraw/zinc/23/65/78/943236578.db2.gz RGSMUGXVBJHAQH-UHFFFAOYSA-N 0 3 410.518 4.140 20 0 HIADHN CC[C@H](C)N[C@@H](CNc1cc(C(F)(F)F)nc(-c2ccncc2)n1)c1ccco1 ZINC000557695096 943260937 /nfs/dbraw/zinc/26/09/37/943260937.db2.gz SUMKJDYAJPJRGI-ZFWWWQNUSA-N 0 3 405.424 4.114 20 0 HIADHN C[C@H](NC(=O)NCC(C)(C)N1CCc2ccccc2C1)c1nccn1-c1ccccc1 ZINC000557740302 943276170 /nfs/dbraw/zinc/27/61/70/943276170.db2.gz UVJGDKSRPNUZEH-IBGZPJMESA-N 0 3 417.557 4.069 20 0 HIADHN Cc1cccc(CCCNC(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)n1 ZINC000557749245 943278653 /nfs/dbraw/zinc/27/86/53/943278653.db2.gz UZECTAKATYOMOM-FQEVSTJZSA-N 0 3 400.592 4.157 20 0 HIADHN COc1ccc(-c2nc(C)c(C(=O)N3CCN(C4CCC4)C[C@@H](C)C3)s2)c(F)c1 ZINC000557840402 943310225 /nfs/dbraw/zinc/31/02/25/943310225.db2.gz VVODUAJIDHVBPA-CQSZACIVSA-N 0 3 417.550 4.213 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)[C@H]1C[C@H]1c1cccc(Br)c1)c1ccco1 ZINC000557911317 943326827 /nfs/dbraw/zinc/32/68/27/943326827.db2.gz FHVTZXZMMSFFMZ-XDKFSHSGSA-N 0 3 405.336 4.391 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)NC[C@@H]1CCCn2cc(C)nc21)c1ccc(Cl)cc1 ZINC000557921703 943329784 /nfs/dbraw/zinc/32/97/84/943329784.db2.gz QZYWCDXWPMUNOQ-ICSRJNTNSA-N 0 3 417.985 4.105 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)Cc2csc(-c3ccoc3)n2)N(C)C)cc1 ZINC000557935553 943333129 /nfs/dbraw/zinc/33/31/29/943333129.db2.gz SQGJKPPSKUBVRO-FQEVSTJZSA-N 0 3 413.543 4.152 20 0 HIADHN Cc1nn(Cc2ccc(Cl)cc2)c(C)c1C(=O)N1CCN([C@@H]2C[C@H]2C)C[C@@H](C)C1 ZINC000558013142 943354831 /nfs/dbraw/zinc/35/48/31/943354831.db2.gz SVHZBRMSDHVOJA-WHSLLNHNSA-N 0 3 414.981 4.004 20 0 HIADHN Cc1ccc(-n2ncc(C(=O)N(C)CCCN(C)Cc3ccncc3)c2C(C)C)cc1 ZINC000558061502 943369467 /nfs/dbraw/zinc/36/94/67/943369467.db2.gz PMQKMCMMFYMFSB-UHFFFAOYSA-N 0 3 419.573 4.293 20 0 HIADHN Brc1cc(Br)cc(CNCc2cccc(-n3cncn3)c2)c1 ZINC000558101188 943379023 /nfs/dbraw/zinc/37/90/23/943379023.db2.gz ONVBEOJDFPJIJZ-UHFFFAOYSA-N 0 3 422.124 4.082 20 0 HIADHN CCCN(C)[C@H](CNC(=O)N1CC[C@H](C2CCOCC2)C1)c1ccc(Cl)cc1 ZINC000558104681 943380407 /nfs/dbraw/zinc/38/04/07/943380407.db2.gz AEOJSWVRNRTJGF-PZJWPPBQSA-N 0 3 407.986 4.181 20 0 HIADHN COc1ccc(OCc2ccccn2)c(CNC[C@@H](CO)c2ccccc2Cl)c1 ZINC000558117643 943384588 /nfs/dbraw/zinc/38/45/88/943384588.db2.gz CXEWSIOULOEMEK-SFHVURJKSA-N 0 3 412.917 4.188 20 0 HIADHN Cc1cc(Oc2ncccn2)ccc1NC(=O)N[C@H]1CCN(Cc2ccccc2)[C@@H]1C ZINC000558194531 943427411 /nfs/dbraw/zinc/42/74/11/943427411.db2.gz YRGBXYLWORBLQH-GCJKJVERSA-N 0 3 417.513 4.362 20 0 HIADHN Cc1ccccc1-c1nn(-c2ccccc2)cc1C(=O)N(C)[C@@H]1CCN(C2CC2)C1 ZINC000558196946 943428551 /nfs/dbraw/zinc/42/85/51/943428551.db2.gz ALNNWEUSLAPRPD-OAQYLSRUSA-N 0 3 400.526 4.156 20 0 HIADHN COc1cc([C@@H](C)NC2CCN(Cc3ccc(Br)cc3)CC2)c(F)cn1 ZINC000558223244 943442654 /nfs/dbraw/zinc/44/26/54/943442654.db2.gz YLISGNCIVLRMGY-CQSZACIVSA-N 0 3 422.342 4.307 20 0 HIADHN C[C@H](CC(=O)Nc1ccc(NC(=O)C2CC2)cc1)N[C@H]1c2ccc(F)cc2O[C@@H]1C ZINC000558256073 943462796 /nfs/dbraw/zinc/46/27/96/943462796.db2.gz HGNFNSWWJGTDGQ-XDEPDNQISA-N 0 3 411.477 4.003 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1cccc(OC[C@H]2CCCO2)c1)c1ccco1 ZINC000558277057 943477880 /nfs/dbraw/zinc/47/78/80/943477880.db2.gz JLCDMEMKMWDTTK-PWIZWCRZSA-N 0 3 401.507 4.088 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)Nc1ccc(Cl)c(C(=O)NC2CC2)c1)c1ccco1 ZINC000558299027 943491898 /nfs/dbraw/zinc/49/18/98/943491898.db2.gz CEDDSXUABBVHIP-FZKQIMNGSA-N 0 3 418.925 4.076 20 0 HIADHN Cc1ccc(NC(=O)C(C)C)cc1NC(=O)N[C@H](CN(C)C)c1ccc(F)cc1 ZINC000558312254 943499495 /nfs/dbraw/zinc/49/94/95/943499495.db2.gz UMIRZRVLXRKLID-HXUWFJFHSA-N 0 3 400.498 4.153 20 0 HIADHN C[C@@H](CCOCc1ccccc1)NC(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000558348579 943519984 /nfs/dbraw/zinc/51/99/84/943519984.db2.gz PAGJBDYXAZJLAZ-AZUAARDMSA-N 0 3 401.576 4.180 20 0 HIADHN COc1ccc(NC(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)c(Br)c1 ZINC000558352314 943521500 /nfs/dbraw/zinc/52/15/00/943521500.db2.gz FIZDYFFJCODOTK-SCLBCKFNSA-N 0 3 406.324 4.271 20 0 HIADHN Brc1ccccc1-n1cc(CN[C@@H]2CCOC3(CCCCC3)C2)nn1 ZINC000558486388 943572608 /nfs/dbraw/zinc/57/26/08/943572608.db2.gz WNNIOLCEUMEIPQ-OAHLLOKOSA-N 0 3 405.340 4.001 20 0 HIADHN COc1ccc([C@@H](Cc2ccccc2)NCC(=O)N2CCC[C@H](C(F)(F)F)C2)cc1 ZINC000558487498 943573103 /nfs/dbraw/zinc/57/31/03/943573103.db2.gz BFYZIPLPYYEYMF-PZJWPPBQSA-N 0 3 420.475 4.370 20 0 HIADHN CNS(=O)(=O)c1ccc([C@@H](C)N[C@@H](Cc2ccccc2)c2ccc(OC)cc2)cc1 ZINC000558505688 943579460 /nfs/dbraw/zinc/57/94/60/943579460.db2.gz NKQJGHUVIAWETR-KOSHJBKYSA-N 0 3 424.566 4.238 20 0 HIADHN O[C@@H](CNC[C@@H](c1ccc(Cl)cc1)N1CCc2sccc2C1)C(F)(F)F ZINC000558628626 943621253 /nfs/dbraw/zinc/62/12/53/943621253.db2.gz NMRYLTPQMFEESW-RDJZCZTQSA-N 0 3 404.885 4.014 20 0 HIADHN COc1cc(Br)c(CN2CCCC[C@@H]2[C@@H]2CCCC[C@H]2O)cc1OC ZINC000558658308 943625156 /nfs/dbraw/zinc/62/51/56/943625156.db2.gz CFBKMXWLFIDFHV-CGTJXYLNSA-N 0 3 412.368 4.372 20 0 HIADHN O=C(CN1[C@@H]2CC[C@H]1C[C@@H](c1ccccc1)C2)NCCc1nc2ccccc2s1 ZINC000558736308 943635115 /nfs/dbraw/zinc/63/51/15/943635115.db2.gz RCMAWRNUBKKKJG-ACDBMABISA-N 0 3 405.567 4.366 20 0 HIADHN Cc1ccc(NC(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)cc1C(=O)NC(C)C ZINC000558771480 943655119 /nfs/dbraw/zinc/65/51/19/943655119.db2.gz YJAJCKPPDPHUDK-FQEVSTJZSA-N 0 3 416.953 4.211 20 0 HIADHN Cc1ccc(CNCc2cccc(NC(=O)c3ccccn3)c2)c(-c2ccnn2C)c1 ZINC000558778281 943659235 /nfs/dbraw/zinc/65/92/35/943659235.db2.gz OHRFYHJKBXRHLM-UHFFFAOYSA-N 0 3 411.509 4.333 20 0 HIADHN CCN1CC[C@H](NCC(=O)Nc2cccc(C(C)=O)c2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000558896846 943730384 /nfs/dbraw/zinc/73/03/84/943730384.db2.gz OBDDWNYLALOVHG-UNMCSNQZSA-N 0 3 417.912 4.045 20 0 HIADHN CCN1CC[C@H](N[C@@H](C)C(=O)Nc2cc(F)ccc2C)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000558898432 943732767 /nfs/dbraw/zinc/73/27/67/943732767.db2.gz SYXIRAJAWNCLIX-LTBCBRHQSA-N 0 3 423.454 4.304 20 0 HIADHN CCCC(=O)Nc1ccc(CNC(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)cc1 ZINC000558899722 943734348 /nfs/dbraw/zinc/73/43/48/943734348.db2.gz YAUJRKINJOXOFX-FQEVSTJZSA-N 0 3 416.953 4.181 20 0 HIADHN Cc1ccccc1CN(C)C(=O)CN[C@@H]1CCN(C(C)C)[C@@H]1c1ccc(F)c(F)c1 ZINC000558899970 943735446 /nfs/dbraw/zinc/73/54/46/943735446.db2.gz ZIISRIQPHWRLQE-ISKFKSNPSA-N 0 3 415.528 4.045 20 0 HIADHN COc1ccc([C@H](OC)[C@@H](C)NC(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)cc1 ZINC000558908446 943740781 /nfs/dbraw/zinc/74/07/81/943740781.db2.gz SXZLXUFFDSKESB-GQWLDOHISA-N 0 3 419.953 4.027 20 0 HIADHN CCOC(=O)[C@H]1CC[C@@H](NCc2ccc(-n3nc(C)cc3C)nc2)c2ccccc21 ZINC000558918715 943746419 /nfs/dbraw/zinc/74/64/19/943746419.db2.gz HIBSBXXGYDDLGN-FCHUYYIVSA-N 0 3 404.514 4.156 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@@H](NCc2ccc(C)cc2O[C@@H]2CCOC2)c2ccccc21 ZINC000558976316 943781302 /nfs/dbraw/zinc/78/13/02/943781302.db2.gz NNAGWDAYDOWAMI-UEVCKROQSA-N 0 3 409.526 4.434 20 0 HIADHN C[C@H]1C[C@@H](N(C)S(=O)(=O)Cc2ccc(C(F)F)cc2)CCN1Cc1ccccc1 ZINC000559051736 943816139 /nfs/dbraw/zinc/81/61/39/943816139.db2.gz JHBVTZROGHLNNR-UWJYYQICSA-N 0 3 422.541 4.439 20 0 HIADHN C[C@H](N[C@H]1CCN([C@@H](C)c2ccc(F)cc2)C1=O)c1ccc(NC(=O)NC2CC2)cc1 ZINC000559148531 943853875 /nfs/dbraw/zinc/85/38/75/943853875.db2.gz ZYJHIMPMKBFJTI-WCJKSRRJSA-N 0 3 424.520 4.122 20 0 HIADHN C[C@H](N[C@@H]1CCN([C@@H](C)c2ccc(F)cc2)C1=O)c1ccc(NC(=O)C2CC2)cc1 ZINC000559147385 943853994 /nfs/dbraw/zinc/85/39/94/943853994.db2.gz WHYNRFHHXSUQEI-PONJGIIJSA-N 0 3 409.505 4.187 20 0 HIADHN CC[C@@H](N[C@@H]1CCc2cccc(Br)c2C1)c1nnc2n1CCCCC2 ZINC000559259917 943886751 /nfs/dbraw/zinc/88/67/51/943886751.db2.gz MISJXYMMIVMUDU-CRAIPNDOSA-N 0 3 403.368 4.365 20 0 HIADHN O=S(=O)(CCCNCc1ccc(Br)c(F)c1)c1ccc(Cl)cc1 ZINC000559357285 943907599 /nfs/dbraw/zinc/90/75/99/943907599.db2.gz CHBZYILMLCEDKG-UHFFFAOYSA-N 0 3 420.731 4.195 20 0 HIADHN Cc1cc(C(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)c2nccc(C)c2c1 ZINC000559555986 944002956 /nfs/dbraw/zinc/00/29/56/944002956.db2.gz PUQJLPVFBJTHBT-PMACEKPBSA-N 0 3 409.574 4.203 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1cc(F)c(OC)cc1F)c1cccc(OC)c1 ZINC000559646618 944024481 /nfs/dbraw/zinc/02/44/81/944024481.db2.gz NHUFYWQZKLZPJZ-IBGZPJMESA-N 0 3 407.461 4.187 20 0 HIADHN O[C@H](CNCc1ccccc1OCC(F)(F)F)COc1ccc2ccccc2c1 ZINC000559735756 944040604 /nfs/dbraw/zinc/04/06/04/944040604.db2.gz FDDWWZTULOSUJG-LJQANCHMSA-N 0 3 405.416 4.310 20 0 HIADHN O=S(=O)(CCCN[C@@H]1CCc2sc(Br)cc21)Cc1ccccc1 ZINC000559740876 944042487 /nfs/dbraw/zinc/04/24/87/944042487.db2.gz HBIJTRYWSLGJHK-OAHLLOKOSA-N 0 3 414.390 4.093 20 0 HIADHN O=C1CCCN1Cc1ccc(CN[C@H]2CCc3sc(Br)cc32)cc1 ZINC000559740736 944042606 /nfs/dbraw/zinc/04/26/06/944042606.db2.gz WSLKKFMNHOCZDV-INIZCTEOSA-N 0 3 405.361 4.410 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1ccc(Oc2ccccc2)cn1 ZINC000559783375 944048941 /nfs/dbraw/zinc/04/89/41/944048941.db2.gz CWIQMMQVSLOVID-UHFFFAOYSA-N 0 3 417.509 4.331 20 0 HIADHN Fc1ccc([C@@H](NCCc2c[nH]c3cccc(Br)c23)c2nnc[nH]2)cc1 ZINC000559856835 944069164 /nfs/dbraw/zinc/06/91/64/944069164.db2.gz VQFZIJPFILPZSS-GOSISDBHSA-N 0 3 414.282 4.109 20 0 HIADHN C[C@@]1(CN[C@@H]2CCS(=O)(=O)c3ccc(Br)cc32)C[C@H]1c1ccccc1 ZINC000559880169 944072771 /nfs/dbraw/zinc/07/27/71/944072771.db2.gz DXOIPUQWQXNRHZ-NSHGMRRFSA-N 0 3 420.372 4.451 20 0 HIADHN COCCOc1ccc([C@H](C)N[C@@H]2CCCN([C@@H](C)c3ccc(F)cc3)C2=O)cc1 ZINC000559899153 944079931 /nfs/dbraw/zinc/07/99/31/944079931.db2.gz KSWDFZAZPJNAKL-IUKKYPGJSA-N 0 3 414.521 4.254 20 0 HIADHN CN1CCC[C@@H](CNC(=O)c2ncoc2C2CC2)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000559908190 944081867 /nfs/dbraw/zinc/08/18/67/944081867.db2.gz IWFKVROXEPQDSN-MAUKXSAKSA-N 0 3 407.436 4.384 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)Nc2ccc(Oc3cccnc3)nc2)CC1 ZINC000559966421 944103245 /nfs/dbraw/zinc/10/32/45/944103245.db2.gz JDXRXLNKQQTEDA-UHFFFAOYSA-N 0 3 417.513 4.397 20 0 HIADHN Cc1ccc(C=Cc2nc(SC[C@@H]3CN(Cc4ccccc4)CCCO3)n[nH]2)o1 ZINC000559976579 944107156 /nfs/dbraw/zinc/10/71/56/944107156.db2.gz CMWKCDGOVZGKNL-PISNEZEASA-N 0 3 410.543 4.260 20 0 HIADHN c1ccc(CN2CCCO[C@@H](CSc3nnc(-c4ccncc4)n3C3CC3)C2)cc1 ZINC000559982958 944109839 /nfs/dbraw/zinc/10/98/39/944109839.db2.gz TUCBAZAJSAEAHF-OAQYLSRUSA-N 0 3 421.570 4.058 20 0 HIADHN CN(C(=O)c1ccc(NCc2sccc2Br)cc1)[C@H]1CCCN(C)C1 ZINC000559995669 944117356 /nfs/dbraw/zinc/11/73/56/944117356.db2.gz BXMDRVJKGDWGKU-INIZCTEOSA-N 0 3 422.392 4.289 20 0 HIADHN CN(C(=O)c1ccc(NCc2csc(Br)c2)cc1)[C@@H]1CCCN(C)C1 ZINC000559997957 944121507 /nfs/dbraw/zinc/12/15/07/944121507.db2.gz JZBZABCZDNRXLG-QGZVFWFLSA-N 0 3 422.392 4.289 20 0 HIADHN COc1ccc(C[C@@H](C)CN(C)CC(=O)N[C@H](c2nccs2)c2ccccc2)cc1 ZINC000560112603 944163607 /nfs/dbraw/zinc/16/36/07/944163607.db2.gz QMEGRMWYPSYCEY-JPYJTQIMSA-N 0 3 423.582 4.168 20 0 HIADHN C[C@]1(C2CC2)NC(=O)N(c2cccc(CN[C@@H]3CCCc4cc(F)ccc43)c2)C1=O ZINC000560267794 944212986 /nfs/dbraw/zinc/21/29/86/944212986.db2.gz GRLVRAVQFZWNMK-ZJSXRUAMSA-N 0 3 407.489 4.218 20 0 HIADHN CC(C)([C@H](NC(=O)[C@H]1CCc2cccc(O)c21)c1ccc(F)c(F)c1)N1CCCC1 ZINC000560366996 944228541 /nfs/dbraw/zinc/22/85/41/944228541.db2.gz YRKXYQCBXRFQGG-HTAPYJJXSA-N 0 3 414.496 4.432 20 0 HIADHN Cc1noc(C)c1C(C)(C)NCCCOc1cccc(I)c1 ZINC000560538831 944247496 /nfs/dbraw/zinc/24/74/96/944247496.db2.gz SUMOQBFUQBAJKJ-UHFFFAOYSA-N 0 3 414.287 4.190 20 0 HIADHN CC(=O)N(c1nc(CN(C)CCCN(C)Cc2ccco2)cs1)c1ccccc1 ZINC000560539251 944247573 /nfs/dbraw/zinc/24/75/73/944247573.db2.gz CTCNVFLAYPWSCM-UHFFFAOYSA-N 0 3 412.559 4.375 20 0 HIADHN CO[C@@H]1C[C@H](c2ccccc2)CC[C@@H]1N[C@@H](C)CS(=O)(=O)c1ccc(C)cc1 ZINC000560576549 944261430 /nfs/dbraw/zinc/26/14/30/944261430.db2.gz ZZTUECREKKCSLY-VOFXCDAESA-N 0 3 401.572 4.098 20 0 HIADHN C[C@@H](CC(=O)NCCc1ccccc1)N[C@@H](CCO)c1ccc(Cl)c(Cl)c1 ZINC000560584299 944263251 /nfs/dbraw/zinc/26/32/51/944263251.db2.gz CVQPTBFRYCDJLK-YWZLYKJASA-N 0 3 409.357 4.144 20 0 HIADHN COc1ccccc1NC(=O)C[C@H](C)N[C@@H](CCO)c1ccc(Cl)c(Cl)c1 ZINC000560585579 944264169 /nfs/dbraw/zinc/26/41/69/944264169.db2.gz UATMESOGWFDWQV-GUYCJALGSA-N 0 3 411.329 4.432 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1cscc1Br ZINC000560692772 944296835 /nfs/dbraw/zinc/29/68/35/944296835.db2.gz SWUHKVZCGOPDJV-UHFFFAOYSA-N 0 3 411.287 4.046 20 0 HIADHN CCCN(C)[C@H](CNC(=O)[C@H](C)Cc1c(C)nn(C)c1C)c1ccc(Cl)cc1 ZINC000560710860 944305186 /nfs/dbraw/zinc/30/51/86/944305186.db2.gz YKLFKKBCQDJFHQ-QVKFZJNVSA-N 0 3 404.986 4.068 20 0 HIADHN Cc1nn(Cc2ccccc2)c2sc(C(=O)N3C[C@@H](N4CCCC4)C[C@@H]3C)cc12 ZINC000560759300 944322797 /nfs/dbraw/zinc/32/27/97/944322797.db2.gz WHNWNEMYWAPWQH-LPHOPBHVSA-N 0 3 408.571 4.153 20 0 HIADHN C[C@H](N[C@@H](CO)Cc1ccc(F)cc1)c1ccc(OC(F)F)cc1OC(F)F ZINC000560908979 944368258 /nfs/dbraw/zinc/36/82/58/944368258.db2.gz MQFSXAOPNZVDKG-SMDDNHRTSA-N 0 3 405.363 4.283 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)c1ccccc1Cn1cccn1)c1ccc(Cl)cc1 ZINC000560974996 944381972 /nfs/dbraw/zinc/38/19/72/944381972.db2.gz XWGMBWHVVBJMAV-QFIPXVFZSA-N 0 3 410.949 4.398 20 0 HIADHN CO[C@@H]1CCC[C@H](C(=O)N(Cc2ccncc2)[C@H]2CCCN(Cc3ccccc3)C2)C1 ZINC000561076764 944430659 /nfs/dbraw/zinc/43/06/59/944430659.db2.gz YIAZXBCGUUDNDV-CCDWMCETSA-N 0 3 421.585 4.280 20 0 HIADHN COc1ccc(OC)c(-c2csc(NC(=O)[C@H]3CCN(Cc4ccccc4)C3)n2)c1 ZINC000561091836 944443267 /nfs/dbraw/zinc/44/32/67/944443267.db2.gz MBUBABCVXYOUHT-KRWDZBQOSA-N 0 3 423.538 4.288 20 0 HIADHN CCCN(C)[C@H](CNC(=O)C(=O)Nc1cncc2ccccc21)c1ccc(Cl)cc1 ZINC000561536220 944661656 /nfs/dbraw/zinc/66/16/56/944661656.db2.gz KFIVNCIXXBWWHH-OAQYLSRUSA-N 0 3 424.932 4.026 20 0 HIADHN COc1cc(CN(Cc2ccccc2)[C@@H](C)CN2CCOCC2)ccc1SC ZINC000561585337 944690280 /nfs/dbraw/zinc/69/02/80/944690280.db2.gz PJRACDGRVTXOCP-IBGZPJMESA-N 0 3 400.588 4.140 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)CCc2cc3ccccc3[nH]c2=O)N(C)C)cc1 ZINC000561638473 944721028 /nfs/dbraw/zinc/72/10/28/944721028.db2.gz OLFFSUBSUNDMGS-QHCPKHFHSA-N 0 3 421.541 4.079 20 0 HIADHN CC(=O)c1oc2cc(C)ccc2c1CC(=O)NC[C@@H]1CCN(Cc2ccccc2)C1 ZINC000561635668 944721092 /nfs/dbraw/zinc/72/10/92/944721092.db2.gz DMZZZPNCRNIIKU-FQEVSTJZSA-N 0 3 404.510 4.125 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)CCc2cnc3ccccc3c2)N(C)C)cc1 ZINC000561658562 944734499 /nfs/dbraw/zinc/73/44/99/944734499.db2.gz ZOTZKMJRPLBPRM-DEOSSOPVSA-N 0 3 405.542 4.374 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)Nc3nc(CC(F)(F)F)cs3)cc2)CC1 ZINC000561709500 944756742 /nfs/dbraw/zinc/75/67/42/944756742.db2.gz OHSMPPFTRXANND-UHFFFAOYSA-N 0 3 412.481 4.031 20 0 HIADHN Cc1oc(-c2cccc(C(F)(F)F)c2)nc1C(=O)N1CCN([C@@H]2C[C@@H]2C)C[C@@H](C)C1 ZINC000561746510 944775152 /nfs/dbraw/zinc/77/51/52/944775152.db2.gz KUJJKLZJRSQVNV-QWQRMKEZSA-N 0 3 421.463 4.471 20 0 HIADHN C[C@@H]1C[C@@H]1N1CCN(C(=O)C(C)(C)c2csc(-c3ccccc3F)n2)C[C@@H](C)C1 ZINC000561761019 944783349 /nfs/dbraw/zinc/78/33/49/944783349.db2.gz KEUXCWMFVAVXEB-FCEWJHQRSA-N 0 3 415.578 4.416 20 0 HIADHN C[C@H](C(=O)N1CCC(F)(c2ccccn2)CC1)N1CCC(Cc2ccccc2)CC1 ZINC000561957101 944875316 /nfs/dbraw/zinc/87/53/16/944875316.db2.gz ODDFHOVCIAMVJE-HXUWFJFHSA-N 0 3 409.549 4.212 20 0 HIADHN Cn1cc(C(F)(F)F)nc1[C@@H]1CCCN(Cc2cnc(-c3ccccc3)nc2)C1 ZINC000561957986 944875532 /nfs/dbraw/zinc/87/55/32/944875532.db2.gz YYFGWWABXCIXTH-QGZVFWFLSA-N 0 3 401.436 4.276 20 0 HIADHN Cc1noc(C)c1CO[C@@H]1CCN(Cc2ccc(-n3ccc(C(F)(F)F)n3)cc2)C1 ZINC000561980833 944885369 /nfs/dbraw/zinc/88/53/69/944885369.db2.gz ZKRXOFAPXIZSDL-GOSISDBHSA-N 0 3 420.435 4.287 20 0 HIADHN C[C@H](N[C@H]1CCN(C)[C@@H]1c1ccc(Cl)cc1)C(=O)Nc1cc(Cl)ccc1F ZINC000562050513 944912645 /nfs/dbraw/zinc/91/26/45/944912645.db2.gz WGKHNDRMCODHPQ-OYYNGEPBSA-N 0 3 410.320 4.495 20 0 HIADHN Cc1nc(C(C)C)sc1[C@H](C)N[C@@H]1CCCN(S(=O)(=O)c2cccs2)C1 ZINC000562057549 944914759 /nfs/dbraw/zinc/91/47/59/944914759.db2.gz JYVGNNHJXVBFLL-DZGCQCFKSA-N 0 3 413.634 4.140 20 0 HIADHN C[C@@H]1C[C@@H]1[C@@H](N[C@H]1CCCc2ccc(S(N)(=O)=O)cc21)c1ccc(Cl)cc1 ZINC000562089724 944933715 /nfs/dbraw/zinc/93/37/15/944933715.db2.gz FFBZIMFBPICROZ-MNSWYVGCSA-N 0 3 404.963 4.352 20 0 HIADHN Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C ZINC000562141804 944969512 /nfs/dbraw/zinc/96/95/12/944969512.db2.gz GHPLZHWYGXDFOC-AVRDEDQJSA-N 0 3 408.546 4.044 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)Nc1nc2c(cccc2COC)s1)c1ccco1 ZINC000562171057 945000246 /nfs/dbraw/zinc/00/02/46/945000246.db2.gz HGGBSGASBYDEKH-HIFRSBDPSA-N 0 3 402.520 4.287 20 0 HIADHN COc1cc(F)c(NC(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)cc1OC ZINC000562173885 945002737 /nfs/dbraw/zinc/00/27/37/945002737.db2.gz VTTAULPSZCDYTP-LJQANCHMSA-N 0 3 419.497 4.055 20 0 HIADHN C[C@H](CNC(=O)Nc1ccc(-c2noc(C(F)F)n2)cc1)N(C)Cc1ccccc1 ZINC000562203888 945017680 /nfs/dbraw/zinc/01/76/80/945017680.db2.gz PYLIUPGRCGTANQ-CQSZACIVSA-N 0 3 415.444 4.316 20 0 HIADHN CN(C)C[C@@H](NC(=O)Nc1ccc(OCC2CCOCC2)cc1)c1ccc(F)cc1 ZINC000562216863 945025486 /nfs/dbraw/zinc/02/54/86/945025486.db2.gz GKGZAUXLFOKGCM-JOCHJYFZSA-N 0 3 415.509 4.056 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3cccnc3C(F)(F)F)c(C)c2)CC1 ZINC000564169714 945415364 /nfs/dbraw/zinc/41/53/64/945415364.db2.gz HORAEQAPKKACJK-UHFFFAOYSA-N 0 3 407.440 4.195 20 0 HIADHN CCCc1nc(-c2noc([C@@]3(C(F)(F)F)CCN(Cc4ccccc4)C3)n2)co1 ZINC000564286232 945498278 /nfs/dbraw/zinc/49/82/78/945498278.db2.gz OCNMSEHRLFKDTB-LJQANCHMSA-N 0 3 406.408 4.383 20 0 HIADHN O=C(NCc1nc2cc(Br)ccc2o1)[C@@H]1CCCCN1C1CCCC1 ZINC000564310750 945508886 /nfs/dbraw/zinc/50/88/86/945508886.db2.gz BXFWIEXUNPPXAS-INIZCTEOSA-N 0 3 406.324 4.004 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)Nc1ccc(C(=O)NC2CCCC2)cc1 ZINC000564363113 945529463 /nfs/dbraw/zinc/52/94/63/945529463.db2.gz RQWSKKISABRWLH-QHCPKHFHSA-N 0 3 420.557 4.145 20 0 HIADHN C[C@H](N[C@@H]1CCN(C)[C@H]1c1ccc(Cl)c(F)c1)C(=O)Nc1ccc(F)cc1F ZINC000564400089 945556042 /nfs/dbraw/zinc/55/60/42/945556042.db2.gz XHQFJVCDRHPXOI-SYURPWHHSA-N 0 3 411.855 4.119 20 0 HIADHN O=C(CCN1CC[C@@H](n2cc(Cl)cn2)C1)NC(c1ccccc1)c1ccccc1 ZINC000564400809 945556641 /nfs/dbraw/zinc/55/66/41/945556641.db2.gz SWYIYXIWYXFTKS-OAQYLSRUSA-N 0 3 408.933 4.079 20 0 HIADHN C[C@H](N[C@@H]1c2ccccc2CC12CCOCC2)C(=O)Nc1nc2ccccc2s1 ZINC000564410363 945562032 /nfs/dbraw/zinc/56/20/32/945562032.db2.gz VQXYQTZXCWANNL-MGPUTAFESA-N 0 3 407.539 4.307 20 0 HIADHN C[C@@H](N[C@H]1CCCc2ccc(S(N)(=O)=O)cc21)c1ccc(-c2cccnc2)cc1 ZINC000564422899 945573458 /nfs/dbraw/zinc/57/34/58/945573458.db2.gz BWAWUVLJKFKPOV-MWTRTKDXSA-N 0 3 407.539 4.124 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@@H]2NC[C@@]2(C)OCCc3sccc32)cc1 ZINC000564438475 945586709 /nfs/dbraw/zinc/58/67/09/945586709.db2.gz JUKBDSWNKGWJPV-KSEOMHKRSA-N 0 3 419.612 4.219 20 0 HIADHN COc1cccc(OC)c1OC[C@H](O)CN1CCCCC[C@H]1/C=C/c1cccs1 ZINC000564605851 945701622 /nfs/dbraw/zinc/70/16/22/945701622.db2.gz SQNNJLTWDQQJJA-UBJZUDALSA-N 0 3 417.571 4.463 20 0 HIADHN FC(F)(F)C1CCN(C2CC(Nc3noc4ccc(Br)cc43)C2)CC1 ZINC000564619960 945712750 /nfs/dbraw/zinc/71/27/50/945712750.db2.gz TYQYZSZVCRSKKE-UHFFFAOYSA-N 0 3 418.257 4.808 20 0 HIADHN O=C1NC2(CCCC2)C(=O)N1c1cccc(CNC/C=C/c2ccc(F)cc2F)c1 ZINC000564688968 945731668 /nfs/dbraw/zinc/73/16/68/945731668.db2.gz FVSHDINHFSUPDD-GQCTYLIASA-N 0 3 411.452 4.137 20 0 HIADHN CCOC(=O)C1CCC(N(CC)CC(=O)c2cc(C)n(Cc3ccco3)c2C)CC1 ZINC000564713215 945738646 /nfs/dbraw/zinc/73/86/46/945738646.db2.gz FZWGNIMVJYJQQT-UHFFFAOYSA-N 0 3 414.546 4.373 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CC[C@H](C(F)(F)F)C4(CCC4)C3)c2)CC1 ZINC000565066082 945765297 /nfs/dbraw/zinc/76/52/97/945765297.db2.gz DUNMVWNXVPKASW-IBGZPJMESA-N 0 3 424.511 4.415 20 0 HIADHN CN(C(=O)N[C@H](c1ccccc1)[C@H]1CCOC1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000565093812 945772838 /nfs/dbraw/zinc/77/28/38/945772838.db2.gz RNWZTRFQFAPARH-KMDXXIMOSA-N 0 3 407.558 4.070 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3cc(Cl)c4ccccc4n3)CC2)C[C@@H](C)O1 ZINC000565553353 945846773 /nfs/dbraw/zinc/84/67/73/945846773.db2.gz JINUXFIHRATTSB-IAGOWNOFSA-N 0 3 415.965 4.240 20 0 HIADHN C[C@H](c1nc(Cc2ccc(Cl)cc2)no1)N(C)CCCN(C)Cc1ccco1 ZINC000565614766 945855130 /nfs/dbraw/zinc/85/51/30/945855130.db2.gz OSNDXCCJXWBVQH-MRXNPFEDSA-N 0 3 402.926 4.422 20 0 HIADHN Cc1cc(NC(=O)C(C)(C)C)sc1C(=O)N[C@@H](CN(C)C)c1ccc(F)cc1 ZINC000565852973 945894223 /nfs/dbraw/zinc/89/42/23/945894223.db2.gz FAEUSMAXPAYQRM-INIZCTEOSA-N 0 3 405.539 4.213 20 0 HIADHN CCCNC(=O)c1ccc(NC(=O)N[C@H](C)CN(C)Cc2ccccc2)cc1Cl ZINC000565970361 945947547 /nfs/dbraw/zinc/94/75/47/945947547.db2.gz AZNZQBDKOGQOKG-MRXNPFEDSA-N 0 3 416.953 4.122 20 0 HIADHN C[C@@H](CCCOc1ccccc1C(N)=O)NCc1nc(-c2ccccc2F)cs1 ZINC000566041753 945993498 /nfs/dbraw/zinc/99/34/98/945993498.db2.gz XZXPGEXTVNMOTH-HNNXBMFYSA-N 0 3 413.518 4.385 20 0 HIADHN O=S(=O)(Cc1ccc(C(F)F)cc1)N1CC[C@]2(CCN(Cc3ccccc3)C2)C1 ZINC000566371828 946012646 /nfs/dbraw/zinc/01/26/46/946012646.db2.gz CCEJZGUVOSMSOC-QFIPXVFZSA-N 0 3 420.525 4.052 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)C(C)(C)c2csc(-c3c(F)cccc3F)n2)CN1C1CC1 ZINC000566552474 946039127 /nfs/dbraw/zinc/03/91/27/946039127.db2.gz CQQMQKMMSASJQP-CHWSQXEVSA-N 0 3 405.514 4.107 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)C(C)(C)c2csc(-c3c(F)cccc3F)n2)CN1C1CC1 ZINC000566552476 946039656 /nfs/dbraw/zinc/03/96/56/946039656.db2.gz CQQMQKMMSASJQP-QWHCGFSZSA-N 0 3 405.514 4.107 20 0 HIADHN COc1ccc([C@@H](Cc2ccccc2)NCc2cnc(N3CCOCC3)c(F)c2)cc1 ZINC000566708028 946079378 /nfs/dbraw/zinc/07/93/78/946079378.db2.gz HFCCBZVPTYCKFT-XMMPIXPASA-N 0 3 421.516 4.140 20 0 HIADHN COc1ccc([C@H](Cc2ccccc2)NCc2cnc(N3CCOCC3)c(F)c2)cc1 ZINC000566708026 946079652 /nfs/dbraw/zinc/07/96/52/946079652.db2.gz HFCCBZVPTYCKFT-DEOSSOPVSA-N 0 3 421.516 4.140 20 0 HIADHN CCCN(CC)C[C@@H](C)N[C@H](c1cccc(S(C)(=O)=O)c1)c1ccc(F)c(F)c1 ZINC000566767209 946095816 /nfs/dbraw/zinc/09/58/16/946095816.db2.gz AXRSGNKODOTHCL-OPAMFIHVSA-N 0 3 424.557 4.168 20 0 HIADHN C[C@H]1CN(c2nnc(-c3cccc4cccnc43)n2C)[C@@H](C)CN1Cc1ccccc1 ZINC000566942984 946181357 /nfs/dbraw/zinc/18/13/57/946181357.db2.gz VRBGMYRTQFMNNI-OALUTQOASA-N 0 3 412.541 4.130 20 0 HIADHN CCN(CC)C(=O)Nc1ccc([C@@H](C)NCc2ccc(Cn3cncn3)cc2)cc1 ZINC000566944594 946182527 /nfs/dbraw/zinc/18/25/27/946182527.db2.gz VBCREVPWHGNTPQ-GOSISDBHSA-N 0 3 406.534 4.051 20 0 HIADHN CC[C@@H]1CN(Cc2cc(Cl)c(OCC(N)=O)c(OC)c2)CC[C@H]1c1ccccc1 ZINC000567068891 946231350 /nfs/dbraw/zinc/23/13/50/946231350.db2.gz APSVIVZUWPMMQR-IEBWSBKVSA-N 0 3 416.949 4.228 20 0 HIADHN CC[C@H]1CN(Cc2cc(Cl)c(OCC(N)=O)c(OC)c2)CC[C@H]1c1ccccc1 ZINC000567068893 946231823 /nfs/dbraw/zinc/23/18/23/946231823.db2.gz APSVIVZUWPMMQR-PKOBYXMFSA-N 0 3 416.949 4.228 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)C1(c2cccc(Cl)c2)CCOCC1 ZINC000567198501 946268189 /nfs/dbraw/zinc/26/81/89/946268189.db2.gz QBHCHBLQZADSTM-GOSISDBHSA-N 0 3 400.950 4.025 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)N1CCC(F)(c2cccnc2)CC1 ZINC000567620780 946383573 /nfs/dbraw/zinc/38/35/73/946383573.db2.gz MTSHCURPPCYHPQ-QFIPXVFZSA-N 0 3 412.553 4.208 20 0 HIADHN COc1ccc([C@@H](CNC(=O)CN(C)[C@@H](C)C2CC2)c2c[nH]c3ccccc32)cc1 ZINC000567718809 946398196 /nfs/dbraw/zinc/39/81/96/946398196.db2.gz UMOVYCDLPONFCZ-HTAPYJJXSA-N 0 3 405.542 4.155 20 0 HIADHN C[C@@H]1[C@H](NC(=O)c2cnn(-c3ccccc3)c2C2CC2)CCN1Cc1ccccc1 ZINC000567780746 946405201 /nfs/dbraw/zinc/40/52/01/946405201.db2.gz HOODYRKGIKNVRL-WZONZLPQSA-N 0 3 400.526 4.143 20 0 HIADHN FC(F)(F)c1ccc(-c2n[nH]cc2CN2CCC(OC[C@@H]3CCOC3)CC2)cc1 ZINC000567997247 946439951 /nfs/dbraw/zinc/43/99/51/946439951.db2.gz YXRJYMPCWFUWHB-OAHLLOKOSA-N 0 3 409.452 4.113 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)NCc2sccc2Br)c1 ZINC000568127490 946470928 /nfs/dbraw/zinc/47/09/28/946470928.db2.gz UQDQGYKKKFAOAD-UHFFFAOYSA-N 0 3 410.381 4.092 20 0 HIADHN COC(=O)c1ccccc1-c1ccc(CN[C@H]2CCO[C@@H]2c2ccnn2C(C)C)o1 ZINC000568328836 946511509 /nfs/dbraw/zinc/51/15/09/946511509.db2.gz PVJBVFUDHFKRRI-UGKGYDQZSA-N 0 3 409.486 4.130 20 0 HIADHN CC(C)Cn1cc(NC(=O)N[C@H]2CCN(Cc3ccccc3)[C@@H]2C)c(C(F)F)n1 ZINC000568524648 946575938 /nfs/dbraw/zinc/57/59/38/946575938.db2.gz APRZCTCNCGOCOX-WBVHZDCISA-N 0 3 405.493 4.261 20 0 HIADHN CN1CC[C@@H](NCC(=O)Nc2cccc(Cl)c2Cl)[C@@H]1c1ccc(F)c(F)c1 ZINC000568698310 946666231 /nfs/dbraw/zinc/66/62/31/946666231.db2.gz KJZPHYSYXILIEU-APWZRJJASA-N 0 3 414.283 4.245 20 0 HIADHN COc1cc(CN2CCC[C@H](c3nnc(C4CC4)[nH]3)C2)ccc1OCC(F)(F)F ZINC000568733312 946674544 /nfs/dbraw/zinc/67/45/44/946674544.db2.gz GYLULNFCMPBPBG-HNNXBMFYSA-N 0 3 410.440 4.011 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)Nc3ccnc4ccc(Oc5ccccc5)cc43)[C@H]2C1 ZINC000568803558 946703413 /nfs/dbraw/zinc/70/34/13/946703413.db2.gz RVNQKQUEEZDSDD-HXOBKFHXSA-N 0 3 402.498 4.007 20 0 HIADHN COCC[C@@H](COC)NCc1cccc(NC(=O)c2ccc(Cl)cc2Cl)c1 ZINC000568817204 946715434 /nfs/dbraw/zinc/71/54/34/946715434.db2.gz DNLFSNPGMMFXAB-KRWDZBQOSA-N 0 3 411.329 4.387 20 0 HIADHN C[C@H](c1ccc(F)cc1)N1CC[C@@H](N[C@@H]2c3ccccc3CC23CCOCC3)C1=O ZINC000569007379 946796344 /nfs/dbraw/zinc/79/63/44/946796344.db2.gz WGSYVMQWFCPSKI-NLSFWIRASA-N 0 3 408.517 4.171 20 0 HIADHN C/C(=C/c1cccc(C(F)(F)F)c1)CN1CCC(C(=O)Nc2nncs2)CC1 ZINC000569038881 946804920 /nfs/dbraw/zinc/80/49/20/946804920.db2.gz LECICEZNQJGXHV-LCYFTJDESA-N 0 3 410.465 4.311 20 0 HIADHN O[C@H](CN[C@H]1CCOc2c(Cl)cccc21)COc1ccccc1C(F)(F)F ZINC000569166058 946830568 /nfs/dbraw/zinc/83/05/68/946830568.db2.gz AOMJFXYZBYAORA-WBMJQRKESA-N 0 3 401.812 4.212 20 0 HIADHN CSc1ccc(NC(=O)CN[C@@H]2CCN(C(C)C)[C@@H]2c2ccc(F)c(F)c2)cc1 ZINC000569359496 946860384 /nfs/dbraw/zinc/86/03/84/946860384.db2.gz WJBJQUYGKGJGAY-IFMALSPDSA-N 0 3 419.541 4.439 20 0 HIADHN C[C@H](N[C@@H]1CCN(C)[C@H]1c1ccc(Cl)cc1)C(=O)Nc1ccccc1OC(F)F ZINC000569394811 946866082 /nfs/dbraw/zinc/86/60/82/946866082.db2.gz QJIRKDZTALHIMI-IRWQIABSSA-N 0 3 423.891 4.303 20 0 HIADHN CCN(C(=O)CN[C@@H]1CCN(C)[C@@H]1c1ccc(F)c(F)c1)[C@@H](C)c1ccc(F)cc1 ZINC000569510875 946882663 /nfs/dbraw/zinc/88/26/63/946882663.db2.gz QIGCPJFOKWSOTJ-PNDGYVOYSA-N 0 3 419.491 4.048 20 0 HIADHN CCOc1c(Cl)cc(CN(C)CCc2nc(-c3ccccc3)no2)cc1OC ZINC000569531702 946887766 /nfs/dbraw/zinc/88/77/66/946887766.db2.gz MZIFKXOGORVIEP-UHFFFAOYSA-N 0 3 401.894 4.472 20 0 HIADHN C[C@H](N[C@@H]1CCN(C)[C@H]1c1ccccc1)C(=O)N(c1nccs1)C1CCCCC1 ZINC000569533593 946888558 /nfs/dbraw/zinc/88/85/58/946888558.db2.gz LXZYEORLGYNJIS-WMQCIHAUSA-N 0 3 412.603 4.232 20 0 HIADHN CN(C)CCn1nccc1NC(=O)Cc1csc(-c2ccc(Cl)cc2Cl)n1 ZINC000569641063 946915665 /nfs/dbraw/zinc/91/56/65/946915665.db2.gz VZRFWGALXUHMHC-UHFFFAOYSA-N 0 3 424.357 4.056 20 0 HIADHN CN(C)C[C@@H](NC(=O)c1ccc2c(c1)[nH]c(=O)n2C1CCCC1)c1ccc(F)cc1 ZINC000569643513 946918168 /nfs/dbraw/zinc/91/81/68/946918168.db2.gz UCTDLDHMWLQUKF-HXUWFJFHSA-N 0 3 410.493 4.029 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccc(F)c2)C1)N1CCCn2c(cc3ccccc32)C1 ZINC000569730160 946956717 /nfs/dbraw/zinc/95/67/17/946956717.db2.gz HLPFGSWMOBTLJZ-OAQYLSRUSA-N 0 3 405.517 4.425 20 0 HIADHN C[C@H]1[C@@H](NC(=O)N2CCC(c3nc4ccccc4[nH]3)CC2)CCN1Cc1ccccc1 ZINC000569726639 946957108 /nfs/dbraw/zinc/95/71/08/946957108.db2.gz WWHINQZBUGPZFW-RXVVDRJESA-N 0 3 417.557 4.115 20 0 HIADHN CCCN(C)[C@H](CNC(=O)c1cnn(CCC(F)(F)F)c1)c1ccc(Cl)cc1 ZINC000569854973 947020863 /nfs/dbraw/zinc/02/08/63/947020863.db2.gz MCRRLYSZGMBFBP-QGZVFWFLSA-N 0 3 416.875 4.302 20 0 HIADHN Brc1cccc(-c2nc(CN[C@H]3CCOC4(CCOCC4)C3)cs2)c1 ZINC000569952486 947050466 /nfs/dbraw/zinc/05/04/66/947050466.db2.gz MGBIUIVYWDKHOA-INIZCTEOSA-N 0 3 423.376 4.390 20 0 HIADHN CCc1ccc([C@H](CNC(=O)Nc2ccc(Oc3cccnc3)nc2)N(C)C)cc1 ZINC000570064148 947082394 /nfs/dbraw/zinc/08/23/94/947082394.db2.gz BBDQVWMESNCOEM-NRFANRHFSA-N 0 3 405.502 4.256 20 0 HIADHN CC(=O)N(Cc1ccc(NC(=O)N[C@@H]2CCN(Cc3ccccc3)[C@H]2C)cc1)C(C)C ZINC000570125020 947104809 /nfs/dbraw/zinc/10/48/09/947104809.db2.gz YKCVMAKHXYFQFE-YADARESESA-N 0 3 422.573 4.228 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)c2csc(Br)c2)N(C)C)cc1 ZINC000570191817 947128172 /nfs/dbraw/zinc/12/81/72/947128172.db2.gz XTLPJBNCTCDQTQ-MRXNPFEDSA-N 0 3 411.365 4.331 20 0 HIADHN Cc1c(NC(=O)NC[C@@H](Cc2ccccc2)N(C)C)cnn1-c1ccc(Cl)cc1 ZINC000570197887 947137565 /nfs/dbraw/zinc/13/75/65/947137565.db2.gz XEIPBJBNTVZTLM-HXUWFJFHSA-N 0 3 411.937 4.129 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(NC(=O)c2ccncc2)cc1)c1ccc2c(c1)OCC(=O)N2 ZINC000570339162 947207057 /nfs/dbraw/zinc/20/70/57/947207057.db2.gz PLGVLYUMYAYIJH-JKSUJKDBSA-N 0 3 416.481 4.077 20 0 HIADHN CCN(CC(=O)Nc1ccc(NC(=O)c2cccs2)cc1)[C@@H]1CCOC(C)(C)C1 ZINC000570366721 947221700 /nfs/dbraw/zinc/22/17/00/947221700.db2.gz GDDCOYAUVGJPIP-GOSISDBHSA-N 0 3 415.559 4.218 20 0 HIADHN Cc1ccc(C)c(NC(=O)[C@H](C)N[C@H]2CCN(C)[C@H]2c2ccc(Cl)c(F)c2)c1 ZINC000570438504 947248134 /nfs/dbraw/zinc/24/81/34/947248134.db2.gz HQTFCJILKHFELB-ZRCAFCQKSA-N 0 3 403.929 4.458 20 0 HIADHN O=C(CN[C@@H]1c2ccccc2CC12CCOCC2)Nc1ccnn1CC1CCCCC1 ZINC000570859362 947372287 /nfs/dbraw/zinc/37/22/87/947372287.db2.gz ZSTMWKBPXUZFAZ-XMMPIXPASA-N 0 3 422.573 4.086 20 0 HIADHN C[C@@H]1CCc2c(F)cccc2[C@@H]1NCc1cccc(N2C(=O)N[C@@](C)(C3CC3)C2=O)c1 ZINC000570948157 947395970 /nfs/dbraw/zinc/39/59/70/947395970.db2.gz APHHDKSMGLFIQL-YQYBNWHVSA-N 0 3 421.516 4.464 20 0 HIADHN CCOC(=O)COc1ccc(CN2CCC(c3noc4cc(F)ccc43)CC2)cc1 ZINC000570983522 947413028 /nfs/dbraw/zinc/41/30/28/947413028.db2.gz LHOOCMVSINAFLU-UHFFFAOYSA-N 0 3 412.461 4.288 20 0 HIADHN COC(=O)c1ccc(CN[C@H](CN2CCCC2)c2ccccc2)c(Br)c1 ZINC000571110903 947504292 /nfs/dbraw/zinc/50/42/92/947504292.db2.gz VXHYARYFLIHJQK-HXUWFJFHSA-N 0 3 417.347 4.162 20 0 HIADHN CCCCOc1ccc(CN2CC[C@](CO)(Cc3ccc(F)cc3)C2)cc1OC ZINC000571365156 947623452 /nfs/dbraw/zinc/62/34/52/947623452.db2.gz JTJKUBJKAFNQRC-DEOSSOPVSA-N 0 3 401.522 4.440 20 0 HIADHN CCOC(=O)c1nnc(-c2cccc(C[NH2+][C@@H]3CCC[C@@H](c4ncccc4C)C3)c2)[n-]1 ZINC000571448175 947653576 /nfs/dbraw/zinc/65/35/76/947653576.db2.gz UZIGCLQDNHXNKT-UYAOXDASSA-N 0 3 419.529 4.168 20 0 HIADHN CCOC(=O)c1nc(-c2cccc(C[NH2+][C@@H]3CCC[C@@H](c4ncccc4C)C3)c2)n[n-]1 ZINC000571448175 947653585 /nfs/dbraw/zinc/65/35/85/947653585.db2.gz UZIGCLQDNHXNKT-UYAOXDASSA-N 0 3 419.529 4.168 20 0 HIADHN C[C@H]1[C@H](NC(=O)c2cc(F)c(F)cc2Br)CCN1Cc1ccccc1 ZINC000571474412 947663847 /nfs/dbraw/zinc/66/38/47/947663847.db2.gz FBKNZBGXIPIGTO-KPZWWZAWSA-N 0 3 409.274 4.120 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)NCc1cc2ccccc2s1 ZINC000571586395 947713490 /nfs/dbraw/zinc/71/34/90/947713490.db2.gz YUTNNPIPKFZMJY-UHFFFAOYSA-N 0 3 403.498 4.453 20 0 HIADHN Cc1ccccc1-n1cc(CNC[C@H]2CCN(C)[C@@H]2c2ccc(Cl)c(F)c2)nn1 ZINC000571717581 947760329 /nfs/dbraw/zinc/76/03/29/947760329.db2.gz DYKNOWFJHYCYBR-VGOFRKELSA-N 0 3 413.928 4.151 20 0 HIADHN COc1ccc(CN2CCC[C@@H](CNC(=O)Nc3ccc(C)cc3)C2)c(C)c1OC ZINC000571808001 947791210 /nfs/dbraw/zinc/79/12/10/947791210.db2.gz SRYSPAZYOMFQIQ-IBGZPJMESA-N 0 3 411.546 4.354 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)c1nc2ccccc2cc1Br)c1ccco1 ZINC000571843104 947802971 /nfs/dbraw/zinc/80/29/71/947802971.db2.gz RKSJUNGENQBEBV-CXAGYDPISA-N 0 3 416.319 4.450 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N[C@@H]2c3ccccc3CC23CCOCC3)C1 ZINC000571936280 947816991 /nfs/dbraw/zinc/81/69/91/947816991.db2.gz UNRJPMAEMBYLCZ-ZFJSRUIDSA-N 0 3 419.569 4.215 20 0 HIADHN CCc1c(NC(=O)[C@@H]2CCCN(Cc3cccnc3)C2)cnn1-c1ccc(Cl)cc1 ZINC000571971715 947825809 /nfs/dbraw/zinc/82/58/09/947825809.db2.gz JVGZITHRBQDXML-GOSISDBHSA-N 0 3 423.948 4.334 20 0 HIADHN C[C@@H]1Cc2ccccc2N1Cc1ccoc1C(=O)N1CCCN(CC2CCC2)CC1 ZINC000571983308 947826231 /nfs/dbraw/zinc/82/62/31/947826231.db2.gz TVYLODRHCJKLJW-LJQANCHMSA-N 0 3 407.558 4.179 20 0 HIADHN CN1CC[C@@H](NCC(=O)NC2(c3ccccc3)CCC2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000572207745 947864561 /nfs/dbraw/zinc/86/45/61/947864561.db2.gz KJLYMTXRYYRADE-IRLDBZIGSA-N 0 3 415.940 4.010 20 0 HIADHN CN1CC[C@H](N[C@@H]2CCN(c3ccccc3Cl)C2=O)[C@H]1c1ccc(Cl)cc1 ZINC000572289707 947876426 /nfs/dbraw/zinc/87/64/26/947876426.db2.gz NAKPIYIKHXAESJ-NLWGTHIKSA-N 0 3 404.341 4.134 20 0 HIADHN CCOc1cc(CN2CCC[C@@H](c3ccnc(N)n3)C2)ccc1OCc1ccccc1 ZINC000572324127 947885111 /nfs/dbraw/zinc/88/51/11/947885111.db2.gz JQEMBOPQFQCZJX-OAQYLSRUSA-N 0 3 418.541 4.416 20 0 HIADHN O=S(=O)(Cc1ccccc1CN[C@@H]1CCCc2c(Cl)cccc21)N1CCCC1 ZINC000572325175 947885182 /nfs/dbraw/zinc/88/51/82/947885182.db2.gz XDLBSTWWODYFJH-JOCHJYFZSA-N 0 3 418.990 4.433 20 0 HIADHN COc1ccc([C@@H]2CCCCCN2C(=O)CN2CCCC3(CCOCC3)C2)cc1 ZINC000572331271 947886555 /nfs/dbraw/zinc/88/65/55/947886555.db2.gz BRQCDPMJGRIOHO-QFIPXVFZSA-N 0 3 400.563 4.032 20 0 HIADHN COc1ccc2c(c1F)CC[C@H]2N[C@@H](C)c1cc(F)ccc1N1CCN(C)CC1 ZINC000572439754 947905650 /nfs/dbraw/zinc/90/56/50/947905650.db2.gz FPNCDTAMDALSAH-MGPUTAFESA-N 0 3 401.501 4.063 20 0 HIADHN COc1ccc(C[C@@H](CO)CNCc2cc(C(F)(F)F)ccc2Cl)cc1O ZINC000572526354 947932230 /nfs/dbraw/zinc/93/22/30/947932230.db2.gz DAMPUAKBNMSJRW-CYBMUJFWSA-N 0 3 403.828 4.014 20 0 HIADHN CCc1oc(CNC[C@@H]2CCN(c3cccc(Br)c3)C2)cc1C(=O)OC ZINC000572620521 947957888 /nfs/dbraw/zinc/95/78/88/947957888.db2.gz LHPHGWYWIIXXSD-AWEZNQCLSA-N 0 3 421.335 4.007 20 0 HIADHN CC[C@H](C)[C@@H](C)N(CC(=O)N1c2ccccc2NC(=O)C[C@@H]1C(F)(F)F)C1CC1 ZINC000572626583 947960132 /nfs/dbraw/zinc/96/01/32/947960132.db2.gz QQKHEURALLMHFF-PMUMKWKESA-N 0 3 411.468 4.192 20 0 HIADHN C[C@H](NC(=O)c1nccnc1-c1nc2ccccc2s1)[C@H](c1ccccc1)N(C)C ZINC000572631123 947962126 /nfs/dbraw/zinc/96/21/26/947962126.db2.gz LXLUFWQTEKCIEX-YCRPNKLZSA-N 0 3 417.538 4.175 20 0 HIADHN C[C@H]1C[C@H]1N1CCN(C(=O)c2ccc(Br)c(C(F)(F)F)c2)C[C@@H](C)C1 ZINC000572670966 947975411 /nfs/dbraw/zinc/97/54/11/947975411.db2.gz JSNWBQPHRCXOAF-MQIPJXDCSA-N 0 3 419.285 4.270 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)c1cnnn1-c1c(Cl)cccc1Cl)c1ccco1 ZINC000572750747 948000698 /nfs/dbraw/zinc/00/06/98/948000698.db2.gz JZZWVWUJGUAZNV-IUODEOHRSA-N 0 3 422.316 4.026 20 0 HIADHN O=C(NCc1csc(-c2ccccc2)n1)N1CCCN(Cc2ccccc2)CC1 ZINC000572913873 948037754 /nfs/dbraw/zinc/03/77/54/948037754.db2.gz UVNDHHXSDURFFM-UHFFFAOYSA-N 0 3 406.555 4.228 20 0 HIADHN COc1ccc([C@@H](NCCC(=O)Nc2ccccn2)C(C)C)c(Br)c1 ZINC000573170699 948099984 /nfs/dbraw/zinc/09/99/84/948099984.db2.gz INOQZTGMRWPJDK-IBGZPJMESA-N 0 3 406.324 4.168 20 0 HIADHN COc1cccc(OC)c1OCCCCN1CCc2c(cnn2-c2ccccc2)C1 ZINC000573403209 948186560 /nfs/dbraw/zinc/18/65/60/948186560.db2.gz RCNFWLFCYPCNNF-UHFFFAOYSA-N 0 3 407.514 4.107 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1cc(Cl)ccc1N1CCOCC1)c1ccco1 ZINC000573751923 948289013 /nfs/dbraw/zinc/28/90/13/948289013.db2.gz OECIVWWYXDGEGB-YJBOKZPZSA-N 0 3 420.941 4.021 20 0 HIADHN Cc1ccc(-c2n[nH]c(NC(=O)[C@H]3CCn4c(cnc4C4CCCCC4)C3)c2C)o1 ZINC000573789242 948300055 /nfs/dbraw/zinc/30/00/55/948300055.db2.gz VCIDRHBQQFIUIG-KRWDZBQOSA-N 0 3 407.518 4.732 20 0 HIADHN Cc1nc(-c2ccc(F)cc2)sc1C(=O)Nc1cccc(CN2CC[C@@H](O)C2)c1 ZINC000573942959 948329374 /nfs/dbraw/zinc/32/93/74/948329374.db2.gz LASSKLHTCGQFOW-LJQANCHMSA-N 0 3 411.502 4.077 20 0 HIADHN CN(C)C[C@@H](NC(=O)CSCc1cc(-c2cccs2)on1)c1ccc(F)cc1 ZINC000574190300 948382901 /nfs/dbraw/zinc/38/29/01/948382901.db2.gz UGHFSGKYVTTWJD-QGZVFWFLSA-N 0 3 419.547 4.195 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)N2CC=C(c3c[nH]c4ncccc34)CC2)CCN1Cc1ccccc1 ZINC000574306960 948407578 /nfs/dbraw/zinc/40/75/78/948407578.db2.gz NLJKUNNMDBJGLN-JPYJTQIMSA-N 0 3 415.541 4.025 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)Nc2cccnc2C(F)(F)F)N(C)C)cc1 ZINC000574313682 948409936 /nfs/dbraw/zinc/40/99/36/948409936.db2.gz PBMBLQSJUHSXFU-QGZVFWFLSA-N 0 3 410.440 4.312 20 0 HIADHN Cc1cccc(Br)c1C(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000574435452 948440735 /nfs/dbraw/zinc/44/07/35/948440735.db2.gz GZKIYTWFEDADOK-CALCHBBNSA-N 0 3 423.395 4.109 20 0 HIADHN COc1ccc(CN2C[C@@H]3CCC[N@@H+]3Cc3ccccc32)c(Br)c1[O-] ZINC000574445987 948445441 /nfs/dbraw/zinc/44/54/41/948445441.db2.gz VSPRAXPFQBFLQM-INIZCTEOSA-N 0 3 403.320 4.148 20 0 HIADHN COc1ccc(CN2C[C@@H]3CCC[N@H+]3Cc3ccccc32)c(Br)c1[O-] ZINC000574445987 948445444 /nfs/dbraw/zinc/44/54/44/948445444.db2.gz VSPRAXPFQBFLQM-INIZCTEOSA-N 0 3 403.320 4.148 20 0 HIADHN C[C@@H](NC[C@H](c1ccc(Cl)cc1)N1CCOCC1)c1ccc(Br)cn1 ZINC000574456534 948446898 /nfs/dbraw/zinc/44/68/98/948446898.db2.gz ZBNUCNQZBJKJEN-AUUYWEPGSA-N 0 3 424.770 4.222 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)NCc1ccccc1NC(C)=O)c1ccc(Cl)cc1 ZINC000574553592 948469966 /nfs/dbraw/zinc/46/99/66/948469966.db2.gz KLYSHXIOCOGWJL-NRFANRHFSA-N 0 3 416.953 4.181 20 0 HIADHN O=C(Nc1cc(F)c(F)cc1N1CCCCC1)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000574585667 948482007 /nfs/dbraw/zinc/48/20/07/948482007.db2.gz SIQYCTIHEXMKSB-SFHVURJKSA-N 0 3 414.500 4.201 20 0 HIADHN Cc1nc(C(C)C)ccc1CN(C)[C@H](C)c1ccc(N2CCCS2(=O)=O)cc1 ZINC000574664145 948498949 /nfs/dbraw/zinc/49/89/49/948498949.db2.gz DPJMLFPIJGLGHB-GOSISDBHSA-N 0 3 401.576 4.246 20 0 HIADHN COC(=O)c1ccc(COc2ccccc2CN2CC[C@H](COC(F)F)C2)cc1 ZINC000574961035 948565609 /nfs/dbraw/zinc/56/56/09/948565609.db2.gz FQXXPUVKGOMDPX-KRWDZBQOSA-N 0 3 405.441 4.113 20 0 HIADHN COc1cc(CN[C@@H](C)c2ccc(-n3cccn3)cc2)cc(OC)c1OCC(F)F ZINC000575020197 948574455 /nfs/dbraw/zinc/57/44/55/948574455.db2.gz FYTUCDAIPRCKOT-HNNXBMFYSA-N 0 3 417.456 4.384 20 0 HIADHN COc1cc(C[NH2+][C@H]2c3ccccc3CC23CCOCC3)cc(Br)c1[O-] ZINC000575098569 948592680 /nfs/dbraw/zinc/59/26/80/948592680.db2.gz OQIKWSRZXUMXIH-FQEVSTJZSA-N 0 3 418.331 4.347 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)c1cn(-c2ccc(Cl)cc2)nc1C)c1ccco1 ZINC000575351701 948652264 /nfs/dbraw/zinc/65/22/64/948652264.db2.gz WQNHZBIJGMBQIE-KUHUBIRLSA-N 0 3 400.910 4.286 20 0 HIADHN CC[C@@H](N[C@H]1CCCc2cc(S(N)(=O)=O)ccc21)c1ccccc1OC(F)F ZINC000575360082 948653569 /nfs/dbraw/zinc/65/35/69/948653569.db2.gz PTGVBIIUZAAYAL-MSOLQXFVSA-N 0 3 410.486 4.054 20 0 HIADHN C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)C(C)(C)c1csc(-c2c(F)cccc2Cl)n1 ZINC000575631483 948683494 /nfs/dbraw/zinc/68/34/94/948683494.db2.gz PIVFRMPRRDWXAI-WBMJQRKESA-N 0 3 421.969 4.479 20 0 HIADHN CC(=O)CCc1ccc2oc(C(=O)Nc3cccc(CN4CC[C@H](O)C4)c3)c(C)c2c1 ZINC000575813658 948722149 /nfs/dbraw/zinc/72/21/49/948722149.db2.gz KNPTYSZXPUYLEA-NRFANRHFSA-N 0 3 420.509 4.082 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)c2c(F)cccc2Br)N(C)C)cc1 ZINC000575828404 948728312 /nfs/dbraw/zinc/72/83/12/948728312.db2.gz PQBOMAMVMCLXNI-GOSISDBHSA-N 0 3 423.326 4.408 20 0 HIADHN CSc1ccc([C@H](CNC(=O)CCn2c3ccccc3nc2C2CC2)N(C)C)cc1 ZINC000575950046 948798396 /nfs/dbraw/zinc/79/83/96/948798396.db2.gz QMXQMEKBSXJDSI-QFIPXVFZSA-N 0 3 422.598 4.445 20 0 HIADHN COc1ccc2cnc(N3CCC4(CC3)CN(Cc3cccs3)CCO4)cc2c1 ZINC001164698453 719895914 /nfs/dbraw/zinc/89/59/14/719895914.db2.gz TYVAZXBBRZINHD-UHFFFAOYSA-N 0 3 409.555 4.176 20 0 HIADHN C[C@@H]1CCc2c(sc3ncnc(N4CC[C@@H]5[C@@H]4CCN5Cc4cccnc4)c23)C1 ZINC001164725076 720380116 /nfs/dbraw/zinc/38/01/16/720380116.db2.gz LPYPMRJFBOHDHA-LZQZEXGQSA-N 0 3 405.571 4.064 20 0 HIADHN Clc1ccc2c(c1)nc(Cl)nc2N1CC[C@H]2[C@@H]1CCN2Cc1cccnc1 ZINC001164726892 720381347 /nfs/dbraw/zinc/38/13/47/720381347.db2.gz PVCBEQYCDNNEHX-ROUUACIJSA-N 0 3 400.313 4.185 20 0 HIADHN c1ccc(Cc2nnc(N3CC[C@@H]4[C@@H]3CCN4Cc3cccnc3)c3ccccc23)cc1 ZINC001164727698 720431839 /nfs/dbraw/zinc/43/18/39/720431839.db2.gz DXBLZNFNSQVMNL-FTJBHMTQSA-N 0 3 421.548 4.469 20 0 HIADHN FC(F)(c1ccc(Cl)nc1Cl)N1CCCn2cnc(CNC3CCC3)c2C1 ZINC001164838892 720736409 /nfs/dbraw/zinc/73/64/09/720736409.db2.gz ZDJIZBNZYFYTEQ-UHFFFAOYSA-N 0 3 416.303 4.182 20 0 HIADHN Cn1cc(CN2CC[C@@H]3CN(c4cc(Cl)nc5cc(Cl)ccc54)C[C@@H]3C2)cn1 ZINC001164771730 721107357 /nfs/dbraw/zinc/10/73/57/721107357.db2.gz STTYADUCBXDGFU-CVEARBPZSA-N 0 3 416.356 4.233 20 0 HIADHN Cn1cc(CN2CC[C@H]3CN(c4cc(SCc5ccccc5)ccn4)C[C@@H]3C2)cn1 ZINC001164770681 721213163 /nfs/dbraw/zinc/21/31/63/721213163.db2.gz OCYLBBDKNLDBSP-VXKWHMMOSA-N 0 3 419.598 4.066 20 0 HIADHN Cn1cc(CN2CC[C@@H]3CN(c4cc(SCc5ccccc5)ccn4)C[C@H]3C2)cn1 ZINC001164770676 721213363 /nfs/dbraw/zinc/21/33/63/721213363.db2.gz OCYLBBDKNLDBSP-FGZHOGPDSA-N 0 3 419.598 4.066 20 0 HIADHN Cn1cc(CN2CC[C@@H]3CN(c4cc(SCc5ccccc5)ccn4)C[C@@H]3C2)cn1 ZINC001164770685 721213814 /nfs/dbraw/zinc/21/38/14/721213814.db2.gz OCYLBBDKNLDBSP-YADHBBJMSA-N 0 3 419.598 4.066 20 0 HIADHN Cn1cc(CN2CC[C@@H]3CN(c4ccc5c(Cl)ccc(Cl)c5n4)C[C@@H]3C2)cn1 ZINC001164760714 721235303 /nfs/dbraw/zinc/23/53/03/721235303.db2.gz GHPMEOIHUJUJJQ-CVEARBPZSA-N 0 3 416.356 4.233 20 0 HIADHN Fc1cccc(O[C@H]2C[C@H]3CN(c4ccc(-c5ccccc5Cl)nn4)CCN3C2)c1 ZINC001164903400 721544469 /nfs/dbraw/zinc/54/44/69/721544469.db2.gz CJXAGEBSSTYDCV-HKUYNNGSSA-N 0 3 424.907 4.278 20 0 HIADHN Cc1cnc(N2CCN3C[C@@H](Oc4cccc(F)c4)C[C@@H]3C2)nc1-c1ccccc1F ZINC001164911888 721565604 /nfs/dbraw/zinc/56/56/04/721565604.db2.gz ZVCRYZBRKQAXDQ-QUCCMNQESA-N 0 3 422.479 4.072 20 0 HIADHN Clc1cccc2nc(N3CCC4(CC3)COCCN(Cc3ccncc3)C4)ccc12 ZINC001164964795 722055623 /nfs/dbraw/zinc/05/56/23/722055623.db2.gz XTJQQRAHVJRMDH-UHFFFAOYSA-N 0 3 422.960 4.402 20 0 HIADHN Clc1ccc2nc(N3CC[C@@H]4CN(Cc5cccnc5)CCO[C@@H]4C3)ccc2c1 ZINC001164986155 722103885 /nfs/dbraw/zinc/10/38/85/722103885.db2.gz YFGUMDFEFGFQCA-DENIHFKCSA-N 0 3 408.933 4.011 20 0 HIADHN Clc1cccc2ccc(N3CC[C@@H]4CN(Cc5cccnc5)CCO[C@H]4C3)nc12 ZINC001164976489 722110624 /nfs/dbraw/zinc/11/06/24/722110624.db2.gz LSFXSNYCLFPYAN-CTNGQTDRSA-N 0 3 408.933 4.011 20 0 HIADHN Clc1cccc2c1ccnc2N1CC[C@@H]2CN(Cc3cccnc3)CCO[C@@H]2C1 ZINC001164974899 722114279 /nfs/dbraw/zinc/11/42/79/722114279.db2.gz IVHDKVDGEPXQRX-XMSQKQJNSA-N 0 3 408.933 4.011 20 0 HIADHN Clc1cccc2nc(N3CC[C@H]4CN(Cc5cccnc5)CCO[C@H]4C3)ccc12 ZINC001164983712 722114510 /nfs/dbraw/zinc/11/45/10/722114510.db2.gz ZERYWFLWBZGCMM-AVRDEDQJSA-N 0 3 408.933 4.011 20 0 HIADHN Cc1c(C(=O)Nc2cccc(CN3CCC(O)CC3)c2)cnn1-c1cc(C)ccc1C ZINC000435976065 861241410 /nfs/dbraw/zinc/24/14/10/861241410.db2.gz UVPGOKXFASLTEE-UHFFFAOYSA-N 0 3 418.541 4.007 20 0 HIADHN CN(C)Cc1cccc(C(=O)N[C@H]2C[C@H](c3ccc(F)c(Br)c3)C2)c1 ZINC000435996771 861281880 /nfs/dbraw/zinc/28/18/80/861281880.db2.gz AETRUZFGMOJXKZ-QAQDUYKDSA-N 0 3 405.311 4.326 20 0 HIADHN CN(C)CCN(C(=O)Nc1cc(C(F)(F)F)ccc1-n1cccn1)C1CCCC1 ZINC000436016651 861307651 /nfs/dbraw/zinc/30/76/51/861307651.db2.gz SQWOLZVXYMIMQP-UHFFFAOYSA-N 0 3 409.456 4.229 20 0 HIADHN CN(C)Cc1ccccc1CNC(=O)c1ccc2c(c1)C[C@@H](c1ccccc1)OC2=O ZINC000010299599 845643235 /nfs/dbraw/zinc/64/32/35/845643235.db2.gz WUVLTOKJKGOZMU-DEOSSOPVSA-N 0 3 414.505 4.132 20 0 HIADHN CCc1ccc([C@H](CNC(=O)C2CCN(c3nc4ccccc4o3)CC2)N(C)C)cc1 ZINC000011604104 845816892 /nfs/dbraw/zinc/81/68/92/845816892.db2.gz VNYAZYFZLPMGKT-QFIPXVFZSA-N 0 3 420.557 4.026 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)C2CCN(c3nc4ccccc4o3)CC2)N(C)C)cc1 ZINC000011604102 845817079 /nfs/dbraw/zinc/81/70/79/845817079.db2.gz VNYAZYFZLPMGKT-JOCHJYFZSA-N 0 3 420.557 4.026 20 0 HIADHN COc1cccc(NC(=O)[C@@H](NCCCn2cnc3ccccc32)c2ccccc2)c1 ZINC000015504831 846055029 /nfs/dbraw/zinc/05/50/29/846055029.db2.gz SZFNUJMSGCTHPR-DEOSSOPVSA-N 0 3 414.509 4.405 20 0 HIADHN CCc1ccc([C@H](NCC(=O)NCC(=O)Nc2c(C)cc(C)cc2C)C(C)C)cc1 ZINC000015522602 846058741 /nfs/dbraw/zinc/05/87/41/846058741.db2.gz PAASZKPEQFBYBO-XMMPIXPASA-N 0 3 409.574 4.216 20 0 HIADHN COc1ccc(CCNCc2c(C)nn(Cc3ccc(F)cc3)c2Cl)cc1OC ZINC000017310878 846244715 /nfs/dbraw/zinc/24/47/15/846244715.db2.gz NSLARQNZHSVQTK-UHFFFAOYSA-N 0 3 417.912 4.382 20 0 HIADHN COc1ccc([C@@H](CNC(=O)CCc2nc3ccccc3s2)N2CCCC2)cc1 ZINC000017911548 846277161 /nfs/dbraw/zinc/27/71/61/846277161.db2.gz WLHATHQIMOYKAJ-HXUWFJFHSA-N 0 3 409.555 4.191 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)CSc3cc(C)c4ccccc4n3)cc2)CC1 ZINC000018488825 846329165 /nfs/dbraw/zinc/32/91/65/846329165.db2.gz SCJUEXLXOOYQOY-UHFFFAOYSA-N 0 3 420.582 4.416 20 0 HIADHN O=C(CN1CCC[C@@H]1c1ccccc1)N1CCC[C@@H]1c1ccc2c(c1)OCCCO2 ZINC000022549177 846586023 /nfs/dbraw/zinc/58/60/23/846586023.db2.gz WPOLVUYCWNXNPF-FGZHOGPDSA-N 0 3 406.526 4.349 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1ccc(Br)cc1)c1cccc(OC)c1 ZINC000022700475 846605960 /nfs/dbraw/zinc/60/59/60/846605960.db2.gz YXNCUQHNOAHKKJ-LJQANCHMSA-N 0 3 405.336 4.271 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1ccc(Br)cc1F)c1cccc(OC)c1 ZINC000022700802 846606423 /nfs/dbraw/zinc/60/64/23/846606423.db2.gz RYMGBZXFNHFHEQ-IBGZPJMESA-N 0 3 423.326 4.410 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Cc1cc(Cl)ccc1OC)c1cccc(OC)c1 ZINC000022700808 846606441 /nfs/dbraw/zinc/60/64/41/846606441.db2.gz VPCQVEGTZFVGRJ-HXUWFJFHSA-N 0 3 404.938 4.099 20 0 HIADHN O=C(CN1CCCN(Cc2ccccc2)CC1)Nc1ccccc1SC(F)F ZINC000022807323 846624109 /nfs/dbraw/zinc/62/41/09/846624109.db2.gz VXSHMTUKQURWBB-UHFFFAOYSA-N 0 3 405.514 4.148 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)c2ccc(OCc3cccnc3)cc2)N(C)C)cc1 ZINC000023114140 846660304 /nfs/dbraw/zinc/66/03/04/846660304.db2.gz BTDYTKOPMLAQDF-XMMPIXPASA-N 0 3 403.526 4.256 20 0 HIADHN COc1cc(CN(C)C[C@@H](O)COc2ccc3ccccc3c2)ccc1OC(F)F ZINC000023408738 846696470 /nfs/dbraw/zinc/69/64/70/846696470.db2.gz LYIHWQQPZDCCMG-LJQANCHMSA-N 0 3 417.452 4.322 20 0 HIADHN CCc1c(C(=O)NC[C@H](c2ccccc2)N2CCCC2)cnn1-c1ccc(F)cc1 ZINC000024556146 846837679 /nfs/dbraw/zinc/83/76/79/846837679.db2.gz XXPYNKVHOPKCFU-HSZRJFAPSA-N 0 3 406.505 4.141 20 0 HIADHN CC(C)NC(=O)Nc1cccc(C(=O)NC[C@H](C(C)C)N2CCc3ccccc3C2)c1 ZINC000024622192 846844270 /nfs/dbraw/zinc/84/42/70/846844270.db2.gz GYYGWZQKBGDXNP-HSZRJFAPSA-N 0 3 422.573 4.029 20 0 HIADHN O=C(CN[C@@H](Cc1ccccc1)c1ccccc1)Nc1cccc(N2CCCC2=O)c1 ZINC000024734701 846859840 /nfs/dbraw/zinc/85/98/40/846859840.db2.gz AEXLRBAHYOIDJB-DEOSSOPVSA-N 0 3 413.521 4.326 20 0 HIADHN O=C(CN[C@@H](Cc1ccccc1)c1ccccc1)Nc1ccccc1N1CCCC1=O ZINC000024734693 846860213 /nfs/dbraw/zinc/86/02/13/846860213.db2.gz ABGXPXNFCIILKX-QHCPKHFHSA-N 0 3 413.521 4.326 20 0 HIADHN CN(C)[C@H](CNC(=O)c1cc(-c2ccccn2)nc2ccccc21)Cc1ccccc1 ZINC000025079894 846920401 /nfs/dbraw/zinc/92/04/01/846920401.db2.gz DZUNIRIIAHRTMA-FQEVSTJZSA-N 0 3 410.521 4.200 20 0 HIADHN CCN(Cc1ccc(OC)c(OC)c1)C[C@H](O)COc1c(Cl)cccc1Cl ZINC000025234737 846945193 /nfs/dbraw/zinc/94/51/93/846945193.db2.gz RBJPTJKCHANCSD-HNNXBMFYSA-N 0 3 414.329 4.272 20 0 HIADHN Cc1ccccc1[C@@H](OC[C@H](O)CN(C)Cc1ccc2c(c1)OCO2)c1ccccc1 ZINC000025368614 846969125 /nfs/dbraw/zinc/96/91/25/846969125.db2.gz MSABDJBWLVNITJ-GJZUVCINSA-N 0 3 419.521 4.323 20 0 HIADHN O=C1c2ccccc2C(=O)N1CCCN1CCC(c2nc3ccccc3s2)CC1 ZINC000025788697 847037187 /nfs/dbraw/zinc/03/71/87/847037187.db2.gz CDQIGUHXEKQIPR-UHFFFAOYSA-N 0 3 405.523 4.162 20 0 HIADHN CCCc1ccc([C@@H](NCC(=O)Nc2oc(C)c3c2c(=O)[nH]nc3C)C(C)C)cc1 ZINC000025817372 847041193 /nfs/dbraw/zinc/04/11/93/847041193.db2.gz JCFVBKBGPOALMM-NRFANRHFSA-N 0 3 410.518 4.011 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cc2cc(OC)ccc2nc1C)c1cccc(OC)c1 ZINC000025862623 847048274 /nfs/dbraw/zinc/04/82/74/847048274.db2.gz CFKDMNJBWBWVJI-XMMPIXPASA-N 0 3 421.541 4.373 20 0 HIADHN CC(=O)Nc1ccc(S(=O)(=O)[N-]c2ccccc2C[N@@H+](C)C2CCCCC2)cc1 ZINC000026093982 847083029 /nfs/dbraw/zinc/08/30/29/847083029.db2.gz ZAGFQJZUZWLXAZ-UHFFFAOYSA-N 0 3 415.559 4.210 20 0 HIADHN CC(=O)Nc1ccc(S(=O)(=O)[N-]c2ccccc2C[N@H+](C)C2CCCCC2)cc1 ZINC000026093982 847083037 /nfs/dbraw/zinc/08/30/37/847083037.db2.gz ZAGFQJZUZWLXAZ-UHFFFAOYSA-N 0 3 415.559 4.210 20 0 HIADHN CCSc1ccc(-c2nn(-c3ccccc3)cc2CNCCNC(=O)C2CC2)cc1 ZINC000026308963 847122853 /nfs/dbraw/zinc/12/28/53/847122853.db2.gz BKPBINXNTCLSFI-UHFFFAOYSA-N 0 3 420.582 4.267 20 0 HIADHN COc1cccc([C@@H](CNC(=O)Cc2c(C)nc3ccccc3c2C)N2CCCC2)c1 ZINC000027340444 847286251 /nfs/dbraw/zinc/28/62/51/847286251.db2.gz JJIHGTMQXNRTFG-RUZDIDTESA-N 0 3 417.553 4.356 20 0 HIADHN CCOc1ccc([C@@H](NCC(=O)Nc2ccc3c(c2)OCO3)C(C)C)cc1OCC ZINC000027379457 847292360 /nfs/dbraw/zinc/29/23/60/847292360.db2.gz GBTQZMGVJNRTMC-QHCPKHFHSA-N 0 3 414.502 4.138 20 0 HIADHN Cc1onc(-c2c(F)cccc2Cl)c1C(=O)NC[C@@H](Cc1ccccc1)N(C)C ZINC000027589271 847324290 /nfs/dbraw/zinc/32/42/90/847324290.db2.gz XPKHDOCLRLAKJW-MRXNPFEDSA-N 0 3 415.896 4.345 20 0 HIADHN Cc1oc(-c2cccs2)nc1CC(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000027608115 847327113 /nfs/dbraw/zinc/32/71/13/847327113.db2.gz IMZPJLHHMAHJGC-INIZCTEOSA-N 0 3 401.557 4.269 20 0 HIADHN O=C(NC1CCN(Cc2ccccc2)CC1)c1cnn(-c2ccccc2)c1C1CC1 ZINC000028272857 847401855 /nfs/dbraw/zinc/40/18/55/847401855.db2.gz MRQHPSJUOSMQQJ-UHFFFAOYSA-N 0 3 400.526 4.144 20 0 HIADHN CC1CCN([C@@H](CNc2ccc3nnc(C(F)(F)F)n3n2)c2cccs2)CC1 ZINC000028740052 847454499 /nfs/dbraw/zinc/45/44/99/847454499.db2.gz MXARRSGKYXNXOU-ZDUSSCGKSA-N 0 3 410.469 4.090 20 0 HIADHN O=C(CCN1CCN(c2ccccc2)CC1)N[C@H](c1cccs1)c1ccccc1 ZINC000028843166 847468525 /nfs/dbraw/zinc/46/85/25/847468525.db2.gz IKGHQXAICJBRQO-DEOSSOPVSA-N 0 3 405.567 4.166 20 0 HIADHN CNC(=O)C1CCN(Cc2cn(-c3ccccc3)nc2-c2ccc(Cl)cc2)CC1 ZINC000029146650 847513414 /nfs/dbraw/zinc/51/34/14/847513414.db2.gz HQNBYWBZOVHICZ-UHFFFAOYSA-N 0 3 408.933 4.151 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)c1cc(Cl)c2c(c1)OCCCO2 ZINC000029178473 847521139 /nfs/dbraw/zinc/52/11/39/847521139.db2.gz UQKKYHPFYNHSAR-LJQANCHMSA-N 0 3 400.906 4.068 20 0 HIADHN O=C(COc1ccc(Oc2ccccn2)cc1)N[C@H](CN1CCCC1)c1ccccc1 ZINC000029179706 847521692 /nfs/dbraw/zinc/52/16/92/847521692.db2.gz RGBNJEQIGUEYNQ-HSZRJFAPSA-N 0 3 417.509 4.206 20 0 HIADHN O=C(NCc1ccccc1OC(F)(F)F)N[C@H](CN1CCCC1)c1ccccc1 ZINC000029326952 847545591 /nfs/dbraw/zinc/54/55/91/847545591.db2.gz GMSCTOSLCLPSEX-GOSISDBHSA-N 0 3 407.436 4.222 20 0 HIADHN CC(C)N(C)C(=O)C1CC[NH+](Cc2c([O-])ccc3cc(Br)ccc32)CC1 ZINC000029586393 847584205 /nfs/dbraw/zinc/58/42/05/847584205.db2.gz CTCSHQKPGAJLIY-UHFFFAOYSA-N 0 3 419.363 4.387 20 0 HIADHN COc1ccc(NC(=O)c2ccccc2NC(=O)CN([C@@H](C)C2CC2)C2CC2)cc1 ZINC000029725340 847610034 /nfs/dbraw/zinc/61/00/34/847610034.db2.gz PAHLWITXTXXQPA-INIZCTEOSA-N 0 3 407.514 4.149 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)CCc3ccc(OC(F)F)cc3)cc2)CC1 ZINC000029798946 847621758 /nfs/dbraw/zinc/62/17/58/847621758.db2.gz PSTCKDPROKXRSF-UHFFFAOYSA-N 0 3 403.473 4.001 20 0 HIADHN Cc1nn(Cc2ccccc2)c(Cl)c1C(=O)NCCCN1CCc2ccccc2C1 ZINC000029837936 847629741 /nfs/dbraw/zinc/62/97/41/847629741.db2.gz CLCDATNTMUUDKG-UHFFFAOYSA-N 0 3 422.960 4.071 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cc(-c2ccccc2F)on1)c1cccc(OC)c1 ZINC000030037588 847676690 /nfs/dbraw/zinc/67/66/90/847676690.db2.gz FKMYGHLRZMZLEP-OAQYLSRUSA-N 0 3 411.477 4.302 20 0 HIADHN COc1ccc(CNCc2ccc(Cn3cccn3)cc2)cc1OCc1cccnc1 ZINC000030629976 847747457 /nfs/dbraw/zinc/74/74/57/847747457.db2.gz CFWIHSLTRNKYAA-UHFFFAOYSA-N 0 3 414.509 4.204 20 0 HIADHN O=C(CNCc1ccc(-c2ccccc2Br)s1)NCc1ccco1 ZINC000030641848 847751237 /nfs/dbraw/zinc/75/12/37/847751237.db2.gz PJZKCPKSAIPYGO-UHFFFAOYSA-N 0 3 405.317 4.177 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2CNCc2ccnc(-n3cccn3)c2)o1 ZINC000030901118 847794532 /nfs/dbraw/zinc/79/45/32/847794532.db2.gz MRRPUZGYGNDFJV-UHFFFAOYSA-N 0 3 410.481 4.311 20 0 HIADHN COc1cc(Br)c(CNC[C@@H]2CCN(c3ccccc3)C2)cc1OC ZINC000030907429 847795167 /nfs/dbraw/zinc/79/51/67/847795167.db2.gz PNFHYMBSRHZELY-HNNXBMFYSA-N 0 3 405.336 4.082 20 0 HIADHN COc1cc(CNCc2cccc(Cn3ccnc3)c2)ccc1OCc1ccncc1 ZINC000030901858 847795615 /nfs/dbraw/zinc/79/56/15/847795615.db2.gz ZJGFFIYWUPVMHO-UHFFFAOYSA-N 0 3 414.509 4.204 20 0 HIADHN COc1cc(OC)c(OC)cc1CNC[C@H](c1c(F)cccc1Cl)N1CCCC1 ZINC000030910894 847797499 /nfs/dbraw/zinc/79/74/99/847797499.db2.gz NFDVAWJUHMLPIE-GOSISDBHSA-N 0 3 422.928 4.432 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCc1cccnc1OC1CCCC1)c1ccsc1 ZINC000031195514 847841037 /nfs/dbraw/zinc/84/10/37/847841037.db2.gz HNJUZOQTAWAMIJ-FQEVSTJZSA-N 0 3 416.591 4.347 20 0 HIADHN C[C@@H]1CCC[C@@H](C)N1C(=O)COc1ccc(C(=O)Nc2ccccc2CN(C)C)cc1 ZINC000031232675 847847646 /nfs/dbraw/zinc/84/76/46/847847646.db2.gz KNHDKKRWDIKLFP-RTBURBONSA-N 0 3 423.557 4.169 20 0 HIADHN COc1ccc(Br)c(C(=O)N2CCCN(Cc3ccccc3C)CC2)c1 ZINC000031766795 847945466 /nfs/dbraw/zinc/94/54/66/847945466.db2.gz RHNBVLKMTRXCRM-UHFFFAOYSA-N 0 3 417.347 4.114 20 0 HIADHN O=C(COC(c1ccccc1)c1ccccc1)NCC1(N2CCSCC2)CCCC1 ZINC000031960149 847972018 /nfs/dbraw/zinc/97/20/18/847972018.db2.gz XQLDXFKRGYVEBE-UHFFFAOYSA-N 0 3 424.610 4.270 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1ccc(OC[C@H]2CCCO2)cc1)c1ccsc1 ZINC000031988940 847975678 /nfs/dbraw/zinc/97/56/78/847975678.db2.gz DQVNVDJIHHRCDB-RTWAWAEBSA-N 0 3 402.560 4.119 20 0 HIADHN O=C(Nc1ccc(C(=O)NCCCN2CCc3ccccc3C2)cc1)c1cccs1 ZINC000032399888 848019347 /nfs/dbraw/zinc/01/93/47/848019347.db2.gz FAXHPQZKOBIENR-UHFFFAOYSA-N 0 3 419.550 4.179 20 0 HIADHN CC[C@@H](CNC(=O)c1cc(C)n(Cc2ccco2)c1C)N1CCc2ccccc2C1 ZINC000032446575 848028890 /nfs/dbraw/zinc/02/88/90/848028890.db2.gz RYYXJRRKEQBFAR-QFIPXVFZSA-N 0 3 405.542 4.313 20 0 HIADHN Cc1cc(NC(=O)c2cc(Oc3ccccc3)ccc2[O-])n(C2CC[NH+](C)CC2)n1 ZINC000436584999 861860485 /nfs/dbraw/zinc/86/04/85/861860485.db2.gz OSZBGSFZHHLFHN-UHFFFAOYSA-N 0 3 406.486 4.208 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)Cn2c3ccccc3nc2C(F)(F)F)N(C)C)cc1 ZINC000032732916 848069321 /nfs/dbraw/zinc/06/93/21/848069321.db2.gz FMXZQSJNBLCGJN-LJQANCHMSA-N 0 3 418.463 4.037 20 0 HIADHN COc1cccc([C@@H](CNC(=O)Cc2ccc(Cl)cc2Cl)N2CCCC2)c1 ZINC000036074960 848146389 /nfs/dbraw/zinc/14/63/89/848146389.db2.gz WYFRSVPDXDYYKY-HXUWFJFHSA-N 0 3 407.341 4.498 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1ccc(CSc2nccn2C)o1)c1ccsc1 ZINC000041427941 848214841 /nfs/dbraw/zinc/21/48/41/848214841.db2.gz JUJCJPWXGHVCRO-QGZVFWFLSA-N 0 3 418.588 4.180 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Cc1csc(-c2ccccn2)n1)c1ccsc1 ZINC000041441326 848215948 /nfs/dbraw/zinc/21/59/48/848215948.db2.gz LGYDPYARNRXKBM-SFHVURJKSA-N 0 3 400.573 4.008 20 0 HIADHN N#CC(C(=O)C[C@@H](NC(=O)c1ccccc1)c1ccccc1)c1nc2ccccc2[nH]1 ZINC000041497887 848222768 /nfs/dbraw/zinc/22/27/68/848222768.db2.gz LNJCLLIBTMJKMI-DENIHFKCSA-N 0 3 408.461 4.301 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)c3occc3COc3ccccc3)cc2)CC1 ZINC000041578011 848234110 /nfs/dbraw/zinc/23/41/10/848234110.db2.gz KUMLLYQNGRVFON-UHFFFAOYSA-N 0 3 419.525 4.248 20 0 HIADHN C[C@@H](NC(=O)C(=O)Nc1cccc(CN(C)C)c1)C(c1ccccc1)c1ccccc1 ZINC000042003231 848273282 /nfs/dbraw/zinc/27/32/82/848273282.db2.gz BLMXCAUHOCUBRF-LJQANCHMSA-N 0 3 415.537 4.024 20 0 HIADHN CN(C)c1ccc(CNCc2cn(-c3ccccc3)nc2-c2ccc(F)cc2)cn1 ZINC000042227607 848305994 /nfs/dbraw/zinc/30/59/94/848305994.db2.gz CCIBNIUCBUWOGM-UHFFFAOYSA-N 0 3 401.489 4.429 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N[C@@H](C)c1cccc(NC(C)=O)c1)c1ccsc1 ZINC000042346515 848320641 /nfs/dbraw/zinc/32/06/41/848320641.db2.gz JNVWIQWSKNYQGJ-YWZLYKJASA-N 0 3 402.564 4.150 20 0 HIADHN COc1cc(-c2noc([C@@H]3CN(Cc4ccccc4)CCC3(F)F)n2)ccc1O ZINC000436680915 861892350 /nfs/dbraw/zinc/89/23/50/861892350.db2.gz LUSDGXVPSAYVFC-INIZCTEOSA-N 0 3 401.413 4.076 20 0 HIADHN CCN(Cc1ccc(OC)c(OC)c1)C(=O)NC[C@H](c1ccccc1)N1CCCC1 ZINC000042813339 848356828 /nfs/dbraw/zinc/35/68/28/848356828.db2.gz VGBLKRLMXCWTDX-OAQYLSRUSA-N 0 3 411.546 4.072 20 0 HIADHN CN(Cc1ccc(Br)o1)C(=O)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000042813794 848356854 /nfs/dbraw/zinc/35/68/54/848356854.db2.gz FVSZZICKBDBRQU-KRWDZBQOSA-N 0 3 406.324 4.021 20 0 HIADHN C[C@H](N[C@@H](C)c1cccc2ccccc21)C(=O)Nc1ccc(N2CCOCC2)cc1 ZINC000043303460 848406740 /nfs/dbraw/zinc/40/67/40/848406740.db2.gz XWUOELHCXASQKJ-OALUTQOASA-N 0 3 403.526 4.354 20 0 HIADHN COc1cc(OC)c(NC(=O)NC[C@@H](c2cccs2)N2CCCC2)cc1Cl ZINC000043413807 848421097 /nfs/dbraw/zinc/42/10/97/848421097.db2.gz HCJLFDVYRKZNQF-HNNXBMFYSA-N 0 3 409.939 4.377 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)Nc1ccc(N2CCCC2=O)c(Cl)c1 ZINC000043937995 848492714 /nfs/dbraw/zinc/49/27/14/848492714.db2.gz XQBCZMPQOIMDJG-UHFFFAOYSA-N 0 3 414.937 4.063 20 0 HIADHN CC(=O)Nc1ccc(F)c(NC(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)c1 ZINC000044078162 848511587 /nfs/dbraw/zinc/51/15/87/848511587.db2.gz LOYKBGXYUWGAGP-LJQANCHMSA-N 0 3 418.538 4.440 20 0 HIADHN CN(C)Cc1cccc(NC(=O)N2CCCN(Cc3ccc(Cl)cc3)CC2)c1 ZINC000044277283 848539597 /nfs/dbraw/zinc/53/95/97/848539597.db2.gz HIIXZSXVGVLQAQ-UHFFFAOYSA-N 0 3 400.954 4.141 20 0 HIADHN COc1c(Br)cc(CNCCOCCC(C)C)cc1Br ZINC000045094210 848633343 /nfs/dbraw/zinc/63/33/43/848633343.db2.gz JYULRXCVPCKABR-UHFFFAOYSA-N 0 3 409.162 4.373 20 0 HIADHN CCOC(=O)Nc1ccc(NC(=O)NC[C@H](c2cccs2)N2CCCC2)cc1 ZINC000047946170 849141717 /nfs/dbraw/zinc/14/17/17/849141717.db2.gz GWDQXYPRDBSXPV-QGZVFWFLSA-N 0 3 402.520 4.275 20 0 HIADHN CCC(=O)Nc1ccc(C)c(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2)c1 ZINC000048081821 849161137 /nfs/dbraw/zinc/16/11/37/849161137.db2.gz IIKTWRQMPFCLNO-UHFFFAOYSA-N 0 3 400.498 4.078 20 0 HIADHN CCNC(=O)c1ccc(NC(=O)NC[C@H](c2ccsc2)N(CC)CC)c(C)c1 ZINC000048116649 849169902 /nfs/dbraw/zinc/16/99/02/849169902.db2.gz HKIJGAIJWIFRAO-LJQANCHMSA-N 0 3 402.564 4.011 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)c(C)c1CNCc1ccc(Cn2cncn2)cc1 ZINC000048710240 849257829 /nfs/dbraw/zinc/25/78/29/849257829.db2.gz OETZWQVIWNNUJT-UHFFFAOYSA-N 0 3 406.921 4.072 20 0 HIADHN Cc1nn(Cc2ccccc2)c(Cl)c1CNC1CCN(Cc2ccccn2)CC1 ZINC000048716752 849259328 /nfs/dbraw/zinc/25/93/28/849259328.db2.gz WRHHKNQUULJZEU-UHFFFAOYSA-N 0 3 409.965 4.042 20 0 HIADHN CCCCCNC(=O)C(C#N)C(=O)Cc1c(C)nn(-c2ccc(C)c(Cl)c2)c1C ZINC000049252801 849299235 /nfs/dbraw/zinc/29/92/35/849299235.db2.gz SFUDGGPFFAQMBM-IBGZPJMESA-N 0 3 414.937 4.009 20 0 HIADHN COc1cc(OC)c([C@H](C)[NH2+]C2CCN(C(=O)c3ccccc3[O-])CC2)cc1Cl ZINC000436827575 862007155 /nfs/dbraw/zinc/00/71/55/862007155.db2.gz KQOFKWPHUZCJRI-AWEZNQCLSA-N 0 3 418.921 4.018 20 0 HIADHN Cc1cc(Cl)c2c(c1)[C@@H]([NH2+]C1CCN(C(=O)c3ccccc3[O-])CC1)CCCO2 ZINC000436825988 862008059 /nfs/dbraw/zinc/00/80/59/862008059.db2.gz GCSQHIHWADCHGZ-FQEVSTJZSA-N 0 3 414.933 4.462 20 0 HIADHN CC[C@@H]([NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1)c1ccccc1OC(F)F ZINC000436825603 862008205 /nfs/dbraw/zinc/00/82/05/862008205.db2.gz DTWDECDPADPDGC-GOSISDBHSA-N 0 3 404.457 4.339 20 0 HIADHN CC(=O)N[C@@H](C(=O)C(C#N)c1nc(-c2ccc(Cl)cc2)cs1)C1CCCC1 ZINC000051156269 849437783 /nfs/dbraw/zinc/43/77/83/849437783.db2.gz JNRWEYIRXLEHBH-FUHWJXTLSA-N 0 3 401.919 4.335 20 0 HIADHN O=C(CCN1CCC(C(=O)c2ccccc2)CC1)Nc1ccc(Br)cc1 ZINC000051379365 849464811 /nfs/dbraw/zinc/46/48/11/849464811.db2.gz FVRMSMMIKIAEOL-UHFFFAOYSA-N 0 3 415.331 4.373 20 0 HIADHN CCN(Cc1cc(=O)n2c3ccccc3[nH]c2c1C#N)[C@@H](C)c1cccc(OC)c1 ZINC000052706423 849615691 /nfs/dbraw/zinc/61/56/91/849615691.db2.gz JVCJPYQQJWTUBD-JXFKEZNVSA-N 0 3 400.482 4.315 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1ccc(-n2cc[nH]c2=S)cc1)c1ccsc1 ZINC000052877876 849637527 /nfs/dbraw/zinc/63/75/27/849637527.db2.gz AGNGHKNDYRCACD-SFHVURJKSA-N 0 3 400.573 4.409 20 0 HIADHN O[C@H](COc1ccc(F)cc1)CN1CCC(c2nc3cc(Cl)ccc3o2)CC1 ZINC000052993718 849652621 /nfs/dbraw/zinc/65/26/21/849652621.db2.gz XWCABZCMHRKJSP-KRWDZBQOSA-N 0 3 404.869 4.240 20 0 HIADHN O=C(CSc1ccc(C(F)(F)F)cn1)NC[C@H](c1ccccc1)N1CCCC1 ZINC000053372710 849701536 /nfs/dbraw/zinc/70/15/36/849701536.db2.gz CFRXLYDWSUKHET-QGZVFWFLSA-N 0 3 409.477 4.146 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)N1CCN(c2ccccc2Cl)CC1 ZINC000053540819 849728974 /nfs/dbraw/zinc/72/89/74/849728974.db2.gz GYVGGMBINBQCOZ-IBGZPJMESA-N 0 3 418.994 4.070 20 0 HIADHN CN(Cc1ccc(OC(F)F)cc1)C(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000053548279 849731056 /nfs/dbraw/zinc/73/10/56/849731056.db2.gz IWSVBEBKUUHHFZ-KRWDZBQOSA-N 0 3 409.502 4.328 20 0 HIADHN CC(C)(C)[C@H](NCC(=O)N1CCC(C(=O)Nc2ccccc2)CC1)c1ccccc1 ZINC000053617788 849737896 /nfs/dbraw/zinc/73/78/96/849737896.db2.gz ASLBKMWZEJPQFZ-HSZRJFAPSA-N 0 3 407.558 4.241 20 0 HIADHN O=C(Cc1ccc(F)c(Br)c1)NC[C@@H](c1cccs1)N1CCCC1 ZINC000054060908 849805252 /nfs/dbraw/zinc/80/52/52/849805252.db2.gz VRCLMAHIEYWBHC-INIZCTEOSA-N 0 3 411.340 4.146 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(C)c1C(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000054225439 849829147 /nfs/dbraw/zinc/82/91/47/849829147.db2.gz ZYTMIKAQSDUGGJ-UWJYYQICSA-N 0 3 406.505 4.194 20 0 HIADHN Cc1noc(C)c1COc1cccc(C(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)c1 ZINC000054227474 849830101 /nfs/dbraw/zinc/83/01/01/849830101.db2.gz UZKOLJDIACWKKO-PGRDOPGGSA-N 0 3 419.525 4.436 20 0 HIADHN NC(=O)CSc1ccccc1NC(=O)CN(Cc1ccccc1)C1CCCCC1 ZINC000054256115 849833532 /nfs/dbraw/zinc/83/35/32/849833532.db2.gz LGKKABGOWKYUDD-UHFFFAOYSA-N 0 3 411.571 4.037 20 0 HIADHN Cc1ccc(C(=O)C2CCN(C[C@H](O)CO[C@H]3CCCc4ccccc43)CC2)cc1 ZINC000054421808 849863922 /nfs/dbraw/zinc/86/39/22/849863922.db2.gz WCWFDNRFPVANAG-ZCYQVOJMSA-N 0 3 407.554 4.345 20 0 HIADHN CCOCCOCc1cccc(NC(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)c1 ZINC000054435450 849867357 /nfs/dbraw/zinc/86/73/57/849867357.db2.gz DNLWYZYHUUBDBO-WMZHIEFXSA-N 0 3 411.546 4.197 20 0 HIADHN CN1CCN(C(C)(C)CNCc2sc(Sc3ccccc3)nc2Cl)CC1 ZINC000054462627 849871518 /nfs/dbraw/zinc/87/15/18/849871518.db2.gz SBUPFMWANYJXDK-UHFFFAOYSA-N 0 3 411.040 4.063 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)N[C@@H]1CCCOc2ccc(F)cc21 ZINC000054784438 849922505 /nfs/dbraw/zinc/92/25/05/849922505.db2.gz COBBQONMORWART-MSOLQXFVSA-N 0 3 403.523 4.237 20 0 HIADHN COC(=O)c1cccc(CNC2(c3cccc(Br)c3)CCOCC2)c1 ZINC000055055624 849965365 /nfs/dbraw/zinc/96/53/65/849965365.db2.gz HRGAAEGBLFHHMO-UHFFFAOYSA-N 0 3 404.304 4.031 20 0 HIADHN C[C@@H](N[C@@H](CCc1ccccc1)c1ccccc1)C(=O)Nc1ccc(C(N)=O)cc1 ZINC000055152998 849978518 /nfs/dbraw/zinc/97/85/18/849978518.db2.gz GYTSNKYZESSZPT-JPYJTQIMSA-N 0 3 401.510 4.076 20 0 HIADHN C[C@H](OC[C@@H](O)CN1CCC(C(=O)c2ccccc2)CC1)c1ccc(Cl)cc1 ZINC000055471977 850032711 /nfs/dbraw/zinc/03/27/11/850032711.db2.gz RXNQIBAVVPHASO-JTSKRJEESA-N 0 3 401.934 4.373 20 0 HIADHN Cc1cccc([C@@H]2CCCN2CC(=O)N2CCC(C(=O)Nc3ccccc3)CC2)c1 ZINC000055910274 850204950 /nfs/dbraw/zinc/20/49/50/850204950.db2.gz YJHUFOCMNAXANE-QHCPKHFHSA-N 0 3 405.542 4.009 20 0 HIADHN COc1ccc(NC(=O)[C@H](C)N[C@H](C)c2ccc(OCc3cccnc3)cc2)cc1 ZINC000056144349 850253721 /nfs/dbraw/zinc/25/37/21/850253721.db2.gz WWKBVPSBORYLHE-MSOLQXFVSA-N 0 3 405.498 4.347 20 0 HIADHN O=C(Nc1ccc(F)cc1)[C@H](NC1CCN(Cc2ccccn2)CC1)c1ccccc1 ZINC000056182703 850274445 /nfs/dbraw/zinc/27/44/45/850274445.db2.gz DUPGPJXRGNHWKY-XMMPIXPASA-N 0 3 418.516 4.155 20 0 HIADHN Cc1ccc(NC(=O)[C@H](NC2CCN(Cc3ccccn3)CC2)c2ccccc2)cc1 ZINC000056182696 850274962 /nfs/dbraw/zinc/27/49/62/850274962.db2.gz KKNZAZZRENNZJB-RUZDIDTESA-N 0 3 414.553 4.324 20 0 HIADHN CC(=O)Nc1c(C)ccc(NC(=O)NCC(C)(C)N2CCc3ccccc3C2)c1C ZINC000056690621 850438953 /nfs/dbraw/zinc/43/89/53/850438953.db2.gz RLQFEQDOWLRUKD-UHFFFAOYSA-N 0 3 408.546 4.220 20 0 HIADHN Cc1ccc(C(=O)C2CCN(C(=O)NCCCN3CCc4ccccc4C3)CC2)cc1 ZINC000056865219 850505611 /nfs/dbraw/zinc/50/56/11/850505611.db2.gz AOYKJGHDBPVOFO-UHFFFAOYSA-N 0 3 419.569 4.048 20 0 HIADHN CC(C)CN(C(=O)c1cnn(-c2ccc(Cl)cc2Cl)c1)C1CCN(C)CC1 ZINC000056986494 850529800 /nfs/dbraw/zinc/52/98/00/850529800.db2.gz JBODXDUNBFKDMU-UHFFFAOYSA-N 0 3 409.361 4.372 20 0 HIADHN O=C(NCCCCN1CCN(Cc2ccccc2)CC1)c1c[nH]cc1-c1ccccc1 ZINC000056995926 850531353 /nfs/dbraw/zinc/53/13/53/850531353.db2.gz NSEPNMQYIWBHFJ-UHFFFAOYSA-N 0 3 416.569 4.010 20 0 HIADHN C[C@H]1C[C@@H]1c1ccc(CCC(=O)NCCCCN2CCN(c3ccccc3)CC2)o1 ZINC000057113242 850548911 /nfs/dbraw/zinc/54/89/11/850548911.db2.gz GGKBICXFDLCQKE-REWPJTCUSA-N 0 3 409.574 4.054 20 0 HIADHN c1csc(CCN2CCN(c3nc(-c4ccncc4)nc4ccccc43)CC2)c1 ZINC000057141388 850560418 /nfs/dbraw/zinc/56/04/18/850560418.db2.gz OJBHVGINPDVMKB-UHFFFAOYSA-N 0 3 401.539 4.118 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N[C@@H](c1ccc(F)cc1)[C@@H]1CCCO1 ZINC000057197665 850577393 /nfs/dbraw/zinc/57/73/93/850577393.db2.gz KVNGTLKPYGYVPA-DYXWJJEUSA-N 0 3 417.550 4.244 20 0 HIADHN CN(C)CCSc1nnc(-c2ccc(Br)o2)n1Cc1ccccc1 ZINC000057502290 850653237 /nfs/dbraw/zinc/65/32/37/850653237.db2.gz HWJBHFKPBQVVIV-UHFFFAOYSA-N 0 3 407.337 4.003 20 0 HIADHN Cc1ccc(NC(=O)C2CC2)cc1NC(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000057543443 850664863 /nfs/dbraw/zinc/66/48/63/850664863.db2.gz SJIVQVRYNZHTBA-IBGZPJMESA-N 0 3 412.559 4.364 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)N[C@@H](c3ccccc3)C3CC3)CC2)c1 ZINC000057590774 850676059 /nfs/dbraw/zinc/67/60/59/850676059.db2.gz WCSYLXMSZKIXOZ-VWLOTQADSA-N 0 3 420.601 4.348 20 0 HIADHN Cc1oc(NC(=O)CN[C@@H](c2ccc(C(C)(C)C)cc2)C(C)C)c2c1c(C)n[nH]c2=O ZINC000057627012 850684545 /nfs/dbraw/zinc/68/45/45/850684545.db2.gz SFJCQDUXIWDZEJ-OAQYLSRUSA-N 0 3 424.545 4.356 20 0 HIADHN Cc1cc(Br)cc(C)c1NC(=O)NC[C@H](Cc1ccccc1)N(C)C ZINC000057773461 850713085 /nfs/dbraw/zinc/71/30/85/850713085.db2.gz XIMKSZXSYHIBSO-SFHVURJKSA-N 0 3 404.352 4.360 20 0 HIADHN CN(C)[C@@H](CNC(=O)Nc1cccc(NC(=O)c2ccccc2)c1)c1ccccc1 ZINC000057779442 850713487 /nfs/dbraw/zinc/71/34/87/850713487.db2.gz NHFXKNNGAKGRNR-QFIPXVFZSA-N 0 3 402.498 4.363 20 0 HIADHN Cc1cc(NC(=O)NC[C@@H](c2ccccc2)N(C)C)ccc1NC(=O)c1ccco1 ZINC000057791367 850717998 /nfs/dbraw/zinc/71/79/98/850717998.db2.gz KRSWVRRJLAVXKS-FQEVSTJZSA-N 0 3 406.486 4.265 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)c1ccccc1OCc1cscn1 ZINC000057922426 850742786 /nfs/dbraw/zinc/74/27/86/850742786.db2.gz FDBGELRBBHIGFL-NRFANRHFSA-N 0 3 407.539 4.289 20 0 HIADHN CN(C)c1ccc(NC(=O)NCCCN2CCc3ccccc3C2)c(C(F)(F)F)c1 ZINC000058133914 850772127 /nfs/dbraw/zinc/77/21/27/850772127.db2.gz OALKEHCLDPQYHR-UHFFFAOYSA-N 0 3 420.479 4.341 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)C[C@H](NC(C)=O)c1ccc(Cl)cc1)c1ccsc1 ZINC000058954499 850968476 /nfs/dbraw/zinc/96/84/76/850968476.db2.gz UOQIKABTQMYVCY-PMACEKPBSA-N 0 3 421.994 4.168 20 0 HIADHN O=C(CCc1ccccc1Br)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000059403444 851004203 /nfs/dbraw/zinc/00/42/03/851004203.db2.gz UVOSYPRWZVCTRW-IBGZPJMESA-N 0 3 401.348 4.163 20 0 HIADHN CCOc1c(Br)cc(Br)cc1CNCCc1nccs1 ZINC000060230347 851052785 /nfs/dbraw/zinc/05/27/85/851052785.db2.gz SEURHBQYYFTWEH-UHFFFAOYSA-N 0 3 420.170 4.399 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)[C@H]1C[C@@H]1c1ccc(Br)cc1 ZINC000060300816 851060223 /nfs/dbraw/zinc/06/02/23/851060223.db2.gz UHOWWPCGVXRHMM-MSOLQXFVSA-N 0 3 423.420 4.030 20 0 HIADHN CC(C)CN(CCN(C)C)C(=O)c1cc(C2CC2)nc2onc(CC(C)(C)C)c21 ZINC000060516495 851130407 /nfs/dbraw/zinc/13/04/07/851130407.db2.gz GOLOARNVXIXLOO-UHFFFAOYSA-N 0 3 400.567 4.349 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)N[C@H]2CCCc3cc(OC(F)F)ccc32)o1 ZINC000060603182 851164153 /nfs/dbraw/zinc/16/41/53/851164153.db2.gz HGISPQDXNVSPKE-FQEVSTJZSA-N 0 3 421.488 4.340 20 0 HIADHN Cc1ccc([C@H](OC[C@H](O)CN(C)Cc2ccc3c(c2)OCO3)c2ccccc2)cc1 ZINC000060845935 851229649 /nfs/dbraw/zinc/22/96/49/851229649.db2.gz ZFVGOXGCGIWZGH-ZEQKJWHPSA-N 0 3 419.521 4.323 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@H](C)NCc2cccc(OC(F)F)c2)cc1 ZINC000060927181 851250896 /nfs/dbraw/zinc/25/08/96/851250896.db2.gz PRAZKSRPFUQMMX-HNNXBMFYSA-N 0 3 412.502 4.169 20 0 HIADHN Cn1cc(CNCc2cn(-c3ccccc3)nc2-c2ccncc2)c(-c2ccncc2)n1 ZINC000060970949 851263421 /nfs/dbraw/zinc/26/34/21/851263421.db2.gz JZBMSHLWKDNWAM-UHFFFAOYSA-N 0 3 421.508 4.020 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NC[C@H](c1ccco1)N1CCCCC1)c1ccsc1 ZINC000061070475 851288837 /nfs/dbraw/zinc/28/88/37/851288837.db2.gz ZPTKBAWYNHPTIT-WOJBJXKFSA-N 0 3 418.607 4.250 20 0 HIADHN CC(C)Oc1ccc([C@@H](C)NC(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)cc1 ZINC000061139251 851303312 /nfs/dbraw/zinc/30/33/12/851303312.db2.gz YDKZBUGMQKYANZ-HXUWFJFHSA-N 0 3 409.574 4.495 20 0 HIADHN COc1ccc(OC)c(CNC(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)c1 ZINC000061191325 851313285 /nfs/dbraw/zinc/31/32/85/851313285.db2.gz DCSXCQRHCQBEMI-IBGZPJMESA-N 0 3 417.575 4.038 20 0 HIADHN CCOc1cccc2cc([C@H](C)NC(=O)NC[C@@H](Cc3ccccc3)N(C)C)oc21 ZINC000061194942 851315207 /nfs/dbraw/zinc/31/52/07/851315207.db2.gz HSNNNWRERGQDHS-FXAWDEMLSA-N 0 3 409.530 4.365 20 0 HIADHN C[C@H](NC(=O)NC[C@H](c1ccccc1)N1CCCC1)c1cccc(OC(F)F)c1 ZINC000061230320 851324054 /nfs/dbraw/zinc/32/40/54/851324054.db2.gz KNMFRLJOXNPYBM-OXJNMPFZSA-N 0 3 403.473 4.485 20 0 HIADHN O=C(CCCOc1cccc(F)c1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000061287400 851338441 /nfs/dbraw/zinc/33/84/41/851338441.db2.gz CMOPNGFTCUEADA-UHFFFAOYSA-N 0 3 402.535 4.215 20 0 HIADHN COc1cc(C(=O)Nc2ccc(CCN3CCSCC3)cc2)ccc1OC(F)F ZINC000061289330 851339182 /nfs/dbraw/zinc/33/91/82/851339182.db2.gz QKDJNQIBMLVYAZ-UHFFFAOYSA-N 0 3 422.497 4.140 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Cc2ccc(F)c(Br)c2)N2CCCC2)cc1 ZINC000061502548 851390396 /nfs/dbraw/zinc/39/03/96/851390396.db2.gz WWFJHZIMJLBZBS-FQEVSTJZSA-N 0 3 419.338 4.392 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2ccc(N3CCCC3=O)cc2)N2CCCC2)cc1 ZINC000061747619 851438035 /nfs/dbraw/zinc/43/80/35/851438035.db2.gz FFINMOSXNFNKND-QFIPXVFZSA-N 0 3 406.530 4.080 20 0 HIADHN CCN(CC)C(=O)c1ccccc1NC(=O)NC[C@@H](c1ccc(C)cc1)N1CCCC1 ZINC000061776778 851447849 /nfs/dbraw/zinc/44/78/49/851447849.db2.gz PAYWXAJDOHIAQW-QHCPKHFHSA-N 0 3 422.573 4.436 20 0 HIADHN O=C(NCCCOc1ccccc1F)Nc1ccc(CCN2CCSCC2)cc1 ZINC000061792108 851453880 /nfs/dbraw/zinc/45/38/80/851453880.db2.gz QGWIDGBNPFJRMX-UHFFFAOYSA-N 0 3 417.550 4.008 20 0 HIADHN Cc1cccc(C)c1OCCNC(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000061791570 851453981 /nfs/dbraw/zinc/45/39/81/851453981.db2.gz FNCLFNWNDYLRCC-UHFFFAOYSA-N 0 3 413.587 4.095 20 0 HIADHN COc1ccc(F)cc1[C@H](C)NC(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000061791989 851454279 /nfs/dbraw/zinc/45/42/79/851454279.db2.gz NVVDMGTXALCCRF-INIZCTEOSA-N 0 3 417.550 4.308 20 0 HIADHN O=C(NCCSc1ccccc1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000061793129 851455662 /nfs/dbraw/zinc/45/56/62/851455662.db2.gz IIMKNEGNLRWWTJ-UHFFFAOYSA-N 0 3 401.601 4.192 20 0 HIADHN Cc1ccc(Oc2ccc(NC(=O)C(=O)NCC(C)(C)N3CCCCC3)cc2)cc1 ZINC000061866069 851462943 /nfs/dbraw/zinc/46/29/43/851462943.db2.gz SDLAOCODPXRACR-UHFFFAOYSA-N 0 3 409.530 4.107 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)Nc1cccc(Br)c1 ZINC000062368235 851530272 /nfs/dbraw/zinc/53/02/72/851530272.db2.gz CVMSFWXPAPAVIV-UHFFFAOYSA-N 0 3 412.278 4.323 20 0 HIADHN COc1cc(NC(=O)N(CCN(C)C)Cc2cccc(F)c2)c(OC)cc1Cl ZINC000062376640 851533890 /nfs/dbraw/zinc/53/38/90/851533890.db2.gz GMSVQUCHKGDECP-UHFFFAOYSA-N 0 3 409.889 4.092 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)Nc1ccc(NC(=O)c2ccco2)cc1 ZINC000062383334 851537382 /nfs/dbraw/zinc/53/73/82/851537382.db2.gz FUBDNVJPPFGWBW-UHFFFAOYSA-N 0 3 424.476 4.267 20 0 HIADHN CCOC(=O)N(C)c1ccc(NC(=O)N(CCN(C)C)Cc2cccc(F)c2)cc1 ZINC000062407180 851544044 /nfs/dbraw/zinc/54/40/44/851544044.db2.gz PRMRYYFIKPFIFK-UHFFFAOYSA-N 0 3 416.497 4.014 20 0 HIADHN Cc1ccc(SCCNC(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)cc1 ZINC000062475678 851559014 /nfs/dbraw/zinc/55/90/14/851559014.db2.gz NZEDEWVPSFMOQX-UHFFFAOYSA-N 0 3 407.530 4.139 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)NCc1ccccc1OC1CCCC1 ZINC000062488869 851563736 /nfs/dbraw/zinc/56/37/36/851563736.db2.gz GYRFSVKYCMOQQW-UHFFFAOYSA-N 0 3 413.537 4.421 20 0 HIADHN COc1ccc(F)cc1[C@@H](C)NC(=O)N(CCN(C)C)Cc1cccc(Cl)c1 ZINC000062487378 851563966 /nfs/dbraw/zinc/56/39/66/851563966.db2.gz PMPASIBQQXKOHV-OAHLLOKOSA-N 0 3 407.917 4.322 20 0 HIADHN CC(C)OCc1ccccc1CNC(=O)N(CCN(C)C)Cc1cccc(F)c1 ZINC000062487003 851564139 /nfs/dbraw/zinc/56/41/39/851564139.db2.gz VXGIDBYAZXBNIA-UHFFFAOYSA-N 0 3 401.526 4.024 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)NC[C@@H]1CCCc2ccccc21 ZINC000062486989 851564191 /nfs/dbraw/zinc/56/41/91/851564191.db2.gz HZAQPLCDBIKPPF-IBGZPJMESA-N 0 3 401.501 4.158 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)CCc2ccc(Br)cc2F)C1 ZINC000062882523 851597238 /nfs/dbraw/zinc/59/72/38/851597238.db2.gz FWYOFPXTBHSQIF-BEFAXECRSA-N 0 3 419.338 4.473 20 0 HIADHN CCOc1ccc(OCC)c(NC(=S)NC2CCN(Cc3ccccc3)CC2)c1 ZINC000063146102 851621520 /nfs/dbraw/zinc/62/15/20/851621520.db2.gz HQHIHNORAUGCMU-UHFFFAOYSA-N 0 3 413.587 4.435 20 0 HIADHN Fc1cc(NC(=S)NC2CCN(Cc3ccccc3)CC2)ccc1N1CCCC1 ZINC000063150012 851623114 /nfs/dbraw/zinc/62/31/14/851623114.db2.gz NEFJPKDMOHQIDR-UHFFFAOYSA-N 0 3 412.578 4.377 20 0 HIADHN O[C@@H](CNCc1ccccc1OC(F)(F)F)COc1cccc(C(F)(F)F)c1 ZINC000063548159 851711848 /nfs/dbraw/zinc/71/18/48/851711848.db2.gz GRMBGOHZIXOQSW-AWEZNQCLSA-N 0 3 409.326 4.134 20 0 HIADHN Cc1ccc([C@@H]2CCCN2CC(=O)N2CCC(C(=O)Nc3ccccc3)CC2)cc1C ZINC000063619606 851725989 /nfs/dbraw/zinc/72/59/89/851725989.db2.gz NUMSTNXWPCXBQE-DEOSSOPVSA-N 0 3 419.569 4.318 20 0 HIADHN C[C@H](CC(=O)Nc1ccc(Br)cc1)N[C@@H]1CCOc2c(F)cccc21 ZINC000437081025 862277293 /nfs/dbraw/zinc/27/72/93/862277293.db2.gz WHOAYEOAASMZGF-SJKOYZFVSA-N 0 3 407.283 4.419 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCC(C)(C)c3ccc(OC)cc3)c(C)c2)CC1 ZINC000063785006 851761665 /nfs/dbraw/zinc/76/16/65/851761665.db2.gz NEKRRKBKUMZYOG-UHFFFAOYSA-N 0 3 424.589 4.245 20 0 HIADHN C[C@H](NC(=O)c1cccc(CN2CCCC2)c1)c1ccc(NC(=O)NC2CC2)cc1 ZINC000063916086 851793501 /nfs/dbraw/zinc/79/35/01/851793501.db2.gz PPJBXNZBDXELCZ-KRWDZBQOSA-N 0 3 406.530 4.057 20 0 HIADHN CC(C)(C)C(=O)N1CCOc2ccc(NC(=O)c3cccc(CN4CCCC4)c3)cc21 ZINC000064026983 851817529 /nfs/dbraw/zinc/81/75/29/851817529.db2.gz CYUBPTBUORXUAB-UHFFFAOYSA-N 0 3 421.541 4.306 20 0 HIADHN Cc1noc(CSc2ccccc2C(=O)N2CCN(CC3CCCCC3)CC2)n1 ZINC000064126160 851832077 /nfs/dbraw/zinc/83/20/77/851832077.db2.gz SLRUWEVWXXUQEM-UHFFFAOYSA-N 0 3 414.575 4.008 20 0 HIADHN Cc1nc2ccccc2n1CCCNC(=O)NC[C@H](c1ccc(C)cc1)N1CCCC1 ZINC000064237561 851855311 /nfs/dbraw/zinc/85/53/11/851855311.db2.gz MZCKFQFHPBSAPR-XMMPIXPASA-N 0 3 419.573 4.180 20 0 HIADHN CN(C)[C@@H](CNC(=O)NCc1ccc(-n2cnc3ccccc32)cc1)c1ccccc1 ZINC000064252340 851857768 /nfs/dbraw/zinc/85/77/68/851857768.db2.gz HJMOUPNKKLRESK-DEOSSOPVSA-N 0 3 413.525 4.128 20 0 HIADHN O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)[C@H]1C[C@H]1c1cccc(Br)c1 ZINC000064488308 851911552 /nfs/dbraw/zinc/91/15/52/851911552.db2.gz CZQJOQMJBYCBCA-HKBOAZHASA-N 0 3 413.359 4.333 20 0 HIADHN CN(C)[C@@H](CNC(=O)CCSc1ccc(Br)cc1)c1ccccc1 ZINC000064680796 851953508 /nfs/dbraw/zinc/95/35/08/851953508.db2.gz UUILYQQKPPRLGW-SFHVURJKSA-N 0 3 407.377 4.350 20 0 HIADHN CCc1ccc([C@H](CNC(=O)c2cc3sc(N(C)C)nc3s2)N(C)C)cc1 ZINC000064750311 851975186 /nfs/dbraw/zinc/97/51/86/851975186.db2.gz RFBMIBSEBXQGNG-HNNXBMFYSA-N 0 3 402.589 4.019 20 0 HIADHN CN(CCNC(=O)c1ccc2c(c1)C[C@@H](c1ccccc1)OC2=O)Cc1ccccc1 ZINC000064804786 851986708 /nfs/dbraw/zinc/98/67/08/851986708.db2.gz MNELTBBLDYPIRV-DEOSSOPVSA-N 0 3 414.505 4.003 20 0 HIADHN O=C(NC1CC1)c1ccc(CNCc2ccc(-n3ccc(C(F)(F)F)n3)cc2)cc1 ZINC000065014551 852040141 /nfs/dbraw/zinc/04/01/41/852040141.db2.gz QWVKMWPJGLBHSG-UHFFFAOYSA-N 0 3 414.431 4.073 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)C2(c3cccc(Br)c3)CC2)C1 ZINC000065140469 852076224 /nfs/dbraw/zinc/07/62/24/852076224.db2.gz PRFXPSYMHVQRBZ-UZLBHIALSA-N 0 3 413.359 4.432 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)CSc2ccc(Br)cc2)C1 ZINC000065140955 852076329 /nfs/dbraw/zinc/07/63/29/852076329.db2.gz FOVYLTDKJHNRAU-QAPCUYQASA-N 0 3 419.388 4.493 20 0 HIADHN O=C(CCN(Cc1cccc(F)c1)C[C@@H]1CCCO1)NCc1ccccc1Cl ZINC000065353132 852111962 /nfs/dbraw/zinc/11/19/62/852111962.db2.gz WBEVJOBMGXPQNU-FQEVSTJZSA-N 0 3 404.913 4.167 20 0 HIADHN Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)N1CCN(CC2CCCCC2)CC1 ZINC000065375738 852116934 /nfs/dbraw/zinc/11/69/34/852116934.db2.gz DBDZGFDIAAZFBF-UHFFFAOYSA-N 0 3 414.594 4.111 20 0 HIADHN Cc1cc(C)n(-c2ccc(NC(=O)NC[C@H](c3ccc(C)cc3)N(C)C)cc2F)n1 ZINC000065413634 852123893 /nfs/dbraw/zinc/12/38/93/852123893.db2.gz WAYNCIJAKMXPKX-JOCHJYFZSA-N 0 3 409.509 4.361 20 0 HIADHN Cc1noc([C@@H]2CCCN(C[C@@H](O)CO[C@H](c3ccccc3)c3ccc(C)cc3)C2)n1 ZINC000065433457 852130372 /nfs/dbraw/zinc/13/03/72/852130372.db2.gz JEZWJMUWYXNIGM-WXFUMESZSA-N 0 3 421.541 4.033 20 0 HIADHN COCCCOc1ccccc1NC(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000065453692 852139573 /nfs/dbraw/zinc/13/95/73/852139573.db2.gz USFFLGCEYKHUHE-SFHVURJKSA-N 0 3 403.548 4.122 20 0 HIADHN CN(C)[C@@H](CNC(=O)Nc1ccc(-n2nccc2C(F)(F)F)cc1)c1ccccc1 ZINC000065471314 852146594 /nfs/dbraw/zinc/14/65/94/852146594.db2.gz IKAYZYMOUCWMJP-SFHVURJKSA-N 0 3 417.435 4.316 20 0 HIADHN CCOC(=O)N(C)c1ccc(NC(=O)NC[C@H](CC)N2CCc3ccccc3C2)cc1 ZINC000065472202 852147707 /nfs/dbraw/zinc/14/77/07/852147707.db2.gz YPKBNRMVMIQMKC-NRFANRHFSA-N 0 3 424.545 4.238 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)NCc2ccnc(OC3CCCC3)c2)C1 ZINC000065522969 852168175 /nfs/dbraw/zinc/16/81/75/852168175.db2.gz ZFMXPJQDNOGMIU-RXVVDRJESA-N 0 3 408.546 4.038 20 0 HIADHN COc1cc(Cl)c(C)cc1NC(=O)c1ccc(N2CCN(C(C)C)CC2)cc1 ZINC000065736763 852240273 /nfs/dbraw/zinc/24/02/73/852240273.db2.gz MSBNDCMTHUBDJW-UHFFFAOYSA-N 0 3 401.938 4.440 20 0 HIADHN CN(C)CCN(C(=O)CSCc1coc(-c2ccccc2)n1)C1CCCCC1 ZINC000065746457 852243325 /nfs/dbraw/zinc/24/33/25/852243325.db2.gz ZRERSUJSKXEFJG-UHFFFAOYSA-N 0 3 401.576 4.298 20 0 HIADHN COc1cccc(C(=O)NC[C@@H](c2ccccc2)N2CCC(C)CC2)c1OC(F)F ZINC000065802356 852261415 /nfs/dbraw/zinc/26/14/15/852261415.db2.gz YVFFGPMMSVIFAF-IBGZPJMESA-N 0 3 418.484 4.500 20 0 HIADHN Cc1ccc(NC(=O)C2CC2)cc1NC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000065867733 852291189 /nfs/dbraw/zinc/29/11/89/852291189.db2.gz QXRNARSXALTEHG-LJQANCHMSA-N 0 3 409.505 4.333 20 0 HIADHN Cc1ccc(-n2nc(C(=O)N(CCN(C)C)Cc3ccccc3F)c3c2CCC3)cc1 ZINC000065893676 852307764 /nfs/dbraw/zinc/30/77/64/852307764.db2.gz RCIMQERGXXMFHG-UHFFFAOYSA-N 0 3 420.532 4.013 20 0 HIADHN Cc1cc(C(=O)N(CCN(C)C)Cc2cccc(C#N)c2)c(C)n1Cc1ccccc1 ZINC000065930918 852322207 /nfs/dbraw/zinc/32/22/07/852322207.db2.gz PCJNXBSLHSWCBL-UHFFFAOYSA-N 0 3 414.553 4.229 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)c1cnc(-c2ccccc2F)s1 ZINC000065931441 852322654 /nfs/dbraw/zinc/32/26/54/852322654.db2.gz FZOLHTIXIOETMQ-UHFFFAOYSA-N 0 3 401.482 4.292 20 0 HIADHN COc1cc(CNCc2ccccc2N2CCOCC2)c(-c2ccccc2)cc1OC ZINC000065934745 852323625 /nfs/dbraw/zinc/32/36/25/852323625.db2.gz OGERNRHWPHJANS-UHFFFAOYSA-N 0 3 418.537 4.497 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)c1csc(Br)c1 ZINC000065936793 852324675 /nfs/dbraw/zinc/32/46/75/852324675.db2.gz UGHHZVLUVNSOQD-UHFFFAOYSA-N 0 3 401.757 4.368 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)c1csc(-c2ccccc2)n1 ZINC000065937902 852325934 /nfs/dbraw/zinc/32/59/34/852325934.db2.gz SEVQBWNLFBFQMN-UHFFFAOYSA-N 0 3 401.482 4.292 20 0 HIADHN Cc1oc(-c2cccs2)nc1CC(=O)N(CCN(C)C)Cc1ccc(F)cc1F ZINC000065937762 852326396 /nfs/dbraw/zinc/32/63/96/852326396.db2.gz URZBJESWTOQMFK-UHFFFAOYSA-N 0 3 419.497 4.123 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)Cc1cn(C)c2ccccc12 ZINC000065938855 852328550 /nfs/dbraw/zinc/32/85/50/852328550.db2.gz CWYQJRFGMRXVNE-UHFFFAOYSA-N 0 3 417.475 4.330 20 0 HIADHN O=c1ccccn1Cc1ccc(CNCc2ccc(OCC(F)(F)F)cc2)cc1 ZINC000065981404 852339943 /nfs/dbraw/zinc/33/99/43/852339943.db2.gz JACAFEMUNVVHTB-UHFFFAOYSA-N 0 3 402.416 4.128 20 0 HIADHN CN(C)[C@@H](CNC(=O)c1cc(-c2cccnc2)nc2ccccc21)Cc1ccccc1 ZINC000069231034 852389092 /nfs/dbraw/zinc/38/90/92/852389092.db2.gz MYAGWFNSVCMBAJ-OAQYLSRUSA-N 0 3 410.521 4.200 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cnn(-c2ccc(Cl)cc2)c1)c1ccsc1 ZINC000071956474 852444740 /nfs/dbraw/zinc/44/47/40/852444740.db2.gz XAVRCPJBYBQDEI-LJQANCHMSA-N 0 3 402.951 4.400 20 0 HIADHN COc1cccc(CN2CCC(NC(=O)Cc3ccc(Cl)c(Cl)c3)CC2)c1 ZINC000072005155 852460068 /nfs/dbraw/zinc/46/00/68/852460068.db2.gz YKWGMIGJUSUYOJ-UHFFFAOYSA-N 0 3 407.341 4.325 20 0 HIADHN CC1CCN([C@@H](CNC(=O)c2ccc(N3CCCC3=O)cc2)c2ccccc2)CC1 ZINC000072006447 852461110 /nfs/dbraw/zinc/46/11/10/852461110.db2.gz DRSHRIBVJPTQFM-QHCPKHFHSA-N 0 3 405.542 4.016 20 0 HIADHN CCc1c(C(=O)NC[C@@H](c2ccccc2)N2CCC(C)CC2)cnn1-c1ccccn1 ZINC000072007055 852462232 /nfs/dbraw/zinc/46/22/32/852462232.db2.gz OPSAUQBNZIBARS-QHCPKHFHSA-N 0 3 417.557 4.033 20 0 HIADHN COc1ccc([C@H](CNC(=O)[C@H]2CCCN2Cc2ccccc2)N2CCCCC2)cc1 ZINC000072015395 852467130 /nfs/dbraw/zinc/46/71/30/852467130.db2.gz IZOSNSQLILUUIK-RPBOFIJWSA-N 0 3 421.585 4.003 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@H](C)NCc2cc(C)c(OC)c(C)c2)cc1 ZINC000072032357 852474652 /nfs/dbraw/zinc/47/46/52/852474652.db2.gz PQKCMBXZOBBNDJ-SFHVURJKSA-N 0 3 404.576 4.193 20 0 HIADHN O[C@H](COc1cccc2[nH]ccc21)CN1CC=C(c2c[nH]c3cc(F)ccc32)CC1 ZINC000077915039 852512979 /nfs/dbraw/zinc/51/29/79/852512979.db2.gz STZOWYDLFCGJMH-SFHVURJKSA-N 0 3 405.473 4.317 20 0 HIADHN CC[C@H](CC(=O)N1CCC[C@@H](CN2CCN(c3ccccn3)CC2)C1)c1ccccc1 ZINC000078414357 852514201 /nfs/dbraw/zinc/51/42/01/852514201.db2.gz DVAMODVHRXQQJZ-XZOQPEGZSA-N 0 3 420.601 4.026 20 0 HIADHN Cc1cc(C(=O)NC2CCN(Cc3ccccc3)CC2)nn1-c1cccc(Cl)c1 ZINC000096605275 852552720 /nfs/dbraw/zinc/55/27/20/852552720.db2.gz DXYYYCKICZJFCJ-UHFFFAOYSA-N 0 3 408.933 4.229 20 0 HIADHN CCCOc1c(Cl)cc(CNCc2ccc(Cn3cncn3)cc2)cc1OC ZINC000097287571 852597702 /nfs/dbraw/zinc/59/77/02/852597702.db2.gz RTFNRQCHAIFPMZ-UHFFFAOYSA-N 0 3 400.910 4.067 20 0 HIADHN Cc1sc(NC(=O)CN2CCN(C3CCCC3)CC2)nc1-c1ccc(Cl)cc1 ZINC000097477890 852617271 /nfs/dbraw/zinc/61/72/71/852617271.db2.gz UDFSSTAEIYUEJK-UHFFFAOYSA-N 0 3 418.994 4.271 20 0 HIADHN Cc1ccc(SCC(=O)NC2CCN(CCOc3ccc(Cl)cc3)CC2)cc1 ZINC000097577245 852637369 /nfs/dbraw/zinc/63/73/69/852637369.db2.gz ZNPXUTSNBOYLEN-UHFFFAOYSA-N 0 3 418.990 4.400 20 0 HIADHN CN1CCN(CCCNC(=O)c2cc(F)c(Cl)cc2Cl)[C@H](c2ccccc2)C1 ZINC000106025505 852747370 /nfs/dbraw/zinc/74/73/70/852747370.db2.gz DQIFQFHNMCHOHT-FQEVSTJZSA-N 0 3 424.347 4.241 20 0 HIADHN Cc1ccccc1CN1CCCN(C(=O)Cc2c(C)nc3ccccc3c2C)CC1 ZINC000106155244 852758811 /nfs/dbraw/zinc/75/88/11/852758811.db2.gz KGYMBADJZPYMRW-UHFFFAOYSA-N 0 3 401.554 4.437 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)c2cc(Cl)ccc2Cl)CC1 ZINC000106189466 852760952 /nfs/dbraw/zinc/76/09/52/852760952.db2.gz GCACUULXFBIGFH-UHFFFAOYSA-N 0 3 406.357 4.061 20 0 HIADHN CC(C)[C@H]1CN(C(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)CCS1 ZINC000437202343 862391992 /nfs/dbraw/zinc/39/19/92/862391992.db2.gz LLVYMEXRNLHCMC-MJGOQNOKSA-N 0 3 400.510 4.041 20 0 HIADHN CC[C@@H](C)c1ccccc1OCC(=O)NCc1ccc(CN2CCN(CC)CC2)cc1 ZINC000107651942 852784108 /nfs/dbraw/zinc/78/41/08/852784108.db2.gz ZEECVLYTAPEAAG-OAQYLSRUSA-N 0 3 423.601 4.033 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1ccc(Cl)c(C(=O)OC)c1)c1ccsc1 ZINC000107705162 852788154 /nfs/dbraw/zinc/78/81/54/852788154.db2.gz AMCBURSFVHDGSZ-KRWDZBQOSA-N 0 3 409.939 4.393 20 0 HIADHN O=C(NCC1(c2ccc3c(c2)OCCO3)CCCC1)c1cccc(CN2CCCC2)c1 ZINC000108706351 852874081 /nfs/dbraw/zinc/87/40/81/852874081.db2.gz KAALYLXZXJMFIZ-UHFFFAOYSA-N 0 3 420.553 4.295 20 0 HIADHN CC(C)Sc1ccccc1C(=O)NCCCN1CCN(Cc2ccccc2)CC1 ZINC000108778146 852879538 /nfs/dbraw/zinc/87/95/38/852879538.db2.gz GCKPEOOGIGCSKR-UHFFFAOYSA-N 0 3 411.615 4.125 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CNC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000109339420 852955400 /nfs/dbraw/zinc/95/54/00/852955400.db2.gz WCZHFKQCDBNQJY-OAQYLSRUSA-N 0 3 420.532 4.157 20 0 HIADHN O=C(NCc1ccc(OC2CCCC2)nc1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000109347141 852956785 /nfs/dbraw/zinc/95/67/85/852956785.db2.gz XABFVEJMMGBTMI-HXUWFJFHSA-N 0 3 411.521 4.071 20 0 HIADHN CC(C)c1cccc(C(C)C)c1NC(=O)CN1CCC(CCN2CCOCC2)CC1 ZINC000109546753 852982031 /nfs/dbraw/zinc/98/20/31/852982031.db2.gz WIMWVFZIKBRWME-UHFFFAOYSA-N 0 3 415.622 4.306 20 0 HIADHN C[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)N(C)C1CCN(CCc2ccccn2)CC1 ZINC000109795582 853015963 /nfs/dbraw/zinc/01/59/63/853015963.db2.gz RFYOAIPLIUBZBH-HXUWFJFHSA-N 0 3 423.601 4.312 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N3CCC[C@@H]3Cc3cccc(F)c3)cc2)CC1 ZINC000109898264 853031136 /nfs/dbraw/zinc/03/11/36/853031136.db2.gz OGUHJHSWECLDSY-XMMPIXPASA-N 0 3 409.549 4.203 20 0 HIADHN Cc1c(C(=O)Nc2ccccc2CN2CCC[C@H](C(N)=O)C2)oc2c1c(C)ccc2C ZINC000109940399 853037760 /nfs/dbraw/zinc/03/77/60/853037760.db2.gz RFLWFQGGKDDCCA-IBGZPJMESA-N 0 3 419.525 4.308 20 0 HIADHN O=C(Nc1ccc(C(=O)Nc2ccccc2)cc1)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000110070399 853056491 /nfs/dbraw/zinc/05/64/91/853056491.db2.gz MUMUUNGVFMKZCA-HSZRJFAPSA-N 0 3 414.509 4.335 20 0 HIADHN Cc1cc(N(C)C)ccc1NC(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000110119856 853061428 /nfs/dbraw/zinc/06/14/28/853061428.db2.gz HVVATHVMJWKSRX-OAQYLSRUSA-N 0 3 405.464 4.454 20 0 HIADHN CC(C)(C)c1ncc(NC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)cn1 ZINC000110119545 853061932 /nfs/dbraw/zinc/06/19/32/853061932.db2.gz OBFSQLQXDRBTKF-HXUWFJFHSA-N 0 3 406.452 4.167 20 0 HIADHN O=C(c1cc(F)ccc1Br)N1CCCN(CCCc2ccccc2)CC1 ZINC000110197441 853071144 /nfs/dbraw/zinc/07/11/44/853071144.db2.gz DJLWQQFQRHKJFI-UHFFFAOYSA-N 0 3 419.338 4.369 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)CCc3ccc(Cl)cc3Cl)CC2)C[C@@H](C)O1 ZINC000110453830 853101088 /nfs/dbraw/zinc/10/10/88/853101088.db2.gz JSJOQSRKJXAHOB-HZPDHXFCSA-N 0 3 413.389 4.274 20 0 HIADHN C[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000110460061 853103379 /nfs/dbraw/zinc/10/33/79/853103379.db2.gz AAJVVEUABAIFGX-HSALFYBXSA-N 0 3 416.606 4.099 20 0 HIADHN Cc1noc([C@@H]2CCCN(CCC(=O)Nc3ccccc3Oc3ccccc3)C2)n1 ZINC000110985472 853179634 /nfs/dbraw/zinc/17/96/34/853179634.db2.gz BTKYYLJXIYXHRL-GOSISDBHSA-N 0 3 406.486 4.379 20 0 HIADHN C[C@H]([NH2+]C(C)(C)C[N-]S(=O)(=O)c1c(Cl)cccc1Cl)c1ccccc1 ZINC000111048522 853193729 /nfs/dbraw/zinc/19/37/29/853193729.db2.gz GRISWGZTNGOXMR-ZDUSSCGKSA-N 0 3 401.359 4.401 20 0 HIADHN COc1ccccc1[C@H](CNc1nc(-c2ccccn2)nc(C)c1C)N1CCCC1 ZINC000111147097 853209870 /nfs/dbraw/zinc/20/98/70/853209870.db2.gz RHPOKIJVUVNHBF-NRFANRHFSA-N 0 3 403.530 4.413 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cc(C)ccc1-n1ccnc1)c1cccc(OC)c1 ZINC000112628195 853234770 /nfs/dbraw/zinc/23/47/70/853234770.db2.gz YUUHETTYVQPVSP-QHCPKHFHSA-N 0 3 406.530 4.002 20 0 HIADHN O=C1O[C@H](CN(CCc2ccccn2)Cc2ccc(F)cc2)CN1c1ccccc1 ZINC000112665119 853237821 /nfs/dbraw/zinc/23/78/21/853237821.db2.gz JRITUUNHYVQCCN-HSZRJFAPSA-N 0 3 405.473 4.291 20 0 HIADHN CCN(C(=O)c1ccc2c(c1)NC(=O)[C@H](C)S2)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000115678238 853259629 /nfs/dbraw/zinc/25/96/29/853259629.db2.gz CQMZLAWKHKPLPJ-ABSDTBQOSA-N 0 3 423.582 4.417 20 0 HIADHN CC(C)Oc1ccc(CC[C@H](C)NC(=O)[C@@H]2CCCN(Cc3cccnc3)C2)cc1 ZINC000116394675 853301403 /nfs/dbraw/zinc/30/14/03/853301403.db2.gz JAWYTMKNIKHAQV-NZQKXSOJSA-N 0 3 409.574 4.218 20 0 HIADHN CC[C@@H](CNC(=O)N(Cc1ccco1)Cc1ccco1)N1CCc2ccccc2C1 ZINC000117307786 853352807 /nfs/dbraw/zinc/35/28/07/853352807.db2.gz XNEJBBQTFTXJGU-NRFANRHFSA-N 0 3 407.514 4.421 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3CCC[C@@H]3c3ccc(O)cc3)c(C)c2)CC1 ZINC000138516269 853389228 /nfs/dbraw/zinc/38/92/28/853389228.db2.gz JAZRDKJRORTPCX-HSZRJFAPSA-N 0 3 408.546 4.212 20 0 HIADHN COc1ccc(-c2nn(-c3ccccc3)cc2CNCc2ccc(CO)c(F)c2)cc1 ZINC000140294326 853440779 /nfs/dbraw/zinc/44/07/79/853440779.db2.gz JMKAWOAKBRTVKC-UHFFFAOYSA-N 0 3 417.484 4.469 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N[C@H](c3ccccc3)c3ccccn3)cc2)CC1 ZINC000142986653 853505287 /nfs/dbraw/zinc/50/52/87/853505287.db2.gz IEISFMKAQGRBDF-RUZDIDTESA-N 0 3 414.553 4.131 20 0 HIADHN CC(C)C(=O)Nc1cccc(NC(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)c1 ZINC000143016591 853506142 /nfs/dbraw/zinc/50/61/42/853506142.db2.gz XWRCRQMVVBSFDB-UHFFFAOYSA-N 0 3 408.546 4.064 20 0 HIADHN Cc1cccc(NC(=O)C(C#N)C(=O)Cc2csc(Cc3ccc(F)cc3)n2)c1 ZINC000143114573 853508282 /nfs/dbraw/zinc/50/82/82/853508282.db2.gz NZLTXCQOJGOJOR-IBGZPJMESA-N 0 3 407.470 4.072 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2cnn(-c3ccccn3)c2C(C)C)N2CCCC2)cc1 ZINC000143109620 853508508 /nfs/dbraw/zinc/50/85/08/853508508.db2.gz IQEUIDUSKXDSRO-JOCHJYFZSA-N 0 3 417.557 4.266 20 0 HIADHN CC(=O)N1C=Cc2ccccc2[C@@H]1CC(=O)NC[C@@H](c1ccc(C)cc1)N1CCCC1 ZINC000143206028 853509839 /nfs/dbraw/zinc/50/98/39/853509839.db2.gz ZMVIAVIDTHSFQN-DQEYMECFSA-N 0 3 417.553 4.212 20 0 HIADHN Cc1ccc(-c2cc(C(=O)N[C@@H]3CCN(C4CC4)C3)c3cnn(C(C)C)c3n2)s1 ZINC000143963513 853526505 /nfs/dbraw/zinc/52/65/05/853526505.db2.gz HRMNBXBVVCDQKZ-OAHLLOKOSA-N 0 3 409.559 4.016 20 0 HIADHN COc1ccc(-c2[nH]c3ccccc3c2CCC(=O)N[C@H]2CCN(C3CC3)C2)cc1 ZINC000143989790 853527567 /nfs/dbraw/zinc/52/75/67/853527567.db2.gz HPFVHXZPVLGSSC-SFHVURJKSA-N 0 3 403.526 4.129 20 0 HIADHN Cc1ccc(CN(Cc2cc(=O)n3cc(Br)ccc3n2)C(C)C)s1 ZINC000144919038 853542650 /nfs/dbraw/zinc/54/26/50/853542650.db2.gz SMRCGQSDLTZYPR-UHFFFAOYSA-N 0 3 406.349 4.238 20 0 HIADHN C[C@H](NC(=S)NC1CCN(Cc2ccccc2)CC1)c1ccc(OC(F)F)cc1 ZINC000145557235 853553235 /nfs/dbraw/zinc/55/32/35/853553235.db2.gz AZXNSJPKYKLPQO-INIZCTEOSA-N 0 3 419.541 4.478 20 0 HIADHN Cc1sc2ncnc(SCCC(=O)C(C#N)C(=O)Nc3ccccc3)c2c1C ZINC000150076781 853636715 /nfs/dbraw/zinc/63/67/15/853636715.db2.gz UNTDSXLFJRSPFU-HNNXBMFYSA-N 0 3 410.524 4.138 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)c2cccc(NC(=O)OC(C)(C)C)c2)CC1 ZINC000195540929 853675136 /nfs/dbraw/zinc/67/51/36/853675136.db2.gz SVEPLNWJFHNCJF-UHFFFAOYSA-N 0 3 413.518 4.363 20 0 HIADHN O=C(NCc1ccccc1OCC(F)(F)F)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000195545505 853675898 /nfs/dbraw/zinc/67/58/98/853675898.db2.gz UYHKLLMZUHTZCL-IBGZPJMESA-N 0 3 421.463 4.264 20 0 HIADHN O=C(NCc1ccccc1OCC(F)(F)F)NC[C@H](c1ccccc1)N1CCCC1 ZINC000195556441 853681723 /nfs/dbraw/zinc/68/17/23/853681723.db2.gz LGUSHAIGZBXLIB-LJQANCHMSA-N 0 3 421.463 4.264 20 0 HIADHN COc1ccc([C@@H](NCC(=O)N2CCC[C@H]2c2ccc(OC)cc2OC)C2CC2)cc1 ZINC000195667942 853747547 /nfs/dbraw/zinc/74/75/47/853747547.db2.gz IZDMFKNADNVTGZ-DHLKQENFSA-N 0 3 424.541 4.117 20 0 HIADHN Cc1cc(C(=O)NCC(C)(C)N2CCc3ccccc3C2)c2c(n1)onc2C(C)C ZINC000195691741 853760473 /nfs/dbraw/zinc/76/04/73/853760473.db2.gz CNGQTVYQTFVTRN-UHFFFAOYSA-N 0 3 406.530 4.221 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(S(=O)(=O)N(C)C)cc1)c1cccc(C(F)(F)F)c1 ZINC000195702192 853768394 /nfs/dbraw/zinc/76/83/94/853768394.db2.gz WKPWRNUEFPQDEC-UONOGXRCSA-N 0 3 400.466 4.368 20 0 HIADHN O=C(NCc1ccccc1)C1CCN(CCOc2ccccc2C(F)(F)F)CC1 ZINC000215883858 853839214 /nfs/dbraw/zinc/83/92/14/853839214.db2.gz BBTIQKGWDMBIOH-UHFFFAOYSA-N 0 3 406.448 4.113 20 0 HIADHN Brc1cc(CN[C@@H](c2ccc3c(c2)OCCO3)C2CC2)cc2c1OCO2 ZINC000236596090 853900338 /nfs/dbraw/zinc/90/03/38/853900338.db2.gz GQVQNGAYNNRDAJ-LJQANCHMSA-N 0 3 418.287 4.190 20 0 HIADHN Brc1ccc([C@H](NCc2cnc(N3CCOCC3)s2)C2CCC2)cc1 ZINC000236618315 853902483 /nfs/dbraw/zinc/90/24/83/853902483.db2.gz XHUVGBHKVLJHJC-GOSISDBHSA-N 0 3 422.392 4.373 20 0 HIADHN CC(C)(CNCc1ccc(OCc2ccc(Cl)c(Cl)c2)cc1)S(C)(=O)=O ZINC000236745397 853918585 /nfs/dbraw/zinc/91/85/85/853918585.db2.gz RYYBUVPSTPCLPG-UHFFFAOYSA-N 0 3 416.370 4.485 20 0 HIADHN CC(C)c1ncc(CNCCC(=O)N(C)Cc2ccccc2Br)s1 ZINC000236860653 853930173 /nfs/dbraw/zinc/93/01/73/853930173.db2.gz QAJQXVQBPBXZFI-UHFFFAOYSA-N 0 3 410.381 4.167 20 0 HIADHN CCOc1cc(CN[C@@H]2CCSc3ccccc32)ccc1O[C@@H](C)C(=O)N(C)C ZINC000236892983 853932951 /nfs/dbraw/zinc/93/29/51/853932951.db2.gz MPWSHLRZZGUOSF-QFBILLFUSA-N 0 3 414.571 4.268 20 0 HIADHN CCNC(=O)COc1ccc(CN[C@H](c2ccc(F)cc2)C(C)(C)C)cc1OC ZINC000236894529 853934165 /nfs/dbraw/zinc/93/41/65/853934165.db2.gz BDEGULUZJLWVIL-JOCHJYFZSA-N 0 3 402.510 4.226 20 0 HIADHN CCOc1cc(CNC(C)(C)c2ccc(F)c(F)c2)ccc1O[C@H](C)C(=O)N(C)C ZINC000236909330 853936219 /nfs/dbraw/zinc/93/62/19/853936219.db2.gz VEXUJMHUEDDUFJ-OAHLLOKOSA-N 0 3 420.500 4.244 20 0 HIADHN CCC(CC)C(=O)N1CCC(NCc2c(C)nn(-c3ccc(F)cc3)c2Cl)CC1 ZINC000236934644 853939321 /nfs/dbraw/zinc/93/93/21/853939321.db2.gz XMNMXCPUEQZAKY-UHFFFAOYSA-N 0 3 420.960 4.490 20 0 HIADHN Cc1cccc(-c2n[nH]cc2CNCc2ccc(N(C)C(=O)c3ccncc3)cc2)c1 ZINC000237096323 853963969 /nfs/dbraw/zinc/96/39/69/853963969.db2.gz DDFROVBRQPVWBO-UHFFFAOYSA-N 0 3 411.509 4.347 20 0 HIADHN CN(C(=O)c1ccncc1)c1ccc(CNCc2cc(Cl)c3c(c2)OCCO3)cc1 ZINC000237096561 853964311 /nfs/dbraw/zinc/96/43/11/853964311.db2.gz SURVSULXCWRRGY-UHFFFAOYSA-N 0 3 423.900 4.073 20 0 HIADHN Cc1nn(-c2ccc(Br)cc2)c(C)c1CNC[C@@H](c1ccco1)N(C)C ZINC000237170120 853975317 /nfs/dbraw/zinc/97/53/17/853975317.db2.gz HQCMYCXHULYOMC-IBGZPJMESA-N 0 3 417.351 4.237 20 0 HIADHN COc1cc(CN[C@@H](c2ccc(F)cc2)C(C)(C)C)cc(Cl)c1OCC(N)=O ZINC000237180990 853977751 /nfs/dbraw/zinc/97/77/51/853977751.db2.gz FQXHOUWOHWCXKX-FQEVSTJZSA-N 0 3 408.901 4.229 20 0 HIADHN CNC(=O)c1ccc(CNCc2ccc(OCCOc3ccc(Cl)cc3)cc2)cc1 ZINC000237222796 853985569 /nfs/dbraw/zinc/98/55/69/853985569.db2.gz KZPBOUKDMPHGKZ-UHFFFAOYSA-N 0 3 424.928 4.447 20 0 HIADHN COc1cc(CN[C@H]2CCCCNC2=O)ccc1OCc1cccc(C(F)(F)F)c1 ZINC000237235853 853987873 /nfs/dbraw/zinc/98/78/73/853987873.db2.gz HREPGLMICTZKNN-SFHVURJKSA-N 0 3 422.447 4.051 20 0 HIADHN COc1cc(CNC[C@@H](O)c2ccccc2F)cc(OC)c1OCc1ccccc1 ZINC000237237092 853988728 /nfs/dbraw/zinc/98/87/28/853988728.db2.gz FTKMESYBUNQMHB-OAQYLSRUSA-N 0 3 411.473 4.245 20 0 HIADHN COc1cccc([C@@H](O)CNCc2cccc(NC(=O)c3ccccc3Cl)c2)c1 ZINC000237300313 854001756 /nfs/dbraw/zinc/00/17/56/854001756.db2.gz JMYPVPDCRFKDKO-QFIPXVFZSA-N 0 3 410.901 4.424 20 0 HIADHN COc1ccc(OCc2nc(CN[C@@H]3C[C@H](C)N(Cc4ccccc4)C3)cs2)cc1 ZINC000237308655 854003880 /nfs/dbraw/zinc/00/38/80/854003880.db2.gz LNOZRXQRQLNLIQ-AZUAARDMSA-N 0 3 423.582 4.483 20 0 HIADHN COc1cccc(CNCc2ccccc2CN2C[C@H](C)O[C@@H](C)C2)c1OC(C)C ZINC000237388363 854020611 /nfs/dbraw/zinc/02/06/11/854020611.db2.gz UYBKALQPVJQDOL-PMACEKPBSA-N 0 3 412.574 4.381 20 0 HIADHN C[C@@H](CC(=O)Nc1cccc(N2CCCC2)c1)NCc1cc2ccccc2[nH]c1=O ZINC000237393411 854021190 /nfs/dbraw/zinc/02/11/90/854021190.db2.gz WCNPTKSLGCGQHM-KRWDZBQOSA-N 0 3 404.514 4.048 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2CNCc2ccc(Br)s2)C[C@@H](C)O1 ZINC000237411728 854026425 /nfs/dbraw/zinc/02/64/25/854026425.db2.gz DKQAKKDCOBFKPE-HUUCEWRRSA-N 0 3 409.393 4.410 20 0 HIADHN COc1cc(CN[C@H]2CCC(C)(C)c3ccccc32)cc(Cl)c1OCC(N)=O ZINC000237413935 854026890 /nfs/dbraw/zinc/02/68/90/854026890.db2.gz WUOHVABSSDCQNE-SFHVURJKSA-N 0 3 402.922 4.115 20 0 HIADHN COc1cc(CN[C@H]2CCc3cc(Cl)ccc32)ccc1OCC(=O)N1CCCC1 ZINC000237422498 854029535 /nfs/dbraw/zinc/02/95/35/854029535.db2.gz XCRMGRVZYPZFIY-FQEVSTJZSA-N 0 3 414.933 4.127 20 0 HIADHN COc1ccc(-c2ccc(CN[C@H](C)[C@@H](O)c3ccc(F)cc3)o2)c([N+](=O)[O-])c1 ZINC000237439664 854033258 /nfs/dbraw/zinc/03/32/58/854033258.db2.gz VRMUOLOXURCWSN-LRTDBIEQSA-N 0 3 400.406 4.214 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(CNCc3ccc(F)c(CN(C)C)c3)c2)cc1 ZINC000237467684 854039032 /nfs/dbraw/zinc/03/90/32/854039032.db2.gz WGSXPKKOVGZLKV-UHFFFAOYSA-N 0 3 421.516 4.438 20 0 HIADHN C[C@H](NCc1cccc(OC(F)(F)F)c1)c1ccc(OCC(=O)NC2CC2)cc1 ZINC000237491687 854044411 /nfs/dbraw/zinc/04/44/11/854044411.db2.gz ABFJGLRPVWFFMI-AWEZNQCLSA-N 0 3 408.420 4.093 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2CNCc2c(F)cccc2N2CCCC2)C[C@@H](C)O1 ZINC000237572603 854056161 /nfs/dbraw/zinc/05/61/61/854056161.db2.gz PJLMJUGGQYWPKU-WOJBJXKFSA-N 0 3 411.565 4.325 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2CNCc2ccc(Br)cc2F)C[C@H](C)O1 ZINC000237621329 854063711 /nfs/dbraw/zinc/06/37/11/854063711.db2.gz LQKIMEXRZKFYGC-IYBDPMFKSA-N 0 3 421.354 4.487 20 0 HIADHN Cc1nn(Cc2ccccc2Cl)c(C)c1CNCCNC(=O)c1ccc(C)cc1 ZINC000237629384 854065077 /nfs/dbraw/zinc/06/50/77/854065077.db2.gz RPOSDXZNWZXPAP-UHFFFAOYSA-N 0 3 410.949 4.030 20 0 HIADHN Cc1nn(Cc2ccccc2Cl)c(C)c1CNC[C@H](O)c1c(F)cccc1F ZINC000237677360 854074344 /nfs/dbraw/zinc/07/43/44/854074344.db2.gz ONRVQIQQKCOFBB-FQEVSTJZSA-N 0 3 405.876 4.303 20 0 HIADHN Cc1nn(-c2cc(C)ccc2C)c(Cl)c1CNC[C@@H]1CCN(CC(F)(F)F)C1 ZINC000237686413 854075978 /nfs/dbraw/zinc/07/59/78/854075978.db2.gz ZDCGXEVCAODRRX-INIZCTEOSA-N 0 3 414.903 4.425 20 0 HIADHN Cn1ncc2c1CCC[C@H]2NCc1ccc(OC(F)(F)[C@H](F)C(F)(F)F)cc1 ZINC000237734385 854085719 /nfs/dbraw/zinc/08/57/19/854085719.db2.gz WXEUCUPBFWXINC-GDBMZVCRSA-N 0 3 407.358 4.459 20 0 HIADHN Cc1nn(Cc2ccccc2Cl)c(C)c1CNC[C@@H](O)COc1cccc(C)c1 ZINC000237773592 854093764 /nfs/dbraw/zinc/09/37/64/854093764.db2.gz JQLONWMILPDCTD-HXUWFJFHSA-N 0 3 413.949 4.040 20 0 HIADHN Cc1nn(Cc2ccc(C)cc2)c(Cl)c1CNC[C@@H]1CCN(CC(F)(F)F)C1 ZINC000237857340 854109331 /nfs/dbraw/zinc/10/93/31/854109331.db2.gz AFLWLWUDGQKSCN-KRWDZBQOSA-N 0 3 414.903 4.175 20 0 HIADHN Fc1cc(CN[C@H]2CCc3c2cccc3Br)ccc1N1CCOCC1 ZINC000237865785 854110679 /nfs/dbraw/zinc/11/06/79/854110679.db2.gz XGSRATAPXUNQAE-IBGZPJMESA-N 0 3 405.311 4.202 20 0 HIADHN Cc1nn(-c2ccccc2)c(Cl)c1CNCCCC(=O)N1Cc2ccccc2C1 ZINC000237873476 854112705 /nfs/dbraw/zinc/11/27/05/854112705.db2.gz VDHUTEFROQVYTN-UHFFFAOYSA-N 0 3 408.933 4.246 20 0 HIADHN O=C(CCCNCc1nc(-c2ccccc2)cs1)N1CCN(c2ccccc2)CC1 ZINC000237998335 854130485 /nfs/dbraw/zinc/13/04/85/854130485.db2.gz WKZKVSJFZJLOIA-UHFFFAOYSA-N 0 3 420.582 4.029 20 0 HIADHN [O-]c1ccc(Cl)cc1CN1CCC[C@@H]([NH2+]Cc2ccc(Oc3cnccn3)cc2)C1 ZINC000238061175 854139755 /nfs/dbraw/zinc/13/97/55/854139755.db2.gz NXTKVGVADHODPD-HXUWFJFHSA-N 0 3 424.932 4.382 20 0 HIADHN FC(F)(F)c1nc2[nH]cnc2c(NC2CCN(Cc3ccc(Cl)cc3)CC2)n1 ZINC000301082038 854290796 /nfs/dbraw/zinc/29/07/96/854290796.db2.gz JCGZCQFKXGSTQZ-UHFFFAOYSA-N 0 3 410.831 4.102 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(NC[C@@H](C(C)C)[N@@H+]3CCc4ccccc4C3)nc2)n1 ZINC000301165717 854317837 /nfs/dbraw/zinc/31/78/37/854317837.db2.gz HQABBAJGEUSUHI-QFIPXVFZSA-N 0 3 417.557 4.301 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(NC[C@@H](C(C)C)[N@H+]3CCc4ccccc4C3)nc2)n1 ZINC000301165717 854317840 /nfs/dbraw/zinc/31/78/40/854317840.db2.gz HQABBAJGEUSUHI-QFIPXVFZSA-N 0 3 417.557 4.301 20 0 HIADHN CCO[C@H]1C[C@H](O)C12CCN(c1c(C)c(C)nc3ccc(Br)cc31)CC2 ZINC000301395276 854381711 /nfs/dbraw/zinc/38/17/11/854381711.db2.gz LHPCAMGMEBDKRC-OALUTQOASA-N 0 3 419.363 4.370 20 0 HIADHN C[C@@H](CN1CCCCC1)Nc1ccc(-n2ncc(Cl)c(Cl)c2=O)cc1Cl ZINC000301522235 854412109 /nfs/dbraw/zinc/41/21/09/854412109.db2.gz LVUOTVIESIQYKQ-LBPRGKRZSA-N 0 3 415.752 4.479 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(N[C@H]3CC[N@H+](Cc4ccccc4)[C@@H](C)C3)nc2)n1 ZINC000301532282 854414253 /nfs/dbraw/zinc/41/42/53/854414253.db2.gz KNFGGICKAACYIP-UWJYYQICSA-N 0 3 403.530 4.272 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(N[C@H]3CC[N@@H+](Cc4ccccc4)[C@@H](C)C3)nc2)n1 ZINC000301532282 854414259 /nfs/dbraw/zinc/41/42/59/854414259.db2.gz KNFGGICKAACYIP-UWJYYQICSA-N 0 3 403.530 4.272 20 0 HIADHN Cc1cc(C)c(NC(=O)CNC(=O)CN[C@H](C)c2cccc3ccccc32)c(C)c1 ZINC000301578939 854423618 /nfs/dbraw/zinc/42/36/18/854423618.db2.gz GMDDTZXAGIHRSC-LJQANCHMSA-N 0 3 403.526 4.171 20 0 HIADHN FC(F)c1nnc2ccc(NCC3CCN(Cc4ccccc4Cl)CC3)nn21 ZINC000301744217 854456733 /nfs/dbraw/zinc/45/67/33/854456733.db2.gz ZRDFGHPNQDXGTC-UHFFFAOYSA-N 0 3 406.868 4.039 20 0 HIADHN CCN1CCN([C@@H](C)CNc2ccc3cc(Br)cc(Cl)c3n2)CC1 ZINC000302033707 854519989 /nfs/dbraw/zinc/51/99/89/854519989.db2.gz TTWXUFYCRICPOW-ZDUSSCGKSA-N 0 3 411.775 4.089 20 0 HIADHN C[C@@H](c1ccccc1)N1CCC(Nc2nn3cc(-c4cccnc4)nc3s2)CC1 ZINC000302082098 854528430 /nfs/dbraw/zinc/52/84/30/854528430.db2.gz JKFVQYDTCBLJBP-INIZCTEOSA-N 0 3 404.543 4.490 20 0 HIADHN CC(C)(C)OC(=O)NC[C@H](NCc1cccc(Br)n1)C1CCCCC1 ZINC000302115296 854532411 /nfs/dbraw/zinc/53/24/11/854532411.db2.gz RBPYJZIQPKHGRS-INIZCTEOSA-N 0 3 412.372 4.407 20 0 HIADHN C[C@@H]1C[C@@H](Nc2nn3cc(-c4cccnc4)nc3s2)CCN1Cc1ccccc1 ZINC000302200002 854549063 /nfs/dbraw/zinc/54/90/63/854549063.db2.gz UUDUZWVCEOHZNZ-APWZRJJASA-N 0 3 404.543 4.318 20 0 HIADHN C[C@H](CCN1CCN(C)CC1)Nc1ccc2cc(Br)cc(Cl)c2n1 ZINC000302238074 854555469 /nfs/dbraw/zinc/55/54/69/854555469.db2.gz GVJNLIYSEHUSBN-CYBMUJFWSA-N 0 3 411.775 4.089 20 0 HIADHN Cc1nc2ccc(Br)cc2c(N2CCC(Cn3cncn3)CC2)c1C ZINC000302341116 854562669 /nfs/dbraw/zinc/56/26/69/854562669.db2.gz AEPVHWQVRCQWME-UHFFFAOYSA-N 0 3 400.324 4.122 20 0 HIADHN COc1ccc(OC)c([C@@H](C)NC(=O)CN[C@@H](c2ccc(Cl)cc2)C2CC2)c1 ZINC000302759472 854623760 /nfs/dbraw/zinc/62/37/60/854623760.db2.gz OBTIOASLNLKDDI-JLCFBVMHSA-N 0 3 402.922 4.275 20 0 HIADHN COc1ccc([C@H](CNC(=O)NCc2cccc(C(F)(F)F)c2)N2CCCC2)cc1 ZINC000302809354 854641614 /nfs/dbraw/zinc/64/16/14/854641614.db2.gz HKGBOPSNSVATGV-FQEVSTJZSA-N 0 3 421.463 4.350 20 0 HIADHN COc1ccc([C@@H](CNC(=O)NCc2ccc(C(F)(F)F)cc2)N2CCCC2)cc1 ZINC000302852239 854657245 /nfs/dbraw/zinc/65/72/45/854657245.db2.gz SASIZGGMUCOHLD-HXUWFJFHSA-N 0 3 421.463 4.350 20 0 HIADHN COc1ccc(OC)c([C@H]2CCCN2C[C@H](O)COc2cccc3ccccc32)c1 ZINC000302876056 854663943 /nfs/dbraw/zinc/66/39/43/854663943.db2.gz NJYICBNSXXBZBE-WMZHIEFXSA-N 0 3 407.510 4.434 20 0 HIADHN CN(CCOc1ccc(Cl)cc1)C(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000302894303 854668698 /nfs/dbraw/zinc/66/86/98/854668698.db2.gz IKARPXAASXZOOE-SFHVURJKSA-N 0 3 407.967 4.259 20 0 HIADHN CC1CCN([C@@H](CNC(=O)Nc2ccc3c(c2)OCCO3)c2cccs2)CC1 ZINC000302913189 854677525 /nfs/dbraw/zinc/67/75/25/854677525.db2.gz SBOFJXLJYVVKBF-KRWDZBQOSA-N 0 3 401.532 4.114 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)c1csc(Cc2ccccc2)n1 ZINC000302955861 854695188 /nfs/dbraw/zinc/69/51/88/854695188.db2.gz FKVWQDUGVCPQLM-UHFFFAOYSA-N 0 3 415.509 4.216 20 0 HIADHN O=C(NC[C@H]1CCCCN1Cc1ccccc1)c1ccc(OC[C@H]2CCCO2)cc1 ZINC000302962217 854697494 /nfs/dbraw/zinc/69/74/94/854697494.db2.gz GHRUTQCTTKYHMN-ISKFKSNPSA-N 0 3 408.542 4.029 20 0 HIADHN O=C(Nc1cccc(OC[C@H]2CCCO2)c1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000302963098 854698288 /nfs/dbraw/zinc/69/82/88/854698288.db2.gz GLTSYYXPJJPGJM-AUSIDOKSSA-N 0 3 412.505 4.234 20 0 HIADHN O=C(NCc1ccc(Br)c(F)c1)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000302963432 854698514 /nfs/dbraw/zinc/69/85/14/854698514.db2.gz GZZDBMNGGRIPQK-QGZVFWFLSA-N 0 3 420.326 4.052 20 0 HIADHN Cc1ccc(-c2nn(Cc3ccccc3)cc2C(=O)NC[C@@H]2CCCN2C)cc1C ZINC000302990639 854712332 /nfs/dbraw/zinc/71/23/32/854712332.db2.gz JJATZVMIKXOMQF-QFIPXVFZSA-N 0 3 402.542 4.039 20 0 HIADHN Cc1cc(-n2c(C)cc(C(=O)N(CCN(C)C)Cc3cccc(Cl)c3)c2C)no1 ZINC000302991448 854713358 /nfs/dbraw/zinc/71/33/58/854713358.db2.gz MNWBIPMQCUJURL-UHFFFAOYSA-N 0 3 414.937 4.248 20 0 HIADHN CC1CCN([C@@H](CNC(=O)[C@H]2CCCN2C(=O)CC(C)(C)C)c2cccs2)CC1 ZINC000303006904 854720150 /nfs/dbraw/zinc/72/01/50/854720150.db2.gz IOYPWKVSGYBEIH-MOPGFXCFSA-N 0 3 419.635 4.065 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N[C@H]3CCOc4c(Cl)cccc43)cc2)CC1 ZINC000303029302 854730881 /nfs/dbraw/zinc/73/08/81/854730881.db2.gz WYQBFHNTJOLFLD-NRFANRHFSA-N 0 3 413.949 4.124 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2ccccc2OC[C@H]2CCCO2)N2CCCC2)cc1 ZINC000303048523 854738094 /nfs/dbraw/zinc/73/80/94/854738094.db2.gz RBZQCMADFCBKQF-FYYLOGMGSA-N 0 3 408.542 4.120 20 0 HIADHN Cc1ccc([C@H](CNC(=O)[C@H]2C[C@H]2c2ccc(Br)cc2)N(C)C)cc1 ZINC000303054713 854740400 /nfs/dbraw/zinc/74/04/00/854740400.db2.gz WIRZMEXXUYFCMI-UFYCRDLUSA-N 0 3 401.348 4.280 20 0 HIADHN O=C(NC[C@@H]1CCCCN1Cc1ccccc1)c1ccccc1OC[C@@H]1CCCO1 ZINC000303073513 854748489 /nfs/dbraw/zinc/74/84/89/854748489.db2.gz QDGCSRVMUHPDLK-VXKWHMMOSA-N 0 3 408.542 4.029 20 0 HIADHN O=C(NC[C@H]1CCCCN1Cc1ccccc1)c1ccccc1OC[C@H]1CCCO1 ZINC000303073512 854748716 /nfs/dbraw/zinc/74/87/16/854748716.db2.gz QDGCSRVMUHPDLK-FGZHOGPDSA-N 0 3 408.542 4.029 20 0 HIADHN C[C@H]1CCCC[N@@H+]1Cc1ccc(NC(=O)[C@H]2CCCN2C(=O)c2ccccc2[O-])cc1 ZINC000303136724 854778689 /nfs/dbraw/zinc/77/86/89/854778689.db2.gz AJIXTENRAIRDPQ-PGRDOPGGSA-N 0 3 421.541 4.010 20 0 HIADHN C[C@H]1CCCC[N@H+]1Cc1ccc(NC(=O)[C@H]2CCCN2C(=O)c2ccccc2[O-])cc1 ZINC000303136724 854778693 /nfs/dbraw/zinc/77/86/93/854778693.db2.gz AJIXTENRAIRDPQ-PGRDOPGGSA-N 0 3 421.541 4.010 20 0 HIADHN Cc1cc(O[C@@H](C)C(=O)N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)ccc1C(C)C ZINC000303139651 854780309 /nfs/dbraw/zinc/78/03/09/854780309.db2.gz KKJLSFIXNSZJEQ-HBMCJLEFSA-N 0 3 416.606 4.234 20 0 HIADHN CC(C)CN(CCN(C)C)C(=O)N[C@H](c1ccccc1)c1ccc2c(c1)CCCO2 ZINC000303264694 854841935 /nfs/dbraw/zinc/84/19/35/854841935.db2.gz DXXHPWYGPBKBTG-XMMPIXPASA-N 0 3 409.574 4.330 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)C2(c3ccccc3Cl)CCOCC2)N(C)C)cc1 ZINC000303355180 854889520 /nfs/dbraw/zinc/88/95/20/854889520.db2.gz YNDYVOHKPAKXKL-OAQYLSRUSA-N 0 3 400.950 4.116 20 0 HIADHN CCc1cccc2c(CC(=O)NC[C@H](c3cccc(OC)c3)N3CCCC3)c[nH]c21 ZINC000303375606 854898221 /nfs/dbraw/zinc/89/82/21/854898221.db2.gz KOWDXQSQPHXBEU-HSZRJFAPSA-N 0 3 405.542 4.235 20 0 HIADHN CCCO[C@@H]1CCCN(CC(=O)N(Cc2ccc(C(F)(F)F)cc2)C2CC2)CC1 ZINC000303409439 854913293 /nfs/dbraw/zinc/91/32/93/854913293.db2.gz UJALUXVMJLNNHT-HXUWFJFHSA-N 0 3 412.496 4.478 20 0 HIADHN CCCO[C@H]1CCCN(CC(=O)N(Cc2ccc(C(F)(F)F)cc2)C2CC2)CC1 ZINC000303409437 854913464 /nfs/dbraw/zinc/91/34/64/854913464.db2.gz UJALUXVMJLNNHT-FQEVSTJZSA-N 0 3 412.496 4.478 20 0 HIADHN O=C(NC[C@@H](O)c1ccc(Cl)cc1Cl)N[C@H](CN1CCCC1)c1ccccc1 ZINC000303456591 854956601 /nfs/dbraw/zinc/95/66/01/854956601.db2.gz KESSQBGDFJVIAV-WOJBJXKFSA-N 0 3 422.356 4.163 20 0 HIADHN O=S(=O)(NC1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1)C1=Cc2ccccc2CC1 ZINC000303484232 854976616 /nfs/dbraw/zinc/97/66/16/854976616.db2.gz QMQBYJMQWFIKEL-NOTZXAQLSA-N 0 3 408.567 4.089 20 0 HIADHN Cc1ccc(S(=O)(=O)NC2C[C@H]3CC[C@@H](C2)N3Cc2ccccc2)c2cccnc12 ZINC000303484224 854976663 /nfs/dbraw/zinc/97/66/63/854976663.db2.gz QMNTYOIQPXDTTN-SEJPIABJSA-N 0 3 421.566 4.017 20 0 HIADHN CCc1nc([C@@H](C)NC(=O)Nc2ccc(CCN3CCSCC3)cc2)cs1 ZINC000303507905 854996061 /nfs/dbraw/zinc/99/60/61/854996061.db2.gz WHLQUPKYXAORGS-OAHLLOKOSA-N 0 3 404.605 4.180 20 0 HIADHN CCN1CCCC[C@H]1CNC(=O)c1ccc(COc2ccc(Br)cc2)o1 ZINC000303523366 855011202 /nfs/dbraw/zinc/01/12/02/855011202.db2.gz VKOHCVZEVGKVNE-INIZCTEOSA-N 0 3 421.335 4.225 20 0 HIADHN COc1ccc(CN(C)C(=O)c2oc3ccccc3c2CN(C)C)cc1OC(F)F ZINC000303590170 855062895 /nfs/dbraw/zinc/06/28/95/855062895.db2.gz UTVHXZNBEDROHK-UHFFFAOYSA-N 0 3 418.440 4.377 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)N1CCN(Cc2ccc(Cl)cc2)CC1 ZINC000303608493 855075336 /nfs/dbraw/zinc/07/53/36/855075336.db2.gz YMFSIOHBFWKTLP-UHFFFAOYSA-N 0 3 411.933 4.106 20 0 HIADHN O=C(CC1CCCC1)NC1CCC(C(=O)O[C@@H]2CCN(Cc3ccccc3)C2)CC1 ZINC000303702770 855142143 /nfs/dbraw/zinc/14/21/43/855142143.db2.gz RYUWGNJMPYGCBV-XPPIMPSXSA-N 0 3 412.574 4.059 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1NC(=O)[C@H](C)N1CCN(C2CCC(C)CC2)CC1 ZINC000303737656 855162191 /nfs/dbraw/zinc/16/21/91/855162191.db2.gz XEPBOFUNPFOIDH-QUENFVSXSA-N 0 3 423.605 4.012 20 0 HIADHN Cc1ccccc1SCC(=O)NC1CCN(CCOc2ccc(Cl)cc2)CC1 ZINC000303738053 855163155 /nfs/dbraw/zinc/16/31/55/855163155.db2.gz YABYKHIHWARIDR-UHFFFAOYSA-N 0 3 418.990 4.400 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)C(C)(C)c2cccc(Cl)c2)CC1 ZINC000303745350 855167464 /nfs/dbraw/zinc/16/74/64/855167464.db2.gz FUYNYRORGAFIML-UHFFFAOYSA-N 0 3 413.993 4.072 20 0 HIADHN CCOC(=O)CCCCN1CCc2cc(OC)c(OC)cc2[C@H]1c1cccs1 ZINC000303755205 855175420 /nfs/dbraw/zinc/17/54/20/855175420.db2.gz BHLSPCFHMIPMTJ-QFIPXVFZSA-N 0 3 403.544 4.446 20 0 HIADHN CSCc1nc2ccccc2n1CC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C ZINC000303858115 855253485 /nfs/dbraw/zinc/25/34/85/855253485.db2.gz PEPWWWGBWUVFJE-LJQANCHMSA-N 0 3 422.598 4.022 20 0 HIADHN COc1cc2c(cc1OC)CN(C(=O)CN1CCC[C@H]1c1cccc(C)c1C)CC2 ZINC000303871298 855262785 /nfs/dbraw/zinc/26/27/85/855262785.db2.gz HVMIGOBETSFMLP-QFIPXVFZSA-N 0 3 408.542 4.042 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2ccc(C(C)(C)C)cc2)cc1)[C@H]1CCCN(C)C1 ZINC000303885453 855269632 /nfs/dbraw/zinc/26/96/32/855269632.db2.gz JTKMFTCAGNKCDO-QFIPXVFZSA-N 0 3 407.558 4.403 20 0 HIADHN CC(C)OCCCNC(=O)C1CCN(CCOc2cc(Cl)cc(Cl)c2)CC1 ZINC000303888200 855271580 /nfs/dbraw/zinc/27/15/80/855271580.db2.gz JXIAEMHRKUORJA-UHFFFAOYSA-N 0 3 417.377 4.016 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)[C@H]1C[C@H]1c1cc(F)ccc1F ZINC000303928369 855297557 /nfs/dbraw/zinc/29/75/57/855297557.db2.gz UWJGKOPZPFJQOG-ICSRJNTNSA-N 0 3 402.510 4.298 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2C(=O)N(C)[C@H]2CCCN(C)C2)c(C)c1 ZINC000303963376 855324945 /nfs/dbraw/zinc/32/49/45/855324945.db2.gz XKNDOXLCTZEPCR-NRFANRHFSA-N 0 3 402.542 4.322 20 0 HIADHN Brc1csc(CNCc2cccc(I)c2)c1 ZINC000304399225 855355481 /nfs/dbraw/zinc/35/54/81/855355481.db2.gz GZULJHNCLLNAKT-UHFFFAOYSA-N 0 3 408.102 4.405 20 0 HIADHN CC(C)(C)OC(=O)NC[C@](C)(NCc1ccc(Br)cc1F)C1CC1 ZINC000310054699 855365086 /nfs/dbraw/zinc/36/50/86/855365086.db2.gz WJIXFVJGRZAUHR-SFHVURJKSA-N 0 3 401.320 4.371 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCN(C(=O)c2ccc(F)cc2Br)C1 ZINC000323879533 855396303 /nfs/dbraw/zinc/39/63/03/855396303.db2.gz GCMNXITZOZWVSP-OAHLLOKOSA-N 0 3 405.311 4.182 20 0 HIADHN O=C(NC[C@@H]1CCCCN1Cc1ccccc1)c1cccc(Br)c1F ZINC000379716888 855427736 /nfs/dbraw/zinc/42/77/36/855427736.db2.gz OOCLQWOCYPGOQR-INIZCTEOSA-N 0 3 405.311 4.373 20 0 HIADHN CC(C)(C)OC(=O)N1CC[C@@H](CCNCc2cccc(F)c2Br)C1 ZINC000382770219 855434376 /nfs/dbraw/zinc/43/43/76/855434376.db2.gz URIAGQBKDZBPNA-CYBMUJFWSA-N 0 3 401.320 4.325 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)c1ccc(Br)cc1F ZINC000383040377 855435437 /nfs/dbraw/zinc/43/54/37/855435437.db2.gz ABQFZHQKKDXVJR-OAHLLOKOSA-N 0 3 405.311 4.325 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)c1ccc(Br)c(F)c1 ZINC000383061479 855437075 /nfs/dbraw/zinc/43/70/75/855437075.db2.gz STROVHMBHBTNLL-HNNXBMFYSA-N 0 3 405.311 4.325 20 0 HIADHN C[C@H](NCC1([S@@](C)=O)CCC1)c1ccc(Br)cc1Br ZINC000393697193 855468645 /nfs/dbraw/zinc/46/86/45/855468645.db2.gz HKUVMUSHWDGHIN-APBUJDDRSA-N 0 3 409.187 4.163 20 0 HIADHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(Br)c(C(F)(F)F)c1 ZINC000394363951 855469704 /nfs/dbraw/zinc/46/97/04/855469704.db2.gz IMDLSECLIZQVAI-OLZOCXBDSA-N 0 3 405.258 4.167 20 0 HIADHN CC(C)(C)OC(=O)N1CCC[C@@H](N[C@H]2CCOc3ccc(Br)cc32)C1 ZINC000394130857 855470034 /nfs/dbraw/zinc/47/00/34/855470034.db2.gz VSGNRSDVSXZTLW-ZBFHGGJFSA-N 0 3 411.340 4.262 20 0 HIADHN O=C(NCC1(O)CCN(Cc2ccccc2)CC1)Nc1ccc(Cl)c(Cl)c1 ZINC000397508980 855473038 /nfs/dbraw/zinc/47/30/38/855473038.db2.gz GOZFGCGEFUSKIW-UHFFFAOYSA-N 0 3 408.329 4.142 20 0 HIADHN Cc1cc(-c2noc(CCC(=O)N[C@H]3CCN([C@H](C)c4ccccc4)C3)n2)ccc1F ZINC000409453695 855486553 /nfs/dbraw/zinc/48/65/53/855486553.db2.gz PYGLKGWEXONGLX-XLIONFOSSA-N 0 3 422.504 4.068 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1ccc2c(c1)nc(C(F)F)n2C)c1ccsc1 ZINC000409456778 855488254 /nfs/dbraw/zinc/48/82/54/855488254.db2.gz HTDNZFUJHIXVKP-QGZVFWFLSA-N 0 3 406.502 4.385 20 0 HIADHN CCCc1cc(C(=O)Nc2ccccc2CN2CCC[C@@H](C(N)=O)C2)ccc1Cl ZINC000409499728 855510288 /nfs/dbraw/zinc/51/02/88/855510288.db2.gz MFGBKBRYPFBTGC-LJQANCHMSA-N 0 3 413.949 4.242 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2ccc3c(c2)nc(C(F)F)n3C)N2CCCC2)cc1 ZINC000409608474 855563090 /nfs/dbraw/zinc/56/30/90/855563090.db2.gz OLPORKVNRKXNCJ-HXUWFJFHSA-N 0 3 412.484 4.386 20 0 HIADHN Cc1cc(C)c(NC(=O)NCCCCN2CCN(Cc3ccccc3)CC2)c(C)c1 ZINC000409680924 855598876 /nfs/dbraw/zinc/59/88/76/855598876.db2.gz YUNDZQPSEUWDLB-UHFFFAOYSA-N 0 3 408.590 4.331 20 0 HIADHN CCN1CCc2nc(NC(=O)c3cccc(CN(C)Cc4ccccc4)c3)sc2C1 ZINC000409746795 855633013 /nfs/dbraw/zinc/63/30/13/855633013.db2.gz LVOYAWSFAGCXSL-UHFFFAOYSA-N 0 3 420.582 4.405 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)c1ccc2c(c1)nc(C(F)F)n2C ZINC000409843476 855682667 /nfs/dbraw/zinc/68/26/67/855682667.db2.gz ONBJJYFFDLHUBR-UHFFFAOYSA-N 0 3 420.891 4.368 20 0 HIADHN CN1CC[C@H](NC(=O)C(C)(C)c2ccccc2Br)[C@H]1c1ccccc1 ZINC000409882348 855704657 /nfs/dbraw/zinc/70/46/57/855704657.db2.gz JMQRAWVONKRWFN-RBUKOAKNSA-N 0 3 401.348 4.288 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3ccc(Br)cc3C)c(C)c2)CC1 ZINC000409941666 855735993 /nfs/dbraw/zinc/73/59/93/855735993.db2.gz BBWXFJQFCXDZPM-UHFFFAOYSA-N 0 3 416.363 4.460 20 0 HIADHN COc1ccc(-c2nc(C)c(C(=O)N(CCN(C)C)Cc3ccco3)s2)c(F)c1 ZINC000410007674 855776342 /nfs/dbraw/zinc/77/63/42/855776342.db2.gz VYXOJAABVSDTPI-UHFFFAOYSA-N 0 3 417.506 4.063 20 0 HIADHN C[C@H](NC(=O)NCC1(N2CCSCC2)CCCC1)c1ccc(C(F)(F)F)cc1 ZINC000410151985 855840319 /nfs/dbraw/zinc/84/03/19/855840319.db2.gz UTMFSAALTKAHDP-HNNXBMFYSA-N 0 3 415.525 4.427 20 0 HIADHN C[C@H](Oc1ccc(Cl)c(Cl)c1)C(=O)N(Cc1ccco1)C1CCN(C)CC1 ZINC000410179404 855851976 /nfs/dbraw/zinc/85/19/76/855851976.db2.gz ALRCEQRQHBZBGF-AWEZNQCLSA-N 0 3 411.329 4.477 20 0 HIADHN COc1ccc2ccccc2c1CNC(=O)N(Cc1ccco1)C1CCN(C)CC1 ZINC000410187349 855854579 /nfs/dbraw/zinc/85/45/79/855854579.db2.gz VVIAWONPVKUIED-UHFFFAOYSA-N 0 3 407.514 4.247 20 0 HIADHN COCC1(CN[C@H](c2ccc3c(c2)OCCO3)c2ccccc2Cl)CCOCC1 ZINC000425952025 856014819 /nfs/dbraw/zinc/01/48/19/856014819.db2.gz RNILSIHWPMCHFM-JOCHJYFZSA-N 0 3 417.933 4.233 20 0 HIADHN Cc1ccc(Cl)cc1NC(=O)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000426009715 856045248 /nfs/dbraw/zinc/04/52/48/856045248.db2.gz YTUABVKHFXRWIN-UHFFFAOYSA-N 0 3 405.901 4.452 20 0 HIADHN CCOc1ccccc1[C@H](CC(C)C)NC(=O)N1CCN(C2CCOCC2)C[C@@H]1C ZINC000426068645 856084847 /nfs/dbraw/zinc/08/48/47/856084847.db2.gz CSABJFSQAPDBPV-UGKGYDQZSA-N 0 3 417.594 4.067 20 0 HIADHN CCOc1ccccc1[C@@H](CC(C)C)NC(=O)N1CCN(C2CCOCC2)C[C@H]1C ZINC000426068642 856084989 /nfs/dbraw/zinc/08/49/89/856084989.db2.gz CSABJFSQAPDBPV-DENIHFKCSA-N 0 3 417.594 4.067 20 0 HIADHN CSc1ccc(Cl)cc1NC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1CO ZINC000426098073 856107103 /nfs/dbraw/zinc/10/71/03/856107103.db2.gz FEIMIWOZPIPZPO-WMZOPIPTSA-N 0 3 419.978 4.066 20 0 HIADHN CCCn1ccc2cc(NC(=O)N[C@@H]3CCN(Cc4ccccc4)C[C@H]3CO)ccc21 ZINC000426106581 856111386 /nfs/dbraw/zinc/11/13/86/856111386.db2.gz PBEPPMDWLUVWQG-JTHBVZDNSA-N 0 3 420.557 4.056 20 0 HIADHN COc1ccc(COC[C@H](O)CN[C@@H](C)c2cc(Cl)ccc2Cl)cc1OC ZINC000426108899 856112538 /nfs/dbraw/zinc/11/25/38/856112538.db2.gz JVFPJBIQWVLCAD-XJKSGUPXSA-N 0 3 414.329 4.239 20 0 HIADHN CC(C)Sc1ccccc1NC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1CO ZINC000426153785 856142282 /nfs/dbraw/zinc/14/22/82/856142282.db2.gz ONWBOCCOELXJAB-WOJBJXKFSA-N 0 3 413.587 4.192 20 0 HIADHN C[C@H]1CN(C2CCOCC2)CCN1C(=O)N[C@@H]1CCc2ccc(-c3ccccc3)cc21 ZINC000426188044 856164880 /nfs/dbraw/zinc/16/48/80/856164880.db2.gz SUDCADRGXWUQFS-UQBPGWFLSA-N 0 3 419.569 4.236 20 0 HIADHN C[C@@H](NC(=O)N1CCN(C2CCOCC2)C[C@H]1C)c1ccc(Cl)c2ccccc21 ZINC000426200258 856171651 /nfs/dbraw/zinc/17/16/51/856171651.db2.gz GYXZLFUADVICRB-IAGOWNOFSA-N 0 3 415.965 4.449 20 0 HIADHN CC(C)c1nn(C)cc1-c1noc([C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)n1 ZINC000426214996 856180941 /nfs/dbraw/zinc/18/09/41/856180941.db2.gz KIGKCZZFBWBDCY-FQEVSTJZSA-N 0 3 419.451 4.300 20 0 HIADHN C[C@@H]1CN(C2CCOCC2)CCN1C(=O)N[C@H]1C[C@@H]2CCC(C)(C)c3cccc1c32 ZINC000426217210 856182502 /nfs/dbraw/zinc/18/25/02/856182502.db2.gz XMMOQMIOJROZQB-FGSXEWAUSA-N 0 3 411.590 4.181 20 0 HIADHN C[C@@H]1CN(C2CCOCC2)CCN1C(=O)N[C@@H]1C[C@H]2CCC(C)(C)c3cccc1c32 ZINC000426217216 856182950 /nfs/dbraw/zinc/18/29/50/856182950.db2.gz XMMOQMIOJROZQB-JBYIUTFZSA-N 0 3 411.590 4.181 20 0 HIADHN CN(C)[C@@H](CNC(=O)N1CCC[C@H](c2nc3c(s2)CCCC3)C1)c1ccccc1 ZINC000426232921 856191340 /nfs/dbraw/zinc/19/13/40/856191340.db2.gz PFFGNTGTJFJCTN-ICSRJNTNSA-N 0 3 412.603 4.214 20 0 HIADHN C[C@H](NC(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C)c1nc(C(F)(F)F)cs1 ZINC000426238909 856195047 /nfs/dbraw/zinc/19/50/47/856195047.db2.gz MJZKBJMKFNHNRC-IPYPFGDCSA-N 0 3 412.481 4.043 20 0 HIADHN COc1cccc([C@@H](CNC(=O)N[C@@H]2CCOC3(CCCCC3)C2)N2CCCC2)c1 ZINC000426242394 856197842 /nfs/dbraw/zinc/19/78/42/856197842.db2.gz XEKHCSQEUSFVPB-IFMALSPDSA-N 0 3 415.578 4.013 20 0 HIADHN Cc1ccc(NC(=O)Nc2cccc3c2CCN(C(=O)[C@H](C(C)C)N(C)C)C3)cc1 ZINC000426356496 856257991 /nfs/dbraw/zinc/25/79/91/856257991.db2.gz KQXWIMICUGFOKM-QFIPXVFZSA-N 0 3 408.546 4.110 20 0 HIADHN Fc1ccc(CN(Cc2cnc3ccc(Br)cn23)C2CCOCC2)cc1 ZINC000426371173 856263286 /nfs/dbraw/zinc/26/32/86/856263286.db2.gz JQIONTXKWKMVRU-UHFFFAOYSA-N 0 3 418.310 4.417 20 0 HIADHN CCOc1cc(CN2CCS[C@@H](C)CC2)ccc1OCC(=O)Nc1ccccc1 ZINC000426377867 856266013 /nfs/dbraw/zinc/26/60/13/856266013.db2.gz JQWCFNYFEVATGS-SFHVURJKSA-N 0 3 414.571 4.430 20 0 HIADHN CC(C)(C)N1C[C@@H](c2nc(CCn3cnc4ccccc43)no2)[C@H](C(F)(F)F)C1 ZINC000426407299 856278130 /nfs/dbraw/zinc/27/81/30/856278130.db2.gz UOHRIEPFCNDMQG-ZIAGYGMSSA-N 0 3 407.440 4.038 20 0 HIADHN C[C@@H](CCCOc1ccccc1C(N)=O)N[C@@H](C)c1nc(C(F)(F)F)cs1 ZINC000426528666 856335074 /nfs/dbraw/zinc/33/50/74/856335074.db2.gz GIZOGHJFXPBDHG-RYUDHWBXSA-N 0 3 401.454 4.159 20 0 HIADHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)N[C@@H]1CCCC(F)(F)C1 ZINC000426623315 856378840 /nfs/dbraw/zinc/37/88/40/856378840.db2.gz MRKPUBGJSKXOCT-MRXNPFEDSA-N 0 3 418.326 4.100 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3ccc(C(F)(F)F)cc3)CC2)C[C@@H](C)O1 ZINC000426640074 856389584 /nfs/dbraw/zinc/38/95/84/856389584.db2.gz ZQJGHECAUUQIMX-HZPDHXFCSA-N 0 3 413.484 4.449 20 0 HIADHN C[C@H](NC(=O)N(CCN(C)C)Cc1cccs1)c1nc(C(F)(F)F)cs1 ZINC000426897597 856531709 /nfs/dbraw/zinc/53/17/09/856531709.db2.gz HCNOZGORUSEALP-NSHDSACASA-N 0 3 406.499 4.058 20 0 HIADHN C[C@H](NC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1)c1nc(C(F)(F)F)cs1 ZINC000426901929 856534473 /nfs/dbraw/zinc/53/44/73/856534473.db2.gz YTDOLOPRFGLEAA-ZFWWWQNUSA-N 0 3 412.481 4.139 20 0 HIADHN CN1CC[C@@H](NC(=O)c2cc3ccccc3n2CC(F)(F)F)[C@H]1c1ccccc1 ZINC000426973320 856571367 /nfs/dbraw/zinc/57/13/67/856571367.db2.gz RVGDMQLHQQTPOI-YLJYHZDGSA-N 0 3 401.432 4.379 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)c1cc(-c2ccc(C)cc2C)n[nH]1 ZINC000426998969 856587665 /nfs/dbraw/zinc/58/76/65/856587665.db2.gz IOTWRISUKCGLBM-OAQYLSRUSA-N 0 3 417.557 4.215 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)c3cc(Cl)cc(C(F)(F)F)c3)CC2)C[C@H](C)O1 ZINC000427128131 856656607 /nfs/dbraw/zinc/65/66/07/856656607.db2.gz YURNHJBDFAZKEY-KBPBESRZSA-N 0 3 418.887 4.320 20 0 HIADHN Cc1ccc(C2(C(=O)N3CC[C@@H](C)N(Cc4ccccc4)CC3)CCOCC2)cc1 ZINC000437460783 862823572 /nfs/dbraw/zinc/82/35/72/862823572.db2.gz SBEZXGLGRNIZTQ-JOCHJYFZSA-N 0 3 406.570 4.166 20 0 HIADHN Cc1cccc2c(CCC(=O)N3CCC(CCN4C[C@@H](C)O[C@H](C)C4)CC3)c[nH]c21 ZINC000427291385 856755098 /nfs/dbraw/zinc/75/50/98/856755098.db2.gz FUEBQNNAHIXZPK-WOJBJXKFSA-N 0 3 411.590 4.147 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3cccc(-c4cscn4)c3)CC2)C[C@H](C)O1 ZINC000427294384 856756129 /nfs/dbraw/zinc/75/61/29/856756129.db2.gz FATPHCFEQCKFQC-HDICACEKSA-N 0 3 413.587 4.162 20 0 HIADHN Cc1c(Br)cccc1C(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000427295904 856757207 /nfs/dbraw/zinc/75/72/07/856757207.db2.gz LUNYJDOTLUZQEF-HZPDHXFCSA-N 0 3 423.395 4.109 20 0 HIADHN Cc1ccc2c(CCC(=O)N3CCC(CCN4C[C@H](C)O[C@@H](C)C4)CC3)c[nH]c2c1 ZINC000427321875 856769692 /nfs/dbraw/zinc/76/96/92/856769692.db2.gz QYLIHIQLXCYHCW-PMACEKPBSA-N 0 3 411.590 4.147 20 0 HIADHN Cc1nc(-c2ccccc2)ccc1C(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000427330948 856774638 /nfs/dbraw/zinc/77/46/38/856774638.db2.gz OBNUPVOJFWSFQO-WOJBJXKFSA-N 0 3 421.585 4.409 20 0 HIADHN CC(C)c1ccc(CCC(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)cc1 ZINC000427332134 856777155 /nfs/dbraw/zinc/77/71/55/856777155.db2.gz SAKZPBKKKRTGRE-NHCUHLMSSA-N 0 3 400.607 4.481 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)CCCCC(=O)c3ccccc3)CC2)C[C@H](C)O1 ZINC000427342122 856781742 /nfs/dbraw/zinc/78/17/42/856781742.db2.gz LHFOKMDMWXCUBU-SFTDATJTSA-N 0 3 414.590 4.168 20 0 HIADHN Cc1cccc(OCCCCC(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)c1 ZINC000427342548 856782225 /nfs/dbraw/zinc/78/22/25/856782225.db2.gz POXPHTPHGWKPNF-VXKWHMMOSA-N 0 3 416.606 4.282 20 0 HIADHN Cc1ccc2[nH]cc(CCC(=O)N3CCC(CCN4C[C@H](C)O[C@@H](C)C4)CC3)c2c1 ZINC000427363583 856795354 /nfs/dbraw/zinc/79/53/54/856795354.db2.gz XCOSMBKWNIOXAN-PMACEKPBSA-N 0 3 411.590 4.147 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3cc(C4CC4)nc4ccccc43)CC2)C[C@@H](C)O1 ZINC000427363697 856795876 /nfs/dbraw/zinc/79/58/76/856795876.db2.gz YGEUTSADTXAHOC-RTBURBONSA-N 0 3 421.585 4.464 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)c3cc(C4CC4)nc4ccccc43)CC2)C[C@H](C)O1 ZINC000427363696 856796309 /nfs/dbraw/zinc/79/63/09/856796309.db2.gz YGEUTSADTXAHOC-OALUTQOASA-N 0 3 421.585 4.464 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(N[C@@H](C)c2ncc(Br)cc2F)CC1 ZINC000427525421 856849688 /nfs/dbraw/zinc/84/96/88/856849688.db2.gz QZMWPARWPGSDGT-UONOGXRCSA-N 0 3 407.331 4.254 20 0 HIADHN C[C@H]1CCN(C(=O)CCCc2nc(-c3cccs3)no2)CCN1Cc1ccccc1 ZINC000437486475 862843363 /nfs/dbraw/zinc/84/33/63/862843363.db2.gz VUFNOUVEDWJJLF-SFHVURJKSA-N 0 3 424.570 4.244 20 0 HIADHN COc1ccc([C@H](CN[C@H](C)c2ncc(Br)cc2F)N2CCCC2)cc1 ZINC000427573546 856872922 /nfs/dbraw/zinc/87/29/22/856872922.db2.gz KEWSCWZAJJIDSC-KUHUBIRLSA-N 0 3 422.342 4.480 20 0 HIADHN O=S(=O)(CCCN[C@@H]1CCCc2ncc(C(F)(F)F)cc21)Cc1ccccc1 ZINC000427595070 856881777 /nfs/dbraw/zinc/88/17/77/856881777.db2.gz SHUVCPMKCQUQRR-GOSISDBHSA-N 0 3 412.477 4.073 20 0 HIADHN COc1ccccc1N1CC[C@@H](CN[C@H](C)c2ncc(Br)cc2F)C1 ZINC000427686480 856908472 /nfs/dbraw/zinc/90/84/72/856908472.db2.gz RGKXFNBQBJLQMX-KGLIPLIRSA-N 0 3 408.315 4.169 20 0 HIADHN CCn1ncc(C(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)c1-c1ccccc1 ZINC000427701243 856915059 /nfs/dbraw/zinc/91/50/59/856915059.db2.gz INSQNQYYBVASQX-UHFFFAOYSA-N 0 3 417.557 4.353 20 0 HIADHN Cc1cc2c(cc1C)[C@@H](NCc1cccc(N3CCCS3(=O)=O)c1)CCS2 ZINC000427840045 856976536 /nfs/dbraw/zinc/97/65/36/856976536.db2.gz FUFRXLUWHJDWDL-FQEVSTJZSA-N 0 3 402.585 4.170 20 0 HIADHN CC(C)n1ncc2cc(S(=O)(=O)NCC(C)(C)N[C@H](C)c3ccccc3)ccc21 ZINC000427845197 856979032 /nfs/dbraw/zinc/97/90/32/856979032.db2.gz PFROZXQBGBIVJL-QGZVFWFLSA-N 0 3 414.575 4.025 20 0 HIADHN C[C@H](CS(=O)(=O)N(C)[C@@H]1CCN(Cc2ccccc2)[C@H](C)C1)c1ccccc1 ZINC000427847602 856980008 /nfs/dbraw/zinc/98/00/08/856980008.db2.gz AMPSPOLDHMHRSC-TXTKFYIRSA-N 0 3 400.588 4.105 20 0 HIADHN CO[C@@H](C)c1nc(CN2CCCN(CCCOc3ccccc3C)CC2)cs1 ZINC000437523772 862866352 /nfs/dbraw/zinc/86/63/52/862866352.db2.gz ISXUUJDHUYUKEX-IBGZPJMESA-N 0 3 403.592 4.136 20 0 HIADHN COc1cc(Cl)c(Br)cc1C(=O)N(CCN(C)C)C1CCCC1 ZINC000428498476 857227870 /nfs/dbraw/zinc/22/78/70/857227870.db2.gz KQWGFQHACGUDQQ-UHFFFAOYSA-N 0 3 403.748 4.058 20 0 HIADHN Cc1ccccc1COc1ccccc1C(=O)Nc1cccc(CN2CC[C@@H](O)C2)c1 ZINC000428529418 857242694 /nfs/dbraw/zinc/24/26/94/857242694.db2.gz HCMQVCJRJKNCNR-HSZRJFAPSA-N 0 3 416.521 4.393 20 0 HIADHN COCCS(=O)(=O)c1ccc(CNCc2ccc(-c3ccc(F)cc3)s2)cc1 ZINC000428532614 857245386 /nfs/dbraw/zinc/24/53/86/857245386.db2.gz CDCWSEBYWXSNKP-UHFFFAOYSA-N 0 3 419.543 4.264 20 0 HIADHN O=C(CSc1cc(Cl)ccc1Cl)Nc1cccc(CN2CC[C@@H](O)C2)c1 ZINC000428539154 857251840 /nfs/dbraw/zinc/25/18/40/857251840.db2.gz PJKRDKALMPPGRK-MRXNPFEDSA-N 0 3 411.354 4.291 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@@H](O)C2)c1)C1(Cc2ccc(C(F)(F)F)cc2)CC1 ZINC000428542473 857254447 /nfs/dbraw/zinc/25/44/47/857254447.db2.gz FVPPRCPIMBNZQO-HXUWFJFHSA-N 0 3 418.459 4.233 20 0 HIADHN CC(C)COc1ccc(C(C)(C)C(=O)Nc2cccc(CN3CC[C@H](O)C3)c2)cc1 ZINC000428546222 857256323 /nfs/dbraw/zinc/25/63/23/857256323.db2.gz WYTDECBUFLKAEI-QFIPXVFZSA-N 0 3 410.558 4.204 20 0 HIADHN COc1cccc(Nc2ccccc2C(=O)Nc2cccc(CN3CC[C@H](O)C3)c2)c1 ZINC000428548120 857258305 /nfs/dbraw/zinc/25/83/05/857258305.db2.gz NMSNQKPPLMKCMC-NRFANRHFSA-N 0 3 417.509 4.258 20 0 HIADHN COc1ccccc1Nc1ccccc1C(=O)Nc1cccc(CN2CC[C@H](O)C2)c1 ZINC000428553724 857261754 /nfs/dbraw/zinc/26/17/54/857261754.db2.gz PMSPFFKXEICRFH-FQEVSTJZSA-N 0 3 417.509 4.258 20 0 HIADHN C[C@H](NC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1)c1nc(C(F)(F)F)cs1 ZINC000428624111 857281621 /nfs/dbraw/zinc/28/16/21/857281621.db2.gz IQYKIUQSFNVGFD-GXTWGEPZSA-N 0 3 415.456 4.390 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)Nc2cccc(COC(C)(C)CC)c2C)CC1 ZINC000428768920 857327491 /nfs/dbraw/zinc/32/74/91/857327491.db2.gz BKTFVGVQBBVKHI-LJQANCHMSA-N 0 3 418.626 4.095 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)NCC(C)(C)c3ccc(F)cc3)CC2)C[C@@H](C)O1 ZINC000428830321 857364454 /nfs/dbraw/zinc/36/44/54/857364454.db2.gz RMUHLCGTMAKDJC-RTBURBONSA-N 0 3 419.585 4.024 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3ccccc3OCC3CC3)CC2)C[C@@H](C)O1 ZINC000428902165 857402453 /nfs/dbraw/zinc/40/24/53/857402453.db2.gz SQAVHHVSDRKXFA-RTBURBONSA-N 0 3 415.578 4.219 20 0 HIADHN CCc1nc(C)c(CN2CCCC3(CCCN(Cc4oc(CC)nc4C)C3)C2)o1 ZINC000428956673 857435352 /nfs/dbraw/zinc/43/53/52/857435352.db2.gz OQQCHOGMUOXXTB-UHFFFAOYSA-N 0 3 400.567 4.282 20 0 HIADHN Cc1nc2ccc(NC(=O)NC[C@H]3CN(Cc4ccccc4)CCCO3)cc2s1 ZINC000429038538 857470085 /nfs/dbraw/zinc/47/00/85/857470085.db2.gz CAXQXLRXIKLILP-IBGZPJMESA-N 0 3 410.543 4.017 20 0 HIADHN CC(C)COc1ccccc1NC(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000429044722 857473133 /nfs/dbraw/zinc/47/31/33/857473133.db2.gz DSLIIKKZIGRJLS-BGYRXZFFSA-N 0 3 417.594 4.465 20 0 HIADHN COc1c(Cl)cccc1NC(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000429044252 857473472 /nfs/dbraw/zinc/47/34/72/857473472.db2.gz JFEUETUCRXQKLT-HZPDHXFCSA-N 0 3 409.958 4.092 20 0 HIADHN Cc1cc(-c2cc(C(=O)N[C@@H]3C[C@@H](C)N(C4CC4)C3)c3c(C)noc3n2)c(C)s1 ZINC000429047163 857474323 /nfs/dbraw/zinc/47/43/23/857474323.db2.gz OVCOXLSJVMGIPM-IAQYHMDHSA-N 0 3 410.543 4.232 20 0 HIADHN CC(C)N(Cc1cccc(F)c1)C(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000429048803 857475696 /nfs/dbraw/zinc/47/56/96/857475696.db2.gz SXWSWMFLODEGOZ-QHCPKHFHSA-N 0 3 413.537 4.037 20 0 HIADHN COc1ccc(C2=NN(C(=O)CN(C3CCC3)C3CCC3)[C@@H](c3ccco3)C2)cc1 ZINC000429170863 857539226 /nfs/dbraw/zinc/53/92/26/857539226.db2.gz MAGJUTDSGMXNCS-JOCHJYFZSA-N 0 3 407.514 4.373 20 0 HIADHN CC(C)[C@H](NC(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1)c1ccccc1 ZINC000429172966 857540502 /nfs/dbraw/zinc/54/05/02/857540502.db2.gz SWNSRVFUMRIMGR-VIZSFHNOSA-N 0 3 401.595 4.305 20 0 HIADHN CCCn1ccnc1CCCN(C)CC(=O)N(C)Cc1ccc(Cl)c(Cl)c1 ZINC000429244297 857570002 /nfs/dbraw/zinc/57/00/02/857570002.db2.gz KBSIIOMADARSPG-UHFFFAOYSA-N 0 3 411.377 4.123 20 0 HIADHN C[C@H]1CN(c2cccc(F)c2)CCN1CCC(=O)Nc1ccccc1C(F)(F)F ZINC000429242374 857570320 /nfs/dbraw/zinc/57/03/20/857570320.db2.gz SQBQZZDQUPRDKW-HNNXBMFYSA-N 0 3 409.427 4.384 20 0 HIADHN CCCn1ccnc1CCCN(C)CC(=O)Nc1c(Cl)cccc1C(F)(F)F ZINC000429255084 857576647 /nfs/dbraw/zinc/57/66/47/857576647.db2.gz OVPSSOJVYFTULZ-UHFFFAOYSA-N 0 3 416.875 4.468 20 0 HIADHN Cc1nn(C)c(C)c1NC(=O)[C@@H](C)N[C@@H]1c2cc(Br)ccc2CC1(C)C ZINC000429296940 857594649 /nfs/dbraw/zinc/59/46/49/857594649.db2.gz TVWHAKPWALLDNM-KZULUSFZSA-N 0 3 419.367 4.040 20 0 HIADHN FC(F)(F)Cn1nnnc1CN[C@@H]1CCCCC[C@@H]1c1ccccc1C(F)(F)F ZINC000429328467 857604662 /nfs/dbraw/zinc/60/46/62/857604662.db2.gz JCXCMYSOWJPRIP-UKRRQHHQSA-N 0 3 421.389 4.460 20 0 HIADHN Fc1ccc([C@H](NC[C@@H]2CN(Cc3ccccc3)CCCO2)c2ccccc2)nc1 ZINC000429413955 857653259 /nfs/dbraw/zinc/65/32/59/857653259.db2.gz AQPHMVFXDNSUOQ-ILBGXUMGSA-N 0 3 405.517 4.191 20 0 HIADHN CC(C)c1ccccc1NC(=O)C[C@H](C)NCc1ccc(S(C)(=O)=O)c(Cl)c1 ZINC000429421083 857657821 /nfs/dbraw/zinc/65/78/21/857657821.db2.gz UMMOYIOBBIOUNK-HNNXBMFYSA-N 0 3 422.978 4.374 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)N(Cc2ccccc2)[C@H]2CCCC2(C)C)CC1 ZINC000429426386 857661143 /nfs/dbraw/zinc/66/11/43/857661143.db2.gz FTXPBWSSCSUMKD-GMAHTHKFSA-N 0 3 414.638 4.051 20 0 HIADHN COCCS(=O)(=O)c1ccc(CN[C@H](C)c2ccc(OC)c3ccccc32)cc1 ZINC000429437665 857668849 /nfs/dbraw/zinc/66/88/49/857668849.db2.gz ZCJLVBNAVQBOCZ-QGZVFWFLSA-N 0 3 413.539 4.119 20 0 HIADHN Cc1cc([C@H](NC[C@@H]2CN(Cc3ccccc3)CCCO2)c2cccnc2)ccc1F ZINC000429439082 857668929 /nfs/dbraw/zinc/66/89/29/857668929.db2.gz ARFVGESDZPPRBC-RSXGOPAZSA-N 0 3 419.544 4.499 20 0 HIADHN CC(C)(C)[C@H](CN1CCc2ccccc2C1)NC(=O)N1CCCC[C@H]1c1ncc[nH]1 ZINC000429499680 857699445 /nfs/dbraw/zinc/69/94/45/857699445.db2.gz UHOOMLRFOXRCJZ-SFTDATJTSA-N 0 3 409.578 4.119 20 0 HIADHN Cc1noc(C[C@H](NCCOc2cc(F)cc(Br)c2)c2ccccc2)n1 ZINC000429540109 857732552 /nfs/dbraw/zinc/73/25/52/857732552.db2.gz LNRHXKQSZZQSKA-SFHVURJKSA-N 0 3 420.282 4.232 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)Nc2ccnn2Cc2ccc(F)cc2)C1 ZINC000429597348 857779508 /nfs/dbraw/zinc/77/95/08/857779508.db2.gz MUCSFKGNQXLKLM-DYESRHJHSA-N 0 3 407.493 4.028 20 0 HIADHN O=C(NC[C@H]1CN(Cc2ccccc2)CCCO1)Nc1ccc(C(=O)C2CCC2)cc1 ZINC000429622536 857802762 /nfs/dbraw/zinc/80/27/62/857802762.db2.gz XROMZDXLHDHODB-QHCPKHFHSA-N 0 3 421.541 4.082 20 0 HIADHN COc1ccc([C@H](NC[C@H]2CN(Cc3ccccc3)CCCO2)C(F)(F)F)cc1 ZINC000429684821 857833442 /nfs/dbraw/zinc/83/34/42/857833442.db2.gz LEDHCKFWHPEZSG-SFTDATJTSA-N 0 3 408.464 4.179 20 0 HIADHN CN(C)[C@H](CNC(=O)Nc1ccnn1Cc1ccc(Cl)c(F)c1)c1ccccc1 ZINC000429696517 857839136 /nfs/dbraw/zinc/83/91/36/857839136.db2.gz IMKKXGCCOQXBQN-LJQANCHMSA-N 0 3 415.900 4.148 20 0 HIADHN CC(C)Oc1ccc(NC(=O)NC[C@@H]2CN(Cc3ccccc3)CCCO2)c(F)c1 ZINC000429734986 857856859 /nfs/dbraw/zinc/85/68/59/857856859.db2.gz KGPSZYHETDUCPE-HXUWFJFHSA-N 0 3 415.509 4.026 20 0 HIADHN CC(C)N1CC[C@@H](N[C@@H](C)C(=O)Nc2nccs2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000429791484 857885967 /nfs/dbraw/zinc/88/59/67/857885967.db2.gz VYBAAHQYDPOZNK-JCURWCKSSA-N 0 3 410.946 4.076 20 0 HIADHN Cc1nc(C(C)C)oc1C(=O)N(CCN(C)C)Cc1ccc(Br)cc1 ZINC000429801521 857889505 /nfs/dbraw/zinc/88/95/05/857889505.db2.gz MFINRTVGOORGBO-UHFFFAOYSA-N 0 3 408.340 4.073 20 0 HIADHN CN(C)C(=O)[C@H](N[C@H]1C[C@H](c2ccc(F)c(Br)c2)C1)c1ccccc1 ZINC000429807946 857891579 /nfs/dbraw/zinc/89/15/79/857891579.db2.gz JUEIKZUZSCLSER-GPMSIDNRSA-N 0 3 405.311 4.253 20 0 HIADHN Cn1c(SC[C@@H]2CN(Cc3ccccc3)CCCO2)nnc1-c1ccc(F)cc1 ZINC000430124358 858042169 /nfs/dbraw/zinc/04/21/69/858042169.db2.gz RBXTXSJQFQAFHR-FQEVSTJZSA-N 0 3 412.534 4.004 20 0 HIADHN CC[C@@H]1CCN1Cc1ccc(OCC(=O)Nc2ccc(Cl)cc2OC)c(OC)c1 ZINC000430205843 858081343 /nfs/dbraw/zinc/08/13/43/858081343.db2.gz NPTISSFYWFBTMW-QGZVFWFLSA-N 0 3 418.921 4.359 20 0 HIADHN COCc1cccc(OCC2(CN3C[C@H](C)O[C@]4(CCO[C@H](C)C4)C3)CCC2)c1 ZINC000430257550 858098289 /nfs/dbraw/zinc/09/82/89/858098289.db2.gz MERHLKYOHHQYJF-NMMYMHLASA-N 0 3 403.563 4.041 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)c2cccc(Br)c2F)cc1 ZINC000430271121 858104095 /nfs/dbraw/zinc/10/40/95/858104095.db2.gz WSXCHHZGEUFSBD-SFHVURJKSA-N 0 3 421.310 4.164 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)N[C@H](CC3CC3)c3cc(F)cc(Br)c3)[C@H]2C1 ZINC000430298934 858113427 /nfs/dbraw/zinc/11/34/27/858113427.db2.gz GXOKUJUOCFVAIN-ZMYBRWDISA-N 0 3 424.358 4.165 20 0 HIADHN O=C([C@H]1CCCN(Cc2cccc(F)c2)C1)N1CCC(c2ncccc2Cl)CC1 ZINC000430505555 858203989 /nfs/dbraw/zinc/20/39/89/858203989.db2.gz QXJZQBLCCPQKPW-IBGZPJMESA-N 0 3 415.940 4.492 20 0 HIADHN Cc1ccc([C@H](N[C@H](C)c2ccc(Br)c(S(N)(=O)=O)c2)C2CC2)cc1 ZINC000430701447 858272905 /nfs/dbraw/zinc/27/29/05/858272905.db2.gz VVBWBLHUWBYVPR-YJYMSZOUSA-N 0 3 423.376 4.207 20 0 HIADHN Cc1cccc([C@@H](C)N[C@H](C)c2ccc(Br)c(S(N)(=O)=O)c2)c1C ZINC000430719958 858277835 /nfs/dbraw/zinc/27/78/35/858277835.db2.gz LIVLBEYBFMUSQC-ZIAGYGMSSA-N 0 3 411.365 4.125 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)cc1CN1CC[C@H](C(=O)N(C)c2ccccc2)C1 ZINC000430864262 858342516 /nfs/dbraw/zinc/34/25/16/858342516.db2.gz JSHGMAFMVGEJJB-SFHVURJKSA-N 0 3 408.933 4.319 20 0 HIADHN CCN(CC)[C@H](CN1C(=O)N[C@H](c2ccc(OC(F)F)cc2)C1=O)c1ccsc1 ZINC000430869010 858346914 /nfs/dbraw/zinc/34/69/14/858346914.db2.gz PAHOEVALSYFMQW-IAGOWNOFSA-N 0 3 423.485 4.026 20 0 HIADHN CCn1ccnc1[C@@H]1CCCCN1C(=O)N[C@H](CN(C)Cc1ccccc1)C(C)C ZINC000430895350 858359000 /nfs/dbraw/zinc/35/90/00/858359000.db2.gz UBOIKWLLZUJCHR-YADHBBJMSA-N 0 3 411.594 4.296 20 0 HIADHN CCn1ccnc1[C@@H]1CCCCN1C(=O)N[C@@H](CN(C)Cc1ccccc1)C(C)C ZINC000430895349 858359015 /nfs/dbraw/zinc/35/90/15/858359015.db2.gz UBOIKWLLZUJCHR-VXKWHMMOSA-N 0 3 411.594 4.296 20 0 HIADHN O=C1CN(Cc2ccc(Cl)cc2)C(=O)N1C[C@H](c1cccs1)N1CCCC1 ZINC000430969517 858386172 /nfs/dbraw/zinc/38/61/72/858386172.db2.gz DGKJJWMMGXIWFL-QGZVFWFLSA-N 0 3 403.935 4.003 20 0 HIADHN O=C1[C@@H]2C[C@H](C3CCCCC3)CN2C(=O)N1C[C@@H](c1cccs1)N1CCCC1 ZINC000430976859 858388732 /nfs/dbraw/zinc/38/87/32/858388732.db2.gz UIJFCPMVAYAQMJ-FHWLQOOXSA-N 0 3 401.576 4.118 20 0 HIADHN CC[C@H](c1ccccc1)N1CC(=O)N(C[C@@H](c2ccc(OC)cc2)N2CCCC2)C1=O ZINC000430980822 858390350 /nfs/dbraw/zinc/39/03/50/858390350.db2.gz UOSRAFIIFKXNLZ-PKTZIBPZSA-N 0 3 421.541 4.248 20 0 HIADHN O=C1N[C@H](C[C@@H]2CCCc3ccccc32)C(=O)N1C[C@H](c1cccs1)N1CCCC1 ZINC000430979101 858390388 /nfs/dbraw/zinc/39/03/88/858390388.db2.gz TUNRGQJEQZZXKN-CEWLAPEOSA-N 0 3 423.582 4.316 20 0 HIADHN Cc1cc(Cl)cc2c1OCCC[C@@H]2NCc1cccc(CN2CCOCC2)c1 ZINC000431325061 858566064 /nfs/dbraw/zinc/56/60/64/858566064.db2.gz YZWRMGBSZKDKBE-QFIPXVFZSA-N 0 3 400.950 4.484 20 0 HIADHN CCN1CCN(Cc2ccc(CNC(=O)c3c(Cl)cc(F)cc3Cl)cc2)CC1 ZINC000431493268 858642694 /nfs/dbraw/zinc/64/26/94/858642694.db2.gz HRVXPYPHUVXZBF-UHFFFAOYSA-N 0 3 424.347 4.200 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N[C@H]3C[C@H](c4ccc(F)cc4)C3)c(C)c2)CC1 ZINC000431717044 858758341 /nfs/dbraw/zinc/75/83/41/858758341.db2.gz DHDOWAVOEQZMDZ-XUTJKUGGSA-N 0 3 410.537 4.344 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(-c2cc[nH]n2)s1 ZINC000431926067 858872939 /nfs/dbraw/zinc/87/29/39/858872939.db2.gz NYLVMCOBPONBMX-QGZVFWFLSA-N 0 3 418.526 4.034 20 0 HIADHN Cc1cc(C)c(NC(=O)NC2CCN(CCOC(C)C)CC2)c(Br)c1 ZINC000431961239 858889088 /nfs/dbraw/zinc/88/90/88/858889088.db2.gz UAOXPXYOWCELKB-UHFFFAOYSA-N 0 3 412.372 4.077 20 0 HIADHN COC(=O)[C@@H](C)Oc1ccc(CN2CCC(F)(c3cccc(OC)c3)CC2)cc1 ZINC000467540771 881362956 /nfs/dbraw/zinc/36/29/56/881362956.db2.gz CWSMJAQZGUSKOI-QGZVFWFLSA-N 0 3 401.478 4.096 20 0 HIADHN O=C(C1CCC(NCc2ccc(F)c(Cl)c2Cl)CC1)N1CCSCC1 ZINC000432236364 859061126 /nfs/dbraw/zinc/06/11/26/859061126.db2.gz TVNKRHPYDNHJRN-UHFFFAOYSA-N 0 3 405.366 4.356 20 0 HIADHN CCCN(C(=O)NCc1ccc2c(c1)COC2)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000432491635 859190996 /nfs/dbraw/zinc/19/09/96/859190996.db2.gz CYGWZUBCIQOUCX-XMMPIXPASA-N 0 3 407.558 4.303 20 0 HIADHN CC1CCN([C@H](CNC(=O)NCCC[C@H]2CCCC[C@H]2O)c2cccs2)CC1 ZINC000432555678 859225282 /nfs/dbraw/zinc/22/52/82/859225282.db2.gz NFKJEYKPWRVQMC-VAMGGRTRSA-N 0 3 407.624 4.152 20 0 HIADHN Cc1ccc(-c2ccc(C)c(NC(=O)N3CC[C@H](N4CCN(C)CC4)[C@H](C)C3)c2)o1 ZINC000432992952 859468460 /nfs/dbraw/zinc/46/84/60/859468460.db2.gz KXDGCBFOAWQTDR-GCJKJVERSA-N 0 3 410.562 4.053 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@H](C)SCCN(C)Cc2ccccc2)cc1F ZINC000433033479 859490978 /nfs/dbraw/zinc/49/09/78/859490978.db2.gz VYFLPVOHWOTZBM-KRWDZBQOSA-N 0 3 404.551 4.046 20 0 HIADHN C/C=C/c1ccc(OC[C@H](O)CN2CCC(c3ncc(C)s3)CC2)c(OC)c1 ZINC000433146957 859540724 /nfs/dbraw/zinc/54/07/24/859540724.db2.gz BSDMWHWPXODWFR-VZSQWMKGSA-N 0 3 402.560 4.113 20 0 HIADHN CCOc1ccc(OCCN2CCC(c3nc(-c4ccccc4OC)no3)CC2)cc1 ZINC000433148656 859541365 /nfs/dbraw/zinc/54/13/65/859541365.db2.gz RSAMBPOOHBPYDV-UHFFFAOYSA-N 0 3 423.513 4.402 20 0 HIADHN Cc1ccc([C@H](CNC(=O)C2(Cc3cccc(F)c3)CCOCC2)N2CCCC2)cc1 ZINC000433250116 859591770 /nfs/dbraw/zinc/59/17/70/859591770.db2.gz YQLYQVYWXZANBP-DEOSSOPVSA-N 0 3 424.560 4.427 20 0 HIADHN Cc1cnc(C2CCN(C(=O)NC[C@H](c3ccc(C)cc3)N3CCCC3)CC2)s1 ZINC000433337558 859652488 /nfs/dbraw/zinc/65/24/88/859652488.db2.gz SNMLSCDTLAPKBR-OAQYLSRUSA-N 0 3 412.603 4.486 20 0 HIADHN Cc1cccc(OC[C@H](O)CN[C@@H](C)c2ccc(OC[C@@H]3CCCCO3)c(F)c2)c1 ZINC000433397126 859675804 /nfs/dbraw/zinc/67/58/04/859675804.db2.gz IHPOQKKGOPEGOZ-DWLFOUALSA-N 0 3 417.521 4.173 20 0 HIADHN COc1ccc([C@H](CNC(=O)Nc2c3c(ccc2Cl)OCC3)N2CCCC2)cc1 ZINC000433478197 859720907 /nfs/dbraw/zinc/72/09/07/859720907.db2.gz QPYGYOLSOWTWFW-IBGZPJMESA-N 0 3 415.921 4.242 20 0 HIADHN COc1cc(NC(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)ccc1Cl ZINC000433637695 859819801 /nfs/dbraw/zinc/81/98/01/859819801.db2.gz GAHFLUMUMKEUFU-HOTGVXAUSA-N 0 3 409.958 4.092 20 0 HIADHN CCNC(=O)Nc1cccc(NC(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)c1C ZINC000433747336 859873024 /nfs/dbraw/zinc/87/30/24/859873024.db2.gz LOUIDCHKTIWGTG-SFHVURJKSA-N 0 3 423.561 4.265 20 0 HIADHN CCN(C(=O)Nc1ccc(F)cc1-c1cnn(C)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000433781493 859890760 /nfs/dbraw/zinc/89/07/60/859890760.db2.gz WZQFMTXIWMOJEG-OAQYLSRUSA-N 0 3 421.520 4.355 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)Nc2ccc(F)cc2-c2cnn(C)c2)CN1Cc1ccccc1 ZINC000433803524 859900597 /nfs/dbraw/zinc/90/05/97/859900597.db2.gz UPZSFMUQFQQPQK-OXQOHEQNSA-N 0 3 407.493 4.011 20 0 HIADHN CC[C@@H](CNC(=O)c1ccc(-c2nc(C3CC3)no2)cc1)N1CCc2ccccc2C1 ZINC000433864416 859941000 /nfs/dbraw/zinc/94/10/00/859941000.db2.gz JVAOFTNSOKGYRM-QFIPXVFZSA-N 0 3 416.525 4.181 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1noc2c1C[C@@H](C)CC2 ZINC000433865195 859941816 /nfs/dbraw/zinc/94/18/16/859941816.db2.gz OPKIHYJNSTZOOA-LPHOPBHVSA-N 0 3 419.529 4.004 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1noc2c1C[C@H](C)CC2 ZINC000433865194 859942163 /nfs/dbraw/zinc/94/21/63/859942163.db2.gz OPKIHYJNSTZOOA-APWZRJJASA-N 0 3 419.529 4.004 20 0 HIADHN COc1ccccc1-c1ccc([C@H](C)NS(=O)(=O)c2ccc(CN(C)C)cc2)cc1 ZINC000433874873 859947274 /nfs/dbraw/zinc/94/72/74/859947274.db2.gz MWMXFVAXMIJNAZ-SFHVURJKSA-N 0 3 424.566 4.463 20 0 HIADHN CC(C)n1ncc2c1nc(C1CC1)cc2C(=O)N[C@@H]1C[C@@H](C)N(Cc2ccccc2)C1 ZINC000467690542 881484304 /nfs/dbraw/zinc/48/43/04/881484304.db2.gz GNPCXJCBELVTLD-YLJYHZDGSA-N 0 3 417.557 4.282 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)c2cc(-c3ccc4c(c3)CCO4)no2)CC1 ZINC000434035992 860054844 /nfs/dbraw/zinc/05/48/44/860054844.db2.gz KKXROBXIHPNTCF-UHFFFAOYSA-N 0 3 417.509 4.013 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2cccc(-c3noc(C4CC4)n3)c2)N(C)C)cc1 ZINC000434055199 860068380 /nfs/dbraw/zinc/06/83/80/860068380.db2.gz YAZRKZCUSPROSX-HXUWFJFHSA-N 0 3 405.502 4.347 20 0 HIADHN C[C@H]1C[C@H](NC(=O)CCCc2ncc(-c3ccccc3)o2)CN1Cc1ccccc1 ZINC000467701302 881496902 /nfs/dbraw/zinc/49/69/02/881496902.db2.gz TYVAUWUISWIKSZ-UGKGYDQZSA-N 0 3 403.526 4.444 20 0 HIADHN C[C@@H](CNC(=O)Nc1cccc(-c2noc(C3CC3)n2)c1)N(C)Cc1ccccc1 ZINC000434067127 860076442 /nfs/dbraw/zinc/07/64/42/860076442.db2.gz TZQLWDUFDAYGAD-INIZCTEOSA-N 0 3 405.502 4.256 20 0 HIADHN Cc1c(C2CC2)nc2ccc(Br)cc2c1C(=O)N[C@H]1CCN(C2CC2)C1 ZINC000434197771 860184838 /nfs/dbraw/zinc/18/48/38/860184838.db2.gz SFNVQCYHLYEZIX-HNNXBMFYSA-N 0 3 414.347 4.150 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)COc1cc(C)ccc1C ZINC000434312593 860273006 /nfs/dbraw/zinc/27/30/06/860273006.db2.gz NTCWVXIOOIQTGW-JOCHJYFZSA-N 0 3 418.541 4.273 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)Cc1cccc(F)c1F ZINC000434319994 860279879 /nfs/dbraw/zinc/27/98/79/860279879.db2.gz XVJCKVBQVHUDFH-IBGZPJMESA-N 0 3 410.468 4.098 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)[C@@H](C)Oc1ccc(F)cc1 ZINC000434323435 860284393 /nfs/dbraw/zinc/28/43/93/860284393.db2.gz JBZSWNKGVZCOKV-WIYYLYMNSA-N 0 3 422.504 4.184 20 0 HIADHN COCc1cccc(C(=O)Nc2c(C)cnn2[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000434324333 860286353 /nfs/dbraw/zinc/28/63/53/860286353.db2.gz DOLSBUNKOQAOKV-QFIPXVFZSA-N 0 3 404.514 4.037 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1cncc2ccccc21 ZINC000434336904 860299239 /nfs/dbraw/zinc/29/92/39/860299239.db2.gz RPRDLBPIPYTYOQ-NRFANRHFSA-N 0 3 411.509 4.439 20 0 HIADHN O=C(NC[C@@H]1CCCCN1C1CC1)N(Cc1cccc(-c2cccnc2)c1)C1CC1 ZINC000434354976 860307597 /nfs/dbraw/zinc/30/75/97/860307597.db2.gz LEIQWOYXXVKVGK-DEOSSOPVSA-N 0 3 404.558 4.440 20 0 HIADHN O=C(NCc1nccn1CCCc1ccccc1)c1cccc(CN2CCCC2)c1 ZINC000434375193 860320803 /nfs/dbraw/zinc/32/08/03/860320803.db2.gz WHRTWFONASKPDK-UHFFFAOYSA-N 0 3 402.542 4.042 20 0 HIADHN O=C(NC[C@@H]1CCCCN1C1CC1)c1ccccc1SCc1cn2ccccc2n1 ZINC000434443518 860354451 /nfs/dbraw/zinc/35/44/51/860354451.db2.gz ZQHBYDZZXCEMKW-FQEVSTJZSA-N 0 3 420.582 4.373 20 0 HIADHN Cc1ncsc1CN(C)C[C@H]1CCN(Cc2sccc2Br)C1 ZINC000434494918 860371874 /nfs/dbraw/zinc/37/18/74/860371874.db2.gz QNSCLQCKAOJGOH-CYBMUJFWSA-N 0 3 400.411 4.229 20 0 HIADHN CCCC(O)(CCC)CC(=O)Nc1c(C)cnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000434549184 860396000 /nfs/dbraw/zinc/39/60/00/860396000.db2.gz MUXFVBKVMIWMJW-NRFANRHFSA-N 0 3 412.578 4.298 20 0 HIADHN CSC1(CNC(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)CCC1 ZINC000434550961 860397116 /nfs/dbraw/zinc/39/71/16/860397116.db2.gz YRGUNNIJJHRKER-UHFFFAOYSA-N 0 3 403.514 4.064 20 0 HIADHN CCOc1ccccc1CN(C)CCC(=O)Nc1cc(OC)c(Cl)cc1OC ZINC000434609609 860427179 /nfs/dbraw/zinc/42/71/79/860427179.db2.gz XDZQGIJJXJEXPK-UHFFFAOYSA-N 0 3 406.910 4.217 20 0 HIADHN CCC[C@H](NC(=O)[C@H](C)N1CCC(c2ncc3n2CCCC3)CC1)c1ccccc1 ZINC000434682735 860458040 /nfs/dbraw/zinc/45/80/40/860458040.db2.gz DFHDROYPDFVLRB-CVDCTZTESA-N 0 3 408.590 4.445 20 0 HIADHN O=C(c1cccc(CN2CCC(c3ncc4n3CCCC4)CC2)c1)N1CCCCC1 ZINC000434690696 860463127 /nfs/dbraw/zinc/46/31/27/860463127.db2.gz JIMPSWMAIXTFBE-UHFFFAOYSA-N 0 3 406.574 4.225 20 0 HIADHN Brc1cc(CN2CCC(c3ncc4n3CCCC4)CC2)cc2c1OCO2 ZINC000434690849 860464536 /nfs/dbraw/zinc/46/45/36/860464536.db2.gz KURNIUXXCKIGAM-UHFFFAOYSA-N 0 3 418.335 4.090 20 0 HIADHN O[C@H](COc1cc(Cl)ccc1Cl)CN1CCC(c2ncc3n2CCCC3)CC1 ZINC000434752673 860482337 /nfs/dbraw/zinc/48/23/37/860482337.db2.gz CLKYKMLEUINUAC-SFHVURJKSA-N 0 3 424.372 4.146 20 0 HIADHN Cc1c(F)cccc1NC(=O)CCN(C)[C@H]1c2cc(Cl)cc(Cl)c2C[C@@H]1O ZINC000434782247 860493718 /nfs/dbraw/zinc/49/37/18/860493718.db2.gz HXYYVPBPOKLSOD-ICSRJNTNSA-N 0 3 411.304 4.360 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)CCCc2ccc(Cl)c(Cl)c2)C[C@@H](C)O1 ZINC000434782812 860493822 /nfs/dbraw/zinc/49/38/22/860493822.db2.gz FJORRWVZLBXBNV-HZPDHXFCSA-N 0 3 401.378 4.322 20 0 HIADHN CC(=O)N(c1nc(CNC[C@@H]2CCCCN2C2CC2)cs1)c1ccc(F)cc1 ZINC000434796258 860497746 /nfs/dbraw/zinc/49/77/46/860497746.db2.gz UBJNPQOUGSPHDV-FQEVSTJZSA-N 0 3 402.539 4.073 20 0 HIADHN COc1cc(CCC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)ccc1Cl ZINC000434848950 860521725 /nfs/dbraw/zinc/52/17/25/860521725.db2.gz OVIWHPUICUUPGR-SFHVURJKSA-N 0 3 400.950 4.404 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CNC(=O)CN1CC[C@@H](c2ccccc2)[C@H]1C ZINC000434898222 860543173 /nfs/dbraw/zinc/54/31/73/860543173.db2.gz UKDYCXRULURKJR-HYBUGGRVSA-N 0 3 416.569 4.042 20 0 HIADHN C[C@@H]1[C@H](c2ccccc2)CCN1CC(=O)N1CCC[C@H]1c1ccc2c(c1)OCCCO2 ZINC000434898510 860543602 /nfs/dbraw/zinc/54/36/02/860543602.db2.gz VRDZNMJHULWCPI-PTUXOGIPSA-N 0 3 420.553 4.389 20 0 HIADHN CCN(CC)C(=O)c1cccc(NC(=O)[C@H](C)N2CC[C@H](c3ccccc3)[C@H]2C)c1 ZINC000434901905 860545937 /nfs/dbraw/zinc/54/59/37/860545937.db2.gz FYDAMKSTFBPQBH-MSYCTHLASA-N 0 3 407.558 4.374 20 0 HIADHN CCCCn1ncc(C(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)c1C ZINC000435010153 860595903 /nfs/dbraw/zinc/59/59/03/860595903.db2.gz XHBVPDUXNVMLRE-UHFFFAOYSA-N 0 3 410.484 4.214 20 0 HIADHN CCc1nn(C)c(CC)c1CN1CCC(Nc2cccc(Br)c2)CC1 ZINC000435024925 860604226 /nfs/dbraw/zinc/60/42/26/860604226.db2.gz AUVRXUITGPRZBW-UHFFFAOYSA-N 0 3 405.384 4.384 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1ccn(C(C)C)n1)c1ccc(C(F)(F)F)cc1 ZINC000435076503 860630388 /nfs/dbraw/zinc/63/03/88/860630388.db2.gz ISJDVVYEZROAPI-KRWDZBQOSA-N 0 3 411.472 4.687 20 0 HIADHN Cc1cccc(-c2cc(Cl)ccc2NC(=O)N[C@@H](C)CCN2CCN(C)CC2)c1 ZINC000435175868 860679404 /nfs/dbraw/zinc/67/94/04/860679404.db2.gz DFZSEOWLSKBUMP-SFHVURJKSA-N 0 3 414.981 4.463 20 0 HIADHN CCS[C@@H](C(=O)Nc1cc(C)nn1[C@@H]1CCN(Cc2ccccc2)C1)C(C)C ZINC000435267309 860708331 /nfs/dbraw/zinc/70/83/31/860708331.db2.gz LZEKWBKSVVWRGG-TZIWHRDSSA-N 0 3 400.592 4.355 20 0 HIADHN Cc1cc(C)n([C@@H](C)CC(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435269410 860709472 /nfs/dbraw/zinc/70/94/72/860709472.db2.gz IHCPFTBHYATNLH-RBBKRZOGSA-N 0 3 420.561 4.042 20 0 HIADHN Cc1cc(NC(=O)Cc2ccc(Cl)cc2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435268979 860709782 /nfs/dbraw/zinc/70/97/82/860709782.db2.gz QFWHEMDQHSYKMY-OAQYLSRUSA-N 0 3 408.933 4.473 20 0 HIADHN CC[C@@H](C)c1cc(C(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)on1 ZINC000435270311 860710438 /nfs/dbraw/zinc/71/04/38/860710438.db2.gz KQIWWQGDNUWOLS-APWZRJJASA-N 0 3 407.518 4.392 20 0 HIADHN COc1ccc(C)cc1CC(=O)Nc1cc(C)nn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435271409 860710457 /nfs/dbraw/zinc/71/04/57/860710457.db2.gz NRBQJIQJRRUWFK-QFIPXVFZSA-N 0 3 418.541 4.137 20 0 HIADHN Cc1cc(NC(=O)[C@H](C)COc2ccccc2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435277045 860713812 /nfs/dbraw/zinc/71/38/12/860713812.db2.gz IKPKWIZSQZYPAR-KNQAVFIVSA-N 0 3 418.541 4.292 20 0 HIADHN Cc1cc(NC(=O)[C@H]2CCOc3ccccc32)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435277378 860714201 /nfs/dbraw/zinc/71/42/01/860714201.db2.gz IZDFEVDZLHHJQX-UNMCSNQZSA-N 0 3 416.525 4.143 20 0 HIADHN Cc1cc(NC(=O)[C@@H](C)Oc2ccc(C)cc2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435278409 860715418 /nfs/dbraw/zinc/71/54/18/860715418.db2.gz FXGGLXSZMALAKQ-IRLDBZIGSA-N 0 3 418.541 4.353 20 0 HIADHN Cc1cc(NC(=O)c2ccnn2C2CCCC2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435282948 860716831 /nfs/dbraw/zinc/71/68/31/860716831.db2.gz VOXFZQAIETZSPR-NRFANRHFSA-N 0 3 418.545 4.202 20 0 HIADHN CCC(=O)c1ccc(C(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000435293255 860722871 /nfs/dbraw/zinc/72/28/71/860722871.db2.gz WTNKDWJUGDJUKF-JOCHJYFZSA-N 0 3 416.525 4.484 20 0 HIADHN Cc1cc(NC(=O)[C@H](C)Oc2ccccc2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435298294 860726036 /nfs/dbraw/zinc/72/60/36/860726036.db2.gz XYVWXGAIWVLYKN-FPOVZHCZSA-N 0 3 404.514 4.045 20 0 HIADHN Cc1cc(NC(=O)Cc2c(F)cccc2F)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435299385 860726663 /nfs/dbraw/zinc/72/66/63/860726663.db2.gz OTVIZAGLDZCDLV-SFHVURJKSA-N 0 3 410.468 4.098 20 0 HIADHN COc1ccccc1CCC(=O)Nc1cc(C)nn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435301765 860727566 /nfs/dbraw/zinc/72/75/66/860727566.db2.gz ZTIPIIDBFLLBDY-JOCHJYFZSA-N 0 3 418.541 4.218 20 0 HIADHN CCC(CC)n1nccc1C(=O)Nc1cc(C)nn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435303092 860728446 /nfs/dbraw/zinc/72/84/46/860728446.db2.gz URGVXZBTKMZNDR-OAQYLSRUSA-N 0 3 420.561 4.448 20 0 HIADHN O=C(Cc1c(F)cccc1Cl)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435370715 860768137 /nfs/dbraw/zinc/76/81/37/860768137.db2.gz QNCPUECKYABXHD-KRWDZBQOSA-N 0 3 412.896 4.304 20 0 HIADHN CC(C)c1ncc(Cl)c(C(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435374043 860771714 /nfs/dbraw/zinc/77/17/14/860771714.db2.gz GULDGMPJERPGSL-KRWDZBQOSA-N 0 3 424.936 4.149 20 0 HIADHN CCSc1ccc(C(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)cn1 ZINC000435375621 860774268 /nfs/dbraw/zinc/77/42/68/860774268.db2.gz VVHQCLKQQDENRJ-LJQANCHMSA-N 0 3 407.543 4.089 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)[C@H]1C[C@@H]1c1cccc(F)c1F ZINC000435381457 860778107 /nfs/dbraw/zinc/77/81/07/860778107.db2.gz TZYKEULKFGNYJX-RLLQIKCJSA-N 0 3 422.479 4.351 20 0 HIADHN Cc1cc([C@H](C)NC(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)ccc1F ZINC000435517916 860834873 /nfs/dbraw/zinc/83/48/73/860834873.db2.gz RUITYYNTIOBZRJ-FHWLQOOXSA-N 0 3 405.558 4.116 20 0 HIADHN Cc1cc(NC(=O)NCc2ccc(C)c(F)c2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435520983 860838868 /nfs/dbraw/zinc/83/88/68/860838868.db2.gz UVKUYXQWDSIILE-NRFANRHFSA-N 0 3 421.520 4.408 20 0 HIADHN Cc1cc(NC(=O)N(C)[C@H](C)c2ccncc2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435521786 860838972 /nfs/dbraw/zinc/83/89/72/860838972.db2.gz YBECLMSXJGYVLU-DENIHFKCSA-N 0 3 418.545 4.258 20 0 HIADHN Cc1cc(NC(=O)NCCCc2ccccc2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435525018 860840858 /nfs/dbraw/zinc/84/08/58/860840858.db2.gz CBQAWJDWRWKCJG-QHCPKHFHSA-N 0 3 417.557 4.393 20 0 HIADHN Cc1cc(NC(=O)N2C[C@@H]3CCCC[C@@H]3C2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435533039 860848006 /nfs/dbraw/zinc/84/80/06/860848006.db2.gz HBFPRVLXOKODNW-BHIFYINESA-N 0 3 407.562 4.292 20 0 HIADHN Cc1cc(NC(=O)N[C@H](C)c2ncc(C)s2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435538879 860851982 /nfs/dbraw/zinc/85/19/82/860851982.db2.gz ZNGQHRWOYZHYEC-IEBWSBKVSA-N 0 3 424.574 4.286 20 0 HIADHN COc1cc(NC(C)=O)ccc1NC(=O)NC[C@@H](c1ccccc1)N1CCC(C)CC1 ZINC000435545651 860859889 /nfs/dbraw/zinc/85/98/89/860859889.db2.gz XIAFGBIBJUCDJJ-QFIPXVFZSA-N 0 3 424.545 4.248 20 0 HIADHN CS[C@H]1CN(C(=O)c2c(C)onc2-c2cccc(Cl)c2Cl)C[C@@H]1N(C)C ZINC000435800598 861069970 /nfs/dbraw/zinc/06/99/70/861069970.db2.gz TWWNHVKPSHBPPD-KBPBESRZSA-N 0 3 414.358 4.074 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)c1ccc(Br)c(Cl)c1F ZINC000435818414 861083982 /nfs/dbraw/zinc/08/39/82/861083982.db2.gz ORQPHAUNYFDROX-UHFFFAOYSA-N 0 3 403.679 4.039 20 0 HIADHN Cc1oc2ccccc2c1CC(=O)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000467801345 881625814 /nfs/dbraw/zinc/62/58/14/881625814.db2.gz RHIIEFQHBYKEQA-UHFFFAOYSA-N 0 3 410.489 4.082 20 0 HIADHN C[C@H]1CCN(C(=O)Nc2ccc(OCC(F)(F)F)nc2)CCN1Cc1ccccc1 ZINC000437784705 863102290 /nfs/dbraw/zinc/10/22/90/863102290.db2.gz KIQFGQUFRNIJJC-INIZCTEOSA-N 0 3 422.451 4.151 20 0 HIADHN C[C@H]1CCN(C(=O)Nc2ccc(N3CCCCC3)nc2)CCN1Cc1ccccc1 ZINC000437787730 863106490 /nfs/dbraw/zinc/10/64/90/863106490.db2.gz LSUQOJTYLURXBW-FQEVSTJZSA-N 0 3 407.562 4.200 20 0 HIADHN C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)[C@](C)(Cc1nc2ccccc2s1)c1ccccc1 ZINC000467803096 881628243 /nfs/dbraw/zinc/62/82/43/881628243.db2.gz MZJPHKDNXVBNBF-IUBQTAPSSA-N 0 3 419.594 4.396 20 0 HIADHN C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)c1ccccc1CSc1nc2ccccc2o1 ZINC000467805364 881631065 /nfs/dbraw/zinc/63/10/65/881631065.db2.gz CLJHKMFBGGCBMW-QRWLVFNGSA-N 0 3 407.539 4.333 20 0 HIADHN CC[C@@H](C)NC(=O)c1ccc(NC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)cc1 ZINC000437837636 863191176 /nfs/dbraw/zinc/19/11/76/863191176.db2.gz JTBJRRZANIUSKO-WOJBJXKFSA-N 0 3 422.573 4.343 20 0 HIADHN C[C@@H](CNC(=O)Nc1ccc(F)cc1-c1ccc(Cl)cc1)CN1CCN(C)CC1 ZINC000437993163 863356103 /nfs/dbraw/zinc/35/61/03/863356103.db2.gz MFJKUCDLQJYCDD-INIZCTEOSA-N 0 3 418.944 4.151 20 0 HIADHN C[C@@H]1CCN(C(=O)Nc2ccc3c(c2)CCCC(=O)N3)CCN1Cc1ccccc1 ZINC000438001276 863362932 /nfs/dbraw/zinc/36/29/32/863362932.db2.gz RMNLAMHRYOUFEG-GOSISDBHSA-N 0 3 406.530 4.090 20 0 HIADHN CC[C@H](C(=O)NC1CCN(CCOC(C)C)CC1)c1cccc(C(F)(F)F)c1 ZINC000438047134 863408993 /nfs/dbraw/zinc/40/89/93/863408993.db2.gz BRGOSQOQLFWJMK-IBGZPJMESA-N 0 3 400.485 4.205 20 0 HIADHN C[C@@H]1CCC[C@@H](OCc2cccc(NC(=O)N(CCN(C)C)C[C@H]3CCCO3)c2)C1 ZINC000438074769 863459793 /nfs/dbraw/zinc/45/97/93/863459793.db2.gz DUEMBPUUVZWLFH-UEVCKROQSA-N 0 3 417.594 4.356 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)c1noc2c1CCCCC2 ZINC000467836224 881671089 /nfs/dbraw/zinc/67/10/89/881671089.db2.gz HTNNXLBYUUXCLC-UHFFFAOYSA-N 0 3 409.452 4.166 20 0 HIADHN CCOc1cccc2[nH]cc(CC(=O)NC[C@@H](c3ccc(C)cc3)N3CCCC3)c21 ZINC000467840506 881678930 /nfs/dbraw/zinc/67/89/30/881678930.db2.gz HXFXLZWSLDZWTN-QFIPXVFZSA-N 0 3 405.542 4.371 20 0 HIADHN Cc1ccc2cc(CNCc3ccc(C(=O)N4C[C@@H](C)O[C@@H](C)C4)cc3)ccc2n1 ZINC000438203212 863633988 /nfs/dbraw/zinc/63/39/88/863633988.db2.gz PIVIONHPYDWXIQ-KDURUIRLSA-N 0 3 403.526 4.082 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)N[C@@H]1C[C@H]1c1cc(F)c(F)c(F)c1 ZINC000438204759 863635460 /nfs/dbraw/zinc/63/54/60/863635460.db2.gz VAGRWFIJINUDQP-XKQJLSEDSA-N 0 3 409.477 4.158 20 0 HIADHN COc1ccc(-c2nn(Cc3ccccc3)cc2CN2CC[C@H](O)C(C)(C)C2)cc1 ZINC000438349303 863817774 /nfs/dbraw/zinc/81/77/74/863817774.db2.gz XJNFLIYYSRTJTB-QHCPKHFHSA-N 0 3 405.542 4.200 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1 ZINC000438456811 863880991 /nfs/dbraw/zinc/88/09/91/863880991.db2.gz GTRKNKPMOQXAJM-ZWKOTPCHSA-N 0 3 407.377 4.205 20 0 HIADHN COC(=O)C(C)(C)c1ccc(NC(=O)NC[C@@H](c2ccccc2)N2CCCC2)cc1 ZINC000438465070 863887235 /nfs/dbraw/zinc/88/72/35/863887235.db2.gz ZIIQGMAUPGMONS-NRFANRHFSA-N 0 3 409.530 4.096 20 0 HIADHN COC(=O)C(C)(C)c1ccc(NC(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)cc1 ZINC000438471916 863890588 /nfs/dbraw/zinc/89/05/88/863890588.db2.gz MYTIGDHUZDDIRC-QFIPXVFZSA-N 0 3 423.557 4.404 20 0 HIADHN CCCc1ccc(-c2ccc(NC(=O)NC[C@@H](C)CN3CCN(C)CC3)cc2)cc1 ZINC000438475673 863893880 /nfs/dbraw/zinc/89/38/80/863893880.db2.gz CPYMKSLQCOOIJC-HXUWFJFHSA-N 0 3 408.590 4.311 20 0 HIADHN COc1ccccc1NC(=O)c1ccc(NC(=O)[C@@H](C)N2CC[C@@H](C(C)C)C2)cc1 ZINC000438487767 863904353 /nfs/dbraw/zinc/90/43/53/863904353.db2.gz UISHRCADNCWTIZ-IEBWSBKVSA-N 0 3 409.530 4.252 20 0 HIADHN CC[C@@H](C(=O)Nc1ccc(Cl)c(C(=O)NCc2cccs2)c1)N(CC)CC ZINC000438548997 863978492 /nfs/dbraw/zinc/97/84/92/863978492.db2.gz UYFZUVASVWWYPO-SFHVURJKSA-N 0 3 407.967 4.390 20 0 HIADHN COc1ccc(CCC(=O)N(Cc2ccccc2)C2CCN(C)CC2)cc1Cl ZINC000438550981 863979479 /nfs/dbraw/zinc/97/94/79/863979479.db2.gz DPSYAWVBYGYWSC-UHFFFAOYSA-N 0 3 400.950 4.404 20 0 HIADHN CC(C)c1nn(C)c2sc(C(=O)N(Cc3ccccc3)C3CCN(C)CC3)cc12 ZINC000438549541 863980465 /nfs/dbraw/zinc/98/04/65/863980465.db2.gz DIIKQFQXDVRZPG-UHFFFAOYSA-N 0 3 410.587 4.495 20 0 HIADHN Cc1cc(C(=O)N(Cc2ccccc2)C2CCN(C)CC2)c2c(n1)onc2C(C)C ZINC000438561145 863993143 /nfs/dbraw/zinc/99/31/43/863993143.db2.gz JAEMWRJJVQTBGV-UHFFFAOYSA-N 0 3 406.530 4.391 20 0 HIADHN COc1ccc(C(=O)c2ccccc2C(=O)Nc2ccccc2CCN(C)C)cc1 ZINC000438563235 863997449 /nfs/dbraw/zinc/99/74/49/863997449.db2.gz LXXKHZYGXTVMEJ-UHFFFAOYSA-N 0 3 402.494 4.283 20 0 HIADHN COc1ccc(Br)c(NC(=O)N(CCN(C)C)Cc2cccs2)c1 ZINC000438579186 864011146 /nfs/dbraw/zinc/01/11/46/864011146.db2.gz BLDXWVDSPMCMHP-UHFFFAOYSA-N 0 3 412.353 4.115 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)Nc1ccc(F)c(Br)c1 ZINC000438597807 864024557 /nfs/dbraw/zinc/02/45/57/864024557.db2.gz MHHGHOFMDRHFCK-UHFFFAOYSA-N 0 3 416.360 4.071 20 0 HIADHN Cc1cc(C(=O)NC(C)C)ccc1NC(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000438622635 864048960 /nfs/dbraw/zinc/04/89/60/864048960.db2.gz RQHPXJWGJNKFMV-UHFFFAOYSA-N 0 3 422.573 4.262 20 0 HIADHN C[C@@H](CNC(=O)Nc1c(F)cc(Br)cc1F)N(C)Cc1ccccc1 ZINC000438637841 864071425 /nfs/dbraw/zinc/07/14/25/864071425.db2.gz PYJTZOKQBWOORV-LBPRGKRZSA-N 0 3 412.278 4.369 20 0 HIADHN CCN(C(=O)C(=O)Nc1ccc(F)cc1Cl)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000438645047 864082768 /nfs/dbraw/zinc/08/27/68/864082768.db2.gz BYAAWEFIECJLDS-MAUKXSAKSA-N 0 3 417.912 4.102 20 0 HIADHN CCN(C(=O)C(=O)Nc1cc(F)cc(Cl)c1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000438655645 864097941 /nfs/dbraw/zinc/09/79/41/864097941.db2.gz NKVZNSHBRQOBDW-QRWLVFNGSA-N 0 3 417.912 4.102 20 0 HIADHN CCN(C(=O)C(=O)Nc1ccc2[nH]c(C)cc2c1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000438663574 864113415 /nfs/dbraw/zinc/11/34/15/864113415.db2.gz DOMHVTMXBFUIDM-XMSQKQJNSA-N 0 3 418.541 4.099 20 0 HIADHN CCN(C(=O)C(=O)Nc1ccccc1OC(C)C)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000438664790 864116823 /nfs/dbraw/zinc/11/68/23/864116823.db2.gz JWBFEOBTUQHREN-CTNGQTDRSA-N 0 3 423.557 4.096 20 0 HIADHN COc1ccc(Br)cc1NC(=O)N(CCN(C)C)Cc1cccs1 ZINC000438671464 864132517 /nfs/dbraw/zinc/13/25/17/864132517.db2.gz NNZOXWHHQKRTAD-UHFFFAOYSA-N 0 3 412.353 4.115 20 0 HIADHN O=C(NC1CC1)c1ccc(CN(CCc2ccc3c(c2)CCO3)Cc2ccco2)cc1 ZINC000438699131 864170459 /nfs/dbraw/zinc/17/04/59/864170459.db2.gz RUCYDBPJKGWMML-UHFFFAOYSA-N 0 3 416.521 4.352 20 0 HIADHN C[C@H]1CCC[C@H](OCc2cccc(NC(=O)C(=O)Nc3cccc(CN(C)C)c3)c2)C1 ZINC000438713201 864193612 /nfs/dbraw/zinc/19/36/12/864193612.db2.gz GCKPXJLUNAQPKE-MBSDFSHPSA-N 0 3 423.557 4.421 20 0 HIADHN CCOCc1ccc(NC(=O)NCC2(N3CCOC(C)(C)C3)CCCCC2)cc1 ZINC000438868184 864360489 /nfs/dbraw/zinc/36/04/89/864360489.db2.gz ZXEXKZCJYJHUDN-UHFFFAOYSA-N 0 3 403.567 4.158 20 0 HIADHN O[C@@H]1CCCC[C@@H]1[C@H]1CCCCN1Cc1csc(-c2ccc3c(c2)OCO3)n1 ZINC000439015694 864466438 /nfs/dbraw/zinc/46/64/38/864466438.db2.gz SZSYRWUPLQOFNP-GUDVDZBRSA-N 0 3 400.544 4.444 20 0 HIADHN Cc1ccsc1CCCC(=O)NCCCCN1CCN(c2cccc(C)c2)CC1 ZINC000439042371 864496284 /nfs/dbraw/zinc/49/62/84/864496284.db2.gz UDBTYCNPYJMFQG-UHFFFAOYSA-N 0 3 413.631 4.406 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3nc(-c4ccccc4F)cs3)cc2)CC1 ZINC000439112473 864550516 /nfs/dbraw/zinc/55/05/16/864550516.db2.gz BCFXRVUZABKSIV-UHFFFAOYSA-N 0 3 410.518 4.343 20 0 HIADHN Cc1ccc(Br)cc1CN[C@@H](C)c1cccc(N2CCCS2(=O)=O)c1 ZINC000439143764 864576472 /nfs/dbraw/zinc/57/64/72/864576472.db2.gz UVDWLSGZCCQYAR-HNNXBMFYSA-N 0 3 423.376 4.148 20 0 HIADHN CC[C@@](C)(O)CN(Cc1ccccc1)Cc1cccc(C(=O)NCc2ccco2)c1 ZINC000439270981 864687779 /nfs/dbraw/zinc/68/77/79/864687779.db2.gz GGRRJLJLGIKVPN-RUZDIDTESA-N 0 3 406.526 4.373 20 0 HIADHN O=C1[C@H](N2CCC([C@@H]3CCCO3)CC2)CCCN1Cc1cccc(C(F)(F)F)c1 ZINC000439277780 864696243 /nfs/dbraw/zinc/69/62/43/864696243.db2.gz WWVGBSSDMPAPKE-UXHICEINSA-N 0 3 410.480 4.087 20 0 HIADHN Brc1ccc(-c2nccc(CN3CCC([C@@H]4CCCO4)CC3)n2)cc1 ZINC000439290040 864710858 /nfs/dbraw/zinc/71/08/58/864710858.db2.gz SGPINEIBSOBSFN-IBGZPJMESA-N 0 3 402.336 4.297 20 0 HIADHN C[C@@H]1C[C@@H](c2ccccc2)CCN1CC(=O)N1CCC(C(=O)Nc2ccccc2)CC1 ZINC000439312518 864745845 /nfs/dbraw/zinc/74/58/45/864745845.db2.gz FLQOPCNXHLBLGV-OFNKIYASSA-N 0 3 419.569 4.132 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)N[C@H](c1nccs1)c1ccccc1 ZINC000439375325 864808325 /nfs/dbraw/zinc/80/83/25/864808325.db2.gz STZVAVNEJZCJAH-SFHVURJKSA-N 0 3 400.573 4.067 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)Nc1cc(F)ccc1Br ZINC000467930881 881804361 /nfs/dbraw/zinc/80/43/61/881804361.db2.gz ITKAJMWFKAVVIL-UHFFFAOYSA-N 0 3 412.278 4.323 20 0 HIADHN Cc1cccnc1[C@H](NC[C@@H](O)COc1cc(F)cc(Br)c1)C(C)C ZINC000439458266 864839000 /nfs/dbraw/zinc/83/90/00/864839000.db2.gz SOFCMJHTLHZVAX-SJLPKXTDSA-N 0 3 411.315 4.018 20 0 HIADHN CN(C)[C@@H](CNCc1cc(Cl)ccc1OC[C@@H]1CCCO1)c1ccc(F)cc1 ZINC000439478425 864845866 /nfs/dbraw/zinc/84/58/66/864845866.db2.gz MRNMWWFEAVHKSE-SFTDATJTSA-N 0 3 406.929 4.429 20 0 HIADHN C[C@@H](C(=O)Nc1ccc(CCn2cc(Br)cn2)cc1)N1[C@H](C)CC[C@@H]1C ZINC000439480946 864846886 /nfs/dbraw/zinc/84/68/86/864846886.db2.gz WXFRHEZOIDQEAD-XHSDSOJGSA-N 0 3 419.367 4.088 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)Nc1cc(F)ccc1Br ZINC000467935739 881808222 /nfs/dbraw/zinc/80/82/22/881808222.db2.gz RQLGJZIHVMUTNG-UHFFFAOYSA-N 0 3 412.278 4.323 20 0 HIADHN COc1ccc(C2(CN[C@H](C)c3nnnn3-c3ccccc3)CCCCC2)cc1OC ZINC000439584545 864907375 /nfs/dbraw/zinc/90/73/75/864907375.db2.gz WSAQJEDRNMEFAC-GOSISDBHSA-N 0 3 421.545 4.232 20 0 HIADHN C[C@@H](NCc1ccccc1CN(C)Cc1ccco1)C(=O)N(C)Cc1ccccc1 ZINC000439598298 864920416 /nfs/dbraw/zinc/92/04/16/864920416.db2.gz QGRQHGWDLSYSRM-HXUWFJFHSA-N 0 3 405.542 4.048 20 0 HIADHN CN(Cc1ccco1)Cc1ccccc1CN[C@@H]1CCCN(c2ccccc2)C1=O ZINC000439600572 864924343 /nfs/dbraw/zinc/92/43/43/864924343.db2.gz WAGDDHQQVHJAHV-XMMPIXPASA-N 0 3 403.526 4.197 20 0 HIADHN CCc1cccc2c(C(=O)[C@@H](NC3CCN(CCOC)CC3)c3ccccc3)c[nH]c21 ZINC000439639596 864966875 /nfs/dbraw/zinc/96/68/75/864966875.db2.gz BYOUHMWKWUMUKQ-VWLOTQADSA-N 0 3 419.569 4.355 20 0 HIADHN CC(C)(C)[C@H](CN1CCc2ccccc2C1)NC(=O)N1CCC([C@@H]2CCCO2)CC1 ZINC000439641817 864968183 /nfs/dbraw/zinc/96/81/83/864968183.db2.gz GVQKBWICPGANEQ-GOTSBHOMSA-N 0 3 413.606 4.060 20 0 HIADHN Cc1ccc(C(=O)NCC2CC2)cc1NC(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000439683114 865018894 /nfs/dbraw/zinc/01/88/94/865018894.db2.gz GCPQKEJHDYOGRZ-XMSQKQJNSA-N 0 3 420.557 4.092 20 0 HIADHN CC[C@](C)(O)CN(Cc1ccccc1)C(=O)N[C@H](CN1CCCC1)c1ccccc1 ZINC000439700174 865036929 /nfs/dbraw/zinc/03/69/29/865036929.db2.gz RAUGOHNJHCCVGI-NOZRDPDXSA-N 0 3 409.574 4.196 20 0 HIADHN C[C@@H](Oc1ccccc1C(F)(F)F)C(=O)NC1CCN([C@@H](C)c2ccncc2)CC1 ZINC000439732841 865063779 /nfs/dbraw/zinc/06/37/79/865063779.db2.gz BLLMCRUPVJJQOR-JKSUJKDBSA-N 0 3 421.463 4.210 20 0 HIADHN CCOc1c(Cl)cc(C(=O)NC2CCN([C@H](C)c3ccncc3)CC2)cc1OC ZINC000439735569 865067010 /nfs/dbraw/zinc/06/70/10/865067010.db2.gz SUXQYZHGEQYMSP-OAHLLOKOSA-N 0 3 417.937 4.098 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)c2cc(C3CC3)nn2-c2ccccc2)CC1 ZINC000439736966 865069624 /nfs/dbraw/zinc/06/96/24/865069624.db2.gz GAXYVGUTZOVFLZ-SFHVURJKSA-N 0 3 415.541 4.100 20 0 HIADHN C[C@@H](C(=O)Nc1ccc(C(=O)NCCN2CCCC2)cc1)c1ccc2ccccc2c1 ZINC000439752966 865082232 /nfs/dbraw/zinc/08/22/32/865082232.db2.gz ZRABISIBFQXMHT-LJQANCHMSA-N 0 3 415.537 4.408 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)Cc2csc(Cc3ccccc3)n2)CC1 ZINC000439764047 865088751 /nfs/dbraw/zinc/08/87/51/865088751.db2.gz BJGADNLHYNUWLJ-GOSISDBHSA-N 0 3 420.582 4.013 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)Cc2csc(-c3cccs3)n2)CC1 ZINC000439764385 865090125 /nfs/dbraw/zinc/09/01/25/865090125.db2.gz FAKOZNGDRWOXLF-OAHLLOKOSA-N 0 3 412.584 4.151 20 0 HIADHN C[C@@H](SCC(=O)NC1CCN([C@@H](C)c2ccncc2)CC1)c1nc2ccccc2[nH]1 ZINC000439764261 865090448 /nfs/dbraw/zinc/09/04/48/865090448.db2.gz HDRBOUUHNCTPOK-DLBZAZTESA-N 0 3 423.586 4.094 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)c2[nH]c3ccc(F)cc3c2Cl)CC1 ZINC000439770342 865095210 /nfs/dbraw/zinc/09/52/10/865095210.db2.gz QQJKHORIAHQJTH-CYBMUJFWSA-N 0 3 400.885 4.311 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3ccc(F)c(C4CC4)c3)CC2)C[C@@H](C)O1 ZINC000439787128 865108882 /nfs/dbraw/zinc/10/88/82/865108882.db2.gz YVCQBDIZJQEVTB-IAGOWNOFSA-N 0 3 403.542 4.446 20 0 HIADHN CN1CCC[C@@H](CNC(=O)c2cn3ccnc3s2)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000467999385 881842332 /nfs/dbraw/zinc/84/23/32/881842332.db2.gz AXJZOGJMSFRQDG-YOEHRIQHSA-N 0 3 422.476 4.228 20 0 HIADHN CN1CCC[C@H](CNC(=O)c2cn3ccnc3s2)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000467999383 881842589 /nfs/dbraw/zinc/84/25/89/881842589.db2.gz AXJZOGJMSFRQDG-RHSMWYFYSA-N 0 3 422.476 4.228 20 0 HIADHN Cc1cc(CCCC(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)c(C)s1 ZINC000439901343 865212125 /nfs/dbraw/zinc/21/21/25/865212125.db2.gz MADJRUZPCABCPP-HDICACEKSA-N 0 3 406.636 4.426 20 0 HIADHN CCn1ncc(NC(=O)N[C@@H](CN(C)Cc2ccccc2)C(C)C)c1C(F)(F)F ZINC000439936915 865237052 /nfs/dbraw/zinc/23/70/52/865237052.db2.gz XTJWOCVDSSVNSZ-KRWDZBQOSA-N 0 3 411.472 4.200 20 0 HIADHN CC[C@H](CNC(=O)Nc1cc(-c2ccnn2C)ccc1C)N1CCc2ccccc2C1 ZINC000439960252 865251498 /nfs/dbraw/zinc/25/14/98/865251498.db2.gz YIYHFVMUODMJFV-JOCHJYFZSA-N 0 3 417.557 4.354 20 0 HIADHN Cc1ccc(-c2ccnn2C)cc1NC(=O)NCC(C)(C)N1CCc2ccccc2C1 ZINC000439961955 865254479 /nfs/dbraw/zinc/25/44/79/865254479.db2.gz PAPFJLFZXAKBSV-UHFFFAOYSA-N 0 3 417.557 4.354 20 0 HIADHN COc1cc(-c2nnc(CN[C@H]3CCCC[C@@H]3C(C)(C)C)o2)cc(OC)c1OC ZINC000440047760 865325382 /nfs/dbraw/zinc/32/53/82/865325382.db2.gz CDOKTHAGNPSXPG-HOTGVXAUSA-N 0 3 403.523 4.457 20 0 HIADHN CC[C@@H](CNC(=O)N(Cc1ccccc1)C1CCN(C)CC1)Oc1cccc(F)c1 ZINC000440184402 865408650 /nfs/dbraw/zinc/40/86/50/865408650.db2.gz OMXYCXSUDDJDFT-QFIPXVFZSA-N 0 3 413.537 4.289 20 0 HIADHN CC(C)C1CCC(N2CCN(C(=O)N[C@H](CCCO)c3ccccc3)CC2)CC1 ZINC000440208024 865439599 /nfs/dbraw/zinc/43/95/99/865439599.db2.gz PGQVWUWHWHJSCK-IQWMQGJTSA-N 0 3 401.595 4.042 20 0 HIADHN CC(=O)Nc1ccc([C@H](C)N[C@@H]2CC(=O)N(Cc3ccccc3C(F)(F)F)C2)cc1 ZINC000468051850 881876595 /nfs/dbraw/zinc/87/65/95/881876595.db2.gz XBHQVEYWEBQHLY-IFXJQAMLSA-N 0 3 419.447 4.116 20 0 HIADHN CC(C)n1cnnc1-c1ccccc1NC(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000440274847 865521993 /nfs/dbraw/zinc/52/19/93/865521993.db2.gz VDCHPHHTBLXXCS-ICSRJNTNSA-N 0 3 418.545 4.483 20 0 HIADHN CC(C)C1CCC(N2CCN(CC(=O)Nc3ccccc3OC(F)F)CC2)CC1 ZINC000440320157 865589000 /nfs/dbraw/zinc/58/90/00/865589000.db2.gz XEOIRDVFBFFRRK-UHFFFAOYSA-N 0 3 409.521 4.059 20 0 HIADHN COc1ccc([C@H](NC[C@@H](O)COCc2ccccc2F)c2ccc(F)cc2)cc1 ZINC000440414337 865708768 /nfs/dbraw/zinc/70/87/68/865708768.db2.gz KIWMQMMJSXSVJW-ZJSXRUAMSA-N 0 3 413.464 4.230 20 0 HIADHN Cc1c2ccc3ccccc3c2oc1C(=O)NC[C@]1(O)CCN(Cc2ccccc2)C1 ZINC000440514446 865801787 /nfs/dbraw/zinc/80/17/87/865801787.db2.gz DTELGZNNZYPMMI-AREMUKBSSA-N 0 3 414.505 4.261 20 0 HIADHN Cc1ccc(-c2ccsc2C(=O)NC[C@]2(O)CCN(Cc3ccccc3)C2)cc1 ZINC000440519575 865802705 /nfs/dbraw/zinc/80/27/05/865802705.db2.gz ZVYXESNWBWRAMI-XMMPIXPASA-N 0 3 406.551 4.090 20 0 HIADHN Cc1cc(OCc2ccccc2)ccc1NC(=O)C(=O)Nc1cccc(CN(C)C)c1 ZINC000440610347 865837353 /nfs/dbraw/zinc/83/73/53/865837353.db2.gz CWCYTAGRBBDUQT-UHFFFAOYSA-N 0 3 417.509 4.213 20 0 HIADHN Cc1nc(-c2ccc(C(=O)NC[C@@H]3CN(Cc4ccccc4)CCCO3)cc2)cs1 ZINC000440887162 865981617 /nfs/dbraw/zinc/98/16/17/865981617.db2.gz LEZNKXZEHBJGFZ-JOCHJYFZSA-N 0 3 421.566 4.139 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)Nc1ccc(OC2CCCCC2)cc1 ZINC000440890636 865986540 /nfs/dbraw/zinc/98/65/40/865986540.db2.gz DDCHPVGOAHRRPQ-UHFFFAOYSA-N 0 3 409.530 4.345 20 0 HIADHN Cc1ccccc1[C@H](OC[C@@H](O)CN1CCc2ccccc2[C@@H]1CO)c1ccccc1 ZINC000440911057 866007212 /nfs/dbraw/zinc/00/72/12/866007212.db2.gz KRPMBRFJBKNSCC-MSLLRLGPSA-N 0 3 417.549 4.054 20 0 HIADHN Cc1ccc(-c2nnc(-c3ccc(C(=O)N[C@H]4C[C@@H](C)N(C5CC5)C4)cc3)o2)cc1 ZINC000440917073 866012254 /nfs/dbraw/zinc/01/22/54/866012254.db2.gz ZGIQZTOEVFOFFI-UZLBHIALSA-N 0 3 402.498 4.067 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)c2ccccc2-c2nc(-c3cccc(Cl)c3)no2)CN1C1CC1 ZINC000440928341 866024881 /nfs/dbraw/zinc/02/48/81/866024881.db2.gz XYBJOVHTCJFVIR-RHSMWYFYSA-N 0 3 422.916 4.412 20 0 HIADHN C[C@H]1C[C@H](NC(=O)c2cn(Cc3ccccc3)nc2-c2cccs2)CN1C1CC1 ZINC000440932732 866029557 /nfs/dbraw/zinc/02/95/57/866029557.db2.gz ZXRPWYGFFJOBOH-WMZOPIPTSA-N 0 3 406.555 4.015 20 0 HIADHN CC(C)(c1ccccc1)c1ccc(OC[C@H](O)CN2CCC(c3c[nH]cn3)CC2)cc1 ZINC000440968375 866054136 /nfs/dbraw/zinc/05/41/36/866054136.db2.gz VROJJPFARDKBAS-HSZRJFAPSA-N 0 3 419.569 4.355 20 0 HIADHN CSc1ccccc1[C@H](C)NC(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000441008453 866079902 /nfs/dbraw/zinc/07/99/02/866079902.db2.gz YRLHDDSDQOWAEH-KSZLIROESA-N 0 3 405.608 4.000 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)CCc2nnc(-c3ccc(Cl)cc3)o2)C1 ZINC000468115642 881942070 /nfs/dbraw/zinc/94/20/70/881942070.db2.gz RSVDZDQGPNNNMJ-OXQOHEQNSA-N 0 3 424.932 4.274 20 0 HIADHN FC(F)(F)c1csc([C@H]2CCCN(CCOCCOc3ccccc3)C2)n1 ZINC000441072852 866161775 /nfs/dbraw/zinc/16/17/75/866161775.db2.gz YUQULOAVYPDKCN-HNNXBMFYSA-N 0 3 400.466 4.437 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N[C@@H](C)c3ccccc3C(F)(F)F)cc2)CC1 ZINC000468118270 881946581 /nfs/dbraw/zinc/94/65/81/881946581.db2.gz WYUGBVNJZLKMSS-INIZCTEOSA-N 0 3 405.464 4.338 20 0 HIADHN O=C(CN1CCC[C@H]([C@H]2CCOC2)C1)N[C@@H](c1ccccc1)c1cccc(Cl)c1 ZINC000441286012 866360190 /nfs/dbraw/zinc/36/01/90/866360190.db2.gz YZAJEORIZPFGJO-HFMPRLQTSA-N 0 3 412.961 4.294 20 0 HIADHN CCOc1cc(CN[C@H]2C(=O)NCC[C@H]2C)ccc1OCc1c(F)cccc1Cl ZINC000441325135 866395801 /nfs/dbraw/zinc/39/58/01/866395801.db2.gz BMFKQFQWYIASBD-SPLOXXLWSA-N 0 3 420.912 4.071 20 0 HIADHN C[C@H]1CCCN1C(=O)CCN1CCc2c(cccc2NC(=O)Nc2ccc(F)cc2)C1 ZINC000441325103 866395878 /nfs/dbraw/zinc/39/58/78/866395878.db2.gz PJJRZSNBVMYZIY-KRWDZBQOSA-N 0 3 424.520 4.229 20 0 HIADHN CN1CCN(CCNC(=O)Nc2ccccc2Oc2ccccc2Cl)CC1(C)C ZINC000441326008 866398224 /nfs/dbraw/zinc/39/82/24/866398224.db2.gz RFFIRIXOGGSRAJ-UHFFFAOYSA-N 0 3 416.953 4.280 20 0 HIADHN Cc1ccc([C@H]2CCC[C@@H]2N(C)CC(=O)Nc2ccccc2N2CCCC2=O)cc1 ZINC000441355586 866424526 /nfs/dbraw/zinc/42/45/26/866424526.db2.gz KNONLBQUXVYERK-IRLDBZIGSA-N 0 3 405.542 4.328 20 0 HIADHN CCN(CC(F)(F)F)C(=O)[C@H]1CCCN(Cc2c(C)cc(C)c(C(C)=O)c2C)C1 ZINC000441364032 866431956 /nfs/dbraw/zinc/43/19/56/866431956.db2.gz YUDDFNXWWXBETI-SFHVURJKSA-N 0 3 412.496 4.437 20 0 HIADHN O=c1nc(CN2CC[C@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)[n-]c2scc(-c3ccco3)c21 ZINC000441421790 866497730 /nfs/dbraw/zinc/49/77/30/866497730.db2.gz OQLJQTCRKCEPKN-YOEHRIQHSA-N 0 3 410.543 4.106 20 0 HIADHN O=c1nc(CN2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)[n-]c2scc(-c3ccco3)c21 ZINC000441421790 866497733 /nfs/dbraw/zinc/49/77/33/866497733.db2.gz OQLJQTCRKCEPKN-YOEHRIQHSA-N 0 3 410.543 4.106 20 0 HIADHN CC(C)c1ncc(CN(C)C(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)cn1 ZINC000441424235 866502037 /nfs/dbraw/zinc/50/20/37/866502037.db2.gz PEVMMYGTNOSEAK-NRFANRHFSA-N 0 3 420.479 4.013 20 0 HIADHN COc1cc(-c2nnc(CN3CCCC[C@H]3Cc3ccccc3)o2)cc(OC)c1OC ZINC000441469216 866545842 /nfs/dbraw/zinc/54/58/42/866545842.db2.gz DHTRQXIJQLTOBR-IBGZPJMESA-N 0 3 423.513 4.360 20 0 HIADHN C[C@@H](c1ccc(Br)cc1)N1CCN(CCCCCn2cccn2)CC1 ZINC000441476241 866554497 /nfs/dbraw/zinc/55/44/97/866554497.db2.gz JYJVVUYFAZSUQN-SFHVURJKSA-N 0 3 405.384 4.195 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)C(=O)Nc1ccc(C(F)(F)F)c(C)c1)c1ccccc1 ZINC000441597985 866688561 /nfs/dbraw/zinc/68/85/61/866688561.db2.gz MGNOPSHXMVNFHL-IBGZPJMESA-N 0 3 421.463 4.152 20 0 HIADHN C[C@H](C(=O)Nc1cccc(CSc2ccccn2)c1)N1CC[C@@H]([C@H]2CCOC2)C1 ZINC000441661251 866779951 /nfs/dbraw/zinc/77/99/51/866779951.db2.gz JUQWKTUPFAYDKM-RLLQIKCJSA-N 0 3 411.571 4.059 20 0 HIADHN C[C@H](C(=O)Nc1cccc(CSc2ccccn2)c1)N1CC[C@H]([C@@H]2CCOC2)C1 ZINC000441661252 866780522 /nfs/dbraw/zinc/78/05/22/866780522.db2.gz JUQWKTUPFAYDKM-YZGWKJHDSA-N 0 3 411.571 4.059 20 0 HIADHN C[C@@H](NC(=O)N(CCN(C)C)Cc1cccs1)c1cccc(OC(F)(F)F)c1 ZINC000441677727 866801394 /nfs/dbraw/zinc/80/13/94/866801394.db2.gz GZJRRJNDJFPEBF-CQSZACIVSA-N 0 3 415.481 4.481 20 0 HIADHN C[C@H](NC(=O)C(=O)Nc1cccc(-c2cccs2)c1)[C@H](c1ccccc1)N(C)C ZINC000441682673 866803698 /nfs/dbraw/zinc/80/36/98/866803698.db2.gz BIFGACXQXYRRSU-HRAATJIYSA-N 0 3 407.539 4.161 20 0 HIADHN Cc1c(Cl)cc(NC(=O)C(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)cc1Cl ZINC000441707519 866814537 /nfs/dbraw/zinc/81/45/37/866814537.db2.gz MFOYTPZYBWFXRP-ACJLOTCBSA-N 0 3 408.329 4.048 20 0 HIADHN CC1CCN([C@@H](CNC(=O)N2CCO[C@@H](c3ccsc3)C2)c2cccs2)CC1 ZINC000468161045 882030675 /nfs/dbraw/zinc/03/06/75/882030675.db2.gz USBPQNAPZBPSFT-RBUKOAKNSA-N 0 3 419.616 4.366 20 0 HIADHN Cc1c(CSC(C)C)cccc1NC(=O)C(=O)N1CCCN(C2CCCC2)CC1 ZINC000441983117 867041992 /nfs/dbraw/zinc/04/19/92/867041992.db2.gz YDDXUYDCIFYXPK-UHFFFAOYSA-N 0 3 417.619 4.052 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1ccc2c(n1)CCCC2 ZINC000442317855 867323903 /nfs/dbraw/zinc/32/39/03/867323903.db2.gz XGAJETPLMHYXKJ-OAQYLSRUSA-N 0 3 415.541 4.165 20 0 HIADHN Cc1ccc(Sc2ccc(NC(=O)C(=O)N[C@H](C)C3=CCN(C)CC3)cc2)c(C)c1 ZINC000442338792 867334628 /nfs/dbraw/zinc/33/46/28/867334628.db2.gz AMNPDLHIAOOHJJ-GOSISDBHSA-N 0 3 423.582 4.160 20 0 HIADHN CN(Cc1ccc(Cl)c(Cl)c1)C(=O)CCN1CCN(c2ccccc2)CC1 ZINC000468201572 882081300 /nfs/dbraw/zinc/08/13/00/882081300.db2.gz MCYYJARTCBLCOF-UHFFFAOYSA-N 0 3 406.357 4.164 20 0 HIADHN CN1CCN(CCNC(=O)N(Cc2cccc3ccccc32)C2CCCC2)CC1(C)C ZINC000442589935 867548083 /nfs/dbraw/zinc/54/80/83/867548083.db2.gz AFGFJZQWFFHFOH-UHFFFAOYSA-N 0 3 422.617 4.320 20 0 HIADHN CC(C)OCCCN(C)Cc1cccc(Br)c1OC[C@@H]1CCCO1 ZINC000442885460 867717810 /nfs/dbraw/zinc/71/78/10/867717810.db2.gz NHVSAABVIWPRDO-KRWDZBQOSA-N 0 3 400.357 4.254 20 0 HIADHN C[C@@H](NCC(=O)Nc1cccc(CN2CCSCC2)c1)c1cc2ccccc2o1 ZINC000442888838 867720039 /nfs/dbraw/zinc/72/00/39/867720039.db2.gz BMZHFKVAOSZWPF-QGZVFWFLSA-N 0 3 409.555 4.271 20 0 HIADHN CCOc1ccccc1CN1CCN(C(=O)c2cccc(CN3CCCC3)c2)[C@@H](C)C1 ZINC000442899881 867730813 /nfs/dbraw/zinc/73/08/13/867730813.db2.gz RAIBWEPTUFAXKM-NRFANRHFSA-N 0 3 421.585 4.028 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)Nc1ccc(O[C@@H]2CCCC[C@H]2O)cc1 ZINC000442938134 867753482 /nfs/dbraw/zinc/75/34/82/867753482.db2.gz PFIRQSBXAMONHS-IFMALSPDSA-N 0 3 408.498 4.429 20 0 HIADHN CC(=O)Nc1ccc(S[C@H](C)C(=O)NCCN2CCC3(CCCCC3)CC2)cc1 ZINC000442980755 867775597 /nfs/dbraw/zinc/77/55/97/867775597.db2.gz SELLVCARLQWTSL-GOSISDBHSA-N 0 3 417.619 4.288 20 0 HIADHN Cc1cc(C(F)(F)F)ccc1CNCc1cccc(OCCN2CCOCC2)c1 ZINC000443001898 867787748 /nfs/dbraw/zinc/78/77/48/867787748.db2.gz QQGQHWGJIMJAKB-UHFFFAOYSA-N 0 3 408.464 4.015 20 0 HIADHN C[C@@H](N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1)c1ccc2c(c1)OCCO2 ZINC000443103786 867820117 /nfs/dbraw/zinc/82/01/17/867820117.db2.gz SLKSHHFABGCSIL-XMSQKQJNSA-N 0 3 402.494 4.358 20 0 HIADHN C[C@H](N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1)c1ccc(-n2cncn2)cc1 ZINC000443104611 867820167 /nfs/dbraw/zinc/82/01/67/867820167.db2.gz FCRCRXMUBXATNP-YADARESESA-N 0 3 411.509 4.168 20 0 HIADHN C[C@H](CC(=O)Nc1ccc(Br)cc1)N[C@H]1CCOc2c(F)cccc21 ZINC000443202001 867873557 /nfs/dbraw/zinc/87/35/57/867873557.db2.gz WHOAYEOAASMZGF-PXAZEXFGSA-N 0 3 407.283 4.419 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)N1CC=C(c2c[nH]c3ncccc23)CC1 ZINC000468244986 882146838 /nfs/dbraw/zinc/14/68/38/882146838.db2.gz FPXQHDYEWWKNFT-UHFFFAOYSA-N 0 3 400.482 4.300 20 0 HIADHN Cc1cc(CN2CCC(CN3CCCCC3=O)CC2)nc(-c2ccc(Cl)cc2)n1 ZINC000443582950 868137359 /nfs/dbraw/zinc/13/73/59/868137359.db2.gz OGSLMDKILCZHKP-UHFFFAOYSA-N 0 3 412.965 4.330 20 0 HIADHN Cc1cc(CN2CCC(C(=O)N[C@H](C)C(C)C)CC2)nc(-c2ccc(Cl)cc2)n1 ZINC000443631792 868209197 /nfs/dbraw/zinc/20/91/97/868209197.db2.gz ROUNYHMYQPWGJI-QGZVFWFLSA-N 0 3 414.981 4.478 20 0 HIADHN CC(C)COc1ccc(C(C)(C)C(=O)NCCCCN2C[C@@H](C)O[C@H](C)C2)cc1 ZINC000443648812 868241110 /nfs/dbraw/zinc/24/11/10/868241110.db2.gz FOMWTBSOSCQJMJ-WOJBJXKFSA-N 0 3 404.595 4.005 20 0 HIADHN C[C@H]1CCN(CC(=O)N(Cc2nnc(-c3ccccc3Cl)o2)C2CC2)C[C@@H](C)C1 ZINC000443654996 868251557 /nfs/dbraw/zinc/25/15/57/868251557.db2.gz NMPJSIDFYCASKQ-HOTGVXAUSA-N 0 3 416.953 4.249 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)c2ccccc2SCc2cscn2)C[C@H](C)O1 ZINC000443658043 868260631 /nfs/dbraw/zinc/26/06/31/868260631.db2.gz UROPVOKSUUBHBH-CALCHBBNSA-N 0 3 419.616 4.055 20 0 HIADHN Cc1ccc(OCc2ccc(C(=O)NCCCCN3C[C@@H](C)O[C@@H](C)C3)o2)c(C)c1 ZINC000443666287 868272647 /nfs/dbraw/zinc/27/26/47/868272647.db2.gz LFWATCAELOOBGZ-BGYRXZFFSA-N 0 3 414.546 4.095 20 0 HIADHN C[C@H]1CN(CCCCNC(=O)CCCOc2cccc(Cl)c2Cl)C[C@H](C)O1 ZINC000443672601 868277630 /nfs/dbraw/zinc/27/76/30/868277630.db2.gz FXYCRUUEYDEZOR-HOTGVXAUSA-N 0 3 417.377 4.158 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)C23C[C@H]4C[C@@H](C2)CC(C(F)(F)F)(C4)C3)C[C@H](C)O1 ZINC000443671724 868278356 /nfs/dbraw/zinc/27/83/56/868278356.db2.gz DEOXTBKNADOZPJ-GXMGCWFQSA-N 0 3 416.528 4.141 20 0 HIADHN C[C@H](CC(=O)NCCCCN1C[C@@H](C)O[C@H](C)C1)c1ccccc1C(F)(F)F ZINC000443677753 868284947 /nfs/dbraw/zinc/28/49/47/868284947.db2.gz UGWCISGTUQBXFJ-BRWVUGGUSA-N 0 3 400.485 4.205 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)Cc2csc(-c3ccc(Cl)cc3)n2)C[C@@H](C)O1 ZINC000443684591 868289466 /nfs/dbraw/zinc/28/94/66/868289466.db2.gz TYVCWFKKCHAHTD-HZPDHXFCSA-N 0 3 421.994 4.012 20 0 HIADHN CCN(C(=O)C(=O)Nc1ccc2ccoc2c1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000443694899 868294248 /nfs/dbraw/zinc/29/42/48/868294248.db2.gz URSRKJFCSCXTIN-UWJYYQICSA-N 0 3 405.498 4.055 20 0 HIADHN Cc1ccccc1[C@@H]([C@@H](C)NC(=O)C(=O)Nc1ccc(Cl)cc1Cl)N(C)C ZINC000443841488 868372488 /nfs/dbraw/zinc/37/24/88/868372488.db2.gz KLAPNZQBOFBQJT-FZKQIMNGSA-N 0 3 408.329 4.048 20 0 HIADHN Cc1ccccc1[C@H]([C@H](C)NC(=O)C(=O)Nc1ccc(Cl)cc1Cl)N(C)C ZINC000443841490 868372970 /nfs/dbraw/zinc/37/29/70/868372970.db2.gz KLAPNZQBOFBQJT-UGSOOPFHSA-N 0 3 408.329 4.048 20 0 HIADHN Cc1ccccc1[C@H]([C@H](C)NC(=O)C(=O)Nc1cccc(C(F)(F)F)c1C)N(C)C ZINC000443843055 868373974 /nfs/dbraw/zinc/37/39/74/868373974.db2.gz RDTAZEIMCRRNSQ-KXBFYZLASA-N 0 3 421.463 4.068 20 0 HIADHN Cc1ccccc1[C@@H]([C@@H](C)NC(=O)C(=O)Nc1ccc(OC2CCCC2)cc1)N(C)C ZINC000443845072 868375599 /nfs/dbraw/zinc/37/55/99/868375599.db2.gz SVBGIPGTWPLMBA-WZONZLPQSA-N 0 3 423.557 4.063 20 0 HIADHN COC(=O)c1c(CN2CCC[C@H]2C[C@H](C)O)nc2ccccc2c1-c1ccccc1 ZINC000443873210 868403682 /nfs/dbraw/zinc/40/36/82/868403682.db2.gz GBAJGVIXHBLMCW-HKUYNNGSSA-N 0 3 404.510 4.424 20 0 HIADHN COC(=O)c1c(CN2CCC[C@@H]2C[C@@H](C)O)nc2ccccc2c1-c1ccccc1 ZINC000443873211 868404667 /nfs/dbraw/zinc/40/46/67/868404667.db2.gz GBAJGVIXHBLMCW-IEBWSBKVSA-N 0 3 404.510 4.424 20 0 HIADHN CC(C)CN(CCN(C)C)C(=O)Nc1ccc(CC(=O)Nc2ccccc2F)cc1 ZINC000443921080 868457738 /nfs/dbraw/zinc/45/77/38/868457738.db2.gz YWOHZTRRSKCNKF-UHFFFAOYSA-N 0 3 414.525 4.058 20 0 HIADHN Cc1cc(Cl)c(NC(=O)NC[C@]2(O)CCN(Cc3ccccc3)C2)cc1Cl ZINC000443943938 868480475 /nfs/dbraw/zinc/48/04/75/868480475.db2.gz SWRNOBFJVDHZLG-HXUWFJFHSA-N 0 3 408.329 4.060 20 0 HIADHN COc1ccc(CNC[C@H](c2ccc(C)o2)N2CCCC2)c(OCc2cccnc2)c1 ZINC000443978927 868506014 /nfs/dbraw/zinc/50/60/14/868506014.db2.gz JFTDNNZAHZIWJJ-HSZRJFAPSA-N 0 3 421.541 4.497 20 0 HIADHN O=C(N[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)N1CC[C@H](N2CC=CC2)C1 ZINC000444034443 868568940 /nfs/dbraw/zinc/56/89/40/868568940.db2.gz PSPWSXKTQJFYJI-HOTGVXAUSA-N 0 3 421.385 4.355 20 0 HIADHN O=C(N[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)N1CC[C@@H](N2CC=CC2)C1 ZINC000444034444 868569245 /nfs/dbraw/zinc/56/92/45/868569245.db2.gz PSPWSXKTQJFYJI-HZPDHXFCSA-N 0 3 421.385 4.355 20 0 HIADHN Cc1ccc2c(CCNC(=O)N(Cc3ccccc3)C3CCN(C)CC3)cn(C)c2c1 ZINC000444115959 868626455 /nfs/dbraw/zinc/62/64/55/868626455.db2.gz DVALKPPKVSNHDM-UHFFFAOYSA-N 0 3 418.585 4.335 20 0 HIADHN Cc1ccc(C[NH+](C)C)cc1[N-]S(=O)(=O)c1ccc(OC(F)F)c(Cl)c1 ZINC000444203899 868663010 /nfs/dbraw/zinc/66/30/10/868663010.db2.gz GRCYIBASFDFPLW-UHFFFAOYSA-N 0 3 404.866 4.112 20 0 HIADHN CCOc1ccc([C@@H]2CCCN2C(=O)CN(C[C@@H]2CCCO2)C2CCCC2)cc1 ZINC000444209776 868668262 /nfs/dbraw/zinc/66/82/62/868668262.db2.gz DOBGAAQNCPIGMO-GOTSBHOMSA-N 0 3 400.563 4.172 20 0 HIADHN COc1cc(NC(=O)CN(C)[C@@H]2CCC[C@@H]2c2ccc(C)cc2)cc(OC)c1OC ZINC000444237736 868687861 /nfs/dbraw/zinc/68/78/61/868687861.db2.gz JCDSFVLOTIOWOM-WOJBJXKFSA-N 0 3 412.530 4.227 20 0 HIADHN COc1ccc(-c2ncc(C(=O)Nc3cc(C)cc(CN(C)C)c3)s2)cc1OC ZINC000444323695 868752444 /nfs/dbraw/zinc/75/24/44/868752444.db2.gz CDGHUFGCJGAASA-UHFFFAOYSA-N 0 3 411.527 4.450 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)NC(=O)NC[C@H](c2cccs2)N2CCCC2)cc1 ZINC000444337980 868763783 /nfs/dbraw/zinc/76/37/83/868763783.db2.gz MYVNNTCTDGJELY-LAUBAEHRSA-N 0 3 423.586 4.440 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)[C@@H]1C[C@@H]1c1cccc(C(F)(F)F)c1 ZINC000444447878 868831999 /nfs/dbraw/zinc/83/19/99/868831999.db2.gz AQIJFGVOGCVYTM-NHCUHLMSSA-N 0 3 418.459 4.404 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)[C@H]1C[C@H]1c1c(F)cccc1Cl ZINC000444462746 868837969 /nfs/dbraw/zinc/83/79/69/868837969.db2.gz VVAXCTUBWRAFTM-MSOLQXFVSA-N 0 3 402.897 4.178 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1ccc(Oc2cccnc2)cc1 ZINC000444543779 868875804 /nfs/dbraw/zinc/87/58/04/868875804.db2.gz DTPVMQSUVIYMGG-UHFFFAOYSA-N 0 3 417.509 4.331 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1csc(-c2cccs2)n1 ZINC000444555453 868880175 /nfs/dbraw/zinc/88/01/75/868880175.db2.gz XWSAHDCWMXPXKE-UHFFFAOYSA-N 0 3 413.568 4.328 20 0 HIADHN Cc1ccc2c(CC(=O)Nc3cccc(CN4CCC(CO)CC4)c3)coc2c1C ZINC000444561548 868883203 /nfs/dbraw/zinc/88/32/03/868883203.db2.gz IOJPMLKLMINWGU-UHFFFAOYSA-N 0 3 406.526 4.435 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)NC(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)cc1 ZINC000444577044 868887992 /nfs/dbraw/zinc/88/79/92/868887992.db2.gz WRHBGYOEJUVSES-YCRNBWNJSA-N 0 3 417.557 4.376 20 0 HIADHN C[C@H](c1ccco1)N(C(=O)NCCCCN1CCN(c2ccccc2)CC1)C1CC1 ZINC000444702542 868964183 /nfs/dbraw/zinc/96/41/83/868964183.db2.gz IMTZKZBYUYGBCP-HXUWFJFHSA-N 0 3 410.562 4.117 20 0 HIADHN C[C@@H](c1ccco1)N(C(=O)NCCCCN1CCN(c2ccccc2)CC1)C1CC1 ZINC000444702535 868964193 /nfs/dbraw/zinc/96/41/93/868964193.db2.gz IMTZKZBYUYGBCP-FQEVSTJZSA-N 0 3 410.562 4.117 20 0 HIADHN Cc1noc(C)c1CCNC(=O)N1CCN(Cc2ccccc2)C2(CCCCC2)C1 ZINC000444709648 868968512 /nfs/dbraw/zinc/96/85/12/868968512.db2.gz SWOWALNGGNNUEV-UHFFFAOYSA-N 0 3 410.562 4.064 20 0 HIADHN Cc1cccc2nc(C3CCN(C[C@H](O)COc4ccccc4Cl)CC3)oc21 ZINC000444769916 868995393 /nfs/dbraw/zinc/99/53/93/868995393.db2.gz ATSFMQOKKUVGRJ-KRWDZBQOSA-N 0 3 400.906 4.409 20 0 HIADHN Cc1ccccc1[C@@H](CC(F)(F)F)NCCCOc1ccc(S(C)(=O)=O)cc1 ZINC000444778827 868999675 /nfs/dbraw/zinc/99/96/75/868999675.db2.gz AEBWXLMCFXRJMG-LJQANCHMSA-N 0 3 415.477 4.451 20 0 HIADHN C[C@H](c1nc(Cc2ccc(F)cc2)no1)N1CCC[C@@H](c2ncc(C(F)(F)F)[nH]2)C1 ZINC000444801370 869015495 /nfs/dbraw/zinc/01/54/95/869015495.db2.gz BQTXIOZUWVQLKA-TZMCWYRMSA-N 0 3 423.414 4.482 20 0 HIADHN CC1CCN([C@H](CNC(=O)Nc2cnn(C)c2C(F)(F)F)c2ccccc2)CC1 ZINC000445027024 869174998 /nfs/dbraw/zinc/17/49/98/869174998.db2.gz CUGHXIYGWSMAOG-QGZVFWFLSA-N 0 3 409.456 4.034 20 0 HIADHN CC1CCN([C@@H](CNC(=O)Nc2cnn(C)c2C(F)(F)F)c2cccs2)CC1 ZINC000445027307 869175945 /nfs/dbraw/zinc/17/59/45/869175945.db2.gz FPYSBIIBEOEYBU-AWEZNQCLSA-N 0 3 415.485 4.095 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N2CCCC[C@@H]2c2cccc(Cl)c2)CC1 ZINC000445126068 869231235 /nfs/dbraw/zinc/23/12/35/869231235.db2.gz OSHJHPHGYMAKGA-OAQYLSRUSA-N 0 3 407.986 4.466 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(C4(c5ccc(F)cc5)CCCC4)n3)cn2)CC1 ZINC000445237368 869292904 /nfs/dbraw/zinc/29/29/04/869292904.db2.gz MORJTPQJBYSNJB-UHFFFAOYSA-N 0 3 421.520 4.273 20 0 HIADHN O=C(N1CCO[C@H](c2ccsc2)C1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000468361513 882302031 /nfs/dbraw/zinc/30/20/31/882302031.db2.gz ZODBAHXHSVBPQN-ICSRJNTNSA-N 0 3 424.488 4.103 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)C1(Cc2ccc(F)cc2)CC1 ZINC000445782555 869820829 /nfs/dbraw/zinc/82/08/29/869820829.db2.gz JIFRLIYALFUIAJ-JOCHJYFZSA-N 0 3 418.516 4.431 20 0 HIADHN Cc1cn(-c2c(F)cccc2F)nc1C(=O)N[C@H](CN1CCCC1)c1ccccc1 ZINC000468402736 882343602 /nfs/dbraw/zinc/34/36/02/882343602.db2.gz LQNDFKVWRUUZPF-HXUWFJFHSA-N 0 3 410.468 4.026 20 0 HIADHN CC(C)[C@H](CC(F)(F)F)NCC(=O)Nc1ccnn1Cc1ccccc1Cl ZINC000445893406 869875431 /nfs/dbraw/zinc/87/54/31/869875431.db2.gz JYCBXLMGEURMQX-HNNXBMFYSA-N 0 3 402.848 4.090 20 0 HIADHN Cn1c(CN[C@@H]2CCC[C@H]2c2ccccc2C(F)(F)F)nc2ccccc2c1=O ZINC000446005227 869970383 /nfs/dbraw/zinc/97/03/83/869970383.db2.gz XOXWQMJHRPQOHS-MAUKXSAKSA-N 0 3 401.432 4.378 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)c1c[nH]nc1-c1ccccc1F ZINC000446121375 870067578 /nfs/dbraw/zinc/06/75/78/870067578.db2.gz JWNVKRYYJWFJSB-UHFFFAOYSA-N 0 3 410.518 4.059 20 0 HIADHN CN(C(=O)c1cc(F)cc(C(F)(F)F)c1)C1CCN(CCc2ccccn2)CC1 ZINC000446132274 870077727 /nfs/dbraw/zinc/07/77/27/870077727.db2.gz VFWRWSOOFNFRNO-UHFFFAOYSA-N 0 3 409.427 4.019 20 0 HIADHN C[C@H]1CN(CCCCNC(=O)C2(c3c(Cl)cccc3Cl)CCC2)C[C@H](C)O1 ZINC000446245797 870186822 /nfs/dbraw/zinc/18/68/22/870186822.db2.gz SSSRBRLVTFVMHH-HOTGVXAUSA-N 0 3 413.389 4.421 20 0 HIADHN CC1CCN([C@H](CNC(=O)Nc2cn(C)nc2C(F)(F)F)c2cccs2)CC1 ZINC000446260784 870200926 /nfs/dbraw/zinc/20/09/26/870200926.db2.gz RGUATUKAFGBLRR-CQSZACIVSA-N 0 3 415.485 4.095 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)N[C@@H](c1ccc(F)c(Cl)c1)C(F)(F)F ZINC000446354527 870264910 /nfs/dbraw/zinc/26/49/10/870264910.db2.gz GGIWDATXSIGCFP-INIZCTEOSA-N 0 3 421.822 4.449 20 0 HIADHN C[C@@H](NC(=O)CCCN1CCN(c2ccccc2)CC1)c1cccc(N2CCCC2)c1 ZINC000446489743 870402310 /nfs/dbraw/zinc/40/23/10/870402310.db2.gz COOYUFGCEBIVNY-JOCHJYFZSA-N 0 3 420.601 4.066 20 0 HIADHN Cc1ccc([C@@H](CCn2cncn2)NCc2ccnc(OCc3ccccc3)c2)cc1 ZINC000446749714 870656582 /nfs/dbraw/zinc/65/65/82/870656582.db2.gz BUHGJHRRCRHJPA-XMMPIXPASA-N 0 3 413.525 4.482 20 0 HIADHN Cc1ccc([C@H](CCn2cncn2)NCc2cc(F)cc(Br)c2)cc1 ZINC000446752855 870660748 /nfs/dbraw/zinc/66/07/48/870660748.db2.gz JECRDUFJTGWELT-IBGZPJMESA-N 0 3 403.299 4.409 20 0 HIADHN COc1ccc([C@H](CCn2cncn2)NCc2cc(Br)cs2)cc1 ZINC000446756253 870668131 /nfs/dbraw/zinc/66/81/31/870668131.db2.gz GDCSBSPOARHQCK-KRWDZBQOSA-N 0 3 407.337 4.032 20 0 HIADHN CC[C@H](C)NC(=O)c1cccc(CN[C@@H](CCn2cncn2)c2ccc(C)cc2)c1 ZINC000446757428 870670360 /nfs/dbraw/zinc/67/03/60/870670360.db2.gz UEAYJQCRVSMQRV-CVDCTZTESA-N 0 3 405.546 4.036 20 0 HIADHN C[C@@H](CC(=O)Nc1cccc(Br)c1)NCc1ccc2c(n1)CCCC2 ZINC000446896614 870816098 /nfs/dbraw/zinc/81/60/98/870816098.db2.gz PLZVCUDBSIMYRC-AWEZNQCLSA-N 0 3 402.336 4.230 20 0 HIADHN C[C@@H](CC(=O)Nc1ccc(Br)cc1)NCc1ccc2c(n1)CCCC2 ZINC000446902455 870821287 /nfs/dbraw/zinc/82/12/87/870821287.db2.gz NCEFKZQFUKSOFL-AWEZNQCLSA-N 0 3 402.336 4.230 20 0 HIADHN Cc1ccc(-n2ncc(C(=O)NC[C@H]3N(C)CCCC3(C)C)c2C(F)(F)F)cc1 ZINC000468480643 882448245 /nfs/dbraw/zinc/44/82/45/882448245.db2.gz UQCKIDHWSCEECV-QGZVFWFLSA-N 0 3 408.468 4.050 20 0 HIADHN Cc1ccc(CNC(=O)N(CCN(C)C)Cc2ccccn2)c(Oc2ccccc2)c1 ZINC000446942763 870852441 /nfs/dbraw/zinc/85/24/41/870852441.db2.gz FWFGBGCTNGTXBO-UHFFFAOYSA-N 0 3 418.541 4.456 20 0 HIADHN COC[C@H](C)OC[C@@H](O)CN(C)C(c1ccc(Cl)cc1)c1ccc(Cl)cc1 ZINC000447008554 870888577 /nfs/dbraw/zinc/88/85/77/870888577.db2.gz WCMXILAEEGEAQB-YWZLYKJASA-N 0 3 412.357 4.427 20 0 HIADHN COC(=O)[C@](C)(CN[C@@H](C)C(=O)Nc1c(C)cccc1C(C)C)c1ccc(F)cc1 ZINC000447024398 870900497 /nfs/dbraw/zinc/90/04/97/870900497.db2.gz WUXVRCJMHZHEIN-BXKMTCNYSA-N 0 3 414.521 4.305 20 0 HIADHN COC(=O)[C@@](C)(CN[C@@H](C)C(=O)Nc1c(C)cc(C)cc1Cl)c1ccc(F)cc1 ZINC000447033037 870908775 /nfs/dbraw/zinc/90/87/75/870908775.db2.gz CVBUEXDMXBZMPW-NYHFZMIOSA-N 0 3 420.912 4.143 20 0 HIADHN COC1(CO)CCN(Cc2cccc(NC(=O)c3ccc(Cl)cc3Cl)c2)CC1 ZINC000447081031 870968469 /nfs/dbraw/zinc/96/84/69/870968469.db2.gz BLAASMNTYKOAGU-UHFFFAOYSA-N 0 3 423.340 4.219 20 0 HIADHN CN1CCC2(CCN(Cc3ccc(OC(F)(F)[C@@H](F)C(F)(F)F)cc3)CC2)C1=O ZINC000447084504 870975591 /nfs/dbraw/zinc/97/55/91/870975591.db2.gz FNTCLDBCFSKCKB-HNNXBMFYSA-N 0 3 424.385 4.003 20 0 HIADHN COCCO[C@H]1C[C@@H](CO)CN(Cc2ccc(-c3ccc(Cl)c(Cl)c3)o2)C1 ZINC000447093679 870991370 /nfs/dbraw/zinc/99/13/70/870991370.db2.gz LUULPDDHZFSYEM-PBHICJAKSA-N 0 3 414.329 4.099 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)NC(c1ccc(F)cc1)c1ccc(F)cc1 ZINC000447317559 871210337 /nfs/dbraw/zinc/21/03/37/871210337.db2.gz FFUIOGLBIOKQGV-UHFFFAOYSA-N 0 3 413.468 4.421 20 0 HIADHN C[C@H](c1nc(Cc2ccc(F)cc2)no1)N1CC[C@H](C)N(Cc2ccccc2)CC1 ZINC000447344805 871246050 /nfs/dbraw/zinc/24/60/50/871246050.db2.gz DERZBDMGOZXVSF-RBUKOAKNSA-N 0 3 408.521 4.457 20 0 HIADHN COCCO[C@H]1C[C@H](CO)CN(Cc2ccc(Oc3ccc(Cl)cc3C)cc2)C1 ZINC000447380114 871285742 /nfs/dbraw/zinc/28/57/42/871285742.db2.gz CWEBVDUXXSTUMN-UGKGYDQZSA-N 0 3 419.949 4.287 20 0 HIADHN COC(=O)c1coc([C@H](C)NC[C@@H]2CCN(c3cccc(Br)c3)C2)c1 ZINC000447545260 871411498 /nfs/dbraw/zinc/41/14/98/871411498.db2.gz WZTFLNPSTXZSNE-KBPBESRZSA-N 0 3 407.308 4.006 20 0 HIADHN CC(C)[C@@H]1C[C@@H](NCc2cccc(NC(=O)CCN3CCOCC3)c2)c2ccccc21 ZINC000447546638 871417693 /nfs/dbraw/zinc/41/76/93/871417693.db2.gz XNBGZPADEXKCGK-LOSJGSFVSA-N 0 3 421.585 4.322 20 0 HIADHN CN(C)Cc1cccc(C(=O)N2CCC(Nc3cccc(Br)c3)CC2)c1 ZINC000447690035 871623729 /nfs/dbraw/zinc/62/37/29/871623729.db2.gz APVQOAQDMKRUKY-UHFFFAOYSA-N 0 3 416.363 4.227 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@@H](C)NCc2nc(-c3ccccc3)c[nH]2)CC1 ZINC000447847232 871769026 /nfs/dbraw/zinc/76/90/26/871769026.db2.gz YZILJFFYTVSSKL-GOSISDBHSA-N 0 3 407.537 4.209 20 0 HIADHN FC(F)(F)c1ccc(N2CCC(NCc3nc(-c4ccccc4)c[nH]3)CC2)nc1 ZINC000447850831 871771562 /nfs/dbraw/zinc/77/15/62/871771562.db2.gz XIJSDOJVGOTPRX-UHFFFAOYSA-N 0 3 401.436 4.249 20 0 HIADHN CC(C)(C)c1cnc(CNC[C@H](CO)Cc2ccc(OC(F)(F)F)cc2)s1 ZINC000447895012 871807206 /nfs/dbraw/zinc/80/72/06/871807206.db2.gz XBMDJECQOXROKU-CQSZACIVSA-N 0 3 402.482 4.280 20 0 HIADHN CC(C)(C)c1cnc(CNC[C@H](CO)Cc2cccc(OC(F)(F)F)c2)s1 ZINC000447936947 871818966 /nfs/dbraw/zinc/81/89/66/871818966.db2.gz TZHXGPXRPXJJPV-CQSZACIVSA-N 0 3 402.482 4.280 20 0 HIADHN COc1cc(CN[C@@H]2C[C@H](C(C)C)c3ccccc32)cc(Cl)c1OCC(N)=O ZINC000447985540 871836272 /nfs/dbraw/zinc/83/62/72/871836272.db2.gz GJZZJNKJXWLYKB-IEBWSBKVSA-N 0 3 402.922 4.187 20 0 HIADHN O=C(CN1CCC[C@H]2CCC[C@H]21)N(Cc1nnc(-c2ccccc2Cl)o1)C1CC1 ZINC000448023833 871864862 /nfs/dbraw/zinc/86/48/62/871864862.db2.gz VFZWIPIVHGGBKB-DNVCBOLYSA-N 0 3 414.937 4.146 20 0 HIADHN O=C(CN1CCC[C@H]2CCC[C@@H]21)N(Cc1nnc(-c2ccccc2Cl)o1)C1CC1 ZINC000448023832 871865153 /nfs/dbraw/zinc/86/51/53/871865153.db2.gz VFZWIPIVHGGBKB-BEFAXECRSA-N 0 3 414.937 4.146 20 0 HIADHN CO[C@@H]1CCOc2c(NC(=O)NC[C@@H](c3ccc(C)cc3)N3CCCC3)cccc21 ZINC000448050638 871881656 /nfs/dbraw/zinc/88/16/56/871881656.db2.gz OUGGSVQYPIMYQH-FCHUYYIVSA-N 0 3 409.530 4.424 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)Nc2cc(-c3cccc(F)c3)on2)CC1 ZINC000448094234 871931304 /nfs/dbraw/zinc/93/13/04/871931304.db2.gz MJYHSDNHEZCFLR-UHFFFAOYSA-N 0 3 408.477 4.609 20 0 HIADHN CC[C@H]1C[C@H](C)CN1CC(=O)N(Cc1nnc(-c2ccccc2Cl)o1)C1CC1 ZINC000448093556 871932480 /nfs/dbraw/zinc/93/24/80/871932480.db2.gz AOHZKOWLNKFRCD-GJZGRUSLSA-N 0 3 402.926 4.001 20 0 HIADHN CCCN(C(=O)NC[C@]1(C)CCO[C@@H]1C1CC1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000468536205 882564197 /nfs/dbraw/zinc/56/41/97/882564197.db2.gz LSSSQBHBYAQPRS-ARNLJNQMSA-N 0 3 413.606 4.278 20 0 HIADHN CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)NCc1ccc(-c2ccco2)cc1F ZINC000448249512 872166746 /nfs/dbraw/zinc/16/67/46/872166746.db2.gz ORCUKBWIULBQHA-REWPJTCUSA-N 0 3 422.504 4.315 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)Nc2ccc(Br)c(Cl)c2)CC1 ZINC000448331036 872270386 /nfs/dbraw/zinc/27/03/86/872270386.db2.gz GRWSJKAOKBEYQX-UHFFFAOYSA-N 0 3 418.763 4.113 20 0 HIADHN COc1ccc([C@@H](CNC(=O)CCCc2ccc(O)c(F)c2)N2CCCCC2)cc1 ZINC000468552783 882599214 /nfs/dbraw/zinc/59/92/14/882599214.db2.gz IKSGNVNOAJGDAE-JOCHJYFZSA-N 0 3 414.521 4.206 20 0 HIADHN CCCCn1ncc(NC(=O)Nc2ccc(CCN3CCSCC3)cc2)c1C ZINC000448401038 872349407 /nfs/dbraw/zinc/34/94/07/872349407.db2.gz CFXLKRWXGDXARQ-UHFFFAOYSA-N 0 3 401.580 4.227 20 0 HIADHN CCN(C(=O)Nc1ccccc1OCC(F)F)[C@H]1CCN(Cc2ccccc2)C1 ZINC000460130255 872612301 /nfs/dbraw/zinc/61/23/01/872612301.db2.gz DIKTXQJNHYYTMA-SFHVURJKSA-N 0 3 403.473 4.459 20 0 HIADHN CCCN(CCN1CCN(CC)CC1)C(=O)N[C@H](C)c1cc(Cl)ccc1Cl ZINC000460144088 872650411 /nfs/dbraw/zinc/65/04/11/872650411.db2.gz UIVAUXUHUHVDRH-MRXNPFEDSA-N 0 3 415.409 4.114 20 0 HIADHN CCn1c([C@H](C)Oc2ccc3ccccc3c2)nnc1N(C)[C@H]1CCN(C2CC2)C1 ZINC000460204359 872783625 /nfs/dbraw/zinc/78/36/25/872783625.db2.gz UVNKALPLLHLLCZ-UWJYYQICSA-N 0 3 405.546 4.264 20 0 HIADHN Cc1ccccc1[C@@H]1CN(C(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)[C@@H](C)CO1 ZINC000460380078 873019698 /nfs/dbraw/zinc/01/96/98/873019698.db2.gz LAVGWTJXENSMRI-OFVILXPXSA-N 0 3 421.585 4.128 20 0 HIADHN CCN1C[C@H](C)N(c2nnc([C@H]3CCO[C@@H]3c3ccccc3)n2CC(C)C)C[C@@H]1C ZINC000460583882 873319975 /nfs/dbraw/zinc/31/99/75/873319975.db2.gz HAJURMLYBVEXGP-BLKABHOGSA-N 0 3 411.594 4.098 20 0 HIADHN CCOCCCn1c([C@H](CC)c2ccccc2)nnc1N1C[C@@H](C)N(CC)C[C@@H]1C ZINC000460765526 873609238 /nfs/dbraw/zinc/60/92/38/873609238.db2.gz ALOHMGVCNDLUCR-RZUBCFFCSA-N 0 3 413.610 4.166 20 0 HIADHN CC1CCN([C@H](CNC(=O)[C@H]2C[C@H]2c2ccc3c(c2)OCCO3)c2ccccc2)CC1 ZINC000460967217 873863781 /nfs/dbraw/zinc/86/37/81/873863781.db2.gz YQHCWOFLXPETAK-RJGXRXQPSA-N 0 3 420.553 4.151 20 0 HIADHN CCSc1cc(Cl)ccc1C(=O)NCc1ccc(CN2CCN(C)CC2)cc1 ZINC000460968702 873865054 /nfs/dbraw/zinc/86/50/54/873865054.db2.gz JFWMEXPYHIOQNS-UHFFFAOYSA-N 0 3 418.006 4.129 20 0 HIADHN CCN(C(=O)c1cccc(OCCCOC)c1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000460971263 873867125 /nfs/dbraw/zinc/86/71/25/873867125.db2.gz SZHZVNVZVPYGTE-REWPJTCUSA-N 0 3 410.558 4.400 20 0 HIADHN CC[C@@H](NC[C@H]1CN(C(=O)c2ccccc2)[C@H]2CCN1C2)c1cccc(Cl)c1F ZINC000461101822 874020473 /nfs/dbraw/zinc/02/04/73/874020473.db2.gz FNFCJHCOWCJRQT-BBTUJRGHSA-N 0 3 415.940 4.119 20 0 HIADHN COCCN1CCC[C@H]1CNC(=O)C1(c2cccc(C(F)(F)F)c2)CCCCC1 ZINC000461108538 874030917 /nfs/dbraw/zinc/03/09/17/874030917.db2.gz NEJZNVFCWGLMMK-IBGZPJMESA-N 0 3 412.496 4.134 20 0 HIADHN C[C@@H](N[C@H]1CCCN(CC(C)(C)C)C1=O)c1ccc(NC(=O)c2ccncc2)cc1 ZINC000461358604 874359725 /nfs/dbraw/zinc/35/97/25/874359725.db2.gz CQAWRPAQKJHEJW-UTKZUKDTSA-N 0 3 408.546 4.022 20 0 HIADHN Cc1ccc(Br)cc1-c1nnc(N2CC[C@@H](N3CCCCC3)C2)s1 ZINC000468704970 882822280 /nfs/dbraw/zinc/82/22/80/882822280.db2.gz FLKKWJVNRIVCNP-OAHLLOKOSA-N 0 3 407.381 4.341 20 0 HIADHN C[C@H]1CC[C@H](C)N1CC(=O)Nc1ccc(CN2C(=O)Cc3ccc(Cl)cc32)cc1 ZINC000468719073 882828020 /nfs/dbraw/zinc/82/80/20/882828020.db2.gz GWGAADYCYJYDOM-HOTGVXAUSA-N 0 3 411.933 4.241 20 0 HIADHN C[C@H](CC(=O)N1C[C@H]2CCN(Cc3ccccc3)C[C@H]2C1)C(=O)c1cccc(F)c1 ZINC000461446986 874504739 /nfs/dbraw/zinc/50/47/39/874504739.db2.gz FXBCKXVCEUVYEM-QIJUGHKUSA-N 0 3 408.517 4.015 20 0 HIADHN C[C@@H]1[C@H](NC(=O)N2CCCC[C@H]2c2nnc(C3CCC3)o2)CCN1Cc1ccccc1 ZINC000461539402 874626818 /nfs/dbraw/zinc/62/68/18/874626818.db2.gz XJYWPQJCKXSSEQ-UIFIKXQLSA-N 0 3 423.561 4.237 20 0 HIADHN CC[C@@H](c1nnc(N(C)[C@@H]2CCN(C3CC3)C2)n1C[C@H]1CCCCO1)c1ccccc1 ZINC000461817699 874938914 /nfs/dbraw/zinc/93/89/14/874938914.db2.gz AWDZBHKOKPYQCX-DNVJHFABSA-N 0 3 423.605 4.062 20 0 HIADHN Cc1c([C@@H](C)N[C@H](C)c2cc(F)ccc2N2CCN(C)CC2)cnn1C(C)(C)C ZINC000468835116 882882133 /nfs/dbraw/zinc/88/21/33/882882133.db2.gz FVZXNUXIINEJGY-IAGOWNOFSA-N 0 3 401.574 4.249 20 0 HIADHN CN(C)Cc1cccc(C(=O)N[C@H](Cn2cnc3ccccc32)c2ccc(F)cc2)c1 ZINC000461872754 875023745 /nfs/dbraw/zinc/02/37/45/875023745.db2.gz WXZYFEACRRXYQH-HSZRJFAPSA-N 0 3 416.500 4.408 20 0 HIADHN O=C(Nc1ccccc1Br)C1CCN(CCc2ccccc2F)CC1 ZINC000468860458 882894285 /nfs/dbraw/zinc/89/42/85/882894285.db2.gz FMWHEGOHTSFUTK-UHFFFAOYSA-N 0 3 405.311 4.481 20 0 HIADHN Cc1ccc(CN(Cc2ccco2)C(=O)CCN2CCN(c3ccccc3)CC2)s1 ZINC000461968617 875093802 /nfs/dbraw/zinc/09/38/02/875093802.db2.gz ARLAJIKVGMHHTG-UHFFFAOYSA-N 0 3 423.582 4.391 20 0 HIADHN Cc1csc(-c2ccc(NC(=O)CCN3CCN(c4ccccc4)CC3)cc2)n1 ZINC000462010678 875131063 /nfs/dbraw/zinc/13/10/63/875131063.db2.gz ZEKOINOCEIDSJT-UHFFFAOYSA-N 0 3 406.555 4.269 20 0 HIADHN O=C(CCN1CCN(c2ccccc2)CC1)N(Cc1ccco1)Cc1ccccc1 ZINC000462024350 875140894 /nfs/dbraw/zinc/14/08/94/875140894.db2.gz NTEMIMPXCZZYSE-UHFFFAOYSA-N 0 3 403.526 4.021 20 0 HIADHN CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)N[C@@H]1CCc2sc(Cl)cc21 ZINC000462050990 875163261 /nfs/dbraw/zinc/16/32/61/875163261.db2.gz COIDOHSUCIHILS-GMBSWORKSA-N 0 3 404.967 4.118 20 0 HIADHN Cc1ccccc1-c1cc(NC(=O)NC[C@H](c2cccs2)N2CCCC2)n(C)n1 ZINC000462085424 875193256 /nfs/dbraw/zinc/19/32/56/875193256.db2.gz RSGFFLHHUXZQBI-LJQANCHMSA-N 0 3 409.559 4.416 20 0 HIADHN CC(C)(C)c1ccccc1S(=O)(=O)NC1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1 ZINC000462138892 875238623 /nfs/dbraw/zinc/23/86/23/875238623.db2.gz XCEWDXSHQHCQRB-SEJPIABJSA-N 0 3 412.599 4.458 20 0 HIADHN CN(C(=O)N[C@H]1CCCc2cn(C3CCCC3)nc21)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000462154728 875251952 /nfs/dbraw/zinc/25/19/52/875251952.db2.gz JZHRMPIQJRIJJF-PKTZIBPZSA-N 0 3 421.589 4.292 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C1(c2cccc(Cl)c2)CCOCC1 ZINC000462162026 875257244 /nfs/dbraw/zinc/25/72/44/875257244.db2.gz ZKJDZPWDHYSKRK-GCJKJVERSA-N 0 3 412.961 4.025 20 0 HIADHN Cc1nc(COc2cccc(C(=O)N[C@@H]3CN(Cc4ccccc4)C[C@@H]3C)c2)cs1 ZINC000462166200 875261454 /nfs/dbraw/zinc/26/14/54/875261454.db2.gz FAXKTBKSUZXPQX-GAJHUEQPSA-N 0 3 421.566 4.281 20 0 HIADHN Cc1cc(C(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)ccc1NC(=O)CC(C)C ZINC000462172779 875270445 /nfs/dbraw/zinc/27/04/45/875270445.db2.gz XTNNTHCLOQMVST-XXBNENTESA-N 0 3 407.558 4.230 20 0 HIADHN Cc1noc(C)c1COc1cccc(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)c1 ZINC000462194994 875302691 /nfs/dbraw/zinc/30/26/91/875302691.db2.gz YFXKTFYWFVGQHH-MZNJEOGPSA-N 0 3 419.525 4.121 20 0 HIADHN O=C(CCCc1ccc([O-])c(F)c1)N1CCC2(CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000468882880 882919850 /nfs/dbraw/zinc/91/98/50/882919850.db2.gz IBOIGSSQQAKXOP-UHFFFAOYSA-N 0 3 410.533 4.369 20 0 HIADHN O=C(CCCc1ccc([O-])c(F)c1)N1CCC2(CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000468882880 882919883 /nfs/dbraw/zinc/91/98/83/882919883.db2.gz IBOIGSSQQAKXOP-UHFFFAOYSA-N 0 3 410.533 4.369 20 0 HIADHN CCN(C(=O)c1ccc(COCCOC)cc1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000462242594 875358200 /nfs/dbraw/zinc/35/82/00/875358200.db2.gz BPUCERUFKGJDOB-GBXCKJPGSA-N 0 3 410.558 4.147 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)Nc1ccc(OCc2ccncc2)cc1 ZINC000462243858 875360380 /nfs/dbraw/zinc/36/03/80/875360380.db2.gz CVARYHNQVWNRSK-CYFREDJKSA-N 0 3 416.525 4.303 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)Nc1cccc(NC(=O)c2ccoc2)c1 ZINC000462256967 875380700 /nfs/dbraw/zinc/38/07/00/875380700.db2.gz UZYKQCJGJCRBHL-VGSWGCGISA-N 0 3 418.497 4.174 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)c(C)c1 ZINC000462258467 875382136 /nfs/dbraw/zinc/38/21/36/875382136.db2.gz LMSATGLMCQKPIW-SELNLUPBSA-N 0 3 422.573 4.165 20 0 HIADHN COc1ccc(NC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)c(C(F)(F)F)c1 ZINC000462275232 875403598 /nfs/dbraw/zinc/40/35/98/875403598.db2.gz RWTHQIUVUKXGRY-AUUYWEPGSA-N 0 3 407.436 4.356 20 0 HIADHN C[C@H](CC(=O)N[C@@H]1CN(C)C[C@H]1c1ccccc1)c1ccc(F)c(Br)c1 ZINC000462282877 875409464 /nfs/dbraw/zinc/40/94/64/875409464.db2.gz XVDZBPHARYODOS-CFLQYTFWSA-N 0 3 419.338 4.296 20 0 HIADHN CC(C)(CNC(=O)N[C@@H]1CCO[C@@H](c2ccccc2)C1)N1CCc2ccccc2C1 ZINC000462299964 875421542 /nfs/dbraw/zinc/42/15/42/875421542.db2.gz UZAWGGPOAPSELU-DHIUTWEWSA-N 0 3 407.558 4.043 20 0 HIADHN COc1ccc([C@H](CNC(=O)CCc2cncc3ccccc32)N2CCCC2)cc1 ZINC000462399535 875507232 /nfs/dbraw/zinc/50/72/32/875507232.db2.gz BMHYXYPJTYUSMF-DEOSSOPVSA-N 0 3 403.526 4.129 20 0 HIADHN C[C@H](NCC(=O)NCCCN1CCCCCC1=O)c1ccc(Cl)c2ccccc21 ZINC000462452156 875559675 /nfs/dbraw/zinc/55/96/75/875559675.db2.gz AIELXGVPMYNSAP-KRWDZBQOSA-N 0 3 415.965 4.053 20 0 HIADHN Cc1nc(C(F)(F)F)sc1C(=O)NC[C@@H](c1ccc(OC(C)C)cc1)N(C)C ZINC000462466131 875573847 /nfs/dbraw/zinc/57/38/47/875573847.db2.gz NXLXLVQJHGYEBE-HNNXBMFYSA-N 0 3 415.481 4.290 20 0 HIADHN C[C@@H](NCc1cnn([C@@]2(C)CCS(=O)(=O)C2)c1)c1ccc(Cl)c2ccccc21 ZINC000462527611 875645225 /nfs/dbraw/zinc/64/52/25/875645225.db2.gz SRUYVQCVOMFOOA-VFNWGFHPSA-N 0 3 417.962 4.074 20 0 HIADHN COc1ccc(OCc2nc(CN[C@H]3CN(Cc4ccccc4)C[C@@H]3C)cs2)cc1 ZINC000462553032 875678193 /nfs/dbraw/zinc/67/81/93/875678193.db2.gz PPGHHFXMXDNOPJ-MBSDFSHPSA-N 0 3 423.582 4.341 20 0 HIADHN OC[C@@H](CNCc1cc(Br)ccc1F)Cc1c(F)cccc1Cl ZINC000462739214 875809773 /nfs/dbraw/zinc/80/97/73/875809773.db2.gz NNMJFQMCFDUMHE-LLVKDONJSA-N 0 3 404.682 4.322 20 0 HIADHN COC(=O)c1cc(CN[C@@H]2c3cc(Br)ccc3SC[C@@H]2C)n(C)c1C ZINC000462784319 875839000 /nfs/dbraw/zinc/83/90/00/875839000.db2.gz DJPKCNLIHXTCOE-VOJFVSQTSA-N 0 3 423.376 4.455 20 0 HIADHN Cc1nc2ccc(Br)cc2c(N2CCN(Cc3cscn3)CC2)c1C ZINC000462787409 875840200 /nfs/dbraw/zinc/84/02/00/875840200.db2.gz BFSGNNRIJCEJRB-UHFFFAOYSA-N 0 3 417.376 4.393 20 0 HIADHN COc1ccc(C[C@@H](NCc2c3c(nn2C)CCCC3)c2ccc(OC)cc2)cc1 ZINC000462811712 875854904 /nfs/dbraw/zinc/85/49/04/875854904.db2.gz KTLBMYFPCDCKJR-XMMPIXPASA-N 0 3 405.542 4.390 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@@H](C)N[C@H]2CCCc3ccc(O)cc32)cc1 ZINC000462814013 875856187 /nfs/dbraw/zinc/85/61/87/875856187.db2.gz CPPRYCKZHITUDK-ZHRRBRCNSA-N 0 3 402.560 4.151 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1[nH]c2ccccc2c1Br ZINC000462823020 875861797 /nfs/dbraw/zinc/86/17/97/875861797.db2.gz RJRIIEJHJCJDIX-KDOFPFPSSA-N 0 3 412.331 4.181 20 0 HIADHN COC(=O)CCCN1CCC(Nc2cc(Cl)ccc2OC[C@@H]2CCCCO2)CC1 ZINC000462903772 875929490 /nfs/dbraw/zinc/92/94/90/875929490.db2.gz BUADTECTSVQLMW-IBGZPJMESA-N 0 3 424.969 4.117 20 0 HIADHN COC(=O)c1cc(CN2CCC[C@@H](c3nc4ccccc4n3C(C)C)C2)n(C)c1C ZINC000462954030 875971519 /nfs/dbraw/zinc/97/15/19/875971519.db2.gz AMYNAYFVZRIWPZ-GOSISDBHSA-N 0 3 408.546 4.430 20 0 HIADHN C[C@@H]1CCN(C(=O)N[C@H]2CCO[C@H](c3ccccc3)C2)CCN1Cc1ccccc1 ZINC000463015040 876031734 /nfs/dbraw/zinc/03/17/34/876031734.db2.gz WWOUSPZNQRSMFM-QDSKXPNFSA-N 0 3 407.558 4.213 20 0 HIADHN Cc1cccc([C@H](NC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)c2ccccn2)c1 ZINC000463023741 876042789 /nfs/dbraw/zinc/04/27/89/876042789.db2.gz YYQZINWKZCBSIH-ZPZUNKDASA-N 0 3 414.553 4.299 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)[C@@]3(C)CCc4ccccc4C3)CC2)c1 ZINC000463100979 876136481 /nfs/dbraw/zinc/13/64/81/876136481.db2.gz ZSKCQZVMMKOLGM-MHZLTWQESA-N 0 3 419.613 4.209 20 0 HIADHN Cc1nc(-c2cccc(C(=O)NCC3(N4CCSCC4)CCCC3)c2)cs1 ZINC000463112746 876151728 /nfs/dbraw/zinc/15/17/28/876151728.db2.gz WKAYYASQRMMUHJ-UHFFFAOYSA-N 0 3 401.601 4.210 20 0 HIADHN CC(C)n1cc(Br)cc1C(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000463152172 876204496 /nfs/dbraw/zinc/20/44/96/876204496.db2.gz REZWLWSVLUEVAV-CRAIPNDOSA-N 0 3 404.352 4.397 20 0 HIADHN COc1ccc(-c2ncc(C(=O)N(CCN(C)C)CC3CCCCC3)s2)cc1 ZINC000463191889 876251591 /nfs/dbraw/zinc/25/15/91/876251591.db2.gz QOIPJSYQLXLYGT-UHFFFAOYSA-N 0 3 401.576 4.403 20 0 HIADHN C[C@@H](NC(=O)N1CCN(CC2CCOCC2)CC1)c1ccc(Cl)c2ccccc21 ZINC000463267486 876325325 /nfs/dbraw/zinc/32/53/25/876325325.db2.gz RGMJBOMYYUYASQ-QGZVFWFLSA-N 0 3 415.965 4.308 20 0 HIADHN COc1ccccc1[C@H](NC(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C)c1ccco1 ZINC000463272973 876331815 /nfs/dbraw/zinc/33/18/15/876331815.db2.gz WGLQXUICONEZMP-JLGINSKQSA-N 0 3 419.525 4.197 20 0 HIADHN CCc1nc2c(s1)[C@H](N(C)C(=O)N[C@H]1CN(Cc3ccccc3)C[C@@H]1C)CCC2 ZINC000463280079 876335777 /nfs/dbraw/zinc/33/57/77/876335777.db2.gz RANYBNIVJIEUIS-FFZOFVMBSA-N 0 3 412.603 4.245 20 0 HIADHN COC(=O)CCCN1CCC(Nc2ccc(NC(=O)c3ccco3)c(Cl)c2)CC1 ZINC000463284368 876343930 /nfs/dbraw/zinc/34/39/30/876343930.db2.gz QZJMLMOEMKPASK-UHFFFAOYSA-N 0 3 419.909 4.015 20 0 HIADHN COC(=O)CCCN1CCC(Nc2ccc(F)c(NC(=O)C3CCCCC3)c2)CC1 ZINC000463303900 876364350 /nfs/dbraw/zinc/36/43/50/876364350.db2.gz RDDBSVLNDPGSBF-UHFFFAOYSA-N 0 3 419.541 4.174 20 0 HIADHN CCN(CC)[C@H](CNC(=O)[C@H]1SCCc2sccc21)c1cccc(OC)c1 ZINC000463341138 876397141 /nfs/dbraw/zinc/39/71/41/876397141.db2.gz ULBOHOQZMSWFHN-QUCCMNQESA-N 0 3 404.601 4.286 20 0 HIADHN NC(=O)c1ccc(NC(=O)CCN2CCC(c3cccc(Cl)c3Cl)CC2)cc1 ZINC000463375545 876431565 /nfs/dbraw/zinc/43/15/65/876431565.db2.gz MJCDADJIZMUQHU-UHFFFAOYSA-N 0 3 420.340 4.301 20 0 HIADHN O=C(CCN1Cc2ccc(O)cc2C2(CC2)C1)Nc1ccccc1Br ZINC000463424842 876479155 /nfs/dbraw/zinc/47/91/55/876479155.db2.gz QZSBMEAFVRYJPN-UHFFFAOYSA-N 0 3 401.304 4.031 20 0 HIADHN CC(C)N(Cc1ccccc1)C(=O)[C@@H](C)N1CCC[C@@](CO)(Cc2ccccc2)C1 ZINC000463433540 876489291 /nfs/dbraw/zinc/48/92/91/876489291.db2.gz DSPDNGPFENDFGZ-ATIYNZHBSA-N 0 3 408.586 4.129 20 0 HIADHN OC[C@]1(Cc2ccccc2)CCCN(C[C@H](O)COc2ccc(Cl)cc2Cl)C1 ZINC000463434072 876489886 /nfs/dbraw/zinc/48/98/86/876489886.db2.gz CJSWSACVRFQFNV-UGKGYDQZSA-N 0 3 424.368 4.050 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)[C@@H]1C[C@H]1c1cc(F)c(F)c(F)c1 ZINC000463526978 876599845 /nfs/dbraw/zinc/59/98/45/876599845.db2.gz IJHKGLDOAURMBF-JKSUJKDBSA-N 0 3 412.402 4.076 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)[C@@H]2C[C@H]2c2cc(F)c(F)c(F)c2)CC1 ZINC000463574070 876669850 /nfs/dbraw/zinc/66/98/50/876669850.db2.gz MFEOVZNXMUTIAI-RBUKOAKNSA-N 0 3 402.460 4.330 20 0 HIADHN O=C(CCN1CCN(c2ccccc2)CC1)N(Cc1ccsc1)c1ccccc1 ZINC000468996821 883061843 /nfs/dbraw/zinc/06/18/43/883061843.db2.gz MXIYBBMQLWEREA-UHFFFAOYSA-N 0 3 405.567 4.494 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)CCC1CCOCC1)c1ccc(C(F)(F)F)cc1 ZINC000463664477 876786842 /nfs/dbraw/zinc/78/68/42/876786842.db2.gz NNEDOFUDELTHEV-IBGZPJMESA-N 0 3 400.485 4.411 20 0 HIADHN CN(C)[C@@H](CNC(=O)Nc1cccc(-c2ncc3n2CCCC3)c1)Cc1ccccc1 ZINC000463700594 876820364 /nfs/dbraw/zinc/82/03/64/876820364.db2.gz UKGKJGNZRUGOEO-HSZRJFAPSA-N 0 3 417.557 4.181 20 0 HIADHN CN(C)[C@H](CNC(=O)Nc1cccc(-c2ncc3n2CCCC3)c1)Cc1ccccc1 ZINC000463700596 876820594 /nfs/dbraw/zinc/82/05/94/876820594.db2.gz UKGKJGNZRUGOEO-QHCPKHFHSA-N 0 3 417.557 4.181 20 0 HIADHN CCCN(C(=O)CCCn1c(C)cc(=O)cc1C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000463718949 876838203 /nfs/dbraw/zinc/83/82/03/876838203.db2.gz WQSHZBYFNPSLBK-DEOSSOPVSA-N 0 3 423.601 4.149 20 0 HIADHN C[C@@H]1CCN(C(=O)[C@H]2C[C@@H]2c2cc(F)c(F)c(F)c2)CCN1Cc1ccccc1 ZINC000463769775 876891752 /nfs/dbraw/zinc/89/17/52/876891752.db2.gz PLMHAORDFMGNJH-LZQZEXGQSA-N 0 3 402.460 4.330 20 0 HIADHN CN(C(=O)C(C)(C)c1csc(-c2cc(F)ccc2F)n1)[C@H]1CCN(C2CC2)C1 ZINC000463775043 876895517 /nfs/dbraw/zinc/89/55/17/876895517.db2.gz ZLSXNNRNZRNGIA-HNNXBMFYSA-N 0 3 405.514 4.061 20 0 HIADHN Cn1cc(N2CCC[C@@H](N[C@@H](Cc3ccccc3Cl)c3ccccc3)C2=O)cn1 ZINC000463908914 877031201 /nfs/dbraw/zinc/03/12/01/877031201.db2.gz ZAYMYMKHUOCBTC-YADHBBJMSA-N 0 3 408.933 4.143 20 0 HIADHN COc1ccc([C@H](CNC(=O)NC[C@H](C)Sc2ccccc2)N2CCCC2)cc1 ZINC000463951439 877073600 /nfs/dbraw/zinc/07/36/00/877073600.db2.gz ARLPCMAAAFPXAM-AVRDEDQJSA-N 0 3 413.587 4.312 20 0 HIADHN COc1ccc([C@H](CNC(=O)NCCc2c[nH]c3c2cccc3C)N2CCCC2)cc1 ZINC000463953573 877075514 /nfs/dbraw/zinc/07/55/14/877075514.db2.gz GQWIYIAZJOKCIU-QHCPKHFHSA-N 0 3 420.557 4.164 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)c1cccc(-c2noc(C3CC3)n2)c1 ZINC000464064042 877209662 /nfs/dbraw/zinc/20/96/62/877209662.db2.gz KAJXQOFLJBNLPI-GOSISDBHSA-N 0 3 416.525 4.351 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)CCc2cc(Br)cs2)CC1 ZINC000503239015 912218112 /nfs/dbraw/zinc/21/81/12/912218112.db2.gz FPSHJBPBZHGQRE-UHFFFAOYSA-N 0 3 411.365 4.159 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1ccn(-c2ccc(F)cc2F)n1)c1ccsc1 ZINC000464320945 877511264 /nfs/dbraw/zinc/51/12/64/877511264.db2.gz UUJSWBHKEUJDDU-LJQANCHMSA-N 0 3 404.486 4.025 20 0 HIADHN CN1CCC[C@H](CNC(=O)c2ccn(-c3ccc(F)cc3F)n2)[C@@H]1c1cccs1 ZINC000464338395 877529137 /nfs/dbraw/zinc/52/91/37/877529137.db2.gz FVFWONTVZYAUEU-JLTOFOAXSA-N 0 3 416.497 4.025 20 0 HIADHN Cc1cccc(S(=O)(=O)CCCN[C@H](C)c2ccc(OC(F)(F)F)cc2)c1 ZINC000464494672 877713205 /nfs/dbraw/zinc/71/32/05/877713205.db2.gz IDQLXZFDIOFWMS-OAHLLOKOSA-N 0 3 401.450 4.408 20 0 HIADHN CCN1CCC[C@@H](CN(C)C(=O)N[C@H]2CCCCC23CCCC3)[C@@H]1c1cnn(C)c1 ZINC000464561964 877780704 /nfs/dbraw/zinc/78/07/04/877780704.db2.gz SLSSHGDSDLBGSR-ILWGZMRPSA-N 0 3 415.626 4.338 20 0 HIADHN Cc1cc(C(=O)N(CC(C)C)C2CCN(C)CC2)c2ccc(Br)cc2n1 ZINC000464565974 877782342 /nfs/dbraw/zinc/78/23/42/877782342.db2.gz BFIJKQWHTIEBKW-UHFFFAOYSA-N 0 3 418.379 4.498 20 0 HIADHN O=C(CN(CCCOc1ccccc1)C1CCOCC1)N1CCC[C@H]2CCCC[C@H]21 ZINC000464575296 877797341 /nfs/dbraw/zinc/79/73/41/877797341.db2.gz FVDMNFGSMNUNPQ-ZJSXRUAMSA-N 0 3 414.590 4.118 20 0 HIADHN CO[C@@H](CNC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1)c1cccc(Cl)c1 ZINC000464592207 877818682 /nfs/dbraw/zinc/81/86/82/877818682.db2.gz HWQXFUBEFYIALC-NQIIRXRSSA-N 0 3 404.913 4.195 20 0 HIADHN Cc1nn(C(C)(C)C)cc1[C@@H](C)NC[C@H](O)COc1ccc(Cl)cc1Cl ZINC000464609763 877837449 /nfs/dbraw/zinc/83/74/49/877837449.db2.gz QFYRCMXMCBCJPV-DOMZBBRYSA-N 0 3 400.350 4.344 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cc(COc2ccccc2F)on1)c1ccsc1 ZINC000464658881 877879923 /nfs/dbraw/zinc/87/99/23/877879923.db2.gz WKEIRJVGZRGKKW-IBGZPJMESA-N 0 3 417.506 4.267 20 0 HIADHN CC[C@H]1CCCCN1CCNC(=O)C(=O)Nc1ccc2c(c1)c1ccccc1n2CC ZINC000503301490 912285083 /nfs/dbraw/zinc/28/50/83/912285083.db2.gz WHLTYISHCDPVOJ-IBGZPJMESA-N 0 3 420.557 4.134 20 0 HIADHN CCCN(CC(F)(F)F)C(=O)[C@H]1CCCN(Cc2cc(-c3ccccc3)no2)C1 ZINC000464727243 877963185 /nfs/dbraw/zinc/96/31/85/877963185.db2.gz BEBLSXAGOLTPSX-KRWDZBQOSA-N 0 3 409.452 4.355 20 0 HIADHN Cc1c(NC(=O)[C@H](C)N2CCCC3(C2)CCCCCC3)c(=O)n(-c2ccccc2)n1C ZINC000464766023 878006231 /nfs/dbraw/zinc/00/62/31/878006231.db2.gz RSWPSACROJAXPZ-FQEVSTJZSA-N 0 3 424.589 4.248 20 0 HIADHN CCS[C@@H]1CC[C@@H](N(C)CC(=O)N2CCC[C@H]2c2ccc3c(c2)OCCCO3)C1 ZINC000464777273 878019857 /nfs/dbraw/zinc/01/98/57/878019857.db2.gz UZYGQJMIMSJZDH-AQNXPRMDSA-N 0 3 418.603 4.117 20 0 HIADHN COc1cc2nc(CN(C)[C@@H](Cc3ccc(F)cc3)C(C)C)[nH]c(=O)c2cc1OC ZINC000464784881 878031493 /nfs/dbraw/zinc/03/14/93/878031493.db2.gz JVRAPMWLSVQROZ-IBGZPJMESA-N 0 3 413.493 4.191 20 0 HIADHN COc1ccc(CN(C)C(=O)CN(C)[C@H](Cc2ccc(F)cc2)C(C)C)cc1F ZINC000464786203 878033631 /nfs/dbraw/zinc/03/36/31/878033631.db2.gz WLUPNGOZVPCMMO-OAQYLSRUSA-N 0 3 404.501 4.131 20 0 HIADHN CCN(Cc1nn(-c2ccccc2)c2c1CCC2)CC1CCN(c2ccccn2)CC1 ZINC000464804094 878047878 /nfs/dbraw/zinc/04/78/78/878047878.db2.gz CNNJNQKPZJJDHY-UHFFFAOYSA-N 0 3 415.585 4.495 20 0 HIADHN CC(C)[C@@H](c1ccccc1Cl)N(C)C(=O)C(=O)Nc1cccc(CN(C)C)c1 ZINC000503323951 912303719 /nfs/dbraw/zinc/30/37/19/912303719.db2.gz GDWAYVHGXBMEOY-FQEVSTJZSA-N 0 3 401.938 4.196 20 0 HIADHN CCOc1ccc(-c2noc(CN3CC[C@H](C)N(Cc4ccccc4)CC3)n2)cc1 ZINC000464832539 878090417 /nfs/dbraw/zinc/09/04/17/878090417.db2.gz LWEGPAXKJQPZRB-IBGZPJMESA-N 0 3 406.530 4.232 20 0 HIADHN C[C@H](C(=O)Nc1ccccc1OC(F)F)N1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC000464838813 878102732 /nfs/dbraw/zinc/10/27/32/878102732.db2.gz OKBPDIDSNAMBLA-QZTJIDSGSA-N 0 3 417.500 4.211 20 0 HIADHN COc1cc(C(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)ccc1OCC(C)C ZINC000464898674 878205823 /nfs/dbraw/zinc/20/58/23/878205823.db2.gz YZKHHDMQDDOBAI-HXUWFJFHSA-N 0 3 410.558 4.467 20 0 HIADHN CCOc1cc(C)ccc1CNC(=O)Nc1ccc(N2CCN(CC)CC2)cc1C ZINC000464909234 878225259 /nfs/dbraw/zinc/22/52/59/878225259.db2.gz CMYOWPSDNBPKJQ-UHFFFAOYSA-N 0 3 410.562 4.166 20 0 HIADHN CCN(C[C@H]1CCN(Cc2ccccc2)C1)C(=O)[C@@H](C)CC(=O)c1ccccc1F ZINC000464960540 878301199 /nfs/dbraw/zinc/30/11/99/878301199.db2.gz KRKYECMIKGXXDH-FPOVZHCZSA-N 0 3 410.533 4.405 20 0 HIADHN Cc1ccc2c(CCC(=O)NCCCCN3CCN(c4ccccc4)CC3)c[nH]c2c1 ZINC000465033325 878397901 /nfs/dbraw/zinc/39/79/01/878397901.db2.gz PDOQGDYLFMHGHJ-UHFFFAOYSA-N 0 3 418.585 4.128 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)c1csc(-c2ccc(F)c(F)c2)n1 ZINC000503391634 912375335 /nfs/dbraw/zinc/37/53/35/912375335.db2.gz BYZJJKZANULQTQ-UHFFFAOYSA-N 0 3 407.511 4.354 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N[C@H](C)c2ccc(-n3cccn3)cc2)N(C)C)cc1 ZINC000465426159 878855924 /nfs/dbraw/zinc/85/59/24/878855924.db2.gz ROCJDXZNRAITGZ-JPYJTQIMSA-N 0 3 405.546 4.098 20 0 HIADHN COc1ccc(C2CCN(C(=O)NC[C@H](c3cccs3)N3CCCC3)CC2)cc1 ZINC000465426515 878856158 /nfs/dbraw/zinc/85/61/58/878856158.db2.gz SDNQCISCRUJLLR-OAQYLSRUSA-N 0 3 413.587 4.483 20 0 HIADHN C[C@@H](NC(=O)NC[C@@H](c1ccccc1)N1CCCC1)c1nc(-c2cccc(F)c2)no1 ZINC000465426671 878856353 /nfs/dbraw/zinc/85/63/53/878856353.db2.gz HPRCMBONDWXQGO-UZLBHIALSA-N 0 3 423.492 4.073 20 0 HIADHN C[C@@H]1CN(C(=O)NC[C@@H](c2cccs2)N2CCCC2)C[C@H](c2ccc(F)cc2)O1 ZINC000465427662 878857941 /nfs/dbraw/zinc/85/79/41/878857941.db2.gz JRMICCJPQIYWID-LSTHTHJFSA-N 0 3 417.550 4.196 20 0 HIADHN CC[C@@H](NC(=O)N[C@H]1CCN(Cc2ccccc2)C1)c1nc(C(F)(F)F)cs1 ZINC000465430413 878861563 /nfs/dbraw/zinc/86/15/63/878861563.db2.gz HPARWALFBQZFPW-LSDHHAIUSA-N 0 3 412.481 4.187 20 0 HIADHN C[C@@H]1CCN(C(=O)N[C@H](c2ccccc2)c2ccccn2)CCN1Cc1ccccc1 ZINC000465429841 878861673 /nfs/dbraw/zinc/86/16/73/878861673.db2.gz GWXKWGRFGQZNTR-PXDATVDWSA-N 0 3 414.553 4.477 20 0 HIADHN O=C(NCc1cc(Cl)ccc1OC(F)F)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000465433372 878864501 /nfs/dbraw/zinc/86/45/01/878864501.db2.gz MZVCUUIAQQHRTE-KRWDZBQOSA-N 0 3 409.864 4.015 20 0 HIADHN Cc1ccc(-c2nc(CNC(=O)NC[C@H](c3cccs3)N3CCCC3)co2)cc1 ZINC000465432755 878864763 /nfs/dbraw/zinc/86/47/63/878864763.db2.gz LUMCPLHVVZJEGK-LJQANCHMSA-N 0 3 410.543 4.348 20 0 HIADHN O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N[C@@H]1COc2c1ccc(Cl)c2Cl ZINC000465434600 878866355 /nfs/dbraw/zinc/86/63/55/878866355.db2.gz RHJQXHVUBIZDRQ-RHSMWYFYSA-N 0 3 406.313 4.001 20 0 HIADHN C[C@@H](NC(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1)c1nc(C(C)(C)C)no1 ZINC000465433951 878866627 /nfs/dbraw/zinc/86/66/27/878866627.db2.gz OVNFAYUZYJCSTM-CVEARBPZSA-N 0 3 419.595 4.262 20 0 HIADHN O=C(NCc1ccc(-c2cccnc2)cc1)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000465436957 878869372 /nfs/dbraw/zinc/86/93/72/878869372.db2.gz DZQILSQXIPEUSE-DEOSSOPVSA-N 0 3 400.526 4.385 20 0 HIADHN COc1cccc([C@H](CNC(=O)N[C@@H](c2nc(C)cs2)C2CC2)N2CCCC2)c1 ZINC000465464582 878897654 /nfs/dbraw/zinc/89/76/54/878897654.db2.gz DJGVSNYHDHHIDJ-VQTJNVASSA-N 0 3 414.575 4.048 20 0 HIADHN COc1cccc([C@H](CNC(=O)NCc2cc(F)ccc2SC)N2CCCC2)c1 ZINC000465472672 878910069 /nfs/dbraw/zinc/91/00/69/878910069.db2.gz HOHUGKIRHAODQM-FQEVSTJZSA-N 0 3 417.550 4.193 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CCC(C(F)(F)F)CC1)c1cccc(OC)c1 ZINC000465499749 878938661 /nfs/dbraw/zinc/93/86/61/878938661.db2.gz IXEQMCUEWWMSDH-SFHVURJKSA-N 0 3 401.473 4.062 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NC[C@@H](OC)c1cccc(Cl)c1)c1ccsc1 ZINC000465532508 878989811 /nfs/dbraw/zinc/98/98/11/878989811.db2.gz FWGZSARFNVIDBF-RTBURBONSA-N 0 3 409.983 4.471 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)NCCc1c[nH]c2ccc(Cl)cc12 ZINC000465535845 878996383 /nfs/dbraw/zinc/99/63/83/878996383.db2.gz ZSPFFJISPBUHGR-UHFFFAOYSA-N 0 3 410.949 4.111 20 0 HIADHN Cc1ccc([C@@H]2C[C@@H](C)CCN2C(=O)NCc2ccc(CN3CCN(C)CC3)cc2)o1 ZINC000465558171 879027414 /nfs/dbraw/zinc/02/74/14/879027414.db2.gz NAOKWVPDPQVIBS-CVDCTZTESA-N 0 3 424.589 4.018 20 0 HIADHN C[C@@H](NC(=O)N[C@@H](CN1CCCC1)c1ccccc1)c1cccc(-n2cccn2)c1 ZINC000465598992 879087557 /nfs/dbraw/zinc/08/75/57/879087557.db2.gz MTBXJHIMGUVJIC-XXBNENTESA-N 0 3 403.530 4.070 20 0 HIADHN O=C(NCc1c(F)cccc1OC(F)F)N[C@H](CN1CCCC1)c1ccccc1 ZINC000465605931 879098907 /nfs/dbraw/zinc/09/89/07/879098907.db2.gz QFWGDMVJWZSJQY-GOSISDBHSA-N 0 3 407.436 4.063 20 0 HIADHN CO[C@H](CNC(=O)N[C@H](CN1CCCC1)c1ccccc1)c1cccc(Cl)c1 ZINC000465609352 879104280 /nfs/dbraw/zinc/10/42/80/879104280.db2.gz UCRXTRMWMOCXRE-NHCUHLMSSA-N 0 3 401.938 4.164 20 0 HIADHN C[C@@H]1CCN(C(=O)NCc2cc(Br)cs2)CCN1Cc1ccccc1 ZINC000465649458 879168581 /nfs/dbraw/zinc/16/85/81/879168581.db2.gz BSLXKGLBZKTELQ-OAHLLOKOSA-N 0 3 422.392 4.317 20 0 HIADHN C[C@@H]1CCN(C(=O)NCCCCOCCc2ccccc2)CCN1Cc1ccccc1 ZINC000465665217 879199029 /nfs/dbraw/zinc/19/90/29/879199029.db2.gz ZEIXRWNWMIAAOI-HSZRJFAPSA-N 0 3 423.601 4.332 20 0 HIADHN CC(C)(C)c1ccc(OC[C@@H](O)CN2CCC[C@H](c3ncc4n3CCCC4)C2)cc1 ZINC000503430447 912428862 /nfs/dbraw/zinc/42/88/62/912428862.db2.gz CWATYLRZMCICNY-UGKGYDQZSA-N 0 3 411.590 4.136 20 0 HIADHN COc1ccc(Cl)cc1CNC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC000465679508 879222941 /nfs/dbraw/zinc/22/29/41/879222941.db2.gz IXUKVLIZTCXTMV-QGZVFWFLSA-N 0 3 401.938 4.155 20 0 HIADHN Cc1cccc(-c2nn(Cc3ccccc3)cc2CN2CCC(n3cncn3)CC2)c1 ZINC000512370589 921111387 /nfs/dbraw/zinc/11/13/87/921111387.db2.gz UEVUZPYOFJXKBH-UHFFFAOYSA-N 0 3 412.541 4.335 20 0 HIADHN CC(C)(CNC(=O)N1CC[C@@H](COCc2ccccc2)C1)N1CCc2ccccc2C1 ZINC000465697387 879255545 /nfs/dbraw/zinc/25/55/45/879255545.db2.gz STETVMLYNPXYPP-JOCHJYFZSA-N 0 3 421.585 4.072 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N2CC[C@H](COCc3ccccc3)C2)C1 ZINC000465748772 879336056 /nfs/dbraw/zinc/33/60/56/879336056.db2.gz IOJCAYDFLGDPDP-SFLYRZDNSA-N 0 3 407.558 4.070 20 0 HIADHN C[C@H](CNC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1)COCc1ccccc1 ZINC000465757840 879351796 /nfs/dbraw/zinc/35/17/96/879351796.db2.gz PWMPDRSCZKDJFC-FGZHOGPDSA-N 0 3 409.574 4.145 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)NCc2c(F)cccc2OC(F)F)C1 ZINC000465759451 879356249 /nfs/dbraw/zinc/35/62/49/879356249.db2.gz PBCFPDUESOGLTB-HOCLYGCPSA-N 0 3 407.436 4.062 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)NCc2ccc(-c3cccnc3)cc2)C1 ZINC000465764833 879360825 /nfs/dbraw/zinc/36/08/25/879360825.db2.gz XQZKXDWAIMURJM-NTKDMRAZSA-N 0 3 400.526 4.383 20 0 HIADHN Cc1cc(C(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)nn1-c1ccc(F)cc1F ZINC000503438689 912448597 /nfs/dbraw/zinc/44/85/97/912448597.db2.gz SMFOISDSNFEGQX-LPHOPBHVSA-N 0 3 410.468 4.024 20 0 HIADHN C[C@H](NC(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1)c1nc(-c2cccc(F)c2)no1 ZINC000465767072 879365832 /nfs/dbraw/zinc/36/58/32/879365832.db2.gz YRFPGIRANRCIML-FTRWYGJKSA-N 0 3 423.492 4.071 20 0 HIADHN CC(C)COC[C@@H](NC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1)c1ccco1 ZINC000465800493 879411270 /nfs/dbraw/zinc/41/12/70/879411270.db2.gz XKGZTTFYEMQWMQ-IFMALSPDSA-N 0 3 413.562 4.299 20 0 HIADHN Cc1ccc([C@H](CNC(=O)NCc2coc(-c3ccccc3)n2)N2CCCC2)cc1 ZINC000465810445 879429323 /nfs/dbraw/zinc/42/93/23/879429323.db2.gz HXDQVUNOBOBKND-QFIPXVFZSA-N 0 3 404.514 4.286 20 0 HIADHN C[C@H]1CCN(C(=O)NCCCCOCc2ccccc2)CCN1Cc1ccccc1 ZINC000465814503 879437132 /nfs/dbraw/zinc/43/71/32/879437132.db2.gz PKFHKIIXWPAKBV-QFIPXVFZSA-N 0 3 409.574 4.289 20 0 HIADHN C[C@H]1CCN(C(=O)NCc2cccc(OC(F)F)c2)CCN1Cc1ccccc1 ZINC000465814365 879437168 /nfs/dbraw/zinc/43/71/68/879437168.db2.gz PRGKGERANFPCLO-KRWDZBQOSA-N 0 3 403.473 4.094 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)N[C@@H](CC2CCCCC2)c2ccccc2)CC1 ZINC000465836386 879472246 /nfs/dbraw/zinc/47/22/46/879472246.db2.gz OTRFDEZBMOORKW-QPPBQGQZSA-N 0 3 414.638 4.271 20 0 HIADHN Cc1csc([C@@H](NC(=O)NCC2(N3CCOC(C)(C)C3)CCCCC2)C2CC2)n1 ZINC000465868677 879520634 /nfs/dbraw/zinc/52/06/34/879520634.db2.gz HDMJHPYCYMCOFB-SFHVURJKSA-N 0 3 420.623 4.016 20 0 HIADHN Cc1c2ccccc2oc1[C@@H](NC(=O)N(CCN(C)C)C[C@H]1CCCO1)C(C)C ZINC000465924708 879588411 /nfs/dbraw/zinc/58/84/11/879588411.db2.gz SLDPYRJKNQPKPL-NQIIRXRSSA-N 0 3 401.551 4.191 20 0 HIADHN CCO[C@@H](C)c1nc(CN(C)C(=O)NC[C@@H]2CCCN2Cc2ccccc2)cs1 ZINC000465931515 879595261 /nfs/dbraw/zinc/59/52/61/879595261.db2.gz NRXJESSXNWOIQL-PXNSSMCTSA-N 0 3 416.591 4.047 20 0 HIADHN CCc1nc(C)c([C@@H](C)N(C)C(=O)NC[C@@H]2CCCN2Cc2ccccc2)s1 ZINC000465943060 879611987 /nfs/dbraw/zinc/61/19/87/879611987.db2.gz ZDDDBRXPYDDGCY-MJGOQNOKSA-N 0 3 400.592 4.381 20 0 HIADHN Cc1ccsc1[C@@H](Cc1ccccc1)NC(=O)N(CCN(C)C)C[C@@H]1CCCO1 ZINC000465955253 879622288 /nfs/dbraw/zinc/62/22/88/879622288.db2.gz VXEMEEYFHJGLSB-LEWJYISDSA-N 0 3 415.603 4.093 20 0 HIADHN C[C@@H]1CCN(C(=O)NC[C@@H]2CCCO[C@@H]2C(C)(C)C)CCN1Cc1ccccc1 ZINC000465982294 879652666 /nfs/dbraw/zinc/65/26/66/879652666.db2.gz IEGYNCBGUANAJC-HJNYFJLDSA-N 0 3 401.595 4.134 20 0 HIADHN C[C@@H]1CCN(C(=O)NCc2ccccc2OC2CCC2)CCN1Cc1ccccc1 ZINC000465993950 879670151 /nfs/dbraw/zinc/67/01/51/879670151.db2.gz YHGGQMSAUNGGQW-HXUWFJFHSA-N 0 3 407.558 4.424 20 0 HIADHN COc1ccc([C@@H](C)CCNC(=O)N(CCN(C)C)Cc2ccc(F)cc2F)cc1 ZINC000466030134 879717083 /nfs/dbraw/zinc/71/70/83/879717083.db2.gz BCBOKTSIJFUSQQ-KRWDZBQOSA-N 0 3 419.516 4.240 20 0 HIADHN O=C(NCc1ccccc1COc1ccccc1Cl)N1CC[C@@H](N2CC=CC2)C1 ZINC000466037409 879726774 /nfs/dbraw/zinc/72/67/74/879726774.db2.gz MEZFGSQWMRWJME-HXUWFJFHSA-N 0 3 411.933 4.075 20 0 HIADHN COc1ccc([C@@H](C)CCNC(=O)N(CCN(C)C)Cc2ccc(F)cc2)cc1 ZINC000466041430 879729882 /nfs/dbraw/zinc/72/98/82/879729882.db2.gz RNKVLJPONIJMDC-SFHVURJKSA-N 0 3 401.526 4.101 20 0 HIADHN CCC[C@H](CCc1ccccc1)NC(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000466053100 879743714 /nfs/dbraw/zinc/74/37/14/879743714.db2.gz PMFDWGHOQDABSC-PQNGQFLHSA-N 0 3 415.622 4.319 20 0 HIADHN CC[C@@H](C)[C@@H](NC(=O)N1CCN(CC2CCOCC2)CC1)c1ccc(Cl)cc1 ZINC000466062665 879759939 /nfs/dbraw/zinc/75/99/39/879759939.db2.gz CFJPJDCGQUTDDI-DYESRHJHSA-N 0 3 407.986 4.181 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)NCc1coc(-c2ccccc2)n1 ZINC000466072439 879775994 /nfs/dbraw/zinc/77/59/94/879775994.db2.gz QFKVEKUSQNBDCB-UHFFFAOYSA-N 0 3 412.921 4.268 20 0 HIADHN C[C@H]1CCN(C(=O)NCc2coc(-c3ccccc3)n2)CCN1Cc1ccccc1 ZINC000466073532 879779353 /nfs/dbraw/zinc/77/93/53/879779353.db2.gz SEMAFSWXNOWZOS-IBGZPJMESA-N 0 3 404.514 4.148 20 0 HIADHN COc1ccccc1[C@H](NC(=O)N1CCN(C)CC[C@@H]1C)c1ccccc1Cl ZINC000466079031 879794487 /nfs/dbraw/zinc/79/44/87/879794487.db2.gz OHHJVRDLEGFQDX-HRAATJIYSA-N 0 3 401.938 4.174 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)N(C)[C@@H](C)c2ccc(-c3ccccc3)cc2)CC1 ZINC000466111193 879825273 /nfs/dbraw/zinc/82/52/73/879825273.db2.gz YCUKYBBWXILHQF-YADHBBJMSA-N 0 3 422.617 4.330 20 0 HIADHN CN(C(=O)NCc1ccc(Oc2ccccc2F)c(F)c1)[C@@H]1CCN(C2CC2)C1 ZINC000466121117 879834998 /nfs/dbraw/zinc/83/49/98/879834998.db2.gz USUYGDDXFBEMGP-QGZVFWFLSA-N 0 3 401.457 4.135 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)N[C@H]1COc2c1ccc(Cl)c2Cl ZINC000466203814 879894718 /nfs/dbraw/zinc/89/47/18/879894718.db2.gz KNTUXECJCBEHSV-KRWDZBQOSA-N 0 3 408.329 4.200 20 0 HIADHN C[C@H]1CCN(C)CCN1C(=O)N[C@@H](c1ccccc1Cl)c1cc(F)ccc1F ZINC000466236995 879943538 /nfs/dbraw/zinc/94/35/38/879943538.db2.gz ANMKQWDXRCGJEN-XOBRGWDASA-N 0 3 407.892 4.443 20 0 HIADHN CO[C@@H](CNC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1)c1cccc(Cl)c1 ZINC000466349794 880107639 /nfs/dbraw/zinc/10/76/39/880107639.db2.gz KNDQPARHIQZQSS-AVRDEDQJSA-N 0 3 415.965 4.334 20 0 HIADHN COc1ccc([C@@H](CNC(=O)Nc2ccccc2OC(F)F)N2CCCC2)cc1 ZINC000503489399 912532351 /nfs/dbraw/zinc/53/23/51/912532351.db2.gz CINAJNNGSDQKQL-GOSISDBHSA-N 0 3 405.445 4.255 20 0 HIADHN Cc1ccccc1[C@H]1C[C@H](NC(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)C1 ZINC000466381509 880141399 /nfs/dbraw/zinc/14/13/99/880141399.db2.gz SPIBSOSCWONVER-OHUMZHCVSA-N 0 3 413.606 4.162 20 0 HIADHN COc1ccc(C(=O)Nc2ccc(C(=O)NC[C@H](C)N3CCCC[C@@H]3C)s2)cc1 ZINC000466457260 880238084 /nfs/dbraw/zinc/23/80/84/880238084.db2.gz RGMGRXBRDIVGJK-HOTGVXAUSA-N 0 3 415.559 4.002 20 0 HIADHN COc1cc(CNCc2c(C)oc3ccccc32)ccc1OCC(=O)N1CCCC1 ZINC000466474380 880257580 /nfs/dbraw/zinc/25/75/80/880257580.db2.gz OELUUBPCYUAXJW-UHFFFAOYSA-N 0 3 408.498 4.041 20 0 HIADHN C[C@H]1C[C@H](NC(=O)N(Cc2ccccc2)CC2CCOCC2)CN1Cc1ccccc1 ZINC000466514553 880289979 /nfs/dbraw/zinc/28/99/79/880289979.db2.gz LDRZUGBMGDRXBG-OFVILXPXSA-N 0 3 421.585 4.288 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)NCc2csc(-c3ccccc3)n2)CN1Cc1ccccc1 ZINC000466517224 880291030 /nfs/dbraw/zinc/29/10/30/880291030.db2.gz ISBFZBPCLXTJAM-XLIONFOSSA-N 0 3 406.555 4.272 20 0 HIADHN Cc1ccc(-c2nc(CNC(=O)N[C@@H]3C[C@@H](C)N(Cc4ccccc4)C3)co2)cc1 ZINC000466516136 880292016 /nfs/dbraw/zinc/29/20/16/880292016.db2.gz QJAYRYATTJKHHO-WIYYLYMNSA-N 0 3 404.514 4.112 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)Nc2ccc(C(=O)NC3CCCC3)cc2)CN1Cc1ccccc1 ZINC000466518177 880293053 /nfs/dbraw/zinc/29/30/53/880293053.db2.gz LSIYTWNERYLCNT-JPYJTQIMSA-N 0 3 420.557 4.144 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)N(C)Cc2ccc(OC(F)F)cc2)CN1Cc1ccccc1 ZINC000466526955 880303160 /nfs/dbraw/zinc/30/31/60/880303160.db2.gz KXPBNXRFDQXFGK-QFBILLFUSA-N 0 3 403.473 4.092 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)Nc2cccc(OCc3cccnc3)c2)CN1Cc1ccccc1 ZINC000466540472 880313686 /nfs/dbraw/zinc/31/36/86/880313686.db2.gz OYHNWLRAQPYDSU-AUSIDOKSSA-N 0 3 416.525 4.445 20 0 HIADHN CN(C(=O)NCc1ccc(OC(C)(C)C)cc1C(F)(F)F)[C@@H]1CCN(C2CC2)C1 ZINC000466601366 880371570 /nfs/dbraw/zinc/37/15/70/880371570.db2.gz QKSYNCJSVWLYTL-MRXNPFEDSA-N 0 3 413.484 4.261 20 0 HIADHN Cc1sc(NC(=O)c2ccc(CN(C)C)cc2)nc1-c1ccc2c(c1)CCC(=O)N2 ZINC000466611440 880382207 /nfs/dbraw/zinc/38/22/07/880382207.db2.gz UPLUOECLQSPUDK-UHFFFAOYSA-N 0 3 420.538 4.317 20 0 HIADHN CC[C@H](NC(=O)N(CCN(C)C)Cc1ccccc1)c1nc(C(F)(F)F)cs1 ZINC000466680023 880468321 /nfs/dbraw/zinc/46/83/21/880468321.db2.gz BHTUNODLQQXZKO-HNNXBMFYSA-N 0 3 414.497 4.386 20 0 HIADHN CCc1c(NC(=O)N[C@H](CN2CCCC2)c2ccccc2)cnn1-c1ccccc1 ZINC000466707634 880498950 /nfs/dbraw/zinc/49/89/50/880498950.db2.gz ZLOWWIIFHUTGKM-JOCHJYFZSA-N 0 3 403.530 4.393 20 0 HIADHN COC(=O)c1ccc(C(C)C)c(NC(=O)N(CCN(C)C)Cc2cccc(F)c2)c1 ZINC000466713975 880503077 /nfs/dbraw/zinc/50/30/77/880503077.db2.gz SLASJCYLBNUWLB-UHFFFAOYSA-N 0 3 415.509 4.331 20 0 HIADHN Cc1ccc(-c2nc(CNC(=O)N(CCN(C)C)Cc3ccccc3F)co2)cc1 ZINC000466754594 880535439 /nfs/dbraw/zinc/53/54/39/880535439.db2.gz MQKRKDXCZXGAGS-UHFFFAOYSA-N 0 3 410.493 4.063 20 0 HIADHN C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)N(C)CCCCCc1cc(-c2ccccc2)no1 ZINC000466777081 880556374 /nfs/dbraw/zinc/55/63/74/880556374.db2.gz MGMSNPWLZMMRFK-JPYJTQIMSA-N 0 3 410.562 4.179 20 0 HIADHN Cc1c(-c2cc(CN(C)CC3(c4ccc(Br)cc4)CC3)on2)cnn1C ZINC000466812009 880587156 /nfs/dbraw/zinc/58/71/56/880587156.db2.gz AMYYIZLIXLXFEX-UHFFFAOYSA-N 0 3 415.335 4.310 20 0 HIADHN COc1ccc(N(C)C(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)cc1Cl ZINC000466877457 880646064 /nfs/dbraw/zinc/64/60/64/880646064.db2.gz MKKYYIMBRSCBKN-UHFFFAOYSA-N 0 3 401.938 4.156 20 0 HIADHN C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)N(C)[C@@H]1CCSc2ccc(Br)cc21 ZINC000466921326 880689912 /nfs/dbraw/zinc/68/99/12/880689912.db2.gz KAIDXXCWQQDSNT-CSMYWGQOSA-N 0 3 424.408 4.110 20 0 HIADHN COc1ccc([C@H](CNC(=O)Nc2cccc(-c3cc[nH]n3)c2)N2CCCC2)cc1 ZINC000466923000 880690651 /nfs/dbraw/zinc/69/06/51/880690651.db2.gz HDRDTSGWKBPQRC-QFIPXVFZSA-N 0 3 405.502 4.044 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)NCc1ccc(-c2cccnc2)cc1 ZINC000466940526 880711005 /nfs/dbraw/zinc/71/10/05/880711005.db2.gz PLQWSNUYPYFJFN-UHFFFAOYSA-N 0 3 406.505 4.161 20 0 HIADHN Cc1ccc(-n2cc(NC(=O)N(C)C[C@@H]3CCN(C)[C@H]3c3cccnc3)cn2)c(C)c1 ZINC000466950772 880728085 /nfs/dbraw/zinc/72/80/85/880728085.db2.gz WSCWQFOOSSBOBH-REWPJTCUSA-N 0 3 418.545 4.041 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)NC[C@H]2CCCO[C@H]2c2ccc(C)cc2)o1 ZINC000466952762 880732658 /nfs/dbraw/zinc/73/26/58/880732658.db2.gz GVDJTBVKFWHSLT-GGAORHGYSA-N 0 3 413.562 4.138 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)Cc2csc(-c3cccc(F)c3)n2)CN1Cc1ccccc1 ZINC000467029658 880828926 /nfs/dbraw/zinc/82/89/26/880828926.db2.gz AFYVLTPXGRAQJM-OXQOHEQNSA-N 0 3 409.530 4.271 20 0 HIADHN C[C@@H](NC(=O)N1CCN(C2CCC(C)CC2)CC1)c1nc(C2CCCCC2)no1 ZINC000467035318 880833489 /nfs/dbraw/zinc/83/34/89/880833489.db2.gz UQZMHZDQDFAMBU-TVRKMHQQSA-N 0 3 403.571 4.084 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)c2cccc(C(=O)N(C)CC(C)(C)C)c2)CN1Cc1ccccc1 ZINC000467040187 880836894 /nfs/dbraw/zinc/83/68/94/880836894.db2.gz HLOVUCHJSXMJFC-WMZHIEFXSA-N 0 3 421.585 4.198 20 0 HIADHN C[C@H]1C[C@H](NC(=O)Cc2ccc(NC(=O)CC(C)(C)C)cc2)CN1Cc1ccccc1 ZINC000467040822 880836976 /nfs/dbraw/zinc/83/69/76/880836976.db2.gz NRRYFKUBQLSRCB-CVDCTZTESA-N 0 3 421.585 4.383 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)N[C@@H](C)c2ccc(Br)cc2)cc1 ZINC000503547592 912612860 /nfs/dbraw/zinc/61/28/60/912612860.db2.gz YBXUUHHCZBRNDF-IFXJQAMLSA-N 0 3 420.351 4.121 20 0 HIADHN COc1ccc(-c2cnc(CCC(=O)N[C@H]3C[C@H](C)N(Cc4ccccc4)C3)o2)cc1 ZINC000467053395 880843492 /nfs/dbraw/zinc/84/34/92/880843492.db2.gz IGLGPVAQEDZGDM-RXVVDRJESA-N 0 3 419.525 4.062 20 0 HIADHN Cc1noc(C)c1COc1cccc(C(=O)N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)c1 ZINC000467054424 880844146 /nfs/dbraw/zinc/84/41/46/880844146.db2.gz STBGLAMFYWYWDD-VGOFRKELSA-N 0 3 419.525 4.263 20 0 HIADHN Cc1noc(C)c1COc1ccccc1C(=O)N[C@H]1C[C@@H](C)N(Cc2ccccc2)C1 ZINC000467060019 880847219 /nfs/dbraw/zinc/84/72/19/880847219.db2.gz QBERDWHJLGOOAJ-UTKZUKDTSA-N 0 3 419.525 4.263 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)c(C)c1 ZINC000467108461 880867534 /nfs/dbraw/zinc/86/75/34/880867534.db2.gz BVPUWUGUDRAURM-IPJJNNNSSA-N 0 3 422.573 4.308 20 0 HIADHN COc1ccc(Br)c(NC(=O)N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)c1 ZINC000467110858 880870389 /nfs/dbraw/zinc/87/03/89/880870389.db2.gz PCVYBDKPVVHSIY-ZBFHGGJFSA-N 0 3 418.335 4.242 20 0 HIADHN C[C@H](NC(=O)N[C@H](CN(C)C)c1ccc(F)cc1)c1ccc(Br)cc1 ZINC000503550481 912616304 /nfs/dbraw/zinc/61/63/04/912616304.db2.gz GHXMQSYUGRJBOI-SCLBCKFNSA-N 0 3 408.315 4.251 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cnc(C)nc1C1CC1)c1ccc(C(F)(F)F)cc1 ZINC000467152150 880888866 /nfs/dbraw/zinc/88/88/66/880888866.db2.gz OGONNWRIGVXABK-LJQANCHMSA-N 0 3 420.479 4.494 20 0 HIADHN COCC[C@@H]1CCCCN(CC(=O)Nc2ccc(NC(=O)c3cccs3)cc2)C1 ZINC000467281685 881028073 /nfs/dbraw/zinc/02/80/73/881028073.db2.gz XEAPIOSOSORVRG-KRWDZBQOSA-N 0 3 415.559 4.078 20 0 HIADHN Brc1cccc(CN(Cc2cccc3c2OCCO3)C2CCOCC2)c1 ZINC000467299101 881046158 /nfs/dbraw/zinc/04/61/58/881046158.db2.gz RJKBRJQNWZHEHL-UHFFFAOYSA-N 0 3 418.331 4.402 20 0 HIADHN COc1cc2c(cc1F)CC[C@@H]2N[C@H](C)c1cc(F)ccc1N1CCN(C)CC1 ZINC000467341314 881093441 /nfs/dbraw/zinc/09/34/41/881093441.db2.gz DLCNQOCWRSGXAZ-VFNWGFHPSA-N 0 3 401.501 4.063 20 0 HIADHN C[S@](=O)c1ccc(CN(Cc2cccc(Br)c2)C2CCOCC2)cc1 ZINC000467351091 881106997 /nfs/dbraw/zinc/10/69/97/881106997.db2.gz XUTSEXISMUVBAL-VWLOTQADSA-N 0 3 422.388 4.368 20 0 HIADHN CCOCCOCc1cccc(NC(=O)N2CCN(CC3CCCCC3)CC2)c1C ZINC000467381530 881160873 /nfs/dbraw/zinc/16/08/73/881160873.db2.gz KDYWSGSOGSOFCA-UHFFFAOYSA-N 0 3 417.594 4.278 20 0 HIADHN CCOCCOCc1cccc(NC(=O)N2CCN(CCC(C)(C)C)CC2)c1C ZINC000467392832 881176277 /nfs/dbraw/zinc/17/62/77/881176277.db2.gz ISLAHZFWXMNKAO-UHFFFAOYSA-N 0 3 405.583 4.134 20 0 HIADHN C[C@H](CCN[C@@H]1CCS(=O)(=O)c2ccc(Br)cc21)c1ccccc1 ZINC000467401629 881185435 /nfs/dbraw/zinc/18/54/35/881185435.db2.gz AXGWEAGVKSURBN-RDTXWAMCSA-N 0 3 408.361 4.451 20 0 HIADHN O[C@H]1Cc2ccccc2[C@H]1N[C@@H](c1cccc(Br)c1)C1CCOCC1 ZINC000467419480 881209125 /nfs/dbraw/zinc/20/91/25/881209125.db2.gz QLGDFLBEWYUUPV-PWRODBHTSA-N 0 3 402.332 4.165 20 0 HIADHN CCC(C)(C)c1ccc(S(=O)(=O)[N-]c2ccc(NC(=O)CC[NH+](C)C)cc2)cc1 ZINC000467437831 881236988 /nfs/dbraw/zinc/23/69/88/881236988.db2.gz DBFFLDTZUSHCPQ-UHFFFAOYSA-N 0 3 417.575 4.065 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](NC[C@H](CO)CC2CCCC2)c2ccc(F)cc2)c1 ZINC000467444716 881246403 /nfs/dbraw/zinc/24/64/03/881246403.db2.gz PXNPTPKBBFEJTM-JPYJTQIMSA-N 0 3 419.562 4.097 20 0 HIADHN Cc1ccc([C@H](NC[C@H](CO)CC2CCCC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000467451836 881254909 /nfs/dbraw/zinc/25/49/09/881254909.db2.gz YZOGHHUGVFBCBT-YKSBVNFPSA-N 0 3 415.599 4.266 20 0 HIADHN CC(C)[C@@H](CNC(=O)N(C)C1CCN(CCc2ccccn2)CC1)Cc1ccccc1 ZINC000469068730 883145830 /nfs/dbraw/zinc/14/58/30/883145830.db2.gz QGTBEGSACWJGOL-HSZRJFAPSA-N 0 3 422.617 4.245 20 0 HIADHN COc1ccc(CC[C@H]2CCCCN2C(=O)c2cccc(CN(C)C)c2)cc1OC ZINC000469179613 883277872 /nfs/dbraw/zinc/27/78/72/883277872.db2.gz QIDFBYGWJXYUIW-JOCHJYFZSA-N 0 3 410.558 4.393 20 0 HIADHN COc1ccc(NC(=O)[C@@H](NC2CCN(c3nccs3)CC2)c2ccccc2)cc1 ZINC000503602425 912693482 /nfs/dbraw/zinc/69/34/82/912693482.db2.gz MDAIEFUNKUVJOT-NRFANRHFSA-N 0 3 422.554 4.090 20 0 HIADHN COc1cc(N[C@@H]2CCCN(Cc3ccc4c(c3)COC(C)(C)O4)C2)cc(OC)c1 ZINC000469220973 883321234 /nfs/dbraw/zinc/32/12/34/883321234.db2.gz DEQJRCMAAFGHTB-LJQANCHMSA-N 0 3 412.530 4.425 20 0 HIADHN COc1cc(Br)ccc1[C@@H](C)N[C@@H](C)Cn1cc(Br)cn1 ZINC000469226390 883326330 /nfs/dbraw/zinc/32/63/30/883326330.db2.gz STTPGGMZULHGCM-WDEREUQCSA-N 0 3 417.145 4.156 20 0 HIADHN COCc1ccc([C@H]2CCCN2C(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)o1 ZINC000469264187 883360063 /nfs/dbraw/zinc/36/00/63/883360063.db2.gz QQVJNWNVAHUFIM-WIYYLYMNSA-N 0 3 400.494 4.141 20 0 HIADHN CCN(C(=O)c1ccc(O[C@@H]2CCOC2)cc1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000469320174 883426162 /nfs/dbraw/zinc/42/61/62/883426162.db2.gz SIYQTHLBYGTJMV-WNOPAQSVSA-N 0 3 408.542 4.152 20 0 HIADHN C[C@H]1CC[N@H+](CCOc2ccc(NC(=O)CCCc3ccc([O-])c(F)c3)cc2)C1 ZINC000469422049 883600411 /nfs/dbraw/zinc/60/04/11/883600411.db2.gz JWNYSCNLKUXCCQ-KRWDZBQOSA-N 0 3 400.494 4.213 20 0 HIADHN C[C@H]1CC[N@@H+](CCOc2ccc(NC(=O)CCCc3ccc([O-])c(F)c3)cc2)C1 ZINC000469422049 883600418 /nfs/dbraw/zinc/60/04/18/883600418.db2.gz JWNYSCNLKUXCCQ-KRWDZBQOSA-N 0 3 400.494 4.213 20 0 HIADHN O=C(CCCc1ccc([O-])c(F)c1)N1CC[C@]2(C1)CCC[N@H+](Cc1ccccc1)C2 ZINC000469427422 883608309 /nfs/dbraw/zinc/60/83/09/883608309.db2.gz BYUJBGSLBLTNFR-RUZDIDTESA-N 0 3 410.533 4.369 20 0 HIADHN O=C(CCCc1ccc([O-])c(F)c1)N1CC[C@]2(C1)CCC[N@@H+](Cc1ccccc1)C2 ZINC000469427422 883608331 /nfs/dbraw/zinc/60/83/31/883608331.db2.gz BYUJBGSLBLTNFR-RUZDIDTESA-N 0 3 410.533 4.369 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)NC[C@@H]1CCO[C@@H]1c1ccccc1 ZINC000469436283 883624508 /nfs/dbraw/zinc/62/45/08/883624508.db2.gz LNMOVEQEHGRKGL-KMDXXIMOSA-N 0 3 409.574 4.220 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)Nc1cccc(NC(=O)C2CC2)c1 ZINC000469448172 883647861 /nfs/dbraw/zinc/64/78/61/883647861.db2.gz LTDRGXULERVADW-JOCHJYFZSA-N 0 3 408.546 4.313 20 0 HIADHN COc1cc(NC(=O)CCN2CC[C@@H](c3c(F)cccc3F)C2)c(OC)cc1Cl ZINC000469452820 883655288 /nfs/dbraw/zinc/65/52/88/883655288.db2.gz ROMPGJBUAQGZTA-CYBMUJFWSA-N 0 3 424.875 4.454 20 0 HIADHN NC(=O)c1ccc(NC(=O)CCN2CCCC[C@@H]2c2cccc(C(F)(F)F)c2)cc1 ZINC000469533067 883803119 /nfs/dbraw/zinc/80/31/19/883803119.db2.gz KZZYFGZNZDDELS-LJQANCHMSA-N 0 3 419.447 4.360 20 0 HIADHN CN(C)[C@@H](CNc1ncccc1C(=O)N1CCCCC1)c1cccc(C(F)(F)F)c1 ZINC000469548065 883809272 /nfs/dbraw/zinc/80/92/72/883809272.db2.gz WFNPLMPTPSWECN-IBGZPJMESA-N 0 3 420.479 4.441 20 0 HIADHN CCN(CC)[C@@H](C(=O)NCCNc1cccc(C)n1)c1cccc(C(F)(F)F)c1 ZINC000469570829 883818878 /nfs/dbraw/zinc/81/88/78/883818878.db2.gz NBYCCBASGCKWTC-LJQANCHMSA-N 0 3 408.468 4.020 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)Nc1ccc(NC[C@H]2CCCO2)c(F)c1 ZINC000469685425 883869647 /nfs/dbraw/zinc/86/96/47/883869647.db2.gz VYXNCUVZRQRHPC-MRXNPFEDSA-N 0 3 411.477 4.477 20 0 HIADHN CCN(C(=O)c1ccc2nnc(C(C)(C)C)n2c1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000469710014 883882263 /nfs/dbraw/zinc/88/22/63/883882263.db2.gz NAQIRDDMHDTDCT-WIYYLYMNSA-N 0 3 419.573 4.324 20 0 HIADHN C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H](C)C1NCc1nc2c3ccccc3oc2c(=O)[n-]1 ZINC000469775864 883951866 /nfs/dbraw/zinc/95/18/66/883951866.db2.gz MURORKIGDDQYLT-IAGOWNOFSA-N 0 3 416.525 4.328 20 0 HIADHN CC[C@H](NCc1cccc(C(=O)N2CCOCC2)c1)c1ccc(OC(F)F)cc1 ZINC000469810567 883985478 /nfs/dbraw/zinc/98/54/78/883985478.db2.gz RAKCYVYRGCGMTL-FQEVSTJZSA-N 0 3 404.457 4.001 20 0 HIADHN CCN1CCN(CCC(=O)N2CCC[C@@H]2c2nc(-c3ccccc3)c(C(C)C)o2)CC1 ZINC000469830717 884011148 /nfs/dbraw/zinc/01/11/48/884011148.db2.gz NFSNGOCHMCMDHI-OAQYLSRUSA-N 0 3 424.589 4.156 20 0 HIADHN Cc1c(F)c(C(F)(F)F)ccc1C(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000469833084 884012916 /nfs/dbraw/zinc/01/29/16/884012916.db2.gz ZWPKHJWZPUDVRP-QGZVFWFLSA-N 0 3 424.438 4.174 20 0 HIADHN O=C(CCCc1ccc(Cl)cc1)NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000469836408 884016702 /nfs/dbraw/zinc/01/67/02/884016702.db2.gz MAIXTSDGBWIRRG-JOCHJYFZSA-N 0 3 400.950 4.070 20 0 HIADHN CCSc1ccc(Cl)cc1C(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000469837574 884019314 /nfs/dbraw/zinc/01/93/14/884019314.db2.gz BQKCEQFKRUIGDU-IBGZPJMESA-N 0 3 418.990 4.473 20 0 HIADHN O=C(NC[C@H]1CN(Cc2ccccc2)CCCO1)c1occc1-c1ccc(F)cc1 ZINC000469862136 884050375 /nfs/dbraw/zinc/05/03/75/884050375.db2.gz ZBUHONMPXBQXAD-NRFANRHFSA-N 0 3 408.473 4.107 20 0 HIADHN O=C(CCCCCc1cccs1)NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000469865945 884056000 /nfs/dbraw/zinc/05/60/00/884056000.db2.gz ODDDJDBJUJQHNR-OAQYLSRUSA-N 0 3 400.588 4.258 20 0 HIADHN O=C(C[C@H](c1ccccc1)C(F)(F)F)NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000469873743 884062560 /nfs/dbraw/zinc/06/25/60/884062560.db2.gz SLPQGPQWWDASOY-LEWJYISDSA-N 0 3 420.475 4.130 20 0 HIADHN Cc1ccc(Sc2ccc(NC(=O)N3CCCN([C@@H](C)CO)CC3)cc2)cc1C ZINC000469909910 884097771 /nfs/dbraw/zinc/09/77/71/884097771.db2.gz UNDQUWVQKFFWGA-IBGZPJMESA-N 0 3 413.587 4.375 20 0 HIADHN COc1ccc(C[C@H](C)CN2CCCN(C(=O)c3cccc(F)c3)CC2)cc1F ZINC000469911554 884102211 /nfs/dbraw/zinc/10/22/11/884102211.db2.gz RZMSTCUJXOXOOF-KRWDZBQOSA-N 0 3 402.485 4.000 20 0 HIADHN Cc1cc(NC(=O)N2CCCC3(CCC3)C2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000469911639 884102439 /nfs/dbraw/zinc/10/24/39/884102439.db2.gz SPBDXAFYRMCNLV-NRFANRHFSA-N 0 3 407.562 4.437 20 0 HIADHN Cc1ccc(Sc2ccc(NC(=O)N3CCCN([C@@H](C)CO)CC3)cc2)c(C)c1 ZINC000469916513 884107388 /nfs/dbraw/zinc/10/73/88/884107388.db2.gz JALLEQUMRHHXAG-IBGZPJMESA-N 0 3 413.587 4.375 20 0 HIADHN CCc1c(C(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)cnn1-c1ccccc1OC ZINC000469924263 884116628 /nfs/dbraw/zinc/11/66/28/884116628.db2.gz CLHDGLNSIFTFRR-AZUAARDMSA-N 0 3 418.541 4.009 20 0 HIADHN C[C@@H]1CN(C(=O)NCC(C)(C)N2CCc3ccccc3C2)C[C@H](c2ccsc2)O1 ZINC000470040586 884281964 /nfs/dbraw/zinc/28/19/64/884281964.db2.gz DTANOCKXPWUGSF-DYESRHJHSA-N 0 3 413.587 4.056 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@@H]2NC(=O)N(Cc2ccco2)C2CCN(C)CC2)cc1 ZINC000470043246 884285362 /nfs/dbraw/zinc/28/53/62/884285362.db2.gz HEYYJSRDZJKFMT-GOTSBHOMSA-N 0 3 411.546 4.114 20 0 HIADHN CC(C)Cn1ncc(C(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)c1C(F)F ZINC000503766560 912819138 /nfs/dbraw/zinc/81/91/38/912819138.db2.gz XAKJAHWQSPNMAJ-UHFFFAOYSA-N 0 3 419.520 4.259 20 0 HIADHN CC(C)[C@@H]1CCC[C@@H](NC(=O)NCc2ccccc2CN2CCC(O)CC2)CC1 ZINC000470163879 884439880 /nfs/dbraw/zinc/43/98/80/884439880.db2.gz PCZQKXCRPSCFSN-DENIHFKCSA-N 0 3 401.595 4.047 20 0 HIADHN C[C@H](NC(=O)NC[C@@H](c1ccccc1)N1CCCC1)c1ccccc1-n1cccn1 ZINC000470183656 884473683 /nfs/dbraw/zinc/47/36/83/884473683.db2.gz RWLPQLKXVXTECO-CVDCTZTESA-N 0 3 403.530 4.070 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)Nc1ccccc1O[C@H]1CCOC1 ZINC000470270413 884624733 /nfs/dbraw/zinc/62/47/33/884624733.db2.gz JGANEXFRJBBDDN-IBGZPJMESA-N 0 3 417.937 4.103 20 0 HIADHN Cc1ccc(-n2ncc(C(=O)NCCN3CCCC(C)(C)C3)c2C(F)(F)F)cc1 ZINC000470289060 884661315 /nfs/dbraw/zinc/66/13/15/884661315.db2.gz LFZYFMKWEDUOOY-UHFFFAOYSA-N 0 3 408.468 4.051 20 0 HIADHN CC1(C)CCCN(CCNC(=O)c2cc(Br)sc2Br)C1 ZINC000470298873 884674953 /nfs/dbraw/zinc/67/49/53/884674953.db2.gz UEYGCJNTXSNZJX-UHFFFAOYSA-N 0 3 424.202 4.125 20 0 HIADHN C[C@H](CO)N1CCCN(C(=O)Nc2ccccc2Oc2ccc(Cl)cc2)CC1 ZINC000470347702 884737306 /nfs/dbraw/zinc/73/73/06/884737306.db2.gz XGRUVAMUNUFWJF-MRXNPFEDSA-N 0 3 403.910 4.053 20 0 HIADHN Cc1cc(NC(=O)NCCc2ccccc2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000470387820 884790702 /nfs/dbraw/zinc/79/07/02/884790702.db2.gz FWYYLLDAAJZSFE-JOCHJYFZSA-N 0 3 403.530 4.003 20 0 HIADHN CCn1c(SCCCN2CCN(C(C)C)CC2)nnc1-c1ccc(Cl)cc1 ZINC000470440509 884839192 /nfs/dbraw/zinc/83/91/92/884839192.db2.gz ILXFKWOLHRKPOU-UHFFFAOYSA-N 0 3 408.015 4.127 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(-c2ccncc2)cc1 ZINC000470480924 884868717 /nfs/dbraw/zinc/86/87/17/884868717.db2.gz ZIYVWYUGUBNJPZ-YADARESESA-N 0 3 400.526 4.383 20 0 HIADHN COC[C@@H](C)Oc1ccc(Cl)cc1NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000470519381 884910906 /nfs/dbraw/zinc/91/09/06/884910906.db2.gz LTFXLJAMEAZYHG-VQIMIIECSA-N 0 3 417.937 4.150 20 0 HIADHN COC[C@@H](C)Oc1ccc(Cl)cc1NC(=O)NC[C@@H](c1ccccc1)N(C)C ZINC000470535070 884936273 /nfs/dbraw/zinc/93/62/73/884936273.db2.gz XUXKBNVWRXJTHS-BEFAXECRSA-N 0 3 405.926 4.178 20 0 HIADHN O[C@@H](COCc1cccs1)CN1CC[C@@H](Oc2ccc(Cl)c(Cl)c2)C1 ZINC000470568156 884985600 /nfs/dbraw/zinc/98/56/00/884985600.db2.gz FAMPIYUYJXEHGL-UKRRQHHQSA-N 0 3 402.343 4.086 20 0 HIADHN Cc1cnn(Cc2ccccc2F)c1NC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000470571332 884988950 /nfs/dbraw/zinc/98/89/50/884988950.db2.gz VURDPBLJWJIPIX-FQEVSTJZSA-N 0 3 424.495 4.369 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)CCc1cc2ccccc2[nH]c1=O ZINC000470588684 885005162 /nfs/dbraw/zinc/00/51/62/885005162.db2.gz SQDBNPVTUAJMKQ-QHCPKHFHSA-N 0 3 405.542 4.146 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)CCc1cc2ccccc2[nH]c1=O ZINC000470588683 885005278 /nfs/dbraw/zinc/00/52/78/885005278.db2.gz SQDBNPVTUAJMKQ-HSZRJFAPSA-N 0 3 405.542 4.146 20 0 HIADHN CN(C(=O)c1cccc(-c2noc(C3CC3)n2)c1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470656702 885078951 /nfs/dbraw/zinc/07/89/51/885078951.db2.gz JECWKBTWXRZXIL-QFIPXVFZSA-N 0 3 416.525 4.351 20 0 HIADHN CN(C(=O)c1cnn(Cc2ccccc2Cl)c1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470656900 885081432 /nfs/dbraw/zinc/08/14/32/885081432.db2.gz JTXZKDSJDUWRSY-JOCHJYFZSA-N 0 3 422.960 4.321 20 0 HIADHN C[C@@H]1C[C@H]1C(=O)Nc1cccc(C(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000470665715 885091763 /nfs/dbraw/zinc/09/17/63/885091763.db2.gz GKDJSHOMPIRVRF-SXSPYAJSSA-N 0 3 405.542 4.018 20 0 HIADHN Cc1cc(C)n(Cc2cccc(C(=O)N(C)[C@@H]3CCCN(Cc4ccccc4)C3)c2)n1 ZINC000470672633 885103319 /nfs/dbraw/zinc/10/33/19/885103319.db2.gz MICXMZWKDPCDOH-RUZDIDTESA-N 0 3 416.569 4.285 20 0 HIADHN CN(C(=O)c1ccc(OCc2ccccc2)nc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470675607 885106479 /nfs/dbraw/zinc/10/64/79/885106479.db2.gz SCGMMBSJCIIGFJ-XMMPIXPASA-N 0 3 415.537 4.397 20 0 HIADHN CN(C(=O)c1ccc(C(=O)NCC(C)(C)C)cc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470675792 885107511 /nfs/dbraw/zinc/10/75/11/885107511.db2.gz UPECHFBAOHISCC-QHCPKHFHSA-N 0 3 421.585 4.199 20 0 HIADHN CC(=O)CCc1ccc(O[C@@H](C)C(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000470678144 885108567 /nfs/dbraw/zinc/10/85/67/885108567.db2.gz JIWYZNPQUVWGHE-URXFXBBRSA-N 0 3 422.569 4.099 20 0 HIADHN COCC[C@H](NC(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1)c1ccco1 ZINC000503999074 912904663 /nfs/dbraw/zinc/90/46/63/912904663.db2.gz IIEDTSFHKWKSGO-ROUUACIJSA-N 0 3 405.564 4.191 20 0 HIADHN Cc1[nH]c2ccccc2c1CCNC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470725062 885173839 /nfs/dbraw/zinc/17/38/39/885173839.db2.gz ANVMLQZGQXWACI-NRFANRHFSA-N 0 3 404.558 4.325 20 0 HIADHN C[C@@H](OCCCNC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1)c1ccccc1 ZINC000470740439 885200437 /nfs/dbraw/zinc/20/04/37/885200437.db2.gz MEEQFUHJUOBFEO-QPPBQGQZSA-N 0 3 409.574 4.460 20 0 HIADHN CN(C(=O)NCCc1cccc2cccnc21)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470742281 885203874 /nfs/dbraw/zinc/20/38/74/885203874.db2.gz AYBGBQOZBWTPFG-HSZRJFAPSA-N 0 3 402.542 4.083 20 0 HIADHN COc1ccc([C@H](CNC(=O)CCc2cnc3ccccc3c2)N2CCCC2)cc1 ZINC000470750379 885215557 /nfs/dbraw/zinc/21/55/57/885215557.db2.gz DJOOHSPZDDPXPY-DEOSSOPVSA-N 0 3 403.526 4.129 20 0 HIADHN CN(C(=O)NCc1cccnc1OC1CCCC1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470752222 885219147 /nfs/dbraw/zinc/21/91/47/885219147.db2.gz VZEIOAHQKOBHRM-JOCHJYFZSA-N 0 3 422.573 4.209 20 0 HIADHN CN(Cc1nc(C(F)(F)F)cs1)C(=O)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000470756050 885221284 /nfs/dbraw/zinc/22/12/84/885221284.db2.gz PFGXCCDLRZMAEZ-HNNXBMFYSA-N 0 3 412.481 4.140 20 0 HIADHN COc1ccc(-c2[nH]c3ccccc3c2CCC(=O)N2CCN3CCC2CC3)cc1 ZINC000470848673 885346042 /nfs/dbraw/zinc/34/60/42/885346042.db2.gz VARYBQGGLJPCRF-UHFFFAOYSA-N 0 3 403.526 4.083 20 0 HIADHN CO[C@H](CNC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1)c1cccc(Cl)c1 ZINC000470885918 885379723 /nfs/dbraw/zinc/37/97/23/885379723.db2.gz JEGYKSCXMIJNOU-FGZHOGPDSA-N 0 3 415.965 4.334 20 0 HIADHN COc1ccc([C@@H](C)CCNC(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000470885549 885380948 /nfs/dbraw/zinc/38/09/48/885380948.db2.gz DDFUQVLAWUIMOX-REWPJTCUSA-N 0 3 409.574 4.495 20 0 HIADHN Cc1ccc(-c2nc(CNC(=O)N(C)[C@H]3CCCN(Cc4ccccc4)C3)co2)cc1 ZINC000470891025 885387041 /nfs/dbraw/zinc/38/70/41/885387041.db2.gz XDYYWGWETNYTOH-QHCPKHFHSA-N 0 3 418.541 4.456 20 0 HIADHN Cn1ccnc1COc1ccc(CN2CCC[C@H](OCc3ccccc3F)C2)cc1 ZINC000470916060 885424356 /nfs/dbraw/zinc/42/43/56/885424356.db2.gz ABXXHBGCVZCRDO-QFIPXVFZSA-N 0 3 409.505 4.319 20 0 HIADHN CCc1ccc(Cl)c(CC)c1NC(=O)CCCN1CCO[C@@]2(CCO[C@@H]2C)C1 ZINC000470934228 885437950 /nfs/dbraw/zinc/43/79/50/885437950.db2.gz AFSDTUJHKYSETG-ZHRRBRCNSA-N 0 3 408.970 4.063 20 0 HIADHN CN1CCN(CC(=O)Nc2cccc(CSc3ccccn3)c2)C2(CCCCC2)C1 ZINC000471035716 885542981 /nfs/dbraw/zinc/54/29/81/885542981.db2.gz QFBATLBYAXEWAA-UHFFFAOYSA-N 0 3 424.614 4.263 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1cccc2oc(C)nc21 ZINC000471046529 885559378 /nfs/dbraw/zinc/55/93/78/885559378.db2.gz GWUSAAZBKNMBEF-LJQANCHMSA-N 0 3 415.497 4.340 20 0 HIADHN Cc1nc2c(cccc2C(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)o1 ZINC000471052179 885565321 /nfs/dbraw/zinc/56/53/21/885565321.db2.gz ISRSGNOILNXTTC-GOSISDBHSA-N 0 3 401.470 4.032 20 0 HIADHN Cc1noc(CSc2ccccc2C(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)n1 ZINC000471124534 885661069 /nfs/dbraw/zinc/66/10/69/885661069.db2.gz KXFIVFLBEXVSMV-YCRPNKLZSA-N 0 3 410.543 4.092 20 0 HIADHN CSc1nc(C(C)(C)C)nc(C)c1C(=O)NC[C@H](c1ccccc1)N1CCCC1 ZINC000471173082 885731535 /nfs/dbraw/zinc/73/15/35/885731535.db2.gz OUHWAUOBPPFJMH-GOSISDBHSA-N 0 3 412.603 4.371 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3ncoc3-c3ccc(F)cc3)c(C)c2)CC1 ZINC000471348958 885960224 /nfs/dbraw/zinc/96/02/24/885960224.db2.gz AKNXGBTZFOKMQP-UHFFFAOYSA-N 0 3 408.477 4.183 20 0 HIADHN Cc1c(NC(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)cccc1NC(=O)N(C)C ZINC000471367930 886002734 /nfs/dbraw/zinc/00/27/34/886002734.db2.gz XUXARXRMSUMFGQ-HKUYNNGSSA-N 0 3 409.534 4.046 20 0 HIADHN Cc1c(NC(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)cccc1NC(=O)N(C)C ZINC000471367932 886004584 /nfs/dbraw/zinc/00/45/84/886004584.db2.gz XUXARXRMSUMFGQ-MJGOQNOKSA-N 0 3 409.534 4.046 20 0 HIADHN CCN(Cc1ccc(OCc2cccs2)c(OC)c1)C(=O)[C@@H](C(C)C)N(C)C ZINC000471404201 886055332 /nfs/dbraw/zinc/05/53/32/886055332.db2.gz GRWSVUXQZVFYED-OAQYLSRUSA-N 0 3 404.576 4.270 20 0 HIADHN O=C(N[C@@H](c1ccco1)c1ccccc1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000471527856 886231162 /nfs/dbraw/zinc/23/11/62/886231162.db2.gz KEFYPVWDEYYUIT-AFMYVXGZSA-N 0 3 421.463 4.474 20 0 HIADHN Cc1ccc([C@H](NC(=O)N[C@H]2CCN(Cc3ccccc3)C2)c2ccccn2)cc1 ZINC000471530388 886235047 /nfs/dbraw/zinc/23/50/47/886235047.db2.gz QYKIGTPGGMNYBS-UPVQGACJSA-N 0 3 400.526 4.053 20 0 HIADHN C[C@H](NC(=O)c1cccc(NC(=O)c2cccs2)c1)[C@@H](c1ccccc1)N(C)C ZINC000471555439 886264910 /nfs/dbraw/zinc/26/49/10/886264910.db2.gz NGQBJBMROHJMNI-KKSFZXQISA-N 0 3 407.539 4.422 20 0 HIADHN C[C@H](Oc1ccccc1Br)C(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C ZINC000471569493 886280134 /nfs/dbraw/zinc/28/01/34/886280134.db2.gz HOJNGFTZORDMAN-DOXZYTNZSA-N 0 3 405.336 4.024 20 0 HIADHN Cc1ccc(C)c2c1CCC[C@@H]2NCc1ccccc1OCC(=O)NC[C@@H]1CCCO1 ZINC000471576728 886287553 /nfs/dbraw/zinc/28/75/53/886287553.db2.gz DZMIQHVQYGORBB-GMAHTHKFSA-N 0 3 422.569 4.145 20 0 HIADHN COc1ccccc1[C@@H](CN[C@H](C)c1ccc(S(C)(=O)=O)c(F)c1)OC(C)C ZINC000471582674 886294724 /nfs/dbraw/zinc/29/47/24/886294724.db2.gz PWBXRTSZMBZREU-FOIQADDNSA-N 0 3 409.523 4.055 20 0 HIADHN C[C@@H](CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)N[C@H](CO)c1ccsc1 ZINC000471586547 886298664 /nfs/dbraw/zinc/29/86/64/886298664.db2.gz DHZSLVFRQRUTQE-ZUZCIYMTSA-N 0 3 406.857 4.461 20 0 HIADHN O=C(NCC1CCN(c2ccccc2)CC1)N[C@H](CN1CCCC1)c1ccccc1 ZINC000471599690 886312432 /nfs/dbraw/zinc/31/24/32/886312432.db2.gz VHBOLMHORPGWNV-XMMPIXPASA-N 0 3 406.574 4.039 20 0 HIADHN CCc1cccc(Oc2ccc(NC(=O)N(CCN(C)C)Cc3ccccn3)cn2)c1 ZINC000504127810 913032776 /nfs/dbraw/zinc/03/27/76/913032776.db2.gz XWAYRGGUZNXIQZ-UHFFFAOYSA-N 0 3 419.529 4.427 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)CCc3ncc(-c4ccc(C)cc4)o3)c2)CC1 ZINC000471623481 886341472 /nfs/dbraw/zinc/34/14/72/886341472.db2.gz BBVMAXFMTGFHLE-UHFFFAOYSA-N 0 3 418.541 4.363 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)[C@H](C)Oc3ccc(F)cc3Cl)c2)CC1 ZINC000471627619 886344497 /nfs/dbraw/zinc/34/44/97/886344497.db2.gz SEAOKLDYRSWBNZ-HNNXBMFYSA-N 0 3 405.901 4.027 20 0 HIADHN CCN(C(=O)Nc1cccc(NC(=O)N(C)C)c1C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000471631276 886350016 /nfs/dbraw/zinc/35/00/16/886350016.db2.gz GZYGDRUANHEJKA-FQEVSTJZSA-N 0 3 423.561 4.217 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)c3cnn(-c4ccccc4Cl)c3C)c2)CC1 ZINC000471650815 886366328 /nfs/dbraw/zinc/36/63/28/886366328.db2.gz XAYSTIFTWUIGBO-UHFFFAOYSA-N 0 3 423.948 4.228 20 0 HIADHN CCc1c(C(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)cnn1-c1ccc(OC)cc1 ZINC000471739657 886462661 /nfs/dbraw/zinc/46/26/61/886462661.db2.gz VNWYSBGWUHFYMT-UYAOXDASSA-N 0 3 418.541 4.009 20 0 HIADHN CSc1cccc(N(C(=O)c2cc(COC(C)(C)C)on2)C2CCN(C)CC2)c1 ZINC000471836649 886595010 /nfs/dbraw/zinc/59/50/10/886595010.db2.gz IZUCKZCBYAPIRG-UHFFFAOYSA-N 0 3 417.575 4.453 20 0 HIADHN COc1ccc(NC(=O)[C@H](C)N[C@@H]2C[C@@H](OCc3ccccc3)C2(C)C)cc1OC ZINC000471860019 886632652 /nfs/dbraw/zinc/63/26/52/886632652.db2.gz WZEVEXZNVVQNQF-KNXBSLHKSA-N 0 3 412.530 4.004 20 0 HIADHN Cc1cn([C@H](C)c2ccccc2)nc1NC(=O)NCCCN1CCc2ccccc2C1 ZINC000471861254 886635560 /nfs/dbraw/zinc/63/55/60/886635560.db2.gz NFOAGGKWZSMRHD-HXUWFJFHSA-N 0 3 417.557 4.371 20 0 HIADHN O=C(NCCCc1c[nH]c2ccccc12)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000471862228 886637153 /nfs/dbraw/zinc/63/71/53/886637153.db2.gz KSSGOFBVAYMLIK-UHFFFAOYSA-N 0 3 422.495 4.205 20 0 HIADHN CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)Nc1ccc(Cl)cc1-n1cccn1 ZINC000471870792 886648493 /nfs/dbraw/zinc/64/84/93/886648493.db2.gz NHLYVKARZOACCM-UWJYYQICSA-N 0 3 424.936 4.077 20 0 HIADHN COc1ccc([C@H](NC(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)C(F)(F)F)cc1 ZINC000471917090 886704604 /nfs/dbraw/zinc/70/46/04/886704604.db2.gz FHAZLVYLCXNGAM-QRVBRYPASA-N 0 3 407.436 4.043 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)c1ccc(Cl)cc1Br ZINC000471919155 886708011 /nfs/dbraw/zinc/70/80/11/886708011.db2.gz OKDGSFCXLHADCI-UHFFFAOYSA-N 0 3 423.738 4.312 20 0 HIADHN CC1CCN([C@H](CNC(=O)Nc2ccc(C(F)(F)F)nn2)c2cccs2)CC1 ZINC000471960294 886782864 /nfs/dbraw/zinc/78/28/64/886782864.db2.gz GCGIGBSFQBMYNY-CYBMUJFWSA-N 0 3 413.469 4.152 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2cc(F)cc(F)c2Br)[C@@H]1c1ccccc1 ZINC000471967929 886796420 /nfs/dbraw/zinc/79/64/20/886796420.db2.gz SZLZIGZTGKYGNR-PBHICJAKSA-N 0 3 410.262 4.294 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2ccccc2CC(=O)OC(C)(C)C)[C@H]1c1ccccc1 ZINC000471985109 886811628 /nfs/dbraw/zinc/81/16/28/886811628.db2.gz JSKTVQBDMOLHJM-RBBKRZOGSA-N 0 3 409.530 4.138 20 0 HIADHN Cc1cnc([C@@H](NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)C2CC2)s1 ZINC000471995290 886820830 /nfs/dbraw/zinc/82/08/30/886820830.db2.gz KQQXRCOWULXRIF-GPANFISMSA-N 0 3 416.513 4.007 20 0 HIADHN CCOCCOCc1cccc(NC(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)c1C ZINC000471996688 886821802 /nfs/dbraw/zinc/82/18/02/886821802.db2.gz BLOXPCXZNOZAMQ-DHIUTWEWSA-N 0 3 411.546 4.115 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2ccc(OCc3ccccn3)c(F)c2)[C@@H]1c1ccccc1 ZINC000471996361 886822160 /nfs/dbraw/zinc/82/21/60/886822160.db2.gz WYMCKYMCVWOEPS-GGAORHGYSA-N 0 3 420.488 4.367 20 0 HIADHN CCOCCOCc1cccc(NC(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)c1C ZINC000471996690 886823291 /nfs/dbraw/zinc/82/32/91/886823291.db2.gz BLOXPCXZNOZAMQ-PKTZIBPZSA-N 0 3 411.546 4.115 20 0 HIADHN CCS[C@H]1CCC[C@H](NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)C1 ZINC000472008585 886832540 /nfs/dbraw/zinc/83/25/40/886832540.db2.gz PHEFSGRDFVUCGT-OTBWCIGPSA-N 0 3 407.546 4.155 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2cccc(-c3noc(C4CC4)n3)c2)[C@@H]1c1ccccc1 ZINC000472010212 886833376 /nfs/dbraw/zinc/83/33/76/886833376.db2.gz CJEMSSOPRBWHSX-PMACEKPBSA-N 0 3 403.486 4.181 20 0 HIADHN FC(F)(F)c1cccc(N2CCN(CCCNCc3ncc(Cl)s3)CC2)c1 ZINC000472056383 886867553 /nfs/dbraw/zinc/86/75/53/886867553.db2.gz UWBBFUGLMUXOFX-UHFFFAOYSA-N 0 3 418.916 4.117 20 0 HIADHN Clc1cnc(CNCc2ccccc2CN2CCN(c3ccccc3)CC2)s1 ZINC000472066550 886873375 /nfs/dbraw/zinc/87/33/75/886873375.db2.gz VLBSJXOZJGDXAU-UHFFFAOYSA-N 0 3 412.990 4.409 20 0 HIADHN COc1ccc(OC)c([C@@H]2C[C@H]2C(=O)NC[C@@H](C(C)C)N2CCc3ccccc3C2)c1 ZINC000472121570 886909382 /nfs/dbraw/zinc/90/93/82/886909382.db2.gz DUPYMEPOUWZXFY-QTJGBDASSA-N 0 3 422.569 4.006 20 0 HIADHN O=C(NCc1cc(Br)ccc1F)N1CCCN(Cc2ccccc2)CC1 ZINC000504226604 913097089 /nfs/dbraw/zinc/09/70/89/913097089.db2.gz BYMFWSNGMQKSPF-UHFFFAOYSA-N 0 3 420.326 4.006 20 0 HIADHN O=C(NCc1ccc(Cl)cc1F)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472178533 886978515 /nfs/dbraw/zinc/97/85/15/886978515.db2.gz YJNVIRJFNXPXQX-UHFFFAOYSA-N 0 3 407.839 4.084 20 0 HIADHN Cc1cc2occ(C(=O)Nc3ccc(C(=O)N(C)[C@@H]4CCCN(C)C4)cc3)c2cc1C ZINC000472304171 887128316 /nfs/dbraw/zinc/12/83/16/887128316.db2.gz VBZOHKTVTMMVEQ-HXUWFJFHSA-N 0 3 419.525 4.468 20 0 HIADHN CC(=O)N(Cc1ccc(NC(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)cc1)C(C)C ZINC000472309672 887137092 /nfs/dbraw/zinc/13/70/92/887137092.db2.gz DKKKDWOOBIMSKP-GOTSBHOMSA-N 0 3 408.546 4.010 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2ccc(OCc3ccncc3)cc2)[C@@H]1c1ccccc1 ZINC000472309640 887137122 /nfs/dbraw/zinc/13/71/22/887137122.db2.gz CWZFTDPRRQJODN-PKTZIBPZSA-N 0 3 402.498 4.228 20 0 HIADHN CCN(CC)C(=O)c1cccc(NC(=O)CN2CC[C@H](Cc3ccccc3)[C@@H]2C)c1 ZINC000472355136 887190577 /nfs/dbraw/zinc/19/05/77/887190577.db2.gz KIDIXWBUTJRIGF-PZJWPPBQSA-N 0 3 407.558 4.060 20 0 HIADHN CC(C)Sc1ccc([C@@H](C)NC(=O)N(CCN(C)C)Cc2ccccn2)cc1 ZINC000504260857 913123898 /nfs/dbraw/zinc/12/38/98/913123898.db2.gz HYJXIBPYFXIHQA-GOSISDBHSA-N 0 3 400.592 4.417 20 0 HIADHN COc1ccc([C@@H](C)N(C)C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cc1 ZINC000472446410 887298724 /nfs/dbraw/zinc/29/87/24/887298724.db2.gz IXTVWLQFZWDGGY-RWBZWWBESA-N 0 3 413.484 4.203 20 0 HIADHN COCCCC[C@@H](NC(=O)N1CCCN(Cc2ccccc2)CC1)c1ccccc1 ZINC000472453608 887307355 /nfs/dbraw/zinc/30/73/55/887307355.db2.gz NWKPZUYFIGAYOS-XMMPIXPASA-N 0 3 409.574 4.462 20 0 HIADHN COCCCC[C@H](NC(=O)N(Cc1ccco1)C1CCN(C)CC1)c1ccccc1 ZINC000472453384 887307818 /nfs/dbraw/zinc/30/78/18/887307818.db2.gz ZVZXKTOWTXEESK-QHCPKHFHSA-N 0 3 413.562 4.443 20 0 HIADHN CCS[C@H]1CC[C@@H](N(C)C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)C1 ZINC000472461017 887317616 /nfs/dbraw/zinc/31/76/16/887317616.db2.gz WIMKGIUAFUDINI-MYBQVCMBSA-N 0 3 407.546 4.107 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N1CCC[C@H]1c1cccc(F)c1 ZINC000472461588 887320443 /nfs/dbraw/zinc/32/04/43/887320443.db2.gz BNUABGBADBHDFC-ACBHZAAOSA-N 0 3 413.459 4.478 20 0 HIADHN CC[C@H]1Cc2ccccc2CN1C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472465672 887326334 /nfs/dbraw/zinc/32/63/34/887326334.db2.gz MLJVRMULNDVGGS-GPJFCIFZSA-N 0 3 409.496 4.338 20 0 HIADHN CN(Cc1ccc(Cl)cc1)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472467005 887327727 /nfs/dbraw/zinc/32/77/27/887327727.db2.gz XVVAPRKDDYNCEQ-UHFFFAOYSA-N 0 3 403.876 4.287 20 0 HIADHN C[C@H]1C[C@H](c2ccccc2)CN1C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472467606 887327928 /nfs/dbraw/zinc/32/79/28/887327928.db2.gz ZWHKDILIJATQEC-CBZJXEIOSA-N 0 3 409.496 4.379 20 0 HIADHN C[C@H](c1c(F)cccc1F)N(C)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472469885 887331866 /nfs/dbraw/zinc/33/18/66/887331866.db2.gz YHRSHRIBXFDWEK-LRVUVFPRSA-N 0 3 419.438 4.473 20 0 HIADHN Cc1nc2cc(C(=O)N(CCN(C)C)Cc3ccco3)ccc2n1Cc1ccsc1 ZINC000472547608 887429472 /nfs/dbraw/zinc/42/94/72/887429472.db2.gz CROYXSOIRATIAZ-UHFFFAOYSA-N 0 3 422.554 4.252 20 0 HIADHN CCN(Cc1ccccc1NC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1)C(C)=O ZINC000472675018 887529130 /nfs/dbraw/zinc/52/91/30/887529130.db2.gz DJOYPGKGDPBDKR-QHCPKHFHSA-N 0 3 422.573 4.183 20 0 HIADHN O[C@H](COc1cccc2[nH]ccc21)CN(CCc1ccccn1)Cc1ccc(F)cc1 ZINC000472689218 887543758 /nfs/dbraw/zinc/54/37/58/887543758.db2.gz SJBJGMKGNFKSDN-QFIPXVFZSA-N 0 3 419.500 4.187 20 0 HIADHN CN1CC[C@@H](NC(=O)NCC2(CCOCc3ccccc3)CC2)[C@H]1c1ccccc1 ZINC000472775767 887621737 /nfs/dbraw/zinc/62/17/37/887621737.db2.gz IQNIXXKPBSBAMJ-DHIUTWEWSA-N 0 3 407.558 4.118 20 0 HIADHN CCC[C@@H](NC(=O)N[C@@H](C)CCN1CCN(C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000472909977 887755755 /nfs/dbraw/zinc/75/57/55/887755755.db2.gz YBHBWWOQFMVGEP-HNAYVOBHSA-N 0 3 415.409 4.160 20 0 HIADHN O=C(Nc1ccc(OCc2ccccn2)c(F)c1)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000472922541 887768657 /nfs/dbraw/zinc/76/86/57/887768657.db2.gz NZKXOMKXTBJZLZ-HXUWFJFHSA-N 0 3 420.488 4.196 20 0 HIADHN CC1CCN([C@H](CNC(=O)N2CC[C@@]3(C2)OCc2ccccc23)c2ccccc2)CC1 ZINC000472924826 887772771 /nfs/dbraw/zinc/77/27/71/887772771.db2.gz HOQSDGRUNCWTIC-RSXGOPAZSA-N 0 3 419.569 4.301 20 0 HIADHN CC(=O)CC(C)(C)CC(=O)N(C[C@H]1CCN(Cc2ccccc2)C1)CC(F)(F)F ZINC000473067477 887887596 /nfs/dbraw/zinc/88/75/96/887887596.db2.gz AQACTYSNFZKJLX-IBGZPJMESA-N 0 3 412.496 4.295 20 0 HIADHN CN(C(=O)Nc1cnn(Cc2ccccc2)c1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000473073441 887891631 /nfs/dbraw/zinc/89/16/31/887891631.db2.gz UAHGKVGAMNKQJG-QHCPKHFHSA-N 0 3 403.530 4.060 20 0 HIADHN OC1(Cc2cccc(F)c2)CCN(Cc2ccc(OCc3ccccn3)cc2)CC1 ZINC000473076953 887894631 /nfs/dbraw/zinc/89/46/31/887894631.db2.gz KVPJTGATMBEGBH-UHFFFAOYSA-N 0 3 406.501 4.369 20 0 HIADHN COc1cc(CN2CC[C@@]3(C2)OCc2ccccc23)ccc1OCc1ccncc1 ZINC000473124692 887917057 /nfs/dbraw/zinc/91/70/57/887917057.db2.gz RFMZTZRLOIDUCC-VWLOTQADSA-N 0 3 402.494 4.301 20 0 HIADHN Brc1ccc(-c2nccc(CN3CCSC4(CCOCC4)C3)n2)cc1 ZINC000473181140 887960090 /nfs/dbraw/zinc/96/00/90/887960090.db2.gz ITNGLDBHMAYSKN-UHFFFAOYSA-N 0 3 420.376 4.004 20 0 HIADHN C[C@H](NC(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1)c1ccc(Cl)cn1 ZINC000473182923 887962042 /nfs/dbraw/zinc/96/20/42/887962042.db2.gz AKWXNBLFKRZCLC-LIRRHRJNSA-N 0 3 411.855 4.367 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)Cc3ccc(F)c(F)c3)c(OCC)c2)CC1 ZINC000473228231 888002183 /nfs/dbraw/zinc/00/21/83/888002183.db2.gz WXOVLDGWRQTTLF-UHFFFAOYSA-N 0 3 417.500 4.077 20 0 HIADHN O=C(C[C@H](c1cccs1)n1cccc1)NCC1(N2CCSCC2)CCCC1 ZINC000473281419 888036998 /nfs/dbraw/zinc/03/69/98/888036998.db2.gz POTVCUSIIRSZCO-GOSISDBHSA-N 0 3 403.617 4.007 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)C[C@H](c3cccs3)n3cccc3)cc2)CC1 ZINC000473281332 888037380 /nfs/dbraw/zinc/03/73/80/888037380.db2.gz ZIPWVFOBODETJB-JOCHJYFZSA-N 0 3 422.598 4.305 20 0 HIADHN CC(C)(NCCC(=O)Nc1ccc(C(N)=O)c(Cl)c1)c1cccc(Cl)c1F ZINC000473438153 888158122 /nfs/dbraw/zinc/15/81/22/888158122.db2.gz ZGOYKINADSVIQI-UHFFFAOYSA-N 0 3 412.292 4.085 20 0 HIADHN CCc1c(C(=O)NC[C@H](c2ccccc2)N2CCCC2)cnn1-c1ccc(OC)cc1 ZINC000473496968 888219755 /nfs/dbraw/zinc/21/97/55/888219755.db2.gz JCEKMBCGWVNTLO-XMMPIXPASA-N 0 3 418.541 4.010 20 0 HIADHN C[C@H](CCN1CCN(C)CC1)NC(=O)Nc1ccccc1Oc1ccccc1Cl ZINC000473499915 888226569 /nfs/dbraw/zinc/22/65/69/888226569.db2.gz VEWINDIGHYIKDT-QGZVFWFLSA-N 0 3 416.953 4.280 20 0 HIADHN CCOc1ccc(CNC(=O)N(CCN(C)C)Cc2cccc(F)c2)cc1Cl ZINC000504405037 913223684 /nfs/dbraw/zinc/22/36/84/913223684.db2.gz YOMAIVAXGAVMGH-UHFFFAOYSA-N 0 3 407.917 4.151 20 0 HIADHN O=C(Cc1cccc(C(F)(F)F)c1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473514840 888245303 /nfs/dbraw/zinc/24/53/03/888245303.db2.gz UIHBXOBHIIXLBA-UHFFFAOYSA-N 0 3 408.386 4.169 20 0 HIADHN CCc1c(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cnn1C(CC)CC ZINC000473517522 888248817 /nfs/dbraw/zinc/24/88/17/888248817.db2.gz AWUSHNKMTGPHIJ-UHFFFAOYSA-N 0 3 414.516 4.342 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1ccc(-n2cccc2)c(F)c1 ZINC000473518489 888249590 /nfs/dbraw/zinc/24/95/90/888249590.db2.gz AGJGNEKZAFIVJZ-UHFFFAOYSA-N 0 3 409.427 4.152 20 0 HIADHN O=C(CSCc1cccc(Cl)c1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473521281 888255573 /nfs/dbraw/zinc/25/55/73/888255573.db2.gz OGDVJGGABUNDPX-UHFFFAOYSA-N 0 3 420.928 4.495 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)[C@@H]1C[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000473523953 888260218 /nfs/dbraw/zinc/26/02/18/888260218.db2.gz HNNROOZKKJORCF-NEXFUWMNSA-N 0 3 420.397 4.129 20 0 HIADHN C[C@@H](CCc1cccc(F)c1)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473526799 888263019 /nfs/dbraw/zinc/26/30/19/888263019.db2.gz SGQCJAMNFLDSIB-YCMKEVRSSA-N 0 3 400.460 4.316 20 0 HIADHN CCOc1cc(Cl)ccc1C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473527227 888265632 /nfs/dbraw/zinc/26/56/32/888265632.db2.gz LBCPYCATGGYNAK-UHFFFAOYSA-N 0 3 404.860 4.274 20 0 HIADHN Cc1cc(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)ccc1Br ZINC000473530170 888267233 /nfs/dbraw/zinc/26/72/33/888267233.db2.gz YIKUBRRQNIVYOA-UHFFFAOYSA-N 0 3 419.285 4.293 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)C1(CCOCc2ccccc2)CC1 ZINC000473533437 888269787 /nfs/dbraw/zinc/26/97/87/888269787.db2.gz SQPZWDALSKTFAI-UHFFFAOYSA-N 0 3 424.507 4.295 20 0 HIADHN O=C(CCCOc1ccc(Cl)cc1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473532977 888270020 /nfs/dbraw/zinc/27/00/20/888270020.db2.gz NSVWTLNRKUGOKV-UHFFFAOYSA-N 0 3 418.887 4.421 20 0 HIADHN C[C@H]1[C@H](C(=O)Nc2ccc(CCN3CCSCC3)cc2)CCN1c1ccccc1 ZINC000473609399 888349757 /nfs/dbraw/zinc/34/97/57/888349757.db2.gz VZAATEPJJPHJRI-WMZHIEFXSA-N 0 3 409.599 4.131 20 0 HIADHN CC[C@H](C)Sc1ccc(NC(=O)NC(C)(C)CCN2CCN(C)CC2)c(C)c1 ZINC000473654365 888404076 /nfs/dbraw/zinc/40/40/76/888404076.db2.gz OASDQXDMCXHZJN-SFHVURJKSA-N 0 3 406.640 4.423 20 0 HIADHN Cc1nc(CNC(=O)N[C@H]2CCN(Cc3ccccc3)C2)oc1-c1ccc(Cl)cc1 ZINC000473678469 888443433 /nfs/dbraw/zinc/44/34/33/888443433.db2.gz QPCSFWKGIYFZTP-FQEVSTJZSA-N 0 3 424.932 4.377 20 0 HIADHN C[C@@H](CCN1CCN(C)CC1)NC(=O)Nc1cccc(CSC2CCCCC2)c1 ZINC000473689793 888461967 /nfs/dbraw/zinc/46/19/67/888461967.db2.gz IRCKWFUGZMWKJW-IBGZPJMESA-N 0 3 418.651 4.400 20 0 HIADHN CCN(C(=O)NCc1oc2ccccc2c1OC)[C@H]1CCN(Cc2ccccc2)C1 ZINC000473722067 888499538 /nfs/dbraw/zinc/49/95/38/888499538.db2.gz LCSDLYIMIVSQLW-IBGZPJMESA-N 0 3 407.514 4.247 20 0 HIADHN CN(C)Cc1cccc(NC(=O)N[C@@H]2CCN(c3ccc(Cl)cc3Cl)C2)c1 ZINC000473760419 888554245 /nfs/dbraw/zinc/55/42/45/888554245.db2.gz HERVNDLLNQLTSB-QGZVFWFLSA-N 0 3 407.345 4.455 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3C[C@@H](c4ccc(F)cc4)C[C@H]3C)c2)CC1 ZINC000473803715 888626264 /nfs/dbraw/zinc/62/62/64/888626264.db2.gz DYSYWAIQDAQYSS-QUCCMNQESA-N 0 3 410.537 4.378 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CCC[C@@]3(C)Cc3ccccc3)c2)CC1 ZINC000473814762 888639698 /nfs/dbraw/zinc/63/96/98/888639698.db2.gz BASYQQBMMFNJIY-VWLOTQADSA-N 0 3 406.574 4.458 20 0 HIADHN Cc1c(NC(=O)N2CCC(CN3C[C@H](C)O[C@@H](C)C3)CC2)cccc1C(F)(F)F ZINC000473818271 888647222 /nfs/dbraw/zinc/64/72/22/888647222.db2.gz KQHZGFWAWMXLTH-GJZGRUSLSA-N 0 3 413.484 4.367 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CCC[C@H]3Cc3cccc(F)c3)c2)CC1 ZINC000473820394 888649922 /nfs/dbraw/zinc/64/99/22/888649922.db2.gz PLTXUWRNDSVQMU-QHCPKHFHSA-N 0 3 410.537 4.207 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@H](c3ccccc3)c3cccnc3)c2)CC1 ZINC000473822268 888653779 /nfs/dbraw/zinc/65/37/79/888653779.db2.gz NDNBPBZZUSJJJZ-XMMPIXPASA-N 0 3 415.541 4.135 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)NCc3cccc(COC(C)(C)C)c3)c2)CC1 ZINC000473823622 888654874 /nfs/dbraw/zinc/65/48/74/888654874.db2.gz LWULEBXUEIAOJN-UHFFFAOYSA-N 0 3 424.589 4.465 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N(C)[C@@H](C)c3c(F)cccc3F)c2)CC1 ZINC000473824214 888656785 /nfs/dbraw/zinc/65/67/85/888656785.db2.gz UTISFBKYOXKUAJ-INIZCTEOSA-N 0 3 402.489 4.332 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)NCc3coc(-c4ccc(C)cc4)n3)c2)CC1 ZINC000473824715 888657019 /nfs/dbraw/zinc/65/70/19/888657019.db2.gz VVXHPIDWMRVMAX-UHFFFAOYSA-N 0 3 419.529 4.114 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CCC(Cc4ccccc4F)CC3)c2)CC1 ZINC000473825207 888658204 /nfs/dbraw/zinc/65/82/04/888658204.db2.gz CIHGCHMOIJZRMI-UHFFFAOYSA-N 0 3 424.564 4.454 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)Nc3ccc(OC[C@H]4CCCO4)cc3)c2)CC1 ZINC000473832378 888667191 /nfs/dbraw/zinc/66/71/91/888667191.db2.gz AXFGCACKNHZVQG-HSZRJFAPSA-N 0 3 424.545 4.030 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@H]3CCCO[C@H]3c3ccc(C)cc3)c2)CC1 ZINC000473839139 888678547 /nfs/dbraw/zinc/67/85/47/888678547.db2.gz YQMQHXJKSRFVNC-ZEQRLZLVSA-N 0 3 422.573 4.179 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CCC[C@H](Cc4ccccc4)C3)c2)CC1 ZINC000473838759 888678669 /nfs/dbraw/zinc/67/86/69/888678669.db2.gz XCWZWPWZBKPNET-JOCHJYFZSA-N 0 3 406.574 4.315 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N(C)CCOc3ccccc3Cl)c2)CC1 ZINC000473839003 888678728 /nfs/dbraw/zinc/67/87/28/888678728.db2.gz ZTASFKAEYQCANW-UHFFFAOYSA-N 0 3 416.953 4.025 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)Nc3cn(CC(C)C)nc3C(F)F)c2)CC1 ZINC000473838890 888678814 /nfs/dbraw/zinc/67/88/14/888678814.db2.gz YPZPTKQMUNLLOZ-UHFFFAOYSA-N 0 3 420.508 4.263 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CCc4c(F)cc(F)cc4[C@@H]3C)c2)CC1 ZINC000473841644 888682563 /nfs/dbraw/zinc/68/25/63/888682563.db2.gz TXCXXTHKIJCFFO-INIZCTEOSA-N 0 3 414.500 4.258 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@H](C)c3cccc(OC(C)C)c3)c2)CC1 ZINC000473840794 888683117 /nfs/dbraw/zinc/68/31/17/888683117.db2.gz QLARGHPVGVFJCA-LJQANCHMSA-N 0 3 410.562 4.498 20 0 HIADHN CC(C)Sc1ccccc1NC(=O)NCc1ccc(CN2CCN(C)CC2)cc1 ZINC000473842862 888684833 /nfs/dbraw/zinc/68/48/33/888684833.db2.gz LVOHUMQBVYFJBJ-UHFFFAOYSA-N 0 3 412.603 4.256 20 0 HIADHN CCCOCc1ccccc1CNC(=O)Nc1cccc(N2CCN(CC)CC2)c1 ZINC000473843359 888687069 /nfs/dbraw/zinc/68/70/69/888687069.db2.gz ZMJSJKGDHRGIAZ-UHFFFAOYSA-N 0 3 410.562 4.077 20 0 HIADHN Cc1ccc(CC(=O)N(Cc2ccccc2)C2CCN(C)CC2)cc1Br ZINC000473888650 888757653 /nfs/dbraw/zinc/75/76/53/888757653.db2.gz RYGJJFXRQQLFLI-UHFFFAOYSA-N 0 3 415.375 4.423 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CCSC[C@@H]1c1nccs1)c1ccsc1 ZINC000473890290 888760289 /nfs/dbraw/zinc/76/02/89/888760289.db2.gz CFRCZWOBDWNHFZ-JKSUJKDBSA-N 0 3 410.634 4.087 20 0 HIADHN CCOc1cccc2[nH]cc(CC(=O)N(C)[C@H]3CCCN(Cc4ccccc4)C3)c21 ZINC000473900274 888774703 /nfs/dbraw/zinc/77/47/03/888774703.db2.gz GUOPFTCLKAVWGI-NRFANRHFSA-N 0 3 405.542 4.232 20 0 HIADHN O=C(NCc1nc2c(s1)CCCC2)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000473919889 888801306 /nfs/dbraw/zinc/80/13/06/888801306.db2.gz FISMVYGJLZZEMD-FQEVSTJZSA-N 0 3 423.504 4.093 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)C3(Cc4ccccc4Cl)CC3)CC2)C[C@H](C)O1 ZINC000473921947 888802284 /nfs/dbraw/zinc/80/22/84/888802284.db2.gz KYIKFBRWLSTPKS-OALUTQOASA-N 0 3 419.009 4.401 20 0 HIADHN CSc1cccc(C)c1NC(=O)N1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000473974597 888839900 /nfs/dbraw/zinc/83/99/00/888839900.db2.gz BANUICPXODMHMQ-ROUUACIJSA-N 0 3 405.608 4.460 20 0 HIADHN O=C(Nc1ccccc1-c1cccs1)N[C@H]1CCN(Cc2ccccc2)C[C@H]1CO ZINC000473976839 888841778 /nfs/dbraw/zinc/84/17/78/888841778.db2.gz STIVVTGAYWZANB-FPOVZHCZSA-N 0 3 421.566 4.420 20 0 HIADHN C[C@H](CC(=O)Nc1ccccc1)N[C@@H]1CCN(c2ccc(Cl)cc2Cl)C1=O ZINC000473986266 888847828 /nfs/dbraw/zinc/84/78/28/888847828.db2.gz IPVFSDXIKFTYBX-CXAGYDPISA-N 0 3 406.313 4.106 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N[C@H](C)c2noc(-c3ccccc3)n2)N2CCCC2)cc1 ZINC000474015759 888870219 /nfs/dbraw/zinc/87/02/19/888870219.db2.gz WHWRMAJKBAHVPG-NQIIRXRSSA-N 0 3 419.529 4.242 20 0 HIADHN CCOC1CC(CCN[C@H](c2cccc(S(C)(=O)=O)c2)c2ccc(F)c(F)c2)C1 ZINC000474028027 888877476 /nfs/dbraw/zinc/87/74/76/888877476.db2.gz CSFYXFFISLJARD-IVMBPFOVSA-N 0 3 423.525 4.253 20 0 HIADHN COc1ccc2c(c1)C(C)(C)C[C@H]2N[C@@H](C)c1cccc(S(=O)(=O)N(C)C)c1 ZINC000474048479 888888589 /nfs/dbraw/zinc/88/85/89/888888589.db2.gz WZIXIHIFFITWOE-YCRPNKLZSA-N 0 3 402.560 4.019 20 0 HIADHN COc1ccc2c(c1)C(C)(C)C[C@H]2NCc1cccc(C(=O)NC[C@@H]2CCCO2)c1 ZINC000474054877 888892800 /nfs/dbraw/zinc/89/28/00/888892800.db2.gz IQSFRBQORFCSFB-NZQKXSOJSA-N 0 3 408.542 4.116 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N[C@@H](C)c2ccc(Br)cn2)C1 ZINC000474180834 889020696 /nfs/dbraw/zinc/02/06/96/889020696.db2.gz FWLKVUACIOQRAC-HDMKZQKVSA-N 0 3 417.351 4.040 20 0 HIADHN COc1cc2c(cc1OC)CN(C(=O)CN1CCC[C@@H]1c1cc(C)ccc1C)CC2 ZINC000474219421 889058562 /nfs/dbraw/zinc/05/85/62/889058562.db2.gz KZDRISUNXVEHRS-JOCHJYFZSA-N 0 3 408.542 4.042 20 0 HIADHN COc1ccc(CC2CCN([C@H](C)C(=O)NCCc3c[nH]c4ccccc34)CC2)cc1 ZINC000504528411 913309323 /nfs/dbraw/zinc/30/93/23/913309323.db2.gz VXJRALOOHPLHJQ-LJQANCHMSA-N 0 3 419.569 4.178 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N[C@@H]3COc4ccc(Cl)cc43)c(C)c2)CC1 ZINC000474353701 889232589 /nfs/dbraw/zinc/23/25/89/889232589.db2.gz VFWSBXUJDJKYGM-HXUWFJFHSA-N 0 3 414.937 4.046 20 0 HIADHN C[C@@H](NC(=O)Nc1ccc(OCC2CCOCC2)cc1)[C@H](c1ccccc1)N(C)C ZINC000474434681 889299719 /nfs/dbraw/zinc/29/97/19/889299719.db2.gz AMHLGPYHWIMBQZ-WZONZLPQSA-N 0 3 411.546 4.305 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)c1ccc(=O)n(Cc2csc(C(C)C)n2)c1 ZINC000474487462 889346656 /nfs/dbraw/zinc/34/66/56/889346656.db2.gz VPWIVBFLSAGPAL-UHFFFAOYSA-N 0 3 424.570 4.099 20 0 HIADHN C[C@@H](NC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1)c1noc(-c2ccccc2)n1 ZINC000474508328 889370933 /nfs/dbraw/zinc/37/09/33/889370933.db2.gz BZFNCIADMIOUNO-RBUKOAKNSA-N 0 3 419.529 4.104 20 0 HIADHN Cc1cc(Br)ccc1NC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000474565817 889442137 /nfs/dbraw/zinc/44/21/37/889442137.db2.gz OBVZDNPCQZANAR-SFHVURJKSA-N 0 3 402.336 4.496 20 0 HIADHN CN(C(=O)Nc1cccc(NC(=O)c2ccoc2)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000474593291 889461394 /nfs/dbraw/zinc/46/13/94/889461394.db2.gz REGSCBIASZCBOS-JOCHJYFZSA-N 0 3 418.497 4.270 20 0 HIADHN CC(C)c1cccc(C(=O)N(CCN(C)C)Cc2ccc(Br)cc2)n1 ZINC000474685655 889548302 /nfs/dbraw/zinc/54/83/02/889548302.db2.gz PAMLFOZJKKMBFW-UHFFFAOYSA-N 0 3 404.352 4.172 20 0 HIADHN CN(C(=O)Nc1ccc(NC(=O)c2ccco2)cc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000474722045 889578366 /nfs/dbraw/zinc/57/83/66/889578366.db2.gz WRECZPPBCXKRHZ-NRFANRHFSA-N 0 3 418.497 4.270 20 0 HIADHN CN(C(=O)Nc1ccccc1OC[C@H]1CCCCO1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000474722219 889578577 /nfs/dbraw/zinc/57/85/77/889578577.db2.gz YUCKSXUNQGDDGN-FCHUYYIVSA-N 0 3 423.557 4.373 20 0 HIADHN CN1CCN(CCC(C)(C)NC(=O)c2ccc(-c3ccc(Cl)cc3)s2)CC1 ZINC000474809982 889662280 /nfs/dbraw/zinc/66/22/80/889662280.db2.gz ONGYHIAXAGSCMU-UHFFFAOYSA-N 0 3 405.995 4.214 20 0 HIADHN CN1CCN(CCC(C)(C)NC(=O)CCCc2ccc3c(c2)-c2ccccc2C3)CC1 ZINC000474811232 889663862 /nfs/dbraw/zinc/66/38/62/889663862.db2.gz NTJCNTDFVNGBCS-UHFFFAOYSA-N 0 3 419.613 4.113 20 0 HIADHN C[C@H](Sc1ccccn1)C(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1 ZINC000474928356 889787231 /nfs/dbraw/zinc/78/72/31/889787231.db2.gz NGJXQNGPOXUWPO-HNNXBMFYSA-N 0 3 411.493 4.171 20 0 HIADHN Cc1cnc([C@@H](C)CNCc2c(F)ccc(I)c2F)s1 ZINC000474949653 889805569 /nfs/dbraw/zinc/80/55/69/889805569.db2.gz UNYHOIPEVWNVKL-QMMMGPOBSA-N 0 3 408.255 4.228 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N[C@H]3CCCc4ccc(F)cc43)c(C)c2)CC1 ZINC000475002745 889854192 /nfs/dbraw/zinc/85/41/92/889854192.db2.gz KGYDCNHLHWAWEX-QHCPKHFHSA-N 0 3 410.537 4.475 20 0 HIADHN CCN(C(=O)Nc1ccc(Cn2cccn2)cc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475002779 889854404 /nfs/dbraw/zinc/85/44/04/889854404.db2.gz KVBUPSOVLGANJV-QHCPKHFHSA-N 0 3 403.530 4.060 20 0 HIADHN CCN(C(=O)Nc1ccc(Cn2cccn2)cc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475002778 889854736 /nfs/dbraw/zinc/85/47/36/889854736.db2.gz KVBUPSOVLGANJV-HSZRJFAPSA-N 0 3 403.530 4.060 20 0 HIADHN CC(C)[C@H](NC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1)c1ccc2c(c1)OCCO2 ZINC000475007954 889860125 /nfs/dbraw/zinc/86/01/25/889860125.db2.gz JZWJFYDZAPYXOT-QPPBQGQZSA-N 0 3 423.557 4.071 20 0 HIADHN CCN(C(=O)Nc1cc(NC(C)=O)ccc1Cl)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475008330 889860776 /nfs/dbraw/zinc/86/07/76/889860776.db2.gz LNBOLBWJIANBJU-LJQANCHMSA-N 0 3 414.937 4.427 20 0 HIADHN CCN(C(=O)Nc1ccc(C)c(C(=O)NC(C)C)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475011081 889865255 /nfs/dbraw/zinc/86/52/55/889865255.db2.gz SKFAVPAVLOPBCZ-QFIPXVFZSA-N 0 3 422.573 4.262 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(Nc2ccnc3cc(Br)cnc32)CC1 ZINC000475040226 889892104 /nfs/dbraw/zinc/89/21/04/889892104.db2.gz LZEWJOGNDFOJKN-CQSZACIVSA-N 0 3 412.335 4.425 20 0 HIADHN CCN1CCN(c2cccc(NCc3csc(COc4ccccc4)n3)c2)CC1 ZINC000475085057 889930793 /nfs/dbraw/zinc/93/07/93/889930793.db2.gz CYQKNYQHSUTHSY-UHFFFAOYSA-N 0 3 408.571 4.476 20 0 HIADHN CN(Cc1cc(Cl)cc(C(F)(F)F)c1)C[C@@H]1C[C@H](F)CN1Cc1ncccn1 ZINC000475097118 889944005 /nfs/dbraw/zinc/94/40/05/889944005.db2.gz YDOWUFLARADVTN-IRXDYDNUSA-N 0 3 416.850 4.193 20 0 HIADHN CCN(C(=O)Nc1ccccc1-n1nccc1C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475102151 889951220 /nfs/dbraw/zinc/95/12/20/889951220.db2.gz RGUQMCGINOFUCX-OAQYLSRUSA-N 0 3 403.530 4.309 20 0 HIADHN CCN(C(=O)Nc1ccc(C[C@H](C)C(=O)OC)cc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475109592 889958459 /nfs/dbraw/zinc/95/84/59/889958459.db2.gz LAKIIYBSRZPICK-CVDCTZTESA-N 0 3 423.557 4.167 20 0 HIADHN C[C@H](NC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(NC(=O)C2CC2)cc1 ZINC000475137522 890004601 /nfs/dbraw/zinc/00/46/01/890004601.db2.gz KIORNQLTIPIEAR-FDDCHVKYSA-N 0 3 420.557 4.012 20 0 HIADHN C[C@H](NC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1)c1ccccc1OC(F)F ZINC000475146379 890014107 /nfs/dbraw/zinc/01/41/07/890014107.db2.gz OBXUEXFUACJHSJ-FUHWJXTLSA-N 0 3 403.473 4.265 20 0 HIADHN CCN(C(=O)NCc1coc(-c2ccccc2)n1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475156512 890021107 /nfs/dbraw/zinc/02/11/07/890021107.db2.gz OLDIQHSOIJTAPD-QFIPXVFZSA-N 0 3 404.514 4.148 20 0 HIADHN CCN(C(=O)NCc1cccc(OC(C)(C)C)n1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475160148 890024729 /nfs/dbraw/zinc/02/47/29/890024729.db2.gz BCDHQRVERFZJIJ-NRFANRHFSA-N 0 3 410.562 4.065 20 0 HIADHN CCN(C(=O)NCc1cccc(OCC(F)F)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475163060 890027429 /nfs/dbraw/zinc/02/74/29/890027429.db2.gz OCKPWYVFPNTCBW-HXUWFJFHSA-N 0 3 417.500 4.137 20 0 HIADHN CCN(C(=O)N[C@H](C)c1cn(C(C)(C)C)nc1C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475166899 890032137 /nfs/dbraw/zinc/03/21/37/890032137.db2.gz XZYJHKUHQDVXNB-NQIIRXRSSA-N 0 3 411.594 4.314 20 0 HIADHN CCN(C(=O)NCc1ccccc1OC(F)F)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475167011 890033100 /nfs/dbraw/zinc/03/31/00/890033100.db2.gz ZPLGMBOYGDUGGX-LJQANCHMSA-N 0 3 403.473 4.094 20 0 HIADHN CCC(CC)[C@@H]1C[C@H](NC(=O)N(CC)[C@@H]2CCN(Cc3ccccc3)C2)CCO1 ZINC000475173283 890040339 /nfs/dbraw/zinc/04/03/39/890040339.db2.gz IZCUIDBOQLWMGW-ZLNRFVROSA-N 0 3 401.595 4.276 20 0 HIADHN O=C(N1CCc2cccc(F)c2C1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000504674090 913412717 /nfs/dbraw/zinc/41/27/17/913412717.db2.gz VJMZCXHHNCSLHI-NRFANRHFSA-N 0 3 406.423 4.165 20 0 HIADHN C[C@@H](CC(=O)N1CCC[C@H](CN2CCN(c3ccccn3)CC2)C1)C1CCCCC1 ZINC000504676114 913414851 /nfs/dbraw/zinc/41/48/51/913414851.db2.gz FYGBEWBABDXNMT-FCHUYYIVSA-N 0 3 412.622 4.049 20 0 HIADHN Fc1ccccc1CO[C@H]1CCCN(Cc2c[nH]nc2-c2ccc3c(c2)OCO3)C1 ZINC000475272058 890169803 /nfs/dbraw/zinc/16/98/03/890169803.db2.gz FCDOFAYVUAKGFI-IBGZPJMESA-N 0 3 409.461 4.126 20 0 HIADHN COc1ccc([C@@H](CNC(=O)[C@@H](C)c2cn(C)c3ccccc23)N2CCCC2)cc1 ZINC000475285393 890186489 /nfs/dbraw/zinc/18/64/89/890186489.db2.gz GTTSKPNLGXQEOI-MHECFPHRSA-N 0 3 405.542 4.244 20 0 HIADHN COc1cc(C(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)ccc1OC1CCCC1 ZINC000475306864 890217662 /nfs/dbraw/zinc/21/76/62/890217662.db2.gz VPPJEBCMZCACKB-OAQYLSRUSA-N 0 3 408.542 4.363 20 0 HIADHN Cc1c(C(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)cnn1-c1ccccc1Cl ZINC000475307019 890218536 /nfs/dbraw/zinc/21/85/36/890218536.db2.gz XJXBFWMSVKGTRX-LJQANCHMSA-N 0 3 408.933 4.181 20 0 HIADHN CN(C(=O)CCCc1ncc(-c2ccccc2)o1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475314409 890230349 /nfs/dbraw/zinc/23/03/49/890230349.db2.gz UBYIZNRNNXYWTF-QFIPXVFZSA-N 0 3 403.526 4.397 20 0 HIADHN Cc1ccc(C(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)cc1NC(=O)c1ccco1 ZINC000475316116 890231077 /nfs/dbraw/zinc/23/10/77/890231077.db2.gz LHANSRPDYFDDJJ-OAQYLSRUSA-N 0 3 417.509 4.187 20 0 HIADHN CO[C@H]1CCC[C@H](CC(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)C1 ZINC000475316691 890232189 /nfs/dbraw/zinc/23/21/89/890232189.db2.gz XVNABAKLVDBLOZ-LPHOPBHVSA-N 0 3 400.485 4.191 20 0 HIADHN CCCOc1c(Cl)cc(C(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)cc1OC ZINC000475317019 890233582 /nfs/dbraw/zinc/23/35/82/890233582.db2.gz NFNJTBUHFDAUGU-IBGZPJMESA-N 0 3 416.949 4.484 20 0 HIADHN CN(C(=O)Cc1csc(Cc2ccccc2)n1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475319725 890237706 /nfs/dbraw/zinc/23/77/06/890237706.db2.gz UJPSPUHNGZLQJT-JOCHJYFZSA-N 0 3 405.567 4.009 20 0 HIADHN CN(C(=O)Cc1csc(-c2cccc(F)c2)n1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475320919 890239841 /nfs/dbraw/zinc/23/98/41/890239841.db2.gz XGUYGTPMURLNDE-NRFANRHFSA-N 0 3 409.530 4.225 20 0 HIADHN O=C(N[C@@H]1C[C@H]1c1ccc(OC(F)F)cc1)N1CCCN(Cc2ccccc2)CC1 ZINC000475400286 890328979 /nfs/dbraw/zinc/32/89/79/890328979.db2.gz OGUJRTMKLJSOAW-LEWJYISDSA-N 0 3 415.484 4.061 20 0 HIADHN Cc1noc(C)c1COc1cccc(C(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000475418532 890343044 /nfs/dbraw/zinc/34/30/44/890343044.db2.gz CDCNKNHJSUYKQK-JOCHJYFZSA-N 0 3 419.525 4.217 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CN1CCC(O)(Cc2cccc(C)c2)CC1 ZINC000475493699 890399646 /nfs/dbraw/zinc/39/96/46/890399646.db2.gz OHTSKCQQBCGQBZ-UHFFFAOYSA-N 0 3 403.570 4.426 20 0 HIADHN CC(C)N(CCN(C)C)C(=O)Nc1ccc(Br)cc1OC(F)(F)F ZINC000475570889 890501538 /nfs/dbraw/zinc/50/15/38/890501538.db2.gz DIYMJALQGXZXPR-UHFFFAOYSA-N 0 3 412.250 4.152 20 0 HIADHN CCNC(=O)COc1ccc(CN2CCC(c3cccc(Cl)c3)CC2)cc1OC ZINC000475579533 890509893 /nfs/dbraw/zinc/50/98/93/890509893.db2.gz VNHAEJNEJPWNMK-UHFFFAOYSA-N 0 3 416.949 4.243 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)Cc2nc(-c3ccc(F)cc3)cs2)C1 ZINC000475614309 890543041 /nfs/dbraw/zinc/54/30/41/890543041.db2.gz VGUZYORVCKCWQE-OXQOHEQNSA-N 0 3 409.530 4.443 20 0 HIADHN OC[C@H](NCc1cc(-n2ccnc2)cs1)c1ccc(Cl)cc1C(F)(F)F ZINC000475640532 890582451 /nfs/dbraw/zinc/58/24/51/890582451.db2.gz SDWALJCXCYVTEO-INIZCTEOSA-N 0 3 401.841 4.429 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)Nc2ccccc2COc2ccccc2)CC1 ZINC000475669607 890613583 /nfs/dbraw/zinc/61/35/83/890613583.db2.gz VBWWDPGIUUSSPX-UHFFFAOYSA-N 0 3 411.546 4.277 20 0 HIADHN CCc1nnc(-c2ccc(NC(=O)N[C@H]3CCN([C@H](C)c4ccccc4)C3)cc2)o1 ZINC000475712920 890651463 /nfs/dbraw/zinc/65/14/63/890651463.db2.gz CMTMYDYLOWYIJD-UZLBHIALSA-N 0 3 405.502 4.256 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)Nc2ccc(OC3CCCC3)c(F)c2)CC1 ZINC000475838595 890770802 /nfs/dbraw/zinc/77/08/02/890770802.db2.gz XRMTZPJOSTUYQY-UHFFFAOYSA-N 0 3 407.530 4.158 20 0 HIADHN Cc1cc(NC(=O)c2oc(CC3CC3)nc2C)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000475902975 890832182 /nfs/dbraw/zinc/83/21/82/890832182.db2.gz DGRNWASTCQMBOA-HXUWFJFHSA-N 0 3 419.529 4.140 20 0 HIADHN C[C@H](c1ccc([S@](C)=O)cc1)N(C)C(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000475956688 890877652 /nfs/dbraw/zinc/87/76/52/890877652.db2.gz KOQNRAZVWFQTBG-RCAOJXLUSA-N 0 3 419.616 4.025 20 0 HIADHN C[C@H](NC(=O)NC[C@@H](Cc1ccccc1)N(C)C)c1ccc(-c2cccnc2)cc1 ZINC000475972204 890890237 /nfs/dbraw/zinc/89/02/37/890890237.db2.gz CWAXXQRKMXMAGV-YADARESESA-N 0 3 402.542 4.282 20 0 HIADHN C[C@H](NC(=O)N(C)[C@@H]1CCN(C2CC2)C1)c1ccc(NC(=O)c2ccc(F)cc2)cc1 ZINC000476152450 891076514 /nfs/dbraw/zinc/07/65/14/891076514.db2.gz MBEAIEKQAZOAOA-KSFYIVLOSA-N 0 3 424.520 4.017 20 0 HIADHN COc1cc([C@H](C)NC(=O)N(C)[C@H]2CCN(C3CC3)C2)ccc1OCCC(C)C ZINC000476163656 891092113 /nfs/dbraw/zinc/09/21/13/891092113.db2.gz RWGZHSKDJYLNDC-PXNSSMCTSA-N 0 3 403.567 4.059 20 0 HIADHN COc1ccc(CNC(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)cc1F ZINC000504803039 913525703 /nfs/dbraw/zinc/52/57/03/913525703.db2.gz WLJWKFRLTOHDTQ-GOSISDBHSA-N 0 3 405.539 4.168 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)Cc2nc(-c3ccc(F)cc3)cs2)c1 ZINC000476239342 891162190 /nfs/dbraw/zinc/16/21/90/891162190.db2.gz RMJIWVRFLOWODW-UHFFFAOYSA-N 0 3 411.546 4.391 20 0 HIADHN O=C(N[C@H]1CCCOc2ccccc21)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000504812708 913532591 /nfs/dbraw/zinc/53/25/91/913532591.db2.gz QDJKFWCDIHQPBE-SIKLNZKXSA-N 0 3 418.459 4.471 20 0 HIADHN CO[C@@H]1CCC[C@@H](CC(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)C1 ZINC000476415725 891330013 /nfs/dbraw/zinc/33/00/13/891330013.db2.gz OCCGAPYHJKNAQN-BHIFYINESA-N 0 3 410.562 4.172 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N2CC3(CCCC3)c3c2cccc3F)CC1 ZINC000476447907 891359628 /nfs/dbraw/zinc/35/96/28/891359628.db2.gz PMPVYTRUMJCXAZ-UHFFFAOYSA-N 0 3 403.542 4.057 20 0 HIADHN CCc1ccc([C@@H]2CCCCCN2C(=O)NC2CCN(CCOC(C)C)CC2)o1 ZINC000476453251 891364083 /nfs/dbraw/zinc/36/40/83/891364083.db2.gz SPEUFMWUVZAVOQ-NRFANRHFSA-N 0 3 405.583 4.358 20 0 HIADHN Cc1ccc([C@@H]2CCC[C@H]2N(C)C(=O)NC2CCN(CCOC(C)C)CC2)cc1 ZINC000476456259 891367459 /nfs/dbraw/zinc/36/74/59/891367459.db2.gz YWDKEHQZXFVELN-XZOQPEGZSA-N 0 3 401.595 4.162 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1nc(SCc2ccccc2)ns1 ZINC000476479334 891390123 /nfs/dbraw/zinc/39/01/23/891390123.db2.gz FKUWXFZSMNWOON-UHFFFAOYSA-N 0 3 417.560 4.019 20 0 HIADHN C[C@H](C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1)c1cn(C)c2ccccc12 ZINC000476766603 891740270 /nfs/dbraw/zinc/74/02/70/891740270.db2.gz SRTVEGSZIBLIIQ-SFHVURJKSA-N 0 3 423.532 4.081 20 0 HIADHN CC(C)[C@H](CNC(=O)Nc1ccccc1N1CCCC1=O)N1CCc2ccccc2C1 ZINC000504863320 913592886 /nfs/dbraw/zinc/59/28/86/913592886.db2.gz JPGUEABURXFFNE-QHCPKHFHSA-N 0 3 420.557 4.018 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)NCc1ccc(-c2csc(C)n2)o1)c1ccco1 ZINC000476813567 891800558 /nfs/dbraw/zinc/80/05/58/891800558.db2.gz JOTOELSQEUREAP-BBRMVZONSA-N 0 3 402.520 4.233 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)NCc1ccc(-c2csc(C)n2)o1)c1ccco1 ZINC000476813569 891800702 /nfs/dbraw/zinc/80/07/02/891800702.db2.gz JOTOELSQEUREAP-CZUORRHYSA-N 0 3 402.520 4.233 20 0 HIADHN CCC(=O)Nc1ccc(Cl)c(NC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000504881387 913609168 /nfs/dbraw/zinc/60/91/68/913609168.db2.gz HOVMEABXNZMRLR-SFHVURJKSA-N 0 3 414.937 4.475 20 0 HIADHN CN(C)C[C@@H](NC(=O)Nc1cccc(-c2noc(C3CC3)n2)c1)c1ccc(F)cc1 ZINC000477046198 891974905 /nfs/dbraw/zinc/97/49/05/891974905.db2.gz JMFWWBAIXMYNRB-LJQANCHMSA-N 0 3 409.465 4.178 20 0 HIADHN CC(=O)c1c(C)[nH]c(C(=O)[C@H](C)N2CC[C@@]3(C2)CCCN(Cc2ccccc2)C3)c1C ZINC000477059680 891990743 /nfs/dbraw/zinc/99/07/43/891990743.db2.gz CFJYKENQEIWUAR-FNZWTVRRSA-N 0 3 421.585 4.393 20 0 HIADHN CC(=O)c1c(C)[nH]c(C(=O)[C@@H](C)N2CC[C@@]3(C2)CCCN(Cc2ccccc2)C3)c1C ZINC000477059690 891993686 /nfs/dbraw/zinc/99/36/86/891993686.db2.gz CFJYKENQEIWUAR-IBVKSMDESA-N 0 3 421.585 4.393 20 0 HIADHN COc1ccc(NC(=O)[C@H](NCCCn2cnc3ccccc32)c2ccccc2)cc1 ZINC000477100840 892034317 /nfs/dbraw/zinc/03/43/17/892034317.db2.gz OYXRGUUIUKBCPX-XMMPIXPASA-N 0 3 414.509 4.405 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)Nc1ccccc1-c1nncn1C(C)C)c1ccco1 ZINC000477184785 892105171 /nfs/dbraw/zinc/10/51/71/892105171.db2.gz CYPBMUDWDHNUIN-APWZRJJASA-N 0 3 410.522 4.370 20 0 HIADHN C[C@H](CNC(=O)N(CCc1ccccc1)Cc1ccncc1)N(C)Cc1ccccc1 ZINC000477336731 892306358 /nfs/dbraw/zinc/30/63/58/892306358.db2.gz BRZMTGBPKRFYPG-JOCHJYFZSA-N 0 3 416.569 4.356 20 0 HIADHN CC[C@@H](NC(=O)NC[C@@H](C)N(C)Cc1ccccc1)c1nc(-c2ccccc2)c[nH]1 ZINC000477339576 892307454 /nfs/dbraw/zinc/30/74/54/892307454.db2.gz QPKCYAHBUDRTQN-WIYYLYMNSA-N 0 3 405.546 4.348 20 0 HIADHN CN(C)Cc1ccc(S(=O)(=O)N[C@@H](c2cccc(C(F)(F)F)c2)C2CC2)cc1 ZINC000477475346 892456301 /nfs/dbraw/zinc/45/63/01/892456301.db2.gz KQRWXVRNMWTBFQ-LJQANCHMSA-N 0 3 412.477 4.197 20 0 HIADHN COc1ccc([C@@H](NS(=O)(=O)c2ccc(CN(C)C)cc2)c2ccc(C)cc2)cc1 ZINC000477537524 892569809 /nfs/dbraw/zinc/56/98/09/892569809.db2.gz MPPZXTPJNWHAAR-DEOSSOPVSA-N 0 3 424.566 4.133 20 0 HIADHN COCCN(CCN(C)C)C(=O)N[C@@H](c1ccccc1)c1cccc2ccccc21 ZINC000477585449 892654736 /nfs/dbraw/zinc/65/47/36/892654736.db2.gz HXWJRKHEXHRGTB-DEOSSOPVSA-N 0 3 405.542 4.149 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)Cc2nc(-c3ccc(F)cc3)cs2)CC1 ZINC000477697033 892814534 /nfs/dbraw/zinc/81/45/34/892814534.db2.gz DHRXZVSNIOWQJC-INIZCTEOSA-N 0 3 424.545 4.229 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1cc(C(F)(F)F)ccc1F ZINC000477714103 892822959 /nfs/dbraw/zinc/82/29/59/892822959.db2.gz BGOMWIQCNQZALV-UHFFFAOYSA-N 0 3 410.411 4.301 20 0 HIADHN Cc1nc2cc(F)ccc2cc1C(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000477732990 892831834 /nfs/dbraw/zinc/83/18/34/892831834.db2.gz XKXIKKNRUNJUQO-UHFFFAOYSA-N 0 3 407.489 4.139 20 0 HIADHN C[C@@H]1C[C@@H]1c1ccc([C@H]2C[C@@H]2C(=O)Nc2cccc(CN3CCC(CO)CC3)c2)o1 ZINC000477735808 892833279 /nfs/dbraw/zinc/83/32/79/892833279.db2.gz BIMAAEKRKXHHPO-SEPFQZFQSA-N 0 3 408.542 4.350 20 0 HIADHN Cc1ccc(Br)c(C(=O)N(Cc2ccccc2)C2CCN(C)CC2)c1 ZINC000477736908 892834135 /nfs/dbraw/zinc/83/41/35/892834135.db2.gz IHDRFTBXRWLGIO-UHFFFAOYSA-N 0 3 401.348 4.494 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1ccc(Br)c(F)c1 ZINC000477738037 892835125 /nfs/dbraw/zinc/83/51/25/892835125.db2.gz FDLOBGMDAWNLAR-UHFFFAOYSA-N 0 3 421.310 4.045 20 0 HIADHN C[C@@H]1CCc2ccccc2N1CCC(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000477739125 892835588 /nfs/dbraw/zinc/83/55/88/892835588.db2.gz LXINOCIRKGWCJQ-HXUWFJFHSA-N 0 3 421.585 4.061 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCc1csc(-c2ccco2)n1)c1ccsc1 ZINC000477825791 892890503 /nfs/dbraw/zinc/89/05/03/892890503.db2.gz ODIZIQWTQQOYSO-INIZCTEOSA-N 0 3 404.561 4.347 20 0 HIADHN C[C@H]1C[C@H]1c1ccc(CN(C(=O)NCC2(N3CCSCC3)CCCC2)C2CC2)o1 ZINC000504977454 913718788 /nfs/dbraw/zinc/71/87/88/913718788.db2.gz QYAQLIUBDCVYNZ-FXAWDEMLSA-N 0 3 417.619 4.439 20 0 HIADHN C[C@H]1C[C@@H]1c1ccc(CN(C(=O)NCC2(N3CCSCC3)CCCC2)C2CC2)o1 ZINC000504977455 913719655 /nfs/dbraw/zinc/71/96/55/913719655.db2.gz QYAQLIUBDCVYNZ-PXNSSMCTSA-N 0 3 417.619 4.439 20 0 HIADHN C[C@H](N[C@@H]1CCCc2nc(-c3ccccc3Br)sc21)C(=O)N(C)C ZINC000477917157 892998771 /nfs/dbraw/zinc/99/87/71/892998771.db2.gz STNVESJCCJOQKN-SMDDNHRTSA-N 0 3 408.365 4.016 20 0 HIADHN Cc1ccc(CN2CC[C@H](N[C@@H](C)c3ccc(OCC(F)(F)F)cc3)C2=O)cc1 ZINC000477918893 893004958 /nfs/dbraw/zinc/00/49/58/893004958.db2.gz QJESQCBUHMCYBP-JXFKEZNVSA-N 0 3 406.448 4.388 20 0 HIADHN C[C@H](NCc1ccc(S(=O)(=O)CCO)cc1)c1ccc(-c2ccccc2)s1 ZINC000477927604 893015264 /nfs/dbraw/zinc/01/52/64/893015264.db2.gz KYVJERZQTOJCON-INIZCTEOSA-N 0 3 401.553 4.032 20 0 HIADHN C[C@H](NCc1ccc(S(=O)(=O)CCO)cc1)c1ccc(C2CCCCC2)cc1 ZINC000477942142 893031566 /nfs/dbraw/zinc/03/15/66/893031566.db2.gz JPUQMCRADHZIEY-SFHVURJKSA-N 0 3 401.572 4.351 20 0 HIADHN Cc1ccc([C@H](NCc2ccc(S(=O)(=O)CCO)cc2)C2CCCCC2)cc1 ZINC000477946751 893037722 /nfs/dbraw/zinc/03/77/22/893037722.db2.gz LXXJGWUADVARPH-HSZRJFAPSA-N 0 3 401.572 4.172 20 0 HIADHN Cc1ccc([C@@H](Cc2ccccc2)NCc2ccc(S(=O)(=O)CCO)cc2)cc1C ZINC000477951993 893042812 /nfs/dbraw/zinc/04/28/12/893042812.db2.gz XZNCQTVDBSEZRN-RUZDIDTESA-N 0 3 423.578 4.143 20 0 HIADHN Cc1cc(Br)c2ccccc2c1NC(=O)N1CC[C@H](N2CC=CC2)C1 ZINC000477976634 893071826 /nfs/dbraw/zinc/07/18/26/893071826.db2.gz IYVPWWKNUHJBHE-HNNXBMFYSA-N 0 3 400.320 4.389 20 0 HIADHN C[C@H](c1cccc(NC(=O)c2ccccc2)c1)N1CCC(N2CCCCC2=O)CC1 ZINC000477991061 893091950 /nfs/dbraw/zinc/09/19/50/893091950.db2.gz LCXFNHWTGSRKAD-LJQANCHMSA-N 0 3 405.542 4.477 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)Nc1ccn(CC(F)(F)F)n1)c1ccc(Cl)cc1 ZINC000478027474 893155040 /nfs/dbraw/zinc/15/50/40/893155040.db2.gz QHZJVQNILUGXFU-HNNXBMFYSA-N 0 3 417.863 4.303 20 0 HIADHN CCCN(C(=O)c1cccc(N2CCCC2=O)c1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000505017127 913759498 /nfs/dbraw/zinc/75/94/98/913759498.db2.gz READIGCZBVRCTJ-XMMPIXPASA-N 0 3 419.569 4.330 20 0 HIADHN CC1CCN([C@H](CNC(=O)N[C@H]2CCO[C@H](C(C)(C)C)C2)c2cccs2)CC1 ZINC000478219858 893379519 /nfs/dbraw/zinc/37/95/19/893379519.db2.gz LKDJZZHQWRHHTE-NSHGMRRFSA-N 0 3 407.624 4.414 20 0 HIADHN Cc1c(Br)cccc1CC(=O)NC1CCN([C@@H](C)c2ccncc2)CC1 ZINC000478324073 893555648 /nfs/dbraw/zinc/55/56/48/893555648.db2.gz HHLJJSICOUJGCS-INIZCTEOSA-N 0 3 416.363 4.037 20 0 HIADHN Cc1c(Br)cccc1CC(=O)NC1CCN([C@H](C)c2ccncc2)CC1 ZINC000478324074 893555865 /nfs/dbraw/zinc/55/58/65/893555865.db2.gz HHLJJSICOUJGCS-MRXNPFEDSA-N 0 3 416.363 4.037 20 0 HIADHN CCCN(C(=O)CCc1nc(C(C)(C)C)no1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000505046084 913788409 /nfs/dbraw/zinc/78/84/09/913788409.db2.gz OGIQHBRZERURTH-FQEVSTJZSA-N 0 3 412.578 4.203 20 0 HIADHN O=S1(=O)CCCN1c1ccc(CN[C@@H](Cc2ccccc2)c2ccccc2)cc1F ZINC000478417143 893706025 /nfs/dbraw/zinc/70/60/25/893706025.db2.gz PSFYCGIGSWZBFB-QHCPKHFHSA-N 0 3 424.541 4.439 20 0 HIADHN CCCN(CCN(C)C)C(=O)c1cccnc1Oc1cccc(Br)c1 ZINC000478424973 893721250 /nfs/dbraw/zinc/72/12/50/893721250.db2.gz FVKZGVROMBHTTP-UHFFFAOYSA-N 0 3 406.324 4.050 20 0 HIADHN O=C(NCc1ncoc1-c1ccccc1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000478673081 893924975 /nfs/dbraw/zinc/92/49/75/893924975.db2.gz ZANHDKDWTSKNQW-UHFFFAOYSA-N 0 3 422.554 4.255 20 0 HIADHN Cc1nc(COc2ccc(F)cc2)sc1C(=O)NC[C@@H](C)N1CCCC[C@@H]1C ZINC000478700560 893961004 /nfs/dbraw/zinc/96/10/04/893961004.db2.gz KREUNOMWVRHGOE-LSDHHAIUSA-N 0 3 405.539 4.162 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)[C@H](C)Cn3ccc4ccccc43)c(C)c2)CC1 ZINC000505121874 913828570 /nfs/dbraw/zinc/82/85/70/913828570.db2.gz ZJHFOMLMKQFCRM-HXUWFJFHSA-N 0 3 404.558 4.366 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CC2(CCOCC2)c2ccccc21)c1ccsc1 ZINC000478754515 894029589 /nfs/dbraw/zinc/02/95/89/894029589.db2.gz HBTGBPPUAHUFCC-NRFANRHFSA-N 0 3 413.587 4.409 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)N[C@@H](C)c2ccc(OC(C)C)cc2)c1 ZINC000478760367 894036880 /nfs/dbraw/zinc/03/68/80/894036880.db2.gz BYULAXNDKYHZII-IBGZPJMESA-N 0 3 413.562 4.317 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)N[C@H](C)c2ccc(OC(C)C)cc2)c1 ZINC000478760369 894037503 /nfs/dbraw/zinc/03/75/03/894037503.db2.gz BYULAXNDKYHZII-LJQANCHMSA-N 0 3 413.562 4.317 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)N[C@H](C)c2ccc(OC(F)F)cc2)c1 ZINC000478766474 894042114 /nfs/dbraw/zinc/04/21/14/894042114.db2.gz DBTYBNCXPCDTQM-MRXNPFEDSA-N 0 3 421.488 4.131 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2cccc(OC(F)(F)F)c2)c1 ZINC000478783329 894059368 /nfs/dbraw/zinc/05/93/68/894059368.db2.gz CTTXAZGPTWFCPM-UHFFFAOYSA-N 0 3 411.424 4.190 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)c1ccccc1NCc1cccnc1 ZINC000478788140 894063570 /nfs/dbraw/zinc/06/35/70/894063570.db2.gz RGQMBKKXRMGUOD-OAQYLSRUSA-N 0 3 406.555 4.322 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2ccccc2OC(F)(F)F)c1 ZINC000478791663 894067572 /nfs/dbraw/zinc/06/75/72/894067572.db2.gz YQPLDJLCLDYNPJ-UHFFFAOYSA-N 0 3 411.424 4.190 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)N2CC3(CCOCC3)c3ccccc32)C1 ZINC000478793316 894068412 /nfs/dbraw/zinc/06/84/12/894068412.db2.gz IMOLWIMELVQWRL-FPOVZHCZSA-N 0 3 405.542 4.100 20 0 HIADHN CN(C)Cc1cccc(NC(=O)[C@H]2CC(=O)N(C)[C@H]2c2ccc(Cl)c(Cl)c2)c1 ZINC000478904029 894184910 /nfs/dbraw/zinc/18/49/10/894184910.db2.gz SNFSWGZZANYGDL-JXFKEZNVSA-N 0 3 420.340 4.213 20 0 HIADHN COC(=O)CCSc1cccc(NC(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)c1 ZINC000478965458 894242934 /nfs/dbraw/zinc/24/29/34/894242934.db2.gz QFDRFQOPEJVHBA-IERDGZPVSA-N 0 3 415.559 4.155 20 0 HIADHN C[C@H](NC(=O)Nc1cccc2c1CN(c1ccccn1)C2)[C@@H](c1ccccc1)N(C)C ZINC000479063005 894323645 /nfs/dbraw/zinc/32/36/45/894323645.db2.gz YYLVQGCCDQZHAU-UUOWRZLLSA-N 0 3 415.541 4.415 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)NCc2csc(Br)c2)N(C)C)cc1 ZINC000505173451 913862080 /nfs/dbraw/zinc/86/20/80/913862080.db2.gz PZRWASMBSMXCSS-MRXNPFEDSA-N 0 3 410.381 4.175 20 0 HIADHN CC[C@H](C)NC(=O)[C@@H]1C[C@H](C)N(CC(=O)Nc2ccc(C)cc2C)[C@H]2CCCC[C@H]12 ZINC000479107719 894373589 /nfs/dbraw/zinc/37/35/89/894373589.db2.gz SYKYJQVIBYHHIW-YDLBFBONSA-N 0 3 413.606 4.426 20 0 HIADHN CC[C@H](C)NC(=O)[C@@H]1C[C@H](C)N(CC(=O)Nc2ccc(C)cc2C)[C@H]2CCCC[C@@H]12 ZINC000479107717 894373843 /nfs/dbraw/zinc/37/38/43/894373843.db2.gz SYKYJQVIBYHHIW-XANJAXJYSA-N 0 3 413.606 4.426 20 0 HIADHN COC(=O)c1ccc([C@H](NC(=O)c2cccc(CN3CCCC3)c2)C(F)(F)F)cc1 ZINC000479121877 894391032 /nfs/dbraw/zinc/39/10/32/894391032.db2.gz QXDRDRKFQYDGJL-IBGZPJMESA-N 0 3 420.431 4.102 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)N[C@@H]1CCCc2c(O)cccc21 ZINC000479204537 894468298 /nfs/dbraw/zinc/46/82/98/894468298.db2.gz BLLZGEXBJTXZTC-HXUWFJFHSA-N 0 3 401.938 4.196 20 0 HIADHN C[C@@H]1CN(Cc2cccc(CN[C@@H]3CCCc4nn(-c5ccccc5)cc43)c2)CCO1 ZINC000479344124 894637776 /nfs/dbraw/zinc/63/77/76/894637776.db2.gz AWHJVMKLOMWVSE-CJFMBICVSA-N 0 3 416.569 4.260 20 0 HIADHN O=C1CCCN1Cc1cccc(CN[C@@H]2CCCc3nn(-c4ccccc4)cc32)c1 ZINC000479367418 894668131 /nfs/dbraw/zinc/66/81/31/894668131.db2.gz ZQWWDZDNIMNIJT-HSZRJFAPSA-N 0 3 400.526 4.162 20 0 HIADHN O=C(Nc1ccc2c(c1)CCC(=O)N2CC1CC1)c1cccc(CN2CCCC2)c1 ZINC000479370872 894671475 /nfs/dbraw/zinc/67/14/75/894671475.db2.gz LABZQRCKNGCWRA-UHFFFAOYSA-N 0 3 403.526 4.224 20 0 HIADHN Cc1cccc(C)c1CCN[C@@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479416649 894727106 /nfs/dbraw/zinc/72/71/06/894727106.db2.gz NTXRRWFTYILBBC-ZDUSSCGKSA-N 0 3 401.359 4.151 20 0 HIADHN OC[C@@H](CC(F)F)N[C@@H]1CCCc2c(Br)cc(Br)cc21 ZINC000479452203 894771478 /nfs/dbraw/zinc/77/14/78/894771478.db2.gz IJBHEBBARZBQND-NOZJJQNGSA-N 0 3 413.100 4.195 20 0 HIADHN CCS(=O)(=O)c1c(Cl)cccc1CNCC1(c2ccc(OC)cc2)CCC1 ZINC000479477027 894800135 /nfs/dbraw/zinc/80/01/35/894800135.db2.gz QTEOSTPITGOHOR-UHFFFAOYSA-N 0 3 407.963 4.354 20 0 HIADHN COc1ccc(-c2ccncc2)cc1CNCCOc1cccc(C(F)(F)F)n1 ZINC000479478213 894801638 /nfs/dbraw/zinc/80/16/38/894801638.db2.gz GYBHDPUKOSUDNG-UHFFFAOYSA-N 0 3 403.404 4.340 20 0 HIADHN CC1CCC(C)(CN[C@H]2CCS(=O)(=O)c3ccc(Br)cc32)CC1 ZINC000479477412 894802005 /nfs/dbraw/zinc/80/20/05/894802005.db2.gz CQZSGVUIIZXVRY-MNQCNDSGSA-N 0 3 400.382 4.474 20 0 HIADHN C[C@@H](NCC1(S(C)(=O)=O)CC1)c1ccc(-c2ccc(Br)cc2)s1 ZINC000479490486 894810855 /nfs/dbraw/zinc/81/08/55/894810855.db2.gz PSWAGTQQBPNZDL-GFCCVEGCSA-N 0 3 414.390 4.405 20 0 HIADHN Fc1cc(Br)cc([C@@H](NCc2ccc(-n3cncn3)cc2)C2CC2)c1 ZINC000479608954 894883659 /nfs/dbraw/zinc/88/36/59/894883659.db2.gz YDZWXVTXRWXBLT-IBGZPJMESA-N 0 3 401.283 4.410 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)NC[C@@H]2CCC[C@@H](C(F)(F)F)C2)c1 ZINC000479680177 894964839 /nfs/dbraw/zinc/96/48/39/894964839.db2.gz VUSNSIQYHSJBOQ-SJLPKXTDSA-N 0 3 415.500 4.137 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)N[C@@H](C)c2cccc(N3CCCC3)c2)c1 ZINC000479698153 894990270 /nfs/dbraw/zinc/99/02/70/894990270.db2.gz BUFBZYZFAMBLSG-FQEVSTJZSA-N 0 3 424.589 4.130 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)NC[C@H](c2ccccc2)C(F)(F)F)c1 ZINC000479739259 895039236 /nfs/dbraw/zinc/03/92/36/895039236.db2.gz DGIMFSLPXDZCKY-HXUWFJFHSA-N 0 3 423.479 4.115 20 0 HIADHN CC[C@@H](NC(=O)N[C@@H](CN(C)C)c1ccc(F)cc1)c1ccccc1OC(F)F ZINC000479760198 895059873 /nfs/dbraw/zinc/05/98/73/895059873.db2.gz QWUXOODKTCDKMG-MSOLQXFVSA-N 0 3 409.452 4.480 20 0 HIADHN C[C@@H](NC(=O)N[C@@H](C)c1ccc(NC(=O)C2CC2)cc1)[C@H](c1ccccc1)N(C)C ZINC000479760447 895061333 /nfs/dbraw/zinc/06/13/33/895061333.db2.gz SHSQWXZVHFRUNK-GSHUGGBRSA-N 0 3 408.546 4.087 20 0 HIADHN COc1cc(OC)c([C@H](C)NC[C@@H](c2cccs2)N2CCOCC2)cc1Cl ZINC000479849177 895182379 /nfs/dbraw/zinc/18/23/79/895182379.db2.gz HJMHCBQDLVAGBB-YOEHRIQHSA-N 0 3 410.967 4.143 20 0 HIADHN C[C@H](NCc1ccc(Cl)cc1)c1ccc(S(=O)(=O)NCc2ccco2)cc1 ZINC000479859586 895193464 /nfs/dbraw/zinc/19/34/64/895193464.db2.gz JORVJXKQVMBQTB-HNNXBMFYSA-N 0 3 404.919 4.262 20 0 HIADHN CCOC(=O)c1cc(NC[C@@H](c2ccccc2OC)N2CCCC2)ncc1Cl ZINC000479867338 895208714 /nfs/dbraw/zinc/20/87/14/895208714.db2.gz UVRJRZCDEYIOOA-SFHVURJKSA-N 0 3 403.910 4.169 20 0 HIADHN Cc1csc(-c2cccc(C(=O)NCc3ccccc3CN3CCC(O)CC3)c2)n1 ZINC000479977654 895331731 /nfs/dbraw/zinc/33/17/31/895331731.db2.gz DFJZAGLWFZVBKG-UHFFFAOYSA-N 0 3 421.566 4.005 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)c3cc4c(cc(Cl)cc4Cl)[nH]3)CC2)C[C@@H](C)O1 ZINC000480028066 895377003 /nfs/dbraw/zinc/37/70/03/895377003.db2.gz CSQJFCDQSXKYSP-ZIAGYGMSSA-N 0 3 424.372 4.436 20 0 HIADHN C[C@@H](NC(=O)Nc1cc(C(C)(C)C)nn1-c1ccccn1)[C@H](c1ccccc1)N(C)C ZINC000480044682 895394408 /nfs/dbraw/zinc/39/44/08/895394408.db2.gz JPNMOCLOJBXBIZ-VGOFRKELSA-N 0 3 420.561 4.378 20 0 HIADHN COc1ccc([C@@H](CN[C@@H](C)c2ccc(F)cc2OC(F)F)N2CCOCC2)cc1 ZINC000480082992 895440926 /nfs/dbraw/zinc/44/09/26/895440926.db2.gz FWVPXWZVGBSEKP-MGPUTAFESA-N 0 3 424.463 4.160 20 0 HIADHN COc1ccc([C@H](CN[C@H](C)c2nnn(-c3ccc(F)cc3)c2C)N2CCCC2)cc1 ZINC000480084466 895443241 /nfs/dbraw/zinc/44/32/41/895443241.db2.gz ROXOZFHQZHNZPX-HXOBKFHXSA-N 0 3 423.536 4.211 20 0 HIADHN CC[C@@H](c1ccccc1)[C@H]1CCCN1CC(=O)Nc1cc(OC)c(OC)c(OC)c1 ZINC000480103139 895470676 /nfs/dbraw/zinc/47/06/76/895470676.db2.gz LOOPJUVRZNETLH-VQTJNVASSA-N 0 3 412.530 4.309 20 0 HIADHN O=S1(=O)CC[C@H](N[C@H](Cc2ccccc2)C2CC2)c2cc(Br)ccc21 ZINC000480159220 895544254 /nfs/dbraw/zinc/54/42/54/895544254.db2.gz KYQBGRLDYQOYNR-RBUKOAKNSA-N 0 3 420.372 4.279 20 0 HIADHN C[C@H](CN[C@@H]1CCS(=O)(=O)c2ccc(Br)cc21)c1ccc(F)cc1 ZINC000480169548 895561143 /nfs/dbraw/zinc/56/11/43/895561143.db2.gz VKPPJQCETAJQQT-SJKOYZFVSA-N 0 3 412.324 4.200 20 0 HIADHN CC(C)[C@H](CN[C@@H]1CCS(=O)(=O)c2ccc(Br)cc21)c1cccnc1 ZINC000480173097 895564324 /nfs/dbraw/zinc/56/43/24/895564324.db2.gz VFRHFIPEMFZUPJ-ZWKOTPCHSA-N 0 3 423.376 4.092 20 0 HIADHN CC(C)(CN[C@H]1CCS(=O)(=O)c2ccc(Br)cc21)C1CCCC1 ZINC000480175207 895567595 /nfs/dbraw/zinc/56/75/95/895567595.db2.gz AZRJRSDIWNDFRQ-INIZCTEOSA-N 0 3 400.382 4.474 20 0 HIADHN Cc1cn2c(n1)[C@@H](CN[C@H](c1ccc(Br)cc1)c1cncnc1)CCC2 ZINC000480181406 895572898 /nfs/dbraw/zinc/57/28/98/895572898.db2.gz NWUVEQJSNRJDOK-VQIMIIECSA-N 0 3 412.335 4.001 20 0 HIADHN Cn1cc(CN2CCN(C(c3ccccc3)c3ccccc3)CC2)c(-c2ccncc2)n1 ZINC000505321420 913983129 /nfs/dbraw/zinc/98/31/29/913983129.db2.gz UOMCGNBBNRLDSG-UHFFFAOYSA-N 0 3 423.564 4.389 20 0 HIADHN O=S1(=O)CC[C@H](NCCc2ccccc2Cl)c2cc(Br)ccc21 ZINC000480218852 895623564 /nfs/dbraw/zinc/62/35/64/895623564.db2.gz DGBGSKZZXQLEHC-INIZCTEOSA-N 0 3 414.752 4.153 20 0 HIADHN CC[C@@H](N[C@@H](CN1CCCC1)c1ccccc1)c1ccccc1OCC(=O)N(C)C ZINC000480233233 895638887 /nfs/dbraw/zinc/63/88/87/895638887.db2.gz UQKDSYUDOWLJAZ-PKTZIBPZSA-N 0 3 409.574 4.031 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1cc(C(C)(C)C)nn1-c1ccccn1)c1ccco1 ZINC000480237340 895646661 /nfs/dbraw/zinc/64/66/61/895646661.db2.gz PTUUIJWBXQVKGI-IRXDYDNUSA-N 0 3 424.549 4.409 20 0 HIADHN CCOCc1ccccc1CN[C@H](C)c1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000480257161 895666085 /nfs/dbraw/zinc/66/60/85/895666085.db2.gz ZAXFPFAXQGHSGA-LJQANCHMSA-N 0 3 416.587 4.249 20 0 HIADHN CC(C)[C@@H]1CCC[C@@H](N[C@@H]2CCS(=O)(=O)c3ccc(Br)cc32)C1 ZINC000480256394 895666761 /nfs/dbraw/zinc/66/67/61/895666761.db2.gz AQUXUDOEGRGBBT-FRFSOERESA-N 0 3 400.382 4.472 20 0 HIADHN CC(C)(CN[C@H]1CCS(=O)(=O)c2ccc(Br)cc21)c1ccccc1 ZINC000480267014 895675818 /nfs/dbraw/zinc/67/58/18/895675818.db2.gz QKDBZTZKMAVBKK-KRWDZBQOSA-N 0 3 408.361 4.235 20 0 HIADHN CCN1CC[C@H](NCc2ccc(Br)o2)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000480304358 895708540 /nfs/dbraw/zinc/70/85/40/895708540.db2.gz ACKNIXODJAZQMV-YOEHRIQHSA-N 0 3 403.242 4.385 20 0 HIADHN NC(=O)[C@@H](CNCc1cc(Br)c(Cl)s1)Cc1ccccc1Cl ZINC000480305423 895708848 /nfs/dbraw/zinc/70/88/48/895708848.db2.gz FRGHGMBHRULCLL-SNVBAGLBSA-N 0 3 422.175 4.251 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)N(CC)Cc2ccc(OC)cc2OC)N(C)C)cc1 ZINC000480320816 895722741 /nfs/dbraw/zinc/72/27/41/895722741.db2.gz SQJFNEKGORGAHX-JOCHJYFZSA-N 0 3 413.562 4.101 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@H](C)NCc2ccc(Br)o2)CC1 ZINC000480384137 895790175 /nfs/dbraw/zinc/79/01/75/895790175.db2.gz NFYZDWRPZYPOAI-AWEZNQCLSA-N 0 3 410.331 4.174 20 0 HIADHN Cc1cc(Br)cc(Cl)c1C(=O)NC[C@H](Cc1ccccc1)N(C)C ZINC000480394325 895799472 /nfs/dbraw/zinc/79/94/72/895799472.db2.gz JVFBKHJZQDMBNN-INIZCTEOSA-N 0 3 409.755 4.314 20 0 HIADHN CC(C)c1cccc(C(C)C)c1NC(=O)N1CC[C@H](N2CCN(C)CC2)[C@@H](C)C1 ZINC000480403907 895806693 /nfs/dbraw/zinc/80/66/93/895806693.db2.gz JVDGVLCZDAUTQH-UGKGYDQZSA-N 0 3 400.611 4.423 20 0 HIADHN C[C@H](NCc1ccccc1Cn1cccn1)c1ccc(S(=O)(=O)C2CCCC2)cc1 ZINC000480416414 895813837 /nfs/dbraw/zinc/81/38/37/895813837.db2.gz ZQYXUGQUHNHIEN-IBGZPJMESA-N 0 3 423.582 4.499 20 0 HIADHN COc1ccc([C@@H](C)N[C@@H](CN2CCOCC2)c2ccccc2)cc1Br ZINC000480437665 895829571 /nfs/dbraw/zinc/82/95/71/895829571.db2.gz PGONZOQDTPERSP-UZLBHIALSA-N 0 3 419.363 4.182 20 0 HIADHN COC(=O)c1csc(-c2cccc(CNCc3ccc(OC(F)F)cc3)c2)n1 ZINC000480477952 895856804 /nfs/dbraw/zinc/85/68/04/895856804.db2.gz MNJDOAUQRDOAOJ-UHFFFAOYSA-N 0 3 404.438 4.488 20 0 HIADHN C[C@@H](NCc1ccc(N2CCCC2)nc1)c1ccc(I)cc1 ZINC000480541289 895903792 /nfs/dbraw/zinc/90/37/92/895903792.db2.gz PFYFCAIASIDBHG-CQSZACIVSA-N 0 3 407.299 4.137 20 0 HIADHN C[C@@H](NC1CCN(c2ccccn2)CC1)c1ccccc1I ZINC000480608657 895973077 /nfs/dbraw/zinc/97/30/77/895973077.db2.gz KNQLURBQVBMQIE-CQSZACIVSA-N 0 3 407.299 4.006 20 0 HIADHN C[C@@H]1CN(c2ccc(CN[C@H]3CCc4ccc(OC(F)(F)F)cc43)cn2)C[C@@H](C)O1 ZINC000480622666 895991652 /nfs/dbraw/zinc/99/16/52/895991652.db2.gz VXHRBWAMNCXNGJ-SXGZJXTBSA-N 0 3 421.463 4.371 20 0 HIADHN C[C@H](NCc1ccc(N2C[C@@H](C)O[C@@H](C)C2)nc1)c1cccc(OC(F)(F)F)c1 ZINC000480623898 895992673 /nfs/dbraw/zinc/99/26/73/895992673.db2.gz XRWPTRVUBZAUPX-XHSDSOJGSA-N 0 3 409.452 4.445 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)N1CCC[C@H]1c1ccc2c(c1)OCO2 ZINC000480652831 896021206 /nfs/dbraw/zinc/02/12/06/896021206.db2.gz XPPOEBRGFIWQQS-LEWJYISDSA-N 0 3 407.514 4.099 20 0 HIADHN C[C@@H](NCCc1nn(C)c2ccccc12)c1ccccc1I ZINC000480665761 896031613 /nfs/dbraw/zinc/03/16/13/896031613.db2.gz QVZUYIQMYVTUDR-CYBMUJFWSA-N 0 3 405.283 4.071 20 0 HIADHN Cn1cc([C@H](NC2CCC3(CC2)C(=O)Nc2ccccc23)c2ccc(F)cc2)cn1 ZINC000480678500 896041563 /nfs/dbraw/zinc/04/15/63/896041563.db2.gz HQFWCVXTNJFKKB-HWDGFJGFSA-N 0 3 404.489 4.071 20 0 HIADHN CCSc1ccccc1[C@@H](C)NCc1ccc(N2CCCS2(=O)=O)c(F)c1 ZINC000480700357 896062027 /nfs/dbraw/zinc/06/20/27/896062027.db2.gz RRSXDBFLQNJNPC-OAHLLOKOSA-N 0 3 408.564 4.328 20 0 HIADHN C[C@@H](NCc1cccc(N2CCOCC2)n1)[C@@H](C)Oc1ccc(Cl)cc1Cl ZINC000480704126 896067839 /nfs/dbraw/zinc/06/78/39/896067839.db2.gz COJANORULODTMA-HUUCEWRRSA-N 0 3 410.345 4.171 20 0 HIADHN C[C@@H](NCc1ccnc(N2CCN(C)CC2)c1)c1ccc(OCc2ccccc2)cc1 ZINC000480717770 896078418 /nfs/dbraw/zinc/07/84/18/896078418.db2.gz MYYSIKOMBPBABG-OAQYLSRUSA-N 0 3 416.569 4.263 20 0 HIADHN COCCOc1ccc([C@@H](C)N[C@H](C)c2ccc3c(c2)C(C)(C)C(=O)N3)cc1OC ZINC000480719111 896079847 /nfs/dbraw/zinc/07/98/47/896079847.db2.gz PGURKSXQDGHLJX-HZPDHXFCSA-N 0 3 412.530 4.362 20 0 HIADHN Cc1nc(-c2cc([C@H](C)NCc3ccnc(N4CCN(C)CC4)c3)cs2)cs1 ZINC000480734350 896095049 /nfs/dbraw/zinc/09/50/49/896095049.db2.gz VVZVETHKCVWANP-HNNXBMFYSA-N 0 3 413.616 4.178 20 0 HIADHN Cc1nc(Cc2ccccc2)sc1[C@@H](C)NCc1ccnc(N2CCN(C)CC2)c1 ZINC000480736041 896097794 /nfs/dbraw/zinc/09/77/94/896097794.db2.gz TYLPOCNPAVKGKY-GOSISDBHSA-N 0 3 421.614 4.040 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)c1ccc(CCC(F)(F)F)cc1 ZINC000505371926 914034956 /nfs/dbraw/zinc/03/49/56/914034956.db2.gz YETPFZVEFLXDSA-UHFFFAOYSA-N 0 3 420.475 4.068 20 0 HIADHN COCCOc1ccc(CN[C@H]2CCCOc3c(Br)cccc32)cc1 ZINC000480752925 896115503 /nfs/dbraw/zinc/11/55/03/896115503.db2.gz ZRSHIZDGAZOHPW-IBGZPJMESA-N 0 3 406.320 4.478 20 0 HIADHN CNS(=O)(=O)c1ccc([C@H](C)NCc2ccc(COCc3ccccc3)cc2)cc1 ZINC000480752071 896116104 /nfs/dbraw/zinc/11/61/04/896116104.db2.gz WWQFNWZTEAQLMG-IBGZPJMESA-N 0 3 424.566 4.162 20 0 HIADHN Cc1ccc(CN2CCC(C(=O)Nc3ccccc3Br)CC2)c(C)n1 ZINC000480760564 896122393 /nfs/dbraw/zinc/12/23/93/896122393.db2.gz QSJNETNDZFLNKP-UHFFFAOYSA-N 0 3 402.336 4.312 20 0 HIADHN C[C@@H](N[C@H]1CCCc2c1cnn2C)c1cccc(OCc2cn3ccccc3n2)c1 ZINC000480766444 896129227 /nfs/dbraw/zinc/12/92/27/896129227.db2.gz FMVZSJIFWVJIHA-VGSWGCGISA-N 0 3 401.514 4.375 20 0 HIADHN COc1cc(CN[C@H]2CCSc3ccc(Br)cc32)ccc1OCCO ZINC000480879244 896236541 /nfs/dbraw/zinc/23/65/41/896236541.db2.gz KYAXDTZEVUHWOT-INIZCTEOSA-N 0 3 424.360 4.156 20 0 HIADHN CC(C)Cc1ccc([C@H](C)NCc2cccc(NC(=O)CCN3CCOCC3)c2)cc1 ZINC000480893546 896250997 /nfs/dbraw/zinc/25/09/97/896250997.db2.gz CMICVRNEPWIOKD-NRFANRHFSA-N 0 3 423.601 4.397 20 0 HIADHN C[C@H](NCCCS(=O)(=O)Cc1ccccc1)c1ccc(F)c(Br)c1 ZINC000480900203 896255492 /nfs/dbraw/zinc/25/54/92/896255492.db2.gz MZFIEPGIMWKOBB-AWEZNQCLSA-N 0 3 414.340 4.244 20 0 HIADHN C[C@H]1C[C@H](NCCNC(=O)c2ccc(Br)cc2)c2ccsc2S1 ZINC000480908034 896264284 /nfs/dbraw/zinc/26/42/84/896264284.db2.gz JYEMQJLRCYXNMU-NHYWBVRUSA-N 0 3 411.390 4.456 20 0 HIADHN CC(C)NC(=O)Nc1ccc(CN[C@@H](C)c2ccc(NC(=O)NC3CC3)cc2)cc1 ZINC000480915735 896274647 /nfs/dbraw/zinc/27/46/47/896274647.db2.gz TYFMSFBRGIOYJM-INIZCTEOSA-N 0 3 409.534 4.351 20 0 HIADHN COc1cccc([C@H](C)N[C@@H](C)c2ccc(S(=O)(=O)NCc3ccco3)cc2)c1 ZINC000480917100 896276269 /nfs/dbraw/zinc/27/62/69/896276269.db2.gz XOOFGSUGZZLFNB-IRXDYDNUSA-N 0 3 414.527 4.179 20 0 HIADHN CNS(=O)(=O)c1ccc([C@H](C)NCc2cccc(COc3ccccc3)c2)cc1 ZINC000480918380 896277144 /nfs/dbraw/zinc/27/71/44/896277144.db2.gz APWMYJFYFBPWCD-SFHVURJKSA-N 0 3 410.539 4.025 20 0 HIADHN O=C(NCCN[C@@H]1CCSc2ccc(F)cc21)c1ccc(Br)cc1 ZINC000480920350 896278682 /nfs/dbraw/zinc/27/86/82/896278682.db2.gz KZAUYXCWWWPUIV-MRXNPFEDSA-N 0 3 409.324 4.145 20 0 HIADHN COc1ccc([C@@H](C)NCc2cccc(S(=O)(=O)NC(C)C)c2)c2ccccc12 ZINC000481041959 896367259 /nfs/dbraw/zinc/36/72/59/896367259.db2.gz BNJMNPNHGYBYGX-QGZVFWFLSA-N 0 3 412.555 4.386 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)NCc1csc(Br)c1)c1ccco1 ZINC000481092816 896415059 /nfs/dbraw/zinc/41/50/59/896415059.db2.gz NISLSNZVVCNJKD-DGCLKSJQSA-N 0 3 400.342 4.032 20 0 HIADHN COC(=O)[C@H]1CC12CCN(Cc1cc(-c3c(OC)ccc4ccccc43)no1)CC2 ZINC000481149055 896477698 /nfs/dbraw/zinc/47/76/98/896477698.db2.gz YACOSNPKHMEIDI-LJQANCHMSA-N 0 3 406.482 4.279 20 0 HIADHN Cc1cccc2c1CC[C@H]2NCc1cccc(S(=O)(=O)NCc2cccc(F)c2)c1 ZINC000481181325 896522414 /nfs/dbraw/zinc/52/24/14/896522414.db2.gz VRDKYZWITPDROT-XMMPIXPASA-N 0 3 424.541 4.390 20 0 HIADHN CNS(=O)(=O)c1ccc([C@@H](C)N[C@@H](C)c2ccc(SCC(F)F)cc2)cc1 ZINC000481182916 896528252 /nfs/dbraw/zinc/52/82/52/896528252.db2.gz QNLBYPKKDCCEPG-UONOGXRCSA-N 0 3 414.543 4.364 20 0 HIADHN COc1cc([C@H](C)N[C@@H](C)c2ccc(Br)s2)ccc1OCCO ZINC000481191281 896543425 /nfs/dbraw/zinc/54/34/25/896543425.db2.gz QMDPYUZHYHNTFO-RYUDHWBXSA-N 0 3 400.338 4.302 20 0 HIADHN O=C(NC[C@H]1CCO[C@@H]1c1ccccc1)NC[C@@H]1CCCCN1Cc1ccccc1 ZINC000481216721 896570232 /nfs/dbraw/zinc/57/02/32/896570232.db2.gz YYNXTVHCMOSBNS-TZRRMPRUSA-N 0 3 407.558 4.118 20 0 HIADHN C[C@H](NCc1cccnc1N1CCN(C)CC1)c1cccc(OCc2ccccc2)c1 ZINC000481239701 896590777 /nfs/dbraw/zinc/59/07/77/896590777.db2.gz GJAJYTSKZMOOSL-NRFANRHFSA-N 0 3 416.569 4.263 20 0 HIADHN CN1CCN(c2ncccc2CN[C@H]2CCCc3nc(-c4ccccc4)sc32)CC1 ZINC000481265736 896614727 /nfs/dbraw/zinc/61/47/27/896614727.db2.gz WOCNMTJYNQIEIJ-FQEVSTJZSA-N 0 3 419.598 4.124 20 0 HIADHN CCOc1ccc([C@@H](C)NCc2ccc(S(=O)(=O)N3CCC[C@H](C)C3)cc2)cc1 ZINC000481302785 896649146 /nfs/dbraw/zinc/64/91/46/896649146.db2.gz DWQXRAJQYJGACM-RBUKOAKNSA-N 0 3 416.587 4.357 20 0 HIADHN CCOc1ccc([C@@H](C)NCc2ccc(S(=O)(=O)N3CCC[C@@H](C)C3)cc2)cc1 ZINC000481302786 896649261 /nfs/dbraw/zinc/64/92/61/896649261.db2.gz DWQXRAJQYJGACM-RTBURBONSA-N 0 3 416.587 4.357 20 0 HIADHN C[C@@H](N[C@H]1CC2(CCC2)Oc2ccccc21)c1ccc(OCC(=O)NC2CC2)cc1 ZINC000481309961 896656879 /nfs/dbraw/zinc/65/68/79/896656879.db2.gz SLRGIDZHSUEHOK-VGSWGCGISA-N 0 3 406.526 4.441 20 0 HIADHN C[C@@H](NCc1ccc(Oc2ccc(F)cc2)nc1)c1ccc(NS(C)(=O)=O)cc1 ZINC000481314811 896664000 /nfs/dbraw/zinc/66/40/00/896664000.db2.gz CGCOORFMDCSZQI-OAHLLOKOSA-N 0 3 415.490 4.235 20 0 HIADHN CC[C@@H](N[C@@H](C)c1ccc(-n2cccn2)cc1)c1ccccc1OCC(=O)N(C)C ZINC000481318328 896669759 /nfs/dbraw/zinc/66/97/59/896669759.db2.gz KDUPAXBXYIICFX-PGRDOPGGSA-N 0 3 406.530 4.141 20 0 HIADHN CC[C@H](NCc1cccc(OCC(=O)N(C)C)c1)c1cccc(Br)c1 ZINC000481323387 896678269 /nfs/dbraw/zinc/67/82/69/896678269.db2.gz VDBUIOFLWIXVPX-IBGZPJMESA-N 0 3 405.336 4.157 20 0 HIADHN CCS(=O)(=O)Nc1ccc([C@H](C)NCc2cc(Br)cs2)cc1 ZINC000481323933 896681225 /nfs/dbraw/zinc/68/12/25/896681225.db2.gz QBOBVGBLMYJCPT-NSHDSACASA-N 0 3 403.367 4.123 20 0 HIADHN CCOc1cc(CN[C@H](C)c2cccc(N3CCOCC3)c2)ccc1OC(F)F ZINC000481325137 896681453 /nfs/dbraw/zinc/68/14/53/896681453.db2.gz TXYRCCYZDCTZNT-MRXNPFEDSA-N 0 3 406.473 4.374 20 0 HIADHN CC[C@@H](N[C@@H](C)c1ccc2c(c1)OCO2)c1ccccc1OCC(=O)N1CCCC1 ZINC000481327591 896685514 /nfs/dbraw/zinc/68/55/14/896685514.db2.gz JWCHEFYJBYTBLA-FXAWDEMLSA-N 0 3 410.514 4.218 20 0 HIADHN COc1cc(C)c([C@@H](C)N[C@H](C)c2ccc(OCC(=O)NC3CC3)cc2)cc1OC ZINC000481327747 896685850 /nfs/dbraw/zinc/68/58/50/896685850.db2.gz MBHRCYRYIXZIOX-IAGOWNOFSA-N 0 3 412.530 4.081 20 0 HIADHN CN(CC(=O)Nc1ccccc1Cl)C(=O)CN[C@H](CC1CCC1)c1ccccc1 ZINC000481328527 896686562 /nfs/dbraw/zinc/68/65/62/896686562.db2.gz CVEDXFSOPVNMKA-OAQYLSRUSA-N 0 3 413.949 4.258 20 0 HIADHN CC[C@@H](N[C@H](C)c1ccc2c(c1)C(C)(C)C(=O)N2)c1ccccc1OCC(=O)N(C)C ZINC000481339733 896705601 /nfs/dbraw/zinc/70/56/01/896705601.db2.gz RFUSDUUWDBWMAR-OXQOHEQNSA-N 0 3 423.557 4.185 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)N[C@H](C1CCCC1)C(F)(F)F ZINC000481350382 896722554 /nfs/dbraw/zinc/72/25/54/896722554.db2.gz UFUSUCPUZGZMTQ-QGZVFWFLSA-N 0 3 407.427 4.159 20 0 HIADHN C[C@@H](NCc1cccc(OCCN2CCOCC2)c1)c1cccc(C(F)(F)F)c1 ZINC000481409859 896815009 /nfs/dbraw/zinc/81/50/09/896815009.db2.gz BMRKSOYITASASD-QGZVFWFLSA-N 0 3 408.464 4.267 20 0 HIADHN Clc1cccc2c1OCCC[C@H]2NCc1cccc(OCCN2CCOCC2)c1 ZINC000481412710 896816919 /nfs/dbraw/zinc/81/69/19/896816919.db2.gz JZXADDVFVAUYEP-JOCHJYFZSA-N 0 3 416.949 4.055 20 0 HIADHN C[C@H](NCc1cccc(OCCN2CCOCC2)c1)c1cccc(OC(F)(F)F)c1 ZINC000481423712 896826830 /nfs/dbraw/zinc/82/68/30/896826830.db2.gz WDHVJTRUUKRLDB-KRWDZBQOSA-N 0 3 424.463 4.147 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1cnn(-c2ccc(Cl)cc2)c1)c1ccco1 ZINC000481431098 896831966 /nfs/dbraw/zinc/83/19/66/896831966.db2.gz ZWMHJGZUOGDZFQ-KBXCAEBGSA-N 0 3 401.898 4.370 20 0 HIADHN Cc1nccn1-c1ccc(CN[C@H](C)c2ccc(OCc3nccn3C)cc2)cc1F ZINC000481560036 896933779 /nfs/dbraw/zinc/93/37/79/896933779.db2.gz VERROTOCSAOYJA-QGZVFWFLSA-N 0 3 419.504 4.483 20 0 HIADHN O[C@@H](CN[C@H]1CCSc2ccc(F)cc21)COc1ccc(C(F)(F)F)cc1 ZINC000481565781 896944147 /nfs/dbraw/zinc/94/41/47/896944147.db2.gz QXUUBHANSCWGAC-YOEHRIQHSA-N 0 3 401.425 4.411 20 0 HIADHN Cc1cc(NC(=O)CCCc2nc3ccccc3[nH]2)cc(N2CCN(C(C)C)CC2)c1 ZINC000481663589 897047201 /nfs/dbraw/zinc/04/72/01/897047201.db2.gz BIBZWFUXVUWUQN-UHFFFAOYSA-N 0 3 419.573 4.363 20 0 HIADHN COc1ccc(SCC(=O)Nc2cc(C)cc(N3CCN(C(C)C)CC3)c2)cc1 ZINC000481664630 897048281 /nfs/dbraw/zinc/04/82/81/897048281.db2.gz GZFQGSYYMZSQIJ-UHFFFAOYSA-N 0 3 413.587 4.265 20 0 HIADHN CC[C@@H](NCCOC1CCCCCC1)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000481677030 897060213 /nfs/dbraw/zinc/06/02/13/897060213.db2.gz JZWKQSSXKKXKLQ-GOSISDBHSA-N 0 3 402.988 4.028 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)Nc1ccc2c(c1)CCC(=O)N2CC1CC1)c1ccco1 ZINC000481717004 897110347 /nfs/dbraw/zinc/11/03/47/897110347.db2.gz UWPOTKSSSUTFMO-UZLBHIALSA-N 0 3 424.545 4.220 20 0 HIADHN CC(C)C[C@@H]1OCCC[C@H]1NCC(=O)N1N=C(c2ccco2)C[C@@H]1c1cccs1 ZINC000481725056 897119788 /nfs/dbraw/zinc/11/97/88/897119788.db2.gz NSVSMTMVRNKUAZ-POAQFYNOSA-N 0 3 415.559 4.202 20 0 HIADHN COc1ccc([C@@H](C)N[C@@H](C)c2ccc(S(=O)(=O)N3CCCCC3)cc2)cc1 ZINC000481734603 897129320 /nfs/dbraw/zinc/12/93/20/897129320.db2.gz KMHKIKLQHOAAMT-MSOLQXFVSA-N 0 3 402.560 4.282 20 0 HIADHN C[C@@H](N[C@H]1CCCc2cc(OC(F)F)ccc21)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000481736350 897131183 /nfs/dbraw/zinc/13/11/83/897131183.db2.gz NLBLFCUTYBZVCW-VLIAUNLRSA-N 0 3 424.513 4.267 20 0 HIADHN NC(=O)[C@@H](Cc1ccc(C(F)(F)F)cc1)NC1CC(F)(c2cccc(Cl)c2)C1 ZINC000481750606 897142148 /nfs/dbraw/zinc/14/21/48/897142148.db2.gz ZIRKINJLYGTOJZ-TVRKMHQQSA-N 0 3 414.830 4.372 20 0 HIADHN Cc1cc2[nH]c(CN3CCC(C(=O)Nc4ccc5c(c4)OCO5)CC3)cc2c(C)c1 ZINC000481910487 897292415 /nfs/dbraw/zinc/29/24/15/897292415.db2.gz NHPICUMFJLUSGP-UHFFFAOYSA-N 0 3 405.498 4.364 20 0 HIADHN COC(=O)c1ccc(-c2ccc(CN3CCC(C(=O)N4CCC[C@@H](C)C4)CC3)o2)cc1 ZINC000481913892 897297869 /nfs/dbraw/zinc/29/78/69/897297869.db2.gz IFDNQENEWNYAKS-GOSISDBHSA-N 0 3 424.541 4.204 20 0 HIADHN COc1ccc(-c2ccncc2)cc1CN1CCC(C(=O)Nc2ccccc2O)CC1 ZINC000481919126 897302291 /nfs/dbraw/zinc/30/22/91/897302291.db2.gz IEUAOTJTKSLVKY-UHFFFAOYSA-N 0 3 417.509 4.314 20 0 HIADHN COc1ccc(-c2ccncc2)cc1CN1CCc2cc(OC)c(OC)cc2CC1 ZINC000481983894 897379426 /nfs/dbraw/zinc/37/94/26/897379426.db2.gz MCVRUSFKFOMSFT-UHFFFAOYSA-N 0 3 404.510 4.375 20 0 HIADHN CC[C@H](NCc1ccc2ncccc2c1)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000481987587 897383117 /nfs/dbraw/zinc/38/31/17/897383117.db2.gz CNFGWEINWCRLEV-SFHVURJKSA-N 0 3 403.935 4.037 20 0 HIADHN CCO[C@@H](CN[C@H](CC)c1ccc(Cl)c(S(=O)(=O)NC)c1)c1ccccc1 ZINC000481989358 897384003 /nfs/dbraw/zinc/38/40/03/897384003.db2.gz ALDMFVIRVJOISO-MOPGFXCFSA-N 0 3 410.967 4.067 20 0 HIADHN CCO[C@@H](CN[C@@H](CC)c1ccc(Cl)c(S(=O)(=O)NC)c1)c1ccccc1 ZINC000481989359 897384474 /nfs/dbraw/zinc/38/44/74/897384474.db2.gz ALDMFVIRVJOISO-OALUTQOASA-N 0 3 410.967 4.067 20 0 HIADHN COC(=O)c1ccc(-c2ccc(CN3CCC(OC[C@H]4CCCCO4)CC3)o2)cc1 ZINC000481991690 897387930 /nfs/dbraw/zinc/38/79/30/897387930.db2.gz PFJQSLNVFSURNU-JOCHJYFZSA-N 0 3 413.514 4.283 20 0 HIADHN Cc1cc(NC(=O)c2ccc(-c3ccco3)[nH]c2=O)cc(N2CCN(C(C)C)CC2)c1 ZINC000482031001 897441517 /nfs/dbraw/zinc/44/15/17/897441517.db2.gz VUPNLLXRRWOYBN-UHFFFAOYSA-N 0 3 420.513 4.138 20 0 HIADHN C[C@H](C(=O)NCCCCN1CCN(c2ccccc2)CC1)c1cc2ccccc2o1 ZINC000482056104 897483205 /nfs/dbraw/zinc/48/32/05/897483205.db2.gz RKPAIHXNWQKCIA-FQEVSTJZSA-N 0 3 405.542 4.255 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)NC[C@H]1CCO[C@@H]1c1ccccc1 ZINC000482081904 897521269 /nfs/dbraw/zinc/52/12/69/897521269.db2.gz OCBWQIWKNGDHDW-TUACAJSNSA-N 0 3 407.558 4.070 20 0 HIADHN CCS(=O)(=O)Nc1ccc([C@H](C)NCc2ccnc(OC3CCCCC3)c2)cc1 ZINC000482121741 897575946 /nfs/dbraw/zinc/57/59/46/897575946.db2.gz LPVIRUTVFGYNIJ-KRWDZBQOSA-N 0 3 417.575 4.406 20 0 HIADHN CCC[C@H](N[C@@H](C)c1cc(OC)c(OC)cc1C)C(=O)N1CCc2sccc2C1 ZINC000482237476 897718125 /nfs/dbraw/zinc/71/81/25/897718125.db2.gz DLOWVLACFNEAAZ-LPHOPBHVSA-N 0 3 416.587 4.478 20 0 HIADHN CC[C@@H](N[C@H](C)c1cccc(S(=O)(=O)NC)c1)c1cccc(Br)c1 ZINC000482249767 897731259 /nfs/dbraw/zinc/73/12/59/897731259.db2.gz ZZIPJDSZGLHFIP-FZKQIMNGSA-N 0 3 411.365 4.159 20 0 HIADHN CCc1ccc(Cl)c(CC)c1NC(=O)CCCN(C)Cc1cnc(N(C)C)nc1 ZINC000505503012 914191917 /nfs/dbraw/zinc/19/19/17/914191917.db2.gz JWQYTYOMZPQTGR-UHFFFAOYSA-N 0 3 417.985 4.172 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)N[C@@H](c1ccc(Cl)cc1)C(F)(F)F ZINC000482327365 897829510 /nfs/dbraw/zinc/82/95/10/897829510.db2.gz PFWSTONKYBSDCP-KRWDZBQOSA-N 0 3 414.859 4.112 20 0 HIADHN C[C@H](NC(=O)N[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)C1=CCN(C)CC1 ZINC000482355090 897870568 /nfs/dbraw/zinc/87/05/68/897870568.db2.gz UBZUTBQYFFMEMJ-NHYWBVRUSA-N 0 3 409.374 4.258 20 0 HIADHN CN(C)C[C@@H](NC(=O)Nc1cc(F)cc(F)c1Br)c1ccc(F)cc1 ZINC000482396755 897932642 /nfs/dbraw/zinc/93/26/42/897932642.db2.gz SBWUWVDSCQBVPY-OAHLLOKOSA-N 0 3 416.241 4.291 20 0 HIADHN Cc1cccc(NC(=O)[C@@H]2CCCN(Cc3ccc(OCC(F)(F)F)cc3)C2)n1 ZINC000505519220 914210509 /nfs/dbraw/zinc/21/05/09/914210509.db2.gz IXVOQOWUFPSPEF-QGZVFWFLSA-N 0 3 407.436 4.182 20 0 HIADHN C[C@H](C1CC1)n1nccc1NC(=O)N(CCN(C)C)Cc1ccc(C(F)(F)F)cc1 ZINC000482442370 898003364 /nfs/dbraw/zinc/00/33/64/898003364.db2.gz WXTJMCDSLQGPFC-OAHLLOKOSA-N 0 3 423.483 4.469 20 0 HIADHN COC(=O)c1cccc(CNC2(c3cccc(OC(F)(F)F)c3)CCOCC2)c1 ZINC000482446185 898011063 /nfs/dbraw/zinc/01/10/63/898011063.db2.gz CGZVJNOFWXTIQA-UHFFFAOYSA-N 0 3 409.404 4.167 20 0 HIADHN CCO[C@@H]1C[C@H](NCc2ccccc2OCc2cccnc2)[C@@H]1Oc1ccccc1 ZINC000482495497 898075320 /nfs/dbraw/zinc/07/53/20/898075320.db2.gz OUAMJDSQIPUWCH-CAOCKLPOSA-N 0 3 404.510 4.375 20 0 HIADHN CC(C)c1nn(-c2ccc(Br)cc2)cc1CNCCC(=O)NC(C)(C)C ZINC000482543947 898133341 /nfs/dbraw/zinc/13/33/41/898133341.db2.gz NPTKTHQLMMQPKY-UHFFFAOYSA-N 0 3 421.383 4.153 20 0 HIADHN COc1cc(F)c([C@H](C)N[C@H](C)c2cc(F)ccc2N2CCN(C)CC2)cc1OC ZINC000482558439 898150705 /nfs/dbraw/zinc/15/07/05/898150705.db2.gz SVXAZGXSORINRS-JKSUJKDBSA-N 0 3 419.516 4.146 20 0 HIADHN Cc1cc(NC(=O)c2ccc(N(C)C)cc2F)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000505530836 914225588 /nfs/dbraw/zinc/22/55/88/914225588.db2.gz VSJSXWCAAUNISG-HXUWFJFHSA-N 0 3 421.520 4.096 20 0 HIADHN CC[C@H](NCc1nc2ccc(Cl)cc2n1C)[C@H](c1ccc(C)cc1)n1cncn1 ZINC000482582503 898179041 /nfs/dbraw/zinc/17/90/41/898179041.db2.gz RTMBLKFTYONIPR-AVRDEDQJSA-N 0 3 408.937 4.284 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)[C@@H](C)NC(=O)c1cccc(Cl)c1Cl ZINC000482589963 898189335 /nfs/dbraw/zinc/18/93/35/898189335.db2.gz BJOFFTJEPSDCPA-CYBMUJFWSA-N 0 3 408.329 4.120 20 0 HIADHN Cc1ncsc1-c1nc2ccccc2n1CC(=O)Nc1cc(CN(C)C)ccc1C ZINC000482615789 898216240 /nfs/dbraw/zinc/21/62/40/898216240.db2.gz JJJXNEVGOWOTNO-UHFFFAOYSA-N 0 3 419.554 4.477 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)COc1ccc(C(=O)c2ccccc2)cc1 ZINC000482625054 898228230 /nfs/dbraw/zinc/22/82/30/898228230.db2.gz BONSPARYGOTCIC-UHFFFAOYSA-N 0 3 402.494 4.305 20 0 HIADHN C[C@@H](NC(=O)N[C@@H](C)c1ccc(NC(=O)NC2CC2)cc1)[C@H](c1ccccc1)N(C)C ZINC000482637167 898240950 /nfs/dbraw/zinc/24/09/50/898240950.db2.gz JYXZYVFHNXTEED-GSHUGGBRSA-N 0 3 423.561 4.022 20 0 HIADHN CCCN(CCC)C(=O)c1cccc(C(=O)NCCCN2CCc3ccccc3C2)c1 ZINC000482704665 898303374 /nfs/dbraw/zinc/30/33/74/898303374.db2.gz JMXPWPKWJCUXQX-UHFFFAOYSA-N 0 3 421.585 4.127 20 0 HIADHN CCc1c(NC(=O)c2ccc(N3CCN(CC)CC3)cc2)cnn1-c1cccc(C)c1 ZINC000482740923 898345032 /nfs/dbraw/zinc/34/50/32/898345032.db2.gz AZSKCKMEMSAAFJ-UHFFFAOYSA-N 0 3 417.557 4.137 20 0 HIADHN O=C(N[C@H](c1nccs1)c1ccccc1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000505546013 914245261 /nfs/dbraw/zinc/24/52/61/914245261.db2.gz ATCLAFAISRWZHS-FPOVZHCZSA-N 0 3 409.530 4.400 20 0 HIADHN O=C(Nc1nnc(SCc2ccccc2)s1)N1CCN(C2CCCCC2)CC1 ZINC000482796710 898405831 /nfs/dbraw/zinc/40/58/31/898405831.db2.gz OZUOZPXGSUCBAO-UHFFFAOYSA-N 0 3 417.604 4.313 20 0 HIADHN CCN1C[C@H](C)N(CCOc2c(Br)cccc2Br)C[C@H]1C ZINC000482799318 898407977 /nfs/dbraw/zinc/40/79/77/898407977.db2.gz SAJPWWGSGPGRLW-OLZOCXBDSA-N 0 3 420.189 4.005 20 0 HIADHN Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)NCc1ccc(Cl)cc1-n1cncn1 ZINC000482814147 898424736 /nfs/dbraw/zinc/42/47/36/898424736.db2.gz WAPLAHSMSNAHBY-NSHDSACASA-N 0 3 412.847 4.147 20 0 HIADHN CC[C@H](C)[C@H](N[C@H](C)c1cn(C)nc1C)C(=O)N1CCC(Cc2ccccc2)CC1 ZINC000482827345 898434642 /nfs/dbraw/zinc/43/46/42/898434642.db2.gz SRCCJSPNZCVYRS-GLDPYIMESA-N 0 3 410.606 4.275 20 0 HIADHN CC[C@@H](C(=O)Nc1ccc(OC)cc1)N1CCC(n2c(C)nc3ccccc32)CC1 ZINC000482889853 898507781 /nfs/dbraw/zinc/50/77/81/898507781.db2.gz MDXJQCIDEQJLPG-QFIPXVFZSA-N 0 3 406.530 4.408 20 0 HIADHN CC[C@@H](C)NC(=O)c1ccc(NC(=O)N2CCN(C3CCCCC3)CC2)c(C)c1 ZINC000482921103 898538292 /nfs/dbraw/zinc/53/82/92/898538292.db2.gz OFBRDYCQAVSNHI-GOSISDBHSA-N 0 3 400.567 4.006 20 0 HIADHN C[C@H](NCc1ccccc1CN1C(=O)NC2(CCCCC2)C1=O)c1cccc(F)c1 ZINC000482973329 898607510 /nfs/dbraw/zinc/60/75/10/898607510.db2.gz SSLSLLVSIJRWHW-KRWDZBQOSA-N 0 3 409.505 4.431 20 0 HIADHN Cc1ccc(S(=O)(=O)N[C@H](CCN(C)Cc2cnccc2C)c2ccccc2)cc1 ZINC000483009189 898661815 /nfs/dbraw/zinc/66/18/15/898661815.db2.gz IUTRYTQMXCAUTO-XMMPIXPASA-N 0 3 423.582 4.240 20 0 HIADHN CO[C@@]1(C)CCCN(CC(=O)NC[C@@H](c2c[nH]c3ccccc32)c2ccccc2)CC1 ZINC000483038490 898704448 /nfs/dbraw/zinc/70/44/48/898704448.db2.gz UQSWUXNDKTZCFE-GJZUVCINSA-N 0 3 419.569 4.307 20 0 HIADHN CC(C)c1ccc(NC(=O)N2CC[C@@H](N3CCN(C)CC3)[C@@H](C)C2)c(C(C)C)c1 ZINC000483040012 898707237 /nfs/dbraw/zinc/70/72/37/898707237.db2.gz KMHBJQLPYULGCR-WMZHIEFXSA-N 0 3 400.611 4.423 20 0 HIADHN Cc1cccc(C)c1NC(=O)CCCN[C@@H](CO)c1ccccc1OC(F)(F)F ZINC000483070522 898752816 /nfs/dbraw/zinc/75/28/16/898752816.db2.gz NSBQBQBCPNZSHZ-KRWDZBQOSA-N 0 3 410.436 4.244 20 0 HIADHN CCCC[C@@](C)(N[C@@H]1CCN(C2CCOCC2)C1=O)c1cccc(Br)c1 ZINC000483082949 898767659 /nfs/dbraw/zinc/76/76/59/898767659.db2.gz BIRPZDUAXPNSAY-TZIWHRDSSA-N 0 3 423.395 4.224 20 0 HIADHN CCCC[C@@](C)(NCC(=O)NCc1cccnc1)c1cccc(Br)c1 ZINC000483087759 898774077 /nfs/dbraw/zinc/77/40/77/898774077.db2.gz KDQNFZWFLBUKIO-HXUWFJFHSA-N 0 3 404.352 4.156 20 0 HIADHN Cc1c([C@H](C)N[C@@H](Cc2ccccc2)[C@@H](O)C(F)F)cnn1-c1ccc(F)cc1 ZINC000483131620 898814381 /nfs/dbraw/zinc/81/43/81/898814381.db2.gz BRDPRAZCZJGFKW-SZFUDVHCSA-N 0 3 403.448 4.208 20 0 HIADHN C[C@@H](N[C@H](CO)Cc1c[nH]c2ccccc12)c1ccccc1I ZINC000483142735 898822009 /nfs/dbraw/zinc/82/20/09/898822009.db2.gz MVIALBMUQUOFBF-HIFRSBDPSA-N 0 3 420.294 4.027 20 0 HIADHN C[C@@H](NC(=O)c1c[nH]c2cccc(Br)c12)[C@H](c1ccccc1)N(C)C ZINC000505580674 914287317 /nfs/dbraw/zinc/28/73/17/914287317.db2.gz HPXALCGQAIGFJV-BFUOFWGJSA-N 0 3 400.320 4.352 20 0 HIADHN C[C@@H](NC(=O)c1c[nH]c2cccc(Br)c12)[C@@H](c1ccccc1)N(C)C ZINC000505580677 914287639 /nfs/dbraw/zinc/28/76/39/914287639.db2.gz HPXALCGQAIGFJV-YJYMSZOUSA-N 0 3 400.320 4.352 20 0 HIADHN COc1cnccc1N1CCN([C@@H](C)c2cccc(NC(=O)c3ccccc3)c2)CC1 ZINC000483215345 898862764 /nfs/dbraw/zinc/86/27/64/898862764.db2.gz HJBXWXVHDYTUAW-IBGZPJMESA-N 0 3 416.525 4.226 20 0 HIADHN C[C@H](NC(=O)c1ccc(C(=O)Nc2ccccc2)cc1)[C@H](c1ccccc1)N(C)C ZINC000505587800 914294145 /nfs/dbraw/zinc/29/41/45/914294145.db2.gz OYCMSROVTPKTQF-FDDCHVKYSA-N 0 3 401.510 4.360 20 0 HIADHN OC[C@H](NC[C@@H](O)CC1CCCC1)c1ccc(Br)cc1C(F)(F)F ZINC000483271579 898910650 /nfs/dbraw/zinc/91/06/50/898910650.db2.gz PUEQQISWDRAUAD-BBRMVZONSA-N 0 3 410.274 4.032 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)Nc3cc(C(F)(F)F)ccc3Br)[C@@H]2C1 ZINC000483330826 898960037 /nfs/dbraw/zinc/96/00/37/898960037.db2.gz CGPNTFDMDJOZDS-IINYFYTJSA-N 0 3 406.246 4.026 20 0 HIADHN C[C@@H](Cc1ccc(O)cc1)N(C)C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000483333743 898963977 /nfs/dbraw/zinc/96/39/77/898963977.db2.gz GRHICIKRYROYSR-SFHVURJKSA-N 0 3 413.587 4.078 20 0 HIADHN C[C@H]1CN(CCC(=O)Nc2ccc(Oc3ccccc3)cc2)C[C@@]2(CCCOC2)O1 ZINC000483367092 899003308 /nfs/dbraw/zinc/00/33/08/899003308.db2.gz LDCDTLRNEYLLTA-YADARESESA-N 0 3 410.514 4.077 20 0 HIADHN Cc1ccc(NC(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)cc1-c1ncco1 ZINC000483369134 899004540 /nfs/dbraw/zinc/00/45/40/899004540.db2.gz DZSCBGCKNVVTBC-UHFFFAOYSA-N 0 3 404.514 4.433 20 0 HIADHN C[C@H](NC(=O)CCCc1nc(-c2ccc(F)cc2)no1)[C@H](c1ccccc1)N(C)C ZINC000505606414 914309562 /nfs/dbraw/zinc/30/95/62/914309562.db2.gz HIHRXNVGMOORLH-KSFYIVLOSA-N 0 3 410.493 4.006 20 0 HIADHN Cc1ccccc1-c1nn(-c2ccccc2)cc1CN1CC[C@@H](N2CCCC2=O)C1 ZINC000483441219 899074525 /nfs/dbraw/zinc/07/45/25/899074525.db2.gz PHWFZOHKPRMENH-JOCHJYFZSA-N 0 3 400.526 4.044 20 0 HIADHN O=C1CCCN1[C@H]1CCN(Cc2ccc(OCc3c(F)cccc3Cl)cc2)C1 ZINC000483449151 899085266 /nfs/dbraw/zinc/08/52/66/899085266.db2.gz YIOSXLODDNEGOO-KRWDZBQOSA-N 0 3 402.897 4.255 20 0 HIADHN Cc1ccc(NC(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)cc1C(=O)N(C)C(C)C ZINC000483450689 899086737 /nfs/dbraw/zinc/08/67/37/899086737.db2.gz WYHNPPGOPKZKLE-PGRDOPGGSA-N 0 3 410.562 4.288 20 0 HIADHN CC[C@H](N[C@H](C)c1ccc(S(=O)(=O)N2CCCCC2)cc1)c1c(C)nn(C)c1C ZINC000483454087 899090770 /nfs/dbraw/zinc/09/07/70/899090770.db2.gz KUHSVIIACAWYOF-IERDGZPVSA-N 0 3 418.607 4.013 20 0 HIADHN CC[C@@H](N[C@@H](C)c1ccc(S(=O)(=O)N2CCCCC2)cc1)c1c(C)nn(C)c1C ZINC000483454086 899091234 /nfs/dbraw/zinc/09/12/34/899091234.db2.gz KUHSVIIACAWYOF-HRAATJIYSA-N 0 3 418.607 4.013 20 0 HIADHN CN(C)C[C@H](NC(=O)Nc1cc(F)c(OC(F)F)cc1F)c1ccc(F)cc1 ZINC000483454956 899092148 /nfs/dbraw/zinc/09/21/48/899092148.db2.gz AQZVPSNYQBCRQK-HNNXBMFYSA-N 0 3 403.351 4.130 20 0 HIADHN COc1ccccc1OCc1ccc(C(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)o1 ZINC000505610892 914314347 /nfs/dbraw/zinc/31/43/47/914314347.db2.gz NBJVRJDRUJGVLG-UZUQRXQVSA-N 0 3 408.498 4.288 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1cc(O)ccc1Cl ZINC000483466984 899109118 /nfs/dbraw/zinc/10/91/18/899109118.db2.gz GRPVPNNHXKSIII-KRWDZBQOSA-N 0 3 410.905 4.250 20 0 HIADHN CN(C)C[C@H](NC(=O)Nc1cc(-c2ccc(Cl)s2)nn1C)c1ccc(F)cc1 ZINC000483573011 899227338 /nfs/dbraw/zinc/22/73/38/899227338.db2.gz HUOYRNUUKQFUAC-HNNXBMFYSA-N 0 3 421.929 4.366 20 0 HIADHN Cc1ccc(NC(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)cc1C(=O)N1CCCCC1 ZINC000483633693 899287025 /nfs/dbraw/zinc/28/70/25/899287025.db2.gz OXCPJRKDNKYAAH-WMZHIEFXSA-N 0 3 422.573 4.434 20 0 HIADHN C[C@H](NCCc1ccc(S(=O)(=O)N2CCCCC2)s1)c1ccc(F)cc1F ZINC000483649116 899306404 /nfs/dbraw/zinc/30/64/04/899306404.db2.gz WILHLYLJNQRKHZ-AWEZNQCLSA-N 0 3 414.543 4.094 20 0 HIADHN CCN(C(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F)c1ccc(OC)c(OC)c1 ZINC000505636890 914337720 /nfs/dbraw/zinc/33/77/20/914337720.db2.gz PWALNHSQXVAGIJ-LJQANCHMSA-N 0 3 418.484 4.214 20 0 HIADHN CNC(=O)[C@H](Cc1c[nH]c2ccccc12)N[C@H](C)c1ccc2cc(OC)ccc2c1 ZINC000483711526 899367407 /nfs/dbraw/zinc/36/74/07/899367407.db2.gz JNLIPEGQKYNXBS-GYCJOSAFSA-N 0 3 401.510 4.338 20 0 HIADHN CNC(=O)[C@H](Cc1c[nH]c2ccccc12)N[C@H](C)c1cccc(OC(F)(F)F)c1 ZINC000483711064 899368201 /nfs/dbraw/zinc/36/82/01/899368201.db2.gz IVXHFTIZWLNXDN-YJYMSZOUSA-N 0 3 405.420 4.074 20 0 HIADHN CC[C@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)c1ccc(OC(F)F)cc1 ZINC000483717226 899376296 /nfs/dbraw/zinc/37/62/96/899376296.db2.gz YXENIWMKKKVADW-ICSRJNTNSA-N 0 3 401.457 4.167 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2c(C)cccc2OC(F)F)c1 ZINC000483729146 899388887 /nfs/dbraw/zinc/38/88/87/899388887.db2.gz OMVAHYFDZIFOKI-UHFFFAOYSA-N 0 3 407.461 4.201 20 0 HIADHN Cc1ccc(C(=O)N2CCN(C3CCCCC3)CC2)cc1NC(=O)NC(C)(C)C ZINC000483866422 899547418 /nfs/dbraw/zinc/54/74/18/899547418.db2.gz BXBXIBWVGOLOQM-UHFFFAOYSA-N 0 3 400.567 4.006 20 0 HIADHN Cc1nc2cc(Br)cc(NC(=O)N(CCN(C)C)Cc3ccco3)c2o1 ZINC000483872894 899551455 /nfs/dbraw/zinc/55/14/55/899551455.db2.gz PTQCJFIPFZIPAE-UHFFFAOYSA-N 0 3 421.295 4.087 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)Nc1ccc2c(c1)CC(=O)N2C)c1ccc(Cl)cc1 ZINC000483875255 899553210 /nfs/dbraw/zinc/55/32/10/899553210.db2.gz DRGDTXTXLWZAAI-FQEVSTJZSA-N 0 3 414.937 4.064 20 0 HIADHN Cc1c(NC(=O)N[C@H](CN(C)C)c2ccc(F)cc2)noc1-c1ccccc1F ZINC000483945095 899598512 /nfs/dbraw/zinc/59/85/12/899598512.db2.gz UXGOXQCRBATFDN-GOSISDBHSA-N 0 3 400.429 4.353 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)NC[C@@H]1CCCC[C@@H]1C(F)(F)F ZINC000484024542 899658070 /nfs/dbraw/zinc/65/80/70/899658070.db2.gz BLDKLUXNFHKFAA-YOEHRIQHSA-N 0 3 421.454 4.407 20 0 HIADHN CC(C)n1ncc2c1nc(-c1ccco1)cc2C(=O)N1CCN(C2CCCCC2)CC1 ZINC000484101515 899727852 /nfs/dbraw/zinc/72/78/52/899727852.db2.gz CEQGVPTXJLPGSM-UHFFFAOYSA-N 0 3 421.545 4.363 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)Nc2nnc(/C=C\c3ccco3)s2)CC1 ZINC000484116679 899741209 /nfs/dbraw/zinc/74/12/09/899741209.db2.gz UPFIBROMLYBTTM-KTKRTIGZSA-N 0 3 423.542 4.430 20 0 HIADHN Cc1c([C@H](C)NCC2CCN(C(=O)c3ccccc3)CC2)nnn1-c1ccc(C)cc1 ZINC000484171379 899791195 /nfs/dbraw/zinc/79/11/95/899791195.db2.gz URFBGRRTFYZFEH-IBGZPJMESA-N 0 3 417.557 4.087 20 0 HIADHN C[C@H](NC(=O)NCc1cccc(NC(=O)C2CCCC2)c1)[C@H](c1ccccc1)N(C)C ZINC000484277447 899847197 /nfs/dbraw/zinc/84/71/97/899847197.db2.gz BYUSGOIOEMDHQR-FDDCHVKYSA-N 0 3 422.573 4.306 20 0 HIADHN CSc1cccc(N(C(=O)c2ccc3c(c2)CCN3C(C)=O)C2CCN(C)CC2)c1 ZINC000484294033 899857424 /nfs/dbraw/zinc/85/74/24/899857424.db2.gz IODZJNPAGSEVEN-UHFFFAOYSA-N 0 3 423.582 4.059 20 0 HIADHN CN1CCC[C@H](N[C@@H]2CCCc3nc(-c4ccc(Br)cc4)sc32)C1=O ZINC000484479815 899972024 /nfs/dbraw/zinc/97/20/24/899972024.db2.gz ZMYBZNLNFGCGFK-ZBFHGGJFSA-N 0 3 420.376 4.160 20 0 HIADHN COc1ccccc1NC(=O)CN[C@H](c1ccc(F)c(F)c1)C(C)(C)N1CCCC1 ZINC000484549556 900029332 /nfs/dbraw/zinc/02/93/32/900029332.db2.gz XGDFQBICODLDKB-JOCHJYFZSA-N 0 3 417.500 4.117 20 0 HIADHN COc1cc([C@H](C)N[C@@H](C)c2cccc(N3CCCC3)c2)ccc1S(C)(=O)=O ZINC000484598531 900059901 /nfs/dbraw/zinc/05/99/01/900059901.db2.gz LKPYBCRNIVOBFG-IRXDYDNUSA-N 0 3 402.560 4.111 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NC3(c4nc(C)cs4)CCC3)c(C)c2)CC1 ZINC000484610873 900068142 /nfs/dbraw/zinc/06/81/42/900068142.db2.gz YAPNCSYOPGEDNG-UHFFFAOYSA-N 0 3 413.591 4.103 20 0 HIADHN CC[C@]1(C)Oc2ccc(NC(=O)N(CCN(C)C)Cc3cccc(OC)c3)cc2O1 ZINC000484658093 900103165 /nfs/dbraw/zinc/10/31/65/900103165.db2.gz SBEPHIDCMYDMNC-HSZRJFAPSA-N 0 3 413.518 4.188 20 0 HIADHN CCc1nc(C2CCN([C@@H](C)C(=O)Nc3ccccc3-c3ccccc3)CC2)n[nH]1 ZINC000484700763 900135558 /nfs/dbraw/zinc/13/55/58/900135558.db2.gz RVMIKGRAWCYXPZ-KRWDZBQOSA-N 0 3 403.530 4.241 20 0 HIADHN CCc1n[nH]c(C2CCN([C@@H](C)C(=O)Nc3ccccc3-c3ccccc3)CC2)n1 ZINC000484700763 900135566 /nfs/dbraw/zinc/13/55/66/900135566.db2.gz RVMIKGRAWCYXPZ-KRWDZBQOSA-N 0 3 403.530 4.241 20 0 HIADHN CCc1nnc(C2CCN([C@@H](C)C(=O)Nc3ccccc3-c3ccccc3)CC2)[nH]1 ZINC000484700763 900135574 /nfs/dbraw/zinc/13/55/74/900135574.db2.gz RVMIKGRAWCYXPZ-KRWDZBQOSA-N 0 3 403.530 4.241 20 0 HIADHN CCc1nnc(C2CCN(Cc3coc(-c4ccc(Br)cc4)n3)CC2)[nH]1 ZINC000484733876 900160958 /nfs/dbraw/zinc/16/09/58/900160958.db2.gz BHQVFZOMDMCVKG-UHFFFAOYSA-N 0 3 416.323 4.164 20 0 HIADHN Cc1ccccc1C1(CNC(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)CCOCC1 ZINC000484932498 900304566 /nfs/dbraw/zinc/30/45/66/900304566.db2.gz DPBBTJJKOBPYDM-REWPJTCUSA-N 0 3 409.574 4.034 20 0 HIADHN CCOc1ccc(NC(=O)CCN2CCC(C(=O)c3ccc(OC)cc3)CC2)cc1 ZINC000484984864 900340607 /nfs/dbraw/zinc/34/06/07/900340607.db2.gz GGJUXFMEDWXFQK-UHFFFAOYSA-N 0 3 410.514 4.017 20 0 HIADHN CCOc1ccccc1NC(=O)CCN1CCC(Oc2ccc(F)cc2F)CC1 ZINC000485034813 900375146 /nfs/dbraw/zinc/37/51/46/900375146.db2.gz NTZTVJVFFOZNRH-UHFFFAOYSA-N 0 3 404.457 4.236 20 0 HIADHN COc1cccc(-c2nc(CN[C@]3(CO)C[C@@H](C)CC(C)(C)C3)cs2)c1OC ZINC000485064299 900389041 /nfs/dbraw/zinc/38/90/41/900389041.db2.gz OJUZDPDGLNYFPK-OYHNWAKOSA-N 0 3 404.576 4.494 20 0 HIADHN COc1ccc(NC(=O)CCN2CCC[C@@H]2c2cccc3c2OCCO3)cc1Cl ZINC000485085661 900399489 /nfs/dbraw/zinc/39/94/89/900399489.db2.gz LJVPFIWAXOOYFH-GOSISDBHSA-N 0 3 416.905 4.286 20 0 HIADHN COC(=O)c1ccc(N2CCN(CCCC(=O)Nc3c(C)cccc3C)[C@H](C)C2)cc1 ZINC000485101713 900410839 /nfs/dbraw/zinc/41/08/39/900410839.db2.gz CWFKKDAYCMBSQC-HXUWFJFHSA-N 0 3 423.557 4.019 20 0 HIADHN O=C(Nc1nnc(-c2cc3ccccc3o2)[n-]1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000485105677 900412814 /nfs/dbraw/zinc/41/28/14/900412814.db2.gz MNHMUHLGLJBDJW-UHFFFAOYSA-N 0 3 401.470 4.069 20 0 HIADHN O=C(Nc1nc(-c2cc3ccccc3o2)n[n-]1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000485105677 900412818 /nfs/dbraw/zinc/41/28/18/900412818.db2.gz MNHMUHLGLJBDJW-UHFFFAOYSA-N 0 3 401.470 4.069 20 0 HIADHN CCc1ccc(Cl)c(CC)c1NC(=O)CCCN[C@](C)(C(N)=O)c1ccccc1 ZINC000485136215 900438385 /nfs/dbraw/zinc/43/83/85/900438385.db2.gz UUHDDBLRWGPGBM-QHCPKHFHSA-N 0 3 415.965 4.174 20 0 HIADHN CCCCn1ncc(NC(=O)N(C)C[C@@H]2CCN(C)[C@H]2c2cccnc2)c1C(C)C ZINC000485168145 900466179 /nfs/dbraw/zinc/46/61/79/900466179.db2.gz YXRYYAGMSSBJPD-UGKGYDQZSA-N 0 3 412.582 4.358 20 0 HIADHN CS[C@@H]1CN(C(=O)Nc2cnn(-c3ccc(Cl)cc3)c2C(C)C)C[C@H]1N(C)C ZINC000485199482 900492647 /nfs/dbraw/zinc/49/26/47/900492647.db2.gz ZJYOKWXMZOBXOO-QZTJIDSGSA-N 0 3 421.998 4.158 20 0 HIADHN Cc1nc(-c2ccccc2Br)sc1[C@H](C)N[C@@H]1CCCN(C)C1=O ZINC000485258800 900543207 /nfs/dbraw/zinc/54/32/07/900543207.db2.gz IWOBVSOLZRPIKS-XHDPSFHLSA-N 0 3 408.365 4.152 20 0 HIADHN O=C(Nc1cccc(-n2ccnc2)c1)c1cc(-c2ccc(Br)cc2)n[nH]1 ZINC000485285932 900563814 /nfs/dbraw/zinc/56/38/14/900563814.db2.gz QFEZYGAMWFZWBM-UHFFFAOYSA-N 0 3 408.259 4.277 20 0 HIADHN C[C@H](c1ccc([S@@](C)=O)cc1)N(C)CCC(=O)Nc1cccc(C(F)(F)F)c1 ZINC000485410337 900708371 /nfs/dbraw/zinc/70/83/71/900708371.db2.gz UWTHFTTUVGLJAS-GMYLUUGSSA-N 0 3 412.477 4.464 20 0 HIADHN C[C@H](c1ccc([S@@](C)=O)cc1)N(C)CCC(=O)Nc1ccccc1C(F)(F)F ZINC000485413497 900712699 /nfs/dbraw/zinc/71/26/99/900712699.db2.gz YQFMXTGDKZJFTO-GMYLUUGSSA-N 0 3 412.477 4.464 20 0 HIADHN COc1ccc2ccccc2c1-c1cc(CNC(=O)[C@@H](C)N2[C@H](C)CC[C@@H]2C)on1 ZINC000485433675 900731281 /nfs/dbraw/zinc/73/12/81/900731281.db2.gz RFOXEVFDJRJRDQ-IXDOHACOSA-N 0 3 407.514 4.381 20 0 HIADHN CO[C@@H](C)c1noc(CN2CCCN(C3c4ccccc4-c4ccccc43)CC2)n1 ZINC000485438171 900735757 /nfs/dbraw/zinc/73/57/57/900735757.db2.gz LNTDBSQQVJODDN-KRWDZBQOSA-N 0 3 404.514 4.055 20 0 HIADHN C[C@]12CC3CC(C(=O)Nc4ccc(C(=O)NCCN5CCCC5)cc4)(C1)C[C@@](C)(C3)C2 ZINC000485476105 900769504 /nfs/dbraw/zinc/76/95/04/900769504.db2.gz ALWMIPPUMHGNAC-JZHSQQRGSA-N 0 3 423.601 4.447 20 0 HIADHN CC[C@H](C)c1ccccc1OCC(=O)Nc1ccc(C(=O)NCCN2CCCC2)cc1 ZINC000485508309 900795163 /nfs/dbraw/zinc/79/51/63/900795163.db2.gz XZZHIQSXGDEKIY-IBGZPJMESA-N 0 3 423.557 4.043 20 0 HIADHN CC[C@@H](Sc1ccccc1)C(=O)Nc1ccc(C(=O)NCCN2CCCC2)cc1 ZINC000485568048 900838158 /nfs/dbraw/zinc/83/81/58/900838158.db2.gz INHRMWJCQDHMIY-OAQYLSRUSA-N 0 3 411.571 4.022 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)NC[C@H](c1ccccc1)C(F)(F)F ZINC000485590791 900853428 /nfs/dbraw/zinc/85/34/28/900853428.db2.gz MOKLDSGAVVCBMS-OAQYLSRUSA-N 0 3 419.491 4.051 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N[C@H](c3ccccc3)c3cccnc3)cc2)CC1 ZINC000485593754 900856263 /nfs/dbraw/zinc/85/62/63/900856263.db2.gz RXYMHQZBTHWEJV-RUZDIDTESA-N 0 3 414.553 4.131 20 0 HIADHN C[C@H](Oc1ccccc1Br)C(=O)N[C@H](CN1CCCC1)c1ccccc1 ZINC000485706218 900955729 /nfs/dbraw/zinc/95/57/29/900955729.db2.gz HACDYJPEAKFHAO-QFBILLFUSA-N 0 3 417.347 4.170 20 0 HIADHN CN(C)Cc1ccccc1C(=O)Nc1ccc(F)c(NC(=O)Cc2ccccc2)c1 ZINC000485796237 901047921 /nfs/dbraw/zinc/04/79/21/901047921.db2.gz SVDVQNPMHTXJAX-UHFFFAOYSA-N 0 3 405.473 4.321 20 0 HIADHN Cc1cccc2c1[C@H](C)C[C@@H]2CC(=O)Nc1ccc2oc(=O)n(CCN(C)C)c2c1 ZINC000485796979 901049314 /nfs/dbraw/zinc/04/93/14/901049314.db2.gz VSUMZNQLEPZPHO-IAGOWNOFSA-N 0 3 407.514 4.084 20 0 HIADHN C[C@H]1CN(C)C[C@H]1C(=O)Nc1nnc(SCc2c(Cl)cccc2Cl)s1 ZINC000485859317 901099995 /nfs/dbraw/zinc/09/99/95/901099995.db2.gz ZXWUMMDGAQBUPN-VHSXEESVSA-N 0 3 417.387 4.273 20 0 HIADHN COC(=O)c1ccc2c(c1)nc(CN1C[C@H](c3ccccc3)[C@@H]3CCCC[C@@H]31)[nH]c2=O ZINC000485880167 901116523 /nfs/dbraw/zinc/11/65/23/901116523.db2.gz IRHKPUJVNKTOGN-DWLFOUALSA-N 0 3 417.509 4.280 20 0 HIADHN COCCN(C(C)=O)c1nc(CN2C[C@H](c3ccccc3)[C@@H]3CCCC[C@H]32)cs1 ZINC000485903576 901132622 /nfs/dbraw/zinc/13/26/22/901132622.db2.gz DMYKHODSORTGIY-BHDDXSALSA-N 0 3 413.587 4.301 20 0 HIADHN C[C@@H](CNC(=O)c1ccc(NC(=O)Nc2ccccc2)s1)N1CCCC[C@H]1C ZINC000485914600 901140753 /nfs/dbraw/zinc/14/07/53/901140753.db2.gz CAGBRKMMVQLJCQ-CVEARBPZSA-N 0 3 400.548 4.385 20 0 HIADHN CCc1ccc(-c2noc([C@@H](C)NC(=O)N3CCN(C4CCCCC4)CC3)n2)cc1 ZINC000485995059 901212440 /nfs/dbraw/zinc/21/24/40/901212440.db2.gz YCZFBOZRWZDNMM-QGZVFWFLSA-N 0 3 411.550 4.020 20 0 HIADHN CC[C@H](N[C@H](C)c1ccc(-n2cnnn2)cc1)c1cc(F)cc(Br)c1 ZINC000486093724 901281719 /nfs/dbraw/zinc/28/17/19/901281719.db2.gz UWUZYWLAXGORKS-XIKOKIGWSA-N 0 3 404.287 4.366 20 0 HIADHN Cc1ccc(F)c(C(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)c1Br ZINC000486117085 901303486 /nfs/dbraw/zinc/30/34/86/901303486.db2.gz FAWHBRRHHLWNMD-YOEHRIQHSA-N 0 3 405.311 4.147 20 0 HIADHN CN(C(=O)c1nc2ccccc2cc1Cl)C1CCN(CCc2ccccn2)CC1 ZINC000486129902 901316698 /nfs/dbraw/zinc/31/66/98/901316698.db2.gz RFGYXGSLBLDHAQ-UHFFFAOYSA-N 0 3 408.933 4.062 20 0 HIADHN C[C@@H](C(=O)N(c1nccs1)C1CCCCC1)N1CCN(C2CCCCC2)CC1 ZINC000486239426 901421842 /nfs/dbraw/zinc/42/18/42/901421842.db2.gz AFGHKRBMFVYHFU-SFHVURJKSA-N 0 3 404.624 4.148 20 0 HIADHN COc1ccc([C@@H]2CCCCCN2C(=O)CN2CCN(C3CCCCC3)CC2)cc1 ZINC000486246088 901428446 /nfs/dbraw/zinc/42/84/46/901428446.db2.gz UQXZTXZFJLQKLD-DEOSSOPVSA-N 0 3 413.606 4.089 20 0 HIADHN O=C(CN1CCN(C2CCCCC2)CC1)Nc1c(Cl)cccc1C(F)(F)F ZINC000486248288 901430808 /nfs/dbraw/zinc/43/08/08/901430808.db2.gz CYNSCLCQPKYMHR-UHFFFAOYSA-N 0 3 403.876 4.248 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)C[C@H](c3ccccc3)C(F)(F)F)CC2)C[C@@H](C)O1 ZINC000486293203 901475188 /nfs/dbraw/zinc/47/51/88/901475188.db2.gz QIKIXVXPCVWZGG-MBOZVWFJSA-N 0 3 412.496 4.070 20 0 HIADHN CCCc1nc(C)c(NC(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)s1 ZINC000486322670 901499277 /nfs/dbraw/zinc/49/92/77/901499277.db2.gz KCVQLVMZSZXRAB-IYBDPMFKSA-N 0 3 408.612 4.147 20 0 HIADHN CN(C)Cc1ccccc1C(=O)Nc1ccc(OCc2cn3ccccc3n2)cc1 ZINC000486382631 901547847 /nfs/dbraw/zinc/54/78/47/901547847.db2.gz SWMQWLMQCUSVNO-UHFFFAOYSA-N 0 3 400.482 4.227 20 0 HIADHN COc1ccc(Cl)cc1CN1C[C@H]2CCC[C@@]2(c2nc(-c3cccnc3)no2)C1 ZINC000486459319 901619062 /nfs/dbraw/zinc/61/90/62/901619062.db2.gz KVQXASIZWPLDFQ-VGOFRKELSA-N 0 3 410.905 4.347 20 0 HIADHN COc1cc2c(cc1CN1C[C@H]3CCC[C@@]3(c3nc(-c4ccccc4)no3)C1)OCO2 ZINC000486461711 901622122 /nfs/dbraw/zinc/62/21/22/901622122.db2.gz CHNBQZSCGJCXPD-HOYKHHGWSA-N 0 3 419.481 4.028 20 0 HIADHN C[S@@](=O)c1ccc(CN2C[C@H]3CCC[C@@]3(c3nc(-c4ccccc4)no3)C2)cc1 ZINC000486464406 901623600 /nfs/dbraw/zinc/62/36/00/901623600.db2.gz GCINVLFHNRGPCU-XGBAOLAVSA-N 0 3 407.539 4.028 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)N[C@@H]2CC(C)(C)Oc3cc(F)ccc32)o1 ZINC000486478794 901638246 /nfs/dbraw/zinc/63/82/46/901638246.db2.gz APZAYJHMCLNCOB-LJQANCHMSA-N 0 3 403.498 4.103 20 0 HIADHN COc1ccc(C2(CNC(=O)c3ccccc3CN(C)C)CCCCC2)cc1OC ZINC000486496734 901649085 /nfs/dbraw/zinc/64/90/85/901649085.db2.gz HJZUUELFSINWBP-UHFFFAOYSA-N 0 3 410.558 4.397 20 0 HIADHN Cn1nc2ccccc2c1C(=O)N[C@H](c1ccc(F)c(F)c1)C(C)(C)N1CCCC1 ZINC000486554850 901701110 /nfs/dbraw/zinc/70/11/10/901701110.db2.gz GBUSSZFQGLFXSA-OAQYLSRUSA-N 0 3 412.484 4.197 20 0 HIADHN C[C@@H](CC(=O)Nc1cccc2c1CCN(CC(C)(C)O)C2)c1c[nH]c2ccccc21 ZINC000486608003 901743482 /nfs/dbraw/zinc/74/34/82/901743482.db2.gz YACXBYAULQLKGL-KRWDZBQOSA-N 0 3 405.542 4.429 20 0 HIADHN C[C@H](Oc1ccccc1Br)C(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000486720366 901812661 /nfs/dbraw/zinc/81/26/61/901812661.db2.gz GHPAKSJAFDHCAB-BQFCYCMXSA-N 0 3 417.347 4.168 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1ccc2c(c1)CCCCC2=O ZINC000486725177 901815791 /nfs/dbraw/zinc/81/57/91/901815791.db2.gz XIOBRTHRBDKDLB-UHFFFAOYSA-N 0 3 406.526 4.052 20 0 HIADHN Cc1nn(-c2ccncc2)cc1CN[C@H]1CSc2ccc(Br)cc21 ZINC000486808536 901867320 /nfs/dbraw/zinc/86/73/20/901867320.db2.gz KVCZMIISTIPNIT-KRWDZBQOSA-N 0 3 401.333 4.275 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)C/C=C/c3cccc(F)c3)CC2)c1 ZINC000486816022 901871074 /nfs/dbraw/zinc/87/10/74/901871074.db2.gz BCQXCGKDSKBWDV-RMKNXTFCSA-N 0 3 409.549 4.256 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3ccc(F)cc3OC(F)F)c(C)c2)CC1 ZINC000486823351 901876578 /nfs/dbraw/zinc/87/65/78/901876578.db2.gz KTPQFYBYOOWYSK-UHFFFAOYSA-N 0 3 407.436 4.130 20 0 HIADHN CN(C(=O)Nc1nnc(/C=C\c2ccco2)s1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000486851253 901896565 /nfs/dbraw/zinc/89/65/65/901896565.db2.gz KGGRKAMOGGJOIN-JYBLJSLWSA-N 0 3 423.542 4.430 20 0 HIADHN CO[C@H](C)c1nc(C)c(C(=O)Nc2ccc(CCN3CCSCC3)cc2)s1 ZINC000486871964 901917060 /nfs/dbraw/zinc/91/70/60/901917060.db2.gz ICBSCNCBKGQMHW-OAHLLOKOSA-N 0 3 405.589 4.003 20 0 HIADHN CC(C)[C@@H](C(=O)Nc1ccc2oc(=O)n(CCN(C)C)c2c1)c1cccc(Cl)c1 ZINC000486882671 901930235 /nfs/dbraw/zinc/93/02/35/901930235.db2.gz RLFKSZATVAFMMZ-HXUWFJFHSA-N 0 3 415.921 4.188 20 0 HIADHN C[C@@H]1CN([C@@H](CNCc2scnc2C2CC2)c2c(F)cccc2Cl)CCO1 ZINC000486925306 901967506 /nfs/dbraw/zinc/96/75/06/901967506.db2.gz FDPGRWKBIPSQNO-DYVFJYSZSA-N 0 3 409.958 4.365 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)NC[C@@H](c1ccccc1)C(F)(F)F ZINC000487030447 902027881 /nfs/dbraw/zinc/02/78/81/902027881.db2.gz IUAVHAYSTIXAII-IBGZPJMESA-N 0 3 411.443 4.245 20 0 HIADHN C[C@H](NC(=O)N(CCN(C)C)Cc1ccccc1F)c1ccc2ncsc2c1 ZINC000487052661 902038661 /nfs/dbraw/zinc/03/86/61/902038661.db2.gz XVGMDASPKGSFTR-HNNXBMFYSA-N 0 3 400.523 4.270 20 0 HIADHN CC(C)([C@H](NC(=O)c1cc(=O)[nH]c(C2CC2)c1)c1ccc(F)c(F)c1)N1CCCC1 ZINC000487073213 902047730 /nfs/dbraw/zinc/04/77/30/902047730.db2.gz PJIUNAANXLEOAP-OAQYLSRUSA-N 0 3 415.484 4.288 20 0 HIADHN COc1ccccc1NCC(=O)N[C@H](c1ccc(F)c(F)c1)C(C)(C)N1CCCC1 ZINC000487109546 902061488 /nfs/dbraw/zinc/06/14/88/902061488.db2.gz HFLOLEMNNPSGAX-JOCHJYFZSA-N 0 3 417.500 4.117 20 0 HIADHN CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)N[C@@H](c1ccc(F)cc1)C(F)(F)F ZINC000487167329 902082960 /nfs/dbraw/zinc/08/29/60/902082960.db2.gz ZRMAWLRCZWNHNM-WDSOQIARSA-N 0 3 424.442 4.159 20 0 HIADHN CCOc1ccc(CNCc2nc(-c3ccc(Br)cc3)n[nH]2)cc1F ZINC000487267574 902129124 /nfs/dbraw/zinc/12/91/24/902129124.db2.gz KVRYESHWZMREFC-UHFFFAOYSA-N 0 3 405.271 4.062 20 0 HIADHN CC[C@H](C)c1nc([C@@H](C)NC(=O)NC[C@@H](c2cccc(Cl)c2)N2CCCC2)n[nH]1 ZINC000487349011 902156539 /nfs/dbraw/zinc/15/65/39/902156539.db2.gz AEQJFXNCIPEGNO-DAYGRLMNSA-N 0 3 418.973 4.169 20 0 HIADHN COc1cc(-c2noc(CN[C@H]3CCCC[C@@H]3C(C)(C)C)n2)cc(OC)c1OC ZINC000487391105 902175968 /nfs/dbraw/zinc/17/59/68/902175968.db2.gz KYTIVQRATKVHOM-HOTGVXAUSA-N 0 3 403.523 4.457 20 0 HIADHN COc1cc(-c2noc(CN3CCC[C@H]3Cc3ccc(C)cc3)n2)cc(OC)c1OC ZINC000487406029 902187782 /nfs/dbraw/zinc/18/77/82/902187782.db2.gz DUDQVTYDJILEAN-IBGZPJMESA-N 0 3 423.513 4.278 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1Cc1nc(-c2cc(F)c(F)c(F)c2)no1 ZINC000487408383 902190064 /nfs/dbraw/zinc/19/00/64/902190064.db2.gz CGAQNVHBDYNESF-OAHLLOKOSA-N 0 3 416.447 4.250 20 0 HIADHN Cc1nc(-c2ccc(C)cc2NC(=O)CN2CCC[C@@H]2Cc2ccccc2C)n[nH]1 ZINC000487433545 902208061 /nfs/dbraw/zinc/20/80/61/902208061.db2.gz SXDVFPIYEITPDG-HXUWFJFHSA-N 0 3 403.530 4.043 20 0 HIADHN C[C@H](c1cccc(N2CCCS2(=O)=O)c1)N(C)Cc1ccc(OC(F)F)cc1 ZINC000487856845 902408698 /nfs/dbraw/zinc/40/86/98/902408698.db2.gz WPGVHEKARCZPLQ-OAHLLOKOSA-N 0 3 410.486 4.021 20 0 HIADHN COc1ccc(CCNC(=O)[C@H](C)N[C@H](C)c2ccc(F)c3ccccc32)cc1OC ZINC000487870996 902415986 /nfs/dbraw/zinc/41/59/86/902415986.db2.gz BMDYHKPJXHQTQG-SJORKVTESA-N 0 3 424.516 4.394 20 0 HIADHN CCOC(=O)c1sc(NC(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)cc1C ZINC000488342057 902776311 /nfs/dbraw/zinc/77/63/11/902776311.db2.gz DGCZQHTZCORPDM-UHFFFAOYSA-N 0 3 415.559 4.016 20 0 HIADHN COCc1ccsc1C(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1 ZINC000488413014 902815886 /nfs/dbraw/zinc/81/58/86/902815886.db2.gz UHPQUGBBXNMPTD-UHFFFAOYSA-N 0 3 400.466 4.117 20 0 HIADHN C[C@H](c1cccc(N2CCCS2(=O)=O)c1)N(C)Cc1cccc(Br)c1 ZINC000488429807 902823577 /nfs/dbraw/zinc/82/35/77/902823577.db2.gz FGDZDLFOQRJWPP-OAHLLOKOSA-N 0 3 423.376 4.182 20 0 HIADHN O=C(Nc1ccc2c(c1)CCCO2)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000505995647 914665658 /nfs/dbraw/zinc/66/56/58/914665658.db2.gz IYSXXAWEMNQCES-NRFANRHFSA-N 0 3 404.432 4.405 20 0 HIADHN CCN(C[C@@H]1CCN(Cc2cncc(OCc3ccccc3)c2)C1)CC(F)(F)F ZINC000488467995 902840721 /nfs/dbraw/zinc/84/07/21/902840721.db2.gz XTFVXGRBQJIBCQ-IBGZPJMESA-N 0 3 407.480 4.367 20 0 HIADHN C[C@@H]1CN(C2CCOCC2)CCN1C(=O)Nc1ccc(COCc2ccccc2)cc1 ZINC000488468270 902840884 /nfs/dbraw/zinc/84/08/84/902840884.db2.gz RZIZKSPGTWBTJH-HXUWFJFHSA-N 0 3 423.557 4.120 20 0 HIADHN CCCOc1ccc(C(=O)CCC(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@@H]2C)cc1 ZINC000488519880 902867395 /nfs/dbraw/zinc/86/73/95/902867395.db2.gz VCRBKDSPHZULDQ-GBXCKJPGSA-N 0 3 422.569 4.465 20 0 HIADHN O=C(CCCc1ncc(-c2ccccc2)o1)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000488660838 902924409 /nfs/dbraw/zinc/92/44/09/902924409.db2.gz SYWUMPYQRSRIDA-UHFFFAOYSA-N 0 3 419.525 4.260 20 0 HIADHN CC[N@H+](Cc1ccc(C(=O)NCc2ccc([O-])c(Br)c2)cc1)C1CC1 ZINC000488663540 902926600 /nfs/dbraw/zinc/92/66/00/902926600.db2.gz ZRCDYNVESMBXLU-UHFFFAOYSA-N 0 3 403.320 4.069 20 0 HIADHN CC[N@@H+](Cc1ccc(C(=O)NCc2ccc([O-])c(Br)c2)cc1)C1CC1 ZINC000488663540 902926614 /nfs/dbraw/zinc/92/66/14/902926614.db2.gz ZRCDYNVESMBXLU-UHFFFAOYSA-N 0 3 403.320 4.069 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)c1ccc(COc2ccccc2)cc1 ZINC000488679126 902939422 /nfs/dbraw/zinc/93/94/22/902939422.db2.gz WOCPEFCCTBGLDK-UHFFFAOYSA-N 0 3 416.521 4.475 20 0 HIADHN O=C(CCc1ccccc1OC(F)(F)F)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000488700595 902953047 /nfs/dbraw/zinc/95/30/47/902953047.db2.gz QZISRTQAHXLBDL-UHFFFAOYSA-N 0 3 422.447 4.113 20 0 HIADHN Cc1ccc(NC(=O)CNC(=O)c2ccc(Oc3ccccc3)cc2)c(CN(C)C)c1 ZINC000506003408 914674001 /nfs/dbraw/zinc/67/40/01/914674001.db2.gz URLYRMPVJAAGST-UHFFFAOYSA-N 0 3 417.509 4.217 20 0 HIADHN CC(C)n1ncc(C(=O)N2CCC(CN3C[C@@H](C)O[C@H](C)C3)CC2)c1-c1ccccc1 ZINC000488829270 903029424 /nfs/dbraw/zinc/02/94/24/903029424.db2.gz CUWNAXWFEGHLDQ-WOJBJXKFSA-N 0 3 424.589 4.092 20 0 HIADHN COc1ccc(NC(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)c(C(F)(F)F)c1 ZINC000488893115 903062455 /nfs/dbraw/zinc/06/24/55/903062455.db2.gz SULVLEDFOGOJET-UHFFFAOYSA-N 0 3 421.463 4.497 20 0 HIADHN C[C@H](N[C@H](COc1ccccc1F)C(C)(C)C)C(=O)N[C@H]1CCOc2ccccc21 ZINC000489025284 903128692 /nfs/dbraw/zinc/12/86/92/903128692.db2.gz DATSINFKAAXSMI-XWFZLUIHSA-N 0 3 414.521 4.237 20 0 HIADHN COc1cc(CN(C)Cc2ccc3c(c2)nnn3C)ccc1OCc1ccccc1 ZINC000506017514 914693273 /nfs/dbraw/zinc/69/32/73/914693273.db2.gz SIRZGCIEVLUELM-UHFFFAOYSA-N 0 3 402.498 4.188 20 0 HIADHN CC(C)c1nc(CCNC(=O)N(Cc2ccccc2)C2CCN(C)CC2)cs1 ZINC000489162550 903237405 /nfs/dbraw/zinc/23/74/05/903237405.db2.gz YMOUISNZVFXPAW-UHFFFAOYSA-N 0 3 400.592 4.115 20 0 HIADHN Cc1ncsc1CNC(=O)N(CCN(C)Cc1ccccc1)Cc1ccccc1 ZINC000489182892 903247871 /nfs/dbraw/zinc/24/78/71/903247871.db2.gz LDDOKHDRKWEDEF-UHFFFAOYSA-N 0 3 408.571 4.295 20 0 HIADHN O=C(Nc1ccn(-c2ncccc2C(F)(F)F)n1)c1cccc(CN2CCCC2)c1 ZINC000489329065 903333016 /nfs/dbraw/zinc/33/30/16/903333016.db2.gz NUANEWUBTLPARC-UHFFFAOYSA-N 0 3 415.419 4.134 20 0 HIADHN C[C@@H](CC(C)(C)c1ccccc1)NC(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000489380569 903355093 /nfs/dbraw/zinc/35/50/93/903355093.db2.gz PVIIRSZDAFAMQV-FQEVSTJZSA-N 0 3 423.601 4.199 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)N3CCC[C@H](C[NH+]4CCCCCC4)C3)cc2)cc(=O)[n-]1 ZINC000489538866 903449242 /nfs/dbraw/zinc/44/92/42/903449242.db2.gz QDUWILLBBONCSW-LJQANCHMSA-N 0 3 423.561 4.278 20 0 HIADHN CC[C@@H](NC(=O)NCc1ccccc1CN1CCC(O)CC1)c1ccc(Cl)s1 ZINC000489614370 903497897 /nfs/dbraw/zinc/49/78/97/903497897.db2.gz BHNCAZNHUOSNEK-GOSISDBHSA-N 0 3 421.994 4.309 20 0 HIADHN COc1ccc2cc(C(=O)NC[C@@H](c3ccc(C)cc3)N3CCCC3)c(C)nc2c1 ZINC000489616657 903499423 /nfs/dbraw/zinc/49/94/23/903499423.db2.gz AMYVQLVKTAHEAK-DEOSSOPVSA-N 0 3 403.526 4.427 20 0 HIADHN c1csc(C2(NCCOCCNC3(c4nccs4)CCCC3)CCCC2)n1 ZINC000489623480 903503030 /nfs/dbraw/zinc/50/30/30/903503030.db2.gz PXADGSCGOPIICZ-UHFFFAOYSA-N 0 3 406.621 4.034 20 0 HIADHN Cc1cc(C(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)c(C)n1-c1nccs1 ZINC000489630231 903506042 /nfs/dbraw/zinc/50/60/42/903506042.db2.gz ZTYVZQDJFGMTMR-NRFANRHFSA-N 0 3 408.571 4.426 20 0 HIADHN COc1cc([C@@H](C)N[C@@H](C)c2ccc(Br)c(F)c2)ccc1OCCO ZINC000489631829 903508180 /nfs/dbraw/zinc/50/81/80/903508180.db2.gz ORAGBNHIIJQDRP-QWHCGFSZSA-N 0 3 412.299 4.380 20 0 HIADHN COc1ccccc1[C@]1(C)C[C@H]1NC(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000489634632 903509533 /nfs/dbraw/zinc/50/95/33/903509533.db2.gz UKRASTSYWJYQDS-NOZRDPDXSA-N 0 3 407.558 4.031 20 0 HIADHN COc1ccccc1[C@]1(C)C[C@@H]1NC(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000489634634 903510310 /nfs/dbraw/zinc/51/03/10/903510310.db2.gz UKRASTSYWJYQDS-ZCYQVOJMSA-N 0 3 407.558 4.031 20 0 HIADHN Cc1nn(C)c2nc(C3CC3)cc(C(=O)NC[C@@H](c3ccc(C)cc3)N3CCCC3)c12 ZINC000489732931 903566147 /nfs/dbraw/zinc/56/61/47/903566147.db2.gz IXPNBPLMNXGPFX-QFIPXVFZSA-N 0 3 417.557 4.029 20 0 HIADHN COc1ccc(-c2noc([C@H](C)NCC3(N4CCSCC4)CCCCC3)n2)cc1 ZINC000489753780 903579717 /nfs/dbraw/zinc/57/97/17/903579717.db2.gz NSVPTMGGNXLJOK-KRWDZBQOSA-N 0 3 416.591 4.148 20 0 HIADHN Clc1cccc(-c2cnc(CN3CCC(CCCN4CCOCC4)CC3)o2)c1 ZINC000506047747 914742610 /nfs/dbraw/zinc/74/26/10/914742610.db2.gz PEJRLMQVQLVVLU-UHFFFAOYSA-N 0 3 403.954 4.319 20 0 HIADHN O=c1cc(CN2CCC[C@H](c3nc4c(s3)CCCC4)C2)nc2ccc(Cl)cn12 ZINC000490011957 903722864 /nfs/dbraw/zinc/72/28/64/903722864.db2.gz LPEPVLQPBKRIDN-AWEZNQCLSA-N 0 3 414.962 4.063 20 0 HIADHN COc1cc(-c2noc(CN3C[C@H](c4ccc(C)cc4)C[C@H]3C)n2)cc(OC)c1OC ZINC000490053652 903745513 /nfs/dbraw/zinc/74/55/13/903745513.db2.gz KWRKROATNWZABB-VQIMIIECSA-N 0 3 423.513 4.449 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](NCCc2cccnc2)c2ccc(Cl)cc2)c1 ZINC000490134898 903784555 /nfs/dbraw/zinc/78/45/55/903784555.db2.gz DASUUBQNADYJFM-OAQYLSRUSA-N 0 3 400.931 4.060 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2ccc(C)c(C(=O)N3CCCCC3)c2)N(C)C)cc1 ZINC000490146483 903793349 /nfs/dbraw/zinc/79/33/49/903793349.db2.gz QANIDMQONCLBFJ-HSZRJFAPSA-N 0 3 422.573 4.354 20 0 HIADHN CCc1ccc([C@@H](NCCN2CCCC[C@@H]2C)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000490168111 903806700 /nfs/dbraw/zinc/80/67/00/903806700.db2.gz RHQATTVXVZAAFH-YADARESESA-N 0 3 414.615 4.206 20 0 HIADHN CC[C@@H](CN[C@H](c1cccc(S(C)(=O)=O)c1)c1ccc(C)cc1C)N1CCCC1 ZINC000490171852 903808794 /nfs/dbraw/zinc/80/87/94/903808794.db2.gz JBINJEFEKYNVOI-XUZZJYLKSA-N 0 3 414.615 4.260 20 0 HIADHN CCc1ccc([C@@H](NC[C@@H](CC)N2CCCC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000490171905 903809172 /nfs/dbraw/zinc/80/91/72/903809172.db2.gz JONKECLJKPHIJQ-ISKFKSNPSA-N 0 3 414.615 4.206 20 0 HIADHN CCc1ccc([C@@H](NCCc2nccs2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000490171536 903809239 /nfs/dbraw/zinc/80/92/39/903809239.db2.gz FLHSLJDQRHOBCM-OAQYLSRUSA-N 0 3 400.569 4.031 20 0 HIADHN CCC(CC)[C@H](CN[C@@H](c1ccc(C)cc1)c1cccc(S(C)(=O)=O)c1)N(C)C ZINC000490191847 903818789 /nfs/dbraw/zinc/81/87/89/903818789.db2.gz XTVYMEUJSSRLLW-ZEQRLZLVSA-N 0 3 416.631 4.444 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)CCc3ncc(-c4ccc(Cl)cc4Cl)o3)[C@@H]2C1 ZINC000490273329 903867918 /nfs/dbraw/zinc/86/79/18/903867918.db2.gz MARZDLFWPHEFTC-SUMWQHHRSA-N 0 3 408.329 4.134 20 0 HIADHN CC[C@H](CNC(=O)N[C@H](c1ccccc1)c1cccnc1)N1CCc2ccccc2C1 ZINC000490285447 903875183 /nfs/dbraw/zinc/87/51/83/903875183.db2.gz JTLZCFUUOHYSDT-JWQCQUIFSA-N 0 3 414.553 4.307 20 0 HIADHN CC1CCN([C@H](CNC(=O)N[C@H]2CCOC3(CCCC3)C2)c2cccs2)CC1 ZINC000490316458 903896986 /nfs/dbraw/zinc/89/69/86/903896986.db2.gz OZYLIZJDRWCVIL-RBUKOAKNSA-N 0 3 405.608 4.312 20 0 HIADHN CCNC(=O)Nc1ccc(C)c(NC(=O)N(CC)[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000490321488 903901822 /nfs/dbraw/zinc/90/18/22/903901822.db2.gz JNLLXFLKFBEAEK-OAQYLSRUSA-N 0 3 423.561 4.265 20 0 HIADHN CCNC(=O)Nc1ccc(C)c(NC(=O)NC[C@H](c2ccsc2)N(CC)CC)c1 ZINC000490336388 903926395 /nfs/dbraw/zinc/92/63/95/903926395.db2.gz KJJOJODEALARIQ-LJQANCHMSA-N 0 3 417.579 4.403 20 0 HIADHN COc1ccc(NC(=O)N[C@H](CN2CCCC2)c2ccccc2)cc1Br ZINC000490341579 903933509 /nfs/dbraw/zinc/93/35/09/903933509.db2.gz QWSNJVQPXRIQGV-GOSISDBHSA-N 0 3 418.335 4.416 20 0 HIADHN CCNC(=O)Nc1ccc(C)c(NC(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)c1 ZINC000490355480 903949106 /nfs/dbraw/zinc/94/91/06/903949106.db2.gz SOKLJCPCZWJFQX-YLJYHZDGSA-N 0 3 409.534 4.093 20 0 HIADHN O=C(NC[C@H]1CCCCC(F)(F)C1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000490355412 903949686 /nfs/dbraw/zinc/94/96/86/903949686.db2.gz SBLUUCNUJCRBLX-JEYLPNPQSA-N 0 3 411.459 4.307 20 0 HIADHN CN(C)CCN(C(=O)Nc1cccc(-c2noc(C(F)(F)F)n2)c1)C1CCCC1 ZINC000490430725 904004894 /nfs/dbraw/zinc/00/48/94/904004894.db2.gz YUURZEZLYSWXFW-UHFFFAOYSA-N 0 3 411.428 4.094 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3ccc(-c4ccco4)cc3F)CC2)C[C@@H](C)O1 ZINC000490510427 904059264 /nfs/dbraw/zinc/05/92/64/904059264.db2.gz SZACVYDEPKCBDF-IAGOWNOFSA-N 0 3 415.509 4.439 20 0 HIADHN CCCNC(=O)c1ccc(NC(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)cc1 ZINC000490635565 904149293 /nfs/dbraw/zinc/14/92/93/904149293.db2.gz ICMCYJRGJANULH-JOCHJYFZSA-N 0 3 408.546 4.093 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)NCCc1coc(-c2ccc(C)cc2)n1)c1ccco1 ZINC000490684741 904171141 /nfs/dbraw/zinc/17/11/41/904171141.db2.gz PPLGTXLPFDYLLQ-FXAWDEMLSA-N 0 3 410.518 4.214 20 0 HIADHN CC(C)(C)c1nn(Cc2ccccc2)cc1CN1CCC(C(=O)N2CCCCC2)CC1 ZINC000506111339 914808058 /nfs/dbraw/zinc/80/80/58/914808058.db2.gz BHOHJILRESNWKJ-UHFFFAOYSA-N 0 3 422.617 4.453 20 0 HIADHN Cc1ccc([C@H](NC[C@@H](O)C2CCCCC2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000491003906 904364519 /nfs/dbraw/zinc/36/45/19/904364519.db2.gz GPFLOMIUUOCYKD-DNQXCXABSA-N 0 3 415.599 4.327 20 0 HIADHN CC(=O)N1CCC(CN[C@@H](c2ccccc2)c2ccccc2Br)CC1 ZINC000491059311 904402526 /nfs/dbraw/zinc/40/25/26/904402526.db2.gz ZNRXIXGASBHDKE-NRFANRHFSA-N 0 3 401.348 4.387 20 0 HIADHN CC[C@H](C)C(=O)Nc1cccc(CNC(=O)N2CCCN(Cc3ccccc3)CC2)c1 ZINC000506109030 914806842 /nfs/dbraw/zinc/80/68/42/914806842.db2.gz XHXKTHJLJHDGLF-FQEVSTJZSA-N 0 3 422.573 4.089 20 0 HIADHN Cc1cccc(N2CCN(CCCN[C@@H](c3ccccc3)c3ccccn3)CC2)c1 ZINC000491317645 904534139 /nfs/dbraw/zinc/53/41/39/904534139.db2.gz VZASRKPUYVFAPK-SANMLTNESA-N 0 3 400.570 4.281 20 0 HIADHN COc1ccc(CN2CCC[C@H](c3nnc4ccc(C(F)(F)F)cn43)C2)c(OC)c1 ZINC000506141307 914820332 /nfs/dbraw/zinc/82/03/32/914820332.db2.gz TZZONUIHAQNNDP-HNNXBMFYSA-N 0 3 420.435 4.145 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)[C@@H]2CN(Cc3ccccc3)CCC2(F)F)cc1Cl ZINC000506140364 914820413 /nfs/dbraw/zinc/82/04/13/914820413.db2.gz AWOSQSVELVDWLS-KRWDZBQOSA-N 0 3 421.875 4.394 20 0 HIADHN Clc1ccc(N2CC[C@H](NCc3cnnn3Cc3ccccc3)C2)c(Cl)c1 ZINC000491358800 904557092 /nfs/dbraw/zinc/55/70/92/904557092.db2.gz HQQVUUNHZUOWJH-KRWDZBQOSA-N 0 3 402.329 4.002 20 0 HIADHN COc1cc(CN2CCC[C@@H](c3nnc4ccccn43)C2)ccc1OCC(F)(F)F ZINC000506146042 914823736 /nfs/dbraw/zinc/82/37/36/914823736.db2.gz AINOFGUNWXDNBV-MRXNPFEDSA-N 0 3 420.435 4.059 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CN1CCC(C(=O)Nc2ccccc2O)CC1 ZINC000506146119 914823817 /nfs/dbraw/zinc/82/38/17/914823817.db2.gz BBANANPOSXJGQP-UHFFFAOYSA-N 0 3 404.514 4.045 20 0 HIADHN CNC(=O)c1ccc(CN(C)Cc2cc(C)c(OCc3ccccn3)c(C)c2)cc1 ZINC000506149557 914825154 /nfs/dbraw/zinc/82/51/54/914825154.db2.gz YJHGWUZHDYQMSG-UHFFFAOYSA-N 0 3 403.526 4.269 20 0 HIADHN COc1ccc(Br)cc1NC(=O)N(CCN(C)C)Cc1cccc(C)c1 ZINC000491538653 904641441 /nfs/dbraw/zinc/64/14/41/904641441.db2.gz OWAYBKNFBZUNKR-UHFFFAOYSA-N 0 3 420.351 4.362 20 0 HIADHN C[C@H](c1ccccc1Br)N(C)C(=O)NC[C@H](c1ccccc1)N(C)C ZINC000506167256 914831321 /nfs/dbraw/zinc/83/13/21/914831321.db2.gz UVBYILDENVXFPD-DNVCBOLYSA-N 0 3 404.352 4.454 20 0 HIADHN CC(=O)Nc1ccc(Br)cc1NC(=O)c1cccc(CN2CCCC2)c1 ZINC000506175494 914833529 /nfs/dbraw/zinc/83/35/29/914833529.db2.gz LMFQIHYENXHLPE-UHFFFAOYSA-N 0 3 416.319 4.256 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)N[C@H](c2ccccc2)c2ccncc2)CCN1Cc1ccccc1 ZINC000491997530 904754972 /nfs/dbraw/zinc/75/49/72/904754972.db2.gz ILSFZDHVGHEDSQ-VEXUSMLFSA-N 0 3 400.526 4.133 20 0 HIADHN CC[C@H](NCCC(=O)N(C)Cc1ccccc1Br)c1ccc(F)cn1 ZINC000492100089 904798500 /nfs/dbraw/zinc/79/85/00/904798500.db2.gz HDVTWZLPAROHDG-KRWDZBQOSA-N 0 3 408.315 4.073 20 0 HIADHN CC[C@@H](NCCC(=O)N(C)Cc1ccccc1Br)c1ccc(F)cn1 ZINC000492100090 904798684 /nfs/dbraw/zinc/79/86/84/904798684.db2.gz HDVTWZLPAROHDG-QGZVFWFLSA-N 0 3 408.315 4.073 20 0 HIADHN Cc1ccc([C@@H](NCCN2[C@H](C)CCC[C@@H]2C)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000492122436 904802059 /nfs/dbraw/zinc/80/20/59/904802059.db2.gz MXGGHESKVRFPTA-JXALWOEJSA-N 0 3 414.615 4.340 20 0 HIADHN CN1CCN(C)[C@H](CN[C@@H](c2ccc(Cl)cc2)c2ccc(C(F)(F)F)cc2)C1 ZINC000492177091 904809849 /nfs/dbraw/zinc/80/98/49/904809849.db2.gz DNKXZSHBRIHEAC-WOJBJXKFSA-N 0 3 411.899 4.284 20 0 HIADHN C[C@H](NCc1cc(Br)c2c(c1)OCCO2)[C@H]1OCCc2sccc21 ZINC000492194049 904812910 /nfs/dbraw/zinc/81/29/10/904812910.db2.gz QCJLPHKPIWPKNV-APPDUMDISA-N 0 3 410.333 4.074 20 0 HIADHN COCCN(C)c1ccc(CN[C@@H]2c3cccc(Br)c3CC2(C)C)cn1 ZINC000492258975 904824480 /nfs/dbraw/zinc/82/44/80/904824480.db2.gz OCNGPSANQPNWQN-HXUWFJFHSA-N 0 3 418.379 4.340 20 0 HIADHN FC(F)(F)c1ccn(C2CCN(Cc3ccc(OC[C@H]4CCCO4)cc3)CC2)n1 ZINC000492274298 904828073 /nfs/dbraw/zinc/82/80/73/904828073.db2.gz VGAXEUNWGZOMKO-LJQANCHMSA-N 0 3 409.452 4.297 20 0 HIADHN C[C@@H](C(=O)Nc1ccccc1-c1ccccc1)N1CCC(CCN2CCOCC2)CC1 ZINC000492377272 904840912 /nfs/dbraw/zinc/84/09/12/904840912.db2.gz QDICTOLCZNMBRV-NRFANRHFSA-N 0 3 421.585 4.115 20 0 HIADHN COc1ccc([C@H](CN[C@H](C)c2ccccc2Br)N2CCOCC2)cc1 ZINC000492786034 904904821 /nfs/dbraw/zinc/90/48/21/904904821.db2.gz WWPKXUKWQABIFC-IERDGZPVSA-N 0 3 419.363 4.182 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)C(=O)Nc1cccc2cccnc21)c1ccc(Cl)cc1 ZINC000506232499 914855152 /nfs/dbraw/zinc/85/51/52/914855152.db2.gz MGQQDEJMILPTEA-FQEVSTJZSA-N 0 3 424.932 4.026 20 0 HIADHN COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC(=O)CN(C(C)C)C(C)C ZINC000492853498 904927177 /nfs/dbraw/zinc/92/71/77/904927177.db2.gz REIWPVVCMNSPLI-UHFFFAOYSA-N 0 3 413.518 4.013 20 0 HIADHN OCC[C@]1(CN[C@@H](c2cccc(F)c2)c2cccc(Br)c2)CCOC1 ZINC000493009331 904985011 /nfs/dbraw/zinc/98/50/11/904985011.db2.gz MYQFYARUJFCMHH-WOJBJXKFSA-N 0 3 408.311 4.056 20 0 HIADHN OCC[C@@]1(CN[C@H](c2ccc(Cl)cc2)c2ccc(OC(F)F)cc2)CCOC1 ZINC000493008806 904986413 /nfs/dbraw/zinc/98/64/13/904986413.db2.gz LMTULLQQMGYEJX-CTNGQTDRSA-N 0 3 411.876 4.410 20 0 HIADHN CCc1ccc([C@H](N[C@@H]2C[C@@H](OC)C2(C)C)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000493011010 904989124 /nfs/dbraw/zinc/98/91/24/904989124.db2.gz SEQRPGCNPZFLSR-VSKRKVRLSA-N 0 3 401.572 4.145 20 0 HIADHN Cc1ccc([C@H](NCCc2cscn2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000493035962 904996923 /nfs/dbraw/zinc/99/69/23/904996923.db2.gz OCTLHNJJCMIJRR-OAQYLSRUSA-N 0 3 400.569 4.085 20 0 HIADHN Cc1ccc([C@H](NCC2(CCO)CCCC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000493056823 905004718 /nfs/dbraw/zinc/00/47/18/905004718.db2.gz KZZSNIVYOMBAOS-QFIPXVFZSA-N 0 3 401.572 4.020 20 0 HIADHN CCc1ccc([C@H](NC[C@@H](OC)C(C)(C)C)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000493059714 905005358 /nfs/dbraw/zinc/00/53/58/905005358.db2.gz PBBLFTSOJGKLTD-YADHBBJMSA-N 0 3 403.588 4.393 20 0 HIADHN CCc1ccc([C@@H](NC[C@@H](CO)c2ccccc2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000493134345 905029767 /nfs/dbraw/zinc/02/97/67/905029767.db2.gz YYUKQBRNHQTFNQ-UKILVPOCSA-N 0 3 423.578 4.108 20 0 HIADHN CCc1ccc([C@@H](NC2CCN(C(C)C)CC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000493134397 905030434 /nfs/dbraw/zinc/03/04/34/905030434.db2.gz ZDDSWIMLKZWCES-XMMPIXPASA-N 0 3 414.615 4.204 20 0 HIADHN CCc1ccc([C@H](NC[C@]2(C)CCCC[C@@H]2O)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000493203594 905048446 /nfs/dbraw/zinc/04/84/46/905048446.db2.gz JHABFPCSFKAIOH-HJOGWXRNSA-N 0 3 415.599 4.273 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)[C@@H]1CCCc2sc(C)nc21)c1cccc(OC)c1 ZINC000493253059 905069412 /nfs/dbraw/zinc/06/94/12/905069412.db2.gz JIYFEUGKHUVCRG-MOPGFXCFSA-N 0 3 401.576 4.079 20 0 HIADHN Cc1cn2c(n1)[C@H](CN[C@@H](c1ccc(C)cc1)c1cccc(S(C)(=O)=O)c1)CCC2 ZINC000493306746 905081369 /nfs/dbraw/zinc/08/13/69/905081369.db2.gz UDYNAHKAULCMPK-GMAHTHKFSA-N 0 3 423.582 4.160 20 0 HIADHN Cc1cccc2sc(N(Cc3ccccc3)C(=O)CN[C@H]3CCC[C@]3(C)CO)nc21 ZINC000493413424 905115122 /nfs/dbraw/zinc/11/51/22/905115122.db2.gz PADDSKLCMUPZTH-GBXCKJPGSA-N 0 3 423.582 4.279 20 0 HIADHN Cc1cc(NC(=O)C[C@H](C)c2c(C)n[nH]c2C)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000493463566 905128585 /nfs/dbraw/zinc/12/85/85/905128585.db2.gz VSYAFGCLVMGATQ-KKSFZXQISA-N 0 3 420.561 4.111 20 0 HIADHN Cc1ccc(-c2cc(C(=O)N3CC[C@@H]4CCN(C)C[C@H]43)c3cnn(C(C)C)c3n2)cc1 ZINC000493533790 905149289 /nfs/dbraw/zinc/14/92/89/905149289.db2.gz DCJDWLBAWTZGDW-WMZHIEFXSA-N 0 3 417.557 4.154 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)c3ccc(Oc4ccc(C(F)(F)F)cn4)cc3)[C@@H]2C1 ZINC000493557998 905161267 /nfs/dbraw/zinc/16/12/67/905161267.db2.gz SNODRDHFBYBPFH-KBXCAEBGSA-N 0 3 405.420 4.059 20 0 HIADHN COc1cc(-c2noc(CN[C@H]3CCC[C@H]3CCC(C)C)n2)cc(OC)c1OC ZINC000493570622 905162880 /nfs/dbraw/zinc/16/28/80/905162880.db2.gz ABXJPWKUWILUBL-RDJZCZTQSA-N 0 3 403.523 4.457 20 0 HIADHN COc1cc(-c2noc(CN[C@@H]3CCC[C@H]3CCC(C)C)n2)cc(OC)c1OC ZINC000493570620 905164069 /nfs/dbraw/zinc/16/40/69/905164069.db2.gz ABXJPWKUWILUBL-DOTOQJQBSA-N 0 3 403.523 4.457 20 0 HIADHN CN(C)Cc1cccc(C(=O)N[C@@H](c2ccccc2OC(F)F)C(F)(F)F)c1 ZINC000493572061 905166284 /nfs/dbraw/zinc/16/62/84/905166284.db2.gz GTBJAVIYPWTVQT-INIZCTEOSA-N 0 3 402.363 4.383 20 0 HIADHN C[C@@H](NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)nc1)c1cc(Br)cs1 ZINC000493735439 905206720 /nfs/dbraw/zinc/20/67/20/905206720.db2.gz HURZLFFSFAVBOU-MGPQQGTHSA-N 0 3 410.381 4.370 20 0 HIADHN COC[C@H](NCc1ccc(CN2C[C@@H](C)O[C@@H](C)C2)cc1)c1ccc(Cl)cc1 ZINC000493738518 905208045 /nfs/dbraw/zinc/20/80/45/905208045.db2.gz PQDODLKAAQOQGC-IXFSTUDKSA-N 0 3 402.966 4.427 20 0 HIADHN COC[C@H](NCc1ccc(CN2C[C@@H](C)O[C@H](C)C2)cc1)c1ccc(Cl)cc1 ZINC000493738519 905208610 /nfs/dbraw/zinc/20/86/10/905208610.db2.gz PQDODLKAAQOQGC-PNCHPQGNSA-N 0 3 402.966 4.427 20 0 HIADHN COCCSc1ccc([C@H](C)NC(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)cc1 ZINC000493809640 905225848 /nfs/dbraw/zinc/22/58/48/905225848.db2.gz MNTZJTZQTKSLKN-SVMVAKDDSA-N 0 3 415.603 4.477 20 0 HIADHN COCCSc1ccc([C@H](C)NC(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)cc1 ZINC000493809637 905225887 /nfs/dbraw/zinc/22/58/87/905225887.db2.gz MNTZJTZQTKSLKN-NJNPRVFISA-N 0 3 415.603 4.477 20 0 HIADHN CNS(=O)(=O)c1ccc([C@@H](C)N[C@@H]2CCc3cc(Br)cc(C)c32)cc1 ZINC000493843986 905231672 /nfs/dbraw/zinc/23/16/72/905231672.db2.gz MOGJASOIEMSLJR-FZKQIMNGSA-N 0 3 423.376 4.004 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)NCc2nc(C(C)(C)C)cs2)N(C)C)cc1 ZINC000493864658 905234659 /nfs/dbraw/zinc/23/46/59/905234659.db2.gz PCECWIMINPAEOD-SFHVURJKSA-N 0 3 418.607 4.330 20 0 HIADHN O=C(NCCCOc1ccccc1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000493902354 905256650 /nfs/dbraw/zinc/25/66/50/905256650.db2.gz CQLYQVOUJAUIMY-OAQYLSRUSA-N 0 3 406.448 4.026 20 0 HIADHN CCOCc1ccc(CNC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)cc1 ZINC000493950938 905300653 /nfs/dbraw/zinc/30/06/53/905300653.db2.gz VAANTJUCPKFBAD-QFIPXVFZSA-N 0 3 420.475 4.294 20 0 HIADHN CCN1CCN(c2ccc(N[C@@H](C)C(=O)NC34CC5CC(CC(C5)C3)C4)c(C)c2)CC1 ZINC000493978697 905324395 /nfs/dbraw/zinc/32/43/95/905324395.db2.gz YICWZKISASRTQY-UREPRSOHSA-N 0 3 424.633 4.022 20 0 HIADHN COc1cccc([C@H](NC2CCC(S(C)(=O)=O)CC2)c2ccccc2Cl)c1 ZINC000493997481 905338608 /nfs/dbraw/zinc/33/86/08/905338608.db2.gz WLYWFULNBNTLSI-IAYYMHMVSA-N 0 3 407.963 4.383 20 0 HIADHN COc1ccc([C@H](NC2CCC(S(C)(=O)=O)CC2)c2ccccc2Cl)cc1 ZINC000493996650 905338985 /nfs/dbraw/zinc/33/89/85/905338985.db2.gz MRTZSLLPVNAHRZ-IAYYMHMVSA-N 0 3 407.963 4.383 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)CCCc2ncc(-c3ccccc3)o2)CCN1Cc1ccccc1 ZINC000493999413 905342509 /nfs/dbraw/zinc/34/25/09/905342509.db2.gz IVHOOMRQDRZODT-KNQAVFIVSA-N 0 3 403.526 4.444 20 0 HIADHN C[C@H]1[C@H](NC(=O)c2ccccc2OCc2cscn2)CCN1Cc1ccccc1 ZINC000494006249 905345830 /nfs/dbraw/zinc/34/58/30/905345830.db2.gz HFKPGDCOLROMFT-LAUBAEHRSA-N 0 3 407.539 4.115 20 0 HIADHN Cc1nc(COc2ccccc2C(=O)N[C@H]2CCN(Cc3ccccc3)[C@@H]2C)cs1 ZINC000494005602 905347080 /nfs/dbraw/zinc/34/70/80/905347080.db2.gz AUEQRMBMEBQADZ-VGSWGCGISA-N 0 3 421.566 4.423 20 0 HIADHN Cc1ccc(C(=O)N[C@H]2CCN(Cc3ccccc3)[C@@H]2C)cc1NC(=O)NC(C)(C)C ZINC000494025588 905366199 /nfs/dbraw/zinc/36/61/99/905366199.db2.gz CRRBHSVBSRXSCQ-NQIIRXRSSA-N 0 3 422.573 4.308 20 0 HIADHN C[C@H](SCC(=O)N[C@@H]1CCN(Cc2ccccc2)[C@H]1C)c1nc2ccccc2[nH]1 ZINC000494036305 905376421 /nfs/dbraw/zinc/37/64/21/905376421.db2.gz DJZDQMDXPZYMIZ-JENIJYKNSA-N 0 3 408.571 4.136 20 0 HIADHN C[C@H](SCC(=O)N[C@H]1CCN(Cc2ccccc2)[C@H]1C)c1nc2ccccc2[nH]1 ZINC000494036306 905376837 /nfs/dbraw/zinc/37/68/37/905376837.db2.gz DJZDQMDXPZYMIZ-LNLFQRSKSA-N 0 3 408.571 4.136 20 0 HIADHN Cn1cc([C@@H](NC[C@H](CO)Cc2ccc(C(F)(F)F)cc2)c2cccc(F)c2)cn1 ZINC000494037533 905378872 /nfs/dbraw/zinc/37/88/72/905378872.db2.gz HEZKIMSTPNIROS-IERDGZPVSA-N 0 3 421.438 4.108 20 0 HIADHN NC(=O)C1CCC(N[C@@H](c2ccccc2)c2ccc(Br)cc2F)CC1 ZINC000494041561 905384679 /nfs/dbraw/zinc/38/46/79/905384679.db2.gz XKCACNWSUMVSPM-KJXMEXGPSA-N 0 3 405.311 4.311 20 0 HIADHN CN(CC(=O)Nc1ccc2nc(C(F)(F)F)[nH]c2c1)Cc1cccc2[nH]ccc21 ZINC000494057681 905395460 /nfs/dbraw/zinc/39/54/60/905395460.db2.gz DHHAGHQUNFNDGF-UHFFFAOYSA-N 0 3 401.392 4.134 20 0 HIADHN C[C@H]1[C@@H](NC(=O)Cc2csc(Cc3ccc(F)cc3)n2)CCN1Cc1ccccc1 ZINC000494076639 905413257 /nfs/dbraw/zinc/41/32/57/905413257.db2.gz CQYNVZYGRCXRLT-JTSKRJEESA-N 0 3 423.557 4.195 20 0 HIADHN c1[nH]c2ccccc2c1-c1nnc(SCCN2CCCCC2)n1C[C@@H]1CCCO1 ZINC000494103166 905436457 /nfs/dbraw/zinc/43/64/57/905436457.db2.gz JUYOWJVCPJGKNU-KRWDZBQOSA-N 0 3 411.575 4.183 20 0 HIADHN c1[nH]c2ccccc2c1-c1nnc(SCCN2CCCCC2)n1C[C@H]1CCCO1 ZINC000494103167 905438452 /nfs/dbraw/zinc/43/84/52/905438452.db2.gz JUYOWJVCPJGKNU-QGZVFWFLSA-N 0 3 411.575 4.183 20 0 HIADHN CC(C)c1ccc([C@H](NC(=O)N2CCN(C3CCOCC3)C[C@H]2C)C(C)C)cc1 ZINC000494212062 905542637 /nfs/dbraw/zinc/54/26/37/905542637.db2.gz KCXILBDUSLIGPG-AUSIDOKSSA-N 0 3 401.595 4.402 20 0 HIADHN COc1cc(CNCc2ccc(-c3ccccc3)c(C)c2)cc(Cl)c1OCC(N)=O ZINC000494231654 905558783 /nfs/dbraw/zinc/55/87/83/905558783.db2.gz ULHWBXAKBGAYSY-UHFFFAOYSA-N 0 3 424.928 4.478 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)C[C@@H](C)c2c[nH]c3ccccc32)CC1 ZINC000494279659 905602515 /nfs/dbraw/zinc/60/25/15/905602515.db2.gz MXDXEVKOYOEMDV-HXUWFJFHSA-N 0 3 418.585 4.115 20 0 HIADHN Cc1cccc2sc(N(Cc3ccccc3)C(=O)CN[C@@]3(C)CCO[C@@H]3C)nc21 ZINC000494281143 905604398 /nfs/dbraw/zinc/60/43/98/905604398.db2.gz BTZHTRKKPFLRDY-HXOBKFHXSA-N 0 3 409.555 4.295 20 0 HIADHN Cc1cccc2sc(N(Cc3ccccc3)C(=O)CN[C@@]3(C)CCO[C@H]3C)nc21 ZINC000494281144 905604616 /nfs/dbraw/zinc/60/46/16/905604616.db2.gz BTZHTRKKPFLRDY-SBUREZEXSA-N 0 3 409.555 4.295 20 0 HIADHN COc1cc(CN2CCC[C@H](CNC(=O)C(C)C)C2)ccc1OCc1cccs1 ZINC000512444488 921166187 /nfs/dbraw/zinc/16/61/87/921166187.db2.gz PNKHXMFOSIDWSR-LJQANCHMSA-N 0 3 416.587 4.320 20 0 HIADHN CCc1ccc([C@@H](NCCCc2ccccn2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000494421466 905707795 /nfs/dbraw/zinc/70/77/95/905707795.db2.gz KIZXGBRLHSOKHS-XMMPIXPASA-N 0 3 408.567 4.359 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)NC2CCC(C)(c3ccccc3)CC2)CC1 ZINC000494423927 905712740 /nfs/dbraw/zinc/71/27/40/905712740.db2.gz GMHOXMUQHDWFJO-UHFFFAOYSA-N 0 3 401.595 4.076 20 0 HIADHN Fc1cc([C@@H]2OCC[C@H]2NCc2ccc(OCC(F)(F)F)nc2)ccc1Cl ZINC000494505691 905797180 /nfs/dbraw/zinc/79/71/80/905797180.db2.gz KCACRZTZXIDBOD-WBVHZDCISA-N 0 3 404.791 4.435 20 0 HIADHN Cc1ccc([C@H](NC(=O)CN2CCCCC[C@H]2C[C@@H](C)O)c2cccs2)cc1 ZINC000512473731 921184079 /nfs/dbraw/zinc/18/40/79/921184079.db2.gz FPPAGAHJPQSFKB-RFWXGWTQSA-N 0 3 400.588 4.278 20 0 HIADHN COc1cc(C)c(NC(=O)NCCCN2CCN(C)C[C@H]2c2ccccc2)c(C)c1C ZINC000494716248 905918648 /nfs/dbraw/zinc/91/86/48/905918648.db2.gz VUKNNSKUWFKCDE-QFIPXVFZSA-N 0 3 424.589 4.121 20 0 HIADHN CCc1ccc([C@@H](NCC(C)(C)[C@H](O)C(C)C)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000494716312 905919135 /nfs/dbraw/zinc/91/91/35/905919135.db2.gz WIOPLKOWIAGYSV-DHIUTWEWSA-N 0 3 417.615 4.375 20 0 HIADHN Cc1ccc([C@H](NCCSCC(F)(F)F)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000494744287 905942432 /nfs/dbraw/zinc/94/24/32/905942432.db2.gz CVVOCSTUGKSEGS-SFHVURJKSA-N 0 3 417.518 4.373 20 0 HIADHN Cc1ccc([C@@H](NCCSCC(F)(F)F)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000494744285 905942459 /nfs/dbraw/zinc/94/24/59/905942459.db2.gz CVVOCSTUGKSEGS-GOSISDBHSA-N 0 3 417.518 4.373 20 0 HIADHN COCCn1cc2c(n1)[C@H](NC1CC(c3ccc(Br)cc3)C1)CCC2 ZINC000494759004 905956610 /nfs/dbraw/zinc/95/66/10/905956610.db2.gz DIGGBUHAEAEJHT-NKELODKYSA-N 0 3 404.352 4.205 20 0 HIADHN CN(C)CCN(Cc1cccc(O)c1)C(=O)c1cccc(NC(=O)C2CCCCC2)c1 ZINC000494783721 905984473 /nfs/dbraw/zinc/98/44/73/905984473.db2.gz HKHHMAJUVIMCMY-UHFFFAOYSA-N 0 3 423.557 4.115 20 0 HIADHN COc1ccc2c(c1)nc(CNC1CC(c3ccc(Br)cc3)C1)n2C ZINC000494790679 905992475 /nfs/dbraw/zinc/99/24/75/905992475.db2.gz AURITRCQHXKSKB-UHFFFAOYSA-N 0 3 400.320 4.380 20 0 HIADHN CC(C)Sc1ccc([C@@H](C)NC(=O)N2CCN(C3CCOCC3)C[C@@H]2C)cc1 ZINC000494922836 906095670 /nfs/dbraw/zinc/09/56/70/906095670.db2.gz XXLUMUDUSKMDBJ-ZWKOTPCHSA-N 0 3 405.608 4.143 20 0 HIADHN Cc1cc(CN[C@H](C)c2ccc(C(=O)N(C)C)cc2)ccc1I ZINC000494970193 906139578 /nfs/dbraw/zinc/13/95/78/906139578.db2.gz FSYSQWIBGGLKSI-CQSZACIVSA-N 0 3 422.310 4.152 20 0 HIADHN Brc1cccc(N2CC[C@@H](N[C@H](c3nc[nH]n3)C3CCCCC3)C2)c1 ZINC000495001352 906162725 /nfs/dbraw/zinc/16/27/25/906162725.db2.gz WYIDEYDTIODUCC-AEFFLSMTSA-N 0 3 404.356 4.057 20 0 HIADHN C[C@@H](N[C@H](c1cncc(Br)c1)C1CC1)c1ccc(C(=O)N(C)C)cc1 ZINC000495020922 906180959 /nfs/dbraw/zinc/18/09/59/906180959.db2.gz VLIDRBOATUIFJD-YJYMSZOUSA-N 0 3 402.336 4.348 20 0 HIADHN Cc1ccc(-c2c[nH]cc2C(=O)NCCCN2CCN(C)C[C@H]2c2ccccc2)s1 ZINC000495036803 906192984 /nfs/dbraw/zinc/19/29/84/906192984.db2.gz OIKZQPNJGFRYOU-QFIPXVFZSA-N 0 3 422.598 4.160 20 0 HIADHN O=C(Nc1ccc(Br)cn1)[C@@H]1CCCN(Cc2scnc2C2CC2)C1 ZINC000495142111 906268438 /nfs/dbraw/zinc/26/84/38/906268438.db2.gz RPDQXJPQCNJYHE-CYBMUJFWSA-N 0 3 421.364 4.029 20 0 HIADHN CC(C)(C)c1n[nH]cc1CN1CCC(C(=O)Nc2ccc(Br)cc2)CC1 ZINC000512547310 921228785 /nfs/dbraw/zinc/22/87/85/921228785.db2.gz LQYAISADVVFARA-UHFFFAOYSA-N 0 3 419.367 4.320 20 0 HIADHN C[C@@H]1CCCCN1CCNC(=O)c1ccc(COc2ccc(Br)cc2)o1 ZINC000495329001 906379947 /nfs/dbraw/zinc/37/99/47/906379947.db2.gz DKADHAOLKJDCPA-OAHLLOKOSA-N 0 3 421.335 4.225 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)Cc2c[nH]c3cccc(Cl)c23)cc1 ZINC000495344900 906390865 /nfs/dbraw/zinc/39/08/65/906390865.db2.gz FNJYSHBAUQJNPA-NRFANRHFSA-N 0 3 411.933 4.326 20 0 HIADHN Cc1coc(-c2cc(NC(=O)c3ccc(CN4CCC(CO)CC4)cc3)ccc2C)n1 ZINC000495361276 906403763 /nfs/dbraw/zinc/40/37/63/906403763.db2.gz ZPINMQWPEWVVAE-UHFFFAOYSA-N 0 3 419.525 4.415 20 0 HIADHN COc1ccc(NC(=O)C[C@H](C)N[C@H]2CCCOc3c(F)cccc32)c(OC)c1 ZINC000495425469 906442920 /nfs/dbraw/zinc/44/29/20/906442920.db2.gz BJAMGLRGDYWFCV-KSSFIOAISA-N 0 3 402.466 4.064 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)N[C@H](C)c2nc(-c3ccccc3)cs2)cc1 ZINC000495425453 906443550 /nfs/dbraw/zinc/44/35/50/906443550.db2.gz BEEOEECUYDURME-UZLBHIALSA-N 0 3 424.570 4.482 20 0 HIADHN COCC[C@@H](N[C@@H](C)CC(=O)Nc1ccc(Br)cc1)c1ccc(C)o1 ZINC000495434540 906449855 /nfs/dbraw/zinc/44/98/55/906449855.db2.gz SNDVHDIIIAUVBA-SUMWQHHRSA-N 0 3 409.324 4.435 20 0 HIADHN Cc1nn(C)c(=O)c(-c2nc(CN[C@H](Cc3ccc(F)cc3)C(C)C)cs2)c1C ZINC000495518193 906495041 /nfs/dbraw/zinc/49/50/41/906495041.db2.gz VROHIZVPOUVWEZ-LJQANCHMSA-N 0 3 414.550 4.017 20 0 HIADHN CCCN(C)[C@H](CNCc1csc(N(CC)C(C)=O)n1)c1ccc(Cl)cc1 ZINC000512566403 921241290 /nfs/dbraw/zinc/24/12/90/921241290.db2.gz WYGZXJSOTIBRCU-LJQANCHMSA-N 0 3 408.999 4.342 20 0 HIADHN CCCN(C)[C@H](CNCc1csc(N(C(C)=O)C2CC2)n1)c1ccc(Cl)cc1 ZINC000512570592 921243178 /nfs/dbraw/zinc/24/31/78/921243178.db2.gz WQKUYVGYMDHPPX-HXUWFJFHSA-N 0 3 421.010 4.485 20 0 HIADHN CC(C)c1noc2nc(C3CC3)cc(C(=O)N(CCN(C)C)Cc3ccccc3)c21 ZINC000495917113 906577208 /nfs/dbraw/zinc/57/72/08/906577208.db2.gz GBPWJWBYNXSXPT-UHFFFAOYSA-N 0 3 406.530 4.428 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)[C@H]1C[C@H]1c1cccc(Br)c1 ZINC000495999876 906595332 /nfs/dbraw/zinc/59/53/32/906595332.db2.gz MIGUFUQJQNKFNB-PMACEKPBSA-N 0 3 401.348 4.143 20 0 HIADHN CCc1nc([C@H](C)NC(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)cs1 ZINC000496165507 906618915 /nfs/dbraw/zinc/61/89/15/906618915.db2.gz HAFZICNFATULRD-KXBFYZLASA-N 0 3 404.580 4.156 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)c1cc(F)ccc1Br ZINC000496261977 906640194 /nfs/dbraw/zinc/64/01/94/906640194.db2.gz JRTMBCWJDILRAN-KRWDZBQOSA-N 0 3 420.326 4.110 20 0 HIADHN CCCN(CCN(C)C)C(=O)c1cc(-c2ccc(C)cc2)nc2c1cnn2C(C)C ZINC000496305693 906652699 /nfs/dbraw/zinc/65/26/99/906652699.db2.gz QWQAZMMVPTZGFG-UHFFFAOYSA-N 0 3 407.562 4.401 20 0 HIADHN CCCN(CCN(C)C)C(=O)c1sc(NC(=O)c2ccccc2Cl)cc1C ZINC000496354418 906664951 /nfs/dbraw/zinc/66/49/51/906664951.db2.gz DFPYVCAGBZTBDZ-UHFFFAOYSA-N 0 3 407.967 4.376 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)cc1CN1CCC(C(=O)Nc2ccc(O)cc2)CC1 ZINC000512605194 921258066 /nfs/dbraw/zinc/25/80/66/921258066.db2.gz XHBOZHQBLPRGFK-UHFFFAOYSA-N 0 3 424.932 4.390 20 0 HIADHN O=C(Nc1ccc(O)cc1)C1CCN(Cc2c[nH]nc2-c2ccc(Cl)cc2)CC1 ZINC000512609882 921259281 /nfs/dbraw/zinc/25/92/81/921259281.db2.gz RXJLPGIXFZJFFY-UHFFFAOYSA-N 0 3 410.905 4.286 20 0 HIADHN Cc1cn(-c2ccc(F)cc2)nc1C(=O)NC[C@@H](c1ccc(C)cc1)N1CCCC1 ZINC000512651165 921274700 /nfs/dbraw/zinc/27/47/00/921274700.db2.gz PNMDAZIDOGKDNH-QFIPXVFZSA-N 0 3 406.505 4.195 20 0 HIADHN Cc1cc(NC(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)c(F)cc1Br ZINC000497446601 906920462 /nfs/dbraw/zinc/92/04/62/906920462.db2.gz YUMMJZFFOXASIX-WMZOPIPTSA-N 0 3 406.299 4.464 20 0 HIADHN COc1cc(CN2CCC[C@H](CCC(N)=O)C2)ccc1OCc1ccc(Cl)cc1 ZINC000512685226 921286566 /nfs/dbraw/zinc/28/65/66/921286566.db2.gz ASKFXDGPQXAJFV-QGZVFWFLSA-N 0 3 416.949 4.405 20 0 HIADHN C[C@@H](NC(=O)N[C@H](CN1CCc2ccccc2C1)C(C)(C)C)c1c(F)cncc1F ZINC000497607346 907087867 /nfs/dbraw/zinc/08/78/67/907087867.db2.gz ACXSYMPGDNRBQH-FOIQADDNSA-N 0 3 416.516 4.193 20 0 HIADHN CC(C)(C)[C@@H](CN1CCc2ccccc2C1)NC(=O)N1CCCC[C@@H]1c1cc[nH]n1 ZINC000497610026 907089552 /nfs/dbraw/zinc/08/95/52/907089552.db2.gz LXVVVENPXHQTPQ-FGZHOGPDSA-N 0 3 409.578 4.119 20 0 HIADHN C[C@H]1[C@H](NC(=O)NCc2csc(-c3ccccc3)n2)CCN1Cc1ccccc1 ZINC000497615982 907093154 /nfs/dbraw/zinc/09/31/54/907093154.db2.gz AZWDOAMBAPWSBR-LAUBAEHRSA-N 0 3 406.555 4.272 20 0 HIADHN CS[C@@H]1CN(C(=O)Nc2cc(C)ccc2SCC(F)(F)F)C[C@H]1N(C)C ZINC000497671542 907173123 /nfs/dbraw/zinc/17/31/23/907173123.db2.gz YSDSTTRJTYUHLC-UKRRQHHQSA-N 0 3 407.527 4.159 20 0 HIADHN COC1CCN(C(C)(C)CNC(=O)[C@H](C)Oc2ccc(Cl)c3ccccc23)CC1 ZINC000497693212 907199978 /nfs/dbraw/zinc/19/99/78/907199978.db2.gz YNDKFVNVIBDMCL-INIZCTEOSA-N 0 3 418.965 4.266 20 0 HIADHN Cc1noc(CSc2ccc(C(=O)NC[C@H](c3ccccc3)N3CCCC3)cc2)n1 ZINC000497696941 907201573 /nfs/dbraw/zinc/20/15/73/907201573.db2.gz RCBULAFRDXAGHN-OAQYLSRUSA-N 0 3 422.554 4.237 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)NC[C@@H]2CCCO[C@H]2C(C)(C)C)N(C)C)cc1 ZINC000497823285 907304872 /nfs/dbraw/zinc/30/48/72/907304872.db2.gz PUKXUUJSRNDGHS-ILWGZMRPSA-N 0 3 419.610 4.217 20 0 HIADHN C[C@H]1CCC[C@H](C)N1C(=O)COc1ccc(C(=O)Nc2cccc(CN(C)C)c2)cc1 ZINC000497936217 907399616 /nfs/dbraw/zinc/39/96/16/907399616.db2.gz RPFSJAMKCSJKBI-OALUTQOASA-N 0 3 423.557 4.169 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCCc1nc2c(s1)CCCC2)c1ccsc1 ZINC000497936499 907402507 /nfs/dbraw/zinc/40/25/07/907402507.db2.gz FNZLWQQPSMPEMS-KRWDZBQOSA-N 0 3 406.621 4.008 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)NCCc1csc(C(C)(C)C)n1 ZINC000497954056 907423384 /nfs/dbraw/zinc/42/33/84/907423384.db2.gz YCKBAPSUIKKSNP-GOSISDBHSA-N 0 3 414.619 4.289 20 0 HIADHN Cc1cccc2nc(CNC(=O)NC[C@@H](c3cccc(Cl)c3)N3CCCC3)[nH]c21 ZINC000497963831 907432358 /nfs/dbraw/zinc/43/23/58/907432358.db2.gz FEEQRQSXVAOQAQ-IBGZPJMESA-N 0 3 411.937 4.161 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)N2C[C@H](C)C[C@@H]2c2cccnc2)N(C)C)cc1 ZINC000512822413 921326661 /nfs/dbraw/zinc/32/66/61/921326661.db2.gz VLQWQMPLGNHEFU-SXSPYAJSSA-N 0 3 410.562 4.264 20 0 HIADHN CCN(C(=O)CSCc1c(C)noc1C)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000498004706 907490435 /nfs/dbraw/zinc/49/04/35/907490435.db2.gz PMVIDYAUHCWNTC-FXAWDEMLSA-N 0 3 401.576 4.209 20 0 HIADHN CC(C)(c1ccccc1)c1ccc(OC[C@@H](O)CN2CC[C@H](COC(F)F)C2)cc1 ZINC000512824985 921329372 /nfs/dbraw/zinc/32/93/72/921329372.db2.gz ZVGFAIYYJAAIOQ-RXVVDRJESA-N 0 3 419.512 4.313 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)N(CC(C)C)[C@@H](C)c2ccccc2Cl)CC1 ZINC000498031271 907533417 /nfs/dbraw/zinc/53/34/17/907533417.db2.gz USLIZENPMHDLGD-UXHICEINSA-N 0 3 423.045 4.342 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)N(CC(C)C)[C@H](C)c2ccccc2Cl)CC1 ZINC000498031272 907533907 /nfs/dbraw/zinc/53/39/07/907533907.db2.gz USLIZENPMHDLGD-VQTJNVASSA-N 0 3 423.045 4.342 20 0 HIADHN Cc1csc([C@H](NC(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)C2CC2)n1 ZINC000498046739 907557872 /nfs/dbraw/zinc/55/78/72/907557872.db2.gz MFSDPHLMEWMFMW-WOJBJXKFSA-N 0 3 416.591 4.292 20 0 HIADHN O=C(NCc1ccccc1N1CCCCC1)NC[C@@H](c1cccs1)N1CCCC1 ZINC000498110241 907620292 /nfs/dbraw/zinc/62/02/92/907620292.db2.gz AVMSBCYOYVMNGD-NRFANRHFSA-N 0 3 412.603 4.375 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)NC[C@@H](c3c[nH]c4ccccc43)c3ccccc3)[C@H]2C1 ZINC000498112523 907623803 /nfs/dbraw/zinc/62/38/03/907623803.db2.gz ARUKLOFYIWFXAV-ZYKOEDHHSA-N 0 3 402.542 4.035 20 0 HIADHN CCOc1ccccc1CN(C)C(=O)NC[C@@H](c1ccc(OC(C)C)cc1)N(C)C ZINC000512839525 921342085 /nfs/dbraw/zinc/34/20/85/921342085.db2.gz SBKCVNBYVRWSGC-QFIPXVFZSA-N 0 3 413.562 4.317 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)N[C@H](c1cccc(F)c1)c1ccccn1 ZINC000498237005 907769733 /nfs/dbraw/zinc/76/97/33/907769733.db2.gz BUKUKINPLGVKFM-BJKOFHAPSA-N 0 3 418.516 4.446 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)N[C@@H](c1cccc(F)c1)c1ccccn1 ZINC000498237009 907770166 /nfs/dbraw/zinc/77/01/66/907770166.db2.gz BUKUKINPLGVKFM-RPWUZVMVSA-N 0 3 418.516 4.446 20 0 HIADHN COc1ccc(C(=O)CCCC(=O)NC2CCN([C@H](C)c3ccccc3)CC2)cc1 ZINC000498345703 907850629 /nfs/dbraw/zinc/85/06/29/907850629.db2.gz NVOYWKYWLRIKFB-LJQANCHMSA-N 0 3 408.542 4.390 20 0 HIADHN CCOc1ccc([C@H](C)NC(=O)CCCNCc2nc3c(s2)C[C@H](C)CC3)cc1 ZINC000498349556 907852344 /nfs/dbraw/zinc/85/23/44/907852344.db2.gz FIECEEQLGOEKQE-SJORKVTESA-N 0 3 415.603 4.414 20 0 HIADHN CCC(CC)[C@H]1C[C@H](NC(=O)N(Cc2ccccc2)C2CCN(C)CC2)CCO1 ZINC000498396943 907879412 /nfs/dbraw/zinc/87/94/12/907879412.db2.gz OLHDQTQWRUMRBB-FYYLOGMGSA-N 0 3 401.595 4.276 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)c2cc3ccc(Br)cc3[nH]2)CC1 ZINC000498464032 907929461 /nfs/dbraw/zinc/92/94/61/907929461.db2.gz NSSHFJJCWQVTCM-UHFFFAOYSA-N 0 3 416.319 4.260 20 0 HIADHN C[C@H](NCc1ccc(-c2ccc(C(F)(F)F)cc2)s1)C1(S(C)(=O)=O)CC1 ZINC000512874896 921372808 /nfs/dbraw/zinc/37/28/08/921372808.db2.gz VVJQJWZVYLFFIT-LBPRGKRZSA-N 0 3 403.491 4.489 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)N[C@@H](C)c2ccc(-c3cccnc3)cc2)cc1 ZINC000498608225 908057671 /nfs/dbraw/zinc/05/76/71/908057671.db2.gz UHCHXPDICADXMZ-UUOWRZLLSA-N 0 3 418.541 4.420 20 0 HIADHN C[C@@H]1CC[C@@H](C)N1CC(=O)NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1 ZINC000498622621 908068710 /nfs/dbraw/zinc/06/87/10/908068710.db2.gz ZNHGNGGROBIRPB-QZTJIDSGSA-N 0 3 406.505 4.167 20 0 HIADHN Cc1ccc(-c2nc(C)c(C(=O)N(CCN(C)C)Cc3ccccc3F)s2)o1 ZINC000498712208 908138871 /nfs/dbraw/zinc/13/88/71/908138871.db2.gz JKODYEXOFVYJIW-UHFFFAOYSA-N 0 3 401.507 4.363 20 0 HIADHN C[C@@H]1[C@H](NC(=O)NCc2ccc(-c3cccnc3)cc2)CCN1Cc1ccccc1 ZINC000498719307 908145856 /nfs/dbraw/zinc/14/58/56/908145856.db2.gz QEJYWSZWGFIAJP-NTKDMRAZSA-N 0 3 400.526 4.211 20 0 HIADHN Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000498851288 908256831 /nfs/dbraw/zinc/25/68/31/908256831.db2.gz DLLFJUVAOWJRSM-JOCHJYFZSA-N 0 3 420.557 4.017 20 0 HIADHN CCCO[C@@H]1CCCN(C(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)CC1 ZINC000512903377 921396051 /nfs/dbraw/zinc/39/60/51/921396051.db2.gz YUDPHJJKJHZPKS-IRLDBZIGSA-N 0 3 405.583 4.067 20 0 HIADHN Cc1csc(C(C)(C)NC(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)n1 ZINC000512906440 921399818 /nfs/dbraw/zinc/39/98/18/921399818.db2.gz FNZMGHHLERWLOT-GOSISDBHSA-N 0 3 404.580 4.076 20 0 HIADHN CCN1C[C@H](C)N(Cc2csc(N(C(C)=O)c3cccc(C)c3C)n2)C[C@@H]1C ZINC000498914791 908323832 /nfs/dbraw/zinc/32/38/32/908323832.db2.gz KBBFSUAQKXDSMU-IRXDYDNUSA-N 0 3 400.592 4.359 20 0 HIADHN CCN(Cc1ccc(OCc2ccccc2)cc1)C(=O)CN1C[C@H](C)N(CC)C[C@H]1C ZINC000498927048 908336188 /nfs/dbraw/zinc/33/61/88/908336188.db2.gz TYZBKZLXYVTIIJ-FCHUYYIVSA-N 0 3 423.601 4.029 20 0 HIADHN CC[C@@H](C)Sc1ccc(NC(=O)C(=O)NCC(C)(C)N2CCCCC2)c(C)c1 ZINC000498962024 908357937 /nfs/dbraw/zinc/35/79/37/908357937.db2.gz JPJFDNXEMNUFCK-QGZVFWFLSA-N 0 3 405.608 4.205 20 0 HIADHN CC(C)(NC(=O)NCc1ccccc1CN1CCC(O)CC1)c1ccc(Cl)cc1 ZINC000499091493 908453649 /nfs/dbraw/zinc/45/36/49/908453649.db2.gz BIYBBJMVSAADEF-UHFFFAOYSA-N 0 3 415.965 4.031 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cccc([C@@H]4CCCOC4)c3)c(C)c2)CC1 ZINC000499128268 908485439 /nfs/dbraw/zinc/48/54/39/908485439.db2.gz QCKDEPZYISGGMJ-JOCHJYFZSA-N 0 3 407.558 4.283 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N2CCC[C@@H]2[C@@H]2C[C@H](C)CC[C@H]2O)N2CCCC2)cc1 ZINC000499140489 908497414 /nfs/dbraw/zinc/49/74/14/908497414.db2.gz HKDSSGICGSQABI-MENZVKOBSA-N 0 3 413.606 4.103 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N2CCC[C@@H]2[C@@H]2C[C@H](C)CC[C@@H]2O)N2CCCC2)cc1 ZINC000499140492 908497463 /nfs/dbraw/zinc/49/74/63/908497463.db2.gz HKDSSGICGSQABI-NZURDFQBSA-N 0 3 413.606 4.103 20 0 HIADHN Cc1nc(COc2cccc(C(=O)NC[C@@H](c3ccc(C)cc3)N(C)C)c2)cs1 ZINC000499145841 908503866 /nfs/dbraw/zinc/50/38/66/908503866.db2.gz YRMVGOPWJMEABA-QFIPXVFZSA-N 0 3 409.555 4.372 20 0 HIADHN Cc1ccc([C@H](CNC(=O)C(C)(C)c2ccc(Br)cc2)N(C)C)cc1 ZINC000499162041 908516608 /nfs/dbraw/zinc/51/66/08/908516608.db2.gz RYBAYXTVSSIZRU-IBGZPJMESA-N 0 3 403.364 4.454 20 0 HIADHN Cc1ccc([C@H](CNC(=O)[C@H]2C[C@@H]2c2cccc(Br)c2)N(C)C)cc1 ZINC000499162377 908516642 /nfs/dbraw/zinc/51/66/42/908516642.db2.gz UVTRTRACAHJHCE-AABGKKOBSA-N 0 3 401.348 4.280 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)C(C)(C)c2ccc(Br)cc2)N(C)C)cc1 ZINC000499162042 908516789 /nfs/dbraw/zinc/51/67/89/908516789.db2.gz RYBAYXTVSSIZRU-LJQANCHMSA-N 0 3 403.364 4.454 20 0 HIADHN CC1CCC(N2CCN(C(=O)N[C@@H](c3cccc(F)c3)c3ccccn3)CC2)CC1 ZINC000499305504 908678526 /nfs/dbraw/zinc/67/85/26/908678526.db2.gz HDONBTOYRYXGJV-HCPAQRILSA-N 0 3 410.537 4.216 20 0 HIADHN CC(C)(C)[C@@H](CN1CCc2ccccc2C1)NC(=O)c1ncsc1Br ZINC000512943536 921430621 /nfs/dbraw/zinc/43/06/21/921430621.db2.gz QDDZGYRWYFCFIV-OAHLLOKOSA-N 0 3 422.392 4.108 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)NC(=O)N[C@@H]2CCN(Cc3ccccc3)[C@@H]2C)cc1 ZINC000499318175 908691033 /nfs/dbraw/zinc/69/10/33/908691033.db2.gz TUJKGVWNEUBKCV-XLNZFTOWSA-N 0 3 417.557 4.204 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)[C@H]1C[C@@H]1c1cccc(Br)c1 ZINC000499365037 908731382 /nfs/dbraw/zinc/73/13/82/908731382.db2.gz SAWKVKLBRCOZQN-UXHICEINSA-N 0 3 419.338 4.282 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)CCc1ccc(OC(F)F)cc1 ZINC000499367366 908735883 /nfs/dbraw/zinc/73/58/83/908735883.db2.gz YCXCNBZABCTOOW-UHFFFAOYSA-N 0 3 412.427 4.089 20 0 HIADHN Cc1cn(-c2ccccc2Cl)nc1C(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000499369276 908737271 /nfs/dbraw/zinc/73/72/71/908737271.db2.gz OPTTUQHWPQLFHS-IEBWSBKVSA-N 0 3 408.933 4.399 20 0 HIADHN COc1cccc([C@@H](C)C(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)c1 ZINC000499382378 908746409 /nfs/dbraw/zinc/74/64/09/908746409.db2.gz HOHNJCJPRAFZAL-MRXNPFEDSA-N 0 3 408.464 4.408 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2cc(C)nc3c2cnn3C(C)C)N2CCCC2)cc1 ZINC000499426114 908789813 /nfs/dbraw/zinc/78/98/13/908789813.db2.gz XLTOIUOYMJGRQU-QFIPXVFZSA-N 0 3 405.546 4.196 20 0 HIADHN CSc1cc(C(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)ccc1F ZINC000499446430 908803136 /nfs/dbraw/zinc/80/31/36/908803136.db2.gz ZWZKQTGHLAZCIE-SFHVURJKSA-N 0 3 410.518 4.443 20 0 HIADHN Cc1noc2nc(C3CC3)cc(C(=O)N(C)C3CCN(Cc4ccccc4)CC3)c12 ZINC000499480217 908812414 /nfs/dbraw/zinc/81/24/14/908812414.db2.gz GYFOPDHBPHMCOQ-UHFFFAOYSA-N 0 3 404.514 4.145 20 0 HIADHN Cc1noc2nc(C(C)C)cc(C(=O)N(C)C3CCN(Cc4ccccc4)CC3)c12 ZINC000499543184 908834765 /nfs/dbraw/zinc/83/47/65/908834765.db2.gz WNUOXNNQOPLZNZ-UHFFFAOYSA-N 0 3 406.530 4.391 20 0 HIADHN O=C(CCc1cc(Br)cs1)NC[C@@H](c1cccs1)N1CCCC1 ZINC000499655251 908866020 /nfs/dbraw/zinc/86/60/20/908866020.db2.gz OYAKYWQEEKPTNO-HNNXBMFYSA-N 0 3 413.406 4.458 20 0 HIADHN CS(=O)(=O)Nc1cccc(CNCc2cccc(OCc3ccc(F)cc3)c2)c1 ZINC000499664831 908869755 /nfs/dbraw/zinc/86/97/55/908869755.db2.gz RSNHJZRQZAQGQV-UHFFFAOYSA-N 0 3 414.502 4.066 20 0 HIADHN CC[C@H]1CCCCN1CCNC(=O)c1sc(COc2ccc(F)cc2)nc1C ZINC000499665998 908870589 /nfs/dbraw/zinc/87/05/89/908870589.db2.gz BGNVRDMYMFHEGU-KRWDZBQOSA-N 0 3 405.539 4.164 20 0 HIADHN Cc1nn(-c2ccccc2)c(Oc2cccc(F)c2)c1CNC[C@@]1(O)CCSC1 ZINC000499676460 908873828 /nfs/dbraw/zinc/87/38/28/908873828.db2.gz DWKVPGHSLBMJJD-QFIPXVFZSA-N 0 3 413.518 4.070 20 0 HIADHN CC(C)Sc1cc(Br)ccc1CNCC1(S(C)(=O)=O)CCCC1 ZINC000512972653 921447685 /nfs/dbraw/zinc/44/76/85/921447685.db2.gz VHTIGMOKPKVPND-UHFFFAOYSA-N 0 3 420.438 4.397 20 0 HIADHN Cc1nn(-c2ccccc2)c(Oc2cccc(F)c2)c1CNCC[C@H](C)[S@](C)=O ZINC000499698145 908880483 /nfs/dbraw/zinc/88/04/83/908880483.db2.gz ABBQITNSVUKBDW-OFJJUDJNSA-N 0 3 415.534 4.359 20 0 HIADHN C[C@@H]1CCCCN1CCNC(=O)c1oc2ccccc2c1CSc1ncccn1 ZINC000499710604 908884632 /nfs/dbraw/zinc/88/46/32/908884632.db2.gz JMMIXKGLYPWBSP-MRXNPFEDSA-N 0 3 410.543 4.119 20 0 HIADHN O=C(NCc1ccnc(OC2CCCC2)c1)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000499742873 908896611 /nfs/dbraw/zinc/89/66/11/908896611.db2.gz NSQJMIAOXIKRPZ-QFIPXVFZSA-N 0 3 408.546 4.039 20 0 HIADHN CCCCOc1ccc(CCNC(=O)N(Cc2ccco2)C2CCN(C)CC2)cc1 ZINC000499742984 908896652 /nfs/dbraw/zinc/89/66/52/908896652.db2.gz OGCDOAVZTDYFGA-UHFFFAOYSA-N 0 3 413.562 4.307 20 0 HIADHN O=C(c1cc(Cl)c[nH]1)N1CCC(NCc2nc(-c3ccccc3)cs2)CC1 ZINC000512993671 921460517 /nfs/dbraw/zinc/46/05/17/921460517.db2.gz UELMTQCUJHQQOQ-UHFFFAOYSA-N 0 3 400.935 4.186 20 0 HIADHN CCOc1cc2c(cc1[C@@H]1C[C@@H]1C(=O)N(CCN(C)C)Cc1ccccc1)O[C@@H](C)C2 ZINC000499936974 909044358 /nfs/dbraw/zinc/04/43/58/909044358.db2.gz QZTWPDNPUCYOJV-HARLFGEKSA-N 0 3 422.569 4.103 20 0 HIADHN Cc1cc(Br)cc(C)c1N1CCC[C@@H](NC/C=C/c2ccncc2)C1=O ZINC000513034781 921493275 /nfs/dbraw/zinc/49/32/75/921493275.db2.gz CXZJHTPLLPZLJP-MEDHRJKHSA-N 0 3 414.347 4.259 20 0 HIADHN CCOc1cc2c(cc1[C@@H]1C[C@@H]1C(=O)NC[C@H](c1ccc(C)cc1)N(C)C)O[C@@H](C)C2 ZINC000499976322 909421321 /nfs/dbraw/zinc/42/13/21/909421321.db2.gz JRCDBOXMSHNAAK-RBQRNVLBSA-N 0 3 422.569 4.240 20 0 HIADHN CCN(C(=O)c1cc(C)n(-c2ccccc2)n1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000499998903 909449459 /nfs/dbraw/zinc/44/94/59/909449459.db2.gz HIHOXHSZUUYQGO-REWPJTCUSA-N 0 3 402.542 4.478 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CN(C)C1CCN(C(=O)c2ccccc2)CC1 ZINC000513038442 921496615 /nfs/dbraw/zinc/49/66/15/921496615.db2.gz YEPZWCJFCBDCDB-UHFFFAOYSA-N 0 3 402.542 4.226 20 0 HIADHN CCc1nnc(NC(=O)[C@H](C)[C@H](C)NCc2ccccc2OC2CCCC2)s1 ZINC000513039992 921498487 /nfs/dbraw/zinc/49/84/87/921498487.db2.gz FFWVUZPBSPQXFJ-CABCVRRESA-N 0 3 402.564 4.175 20 0 HIADHN CC(C)c1cccc(O[C@@H](C)C(=O)N(C)C2CCN(CCc3ccccn3)CC2)c1 ZINC000500024091 909480491 /nfs/dbraw/zinc/48/04/91/909480491.db2.gz IBFQYKOJELPCFV-FQEVSTJZSA-N 0 3 409.574 4.138 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)N[C@H]2CC(C)(C)Oc3cc(F)ccc32)cc1 ZINC000500131556 909613109 /nfs/dbraw/zinc/61/31/09/909613109.db2.gz NBHMEARIFBVHEG-PMACEKPBSA-N 0 3 415.509 4.039 20 0 HIADHN CCOc1cc(C[NH2+]CCc2nc3ccccc3s2)cc(Br)c1[O-] ZINC000500140662 909619598 /nfs/dbraw/zinc/61/95/98/909619598.db2.gz SJTXXFLDRNGSHG-UHFFFAOYSA-N 0 3 407.333 4.495 20 0 HIADHN COc1cccc(C2(F)CCN(C[C@@H](O)COCc3ccc(Cl)cc3)CC2)c1 ZINC000500151322 909626768 /nfs/dbraw/zinc/62/67/68/909626768.db2.gz FHLXTTJMMIKYDZ-HXUWFJFHSA-N 0 3 407.913 4.187 20 0 HIADHN COc1ccccc1[C@H](NC(=O)N[C@H]1CCN(Cc2ccccc2)[C@H]1C)c1ccco1 ZINC000500153857 909633417 /nfs/dbraw/zinc/63/34/17/909633417.db2.gz ZHCFCPHBRKOPND-XZOYJPPVSA-N 0 3 419.525 4.340 20 0 HIADHN COc1ccccc1[C@@H](NC(=O)N[C@@H](CN(C)C)c1ccc(F)cc1)c1ccco1 ZINC000500164132 909646865 /nfs/dbraw/zinc/64/68/65/909646865.db2.gz PQXXDQUHZWLQFN-SIKLNZKXSA-N 0 3 411.477 4.119 20 0 HIADHN CCc1nnc(NC(=O)[C@H](C)[C@H](C)NCc2cc(C(F)(F)F)ccc2F)s1 ZINC000513059894 921515540 /nfs/dbraw/zinc/51/55/40/921515540.db2.gz XMVPIKMRALFAPN-ZJUUUORDSA-N 0 3 404.433 4.011 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)[C@@H]3C[C@@H]3c3ccc([C@H]4C[C@H]4C)o3)cc2)CC1 ZINC000500203638 909694411 /nfs/dbraw/zinc/69/44/11/909694411.db2.gz JBQDFDRTQWNMDX-KDXIVRHGSA-N 0 3 407.558 4.283 20 0 HIADHN O=C(NC[C@H]1CCCN(Cc2ccccc2OCc2ccncc2)C1)c1ccccc1 ZINC000513060315 921517400 /nfs/dbraw/zinc/51/74/00/921517400.db2.gz ZNPNUFPIJMSHPN-JOCHJYFZSA-N 0 3 415.537 4.303 20 0 HIADHN CCN(C(=O)C(=O)Nc1cccc(F)c1Cl)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000500225485 909717224 /nfs/dbraw/zinc/71/72/24/909717224.db2.gz CNQCNADWMNHWNC-DOTOQJQBSA-N 0 3 417.912 4.102 20 0 HIADHN CCc1nnc(NC(=O)[C@@H](C)[C@H](C)NCc2cc(Cl)c(OC)cc2Cl)s1 ZINC000513066047 921521245 /nfs/dbraw/zinc/52/12/45/921521245.db2.gz ZJJITHUILNPHLI-UWVGGRQHSA-N 0 3 417.362 4.169 20 0 HIADHN CCc1cc(=O)[n-]c(-c2cccc(NC(=O)c3ccc(C[NH+]4CCCC4)cc3)c2)n1 ZINC000500351215 909807138 /nfs/dbraw/zinc/80/71/38/909807138.db2.gz VBBHYEIAQWOIAY-UHFFFAOYSA-N 0 3 402.498 4.260 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)c2cc(C)n(C3CCCCC3)n2)cc1 ZINC000500417096 909845656 /nfs/dbraw/zinc/84/56/56/909845656.db2.gz ZVODBSZQEMFHRC-QHCPKHFHSA-N 0 3 410.562 4.272 20 0 HIADHN COc1ccc(SCCC(=O)N[C@@H](CN2CCCC2)c2ccc(OC)cc2)cc1 ZINC000500421827 909847090 /nfs/dbraw/zinc/84/70/90/909847090.db2.gz OWYSPJAITRMWKY-QFIPXVFZSA-N 0 3 414.571 4.139 20 0 HIADHN CC(=O)Nc1ccc(CNCc2ccc(I)c(Cl)c2)cc1 ZINC000500439408 909859242 /nfs/dbraw/zinc/85/92/42/909859242.db2.gz JNMAZRVIXJDXDL-UHFFFAOYSA-N 0 3 414.674 4.193 20 0 HIADHN CCc1nnc(NC(=O)[C@@H](C)[C@H](C)NCc2ccc(-c3ccc(F)cc3)o2)s1 ZINC000513075074 921529081 /nfs/dbraw/zinc/52/90/81/921529081.db2.gz JWXRJHSVJUIOPT-STQMWFEESA-N 0 3 402.495 4.253 20 0 HIADHN CC(C)N1CCc2nc(CN[C@]3(Cc4ccc(Cl)cc4)CCOC3)sc2C1 ZINC000500463171 909872947 /nfs/dbraw/zinc/87/29/47/909872947.db2.gz OSDKYUFBHLSVRD-NRFANRHFSA-N 0 3 405.995 4.054 20 0 HIADHN CCCOc1cccc(CNCc2ccc(S(=O)(=O)N3CCC[C@@H](C)C3)cc2)c1 ZINC000513076812 921530513 /nfs/dbraw/zinc/53/05/13/921530513.db2.gz RWVIGQUNHMTYSJ-LJQANCHMSA-N 0 3 416.587 4.186 20 0 HIADHN CC[C@H]1C[C@]1(NCc1ccc(OCC(=O)N2CCCC2)c(OC)c1)c1cccc(C)c1 ZINC000500496045 909890312 /nfs/dbraw/zinc/89/03/12/909890312.db2.gz JVHVXIBUUOZDTK-HFZDXXHNSA-N 0 3 422.569 4.420 20 0 HIADHN CCOc1cc(CN2CCC(C)(OC)CC2)ccc1OCC(=O)N(C(C)C)C(C)C ZINC000500748888 910059238 /nfs/dbraw/zinc/05/92/38/910059238.db2.gz JRRIXKACENCBQP-UHFFFAOYSA-N 0 3 420.594 4.110 20 0 HIADHN COc1ccc(-c2cc(C(=O)N(CCN(C)C)Cc3ccccn3)sc2C)cc1 ZINC000500765371 910067895 /nfs/dbraw/zinc/06/78/95/910067895.db2.gz CKSSHSUZWJYIPK-UHFFFAOYSA-N 0 3 409.555 4.331 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)CCc2ccccc2Br)C1 ZINC000500862571 910136240 /nfs/dbraw/zinc/13/62/40/910136240.db2.gz ZLKPMWZXSBFYEW-LPHOPBHVSA-N 0 3 401.348 4.333 20 0 HIADHN CCN1CCN(CCNc2ncnc3cc(-c4ccc(Cl)cc4)sc32)CC1 ZINC000513117344 921563651 /nfs/dbraw/zinc/56/36/51/921563651.db2.gz CEKJMYSXRFUIQU-UHFFFAOYSA-N 0 3 401.967 4.061 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCCCn1c(C)nc2ccccc21)c1ccsc1 ZINC000501134523 910314803 /nfs/dbraw/zinc/31/48/03/910314803.db2.gz ZXDJYLDXWLCBBM-OAQYLSRUSA-N 0 3 413.591 4.179 20 0 HIADHN Cc1cc(N(C)C)cc(C)c1NC(=O)NCC1(N2CCOC(C)(C)C2)CCCCC1 ZINC000501196177 910358817 /nfs/dbraw/zinc/35/88/17/910358817.db2.gz GKAOQUXPQPSFEW-UHFFFAOYSA-N 0 3 416.610 4.305 20 0 HIADHN C[C@@H](CC(=O)c1ccccc1F)C(=O)N[C@@H]1CCN(Cc2ccccc2)CC1(C)C ZINC000513126314 921570253 /nfs/dbraw/zinc/57/02/53/921570253.db2.gz RCRJIETZLFDGBX-FDDCHVKYSA-N 0 3 410.533 4.452 20 0 HIADHN Cc1noc(CSc2ccccc2C(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)n1 ZINC000501228596 910387278 /nfs/dbraw/zinc/38/72/78/910387278.db2.gz OFINCRQTOWQKCR-QFBILLFUSA-N 0 3 422.554 4.236 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)c2cnn(Cc3ccccc3Cl)c2)C1 ZINC000501258914 910420182 /nfs/dbraw/zinc/42/01/82/910420182.db2.gz RFQMGJPFIMJXEI-UTKZUKDTSA-N 0 3 408.933 4.150 20 0 HIADHN CN(Cc1ccccc1N1CCCC1)C(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000513135989 921576376 /nfs/dbraw/zinc/57/63/76/921576376.db2.gz QUIDZRZKRBWKQP-JOCHJYFZSA-N 0 3 409.549 4.297 20 0 HIADHN CC[C@@H](CNC(=O)Nc1cccc(C(=O)N(CC)CC)c1)N1CCc2ccccc2C1 ZINC000501353507 910488869 /nfs/dbraw/zinc/48/88/69/910488869.db2.gz QWEXXTWFDPVSEH-QHCPKHFHSA-N 0 3 422.573 4.127 20 0 HIADHN CC[C@H](CNC(=O)N1CC=C(c2ccc(O)cc2)CC1)N1CCc2ccccc2C1 ZINC000501359167 910491322 /nfs/dbraw/zinc/49/13/22/910491322.db2.gz LVVZYEVBCRRZQH-HSZRJFAPSA-N 0 3 405.542 4.028 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)c2cc3c(cccc3Br)[nH]2)o1 ZINC000501374515 910502775 /nfs/dbraw/zinc/50/27/75/910502775.db2.gz ZWCLBZDLJMQUGY-UHFFFAOYSA-N 0 3 404.308 4.036 20 0 HIADHN CCC(CC)[C@@H]1C[C@H](NC(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)CCO1 ZINC000501403792 910536417 /nfs/dbraw/zinc/53/64/17/910536417.db2.gz DOTAGTJPSDTZAS-PUHATCMVSA-N 0 3 419.610 4.360 20 0 HIADHN O=C(Cc1cccc(C(F)(F)F)c1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000501433886 910562916 /nfs/dbraw/zinc/56/29/16/910562916.db2.gz JHBKBQLIXDWBNM-UHFFFAOYSA-N 0 3 408.489 4.478 20 0 HIADHN COC(=O)CCC[C@@H]1CCC[C@H](N[C@H](C)c2nc(-c3ccccc3OC)no2)C1 ZINC000513157661 921590491 /nfs/dbraw/zinc/59/04/91/921590491.db2.gz CPZIPLHTNWCHBB-IKGGRYGDSA-N 0 3 401.507 4.298 20 0 HIADHN CNS(=O)(=O)c1cccc([C@H](C)NC/C(C)=C/c2ccccc2C(F)(F)F)c1 ZINC000501456342 910581491 /nfs/dbraw/zinc/58/14/91/910581491.db2.gz UGJQCCWMCGRURU-GOFCXVBSSA-N 0 3 412.477 4.368 20 0 HIADHN CC1CCN([C@@H](CNC(=O)NC[C@H](c2ccsc2)N(C)C)c2cccs2)CC1 ZINC000501520893 910629998 /nfs/dbraw/zinc/62/99/98/910629998.db2.gz XPSNYYUGRQNFKW-MOPGFXCFSA-N 0 3 420.648 4.185 20 0 HIADHN COC(=O)CCC[C@@H]1CCC[C@@H](N[C@H](C)c2nc(-c3cccc(OC)c3)no2)C1 ZINC000513163505 921595250 /nfs/dbraw/zinc/59/52/50/921595250.db2.gz AYDFAFNDEAOKCK-SOLBZPMBSA-N 0 3 401.507 4.298 20 0 HIADHN C[C@H](NC(=O)CN[C@@]1(Cc2ccc(C(F)(F)F)cc2)CCOC1)c1ccc(F)cc1 ZINC000513171964 921599016 /nfs/dbraw/zinc/59/90/16/921599016.db2.gz DIZOFDJREXHOMA-YCRPNKLZSA-N 0 3 424.438 4.013 20 0 HIADHN Cc1ccc(Br)cc1NC(=O)NCCCN1CCc2ccccc2C1 ZINC000501706617 910773452 /nfs/dbraw/zinc/77/34/52/910773452.db2.gz BYRBVRXNMXJTEN-UHFFFAOYSA-N 0 3 402.336 4.327 20 0 HIADHN C[C@H](CC(=O)N(C)C1CCN(CCc2ccccn2)CC1)c1ccc(F)cc1F ZINC000501735756 910798021 /nfs/dbraw/zinc/79/80/21/910798021.db2.gz SZRFKGQTFURBDZ-QGZVFWFLSA-N 0 3 401.501 4.019 20 0 HIADHN O=C(COCc1cccnc1)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000501740406 910801198 /nfs/dbraw/zinc/80/11/98/910801198.db2.gz GVOOVDUZTTYZLN-UHFFFAOYSA-N 0 3 422.356 4.030 20 0 HIADHN C[C@@H](c1ccccc1)N(C)C(=O)CN[C@]1(Cc2ccc(C(F)(F)F)cc2)CCOC1 ZINC000513181423 921606399 /nfs/dbraw/zinc/60/63/99/921606399.db2.gz AMRUGGVWMMSPPN-JTSKRJEESA-N 0 3 420.475 4.216 20 0 HIADHN C[C@H](NC(=O)N[C@H]1CCCc2cn(C3CCCC3)nc21)[C@H](c1ccccc1)N(C)C ZINC000501766716 910822091 /nfs/dbraw/zinc/82/20/91/910822091.db2.gz HJHONABRDFVFJZ-JWNTYJGQSA-N 0 3 409.578 4.366 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)N1CCC(OCc2ccccc2)CC1 ZINC000501802661 910853540 /nfs/dbraw/zinc/85/35/40/910853540.db2.gz NPTKSZNLNDBFQQ-DEOSSOPVSA-N 0 3 407.558 4.214 20 0 HIADHN CCN(Cc1ccc(OC)c(OC)c1)C(=O)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000501802784 910853959 /nfs/dbraw/zinc/85/39/59/910853959.db2.gz OMLHESLQJZNIGR-NRFANRHFSA-N 0 3 411.546 4.072 20 0 HIADHN CC(C)(C)NC(=O)c1ccc(NC(=O)N[C@H](CN2CCCC2)c2ccccc2)cc1 ZINC000501851252 910884731 /nfs/dbraw/zinc/88/47/31/910884731.db2.gz VXXRMPIVDLUZML-OAQYLSRUSA-N 0 3 408.546 4.174 20 0 HIADHN CC[C@H](CC(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1)c1ccc(OC)cc1 ZINC000501872155 910898092 /nfs/dbraw/zinc/89/80/92/910898092.db2.gz ISMACWGWXIVLHF-RZUBCFFCSA-N 0 3 416.606 4.317 20 0 HIADHN CC(C)c1ccccc1OCCC(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000501872174 910898147 /nfs/dbraw/zinc/89/81/47/910898147.db2.gz IYEUYPPUPCYRKZ-NHCUHLMSSA-N 0 3 416.606 4.317 20 0 HIADHN C[C@@H](NCC1(c2c(F)cccc2F)CCCC1)C(=O)Nc1ccc2c(c1)OCCO2 ZINC000501987372 910965352 /nfs/dbraw/zinc/96/53/52/910965352.db2.gz VSWPKPURGLSPTH-OAHLLOKOSA-N 0 3 416.468 4.165 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)C[C@H](c2cccs2)n2cccc2)CC1 ZINC000502013141 910977409 /nfs/dbraw/zinc/97/74/09/910977409.db2.gz YTRKFJWDYSVHNA-WIYYLYMNSA-N 0 3 408.571 4.266 20 0 HIADHN CSc1ccc(NC(=O)CN[C@]2(Cc3ccc(C(F)(F)F)cc3)CCOC2)cc1 ZINC000513205475 921622601 /nfs/dbraw/zinc/62/26/01/921622601.db2.gz NOQHYLYKVQDDAH-FQEVSTJZSA-N 0 3 424.488 4.357 20 0 HIADHN Cc1ccc(NC(=O)[C@H](NC2CCN(c3nccs3)CC2)c2ccccc2)cc1 ZINC000502058644 911008318 /nfs/dbraw/zinc/00/83/18/911008318.db2.gz QPPQJYIWRMFBEJ-OAQYLSRUSA-N 0 3 406.555 4.390 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)C1(c2ccc(Cl)cc2)CCOCC1 ZINC000513216338 921631753 /nfs/dbraw/zinc/63/17/53/921631753.db2.gz AJMMDZKWJVFEHQ-QFIPXVFZSA-N 0 3 412.961 4.169 20 0 HIADHN O=C(NC[C@H]1CCCN1Cc1ccccc1)c1cccc(OCc2cccnc2)c1 ZINC000513218028 921633513 /nfs/dbraw/zinc/63/35/13/921633513.db2.gz MVAIGEJBTUZBQX-HSZRJFAPSA-N 0 3 401.510 4.055 20 0 HIADHN O=C(Cc1csc(Cc2ccccc2)n1)NC[C@@H]1CCCN1Cc1ccccc1 ZINC000513221004 921635507 /nfs/dbraw/zinc/63/55/07/921635507.db2.gz APFJZKLYFKUFOE-QFIPXVFZSA-N 0 3 405.567 4.057 20 0 HIADHN CC(C)(COc1ccc(C(F)(F)F)cn1)NCc1cc(F)cc2c1OCOC2 ZINC000502218175 911160668 /nfs/dbraw/zinc/16/06/68/911160668.db2.gz UZGOAIJMVKFXNJ-UHFFFAOYSA-N 0 3 400.372 4.053 20 0 HIADHN Cc1cc(CSc2ncccc2C(=O)NC[C@H]2CCCN2Cc2ccccc2)no1 ZINC000513237636 921650671 /nfs/dbraw/zinc/65/06/71/921650671.db2.gz CNMMFMSKSMQPJY-HXUWFJFHSA-N 0 3 422.554 4.065 20 0 HIADHN COc1ccc(NC(=O)C[C@H](C)N[C@H]2CCOc3c(Br)cccc32)cc1 ZINC000502335225 911315444 /nfs/dbraw/zinc/31/54/44/911315444.db2.gz BDPOLRZDABBIMK-UGSOOPFHSA-N 0 3 419.319 4.288 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)CN2C[C@@H](C)C[C@H]2c2ccccc2)cc1OC ZINC000513241910 921651918 /nfs/dbraw/zinc/65/19/18/921651918.db2.gz MXGOFWYXKNOUKY-NYVOZVTQSA-N 0 3 408.542 4.450 20 0 HIADHN CN1CCN(CCCNC(=O)Nc2ccccc2C(F)(F)F)[C@H](c2ccccc2)C1 ZINC000502349973 911330400 /nfs/dbraw/zinc/33/04/00/911330400.db2.gz ACITWGSARJWPSV-FQEVSTJZSA-N 0 3 420.479 4.206 20 0 HIADHN CC(=O)Nc1c[nH]nc1[C@@H]1CCCN([C@@H]2CCCc3ccc(Br)cc32)C1 ZINC000502356859 911339325 /nfs/dbraw/zinc/33/93/25/911339325.db2.gz CSWSOCPACQOSJX-DNVCBOLYSA-N 0 3 417.351 4.388 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)c1cnn(-c2cccc(Cl)c2)c1 ZINC000502358799 911343346 /nfs/dbraw/zinc/34/33/46/911343346.db2.gz UCIARXYRPRVGFW-UHFFFAOYSA-N 0 3 410.949 4.162 20 0 HIADHN COc1cc(C)c(C[C@H](C)N[C@@H](CO)c2ccccc2OC(F)(F)F)cc1OC ZINC000502373856 911357606 /nfs/dbraw/zinc/35/76/06/911357606.db2.gz NOULOUCWEOZZBU-YOEHRIQHSA-N 0 3 413.436 4.165 20 0 HIADHN Cc1c(C(=O)NC[C@H]2CCCN2Cc2ccccc2)cnn1-c1ccccc1Cl ZINC000513253876 921658852 /nfs/dbraw/zinc/65/88/52/921658852.db2.gz FOTPHIGCTOTGAM-LJQANCHMSA-N 0 3 408.933 4.229 20 0 HIADHN Cn1cc(C(=O)NC[C@@H]2CCCN2Cc2ccccc2)c(-c2ccccc2Cl)n1 ZINC000513262762 921666656 /nfs/dbraw/zinc/66/66/56/921666656.db2.gz OFMDCQBQFDMWDM-SFHVURJKSA-N 0 3 408.933 4.135 20 0 HIADHN COCC1(CN[C@H](c2ccc(Cl)cc2)c2cccc(S(C)(=O)=O)c2)CCC1 ZINC000502531941 911537633 /nfs/dbraw/zinc/53/76/33/911537633.db2.gz UMCDDIVZLBHUSC-HXUWFJFHSA-N 0 3 407.963 4.239 20 0 HIADHN CC(C)N(CCC(=O)Nc1ccccc1C(F)(F)F)CC(=O)N1CCCCCC1 ZINC000513267089 921669789 /nfs/dbraw/zinc/66/97/89/921669789.db2.gz ONCBXTKAYPWYPJ-UHFFFAOYSA-N 0 3 413.484 4.147 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)[C@H](C)c1c(C)nn(C)c1C)c1ccc(C(F)(F)F)cc1 ZINC000502545925 911551455 /nfs/dbraw/zinc/55/14/55/911551455.db2.gz YIOQKWCCBJFVCS-KUHUBIRLSA-N 0 3 424.511 4.359 20 0 HIADHN COCCN1CCC(NC(=O)N[C@@H](c2ccccc2)[C@H]2CCCc3ccccc32)CC1 ZINC000502564200 911571852 /nfs/dbraw/zinc/57/18/52/911571852.db2.gz UJVXKYGMJWTWIL-DQEYMECFSA-N 0 3 421.585 4.258 20 0 HIADHN O=C(COc1ccc(Cl)c2cccnc12)NC[C@H]1CCCN1Cc1ccccc1 ZINC000513272122 921673269 /nfs/dbraw/zinc/67/32/69/921673269.db2.gz GWMIGFXRXHUXQJ-GOSISDBHSA-N 0 3 409.917 4.048 20 0 HIADHN O=C(COc1ccc(Cl)c2cccnc12)NC[C@@H]1CCCN1Cc1ccccc1 ZINC000513272123 921673859 /nfs/dbraw/zinc/67/38/59/921673859.db2.gz GWMIGFXRXHUXQJ-SFHVURJKSA-N 0 3 409.917 4.048 20 0 HIADHN CC[C@@H]1c2ccsc2CCN1C(=O)CN[C@]1(Cc2ccc(Cl)cc2)CCOC1 ZINC000502597455 911600725 /nfs/dbraw/zinc/60/07/25/911600725.db2.gz USYGKGDTKGAZHD-KNQAVFIVSA-N 0 3 418.990 4.229 20 0 HIADHN O=c1[n-]c(C[NH2+][C@@]2(Cc3ccc(Cl)cc3)CCOC2)nc2c3ccccc3oc21 ZINC000502601886 911608429 /nfs/dbraw/zinc/60/84/29/911608429.db2.gz RIRYGVSXOIYBHH-JOCHJYFZSA-N 0 3 409.873 4.226 20 0 HIADHN Cc1nc(COc2ccccc2C(=O)NC[C@@H]2CCCN2Cc2ccccc2)cs1 ZINC000513283901 921683079 /nfs/dbraw/zinc/68/30/79/921683079.db2.gz HSHJEKKNZOVORK-NRFANRHFSA-N 0 3 421.566 4.425 20 0 HIADHN CC[C@H](NC(=O)N[C@H]1CCN(Cc2ccccc2)C1)c1ccccc1OC(F)F ZINC000502646231 911683760 /nfs/dbraw/zinc/68/37/60/911683760.db2.gz BHQVCRPEQRZFMD-HKUYNNGSSA-N 0 3 403.473 4.313 20 0 HIADHN CCN1CC[C@H]2OCCN(C(=O)c3oc4cc(OC)ccc4c3-c3ccccc3)[C@H]2C1 ZINC000502653805 911698111 /nfs/dbraw/zinc/69/81/11/911698111.db2.gz TVQCIYWFGNAHHG-LEWJYISDSA-N 0 3 420.509 4.044 20 0 HIADHN CCCOc1ccc([C@H](C)NC(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1OC ZINC000502667447 911708158 /nfs/dbraw/zinc/70/81/58/911708158.db2.gz MDDCOQUMQQSJEN-RXVVDRJESA-N 0 3 411.546 4.119 20 0 HIADHN O=S1(=O)CCC(CN(Cc2ccccc2OC(F)(F)F)C2CCCC2)CC1 ZINC000502705416 911738291 /nfs/dbraw/zinc/73/82/91/911738291.db2.gz HPXOLCKVDALIRC-UHFFFAOYSA-N 0 3 405.482 4.155 20 0 HIADHN Cc1noc(C)c1COc1cccc(C(=O)NC[C@H]2CCCN2Cc2ccccc2)c1 ZINC000513302207 921698415 /nfs/dbraw/zinc/69/84/15/921698415.db2.gz SOGBNKVZIPCTJC-JOCHJYFZSA-N 0 3 419.525 4.265 20 0 HIADHN CCCn1cc(CN2CCCN(Cc3c[nH]nc3-c3ccc(Cl)cc3)CC2)cn1 ZINC000513334288 921720485 /nfs/dbraw/zinc/72/04/85/921720485.db2.gz WAYMPYDDVXRLJE-UHFFFAOYSA-N 0 3 412.969 4.045 20 0 HIADHN CC(C)Cc1ccc([C@@H](CNC(=O)N2CCC3(CCOCC3)[C@H]2C)N(C)C)cc1 ZINC000513340463 921725348 /nfs/dbraw/zinc/72/53/48/921725348.db2.gz KHMUOAFRNMYCBJ-DENIHFKCSA-N 0 3 401.595 4.088 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)N(C)[C@@H]3CCCC[C@@H]3C)CC2)c1 ZINC000503217117 912199944 /nfs/dbraw/zinc/19/99/44/912199944.db2.gz NUJBYICKRZKFGF-JTHBVZDNSA-N 0 3 400.611 4.117 20 0 HIADHN Fc1ccc(CN2CCC[C@@H](NCc3ccc(Br)cn3)C2)c(Cl)c1 ZINC000506277940 914879595 /nfs/dbraw/zinc/87/95/95/914879595.db2.gz WPIMHOVKNJLTPR-QGZVFWFLSA-N 0 3 412.734 4.391 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)Nc2cc3c(cc2Cl)OCCCO3)C1 ZINC000506294815 914889999 /nfs/dbraw/zinc/88/99/99/914889999.db2.gz LGMAWZBROYFDEE-DOTOQJQBSA-N 0 3 415.921 4.458 20 0 HIADHN Cc1ncsc1CCN[C@@H](c1ccc(C)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000506294951 914890905 /nfs/dbraw/zinc/89/09/05/914890905.db2.gz NJGFQSFQNPKSRC-NRFANRHFSA-N 0 3 400.569 4.085 20 0 HIADHN CC(=O)Nc1ccc(Cl)c(NC(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)c1 ZINC000506296301 914891469 /nfs/dbraw/zinc/89/14/69/914891469.db2.gz XZNVYPPWPOBNQA-KBXCAEBGSA-N 0 3 400.910 4.255 20 0 HIADHN CCN(CC)C(=O)Cc1ccc(NC(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)cc1 ZINC000506297798 914892480 /nfs/dbraw/zinc/89/24/80/914892480.db2.gz NAMGBQXSSXZIEF-XXBNENTESA-N 0 3 422.573 4.055 20 0 HIADHN Cc1nn(Cc2ccccc2Cl)c(C)c1CN1CCC(C(=O)N2CCCC2)CC1 ZINC000506307964 914898327 /nfs/dbraw/zinc/89/83/27/914898327.db2.gz GEACKYMPKRDMOS-UHFFFAOYSA-N 0 3 414.981 4.036 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)N3CCC[C@H](C[N@H+]4CCCC[C@H]4C)C3)cc2)cc(=O)[n-]1 ZINC000506314229 914907363 /nfs/dbraw/zinc/90/73/63/914907363.db2.gz JEIYVWRQTBRNBX-IEBWSBKVSA-N 0 3 423.561 4.276 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)N3CCC[C@H](C[N@@H+]4CCCC[C@H]4C)C3)cc2)cc(=O)[n-]1 ZINC000506314229 914907392 /nfs/dbraw/zinc/90/73/92/914907392.db2.gz JEIYVWRQTBRNBX-IEBWSBKVSA-N 0 3 423.561 4.276 20 0 HIADHN CCC(=O)Nc1ccc(NC(=O)[C@H]2CN(Cc3ccccc3)CCC2(F)F)cc1 ZINC000506340026 914957752 /nfs/dbraw/zinc/95/77/52/914957752.db2.gz KFCMGLOFRDGDBS-LJQANCHMSA-N 0 3 401.457 4.131 20 0 HIADHN COC(=O)CCn1nc(C)c(CN2CC=C(c3c(C)[nH]c4ccccc43)CC2)c1C ZINC000506416608 915025571 /nfs/dbraw/zinc/02/55/71/915025571.db2.gz NGMCPHFZPKBXNP-UHFFFAOYSA-N 0 3 406.530 4.142 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)N[C@H]1CCCOc2ccccc21 ZINC000506531092 915174504 /nfs/dbraw/zinc/17/45/04/915174504.db2.gz FLPQCWTYIWNRNR-NRFANRHFSA-N 0 3 411.571 4.313 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)CCN1CCC[C@@H](Oc2ccccc2OC)C1 ZINC000513378165 921751916 /nfs/dbraw/zinc/75/19/16/921751916.db2.gz ZPUIKSDDTVOZIB-QGZVFWFLSA-N 0 3 418.921 4.229 20 0 HIADHN Cc1noc(C)c1[C@@H](C)CNC(=O)N[C@@H](CN1CCc2ccccc2C1)C(C)(C)C ZINC000506610514 915263241 /nfs/dbraw/zinc/26/32/41/915263241.db2.gz AKIOOKBXUZTMFI-KKSFZXQISA-N 0 3 412.578 4.167 20 0 HIADHN NC(=O)[C@H](Cc1ccc(Cl)cc1)NC[C@@H](OCC1CC1)c1ccc(Cl)cc1 ZINC000506617042 915273678 /nfs/dbraw/zinc/27/36/78/915273678.db2.gz NDXNCNGVPVRNCJ-VQTJNVASSA-N 0 3 407.341 4.147 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(C)c1CN1CCC[C@@H](c2nnc3n2CCCCC3)C1 ZINC000506616977 915274381 /nfs/dbraw/zinc/27/43/81/915274381.db2.gz GUBFPGVQHHJFAJ-LJQANCHMSA-N 0 3 422.552 4.326 20 0 HIADHN COc1ccc(CN2CCC[C@H](c3nnc4n3CCCCC4)C2)cc1OCC(C)C ZINC000506622241 915284137 /nfs/dbraw/zinc/28/41/37/915284137.db2.gz BIYVBSRGQTZYGE-FQEVSTJZSA-N 0 3 412.578 4.428 20 0 HIADHN CC[C@@H](N[C@H]1CCCN(Cc2ccc(F)cc2F)C1=O)c1ccc(OC)c(OC)c1 ZINC000506661030 915335459 /nfs/dbraw/zinc/33/54/59/915335459.db2.gz FDYUQEYFHIJIIV-UXHICEINSA-N 0 3 418.484 4.214 20 0 HIADHN CC(C)c1nn(-c2ccccc2)cc1CN1CCC(c2nnc3ccccn32)CC1 ZINC000506721706 915401323 /nfs/dbraw/zinc/40/13/23/915401323.db2.gz HEESQUIFTCOAMM-UHFFFAOYSA-N 0 3 400.530 4.418 20 0 HIADHN C[C@H](CNC(=O)N1CCC[C@H](c2nc3ccc(F)cc3o2)C1)N(C)Cc1ccccc1 ZINC000506730419 915416250 /nfs/dbraw/zinc/41/62/50/915416250.db2.gz HIXFOHPNNFKNAQ-MJGOQNOKSA-N 0 3 424.520 4.376 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CN1CCC(C(=O)NCc2ccccc2)CC1 ZINC000506734608 915421342 /nfs/dbraw/zinc/42/13/42/915421342.db2.gz JTSOPUTYTDLBQQ-UHFFFAOYSA-N 0 3 402.542 4.018 20 0 HIADHN Cc1ccc(-c2ncc(CN3CCC(C(=O)NCCCOC(C)C)CC3)s2)cc1 ZINC000506879622 915672586 /nfs/dbraw/zinc/67/25/86/915672586.db2.gz DIXCGUZKYAPLKU-UHFFFAOYSA-N 0 3 415.603 4.262 20 0 HIADHN CN(C)[C@@H](CNC(=O)Nc1ccc(F)cc1OCC(F)(F)F)Cc1ccccc1 ZINC000506896802 915691843 /nfs/dbraw/zinc/69/18/43/915691843.db2.gz LTHDWOUHUWWNCT-MRXNPFEDSA-N 0 3 413.415 4.061 20 0 HIADHN CCc1c(C(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)cnn1Cc1ccccc1 ZINC000513423755 921793843 /nfs/dbraw/zinc/79/38/43/921793843.db2.gz PPLPSKCRJAEPSN-VWLOTQADSA-N 0 3 416.569 4.369 20 0 HIADHN COc1ccc([C@H](C)NC(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)c(C)c1OC ZINC000513432195 921801024 /nfs/dbraw/zinc/80/10/24/921801024.db2.gz OWEIGWOKBFDFMI-KXBFYZLASA-N 0 3 419.953 4.329 20 0 HIADHN CC(C)(C)[C@H](NCC(=O)NCc1ccccc1Cn1cccn1)c1ccc(F)cc1 ZINC000507041776 915836535 /nfs/dbraw/zinc/83/65/35/915836535.db2.gz VOQSRUJILZHECL-HSZRJFAPSA-N 0 3 408.521 4.064 20 0 HIADHN COc1cccc(CN(C)C(=O)CN[C@H](c2ccc(F)cc2)C(C)(C)C)c1OC ZINC000507042413 915837259 /nfs/dbraw/zinc/83/72/59/915837259.db2.gz XJHMDGMQBAMUEF-JOCHJYFZSA-N 0 3 402.510 4.178 20 0 HIADHN CC(C)Cn1ncc(C(=O)Nc2ccc(CCN3CCSCC3)cc2)c1C1CC1 ZINC000507089072 915864274 /nfs/dbraw/zinc/86/42/74/915864274.db2.gz ULLZWCRPYBPOKS-UHFFFAOYSA-N 0 3 412.603 4.260 20 0 HIADHN CC(C)C(=O)Nc1ccc(C(=O)N2CCCN(CCCc3ccccc3)CC2)cc1 ZINC000507164284 915903669 /nfs/dbraw/zinc/90/36/69/915903669.db2.gz WTENEVZJTGVYRK-UHFFFAOYSA-N 0 3 407.558 4.062 20 0 HIADHN Cc1ccccc1C(=O)NC1CCN(Cc2cccc(OCc3ccccn3)c2)CC1 ZINC000507166568 915909308 /nfs/dbraw/zinc/90/93/08/915909308.db2.gz DGWAXWWKWDSVAP-UHFFFAOYSA-N 0 3 415.537 4.363 20 0 HIADHN COc1ccc([C@H]2CCCN2C(=O)CN2CC[C@H](c3ccccc3C)C2)c(OC)c1 ZINC000507177363 915922303 /nfs/dbraw/zinc/92/23/03/915922303.db2.gz HAVLJEGWUTZXHF-WMZHIEFXSA-N 0 3 408.542 4.165 20 0 HIADHN CN(CCCc1cc(-c2ccccc2)no1)Cc1cc(=O)n2cc(Cl)ccc2n1 ZINC000507184952 915933113 /nfs/dbraw/zinc/93/31/13/915933113.db2.gz VHIFSZVRMZZKOL-UHFFFAOYSA-N 0 3 408.889 4.068 20 0 HIADHN O[C@@H](COc1c(Cl)cccc1Cl)CN1CCC(Nc2ccc(F)cc2)CC1 ZINC000507256883 916017248 /nfs/dbraw/zinc/01/72/48/916017248.db2.gz WSKFRZQIPXOOTQ-QGZVFWFLSA-N 0 3 413.320 4.449 20 0 HIADHN Cc1cccc(-c2nnc(-c3ccc(C(=O)NCCN4CCCC[C@@H]4C)cc3)o2)c1 ZINC000507352495 916107426 /nfs/dbraw/zinc/10/74/26/916107426.db2.gz KNHSOQXZHFHFFA-SFHVURJKSA-N 0 3 404.514 4.316 20 0 HIADHN COCCSc1ccc([C@H](C)N[C@H](C)C(=O)N[C@H]2CCOc3ccccc32)cc1 ZINC000507449444 916219228 /nfs/dbraw/zinc/21/92/28/916219228.db2.gz HXNIWZPMBXYWEG-FVJLSDCUSA-N 0 3 414.571 4.104 20 0 HIADHN CCSc1ccc([C@@H](C)N[C@@H](C)C(=O)NCc2ccc(OC)c(OC)c2)cc1 ZINC000507537908 916294404 /nfs/dbraw/zinc/29/44/04/916294404.db2.gz SSJIUTWFQHAXKF-CVEARBPZSA-N 0 3 402.560 4.171 20 0 HIADHN Cc1sc(Br)c(C(=O)NCC2(N3CCSCC3)CCCC2)c1C ZINC000507547781 916305213 /nfs/dbraw/zinc/30/52/13/916305213.db2.gz GFCMEAFONURTEU-UHFFFAOYSA-N 0 3 417.438 4.219 20 0 HIADHN Cc1ccc(-n2nc(C(=O)N[C@H]3CCN([C@@H](C)c4ccccc4)C3)c3c2CCC3)cc1 ZINC000507604611 916360004 /nfs/dbraw/zinc/36/00/04/916360004.db2.gz LWJOBGYJCJXDOC-FPOVZHCZSA-N 0 3 414.553 4.235 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)c2nn(-c3ccccc3F)c3c2CCC3)C1 ZINC000507619330 916377567 /nfs/dbraw/zinc/37/75/67/916377567.db2.gz GLEVHMWRXLTTFX-HKUYNNGSSA-N 0 3 418.516 4.065 20 0 HIADHN Cc1cc(C)n(-c2ccc(Cl)c(C(=O)N[C@H]3CCN([C@H](C)c4ccccc4)C3)n2)n1 ZINC000507627909 916386072 /nfs/dbraw/zinc/38/60/72/916386072.db2.gz BWYZWNJDWGIOPG-MJGOQNOKSA-N 0 3 423.948 4.103 20 0 HIADHN CC(C)(C)[C@@H](CN1CCc2ccccc2C1)NC(=O)C1CCC(OC(F)F)CC1 ZINC000507688300 916459659 /nfs/dbraw/zinc/45/96/59/916459659.db2.gz NGDXWYVIXBQBEE-LYBXBRPPSA-N 0 3 408.533 4.374 20 0 HIADHN c1cnc(Oc2ccc(CN3CC=C(c4ccc5c(c4)OCCO5)CC3)cc2)cn1 ZINC000507712698 916506664 /nfs/dbraw/zinc/50/66/64/916506664.db2.gz FENWYKKFOZXQKN-UHFFFAOYSA-N 0 3 401.466 4.329 20 0 HIADHN COCCOc1ccc(NC(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)cc1Cl ZINC000507746926 916537610 /nfs/dbraw/zinc/53/76/10/916537610.db2.gz JPLLVAFTPOETTP-VQIMIIECSA-N 0 3 417.937 4.322 20 0 HIADHN COc1ccc(C)cc1NC(=O)[C@H](NCCc1c[nH]c2ncccc12)c1ccccc1 ZINC000507842105 916651642 /nfs/dbraw/zinc/65/16/42/916651642.db2.gz REPNSJKQGSHVTQ-HSZRJFAPSA-N 0 3 414.509 4.392 20 0 HIADHN CCOC(=O)c1ccc(N2CCCN(C/C(C)=C\c3ccccc3COC)CC2)nc1 ZINC000507871481 916709154 /nfs/dbraw/zinc/70/91/54/916709154.db2.gz FRTIUJIDPQZVLK-SILNSSARSA-N 0 3 423.557 4.020 20 0 HIADHN Cc1ccc(CN[C@H]2CCc3nnc(-c4ccc(F)cc4)n3C2)c(Br)c1 ZINC000507874633 916711447 /nfs/dbraw/zinc/71/14/47/916711447.db2.gz QLSNBHMFCOLXFU-KRWDZBQOSA-N 0 3 415.310 4.260 20 0 HIADHN O=C(CCN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1)Nc1cccc2ccccc21 ZINC000507878054 916717388 /nfs/dbraw/zinc/71/73/88/916717388.db2.gz XDYPDUNWVAUONE-HXUWFJFHSA-N 0 3 420.488 4.204 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CN1CCC[C@H](C(=O)Nc2ccc(C)cn2)C1 ZINC000507983266 916828519 /nfs/dbraw/zinc/82/85/19/916828519.db2.gz AONCLYRPIUTQEF-QFIPXVFZSA-N 0 3 417.557 4.102 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1csc(-c2ccccc2)n1 ZINC000508064903 916888490 /nfs/dbraw/zinc/88/84/90/916888490.db2.gz UYQYJOJGMJNYAK-UHFFFAOYSA-N 0 3 407.539 4.267 20 0 HIADHN COc1cccc(COc2cccc(Cl)c2CNC2CCC(NC(C)=O)CC2)c1 ZINC000508076941 916897946 /nfs/dbraw/zinc/89/79/46/916897946.db2.gz ANFCGDACNQZEHW-UHFFFAOYSA-N 0 3 416.949 4.465 20 0 HIADHN Cc1cc(C(=O)NCCN2CCN(C)C(C)(C)C2)sc1-c1cccc(Cl)c1 ZINC000508299218 917107634 /nfs/dbraw/zinc/10/76/34/917107634.db2.gz KQJSHQOZQMFNBS-UHFFFAOYSA-N 0 3 405.995 4.133 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)c2ccnc(-c3ccc(Cl)cc3)n2)c1 ZINC000508467561 917251609 /nfs/dbraw/zinc/25/16/09/917251609.db2.gz NNHMDMXUMHMAOD-UHFFFAOYSA-N 0 3 424.932 4.010 20 0 HIADHN Cc1cc(NC(=O)c2csc(C(F)(F)F)n2)cc(N2CCN(C(C)C)CC2)c1 ZINC000508483213 917268170 /nfs/dbraw/zinc/26/81/70/917268170.db2.gz FJOKUXMJMIZSTI-UHFFFAOYSA-N 0 3 412.481 4.253 20 0 HIADHN CCc1ccc(-c2nn(-c3ccccc3)cc2CN2CCC(CC(N)=O)CC2)cc1 ZINC000508593612 917363911 /nfs/dbraw/zinc/36/39/11/917363911.db2.gz GISLFVMUNFYXIP-UHFFFAOYSA-N 0 3 402.542 4.189 20 0 HIADHN CCN(Cc1ccc2ccccc2c1)Cc1cc(Cl)c(OCC(N)=O)c(OC)c1 ZINC000508614063 917383022 /nfs/dbraw/zinc/38/30/22/917383022.db2.gz IHFWBBRUNXWBAU-UHFFFAOYSA-N 0 3 412.917 4.388 20 0 HIADHN COC(=O)[C@H]1CCN(Cc2cccc(NC(=O)c3ccc(Cl)cc3Cl)c2)C1 ZINC000508664525 917430420 /nfs/dbraw/zinc/43/04/20/917430420.db2.gz JXOHAFLMDKGBFB-AWEZNQCLSA-N 0 3 407.297 4.241 20 0 HIADHN Cc1cccc(-c2nn(-c3ccc(F)cc3)cc2CN2CCC(CC(N)=O)CC2)c1 ZINC000508679985 917443927 /nfs/dbraw/zinc/44/39/27/917443927.db2.gz NVTOKANYSNMSFK-UHFFFAOYSA-N 0 3 406.505 4.074 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2cccc(C(=O)Nc3ccccc3)c2)N(C)C)cc1 ZINC000508703829 917464455 /nfs/dbraw/zinc/46/44/55/917464455.db2.gz NIOJOWUFWCPTGZ-HSZRJFAPSA-N 0 3 401.510 4.280 20 0 HIADHN CCCOc1c(Cl)cc(CNCc2ccccc2Cn2cncn2)cc1OC ZINC000508724381 917486358 /nfs/dbraw/zinc/48/63/58/917486358.db2.gz RCCQBOFKBHUZPD-UHFFFAOYSA-N 0 3 400.910 4.067 20 0 HIADHN O=C(N1CCC[C@H](C(F)(F)F)C1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000508777270 917531714 /nfs/dbraw/zinc/53/17/14/917531714.db2.gz HQACEJYKVJWIFB-RDJZCZTQSA-N 0 3 408.386 4.242 20 0 HIADHN CN(Cc1ccc(F)c(F)c1)C(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000508803060 917557656 /nfs/dbraw/zinc/55/76/56/917557656.db2.gz MWRHMIMQLLNNRC-FQEVSTJZSA-N 0 3 412.402 4.378 20 0 HIADHN C[C@H](NC(=O)N(Cc1cccs1)C[C@@H]1CCCO1)[C@@H](c1ccccc1)N(C)C ZINC000508852890 917606481 /nfs/dbraw/zinc/60/64/81/917606481.db2.gz OLBVUAONZUMBNZ-CUWPLCDZSA-N 0 3 401.576 4.130 20 0 HIADHN C[C@@H](NC(=O)Nc1ccccc1CN1C[C@@H](C)O[C@@H](C)C1)[C@H](c1ccccc1)N(C)C ZINC000508877247 917630558 /nfs/dbraw/zinc/63/05/58/917630558.db2.gz XUFQSMGTNYVYBD-ZBNTXBBCSA-N 0 3 424.589 4.109 20 0 HIADHN C[C@@H](NC(=O)N1CCC2(CC1)OCCc1ccsc12)[C@H](c1ccccc1)N(C)C ZINC000508891084 917645822 /nfs/dbraw/zinc/64/58/22/917645822.db2.gz GIWWMCUXSYHSOQ-YLJYHZDGSA-N 0 3 413.587 4.013 20 0 HIADHN C[C@@H](NC(=O)N1CCC2(CC1)OCCc1ccsc12)[C@@H](c1ccccc1)N(C)C ZINC000508891083 917646084 /nfs/dbraw/zinc/64/60/84/917646084.db2.gz GIWWMCUXSYHSOQ-XLIONFOSSA-N 0 3 413.587 4.013 20 0 HIADHN COc1ccccc1NC(=O)C1CCN(Cc2ccc(OC[C@@H]3CCCO3)cc2)CC1 ZINC000508892986 917647458 /nfs/dbraw/zinc/64/74/58/917647458.db2.gz HQDUKSHIVGVIQJ-QFIPXVFZSA-N 0 3 424.541 4.104 20 0 HIADHN C[C@H](NC(=O)NCc1ccncc1OCc1ccccc1)[C@H](c1ccccc1)N(C)C ZINC000508900190 917654417 /nfs/dbraw/zinc/65/44/17/917654417.db2.gz XEWATAUOJYEKIC-YADARESESA-N 0 3 418.541 4.151 20 0 HIADHN Cc1ccc(NC(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)c(OC[C@H]2CCCO2)c1 ZINC000508905443 917662000 /nfs/dbraw/zinc/66/20/00/917662000.db2.gz KWBCKWDQLUHALY-KKLQWCBXSA-N 0 3 411.546 4.366 20 0 HIADHN C[C@@H](NC(=O)N(C)Cc1cccc(Br)c1)[C@H](c1ccccc1)N(C)C ZINC000508905648 917662169 /nfs/dbraw/zinc/66/21/69/917662169.db2.gz MJWXOIWTUPPOMD-DNVCBOLYSA-N 0 3 404.352 4.282 20 0 HIADHN C[C@H](NC(=O)Nc1ccc(C(=O)N2CCC(C)CC2)cc1)[C@H](c1ccccc1)N(C)C ZINC000508908446 917665472 /nfs/dbraw/zinc/66/54/72/917665472.db2.gz SMMNETREGFSRAL-WMZHIEFXSA-N 0 3 422.573 4.372 20 0 HIADHN C[C@@H](NC(=O)Nc1ccc(C(=O)N2CCC(C)CC2)cc1)[C@@H](c1ccccc1)N(C)C ZINC000508908448 917665747 /nfs/dbraw/zinc/66/57/47/917665747.db2.gz SMMNETREGFSRAL-XXBNENTESA-N 0 3 422.573 4.372 20 0 HIADHN CCOc1cc(NC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)ccc1OC ZINC000508978479 917732161 /nfs/dbraw/zinc/73/21/61/917732161.db2.gz IWSTUNAGHMYIPD-OAQYLSRUSA-N 0 3 422.447 4.487 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)NCc2c(F)cccc2N2CCCC2)CC1 ZINC000509039661 917793624 /nfs/dbraw/zinc/79/36/24/917793624.db2.gz LCCFYQBJRCYWMP-UHFFFAOYSA-N 0 3 424.564 4.232 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)N(C)Cc1ccc(OC)c(O)c1)c1ccc(Cl)cc1 ZINC000509042055 917794991 /nfs/dbraw/zinc/79/49/91/917794991.db2.gz YDLGRTGIFMLDSI-IBGZPJMESA-N 0 3 419.953 4.279 20 0 HIADHN COC(=O)C[C@@](C)(NCC/C=C\c1ccc(Br)cc1)c1ccccn1 ZINC000509127797 917859406 /nfs/dbraw/zinc/85/94/06/917859406.db2.gz QLGPYTZUYZEWNP-CNMWDZGZSA-N 0 3 403.320 4.316 20 0 HIADHN CCc1cc(C(=O)N(Cc2ccco2)C2CCN(C)CC2)c2c(n1)onc2C(C)C ZINC000509148058 917870325 /nfs/dbraw/zinc/87/03/25/917870325.db2.gz YKILNOCQNDPTRN-UHFFFAOYSA-N 0 3 410.518 4.238 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(CN3CCC[C@@H](c4nc(C)no4)C3)c2)cc1 ZINC000509343382 918007836 /nfs/dbraw/zinc/00/78/36/918007836.db2.gz KDCYVAGRCDWGDX-LJQANCHMSA-N 0 3 406.486 4.019 20 0 HIADHN CSc1cccc(F)c1CNC(=O)N(CCN(C)C)Cc1ccc(F)cc1F ZINC000509343620 918008540 /nfs/dbraw/zinc/00/85/40/918008540.db2.gz LGQCSQAPGMMXCO-UHFFFAOYSA-N 0 3 411.493 4.099 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)NCC(C)(C)Oc2cc(F)cc(F)c2)CC1 ZINC000509348684 918014614 /nfs/dbraw/zinc/01/46/14/918014614.db2.gz AKKJINQXGRGXCA-UHFFFAOYSA-N 0 3 421.488 4.021 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)N[C@@H](c1nccs1)c1ccccc1 ZINC000509366698 918031575 /nfs/dbraw/zinc/03/15/75/918031575.db2.gz PQASZAYHEJFPCG-PKOBYXMFSA-N 0 3 412.584 4.430 20 0 HIADHN CCOc1ccc(CN2CCC(C(=O)Nc3ccc(Br)cn3)CC2)cc1 ZINC000509370551 918035382 /nfs/dbraw/zinc/03/53/82/918035382.db2.gz GSNCSHGXSNCGIR-UHFFFAOYSA-N 0 3 418.335 4.094 20 0 HIADHN CCC(C)(C)c1ccc(CN2CCCN(Cc3nc([C@H](C)OC)no3)CC2)cc1 ZINC000509391201 918057284 /nfs/dbraw/zinc/05/72/84/918057284.db2.gz XTTLGMNMTATNMQ-SFHVURJKSA-N 0 3 400.567 4.173 20 0 HIADHN CCOCc1cc(CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)ccc1OC ZINC000509422502 918082622 /nfs/dbraw/zinc/08/26/22/918082622.db2.gz SHWVTCGIQHOTDY-UHFFFAOYSA-N 0 3 417.937 4.131 20 0 HIADHN CCC[C@H](NCc1ccc(-c2cnn(C)c2)s1)C(=O)N1CCc2sccc2C1 ZINC000509462118 918113126 /nfs/dbraw/zinc/11/31/26/918113126.db2.gz GAKDSDKOSLNLTK-SFHVURJKSA-N 0 3 414.600 4.053 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)c2[nH]c3ccccc3c2Br)C1 ZINC000509519568 918169045 /nfs/dbraw/zinc/16/90/45/918169045.db2.gz KSCLUHLIOVTPDO-GOEBONIOSA-N 0 3 412.331 4.496 20 0 HIADHN C[C@@H]1CCCN(C(=O)C2CCN(Cc3ccc(OCc4ccccn4)cc3)CC2)C1 ZINC000509550235 918200463 /nfs/dbraw/zinc/20/04/63/918200463.db2.gz TZXLHQLMYMVRDU-HXUWFJFHSA-N 0 3 407.558 4.131 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)N1CCC(Oc2ccc(F)cc2)CC1)c1ccco1 ZINC000509561750 918210606 /nfs/dbraw/zinc/21/06/06/918210606.db2.gz ZCBCEFFSQQIIOM-UZLBHIALSA-N 0 3 403.498 4.101 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)N1CCC(Oc2ccc(F)cc2F)CC1)c1ccco1 ZINC000509580688 918230422 /nfs/dbraw/zinc/23/04/22/918230422.db2.gz ZJDSAFOILCXRQP-DNVCBOLYSA-N 0 3 421.488 4.240 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)N(C)Cc1ccccc1Br)c1ccco1 ZINC000509584439 918232954 /nfs/dbraw/zinc/23/29/54/918232954.db2.gz CKVGWDDNYGKOFP-PBHICJAKSA-N 0 3 408.340 4.313 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N1CC[C@H](C(F)(F)F)C2(CCC2)C1)c1ccco1 ZINC000509592647 918241050 /nfs/dbraw/zinc/24/10/50/918241050.db2.gz UNVPSQMVCAQTDU-ZOBUZTSGSA-N 0 3 401.473 4.473 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N(C)Cc1cc(Br)cs1)c1ccco1 ZINC000509593422 918242969 /nfs/dbraw/zinc/24/29/69/918242969.db2.gz CUBNZXBGZMHXII-WFASDCNBSA-N 0 3 414.369 4.374 20 0 HIADHN CC[C@H](NC(=O)N[C@@H](CN(C)C)c1ccc(Cl)cc1)c1ccc(OC)c(OC)c1 ZINC000509594934 918244137 /nfs/dbraw/zinc/24/41/37/918244137.db2.gz GBIPQLTZHLBJCE-OALUTQOASA-N 0 3 419.953 4.410 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N1CCC(OCCc2ccccc2)CC1)c1ccco1 ZINC000509595674 918246802 /nfs/dbraw/zinc/24/68/02/918246802.db2.gz ISIBRLWACDEUOO-UGKGYDQZSA-N 0 3 413.562 4.142 20 0 HIADHN CCN1CCC[C@@H](CN(C)c2nnc(-c3cccc(F)c3)cc2C)[C@@H]1c1cnn(C)c1 ZINC000509600425 918249441 /nfs/dbraw/zinc/24/94/41/918249441.db2.gz MDEGGHRBZGZJAE-WMZHIEFXSA-N 0 3 422.552 4.234 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)N1CCC(c2ncccc2Cl)CC1)c1ccco1 ZINC000509599062 918249768 /nfs/dbraw/zinc/24/97/68/918249768.db2.gz FEKHKYXJYUYFRN-CRAIPNDOSA-N 0 3 404.942 4.346 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N1CCC(c2ncccc2Cl)CC1)c1ccco1 ZINC000509599065 918249996 /nfs/dbraw/zinc/24/99/96/918249996.db2.gz FEKHKYXJYUYFRN-YJBOKZPZSA-N 0 3 404.942 4.346 20 0 HIADHN CC[C@H](NC(=O)N[C@H]1CCN(Cc2ccccc2)[C@@H]1C)c1ccc(OC)c(OC)c1 ZINC000509612373 918259460 /nfs/dbraw/zinc/25/94/60/918259460.db2.gz XVNTXBWDHJWPEI-QMMLZNLJSA-N 0 3 411.546 4.117 20 0 HIADHN CCc1nc2c(s1)[C@H](N(C)C(=O)NC[C@@H](N[C@@H](C)CC)c1ccco1)CCC2 ZINC000509615384 918264470 /nfs/dbraw/zinc/26/44/70/918264470.db2.gz UTNIJWTUIWWMGP-USXIJHARSA-N 0 3 404.580 4.447 20 0 HIADHN CC(C)(CNC(=O)N[C@H](C[C@H]1CCOC1)c1ccccc1)N1CCc2ccccc2C1 ZINC000509760729 918375415 /nfs/dbraw/zinc/37/54/15/918375415.db2.gz HITOAQIBEYWOQJ-HYBUGGRVSA-N 0 3 421.585 4.290 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)N[C@@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000509778071 918388544 /nfs/dbraw/zinc/38/85/44/918388544.db2.gz SMEVLDLJLXADGU-XWGVYQGASA-N 0 3 407.558 4.118 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCO[C@]2(CCc3ccccc32)C1)c1ccsc1 ZINC000509791048 918399602 /nfs/dbraw/zinc/39/96/02/918399602.db2.gz RWWTXIFAHJPDHU-FYYLOGMGSA-N 0 3 413.587 4.015 20 0 HIADHN CCC(CC)[C@@H](CNC(=O)Nc1ccc(-c2cc(=O)[n-]c(C)n2)cc1)[NH+]1CCCC1 ZINC000509891087 918493106 /nfs/dbraw/zinc/49/31/06/918493106.db2.gz QODNETKLYNRYPP-OAQYLSRUSA-N 0 3 411.550 4.180 20 0 HIADHN Cc1ccc(C(=O)N(CC(C)C)C2CCN(C)CC2)cc1NC(=O)c1ccccc1 ZINC000509937668 918534957 /nfs/dbraw/zinc/53/49/57/918534957.db2.gz MBFVKXCXXKDNQF-UHFFFAOYSA-N 0 3 407.558 4.440 20 0 HIADHN CCOc1c(Cl)cc(CN[C@@H]2CCN(C(=O)Nc3ccccc3)C2)cc1OC ZINC000509964867 918556037 /nfs/dbraw/zinc/55/60/37/918556037.db2.gz VOYAJNXDZZQPBQ-QGZVFWFLSA-N 0 3 403.910 4.143 20 0 HIADHN O=C(Nc1ccccc1)N1CC[C@@H](NCc2ccccc2OCc2ccccn2)C1 ZINC000509971585 918561462 /nfs/dbraw/zinc/56/14/62/918561462.db2.gz MCHMFQCKPQIPJL-OAQYLSRUSA-N 0 3 402.498 4.057 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)c3sc(C)cc3OC(F)F)cc2)CC1 ZINC000510044042 918615427 /nfs/dbraw/zinc/61/54/27/918615427.db2.gz VEORRKXPQCTRHQ-UHFFFAOYSA-N 0 3 409.502 4.048 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Cc3ccc(Br)s3)c(C)c2)CC1 ZINC000510047338 918618084 /nfs/dbraw/zinc/61/80/84/918618084.db2.gz GLGAQOHGWKBQMK-UHFFFAOYSA-N 0 3 422.392 4.142 20 0 HIADHN COCCOc1cccc(NC(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)c1 ZINC000510149679 918705325 /nfs/dbraw/zinc/70/53/25/918705325.db2.gz SWRKGVUISRILDW-HXUWFJFHSA-N 0 3 417.575 4.368 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1nnc(-c2ccco2)s1)c1cccc(OC)c1 ZINC000510226303 918768930 /nfs/dbraw/zinc/76/89/30/918768930.db2.gz DCPLMHRFGZNWJS-INIZCTEOSA-N 0 3 415.519 4.011 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)Nc1ccc2c(c1)COC2 ZINC000510252198 918787571 /nfs/dbraw/zinc/78/75/71/918787571.db2.gz FGMPSICFWIGXDM-UHFFFAOYSA-N 0 3 407.436 4.331 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)NCc1cc(Cl)c2c(c1)OCCCO2 ZINC000510329851 918835029 /nfs/dbraw/zinc/83/50/29/918835029.db2.gz SNSMVYJVDPCNLP-UHFFFAOYSA-N 0 3 414.889 4.239 20 0 HIADHN c1[nH]nc(-c2ccc3c(c2)OCCO3)c1CN1CCC(OCCc2ccccc2)CC1 ZINC000510331770 918836430 /nfs/dbraw/zinc/83/64/30/918836430.db2.gz MKCBXENFRZDPRK-UHFFFAOYSA-N 0 3 419.525 4.072 20 0 HIADHN CN(C)[C@H](CNC(=O)N[C@@H](CC(F)(F)F)c1ccc(F)cc1)Cc1ccccc1 ZINC000510350023 918846925 /nfs/dbraw/zinc/84/69/25/918846925.db2.gz FQBNGDMPWVUQQT-OALUTQOASA-N 0 3 411.443 4.291 20 0 HIADHN Cc1ccc(F)c(NC(=O)N(CCN(C)C)Cc2ccc(Br)cc2)c1 ZINC000510353346 918848025 /nfs/dbraw/zinc/84/80/25/918848025.db2.gz WYESZNRRNSFOCE-UHFFFAOYSA-N 0 3 408.315 4.492 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)NCc1ccccc1OCC(F)(F)F ZINC000510484808 918935856 /nfs/dbraw/zinc/93/58/56/918935856.db2.gz YDPLEGXYWZINBK-UHFFFAOYSA-N 0 3 406.404 4.366 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)Nc1ccc(CCC(=O)N2CCCC2)cc1 ZINC000510484137 918936295 /nfs/dbraw/zinc/93/62/95/918936295.db2.gz XAJQBPTYAVFKAP-UHFFFAOYSA-N 0 3 419.525 4.302 20 0 HIADHN Cn1c2ccc(CNC3(c4ccc(Br)cc4)CCCC3)cc2oc1=O ZINC000510485971 918937157 /nfs/dbraw/zinc/93/71/57/918937157.db2.gz SSJQBACMPJGLFM-UHFFFAOYSA-N 0 3 401.304 4.453 20 0 HIADHN O=C(Nc1cccc(OCc2cccnc2)c1)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000510498486 918947476 /nfs/dbraw/zinc/94/74/76/918947476.db2.gz ZXSNGGLMOQHJEQ-QFIPXVFZSA-N 0 3 402.498 4.057 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3CC[C@@H](c4ccccc4C)C3)c(C)c2)CC1 ZINC000510596899 919039274 /nfs/dbraw/zinc/03/92/74/919039274.db2.gz APOVAKSBWAOJAI-OAQYLSRUSA-N 0 3 406.574 4.467 20 0 HIADHN C[C@@H](NC(=O)NC(Cc1ccccc1F)Cc1ccccc1F)C1=CCN(C)CC1 ZINC000510602130 919044185 /nfs/dbraw/zinc/04/41/85/919044185.db2.gz VTVCZIRHPZVZQP-QGZVFWFLSA-N 0 3 413.512 4.068 20 0 HIADHN CN(C)Cc1cccc(NC(=O)[C@H](c2cc(Cl)cc(Cl)c2)N2CCOCC2)c1 ZINC000510604985 919046391 /nfs/dbraw/zinc/04/63/91/919046391.db2.gz HBQUUESMAJKLEB-FQEVSTJZSA-N 0 3 422.356 4.067 20 0 HIADHN Cc1cc(Br)cc(C)c1N1CCC[C@@H](N2CC[C@@]3(C2)CCCOC3)C1=O ZINC000510615530 919057162 /nfs/dbraw/zinc/05/71/62/919057162.db2.gz CHRCAXORIOVFDW-WIYYLYMNSA-N 0 3 421.379 4.064 20 0 HIADHN CCOC1CC(CN2CCN(CC3CC(OCC)C3)[C@@H](c3cccc(F)c3)C2)C1 ZINC000510630869 919070854 /nfs/dbraw/zinc/07/08/54/919070854.db2.gz DHHTYVHJLIEVBQ-HKZVOWMYSA-N 0 3 404.570 4.115 20 0 HIADHN CC(C)(C)n1cc(CN2CCC[C@H]2CN2CCOCC2)c(-c2ccccc2Cl)n1 ZINC000510632576 919072406 /nfs/dbraw/zinc/07/24/06/919072406.db2.gz WFANLBOHZRTYHL-IBGZPJMESA-N 0 3 416.997 4.255 20 0 HIADHN O=C1COc2ccc(CNCc3ccccc3-c3ccc(Cn4cccn4)cc3)cc2N1 ZINC000510634164 919074803 /nfs/dbraw/zinc/07/48/03/919074803.db2.gz OQNCYHKFXUIGLO-UHFFFAOYSA-N 0 3 424.504 4.219 20 0 HIADHN C[C@@H](NCC(=O)NC(=O)Nc1ccc2c(c1)OCCCO2)c1cccc2ccccc21 ZINC000510634161 919075050 /nfs/dbraw/zinc/07/50/50/919075050.db2.gz OPKXXLFVAPSBNP-MRXNPFEDSA-N 0 3 419.481 4.000 20 0 HIADHN COc1ccc([C@H](CNC(=O)Nc2ccc(OC(F)F)c(F)c2)N2CCCC2)cc1 ZINC000510667231 919107104 /nfs/dbraw/zinc/10/71/04/919107104.db2.gz QMMFUFFNAWPRHH-SFHVURJKSA-N 0 3 423.435 4.394 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)Nc1ccccc1OC[C@@H]1CCCCO1 ZINC000510747224 919197810 /nfs/dbraw/zinc/19/78/10/919197810.db2.gz GZQBXDFFICCFEM-QFIPXVFZSA-N 0 3 423.557 4.204 20 0 HIADHN CC(C)[C@@H](NCc1ccc(C2CCCCC2)cc1)C(=O)N(C)Cc1nnc2n1CCC2 ZINC000510761862 919213500 /nfs/dbraw/zinc/21/35/00/919213500.db2.gz IQCVVFJSUXZGIR-XMMPIXPASA-N 0 3 423.605 4.045 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)NCCc1cc(Br)ccc1F ZINC000510802749 919274275 /nfs/dbraw/zinc/27/42/75/919274275.db2.gz GZMJRGOHDRIEOT-UHFFFAOYSA-N 0 3 419.294 4.369 20 0 HIADHN CC(C)COc1cccc(CNCc2ccc(C(=O)N3C[C@H](C)O[C@@H](C)C3)cc2)c1 ZINC000510845514 919329733 /nfs/dbraw/zinc/32/97/33/919329733.db2.gz MSEHYODLYUJNGG-PMACEKPBSA-N 0 3 410.558 4.261 20 0 HIADHN CC(C)COc1cccc(CNCc2ccc(C(=O)N3C[C@@H](C)O[C@@H](C)C3)cc2)c1 ZINC000510845513 919329972 /nfs/dbraw/zinc/32/99/72/919329972.db2.gz MSEHYODLYUJNGG-BGYRXZFFSA-N 0 3 410.558 4.261 20 0 HIADHN CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)NCC(F)(F)c1ccc(Cl)cc1 ZINC000510928845 919450204 /nfs/dbraw/zinc/45/02/04/919450204.db2.gz LHIUUWGOPYNLNG-LPHOPBHVSA-N 0 3 422.907 4.161 20 0 HIADHN C[C@H](CCc1ccc(C(F)(F)F)cc1)NCc1cc(S(C)(=O)=O)ccc1F ZINC000510964193 919504981 /nfs/dbraw/zinc/50/49/81/919504981.db2.gz CAGXGWKVFCYVFF-CYBMUJFWSA-N 0 3 403.441 4.359 20 0 HIADHN CC[C@@H](N[C@H]1CCc2cc(F)c(OC)cc21)c1ccccc1OCC(=O)N(C)C ZINC000510976810 919525339 /nfs/dbraw/zinc/52/53/39/919525339.db2.gz HGRGXHAUDBKZIO-UXHICEINSA-N 0 3 400.494 4.030 20 0 HIADHN COc1ccc2oc([C@@H](C)N[C@H]3CCN(C(=O)COc4ccccc4)C3)c(C)c2c1 ZINC000511009385 919571653 /nfs/dbraw/zinc/57/16/53/919571653.db2.gz FNEDUBBCXSBYLT-MSOLQXFVSA-N 0 3 408.498 4.080 20 0 HIADHN O=C(Nc1ccccc1)N1CC[C@@H](N[C@@H]2CCCc3ncc(C(F)(F)F)cc32)C1 ZINC000511035207 919616183 /nfs/dbraw/zinc/61/61/83/919616183.db2.gz SRMSNBYAMRCUCE-VQIMIIECSA-N 0 3 404.436 4.374 20 0 HIADHN O=C(Nc1ccccc1)N1CC[C@H](N[C@H]2CCCc3ncc(C(F)(F)F)cc32)C1 ZINC000511035201 919617715 /nfs/dbraw/zinc/61/77/15/919617715.db2.gz SRMSNBYAMRCUCE-LPHOPBHVSA-N 0 3 404.436 4.374 20 0 HIADHN C[C@@H](NCCOc1ccc(I)cc1)c1ccc(Cl)cn1 ZINC000511038815 919622704 /nfs/dbraw/zinc/62/27/04/919622704.db2.gz VVTUATABAPNNAH-LLVKDONJSA-N 0 3 402.663 4.069 20 0 HIADHN CC(C)CN(C(=O)COc1ccc(OCc2ccccc2)cc1)C1CCN(C)CC1 ZINC000511041483 919629844 /nfs/dbraw/zinc/62/98/44/919629844.db2.gz XDSBREIUYXGBSF-UHFFFAOYSA-N 0 3 410.558 4.223 20 0 HIADHN CCC(C)(C)NC(=O)c1ccc(NC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000511055303 919652715 /nfs/dbraw/zinc/65/27/15/919652715.db2.gz XTDHTGKYRAXODL-JOCHJYFZSA-N 0 3 422.573 4.391 20 0 HIADHN Cc1ccc2nc(CN3CCC[C@H](c4cccc(C(F)(F)F)c4)C3)cc(=O)n2c1 ZINC000511066520 919668487 /nfs/dbraw/zinc/66/84/87/919668487.db2.gz RQOMRLICYWSPQV-KRWDZBQOSA-N 0 3 401.432 4.401 20 0 HIADHN CC[C@@H](C)n1ncc2c1nc(C)cc2C(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000511087068 919691379 /nfs/dbraw/zinc/69/13/79/919691379.db2.gz XGEBQWYKBHAVLN-VQIMIIECSA-N 0 3 411.575 4.339 20 0 HIADHN CC1(c2nc3ccccc3s2)CCN(C[C@H](O)COc2ccccc2F)CC1 ZINC000511105933 919712124 /nfs/dbraw/zinc/71/21/24/919712124.db2.gz GTMMJJZULUFGGU-INIZCTEOSA-N 0 3 400.519 4.229 20 0 HIADHN Cc1cc(Br)cc2cc(C(=O)NCCCCN3C[C@H](C)O[C@@H](C)C3)oc21 ZINC000511125927 919737326 /nfs/dbraw/zinc/73/73/26/919737326.db2.gz NZHVMZSRSWSBGV-GJZGRUSLSA-N 0 3 423.351 4.123 20 0 HIADHN O=C(CCN[C@@H](Cc1ccccc1)c1ccccc1F)NCC(=O)c1ccccc1 ZINC000511165274 919786317 /nfs/dbraw/zinc/78/63/17/919786317.db2.gz NPXBZIOSKXNEMI-QHCPKHFHSA-N 0 3 404.485 4.088 20 0 HIADHN CN(C)C(=O)CC1CCN(Cc2ccc(-c3ccc(Br)cc3)o2)CC1 ZINC000511212243 919824749 /nfs/dbraw/zinc/82/47/49/919824749.db2.gz BCMOKCQCTIVPNM-UHFFFAOYSA-N 0 3 405.336 4.399 20 0 HIADHN C[C@@H](NC(=O)N[C@H](C)C1=CCN(C)CC1)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000511216494 919826788 /nfs/dbraw/zinc/82/67/88/919826788.db2.gz MFBMHBPYTSOWTN-QZTJIDSGSA-N 0 3 411.521 4.415 20 0 HIADHN C[C@@H](NC(=O)NC1(c2ccc(Br)cc2)CCCC1)C1=CCN(C)CC1 ZINC000511229074 919832941 /nfs/dbraw/zinc/83/29/41/919832941.db2.gz PGAMWBNSMTWVOZ-OAHLLOKOSA-N 0 3 406.368 4.168 20 0 HIADHN COc1ccc2c(c1)CN(C(=O)N[C@@H](C)C1=CCN(C)CC1)[C@@H](C1CCCCC1)C2 ZINC000511249823 919850660 /nfs/dbraw/zinc/85/06/60/919850660.db2.gz PLMXLFFHVFLQDH-MHECFPHRSA-N 0 3 411.590 4.362 20 0 HIADHN C[C@H](NC(=O)N(C)[C@H]1CCSc2ccc(Br)cc21)C1=CCN(C)CC1 ZINC000511254691 919856962 /nfs/dbraw/zinc/85/69/62/919856962.db2.gz ROUMRZCFEVJTMC-GUYCJALGSA-N 0 3 424.408 4.278 20 0 HIADHN C[C@H](NC(=O)N1CCC[C@H](Oc2ccc(Cl)c(Cl)c2)C1)C1=CCN(C)CC1 ZINC000511273859 919870414 /nfs/dbraw/zinc/87/04/14/919870414.db2.gz PBHDMAYULIZCJF-YOEHRIQHSA-N 0 3 412.361 4.197 20 0 HIADHN C[C@H](NC(=O)N[C@H]1CCCc2nc(-c3ccc(F)cc3)sc21)C1=CCN(C)CC1 ZINC000511293335 919889745 /nfs/dbraw/zinc/88/97/45/919889745.db2.gz ZAAYYDXTKAICRD-LIRRHRJNSA-N 0 3 414.550 4.276 20 0 HIADHN CN(C)CCN(C(=O)CSc1nnc(-c2ccc(Cl)cc2)o1)C1CCCCC1 ZINC000511298935 919894434 /nfs/dbraw/zinc/89/44/34/919894434.db2.gz ARWZPRIFJWFAIK-UHFFFAOYSA-N 0 3 422.982 4.205 20 0 HIADHN C[C@H](NC(=O)C1(c2cccc(Br)c2)CCCCC1)C1=CCN(C)CC1 ZINC000511335423 919926054 /nfs/dbraw/zinc/92/60/54/919926054.db2.gz VGHSSJGEJDSJGA-INIZCTEOSA-N 0 3 405.380 4.418 20 0 HIADHN CN(C(=O)N[C@H](C[C@H]1CCOC1)c1ccccc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000511369237 919961126 /nfs/dbraw/zinc/96/11/26/919961126.db2.gz ADGQQKSYFGIEKM-QLBJFCOMSA-N 0 3 421.585 4.460 20 0 HIADHN Cc1cc(NC(=O)c2ccccc2Cl)sc1C(=O)N[C@@H](C)C1=CCN(C)CC1 ZINC000511386436 919989594 /nfs/dbraw/zinc/98/95/94/919989594.db2.gz ZFYMNJFPNPYSPU-AWEZNQCLSA-N 0 3 417.962 4.342 20 0 HIADHN CC(C)CNC(=O)c1ccc(NC(=O)NC[C@H](c2ccccc2)N(C)C)cc1Cl ZINC000511513334 920131616 /nfs/dbraw/zinc/13/16/16/920131616.db2.gz OOFFZIWVUCVTNN-HXUWFJFHSA-N 0 3 416.953 4.150 20 0 HIADHN Cc1cnc([C@H](C)NC2CCC(NC(=O)COc3ccc(Cl)cc3)CC2)s1 ZINC000511526340 920146377 /nfs/dbraw/zinc/14/63/77/920146377.db2.gz NYDOLSFCZLBKJP-OOHWJJMZSA-N 0 3 407.967 4.262 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)N[C@@H](CC(F)(F)F)c1ccc(F)cc1 ZINC000511548594 920179935 /nfs/dbraw/zinc/17/99/35/920179935.db2.gz ZDUDQRYQMGMXIK-KRWDZBQOSA-N 0 3 401.404 4.186 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)Nc1cccc(Cl)c1-n1cccn1 ZINC000511572260 920215538 /nfs/dbraw/zinc/21/55/38/920215538.db2.gz JWUMUNRAWLALKU-UHFFFAOYSA-N 0 3 415.900 4.261 20 0 HIADHN CCC(=O)Nc1ccc(Cl)c(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2)c1 ZINC000511580969 920225111 /nfs/dbraw/zinc/22/51/11/920225111.db2.gz OKRHGTKAYXGXNE-UHFFFAOYSA-N 0 3 420.916 4.423 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)Nc1cccc(C(=O)N2CCCCC2)c1 ZINC000511631027 920292469 /nfs/dbraw/zinc/29/24/69/920292469.db2.gz VKFJRTOASVQBTO-QHCPKHFHSA-N 0 3 420.557 4.271 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)c1cscc1Br ZINC000511741839 920416770 /nfs/dbraw/zinc/41/67/70/920416770.db2.gz XCYWZTMQNLCCRS-HNNXBMFYSA-N 0 3 408.365 4.032 20 0 HIADHN CCN1CCN(CCC(=O)Nc2ccc(Oc3ccccc3C(F)(F)F)cc2)CC1 ZINC000511744238 920420691 /nfs/dbraw/zinc/42/06/91/920420691.db2.gz KWBWVUKVSZQRCM-UHFFFAOYSA-N 0 3 421.463 4.464 20 0 HIADHN Cc1ncc(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2c2ccccc2)c(C(C)C)n1 ZINC000511755210 920435201 /nfs/dbraw/zinc/43/52/01/920435201.db2.gz QZNPGYCZTKJCDP-BJKOFHAPSA-N 0 3 414.553 4.306 20 0 HIADHN Fc1ccc([C@@H]2CC[C@H](NCc3ncc(I)s3)C2)cc1 ZINC000511760183 920441282 /nfs/dbraw/zinc/44/12/82/920441282.db2.gz WBRZKMIHICOAOM-YPMHNXCESA-N 0 3 402.276 4.313 20 0 HIADHN Cc1ccc([C@H](NC(=O)CN2C[C@H](c3ccccc3)[C@@H]3COCC[C@H]32)C2CC2)cc1 ZINC000511795938 920489821 /nfs/dbraw/zinc/48/98/21/920489821.db2.gz JITNOSHCRSXKID-TWZJLLKVSA-N 0 3 404.554 4.067 20 0 HIADHN O=c1[nH]c(CN2C[C@H](c3ccccc3)[C@@H]3COCC[C@H]32)nc2c3ccccc3oc21 ZINC000511797605 920491330 /nfs/dbraw/zinc/49/13/30/920491330.db2.gz PAHYZARLGRDTIP-CEXWTWQISA-N 0 3 401.466 4.086 20 0 HIADHN CCN(C)C(=O)c1cccc(C(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)c1 ZINC000512027678 920801902 /nfs/dbraw/zinc/80/19/02/920801902.db2.gz XOIMPMYNFLOVON-FQEVSTJZSA-N 0 3 413.587 4.043 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N[C@@H](C)c1cc(OC)c(OC)cc1F)c1ccsc1 ZINC000512041000 920812604 /nfs/dbraw/zinc/81/26/04/920812604.db2.gz KHLKRYBAXYDFDN-KSSFIOAISA-N 0 3 423.554 4.348 20 0 HIADHN CCCN(CC)C(=O)c1ccc(C(=O)N[C@@H](CN2CCCC2)c2ccccc2)cc1 ZINC000512044578 920815509 /nfs/dbraw/zinc/81/55/09/920815509.db2.gz GJBCPLONPNGQJF-QHCPKHFHSA-N 0 3 407.558 4.126 20 0 HIADHN CC1CCN(CC(=O)N2CCC[C@@H](Cc3nc(C4CCCCCC4)no3)C2)CC1 ZINC000512058602 920828232 /nfs/dbraw/zinc/82/82/32/920828232.db2.gz PAJWGZDXANBXLP-IBGZPJMESA-N 0 3 402.583 4.020 20 0 HIADHN CNC(=O)[C@H](Cc1c[nH]c2ccccc12)N[C@H](C)c1cc(C)c(Br)s1 ZINC000512068640 920836117 /nfs/dbraw/zinc/83/61/17/920836117.db2.gz SVDFCMLKWJYWCI-WBMJQRKESA-N 0 3 420.376 4.308 20 0 HIADHN OC[C@@H](CNCc1cscc1Br)Cc1ccc(C(F)(F)F)cc1 ZINC000512068781 920836342 /nfs/dbraw/zinc/83/63/42/920836342.db2.gz SJPWFNIZKYPKBD-GFCCVEGCSA-N 0 3 408.283 4.470 20 0 HIADHN COc1ccc(CNC2CCN(c3ccccc3OC)CC2)c(Br)c1 ZINC000512100889 920860380 /nfs/dbraw/zinc/86/03/80/920860380.db2.gz WAAIBMTWYAMHIZ-UHFFFAOYSA-N 0 3 405.336 4.225 20 0 HIADHN Cc1ccc(-c2nn(-c3ccc(F)cc3)cc2C(=O)N[C@H](C)C2=CCN(C)CC2)cc1 ZINC000512120884 920873102 /nfs/dbraw/zinc/87/31/02/920873102.db2.gz CFDBTSMJDJTDRB-GOSISDBHSA-N 0 3 418.516 4.367 20 0 HIADHN CC(C)n1ncc2c1nc(-c1cccs1)cc2C(=O)N[C@H](C)C1=CCN(C)CC1 ZINC000512129564 920877656 /nfs/dbraw/zinc/87/76/56/920877656.db2.gz WPACRLMGQYVJSO-OAHLLOKOSA-N 0 3 409.559 4.121 20 0 HIADHN Cc1cc([C@H](C)NCc2ccc(N3CCO[C@@H](C)C3)nc2)sc1Br ZINC000512135228 920882857 /nfs/dbraw/zinc/88/28/57/920882857.db2.gz HAIPLCXVWASXJY-KBPBESRZSA-N 0 3 410.381 4.290 20 0 HIADHN C[C@@H](NC(=O)c1ccccc1CSc1nc2ccccc2[nH]1)C1=CCN(C)CC1 ZINC000512141548 920886579 /nfs/dbraw/zinc/88/65/79/920886579.db2.gz AXFHDSXVTPXVIS-MRXNPFEDSA-N 0 3 406.555 4.235 20 0 HIADHN CN(C)[C@@H](CNC(=O)Cc1csc(Cc2cccc(Cl)c2)n1)c1ccccc1 ZINC000512143446 920887557 /nfs/dbraw/zinc/88/75/57/920887557.db2.gz RGZAOCAUGGJMFP-FQEVSTJZSA-N 0 3 413.974 4.349 20 0 HIADHN O=C(CCN[C@H](CCO)c1ccc(Cl)c(Cl)c1)N1CCCc2ccccc21 ZINC000512153611 920894963 /nfs/dbraw/zinc/89/49/63/920894963.db2.gz UHLYFWYDBDOIGY-LJQANCHMSA-N 0 3 407.341 4.376 20 0 HIADHN OCC[C@H](NC[C@@H](O)COCc1ccc(Cl)cc1)c1ccc(Cl)c(Cl)c1 ZINC000512211208 920956364 /nfs/dbraw/zinc/95/63/64/920956364.db2.gz GTLZSBDZQCQTKJ-APWZRJJASA-N 0 3 418.748 4.238 20 0 HIADHN OCC[C@H](NC[C@@H](O)CO[C@H]1CCCc2ccccc21)c1ccc(Cl)c(Cl)c1 ZINC000512213572 920960783 /nfs/dbraw/zinc/96/07/83/920960783.db2.gz PEAMVURMXDEERL-WTNAPCKOSA-N 0 3 424.368 4.462 20 0 HIADHN O=C(N[C@H](C[C@@H]1CCOC1)c1ccccc1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000512250146 921009815 /nfs/dbraw/zinc/00/98/15/921009815.db2.gz OOXJOBMFCPOLFU-BGWNEDDSSA-N 0 3 410.533 4.322 20 0 HIADHN CC(=O)N(C)C1CCN(Cc2cn(Cc3ccccc3)nc2-c2cccc(C)c2)CC1 ZINC000512285159 921038898 /nfs/dbraw/zinc/03/88/98/921038898.db2.gz GFPFHEIQZNCEPE-UHFFFAOYSA-N 0 3 416.569 4.350 20 0 HIADHN Cc1nn(-c2ccccc2)cc1CN[C@H](C)CC(=O)N(C)Cc1cccc(Cl)c1 ZINC000512314604 921065728 /nfs/dbraw/zinc/06/57/28/921065728.db2.gz OXLSOHZQQURXRS-QGZVFWFLSA-N 0 3 410.949 4.361 20 0 HIADHN COc1ccc(CN2CCC(C(=O)NC3CCCCC3)CC2)cc1OCC(C)C ZINC000512345983 921091749 /nfs/dbraw/zinc/09/17/49/921091749.db2.gz JVCIEGRGWCLALR-UHFFFAOYSA-N 0 3 402.579 4.391 20 0 HIADHN CC1(C)CCc2cc(CN3CCC(C(=O)NCCc4cccs4)CC3)ccc2O1 ZINC000512350222 921096525 /nfs/dbraw/zinc/09/65/25/921096525.db2.gz JZJKEYMRHZXJRK-UHFFFAOYSA-N 0 3 412.599 4.423 20 0 HIADHN CCN1CCN(c2ccccc2CNc2ccc(C(=O)N3CCCCCC3)cc2)CC1 ZINC000512369985 921109824 /nfs/dbraw/zinc/10/98/24/921109824.db2.gz IRMJOPHZUJCWAR-UHFFFAOYSA-N 0 3 420.601 4.457 20 0 HIADHN O=C(NC[C@@H]1CCO[C@H]1c1ccccc1)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000513449115 921816788 /nfs/dbraw/zinc/81/67/88/921816788.db2.gz XQMOBTSZZZUIQD-FKBYEOEOSA-N 0 3 414.496 4.038 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(CN(CCCO)Cc3ccccc3)c2)cc1 ZINC000513488931 921840961 /nfs/dbraw/zinc/84/09/61/921840961.db2.gz CJZDUKXVQIAQTH-UHFFFAOYSA-N 0 3 404.510 4.332 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)Nc1cccc(C(=O)N(C)C)c1)c1ccc(Cl)cc1 ZINC000513601560 921933938 /nfs/dbraw/zinc/93/39/38/921933938.db2.gz WAFRASUETOHBFQ-FQEVSTJZSA-N 0 3 416.953 4.246 20 0 HIADHN COc1ccc2[nH]cc(C3CCN([C@@H](C)C(=O)N4CCc5ccccc54)CC3)c2c1 ZINC000513624546 921952815 /nfs/dbraw/zinc/95/28/15/921952815.db2.gz MHXPIKDMXPITDS-KRWDZBQOSA-N 0 3 403.526 4.334 20 0 HIADHN CC(C)(C)c1nn(-c2ccccc2)cc1CN1CCC[C@H](c2nnc3n2CCC3)C1 ZINC000513643415 921966501 /nfs/dbraw/zinc/96/65/01/921966501.db2.gz UTCPUIPCKIFGEO-SFHVURJKSA-N 0 3 404.562 4.087 20 0 HIADHN CC[C@H](NCc1cccc(NS(C)(=O)=O)c1)c1ccc(OC(F)(F)F)cc1 ZINC000513703524 922024184 /nfs/dbraw/zinc/02/41/84/922024184.db2.gz WWBDPLYFPKIUQF-KRWDZBQOSA-N 0 3 402.438 4.198 20 0 HIADHN CC(=O)Nc1ccc(OC[C@H](O)CN(Cc2ccc([C@H]3C[C@H]3C)o2)C(C)C)cc1 ZINC000513703513 922024421 /nfs/dbraw/zinc/02/44/21/922024421.db2.gz WQZGRKYSFXCQPA-PERKRYKHSA-N 0 3 400.519 4.012 20 0 HIADHN O=C1CCCN1C1CCN(Cc2cn(Cc3ccccc3)nc2-c2ccccc2)CC1 ZINC000513745945 922067582 /nfs/dbraw/zinc/06/75/82/922067582.db2.gz KMOXPGBRENDORB-UHFFFAOYSA-N 0 3 414.553 4.185 20 0 HIADHN COc1ccc(CCCC(=O)NC[C@@H](c2cccs2)N2CCCC2)c(OC)c1 ZINC000513807117 922132457 /nfs/dbraw/zinc/13/24/57/922132457.db2.gz VRWCOFDUOHWCBL-IBGZPJMESA-N 0 3 402.560 4.041 20 0 HIADHN COc1cc(Cl)c(C(=O)Nc2ccc(CCN3CCSCC3)cc2)cc1OC ZINC000513825592 922151379 /nfs/dbraw/zinc/15/13/79/922151379.db2.gz FWJNZUOXQRSYPG-UHFFFAOYSA-N 0 3 420.962 4.201 20 0 HIADHN CN1CCN(CCCNC(=O)Nc2cccc(C(F)F)c2)[C@H](c2ccccc2)C1 ZINC000513920012 922242860 /nfs/dbraw/zinc/24/28/60/922242860.db2.gz IGIMXRVMSRQDRK-FQEVSTJZSA-N 0 3 402.489 4.125 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)C[C@@H](C)c1c(C)noc1C ZINC000513949158 922268208 /nfs/dbraw/zinc/26/82/08/922268208.db2.gz WJVFLEMJIWDSSY-IIBYNOLFSA-N 0 3 421.545 4.376 20 0 HIADHN FC1(F)CCC[C@H](CN2CCN(CCCc3nc(-c4cccs4)no3)CC2)C1 ZINC000513961428 922279523 /nfs/dbraw/zinc/27/95/23/922279523.db2.gz CWMVZXFYBNPHSD-INIZCTEOSA-N 0 3 410.534 4.174 20 0 HIADHN O=C(CCCOc1ccccc1)Nc1ccc(CN[C@@H]2CCCc3n[nH]cc32)cc1 ZINC000514094423 922417370 /nfs/dbraw/zinc/41/73/70/922417370.db2.gz NCDSQFQPEVSGDG-JOCHJYFZSA-N 0 3 404.514 4.375 20 0 HIADHN CC[C@@H](NCc1ccc(N2CCO[C@H](C)C2)nc1)c1ccc(OC(F)(F)F)cc1 ZINC000514095257 922418967 /nfs/dbraw/zinc/41/89/67/922418967.db2.gz QCOINBHPTNYYDM-DNVCBOLYSA-N 0 3 409.452 4.446 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)NCC2(c3ccccc3C)CCOCC2)N(C)C)cc1 ZINC000514166411 922506491 /nfs/dbraw/zinc/50/64/91/922506491.db2.gz CKIYZOZSFLPZQU-XMMPIXPASA-N 0 3 423.601 4.208 20 0 HIADHN CCCN(C(=O)NCc1noc2c1CCCC2)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000514174661 922512890 /nfs/dbraw/zinc/51/28/90/922512890.db2.gz PAXCVEKOJSSOLB-FQEVSTJZSA-N 0 3 410.562 4.140 20 0 HIADHN Cc1ccccc1CN(Cc1cccnc1)C(=O)NC[C@@H](Cc1ccccc1)N(C)C ZINC000514176549 922515090 /nfs/dbraw/zinc/51/50/90/922515090.db2.gz RIBKHSFTPCTUGJ-RUZDIDTESA-N 0 3 416.569 4.275 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N[C@@H](C)c2ccc(Br)cc2)N(C)C)cc1 ZINC000514181130 922520064 /nfs/dbraw/zinc/52/00/64/922520064.db2.gz ZUUAZXZYSHANMD-HNAYVOBHSA-N 0 3 404.352 4.421 20 0 HIADHN CC(C)[C@H]1C[C@H](CC(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)CCO1 ZINC000514188726 922528950 /nfs/dbraw/zinc/52/89/50/922528950.db2.gz HCOHFNXMNDTQDB-UYAOXDASSA-N 0 3 414.512 4.437 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)N3CC[C@H](C(F)(F)F)C4(CCC4)C3)CC2)c1 ZINC000514217449 922551282 /nfs/dbraw/zinc/55/12/82/922551282.db2.gz CLUVBWANTDDSDW-FQEVSTJZSA-N 0 3 423.523 4.088 20 0 HIADHN C[C@@H](NC(=O)N(CCN(C)C)Cc1ccccc1)c1ccc(Br)cc1 ZINC000514438929 922627086 /nfs/dbraw/zinc/62/70/86/922627086.db2.gz YMWPIRIIKQQLDR-MRXNPFEDSA-N 0 3 404.352 4.284 20 0 HIADHN COc1ccc([C@@H](CNC(=O)CN(C)[C@H](C)c2ccccc2)N2CCCCC2)cc1 ZINC000514745347 922778345 /nfs/dbraw/zinc/77/83/45/922778345.db2.gz NYCMKKATNWUKKA-HYBUGGRVSA-N 0 3 409.574 4.031 20 0 HIADHN CSc1ccc([C@H](CNC(=O)[C@H]2C[C@H]2c2cc(F)c(F)c(F)c2)N(C)C)cc1 ZINC000514786121 922802735 /nfs/dbraw/zinc/80/27/35/922802735.db2.gz WTMRELFRUOJIOB-BXWFABGCSA-N 0 3 408.489 4.348 20 0 HIADHN Cc1nc(COc2ccccc2C(=O)N[C@H](C)CN(C)Cc2ccccc2)cs1 ZINC000514817050 922812095 /nfs/dbraw/zinc/81/20/95/922812095.db2.gz UMCNMZNZOFZHIN-QGZVFWFLSA-N 0 3 409.555 4.281 20 0 HIADHN COc1ccc(C[C@](C)(O)CN[C@H](C)c2sccc2Br)cc1OC ZINC000514892756 922835057 /nfs/dbraw/zinc/83/50/57/922835057.db2.gz AVEIZRAUYIQQIE-XIKOKIGWSA-N 0 3 414.365 4.172 20 0 HIADHN C[C@@H]1C[C@@H]1N1CCN(C(=O)c2cc(F)c(Br)cc2Cl)C[C@@H](C)C1 ZINC000515079670 922896138 /nfs/dbraw/zinc/89/61/38/922896138.db2.gz ACZKWBSGRCWEDU-USBNGQNGSA-N 0 3 403.723 4.044 20 0 HIADHN CC(C)Oc1ccc([C@H](C)N[C@@H]2CCCN(S(=O)(=O)c3cccs3)C2)cc1 ZINC000515082002 922897432 /nfs/dbraw/zinc/89/74/32/922897432.db2.gz SREIXJNPMZBCRR-FUHWJXTLSA-N 0 3 408.589 4.039 20 0 HIADHN Cc1cccc(C)c1NC(=O)CNC(=O)[C@H](C)N[C@@H](C)c1ccc(F)c2ccccc21 ZINC000515090128 922901574 /nfs/dbraw/zinc/90/15/74/922901574.db2.gz RXMPPCMMMMJIOD-ROUUACIJSA-N 0 3 421.516 4.390 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N(C)[C@@H](C)c3ccc(OC)cc3)c(C)c2)CC1 ZINC000515112590 922925669 /nfs/dbraw/zinc/92/56/69/922925669.db2.gz KTZLBZJFHWKXFQ-IBGZPJMESA-N 0 3 410.562 4.370 20 0 HIADHN Cc1cc(NC(=O)NC[C@@H](c2ccccc2)N2CCCC2)n(Cc2ccccc2)n1 ZINC000515117766 922930727 /nfs/dbraw/zinc/93/07/27/922930727.db2.gz ABKSHXMJFMBVIE-QFIPXVFZSA-N 0 3 403.530 4.198 20 0 HIADHN Cc1c(C(=O)N[C@H](CN2CCCC2)c2ccccc2)cnn1-c1ccc(F)cc1F ZINC000515206566 922991498 /nfs/dbraw/zinc/99/14/98/922991498.db2.gz KVTRNMRCAOZYEF-OAQYLSRUSA-N 0 3 410.468 4.026 20 0 HIADHN COc1ccc([C@H](Cc2ccccc2)NCc2ccc(N3CCO[C@H](C)C3)nc2)cc1 ZINC000515257048 923022963 /nfs/dbraw/zinc/02/29/63/923022963.db2.gz JKOLYQLJGZXTDU-NLFFAJNJSA-N 0 3 417.553 4.389 20 0 HIADHN COc1ccc([C@H](CNC(=O)NCCN2CCCCC2)c2c[nH]c3ccccc32)cc1 ZINC000515289728 923036896 /nfs/dbraw/zinc/03/68/96/923036896.db2.gz IUKHZFJQZGDMDB-QFIPXVFZSA-N 0 3 420.557 4.094 20 0 HIADHN C[C@@H](NC(=O)NC[C@@H](c1ccccc1)N(C)C)c1nc2ccccc2n1C(F)F ZINC000515296148 923038888 /nfs/dbraw/zinc/03/88/88/923038888.db2.gz XJBZNLUYENXXJJ-KDOFPFPSSA-N 0 3 401.461 4.095 20 0 HIADHN CCc1ccc([C@H](CNC(=O)Nc2nc(CN3CCCCC3)cs2)N(C)C)cc1 ZINC000515384362 923073520 /nfs/dbraw/zinc/07/35/20/923073520.db2.gz CFFCNPYSDYTIMH-FQEVSTJZSA-N 0 3 415.607 4.116 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)Nc2nc(CN3CCCCC3)cs2)N(C)C)cc1 ZINC000515384369 923074125 /nfs/dbraw/zinc/07/41/25/923074125.db2.gz CFFCNPYSDYTIMH-HXUWFJFHSA-N 0 3 415.607 4.116 20 0 HIADHN CN(C(=O)NCCCN1CCN(C)C[C@@H]1c1ccccc1)[C@@H]1CCCc2ccccc21 ZINC000515465590 923120403 /nfs/dbraw/zinc/12/04/03/923120403.db2.gz VGBQTQBRRLMEIY-JWQCQUIFSA-N 0 3 420.601 4.084 20 0 HIADHN CC(C)c1ccccc1NC(=O)[C@@H](C)N[C@H](C)c1ccc(OCC(=O)NC2CC2)cc1 ZINC000515759581 923332502 /nfs/dbraw/zinc/33/25/02/923332502.db2.gz PXYWGZNRODSSJR-QZTJIDSGSA-N 0 3 423.557 4.145 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)N1CCC[C@@H]1c1cccc(F)c1 ZINC000515791407 923351570 /nfs/dbraw/zinc/35/15/70/923351570.db2.gz ZAKRTANQPNVLRL-XMMPIXPASA-N 0 3 424.564 4.275 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)N(CC1CCCCC1)C1CC1 ZINC000515794148 923353048 /nfs/dbraw/zinc/35/30/48/923353048.db2.gz AKLSIJDAKAIRJE-UHFFFAOYSA-N 0 3 412.622 4.343 20 0 HIADHN COc1cccc([C@@H](CNC(=O)N[C@H](C)c2c(F)cccc2F)N2CCCC2)c1 ZINC000515821054 923372657 /nfs/dbraw/zinc/37/26/57/923372657.db2.gz HPEYMZPNZUBMHM-FOIQADDNSA-N 0 3 403.473 4.171 20 0 HIADHN COc1cccc([C@H](CNC(=O)N[C@H](C)c2c(F)cccc2F)N2CCCC2)c1 ZINC000515821056 923373978 /nfs/dbraw/zinc/37/39/78/923373978.db2.gz HPEYMZPNZUBMHM-QRWLVFNGSA-N 0 3 403.473 4.171 20 0 HIADHN CC1CCN([C@H](CNC(=O)Nc2nnc(-c3ccco3)s2)c2ccccc2)CC1 ZINC000516078320 923532298 /nfs/dbraw/zinc/53/22/98/923532298.db2.gz LMGKSKOELLKFCG-QGZVFWFLSA-N 0 3 411.531 4.393 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)cc1OC ZINC000516164954 923584021 /nfs/dbraw/zinc/58/40/21/923584021.db2.gz IHPLPVNYHGNMLQ-COPCDDAFSA-N 0 3 423.557 4.386 20 0 HIADHN COc1ccc([C@@H](CNC(=O)N[C@@H]2CCc3c2cccc3Cl)N2CCCC2)cc1 ZINC000516226049 923613686 /nfs/dbraw/zinc/61/36/86/923613686.db2.gz RIJKTPWZBKKGJC-FGZHOGPDSA-N 0 3 413.949 4.472 20 0 HIADHN CC(=O)Nc1ccc(S[C@H](C)C(=O)N[C@@H](CN2CCCC2)c2ccccc2)cc1 ZINC000516391970 923706250 /nfs/dbraw/zinc/70/62/50/923706250.db2.gz XYOFHADGCUITDP-VGSWGCGISA-N 0 3 411.571 4.079 20 0 HIADHN C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000516437365 923731631 /nfs/dbraw/zinc/73/16/31/923731631.db2.gz CNFLASWUIVBORU-HYVNUMGLSA-N 0 3 404.423 4.333 20 0 HIADHN C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000516437364 923732083 /nfs/dbraw/zinc/73/20/83/923732083.db2.gz CNFLASWUIVBORU-DJIMGWMZSA-N 0 3 404.423 4.333 20 0 HIADHN C[C@@H](CNC(=O)CSc1nnc(-c2ccc3ccccc3c2)o1)N1CCCC[C@H]1C ZINC000516491431 923757493 /nfs/dbraw/zinc/75/74/93/923757493.db2.gz GVIKOUKJMVDDAY-SJORKVTESA-N 0 3 424.570 4.361 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)Nc1ccc(N(C)C)cc1C(F)(F)F ZINC000516509503 923769391 /nfs/dbraw/zinc/76/93/91/923769391.db2.gz ROCLZKRBLQYCKT-OAHLLOKOSA-N 0 3 408.468 4.413 20 0 HIADHN COCCCN(Cc1ccncc1)Cc1ccc(-n2ccc(C(F)(F)F)n2)cc1 ZINC000516603525 923811713 /nfs/dbraw/zinc/81/17/13/923811713.db2.gz BZHOXXPHVDYLAH-UHFFFAOYSA-N 0 3 404.436 4.325 20 0 HIADHN CC[C@H](CNC(=O)NC[C@H]1CCCO[C@@H]1c1ccccc1)N1CCc2ccccc2C1 ZINC000516716827 923861224 /nfs/dbraw/zinc/86/12/24/923861224.db2.gz IXHJQIQBLQRUDO-QLBJFCOMSA-N 0 3 421.585 4.290 20 0 HIADHN COC(=O)c1ccccc1N(C)C(=O)CN1CCC[C@@H]1c1cccc2ccccc21 ZINC000516746966 923874163 /nfs/dbraw/zinc/87/41/63/923874163.db2.gz XILQVVTYOVRATG-HSZRJFAPSA-N 0 3 402.494 4.426 20 0 HIADHN CCCN(C)[C@H](CNC(=O)NCc1csc([C@H](C)OC)n1)c1ccc(Cl)cc1 ZINC000516798862 923891064 /nfs/dbraw/zinc/89/10/64/923891064.db2.gz CJMINCAVDSRWCM-KBXCAEBGSA-N 0 3 424.998 4.386 20 0 HIADHN C[C@@H]1[C@H](NC(=O)N2CCC(Nc3ccc(F)cc3)CC2)CCN1Cc1ccccc1 ZINC000516989902 923954279 /nfs/dbraw/zinc/95/42/79/923954279.db2.gz SSPLUKXPRYTSOI-WZONZLPQSA-N 0 3 410.537 4.075 20 0 HIADHN C[C@@H]1[C@H](NC(=O)c2ccc(-c3nc(C4CC4)no3)cc2)CCN1Cc1ccccc1 ZINC000517021851 923966889 /nfs/dbraw/zinc/96/68/89/923966889.db2.gz YYUJSYAYBIDNAC-IIBYNOLFSA-N 0 3 402.498 4.007 20 0 HIADHN COc1ccc([C@H](CNC(=O)NCc2nc(C(C)(C)C)cs2)N2CCCC2)cc1 ZINC000517103108 923998636 /nfs/dbraw/zinc/99/86/36/923998636.db2.gz BFKPVZDXHINMLP-SFHVURJKSA-N 0 3 416.591 4.086 20 0 HIADHN CC[C@H](NC(=O)NC[C@H](c1cccc(OC)c1)N1CCCC1)c1nc(C)cs1 ZINC000517136873 924020485 /nfs/dbraw/zinc/02/04/85/924020485.db2.gz TZFRYPWFYPQNRG-RBUKOAKNSA-N 0 3 402.564 4.048 20 0 HIADHN C[C@@H]1[C@H](NC(=O)N(Cc2cccs2)C[C@@H]2CCCO2)CCN1Cc1ccccc1 ZINC000517255491 924064186 /nfs/dbraw/zinc/06/41/86/924064186.db2.gz LUKITIPFQJFXKE-KAGYGMCKSA-N 0 3 413.587 4.102 20 0 HIADHN Cc1cc(C(=O)NC(C)C)ccc1NC(=O)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000517304193 924090752 /nfs/dbraw/zinc/09/07/52/924090752.db2.gz ZHGNWCTXIHXKGT-QFIPXVFZSA-N 0 3 408.546 4.092 20 0 HIADHN CN(C)Cc1cccc(NC(=O)c2nc(-c3cccs3)n(-c3ccccc3)n2)c1 ZINC000517303753 924090781 /nfs/dbraw/zinc/09/07/81/924090781.db2.gz RZOFHWRUNYJMHP-UHFFFAOYSA-N 0 3 403.511 4.310 20 0 HIADHN CC1CCN([C@@H](CNC(=O)Nc2ccccc2N2CCCC2=O)c2ccccc2)CC1 ZINC000517315317 924098104 /nfs/dbraw/zinc/09/81/04/924098104.db2.gz LIIZVXKPCKPZEA-QHCPKHFHSA-N 0 3 420.557 4.408 20 0 HIADHN NS(=O)(=O)c1ccc2c(c1)[C@@H](NCCOc1ccccc1-c1ccccc1)CCC2 ZINC000517349778 924122146 /nfs/dbraw/zinc/12/21/46/924122146.db2.gz TTZMTVRNMRFRHA-QHCPKHFHSA-N 0 3 422.550 4.047 20 0 HIADHN O=S(=O)(c1c(Cl)cc(Cl)cc1Cl)N1CCCC[C@H](N2CCCC2)C1 ZINC000517415651 924165775 /nfs/dbraw/zinc/16/57/75/924165775.db2.gz XMJMRKYCKNIFAI-ZDUSSCGKSA-N 0 3 411.782 4.286 20 0 HIADHN Cc1ccc(NC(=O)C(C)C)cc1NC(=O)N[C@@H]1CCN(Cc2ccccc2)[C@@H]1C ZINC000517420490 924170891 /nfs/dbraw/zinc/17/08/91/924170891.db2.gz FDMCWTSQNRBISU-WIYYLYMNSA-N 0 3 408.546 4.374 20 0 HIADHN C[C@H](CNC(=O)N1CCC(C(=O)c2ccc(Cl)cc2)CC1)N1CCC[C@H](C)C1 ZINC000517523448 924243813 /nfs/dbraw/zinc/24/38/13/924243813.db2.gz YFUNAPKVXHDRCK-DLBZAZTESA-N 0 3 405.970 4.065 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NC1CCN(c2ccccc2)CC1)c1cccc(OC)c1 ZINC000517540545 924253611 /nfs/dbraw/zinc/25/36/11/924253611.db2.gz DBHFPJFAMJHLQA-DEOSSOPVSA-N 0 3 424.589 4.046 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)NCc2ccccc2OC(F)(F)F)C1 ZINC000517541787 924254777 /nfs/dbraw/zinc/25/47/77/924254777.db2.gz WXVZMSCNIPSZLG-CRAIPNDOSA-N 0 3 407.436 4.220 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)NCc2ccccc2OC(F)(F)F)C1 ZINC000517541789 924255145 /nfs/dbraw/zinc/25/51/45/924255145.db2.gz WXVZMSCNIPSZLG-QAPCUYQASA-N 0 3 407.436 4.220 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)NCc2ccccc2OCC(F)(F)F)C1 ZINC000517542950 924255223 /nfs/dbraw/zinc/25/52/23/924255223.db2.gz GWEQULQUIOODDO-VQIMIIECSA-N 0 3 421.463 4.262 20 0 HIADHN Cc1ccc(C(=O)NC[C@H](C)N(C)Cc2ccccc2)cc1NC(=O)c1ccco1 ZINC000517658145 926766555 /nfs/dbraw/zinc/76/65/55/926766555.db2.gz BMTWHMPBDJSHAJ-SFHVURJKSA-N 0 3 405.498 4.091 20 0 HIADHN CCCC(=O)Nc1cccc(CNC(=O)[C@@H](C)N2CCC(Cc3ccccc3)CC2)c1 ZINC000517664435 926770853 /nfs/dbraw/zinc/77/08/53/926770853.db2.gz YZJYBFYPYWTFST-HXUWFJFHSA-N 0 3 421.585 4.385 20 0 HIADHN CC(C)COc1cccc(CNC(=O)N(CCN(C)C)Cc2ccccc2F)c1 ZINC000517684852 926788502 /nfs/dbraw/zinc/78/85/02/926788502.db2.gz ZLXIHWYUUJPIGR-UHFFFAOYSA-N 0 3 401.526 4.134 20 0 HIADHN C[C@H](CNC(=O)N(C)CCc1ccc(Br)cc1)N(C)Cc1ccccc1 ZINC000517703947 926804145 /nfs/dbraw/zinc/80/41/45/926804145.db2.gz VZNRZYSXGSVCMQ-QGZVFWFLSA-N 0 3 418.379 4.154 20 0 HIADHN CSc1ccc([C@@H](CNC(=O)c2ccc(NC(C)=O)c(SC)c2)N(C)C)cc1 ZINC000517725058 926814868 /nfs/dbraw/zinc/81/48/68/926814868.db2.gz HYVQQYPBQBCSTO-LJQANCHMSA-N 0 3 417.600 4.122 20 0 HIADHN Cc1cc(NC(=O)c2cccc(F)c2)sc1C(=O)NCC(C)(C)N1CCCCC1 ZINC000517970849 926916324 /nfs/dbraw/zinc/91/63/24/926916324.db2.gz QFRAKOQICDKIRO-UHFFFAOYSA-N 0 3 417.550 4.442 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)[C@@H]1CCO[C@H]1c1ccc(Cl)c(F)c1)c1ccco1 ZINC000517993029 926935574 /nfs/dbraw/zinc/93/55/74/926935574.db2.gz XNGACOMEWNCEKA-XAMZUMDUSA-N 0 3 408.901 4.395 20 0 HIADHN O=C(NCc1nc2cc(Cl)ccc2s1)N1CCCN(Cc2ccccc2)CC1 ZINC000518009470 926949881 /nfs/dbraw/zinc/94/98/81/926949881.db2.gz VNXUIKYABUJAQY-UHFFFAOYSA-N 0 3 414.962 4.367 20 0 HIADHN Cc1ccc(-c2noc([C@@H](C)NC[C@H]3CN(Cc4ccccc4)CCCO3)n2)cc1F ZINC000518348988 927212238 /nfs/dbraw/zinc/21/22/38/927212238.db2.gz KCXWJXRVSMSCLE-NQIIRXRSSA-N 0 3 424.520 4.126 20 0 HIADHN Cc1nn(-c2ccc(Cl)c(Cl)c2)c(C)c1CC(=O)N(C)[C@@H]1CCN(C2CC2)C1 ZINC000518366563 927223279 /nfs/dbraw/zinc/22/32/79/927223279.db2.gz ZNFTXTNOSHDORF-QGZVFWFLSA-N 0 3 421.372 4.034 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)NCc2cccc(OCC(F)(F)F)c2)C1 ZINC000518403656 927244882 /nfs/dbraw/zinc/24/48/82/927244882.db2.gz QPMPJUFQKFUZTO-QFBILLFUSA-N 0 3 421.463 4.262 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)NCc2cc(F)ccc2Br)C1 ZINC000518407098 927247109 /nfs/dbraw/zinc/24/71/09/927247109.db2.gz AFKBBGIFDYYFTD-KBXCAEBGSA-N 0 3 420.326 4.223 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N(Cc2ccccc2)C[C@@H]2CCCO2)C1 ZINC000518406786 927247849 /nfs/dbraw/zinc/24/78/49/927247849.db2.gz CMFIVKBFOGCWRW-QDSKXPNFSA-N 0 3 407.558 4.213 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)NCc2ccc(OC(F)(F)F)cc2)C1 ZINC000518409646 927250011 /nfs/dbraw/zinc/25/00/11/927250011.db2.gz LGSVUCCWMFKLCK-YJBOKZPZSA-N 0 3 407.436 4.220 20 0 HIADHN Cc1ccc(-c2nn(-c3ccc(F)cc3)cc2C(=O)N(C)[C@H]2CCN(C3CC3)C2)cc1 ZINC000518428715 927264238 /nfs/dbraw/zinc/26/42/38/927264238.db2.gz VWRXVTWHPLIRTO-QFIPXVFZSA-N 0 3 418.516 4.296 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)N1CCC[C@H]1CCc1ccccc1 ZINC000518457698 927288125 /nfs/dbraw/zinc/28/81/25/927288125.db2.gz JWADODJCCYTGJT-VWLOTQADSA-N 0 3 405.586 4.213 20 0 HIADHN Cc1noc(-c2ccc(C)c(NC(=O)N[C@H]3CCN([C@H](C)c4ccccc4)C3)c2)n1 ZINC000518474201 927297559 /nfs/dbraw/zinc/29/75/59/927297559.db2.gz ZVFBSKZPYUXPOO-UZLBHIALSA-N 0 3 405.502 4.310 20 0 HIADHN CC[C@H](Oc1ccccc1C(C)C)C(=O)N1CCC(CN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000518500217 927310477 /nfs/dbraw/zinc/31/04/77/927310477.db2.gz IZWWGZZXBLWMIX-JTAQYXEDSA-N 0 3 416.606 4.315 20 0 HIADHN CC(C)c1ccc(-n2ccnc2SCC(=O)N2CC[C@@H](N3CCCCC3)C2)cc1 ZINC000518619655 927383745 /nfs/dbraw/zinc/38/37/45/927383745.db2.gz DLFKDCPXTLQRRR-OAQYLSRUSA-N 0 3 412.603 4.175 20 0 HIADHN CC(C)c1ccc(-n2ccnc2SCC(=O)N2CC[C@H](N3CCCCC3)C2)cc1 ZINC000518619653 927384082 /nfs/dbraw/zinc/38/40/82/927384082.db2.gz DLFKDCPXTLQRRR-NRFANRHFSA-N 0 3 412.603 4.175 20 0 HIADHN Cc1cc(C)n(-c2cncc(N3CCN(C(c4ccccc4)c4ccccc4)CC3)n2)n1 ZINC000518646008 927400334 /nfs/dbraw/zinc/40/03/34/927400334.db2.gz AMBXKCWKZLVIQY-UHFFFAOYSA-N 0 3 424.552 4.191 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2ccc(C(=O)NC(C)C)c(C)c2)N2CCCC2)cc1 ZINC000518720130 927453367 /nfs/dbraw/zinc/45/33/67/927453367.db2.gz SFYHYCKJHYZUPX-QHCPKHFHSA-N 0 3 422.573 4.400 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1ccc(C)c(C(=O)NC(C)C)c1)c1ccsc1 ZINC000518720200 927453926 /nfs/dbraw/zinc/45/39/26/927453926.db2.gz UOPQXBLEANQDMY-HXUWFJFHSA-N 0 3 416.591 4.399 20 0 HIADHN O=C(Nc1cccc(CNC[C@H](O)COCC2CC2)c1)c1ccc(Cl)cc1Cl ZINC000518785118 927490043 /nfs/dbraw/zinc/49/00/43/927490043.db2.gz NXBDKLPVNWEBNZ-SFHVURJKSA-N 0 3 423.340 4.123 20 0 HIADHN C[C@@H](CN1CCN(C)CC1)NCc1c(Cl)cccc1OCc1ccccc1Cl ZINC000518793997 927497228 /nfs/dbraw/zinc/49/72/28/927497228.db2.gz IWMDMXIQCRJCOB-KRWDZBQOSA-N 0 3 422.400 4.298 20 0 HIADHN Cc1nc(C(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)c(-c2ccccc2)o1 ZINC000518821245 927517061 /nfs/dbraw/zinc/51/70/61/927517061.db2.gz UWMZDJAHHVLINP-OAQYLSRUSA-N 0 3 407.514 4.470 20 0 HIADHN COc1cccc(CN(C[C@H](O)COc2ccc3ccccc3c2)C[C@H]2CCCO2)c1 ZINC000518830486 927527506 /nfs/dbraw/zinc/52/75/06/927527506.db2.gz MBYQWNMBKGTHOK-JYFHCDHNSA-N 0 3 421.537 4.269 20 0 HIADHN CSc1ccc(Cl)cc1NC(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000518838698 927537689 /nfs/dbraw/zinc/53/76/89/927537689.db2.gz LHQMEZBTXYDUPX-GASCZTMLSA-N 0 3 411.999 4.415 20 0 HIADHN CCN(C(=O)c1ccc2c(c1)SCC(=O)N2)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000518847528 927549545 /nfs/dbraw/zinc/54/95/45/927549545.db2.gz PVWLRCLRAWDRGZ-VQIMIIECSA-N 0 3 409.555 4.028 20 0 HIADHN CC[C@H](C)c1ccc(S(=O)(=O)Nc2ccc(N3CCN(CC)CC3)cc2C)cc1 ZINC000518860220 927565855 /nfs/dbraw/zinc/56/58/55/927565855.db2.gz UAJBMZVNJHKEHM-SFHVURJKSA-N 0 3 415.603 4.451 20 0 HIADHN O=C(CN[C@@H](c1cccc(C(F)(F)F)c1)C1CCOCC1)NC(C1CC1)C1CC1 ZINC000519008455 927688565 /nfs/dbraw/zinc/68/85/65/927688565.db2.gz GYTMRAROVNWODR-HXUWFJFHSA-N 0 3 410.480 4.068 20 0 HIADHN COc1ccc([C@H](Cc2ccc(F)cc2)N[C@@H](C)C(=O)Nc2c(C)nn(C)c2C)cc1 ZINC000519064249 927742383 /nfs/dbraw/zinc/74/23/83/927742383.db2.gz PUCXLQPLFJTUDP-AOMKIAJQSA-N 0 3 424.520 4.085 20 0 HIADHN CCCN(CC)C(=O)c1ccc(C(=O)NC[C@H](c2ccccc2)N2CCCC2)cc1 ZINC000519085229 927758185 /nfs/dbraw/zinc/75/81/85/927758185.db2.gz SVKXMQNIQCNCKO-HSZRJFAPSA-N 0 3 407.558 4.126 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccc(F)c2)C1)N1CCC(COc2ccccc2)CC1 ZINC000519110758 927779349 /nfs/dbraw/zinc/77/93/49/927779349.db2.gz QLMHYRQQZRVQPU-JOCHJYFZSA-N 0 3 410.533 4.355 20 0 HIADHN COC(=O)CCc1ccc(NC(=O)N(CCN(C)C)Cc2cccc(Cl)c2)cc1 ZINC000519198040 927822448 /nfs/dbraw/zinc/82/24/48/927822448.db2.gz ZWPJWKLREZRDGI-UHFFFAOYSA-N 0 3 417.937 4.041 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCC(F)(F)c3ccccc3)c(C)c2)CC1 ZINC000519235087 927840026 /nfs/dbraw/zinc/84/00/26/927840026.db2.gz WVJMHMBVDNEJGY-UHFFFAOYSA-N 0 3 402.489 4.050 20 0 HIADHN C[C@@H]1CCCN(Cc2csc(NC(=O)N3CCN(CC4CCCCC4)CC3)n2)C1 ZINC000519261967 927853940 /nfs/dbraw/zinc/85/39/40/927853940.db2.gz KASAGGQDKKSSOR-GOSISDBHSA-N 0 3 419.639 4.105 20 0 HIADHN Cc1sc2ncnc(SCC(=O)NC[C@@H](c3ccc(C)cc3)N(C)C)c2c1C ZINC000519281175 927862618 /nfs/dbraw/zinc/86/26/18/927862618.db2.gz AHUXULQNYZMTMM-KRWDZBQOSA-N 0 3 414.600 4.128 20 0 HIADHN Cc1ccc([C@H](CNC(=O)NCc2nc3cc(Cl)ccc3s2)N(C)C)cc1 ZINC000519312907 927876449 /nfs/dbraw/zinc/87/64/49/927876449.db2.gz ALVOOKTUBPIXBN-KRWDZBQOSA-N 0 3 402.951 4.360 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000519410798 927929131 /nfs/dbraw/zinc/92/91/31/927929131.db2.gz ONAXIKHPCWTSAS-UHFFFAOYSA-N 0 3 412.824 4.122 20 0 HIADHN COCCOc1c(Cl)cccc1NC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000519421622 927936324 /nfs/dbraw/zinc/93/63/24/927936324.db2.gz NYKUFEWIMYZAEU-KRWDZBQOSA-N 0 3 420.912 4.355 20 0 HIADHN COc1ccc(Cl)cc1NCCC(=O)N[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000519432299 927944026 /nfs/dbraw/zinc/94/40/26/927944026.db2.gz DPJVUVBIXIGRTR-APWZRJJASA-N 0 3 401.938 4.102 20 0 HIADHN CC[C@H](NC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1)c1ccc2c(c1)OCCO2 ZINC000519440119 927948309 /nfs/dbraw/zinc/94/83/09/927948309.db2.gz JKEIPABPRKHTKS-FPOVZHCZSA-N 0 3 412.505 4.076 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)NC[C@H]1CCCc2ccccc21 ZINC000519505608 927998812 /nfs/dbraw/zinc/99/88/12/927998812.db2.gz HZAQPLCDBIKPPF-LJQANCHMSA-N 0 3 401.501 4.158 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)Nc1ccc(C(=O)N2CCCC[C@H]2C)cc1 ZINC000519555230 928013352 /nfs/dbraw/zinc/01/33/52/928013352.db2.gz HLSUWATXGUCSIN-WOJBJXKFSA-N 0 3 422.573 4.343 20 0 HIADHN FC(F)(F)C12CCC(NCc3ncc(I)s3)(CC1)CC2 ZINC000519566091 928019141 /nfs/dbraw/zinc/01/91/41/928019141.db2.gz IBUKQKGPXBUNJW-UHFFFAOYSA-N 0 3 416.250 4.493 20 0 HIADHN CN(C)Cc1cccc(C(=O)NC2(Cc3ccc(F)cc3Cl)CCOCC2)c1 ZINC000519794548 928079817 /nfs/dbraw/zinc/07/98/17/928079817.db2.gz SYMGDNHDRVOXIY-UHFFFAOYSA-N 0 3 404.913 4.062 20 0 HIADHN COc1cc(NC(=O)CCNCc2ccc(-c3ccccc3)o2)cc(OC)c1OC ZINC000519803583 928082628 /nfs/dbraw/zinc/08/26/28/928082628.db2.gz VZOWDWVYVLDYCB-UHFFFAOYSA-N 0 3 410.470 4.091 20 0 HIADHN Cc1cccc(C)c1NC(=O)CN[C@H]1CCN(C(C)C)[C@H]1c1ccc(F)c(F)c1 ZINC000519835315 928086834 /nfs/dbraw/zinc/08/68/34/928086834.db2.gz FVVZZQLSAUFTKJ-REWPJTCUSA-N 0 3 401.501 4.334 20 0 HIADHN Cc1noc(C)c1COc1ccc(CC(=O)N(CCN(C)C)c2ccccc2)cc1 ZINC000519899004 928134542 /nfs/dbraw/zinc/13/45/42/928134542.db2.gz QYBACFUVNGNDAQ-UHFFFAOYSA-N 0 3 407.514 4.008 20 0 HIADHN Cc1sc2nc(C)nc(SCC(=O)N(CCN(C)C)c3ccccc3)c2c1C ZINC000519901408 928136588 /nfs/dbraw/zinc/13/65/88/928136588.db2.gz VBQVZMTXEPTQHE-UHFFFAOYSA-N 0 3 414.600 4.303 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N2CCc3[nH]c4ccccc4c3C2)N2CCCC2)cc1 ZINC000519935759 928170494 /nfs/dbraw/zinc/17/04/94/928170494.db2.gz QYQGWGXVACFUOV-DEOSSOPVSA-N 0 3 402.542 4.381 20 0 HIADHN Cc1nc(COc2ccccc2C(=O)NC[C@@H](c2ccc(C)cc2)N(C)C)cs1 ZINC000520061895 928285455 /nfs/dbraw/zinc/28/54/55/928285455.db2.gz JZFBDRLEPAFPPK-NRFANRHFSA-N 0 3 409.555 4.372 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)NCc2ccc(Oc3ccc(F)cc3)nc2)N(C)C)cc1 ZINC000520067986 928291522 /nfs/dbraw/zinc/29/15/22/928291522.db2.gz SOKAQSNIULKCEE-JOCHJYFZSA-N 0 3 422.504 4.424 20 0 HIADHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)c1cc2c(cccc2F)[nH]1 ZINC000520105338 928313653 /nfs/dbraw/zinc/31/36/53/928313653.db2.gz ZECBKIMIFQZHNH-UHFFFAOYSA-N 0 3 418.310 4.274 20 0 HIADHN CCCN(CC(=O)N1CCC(C(=O)Nc2ccccc2)CC1)[C@@H]1CCc2ccccc21 ZINC000520171617 928361609 /nfs/dbraw/zinc/36/16/09/928361609.db2.gz UZCXJMYHJMBHFU-XMMPIXPASA-N 0 3 419.569 4.263 20 0 HIADHN CC(=O)Nc1ccc(OC[C@H](O)CN(C)[C@@H](C)c2ccc(Cl)c(Cl)c2)cc1 ZINC000520173259 928362084 /nfs/dbraw/zinc/36/20/84/928362084.db2.gz ZZZNLKUOQGURRD-SUMWQHHRSA-N 0 3 411.329 4.385 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)c(C)c1CNCCNC(=O)c1ccc(C)c(F)c1 ZINC000520207451 928387920 /nfs/dbraw/zinc/38/79/20/928387920.db2.gz ZFKVHBOLMXRJJE-UHFFFAOYSA-N 0 3 414.912 4.110 20 0 HIADHN CNC(=O)c1ccc(CN[C@@H](Cc2ccc(OC)cc2)c2ccc(OC)cc2)cc1 ZINC000520208301 928390181 /nfs/dbraw/zinc/39/01/81/928390181.db2.gz DSTLTZWRGBTBGB-DEOSSOPVSA-N 0 3 404.510 4.137 20 0 HIADHN CCCOc1ccc(NC(=O)N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)cc1Cl ZINC000520266503 928431638 /nfs/dbraw/zinc/43/16/38/928431638.db2.gz RUTINHYAPHXOCN-CALCHBBNSA-N 0 3 423.985 4.482 20 0 HIADHN CCCC(=O)Nc1cccc(CNC(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)c1 ZINC000520297821 928460028 /nfs/dbraw/zinc/46/00/28/928460028.db2.gz OUCKROHMBADZLP-HSZRJFAPSA-N 0 3 422.573 4.370 20 0 HIADHN C[C@@H]1CN(c2nnc(C3CCCC3)n2C[C@@H]2CCOC2)[C@H](C)CN1Cc1ccccc1 ZINC000520301026 928462979 /nfs/dbraw/zinc/46/29/79/928462979.db2.gz BHCNTPRFVCEHRQ-SJBKTWHCSA-N 0 3 423.605 4.071 20 0 HIADHN COc1cc(OC)c(OC)cc1CN[C@@H]1CCCN(Cc2ccc(F)cc2Cl)C1 ZINC000520390216 928543162 /nfs/dbraw/zinc/54/31/62/928543162.db2.gz QALUZTKINRLUGA-GOSISDBHSA-N 0 3 422.928 4.259 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)N1CCC(Cc2ccc(F)cc2)CC1 ZINC000520396498 928545840 /nfs/dbraw/zinc/54/58/40/928545840.db2.gz USZFCTNTKNUKAT-UHFFFAOYSA-N 0 3 423.576 4.209 20 0 HIADHN Cc1noc(C2CCN(C[C@H](O)CO[C@H](c3ccccc3)c3ccccc3C)CC2)n1 ZINC000520419348 928556538 /nfs/dbraw/zinc/55/65/38/928556538.db2.gz DRUFICYSTFAONU-LADGPHEKSA-N 0 3 421.541 4.033 20 0 HIADHN C[C@H](Cc1ccc(O)cc1)NC(=O)N(CCN(C)C)Cc1ccc(C(F)(F)F)cc1 ZINC000520439656 928565944 /nfs/dbraw/zinc/56/59/44/928565944.db2.gz IOZBOBBSQZEHBR-MRXNPFEDSA-N 0 3 423.479 4.115 20 0 HIADHN Cc1cc(Oc2ncccn2)ccc1NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000520462705 928579518 /nfs/dbraw/zinc/57/95/18/928579518.db2.gz PVDCJWYMSNBLFZ-HXUWFJFHSA-N 0 3 417.513 4.363 20 0 HIADHN O=C(c1cccc(CN2CCC[C@H](c3nnc4n3CCCCC4)C2)c1)N1CCCCC1 ZINC000520480029 928590676 /nfs/dbraw/zinc/59/06/76/928590676.db2.gz KDWWQNOMAVVWSC-QFIPXVFZSA-N 0 3 421.589 4.010 20 0 HIADHN O=C(NCc1ccco1)c1cccc(CN2CC[C@@]3(C2)CCc2ccccc2O3)c1 ZINC000520663570 928709354 /nfs/dbraw/zinc/70/93/54/928709354.db2.gz OUSIZZMXVWAINH-RUZDIDTESA-N 0 3 402.494 4.179 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)NC[C@@H](c2ccc(C)cc2)N(C)C)cc1OC ZINC000520936472 928882642 /nfs/dbraw/zinc/88/26/42/928882642.db2.gz BKEUWLCPVCZYLN-SFTDATJTSA-N 0 3 411.546 4.162 20 0 HIADHN O=C(NCc1cccc(OCC(F)(F)F)c1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000520954118 928888379 /nfs/dbraw/zinc/88/83/79/928888379.db2.gz YXEKUDQNBFDDIG-SFHVURJKSA-N 0 3 424.438 4.295 20 0 HIADHN Cc1cccc(OC(F)F)c1NC(=O)N(CCN(C)C)Cc1ccc(F)cc1F ZINC000521007664 928924248 /nfs/dbraw/zinc/92/42/48/928924248.db2.gz QRHPWEBIYXFGRO-UHFFFAOYSA-N 0 3 413.415 4.470 20 0 HIADHN CC(C)[C@@H](C(=O)Nc1cccc(CN(C)Cc2cscn2)c1)N1CCCCC1 ZINC000521148538 929026268 /nfs/dbraw/zinc/02/62/68/929026268.db2.gz IRLQLLINKPLRJL-NRFANRHFSA-N 0 3 400.592 4.224 20 0 HIADHN CN(C(=O)c1ccccc1CSc1nc2ccccc2[nH]1)[C@H]1CCN(C2CC2)C1 ZINC000521150875 929027106 /nfs/dbraw/zinc/02/71/06/929027106.db2.gz XREUFFFLCNPBEO-SFHVURJKSA-N 0 3 406.555 4.164 20 0 HIADHN C[C@@H](C(=O)N1CCC(c2ccc(O)cc2)CC1)N1CCC(Cc2ccccc2)CC1 ZINC000521164504 929036998 /nfs/dbraw/zinc/03/69/98/929036998.db2.gz VTVFOCFXCJRPMR-FQEVSTJZSA-N 0 3 406.570 4.441 20 0 HIADHN C[C@H](Cc1ccc(C(F)(F)F)cc1)NC(=O)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000521167578 929041283 /nfs/dbraw/zinc/04/12/83/929041283.db2.gz VOPXUSBXNKHYOT-UZLBHIALSA-N 0 3 405.464 4.210 20 0 HIADHN CN(C)C[C@H](NC(=O)N[C@@H](c1ccccc1)c1ccccn1)c1ccc(Cl)cc1 ZINC000521276168 929094355 /nfs/dbraw/zinc/09/43/55/929094355.db2.gz WPJZDNDBHHUBQG-VXKWHMMOSA-N 0 3 408.933 4.427 20 0 HIADHN CCN1CCCC[C@H]1CNC(=O)c1oc2ccccc2c1CSc1ncccn1 ZINC000521357604 929178382 /nfs/dbraw/zinc/17/83/82/929178382.db2.gz WSXIWZRZLHKPCC-INIZCTEOSA-N 0 3 410.543 4.119 20 0 HIADHN Cc1cnc(-c2cccc(NC(=O)CCCN3CCN(c4ccccc4)CC3)c2)o1 ZINC000521360788 929182882 /nfs/dbraw/zinc/18/28/82/929182882.db2.gz DSWBQGMJOITAFS-UHFFFAOYSA-N 0 3 404.514 4.191 20 0 HIADHN O=C(CN1CCN(CC2CCCCC2)CC1)N[C@@H](c1cccs1)c1ccccc1 ZINC000521480806 929243640 /nfs/dbraw/zinc/24/36/40/929243640.db2.gz FNYDKSXPKHYORK-XMMPIXPASA-N 0 3 411.615 4.152 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Cc2csc(Cc3ccc(F)cc3)n2)N(C)C)cc1 ZINC000521488978 929247793 /nfs/dbraw/zinc/24/77/93/929247793.db2.gz JQIUMUNAAUXLOJ-OAQYLSRUSA-N 0 3 411.546 4.143 20 0 HIADHN CSc1cccc(N(C(=O)c2cccc3ccc(=O)[nH]c32)C2CCN(C)CC2)c1 ZINC000521501512 929256647 /nfs/dbraw/zinc/25/66/47/929256647.db2.gz OZLLQTBSGJHDOH-UHFFFAOYSA-N 0 3 407.539 4.403 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)NCc2ccc(OCc3ccccn3)cc2)N(C)C)cc1 ZINC000521509770 929263503 /nfs/dbraw/zinc/26/35/03/929263503.db2.gz ZQDOOYIWXCLLBO-XMMPIXPASA-N 0 3 418.541 4.071 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)N1CCn2cccc2[C@@H]1c1ccccc1 ZINC000521524195 929274646 /nfs/dbraw/zinc/27/46/46/929274646.db2.gz JODNYCKYLSBHCM-ZCYQVOJMSA-N 0 3 414.553 4.440 20 0 HIADHN CCN(C(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1)c1ccc(OC)c(OC)c1 ZINC000521531656 929277859 /nfs/dbraw/zinc/27/78/59/929277859.db2.gz CSAMFIBUTJOIIZ-GOSISDBHSA-N 0 3 400.494 4.108 20 0 HIADHN O=C(Nc1ccc(OC[C@@H]2CCCO2)cc1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000521597590 929319504 /nfs/dbraw/zinc/31/95/04/929319504.db2.gz HEECASVLBXLGSX-CVDCTZTESA-N 0 3 412.505 4.234 20 0 HIADHN COc1cccc(C[C@@H]2CCCN2C(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)c1 ZINC000521598785 929321231 /nfs/dbraw/zinc/32/12/31/929321231.db2.gz ZDLJDHPOLUGIJD-GGAORHGYSA-N 0 3 410.533 4.280 20 0 HIADHN Cc1noc(-c2ccc(C)c(NC(=O)[C@H]3CCCN(Cc4cccc(F)c4)C3)c2)n1 ZINC000521601550 929323974 /nfs/dbraw/zinc/32/39/74/929323974.db2.gz AYSFSVXXLWUAHM-IBGZPJMESA-N 0 3 408.477 4.343 20 0 HIADHN COc1ccc(OC(F)F)c(NC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)c1 ZINC000521602232 929324023 /nfs/dbraw/zinc/32/40/23/929324023.db2.gz UNLUVOTZCFKJAZ-HNNXBMFYSA-N 0 3 408.420 4.286 20 0 HIADHN COc1ccccc1C[C@@H]1CCCN1C(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000521832018 929483434 /nfs/dbraw/zinc/48/34/34/929483434.db2.gz OEEMVSKTEPBSNA-VJBMBRPKSA-N 0 3 407.558 4.247 20 0 HIADHN O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)N1CC[C@@H]1c1ccc(Cl)cc1 ZINC000521926375 929567196 /nfs/dbraw/zinc/56/71/96/929567196.db2.gz LBVYMSCSZVTUTI-FGZHOGPDSA-N 0 3 413.949 4.088 20 0 HIADHN COCCCN(C(=O)CCOc1ccccc1-c1ccccc1)C1CCN(C)CC1 ZINC000521948142 929584159 /nfs/dbraw/zinc/58/41/59/929584159.db2.gz XUPSNPXZCTZQII-UHFFFAOYSA-N 0 3 410.558 4.082 20 0 HIADHN C[C@@H](c1c(F)cccc1F)N(C)C(=O)CCCN1CCN(c2ccccc2)CC1 ZINC000521954227 929589429 /nfs/dbraw/zinc/58/94/29/929589429.db2.gz GKKCYSAYAWXFQW-SFHVURJKSA-N 0 3 401.501 4.087 20 0 HIADHN Cc1cccc(CN(Cc2ccccn2)C(=O)[C@H]2CCCN(Cc3cccnc3)C2)c1 ZINC000522130931 929630262 /nfs/dbraw/zinc/63/02/62/929630262.db2.gz UMDZEGXZTCIQLH-DEOSSOPVSA-N 0 3 414.553 4.226 20 0 HIADHN CC(C)(C)NC(=O)c1cccc(NC(=O)NC[C@H]2CCCN2Cc2ccccc2)c1 ZINC000524483249 929632611 /nfs/dbraw/zinc/63/26/11/929632611.db2.gz KVWLWONXLNBYSW-OAQYLSRUSA-N 0 3 408.546 4.001 20 0 HIADHN CCCN(Cc1csc(C(=O)OCC)n1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000524540238 929672682 /nfs/dbraw/zinc/67/26/82/929672682.db2.gz DOAGLXMQOPUPNW-FQEVSTJZSA-N 0 3 401.576 4.196 20 0 HIADHN Cc1nc(COc2cccc(C(=O)N3CCN(C4CCC(C)CC4)CC3)c2)cs1 ZINC000524543498 929674478 /nfs/dbraw/zinc/67/44/78/929674478.db2.gz JNEQOCPOESXKQX-UHFFFAOYSA-N 0 3 413.587 4.367 20 0 HIADHN CCCN(CCc1ccccn1)C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000524597096 929706606 /nfs/dbraw/zinc/70/66/06/929706606.db2.gz JRKOUCXITUKJKL-UHFFFAOYSA-N 0 3 412.603 4.160 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2ccc(OC3CCOCC3)c(C)c2)N(C)C)cc1 ZINC000524599666 929709681 /nfs/dbraw/zinc/70/96/81/929709681.db2.gz RTVVQXGOEOKHSP-JOCHJYFZSA-N 0 3 411.546 4.286 20 0 HIADHN COc1ccc2oc([C@@H](C)NC(=O)[C@H]3CCCN(Cc4cccnc4)C3)c(C)c2c1 ZINC000524605858 929715649 /nfs/dbraw/zinc/71/56/49/929715649.db2.gz XPJYSUOXUAYBPV-MJGOQNOKSA-N 0 3 407.514 4.234 20 0 HIADHN CCCN(C(=O)NC[C@H](c1ccc(C)cc1)N1CCCC1)[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC000524628314 929737649 /nfs/dbraw/zinc/73/76/49/929737649.db2.gz RRXFNUBGWFKDEK-AFXVXQJMSA-N 0 3 413.606 4.367 20 0 HIADHN CCCN(CC)C(=O)c1ccc(C(=O)N(CCN(C)C)CC2CCCCC2)cc1 ZINC000524653556 929766076 /nfs/dbraw/zinc/76/60/76/929766076.db2.gz ZBIAFUJBZPAALC-UHFFFAOYSA-N 0 3 401.595 4.143 20 0 HIADHN COc1cccc(Oc2ccc(NC(=O)CC3(N4CCOCC4)CCCC3)cc2)c1 ZINC000524796949 929832132 /nfs/dbraw/zinc/83/21/32/929832132.db2.gz FKFVLRWHEDPPPL-UHFFFAOYSA-N 0 3 410.514 4.461 20 0 HIADHN O=C(Nc1ccc(Oc2ccc(Cl)cc2)nc1)[C@]1(O)CCN(Cc2ccccc2)C1 ZINC000524796807 929832287 /nfs/dbraw/zinc/83/22/87/929832287.db2.gz PIXNJQDGHMWJJB-QHCPKHFHSA-N 0 3 423.900 4.103 20 0 HIADHN Cc1[nH]c2ccc(C(=O)NC3CCN(CCOc4ccc(F)cc4)CC3)cc2c1C ZINC000524816742 929841565 /nfs/dbraw/zinc/84/15/65/929841565.db2.gz XPLPIDBPCIZOIU-UHFFFAOYSA-N 0 3 409.505 4.197 20 0 HIADHN CCOC(=O)CCc1ccc(NC(=O)NC[C@H](c2cccs2)N2CCCC2)cc1 ZINC000524828436 929848115 /nfs/dbraw/zinc/84/81/15/929848115.db2.gz WPFVNOFORCXHIV-LJQANCHMSA-N 0 3 415.559 4.202 20 0 HIADHN CCCN(CC)C(=O)c1ccc(C(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)cc1 ZINC000524866521 929864505 /nfs/dbraw/zinc/86/45/05/929864505.db2.gz CMPHWZPAWBYMSI-NRFANRHFSA-N 0 3 421.585 4.295 20 0 HIADHN Cc1nc2c(cnn2C(C)C)cc1C(=O)N1CCCN(Cc2ccccc2)C[C@H]1C ZINC000524866117 929864688 /nfs/dbraw/zinc/86/46/88/929864688.db2.gz YJFVASFUMCFKBU-GOSISDBHSA-N 0 3 405.546 4.057 20 0 HIADHN C[C@H]1CCC[C@H](C)N1CCNC(=O)C(=O)Nc1cccc(CSC2CCCC2)c1 ZINC000524921310 929890293 /nfs/dbraw/zinc/89/02/93/929890293.db2.gz XRFAGOYSHLKDHA-ROUUACIJSA-N 0 3 417.619 4.180 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)[C@@H]1C[C@@H]1c1ccccc1OC(F)(F)F ZINC000524969340 929933573 /nfs/dbraw/zinc/93/35/73/929933573.db2.gz WAMZMXOAIGBDOE-DFQSSKMNSA-N 0 3 418.459 4.470 20 0 HIADHN CN(C)[C@H](CNC(=O)Nc1cnn(-c2cccc(C(F)(F)F)c2)c1)c1ccccc1 ZINC000525001952 929966141 /nfs/dbraw/zinc/96/61/41/929966141.db2.gz STQJXABIRYWGKZ-LJQANCHMSA-N 0 3 417.435 4.316 20 0 HIADHN COc1ccc(C)cc1-n1ccc(C(=O)NC[C@H]2CCCN(C)[C@H]2c2cccs2)n1 ZINC000525036015 929992764 /nfs/dbraw/zinc/99/27/64/929992764.db2.gz MRTQQGXLBXVKOX-VGOFRKELSA-N 0 3 424.570 4.064 20 0 HIADHN CC(C)(C)C(=O)NCc1ccc(C(=O)N(CCN2CCCC2)c2ccccc2)cc1 ZINC000525053446 930005532 /nfs/dbraw/zinc/00/55/32/930005532.db2.gz RKBXYYWYOPKRAA-UHFFFAOYSA-N 0 3 407.558 4.092 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)C23CC4CC(CC(C4)C2)C3)cc1)[C@@H]1CCCN(C)C1 ZINC000525066503 930013578 /nfs/dbraw/zinc/01/35/78/930013578.db2.gz RGILHLTWVDTRNB-VBSWXYJSSA-N 0 3 409.574 4.008 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)CCc2ccc(Cl)s2)cc1)[C@H]1CCCN(C)C1 ZINC000525066362 930013645 /nfs/dbraw/zinc/01/36/45/930013645.db2.gz OYWKVELAVNDJDT-KRWDZBQOSA-N 0 3 419.978 4.139 20 0 HIADHN COc1cc(C(C)=O)ccc1OC[C@H](O)CN(Cc1ccoc1)C1CCCCC1 ZINC000525120644 930048290 /nfs/dbraw/zinc/04/82/90/930048290.db2.gz LITNBMGEGIJXFF-OAQYLSRUSA-N 0 3 401.503 4.065 20 0 HIADHN Cc1cc(C(=O)N(CCN(C)C)Cc2ccccc2F)ccc1NC(=O)CC(C)C ZINC000525134960 930054747 /nfs/dbraw/zinc/05/47/47/930054747.db2.gz PGSZWXORJWAMEG-UHFFFAOYSA-N 0 3 413.537 4.323 20 0 HIADHN C[C@H](C(=O)N(CCN(C)C)Cc1ccc(Br)cc1)c1cccc(F)c1 ZINC000525134795 930054783 /nfs/dbraw/zinc/05/47/83/930054783.db2.gz LSTSWNVMWNLIRZ-HNNXBMFYSA-N 0 3 407.327 4.282 20 0 HIADHN CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NCc1ccc(-c2ccccc2F)s1 ZINC000525184067 930079935 /nfs/dbraw/zinc/07/99/35/930079935.db2.gz JMEKWTVJIXJYDJ-NRFANRHFSA-N 0 3 407.514 4.482 20 0 HIADHN Cc1cc(C)cc(-c2ccc(CNCc3ccc([C@@]4(C)NC(=O)NC4=O)cc3)cc2)c1 ZINC000525195449 930083196 /nfs/dbraw/zinc/08/31/96/930083196.db2.gz UDXVBJFRLAGNKJ-AREMUKBSSA-N 0 3 413.521 4.315 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3ccc(OCc4ccccc4)nc3)cc2)CC1 ZINC000525240237 930100484 /nfs/dbraw/zinc/10/04/84/930100484.db2.gz OZMLUXFZTGDTCY-UHFFFAOYSA-N 0 3 416.525 4.055 20 0 HIADHN COc1cc(-c2nnc(CN3C[C@@H](c4ccccc4)C[C@H]3C)o2)cc(OC)c1OC ZINC000525273054 930125592 /nfs/dbraw/zinc/12/55/92/930125592.db2.gz OWKRBPFCGBNYDQ-QAPCUYQASA-N 0 3 409.486 4.140 20 0 HIADHN O=C(CCc1cccc(Cl)c1)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000525333713 930169406 /nfs/dbraw/zinc/16/94/06/930169406.db2.gz VYKIJDQDQHPUFH-UHFFFAOYSA-N 0 3 404.913 4.071 20 0 HIADHN COc1ccc(Nc2nc(C(=O)NC3CCN(Cc4ccccc4)CC3)cs2)cc1 ZINC000525338489 930175906 /nfs/dbraw/zinc/17/59/06/930175906.db2.gz GOLLBFOAELJDGS-UHFFFAOYSA-N 0 3 422.554 4.290 20 0 HIADHN Cc1ccc(C(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)cc1NC(=O)NC(C)(C)C ZINC000525371794 930202473 /nfs/dbraw/zinc/20/24/73/930202473.db2.gz SEFJAYUQPRKGRQ-GHTZIAJQSA-N 0 3 422.573 4.480 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCc1nc(C(F)(F)F)cs1)c1ccsc1 ZINC000525395246 930216946 /nfs/dbraw/zinc/21/69/46/930216946.db2.gz XBNAPOITNMLSMR-LBPRGKRZSA-N 0 3 406.499 4.106 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1ccc(C(=O)NC(C)(C)C)cc1 ZINC000525440179 930241356 /nfs/dbraw/zinc/24/13/56/930241356.db2.gz YLOVIJLGOKHJAH-LJQANCHMSA-N 0 3 422.573 4.343 20 0 HIADHN Cc1cccc(NC2CCN(C(=O)c3ccc(N4CCN(C(C)C)CC4)cc3)CC2)c1 ZINC000525493337 930279937 /nfs/dbraw/zinc/27/99/37/930279937.db2.gz XZIQPNKXJXQPLX-UHFFFAOYSA-N 0 3 420.601 4.242 20 0 HIADHN CCC(CC)[C@@H](NC(=O)NC[C@]1(O)CCN(Cc2ccccc2)C1)c1cccs1 ZINC000525497379 930283969 /nfs/dbraw/zinc/28/39/69/930283969.db2.gz PIMDKOJAEAKQQE-FYYLOGMGSA-N 0 3 415.603 4.162 20 0 HIADHN CN(C(=O)c1ccc(Oc2cccc(Cl)c2Cl)nc1)[C@H]1CCN(C2CC2)C1 ZINC000525567246 930333822 /nfs/dbraw/zinc/33/38/22/930333822.db2.gz CQAAZETVZGNPCU-HNNXBMFYSA-N 0 3 406.313 4.489 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)c3ccccc3OC3CCCCC3)CC2)C[C@H](C)O1 ZINC000525569799 930335986 /nfs/dbraw/zinc/33/59/86/930335986.db2.gz UXTSQPVBHMYVSU-BGYRXZFFSA-N 0 3 414.590 4.360 20 0 HIADHN Cc1ccc(CCCC(=O)Nc2ccc(C(=O)N(C)[C@@H]3CCCN(C)C3)cc2)cc1 ZINC000525581161 930343732 /nfs/dbraw/zinc/34/37/32/930343732.db2.gz KRIGPBSSFIPGGS-HSZRJFAPSA-N 0 3 407.558 4.123 20 0 HIADHN CC1CCN([C@H](CNC(=O)c2cc(N3CCCC3=O)ccc2F)c2ccccc2)CC1 ZINC000525582290 930344221 /nfs/dbraw/zinc/34/42/21/930344221.db2.gz ORRCFBOIRDOTDA-HSZRJFAPSA-N 0 3 423.532 4.156 20 0 HIADHN COc1ccc(Oc2ccc(NC(=O)[C@H]3CCCN(Cc4cccnc4)C3)cn2)cc1 ZINC000525614162 930363146 /nfs/dbraw/zinc/36/31/46/930363146.db2.gz HIFYFWABWABWDP-IBGZPJMESA-N 0 3 418.497 4.128 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)c3oc(-c4ccccc4)nc3C)cc2)CC1 ZINC000525619382 930366559 /nfs/dbraw/zinc/36/65/59/930366559.db2.gz MIDOJWSSVDANMR-UHFFFAOYSA-N 0 3 404.514 4.040 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)CN2CC[C@H](c3ccccc3)[C@@H](C)C2)c(OC)c1 ZINC000525787148 930444949 /nfs/dbraw/zinc/44/49/49/930444949.db2.gz RFHROJROZAKWQA-APTRMMRNSA-N 0 3 422.569 4.493 20 0 HIADHN COc1cc([C@@H](C)NCc2ccc3c(c2)sc(=O)n3C)ccc1OCC(C)C ZINC000525980754 930501887 /nfs/dbraw/zinc/50/18/87/930501887.db2.gz QCLFFJILTAOHLO-OAHLLOKOSA-N 0 3 400.544 4.494 20 0 HIADHN CCN(C(=O)C(=O)Nc1cc(F)ccc1Cl)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000526123237 930539385 /nfs/dbraw/zinc/53/93/85/930539385.db2.gz RGGGKKVAHHRYQP-MAUKXSAKSA-N 0 3 417.912 4.102 20 0 HIADHN C[C@@H](CNC(=O)[C@@H]1CCCN(Cc2cccnc2)C1)c1ccc(C(F)(F)F)cc1 ZINC000526956104 930557630 /nfs/dbraw/zinc/55/76/30/930557630.db2.gz GJBUUTQCRQDJAW-QFBILLFUSA-N 0 3 405.464 4.232 20 0 HIADHN CC(C)N1CCN(CCCSc2nnc(-c3ccccc3)n2-c2ccccc2)CC1 ZINC000527059491 930577424 /nfs/dbraw/zinc/57/74/24/930577424.db2.gz HRRUZNCVCUAZRB-UHFFFAOYSA-N 0 3 421.614 4.443 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2cc(F)ccc2OCC(F)(F)F)[C@H]1c1ccccc1 ZINC000527066998 930578982 /nfs/dbraw/zinc/57/89/82/930578982.db2.gz HHEICPHIWAZHGX-CRAIPNDOSA-N 0 3 411.399 4.334 20 0 HIADHN CSCc1cccc(CNC(=O)Nc2ccc(CCN3CCSCC3)cc2)c1 ZINC000527081893 930581893 /nfs/dbraw/zinc/58/18/93/930581893.db2.gz YPEFQVOGFGQXLI-UHFFFAOYSA-N 0 3 415.628 4.463 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)C(=O)Nc2ccc3oc4ccccc4c3c2)o1 ZINC000527104821 930591295 /nfs/dbraw/zinc/59/12/95/930591295.db2.gz LRAWWNCJWMIOLG-UHFFFAOYSA-N 0 3 419.481 4.016 20 0 HIADHN COc1cc(CNCc2ccc3c(c2)sc(=O)n3C)ccc1OCCC(C)C ZINC000527514173 930672179 /nfs/dbraw/zinc/67/21/79/930672179.db2.gz VKBMSKUKUWJMNY-UHFFFAOYSA-N 0 3 400.544 4.323 20 0 HIADHN CCCN(C(=O)c1c[nH]c(=O)c2ccccc12)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000530330904 930685351 /nfs/dbraw/zinc/68/53/51/930685351.db2.gz YBFXNKXDHRMYSW-FQEVSTJZSA-N 0 3 403.526 4.457 20 0 HIADHN CCC(C)(C)NC(=O)c1ccc(NC(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)cc1 ZINC000530409367 930703966 /nfs/dbraw/zinc/70/39/66/930703966.db2.gz XDGXEZMKEGEUAY-LEWJYISDSA-N 0 3 408.546 4.172 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2ccc(NC(=O)c3ccco3)cc2)[C@H]1c1ccccc1 ZINC000530462576 930718613 /nfs/dbraw/zinc/71/86/13/930718613.db2.gz LXJRISRHBJTSOQ-PZJWPPBQSA-N 0 3 404.470 4.099 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2cc(N3CCCC3=O)ccc2Cl)[C@@H]1c1ccccc1 ZINC000530515852 930734827 /nfs/dbraw/zinc/73/48/27/930734827.db2.gz CSOCQWYQRCNLMX-NQIIRXRSSA-N 0 3 412.921 4.034 20 0 HIADHN O=C(Nc1ccc(OCc2ccccn2)c(F)c1)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000530602832 930767553 /nfs/dbraw/zinc/76/75/53/930767553.db2.gz JCVWASLITFZLRX-IBGZPJMESA-N 0 3 420.488 4.045 20 0 HIADHN C[C@H](NC(=O)[C@H]1CCCN(Cc2cccnc2)C1)c1ccc(-c2cccnc2)cc1 ZINC000530619208 930774777 /nfs/dbraw/zinc/77/47/77/930774777.db2.gz NZTBNEOZPWKSGB-CYFREDJKSA-N 0 3 400.526 4.233 20 0 HIADHN CCCCCn1nc(-c2nc(-c3ccc(CN(C)C)cc3)no2)c2ccccc2c1=O ZINC000530632800 930780031 /nfs/dbraw/zinc/78/00/31/930780031.db2.gz MHIDPRGMPUPKOK-UHFFFAOYSA-N 0 3 417.513 4.365 20 0 HIADHN CN(C)Cc1ccc(-c2noc(-c3ccc(F)cc3I)n2)cc1 ZINC000530632987 930780102 /nfs/dbraw/zinc/78/01/02/930780102.db2.gz MTBKVSVMQYDMHT-UHFFFAOYSA-N 0 3 423.229 4.209 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)COc2cc(Cl)ccc2Cl)CC1 ZINC000530679992 930796905 /nfs/dbraw/zinc/79/69/05/930796905.db2.gz MJNYZTASUIJUCE-UHFFFAOYSA-N 0 3 407.341 4.495 20 0 HIADHN CC(C)(C)[C@H](CN1CCc2ccccc2C1)NC(=O)N1CCC[C@H]1c1ccccn1 ZINC000530709295 930803057 /nfs/dbraw/zinc/80/30/57/930803057.db2.gz DIMZGOOZLQHQDE-GOTSBHOMSA-N 0 3 406.574 4.401 20 0 HIADHN C[C@H](CNC(=O)C(=O)Nc1ccc([C@@H](C)Sc2ccccc2)cc1)N1CCCC1 ZINC000530746912 930815712 /nfs/dbraw/zinc/81/57/12/930815712.db2.gz LYIYRRIIXVIUDX-QZTJIDSGSA-N 0 3 411.571 4.079 20 0 HIADHN C[C@H]1CN(CCCCNC(=O)c2ccc(Oc3ccccc3Cl)nc2)C[C@H](C)O1 ZINC000530775497 930820724 /nfs/dbraw/zinc/82/07/24/930820724.db2.gz XHSAAHWVAYNERC-IRXDYDNUSA-N 0 3 417.937 4.147 20 0 HIADHN Cc1noc(-c2ccc(C)c(NC(=O)N(C)[C@@H]3CCCN(Cc4ccccc4)C3)c2)n1 ZINC000530837816 930836541 /nfs/dbraw/zinc/83/65/41/930836541.db2.gz XEVCRXZRXRWUPR-OAQYLSRUSA-N 0 3 419.529 4.482 20 0 HIADHN CC(=O)Nc1ccc(Cl)c(NC(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000530838227 930837084 /nfs/dbraw/zinc/83/70/84/930837084.db2.gz PJOWBQDHQNEPNZ-LJQANCHMSA-N 0 3 414.937 4.427 20 0 HIADHN Cc1ccc(OCCc2nc(-c3ccc(CN(C)C)cc3)no2)c(Br)c1 ZINC000530871981 930845127 /nfs/dbraw/zinc/84/51/27/930845127.db2.gz ZJJNDWGJDJPDNT-UHFFFAOYSA-N 0 3 416.319 4.491 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)C1(c2cccs2)CCCCC1 ZINC000530914648 930857921 /nfs/dbraw/zinc/85/79/21/930857921.db2.gz INVXXMANMAONJA-UHFFFAOYSA-N 0 3 412.599 4.223 20 0 HIADHN CCN(CC)C(=O)c1cccc(NC(=O)[C@H](C)N[C@H](C)[C@@H]2Oc3ccccc3[C@@H]2C)c1 ZINC000530972899 930872469 /nfs/dbraw/zinc/87/24/69/930872469.db2.gz KCKGDPOGFXDUBR-DDOIHHOZSA-N 0 3 423.557 4.038 20 0 HIADHN Cc1nc(-c2ccc(CNC(=O)N(CCN(C)C)Cc3cccs3)cc2)cs1 ZINC000530990100 930878490 /nfs/dbraw/zinc/87/84/90/930878490.db2.gz KIBMRVLOCYPGJR-UHFFFAOYSA-N 0 3 414.600 4.453 20 0 HIADHN C[C@H]1C[C@H](NC(=O)N(C)CCCCCc2cc(-c3ccccc3)n[nH]2)CN1C1CC1 ZINC000531006942 930882730 /nfs/dbraw/zinc/88/27/30/930882730.db2.gz QYLJPRVVTBKGLI-RXVVDRJESA-N 0 3 409.578 4.056 20 0 HIADHN CO[C@@H](C)c1nc(CN2CCCN(CCCOc3ccc(Cl)cc3)CC2)cs1 ZINC000531231363 930975789 /nfs/dbraw/zinc/97/57/89/930975789.db2.gz NTLZLJCEIRKBER-KRWDZBQOSA-N 0 3 424.010 4.481 20 0 HIADHN Cc1sc([C@@H](C)NC(=O)N[C@H]2CCN(C3CC3)C2)nc1-c1ccc(Cl)cc1 ZINC000531263619 930987359 /nfs/dbraw/zinc/98/73/59/930987359.db2.gz YHXLSVOVSHFYNE-WBMJQRKESA-N 0 3 404.967 4.369 20 0 HIADHN COc1ccc([C@H](CNC(=O)[C@@H]2CCCCN2Cc2ccccc2)N2CCCC2)cc1 ZINC000531281675 931000002 /nfs/dbraw/zinc/00/00/02/931000002.db2.gz XZYVKKFYFUIDNW-DQEYMECFSA-N 0 3 421.585 4.003 20 0 HIADHN CC[C@@H](C(=O)Nc1ccc(=O)n(Cc2ccc(Cl)c(Cl)c2)c1)N(CC)CC ZINC000531287361 931002271 /nfs/dbraw/zinc/00/22/71/931002271.db2.gz QNHINNWPEISGLD-SFHVURJKSA-N 0 3 410.345 4.262 20 0 HIADHN O=C(N[C@@H](c1cccc(Cl)c1)c1ccccn1)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000531618420 931129749 /nfs/dbraw/zinc/12/97/49/931129749.db2.gz IBXXOBAMHCOHRL-OFNKIYASSA-N 0 3 420.944 4.248 20 0 HIADHN CN1CCN(c2ncc(CN[C@H](CCCc3ccccc3)c3ccccc3)cn2)CC1 ZINC000531631649 931133927 /nfs/dbraw/zinc/13/39/27/931133927.db2.gz JDUNWOHTDFZADV-RUZDIDTESA-N 0 3 415.585 4.082 20 0 HIADHN O=C(CN1CC[C@H](Cc2ccccc2)C1)NCc1cccc(COCc2ccco2)c1 ZINC000531643710 931137123 /nfs/dbraw/zinc/13/71/23/931137123.db2.gz HFRRKGMTRROHGE-HSZRJFAPSA-N 0 3 418.537 4.177 20 0 HIADHN C[C@@H](CC(=O)N(C)Cc1ccccc1Cl)NCc1cnn(Cc2ccccc2)c1 ZINC000531685817 931151714 /nfs/dbraw/zinc/15/17/14/931151714.db2.gz KIZGURRUGULCCX-SFHVURJKSA-N 0 3 410.949 4.112 20 0 HIADHN COc1cc([C@@H](C)N[C@@H](C)c2ccc(NS(C)(=O)=O)cc2)ccc1OC(C)C ZINC000531689844 931155121 /nfs/dbraw/zinc/15/51/21/931155121.db2.gz UYDCHVLIKSDFQF-JKSUJKDBSA-N 0 3 406.548 4.266 20 0 HIADHN CNC(=O)c1cccc(CN[C@@H]2CCCc3nc(-c4ccc(OC)cc4)sc32)c1 ZINC000531694016 931157069 /nfs/dbraw/zinc/15/70/69/931157069.db2.gz QSGHEWVDUJTWSW-LJQANCHMSA-N 0 3 407.539 4.346 20 0 HIADHN C[C@H](N[C@H](CN1CCN(C)CC1)c1ccccc1)c1cc(Br)ccc1F ZINC000531703579 931164710 /nfs/dbraw/zinc/16/47/10/931164710.db2.gz MAVXPXVMJKIETJ-HRAATJIYSA-N 0 3 420.370 4.228 20 0 HIADHN Cc1nc(-c2cccnc2)sc1[C@@H](C)N[C@@H](CN1CCN(C)CC1)c1ccccc1 ZINC000531703686 931165720 /nfs/dbraw/zinc/16/57/20/931165720.db2.gz WDPPJVWBMVZDMC-GCJKJVERSA-N 0 3 421.614 4.153 20 0 HIADHN C[C@@H](NCc1ccc(OC2CCCCC2)nc1)c1ccc(NS(C)(=O)=O)cc1 ZINC000531707670 931167792 /nfs/dbraw/zinc/16/77/92/931167792.db2.gz YPFFBEXKOVLDCU-MRXNPFEDSA-N 0 3 403.548 4.015 20 0 HIADHN COc1ccc(CN[C@@H](C)CC(=O)Nc2ccccc2C(F)(F)F)cc1NC(C)=O ZINC000531708956 931167996 /nfs/dbraw/zinc/16/79/96/931167996.db2.gz GHZMKOJUOFJONB-ZDUSSCGKSA-N 0 3 423.435 4.179 20 0 HIADHN CC[C@H](C)[C@@H](NC(=O)N1CC[C@H](N2CCN(C(C)C)CC2)C1)c1ccc(Cl)cc1 ZINC000531839691 931215804 /nfs/dbraw/zinc/21/58/04/931215804.db2.gz MKOARJVCPSKZHX-YUXAGFNASA-N 0 3 421.029 4.237 20 0 HIADHN O=C(NC1(c2c(Cl)cccc2Cl)CC1)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000531847583 931219182 /nfs/dbraw/zinc/21/91/82/931219182.db2.gz VRDREUDNBHDECH-MRXNPFEDSA-N 0 3 404.341 4.406 20 0 HIADHN COc1ccc(NC(=O)[C@@H](N[C@@H](C)C2CCOCC2)c2ccccc2)cc1Cl ZINC000531883819 931234245 /nfs/dbraw/zinc/23/42/45/931234245.db2.gz KUQBZDZFAYREIP-BTYIYWSLSA-N 0 3 402.922 4.433 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc(CNCc2cc(Cl)cc3cccnc32)cc1 ZINC000531912317 931244141 /nfs/dbraw/zinc/24/41/41/931244141.db2.gz PHJMVEJLRODIQG-UHFFFAOYSA-N 0 3 417.962 4.209 20 0 HIADHN CC(C)NS(=O)(=O)Cc1ccccc1CNCc1cc(Cl)cc2cccnc21 ZINC000531909410 931244183 /nfs/dbraw/zinc/24/41/83/931244183.db2.gz SIBQDYAPGMEZKN-UHFFFAOYSA-N 0 3 417.962 4.006 20 0 HIADHN CC(C)NS(=O)(=O)Cc1ccc(CNCc2cc(Cl)cc3cccnc32)cc1 ZINC000531909611 931244372 /nfs/dbraw/zinc/24/43/72/931244372.db2.gz WMOSNBOXFHSCRG-UHFFFAOYSA-N 0 3 417.962 4.006 20 0 HIADHN C[C@H](NC[C@@H](c1cccs1)N1CCN(C)CC1)c1ccc(F)cc1OC(F)F ZINC000531932530 931250838 /nfs/dbraw/zinc/25/08/38/931250838.db2.gz SQVOUFXHMICSJB-YOEHRIQHSA-N 0 3 413.509 4.128 20 0 HIADHN CCC(=O)Nc1cccc(CN[C@@H](C)c2ccc(I)cc2)c1 ZINC000531936274 931253021 /nfs/dbraw/zinc/25/30/21/931253021.db2.gz HIZCFOLZYJZCCW-ZDUSSCGKSA-N 0 3 408.283 4.491 20 0 HIADHN C[C@@H](NC[C@@H](c1cccc(F)c1)N1CCOCC1)c1sccc1Br ZINC000531952720 931261513 /nfs/dbraw/zinc/26/15/13/931261513.db2.gz POSIFPUCEAFIIM-DYVFJYSZSA-N 0 3 413.356 4.374 20 0 HIADHN CCCOc1ccc([C@@H](C)NCc2ccccc2CS(=O)(=O)NC(C)C)cc1 ZINC000531958553 931264689 /nfs/dbraw/zinc/26/46/89/931264689.db2.gz MFZMCAMVQWFCGW-GOSISDBHSA-N 0 3 404.576 4.154 20 0 HIADHN COc1cc(OC)c(CCN[C@@H](C)c2sccc2Br)c(OC)c1 ZINC000531970603 931270144 /nfs/dbraw/zinc/27/01/44/931270144.db2.gz PYCVOCAWCNQMLG-NSHDSACASA-N 0 3 400.338 4.430 20 0 HIADHN CN1CCN(c2ccc(CN[C@H]3CCCOc4c(Cl)c(Cl)ccc43)cn2)CC1 ZINC000531989673 931278193 /nfs/dbraw/zinc/27/81/93/931278193.db2.gz NGYFRSCWPYLONJ-SFHVURJKSA-N 0 3 421.372 4.144 20 0 HIADHN COc1cc(C[C@H](CO)CN[C@H](C)c2sccc2Br)cc(OC)c1 ZINC000531994812 931279322 /nfs/dbraw/zinc/27/93/22/931279322.db2.gz QJZGZPVNZZWDTB-OCCSQVGLSA-N 0 3 414.365 4.030 20 0 HIADHN CC(C)N1CCN([C@@H]2CCN(C(=O)[C@@H](Sc3ccccc3)c3ccccc3)C2)CC1 ZINC000532088893 931307927 /nfs/dbraw/zinc/30/79/27/931307927.db2.gz HVIZMBFUVQKNSO-VWNXMTODSA-N 0 3 423.626 4.147 20 0 HIADHN Clc1cc(CN[C@@H]2CCSc3ccccc32)ccc1OCCN1CCOCC1 ZINC000532094370 931309519 /nfs/dbraw/zinc/30/95/19/931309519.db2.gz NBQUPMPLWJEXJP-HXUWFJFHSA-N 0 3 418.990 4.378 20 0 HIADHN C[C@@H](CC(=O)Nc1ccc(OC(F)(F)F)cc1)NCc1cnn(-c2ccccc2)c1 ZINC000532197262 931345178 /nfs/dbraw/zinc/34/51/78/931345178.db2.gz FKORHFZVGGSJAP-HNNXBMFYSA-N 0 3 418.419 4.278 20 0 HIADHN C[C@@H](NC[C@@H](c1ccc(F)cc1)N1CCOCC1)c1sccc1Br ZINC000532204372 931349226 /nfs/dbraw/zinc/34/92/26/931349226.db2.gz ZDXSDKFXAODORJ-DYVFJYSZSA-N 0 3 413.356 4.374 20 0 HIADHN Cc1nn(C)c(C)c1CN[C@@H](C)CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 ZINC000532205351 931349512 /nfs/dbraw/zinc/34/95/12/931349512.db2.gz SAMIXSPBKPMZCI-JTQLQIEISA-N 0 3 402.848 4.216 20 0 HIADHN C[C@@H](NCc1cccc(OCCN2CCOCC2)c1)c1ccc(Br)cc1 ZINC000532204472 931349599 /nfs/dbraw/zinc/34/95/99/931349599.db2.gz LDAUIYPGRYXBQM-QGZVFWFLSA-N 0 3 419.363 4.011 20 0 HIADHN COc1ccc([C@H](C)N[C@H](C)c2ccc(OCC(=O)NC3CC3)cc2)cc1Cl ZINC000532211354 931354120 /nfs/dbraw/zinc/35/41/20/931354120.db2.gz QXDIRDIKWSRAHM-CABCVRRESA-N 0 3 402.922 4.418 20 0 HIADHN CC(C)NS(=O)(=O)Cc1ccccc1CN[C@@H](C)c1cc2c(s1)CCCC2 ZINC000532213870 931355312 /nfs/dbraw/zinc/35/53/12/931355312.db2.gz MCPQIYAJTYBZRK-INIZCTEOSA-N 0 3 406.617 4.306 20 0 HIADHN C[C@H](CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)N[C@@H](CO)c1ccccc1 ZINC000532246363 931371149 /nfs/dbraw/zinc/37/11/49/931371149.db2.gz GZYFIGQLUJDNSQ-PXAZEXFGSA-N 0 3 400.828 4.399 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@@H](C)N[C@H](C)c2ccc(OC)c(OC)c2)cc1 ZINC000532441192 931435431 /nfs/dbraw/zinc/43/54/31/931435431.db2.gz GYHUJDKZBZNMFT-IAGOWNOFSA-N 0 3 420.575 4.146 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@H](C)N[C@@H](C)c2ccc3c(c2)COC3)cc1 ZINC000532441175 931435539 /nfs/dbraw/zinc/43/55/39/931435539.db2.gz WDCSDRFCHIOLCV-IRXDYDNUSA-N 0 3 402.560 4.159 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@H](C)N[C@H](C)c2ccc3c(c2)COC3)cc1 ZINC000532441170 931435654 /nfs/dbraw/zinc/43/56/54/931435654.db2.gz WDCSDRFCHIOLCV-DLBZAZTESA-N 0 3 402.560 4.159 20 0 HIADHN COc1ccccc1OCCN[C@H](C)c1ccc(S(=O)(=O)C2CCCC2)cc1 ZINC000532461045 931445474 /nfs/dbraw/zinc/44/54/74/931445474.db2.gz RDHFIUFGLRPESE-QGZVFWFLSA-N 0 3 403.544 4.141 20 0 HIADHN CC[C@@H](N[C@H](C)c1ccc(S(=O)(=O)NC)cc1)c1ccc(Br)cc1 ZINC000532467994 931448255 /nfs/dbraw/zinc/44/82/55/931448255.db2.gz JRIGQEUYHHJVOU-FZKQIMNGSA-N 0 3 411.365 4.159 20 0 HIADHN O=C(c1ccc(CN[C@H]2CCSc3ccc(Cl)cc32)cc1)N1CCOCC1 ZINC000532472111 931451248 /nfs/dbraw/zinc/45/12/48/931451248.db2.gz MNBPWUKDGXXZLD-IBGZPJMESA-N 0 3 402.947 4.139 20 0 HIADHN COc1cccc(CCN[C@H](C)c2ccccc2I)c1OC ZINC000532475787 931453628 /nfs/dbraw/zinc/45/36/28/931453628.db2.gz MHWXKXCJZLRTSJ-CYBMUJFWSA-N 0 3 411.283 4.202 20 0 HIADHN O=C(c1ccccc1Cl)N1CCC(NCc2coc(-c3cccs3)n2)CC1 ZINC000532476208 931453668 /nfs/dbraw/zinc/45/36/68/931453668.db2.gz KINNENNOENCDNU-UHFFFAOYSA-N 0 3 401.919 4.451 20 0 HIADHN C[C@@H]([NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1)c1sccc1Br ZINC000532494884 931461033 /nfs/dbraw/zinc/46/10/33/931461033.db2.gz WUGRZSHCKJKKFF-GFCCVEGCSA-N 0 3 409.349 4.172 20 0 HIADHN C[C@@H](N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)c1ccc(Br)cc1 ZINC000532494871 931461455 /nfs/dbraw/zinc/46/14/55/931461455.db2.gz TXHVBYVFVWETQQ-UZLBHIALSA-N 0 3 401.348 4.333 20 0 HIADHN Cc1cccc(O[C@@H]2CCCC[C@H]2NC(=O)[C@@H]2CCCN(Cc3cccnc3)C2)c1 ZINC000532516145 931470646 /nfs/dbraw/zinc/47/06/46/931470646.db2.gz ZTCQFEUXZQDFAO-GMKZXUHWSA-N 0 3 407.558 4.108 20 0 HIADHN COc1ccc([C@@H](N[C@@H](C)Cc2ccsc2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000532531082 931512309 /nfs/dbraw/zinc/51/23/09/931512309.db2.gz KHSIFIDRDNVGII-KSFYIVLOSA-N 0 3 415.580 4.470 20 0 HIADHN COc1ccc(NC(=O)C[C@H](C)NCc2cc(C)ccc2OC(F)F)c(OC)c1 ZINC000532543534 931517476 /nfs/dbraw/zinc/51/74/76/931517476.db2.gz RMGMNIUSXBHLDY-AWEZNQCLSA-N 0 3 408.445 4.121 20 0 HIADHN CCOC(=O)c1oc2ccc(Br)cc2c1CN(C)C[C@H]1CCCOC1 ZINC000532556635 931523132 /nfs/dbraw/zinc/52/31/32/931523132.db2.gz SOSFSHCBTPIZQF-CYBMUJFWSA-N 0 3 410.308 4.230 20 0 HIADHN CO[C@H](C)CN(CC(=O)NC[C@H](c1c[nH]c2ccccc21)c1ccccc1)C(C)C ZINC000532586907 931544592 /nfs/dbraw/zinc/54/45/92/931544592.db2.gz UBFPJUDYHWAAJW-KNQAVFIVSA-N 0 3 407.558 4.161 20 0 HIADHN O=c1cc(CN2CCC(COc3cc(Cl)cc(Cl)c3)CC2)nc2ccccn12 ZINC000532586969 931544750 /nfs/dbraw/zinc/54/47/50/931544750.db2.gz VALWUTLIOPOUNH-UHFFFAOYSA-N 0 3 418.324 4.292 20 0 HIADHN O=C(CN[C@H](c1ccccc1)C1CCC1)N1CCC[C@@H]1c1ccc2c(c1)OCCO2 ZINC000532701622 931594660 /nfs/dbraw/zinc/59/46/60/931594660.db2.gz MFPJOOITYZSATJ-PXDATVDWSA-N 0 3 406.526 4.252 20 0 HIADHN COc1cc(CN[C@H]2CC(C)(C)c3ccccc32)ccc1OCC(=O)N1CCCC1 ZINC000532705119 931598819 /nfs/dbraw/zinc/59/88/19/931598819.db2.gz MEIVFYWYYRWOAM-NRFANRHFSA-N 0 3 408.542 4.209 20 0 HIADHN CCN(C(=O)c1cnc2c(C)cc(F)cc2c1O)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000532863925 931670997 /nfs/dbraw/zinc/67/09/97/931670997.db2.gz IWYCQHUEDFPHOM-FXAWDEMLSA-N 0 3 421.516 4.273 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1ccc(N(C)C)c(F)c1 ZINC000532910897 931689104 /nfs/dbraw/zinc/68/91/04/931689104.db2.gz ZECMSRHMOXAFAM-FQEVSTJZSA-N 0 3 421.520 4.096 20 0 HIADHN COc1ccc(C)cc1NC(=O)[C@H](C)N(C)CCCc1cc(-c2cccc(F)c2)n[nH]1 ZINC000532959171 931713031 /nfs/dbraw/zinc/71/30/31/931713031.db2.gz NNOQKSVZYAASKT-KRWDZBQOSA-N 0 3 424.520 4.424 20 0 HIADHN C[C@H](c1cccc(NC(=O)c2ccccc2)c1)N(C)C(=O)CN1C[C@@H]2[C@H](C1)C2(C)C ZINC000532974526 931722447 /nfs/dbraw/zinc/72/24/47/931722447.db2.gz SGFDRWXIAAMDGH-YHYVQYDKSA-N 0 3 405.542 4.046 20 0 HIADHN CCn1c2ccccc2c2cc(NC(=O)CN(CC(C)(C)O)C3CCOCC3)ccc21 ZINC000533022453 931742960 /nfs/dbraw/zinc/74/29/60/931742960.db2.gz AALVKDLGWONNRR-UHFFFAOYSA-N 0 3 423.557 4.005 20 0 HIADHN Cc1nn(-c2ccc(F)cc2F)c(C)c1CNCCc1nnc(-c2ccccc2)o1 ZINC000533039398 931748442 /nfs/dbraw/zinc/74/84/42/931748442.db2.gz ZJKKYKGEMMCJNZ-UHFFFAOYSA-N 0 3 409.440 4.150 20 0 HIADHN COc1ccc(OC)c([C@@H]2CCCN2C(=O)CN[C@H](c2ccccc2)C2CCC2)c1 ZINC000533046368 931751319 /nfs/dbraw/zinc/75/13/19/931751319.db2.gz RIABDCOMWWYCLH-WIOPSUGQSA-N 0 3 408.542 4.498 20 0 HIADHN Cn1ccnc1COc1ccc(CNC2(c3ccc(Cl)cc3)CCOCC2)cc1 ZINC000533064033 931759702 /nfs/dbraw/zinc/75/97/02/931759702.db2.gz UHRKSCFBPBGFBS-UHFFFAOYSA-N 0 3 411.933 4.448 20 0 HIADHN CC(C)c1ccc(CCNC(=O)CNC2(c3ccc(Cl)cc3)CCOCC2)cc1 ZINC000533063944 931759718 /nfs/dbraw/zinc/75/97/18/931759718.db2.gz RAYDWWXZVXDBIM-UHFFFAOYSA-N 0 3 414.977 4.418 20 0 HIADHN O=c1cc(CN[C@H](c2ccccc2)C2CCCC2)nc2ccc(Br)cn12 ZINC000533063462 931760018 /nfs/dbraw/zinc/76/00/18/931760018.db2.gz GEXMGFKCDZZVBM-OAQYLSRUSA-N 0 3 412.331 4.478 20 0 HIADHN COC(=O)CC1(NCC(=O)Nc2ccc(Cl)cc2C(F)(F)F)CCCCC1 ZINC000533068746 931761366 /nfs/dbraw/zinc/76/13/66/931761366.db2.gz WWQFKDNYANAQEX-UHFFFAOYSA-N 0 3 406.832 4.153 20 0 HIADHN CCN(CC(=O)Nc1ccc(C)cc1)C1CCN(c2cc(C)nc(C(C)C)n2)CC1 ZINC000533072990 931763687 /nfs/dbraw/zinc/76/36/87/931763687.db2.gz KFSDEWQIISTBCK-UHFFFAOYSA-N 0 3 409.578 4.146 20 0 HIADHN CCCn1c2ccccc2nc1CNC[C@H](CO)Cc1ccc(C(F)(F)F)cc1 ZINC000533187441 931804661 /nfs/dbraw/zinc/80/46/61/931804661.db2.gz ZGJCSXXWHUWVQH-QGZVFWFLSA-N 0 3 405.464 4.406 20 0 HIADHN O=C(CC(F)(F)F)N1CCC(NCc2ccc(Cl)cc2Br)CC1 ZINC000533201181 931807572 /nfs/dbraw/zinc/80/75/72/931807572.db2.gz LFQSEURSHOAOLV-UHFFFAOYSA-N 0 3 413.665 4.136 20 0 HIADHN Brc1ccc(CNCc2cccc3[nH]ccc32)c(N2CCOCC2)c1 ZINC000533201288 931807575 /nfs/dbraw/zinc/80/75/75/931807575.db2.gz YFCNZMMPQKICSB-UHFFFAOYSA-N 0 3 400.320 4.057 20 0 HIADHN CCCN(Cc1nc(=O)c2c(C)c(C(=O)OC)sc2[nH]1)[C@@H](CC)c1ccccc1 ZINC000533251241 931819015 /nfs/dbraw/zinc/81/90/15/931819015.db2.gz WSJHLXJILQMFBU-INIZCTEOSA-N 0 3 413.543 4.443 20 0 HIADHN CCCN(CC(=O)Nc1ccc(Br)cc1C)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000533293658 931830518 /nfs/dbraw/zinc/83/05/18/931830518.db2.gz YYLJNWROPWKCRI-KFKAGJAMSA-N 0 3 409.368 4.222 20 0 HIADHN O=C(CN[C@@H](Cc1ccccc1)c1ccccc1)NCc1ccccc1Cn1cccn1 ZINC000533343326 931843027 /nfs/dbraw/zinc/84/30/27/931843027.db2.gz VDYHWDJLZMMLEU-SANMLTNESA-N 0 3 424.548 4.121 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)CN[C@@H](c2ccccc2)C2CCC2)c(OC)c1 ZINC000533368337 931850326 /nfs/dbraw/zinc/85/03/26/931850326.db2.gz JFAMPJMIFFUFKU-DHLKQENFSA-N 0 3 408.542 4.498 20 0 HIADHN COc1cc(C)c([C@H](C)NC(=O)CN[C@H](c2ccc(F)cc2)C2CCC2)cc1OC ZINC000533367894 931850422 /nfs/dbraw/zinc/85/04/22/931850422.db2.gz ZZSHDWMFBREHDL-FYSMJZIKSA-N 0 3 414.521 4.460 20 0 HIADHN CCN(CC)C(=O)c1cccc(NC(=O)CN[C@@H](c2ccc(F)cc2)C2CCC2)c1 ZINC000533376541 931852532 /nfs/dbraw/zinc/85/25/32/931852532.db2.gz AFXYANXSRTXRPZ-HSZRJFAPSA-N 0 3 411.521 4.377 20 0 HIADHN O=C(CN[C@@H](c1ccccc1)C1CCCC1)NCC1(c2ccccc2)CCOCC1 ZINC000533386590 931855090 /nfs/dbraw/zinc/85/50/90/931855090.db2.gz XGQVYDHHANCPSY-VWLOTQADSA-N 0 3 406.570 4.372 20 0 HIADHN Cc1cc(NC(=O)COc2cc(C)cc(C)c2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000533398425 931858025 /nfs/dbraw/zinc/85/80/25/931858025.db2.gz ZPIHFSQLUVFHPE-JOCHJYFZSA-N 0 3 418.541 4.273 20 0 HIADHN CN(CCCC(c1ccc(F)cc1)c1ccc(F)cc1)C[C@@H]1CCS(=O)(=O)C1 ZINC000533429141 931865949 /nfs/dbraw/zinc/86/59/49/931865949.db2.gz NZSSSNFXIGMKSB-KRWDZBQOSA-N 0 3 407.526 4.243 20 0 HIADHN CC[C@@H](Cc1ccccc1)N(C)CC(=O)N1CCC[C@@H]1c1ccc(OC)c(OC)c1 ZINC000533431904 931866894 /nfs/dbraw/zinc/86/68/94/931866894.db2.gz RIKYLMWZYGAIOR-FCHUYYIVSA-N 0 3 410.558 4.320 20 0 HIADHN CC[C@@H](Cc1ccccc1)N(C)CC(=O)N1CCC[C@H]1c1ccc(OC)c(OC)c1 ZINC000533431913 931866960 /nfs/dbraw/zinc/86/69/60/931866960.db2.gz RIKYLMWZYGAIOR-VXKWHMMOSA-N 0 3 410.558 4.320 20 0 HIADHN CC[C@H]1CCCN(CC(=O)N(Cc2nnc(-c3ccccc3Cl)o2)C2CC2)CC1 ZINC000533436361 931868647 /nfs/dbraw/zinc/86/86/47/931868647.db2.gz NCYDKCWOBXKAAT-INIZCTEOSA-N 0 3 416.953 4.393 20 0 HIADHN CC(C)(COc1ncccc1Br)NCc1c[nH]c(-c2ccccc2)n1 ZINC000533452508 931874102 /nfs/dbraw/zinc/87/41/02/931874102.db2.gz HOUBROSIVYNJOX-UHFFFAOYSA-N 0 3 401.308 4.181 20 0 HIADHN C[C@@H]1CCCC[C@@H]1N(C)C(=O)CNC1(c2cccc(Br)c2)CCOCC1 ZINC000533485259 931881627 /nfs/dbraw/zinc/88/16/27/931881627.db2.gz KTQMKQGJOLXRFB-APWZRJJASA-N 0 3 423.395 4.082 20 0 HIADHN C[C@H]1CCCC[C@H]1N(C)C(=O)CNC1(c2cccc(Br)c2)CCOCC1 ZINC000533485260 931881726 /nfs/dbraw/zinc/88/17/26/931881726.db2.gz KTQMKQGJOLXRFB-QFBILLFUSA-N 0 3 423.395 4.082 20 0 HIADHN COc1ccc(CCNC(=O)[C@H](C)N[C@@H](c2ccc(F)cc2)C2CCC2)cc1OC ZINC000533505563 931887334 /nfs/dbraw/zinc/88/73/34/931887334.db2.gz QDZBMGYHHPXGAQ-QMHKHESXSA-N 0 3 414.521 4.021 20 0 HIADHN COc1ccc(CCNC(=O)[C@H](C)N[C@H](c2ccc(F)cc2)C2CCC2)cc1OC ZINC000533505557 931887436 /nfs/dbraw/zinc/88/74/36/931887436.db2.gz QDZBMGYHHPXGAQ-HJPURHCSSA-N 0 3 414.521 4.021 20 0 HIADHN COc1ccc(CCNC(=O)[C@@H](C)N[C@@H](c2ccc(F)cc2)C2CCC2)cc1OC ZINC000533505565 931887450 /nfs/dbraw/zinc/88/74/50/931887450.db2.gz QDZBMGYHHPXGAQ-WAIKUNEKSA-N 0 3 414.521 4.021 20 0 HIADHN O=C(Nc1cccc(F)c1)C1CCN(C[C@@H](O)COc2ccc3ccccc3c2)CC1 ZINC000533507740 931888837 /nfs/dbraw/zinc/88/88/37/931888837.db2.gz GIKMOLJTOWHACW-HSZRJFAPSA-N 0 3 422.500 4.069 20 0 HIADHN O=C(CNC1(c2ccc(F)cc2)CCCC1)N1CCC[C@@H]1c1ccc2c(c1)OCCO2 ZINC000533510592 931889297 /nfs/dbraw/zinc/88/92/97/931889297.db2.gz ZDQQIUMSABVGBM-OAQYLSRUSA-N 0 3 424.516 4.320 20 0 HIADHN COc1ccc([C@@H]2CCCCCN2C(=O)CNC2(c3ccccc3)CCOCC2)cc1 ZINC000533517732 931892046 /nfs/dbraw/zinc/89/20/46/931892046.db2.gz FGVZTEYBCJLYIF-DEOSSOPVSA-N 0 3 422.569 4.434 20 0 HIADHN Cc1nc2c(s1)[C@H](N(C)C[C@@H](O)COc1cccc(C(F)(F)F)c1)CCC2 ZINC000533522978 931893721 /nfs/dbraw/zinc/89/37/21/931893721.db2.gz FYPLJWGVRNIGOI-RHSMWYFYSA-N 0 3 400.466 4.219 20 0 HIADHN CC(C)N1CCN([C@H]2CCN([C@H](C)c3ncc(-c4ccc(Cl)cc4)o3)C2)CC1 ZINC000533559063 931899883 /nfs/dbraw/zinc/89/98/83/931899883.db2.gz PFZHVLLQFPWKKK-XLIONFOSSA-N 0 3 402.970 4.156 20 0 HIADHN C[C@H](NCc1cnc([C@@H]2CCCO2)s1)[C@@H](OC1CCOCC1)c1ccccc1 ZINC000533756622 932012718 /nfs/dbraw/zinc/01/27/18/932012718.db2.gz NDAHIDUPYHPVSK-ORYQWCPZSA-N 0 3 402.560 4.410 20 0 HIADHN C[C@H](NCC1(N2CCSCC2)CCCCC1)c1ncc(Br)s1 ZINC000533785818 932032583 /nfs/dbraw/zinc/03/25/83/932032583.db2.gz WUDLLHDUXWKVOV-ZDUSSCGKSA-N 0 3 404.443 4.308 20 0 HIADHN CC(=O)N1CC[C@@H](NCC2=Cc3cc(Br)ccc3OC2)c2ccccc21 ZINC000533804196 932039703 /nfs/dbraw/zinc/03/97/03/932039703.db2.gz RHZVBRGORUXRLU-LJQANCHMSA-N 0 3 413.315 4.312 20 0 HIADHN C[C@@H](Oc1ccc(C(=O)NC[C@H](Cc2ccccc2)N(C)C)cn1)c1ccccc1 ZINC000533808975 932042018 /nfs/dbraw/zinc/04/20/18/932042018.db2.gz TWDXQJVJJFKEOE-XXBNENTESA-N 0 3 403.526 4.124 20 0 HIADHN CC[C@](C)(COc1ncccc1Cl)NCC(=O)Nc1cc(Cl)ccc1F ZINC000533828355 932048402 /nfs/dbraw/zinc/04/84/02/932048402.db2.gz STCZOKHYTAIZMF-GOSISDBHSA-N 0 3 400.281 4.303 20 0 HIADHN CCCOc1ccc([C@H](C)NC(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)cc1OC ZINC000533929694 932105887 /nfs/dbraw/zinc/10/58/87/932105887.db2.gz LVBPSMJCDVQBIF-XTQVGHSUSA-N 0 3 411.546 4.290 20 0 HIADHN CN(Cc1csc(Br)c1)C(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000533945245 932118730 /nfs/dbraw/zinc/11/87/30/932118730.db2.gz SXJPTMQMWBCLGN-DOTOQJQBSA-N 0 3 408.365 4.097 20 0 HIADHN COc1cc(C(=O)N(C)C2CCN(Cc3ccccc3)CC2)sc1Br ZINC000533948751 932121666 /nfs/dbraw/zinc/12/16/66/932121666.db2.gz IKDBNFVERDCZJE-UHFFFAOYSA-N 0 3 423.376 4.256 20 0 HIADHN CC(C)(C)[C@@H](CN1CCc2ccccc2C1)NC(=O)N[C@H](c1cccnc1)C1CC1 ZINC000533967702 932142478 /nfs/dbraw/zinc/14/24/78/932142478.db2.gz YGKZEOVLECEYNZ-PKTZIBPZSA-N 0 3 406.574 4.305 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)c2cnn(-c3ncccc3Cl)c2C(F)F)c1 ZINC000533971647 932149101 /nfs/dbraw/zinc/14/91/01/932149101.db2.gz RXXYXMZSWNDAAP-UHFFFAOYSA-N 0 3 419.863 4.481 20 0 HIADHN CN1CC[C@@H](NC(=O)CCc2ncc(-c3ccccc3Cl)o2)[C@@H]1c1ccccc1 ZINC000534018323 932199712 /nfs/dbraw/zinc/19/97/12/932199712.db2.gz CGICVGDNUJYYLT-XXBNENTESA-N 0 3 409.917 4.489 20 0 HIADHN CN1CC[C@@H](NC(=O)C2CCN(c3nc4ccccc4s3)CC2)[C@@H]1c1ccccc1 ZINC000534017959 932200225 /nfs/dbraw/zinc/20/02/25/932200225.db2.gz LTLQCZOTIPSSQI-IRLDBZIGSA-N 0 3 420.582 4.074 20 0 HIADHN Cc1ccc(C(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)cc1NC(=O)NC(C)(C)C ZINC000534018850 932201474 /nfs/dbraw/zinc/20/14/74/932201474.db2.gz LNGOAEYLXYKLHU-TZIWHRDSSA-N 0 3 408.546 4.090 20 0 HIADHN COC(=O)[C@H]1CCCC[C@@]1(C)NCC(=O)Nc1ccc(Cl)cc1C(F)(F)F ZINC000534022485 932203799 /nfs/dbraw/zinc/20/37/99/932203799.db2.gz AASVRONOZMCLAI-SJKOYZFVSA-N 0 3 406.832 4.009 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)Nc1cccc2c1CN(c1nccs1)C2 ZINC000534024763 932205891 /nfs/dbraw/zinc/20/58/91/932205891.db2.gz RBHPGHBUNVINKI-UHFFFAOYSA-N 0 3 421.570 4.259 20 0 HIADHN CCc1cc(N2CCC(N[C@H]3CCc4c3c(Br)ccc4F)CC2)ncn1 ZINC000534059516 932237416 /nfs/dbraw/zinc/23/74/16/932237416.db2.gz STQBJLNQXQKGSX-SFHVURJKSA-N 0 3 419.342 4.187 20 0 HIADHN CC[C@@H](C)n1ncc(C(=O)NCC2(N3CCSCC3)CCCCC2)c1C1CC1 ZINC000534068537 932247452 /nfs/dbraw/zinc/24/74/52/932247452.db2.gz MVSFBFFZVVCZSQ-QGZVFWFLSA-N 0 3 404.624 4.213 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCc1cncc(C)c1)c1ccc(C(F)(F)F)cc1 ZINC000534071796 932250727 /nfs/dbraw/zinc/25/07/27/932250727.db2.gz ZCFBHEKJLBLYMB-LJQANCHMSA-N 0 3 408.468 4.291 20 0 HIADHN COc1ccc(COCCCC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)cc1 ZINC000534114989 932286210 /nfs/dbraw/zinc/28/62/10/932286210.db2.gz YZSVXJRFBRQROU-OAQYLSRUSA-N 0 3 410.558 4.115 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)c2cc3ccccc3cc2OC(F)F)C[C@H](C)O1 ZINC000534162025 932309643 /nfs/dbraw/zinc/30/96/43/932309643.db2.gz BXGUCJJENSJUDH-IYBDPMFKSA-N 0 3 406.473 4.060 20 0 HIADHN CCN(C(=O)c1ccc(OCC(F)F)nc1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000534175123 932316083 /nfs/dbraw/zinc/31/60/83/932316083.db2.gz DDWGKUXSWZCUBS-LPHOPBHVSA-N 0 3 403.473 4.023 20 0 HIADHN O=C(N[C@@H]1CCN(Cc2ccccc2)C[C@H]1CO)c1ccc(-c2ccccc2Cl)o1 ZINC000534181863 932318983 /nfs/dbraw/zinc/31/89/83/932318983.db2.gz PEIGWQFIRUAJNW-GHTZIAJQSA-N 0 3 424.928 4.213 20 0 HIADHN O=C(N[C@H]1CCN(Cc2ccccc2)C[C@@H]1CO)c1cccc(Oc2ccccc2)c1 ZINC000534181062 932319140 /nfs/dbraw/zinc/31/91/40/932319140.db2.gz AFHPRIGBUQJWJJ-RDGATRHJSA-N 0 3 416.521 4.092 20 0 HIADHN O=C(N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1CO)c1ccc(OC2CCCCC2)cc1 ZINC000534182679 932319907 /nfs/dbraw/zinc/31/99/07/932319907.db2.gz WMMMPURGOFINJD-RCZVLFRGSA-N 0 3 422.569 4.011 20 0 HIADHN C[C@H]1CN(C(=O)Nc2ccc3oc4ccccc4c3c2)CC[C@H]1N1CCN(C)CC1 ZINC000534269698 932373222 /nfs/dbraw/zinc/37/32/22/932373222.db2.gz YRKLVACDVALKPG-LAUBAEHRSA-N 0 3 406.530 4.076 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)CCc1ccc(C)cc1Br ZINC000534309090 932379967 /nfs/dbraw/zinc/37/99/67/932379967.db2.gz AZJGGODELUCUMX-UHFFFAOYSA-N 0 3 405.336 4.399 20 0 HIADHN O=C(Nc1ccc2c(c1)OCO2)C1CCN(Cc2cc(Cl)cc3cccnc32)CC1 ZINC000534331355 932384471 /nfs/dbraw/zinc/38/44/71/932384471.db2.gz UGJSRLMGHCYCND-UHFFFAOYSA-N 0 3 423.900 4.468 20 0 HIADHN Cc1c(C(=O)N2CCC(CN3C[C@@H](C)O[C@H](C)C3)CC2)cccc1-c1ccccn1 ZINC000534365405 932397292 /nfs/dbraw/zinc/39/72/92/932397292.db2.gz GPOUHOOCCKJVSD-RTBURBONSA-N 0 3 407.558 4.018 20 0 HIADHN C[C@H](C(=O)Nc1ccc(OCc2ccccc2)cc1)N1CC[C@@H](C2CCOCC2)C1 ZINC000534380224 932407728 /nfs/dbraw/zinc/40/77/28/932407728.db2.gz FSHILGLRIRQBQK-DENIHFKCSA-N 0 3 408.542 4.341 20 0 HIADHN Cc1cc(C)c(CC(C(=O)Nc2ccc(S(C)(=O)=O)cc2)C(F)(F)F)c(C)c1 ZINC000534457268 932473862 /nfs/dbraw/zinc/47/38/62/932473862.db2.gz KERIOODVYDXYQW-GOSISDBHSA-N 0 3 413.461 4.375 20 0 HIADHN CN(C)[C@H](CNC(=O)c1cnc2ccccc2c1C(F)(F)F)Cc1ccccc1 ZINC000534521312 932543534 /nfs/dbraw/zinc/54/35/34/932543534.db2.gz DOEWWUKZPWEXCA-INIZCTEOSA-N 0 3 401.432 4.156 20 0 HIADHN COc1cc([C@H](C)NC(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)ccc1OC(C)C ZINC000534611538 932595559 /nfs/dbraw/zinc/59/55/59/932595559.db2.gz VUEINKYTSQQOIK-NYDSKATKSA-N 0 3 411.546 4.288 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)c1ccc(C(=O)Nc2ccccc2)cc1 ZINC000534612213 932596128 /nfs/dbraw/zinc/59/61/28/932596128.db2.gz CLHYPFGAPIJAKJ-UHFFFAOYSA-N 0 3 401.510 4.143 20 0 HIADHN Cc1ccc(C[C@H](NC(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)c2ccccn2)cc1 ZINC000534684693 932655368 /nfs/dbraw/zinc/65/53/68/932655368.db2.gz GERQXNYJFGRQDV-SDHOMARFSA-N 0 3 414.553 4.418 20 0 HIADHN CCOc1ccc(F)c(NC(=O)NCC(C)(C)N2CCc3ccccc3C2)c1F ZINC000534780058 932760365 /nfs/dbraw/zinc/76/03/65/932760365.db2.gz CBVKAAYRZLHAKT-UHFFFAOYSA-N 0 3 403.473 4.322 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)c1cccc(-c2ccoc2)c1 ZINC000534818042 932790775 /nfs/dbraw/zinc/79/07/75/932790775.db2.gz QAOLHZPGNFZEDD-UHFFFAOYSA-N 0 3 403.526 4.279 20 0 HIADHN C[C@H](CNC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1)c1nc(-c2ccccc2)no1 ZINC000534834918 932801263 /nfs/dbraw/zinc/80/12/63/932801263.db2.gz DCQTUXSBPXUJGE-XLIONFOSSA-N 0 3 422.504 4.008 20 0 HIADHN Cc1ccc(COc2ccc(CN3CCC(C(=O)NCC(F)(F)F)CC3)cc2)cc1 ZINC000535077327 932898425 /nfs/dbraw/zinc/89/84/25/932898425.db2.gz KTSJLZNTRMJZJZ-UHFFFAOYSA-N 0 3 420.475 4.465 20 0 HIADHN Cc1c(C(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)cccc1-c1ccccn1 ZINC000535097858 932914723 /nfs/dbraw/zinc/91/47/23/932914723.db2.gz AORUXTVRIIRYEM-BGYRXZFFSA-N 0 3 421.585 4.409 20 0 HIADHN Cc1cc(NC(=O)c2cccc(OC(C)C)n2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000535102504 932918867 /nfs/dbraw/zinc/91/88/67/932918867.db2.gz XJTCJKPDIAZGRA-HXUWFJFHSA-N 0 3 419.529 4.073 20 0 HIADHN CC(=O)N(c1nc(CN2CCN(CC3CC3)CC2)cs1)c1cccc(Cl)c1 ZINC000535219644 933023949 /nfs/dbraw/zinc/02/39/49/933023949.db2.gz NGAZLPBZYDQEKF-UHFFFAOYSA-N 0 3 404.967 4.009 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(N(CC[NH+](CC)CC)Cc3ccccc3)nc2)n1 ZINC000535231414 933030401 /nfs/dbraw/zinc/03/04/01/933030401.db2.gz UYNUAVLFHPADSB-UHFFFAOYSA-N 0 3 405.546 4.155 20 0 HIADHN CCSc1ccc([C@H](C)NCc2ccccc2CS(=O)(=O)NC(C)C)cc1 ZINC000535235388 933032639 /nfs/dbraw/zinc/03/26/39/933032639.db2.gz YFPCEJAEJHVFOP-KRWDZBQOSA-N 0 3 406.617 4.477 20 0 HIADHN CN(C)[C@@H](CNC(=O)C(C)(C)c1ccc(Br)cc1)Cc1ccccc1 ZINC000535257812 933039864 /nfs/dbraw/zinc/03/98/64/933039864.db2.gz QYXORJJKJNSMTF-LJQANCHMSA-N 0 3 403.364 4.016 20 0 HIADHN CN(C)[C@@H](CNc1cnn(-c2ccc(Cl)cc2)c(=O)c1Cl)Cc1ccccc1 ZINC000535257019 933039953 /nfs/dbraw/zinc/03/99/53/933039953.db2.gz HUKCJHVIYYZBEP-GOSISDBHSA-N 0 3 417.340 4.124 20 0 HIADHN Cc1cc(C)c(CC(C(=O)Nc2cc(C(=O)N(C)C)ccn2)C(F)(F)F)c(C)c1 ZINC000535269924 933044066 /nfs/dbraw/zinc/04/40/66/933044066.db2.gz NANNQVKPUWNIDR-KRWDZBQOSA-N 0 3 407.436 4.068 20 0 HIADHN CC[C@H](NC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1)c1nc(C(F)(F)F)cs1 ZINC000535397932 933114815 /nfs/dbraw/zinc/11/48/15/933114815.db2.gz SHYOQUGXWOBHQQ-DZKIICNBSA-N 0 3 412.481 4.358 20 0 HIADHN CCOc1cc2c(cc1[C@@H]1C[C@@H]1C(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1)O[C@H](C)C2 ZINC000535468029 933158790 /nfs/dbraw/zinc/15/87/90/933158790.db2.gz GWXVZHXOKRZWGX-MFGDGSIBSA-N 0 3 420.553 4.074 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)c1ccc(C(=O)Nc2ccccc2)cc1 ZINC000535501878 933191858 /nfs/dbraw/zinc/19/18/58/933191858.db2.gz DNIZFPKFXAOIRR-UHFFFAOYSA-N 0 3 419.500 4.282 20 0 HIADHN Cc1cc(NC(=O)N(CCN(C)C)Cc2ccco2)ccc1C(=O)OC(C)(C)C ZINC000535614018 933269302 /nfs/dbraw/zinc/26/93/02/933269302.db2.gz WNDYPJHKTXBPAB-UHFFFAOYSA-N 0 3 401.507 4.139 20 0 HIADHN CCN(Cc1ccncc1)C[C@H](O)COC(c1ccc(F)cc1)c1ccc(F)cc1 ZINC000535763995 933378902 /nfs/dbraw/zinc/37/89/02/933378902.db2.gz GCVCLUGHRCMYDN-QHCPKHFHSA-N 0 3 412.480 4.349 20 0 HIADHN Brc1ccc(-c2ncc(CN3CCC(Cn4ccnn4)CC3)s2)cc1 ZINC000535810043 933405907 /nfs/dbraw/zinc/40/59/07/933405907.db2.gz XINSGIFFKHDQNO-UHFFFAOYSA-N 0 3 418.364 4.076 20 0 HIADHN COc1ccc(C(=O)N(CCN(C)C)Cc2ccccc2F)cc1-c1ccccn1 ZINC000535850473 933431525 /nfs/dbraw/zinc/43/15/25/933431525.db2.gz BAEQDAZTTMYYGP-UHFFFAOYSA-N 0 3 407.489 4.100 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(CN3CC[C@H](C)[C@H](n4ccnc4)C3)c2)cc1 ZINC000535850003 933432864 /nfs/dbraw/zinc/43/28/64/933432864.db2.gz CCEYMGCFKFECBT-FDDCHVKYSA-N 0 3 404.514 4.227 20 0 HIADHN Cc1ccc(C(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)c(Br)c1 ZINC000535857585 933440720 /nfs/dbraw/zinc/44/07/20/933440720.db2.gz ZZSQNEZRTVJVSV-IRXDYDNUSA-N 0 3 423.395 4.109 20 0 HIADHN C[C@H](Cc1cccc(Cl)c1)C(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000535909071 933484264 /nfs/dbraw/zinc/48/42/64/933484264.db2.gz BYPZBMAVAZJEEU-QRVBRYPASA-N 0 3 406.998 4.257 20 0 HIADHN COc1cc(CN[C@@H](C)c2ccc([S@@](C)=O)cc2)ccc1OCc1ccncc1 ZINC000535946845 933513232 /nfs/dbraw/zinc/51/32/32/933513232.db2.gz XSGQGBQHNDHVPH-SFNQZPIRSA-N 0 3 410.539 4.257 20 0 HIADHN Brc1ccc(N2CC[C@H](NCc3cnc([C@@H]4CCCO4)s3)C2)cc1 ZINC000535959878 933525217 /nfs/dbraw/zinc/52/52/17/933525217.db2.gz WEXSJYWTIYVBTP-YOEHRIQHSA-N 0 3 408.365 4.126 20 0 HIADHN CN(C)[C@@H](CNC(=O)Nc1cc(C2CC2)nn1-c1ccccc1)Cc1ccccc1 ZINC000536012805 933571645 /nfs/dbraw/zinc/57/16/45/933571645.db2.gz UXURBWNSZRVCGN-OAQYLSRUSA-N 0 3 403.530 4.044 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)c2ccc(-n3nc(C)cc3C)cc2)cc1 ZINC000536094030 933644028 /nfs/dbraw/zinc/64/40/28/933644028.db2.gz CAWWUDKZXQKFHE-XMMPIXPASA-N 0 3 418.541 4.065 20 0 HIADHN CN1CC[C@H](NC(=O)NCc2ccc(Oc3ccc(F)cc3)nc2)[C@H]1c1ccccc1 ZINC000536094423 933644259 /nfs/dbraw/zinc/64/42/59/933644259.db2.gz FTCRQAUMYVKATN-JTHBVZDNSA-N 0 3 420.488 4.258 20 0 HIADHN COc1ccccc1CC(=O)N1CCC(NCc2ncc(-c3ccccc3)s2)CC1 ZINC000536130411 933678405 /nfs/dbraw/zinc/67/84/05/933678405.db2.gz MYOCCNYMUZNWIS-UHFFFAOYSA-N 0 3 421.566 4.142 20 0 HIADHN CCc1nn(C)cc1C(=O)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000536137749 933682641 /nfs/dbraw/zinc/68/26/41/933682641.db2.gz QEKBJBVERIOAIV-UHFFFAOYSA-N 0 3 409.361 4.028 20 0 HIADHN CC[C@H](N[C@H]1CCO[C@H]1c1ccc(F)c(F)c1)c1ccccc1OCC(=O)N(C)C ZINC000537303153 933705827 /nfs/dbraw/zinc/70/58/27/933705827.db2.gz CVKMKRBSGNJHLE-JTAQYXEDSA-N 0 3 418.484 4.003 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCC[C@@H]1[C@@H]1C[C@H](C)CC[C@H]1O)c1ccsc1 ZINC000537305497 933706606 /nfs/dbraw/zinc/70/66/06/933706606.db2.gz VWPAVGDTINIMSH-RSRIQPTJSA-N 0 3 407.624 4.102 20 0 HIADHN COc1ccc([C@@H](C)NC2CCN(C(=O)CC(F)(F)F)CC2)c(Br)c1 ZINC000537308241 933708767 /nfs/dbraw/zinc/70/87/67/933708767.db2.gz YTMREFSCNZKJMA-LLVKDONJSA-N 0 3 423.273 4.052 20 0 HIADHN COc1ccc(OCc2ccccn2)c(CN[C@H]2CCN(c3ccccc3OC)C2)c1 ZINC000537399335 933758092 /nfs/dbraw/zinc/75/80/92/933758092.db2.gz YNKWOSOUNLVQHI-FQEVSTJZSA-N 0 3 419.525 4.046 20 0 HIADHN CCN1CCN(c2ccc(N[C@H](C)c3cc(OC)c(OC)c(OC)c3)c(C)c2)CC1 ZINC000537407266 933761473 /nfs/dbraw/zinc/76/14/73/933761473.db2.gz JNPBMHVWUUDESD-GOSISDBHSA-N 0 3 413.562 4.336 20 0 HIADHN CCN1CCN(c2ccc(N[C@H](C)c3cc(OC)c(OC)cc3F)c(C)c2)CC1 ZINC000537406185 933761512 /nfs/dbraw/zinc/76/15/12/933761512.db2.gz CBHPZZLCUWJZFP-QGZVFWFLSA-N 0 3 401.526 4.466 20 0 HIADHN Cc1ccc(N[C@H]2CCN(Cc3ccccn3)C[C@@H]2C)cc1I ZINC000537406518 933761961 /nfs/dbraw/zinc/76/19/61/933761961.db2.gz KEMIHDWWEVXCFF-KXBFYZLASA-N 0 3 421.326 4.317 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)c1cc(C)n(C2CCCCC2)n1 ZINC000537421491 933769498 /nfs/dbraw/zinc/76/94/98/933769498.db2.gz NWGZFEBPLUNUSK-JOCHJYFZSA-N 0 3 409.578 4.218 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2CN2CCC(O[C@@H]3CCOC3)CC2)o1 ZINC000562857881 945128347 /nfs/dbraw/zinc/12/83/47/945128347.db2.gz YDLHBEMRQROKAV-JOCHJYFZSA-N 0 3 407.514 4.211 20 0 HIADHN Cn1nc2ccccc2c1-c1noc([C@H]2CN(Cc3ccccc3)CCC2(F)F)n1 ZINC000562898488 945144777 /nfs/dbraw/zinc/14/47/77/945144777.db2.gz ANWRDJMPLOFOJF-QGZVFWFLSA-N 0 3 409.440 4.248 20 0 HIADHN Cc1ccc(C2=NN(C(=O)CN3CCC[C@@H]3C3CCOCC3)[C@H](c3ccco3)C2)cc1 ZINC000537524670 938315877 /nfs/dbraw/zinc/31/58/77/938315877.db2.gz WTSWRINEITYQRJ-PKTZIBPZSA-N 0 3 421.541 4.157 20 0 HIADHN O[C@@H](COc1ccc2ccccc2c1)CN1CCC(n2ccc(C(F)(F)F)n2)CC1 ZINC000537610261 938332374 /nfs/dbraw/zinc/33/23/74/938332374.db2.gz MYEKZNPGPPYEOI-LJQANCHMSA-N 0 3 419.447 4.132 20 0 HIADHN COc1cc(CN2CCC[C@@H]2c2ccc(C(C)C)cc2)cc(OC)c1OCC(N)=O ZINC000537622029 938336924 /nfs/dbraw/zinc/33/69/24/938336924.db2.gz OAKIJKBLYCIPOJ-HXUWFJFHSA-N 0 3 412.530 4.028 20 0 HIADHN COc1cc(CN(C)CC[C@H](C)O)cc(Br)c1OCc1ccccc1 ZINC000537623451 938337496 /nfs/dbraw/zinc/33/74/96/938337496.db2.gz FFGIMBYTCJZXOZ-HNNXBMFYSA-N 0 3 408.336 4.239 20 0 HIADHN CNC(=O)COc1cccc(CN[C@@H]2CCc3c2cc(Cl)cc3Br)c1 ZINC000563269718 945166621 /nfs/dbraw/zinc/16/66/21/945166621.db2.gz UGAPTNPPKRYQTF-GOSISDBHSA-N 0 3 423.738 4.004 20 0 HIADHN CCCc1nc2ccccc2n1CCC(=O)N(Cc1ccco1)C1CCN(C)CC1 ZINC000537641216 938344033 /nfs/dbraw/zinc/34/40/33/938344033.db2.gz QADHBWDZUXSKGA-UHFFFAOYSA-N 0 3 408.546 4.095 20 0 HIADHN CCN(C[C@@H]1CCN(Cc2cc(OC)c(OC)cc2SC)C1)CC(F)(F)F ZINC000537647784 938345482 /nfs/dbraw/zinc/34/54/82/938345482.db2.gz IGKMDJBDCBRYLX-AWEZNQCLSA-N 0 3 406.514 4.132 20 0 HIADHN CCOc1cc(CN2CCSC3(CCCCC3)C2)ccc1O[C@H](C)C(=O)N(C)C ZINC000537649584 938346689 /nfs/dbraw/zinc/34/66/89/938346689.db2.gz PFHIDBFGPPOALS-GOSISDBHSA-N 0 3 420.619 4.193 20 0 HIADHN F[C@H](C(F)(F)F)C(F)(F)Oc1ccc(CN2CCS[C@@H]3COCC[C@H]32)cc1 ZINC000537707599 938360370 /nfs/dbraw/zinc/36/03/70/938360370.db2.gz FECYGUGMDPGXPH-RBSFLKMASA-N 0 3 415.399 4.265 20 0 HIADHN COc1cc(CN2CCCCC[C@@H]2/C=C/c2ccccc2)cc(OC)c1OCC(N)=O ZINC000537709822 938361258 /nfs/dbraw/zinc/36/12/58/938361258.db2.gz JQNUNDGCIBCHSI-JNCYCUAHSA-N 0 3 424.541 4.026 20 0 HIADHN CCOC(=O)c1c2c(sc1NC(=O)[C@@H]1C[C@@H](C)O[C@@H](C)C1)C(C)(C)NC(C)(C)C2 ZINC000537710518 938361277 /nfs/dbraw/zinc/36/12/77/938361277.db2.gz PWJSFJJWILEDTH-BTTYYORXSA-N 0 3 422.591 4.226 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)c2ccc(-c3ccccc3)[nH]c2=O)cc1 ZINC000537728501 938364304 /nfs/dbraw/zinc/36/43/04/938364304.db2.gz PPDTWTSVISKMTP-QHCPKHFHSA-N 0 3 417.509 4.030 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)[C@@H](C)Oc2ccccc2Cl)cc1 ZINC000537731306 938364911 /nfs/dbraw/zinc/36/49/11/938364911.db2.gz TUJGFKOUDGIWLG-UZLBHIALSA-N 0 3 402.922 4.069 20 0 HIADHN Cc1ccc(Cl)cc1NC(=O)C[C@H](C)N[C@H]1CC(=O)N(c2c(F)cccc2F)C1 ZINC000537765760 938372661 /nfs/dbraw/zinc/37/26/61/938372661.db2.gz STUCYHHLEFGVHO-ZFWWWQNUSA-N 0 3 421.875 4.039 20 0 HIADHN COc1ccc([C@@H](OC)[C@@H](C)[NH2+]Cc2cc(Br)c([O-])c(OC)c2)cc1 ZINC000537864331 938393953 /nfs/dbraw/zinc/39/39/53/938393953.db2.gz WBVIUSPNCMUTRM-BLVKFPJESA-N 0 3 410.308 4.038 20 0 HIADHN CC(C)n1cnnc1[C@H]1CCCN(CCC(=O)Nc2c(Cl)cccc2Cl)C1 ZINC000537865706 938394297 /nfs/dbraw/zinc/39/42/97/938394297.db2.gz ZAQZSZDKDHUBJB-AWEZNQCLSA-N 0 3 410.349 4.374 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)Nc2ccc3[nH]c(C(F)F)nc3c2)CC1 ZINC000537882637 938398760 /nfs/dbraw/zinc/39/87/60/938398760.db2.gz DMSQCVQGTNKHTR-ZDUSSCGKSA-N 0 3 414.460 4.243 20 0 HIADHN COc1ccc([C@@H](C)N[C@H](C)c2ccc(-n3ccnn3)cc2)cc1Br ZINC000537937970 938423232 /nfs/dbraw/zinc/42/32/32/938423232.db2.gz HDVCRWQQKPWVTD-ZIAGYGMSSA-N 0 3 401.308 4.450 20 0 HIADHN Cc1c([C@H](C)N[C@@H](C)Cn2ncc3ccccc3c2=O)cnn1-c1cc(C)ccc1C ZINC000537941984 938426074 /nfs/dbraw/zinc/42/60/74/938426074.db2.gz KXKDPJBHNRRWJY-OALUTQOASA-N 0 3 415.541 4.247 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)N[C@H]2CC(=O)N(C)[C@H]2c2ccc(F)c(F)c2)cc1 ZINC000537944454 938426789 /nfs/dbraw/zinc/42/67/89/938426789.db2.gz BGMQHFSBMRUXNR-BKAZIGDYSA-N 0 3 410.468 4.082 20 0 HIADHN C[C@H](NCc1ccc(COC2CCOCC2)cc1)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000537951786 938430571 /nfs/dbraw/zinc/43/05/71/938430571.db2.gz BTRHVQQKHOVWTR-KRWDZBQOSA-N 0 3 408.542 4.463 20 0 HIADHN C[C@@H](NC[C@@H](O)COc1ccccc1Br)c1ccc2ccccc2n1 ZINC000537959349 938434425 /nfs/dbraw/zinc/43/44/25/938434425.db2.gz CSUYDELJLAJUQW-GDBMZVCRSA-N 0 3 401.304 4.088 20 0 HIADHN COc1ccc(C[C@H](C)CN[C@@H](C)c2nnn(-c3ccc(F)cc3)c2C)cc1OC ZINC000537962150 938435291 /nfs/dbraw/zinc/43/52/91/938435291.db2.gz MROOHCMONYOORR-HOTGVXAUSA-N 0 3 412.509 4.261 20 0 HIADHN CCc1nc([C@@H](C)N[C@@H](C)CC(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)n[nH]1 ZINC000537961406 938435615 /nfs/dbraw/zinc/43/56/15/938435615.db2.gz JFWGAIMEQACADU-VHSXEESVSA-N 0 3 403.836 4.107 20 0 HIADHN C[C@H]1Cc2ccc(F)cc2[C@H]1NCc1ccc(Br)cc1N1CCOCC1 ZINC000537960615 938435651 /nfs/dbraw/zinc/43/56/51/938435651.db2.gz BNYISQPYRKBBDS-QKKBWIMNSA-N 0 3 419.338 4.448 20 0 HIADHN COCCNS(=O)(=O)c1ccc(CN[C@@H](C)c2ccc(-c3ccccc3)cc2)cc1 ZINC000537967239 938439119 /nfs/dbraw/zinc/43/91/19/938439119.db2.gz ZNXZWLPXZXLPTI-IBGZPJMESA-N 0 3 424.566 4.129 20 0 HIADHN C[C@H](N[C@@H]1CCN(c2cnn(C)c2)C1=O)c1ccc(-c2ccccc2Cl)s1 ZINC000537972105 938441528 /nfs/dbraw/zinc/44/15/28/938441528.db2.gz VZHYGJYVACUJCN-SUMWQHHRSA-N 0 3 400.935 4.258 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(OCCN[C@H](C)c3ccc(F)cn3)c2)cc1 ZINC000537979599 938445451 /nfs/dbraw/zinc/44/54/51/938445451.db2.gz NBOMSBGGEFIAQV-MRXNPFEDSA-N 0 3 409.461 4.211 20 0 HIADHN COc1ccc(-c2ccc(CN[C@@H](C)c3ccc(S(=O)(=O)N(C)C)cc3)cc2)cc1 ZINC000537986270 938448985 /nfs/dbraw/zinc/44/89/85/938448985.db2.gz GSEFFBSFPYFPFD-SFHVURJKSA-N 0 3 424.566 4.463 20 0 HIADHN CCSc1ccc([C@@H](C)NCc2ccc(S(=O)(=O)N3CCCC3)cc2)cc1 ZINC000537989689 938451563 /nfs/dbraw/zinc/45/15/63/938451563.db2.gz CLARCPDZKVSPGI-QGZVFWFLSA-N 0 3 404.601 4.434 20 0 HIADHN C[C@@H](NCc1nnc(-c2ccc(Br)cc2)[nH]1)c1ccc(-n2ccnc2)cc1 ZINC000538017507 938463816 /nfs/dbraw/zinc/46/38/16/938463816.db2.gz DSVKAMCQAMTBBL-CQSZACIVSA-N 0 3 423.318 4.271 20 0 HIADHN C[C@@H]([NH2+]Cc1nnc(-c2ccc(Br)cc2)[n-]1)c1ccc(-n2ccnc2)cc1 ZINC000538017507 938463825 /nfs/dbraw/zinc/46/38/25/938463825.db2.gz DSVKAMCQAMTBBL-CQSZACIVSA-N 0 3 423.318 4.271 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3ccccc3COC(C)(C)C)CC2)C[C@H](C)O1 ZINC000538019677 938464984 /nfs/dbraw/zinc/46/49/84/938464984.db2.gz FTBWUBCVJRPEFM-BGYRXZFFSA-N 0 3 416.606 4.353 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)Nc2ccc(COc3ccccc3)cc2)CC1 ZINC000538032362 938474007 /nfs/dbraw/zinc/47/40/07/938474007.db2.gz RXZWFLQYQFJZLZ-UHFFFAOYSA-N 0 3 411.546 4.277 20 0 HIADHN CC(C)[C@@H](NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)nc1)c1ccc2[nH]c(=O)oc2c1 ZINC000538062031 938491403 /nfs/dbraw/zinc/49/14/03/938491403.db2.gz KLEWFIZKUFFBHJ-XCGNWRKASA-N 0 3 410.518 4.029 20 0 HIADHN COc1ccc(CN(C(=O)NC[C@@H]2CCCCN2C2CC2)[C@@H](C)C2CC2)c(OC)c1 ZINC000563320635 945179849 /nfs/dbraw/zinc/17/98/49/945179849.db2.gz QNSJWJBCIRUHLX-UWJYYQICSA-N 0 3 415.578 4.031 20 0 HIADHN CC(C)NS(=O)(=O)Cc1ccccc1CN[C@@H](c1ccc(Cl)cc1)C1CC1 ZINC000538098833 938501711 /nfs/dbraw/zinc/50/17/11/938501711.db2.gz MRLXMTBEZVAAFH-OAQYLSRUSA-N 0 3 406.979 4.409 20 0 HIADHN Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)N[C@H](C)c1ccc(S(N)(=O)=O)cc1 ZINC000538101027 938502678 /nfs/dbraw/zinc/50/26/78/938502678.db2.gz ZRZMWXCCGREQEE-HUUCEWRRSA-N 0 3 415.584 4.486 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)N[C@H]1CCO[C@@H]1c1ccc(Cl)c(F)c1 ZINC000538116085 938505947 /nfs/dbraw/zinc/50/59/47/938505947.db2.gz IEUYTJKNRYDLMQ-LEWJYISDSA-N 0 3 419.928 4.083 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(OCc2cccnc2)cc1)C(=O)N1CCc2ccccc21 ZINC000538126796 938512813 /nfs/dbraw/zinc/51/28/13/938512813.db2.gz ZJGVEYIKDMKWEX-RBUKOAKNSA-N 0 3 401.510 4.289 20 0 HIADHN O=S(=O)(Cc1cccc(C(F)(F)F)c1)N1C[C@@H]2CCCN2Cc2ccccc21 ZINC000538132988 938516080 /nfs/dbraw/zinc/51/60/80/938516080.db2.gz WTBIRVBSAXDPSW-SFHVURJKSA-N 0 3 410.461 4.020 20 0 HIADHN Cc1ccc([C@H](CN2CCOCC2)NCc2ccc(OCc3cccnc3)cc2)cc1 ZINC000538141603 938518091 /nfs/dbraw/zinc/51/80/91/938518091.db2.gz SAQYUSIWDLXEJY-SANMLTNESA-N 0 3 417.553 4.132 20 0 HIADHN CC[C@H](NCC(=O)N1CCC[C@@H]1c1ccc2c(c1)OCCCO2)c1ccc(OC)cc1 ZINC000538142270 938518815 /nfs/dbraw/zinc/51/88/15/938518815.db2.gz ZYBBFVGMQSVKTK-FCHUYYIVSA-N 0 3 424.541 4.261 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)NC1CCC(C)CC1)c1ccc(NC(=O)c2ccncc2)cc1 ZINC000538187871 938543971 /nfs/dbraw/zinc/54/39/71/938543971.db2.gz JTXFSWVIVQXINL-IOBOIYPZSA-N 0 3 408.546 4.068 20 0 HIADHN CCOc1ccc([C@@H]2CCCN2C(=O)CN[C@H](c2ccccc2)[C@H]2CCOC2)cc1 ZINC000538189561 938545954 /nfs/dbraw/zinc/54/59/54/938545954.db2.gz GFJJFVHDVYLPGD-UMXIMWEHSA-N 0 3 408.542 4.116 20 0 HIADHN C[C@@H](N[C@@H]1CCCN(c2ccccc2)C1=O)c1ccc(NC(=O)c2ccncc2)cc1 ZINC000538193734 938547759 /nfs/dbraw/zinc/54/77/59/938547759.db2.gz CKTGVOGZEWIJPN-WZONZLPQSA-N 0 3 414.509 4.180 20 0 HIADHN COC[C@@H](NC[C@H](CO)Cc1ccc(C(F)(F)F)cc1)c1ccc(F)c(F)c1 ZINC000538194442 938548374 /nfs/dbraw/zinc/54/83/74/938548374.db2.gz KUHZIIQQDMWXDS-AUUYWEPGSA-N 0 3 403.391 4.112 20 0 HIADHN CC[C@@H]1CCCCN1C(=O)[C@@H](C)N[C@H](C)c1ccc(NC(=O)c2ccncc2)cc1 ZINC000538197811 938549984 /nfs/dbraw/zinc/54/99/84/938549984.db2.gz LLOQTHGWPUNMNC-JBYIUTFZSA-N 0 3 408.546 4.164 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@@H](C)NCc2cc(-c3ccccc3)no2)CC1 ZINC000538209336 938556542 /nfs/dbraw/zinc/55/65/42/938556542.db2.gz BFVCFSHGNZKUJQ-GOSISDBHSA-N 0 3 408.521 4.473 20 0 HIADHN Cc1n[nH]c(C)c1[C@@H]1CCCN1C(=O)N[C@@H](CN1CCc2ccccc2C1)C(C)(C)C ZINC000538215532 938558936 /nfs/dbraw/zinc/55/89/36/938558936.db2.gz YUGDNBKQPCWPLQ-VXKWHMMOSA-N 0 3 423.605 4.346 20 0 HIADHN Cc1n[nH]c(C)c1[C@H]1CCCN1C(=O)N[C@@H](CN1CCc2ccccc2C1)C(C)(C)C ZINC000538215534 938559343 /nfs/dbraw/zinc/55/93/43/938559343.db2.gz YUGDNBKQPCWPLQ-YADHBBJMSA-N 0 3 423.605 4.346 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)N[C@@H](C)c1ccc2ccccc2c1)c1ccc(-n2ccnn2)cc1 ZINC000538234387 938567993 /nfs/dbraw/zinc/56/79/93/938567993.db2.gz LSSCYGSQGTUEFS-QYZOEREBSA-N 0 3 413.525 4.337 20 0 HIADHN C[C@H](NCC(=O)N[C@@H](C)c1ccc(Cl)cc1Cl)c1ccc(-n2ccnn2)cc1 ZINC000538233606 938568023 /nfs/dbraw/zinc/56/80/23/938568023.db2.gz UXJDDDTVABRHJY-KBPBESRZSA-N 0 3 418.328 4.102 20 0 HIADHN C[C@@H](NCC(=O)N[C@@H](C)c1ccc(Cl)cc1Cl)c1ccc(-n2ccnn2)cc1 ZINC000538233611 938568079 /nfs/dbraw/zinc/56/80/79/938568079.db2.gz UXJDDDTVABRHJY-KGLIPLIRSA-N 0 3 418.328 4.102 20 0 HIADHN COc1ccc(CNC(=O)[C@H](C)N[C@@H](C)c2ccc(-c3ccncc3)cc2)cc1OC ZINC000538235834 938568444 /nfs/dbraw/zinc/56/84/44/938568444.db2.gz PYGZZVIOZDXXHB-ROUUACIJSA-N 0 3 419.525 4.121 20 0 HIADHN Cc1cccc(N2CCN(C(=O)CN[C@H](C)c3ccc(-c4ccncc4)cc3)CC2)c1 ZINC000538237562 938569777 /nfs/dbraw/zinc/56/97/77/938569777.db2.gz WBGIOUOSNHQBLO-OAQYLSRUSA-N 0 3 414.553 4.056 20 0 HIADHN C[C@@H](NCC(=O)Nc1ccc(Br)cc1)c1cccc(N2CCCC2)c1 ZINC000538280836 938582578 /nfs/dbraw/zinc/58/25/78/938582578.db2.gz WGMLJNDSGVNLCD-OAHLLOKOSA-N 0 3 402.336 4.339 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@H](C)N[C@H](c2ccc(F)c(C)c2)C2CC2)cc1OC ZINC000538323118 938592615 /nfs/dbraw/zinc/59/26/15/938592615.db2.gz JWHZKQSBSMUERC-HJPURHCSSA-N 0 3 414.521 4.239 20 0 HIADHN CO[C@H](c1ccccc1F)[C@@H](C)NC(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000538372803 938606170 /nfs/dbraw/zinc/60/61/70/938606170.db2.gz KFOBBJSKHHZPRS-BPAFIMBUSA-N 0 3 405.539 4.100 20 0 HIADHN CSCC[C@@H](CO)NCc1c(C)nn(-c2ccccc2)c1Oc1cccc(F)c1 ZINC000538421480 938616993 /nfs/dbraw/zinc/61/69/93/938616993.db2.gz KAUWWHZVQOLFEK-SFHVURJKSA-N 0 3 415.534 4.316 20 0 HIADHN CN(C)Cc1cccc(NC(=O)C(=O)N[C@@H]2C[C@H]3CCC(C)(C)c4cccc2c43)c1 ZINC000538483230 938632270 /nfs/dbraw/zinc/63/22/70/938632270.db2.gz DYRQLKBRTNGAJD-DYESRHJHSA-N 0 3 405.542 4.103 20 0 HIADHN CCN1CCN(Cc2ccc(N[C@H](c3ccc4[nH]c(=O)oc4c3)C(C)C)cc2)CC1 ZINC000538535948 938643795 /nfs/dbraw/zinc/64/37/95/938643795.db2.gz QIYHAYIGAAKBIR-QHCPKHFHSA-N 0 3 408.546 4.480 20 0 HIADHN OC[C@H]1C=C[C@@H](NCc2cn(-c3ccccc3)nc2-c2cccc(Br)c2)C1 ZINC000538609727 938660714 /nfs/dbraw/zinc/66/07/14/938660714.db2.gz QSLSLDTWUYZUKR-OXJNMPFZSA-N 0 3 424.342 4.328 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)c1cnn(Cc2ccccc2Cl)c1)c1ccco1 ZINC000563472593 945194616 /nfs/dbraw/zinc/19/46/16/945194616.db2.gz QARCLKLFHKPZKP-KXBFYZLASA-N 0 3 400.910 4.037 20 0 HIADHN NC(=O)[C@@H](N[C@H]1CC=C(c2ccc(F)cc2)CC1)c1cccc(Br)c1 ZINC000538655169 938674700 /nfs/dbraw/zinc/67/47/00/938674700.db2.gz OMWZQUTUWLWSJB-OALUTQOASA-N 0 3 403.295 4.340 20 0 HIADHN CCOc1ccc(-c2nc(CN3CCC[C@@H](c4nnc(C)[nH]4)C3)cs2)cc1OC ZINC000538661267 938676625 /nfs/dbraw/zinc/67/66/25/938676625.db2.gz DRWWQPCKZKHDED-MRXNPFEDSA-N 0 3 413.547 4.024 20 0 HIADHN C[C@@H](C(=O)c1c[nH]c2ncccc12)N1CCC[C@H](c2nc(C3CCCCC3)n[nH]2)C1 ZINC000538664596 938678875 /nfs/dbraw/zinc/67/88/75/938678875.db2.gz RLPQFZVPRKVYCU-RDJZCZTQSA-N 0 3 406.534 4.180 20 0 HIADHN COC(=O)[C@H]1CC12CCN(Cc1cn(Cc3ccccc3)nc1-c1ccccc1)CC2 ZINC000538725848 938692762 /nfs/dbraw/zinc/69/27/62/938692762.db2.gz BKFVGIQYPMOLSO-HSZRJFAPSA-N 0 3 415.537 4.374 20 0 HIADHN CC(C)(C)c1nn(Cc2ccccc2)cc1CN1CCC[C@H](C(=O)N2CCCC2)C1 ZINC000538729409 938694379 /nfs/dbraw/zinc/69/43/79/938694379.db2.gz NBCMHVSCEUEPGI-NRFANRHFSA-N 0 3 408.590 4.063 20 0 HIADHN C/C(=C\c1ccccc1)CN1CCC(C(=O)c2ccc3c(c2)NC(=O)[C@@H](C)O3)CC1 ZINC000538739618 938697667 /nfs/dbraw/zinc/69/76/67/938697667.db2.gz INTVNIBWZUHDOQ-UWXVCKHVSA-N 0 3 404.510 4.404 20 0 HIADHN CCN(CC)[C@H](CNC(=O)C1C[C@@H](C)O[C@H](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000538744615 938699622 /nfs/dbraw/zinc/69/96/22/938699622.db2.gz FBVFZSYXCBIMIA-SPYBWZPUSA-N 0 3 400.485 4.408 20 0 HIADHN C[C@H](NCc1ccc(S(=O)(=O)N2CCC[C@H](C)C2)cc1)c1ccccc1N(C)C ZINC000538759976 938703554 /nfs/dbraw/zinc/70/35/54/938703554.db2.gz IRPZORTUCCWCGV-OALUTQOASA-N 0 3 415.603 4.024 20 0 HIADHN COc1ccc(CN(C(=O)N[C@@H]2CN(C3CC3)C[C@@H]2C)C2CCCCC2)cc1OC ZINC000538811842 938718991 /nfs/dbraw/zinc/71/89/91/938718991.db2.gz JPFHRQFVYROYBJ-LAUBAEHRSA-N 0 3 415.578 4.031 20 0 HIADHN CCN(CC)[C@H](C(=O)Nc1cc(CN(C)C)ccn1)c1cccc(C(F)(F)F)c1 ZINC000538822650 938720576 /nfs/dbraw/zinc/72/05/76/938720576.db2.gz XWQPFXDYUUKBKY-IBGZPJMESA-N 0 3 408.468 4.184 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)[C@@H]2C[C@H]2c2cccc(F)c2F)cc1 ZINC000538830403 938721411 /nfs/dbraw/zinc/72/14/11/938721411.db2.gz MJTFNFALJDBQQY-ZVDOUQERSA-N 0 3 400.469 4.030 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)Cc2cccc(OCc3cccnc3)c2)C1 ZINC000538839835 938723253 /nfs/dbraw/zinc/72/32/53/938723253.db2.gz BGFFFYAPUUMQEU-GBXCKJPGSA-N 0 3 415.537 4.155 20 0 HIADHN COCCn1ccc2ccc(NC(=O)N[C@H]3C[C@@H](C)N(Cc4ccccc4)C3)cc21 ZINC000538903148 938734400 /nfs/dbraw/zinc/73/44/00/938734400.db2.gz SYYPTWJCNRHLHI-GCJKJVERSA-N 0 3 406.530 4.072 20 0 HIADHN c1csc(-c2noc(CCCN3CC=C(c4ccc5c(c4)OCCO5)CC3)n2)c1 ZINC000538944038 938743290 /nfs/dbraw/zinc/74/32/90/938743290.db2.gz ZMPUFDWBJVNDLI-UHFFFAOYSA-N 0 3 409.511 4.291 20 0 HIADHN CCc1nc2ccccc2n1C1CCN(CC(=O)N(Cc2ccccc2)C2CC2)CC1 ZINC000538955733 938748855 /nfs/dbraw/zinc/74/88/55/938748855.db2.gz LTKWQBKOWHZNLC-UHFFFAOYSA-N 0 3 416.569 4.427 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)N[C@@H](c1ccccc1)[C@H]1CCOC1 ZINC000538996247 938763793 /nfs/dbraw/zinc/76/37/93/938763793.db2.gz GNLYRUZZIFWUJR-QDSKXPNFSA-N 0 3 407.558 4.070 20 0 HIADHN CC[C@@H](NCc1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1)c1cccc(Cl)c1 ZINC000539044998 938781220 /nfs/dbraw/zinc/78/12/20/938781220.db2.gz XTJCUIHCJVZJKQ-PZJWPPBQSA-N 0 3 422.978 4.038 20 0 HIADHN O[C@@H](CN[C@@H]1CCSc2c(F)cccc21)COc1ccccc1Br ZINC000539060298 938787805 /nfs/dbraw/zinc/78/78/05/938787805.db2.gz UBNMBELQVHFSDW-BLLLJJGKSA-N 0 3 412.324 4.155 20 0 HIADHN COCCSc1ccc([C@@H](C)N[C@H](C)c2ccc(S(=O)(=O)N(C)C)cc2)cc1 ZINC000539076571 938796129 /nfs/dbraw/zinc/79/61/29/938796129.db2.gz GXPWEPDMCIBHCU-IAGOWNOFSA-N 0 3 422.616 4.087 20 0 HIADHN C[C@H](N[C@H]1CC(=O)N(c2ccccc2Cl)C1)c1ccc(OCc2nccn2C)cc1 ZINC000539079770 938797311 /nfs/dbraw/zinc/79/73/11/938797311.db2.gz HXSZASZBDFGPTN-WMZOPIPTSA-N 0 3 424.932 4.109 20 0 HIADHN C[C@@H](NCCCN1C(=O)COc2ccccc21)c1ccc(F)cc1Br ZINC000539088102 938800104 /nfs/dbraw/zinc/80/01/04/938800104.db2.gz YOKRDYQAHAQVOP-CYBMUJFWSA-N 0 3 407.283 4.055 20 0 HIADHN Cc1cc(N2CC[C@@H](N[C@@H](C)c3ccc(OCc4ccccc4C)cc3)C2=O)n(C)n1 ZINC000539088545 938800109 /nfs/dbraw/zinc/80/01/09/938800109.db2.gz VDOSXZIFZBIRHL-WMZHIEFXSA-N 0 3 418.541 4.072 20 0 HIADHN O=C(NCCN[C@@H]1CCSc2ccc(F)cc21)c1cccc(Br)c1 ZINC000539086956 938800160 /nfs/dbraw/zinc/80/01/60/938800160.db2.gz CXQVQPBVDOEXBI-MRXNPFEDSA-N 0 3 409.324 4.145 20 0 HIADHN COC[C@H](N[C@@H](C)CC(=O)Nc1ccc(OC(F)(F)F)cc1)c1ccc(F)cc1 ZINC000539090016 938800749 /nfs/dbraw/zinc/80/07/49/938800749.db2.gz GGHWMZZNBXLEIA-UGSOOPFHSA-N 0 3 414.399 4.419 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(S(=O)(=O)N(C)C)cc1)c1cccc(-c2ccncc2)c1 ZINC000539090779 938801125 /nfs/dbraw/zinc/80/11/25/938801125.db2.gz BUPDDAVWHNHTTI-ZWKOTPCHSA-N 0 3 409.555 4.411 20 0 HIADHN C[C@H](NCc1ccc(C(=O)N2CCCCC2)cc1)c1cccc(N2CCOCC2)c1 ZINC000539092208 938801362 /nfs/dbraw/zinc/80/13/62/938801362.db2.gz ZDXFYPWTKCTCBP-FQEVSTJZSA-N 0 3 407.558 4.000 20 0 HIADHN CCN1CCCN(C(=O)Nc2ccnc(Oc3ccccc3Br)c2)CC1 ZINC000539149609 938811581 /nfs/dbraw/zinc/81/15/81/938811581.db2.gz VNOHYUGTOJGAFQ-UHFFFAOYSA-N 0 3 419.323 4.196 20 0 HIADHN C[C@H](NC[C@H](c1cccs1)N1CCOCC1)c1nc2ccc(Cl)cc2n1C ZINC000539162128 938814254 /nfs/dbraw/zinc/81/42/54/938814254.db2.gz VNSZYVOACDVUCO-KBXCAEBGSA-N 0 3 404.967 4.012 20 0 HIADHN Brc1cccc2c1CC[C@@H]2N[C@H](CN1CCOCC1)c1ccccc1 ZINC000539164750 938814805 /nfs/dbraw/zinc/81/48/05/938814805.db2.gz XXPKPEKFFVQCDL-LEWJYISDSA-N 0 3 401.348 4.100 20 0 HIADHN CN1CCN(c2ncccc2CN[C@H](c2cccc(C(F)(F)F)c2)C2CC2)CC1 ZINC000539200204 938818527 /nfs/dbraw/zinc/81/85/27/938818527.db2.gz CDZPBNKVOVFRAD-FQEVSTJZSA-N 0 3 404.480 4.093 20 0 HIADHN CC(C)[C@H](NCc1ccc(S(=O)(=O)N(C)C)cc1)c1ccc(C(F)(F)F)cc1 ZINC000539214398 938819837 /nfs/dbraw/zinc/81/98/37/938819837.db2.gz JUNXEYVFXPFRPK-IBGZPJMESA-N 0 3 414.493 4.443 20 0 HIADHN CCc1cnccc1[C@H](C)N[C@@H](C)c1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000539216305 938820170 /nfs/dbraw/zinc/82/01/70/938820170.db2.gz UDNLFYBNLHTHCY-ROUUACIJSA-N 0 3 401.576 4.230 20 0 HIADHN CCc1cnccc1[C@@H](C)N[C@@H](C)c1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000539216306 938820238 /nfs/dbraw/zinc/82/02/38/938820238.db2.gz UDNLFYBNLHTHCY-ZWKOTPCHSA-N 0 3 401.576 4.230 20 0 HIADHN C[C@H](N[C@H](c1ccc(Br)cc1)C1CCC1)c1cccc(S(N)(=O)=O)c1 ZINC000539216833 938820259 /nfs/dbraw/zinc/82/02/59/938820259.db2.gz KLNSVWKKKQUCNM-DJJJIMSYSA-N 0 3 423.376 4.289 20 0 HIADHN COc1ccc(OCCN[C@@H](CN2CCCC2=O)c2cccc(C(F)(F)F)c2)cc1 ZINC000539221351 938820734 /nfs/dbraw/zinc/82/07/34/938820734.db2.gz ZQRYJWREOGDQJK-FQEVSTJZSA-N 0 3 422.447 4.046 20 0 HIADHN CC(C)C[C@@H](NCC(=O)NC1CCN(C(=O)C2CCCCC2)CC1)c1ccccc1 ZINC000539242253 938824067 /nfs/dbraw/zinc/82/40/67/938824067.db2.gz ZNDKJOIJAVYSFQ-HSZRJFAPSA-N 0 3 413.606 4.051 20 0 HIADHN C[C@@H](NCCC(=O)Nc1ccc(N2CCCC2=O)cc1)c1ccccc1OC(F)F ZINC000539246858 938825232 /nfs/dbraw/zinc/82/52/32/938825232.db2.gz RUGULNJQEDJNMG-OAHLLOKOSA-N 0 3 417.456 4.094 20 0 HIADHN CC(C)[C@H](NCc1cccc(S(=O)(=O)N(C)C)c1)c1cccc(C(F)(F)F)c1 ZINC000539260619 938828850 /nfs/dbraw/zinc/82/88/50/938828850.db2.gz PUJYCZGTEPBHKB-IBGZPJMESA-N 0 3 414.493 4.443 20 0 HIADHN C[C@@H](NCC(=O)N(Cc1ccccc1)[C@H](C)C1CC1)c1ccccc1-n1cccn1 ZINC000539260022 938828971 /nfs/dbraw/zinc/82/89/71/938828971.db2.gz NVEQIQNEQCFNHP-WOJBJXKFSA-N 0 3 402.542 4.350 20 0 HIADHN COc1ccc2cc(CN(C)C(=O)CN[C@@H](c3ccccc3)[C@H]3CCOC3)ccc2c1 ZINC000539288888 938834161 /nfs/dbraw/zinc/83/41/61/938834161.db2.gz GWKSEKZMXBOHFT-OZXSUGGESA-N 0 3 418.537 4.174 20 0 HIADHN CCOc1ccccc1[C@@H](CC)NC(=O)CN[C@@H](C)c1cccc(-n2cccn2)c1 ZINC000539290352 938834567 /nfs/dbraw/zinc/83/45/67/938834567.db2.gz YEZRNJJJRPCPPZ-PGRDOPGGSA-N 0 3 406.530 4.189 20 0 HIADHN COc1ccc([C@H]2CCCN2C(=O)CNC2(c3ccccc3)CCCC2)cc1OC ZINC000539290838 938834765 /nfs/dbraw/zinc/83/47/65/938834765.db2.gz LWEPYUNRQAUNGU-OAQYLSRUSA-N 0 3 408.542 4.426 20 0 HIADHN C[C@H](NC[C@@H]1CC[C@H](C(=O)N(C)C)O1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000539295696 938835539 /nfs/dbraw/zinc/83/55/39/938835539.db2.gz QQYHFYZRCYDCQH-NZVBXONLSA-N 0 3 412.374 4.011 20 0 HIADHN COc1ccc([C@@H](NC2CCN(CC(F)(F)F)CC2)c2ccccc2OC)cc1 ZINC000539295884 938835589 /nfs/dbraw/zinc/83/55/89/938835589.db2.gz UVPHAAJBQUTNGO-OAQYLSRUSA-N 0 3 408.464 4.410 20 0 HIADHN O=C(CN[C@H](c1ccccc1)[C@H]1CCOC1)N[C@H](c1cccs1)c1ccc(F)cc1 ZINC000539297587 938835863 /nfs/dbraw/zinc/83/58/63/938835863.db2.gz HGKAKKNBWISVKQ-IEXUWNMDSA-N 0 3 424.541 4.460 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)N[C@H]1CCO[C@@H]1c1ccc(Cl)cc1 ZINC000539305534 938837773 /nfs/dbraw/zinc/83/77/73/938837773.db2.gz KKEBAIRJPDMNOD-FXAWDEMLSA-N 0 3 403.910 4.062 20 0 HIADHN O=C(CN[C@@H](C[C@H]1CCOC1)c1ccccc1)Nc1ccc2c(c1)OC1(CCCC1)O2 ZINC000539325259 938841575 /nfs/dbraw/zinc/84/15/75/938841575.db2.gz GLTOUYMPYHCOGN-NQIIRXRSSA-N 0 3 422.525 4.424 20 0 HIADHN O=C(CN[C@@H](c1cccc(F)c1)C1CCCC1)Nc1ccccc1N1CCCC1=O ZINC000539334830 938843566 /nfs/dbraw/zinc/84/35/66/938843566.db2.gz LZLKITQPNGMSAT-XMMPIXPASA-N 0 3 409.505 4.412 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(-n2cccn2)cc1)C(=O)N(C)Cc1nc2ccccc2s1 ZINC000539336348 938844074 /nfs/dbraw/zinc/84/40/74/938844074.db2.gz IGEQCDLPRAQBJD-IRXDYDNUSA-N 0 3 419.554 4.180 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)N[C@H](C)C(=O)Nc2nc3ccccc3s2)cc1 ZINC000539363609 938849116 /nfs/dbraw/zinc/84/91/16/938849116.db2.gz PYIPCZICRSAIQU-HUUCEWRRSA-N 0 3 405.527 4.468 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)N[C@H](C)C(=O)Nc2ccc(OC(F)F)cc2)cc1 ZINC000539368354 938849883 /nfs/dbraw/zinc/84/98/83/938849883.db2.gz OQSWPMRIGWMIJW-HUUCEWRRSA-N 0 3 414.456 4.460 20 0 HIADHN COc1cc(OC)c(NC(=O)CN[C@@H](C)c2cccc(N3CCCC3)c2)cc1Cl ZINC000539378996 938851808 /nfs/dbraw/zinc/85/18/08/938851808.db2.gz NJEFXBMBJRPBLS-HNNXBMFYSA-N 0 3 417.937 4.247 20 0 HIADHN CC[C@@H](C(=O)NCCCCN1CCN(c2cccc(C)c2)CC1)c1ccc(OC)cc1 ZINC000539398770 938854973 /nfs/dbraw/zinc/85/49/73/938854973.db2.gz LDKBVPGLDWCSCX-RUZDIDTESA-N 0 3 423.601 4.216 20 0 HIADHN CO[C@@H](c1ccccc1F)[C@@H](C)NC(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000539470169 938865162 /nfs/dbraw/zinc/86/51/62/938865162.db2.gz IYPGXCZXLWFEPB-WZONZLPQSA-N 0 3 413.537 4.208 20 0 HIADHN CO[C@H](c1ccccc1F)[C@H](C)NC(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000539470168 938865189 /nfs/dbraw/zinc/86/51/89/938865189.db2.gz IYPGXCZXLWFEPB-MBSDFSHPSA-N 0 3 413.537 4.208 20 0 HIADHN CCOc1ccccc1[C@@H](CC)NC(=O)CN[C@@H](c1ccc2c(c1)OCCO2)C1CC1 ZINC000539491666 938867847 /nfs/dbraw/zinc/86/78/47/938867847.db2.gz XGUYGKKYOQJOAV-CJFMBICVSA-N 0 3 424.541 4.165 20 0 HIADHN COC(=O)c1cc(Cl)cc(Cl)c1NC(=O)CN[C@H](c1ccccc1)C1CC1 ZINC000539492574 938868175 /nfs/dbraw/zinc/86/81/75/938868175.db2.gz CJVSDWZDARIZQU-GOSISDBHSA-N 0 3 407.297 4.459 20 0 HIADHN COc1ccc(C)cc1CNCc1cc(C(F)(F)F)ccc1N1CCN(C)CC1 ZINC000539502655 938869434 /nfs/dbraw/zinc/86/94/34/938869434.db2.gz KOHUWJJVVWBXPC-UHFFFAOYSA-N 0 3 407.480 4.064 20 0 HIADHN CCN(CC)CCN(C(=O)[C@H]1CCC(=O)C[C@@H]1C)c1cccc(Br)c1 ZINC000539546861 938878100 /nfs/dbraw/zinc/87/81/00/938878100.db2.gz XKOCWKLDHCXXND-KXBFYZLASA-N 0 3 409.368 4.129 20 0 HIADHN CCN1CCN(Cc2ccc(N[C@@H](C)c3nnn(-c4ccc(C)cc4)c3C)cc2)CC1 ZINC000539635449 938891410 /nfs/dbraw/zinc/89/14/10/938891410.db2.gz ZVIMEOBMKCCOMF-FQEVSTJZSA-N 0 3 418.589 4.195 20 0 HIADHN CCN1CCN(c2ccccc2N[C@@H](C)c2ccc(OCc3nccn3C)cc2)CC1 ZINC000539646329 938892989 /nfs/dbraw/zinc/89/29/89/938892989.db2.gz LSVWKFKKFIYWBJ-FQEVSTJZSA-N 0 3 419.573 4.314 20 0 HIADHN CC[C@H](C)Oc1cc(C(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)ccn1 ZINC000539665615 938897029 /nfs/dbraw/zinc/89/70/29/938897029.db2.gz DOERZKSSJKDMLM-RXVVDRJESA-N 0 3 419.529 4.155 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)c2cccc(NC(=O)c3cccs3)c2)cc1 ZINC000563556768 945213988 /nfs/dbraw/zinc/21/39/88/945213988.db2.gz IIIIGUOMLUVTBA-FQEVSTJZSA-N 0 3 423.538 4.042 20 0 HIADHN C[C@@H](c1nc(-c2cccnc2)no1)N1CCC[C@H](c2nc(C3CCCCC3)n[nH]2)C1 ZINC000539764272 938928986 /nfs/dbraw/zinc/92/89/86/938928986.db2.gz BMEMLFDMYHPQPN-YJBOKZPZSA-N 0 3 407.522 4.238 20 0 HIADHN C[C@@H](c1nc(-c2cccnc2)no1)N1CCC[C@H](c2n[nH]c(C3CCCCC3)n2)C1 ZINC000539764272 938928994 /nfs/dbraw/zinc/92/89/94/938928994.db2.gz BMEMLFDMYHPQPN-YJBOKZPZSA-N 0 3 407.522 4.238 20 0 HIADHN COc1ccc(-c2nnc(CN3CCC[C@@H](c4nc(C5CCCCC5)n[nH]4)C3)o2)cc1 ZINC000539765750 938929486 /nfs/dbraw/zinc/92/94/86/938929486.db2.gz ORBXCQFCQOKNNP-GOSISDBHSA-N 0 3 422.533 4.291 20 0 HIADHN COc1ccc(-c2nnc(CN3CCC[C@@H](c4n[nH]c(C5CCCCC5)n4)C3)o2)cc1 ZINC000539765750 938929495 /nfs/dbraw/zinc/92/94/95/938929495.db2.gz ORBXCQFCQOKNNP-GOSISDBHSA-N 0 3 422.533 4.291 20 0 HIADHN CN(C)CCn1cc(NC(=O)c2cccc(Oc3ccc(Cl)cc3)c2)ccc1=O ZINC000539791444 938935444 /nfs/dbraw/zinc/93/54/44/938935444.db2.gz ZYHJMBYVTCOETK-UHFFFAOYSA-N 0 3 411.889 4.108 20 0 HIADHN COc1ccc(CN2CCC(C(=O)N(Cc3ccccc3)C3CC3)CC2)cc1OC ZINC000539817182 938941002 /nfs/dbraw/zinc/94/10/02/938941002.db2.gz LGPFHRCLUQHVQA-UHFFFAOYSA-N 0 3 408.542 4.107 20 0 HIADHN Cc1ccc(-c2n[nH]cc2CN2CCC(C(=O)N(Cc3ccccc3)C3CC3)CC2)o1 ZINC000539818465 938941740 /nfs/dbraw/zinc/94/17/40/938941740.db2.gz PZSFOFDIOYDTFW-UHFFFAOYSA-N 0 3 418.541 4.381 20 0 HIADHN COc1ccc([C@@H](CO)N(C)Cc2cc(C)c(OCc3ccccn3)c(C)c2)cc1 ZINC000539828056 938949167 /nfs/dbraw/zinc/94/91/67/938949167.db2.gz DJLKYQHTTYYDIC-XMMPIXPASA-N 0 3 406.526 4.451 20 0 HIADHN COc1cc(CN2CCC(CN3CCCCC3=O)CC2)ccc1OCc1ccccc1 ZINC000539838276 938953727 /nfs/dbraw/zinc/95/37/27/938953727.db2.gz QJFNHZMAVFLGKF-UHFFFAOYSA-N 0 3 422.569 4.499 20 0 HIADHN CCCC[C@@H](NCc1cccc2nccn21)C(=O)Nc1cccc(N2CCCC2)c1 ZINC000539859993 938959806 /nfs/dbraw/zinc/95/98/06/938959806.db2.gz CADDTIJXWZQYPR-JOCHJYFZSA-N 0 3 405.546 4.222 20 0 HIADHN Brc1ccc2c(c1)[C@H](N1CCC[C@H](c3nnc4n3CCC4)C1)CCC2 ZINC000539882905 938965328 /nfs/dbraw/zinc/96/53/28/938965328.db2.gz YSCVAPXLIKCJOB-MAUKXSAKSA-N 0 3 401.352 4.244 20 0 HIADHN O=C(Nc1cccc(CN2CCS[C@@H]3COCC[C@H]32)c1)c1ccccc1Cl ZINC000539909613 938976163 /nfs/dbraw/zinc/97/61/63/938976163.db2.gz FNVWFAKRISDFTD-WOJBJXKFSA-N 0 3 402.947 4.299 20 0 HIADHN CCc1ccc([C@H](CNC(=O)Cc2cccc(OCc3cccnc3)c2)N(C)C)cc1 ZINC000539961042 938981582 /nfs/dbraw/zinc/98/15/82/938981582.db2.gz WSFVNMLFPZBOOO-VWLOTQADSA-N 0 3 417.553 4.185 20 0 HIADHN COc1cccc(COc2cccc(Cl)c2CN[C@H]2CCO[C@@]3(CCOC3)C2)c1 ZINC000539976870 939028474 /nfs/dbraw/zinc/02/84/74/939028474.db2.gz FNVOOKDIWCANKE-MBSDFSHPSA-N 0 3 417.933 4.355 20 0 HIADHN Cc1ccncc1C(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1 ZINC000540021585 939041656 /nfs/dbraw/zinc/04/16/56/939041656.db2.gz SROOWXHNAXIPGD-UHFFFAOYSA-N 0 3 400.526 4.007 20 0 HIADHN C[C@@H](CC(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1)Cc1ccc(Cl)cc1 ZINC000540054477 939052121 /nfs/dbraw/zinc/05/21/21/939052121.db2.gz RVJLSWGAXNQLGO-QRVBRYPASA-N 0 3 406.998 4.257 20 0 HIADHN Cc1cc2ncc([C@@H](C)NCc3ccccc3CN(C)Cc3ccco3)c(C)n2n1 ZINC000540085830 939064821 /nfs/dbraw/zinc/06/48/21/939064821.db2.gz SXKWUHNJHPFKCY-GOSISDBHSA-N 0 3 403.530 4.422 20 0 HIADHN C[C@H](NC[C@H](CO)Cc1cccc(OC(F)(F)F)c1)c1nc2c(s1)CCCC2 ZINC000540086789 939065024 /nfs/dbraw/zinc/06/50/24/939065024.db2.gz QLFKJVVUWKQGIH-DZGCQCFKSA-N 0 3 414.493 4.422 20 0 HIADHN Cc1cc(NC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)nn1-c1ccccc1 ZINC000540110481 939075731 /nfs/dbraw/zinc/07/57/31/939075731.db2.gz HLOLQVRQMTZEPX-IBGZPJMESA-N 0 3 403.530 4.309 20 0 HIADHN CC(C)Cn1cc(NC(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)c(C(F)F)n1 ZINC000540114041 939077272 /nfs/dbraw/zinc/07/72/72/939077272.db2.gz HTWSJGNGORFZMA-NVXWUHKLSA-N 0 3 405.493 4.434 20 0 HIADHN C[C@@H](NCc1ccc(S(=O)(=O)N2CCCC2)cc1)c1ccccc1C(F)(F)F ZINC000540119484 939079578 /nfs/dbraw/zinc/07/95/78/939079578.db2.gz BYSFULXPBOGXKQ-OAHLLOKOSA-N 0 3 412.477 4.341 20 0 HIADHN C[C@H](CC(=O)Nc1cccc(Cl)c1)N[C@@H](CO)c1ccc(Br)cc1 ZINC000540142023 939088925 /nfs/dbraw/zinc/08/89/25/939088925.db2.gz XJXFFYWLBSENKP-PXAZEXFGSA-N 0 3 411.727 4.143 20 0 HIADHN C[C@H](N[C@@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000540144188 939090351 /nfs/dbraw/zinc/09/03/51/939090351.db2.gz LHTCAMJPAYFNQX-GXTWGEPZSA-N 0 3 415.896 4.165 20 0 HIADHN C[C@@H](NCc1ccc(CO)c(F)c1)c1cccc(OCc2cn3ccccc3n2)c1 ZINC000540157043 939094961 /nfs/dbraw/zinc/09/49/61/939094961.db2.gz YUQNPBVEHOXAAF-QGZVFWFLSA-N 0 3 405.473 4.396 20 0 HIADHN COc1ccc(C[C@H](N[C@@H]2CCN(C(C)=O)C2)c2cc(Cl)ccc2Cl)cc1 ZINC000540161719 939097712 /nfs/dbraw/zinc/09/77/12/939097712.db2.gz VJSFXDSTWGQKMA-UTKZUKDTSA-N 0 3 407.341 4.496 20 0 HIADHN C[C@@H](NCc1cnc2ccccc2c1)c1ccc(S(=O)(=O)NCc2ccco2)cc1 ZINC000540169309 939100471 /nfs/dbraw/zinc/10/04/71/939100471.db2.gz CURFAMLIWNYBQP-QGZVFWFLSA-N 0 3 421.522 4.157 20 0 HIADHN Cc1nc(Cc2ccccc2)sc1[C@@H](C)NCCNC(=O)c1c(F)cccc1F ZINC000540179638 939107660 /nfs/dbraw/zinc/10/76/60/939107660.db2.gz ZNJLRSDYLLUGPN-CQSZACIVSA-N 0 3 415.509 4.401 20 0 HIADHN Cc1cccc(COc2ccc([C@H](C)N[C@H]3CCCN(c4ccn(C)n4)C3=O)cc2)c1 ZINC000540181408 939108386 /nfs/dbraw/zinc/10/83/86/939108386.db2.gz GGNYELKVXBYTEA-CVDCTZTESA-N 0 3 418.541 4.154 20 0 HIADHN Cc1ccc(S(=O)(=O)N2CCC(N[C@@H](C)c3c(F)cccc3Cl)CC2)cc1 ZINC000540183438 939109515 /nfs/dbraw/zinc/10/95/15/939109515.db2.gz IMMRYYZARHIEEF-HNNXBMFYSA-N 0 3 410.942 4.291 20 0 HIADHN CC[C@H](N[C@@H](c1cccc(S(C)(=O)=O)c1)c1cc(F)ccc1F)C1CCOCC1 ZINC000540188405 939113345 /nfs/dbraw/zinc/11/33/45/939113345.db2.gz JIBOBIUBDHEVGP-VXKWHMMOSA-N 0 3 423.525 4.253 20 0 HIADHN CCOc1ccc([C@H](C)N[C@@H](C)c2ccc(NS(C)(=O)=O)cc2)cc1OCC ZINC000540190202 939114930 /nfs/dbraw/zinc/11/49/30/939114930.db2.gz GVGHLKMWUWMPPP-HOTGVXAUSA-N 0 3 406.548 4.267 20 0 HIADHN Cc1cc(C)c([C@H](C)NCc2ccccc2OCC(=O)NC[C@@H]2CCCO2)cc1C ZINC000540191634 939115818 /nfs/dbraw/zinc/11/58/18/939115818.db2.gz SRCRPQMFWGIFBF-UNMCSNQZSA-N 0 3 410.558 4.137 20 0 HIADHN CC(C)NC(=O)Nc1ccc([C@H](C)NCc2ccc(Cn3ccccc3=O)cc2)cc1 ZINC000540192358 939117205 /nfs/dbraw/zinc/11/72/05/939117205.db2.gz IQAPSRYNQIFYNB-IBGZPJMESA-N 0 3 418.541 4.277 20 0 HIADHN COc1ccc(CN[C@@H](C)[C@H](OC)c2ccc(Br)cc2)c(OC)c1OC ZINC000540223528 939139864 /nfs/dbraw/zinc/13/98/64/939139864.db2.gz LNBIOHXCSNQDNP-UGSOOPFHSA-N 0 3 424.335 4.341 20 0 HIADHN CCCN1C(=O)CCc2cc(NC(=O)[C@@H]3CCCN(Cc4cccc(F)c4)C3)ccc21 ZINC000540249134 939167207 /nfs/dbraw/zinc/16/72/07/939167207.db2.gz UGQZOFAXGLAYPI-HXUWFJFHSA-N 0 3 423.532 4.366 20 0 HIADHN CN1CCN(C(=O)c2ccc(CN[C@H](c3ccccc3F)C3CCCC3)cc2)CC1 ZINC000540266035 939177489 /nfs/dbraw/zinc/17/74/89/939177489.db2.gz WGMLNOHEWKLLOC-DEOSSOPVSA-N 0 3 409.549 4.234 20 0 HIADHN CC(C)[C@H](NCc1cccc(NC(=O)[C@@H]2CCCO2)c1)c1ccc2[nH]c(=O)oc2c1 ZINC000540302902 939187896 /nfs/dbraw/zinc/18/78/96/939187896.db2.gz VPOYEOTYWNHRMF-FPOVZHCZSA-N 0 3 409.486 4.138 20 0 HIADHN COc1cccc(OCCN[C@H](CN2CCCC2=O)c2cccc(C(F)(F)F)c2)c1 ZINC000540319068 939192728 /nfs/dbraw/zinc/19/27/28/939192728.db2.gz YCEXUIJJFCFLFH-HXUWFJFHSA-N 0 3 422.447 4.046 20 0 HIADHN Cc1ccsc1[C@@H](Cc1ccccc1)N[C@@H](C)c1cccc(S(N)(=O)=O)c1 ZINC000540320479 939193260 /nfs/dbraw/zinc/19/32/60/939193260.db2.gz LLKRUHOWNNLMLE-OXJNMPFZSA-N 0 3 400.569 4.339 20 0 HIADHN CC[C@H](NCC(=O)N1CCC(C(=O)N2CCCCCC2)CC1)c1cccc(Cl)c1 ZINC000540328689 939196481 /nfs/dbraw/zinc/19/64/81/939196481.db2.gz POYFBHRNVHVZFD-NRFANRHFSA-N 0 3 419.997 4.022 20 0 HIADHN CCOc1ccc(S(=O)(=O)Nc2ccc(CN3CCSCC3)cc2C)c(C)c1 ZINC000540330610 939197208 /nfs/dbraw/zinc/19/72/08/939197208.db2.gz DCYBFDSBHOZQTJ-UHFFFAOYSA-N 0 3 420.600 4.052 20 0 HIADHN CCC(=O)Nc1ccc(S(=O)(=O)[N-]c2ccc(C[NH+]3CCC(C)CC3)cc2)cc1 ZINC000540335835 939198862 /nfs/dbraw/zinc/19/88/62/939198862.db2.gz ILAMVWCGEBAUFO-UHFFFAOYSA-N 0 3 415.559 4.068 20 0 HIADHN C[C@H](NCC(=O)N1CCC(C(=O)N2CCCCCC2)CC1)c1cccc2ccccc21 ZINC000540342285 939200700 /nfs/dbraw/zinc/20/07/00/939200700.db2.gz IKKLGEXAUGPSLJ-FQEVSTJZSA-N 0 3 421.585 4.132 20 0 HIADHN Cc1ccccc1-n1nccc1NC(=O)N(CCN(C)C)Cc1ccc(F)cc1F ZINC000540358085 939207497 /nfs/dbraw/zinc/20/74/97/939207497.db2.gz VCZKRZRVUIVXAL-UHFFFAOYSA-N 0 3 413.472 4.055 20 0 HIADHN CNC(=O)c1ccc(CN[C@@H](C)c2ccc(NC(=O)c3ccc(F)cc3)cc2)cc1 ZINC000540375360 939215222 /nfs/dbraw/zinc/21/52/22/939215222.db2.gz GYFUFCZRSYDZBB-INIZCTEOSA-N 0 3 405.473 4.288 20 0 HIADHN C[C@@H](N[C@@H](C)c1cccc(-n2cccn2)c1)C(=O)Nc1ccc(OC(F)(F)F)cc1 ZINC000540387122 939223158 /nfs/dbraw/zinc/22/31/58/939223158.db2.gz NENACVLMMILLMT-LSDHHAIUSA-N 0 3 418.419 4.449 20 0 HIADHN C[C@@H](NCC(=O)Nc1ccc(Br)cc1F)c1cccc(-n2cccn2)c1 ZINC000540388144 939226032 /nfs/dbraw/zinc/22/60/32/939226032.db2.gz JJGQTAPULOPRPN-CYBMUJFWSA-N 0 3 417.282 4.063 20 0 HIADHN O=C(CN[C@@H](c1ccccc1)[C@H]1CCOC1)Nc1ccc2c(c1)OC1(CCCC1)O2 ZINC000540390491 939228725 /nfs/dbraw/zinc/22/87/25/939228725.db2.gz YXQDFVSCZSDUQL-MBSDFSHPSA-N 0 3 408.498 4.034 20 0 HIADHN CN(C(=O)N[C@@H]1CCO[C@H]1c1ccc(Cl)cc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000540393265 939232130 /nfs/dbraw/zinc/23/21/30/939232130.db2.gz ROVVPXGUIXFSTH-BDTNDASRSA-N 0 3 413.949 4.086 20 0 HIADHN CN(Cc1ccc(Cl)c(Cl)c1)C(=O)CN[C@H](c1ccccc1)[C@@H]1CCOC1 ZINC000540395387 939232488 /nfs/dbraw/zinc/23/24/88/939232488.db2.gz UZYZOBJVLXGAOK-DYESRHJHSA-N 0 3 407.341 4.319 20 0 HIADHN O=C(CN[C@H](c1ccc(F)cc1)C1CCCC1)Nc1cccc(N2CCCC2=O)c1 ZINC000540409853 939238459 /nfs/dbraw/zinc/23/84/59/939238459.db2.gz SRKLGMXJFTUHNW-DEOSSOPVSA-N 0 3 409.505 4.412 20 0 HIADHN COc1ccc([C@H](NC(=O)CN[C@@H](C[C@H]2CCOC2)c2ccccc2)C2CC2)cc1 ZINC000540435008 939247924 /nfs/dbraw/zinc/24/79/24/939247924.db2.gz WWRJLPQBJVWVJI-FMNCTDSISA-N 0 3 408.542 4.020 20 0 HIADHN Cc1cccc([C@@H](NCC(=O)Nc2ccc(CN3CCOCC3)cc2)C(C)(C)C)c1 ZINC000540435973 939248191 /nfs/dbraw/zinc/24/81/91/939248191.db2.gz YJRYGBSNVORETD-XMMPIXPASA-N 0 3 409.574 4.143 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(-c2ccncc2)cc1)C(=O)N[C@H]1CCOc2ccccc21 ZINC000540440703 939251042 /nfs/dbraw/zinc/25/10/42/939251042.db2.gz ZOMJLBNDOPLHGA-BSRJHKFKSA-N 0 3 401.510 4.428 20 0 HIADHN C[C@@](Cc1cccc(Br)c1)(NCc1cc(=O)c(O)co1)c1ccccc1 ZINC000540443771 939252432 /nfs/dbraw/zinc/25/24/32/939252432.db2.gz FXGVCRJIHUJNTJ-NRFANRHFSA-N 0 3 414.299 4.356 20 0 HIADHN CC[C@@H](N[C@H](C)c1ccc(OC(F)(F)F)cc1)c1cccc(S(N)(=O)=O)c1 ZINC000540464239 939262551 /nfs/dbraw/zinc/26/25/51/939262551.db2.gz ONVGBVIXNJHEEK-SJKOYZFVSA-N 0 3 402.438 4.035 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)N[C@@H](C)C(=O)NCCc2c[nH]c3ccccc23)cc1 ZINC000540468449 939264696 /nfs/dbraw/zinc/26/46/96/939264696.db2.gz PCBCTSXERPPGAT-MSOLQXFVSA-N 0 3 415.541 4.060 20 0 HIADHN C[C@@H](NCC(=O)N[C@H](c1nccs1)c1ccccc1)c1cccc(N2CCCC2)c1 ZINC000540477296 939267917 /nfs/dbraw/zinc/26/79/17/939267917.db2.gz LRNOZRVNXPHJEP-JPYJTQIMSA-N 0 3 420.582 4.300 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@H]1CCO[C@H]1c1ccc(F)c(F)c1)c1ccsc1 ZINC000540494030 939275008 /nfs/dbraw/zinc/27/50/08/939275008.db2.gz RIQXVGJGZUPCET-ZCNNSNEGSA-N 0 3 423.529 4.239 20 0 HIADHN C[C@@H]1C[C@@H]1[C@@H](NCC(=O)Nc1nc(CN2CCCC2)cs1)c1ccc(Cl)cc1 ZINC000540519137 939285224 /nfs/dbraw/zinc/28/52/24/939285224.db2.gz BDWUPODCHQNRFI-WNYOCNMUSA-N 0 3 418.994 4.318 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)N[C@H]1CCCOc2c(Cl)cccc21 ZINC000540569809 939307512 /nfs/dbraw/zinc/30/75/12/939307512.db2.gz WQCYMLVIDUBSJP-SFHVURJKSA-N 0 3 407.967 4.389 20 0 HIADHN CC[C@@H](NCc1cccc(CS(C)(=O)=O)c1)c1cc(F)cc(Br)c1 ZINC000540593471 939313685 /nfs/dbraw/zinc/31/36/85/939313685.db2.gz GTYGVINSBSHBAG-GOSISDBHSA-N 0 3 414.340 4.374 20 0 HIADHN CC[C@H](NCc1c(C(C)C)nc2sc(C)nn12)[C@@H](c1ccc(C)cc1)n1cncn1 ZINC000540627674 939323284 /nfs/dbraw/zinc/32/32/84/939323284.db2.gz CYAYVEHAORTAKY-GHTZIAJQSA-N 0 3 423.590 4.280 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)N[C@H]1C[C@H]2CCC(C)(C)c3cccc1c32 ZINC000540665550 939334589 /nfs/dbraw/zinc/33/45/89/939334589.db2.gz OWLPUNAFVCBDED-GCJKJVERSA-N 0 3 406.574 4.455 20 0 HIADHN Cc1cc(C(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)nn1-c1ccc(F)cc1 ZINC000540719586 939348572 /nfs/dbraw/zinc/34/85/72/939348572.db2.gz HWDAOCKEZGIISM-IBGZPJMESA-N 0 3 406.505 4.056 20 0 HIADHN NC(=O)[C@@H](CNCc1c(Cl)cccc1N1CCCC1)Cc1ccccc1Cl ZINC000540731898 939352261 /nfs/dbraw/zinc/35/22/61/939352261.db2.gz KBRRFKIDJPBEJU-MRXNPFEDSA-N 0 3 406.357 4.027 20 0 HIADHN C[C@@H](CC(=O)N(C)Cc1ccccc1Cl)NC1(c2ccc3c(c2)OCO3)CC1 ZINC000540749166 939358005 /nfs/dbraw/zinc/35/80/05/939358005.db2.gz FDXBRHSJXGKSCK-HNNXBMFYSA-N 0 3 400.906 4.085 20 0 HIADHN CCOCCOc1ccc(Br)cc1CN1CCC[C@@H]1C1CCOCC1 ZINC000540769410 939366035 /nfs/dbraw/zinc/36/60/35/939366035.db2.gz JRLWTVXUQWEYDX-LJQANCHMSA-N 0 3 412.368 4.255 20 0 HIADHN Cc1nn(-c2ccccc2)cc1NC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC000540978951 939423653 /nfs/dbraw/zinc/42/36/53/939423653.db2.gz CQBYHGYSWHZRBC-LJQANCHMSA-N 0 3 403.530 4.309 20 0 HIADHN C[C@@H](NCCC(=O)N1CCCCC1)c1cccc(NC(=O)Cc2ccccc2F)c1 ZINC000541022447 939433139 /nfs/dbraw/zinc/43/31/39/939433139.db2.gz FJAXWEBXOITBAN-GOSISDBHSA-N 0 3 411.521 4.060 20 0 HIADHN COc1ccc2c(c1)[C@@H](N(CCC(=O)N1CCCCC1)Cc1ccccc1)CCO2 ZINC000541057305 939444243 /nfs/dbraw/zinc/44/42/43/939444243.db2.gz XZXRCEALPLLIAX-QHCPKHFHSA-N 0 3 408.542 4.424 20 0 HIADHN O=C(Nc1cccc(CCCO)c1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000541059174 939445183 /nfs/dbraw/zinc/44/51/83/939445183.db2.gz GLBFUDWXFBZSOT-OAQYLSRUSA-N 0 3 406.448 4.005 20 0 HIADHN COc1ccc(CNCc2cn(C)nc2-c2ccccc2)cc1OCc1cccnc1 ZINC000541063387 939446601 /nfs/dbraw/zinc/44/66/01/939446601.db2.gz LBXFVLDTWZMNNO-UHFFFAOYSA-N 0 3 414.509 4.360 20 0 HIADHN COc1cccc2c1CCN(C(=O)[C@]1(C(F)(F)F)CCN(Cc3ccccc3)C1)C2 ZINC000541086459 939455127 /nfs/dbraw/zinc/45/51/27/939455127.db2.gz DSDMPKDVDPDWNU-QFIPXVFZSA-N 0 3 418.459 4.035 20 0 HIADHN Cc1ccnc(OC2CCN(CCC(=O)Nc3ccccc3Br)CC2)c1 ZINC000541119462 939467861 /nfs/dbraw/zinc/46/78/61/939467861.db2.gz HEMFHHDCBGYSDF-UHFFFAOYSA-N 0 3 418.335 4.025 20 0 HIADHN COc1cccc(C[C@@H](C)N[C@@H](c2ccc(C)cc2)c2cccc(S(C)(=O)=O)c2)n1 ZINC000541207572 939485711 /nfs/dbraw/zinc/48/57/11/939485711.db2.gz YROBEBBCYUOAHZ-KOSHJBKYSA-N 0 3 424.566 4.112 20 0 HIADHN COC(=O)c1cccc(NC(=O)C[C@H](C)N[C@@H]2CCSc3c(F)cccc32)c1 ZINC000541210502 939485772 /nfs/dbraw/zinc/48/57/72/939485772.db2.gz PVCWQNFLYXFAHE-SCLBCKFNSA-N 0 3 402.491 4.156 20 0 HIADHN CC(C)(C)OCc1cccc(CN[C@H](Cc2ccc(C(F)(F)F)cc2)C(N)=O)c1 ZINC000541304995 939490271 /nfs/dbraw/zinc/49/02/71/939490271.db2.gz VUJUUEATXZQRLN-LJQANCHMSA-N 0 3 408.464 4.207 20 0 HIADHN O=C1[C@H](NCc2ccc(Oc3cc(F)cc(F)c3)cc2)CCCN1Cc1ccccn1 ZINC000541381105 939501904 /nfs/dbraw/zinc/50/19/04/939501904.db2.gz KMKAMRCFHMIAQQ-HSZRJFAPSA-N 0 3 423.463 4.433 20 0 HIADHN CN1CC[C@H](NC(=O)[C@@H]2CCn3c(cnc3C3CCCCC3)C2)[C@@H]1c1ccccc1 ZINC000541454468 939520920 /nfs/dbraw/zinc/52/09/20/939520920.db2.gz NBBOZEODVXITAT-PUHATCMVSA-N 0 3 406.574 4.055 20 0 HIADHN CCN1CCN(Cc2ccc(CN[C@@H](c3ccc(F)cc3)c3ccccn3)cc2)CC1 ZINC000541545718 939550319 /nfs/dbraw/zinc/55/03/19/939550319.db2.gz JSFBPVKSDWMJAY-SANMLTNESA-N 0 3 418.560 4.237 20 0 HIADHN Cc1ccsc1[C@@H](Cc1ccccc1)N[C@H](C)C(=O)N1CC(=O)Nc2ccccc21 ZINC000541593711 939562341 /nfs/dbraw/zinc/56/23/41/939562341.db2.gz XIJNSBWWHOXQTR-YLJYHZDGSA-N 0 3 419.550 4.304 20 0 HIADHN COc1cccc(S(=O)(=O)CCN[C@@H](Cc2ccccc2)c2cccs2)c1 ZINC000541594877 939562599 /nfs/dbraw/zinc/56/25/99/939562599.db2.gz ICSHJRCNEHBDGM-FQEVSTJZSA-N 0 3 401.553 4.104 20 0 HIADHN O=C(CN[C@H](Cc1ccccc1)c1cccs1)NC[C@@H]1CCN(c2ccccc2)C1 ZINC000541597223 939563039 /nfs/dbraw/zinc/56/30/39/939563039.db2.gz ODABVMVYPIOSAE-JTHBVZDNSA-N 0 3 419.594 4.264 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N[C@@H]2CCO[C@@H](c3ccc(F)cc3)C2)C1 ZINC000541619779 939572555 /nfs/dbraw/zinc/57/25/55/939572555.db2.gz WVIGHZSNVFMZLF-OCYFJXFZSA-N 0 3 411.521 4.181 20 0 HIADHN COc1cc2c(cc1OC)CN(C(=O)CN[C@@H](CC(C)C)c1cccs1)CC2 ZINC000541627676 939574924 /nfs/dbraw/zinc/57/49/24/939574924.db2.gz VKCFJCSOWLTXDG-SFHVURJKSA-N 0 3 402.560 4.027 20 0 HIADHN C[C@@H](NCC(=O)NCc1ccc(-c2ccc(Cl)cc2)o1)[C@@H]1COc2ccccc21 ZINC000541698324 939607912 /nfs/dbraw/zinc/60/79/12/939607912.db2.gz UWZQUAFPNABDQW-QRWLVFNGSA-N 0 3 410.901 4.371 20 0 HIADHN CCCCSc1ccc(Cl)cc1C(=O)NC[C@@H](C)CN1CCN(CC)CC1 ZINC000541730932 939615762 /nfs/dbraw/zinc/61/57/62/939615762.db2.gz HSJSCYNDWCOJFW-QGZVFWFLSA-N 0 3 412.043 4.236 20 0 HIADHN COc1ccc(C[C@H](NCc2ccc3c(c2)C(=O)NCC3)c2ccc(OC)cc2)cc1 ZINC000541739306 939618093 /nfs/dbraw/zinc/61/80/93/939618093.db2.gz WYUSCYXGNOEMJY-VWLOTQADSA-N 0 3 416.521 4.063 20 0 HIADHN OC[C@@H](CN[C@H](c1ccccc1)c1cncnc1)Cc1ccccc1C(F)(F)F ZINC000541743338 939618850 /nfs/dbraw/zinc/61/88/50/939618850.db2.gz IGTXCUJLVIGJOT-IIBYNOLFSA-N 0 3 401.432 4.026 20 0 HIADHN CCNC(=O)COc1ccc(CN[C@@H]2CCCc3c(Cl)cccc32)cc1OC ZINC000541746360 939619821 /nfs/dbraw/zinc/61/98/21/939619821.db2.gz WGPYTGAKASTYHU-LJQANCHMSA-N 0 3 402.922 4.031 20 0 HIADHN C[C@H](NC(=O)Nc1ccc(OC(F)(F)F)cc1Br)C1=CCN(C)CC1 ZINC000541908032 939651341 /nfs/dbraw/zinc/65/13/41/939651341.db2.gz FXCYNUYCMKNDBY-JTQLQIEISA-N 0 3 422.245 4.120 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@@H](C)N[C@@H](C)c2ccc(NC(C)=O)cc2)cc1 ZINC000541912946 939651723 /nfs/dbraw/zinc/65/17/23/939651723.db2.gz RIMBQPOEOZLHIA-DLBZAZTESA-N 0 3 417.575 4.087 20 0 HIADHN COc1ccc(C[C@@H](C)N[C@@H](CCO)c2ccccc2Br)cc1OC ZINC000541916518 939653347 /nfs/dbraw/zinc/65/33/47/939653347.db2.gz JDLJERPYQGJYBR-KDOFPFPSSA-N 0 3 408.336 4.111 20 0 HIADHN CC(=O)N1CCN(c2ccccc2CN[C@H](c2ccc(F)c(F)c2)C(C)C)CC1 ZINC000541918054 939653827 /nfs/dbraw/zinc/65/38/27/939653827.db2.gz MCUIRVBZOHAXHS-QHCPKHFHSA-N 0 3 401.501 4.120 20 0 HIADHN Cc1nn(-c2ccccc2)cc1NC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C ZINC000541924185 939655138 /nfs/dbraw/zinc/65/51/38/939655138.db2.gz ATXBRESEELAEAA-LJQANCHMSA-N 0 3 403.530 4.309 20 0 HIADHN CC[C@@H]1C[C@@H](CC(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)CCO1 ZINC000541959440 939663071 /nfs/dbraw/zinc/66/30/71/939663071.db2.gz ZWFFWDGTXCVCGZ-BHDDXSALSA-N 0 3 410.562 4.172 20 0 HIADHN OC[C@@H]1CN(Cc2ccccc2)CC[C@H]1Nc1cnc2cc(Cl)c(Cl)cc2n1 ZINC000542042886 939697396 /nfs/dbraw/zinc/69/73/96/939697396.db2.gz PVBOUJRSUXWRLW-MAUKXSAKSA-N 0 3 417.340 4.232 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)[C@H](C)c3cn(C)c4ccccc34)cc2)CC1 ZINC000542104019 939714703 /nfs/dbraw/zinc/71/47/03/939714703.db2.gz AROWKMOBMOLROT-LJQANCHMSA-N 0 3 404.558 4.058 20 0 HIADHN CC(C)n1ccc(C[C@@H](C)N[C@@H](C)c2cc3c(cc2Br)OCCO3)n1 ZINC000542143642 939728888 /nfs/dbraw/zinc/72/88/88/939728888.db2.gz WOSGFQPVKVVAHW-KGLIPLIRSA-N 0 3 408.340 4.280 20 0 HIADHN CN(C)C(=O)COc1cccc(CN[C@H]2CCCc3c(Br)cccc32)c1 ZINC000542152074 939732733 /nfs/dbraw/zinc/73/27/33/939732733.db2.gz DZCQXVUHWGZLRM-FQEVSTJZSA-N 0 3 417.347 4.083 20 0 HIADHN Cc1cccc([C@H]2CCN(C(=O)NCCCCN3CCN(c4ccccc4)CC3)C2)c1 ZINC000542269260 939779273 /nfs/dbraw/zinc/77/92/73/939779273.db2.gz IBLJGRVWDWVWPM-DEOSSOPVSA-N 0 3 420.601 4.096 20 0 HIADHN C[C@H](C[S@@](C)=O)NCc1cn(Cc2ccccc2)nc1-c1ccc(Cl)cc1 ZINC000542301842 939791263 /nfs/dbraw/zinc/79/12/63/939791263.db2.gz MQZFMIVPNKSGJF-CHAGWJKLSA-N 0 3 401.963 4.108 20 0 HIADHN COc1ccc([C@H]2CCCN2C(=O)CN2CC[C@@H](c3ccc(C)cc3)C2)c(OC)c1 ZINC000542323453 939800407 /nfs/dbraw/zinc/80/04/07/939800407.db2.gz VZJWFCGQDCGLHL-NFBKMPQASA-N 0 3 408.542 4.165 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3ccc(-c4ccc[nH]4)cc3)CC2)C[C@H](C)O1 ZINC000542380146 939810943 /nfs/dbraw/zinc/81/09/43/939810943.db2.gz QWKOWFOYLQRJII-KDURUIRLSA-N 0 3 410.562 4.425 20 0 HIADHN Cc1ccc([C@H](CN[C@H](c2ccc(F)cc2)c2cccnc2)N2CCOCC2)cc1 ZINC000542477141 939829945 /nfs/dbraw/zinc/82/99/45/939829945.db2.gz DOTAZKYPLQZGFP-LOSJGSFVSA-N 0 3 405.517 4.282 20 0 HIADHN C[C@@H]1C[C@H](CCN[C@H](c2ccc(F)cc2)c2cccc(S(C)(=O)=O)c2)CCO1 ZINC000542486423 939831844 /nfs/dbraw/zinc/83/18/44/939831844.db2.gz IUJGBJLWCDHYPL-DRSNIGMVSA-N 0 3 405.535 4.113 20 0 HIADHN COc1ccc(C(=O)C[C@H](C)C(=O)NC2[C@@H](C)CN(Cc3ccccc3)C[C@@H]2C)cc1 ZINC000542489418 939832216 /nfs/dbraw/zinc/83/22/16/939832216.db2.gz IAVXYUWCUJFXIT-UFYCRDLUSA-N 0 3 422.569 4.177 20 0 HIADHN CCOc1ccc([C@H](CC)N[C@@H]2CCCN(Cc3ccccn3)C2=O)cc1OCC ZINC000542498326 939832880 /nfs/dbraw/zinc/83/28/80/939832880.db2.gz JIUBGLDEUZGASA-LEWJYISDSA-N 0 3 411.546 4.111 20 0 HIADHN COC(=O)C[C@H](N[C@H](C)C(=O)Nc1ccccc1C(F)(F)F)C1CCCCC1 ZINC000542534166 939839316 /nfs/dbraw/zinc/83/93/16/939839316.db2.gz YGHLDNWSNSLCLP-DYVFJYSZSA-N 0 3 400.441 4.134 20 0 HIADHN C[C@H](NCC(=O)N1CCC(c2ccccc2)=N1)[C@@H](C)c1ccccc1C(F)(F)F ZINC000542564722 939844418 /nfs/dbraw/zinc/84/44/18/939844418.db2.gz XIOYBKYUKPFSAT-CVEARBPZSA-N 0 3 403.448 4.424 20 0 HIADHN C[C@@H](NCC(=O)Nc1ccc(OCc2ccccc2)cc1)[C@@H]1COc2ccccc21 ZINC000542624662 939849931 /nfs/dbraw/zinc/84/99/31/939849931.db2.gz AAXFODDFLNOHGU-JPYJTQIMSA-N 0 3 402.494 4.358 20 0 HIADHN C[C@H](N[C@@H](C)[C@@H]1COc2ccccc21)C(=O)NC(c1ccccc1)c1ccccc1 ZINC000542629236 939850308 /nfs/dbraw/zinc/85/03/08/939850308.db2.gz YEVCHPNCBADWIZ-YDHSSHFGSA-N 0 3 400.522 4.435 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@H]2N[C@H](CCCO)c2ccccc2)cc1 ZINC000542662896 939852386 /nfs/dbraw/zinc/85/23/86/939852386.db2.gz VJGPAXWYLVQPRD-DNVJHFABSA-N 0 3 401.572 4.183 20 0 HIADHN COc1ccc([C@@H](Cc2ccc(F)cc2)NCc2ccc3c(c2)C(=O)NCC3)cc1 ZINC000542683280 939853899 /nfs/dbraw/zinc/85/38/99/939853899.db2.gz NSWWLZRTDJFQRG-XMMPIXPASA-N 0 3 404.485 4.194 20 0 HIADHN CN(C(=O)[C@@H]1CCO[C@H]1c1ccc(Cl)c(F)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000542731730 939857718 /nfs/dbraw/zinc/85/77/18/939857718.db2.gz MHLBLPJBNFYSRG-KNKQGSTJSA-N 0 3 416.924 4.290 20 0 HIADHN C[C@@H]1N(C(=O)N[C@H](CN2CCc3ccccc3C2)C(C)(C)C)CCC12CCOCC2 ZINC000542744466 939858633 /nfs/dbraw/zinc/85/86/33/939858633.db2.gz DGUYCPMLLJUIEW-SIKLNZKXSA-N 0 3 413.606 4.060 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)c2cc(Cl)ccc2SC2CCCC2)CC1 ZINC000542761442 939859457 /nfs/dbraw/zinc/85/94/57/939859457.db2.gz WYJMINSFWWZLNB-KRWDZBQOSA-N 0 3 424.054 4.378 20 0 HIADHN Cc1cc2c(cc1NC(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1)OCO2 ZINC000542837345 939862050 /nfs/dbraw/zinc/86/20/50/939862050.db2.gz IWRVLHPETPHGNP-KRWDZBQOSA-N 0 3 401.532 4.380 20 0 HIADHN Cc1nn(-c2ccccc2)cc1NC(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000542839350 939862287 /nfs/dbraw/zinc/86/22/87/939862287.db2.gz CLGZMACZZCSVST-UHFFFAOYSA-N 0 3 403.530 4.309 20 0 HIADHN COc1cccc2sc(NC(=O)CN[C@@H](C)c3ccc(-n4ccnc4C)cc3)nc21 ZINC000542882565 939865201 /nfs/dbraw/zinc/86/52/01/939865201.db2.gz GAKMJXCUUUUFPP-AWEZNQCLSA-N 0 3 421.526 4.088 20 0 HIADHN CCN1CC[C@@H](NC(=O)Nc2cccc(CN(C)C)c2)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000542936195 939881706 /nfs/dbraw/zinc/88/17/06/939881706.db2.gz MIXTXFLXFRQONW-CTNGQTDRSA-N 0 3 420.479 4.123 20 0 HIADHN CCCc1c(C(=O)NC2CCN(Cc3ccccc3)CC2)cnn1-c1ccc(F)cc1 ZINC000542937641 939882036 /nfs/dbraw/zinc/88/20/36/939882036.db2.gz YNEMKYZHIOIPFC-UHFFFAOYSA-N 0 3 420.532 4.358 20 0 HIADHN O=S(=O)(c1ccccc1CNC1CC(c2cccc(F)c2)C1)N1CCCCC1 ZINC000543070352 939922111 /nfs/dbraw/zinc/92/21/11/939922111.db2.gz XGWOASRNCKCIEP-UHFFFAOYSA-N 0 3 402.535 4.036 20 0 HIADHN C[C@@H](CC(=O)Nc1cccc(Cl)c1)N[C@@H](CO)c1ccc(C(F)(F)F)cc1 ZINC000543072639 939925363 /nfs/dbraw/zinc/92/53/63/939925363.db2.gz MMMITJXMBDBTMR-SJCJKPOMSA-N 0 3 400.828 4.399 20 0 HIADHN CNS(=O)(=O)c1cccc([C@H](C)N[C@@H]2CCCc3c(Br)cccc32)c1 ZINC000543078841 939930289 /nfs/dbraw/zinc/93/02/89/939930289.db2.gz CEUBOUWZMDWYPI-ORAYPTAESA-N 0 3 423.376 4.085 20 0 HIADHN C[C@H](N[C@@H](Cc1ccc(F)cc1)C(N)=O)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000543160155 939980996 /nfs/dbraw/zinc/98/09/96/939980996.db2.gz OJLDOOIYECVHQB-HJPURHCSSA-N 0 3 410.464 4.291 20 0 HIADHN C[C@H](N[C@H](Cc1ccc(F)cc1)C(N)=O)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000543160157 939981167 /nfs/dbraw/zinc/98/11/67/939981167.db2.gz OJLDOOIYECVHQB-QMHKHESXSA-N 0 3 410.464 4.291 20 0 HIADHN COc1ccc([C@H]2CCCN2C(=O)CN2CC[C@@H](c3ccc(C)cc3)C2)cc1OC ZINC000543254159 940009546 /nfs/dbraw/zinc/00/95/46/940009546.db2.gz UCPJFUHGQNDKRL-FGZHOGPDSA-N 0 3 408.542 4.165 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)CN2CC[C@@H](c3ccc(C)cc3)C2)cc1OC ZINC000543254161 940009562 /nfs/dbraw/zinc/00/95/62/940009562.db2.gz UCPJFUHGQNDKRL-YADHBBJMSA-N 0 3 408.542 4.165 20 0 HIADHN CCCc1c(C(=O)Nc2cccc(CN3CCC(O)CC3)c2)cnn1C1CCCC1 ZINC000543279224 940016366 /nfs/dbraw/zinc/01/63/66/940016366.db2.gz ZOBLRQOQTWQPCU-UHFFFAOYSA-N 0 3 410.562 4.160 20 0 HIADHN Cc1cc(NC(=O)N(C)C[C@H]2CC=CCC2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000543314610 940026583 /nfs/dbraw/zinc/02/65/83/940026583.db2.gz BQFCIERBTZCCFZ-UNMCSNQZSA-N 0 3 407.562 4.459 20 0 HIADHN Cn1cc(CN2CCC(C(=O)NCc3ccc(F)cc3)CC2)c(C2CCCCC2)n1 ZINC000543396628 940050936 /nfs/dbraw/zinc/05/09/36/940050936.db2.gz KZYNSSSYSGVIFK-UHFFFAOYSA-N 0 3 412.553 4.135 20 0 HIADHN Cc1c([C@H](C)NC[C@H](O)COc2ccccc2Cl)cnn1-c1ccc(F)cc1 ZINC000543470261 940074823 /nfs/dbraw/zinc/07/48/23/940074823.db2.gz OXXLLZVKWDVXFT-KSSFIOAISA-N 0 3 403.885 4.064 20 0 HIADHN CC(C)C[C@H](N[C@H](C)C(=O)N[C@H](C)c1ccc2c(c1)OCCO2)c1cccs1 ZINC000543485944 940079991 /nfs/dbraw/zinc/07/99/91/940079991.db2.gz PNPOUFPMDDKQIO-NUJGCVRESA-N 0 3 402.560 4.462 20 0 HIADHN CC[C@H](NCC(=O)N1N=C(c2cc3ccccc3o2)C[C@@H]1c1ccco1)[C@@H]1CCCO1 ZINC000543494515 940083972 /nfs/dbraw/zinc/08/39/72/940083972.db2.gz KNZDDWLHQSBEKW-DSKINZAPSA-N 0 3 421.497 4.251 20 0 HIADHN C[C@H](c1ccc(F)c(F)c1)N(C)C(=O)CN(C)[C@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000543555726 940106797 /nfs/dbraw/zinc/10/67/97/940106797.db2.gz UUQGGOZEOCUISB-MPHOGZCYSA-N 0 3 420.475 4.475 20 0 HIADHN Cc1ccc(NC(=O)[C@H](C)N[C@H](C)[C@@H]2COc3ccccc32)c(Br)c1 ZINC000543558187 940107787 /nfs/dbraw/zinc/10/77/87/940107787.db2.gz BTGFIGVRCMURKL-YCPHGPKFSA-N 0 3 403.320 4.239 20 0 HIADHN CCOc1cc(CN2CCCSCC2)ccc1OCC(=O)N(C(C)C)C(C)C ZINC000543621332 940136070 /nfs/dbraw/zinc/13/60/70/940136070.db2.gz MDIGKBAWTAWFKK-UHFFFAOYSA-N 0 3 408.608 4.048 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)Nc1csc(-c2ccccn2)n1 ZINC000543620049 940136184 /nfs/dbraw/zinc/13/61/84/940136184.db2.gz RQBCOCPUBNFKQD-UHFFFAOYSA-N 0 3 417.485 4.079 20 0 HIADHN COc1ccc2ccccc2c1-c1cc(CNC2CCN(c3cnccn3)CC2)on1 ZINC000543704362 940165760 /nfs/dbraw/zinc/16/57/60/940165760.db2.gz BYJJJFHQWIMTAZ-UHFFFAOYSA-N 0 3 415.497 4.052 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)NCC(=O)NCc2cccc(COC(C)C)c2)cc1 ZINC000543811792 940193921 /nfs/dbraw/zinc/19/39/21/940193921.db2.gz IOHDHQLPHJLBDT-IBGZPJMESA-N 0 3 420.557 4.073 20 0 HIADHN COc1ccc2c(c1)C1(CC1)CN(C(=O)N[C@H](CN1CCCC1)c1ccccc1)C2 ZINC000563791558 945303666 /nfs/dbraw/zinc/30/36/66/945303666.db2.gz VWPGWHLLGXNXNQ-HSZRJFAPSA-N 0 3 405.542 4.089 20 0 HIADHN C[C@@H](C(=O)N(C)Cc1c(F)cccc1Cl)N1CCC(CCCn2ccnc2)CC1 ZINC000543987819 940284205 /nfs/dbraw/zinc/28/42/05/940284205.db2.gz JPODEXXBFUHMBW-KRWDZBQOSA-N 0 3 420.960 4.215 20 0 HIADHN O=C(Nc1ccc(C(=O)NCCN2CCCC2)cc1)c1ccc(-c2ccccc2)o1 ZINC000544074394 940318320 /nfs/dbraw/zinc/31/83/20/940318320.db2.gz SWTBTCVKHIQFGC-UHFFFAOYSA-N 0 3 403.482 4.025 20 0 HIADHN COCC[C@H](Cc1ccco1)NC(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1 ZINC000544127085 940332928 /nfs/dbraw/zinc/33/29/28/940332928.db2.gz FSHIEDQNIUXZNW-QUCCMNQESA-N 0 3 419.591 4.061 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)[C@H]1CCn2c(cnc2C2CCCCC2)C1 ZINC000544197926 940351369 /nfs/dbraw/zinc/35/13/69/940351369.db2.gz WTEVRCQNOBCQOD-IBGZPJMESA-N 0 3 410.562 4.202 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(F)cc2)CC1)c1ccc(-c2ccccc2)o1 ZINC000544234659 940363151 /nfs/dbraw/zinc/36/31/51/940363151.db2.gz IIUWZCMLTFQNKI-UHFFFAOYSA-N 0 3 408.473 4.359 20 0 HIADHN Cc1cn(C2CCCCC2)nc1NC(=O)N(CCN(C)C)Cc1cccc(F)c1 ZINC000544241744 940365013 /nfs/dbraw/zinc/36/50/13/940365013.db2.gz LGCZMTUSVBZCAU-UHFFFAOYSA-N 0 3 401.530 4.432 20 0 HIADHN CSc1ccc(NC(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)nc1 ZINC000544272719 940375446 /nfs/dbraw/zinc/37/54/46/940375446.db2.gz KHLSBVUWDGQIHM-UHFFFAOYSA-N 0 3 412.481 4.418 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)[C@@H]2CCn3c(cnc3C3CCCCC3)C2)CN1Cc1ccccc1 ZINC000544287536 940380406 /nfs/dbraw/zinc/38/04/06/940380406.db2.gz WKIIQAFJBMUQGV-UEVCKROQSA-N 0 3 420.601 4.272 20 0 HIADHN Cc1ccc(S[C@H](C)c2nc(-c3ccc(N4CCCN(C)CC4)nc3)no2)cc1 ZINC000544346679 940396142 /nfs/dbraw/zinc/39/61/42/940396142.db2.gz ZURMAOZXIVPQCC-QGZVFWFLSA-N 0 3 409.559 4.435 20 0 HIADHN C[C@@H](c1cc2ccccc2o1)c1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1 ZINC000544362968 940401993 /nfs/dbraw/zinc/40/19/93/940401993.db2.gz PEDYQMDECYQCJM-INIZCTEOSA-N 0 3 403.486 4.172 20 0 HIADHN Cc1cc(C)c(CN[C@H](CN2CCC(C(N)=O)CC2)c2ccc(Cl)cc2)c(C)c1 ZINC000544363705 940402142 /nfs/dbraw/zinc/40/21/42/940402142.db2.gz VPDHYQLVJDOJFW-HSZRJFAPSA-N 0 3 413.993 4.293 20 0 HIADHN COc1ccc(C(=O)C[C@H](C)C(=O)N[C@@H]2CCN(Cc3ccccc3)[C@H](C)C2)cc1 ZINC000544378498 940406532 /nfs/dbraw/zinc/40/65/32/940406532.db2.gz ZRHKTHCZHORHGW-NNMXDRDESA-N 0 3 408.542 4.073 20 0 HIADHN CCCCOc1ccc([C@@H](C)N[C@@H]2CCCN(Cc3ccccn3)C2=O)cc1OC ZINC000544385010 940407670 /nfs/dbraw/zinc/40/76/70/940407670.db2.gz HLHNDRKLBLNUPF-WIYYLYMNSA-N 0 3 411.546 4.111 20 0 HIADHN CN1CCCN(c2ccc(-c3noc([C@@H]4CCC[C@@H](C(F)(F)F)C4)n3)cn2)CC1 ZINC000544397172 940411480 /nfs/dbraw/zinc/41/14/80/940411480.db2.gz YAHDWVCINBBBLQ-GDBMZVCRSA-N 0 3 409.456 4.110 20 0 HIADHN O=C(Nc1cccc(Cl)c1)N1CCCN(CCCOCc2ccccc2)CC1 ZINC000544397744 940411846 /nfs/dbraw/zinc/41/18/46/940411846.db2.gz JDZXITTUPVDECI-UHFFFAOYSA-N 0 3 401.938 4.487 20 0 HIADHN COc1ccc(CN(C)C[C@H](O)COc2cc(C)ccc2Cl)cc1OC(F)F ZINC000544410142 940416334 /nfs/dbraw/zinc/41/63/34/940416334.db2.gz ZLODPHIZEPTCGX-HNNXBMFYSA-N 0 3 415.864 4.130 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)N[C@@H]2CCO[C@@H](c3ccc(F)cc3)C2)CN1Cc1ccccc1 ZINC000544427717 940425659 /nfs/dbraw/zinc/42/56/59/940425659.db2.gz UBQMCGXGYPTMCH-OCYFJXFZSA-N 0 3 411.521 4.008 20 0 HIADHN CC(C)c1cc(-c2nc(-c3ccc(N4CCCN(C)CC4)nc3)no2)nn1C(C)(C)C ZINC000544429659 940426886 /nfs/dbraw/zinc/42/68/86/940426886.db2.gz CVKCOILPJMSBIN-UHFFFAOYSA-N 0 3 423.565 4.015 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)N(C)Cc1nc2ccccc2s1)[C@@H]1Oc2ccccc2[C@@H]1C ZINC000544508533 940460770 /nfs/dbraw/zinc/46/07/70/940460770.db2.gz BRGYALHKIBNZKF-CJKQYIFKSA-N 0 3 409.555 4.186 20 0 HIADHN C[C@H](NCC(=O)N(C)Cc1cc(Br)cs1)[C@H]1Oc2ccccc2[C@H]1C ZINC000544514112 940465853 /nfs/dbraw/zinc/46/58/53/940465853.db2.gz HRUUHGOJBPTLGD-NQCMUKECSA-N 0 3 423.376 4.012 20 0 HIADHN CCOc1cccc2[nH]cc(CC(=O)NC[C@H](c3ccc(SC)cc3)N(C)C)c21 ZINC000563912370 945323405 /nfs/dbraw/zinc/32/34/05/945323405.db2.gz ROGCRQXQLPJQTL-HXUWFJFHSA-N 0 3 411.571 4.250 20 0 HIADHN Cc1ccc([C@H](NC(=O)CN[C@@H](C)[C@@H]2COc3ccccc32)c2cccs2)cc1 ZINC000544528186 940472276 /nfs/dbraw/zinc/47/22/76/940472276.db2.gz GXGPIONFTDBKEO-REIDKSKDSA-N 0 3 406.551 4.416 20 0 HIADHN CCCOc1cccc(CNC(=O)CN(C)[C@@H]2CCO[C@@H](c3ccc(F)cc3)C2)c1 ZINC000544530969 940473503 /nfs/dbraw/zinc/47/35/03/940473503.db2.gz XVVLQHYFKPBGBE-FYYLOGMGSA-N 0 3 414.521 4.083 20 0 HIADHN Fc1cc(CN2CCC(CCCN3CCOCC3)CC2)ccc1OCC(F)(F)F ZINC000544598649 940487747 /nfs/dbraw/zinc/48/77/47/940487747.db2.gz IRJZMPSKEMGEQV-UHFFFAOYSA-N 0 3 418.475 4.091 20 0 HIADHN CCS(=O)(=O)N1CCC(CN[C@H](c2ccc(F)cc2)c2ccccc2Cl)CC1 ZINC000544601915 940488395 /nfs/dbraw/zinc/48/83/95/940488395.db2.gz FAPVXGARRBKMER-OAQYLSRUSA-N 0 3 424.969 4.220 20 0 HIADHN Cc1nnc([C@@H](C)NC(=O)N(CCN(C)Cc2ccccc2)Cc2ccccc2)s1 ZINC000544801646 940515666 /nfs/dbraw/zinc/51/56/66/940515666.db2.gz WAYXQTMKMMXBRJ-GOSISDBHSA-N 0 3 423.586 4.251 20 0 HIADHN CCN(C(=O)c1ccnc(SCC(F)(F)F)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000544847869 940518925 /nfs/dbraw/zinc/51/89/25/940518925.db2.gz LWBGKVSDLXSCOG-SFHVURJKSA-N 0 3 423.504 4.473 20 0 HIADHN CCN(C(=O)c1cc(C)nc2c1cnn2C(C)C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000544848433 940519027 /nfs/dbraw/zinc/51/90/27/940519027.db2.gz BDRAWQJQXQZCAY-FQEVSTJZSA-N 0 3 405.546 4.057 20 0 HIADHN CCN(Cc1coc(-c2ccc(C(=O)OC)cc2)n1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000544897736 940522832 /nfs/dbraw/zinc/52/28/32/940522832.db2.gz PPPAPWUTEDOCTM-HSZRJFAPSA-N 0 3 419.525 4.225 20 0 HIADHN Cc1ccc([C@@H](CCn2cncn2)NCc2cccc(NC(=O)C3CCC3)c2)cc1 ZINC000545011994 940533389 /nfs/dbraw/zinc/53/33/89/940533389.db2.gz FWMGQSFTCYTHHH-HSZRJFAPSA-N 0 3 403.530 4.246 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CCC[C@H]3Cc3cccc(OC)c3)c2)CC1 ZINC000545331894 940562253 /nfs/dbraw/zinc/56/22/53/940562253.db2.gz ZYQOZCCNPVORSQ-QHCPKHFHSA-N 0 3 422.573 4.076 20 0 HIADHN CCN1C(=O)CCc2cc(NC(=O)N3CCCN(Cc4ccccc4)C[C@H]3C)ccc21 ZINC000545430823 940569531 /nfs/dbraw/zinc/56/95/31/940569531.db2.gz DVYCQUNXBMMJHB-LJQANCHMSA-N 0 3 420.557 4.114 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)NCc1nc2ccccc2n1C1CC1 ZINC000545449539 940570497 /nfs/dbraw/zinc/57/04/97/940570497.db2.gz XKKWTQVDQDYVQX-UHFFFAOYSA-N 0 3 419.573 4.077 20 0 HIADHN CCN(C(=O)c1cccc(-c2noc(C3CC3)n2)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000545475441 940571377 /nfs/dbraw/zinc/57/13/77/940571377.db2.gz QUIUKOCNGCOKAM-JOCHJYFZSA-N 0 3 416.525 4.351 20 0 HIADHN CCN(C(=O)c1cccc(Cn2nc(C)cc2C)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000545476884 940571467 /nfs/dbraw/zinc/57/14/67/940571467.db2.gz WYDBPCDJDSMJAN-VWLOTQADSA-N 0 3 416.569 4.285 20 0 HIADHN CCN(C(=O)c1cccc(Nc2ccc(C)nn2)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000545492241 940571917 /nfs/dbraw/zinc/57/19/17/940571917.db2.gz MEPZVMNDQVMGET-HSZRJFAPSA-N 0 3 415.541 4.265 20 0 HIADHN COc1ccc(Br)cc1-c1nc(CN[C@@H](CCO)C(C)(C)C)cs1 ZINC000545516720 940572851 /nfs/dbraw/zinc/57/28/51/940572851.db2.gz FPJSYRLOJURRTB-INIZCTEOSA-N 0 3 413.381 4.468 20 0 HIADHN C[C@H](N[C@H]1COc2ccc(F)cc2C1)c1ccc(S(=O)(=O)C2CCCC2)cc1 ZINC000563998778 945340307 /nfs/dbraw/zinc/34/03/07/945340307.db2.gz NDBMDGNUVUPAAX-HNAYVOBHSA-N 0 3 403.519 4.196 20 0 HIADHN COC1CCN(C2(CNC(=O)[C@@H](C)CC(=O)c3ccc(Cl)cc3)CCCC2)CC1 ZINC000546085067 940694999 /nfs/dbraw/zinc/69/49/99/940694999.db2.gz BJYJKDFBLMQKBV-KRWDZBQOSA-N 0 3 420.981 4.089 20 0 HIADHN COc1ccccc1Oc1ccc(NC(=O)N2C[C@@H](SC)[C@H](N(C)C)C2)cc1F ZINC000546131459 940708289 /nfs/dbraw/zinc/70/82/89/940708289.db2.gz CVVGXNGJRWXPQY-OXQOHEQNSA-N 0 3 419.522 4.136 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](NCCC[C@@H]2CCCCO2)c2ccc(F)cc2)c1 ZINC000546165895 940719129 /nfs/dbraw/zinc/71/91/29/940719129.db2.gz HAXXXJQEULSZRA-UNMCSNQZSA-N 0 3 405.535 4.258 20 0 HIADHN CCN(C(=O)c1ccc(CN(C)C(=O)C(C)C)cc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000546183831 940723233 /nfs/dbraw/zinc/72/32/33/940723233.db2.gz BFQODDUWIJYHIN-DEOSSOPVSA-N 0 3 421.585 4.038 20 0 HIADHN CCN(C(=O)c1ccc(CN(C)C(=O)C(C)C)cc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000546183834 940723513 /nfs/dbraw/zinc/72/35/13/940723513.db2.gz BFQODDUWIJYHIN-XMMPIXPASA-N 0 3 421.585 4.038 20 0 HIADHN Cc1cc(Br)cn2cc(CCN[C@H](C)c3nc4ccccc4n3C)nc12 ZINC000546223718 940734505 /nfs/dbraw/zinc/73/45/05/940734505.db2.gz ICFNSQPCXZMGHR-CQSZACIVSA-N 0 3 412.335 4.185 20 0 HIADHN Fc1cccc(CN2CCC[C@@H](c3nc(-c4ccc(OCC5CC5)nc4)no3)C2)c1 ZINC000546359225 940801265 /nfs/dbraw/zinc/80/12/65/940801265.db2.gz NYCJBKAWWXXIPC-LJQANCHMSA-N 0 3 408.477 4.439 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(CCCc4ccc(Cl)cc4)n3)cn2)CC1 ZINC000546365339 940802509 /nfs/dbraw/zinc/80/25/09/940802509.db2.gz TWMOMZVRWCNUKH-UHFFFAOYSA-N 0 3 411.937 4.102 20 0 HIADHN Fc1cccc(CN2CCC[C@H](c3nc(-c4ccccc4-n4cccn4)no3)C2)c1 ZINC000546373567 940804417 /nfs/dbraw/zinc/80/44/17/940804417.db2.gz SWIJHACBNURXPN-SFHVURJKSA-N 0 3 403.461 4.441 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](NC2Cc3ccccc3C2)c2ccc(F)c(F)c2)c1 ZINC000546573465 940855795 /nfs/dbraw/zinc/85/57/95/940855795.db2.gz MCZPQBZDUPSROI-QHCPKHFHSA-N 0 3 413.489 4.215 20 0 HIADHN COc1cc(CN2CCCC[C@H]2c2ccccc2)ccc1OCC(=O)N1CCCC1 ZINC000546691458 940869734 /nfs/dbraw/zinc/86/97/34/940869734.db2.gz BOPVKLFQIRJZOP-QFIPXVFZSA-N 0 3 408.542 4.424 20 0 HIADHN CCN(CC)[C@H](CNC(=O)C1(c2ccc(OC)cc2)CCOCC1)c1ccsc1 ZINC000546702472 940870815 /nfs/dbraw/zinc/87/08/15/940870815.db2.gz RZECGIVDVQNRPP-OAQYLSRUSA-N 0 3 416.587 4.004 20 0 HIADHN CN(CCCN1CCN(C)CC1)C(=O)c1cc(Cl)ccc1Sc1ccccc1 ZINC000546791065 940883546 /nfs/dbraw/zinc/88/35/46/940883546.db2.gz WVKMVRRVCIQOGR-UHFFFAOYSA-N 0 3 418.006 4.201 20 0 HIADHN COCCN1CCC(NC(=O)c2cc(Cl)ccc2Sc2ccccc2)CC1 ZINC000546807795 940885878 /nfs/dbraw/zinc/88/58/78/940885878.db2.gz JTKOXJGHDKZYPH-UHFFFAOYSA-N 0 3 404.963 4.332 20 0 HIADHN Cc1c([C@H](C)NCCC[C@@H]2CCCCO2)nnn1-c1cccc(Br)c1 ZINC000546872017 940898807 /nfs/dbraw/zinc/89/88/07/940898807.db2.gz WLGSXJTUPCIPHJ-KSSFIOAISA-N 0 3 407.356 4.338 20 0 HIADHN CCN(C(=O)c1cccc(NC(=O)c2ccco2)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000546889681 940902933 /nfs/dbraw/zinc/90/29/33/940902933.db2.gz MDPJNPRYMLZWIM-QFIPXVFZSA-N 0 3 417.509 4.269 20 0 HIADHN CCN(C(=O)CCc1ncc(-c2ccccc2)o1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000546904955 940908430 /nfs/dbraw/zinc/90/84/30/940908430.db2.gz HMIQCIHGWCCJFC-JOCHJYFZSA-N 0 3 403.526 4.397 20 0 HIADHN CC[C@H](C)Oc1ccc(-c2nc(-c3ccc(N4CCCN(C)CC4)nc3)no2)cc1 ZINC000547061713 940978937 /nfs/dbraw/zinc/97/89/37/940978937.db2.gz FPQHVGDBCHVMSN-KRWDZBQOSA-N 0 3 407.518 4.118 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(-c4ccc(-c5cccs5)o4)n3)cn2)CC1 ZINC000547071871 940983535 /nfs/dbraw/zinc/98/35/35/940983535.db2.gz COALYXCRLDAERV-UHFFFAOYSA-N 0 3 407.499 4.262 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(Cc4c(Cl)cccc4Cl)n3)cn2)CC1 ZINC000547073282 940984517 /nfs/dbraw/zinc/98/45/17/940984517.db2.gz WJRVNONIDSUFNJ-UHFFFAOYSA-N 0 3 418.328 4.171 20 0 HIADHN FC(F)(F)[C@]1(c2nc(-c3n[nH]c4ccccc43)no2)CCN(Cc2ccccc2)C1 ZINC000547122550 941003799 /nfs/dbraw/zinc/00/37/99/941003799.db2.gz VPUURZNFLRKSGG-HXUWFJFHSA-N 0 3 413.403 4.319 20 0 HIADHN CCc1cccnc1-c1noc([C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)n1 ZINC000547124987 941004685 /nfs/dbraw/zinc/00/46/85/941004685.db2.gz GFAHGJIVKOGNTC-HXUWFJFHSA-N 0 3 402.420 4.400 20 0 HIADHN Cc1cc(-c2noc(-c3ccc(CN4C[C@@H](C)O[C@@H](C)C4)cc3)n2)cc2nc[nH]c21 ZINC000547150974 941012347 /nfs/dbraw/zinc/01/23/47/941012347.db2.gz LJTXNJZHYYVCMW-IYBDPMFKSA-N 0 3 403.486 4.198 20 0 HIADHN C[C@@H](c1noc([C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)n1)c1ccncc1 ZINC000547220884 941036222 /nfs/dbraw/zinc/03/62/22/941036222.db2.gz GJBIKYDHKOGPFD-QRWLVFNGSA-N 0 3 402.420 4.322 20 0 HIADHN COc1ccc(NC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)c2ncccc12 ZINC000547452923 941063533 /nfs/dbraw/zinc/06/35/33/941063533.db2.gz AQMCJMHDMJYOOR-SFHVURJKSA-N 0 3 404.514 4.372 20 0 HIADHN CN1CCN(C[C@H](N[C@@H]2CCCc3ncc(C(F)(F)F)cc32)c2ccccc2)CC1 ZINC000547654105 941070692 /nfs/dbraw/zinc/07/06/92/941070692.db2.gz STLDFQARWKOBPY-YADHBBJMSA-N 0 3 418.507 4.056 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)c3coc(C4CCCCC4)n3)CC2)C[C@H](C)O1 ZINC000547948212 941080018 /nfs/dbraw/zinc/08/00/18/941080018.db2.gz CFNIJBMBWSTBML-ROUUACIJSA-N 0 3 403.567 4.074 20 0 HIADHN CC(C)c1c(C(=O)NC[C@]2(C)CCCN2Cc2ccccc2)cnn1-c1ccccn1 ZINC000548294802 941094257 /nfs/dbraw/zinc/09/42/57/941094257.db2.gz XAEFHKOVLCFPAO-VWLOTQADSA-N 0 3 417.557 4.175 20 0 HIADHN COc1ccc([C@@H](CNC(=O)N[C@@H](C(C)(C)C)C(F)(F)F)N2CCCC2)cc1 ZINC000548510297 941111389 /nfs/dbraw/zinc/11/13/89/941111389.db2.gz DEDFTNAQQAFWOS-SJORKVTESA-N 0 3 401.473 4.108 20 0 HIADHN Cc1nc(N[C@H]2CCCC23CCOCC3)cc(N[C@H]2CCCC23CCOCC3)n1 ZINC000548822212 941125337 /nfs/dbraw/zinc/12/53/37/941125337.db2.gz BSHFJYIERUCWES-OALUTQOASA-N 0 3 400.567 4.307 20 0 HIADHN COc1cc(CNC[C@H](O)COc2ccccc2Cl)ccc1OC1CCCC1 ZINC000548950660 941132556 /nfs/dbraw/zinc/13/25/56/941132556.db2.gz SMCRRGOKJNNBCL-KRWDZBQOSA-N 0 3 405.922 4.200 20 0 HIADHN CCN1CC[C@H](NCC(=O)N[C@@H](C)c2cccs2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000549111878 941160769 /nfs/dbraw/zinc/16/07/69/941160769.db2.gz DNEZIYAZFHRCNF-QKMWGZLOSA-N 0 3 409.958 4.143 20 0 HIADHN O=C1CCCN1C[C@@H](NC[C@H]1CCC2(CCCC2)O1)c1cccc(C(F)(F)F)c1 ZINC000549136808 941164481 /nfs/dbraw/zinc/16/44/81/941164481.db2.gz YLBZBPDOTUCOEK-RTBURBONSA-N 0 3 410.480 4.450 20 0 HIADHN CCOC(=O)C1CCN(C(=O)CN[C@@H](c2ccc(C(C)(C)C)cc2)C(C)C)CC1 ZINC000549178465 941168849 /nfs/dbraw/zinc/16/88/49/941168849.db2.gz UTNVPJSGCZNVTH-JOCHJYFZSA-N 0 3 402.579 4.073 20 0 HIADHN O=S1(=O)CCc2cc(CN[C@H]3CCCCc4cc(Br)ccc43)ccc21 ZINC000549237368 941173094 /nfs/dbraw/zinc/17/30/94/941173094.db2.gz NTELTMKXJBZKNA-IBGZPJMESA-N 0 3 420.372 4.336 20 0 HIADHN Cc1cn(-c2c(F)cccc2F)nc1C(=O)N[C@H](CN(C)C)c1ccc(Cl)cc1 ZINC000549242296 941173452 /nfs/dbraw/zinc/17/34/52/941173452.db2.gz VPDBYTHJYQCKCX-GOSISDBHSA-N 0 3 418.875 4.145 20 0 HIADHN CN(C)C[C@@H](NC(=O)CSc1ccc(C(F)(F)F)cn1)c1ccc(Cl)cc1 ZINC000549244459 941173659 /nfs/dbraw/zinc/17/36/59/941173659.db2.gz FGCLYBJHSDCFAF-OAHLLOKOSA-N 0 3 417.884 4.265 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)NCCc2nc3ccccc3s2)N2CCCC2)cc1 ZINC000549276948 941176366 /nfs/dbraw/zinc/17/63/66/941176366.db2.gz WCMMGSIQWQHUGT-HXUWFJFHSA-N 0 3 408.571 4.284 20 0 HIADHN COC(=O)c1c(F)cc(NC(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)cc1F ZINC000549363518 941182844 /nfs/dbraw/zinc/18/28/44/941182844.db2.gz MRXOTOHPWSLHKE-IBGZPJMESA-N 0 3 417.456 4.018 20 0 HIADHN COc1cc(OC)cc(C2(F)CCN(Cc3ccccc3N3CCOCC3)CC2)c1 ZINC000549406756 941186804 /nfs/dbraw/zinc/18/68/04/941186804.db2.gz OBTMKHWRDHZGHT-UHFFFAOYSA-N 0 3 414.521 4.001 20 0 HIADHN CCN1CC[C@@H](NCC(=O)Nc2cccc(SC)c2)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000549472360 941193598 /nfs/dbraw/zinc/19/35/98/941193598.db2.gz MZKYJMFZFJMZFM-NQIIRXRSSA-N 0 3 423.504 4.189 20 0 HIADHN COc1ccc(NC(=O)[C@H](C)N[C@@H]2CCN(C(C)C)[C@H]2c2ccc(F)c(F)c2)cc1 ZINC000549476917 941194344 /nfs/dbraw/zinc/19/43/44/941194344.db2.gz OPTDLALRZTWKSU-ARBPTSGCSA-N 0 3 417.500 4.114 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3ccccc3OC(F)F)c(C)c2)CC1 ZINC000549512153 941197626 /nfs/dbraw/zinc/19/76/26/941197626.db2.gz KTWGLBSBPTYFKG-UHFFFAOYSA-N 0 3 404.461 4.382 20 0 HIADHN CCCCNC(=O)c1ccc(CN[C@H]2CC[C@H](C(=O)OCC)c3ccccc32)cc1 ZINC000549525911 941198023 /nfs/dbraw/zinc/19/80/23/941198023.db2.gz BEFOBSNAZHPECE-GOTSBHOMSA-N 0 3 408.542 4.488 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@H](NCc2cccc(NC(=O)[C@H]3CCCO3)c2)c2ccccc21 ZINC000549525019 941198055 /nfs/dbraw/zinc/19/80/55/941198055.db2.gz QCHFKOLZVGFQDU-XPWALMASSA-N 0 3 422.525 4.076 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@@H](N[C@@H](CN2CCOCC2)c2ccc(C)cc2)c2ccccc21 ZINC000549527870 941198102 /nfs/dbraw/zinc/19/81/02/941198102.db2.gz OXFPFFIXZGZIEU-SDHSZQHLSA-N 0 3 422.569 4.140 20 0 HIADHN Cc1ccsc1-c1nnc(N2CCN(C)[C@@H](C(C)C)C2)n1Cc1cccs1 ZINC000549574350 941200032 /nfs/dbraw/zinc/20/00/32/941200032.db2.gz YOQGVMLCRRKFPS-QGZVFWFLSA-N 0 3 401.605 4.201 20 0 HIADHN CN(C)C[C@@H](NC(=O)c1cccc(NC(=O)c2cccnc2)c1)c1ccc(Cl)cc1 ZINC000549618480 941201477 /nfs/dbraw/zinc/20/14/77/941201477.db2.gz STSMDNCTHRGTOH-OAQYLSRUSA-N 0 3 422.916 4.020 20 0 HIADHN CN(C)C[C@H](NC(=O)c1ccc(CNC(=O)C(C)(C)C)cc1)c1ccc(Cl)cc1 ZINC000549617611 941201482 /nfs/dbraw/zinc/20/14/82/941201482.db2.gz RTGYNHMTWMDMBS-FQEVSTJZSA-N 0 3 415.965 4.035 20 0 HIADHN CN(C)C[C@@H](NC(=O)Cc1cccc(OCc2cccnc2)c1)c1ccc(Cl)cc1 ZINC000549618704 941201638 /nfs/dbraw/zinc/20/16/38/941201638.db2.gz VGDBRIUYCMGTQB-HSZRJFAPSA-N 0 3 423.944 4.276 20 0 HIADHN CCN(C(=O)N[C@H]1CCc2cc(F)c(OC)cc21)[C@H]1CCN(Cc2ccccc2)C1 ZINC000549625615 941201888 /nfs/dbraw/zinc/20/18/88/941201888.db2.gz QHWYLBQIRPLUBT-UGKGYDQZSA-N 0 3 411.521 4.128 20 0 HIADHN Cc1sc2nc([C@@H](C)N[C@@H](C)C3CCN(CC(F)(F)F)CC3)nc(N)c2c1C ZINC000549633613 941202226 /nfs/dbraw/zinc/20/22/26/941202226.db2.gz NPQYDAPXUPAKAT-NWDGAFQWSA-N 0 3 415.529 4.204 20 0 HIADHN CC[C@@H]1CN(c2nnc(C3CCCC3)n2C[C@@H]2CCOC2)CCN1Cc1ccccc1 ZINC000549678420 941204139 /nfs/dbraw/zinc/20/41/39/941204139.db2.gz NKFHLNWRJFPSOR-JTHBVZDNSA-N 0 3 423.605 4.073 20 0 HIADHN O=C(NCCN1CCCC1)c1ccc(NCc2cccc(-c3cccnc3)c2)cc1 ZINC000549680243 941204221 /nfs/dbraw/zinc/20/42/21/941204221.db2.gz FJNCLVCXBLGPFY-UHFFFAOYSA-N 0 3 400.526 4.186 20 0 HIADHN Cc1c2cccc(Cl)c2sc1CNCc1ccc(S(=O)(=O)N(C)C)cc1 ZINC000549711178 941205421 /nfs/dbraw/zinc/20/54/21/941205421.db2.gz LQSCPOWDYUPYQM-UHFFFAOYSA-N 0 3 408.976 4.403 20 0 HIADHN COc1ccc(CNC2(Cc3ccc(F)cc3)CCOCC2)c(Br)c1O ZINC000549842839 941212239 /nfs/dbraw/zinc/21/22/39/941212239.db2.gz ABQFVJDBPOKFPD-UHFFFAOYSA-N 0 3 424.310 4.184 20 0 HIADHN COc1ccc(C[NH2+]C2(Cc3ccc(F)cc3)CCOCC2)c(Br)c1[O-] ZINC000549842839 941212243 /nfs/dbraw/zinc/21/22/43/941212243.db2.gz ABQFVJDBPOKFPD-UHFFFAOYSA-N 0 3 424.310 4.184 20 0 HIADHN CCN(C(=O)c1ccc2c(c1)NC(=O)C2(C)C)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000549931220 941241464 /nfs/dbraw/zinc/24/14/64/941241464.db2.gz HYPCJTYAPBFYCY-PXNSSMCTSA-N 0 3 405.542 4.214 20 0 HIADHN CC(=O)c1ccc2c(c1)CCN(C[C@H](O)CO[C@@H](C)c1ccc(Cl)cc1)CC2 ZINC000549970625 941254820 /nfs/dbraw/zinc/25/48/20/941254820.db2.gz JPXURRLWAGICPC-SBUREZEXSA-N 0 3 401.934 4.082 20 0 HIADHN COCCc1ccc(OC[C@@H](O)CN2CCC([C@@H](F)c3ccccc3F)CC2)cc1 ZINC000550097812 941284231 /nfs/dbraw/zinc/28/42/31/941284231.db2.gz VERXMWOWVQXYFK-GBXCKJPGSA-N 0 3 419.512 4.177 20 0 HIADHN Cn1cc(-c2cc(CN3CCC(c4ccc(OC(F)(F)F)cc4)CC3)on2)cn1 ZINC000550464509 941329966 /nfs/dbraw/zinc/32/99/66/941329966.db2.gz VSCKFCFKOWOTNT-UHFFFAOYSA-N 0 3 406.408 4.353 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1ccc(-c2nncs2)cc1)c1ccsc1 ZINC000550672188 941352667 /nfs/dbraw/zinc/35/26/67/941352667.db2.gz XLYXDRMPBJQZHQ-KRWDZBQOSA-N 0 3 401.561 4.471 20 0 HIADHN O=C(CN1CCC[C@H](c2ccccc2)CC1)NCC1(c2ccccc2)CCOCC1 ZINC000550992965 941391933 /nfs/dbraw/zinc/39/19/33/941391933.db2.gz NOJRVGCOBZZYNP-QHCPKHFHSA-N 0 3 406.570 4.121 20 0 HIADHN CCNC(=O)COc1ccc(CNC(C)(C)c2cccc(C(F)(F)F)c2)cc1OC ZINC000551052046 941401355 /nfs/dbraw/zinc/40/13/55/941401355.db2.gz XSTCVFOFPQDTJF-UHFFFAOYSA-N 0 3 424.463 4.254 20 0 HIADHN CN(C(=O)c1ccc(NCc2cc(Cl)cc3c2OCC3)cc1)[C@@H]1CCCN(C)C1 ZINC000551089383 941408027 /nfs/dbraw/zinc/40/80/27/941408027.db2.gz FGZSYMPFKSVDMU-OAQYLSRUSA-N 0 3 413.949 4.053 20 0 HIADHN Cc1ccc(-c2noc([C@H](C)N[C@H](C)C3CCN(CC(F)(F)F)CC3)n2)cc1F ZINC000551093596 941408975 /nfs/dbraw/zinc/40/89/75/941408975.db2.gz OYMXAYGPJDTVJL-KGLIPLIRSA-N 0 3 414.447 4.498 20 0 HIADHN CS(=O)(=O)CC1CCC(NCc2nc(-c3cc4ccccc4o3)cs2)CC1 ZINC000551176332 941422741 /nfs/dbraw/zinc/42/27/41/941422741.db2.gz SCEVPEQZIISCJU-UHFFFAOYSA-N 0 3 404.557 4.249 20 0 HIADHN OC[C@@H]1CC[C@H](CN[C@H](Cc2ccccc2F)c2ccccc2Br)O1 ZINC000551229302 941431365 /nfs/dbraw/zinc/43/13/65/941431365.db2.gz RXWSHRBOPZQKML-GQIGUUNPSA-N 0 3 408.311 4.002 20 0 HIADHN CCO[C@@H]1C[C@H](N[C@H](c2ccc(Br)cc2F)C2CC2)[C@@H]1n1cccn1 ZINC000551320118 941451669 /nfs/dbraw/zinc/45/16/69/941451669.db2.gz JDMSBYJGBPAENX-RDGPPVDQSA-N 0 3 408.315 4.244 20 0 HIADHN COc1ccc2ccccc2c1CN(C[C@@H]1CCCS(=O)(=O)C1)C1CCCC1 ZINC000551385252 941466416 /nfs/dbraw/zinc/46/64/16/941466416.db2.gz JELDPBMJANNNCD-SFHVURJKSA-N 0 3 401.572 4.418 20 0 HIADHN COc1cc(Cl)c(C)cc1NC(=O)CCN[C@H](C)c1cnc(OC)c(Cl)c1 ZINC000551533057 941496408 /nfs/dbraw/zinc/49/64/08/941496408.db2.gz JTUIHWDHPUVWRN-GFCCVEGCSA-N 0 3 412.317 4.393 20 0 HIADHN COc1ncc([C@@H](C)N[C@H](C)CC(=O)Nc2cccc(N3CCCC3)c2)cc1Cl ZINC000551534796 941497005 /nfs/dbraw/zinc/49/70/05/941497005.db2.gz QXYBUQFNPRTHDX-HZPDHXFCSA-N 0 3 416.953 4.412 20 0 HIADHN CCS(=O)(=O)c1ccc([C@@H](C)N[C@@H](C)CC(=O)Nc2ccc(C)cc2C)cc1 ZINC000551564911 941502468 /nfs/dbraw/zinc/50/24/68/941502468.db2.gz RHUQNZQRFOIXMC-ZWKOTPCHSA-N 0 3 402.560 4.165 20 0 HIADHN COc1ccc([C@H](CNCc2c(F)cccc2OC(F)(F)F)N(C)C)cc1OC ZINC000551570755 941503953 /nfs/dbraw/zinc/50/39/53/941503953.db2.gz AMYCQVGCYGPTIM-INIZCTEOSA-N 0 3 416.415 4.134 20 0 HIADHN CC[C@@H](NCc1cccc(N2C(=O)N[C@@](C)(C3CC3)C2=O)c1)c1ccc(OC)cc1 ZINC000551574453 941505442 /nfs/dbraw/zinc/50/54/42/941505442.db2.gz IWJUODPNBHZYDQ-QPPBQGQZSA-N 0 3 407.514 4.161 20 0 HIADHN COc1ccc([C@H](CN(C)C)NCc2ccc(-n3ccc(C(F)(F)F)n3)cc2)cc1 ZINC000551580380 941506294 /nfs/dbraw/zinc/50/62/94/941506294.db2.gz GJBMPEYMDKXEFF-FQEVSTJZSA-N 0 3 418.463 4.292 20 0 HIADHN C[C@@]1(C2CC2)NC(=O)N(c2cccc(CNCc3csc4ccccc34)c2)C1=O ZINC000551584309 941507067 /nfs/dbraw/zinc/50/70/67/941507067.db2.gz ACOSJTLLHUTQAQ-QHCPKHFHSA-N 0 3 405.523 4.416 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)[C@@H]1CCCc2cccnc21 ZINC000551646387 941518005 /nfs/dbraw/zinc/51/80/05/941518005.db2.gz NKTJLRXAQHGUOF-FGZHOGPDSA-N 0 3 415.541 4.092 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)c2sc(-c3ccccc3C)nc2C)cc1 ZINC000551795502 941546228 /nfs/dbraw/zinc/54/62/28/941546228.db2.gz FCXSSIGTWSEYHO-HXUWFJFHSA-N 0 3 409.555 4.468 20 0 HIADHN CCN(Cc1ccc(C(=O)N(C)C)cc1)Cc1cccc(I)c1 ZINC000551806834 941548781 /nfs/dbraw/zinc/54/87/81/941548781.db2.gz VWUPNFUJEVCCPA-UHFFFAOYSA-N 0 3 422.310 4.015 20 0 HIADHN COc1ccc(C[C@H](C)N[C@@H](c2nc(-c3cccnc3)no2)C(C)C)c(C)c1OC ZINC000552045800 941573122 /nfs/dbraw/zinc/57/31/22/941573122.db2.gz PLPBLDMVKVJJBP-MGPUTAFESA-N 0 3 410.518 4.375 20 0 HIADHN C[C@H](NC(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F)c1ccc(-n2cccn2)cc1 ZINC000552068909 941578834 /nfs/dbraw/zinc/57/88/34/941578834.db2.gz UFMRQAWKPWAISS-AVRDEDQJSA-N 0 3 424.495 4.207 20 0 HIADHN O=C(NCC(F)(F)F)C1CCN(CC2=Cc3cc(Cl)cc(Cl)c3OC2)CC1 ZINC000552071703 941579609 /nfs/dbraw/zinc/57/96/09/941579609.db2.gz DTOFXJUNTAYUHF-UHFFFAOYSA-N 0 3 423.262 4.160 20 0 HIADHN O=C(NCC(F)(F)F)C1CCN(Cc2ccccc2OCc2ccccc2)CC1 ZINC000552071704 941579649 /nfs/dbraw/zinc/57/96/49/941579649.db2.gz GAPGRBZAQDQMED-UHFFFAOYSA-N 0 3 406.448 4.156 20 0 HIADHN CNC(=O)COc1cccc(CN[C@H](C)c2ccc(OCc3ccccc3)cc2)c1 ZINC000552074734 941580258 /nfs/dbraw/zinc/58/02/58/941580258.db2.gz YZFJFBLKKJCAMO-LJQANCHMSA-N 0 3 404.510 4.241 20 0 HIADHN CNC(=O)COc1cccc(CN[C@@H](C)c2csc(-c3csc(C)n3)c2)c1 ZINC000552074402 941580281 /nfs/dbraw/zinc/58/02/81/941580281.db2.gz MSTSZIKUIICCIR-ZDUSSCGKSA-N 0 3 401.557 4.156 20 0 HIADHN CCc1noc(C2CCC(NCc3cc(F)c(F)cc3Br)CC2)n1 ZINC000552100502 941585189 /nfs/dbraw/zinc/58/51/89/941585189.db2.gz KPUNCTDHJIRNTF-UHFFFAOYSA-N 0 3 400.267 4.489 20 0 HIADHN Cc1ccccc1COc1c(C)cc(CN2CCC[C@H](n3cc(CO)nn3)C2)cc1C ZINC000552110559 941586796 /nfs/dbraw/zinc/58/67/96/941586796.db2.gz UDIQRDHYJOVNIA-DEOSSOPVSA-N 0 3 420.557 4.112 20 0 HIADHN COc1cc(CN2CCC[C@@H](O)CC2)ccc1OCCOc1ccccc1Cl ZINC000552147155 941593895 /nfs/dbraw/zinc/59/38/95/941593895.db2.gz OKYFHHNRKAUXQA-GOSISDBHSA-N 0 3 405.922 4.153 20 0 HIADHN COCc1c(C(=O)Nc2cccc(CN3CC[C@H](O)C3)c2)sc2cccc(F)c21 ZINC000552199390 941600225 /nfs/dbraw/zinc/60/02/25/941600225.db2.gz WPXVJDAIHYWXEI-INIZCTEOSA-N 0 3 414.502 4.006 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)c1ccc(NC(C)=O)c(F)c1)c1ccc(Cl)cc1 ZINC000552240973 941610664 /nfs/dbraw/zinc/61/06/64/941610664.db2.gz YXXBHHXMPNLTFU-FQEVSTJZSA-N 0 3 405.901 4.250 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)c1cc(NC(C)=O)ccc1C)c1ccc(Cl)cc1 ZINC000552243741 941611958 /nfs/dbraw/zinc/61/19/58/941611958.db2.gz JEZFNUKJABBLMP-NRFANRHFSA-N 0 3 401.938 4.420 20 0 HIADHN CCCN(C)[C@H](CNC(=O)c1ccc(C)c(NC(C)=O)c1)c1ccc(Cl)cc1 ZINC000552242754 941612389 /nfs/dbraw/zinc/61/23/89/941612389.db2.gz HPJPJGZIVYBSBG-OAQYLSRUSA-N 0 3 401.938 4.420 20 0 HIADHN O=C(c1cc(Cl)c[nH]1)N1CCC(NCc2ccc(Sc3ccccn3)o2)CC1 ZINC000552243228 941612485 /nfs/dbraw/zinc/61/24/85/941612485.db2.gz SFPDDDJRPJNXAV-UHFFFAOYSA-N 0 3 416.934 4.202 20 0 HIADHN Clc1ccc([C@H](CN[C@H](c2ncc[nH]2)C2CCCCC2)N2CCOCC2)cc1 ZINC000552248460 941613300 /nfs/dbraw/zinc/61/33/00/941613300.db2.gz HULZMNSFVFKFPJ-SFTDATJTSA-N 0 3 402.970 4.348 20 0 HIADHN CC[C@@H](N[C@@H](C)c1cccc(S(=O)(=O)NC)c1)c1ccc(OC(F)(F)F)cc1 ZINC000552247637 941613363 /nfs/dbraw/zinc/61/33/63/941613363.db2.gz WBFFWFVVZPHMAP-SCLBCKFNSA-N 0 3 416.465 4.295 20 0 HIADHN COc1ccc(NC(=O)CN[C@@H]2CC[C@H](c3ccccc3)C[C@H]2OC)cc1Cl ZINC000552258628 941616043 /nfs/dbraw/zinc/61/60/43/941616043.db2.gz RNQJQZVTQKBCNU-LDQXTDLNSA-N 0 3 402.922 4.228 20 0 HIADHN O=C(N[C@H]1CCOC2(CCCCC2)C1)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000552388648 941653690 /nfs/dbraw/zinc/65/36/90/941653690.db2.gz MPOMNLLFTOXDQB-VQTJNVASSA-N 0 3 406.517 4.142 20 0 HIADHN O[C@@H](CNCc1ccc(Oc2cccnc2)c(F)c1)COc1ccc(Cl)cc1 ZINC000552493924 941688471 /nfs/dbraw/zinc/68/84/71/941688471.db2.gz PLKBYXNHBHAMEL-KRWDZBQOSA-N 0 3 402.853 4.196 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)[C@H]1C[C@H]1c1cccc(C(F)(F)F)c1 ZINC000552514821 941692531 /nfs/dbraw/zinc/69/25/31/941692531.db2.gz OZDNCHHKPIBBLX-UFYCRDLUSA-N 0 3 404.432 4.014 20 0 HIADHN C[C@H](Cc1cccc(C(F)(F)F)c1)C(=O)Nc1cccc(CN2CC[C@@H](O)C2)c1 ZINC000552516470 941693498 /nfs/dbraw/zinc/69/34/98/941693498.db2.gz UKPTXJCUJLIGHF-FOIQADDNSA-N 0 3 406.448 4.089 20 0 HIADHN C/C=C/c1ccc(OC[C@H](O)CN[C@@H]2CCSc3c(F)cccc32)c(OC)c1 ZINC000552676121 941735467 /nfs/dbraw/zinc/73/54/67/941735467.db2.gz KOWOZMONAMHRRK-FIXKIMANSA-N 0 3 403.519 4.434 20 0 HIADHN Cc1cc(C(=O)CCC(=O)N2CC[C@]3(CCN(Cc4ccccc4)C3)C2)c(C)s1 ZINC000552678892 941735932 /nfs/dbraw/zinc/73/59/32/941735932.db2.gz HPSQHDSIGVMKFR-DEOSSOPVSA-N 0 3 410.583 4.452 20 0 HIADHN O=C(NCc1ccncc1OCc1ccccc1)c1cccc(CN2CCCC2)c1 ZINC000552714098 941743475 /nfs/dbraw/zinc/74/34/75/941743475.db2.gz GZFJUHGTAILOMY-UHFFFAOYSA-N 0 3 401.510 4.186 20 0 HIADHN CO[C@@H]1CCC[C@H](C(=O)N(Cc2ccccc2Br)C2CCN(C)CC2)C1 ZINC000552748254 941751170 /nfs/dbraw/zinc/75/11/70/941751170.db2.gz ORHXLUSURWNWQQ-QFBILLFUSA-N 0 3 423.395 4.077 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)c2cc(Cl)ccc2Br)cc1 ZINC000552817675 941775844 /nfs/dbraw/zinc/77/58/44/941775844.db2.gz XGKOSJQHUCCYLB-KRWDZBQOSA-N 0 3 411.727 4.144 20 0 HIADHN O=C(Cc1cccc(O)c1)N(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000552850943 941788159 /nfs/dbraw/zinc/78/81/59/941788159.db2.gz DNTXUWQNOCFRED-XMMPIXPASA-N 0 3 415.537 4.023 20 0 HIADHN Cc1nn(-c2ccccc2)cc1CCCN[C@@H](C)c1nnn(-c2ccc(F)cc2)c1C ZINC000552879934 941797441 /nfs/dbraw/zinc/79/74/41/941797441.db2.gz KUHZLUIGUHTHFG-SFHVURJKSA-N 0 3 418.520 4.492 20 0 HIADHN CCS(=O)(=O)c1ccc([C@H](C)NCCc2nc(-c3ccc(Cl)cc3)no2)cc1 ZINC000552904741 941800790 /nfs/dbraw/zinc/80/07/90/941800790.db2.gz VESUGCCOUJQKFQ-AWEZNQCLSA-N 0 3 419.934 4.077 20 0 HIADHN CCCN(C)[C@H](CNC(=O)[C@H]1CCCN(C(=O)[C@H](C)CC)C1)c1ccc(Cl)cc1 ZINC000553027453 941819514 /nfs/dbraw/zinc/81/95/14/941819514.db2.gz ZUBYLJWZKHUZSO-SLYNCCJLSA-N 0 3 422.013 4.124 20 0 HIADHN C[C@@H](Cc1ccc(Cl)cc1)C(=O)N1CCC[C@H](c2n[nH]cc2CN2CCCC2)C1 ZINC000553180635 941845046 /nfs/dbraw/zinc/84/50/46/941845046.db2.gz CRKJNBUYLOOPQS-HKUYNNGSSA-N 0 3 414.981 4.244 20 0 HIADHN O=C(COc1ccsc1)N(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000553196334 941847530 /nfs/dbraw/zinc/84/75/30/941847530.db2.gz KHJQZOXHUBOIAH-QFIPXVFZSA-N 0 3 421.566 4.215 20 0 HIADHN Cc1ccc(C(=O)N(Cc2ccncc2)[C@@H]2CCCN(Cc3ccccc3)C2)cc1O ZINC000553196617 941847644 /nfs/dbraw/zinc/84/76/44/941847644.db2.gz WJFBQHGWERTOOD-XMMPIXPASA-N 0 3 415.537 4.403 20 0 HIADHN Cc1cccc(C(C)(C)NCC(=O)NCc2cccc(COCc3ccco3)c2)c1 ZINC000553337953 941869230 /nfs/dbraw/zinc/86/92/30/941869230.db2.gz DZXZCGVABGWZEL-UHFFFAOYSA-N 0 3 406.526 4.446 20 0 HIADHN CC(C)c1ccc2occ(C(=O)N[C@@H]3CCN(Cc4ccccc4)C[C@@H]3CO)c2c1 ZINC000553434664 941884112 /nfs/dbraw/zinc/88/41/12/941884112.db2.gz MKTQSOYCDKGQJA-NFBKMPQASA-N 0 3 406.526 4.169 20 0 HIADHN CCOc1cc(CNC[C@@H](O)C(F)F)ccc1OCc1c(F)cccc1Cl ZINC000553517789 941900626 /nfs/dbraw/zinc/90/06/26/941900626.db2.gz SOUKSIMAMSCHDN-MRXNPFEDSA-N 0 3 403.828 4.172 20 0 HIADHN CCCN1CCC[C@H]1CNC(=O)c1sc(NC(=O)c2cccc(F)c2)cc1C ZINC000553690350 941944802 /nfs/dbraw/zinc/94/48/02/941944802.db2.gz JGEAIGLCSIZYHH-KRWDZBQOSA-N 0 3 403.523 4.052 20 0 HIADHN C[C@@H]1CN(C(=O)c2ccccc2CN(C)C)C[C@H](c2cccc(C(F)(F)F)c2)O1 ZINC000553722150 941952624 /nfs/dbraw/zinc/95/26/24/941952624.db2.gz GCIMFELXBBYLCU-FOIQADDNSA-N 0 3 406.448 4.369 20 0 HIADHN CCOc1ccc(-c2nc(CC)c(C(=O)N3CC[C@@H](N4CCCC4)[C@H]3C)s2)cc1 ZINC000553775501 941965420 /nfs/dbraw/zinc/96/54/20/941965420.db2.gz XCRLGBWCOAEBQN-OXQOHEQNSA-N 0 3 413.587 4.470 20 0 HIADHN Cc1cccc(-n2ncc(C(=O)N3CCN([C@@H]4C[C@H]4C)C[C@H](C)C3)c2C(F)(F)F)c1 ZINC000553783445 941967714 /nfs/dbraw/zinc/96/77/14/941967714.db2.gz VNBSEXNIKCWHDI-FRQCXROJSA-N 0 3 420.479 4.002 20 0 HIADHN CCCN(C)[C@H](CNC(=O)N(CC)CCc1nccs1)c1ccc(Cl)cc1 ZINC000553896268 941992924 /nfs/dbraw/zinc/99/29/24/941992924.db2.gz YSXOKZYMGIGVNG-GOSISDBHSA-N 0 3 408.999 4.454 20 0 HIADHN CCCN(C)[C@H](CNC(=O)N(C)Cc1cnc(C(C)C)nc1)c1ccc(Cl)cc1 ZINC000553897044 941993653 /nfs/dbraw/zinc/99/36/53/941993653.db2.gz WULZEPZHPHKSLJ-HXUWFJFHSA-N 0 3 417.985 4.478 20 0 HIADHN Cc1cc(C)c(CN(C)C2CCN(c3cnccn3)CC2)c(OCc2ccccc2)n1 ZINC000553897162 941993672 /nfs/dbraw/zinc/99/36/72/941993672.db2.gz AMRXQUOYUOBXOU-UHFFFAOYSA-N 0 3 417.557 4.168 20 0 HIADHN c1ccc(CN2CCCO[C@H](CN3CCCC[C@H]3c3nnc(C4CCC4)o3)C2)cc1 ZINC000553923707 941999666 /nfs/dbraw/zinc/99/96/66/941999666.db2.gz AXZZFBSBQDKOEA-VXKWHMMOSA-N 0 3 410.562 4.155 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)c2cccc([C@H]3CCCOC3)c2)N(C)C)cc1 ZINC000554012832 942019015 /nfs/dbraw/zinc/01/90/15/942019015.db2.gz QKOWCDVUHJBQSP-UPVQGACJSA-N 0 3 410.558 4.401 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)[C@H]2C[C@H]2c2ccc(F)cc2F)N(C)C)cc1 ZINC000554015324 942019321 /nfs/dbraw/zinc/01/93/21/942019321.db2.gz MSDCLYJGMVPGCJ-ONTIZHBOSA-N 0 3 402.485 4.275 20 0 HIADHN COc1cccc2cc([C@H](C)N[C@@H]3CCCN(S(=O)(=O)c4cccs4)C3)oc21 ZINC000554085513 942033412 /nfs/dbraw/zinc/03/34/12/942033412.db2.gz KTRDXEKIWLEQRE-GOEBONIOSA-N 0 3 420.556 4.007 20 0 HIADHN C[C@@H](N[C@@H]1CCN(c2ccc(Cl)cc2Cl)C1=O)c1cccc(-n2ccnn2)c1 ZINC000554090278 942034383 /nfs/dbraw/zinc/03/43/83/942034383.db2.gz PLMQHZBLMWFMIC-FZKQIMNGSA-N 0 3 416.312 4.030 20 0 HIADHN C[C@@H](NC[C@H](CO)c1cccnc1)c1ccc(Br)cc1Br ZINC000554116825 942040470 /nfs/dbraw/zinc/04/04/70/942040470.db2.gz XEGHZFOHZAAJSZ-DGCLKSJQSA-N 0 3 414.141 4.033 20 0 HIADHN C[C@H](NC(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F)[C@H]1OCCc2sccc21 ZINC000554208371 942067386 /nfs/dbraw/zinc/06/73/86/942067386.db2.gz HREFLFAEFSYOGS-QKYXUNIQSA-N 0 3 420.525 4.024 20 0 HIADHN C[C@@H](CN(C(=O)NC[C@@H](c1cccs1)N1CCCC1)[C@@H](C)CO)c1ccccc1 ZINC000554218614 942070985 /nfs/dbraw/zinc/07/09/85/942070985.db2.gz OUTUOQIJAWNOQU-ZJOUEHCJSA-N 0 3 415.603 4.081 20 0 HIADHN C[C@@H](CN(C(=O)NC[C@H](c1cccs1)N1CCCC1)[C@@H](C)CO)c1ccccc1 ZINC000554218612 942071237 /nfs/dbraw/zinc/07/12/37/942071237.db2.gz OUTUOQIJAWNOQU-IRFCIJBXSA-N 0 3 415.603 4.081 20 0 HIADHN CSC[C@@H]1CCCN(C(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)C1 ZINC000554278501 942088609 /nfs/dbraw/zinc/08/86/09/942088609.db2.gz IXMWSOVLIDPYLF-IEBWSBKVSA-N 0 3 400.510 4.043 20 0 HIADHN COc1ccc(CN2CC[C@H](N[C@H]3CCCc4ccc(Cl)cc43)C2=O)c(OC)c1 ZINC000554355776 942111722 /nfs/dbraw/zinc/11/17/22/942111722.db2.gz ZSXJCDBMNCLFAO-SFTDATJTSA-N 0 3 414.933 4.125 20 0 HIADHN CCN1CCN(c2ccc(N[C@@H]3CCN(c4ccccc4Cl)C3=O)c(C)c2)CC1 ZINC000554384495 942121065 /nfs/dbraw/zinc/12/10/65/942121065.db2.gz QMNYSXAWHJFFRP-OAQYLSRUSA-N 0 3 412.965 4.008 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)Nc1ccc2c(c1)CCC(=O)N2)c1ccc(Cl)cc1 ZINC000554403101 942128247 /nfs/dbraw/zinc/12/82/47/942128247.db2.gz LHJSZDDDYSAYPG-FQEVSTJZSA-N 0 3 414.937 4.429 20 0 HIADHN CC(=O)Nc1cc(NC(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)ccc1C ZINC000554413156 942132352 /nfs/dbraw/zinc/13/23/52/942132352.db2.gz PDMKHPMUIIXAMK-JOCHJYFZSA-N 0 3 412.534 4.165 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)Nc1ccc(N2CCSCC2)cc1C)c1ccco1 ZINC000554428747 942140606 /nfs/dbraw/zinc/14/06/06/942140606.db2.gz ZWVNWRMSFYYUKL-YLJYHZDGSA-N 0 3 416.591 4.392 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1ccc(C)cc1OC[C@H]1CCCO1)c1ccco1 ZINC000554433115 942141099 /nfs/dbraw/zinc/14/10/99/942141099.db2.gz SNKFVMHOXBOIEQ-NLWGTHIKSA-N 0 3 415.534 4.397 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1ccc(C)cc1OC[C@@H]1CCCO1)c1ccco1 ZINC000554433113 942141332 /nfs/dbraw/zinc/14/13/32/942141332.db2.gz SNKFVMHOXBOIEQ-BJLQDIEVSA-N 0 3 415.534 4.397 20 0 HIADHN COc1cccc(COc2cccc(NC(=O)N[C@@H](C)C3=CCN(C)CC3)c2C)c1 ZINC000554619789 942176740 /nfs/dbraw/zinc/17/67/40/942176740.db2.gz IPDZPSMZWGRZCM-SFHVURJKSA-N 0 3 409.530 4.355 20 0 HIADHN Cc1cccc([C@@H](NC(=O)N[C@H](C)CN(C)Cc2ccccc2)c2ccccn2)c1 ZINC000554706499 942206563 /nfs/dbraw/zinc/20/65/63/942206563.db2.gz OLBRZAAUELVSTR-HYBUGGRVSA-N 0 3 402.542 4.299 20 0 HIADHN CCOC(=O)C1CCC(N(CC)CC(=O)Nc2cccc(C(F)(F)F)c2)CC1 ZINC000554853536 942289861 /nfs/dbraw/zinc/28/98/61/942289861.db2.gz DPJNZXKWXMWMPK-UHFFFAOYSA-N 0 3 400.441 4.088 20 0 HIADHN CCOC(=O)C1CCC(N(CC)CC(=O)Nc2cccc(Cl)c2Cl)CC1 ZINC000554861331 942296036 /nfs/dbraw/zinc/29/60/36/942296036.db2.gz XDWSDKMMJNTAFI-UHFFFAOYSA-N 0 3 401.334 4.376 20 0 HIADHN CCOC(=O)c1nnc(-c2cccc(C[NH2+]Cc3cccc(-c4ccccn4)c3)c2)[n-]1 ZINC000554883500 942306974 /nfs/dbraw/zinc/30/69/74/942306974.db2.gz GUIKOKWVZOUWIS-UHFFFAOYSA-N 0 3 413.481 4.000 20 0 HIADHN CCOC(=O)c1nc(-c2cccc(C[NH2+]Cc3cccc(-c4ccccn4)c3)c2)n[n-]1 ZINC000554883500 942306979 /nfs/dbraw/zinc/30/69/79/942306979.db2.gz GUIKOKWVZOUWIS-UHFFFAOYSA-N 0 3 413.481 4.000 20 0 HIADHN CN(C)C[C@@H](NC(=O)Nc1ccc(OC[C@@H]2CCCO2)cc1)c1ccc(Cl)cc1 ZINC000554909504 942315828 /nfs/dbraw/zinc/31/58/28/942315828.db2.gz FHXJUPDDPQDINK-LEWJYISDSA-N 0 3 417.937 4.322 20 0 HIADHN Cc1c(Cl)cccc1NC(=O)CN[C@H]1CCN(C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000554954641 942332253 /nfs/dbraw/zinc/33/22/53/942332253.db2.gz PZTAOKIBWIXIGV-ICSRJNTNSA-N 0 3 410.320 4.414 20 0 HIADHN COCc1cc(OC[C@@H]2CN(Cc3ccccc3)CCCO2)c2cc(F)ccc2n1 ZINC000554958664 942333792 /nfs/dbraw/zinc/33/37/92/942333792.db2.gz SHNVZLYGQADFKC-NRFANRHFSA-N 0 3 410.489 4.190 20 0 HIADHN CCn1c(-c2sccc2C)nnc1N1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000555076351 942378566 /nfs/dbraw/zinc/37/85/66/942378566.db2.gz IWYNTUMTZGAFIU-ROUUACIJSA-N 0 3 417.623 4.051 20 0 HIADHN CC(C)N1CC[C@@H](NCC(=O)NCc2cccc(Cl)c2)[C@@H]1c1ccc(F)c(F)c1 ZINC000555125203 942392600 /nfs/dbraw/zinc/39/26/00/942392600.db2.gz IIQQUWQCSLQEQM-IRLDBZIGSA-N 0 3 421.919 4.048 20 0 HIADHN COc1cccc([C@@H]2[C@H](N[C@H](C)C(=O)N[C@@H](C)c3ccccc3C)CCN2C2CC2)c1 ZINC000555125262 942392763 /nfs/dbraw/zinc/39/27/63/942392763.db2.gz GEMATNCGJXIHNQ-NUQURWJTSA-N 0 3 421.585 4.137 20 0 HIADHN CCn1c(CN[C@H]2CCN(C3CC3)[C@H]2c2cccc(OC)c2)nc2cc(F)ccc21 ZINC000555128243 942394278 /nfs/dbraw/zinc/39/42/78/942394278.db2.gz FJSUCPZSXDNJBV-RDPSFJRHSA-N 0 3 408.521 4.272 20 0 HIADHN CCN1CC[C@H](NCC(=O)Nc2ccc(C)cc2F)[C@H]1c1ccc(Cl)c(F)c1 ZINC000555131660 942396464 /nfs/dbraw/zinc/39/64/64/942396464.db2.gz PEHJKULYAAIVCE-PZJWPPBQSA-N 0 3 407.892 4.290 20 0 HIADHN CCN1CC[C@@H](NCC(=O)Nc2ccc(C)cc2F)[C@H]1c1ccc(Cl)c(F)c1 ZINC000555131661 942396670 /nfs/dbraw/zinc/39/66/70/942396670.db2.gz PEHJKULYAAIVCE-TZIWHRDSSA-N 0 3 407.892 4.290 20 0 HIADHN COc1cc(C)c([C@@H](C)NC(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)cc1OC ZINC000555132525 942397116 /nfs/dbraw/zinc/39/71/16/942397116.db2.gz VYKVQJBBXJPZNG-BEFAXECRSA-N 0 3 419.953 4.329 20 0 HIADHN Brc1ccc2c(c1)CCCC[C@H]2NCc1cccc(N2CCOCC2)n1 ZINC000555225071 942436936 /nfs/dbraw/zinc/43/69/36/942436936.db2.gz GNSAONYMVGAMCD-HXUWFJFHSA-N 0 3 416.363 4.238 20 0 HIADHN Cc1ccc(C)n1-c1nc(CC(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)cs1 ZINC000555230009 942438082 /nfs/dbraw/zinc/43/80/82/942438082.db2.gz IDTGRDGREOTCHR-LJQANCHMSA-N 0 3 416.978 4.166 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@H](N[C@H]2CCN(c3ccccc3Cl)C2=O)c2ccccc21 ZINC000555232845 942438802 /nfs/dbraw/zinc/43/88/02/942438802.db2.gz NOFPDWGSGOHJRW-HOJAQTOUSA-N 0 3 412.917 4.217 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)C1CCC(OC[C@H]2CCCO2)CC1)c1ccsc1 ZINC000555297971 942466131 /nfs/dbraw/zinc/46/61/31/942466131.db2.gz CBBWHZQSMUWHRA-HXJFWZBSSA-N 0 3 408.608 4.002 20 0 HIADHN Cc1cccc(C(=O)N2CCCN(Cc3ccc(C)cc3-c3cnn(C)c3)CC2)c1 ZINC000555323547 942476970 /nfs/dbraw/zinc/47/69/70/942476970.db2.gz ZBVNWKOGAYFJEX-UHFFFAOYSA-N 0 3 402.542 4.052 20 0 HIADHN COC(=O)c1ccc(-c2nc(CNC3(Cc4ccc(F)cc4)CCOCC3)co2)cc1 ZINC000555572458 942648621 /nfs/dbraw/zinc/64/86/21/942648621.db2.gz PFDMSAXSEVHZBC-UHFFFAOYSA-N 0 3 424.472 4.149 20 0 HIADHN CC(C)(C(=O)N1CC[C@@H](N2CCCCC2)C1)c1csc(-c2ccccc2F)n1 ZINC000555951726 942778107 /nfs/dbraw/zinc/77/81/07/942778107.db2.gz CXXSJVSTARRMGK-MRXNPFEDSA-N 0 3 401.551 4.314 20 0 HIADHN COc1cnccc1[C@H](C)NC[C@@H](O)CO[C@@H](c1ccccc1)c1ccc(C)cc1 ZINC000556018220 942786598 /nfs/dbraw/zinc/78/65/98/942786598.db2.gz REURDCIUXJXZIF-SWHJIRTISA-N 0 3 406.526 4.216 20 0 HIADHN CC(C)(NC(=O)[C@H]1CCCN(Cc2cccnc2)C1)c1cccc(C(F)(F)F)c1 ZINC000556030904 942789873 /nfs/dbraw/zinc/78/98/73/942789873.db2.gz LVYRGPIPAXPHJO-KRWDZBQOSA-N 0 3 405.464 4.364 20 0 HIADHN Clc1cccc(CN2CCCC[C@@H]2CN[C@@H](c2cccs2)c2nnc[nH]2)c1 ZINC000556094475 942804777 /nfs/dbraw/zinc/80/47/77/942804777.db2.gz XZDQGBPESBZIPG-MJGOQNOKSA-N 0 3 401.967 4.253 20 0 HIADHN COc1cccc(C(=O)CCCC(=O)NC2CCN([C@H](C)c3ccccc3)CC2)c1 ZINC000556203111 942818369 /nfs/dbraw/zinc/81/83/69/942818369.db2.gz ZZMMKUFRQHLWOJ-LJQANCHMSA-N 0 3 408.542 4.390 20 0 HIADHN COc1ccc2c(c1F)CC[C@@H]2N[C@H]1CCCN([C@@H](C)c2ccccc2F)C1=O ZINC000556225710 942821479 /nfs/dbraw/zinc/82/14/79/942821479.db2.gz ZIVQFCXINMPALN-GKCIPKSASA-N 0 3 400.469 4.303 20 0 HIADHN C[C@@H](NCCCN1CCN(c2cccc(C(F)(F)F)c2)CC1)c1ccncc1F ZINC000556232592 942823820 /nfs/dbraw/zinc/82/38/20/942823820.db2.gz ASQYJCOINNHHNX-MRXNPFEDSA-N 0 3 410.459 4.102 20 0 HIADHN CC(C)NC(=O)Nc1ccc([C@H](C)N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)cc1 ZINC000556247061 942825687 /nfs/dbraw/zinc/82/56/87/942825687.db2.gz YAJCTMPNKHSBHV-OKZBNKHCSA-N 0 3 408.546 4.233 20 0 HIADHN CS[C@H]1CN(C(=O)c2ccccc2-c2ncc(-c3ccccc3)o2)C[C@H]1N(C)C ZINC000556279536 942831858 /nfs/dbraw/zinc/83/18/58/942831858.db2.gz OJRZZWYDKGAPJE-CTNGQTDRSA-N 0 3 407.539 4.126 20 0 HIADHN Cc1ccc2nc(CNC3CCN(Cc4ccc(Br)cc4)CC3)cn2c1 ZINC000556417237 942860641 /nfs/dbraw/zinc/86/06/41/942860641.db2.gz WXCMWKBKXXPRNV-UHFFFAOYSA-N 0 3 413.363 4.159 20 0 HIADHN Cc1cc(C)c(CC(C(=O)Nc2ccc3c(c2F)CCNC3=O)C(F)(F)F)c(C)c1 ZINC000556492965 942884016 /nfs/dbraw/zinc/88/40/16/942884016.db2.gz SJDWIJWNDVAROH-QGZVFWFLSA-N 0 3 422.422 4.397 20 0 HIADHN CN(C(=O)CN[C@H](c1cccc(C(F)(F)F)c1)C1CCOCC1)c1ccccc1 ZINC000556512921 942889067 /nfs/dbraw/zinc/88/90/67/942889067.db2.gz NZNDNBGNACOPLA-NRFANRHFSA-N 0 3 406.448 4.426 20 0 HIADHN CC(C)(NCC(=O)N1CCC[C@@H]1c1ccc2c(c1)OCCO2)c1ccc(Cl)cc1 ZINC000556518964 942890576 /nfs/dbraw/zinc/89/05/76/942890576.db2.gz HLILQDWNZBIPQP-LJQANCHMSA-N 0 3 414.933 4.300 20 0 HIADHN CCn1nc(C)c(CC(=O)N(CCN(C)Cc2ccccc2)Cc2ccccc2)c1C ZINC000556535654 942893748 /nfs/dbraw/zinc/89/37/48/942893748.db2.gz JCNOMKUFDIFLRE-UHFFFAOYSA-N 0 3 418.585 4.223 20 0 HIADHN CCOc1ccc([C@@H](C)NCc2cccc(N3C(=O)N[C@@](C)(C4CC4)C3=O)c2)cc1 ZINC000556611395 942915128 /nfs/dbraw/zinc/91/51/28/942915128.db2.gz OESJSDCEYAKCOB-GYCJOSAFSA-N 0 3 407.514 4.161 20 0 HIADHN O=C(c1ccn(-c2cccc(Cl)c2)n1)N1CCN(c2ccnc3ccccc32)CC1 ZINC000556833522 942937313 /nfs/dbraw/zinc/93/73/13/942937313.db2.gz VDKFRVZMHYAQCS-UHFFFAOYSA-N 0 3 417.900 4.036 20 0 HIADHN O=C(c1csc(-c2ccccc2)n1)N1CCN(c2ccnc3ccccc32)CC1 ZINC000556832293 942937717 /nfs/dbraw/zinc/93/77/17/942937717.db2.gz GKAZASBKIVSPCD-UHFFFAOYSA-N 0 3 400.507 4.321 20 0 HIADHN CC(C)(Cc1nc2ccccc2[nH]1)C(=O)N1CCN(c2ccnc3ccccc32)CC1 ZINC000556833058 942937737 /nfs/dbraw/zinc/93/77/37/942937737.db2.gz VKUUYNWXYVVOOG-UHFFFAOYSA-N 0 3 413.525 4.029 20 0 HIADHN Cc1ccc(C(=O)Nc2cccc(CNC[C@H](O)COc3cccc(C)c3)c2)cc1 ZINC000556896112 942956455 /nfs/dbraw/zinc/95/64/55/942956455.db2.gz CUZYSUIXUIISNC-QHCPKHFHSA-N 0 3 404.510 4.085 20 0 HIADHN O[C@H](CN[C@@H]1CCSc2ccc(F)cc21)COc1cccc(Br)c1 ZINC000557013958 942993814 /nfs/dbraw/zinc/99/38/14/942993814.db2.gz LXSQQGDUWFMXHW-RHSMWYFYSA-N 0 3 412.324 4.155 20 0 HIADHN O[C@H](CN[C@H]1CCSc2ccc(F)cc21)COc1ccc(Br)cc1 ZINC000557014774 942994728 /nfs/dbraw/zinc/99/47/28/942994728.db2.gz XBOYVKOYDMCKAF-PBHICJAKSA-N 0 3 412.324 4.155 20 0 HIADHN CCCN(C)[C@H](CNC(=O)Cc1c(C)nn(C(F)F)c1C)c1ccc(Cl)cc1 ZINC000557059413 943007984 /nfs/dbraw/zinc/00/79/84/943007984.db2.gz RDXZBIQIPATPTK-GOSISDBHSA-N 0 3 412.912 4.290 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)c1ccc(OC)c(OC)c1OC)c1ccc(Cl)cc1 ZINC000557061267 943009070 /nfs/dbraw/zinc/00/90/70/943009070.db2.gz VYEYXHWFLWROSD-SFHVURJKSA-N 0 3 420.937 4.179 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)c2cc3ccccc3n2CC(F)(F)F)cc1 ZINC000557207178 943051947 /nfs/dbraw/zinc/05/19/47/943051947.db2.gz ZPZIJGIMGGWYMR-GOSISDBHSA-N 0 3 419.447 4.245 20 0 HIADHN COc1ccc2c(c1)OC[C@@H](N[C@H](C)c1ccc(S(=O)(=O)C3CCCC3)cc1)C2 ZINC000557266444 943063263 /nfs/dbraw/zinc/06/32/63/943063263.db2.gz RCGNIGAHQGSPKC-APWZRJJASA-N 0 3 415.555 4.066 20 0 HIADHN CC(C)C[C@H](NCc1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1)c1cccs1 ZINC000557271820 943064228 /nfs/dbraw/zinc/06/42/28/943064228.db2.gz FLQBIUPIMPASJY-QUCCMNQESA-N 0 3 422.616 4.082 20 0 HIADHN CCCN(C)[C@H](CNC(=O)c1c(C)nn2c1nc(C)cc2C)c1ccc(Cl)cc1 ZINC000557336826 943076896 /nfs/dbraw/zinc/07/68/96/943076896.db2.gz QXCMOUYXFHGUMW-LJQANCHMSA-N 0 3 413.953 4.121 20 0 HIADHN CN(C)CCN(C[C@@H]1CCCO1)C(=O)c1ccc(-c2ccc(Cl)cc2)cc1F ZINC000557359126 943085829 /nfs/dbraw/zinc/08/58/29/943085829.db2.gz YCUHBGNNJYOKTL-IBGZPJMESA-N 0 3 404.913 4.329 20 0 HIADHN O=C(COc1ccccc1)N(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000557447689 943132217 /nfs/dbraw/zinc/13/22/17/943132217.db2.gz CNDNWZNCIJFYLI-DEOSSOPVSA-N 0 3 415.537 4.154 20 0 HIADHN O=C(Cc1ccc(O)cc1)N(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000557449346 943133542 /nfs/dbraw/zinc/13/35/42/943133542.db2.gz VMBZJEKMUPXRBE-DEOSSOPVSA-N 0 3 415.537 4.023 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)c1cnoc1-c1ccc(F)cc1Cl ZINC000557464675 943145700 /nfs/dbraw/zinc/14/57/00/943145700.db2.gz ZSCJJKYWMLGRHY-UHFFFAOYSA-N 0 3 413.880 4.312 20 0 HIADHN Cc1ccncc1CCCNc1ccccc1N1CCN(CCc2ccncc2)CC1 ZINC000557520357 943187996 /nfs/dbraw/zinc/18/79/96/943187996.db2.gz AUGKPCNOVDQJHG-UHFFFAOYSA-N 0 3 415.585 4.194 20 0 HIADHN O=C(c1occc1-c1ccc(F)cc1)N1CCC[C@@H](c2n[nH]cc2CN2CCCC2)C1 ZINC000557645941 943246964 /nfs/dbraw/zinc/24/69/64/943246964.db2.gz CONBYLXPPCGMPL-GOSISDBHSA-N 0 3 422.504 4.424 20 0 HIADHN COC(=O)c1ccc(CNC(=O)[C@H](C)N[C@@H](c2ccc(Cl)cc2)C(C)C)cc1 ZINC000557655099 943249486 /nfs/dbraw/zinc/24/94/86/943249486.db2.gz XAXDWVMUYXLIRK-MGPUTAFESA-N 0 3 402.922 4.118 20 0 HIADHN C[C@@H]1CCN(C(=O)c2ccnc(-c3ccccc3)c2N)CCN1Cc1ccccc1 ZINC000557727182 943270569 /nfs/dbraw/zinc/27/05/69/943270569.db2.gz BCAIABUPMRAFFU-LJQANCHMSA-N 0 3 400.526 4.067 20 0 HIADHN C[C@H]1C[C@H](N(C)S(=O)(=O)c2ccc(C(F)F)cc2)CCN1Cc1ccccc1 ZINC000557824742 943305268 /nfs/dbraw/zinc/30/52/68/943305268.db2.gz LBVDYYXPRMEDOQ-QFBILLFUSA-N 0 3 408.514 4.298 20 0 HIADHN O[C@@H](CNCc1cn(-c2ccccc2)nc1-c1cccc(Br)c1)C(F)F ZINC000557838437 943308890 /nfs/dbraw/zinc/30/88/90/943308890.db2.gz JTRLNCMQARFKEZ-KRWDZBQOSA-N 0 3 422.273 4.017 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)[C@@H](C)Oc1cccc(Br)c1)c1ccco1 ZINC000557911281 943326713 /nfs/dbraw/zinc/32/67/13/943326713.db2.gz DNPIBHQGDWEIPE-JJRVBVJISA-N 0 3 409.324 4.055 20 0 HIADHN CSc1ccc2ncnc(N3CCC(CCN4C[C@@H](C)O[C@@H](C)C4)CC3)c2c1 ZINC000558017568 943356986 /nfs/dbraw/zinc/35/69/86/943356986.db2.gz ZQYDUPMVBZVXND-CALCHBBNSA-N 0 3 400.592 4.067 20 0 HIADHN Cc1cccc(C(=O)N2CCN([C@@H]3C[C@H]3C)C[C@@H](C)C2)c1NC(=O)c1ccccc1F ZINC000558026342 943359543 /nfs/dbraw/zinc/35/95/43/943359543.db2.gz WMEHHIUIAGIYDY-RADWXHQJSA-N 0 3 423.532 4.189 20 0 HIADHN CCc1onc(-c2ccccc2Cl)c1C(=O)N1CCN([C@@H]2C[C@@H]2C)C[C@H](C)C1 ZINC000558027639 943360662 /nfs/dbraw/zinc/36/06/62/943360662.db2.gz RKCAMMYJXJVZED-RLFYNMQTSA-N 0 3 401.938 4.360 20 0 HIADHN CSCC[C@@H](N)C(=O)N(C)Cc1cn(-c2ccccc2)nc1-c1ccc(C)c(C)c1 ZINC000558164656 943405098 /nfs/dbraw/zinc/40/50/98/943405098.db2.gz XKYPPEQBXQYDBW-JOCHJYFZSA-N 0 3 422.598 4.195 20 0 HIADHN CN(CC(=O)Nc1cc2c(cc1Cl)OCCCO2)[C@H]1CC[C@@H](C(F)(F)F)CC1 ZINC000558184177 943418258 /nfs/dbraw/zinc/41/82/58/943418258.db2.gz YEZBAHTZPWLYAH-BETUJISGSA-N 0 3 420.859 4.493 20 0 HIADHN CC[C@H](N[C@H]1CCN(Cc2ccc(OC)cc2OC)C1=O)c1cccc(Cl)c1 ZINC000558240090 943453620 /nfs/dbraw/zinc/45/36/20/943453620.db2.gz ABQOMKPFENPFDK-PMACEKPBSA-N 0 3 402.922 4.199 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1cccc(OC[C@H]2CCCO2)c1)c1ccco1 ZINC000558277050 943477618 /nfs/dbraw/zinc/47/76/18/943477618.db2.gz JLCDMEMKMWDTTK-DBVUQKKJSA-N 0 3 401.507 4.088 20 0 HIADHN Cc1ccc(NC(=O)N[C@H](CN(C)C)c2ccc(F)cc2)c(-c2nc(C3CC3)no2)c1 ZINC000558351533 943521540 /nfs/dbraw/zinc/52/15/40/943521540.db2.gz DJUHOXBMNHCUBT-HXUWFJFHSA-N 0 3 423.492 4.486 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCC(C)(C)c1ncccc1C)c1cccc(OC)c1 ZINC000558608593 943616982 /nfs/dbraw/zinc/61/69/82/943616982.db2.gz STFJAEDOFYMBPS-OAQYLSRUSA-N 0 3 412.578 4.059 20 0 HIADHN O=C(Nc1cc(CC2CC2)nn1-c1ccccc1)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000558618813 943619391 /nfs/dbraw/zinc/61/93/91/943619391.db2.gz HEBMAXHXHXYIIM-OAQYLSRUSA-N 0 3 415.541 4.071 20 0 HIADHN CCNC(=O)c1ccc(CNC[C@H](O)COc2cc(C)c(Cl)cc2C(C)C)cc1 ZINC000558750499 943642763 /nfs/dbraw/zinc/64/27/63/943642763.db2.gz GNRIZTNBBMKFKJ-IBGZPJMESA-N 0 3 418.965 4.051 20 0 HIADHN CC(C)C(=O)c1ccc([C@H](C)C(=O)NCC2(N3CCSCC3)CCCC2)cc1 ZINC000558760430 943649691 /nfs/dbraw/zinc/64/96/91/943649691.db2.gz VMROJDKZQOTBED-SFHVURJKSA-N 0 3 402.604 4.107 20 0 HIADHN COCCOc1cc(C)ccc1NC(=O)N[C@H](CN(C)C)c1ccc(Cl)cc1 ZINC000558771016 943655089 /nfs/dbraw/zinc/65/50/89/943655089.db2.gz VUEJVIFKEJFCSD-LJQANCHMSA-N 0 3 405.926 4.098 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2ccc3nnc(C(C)C)n3c2)N2CCCC2)cc1 ZINC000558801771 943669151 /nfs/dbraw/zinc/66/91/51/943669151.db2.gz GRVKRJFWQQTMLH-FQEVSTJZSA-N 0 3 406.534 4.120 20 0 HIADHN Fc1cc(CN(Cc2ccc(-n3cncn3)cc2)C2CC2)ccc1Br ZINC000558861236 943704682 /nfs/dbraw/zinc/70/46/82/943704682.db2.gz HQKIVHDIGUEMGH-UHFFFAOYSA-N 0 3 401.283 4.334 20 0 HIADHN COc1cccc([C@@H]2[C@H](N[C@@H](C)C(=O)Nc3ccc(C)c(C)c3)CCN2C2CC2)c1 ZINC000558894684 943727305 /nfs/dbraw/zinc/72/73/05/943727305.db2.gz IWFMWDZIWNSXMP-NTUVXCKYSA-N 0 3 407.558 4.207 20 0 HIADHN CCN1CC[C@H](N[C@@H](C)C(=O)Nc2cc(F)ccc2C)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000558898423 943732203 /nfs/dbraw/zinc/73/22/03/943732203.db2.gz SYXIRAJAWNCLIX-FPSMJMQUSA-N 0 3 423.454 4.304 20 0 HIADHN Cc1ccccc1CN(C)C(=O)CN[C@H]1CCN(C(C)C)[C@@H]1c1ccc(F)c(F)c1 ZINC000558899972 943735804 /nfs/dbraw/zinc/73/58/04/943735804.db2.gz ZIISRIQPHWRLQE-LADGPHEKSA-N 0 3 415.528 4.045 20 0 HIADHN CCN1CC[C@@H](NCC(=O)Nc2c(C)cc(C)cc2C)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000558902496 943736430 /nfs/dbraw/zinc/73/64/30/943736430.db2.gz ZGUHHVOJWXFEOO-AUSIDOKSSA-N 0 3 419.491 4.393 20 0 HIADHN COc1ccc([C@H](OC)[C@@H](C)NC(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)cc1 ZINC000558908457 943740930 /nfs/dbraw/zinc/74/09/30/943740930.db2.gz SXZLXUFFDSKESB-IPHXSNPTSA-N 0 3 419.953 4.027 20 0 HIADHN CN(C)C[C@@H](NC(=O)NC[C@@H]1CCCN(c2ccccc2)C1)c1ccc(Cl)cc1 ZINC000558950446 943768973 /nfs/dbraw/zinc/76/89/73/943768973.db2.gz OQQOESXXNFXAOJ-PGRDOPGGSA-N 0 3 414.981 4.159 20 0 HIADHN COCCO[C@@H]1CCCN(Cc2cn(Cc3ccccc3)nc2-c2ccccc2)C1 ZINC000559073063 943825220 /nfs/dbraw/zinc/82/52/20/943825220.db2.gz VUBXZCFIWJNDFY-XMMPIXPASA-N 0 3 405.542 4.226 20 0 HIADHN Cc1nc2ccccc2n1C1CCN([C@@H]2CCN([C@@H](C)c3ccc(F)cc3)C2=O)CC1 ZINC000559185837 943865204 /nfs/dbraw/zinc/86/52/04/943865204.db2.gz HBHZBGACNVIJEZ-BXKMTCNYSA-N 0 3 420.532 4.483 20 0 HIADHN Cc1ccc([C@@H](CNCc2c(Cl)cccc2N2CCOCC2)N2CCCC2)o1 ZINC000559260274 943886725 /nfs/dbraw/zinc/88/67/25/943886725.db2.gz WGRQPUWYUKRENQ-OAQYLSRUSA-N 0 3 403.954 4.005 20 0 HIADHN O=c1[nH]c(CNC2(Cc3ccc(F)cc3)CCOCC2)nc2cc(Cl)ccc12 ZINC000559289798 943891129 /nfs/dbraw/zinc/89/11/29/943891129.db2.gz NSEDOXVWOKQQOV-UHFFFAOYSA-N 0 3 401.869 4.009 20 0 HIADHN CCO[C@@H]1C[C@H](NCc2cccc(NC(=O)c3ccc(Cl)cc3)c2)[C@@H]1n1cccn1 ZINC000559365045 943913115 /nfs/dbraw/zinc/91/31/15/943913115.db2.gz OOQROHHOXKWGAC-BDTNDASRSA-N 0 3 424.932 4.297 20 0 HIADHN CC(=O)Nc1ccc(OC[C@@H](O)CN2CCc3ccccc3[C@@H]2c2ccccc2)cc1 ZINC000559368342 943914497 /nfs/dbraw/zinc/91/44/97/943914497.db2.gz BAPNEETZPAROET-OZXSUGGESA-N 0 3 416.521 4.032 20 0 HIADHN COc1ccc(CNC[C@H](O)COc2cc(C)c(Cl)cc2C(C)C)cc1OC ZINC000559581280 944010751 /nfs/dbraw/zinc/01/07/51/944010751.db2.gz HACJGHVJWLMGHU-KRWDZBQOSA-N 0 3 407.938 4.319 20 0 HIADHN COc1cccc(-c2ccc(CN[C@@H]3CCCc4cc(S(N)(=O)=O)ccc43)cc2)c1 ZINC000559766622 944047277 /nfs/dbraw/zinc/04/72/77/944047277.db2.gz KIVOMPGPQBTJBR-XMMPIXPASA-N 0 3 422.550 4.177 20 0 HIADHN C[C@H](NCc1nnc(-c2ccccc2Cl)o1)C1CCN(CC(F)(F)F)CC1 ZINC000559778533 944049175 /nfs/dbraw/zinc/04/91/75/944049175.db2.gz VUQSDHODANQZAT-LBPRGKRZSA-N 0 3 402.848 4.142 20 0 HIADHN Cc1ccc(NC(=O)[C@H](C)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)c(Br)c1 ZINC000559793090 944050785 /nfs/dbraw/zinc/05/07/85/944050785.db2.gz IPFZAOBNNULMPO-CWFSZBLJSA-N 0 3 416.363 4.120 20 0 HIADHN CN1CC[C@@H](NCC(=O)Nc2c(Cl)cccc2Cl)[C@@H]1c1ccc(F)c(F)c1 ZINC000559793006 944051761 /nfs/dbraw/zinc/05/17/61/944051761.db2.gz JDEMHABCQQYMDG-APWZRJJASA-N 0 3 414.283 4.245 20 0 HIADHN O=C(N[C@@H]1CCN(Cc2ccccc2)C1)NC1(c2cccc(C(F)(F)F)c2)CC1 ZINC000559828730 944062453 /nfs/dbraw/zinc/06/24/53/944062453.db2.gz HTSMFYICKSLNFB-LJQANCHMSA-N 0 3 403.448 4.268 20 0 HIADHN C[C@H](N[C@@H](C)c1cc[nH]c(=O)c1)c1cccc(S(=O)(=O)NC2CCCCCC2)c1 ZINC000559878811 944072654 /nfs/dbraw/zinc/07/26/54/944072654.db2.gz RDONPPWCXOJVBJ-IRXDYDNUSA-N 0 3 417.575 4.200 20 0 HIADHN Cc1ccc(C=Cc2nc(SC[C@H]3CN(Cc4ccccc4)CCCO3)n[nH]2)o1 ZINC000559976578 944106658 /nfs/dbraw/zinc/10/66/58/944106658.db2.gz CMWKCDGOVZGKNL-JPMGXVIASA-N 0 3 410.543 4.260 20 0 HIADHN COC(=O)CC[C@@H](NCc1cccc(I)c1)c1ccccc1 ZINC000560048593 944141026 /nfs/dbraw/zinc/14/10/26/944141026.db2.gz MWTZEKAXADAYHN-QGZVFWFLSA-N 0 3 409.267 4.075 20 0 HIADHN Cc1c(Br)cc(CN[C@@H]2CCCc3c2cnn3C)cc1Br ZINC000560061116 944144952 /nfs/dbraw/zinc/14/49/52/944144952.db2.gz XVCDFIOXSRFEFH-OAHLLOKOSA-N 0 3 413.157 4.421 20 0 HIADHN C[C@@H]1C[C@H](C)CN(C(=O)CN[C@H](c2cccc(C(F)(F)F)c2)C2CCOCC2)C1 ZINC000560179755 944188369 /nfs/dbraw/zinc/18/83/69/944188369.db2.gz UEEPANDIQXASKW-MRUHUIDDSA-N 0 3 412.496 4.267 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3cc(Cl)c(F)cc3Cl)CC2)C[C@@H](C)O1 ZINC000560207516 944197348 /nfs/dbraw/zinc/19/73/48/944197348.db2.gz QLGGKEOKEHQNIT-ZIAGYGMSSA-N 0 3 417.352 4.484 20 0 HIADHN COc1ccc([C@H](CN(C)C)N[C@H]2CCc3c2cc(Br)cc3F)cc1 ZINC000560261520 944210354 /nfs/dbraw/zinc/21/03/54/944210354.db2.gz ZJNSMXWPZGFDSP-PMACEKPBSA-N 0 3 407.327 4.477 20 0 HIADHN Cc1c([C@H](C)N[C@@H](CO)C[C@@H](O)C(C)(C)C)cnn1-c1ccc(Cl)cc1Cl ZINC000560267439 944213571 /nfs/dbraw/zinc/21/35/71/944213571.db2.gz CRHGXOSCHHLKQC-IOHHAYIISA-N 0 3 414.377 4.296 20 0 HIADHN CCOc1cc2c(cc1CNC[C@H](O)CO[C@@H](C)c1ccc(Cl)cc1)O[C@@H](C)C2 ZINC000560315318 944225484 /nfs/dbraw/zinc/22/54/84/944225484.db2.gz WHBUZMLTGWAHBG-QYWGDWMGSA-N 0 3 419.949 4.290 20 0 HIADHN Cc1ccc(C(=O)C2CCN(CCCN3CCN(c4ccccc4)CC3)CC2)c(C)c1 ZINC000560466276 944235110 /nfs/dbraw/zinc/23/51/10/944235110.db2.gz WWMINEJXBIGQQF-UHFFFAOYSA-N 0 3 419.613 4.410 20 0 HIADHN CCOc1c(Br)cc(CN(CCO)[C@@H]2CCc3ccccc32)cc1OC ZINC000560523989 944241433 /nfs/dbraw/zinc/24/14/33/944241433.db2.gz KYVOGXTYXYXBND-LJQANCHMSA-N 0 3 420.347 4.338 20 0 HIADHN OCC1([C@@H](NCc2cccc(I)c2)c2ccccc2)CCC1 ZINC000560569788 944257833 /nfs/dbraw/zinc/25/78/33/944257833.db2.gz RFUGJXHJYVRPND-SFHVURJKSA-N 0 3 407.295 4.285 20 0 HIADHN CN(CCCN(C)C(=O)[C@@H]1C[C@@H]1c1ccccc1OC(F)(F)F)Cc1ccncc1 ZINC000560596298 944268448 /nfs/dbraw/zinc/26/84/48/944268448.db2.gz MSBXHNWPCGMULD-RTBURBONSA-N 0 3 421.463 4.064 20 0 HIADHN CCCN(C)[C@H](CNC(=O)c1ccc(-n2cncn2)cc1C)c1ccc(Cl)cc1 ZINC000560975008 944381918 /nfs/dbraw/zinc/38/19/18/944381918.db2.gz LNBYDGFADYECKT-OAQYLSRUSA-N 0 3 411.937 4.042 20 0 HIADHN Brc1cc2cccnc2c(CN2CCC[C@H](c3nncn3C3CC3)C2)c1 ZINC000561060077 944421326 /nfs/dbraw/zinc/42/13/26/944421326.db2.gz ISTXKYDOMIJVAX-HNNXBMFYSA-N 0 3 412.335 4.303 20 0 HIADHN CCCN(CCN1CCCC1)C(=O)c1cc(OCC(F)(F)F)c2ccccc2n1 ZINC000561192798 944508031 /nfs/dbraw/zinc/50/80/31/944508031.db2.gz WBHVRPBVNGTPQQ-UHFFFAOYSA-N 0 3 409.452 4.124 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)CCc1ncc(-c2ccc(F)cc2F)o1 ZINC000561267306 944534718 /nfs/dbraw/zinc/53/47/18/944534718.db2.gz BXMWZQKHKXHPMG-UHFFFAOYSA-N 0 3 405.489 4.277 20 0 HIADHN CCS(=O)(=O)c1ccc([C@H](C)N[C@@H](C)CC(=O)Nc2cccc(C)c2C)cc1 ZINC000561297695 944542640 /nfs/dbraw/zinc/54/26/40/944542640.db2.gz IFTRLYQFCJYAKL-WMZOPIPTSA-N 0 3 402.560 4.165 20 0 HIADHN COC(=O)c1c(F)ccc(NC(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)c1C ZINC000561403280 944581336 /nfs/dbraw/zinc/58/13/36/944581336.db2.gz OCRHJJVHOKMRLY-INIZCTEOSA-N 0 3 413.493 4.049 20 0 HIADHN COc1ccc([C@H](C)NCCCC(=O)N2Cc3ccccc3C2)c(Br)c1 ZINC000561480069 944624276 /nfs/dbraw/zinc/62/42/76/944624276.db2.gz RKPXXXGFZSZRTR-HNNXBMFYSA-N 0 3 417.347 4.431 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)CCc1ccc(Br)cc1OC)c1ccco1 ZINC000561609989 944705376 /nfs/dbraw/zinc/70/53/76/944705376.db2.gz GNQLIZBRNCRUDY-WMLDXEAASA-N 0 3 423.351 4.229 20 0 HIADHN Cc1noc2nc(C3CC3)cc(C(=O)NC[C@@H](c3ccc(OC(C)C)cc3)N(C)C)c12 ZINC000561657875 944733153 /nfs/dbraw/zinc/73/31/53/944733153.db2.gz QZVVMWFJVSOLPH-NRFANRHFSA-N 0 3 422.529 4.229 20 0 HIADHN CCOc1cccc2[nH]cc(CC(=O)NC[C@H](c3ccc(OC(C)C)cc3)N(C)C)c21 ZINC000561676904 944741806 /nfs/dbraw/zinc/74/18/06/944741806.db2.gz FZHAWCFSAHTZMT-JOCHJYFZSA-N 0 3 423.557 4.315 20 0 HIADHN COc1cc(C2(C(=O)N(C)CCCN(C)Cc3ccncc3)CCCC2)ccc1C ZINC000561709352 944756110 /nfs/dbraw/zinc/75/61/10/944756110.db2.gz JALBGAOBNGWYRV-UHFFFAOYSA-N 0 3 409.574 4.191 20 0 HIADHN C[C@@H](Cc1ccccc1C(F)(F)F)N(C)C(=O)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000561740857 944773210 /nfs/dbraw/zinc/77/32/10/944773210.db2.gz PCSVOIIWBYAQQC-FXAWDEMLSA-N 0 3 419.491 4.402 20 0 HIADHN Cc1nn(Cc2ccccc2)c2sc(C(=O)N3CC[C@H](N4CCCC4)[C@@H]3C)cc12 ZINC000561749579 944778163 /nfs/dbraw/zinc/77/81/63/944778163.db2.gz VDOSQXBLUULQNM-PXNSSMCTSA-N 0 3 408.571 4.153 20 0 HIADHN CN(C(=O)c1cc(-c2ccc(F)cc2)nc2onc(C3CC3)c21)[C@H]1CCN(C2CC2)C1 ZINC000561862636 944825415 /nfs/dbraw/zinc/82/54/15/944825415.db2.gz JIQFNUHPRBJSAV-SFHVURJKSA-N 0 3 420.488 4.215 20 0 HIADHN O=C([C@H]1CCCN(Cc2cccnc2)C1)N1CC[C@@H](Sc2cccc(Cl)c2)C1 ZINC000561888113 944838430 /nfs/dbraw/zinc/83/84/30/944838430.db2.gz ORUXIALLVJPLBL-GHTZIAJQSA-N 0 3 415.990 4.340 20 0 HIADHN CC(C)(NC(=O)c1ccccc1)c1noc(C2CCN(Cc3ccccc3)CC2)n1 ZINC000561926672 944859834 /nfs/dbraw/zinc/85/98/34/944859834.db2.gz BFBXJWSAMAAQAL-UHFFFAOYSA-N 0 3 404.514 4.114 20 0 HIADHN COc1ccc2ccccc2c1-c1cc(CN2CCC[C@@H](CCNC(C)=O)C2)on1 ZINC000561928756 944861493 /nfs/dbraw/zinc/86/14/93/944861493.db2.gz QDKIOMTUAOURKX-SFHVURJKSA-N 0 3 407.514 4.242 20 0 HIADHN CN1CC[C@H](NCC(=O)N(Cc2ccccc2)C(C)(C)C)[C@@H]1c1ccc(F)c(F)c1 ZINC000562045969 944909950 /nfs/dbraw/zinc/90/99/50/944909950.db2.gz FOFCVRGECRCTQM-GMAHTHKFSA-N 0 3 415.528 4.127 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)[C@H](C)N[C@H]1CCN(C)[C@H]1c1ccc(Cl)cc1 ZINC000562050195 944912395 /nfs/dbraw/zinc/91/23/95/944912395.db2.gz NYGPHXJBFDIJCY-ROOHIHILSA-N 0 3 422.356 4.364 20 0 HIADHN C[C@H]1CCCN(CCNC(=O)C(C)(C)c2csc(-c3cc(F)ccc3F)n2)C1 ZINC000562070843 944921934 /nfs/dbraw/zinc/92/19/34/944921934.db2.gz RVXLGQAHSAKZOD-AWEZNQCLSA-N 0 3 407.530 4.214 20 0 HIADHN O=C1[C@@H](N[C@H]2c3ccccc3CC23CCOCC3)CCN1c1ccc(Cl)c(F)c1 ZINC000562071098 944922182 /nfs/dbraw/zinc/92/21/82/944922182.db2.gz UHPJSCLJYIOVPO-SFTDATJTSA-N 0 3 414.908 4.268 20 0 HIADHN CC(C)(C)[C@@H]1NC(=O)CC[C@H]1NCc1cc(C(F)(F)F)ccc1Br ZINC000562073336 944923345 /nfs/dbraw/zinc/92/33/45/944923345.db2.gz CLPJFPIKYCTMRE-UKRRQHHQSA-N 0 3 407.274 4.251 20 0 HIADHN Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)N[C@H](C)[C@H](c1ccccc1)N(C)C ZINC000562141809 944969258 /nfs/dbraw/zinc/96/92/58/944969258.db2.gz GHPLZHWYGXDFOC-XMSQKQJNSA-N 0 3 408.546 4.044 20 0 HIADHN C[C@@H](NC(=O)Nc1ccc(CCC(=O)N2CCCC2)cc1)[C@H](c1ccccc1)N(C)C ZINC000562152941 944981438 /nfs/dbraw/zinc/98/14/38/944981438.db2.gz AQNUPUVCMXMAKT-NTKDMRAZSA-N 0 3 422.573 4.055 20 0 HIADHN C[C@H](NC(=O)Nc1cc(F)ccc1OC[C@@H]1CCCO1)[C@@H](c1ccccc1)N(C)C ZINC000562161876 944989932 /nfs/dbraw/zinc/98/99/32/944989932.db2.gz GEYZDGZZSRFOQE-BPXKWBHBSA-N 0 3 415.509 4.196 20 0 HIADHN C[C@H](NC(=O)Nc1cc(F)ccc1OC[C@H]1CCCO1)[C@@H](c1ccccc1)N(C)C ZINC000562161878 944990025 /nfs/dbraw/zinc/99/00/25/944990025.db2.gz GEYZDGZZSRFOQE-NBCNXNJRSA-N 0 3 415.509 4.196 20 0 HIADHN CC(C)Cc1ccc([C@H](CNC(=O)Nc2ccc3c(c2)CCC(=O)N3C)N(C)C)cc1 ZINC000562168159 944995788 /nfs/dbraw/zinc/99/57/88/944995788.db2.gz HCOIIMNBTGJRCX-QHCPKHFHSA-N 0 3 422.573 4.219 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)Nc1ccc(OC)c(Br)c1)c1ccco1 ZINC000562169182 944999646 /nfs/dbraw/zinc/99/96/46/944999646.db2.gz QNTJARXHEWBMQG-DOMZBBRYSA-N 0 3 410.312 4.302 20 0 HIADHN C[C@H](N[C@@H]1CCN(C)[C@H]1c1ccc(Cl)c(F)c1)C(=O)Nc1ccccc1Cl ZINC000564069896 945370294 /nfs/dbraw/zinc/37/02/94/945370294.db2.gz KKGVNRUCNVSGSH-RQUSPXKASA-N 0 3 410.320 4.495 20 0 HIADHN CCCN(C)[C@H](CNC(=O)NCCc1c[nH]c2ncccc12)c1ccc(Cl)cc1 ZINC000564114236 945383463 /nfs/dbraw/zinc/38/34/63/945383463.db2.gz XTIYDRKJEOMMPF-HXUWFJFHSA-N 0 3 413.953 4.141 20 0 HIADHN CCOC(=O)c1ccn(-c2cccc(CNCc3csc(Br)c3)c2)n1 ZINC000564320660 945513940 /nfs/dbraw/zinc/51/39/40/945513940.db2.gz KPXLTHGSGHCQFO-UHFFFAOYSA-N 0 3 420.332 4.163 20 0 HIADHN Cc1c(C(=O)N[C@@H](CN(C)C)c2ccc(F)cc2)cnn1-c1ccc(Cl)cc1 ZINC000564360666 945527979 /nfs/dbraw/zinc/52/79/79/945527979.db2.gz AXYCUSWNAKRSBU-FQEVSTJZSA-N 0 3 400.885 4.006 20 0 HIADHN C[C@H](N[C@H]1CCN(C)[C@H]1c1ccc(Cl)c(F)c1)C(=O)Nc1ccc(F)cc1F ZINC000564400082 945555572 /nfs/dbraw/zinc/55/55/72/945555572.db2.gz XHQFJVCDRHPXOI-BKOMCJNNSA-N 0 3 411.855 4.119 20 0 HIADHN O=C(CN[C@@H]1c2ccccc2CC12CCOCC2)NCC1(c2ccccc2)CCCC1 ZINC000564411531 945562329 /nfs/dbraw/zinc/56/23/29/945562329.db2.gz UMIZRCSKUVDYES-RUZDIDTESA-N 0 3 418.581 4.298 20 0 HIADHN C[C@@H](CC(=O)N(Cc1ccccc1Br)C1CCN(C)CC1)n1cccc1 ZINC000564591326 945691403 /nfs/dbraw/zinc/69/14/03/945691403.db2.gz UKNMTPBEONBCGX-KRWDZBQOSA-N 0 3 418.379 4.325 20 0 HIADHN CCN(C[C@H]1CCCN1CC)C(=O)c1sc(COc2ccc(F)cc2)nc1C ZINC000564700341 945737665 /nfs/dbraw/zinc/73/76/65/945737665.db2.gz ZJPBDTKCFPMIIV-QGZVFWFLSA-N 0 3 405.539 4.116 20 0 HIADHN CC[C@H](N[C@H](C)c1ccc(-n2cccn2)c(F)c1)c1ccccc1OCC(=O)N(C)C ZINC000564743626 945745308 /nfs/dbraw/zinc/74/53/08/945745308.db2.gz XTMKADAEGYUQSQ-UTKZUKDTSA-N 0 3 424.520 4.280 20 0 HIADHN CCC(CC)Nc1ccncc1NC(=O)C1CCN(c2nc3ccccc3o2)CC1 ZINC000564758981 945751017 /nfs/dbraw/zinc/75/10/17/945751017.db2.gz TUUACUQLEKODHV-UHFFFAOYSA-N 0 3 407.518 4.100 20 0 HIADHN Cc1onc(-c2ccccc2)c1C(=O)NC[C@@H](c1ccc(OC(C)C)cc1)N(C)C ZINC000565323404 945810238 /nfs/dbraw/zinc/81/02/38/945810238.db2.gz HKHWGYOSKSCSCZ-NRFANRHFSA-N 0 3 407.514 4.470 20 0 HIADHN CS[C@@H](C)CCC(=O)N(Cc1ccccc1Br)C1CCN(C)CC1 ZINC000565335745 945815534 /nfs/dbraw/zinc/81/55/34/945815534.db2.gz HMWLHUJSQBKEJS-HNNXBMFYSA-N 0 3 413.425 4.404 20 0 HIADHN CS[C@H](C)CCC(=O)N(Cc1ccccc1Br)C1CCN(C)CC1 ZINC000565335748 945815604 /nfs/dbraw/zinc/81/56/04/945815604.db2.gz HMWLHUJSQBKEJS-OAHLLOKOSA-N 0 3 413.425 4.404 20 0 HIADHN C[C@H](CCN1CCCN(S(=O)(=O)c2cccc3cnccc32)CC1)c1ccccc1 ZINC000565389339 945822529 /nfs/dbraw/zinc/82/25/29/945822529.db2.gz CNAKHSJHZPPBQO-HXUWFJFHSA-N 0 3 423.582 4.125 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)c1cc(NC(C)=O)cc(C(F)(F)F)c1)c1ccco1 ZINC000565500123 945839904 /nfs/dbraw/zinc/83/99/04/945839904.db2.gz GBQXNMYGTKZDLP-YVEFUNNKSA-N 0 3 411.424 4.116 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)NCCc1cccc2cccnc21 ZINC000565570083 945851028 /nfs/dbraw/zinc/85/10/28/945851028.db2.gz SGYLACDONOZLIZ-HXUWFJFHSA-N 0 3 402.542 4.083 20 0 HIADHN C[C@@H]1C[C@@H]1N1CCN(C(=O)c2ccc3c(c2)nc(Cc2cccs2)n3C)C[C@@H](C)C1 ZINC000565617098 945855901 /nfs/dbraw/zinc/85/59/01/945855901.db2.gz NEQNTLFPIWXTEG-JKSBSHDWSA-N 0 3 422.598 4.028 20 0 HIADHN Cc1ccc(NC(=O)[C@H](C)N[C@@H]2CCN(C)[C@@H]2c2ccc(Cl)c(F)c2)c(C)c1 ZINC000565743703 945878087 /nfs/dbraw/zinc/87/80/87/945878087.db2.gz NJUYWSMMUWUCCE-IWMITWMQSA-N 0 3 403.929 4.458 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Cc1coc(-c2ccc(Cl)cc2)n1)c1ccco1 ZINC000565826841 945891016 /nfs/dbraw/zinc/89/10/16/945891016.db2.gz TVYGVEKHGQGCEC-KBXCAEBGSA-N 0 3 401.894 4.376 20 0 HIADHN COc1ccc([C@H](Cc2ccccc2)NCC(=O)Nc2cccc(NC(C)=O)c2)cc1 ZINC000565863479 945898726 /nfs/dbraw/zinc/89/87/26/945898726.db2.gz ZZQBRWMELWQHHC-DEOSSOPVSA-N 0 3 417.509 4.166 20 0 HIADHN FC(F)(F)c1cscc1CN1CCC[C@H](CN2CCN(c3ccccn3)CC2)C1 ZINC000565922617 945927248 /nfs/dbraw/zinc/92/72/48/945927248.db2.gz LISXHUYXORRHDH-QGZVFWFLSA-N 0 3 424.536 4.196 20 0 HIADHN NS(=O)(=O)c1ccc2c(c1)[C@@H](NCc1ccc(COc3ccccc3)cc1)CCC2 ZINC000565979670 945958857 /nfs/dbraw/zinc/95/88/57/945958857.db2.gz ZCCAXLKGZJUUOX-DEOSSOPVSA-N 0 3 422.550 4.080 20 0 HIADHN COc1cccc([C@H]2[C@@H](NCc3nc4sc(C)c(C)c4c(=O)[nH]3)CCN2C2CC2)c1 ZINC000566022118 945974369 /nfs/dbraw/zinc/97/43/69/945974369.db2.gz SLJHRXDCEZXLOB-RXVVDRJESA-N 0 3 424.570 4.090 20 0 HIADHN C[C@H]1[C@H](NC(=O)c2cccc(OCc3cscn3)c2)CCN1Cc1ccccc1 ZINC000566390389 946018648 /nfs/dbraw/zinc/01/86/48/946018648.db2.gz RNVOJIJJMMXDDG-HTAPYJJXSA-N 0 3 407.539 4.115 20 0 HIADHN C[C@@H]1[C@H](NC(=O)C2(c3cccc(Cl)c3)CCOCC2)CCN1Cc1ccccc1 ZINC000566580743 946044623 /nfs/dbraw/zinc/04/46/23/946044623.db2.gz CCZYGIMGAZVSQF-XMSQKQJNSA-N 0 3 412.961 4.167 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)c1ccc(C)c(NC(=O)c2ccco2)c1)c1ccco1 ZINC000566758018 946090176 /nfs/dbraw/zinc/09/01/76/946090176.db2.gz YXHDBIBBKIEQLK-VQIMIIECSA-N 0 3 409.486 4.293 20 0 HIADHN CCCN(CC)C[C@@H](C)N[C@@H](c1cccc(S(C)(=O)=O)c1)c1ccc(F)c(F)c1 ZINC000566767211 946095466 /nfs/dbraw/zinc/09/54/66/946095466.db2.gz AXRSGNKODOTHCL-ZHRRBRCNSA-N 0 3 424.557 4.168 20 0 HIADHN COc1ccc([C@@H](Cc2ccccc2)N[C@H]2CCCN(CC(F)(F)F)C2=O)cc1 ZINC000567003182 946212871 /nfs/dbraw/zinc/21/28/71/946212871.db2.gz VTXDZEKKXATBNP-VQTJNVASSA-N 0 3 406.448 4.122 20 0 HIADHN CC[C@@H]1CN(Cc2cc(Cl)c(OCC(N)=O)c(OC)c2)CC[C@@H]1c1ccccc1 ZINC000567068892 946231582 /nfs/dbraw/zinc/23/15/82/946231582.db2.gz APSVIVZUWPMMQR-MJGOQNOKSA-N 0 3 416.949 4.228 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)N1CCC(F)(c2cccnc2)CC1 ZINC000567620779 946383985 /nfs/dbraw/zinc/38/39/85/946383985.db2.gz MTSHCURPPCYHPQ-JOCHJYFZSA-N 0 3 412.553 4.208 20 0 HIADHN CSc1ccc([C@H](CNC(=O)c2cc(C3CC3)nc3onc(C)c32)N(C)C)cc1 ZINC000567784250 946408336 /nfs/dbraw/zinc/40/83/36/946408336.db2.gz AUGQFSSYWUXYFW-IBGZPJMESA-N 0 3 410.543 4.163 20 0 HIADHN C[C@H](NC[C@@H]1CSCCN1Cc1ccccc1)c1ccc(Br)cn1 ZINC000567986326 946439405 /nfs/dbraw/zinc/43/94/05/946439405.db2.gz RSYKNSNDZLJMMY-MAUKXSAKSA-N 0 3 406.393 4.112 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)CCc1nnc(-c2cc3ccccc3o2)o1)c1ccco1 ZINC000568313552 946500696 /nfs/dbraw/zinc/50/06/96/946500696.db2.gz RFDQDDYXBMFJGQ-NVXWUHKLSA-N 0 3 422.485 4.254 20 0 HIADHN COC(=O)c1cc(NC(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)cc2[nH]ccc21 ZINC000568321856 946505006 /nfs/dbraw/zinc/50/50/06/946505006.db2.gz CUYDDWYNCGCBOY-IBGZPJMESA-N 0 3 420.513 4.083 20 0 HIADHN CC(=O)Nc1ccccc1-c1noc([C@H]2CN(Cc3ccccc3)CCC2(F)F)n1 ZINC000568324335 946506882 /nfs/dbraw/zinc/50/68/82/946506882.db2.gz BCHJYWKSPBZFSZ-GOSISDBHSA-N 0 3 412.440 4.320 20 0 HIADHN COc1ccc(C[C@@](C)(O)CN[C@@H](c2cccnc2)c2ccc(F)c(C)c2)cc1OC ZINC000568334166 946514044 /nfs/dbraw/zinc/51/40/44/946514044.db2.gz RTSKKMNASMUSRG-JWQCQUIFSA-N 0 3 424.516 4.219 20 0 HIADHN Cc1ccccc1NC(=O)[C@H](C)N[C@H]1CCN(C(C)C)[C@@H]1c1ccc(F)c(F)c1 ZINC000568416831 946533025 /nfs/dbraw/zinc/53/30/25/946533025.db2.gz JOGLMNVUOPWTLB-WQTXXOFMSA-N 0 3 401.501 4.414 20 0 HIADHN CN(CCCN[C@@H](c1ccccc1)c1cccc(S(C)(=O)=O)c1)c1ccccc1 ZINC000568429773 946540855 /nfs/dbraw/zinc/54/08/55/946540855.db2.gz WDAQUIQNOGGBBC-DEOSSOPVSA-N 0 3 408.567 4.296 20 0 HIADHN CSc1ccc([C@H](CNC(=O)c2cc(-c3csc(C)n3)c[nH]2)N(C)C)cc1 ZINC000568555194 946592115 /nfs/dbraw/zinc/59/21/15/946592115.db2.gz HXXKEQFDHJBKLQ-IBGZPJMESA-N 0 3 400.573 4.201 20 0 HIADHN Cc1cc(CNCc2cccc(N3C(=O)NC4(CCCC4)C3=O)c2)cc2cccnc12 ZINC000568685634 946654342 /nfs/dbraw/zinc/65/43/42/946654342.db2.gz CFHAJYFIFZWUSG-UHFFFAOYSA-N 0 3 414.509 4.202 20 0 HIADHN CC[C@H](NC(=O)c1ccccc1)c1noc([C@H]2CCCN(Cc3cccc(F)c3)C2)n1 ZINC000568799258 946699305 /nfs/dbraw/zinc/69/93/05/946699305.db2.gz HYNBZJLTXWCCSP-FPOVZHCZSA-N 0 3 422.504 4.469 20 0 HIADHN CC(C)Oc1ccc([C@@H](C)NCc2cccc(OCC(=O)N(C)C)c2)cc1Cl ZINC000568995900 946793861 /nfs/dbraw/zinc/79/38/61/946793861.db2.gz DEIFSMBVPGQARM-MRXNPFEDSA-N 0 3 404.938 4.445 20 0 HIADHN COCCOc1ccc(Cl)cc1C(=O)NC[C@H](c1ccc(SC)cc1)N(C)C ZINC000569147757 946823806 /nfs/dbraw/zinc/82/38/06/946823806.db2.gz WKLDMJHZTJXUHZ-LJQANCHMSA-N 0 3 422.978 4.120 20 0 HIADHN COC(C)(C)c1nc(C)c(C(=O)NC[C@H](c2ccc(SC)cc2)N(C)C)s1 ZINC000569285698 946849908 /nfs/dbraw/zinc/84/99/08/946849908.db2.gz XLEVFDFSJZFATK-MRXNPFEDSA-N 0 3 407.605 4.088 20 0 HIADHN CC[C@H](NCc1cccc(N2C(=O)N[C@@](C)(C3CC3)C2=O)c1)c1cccc(OC)c1 ZINC000569389123 946864659 /nfs/dbraw/zinc/86/46/59/946864659.db2.gz QVWPHJVBHJAKFM-URXFXBBRSA-N 0 3 407.514 4.161 20 0 HIADHN c1cc2c(s1)CCN([C@@H](CN[C@H](c1nnc[nH]1)c1ccccc1)c1ccccc1)C2 ZINC000569617834 946897364 /nfs/dbraw/zinc/89/73/64/946897364.db2.gz ROBPFNOQKSZWRZ-GMAHTHKFSA-N 0 3 415.566 4.345 20 0 HIADHN CN1CC[C@@H](NCc2nc3cc(Br)ccc3[nH]2)[C@H]1c1ccc(F)c(F)c1 ZINC000569970785 947057681 /nfs/dbraw/zinc/05/76/81/947057681.db2.gz XTOQNSCZCUIIEY-VQIMIIECSA-N 0 3 421.289 4.139 20 0 HIADHN C[C@H](NC(=O)N1CCC(OCC2CCCCC2)CC1)[C@H](c1ccccc1)N(C)C ZINC000569998889 947066640 /nfs/dbraw/zinc/06/66/40/947066640.db2.gz KBYMHVWPBOBMQT-WMZHIEFXSA-N 0 3 401.595 4.449 20 0 HIADHN C[C@@H]1[C@H](NC(=O)N(C)Cc2ccc(OC(F)F)cc2)CCN1Cc1ccccc1 ZINC000569999348 947066877 /nfs/dbraw/zinc/06/68/77/947066877.db2.gz NYYGCNSGAXFGLP-OXQOHEQNSA-N 0 3 403.473 4.092 20 0 HIADHN C[C@H](NCCN1CCCS1(=O)=O)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 ZINC000570185950 947126857 /nfs/dbraw/zinc/12/68/57/947126857.db2.gz VOYLHAVOFIDGLY-ZDUSSCGKSA-N 0 3 418.506 4.120 20 0 HIADHN C[C@@H](NCCN1CCCS1(=O)=O)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 ZINC000570185944 947127049 /nfs/dbraw/zinc/12/70/49/947127049.db2.gz VOYLHAVOFIDGLY-CYBMUJFWSA-N 0 3 418.506 4.120 20 0 HIADHN CN(C)C[C@H](NC(=O)c1cnc(Cc2ccccc2F)s1)c1ccc(F)cc1 ZINC000570191807 947127844 /nfs/dbraw/zinc/12/78/44/947127844.db2.gz XORWJCRQVPPUGG-SFHVURJKSA-N 0 3 401.482 4.045 20 0 HIADHN CC(C)(C)C[C@H](O)CC(=O)N(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000570234490 947156118 /nfs/dbraw/zinc/15/61/18/947156118.db2.gz XLTJPQJSPJUJNA-BJKOFHAPSA-N 0 3 423.601 4.262 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)[C@H](C)Cc2ccc(C(F)(F)F)cc2)cc1 ZINC000570309994 947190210 /nfs/dbraw/zinc/19/02/10/947190210.db2.gz URFGBAAAPLJLRE-FOIQADDNSA-N 0 3 408.464 4.312 20 0 HIADHN O=C(COc1ccc(Cl)c2ccccc12)Nc1cccc(CN2CC[C@H](O)C2)c1 ZINC000570420116 947234998 /nfs/dbraw/zinc/23/49/98/947234998.db2.gz SETLGPOKJFXBNP-SFHVURJKSA-N 0 3 410.901 4.077 20 0 HIADHN CC(C)c1nc2cc(NC(=O)NC[C@H]3CN(Cc4ccccc4)CCCO3)ccc2o1 ZINC000570503898 947270704 /nfs/dbraw/zinc/27/07/04/947270704.db2.gz VLXQZBPCFOOOLG-FQEVSTJZSA-N 0 3 422.529 4.364 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)c1c(F)cc(Br)cc1F)c1ccco1 ZINC000570712945 947331725 /nfs/dbraw/zinc/33/17/25/947331725.db2.gz BMMAMBWWZYFDAR-IINYFYTJSA-N 0 3 401.251 4.180 20 0 HIADHN FC(F)Oc1cc(Br)ccc1-c1noc(C2CCN(C3CC3)CC2)n1 ZINC000570759412 947348808 /nfs/dbraw/zinc/34/88/08/947348808.db2.gz MRCNDGARMMGYLF-UHFFFAOYSA-N 0 3 414.250 4.442 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)C1CCN(c2nc3ccccc3s2)CC1 ZINC000570882005 947381167 /nfs/dbraw/zinc/38/11/67/947381167.db2.gz YSRQFBOFOIBSBU-GOSISDBHSA-N 0 3 422.598 4.149 20 0 HIADHN CSc1cccc(N(C(=O)c2cc(-n3cccc3)ccn2)C2CCN(C)CC2)c1 ZINC000570881890 947381420 /nfs/dbraw/zinc/38/14/20/947381420.db2.gz VTTIQUVHJJYVFT-UHFFFAOYSA-N 0 3 406.555 4.335 20 0 HIADHN CN1CC[C@H](NCC(=O)Nc2ccccc2C(C)(C)C)[C@@H]1c1ccc(F)c(F)c1 ZINC000570976500 947406613 /nfs/dbraw/zinc/40/66/13/947406613.db2.gz UZQCGCPAHHEYFV-UNMCSNQZSA-N 0 3 401.501 4.236 20 0 HIADHN Brc1ccccc1-c1noc(C2CCN(CCOC3CCC3)CC2)n1 ZINC000571072349 947469935 /nfs/dbraw/zinc/46/99/35/947469935.db2.gz PJBDQTODQSMHHN-UHFFFAOYSA-N 0 3 406.324 4.248 20 0 HIADHN OCC1([C@H](NCc2cc3c(c(Br)c2)OCO3)c2ccccc2)CCC1 ZINC000571187388 947535752 /nfs/dbraw/zinc/53/57/52/947535752.db2.gz GKUMZPSRCKJPMK-LJQANCHMSA-N 0 3 404.304 4.171 20 0 HIADHN Cc1nnc(-c2cccc(C(=O)NC[C@H](c3ccc(CC(C)C)cc3)N(C)C)c2)o1 ZINC000571195636 947540852 /nfs/dbraw/zinc/54/08/52/947540852.db2.gz CRICQYCJOFDPIE-JOCHJYFZSA-N 0 3 406.530 4.276 20 0 HIADHN O=C(c1cccc(-n2cccn2)c1)N(CCN1CCCC1)Cc1ccc(Cl)cc1 ZINC000571319405 947594588 /nfs/dbraw/zinc/59/45/88/947594588.db2.gz VUHHKQKVFXJHBC-UHFFFAOYSA-N 0 3 408.933 4.264 20 0 HIADHN Cc1[nH]c(=O)c(C(=O)N[C@@H]2CCN(Cc3ccccc3)[C@H]2C)cc1-c1ccccc1 ZINC000571736849 947771481 /nfs/dbraw/zinc/77/14/81/947771481.db2.gz WIQVBOIMNLRWJX-FDDCHVKYSA-N 0 3 401.510 4.155 20 0 HIADHN CCN1CC[C@H](NCc2cc(-c3cnn(C)c3C)no2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000571823376 947795559 /nfs/dbraw/zinc/79/55/59/947795559.db2.gz ZLSUWIXONRZJNA-FPOVZHCZSA-N 0 3 417.916 4.101 20 0 HIADHN CCn1nccc1N1CCC[C@@H](N[C@H](C)c2ccc(OC(C)C)c(Cl)c2)C1=O ZINC000572264300 947871008 /nfs/dbraw/zinc/87/10/08/947871008.db2.gz HRIKSIATXGJODM-CRAIPNDOSA-N 0 3 404.942 4.190 20 0 HIADHN CSc1ccc([C@H](CNC(=O)c2c[nH]nc2-c2c(F)cccc2F)N(C)C)cc1 ZINC000572268527 947873094 /nfs/dbraw/zinc/87/30/94/947873094.db2.gz AQRJFRRKXSAVNR-SFHVURJKSA-N 0 3 416.497 4.110 20 0 HIADHN CC(C)N1CC[C@@H](N[C@@H](C)C(=O)Nc2ccc(F)cc2F)[C@H]1c1ccc(F)c(F)c1 ZINC000572375190 947890044 /nfs/dbraw/zinc/89/00/44/947890044.db2.gz ILSODRQKQICSIL-JDORSLCVSA-N 0 3 423.454 4.384 20 0 HIADHN C[C@H](NC[C@H](CO)Cc1cc(F)c(F)c(F)c1)c1sccc1Br ZINC000572451687 947911725 /nfs/dbraw/zinc/91/17/25/947911725.db2.gz SVEPSYYMAXJPLE-GXSJLCMTSA-N 0 3 408.283 4.430 20 0 HIADHN COc1ccc([C@H](C)NCc2cc3c(c(Br)c2)OCO3)c(C)c1OC ZINC000572588790 947954060 /nfs/dbraw/zinc/95/40/60/947954060.db2.gz RNZAGDZIRIMOCQ-LBPRGKRZSA-N 0 3 408.292 4.354 20 0 HIADHN Fc1ccc([C@@H](NCCc2ccc(OCc3ccccc3)cc2)c2c[nH]nn2)cc1 ZINC000572785865 948009832 /nfs/dbraw/zinc/00/98/32/948009832.db2.gz BGKKONDYVCBUEZ-XMMPIXPASA-N 0 3 402.473 4.445 20 0 HIADHN CCc1nn(-c2ccccc2)c(CC)c1CN[C@@H](C)c1ccccc1-n1ccnn1 ZINC000573228870 948113808 /nfs/dbraw/zinc/11/38/08/948113808.db2.gz CTSZNDQRQYEIAW-SFHVURJKSA-N 0 3 400.530 4.429 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccc(OCc4cn5cccc(C)c5n4)cc3)C2)c1 ZINC000573375308 948171236 /nfs/dbraw/zinc/17/12/36/948171236.db2.gz BQDVABNPGRGZLU-QFIPXVFZSA-N 0 3 401.514 4.174 20 0 HIADHN Cc1ccccc1-c1nn(-c2ccccc2)cc1C(=O)N1[C@@H]2CC[C@H]1CCN(C)C2 ZINC000573632295 948259113 /nfs/dbraw/zinc/25/91/13/948259113.db2.gz LYGPLFHUXIGFHQ-LEWJYISDSA-N 0 3 400.526 4.156 20 0 HIADHN CN1CCN(C[C@@H](NCc2ccc(-c3cccc(F)c3F)o2)c2ccccc2)CC1 ZINC000573656194 948270232 /nfs/dbraw/zinc/27/02/32/948270232.db2.gz QKIZRNXAYAVJKN-JOCHJYFZSA-N 0 3 411.496 4.303 20 0 HIADHN CSCC[C@H](N[C@H]1CCCc2c3cc(Br)ccc3[nH]c21)C(=O)N(C)C ZINC000573759621 948290722 /nfs/dbraw/zinc/29/07/22/948290722.db2.gz WWVNSYSQUSSJEP-IRXDYDNUSA-N 0 3 424.408 4.107 20 0 HIADHN CN1CCO[C@@H]([C@H](NC[C@H]2CC[C@H](c3ccccc3)O2)c2ccc(Cl)cc2)C1 ZINC000573836754 948306755 /nfs/dbraw/zinc/30/67/55/948306755.db2.gz KCLBMQBYRHMEJH-SSGKUCQKSA-N 0 3 400.950 4.222 20 0 HIADHN NC(=O)[C@@H]1CCCN(Cc2ccccc2NC(=O)c2ccc(C3=CCCC3)cc2)C1 ZINC000573972706 948338186 /nfs/dbraw/zinc/33/81/86/948338186.db2.gz BPBNEBMXNIRACT-JOCHJYFZSA-N 0 3 403.526 4.204 20 0 HIADHN CCOc1cc(C[NH2+]CCc2cnn(-c3ccccc3)c2)cc(Br)c1[O-] ZINC000574111852 948367248 /nfs/dbraw/zinc/36/72/48/948367248.db2.gz PYDMVAYYIWJPFZ-UHFFFAOYSA-N 0 3 416.319 4.071 20 0 HIADHN Brc1ccc2[nH]cc(CC[NH2+][C@@H](c3cccs3)c3nnc[n-]3)c2c1 ZINC000574300139 948405413 /nfs/dbraw/zinc/40/54/13/948405413.db2.gz NVGGCYPKAQBETP-INIZCTEOSA-N 0 3 402.321 4.032 20 0 HIADHN Cc1nc(-c2ncccn2)sc1C(=O)NC[C@@H](c1ccc(CC(C)C)cc1)N(C)C ZINC000574334574 948415896 /nfs/dbraw/zinc/41/58/96/948415896.db2.gz VEIRCGQROLGZQV-IBGZPJMESA-N 0 3 423.586 4.140 20 0 HIADHN C[C@H]1CN(CCC(=O)Nc2ccccc2Oc2ccccc2)CC2(CCOCC2)O1 ZINC000574598381 948487915 /nfs/dbraw/zinc/48/79/15/948487915.db2.gz ARZAWJAVFSHXHQ-IBGZPJMESA-N 0 3 410.514 4.077 20 0 HIADHN CN1CCCN(c2ccc(-c3noc([C@@H]4C[C@H]4c4ccc(Cl)s4)n3)cn2)CC1 ZINC000574674677 948502142 /nfs/dbraw/zinc/50/21/42/948502142.db2.gz RIHBZBPFMWYEQX-HUUCEWRRSA-N 0 3 415.950 4.260 20 0 HIADHN C[C@H]1[C@@H](NC(=O)CCc2nc(-c3ccc(Cl)cc3)no2)CCN1Cc1ccccc1 ZINC000574716504 948510678 /nfs/dbraw/zinc/51/06/78/948510678.db2.gz BSACDGFESPLTQI-JXFKEZNVSA-N 0 3 424.932 4.102 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)N1CCC(OCC2CCCCC2)CC1)c1ccco1 ZINC000574783312 948524878 /nfs/dbraw/zinc/52/48/78/948524878.db2.gz QCHFWQXOKNALNT-NQIIRXRSSA-N 0 3 405.583 4.480 20 0 HIADHN Clc1cccc(N2CC[C@@H](NCc3cn4ccc(Br)cc4n3)C2)c1 ZINC000574847445 948543844 /nfs/dbraw/zinc/54/38/44/948543844.db2.gz QPNMIWNYLBERAK-OAHLLOKOSA-N 0 3 405.727 4.119 20 0 HIADHN CN(CC1CCCCC1)C(=O)CNC1(c2cccc(C(F)(F)F)c2)CCOCC1 ZINC000575081603 948587310 /nfs/dbraw/zinc/58/73/10/948587310.db2.gz GYMBUGHGSRKZLI-UHFFFAOYSA-N 0 3 412.496 4.339 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)c1cccc(C(=O)Nc2ccccc2)c1)c1ccco1 ZINC000575085408 948588742 /nfs/dbraw/zinc/58/87/42/948588742.db2.gz LYVMYBGSDFMKSM-DYESRHJHSA-N 0 3 405.498 4.391 20 0 HIADHN C[C@@H]1CCCC[C@@H]1N(C)C(=O)CNC1(c2cccc(C(F)(F)F)c2)CCOCC1 ZINC000575207069 948629420 /nfs/dbraw/zinc/62/94/20/948629420.db2.gz BHXCHQZSPLMMLX-APWZRJJASA-N 0 3 412.496 4.338 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)c2cccc(Br)c2Cl)cc1 ZINC000575204875 948630146 /nfs/dbraw/zinc/63/01/46/948630146.db2.gz TVGBCAMQAPSZLL-INIZCTEOSA-N 0 3 411.727 4.144 20 0 HIADHN C[C@H](NC(=O)CN[C@@H]1CCN(C)[C@H]1c1ccccc1)c1ccc(Cl)c(Cl)c1 ZINC000575370020 948658939 /nfs/dbraw/zinc/65/89/39/948658939.db2.gz KUURBOQLTBYGOT-ZKYUUJBMSA-N 0 3 406.357 4.206 20 0 HIADHN C[C@H]1CN(C2CC2)C[C@@H]1NC(=O)C(C)(C)c1csc(-c2c(F)cccc2Cl)n1 ZINC000575631481 948683974 /nfs/dbraw/zinc/68/39/74/948683974.db2.gz PIVFRMPRRDWXAI-LRDDRELGSA-N 0 3 421.969 4.479 20 0 HIADHN C[C@@H](N[C@@H]1CCN(c2ccc(Cl)cc2Cl)C1=O)c1ccccc1-n1ccnn1 ZINC000576017187 948810761 /nfs/dbraw/zinc/81/07/61/948810761.db2.gz ZMFHOABWNISAMG-CXAGYDPISA-N 0 3 416.312 4.030 20 0 HIADHN CCOC(=O)c1ccn(-c2cccc(CNCc3ccc(F)cc3C(F)(F)F)c2)n1 ZINC000576029403 948813810 /nfs/dbraw/zinc/81/38/10/948813810.db2.gz KUTVIJQUGXCXSZ-UHFFFAOYSA-N 0 3 421.394 4.497 20 0 HIADHN Clc1cccc2c1nc(Cl)nc2N1CC[C@H]2[C@H]1CCN2Cc1cccnc1 ZINC001164726532 720372361 /nfs/dbraw/zinc/37/23/61/720372361.db2.gz PDINAJOIEJTJCV-DLBZAZTESA-N 0 3 400.313 4.185 20 0 HIADHN Clc1cc2c(Cl)ccnc2c(N2CC[C@@H]3[C@@H]2CCN3Cc2cccnc2)n1 ZINC001164727151 720378280 /nfs/dbraw/zinc/37/82/80/720378280.db2.gz QMUUMLYTZZGYEO-SJORKVTESA-N 0 3 400.313 4.185 20 0 HIADHN Cc1nc2sc3c(c2c(N2CC[C@@H]4[C@@H]2CCN4Cc2cccnc2)n1)CCCC3 ZINC001164734506 720431792 /nfs/dbraw/zinc/43/17/92/720431792.db2.gz SXJDDYWHPWSZMY-MOPGFXCFSA-N 0 3 405.571 4.127 20 0 HIADHN FC(F)(c1cc(Cl)cnc1Cl)N1CCCn2cnc(CNC3CCC3)c2C1 ZINC001164836221 720736435 /nfs/dbraw/zinc/73/64/35/720736435.db2.gz CLNMOIWBKKHEPY-UHFFFAOYSA-N 0 3 416.303 4.182 20 0 HIADHN FC(F)(c1cc2cc[nH]c2c(Cl)n1)N1CCCn2cnc(CNC3CCC3)c2C1 ZINC001164839025 720738832 /nfs/dbraw/zinc/73/88/32/720738832.db2.gz ZXALJDCFWUDZGR-UHFFFAOYSA-N 0 3 420.895 4.010 20 0 HIADHN Cc1cnc(N2CCN3C[C@@H](Oc4cccc(F)c4)C[C@H]3C2)nc1-c1ccccc1F ZINC001164911887 721564904 /nfs/dbraw/zinc/56/49/04/721564904.db2.gz ZVCRYZBRKQAXDQ-ICSRJNTNSA-N 0 3 422.479 4.072 20 0 HIADHN Cc1cncc(COC[C@]23CCC[C@H]2CN(c2ncccc2CN2CCCC2)C3)c1 ZINC001164803628 721601880 /nfs/dbraw/zinc/60/18/80/721601880.db2.gz WIUBTNXPTKOBGX-UKILVPOCSA-N 0 3 406.574 4.204 20 0 HIADHN CCOc1cc(Cl)nc(N2CCC(F)(F)[C@@]3(CCN(Cc4ccccn4)C3)C2)c1 ZINC001164904242 721701463 /nfs/dbraw/zinc/70/14/63/721701463.db2.gz DYNODBIMTDHKKO-HXUWFJFHSA-N 0 3 422.907 4.266 20 0 HIADHN Cc1nc(Cl)cc(N2CCC(F)(F)[C@]3(CCN(Cc4ccccn4)C3)C2)c1C ZINC001164908141 721708799 /nfs/dbraw/zinc/70/87/99/721708799.db2.gz VZLDLPKVCYRFFK-FQEVSTJZSA-N 0 3 406.908 4.485 20 0 HIADHN COc1cccc2c1ccnc2N1CCC(F)(F)[C@]2(CCN(Cc3ccccn3)C2)C1 ZINC001164909874 721729273 /nfs/dbraw/zinc/72/92/73/721729273.db2.gz FARXVUVFXBJZED-QHCPKHFHSA-N 0 3 424.495 4.376 20 0 HIADHN Clc1cccc2ccc(N3CC[C@H]4CN(Cc5cccnc5)CCO[C@@H]4C3)nc12 ZINC001164976502 722110840 /nfs/dbraw/zinc/11/08/40/722110840.db2.gz LSFXSNYCLFPYAN-PZJWPPBQSA-N 0 3 408.933 4.011 20 0 HIADHN Cc1c(Cl)ccc2ccc(N3CC[C@H]4CN(Cc5cccnc5)CCO[C@@H]4C3)nc21 ZINC001164984225 722134859 /nfs/dbraw/zinc/13/48/59/722134859.db2.gz WOPVHVZZFVZCDQ-RBBKRZOGSA-N 0 3 422.960 4.319 20 0 HIADHN Cc1cccc2cc(Cl)nc(N3CC[C@@H]4CN(Cc5cccnc5)CCO[C@@H]4C3)c12 ZINC001164971260 722153531 /nfs/dbraw/zinc/15/35/31/722153531.db2.gz BLWYYFLYNWYNLK-NHCUHLMSSA-N 0 3 422.960 4.319 20 0 HIADHN COc1cc2ncnc(N3CCC[C@@]4(CCN4Cc4cccc(F)c4)C3)c2c(OC)c1 ZINC001164993767 722202112 /nfs/dbraw/zinc/20/21/12/722202112.db2.gz ASTQVOKNVICUQK-XMMPIXPASA-N 0 3 422.504 4.031 20 0 HIADHN O=C(N[C@H]1CCN(Cc2ccccc2)C1)C1(c2cc(F)cc(C(F)(F)F)c2)CC1 ZINC000435935159 861197012 /nfs/dbraw/zinc/19/70/12/861197012.db2.gz BUJNDCFIFVPCSO-IBGZPJMESA-N 0 3 406.423 4.267 20 0 HIADHN COc1cc(CCC(=O)Nc2cccc(CN3CCC(CO)CC3)c2)ccc1Cl ZINC000435972676 861237339 /nfs/dbraw/zinc/23/73/39/861237339.db2.gz PHGDKMVCJIIIIW-UHFFFAOYSA-N 0 3 416.949 4.124 20 0 HIADHN CN(C)CCN(C(=O)Nc1cccc(C(=O)Nc2cccc(F)c2)c1)C1CCCC1 ZINC000436000342 861286385 /nfs/dbraw/zinc/28/63/85/861286385.db2.gz CLUPFAZKHQAJHD-UHFFFAOYSA-N 0 3 412.509 4.416 20 0 HIADHN CC[C@H](Nc1ccccc1)C(=O)Nc1cc(C)nn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000436007658 861296047 /nfs/dbraw/zinc/29/60/47/861296047.db2.gz YTAFDDPXCRCBLA-PKTZIBPZSA-N 0 3 417.557 4.468 20 0 HIADHN COc1ccc([C@H](C/N=C/c2cc(Br)ccc2O)N2CCCC2)cc1 ZINC000005291391 845098950 /nfs/dbraw/zinc/09/89/50/845098950.db2.gz PFDDISKQSDJFGX-MEGCXXLRSA-N 0 3 403.320 4.419 20 0 HIADHN Cc1cc(C)n(-c2ccc(C(=O)N3c4ccc(C)cc4[C@@H]4CN(C)CC[C@@H]43)cc2)n1 ZINC000010045401 845615050 /nfs/dbraw/zinc/61/50/50/845615050.db2.gz SUFSPQISZYFFPF-UPVQGACJSA-N 0 3 400.526 4.246 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)CCc3ncc(-c4ccc(C)cc4)o3)cc2)CC1 ZINC000010192995 845629926 /nfs/dbraw/zinc/62/99/26/845629926.db2.gz MJPFHEPJLMOCSI-UHFFFAOYSA-N 0 3 418.541 4.363 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3occc3COc3ccccc3)cc2)CC1 ZINC000010193024 845629955 /nfs/dbraw/zinc/62/99/55/845629955.db2.gz YSJLVUFNIBDCEP-UHFFFAOYSA-N 0 3 405.498 4.253 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3ccc(NC(=O)OC(C)(C)C)cc3)cc2)CC1 ZINC000011950842 845842964 /nfs/dbraw/zinc/84/29/64/845842964.db2.gz KXSPBWDHDPXUSN-UHFFFAOYSA-N 0 3 424.545 4.428 20 0 HIADHN O=C(Nc1ccc(-c2nc3ccccc3[nH]2)cc1)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000012433379 845870466 /nfs/dbraw/zinc/87/04/66/845870466.db2.gz ZYHDDCHCWXFARI-HXUWFJFHSA-N 0 3 411.509 4.476 20 0 HIADHN CC(C)(C)c1ccc(CNCc2ccc(S(=O)(=O)N3CCCCC3)cc2)cc1 ZINC000017317668 846244053 /nfs/dbraw/zinc/24/40/53/846244053.db2.gz DPWONFLMPASSRV-UHFFFAOYSA-N 0 3 400.588 4.449 20 0 HIADHN CN(Cc1c(-c2ccccc2)nc2ccccn21)Cc1ccccc1N1CCOCC1 ZINC000021318420 846428352 /nfs/dbraw/zinc/42/83/52/846428352.db2.gz JMBZCUNVXCUEKB-UHFFFAOYSA-N 0 3 412.537 4.470 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1)c1ccc(Br)s1 ZINC000436357781 861686553 /nfs/dbraw/zinc/68/65/53/861686553.db2.gz JLQHRPJADBDAFC-DXCKQFNASA-N 0 3 408.365 4.316 20 0 HIADHN C[C@H](NC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1)c1ccc(Br)s1 ZINC000436357796 861686874 /nfs/dbraw/zinc/68/68/74/861686874.db2.gz JLQHRPJADBDAFC-RVSPLBMKSA-N 0 3 408.365 4.316 20 0 HIADHN O=c1cc(CN(Cc2ccc3c(c2)OCO3)C2CCCC2)nc2ccc(Cl)cn12 ZINC000022015046 846520479 /nfs/dbraw/zinc/52/04/79/846520479.db2.gz LURNFTAZDPXMQM-UHFFFAOYSA-N 0 3 411.889 4.021 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1sc(-c2ccccn2)nc1C)c1cccc(OC)c1 ZINC000022700731 846606503 /nfs/dbraw/zinc/60/65/03/846606503.db2.gz BRCOAYCFFLCBJJ-HXUWFJFHSA-N 0 3 424.570 4.335 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)c1cccc(OCc2cscn2)c1 ZINC000023741303 846744842 /nfs/dbraw/zinc/74/48/42/846744842.db2.gz GUQIWGCXDYRTPH-JOCHJYFZSA-N 0 3 407.539 4.289 20 0 HIADHN Cc1ccc(CN(CCc2ccccc2)Cc2nn3c(nc(C)cc3=O)s2)s1 ZINC000024337451 846814651 /nfs/dbraw/zinc/81/46/51/846814651.db2.gz KNLGOFXMEQYWCE-UHFFFAOYSA-N 0 3 410.568 4.074 20 0 HIADHN CN(C)Cc1ccccc1NC(=O)c1nc(-c2cccs2)n(-c2ccc(F)cc2)n1 ZINC000024809233 846870720 /nfs/dbraw/zinc/87/07/20/846870720.db2.gz MLPLBUHUPKNCEG-UHFFFAOYSA-N 0 3 421.501 4.449 20 0 HIADHN O=C(CN1CCC[C@@H]1Cc1ccccc1)N1CCC[C@@H]1c1ccc2c(c1)OCCCO2 ZINC000025359321 846966389 /nfs/dbraw/zinc/96/63/89/846966389.db2.gz RFCUTFPFLPPLSZ-DHIUTWEWSA-N 0 3 420.553 4.219 20 0 HIADHN Cc1ccccc1[C@@H](OC[C@@H](O)CN(C)Cc1ccc2c(c1)OCO2)c1ccccc1 ZINC000025368618 846969529 /nfs/dbraw/zinc/96/95/29/846969529.db2.gz MSABDJBWLVNITJ-NVQXNPDNSA-N 0 3 419.521 4.323 20 0 HIADHN CC(C)[C@H](CNC(=O)c1ccc(OC[C@H]2CCCO2)cc1)N1CCc2ccccc2C1 ZINC000025534533 846994981 /nfs/dbraw/zinc/99/49/81/846994981.db2.gz OXRTVUAXYFYNJV-RPBOFIJWSA-N 0 3 422.569 4.057 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@@H](C)NCc2ccc(OC(F)F)cc2)cc1 ZINC000026311101 847122967 /nfs/dbraw/zinc/12/29/67/847122967.db2.gz BPLMMTRGKFSSBT-OAHLLOKOSA-N 0 3 412.502 4.169 20 0 HIADHN COc1ccc(OC)c([C@H](C)NC[C@H](O)COc2ccc(-c3ccccc3)cc2)c1 ZINC000026715165 847189995 /nfs/dbraw/zinc/18/99/95/847189995.db2.gz DSFCTOMVUIIWAY-RXVVDRJESA-N 0 3 407.510 4.461 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)c3nc(Cl)ccc3Cl)CC2)c1 ZINC000026958212 847226626 /nfs/dbraw/zinc/22/66/26/847226626.db2.gz IYEOWHKWIGFQEN-UHFFFAOYSA-N 0 3 421.372 4.029 20 0 HIADHN Cc1ccc(SCC(=O)NCCCCN2CCN(c3cccc(C)c3)CC2)cc1 ZINC000026955128 847226691 /nfs/dbraw/zinc/22/66/91/847226691.db2.gz KPWFEBLGUWTSPZ-UHFFFAOYSA-N 0 3 411.615 4.114 20 0 HIADHN CSc1ccc(C)c(C(=O)NCCCCN2CCN(c3cccc(C)c3)CC2)c1 ZINC000026961230 847226746 /nfs/dbraw/zinc/22/67/46/847226746.db2.gz FSKIMVSNOMOLAA-UHFFFAOYSA-N 0 3 411.615 4.358 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)c3cc(Cl)ccc3F)CC2)c1 ZINC000026957852 847226869 /nfs/dbraw/zinc/22/68/69/847226869.db2.gz XXTDOQNZZYADEK-UHFFFAOYSA-N 0 3 403.929 4.120 20 0 HIADHN O=C(CN1CCN(C2CCCC2)CC1)N[C@@H](c1ccccc1)c1ccc(Cl)cc1 ZINC000027119175 847250538 /nfs/dbraw/zinc/25/05/38/847250538.db2.gz MVMQCLGQYGUADQ-DEOSSOPVSA-N 0 3 411.977 4.106 20 0 HIADHN COc1cccc([C@@H](CNC(=O)CCc2ncc(-c3ccccc3)o2)N2CCCC2)c1 ZINC000027342961 847286029 /nfs/dbraw/zinc/28/60/29/847286029.db2.gz RQDOVPUZVHUNMS-JOCHJYFZSA-N 0 3 419.525 4.236 20 0 HIADHN COc1ccc(CCC(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)cc1OC ZINC000027573195 847321549 /nfs/dbraw/zinc/32/15/49/847321549.db2.gz CELWQGLYGVPZOA-IBGZPJMESA-N 0 3 416.587 4.287 20 0 HIADHN COc1ccc(O[C@H](C)C(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)cc1 ZINC000027575383 847323335 /nfs/dbraw/zinc/32/33/35/847323335.db2.gz QHIAQQLAMWVGFY-YLJYHZDGSA-N 0 3 402.560 4.113 20 0 HIADHN COc1ccc(NC(=O)[C@@H](NCCc2ccc(OC)c(OC)c2)c2ccccc2)cc1 ZINC000028621935 847438061 /nfs/dbraw/zinc/43/80/61/847438061.db2.gz KNNPOQPJGIHUII-DEOSSOPVSA-N 0 3 420.509 4.225 20 0 HIADHN Cc1ccc(-n2ncc(C(=O)NC[C@H](Cc3ccccc3)N(C)C)c2C(C)C)cc1 ZINC000028840233 847467038 /nfs/dbraw/zinc/46/70/38/847467038.db2.gz IBLWCMPRAZVGKW-QFIPXVFZSA-N 0 3 404.558 4.207 20 0 HIADHN COc1cc(CN(C)CCC(=O)N[C@H]2CCCc3ccccc32)ccc1OC(F)F ZINC000028852860 847469705 /nfs/dbraw/zinc/46/97/05/847469705.db2.gz KWSCECPMOWTFCO-IBGZPJMESA-N 0 3 418.484 4.312 20 0 HIADHN CC(=O)Nc1cccc([C@H](C)NC[C@H](O)COc2ccc(-c3ccccc3)cc2)c1 ZINC000028917881 847477699 /nfs/dbraw/zinc/47/76/99/847477699.db2.gz URGWWAWVOWUCJT-UUOWRZLLSA-N 0 3 404.510 4.403 20 0 HIADHN O=C(Cc1csc(-c2cccc(F)c2)n1)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000029178792 847520499 /nfs/dbraw/zinc/52/04/99/847520499.db2.gz VLNBWOUCSSRECV-NRFANRHFSA-N 0 3 409.530 4.445 20 0 HIADHN Cc1nc(-c2ccc(CNC(=O)N[C@@H](CN3CCCC3)c3ccccc3)o2)cs1 ZINC000029326531 847545979 /nfs/dbraw/zinc/54/59/79/847545979.db2.gz PEKIJERUTFOHRL-IBGZPJMESA-N 0 3 410.543 4.348 20 0 HIADHN CCN(CC)C(=O)c1ccc(NC(=O)CN(Cc2ccccc2)[C@H](C)C2CC2)cc1 ZINC000029842373 847631093 /nfs/dbraw/zinc/63/10/93/847631093.db2.gz PTQDYMIJUWNJDD-LJQANCHMSA-N 0 3 407.558 4.408 20 0 HIADHN CC[C@H](C)c1ccc(S(=O)(=O)NC2CCN(CCc3ccccc3)CC2)cc1 ZINC000030380700 847708369 /nfs/dbraw/zinc/70/83/69/847708369.db2.gz NBVGCTHOEUPWTK-IBGZPJMESA-N 0 3 400.588 4.186 20 0 HIADHN c1cn(Cc2ccccc2CNCc2cn(-c3ccccc3)nc2-c2cccnc2)cn1 ZINC000030651935 847752518 /nfs/dbraw/zinc/75/25/18/847752518.db2.gz OMENBHPCRAWTBG-UHFFFAOYSA-N 0 3 420.520 4.469 20 0 HIADHN c1cnn(-c2cc(CNCc3cn(Cc4ccccc4)nc3-c3ccccc3)ccn2)c1 ZINC000030901177 847794309 /nfs/dbraw/zinc/79/43/09/847794309.db2.gz KBIGDOXYYAEFOB-UHFFFAOYSA-N 0 3 420.520 4.469 20 0 HIADHN COc1cc(CNCc2ccccc2Cn2cncn2)ccc1OCc1cccs1 ZINC000030900823 847794553 /nfs/dbraw/zinc/79/45/53/847794553.db2.gz FLSIXUBLVBYARK-UHFFFAOYSA-N 0 3 420.538 4.265 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)c2cc3c(cccc3OC(F)F)[nH]2)N(C)C)cc1 ZINC000031209868 847844895 /nfs/dbraw/zinc/84/48/95/847844895.db2.gz OZLSHQIKYIAFJM-LJQANCHMSA-N 0 3 401.457 4.364 20 0 HIADHN CCN(CC)[C@H](CNC(=O)[C@@H](NC(=O)c1cccc(C)c1)C(C)C)c1ccsc1 ZINC000031987749 847975616 /nfs/dbraw/zinc/97/56/16/847975616.db2.gz DSXINAGOGQOVHK-RTWAWAEBSA-N 0 3 415.603 4.010 20 0 HIADHN O=C(Nc1ccccc1C(=O)NCCCN1CCc2ccccc2C1)c1cccs1 ZINC000032401029 848020438 /nfs/dbraw/zinc/02/04/38/848020438.db2.gz JHALTLTXPRTPNP-UHFFFAOYSA-N 0 3 419.550 4.179 20 0 HIADHN CC[C@H](CNC(=O)c1cccc(OCc2cscn2)c1)N1CCc2ccccc2C1 ZINC000032447000 848028807 /nfs/dbraw/zinc/02/88/07/848028807.db2.gz SMJFYYGWUQHUQI-JOCHJYFZSA-N 0 3 421.566 4.289 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cccc(NC(=O)[C@@H]2C[C@@H]2C)c1)c1cccc(OC)c1 ZINC000032949756 848095476 /nfs/dbraw/zinc/09/54/76/848095476.db2.gz WYTNIDQXNAXCCL-JJEOQYAHSA-N 0 3 423.557 4.103 20 0 HIADHN Cc1ccc(-c2cnc(CCC(=O)NC[C@@H](c3ccc(N(C)C)cc3)N(C)C)o2)cc1 ZINC000041021165 848200179 /nfs/dbraw/zinc/20/01/79/848200179.db2.gz QRAULPAMFCSRFT-QFIPXVFZSA-N 0 3 420.557 4.068 20 0 HIADHN CSCC[C@H](NC(=O)OC(C)(C)C)C(=O)C(C#N)c1nc2ccccc2s1 ZINC000041499481 848222204 /nfs/dbraw/zinc/22/22/04/848222204.db2.gz ZXFSLTVKYNLRCG-OCCSQVGLSA-N 0 3 405.545 4.119 20 0 HIADHN CSCC[C@@H](NC(=O)c1ccccc1)C(=O)C(C#N)c1nc2ccccc2s1 ZINC000041503762 848222385 /nfs/dbraw/zinc/22/23/85/848222385.db2.gz KDXRCGAVIKNCGS-NVXWUHKLSA-N 0 3 409.536 4.024 20 0 HIADHN CSCC[C@H](NC(=O)c1ccccc1)C(=O)C(C#N)c1nc2ccccc2s1 ZINC000041503757 848222442 /nfs/dbraw/zinc/22/24/42/848222442.db2.gz KDXRCGAVIKNCGS-WBVHZDCISA-N 0 3 409.536 4.024 20 0 HIADHN CCOC(=O)N[C@H](C(=O)C(C#N)c1nc2cc(C(F)(F)F)ccc2s1)C(C)C ZINC000041548364 848229488 /nfs/dbraw/zinc/22/94/88/848229488.db2.gz MITNYMVFOZUFOO-FZMZJTMJSA-N 0 3 413.421 4.262 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@@H](C)c1cccc(NC(C)=O)c1)c1ccsc1 ZINC000042346517 848320503 /nfs/dbraw/zinc/32/05/03/848320503.db2.gz JNVWIQWSKNYQGJ-MGPUTAFESA-N 0 3 402.564 4.150 20 0 HIADHN COc1ccc(NC(C)=O)cc1NC(=O)[C@H](C)N[C@H](C)c1cccc2ccccc21 ZINC000042636678 848336257 /nfs/dbraw/zinc/33/62/57/848336257.db2.gz LKZUIUYDNBSIAC-CVEARBPZSA-N 0 3 405.498 4.485 20 0 HIADHN CN(C)[C@H](CNC(=O)c1ccccc1SCc1cscn1)Cc1ccccc1 ZINC000043109649 848385648 /nfs/dbraw/zinc/38/56/48/848385648.db2.gz KVQKTGXEXBWYNL-IBGZPJMESA-N 0 3 411.596 4.338 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N[C@H](C)c3ccc(OC)c(F)c3)c(C)c2)CC1 ZINC000043522719 848435715 /nfs/dbraw/zinc/43/57/15/848435715.db2.gz HCPLYBJXCQBLEE-QGZVFWFLSA-N 0 3 414.525 4.167 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N[C@@H](C)c3ccc(OC)c(F)c3)c(C)c2)CC1 ZINC000043522715 848436198 /nfs/dbraw/zinc/43/61/98/848436198.db2.gz HCPLYBJXCQBLEE-KRWDZBQOSA-N 0 3 414.525 4.167 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)cc1 ZINC000043653777 848446873 /nfs/dbraw/zinc/44/68/73/848446873.db2.gz RNMTZNXLSRELIP-IBGZPJMESA-N 0 3 400.548 4.301 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1csc(Br)c1)c1cccc(OC)c1 ZINC000043728064 848454949 /nfs/dbraw/zinc/45/49/49/848454949.db2.gz HEUWEYIRCKNOTM-MRXNPFEDSA-N 0 3 411.365 4.332 20 0 HIADHN CC1CCN([C@@H](CNC(=O)Nc2cccc(C(=O)N(C)C)c2)c2cccs2)CC1 ZINC000043992671 848497456 /nfs/dbraw/zinc/49/74/56/848497456.db2.gz HOONNNBPZKONDM-IBGZPJMESA-N 0 3 414.575 4.045 20 0 HIADHN CC(=O)Nc1cc(NC(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)ccc1F ZINC000044016048 848500310 /nfs/dbraw/zinc/50/03/10/848500310.db2.gz FARSNUWMQHKHCG-IBGZPJMESA-N 0 3 418.538 4.440 20 0 HIADHN COc1ccc(NC(=O)N2CCN(C3CCCC3)CC2)cc1NC(=O)OC(C)(C)C ZINC000044304093 848542154 /nfs/dbraw/zinc/54/21/54/848542154.db2.gz DVZWJJUHSWSNIP-UHFFFAOYSA-N 0 3 418.538 4.134 20 0 HIADHN CC(C)(C)n1ncc(C(=O)NC[C@H](c2ccccc2)N2CCCC2)c1C(F)(F)F ZINC000045080144 848631041 /nfs/dbraw/zinc/63/10/41/848631041.db2.gz XVQPDBXVHJZEKF-QGZVFWFLSA-N 0 3 408.468 4.224 20 0 HIADHN COc1cc(-c2nc(CN(C)CCCN(C)Cc3ccco3)cs2)ccc1O ZINC000436742367 861925706 /nfs/dbraw/zinc/92/57/06/861925706.db2.gz VYYRKMXDORSGPO-UHFFFAOYSA-N 0 3 401.532 4.071 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N(C)Cc1ccc(OC)c(F)c1)c1cccc(OC)c1 ZINC000045596093 848698015 /nfs/dbraw/zinc/69/80/15/848698015.db2.gz NONBOZQRMYZDDH-OAQYLSRUSA-N 0 3 417.525 4.067 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(NC(=O)C2CC2)cc1)C(=O)Nc1ccc(OC(F)F)cc1 ZINC000045812658 848732540 /nfs/dbraw/zinc/73/25/40/848732540.db2.gz NHDBZLLQZIIYNC-KBPBESRZSA-N 0 3 417.456 4.314 20 0 HIADHN N#CC(C(=O)C1CCN(C(=O)c2ccc(F)cc2F)CC1)c1ccc2ccccc2n1 ZINC000047375532 849035062 /nfs/dbraw/zinc/03/50/62/849035062.db2.gz BTGJTUVYPKJAHN-IBGZPJMESA-N 0 3 419.431 4.242 20 0 HIADHN CC(C)[C@@H](NC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)Nc1cccc(CN(C)C)c1 ZINC000047453367 849051128 /nfs/dbraw/zinc/05/11/28/849051128.db2.gz PDGJOWVEOWGRRH-HUUFRCNWSA-N 0 3 411.590 4.044 20 0 HIADHN COc1ccc([C@@H](CNC(=O)Nc2cccc(OC(F)F)c2)N2CCCC2)cc1 ZINC000047909799 849136519 /nfs/dbraw/zinc/13/65/19/849136519.db2.gz GZUYNAIGTDPEKT-LJQANCHMSA-N 0 3 405.445 4.255 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)N[C@@H](c1ccccc1)c1ccccn1 ZINC000047948754 849143067 /nfs/dbraw/zinc/14/30/67/849143067.db2.gz VAVBOOHPTBZITI-RPWUZVMVSA-N 0 3 400.526 4.307 20 0 HIADHN COc1cc(C)c([C@@H](C)NC(=O)NC[C@H](c2cccs2)N2CCCC2)cc1OC ZINC000047951697 849144160 /nfs/dbraw/zinc/14/41/60/849144160.db2.gz WUXKNNQSIWUOJI-SJLPKXTDSA-N 0 3 417.575 4.271 20 0 HIADHN CCOc1ccccc1-c1cc(C(=O)N2CCCN(Cc3ccccc3C)CC2)[nH]n1 ZINC000048153240 849181845 /nfs/dbraw/zinc/18/18/45/849181845.db2.gz WCPJCGHHTAGHEH-UHFFFAOYSA-N 0 3 418.541 4.132 20 0 HIADHN CC1CCN([C@H](CNC(=O)CCSCc2ccccn2)c2cccs2)CC1 ZINC000048299534 849205176 /nfs/dbraw/zinc/20/51/76/849205176.db2.gz CQXKJPHTZZCVMK-LJQANCHMSA-N 0 3 403.617 4.356 20 0 HIADHN Cc1nn(-c2ccc(F)cc2F)c(C)c1CNCc1ccccc1Cn1cccn1 ZINC000048685635 849255237 /nfs/dbraw/zinc/25/52/37/849255237.db2.gz SFCPLWLTUCUUCA-UHFFFAOYSA-N 0 3 407.468 4.302 20 0 HIADHN C[C@@H]([NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1)c1cccc(-c2ccncc2)c1 ZINC000436826696 862007533 /nfs/dbraw/zinc/00/75/33/862007533.db2.gz IFSVRTYCSWPJPC-GOSISDBHSA-N 0 3 401.510 4.410 20 0 HIADHN CCc1ccc(C(=O)N(C[C@H]2CC[N@H+](Cc3ccccc3)C2)CC(F)(F)F)c([O-])c1 ZINC000436832427 862013086 /nfs/dbraw/zinc/01/30/86/862013086.db2.gz IXUYLISWBSRKIW-IBGZPJMESA-N 0 3 420.475 4.481 20 0 HIADHN CCc1ccc(C(=O)N(C[C@H]2CC[N@@H+](Cc3ccccc3)C2)CC(F)(F)F)c([O-])c1 ZINC000436832427 862013098 /nfs/dbraw/zinc/01/30/98/862013098.db2.gz IXUYLISWBSRKIW-IBGZPJMESA-N 0 3 420.475 4.481 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2ccc(N3C[C@@H](C)O[C@@H](C)C3)cc2)N(C)C)cc1 ZINC000050080066 849350538 /nfs/dbraw/zinc/35/05/38/849350538.db2.gz MWJRWKOCTBJVLE-YYDVJCTNSA-N 0 3 410.562 4.033 20 0 HIADHN O=C(NC1CCN(Cc2ccc(OCc3cccnc3)cc2)CC1)c1ccsc1 ZINC000050961523 849423276 /nfs/dbraw/zinc/42/32/76/849423276.db2.gz CAPWCNBQXDVZAS-UHFFFAOYSA-N 0 3 407.539 4.117 20 0 HIADHN COc1ccccc1[C@H](C)NC(=O)[C@H](C)N(C)C[C@@H]1CCCO[C@@H]1c1ccccc1 ZINC000051132495 849434470 /nfs/dbraw/zinc/43/44/70/849434470.db2.gz NGPGFKXMEZLWLP-OEEHMVQOSA-N 0 3 410.558 4.361 20 0 HIADHN CN(CC(=O)N(C)Cc1ccc(Cl)s1)C[C@H]1CCCO[C@@H]1c1ccccc1 ZINC000051132980 849434502 /nfs/dbraw/zinc/43/45/02/849434502.db2.gz BMTRIXHNBXHHHK-DYESRHJHSA-N 0 3 406.979 4.460 20 0 HIADHN CC(=O)N[C@@H](C(=O)C(C#N)c1nc(-c2ccc(Cl)cc2)cs1)C1CCCC1 ZINC000051156265 849438117 /nfs/dbraw/zinc/43/81/17/849438117.db2.gz JNRWEYIRXLEHBH-SJLPKXTDSA-N 0 3 401.919 4.335 20 0 HIADHN CCN(Cc1cc(=O)n2c3ccccc3[nH]c2c1C#N)[C@@H](C)c1cccc(OC)c1 ZINC000052706421 849616251 /nfs/dbraw/zinc/61/62/51/849616251.db2.gz JVCJPYQQJWTUBD-OXJNMPFZSA-N 0 3 400.482 4.315 20 0 HIADHN O=C(Nc1cc(Cl)ccc1[O-])C1CC[NH+](Cc2ccc(-n3cccn3)cc2)CC1 ZINC000053019764 849656263 /nfs/dbraw/zinc/65/62/63/849656263.db2.gz KYEBUGBNLHQYCF-UHFFFAOYSA-N 0 3 410.905 4.082 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)c1cc(-c2ccc(C)cc2)no1 ZINC000053120877 849669949 /nfs/dbraw/zinc/66/99/49/849669949.db2.gz UFVYHRPCQZXQRZ-OAQYLSRUSA-N 0 3 404.514 4.172 20 0 HIADHN Cc1nn(-c2ccc(C(=O)N(CC(C)C)C3CCN(C)CC3)cc2)c(C)c1Cl ZINC000053222346 849681089 /nfs/dbraw/zinc/68/10/89/849681089.db2.gz AFBDGYGVHIYERR-UHFFFAOYSA-N 0 3 402.970 4.335 20 0 HIADHN CC(C)c1ccc(-c2noc(CCC(=O)NCCN(C)Cc3ccccc3)n2)cc1 ZINC000053349478 849698206 /nfs/dbraw/zinc/69/82/06/849698206.db2.gz OPRLUGOPQHVAEH-UHFFFAOYSA-N 0 3 406.530 4.041 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)N1CCC(OCc2ccccc2)CC1 ZINC000053540929 849728550 /nfs/dbraw/zinc/72/85/50/849728550.db2.gz AFMFZPZXDFFUHU-XMMPIXPASA-N 0 3 407.558 4.214 20 0 HIADHN COc1cccc([C@@H](CNC(=O)N[C@@H](C)c2ccc(OC)c(F)c2)N2CCCC2)c1 ZINC000053553117 849730814 /nfs/dbraw/zinc/73/08/14/849730814.db2.gz XQPNYFCAHNDDFO-HRAATJIYSA-N 0 3 415.509 4.040 20 0 HIADHN CN(Cc1nc2ccccc2s1)C(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000053548468 849731292 /nfs/dbraw/zinc/73/12/92/849731292.db2.gz HVNAFLLDQRAZGM-MRXNPFEDSA-N 0 3 400.573 4.336 20 0 HIADHN Brc1ccc([C@@H](NCc2cnc(N3CCCC3)nc2)C2CCC2)cc1 ZINC000054178179 849821799 /nfs/dbraw/zinc/82/17/99/849821799.db2.gz VAMUBEYJSJMKSL-IBGZPJMESA-N 0 3 401.352 4.470 20 0 HIADHN Cc1cc(NC(=O)C2CCN(Cc3ccc(C(=O)Nc4ccccc4)cc3)CC2)no1 ZINC000054359840 849851826 /nfs/dbraw/zinc/85/18/26/849851826.db2.gz HXEHLAIHLIYKPM-UHFFFAOYSA-N 0 3 418.497 4.086 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)Nc2ccc(NC(=O)c3ccco3)cc2)C1 ZINC000054387513 849856779 /nfs/dbraw/zinc/85/67/79/849856779.db2.gz ADHAPCIJPDROKM-UWJYYQICSA-N 0 3 418.497 4.489 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)Nc2ccc(C(=O)NC(C)(C)C)cc2)C1 ZINC000054405676 849861821 /nfs/dbraw/zinc/86/18/21/849861821.db2.gz SGKOSBMWVAPLBX-UTKZUKDTSA-N 0 3 408.546 4.172 20 0 HIADHN Cc1cc(C)cc(C(=O)N2CCC[C@H](C(=O)C(C#N)c3nc4ccccc4o3)C2)c1 ZINC000054735692 849915939 /nfs/dbraw/zinc/91/59/39/849915939.db2.gz RMLTXMHRQSORGX-HKUYNNGSSA-N 0 3 401.466 4.173 20 0 HIADHN C[C@@H](NC(=O)NCCN(C)Cc1ccccc1)c1ccc(OCc2cccnc2)cc1 ZINC000054764081 849919227 /nfs/dbraw/zinc/91/92/27/849919227.db2.gz FJRFHIBDATWXNA-HXUWFJFHSA-N 0 3 418.541 4.153 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=S)Nc1cccc(Br)c1 ZINC000054974389 849949528 /nfs/dbraw/zinc/94/95/28/849949528.db2.gz WEZKTHOVDRSLKN-UHFFFAOYSA-N 0 3 410.356 4.349 20 0 HIADHN CN(C)Cc1ccccc1NC(=O)[C@@H]1CC(=O)N(c2cc(Cl)cc(Cl)c2)C1 ZINC000055228215 849990619 /nfs/dbraw/zinc/99/06/19/849990619.db2.gz DHXBGHZCPUHOLF-CQSZACIVSA-N 0 3 406.313 4.047 20 0 HIADHN CN(C)Cc1ccccc1NC(=O)[C@H]1CC(=O)N(c2cc(Cl)cc(Cl)c2)C1 ZINC000055228219 849990987 /nfs/dbraw/zinc/99/09/87/849990987.db2.gz DHXBGHZCPUHOLF-AWEZNQCLSA-N 0 3 406.313 4.047 20 0 HIADHN C[C@H](OC[C@H](O)CN1CCC(C(=O)c2ccccc2)CC1)c1ccc(Cl)cc1 ZINC000055471975 850033141 /nfs/dbraw/zinc/03/31/41/850033141.db2.gz RXNQIBAVVPHASO-HTAPYJJXSA-N 0 3 401.934 4.373 20 0 HIADHN Cc1cccc(-c2nnc(-c3ccc(C(=O)NC[C@@H](C)N4CCCCC4)cc3)o2)c1 ZINC000055934841 850210385 /nfs/dbraw/zinc/21/03/85/850210385.db2.gz BURJCJGJTFIQKE-GOSISDBHSA-N 0 3 404.514 4.316 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCc3ccccc3OC(C)C)c(C)c2)CC1 ZINC000056563238 850394239 /nfs/dbraw/zinc/39/42/39/850394239.db2.gz BLDQIKOVFZGVPM-UHFFFAOYSA-N 0 3 410.562 4.246 20 0 HIADHN CCN(CC)C(=O)c1ccccc1NC(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000056754128 850467784 /nfs/dbraw/zinc/46/77/84/850467784.db2.gz AHZSHNZQAULNQV-ICSRJNTNSA-N 0 3 408.546 4.126 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)Nc1ccccc1OC[C@H]1CCCCO1 ZINC000056784591 850480969 /nfs/dbraw/zinc/48/09/69/850480969.db2.gz UFPWRBSOCMDKNM-OAQYLSRUSA-N 0 3 411.546 4.230 20 0 HIADHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)Cc1c[nH]c2ccccc12 ZINC000056996998 850530708 /nfs/dbraw/zinc/53/07/08/850530708.db2.gz VZMOLMNJCSOYJV-UHFFFAOYSA-N 0 3 414.347 4.063 20 0 HIADHN CCc1ccc([C@H](CNC(=O)Nc2cc(NC(=O)C3CC3)ccc2C)N(C)C)cc1 ZINC000057543433 850664991 /nfs/dbraw/zinc/66/49/91/850664991.db2.gz MQTKZHOMLALSSP-QFIPXVFZSA-N 0 3 408.546 4.330 20 0 HIADHN Cc1cc(C)n(-c2ccccc2NC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)n1 ZINC000058025199 850752384 /nfs/dbraw/zinc/75/23/84/850752384.db2.gz BBRGCUXSIHVMQB-NRFANRHFSA-N 0 3 403.530 4.275 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)Nc1cccc(OCC(F)(F)F)c1 ZINC000058076308 850763689 /nfs/dbraw/zinc/76/36/89/850763689.db2.gz QWNWONAIKOYUAY-UHFFFAOYSA-N 0 3 407.436 4.198 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)Nc3ccc(N(C)C)cc3C)CC2)c1 ZINC000058551839 850853826 /nfs/dbraw/zinc/85/38/26/850853826.db2.gz NUIPAYUZKWEGNJ-UHFFFAOYSA-N 0 3 423.605 4.093 20 0 HIADHN C[C@@H](Sc1nc2ccc(Cl)cc2[nH]1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000058593201 850863947 /nfs/dbraw/zinc/86/39/47/850863947.db2.gz AGWGIIJOKJLKCQ-RHSMWYFYSA-N 0 3 414.962 4.088 20 0 HIADHN Cc1c(C(=O)Nc2ccc3oc(=O)n(CCN(C)C)c3c2)sc2cccc(F)c12 ZINC000058739393 850908678 /nfs/dbraw/zinc/90/86/78/850908678.db2.gz CJPHMRNRQGRPBR-UHFFFAOYSA-N 0 3 413.474 4.071 20 0 HIADHN CCN(CC)C(=O)c1ccc(NC(=O)NC[C@@H](c2cccs2)N2CCCC2)cc1 ZINC000058864099 850946343 /nfs/dbraw/zinc/94/63/43/850946343.db2.gz SPZMIQNQFCAQBA-IBGZPJMESA-N 0 3 414.575 4.189 20 0 HIADHN CCN(C[C@@H]1COc2ccccc2O1)C(=O)NC[C@@H](c1ccsc1)N(CC)CC ZINC000059308170 850994591 /nfs/dbraw/zinc/99/45/91/850994591.db2.gz GRKNMLYULJOUTE-MOPGFXCFSA-N 0 3 417.575 4.003 20 0 HIADHN COc1ccc(-c2nc(CN3CCN(CCC(C)(C)C)CC3)cs2)c(OC)c1 ZINC000059812237 851014812 /nfs/dbraw/zinc/01/48/12/851014812.db2.gz SDGZPBVRFPGAHB-UHFFFAOYSA-N 0 3 403.592 4.381 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)c1ccc(F)c(C(F)(F)F)c1 ZINC000060167948 851047818 /nfs/dbraw/zinc/04/78/18/851047818.db2.gz QNPJDQNXLBBYOC-UHFFFAOYSA-N 0 3 404.354 4.327 20 0 HIADHN Cc1cc(C)n(-c2ccc(C(=O)NC[C@@H](c3ccc(C)cc3)N3CCCC3)cc2)n1 ZINC000060238971 851054494 /nfs/dbraw/zinc/05/44/94/851054494.db2.gz BQSBBPDWIWNHLK-DEOSSOPVSA-N 0 3 402.542 4.364 20 0 HIADHN CCCN(C(=O)c1ccc(-c2ccco2)[nH]c1=O)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000060351759 851073328 /nfs/dbraw/zinc/07/33/28/851073328.db2.gz HGTXKXRVOJHSFR-HXUWFJFHSA-N 0 3 419.525 4.152 20 0 HIADHN O=C(N[C@H]1CCN(C2CC2)C1)c1cc(-c2nc3ccccc3s2)nc2ccccc21 ZINC000060470434 851110528 /nfs/dbraw/zinc/11/05/28/851110528.db2.gz UQGLGADSJBGMAG-HNNXBMFYSA-N 0 3 414.534 4.478 20 0 HIADHN CCc1ccc(-c2nn(-c3ccccc3)cc2C(=O)N[C@@H]2CCN(C3CC3)C2)cc1 ZINC000060470358 851111025 /nfs/dbraw/zinc/11/10/25/851111025.db2.gz UGFPLPBARHGAKI-HXUWFJFHSA-N 0 3 400.526 4.068 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)NCc1cc2ccccc2[nH]1 ZINC000060584963 851157224 /nfs/dbraw/zinc/15/72/24/851157224.db2.gz QAJBVJWWQFFRLV-UHFFFAOYSA-N 0 3 418.463 4.460 20 0 HIADHN Cc1nn(Cc2ccccc2)c(Cl)c1CNCC1(N2CCOCC2)CCCCC1 ZINC000061013575 851273156 /nfs/dbraw/zinc/27/31/56/851273156.db2.gz BJBGAFRVSMRSKY-UHFFFAOYSA-N 0 3 416.997 4.018 20 0 HIADHN CCOc1cc(CNCc2ccc(C)s2)ccc1OCC(=O)N1CCCCC1 ZINC000061107322 851294854 /nfs/dbraw/zinc/29/48/54/851294854.db2.gz RFGUIFBNAZLTRD-UHFFFAOYSA-N 0 3 402.560 4.136 20 0 HIADHN CN(C)[C@H](CNC(=O)N[C@H]1CCSc2ccc(Cl)cc21)Cc1ccccc1 ZINC000061195535 851314742 /nfs/dbraw/zinc/31/47/42/851314742.db2.gz BMWIEKFGOYSXGK-HKUYNNGSSA-N 0 3 403.979 4.349 20 0 HIADHN O=C(NCc1cccc(OCC(F)(F)F)c1)NC[C@H](c1ccccc1)N1CCCC1 ZINC000061229856 851322953 /nfs/dbraw/zinc/32/29/53/851322953.db2.gz JQGNMTURYBJMSN-HXUWFJFHSA-N 0 3 421.463 4.264 20 0 HIADHN Cc1ccc(CSCC(=O)Nc2ccc(CCN3CCSCC3)cc2)cc1 ZINC000061289191 851339677 /nfs/dbraw/zinc/33/96/77/851339677.db2.gz KIJFNGMGWPZADA-UHFFFAOYSA-N 0 3 400.613 4.458 20 0 HIADHN CCOc1cccc2c1OCC(C(=O)Nc1ccc(CCN3CCSCC3)cc1)=C2 ZINC000061287694 851339905 /nfs/dbraw/zinc/33/99/05/851339905.db2.gz XBQPWZACAMSIGO-UHFFFAOYSA-N 0 3 424.566 4.091 20 0 HIADHN O=C(CCOc1ccccc1Cl)Nc1ccc(CCN2CCSCC2)cc1 ZINC000061287947 851339981 /nfs/dbraw/zinc/33/99/81/851339981.db2.gz ZVUUVBKNZGVIRI-UHFFFAOYSA-N 0 3 404.963 4.339 20 0 HIADHN C[C@@H](NC(=O)NCCCN1CCN(C)C[C@@H]1c1ccccc1)c1cc2ccccc2o1 ZINC000061449476 851381499 /nfs/dbraw/zinc/38/14/99/851381499.db2.gz NMYRNSQWUILZSU-DENIHFKCSA-N 0 3 420.557 4.172 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CC(=O)NC[C@@H](c1ccc(C)cc1)N1CCCC1 ZINC000061503166 851390920 /nfs/dbraw/zinc/39/09/20/851390920.db2.gz LESARSDJVIWGSS-VWLOTQADSA-N 0 3 416.569 4.293 20 0 HIADHN CSCc1nc2ccccc2n1CC(=O)NC[C@@H](c1ccc(C)cc1)N1CCCC1 ZINC000061503067 851391284 /nfs/dbraw/zinc/39/12/84/851391284.db2.gz URLULJURGJCASR-QFIPXVFZSA-N 0 3 422.598 4.161 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2ccccc2N2CCCC2=O)N2CCCC2)cc1 ZINC000061748348 851438973 /nfs/dbraw/zinc/43/89/73/851438973.db2.gz WILOGMAGPBMVHN-QFIPXVFZSA-N 0 3 406.530 4.080 20 0 HIADHN C[C@H](OC(=O)C1CCN(c2ccccc2Br)C1=O)c1ccccc1F ZINC000061753233 851441556 /nfs/dbraw/zinc/44/15/56/851441556.db2.gz LBRLLVOEUAQURI-JSGCOSHPSA-N 0 3 406.251 4.246 20 0 HIADHN C[C@H](NC(=O)Nc1ccc(CCN2CCSCC2)cc1)c1nc2ccccc2[nH]1 ZINC000061790747 851454469 /nfs/dbraw/zinc/45/44/69/851454469.db2.gz KAUDGQALYQOAKF-INIZCTEOSA-N 0 3 409.559 4.037 20 0 HIADHN O=C(NCc1nc2ccccc2s1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000061793362 851455654 /nfs/dbraw/zinc/45/56/54/851455654.db2.gz NYQWXXOVLFSFCQ-UHFFFAOYSA-N 0 3 412.584 4.209 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)Nc1ccc(N(C)C)cc1 ZINC000062368979 851530702 /nfs/dbraw/zinc/53/07/02/851530702.db2.gz PEXIDSNGOQETAF-UHFFFAOYSA-N 0 3 408.468 4.367 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)Nc1ccccc1Br ZINC000062368106 851530992 /nfs/dbraw/zinc/53/09/92/851530992.db2.gz VRHVJQZZLLZBPP-UHFFFAOYSA-N 0 3 412.278 4.323 20 0 HIADHN CCC(=O)Nc1ccc(NC(=O)N(CCN(C)C)Cc2cccc(Cl)c2)cc1 ZINC000062393319 851539442 /nfs/dbraw/zinc/53/94/42/851539442.db2.gz HCOJAFPONYWDNP-UHFFFAOYSA-N 0 3 402.926 4.284 20 0 HIADHN CC(C)NC(=O)c1ccc(NC(=O)N(CCN(C)C)Cc2cccc(Cl)c2)cc1 ZINC000062402744 851541907 /nfs/dbraw/zinc/54/19/07/851541907.db2.gz SARJMUWQZJMQBQ-UHFFFAOYSA-N 0 3 416.953 4.074 20 0 HIADHN CC(=O)Nc1ccc(Cl)c(NC(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)c1 ZINC000062404529 851542683 /nfs/dbraw/zinc/54/26/83/851542683.db2.gz UARGWLWUXHBAMO-UHFFFAOYSA-N 0 3 424.879 4.172 20 0 HIADHN CC(=O)Nc1ccc(Cl)c(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2F)c1 ZINC000062404531 851542918 /nfs/dbraw/zinc/54/29/18/851542918.db2.gz PLIGCBPLBAQLCH-UHFFFAOYSA-N 0 3 424.879 4.172 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)Nc1ccc(N2CCCC2)c(F)c1 ZINC000062403181 851543086 /nfs/dbraw/zinc/54/30/86/851543086.db2.gz WSRGFYBMIRIIBC-UHFFFAOYSA-N 0 3 420.479 4.300 20 0 HIADHN COc1cc(CNCc2ccccc2-n2cccn2)ccc1OCc1c(C)noc1C ZINC000062425943 851550748 /nfs/dbraw/zinc/55/07/48/851550748.db2.gz QLGUHPYLSQHCAB-UHFFFAOYSA-N 0 3 418.497 4.355 20 0 HIADHN O=C(NCc1ccncc1)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000062473605 851559189 /nfs/dbraw/zinc/55/91/89/851559189.db2.gz VXKHBYHETWHSME-UHFFFAOYSA-N 0 3 407.345 4.196 20 0 HIADHN CC(C)Oc1ccc(CCNC(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)cc1 ZINC000062484933 851562333 /nfs/dbraw/zinc/56/23/33/851562333.db2.gz JZTIDYJPPJZXFH-UHFFFAOYSA-N 0 3 419.516 4.068 20 0 HIADHN CC(C)COc1cccc(CNC(=O)N(CCN(C)C)Cc2cccc(F)c2)c1 ZINC000062501173 851565750 /nfs/dbraw/zinc/56/57/50/851565750.db2.gz LWNQDUATTHUUAD-UHFFFAOYSA-N 0 3 401.526 4.134 20 0 HIADHN CC(=O)c1cccc(O[C@@H](C)C(=O)N[C@H](CN2CCc3ccccc3C2)C(C)(C)C)c1 ZINC000062880448 851596304 /nfs/dbraw/zinc/59/63/04/851596304.db2.gz CDKKRZARCVCIMN-YADARESESA-N 0 3 422.569 4.246 20 0 HIADHN COc1ccc([C@@H](CNC(=O)NCCc2ccccc2Cl)N2CCCC2)cc1 ZINC000063070797 851610289 /nfs/dbraw/zinc/61/02/89/851610289.db2.gz QJDCKALBWIBGRQ-OAQYLSRUSA-N 0 3 401.938 4.027 20 0 HIADHN COc1ccc([C@H]2CCCN2C(=S)NC2CCN(Cc3ccccc3)CC2)cc1 ZINC000063144412 851619846 /nfs/dbraw/zinc/61/98/46/851619846.db2.gz QTKGOJMAMJQBPS-HSZRJFAPSA-N 0 3 409.599 4.371 20 0 HIADHN CCN(CC)C(=O)c1ccc(NC(=S)NC2CCN(Cc3ccccc3)CC2)cc1 ZINC000063144054 851620384 /nfs/dbraw/zinc/62/03/84/851620384.db2.gz HYEPDNKGWBSIOR-UHFFFAOYSA-N 0 3 424.614 4.120 20 0 HIADHN C[C@H]1CCCN(CC(=O)N(Cc2nnc(-c3ccccc3Cl)o2)C2CC2)CC1 ZINC000063308817 851656882 /nfs/dbraw/zinc/65/68/82/851656882.db2.gz JYTKQCCRMCIMFX-HNNXBMFYSA-N 0 3 402.926 4.003 20 0 HIADHN CCOCCOc1c(Cl)cccc1NC(=O)N1CCN(CC2CCCCC2)CC1 ZINC000063397614 851677264 /nfs/dbraw/zinc/67/72/64/851677264.db2.gz SGNPIOQJTNNKES-UHFFFAOYSA-N 0 3 423.985 4.485 20 0 HIADHN CC(C)Cc1nc(C(=O)N(CCN(C)C)Cc2ccc(Br)cc2)cs1 ZINC000063661752 851736401 /nfs/dbraw/zinc/73/64/01/851736401.db2.gz YTRDDIFGRKNYCY-UHFFFAOYSA-N 0 3 424.408 4.308 20 0 HIADHN Cc1ccccc1CN1CCCN(C(=O)NCc2cccc(Br)c2)CC1 ZINC000063796370 851765713 /nfs/dbraw/zinc/76/57/13/851765713.db2.gz OKJPVDFQJRJBDA-UHFFFAOYSA-N 0 3 416.363 4.175 20 0 HIADHN C[C@@H](OC(=O)C1CCN(c2ccc(Cl)cc2)C1=O)c1nc(-c2cccs2)no1 ZINC000064001665 851813110 /nfs/dbraw/zinc/81/31/10/851813110.db2.gz TZEQDHXEWJPNEY-BXUZGUMPSA-N 0 3 417.874 4.109 20 0 HIADHN COCCOc1ccc(C(F)(F)F)cc1NC(=O)[C@@H](C)N(C)CC1CCCC1 ZINC000064014538 851815311 /nfs/dbraw/zinc/81/53/11/851815311.db2.gz DJKHMOZDHNFEFR-CQSZACIVSA-N 0 3 402.457 4.180 20 0 HIADHN O=C(N1CCN(CC2CCCCC2)CC1)C1(c2ccc(Cl)cc2)CCOCC1 ZINC000064126009 851832124 /nfs/dbraw/zinc/83/21/24/851832124.db2.gz YXNRPQBPSJPNIT-UHFFFAOYSA-N 0 3 404.982 4.113 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N2CCc3[nH]c4ccccc4c3C2)N2CCCC2)cc1 ZINC000064237476 851855175 /nfs/dbraw/zinc/85/51/75/851855175.db2.gz QYQGWGXVACFUOV-XMMPIXPASA-N 0 3 402.542 4.381 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)cc1 ZINC000064334657 851874581 /nfs/dbraw/zinc/87/45/81/851874581.db2.gz XMMJLQVTMMTJGF-NRFANRHFSA-N 0 3 406.448 4.108 20 0 HIADHN COc1ccc(NC(=S)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)cc1 ZINC000064371321 851880573 /nfs/dbraw/zinc/88/05/73/851880573.db2.gz IKCULBFDGHZHKY-UHFFFAOYSA-N 0 3 411.493 4.475 20 0 HIADHN Cc1ccc(CNC(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)cc1F ZINC000064412272 851891161 /nfs/dbraw/zinc/89/11/61/851891161.db2.gz BRUCVBSQIAEHTE-UHFFFAOYSA-N 0 3 411.443 4.426 20 0 HIADHN CC(C)(C)n1nc(C(=O)NC[C@H]2CCCN(Cc3cccs3)C2)cc1C1CC1 ZINC000064521339 851918755 /nfs/dbraw/zinc/91/87/55/851918755.db2.gz YHCZOTQMUGVIPB-MRXNPFEDSA-N 0 3 400.592 4.219 20 0 HIADHN Cc1onc(-c2ccc(F)cc2)c1C(=O)NC[C@H]1CCCN(Cc2cccs2)C1 ZINC000064521492 851918849 /nfs/dbraw/zinc/91/88/49/851918849.db2.gz FDCMKGHBRGOFCF-MRXNPFEDSA-N 0 3 413.518 4.493 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1cccc(-c2noc(C)n2)c1)c1cccc(OC)c1 ZINC000064545152 851925144 /nfs/dbraw/zinc/92/51/44/851925144.db2.gz AQHZFCKXSNOSKB-NRFANRHFSA-N 0 3 423.517 4.258 20 0 HIADHN C[C@@H](NC(=O)c1ccccc1)C(=O)C(C#N)c1nc(-c2c(F)cccc2F)cs1 ZINC000064714958 851964926 /nfs/dbraw/zinc/96/49/26/851964926.db2.gz QLPBIFSLBHQIHT-OCCSQVGLSA-N 0 3 411.433 4.083 20 0 HIADHN COCc1ccc(CNC(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)cc1 ZINC000064755592 851977807 /nfs/dbraw/zinc/97/78/07/851977807.db2.gz ZLQZVSQVUQOFGL-UHFFFAOYSA-N 0 3 423.479 4.125 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)NCCc1ccccc1F ZINC000064753761 851977922 /nfs/dbraw/zinc/97/79/22/851977922.db2.gz XJDQUCNUJZLTGG-UHFFFAOYSA-N 0 3 411.443 4.160 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)NC[C@@H](C)c3ccc(F)cc3F)cc2)CC1 ZINC000437121942 862308962 /nfs/dbraw/zinc/30/89/62/862308962.db2.gz YYNCTGYYMQUAHB-QGZVFWFLSA-N 0 3 401.501 4.029 20 0 HIADHN CCOc1cc(CNCc2ccc3[nH]c(C)c(C)c3c2)ccc1O[C@H](C)C(=O)N(C)C ZINC000065013616 852039336 /nfs/dbraw/zinc/03/93/36/852039336.db2.gz PPVUEACBPGUQND-GOSISDBHSA-N 0 3 423.557 4.329 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cccc(NC(N)=O)c1)c1ccc(C(F)(F)F)cc1 ZINC000065121859 852071466 /nfs/dbraw/zinc/07/14/66/852071466.db2.gz UVJPOHUEHFYDMQ-SFHVURJKSA-N 0 3 422.451 4.009 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cccc2n[nH]cc21)c1ccc(C(F)(F)F)cc1 ZINC000065121751 852071627 /nfs/dbraw/zinc/07/16/27/852071627.db2.gz QVBYYTMLGUMCQD-LJQANCHMSA-N 0 3 404.436 4.395 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Cc1ccccc1OC)c1ccc(C(F)(F)F)cc1 ZINC000065121918 852071697 /nfs/dbraw/zinc/07/16/97/852071697.db2.gz XCVTWVLTKZBTLX-IBGZPJMESA-N 0 3 408.464 4.456 20 0 HIADHN CC(C)(C)N1CCCN(C(=O)CSCc2ccc(Br)cc2F)CC1 ZINC000065128321 852075260 /nfs/dbraw/zinc/07/52/60/852075260.db2.gz XIOKOOKLYKLSOM-UHFFFAOYSA-N 0 3 417.388 4.154 20 0 HIADHN O=C(Nc1ccc(NC(=O)N2CCN(CC3CCCCC3)CC2)cc1)c1ccco1 ZINC000065360127 852113383 /nfs/dbraw/zinc/11/33/83/852113383.db2.gz GTKKTKAJXKCVLH-UHFFFAOYSA-N 0 3 410.518 4.262 20 0 HIADHN Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000065376363 852116774 /nfs/dbraw/zinc/11/67/74/852116774.db2.gz CVWUWCZMCHLHCW-UGKGYDQZSA-N 0 3 422.573 4.338 20 0 HIADHN C[C@@H]1CN(c2ccccc2NC(=O)N2CCN(CC3CCCCC3)CC2)C[C@@H](C)O1 ZINC000065413459 852123833 /nfs/dbraw/zinc/12/38/33/852123833.db2.gz XTXCOZSKDDYVHL-WOJBJXKFSA-N 0 3 414.594 4.030 20 0 HIADHN Cc1c([C@H](C)NC(=O)NC[C@@H](c2ccc(C)cc2)N(C)C)cnn1-c1ccc(F)cc1 ZINC000065467678 852144706 /nfs/dbraw/zinc/14/47/06/852144706.db2.gz GJAVGDRSUGUJJQ-SBUREZEXSA-N 0 3 423.536 4.291 20 0 HIADHN COc1ccc(OC)c([C@@H]2CCCN2C(=O)NC[C@@H](c2ccc(C)cc2)N(C)C)c1 ZINC000065470058 852144839 /nfs/dbraw/zinc/14/48/39/852144839.db2.gz VZGBYTASOCBGAD-VXKWHMMOSA-N 0 3 411.546 4.162 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)NCc2cccc(OCC(F)(F)F)c2)C1 ZINC000065523017 852168201 /nfs/dbraw/zinc/16/82/01/852168201.db2.gz QPMPJUFQKFUZTO-LPHOPBHVSA-N 0 3 421.463 4.262 20 0 HIADHN CN(C)Cc1cccc(NC(=O)[C@H]2CC(=O)N(c3cc(Cl)cc(Cl)c3)C2)c1 ZINC000065637144 852206357 /nfs/dbraw/zinc/20/63/57/852206357.db2.gz JRVZULOIVFCXGP-AWEZNQCLSA-N 0 3 406.313 4.047 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=S)Nc1ccccc1C#N ZINC000065704422 852225516 /nfs/dbraw/zinc/22/55/16/852225516.db2.gz RTTZWPNCHYUAOX-UHFFFAOYSA-N 0 3 406.477 4.338 20 0 HIADHN CN(C)CCN(C(=O)c1ccc2c(c1)C[C@H](c1ccccc1)OC2=O)C1CCCCC1 ZINC000065746027 852241915 /nfs/dbraw/zinc/24/19/15/852241915.db2.gz SBRYXTCSQPDBBF-XMMPIXPASA-N 0 3 420.553 4.477 20 0 HIADHN COc1ccccc1OCc1ccc(C(=O)N(CCN(C)C)C2CCCCC2)o1 ZINC000065746479 852243513 /nfs/dbraw/zinc/24/35/13/852243513.db2.gz FUAKXOPTRZDJPI-UHFFFAOYSA-N 0 3 400.519 4.204 20 0 HIADHN CC1CCN([C@H](CNC(=O)C2(c3ccccc3)CCOCC2)c2ccccc2)CC1 ZINC000065802676 852261189 /nfs/dbraw/zinc/26/11/89/852261189.db2.gz MQBPCTSHDPLBCH-XMMPIXPASA-N 0 3 406.570 4.324 20 0 HIADHN COc1cc(Br)cc(C)c1NC(=O)N1CCN(CCC(C)(C)C)CC1 ZINC000065818098 852268046 /nfs/dbraw/zinc/26/80/46/852268046.db2.gz RFSXOYFCWIANSK-UHFFFAOYSA-N 0 3 412.372 4.352 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccc(F)c2)C1)N1CCC(OCc2ccccc2)CC1 ZINC000065858773 852286740 /nfs/dbraw/zinc/28/67/40/852286740.db2.gz AGFGSIJNERXQIQ-JOCHJYFZSA-N 0 3 410.533 4.246 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)c1ccc(NC(=O)c2ccccc2)cc1 ZINC000065931662 852321934 /nfs/dbraw/zinc/32/19/34/852321934.db2.gz WFLWXAJZEGIEID-UHFFFAOYSA-N 0 3 419.500 4.282 20 0 HIADHN COc1ccc(SCCC(=O)N(CCN(C)C)Cc2ccc(F)cc2F)cc1 ZINC000065937900 852326953 /nfs/dbraw/zinc/32/69/53/852326953.db2.gz KDYDTZHPKNJSPL-UHFFFAOYSA-N 0 3 408.514 4.046 20 0 HIADHN CCSc1cc(C(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)ccn1 ZINC000065938865 852327640 /nfs/dbraw/zinc/32/76/40/852327640.db2.gz ZVJPNTAYIHNOFJ-UHFFFAOYSA-N 0 3 411.493 4.416 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)c1[nH]c2ccccc2c1Br ZINC000065939535 852327748 /nfs/dbraw/zinc/32/77/48/852327748.db2.gz RFAZVPAGLONACJ-UHFFFAOYSA-N 0 3 418.310 4.274 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)Cc1ccc(Cl)c(Cl)c1 ZINC000065938775 852328012 /nfs/dbraw/zinc/32/80/12/852328012.db2.gz QIJCKJNOLUXCPH-UHFFFAOYSA-N 0 3 401.284 4.405 20 0 HIADHN COc1ccccc1OCCC(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1 ZINC000065938993 852328072 /nfs/dbraw/zinc/32/80/72/852328072.db2.gz YAZLWSSVVMPGSQ-UHFFFAOYSA-N 0 3 424.463 4.073 20 0 HIADHN Cc1ccc(-c2cnc(CCC(=O)N(CCN(C)C)Cc3cccc(F)c3)o2)cc1 ZINC000065939827 852329212 /nfs/dbraw/zinc/32/92/12/852329212.db2.gz PVLJWJUWVVUMCE-UHFFFAOYSA-N 0 3 409.505 4.312 20 0 HIADHN CN(C)c1ccc(CN(C)C(=O)CN2CCC(c3cc4ccccc4[nH]3)CC2)cc1 ZINC000065966086 852335724 /nfs/dbraw/zinc/33/57/24/852335724.db2.gz TVBMFPSKCOBMMG-UHFFFAOYSA-N 0 3 404.558 4.072 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2CNCCNC(=O)c2ccccc2)cc1 ZINC000065979402 852338050 /nfs/dbraw/zinc/33/80/50/852338050.db2.gz GTLKGYBDFMKVCP-UHFFFAOYSA-N 0 3 410.521 4.367 20 0 HIADHN O=C(CCNCc1cccc(NC(=O)c2ccccc2Cl)c1)Nc1ccccn1 ZINC000065977712 852338738 /nfs/dbraw/zinc/33/87/38/852338738.db2.gz ZVBHAYVTPGYQQU-UHFFFAOYSA-N 0 3 408.889 4.106 20 0 HIADHN COc1cc(CNCc2ccc(-c3ccccc3)cc2)ccc1OCC(=O)N(C)C ZINC000065981260 852339530 /nfs/dbraw/zinc/33/95/30/852339530.db2.gz VUZAVXOQXYCCSR-UHFFFAOYSA-N 0 3 404.510 4.119 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=S)Nc2ccc(Oc3ccccc3)cc2)CC1 ZINC000066007907 852354327 /nfs/dbraw/zinc/35/43/27/852354327.db2.gz IYFLQHBTXAEYRB-IBGZPJMESA-N 0 3 412.603 4.039 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=S)Nc2c(C(C)C)cccc2C(C)C)CC1 ZINC000066007894 852354420 /nfs/dbraw/zinc/35/44/20/852354420.db2.gz RTMPAQFQRCPLPM-LJQANCHMSA-N 0 3 404.668 4.493 20 0 HIADHN CN(C)[C@@H](CNC(=O)c1ccc(-c2nc3ccccc3s2)o1)Cc1ccccc1 ZINC000069231006 852389111 /nfs/dbraw/zinc/38/91/11/852389111.db2.gz MHOSTSFPSCRVTO-QGZVFWFLSA-N 0 3 405.523 4.459 20 0 HIADHN CC1CCN([C@@H](CNC(=O)c2ccc(Cn3cccn3)cc2)c2ccccc2)CC1 ZINC000072006803 852462343 /nfs/dbraw/zinc/46/23/43/852462343.db2.gz YVZYXSYDJGNATN-DEOSSOPVSA-N 0 3 402.542 4.134 20 0 HIADHN O=C(CSCc1ccco1)Nc1ccc(N2CCN(Cc3ccccc3)CC2)cc1 ZINC000097027776 852575411 /nfs/dbraw/zinc/57/54/11/852575411.db2.gz PDOURPYAKBXRSR-UHFFFAOYSA-N 0 3 421.566 4.474 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)c1cnc2ccccc2c1C(F)(F)F ZINC000097214764 852590786 /nfs/dbraw/zinc/59/07/86/852590786.db2.gz BXEGLLRYPGGPFN-UHFFFAOYSA-N 0 3 413.443 4.432 20 0 HIADHN CC[C@H](CNC(=O)c1cc(C)n(Cc2ccccn2)c1C)N1CCc2ccccc2C1 ZINC000097286222 852597744 /nfs/dbraw/zinc/59/77/44/852597744.db2.gz CUYRLGVJERSTRV-XMMPIXPASA-N 0 3 416.569 4.115 20 0 HIADHN CCN(CC)[C@H](CNC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccsc1 ZINC000097327269 852601301 /nfs/dbraw/zinc/60/13/01/852601301.db2.gz LSVWLCGVIUDCSZ-QZTJIDSGSA-N 0 3 419.616 4.004 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)CCCc3nc4ccccc4s3)cc2)CC1 ZINC000106193838 852761007 /nfs/dbraw/zinc/76/10/07/852761007.db2.gz CSLBYIGIWVJTEE-UHFFFAOYSA-N 0 3 422.598 4.395 20 0 HIADHN Cc1cccc(-c2nnc(-c3ccc(C(=O)NCCN4CCC[C@@H](C)C4)cc3)o2)c1 ZINC000107632895 852783271 /nfs/dbraw/zinc/78/32/71/852783271.db2.gz BTECAFRFROVWSH-GOSISDBHSA-N 0 3 404.514 4.174 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)c2ccccc2SC(C)C)CC1 ZINC000107797951 852798687 /nfs/dbraw/zinc/79/86/87/852798687.db2.gz VXNBUAXFKJXXET-UHFFFAOYSA-N 0 3 411.615 4.255 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)c1cc(Cl)ccc1Cl ZINC000108222214 852829722 /nfs/dbraw/zinc/82/97/22/852829722.db2.gz ZMKZQMFLQSDFPM-UHFFFAOYSA-N 0 3 406.357 4.326 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)c1ccc(Cl)cc1Cl ZINC000108224528 852830061 /nfs/dbraw/zinc/83/00/61/852830061.db2.gz XAHMFGGJRUBXEV-UHFFFAOYSA-N 0 3 406.357 4.326 20 0 HIADHN COc1cccc(CN2CCC(NC(=O)[C@H](C)Oc3cc(C)ccc3Cl)CC2)c1 ZINC000108536099 852857916 /nfs/dbraw/zinc/85/79/16/852857916.db2.gz BPLXFKRTTKCQPX-KRWDZBQOSA-N 0 3 416.949 4.205 20 0 HIADHN Cc1ccccc1C(=O)N[C@H](CC(C)C)C(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000108820640 852882032 /nfs/dbraw/zinc/88/20/32/852882032.db2.gz NTXBBNJMIYUZEC-ODGPQVTHSA-N 0 3 421.585 4.091 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)c(C)c1CC(=O)NC[C@H](c1ccc(C)cc1)N(C)C ZINC000109289618 852947626 /nfs/dbraw/zinc/94/76/26/852947626.db2.gz OYCBQXJJZCDDNJ-HSZRJFAPSA-N 0 3 424.976 4.413 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2ccc(NC(=O)c3ccccc3)cc2)N(C)C)cc1 ZINC000109289021 852947682 /nfs/dbraw/zinc/94/76/82/852947682.db2.gz SOXVMXPFFNDVSR-QHCPKHFHSA-N 0 3 401.510 4.280 20 0 HIADHN CN(Cc1ccccc1Br)C(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000109340100 852955818 /nfs/dbraw/zinc/95/58/18/852955818.db2.gz DQALILSBTXHVJH-GOSISDBHSA-N 0 3 419.338 4.459 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)c1cccc(OCc2cscn2)c1 ZINC000109358432 852958083 /nfs/dbraw/zinc/95/80/83/852958083.db2.gz OWSKURBCADGTMB-UHFFFAOYSA-N 0 3 413.518 4.065 20 0 HIADHN CC(=O)c1cccc(O[C@@H](C)C(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)c1 ZINC000109366400 852959782 /nfs/dbraw/zinc/95/97/82/852959782.db2.gz ZOBAFQZYOHLFFV-GHTZIAJQSA-N 0 3 414.571 4.307 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N(C)[C@H](C)c3ccc(F)c(F)c3)cc2)CC1 ZINC000109489619 852975991 /nfs/dbraw/zinc/97/59/91/852975991.db2.gz XEKFYHAGPSXSNU-QGZVFWFLSA-N 0 3 401.501 4.328 20 0 HIADHN Cc1c(C(=O)Nc2ccc(CCN3CCSCC3)cc2)cnn1-c1ccccc1F ZINC000109498767 852976938 /nfs/dbraw/zinc/97/69/38/852976938.db2.gz IXTNBXWWNPTEOJ-UHFFFAOYSA-N 0 3 424.545 4.163 20 0 HIADHN CC(=O)Nc1ccc(F)c(NC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)c1 ZINC000110126387 853063843 /nfs/dbraw/zinc/06/38/43/853063843.db2.gz ZCEMZZHANSMGHT-HXUWFJFHSA-N 0 3 423.410 4.177 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)CCCOc3cccc4ccccc43)CC2)C[C@H](C)O1 ZINC000110408974 853095948 /nfs/dbraw/zinc/09/59/48/853095948.db2.gz UVTHHVJVKPMRCS-OYRHEFFESA-N 0 3 424.585 4.347 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)c3ccccc3Oc3ccccc3)CC2)C[C@@H](C)O1 ZINC000110457577 853102515 /nfs/dbraw/zinc/10/25/15/853102515.db2.gz LLSXILXCUBADMF-WOJBJXKFSA-N 0 3 408.542 4.440 20 0 HIADHN Fc1cccc(-c2noc([C@H]3CCCN(Cn4cnc5cc(F)c(F)cc54)C3)n2)c1 ZINC000110479215 853105324 /nfs/dbraw/zinc/10/53/24/853105324.db2.gz JXZUQDVCEXPMDZ-AWEZNQCLSA-N 0 3 413.403 4.341 20 0 HIADHN CN(C(=O)c1cc(C2CC2)nc2ccccc21)C1CCN(CCc2ccccn2)CC1 ZINC000110488709 853107265 /nfs/dbraw/zinc/10/72/65/853107265.db2.gz DRUQCJOTSFGDOJ-UHFFFAOYSA-N 0 3 414.553 4.286 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3ccc(OC4CCCC4)cc3)CC2)C[C@@H](C)O1 ZINC000110727313 853145335 /nfs/dbraw/zinc/14/53/35/853145335.db2.gz MMVWXUDRCRROST-RTBURBONSA-N 0 3 415.578 4.361 20 0 HIADHN C[C@@H]1Cc2ccccc2N1Cc1occc1C(=O)NC[C@@H](Cc1ccccc1)N(C)C ZINC000111140337 853207964 /nfs/dbraw/zinc/20/79/64/853207964.db2.gz NLFWIAYXSZETAO-DENIHFKCSA-N 0 3 417.553 4.134 20 0 HIADHN O=C(N1CC[C@H](Nc2ccccc2)C1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000111209021 853222738 /nfs/dbraw/zinc/22/27/38/853222738.db2.gz SYGGGIYSEMYCQR-UNMCSNQZSA-N 0 3 417.475 4.154 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(NCc3ccccc3C[N@@H+]3CCC[C@H](C)C3)nc2)n1 ZINC000111221852 853226481 /nfs/dbraw/zinc/22/64/81/853226481.db2.gz WMSRSMDFZJVTFN-SFHVURJKSA-N 0 3 417.557 4.238 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(NCc3ccccc3C[N@H+]3CCC[C@H](C)C3)nc2)n1 ZINC000111221852 853226496 /nfs/dbraw/zinc/22/64/96/853226496.db2.gz WMSRSMDFZJVTFN-SFHVURJKSA-N 0 3 417.557 4.238 20 0 HIADHN COc1cc(C(=O)N(CCN(C)C)c2ccccc2)ccc1OCc1ccccc1 ZINC000116123860 853284493 /nfs/dbraw/zinc/28/44/93/853284493.db2.gz MTOIETACDXHGGK-UHFFFAOYSA-N 0 3 404.510 4.483 20 0 HIADHN Cc1ccccc1CN(Cc1cccnc1)C(=O)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000116395406 853301341 /nfs/dbraw/zinc/30/13/41/853301341.db2.gz IQSAJZGJLZHDLB-RUZDIDTESA-N 0 3 414.553 4.226 20 0 HIADHN CCCN(C(=O)Cc1cn2cccc(C)c2n1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000116681401 853325093 /nfs/dbraw/zinc/32/50/93/853325093.db2.gz YXEIADAWYXFIAA-QHCPKHFHSA-N 0 3 404.558 4.088 20 0 HIADHN Cc1nn(-c2ccc(C(=O)N(CCc3ccccc3)CCN(C)C)cc2)c(C)c1Cl ZINC000117114386 853343845 /nfs/dbraw/zinc/34/38/45/853343845.db2.gz NVRYIOYADZNFNA-UHFFFAOYSA-N 0 3 424.976 4.389 20 0 HIADHN COCCN1CCC(NC(=O)c2ccccc2-c2ccc(C(F)(F)F)cc2)CC1 ZINC000138549253 853390359 /nfs/dbraw/zinc/39/03/59/853390359.db2.gz VQTQVXKXFUGXQQ-UHFFFAOYSA-N 0 3 406.448 4.213 20 0 HIADHN Cc1cc(C)n(Cc2ccc(C(=O)NC[C@H](c3ccccc3)N3CCCC3)cc2)n1 ZINC000139678753 853418302 /nfs/dbraw/zinc/41/83/02/853418302.db2.gz PVAUTXYOIDQHMO-XMMPIXPASA-N 0 3 402.542 4.115 20 0 HIADHN O=C(NCc1cccc2cccnc21)Nc1ccc(CCN2CCSCC2)cc1 ZINC000139915602 853426770 /nfs/dbraw/zinc/42/67/70/853426770.db2.gz FNXYBGANXIYEJQ-UHFFFAOYSA-N 0 3 406.555 4.148 20 0 HIADHN COc1ccc(CN[C@H](C)c2ccc(N3CCOC3=O)cc2)cc1Br ZINC000142753922 853498926 /nfs/dbraw/zinc/49/89/26/853498926.db2.gz AFTXJFAXTMDHPA-CYBMUJFWSA-N 0 3 405.292 4.265 20 0 HIADHN Cc1cc(Oc2ncccn2)ccc1NC(=O)N1CCCN(Cc2ccccc2)CC1 ZINC000142828606 853502145 /nfs/dbraw/zinc/50/21/45/853502145.db2.gz OZXXNFYIJPZYFC-UHFFFAOYSA-N 0 3 417.513 4.317 20 0 HIADHN CC(=O)N1C=Cc2ccccc2[C@@H]1CC(=O)NC[C@H](c1ccc(C)cc1)N1CCCC1 ZINC000143205817 853509887 /nfs/dbraw/zinc/50/98/87/853509887.db2.gz ZMVIAVIDTHSFQN-LOSJGSFVSA-N 0 3 417.553 4.212 20 0 HIADHN S=C(NC1CCN(Cc2ccccc2)CC1)N[C@@H]1CCOc2c(Cl)cccc21 ZINC000145705799 853556558 /nfs/dbraw/zinc/55/65/58/853556558.db2.gz YVFDRRGASNYTMF-HXUWFJFHSA-N 0 3 415.990 4.292 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3cccc(Cn4cccn4)c3)c(C)c2)CC1 ZINC000149737715 853629607 /nfs/dbraw/zinc/62/96/07/853629607.db2.gz ARBZHZQUZKKPHI-UHFFFAOYSA-N 0 3 418.545 4.026 20 0 HIADHN COc1ccc(CNCc2ccc(S(=O)(=O)N(C)C(C)C)cc2)c2ccccc12 ZINC000165517568 853651711 /nfs/dbraw/zinc/65/17/11/853651711.db2.gz VRIBNVOBWWMKQY-UHFFFAOYSA-N 0 3 412.555 4.167 20 0 HIADHN COCCOc1ccc(NC(=O)N[C@H](CN2CCCC2)c2ccccc2)cc1Cl ZINC000195581674 853694994 /nfs/dbraw/zinc/69/49/94/853694994.db2.gz LYWSSFWYUGHJFM-HXUWFJFHSA-N 0 3 417.937 4.324 20 0 HIADHN O=C(CNC1(c2ccc(Br)cc2)CCOCC1)NC1CCCCCCC1 ZINC000195600814 853706347 /nfs/dbraw/zinc/70/63/47/853706347.db2.gz ZJZMBPZZNJJSMZ-UHFFFAOYSA-N 0 3 423.395 4.274 20 0 HIADHN C[C@H]1CCCC[C@H]1N(C)C(=O)CNC1(c2ccc(Br)cc2)CCOCC1 ZINC000195600970 853706549 /nfs/dbraw/zinc/70/65/49/853706549.db2.gz RFMRSQGUYJSDLU-QFBILLFUSA-N 0 3 423.395 4.082 20 0 HIADHN O=C(CNC1(c2ccc(Br)cc2)CCOCC1)NCCC1CCCCC1 ZINC000195600984 853706714 /nfs/dbraw/zinc/70/67/14/853706714.db2.gz RWXASGZVKVRDAT-UHFFFAOYSA-N 0 3 423.395 4.131 20 0 HIADHN Cc1nc(COc2ccc(F)cc2)sc1C(=O)NCC(C)(C)N1CCC[C@@H](C)C1 ZINC000195612082 853713749 /nfs/dbraw/zinc/71/37/49/853713749.db2.gz ONFGAKNJAUYUHD-OAHLLOKOSA-N 0 3 419.566 4.410 20 0 HIADHN Cc1nc(COc2ccc(F)cc2)sc1C(=O)NCCN(C)Cc1ccccc1 ZINC000195611942 853713966 /nfs/dbraw/zinc/71/39/66/853713966.db2.gz YDITZSKDGSFBHE-UHFFFAOYSA-N 0 3 413.518 4.031 20 0 HIADHN C[C@H](CNC(=O)NC[C@H](c1cccs1)N1CCCC1)COCc1ccccc1 ZINC000195615814 853716086 /nfs/dbraw/zinc/71/60/86/853716086.db2.gz VJTOIIJKGUINIG-UYAOXDASSA-N 0 3 401.576 4.037 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)c1ccc(-n2cccn2)cc1 ZINC000195686523 853758172 /nfs/dbraw/zinc/75/81/72/853758172.db2.gz FHEIERZRJIXEGX-UHFFFAOYSA-N 0 3 416.447 4.095 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(S(=O)(=O)N(C)C)cc1)c1ccc(C(F)(F)F)cc1 ZINC000195702197 853768544 /nfs/dbraw/zinc/76/85/44/853768544.db2.gz CDNQACFENYNPQB-ZIAGYGMSSA-N 0 3 400.466 4.368 20 0 HIADHN CCNC(=O)COc1ccc(CN[C@@H](C)c2ccc3cc(OC)ccc3c2)cc1OC ZINC000195733332 853785089 /nfs/dbraw/zinc/78/50/89/853785089.db2.gz LUROJSUWGHEXRM-KRWDZBQOSA-N 0 3 422.525 4.223 20 0 HIADHN COc1ccc(/C=C\C(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)cc1OC ZINC000212525211 853821489 /nfs/dbraw/zinc/82/14/89/853821489.db2.gz QWNSYSHRIWDLRM-GXVATQTDSA-N 0 3 414.571 4.368 20 0 HIADHN CC[C@H](N[C@H](C)C(=O)Nc1cccc(C(=O)N(CC)CC)c1)c1ccc(OC)cc1 ZINC000218854533 853864209 /nfs/dbraw/zinc/86/42/09/853864209.db2.gz DSOITZYPYKTVHV-VGSWGCGISA-N 0 3 411.546 4.245 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)c2cccc(OCc3cscn3)c2)C1 ZINC000227383351 853886216 /nfs/dbraw/zinc/88/62/16/853886216.db2.gz SRDOVEOYYDZASV-YLJYHZDGSA-N 0 3 407.539 4.287 20 0 HIADHN c1sc(-c2ccc3c(c2)OCO3)nc1CN[C@@H](CN1CCCC1)c1ccccc1 ZINC000236613150 853902672 /nfs/dbraw/zinc/90/26/72/853902672.db2.gz HFUVVTQMJDTCJI-FQEVSTJZSA-N 0 3 407.539 4.466 20 0 HIADHN Brc1cccc(-c2nc(CNC3CCC4(CC3)OCCO4)cs2)c1 ZINC000236671402 853910628 /nfs/dbraw/zinc/91/06/28/853910628.db2.gz YXQMWRXRISXQLS-UHFFFAOYSA-N 0 3 409.349 4.348 20 0 HIADHN CCCN1CCN(c2ccccc2CNc2ccc(C)c(N3CCOC3=O)c2)CC1 ZINC000236815909 853925466 /nfs/dbraw/zinc/92/54/66/853925466.db2.gz GPFRVUSFCFCHNR-UHFFFAOYSA-N 0 3 408.546 4.096 20 0 HIADHN CC(C)n1ncc2cc(CNCCc3nc4c(cccc4F)n3C)c(Cl)nc21 ZINC000236842162 853927581 /nfs/dbraw/zinc/92/75/81/853927581.db2.gz USVWYMBHUIKRNG-UHFFFAOYSA-N 0 3 400.889 4.024 20 0 HIADHN C=CCOc1c(Br)cc(CNC[C@@](C)(O)c2ccco2)cc1OCC ZINC000236948328 853941614 /nfs/dbraw/zinc/94/16/14/853941614.db2.gz HNDKBCSCTUBLHI-LJQANCHMSA-N 0 3 410.308 4.003 20 0 HIADHN CCOc1ccc(C(=O)N2CCC(NCc3coc(-c4ccccc4)n3)CC2)cc1 ZINC000236964231 853943434 /nfs/dbraw/zinc/94/34/34/853943434.db2.gz LQHPNTVSZZEFJR-UHFFFAOYSA-N 0 3 405.498 4.135 20 0 HIADHN CCOc1cc(CNCc2ccc(O)cc2)ccc1OCC(=O)Nc1ccccc1 ZINC000236968741 853944412 /nfs/dbraw/zinc/94/44/12/853944412.db2.gz PKQUYXOHMGYOGZ-UHFFFAOYSA-N 0 3 406.482 4.098 20 0 HIADHN CCOc1cc(CNCC2=Cc3cc(Br)ccc3OC2)ccc1OC ZINC000237084463 853962253 /nfs/dbraw/zinc/96/22/53/853962253.db2.gz SIDTWUQRNZKSTM-UHFFFAOYSA-N 0 3 404.304 4.422 20 0 HIADHN CN(CCC#N)c1ccc(C[NH2+][C@@H]2CCCN(Cc3cc(Cl)ccc3[O-])C2)cc1 ZINC000237209045 853982622 /nfs/dbraw/zinc/98/26/22/853982622.db2.gz OQFAWSUCLICGSO-OAQYLSRUSA-N 0 3 412.965 4.150 20 0 HIADHN COc1ccc(OC)c([C@H](O)CNCc2ccc(-c3nc4ccccc4s3)o2)c1 ZINC000237286279 853998531 /nfs/dbraw/zinc/99/85/31/853998531.db2.gz MZBATECIAHLWRV-GOSISDBHSA-N 0 3 410.495 4.397 20 0 HIADHN COc1ccc(OC)c(CCNCc2nc(-c3ccc(Br)cc3)c[nH]2)c1 ZINC000237377036 854017328 /nfs/dbraw/zinc/01/73/28/854017328.db2.gz IGQQVUPOCSAMRC-UHFFFAOYSA-N 0 3 416.319 4.189 20 0 HIADHN COc1cc2c(c(CNCCC(=O)Nc3cc(C)c(Cl)cc3OC)c1)O[C@H](C)C2 ZINC000237385721 854019520 /nfs/dbraw/zinc/01/95/20/854019520.db2.gz BYLQLSINIYJPFS-CQSZACIVSA-N 0 3 418.921 4.107 20 0 HIADHN COc1ccc(OC)c(NC(=O)C[C@@H](C)NCc2oc3ccc(F)cc3c2C)c1 ZINC000237396639 854022391 /nfs/dbraw/zinc/02/23/91/854022391.db2.gz NOJDLABLQYYOSQ-CYBMUJFWSA-N 0 3 400.450 4.404 20 0 HIADHN COc1ccc(Br)c(C(=O)NCCCNCc2ccc([C@@H]3C[C@H]3C)o2)c1 ZINC000237419121 854028950 /nfs/dbraw/zinc/02/89/50/854028950.db2.gz NOJZVSCQSODOIZ-CZUORRHYSA-N 0 3 421.335 4.084 20 0 HIADHN COc1ccc(CNCc2ccccc2CN2C[C@@H](C)O[C@@H](C)C2)c(Cl)c1OC ZINC000237441112 854033992 /nfs/dbraw/zinc/03/39/92/854033992.db2.gz UZTGHOONSDUUBM-CALCHBBNSA-N 0 3 418.965 4.256 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(CNCCC(=O)Nc3ccccc3)c2)cc1 ZINC000237461581 854037164 /nfs/dbraw/zinc/03/71/64/854037164.db2.gz JAZQTUGIYLIPLV-UHFFFAOYSA-N 0 3 403.482 4.066 20 0 HIADHN C[C@@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@@H]1CNCc1cnc(-c2ccccn2)s1 ZINC000237474064 854041106 /nfs/dbraw/zinc/04/11/06/854041106.db2.gz HJPHASOOLAUEAG-WMLDXEAASA-N 0 3 418.563 4.055 20 0 HIADHN Cc1ccc(COc2ccc(CNCc3ccc(N4CCO[C@@H](C)C4)nc3)cc2)cc1 ZINC000237543591 854052127 /nfs/dbraw/zinc/05/21/27/854052127.db2.gz AVGPKYVEMQXFDC-NRFANRHFSA-N 0 3 417.553 4.484 20 0 HIADHN Cc1nn(-c2ccccc2)c(Oc2ccc(Br)cc2)c1CNC[C@H](C)O ZINC000237547575 854053620 /nfs/dbraw/zinc/05/36/20/854053620.db2.gz YEQYHNHFLSMRJM-AWEZNQCLSA-N 0 3 416.319 4.206 20 0 HIADHN C[C@@H]1CN(C(=O)c2ccc(CNCc3cccc(OC(F)(F)F)c3)cc2)C[C@@H](C)O1 ZINC000237658665 854070021 /nfs/dbraw/zinc/07/00/21/854070021.db2.gz GDEANTWJDNSXTJ-HZPDHXFCSA-N 0 3 422.447 4.124 20 0 HIADHN Cc1nn(Cc2ccccc2Cl)c(C)c1CNCCC(=O)N1CCCCCC1 ZINC000237673471 854073166 /nfs/dbraw/zinc/07/31/66/854073166.db2.gz DZLLWAUPHIRXMK-UHFFFAOYSA-N 0 3 402.970 4.084 20 0 HIADHN Cc1nn(Cc2ccccc2Cl)c(Cl)c1CNCCCOC[C@H]1CCCO1 ZINC000237689910 854076140 /nfs/dbraw/zinc/07/61/40/854076140.db2.gz PQKUWWCGMMGMJT-QGZVFWFLSA-N 0 3 412.361 4.222 20 0 HIADHN Cn1c(CCCNCc2csc(-c3ccc4c(c3)OCO4)n2)nc2ccccc21 ZINC000237739514 854087025 /nfs/dbraw/zinc/08/70/25/854087025.db2.gz DWRKKVSNSIMHPT-UHFFFAOYSA-N 0 3 406.511 4.148 20 0 HIADHN Cc1nc(COc2ccc(CNCc3ccc(C(=O)OC(C)(C)C)cc3)cc2)no1 ZINC000237753228 854089106 /nfs/dbraw/zinc/08/91/06/854089106.db2.gz ITWUNFHJYLJJKX-UHFFFAOYSA-N 0 3 409.486 4.202 20 0 HIADHN Fc1cccc(C2(NCc3cnc4ccc(Br)cn34)CCOCC2)c1 ZINC000237749431 854089196 /nfs/dbraw/zinc/08/91/96/854089196.db2.gz LPXQQEPWIYMVRC-UHFFFAOYSA-N 0 3 404.283 4.031 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(C)c1CNC[C@H](O)c1cccc(C(F)(F)F)c1 ZINC000237758469 854090055 /nfs/dbraw/zinc/09/00/55/854090055.db2.gz ATNXEUSLEKRZBB-FQEVSTJZSA-N 0 3 407.411 4.470 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(Cl)c1CNCCCNC(=O)c1cccc(F)c1 ZINC000237773392 854094080 /nfs/dbraw/zinc/09/40/80/854094080.db2.gz VFLRPZNVDFYHHZ-UHFFFAOYSA-N 0 3 418.875 4.022 20 0 HIADHN Cc1nn(Cc2ccc(Cl)cc2)c(C)c1CNC[C@@H](O)COc1cccc(C)c1 ZINC000237773499 854094152 /nfs/dbraw/zinc/09/41/52/854094152.db2.gz YCKVKEPZADQKDJ-OAQYLSRUSA-N 0 3 413.949 4.040 20 0 HIADHN Fc1ccc(C2(NCc3cc4c(c(Br)c3)OCO4)CCOCC2)cc1 ZINC000237829483 854105575 /nfs/dbraw/zinc/10/55/75/854105575.db2.gz FLSRUIVHYDSVCI-UHFFFAOYSA-N 0 3 408.267 4.112 20 0 HIADHN O=C(NCCN1CCCC1)c1ccc(CNCc2c(Cl)cccc2Cl)cc1 ZINC000237843053 854106417 /nfs/dbraw/zinc/10/64/17/854106417.db2.gz XIFNGRZCVZVALF-UHFFFAOYSA-N 0 3 406.357 4.109 20 0 HIADHN O=C(CCNCc1cccc(NC(=O)c2ccccc2Cl)c1)N1CCCCCC1 ZINC000237858811 854109629 /nfs/dbraw/zinc/10/96/29/854109629.db2.gz ICHIBNHXPYENMY-UHFFFAOYSA-N 0 3 413.949 4.475 20 0 HIADHN O[C@@H](CNCc1cnc2ccc(Br)cn12)c1c(Cl)cccc1Cl ZINC000238057516 854138572 /nfs/dbraw/zinc/13/85/72/854138572.db2.gz PTUPTRNNBVDWLM-AWEZNQCLSA-N 0 3 415.118 4.227 20 0 HIADHN [O-]c1ccc(Cl)cc1CN1CCC[C@H]([NH2+]Cc2c[nH]nc2-c2cccs2)C1 ZINC000238061613 854139529 /nfs/dbraw/zinc/13/95/29/854139529.db2.gz BLXUSBIPXMNROP-KRWDZBQOSA-N 0 3 402.951 4.251 20 0 HIADHN [O-]c1ccc(Cl)cc1CN1CCC[C@@H]([NH2+]Cc2c[nH]nc2-c2cccs2)C1 ZINC000238060739 854139905 /nfs/dbraw/zinc/13/99/05/854139905.db2.gz BLXUSBIPXMNROP-QGZVFWFLSA-N 0 3 402.951 4.251 20 0 HIADHN [O-]c1ccc(Cl)cc1CN1CCC[C@H]([NH2+]Cc2ccc(Oc3cnccn3)cc2)C1 ZINC000238061910 854139942 /nfs/dbraw/zinc/13/99/42/854139942.db2.gz NXTKVGVADHODPD-FQEVSTJZSA-N 0 3 424.932 4.382 20 0 HIADHN O[C@@H](CNCc1cn(-c2ccccc2)nc1-c1ccncc1)c1c(F)cccc1F ZINC000238073708 854140575 /nfs/dbraw/zinc/14/05/75/854140575.db2.gz GXRJVFKINGGWBP-NRFANRHFSA-N 0 3 406.436 4.036 20 0 HIADHN OCC[C@@H](CNCc1nc(-c2cccc(Br)c2)c[nH]1)c1ccccc1 ZINC000238194539 854151806 /nfs/dbraw/zinc/15/18/06/854151806.db2.gz JGMUIXPYOZNGJU-KRWDZBQOSA-N 0 3 400.320 4.095 20 0 HIADHN C[C@H]1Cc2ccccc2N1Cc1occc1C(=O)NC[C@H](c1ccccc1)N(C)C ZINC000248031866 854174673 /nfs/dbraw/zinc/17/46/73/854174673.db2.gz TZWDNYJWDQCDTQ-FDDCHVKYSA-N 0 3 403.526 4.264 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2ccc(NC(=O)[C@H]3C[C@H]3C)cc2)N2CCCC2)cc1 ZINC000248151136 854182868 /nfs/dbraw/zinc/18/28/68/854182868.db2.gz JZZPKQPRRIKOHS-LEOXJPRUSA-N 0 3 405.542 4.156 20 0 HIADHN Cc1ccccc1-n1ccnc1SCC(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000250989064 854196738 /nfs/dbraw/zinc/19/67/38/854196738.db2.gz NMOYINQNAMIOTH-TZIWHRDSSA-N 0 3 420.582 4.225 20 0 HIADHN CN(C)[C@@H](CNc1cc(C(F)(F)F)nc(-c2cccnc2)n1)c1cccc(F)c1 ZINC000301312508 854355136 /nfs/dbraw/zinc/35/51/36/854355136.db2.gz IVQGCQSXPLJGSY-INIZCTEOSA-N 0 3 405.399 4.411 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(N[C@@H]3CC[N@H+](Cc4ccccc4)C[C@@H]3C)nc2)n1 ZINC000301588457 854425631 /nfs/dbraw/zinc/42/56/31/854425631.db2.gz PWTJWQKSBPCYJR-LAUBAEHRSA-N 0 3 403.530 4.129 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(N[C@@H]3CC[N@@H+](Cc4ccccc4)C[C@@H]3C)nc2)n1 ZINC000301588457 854425636 /nfs/dbraw/zinc/42/56/36/854425636.db2.gz PWTJWQKSBPCYJR-LAUBAEHRSA-N 0 3 403.530 4.129 20 0 HIADHN Clc1cc(Br)cc2ccc(NC3CCN([C@H]4CCOC4)CC3)nc12 ZINC000302026419 854518192 /nfs/dbraw/zinc/51/81/92/854518192.db2.gz QIIDFTKOIHDUQA-HNNXBMFYSA-N 0 3 410.743 4.316 20 0 HIADHN COc1ccc([C@H](C[NH+]2CCCC2)Nc2ccc(-c3nc(C)c(C)c(=O)[n-]3)cn2)cc1 ZINC000302138371 854535610 /nfs/dbraw/zinc/53/56/10/854535610.db2.gz NRVQUICVHKSYBK-NRFANRHFSA-N 0 3 419.529 4.119 20 0 HIADHN COc1ccc(C(NC(=O)CN[C@H](C)c2ccccc2)c2ccc(OC)cc2)cc1 ZINC000302603603 854590541 /nfs/dbraw/zinc/59/05/41/854590541.db2.gz QUKCKOGCXNLLOD-GOSISDBHSA-N 0 3 404.510 4.260 20 0 HIADHN COc1ccc([C@@H](NCC(=O)Nc2ccccc2C(=O)NC2CCCC2)C(C)C)cc1 ZINC000302755937 854621889 /nfs/dbraw/zinc/62/18/89/854621889.db2.gz KQOZGAXKICDIEZ-DEOSSOPVSA-N 0 3 423.557 4.293 20 0 HIADHN CN1CC[C@@H]2[C@@H](CCCN2c2nnc(-c3cc(Br)ccc3F)s2)C1 ZINC000302759866 854624061 /nfs/dbraw/zinc/62/40/61/854624061.db2.gz WVOBSAVLKCVZGM-XHDPSFHLSA-N 0 3 411.344 4.027 20 0 HIADHN CN1CC[C@@H](Nc2ncc(Cn3cc(Br)cn3)s2)[C@@H]1c1ccccc1 ZINC000302839123 854651204 /nfs/dbraw/zinc/65/12/04/854651204.db2.gz YYIBZSRYMBUMSB-SJORKVTESA-N 0 3 418.364 4.008 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1ccc(-n2nc(C)cc2C)cc1)c1cccc(OC)c1 ZINC000302878068 854664093 /nfs/dbraw/zinc/66/40/93/854664093.db2.gz JBSKVJSNCBMJLJ-DEOSSOPVSA-N 0 3 420.557 4.311 20 0 HIADHN CN(C)[C@H](CNc1nc(C(F)(F)F)nc2nc[nH]c21)c1cccc(C(F)(F)F)c1 ZINC000302877358 854664131 /nfs/dbraw/zinc/66/41/31/854664131.db2.gz GMHOPFCIOIBCKX-LLVKDONJSA-N 0 3 418.345 4.105 20 0 HIADHN COc1ccc([C@H](C)NC(=O)NC[C@@H](c2ccccc2)N(C)C)cc1Br ZINC000302896580 854670150 /nfs/dbraw/zinc/67/01/50/854670150.db2.gz LGBNSRNDIHUCSV-KSSFIOAISA-N 0 3 420.351 4.121 20 0 HIADHN COCc1nc2n(n1)C[C@@H](Nc1ccnc3ccc(Oc4ccccc4)cc31)CC2 ZINC000302901758 854672064 /nfs/dbraw/zinc/67/20/64/854672064.db2.gz QSAMZYJKVGKEMU-INIZCTEOSA-N 0 3 401.470 4.192 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cc(C(C)C)nc2onc(C)c21)c1cccc(OC)c1 ZINC000302929774 854683830 /nfs/dbraw/zinc/68/38/30/854683830.db2.gz DSNQVRJVFDIVMQ-NRFANRHFSA-N 0 3 424.545 4.476 20 0 HIADHN O=C(NC[C@H]1CCCCN1Cc1ccccc1)c1ccc(OC[C@@H]2CCCO2)cc1 ZINC000302962223 854697128 /nfs/dbraw/zinc/69/71/28/854697128.db2.gz GHRUTQCTTKYHMN-VWNXMTODSA-N 0 3 408.542 4.029 20 0 HIADHN COc1ccc2cc(CN(C)C(=O)CN(C[C@H]3CCCO3)C3CCCC3)ccc2c1 ZINC000303034225 854733263 /nfs/dbraw/zinc/73/32/63/854733263.db2.gz OOTZVJZKSNUJAA-XMMPIXPASA-N 0 3 410.558 4.230 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)c1ccc(OC(F)(F)F)cc1 ZINC000303039238 854735281 /nfs/dbraw/zinc/73/52/81/854735281.db2.gz ZJNDDEOIXYKHEN-UHFFFAOYSA-N 0 3 402.363 4.067 20 0 HIADHN COCCN1CCC(NC(=O)CCc2c3cc(F)ccc3[nH]c2-c2ccccc2)CC1 ZINC000303071377 854747571 /nfs/dbraw/zinc/74/75/71/854747571.db2.gz XIMZPLPTEQVIIQ-UHFFFAOYSA-N 0 3 423.532 4.134 20 0 HIADHN O=C(c1ccc(Br)cc1)N1CCCN(CCCc2ccccc2)CC1 ZINC000303097926 854758983 /nfs/dbraw/zinc/75/89/83/854758983.db2.gz GJHPARHYSFLAED-UHFFFAOYSA-N 0 3 401.348 4.230 20 0 HIADHN CN(C[C@@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)c1cccc(Cl)c1Cl ZINC000437330681 862601405 /nfs/dbraw/zinc/60/14/05/862601405.db2.gz ZOKMIWLPZAKLHL-INIZCTEOSA-N 0 3 413.370 4.136 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Cc1cccc(Br)c1)c1cccc(OC)c1 ZINC000303148152 854785413 /nfs/dbraw/zinc/78/54/13/854785413.db2.gz SGCYFXUWKHVUBP-FQEVSTJZSA-N 0 3 419.363 4.200 20 0 HIADHN COc1ccc(OC)c(CNC[C@H](c2c(F)cccc2Cl)N2CCO[C@@H](C)C2)c1 ZINC000303225174 854825128 /nfs/dbraw/zinc/82/51/28/854825128.db2.gz WKGDOZJGBBFXCT-MGPUTAFESA-N 0 3 422.928 4.048 20 0 HIADHN CCN1CCN(c2ccc(NS(=O)(=O)c3cccc(C(C)C)c3)c(C)c2)CC1 ZINC000437335852 862609196 /nfs/dbraw/zinc/60/91/96/862609196.db2.gz FDOAPLSVOVDQDT-UHFFFAOYSA-N 0 3 401.576 4.061 20 0 HIADHN CCN(CC)[C@@H](C(=O)NC[C@@H](c1cccc(OC)c1)N1CCCC1)c1ccccc1 ZINC000303306579 854863288 /nfs/dbraw/zinc/86/32/88/854863288.db2.gz ZVNQNCDUNPJWOL-BJKOFHAPSA-N 0 3 409.574 4.031 20 0 HIADHN CC(C)(C)OC(=O)NC(C)(C)CNCc1cccc2c1N(C(=O)OC(C)(C)C)CC2 ZINC000303320404 854870375 /nfs/dbraw/zinc/87/03/75/854870375.db2.gz QCBBHZZFVAEARE-UHFFFAOYSA-N 0 3 419.566 4.377 20 0 HIADHN CCCOc1ccc(NC(=O)N2CCC(CN3C[C@H](C)O[C@@H](C)C3)CC2)c(C)c1 ZINC000303350509 854887250 /nfs/dbraw/zinc/88/72/50/854887250.db2.gz FTPPDGLEBDAZAB-OALUTQOASA-N 0 3 403.567 4.137 20 0 HIADHN Cc1cc(C)c(C)c(S(=O)(=O)NC2C[C@H]3CC[C@@H](C2)N3Cc2ccccc2)c1C ZINC000303452937 854952105 /nfs/dbraw/zinc/95/21/05/854952105.db2.gz JBOAQGRNMOADFY-NOTZXAQLSA-N 0 3 412.599 4.394 20 0 HIADHN O=S(=O)(NC1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1)c1ccc2ccccc2c1 ZINC000303478364 854974055 /nfs/dbraw/zinc/97/40/55/854974055.db2.gz PISOUGHBUYSJJE-NOTZXAQLSA-N 0 3 406.551 4.314 20 0 HIADHN C[C@H](NC(=O)c1oc2ccccc2c1CN(C)C)c1ccc(N2CCCC2=O)cc1 ZINC000303588241 855062279 /nfs/dbraw/zinc/06/22/79/855062279.db2.gz UEXHKCIJNWXVGA-INIZCTEOSA-N 0 3 405.498 4.112 20 0 HIADHN CCN(Cc1ccc(OC)c(OC)c1)C(=O)CN1C[C@@H](c2ccc(F)cc2)C[C@@H]1C ZINC000303694694 855138431 /nfs/dbraw/zinc/13/84/31/855138431.db2.gz ABDONOTUMQRBLB-PXNSSMCTSA-N 0 3 414.521 4.069 20 0 HIADHN C[C@H]1C[C@@H](N(C)S(=O)(=O)c2ccc(F)cc2Cl)CCN1Cc1ccccc1 ZINC000303755870 855176333 /nfs/dbraw/zinc/17/63/33/855176333.db2.gz CYOJJYSDIUIBMF-YJBOKZPZSA-N 0 3 410.942 4.153 20 0 HIADHN O=C(CCN1CCC[C@H](C(=O)c2ccc(F)cc2)C1)NCc1ccccc1Cl ZINC000303763362 855182665 /nfs/dbraw/zinc/18/26/65/855182665.db2.gz PBXISTIYZLDLNL-SFHVURJKSA-N 0 3 402.897 4.080 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)[C@H]3C[C@@H]3c3c(F)cccc3Cl)cc2)CC1 ZINC000303797839 855203717 /nfs/dbraw/zinc/20/37/17/855203717.db2.gz GHDMWMUOAPQEHO-OALUTQOASA-N 0 3 415.940 4.359 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)[C@H](C)Oc3ccc(SC)cc3)c(C)c2)CC1 ZINC000303807319 855211642 /nfs/dbraw/zinc/21/16/42/855211642.db2.gz KOVZCFILYJFWJG-SFHVURJKSA-N 0 3 413.587 4.265 20 0 HIADHN CSc1ccc(C)c(C(=O)Nc2ccc(C(=O)N(C)[C@@H]3CCCN(C)C3)cc2)c1 ZINC000303821411 855223090 /nfs/dbraw/zinc/22/30/90/855223090.db2.gz ABDXAWYLAXADGY-LJQANCHMSA-N 0 3 411.571 4.135 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1cccc(-c2nccn2C)c1 ZINC000303856603 855251662 /nfs/dbraw/zinc/25/16/62/855251662.db2.gz LPPBVIPEGMHDEO-IBGZPJMESA-N 0 3 403.530 4.215 20 0 HIADHN O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)[C@H]1C[C@H]1c1ccccc1OC(F)(F)F ZINC000303857309 855252553 /nfs/dbraw/zinc/25/25/53/855252553.db2.gz LULPCEDQYKLEOV-HOJAQTOUSA-N 0 3 418.459 4.470 20 0 HIADHN COc1cc2c(cc1OC)CN(C(=O)CN1CCC[C@@H]1c1cccc(C)c1C)CC2 ZINC000303871293 855262482 /nfs/dbraw/zinc/26/24/82/855262482.db2.gz HVMIGOBETSFMLP-JOCHJYFZSA-N 0 3 408.542 4.042 20 0 HIADHN O=C(Nc1ccc(N2CCSCC2)cc1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000303874548 855263708 /nfs/dbraw/zinc/26/37/08/855263708.db2.gz IPXMIEPRABUZAQ-LJQANCHMSA-N 0 3 413.562 4.230 20 0 HIADHN C[C@H](c1ccccc1)N(CC(=O)Nc1ccc(N2CCOCC2)cc1)CC1CCC1 ZINC000303908422 855282556 /nfs/dbraw/zinc/28/25/56/855282556.db2.gz UCWPSUAHZZMDNQ-HXUWFJFHSA-N 0 3 407.558 4.325 20 0 HIADHN Cc1ccc(-c2nnc3n2CCCCC3)cc1NC(=O)c1cccc(CN(C)C)c1 ZINC000303916541 855288172 /nfs/dbraw/zinc/28/81/72/855288172.db2.gz SOXRCJSGEPQIND-UHFFFAOYSA-N 0 3 403.530 4.294 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N3CC[C@@H](c4ccccc4)[C@H](C)C3)cc2)CC1 ZINC000303967073 855327895 /nfs/dbraw/zinc/32/78/95/855327895.db2.gz DEXFGBLXNZFPTB-PXDATVDWSA-N 0 3 405.586 4.483 20 0 HIADHN O=C(c1ccc(Br)cc1C(F)(F)F)N1CC[C@H](N2CCCCC2)C1 ZINC000326369585 855409441 /nfs/dbraw/zinc/40/94/41/855409441.db2.gz YXPVLFLPCMWEGK-ZDUSSCGKSA-N 0 3 405.258 4.168 20 0 HIADHN COc1ccc([C@H](C)NCc2ccc(N3CCCC3=O)cc2)cc1Br ZINC000327025254 855414343 /nfs/dbraw/zinc/41/43/43/855414343.db2.gz UABMTMHGGVAQBY-AWEZNQCLSA-N 0 3 403.320 4.435 20 0 HIADHN COc1cc(Br)ccc1C(=O)NC[C@H](c1ccccc1)N1CCCC1 ZINC000327378848 855417345 /nfs/dbraw/zinc/41/73/45/855417345.db2.gz NUWNMOWRBUNMGF-GOSISDBHSA-N 0 3 403.320 4.025 20 0 HIADHN COc1ccc(C(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)cc1Br ZINC000383053745 855435848 /nfs/dbraw/zinc/43/58/48/855435848.db2.gz MCBLECRASUEUHK-MRXNPFEDSA-N 0 3 417.347 4.194 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)c1cc(Br)ccc1F ZINC000383040560 855436016 /nfs/dbraw/zinc/43/60/16/855436016.db2.gz AQPNRWBSWBPIOE-HNNXBMFYSA-N 0 3 405.311 4.325 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc2c(c1)OCCO2)c1ccc(I)cc1 ZINC000386057073 855443044 /nfs/dbraw/zinc/44/30/44/855443044.db2.gz GTKGMASSHIDAPZ-STQMWFEESA-N 0 3 409.267 4.474 20 0 HIADHN C[C@@H](C[C@H]1COCCN1C(=O)OC(C)(C)C)NCc1ccsc1Br ZINC000388551050 855447903 /nfs/dbraw/zinc/44/79/03/855447903.db2.gz PAKDLDUZOAANDF-JSGCOSHPSA-N 0 3 419.385 4.015 20 0 HIADHN CN(C(=O)c1ccc(F)cc1Br)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000388937030 855449206 /nfs/dbraw/zinc/44/92/06/855449206.db2.gz WUZUUJNCKHKKGF-KRWDZBQOSA-N 0 3 405.311 4.325 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)c2ccnc(OCc3ccccc3)c2)C1 ZINC000409457143 855488065 /nfs/dbraw/zinc/48/80/65/855488065.db2.gz QELGTXJDEMFQHF-XXBNENTESA-N 0 3 401.510 4.226 20 0 HIADHN CN(Cc1cc(Br)ccc1F)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000409470478 855496602 /nfs/dbraw/zinc/49/66/02/855496602.db2.gz KRZLVRANVGDDLT-GOSISDBHSA-N 0 3 420.326 4.004 20 0 HIADHN O=C(NCc1ccc(-c2cccnc2)cc1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000437378528 862686615 /nfs/dbraw/zinc/68/66/15/862686615.db2.gz YKUIITJDCKWCCM-HSZRJFAPSA-N 0 3 403.501 4.416 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3C[C@H](C)O[C@@H](c4ccccc4)C3)c(C)c2)CC1 ZINC000409617223 855566599 /nfs/dbraw/zinc/56/65/99/855566599.db2.gz ROEONYDIYQYXQK-GBXCKJPGSA-N 0 3 422.573 4.131 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)N[C@H]1CCSc2ccc(F)cc21 ZINC000409647852 855581161 /nfs/dbraw/zinc/58/11/61/855581161.db2.gz DUQFCZLQXBGOGG-NRFANRHFSA-N 0 3 413.562 4.081 20 0 HIADHN CSc1cc(C(=O)N(CCCc2ccccc2)CCN(C)C)ccc1NC(C)=O ZINC000409696205 855606072 /nfs/dbraw/zinc/60/60/72/855606072.db2.gz GIFALKXLDGYOGH-UHFFFAOYSA-N 0 3 413.587 4.004 20 0 HIADHN CN(C(=O)c1ccc2c(c1)nc(C(F)F)n2C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000409791135 855656121 /nfs/dbraw/zinc/65/61/21/855656121.db2.gz PDYRHCMZFKXATJ-SFHVURJKSA-N 0 3 412.484 4.248 20 0 HIADHN CC[C@H](NCC(=O)N[C@H]1CCOc2ccccc21)c1ccc(Br)cc1 ZINC000409862332 855693427 /nfs/dbraw/zinc/69/34/27/855693427.db2.gz ZJVXHKUZFHVKJO-ROUUACIJSA-N 0 3 403.320 4.130 20 0 HIADHN CC(C)(Cc1nc2ccccc2[nH]1)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000410011407 855778739 /nfs/dbraw/zinc/77/87/39/855778739.db2.gz MRXVFIQWPJPIRG-UHFFFAOYSA-N 0 3 422.495 4.053 20 0 HIADHN Cc1ccc(-c2ccnn2C)cc1NC(=O)c1ccc(N2CCN(C(C)C)CC2)cc1 ZINC000410186209 855854658 /nfs/dbraw/zinc/85/46/58/855854658.db2.gz SKMSTVWURRYDDP-UHFFFAOYSA-N 0 3 417.557 4.178 20 0 HIADHN CC(C)[C@@H](NC(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1)c1ccc(F)cc1 ZINC000410221333 855867634 /nfs/dbraw/zinc/86/76/34/855867634.db2.gz VJQUZOUSSINNAM-KGVIQGDOSA-N 0 3 405.558 4.054 20 0 HIADHN O=C(NCCN1CCCCC1)c1ccc(COc2ccccc2Br)cc1 ZINC000410338121 855936653 /nfs/dbraw/zinc/93/66/53/855936653.db2.gz DIDCNQAOCMHJTO-UHFFFAOYSA-N 0 3 417.347 4.244 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@@H]2NCCc2nc3c(cccc3C)o2)cc1 ZINC000410358030 855947842 /nfs/dbraw/zinc/94/78/42/855947842.db2.gz HIKXBKFWEBSWJC-PZJWPPBQSA-N 0 3 412.555 4.362 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@H]2NCCc2nc3c(cccc3C)o2)cc1 ZINC000410358096 855947887 /nfs/dbraw/zinc/94/78/87/855947887.db2.gz HIKXBKFWEBSWJC-TZIWHRDSSA-N 0 3 412.555 4.362 20 0 HIADHN Cc1ccc(CNC(=O)N2CCN(C3CCOCC3)C[C@H]2C)c(Oc2ccccc2)c1 ZINC000426069875 856086427 /nfs/dbraw/zinc/08/64/27/856086427.db2.gz MERVNJUOAIAEIS-HXUWFJFHSA-N 0 3 423.557 4.182 20 0 HIADHN COc1ccccc1[C@H](CNC(=O)CCc1nc2cccc(C)c2[nH]1)N1CCCCC1 ZINC000426136914 856131813 /nfs/dbraw/zinc/13/18/13/856131813.db2.gz CJSRZPADABUJCN-NRFANRHFSA-N 0 3 420.557 4.156 20 0 HIADHN Cc1cc(F)cc2c(=O)c(C(=O)Nc3ccc(CC[NH+]4CCCCC4)cc3)c[n-]c12 ZINC000426203478 856173824 /nfs/dbraw/zinc/17/38/24/856173824.db2.gz AJZZRNNRLVSEBB-UHFFFAOYSA-N 0 3 407.489 4.256 20 0 HIADHN CC(C)c1nnc(CCN[C@@H](C)c2ccccc2I)s1 ZINC000426299806 856231029 /nfs/dbraw/zinc/23/10/29/856231029.db2.gz ASFBJIGPABXFOC-NSHDSACASA-N 0 3 401.317 4.159 20 0 HIADHN Cc1cc(CN[C@@H](C)Cc2ccc(Br)cc2F)nc(N2CCCC2)n1 ZINC000426317856 856242461 /nfs/dbraw/zinc/24/24/61/856242461.db2.gz HFQKLPJNUJFYHL-ZDUSSCGKSA-N 0 3 407.331 4.008 20 0 HIADHN CCN(CC)C(=O)Nc1ccc([C@H](C)NCc2cc3ccccc3n(C)c2=O)cc1 ZINC000426319695 856243571 /nfs/dbraw/zinc/24/35/71/856243571.db2.gz XKUXBLKFJCFXRZ-KRWDZBQOSA-N 0 3 406.530 4.263 20 0 HIADHN CN(CC(=O)OC(C)(C)C)C1CCN(Cc2cnc(-c3ccsc3)s2)CC1 ZINC000426383424 856268103 /nfs/dbraw/zinc/26/81/03/856268103.db2.gz VKBZKCJYNXGWFB-UHFFFAOYSA-N 0 3 407.605 4.110 20 0 HIADHN CC(=O)N(C)c1ccc(C(=O)N(CCN2CCCC2)Cc2ccc(Cl)cc2)cc1 ZINC000426386232 856269831 /nfs/dbraw/zinc/26/98/31/856269831.db2.gz WLFHFGZVYFXLQO-UHFFFAOYSA-N 0 3 413.949 4.061 20 0 HIADHN CO[C@@H](C)c1nc(Cc2noc([C@@H]3CN(C(C)(C)C)C[C@H]3C(F)(F)F)n2)cs1 ZINC000426451614 856297321 /nfs/dbraw/zinc/29/73/21/856297321.db2.gz SKHZFDNJSDUCJD-CYZMBNFOSA-N 0 3 418.485 4.201 20 0 HIADHN C[C@H](NC(=O)N1CCN(CC2CCCCC2)CC1)c1nc(C(F)(F)F)cs1 ZINC000426663631 856400464 /nfs/dbraw/zinc/40/04/64/856400464.db2.gz MOQJFAJKPDLWPT-ZDUSSCGKSA-N 0 3 404.502 4.130 20 0 HIADHN COCCOc1ccc(C(F)(F)F)cc1NC(=O)[C@@H](C)N1C[C@@H]2CCCC[C@@H]2C1 ZINC000426769041 856467408 /nfs/dbraw/zinc/46/74/08/856467408.db2.gz FKTBRIYPGHCXSE-OAGGEKHMSA-N 0 3 414.468 4.180 20 0 HIADHN COc1ccccc1[C@@H](NC(=O)N(CCN(C)C)Cc1ccc(C)o1)c1ccco1 ZINC000426777453 856472953 /nfs/dbraw/zinc/47/29/53/856472953.db2.gz NMCLKTIIAQDUKL-JOCHJYFZSA-N 0 3 411.502 4.052 20 0 HIADHN COc1ccccc1NC(=O)c1ccc(NC(=O)[C@H](C)N2C[C@@H]3CCCC[C@H]3C2)cc1 ZINC000426817971 856495346 /nfs/dbraw/zinc/49/53/46/856495346.db2.gz QNMHAVWEBXFURR-IHPCNDPISA-N 0 3 421.541 4.397 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1ccc(F)cc1C(F)(F)F ZINC000426904449 856535553 /nfs/dbraw/zinc/53/55/53/856535553.db2.gz GACZXWQGHWQNBO-UHFFFAOYSA-N 0 3 410.411 4.301 20 0 HIADHN COc1ccc(C(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)c2ccccc12 ZINC000427286830 856752198 /nfs/dbraw/zinc/75/21/98/856752198.db2.gz HWFGXQHFPVUBQF-RTBURBONSA-N 0 3 410.558 4.200 20 0 HIADHN Cc1nc(C(C)(C)C)sc1C(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000427298829 856758870 /nfs/dbraw/zinc/75/88/70/856758870.db2.gz GYLGLNQOVJOOIL-HZPDHXFCSA-N 0 3 407.624 4.101 20 0 HIADHN CSc1ccc(Cl)c(C(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)c1 ZINC000427298799 856758970 /nfs/dbraw/zinc/75/89/70/856758970.db2.gz GSKSXLMUAYTSBG-HZPDHXFCSA-N 0 3 411.011 4.413 20 0 HIADHN Cc1ccc(C(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)cc1Br ZINC000427298930 856759980 /nfs/dbraw/zinc/75/99/80/856759980.db2.gz HYVRLTBBQUZNPZ-IAGOWNOFSA-N 0 3 423.395 4.109 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)[C@@H]3C[C@H]3c3cccc(Cl)c3)CC2)C[C@@H](C)O1 ZINC000427318574 856768419 /nfs/dbraw/zinc/76/84/19/856768419.db2.gz ADAKEULEMHUHJY-FTIBCMOBSA-N 0 3 404.982 4.181 20 0 HIADHN CC(C)c1ccc(CCC(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)cc1 ZINC000427332135 856776314 /nfs/dbraw/zinc/77/63/14/856776314.db2.gz SAKZPBKKKRTGRE-OYRHEFFESA-N 0 3 400.607 4.481 20 0 HIADHN Cc1cccc(OCCCCC(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)c1 ZINC000427342547 856781440 /nfs/dbraw/zinc/78/14/40/856781440.db2.gz POXPHTPHGWKPNF-SZPZYZBQSA-N 0 3 416.606 4.282 20 0 HIADHN C[C@@H](CCc1cccc(F)c1)C(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000427343804 856783210 /nfs/dbraw/zinc/78/32/10/856783210.db2.gz YFQPBUHRGCTFOF-XUVXKRRUSA-N 0 3 404.570 4.132 20 0 HIADHN C[C@H](CCc1cccc(F)c1)C(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000427343801 856783780 /nfs/dbraw/zinc/78/37/80/856783780.db2.gz YFQPBUHRGCTFOF-AQNXPRMDSA-N 0 3 404.570 4.132 20 0 HIADHN Cc1ccc2[nH]cc(CCC(=O)N3CCC(CCN4C[C@@H](C)O[C@@H](C)C4)CC3)c2c1 ZINC000427363582 856796238 /nfs/dbraw/zinc/79/62/38/856796238.db2.gz XCOSMBKWNIOXAN-BGYRXZFFSA-N 0 3 411.590 4.147 20 0 HIADHN C[C@@H](NC1CCN(Cc2ccc(F)cc2)CC1)c1ncc(Br)cc1F ZINC000427592647 856881264 /nfs/dbraw/zinc/88/12/64/856881264.db2.gz GQIGRQIOFIICPO-CYBMUJFWSA-N 0 3 410.306 4.438 20 0 HIADHN O=c1ccccn1Cc1ccc(CN[C@H]2CCCc3ncc(C(F)(F)F)cc32)cc1 ZINC000427615752 856888029 /nfs/dbraw/zinc/88/80/29/856888029.db2.gz QENQVOSMKXWDQQ-FQEVSTJZSA-N 0 3 413.443 4.478 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)CCCCC(=O)c2ccc(F)cc2)CC1 ZINC000427669356 856903036 /nfs/dbraw/zinc/90/30/36/856903036.db2.gz YNXKHMGVTRVVGC-SFHVURJKSA-N 0 3 411.521 4.306 20 0 HIADHN COc1ccccc1N1CC[C@H](CN[C@H](C)c2ncc(Br)cc2F)C1 ZINC000427686482 856908665 /nfs/dbraw/zinc/90/86/65/856908665.db2.gz RGKXFNBQBJLQMX-ZIAGYGMSSA-N 0 3 408.315 4.169 20 0 HIADHN Cc1cc2c(cc1C)[C@@H](NCc1ccccc1CS(=O)(=O)NC(C)C)CCS2 ZINC000427689936 856909262 /nfs/dbraw/zinc/90/92/62/856909262.db2.gz KLSRWVFVVXNWBI-NRFANRHFSA-N 0 3 418.628 4.458 20 0 HIADHN C[C@H](NCC1CCN(C(=O)c2ccccc2)CC1)c1ncc(Br)cc1F ZINC000427709017 856918106 /nfs/dbraw/zinc/91/81/06/856918106.db2.gz FKJDXPWPBWRCHU-AWEZNQCLSA-N 0 3 420.326 4.186 20 0 HIADHN O=C(NC1CCCCC1)N1CCC(NCc2ccc(Sc3ccccn3)o2)CC1 ZINC000428275250 857136032 /nfs/dbraw/zinc/13/60/32/857136032.db2.gz GSTSVAMELILLII-UHFFFAOYSA-N 0 3 414.575 4.422 20 0 HIADHN Cc1ccc(OC(F)F)c(CN(C)[C@H](C)c2ccc(N3CCCS3(=O)=O)cc2)c1 ZINC000428426537 857200843 /nfs/dbraw/zinc/20/08/43/857200843.db2.gz NEAUMQFJCUCMMQ-MRXNPFEDSA-N 0 3 424.513 4.329 20 0 HIADHN COc1ccc2oc(CN(C)[C@H](C)c3cccc(N4CCCS4(=O)=O)c3)cc2c1 ZINC000428486338 857223049 /nfs/dbraw/zinc/22/30/49/857223049.db2.gz XCBJGOXWDLNPAA-MRXNPFEDSA-N 0 3 414.527 4.174 20 0 HIADHN Cc1ccc(-c2nc(CNC[C@H]3CN(Cc4ccccc4)CCCO3)cs2)cc1 ZINC000428534151 857247650 /nfs/dbraw/zinc/24/76/50/857247650.db2.gz FGGPHDJJFPKBQV-QHCPKHFHSA-N 0 3 407.583 4.499 20 0 HIADHN OC[C@]1(CNCc2cc(Cl)ccc2OC[C@@H]2CCCO2)C[C@@H]1c1ccc(F)cc1 ZINC000428541052 857253106 /nfs/dbraw/zinc/25/31/06/857253106.db2.gz DONDNJSKQWTBFY-QZNHQXDQSA-N 0 3 419.924 4.293 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@@H](O)C2)c1)c1ccc(Oc2ccncc2)c(Cl)c1 ZINC000428550657 857259432 /nfs/dbraw/zinc/25/94/32/857259432.db2.gz ROYGFBBPTURGCR-LJQANCHMSA-N 0 3 423.900 4.346 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@@H](O)C2)c1)c1cccc(-c2c(F)cccc2F)c1 ZINC000428555112 857263468 /nfs/dbraw/zinc/26/34/68/857263468.db2.gz WWIZEOGMNPKQKH-HXUWFJFHSA-N 0 3 408.448 4.451 20 0 HIADHN Cc1csc(Nc2ccc(C(=O)Nc3cccc(CN4CC[C@@H](O)C4)c3)cc2)n1 ZINC000428554499 857264063 /nfs/dbraw/zinc/26/40/63/857264063.db2.gz ZSFPQZHAZJDEHT-HXUWFJFHSA-N 0 3 408.527 4.014 20 0 HIADHN C[C@H](CNC(=O)N1CCC(c2ncccc2Cl)CC1)N(C)Cc1ccccc1 ZINC000428576829 857269783 /nfs/dbraw/zinc/26/97/83/857269783.db2.gz CYSXHBMQPVWLDX-QGZVFWFLSA-N 0 3 400.954 4.145 20 0 HIADHN CC(C)(C)[C@@H](CN1CCc2ccccc2C1)NC(=O)N1CCC(c2ccncc2)CC1 ZINC000428586155 857273118 /nfs/dbraw/zinc/27/31/18/857273118.db2.gz FNHSABOXZDYHCJ-XMMPIXPASA-N 0 3 420.601 4.444 20 0 HIADHN O=C(C(=O)N1CC[C@]2(C1)CCCN(Cc1ccccc1)C2)c1ccc(Cl)s1 ZINC000428648148 857288919 /nfs/dbraw/zinc/28/89/19/857288919.db2.gz PRQKUOACTGXMON-OAQYLSRUSA-N 0 3 402.947 4.099 20 0 HIADHN CCN1CCCN(C(=O)N[C@@H](c2ccccc2Cl)c2ccccc2OC)CC1 ZINC000428683737 857296591 /nfs/dbraw/zinc/29/65/91/857296591.db2.gz GHPIARUSZKGASA-NRFANRHFSA-N 0 3 401.938 4.175 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3CC[C@@H](Cc4ccccc4)C3)c(C)c2)CC1 ZINC000437576626 862895410 /nfs/dbraw/zinc/89/54/10/862895410.db2.gz JTRJMUNLHZBELA-QFIPXVFZSA-N 0 3 406.574 4.233 20 0 HIADHN O=S1(=O)CCC2(CCN(CCCCOc3ccccc3C(F)(F)F)CC2)CC1 ZINC000428699311 857301503 /nfs/dbraw/zinc/30/15/03/857301503.db2.gz HPBJFVFOBUKFTK-UHFFFAOYSA-N 0 3 419.509 4.155 20 0 HIADHN COC(=O)c1ccoc1CN(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000428773699 857329876 /nfs/dbraw/zinc/32/98/76/857329876.db2.gz RBANGWYFVGHUDZ-JOCHJYFZSA-N 0 3 419.525 4.128 20 0 HIADHN CC(C)c1nc(CN(Cc2ccncc2)[C@H]2CCCN(Cc3ccccc3)C2)no1 ZINC000428778705 857334179 /nfs/dbraw/zinc/33/41/79/857334179.db2.gz CUXOMCVHYDYGIC-QFIPXVFZSA-N 0 3 405.546 4.255 20 0 HIADHN CCCCc1noc(CN(Cc2ccncc2)[C@@H]2CCCN(Cc3ccccc3)C2)n1 ZINC000428798810 857347588 /nfs/dbraw/zinc/34/75/88/857347588.db2.gz USNRRHAIZLFLGM-HSZRJFAPSA-N 0 3 419.573 4.474 20 0 HIADHN CC(C)(C)c1noc(CN(Cc2ccncc2)[C@@H]2CCCN(Cc3ccccc3)C2)n1 ZINC000428802388 857350015 /nfs/dbraw/zinc/35/00/15/857350015.db2.gz JDPRUBUPLZKCRE-JOCHJYFZSA-N 0 3 419.573 4.429 20 0 HIADHN COC(=O)c1ccc(CN(Cc2ccncc2)[C@@H]2CCCN(Cc3ccccc3)C2)o1 ZINC000428811033 857355535 /nfs/dbraw/zinc/35/55/35/857355535.db2.gz ZLQYTNNGTUTLSK-JOCHJYFZSA-N 0 3 419.525 4.128 20 0 HIADHN CCOc1cccc([C@H](C)NC(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)c1 ZINC000428834581 857365295 /nfs/dbraw/zinc/36/52/95/857365295.db2.gz NKEUKCIEJWJCKA-UFYCRDLUSA-N 0 3 417.594 4.067 20 0 HIADHN C[C@H](C(=O)Nc1cccc(F)c1)N1CCN([C@H]2CC[C@@](C)(c3ccccc3)C2)CC1 ZINC000437590446 862903149 /nfs/dbraw/zinc/90/31/49/862903149.db2.gz MIZPCMDXPVWMDY-HFRGRHLUSA-N 0 3 409.549 4.281 20 0 HIADHN C[C@@H](c1ccccc1)[C@@H](NCc1cn(-c2ccccc2)nc1-c1ccccc1)C(N)=O ZINC000428846149 857370599 /nfs/dbraw/zinc/37/05/99/857370599.db2.gz AVFIUNPWLQLLDQ-YADARESESA-N 0 3 410.521 4.287 20 0 HIADHN OC[C@@H](CNCc1nc2ccc(F)cc2s1)Cc1ccccc1OC(F)(F)F ZINC000428852581 857372708 /nfs/dbraw/zinc/37/27/08/857372708.db2.gz UHLCBZKVTKIJDG-GFCCVEGCSA-N 0 3 414.424 4.275 20 0 HIADHN CCn1cnnc1-c1ccccc1NC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC000428896052 857397600 /nfs/dbraw/zinc/39/76/00/857397600.db2.gz LEBXRNFELBPRJF-LJQANCHMSA-N 0 3 418.545 4.093 20 0 HIADHN CCn1cnnc1-c1ccccc1NC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C ZINC000428898047 857399038 /nfs/dbraw/zinc/39/90/38/857399038.db2.gz UDTISHHSLGZFDZ-LJQANCHMSA-N 0 3 418.545 4.093 20 0 HIADHN O=C(C1CCN(Cc2cccc3c(Br)cccc23)CC1)N1CCCC1 ZINC000428940181 857427476 /nfs/dbraw/zinc/42/74/76/857427476.db2.gz PDWHWTLKKNETNT-UHFFFAOYSA-N 0 3 401.348 4.437 20 0 HIADHN Cc1ccc(C)c([C@H](C)N(C)C(=O)NC[C@H]2CN(Cc3ccccc3)CCCO2)c1 ZINC000429017507 857459908 /nfs/dbraw/zinc/45/99/08/857459908.db2.gz FNNBMMDUJVHTRS-GMAHTHKFSA-N 0 3 409.574 4.297 20 0 HIADHN CC(C)N(Cc1ccccc1F)C(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000429035618 857467050 /nfs/dbraw/zinc/46/70/50/857467050.db2.gz NJZXFDMBMCEJEP-QFIPXVFZSA-N 0 3 413.537 4.037 20 0 HIADHN Cc1ccc(CN(C(=O)NC[C@@H]2CN(Cc3ccccc3)CCCO2)C(C)C)s1 ZINC000429036955 857469053 /nfs/dbraw/zinc/46/90/53/857469053.db2.gz RXFJGSHHWQCWPI-OAQYLSRUSA-N 0 3 415.603 4.268 20 0 HIADHN CCN(C(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1)[C@H](C)Cc1ccsc1 ZINC000429040679 857470229 /nfs/dbraw/zinc/47/02/29/857470229.db2.gz IWKDDRSPZWBYBM-DENIHFKCSA-N 0 3 415.603 4.002 20 0 HIADHN COc1ccc(Cl)c(NC(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)c1 ZINC000429046880 857474683 /nfs/dbraw/zinc/47/46/83/857474683.db2.gz ONJFNPROAZRTKE-HZPDHXFCSA-N 0 3 409.958 4.092 20 0 HIADHN CC(C)[C@@H](NC(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1)c1ccccc1 ZINC000429172967 857541011 /nfs/dbraw/zinc/54/10/11/857541011.db2.gz SWNSRVFUMRIMGR-ZRCGQRJVSA-N 0 3 401.595 4.305 20 0 HIADHN C[C@H](NC(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1)c1cccc(Cl)c1 ZINC000429201307 857550922 /nfs/dbraw/zinc/55/09/22/857550922.db2.gz RVMSOGUCFUNEJY-KURKYZTESA-N 0 3 407.986 4.322 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)N[C@@H](c3cccs3)C3CC3)CC2)C[C@@H](C)O1 ZINC000429210398 857555781 /nfs/dbraw/zinc/55/57/81/857555781.db2.gz YCIPOYIQWRAZFK-CBGDNZLLSA-N 0 3 405.608 4.120 20 0 HIADHN CCCn1ccnc1CCCN(C)CC(=O)N[C@H](C)c1ccc(Cl)c(Cl)c1 ZINC000429237358 857568034 /nfs/dbraw/zinc/56/80/34/857568034.db2.gz OSTIMZKFLVDPBT-OAHLLOKOSA-N 0 3 411.377 4.342 20 0 HIADHN CCCn1ccnc1CCCN(C)[C@H]1CCN(c2ccc(Cl)cc2Cl)C1=O ZINC000429246978 857572581 /nfs/dbraw/zinc/57/25/81/857572581.db2.gz PRRBZVDPTBDNJU-SFHVURJKSA-N 0 3 409.361 4.270 20 0 HIADHN O[C@H](COc1cccc2[nH]ccc21)CN(CCc1ccccc1)Cc1cccnc1 ZINC000429283157 857589920 /nfs/dbraw/zinc/58/99/20/857589920.db2.gz IAKQJVACIVIHSK-QFIPXVFZSA-N 0 3 401.510 4.048 20 0 HIADHN CCO[C@H]1C[C@@H](NCC(=O)Nc2c(F)cc(F)cc2Br)C1(CC)CC ZINC000429329628 857604841 /nfs/dbraw/zinc/60/48/41/857604841.db2.gz AYYZGRDWIWKDEQ-CABCVRRESA-N 0 3 419.310 4.239 20 0 HIADHN CC(C)c1ccccc1NC(=O)C[C@@H](C)NCc1ccc(S(C)(=O)=O)c(Cl)c1 ZINC000429421084 857657867 /nfs/dbraw/zinc/65/78/67/857657867.db2.gz UMMOYIOBBIOUNK-OAHLLOKOSA-N 0 3 422.978 4.374 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)N(Cc2ccccc2)[C@H]2CCCC2(C)C)CC1 ZINC000429426384 857660976 /nfs/dbraw/zinc/66/09/76/857660976.db2.gz FTXPBWSSCSUMKD-GGAORHGYSA-N 0 3 414.638 4.051 20 0 HIADHN COCCS(=O)(=O)c1ccc(CN[C@H]2CCCCc3ccc(Cl)cc32)cc1 ZINC000429426897 857661027 /nfs/dbraw/zinc/66/10/27/857661027.db2.gz GVVPCGWSTFWUHN-NRFANRHFSA-N 0 3 407.963 4.317 20 0 HIADHN COCCS(=O)(=O)c1ccc(CN[C@H](C)c2cccc(-c3ccncc3)c2)cc1 ZINC000429455269 857679611 /nfs/dbraw/zinc/67/96/11/857679611.db2.gz PVTKWHGMJQXQNS-GOSISDBHSA-N 0 3 410.539 4.020 20 0 HIADHN C[C@@H](NC[C@@H](CO)Cc1cccc(Br)c1)c1nc2c(s1)CCCC2 ZINC000429456811 857679827 /nfs/dbraw/zinc/67/98/27/857679827.db2.gz RHSGZGHPAJNDJE-HIFRSBDPSA-N 0 3 409.393 4.286 20 0 HIADHN CCO[C@@H]1C[C@H](NC(=O)N(Cc2ccco2)C2CCN(C)CC2)C12CCCCC2 ZINC000429463413 857684089 /nfs/dbraw/zinc/68/40/89/857684089.db2.gz BPNNMYYKGUBGNI-LEWJYISDSA-N 0 3 403.567 4.013 20 0 HIADHN COC1CCC(N(C)C(=O)N[C@H](CN2CCc3ccccc3C2)C(C)(C)C)CC1 ZINC000429496892 857698051 /nfs/dbraw/zinc/69/80/51/857698051.db2.gz ZRUMHDVHJDYHSG-LZBANZJXSA-N 0 3 401.595 4.058 20 0 HIADHN Cc1ccc([C@H](C)CNC(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)cc1 ZINC000429504241 857702403 /nfs/dbraw/zinc/70/24/03/857702403.db2.gz PDVNAIXLSQPBAR-NJYVYQBISA-N 0 3 401.595 4.019 20 0 HIADHN COc1ccc([C@@H](N[C@H](C)CC2(OC)CCC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000429517279 857711697 /nfs/dbraw/zinc/71/16/97/857711697.db2.gz NBOWYELVIPSWFF-VGOFRKELSA-N 0 3 417.571 4.125 20 0 HIADHN Cc1noc(C[C@@H](NC[C@H](O)COc2ccc(C(C)(C)C)cc2C)c2ccccc2)n1 ZINC000429530829 857723397 /nfs/dbraw/zinc/72/33/97/857723397.db2.gz QNBYIAOENRFLKC-FCHUYYIVSA-N 0 3 423.557 4.297 20 0 HIADHN CN(C(=O)Nc1ccnn1Cc1ccc(F)cc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000429573018 857757798 /nfs/dbraw/zinc/75/77/98/857757798.db2.gz XFGRSVVXCAUTFK-QFIPXVFZSA-N 0 3 421.520 4.199 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)Nc2ccnn2Cc2ccc(F)cc2)CC1 ZINC000429593189 857775939 /nfs/dbraw/zinc/77/59/39/857775939.db2.gz VJWUEHMIHPNZCC-UHFFFAOYSA-N 0 3 421.520 4.199 20 0 HIADHN Cc1nc(CC(C)C)c(NC(=O)NC[C@@H]2CN(Cc3ccccc3)CCCO2)s1 ZINC000429601184 857784217 /nfs/dbraw/zinc/78/42/17/857784217.db2.gz KVTNTPHXOKZLBR-LJQANCHMSA-N 0 3 416.591 4.063 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NCc1nnc(C(=O)Nc2ccccc2)s1 ZINC000429638508 857812559 /nfs/dbraw/zinc/81/25/59/857812559.db2.gz YYILQXFSYXUAOX-HXUWFJFHSA-N 0 3 423.586 4.037 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NCc1nnc(C(=O)Nc2ccccc2)s1 ZINC000429638507 857812628 /nfs/dbraw/zinc/81/26/28/857812628.db2.gz YYILQXFSYXUAOX-FQEVSTJZSA-N 0 3 423.586 4.037 20 0 HIADHN CC[C@H](NC[C@@H]1CN(Cc2ccccc2)CCCO1)c1nc(C(F)(F)F)cs1 ZINC000429683072 857833643 /nfs/dbraw/zinc/83/36/43/857833643.db2.gz PLOJAGZZYGGJAB-SJORKVTESA-N 0 3 413.509 4.494 20 0 HIADHN CN(C)CCN(C[C@@H]1CCCO1)C(=O)Nc1ccc(C(C)(C)C(F)(F)F)cc1 ZINC000429691854 857837225 /nfs/dbraw/zinc/83/72/25/857837225.db2.gz PXMOXVCYNDYGMD-KRWDZBQOSA-N 0 3 401.473 4.101 20 0 HIADHN CCOC(=O)c1ncn(C2CCN(Cc3sc4ccccc4c3Cl)CC2)c1N ZINC000429718896 857848591 /nfs/dbraw/zinc/84/85/91/857848591.db2.gz BNIQTRSUOFHVJF-UHFFFAOYSA-N 0 3 418.950 4.347 20 0 HIADHN Cc1ccc(-c2noc(CCCN3CCC(Oc4ccncc4C)CC3)n2)cc1F ZINC000429728627 857853321 /nfs/dbraw/zinc/85/33/21/857853321.db2.gz ZNKIWVWEQQKBFE-UHFFFAOYSA-N 0 3 410.493 4.364 20 0 HIADHN c1csc(CN(C[C@@H]2CCCO2)C[C@@H]2CN(Cc3ccccc3)CCCO2)c1 ZINC000429732843 857856033 /nfs/dbraw/zinc/85/60/33/857856033.db2.gz YYOJJKFBZNXLHL-VXKWHMMOSA-N 0 3 400.588 4.020 20 0 HIADHN Cc1ccc(C(F)(F)F)cc1NC(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000429748244 857868100 /nfs/dbraw/zinc/86/81/00/857868100.db2.gz AIMJZQMOYQWHOH-LJQANCHMSA-N 0 3 421.463 4.426 20 0 HIADHN CCSCc1cccc(NC(=O)NC[C@@H]2CN(Cc3ccccc3)CCCO2)c1 ZINC000429771411 857879180 /nfs/dbraw/zinc/87/91/80/857879180.db2.gz VWHXYVCUUPLUIH-JOCHJYFZSA-N 0 3 413.587 4.352 20 0 HIADHN O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)Nc1cccc(CC(F)(F)F)c1 ZINC000429771103 857879518 /nfs/dbraw/zinc/87/95/18/857879518.db2.gz HNARVCHOVGHUJX-HXUWFJFHSA-N 0 3 421.463 4.204 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCc1ccncc1C)c1ccc(C(F)(F)F)cc1 ZINC000429777313 857881770 /nfs/dbraw/zinc/88/17/70/857881770.db2.gz VMALQWZQWNPDMU-IBGZPJMESA-N 0 3 408.468 4.291 20 0 HIADHN CCCN1c2ccc(NC(=O)N[C@H](C)[C@@H](c3ccccc3)N(C)C)cc2CCC1=O ZINC000429982836 857982459 /nfs/dbraw/zinc/98/24/59/857982459.db2.gz SVUKDODKNORMRC-HXOBKFHXSA-N 0 3 408.546 4.189 20 0 HIADHN COc1ccc([C@H](NC(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)C(F)(F)F)cc1 ZINC000429983456 857983155 /nfs/dbraw/zinc/98/31/55/857983155.db2.gz WEJMQRZQTKBWJV-KYNGSXCRSA-N 0 3 409.452 4.289 20 0 HIADHN CC(C)C(=O)Nc1ccc(NC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)cc1 ZINC000437644273 862973249 /nfs/dbraw/zinc/97/32/49/862973249.db2.gz DYTYSQOXBIXMKX-IBGZPJMESA-N 0 3 408.546 4.409 20 0 HIADHN Cc1ccccc1-c1nnc(SC[C@H]2CN(Cc3ccccc3)CCCO2)n1C ZINC000430096190 858029748 /nfs/dbraw/zinc/02/97/48/858029748.db2.gz FYUMLMSSTYVGOR-HXUWFJFHSA-N 0 3 408.571 4.174 20 0 HIADHN COC(=O)[C@@H]1CCO[C@H]1C1CCN(Cc2c(OC(F)F)ccc3ccccc32)CC1 ZINC000430102974 858032931 /nfs/dbraw/zinc/03/29/31/858032931.db2.gz KRHPRUQESLXTCS-NQIIRXRSSA-N 0 3 419.468 4.231 20 0 HIADHN CN(CCSc1nnc(-c2cccnc2)n1Cc1ccco1)Cc1ccccc1 ZINC000430104058 858033106 /nfs/dbraw/zinc/03/31/06/858033106.db2.gz QREIGKHSRMAQJY-UHFFFAOYSA-N 0 3 405.527 4.206 20 0 HIADHN Cc1ccc(-c2nnc(SC[C@H]3CN(Cc4ccccc4)CCCO3)n2C)cc1 ZINC000430107332 858034254 /nfs/dbraw/zinc/03/42/54/858034254.db2.gz WXUWSLTVOOZOJI-OAQYLSRUSA-N 0 3 408.571 4.174 20 0 HIADHN COCCn1c2ccccc2nc1SC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000430115545 858038102 /nfs/dbraw/zinc/03/81/02/858038102.db2.gz BKSQXMPMACNNCI-FQEVSTJZSA-N 0 3 411.571 4.066 20 0 HIADHN C[C@@H]1C[C@@]2(CCO1)CN(CCC(=O)Nc1ccccc1Oc1ccccc1)C[C@H](C)O2 ZINC000430270694 858103845 /nfs/dbraw/zinc/10/38/45/858103845.db2.gz SLRXNSNRFBKJHE-RNHFSVANSA-N 0 3 424.541 4.466 20 0 HIADHN C[C@@H]1C[C@@]2(CCO1)CN(CCC(=O)Nc1ccccc1-c1ccccc1)C[C@H](C)O2 ZINC000430278485 858105962 /nfs/dbraw/zinc/10/59/62/858105962.db2.gz QDQRXESXMACRHG-RNHFSVANSA-N 0 3 408.542 4.341 20 0 HIADHN CN(C(=O)c1cccc(CN2CCCC2)c1)[C@@H]1c2cc(Cl)cc(Cl)c2C[C@H]1O ZINC000430423427 858154637 /nfs/dbraw/zinc/15/46/37/858154637.db2.gz GCYGOBRSYGBUFY-NHCUHLMSSA-N 0 3 419.352 4.320 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)CCC(=O)c2ccc(F)cc2F)CCN1Cc1ccccc1 ZINC000430685686 858269533 /nfs/dbraw/zinc/26/95/33/858269533.db2.gz RZYORTWKPNMRSF-APWZRJJASA-N 0 3 400.469 4.097 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3ccc(OC(C)(C)C)cc3)CC2)C[C@H](C)O1 ZINC000430692915 858271357 /nfs/dbraw/zinc/27/13/57/858271357.db2.gz XHPFPVWLWAXYPF-KDURUIRLSA-N 0 3 402.579 4.215 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3cccc(C(F)(F)F)c3F)CC2)C[C@@H](C)O1 ZINC000430692199 858271685 /nfs/dbraw/zinc/27/16/85/858271685.db2.gz QSAAASWTOFNECF-HUUCEWRRSA-N 0 3 416.459 4.196 20 0 HIADHN C[C@H](N[C@@H]1CC(C)(C)c2ccccc21)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000430704713 858274276 /nfs/dbraw/zinc/27/42/76/858274276.db2.gz JJRZUKPHHCQVMR-YVEFUNNKSA-N 0 3 423.376 4.170 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)CCC(=O)c2ccc3c(c2)CCC3)CCN1Cc1ccccc1 ZINC000430741508 858283712 /nfs/dbraw/zinc/28/37/12/858283712.db2.gz SYFOPTCMZISKGJ-DVECYGJZSA-N 0 3 404.554 4.308 20 0 HIADHN COc1ccc([C@H](CNC(=O)N[C@H]2C[C@H](c3ccc(F)cc3)C2)N2CCCC2)cc1 ZINC000430940271 858376905 /nfs/dbraw/zinc/37/69/05/858376905.db2.gz ODQAJDJMVCDWBH-RRPUWOKSSA-N 0 3 411.521 4.217 20 0 HIADHN O=C1N[C@H](C[C@H]2CCCc3ccccc32)C(=O)N1C[C@@H](c1cccs1)N1CCCC1 ZINC000430979103 858389856 /nfs/dbraw/zinc/38/98/56/858389856.db2.gz TUNRGQJEQZZXKN-NRSPTQNISA-N 0 3 423.582 4.316 20 0 HIADHN Cc1ccc([C@@H](CN2C(=O)[C@@H](Cc3ccccc3)N(C3CC3)C2=O)N2CCCC2)cc1 ZINC000431061228 858427581 /nfs/dbraw/zinc/42/75/81/858427581.db2.gz JEKLDLBATXLDIM-DNQXCXABSA-N 0 3 417.553 4.170 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)NC[C@@H]1CCC(F)(F)C1 ZINC000431116489 858453625 /nfs/dbraw/zinc/45/36/25/858453625.db2.gz WYJUXLJGAZPJDA-OAHLLOKOSA-N 0 3 407.427 4.214 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)Nc1ccc2nc(C3CC3)oc2c1 ZINC000431139626 858465915 /nfs/dbraw/zinc/46/59/15/858465915.db2.gz PVSVISZFLFUCKC-UHFFFAOYSA-N 0 3 400.548 4.188 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)c1cccc(OCC(F)(F)F)c1 ZINC000431478053 858635957 /nfs/dbraw/zinc/63/59/57/858635957.db2.gz OLZBGNDAJBZNNP-KRWDZBQOSA-N 0 3 406.448 4.364 20 0 HIADHN Cc1ccc(NC(=O)NC[C@H]2CCCN(Cc3c[nH]nc3-c3ccsc3)C2)cc1 ZINC000437715379 863046580 /nfs/dbraw/zinc/04/65/80/863046580.db2.gz FEHMZGXZQZQVAX-QGZVFWFLSA-N 0 3 409.559 4.480 20 0 HIADHN COc1ccccc1CSc1ccccc1NC(=O)N1CC[C@@H](N2CC=CC2)C1 ZINC000431724722 858765604 /nfs/dbraw/zinc/76/56/04/858765604.db2.gz VXGPNOZIGYLIRM-LJQANCHMSA-N 0 3 409.555 4.466 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CC(C)(C)[C@H]1c1ccncc1)c1cccc(OC)c1 ZINC000431775107 858805932 /nfs/dbraw/zinc/80/59/32/858805932.db2.gz HQQMVNPCCMSQGW-FCHUYYIVSA-N 0 3 410.562 4.266 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N[C@H]1C[C@H](c2ccc(F)cc2)C1 ZINC000431913910 858868606 /nfs/dbraw/zinc/86/86/06/858868606.db2.gz YBWDFRIZCXEVRG-OOFWROHXSA-N 0 3 413.459 4.176 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N1CCC[C@@H](c2ccccc2)C1 ZINC000431917632 858870382 /nfs/dbraw/zinc/87/03/82/858870382.db2.gz YQDCFZPEAKBVEW-QHGAOEGBSA-N 0 3 409.496 4.381 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)c3cc(F)ccc3Cl)CC2)c1 ZINC000431953614 858885176 /nfs/dbraw/zinc/88/51/76/858885176.db2.gz JLRKLOSVZZNDMK-UHFFFAOYSA-N 0 3 403.929 4.120 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)c3c(Cl)cncc3Cl)CC2)c1 ZINC000431959533 858888212 /nfs/dbraw/zinc/88/82/12/858888212.db2.gz VBTBVYSQXKKOJK-UHFFFAOYSA-N 0 3 421.372 4.029 20 0 HIADHN CCN(CC)[C@H](CNC(=O)C1(Cc2ccc(F)cc2)CCOCC1)c1ccsc1 ZINC000432007785 858922157 /nfs/dbraw/zinc/92/21/57/858922157.db2.gz RULFIQYJZWDRQL-OAQYLSRUSA-N 0 3 418.578 4.426 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)N[C@H](c3ccc(F)cc3)C(F)(F)F)CC2)c1 ZINC000467554221 881375779 /nfs/dbraw/zinc/37/57/79/881375779.db2.gz OCGYLTIVBXJEOB-OAQYLSRUSA-N 0 3 423.454 4.066 20 0 HIADHN COc1ccccc1CC(=O)N1CCC(NCc2csc(Cl)c2Cl)CC1 ZINC000432238448 859062587 /nfs/dbraw/zinc/06/25/87/859062587.db2.gz RBADOZSSMPDHNG-UHFFFAOYSA-N 0 3 413.370 4.387 20 0 HIADHN CCN1CCCN(C(=O)c2c(C)c(C3CC3)nc3ccc(Br)cc32)CC1 ZINC000432285563 859085463 /nfs/dbraw/zinc/08/54/63/859085463.db2.gz LMYYELFZWKYZFH-UHFFFAOYSA-N 0 3 416.363 4.351 20 0 HIADHN COc1cnccc1N1CCN(C(=O)Nc2ccc(-c3ccccc3)c(C)c2)CC1 ZINC000432413290 859153217 /nfs/dbraw/zinc/15/32/17/859153217.db2.gz LVLVCACXAXTUQN-UHFFFAOYSA-N 0 3 402.498 4.420 20 0 HIADHN Cc1cnc(C2CCN(C(=O)[C@@H]3CCCN(Cc4cccc(F)c4)C3)CC2)s1 ZINC000432483485 859186862 /nfs/dbraw/zinc/18/68/62/859186862.db2.gz OXDZCXGKGNYODL-LJQANCHMSA-N 0 3 401.551 4.209 20 0 HIADHN Cc1noc(C)c1NC(=O)N(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000432818034 859373315 /nfs/dbraw/zinc/37/33/15/859373315.db2.gz DAIOHGAQZXAKOS-JOCHJYFZSA-N 0 3 419.529 4.385 20 0 HIADHN COC(=O)c1cc([C@@H](C)N2CCC[C@@H](c3nnc(C4CCCCC4)[nH]3)C2)oc1C ZINC000432850367 859387450 /nfs/dbraw/zinc/38/74/50/859387450.db2.gz JKFWQSGZTJEHSX-RHSMWYFYSA-N 0 3 400.523 4.481 20 0 HIADHN COC(=O)c1cc([C@@H](C)N2CCC[C@H](c3nnc(C4CCCCC4)[nH]3)C2)oc1C ZINC000432850366 859387980 /nfs/dbraw/zinc/38/79/80/859387980.db2.gz JKFWQSGZTJEHSX-PBHICJAKSA-N 0 3 400.523 4.481 20 0 HIADHN CC[C@@H](CNC(=O)NCCC1CC(OC(C)(C)C)C1)N1CCc2ccccc2C1 ZINC000432863822 859394722 /nfs/dbraw/zinc/39/47/22/859394722.db2.gz JSHURIVBFROBNP-QUENFVSXSA-N 0 3 401.595 4.106 20 0 HIADHN Cc1nc(CN(c2ccc(F)cc2)S(=O)(=O)c2ccc(CN(C)C)cc2)cs1 ZINC000432875705 859402138 /nfs/dbraw/zinc/40/21/38/859402138.db2.gz ZWMQIJZCXPMZRE-UHFFFAOYSA-N 0 3 419.547 4.048 20 0 HIADHN COC(=O)c1ccccc1-c1ccc(CNC[C@]2(CO)C[C@H]2c2ccc(F)cc2)o1 ZINC000433045426 859496874 /nfs/dbraw/zinc/49/68/74/859496874.db2.gz QOJXRRBYXNSIBF-URXFXBBRSA-N 0 3 409.457 4.128 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)[C@@H]1C[C@H]1c1cc(F)c(F)c(F)c1 ZINC000467635512 881433924 /nfs/dbraw/zinc/43/39/24/881433924.db2.gz YTVLIGNUGXYCPK-RBUKOAKNSA-N 0 3 418.459 4.050 20 0 HIADHN Cc1ncc(CN[C@H](Cc2ccccc2Br)c2ccc(F)cc2)c(=O)[nH]1 ZINC000467640343 881437185 /nfs/dbraw/zinc/43/71/85/881437185.db2.gz NACICPMYKQZSBV-LJQANCHMSA-N 0 3 416.294 4.466 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Cc2cscc2Br)N2CCCC2)cc1 ZINC000433241747 859586660 /nfs/dbraw/zinc/58/66/60/859586660.db2.gz BXBIFHXJBCVVDR-SFHVURJKSA-N 0 3 407.377 4.315 20 0 HIADHN C[C@@H](NCCNC(=O)CC1CCCC1)c1ccc(OC[C@H]2CCCCO2)c(F)c1 ZINC000433369869 859661821 /nfs/dbraw/zinc/66/18/21/859661821.db2.gz ANYVRDUKKQYXCS-YLJYHZDGSA-N 0 3 406.542 4.121 20 0 HIADHN C[C@@H]1C[C@]2(CCN1Cc1ccccc1)Nc1ccc(Br)cc1C(=O)N2C ZINC000433373685 859663542 /nfs/dbraw/zinc/66/35/42/859663542.db2.gz KKJOMGYNFHGMSP-QVKFZJNVSA-N 0 3 414.347 4.327 20 0 HIADHN C[C@H](NC[C@@H](O)COc1ccc(F)cc1)c1ccc(OC[C@H]2CCCCO2)c(F)c1 ZINC000433397450 859675864 /nfs/dbraw/zinc/67/58/64/859675864.db2.gz IYVQIBPDPCDQLB-LDQXTDLNSA-N 0 3 421.484 4.003 20 0 HIADHN CN(C(=O)NCCC1CC(OC(C)(C)C)C1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000433479854 859722288 /nfs/dbraw/zinc/72/22/88/859722288.db2.gz JGJIJKOOWQRDOB-ATKRNPRHSA-N 0 3 401.595 4.276 20 0 HIADHN O=C(NC1CCN(Cc2ccccc2)CC1)c1ccc(-c2nc(C3CC3)no2)cc1 ZINC000433504952 859740228 /nfs/dbraw/zinc/74/02/28/859740228.db2.gz BTFSSXJYDBNHAL-UHFFFAOYSA-N 0 3 402.498 4.008 20 0 HIADHN COc1cccc([C@H](CNC(=O)Nc2ccc(Cl)c(OC)c2)N2CCCC2)c1 ZINC000433604701 859806421 /nfs/dbraw/zinc/80/64/21/859806421.db2.gz SHRRCTKWQNFIEH-IBGZPJMESA-N 0 3 403.910 4.316 20 0 HIADHN C[C@H]1CN(C2CCOCC2)CCN1C(=O)Nc1ccccc1CN(C)c1ccccc1 ZINC000433663633 859829417 /nfs/dbraw/zinc/82/94/17/859829417.db2.gz WZWAXHAHZNSRIP-FQEVSTJZSA-N 0 3 422.573 4.040 20 0 HIADHN O=C(N1CC[C@H](CC(F)(F)F)C1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000433738301 859866530 /nfs/dbraw/zinc/86/65/30/859866530.db2.gz CWPCHXNWNVMVEX-NVXWUHKLSA-N 0 3 408.386 4.242 20 0 HIADHN CC(C)[C@H](N[C@H](C)C(=O)Nc1ccccc1S(C)(=O)=O)c1ccc(Cl)cc1 ZINC000433779208 859889963 /nfs/dbraw/zinc/88/99/63/859889963.db2.gz HQPHRIQCRSITGB-KUHUBIRLSA-N 0 3 408.951 4.057 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)Nc1c2c(ccc1Cl)OCC2 ZINC000433790433 859894104 /nfs/dbraw/zinc/89/41/04/859894104.db2.gz XEFTXUJVDBBYPS-UHFFFAOYSA-N 0 3 409.864 4.149 20 0 HIADHN Cn1cc(-c2cc(F)ccc2NC(=O)NC[C@@H](c2cccs2)N2CCCC2)cn1 ZINC000433797527 859896648 /nfs/dbraw/zinc/89/66/48/859896648.db2.gz AUJLRUPIARVQPQ-IBGZPJMESA-N 0 3 413.522 4.246 20 0 HIADHN O=C(Nc1ccc(-c2csc(C(F)(F)F)n2)cc1)N1CC[C@@H](N2CC=CC2)C1 ZINC000433803233 859900373 /nfs/dbraw/zinc/90/03/73/859900373.db2.gz SVMDOLJVJIMNIR-OAHLLOKOSA-N 0 3 408.449 4.307 20 0 HIADHN O=C(Nc1ccc(-c2csc(C(F)(F)F)n2)cc1)N1CC[C@H](N2CC=CC2)C1 ZINC000433803232 859900707 /nfs/dbraw/zinc/90/07/07/859900707.db2.gz SVMDOLJVJIMNIR-HNNXBMFYSA-N 0 3 408.449 4.307 20 0 HIADHN CN(C(=O)Nc1ccc(F)cc1-c1cnn(C)c1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000433805343 859902162 /nfs/dbraw/zinc/90/21/62/859902162.db2.gz VNVAWUOCKXZXLG-OAQYLSRUSA-N 0 3 421.520 4.355 20 0 HIADHN COc1cc(NC(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)ccc1OC(C)C ZINC000467684415 881478227 /nfs/dbraw/zinc/47/82/27/881478227.db2.gz CNAUHFUIWNPTKH-UHFFFAOYSA-N 0 3 421.488 4.356 20 0 HIADHN Cc1c(NC(=O)NC[C@H](c2cccs2)N2CCCC2)noc1-c1ccccc1F ZINC000433906706 859962496 /nfs/dbraw/zinc/96/24/96/859962496.db2.gz GMPFGIQZUYNSKR-QGZVFWFLSA-N 0 3 414.506 4.809 20 0 HIADHN O=C(NC[C@H]1CCCN(c2ccccc2)C1)N[C@H](CN1CCCC1)c1ccccc1 ZINC000433936111 859984662 /nfs/dbraw/zinc/98/46/62/859984662.db2.gz GWZFJFDDCGHKMW-ZJSXRUAMSA-N 0 3 406.574 4.039 20 0 HIADHN Cc1ccc(-c2nc(CC(=O)N[C@H]3C[C@H](C)N(Cc4ccccc4)C3)cs2)cc1 ZINC000467695369 881489454 /nfs/dbraw/zinc/48/94/54/881489454.db2.gz QXIJLWVIURGKPO-RXVVDRJESA-N 0 3 405.567 4.440 20 0 HIADHN C[C@H]1C[C@H](NC(=O)Cc2csc(Cc3ccc(F)cc3)n2)CN1Cc1ccccc1 ZINC000467696720 881490558 /nfs/dbraw/zinc/49/05/58/881490558.db2.gz JLIOHPDRNQEMPI-UWJYYQICSA-N 0 3 423.557 4.195 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)Cc2csc(Cc3ccc(F)cc3)n2)CN1Cc1ccccc1 ZINC000467696717 881490791 /nfs/dbraw/zinc/49/07/91/881490791.db2.gz JLIOHPDRNQEMPI-DYESRHJHSA-N 0 3 423.557 4.195 20 0 HIADHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc(-c2cc(C)oc2C)nc2onc(C)c21 ZINC000434020551 860043795 /nfs/dbraw/zinc/04/37/95/860043795.db2.gz HAGZFBYZEPYAGC-SJORKVTESA-N 0 3 408.502 4.107 20 0 HIADHN CCCNc1ccc(CNC(=O)Nc2ccc(CCN3CCSCC3)cc2)cc1 ZINC000434145397 860142969 /nfs/dbraw/zinc/14/29/69/860142969.db2.gz QXEDBXHYQCGECK-UHFFFAOYSA-N 0 3 412.603 4.422 20 0 HIADHN CN1CCC[C@H](CNC(=O)c2cc(-c3ccc4c(c3)CCO4)no2)[C@H]1c1cccs1 ZINC000434152915 860149481 /nfs/dbraw/zinc/14/94/81/860149481.db2.gz KUCJVWITJMJNGL-VGSWGCGISA-N 0 3 423.538 4.151 20 0 HIADHN Cc1ccn(C2CCN(C(=O)N[C@H](CN3CCc4ccccc4C3)C(C)(C)C)CC2)n1 ZINC000434188435 860177180 /nfs/dbraw/zinc/17/71/80/860177180.db2.gz HSLDAFQXHLRGEB-HSZRJFAPSA-N 0 3 423.605 4.011 20 0 HIADHN COc1ccc(C(=O)CCC(=O)NC2CCN([C@H](C)c3ccccc3)CC2)cc1F ZINC000434264958 860241238 /nfs/dbraw/zinc/24/12/38/860241238.db2.gz SCAVSNRUWQSSPF-QGZVFWFLSA-N 0 3 412.505 4.139 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)COc1ccc(C)c(C)c1 ZINC000434313830 860274249 /nfs/dbraw/zinc/27/42/49/860274249.db2.gz ZDUPJAKPMXMFNA-JOCHJYFZSA-N 0 3 418.541 4.273 20 0 HIADHN CCC(CC)n1nccc1C(=O)Nc1c(C)cnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000434315602 860275738 /nfs/dbraw/zinc/27/57/38/860275738.db2.gz JOEWFIFNZCSOCM-NRFANRHFSA-N 0 3 420.561 4.448 20 0 HIADHN CC[C@@H](OC1CCCC1)C(=O)Nc1c(C)cnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000434314902 860276073 /nfs/dbraw/zinc/27/60/73/860276073.db2.gz HSPLDQGZDHLGHT-IFMALSPDSA-N 0 3 410.562 4.315 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)Cc1cccc(F)c1F ZINC000434319995 860279473 /nfs/dbraw/zinc/27/94/73/860279473.db2.gz XVJCKVBQVHUDFH-LJQANCHMSA-N 0 3 410.468 4.098 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1cc2c(s1)CCOC2 ZINC000434319468 860279817 /nfs/dbraw/zinc/27/98/17/860279817.db2.gz XYEKBGGJVQSPEL-IBGZPJMESA-N 0 3 422.554 4.025 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)[C@H]1CSc2ccccc21 ZINC000434324766 860285947 /nfs/dbraw/zinc/28/59/47/860285947.db2.gz FRGCEAATUMESKW-CTNGQTDRSA-N 0 3 418.566 4.467 20 0 HIADHN COc1cccc([C@@H](C)C(=O)Nc2c(C)cnn2[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000434325225 860286244 /nfs/dbraw/zinc/28/62/44/860286244.db2.gz HKBBCNHISFCNDH-KNQAVFIVSA-N 0 3 418.541 4.389 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)[C@@H](C)Oc1ccccc1 ZINC000434329658 860290759 /nfs/dbraw/zinc/29/07/59/860290759.db2.gz BSROYKZCKVMPLK-CTNGQTDRSA-N 0 3 404.514 4.045 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)[C@@H](C)COc1ccccc1 ZINC000434333174 860295335 /nfs/dbraw/zinc/29/53/35/860295335.db2.gz DOKIQNXMJPJTJS-UNMCSNQZSA-N 0 3 418.541 4.292 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)[C@H](C)Oc1ccc(C)cc1 ZINC000434334875 860296340 /nfs/dbraw/zinc/29/63/40/860296340.db2.gz SNTWZJJXLWPLGF-RBBKRZOGSA-N 0 3 418.541 4.353 20 0 HIADHN Cc1ccc(Cl)c(NC(=O)N2CCN(CCN(C)Cc3ccccc3)CC2)c1C ZINC000434479152 860367363 /nfs/dbraw/zinc/36/73/63/860367363.db2.gz JLGSYCWKHBGDCL-UHFFFAOYSA-N 0 3 414.981 4.238 20 0 HIADHN C[C@@H](N[C@H]1CCCN(CC(F)(F)F)C1=O)c1cccc(OCc2ccccc2)c1 ZINC000434632660 860441261 /nfs/dbraw/zinc/44/12/61/860441261.db2.gz ZIOGBHXVYMDBPY-UZLBHIALSA-N 0 3 406.448 4.470 20 0 HIADHN C[C@H](N[C@@H]1CCCN(CC(F)(F)F)C1=O)c1cccc(OCc2ccccc2)c1 ZINC000434636390 860442440 /nfs/dbraw/zinc/44/24/40/860442440.db2.gz ZIOGBHXVYMDBPY-OXJNMPFZSA-N 0 3 406.448 4.470 20 0 HIADHN COc1ccc(-c2noc([C@@H](C)N3CCC(c4ncc5n4CCCC5)CC3)n2)cc1 ZINC000434672054 860454000 /nfs/dbraw/zinc/45/40/00/860454000.db2.gz LHZCNBKOSRKGCU-MRXNPFEDSA-N 0 3 407.518 4.219 20 0 HIADHN Cc1cc(F)ccc1N1CCC[C@@H](N2CCC(c3ncc4n3CCCC4)CC2)C1=O ZINC000434681537 860457219 /nfs/dbraw/zinc/45/72/19/860457219.db2.gz PSHXDYQMJGZRQL-JOCHJYFZSA-N 0 3 410.537 4.042 20 0 HIADHN C[C@@H](C(=O)N1CCC[C@H]1c1cccs1)N1CCC(c2ncc3n2CCCC3)CC1 ZINC000434688999 860461726 /nfs/dbraw/zinc/46/17/26/860461726.db2.gz RUNZOBWRYFAXQN-PXNSSMCTSA-N 0 3 412.603 4.213 20 0 HIADHN Cc1nc(-c2cccc(Cl)c2)sc1C(=O)NCCCCN1C[C@@H](C)O[C@H](C)C1 ZINC000434782723 860493524 /nfs/dbraw/zinc/49/35/24/860493524.db2.gz DMFUXFQFESYZQG-HUUCEWRRSA-N 0 3 421.994 4.391 20 0 HIADHN CCN(C(=O)NC[C@@H]1CCCN(c2ccccc2)C1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000434868553 860529297 /nfs/dbraw/zinc/52/92/97/860529297.db2.gz LWHWUSRXOOWDSA-ZCYQVOJMSA-N 0 3 420.601 4.209 20 0 HIADHN CCN(CC)C(=O)c1cccc(NC(=O)[C@H](C)N2CC[C@@H](c3ccccc3)[C@H]2C)c1 ZINC000434901906 860545783 /nfs/dbraw/zinc/54/57/83/860545783.db2.gz FYDAMKSTFBPQBH-SELNLUPBSA-N 0 3 407.558 4.374 20 0 HIADHN COc1cccc(OC)c1OC[C@@H](O)CN(Cc1cc(F)ccc1F)C1CCCC1 ZINC000434904806 860548070 /nfs/dbraw/zinc/54/80/70/860548070.db2.gz GYAUUCYPDIBRSL-IBGZPJMESA-N 0 3 421.484 4.167 20 0 HIADHN CCN1CCN(Cc2ccc(CN[C@H](C)c3nc(C(F)(F)F)cs3)cc2)CC1 ZINC000467748521 881554781 /nfs/dbraw/zinc/55/47/81/881554781.db2.gz YVQJWRKIXIPHEV-OAHLLOKOSA-N 0 3 412.525 4.150 20 0 HIADHN CC(C)N1CCCN(C(=O)c2cc(COc3ccc(Cl)cc3Cl)on2)CC1 ZINC000435005836 860593414 /nfs/dbraw/zinc/59/34/14/860593414.db2.gz RRNXGMCGJRMGEK-UHFFFAOYSA-N 0 3 412.317 4.117 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)CCc2nnc(-c3ccc(Cl)cc3)o2)CN1Cc1ccccc1 ZINC000467750836 881557937 /nfs/dbraw/zinc/55/79/37/881557937.db2.gz CCWRVLBZKKCXSQ-UZLBHIALSA-N 0 3 424.932 4.102 20 0 HIADHN Cc1ccc(-n2cc(CN(C)C3CCN(c4cnccn4)CC3)c(C(C)(C)C)n2)cc1 ZINC000435060951 860622010 /nfs/dbraw/zinc/62/20/10/860622010.db2.gz NPQHTPAIHFYPAQ-UHFFFAOYSA-N 0 3 418.589 4.369 20 0 HIADHN CC[C@H](OC1CCCC1)C(=O)Nc1cc(C)nn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435268653 860709839 /nfs/dbraw/zinc/70/98/39/860709839.db2.gz PFNMBVASXHWSJL-IRLDBZIGSA-N 0 3 410.562 4.315 20 0 HIADHN COc1ccc(C)cc1CC(=O)Nc1cc(C)nn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435271408 860710923 /nfs/dbraw/zinc/71/09/23/860710923.db2.gz NRBQJIQJRRUWFK-JOCHJYFZSA-N 0 3 418.541 4.137 20 0 HIADHN Cc1cc(NC(=O)[C@H](C)Oc2ccccc2F)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435275071 860712473 /nfs/dbraw/zinc/71/24/73/860712473.db2.gz OMPJEBXCHRXBFU-AZUAARDMSA-N 0 3 422.504 4.184 20 0 HIADHN CCc1ccc(OCC(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000435275937 860713239 /nfs/dbraw/zinc/71/32/39/860713239.db2.gz BOCASOVVPNXSBP-JOCHJYFZSA-N 0 3 418.541 4.218 20 0 HIADHN Cc1cc(NC(=O)[C@@H]2CCOc3ccccc32)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435277372 860714184 /nfs/dbraw/zinc/71/41/84/860714184.db2.gz IZDFEVDZLHHJQX-IFMALSPDSA-N 0 3 416.525 4.143 20 0 HIADHN Cc1cc(NC(=O)c2c(F)cc(F)cc2F)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435278103 860714503 /nfs/dbraw/zinc/71/45/03/860714503.db2.gz FAQPXXBFFDFMBI-KRWDZBQOSA-N 0 3 414.431 4.308 20 0 HIADHN Cc1cc(NC(=O)Cc2cc(C)ccc2C)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435281914 860717000 /nfs/dbraw/zinc/71/70/00/860717000.db2.gz RATKPDNWGOOEQH-QHCPKHFHSA-N 0 3 402.542 4.437 20 0 HIADHN Cc1cc(NC(=O)Cn2ccc3ccccc32)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435282435 860717217 /nfs/dbraw/zinc/71/72/17/860717217.db2.gz VBXPIPGHOZCHHQ-QFIPXVFZSA-N 0 3 413.525 4.232 20 0 HIADHN COc1cccc([C@@H](C)C(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000435282053 860717285 /nfs/dbraw/zinc/71/72/85/860717285.db2.gz YISYKEIDENKGRJ-DENIHFKCSA-N 0 3 418.541 4.389 20 0 HIADHN Cc1cc(NC(=O)COc2ccc(C)cc2C)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435283272 860717927 /nfs/dbraw/zinc/71/79/27/860717927.db2.gz ZEJVXUQWPKCVCC-QFIPXVFZSA-N 0 3 418.541 4.273 20 0 HIADHN CCSc1cc(C(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)ccn1 ZINC000435287786 860719990 /nfs/dbraw/zinc/71/99/90/860719990.db2.gz IRLJZLVUJYPHDM-FQEVSTJZSA-N 0 3 421.570 4.398 20 0 HIADHN CCO[C@@H](CC(=O)Nc1cc(C)nn1[C@@H]1CCN(Cc2ccccc2)C1)C1=CCCC1 ZINC000435292815 860723464 /nfs/dbraw/zinc/72/34/64/860723464.db2.gz ZELKRBKIEMYXPC-PKTZIBPZSA-N 0 3 422.573 4.483 20 0 HIADHN Cc1cc(NC(=O)[C@@H](C)Oc2ccccc2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435298296 860725731 /nfs/dbraw/zinc/72/57/31/860725731.db2.gz XYVWXGAIWVLYKN-TZIWHRDSSA-N 0 3 404.514 4.045 20 0 HIADHN Cc1cc(NC(=O)c2cc3nc(C)ccc3o2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435300006 860726956 /nfs/dbraw/zinc/72/69/56/860726956.db2.gz SUOQNEBOBLWRMH-IBGZPJMESA-N 0 3 415.497 4.340 20 0 HIADHN CCC(CC)n1ccc(C(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435368005 860766236 /nfs/dbraw/zinc/76/62/36/860766236.db2.gz DGDYJLPCTGTUTR-HXUWFJFHSA-N 0 3 406.534 4.140 20 0 HIADHN CCOc1cc(C(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)ccc1C ZINC000435370718 860768077 /nfs/dbraw/zinc/76/80/77/860768077.db2.gz QOOBEBWSCWYOFT-NRFANRHFSA-N 0 3 404.514 4.290 20 0 HIADHN COc1cccc([C@@H]2C[C@H]2C(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000435373954 860771273 /nfs/dbraw/zinc/77/12/73/860771273.db2.gz ONQVIKGRMMBCPF-AKIFATBCSA-N 0 3 416.525 4.081 20 0 HIADHN O=C(Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)[C@H]1CCCc2ccccc21 ZINC000435373837 860771316 /nfs/dbraw/zinc/77/13/16/860771316.db2.gz GDRFYMGMPJDENK-GMAHTHKFSA-N 0 3 400.526 4.389 20 0 HIADHN O=C(Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)[C@H]1CSc2ccccc21 ZINC000435374196 860772856 /nfs/dbraw/zinc/77/28/56/860772856.db2.gz HSISIJSUGMRVPT-ICSRJNTNSA-N 0 3 404.539 4.158 20 0 HIADHN O=C(Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)[C@@H]1CCCc2sccc21 ZINC000435377396 860774928 /nfs/dbraw/zinc/77/49/28/860774928.db2.gz BCVSLUDLJFDVLR-AZUAARDMSA-N 0 3 406.555 4.450 20 0 HIADHN Cc1cc(C(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)nc2ccccc12 ZINC000435379498 860776042 /nfs/dbraw/zinc/77/60/42/860776042.db2.gz MOETWJRSNPGWIT-FQEVSTJZSA-N 0 3 411.509 4.439 20 0 HIADHN Cc1cc(NC(=O)N(C)Cc2ccoc2C)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435513244 860831720 /nfs/dbraw/zinc/83/17/20/860831720.db2.gz CNJVGNGJACATGK-NRFANRHFSA-N 0 3 407.518 4.204 20 0 HIADHN Cc1cc(NC(=O)N2CCC[C@H]2C2CCC2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435517150 860834920 /nfs/dbraw/zinc/83/49/20/860834920.db2.gz OVNBBZUOWDAMPN-VXKWHMMOSA-N 0 3 407.562 4.435 20 0 HIADHN Cc1cc(NC(=O)N(C)Cc2cccs2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435518647 860836290 /nfs/dbraw/zinc/83/62/90/860836290.db2.gz JRCRFMKBGWSNCU-IBGZPJMESA-N 0 3 409.559 4.364 20 0 HIADHN Cc1cc(NC(=O)N(C)Cc2cccc(F)c2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435518719 860836479 /nfs/dbraw/zinc/83/64/79/860836479.db2.gz KGGQSIAOUZHDRS-JOCHJYFZSA-N 0 3 421.520 4.442 20 0 HIADHN CC[C@H](NC(=O)Nc1cc(C)nn1[C@H]1CCN(Cc2ccccc2)C1)c1ccncc1 ZINC000435536875 860851197 /nfs/dbraw/zinc/85/11/97/860851197.db2.gz MOZLZOLYZTXKMC-VXKWHMMOSA-N 0 3 418.545 4.306 20 0 HIADHN Cc1c(NC(=O)NC[C@H]2CCCN2Cc2ccccc2)cnn1-c1ccccc1F ZINC000435552327 860868267 /nfs/dbraw/zinc/86/82/67/860868267.db2.gz QPVUATOERDDTTB-LJQANCHMSA-N 0 3 407.493 4.106 20 0 HIADHN Cc1c(NC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)cnn1-c1ccccc1F ZINC000435560787 860881115 /nfs/dbraw/zinc/88/11/15/860881115.db2.gz XTRLJMIGQYSFHF-LJQANCHMSA-N 0 3 407.493 4.106 20 0 HIADHN CCCN(C(=O)Cc1ccccc1NC(C)=O)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000435719502 861005518 /nfs/dbraw/zinc/00/55/18/861005518.db2.gz NGGZZYRSEKLNTG-HSZRJFAPSA-N 0 3 407.558 4.091 20 0 HIADHN CN(C)Cc1cccc(NC(=O)N(C)[C@H]2c3cc(Cl)cc(Cl)c3C[C@@H]2O)c1 ZINC000435919482 861178756 /nfs/dbraw/zinc/17/87/56/861178756.db2.gz YGFBHOQEEDISHU-OALUTQOASA-N 0 3 408.329 4.177 20 0 HIADHN COC(=O)c1cc2cc(NC(=O)N3CC[C@@H](C)N(Cc4ccccc4)CC3)ccc2o1 ZINC000437773108 863091978 /nfs/dbraw/zinc/09/19/78/863091978.db2.gz LKUBXACTTLGWHV-QGZVFWFLSA-N 0 3 421.497 4.348 20 0 HIADHN Cc1noc(C)c1COc1cc2ccccc2cc1C(=O)N[C@@H]1CN(C2CC2)C[C@H]1C ZINC000467802934 881628288 /nfs/dbraw/zinc/62/82/88/881628288.db2.gz LKQAOGGLNJWNKG-IQMFZBJNSA-N 0 3 419.525 4.236 20 0 HIADHN COc1ccc(OC(F)F)c(NC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)c1 ZINC000437871574 863232830 /nfs/dbraw/zinc/23/28/30/863232830.db2.gz XMAMXWVNSXBOIQ-INIZCTEOSA-N 0 3 419.472 4.425 20 0 HIADHN CC(=O)Nc1ccc(Cl)c(NC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)c1 ZINC000437882582 863245829 /nfs/dbraw/zinc/24/58/29/863245829.db2.gz QUZVFXJLJXIWGW-MRXNPFEDSA-N 0 3 414.937 4.427 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)c3ncsc3-c3ccccc3)CC2)C[C@H](C)O1 ZINC000437899031 863271167 /nfs/dbraw/zinc/27/11/67/863271167.db2.gz RGWONQBGCJCFDI-ROUUACIJSA-N 0 3 413.587 4.162 20 0 HIADHN Cc1ccc(NC(=O)N(C)C)cc1NC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000437917452 863293550 /nfs/dbraw/zinc/29/35/50/863293550.db2.gz HHHIIOCFADZFLB-GOSISDBHSA-N 0 3 412.509 4.078 20 0 HIADHN C[C@H](c1ccc(N2CCCS2(=O)=O)cc1)N(C)Cc1cc2c(cccc2F)[nH]1 ZINC000437958650 863330174 /nfs/dbraw/zinc/33/01/74/863330174.db2.gz FYRDTMYQRROCFI-OAHLLOKOSA-N 0 3 401.507 4.040 20 0 HIADHN C[C@@H](c1ccc(N2CCCS2(=O)=O)cc1)N(C)Cc1cc2c(cccc2F)[nH]1 ZINC000437958647 863330344 /nfs/dbraw/zinc/33/03/44/863330344.db2.gz FYRDTMYQRROCFI-HNNXBMFYSA-N 0 3 401.507 4.040 20 0 HIADHN C[C@@H]1CCCN(CCNC(=O)c2cc(COc3c(Cl)cccc3Cl)on2)C1 ZINC000467822410 881651574 /nfs/dbraw/zinc/65/15/74/881651574.db2.gz AZSSAJUBOOEPEK-CYBMUJFWSA-N 0 3 412.317 4.022 20 0 HIADHN O=C(Nc1ccc(Oc2ccc(C(F)(F)F)cc2)nc1)N1CC[C@H](N2CC=CC2)C1 ZINC000437996677 863359293 /nfs/dbraw/zinc/35/92/93/863359293.db2.gz GNQOINWKVHFANJ-KRWDZBQOSA-N 0 3 418.419 4.371 20 0 HIADHN C[C@@H](CNC(=O)Nc1ccc(CCN2CCSCC2)cc1)Oc1cccc(F)c1 ZINC000438098672 863505308 /nfs/dbraw/zinc/50/53/08/863505308.db2.gz UEJVUQUFMBWONF-KRWDZBQOSA-N 0 3 417.550 4.006 20 0 HIADHN Cc1cc(SC2CCCCC2)ccc1NC(=O)NC[C@@H](C)CN1CCN(C)CC1 ZINC000438174851 863599056 /nfs/dbraw/zinc/59/90/56/863599056.db2.gz GETWPVMSQVRCNQ-GOSISDBHSA-N 0 3 418.651 4.425 20 0 HIADHN CCOC(=O)Cn1nc(C)c(CNCc2ccc(-c3ccc(OC)cc3)cc2)c1C ZINC000438189122 863614629 /nfs/dbraw/zinc/61/46/29/863614629.db2.gz SKKPCLVUFYJTIV-UHFFFAOYSA-N 0 3 407.514 4.028 20 0 HIADHN C[C@H]1CCN(C(=O)Nc2ccc(Cn3cccn3)cc2)CCN1Cc1ccccc1 ZINC000438224932 863660767 /nfs/dbraw/zinc/66/07/67/863660767.db2.gz LWUZIQUEENJZHV-FQEVSTJZSA-N 0 3 403.530 4.060 20 0 HIADHN CCOc1cccc2[nH]cc(CC(=O)N[C@H](CN3CCCC3)c3ccc(OC)cc3)c21 ZINC000438281575 863753080 /nfs/dbraw/zinc/75/30/80/863753080.db2.gz SRCCGAACOAWMAD-JOCHJYFZSA-N 0 3 421.541 4.071 20 0 HIADHN CN(C(=O)Nc1ccc(OC(C)(C)C)cc1)C1CCN(CCc2ccccn2)CC1 ZINC000438386475 863840045 /nfs/dbraw/zinc/84/00/45/863840045.db2.gz ICRUYJZCQKPKBK-UHFFFAOYSA-N 0 3 410.562 4.430 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)N[C@H]1C[C@H](c2cccc(C(F)(F)F)c2)C1 ZINC000438438623 863865945 /nfs/dbraw/zinc/86/59/45/863865945.db2.gz POZKKAVTTFBGAH-SAABIXHNSA-N 0 3 409.452 4.318 20 0 HIADHN COC(=O)C(C)(C)c1ccc(NC(=O)NC[C@H](c2ccccc2)N2CCCC2)cc1 ZINC000438465071 863887486 /nfs/dbraw/zinc/88/74/86/863887486.db2.gz ZIIQGMAUPGMONS-OAQYLSRUSA-N 0 3 409.530 4.096 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Cc1csc(Cc2ccc(F)cc2)n1 ZINC000438533842 863959209 /nfs/dbraw/zinc/95/92/09/863959209.db2.gz MOOHKLCOKHBQBV-UHFFFAOYSA-N 0 3 417.575 4.067 20 0 HIADHN CN(Cc1cc(Br)ccc1OCc1ccccc1)CC1(O)CCOCC1 ZINC000438551162 863981564 /nfs/dbraw/zinc/98/15/64/863981564.db2.gz COVKGVPZDQTZGD-UHFFFAOYSA-N 0 3 420.347 4.001 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)Cc2ccc(Br)s2)CC1 ZINC000438558022 863989830 /nfs/dbraw/zinc/98/98/30/863989830.db2.gz GQTMTCDKUACCGH-UHFFFAOYSA-N 0 3 407.377 4.176 20 0 HIADHN Cc1nc(-c2ccccn2)sc1C(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000438562798 863995226 /nfs/dbraw/zinc/99/52/26/863995226.db2.gz RWPSSNZVLSNPOQ-UHFFFAOYSA-N 0 3 406.555 4.250 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Nc1ccc(N(C)C)cc1C(F)(F)F ZINC000438580023 864012181 /nfs/dbraw/zinc/01/21/81/864012181.db2.gz CNYAPCUOAGYBOT-UHFFFAOYSA-N 0 3 414.497 4.429 20 0 HIADHN CCC(C)(C)NC(=O)c1ccc(NC(=O)N(CCN(C)C)Cc2cccs2)cc1 ZINC000438582599 864013283 /nfs/dbraw/zinc/01/32/83/864013283.db2.gz LAQNVLSLBLSNHV-UHFFFAOYSA-N 0 3 416.591 4.262 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)Nc1ccc(Br)c(F)c1 ZINC000438606593 864031962 /nfs/dbraw/zinc/03/19/62/864031962.db2.gz RSTBGIDNJCZGLX-UHFFFAOYSA-N 0 3 406.299 4.158 20 0 HIADHN COc1ccc(NC(=O)N(CCN(C)C)Cc2cccs2)c(C(F)(F)F)c1 ZINC000438629721 864059569 /nfs/dbraw/zinc/05/95/69/864059569.db2.gz RGAIGEIDTQAGTA-UHFFFAOYSA-N 0 3 401.454 4.371 20 0 HIADHN CC(C)(C)c1nc2ccc(NC(=O)N3CCN(CC4CCOCC4)CC3)cc2s1 ZINC000438657854 864104325 /nfs/dbraw/zinc/10/43/25/864104325.db2.gz TZTWUERGMZVCPY-UHFFFAOYSA-N 0 3 416.591 4.170 20 0 HIADHN CCN(C(=O)C(=O)Nc1cc(Cl)ccc1F)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000438661847 864110926 /nfs/dbraw/zinc/11/09/26/864110926.db2.gz VAYMXMWQAYSBAL-YJBOKZPZSA-N 0 3 417.912 4.102 20 0 HIADHN CCN(C(=O)C(=O)Nc1ccccc1OC(C)C)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000438664794 864116312 /nfs/dbraw/zinc/11/63/12/864116312.db2.gz JWBFEOBTUQHREN-TZIWHRDSSA-N 0 3 423.557 4.096 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)Nc1ccc(F)cc1OC(F)F ZINC000438676277 864136514 /nfs/dbraw/zinc/13/65/14/864136514.db2.gz BJHUJLMVFITXAS-UHFFFAOYSA-N 0 3 417.378 4.301 20 0 HIADHN Cc1cc(C)c2nc(C3CC3)cc(C(=O)NC3CCN(CCOC(C)C)CC3)c2c1 ZINC000438724390 864207138 /nfs/dbraw/zinc/20/71/38/864207138.db2.gz QHNUVZWIDNPFHR-UHFFFAOYSA-N 0 3 409.574 4.348 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)Nc1cccc(COC2CCCCC2)c1 ZINC000438760282 864254568 /nfs/dbraw/zinc/25/45/68/864254568.db2.gz WBNJQVOQAMABHI-UHFFFAOYSA-N 0 3 423.557 4.483 20 0 HIADHN COc1cc(CN(C)C[C@@H](O)CO[C@H](c2ccccc2)c2ccc(C)cc2)ccc1O ZINC000438792054 864284969 /nfs/dbraw/zinc/28/49/69/864284969.db2.gz OFXAKWZVQUAJDK-ZEQKJWHPSA-N 0 3 421.537 4.308 20 0 HIADHN C[C@H](Sc1ccccc1)c1ccc(NC(=O)C(=O)N2CC[C@H]3CC[C@@H](C2)N3C)cc1 ZINC000438811666 864303781 /nfs/dbraw/zinc/30/37/81/864303781.db2.gz FAXIKNYWCUKSMT-WMQCIHAUSA-N 0 3 423.582 4.174 20 0 HIADHN CCCn1ccc2ccc(NC(=O)NCc3ccccc3CN3CCC(O)CC3)cc21 ZINC000438897444 864379058 /nfs/dbraw/zinc/37/90/58/864379058.db2.gz VRUQYVRUMLIEGB-UHFFFAOYSA-N 0 3 420.557 4.330 20 0 HIADHN COc1ccc(Cl)cc1N1CC[C@@H](N[C@@H](C)c2ccc(NC(C)=O)cc2OC)C1 ZINC000438978344 864441532 /nfs/dbraw/zinc/44/15/32/864441532.db2.gz MIFLQFMPVHBDKQ-KBXCAEBGSA-N 0 3 417.937 4.245 20 0 HIADHN Cc1cc(Br)ccc1NC(=O)CN1CCCC[C@@H]1[C@H]1CCCC[C@@H]1O ZINC000439006047 864460277 /nfs/dbraw/zinc/46/02/77/864460277.db2.gz FVYVBDXXEQNERO-QRQLOZEOSA-N 0 3 409.368 4.102 20 0 HIADHN CN(Cc1c(F)cccc1Cl)C(=O)CN(C)C1CCN(c2ccccc2)CC1 ZINC000439008906 864462484 /nfs/dbraw/zinc/46/24/84/864462484.db2.gz UUCPTEWDUHEOAP-UHFFFAOYSA-N 0 3 403.929 4.038 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)c1cc2c(cc(Br)cc2F)[nH]1 ZINC000439031017 864487258 /nfs/dbraw/zinc/48/72/58/864487258.db2.gz XTYKBTAIQURYHZ-UHFFFAOYSA-N 0 3 424.339 4.335 20 0 HIADHN CS(=O)(=O)Nc1ccc(CN[C@H](c2ccc(Br)s2)C2CC2)cc1 ZINC000439141099 864574128 /nfs/dbraw/zinc/57/41/28/864574128.db2.gz RGTXMFVVRVQVKI-INIZCTEOSA-N 0 3 415.378 4.123 20 0 HIADHN O=C(NC[C@@H]1CCC[C@H](C(F)(F)F)C1)NCC1(N2CCSCC2)CCCC1 ZINC000439243524 864660508 /nfs/dbraw/zinc/66/05/08/864660508.db2.gz CNFMYCSYWKVRFK-CVEARBPZSA-N 0 3 407.546 4.016 20 0 HIADHN C[C@H](Cc1ccc(Br)cc1)NC(=O)N(CCN(C)C)Cc1cccs1 ZINC000439248418 864664573 /nfs/dbraw/zinc/66/45/73/864664573.db2.gz QIIVVWFVIJLUGW-OAHLLOKOSA-N 0 3 424.408 4.215 20 0 HIADHN CC(C)COc1ccc(NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cn1 ZINC000467920176 881791400 /nfs/dbraw/zinc/79/14/00/881791400.db2.gz RSMRPULIMFPZAZ-UHFFFAOYSA-N 0 3 414.472 4.043 20 0 HIADHN O=C1[C@@H](N2CCC([C@@H]3CCCO3)CC2)CCCN1Cc1cccc(C(F)(F)F)c1 ZINC000439277777 864696510 /nfs/dbraw/zinc/69/65/10/864696510.db2.gz WWVGBSSDMPAPKE-PMACEKPBSA-N 0 3 410.480 4.087 20 0 HIADHN O=C(CCN1CCC([C@@H]2CCCO2)CC1)Nc1ccccc1C(=O)c1ccccc1 ZINC000439293446 864716941 /nfs/dbraw/zinc/71/69/41/864716941.db2.gz DJDKQUKTQIJRPF-QHCPKHFHSA-N 0 3 406.526 4.137 20 0 HIADHN Cc1nc(C)c([C@@H](C)N(C)C[C@@H](O)COc2cc(F)cc(Br)c2)s1 ZINC000439436463 864830493 /nfs/dbraw/zinc/83/04/93/864830493.db2.gz XAQARTLAUJSJNV-IAQYHMDHSA-N 0 3 417.344 4.094 20 0 HIADHN COc1ccccc1[C@H](CNCc1cc(Cl)ccc1OC[C@H]1CCCO1)N(C)C ZINC000439475970 864844446 /nfs/dbraw/zinc/84/44/46/864844446.db2.gz GRBNOSYNDZLCPN-CTNGQTDRSA-N 0 3 418.965 4.299 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@@H]2NC(=O)N(CCN(C)C)Cc2cccs2)cc1 ZINC000439501356 864855891 /nfs/dbraw/zinc/85/58/91/864855891.db2.gz DDBMSEUXJIXGDI-SFTDATJTSA-N 0 3 401.576 4.050 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)N(C)C[C@@H]1COc2ccccc2O1)c1ccc(C(F)(F)F)cc1 ZINC000439543318 864871870 /nfs/dbraw/zinc/87/18/70/864871870.db2.gz DOUNLMLQZRSSEL-RVKKMQEKSA-N 0 3 422.447 4.043 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)NC1CCC2(CCOCC2)CC1 ZINC000439586023 864909519 /nfs/dbraw/zinc/90/95/19/864909519.db2.gz GRBDGVCCZYITRA-UHFFFAOYSA-N 0 3 407.986 4.153 20 0 HIADHN C[C@H](NCc1ccccc1CN(C)Cc1ccco1)C(=O)N1CCCc2ccccc21 ZINC000439593939 864915763 /nfs/dbraw/zinc/91/57/63/864915763.db2.gz HKTAIXQKPQBPIU-FQEVSTJZSA-N 0 3 417.553 4.369 20 0 HIADHN C[C@@H](NCc1ccccc1CN(C)Cc1ccco1)C(=O)Nc1ccc(Cl)cn1 ZINC000439599589 864922721 /nfs/dbraw/zinc/92/27/21/864922721.db2.gz SZZJLGKIJDDPPP-MRXNPFEDSA-N 0 3 412.921 4.077 20 0 HIADHN C[C@H](NCc1ccccc1CN(C)Cc1ccco1)C(=O)N(C)Cc1cccc(F)c1 ZINC000439599694 864923033 /nfs/dbraw/zinc/92/30/33/864923033.db2.gz WUSVBOMVLVUQAC-IBGZPJMESA-N 0 3 423.532 4.187 20 0 HIADHN Cc1ccccc1CNC(=O)[C@@H](C)NCc1ccccc1CN(C)Cc1ccco1 ZINC000439600966 864923366 /nfs/dbraw/zinc/92/33/66/864923366.db2.gz YPEQVTPVZPETQP-HXUWFJFHSA-N 0 3 405.542 4.015 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)NC[C@H]1CCC[C@H](C(F)(F)F)C1 ZINC000439631112 864956739 /nfs/dbraw/zinc/95/67/39/864956739.db2.gz DGRQSOFPUBNFBA-HOCLYGCPSA-N 0 3 421.454 4.407 20 0 HIADHN COc1ccc(NC(=O)[C@H](C)NCC(C)(C)c2c(F)cccc2Cl)c(OC)c1 ZINC000439642824 864969129 /nfs/dbraw/zinc/96/91/29/864969129.db2.gz OXNWAVAXCQVBAF-ZDUSSCGKSA-N 0 3 408.901 4.391 20 0 HIADHN CCO[C@@H]1C[C@@H](N[C@@H](C)C(=O)Nc2ccc(C)cc2Br)C12CCCC2 ZINC000439653959 864981142 /nfs/dbraw/zinc/98/11/42/864981142.db2.gz VZWXLKBYVMDAGD-BMGDILEWSA-N 0 3 409.368 4.412 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@H]2CN[C@H](C(N)=O)c2ccc(Br)cc2)cc1 ZINC000439659204 864987542 /nfs/dbraw/zinc/98/75/42/864987542.db2.gz DQTXREHCWDKISW-IHPCNDPISA-N 0 3 417.347 4.041 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)Nc2cc(C(=O)NCC3CC3)ccc2C)c1 ZINC000439687212 865022643 /nfs/dbraw/zinc/02/26/43/865022643.db2.gz WDXZFICGWJOZHX-UHFFFAOYSA-N 0 3 422.573 4.039 20 0 HIADHN CCc1ccc([C@H](CNC(=O)Nc2cc(C(=O)NCC3CC3)ccc2C)N(C)C)cc1 ZINC000439689489 865027060 /nfs/dbraw/zinc/02/70/60/865027060.db2.gz CMXDKJIVRPTNDA-QHCPKHFHSA-N 0 3 422.573 4.122 20 0 HIADHN Cc1ccc(C(=O)NCC2CC2)cc1NC(=O)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000439708681 865045428 /nfs/dbraw/zinc/04/54/28/865045428.db2.gz ZTQAYVJZONZYRK-QHCPKHFHSA-N 0 3 420.557 4.093 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)COc2c(Cl)cccc2Cl)CC1 ZINC000439774542 865099121 /nfs/dbraw/zinc/09/91/21/865099121.db2.gz LFNZIPKTHCBCFZ-AWEZNQCLSA-N 0 3 408.329 4.109 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)COc2c(Cl)cccc2Cl)CC1 ZINC000439774543 865099598 /nfs/dbraw/zinc/09/95/98/865099598.db2.gz LFNZIPKTHCBCFZ-CQSZACIVSA-N 0 3 408.329 4.109 20 0 HIADHN O=C(Cc1ccc(NC(=O)[C@H]2CCCN2C2CCCC2)cc1)Nc1ccccc1F ZINC000439839475 865151112 /nfs/dbraw/zinc/15/11/12/865151112.db2.gz WGBPVWGDMZBENC-JOCHJYFZSA-N 0 3 409.505 4.352 20 0 HIADHN Cc1ccc(-c2ccnn2C)cc1NC(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C ZINC000439947338 865241776 /nfs/dbraw/zinc/24/17/76/865241776.db2.gz DNMZKMZFJSRXOV-PGRDOPGGSA-N 0 3 403.530 4.038 20 0 HIADHN CC[C@H](C)NC(=O)[C@@H]1C[C@H](C)N(Cc2ccsc2C(=O)OC)[C@@H]2CCCC[C@@H]12 ZINC000439982174 865284356 /nfs/dbraw/zinc/28/43/56/865284356.db2.gz IURQXRGKZJBIOS-WAARBJQMSA-N 0 3 406.592 4.219 20 0 HIADHN COc1ccc2c(c1)[C@@H](N[C@@H](C)CC(=O)N(C)Cc1ccccc1Cl)CCO2 ZINC000468025122 881859684 /nfs/dbraw/zinc/85/96/84/881859684.db2.gz FIFVQNVQUZUVAI-YWZLYKJASA-N 0 3 402.922 4.199 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)NCc2cccc(-c3ccccn3)c2)C1 ZINC000440071982 865337637 /nfs/dbraw/zinc/33/76/37/865337637.db2.gz CHZYCLOXZGYLQQ-XXBNENTESA-N 0 3 400.526 4.383 20 0 HIADHN Cc1nc2c(s1)[C@H](N[C@@H]1CC(=O)N(Cc3ccccc3C(F)(F)F)C1)CCC2 ZINC000468049595 881875522 /nfs/dbraw/zinc/87/55/22/881875522.db2.gz OFSCFUIVNILJSI-RHSMWYFYSA-N 0 3 409.477 4.238 20 0 HIADHN COc1cccc([C@H](NC(=O)N(CCN(C)C)C(C)C)c2ccccc2Cl)c1 ZINC000440241554 865479704 /nfs/dbraw/zinc/47/97/04/865479704.db2.gz GFVJXVDRKYAGMC-NRFANRHFSA-N 0 3 403.954 4.420 20 0 HIADHN CC(=O)Nc1cc(NC(=O)N2CCN(C3CCC(C(C)C)CC3)CC2)ccc1C ZINC000440259494 865508747 /nfs/dbraw/zinc/50/87/47/865508747.db2.gz WLBVNNGSBCBMSY-UHFFFAOYSA-N 0 3 400.567 4.318 20 0 HIADHN COc1cc(C(C)=O)ccc1OC[C@H](O)CN1CCC[C@@]2(CCCc3ccccc32)C1 ZINC000440327259 865603088 /nfs/dbraw/zinc/60/30/88/865603088.db2.gz QJDXERZDANAXOF-GJZUVCINSA-N 0 3 423.553 4.008 20 0 HIADHN Cc1cc(C(=O)CN(C)C2CCN(Cc3ccccc3)CC2)c(C)n1CC(F)(F)F ZINC000440446673 865749326 /nfs/dbraw/zinc/74/93/26/865749326.db2.gz BTLRFCFWHHUXKD-UHFFFAOYSA-N 0 3 421.507 4.446 20 0 HIADHN CC(C)=CCSc1ccccc1C(=O)NC[C@@]1(O)CCN(Cc2ccccc2)C1 ZINC000440506538 865799041 /nfs/dbraw/zinc/79/90/41/865799041.db2.gz QLRXSMYLZSPUCS-DEOSSOPVSA-N 0 3 410.583 4.112 20 0 HIADHN Cc1cccc(C)c1NC(=O)CNC(=O)[C@H](C)N[C@@H]1CC(C)(C)CCc2ccccc21 ZINC000440635887 865851522 /nfs/dbraw/zinc/85/15/22/865851522.db2.gz KTTXCTFAWLGMMP-SIKLNZKXSA-N 0 3 421.585 4.440 20 0 HIADHN CN(C[C@@H]1CCCN(C)[C@H]1c1cnn(C)c1)c1ncnc2sc3ccccc3c21 ZINC000440642166 865853916 /nfs/dbraw/zinc/85/39/16/865853916.db2.gz YDZKPDQCZKPGTK-MGPUTAFESA-N 0 3 406.559 4.097 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)c2cccc(NC(=O)CCCc3cccs3)c2)CN1C1CC1 ZINC000440926411 866023911 /nfs/dbraw/zinc/02/39/11/866023911.db2.gz XFLYALFZMOTEPQ-QFBILLFUSA-N 0 3 411.571 4.065 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)Cc2csc(-c3ccc(Cl)cc3Cl)n2)CN1C1CC1 ZINC000440930232 866026731 /nfs/dbraw/zinc/02/67/31/866026731.db2.gz GEETXYOWEJEMDM-YPMHNXCESA-N 0 3 410.370 4.401 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)c2cn(C(C)(C)C)nc2-c2ccccc2Cl)CN1C1CC1 ZINC000440933929 866031492 /nfs/dbraw/zinc/03/14/92/866031492.db2.gz RNAVMRFWGXYMNQ-HUUCEWRRSA-N 0 3 400.954 4.314 20 0 HIADHN O=C(NCCc1ccc2[nH]ccc2c1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000440934659 866033566 /nfs/dbraw/zinc/03/35/66/866033566.db2.gz SZKQMXXTOYVYCL-UHFFFAOYSA-N 0 3 408.571 4.123 20 0 HIADHN COc1cc(-c2nnc(CN(C3CC3)C3CCC(C)CC3)o2)cc(OC)c1OC ZINC000441218785 866293779 /nfs/dbraw/zinc/29/37/79/866293779.db2.gz NLXUXOQRUVGYGU-UHFFFAOYSA-N 0 3 401.507 4.306 20 0 HIADHN C[C@H](C(=O)NCCc1c[nH]c2ccccc12)N1CCC[C@@H]1c1cccc(N(C)C)c1 ZINC000441364875 866434181 /nfs/dbraw/zinc/43/41/81/866434181.db2.gz NUQJMHMYUNIHLM-HOYKHHGWSA-N 0 3 404.558 4.118 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N(C)[C@@H](C)[C@@H](C)c1ccc(Cl)cc1 ZINC000441399992 866475507 /nfs/dbraw/zinc/47/55/07/866475507.db2.gz FVWIDHAVCUYNLQ-SJORKVTESA-N 0 3 415.965 4.299 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)Nc1cc(F)c(OC(C)(C)C)c(F)c1 ZINC000441673843 866797805 /nfs/dbraw/zinc/79/78/05/866797805.db2.gz WPGFNMMAMNTGDE-UHFFFAOYSA-N 0 3 419.472 4.089 20 0 HIADHN C[C@@H](NC(=O)C(=O)Nc1ccccc1-c1ccccc1)[C@@H](c1ccccc1)N(C)C ZINC000441696537 866809985 /nfs/dbraw/zinc/80/99/85/866809985.db2.gz YUBNDMNITGRXDO-JPYJTQIMSA-N 0 3 401.510 4.100 20 0 HIADHN Cc1cc(Cl)c(NC(=O)C(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)cc1Cl ZINC000441706478 866814646 /nfs/dbraw/zinc/81/46/46/866814646.db2.gz XHXMPDLCHZWISK-UGSOOPFHSA-N 0 3 408.329 4.048 20 0 HIADHN CC(C)Sc1c(Cl)cccc1NC(=O)C(=O)NCCN1[C@H](C)CCC[C@@H]1C ZINC000441848597 866911241 /nfs/dbraw/zinc/91/12/41/866911241.db2.gz VAFRNPDKDUMTKB-GASCZTMLSA-N 0 3 411.999 4.158 20 0 HIADHN Cc1cc(N2CCCC[C@H]2C)ccc1NC(=O)C(=O)Nc1cccc(CN(C)C)c1 ZINC000441851129 866915400 /nfs/dbraw/zinc/91/54/00/866915400.db2.gz SCQDQXORYJIHRC-GOSISDBHSA-N 0 3 408.546 4.013 20 0 HIADHN CC1CCN([C@@H](CNC(=O)NCc2nnc(C(C)(C)C)s2)c2cccs2)CC1 ZINC000468160076 882026388 /nfs/dbraw/zinc/02/63/88/882026388.db2.gz PCPXNQBPLIIGMS-HNNXBMFYSA-N 0 3 421.636 4.170 20 0 HIADHN Brc1ccc(-c2nccc(CN3CCC[C@]4(CCCOC4)C3)n2)cc1 ZINC000441883941 866948719 /nfs/dbraw/zinc/94/87/19/866948719.db2.gz DXNGZPRWHSRITA-FQEVSTJZSA-N 0 3 402.336 4.299 20 0 HIADHN CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)Nc1nc2c(s1)CCCCCC2 ZINC000441964743 867028690 /nfs/dbraw/zinc/02/86/90/867028690.db2.gz IXMQEQMJIXUDLU-PXNSSMCTSA-N 0 3 413.591 4.354 20 0 HIADHN CCC[C@@H]1CCc2nc(NC(=O)NC3CCN(CCOC(C)C)CC3)sc2C1 ZINC000441966724 867030392 /nfs/dbraw/zinc/03/03/92/867030392.db2.gz PQCCJJFFQFSUSU-MRXNPFEDSA-N 0 3 408.612 4.059 20 0 HIADHN CN(C)Cc1cccc(NC(=O)C(=O)N(Cc2ccccc2)[C@H]2CCCC2(C)C)c1 ZINC000441996914 867051407 /nfs/dbraw/zinc/05/14/07/867051407.db2.gz BBYVYYIWZNHSAX-QFIPXVFZSA-N 0 3 407.558 4.294 20 0 HIADHN CN(C(=O)N[C@H]1CCCc2sc(-c3ccc(F)cc3)nc21)[C@H]1CCN(C2CC2)C1 ZINC000468167389 882043506 /nfs/dbraw/zinc/04/35/06/882043506.db2.gz AELPUAAQSIJALG-ROUUACIJSA-N 0 3 414.550 4.205 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)CC(C)(C)CC(=O)c3ccccc3)CC2)C[C@H](C)O1 ZINC000442024235 867071344 /nfs/dbraw/zinc/07/13/44/867071344.db2.gz XZEBMYLPIDHXEY-BGYRXZFFSA-N 0 3 414.590 4.024 20 0 HIADHN CCN1CCC[C@@H](CN(C)C(=O)Nc2nc(C3CCC3)cs2)[C@@H]1c1cnn(C)c1 ZINC000442067708 867098952 /nfs/dbraw/zinc/09/89/52/867098952.db2.gz ALZSAEMGPBWGAN-QFBILLFUSA-N 0 3 416.595 4.081 20 0 HIADHN CC(C)C[C@@H](NC(=O)C(=O)Nc1cccc(CN(C)C)c1)c1ccc(Cl)cc1 ZINC000442086279 867114723 /nfs/dbraw/zinc/11/47/23/867114723.db2.gz XWBSIMXEOKEIMB-HXUWFJFHSA-N 0 3 401.938 4.244 20 0 HIADHN CCCCc1ccc(NC(=O)C(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)cc1 ZINC000442202403 867224065 /nfs/dbraw/zinc/22/40/65/867224065.db2.gz XTPBGPCGFFXYRV-UHFFFAOYSA-N 0 3 422.573 4.137 20 0 HIADHN Cc1cc(NC(=O)c2ccc3c(n2)CCCC3)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000442319147 867323623 /nfs/dbraw/zinc/32/36/23/867323623.db2.gz DFEPFZUFRCXDEI-OAQYLSRUSA-N 0 3 415.541 4.165 20 0 HIADHN CN(C(=O)NCCN1CCN(C)C(C)(C)C1)[C@@H](c1ccc(Cl)cc1)C1CCCC1 ZINC000442611027 867557853 /nfs/dbraw/zinc/55/78/53/867557853.db2.gz RDSWIGIRWHIDNY-OAQYLSRUSA-N 0 3 421.029 4.239 20 0 HIADHN COCc1nc(C(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)c(-c2ccccc2)s1 ZINC000442694446 867629334 /nfs/dbraw/zinc/62/93/34/867629334.db2.gz SDIJGGGBMJCANA-FXAWDEMLSA-N 0 3 421.566 4.349 20 0 HIADHN FC(F)(F)c1cc(Cl)c2nnc(CN[C@@H]3Cc4[nH]c5ccccc5c4C3)n2c1 ZINC000442722262 867648938 /nfs/dbraw/zinc/64/89/38/867648938.db2.gz WYVLCMOGLZMQDL-NSHDSACASA-N 0 3 405.811 4.140 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](N[C@@H]2Cc3[nH]c4ccccc4c3C2)c2ccccc2)c1 ZINC000442789505 867675750 /nfs/dbraw/zinc/67/57/50/867675750.db2.gz HIEXPCGNFQXPIG-UQBPGWFLSA-N 0 3 416.546 4.418 20 0 HIADHN COc1cc(Br)c(CN[C@@H]2Cc3[nH]c4ccccc4c3C2)cc1OC ZINC000442865636 867704280 /nfs/dbraw/zinc/70/42/80/867704280.db2.gz FZQRHVHMIHXILK-ZDUSSCGKSA-N 0 3 401.304 4.205 20 0 HIADHN C[C@@H](CC(=O)Nc1ccccc1)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1 ZINC000442993488 867782846 /nfs/dbraw/zinc/78/28/46/867782846.db2.gz OHHPOJUGXRHSAB-WMZHIEFXSA-N 0 3 401.510 4.243 20 0 HIADHN C[C@@H](NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(Br)s1 ZINC000443294690 867892950 /nfs/dbraw/zinc/89/29/50/867892950.db2.gz HZURJGWHIUCIHX-UKRRQHHQSA-N 0 3 408.365 4.145 20 0 HIADHN C[C@@H](NC(=O)N1CCCN(Cc2ccccc2)CC1)c1ccc(Br)s1 ZINC000443312206 867899081 /nfs/dbraw/zinc/89/90/81/867899081.db2.gz ZSWIPHYNOLJCGN-OAHLLOKOSA-N 0 3 422.392 4.489 20 0 HIADHN Cc1nccn1CCCN1CCC[C@H]1c1nc(-c2ccccc2Br)no1 ZINC000443328861 867906584 /nfs/dbraw/zinc/90/65/84/867906584.db2.gz HVDYECWPHYSYAM-KRWDZBQOSA-N 0 3 416.323 4.231 20 0 HIADHN C[C@@H](CNC(=O)Nc1ccc(Cl)cc1-c1ccccc1)CN1CCN(C)CC1 ZINC000443530880 868089399 /nfs/dbraw/zinc/08/93/99/868089399.db2.gz OVBZPFUQEHZLMO-KRWDZBQOSA-N 0 3 400.954 4.012 20 0 HIADHN C[C@@H](NC(=O)NC[C@H](Cc1ccccc1)N(C)C)c1ccc(Br)s1 ZINC000443539611 868097818 /nfs/dbraw/zinc/09/78/18/868097818.db2.gz GZQISMABRQRERW-HIFRSBDPSA-N 0 3 410.381 4.044 20 0 HIADHN COc1cccc(OCCN2CCC[C@@H](c3nnc4ccc(C(F)(F)F)cn43)C2)c1 ZINC000443614087 868181904 /nfs/dbraw/zinc/18/19/04/868181904.db2.gz KUNGUHUBKRCDIA-OAHLLOKOSA-N 0 3 420.435 4.015 20 0 HIADHN C[C@H]1CN(CCCCNC(=O)C2(c3ccc(Cl)c(Cl)c3)CCC2)C[C@H](C)O1 ZINC000443673855 868281606 /nfs/dbraw/zinc/28/16/06/868281606.db2.gz KUWXBJOYDDKUPE-HOTGVXAUSA-N 0 3 413.389 4.421 20 0 HIADHN C[C@H]1CN(CCCCNC(=O)COc2cc(Cl)c(Cl)cc2Cl)C[C@H](C)O1 ZINC000443677520 868284988 /nfs/dbraw/zinc/28/49/88/868284988.db2.gz XXRUCVLBZOSFPO-STQMWFEESA-N 0 3 423.768 4.031 20 0 HIADHN Cc1ccccc1[C@H]([C@@H](C)NC(=O)C(=O)Nc1ccc(Cl)cc1Cl)N(C)C ZINC000443841487 868372762 /nfs/dbraw/zinc/37/27/62/868372762.db2.gz KLAPNZQBOFBQJT-ACJLOTCBSA-N 0 3 408.329 4.048 20 0 HIADHN CCCn1ccc2ccc(NC(=O)C(=O)N[C@@H](C)[C@@H](c3ccccc3C)N(C)C)cc21 ZINC000443841285 868372838 /nfs/dbraw/zinc/37/28/38/868372838.db2.gz ZLOFWPTVYVZCIN-MBSDFSHPSA-N 0 3 420.557 4.106 20 0 HIADHN Cc1oc2ccc(NC(=O)C(=O)N[C@H](C)[C@H](c3ccccc3C)N(C)C)cc2c1C ZINC000443846736 868377874 /nfs/dbraw/zinc/37/78/74/868377874.db2.gz WNPWXZGSFWOEGJ-OPAMFIHVSA-N 0 3 407.514 4.104 20 0 HIADHN CC(C)CN(CCN(C)C)C(=O)Nc1cccc(C[S@@](=O)Cc2ccccc2)c1 ZINC000443915170 868450325 /nfs/dbraw/zinc/45/03/25/868450325.db2.gz IXGUMWBKTJBNRG-LJAQVGFWSA-N 0 3 415.603 4.187 20 0 HIADHN CC(C)CN(CCN(C)C)C(=O)Nc1cccc(C[S@](=O)Cc2ccccc2)c1 ZINC000443915169 868450429 /nfs/dbraw/zinc/45/04/29/868450429.db2.gz IXGUMWBKTJBNRG-GDLZYMKVSA-N 0 3 415.603 4.187 20 0 HIADHN O=C(N[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)N1CC[C@@H](N2CC=CC2)C1 ZINC000444034442 868569936 /nfs/dbraw/zinc/56/99/36/868569936.db2.gz PSPWSXKTQJFYJI-CVEARBPZSA-N 0 3 421.385 4.355 20 0 HIADHN CSc1ccccc1S(=O)(=O)N(C)[C@H]1CCN(Cc2ccccc2)[C@@H](C)C1 ZINC000444082662 868607183 /nfs/dbraw/zinc/60/71/83/868607183.db2.gz IIEAJWDGEHKYJE-HKUYNNGSSA-N 0 3 404.601 4.082 20 0 HIADHN CCN(CC(F)(F)F)C(=O)[C@H]1CCCN(Cc2ccccc2Oc2cccnc2)C1 ZINC000444162480 868644013 /nfs/dbraw/zinc/64/40/13/868644013.db2.gz ATSHSHXSVPGLMI-SFHVURJKSA-N 0 3 421.463 4.497 20 0 HIADHN C[C@H](Oc1cccc2ccccc21)C(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000444299660 868730922 /nfs/dbraw/zinc/73/09/22/868730922.db2.gz CNDMQZAQIXGNKM-IBGZPJMESA-N 0 3 418.537 4.450 20 0 HIADHN COc1ccc(SCCCC(=O)N(C)C[C@@H]2CCN(C)[C@H]2c2cccnc2)cc1 ZINC000444343804 868774214 /nfs/dbraw/zinc/77/42/14/868774214.db2.gz QRSUIQXRFRWAEH-CVDCTZTESA-N 0 3 413.587 4.114 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)[C@@H]1C[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000444448129 868832069 /nfs/dbraw/zinc/83/20/69/868832069.db2.gz BJFCWMSLSVGWSV-NHCUHLMSSA-N 0 3 418.459 4.404 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)[C@@H]1C[C@H]1c1cccc(C(F)(F)F)c1 ZINC000444447877 868832075 /nfs/dbraw/zinc/83/20/75/868832075.db2.gz AQIJFGVOGCVYTM-LEWJYISDSA-N 0 3 418.459 4.404 20 0 HIADHN C[C@@H](Oc1ccc(Cl)c(Cl)c1)C(=O)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000444453528 868833645 /nfs/dbraw/zinc/83/36/45/868833645.db2.gz IXYXHFJMZLIRTQ-CQSZACIVSA-N 0 3 423.340 4.356 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)c1cccc2c3c([nH]c21)CCCC3 ZINC000444453697 868833807 /nfs/dbraw/zinc/83/38/07/868833807.db2.gz JROSPWOXIXKGGY-UHFFFAOYSA-N 0 3 403.526 4.256 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)c1ccccc1COc1ccccc1 ZINC000444457062 868835244 /nfs/dbraw/zinc/83/52/44/868835244.db2.gz ARABXRAURDYMKE-UHFFFAOYSA-N 0 3 416.521 4.475 20 0 HIADHN O=C(CCOc1ccc(Cl)c(Cl)c1)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000444458433 868835924 /nfs/dbraw/zinc/83/59/24/868835924.db2.gz FISZLURIYGRVBD-UHFFFAOYSA-N 0 3 423.340 4.358 20 0 HIADHN C[C@H](Oc1cccc(C(C)(C)C)c1)C(=O)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000444461140 868836530 /nfs/dbraw/zinc/83/65/30/868836530.db2.gz PBZAEKHTOIPFDO-SFHVURJKSA-N 0 3 410.558 4.347 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1cc(F)ccc1Br ZINC000444548413 868877724 /nfs/dbraw/zinc/87/77/24/868877724.db2.gz JYFQPQSKTQCBSD-UHFFFAOYSA-N 0 3 421.310 4.045 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1cnc(-c2ccsc2)s1 ZINC000444547255 868877780 /nfs/dbraw/zinc/87/77/80/868877780.db2.gz IYISFYIKLVEGBA-UHFFFAOYSA-N 0 3 413.568 4.328 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)C1(c2cccc(F)c2)CCCC1 ZINC000444559654 868882401 /nfs/dbraw/zinc/88/24/01/868882401.db2.gz BOQLBYGIJRQRCN-UHFFFAOYSA-N 0 3 410.533 4.481 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)Nc3ccc(Nc4ncccn4)cc3)cc2)CC1 ZINC000444610802 868905711 /nfs/dbraw/zinc/90/57/11/868905711.db2.gz RFWFWDZREADMAW-UHFFFAOYSA-N 0 3 416.529 4.003 20 0 HIADHN CCOC(=O)c1c(C)oc2nc(CN[C@H]3CCCC[C@@H]3c3ccccc3)nc(N)c21 ZINC000444648214 868929017 /nfs/dbraw/zinc/92/90/17/868929017.db2.gz XQEPPSUZVHLJJT-SJORKVTESA-N 0 3 408.502 4.106 20 0 HIADHN CCc1ccccc1CCN1CCC(C(=O)c2ccc3c(c2)NC(=O)[C@H](C)O3)CC1 ZINC000444657267 868935694 /nfs/dbraw/zinc/93/56/94/868935694.db2.gz BVTBJBWFPYUEIE-KRWDZBQOSA-N 0 3 406.526 4.106 20 0 HIADHN C[C@@H](NCCO[C@@H]1CCCCO1)c1cccc(NC(=O)Cc2ccccc2F)c1 ZINC000444689952 868960437 /nfs/dbraw/zinc/96/04/37/868960437.db2.gz PTHIQALNRLZEEX-UZUQRXQVSA-N 0 3 400.494 4.201 20 0 HIADHN Cc1cccc2nc(C3CCN(C[C@H](O)COc4ccc(Cl)cc4)CC3)oc21 ZINC000444768168 868993887 /nfs/dbraw/zinc/99/38/87/868993887.db2.gz VTPUDMZDRDNGKA-SFHVURJKSA-N 0 3 400.906 4.409 20 0 HIADHN Cc1ccc(S(=O)(=O)CCCN[C@@H](C)c2ccc(Br)s2)cc1 ZINC000444774632 868996587 /nfs/dbraw/zinc/99/65/87/868996587.db2.gz XHTYPGCUUHKFRL-ZDUSSCGKSA-N 0 3 402.379 4.334 20 0 HIADHN COc1ccc(OC)c(-c2csc(NC(=O)CN(CC3CCC3)C(C)C)n2)c1 ZINC000444779647 868999305 /nfs/dbraw/zinc/99/93/05/868999305.db2.gz YABZXXCJKKMQAL-UHFFFAOYSA-N 0 3 403.548 4.276 20 0 HIADHN COCCc1nsc(N(CCN2CCCC2)Cc2ccc(Cl)c(Cl)c2)n1 ZINC000444827236 869036360 /nfs/dbraw/zinc/03/63/60/869036360.db2.gz IAGZHSBWSCLEPP-UHFFFAOYSA-N 0 3 415.390 4.136 20 0 HIADHN CC1CCN([C@@H](CNC(=O)Nc2cnn(C)c2C(F)(F)F)c2ccccc2)CC1 ZINC000445027023 869174967 /nfs/dbraw/zinc/17/49/67/869174967.db2.gz CUGHXIYGWSMAOG-KRWDZBQOSA-N 0 3 409.456 4.034 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)[C@@H]2C[C@H]2c2cc(F)c(F)c(F)c2)cc1 ZINC000468341529 882276643 /nfs/dbraw/zinc/27/66/43/882276643.db2.gz VEGRYRNZXLSKDD-UEXGIBASSA-N 0 3 418.459 4.169 20 0 HIADHN C[C@@H](NC(=O)Cc1noc([C@@H]2CCCN(Cc3cccc(F)c3)C2)n1)c1ccccc1 ZINC000445289887 869341475 /nfs/dbraw/zinc/34/14/75/869341475.db2.gz AKAYFAVDSKNLSX-YLJYHZDGSA-N 0 3 422.504 4.008 20 0 HIADHN Cc1ccc(NC(=O)Cc2noc(-c3ccc(CN4CCSCC4)cc3)n2)c(C)c1 ZINC000445359419 869424749 /nfs/dbraw/zinc/42/47/49/869424749.db2.gz PZLKPXRTFSUYLW-UHFFFAOYSA-N 0 3 422.554 4.083 20 0 HIADHN COc1cccc([C@@H](CNC(=O)CCCc2ccc(F)c(F)c2)N2CCCC2)c1 ZINC000445652530 869723423 /nfs/dbraw/zinc/72/34/23/869723423.db2.gz KQMCCJHKCHEGMZ-JOCHJYFZSA-N 0 3 402.485 4.249 20 0 HIADHN C[C@H](N[C@@H]1CCCC[C@@H]1C(N)=O)c1nc2cc(Cl)ccc2n1Cc1ccccc1 ZINC000445788205 869824772 /nfs/dbraw/zinc/82/47/72/869824772.db2.gz YPISJWOKFNWTSC-ZYSHUDEJSA-N 0 3 410.949 4.433 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@@H](C)NCc2cncn2Cc2ccccc2)CC1 ZINC000445806826 869833090 /nfs/dbraw/zinc/83/30/90/869833090.db2.gz BHYMQAAMIGXURW-HXUWFJFHSA-N 0 3 421.564 4.063 20 0 HIADHN COc1ccc(NC(=O)CCN(C)[C@H]2CCOc3ccc(Br)cc32)cc1 ZINC000445888146 869873273 /nfs/dbraw/zinc/87/32/73/869873273.db2.gz SWEFGUNALCDZGY-SFHVURJKSA-N 0 3 419.319 4.242 20 0 HIADHN CCCCOc1ccccc1CN1CCC(C(=O)NCCc2cccs2)CC1 ZINC000468406834 882348556 /nfs/dbraw/zinc/34/85/56/882348556.db2.gz YRSWCCUHTWLWCP-UHFFFAOYSA-N 0 3 400.588 4.498 20 0 HIADHN Cc1nc(CC(C)C)c(C(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)s1 ZINC000445942655 869901754 /nfs/dbraw/zinc/90/17/54/869901754.db2.gz DDJLJPFLNAZGJH-IAGOWNOFSA-N 0 3 407.624 4.002 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)CCCc3ccc(F)c(F)c3)CC2)C[C@@H](C)O1 ZINC000445948062 869909900 /nfs/dbraw/zinc/90/99/00/869909900.db2.gz DBCGMERHFHMRAH-QZTJIDSGSA-N 0 3 408.533 4.025 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)CCCc3ccc(F)c(F)c3)CC2)C[C@H](C)O1 ZINC000445948061 869910230 /nfs/dbraw/zinc/91/02/30/869910230.db2.gz DBCGMERHFHMRAH-HDICACEKSA-N 0 3 408.533 4.025 20 0 HIADHN CN(C)C(=O)Cc1nc(CN[C@H]2CCC[C@H]2c2ccccc2C(F)(F)F)cs1 ZINC000446002194 869966035 /nfs/dbraw/zinc/96/60/35/869966035.db2.gz NPXWWKCYALNTKK-RDJZCZTQSA-N 0 3 411.493 4.219 20 0 HIADHN Cn1c(CN[C@H]2CCC[C@H]2c2ccccc2C(F)(F)F)nc2ccccc2c1=O ZINC000446005229 869970315 /nfs/dbraw/zinc/97/03/15/869970315.db2.gz XOXWQMJHRPQOHS-YJBOKZPZSA-N 0 3 401.432 4.378 20 0 HIADHN COC1CCN(C(C)(C)CNC(=O)CCC(=O)c2cc(Cl)sc2Cl)CC1 ZINC000446056226 870017480 /nfs/dbraw/zinc/01/74/80/870017480.db2.gz VWVBYAYZYFQTHV-UHFFFAOYSA-N 0 3 421.390 4.023 20 0 HIADHN O=C(c1cc(-c2cccs2)n(-c2ccccc2)n1)N1CC[C@@H](N2CCCCC2)C1 ZINC000446064819 870024071 /nfs/dbraw/zinc/02/40/71/870024071.db2.gz ZSNYAMPJAISJKX-LJQANCHMSA-N 0 3 406.555 4.301 20 0 HIADHN Cn1cc(NC(=O)N[C@H](CN2CCc3ccccc3C2)C(C)(C)C)c(C(F)(F)F)n1 ZINC000446276899 870212181 /nfs/dbraw/zinc/21/21/81/870212181.db2.gz NMTQTBXFHCZRPS-QGZVFWFLSA-N 0 3 423.483 4.033 20 0 HIADHN Cc1nc(CC(C)C)c(C(=O)NC2CCN(CCOc3ccc(F)cc3)CC2)s1 ZINC000446309579 870234259 /nfs/dbraw/zinc/23/42/59/870234259.db2.gz IDIIYYDMMRPPKU-UHFFFAOYSA-N 0 3 419.566 4.062 20 0 HIADHN CC(C)Cn1ccc2c1cccc2C(=O)N(C)C[C@]1(O)CCN(Cc2ccccc2)C1 ZINC000446329183 870244459 /nfs/dbraw/zinc/24/44/59/870244459.db2.gz FIVUKVZBBKORQD-AREMUKBSSA-N 0 3 419.569 4.006 20 0 HIADHN COc1cc(C)c(NC(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)cc1C ZINC000446367850 870277808 /nfs/dbraw/zinc/27/78/08/870277808.db2.gz ADKOXBLLOPPENB-KDURUIRLSA-N 0 3 403.567 4.055 20 0 HIADHN COc1cc(SC)ccc1NC(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000446414512 870321666 /nfs/dbraw/zinc/32/16/66/870321666.db2.gz XPNKNNBMSRIVJQ-CALCHBBNSA-N 0 3 421.607 4.160 20 0 HIADHN CN(C(=O)N[C@@H]1CC[C@H](Cc2ccccc2)C1)C1CCN(CCc2ccccn2)CC1 ZINC000446634989 870540766 /nfs/dbraw/zinc/54/07/66/870540766.db2.gz QTJGEYIWELXQIC-ISKFKSNPSA-N 0 3 420.601 4.141 20 0 HIADHN COc1cc(CN2CCC(CO)(Cc3ccccc3)CC2)c(SC)cc1OC ZINC000446842123 870759883 /nfs/dbraw/zinc/75/98/83/870759883.db2.gz DESMXOSVAXYPCZ-UHFFFAOYSA-N 0 3 401.572 4.243 20 0 HIADHN CCN(C(=O)c1ccc(N2CCN(CC)CC2)cc1)c1cccc(Br)c1 ZINC000468478860 882441395 /nfs/dbraw/zinc/44/13/95/882441395.db2.gz LACJIJNAVFXEKB-UHFFFAOYSA-N 0 3 416.363 4.258 20 0 HIADHN CCOC(=O)c1nnc(C2CC[NH+](Cc3ccc(-c4ccc(F)cc4)s3)CC2)[n-]1 ZINC000446847200 870766850 /nfs/dbraw/zinc/76/68/50/870766850.db2.gz JTOXQWVCLHTIDO-UHFFFAOYSA-N 0 3 414.506 4.229 20 0 HIADHN Cc1ccc2ncc(CNC3(c4cccc(OC(F)(F)F)c4)CCOCC3)n2c1 ZINC000446847099 870767147 /nfs/dbraw/zinc/76/71/47/870767147.db2.gz INTHOZNNZQCAHN-UHFFFAOYSA-N 0 3 405.420 4.337 20 0 HIADHN CC(C)N(C)C(=O)c1ccc(Cl)c(NC(=O)N(CCN(C)C)Cc2ccco2)c1 ZINC000446850669 870770816 /nfs/dbraw/zinc/77/08/16/870770816.db2.gz BSAMHWDQMMMKRC-UHFFFAOYSA-N 0 3 420.941 4.009 20 0 HIADHN Cc1ccc([C@H](CCn2cncn2)NCc2ccc(C)cc2OC[C@H]2CCOC2)cc1 ZINC000446938269 870848420 /nfs/dbraw/zinc/84/84/20/870848420.db2.gz HXYFXJDGJCCLSM-URXFXBBRSA-N 0 3 420.557 4.231 20 0 HIADHN COC[C@H](C)OC[C@H](O)CN(C)C(c1ccc(Cl)cc1)c1ccc(Cl)cc1 ZINC000447008552 870888871 /nfs/dbraw/zinc/88/88/71/870888871.db2.gz WCMXILAEEGEAQB-MGPUTAFESA-N 0 3 412.357 4.427 20 0 HIADHN CC[C@H](C)c1ccccc1NC(=O)[C@H](C)NC[C@](C)(C(=O)OC)c1ccc(F)cc1 ZINC000447033546 870908467 /nfs/dbraw/zinc/90/84/67/870908467.db2.gz JBHHQFXZENLDTD-UAVUOLJFSA-N 0 3 414.521 4.387 20 0 HIADHN COC1(CO)CCN(Cc2cn(-c3ccccc3)nc2-c2cc3ccccc3o2)CC1 ZINC000447059979 870939833 /nfs/dbraw/zinc/93/98/33/870939833.db2.gz ZTDZLIYSVLKSAJ-UHFFFAOYSA-N 0 3 417.509 4.259 20 0 HIADHN COc1ccccc1-c1csc([C@@H]2CCCN(Cc3cc(C(N)=O)cs3)C2)n1 ZINC000447070029 870951429 /nfs/dbraw/zinc/95/14/29/870951429.db2.gz VFOQXHAIAWQAHT-CQSZACIVSA-N 0 3 413.568 4.359 20 0 HIADHN COC(=O)c1cc(C(C)(C)C)sc1NC(=O)N(CCN(C)C)Cc1ccco1 ZINC000447077775 870963014 /nfs/dbraw/zinc/96/30/14/870963014.db2.gz MIZKNWQLDWSMET-UHFFFAOYSA-N 0 3 407.536 4.021 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)N[C@H](C)c2cccc(N3CCCC3)c2)c1 ZINC000447232821 871118124 /nfs/dbraw/zinc/11/81/24/871118124.db2.gz ZVFLEJIFKWLRPA-OAQYLSRUSA-N 0 3 408.590 4.430 20 0 HIADHN COc1ccc([C@H](NC(=O)N(CCN(C)C)Cc2ccco2)c2ccc(C)cc2)cc1 ZINC000447330580 871222098 /nfs/dbraw/zinc/22/20/98/871222098.db2.gz CYCDUKAWVIXIIG-XMMPIXPASA-N 0 3 421.541 4.459 20 0 HIADHN COc1ccc([C@@H](NC(=O)N(CCN(C)C)Cc2ccco2)c2ccc(C)cc2)cc1 ZINC000447330578 871222742 /nfs/dbraw/zinc/22/27/42/871222742.db2.gz CYCDUKAWVIXIIG-DEOSSOPVSA-N 0 3 421.541 4.459 20 0 HIADHN COc1cccc(C2(NCCOc3cccc(Br)c3)CCOCC2)c1F ZINC000447369523 871275687 /nfs/dbraw/zinc/27/56/87/871275687.db2.gz XPKAWSYZMQSPKD-UHFFFAOYSA-N 0 3 424.310 4.271 20 0 HIADHN C[C@H]1CN(c2cccc3cnccc32)CCN1CCCc1nc(-c2ccccc2)no1 ZINC000447392337 871303561 /nfs/dbraw/zinc/30/35/61/871303561.db2.gz BSYJRHAHOXPTRO-IBGZPJMESA-N 0 3 413.525 4.428 20 0 HIADHN CN(C)Cc1cccc(NC(=O)C(=O)NC2(c3c(Cl)cccc3Cl)CCC2)c1 ZINC000447460405 871350916 /nfs/dbraw/zinc/35/09/16/871350916.db2.gz LTNGVRFIWFASGX-UHFFFAOYSA-N 0 3 420.340 4.189 20 0 HIADHN Cc1c(Br)ccc(C(=O)Nc2cccc(CN3CCC(O)CC3)c2)c1F ZINC000447501252 871376433 /nfs/dbraw/zinc/37/64/33/871376433.db2.gz WRFJBHAXUHRMBV-UHFFFAOYSA-N 0 3 421.310 4.106 20 0 HIADHN COc1ccc([C@@H](N[C@@H]2CCCN(c3cc(C)nn3C)C2)c2ccc(F)cc2)cc1 ZINC000447560235 871449792 /nfs/dbraw/zinc/44/97/92/871449792.db2.gz WEEYAJNSGRCHEZ-QPPBQGQZSA-N 0 3 408.521 4.224 20 0 HIADHN Cc1ccc([C@H](NC[C@@H]2CCCCN2C2CC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000447593382 871499394 /nfs/dbraw/zinc/49/93/94/871499394.db2.gz RNODBTUEKDXSMK-UPVQGACJSA-N 0 3 412.599 4.094 20 0 HIADHN CC(C)[C@@H]1C[C@@H](NCc2ccc(N3CCCS3(=O)=O)c(F)c2)c2ccccc21 ZINC000447608826 871517450 /nfs/dbraw/zinc/51/74/50/871517450.db2.gz WKKCUIQPOKIMFU-PZJWPPBQSA-N 0 3 402.535 4.340 20 0 HIADHN COc1ccc(Cn2nc(C)c(CN3CC[C@H](n4ncc5ccccc54)C3)c2C)cc1 ZINC000468518434 882527363 /nfs/dbraw/zinc/52/73/63/882527363.db2.gz WLVSNQFUBCQOHX-QFIPXVFZSA-N 0 3 415.541 4.354 20 0 HIADHN CC[C@H](C(=O)N1CCC(NCc2nc(-c3ccccc3)c[nH]2)CC1)c1ccccc1 ZINC000447847881 871767071 /nfs/dbraw/zinc/76/70/71/871767071.db2.gz IUPVBVJKSJKQAP-QFIPXVFZSA-N 0 3 402.542 4.351 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)[C@H](C)N[C@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000447885539 871798157 /nfs/dbraw/zinc/79/81/57/871798157.db2.gz HXGXNDLSFWUJGJ-TXPKVOOTSA-N 0 3 402.922 4.433 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)[C@H](C)N[C@@H](C[C@H]1CCOC1)c1ccccc1 ZINC000447885537 871798803 /nfs/dbraw/zinc/79/88/03/871798803.db2.gz HXGXNDLSFWUJGJ-FCEWJHQRSA-N 0 3 402.922 4.433 20 0 HIADHN CCOc1ccc([C@H](N[C@@H]2CCCN(CC(F)(F)F)C2=O)C(C)C)cc1OCC ZINC000447886678 871800733 /nfs/dbraw/zinc/80/07/33/871800733.db2.gz ULVIGGQKWBVOEI-VQIMIIECSA-N 0 3 416.484 4.324 20 0 HIADHN CCOc1cc(CN[C@H](CO)[C@@H]2CCCO2)ccc1OCc1c(F)cccc1Cl ZINC000447982000 871833524 /nfs/dbraw/zinc/83/35/24/871833524.db2.gz HUUQBMPIZXOBDC-UXHICEINSA-N 0 3 423.912 4.086 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1cccc2c1OCC[C@@H]2OC)c1ccsc1 ZINC000448043850 871875635 /nfs/dbraw/zinc/87/56/35/871875635.db2.gz OWRSBZXPEJOBRD-OALUTQOASA-N 0 3 403.548 4.423 20 0 HIADHN CC[C@H](CNC(=O)Nc1cccc2c1OCC[C@@H]2OC)N1CCc2ccccc2C1 ZINC000448045352 871876745 /nfs/dbraw/zinc/87/67/45/871876745.db2.gz QKWMCXSVEMKILJ-KNQAVFIVSA-N 0 3 409.530 4.115 20 0 HIADHN CO[C@@H]1CCOc2c(NC(=O)NC[C@H]3CCCCN3Cc3ccccc3)cccc21 ZINC000448048523 871879891 /nfs/dbraw/zinc/87/98/91/871879891.db2.gz KRZUUFHNCCMQOF-DENIHFKCSA-N 0 3 409.530 4.333 20 0 HIADHN Cc1[nH]nc2ncc(CN3CCC[C@H](Nc4cccc(Br)c4)C3)cc12 ZINC000448353578 872301264 /nfs/dbraw/zinc/30/12/64/872301264.db2.gz HDSCGLOIWGRNRM-KRWDZBQOSA-N 0 3 400.324 4.105 20 0 HIADHN CCN(C(=O)NC[C@@H](c1ccccc1)N1CCC(C)CC1)[C@@H]1CCOC(C)(C)C1 ZINC000460119118 872589814 /nfs/dbraw/zinc/58/98/14/872589814.db2.gz XPFGGMVPDGAAIH-YADHBBJMSA-N 0 3 401.595 4.449 20 0 HIADHN CC[C@@H](C)[C@H](C)NC(=O)N(Cc1ccccc1Br)C1CCN(C)CC1 ZINC000460121926 872594223 /nfs/dbraw/zinc/59/42/23/872594223.db2.gz VIAPPSLXDOECTC-CVEARBPZSA-N 0 3 410.400 4.490 20 0 HIADHN CCN(C(=O)Nc1ccc(NC(=O)C2CC2)cc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000460126779 872604825 /nfs/dbraw/zinc/60/48/25/872604825.db2.gz ZEDUCVQQOKPYRI-JOCHJYFZSA-N 0 3 406.530 4.163 20 0 HIADHN CCn1c(C2CCC2)nnc1N1CCCN(Cc2ccc(C(F)(F)F)cc2)CC1 ZINC000460203757 872781236 /nfs/dbraw/zinc/78/12/36/872781236.db2.gz DPDIUFWPYQJGJK-UHFFFAOYSA-N 0 3 407.484 4.297 20 0 HIADHN CCn1c([C@@H](C)Oc2ccc3ccccc3c2)nnc1N(C)[C@H]1CCN(C2CC2)C1 ZINC000460204357 872784156 /nfs/dbraw/zinc/78/41/56/872784156.db2.gz UVNKALPLLHLLCZ-UTKZUKDTSA-N 0 3 405.546 4.264 20 0 HIADHN C[C@@H](CNC(=O)N1CCCC[C@@H]1c1nnc(C2CCC2)o1)N(C)Cc1ccccc1 ZINC000460277882 872866084 /nfs/dbraw/zinc/86/60/84/872866084.db2.gz VOBCJXBAKDYVPD-FXAWDEMLSA-N 0 3 411.550 4.094 20 0 HIADHN O=C(CCN1CCN(c2ccccc2)CC1)Nc1cccc(COCc2ccco2)c1 ZINC000468589303 882674270 /nfs/dbraw/zinc/67/42/70/882674270.db2.gz MDJPCAHXWGAKTI-UHFFFAOYSA-N 0 3 419.525 4.147 20 0 HIADHN Cc1ccc(CNCc2ccc(OC[C@H]3CCCO3)cc2)c(-n2cc(Cl)cn2)n1 ZINC000468590769 882677289 /nfs/dbraw/zinc/67/72/89/882677289.db2.gz NVNBRRRQOFEXDV-OAQYLSRUSA-N 0 3 412.921 4.077 20 0 HIADHN COc1cccc(-c2ccc(CNC(=O)CC3(N4CCOCC4)CCCC3)cc2)c1 ZINC000460456960 873135627 /nfs/dbraw/zinc/13/56/27/873135627.db2.gz BSPVIDAICUTCFS-UHFFFAOYSA-N 0 3 408.542 4.014 20 0 HIADHN CC(C)CC1(C)CCN(C(=O)NCc2ccccc2CN2CCC(O)CC2)CC1 ZINC000460487641 873173743 /nfs/dbraw/zinc/17/37/43/873173743.db2.gz IOPVYWXFBSAAIJ-UHFFFAOYSA-N 0 3 401.595 4.001 20 0 HIADHN CC(C)Cn1c([C@@H]2OCC[C@@H]2C)nnc1N1C[C@@H](C)N(Cc2ccccc2)C[C@H]1C ZINC000460614606 873357813 /nfs/dbraw/zinc/35/78/13/873357813.db2.gz WMCOUHSGJDXIAZ-GPQLQYNLSA-N 0 3 411.594 4.131 20 0 HIADHN CCOCCCn1c(C2CCC2)nnc1N1C[C@@H](C)N(Cc2ccccc2)C[C@@H]1C ZINC000460795270 873664702 /nfs/dbraw/zinc/66/47/02/873664702.db2.gz PJWFMDWVRWCLMZ-UXHICEINSA-N 0 3 411.594 4.071 20 0 HIADHN C[C@H](Oc1cccc(Br)c1)C(=O)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000460804702 873679341 /nfs/dbraw/zinc/67/93/41/873679341.db2.gz JUYLAUDIVZVFQM-JXFKEZNVSA-N 0 3 417.347 4.170 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)c1ccc(OCc2ccccn2)cc1 ZINC000460805724 873680857 /nfs/dbraw/zinc/68/08/57/873680857.db2.gz NHJOEHIGBPADSX-XMMPIXPASA-N 0 3 401.510 4.228 20 0 HIADHN Cc1ccc(C(=O)NCCN2CCCC2)cc1OCc1csc(Br)c1 ZINC000460806447 873682793 /nfs/dbraw/zinc/68/27/93/873682793.db2.gz WMFFNIQJYVKMLS-UHFFFAOYSA-N 0 3 423.376 4.224 20 0 HIADHN Cc1nc2ccccc2n1CCc1noc(-c2ccc(CN3CCSCC3)cc2)n1 ZINC000460818966 873701103 /nfs/dbraw/zinc/70/11/03/873701103.db2.gz GOZYENUOZWMLKV-UHFFFAOYSA-N 0 3 419.554 4.186 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)N[C@@H]1CCCc2cn(C3CCCC3)nc21 ZINC000460889946 873801410 /nfs/dbraw/zinc/80/14/10/873801410.db2.gz RVRTZLUELURXCZ-XMSQKQJNSA-N 0 3 409.578 4.195 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N[C@@H]1c2ccccc2CC12CCOCC2)c1ccco1 ZINC000461004533 873880696 /nfs/dbraw/zinc/88/06/96/873880696.db2.gz CNEHGFPFCRNPFS-UCNVEGJOSA-N 0 3 411.546 4.102 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N1CCCC[C@H]1c1nnc(C2CCC2)o1)c1ccco1 ZINC000461025680 873891560 /nfs/dbraw/zinc/89/15/60/873891560.db2.gz MGAPMSTVTTUUFI-SZMVWBNQSA-N 0 3 415.538 4.296 20 0 HIADHN C[C@@H](C(=O)NC1CCN(CCOc2ccc(Cl)cc2)CC1)c1ccc(F)c(F)c1 ZINC000461056207 873930446 /nfs/dbraw/zinc/93/04/46/873930446.db2.gz WFAIJBQPFXPGKT-OAHLLOKOSA-N 0 3 422.903 4.381 20 0 HIADHN C[C@H](C(=O)NC1CCN(CCOc2ccc(Cl)cc2)CC1)c1ccc(F)c(F)c1 ZINC000461056206 873930967 /nfs/dbraw/zinc/93/09/67/873930967.db2.gz WFAIJBQPFXPGKT-HNNXBMFYSA-N 0 3 422.903 4.381 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)c1ccc(OCc2ccccn2)cc1 ZINC000461075666 873974595 /nfs/dbraw/zinc/97/45/95/873974595.db2.gz PELURTCYVKJOIZ-OAQYLSRUSA-N 0 3 415.537 4.397 20 0 HIADHN Cc1cc(Cl)cc2c1OCCC[C@H]2NCc1ccc(N2CCCS2(=O)=O)cc1 ZINC000461081826 873989177 /nfs/dbraw/zinc/98/91/77/873989177.db2.gz BRMQJLIKBUDPGA-HXUWFJFHSA-N 0 3 420.962 4.192 20 0 HIADHN CCN1CCCC[C@H]1CNC(=O)c1ccc(Oc2cccc(Cl)c2Cl)nn1 ZINC000461082602 873990882 /nfs/dbraw/zinc/99/08/82/873990882.db2.gz IPVVBRPFCGXXHU-ZDUSSCGKSA-N 0 3 409.317 4.180 20 0 HIADHN C[C@H](NC(=O)N[C@H]1c2ccccc2CC12CCOCC2)[C@@H](c1ccccc1)N(C)C ZINC000461226314 874228139 /nfs/dbraw/zinc/22/81/39/874228139.db2.gz MIAHDOXYZFVORH-TZYHBYERSA-N 0 3 407.558 4.071 20 0 HIADHN C[C@@H](N[C@@H]1CCCN(CC(C)(C)C)C1=O)c1ccc(NC(=O)c2ccncc2)cc1 ZINC000461358600 874360121 /nfs/dbraw/zinc/36/01/21/874360121.db2.gz CQAWRPAQKJHEJW-DYESRHJHSA-N 0 3 408.546 4.022 20 0 HIADHN C[C@H](N[C@@H]1CCCN(CC(C)(C)C)C1=O)c1ccc(NC(=O)c2ccncc2)cc1 ZINC000461358602 874360370 /nfs/dbraw/zinc/36/03/70/874360370.db2.gz CQAWRPAQKJHEJW-LAUBAEHRSA-N 0 3 408.546 4.022 20 0 HIADHN CCOc1ccccc1C1=CCN(C(=O)c2ccc(N3CCN(CC)CC3)cc2)CC1 ZINC000468708522 882824244 /nfs/dbraw/zinc/82/42/44/882824244.db2.gz YZRUAHFJGAOWIW-UHFFFAOYSA-N 0 3 419.569 4.157 20 0 HIADHN O=C(CCC(=O)N1C[C@@H]2CCN(Cc3ccccc3)C[C@H]2C1)c1ccc2c(c1)CCC2 ZINC000461439506 874492734 /nfs/dbraw/zinc/49/27/34/874492734.db2.gz RUFCLBAASREBPF-DQEYMECFSA-N 0 3 416.565 4.119 20 0 HIADHN Cc1ccc(C(=O)CCCC(=O)N2C[C@H]3CN(Cc4ccccc4)CC[C@@H]3C2)cc1 ZINC000461446086 874502466 /nfs/dbraw/zinc/50/24/66/874502466.db2.gz OGMYCVIDDDQVJC-DNQXCXABSA-N 0 3 404.554 4.329 20 0 HIADHN CC[C@@H](CN(C)C(=O)N[C@@H](C)C1=CCN(C)CC1)Oc1ccc(Cl)c(Cl)c1 ZINC000468745765 882839596 /nfs/dbraw/zinc/83/95/96/882839596.db2.gz WEIHURNFXBBTLN-HOCLYGCPSA-N 0 3 414.377 4.443 20 0 HIADHN CC1CCN([C@@H](CNC(=O)Cc2cncn2Cc2ccccc2)c2cccs2)CC1 ZINC000468788845 882860554 /nfs/dbraw/zinc/86/05/54/882860554.db2.gz CAUXPYDPGXDSAL-QFIPXVFZSA-N 0 3 422.598 4.125 20 0 HIADHN C[C@@H]1CCN(C)CCN1C(=O)N[C@@H]1CCCc2c3cc(Br)ccc3[nH]c21 ZINC000461714661 874863994 /nfs/dbraw/zinc/86/39/94/874863994.db2.gz JDSBPQIPCDNBGL-FZKQIMNGSA-N 0 3 419.367 4.043 20 0 HIADHN Cc1ccc(F)c(C(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)c1Br ZINC000468840047 882884908 /nfs/dbraw/zinc/88/49/08/882884908.db2.gz DHBUSMYYLNKFBG-GDBMZVCRSA-N 0 3 405.311 4.462 20 0 HIADHN Cc1ccc(F)c(C(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)c1Br ZINC000468840663 882885746 /nfs/dbraw/zinc/88/57/46/882885746.db2.gz DHBUSMYYLNKFBG-HOCLYGCPSA-N 0 3 405.311 4.462 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)N[C@@H]2CCCc3cn(C4CCCC4)nc32)o1 ZINC000461972534 875095336 /nfs/dbraw/zinc/09/53/36/875095336.db2.gz ZOOYKLQDDHKJJF-OAQYLSRUSA-N 0 3 413.566 4.050 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)N[C@@H]1CCCc2cn(C3CCCC3)nc21 ZINC000461996662 875116968 /nfs/dbraw/zinc/11/69/68/875116968.db2.gz QYKPFRGNRGTUPP-XZOQPEGZSA-N 0 3 421.589 4.339 20 0 HIADHN Cc1nc(C(F)(F)F)sc1C(=O)NC[C@@H]1CCCN(Cc2cccs2)C1 ZINC000462020507 875137264 /nfs/dbraw/zinc/13/72/64/875137264.db2.gz NBGQBYAZJLHYBV-LBPRGKRZSA-N 0 3 403.495 4.174 20 0 HIADHN COc1cccc([C@@H](CNc2ncccc2C(=O)N2CCc3ccccc32)N(C)C)c1 ZINC000462116812 875220485 /nfs/dbraw/zinc/22/04/85/875220485.db2.gz RGEKVBUHOZIKOJ-HSZRJFAPSA-N 0 3 416.525 4.008 20 0 HIADHN Cc1nc(C(F)(F)F)sc1C(=O)NC[C@H]1CCCN(C)[C@@H]1c1cccs1 ZINC000462137182 875236052 /nfs/dbraw/zinc/23/60/52/875236052.db2.gz ASHCLLBAFDZIQX-YPMHNXCESA-N 0 3 403.495 4.345 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)N[C@H]1CCCc2cn(C3CCCC3)nc21 ZINC000462159076 875254695 /nfs/dbraw/zinc/25/46/95/875254695.db2.gz ZHNAITDFNCXZFE-FQEVSTJZSA-N 0 3 415.607 4.211 20 0 HIADHN Cc1nc(COc2cccc(C(=O)N[C@H]3CN(Cc4ccccc4)C[C@@H]3C)c2)cs1 ZINC000462166202 875263668 /nfs/dbraw/zinc/26/36/68/875263668.db2.gz FAXKTBKSUZXPQX-SBUREZEXSA-N 0 3 421.566 4.281 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1cnn(-c2ccccc2)c1C1CC1 ZINC000462171584 875267818 /nfs/dbraw/zinc/26/78/18/875267818.db2.gz SSVGKPZBZGJEQN-JPYJTQIMSA-N 0 3 400.526 4.000 20 0 HIADHN CSc1nc(C(C)(C)C)nc(C)c1C(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C ZINC000462178554 875278847 /nfs/dbraw/zinc/27/88/47/875278847.db2.gz IMMQKEFFPDPWFO-YJBOKZPZSA-N 0 3 412.603 4.055 20 0 HIADHN Cc1nc(CCC(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)oc1-c1ccccc1 ZINC000462180885 875280604 /nfs/dbraw/zinc/28/06/04/875280604.db2.gz OIVNXEALLPVGQP-AVRDEDQJSA-N 0 3 403.526 4.219 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)CCc1cc(Br)cs1 ZINC000462180932 875280986 /nfs/dbraw/zinc/28/09/86/875280986.db2.gz WFBOLJJGCNEDSW-KDOFPFPSSA-N 0 3 407.377 4.080 20 0 HIADHN CC(C)CC(=O)Nc1ccc(C(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)cc1F ZINC000462188570 875290857 /nfs/dbraw/zinc/29/08/57/875290857.db2.gz NSDNFUJKKCXMCR-JTSKRJEESA-N 0 3 411.521 4.061 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)NCc1csc(-c2ccccc2)n1 ZINC000462212656 875319855 /nfs/dbraw/zinc/31/98/55/875319855.db2.gz VFIVTNBDPDYLDT-DYESRHJHSA-N 0 3 406.555 4.130 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)Nc1cccc(OCc2cccnc2)c1 ZINC000462241602 875356472 /nfs/dbraw/zinc/35/64/72/875356472.db2.gz AIRVYAZBNJIQTL-CYFREDJKSA-N 0 3 416.525 4.303 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)Nc1ccc(NC(=O)c2ccco2)cc1 ZINC000462267082 875394639 /nfs/dbraw/zinc/39/46/39/875394639.db2.gz HCGFHRQAWWUCFP-UTKZUKDTSA-N 0 3 418.497 4.174 20 0 HIADHN COCCOc1c(Cl)cccc1NC(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C ZINC000462268604 875395974 /nfs/dbraw/zinc/39/59/74/875395974.db2.gz QBQBUGACQSLQPO-OXQOHEQNSA-N 0 3 417.937 4.007 20 0 HIADHN CC(C)Cn1ncc(NC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)c1C(F)F ZINC000462273316 875401605 /nfs/dbraw/zinc/40/16/05/875401605.db2.gz BQYPDQZARSVQFD-MAUKXSAKSA-N 0 3 405.493 4.119 20 0 HIADHN Cc1ccnc(Oc2ccc(NC(=O)N[C@H]3CN(Cc4ccccc4)C[C@H]3C)cc2)n1 ZINC000462277144 875404775 /nfs/dbraw/zinc/40/47/75/875404775.db2.gz JWAHEWLZBQFHOB-VGSWGCGISA-N 0 3 417.513 4.219 20 0 HIADHN O=C(NC[C@@H]1CCCCN1Cc1ccccc1)N[C@H]1CCO[C@@H](c2ccccc2)C1 ZINC000462317596 875437752 /nfs/dbraw/zinc/43/77/52/875437752.db2.gz ZDNPZDXPGZDKRF-KMDXXIMOSA-N 0 3 407.558 4.261 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)[C@H](C)c2cccc(Br)c2)c1 ZINC000462345413 875458809 /nfs/dbraw/zinc/45/88/09/875458809.db2.gz XQWPSEQAEHXQHD-MRXNPFEDSA-N 0 3 419.363 4.152 20 0 HIADHN CSc1cc2c(cc1CNCCOc1cccc(Br)c1)OCCO2 ZINC000462367779 875479333 /nfs/dbraw/zinc/47/93/33/875479333.db2.gz KMSMPNODFCIZOK-UHFFFAOYSA-N 0 3 410.333 4.111 20 0 HIADHN CC(C)(C)OC1CCN(C[C@H](O)COc2ccc(Cl)cc2Br)CC1 ZINC000468891728 882935170 /nfs/dbraw/zinc/93/51/70/882935170.db2.gz IUJPORZLXDTYFL-AWEZNQCLSA-N 0 3 420.775 4.122 20 0 HIADHN COc1ccc(CNC(=O)CN[C@H](C)c2ccc(Cl)c3ccccc32)cc1OC ZINC000462455329 875561217 /nfs/dbraw/zinc/56/12/17/875561217.db2.gz NGWYHEMXAKZEOQ-OAHLLOKOSA-N 0 3 412.917 4.477 20 0 HIADHN C[C@H](NCC(=O)Nc1ccc(C(=O)N(C)C)cc1)c1ccc(Cl)c2ccccc21 ZINC000462453486 875562139 /nfs/dbraw/zinc/56/21/39/875562139.db2.gz UQNIFYUFMCFQRU-HNNXBMFYSA-N 0 3 409.917 4.484 20 0 HIADHN C[C@@H](Cn1cc(Br)cn1)NCc1ccc(Oc2cccnc2)c(F)c1 ZINC000468894850 882942240 /nfs/dbraw/zinc/94/22/40/882942240.db2.gz HFYFEONUPPIBRY-ZDUSSCGKSA-N 0 3 405.271 4.150 20 0 HIADHN COc1cccc(Cl)c1CC(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000462493429 875606679 /nfs/dbraw/zinc/60/66/79/875606679.db2.gz ZHRNBPUUZJDKFU-UHFFFAOYSA-N 0 3 404.963 4.121 20 0 HIADHN COC(=O)[C@@](C)(CN[C@@H](C)C(=O)Nc1cccc(Cl)c1Cl)c1ccccc1 ZINC000468898275 882947057 /nfs/dbraw/zinc/94/70/57/882947057.db2.gz HXXRJIVQYZTUTQ-RBZFPXEDSA-N 0 3 409.313 4.041 20 0 HIADHN CC(C)[C@H](Oc1ccc(Cl)cc1)C(=O)N(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1 ZINC000462539009 875660063 /nfs/dbraw/zinc/66/00/63/875660063.db2.gz NALKNCIVVGUOHF-NYVOZVTQSA-N 0 3 415.965 4.290 20 0 HIADHN Brc1cc2c(c(CNCCc3nc(-c4ccncc4)cs3)c1)OCC2 ZINC000462546315 875668356 /nfs/dbraw/zinc/66/83/56/875668356.db2.gz GKHPASKBBATMFU-UHFFFAOYSA-N 0 3 416.344 4.235 20 0 HIADHN C[C@H](N[C@H]1CCCN(Cc2ccc(F)cc2F)C1=O)c1ccc(OC(F)F)cc1 ZINC000468906512 882959817 /nfs/dbraw/zinc/95/98/17/882959817.db2.gz HVYNVKOXQKLXPQ-DJJJIMSYSA-N 0 3 410.411 4.408 20 0 HIADHN COc1cccc(O[C@@H](C)CNCc2cnn(-c3ccc(Br)cc3)c2)c1 ZINC000462734935 875807241 /nfs/dbraw/zinc/80/72/41/875807241.db2.gz CGOBRQYLDFHVNF-HNNXBMFYSA-N 0 3 416.319 4.201 20 0 HIADHN CCc1cc(N2CCC[C@@H](NCc3ccc(Br)cc3Cl)C2)ncn1 ZINC000462747098 875815613 /nfs/dbraw/zinc/81/56/13/875815613.db2.gz XLPZJFBIIMIILE-MRXNPFEDSA-N 0 3 409.759 4.214 20 0 HIADHN COC(=O)c1cc(CN[C@H]2c3cc(Br)ccc3SC[C@H]2C)n(C)c1C ZINC000462784317 875838950 /nfs/dbraw/zinc/83/89/50/875838950.db2.gz DJPKCNLIHXTCOE-ADLMAVQZSA-N 0 3 423.376 4.455 20 0 HIADHN CCOc1cc(CN(C)C[C@H](C)O)cc(Br)c1OCc1ccccc1 ZINC000462825535 875863403 /nfs/dbraw/zinc/86/34/03/875863403.db2.gz KVSBZROFYQPDST-HNNXBMFYSA-N 0 3 408.336 4.239 20 0 HIADHN CCc1ccc([C@H](N[C@H]2CCO[C@@H](C3CC3)C2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000462838712 875873948 /nfs/dbraw/zinc/87/39/48/875873948.db2.gz ZHISVQJYFZFNNA-QTJGBDASSA-N 0 3 413.583 4.289 20 0 HIADHN O=S1(=O)CCCN1c1cccc(CN[C@H]2CCCCc3ccc(Cl)cc32)c1 ZINC000462840038 875875360 /nfs/dbraw/zinc/87/53/60/875875360.db2.gz KOIPZSTZOJYZDS-NRFANRHFSA-N 0 3 404.963 4.437 20 0 HIADHN CCc1ccccc1NC(=O)C[C@@H](C)NCc1cc(Br)cc2c1OCC2 ZINC000462841684 875876683 /nfs/dbraw/zinc/87/66/83/875876683.db2.gz FALVVQXCUDMJES-CQSZACIVSA-N 0 3 417.347 4.453 20 0 HIADHN CCOC(=O)c1csc(CCN[C@H](C)c2ccc(F)cc2Br)n1 ZINC000468916748 882976271 /nfs/dbraw/zinc/97/62/71/882976271.db2.gz LAFIHHOHXYFYAM-SNVBAGLBSA-N 0 3 401.301 4.115 20 0 HIADHN COC(=O)c1cc(CNCc2ccc(Oc3cc(OC)cc(OC)c3)cc2)n(C)c1C ZINC000462900489 875926345 /nfs/dbraw/zinc/92/63/45/875926345.db2.gz NFRVUSGHKKRPEH-UHFFFAOYSA-N 0 3 424.497 4.219 20 0 HIADHN COC(=O)c1cc(CN2CCC[C@H](c3nc4ccccc4n3C(C)C)C2)n(C)c1C ZINC000462954031 875971309 /nfs/dbraw/zinc/97/13/09/875971309.db2.gz AMYNAYFVZRIWPZ-SFHVURJKSA-N 0 3 408.546 4.430 20 0 HIADHN O=C(c1ccccc1Cl)N1CCC(N[C@@H]2CCOc3c(F)ccc(F)c32)CC1 ZINC000462965839 875979958 /nfs/dbraw/zinc/97/99/58/875979958.db2.gz OZGIGOINHCAZMT-GOSISDBHSA-N 0 3 406.860 4.336 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N[C@H](CC(F)(F)F)c1ccccc1 ZINC000463004010 876018552 /nfs/dbraw/zinc/01/85/52/876018552.db2.gz WDPSZOFHTPGLCR-AHRSYUTCSA-N 0 3 405.464 4.500 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)N[C@H]1CCO[C@@H](c2ccccc2)C1 ZINC000463006319 876020633 /nfs/dbraw/zinc/02/06/33/876020633.db2.gz BDIKYFFRCDWYRT-FGCOXFRFSA-N 0 3 407.558 4.213 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)N[C@H]1CCO[C@H](c2ccccc2)C1 ZINC000463006321 876020684 /nfs/dbraw/zinc/02/06/84/876020684.db2.gz BDIKYFFRCDWYRT-QDSKXPNFSA-N 0 3 407.558 4.213 20 0 HIADHN OC[C@@]1(c2ccccc2)CCN(Cc2cnn(Cc3ccc(C(F)(F)F)cc3)c2)C1 ZINC000463022560 876040480 /nfs/dbraw/zinc/04/04/80/876040480.db2.gz JZHCCUKVANFVGF-JOCHJYFZSA-N 0 3 415.459 4.086 20 0 HIADHN Brc1ccc2nc(CN3CCCN(Cc4ccccc4)CC3)oc2c1 ZINC000463078424 876109352 /nfs/dbraw/zinc/10/93/52/876109352.db2.gz RJLKMEBWJWWPNU-UHFFFAOYSA-N 0 3 400.320 4.298 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cccc(-c2noc(C3CC3)n2)c1)c1ccsc1 ZINC000463108330 876147016 /nfs/dbraw/zinc/14/70/16/876147016.db2.gz SRYAQCLUAZTLNN-LJQANCHMSA-N 0 3 410.543 4.488 20 0 HIADHN CC[C@H](NC1CCN(Cc2ccccc2Cl)CC1)c1nnc2n1CCCCC2 ZINC000463112943 876151847 /nfs/dbraw/zinc/15/18/47/876151847.db2.gz MYZFJZIAXQVKIH-FQEVSTJZSA-N 0 3 401.986 4.363 20 0 HIADHN COc1ccc(-n2ccc(CNC3CCN(Cc4ccc(Cl)cc4)CC3)n2)cc1 ZINC000463117731 876158519 /nfs/dbraw/zinc/15/85/19/876158519.db2.gz XJZLDFOHOQJGDQ-UHFFFAOYSA-N 0 3 410.949 4.289 20 0 HIADHN CC[C@H](O[C@H]1CCC[C@@H](C)C1)C(=O)NCCCCN1CCN(c2ccccc2)CC1 ZINC000463123158 876164792 /nfs/dbraw/zinc/16/47/92/876164792.db2.gz ARXKCNLOJUWQDC-NHTMILBNSA-N 0 3 415.622 4.079 20 0 HIADHN O=C(CCCc1ccc([O-])c(F)c1)N1CC[C@@H]2[C@@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000468936364 883001530 /nfs/dbraw/zinc/00/15/30/883001530.db2.gz MFDUMEDESIBZPK-JTHBVZDNSA-N 0 3 410.533 4.367 20 0 HIADHN O=C(CCCc1ccc([O-])c(F)c1)N1CC[C@@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000468936364 883001552 /nfs/dbraw/zinc/00/15/52/883001552.db2.gz MFDUMEDESIBZPK-JTHBVZDNSA-N 0 3 410.533 4.367 20 0 HIADHN CN(C)CCN(CC1CCCCC1)C(=O)c1cc(NC(=O)C(C)(C)C)ccc1F ZINC000463181130 876238481 /nfs/dbraw/zinc/23/84/81/876238481.db2.gz AERGKMNBHCSHGS-UHFFFAOYSA-N 0 3 405.558 4.394 20 0 HIADHN COc1ccc(CN2CCCC[C@@H]2[C@@H]2CCCC[C@H]2O)c(Br)c1OC ZINC000463197109 876255620 /nfs/dbraw/zinc/25/56/20/876255620.db2.gz OKGQJGFZMLIXSJ-GVDBMIGSSA-N 0 3 412.368 4.372 20 0 HIADHN COc1ccc(CN2CCCC[C@@H]2[C@H]2CCCC[C@H]2O)c(Br)c1OC ZINC000463197108 876256752 /nfs/dbraw/zinc/25/67/52/876256752.db2.gz OKGQJGFZMLIXSJ-BRWVUGGUSA-N 0 3 412.368 4.372 20 0 HIADHN CC(=O)NCCN(Cc1ccc(Br)s1)C[C@@H]1C[C@H]1c1ccccc1 ZINC000463199118 876259016 /nfs/dbraw/zinc/25/90/16/876259016.db2.gz GALMOBVKJBGPMR-WMZOPIPTSA-N 0 3 407.377 4.252 20 0 HIADHN C[C@@H]1CC[C@H](O)[C@H]([C@H]2CCCCN2CC(=O)N(Cc2ccco2)c2ccccc2)C1 ZINC000463203538 876264682 /nfs/dbraw/zinc/26/46/82/876264682.db2.gz KTRRSLZPFCTMIX-GOUWZUTHSA-N 0 3 410.558 4.464 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)N[C@H]2CCO[C@@H](c3ccccc3)C2)CC1 ZINC000463256824 876313759 /nfs/dbraw/zinc/31/37/59/876313759.db2.gz GDXAAAZEHSGDDR-LADGPHEKSA-N 0 3 407.558 4.213 20 0 HIADHN CN(CCN(Cc1ccccc1)C(=O)N[C@H]1CCO[C@H](C2CC2)C1)Cc1ccccc1 ZINC000463258648 876316474 /nfs/dbraw/zinc/31/64/74/876316474.db2.gz RCSVNVRBPJVMBA-DQEYMECFSA-N 0 3 421.585 4.288 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N[C@H]1CCCc2cn(C3CCCC3)nc21 ZINC000463280944 876337534 /nfs/dbraw/zinc/33/75/34/876337534.db2.gz UMGJFPMBDVCZAZ-YFXJRYMSSA-N 0 3 421.589 4.195 20 0 HIADHN COC(=O)CCCN1CCC(Nc2ccccc2CN2CCc3ccccc32)CC1 ZINC000463298675 876360633 /nfs/dbraw/zinc/36/06/33/876360633.db2.gz AEZJOSFFVHLOJA-UHFFFAOYSA-N 0 3 407.558 4.079 20 0 HIADHN CC(C)(C)C(=O)Nc1ccc(F)c(C(=O)N[C@H](CN2CCCC2)c2ccccc2)c1 ZINC000463323302 876379813 /nfs/dbraw/zinc/37/98/13/876379813.db2.gz HBPHFBPERHMIMG-OAQYLSRUSA-N 0 3 411.521 4.377 20 0 HIADHN C[C@H](C(=O)N(CCN(C)C)Cc1ccc(F)cc1)c1ccc(Br)s1 ZINC000463508157 876569975 /nfs/dbraw/zinc/56/99/75/876569975.db2.gz CPQGNELDAVLWQM-ZDUSSCGKSA-N 0 3 413.356 4.344 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)N1Cc2ccc(O)cc2C2(CC2)C1 ZINC000463520577 876587853 /nfs/dbraw/zinc/58/78/53/876587853.db2.gz DHMIRBQGQCCEJG-UHFFFAOYSA-N 0 3 423.582 4.063 20 0 HIADHN CCc1ccc(-c2ccc(C(=O)N3CCC(CN4C[C@@H](C)O[C@H](C)C4)CC3)o2)cc1 ZINC000463558316 876644661 /nfs/dbraw/zinc/64/46/61/876644661.db2.gz PBVBHFBIEPTWPA-RTBURBONSA-N 0 3 410.558 4.470 20 0 HIADHN Cc1cc(Br)cc(C(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)c1 ZINC000463568947 876660936 /nfs/dbraw/zinc/66/09/36/876660936.db2.gz KYFIUMVOIRFXOW-IRXDYDNUSA-N 0 3 423.395 4.109 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)[C@H]2C[C@H]2c2cc(F)c(F)c(F)c2)CC1 ZINC000463574069 876670026 /nfs/dbraw/zinc/67/00/26/876670026.db2.gz MFEOVZNXMUTIAI-OALUTQOASA-N 0 3 402.460 4.330 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)[C@@H]3C[C@H]3c3cc(F)c(F)c(F)c3)c2)CC1 ZINC000463595196 876706103 /nfs/dbraw/zinc/70/61/03/876706103.db2.gz LEVRZQKEILZTKP-RBUKOAKNSA-N 0 3 417.475 4.377 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2cccc(-c3ncc4n3CCCC4)c2)[C@H]1c1ccccc1 ZINC000463704401 876823797 /nfs/dbraw/zinc/82/37/97/876823797.db2.gz QGQCZIVJCBORLR-XZOQPEGZSA-N 0 3 415.541 4.453 20 0 HIADHN CN(C)C[C@H](NC(=O)Nc1cccc(-c2ncc3n2CCCC3)c1)c1ccc(F)cc1 ZINC000463708945 876828066 /nfs/dbraw/zinc/82/80/66/876828066.db2.gz CPURCDKWSAMITK-QFIPXVFZSA-N 0 3 421.520 4.450 20 0 HIADHN Cn1ccc(N2CCC[C@H](N[C@H](Cc3ccccc3Cl)c3ccccc3)C2=O)n1 ZINC000463889881 877012755 /nfs/dbraw/zinc/01/27/55/877012755.db2.gz BEMZYFDIFGIXNI-LEWJYISDSA-N 0 3 408.933 4.143 20 0 HIADHN COc1cccc([C@@H](Cc2cc(C)cc(C)c2)N[C@@H](C)C(=O)NCC(F)(F)F)c1 ZINC000463918165 877040054 /nfs/dbraw/zinc/04/00/54/877040054.db2.gz BHVBHBTXRRQSTI-OXJNMPFZSA-N 0 3 408.464 4.252 20 0 HIADHN COc1ccccc1[C@@H](NC(=O)NCCN1CCCCC1)c1ccccc1Cl ZINC000463957037 877080597 /nfs/dbraw/zinc/08/05/97/877080597.db2.gz ARHRDDXFPJFCTB-NRFANRHFSA-N 0 3 401.938 4.223 20 0 HIADHN COc1ccc([C@H](CNC(=O)N[C@@H](c2ncc(C)s2)C2CC2)N2CCCC2)cc1 ZINC000463969832 877095637 /nfs/dbraw/zinc/09/56/37/877095637.db2.gz KDFWZCJADUJHDX-VQTJNVASSA-N 0 3 414.575 4.048 20 0 HIADHN Cc1cc(N2CCC[C@H](N[C@H](C)c3cccc(CO)c3)C2=O)ccc1Br ZINC000464076048 877224149 /nfs/dbraw/zinc/22/41/49/877224149.db2.gz XXQZSFFCPGOHDP-QRWLVFNGSA-N 0 3 417.347 4.096 20 0 HIADHN CCOc1cc2c(cc1[C@@H]1C[C@H]1C(=O)N(CC(C)C)C1CCN(C)CC1)O[C@H](C)C2 ZINC000503239904 912218967 /nfs/dbraw/zinc/21/89/67/912218967.db2.gz LIYYZDIOSIWMDG-PIPMEXSNSA-N 0 3 414.590 4.091 20 0 HIADHN Cc1nn(C)c(Sc2ccccc2)c1C(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C ZINC000464168155 877334393 /nfs/dbraw/zinc/33/43/93/877334393.db2.gz NIBBEIRVCGZVDG-UTKZUKDTSA-N 0 3 420.582 4.130 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1cccc2cccnc21 ZINC000464182322 877353180 /nfs/dbraw/zinc/35/31/80/877353180.db2.gz AGFPVDFMVRXXFH-NRFANRHFSA-N 0 3 411.509 4.439 20 0 HIADHN C[C@H]1C[C@H](c2ccccc2F)N(C(=O)CCCN2CCN(c3ccccc3)CC2)C1 ZINC000464229727 877405772 /nfs/dbraw/zinc/40/57/72/877405772.db2.gz FHCCXHMFOIGSIX-GBXCKJPGSA-N 0 3 409.549 4.338 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)N[C@H]2CCCc3sc(-c4ccc(F)cc4)nc32)CCCN1C ZINC000464314341 877504808 /nfs/dbraw/zinc/50/48/08/877504808.db2.gz WPKHIKRRARBKRA-COXVUDFISA-N 0 3 402.539 4.109 20 0 HIADHN C[C@@H]1[C@H](NC(=O)N[C@H]2CCCc3sc(-c4ccc(F)cc4)nc32)CCCN1C ZINC000464314356 877507111 /nfs/dbraw/zinc/50/71/11/877507111.db2.gz WPKHIKRRARBKRA-XYPHTWIQSA-N 0 3 402.539 4.109 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N3CC[C@H](CSc4ccccc4)C3)cc2)CC1 ZINC000464332731 877523382 /nfs/dbraw/zinc/52/33/82/877523382.db2.gz HGFDLOIDFKKPPH-NRFANRHFSA-N 0 3 423.626 4.471 20 0 HIADHN Cc1nn(C)c(Sc2ccccc2)c1C(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000464402115 877603938 /nfs/dbraw/zinc/60/39/38/877603938.db2.gz XIGKVQDUTUDZCT-FQEVSTJZSA-N 0 3 420.582 4.226 20 0 HIADHN COc1ccccc1S(=O)(=O)CCCN[C@H](C)c1ccccc1C(F)(F)F ZINC000464490267 877709262 /nfs/dbraw/zinc/70/92/62/877709262.db2.gz LHYGZKSIXIAKDV-CQSZACIVSA-N 0 3 401.450 4.229 20 0 HIADHN CC(C)CN(C(=O)c1cc2sc(N3CCCC3)nc2s1)C1CCN(C)CC1 ZINC000464575033 877797210 /nfs/dbraw/zinc/79/72/10/877797210.db2.gz MCSDWABEUISBEX-UHFFFAOYSA-N 0 3 406.621 4.150 20 0 HIADHN Cc1cc(C(=O)N(CC(C)C)C2CCN(C)CC2)nc(-c2ccc(Cl)cc2)n1 ZINC000464579882 877803064 /nfs/dbraw/zinc/80/30/64/877803064.db2.gz XQLDYBHZJQLTKQ-UHFFFAOYSA-N 0 3 400.954 4.298 20 0 HIADHN O=C(CN(CCCOc1ccccc1)C1CCOCC1)N[C@H]1CCCc2ccccc21 ZINC000464585516 877810984 /nfs/dbraw/zinc/81/09/84/877810984.db2.gz DWDWMCRDCCHQBL-VWLOTQADSA-N 0 3 422.569 4.130 20 0 HIADHN C/C=C\c1ccc(OC[C@H](O)CN[C@@H](C)c2cn(C(C)(C)C)nc2C)c(OC)c1 ZINC000464600013 877827541 /nfs/dbraw/zinc/82/75/41/877827541.db2.gz FNHJPIQJPFTCFO-KJYTYGLYSA-N 0 3 401.551 4.079 20 0 HIADHN COc1ccccc1S(=O)(=O)CCCNC1(c2cccc(C(F)(F)F)c2)CC1 ZINC000464682857 877898255 /nfs/dbraw/zinc/89/82/55/877898255.db2.gz JTRJNAIYXIIDLF-UHFFFAOYSA-N 0 3 413.461 4.157 20 0 HIADHN COCCCN(C(=O)c1ccc(Oc2ccc(F)cc2F)cc1)C1CCN(C)CC1 ZINC000464714929 877940807 /nfs/dbraw/zinc/94/08/07/877940807.db2.gz SKFXVRUXZRXDSN-UHFFFAOYSA-N 0 3 418.484 4.330 20 0 HIADHN CCCN(CC(F)(F)F)C(=O)[C@@H]1CCCN(Cc2ccccc2OC(C)C)C1 ZINC000464726674 877960160 /nfs/dbraw/zinc/96/01/60/877960160.db2.gz AOBLCXUVZPSBPV-GOSISDBHSA-N 0 3 400.485 4.487 20 0 HIADHN CC[C@@H]1CCCCN1CCNC(=O)C(=O)Nc1ccccc1Sc1ccccc1 ZINC000503325997 912304865 /nfs/dbraw/zinc/30/48/65/912304865.db2.gz PVTMWUNMBJCABJ-GOSISDBHSA-N 0 3 411.571 4.157 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)NCC(C)(C)Cc2cccc(Cl)c2)CC1 ZINC000464754611 877994047 /nfs/dbraw/zinc/99/40/47/877994047.db2.gz UPALESKGWIEXTP-UHFFFAOYSA-N 0 3 410.002 4.097 20 0 HIADHN Cc1c(NC(=O)[C@@H](C)N2CCCC3(C2)CCCCCC3)c(=O)n(-c2ccccc2)n1C ZINC000464766024 878006120 /nfs/dbraw/zinc/00/61/20/878006120.db2.gz RSWPSACROJAXPZ-HXUWFJFHSA-N 0 3 424.589 4.248 20 0 HIADHN CCN(CC(=O)Nc1ccc(OC)cc1OC)[C@H](Cc1ccc(F)cc1)C(C)C ZINC000464767000 878010175 /nfs/dbraw/zinc/01/01/75/878010175.db2.gz BLUTXSNTOJCSRD-OAQYLSRUSA-N 0 3 402.510 4.371 20 0 HIADHN CCS[C@@H]1CC[C@@H](N(C)CC(=O)N2CCC[C@@H]2c2ccc3c(c2)OCCCO3)C1 ZINC000464777274 878020121 /nfs/dbraw/zinc/02/01/21/878020121.db2.gz UZYGQJMIMSJZDH-VAMGGRTRSA-N 0 3 418.603 4.117 20 0 HIADHN CC(C)[C@H](Cc1ccc(F)cc1)N(C)CC(=O)Nc1ccccc1N1CCCC1=O ZINC000464784357 878031247 /nfs/dbraw/zinc/03/12/47/878031247.db2.gz DMFCETWNURMUQT-QFIPXVFZSA-N 0 3 411.521 4.090 20 0 HIADHN CC(C)[C@H](Cc1ccc(F)cc1)N(C)CC(=O)Nc1ccc2c(c1)OCCCO2 ZINC000464791889 878038546 /nfs/dbraw/zinc/03/85/46/878038546.db2.gz NVRRRKDSHVIBTI-FQEVSTJZSA-N 0 3 400.494 4.125 20 0 HIADHN CCOc1cccc(CNC(=O)NC[C@H](c2ccc(C)cc2)N(C)C)c1OC(F)F ZINC000464804197 878047126 /nfs/dbraw/zinc/04/71/26/878047126.db2.gz DDOGLNLAMCIMCM-GOSISDBHSA-N 0 3 421.488 4.097 20 0 HIADHN C[C@@H](C(=O)N1CCC[C@H]1c1cccs1)N1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC000464839510 878105249 /nfs/dbraw/zinc/10/52/49/878105249.db2.gz PWILBTDEGAWYKK-URVUXULASA-N 0 3 411.615 4.397 20 0 HIADHN COC(=O)c1ccc(CN2CCC[C@H](c3nc(-c4cccc(F)c4)no3)C2)cc1F ZINC000464864615 878147938 /nfs/dbraw/zinc/14/79/38/878147938.db2.gz PWKQXZFKJIZENG-INIZCTEOSA-N 0 3 413.424 4.181 20 0 HIADHN COC(=O)c1cc(CNC2(c3ccc(Br)cc3)CCOCC2)c(C)s1 ZINC000464866337 878150895 /nfs/dbraw/zinc/15/08/95/878150895.db2.gz DIEIVBIVKWOOSQ-UHFFFAOYSA-N 0 3 424.360 4.401 20 0 HIADHN C[C@@H]1CCN(C(=O)c2cccc(NC(=O)c3ccco3)c2)CCN1Cc1ccccc1 ZINC000464893475 878196906 /nfs/dbraw/zinc/19/69/06/878196906.db2.gz MNGYPVKQOAMNEZ-LJQANCHMSA-N 0 3 417.509 4.269 20 0 HIADHN Cc1cc(Br)ccc1C(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1 ZINC000464897142 878202456 /nfs/dbraw/zinc/20/24/56/878202456.db2.gz SFMQPURFQCSCKB-KRWDZBQOSA-N 0 3 401.348 4.494 20 0 HIADHN Cc1ccc(-c2nc(CC(=O)N3CC[C@@H](C)N(Cc4ccccc4)CC3)cs2)o1 ZINC000464897090 878203068 /nfs/dbraw/zinc/20/30/68/878203068.db2.gz FIJTUMRWYCNSSR-QGZVFWFLSA-N 0 3 409.555 4.377 20 0 HIADHN Cc1nc2cc(F)cc(C(=O)N3CC[C@@H](C)N(Cc4ccccc4)CC3)c2nc1C ZINC000464898764 878206179 /nfs/dbraw/zinc/20/61/79/878206179.db2.gz YSASOMAIJUEXNR-MRXNPFEDSA-N 0 3 406.505 4.122 20 0 HIADHN CCN(Cc1cnn(C)c1C(F)(F)F)C1CCN(c2cc(C)nc(C(C)C)n2)CC1 ZINC000464898388 878206292 /nfs/dbraw/zinc/20/62/92/878206292.db2.gz UXTYAUKFHGJQLE-UHFFFAOYSA-N 0 3 424.515 4.152 20 0 HIADHN CCOc1ccccc1OCCCC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1 ZINC000464904927 878218567 /nfs/dbraw/zinc/21/85/67/878218567.db2.gz BGFQEVOSMPWCQM-NRFANRHFSA-N 0 3 410.558 4.367 20 0 HIADHN COc1c(Br)cc(Br)cc1CNC[C@H](OC)C(C)(C)C ZINC000465021458 878384954 /nfs/dbraw/zinc/38/49/54/878384954.db2.gz UEGPXWBGHDLKID-ZDUSSCGKSA-N 0 3 409.162 4.371 20 0 HIADHN COc1cccc([C@H](CNC(=O)CCc2c[nH]c3cc(C)ccc23)N2CCCC2)c1 ZINC000465053079 878416277 /nfs/dbraw/zinc/41/62/77/878416277.db2.gz OTFVJVJAAZSTES-DEOSSOPVSA-N 0 3 405.542 4.371 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)c1cccc2cnccc21 ZINC000465178811 878566399 /nfs/dbraw/zinc/56/63/99/878566399.db2.gz XUIQOSSSMAQOOI-UHFFFAOYSA-N 0 3 401.432 4.458 20 0 HIADHN Cc1nc(C)c(NC(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)s1 ZINC000465239591 878658044 /nfs/dbraw/zinc/65/80/44/878658044.db2.gz GTRRILZTIJVGDY-UHFFFAOYSA-N 0 3 400.470 4.374 20 0 HIADHN O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N(Cc1ccc2c(c1)CCO2)C1CCCC1 ZINC000465428017 878858144 /nfs/dbraw/zinc/85/81/44/878858144.db2.gz DCPOCEXZCGXKFF-HSZRJFAPSA-N 0 3 419.569 4.350 20 0 HIADHN CO[C@H](CNC(=O)NC[C@@H](c1cccs1)N1CCCC1)c1cccc(Cl)c1 ZINC000465432439 878863787 /nfs/dbraw/zinc/86/37/87/878863787.db2.gz XEDMOPOJNKJAHJ-ZWKOTPCHSA-N 0 3 407.967 4.225 20 0 HIADHN C[C@@H](CCc1cccn1C)NC(=O)NC[C@H](c1cccs1)N1CCC(C)CC1 ZINC000465433755 878864721 /nfs/dbraw/zinc/86/47/21/878864721.db2.gz OFIXXLIXJAGEQH-AZUAARDMSA-N 0 3 402.608 4.180 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)N1CC[C@@H](COCc2ccccc2)C1 ZINC000465436980 878870048 /nfs/dbraw/zinc/87/00/48/878870048.db2.gz FBOWUBLYGSRHCW-VWNXMTODSA-N 0 3 407.558 4.072 20 0 HIADHN CO[C@H](CNC(=O)NC[C@H](c1ccccc1)N1CCCC1)c1ccc(Cl)cc1 ZINC000465439376 878871149 /nfs/dbraw/zinc/87/11/49/878871149.db2.gz FUHZEFZSKKYQAL-NHCUHLMSSA-N 0 3 401.938 4.164 20 0 HIADHN CC[C@@H](NC(=O)NC[C@@H](Cc1ccccc1)N(C)C)c1nc(C(F)(F)F)cs1 ZINC000465440348 878871489 /nfs/dbraw/zinc/87/14/89/878871489.db2.gz ZWVVBBPSIIOMPY-HUUCEWRRSA-N 0 3 414.497 4.085 20 0 HIADHN Cc1ccc(CCN(C[C@@H]2CCCO2)C(=O)NC[C@@H](c2ccccc2)N(C)C)cc1 ZINC000465454150 878885054 /nfs/dbraw/zinc/88/50/54/878885054.db2.gz LYTCAXXKKXUOTK-ZEQRLZLVSA-N 0 3 409.574 4.031 20 0 HIADHN C[C@@H]1CCN(C(=O)NCc2cccnc2OC2CCCC2)CCN1Cc1ccccc1 ZINC000465510175 878949633 /nfs/dbraw/zinc/94/96/33/878949633.db2.gz BIROWWQMBORKLK-HXUWFJFHSA-N 0 3 422.573 4.209 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@H]1C[C@@]1(C)c1ccccc1OC)c1ccsc1 ZINC000465526566 878979527 /nfs/dbraw/zinc/97/95/27/878979527.db2.gz OVORBMRELNRPAL-CBQOVEMMSA-N 0 3 401.576 4.169 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCc1cc(OC)nc2ccccc12)c1ccsc1 ZINC000465528238 878981739 /nfs/dbraw/zinc/98/17/39/878981739.db2.gz JMAGGQLHTVXOPR-HXUWFJFHSA-N 0 3 412.559 4.187 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NC[C@@H](OC)c1ccc(Cl)cc1)c1ccsc1 ZINC000465529708 878983669 /nfs/dbraw/zinc/98/36/69/878983669.db2.gz XKJSUBQGYYWDOH-RBUKOAKNSA-N 0 3 409.983 4.471 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NC[C@H](OC)c1ccc(Cl)cc1)c1ccsc1 ZINC000465529706 878984102 /nfs/dbraw/zinc/98/41/02/878984102.db2.gz XKJSUBQGYYWDOH-MOPGFXCFSA-N 0 3 409.983 4.471 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1C[C@@H](C)O[C@H](c2ccc(F)cc2)C1)c1ccsc1 ZINC000465534463 878993962 /nfs/dbraw/zinc/99/39/62/878993962.db2.gz QUIBLSJILREHKE-HBGVWJBISA-N 0 3 419.566 4.442 20 0 HIADHN Cc1ccc([C@@H]2CCCCN2C(=O)NCc2ccc(CN3CCN(C)CC3)cc2)cc1 ZINC000465549197 879012355 /nfs/dbraw/zinc/01/23/55/879012355.db2.gz JPXKVUYNJBQROU-VWLOTQADSA-N 0 3 420.601 4.179 20 0 HIADHN CC(=O)Nc1cccc([C@@H](C)NC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)c1 ZINC000465563379 879034965 /nfs/dbraw/zinc/03/49/65/879034965.db2.gz GQBGVYPEQVRHJD-RBUKOAKNSA-N 0 3 408.546 4.012 20 0 HIADHN CC(C)C(=O)Nc1ccc(CNC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)cc1 ZINC000465575550 879050426 /nfs/dbraw/zinc/05/04/26/879050426.db2.gz QKAOIMBKHWDWPS-FQEVSTJZSA-N 0 3 422.573 4.087 20 0 HIADHN CO[C@H](CNC(=O)N[C@@H](CN1CCCC1)c1ccccc1)c1cccc(Cl)c1 ZINC000465609351 879104111 /nfs/dbraw/zinc/10/41/11/879104111.db2.gz UCRXTRMWMOCXRE-LEWJYISDSA-N 0 3 401.938 4.164 20 0 HIADHN C[C@H]1CCN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)[C@H](c2ccco2)C1 ZINC000465670247 879206240 /nfs/dbraw/zinc/20/62/40/879206240.db2.gz WWTPVOBVURPINW-GMAHTHKFSA-N 0 3 424.589 4.365 20 0 HIADHN Cc1ccc(-c2nc(CNC(=O)NCC(C)(C)N3CCc4ccccc4C3)co2)cc1 ZINC000465686607 879235225 /nfs/dbraw/zinc/23/52/25/879235225.db2.gz DWHIBXODWFHDTD-UHFFFAOYSA-N 0 3 418.541 4.286 20 0 HIADHN CCO[C@H](C)c1nc(CN(C)C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)cs1 ZINC000465688684 879239446 /nfs/dbraw/zinc/23/94/46/879239446.db2.gz JKHPWMMICOOEDD-MJGOQNOKSA-N 0 3 416.591 4.047 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N2C[C@@H](C)O[C@@H](c3ccc(F)cc3)C2)C1 ZINC000465741930 879327352 /nfs/dbraw/zinc/32/73/52/879327352.db2.gz ADCCJUMNJJCFCW-DPZOUVDISA-N 0 3 411.521 4.133 20 0 HIADHN Cc1ccc(-c2nc(CNC(=O)N[C@H]3CCN([C@H](C)c4ccccc4)C3)co2)cc1 ZINC000465756531 879348914 /nfs/dbraw/zinc/34/89/14/879348914.db2.gz OAOKMNBLEVRFSS-NQIIRXRSSA-N 0 3 404.514 4.285 20 0 HIADHN CO[C@H](CNC(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1)c1cccc(Cl)c1 ZINC000465761295 879356713 /nfs/dbraw/zinc/35/67/13/879356713.db2.gz QNBMBHIDEQJQQG-MAODMQOUSA-N 0 3 401.938 4.162 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N(Cc2ccc(O)cc2)CC2CC2)N2CCCC2)cc1 ZINC000465825460 879455988 /nfs/dbraw/zinc/45/59/88/879455988.db2.gz FJQZDVDSTUVHTG-XMMPIXPASA-N 0 3 407.558 4.459 20 0 HIADHN Cc1cccc(Oc2ccccc2CNC(=O)N(CCN(C)C)C[C@@H]2CCCO2)c1 ZINC000465865809 879514854 /nfs/dbraw/zinc/51/48/54/879514854.db2.gz SCPRDNGRIWGSGA-QFIPXVFZSA-N 0 3 411.546 4.040 20 0 HIADHN Cc1cnc([C@@H](NC(=O)NCC2(N3CCOC(C)(C)C3)CCCCC2)C2CC2)s1 ZINC000465865961 879516425 /nfs/dbraw/zinc/51/64/25/879516425.db2.gz DZDKHUFPXHJWTR-SFHVURJKSA-N 0 3 420.623 4.016 20 0 HIADHN C[C@@H]1CCN(C(=O)NCCc2nc(C(C)(C)C)cs2)CCN1Cc1ccccc1 ZINC000465870145 879522415 /nfs/dbraw/zinc/52/24/15/879522415.db2.gz QTSZCCBDHVVVTA-GOSISDBHSA-N 0 3 414.619 4.289 20 0 HIADHN Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)NC(=O)N1CC[C@H](N2CC=CC2)C1 ZINC000465912525 879575488 /nfs/dbraw/zinc/57/54/88/879575488.db2.gz UPLOUEJLVUCGHG-YJBOKZPZSA-N 0 3 416.978 4.489 20 0 HIADHN Cc1c2ccccc2oc1[C@@H](NC(=O)N(CCN(C)C)C[C@@H]1CCCO1)C(C)C ZINC000465924709 879587709 /nfs/dbraw/zinc/58/77/09/879587709.db2.gz SLDPYRJKNQPKPL-RXVVDRJESA-N 0 3 401.551 4.191 20 0 HIADHN CCO[C@@H](C)c1nc(CN(C)C(=O)NC[C@H]2CCCN2Cc2ccccc2)cs1 ZINC000465931513 879595736 /nfs/dbraw/zinc/59/57/36/879595736.db2.gz NRXJESSXNWOIQL-FXAWDEMLSA-N 0 3 416.591 4.047 20 0 HIADHN Cc1cccc(COc2ccc([C@@H](C)NC(=O)N3CC[C@@H](N4CC=CC4)C3)cc2)c1 ZINC000465953517 879620631 /nfs/dbraw/zinc/62/06/31/879620631.db2.gz QBKJJEYYXSACRV-NFBKMPQASA-N 0 3 405.542 4.291 20 0 HIADHN COc1ccc([C@@H](CNC(=O)Nc2cccc(-c3noc(C)n3)c2)N2CCCC2)cc1 ZINC000503457175 912484284 /nfs/dbraw/zinc/48/42/84/912484284.db2.gz CVPHFYJXAARGKT-OAQYLSRUSA-N 0 3 421.501 4.012 20 0 HIADHN COc1ccccc1[C@]1(C)C[C@H]1NC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C ZINC000466046372 879736281 /nfs/dbraw/zinc/73/62/81/879736281.db2.gz FTPFOJSTOOSEAB-NIDLKEISSA-N 0 3 407.558 4.031 20 0 HIADHN COc1ccccc1[C@@H](NC(=O)N1CCN(C)CC[C@H]1C)c1ccccc1Cl ZINC000466079032 879794108 /nfs/dbraw/zinc/79/41/08/879794108.db2.gz OHHJVRDLEGFQDX-IERDGZPVSA-N 0 3 401.938 4.174 20 0 HIADHN CO[C@H](CNC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C)c1ccc(Cl)cc1 ZINC000466081055 879799911 /nfs/dbraw/zinc/79/99/11/879799911.db2.gz HMWUXHXDAGKUOA-XMSQKQJNSA-N 0 3 415.965 4.334 20 0 HIADHN CO[C@@H](CNC(=O)N(CCN(C)C)Cc1cccc(C)c1)c1ccc(Cl)cc1 ZINC000466090794 879809484 /nfs/dbraw/zinc/80/94/84/879809484.db2.gz KXALFLBXHUIPGT-NRFANRHFSA-N 0 3 403.954 4.109 20 0 HIADHN CO[C@H](CNC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1)c1ccc(Cl)cc1 ZINC000466092263 879810716 /nfs/dbraw/zinc/81/07/16/879810716.db2.gz NEJMIGBPEOQLRP-XMSQKQJNSA-N 0 3 415.965 4.334 20 0 HIADHN COc1ccccc1[C@@H](NC(=O)N(C)[C@H]1CCN(C2CC2)C1)c1ccccc1Cl ZINC000466095462 879814129 /nfs/dbraw/zinc/81/41/29/879814129.db2.gz FGXSHLTYXIWZGE-JTSKRJEESA-N 0 3 413.949 4.316 20 0 HIADHN COc1ccccc1[C@H](NC(=O)N(C)[C@@H]1CCN(C2CC2)C1)c1ccccc1Cl ZINC000466095465 879814236 /nfs/dbraw/zinc/81/42/36/879814236.db2.gz FGXSHLTYXIWZGE-VGOFRKELSA-N 0 3 413.949 4.316 20 0 HIADHN Cc1cc(C)cc(Oc2ccc(NC(=O)NC[C@H](C)CN3CCN(C)CC3)cc2)c1 ZINC000466134916 879846818 /nfs/dbraw/zinc/84/68/18/879846818.db2.gz HPBIUKURAPEYFG-FQEVSTJZSA-N 0 3 410.562 4.101 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)N[C@@H](c1ccccc1)c1cccnc1 ZINC000503471834 912508223 /nfs/dbraw/zinc/50/82/23/912508223.db2.gz IWIXSWMRDTVNSR-ZEQRLZLVSA-N 0 3 400.526 4.307 20 0 HIADHN CC[C@H](C)C(=O)Nc1cccc(CNC(=O)N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)c1 ZINC000466214164 879905679 /nfs/dbraw/zinc/90/56/79/879905679.db2.gz APRDLLJRVMCCST-YCRNBWNJSA-N 0 3 422.573 4.133 20 0 HIADHN CC[C@H](C)C(=O)Nc1cccc(CNC(=O)N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)c1 ZINC000466214166 879906728 /nfs/dbraw/zinc/90/67/28/879906728.db2.gz APRDLLJRVMCCST-YYDVJCTNSA-N 0 3 422.573 4.133 20 0 HIADHN Cc1nc(-c2ccc(CNC(=O)N[C@@H]3C[C@@H](C)N(Cc4ccccc4)C3)o2)cs1 ZINC000466253323 879975459 /nfs/dbraw/zinc/97/54/59/879975459.db2.gz OPBZWNCGTWZRQS-CRAIPNDOSA-N 0 3 410.543 4.174 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)N[C@@H](c2nccs2)c2ccccc2)CN1Cc1ccccc1 ZINC000466267478 880001361 /nfs/dbraw/zinc/00/13/61/880001361.db2.gz HNBRFKZCZMDEAK-DUXKGJEZSA-N 0 3 406.555 4.195 20 0 HIADHN Cc1ccccc1[C@H]1C[C@H](NC(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)C1 ZINC000466381511 880141839 /nfs/dbraw/zinc/14/18/39/880141839.db2.gz SPIBSOSCWONVER-SQOUVECCSA-N 0 3 413.606 4.162 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2cccc3ccsc32)cc1)[C@@H]1CCCN(C)C1 ZINC000466435337 880210853 /nfs/dbraw/zinc/21/08/53/880210853.db2.gz SCVFXZQOYBDZDA-LJQANCHMSA-N 0 3 407.539 4.320 20 0 HIADHN COc1ccc([C@@H](CNC(=O)Nc2cccc(N3CCCC3)c2)N2CCCC2)cc1 ZINC000503498670 912545132 /nfs/dbraw/zinc/54/51/32/912545132.db2.gz NJDHDPPXQJYEHJ-HSZRJFAPSA-N 0 3 408.546 4.254 20 0 HIADHN O=C1N[C@]2(CCN(Cc3ccccc3)C2)C(=O)N1Cc1ccc(-c2ccccc2)cc1 ZINC000466478317 880259986 /nfs/dbraw/zinc/25/99/86/880259986.db2.gz ZHETXPDQXWHCNB-SANMLTNESA-N 0 3 411.505 4.050 20 0 HIADHN CC(C)CC(=O)Nc1ccc(NC(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)cc1 ZINC000466518147 880293847 /nfs/dbraw/zinc/29/38/47/880293847.db2.gz LKVMINTXVVFLIM-PGRDOPGGSA-N 0 3 408.546 4.456 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)N2CC=C(c3c[nH]c4ncccc34)CC2)CN1Cc1ccccc1 ZINC000466519266 880294709 /nfs/dbraw/zinc/29/47/09/880294709.db2.gz PJFJJLUXCBFUSU-WIYYLYMNSA-N 0 3 415.541 4.025 20 0 HIADHN Cc1ccc(NC(=O)C2CC2)cc1NC(=O)N[C@H]1C[C@H](C)N(Cc2ccccc2)C1 ZINC000466518630 880295594 /nfs/dbraw/zinc/29/55/94/880295594.db2.gz ZABUGDXHRQSFCC-UWJYYQICSA-N 0 3 406.530 4.128 20 0 HIADHN Cc1cccc(C(=O)N2CCCC2)c1NC(=O)N[C@H]1C[C@@H](C)N(Cc2ccccc2)C1 ZINC000466522201 880298726 /nfs/dbraw/zinc/29/87/26/880298726.db2.gz JTSAPKKVOOPEKM-CTNGQTDRSA-N 0 3 420.557 4.016 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)N2CCC(c3c[nH]c4ncccc34)CC2)CN1Cc1ccccc1 ZINC000466523151 880300261 /nfs/dbraw/zinc/30/02/61/880300261.db2.gz UFVVJMXRWNTDEG-GHTZIAJQSA-N 0 3 417.557 4.115 20 0 HIADHN C[C@H]1C[C@H](NC(=O)N(C)Cc2ccc(OC(F)F)cc2)CN1Cc1ccccc1 ZINC000466526954 880302696 /nfs/dbraw/zinc/30/26/96/880302696.db2.gz KXPBNXRFDQXFGK-LPHOPBHVSA-N 0 3 403.473 4.092 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)Nc2ccccc2N2C[C@@H](C)O[C@@H](C)C2)CN1Cc1ccccc1 ZINC000466530051 880305799 /nfs/dbraw/zinc/30/57/99/880305799.db2.gz UMONKAQYRHXBOK-ITTUMRLJSA-N 0 3 422.573 4.085 20 0 HIADHN CCCN(C(=O)NCC1(CC)CCOCC1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000466628598 880400577 /nfs/dbraw/zinc/40/05/77/880400577.db2.gz XZPXMAJQMVVJSM-JOCHJYFZSA-N 0 3 401.595 4.279 20 0 HIADHN CC(C)C[C@@H]1CCCCN1CC(=O)N(C)CC(=O)Nc1ccccc1C(F)(F)F ZINC000466692401 880482098 /nfs/dbraw/zinc/48/20/98/880482098.db2.gz ROHKUGBVJOZAJG-INIZCTEOSA-N 0 3 413.484 4.003 20 0 HIADHN CCc1c(NC(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)cnn1-c1ccccc1 ZINC000466716362 880506387 /nfs/dbraw/zinc/50/63/87/880506387.db2.gz HAYBYJWETSKRQQ-UYAOXDASSA-N 0 3 403.530 4.392 20 0 HIADHN CC[C@@H]1C[C@H](C(=O)Nc2cccc(N3CCN(CCc4ccccc4)CC3)c2)CCO1 ZINC000503528917 912583146 /nfs/dbraw/zinc/58/31/46/912583146.db2.gz WVRMYIAAMLVOLX-RCZVLFRGSA-N 0 3 421.585 4.195 20 0 HIADHN Cc1noc(C2CC2)c1NC(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1 ZINC000466924612 880692635 /nfs/dbraw/zinc/69/26/35/880692635.db2.gz RHVCGFJWNUMILR-UHFFFAOYSA-N 0 3 410.440 4.475 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@H]2CNC(=O)N(CCN(C)C)Cc2ccccc2)cc1 ZINC000466949785 880726012 /nfs/dbraw/zinc/72/60/12/880726012.db2.gz FMWOTRCUPYFIEI-ZEQRLZLVSA-N 0 3 409.574 4.236 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)NCc1ccc(-c2cccnc2)cc1 ZINC000466951524 880728718 /nfs/dbraw/zinc/72/87/18/880728718.db2.gz AIANHWLVPNJPPA-UHFFFAOYSA-N 0 3 424.495 4.300 20 0 HIADHN C[C@@H](NC(=O)N[C@@H](CN(C)C)c1ccc(F)cc1)c1ccc(Br)cc1 ZINC000503541236 912600430 /nfs/dbraw/zinc/60/04/30/912600430.db2.gz GHXMQSYUGRJBOI-ACJLOTCBSA-N 0 3 408.315 4.251 20 0 HIADHN COCc1ccc([C@@H]2CCCN2CCC(=O)Nc2ccccc2Br)o1 ZINC000467022987 880823983 /nfs/dbraw/zinc/82/39/83/880823983.db2.gz JZYFDEYISPQQOK-KRWDZBQOSA-N 0 3 407.308 4.354 20 0 HIADHN C[C@H]1C[C@H](NC(=O)C2(c3ccc(Cl)cc3)CCOCC2)CN1Cc1ccccc1 ZINC000467024632 880825222 /nfs/dbraw/zinc/82/52/22/880825222.db2.gz PLIPQYCEQMLARQ-AVRDEDQJSA-N 0 3 412.961 4.167 20 0 HIADHN C[C@H](C(=O)N[C@H]1C[C@H](C)N(Cc2ccccc2)C1)c1ccc(Br)s1 ZINC000467024871 880826247 /nfs/dbraw/zinc/82/62/47/880826247.db2.gz QYHCCNGYEZZGKJ-DZKIICNBSA-N 0 3 407.377 4.393 20 0 HIADHN Cc1noc(CSc2ccc(C(=O)N[C@H]3C[C@H](C)N(Cc4ccccc4)C3)cc2)n1 ZINC000467033725 880832135 /nfs/dbraw/zinc/83/21/35/880832135.db2.gz NIJKKTLEWYHXNP-JXFKEZNVSA-N 0 3 422.554 4.063 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(C)c1C(=O)N[C@@H]1C[C@@H](C)N(Cc2ccccc2)C1 ZINC000467035329 880833634 /nfs/dbraw/zinc/83/36/34/880833634.db2.gz UTYUDIAEBNGWMD-IIBYNOLFSA-N 0 3 406.505 4.021 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)[C@@H]2C[C@@H]2c2ccccc2OC(F)F)CN1Cc1ccccc1 ZINC000467044486 880839628 /nfs/dbraw/zinc/83/96/28/880839628.db2.gz JFVFIRAXHDOUCR-MCYKXBRJSA-N 0 3 400.469 4.171 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)c2cccc(OCc3cscn3)c2)CN1Cc1ccccc1 ZINC000467052671 880842944 /nfs/dbraw/zinc/84/29/44/880842944.db2.gz AUXCEEPFELUATP-YLJYHZDGSA-N 0 3 407.539 4.115 20 0 HIADHN Cc1cccc(-c2nc(CC(=O)N[C@@H]3C[C@@H](C)N(Cc4ccccc4)C3)cs2)c1 ZINC000467054368 880844170 /nfs/dbraw/zinc/84/41/70/880844170.db2.gz SFRCJNZKQDSLBO-WIYYLYMNSA-N 0 3 405.567 4.440 20 0 HIADHN C[C@H](NC(=O)N(CCN(C)C)Cc1cccc(F)c1)c1nc(C2CCCCC2)no1 ZINC000467056172 880844869 /nfs/dbraw/zinc/84/48/69/880844869.db2.gz GNJLMXIIKXHONG-INIZCTEOSA-N 0 3 417.529 4.091 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)NCc1nc(-c2ccccc2F)cs1 ZINC000503550813 912618247 /nfs/dbraw/zinc/61/82/47/912618247.db2.gz IZUYESWESORBKY-UHFFFAOYSA-N 0 3 404.555 4.357 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cnc(C)nc1C1CC1)c1ccc(C(F)(F)F)cc1 ZINC000467152149 880888889 /nfs/dbraw/zinc/88/88/89/880888889.db2.gz OGONNWRIGVXABK-IBGZPJMESA-N 0 3 420.479 4.494 20 0 HIADHN COc1ccc(C(C)(C)C(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)cc1OC ZINC000467203479 880932838 /nfs/dbraw/zinc/93/28/38/880932838.db2.gz ADVRCWITHHWOQD-IBGZPJMESA-N 0 3 410.558 4.104 20 0 HIADHN Cc1ccc(-c2cncc(C(=O)N(C)C3CCN(CCc4ccccn4)CC3)c2)cc1 ZINC000467259495 880994780 /nfs/dbraw/zinc/99/47/80/880994780.db2.gz BVYQVGACUCSXOB-UHFFFAOYSA-N 0 3 414.553 4.231 20 0 HIADHN COC[C@@H]1CCCCN(CC(=O)N[C@@H](c2ccccc2)c2cccc(Cl)c2)C1 ZINC000467275440 881018443 /nfs/dbraw/zinc/01/84/43/881018443.db2.gz PVNHVLTVSPZZQP-JPYJTQIMSA-N 0 3 400.950 4.294 20 0 HIADHN COCCOc1ccc([C@@H](C)NCc2cc(Cl)ccc2N2CCOCC2)cc1 ZINC000467334131 881083135 /nfs/dbraw/zinc/08/31/35/881083135.db2.gz FYJSAOQDBZIKQR-QGZVFWFLSA-N 0 3 404.938 4.053 20 0 HIADHN Cc1cc(CN[C@@H](C)c2ccc3c(c2)OCCO3)ccc1I ZINC000467369874 881142270 /nfs/dbraw/zinc/14/22/70/881142270.db2.gz MQFMSLMWQGXONO-ZDUSSCGKSA-N 0 3 409.267 4.222 20 0 HIADHN COc1cc(C)c([C@@H](C)NCc2cc(Cl)ccc2N2CCOCC2)cc1OC ZINC000467380159 881158325 /nfs/dbraw/zinc/15/83/25/881158325.db2.gz CPLVKVGTRIUVCI-MRXNPFEDSA-N 0 3 404.938 4.353 20 0 HIADHN C[C@@H](CCN[C@H]1CCS(=O)(=O)c2ccc(Br)cc21)c1ccccc1 ZINC000467401627 881184892 /nfs/dbraw/zinc/18/48/92/881184892.db2.gz AXGWEAGVKSURBN-KSSFIOAISA-N 0 3 408.361 4.451 20 0 HIADHN CCS(=O)(=O)c1cccc(CN[C@@H](C)CC(=O)Nc2ccc(C(C)C)cc2)c1 ZINC000467417797 881206569 /nfs/dbraw/zinc/20/65/69/881206569.db2.gz HNOIDKFBYDOXPR-KRWDZBQOSA-N 0 3 402.560 4.111 20 0 HIADHN O[C@H]1Cc2ccccc2[C@H]1N[C@H](c1cccc(Br)c1)C1CCOCC1 ZINC000467419477 881209056 /nfs/dbraw/zinc/20/90/56/881209056.db2.gz QLGDFLBEWYUUPV-PCCBWWKXSA-N 0 3 402.332 4.165 20 0 HIADHN COc1ccc2c(c1)[C@@H](N[C@@H](C)c1cc(F)ccc1N1CCN(C)CC1)CCS2 ZINC000467422238 881210389 /nfs/dbraw/zinc/21/03/89/881210389.db2.gz ZJOVUSCPFSVAAN-KKSFZXQISA-N 0 3 415.578 4.474 20 0 HIADHN C[C@H]1CN(CCCCNC(=O)C(Cc2ccccc2)Cc2ccccc2)C[C@H](C)O1 ZINC000467427798 881218742 /nfs/dbraw/zinc/21/87/42/881218742.db2.gz HYJWIWJFMXTGIS-VXKWHMMOSA-N 0 3 408.586 4.094 20 0 HIADHN CC(C)(C)OC(=O)Cc1ccccc1NC(=O)N1CCN(CC2CCCCC2)CC1 ZINC000467428784 881220623 /nfs/dbraw/zinc/22/06/23/881220623.db2.gz IRYMJXMJEPJUKC-UHFFFAOYSA-N 0 3 415.578 4.301 20 0 HIADHN Cc1nc(-c2cccnc2)sc1[C@H](C)N[C@@H]1CC(=O)N(Cc2ccccc2)[C@H]1C ZINC000467440699 881241900 /nfs/dbraw/zinc/24/19/00/881241900.db2.gz WMSCRCKDNUJVPE-RIFZZMRRSA-N 0 3 406.555 4.354 20 0 HIADHN COc1cc([C@H](C)N[C@@H]2CC(=O)N(Cc3ccccc3)[C@H]2C)ccc1OC(F)F ZINC000467444985 881248408 /nfs/dbraw/zinc/24/84/08/881248408.db2.gz YBZIHCWTAGPHRR-RLFYNMQTSA-N 0 3 404.457 4.137 20 0 HIADHN Cc1ccc([C@@H](NC[C@H](CO)CC2CCCC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000467451834 881256213 /nfs/dbraw/zinc/25/62/13/881256213.db2.gz YZOGHHUGVFBCBT-HYBUGGRVSA-N 0 3 415.599 4.266 20 0 HIADHN CCc1noc(-c2ccc(C)c(NC(=O)N[C@H]3C[C@@H](C)N(Cc4ccccc4)C3)c2)n1 ZINC000467458233 881266566 /nfs/dbraw/zinc/26/65/66/881266566.db2.gz FWYQNDFRPBFMOF-XLIONFOSSA-N 0 3 419.529 4.392 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@H](C)N[C@H](C)c2ccc(SC)cc2)cc1OC ZINC000503581681 912665567 /nfs/dbraw/zinc/66/55/67/912665567.db2.gz QCNWGIJUAKIWAW-CVEARBPZSA-N 0 3 402.560 4.123 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)c1cc(F)c(Cl)cc1Cl ZINC000467489089 881308382 /nfs/dbraw/zinc/30/83/82/881308382.db2.gz AUYFLLIZBSCTDB-UHFFFAOYSA-N 0 3 411.304 4.019 20 0 HIADHN CSc1ccc([C@@H](C)N[C@H](C)C(=O)N[C@@H](C)c2ccc3c(c2)OCCO3)cc1 ZINC000503587394 912670903 /nfs/dbraw/zinc/67/09/03/912670903.db2.gz TVOBQHVIOCSPQU-OWCLPIDISA-N 0 3 400.544 4.096 20 0 HIADHN O=C(C1CCC(NCc2ccc(Oc3ccccc3)o2)CC1)N1CCSCC1 ZINC000503587000 912671440 /nfs/dbraw/zinc/67/14/40/912671440.db2.gz PWFLHXVHBQHZQQ-UHFFFAOYSA-N 0 3 400.544 4.296 20 0 HIADHN CCCn1c(C(=O)Nc2ccccc2CN2CCC[C@H](C(N)=O)C2)cc2ccccc21 ZINC000469075543 883159055 /nfs/dbraw/zinc/15/90/55/883159055.db2.gz WRHKTTHHDXVKDQ-FQEVSTJZSA-N 0 3 418.541 4.001 20 0 HIADHN C[C@H](O)C[C@@H](CNC(=O)[C@H](C)N1CCC(Cc2ccccc2)CC1)c1ccccc1 ZINC000469075787 883161590 /nfs/dbraw/zinc/16/15/90/883161590.db2.gz VUOAKVLNOZNONP-WATLYSKOSA-N 0 3 408.586 4.001 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)N3C[C@H](c4ccc(F)cc4)C[C@H]3C)CC2)c1 ZINC000469095177 883185218 /nfs/dbraw/zinc/18/52/18/883185218.db2.gz VGSVIKRWNBEICZ-IFMALSPDSA-N 0 3 409.549 4.051 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)N3C[C@@H](c4ccc(F)cc4)C[C@H]3C)CC2)c1 ZINC000469095284 883185359 /nfs/dbraw/zinc/18/53/59/883185359.db2.gz VGSVIKRWNBEICZ-IRLDBZIGSA-N 0 3 409.549 4.051 20 0 HIADHN O=C(CCN1CCN(c2ccccc2)CC1)NC1(c2cccc(C(F)(F)F)c2)CC1 ZINC000469169993 883269403 /nfs/dbraw/zinc/26/94/03/883269403.db2.gz UFZLOFZZYIVYSJ-UHFFFAOYSA-N 0 3 417.475 4.023 20 0 HIADHN CC[C@@H](NCc1cccc(C(=O)N2CCOCC2)c1)c1ccc(Br)cc1 ZINC000469180980 883279842 /nfs/dbraw/zinc/27/98/42/883279842.db2.gz JVXNTCJFLJUYDC-HXUWFJFHSA-N 0 3 417.347 4.162 20 0 HIADHN CC[C@H](NCc1cccc(C(=O)N2CCOCC2)c1)c1ccc(Br)cc1 ZINC000469180893 883280001 /nfs/dbraw/zinc/28/00/01/883280001.db2.gz JVXNTCJFLJUYDC-FQEVSTJZSA-N 0 3 417.347 4.162 20 0 HIADHN CCN(C(=O)c1nnn(CC2CCCC2)c1C)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000469187435 883288407 /nfs/dbraw/zinc/28/84/07/883288407.db2.gz CSMYVRWVFHNPSM-AVRDEDQJSA-N 0 3 409.578 4.074 20 0 HIADHN Cc1ccc(C(=O)Nc2ccc(C(=O)N(C)[C@@H]3CCCN(C)C3)cc2)c(F)c1Cl ZINC000469232108 883331948 /nfs/dbraw/zinc/33/19/48/883331948.db2.gz UHVQWQJDDASRMN-QGZVFWFLSA-N 0 3 417.912 4.206 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@@H](C)N[C@@H](C)c2cnn(C(C)C)c2C)CC1 ZINC000469240265 883338807 /nfs/dbraw/zinc/33/88/07/883338807.db2.gz PTQIYXKLGWMHOT-MSOLQXFVSA-N 0 3 401.574 4.465 20 0 HIADHN COc1ccc(C(=O)N2CCCCCC2)cc1NC(=O)c1cccc(CN(C)C)c1 ZINC000469297824 883396121 /nfs/dbraw/zinc/39/61/21/883396121.db2.gz UJXVTKNFFNAZMY-UHFFFAOYSA-N 0 3 409.530 4.025 20 0 HIADHN CO[C@@H](CCN[C@H](c1ccc(C)cc1)c1cccc(S(C)(=O)=O)c1)C(F)(F)F ZINC000469314157 883415516 /nfs/dbraw/zinc/41/55/16/883415516.db2.gz FDDICKBXUQYYCO-RBUKOAKNSA-N 0 3 415.477 4.045 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)NCc1ncoc1-c1ccccc1 ZINC000469430315 883612301 /nfs/dbraw/zinc/61/23/01/883612301.db2.gz PFKOCPNXJRTJIQ-JOCHJYFZSA-N 0 3 406.530 4.297 20 0 HIADHN Cc1ccc(C(=O)NC2CC2)cc1NC(=O)N[C@H](CN(C)Cc1ccccc1)C(C)C ZINC000469455732 883663885 /nfs/dbraw/zinc/66/38/85/883663885.db2.gz YEHZCYHNMNKCGG-HSZRJFAPSA-N 0 3 422.573 4.165 20 0 HIADHN CC(C)NC(=O)c1ccc(NC(=O)N[C@H](CN(C)Cc2ccccc2)C(C)C)cc1 ZINC000469469629 883692704 /nfs/dbraw/zinc/69/27/04/883692704.db2.gz YOVSZAQLLNGVCC-JOCHJYFZSA-N 0 3 410.562 4.103 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)c1ccc(OC2CCOCC2)cc1 ZINC000469475089 883705302 /nfs/dbraw/zinc/70/53/02/883705302.db2.gz VJRBXIYJAASPNV-XMMPIXPASA-N 0 3 410.558 4.131 20 0 HIADHN CSc1nc(C)c(CCC(=O)N[C@H](CN(C)Cc2ccccc2)C(C)C)c(C)n1 ZINC000469480002 883709902 /nfs/dbraw/zinc/70/99/02/883709902.db2.gz OMAXGGLOEOUPLA-OAQYLSRUSA-N 0 3 414.619 4.021 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)c1ccc2c(c1)NC(=O)[C@H](C)S2 ZINC000469479181 883711511 /nfs/dbraw/zinc/71/15/11/883711511.db2.gz CLMGPLJZCLDPRT-OXJNMPFZSA-N 0 3 411.571 4.006 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)c1cccc(COC2CCOCC2)c1 ZINC000469504791 883751003 /nfs/dbraw/zinc/75/10/03/883751003.db2.gz KCVRWJVTAIOYMO-RUZDIDTESA-N 0 3 424.585 4.269 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3cc(Br)c(F)cc3F)cc2)CC1 ZINC000469506549 883758117 /nfs/dbraw/zinc/75/81/17/883758117.db2.gz IWWIRLXHVUFVSG-UHFFFAOYSA-N 0 3 424.289 4.122 20 0 HIADHN CN(CCCCCc1cc(-c2cccc(F)c2)n[nH]1)Cc1cc(-c2cnn(C)c2)no1 ZINC000469521651 883790171 /nfs/dbraw/zinc/79/01/71/883790171.db2.gz FYMFFDNMQVEZND-UHFFFAOYSA-N 0 3 422.508 4.449 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)[C@@H]3C[C@H]3c3ccc(Cl)s3)CC2)C[C@@H](C)O1 ZINC000469528306 883800678 /nfs/dbraw/zinc/80/06/78/883800678.db2.gz BQQHCQUXRYCQPG-JOCBIADPSA-N 0 3 411.011 4.243 20 0 HIADHN COc1cc([C@H](C)NCc2ccc(Br)c(Cl)c2)ccc1OCCO ZINC000469781111 883955786 /nfs/dbraw/zinc/95/57/86/883955786.db2.gz SEXSZPAKNGBEKG-LBPRGKRZSA-N 0 3 414.727 4.333 20 0 HIADHN COc1ccc([C@@H](C)NCc2cccc(C(=O)N3CCOCC3)c2)c2ccccc12 ZINC000469810797 883985197 /nfs/dbraw/zinc/98/51/97/883985197.db2.gz YJMOLMFYVQLNJC-GOSISDBHSA-N 0 3 404.510 4.172 20 0 HIADHN Cc1ccn(-c2ccccc2NC(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)n1 ZINC000469839778 884020836 /nfs/dbraw/zinc/02/08/36/884020836.db2.gz DUWLJGCMDLQNRW-UHFFFAOYSA-N 0 3 413.472 4.055 20 0 HIADHN COc1ccc2c(c1)[C@H](C(=O)Nc1cc(C)cc(N3CCN(C(C)C)CC3)c1)CC2 ZINC000469850541 884033463 /nfs/dbraw/zinc/03/34/63/884033463.db2.gz DSFPBARYNAODSW-HSZRJFAPSA-N 0 3 407.558 4.203 20 0 HIADHN CCSc1cc(Cl)ccc1C(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000469868447 884057166 /nfs/dbraw/zinc/05/71/66/884057166.db2.gz CDMPCDGIEVNLQO-IBGZPJMESA-N 0 3 418.990 4.473 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)Nc3ccc4nn(C(C)C)cc4c3)CC2)c1 ZINC000469895412 884086059 /nfs/dbraw/zinc/08/60/59/884086059.db2.gz FDXLYLMHVYWCDQ-UHFFFAOYSA-N 0 3 405.546 4.076 20 0 HIADHN CCCN(C(=O)NCCC(=O)Nc1ccccc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000503679541 912786401 /nfs/dbraw/zinc/78/64/01/912786401.db2.gz KBKNGQHVEHGPFP-HSZRJFAPSA-N 0 3 422.573 4.101 20 0 HIADHN Cc1cc(NC(=O)N2CCCC3(CCC3)C2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000469911641 884102748 /nfs/dbraw/zinc/10/27/48/884102748.db2.gz SPBDXAFYRMCNLV-OAQYLSRUSA-N 0 3 407.562 4.437 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3ccc(C)c(NC(=O)C(C)(C)C)c3)cc2)CC1 ZINC000469959895 884165784 /nfs/dbraw/zinc/16/57/84/884165784.db2.gz QZUKJBJUJMOTIN-UHFFFAOYSA-N 0 3 422.573 4.374 20 0 HIADHN CC1CCN([C@H](CNC(=O)N[C@H]2CCCC[C@@H]2n2cccn2)c2cccs2)CC1 ZINC000470049595 884295584 /nfs/dbraw/zinc/29/55/84/884295584.db2.gz GFBGHZFGBPYJGH-SLFFLAALSA-N 0 3 415.607 4.201 20 0 HIADHN CC[C@@H](C)[C@@H](NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1)C(F)(F)F ZINC000470122381 884384457 /nfs/dbraw/zinc/38/44/57/884384457.db2.gz NQYLQRXJYHTSHO-WKIYYKSKSA-N 0 3 403.411 4.068 20 0 HIADHN NC(=O)CC1CCN(Cc2ccc(Oc3cccc(Br)c3)cc2)CC1 ZINC000470177750 884459136 /nfs/dbraw/zinc/45/91/36/884459136.db2.gz FOTUERGVMTZQSC-UHFFFAOYSA-N 0 3 403.320 4.329 20 0 HIADHN Cc1onc(-c2cccc(Br)c2)c1C(=O)NC[C@H]1CCCCN1C1CC1 ZINC000470178588 884461762 /nfs/dbraw/zinc/46/17/62/884461762.db2.gz LDXBRKAOBRRLPZ-QGZVFWFLSA-N 0 3 418.335 4.159 20 0 HIADHN C[C@@H](NC(=O)NC[C@@H](c1ccccc1)N1CCCC1)c1ccccc1-n1cccn1 ZINC000470183658 884473174 /nfs/dbraw/zinc/47/31/74/884473174.db2.gz RWLPQLKXVXTECO-XXBNENTESA-N 0 3 403.530 4.070 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)N1CCC[C@H](c2nccs2)C1 ZINC000470279143 884639412 /nfs/dbraw/zinc/63/94/12/884639412.db2.gz JDTKHPNOTLQLCN-PMACEKPBSA-N 0 3 400.592 4.189 20 0 HIADHN O=C(CN[C@H]1CCCc2ccc(Br)cc21)N[C@@H]1CCOc2ccccc21 ZINC000503907472 912860698 /nfs/dbraw/zinc/86/06/98/912860698.db2.gz DPDKHEPNNULLHQ-RBUKOAKNSA-N 0 3 415.331 4.056 20 0 HIADHN Cc1cccc(Nc2nnc(SCCCN3CCN(C(C)C)CC3)s2)c1C ZINC000470440801 884839271 /nfs/dbraw/zinc/83/92/71/884839271.db2.gz MZNXBKCWHKCDJL-UHFFFAOYSA-N 0 3 405.637 4.407 20 0 HIADHN Cc1ccc(Nc2nnc(SCCCN3CCN(C(C)C)CC3)s2)cc1C ZINC000470442310 884840168 /nfs/dbraw/zinc/84/01/68/884840168.db2.gz NOIVVFGQTFPKNB-UHFFFAOYSA-N 0 3 405.637 4.407 20 0 HIADHN Cc1ccc(NC(=O)C[C@@H](C)N[C@@H](Cn2ccccc2=O)c2ccccc2)c(C)c1 ZINC000503927414 912868375 /nfs/dbraw/zinc/86/83/75/912868375.db2.gz PQUDFDJTWNRUSF-OFNKIYASSA-N 0 3 403.526 4.213 20 0 HIADHN CCn1c(SCCCN2CCN(C(C)C)CC2)nnc1-c1cccc(Cl)c1 ZINC000470451701 884847264 /nfs/dbraw/zinc/84/72/64/884847264.db2.gz LCGGWMPLDZJDLK-UHFFFAOYSA-N 0 3 408.015 4.127 20 0 HIADHN C[C@H](CC(=O)Nc1cccc(Cl)c1)N[C@H](Cn1ccccc1=O)c1ccccc1 ZINC000503944020 912876000 /nfs/dbraw/zinc/87/60/00/912876000.db2.gz YFHOMUXYUNMRCS-DYESRHJHSA-N 0 3 409.917 4.250 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)c1cccc(Nc2cnn(C)c2)c1 ZINC000470586190 885002297 /nfs/dbraw/zinc/00/22/97/885002297.db2.gz ANIAEGUIEJUXPG-HSZRJFAPSA-N 0 3 405.546 4.050 20 0 HIADHN CSc1cc(C(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)ccc1NC(C)=O ZINC000470656611 885078639 /nfs/dbraw/zinc/07/86/39/885078639.db2.gz IQLFRZPAMKCSAU-FQEVSTJZSA-N 0 3 411.571 4.104 20 0 HIADHN CN(C(=O)c1ccc(CNC(=O)C(C)(C)C)cc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470657786 885080877 /nfs/dbraw/zinc/08/08/77/885080877.db2.gz UTCZGDGDOTWCIP-QHCPKHFHSA-N 0 3 421.585 4.086 20 0 HIADHN CN(C(=O)c1cccc(NC(=O)c2ccco2)c1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470658937 885083031 /nfs/dbraw/zinc/08/30/31/885083031.db2.gz SWRTYHVRTBGFCF-JOCHJYFZSA-N 0 3 417.509 4.269 20 0 HIADHN CCOc1c(Cl)cc(C(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)cc1OC ZINC000470660315 885084614 /nfs/dbraw/zinc/08/46/14/885084614.db2.gz ICAXEEHSMCIRRX-LJQANCHMSA-N 0 3 416.949 4.484 20 0 HIADHN CN(C(=O)CCc1ncc(-c2ccccc2)o1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470665854 885092415 /nfs/dbraw/zinc/09/24/15/885092415.db2.gz DENPOBDKWCLCBE-JOCHJYFZSA-N 0 3 403.526 4.397 20 0 HIADHN CN(C(=O)Cc1csc(-c2ccccc2)n1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470667003 885094211 /nfs/dbraw/zinc/09/42/11/885094211.db2.gz LAZKYWAKJARQTP-QFIPXVFZSA-N 0 3 405.567 4.476 20 0 HIADHN CN(C(=O)CN[C@@H](c1ccccc1)C(F)(F)F)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470669712 885098048 /nfs/dbraw/zinc/09/80/48/885098048.db2.gz SFNONCAYUUPVCE-UNMCSNQZSA-N 0 3 419.491 4.003 20 0 HIADHN CN(C(=O)c1cc(F)cc(Br)c1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470673374 885103505 /nfs/dbraw/zinc/10/35/05/885103505.db2.gz FXTAJJRASUVUHM-IBGZPJMESA-N 0 3 405.311 4.325 20 0 HIADHN CN(C(=O)c1ccc(OCc2ccncc2)cc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470675008 885104679 /nfs/dbraw/zinc/10/46/79/885104679.db2.gz OHOFKMYZIZRCOY-DEOSSOPVSA-N 0 3 415.537 4.397 20 0 HIADHN CN(C(=O)c1ccc(OCc2ccccc2)nc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470675606 885107548 /nfs/dbraw/zinc/10/75/48/885107548.db2.gz SCGMMBSJCIIGFJ-DEOSSOPVSA-N 0 3 415.537 4.397 20 0 HIADHN Cc1ccc(-c2nnc(-c3ccc(C(=O)N[C@@H]4CCCN(C(C)C)C4)cc3)o2)cc1 ZINC000470688606 885123656 /nfs/dbraw/zinc/12/36/56/885123656.db2.gz MRMQYTJKILJBQE-OAQYLSRUSA-N 0 3 404.514 4.315 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)N(C)Cc2nc(C(F)(F)F)cs2)C1 ZINC000470722474 885168611 /nfs/dbraw/zinc/16/86/11/885168611.db2.gz JUCRVHHSQAILSD-DZGCQCFKSA-N 0 3 412.481 4.139 20 0 HIADHN CN(C(=O)NCc1csc(Br)c1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470727924 885180109 /nfs/dbraw/zinc/18/01/09/885180109.db2.gz XCUVHZZHHMIJKF-KRWDZBQOSA-N 0 3 422.392 4.317 20 0 HIADHN C[C@@H](COc1ccc(F)cc1F)NC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470731071 885183390 /nfs/dbraw/zinc/18/33/90/885183390.db2.gz BTYAEOGDYYAKCN-PXNSSMCTSA-N 0 3 417.500 4.038 20 0 HIADHN CN(C(=O)NCc1cccc(OC(F)F)c1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470732626 885185870 /nfs/dbraw/zinc/18/58/70/885185870.db2.gz KQXPYAVSJZVRDE-IBGZPJMESA-N 0 3 403.473 4.094 20 0 HIADHN CN(C(=O)NCCCCOc1ccc(F)cc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470736639 885194172 /nfs/dbraw/zinc/19/41/72/885194172.db2.gz IXHBYAQRROFHII-QFIPXVFZSA-N 0 3 413.537 4.291 20 0 HIADHN C[C@H](NC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1)c1ccccc1-n1cccn1 ZINC000470771983 885238575 /nfs/dbraw/zinc/23/85/75/885238575.db2.gz IGNMVFZWXOJFDJ-ICSRJNTNSA-N 0 3 406.505 4.101 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CC[C@@H](COc2ccccc2)C1)c1ccsc1 ZINC000504010958 912915510 /nfs/dbraw/zinc/91/55/10/912915510.db2.gz XZRKLGOCXXTFHU-NQIIRXRSSA-N 0 3 401.576 4.242 20 0 HIADHN Cc1ccc(C2(C(=O)N(C)[C@H]3CCCN(Cc4ccccc4)C3)CCOCC2)cc1 ZINC000470812743 885302921 /nfs/dbraw/zinc/30/29/21/885302921.db2.gz NJWBBLCEWUKTAM-DEOSSOPVSA-N 0 3 406.570 4.166 20 0 HIADHN CC(C)CN(C(=O)NCCN1CCN(C)C(C)(C)C1)[C@@H](C)c1ccccc1Cl ZINC000504026759 912929805 /nfs/dbraw/zinc/92/98/05/912929805.db2.gz PWYGWWJJKSICBR-SFHVURJKSA-N 0 3 409.018 4.095 20 0 HIADHN CN(C(=O)NCCc1nc(C(C)(C)C)cs1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470894502 885391168 /nfs/dbraw/zinc/39/11/68/885391168.db2.gz IWVWQJNUEHYISM-LJQANCHMSA-N 0 3 414.619 4.289 20 0 HIADHN COc1ccccc1[C@]1(C)C[C@H]1NC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470895133 885393017 /nfs/dbraw/zinc/39/30/17/885393017.db2.gz RTVIAYFJDVMITN-XRODADMRSA-N 0 3 407.558 4.031 20 0 HIADHN C[C@H](NC(=O)NC[C@@H](c1cccs1)N1CCCC1)c1ccccc1-n1cccn1 ZINC000470898327 885397277 /nfs/dbraw/zinc/39/72/77/885397277.db2.gz RJRYOVBIPZZROA-PXNSSMCTSA-N 0 3 409.559 4.131 20 0 HIADHN CN(C(=O)NCCCc1c[nH]c2ccccc12)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470897690 885397868 /nfs/dbraw/zinc/39/78/68/885397868.db2.gz OKZDYKOIZVZXBJ-JOCHJYFZSA-N 0 3 404.558 4.407 20 0 HIADHN Cc1sc(CNC(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)nc1C(C)C ZINC000470900868 885403926 /nfs/dbraw/zinc/40/39/26/885403926.db2.gz SVVRWSSHRKIOTM-LJQANCHMSA-N 0 3 400.592 4.381 20 0 HIADHN Cc1cc(Br)cc(C)c1NC(=O)CCCN1C[C@@H](C)O[C@H](C2CC2)C1 ZINC000470928744 885434117 /nfs/dbraw/zinc/43/41/17/885434117.db2.gz GXBQYJMWYOOVEP-QAPCUYQASA-N 0 3 409.368 4.284 20 0 HIADHN Cc1ccc([C@H]2CCN(CC(=O)N3CCC(OCc4ccccc4)CC3)C2)c(C)c1 ZINC000471010581 885511956 /nfs/dbraw/zinc/51/19/56/885511956.db2.gz YGMYLJSFGXJAEA-QHCPKHFHSA-N 0 3 406.570 4.301 20 0 HIADHN COc1cc(-c2nnc(CN3CC[C@@H](c4ccc(C)cc4C)C3)o2)cc(OC)c1OC ZINC000471009512 885512625 /nfs/dbraw/zinc/51/26/25/885512625.db2.gz VUHZJWPIVUAJAM-QGZVFWFLSA-N 0 3 423.513 4.369 20 0 HIADHN CN1CCN(CC(=O)N[C@H](Cc2ccccc2)c2ccccc2)C2(CCCCC2)C1 ZINC000471040133 885550475 /nfs/dbraw/zinc/55/04/75/885550475.db2.gz YHTIDTXJKKIBIE-XMMPIXPASA-N 0 3 405.586 4.037 20 0 HIADHN CN(C)CCN(C(=O)c1cccc(-n2ccc(C(F)(F)F)n2)c1)c1ccccc1 ZINC000471062046 885576876 /nfs/dbraw/zinc/57/68/76/885576876.db2.gz KIWHFJATUYTUBH-UHFFFAOYSA-N 0 3 402.420 4.100 20 0 HIADHN C[C@H](NC(=O)C1(c2ccc(Cl)cc2)CCOCC1)[C@H](c1ccccc1)N(C)C ZINC000471134032 885674900 /nfs/dbraw/zinc/67/49/00/885674900.db2.gz PSVMWQYZQZOLFK-LAUBAEHRSA-N 0 3 400.950 4.196 20 0 HIADHN CCOC(=O)c1c2c(sc1NC(=O)c1ccncc1C)C(C)(C)NC(C)(C)C2 ZINC000471368560 886004259 /nfs/dbraw/zinc/00/42/59/886004259.db2.gz FRJWRYVDLIXBAB-UHFFFAOYSA-N 0 3 401.532 4.040 20 0 HIADHN COc1cc(NC(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)cc(-n2cccn2)c1 ZINC000471476399 886171322 /nfs/dbraw/zinc/17/13/22/886171322.db2.gz OLRQXPUPCGBSRK-OAQYLSRUSA-N 0 3 419.529 4.009 20 0 HIADHN CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)Nc1ncc(Cc2ccccc2)s1 ZINC000471493818 886194340 /nfs/dbraw/zinc/19/43/40/886194340.db2.gz TYQVHSQOVOXHLE-FPOVZHCZSA-N 0 3 421.570 4.286 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N[C@@H]1CCSc2ccccc21 ZINC000471495773 886196862 /nfs/dbraw/zinc/19/68/62/886196862.db2.gz LCOKXMPPWRPENR-VMBOVVBDSA-N 0 3 413.509 4.328 20 0 HIADHN CC(C)c1nn(-c2ccc(Br)cc2)cc1CNCCOCC(F)F ZINC000471522258 886226203 /nfs/dbraw/zinc/22/62/03/886226203.db2.gz NPPSOMXPKZQJOW-UHFFFAOYSA-N 0 3 402.283 4.130 20 0 HIADHN C[C@@H](NC(=O)c1cccc(NC(=O)c2cccs2)c1)[C@H](c1ccccc1)N(C)C ZINC000471555438 886263791 /nfs/dbraw/zinc/26/37/91/886263791.db2.gz NGQBJBMROHJMNI-IIBYNOLFSA-N 0 3 407.539 4.422 20 0 HIADHN C[C@@H](NC(=O)c1nn(-c2ccc(F)c(F)c2)c2c1CCC2)[C@H](c1ccccc1)N(C)C ZINC000471577403 886290359 /nfs/dbraw/zinc/29/03/59/886290359.db2.gz KAKLWBYMZXFOIG-IQMFZBJNSA-N 0 3 424.495 4.060 20 0 HIADHN COc1ccccc1[C@@H](CN[C@@H](C)c1ccc(NC(C)=O)cc1OC)OC(C)C ZINC000471593932 886306732 /nfs/dbraw/zinc/30/67/32/886306732.db2.gz NPGCBPGTUXSDMZ-QMHKHESXSA-N 0 3 400.519 4.479 20 0 HIADHN COC1CCN(C(=O)N(CCN2CCCC2)Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000471604564 886317931 /nfs/dbraw/zinc/31/79/31/886317931.db2.gz XUWWOWCMRLRFDS-UHFFFAOYSA-N 0 3 414.377 4.122 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)c3c(C)nc(C(C)C)nc3SC)c2)CC1 ZINC000471623477 886341072 /nfs/dbraw/zinc/34/10/72/886341072.db2.gz BAPSOAPANLNKOU-UHFFFAOYSA-N 0 3 413.591 4.025 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)CCc3nc(C)c(-c4ccccc4)o3)c2)CC1 ZINC000471624389 886343447 /nfs/dbraw/zinc/34/34/47/886343447.db2.gz HJAFCBMUJDRWAI-UHFFFAOYSA-N 0 3 418.541 4.363 20 0 HIADHN CCOc1ccc(C2(CN[C@H](C)c3cn(-c4ccccc4)nn3)CCOCC2)cc1 ZINC000471640832 886357754 /nfs/dbraw/zinc/35/77/54/886357754.db2.gz AZPAYSILZYCWMI-LJQANCHMSA-N 0 3 406.530 4.065 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)c3ccc(COc4ccc(F)cc4)o3)c2)CC1 ZINC000471646088 886360115 /nfs/dbraw/zinc/36/01/15/886360115.db2.gz SUINKRCAULPWGC-UHFFFAOYSA-N 0 3 423.488 4.392 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)CCc3ccc(OC)c(Cl)c3)c2)CC1 ZINC000471653012 886367318 /nfs/dbraw/zinc/36/73/18/886367318.db2.gz MDFKMTWGEYKAGB-UHFFFAOYSA-N 0 3 401.938 4.062 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)NCC2CCN(c3ccccc3)CC2)C1 ZINC000471731000 886450507 /nfs/dbraw/zinc/45/05/07/886450507.db2.gz GZOUDQBDQPCEGP-REWPJTCUSA-N 0 3 406.574 4.038 20 0 HIADHN Cc1cccc(C(C)(C)CNC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)c1 ZINC000471761363 886493657 /nfs/dbraw/zinc/49/36/57/886493657.db2.gz QTQHSYRPKNDEOR-UHFFFAOYSA-N 0 3 411.512 4.377 20 0 HIADHN C[C@@H](NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1)C(C)(C)c1ccccc1 ZINC000471828158 886577883 /nfs/dbraw/zinc/57/78/83/886577883.db2.gz UJJDODXSEIKXRG-VNCLNFNDSA-N 0 3 411.512 4.457 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N[C@H]1CCCOc2ccccc21 ZINC000471837641 886594376 /nfs/dbraw/zinc/59/43/76/886594376.db2.gz KIFSCIDCVVSQRZ-HTWSVDAQSA-N 0 3 411.468 4.005 20 0 HIADHN CC[C@@H](NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1nc(C)cs1 ZINC000471840968 886601079 /nfs/dbraw/zinc/60/10/79/886601079.db2.gz VTWBQDYZPIXBHG-YMAMQOFZSA-N 0 3 404.502 4.007 20 0 HIADHN CCSCc1cc(C(=O)N(c2cccc(SC)c2)C2CCN(C)CC2)no1 ZINC000471841345 886601975 /nfs/dbraw/zinc/60/19/75/886601975.db2.gz XXNXXNRPQUDRCM-UHFFFAOYSA-N 0 3 405.589 4.391 20 0 HIADHN COc1ccc(NC(=O)[C@H](C)N[C@H]2C[C@H](OCc3ccccc3)C2(C)C)c(OC)c1 ZINC000471855397 886625046 /nfs/dbraw/zinc/62/50/46/886625046.db2.gz GBSSDBWOHNTOGC-SSKFGXFMSA-N 0 3 412.530 4.004 20 0 HIADHN CCCc1cccc(C(C)C)c1NC(=O)N1CC[C@H](N2CCN(C)CC2)[C@@H](C)C1 ZINC000471922371 886712336 /nfs/dbraw/zinc/71/23/36/886712336.db2.gz YJGFQKZVGALEGL-UGKGYDQZSA-N 0 3 400.611 4.252 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2cccc3c2CN(c2ccccn2)C3)[C@@H]1c1ccccc1 ZINC000471939713 886738150 /nfs/dbraw/zinc/73/81/50/886738150.db2.gz LLVKDODHTBBJHE-VWNXMTODSA-N 0 3 413.525 4.169 20 0 HIADHN Cc1c(NC(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)cnn1-c1cc(C)ccc1C ZINC000471980768 886809676 /nfs/dbraw/zinc/80/96/76/886809676.db2.gz SIQJTAPOZOXQAY-NFBKMPQASA-N 0 3 403.530 4.364 20 0 HIADHN Cc1ccc2[nH]c(CNCc3ccc(C(=O)N4C[C@@H](C)O[C@H](C)C4)cc3)cc2c1C ZINC000472040754 886858219 /nfs/dbraw/zinc/85/82/19/886858219.db2.gz ILXSLJNTYBWZOL-QZTJIDSGSA-N 0 3 405.542 4.324 20 0 HIADHN COc1cc(F)c(NC(=O)NC[C@H](c2ccccc2)N2CCC(C)CC2)cc1OC ZINC000504212772 913089727 /nfs/dbraw/zinc/08/97/27/913089727.db2.gz OOIJUVKEJQEUFO-HXUWFJFHSA-N 0 3 415.509 4.438 20 0 HIADHN C[C@@H](CCN1CCN(C)CC1)NC(=O)c1cc2c(s1)-c1ccccc1C(C)(C)C2 ZINC000472087089 886886982 /nfs/dbraw/zinc/88/69/82/886886982.db2.gz QIIWKSWBLXCXEH-KRWDZBQOSA-N 0 3 411.615 4.005 20 0 HIADHN C[C@@H](CCCCN1C(=O)c2ccccc2C1=O)NCc1cc(-c2ccccc2)on1 ZINC000472132782 886924559 /nfs/dbraw/zinc/92/45/59/886924559.db2.gz PPBNHOYDEPNTPD-KRWDZBQOSA-N 0 3 403.482 4.286 20 0 HIADHN Cc1ccc([C@H](NC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)c2ccccn2)cc1 ZINC000472174820 886974759 /nfs/dbraw/zinc/97/47/59/886974759.db2.gz RADCWKXLDRPLMF-ZPZUNKDASA-N 0 3 414.553 4.299 20 0 HIADHN C[C@H](CCCC(F)(F)F)NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472193951 886994400 /nfs/dbraw/zinc/99/44/00/886994400.db2.gz SZOAIKQGPVULDR-LMWSTFAQSA-N 0 3 403.411 4.212 20 0 HIADHN COc1ccc(OC)c([C@H]2C[C@H]2C(=O)N(CCN(C)C)Cc2cccc(Cl)c2)c1 ZINC000472217972 887019054 /nfs/dbraw/zinc/01/90/54/887019054.db2.gz ZZYUXIIYPHASPN-TZIWHRDSSA-N 0 3 416.949 4.051 20 0 HIADHN COc1ccc(OC)c([C@@H]2C[C@@H]2C(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)c1 ZINC000472230720 887037103 /nfs/dbraw/zinc/03/71/03/887037103.db2.gz HIKCBDDRUVTHKG-ACIOBRDBSA-N 0 3 408.542 4.069 20 0 HIADHN Cc1cc2occ(C(=O)Nc3ccc(C(=O)N(C)[C@H]4CCCN(C)C4)cc3)c2cc1C ZINC000472304169 887127927 /nfs/dbraw/zinc/12/79/27/887127927.db2.gz VBZOHKTVTMMVEQ-FQEVSTJZSA-N 0 3 419.525 4.468 20 0 HIADHN CC(C)c1noc(-c2ccc(NC(=O)N[C@@H]3CCN(C)[C@@H]3c3ccccc3)cc2)n1 ZINC000472307579 887134036 /nfs/dbraw/zinc/13/40/36/887134036.db2.gz XXTHIZKISWOOIC-WOJBJXKFSA-N 0 3 405.502 4.427 20 0 HIADHN CC[C@@H]1CN(C(C)=O)[C@H](CC)CN1CCC(=O)Nc1cc(Cl)ccc1Cl ZINC000472317681 887150394 /nfs/dbraw/zinc/15/03/94/887150394.db2.gz QWKNYLGPASXIHR-HZPDHXFCSA-N 0 3 400.350 4.043 20 0 HIADHN Cc1cc(-c2noc([C@H](C)NC(=O)c3cccc(CN4CCCC4)c3)n2)ccc1F ZINC000472393861 887239616 /nfs/dbraw/zinc/23/96/16/887239616.db2.gz IQNXRUMPMROLMZ-INIZCTEOSA-N 0 3 408.477 4.271 20 0 HIADHN CCc1ccc(-c2noc([C@H](C)NC(=O)c3cccc(CN4CCCC4)c3)n2)cc1 ZINC000472397896 887245138 /nfs/dbraw/zinc/24/51/38/887245138.db2.gz XOJJAYHLRSCPFM-KRWDZBQOSA-N 0 3 404.514 4.386 20 0 HIADHN C[C@@H](c1ccccc1F)N(C)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472447546 887300652 /nfs/dbraw/zinc/30/06/52/887300652.db2.gz MVRBUDKGBHUFGP-JEYLPNPQSA-N 0 3 401.448 4.333 20 0 HIADHN CN(Cc1cccc2[nH]ccc21)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472449963 887301989 /nfs/dbraw/zinc/30/19/89/887301989.db2.gz IQNJGJLOMAHQAO-UHFFFAOYSA-N 0 3 408.468 4.115 20 0 HIADHN C[C@H](c1cc(F)ccc1F)N(C)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472455153 887308526 /nfs/dbraw/zinc/30/85/26/887308526.db2.gz KOLUODMVVIWTGP-UWTIGNOOSA-N 0 3 419.438 4.473 20 0 HIADHN C[C@@H]1[C@H](Cc2ccccc2)CCN1C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472456827 887310565 /nfs/dbraw/zinc/31/05/65/887310565.db2.gz PICBEBWNIAIYII-IWCLVNKQSA-N 0 3 423.523 4.454 20 0 HIADHN Cc1nc(C)c([C@H](C)N(C)C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)s1 ZINC000472455519 887310585 /nfs/dbraw/zinc/31/05/85/887310585.db2.gz QPBDULXBUBMTBW-JQRITLKVSA-N 0 3 418.529 4.268 20 0 HIADHN CC(C)CCOC1CCN(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)CC1 ZINC000472456065 887310887 /nfs/dbraw/zinc/31/08/87/887310887.db2.gz QZTSRGDSSUWJNI-UHFFFAOYSA-N 0 3 419.532 4.028 20 0 HIADHN COCCCC[C@@H](NC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1)c1ccccc1 ZINC000472458986 887315720 /nfs/dbraw/zinc/31/57/20/887315720.db2.gz YWDLFSCKJWXKEK-BJKOFHAPSA-N 0 3 409.574 4.460 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N1CCC(Cc2ccccc2)CC1 ZINC000472460054 887318280 /nfs/dbraw/zinc/31/82/80/887318280.db2.gz ARGQUKPJTNFFFX-UHFFFAOYSA-N 0 3 423.523 4.456 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N1CC[C@H](Cc2ccccc2)C1 ZINC000472461456 887319424 /nfs/dbraw/zinc/31/94/24/887319424.db2.gz ZNIINGBKLKARJM-QHGAOEGBSA-N 0 3 409.496 4.066 20 0 HIADHN Cc1cccc([C@H]2CCN(C(=O)NC3CC(N4CCC(C(F)(F)F)CC4)C3)C2)c1 ZINC000472470174 887331940 /nfs/dbraw/zinc/33/19/40/887331940.db2.gz ZIYKVUFHIXKUAA-KKXNLOMOSA-N 0 3 409.496 4.299 20 0 HIADHN Cc1ccc([C@@H](NC(=O)N(CCN(C)C)Cc2ccc(F)cc2)c2ccccn2)cc1 ZINC000472474318 887335114 /nfs/dbraw/zinc/33/51/14/887335114.db2.gz BXPKPHNUZKTYNL-XMMPIXPASA-N 0 3 420.532 4.392 20 0 HIADHN CN(C(=O)N[C@@H]1CC[C@H](c2ccc(F)cc2)C1)C1CCN(CCc2ccccn2)CC1 ZINC000472544672 887424143 /nfs/dbraw/zinc/42/41/43/887424143.db2.gz FZICIGVMQJPULL-NZQKXSOJSA-N 0 3 424.564 4.205 20 0 HIADHN COCCOc1cc(C)ccc1NC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000472704083 887556447 /nfs/dbraw/zinc/55/64/47/887556447.db2.gz MYRQCMSSMASPGB-NRFANRHFSA-N 0 3 411.546 4.149 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)c3cc4c(cccc4OC(F)F)[nH]3)c2)CC1 ZINC000472731254 887577485 /nfs/dbraw/zinc/57/74/85/887577485.db2.gz DAHVQULYMWICBG-UHFFFAOYSA-N 0 3 414.456 4.164 20 0 HIADHN CCOc1ccc(C(=O)CCC(=O)NCc2ccccc2CN2CCCC2)cc1F ZINC000472730341 887577757 /nfs/dbraw/zinc/57/77/57/887577757.db2.gz SIXVSOSZSHRGIK-UHFFFAOYSA-N 0 3 412.505 4.100 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)C[C@@H](C)C(=O)c3ccc(Cl)cc3)c2)CC1 ZINC000472753495 887599394 /nfs/dbraw/zinc/59/93/94/887599394.db2.gz OTGFLDXBGMDZFN-QGZVFWFLSA-N 0 3 413.949 4.330 20 0 HIADHN Cc1c(COc2ccccc2)cccc1NC(=O)N(CCN(C)C)C[C@@H]1CCCO1 ZINC000472830469 887678020 /nfs/dbraw/zinc/67/80/20/887678020.db2.gz JGJQQMPQVANZGP-QFIPXVFZSA-N 0 3 411.546 4.149 20 0 HIADHN C[C@H](CCN1CCN(C)CC1)NC(=O)N(Cc1ccccc1)[C@@H](C)c1cccs1 ZINC000472920179 887765307 /nfs/dbraw/zinc/76/53/07/887765307.db2.gz VEUWJDUHOIEBHL-UXHICEINSA-N 0 3 414.619 4.047 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(CN3CCSC4(CCOCC4)C3)c2)cc1 ZINC000473062790 887883358 /nfs/dbraw/zinc/88/33/58/887883358.db2.gz IVLUVRQQBAQSDS-UHFFFAOYSA-N 0 3 412.555 4.046 20 0 HIADHN OC1(Cc2cccc(F)c2)CCN(Cc2ccc(OCc3cccnc3)cc2)CC1 ZINC000473064356 887884430 /nfs/dbraw/zinc/88/44/30/887884430.db2.gz HECNQYIKEFJNLM-UHFFFAOYSA-N 0 3 406.501 4.369 20 0 HIADHN OC1(Cc2cccc(F)c2)CCN(Cc2ccccc2OCc2ccccn2)CC1 ZINC000473076425 887893158 /nfs/dbraw/zinc/89/31/58/887893158.db2.gz WXFIVXGSEYCGNN-UHFFFAOYSA-N 0 3 406.501 4.369 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)C1NC(=O)CCC(=O)c1ccc(F)c(F)c1 ZINC000473278675 888035589 /nfs/dbraw/zinc/03/55/89/888035589.db2.gz SSYNXDMEZYYCES-IAGOWNOFSA-N 0 3 414.496 4.201 20 0 HIADHN OC1(Cc2cccc(F)c2)CCN(CCOc2cccc(Br)c2)CC1 ZINC000473437391 888159061 /nfs/dbraw/zinc/15/90/61/888159061.db2.gz MCVNNGIDFCJUGB-UHFFFAOYSA-N 0 3 408.311 4.037 20 0 HIADHN CC(C)N1CCC[C@@H](N[C@H](Cc2ccccn2)c2ccc(Br)cc2)C1=O ZINC000473444642 888167463 /nfs/dbraw/zinc/16/74/63/888167463.db2.gz ZMJOBIHIFONALP-WOJBJXKFSA-N 0 3 416.363 4.117 20 0 HIADHN COc1ccc(-c2n[nH]c(SCCCCn3ccnc3C)n2)cc1Br ZINC000473510915 888238754 /nfs/dbraw/zinc/23/87/54/888238754.db2.gz VZNBSELNLHTHTF-UHFFFAOYSA-N 0 3 422.352 4.320 20 0 HIADHN C[C@H](Oc1ccc(F)cc1Cl)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473512279 888240930 /nfs/dbraw/zinc/24/09/30/888240930.db2.gz JTSANPXUHXJNOG-QGLTVNCISA-N 0 3 422.850 4.168 20 0 HIADHN COc1ccc(CCCCC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cc1 ZINC000473512579 888242466 /nfs/dbraw/zinc/24/24/66/888242466.db2.gz KHUNLVZMFNLQDD-UHFFFAOYSA-N 0 3 412.496 4.330 20 0 HIADHN O=C(Cc1csc(-c2ccccc2)n1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473515236 888245009 /nfs/dbraw/zinc/24/50/09/888245009.db2.gz VZMMBFJUDALYAH-UHFFFAOYSA-N 0 3 423.504 4.274 20 0 HIADHN CC[C@@H](C)n1ncc(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)c1C1CC1 ZINC000473518285 888249497 /nfs/dbraw/zinc/24/94/97/888249497.db2.gz CUCPVMANLYZUSJ-NVPAJSRCSA-N 0 3 412.500 4.267 20 0 HIADHN C[C@@H](CCc1ccccc1F)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473520774 888255707 /nfs/dbraw/zinc/25/57/07/888255707.db2.gz DCFASIZGOGPSIX-NNGSBXSVSA-N 0 3 400.460 4.316 20 0 HIADHN CCN1CCN(CCC(=O)N2CCCCC[C@@H]2c2ccc(C(F)(F)F)cc2)CC1 ZINC000473526882 888263160 /nfs/dbraw/zinc/26/31/60/888263160.db2.gz SJSLLHIRRUPSDG-HXUWFJFHSA-N 0 3 411.512 4.177 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)C1(c2cccc(Cl)c2)CC1 ZINC000473526844 888263550 /nfs/dbraw/zinc/26/35/50/888263550.db2.gz YUXVVAWGIGBHLJ-UHFFFAOYSA-N 0 3 400.872 4.293 20 0 HIADHN Cc1sc(-c2ccco2)nc1C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473530361 888266567 /nfs/dbraw/zinc/26/65/67/888266567.db2.gz ZEBNAPKIVDANEP-UHFFFAOYSA-N 0 3 413.465 4.247 20 0 HIADHN C[C@H](CC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1)Cc1cccc(F)c1 ZINC000473530606 888268410 /nfs/dbraw/zinc/26/84/10/888268410.db2.gz ZUMUNGUTWVVOAJ-YCMKEVRSSA-N 0 3 400.460 4.316 20 0 HIADHN Cc1cc(C)n(-c2ccc(C(=O)NC3CC(N4CCC(C(F)(F)F)CC4)C3)cc2)n1 ZINC000473530551 888268881 /nfs/dbraw/zinc/26/88/81/888268881.db2.gz KJCGFEJHDGMQPB-UHFFFAOYSA-N 0 3 420.479 4.024 20 0 HIADHN Cc1ccc(S[C@@H](C)C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cc1 ZINC000473530843 888268911 /nfs/dbraw/zinc/26/89/11/888268911.db2.gz XSNAXOBKEWSVHB-OOHWJJMZSA-N 0 3 400.510 4.397 20 0 HIADHN O=C(CCc1ccc(OC(F)F)cc1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473534113 888271503 /nfs/dbraw/zinc/27/15/03/888271503.db2.gz URMBISOINRPCPR-UHFFFAOYSA-N 0 3 420.422 4.142 20 0 HIADHN CCc1cccc2c(CC(=O)NC3CC(N4CCC(C(F)(F)F)CC4)C3)c[nH]c21 ZINC000473536853 888275199 /nfs/dbraw/zinc/27/51/99/888275199.db2.gz XRAUPLWGANIUDA-UHFFFAOYSA-N 0 3 407.480 4.194 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cn2ccnc2s1)c1ccc(C(F)(F)F)cc1 ZINC000473582865 888325342 /nfs/dbraw/zinc/32/53/42/888325342.db2.gz NDNQIQFKFDZXQP-OAHLLOKOSA-N 0 3 410.465 4.228 20 0 HIADHN COc1ccc(CCNC(=O)N(Cc2ccccc2)C2CCN(C)CC2)c(Cl)c1 ZINC000473725622 888502808 /nfs/dbraw/zinc/50/28/08/888502808.db2.gz ZJOBATLSTDGLSC-UHFFFAOYSA-N 0 3 415.965 4.197 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@@H]3CCCOc4ccc(F)cc43)c2)CC1 ZINC000473803294 888624778 /nfs/dbraw/zinc/62/47/78/888624778.db2.gz CNTQZVYZEUDWBE-OAQYLSRUSA-N 0 3 412.509 4.003 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CCC(Cc4cccc(F)c4)CC3)c2)CC1 ZINC000473819370 888649073 /nfs/dbraw/zinc/64/90/73/888649073.db2.gz NGPZQHUVBDDQRN-UHFFFAOYSA-N 0 3 424.564 4.454 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N(C)Cc3cc(Cl)ccc3OC)c2)CC1 ZINC000473820060 888649835 /nfs/dbraw/zinc/64/98/35/888649835.db2.gz IPGNUYSIXCJDNI-UHFFFAOYSA-N 0 3 416.953 4.154 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N(C)[C@H](C)c3c(F)cccc3F)c2)CC1 ZINC000473824216 888656639 /nfs/dbraw/zinc/65/66/39/888656639.db2.gz UTISFBKYOXKUAJ-MRXNPFEDSA-N 0 3 402.489 4.332 20 0 HIADHN CC[C@H](NC(=O)Nc1cccc(N2CCN(CC)CC2)c1)c1cc(F)ccc1F ZINC000473824347 888656692 /nfs/dbraw/zinc/65/66/92/888656692.db2.gz YOPBQTVIBKLITL-NRFANRHFSA-N 0 3 402.489 4.380 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N(C)[C@@H]3CCCc4nc(C)sc43)c2)CC1 ZINC000473828295 888661879 /nfs/dbraw/zinc/66/18/79/888661879.db2.gz JTNQSQWQUYACQO-HXUWFJFHSA-N 0 3 413.591 4.135 20 0 HIADHN CCc1cccc2c1OCC[C@@H]2NC(=O)Nc1cccc(N2CCN(CC)CC2)c1 ZINC000473837215 888675951 /nfs/dbraw/zinc/67/59/51/888675951.db2.gz PRRTXGWYSJMTLG-QFIPXVFZSA-N 0 3 408.546 4.036 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@@H](C)c3ccc(OC(F)F)cc3)c2)CC1 ZINC000473839999 888680581 /nfs/dbraw/zinc/68/05/81/888680581.db2.gz CFUTWNJIFUDKPR-INIZCTEOSA-N 0 3 418.488 4.313 20 0 HIADHN Cc1cc(C(=O)NC[C@H](c2ccccc2)N2CCCC2)nn1-c1ccc(F)cc1F ZINC000504480225 913275171 /nfs/dbraw/zinc/27/51/71/913275171.db2.gz MVIRURWIFSKNTN-JOCHJYFZSA-N 0 3 410.468 4.026 20 0 HIADHN C[C@@H](NC(=O)N(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1)c1cc2cccc(F)c2o1 ZINC000473885818 888753120 /nfs/dbraw/zinc/75/31/20/888753120.db2.gz KZTLPRXPUNEHOA-YWMUFLPLSA-N 0 3 410.493 4.362 20 0 HIADHN CC(C)c1ccc([C@@H](NC(=O)NC(C)(C)CCN2CCN(C)CC2)C(C)C)cc1 ZINC000473890456 888760021 /nfs/dbraw/zinc/76/00/21/888760021.db2.gz FWNCAIVZDKZDKI-QFIPXVFZSA-N 0 3 402.627 4.222 20 0 HIADHN Cn1cc(CCNC(=O)NC[C@H](c2cccs2)N2CCCC2)c2ccc(F)cc21 ZINC000473893386 888764557 /nfs/dbraw/zinc/76/45/57/888764557.db2.gz HDWKWEDGWCNDAA-HXUWFJFHSA-N 0 3 414.550 4.058 20 0 HIADHN COc1c(F)cc(F)cc1NC(=O)N1CCCN(CCCc2ccccc2)CC1 ZINC000473896372 888769945 /nfs/dbraw/zinc/76/99/45/888769945.db2.gz PEHQUVZOWCLHLF-UHFFFAOYSA-N 0 3 403.473 4.146 20 0 HIADHN CN1CCN(CCC(C)(C)NC(=O)N[C@H](CC(C)(C)C)c2ccc(F)cc2)CC1 ZINC000473897189 888770927 /nfs/dbraw/zinc/77/09/27/888770927.db2.gz TVSAVJOIVHAOFN-HXUWFJFHSA-N 0 3 406.590 4.018 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3ccc(C(F)(F)F)c(F)c3)CC2)C[C@H](C)O1 ZINC000473923160 888803265 /nfs/dbraw/zinc/80/32/65/888803265.db2.gz YDFYUTMDGFJCCW-GASCZTMLSA-N 0 3 416.459 4.196 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)N[C@@H](C)c2ccc(Br)cn2)N(C)C)cc1 ZINC000473967477 888835277 /nfs/dbraw/zinc/83/52/77/888835277.db2.gz GIIYGTOJQIVOLK-IFXJQAMLSA-N 0 3 419.367 4.070 20 0 HIADHN CCOC1CC(CCN[C@@H](c2cccc(S(C)(=O)=O)c2)c2ccc(F)c(F)c2)C1 ZINC000474028029 888878203 /nfs/dbraw/zinc/87/82/03/888878203.db2.gz CSFYXFFISLJARD-URWDPPFZSA-N 0 3 423.525 4.253 20 0 HIADHN C[C@H](N[C@@H]1CCN(c2ccc(Cl)cc2Cl)C1=O)c1ccc(-n2cncn2)cc1 ZINC000474090167 888916635 /nfs/dbraw/zinc/91/66/35/888916635.db2.gz RKBGWQCFGHMXFQ-SCLBCKFNSA-N 0 3 416.312 4.030 20 0 HIADHN CN(CCCCCc1cc(-c2ccccc2)n[nH]1)Cc1cnc(-c2cnn(C)c2)nc1 ZINC000474150229 888978536 /nfs/dbraw/zinc/97/85/36/888978536.db2.gz HUBSOBJIZQORMZ-UHFFFAOYSA-N 0 3 415.545 4.112 20 0 HIADHN C[C@H]1C[C@@H](c2ccc(C(F)(F)F)cc2)N(Cc2cnc(-c3cnn(C)c3)nc2)C1 ZINC000474260219 889117359 /nfs/dbraw/zinc/11/73/59/889117359.db2.gz QYIXZODQIKGDOE-LIRRHRJNSA-N 0 3 401.436 4.479 20 0 HIADHN Cn1c2ccc(CN3CCC[C@H](c4nc(-c5ccc(F)cc5)no4)C3)cc2sc1=O ZINC000474263717 889125047 /nfs/dbraw/zinc/12/50/47/889125047.db2.gz FLYPLDUTUFJLSK-INIZCTEOSA-N 0 3 424.501 4.169 20 0 HIADHN C[C@@H]1CCN(Cc2cnc(-c3cnn(C)c3)nc2)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000474270924 889131993 /nfs/dbraw/zinc/13/19/93/889131993.db2.gz PSMGDYZFNXNARM-AUUYWEPGSA-N 0 3 401.436 4.479 20 0 HIADHN COc1cc(NC(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)ccc1Br ZINC000474436790 889301505 /nfs/dbraw/zinc/30/15/05/889301505.db2.gz FEYIVUSMEYLFTG-FZKQIMNGSA-N 0 3 406.324 4.271 20 0 HIADHN Cc1cc(NC(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)ccc1OC1CCOCC1 ZINC000474443739 889309542 /nfs/dbraw/zinc/30/95/42/889309542.db2.gz FDTZFIPPXFPVIL-FDDCHVKYSA-N 0 3 411.546 4.366 20 0 HIADHN FC(F)(F)c1cc(Br)ccc1CNCc1ccnc(-n2cccn2)c1 ZINC000474462177 889327510 /nfs/dbraw/zinc/32/75/10/889327510.db2.gz RLSIPPRNJMPEQJ-UHFFFAOYSA-N 0 3 411.225 4.338 20 0 HIADHN CN(C(=O)Nc1ccc(OCC2CCOCC2)cc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000474608661 889473731 /nfs/dbraw/zinc/47/37/31/889473731.db2.gz WYGNQZYFRNJXAP-HSZRJFAPSA-N 0 3 423.557 4.230 20 0 HIADHN C[C@@H]1CN(c2ccccc2NC(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)C[C@@H](C)O1 ZINC000474730985 889586458 /nfs/dbraw/zinc/58/64/58/889586458.db2.gz ZVRXFMZUMMVMQW-SJBKTWHCSA-N 0 3 422.573 4.038 20 0 HIADHN CN(C(=O)Nc1ccc(F)cc1Br)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000474753128 889611838 /nfs/dbraw/zinc/61/18/38/889611838.db2.gz TXMMZPDFTPOAIO-MRXNPFEDSA-N 0 3 406.299 4.326 20 0 HIADHN Cc1sc(C(=O)NC(C)(C)CCN2CCN(C)CC2)cc1-c1ccc(F)cc1 ZINC000474802440 889655276 /nfs/dbraw/zinc/65/52/76/889655276.db2.gz QWSYENBAAQQIRF-UHFFFAOYSA-N 0 3 403.567 4.009 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)CSc3nccc4ccccc43)c2)CC1 ZINC000474829103 889686804 /nfs/dbraw/zinc/68/68/04/889686804.db2.gz KCTIADFZMSXAJG-UHFFFAOYSA-N 0 3 406.555 4.108 20 0 HIADHN CCc1ccccc1O[C@H](C(=O)NC1CCN(CCOC(C)C)CC1)c1ccccc1 ZINC000474872530 889726398 /nfs/dbraw/zinc/72/63/98/889726398.db2.gz JUTNJBZBXABHHS-VWLOTQADSA-N 0 3 424.585 4.375 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)COc2cc(Cl)c(Cl)cc2Cl)CC1 ZINC000474879858 889735018 /nfs/dbraw/zinc/73/50/18/889735018.db2.gz OQJNCEQKLIJEJY-UHFFFAOYSA-N 0 3 423.768 4.031 20 0 HIADHN Cc1ccccc1COc1ccccc1C(=O)NC1CCN(CCOC(C)C)CC1 ZINC000474889124 889746863 /nfs/dbraw/zinc/74/68/63/889746863.db2.gz VBGABJJTZFLSIV-UHFFFAOYSA-N 0 3 410.558 4.193 20 0 HIADHN Cc1cc(F)c(Br)cc1NC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000474949002 889805084 /nfs/dbraw/zinc/80/50/84/889805084.db2.gz ZIPHNCJBHMOYOZ-AEFFLSMTSA-N 0 3 406.299 4.464 20 0 HIADHN CCN(C(=O)Nc1ccc(C(=O)NC(C)C)cc1C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475001839 889853125 /nfs/dbraw/zinc/85/31/25/889853125.db2.gz LLZBHULNDVUINY-QFIPXVFZSA-N 0 3 422.573 4.262 20 0 HIADHN CCN(C(=O)Nc1cc(-c2n[nH]c(C)n2)ccc1C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475004947 889855692 /nfs/dbraw/zinc/85/56/92/889855692.db2.gz XKDCKQBDNYNLCC-OAQYLSRUSA-N 0 3 418.545 4.217 20 0 HIADHN CCN(C(=O)N[C@@H](C)c1cc(OC)ccc1OC)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475005891 889857532 /nfs/dbraw/zinc/85/75/32/889857532.db2.gz CJYZUWDQTYKJNM-ICSRJNTNSA-N 0 3 411.546 4.071 20 0 HIADHN CCN(C(=O)N[C@@H](c1ccccc1)c1ccccn1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475008479 889862517 /nfs/dbraw/zinc/86/25/17/889862517.db2.gz NZWRJDSOUIRZNS-ZCYQVOJMSA-N 0 3 414.553 4.477 20 0 HIADHN CCN(C(=O)Nc1cc(C)n(-c2ccccc2)n1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475011763 889865183 /nfs/dbraw/zinc/86/51/83/889865183.db2.gz BCLOYVLTJMXXBW-JOCHJYFZSA-N 0 3 403.530 4.309 20 0 HIADHN C[C@@H]1CCN(C(=O)Nc2ccccc2OCC(F)F)CCN1Cc1ccccc1 ZINC000475031772 889884244 /nfs/dbraw/zinc/88/42/44/889884244.db2.gz VQKYDLUPFHMJTI-QGZVFWFLSA-N 0 3 403.473 4.459 20 0 HIADHN O=C(NC(CCc1ccccc1)CCc1ccccc1)N1CC[C@@H](N2CC=CC2)C1 ZINC000475069370 889915041 /nfs/dbraw/zinc/91/50/41/889915041.db2.gz YADGQANDEPPGJV-RUZDIDTESA-N 0 3 403.570 4.276 20 0 HIADHN CN(C(=O)NCc1ccc(Oc2ccccc2)nc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475113543 889964352 /nfs/dbraw/zinc/96/43/52/889964352.db2.gz VRGHCQLAAZBHLS-JOCHJYFZSA-N 0 3 416.525 4.290 20 0 HIADHN CN(C(=O)NCc1cc(F)cc(Br)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475127234 889988518 /nfs/dbraw/zinc/98/85/18/889988518.db2.gz BRXKUIIELNBMHH-IBGZPJMESA-N 0 3 420.326 4.004 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N[C@@H](C)C1CCOCC1)c1ccc(C(F)(F)F)cc1 ZINC000475133796 889998353 /nfs/dbraw/zinc/99/83/53/889998353.db2.gz BELAKRRLIQFSKS-KXBFYZLASA-N 0 3 415.500 4.203 20 0 HIADHN C[C@H](NC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1)c1cccc(OC(F)F)c1 ZINC000475144158 890012029 /nfs/dbraw/zinc/01/20/29/890012029.db2.gz SLNBZBUIFOMMCY-LPHOPBHVSA-N 0 3 403.473 4.265 20 0 HIADHN CCN(C(=O)N[C@@H]1CCO[C@H](c2ccccc2)C1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475164757 890030563 /nfs/dbraw/zinc/03/05/63/890030563.db2.gz PNXCFVZUKBRVIN-SMIHKQSGSA-N 0 3 407.558 4.213 20 0 HIADHN CCN(C(=O)NC[C@@H]1CCCO[C@H]1c1ccccc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475172749 890040229 /nfs/dbraw/zinc/04/02/29/890040229.db2.gz GCTRFJLEDBNHOR-GVAUOCQISA-N 0 3 421.585 4.460 20 0 HIADHN CCCC(=O)Nc1ccc(CNC(=O)N(CC)[C@@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000475186057 890055542 /nfs/dbraw/zinc/05/55/42/890055542.db2.gz WYNUQRXUPKQNFI-HSZRJFAPSA-N 0 3 422.573 4.231 20 0 HIADHN COC(=O)C[C@@H]1CC[C@H](N[C@H](C)c2nc(-c3ccc(Br)cc3)no2)[C@@H]1C ZINC000475192807 890061398 /nfs/dbraw/zinc/06/13/98/890061398.db2.gz BZZJUOSNDTWFFX-HLSYRSCKSA-N 0 3 422.323 4.128 20 0 HIADHN Fc1ccc(Br)c(CNCCCCn2cc(Br)cn2)c1 ZINC000475224027 890093339 /nfs/dbraw/zinc/09/33/39/890093339.db2.gz LCAJEAKUJIPELF-UHFFFAOYSA-N 0 3 405.109 4.117 20 0 HIADHN C[C@@H](NC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1)c1cccc(N2CCCC2)c1 ZINC000475289867 890190940 /nfs/dbraw/zinc/19/09/40/890190940.db2.gz CXLXGZGGNKMBLR-YKSBVNFPSA-N 0 3 406.574 4.264 20 0 HIADHN CC(C)c1noc(-c2ccccc2C(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000475303388 890213070 /nfs/dbraw/zinc/21/30/70/890213070.db2.gz HVUFXYSVLGEDNO-LJQANCHMSA-N 0 3 404.514 4.207 20 0 HIADHN CN(C(=O)Cc1ccc(NC(=O)CC(C)(C)C)cc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475315204 890228947 /nfs/dbraw/zinc/22/89/47/890228947.db2.gz JFHDRZLDAXZILI-HSZRJFAPSA-N 0 3 421.585 4.337 20 0 HIADHN CN(C(=O)CCCc1ncc(-c2ccccc2)o1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475314407 890229537 /nfs/dbraw/zinc/22/95/37/890229537.db2.gz UBYIZNRNNXYWTF-JOCHJYFZSA-N 0 3 403.526 4.397 20 0 HIADHN Cc1nc(CCC(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)oc1-c1ccccc1 ZINC000475316058 890232051 /nfs/dbraw/zinc/23/20/51/890232051.db2.gz KTBFIIVOUPKSIC-QFIPXVFZSA-N 0 3 403.526 4.316 20 0 HIADHN O=C(CC1(N2CCOCC2)CCCC1)N1CCC(c2ccccc2C(F)(F)F)CC1 ZINC000475422518 890344544 /nfs/dbraw/zinc/34/45/44/890344544.db2.gz RCJOBKSGPZGAJB-UHFFFAOYSA-N 0 3 424.507 4.447 20 0 HIADHN CCCOc1cc(OC)ccc1C(=O)Nc1ccc(N2CCN(CC)CC2)cc1C ZINC000475480169 890386236 /nfs/dbraw/zinc/38/62/36/890386236.db2.gz SSQCFLQLJDDGOP-UHFFFAOYSA-N 0 3 411.546 4.187 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)Cc1cnc2ccccc2c1 ZINC000475506232 890421788 /nfs/dbraw/zinc/42/17/88/890421788.db2.gz XREUOMFDRABDCW-UHFFFAOYSA-N 0 3 415.459 4.387 20 0 HIADHN Cc1nc(CC2CC2)oc1C(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1 ZINC000475507949 890424871 /nfs/dbraw/zinc/42/48/71/890424871.db2.gz NSAVGUYGZFMJBB-UHFFFAOYSA-N 0 3 409.452 4.158 20 0 HIADHN CC(C)Cn1ccc2cc(NC(=O)NC3CCN(CCOC(C)C)CC3)ccc21 ZINC000475603084 890529907 /nfs/dbraw/zinc/52/99/07/890529907.db2.gz MHAQYTCCXNSMEH-UHFFFAOYSA-N 0 3 400.567 4.308 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)Nc2cc(F)ccc2SCC(F)F)CC1 ZINC000475630895 890571225 /nfs/dbraw/zinc/57/12/25/890571225.db2.gz KGXRDIDABMXIJZ-UHFFFAOYSA-N 0 3 419.513 4.194 20 0 HIADHN Cc1nc(CN(C)[C@H]2CCCN(Cc3c(Cl)cccc3N3CCCC3)CC2)no1 ZINC000475630320 890571248 /nfs/dbraw/zinc/57/12/48/890571248.db2.gz ZJCRHAXROXLLGI-SFHVURJKSA-N 0 3 417.985 4.118 20 0 HIADHN C[C@H]1CCN(C(=O)Nc2cnc(-c3ccccc3)nc2)CCN1Cc1ccccc1 ZINC000475664137 890610432 /nfs/dbraw/zinc/61/04/32/890610432.db2.gz XRUKDOXIFYCXMY-IBGZPJMESA-N 0 3 401.514 4.272 20 0 HIADHN COc1ccc2cc(CN(C)C(=O)[C@@H](C)N3CCC[C@]4(CCCOC4)C3)ccc2c1 ZINC000475739900 890682629 /nfs/dbraw/zinc/68/26/29/890682629.db2.gz YFSUYCHYYFUYSL-CLOONOSVSA-N 0 3 410.558 4.088 20 0 HIADHN C[C@@H](c1ccc([S@](C)=O)cc1)N(C)CCC(=O)Nc1ccc(Br)cc1 ZINC000475745518 890689000 /nfs/dbraw/zinc/68/90/00/890689000.db2.gz DMQHGNPYHYHQTQ-SXBQZSJRSA-N 0 3 423.376 4.208 20 0 HIADHN CCc1onc(-c2ccccc2Cl)c1C(=O)NCC(C)(C)N1CCC(OC)CC1 ZINC000475759965 890707315 /nfs/dbraw/zinc/70/73/15/890707315.db2.gz RIRPRBAJYVRWJB-UHFFFAOYSA-N 0 3 419.953 4.177 20 0 HIADHN CC1CCN([C@H](CNC(=O)Nc2ccc([S@@](C)=O)c(F)c2)c2cccs2)CC1 ZINC000475855375 890789807 /nfs/dbraw/zinc/78/98/07/890789807.db2.gz YKKOBFFASRMLCL-JYRCXFKTSA-N 0 3 423.579 4.219 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N(C)Cc2nc3c(s2)CCCC3)N2CCCC2)cc1 ZINC000475911717 890840337 /nfs/dbraw/zinc/84/03/37/890840337.db2.gz VERMUCHWOUQPNO-HXUWFJFHSA-N 0 3 412.603 4.309 20 0 HIADHN C[C@@H](NC(=O)N[C@H]1CCN(Cc2ccccc2)C1)c1ccc(-c2cccnc2)cc1 ZINC000475947148 890869153 /nfs/dbraw/zinc/86/91/53/890869153.db2.gz SGCVMGQHSKOLCG-DVECYGJZSA-N 0 3 400.526 4.383 20 0 HIADHN CC[C@H](NC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1CO)c1ccc(Cl)s1 ZINC000476026707 890957659 /nfs/dbraw/zinc/95/76/59/890957659.db2.gz CGPQOXWIVCBMJY-OKZBNKHCSA-N 0 3 421.994 4.035 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)NC(c2cccs2)c2cccs2)CC1 ZINC000476032481 890964538 /nfs/dbraw/zinc/96/45/38/890964538.db2.gz JTHDHIQWOCLVML-UHFFFAOYSA-N 0 3 407.605 4.088 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)NC2(c3ccc(Cl)cc3)CCCC2)CC1 ZINC000476048943 890980973 /nfs/dbraw/zinc/98/09/73/890980973.db2.gz IEOUHGKPVSNOGS-UHFFFAOYSA-N 0 3 407.986 4.298 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)NCC2(Sc3ccccc3)CCCC2)CC1 ZINC000476056153 890985309 /nfs/dbraw/zinc/98/53/09/890985309.db2.gz OZFPJIMKZGRYKM-UHFFFAOYSA-N 0 3 419.635 4.280 20 0 HIADHN CN(C(=O)N[C@H](c1ccc(F)cc1)c1ccccc1Cl)[C@@H]1CCN(C2CC2)C1 ZINC000476127612 891050330 /nfs/dbraw/zinc/05/03/30/891050330.db2.gz AYECRBUDUDJAPE-WIYYLYMNSA-N 0 3 401.913 4.447 20 0 HIADHN COc1cccc(C2=CCN(C(=O)[C@H]3CCCN(Cc4cccc(F)c4)C3)CC2)c1 ZINC000476157508 891082302 /nfs/dbraw/zinc/08/23/02/891082302.db2.gz PJIAXPUAYDEMGQ-QFIPXVFZSA-N 0 3 408.517 4.362 20 0 HIADHN COc1ccc(Br)c(NC(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)c1 ZINC000476232134 891155400 /nfs/dbraw/zinc/15/54/00/891155400.db2.gz XJHFVYNPBOJKTF-ACJLOTCBSA-N 0 3 406.324 4.271 20 0 HIADHN CCc1onc(-c2ccc(Br)cc2)c1C(=O)N[C@H]1C[C@@H](C)N(C2CC2)C1 ZINC000476297292 891211637 /nfs/dbraw/zinc/21/16/37/891211637.db2.gz DGBAFUDDMNTCHR-DOMZBBRYSA-N 0 3 418.335 4.022 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)Nc1cccc2c1CN(CC(F)(F)F)C2 ZINC000476364032 891270325 /nfs/dbraw/zinc/27/03/25/891270325.db2.gz KWAFUQYSBOJNAV-MRXNPFEDSA-N 0 3 420.479 4.207 20 0 HIADHN CO[C@@H]1CCC[C@H](CC(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)C1 ZINC000476415726 891329481 /nfs/dbraw/zinc/32/94/81/891329481.db2.gz OCCGAPYHJKNAQN-FDFHNCONSA-N 0 3 410.562 4.172 20 0 HIADHN CC[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)NC1CCN(CCOC(C)C)CC1 ZINC000476437372 891348954 /nfs/dbraw/zinc/34/89/54/891348954.db2.gz OXKOEQAHMLOKJU-GOTSBHOMSA-N 0 3 401.595 4.244 20 0 HIADHN CC[C@H](Cc1ccc(C)cc1)N(CC)C(=O)NC1CCN(CCOC(C)C)CC1 ZINC000476456235 891368268 /nfs/dbraw/zinc/36/82/68/891368268.db2.gz YRLYXZIUSMITHA-HSZRJFAPSA-N 0 3 403.611 4.237 20 0 HIADHN c1cc(-c2nc(-c3ccc(N4CCCCC4)nc3)no2)ccc1CN1CCSCC1 ZINC000504839095 913561439 /nfs/dbraw/zinc/56/14/39/913561439.db2.gz UNTLJGBZWSHUMJ-UHFFFAOYSA-N 0 3 421.570 4.338 20 0 HIADHN O=C(Nc1cccc2c1CN(CC(F)(F)F)C2)N1CCN(CC2CCCCC2)CC1 ZINC000504837339 913560304 /nfs/dbraw/zinc/56/03/04/913560304.db2.gz QSOONPQEPZWQEH-UHFFFAOYSA-N 0 3 424.511 4.294 20 0 HIADHN C[C@@H](c1ccc(F)c(F)c1)N(C)C(=O)CN1CC[C@@H](COCc2ccccc2)C1 ZINC000476586949 891514904 /nfs/dbraw/zinc/51/49/04/891514904.db2.gz GHVVWZRVMORVEL-PKOBYXMFSA-N 0 3 402.485 4.023 20 0 HIADHN C[C@H](c1ccc(Cl)cc1)N(C)C(=O)CN1CC[C@H](COCc2ccccc2)C1 ZINC000476590084 891520972 /nfs/dbraw/zinc/52/09/72/891520972.db2.gz YHAAIIFQAWADGL-QUCCMNQESA-N 0 3 400.950 4.398 20 0 HIADHN CC(C)n1ncc2ccc(NC(=O)N(CCN(C)C)Cc3ccc(F)cc3F)cc21 ZINC000476596189 891529522 /nfs/dbraw/zinc/52/95/22/891529522.db2.gz LKMDNTNIFLOPOU-UHFFFAOYSA-N 0 3 415.488 4.491 20 0 HIADHN O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCC(c2c[nH]c3cc(F)ccc32)CC1 ZINC000476653845 891598198 /nfs/dbraw/zinc/59/81/98/891598198.db2.gz MXLJGPOUAAJWDQ-NRFANRHFSA-N 0 3 420.532 4.471 20 0 HIADHN CC(C)[C@H](CNC(=O)Nc1cccc(N2CCCC2=O)c1)N1CCc2ccccc2C1 ZINC000504849003 913573734 /nfs/dbraw/zinc/57/37/34/913573734.db2.gz OKFGACATDQXQFG-QHCPKHFHSA-N 0 3 420.557 4.018 20 0 HIADHN CCc1onc(-c2ccc(Br)cc2)c1C(=O)N[C@@H](C)C1=CCN(C)CC1 ZINC000476658573 891604653 /nfs/dbraw/zinc/60/46/53/891604653.db2.gz KRSPDGQPLUDBBE-ZDUSSCGKSA-N 0 3 418.335 4.047 20 0 HIADHN C[C@@H]1CO[C@@H](c2ccccc2Cl)CN1C(=O)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000476657577 891604904 /nfs/dbraw/zinc/60/49/04/891604904.db2.gz PTQSBRQVKUMXSS-ZWCUEREDSA-N 0 3 413.949 4.086 20 0 HIADHN CN(C(=O)NC[C@@H]1CC2c3ccccc3C1c1ccccc12)[C@H]1CCN(C2CC2)C1 ZINC000476680300 891631344 /nfs/dbraw/zinc/63/13/44/891631344.db2.gz ADBYCCNQJPLWPR-XWXQCQSESA-N 0 3 401.554 4.162 20 0 HIADHN CC(C)c1nc2c([nH]1)C[C@@H](C(=O)NC[C@@H](c1cccc(C(F)(F)F)c1)N(C)C)CC2 ZINC000476725688 891690585 /nfs/dbraw/zinc/69/05/85/891690585.db2.gz MJGBOVJTBGAWHO-KXBFYZLASA-N 0 3 422.495 4.076 20 0 HIADHN CC(C)c1nc2c([nH]1)CC[C@H](C(=O)NC[C@@H](c1cccc(C(F)(F)F)c1)N(C)C)C2 ZINC000476725688 891690600 /nfs/dbraw/zinc/69/06/00/891690600.db2.gz MJGBOVJTBGAWHO-KXBFYZLASA-N 0 3 422.495 4.076 20 0 HIADHN Cc1nc(-c2ccc(CNC(=O)N[C@H]3CCN(Cc4ccccc4)[C@H]3C)o2)cs1 ZINC000476736160 891703407 /nfs/dbraw/zinc/70/34/07/891703407.db2.gz KHPFKHFXLXWWOO-KXBFYZLASA-N 0 3 410.543 4.174 20 0 HIADHN COc1cc(N[C@H]2CCCN(C(=O)c3cccc(CN4CCCC4)c3)C2)cc(OC)c1 ZINC000476779807 891759704 /nfs/dbraw/zinc/75/97/04/891759704.db2.gz OJMDTUWGOJZTBP-NRFANRHFSA-N 0 3 423.557 4.016 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)N(Cc2ccccc2)CC2CCOCC2)C1 ZINC000476816889 891803051 /nfs/dbraw/zinc/80/30/51/891803051.db2.gz OKJGPEHAYZSTNC-SQJMNOBHSA-N 0 3 421.585 4.460 20 0 HIADHN O=C(Nc1ccc(OC[C@@H]2CCCO2)cc1)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000504877513 913605345 /nfs/dbraw/zinc/60/53/45/913605345.db2.gz UVSRVHPLTCHFSZ-GGAORHGYSA-N 0 3 409.530 4.031 20 0 HIADHN COc1ccc([C@@H](C)NC(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)cc1F ZINC000476905747 891859432 /nfs/dbraw/zinc/85/94/32/891859432.db2.gz VIWCPFWQUVBZFQ-IIBYNOLFSA-N 0 3 417.525 4.285 20 0 HIADHN CC(C)(C)C1=CCN(CCNC(=O)CCc2nc(-c3ccc(Cl)cc3)no2)CC1 ZINC000476925587 891872739 /nfs/dbraw/zinc/87/27/39/891872739.db2.gz JKUHINVQCOHMAF-UHFFFAOYSA-N 0 3 416.953 4.117 20 0 HIADHN Cc1c(Br)scc1C(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000476931886 891875948 /nfs/dbraw/zinc/87/59/48/891875948.db2.gz ZSXITICKICZNBM-UHFFFAOYSA-N 0 3 423.376 4.276 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1cccc(-c2noc(C3CC3)n2)c1)c1ccco1 ZINC000477031479 891956751 /nfs/dbraw/zinc/95/67/51/891956751.db2.gz GAJSFQLZEWDJDC-KSSFIOAISA-N 0 3 409.490 4.458 20 0 HIADHN CN(Cc1ccc(Br)s1)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000504884261 913615541 /nfs/dbraw/zinc/61/55/41/913615541.db2.gz ZUWZBVDJNCXYAB-INIZCTEOSA-N 0 3 422.392 4.317 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1ccc(Oc2nccc(C)n2)cc1)c1ccco1 ZINC000477110897 892042177 /nfs/dbraw/zinc/04/21/77/892042177.db2.gz FNLTZAOJBJBTTC-KXBFYZLASA-N 0 3 409.490 4.421 20 0 HIADHN CCc1noc(-c2ccc(C)c(NC(=O)N[C@H](CN(C)C)c3ccc(F)cc3)c2)n1 ZINC000477193654 892118729 /nfs/dbraw/zinc/11/87/29/892118729.db2.gz YWBSEEILRLQMNX-LJQANCHMSA-N 0 3 411.481 4.171 20 0 HIADHN CC(C)n1cnnc1-c1ccccc1NC(=O)N[C@@H](CN(C)C)c1ccc(F)cc1 ZINC000477222283 892158188 /nfs/dbraw/zinc/15/81/88/892158188.db2.gz OKFVLFNDXXIBDL-FQEVSTJZSA-N 0 3 410.497 4.090 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3CCC[C@H](Nc4ccccc4)C3)c(C)c2)CC1 ZINC000477333925 892302505 /nfs/dbraw/zinc/30/25/05/892302505.db2.gz UVVMFZLJSITFRV-QFIPXVFZSA-N 0 3 421.589 4.245 20 0 HIADHN C[C@@H](CNC(=O)N(Cc1cccc(F)c1)C[C@H]1CCCO1)N(C)Cc1ccccc1 ZINC000477339549 892307087 /nfs/dbraw/zinc/30/70/87/892307087.db2.gz HHZDNXWNSFBRNR-WMZHIEFXSA-N 0 3 413.537 4.037 20 0 HIADHN C[C@@H](c1cccc(C(F)(F)F)c1)N(C)S(=O)(=O)c1ccc(CN(C)C)cc1 ZINC000477512718 892524779 /nfs/dbraw/zinc/52/47/79/892524779.db2.gz FHSIZLFHCPDUIA-AWEZNQCLSA-N 0 3 400.466 4.149 20 0 HIADHN CN(C)C[C@@H](NC(=O)NCc1ccc(F)cc1C(F)(F)F)c1ccc(F)cc1 ZINC000477585915 892654203 /nfs/dbraw/zinc/65/42/03/892654203.db2.gz IKFWYVYADLZOJY-QGZVFWFLSA-N 0 3 401.379 4.086 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)c2cccc(Oc3ccc(Cl)cc3)c2)CC1 ZINC000477634750 892756943 /nfs/dbraw/zinc/75/69/43/892756943.db2.gz GHOANUCMLJFPAN-SFHVURJKSA-N 0 3 415.965 4.136 20 0 HIADHN Cc1cccc(CC2(O)CCN(C(=O)c3oc4ccccc4c3CN(C)C)CC2)c1 ZINC000477669407 892802824 /nfs/dbraw/zinc/80/28/24/892802824.db2.gz DLTFCTIFUGCEIR-UHFFFAOYSA-N 0 3 406.526 4.013 20 0 HIADHN Cc1nc(-c2ccccc2NC(=O)CCN2CCN(c3ccccc3)CC2)cs1 ZINC000477708238 892820685 /nfs/dbraw/zinc/82/06/85/892820685.db2.gz QQXUYWGEIJEDHF-UHFFFAOYSA-N 0 3 406.555 4.269 20 0 HIADHN CC[C@H](Oc1ccccc1Cl)C(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000477719535 892825110 /nfs/dbraw/zinc/82/51/10/892825110.db2.gz BPPSEEAGRNCRNT-NRFANRHFSA-N 0 3 416.949 4.340 20 0 HIADHN CCN(C[C@@H]1CCN([C@H](C)C(=O)N(Cc2ccccc2)C(C)C)C1)CC(F)(F)F ZINC000477723495 892827140 /nfs/dbraw/zinc/82/71/40/892827140.db2.gz JQTQJMYWBGEGLJ-QUCCMNQESA-N 0 3 413.528 4.018 20 0 HIADHN C[C@@H]1C[C@@H]1c1ccc([C@@H]2C[C@@H]2C(=O)Nc2cccc(CN3CCC(CO)CC3)c2)o1 ZINC000477735810 892833484 /nfs/dbraw/zinc/83/34/84/892833484.db2.gz BIMAAEKRKXHHPO-ZJMJOCHXSA-N 0 3 408.542 4.350 20 0 HIADHN CCOC(=O)c1oc2ccccc2c1CN1CC[C@H](CN(CC)CC(F)(F)F)C1 ZINC000477741589 892836777 /nfs/dbraw/zinc/83/67/77/892836777.db2.gz OZHUXNYEBBQWJX-OAHLLOKOSA-N 0 3 412.452 4.316 20 0 HIADHN CCN(C[C@@H]1CCN([C@H](C)C(=O)N[C@H](C)c2ccc(Cl)cc2)C1)CC(F)(F)F ZINC000477760716 892850262 /nfs/dbraw/zinc/85/02/62/892850262.db2.gz QAJDYSIEXZOKNW-OAGGEKHMSA-N 0 3 419.919 4.112 20 0 HIADHN Cc1ccc(COc2ccc(C[C@@H](C)NC(=O)N(C)[C@@H]3CCN(C4CC4)C3)cc2)cc1 ZINC000477764678 892852766 /nfs/dbraw/zinc/85/27/66/892852766.db2.gz SYUKXVDSEVMUST-HYBUGGRVSA-N 0 3 421.585 4.383 20 0 HIADHN CC(C)(C)[C@H](CN1CCc2ccccc2C1)NC(=O)Nc1ccc2c(c1)NC(=O)CC2 ZINC000477778455 892861764 /nfs/dbraw/zinc/86/17/64/892861764.db2.gz HCBXNOMSOIBUFY-QFIPXVFZSA-N 0 3 420.557 4.166 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCc1ncoc1-c1ccccc1)c1cccc(OC)c1 ZINC000477821498 892888648 /nfs/dbraw/zinc/88/86/48/892888648.db2.gz MHZLWAMPZNAFLU-QFIPXVFZSA-N 0 3 422.529 4.233 20 0 HIADHN Cc1cc(Br)ccc1NC(=O)NCC1(N2CCSCC2)CCCC1 ZINC000504972004 913712207 /nfs/dbraw/zinc/71/22/07/913712207.db2.gz ZTHMOPXPMCSNGM-UHFFFAOYSA-N 0 3 412.397 4.241 20 0 HIADHN COC(=O)c1csc(-c2cccc(CN[C@@H](C)c3ccc4c(c3)OCCO4)c2)n1 ZINC000477867768 892926442 /nfs/dbraw/zinc/92/64/42/892926442.db2.gz UFXCFHANXFTFJD-AWEZNQCLSA-N 0 3 410.495 4.219 20 0 HIADHN O=C(N[C@@H](Cc1ccc(Cl)cc1)c1ccccn1)N1CCN(C2CCCC2)CC1 ZINC000504973324 913714788 /nfs/dbraw/zinc/71/47/88/913714788.db2.gz RLEKTWUYPDDNHV-QFIPXVFZSA-N 0 3 412.965 4.289 20 0 HIADHN COC(=O)C1CCN(CCCNC(=O)c2ccc(-c3ccc(Cl)cc3)s2)CC1 ZINC000477885239 892951106 /nfs/dbraw/zinc/95/11/06/892951106.db2.gz WYFJTYSZAWFDEW-UHFFFAOYSA-N 0 3 420.962 4.073 20 0 HIADHN Cc1ccc(CN2CC[C@H](N[C@H](C)CC(=O)Nc3ccccc3C(C)C)C2=O)cc1 ZINC000477915618 892996522 /nfs/dbraw/zinc/99/65/22/892996522.db2.gz LFSIOKVYCQGQIT-XXBNENTESA-N 0 3 407.558 4.226 20 0 HIADHN Cc1ccc(CN2CC[C@@H](N[C@H](C)c3ccc(OCC(F)(F)F)cc3)C2=O)cc1 ZINC000477919350 893003899 /nfs/dbraw/zinc/00/38/99/893003899.db2.gz QJESQCBUHMCYBP-OXQOHEQNSA-N 0 3 406.448 4.388 20 0 HIADHN C[C@@H](N[C@@H]1CCN(Cc2ccc(F)cc2)C1=O)c1ccc(OCC(F)(F)F)cc1 ZINC000477924259 893011861 /nfs/dbraw/zinc/01/18/61/893011861.db2.gz YPCKPGGEKPAHFN-AUUYWEPGSA-N 0 3 410.411 4.219 20 0 HIADHN Cc1cc([C@H](NC[C@@H](CO)Cc2ccc(F)c(F)c2)c2cccnc2)ccc1F ZINC000477931257 893020541 /nfs/dbraw/zinc/02/05/41/893020541.db2.gz MOSVRMFTCSVXRX-SBUREZEXSA-N 0 3 400.444 4.338 20 0 HIADHN CCCN(C(=O)CCc1nc2ccccc2[nH]1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000505005968 913748942 /nfs/dbraw/zinc/74/89/42/913748942.db2.gz PAUUBIPVRJSNCS-NRFANRHFSA-N 0 3 404.558 4.399 20 0 HIADHN CC1CCN([C@H](CNC(=O)N[C@@H]2CCO[C@@H](C(C)(C)C)C2)c2cccs2)CC1 ZINC000478219859 893378630 /nfs/dbraw/zinc/37/86/30/893378630.db2.gz LKDJZZHQWRHHTE-QWFCFKBJSA-N 0 3 407.624 4.414 20 0 HIADHN CCN(CC(=O)Nc1c(Cl)cccc1Cl)C(=O)[C@H](C)N1[C@H](C)CC[C@H]1C ZINC000478231933 893393376 /nfs/dbraw/zinc/39/33/76/893393376.db2.gz HEXRGXRXFXTTIV-MCIONIFRSA-N 0 3 400.350 4.042 20 0 HIADHN CCOc1c(Cl)cccc1CC(=O)NC[C@H](c1ccc(OC)cc1)N1CCCC1 ZINC000478233991 893395289 /nfs/dbraw/zinc/39/52/89/893395289.db2.gz UFLGNIYETIIARA-OAQYLSRUSA-N 0 3 416.949 4.243 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N2CC3(CCOCC3)c3ccccc32)N(C)C)cc1 ZINC000478448615 893763646 /nfs/dbraw/zinc/76/36/46/893763646.db2.gz PHMFXIUHTMUGCD-QHCPKHFHSA-N 0 3 407.558 4.130 20 0 HIADHN COc1cnccc1N1CCN(C(=O)c2sc(C3CC3)nc2-c2ccccc2)CC1 ZINC000478465718 893791257 /nfs/dbraw/zinc/79/12/57/893791257.db2.gz HDGWJVKJVJNKII-UHFFFAOYSA-N 0 3 420.538 4.054 20 0 HIADHN Cc1coc(-c2cc(NC(=O)CCCN3CCN(c4ccccc4)CC3)ccc2C)n1 ZINC000478483422 893806750 /nfs/dbraw/zinc/80/67/50/893806750.db2.gz AMSZCNXVIPNCEE-UHFFFAOYSA-N 0 3 418.541 4.499 20 0 HIADHN Cc1nc(COc2ccc(F)cc2)sc1C(=O)NC[C@H](C)N1CCC[C@H](C)C1 ZINC000478487985 893808838 /nfs/dbraw/zinc/80/88/38/893808838.db2.gz PYGTYXFFEHMQAH-GJZGRUSLSA-N 0 3 405.539 4.020 20 0 HIADHN CC(C)[C@@H](C(=O)N[C@H](C)c1nc(-c2ccc(Br)cc2)cs1)N(C)C ZINC000478503069 893816596 /nfs/dbraw/zinc/81/65/96/893816596.db2.gz DQCGXWJGZANFMX-WBMJQRKESA-N 0 3 410.381 4.336 20 0 HIADHN CC1CCN([C@H](CNC(=O)c2ccc(-c3ccccn3)[nH]c2=O)c2cccs2)CC1 ZINC000478522523 893828353 /nfs/dbraw/zinc/82/83/53/893828353.db2.gz WIKMBTADKKAQOY-HXUWFJFHSA-N 0 3 422.554 4.114 20 0 HIADHN COc1cccc([C@@H](CNC(=O)NCC2(c3ccc(F)cc3)CC2)N2CCCC2)c1 ZINC000505079951 913808788 /nfs/dbraw/zinc/80/87/88/913808788.db2.gz MEXCVIDXBMBDLJ-JOCHJYFZSA-N 0 3 411.521 4.002 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)N[C@@H](C)c2nc(C(C)(C)C)cs2)c1 ZINC000478605606 893870588 /nfs/dbraw/zinc/87/05/88/893870588.db2.gz FKYXCUGPGLKWTO-INIZCTEOSA-N 0 3 418.607 4.284 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)Nc2ccc(Cl)cc2Br)CC1 ZINC000478752025 894027814 /nfs/dbraw/zinc/02/78/14/894027814.db2.gz BYUJACQAUWBQRH-UHFFFAOYSA-N 0 3 418.763 4.113 20 0 HIADHN CC(C)NC(=O)Nc1ccc([C@@H](C)N[C@H]2CCCN(c3ccccc3F)C2=O)cc1 ZINC000478980317 894257286 /nfs/dbraw/zinc/25/72/86/894257286.db2.gz YLYRFFIQWLMVSY-UZLBHIALSA-N 0 3 412.509 4.202 20 0 HIADHN Cc1cc(C)c(S(N)(=O)=O)cc1[C@@H](C)N[C@@H]1CCCc2cc(OC(F)F)ccc21 ZINC000479059541 894318002 /nfs/dbraw/zinc/31/80/02/894318002.db2.gz LEMBEEKUCZTFJN-AUUYWEPGSA-N 0 3 424.513 4.280 20 0 HIADHN Cc1cc(C)c(S(N)(=O)=O)cc1[C@H](C)N[C@H](C)c1ccc(-c2cccnc2)cc1 ZINC000479062418 894322715 /nfs/dbraw/zinc/32/27/15/894322715.db2.gz BDIWAFYJRDHBQE-MSOLQXFVSA-N 0 3 409.555 4.425 20 0 HIADHN COc1cc2c(cc1OC)[C@H](NCc1ccc(NC(=O)c3cccnc3)cc1)CC2 ZINC000479062748 894324016 /nfs/dbraw/zinc/32/40/16/894324016.db2.gz OMGXLBXTNWLIFV-OAQYLSRUSA-N 0 3 403.482 4.128 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccc(F)c2)C1)N1CCC(N2CCc3ccccc32)CC1 ZINC000505168691 913858417 /nfs/dbraw/zinc/85/84/17/913858417.db2.gz ZNYDFRMUSVIVFR-JOCHJYFZSA-N 0 3 421.560 4.091 20 0 HIADHN CCO[C@H](CCN[C@@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl)C1CCCC1 ZINC000479069876 894334466 /nfs/dbraw/zinc/33/44/66/894334466.db2.gz QCXZRZJAJWTWFY-YVEFUNNKSA-N 0 3 423.406 4.277 20 0 HIADHN Cc1c2ccccc2oc1[C@@H](C)NC(=O)N1CCC(CN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000479232656 894494363 /nfs/dbraw/zinc/49/43/63/894494363.db2.gz VKNNGDNNOPXUCF-JENIJYKNSA-N 0 3 413.562 4.333 20 0 HIADHN CSc1cccc(N(C(=O)c2cn3cc(C)nc3s2)C2CCN(C)CC2)c1 ZINC000505207119 913883823 /nfs/dbraw/zinc/88/38/23/913883823.db2.gz KWIASEDJLYITOT-UHFFFAOYSA-N 0 3 400.573 4.167 20 0 HIADHN CCOc1ccc([C@@H](C)NC(=O)N(Cc2ccco2)C2CCN(C)CC2)cc1OC ZINC000505210358 913885196 /nfs/dbraw/zinc/88/51/96/913885196.db2.gz LVDNYDHATLYPNI-QGZVFWFLSA-N 0 3 415.534 4.054 20 0 HIADHN Cc1ccc(CCN[C@@H](C)c2cc(S(N)(=O)=O)c(Cl)cc2Cl)c(C)c1 ZINC000479334327 894627633 /nfs/dbraw/zinc/62/76/33/894627633.db2.gz IHXQIXCCGCRYDK-ZDUSSCGKSA-N 0 3 401.359 4.151 20 0 HIADHN O=C(NCCN[C@H](c1ccc(Br)cc1F)C1CC1)c1ccccc1F ZINC000479347595 894643327 /nfs/dbraw/zinc/64/33/27/894643327.db2.gz IGTFCMBRCFSFFR-SFHVURJKSA-N 0 3 409.274 4.198 20 0 HIADHN CC1(C)C[C@@H](NCc2ccc(N3CCOCC3)nc2)c2cc(Br)ccc21 ZINC000479365405 894664268 /nfs/dbraw/zinc/66/42/68/894664268.db2.gz VUBXTKTUJJVJDM-LJQANCHMSA-N 0 3 416.363 4.193 20 0 HIADHN O=C1CCCN1Cc1cccc(CN[C@H]2CCCc3nn(-c4ccccc4)cc32)c1 ZINC000479367421 894668323 /nfs/dbraw/zinc/66/83/23/894668323.db2.gz ZQWWDZDNIMNIJT-QHCPKHFHSA-N 0 3 400.526 4.162 20 0 HIADHN C[C@H](NCCc1nc(-c2ccc(Cl)cc2)no1)c1ccc(Br)cn1 ZINC000479391581 894693557 /nfs/dbraw/zinc/69/35/57/894693557.db2.gz KHLVKFOMJJONGI-NSHDSACASA-N 0 3 407.699 4.441 20 0 HIADHN COC(=O)c1ccc(CN[C@H]2CCCc3cc(Br)ccc32)cc1OC ZINC000479403047 894707048 /nfs/dbraw/zinc/70/70/48/894707048.db2.gz WWXQRHCKDUFERB-SFHVURJKSA-N 0 3 404.304 4.412 20 0 HIADHN O=C(NCc1csc(-c2ccco2)n1)NC[C@@H](c1cccs1)N1CCCC1 ZINC000479423438 894736542 /nfs/dbraw/zinc/73/65/42/894736542.db2.gz PMRFGNPIODKKBZ-HNNXBMFYSA-N 0 3 402.545 4.101 20 0 HIADHN CN(Cc1nc(-c2ccccc2)c[nH]1)C(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000479423538 894736692 /nfs/dbraw/zinc/73/66/92/894736692.db2.gz PZTGKZMYKJHJPH-LJQANCHMSA-N 0 3 409.559 4.117 20 0 HIADHN CCc1nc2c(s1)[C@@H](N(C)C(=O)N[C@@H]1CCCN(Cc3ccccc3)C1)CCC2 ZINC000479426655 894740330 /nfs/dbraw/zinc/74/03/30/894740330.db2.gz RNQDTWRWCYFZEQ-QUCCMNQESA-N 0 3 412.603 4.389 20 0 HIADHN C[C@@H]1CCc2ccc(Br)cc2[C@@H](NC[C@H]2CCCCS2(=O)=O)C1 ZINC000479441381 894757125 /nfs/dbraw/zinc/75/71/25/894757125.db2.gz UDDJITUKAKBXRB-QBIMZIAESA-N 0 3 400.382 4.020 20 0 HIADHN COc1ccc(-c2ccncc2)cc1CNCCOc1ncccc1C(F)(F)F ZINC000479442952 894759128 /nfs/dbraw/zinc/75/91/28/894759128.db2.gz ZNPIGJOVSTUPIY-UHFFFAOYSA-N 0 3 403.404 4.340 20 0 HIADHN COc1cccc(NC(=O)[C@H](N[C@@H]2CCc3cnn(C(C)C)c3C2)c2ccccc2)c1 ZINC000479484287 894806904 /nfs/dbraw/zinc/80/69/04/894806904.db2.gz AUNQBLRBHZHHRU-ZJSXRUAMSA-N 0 3 418.541 4.300 20 0 HIADHN C[C@@H]1CCc2ccc(Br)cc2[C@@H](NCC2(S(C)(=O)=O)CCC2)C1 ZINC000479488204 894809359 /nfs/dbraw/zinc/80/93/59/894809359.db2.gz IKDWVVKURBDVMR-DYVFJYSZSA-N 0 3 400.382 4.020 20 0 HIADHN CC(C)n1ncc2c1C[C@H](N[C@@H](C(=O)Nc1ccc(F)cc1)c1ccccc1)CC2 ZINC000479491832 894811581 /nfs/dbraw/zinc/81/15/81/894811581.db2.gz QPLAWSDJFVIGDK-FYYLOGMGSA-N 0 3 406.505 4.430 20 0 HIADHN C[C@H](CNC(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1)Oc1ccccc1 ZINC000505251599 913906413 /nfs/dbraw/zinc/90/64/13/913906413.db2.gz PIMKVUPSKXJPJN-DYESRHJHSA-N 0 3 406.448 4.025 20 0 HIADHN COc1ccc(-c2nc3c(s2)[C@@H](NCC(=O)N2Cc4ccccc4C2)CCC3)cc1 ZINC000479519782 894830839 /nfs/dbraw/zinc/83/08/39/894830839.db2.gz UFECMQDAUAUYEL-FQEVSTJZSA-N 0 3 419.550 4.328 20 0 HIADHN C[C@H]1CN(Cc2ccccn2)CC[C@H]1Nc1ccc(NC(=O)c2ccccc2)cn1 ZINC000479535592 894839792 /nfs/dbraw/zinc/83/97/92/894839792.db2.gz AGKXSRQUSNFTKF-PGRDOPGGSA-N 0 3 401.514 4.051 20 0 HIADHN Cc1ccccc1[C@H](OC[C@H](O)CN(C)[C@@H](CO)c1ccccc1)c1ccccc1 ZINC000479667623 894944342 /nfs/dbraw/zinc/94/43/42/894944342.db2.gz ROPCTOZSMDGGDZ-DMTNHVFBSA-N 0 3 405.538 4.127 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)NCc2cccc(-c3ccccn3)c2)c1 ZINC000479714628 895010025 /nfs/dbraw/zinc/01/00/25/895010025.db2.gz HSHCMIBBSAQWFO-UHFFFAOYSA-N 0 3 418.541 4.031 20 0 HIADHN Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)NC(=O)c1oc2ccccc2c1CN(C)C ZINC000479729416 895028188 /nfs/dbraw/zinc/02/81/88/895028188.db2.gz PTHNRKIOMOBEOI-GFCCVEGCSA-N 0 3 422.451 4.361 20 0 HIADHN O=C(Nc1ccc(Br)cc1)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000479747879 895046163 /nfs/dbraw/zinc/04/61/63/895046163.db2.gz SNHYHISGQQIOSF-UHFFFAOYSA-N 0 3 404.308 4.050 20 0 HIADHN CC(C)[C@](C)(NC(=O)N[C@@H](C)C1=CCN(C)CC1)c1ccc(Br)cc1 ZINC000479746883 895046275 /nfs/dbraw/zinc/04/62/75/895046275.db2.gz BVGXUJRFPPGGTB-YWZLYKJASA-N 0 3 408.384 4.270 20 0 HIADHN CC[C@H](NC(=O)N[C@@H](CN(C)C)c1ccc(F)cc1)c1ccccc1OC(F)F ZINC000479760200 895061071 /nfs/dbraw/zinc/06/10/71/895061071.db2.gz QWUXOODKTCDKMG-ROUUACIJSA-N 0 3 409.452 4.480 20 0 HIADHN COc1ccc(CN[C@@H]2CCCOc3ccc(I)cc32)cc1 ZINC000479862471 895200106 /nfs/dbraw/zinc/20/01/06/895200106.db2.gz PDWZETPJRHCROZ-QGZVFWFLSA-N 0 3 409.267 4.303 20 0 HIADHN COc1ccccc1[C@@H](CN[C@H](C)c1cc(OC)c(OC)cc1F)N1CCCC1 ZINC000479875489 895216773 /nfs/dbraw/zinc/21/67/73/895216773.db2.gz QTLRZSFTAVGIDG-OXQOHEQNSA-N 0 3 402.510 4.339 20 0 HIADHN C[C@H](NCc1ccccc1CN1CCOCC1)c1ccc(F)c(Br)c1 ZINC000479876722 895218583 /nfs/dbraw/zinc/21/85/83/895218583.db2.gz UPIBRDBMJGKSPV-HNNXBMFYSA-N 0 3 407.327 4.271 20 0 HIADHN COc1ccc(CN[C@@H]2CCN(c3ccccc3C(F)(F)F)C2)c(OC)c1OC ZINC000479883616 895227770 /nfs/dbraw/zinc/22/77/70/895227770.db2.gz MDWLIQNNJQMBCR-OAHLLOKOSA-N 0 3 410.436 4.100 20 0 HIADHN CC(C)[C@H](Sc1ccccc1)C(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000479961344 895315780 /nfs/dbraw/zinc/31/57/80/895315780.db2.gz HCXPIEZJOUTLJM-QHCPKHFHSA-N 0 3 412.599 4.076 20 0 HIADHN CC(C)Cc1ccc([C@@H](CNC(=O)Nc2cn(C)nc2C(F)(F)F)N(C)C)cc1 ZINC000480040753 895389335 /nfs/dbraw/zinc/38/93/35/895389335.db2.gz DLDHPSYNDYKBQH-QGZVFWFLSA-N 0 3 411.472 4.062 20 0 HIADHN COc1ccc([C@H](CN[C@H](C)c2nnn(-c3ccccc3)c2C)N2CCCC2)cc1 ZINC000480079859 895436280 /nfs/dbraw/zinc/43/62/80/895436280.db2.gz DTJDHKPWMGSTGH-JPYJTQIMSA-N 0 3 405.546 4.072 20 0 HIADHN C[C@H](NCCCN1C(=O)NC2(CCCC2)C1=O)c1cc(F)c(Cl)cc1Cl ZINC000480133492 895511223 /nfs/dbraw/zinc/51/12/23/895511223.db2.gz CABXURDUMVKCQU-NSHDSACASA-N 0 3 402.297 4.038 20 0 HIADHN Cc1ccc([C@@H](C)CN[C@@H]2CCS(=O)(=O)c3ccc(Br)cc32)cc1 ZINC000480147778 895530549 /nfs/dbraw/zinc/53/05/49/895530549.db2.gz LCLPGAJPTOIQBQ-KBXCAEBGSA-N 0 3 408.361 4.369 20 0 HIADHN CCN(CC)C(=O)c1ccc(CN[C@H](C)c2ccc(NC(=O)NC3CC3)cc2)cc1 ZINC000480231036 895636467 /nfs/dbraw/zinc/63/64/67/895636467.db2.gz RDUVOHWCQBFTJF-QGZVFWFLSA-N 0 3 408.546 4.303 20 0 HIADHN COc1cc(F)c([C@H](C)NCc2ccc(CN3C[C@H](C)O[C@@H](C)C3)cc2)cc1OC ZINC000480247233 895658276 /nfs/dbraw/zinc/65/82/76/895658276.db2.gz ZSQGOZCJWFTPQQ-BZSNNMDCSA-N 0 3 416.537 4.303 20 0 HIADHN COc1cc(F)c([C@H](C)NCc2ccc(CN3C[C@@H](C)O[C@@H](C)C3)cc2)cc1OC ZINC000480247235 895658775 /nfs/dbraw/zinc/65/87/75/895658775.db2.gz ZSQGOZCJWFTPQQ-KSZLIROESA-N 0 3 416.537 4.303 20 0 HIADHN Cc1cc(CN[C@@H](C)c2ccc(S(=O)(=O)NCc3ccco3)cc2)ccc1F ZINC000480256966 895666496 /nfs/dbraw/zinc/66/64/96/895666496.db2.gz FBDCUGQUMJFRJI-INIZCTEOSA-N 0 3 402.491 4.056 20 0 HIADHN CC[C@H](NCc1ccc(N(C)CCOC)nc1)c1cc(F)cc(Br)c1 ZINC000480267712 895675872 /nfs/dbraw/zinc/67/58/72/895675872.db2.gz RCHPHBYIACXMDU-SFHVURJKSA-N 0 3 410.331 4.307 20 0 HIADHN CCOCc1ccccc1CN[C@@H](C)c1ccc(S(=O)(=O)N(CC)CC)cc1 ZINC000480273744 895680898 /nfs/dbraw/zinc/68/08/98/895680898.db2.gz IXBJMBMASBWLSD-SFHVURJKSA-N 0 3 404.576 4.104 20 0 HIADHN O[C@@H](C(F)F)[C@@H](Cc1ccccc1)NCc1cc(Br)c(Cl)s1 ZINC000480343827 895749864 /nfs/dbraw/zinc/74/98/64/895749864.db2.gz OUYLNCPJMQSCSI-CHWSQXEVSA-N 0 3 410.711 4.491 20 0 HIADHN CCN(Cc1ccc(OC)cc1OC)C(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000480374267 895780500 /nfs/dbraw/zinc/78/05/00/895780500.db2.gz HBFBUFWQODUGKR-LJQANCHMSA-N 0 3 417.575 4.134 20 0 HIADHN Cc1ccc([C@H](CN[C@H](C)c2cc(Br)ccc2F)N2CCOCC2)o1 ZINC000480385222 895791220 /nfs/dbraw/zinc/79/12/20/895791220.db2.gz GJAFKSOJYLIDDK-KDOFPFPSSA-N 0 3 411.315 4.214 20 0 HIADHN COc1cc([C@@H](C)N[C@H](CN2CCOCC2)c2ccccc2)ccc1OC(F)F ZINC000480447090 895835204 /nfs/dbraw/zinc/83/52/04/895835204.db2.gz USPBNGLPPVTYES-VQIMIIECSA-N 0 3 406.473 4.021 20 0 HIADHN COc1cc([C@H](C)N[C@H](CN2CCOCC2)c2ccc(C)cc2)ccc1OC(F)F ZINC000480453665 895840976 /nfs/dbraw/zinc/84/09/76/895840976.db2.gz FDFCKZJUGUESEB-FXAWDEMLSA-N 0 3 420.500 4.329 20 0 HIADHN CC(C)[C@](C)(NCc1cnc(N2CCOCC2)s1)c1ccc(Br)cc1 ZINC000480463968 895847465 /nfs/dbraw/zinc/84/74/65/895847465.db2.gz AZESHSYMSIEQLB-IBGZPJMESA-N 0 3 424.408 4.403 20 0 HIADHN COC(=O)c1csc(-c2cccc(CNCc3cn(C)nc3-c3cccs3)c2)n1 ZINC000480477982 895856636 /nfs/dbraw/zinc/85/66/36/895856636.db2.gz CEFVUZLFHIKBRR-UHFFFAOYSA-N 0 3 424.551 4.349 20 0 HIADHN O=C1[C@@H](NCc2ccc(-n3cnc4ccccc43)cc2)CCN1Cc1ccc(F)cc1 ZINC000480485422 895861499 /nfs/dbraw/zinc/86/14/99/895861499.db2.gz CKPZQWTVKXVULO-QHCPKHFHSA-N 0 3 414.484 4.055 20 0 HIADHN COC(=O)c1csc(-c2cccc(CNCc3c[nH]nc3-c3ccccc3)c2)n1 ZINC000480498629 895868805 /nfs/dbraw/zinc/86/88/05/895868805.db2.gz WYHAIQLQRSNKQC-UHFFFAOYSA-N 0 3 404.495 4.277 20 0 HIADHN C[C@H](c1ccccc1Cl)N1CCN(CC2CCN(C(=O)C(C)(C)C)CC2)CC1 ZINC000480513255 895880104 /nfs/dbraw/zinc/88/01/04/895880104.db2.gz QBIAEEGYSXRZRM-GOSISDBHSA-N 0 3 406.014 4.303 20 0 HIADHN CN(C)CCN(C[C@@H]1CCCO1)C(=O)c1csc(-c2cccc3ccccc32)n1 ZINC000480598558 895961191 /nfs/dbraw/zinc/96/11/91/895961191.db2.gz TZHCANAUWBLMAE-SFHVURJKSA-N 0 3 409.555 4.146 20 0 HIADHN CCS(=O)(=O)Nc1ccc([C@@H](C)NCc2ccc(F)cc2C(F)(F)F)cc1 ZINC000480602563 895966059 /nfs/dbraw/zinc/96/60/59/895966059.db2.gz UICHTQABIIEIRT-GFCCVEGCSA-N 0 3 404.429 4.457 20 0 HIADHN C[C@H](NCc1ccnc(OCC(F)(F)F)c1)c1ccc(NC(=O)NC2CC2)cc1 ZINC000480626597 895993536 /nfs/dbraw/zinc/99/35/36/895993536.db2.gz QFMHXSSGHKGIEU-ZDUSSCGKSA-N 0 3 408.424 4.157 20 0 HIADHN C[C@@H]1C[C@@H](N(C)S(=O)(=O)Cc2ccc(Cl)c(F)c2)CCN1Cc1ccccc1 ZINC000480639122 896009304 /nfs/dbraw/zinc/00/93/04/896009304.db2.gz KZGXFGGJSPKLEH-APWZRJJASA-N 0 3 424.969 4.294 20 0 HIADHN Cc1nc(-c2cccnc2)sc1[C@H](C)NCc1ccc(N2C[C@@H](C)O[C@@H](C)C2)nc1 ZINC000480643732 896011960 /nfs/dbraw/zinc/01/19/60/896011960.db2.gz OWVUXWASNJIPBE-BBWFWOEESA-N 0 3 423.586 4.373 20 0 HIADHN Cc1ccc([C@@H](CNCc2cc(Br)c(Cl)s2)N2CCOCC2)o1 ZINC000480658267 896025694 /nfs/dbraw/zinc/02/56/94/896025694.db2.gz AMEXAUXRVRGJJA-CQSZACIVSA-N 0 3 419.772 4.229 20 0 HIADHN CS[C@H](CN[C@@H]1CCS(=O)(=O)c2ccc(Br)cc21)C(C)(C)C ZINC000480657774 896025861 /nfs/dbraw/zinc/02/58/61/896025861.db2.gz AYNSCMPLFMFOGE-UKRRQHHQSA-N 0 3 406.411 4.035 20 0 HIADHN Cc1cc([C@H](NCc2ccc(N3CCCS3(=O)=O)c(F)c2)C2CC2)ccc1F ZINC000480683857 896046450 /nfs/dbraw/zinc/04/64/50/896046450.db2.gz SDRJNRXYUDGFSS-OAQYLSRUSA-N 0 3 406.498 4.054 20 0 HIADHN C[C@H]1CN(Cc2ccccn2)CC[C@H]1Nc1ccc2c(c1)CCC(=O)N2CC1CC1 ZINC000480684653 896047882 /nfs/dbraw/zinc/04/78/82/896047882.db2.gz UNTRHNPDRBYYNW-FDDCHVKYSA-N 0 3 404.558 4.093 20 0 HIADHN CCCCOc1cccc(CN[C@H](C)c2cccc(N3CCCS3(=O)=O)c2)c1 ZINC000480711029 896072576 /nfs/dbraw/zinc/07/25/76/896072576.db2.gz GEGAJPWAFQMMDE-GOSISDBHSA-N 0 3 402.560 4.256 20 0 HIADHN COCCOc1ccc([C@@H](C)N[C@H](C)c2cccc(N3CCCC3=O)c2)cc1OC ZINC000480713402 896074865 /nfs/dbraw/zinc/07/48/65/896074865.db2.gz XQXVFXVDFVKFOX-QZTJIDSGSA-N 0 3 412.530 4.259 20 0 HIADHN COc1ccc(Cl)cc1[C@@H](CC(C)C)NCc1ccnc(N2CCN(C)CC2)c1 ZINC000480724792 896084568 /nfs/dbraw/zinc/08/45/68/896084568.db2.gz WGAHREPNHVEEBG-OAQYLSRUSA-N 0 3 416.997 4.372 20 0 HIADHN C[C@H](NCc1ccc(N2CCCS2(=O)=O)c(F)c1)c1ccc2c(c1)CCCC2 ZINC000480723434 896084843 /nfs/dbraw/zinc/08/48/43/896084843.db2.gz YXUOEIVZYKRVKW-INIZCTEOSA-N 0 3 402.535 4.095 20 0 HIADHN C[C@@H](NCc1ccnc(N2CCN(C)CC2)c1)c1cccc(OCc2ccccc2)c1 ZINC000480723473 896085258 /nfs/dbraw/zinc/08/52/58/896085258.db2.gz ZHCWCSSTQCBZSE-OAQYLSRUSA-N 0 3 416.569 4.263 20 0 HIADHN C[C@H](NCc1ccc(N2CCC(C)CC2)nc1)c1ccc(OCc2nccn2C)cc1 ZINC000480724091 896085456 /nfs/dbraw/zinc/08/54/56/896085456.db2.gz AKSDLTLMDCVWRR-FQEVSTJZSA-N 0 3 419.573 4.481 20 0 HIADHN CCN1CCN(c2ccc(CN[C@@H](C)c3cc(Cl)ccc3OC(F)F)cn2)CC1 ZINC000480733344 896093301 /nfs/dbraw/zinc/09/33/01/896093301.db2.gz SVEVMKLWUFSPSD-HNNXBMFYSA-N 0 3 424.923 4.329 20 0 HIADHN COCCOc1ccc(CN[C@@H]2CCCOc3c(Br)cccc32)cc1 ZINC000480752927 896115872 /nfs/dbraw/zinc/11/58/72/896115872.db2.gz ZRSHIZDGAZOHPW-LJQANCHMSA-N 0 3 406.320 4.478 20 0 HIADHN Clc1ccccc1-c1csc(CN2CCC(CCN3CCOCC3)CC2)n1 ZINC000480776995 896140629 /nfs/dbraw/zinc/14/06/29/896140629.db2.gz SZBFSJWCJUNDIQ-UHFFFAOYSA-N 0 3 405.995 4.398 20 0 HIADHN CCOCc1ccc(CN[C@@H](C)c2ccc(S(=O)(=O)N3CCCCC3)cc2)cc1 ZINC000480816597 896188328 /nfs/dbraw/zinc/18/83/28/896188328.db2.gz ISMLEIHGANFERM-IBGZPJMESA-N 0 3 416.587 4.249 20 0 HIADHN C[C@@H]1CN(C(=O)Nc2ccc3c(c2)C(C)(C)CC3(C)C)CC[C@H]1N1CCN(C)CC1 ZINC000480816434 896188409 /nfs/dbraw/zinc/18/84/09/896188409.db2.gz FQGDUFIVUXLLMG-XMSQKQJNSA-N 0 3 412.622 4.135 20 0 HIADHN CC[C@H](NCc1cccc(NC(=O)CCN2CCOCC2)c1)c1ccc(Cl)s1 ZINC000480877239 896235424 /nfs/dbraw/zinc/23/54/24/896235424.db2.gz KVFCWHNQAPMCGM-SFHVURJKSA-N 0 3 421.994 4.303 20 0 HIADHN C[C@@H](NCc1cccc(NC(=O)Cn2cccn2)c1)c1ccc(-c2ccncc2)cc1 ZINC000480896288 896252389 /nfs/dbraw/zinc/25/23/89/896252389.db2.gz IVFZPEVGSKFSAM-LJQANCHMSA-N 0 3 411.509 4.435 20 0 HIADHN CCS(=O)(=O)Nc1ccc([C@H](C)NCc2ccccc2OCC(F)(F)F)cc1 ZINC000480904033 896259984 /nfs/dbraw/zinc/25/99/84/896259984.db2.gz FQBRNHANGFWWHQ-AWEZNQCLSA-N 0 3 416.465 4.240 20 0 HIADHN COCCOc1ccc([C@@H](C)NCc2cccc(NC(=O)c3ccncc3)c2)cc1 ZINC000480914367 896272429 /nfs/dbraw/zinc/27/24/29/896272429.db2.gz VJFCJUOWRNERFM-GOSISDBHSA-N 0 3 405.498 4.210 20 0 HIADHN CSCCCCCNC(=O)Nc1cc(C)nn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000481014767 896343955 /nfs/dbraw/zinc/34/39/55/896343955.db2.gz ZLNWPZBCBVEZBE-HXUWFJFHSA-N 0 3 415.607 4.293 20 0 HIADHN COc1cc([C@H](C)N[C@@H]2CCc3ccc(OC(F)(F)F)cc32)ccc1OCCO ZINC000481180473 896518303 /nfs/dbraw/zinc/51/83/03/896518303.db2.gz MFNNQJUZAMZAQX-SCLBCKFNSA-N 0 3 411.420 4.303 20 0 HIADHN CNS(=O)(=O)c1ccc([C@H](C)N[C@@H](C)c2csc(-c3csc(C)n3)c2)cc1 ZINC000481180361 896518459 /nfs/dbraw/zinc/51/84/59/896518459.db2.gz XHYTWFUOIWRVHI-STQMWFEESA-N 0 3 421.613 4.500 20 0 HIADHN CCOc1ccc([C@@H](CC)N[C@H](C)c2ccc(S(=O)(=O)NC)cc2)cc1OCC ZINC000481182787 896523218 /nfs/dbraw/zinc/52/32/18/896523218.db2.gz QEGIIWDOQXXZJI-OXQOHEQNSA-N 0 3 420.575 4.194 20 0 HIADHN COc1cc([C@@H](C)N[C@@H](C)c2ccc(NC(=O)NC(C)C)cc2)ccc1OCCO ZINC000481185419 896529974 /nfs/dbraw/zinc/52/99/74/896529974.db2.gz GRCNEZHDMHXETB-DLBZAZTESA-N 0 3 415.534 4.008 20 0 HIADHN COc1ccc([C@@H](C)N[C@@H](C)c2ccc(OCCO)c(OC)c2)cc1Br ZINC000481187122 896535529 /nfs/dbraw/zinc/53/55/29/896535529.db2.gz WWIQOGJDSQQNKJ-KGLIPLIRSA-N 0 3 424.335 4.249 20 0 HIADHN Cc1nn(-c2ccccc2)cc1CCCNC(=O)N[C@H](C)[C@@H](c1ccccc1)N(C)C ZINC000481224879 896577164 /nfs/dbraw/zinc/57/71/64/896577164.db2.gz IFBWUKFBSNTZSI-YKSBVNFPSA-N 0 3 419.573 4.104 20 0 HIADHN O=C(CN[C@@H](CC1CCC1)c1ccccc1)Nc1cc(Cl)ccc1-n1cncn1 ZINC000481252530 896604440 /nfs/dbraw/zinc/60/44/40/896604440.db2.gz GKXPECDLTATTGR-IBGZPJMESA-N 0 3 409.921 4.380 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3Cc4ccccc4C4(CCC4)C3)c2)CC1 ZINC000481300926 896645009 /nfs/dbraw/zinc/64/50/09/896645009.db2.gz MSJVYTILIQNKJY-UHFFFAOYSA-N 0 3 404.558 4.298 20 0 HIADHN Cc1c([C@@H](C)NC2CCN(Cc3ccc(F)cc3)CC2)nnn1-c1ccc(C)cc1 ZINC000481305299 896650766 /nfs/dbraw/zinc/65/07/66/896650766.db2.gz FGVGBQAHEMINAP-GOSISDBHSA-N 0 3 407.537 4.338 20 0 HIADHN COc1cccc(Oc2ccc(CN[C@@H](C)c3ccc(-n4cncn4)cc3)cn2)c1 ZINC000481307707 896654818 /nfs/dbraw/zinc/65/48/18/896654818.db2.gz KCXXHMBMAVUDRA-KRWDZBQOSA-N 0 3 401.470 4.314 20 0 HIADHN C[C@H](N[C@H]1CC2(CCC2)Oc2ccccc21)c1ccc(OCC(=O)NC2CC2)cc1 ZINC000481309958 896656647 /nfs/dbraw/zinc/65/66/47/896656647.db2.gz SLRGIDZHSUEHOK-JTSKRJEESA-N 0 3 406.526 4.441 20 0 HIADHN CCc1nc2c(s1)[C@H](N[C@H](CC)c1ccccc1OCC(=O)N(C)C)CCC2 ZINC000481317711 896670675 /nfs/dbraw/zinc/67/06/75/896670675.db2.gz UNZPDOPZGOIHON-IAGOWNOFSA-N 0 3 401.576 4.291 20 0 HIADHN CC[C@@H](N[C@H](C)c1ccc2c(c1)OCCO2)c1ccccc1OCC(=O)N1CCCC1 ZINC000481319984 896673467 /nfs/dbraw/zinc/67/34/67/896673467.db2.gz USZAFMYMQZKVRL-WIYYLYMNSA-N 0 3 424.541 4.261 20 0 HIADHN C[C@@H](NCc1ccc(N2CCc3ccccc3C2)nc1)c1ccc([S@](C)=O)cc1 ZINC000481323647 896678397 /nfs/dbraw/zinc/67/83/97/896678397.db2.gz OUSVATZYVUYGKR-LBEKAKSKSA-N 0 3 405.567 4.233 20 0 HIADHN CN(C)C[C@H](NC(=O)N[C@H](c1c(F)cccc1F)C(F)(F)F)c1ccc(F)cc1 ZINC000481357775 896734599 /nfs/dbraw/zinc/73/45/99/896734599.db2.gz GFXHXVLSCQVIOO-DOTOQJQBSA-N 0 3 419.369 4.309 20 0 HIADHN Cc1nc(NC(=O)N(Cc2ccccc2)C2CCN(C)CC2)ccc1Br ZINC000481375824 896770476 /nfs/dbraw/zinc/77/04/76/896770476.db2.gz QRWOHZHAVWVJOG-UHFFFAOYSA-N 0 3 417.351 4.281 20 0 HIADHN Cc1cc(Br)c(F)cc1NC(=O)N[C@H](CN(C)C)c1ccc(F)cc1 ZINC000481383161 896781477 /nfs/dbraw/zinc/78/14/77/896781477.db2.gz QZGRVSNHDUHSKO-QGZVFWFLSA-N 0 3 412.278 4.460 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)N[C@@H](c1ccc(OC)cc1)C(F)(F)F ZINC000481381928 896782537 /nfs/dbraw/zinc/78/25/37/896782537.db2.gz OCLRJLUEVCSHTA-SFHVURJKSA-N 0 3 401.473 4.206 20 0 HIADHN CN(C)C[C@H](NC(=O)N[C@H](c1ccc(F)cc1)C(F)(F)F)c1ccc(F)cc1 ZINC000481391411 896795104 /nfs/dbraw/zinc/79/51/04/896795104.db2.gz LVGPJWYFDJKWCE-DLBZAZTESA-N 0 3 401.379 4.170 20 0 HIADHN C[C@H]1C[C@H](NCc2cccc(OCCN3CCOCC3)c2)c2ccsc2S1 ZINC000481404184 896810672 /nfs/dbraw/zinc/81/06/72/896810672.db2.gz MQVYSDYGKOKRHK-JXFKEZNVSA-N 0 3 404.601 4.174 20 0 HIADHN Cc1nc(C(C)C)sc1[C@H](C)NCc1cccc(OCCN2CCOCC2)c1 ZINC000481418847 896821946 /nfs/dbraw/zinc/82/19/46/896821946.db2.gz UTZLGEDPSSJNPT-KRWDZBQOSA-N 0 3 403.592 4.137 20 0 HIADHN Cc1cc2c(cc1C)[C@H](NCc1cccc(OCCN3CCOCC3)c1)CCCO2 ZINC000481421057 896824051 /nfs/dbraw/zinc/82/40/51/896824051.db2.gz HNHBCDSKUYVKAD-XMMPIXPASA-N 0 3 410.558 4.018 20 0 HIADHN CCOc1cc(O)ccc1NC(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000481524570 896888554 /nfs/dbraw/zinc/88/85/54/896888554.db2.gz YVQIXPMRXLEZBP-FQEVSTJZSA-N 0 3 408.420 4.184 20 0 HIADHN Cc1c([C@@H](C)NCc2cccc(CN3CCO[C@@H](C)C3)c2)cnn1-c1ccc(F)cc1 ZINC000481534703 896895355 /nfs/dbraw/zinc/89/53/55/896895355.db2.gz OJJPUSLKZGWGIZ-RBUKOAKNSA-N 0 3 422.548 4.391 20 0 HIADHN COc1ccc2c(c1)[C@@H](NC[C@@H](O)COc1cccc(Cl)c1Cl)CCCO2 ZINC000481538968 896898089 /nfs/dbraw/zinc/89/80/89/896898089.db2.gz XLKPLIYUBGFZQV-DYVFJYSZSA-N 0 3 412.313 4.245 20 0 HIADHN CC(C)N(C)S(=O)(=O)c1ccc(CN[C@@H]2c3cccc(F)c3CC[C@H]2C)cc1 ZINC000481560857 896935025 /nfs/dbraw/zinc/93/50/25/896935025.db2.gz XQKUFLBFPALSIM-ZHRRBRCNSA-N 0 3 404.551 4.268 20 0 HIADHN OC1(Cc2ccc(F)cc2)CCN(CCOc2ccc(Br)cc2)CC1 ZINC000481604891 896985108 /nfs/dbraw/zinc/98/51/08/896985108.db2.gz GRAWZLMKVSBVQN-UHFFFAOYSA-N 0 3 408.311 4.037 20 0 HIADHN Cc1nc(CCCC(=O)Nc2cc(C)cc(N3CCN(C(C)C)CC3)c2)cs1 ZINC000481636824 897021489 /nfs/dbraw/zinc/02/14/89/897021489.db2.gz MIWRKVNFPGUEMH-UHFFFAOYSA-N 0 3 400.592 4.252 20 0 HIADHN Cc1oc(-c2ccco2)nc1CC(=O)Nc1cc(C)cc(N2CCN(C(C)C)CC2)c1 ZINC000481647101 897032814 /nfs/dbraw/zinc/03/28/14/897032814.db2.gz ZRYMIFYZPHFREX-UHFFFAOYSA-N 0 3 422.529 4.263 20 0 HIADHN CCC(=O)c1ccc(OCC(=O)Nc2cc(C)cc(N3CCN(C(C)C)CC3)c2)cc1 ZINC000481647986 897033023 /nfs/dbraw/zinc/03/30/23/897033023.db2.gz VMJYMZGGVXPBNU-UHFFFAOYSA-N 0 3 423.557 4.136 20 0 HIADHN Cc1cc(Br)oc1C(=O)Nc1cc(C)cc(N2CCN(C(C)C)CC2)c1 ZINC000481650914 897036311 /nfs/dbraw/zinc/03/63/11/897036311.db2.gz PAJKEWXITBNRKS-UHFFFAOYSA-N 0 3 420.351 4.442 20 0 HIADHN Cc1cc(NC(=O)C[C@H]2OCCc3ccccc32)cc(N2CCN(C(C)C)CC2)c1 ZINC000481653798 897038234 /nfs/dbraw/zinc/03/82/34/897038234.db2.gz VASCSAMPZJBKLK-XMMPIXPASA-N 0 3 407.558 4.168 20 0 HIADHN CCC(CC)[C@@H]1C[C@H](NC(=O)Nc2ccc(N3CCN(CC)CC3)cc2C)CCO1 ZINC000481672994 897056899 /nfs/dbraw/zinc/05/68/99/897056899.db2.gz PPZKHXIZGCQJPF-OFNKIYASSA-N 0 3 416.610 4.242 20 0 HIADHN CC[C@@H](CN(CC)[C@H](C)C(=O)Nc1cc(NC(C)=O)ccc1OC)c1ccccc1 ZINC000481696772 897084572 /nfs/dbraw/zinc/08/45/72/897084572.db2.gz VIYIWKDOAGMMPL-MJGOQNOKSA-N 0 3 411.546 4.496 20 0 HIADHN CCOC(=O)C[C@](C)(NCC(=O)Nc1cc(C(F)(F)F)ccc1Cl)C(C)C ZINC000481703043 897091217 /nfs/dbraw/zinc/09/12/17/897091217.db2.gz QTTUBNQJCQJLER-KRWDZBQOSA-N 0 3 408.848 4.255 20 0 HIADHN CC(C)C[C@@H]1OCCC[C@@H]1NCC(=O)N1N=C(c2cccs2)C[C@@H]1c1ccco1 ZINC000481721247 897116297 /nfs/dbraw/zinc/11/62/97/897116297.db2.gz HKPGOHWICMOAJC-HQRMLTQVSA-N 0 3 415.559 4.202 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3ccc(OCC(F)F)cc3)c(C)c2)CC1 ZINC000481734553 897129732 /nfs/dbraw/zinc/12/97/32/897129732.db2.gz GUNSKNJMSHNJNZ-UHFFFAOYSA-N 0 3 418.488 4.425 20 0 HIADHN C[C@H](NCc1cccc2cccnc21)c1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000481737460 897131389 /nfs/dbraw/zinc/13/13/89/897131389.db2.gz OQYIILYQMXWFAO-SFHVURJKSA-N 0 3 409.555 4.260 20 0 HIADHN C[C@H](NC(=O)Nc1ccc2c(c1)CCC(=O)N2CC1CC1)[C@@H](c1ccccc1)N(C)C ZINC000481755817 897146183 /nfs/dbraw/zinc/14/61/83/897146183.db2.gz PQGFPLPYSCFLNJ-XDHUDOTRSA-N 0 3 420.557 4.189 20 0 HIADHN CC(C)C[C@@H]1OCCC[C@H]1NCC(=O)Nc1ccc(Br)cc1Cl ZINC000481760755 897148626 /nfs/dbraw/zinc/14/86/26/897148626.db2.gz KSPDBCUKMVKZGL-CVEARBPZSA-N 0 3 403.748 4.224 20 0 HIADHN CCCN(C(=O)NC1CCN(CCOC(C)C)CC1)[C@H]1C[C@H](OCC)C12CCCC2 ZINC000481788023 897168821 /nfs/dbraw/zinc/16/88/21/897168821.db2.gz YSRISVRFJOJAKK-VXKWHMMOSA-N 0 3 423.642 4.035 20 0 HIADHN COc1cccc(C(NC(=O)N(CCN(C)C)CC(C)C)c2cccc(OC)c2)c1 ZINC000481787320 897169331 /nfs/dbraw/zinc/16/93/31/897169331.db2.gz LYTJJPDQHDSFOO-UHFFFAOYSA-N 0 3 413.562 4.022 20 0 HIADHN COC(=O)c1ccccc1-c1ccc(CN2CCC(c3nnc4ccccn43)CC2)o1 ZINC000481910112 897292019 /nfs/dbraw/zinc/29/20/19/897292019.db2.gz RDNIHPMWKSRGLU-UHFFFAOYSA-N 0 3 416.481 4.156 20 0 HIADHN COC(=O)c1ccc(-c2ccc(CN3CCC(OC[C@@H]4CCCCO4)CC3)o2)cc1 ZINC000481991691 897388761 /nfs/dbraw/zinc/38/87/61/897388761.db2.gz PFJQSLNVFSURNU-QFIPXVFZSA-N 0 3 413.514 4.283 20 0 HIADHN C[C@@H]1CCC[C@H](CN[C@@H]2CCS(=O)(=O)c3ccc(Br)cc32)[C@H]1C ZINC000481994210 897390023 /nfs/dbraw/zinc/39/00/23/897390023.db2.gz WEDGUTIRPNOGSD-UMPJEAMMSA-N 0 3 400.382 4.330 20 0 HIADHN COc1ccc(-c2ccncc2)cc1CN1CCC[C@H](CNC(=O)c2ccccc2)C1 ZINC000482005218 897402985 /nfs/dbraw/zinc/40/29/85/897402985.db2.gz JKUCXIJQOXVKNO-HXUWFJFHSA-N 0 3 415.537 4.399 20 0 HIADHN CC(=O)N1CCN(c2ccccc2CN[C@H](C)c2ccc(-c3ccncc3)cc2)CC1 ZINC000482018821 897422457 /nfs/dbraw/zinc/42/24/57/897422457.db2.gz TXHLRFWAPCTOBZ-HXUWFJFHSA-N 0 3 414.553 4.268 20 0 HIADHN CC(=O)N1CCN(c2ccccc2CN[C@@H](C)c2ccc(OC(F)(F)F)cc2)CC1 ZINC000482037812 897454615 /nfs/dbraw/zinc/45/46/15/897454615.db2.gz XJZOUQQMGZAWOT-INIZCTEOSA-N 0 3 421.463 4.105 20 0 HIADHN CN(C)C[C@H](NC(=O)Nc1ccc(Cl)cc1-n1cccn1)c1ccc(F)cc1 ZINC000482086035 897526594 /nfs/dbraw/zinc/52/65/94/897526594.db2.gz WVHMVPSVMHNBGR-SFHVURJKSA-N 0 3 401.873 4.089 20 0 HIADHN C[C@H](NCc1cccc(COC(C)(C)C)c1)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000482087625 897529945 /nfs/dbraw/zinc/52/99/45/897529945.db2.gz FRSCHTAHGZTSRO-KRWDZBQOSA-N 0 3 404.576 4.103 20 0 HIADHN NC(=O)C1CCN(Cc2cccc(NC(=O)c3ccc(Oc4ccccc4)o3)c2)CC1 ZINC000482106776 897555655 /nfs/dbraw/zinc/55/56/55/897555655.db2.gz VEWQQYRNXAKNJV-UHFFFAOYSA-N 0 3 419.481 4.022 20 0 HIADHN C[C@@H](N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)c1ccc(OC(F)(F)F)cc1 ZINC000482108283 897557070 /nfs/dbraw/zinc/55/70/70/897557070.db2.gz HNOXEKPOISLURN-UZLBHIALSA-N 0 3 406.448 4.470 20 0 HIADHN C[C@H](N[C@H](Cc1ccccc1)C(=O)N1CCCC1)c1cccc(OC(F)(F)F)c1 ZINC000482109605 897559686 /nfs/dbraw/zinc/55/96/86/897559686.db2.gz LPOFKPSXFVHUPC-OXJNMPFZSA-N 0 3 406.448 4.470 20 0 HIADHN CC1(C)C[C@@H](NCC(=O)N2N=C(c3cccs3)C[C@H]2c2cccs2)C(C)(C)O1 ZINC000482165392 897630312 /nfs/dbraw/zinc/63/03/12/897630312.db2.gz RHJZNNSBOIJBQJ-MAUKXSAKSA-N 0 3 417.600 4.423 20 0 HIADHN C[C@@H](CNC(=O)Cc1c[nH]c2cc(Br)ccc12)N(C)Cc1ccccc1 ZINC000482168725 897635319 /nfs/dbraw/zinc/63/53/19/897635319.db2.gz ZTVOIRQBAUMODS-HNNXBMFYSA-N 0 3 414.347 4.110 20 0 HIADHN COc1ccc(-c2nn(Cc3ccccc3)cc2CN(C)C[C@@H]2CCCO2)cc1OC ZINC000482276555 897765635 /nfs/dbraw/zinc/76/56/35/897765635.db2.gz JMMXMFBJSYHWEO-QFIPXVFZSA-N 0 3 421.541 4.226 20 0 HIADHN COc1ccc([C@H](NC(=O)N2CCCN(Cc3ccccc3)CC2)C(F)(F)F)cc1 ZINC000482344007 897852768 /nfs/dbraw/zinc/85/27/68/897852768.db2.gz MHHLCQIELWAKLM-FQEVSTJZSA-N 0 3 421.463 4.216 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)CC2CCC(C(F)(F)F)CC2)c1 ZINC000482369581 897889930 /nfs/dbraw/zinc/88/99/30/897889930.db2.gz HEHKMBGFOSVPDU-UHFFFAOYSA-N 0 3 400.485 4.344 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)N[C@H](c3ccccc3C(F)(F)F)C(F)(F)F)[C@H]2C1 ZINC000482404067 897945212 /nfs/dbraw/zinc/94/52/12/897945212.db2.gz MIDSBWPNGARCNK-BYCMXARLSA-N 0 3 409.374 4.044 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1cccc2c1CN(CC(F)(F)F)C2)c1ccco1 ZINC000482422285 897973947 /nfs/dbraw/zinc/97/39/47/897973947.db2.gz NCEOIKKCXCNGQG-KSSFIOAISA-N 0 3 424.467 4.408 20 0 HIADHN O=C(N[C@@H](c1ccc(OC(F)F)cc1)C(F)(F)F)N1CCN(C2CCCC2)CC1 ZINC000482438305 897998476 /nfs/dbraw/zinc/99/84/76/897998476.db2.gz PTHGLCKWLVUAAU-INIZCTEOSA-N 0 3 421.410 4.161 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)N[C@@H](c1cccc(F)c1F)C(F)(F)F ZINC000482444882 898008498 /nfs/dbraw/zinc/00/84/98/898008498.db2.gz OFAXIMZQAZWYAR-SFHVURJKSA-N 0 3 415.406 4.342 20 0 HIADHN CC(=O)Nc1ccc(CCN[C@@H](C)c2ccccc2I)cc1 ZINC000482461434 898034368 /nfs/dbraw/zinc/03/43/68/898034368.db2.gz RVUIFAAFBDZXHU-ZDUSSCGKSA-N 0 3 408.283 4.143 20 0 HIADHN CC[C@@H](N[C@H](C)c1cc(F)ccc1N1CCN(C)CC1)c1ccc(OC)c(OC)c1 ZINC000482536912 898123593 /nfs/dbraw/zinc/12/35/93/898123593.db2.gz QNPXJAWBUYHZPY-DYESRHJHSA-N 0 3 415.553 4.397 20 0 HIADHN CC[C@H](N[C@@H](C)c1cc(F)ccc1N1CCN(C)CC1)c1ccc(OC)c(OC)c1 ZINC000482536918 898123632 /nfs/dbraw/zinc/12/36/32/898123632.db2.gz QNPXJAWBUYHZPY-UWJYYQICSA-N 0 3 415.553 4.397 20 0 HIADHN C[C@H](N[C@@H](C)c1cc(F)ccc1N1CCN(C)CC1)c1cccc(N2CCCC2=O)c1 ZINC000482537552 898125399 /nfs/dbraw/zinc/12/53/99/898125399.db2.gz NTSQOGMXXRDCBM-OALUTQOASA-N 0 3 424.564 4.116 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)c1cnc(Sc2nccn2C)c(Cl)c1 ZINC000482580557 898177106 /nfs/dbraw/zinc/17/71/06/898177106.db2.gz JVMVXUSDWAOCHH-UHFFFAOYSA-N 0 3 415.950 4.242 20 0 HIADHN COc1ccc(CCC(=O)Nc2cc(CN(C)C)ccc2C)cc1Br ZINC000482582557 898178793 /nfs/dbraw/zinc/17/87/93/898178793.db2.gz FYDDUYBCFOSVPM-UHFFFAOYSA-N 0 3 405.336 4.399 20 0 HIADHN COCCOc1ccc(Cl)cc1C(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000482587023 898184168 /nfs/dbraw/zinc/18/41/68/898184168.db2.gz XBVDQRLYKJXVQD-HXUWFJFHSA-N 0 3 416.949 4.102 20 0 HIADHN CC1CCC(N2CCN(C(=O)Nc3ccc4c(c3)CCC(=O)N4CC3CC3)CC2)CC1 ZINC000482588454 898185983 /nfs/dbraw/zinc/18/59/83/898185983.db2.gz DRLCIBDAEPMBGJ-UHFFFAOYSA-N 0 3 424.589 4.104 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)CSc1nnc(-c2ccc(Cl)cc2)o1 ZINC000482601002 898202884 /nfs/dbraw/zinc/20/28/84/898202884.db2.gz ZEEDUPZGNPTYET-UHFFFAOYSA-N 0 3 416.934 4.491 20 0 HIADHN CC(C)(C)c1nn(Cc2ccccc2)cc1CNCCC(=O)NCc1ccccc1 ZINC000482605430 898206117 /nfs/dbraw/zinc/20/61/17/898206117.db2.gz QCVJQFSRANJQGJ-UHFFFAOYSA-N 0 3 404.558 4.025 20 0 HIADHN C[C@H](NC(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C)c1ccc(NC(=O)NC2CC2)cc1 ZINC000482637168 898239965 /nfs/dbraw/zinc/23/99/65/898239965.db2.gz JYXZYVFHNXTEED-HOIFWPIMSA-N 0 3 423.561 4.022 20 0 HIADHN Cc1c([C@H](C)NC(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)cnn1-c1ccc(F)cc1 ZINC000482667059 898269145 /nfs/dbraw/zinc/26/91/45/898269145.db2.gz BDXPSWFLSKZFIS-YGKZAACZSA-N 0 3 423.536 4.371 20 0 HIADHN CN1C(=O)C[C@H](NCc2ccc(OCc3cccnc3)cc2)[C@H]1c1ccc(F)c(F)c1 ZINC000482698076 898297491 /nfs/dbraw/zinc/29/74/91/898297491.db2.gz YEQXINGJTQTELP-LADGPHEKSA-N 0 3 423.463 4.000 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)N2CCN(C3CCCCC3)CC2)c(C(F)(F)F)c1 ZINC000482725219 898325900 /nfs/dbraw/zinc/32/59/00/898325900.db2.gz VIFPQVPCQLYSGU-UHFFFAOYSA-N 0 3 412.456 4.146 20 0 HIADHN CN1C(=O)C[C@H](NCc2ccc(OCc3ccncc3)cc2)[C@H]1c1ccc(F)c(F)c1 ZINC000482727552 898327977 /nfs/dbraw/zinc/32/79/77/898327977.db2.gz XJURCXNLTOXCLF-LADGPHEKSA-N 0 3 423.463 4.000 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCCC1)c1cc(Br)ccc1F ZINC000482733616 898334799 /nfs/dbraw/zinc/33/47/99/898334799.db2.gz FXHPHLQYQMDTGA-UHFFFAOYSA-N 0 3 415.372 4.070 20 0 HIADHN CC(C)c1nn(-c2ccc(Br)cc2)cc1CN[C@@H](C)CC[S@@](C)=O ZINC000482753201 898359032 /nfs/dbraw/zinc/35/90/32/898359032.db2.gz OMDOSLRHMKQLTI-LFPIHBKWSA-N 0 3 412.397 4.005 20 0 HIADHN CC[C@H](C)[C@H](N[C@@H](C)c1cn(C)nc1C)C(=O)N1CCC(Cc2ccccc2)CC1 ZINC000482827347 898435317 /nfs/dbraw/zinc/43/53/17/898435317.db2.gz SRCCJSPNZCVYRS-JXQFQVJHSA-N 0 3 410.606 4.275 20 0 HIADHN CN1CCN(C)[C@@H](CN[C@@H](Cc2cccc(F)c2)c2ccc(Cl)c(Cl)c2)C1 ZINC000482886455 898501277 /nfs/dbraw/zinc/50/12/77/898501277.db2.gz NXVLKKSJVABYOR-RXVVDRJESA-N 0 3 410.364 4.252 20 0 HIADHN O=C1[C@@H](N2CCC(Cc3cc(Cl)ccc3Cl)CC2)CCN1C1CCOCC1 ZINC000482888331 898504721 /nfs/dbraw/zinc/50/47/21/898504721.db2.gz JQDCLOSIFPRRSB-FQEVSTJZSA-N 0 3 411.373 4.028 20 0 HIADHN CC(C)C[C@H](C)Oc1cc(CN[C@H](C)c2ccc(NS(C)(=O)=O)cc2)ccn1 ZINC000482888971 898506736 /nfs/dbraw/zinc/50/67/36/898506736.db2.gz NQKZEOQAYHJSAV-DLBZAZTESA-N 0 3 405.564 4.117 20 0 HIADHN Cc1cccc(CC2(O)CCN(C[C@@H](O)COc3cc(Cl)ccc3Cl)CC2)c1 ZINC000482926063 898546208 /nfs/dbraw/zinc/54/62/08/898546208.db2.gz YMCSUVVSFPDQLS-LJQANCHMSA-N 0 3 424.368 4.111 20 0 HIADHN CC(C)c1cc(C(=O)NCC2(N3CCSCC3)CCCCC2)nn1C(C)(C)C ZINC000482936329 898558642 /nfs/dbraw/zinc/55/86/42/898558642.db2.gz PDSXLNKOSJWMJK-UHFFFAOYSA-N 0 3 406.640 4.243 20 0 HIADHN COc1cccc2c1CC[C@H]2NCc1cccc(NC(=O)NCc2ccncc2)c1 ZINC000482943586 898566551 /nfs/dbraw/zinc/56/65/51/898566551.db2.gz CZUCWMUNYKHBCS-JOCHJYFZSA-N 0 3 402.498 4.189 20 0 HIADHN CO[C@]1(C)CCCN([C@@H](C)C(=O)Nc2ccc(NC(=O)c3cccs3)cc2)CC1 ZINC000483014531 898670779 /nfs/dbraw/zinc/67/07/79/898670779.db2.gz IKJJIBQAUOXYNW-KSFYIVLOSA-N 0 3 415.559 4.218 20 0 HIADHN C[C@H](NC(=O)c1ccc(-c2noc(C(F)(F)F)n2)cc1)[C@@H](c1ccccc1)N(C)C ZINC000505575034 914280651 /nfs/dbraw/zinc/28/06/51/914280651.db2.gz NVOSOVYXJKSFBT-GUYCJALGSA-N 0 3 418.419 4.177 20 0 HIADHN CCCC[C@@](C)(NCC(=O)Nc1c(C)n[nH]c1C)c1cccc(Br)c1 ZINC000483073781 898756890 /nfs/dbraw/zinc/75/68/90/898756890.db2.gz UWPRXKBIUMCNSM-LJQANCHMSA-N 0 3 407.356 4.423 20 0 HIADHN Cc1c([C@H](C)N[C@H](Cc2ccccc2)[C@@H](O)C(F)F)cnn1-c1ccc(F)cc1 ZINC000483131619 898814134 /nfs/dbraw/zinc/81/41/34/898814134.db2.gz BRDPRAZCZJGFKW-LVXYXVKQSA-N 0 3 403.448 4.208 20 0 HIADHN Cc1ccc(C[C@@H](N[C@H](C)c2ccc(NS(C)(=O)=O)cc2)c2ccccn2)cc1 ZINC000483134886 898816443 /nfs/dbraw/zinc/81/64/43/898816443.db2.gz NJVCIOXFULJTNB-WZONZLPQSA-N 0 3 409.555 4.396 20 0 HIADHN CC[C@H](CN(CC)C(=O)NCc1ccccc1CN1CCC(O)CC1)c1ccccc1 ZINC000483139513 898819557 /nfs/dbraw/zinc/81/95/57/898819557.db2.gz BOFBTQHNHOXHRS-OAQYLSRUSA-N 0 3 423.601 4.369 20 0 HIADHN C[C@@H](CN1CCN(c2ccccn2)CC1)N[C@@H](C)c1nc(-c2ccccc2)cs1 ZINC000483160103 898831448 /nfs/dbraw/zinc/83/14/48/898831448.db2.gz PZOSXLVKVNCZNY-OALUTQOASA-N 0 3 407.587 4.066 20 0 HIADHN CCc1ccc(Cl)c(CC)c1NC(=O)CCCN1C[C@H](C)O[C@]2(CCOC2)C1 ZINC000483172884 898840612 /nfs/dbraw/zinc/84/06/12/898840612.db2.gz LVJXYKZXLQWOJZ-KSFYIVLOSA-N 0 3 408.970 4.063 20 0 HIADHN C[C@H](NC(=O)c1cn(C)nc1-c1ccc(Cl)s1)[C@@H](c1ccccc1)N(C)C ZINC000505585642 914292827 /nfs/dbraw/zinc/29/28/27/914292827.db2.gz GBGMGRPQMZZVEZ-DJJJIMSYSA-N 0 3 402.951 4.223 20 0 HIADHN C[C@@H](NC(=O)Cc1cccc(OCc2cccnc2)c1)[C@@H](c1ccccc1)N(C)C ZINC000505590816 914298003 /nfs/dbraw/zinc/29/80/03/914298003.db2.gz KGSVJFXAMRIYPH-CLOONOSVSA-N 0 3 403.526 4.011 20 0 HIADHN Cc1nn(C)c(Sc2ccccc2)c1C(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C ZINC000505592046 914299203 /nfs/dbraw/zinc/29/92/03/914299203.db2.gz QRIPKPFTYZMIFB-LAUBAEHRSA-N 0 3 408.571 4.301 20 0 HIADHN CC(C)[C@@H](CNC(=O)c1cscc1Br)N1CCc2ccccc2C1 ZINC000505606732 914310393 /nfs/dbraw/zinc/31/03/93/914310393.db2.gz GRZSROXMKQBKMO-GOSISDBHSA-N 0 3 407.377 4.323 20 0 HIADHN CCS[C@@H]1CCC[C@H](NC(=O)Nc2ccc(N3CCN(CC)CC3)cc2C)C1 ZINC000483435961 899068443 /nfs/dbraw/zinc/06/84/43/899068443.db2.gz BWUCYWYPQCMCAD-AZUAARDMSA-N 0 3 404.624 4.323 20 0 HIADHN COc1ccccc1-c1nc(C2CCN(Cc3ccc(NC(C)=O)cc3)CC2)no1 ZINC000483439486 899072803 /nfs/dbraw/zinc/07/28/03/899072803.db2.gz KWZIDJYGTDMUAX-UHFFFAOYSA-N 0 3 406.486 4.083 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)Nc1cc(F)c(OC(F)F)cc1F)c1ccco1 ZINC000483448933 899086419 /nfs/dbraw/zinc/08/64/19/899086419.db2.gz RZKRIYICUKWGLN-YGRLFVJLSA-N 0 3 403.376 4.410 20 0 HIADHN CN(C(=O)Nc1ccc(OCC(F)F)cc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000483590566 899241684 /nfs/dbraw/zinc/24/16/84/899241684.db2.gz JXACDLRUEMLULT-LJQANCHMSA-N 0 3 403.473 4.459 20 0 HIADHN Cc1cc(-c2noc([C@H](C)NC3CCN(CCC(F)(F)F)CC3)n2)ccc1F ZINC000483641667 899298259 /nfs/dbraw/zinc/29/82/59/899298259.db2.gz UMCCNSVRVRPCBB-ZDUSSCGKSA-N 0 3 400.420 4.252 20 0 HIADHN CCOC(=O)C1CCC(N[C@H](C)c2nc(-c3ccc(Br)cc3)no2)CC1 ZINC000483657047 899315887 /nfs/dbraw/zinc/31/58/87/899315887.db2.gz SJTYYMKONXAKIL-XEBKBJJBSA-N 0 3 422.323 4.272 20 0 HIADHN CNC(=O)[C@H](Cc1c[nH]c2ccccc12)N[C@@H](C)c1cccc(OC(F)(F)F)c1 ZINC000483711063 899368279 /nfs/dbraw/zinc/36/82/79/899368279.db2.gz IVXHFTIZWLNXDN-DJJJIMSYSA-N 0 3 405.420 4.074 20 0 HIADHN C[C@H](N[C@@H]1CCCN(c2ccccc2Cl)C1=O)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000483717441 899375362 /nfs/dbraw/zinc/37/53/62/899375362.db2.gz ZGJXYXLYYYRBLA-IFXJQAMLSA-N 0 3 411.933 4.416 20 0 HIADHN Cc1nc2c(s1)[C@@H](NCc1cc(C(F)(F)F)ccc1N1CCN(C)CC1)CCC2 ZINC000483739982 899401093 /nfs/dbraw/zinc/40/10/93/899401093.db2.gz HAYUWRQPROCEJU-KRWDZBQOSA-N 0 3 424.536 4.389 20 0 HIADHN C[C@@H](NC(=O)Nc1cc(-c2ccc(F)cc2F)nn1C)[C@@H](c1ccccc1)N(C)C ZINC000483800149 899473361 /nfs/dbraw/zinc/47/33/61/899473361.db2.gz FYLUMIOIDVVBPX-SZNDQCEHSA-N 0 3 413.472 4.178 20 0 HIADHN COc1cc(Cl)cc(C(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000483800427 899475454 /nfs/dbraw/zinc/47/54/54/899475454.db2.gz LQSMXUIDSTVKER-LJQANCHMSA-N 0 3 410.905 4.244 20 0 HIADHN C[C@H](CNC(=O)Nc1cccc(CN(C)C)c1)Oc1ccccc1Br ZINC000483833159 899512079 /nfs/dbraw/zinc/51/20/79/899512079.db2.gz NTEARKAKJCAOQI-CQSZACIVSA-N 0 3 406.324 4.100 20 0 HIADHN Cc1ccc(NC(=O)c2ccc3c(c2)C(=O)N(C2CCCCC2)C3=O)c(CN(C)C)c1 ZINC000505662472 914359078 /nfs/dbraw/zinc/35/90/78/914359078.db2.gz WYDVUFAFHLTZEU-UHFFFAOYSA-N 0 3 419.525 4.238 20 0 HIADHN COC(=O)[C@@H](c1ccc(Cl)c(Cl)c1)N(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1 ZINC000483993562 899633535 /nfs/dbraw/zinc/63/35/35/899633535.db2.gz LFEVSDPUVUXAFS-FFZOFVMBSA-N 0 3 422.356 4.227 20 0 HIADHN CN(CCc1cccnc1)Cc1cccc(Br)c1OC[C@@H]1CCCO1 ZINC000484021316 899655403 /nfs/dbraw/zinc/65/54/03/899655403.db2.gz NJIVPRUKGKCVRL-SFHVURJKSA-N 0 3 405.336 4.076 20 0 HIADHN CN(CCc1cccnc1)Cc1cccc(Br)c1OC[C@H]1CCCO1 ZINC000484021314 899656310 /nfs/dbraw/zinc/65/63/10/899656310.db2.gz NJIVPRUKGKCVRL-GOSISDBHSA-N 0 3 405.336 4.076 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)NC[C@H]1CCCC[C@H]1C(F)(F)F ZINC000484024540 899657335 /nfs/dbraw/zinc/65/73/35/899657335.db2.gz BLDKLUXNFHKFAA-RHSMWYFYSA-N 0 3 421.454 4.407 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1ccc2oc(N(C)C)nc2c1 ZINC000484037841 899669790 /nfs/dbraw/zinc/66/97/90/899669790.db2.gz FMIOUDBZSNQFPW-QGZVFWFLSA-N 0 3 407.518 4.022 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)NC[C@H]1CCCC[C@H]1C(F)(F)F ZINC000484042585 899673904 /nfs/dbraw/zinc/67/39/04/899673904.db2.gz KSDKNQVSMYSSIB-NVXWUHKLSA-N 0 3 403.464 4.268 20 0 HIADHN Fc1ccc(N2CCOCC2)c(CN[C@@H]2CCc3cc(Br)ccc32)c1 ZINC000484134567 899755751 /nfs/dbraw/zinc/75/57/51/899755751.db2.gz BTVSLRXBUSDRGI-LJQANCHMSA-N 0 3 405.311 4.202 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)c1ccc(Oc2ccc(F)cc2F)cc1 ZINC000484142035 899762273 /nfs/dbraw/zinc/76/22/73/899762273.db2.gz NEBDOKOCGMHLCW-UHFFFAOYSA-N 0 3 411.452 4.356 20 0 HIADHN CCCc1nc(C)c(C(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)o1 ZINC000484156344 899777388 /nfs/dbraw/zinc/77/73/88/899777388.db2.gz IPYLXKSEWXPCMG-IBGZPJMESA-N 0 3 407.518 4.140 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2cccc(-c3nccs3)c2)c1 ZINC000484201121 899810353 /nfs/dbraw/zinc/81/03/53/899810353.db2.gz LHRBGSIGULUXRF-UHFFFAOYSA-N 0 3 410.543 4.414 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N[C@H](c1ccccc1)c1ccc(F)cc1 ZINC000484207825 899814018 /nfs/dbraw/zinc/81/40/18/899814018.db2.gz MOJYEPVBCFBMMX-HSZRJFAPSA-N 0 3 419.500 4.040 20 0 HIADHN Cc1cc(C)n(-c2ccc(C(=O)N(CCN(C)C)CC3CCCCC3)cc2F)n1 ZINC000484220383 899819740 /nfs/dbraw/zinc/81/97/40/899819740.db2.gz MZFKDEKJOOUQOG-UHFFFAOYSA-N 0 3 400.542 4.212 20 0 HIADHN C[C@H](NC(=O)NCc1cccc(NC(=O)C2CCCC2)c1)[C@@H](c1ccccc1)N(C)C ZINC000484277860 899847158 /nfs/dbraw/zinc/84/71/58/899847158.db2.gz BYUSGOIOEMDHQR-MBSDFSHPSA-N 0 3 422.573 4.306 20 0 HIADHN O=C1Nc2ccccc2C12CCC(NCc1nccn1CCc1ccccc1)CC2 ZINC000484281556 899849627 /nfs/dbraw/zinc/84/96/27/899849627.db2.gz VJTNKEODTBWHDM-UHFFFAOYSA-N 0 3 400.526 4.048 20 0 HIADHN Cc1c(CSC(C)C)cccc1NC(=O)N1CC[C@H](N2CCN(C)CC2)[C@H](C)C1 ZINC000484280453 899849979 /nfs/dbraw/zinc/84/99/79/899849979.db2.gz MSOFMGUMLYZZHM-GCJKJVERSA-N 0 3 418.651 4.126 20 0 HIADHN COc1cc(C)ccc1OCC(=O)N(c1cccc(SC)c1)C1CCN(C)CC1 ZINC000484290938 899855510 /nfs/dbraw/zinc/85/55/10/899855510.db2.gz DOMFXKXINXCXGY-UHFFFAOYSA-N 0 3 414.571 4.232 20 0 HIADHN CC[S@](=O)[C@@H]1CCC[C@@H](N[C@@H](C)c2ccccc2I)C1 ZINC000484290524 899855639 /nfs/dbraw/zinc/85/56/39/899855639.db2.gz FAZONYQRZAMTCS-BSGIZYOKSA-N 0 3 405.345 4.022 20 0 HIADHN Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)N[C@H](C(=O)N1CCOCC1)C(C)C ZINC000484302182 899863559 /nfs/dbraw/zinc/86/35/59/899863559.db2.gz PCDZJMIMUKXETM-KDOFPFPSSA-N 0 3 421.994 4.306 20 0 HIADHN CC[C@@H](N[C@@H](C)c1sc(-c2ccc(Cl)cc2)nc1C)C(=O)N1CCOCC1 ZINC000484305021 899864981 /nfs/dbraw/zinc/86/49/81/899864981.db2.gz UJKDPRKCPHBURF-SUMWQHHRSA-N 0 3 407.967 4.060 20 0 HIADHN CSc1cccc(N(C(=O)c2cc(=O)[nH]c3ccccc32)C2CCN(C)CC2)c1 ZINC000484400342 899926357 /nfs/dbraw/zinc/92/63/57/899926357.db2.gz GEFSJZMHPOMBKV-UHFFFAOYSA-N 0 3 407.539 4.403 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(NS(C)(=O)=O)cc1)c1ccc(OCC2CC2)c(F)c1 ZINC000484500131 899991418 /nfs/dbraw/zinc/99/14/18/899991418.db2.gz HCANUTGUROAYMA-LSDHHAIUSA-N 0 3 406.523 4.398 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2ccc(C)c(-c3ncco3)c2)c1 ZINC000484533872 900019713 /nfs/dbraw/zinc/01/97/13/900019713.db2.gz YLNDTDRMJYZPMB-UHFFFAOYSA-N 0 3 408.502 4.254 20 0 HIADHN CNC(=O)c1cccc(CN[C@@H](c2ccc(F)c(F)c2)C(C)(C)N2CCCC2)c1 ZINC000484546185 900027890 /nfs/dbraw/zinc/02/78/90/900027890.db2.gz XGJVLTVGFTXFHZ-NRFANRHFSA-N 0 3 401.501 4.030 20 0 HIADHN COc1cc([C@@H](C)N[C@H](C)c2cccc(N3CCCC3)c2)ccc1S(C)(=O)=O ZINC000484598530 900060431 /nfs/dbraw/zinc/06/04/31/900060431.db2.gz LKPYBCRNIVOBFG-IAGOWNOFSA-N 0 3 402.560 4.111 20 0 HIADHN Brc1cc2c(cc1CN[C@H]1CCCC[C@H]1n1cccn1)OCCCO2 ZINC000484614602 900070811 /nfs/dbraw/zinc/07/08/11/900070811.db2.gz KKTKCNBCIURJNO-DLBZAZTESA-N 0 3 406.324 4.080 20 0 HIADHN CSCc1cc(F)ccc1CN[C@H](C)c1cccc(N2CCCS2(=O)=O)c1 ZINC000484624707 900077364 /nfs/dbraw/zinc/07/73/64/900077364.db2.gz UVYJKBVLNJWLCE-OAHLLOKOSA-N 0 3 408.564 4.079 20 0 HIADHN Brc1ccc(-c2nccc(CN[C@@H]3CCCC[C@H]3n3cccn3)n2)cc1 ZINC000484626364 900079447 /nfs/dbraw/zinc/07/94/47/900079447.db2.gz IRZOOIRZGMGNGK-RTBURBONSA-N 0 3 412.335 4.376 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N2C[C@H](c3ccccc3)[C@@H]3COCC[C@@H]32)C1 ZINC000484693513 900131193 /nfs/dbraw/zinc/13/11/93/900131193.db2.gz GCEBSNOMRGENID-WKNJGTSGSA-N 0 3 419.569 4.036 20 0 HIADHN CCc1nnc(C2CCN(Cc3nc4ccccc4n3-c3ccc(OC)cc3)CC2)[nH]1 ZINC000484699609 900134955 /nfs/dbraw/zinc/13/49/55/900134955.db2.gz FKTWQFVRRBBERZ-UHFFFAOYSA-N 0 3 416.529 4.094 20 0 HIADHN COc1ccc([C@H](C)NC(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)c(C)c1OC ZINC000484742725 900166944 /nfs/dbraw/zinc/16/69/44/900166944.db2.gz ZCVWGHOUYGOBLQ-NSHGMRRFSA-N 0 3 411.546 4.208 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2ccc(OC)c(OC(C)C)c2)c1 ZINC000484793178 900198872 /nfs/dbraw/zinc/19/88/72/900198872.db2.gz SSPDZHCMJTWQAK-UHFFFAOYSA-N 0 3 415.534 4.087 20 0 HIADHN CCOCCNC(=O)CN[C@H](C)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 ZINC000484794579 900200553 /nfs/dbraw/zinc/20/05/53/900200553.db2.gz IIGIUBZJWHZHJE-CYBMUJFWSA-N 0 3 400.466 4.237 20 0 HIADHN Cc1ccccc1C1(CNC(=O)N[C@H]2CCN(Cc3ccccc3)[C@H]2C)CCOCC1 ZINC000484893726 900277265 /nfs/dbraw/zinc/27/72/65/900277265.db2.gz WOCBUQVRZBJIME-URXFXBBRSA-N 0 3 421.585 4.005 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCCC1)c1cc2c(cccc2OC(F)F)[nH]1 ZINC000484911242 900288642 /nfs/dbraw/zinc/28/86/42/900288642.db2.gz CKYFYNHQOXINCD-UHFFFAOYSA-N 0 3 423.529 4.251 20 0 HIADHN C[C@@H]1Cc2ccccc2N1Cc1ccoc1C(=O)NC[C@H](Cc1ccccc1)N(C)C ZINC000484919445 900295126 /nfs/dbraw/zinc/29/51/26/900295126.db2.gz UKRYSTPGILHZNK-XXBNENTESA-N 0 3 417.553 4.134 20 0 HIADHN Cc1ccccc1C1(CNC(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)CCOCC1 ZINC000484932494 900304091 /nfs/dbraw/zinc/30/40/91/900304091.db2.gz DPBBTJJKOBPYDM-NZQKXSOJSA-N 0 3 409.574 4.034 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)Nc1cc(-c2cccnc2)ccc1C ZINC000484960747 900324799 /nfs/dbraw/zinc/32/47/99/900324799.db2.gz NIJRSLHPAWWCAI-UHFFFAOYSA-N 0 3 402.498 4.004 20 0 HIADHN Cc1ccccc1[C@@H](C)N1CCN(Cc2nc3sc4c(c3c(=O)[nH]2)CCCC4)CC1 ZINC000484984658 900341142 /nfs/dbraw/zinc/34/11/42/900341142.db2.gz GRWCMSHYMBHUPI-QGZVFWFLSA-N 0 3 422.598 4.463 20 0 HIADHN CC[C@H](C(=O)Nc1c(-c2ccc(Br)cc2)nc(C)n1C)N(CC)CC ZINC000484993368 900346576 /nfs/dbraw/zinc/34/65/76/900346576.db2.gz CXFDMJCLWPNLCJ-MRXNPFEDSA-N 0 3 407.356 4.217 20 0 HIADHN COc1cccc2[nH]cc(CC(=O)NC[C@@H](c3cccs3)N3CCC(C)CC3)c21 ZINC000485036237 900374667 /nfs/dbraw/zinc/37/46/67/900374667.db2.gz UJOLGLMXWOWRSW-IBGZPJMESA-N 0 3 411.571 4.370 20 0 HIADHN COc1cccc(-c2nc(CN[C@@]3(CO)C[C@@H](C)CC(C)(C)C3)cs2)c1OC ZINC000485064298 900389631 /nfs/dbraw/zinc/38/96/31/900389631.db2.gz OJUZDPDGLNYFPK-NYHFZMIOSA-N 0 3 404.576 4.494 20 0 HIADHN CC(C)(C)OC(=O)C1CCN(CCC(=O)Nc2ccccc2C(F)(F)F)CC1 ZINC000485124525 900428410 /nfs/dbraw/zinc/42/84/10/900428410.db2.gz ODMAJBVXDSHDAE-UHFFFAOYSA-N 0 3 400.441 4.088 20 0 HIADHN Cc1c([C@@H](C)NC(=O)N2CCN(C3CCCCC3)CC2)cnn1-c1ccc(F)cc1 ZINC000485186292 900480690 /nfs/dbraw/zinc/48/06/90/900480690.db2.gz FWWFVAUBLBZFHK-QGZVFWFLSA-N 0 3 413.541 4.041 20 0 HIADHN CCc1c(NC(=O)N[C@H]2CCCN(C)[C@@H]2C)cnn1-c1cccc(C(F)(F)F)c1 ZINC000485323430 900605314 /nfs/dbraw/zinc/60/53/14/900605314.db2.gz PCCVTJVAATXUQO-CJNGLKHVSA-N 0 3 409.456 4.058 20 0 HIADHN Cc1nc(-c2ccc(Br)cc2)sc1[C@@H](C)N[C@H]1CCCN(C)C1=O ZINC000485390279 900685299 /nfs/dbraw/zinc/68/52/99/900685299.db2.gz YEOYWEMEBHADAD-ABAIWWIYSA-N 0 3 408.365 4.152 20 0 HIADHN Cc1nc(-c2ccc(Br)cc2)sc1[C@H](C)N[C@@H]1CCCN(C)C1=O ZINC000485390282 900685624 /nfs/dbraw/zinc/68/56/24/900685624.db2.gz YEOYWEMEBHADAD-XHDPSFHLSA-N 0 3 408.365 4.152 20 0 HIADHN CO[C@H](C)c1noc(CN2CCCN(C3c4ccccc4-c4ccccc43)CC2)n1 ZINC000485438174 900735107 /nfs/dbraw/zinc/73/51/07/900735107.db2.gz LNTDBSQQVJODDN-QGZVFWFLSA-N 0 3 404.514 4.055 20 0 HIADHN CC[C@@H](C)c1ccccc1OCC(=O)Nc1ccc(C(=O)NCCN2CCCC2)cc1 ZINC000485508310 900795099 /nfs/dbraw/zinc/79/50/99/900795099.db2.gz XZZHIQSXGDEKIY-LJQANCHMSA-N 0 3 423.557 4.043 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N[C@@H]1CCCc2c[nH]nc21)c1ccc(C(F)(F)F)cc1 ZINC000485613324 900871004 /nfs/dbraw/zinc/87/10/04/900871004.db2.gz LSONQVLRLMUVQH-MSOLQXFVSA-N 0 3 423.483 4.188 20 0 HIADHN CN(C)Cc1ccccc1C(=O)N1CCCN(Cc2ccc(C(F)(F)F)cc2)CC1 ZINC000485693891 900944198 /nfs/dbraw/zinc/94/41/98/900944198.db2.gz KQNKUWIFNYRHKG-UHFFFAOYSA-N 0 3 419.491 4.115 20 0 HIADHN CC(=O)Nc1ccc(OC[C@H](O)CN(Cc2cc(F)cc(Cl)c2)C(C)C)cc1 ZINC000485696168 900945768 /nfs/dbraw/zinc/94/57/68/900945768.db2.gz NVFYQEKOGOTSOM-HXUWFJFHSA-N 0 3 408.901 4.088 20 0 HIADHN COc1ccc(CN(C)[C@@H](C)c2ccc(N3CCCS3(=O)=O)cc2)cc1Cl ZINC000485705883 900954915 /nfs/dbraw/zinc/95/49/15/900954915.db2.gz QQNKTNUACZKDME-HNNXBMFYSA-N 0 3 408.951 4.082 20 0 HIADHN C[C@@H](Oc1ccccc1Br)C(=O)N[C@H](CN1CCCC1)c1ccccc1 ZINC000485706220 900955769 /nfs/dbraw/zinc/95/57/69/900955769.db2.gz HACDYJPEAKFHAO-VQIMIIECSA-N 0 3 417.347 4.170 20 0 HIADHN CC(C)(C)[C@H](CN1CCc2ccccc2C1)NC(=O)NCc1nc(C2CC2)cs1 ZINC000485776340 901033470 /nfs/dbraw/zinc/03/34/70/901033470.db2.gz VTVVTUPMQXIDPV-FQEVSTJZSA-N 0 3 412.603 4.293 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)[C@@H]1COc2ccc(Cl)cc21 ZINC000485779994 901034454 /nfs/dbraw/zinc/03/44/54/901034454.db2.gz DZQJSFYESVZBFD-LJQANCHMSA-N 0 3 402.947 4.046 20 0 HIADHN COc1ccc(OC)c([C@H](C)NC(=O)[C@@H](C)N[C@H](C)c2ccc3ncsc3c2)c1 ZINC000485830115 901076535 /nfs/dbraw/zinc/07/65/35/901076535.db2.gz FEVCJTRTSHSFEL-QLFBSQMISA-N 0 3 413.543 4.230 20 0 HIADHN Cc1[nH]c2ccc(Cl)cc2c1C(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000485846608 901090578 /nfs/dbraw/zinc/09/05/78/901090578.db2.gz PNBSYLFJSZSXQK-GASCZTMLSA-N 0 3 403.954 4.091 20 0 HIADHN CC[C@H](NC[C@H](O)COc1cccc(C(C)=O)c1)c1cc(F)cc(Br)c1 ZINC000485848241 901091833 /nfs/dbraw/zinc/09/18/33/901091833.db2.gz VGTZGIWHBYAWIK-ICSRJNTNSA-N 0 3 424.310 4.271 20 0 HIADHN CCc1ccc(Cl)c(CC)c1NC(=O)CCCN(C)[C@H](C)C(=O)NC(C)(C)C ZINC000485856460 901098481 /nfs/dbraw/zinc/09/84/81/901098481.db2.gz GMYHVDAMWYUECV-OAHLLOKOSA-N 0 3 410.002 4.419 20 0 HIADHN C[C@H]1CN(C(=O)c2ccc(-c3ccc(C(C)(C)C)cc3)o2)CC[C@H]1N1CCN(C)CC1 ZINC000486154705 901342246 /nfs/dbraw/zinc/34/22/46/901342246.db2.gz SOKONRICHYUGDX-SIKLNZKXSA-N 0 3 423.601 4.342 20 0 HIADHN C[C@H](C(=O)Nc1nc(-c2ccc(F)cc2)cs1)N1CCN(C2CCCCC2)CC1 ZINC000486243142 901425143 /nfs/dbraw/zinc/42/51/43/901425143.db2.gz JGTRHCFDARMFBF-MRXNPFEDSA-N 0 3 416.566 4.227 20 0 HIADHN COc1ccc(Cl)cc1S(=O)(=O)N(C)[C@@H]1CCN(Cc2ccccc2)[C@H](C)C1 ZINC000486250954 901434378 /nfs/dbraw/zinc/43/43/78/901434378.db2.gz GZUPVJOISWMOBD-VQIMIIECSA-N 0 3 422.978 4.022 20 0 HIADHN C[C@@H](CNC(=O)c1ccccc1CN(C)C)Sc1ccc(Br)cc1 ZINC000486255047 901437999 /nfs/dbraw/zinc/43/79/99/901437999.db2.gz JDYAYWCVBZLWMI-AWEZNQCLSA-N 0 3 407.377 4.421 20 0 HIADHN COc1ccccc1[C@@H](CNc1ccc(C(=O)N2CCC(C)CC2)cn1)N1CCCC1 ZINC000486445308 901603700 /nfs/dbraw/zinc/60/37/00/901603700.db2.gz BJCNXYGHZPUODP-JOCHJYFZSA-N 0 3 422.573 4.211 20 0 HIADHN Fc1ccc(-c2nnc3n2C[C@@H](NCc2ccc(F)cc2Br)CC3)cc1 ZINC000505913135 914556259 /nfs/dbraw/zinc/55/62/59/914556259.db2.gz PYOARCWYUDDCKG-INIZCTEOSA-N 0 3 419.273 4.090 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)c1ccnc(-c2ccc(Cl)cc2)n1 ZINC000486559012 901704376 /nfs/dbraw/zinc/70/43/76/901704376.db2.gz GYVUHGSYLGHCAO-UHFFFAOYSA-N 0 3 422.916 4.006 20 0 HIADHN Cc1cccc(Br)c1C(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000486722837 901813871 /nfs/dbraw/zinc/81/38/71/901813871.db2.gz PWXMNNVQMTVYGO-UHFFFAOYSA-N 0 3 417.347 4.214 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N(C)CCc3ccc(Cl)cc3)c(C)c2)CC1 ZINC000486749283 901828028 /nfs/dbraw/zinc/82/80/28/901828028.db2.gz QWFUJGHUFSRDDF-UHFFFAOYSA-N 0 3 414.981 4.497 20 0 HIADHN C[C@@H]1CCCCN1CCNC(=O)c1cccc(NC(=O)CCCc2cccs2)c1 ZINC000486767291 901841152 /nfs/dbraw/zinc/84/11/52/901841152.db2.gz FYRIYWUHXKWZDO-GOSISDBHSA-N 0 3 413.587 4.314 20 0 HIADHN CN(C(=O)Nc1nnc(/C=C/c2ccco2)s1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000486851251 901896998 /nfs/dbraw/zinc/89/69/98/901896998.db2.gz KGGRKAMOGGJOIN-DXRVJIQQSA-N 0 3 423.542 4.430 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)Nc3ncc(Cc4cccc(C(F)(F)F)c4)s3)[C@@H]2C1 ZINC000486858633 901903872 /nfs/dbraw/zinc/90/38/72/901903872.db2.gz BOPWLHDYAUWLEU-WMLDXEAASA-N 0 3 424.492 4.311 20 0 HIADHN Cc1nc2sc(-c3ccccc3)cc2c(NC[C@H](C(C)C)N2CCN(C)CC2)n1 ZINC000486863139 901908219 /nfs/dbraw/zinc/90/82/19/901908219.db2.gz IBPHWWWQLOPJFF-HXUWFJFHSA-N 0 3 409.603 4.351 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2c(F)cccc2Br)N2CCCC2)cc1 ZINC000486868617 901914009 /nfs/dbraw/zinc/91/40/09/901914009.db2.gz MLUOFECFECZUKL-GOSISDBHSA-N 0 3 405.311 4.464 20 0 HIADHN CN(C(=O)Nc1nnc(/C=C\c2ccco2)s1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000486898914 901942578 /nfs/dbraw/zinc/94/25/78/901942578.db2.gz HJNSZFIHZJEUPU-IBSYWUHOSA-N 0 3 409.515 4.040 20 0 HIADHN Cc1n[nH]c(C)c1[C@@H](C)C(=O)N[C@H](c1ccc(F)c(F)c1)C(C)(C)N1CCCC1 ZINC000487138211 902069351 /nfs/dbraw/zinc/06/93/51/902069351.db2.gz NAKVJKHRRUCXME-ZUOKHONESA-N 0 3 404.505 4.140 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3cccc(C)c3Br)cc2)CC1 ZINC000487193692 902095798 /nfs/dbraw/zinc/09/57/98/902095798.db2.gz BKZSGNINWDFDKR-UHFFFAOYSA-N 0 3 402.336 4.152 20 0 HIADHN COc1cc(Cl)c(C)cc1NC(=O)CCNCc1cnc(-c2ccco2)s1 ZINC000487297500 902140085 /nfs/dbraw/zinc/14/00/85/902140085.db2.gz LAWXPBHVPGSKPA-UHFFFAOYSA-N 0 3 405.907 4.492 20 0 HIADHN Cc1cc(NC(=O)NC[C@H]2CN(Cc3ccccc3)CCCO2)c(Cl)cc1F ZINC000487454759 902216700 /nfs/dbraw/zinc/21/67/00/902216700.db2.gz JZGFPGWACCCCJV-KRWDZBQOSA-N 0 3 405.901 4.200 20 0 HIADHN O=C(c1ccc(-c2noc(C(F)F)n2)cc1)N1CCN(CC2CCCCC2)CC1 ZINC000487566583 902243334 /nfs/dbraw/zinc/24/33/34/902243334.db2.gz OGJFMJSGUTWANU-UHFFFAOYSA-N 0 3 404.461 4.012 20 0 HIADHN COc1ccc(CCNC(=O)[C@H](C)N[C@@H](C)c2ccc(F)c3ccccc32)cc1OC ZINC000487870995 902416212 /nfs/dbraw/zinc/41/62/12/902416212.db2.gz BMDYHKPJXHQTQG-IRXDYDNUSA-N 0 3 424.516 4.394 20 0 HIADHN COCCSCCCN1CCC[C@@H]1c1ccccc1I ZINC000487914110 902447503 /nfs/dbraw/zinc/44/75/03/902447503.db2.gz HKZUAPTVIFZACI-MRXNPFEDSA-N 0 3 405.345 4.198 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CC(C)(C)[C@@H]1c1cccnc1)c1cccc(OC)c1 ZINC000488146421 902641483 /nfs/dbraw/zinc/64/14/83/902641483.db2.gz VJBXUKSQOHKIMY-VXKWHMMOSA-N 0 3 410.562 4.266 20 0 HIADHN CC(C)c1nc2ccc(NC(=O)N3CCN(C4CCOCC4)C[C@@H]3C)cc2s1 ZINC000488375183 902788550 /nfs/dbraw/zinc/78/85/50/902788550.db2.gz ASYXWZDBRUTEJP-HNNXBMFYSA-N 0 3 402.564 4.137 20 0 HIADHN CCOc1cc(CN(C)[C@H](C)c2ccc(-n3cncn3)cc2)ccc1OC(F)F ZINC000488397431 902807516 /nfs/dbraw/zinc/80/75/16/902807516.db2.gz NCBNNBYMHFJYAF-OAHLLOKOSA-N 0 3 402.445 4.460 20 0 HIADHN CC(C)(C)S(=O)(=O)Cc1cccc(NC(=O)c2cccc(CN3CCCC3)c2)c1 ZINC000488405703 902811872 /nfs/dbraw/zinc/81/18/72/902811872.db2.gz UVCMSYZDSWVTSN-UHFFFAOYSA-N 0 3 414.571 4.248 20 0 HIADHN CCn1cc([C@@H]2NC(=O)CC[C@H]2N[C@@H](C)c2ccccc2OCc2ccccc2)cn1 ZINC000488464394 902838597 /nfs/dbraw/zinc/83/85/97/902838597.db2.gz RZPFVOVJUXKLJJ-FKRCVWNDSA-N 0 3 418.541 4.153 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1ccc(F)cc1OC1CCOCC1)c1ccco1 ZINC000488711486 902959648 /nfs/dbraw/zinc/95/96/48/902959648.db2.gz WQPDLVPVBTZSRW-HNAYVOBHSA-N 0 3 419.497 4.227 20 0 HIADHN Cc1cccc2nc(C3CCN(CCC(=O)c4ccc5c(c4)OCCO5)CC3)oc21 ZINC000489026820 903131032 /nfs/dbraw/zinc/13/10/32/903131032.db2.gz LHJQMTNMDGDAGQ-UHFFFAOYSA-N 0 3 406.482 4.360 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)Nc2ccc(OCC(F)(F)F)nc2)CC1 ZINC000489030780 903137473 /nfs/dbraw/zinc/13/74/73/903137473.db2.gz ZIECCSQALHOJQQ-UHFFFAOYSA-N 0 3 422.451 4.151 20 0 HIADHN CC(=O)c1ccc(NC(=O)[C@H](C)N[C@H](COc2ccccc2F)C(C)(C)C)cc1 ZINC000489033662 903139362 /nfs/dbraw/zinc/13/93/62/903139362.db2.gz IEJWBNSSPXRLSJ-YCRPNKLZSA-N 0 3 400.494 4.439 20 0 HIADHN CCOc1c(Br)cc(Br)cc1CNC[C@H](O)[C@@H](C)CC ZINC000489064028 903167617 /nfs/dbraw/zinc/16/76/17/903167617.db2.gz JGNZTZRTNIKKRM-HZMBPMFUSA-N 0 3 409.162 4.107 20 0 HIADHN CCOc1c(Br)cc(Br)cc1CNC[C@H](O)[C@H](C)CC ZINC000489064031 903167711 /nfs/dbraw/zinc/16/77/11/903167711.db2.gz JGNZTZRTNIKKRM-YGRLFVJLSA-N 0 3 409.162 4.107 20 0 HIADHN CCc1cccc2c1OCC[C@H]2NC(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000489130694 903220793 /nfs/dbraw/zinc/22/07/93/903220793.db2.gz CPSSATXNNQETNH-HSZRJFAPSA-N 0 3 407.558 4.379 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)NCc2cccc(OC(F)F)c2)N(C)C)cc1 ZINC000489199229 903258754 /nfs/dbraw/zinc/25/87/54/903258754.db2.gz SCPFYJIXOHTIFO-HXUWFJFHSA-N 0 3 421.488 4.177 20 0 HIADHN Cc1cccc(C)c1OC[C@@H](C)NC(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000489399086 903367589 /nfs/dbraw/zinc/36/75/89/903367589.db2.gz IMGIULCFDLRSBA-OAQYLSRUSA-N 0 3 409.574 4.377 20 0 HIADHN C[C@@H](CNC(=O)N(Cc1ccccc1)C1CCN(C)CC1)c1ccc(F)cc1F ZINC000489493117 903420541 /nfs/dbraw/zinc/42/05/41/903420541.db2.gz ZWYTZXFLLSZJHA-KRWDZBQOSA-N 0 3 401.501 4.374 20 0 HIADHN COc1cccc(NC(=O)[C@H](N[C@H]2CCO[C@@]3(CCSC3)C2)c2ccccc2)c1 ZINC000489524748 903437284 /nfs/dbraw/zinc/43/72/84/903437284.db2.gz BAHANHKQAPAEOC-WPYKKVEZSA-N 0 3 412.555 4.019 20 0 HIADHN CC(C)(CNC(=O)N[C@@H](c1ccccc1)c1ccncc1)N1CCc2ccccc2C1 ZINC000489536964 903447346 /nfs/dbraw/zinc/44/73/46/903447346.db2.gz KIYANWZYLRSCHL-DEOSSOPVSA-N 0 3 414.553 4.307 20 0 HIADHN Cc1cc(Cl)c2c(c1)[C@H](NCc1cccc(CN3CCOCC3)c1)CCCO2 ZINC000489575620 903473209 /nfs/dbraw/zinc/47/32/09/903473209.db2.gz WLMOUIZKLPCZKG-JOCHJYFZSA-N 0 3 400.950 4.484 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)NCCc2c[nH]c3ccc(F)cc23)CC1 ZINC000489615678 903499227 /nfs/dbraw/zinc/49/92/27/903499227.db2.gz ZEDPIBJMTORBET-UHFFFAOYSA-N 0 3 408.521 4.156 20 0 HIADHN CCCN(C(=O)NC[C@@H]1CCCn2cc(C)nc21)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000506038925 914728596 /nfs/dbraw/zinc/72/85/96/914728596.db2.gz RQGIAEJABTZNEZ-GOTSBHOMSA-N 0 3 423.605 4.155 20 0 HIADHN CC(C)n1ncc(C(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)c1-c1ccccc1 ZINC000489743153 903571662 /nfs/dbraw/zinc/57/16/62/903571662.db2.gz SKIBQBZHLHMHIS-JOCHJYFZSA-N 0 3 402.542 4.478 20 0 HIADHN CN(Cc1nc2ccccc2s1)C(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000506039777 914729496 /nfs/dbraw/zinc/72/94/96/914729496.db2.gz CGJYKLXDPBAMQZ-KRWDZBQOSA-N 0 3 415.509 4.412 20 0 HIADHN Cc1cc([C@H]2CN(C(=O)NC[C@@H](c3cccs3)N3CCCC3)CCO2)ccc1F ZINC000489782608 903595552 /nfs/dbraw/zinc/59/55/52/903595552.db2.gz WSHNBQQITSHSPF-VQTJNVASSA-N 0 3 417.550 4.116 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)N1CCC[C@@H]1CC1CCCCC1 ZINC000489788330 903598122 /nfs/dbraw/zinc/59/81/22/903598122.db2.gz HIWJHCNZLPOBQA-HSZRJFAPSA-N 0 3 413.606 4.288 20 0 HIADHN C[C@@H](C1CC1)N(Cc1ccccc1)C(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000489806415 903605192 /nfs/dbraw/zinc/60/51/92/903605192.db2.gz IKXODAKPSMGZKD-FQEVSTJZSA-N 0 3 421.585 4.154 20 0 HIADHN CCN(Cc1ccccc1Cl)C(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000489812740 903609085 /nfs/dbraw/zinc/60/90/85/903609085.db2.gz RIYUZAPDLBFXPD-UHFFFAOYSA-N 0 3 415.965 4.028 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)NCc2ccc(OC(F)F)cc2)CC1 ZINC000489888134 903652645 /nfs/dbraw/zinc/65/26/45/903652645.db2.gz NKYJCZXXZKEONN-UHFFFAOYSA-N 0 3 403.473 4.094 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](NCC2(O)CCCCC2)c2ccc(Cl)cc2)c1 ZINC000490151531 903795060 /nfs/dbraw/zinc/79/50/60/903795060.db2.gz RAHRZNLCNNEPJD-FQEVSTJZSA-N 0 3 407.963 4.118 20 0 HIADHN CCN1CCN([C@@H](C)CN[C@H](c2ccccc2Cl)c2cc(F)ccc2F)CC1 ZINC000490168443 903806410 /nfs/dbraw/zinc/80/64/10/903806410.db2.gz VRIPSZYJSKZSFJ-KSFYIVLOSA-N 0 3 407.936 4.323 20 0 HIADHN Cc1ccc([C@H](NCCN2CCC[C@@H](C)C2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000490173094 903810137 /nfs/dbraw/zinc/81/01/37/903810137.db2.gz SKCZGEBJBPHZEY-NTKDMRAZSA-N 0 3 414.615 4.118 20 0 HIADHN Cc1ccc([C@H](NC[C@@H](C)N2CCCC[C@H]2C)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000490184932 903814670 /nfs/dbraw/zinc/81/46/70/903814670.db2.gz PZGOSVLBMZGFJY-REHUZNOOSA-N 0 3 414.615 4.340 20 0 HIADHN COc1ccc(NC(=O)N[C@@H](CN2CCCC2)c2ccccc2)cc1Br ZINC000490341580 903933722 /nfs/dbraw/zinc/93/37/22/903933722.db2.gz QWSNJVQPXRIQGV-SFHVURJKSA-N 0 3 418.335 4.416 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)Nc3ccc(Br)cc3C(F)(F)F)[C@H]2C1 ZINC000490547392 904092508 /nfs/dbraw/zinc/09/25/08/904092508.db2.gz RHLSCLUZKPTYOO-YGRLFVJLSA-N 0 3 406.246 4.026 20 0 HIADHN CCN1CCN(CCC(=O)NCC(CC)(CC)c2ccc(Cl)c(Cl)c2)CC1 ZINC000490567482 904105014 /nfs/dbraw/zinc/10/50/14/904105014.db2.gz PBEOTGCSAMQZGW-UHFFFAOYSA-N 0 3 414.421 4.195 20 0 HIADHN O=C(CN1CCCC[C@H]1[C@@H]1CNC(=O)C1)c1c2ccccc2[nH]c1-c1ccccc1 ZINC000490631940 904147648 /nfs/dbraw/zinc/14/76/48/904147648.db2.gz QCRJIEFFNZQEKA-RXVVDRJESA-N 0 3 401.510 4.008 20 0 HIADHN CCN(CC)C(=O)c1ccc(NC(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)cc1 ZINC000490661193 904161296 /nfs/dbraw/zinc/16/12/96/904161296.db2.gz OABOMCFOUJTDPE-HSZRJFAPSA-N 0 3 422.573 4.436 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)NCCc1coc(-c2ccc(C)cc2)n1)c1ccco1 ZINC000490684745 904172654 /nfs/dbraw/zinc/17/26/54/904172654.db2.gz PPLGTXLPFDYLLQ-YLJYHZDGSA-N 0 3 410.518 4.214 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2cccc(C(=O)N3CCCC3)c2)N2CCCC2)cc1 ZINC000490690315 904175809 /nfs/dbraw/zinc/17/58/09/904175809.db2.gz HSHNSVYAGJGZDD-HSZRJFAPSA-N 0 3 420.557 4.190 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)NCc1ccc(OC)cc1C(F)(F)F)c1ccco1 ZINC000490729405 904195670 /nfs/dbraw/zinc/19/56/70/904195670.db2.gz CSYPOBPQKGYWIR-CXAGYDPISA-N 0 3 413.440 4.236 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)NCCc1coc(-c2ccc(F)cc2)n1)c1ccco1 ZINC000490754319 904210835 /nfs/dbraw/zinc/21/08/35/904210835.db2.gz DMEZDOBGZCCRAM-BEFAXECRSA-N 0 3 414.481 4.045 20 0 HIADHN CCN(CCN[C@@H](c1cccc(S(C)(=O)=O)c1)c1ccc(C)cc1C)C(C)C ZINC000491003672 904365118 /nfs/dbraw/zinc/36/51/18/904365118.db2.gz GHPWFNLAFCLQPD-QHCPKHFHSA-N 0 3 402.604 4.116 20 0 HIADHN COc1ccc(CN2CCC(C(=O)Nc3ccccc3O)CC2)cc1OCC(C)C ZINC000506128215 914815291 /nfs/dbraw/zinc/81/52/91/914815291.db2.gz BFROKAHJZUXSOS-UHFFFAOYSA-N 0 3 412.530 4.286 20 0 HIADHN Cc1nc(CCN[C@H](c2ccc(C)cc2)c2cccc(S(C)(=O)=O)c2)cs1 ZINC000491342861 904546498 /nfs/dbraw/zinc/54/64/98/904546498.db2.gz LEYWWDHVKQNMRD-OAQYLSRUSA-N 0 3 400.569 4.085 20 0 HIADHN Cc1nc2ccccn2c1CN1CCC[C@@H](c2nnc3ccc(C(F)(F)F)cn32)C1 ZINC000506148128 914824701 /nfs/dbraw/zinc/82/47/01/914824701.db2.gz PAIFOWJLTSGGHR-OAHLLOKOSA-N 0 3 414.435 4.084 20 0 HIADHN CCc1ccc([C@@H](NC[C@@H]2Cc3ccccc3O2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000491420139 904586459 /nfs/dbraw/zinc/58/64/59/904586459.db2.gz AURXXPIMJLWBTC-WIOPSUGQSA-N 0 3 421.562 4.335 20 0 HIADHN C[C@@H]1C[C@@H]1C(=O)Nc1cccc(C(=O)NC[C@H](c2ccccc2)N2CCC(C)CC2)c1 ZINC000491423951 904590542 /nfs/dbraw/zinc/59/05/42/904590542.db2.gz OOLGKKFVCATHGL-VEXUSMLFSA-N 0 3 419.569 4.484 20 0 HIADHN Cn1c2ccccc2cc(CNCC2=Cc3cc(Cl)cc(Cl)c3OC2)c1=O ZINC000491470656 904613631 /nfs/dbraw/zinc/61/36/31/904613631.db2.gz JDJHMXXKTOZQIA-UHFFFAOYSA-N 0 3 401.293 4.411 20 0 HIADHN CN(C)Cc1ccc(C(=O)Nc2cccc(S(=O)(=O)C3CCCCC3)c2)cc1 ZINC000491492794 904621661 /nfs/dbraw/zinc/62/16/61/904621661.db2.gz JSGPQOJVHRVQQH-UHFFFAOYSA-N 0 3 400.544 4.107 20 0 HIADHN c1csc(-c2noc(CCCN3CCN(C[C@H]4C[C@@H]4c4ccccc4)CC3)n2)c1 ZINC000506158652 914828472 /nfs/dbraw/zinc/82/84/72/914828472.db2.gz AXDRAFWFTRQOBM-WOJBJXKFSA-N 0 3 408.571 4.152 20 0 HIADHN COC(=O)c1cc2cc(NC(=O)N(CCN(C)C)Cc3cccc(C)c3)ccc2o1 ZINC000491537787 904642023 /nfs/dbraw/zinc/64/20/23/904642023.db2.gz KCNGIFXCHKEUEE-UHFFFAOYSA-N 0 3 409.486 4.124 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)Nc2ccccc2N2C[C@@H](C)O[C@H](C)C2)c1 ZINC000491557247 904650034 /nfs/dbraw/zinc/65/00/34/904650034.db2.gz KDNUMXUKEYCCPD-NHCUHLMSSA-N 0 3 424.589 4.204 20 0 HIADHN CCOCCOc1ccc(Br)cc1NC(=O)c1cccc(CN(C)C)c1 ZINC000491572245 904655459 /nfs/dbraw/zinc/65/54/59/904655459.db2.gz AQTBNUVCASGGMO-UHFFFAOYSA-N 0 3 421.335 4.178 20 0 HIADHN COc1ccccc1-c1ncc(CN[C@@H]2c3ccccc3CC23CCOCC3)cn1 ZINC000491591728 904665411 /nfs/dbraw/zinc/66/54/11/904665411.db2.gz NTIHMYIZAGIIMT-HSZRJFAPSA-N 0 3 401.510 4.336 20 0 HIADHN CCOc1cc2c(cc1NC(=O)N(CCN(C)C)Cc1cccc(C)c1)O[C@H](C)C2 ZINC000491723183 904689127 /nfs/dbraw/zinc/68/91/27/904689127.db2.gz WLGZUFJLAAMHTR-GOSISDBHSA-N 0 3 411.546 4.313 20 0 HIADHN COc1ccc([C@H](CNC(=O)NCc2ccc(CSC)cc2)N2CCCC2)cc1 ZINC000506179180 914835487 /nfs/dbraw/zinc/83/54/87/914835487.db2.gz NTTOSXVWEYKQLL-QFIPXVFZSA-N 0 3 413.587 4.195 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(S(=O)(=O)N(C)C)cc1)c1cc(Br)cs1 ZINC000491846012 904711197 /nfs/dbraw/zinc/71/11/97/904711197.db2.gz HNNJQZDFNIHUSH-NWDGAFQWSA-N 0 3 417.394 4.173 20 0 HIADHN Cc1csc(Sc2ccc(NC(=O)N3CC[C@@H]4CCN(C)C[C@H]43)c(C)c2)n1 ZINC000492176681 904809974 /nfs/dbraw/zinc/80/99/74/904809974.db2.gz BTZKLUFAAHFPRR-MAUKXSAKSA-N 0 3 402.589 4.469 20 0 HIADHN CCN(CCCS(=O)(=O)N(C)C)Cc1ccc(-c2ccc(C(F)(F)F)cc2)o1 ZINC000492205654 904814289 /nfs/dbraw/zinc/81/42/89/904814289.db2.gz CPGHEAPVSHOLPH-UHFFFAOYSA-N 0 3 418.481 4.069 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)Nc3ccc(OCc4cccc(F)c4)c(F)c3)[C@@H]2C1 ZINC000492236285 904820901 /nfs/dbraw/zinc/82/09/01/904820901.db2.gz DWVCVRPTZQDQDT-OXQOHEQNSA-N 0 3 401.457 4.102 20 0 HIADHN COCCc1ccc(Oc2ccc(NC(=O)N3CC[C@H]4CCN(C)C[C@H]43)cc2)cc1 ZINC000492236723 904822028 /nfs/dbraw/zinc/82/20/28/904822028.db2.gz KTKBFHMGUMLLEZ-AUSIDOKSSA-N 0 3 409.530 4.226 20 0 HIADHN COc1ccc([C@H](CNC(=O)N[C@H](C)CCCC(F)(F)F)N2CCCC2)cc1 ZINC000492313970 904833713 /nfs/dbraw/zinc/83/37/13/904833713.db2.gz QRKFEPBPIQXFPG-QAPCUYQASA-N 0 3 401.473 4.252 20 0 HIADHN CC(C)c1ccccc1OC[C@@H](O)CN1CCC2(CC1)OCCc1ccsc12 ZINC000492556365 904867177 /nfs/dbraw/zinc/86/71/77/904867177.db2.gz FHTHIMDCWXFIIP-IBGZPJMESA-N 0 3 401.572 4.175 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)C[C@H](C)c1c(C)n[nH]c1C ZINC000492594393 904874522 /nfs/dbraw/zinc/87/45/22/904874522.db2.gz ZEZDBTQSKKHNMY-KKSFZXQISA-N 0 3 420.561 4.111 20 0 HIADHN C[C@@H](CCCC(F)(F)F)N[C@@H](C(=O)NCc1ccc2c(c1)OCO2)c1ccccc1 ZINC000492630414 904880171 /nfs/dbraw/zinc/88/01/71/904880171.db2.gz MSAKUKMYJOKALO-MGPUTAFESA-N 0 3 422.447 4.484 20 0 HIADHN C[C@@H](C(=O)N(C)[C@H](c1ncc[nH]1)c1ccccc1)N1CCC(Cc2ccccc2)CC1 ZINC000493010017 904988747 /nfs/dbraw/zinc/98/87/47/904988747.db2.gz PGGYVRZAJKBERI-RDPSFJRHSA-N 0 3 416.569 4.301 20 0 HIADHN CCc1ccc([C@H](NC[C@H](OC)C(C)(C)C)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000493059713 905005437 /nfs/dbraw/zinc/00/54/37/905005437.db2.gz PBBLFTSOJGKLTD-VXKWHMMOSA-N 0 3 403.588 4.393 20 0 HIADHN Cc1nc(CCN[C@@H](c2ccc(C)cc2)c2cccc(S(C)(=O)=O)c2)sc1C ZINC000493077897 905013057 /nfs/dbraw/zinc/01/30/57/905013057.db2.gz IQXXVTVMGZCNOU-QFIPXVFZSA-N 0 3 414.596 4.394 20 0 HIADHN Cc1ccc([C@H](NCC2(O)CCCCCC2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000493081623 905013984 /nfs/dbraw/zinc/01/39/84/905013984.db2.gz RSRAZERCPVCMCF-HSZRJFAPSA-N 0 3 415.599 4.471 20 0 HIADHN CC[C@@H](NCc1cc(C(F)(F)F)ccc1N1CCN(C)CC1)c1ccc(F)cn1 ZINC000493106854 905022253 /nfs/dbraw/zinc/02/22/53/905022253.db2.gz WLERIFFJTJZSJQ-GOSISDBHSA-N 0 3 410.459 4.232 20 0 HIADHN O=C(C1CCN(Cc2cn(-c3ccccc3)nc2-c2cccs2)CC1)N1CCCC1 ZINC000506260412 914869629 /nfs/dbraw/zinc/86/96/29/914869629.db2.gz YNVRYONMBDVIMF-UHFFFAOYSA-N 0 3 420.582 4.435 20 0 HIADHN Cc1ccc([C@H](NCCc2ccc3c(c2)CCO3)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000493253952 905069917 /nfs/dbraw/zinc/06/99/17/905069917.db2.gz ZBBSQDQDLNTRNF-VWLOTQADSA-N 0 3 421.562 4.255 20 0 HIADHN COc1cc(CN(C)[C@@H](C)c2ccc(F)cc2)ccc1OCC(=O)N1CCCC1 ZINC000506258876 914868690 /nfs/dbraw/zinc/86/86/90/914868690.db2.gz LIAVKLONGZOMAA-KRWDZBQOSA-N 0 3 400.494 4.029 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)c2ccnc(SCC(F)(F)F)c2)C1 ZINC000493387819 905101981 /nfs/dbraw/zinc/10/19/81/905101981.db2.gz RKJCUPMMTABYKO-YOEHRIQHSA-N 0 3 409.477 4.301 20 0 HIADHN Cc1cc(-c2cc(C(=O)N3CC[C@H]4CCN(C)C[C@H]43)c3c(C)noc3n2)c(C)s1 ZINC000493467112 905130661 /nfs/dbraw/zinc/13/06/61/905130661.db2.gz RVIKMKVHOUXUJR-DNVCBOLYSA-N 0 3 410.543 4.043 20 0 HIADHN CS(=O)(=O)c1ccc(-c2nc(CN[C@H]3CCC[C@@H]3Cc3ccccc3)co2)cc1 ZINC000493576122 905168121 /nfs/dbraw/zinc/16/81/21/905168121.db2.gz VYVXGIXNWDQQAF-KNQAVFIVSA-N 0 3 410.539 4.246 20 0 HIADHN CS(=O)(=O)c1ccc(-c2nc(CN[C@@H]3CCC[C@@H]3Cc3ccccc3)co2)cc1 ZINC000493576119 905168574 /nfs/dbraw/zinc/16/85/74/905168574.db2.gz VYVXGIXNWDQQAF-DENIHFKCSA-N 0 3 410.539 4.246 20 0 HIADHN Cc1cc(Br)cc2c1[C@@H](NCc1cccc(CS(C)(=O)=O)c1)CC2 ZINC000493895593 905253396 /nfs/dbraw/zinc/25/33/96/905253396.db2.gz YMMAWKHVHYYPHI-SFHVURJKSA-N 0 3 408.361 4.079 20 0 HIADHN COC[C@@H](N[C@H](C)c1cc(F)ccc1N1CCN(C)CC1)c1ccc(Cl)cc1 ZINC000493961335 905310529 /nfs/dbraw/zinc/31/05/29/905310529.db2.gz PFNULPNVFXTRND-IIBYNOLFSA-N 0 3 405.945 4.269 20 0 HIADHN COc1cccc(Cn2ccc3ccc(NC(=O)N4CC[C@@H]5CCN(C)C[C@H]54)cc32)c1 ZINC000493965844 905315507 /nfs/dbraw/zinc/31/55/07/905315507.db2.gz XAVYOQUZPIVEOP-GBXCKJPGSA-N 0 3 418.541 4.256 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](N[C@@H]2CCOC3(CCC3)C2)c2ccc(F)c(F)c2)c1 ZINC000493989585 905333427 /nfs/dbraw/zinc/33/34/27/905333427.db2.gz LYBXTYCHNOPAQH-DYESRHJHSA-N 0 3 421.509 4.149 20 0 HIADHN CC(C)c1noc(-c2ccccc2C(=O)N[C@H]2CCN(Cc3ccccc3)[C@@H]2C)n1 ZINC000493997614 905340338 /nfs/dbraw/zinc/34/03/38/905340338.db2.gz ATVQAOMRCCFPJZ-UTKZUKDTSA-N 0 3 404.514 4.253 20 0 HIADHN CSc1nc(C(C)(C)C)nc(C)c1C(=O)N[C@H]1CCN(Cc2ccccc2)[C@@H]1C ZINC000494017098 905354592 /nfs/dbraw/zinc/35/45/92/905354592.db2.gz LBPBRUYGLHMRBE-AEFFLSMTSA-N 0 3 412.603 4.197 20 0 HIADHN CSc1nc(C(C)(C)C)nc(C)c1C(=O)N[C@@H]1CCN(Cc2ccccc2)[C@@H]1C ZINC000494017100 905355362 /nfs/dbraw/zinc/35/53/62/905355362.db2.gz LBPBRUYGLHMRBE-SJLPKXTDSA-N 0 3 412.603 4.197 20 0 HIADHN CSc1nc(C(C)(C)C)nc(C)c1C(=O)N[C@@H]1CCN(Cc2ccccc2)[C@H]1C ZINC000494017099 905355855 /nfs/dbraw/zinc/35/58/55/905355855.db2.gz LBPBRUYGLHMRBE-FUHWJXTLSA-N 0 3 412.603 4.197 20 0 HIADHN Cc1ncc(-c2ccc(NC(=O)c3ccc(CN4CCC(CO)CC4)cc3)cc2)o1 ZINC000494046492 905386162 /nfs/dbraw/zinc/38/61/62/905386162.db2.gz BKDWWTPYNPVCRQ-UHFFFAOYSA-N 0 3 405.498 4.107 20 0 HIADHN COCc1nc(C(=O)N[C@@H]2CCN(Cc3ccccc3)[C@@H]2C)c(-c2ccccc2)s1 ZINC000494051312 905389738 /nfs/dbraw/zinc/38/97/38/905389738.db2.gz UNIUVXOHVDHTDE-YLJYHZDGSA-N 0 3 421.566 4.349 20 0 HIADHN Cc1cccc2sc(N(Cc3ccccc3)C(=O)CN[C@]3(C)CCO[C@@H]3C)nc21 ZINC000494281145 905603833 /nfs/dbraw/zinc/60/38/33/905603833.db2.gz BTZHTRKKPFLRDY-UZUQRXQVSA-N 0 3 409.555 4.295 20 0 HIADHN CC1(C)Cc2ccc(Br)cc2[C@@H]1NCc1ccc(S(C)(=O)=O)cc1 ZINC000494308860 905625131 /nfs/dbraw/zinc/62/51/31/905625131.db2.gz IBIKCRMQZXNHJM-SFHVURJKSA-N 0 3 408.361 4.266 20 0 HIADHN Cc1ccnc(-c2n[nH]c([C@@H](C)N[C@@H](C)Cc3ccc(Br)cc3F)n2)c1 ZINC000494327672 905638911 /nfs/dbraw/zinc/63/89/11/905638911.db2.gz IHENMWYFEXUVNH-QWHCGFSZSA-N 0 3 418.314 4.359 20 0 HIADHN C[C@H]1CN(c2ccc(Cl)c(F)c2)CCN1C(=O)Nc1cccc(CN(C)C)c1 ZINC000494379601 905676138 /nfs/dbraw/zinc/67/61/38/905676138.db2.gz XKJVZIKTZOBJDN-HNNXBMFYSA-N 0 3 404.917 4.283 20 0 HIADHN Cc1ccnc(-c2n[nH]c([C@@H](C)N[C@H](C)Cc3ccc(Br)cc3)n2)c1 ZINC000494407745 905698402 /nfs/dbraw/zinc/69/84/02/905698402.db2.gz UWBUXYSNSSRVPS-ZIAGYGMSSA-N 0 3 400.324 4.219 20 0 HIADHN C[C@H](CC(=O)NCCc1ccccc1)NCc1ccnc(Oc2ccccc2F)c1 ZINC000494489968 905775391 /nfs/dbraw/zinc/77/53/91/905775391.db2.gz XEKRYSAQGBPJPJ-GOSISDBHSA-N 0 3 407.489 4.240 20 0 HIADHN COc1ccc(CCN(CCn2c(C)csc2=O)Cc2ccsc2)cc1OC ZINC000494543528 905823040 /nfs/dbraw/zinc/82/30/40/905823040.db2.gz MSDWXYQRVIGZDT-UHFFFAOYSA-N 0 3 418.584 4.042 20 0 HIADHN CCCC(=O)NC[C@@H]1CCCN(Cc2cc3ccccc3nc2N2CCCCC2)C1 ZINC000512470251 921182838 /nfs/dbraw/zinc/18/28/38/921182838.db2.gz WNLIKHJNABGQLB-FQEVSTJZSA-N 0 3 408.590 4.353 20 0 HIADHN FC(F)(F)c1ccc(Cn2cc(CNC[C@@H](c3ccco3)N3CCCC3)cn2)cc1 ZINC000494584463 905850389 /nfs/dbraw/zinc/85/03/89/905850389.db2.gz HLGRYKPKAMPARS-FQEVSTJZSA-N 0 3 418.463 4.470 20 0 HIADHN Cc1nc2ccccc2n1CCNCc1cnn(Cc2ccc(C(F)(F)F)cc2)c1 ZINC000494595078 905854964 /nfs/dbraw/zinc/85/49/64/905854964.db2.gz GERZUOJJMAUUKR-UHFFFAOYSA-N 0 3 413.447 4.398 20 0 HIADHN CCCCc1cc(NC(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)n[nH]1 ZINC000494649366 905882617 /nfs/dbraw/zinc/88/26/17/905882617.db2.gz MYEZJLDFURFMDX-HXUWFJFHSA-N 0 3 421.549 4.348 20 0 HIADHN CC(C)Oc1ccc(F)cc1NC(=O)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000494678634 905895644 /nfs/dbraw/zinc/89/56/44/905895644.db2.gz FUZBOVTXRVLOTL-UHFFFAOYSA-N 0 3 400.494 4.070 20 0 HIADHN Cc1ccc([C@@H](NCC(C)(C)[C@H](O)C(C)C)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000494714504 905915961 /nfs/dbraw/zinc/91/59/61/905915961.db2.gz IZUZRWYFIKJIHS-FGZHOGPDSA-N 0 3 403.588 4.121 20 0 HIADHN O=C(NC[C@@H]1CCCN(Cc2cnc(-c3ccccc3)[nH]2)C1)Nc1cccc(F)c1 ZINC000512479919 921190073 /nfs/dbraw/zinc/19/00/73/921190073.db2.gz JSKGCGZUTSKRIY-KRWDZBQOSA-N 0 3 407.493 4.250 20 0 HIADHN CCOCCC1(CN[C@H](c2ccc(F)cc2)c2cccc(S(C)(=O)=O)c2)CC1 ZINC000494728506 905929829 /nfs/dbraw/zinc/92/98/29/905929829.db2.gz DKYIZCVOODHBLU-OAQYLSRUSA-N 0 3 405.535 4.115 20 0 HIADHN CCOCCC1(CN[C@H](c2cccc(S(C)(=O)=O)c2)c2ccc(F)c(F)c2)CC1 ZINC000494744369 905942224 /nfs/dbraw/zinc/94/22/24/905942224.db2.gz DFYZJRQUPBINHK-OAQYLSRUSA-N 0 3 423.525 4.254 20 0 HIADHN Cc1ccccc1Oc1ccccc1CNC(=O)N1CCN(C2CCOCC2)C[C@H]1C ZINC000494900532 906076076 /nfs/dbraw/zinc/07/60/76/906076076.db2.gz JZMLTKQKCKABNV-HXUWFJFHSA-N 0 3 423.557 4.182 20 0 HIADHN O=C(CN[C@H](C[C@@H]1CCOC1)c1ccc(F)cc1)Nc1ccc(Br)cc1 ZINC000494905778 906081582 /nfs/dbraw/zinc/08/15/82/906081582.db2.gz FGJRQFLPMCSHGN-IFXJQAMLSA-N 0 3 421.310 4.284 20 0 HIADHN C[C@H](NC(=O)N[C@@H](CN(C)C)c1ccc(Cl)cc1)[C@@H]1OCCc2sccc21 ZINC000494959293 906130387 /nfs/dbraw/zinc/13/03/87/906130387.db2.gz MTUKXRRCZGNSIX-IXDGSTSKSA-N 0 3 407.967 4.006 20 0 HIADHN C[C@@H](CCO)C1(CN[C@H](c2ccc(F)cc2)c2cccc(S(C)(=O)=O)c2)CCC1 ZINC000494959889 906130552 /nfs/dbraw/zinc/13/05/52/906130552.db2.gz YVZYVROPGGIQQR-HTAPYJJXSA-N 0 3 419.562 4.097 20 0 HIADHN CCCC(=O)NC[C@@H]1CCCN(Cc2c[nH]nc2-c2ccc(C(F)(F)F)cc2)C1 ZINC000494961286 906131608 /nfs/dbraw/zinc/13/16/08/906131608.db2.gz UITXGNJLLCWBGP-HNNXBMFYSA-N 0 3 408.468 4.224 20 0 HIADHN CN(CCN(Cc1ccccc1)C(=O)NCCc1cscn1)Cc1ccccc1 ZINC000494981562 906146597 /nfs/dbraw/zinc/14/65/97/906146597.db2.gz SMAKEBOKYHTRCR-UHFFFAOYSA-N 0 3 408.571 4.029 20 0 HIADHN CCC(CC)(CO)CN[C@@H](c1cccc(S(C)(=O)=O)c1)c1ccc(C)cc1C ZINC000494986311 906150245 /nfs/dbraw/zinc/15/02/45/906150245.db2.gz CLGJCVBZXWINDL-QFIPXVFZSA-N 0 3 403.588 4.185 20 0 HIADHN COc1cc(Cl)c(C)cc1NC(=O)CCN[C@@H](c1nnc[nH]1)C1CCCCC1 ZINC000495045792 906202502 /nfs/dbraw/zinc/20/25/02/906202502.db2.gz FGUOYSQIDSUMTO-LJQANCHMSA-N 0 3 405.930 4.015 20 0 HIADHN FC(F)(F)c1cnc(OCCN[C@H](c2nc[nH]n2)C2CCCCC2)c(Cl)c1 ZINC000495053006 906206798 /nfs/dbraw/zinc/20/67/98/906206798.db2.gz YUJWGDSFUIHZJB-AWEZNQCLSA-N 0 3 403.836 4.162 20 0 HIADHN FC(F)(F)c1cnc(OCC[NH2+][C@H](c2nnc[n-]2)C2CCCCC2)c(Cl)c1 ZINC000495053006 906206813 /nfs/dbraw/zinc/20/68/13/906206813.db2.gz YUJWGDSFUIHZJB-AWEZNQCLSA-N 0 3 403.836 4.162 20 0 HIADHN CCc1ccc([C@@H](NCCc2ccncc2C)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000495053356 906207709 /nfs/dbraw/zinc/20/77/09/906207709.db2.gz XLMRGACRCVTBCZ-XMMPIXPASA-N 0 3 408.567 4.278 20 0 HIADHN CCN(C(=O)c1ccc2c(c1)C(C)(C)C(=O)N2)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000495060097 906211297 /nfs/dbraw/zinc/21/12/97/906211297.db2.gz PTPIJTLXFWMKQO-XLIONFOSSA-N 0 3 405.542 4.214 20 0 HIADHN Clc1ccccc1[C@H](N[C@@H]1CCO[C@]2(CCOC2)C1)c1ccc2c(c1)OCCO2 ZINC000495061002 906214280 /nfs/dbraw/zinc/21/42/80/906214280.db2.gz BWKHKEHQLIENKQ-NLSFWIRASA-N 0 3 415.917 4.128 20 0 HIADHN COc1cc(CN[C@@H]2CCc3ccc(C(C)C)cc32)cc(Cl)c1OCC(N)=O ZINC000495156450 906274400 /nfs/dbraw/zinc/27/44/00/906274400.db2.gz HVQZDRNNKMWLNJ-LJQANCHMSA-N 0 3 402.922 4.113 20 0 HIADHN CCN(CC(=O)Nc1cccc(CN2CCSCC2)c1)[C@H](C)Cc1ccsc1 ZINC000495250750 906338132 /nfs/dbraw/zinc/33/81/32/906338132.db2.gz QWGQBVPOEIMMLQ-GOSISDBHSA-N 0 3 417.644 4.189 20 0 HIADHN COC(=O)C(C)(C)CCNCc1cc(Br)ccc1OCc1ccccn1 ZINC000512547150 921228327 /nfs/dbraw/zinc/22/83/27/921228327.db2.gz JQRFITGAYHSTRZ-UHFFFAOYSA-N 0 3 421.335 4.102 20 0 HIADHN Cc1nc(CC(C)C)c(NC(=O)c2ccc(CN3CCC(CO)CC3)cc2)s1 ZINC000495345500 906391613 /nfs/dbraw/zinc/39/16/13/906391613.db2.gz REYWDKOZZSXZJH-UHFFFAOYSA-N 0 3 401.576 4.107 20 0 HIADHN COCC[C@@H](N[C@H](C)CC(=O)Nc1cccc(Br)c1)c1ccc(C)o1 ZINC000495400891 906428618 /nfs/dbraw/zinc/42/86/18/906428618.db2.gz GUWFKJQXTRVSJD-CXAGYDPISA-N 0 3 409.324 4.435 20 0 HIADHN COCC[C@H](N[C@H](C)CC(=O)Nc1ccc(Br)cc1)c1ccc(C)o1 ZINC000495434537 906448729 /nfs/dbraw/zinc/44/87/29/906448729.db2.gz SNDVHDIIIAUVBA-DYVFJYSZSA-N 0 3 409.324 4.435 20 0 HIADHN CC(C)n1cc2cc(NC(=O)c3ccc(CN4CCC(CO)CC4)cc3)ccc2n1 ZINC000495502281 906491844 /nfs/dbraw/zinc/49/18/44/906491844.db2.gz PHEUDGBIRDVTKE-UHFFFAOYSA-N 0 3 406.530 4.074 20 0 HIADHN CCCN(C)[C@@H](CNCc1csc(N(CC)C(C)=O)n1)c1ccc(Cl)cc1 ZINC000512566401 921240896 /nfs/dbraw/zinc/24/08/96/921240896.db2.gz WYGZXJSOTIBRCU-IBGZPJMESA-N 0 3 408.999 4.342 20 0 HIADHN CS[C@@H]1CN(C(=O)c2ccc(-c3nc4ccccc4s3)s2)C[C@@H]1N(C)C ZINC000495608658 906512456 /nfs/dbraw/zinc/51/24/56/906512456.db2.gz UQQKJMZPCXLGEI-SUMWQHHRSA-N 0 3 403.598 4.142 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)[C@@H]1C[C@@H]1c1ccc(Br)cc1 ZINC000496000394 906595137 /nfs/dbraw/zinc/59/51/37/906595137.db2.gz UHGMXDOMHDCXMD-WOJBJXKFSA-N 0 3 401.348 4.143 20 0 HIADHN CCOC(=O)c1c(NC(=O)C2CCSCC2)sc2c1CC(C)(C)NC2(C)C ZINC000496013586 906596097 /nfs/dbraw/zinc/59/60/97/906596097.db2.gz OOZUWRWPZZOUCJ-UHFFFAOYSA-N 0 3 410.605 4.166 20 0 HIADHN CCCN(CCN(C)C)C(=O)c1cc(-c2ccc(C)s2)nc2c1cnn2C(C)C ZINC000496246256 906638744 /nfs/dbraw/zinc/63/87/44/906638744.db2.gz ROZRITFIRCCURR-UHFFFAOYSA-N 0 3 413.591 4.463 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)c1ccc(Br)cc1F ZINC000496272815 906645021 /nfs/dbraw/zinc/64/50/21/906645021.db2.gz QCHSOUPWEGBKFN-QGZVFWFLSA-N 0 3 420.326 4.110 20 0 HIADHN O=C(Nc1ccc(O)cc1)C1CCN(Cc2ccc(OCc3ccncc3)cc2)CC1 ZINC000512604291 921256954 /nfs/dbraw/zinc/25/69/54/921256954.db2.gz HWOPMMUCGKXDKQ-UHFFFAOYSA-N 0 3 417.509 4.217 20 0 HIADHN CCN(CC)[C@@H](C(=O)N[C@H](C)c1n[nH]c(C(C)C)n1)c1cccc(C(F)(F)F)c1 ZINC000496552997 906708957 /nfs/dbraw/zinc/70/89/57/906708957.db2.gz LNCUKXAXZOYGGD-CZUORRHYSA-N 0 3 411.472 4.207 20 0 HIADHN CCCOc1ccc(CN2CCC(C(=O)Nc3ccc(O)cc3)CC2)cc1OCC ZINC000512623362 921265476 /nfs/dbraw/zinc/26/54/76/921265476.db2.gz REJRZZMJNNBPSR-UHFFFAOYSA-N 0 3 412.530 4.430 20 0 HIADHN CCN(C)C(=O)c1cccc(NC(=O)N[C@H](CN(C)Cc2ccccc2)C(C)C)c1 ZINC000496916669 906780473 /nfs/dbraw/zinc/78/04/73/906780473.db2.gz QGMBLAKLGJXWQL-JOCHJYFZSA-N 0 3 410.562 4.057 20 0 HIADHN Cn1ncc(NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)c1-c1ccccc1 ZINC000496916578 906780898 /nfs/dbraw/zinc/78/08/98/906780898.db2.gz OUTXXQPHEGIBCF-UHFFFAOYSA-N 0 3 421.467 4.014 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CN1CCC(C(=O)Nc2ccc(O)cc2)CC1 ZINC000512623982 921266176 /nfs/dbraw/zinc/26/61/76/921266176.db2.gz VLVLWCZIOMWHGL-UHFFFAOYSA-N 0 3 418.541 4.105 20 0 HIADHN COc1ccc([C@@H]2CCCN2C[C@@H](O)CO[C@H]2CCCc3ccccc32)cc1OC ZINC000497096234 906805595 /nfs/dbraw/zinc/80/55/95/906805595.db2.gz HXHVGNOXJJPUDE-PUHATCMVSA-N 0 3 411.542 4.296 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)cc1CN1CCC(C(=O)N[C@@H](C)C(C)C)CC1 ZINC000512639365 921270769 /nfs/dbraw/zinc/27/07/69/921270769.db2.gz WTMUUMGXUPCWQH-INIZCTEOSA-N 0 3 402.970 4.207 20 0 HIADHN COc1ccc(CC[C@H]2CCCCN2Cc2ccc([S@@](C)=O)cc2)cc1OC ZINC000512644041 921272167 /nfs/dbraw/zinc/27/21/67/921272167.db2.gz IHVOWBIUIJABEJ-PIIWDFAUSA-N 0 3 401.572 4.429 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)c2cc(C)c(OCc3cccnc3)c(C)c2)o1 ZINC000497388627 906874299 /nfs/dbraw/zinc/87/42/99/906874299.db2.gz MKBINHZDKPKKBL-UHFFFAOYSA-N 0 3 421.541 4.383 20 0 HIADHN CC(C)c1ccc(-c2noc(CCC(=O)NC[C@@H](c3ccccc3)N(C)C)n2)cc1 ZINC000497391461 906875058 /nfs/dbraw/zinc/87/50/58/906875058.db2.gz UIWKXZUJSKYMEK-NRFANRHFSA-N 0 3 406.530 4.212 20 0 HIADHN CC(C)CC[C@@H](NC(=O)N(C)CCCN1CCN(C)CC1)c1ccc(Cl)cc1 ZINC000497393650 906876414 /nfs/dbraw/zinc/87/64/14/906876414.db2.gz YKYITKUQXTVRED-OAQYLSRUSA-N 0 3 409.018 4.096 20 0 HIADHN Cc1nsc(C)c1C(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1 ZINC000497399124 906880237 /nfs/dbraw/zinc/88/02/37/906880237.db2.gz LVAJHXKIFGFBFV-UHFFFAOYSA-N 0 3 420.582 4.377 20 0 HIADHN O=C(Nc1cc(C(F)F)ccc1Cl)N[C@H]1CCN(Cc2ccccc2)C[C@H]1CO ZINC000497448114 906923769 /nfs/dbraw/zinc/92/37/69/906923769.db2.gz XVMDGDFGNQXMHY-WMZOPIPTSA-N 0 3 423.891 4.282 20 0 HIADHN O=C(N[C@@H]1CCN(c2ccc(Cl)c(F)c2)C1)c1cccc(CN2CCCC2)c1 ZINC000497456498 906932389 /nfs/dbraw/zinc/93/23/89/906932389.db2.gz CJGDGTCPTAKUEV-GOSISDBHSA-N 0 3 401.913 4.084 20 0 HIADHN O=C(Nc1cccc(CN2CCCCC2=O)c1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000497469660 906947286 /nfs/dbraw/zinc/94/72/86/906947286.db2.gz NFKYAEBIKXIMKI-OAQYLSRUSA-N 0 3 423.532 4.189 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)c1cc(-c2ccccc2Cl)on1 ZINC000512675750 921284018 /nfs/dbraw/zinc/28/40/18/921284018.db2.gz RAQMQCCRTQCQCN-UHFFFAOYSA-N 0 3 401.869 4.338 20 0 HIADHN Cc1nc2c(s1)[C@@H](N(C)C(=O)[C@H]1CN(Cc3ccccc3)CCC1(F)F)CCC2 ZINC000512689996 921288413 /nfs/dbraw/zinc/28/84/13/921288413.db2.gz KKAOQBDTDSAYAE-MJGOQNOKSA-N 0 3 419.541 4.445 20 0 HIADHN NC(=O)CC1(NCc2cccc(NC(=O)c3ccc(Cl)cc3Cl)c2)CCC1 ZINC000497583740 907065673 /nfs/dbraw/zinc/06/56/73/907065673.db2.gz BSXUJDJBMMUZMJ-UHFFFAOYSA-N 0 3 406.313 4.133 20 0 HIADHN Cc1ccc(CNC(=O)C2CCN(Cc3ccc(OCC(F)(F)F)cc3)CC2)cc1 ZINC000512697092 921290890 /nfs/dbraw/zinc/29/08/90/921290890.db2.gz MGIXXHLXBZHCME-UHFFFAOYSA-N 0 3 420.475 4.465 20 0 HIADHN CC(C)[C@@H](c1ccccc1)N(C)C(=O)NCCCN1CCN(C)C[C@H]1c1ccccc1 ZINC000497604667 907083333 /nfs/dbraw/zinc/08/33/33/907083333.db2.gz SUXTVSNKFAITSJ-DQEYMECFSA-N 0 3 422.617 4.404 20 0 HIADHN CN(CCCCCc1cc(-c2cccc(F)c2)no1)Cc1cc(C(N)=O)cs1 ZINC000512705095 921292950 /nfs/dbraw/zinc/29/29/50/921292950.db2.gz CIGKRQNENSECKR-UHFFFAOYSA-N 0 3 401.507 4.486 20 0 HIADHN Cc1cccnc1[C@@H](NC(=O)NC[C@@H](c1ccc(OC(C)C)cc1)N(C)C)C(C)C ZINC000497629909 907110958 /nfs/dbraw/zinc/11/09/58/907110958.db2.gz UQINSEWDZTZNKN-VXKWHMMOSA-N 0 3 412.578 4.476 20 0 HIADHN Cc1noc(CSc2ccc(C(=O)NC[C@@H](c3ccccc3)N3CCCC3)cc2)n1 ZINC000497696940 907202463 /nfs/dbraw/zinc/20/24/63/907202463.db2.gz RCBULAFRDXAGHN-NRFANRHFSA-N 0 3 422.554 4.237 20 0 HIADHN CCOc1cc(C[NH2+]C[C@@H](c2cccc(F)c2)N(C)C)cc(Br)c1[O-] ZINC000497703886 907208157 /nfs/dbraw/zinc/20/81/57/907208157.db2.gz BCVRVUINYTYTGR-KRWDZBQOSA-N 0 3 411.315 4.085 20 0 HIADHN CCOc1cc(CNCc2ccc(OC(F)F)cc2)cc(Br)c1O ZINC000497704787 907208495 /nfs/dbraw/zinc/20/84/95/907208495.db2.gz AJCUMZKTBIBFIY-UHFFFAOYSA-N 0 3 402.235 4.445 20 0 HIADHN COc1cc(C)c(CN(C)C[C@H](O)CO[C@@H](C)c2ccc(Cl)cc2)cc1OC ZINC000497706074 907210274 /nfs/dbraw/zinc/21/02/74/907210274.db2.gz LDBXIMQLIALILC-JXFKEZNVSA-N 0 3 407.938 4.236 20 0 HIADHN O=C(COc1ccc(Oc2ccccn2)cc1)NC[C@H](c1cccs1)N1CCCC1 ZINC000497756507 907247426 /nfs/dbraw/zinc/24/74/26/907247426.db2.gz WVDPHIOWJNQGFC-HXUWFJFHSA-N 0 3 423.538 4.268 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cnn(-c2cccc(C)c2)c1C)c1cccc(OC)c1 ZINC000497757637 907249209 /nfs/dbraw/zinc/24/92/09/907249209.db2.gz QVNWUTIAYAAIQA-DEOSSOPVSA-N 0 3 420.557 4.311 20 0 HIADHN CCN(C(=O)N[C@@H](C)c1nccn1-c1ccccc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000512778479 921309744 /nfs/dbraw/zinc/30/97/44/921309744.db2.gz NKJNPIBPSNQKHB-NZQKXSOJSA-N 0 3 417.557 4.239 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)c2ccc(Cn3nc(C)cc3C)cc2)N(C)C)cc1 ZINC000497803005 907287233 /nfs/dbraw/zinc/28/72/33/907287233.db2.gz VOJKPCGXTUUFFR-XMMPIXPASA-N 0 3 404.558 4.143 20 0 HIADHN CC(C)(C)[C@@H](NC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2)c1cc2ccccc2o1 ZINC000497811678 907296214 /nfs/dbraw/zinc/29/62/14/907296214.db2.gz FRSCRASOJBGQIJ-KOSHJBKYSA-N 0 3 422.525 4.434 20 0 HIADHN C[C@@H](CC(=O)OC(C)(C)C)N[C@@H](CN1CCCC1=O)c1cccc(C(F)(F)F)c1 ZINC000497830964 907313044 /nfs/dbraw/zinc/31/30/44/907313044.db2.gz FSVCDIOGPDHBNX-YOEHRIQHSA-N 0 3 414.468 4.079 20 0 HIADHN OCCn1nccc1C1CCN(Cc2ccc(Oc3cc(F)cc(F)c3)cc2)CC1 ZINC000512806332 921315335 /nfs/dbraw/zinc/31/53/35/921315335.db2.gz UHGPSGBHAZUYMV-UHFFFAOYSA-N 0 3 413.468 4.326 20 0 HIADHN CCCCOC1CCN(C(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)CC1 ZINC000512807693 921315663 /nfs/dbraw/zinc/31/56/63/921315663.db2.gz JHXBKGZMGBJXGI-JOCHJYFZSA-N 0 3 405.583 4.067 20 0 HIADHN CCS[C@@H]1CC[C@H](N(C)C(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)C1 ZINC000512807942 921315843 /nfs/dbraw/zinc/31/58/43/921315843.db2.gz LWIJXGQEXWFCNS-TYPHKJRUSA-N 0 3 407.624 4.392 20 0 HIADHN CCS[C@@H]1CC[C@@H](N(C)C(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)C1 ZINC000512807941 921315922 /nfs/dbraw/zinc/31/59/22/921315922.db2.gz LWIJXGQEXWFCNS-NRSPTQNISA-N 0 3 407.624 4.392 20 0 HIADHN CCCc1noc2nc(C3CC3)cc(C(=O)NC3CCN(Cc4ccccc4)CC3)c12 ZINC000497871924 907349965 /nfs/dbraw/zinc/34/99/65/907349965.db2.gz MGSBBTCHVKWWIL-UHFFFAOYSA-N 0 3 418.541 4.447 20 0 HIADHN CCn1nc(C(C)C)cc1C(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1 ZINC000497880618 907354556 /nfs/dbraw/zinc/35/45/56/907354556.db2.gz DPAARPHNTDJKPY-UHFFFAOYSA-N 0 3 410.484 4.249 20 0 HIADHN CCN(C(=O)c1ccc(NC(=O)C2CC2)cc1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000497950641 907421275 /nfs/dbraw/zinc/42/12/75/907421275.db2.gz JMHTXWRISUQLGY-MBSDFSHPSA-N 0 3 405.542 4.333 20 0 HIADHN CCOC(=O)c1c(C)[nH]c(C(=O)N(CC)[C@H]2CCN([C@@H](C)c3ccccc3)C2)c1C ZINC000497956292 907426011 /nfs/dbraw/zinc/42/60/11/907426011.db2.gz ATHGBRQFTZSIPJ-ICSRJNTNSA-N 0 3 411.546 4.106 20 0 HIADHN CN1CC[C@H](NC(=O)N[C@H](c2cccc(F)c2)c2ccccn2)[C@H]1c1ccccc1 ZINC000497958298 907430167 /nfs/dbraw/zinc/43/01/67/907430167.db2.gz OFIDFYVOJUSVLI-YTFSRNRJSA-N 0 3 404.489 4.055 20 0 HIADHN COc1ccc([C@H](CNC(=O)Cc2ccc(OC(F)(F)F)cc2)N2CCCC2)cc1 ZINC000497992223 907473061 /nfs/dbraw/zinc/47/30/61/907473061.db2.gz ACQAGAXDROOASA-FQEVSTJZSA-N 0 3 422.447 4.090 20 0 HIADHN Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000497995639 907474889 /nfs/dbraw/zinc/47/48/89/907474889.db2.gz CVWUWCZMCHLHCW-SIKLNZKXSA-N 0 3 422.573 4.338 20 0 HIADHN CCN(C(=O)c1cncc(Br)c1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000498007357 907495160 /nfs/dbraw/zinc/49/51/60/907495160.db2.gz AKFMOBSRUFOSQW-DNVCBOLYSA-N 0 3 402.336 4.142 20 0 HIADHN CCN(C(=O)c1cnn(-c2ccccc2)c1C)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000498022470 907520455 /nfs/dbraw/zinc/52/04/55/907520455.db2.gz MOPDGIPKXNMDNJ-WMZHIEFXSA-N 0 3 402.542 4.478 20 0 HIADHN CN(C)Cc1ccccc1C(=O)N1CC[C@@H](Cc2ccc(Br)cc2)C1 ZINC000498027204 907529173 /nfs/dbraw/zinc/52/91/73/907529173.db2.gz KBMIMIIUQLNLCE-KRWDZBQOSA-N 0 3 401.348 4.216 20 0 HIADHN CCC(CC)[C@@H]1C[C@@H](NC(=O)NC[C@@H](c2cccc(OC)c2)N2CCCC2)CCO1 ZINC000498116900 907628681 /nfs/dbraw/zinc/62/86/81/907628681.db2.gz HBUTYNDPLCHXEG-PMVMPFDFSA-N 0 3 417.594 4.115 20 0 HIADHN Brc1ccc(-c2ccc(CN[C@@H]3CCCN(c4ncccn4)C3)o2)cc1 ZINC000512840779 921344114 /nfs/dbraw/zinc/34/41/14/921344114.db2.gz PDIJRQILLVUSBE-QGZVFWFLSA-N 0 3 413.319 4.258 20 0 HIADHN Cc1cccc([C@H](NC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)c2ccccn2)c1 ZINC000498231859 907765045 /nfs/dbraw/zinc/76/50/45/907765045.db2.gz QGFWADLFZWJNDG-ZCYQVOJMSA-N 0 3 414.553 4.443 20 0 HIADHN Cc1cccc([C@H](NC(=O)NC[C@H]2CCCN2Cc2ccccc2)c2ccccn2)c1 ZINC000498244484 907782310 /nfs/dbraw/zinc/78/23/10/907782310.db2.gz UQQLZXAZLXPWEJ-NOZRDPDXSA-N 0 3 414.553 4.443 20 0 HIADHN CC[C@@H](NCc1ccc(Br)c(Br)c1)[C@H](O)C(F)(F)F ZINC000498352845 907854093 /nfs/dbraw/zinc/85/40/93/907854093.db2.gz IVDQZVVEFXVEJJ-MNOVXSKESA-N 0 3 405.052 4.003 20 0 HIADHN O=C(N[C@H](CC1CCC1)c1ccccc1)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1CO ZINC000498359887 907857337 /nfs/dbraw/zinc/85/73/37/907857337.db2.gz MWSXSHFQFYIPEE-DSNGMDLFSA-N 0 3 421.585 4.100 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c2sc(C(=O)N(CCN(C)C)C3CCCC3)cc12 ZINC000498467019 907934826 /nfs/dbraw/zinc/93/48/26/907934826.db2.gz QHICDJLXDPLAQU-UHFFFAOYSA-N 0 3 414.550 4.481 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)NCc1cc(F)c(C(F)(F)F)cc1F ZINC000512877800 921374118 /nfs/dbraw/zinc/37/41/18/921374118.db2.gz JHEHUIQEIFUCHE-UHFFFAOYSA-N 0 3 415.406 4.257 20 0 HIADHN CC(C)(C)c1nc(CCNC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)cs1 ZINC000498599601 908047798 /nfs/dbraw/zinc/04/77/98/908047798.db2.gz JMWQACXCVIPRER-QGZVFWFLSA-N 0 3 403.567 4.151 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)N[C@H](C)c2ccc(-c3cccnc3)cc2)cc1 ZINC000498608222 908057920 /nfs/dbraw/zinc/05/79/20/908057920.db2.gz UHCHXPDICADXMZ-KOSHJBKYSA-N 0 3 418.541 4.420 20 0 HIADHN Cc1ccc(-c2nn(Cc3ccccc3)cc2C(=O)N2CCN(C)CC[C@H]2C)cc1 ZINC000498705549 908130949 /nfs/dbraw/zinc/13/09/49/908130949.db2.gz ARKGMPOKFGMHBB-HXUWFJFHSA-N 0 3 402.542 4.073 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)[C@H]1C[C@@H]1c1ccc(Br)cc1 ZINC000498709804 908136721 /nfs/dbraw/zinc/13/67/21/908136721.db2.gz BQNKHNYNGNOFND-MOPGFXCFSA-N 0 3 419.338 4.282 20 0 HIADHN Cc1nc(C(=O)N(CCN(C)C)Cc2ccccc2F)nn1-c1ccccc1C(C)C ZINC000498712180 908138039 /nfs/dbraw/zinc/13/80/39/908138039.db2.gz ZYRDAJSVAMFFLM-UHFFFAOYSA-N 0 3 423.536 4.042 20 0 HIADHN C[C@@H]1CCN(C)CCN1C(=O)[C@](C)(Cc1nc2ccccc2s1)c1ccccc1 ZINC000498717185 908141984 /nfs/dbraw/zinc/14/19/84/908141984.db2.gz RFGXAIPMSRFHPQ-HOYKHHGWSA-N 0 3 407.583 4.349 20 0 HIADHN C[C@H]1[C@@H](NC(=O)NCc2ccc(-c3cccnc3)cc2)CCN1Cc1ccccc1 ZINC000498719303 908145619 /nfs/dbraw/zinc/14/56/19/908145619.db2.gz QEJYWSZWGFIAJP-CYFREDJKSA-N 0 3 400.526 4.211 20 0 HIADHN Cc1ccc(-c2nn(Cc3ccccc3)cc2C(=O)N2CCN(C)CC[C@H]2C)cc1C ZINC000498723816 908149316 /nfs/dbraw/zinc/14/93/16/908149316.db2.gz ANQUXBZQAYIOCC-OAQYLSRUSA-N 0 3 416.569 4.381 20 0 HIADHN CN(C)C[C@H](NC(=O)NCc1cc(Cl)ccc1OC(F)F)c1ccc(F)cc1 ZINC000498725901 908151904 /nfs/dbraw/zinc/15/19/04/908151904.db2.gz KMZNQZLTYXWHQO-INIZCTEOSA-N 0 3 415.843 4.183 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2C(=O)N2CCN(C)CC[C@H]2C)cc1C ZINC000498729282 908156182 /nfs/dbraw/zinc/15/61/82/908156182.db2.gz VOXCBJPQUREVEC-HXUWFJFHSA-N 0 3 402.542 4.322 20 0 HIADHN O=C(c1cccc(CN2CCCC2)c1)N1CCO[C@H](c2ccc(OC(F)F)cc2)C1 ZINC000498841655 908247326 /nfs/dbraw/zinc/24/73/26/908247326.db2.gz NUBVYDOROOSSTC-NRFANRHFSA-N 0 3 416.468 4.098 20 0 HIADHN CCc1cccc(C)c1NC(=O)N1CCC[C@H](CN2CCN(c3ccccn3)CC2)C1 ZINC000498846205 908249808 /nfs/dbraw/zinc/24/98/08/908249808.db2.gz WTHYKXITJDIGGG-OAQYLSRUSA-N 0 3 421.589 4.019 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)N[C@H](C)c1noc(-c2ccc(Cl)cc2)n1 ZINC000498907694 908316644 /nfs/dbraw/zinc/31/66/44/908316644.db2.gz FWANYHWQKFXTJP-MRXNPFEDSA-N 0 3 419.957 4.359 20 0 HIADHN C[C@@H](NC(=O)NCc1csc(CCc2ccccc2)n1)[C@H](c1ccccc1)N(C)C ZINC000498907978 908316759 /nfs/dbraw/zinc/31/67/59/908316759.db2.gz PUEUYXVRSDTIKO-WZONZLPQSA-N 0 3 422.598 4.419 20 0 HIADHN C[C@H](C(=O)N[C@@H](C)c1cccc2ccccc21)N1CCC[C@H](c2nc(C3CC3)n[nH]2)C1 ZINC000498935717 908344032 /nfs/dbraw/zinc/34/40/32/908344032.db2.gz ADAOXGFDDNAPLL-QKLQHJQFSA-N 0 3 417.557 4.281 20 0 HIADHN C[C@H](C(=O)N[C@@H](C)c1cccc2ccccc21)N1CCC[C@H](c2n[nH]c(C3CC3)n2)C1 ZINC000498935717 908344050 /nfs/dbraw/zinc/34/40/50/908344050.db2.gz ADAOXGFDDNAPLL-QKLQHJQFSA-N 0 3 417.557 4.281 20 0 HIADHN Cc1cccc([C@H](NC(=O)N(CCN(C)C)Cc2ccc(F)cc2)c2ccccn2)c1 ZINC000499010906 908387244 /nfs/dbraw/zinc/38/72/44/908387244.db2.gz BPDTVBFQBDXVIL-DEOSSOPVSA-N 0 3 420.532 4.392 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)N2CCC(OC(C)(C)C)CC2)N(C)C)cc1 ZINC000512913241 921405367 /nfs/dbraw/zinc/40/53/67/921405367.db2.gz UDCZOFQIEISXHZ-OAQYLSRUSA-N 0 3 405.583 4.066 20 0 HIADHN CC(C)(CNC(=O)NCc1ccccc1CN1CCC(O)CC1)C1CCCCC1 ZINC000499030538 908406879 /nfs/dbraw/zinc/40/68/79/908406879.db2.gz GTIAIELYVCKLFT-UHFFFAOYSA-N 0 3 401.595 4.049 20 0 HIADHN COc1ccc(C[C@H](N[C@H](C)C(=O)N2CCC(C)CC2)c2ccc(OC)cc2)cc1 ZINC000499058308 908427116 /nfs/dbraw/zinc/42/71/16/908427116.db2.gz WRMITMCUPNGRKA-DVECYGJZSA-N 0 3 410.558 4.224 20 0 HIADHN COc1ccc(C[C@@H](N[C@@H](C)C(=O)N2CCC(C)CC2)c2ccc(OC)cc2)cc1 ZINC000499058310 908427758 /nfs/dbraw/zinc/42/77/58/908427758.db2.gz WRMITMCUPNGRKA-YADARESESA-N 0 3 410.558 4.224 20 0 HIADHN COc1ccc(C[C@H](N[C@H](C)C(=O)NCc2ccccc2)c2ccc(OC)cc2)cc1 ZINC000499068980 908435232 /nfs/dbraw/zinc/43/52/32/908435232.db2.gz KDATYEPDPTWRKA-CLOONOSVSA-N 0 3 418.537 4.282 20 0 HIADHN C[C@@H]1CC[C@@H](c2ccccc2)N(C(=O)NCc2ccccc2CN2CCC(O)CC2)C1 ZINC000499110007 908468610 /nfs/dbraw/zinc/46/86/10/908468610.db2.gz ITIYPOFKDYWCCX-NLFFAJNJSA-N 0 3 421.585 4.326 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)C2(c3ccc(Cl)cc3)CCOCC2)N(C)C)cc1 ZINC000499138179 908495379 /nfs/dbraw/zinc/49/53/79/908495379.db2.gz XTUUUSGMMLVWRM-OAQYLSRUSA-N 0 3 400.950 4.116 20 0 HIADHN CC1CCN(CCNC(=O)c2cccc(NC(=O)CCCc3cccs3)c2)CC1 ZINC000499186750 908541393 /nfs/dbraw/zinc/54/13/93/908541393.db2.gz CDSVLWWWRHQWCS-UHFFFAOYSA-N 0 3 413.587 4.171 20 0 HIADHN Cc1ccc(C[C@@H]2CCCN2C(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)cc1 ZINC000499200227 908554309 /nfs/dbraw/zinc/55/43/09/908554309.db2.gz BHICFRRTEVVDMS-VWLOTQADSA-N 0 3 405.586 4.373 20 0 HIADHN CCOc1cccc(CNC(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)c1OC(F)F ZINC000499210826 908566179 /nfs/dbraw/zinc/56/61/79/908566179.db2.gz LLECZORQLQXJJO-BEFAXECRSA-N 0 3 421.488 4.177 20 0 HIADHN CN(CC[C@H]1CCCCN1C)C(=O)CCCC(=O)c1ccc(Br)cc1 ZINC000499246473 908615349 /nfs/dbraw/zinc/61/53/49/908615349.db2.gz CQGOYCJDRBPCFR-GOSISDBHSA-N 0 3 409.368 4.135 20 0 HIADHN CC(C)(C)[C@H](CN1CCc2ccccc2C1)NC(=O)c1ncsc1Br ZINC000512943535 921430211 /nfs/dbraw/zinc/43/02/11/921430211.db2.gz QDDZGYRWYFCFIV-HNNXBMFYSA-N 0 3 422.392 4.108 20 0 HIADHN CN(C(=O)N[C@@H](c1cccc(F)c1)c1ccccn1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000499317042 908689836 /nfs/dbraw/zinc/68/98/36/908689836.db2.gz QCIRTVZYLIRGCL-VWNXMTODSA-N 0 3 418.516 4.226 20 0 HIADHN Cc1nn(-c2ccccc2)c(Oc2cccc(F)c2)c1CNCC[C@@H](C)[S@@](C)=O ZINC000499698144 908880340 /nfs/dbraw/zinc/88/03/40/908880340.db2.gz ABBQITNSVUKBDW-HYDGNGQDSA-N 0 3 415.534 4.359 20 0 HIADHN CN(C)CCN(C[C@@H]1CCCO1)C(=O)c1sc2cc(Cl)ccc2c1Cl ZINC000499917446 909031550 /nfs/dbraw/zinc/03/15/50/909031550.db2.gz CYPAGISMBQAYQH-ZDUSSCGKSA-N 0 3 401.359 4.391 20 0 HIADHN FC(F)(F)c1ccc(C[C@]2(NCc3ccc(Br)cn3)CCOC2)cc1 ZINC000513012883 921476730 /nfs/dbraw/zinc/47/67/30/921476730.db2.gz SZARMBVODGADNM-QGZVFWFLSA-N 0 3 415.253 4.354 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N[C@H](C)Cc1cc(C)nn1-c1ccccc1)c1ccco1 ZINC000499968092 909410767 /nfs/dbraw/zinc/41/07/67/909410767.db2.gz JSZCAYKQQFAKHH-SVMVAKDDSA-N 0 3 423.561 4.133 20 0 HIADHN COc1ccccc1C[C@@H](C)CC(=O)N(CCN(C)C)Cc1ccc(F)c(F)c1 ZINC000499978602 909427588 /nfs/dbraw/zinc/42/75/88/909427588.db2.gz MVLJPDZYBWHORK-QGZVFWFLSA-N 0 3 404.501 4.133 20 0 HIADHN CCN(C(=O)c1nnn(-c2cccc(C)c2)c1C)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000499997329 909449529 /nfs/dbraw/zinc/44/95/29/909449529.db2.gz FHQGWYVNEXJLFI-WMZHIEFXSA-N 0 3 417.557 4.182 20 0 HIADHN CCN(C(=O)c1cccc(NC(=O)C2CC2)c1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000500010784 909466188 /nfs/dbraw/zinc/46/61/88/909466188.db2.gz UYHRYBOSESUZRF-JPYJTQIMSA-N 0 3 405.542 4.333 20 0 HIADHN CCc1nnc(NC(=O)[C@H](C)[C@H](C)NCc2ccc(Oc3ccccc3)o2)s1 ZINC000513041872 921501429 /nfs/dbraw/zinc/50/14/29/921501429.db2.gz SSLIGHMOYBTUME-KGLIPLIRSA-N 0 3 400.504 4.239 20 0 HIADHN CC(C)[C@@H]1CC[C@@H](C)C[C@H]1OCC(=O)N(C)C1CCN(CCc2ccccn2)CC1 ZINC000500063104 909530945 /nfs/dbraw/zinc/53/09/45/909530945.db2.gz LZZSZDYPRSCMPQ-FGCOXFRFSA-N 0 3 415.622 4.024 20 0 HIADHN COc1ccc(OC(F)F)c(CN(C)C2CCN(C(=O)c3ccccc3)CC2)c1 ZINC000513046414 921503939 /nfs/dbraw/zinc/50/39/39/921503939.db2.gz LHYWKZITZQWXSQ-UHFFFAOYSA-N 0 3 404.457 4.033 20 0 HIADHN Cc1ccc([C@H](Cn2ccnc2)NC(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)c(C)c1 ZINC000500099598 909577707 /nfs/dbraw/zinc/57/77/07/909577707.db2.gz BNHIZAIWXPHWPV-NKKJXINNSA-N 0 3 419.573 4.232 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N[C@@H](Cn1ccnc1)c1ccc(C)cc1C)c1ccco1 ZINC000500113764 909594795 /nfs/dbraw/zinc/59/47/95/909594795.db2.gz PVFBQWYWYLMJRN-NNWRFLSQSA-N 0 3 423.561 4.263 20 0 HIADHN CC(C)(C)OC(=O)c1cccc(CN2CCC(n3cc(Br)cn3)CC2)c1 ZINC000500119475 909597534 /nfs/dbraw/zinc/59/75/34/909597534.db2.gz CBLAIZNNMOWPQI-UHFFFAOYSA-N 0 3 420.351 4.438 20 0 HIADHN CN(C)C[C@H](NC(=O)N[C@@H]1CC(C)(C)Oc2cc(F)ccc21)c1ccc(F)cc1 ZINC000500142444 909622081 /nfs/dbraw/zinc/62/20/81/909622081.db2.gz ORGWSQSRPIXBKF-MOPGFXCFSA-N 0 3 403.473 4.169 20 0 HIADHN CCOC(=O)c1oc2ccccc2c1CN(C)C1CCN(C(=O)c2ccccc2)CC1 ZINC000500178650 909672516 /nfs/dbraw/zinc/67/25/16/909672516.db2.gz KAQYNNVRAOPAAA-UHFFFAOYSA-N 0 3 420.509 4.346 20 0 HIADHN CC(C)C[C@@H](NC(=O)CN(C)C1CCN(C(=O)c2ccccc2)CC1)c1ccccc1 ZINC000500208850 909699044 /nfs/dbraw/zinc/69/90/44/909699044.db2.gz BVDLQVZBJLQLNB-XMMPIXPASA-N 0 3 421.585 4.127 20 0 HIADHN CCN1CCN(Cc2ccc(NCc3ccccc3OCc3ccncc3)cc2)CC1 ZINC000513060367 921516692 /nfs/dbraw/zinc/51/66/92/921516692.db2.gz ZWBFMXDMDIZRLZ-UHFFFAOYSA-N 0 3 416.569 4.410 20 0 HIADHN COc1ccc(OC)c([C@@H](C)NC(=O)[C@H](C)N[C@@H](C)c2ccc(SC)cc2)c1 ZINC000500238484 909727582 /nfs/dbraw/zinc/72/75/82/909727582.db2.gz PUMVZRQSQCKMJW-XHSDSOJGSA-N 0 3 402.560 4.342 20 0 HIADHN CC[C@H](NC(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1)c1ccc(Cl)s1 ZINC000513075013 921528757 /nfs/dbraw/zinc/52/87/57/921528757.db2.gz KBASXTWKJHUPDQ-UXLLHSPISA-N 0 3 414.015 4.383 20 0 HIADHN COc1ccc(C(=O)CCCC(=O)N[C@H]2CCN(Cc3ccccc3)[C@@H](C)C2)cc1 ZINC000500494795 909890298 /nfs/dbraw/zinc/89/02/98/909890298.db2.gz ABSQLHWEXQBYAQ-UGKGYDQZSA-N 0 3 408.542 4.218 20 0 HIADHN CC[C@H]1C[C@@]1(NCc1ccc(OCC(=O)N2CCCC2)c(OC)c1)c1cccc(C)c1 ZINC000500496047 909891565 /nfs/dbraw/zinc/89/15/65/909891565.db2.gz JVHVXIBUUOZDTK-LVXARBLLSA-N 0 3 422.569 4.420 20 0 HIADHN COc1ccccc1[C@H](NC(=O)N[C@H](C)[C@H](c1ccccc1)N(C)C)c1ccccn1 ZINC000500525025 909907570 /nfs/dbraw/zinc/90/75/70/909907570.db2.gz IVQGYGHVZPSOAB-PUZWTLIVSA-N 0 3 418.541 4.170 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N[C@@H](C)c1cnn(Cc2ccccc2)c1)c1ccco1 ZINC000500601235 909958516 /nfs/dbraw/zinc/95/85/16/909958516.db2.gz KTTMSJHDOVEDBQ-BBTUJRGHSA-N 0 3 409.534 4.014 20 0 HIADHN CCN1CCN(Cc2ccc(CNC(=O)Nc3cccc4ccccc43)cc2)CC1 ZINC000500619702 909970513 /nfs/dbraw/zinc/97/05/13/909970513.db2.gz JZZLMOMDEZVJSS-UHFFFAOYSA-N 0 3 402.542 4.299 20 0 HIADHN Cc1ccccc1[C@@H]([C@H](C)NC(=O)C(=O)Nc1cc(C(F)F)ccc1Cl)N(C)C ZINC000500626209 909976475 /nfs/dbraw/zinc/97/64/75/909976475.db2.gz SAROIDBSFVJGNA-SCLBCKFNSA-N 0 3 423.891 4.332 20 0 HIADHN C[S@](=O)Cc1ccc(CNCc2cn(-c3ccccc3)nc2-c2cccnc2)cc1 ZINC000513088938 921539875 /nfs/dbraw/zinc/53/98/75/921539875.db2.gz KLGOCULGGIYGCS-PMERELPUSA-N 0 3 416.550 4.103 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)N[C@H](C)c2cc3ccccc3o2)CC1 ZINC000500657038 910000532 /nfs/dbraw/zinc/00/05/32/910000532.db2.gz WHTIRDYYQFWOCN-LJQANCHMSA-N 0 3 420.557 4.131 20 0 HIADHN CCC[C@@H](NC(=O)NCc1ccc(CN2CCN(CC)CC2)cc1)c1ccccc1 ZINC000500661625 910002546 /nfs/dbraw/zinc/00/25/46/910002546.db2.gz HPCIMNIVWYERRB-XMMPIXPASA-N 0 3 408.590 4.165 20 0 HIADHN CCOc1ccc(-c2nc(C)c(C(=O)N(CCN(C)C)Cc3ccccn3)s2)cc1 ZINC000500774186 910071512 /nfs/dbraw/zinc/07/15/12/910071512.db2.gz NXHTVYRUQGXHHH-UHFFFAOYSA-N 0 3 424.570 4.116 20 0 HIADHN Cc1c2ccc(C(F)(F)F)nc2sc1C(=O)N(CCN(C)C)Cc1ccccn1 ZINC000500777937 910073209 /nfs/dbraw/zinc/07/32/09/910073209.db2.gz ZVHYNCWGFDXOIP-UHFFFAOYSA-N 0 3 422.476 4.223 20 0 HIADHN COc1cccc([C@@H](CNC(=O)N[C@H](C)c2cccc(F)c2F)N2CCCC2)c1 ZINC000500834535 910110657 /nfs/dbraw/zinc/11/06/57/910110657.db2.gz REBBTBYHTKUHEH-FOIQADDNSA-N 0 3 403.473 4.171 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)c2cc(C3CC3)nn2-c2ccccc2)C1 ZINC000500845672 910120976 /nfs/dbraw/zinc/12/09/76/910120976.db2.gz XDUJSLJZVWGZIA-WIYYLYMNSA-N 0 3 400.526 4.315 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCc1csc(Br)c1)c1ccsc1 ZINC000501139282 910319106 /nfs/dbraw/zinc/31/91/06/910319106.db2.gz ARIZYBRLPACZRH-CQSZACIVSA-N 0 3 416.410 4.454 20 0 HIADHN COCCN(C)CCOc1cccc(CNC(=O)Nc2cccc3ccsc32)c1 ZINC000501220121 910382653 /nfs/dbraw/zinc/38/26/53/910382653.db2.gz XMYVDBPIDZMSGG-UHFFFAOYSA-N 0 3 413.543 4.180 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)C2(c3cccc(Br)c3)CC2)C1 ZINC000501228370 910387552 /nfs/dbraw/zinc/38/75/52/910387552.db2.gz PRFXPSYMHVQRBZ-JXFKEZNVSA-N 0 3 413.359 4.432 20 0 HIADHN Cc1cc(C)n2c(CN3CCC[C@H](c4nc(-c5ccc(Cl)cc5)no4)C3)cnc2n1 ZINC000513128826 921571921 /nfs/dbraw/zinc/57/19/21/921571921.db2.gz SXPXJRBTDRFJMT-KRWDZBQOSA-N 0 3 422.920 4.429 20 0 HIADHN Cc1ccc(NC(=O)CS[C@H](C)C(=O)N(CCN(C)C)CC2CCCCC2)cc1 ZINC000501249641 910407627 /nfs/dbraw/zinc/40/76/27/910407627.db2.gz UDVVUFCSDUDBJN-LJQANCHMSA-N 0 3 419.635 4.026 20 0 HIADHN CN(C(=O)c1ccnc(-c2ccc(Cl)cc2)n1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000501261155 910421946 /nfs/dbraw/zinc/42/19/46/910421946.db2.gz GSEDWLCVVBOSSL-FQEVSTJZSA-N 0 3 406.917 4.144 20 0 HIADHN COc1ccc(CN2CCC(C(=O)Nc3ccc(F)cc3)CC2)cc1OC(F)F ZINC000513139543 921579198 /nfs/dbraw/zinc/57/91/98/921579198.db2.gz SUCNATJKAHIIIK-UHFFFAOYSA-N 0 3 408.420 4.286 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)CCOc2ccc(Cl)cc2Cl)CC1 ZINC000501403256 910533987 /nfs/dbraw/zinc/53/39/87/910533987.db2.gz WUTCVKKYRBHLNP-UHFFFAOYSA-N 0 3 411.329 4.478 20 0 HIADHN COc1cccc(CN(Cc2ccc(OC)c(OC)c2OC)C2CCC(O)CC2)c1 ZINC000513152425 921587651 /nfs/dbraw/zinc/58/76/51/921587651.db2.gz DXIKPVLAIYPVLB-UHFFFAOYSA-N 0 3 415.530 4.027 20 0 HIADHN C[C@H](C(=O)Nc1cccc(CN2CCC(O)CC2)c1)c1ccc(Br)cc1 ZINC000501495342 910606918 /nfs/dbraw/zinc/60/69/18/910606918.db2.gz GMPZPSLYXDGYMW-HNNXBMFYSA-N 0 3 417.347 4.148 20 0 HIADHN CC1CCN([C@@H](CNC(=O)NC[C@@H](c2ccsc2)N(C)C)c2cccs2)CC1 ZINC000501520895 910631402 /nfs/dbraw/zinc/63/14/02/910631402.db2.gz XPSNYYUGRQNFKW-OALUTQOASA-N 0 3 420.648 4.185 20 0 HIADHN CN(C)C[C@H](NC(=O)N[C@H]1CCO[C@H]1c1ccc(Cl)c(F)c1)c1ccc(F)cc1 ZINC000501570365 910675725 /nfs/dbraw/zinc/67/57/25/910675725.db2.gz VANIFLDZORRQRW-UFYCRDLUSA-N 0 3 423.891 4.050 20 0 HIADHN O=C(N1CC=C(c2ccccc2)C1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000501615954 910717244 /nfs/dbraw/zinc/71/72/44/910717244.db2.gz WKZCLFWHLZYDAO-QFIPXVFZSA-N 0 3 400.444 4.367 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)Cc2ccc(OCc3ccccn3)cc2)C1 ZINC000501677704 910751933 /nfs/dbraw/zinc/75/19/33/910751933.db2.gz GYYUJYGFNGXGRR-OFNKIYASSA-N 0 3 415.537 4.155 20 0 HIADHN CNC(=O)CC[C@@H]1CCCCN1CC(=O)N1CCC[C@H]1c1ccc(C(C)(C)C)cc1 ZINC000513177704 921602694 /nfs/dbraw/zinc/60/26/94/921602694.db2.gz IMGKIGLHQMMKGG-VXKWHMMOSA-N 0 3 413.606 4.028 20 0 HIADHN O=C(Nc1c[nH]nc1[C@@H]1CCCN(Cc2c[nH]nc2-c2cccs2)C1)C1CCCC1 ZINC000501692714 910763461 /nfs/dbraw/zinc/76/34/61/910763461.db2.gz CWQXLQNDWVLKER-MRXNPFEDSA-N 0 3 424.574 4.370 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)C[C@@H](c1cccs1)n1cccc1 ZINC000501740010 910801116 /nfs/dbraw/zinc/80/11/16/910801116.db2.gz DASPLZLVUSKBBJ-FQEVSTJZSA-N 0 3 417.525 4.398 20 0 HIADHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)CC1(C(F)(F)F)CC1 ZINC000501750806 910811135 /nfs/dbraw/zinc/81/11/35/910811135.db2.gz XSKZIGYJEQNJJP-UHFFFAOYSA-N 0 3 407.274 4.072 20 0 HIADHN CN(Cc1ccccc1OC(F)(F)F)C(=O)NCCCN1CCc2ccccc2C1 ZINC000501775928 910831210 /nfs/dbraw/zinc/83/12/10/910831210.db2.gz LRQPRLWKCQCTQI-UHFFFAOYSA-N 0 3 421.463 4.175 20 0 HIADHN O=C(Nc1cc2c(cc1Cl)OCCCO2)N[C@H](CN1CCCC1)c1ccccc1 ZINC000501818169 910865358 /nfs/dbraw/zinc/86/53/58/910865358.db2.gz ZLCKKLAHCGCJNW-LJQANCHMSA-N 0 3 415.921 4.460 20 0 HIADHN O=C(Nc1cc2c(cc1Cl)OCCCO2)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000501818168 910865729 /nfs/dbraw/zinc/86/57/29/910865729.db2.gz ZLCKKLAHCGCJNW-IBGZPJMESA-N 0 3 415.921 4.460 20 0 HIADHN COC(=O)c1cc2cc(NC(=O)N[C@H](CN3CCCC3)c3ccccc3)ccc2o1 ZINC000501836567 910878175 /nfs/dbraw/zinc/87/81/75/910878175.db2.gz KUVRZJBDIUZXSF-LJQANCHMSA-N 0 3 407.470 4.178 20 0 HIADHN CCOc1cc2c(cc1CNC(=O)N[C@@H](CN1CCCC1)c1ccccc1)O[C@H](C)C2 ZINC000501852110 910884544 /nfs/dbraw/zinc/88/45/44/910884544.db2.gz UCEIDLJJFMTFTJ-GCJKJVERSA-N 0 3 423.557 4.045 20 0 HIADHN Cc1noc(C)c1COc1cccc(C(=O)N2CCN(CC3CCCCC3)CC2)c1 ZINC000501867565 910894713 /nfs/dbraw/zinc/89/47/13/910894713.db2.gz OPTZGCYMXMEZDY-UHFFFAOYSA-N 0 3 411.546 4.209 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3occc3-c3ccc(F)cc3)CC2)C[C@H](C)O1 ZINC000501873532 910897701 /nfs/dbraw/zinc/89/77/01/910897701.db2.gz OIHPASIWUJHZKP-HDICACEKSA-N 0 3 414.521 4.437 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)N[C@H]1CCCc2cn(C3CCCC3)nc21 ZINC000501945039 910931458 /nfs/dbraw/zinc/93/14/58/910931458.db2.gz OIQKUVAMBIWNOI-NRFANRHFSA-N 0 3 401.599 4.283 20 0 HIADHN C[C@@H]1[C@H](NC(=O)N[C@H]2CCO[C@@H](c3ccc(F)cc3)C2)CCN1Cc1ccccc1 ZINC000501949091 910936416 /nfs/dbraw/zinc/93/64/16/910936416.db2.gz NHZMAGHNNDVAGZ-FJTGNWTPSA-N 0 3 411.521 4.008 20 0 HIADHN CCN(C(=O)c1cc2c(c(Cl)c1)OCO2)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000501953071 910939628 /nfs/dbraw/zinc/93/96/28/910939628.db2.gz BNRQIBMRQJHYGF-YJBOKZPZSA-N 0 3 400.906 4.366 20 0 HIADHN COc1cccc([C@H](C)C(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)c1 ZINC000502019744 910980902 /nfs/dbraw/zinc/98/09/02/910980902.db2.gz RXYJROIIUBMXBS-INIZCTEOSA-N 0 3 408.464 4.408 20 0 HIADHN C[C@@H](C[NH2+][C@@H](c1nc(-c2nc[n-]n2)no1)C(C)(C)C)c1ccc(C(F)(F)F)cc1 ZINC000502020896 910981188 /nfs/dbraw/zinc/98/11/88/910981188.db2.gz FNYQYQAVIKUFQQ-FZMZJTMJSA-N 0 3 408.428 4.354 20 0 HIADHN C[C@@H](CN[C@@H](c1nc(-c2nc[nH]n2)no1)C(C)(C)C)c1ccc(C(F)(F)F)cc1 ZINC000502020896 910981200 /nfs/dbraw/zinc/98/12/00/910981200.db2.gz FNYQYQAVIKUFQQ-FZMZJTMJSA-N 0 3 408.428 4.354 20 0 HIADHN Cc1ccc(NC(=O)CN[C@]2(Cc3ccc(C(F)(F)F)cc3)CCOC2)c(C)c1 ZINC000513210437 921626160 /nfs/dbraw/zinc/62/61/60/921626160.db2.gz PRJUMZNUZVKGDE-NRFANRHFSA-N 0 3 406.448 4.252 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)N[C@H](C)[C@H](OC)c2ccccc2Cl)cc1 ZINC000502105917 911041646 /nfs/dbraw/zinc/04/16/46/911041646.db2.gz PBXXRYGLIZZNCN-NQERJWCQSA-N 0 3 419.953 4.027 20 0 HIADHN c1cc(Sc2ccccn2)oc1CNC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000513235317 921648632 /nfs/dbraw/zinc/64/86/32/921648632.db2.gz AQGQOYXDMJNKJA-OAQYLSRUSA-N 0 3 409.555 4.207 20 0 HIADHN CC(C)N(CCC(=O)Nc1cc(Cl)ccc1Cl)CC(=O)N1CCCCCC1 ZINC000513235320 921648835 /nfs/dbraw/zinc/64/88/35/921648835.db2.gz ASWRZMIGQVPHFB-UHFFFAOYSA-N 0 3 414.377 4.435 20 0 HIADHN COc1ccc(-c2nc(C(=O)N(CCCc3ccccc3)CCN(C)C)cs2)cc1 ZINC000502352616 911331705 /nfs/dbraw/zinc/33/17/05/911331705.db2.gz LATWUQIEKDBSAF-UHFFFAOYSA-N 0 3 423.582 4.455 20 0 HIADHN O=C(Nc1c[nH]nc1[C@H]1CCCN(CCCOc2ccccc2)C1)c1ccccc1 ZINC000502357222 911341467 /nfs/dbraw/zinc/34/14/67/911341467.db2.gz FPRHOJGARINRMS-FQEVSTJZSA-N 0 3 404.514 4.311 20 0 HIADHN C[C@@H](SCC(=O)NC[C@H]1CCCN1Cc1ccccc1)c1nc2ccccc2[nH]1 ZINC000513243397 921653888 /nfs/dbraw/zinc/65/38/88/921653888.db2.gz GUBOCXCCEOPDMO-IEBWSBKVSA-N 0 3 408.571 4.138 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCC[C@H]1C[C@@H](C)O)c1ccc(C(F)(F)F)cc1 ZINC000502468937 911460486 /nfs/dbraw/zinc/46/04/86/911460486.db2.gz AISGNKHSORPQOD-AYOQOUSVSA-N 0 3 415.500 4.033 20 0 HIADHN O=C(CN[C@@H]1CCCC[C@H]1OC(F)F)N1N=C(c2ccco2)C[C@@H]1c1cccs1 ZINC000502483080 911478457 /nfs/dbraw/zinc/47/84/57/911478457.db2.gz TWEXTRIPIIGAES-FRFSOERESA-N 0 3 423.485 4.159 20 0 HIADHN COc1ccc(NC(C)=O)cc1NC(=O)[C@H](C)N[C@@H](c1ccc(F)cc1)C(C)C ZINC000502489174 911485788 /nfs/dbraw/zinc/48/57/88/911485788.db2.gz ZLJQITCCHYYZLL-LHSJRXKWSA-N 0 3 401.482 4.107 20 0 HIADHN COc1ccc(NC(C)=O)cc1NC(=O)[C@@H](C)N[C@@H](c1ccc(F)cc1)C(C)C ZINC000502489176 911488377 /nfs/dbraw/zinc/48/83/77/911488377.db2.gz ZLJQITCCHYYZLL-SPLOXXLWSA-N 0 3 401.482 4.107 20 0 HIADHN COc1ccc(OC)c(NC(=O)C[C@H](C)N[C@H](C)c2ccccc2OC(F)F)c1 ZINC000502499163 911501466 /nfs/dbraw/zinc/50/14/66/911501466.db2.gz FOXZKFZAZAESEB-UONOGXRCSA-N 0 3 408.445 4.373 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Cc1ccc2c(c1)OCO2)c1ccc(C(F)(F)F)cc1 ZINC000502538892 911544474 /nfs/dbraw/zinc/54/44/74/911544474.db2.gz DVQLZEHDDFYCNH-GOSISDBHSA-N 0 3 422.447 4.176 20 0 HIADHN CCOc1ccccc1OCCCC(=O)NCC(C)(C)N1CCc2ccccc2C1 ZINC000502566981 911574620 /nfs/dbraw/zinc/57/46/20/911574620.db2.gz VZFILKJFMWGNON-UHFFFAOYSA-N 0 3 410.558 4.197 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)c1cnc(-c2ccc(F)c(F)c2)s1 ZINC000502577455 911583367 /nfs/dbraw/zinc/58/33/67/911583367.db2.gz SDROGNVWOCDTFL-UHFFFAOYSA-N 0 3 401.482 4.292 20 0 HIADHN C[C@@H](NC(=O)NC[C@@H](c1ccccc1)N1CCCC1)c1ccc(NC(=O)C2CC2)cc1 ZINC000502650431 911690918 /nfs/dbraw/zinc/69/09/18/911690918.db2.gz OLLLMOWPYUAIGD-JPYJTQIMSA-N 0 3 420.557 4.232 20 0 HIADHN O=C(NC1CCN(Cc2ccccc2)CC1)c1csc(-c2ccc(F)c(F)c2)n1 ZINC000502650212 911691221 /nfs/dbraw/zinc/69/12/21/911691221.db2.gz KXXOIHSWMBRZKA-UHFFFAOYSA-N 0 3 413.493 4.483 20 0 HIADHN O=C(Nc1ccc(C(=O)NC[C@@H]2CCCN2Cc2ccccc2)cc1)c1cccs1 ZINC000513296082 921693163 /nfs/dbraw/zinc/69/31/63/921693163.db2.gz ZZFUGBFLNJERIK-NRFANRHFSA-N 0 3 419.550 4.395 20 0 HIADHN Cc1noc(C)c1COc1cccc(C(=O)NC[C@@H]2CCCN2Cc2ccccc2)c1 ZINC000513302208 921698965 /nfs/dbraw/zinc/69/89/65/921698965.db2.gz SOGBNKVZIPCTJC-QFIPXVFZSA-N 0 3 419.525 4.265 20 0 HIADHN Cc1cc(C(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)c2cnn(C(C)C)c2n1 ZINC000502890853 911886755 /nfs/dbraw/zinc/88/67/55/911886755.db2.gz QHVVRHXDGYIYAW-UHFFFAOYSA-N 0 3 420.561 4.103 20 0 HIADHN CCCN(CC(=O)Nc1ccnn1C1CCCC1)[C@H](C)CC(=O)Nc1ccccc1 ZINC000502920309 911906288 /nfs/dbraw/zinc/90/62/88/911906288.db2.gz RWSJITKROPJISC-GOSISDBHSA-N 0 3 411.550 4.066 20 0 HIADHN CC(C)C1CCC(N2CCN(CC(=O)Nc3ccccc3C(F)(F)F)CC2)CC1 ZINC000513308260 921701865 /nfs/dbraw/zinc/70/18/65/921701865.db2.gz GVYDJNUKXXNGOK-UHFFFAOYSA-N 0 3 411.512 4.476 20 0 HIADHN COc1cccc([C@H](CNC(=O)NC(C)(C)c2ccccc2OC)N2CCCC2)c1 ZINC000502933142 911919599 /nfs/dbraw/zinc/91/95/99/911919599.db2.gz CBHVMKLYTXXOAM-NRFANRHFSA-N 0 3 411.546 4.075 20 0 HIADHN Cc1ccc(OCCCCNC(=O)NC[C@@H](c2cccs2)N2CCCC2)cc1 ZINC000502967673 911949604 /nfs/dbraw/zinc/94/96/04/911949604.db2.gz FFJNOKGJJBEFSE-FQEVSTJZSA-N 0 3 401.576 4.352 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)N[C@H](c1ccccc1)c1ccncc1 ZINC000503040473 912009109 /nfs/dbraw/zinc/00/91/09/912009109.db2.gz AZXCTAUNSKJLBK-BJKOFHAPSA-N 0 3 400.526 4.307 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)N[C@@H](c1ccccc1)c1ccncc1 ZINC000503040475 912009842 /nfs/dbraw/zinc/00/98/42/912009842.db2.gz AZXCTAUNSKJLBK-RPWUZVMVSA-N 0 3 400.526 4.307 20 0 HIADHN Cc1cc(NC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)ccc1NC(=O)c1ccco1 ZINC000503054342 912018415 /nfs/dbraw/zinc/01/84/15/912018415.db2.gz RZHCFHGPJSCDJE-HXUWFJFHSA-N 0 3 418.497 4.236 20 0 HIADHN Cc1nccn1CCCN(C)[C@H](C)C(=O)Nc1ccc(Cl)cc1C(F)(F)F ZINC000503065599 912030858 /nfs/dbraw/zinc/03/08/58/912030858.db2.gz WYCSBZSCMLZNLV-GFCCVEGCSA-N 0 3 402.848 4.213 20 0 HIADHN CCC[C@@H]1C[C@@H](C(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)CCO1 ZINC000503068472 912033616 /nfs/dbraw/zinc/03/36/16/912033616.db2.gz KESBTQBZKPWSLR-PKOBYXMFSA-N 0 3 400.485 4.191 20 0 HIADHN Cc1nccn1CCCN(C)[C@H](C)C(=O)Nc1cccc(CSc2ccccn2)c1 ZINC000503077323 912047857 /nfs/dbraw/zinc/04/78/57/912047857.db2.gz SJIDADFZLSQNAV-GOSISDBHSA-N 0 3 423.586 4.228 20 0 HIADHN C[C@H]1CCN(Cc2ccnc(-c3ccc(Br)cc3)n2)C[C@@H]1n1ccnc1 ZINC000503076589 912048387 /nfs/dbraw/zinc/04/83/87/912048387.db2.gz YPGGPGDTNYBXPM-KXBFYZLASA-N 0 3 412.335 4.186 20 0 HIADHN CCN(C(=O)CSc1nccn1C(C)(C)C)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000503158724 912124642 /nfs/dbraw/zinc/12/46/42/912124642.db2.gz VFIMFDZNYIFJGE-ICSRJNTNSA-N 0 3 414.619 4.414 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)Nc2ccccc2C(=O)N2CCCCC2)C1 ZINC000506293574 914889230 /nfs/dbraw/zinc/88/92/30/914889230.db2.gz GZMUNRKSDWKQCX-PZJWPPBQSA-N 0 3 420.557 4.270 20 0 HIADHN COc1cc(NC(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)c(OC)cc1Cl ZINC000506294999 914890984 /nfs/dbraw/zinc/89/09/84/914890984.db2.gz MUGKVWAKKNODIW-ZBFHGGJFSA-N 0 3 403.910 4.314 20 0 HIADHN CCC1(CC)CN(C(=O)NCc2ccccc2CN2CCC(O)CC2)c2ccccc21 ZINC000506304843 914896899 /nfs/dbraw/zinc/89/68/99/914896899.db2.gz IXGAYIIASCOTNA-UHFFFAOYSA-N 0 3 421.585 4.431 20 0 HIADHN COCCOc1ccc(CN2CCCN(Cc3ccc(Cl)cc3)CC2)cc1OC ZINC000506308047 914898360 /nfs/dbraw/zinc/89/83/60/914898360.db2.gz IUZZKWZDOJPUSR-UHFFFAOYSA-N 0 3 418.965 4.082 20 0 HIADHN CCCNC(=O)C1CCN(Cc2cn(-c3ccccc3)nc2-c2ccc(F)cc2)CC1 ZINC000506323643 914927058 /nfs/dbraw/zinc/92/70/58/914927058.db2.gz BFJZSUKMPHQOBD-UHFFFAOYSA-N 0 3 420.532 4.417 20 0 HIADHN COc1cccc2c1[C@H](C(=O)Nc1cc(C)cc(N3CCN(C(C)C)CC3)c1)CC2 ZINC000506339427 914955887 /nfs/dbraw/zinc/95/58/87/914955887.db2.gz JMYUEQAHZCYBIC-JOCHJYFZSA-N 0 3 407.558 4.203 20 0 HIADHN CC[C@@H](C)[C@@H](C)C(=O)NC1CCN(CCOc2ccc(Br)cc2)CC1 ZINC000506470643 915069363 /nfs/dbraw/zinc/06/93/63/915069363.db2.gz MTVHTUJIFCCROX-HZPDHXFCSA-N 0 3 411.384 4.091 20 0 HIADHN CCN(CCc1nccs1)C(=O)NC[C@H](c1ccc(CC(C)C)cc1)N(C)C ZINC000513377898 921751540 /nfs/dbraw/zinc/75/15/40/921751540.db2.gz MYJCNWAWGMMFFP-HXUWFJFHSA-N 0 3 402.608 4.219 20 0 HIADHN CCCN(C(=O)NC[C@@H](C)c1c(C)noc1C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000506644907 915314005 /nfs/dbraw/zinc/31/40/05/915314005.db2.gz FLTRVBSGIVKGMX-XMSQKQJNSA-N 0 3 412.578 4.481 20 0 HIADHN CC[C@H](N[C@H]1CCCN(Cc2ccc(F)cc2F)C1=O)c1ccc(OC)c(OC)c1 ZINC000506661029 915335538 /nfs/dbraw/zinc/33/55/38/915335538.db2.gz FDYUQEYFHIJIIV-PMACEKPBSA-N 0 3 418.484 4.214 20 0 HIADHN COc1ccc([C@@H](NC(=O)N(CCN(C)C)CC(C)C)c2ccccc2OC)cc1 ZINC000506695250 915371802 /nfs/dbraw/zinc/37/18/02/915371802.db2.gz LYUUQVXJESHEQI-HSZRJFAPSA-N 0 3 413.562 4.022 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CN1CCC(C(=O)NCc2ccccc2)CC1 ZINC000506722114 915404530 /nfs/dbraw/zinc/40/45/30/915404530.db2.gz NULQCWGYCVSGRZ-UHFFFAOYSA-N 0 3 416.569 4.077 20 0 HIADHN Cc1nn(Cc2ccc(C)cc2)c(C)c1CN1CCC(c2nnc3ccccn32)CC1 ZINC000506736995 915423661 /nfs/dbraw/zinc/42/36/61/915423661.db2.gz VHDOJCQBTSCZNV-UHFFFAOYSA-N 0 3 414.557 4.279 20 0 HIADHN Cc1nc2sc(-c3ccccc3)cc2c(NCCCN2CCC[C@@H]2C(=O)N(C)C)n1 ZINC000506752430 915447129 /nfs/dbraw/zinc/44/71/29/915447129.db2.gz FVTMMZWXWUGCTC-LJQANCHMSA-N 0 3 423.586 4.021 20 0 HIADHN Cc1nc2c3ccccc3nn2c(C)c1CCC(=O)Nc1cccc(CN(C)C)c1 ZINC000506781149 915504912 /nfs/dbraw/zinc/50/49/12/915504912.db2.gz NUCJHJKCKOCNKN-UHFFFAOYSA-N 0 3 401.514 4.132 20 0 HIADHN CCN(Cc1ccc(OCc2ccncc2)c(OC)c1)C[C@H]1COc2ccccc2O1 ZINC000506806125 915553933 /nfs/dbraw/zinc/55/39/33/915553933.db2.gz PDFMACYAXSGBJV-NRFANRHFSA-N 0 3 420.509 4.331 20 0 HIADHN CC(C)Cn1ncc(C(=O)NC[C@H](C(C)C)N2CCc3ccccc3C2)c1C1CC1 ZINC000506835000 915611035 /nfs/dbraw/zinc/61/10/35/915611035.db2.gz OFKYYWSTSGACAL-HSZRJFAPSA-N 0 3 408.590 4.229 20 0 HIADHN COC(=O)c1c(C2CC2)csc1NC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000506851387 915633753 /nfs/dbraw/zinc/63/37/53/915633753.db2.gz OIPFUMCNXDLVQA-KRWDZBQOSA-N 0 3 413.543 4.150 20 0 HIADHN COc1ccc([C@H](C)NC(=O)N[C@@H]2CCN(Cc3ccccc3)[C@H]2C)c(C)c1OC ZINC000513418665 921787084 /nfs/dbraw/zinc/78/70/84/921787084.db2.gz CAGOAASCOSWMEX-BBTUJRGHSA-N 0 3 411.546 4.035 20 0 HIADHN CC(C)OCCCNC(=O)C1CCN(Cc2cccc(OC3CCCC3)c2)CC1 ZINC000506882954 915676378 /nfs/dbraw/zinc/67/63/78/915676378.db2.gz ZQXUJDJGSLBVQB-UHFFFAOYSA-N 0 3 402.579 4.151 20 0 HIADHN CC(=O)Nc1cccc(CNC2(c3ccc(Br)cc3)CCOCC2)c1 ZINC000506914013 915713801 /nfs/dbraw/zinc/71/38/01/915713801.db2.gz AMNOBQPOQGUTDK-UHFFFAOYSA-N 0 3 403.320 4.203 20 0 HIADHN O=C(Nc1cc(Cl)ccc1[O-])C1CC[NH+](Cc2ccc(-n3ccnc3)cc2)CC1 ZINC000506934238 915737469 /nfs/dbraw/zinc/73/74/69/915737469.db2.gz VQCUVNWAARNULX-UHFFFAOYSA-N 0 3 410.905 4.082 20 0 HIADHN Cc1ccc(CN(CC(=O)Nc2cccc(CN3CCSCC3)c2)C(C)C)s1 ZINC000506957241 915764160 /nfs/dbraw/zinc/76/41/60/915764160.db2.gz NZJUOSYFSPBZDY-UHFFFAOYSA-N 0 3 417.644 4.454 20 0 HIADHN Cc1cc(NC(=O)CN[C@H](c2ccc(F)cc2)C(C)(C)C)n(-c2nc(C)cc(C)n2)n1 ZINC000507027649 915830033 /nfs/dbraw/zinc/83/00/33/915830033.db2.gz WPWBBBWGIVHQFV-OAQYLSRUSA-N 0 3 424.524 4.042 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)N1CCC(N2CCc3ccccc32)CC1 ZINC000507074409 915854914 /nfs/dbraw/zinc/85/49/14/915854914.db2.gz ZWRRYLXJTMYSBK-VWLOTQADSA-N 0 3 418.585 4.060 20 0 HIADHN O=C(NC[C@@H]1CCCN(Cc2cccs2)C1)c1csc(-c2ncccc2F)n1 ZINC000507109336 915872851 /nfs/dbraw/zinc/87/28/51/915872851.db2.gz CNKXFVIHTWKTCE-AWEZNQCLSA-N 0 3 416.547 4.048 20 0 HIADHN Cc1ccc(CNC(=O)C2CCN(Cc3c[nH]nc3-c3ccccc3)CC2)cc1F ZINC000507133889 915882705 /nfs/dbraw/zinc/88/27/05/915882705.db2.gz HANJABCDONCSTK-UHFFFAOYSA-N 0 3 406.505 4.053 20 0 HIADHN COc1nc(C(=O)N2CCCN(CCCc3ccccc3)CC2)cc2ccccc21 ZINC000507136353 915884120 /nfs/dbraw/zinc/88/41/20/915884120.db2.gz QGWMIBQCANXORT-UHFFFAOYSA-N 0 3 403.526 4.024 20 0 HIADHN CCOCCCNC(=O)C1CCN(Cc2ccc(F)c(-c3cccs3)c2)CC1 ZINC000507146554 915889678 /nfs/dbraw/zinc/88/96/78/915889678.db2.gz VSJBHGUHEOUPDI-UHFFFAOYSA-N 0 3 404.551 4.309 20 0 HIADHN CCOc1cc(CN(Cc2cccc(F)c2)C(C)C)ccc1O[C@@H](C)C(=O)N(C)C ZINC000507172201 915915192 /nfs/dbraw/zinc/91/51/92/915915192.db2.gz ZOWGJCMPLWCINU-SFHVURJKSA-N 0 3 416.537 4.491 20 0 HIADHN Cc1ccccc1[C@H]1CCN(CC(=O)N2CCC[C@@H]2c2ccc3c(c2)OCCCO3)C1 ZINC000507184824 915932304 /nfs/dbraw/zinc/93/23/04/915932304.db2.gz XCORRBQPAVOSKA-JTHBVZDNSA-N 0 3 420.553 4.309 20 0 HIADHN C[C@H](N[C@@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O)c1ccc2n[nH]cc2c1 ZINC000507225617 915978501 /nfs/dbraw/zinc/97/85/01/915978501.db2.gz AKRIITCMXNGUJD-VBKZILBWSA-N 0 3 416.447 4.424 20 0 HIADHN C[C@H](N[C@@H]1CSC[C@@H]1C)C(=O)N1N=C(c2ccc(Cl)cc2)C[C@@H]1c1ccco1 ZINC000507252137 916013706 /nfs/dbraw/zinc/01/37/06/916013706.db2.gz LSTZKLDXJBAQPS-YXUGBTPSSA-N 0 3 417.962 4.340 20 0 HIADHN C[C@H](CNC(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1)Oc1ccccc1 ZINC000507340001 916095226 /nfs/dbraw/zinc/09/52/26/916095226.db2.gz SRHFZWXFNANDNS-QGZVFWFLSA-N 0 3 423.479 4.246 20 0 HIADHN CCOC(=O)CC1CCN(Cc2c(C)nn(Cc3ccc(Cl)cc3)c2C)CC1 ZINC000507369766 916126488 /nfs/dbraw/zinc/12/64/88/916126488.db2.gz GCPPUYOLCKXCMK-UHFFFAOYSA-N 0 3 403.954 4.367 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)Nc1ccc(N2CCCCCC2)cc1C ZINC000507393210 916153198 /nfs/dbraw/zinc/15/31/98/916153198.db2.gz LKVVYFYVDBGKLF-UHFFFAOYSA-N 0 3 422.573 4.323 20 0 HIADHN CC(=O)Nc1ccc(CCN[C@@H](C(=O)Nc2ccc(F)cc2)c2ccccc2)cc1 ZINC000507500175 916264073 /nfs/dbraw/zinc/26/40/73/916264073.db2.gz HGJGMHWGFLHHRH-HSZRJFAPSA-N 0 3 405.473 4.296 20 0 HIADHN CC(=O)Nc1ccc(CCN[C@H](C(=O)Nc2ccc(C)cc2)c2ccccc2)cc1 ZINC000507501221 916267083 /nfs/dbraw/zinc/26/70/83/916267083.db2.gz MNQPWKMLOSTOEK-DEOSSOPVSA-N 0 3 401.510 4.466 20 0 HIADHN CCCN(CC(=O)Nc1ccc(C)cc1C)C1CCN(C(=O)c2ccccc2)CC1 ZINC000507597410 916351223 /nfs/dbraw/zinc/35/12/23/916351223.db2.gz MRXUULYCJDEGLB-UHFFFAOYSA-N 0 3 407.558 4.259 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)COc2ccc(Cl)c3cccnc23)C1 ZINC000507599137 916352237 /nfs/dbraw/zinc/35/22/37/916352237.db2.gz WLLDKLICXADIEG-SJLPKXTDSA-N 0 3 409.917 4.219 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(C)c1CC(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000507603015 916358931 /nfs/dbraw/zinc/35/89/31/916358931.db2.gz QUEWCEGWARHZHG-PGRDOPGGSA-N 0 3 420.532 4.122 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3cccc4ncccc43)c(OCC)c2)CC1 ZINC000507610019 916368986 /nfs/dbraw/zinc/36/89/86/916368986.db2.gz HAFADCRXDZLSIP-UHFFFAOYSA-N 0 3 418.541 4.418 20 0 HIADHN CCCc1c(C(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)cnn1Cc1ccccc1 ZINC000507615230 916374056 /nfs/dbraw/zinc/37/40/56/916374056.db2.gz YAZUIOVFHTVKDS-NFBKMPQASA-N 0 3 416.569 4.449 20 0 HIADHN COc1cccc(OC)c1OC1CCN(Cc2ccccc2-c2ccnn2C)CC1 ZINC000507616571 916376217 /nfs/dbraw/zinc/37/62/17/916376217.db2.gz LKHAEOXPXDNMOJ-UHFFFAOYSA-N 0 3 407.514 4.148 20 0 HIADHN Cc1noc([C@@H]2CCCN(C[C@@H](O)CO[C@@H](c3ccccc3)c3ccccc3C)C2)n1 ZINC000507688166 916458833 /nfs/dbraw/zinc/45/88/33/916458833.db2.gz OXZUTCLQTXWTNJ-AKFKNWHVSA-N 0 3 421.541 4.033 20 0 HIADHN CC(C)c1nc(C2CCN(CCC(=O)Nc3ccc(Br)cc3)CC2)no1 ZINC000507773825 916558630 /nfs/dbraw/zinc/55/86/30/916558630.db2.gz TUJOUFIBSBQBCV-UHFFFAOYSA-N 0 3 421.339 4.164 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)N[C@H](C)c2ccccc2SC)c1 ZINC000507798504 916580686 /nfs/dbraw/zinc/58/06/86/916580686.db2.gz YMRGEIJCWGPDSG-QGZVFWFLSA-N 0 3 401.576 4.252 20 0 HIADHN CCN(CC)[C@H](CN[C@@H](c1nccn1C)c1cccc(F)c1)c1cccc(OC)c1 ZINC000507808885 916597954 /nfs/dbraw/zinc/59/79/54/916597954.db2.gz XAHJYONSVQOTPD-DHIUTWEWSA-N 0 3 410.537 4.330 20 0 HIADHN CCOC(=O)C1CCN(C(=O)[C@H](C)N[C@@H](C)c2ccc(Oc3ccccc3)cc2)CC1 ZINC000507892551 916744508 /nfs/dbraw/zinc/74/45/08/916744508.db2.gz HCBYZZKXXBIMDT-OALUTQOASA-N 0 3 424.541 4.320 20 0 HIADHN Cc1ccc(NC(=O)[C@@H]2CCCN(Cc3ccc(OCc4ccccn4)cc3)C2)nc1 ZINC000507997118 916838576 /nfs/dbraw/zinc/83/85/76/916838576.db2.gz FRVKYKUTVYFPMM-OAQYLSRUSA-N 0 3 416.525 4.215 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(C)c1CN1CCC[C@@H](C(=O)Nc2ccc(C)cn2)C1 ZINC000508011227 916849002 /nfs/dbraw/zinc/84/90/02/916849002.db2.gz BOYJHRLGCNYCRT-LJQANCHMSA-N 0 3 421.520 4.182 20 0 HIADHN Cc1cc(OCC(=O)Nc2cccc(CN3CCC(CO)CC3)c2)ccc1C(C)C ZINC000508058202 916883237 /nfs/dbraw/zinc/88/32/37/916883237.db2.gz MPUVWGPHVXWTPJ-UHFFFAOYSA-N 0 3 410.558 4.340 20 0 HIADHN CSc1ccccc1[C@@H](C)NC(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000508062640 916885766 /nfs/dbraw/zinc/88/57/66/916885766.db2.gz HCSKAZZEVIUJFC-CEXWTWQISA-N 0 3 419.635 4.390 20 0 HIADHN CCCN(C(=O)N[C@H]1CCCC12CCOCC2)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000508065936 916888651 /nfs/dbraw/zinc/88/86/51/916888651.db2.gz XWQFXTDXGHVFPI-PKTZIBPZSA-N 0 3 413.606 4.422 20 0 HIADHN O=C(COc1ccc(Cl)c(Cl)c1)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000508072947 916894971 /nfs/dbraw/zinc/89/49/71/916894971.db2.gz UXSFRWMLIZENRV-UHFFFAOYSA-N 0 3 423.340 4.215 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@@H](C)[C@H]1CCCOC1)c1ccc(C(F)(F)F)cc1 ZINC000508159156 916980024 /nfs/dbraw/zinc/98/00/24/916980024.db2.gz FAVVWQYERJUKTH-VDZJLULYSA-N 0 3 415.500 4.203 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)N1CCN(c2nc3ccccc3s2)CC1 ZINC000508248008 917066437 /nfs/dbraw/zinc/06/64/37/917066437.db2.gz NISZCFIOETYNFM-UHFFFAOYSA-N 0 3 420.538 4.067 20 0 HIADHN CC(=O)c1ccc(SCC(=O)NCCN2CCC3(CCCCC3)CC2)cc1F ZINC000508287954 917100795 /nfs/dbraw/zinc/10/07/95/917100795.db2.gz LSEZJZQLDKOGGY-UHFFFAOYSA-N 0 3 406.567 4.283 20 0 HIADHN Cc1cc(C(=O)Nc2ccc(OC3CCN(C)CC3)nc2)c(C)cc1Br ZINC000508311764 917119146 /nfs/dbraw/zinc/11/91/46/917119146.db2.gz MJZNBSSLOGCHIJ-UHFFFAOYSA-N 0 3 418.335 4.186 20 0 HIADHN CN1CCN(CCNC(=O)c2cc(Cl)ccc2SC2CCCC2)CC1(C)C ZINC000508318854 917124906 /nfs/dbraw/zinc/12/49/06/917124906.db2.gz NMXYLVMDWBNARD-UHFFFAOYSA-N 0 3 410.027 4.131 20 0 HIADHN COc1ccccc1NC(=O)C[C@H](C)NCc1cc(Cl)c2c(c1)OCCCO2 ZINC000508326383 917129874 /nfs/dbraw/zinc/12/98/74/917129874.db2.gz OCDYPEHBEGIGJY-AWEZNQCLSA-N 0 3 404.894 4.017 20 0 HIADHN Cc1cc(NC(=O)c2cccc(F)c2)sc1C(=O)N[C@@H](C)CN1CCC[C@@H](C)C1 ZINC000508336984 917141114 /nfs/dbraw/zinc/14/11/14/917141114.db2.gz BNOREOJFFYDTPZ-ZBFHGGJFSA-N 0 3 417.550 4.298 20 0 HIADHN COCCSc1ccc([C@H](C)NC(=O)NC[C@@H](c2ccccc2)N(C)C)cc1 ZINC000508547083 917325282 /nfs/dbraw/zinc/32/52/82/917325282.db2.gz AFROPYRXGNBXLT-UWJYYQICSA-N 0 3 401.576 4.088 20 0 HIADHN COc1cc(CNC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)ccc1C ZINC000508588110 917360048 /nfs/dbraw/zinc/36/00/48/917360048.db2.gz MLVZQEZVXKPUPT-OAQYLSRUSA-N 0 3 406.448 4.074 20 0 HIADHN O=C(N[C@@H]1CCOc2c(F)cccc21)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000508604275 917373795 /nfs/dbraw/zinc/37/37/95/917373795.db2.gz OEXDSQNCFDTJSR-NQIIRXRSSA-N 0 3 422.422 4.220 20 0 HIADHN CCN1CCN(CCCNC(=O)C(CC)(CC)c2ccc(Cl)c(Cl)c2)CC1 ZINC000508619271 917386006 /nfs/dbraw/zinc/38/60/06/917386006.db2.gz MPLWUSKUWWQROD-UHFFFAOYSA-N 0 3 414.421 4.195 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)NCCCc1c[nH]c2ccc(F)cc12 ZINC000508627228 917392826 /nfs/dbraw/zinc/39/28/26/917392826.db2.gz DIRPOQFQOCOMFK-UHFFFAOYSA-N 0 3 414.500 4.152 20 0 HIADHN COc1ccc(OC)c(-c2nn(-c3ccccc3)cc2CN2CCCSCC2)c1 ZINC000508628217 917393294 /nfs/dbraw/zinc/39/32/94/917393294.db2.gz FTEOSCSAKKHMAE-UHFFFAOYSA-N 0 3 409.555 4.495 20 0 HIADHN CC[C@H](C)NC(=O)[C@@H]1C[C@H](C)N(Cc2nnc(-c3ccccc3)o2)[C@@H]2CCCC[C@@H]12 ZINC000508655853 917421103 /nfs/dbraw/zinc/42/11/03/917421103.db2.gz OVABGAWCCIQPIL-SQEGATDGSA-N 0 3 410.562 4.421 20 0 HIADHN Brc1ccc2c(c1)[C@H](NCc1ccccc1Cn1cncn1)CCS2 ZINC000508735126 917495189 /nfs/dbraw/zinc/49/51/89/917495189.db2.gz UQBKIYHNILFLHE-GOSISDBHSA-N 0 3 415.360 4.416 20 0 HIADHN C[C@@H](NC(=O)N1CCC(OC2CCC(C)CC2)CC1)[C@@H](c1ccccc1)N(C)C ZINC000508850583 917602832 /nfs/dbraw/zinc/60/28/32/917602832.db2.gz FRCSQSBBEDCFLS-BJSHUGAESA-N 0 3 401.595 4.447 20 0 HIADHN C[C@@H](NC(=O)N(C)Cc1ccc(OCC(F)(F)F)cc1)[C@@H](c1ccccc1)N(C)C ZINC000508861846 917615138 /nfs/dbraw/zinc/61/51/38/917615138.db2.gz IKWIXIMAVFGXJZ-UZLBHIALSA-N 0 3 423.479 4.461 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)c(C(F)(F)F)c1 ZINC000508876584 917630505 /nfs/dbraw/zinc/63/05/05/917630505.db2.gz DGKIUDKVSIMZOM-ORAYPTAESA-N 0 3 422.451 4.477 20 0 HIADHN C[C@H](NC(=O)Nc1ccc(Cl)c(C(=O)NC2CC2)c1)[C@@H](c1ccccc1)N(C)C ZINC000508878176 917632549 /nfs/dbraw/zinc/63/25/49/917632549.db2.gz GRRXMTZXTFBZML-XOBRGWDASA-N 0 3 414.937 4.045 20 0 HIADHN C[C@H](NC(=O)N1CCOC[C@H]1c1nc2ccccc2s1)[C@H](c1ccccc1)N(C)C ZINC000508898052 917652745 /nfs/dbraw/zinc/65/27/45/917652745.db2.gz ORENMOVVNDYGRX-NBHGPNQESA-N 0 3 424.570 4.071 20 0 HIADHN C[C@H](NC(=O)N(C)[C@@H]1CCO[C@H](c2ccc(F)cc2)C1)[C@@H](c1ccccc1)N(C)C ZINC000508901215 917656794 /nfs/dbraw/zinc/65/67/94/917656794.db2.gz BCXRYLWSAVWELP-DWJNZPNVSA-N 0 3 413.537 4.379 20 0 HIADHN C[C@H](NC(=O)N1CCO[C@H](c2ccccc2Cl)C1)[C@@H](c1ccccc1)N(C)C ZINC000508907750 917663497 /nfs/dbraw/zinc/66/34/97/917663497.db2.gz QWXBSPNDDBMGFX-NDXORKPFSA-N 0 3 401.938 4.114 20 0 HIADHN CCCN(C)[C@H](CNC(=O)N1CCCC[C@H]1c1ncc[nH]1)c1ccc(Cl)cc1 ZINC000509033312 917789041 /nfs/dbraw/zinc/78/90/41/917789041.db2.gz RAIPXOVTIYJLDZ-RBUKOAKNSA-N 0 3 403.958 4.383 20 0 HIADHN COc1ccc(C(=O)CCN2CCC[C@H](c3nc(-c4cccc(F)c4)no3)C2)cc1 ZINC000509349738 918015053 /nfs/dbraw/zinc/01/50/53/918015053.db2.gz ZUZZWUXNOXJUJM-SFHVURJKSA-N 0 3 409.461 4.337 20 0 HIADHN CCOc1ccc(CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)cc1OCC ZINC000509357412 918023704 /nfs/dbraw/zinc/02/37/04/918023704.db2.gz LAJMMVPQPJRTIN-UHFFFAOYSA-N 0 3 417.937 4.383 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)N1CCO[C@@H](c2ccccc2Cl)C1 ZINC000509365741 918030229 /nfs/dbraw/zinc/03/02/29/918030229.db2.gz LIDFKHBDZYVMSW-RBUKOAKNSA-N 0 3 419.978 4.322 20 0 HIADHN O=C(Nc1ccc(Cl)cn1)[C@@H]1CCCN(Cc2c[nH]nc2-c2cccs2)C1 ZINC000509371078 918035534 /nfs/dbraw/zinc/03/55/34/918035534.db2.gz JDGFPHCLAOMHTI-CYBMUJFWSA-N 0 3 401.923 4.037 20 0 HIADHN Cc1ccccc1[C@H](OC[C@@H](O)CN(C)Cc1ccc2c(c1)OCO2)c1ccccc1 ZINC000509372408 918037086 /nfs/dbraw/zinc/03/70/86/918037086.db2.gz MSABDJBWLVNITJ-BKMJKUGQSA-N 0 3 419.521 4.323 20 0 HIADHN CC(C)[C@H](NCc1cnn([C@@]2(C)CCS(=O)(=O)C2)c1)c1ccc(C(C)(C)C)cc1 ZINC000509404273 918068663 /nfs/dbraw/zinc/06/86/63/918068663.db2.gz PUAHBCDVGSDSDA-GMAHTHKFSA-N 0 3 417.619 4.201 20 0 HIADHN COc1cc(OC)cc(Oc2ccc(CN3CCC(c4nncn4C)CC3)cc2)c1 ZINC000509408522 918072198 /nfs/dbraw/zinc/07/21/98/918072198.db2.gz RHBGODABKHWGGE-UHFFFAOYSA-N 0 3 408.502 4.004 20 0 HIADHN COc1ccc(C2(NCc3ccc(-c4cnn(C)c4)s3)CCOCC2)cc1F ZINC000509437523 918092931 /nfs/dbraw/zinc/09/29/31/918092931.db2.gz HZCZLJZUSAROKN-UHFFFAOYSA-N 0 3 401.507 4.092 20 0 HIADHN Cn1cc(-c2ccc(CN[C@@H](Cc3ccccc3)C(=O)Nc3ccccc3)s2)cn1 ZINC000509464773 918114474 /nfs/dbraw/zinc/11/44/74/918114474.db2.gz PERAPAPPVLCJCM-QFIPXVFZSA-N 0 3 416.550 4.488 20 0 HIADHN Cn1cc(-c2ccc(CNCc3ccc(NC(=O)c4cccnc4)cc3)s2)cn1 ZINC000509469830 918117794 /nfs/dbraw/zinc/11/77/94/918117794.db2.gz JSLMWZDHZISLSA-UHFFFAOYSA-N 0 3 403.511 4.086 20 0 HIADHN O=C([C@@H]1CN(Cc2ccccc2)CCC1(F)F)N1CCC(OC2CCCCC2)CC1 ZINC000509489868 918135240 /nfs/dbraw/zinc/13/52/40/918135240.db2.gz SOEJLWWEOJIMNN-QFIPXVFZSA-N 0 3 420.544 4.484 20 0 HIADHN Cc1nn(Cc2ccc(C)cc2)c(C)c1CN1CCC(C(=O)N2CCC[C@H](C)C2)CC1 ZINC000509554504 918205769 /nfs/dbraw/zinc/20/57/69/918205769.db2.gz HDAPZFDRLPMWTR-FQEVSTJZSA-N 0 3 422.617 4.327 20 0 HIADHN CCOCc1cc(CN2CCC(C(=O)Nc3ccccc3OC)CC2)ccc1OC ZINC000509555784 918205811 /nfs/dbraw/zinc/20/58/11/918205811.db2.gz JZLVCABUPRNHNS-UHFFFAOYSA-N 0 3 412.530 4.091 20 0 HIADHN COC(=O)C1CCN(CCCNc2ncnc3sc(-c4ccccc4)cc32)CC1 ZINC000509556910 918207536 /nfs/dbraw/zinc/20/75/36/918207536.db2.gz MOMXEWMFZYQAKA-UHFFFAOYSA-N 0 3 410.543 4.045 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)N(C)Cc1ccc(Br)s1)c1ccco1 ZINC000509559571 918208666 /nfs/dbraw/zinc/20/86/66/918208666.db2.gz SZLQSFSNFLKLIH-TZMCWYRMSA-N 0 3 414.369 4.374 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N1CCC[C@@H]1c1cccc2c1OCCO2)c1ccco1 ZINC000509565666 918215320 /nfs/dbraw/zinc/21/53/20/918215320.db2.gz AVHJHTFISPDGAE-QXAKKESOSA-N 0 3 413.518 4.027 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N1CCO[C@@H](c2ccc(F)c(Cl)c2)C1)c1ccco1 ZINC000509566728 918215829 /nfs/dbraw/zinc/21/58/29/918215829.db2.gz GSXOXFLOTDWUHR-BOUXLOLZSA-N 0 3 423.916 4.284 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N[C@@H]1c2ccccc2CC[C@@H]1n1ccnc1)c1ccco1 ZINC000509569498 918218967 /nfs/dbraw/zinc/21/89/67/918218967.db2.gz NEHFWKYBBSQKIO-XKPYVIEYSA-N 0 3 421.545 4.133 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N(C)[C@@H](COC)c1ccc(Cl)cc1)c1ccco1 ZINC000509571023 918221526 /nfs/dbraw/zinc/22/15/26/918221526.db2.gz RNKMQYFZMLGGSM-IPELMVKDSA-N 0 3 407.942 4.391 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N(C)Cc1csc(Br)c1)c1ccco1 ZINC000509595657 918244630 /nfs/dbraw/zinc/24/46/30/918244630.db2.gz INHXPZQTBDXTJX-GXTWGEPZSA-N 0 3 414.369 4.374 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)N(C)Cc1cccc(Br)c1)c1ccco1 ZINC000509596592 918245875 /nfs/dbraw/zinc/24/58/75/918245875.db2.gz RZHYNYVHRCLURB-RHSMWYFYSA-N 0 3 408.340 4.313 20 0 HIADHN COc1cc(CNCc2ccc(Cn3cccn3)cc2)ccc1OCC(F)(F)F ZINC000509600609 918249717 /nfs/dbraw/zinc/24/97/17/918249717.db2.gz JPQWSIGJYZFFQY-UHFFFAOYSA-N 0 3 405.420 4.171 20 0 HIADHN CCN1CCC[C@@H](CN(C)c2nc(C)nc3sc(C)c(C)c32)[C@@H]1c1cnn(C)c1 ZINC000509599258 918250263 /nfs/dbraw/zinc/25/02/63/918250263.db2.gz IHFSAHNPNGVGTI-FXAWDEMLSA-N 0 3 412.607 4.259 20 0 HIADHN CC[C@H](NC(=O)N[C@@H]1CCN(Cc2ccccc2)[C@@H]1C)c1ccc(OC)c(OC)c1 ZINC000509612372 918258587 /nfs/dbraw/zinc/25/85/87/918258587.db2.gz XVNTXBWDHJWPEI-JRGCBEDISA-N 0 3 411.546 4.117 20 0 HIADHN CC[C@H](NC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(OC)c(OC)c1 ZINC000509613392 918260779 /nfs/dbraw/zinc/26/07/79/918260779.db2.gz LJWAYJXOKKQFBJ-RTWAWAEBSA-N 0 3 411.546 4.071 20 0 HIADHN CC[C@@H](NC(=O)N1CCCN(Cc2ccccc2)CC1)c1ccc(OC)c(OC)c1 ZINC000509615339 918264901 /nfs/dbraw/zinc/26/49/01/918264901.db2.gz UNAHJEPXXDBLEE-OAQYLSRUSA-N 0 3 411.546 4.072 20 0 HIADHN CCCOc1ccccc1NC(=O)NCCCCN1CCN(c2ccccc2)CC1 ZINC000509617152 918265908 /nfs/dbraw/zinc/26/59/08/918265908.db2.gz IWBASJRXTZGHTH-UHFFFAOYSA-N 0 3 410.562 4.199 20 0 HIADHN CCC(C)(C)c1ccc(C(=O)Nc2ccccc2CN2CCC[C@H](C(N)=O)C2)cc1 ZINC000509707384 918336373 /nfs/dbraw/zinc/33/63/73/918336373.db2.gz GXNUONDVDVUGTF-FQEVSTJZSA-N 0 3 407.558 4.324 20 0 HIADHN CC[C@H](CNC(=O)N[C@@H](C[C@H]1CCOC1)c1ccccc1)N1CCc2ccccc2C1 ZINC000509752892 918370357 /nfs/dbraw/zinc/37/03/57/918370357.db2.gz WDEPZRYHJPJRJH-ZPZUNKDASA-N 0 3 421.585 4.290 20 0 HIADHN COc1cc2c(cc1OC)[C@@H](c1ccccc1)N(C(=O)[C@@H](C)N1CCCCCC1)CC2 ZINC000509812511 918415089 /nfs/dbraw/zinc/41/50/89/918415089.db2.gz YLWSFDSFJOCMAS-KBMIEXCESA-N 0 3 422.569 4.442 20 0 HIADHN CC[NH+](CC)[C@H](CNC(=O)Nc1ccc(-c2cc(=O)[n-]c(C)n2)cc1)c1ccccc1 ZINC000509881997 918484215 /nfs/dbraw/zinc/48/42/15/918484215.db2.gz PMGAKZUHDBWEJE-JOCHJYFZSA-N 0 3 419.529 4.362 20 0 HIADHN CCc1ccc([C@H](CNC(=O)Nc2ccc(-c3cc(=O)[nH]c(C)n3)cc2)N(C)C)cc1 ZINC000509882278 918484493 /nfs/dbraw/zinc/48/44/93/918484493.db2.gz QEHITRRIXUYCBT-QFIPXVFZSA-N 0 3 419.529 4.144 20 0 HIADHN O=C(NCc1cc2ccccc2[nH]1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000509916921 918516499 /nfs/dbraw/zinc/51/64/99/918516499.db2.gz MHOQPVSYCKRONT-NRFANRHFSA-N 0 3 401.432 4.239 20 0 HIADHN Cc1nn(Cc2ccc(C)cc2)c(C)c1CN[C@H]1CCN(C(=O)Nc2ccccc2)C1 ZINC000509948670 918543957 /nfs/dbraw/zinc/54/39/57/918543957.db2.gz KIDIWYKJPBBKRX-QHCPKHFHSA-N 0 3 417.557 4.253 20 0 HIADHN O=C(Nc1cnc(-c2ccccc2)nc1)N1CCCN(CCCc2ccccc2)CC1 ZINC000510041157 918612227 /nfs/dbraw/zinc/61/22/27/918612227.db2.gz OLCJBBNWZGMAHX-UHFFFAOYSA-N 0 3 415.541 4.316 20 0 HIADHN O=C(Nc1ccc(C(=O)NC2CCCC2)cc1)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000510214201 918761417 /nfs/dbraw/zinc/76/14/17/918761417.db2.gz SQLUTMNCJXJUKA-QHCPKHFHSA-N 0 3 420.557 4.318 20 0 HIADHN CCOc1ccc(C(=O)N2CCC(NCc3cscc3Br)CC2)cc1 ZINC000510262162 918793864 /nfs/dbraw/zinc/79/38/64/918793864.db2.gz ZAFNLAWGUZGJEN-UHFFFAOYSA-N 0 3 423.376 4.304 20 0 HIADHN CC[C@H](N[C@@H](C)C(=O)Nc1ccc(-c2c[nH]cn2)cc1)c1ccc(OC)c(OC)c1 ZINC000510272013 918798690 /nfs/dbraw/zinc/79/86/90/918798690.db2.gz WSWJIPNZLPDVSS-KXBFYZLASA-N 0 3 408.502 4.162 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)Nc1cccc(NC(=O)c2ccncc2)c1 ZINC000510308676 918821239 /nfs/dbraw/zinc/82/12/39/918821239.db2.gz QTVINSYQWOBPNC-UHFFFAOYSA-N 0 3 414.465 4.394 20 0 HIADHN COc1ccc([C@@H](Cc2ccc(F)cc2)NCc2ccc3c(c2)oc(=O)n3C)cc1 ZINC000510333851 918837646 /nfs/dbraw/zinc/83/76/46/918837646.db2.gz AEPAAXWIKXQYII-OAQYLSRUSA-N 0 3 406.457 4.353 20 0 HIADHN C[C@@H](c1ncc(-c2ccc(Cl)cc2Cl)o1)N1CCN(C[C@H]2CCOC2)CC1 ZINC000510374504 918860421 /nfs/dbraw/zinc/86/04/21/918860421.db2.gz GUZLPBQJDJCKAQ-LSDHHAIUSA-N 0 3 410.345 4.364 20 0 HIADHN Cn1ccnc1[C@H](NC(=O)N1CCN(Cc2ccccc2)C2(CCCCC2)C1)C1CC1 ZINC000510379146 918862397 /nfs/dbraw/zinc/86/23/97/918862397.db2.gz LYLGYDQXVFNUFI-JOCHJYFZSA-N 0 3 421.589 4.102 20 0 HIADHN O=C(N[C@H](CC(F)(F)F)c1ccc(F)cc1)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000510385813 918865836 /nfs/dbraw/zinc/86/58/36/918865836.db2.gz DJXNAPOGEPYMJF-RBUKOAKNSA-N 0 3 409.427 4.393 20 0 HIADHN COc1ccc(CN2CCC(C(=O)N3CCC(C)CC3)CC2)cc1OCC(C)C ZINC000510410937 918879996 /nfs/dbraw/zinc/87/99/96/918879996.db2.gz ILTCTUNTFHSHFK-UHFFFAOYSA-N 0 3 402.579 4.201 20 0 HIADHN O=C(Nc1cccc(COCc2ccco2)c1)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000510416853 918885103 /nfs/dbraw/zinc/88/51/03/918885103.db2.gz ZQUYDPWXJYQISZ-JOCHJYFZSA-N 0 3 405.498 4.392 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N3CCC(Oc4cc(C)ccc4C)CC3)cc2)CC1 ZINC000510433824 918893775 /nfs/dbraw/zinc/89/37/75/918893775.db2.gz IOVVKHGCAYXADH-UHFFFAOYSA-N 0 3 421.585 4.129 20 0 HIADHN CC(C)(C)NC(=O)c1cccc(NC(=O)NCC(C)(C)N2CCc3ccccc3C2)c1 ZINC000510457345 918912486 /nfs/dbraw/zinc/91/24/86/918912486.db2.gz DJUVLHZLIWIVOS-UHFFFAOYSA-N 0 3 422.573 4.173 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)NCc1cc(F)cc(Br)c1 ZINC000510478075 918930571 /nfs/dbraw/zinc/93/05/71/918930571.db2.gz YSYGIFVGVZEAHJ-UHFFFAOYSA-N 0 3 405.267 4.326 20 0 HIADHN Cc1ccccc1C1(CNC(=O)c2oc3ccccc3c2CN(C)C)CCOCC1 ZINC000510484454 918936365 /nfs/dbraw/zinc/93/63/65/918936365.db2.gz YBKAMGCDIYGQKB-UHFFFAOYSA-N 0 3 406.526 4.281 20 0 HIADHN COc1cc(F)ccc1NC(=O)N(CCN(C)C)Cc1ccc(Br)cc1 ZINC000510486530 918937842 /nfs/dbraw/zinc/93/78/42/918937842.db2.gz ATXDECWGLWUPSB-UHFFFAOYSA-N 0 3 424.314 4.193 20 0 HIADHN CCN1CCN([C@H]2CCN([C@H](C)c3ncc(-c4ccc(Cl)cc4Cl)o3)C2)CC1 ZINC000510496911 918944728 /nfs/dbraw/zinc/94/47/28/918944728.db2.gz RVYHRSLAQGEWDZ-WBVHZDCISA-N 0 3 423.388 4.421 20 0 HIADHN CN(C(=O)c1cccc(Oc2ccc(Cl)c(Cl)c2)n1)[C@H]1CCN(C2CC2)C1 ZINC000510531213 918977514 /nfs/dbraw/zinc/97/75/14/918977514.db2.gz BMGYEGIDKWYTDQ-AWEZNQCLSA-N 0 3 406.313 4.489 20 0 HIADHN O=C(Nc1ccc(C(=O)NC2CCCCC2)cc1)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000510534831 918980810 /nfs/dbraw/zinc/98/08/10/918980810.db2.gz RZSKUYZVZWTWQP-QHCPKHFHSA-N 0 3 420.557 4.145 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)Nc1ccc(OC[C@H]2CCCO2)cc1 ZINC000510566978 919008799 /nfs/dbraw/zinc/00/87/99/919008799.db2.gz XOERDDZPUOJJJP-DHIUTWEWSA-N 0 3 409.530 4.203 20 0 HIADHN CCOC(=O)c1cnn(C2CCN(CCOc3ccc4ccccc4c3)CC2)c1C ZINC000510612919 919054186 /nfs/dbraw/zinc/05/41/86/919054186.db2.gz FHZLWJNZYQQOIW-UHFFFAOYSA-N 0 3 407.514 4.237 20 0 HIADHN Fc1ccc(N2CCOCC2)c(CN[C@H]2CCc3ccc(Br)cc32)c1 ZINC000510683303 919120694 /nfs/dbraw/zinc/12/06/94/919120694.db2.gz NMEIZZUFJFYIIS-IBGZPJMESA-N 0 3 405.311 4.202 20 0 HIADHN Cc1nc(C)c([C@@H](C)N(C)C(=O)[C@H]2CN(Cc3ccccc3)CCC2(F)F)s1 ZINC000510705537 919144541 /nfs/dbraw/zinc/14/45/41/919144541.db2.gz WBKCBAHHIBSBRU-CRAIPNDOSA-N 0 3 407.530 4.437 20 0 HIADHN COCCNC(=O)c1c[nH]nc1[C@H]1CCCN(Cc2ccc(C3CCCCC3)cc2)C1 ZINC000510756158 919207089 /nfs/dbraw/zinc/20/70/89/919207089.db2.gz WNMKZXGKUURXSX-QFIPXVFZSA-N 0 3 424.589 4.213 20 0 HIADHN CC[C@H](CC1CCCC1)C(=O)N1CCC[C@@H](CN2CCN(c3ccccn3)CC2)C1 ZINC000510785185 919249846 /nfs/dbraw/zinc/24/98/46/919249846.db2.gz ZDUHJEXLUYFXGU-XZOQPEGZSA-N 0 3 412.622 4.049 20 0 HIADHN Cc1cc(C)n(-c2ccc(NC(=O)N3CCCN(Cc4ccccc4)CC3)cc2F)n1 ZINC000510826602 919306252 /nfs/dbraw/zinc/30/62/52/919306252.db2.gz SFASLXINVUDJCP-UHFFFAOYSA-N 0 3 421.520 4.368 20 0 HIADHN C[C@H](c1ccc(NC(=O)c2oc3ccccc3c2CN(C)C)cc1)N1CCOCC1 ZINC000510852926 919341735 /nfs/dbraw/zinc/34/17/35/919341735.db2.gz PCFYHLMGTQBTGF-QGZVFWFLSA-N 0 3 407.514 4.140 20 0 HIADHN Cc1ccc(OCc2cccc(C(=O)N3C[C@H](N(C)C)Cc4ccccc43)c2)cn1 ZINC000510876867 919371669 /nfs/dbraw/zinc/37/16/69/919371669.db2.gz DJTPAQXTFGIIIR-JOCHJYFZSA-N 0 3 401.510 4.102 20 0 HIADHN COc1ccc(C[C@H](C)C(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)cc1OC ZINC000510883603 919379615 /nfs/dbraw/zinc/37/96/15/919379615.db2.gz YQMNBAZERWBVDW-VQTJNVASSA-N 0 3 410.558 4.005 20 0 HIADHN O=C(NCc1ccsc1Br)N[C@H](CN1CCCC1)c1ccccc1 ZINC000510894296 919391755 /nfs/dbraw/zinc/39/17/55/919391755.db2.gz OJZRIYVFYPLVMR-MRXNPFEDSA-N 0 3 408.365 4.147 20 0 HIADHN Cc1c([C@@H](C)N[C@H]2CCN(C(=O)Nc3ccccc3)C2)cnn1-c1ccc(F)cc1 ZINC000510946221 919475935 /nfs/dbraw/zinc/47/59/35/919475935.db2.gz VFYYGXGWIFFGAY-UZLBHIALSA-N 0 3 407.493 4.277 20 0 HIADHN CC[C@H](N[C@@H]1CCc2cc(F)c(OC)cc21)c1ccccc1OCC(=O)N(C)C ZINC000510976814 919524200 /nfs/dbraw/zinc/52/42/00/919524200.db2.gz HGRGXHAUDBKZIO-VQTJNVASSA-N 0 3 400.494 4.030 20 0 HIADHN O=C(Nc1ccccc1)N1CC[C@@H](N[C@H]2CCCc3nn(-c4ccccc4)cc32)C1 ZINC000510987534 919542274 /nfs/dbraw/zinc/54/22/74/919542274.db2.gz SGMVHJJAZCXDGE-KNQAVFIVSA-N 0 3 401.514 4.146 20 0 HIADHN CCOc1cccc2cc([C@@H](C)N[C@H]3CCN(C(=O)COc4ccccc4)C3)oc21 ZINC000511013420 919579427 /nfs/dbraw/zinc/57/94/27/919579427.db2.gz JEMANEXWGVJMQQ-MJGOQNOKSA-N 0 3 408.498 4.162 20 0 HIADHN COc1ccc(C[C@@H](C)C(=O)N(CCN(C)C)Cc2cccc(Cl)c2)cc1OC ZINC000511018170 919584265 /nfs/dbraw/zinc/58/42/65/919584265.db2.gz SHDSDNOQCNKZJI-QGZVFWFLSA-N 0 3 418.965 4.126 20 0 HIADHN CCOC(=O)c1oc2c(c1C)[C@H](N[C@@H]1CCN(C(=O)Nc3ccccc3)C1)CCC2 ZINC000511028158 919601747 /nfs/dbraw/zinc/60/17/47/919601747.db2.gz FSQCPTJZJZMMPZ-QZTJIDSGSA-N 0 3 411.502 4.038 20 0 HIADHN COCCCNC(=O)C1CCN(Cc2ccc(Oc3cc(F)cc(F)c3)cc2)CC1 ZINC000511126818 919739597 /nfs/dbraw/zinc/73/95/97/919739597.db2.gz QSWQXCRQUKSYKD-UHFFFAOYSA-N 0 3 418.484 4.122 20 0 HIADHN C[C@@H](NC(=O)N(Cc1ccc2c(c1)OCO2)C1CCC(C)CC1)C1=CCN(C)CC1 ZINC000511285232 919880094 /nfs/dbraw/zinc/88/00/94/919880094.db2.gz JJIAXVIKUAABGT-IDYZSHNDSA-N 0 3 413.562 4.156 20 0 HIADHN Cc1ccc([C@H](CN[C@H](c2ccc(Cl)cc2)[C@@H]2CN(C)CCO2)N2CCCC2)o1 ZINC000511367139 919959050 /nfs/dbraw/zinc/95/90/50/919959050.db2.gz MSITVWDCVXBQGM-ACIOBRDBSA-N 0 3 417.981 4.040 20 0 HIADHN CCc1cccc2c3c([nH]c21)[C@](CC)(CC(=O)N[C@H](C)C1=CCN(C)CC1)OCC3 ZINC000511368902 919961052 /nfs/dbraw/zinc/96/10/52/919961052.db2.gz IWHJAROQLIKRFP-NSYGIPOTSA-N 0 3 409.574 4.065 20 0 HIADHN CN(C(=O)N[C@H](C[C@@H]1CCOC1)c1ccccc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000511369235 919961790 /nfs/dbraw/zinc/96/17/90/919961790.db2.gz ADGQQKSYFGIEKM-ICDZXHCJSA-N 0 3 421.585 4.460 20 0 HIADHN CN(Cc1ccccc1)Cc1cccc(C(=O)NCc2ccccc2Cn2ccnc2)c1 ZINC000511407375 920021188 /nfs/dbraw/zinc/02/11/88/920021188.db2.gz PTKVCRUHBNEUOY-UHFFFAOYSA-N 0 3 424.548 4.493 20 0 HIADHN CCCN(CC)c1ccc(C(=O)Nc2ccc(N3CCN(CC)CC3)cc2C)cn1 ZINC000511406545 920021351 /nfs/dbraw/zinc/02/13/51/920021351.db2.gz XCQVJLISTBSRBC-UHFFFAOYSA-N 0 3 409.578 4.021 20 0 HIADHN Cc1n[nH]c(C)c1[C@@H]1CCCCCN1C(=O)N[C@@H]1C[C@H](C)N(Cc2ccccc2)C1 ZINC000511415547 920029372 /nfs/dbraw/zinc/02/93/72/920029372.db2.gz BGMRUCGMZIABAN-WTOYTKOKSA-N 0 3 409.578 4.316 20 0 HIADHN COC[C@H](NC1CCC(NC(=O)COc2ccc(Cl)cc2)CC1)c1ccc(C)o1 ZINC000511507667 920125582 /nfs/dbraw/zinc/12/55/82/920125582.db2.gz QQYNGFQEMAVQHT-QLOJAFMTSA-N 0 3 420.937 4.025 20 0 HIADHN Cc1ncsc1CN(C)C[C@H]1CCN(C(=O)N[C@@H]2CCC[C@H]2c2ccccc2)C1 ZINC000511519685 920138372 /nfs/dbraw/zinc/13/83/72/920138372.db2.gz AISYNMFNQRELJG-HLAWJBBLSA-N 0 3 412.603 4.251 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)Cc1ccc(Br)s1 ZINC000511532263 920153688 /nfs/dbraw/zinc/15/36/88/920153688.db2.gz LVBFVFATNGWRAV-UHFFFAOYSA-N 0 3 409.393 4.076 20 0 HIADHN CC[C@H](O)[C@@H]1CCCCN1CC(=O)NC[C@H](c1c[nH]c2ccccc21)c1ccccc1 ZINC000511573986 920219086 /nfs/dbraw/zinc/21/90/86/920219086.db2.gz RMURPDOBDQDGHT-TUSQITKMSA-N 0 3 419.569 4.041 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)CN[C@H](c2cccc(OC(F)(F)F)c2)C2CC2)cc1 ZINC000511589060 920233495 /nfs/dbraw/zinc/23/34/95/920233495.db2.gz UZYAVHABDNILBB-FQEVSTJZSA-N 0 3 421.419 4.223 20 0 HIADHN O=C1[C@@H](N[C@H](c2cccc(OC(F)(F)F)c2)C2CC2)CCCN1CC(F)(F)F ZINC000511622758 920280118 /nfs/dbraw/zinc/28/01/18/920280118.db2.gz LIAYXUOKLHRADW-GJZGRUSLSA-N 0 3 410.358 4.179 20 0 HIADHN C[C@H](N[C@H](c1cccc(OC(F)(F)F)c1)C1CC1)C(=O)NCCc1cccs1 ZINC000511623848 920282856 /nfs/dbraw/zinc/28/28/56/920282856.db2.gz OJDRGGZDRBUBAB-UGSOOPFHSA-N 0 3 412.477 4.435 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)N1CCC(N2CCc3cc(F)ccc32)CC1 ZINC000511646772 920314806 /nfs/dbraw/zinc/31/48/06/920314806.db2.gz WUKRSSARYNIZBM-UHFFFAOYSA-N 0 3 421.516 4.301 20 0 HIADHN CN(C)C(=O)c1ccc(CN(C)CCCCCc2cc(-c3cccc(F)c3)n[nH]2)[nH]1 ZINC000511665293 920332499 /nfs/dbraw/zinc/33/24/99/920332499.db2.gz RFOKFYDSRDRZFS-UHFFFAOYSA-N 0 3 411.525 4.091 20 0 HIADHN CN(C(=O)c1ccc2c(c1)oc1ccccc12)C1CCN(CCn2cccn2)CC1 ZINC000511745220 920422419 /nfs/dbraw/zinc/42/24/19/920422419.db2.gz ZAYUYTQHLVJNQG-UHFFFAOYSA-N 0 3 402.498 4.019 20 0 HIADHN C[C@]1(n2cc(CN(CC3CCCCC3)CC3CCCCC3)cn2)CCS(=O)(=O)C1 ZINC000511765616 920449680 /nfs/dbraw/zinc/44/96/80/920449680.db2.gz UBUSKAIXJPZXBM-QHCPKHFHSA-N 0 3 421.651 4.379 20 0 HIADHN O=C(NC1CCCCC1)NC1CCN(Cc2cccc(OCc3ccccn3)c2)CC1 ZINC000511782236 920472334 /nfs/dbraw/zinc/47/23/34/920472334.db2.gz YJFQHDZPSRQJMO-UHFFFAOYSA-N 0 3 422.573 4.257 20 0 HIADHN O=C(Nc1ccc2nc([C@@H]3CCCO3)[nH]c2c1)c1ccc(CN2CCSCC2)cc1 ZINC000511782878 920475524 /nfs/dbraw/zinc/47/55/24/920475524.db2.gz ACJSVAFWLWVNSI-NRFANRHFSA-N 0 3 422.554 4.216 20 0 HIADHN CSc1nccn1-c1ccc(C(=O)NC[C@H](c2ccccc2)N2CCCC2)cc1 ZINC000511818559 920515686 /nfs/dbraw/zinc/51/56/86/920515686.db2.gz WTWDVMNIKGNIHC-OAQYLSRUSA-N 0 3 406.555 4.161 20 0 HIADHN O=C(CN1C[C@H](c2ccccc2)[C@@H]2CCC[C@@H]21)NCC1(c2ccccc2)CCOCC1 ZINC000511829571 920531138 /nfs/dbraw/zinc/53/11/38/920531138.db2.gz KKGSPYKAZXKYQW-GVAUOCQISA-N 0 3 418.581 4.119 20 0 HIADHN CCCN(CC)C(=O)c1ccc(C(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)cc1 ZINC000511828906 920532403 /nfs/dbraw/zinc/53/24/03/920532403.db2.gz GYVDQNPIQQAWRP-XXBNENTESA-N 0 3 407.558 4.124 20 0 HIADHN C[C@H](CC(=O)Nc1cc(C(F)(F)F)ccc1Cl)N[C@H](CO)c1ccccc1 ZINC000512007690 920779863 /nfs/dbraw/zinc/77/98/63/920779863.db2.gz OBIYIMUVRZTTHR-SJKOYZFVSA-N 0 3 400.828 4.399 20 0 HIADHN CCCOc1ccc(O[C@@H]2CCCC[C@@H]2NCc2ncc(CN(C)C)s2)cc1 ZINC000512032272 920804522 /nfs/dbraw/zinc/80/45/22/920804522.db2.gz TYWUYWBTEJGBKZ-LEWJYISDSA-N 0 3 403.592 4.473 20 0 HIADHN COc1ccc(CNC[C@H](C)c2nc(-c3ccccc3)no2)c(Br)c1 ZINC000512054112 920823028 /nfs/dbraw/zinc/82/30/28/920823028.db2.gz TYCBHLZDPCMSMN-ZDUSSCGKSA-N 0 3 402.292 4.401 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Cc2cccc(Br)c2)N2CCCC2)cc1 ZINC000512092125 920855361 /nfs/dbraw/zinc/85/53/61/920855361.db2.gz PNIGXTFCWFKCRY-FQEVSTJZSA-N 0 3 401.348 4.253 20 0 HIADHN CO[C@@H]1C[C@@H](c2ccccc2)CC[C@@H]1NC(=O)N(CCN(C)C)Cc1cccs1 ZINC000512098827 920859545 /nfs/dbraw/zinc/85/95/45/920859545.db2.gz SHJQSFAGZWLRAO-ILWGZMRPSA-N 0 3 415.603 4.173 20 0 HIADHN C[C@H](NC(=O)CSc1ncnc2scc(-c3ccccc3)c21)C1=CCN(C)CC1 ZINC000512123889 920874123 /nfs/dbraw/zinc/87/41/23/920874123.db2.gz OLWJNYVIWCHSPM-HNNXBMFYSA-N 0 3 424.595 4.217 20 0 HIADHN Cc1nn(-c2cccc(Cl)c2)c2sc(C(=O)N[C@H](C)C3=CCN(C)CC3)cc12 ZINC000512134631 920881382 /nfs/dbraw/zinc/88/13/82/920881382.db2.gz YAWOYZSSCNSNKH-CYBMUJFWSA-N 0 3 414.962 4.429 20 0 HIADHN C[C@H](NC(=O)c1cnn(-c2cccc(C(F)(F)F)c2)c1C1CC1)C1=CCN(C)CC1 ZINC000512133913 920881573 /nfs/dbraw/zinc/88/15/73/920881573.db2.gz RVGPIMDLHHCVRC-AWEZNQCLSA-N 0 3 418.463 4.149 20 0 HIADHN C[C@H](NC(=O)c1cn(C(C)(C)C)nc1-c1ccccc1Cl)C1=CCN(C)CC1 ZINC000512139328 920885256 /nfs/dbraw/zinc/88/52/56/920885256.db2.gz QMVUZJUVLLBFNZ-HNNXBMFYSA-N 0 3 400.954 4.339 20 0 HIADHN C[C@@H](NC(=O)c1cn(Cc2ccccc2)nc1-c1cccs1)C1=CCN(C)CC1 ZINC000512141533 920886160 /nfs/dbraw/zinc/88/61/60/920886160.db2.gz ATQUZFUVHIDUPY-QGZVFWFLSA-N 0 3 406.555 4.040 20 0 HIADHN COc1cc2c(cc1OC)CN(C(=O)CN1C[C@H](C)CC[C@H]1c1ccccc1)CC2 ZINC000512144068 920887880 /nfs/dbraw/zinc/88/78/80/920887880.db2.gz ALMFUCXIBNJEGQ-GCJKJVERSA-N 0 3 408.542 4.062 20 0 HIADHN C[C@@H]1CSC[C@H]1NCC(=O)Nc1nc(-c2ccc(Cl)cc2Cl)cs1 ZINC000512180218 920921509 /nfs/dbraw/zinc/92/15/09/920921509.db2.gz NIXMSKMLZQWWLG-NOZJJQNGSA-N 0 3 402.372 4.397 20 0 HIADHN C[C@@H](OC[C@H](O)CN(C)CCc1nc(-c2ccccc2)no1)c1ccc(Cl)cc1 ZINC000512181262 920921649 /nfs/dbraw/zinc/92/16/49/920921649.db2.gz OVRVMVKSUHULCH-OXQOHEQNSA-N 0 3 415.921 4.003 20 0 HIADHN O=C(NCCCCN1CCN(Cc2ccccc2)CC1)N1CCC[C@@]2(CC=CCC2)C1 ZINC000512197262 920943297 /nfs/dbraw/zinc/94/32/97/920943297.db2.gz OXYGLVQKEMUWAZ-SANMLTNESA-N 0 3 424.633 4.116 20 0 HIADHN CCN(CC)C(=O)C1CCN(Cc2c(C)nn(-c3ccc(Cl)cc3)c2C)CC1 ZINC000512221402 920971874 /nfs/dbraw/zinc/97/18/74/920971874.db2.gz YBELOKYNRRSLIX-UHFFFAOYSA-N 0 3 402.970 4.223 20 0 HIADHN COc1ccc(NC(=O)[C@@H](NCCC2CCOCC2)c2ccccc2)cc1Cl ZINC000512234927 920990128 /nfs/dbraw/zinc/99/01/28/920990128.db2.gz USLAJMIYZKCNLE-NRFANRHFSA-N 0 3 402.922 4.435 20 0 HIADHN CCCN(CC(=O)Nc1c(C)cccc1CC)C1CCN(c2cc(C)nc(C)n2)CC1 ZINC000512276401 921031676 /nfs/dbraw/zinc/03/16/76/921031676.db2.gz CNDQEIYNEQAOLM-UHFFFAOYSA-N 0 3 423.605 4.284 20 0 HIADHN Cc1ccc(-c2n[nH]cc2CN2CCC(C(=O)N3CCc4ccccc43)CC2)cc1 ZINC000512297882 921053437 /nfs/dbraw/zinc/05/34/37/921053437.db2.gz ASXFKOZJBRXXFH-UHFFFAOYSA-N 0 3 400.526 4.186 20 0 HIADHN CC(C)COc1ccc(CN2CCC(C(=O)NCCc3cccs3)CC2)cc1 ZINC000512350097 921096301 /nfs/dbraw/zinc/09/63/01/921096301.db2.gz HEQNVRASHYRPME-UHFFFAOYSA-N 0 3 400.588 4.354 20 0 HIADHN CCOc1c(Br)cc(CN(CCCO)Cc2ccccc2)cc1OC ZINC000513479900 921836961 /nfs/dbraw/zinc/83/69/61/921836961.db2.gz SXLLANBXMHAGIM-UHFFFAOYSA-N 0 3 408.336 4.241 20 0 HIADHN COC(=O)c1ccc(CNCc2ccc(OCc3csc(C)n3)cc2)cc1OC ZINC000513540556 921879229 /nfs/dbraw/zinc/87/92/29/921879229.db2.gz WSQJPKNBBQJWCY-UHFFFAOYSA-N 0 3 412.511 4.116 20 0 HIADHN COc1ccc(OC)c(NC(=O)C[C@H](C)NCc2ccc(-c3csc(C)n3)o2)c1 ZINC000513581901 921913667 /nfs/dbraw/zinc/91/36/67/921913667.db2.gz DHFHQYZIJXTMRI-ZDUSSCGKSA-N 0 3 415.515 4.236 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)c1ccc(C(F)(F)F)cn1 ZINC000513600186 921932460 /nfs/dbraw/zinc/93/24/60/921932460.db2.gz WUUYYXWRLXXBDI-UHFFFAOYSA-N 0 3 419.369 4.323 20 0 HIADHN CC(=O)Nc1ccc(OC[C@@H](O)CN(Cc2ccc(Cl)c(F)c2)C(C)C)cc1 ZINC000513655750 921977277 /nfs/dbraw/zinc/97/72/77/921977277.db2.gz OECPFPAVFBOIGV-SFHVURJKSA-N 0 3 408.901 4.088 20 0 HIADHN Cc1ccc(-n2cc(CN3CCC[C@H](c4nnc5n4CCC5)C3)c(C(C)(C)C)n2)cc1 ZINC000513660492 921983025 /nfs/dbraw/zinc/98/30/25/921983025.db2.gz ILFQTZHDUCXHSX-IBGZPJMESA-N 0 3 418.589 4.396 20 0 HIADHN CC(=O)Nc1ccc(OC[C@H](O)CN(Cc2ccc([C@@H]3C[C@@H]3C)o2)C(C)C)cc1 ZINC000513703511 922022664 /nfs/dbraw/zinc/02/26/64/922022664.db2.gz WQZGRKYSFXCQPA-DKZVUGQWSA-N 0 3 400.519 4.012 20 0 HIADHN CCN(Cc1ccc(OCc2cccnc2)cc1)Cc1ccc(C(=O)N(C)C)cc1 ZINC000513745949 922066817 /nfs/dbraw/zinc/06/68/17/922066817.db2.gz KPLDIKUORLTNSZ-UHFFFAOYSA-N 0 3 403.526 4.385 20 0 HIADHN COc1ccc(-c2nn(Cc3ccccc3)cc2CN2CCCO[C@H](C)C2)cc1OC ZINC000513762081 922080164 /nfs/dbraw/zinc/08/01/64/922080164.db2.gz PWMTXJSWVMHWFL-LJQANCHMSA-N 0 3 421.541 4.226 20 0 HIADHN C[C@H](N[C@@H]1CCc2c1cccc2Br)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000513861823 922188625 /nfs/dbraw/zinc/18/86/25/922188625.db2.gz NSMUUTHBNLVLPZ-ORAYPTAESA-N 0 3 423.376 4.038 20 0 HIADHN CN1CCC(Oc2ccc(NC(=O)Nc3ncc(-c4ccccc4)s3)cn2)CC1 ZINC000513865575 922194392 /nfs/dbraw/zinc/19/43/92/922194392.db2.gz HMTKPSGHEXFVLJ-UHFFFAOYSA-N 0 3 409.515 4.322 20 0 HIADHN COc1ccc(C(=O)C[C@@H](C)C(=O)N[C@H]2CCN(Cc3ccccc3)CC2(C)C)cc1 ZINC000513921175 922243749 /nfs/dbraw/zinc/24/37/49/922243749.db2.gz YCFRHBIOHVANDE-DVECYGJZSA-N 0 3 422.569 4.321 20 0 HIADHN Cc1cc(NC(=O)C[C@@H](C)c2c(C)noc2C)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000513932737 922253233 /nfs/dbraw/zinc/25/32/33/922253233.db2.gz AJFDSDRYYLUHLF-IERDGZPVSA-N 0 3 421.545 4.376 20 0 HIADHN FC1(F)CCC[C@@H](CN2CCN(CCCc3nc(-c4cccs4)no3)CC2)C1 ZINC000513961429 922280055 /nfs/dbraw/zinc/28/00/55/922280055.db2.gz CWMVZXFYBNPHSD-MRXNPFEDSA-N 0 3 410.534 4.174 20 0 HIADHN CSc1cc2c(cc1NC(=O)N[C@@H](CN1CCCC1)c1ccccc1)OCCO2 ZINC000513976515 922296214 /nfs/dbraw/zinc/29/62/14/922296214.db2.gz XVLCPRICFFOHIA-SFHVURJKSA-N 0 3 413.543 4.138 20 0 HIADHN Cc1noc(C)c1[C@@H](C)CC(=O)NC1CCN(CCOc2ccc(Cl)cc2)CC1 ZINC000514011453 922334866 /nfs/dbraw/zinc/33/48/66/922334866.db2.gz OVLMFTHXCHYUCS-HNNXBMFYSA-N 0 3 419.953 4.098 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)CCC(C)(C)c3ccccc3)CC2)C[C@H](C)O1 ZINC000514012274 922336449 /nfs/dbraw/zinc/33/64/49/922336449.db2.gz ZYGXENKSIQKEDT-OYRHEFFESA-N 0 3 400.607 4.482 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)CCC(C)(C)c3ccccc3)CC2)C[C@H](C)O1 ZINC000514012275 922337077 /nfs/dbraw/zinc/33/70/77/922337077.db2.gz ZYGXENKSIQKEDT-SFTDATJTSA-N 0 3 400.607 4.482 20 0 HIADHN CC[S@](=O)c1ccccc1C(=O)NCC1(CC)CCN(Cc2ccccc2)CC1 ZINC000514042120 922363579 /nfs/dbraw/zinc/36/35/79/922363579.db2.gz AUYOSXVGGBSJCY-LJAQVGFWSA-N 0 3 412.599 4.236 20 0 HIADHN O=C(Nc1ccccc1)[C@H](NC[C@@H]1CCN(C(=O)c2ccccc2)C1)c1ccccc1 ZINC000514076337 922398140 /nfs/dbraw/zinc/39/81/40/922398140.db2.gz WUHTUVMQSFNVKT-GBXCKJPGSA-N 0 3 413.521 4.118 20 0 HIADHN COCCOc1ccc(CN2CCC([C@@H]3C(=O)Nc4cc(Cl)ccc43)CC2)cc1 ZINC000514086025 922410331 /nfs/dbraw/zinc/41/03/31/922410331.db2.gz YJZUNDDZONNFSU-QFIPXVFZSA-N 0 3 414.933 4.313 20 0 HIADHN CC(=O)Nc1ccc(S(=O)(=O)CCCN(C)[C@H](c2ccccc2C)C(C)C)cc1 ZINC000514095476 922419708 /nfs/dbraw/zinc/41/97/08/922419708.db2.gz OWUGTIIQKHFXRK-QHCPKHFHSA-N 0 3 416.587 4.446 20 0 HIADHN CCCN(CC(=O)Nc1ccc(Cl)cc1)C[C@@H]1CCN(C(=O)c2ccccc2)C1 ZINC000514107335 922437241 /nfs/dbraw/zinc/43/72/41/922437241.db2.gz KHUYNWBOQFEKIN-SFHVURJKSA-N 0 3 413.949 4.153 20 0 HIADHN O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N[C@H]1CCCc2cc(OC(F)F)ccc21 ZINC000514159034 922496926 /nfs/dbraw/zinc/49/69/26/922496926.db2.gz ZAPUIERKEDLAIL-NQIIRXRSSA-N 0 3 415.484 4.239 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N[C@H](c2ccccc2)c2ccccn2)C1 ZINC000514168385 922506320 /nfs/dbraw/zinc/50/63/20/922506320.db2.gz XOGFMKCSUVXSBB-ZFJSRUIDSA-N 0 3 400.526 4.306 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)CN2CCC[C@@H]2Cc2ccccc2C)c(OC)c1 ZINC000514171179 922509339 /nfs/dbraw/zinc/50/93/39/922509339.db2.gz YVIDBJHISVXASC-QPPBQGQZSA-N 0 3 422.569 4.383 20 0 HIADHN C[C@H](NC(=O)N(CCN(C)C)Cc1ccco1)c1ccc(Oc2cccnc2)cc1 ZINC000514178362 922516411 /nfs/dbraw/zinc/51/64/11/922516411.db2.gz MBUZIQCNLWFDPN-SFHVURJKSA-N 0 3 408.502 4.301 20 0 HIADHN CC(C)[C@@H]1C[C@H](CC(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)CCO1 ZINC000514188725 922528402 /nfs/dbraw/zinc/52/84/02/922528402.db2.gz HCOHFNXMNDTQDB-QUCCMNQESA-N 0 3 414.512 4.437 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N3CC[C@@H](C(F)(F)F)C4(CCC4)C3)cc2)CC1 ZINC000514191104 922530982 /nfs/dbraw/zinc/53/09/82/922530982.db2.gz VLEYMSMJVILNIU-HXUWFJFHSA-N 0 3 423.523 4.412 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NC[C@H]1CCN(c2ccc(F)cc2)C1)c1ccsc1 ZINC000514221615 922554865 /nfs/dbraw/zinc/55/48/65/922554865.db2.gz ISRDHXCULJECPQ-DYESRHJHSA-N 0 3 418.582 4.096 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCc1ccccc1Br)c1ccsc1 ZINC000514226337 922563341 /nfs/dbraw/zinc/56/33/41/922563341.db2.gz SRXPEQXNXJNGRD-QGZVFWFLSA-N 0 3 410.381 4.393 20 0 HIADHN CC(C)(C)OC(=O)C[C@H]1CCCN(C(=O)NC[C@@H](c2cccs2)N2CCCC2)C1 ZINC000514425132 922621258 /nfs/dbraw/zinc/62/12/58/922621258.db2.gz GRSUCYSBMQHMDR-MSOLQXFVSA-N 0 3 421.607 4.038 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N[C@H](C)c1ccc(OC)c(F)c1)c1cccc(OC)c1 ZINC000514535918 922683217 /nfs/dbraw/zinc/68/32/17/922683217.db2.gz KOVRSPUWBXIGBJ-IERDGZPVSA-N 0 3 417.525 4.286 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)N1CCC(c2nc3ccccc3[nH]2)CC1 ZINC000514564513 922701546 /nfs/dbraw/zinc/70/15/46/922701546.db2.gz HQPQWCMKXYGBDF-FQEVSTJZSA-N 0 3 423.586 4.351 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)c1cccc(-n2ccc(C(F)(F)F)n2)c1)c1ccco1 ZINC000514750655 922781505 /nfs/dbraw/zinc/78/15/05/922781505.db2.gz ZURUBKYQOWRNGI-YOEHRIQHSA-N 0 3 420.435 4.343 20 0 HIADHN CC(C)[C@H]1CN(c2nnc(-c3c[nH]c4ccccc34)n2Cc2cccs2)CCN1C ZINC000514827575 922817349 /nfs/dbraw/zinc/81/73/49/922817349.db2.gz SNLNFOXKHKOXOY-OAQYLSRUSA-N 0 3 420.586 4.313 20 0 HIADHN CCOC(=O)c1ccn(-c2cccc(CNCc3cccc(OC(F)(F)F)c3)c2)n1 ZINC000514891505 922835431 /nfs/dbraw/zinc/83/54/31/922835431.db2.gz TWWNLBABIAAQHY-UHFFFAOYSA-N 0 3 419.403 4.237 20 0 HIADHN C[C@H](CCN1CCN(C)CC1)NC(=O)Nc1ccc(Oc2ccc(Cl)cc2)cc1 ZINC000514973850 922861229 /nfs/dbraw/zinc/86/12/29/922861229.db2.gz FIPMLZYSICNEJQ-QGZVFWFLSA-N 0 3 416.953 4.280 20 0 HIADHN O=S(=O)(c1ccc(C(F)(F)F)c(F)c1)N1C[C@H]2CCCN2Cc2ccccc21 ZINC000514991210 922870187 /nfs/dbraw/zinc/87/01/87/922870187.db2.gz HLQBPCCTSHBMPS-CQSZACIVSA-N 0 3 414.424 4.018 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(-c4ccc(F)c5ccccc45)n3)cn2)CC1 ZINC000515016499 922878599 /nfs/dbraw/zinc/87/85/99/922878599.db2.gz JARYNHMXAYNQGL-UHFFFAOYSA-N 0 3 403.461 4.233 20 0 HIADHN O=C(CCc1ncc(-c2ccccc2F)o1)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000515196319 922983475 /nfs/dbraw/zinc/98/34/75/922983475.db2.gz OBLAYKUQVXBSBS-IBGZPJMESA-N 0 3 407.489 4.194 20 0 HIADHN COC(=O)c1cccc(NC(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)c1 ZINC000515254809 923021783 /nfs/dbraw/zinc/02/17/83/923021783.db2.gz RBLUMZMRXUSFIY-SFHVURJKSA-N 0 3 401.532 4.129 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)CCOc3ccc(F)c(Cl)c3)c(C)c2)CC1 ZINC000515298464 923040439 /nfs/dbraw/zinc/04/04/39/923040439.db2.gz FRCMNTCOEPZESW-UHFFFAOYSA-N 0 3 419.928 4.337 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@H](C)c1c(F)cccc1F)c1cccc(OC)c1 ZINC000515528779 923157849 /nfs/dbraw/zinc/15/78/49/923157849.db2.gz NSVFWPWSJSZZSM-FOIQADDNSA-N 0 3 405.489 4.417 20 0 HIADHN CC(C)c1ccccc1NC(=O)[C@H](C)N[C@@H](C)c1ccc(OCC(=O)NC2CC2)cc1 ZINC000515759582 923332246 /nfs/dbraw/zinc/33/22/46/923332246.db2.gz PXYWGZNRODSSJR-ROUUACIJSA-N 0 3 423.557 4.145 20 0 HIADHN CCOc1ccc(NC(=O)NC[C@H](c2cccc(OC)c2)N2CCCC2)cc1F ZINC000515807235 923364582 /nfs/dbraw/zinc/36/45/82/923364582.db2.gz YBSQHLCSASWEOD-HXUWFJFHSA-N 0 3 401.482 4.192 20 0 HIADHN COc1ccc([C@@H](CNC(=O)NCc2ccccc2OC(C)C)N2CCCC2)cc1 ZINC000515868432 923400741 /nfs/dbraw/zinc/40/07/41/923400741.db2.gz MFGLYIXAABOYNB-JOCHJYFZSA-N 0 3 411.546 4.119 20 0 HIADHN C[C@H](c1ccc(F)cc1)N(C)C(=O)NCCCCN1CCN(c2ccccc2)CC1 ZINC000515903019 923421075 /nfs/dbraw/zinc/42/10/75/923421075.db2.gz ANOPYZDQQNIUMW-HXUWFJFHSA-N 0 3 412.553 4.131 20 0 HIADHN C[C@H](CC(=O)NCCCCN1CCN(Cc2ccccc2)CC1)c1ccc(F)cc1 ZINC000516010319 923499727 /nfs/dbraw/zinc/49/97/27/923499727.db2.gz WVXBUUWPCRQMJR-OAQYLSRUSA-N 0 3 411.565 4.034 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)c1cccc(-n2nccc2C(F)(F)F)c1)c1ccco1 ZINC000516335064 923672030 /nfs/dbraw/zinc/67/20/30/923672030.db2.gz ZGMMPOREUCGOQO-RHSMWYFYSA-N 0 3 420.435 4.343 20 0 HIADHN CSc1ccccc1NC(=O)[C@H](C)N[C@@H]1CCN(C)[C@@H]1c1ccc(Cl)cc1 ZINC000516351752 923681946 /nfs/dbraw/zinc/68/19/46/923681946.db2.gz KBEFGDHELPAGCA-BOUXLOLZSA-N 0 3 403.979 4.424 20 0 HIADHN CC1CCN([C@@H](CNC(=O)Nc2cc3c(cc2F)CCC(=O)N3)c2ccccc2)CC1 ZINC000516466628 923746004 /nfs/dbraw/zinc/74/60/04/923746004.db2.gz UIYOOAKRLUQVOU-QFIPXVFZSA-N 0 3 424.520 4.305 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)NCc2ccc(OC3CCCC3)nc2)C1 ZINC000516579376 923801005 /nfs/dbraw/zinc/80/10/05/923801005.db2.gz SFOOYVBDHVASTB-RXVVDRJESA-N 0 3 408.546 4.038 20 0 HIADHN Cc1ccccc1CNC(=O)N(CCN(C)C)Cc1ccc(Br)cc1 ZINC000516661786 923832592 /nfs/dbraw/zinc/83/25/92/923832592.db2.gz UXNGFOBTNXENJC-UHFFFAOYSA-N 0 3 404.352 4.031 20 0 HIADHN Cc1cc(NC(=O)c2ccco2)sc1C(=O)N[C@H](CN(C)C)c1ccc(F)cc1 ZINC000516675798 923838818 /nfs/dbraw/zinc/83/88/18/923838818.db2.gz RSDMCFPPDSRNCO-MRXNPFEDSA-N 0 3 415.490 4.074 20 0 HIADHN Cc1cc(NC(=O)c2ccco2)sc1C(=O)N[C@@H](CN(C)C)c1ccc(F)cc1 ZINC000516675797 923838920 /nfs/dbraw/zinc/83/89/20/923838920.db2.gz RSDMCFPPDSRNCO-INIZCTEOSA-N 0 3 415.490 4.074 20 0 HIADHN CSCC[C@H](NCc1ccc(-c2ccccc2Br)cc1)C(=O)N(C)C ZINC000516679555 923841489 /nfs/dbraw/zinc/84/14/89/923841489.db2.gz UIQFRJLPKWWKEN-IBGZPJMESA-N 0 3 421.404 4.416 20 0 HIADHN COc1ccc([C@H](NC(=O)N2CCN(C3CCCC3)CC2)c2ccc(C)cc2)cc1 ZINC000516704454 923854861 /nfs/dbraw/zinc/85/48/61/923854861.db2.gz JZJQPWDQGOZLMJ-XMMPIXPASA-N 0 3 407.558 4.363 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)NC[C@@H]2CCCO[C@H]2c2ccccc2)CC1 ZINC000516715988 923859798 /nfs/dbraw/zinc/85/97/98/923859798.db2.gz VCDQPOAMGQRDIQ-REWPJTCUSA-N 0 3 411.546 4.053 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1cc(F)ccc1OC[C@@H]1CCCO1)c1ccco1 ZINC000516885566 923924853 /nfs/dbraw/zinc/92/48/53/923924853.db2.gz OBBZJHCUOMCVOG-VDZJLULYSA-N 0 3 419.497 4.227 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1cc(F)ccc1OC[C@@H]1CCCO1)c1ccco1 ZINC000516885564 923925764 /nfs/dbraw/zinc/92/57/64/923925764.db2.gz OBBZJHCUOMCVOG-IEZWGBDMSA-N 0 3 419.497 4.227 20 0 HIADHN CC[C@@H](NC(=O)Nc1ccc(N2CCN(CC)CC2)cc1C)c1nc(C)cs1 ZINC000517118792 924008500 /nfs/dbraw/zinc/00/85/00/924008500.db2.gz KNCVEYMBRFDHBH-GOSISDBHSA-N 0 3 401.580 4.175 20 0 HIADHN COCc1cccc2sc(NC(=O)NCCCN3CCc4ccccc4C3)nc21 ZINC000517131898 924017379 /nfs/dbraw/zinc/01/73/79/924017379.db2.gz KNXVPEWGVJMOPR-UHFFFAOYSA-N 0 3 410.543 4.013 20 0 HIADHN CC[C@@H](NC(=O)NC[C@@H](c1cccc(OC)c1)N1CCCC1)c1nc(C)cs1 ZINC000517136871 924020002 /nfs/dbraw/zinc/02/00/02/924020002.db2.gz TZFRYPWFYPQNRG-MOPGFXCFSA-N 0 3 402.564 4.048 20 0 HIADHN CC(C)Oc1ccc(CC[C@H](C)N[C@H](C(N)=O)c2ccc(Br)cc2)cc1 ZINC000517166580 924034365 /nfs/dbraw/zinc/03/43/65/924034365.db2.gz MLAQGSVJSKVMNZ-YWZLYKJASA-N 0 3 419.363 4.374 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)Nc2ccc(C(=O)NC(C)C)cc2C)N(C)C)cc1 ZINC000517303815 924090236 /nfs/dbraw/zinc/09/02/36/924090236.db2.gz UDOGVJFEPYWLOH-JOCHJYFZSA-N 0 3 410.562 4.120 20 0 HIADHN CN(C[C@@H](O)COc1ccccc1)[C@@H]1CCSc2ccc(Br)cc21 ZINC000517526744 924246936 /nfs/dbraw/zinc/24/69/36/924246936.db2.gz BZZOTLFWSYMUSR-CRAIPNDOSA-N 0 3 408.361 4.358 20 0 HIADHN CCN(Cc1ccc(OC)c(OC)c1)C(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000517541799 924254574 /nfs/dbraw/zinc/25/45/74/924254574.db2.gz XNHHAGOIGONCLS-WIYYLYMNSA-N 0 3 411.546 4.071 20 0 HIADHN CC(C)Oc1ccc([C@H](C)NC(=O)N(CCN(C)C)Cc2ccc(F)cc2)cc1 ZINC000517542108 924255083 /nfs/dbraw/zinc/25/50/83/924255083.db2.gz FAYCGWSWPPGPJO-SFHVURJKSA-N 0 3 401.526 4.447 20 0 HIADHN COCCOc1ccc(CNC2(c3ccc4c(c3)OCCO4)CCCC2)cc1OC ZINC000517545503 924257487 /nfs/dbraw/zinc/25/74/87/924257487.db2.gz PXDRXSZGBHYTKM-UHFFFAOYSA-N 0 3 413.514 4.051 20 0 HIADHN COc1cc(CN[C@H]2CCc3cc(C)ccc32)cc(I)c1OC ZINC000517549305 924259902 /nfs/dbraw/zinc/25/99/02/924259902.db2.gz FYJDHUOXWWESAF-KRWDZBQOSA-N 0 3 423.294 4.394 20 0 HIADHN C[C@@H](NC(=O)CN1CCC(CCCn2ccnc2)CC1)c1cccc2ccccc21 ZINC000517613142 926720529 /nfs/dbraw/zinc/72/05/29/926720529.db2.gz ICNRYDZKUZKDTO-HXUWFJFHSA-N 0 3 404.558 4.406 20 0 HIADHN C[C@H](NC(=O)CN1CCC(CCCn2ccnc2)CC1)c1cccc2ccccc21 ZINC000517613141 926720931 /nfs/dbraw/zinc/72/09/31/926720931.db2.gz ICNRYDZKUZKDTO-FQEVSTJZSA-N 0 3 404.558 4.406 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)c(C)c1CC(=O)NC[C@H](C)N(C)Cc1ccccc1 ZINC000517659054 926767109 /nfs/dbraw/zinc/76/71/09/926767109.db2.gz URSPEPVGGJCAIO-KRWDZBQOSA-N 0 3 424.976 4.322 20 0 HIADHN Cc1csc(Nc2ccc(NC(=O)[C@H]3CCCN(Cc4cccnc4)C3)cc2)n1 ZINC000517681154 926785946 /nfs/dbraw/zinc/78/59/46/926785946.db2.gz MJHRAMVRXBPSTH-SFHVURJKSA-N 0 3 407.543 4.441 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(OCCNCc3cc(C)ccc3OC)c2)cc1 ZINC000517711765 926809101 /nfs/dbraw/zinc/80/91/01/926809101.db2.gz NPPZBBJJVCIBQG-UHFFFAOYSA-N 0 3 420.509 4.433 20 0 HIADHN O=C([C@H]1CCCN(Cc2cccc(F)c2)C1)N(Cc1ccncc1)Cc1cccnc1 ZINC000517805534 926844471 /nfs/dbraw/zinc/84/44/71/926844471.db2.gz HIIYQUJCOCEXCU-QHCPKHFHSA-N 0 3 418.516 4.057 20 0 HIADHN C[C@H](C(=O)NCCc1c[nH]c2ccccc12)N1CCC(CCc2ccc(O)cc2)CC1 ZINC000517827803 926854854 /nfs/dbraw/zinc/85/48/54/926854854.db2.gz ZBDTZFZNMMQNND-LJQANCHMSA-N 0 3 419.569 4.266 20 0 HIADHN CN(C(=O)c1cccc(OC2CCCC2)c1)C1CCN(CCc2ccccn2)CC1 ZINC000518216464 927084232 /nfs/dbraw/zinc/08/42/32/927084232.db2.gz ASJRTEYATXRJOS-UHFFFAOYSA-N 0 3 407.558 4.182 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2CNCCNC(=O)c2cccs2)cc1 ZINC000518275323 927132648 /nfs/dbraw/zinc/13/26/48/927132648.db2.gz PLGYEPOPZMJFPS-UHFFFAOYSA-N 0 3 416.550 4.429 20 0 HIADHN Fc1cccc(N2CCCC2)c1CNC[C@H](c1cccc(Cl)c1)N1CCOCC1 ZINC000518275360 927133036 /nfs/dbraw/zinc/13/30/36/927133036.db2.gz FVSSYOJGVCKFMO-HSZRJFAPSA-N 0 3 417.956 4.242 20 0 HIADHN O[C@H](CNCc1cccc(OC(F)(F)F)c1)COc1cccc(Cl)c1Cl ZINC000518277304 927135728 /nfs/dbraw/zinc/13/57/28/927135728.db2.gz FWHJWXRZNFVSHV-GFCCVEGCSA-N 0 3 410.219 4.422 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3ccccc3OC3CCCC3)CC2)C[C@H](C)O1 ZINC000518314524 927176290 /nfs/dbraw/zinc/17/62/90/927176290.db2.gz KRDXJDQZBUTPHB-KDURUIRLSA-N 0 3 415.578 4.361 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)N1CCC[C@@H]1Cc1ccccc1 ZINC000518356682 927217823 /nfs/dbraw/zinc/21/78/23/927217823.db2.gz DILYUOIIWFIIBP-RUZDIDTESA-N 0 3 420.601 4.006 20 0 HIADHN CCOc1ccc(-c2nc(CC(=O)NC[C@@H](C)N(C)Cc3ccccc3)cs2)cc1 ZINC000518377881 927230021 /nfs/dbraw/zinc/23/00/21/927230021.db2.gz KCLFSAUVANQGBV-GOSISDBHSA-N 0 3 423.582 4.388 20 0 HIADHN C[C@@H](NCc1ccc(-n2ccc(C(F)(F)F)n2)cc1)c1ccc2c(c1)OCC(=O)N2 ZINC000518386329 927233932 /nfs/dbraw/zinc/23/39/32/927233932.db2.gz AOSOUCIGUKDCFV-CYBMUJFWSA-N 0 3 416.403 4.073 20 0 HIADHN COc1ccc2cc(CNC(=O)N[C@H]3CCN([C@H](C)c4ccccc4)C3)ccc2c1 ZINC000518409555 927250472 /nfs/dbraw/zinc/25/04/72/927250472.db2.gz CWACKNXHBVZWLX-JPYJTQIMSA-N 0 3 403.526 4.483 20 0 HIADHN CN(CCN(Cc1ccccc1)C(=O)Nc1cc(C2CC2)n(C)n1)Cc1ccccc1 ZINC000518446673 927279949 /nfs/dbraw/zinc/27/99/49/927279949.db2.gz IRXQFHHWCUNQIU-UHFFFAOYSA-N 0 3 417.557 4.464 20 0 HIADHN Cc1noc(-c2ccc(C)c(NC(=O)N[C@@H]3CCN([C@@H](C)c4ccccc4)C3)c2)n1 ZINC000518474199 927296562 /nfs/dbraw/zinc/29/65/62/927296562.db2.gz ZVFBSKZPYUXPOO-OXJNMPFZSA-N 0 3 405.502 4.310 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)NC[C@@H]1CCCO[C@@H]1c1ccccc1 ZINC000518521958 927323717 /nfs/dbraw/zinc/32/37/17/927323717.db2.gz UKJXHTYSJKTVLJ-NZQKXSOJSA-N 0 3 413.537 4.067 20 0 HIADHN Cc1cc(SCC(=O)N2CC[C@H](N3CCCCC3)C2)c(C)cc1Br ZINC000518637672 927395062 /nfs/dbraw/zinc/39/50/62/927395062.db2.gz UPPJNEVKKVSLMF-INIZCTEOSA-N 0 3 411.409 4.245 20 0 HIADHN COc1ccccc1[C@H](NC(=O)N(CCN(C)C)Cc1ccc(C)o1)c1ccccc1 ZINC000518703628 927445819 /nfs/dbraw/zinc/44/58/19/927445819.db2.gz VDNHKPHQIBGTSD-XMMPIXPASA-N 0 3 421.541 4.459 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)c(Cl)c1 ZINC000518812472 927508471 /nfs/dbraw/zinc/50/84/71/927508471.db2.gz PQISZFACFSWQEB-KBXCAEBGSA-N 0 3 400.910 4.255 20 0 HIADHN CCN(C(=O)c1ccc2c(c1)SCC(=O)N2)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000518847526 927549760 /nfs/dbraw/zinc/54/97/60/927549760.db2.gz PVWLRCLRAWDRGZ-LPHOPBHVSA-N 0 3 409.555 4.028 20 0 HIADHN CO[C@H](CNC(=O)N(CCN(C)C)Cc1ccc(C(F)(F)F)cc1)c1ccccc1 ZINC000518863964 927570166 /nfs/dbraw/zinc/57/01/66/927570166.db2.gz KIXDTVMRPFWACL-HXUWFJFHSA-N 0 3 423.479 4.166 20 0 HIADHN COCc1c(C(=O)NC[C@H](C)N(C)Cc2ccccc2)sc2cccc(F)c21 ZINC000518907743 927616960 /nfs/dbraw/zinc/61/69/60/927616960.db2.gz BPRTXPHQCUWFLM-HNNXBMFYSA-N 0 3 400.519 4.437 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)NCC(C)(C)[N@@H+]3C[C@H](C)C[C@H](C)C3)cc2)cc(=O)[n-]1 ZINC000518909584 927618916 /nfs/dbraw/zinc/61/89/16/927618916.db2.gz NHFKJVKTEOZWNN-IYBDPMFKSA-N 0 3 411.550 4.036 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)NCC(C)(C)[N@H+]3C[C@H](C)C[C@H](C)C3)cc2)cc(=O)[n-]1 ZINC000518909584 927618924 /nfs/dbraw/zinc/61/89/24/927618924.db2.gz NHFKJVKTEOZWNN-IYBDPMFKSA-N 0 3 411.550 4.036 20 0 HIADHN CN(C(=O)c1cc(-c2ccc(F)cc2)nc2onc(C3CC3)c21)[C@H]1CN2CCC1CC2 ZINC000518961022 927659461 /nfs/dbraw/zinc/65/94/61/927659461.db2.gz GYIQSLQNMTTZKY-FQEVSTJZSA-N 0 3 420.488 4.073 20 0 HIADHN CN(C(=O)c1cc(-c2ccc(F)cc2)nc2onc(C3CC3)c21)[C@@H]1CN2CCC1CC2 ZINC000518961023 927659992 /nfs/dbraw/zinc/65/99/92/927659992.db2.gz GYIQSLQNMTTZKY-HXUWFJFHSA-N 0 3 420.488 4.073 20 0 HIADHN C[C@H](NC(=O)CN1CCN(CCC(C)(C)C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000519068543 927744126 /nfs/dbraw/zinc/74/41/26/927744126.db2.gz GISNFZJAJZVYER-HNNXBMFYSA-N 0 3 400.394 4.224 20 0 HIADHN COC(=O)c1ccc(CNCc2ccc(OCc3ccc(F)cc3)c(OC)c2)cc1 ZINC000519230244 927837510 /nfs/dbraw/zinc/83/75/10/927837510.db2.gz FPYOAEXKNIVZEQ-UHFFFAOYSA-N 0 3 409.457 4.490 20 0 HIADHN CC(C)(C)Oc1cccc(CCC(=O)N2CCN(c3ccnc4ccccc43)CC2)n1 ZINC000519230579 927837613 /nfs/dbraw/zinc/83/76/13/927837613.db2.gz PILMYYREQHWLHG-UHFFFAOYSA-N 0 3 418.541 4.089 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2cc(C3CC3)nn2-c2ccccc2)N(C)C)cc1 ZINC000519260256 927852506 /nfs/dbraw/zinc/85/25/06/927852506.db2.gz YPORCJKARLRITA-JOCHJYFZSA-N 0 3 403.530 4.483 20 0 HIADHN COc1ccc2oc([C@@H](C)NC(=O)N[C@H]3CCN(Cc4ccccc4)C3)c(C)c2c1 ZINC000519294730 927867632 /nfs/dbraw/zinc/86/76/32/927867632.db2.gz JVBOFMIZGSBWCC-MJGOQNOKSA-N 0 3 407.514 4.385 20 0 HIADHN Cc1nc(C)c([C@@H](C)N(C)C(=O)NCC(C)(C)N2CCc3ccccc3C2)s1 ZINC000519300398 927870886 /nfs/dbraw/zinc/87/08/86/927870886.db2.gz JCHDZUXOFNMEJO-MRXNPFEDSA-N 0 3 400.592 4.299 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccc(F)c2)C1)N1CCC(c2nc3ccccc3[nH]2)CC1 ZINC000519363680 927897664 /nfs/dbraw/zinc/89/76/64/927897664.db2.gz OJKZUNVAMCXNBF-HXUWFJFHSA-N 0 3 420.532 4.320 20 0 HIADHN COC1CCN(C(C)(C)CNC(=O)CSc2cc(Cl)ccc2Cl)CC1 ZINC000519369646 927899589 /nfs/dbraw/zinc/89/95/89/927899589.db2.gz PSEMOMBFUSXLKR-UHFFFAOYSA-N 0 3 405.391 4.091 20 0 HIADHN COC1CCN(C(C)(C)CNC(=O)c2ccccc2Sc2ccccc2C#N)CC1 ZINC000519372134 927901394 /nfs/dbraw/zinc/90/13/94/927901394.db2.gz VLLFNFHLQFAUJW-UHFFFAOYSA-N 0 3 423.582 4.329 20 0 HIADHN CCOc1ccc(CNC(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)cc1 ZINC000519452509 927960991 /nfs/dbraw/zinc/96/09/91/927960991.db2.gz FGOZYUGKVMZMTJ-UHFFFAOYSA-N 0 3 423.479 4.378 20 0 HIADHN Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)N[C@@H]1CCN(Cc2ccccc2)[C@@H]1C ZINC000519468518 927969073 /nfs/dbraw/zinc/96/90/73/927969073.db2.gz NZEMIJFDSUGNNG-AUSIDOKSSA-N 0 3 422.573 4.165 20 0 HIADHN Cc1ccc(NC(=O)N[C@H](CN2CCCC2)c2ccccc2)cc1C(=O)NC(C)C ZINC000519497163 927992280 /nfs/dbraw/zinc/99/22/80/927992280.db2.gz ZRBXNPXIXKFBSJ-JOCHJYFZSA-N 0 3 408.546 4.092 20 0 HIADHN Cc1ccc(NC(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)cc1C(=O)NC(C)C ZINC000519498447 927994285 /nfs/dbraw/zinc/99/42/85/927994285.db2.gz JIQLEALPYNJSCF-NQIIRXRSSA-N 0 3 408.546 4.090 20 0 HIADHN COc1cc(CN(C)C(=O)NC[C@@H](c2ccccc2)N2CCCC2)ccc1SC ZINC000519923571 928156395 /nfs/dbraw/zinc/15/63/95/928156395.db2.gz XQAKEDDCEYFACW-FQEVSTJZSA-N 0 3 413.587 4.396 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCc1cccc(C)n1)c1ccc(C(F)(F)F)cc1 ZINC000519951013 928182849 /nfs/dbraw/zinc/18/28/49/928182849.db2.gz WKBQWJWRKSBMQP-IBGZPJMESA-N 0 3 408.468 4.291 20 0 HIADHN C[C@@H](CNC(=O)CSc1nnc(-c2ccc3ccccc3c2)o1)N1CCC(C)CC1 ZINC000520064846 928290307 /nfs/dbraw/zinc/29/03/07/928290307.db2.gz JWZNMKDBIXXKME-KRWDZBQOSA-N 0 3 424.570 4.219 20 0 HIADHN CCN(Cc1cccc(NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)c1)C(C)=O ZINC000520094210 928305864 /nfs/dbraw/zinc/30/58/64/928305864.db2.gz RCRHAUBMXVDTFE-OAQYLSRUSA-N 0 3 411.521 4.045 20 0 HIADHN COCCN1CCC(NC(=O)Nc2cccc(CO[C@@H]3CCC[C@H](C)C3)c2)CC1 ZINC000520132691 928330553 /nfs/dbraw/zinc/33/05/53/928330553.db2.gz PZTYJYLMOWETCE-PGRDOPGGSA-N 0 3 403.567 4.014 20 0 HIADHN COc1cc2c(cc1OC)CN(C(=O)CN(Cc1cccc(C)c1)CC(C)C)CC2 ZINC000520173709 928364529 /nfs/dbraw/zinc/36/45/29/928364529.db2.gz XEAURWCZIRMQDT-UHFFFAOYSA-N 0 3 410.558 4.055 20 0 HIADHN C/C(=C/c1ccccc1)CNCc1cccc(S(=O)(=O)NCc2cccc(F)c2)c1 ZINC000520200630 928385091 /nfs/dbraw/zinc/38/50/91/928385091.db2.gz IOWWVOYPYSSVKM-UYRXBGFRSA-N 0 3 424.541 4.497 20 0 HIADHN COc1cc(CN(C)C(=O)NC[C@H](c2ccc(C)cc2)N(C)C)ccc1SC ZINC000520215366 928393427 /nfs/dbraw/zinc/39/34/27/928393427.db2.gz IHVGSOYHEOMRGB-LJQANCHMSA-N 0 3 401.576 4.170 20 0 HIADHN CCn1c(Cc2ccccc2)nnc1SC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000520261098 928424817 /nfs/dbraw/zinc/42/48/17/928424817.db2.gz OEWGVSXZQGQGLN-QFIPXVFZSA-N 0 3 422.598 4.272 20 0 HIADHN CCCOc1ccc(NC(=O)N2CCC(CN3C[C@H](C)O[C@@H](C)C3)CC2)cc1Cl ZINC000520266505 928431276 /nfs/dbraw/zinc/43/12/76/928431276.db2.gz RUTINHYAPHXOCN-IRXDYDNUSA-N 0 3 423.985 4.482 20 0 HIADHN CN(C(=O)c1cnn(-c2cccc(C(F)(F)F)c2)c1C1CC1)[C@H]1CCN(C2CC2)C1 ZINC000520367906 928524261 /nfs/dbraw/zinc/52/42/61/928524261.db2.gz HJLNHTPDLZSLCG-SFHVURJKSA-N 0 3 418.463 4.077 20 0 HIADHN Cc1c([C@@H](C)NC(=O)NC[C@H](C)N(C)Cc2ccccc2)cnn1-c1ccc(F)cc1 ZINC000520377821 928531167 /nfs/dbraw/zinc/53/11/67/928531167.db2.gz QMTSVPKYSSFVHT-ZWKOTPCHSA-N 0 3 423.536 4.201 20 0 HIADHN O=C(NCc1ccco1)c1cccc(CN2CC[C@]3(C2)CCc2ccccc2O3)c1 ZINC000520663571 928708841 /nfs/dbraw/zinc/70/88/41/928708841.db2.gz OUSIZZMXVWAINH-VWLOTQADSA-N 0 3 402.494 4.179 20 0 HIADHN CC(C)C[C@@H](CNc1nc2c(cnn2C(C)(C)C)c(=O)[nH]1)N[C@H](C)c1ccccc1 ZINC000520673777 928720136 /nfs/dbraw/zinc/72/01/36/928720136.db2.gz PBGMXBGRCCMYOR-AEFFLSMTSA-N 0 3 410.566 4.464 20 0 HIADHN Cc1nc(COc2ccc(Cl)cc2)sc1C(=O)N[C@@H]1CCN(C2CCCC2)C1 ZINC000520733832 928783001 /nfs/dbraw/zinc/78/30/01/928783001.db2.gz RGRWMJOPCUKEMD-MRXNPFEDSA-N 0 3 419.978 4.431 20 0 HIADHN O=C(N[C@H](c1ccc(F)cc1)[C@@H]1CCCO1)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000520753946 928802438 /nfs/dbraw/zinc/80/24/38/928802438.db2.gz RCXSDJFNQBNBCX-XPWALMASSA-N 0 3 411.521 4.010 20 0 HIADHN O=C(CN1CCCCC[C@H]1c1ccccc1)Nc1ccc(CN2CCOCC2)cc1 ZINC000520788631 928819499 /nfs/dbraw/zinc/81/94/99/928819499.db2.gz OAGFHLXVQXTBAH-DEOSSOPVSA-N 0 3 407.558 4.075 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2nc(CN3CCC[C@@H](C)C3)cs2)N(C)C)cc1 ZINC000520830068 928835914 /nfs/dbraw/zinc/83/59/14/928835914.db2.gz JTKWRIWZLWCXNL-YLJYHZDGSA-N 0 3 415.607 4.108 20 0 HIADHN CCOC(=O)c1cnn(C2CCN(C/C(C)=C/c3ccccc3COC)CC2)c1C ZINC000520855820 928846523 /nfs/dbraw/zinc/84/65/23/928846523.db2.gz KIKKHBISHZATIX-NBVRZTHBSA-N 0 3 411.546 4.255 20 0 HIADHN COc1ccc(-c2nc(C)c(C(=O)NC[C@@H](c3ccc(C)cc3)N(C)C)s2)cc1 ZINC000520857760 928847080 /nfs/dbraw/zinc/84/70/80/928847080.db2.gz TUDKKQRNACUNCK-FQEVSTJZSA-N 0 3 409.555 4.468 20 0 HIADHN COc1ccc(CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)[C@H](C)C2CC2)cc1 ZINC000520905992 928868551 /nfs/dbraw/zinc/86/85/51/928868551.db2.gz NYHKTVRBMQWJPH-AUSIDOKSSA-N 0 3 407.558 4.280 20 0 HIADHN COc1ccc(CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)[C@@H](C)C2CC2)cc1 ZINC000520905994 928868852 /nfs/dbraw/zinc/86/88/52/928868852.db2.gz NYHKTVRBMQWJPH-WMZHIEFXSA-N 0 3 407.558 4.280 20 0 HIADHN CC(=O)Nc1ccc(CNCc2ccc(OCc3cn4cccc(C)c4n3)cc2)cc1 ZINC000520934014 928881320 /nfs/dbraw/zinc/88/13/20/928881320.db2.gz ZNRYUHRAESUXGA-UHFFFAOYSA-N 0 3 414.509 4.470 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3cc(Cl)cc4cccnc43)CC2)C[C@@H](C)O1 ZINC000521006323 928922203 /nfs/dbraw/zinc/92/22/03/928922203.db2.gz JWGXFFAVXFKGOF-HZPDHXFCSA-N 0 3 416.953 4.241 20 0 HIADHN CCCOc1ccc(Cl)cc1NC(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000521007500 928923763 /nfs/dbraw/zinc/92/37/63/928923763.db2.gz LATVQHPGCBHSEH-IAGOWNOFSA-N 0 3 423.985 4.482 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)Nc1ncc(Cc2ccccc2)s1 ZINC000521064700 928968699 /nfs/dbraw/zinc/96/86/99/928968699.db2.gz QXVUVOSWRARSSK-UHFFFAOYSA-N 0 3 412.534 4.469 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)N[C@@H]1CCOc2c(Cl)cccc21 ZINC000521070376 928971623 /nfs/dbraw/zinc/97/16/23/928971623.db2.gz RQPGIASAMJDXJC-LJQANCHMSA-N 0 3 423.891 4.215 20 0 HIADHN C[C@H](CNC(=O)COC(c1ccccc1)c1ccccc1)N(C)Cc1ccccc1 ZINC000521095623 928990725 /nfs/dbraw/zinc/99/07/25/928990725.db2.gz KTEABTCXMCJCEP-OAQYLSRUSA-N 0 3 402.538 4.429 20 0 HIADHN Cc1nc2c(s1)[C@@H](N(C)C(=O)c1ccc(N3CCN(C(C)C)CC3)cc1)CCC2 ZINC000521111829 929002354 /nfs/dbraw/zinc/00/23/54/929002354.db2.gz OBYIARKNPYVQQX-NRFANRHFSA-N 0 3 412.603 4.132 20 0 HIADHN C[C@@H](CNC(=O)N1CCO[C@H](c2ccc(F)c(Cl)c2)C1)N(C)Cc1ccccc1 ZINC000521162607 929035908 /nfs/dbraw/zinc/03/59/08/929035908.db2.gz WJLHLEJDCVNMFF-KKSFZXQISA-N 0 3 419.928 4.083 20 0 HIADHN CCCN(CC(=O)Nc1ccc(CN2CCOCC2)cc1)[C@H](CC)c1ccccc1 ZINC000521193860 929055266 /nfs/dbraw/zinc/05/52/66/929055266.db2.gz VTQHYWYRDPVRMG-XMMPIXPASA-N 0 3 409.574 4.321 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)CCc1c(C)n[nH]c1C)c1ccc(C(F)(F)F)cc1 ZINC000521297055 929107759 /nfs/dbraw/zinc/10/77/59/929107759.db2.gz ANXBZOIFWOTSJD-IBGZPJMESA-N 0 3 410.484 4.177 20 0 HIADHN CC(C)n1ncc2c1nc(C1CC1)cc2C(=O)N1CCN(CC2CCCCC2)CC1 ZINC000521419732 929213515 /nfs/dbraw/zinc/21/35/15/929213515.db2.gz WFSGRJKDEXTSRZ-UHFFFAOYSA-N 0 3 409.578 4.228 20 0 HIADHN CC[C@@H](C)NC(=O)c1ccc(NC(=O)NC[C@@H](c2ccc(C)cc2)N(C)C)c(C)c1 ZINC000521466639 929233674 /nfs/dbraw/zinc/23/36/74/929233674.db2.gz GHKJBPINBXNQNP-GCJKJVERSA-N 0 3 410.562 4.256 20 0 HIADHN CC(C)[C@@H](C(=O)Nc1ccc(CC(=O)N(C)c2ccccc2)cc1)N1CCCCC1 ZINC000521469435 929234913 /nfs/dbraw/zinc/23/49/13/929234913.db2.gz JXDFATXXQPHNBU-DEOSSOPVSA-N 0 3 407.558 4.341 20 0 HIADHN Cc1ccc(NC(=O)c2cn[nH]c2-c2ccccc2)cc1NC(=O)CN1CCCCC1 ZINC000521485248 929245284 /nfs/dbraw/zinc/24/52/84/929245284.db2.gz JLDLVRTWXGPCAT-UHFFFAOYSA-N 0 3 417.513 4.062 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N(C)Cc2ccc(OC(F)(F)F)cc2)N(C)C)cc1 ZINC000521509640 929260676 /nfs/dbraw/zinc/26/06/76/929260676.db2.gz ROYRARMHRJWKPY-LJQANCHMSA-N 0 3 409.452 4.338 20 0 HIADHN O=C(NCc1cccnc1OC1CCCC1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000521533943 929279228 /nfs/dbraw/zinc/27/92/28/929279228.db2.gz SKDYOQJESNIXOR-HXUWFJFHSA-N 0 3 411.521 4.071 20 0 HIADHN NS(=O)(=O)c1ccc2c(c1)CCC[C@H]2N[C@H]1CCc2c1ccc(Cl)c2Cl ZINC000521595074 929316477 /nfs/dbraw/zinc/31/64/77/929316477.db2.gz QWTGHVZJJBJWOF-MSOLQXFVSA-N 0 3 411.354 4.295 20 0 HIADHN CC(C)N1CCCN(C(=O)c2nn(-c3ccc(Cl)cc3Cl)c3c2CCC3)CC1 ZINC000521648380 929343827 /nfs/dbraw/zinc/34/38/27/929343827.db2.gz WONIIPMOSCRWOV-UHFFFAOYSA-N 0 3 421.372 4.224 20 0 HIADHN C[C@@H](NC(=O)N(CCN(C)C)Cc1cccc(F)c1)c1ccc(Br)cc1 ZINC000521678320 929361463 /nfs/dbraw/zinc/36/14/63/929361463.db2.gz KMZUIHZGHQYBEJ-OAHLLOKOSA-N 0 3 422.342 4.423 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)N[C@@H]1CCOc2c(Cl)cccc21 ZINC000521687847 929367302 /nfs/dbraw/zinc/36/73/02/929367302.db2.gz YUHVFMZFAMKNPB-LJQANCHMSA-N 0 3 423.891 4.215 20 0 HIADHN FC(F)(F)Oc1ccc(CNCc2cc(Br)c3c(c2)OCCO3)cc1 ZINC000521826558 929481126 /nfs/dbraw/zinc/48/11/26/929481126.db2.gz IPIIHIMXQGAHLF-UHFFFAOYSA-N 0 3 418.209 4.409 20 0 HIADHN c1ccc(-c2ccc(NCCNCc3ccccc3OCc3ccccn3)nn2)cc1 ZINC000521832752 929483630 /nfs/dbraw/zinc/48/36/30/929483630.db2.gz PXWIMCJUCBYTIK-UHFFFAOYSA-N 0 3 411.509 4.319 20 0 HIADHN COc1ccc(OC)c([C@H](C)NC(=O)[C@@H](C)N[C@@H](C)c2ccc(OC(C)C)cc2)c1 ZINC000521862072 929513438 /nfs/dbraw/zinc/51/34/38/929513438.db2.gz KFCLWTYIKQPYOQ-OKZBNKHCSA-N 0 3 414.546 4.408 20 0 HIADHN O=C(Nc1ccc(C(=O)N[C@H]2CCN(C3CC3)C2)cc1)c1cc(Cl)cc(Cl)c1 ZINC000521868994 929520156 /nfs/dbraw/zinc/52/01/56/929520156.db2.gz XVVXDHGBVRIDAX-SFHVURJKSA-N 0 3 418.324 4.212 20 0 HIADHN COCCSc1ccc([C@@H](C)N[C@@H](C)C(=O)N(C)Cc2cccc(F)c2)cc1 ZINC000521881795 929531044 /nfs/dbraw/zinc/53/10/44/929531044.db2.gz VRQARHSBGDDOFK-SJORKVTESA-N 0 3 404.551 4.262 20 0 HIADHN COc1cc(CN(C)C(=O)N[C@@H](CN2CCCC2)c2ccccc2)ccc1SC ZINC000521895111 929542034 /nfs/dbraw/zinc/54/20/34/929542034.db2.gz BXJXVGHUOMNQOO-FQEVSTJZSA-N 0 3 413.587 4.396 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N[C@@H]3CCSc4ccc(F)cc43)cc2)CC1 ZINC000521931405 929570697 /nfs/dbraw/zinc/57/06/97/929570697.db2.gz VGMDNWBFMABYRQ-OAQYLSRUSA-N 0 3 413.562 4.323 20 0 HIADHN CC(C)Oc1ccccc1[C@@H](C)NC(=O)c1ccc(N2CCN(C(C)C)CC2)cc1 ZINC000521931383 929570843 /nfs/dbraw/zinc/57/08/43/929570843.db2.gz GDJMONFIQGFNLS-HXUWFJFHSA-N 0 3 409.574 4.495 20 0 HIADHN CC(C)N(C)S(=O)(=O)c1ccc(CN[C@@H]2CCCc3c4ccccc4[nH]c32)cc1 ZINC000521937969 929575966 /nfs/dbraw/zinc/57/59/66/929575966.db2.gz FTGGSOQBOMPMDN-JOCHJYFZSA-N 0 3 411.571 4.364 20 0 HIADHN COCCN1CCC[C@H]1CNC(=O)Nc1ccccc1Oc1ccccc1Cl ZINC000521953193 929587311 /nfs/dbraw/zinc/58/73/11/929587311.db2.gz UPYOJFCMMZJDGG-INIZCTEOSA-N 0 3 403.910 4.365 20 0 HIADHN O=C([C@H]1CCCN(Cc2cccc(F)c2)C1)N(Cc1ccccc1)CC1CCOCC1 ZINC000521981019 929609590 /nfs/dbraw/zinc/60/95/90/929609590.db2.gz JOVKGTNIBJHDEB-DEOSSOPVSA-N 0 3 424.560 4.493 20 0 HIADHN O=C(NC[C@H]1CCCN1Cc1ccccc1)Nc1cccc(C(=O)N2CCCCC2)c1 ZINC000524484356 929632667 /nfs/dbraw/zinc/63/26/67/929632667.db2.gz VRRAONVKLJKHIT-HSZRJFAPSA-N 0 3 420.557 4.099 20 0 HIADHN CCN(C(=O)N[C@@H]1CCN(C2CC2)C1)[C@H]1CCSc2ccc(Br)cc21 ZINC000524493564 929642117 /nfs/dbraw/zinc/64/21/17/929642117.db2.gz ZICOVQYZFSSCMN-PBHICJAKSA-N 0 3 424.408 4.254 20 0 HIADHN CC(C)c1nc(C(=O)N2C[C@@H]3CCCN3Cc3ccccc32)nn1-c1cccc(F)c1 ZINC000524556051 929685287 /nfs/dbraw/zinc/68/52/87/929685287.db2.gz MJVVSXNXSYFYDW-FQEVSTJZSA-N 0 3 419.504 4.155 20 0 HIADHN COCCN1CC[C@@H](NC(=O)N[C@@H](C)c2ccccc2-c2ccc(Cl)cc2)C1 ZINC000524605418 929715206 /nfs/dbraw/zinc/71/52/06/929715206.db2.gz YJKSMMAZALFOGS-QFBILLFUSA-N 0 3 401.938 4.088 20 0 HIADHN CCCN(CC(=O)Nc1cccc(NC(C)=O)c1)[C@@H]1C[C@H](OCC)C12CCCC2 ZINC000524619708 929728130 /nfs/dbraw/zinc/72/81/30/929728130.db2.gz FVSXRFOIWWLGRA-RTWAWAEBSA-N 0 3 401.551 4.033 20 0 HIADHN O=C(CCN1CCc2c(cccc2NC(=O)Nc2ccc(F)cc2)C1)NC1CCCC1 ZINC000524682273 929795139 /nfs/dbraw/zinc/79/51/39/929795139.db2.gz SIWTXSPGIZEHHL-UHFFFAOYSA-N 0 3 424.520 4.277 20 0 HIADHN CN(C(=O)[C@@H](Oc1ccc(F)c(Cl)c1)c1ccccc1)[C@H]1CCN(C2CC2)C1 ZINC000524694264 929802279 /nfs/dbraw/zinc/80/22/79/929802279.db2.gz FYAQTZRROCLTAR-UWJYYQICSA-N 0 3 402.897 4.294 20 0 HIADHN Cc1cc(NC(=O)c2ccc(F)cc2Cl)sc1C(=O)NCCN1CC[C@H](C)C1 ZINC000524719383 929809411 /nfs/dbraw/zinc/80/94/11/929809411.db2.gz KDMYNNDECPSRJK-LBPRGKRZSA-N 0 3 423.941 4.173 20 0 HIADHN Cc1cccc(NC(=O)NCCCN2CCN(C)C[C@@H]2c2ccccc2)c1Cl ZINC000524795787 929831492 /nfs/dbraw/zinc/83/14/92/929831492.db2.gz KQDLEPDZMRSPRW-HXUWFJFHSA-N 0 3 400.954 4.149 20 0 HIADHN O=C(Cc1ccc2ccccc2c1)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000524816496 929841271 /nfs/dbraw/zinc/84/12/71/929841271.db2.gz RMKVVRCYOZSBFZ-UHFFFAOYSA-N 0 3 406.501 4.181 20 0 HIADHN Cc1ccc(C(=O)N[C@H](CN2CCCC2)c2ccccc2)cc1NC(=O)NC(C)(C)C ZINC000524853773 929859256 /nfs/dbraw/zinc/85/92/56/929859256.db2.gz IOTUZYPYBRWPLI-JOCHJYFZSA-N 0 3 422.573 4.482 20 0 HIADHN CCCN(Cc1ccc(OC)c(OC)c1Br)[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC000524908107 929883914 /nfs/dbraw/zinc/88/39/14/929883914.db2.gz NHPDEAQZCHJPKN-KYNGSXCRSA-N 0 3 412.368 4.492 20 0 HIADHN CN(C)Cc1cccc(C(=O)N(C)CC2(c3ccc(Br)cc3)CC2)c1 ZINC000524969887 929934692 /nfs/dbraw/zinc/93/46/92/929934692.db2.gz UVOKUYMRZRYAAK-UHFFFAOYSA-N 0 3 401.348 4.315 20 0 HIADHN C[C@@H](O)CN(Cc1ccccc1)C(=O)NC[C@@H](c1ccccc1)N1CCC(C)CC1 ZINC000524981300 929946189 /nfs/dbraw/zinc/94/61/89/929946189.db2.gz QCBWFDBAVBAJKZ-QPPBQGQZSA-N 0 3 409.574 4.052 20 0 HIADHN CN(C(=O)c1cccc(Sc2cccc(Br)c2)n1)C1CCN(C)CC1 ZINC000525010894 929972548 /nfs/dbraw/zinc/97/25/48/929972548.db2.gz OJFFOWJZXGWVGL-UHFFFAOYSA-N 0 3 420.376 4.162 20 0 HIADHN CCc1nc(C)c([C@@H](C)N(C)C(=O)CCCN2CCN(c3ccccc3)CC2)s1 ZINC000525048571 930002327 /nfs/dbraw/zinc/00/23/27/930002327.db2.gz XHXVSKBLUAJINH-LJQANCHMSA-N 0 3 414.619 4.136 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)C[C@H]2CCCc3ccccc32)cc1)[C@H]1CCCN(C)C1 ZINC000525065778 930013510 /nfs/dbraw/zinc/01/35/10/930013510.db2.gz TUYUDZWJHDHPLZ-GGAORHGYSA-N 0 3 419.569 4.302 20 0 HIADHN COc1ccc(C[C@H](C)NC(=O)[C@@H](C)N2CCC(Cc3ccccc3)CC2)cc1OC ZINC000525088166 930027066 /nfs/dbraw/zinc/02/70/66/930027066.db2.gz IADAMCZERDFQBJ-VQTJNVASSA-N 0 3 424.585 4.094 20 0 HIADHN C[C@@H]1CN(C(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)C[C@H](c2ccc(F)cc2)O1 ZINC000525095993 930032079 /nfs/dbraw/zinc/03/20/79/930032079.db2.gz OKAWYIPHCORQAH-DHJUGAMNSA-N 0 3 414.496 4.165 20 0 HIADHN CCN(Cc1ccc(OC)c(OC)c1)C(=O)CN1CC[C@@H](c2ccccc2)[C@H](C)C1 ZINC000525122236 930049014 /nfs/dbraw/zinc/04/90/14/930049014.db2.gz BRDIZYVJZGOWHZ-DENIHFKCSA-N 0 3 410.558 4.178 20 0 HIADHN Cc1ccc(Oc2ccc(NC(=O)[C@@]3(O)CCN(Cc4ccccc4)C3)cn2)cc1C ZINC000525176881 930076987 /nfs/dbraw/zinc/07/69/87/930076987.db2.gz RMCCOISPLZBPJY-RUZDIDTESA-N 0 3 417.509 4.066 20 0 HIADHN CSc1ccc([C@@H](CNCc2ccc(CO)o2)N2CCc3sccc3C2)cc1 ZINC000525180816 930077564 /nfs/dbraw/zinc/07/75/64/930077564.db2.gz QXXOTUQVJGITRN-OAQYLSRUSA-N 0 3 414.596 4.445 20 0 HIADHN CC(C)(C)OC(=O)CCNCc1cc(Br)ccc1OCc1ccccn1 ZINC000525183953 930079599 /nfs/dbraw/zinc/07/95/99/930079599.db2.gz RKIVROCSIIXTSS-UHFFFAOYSA-N 0 3 421.335 4.245 20 0 HIADHN COc1ccccc1-c1ccc(CNCc2ccc(C(=O)N3CCOCC3)cc2)cc1 ZINC000525190110 930081232 /nfs/dbraw/zinc/08/12/32/930081232.db2.gz JNVAMYYKPIZZTN-UHFFFAOYSA-N 0 3 416.521 4.124 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)COc3cc(Cl)cc(Cl)c3)c(C)c2)CC1 ZINC000525199238 930084193 /nfs/dbraw/zinc/08/41/93/930084193.db2.gz HPUWXEKCTWVQED-UHFFFAOYSA-N 0 3 422.356 4.461 20 0 HIADHN CC(C)(C)OC(=O)Cc1cccc(NC(=O)NC[C@@H]2CCCN2Cc2ccccc2)c1 ZINC000525227645 930094041 /nfs/dbraw/zinc/09/40/41/930094041.db2.gz ALLURQSZAOOMBS-QFIPXVFZSA-N 0 3 423.557 4.357 20 0 HIADHN C[NH+](C)Cc1c2ccccc2oc1C(=O)[N-]c1nnc(Cc2ccc(F)cc2)s1 ZINC000525243217 930102395 /nfs/dbraw/zinc/10/23/95/930102395.db2.gz YNRZDBSRDFLCKJ-UHFFFAOYSA-N 0 3 410.474 4.328 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)Nc1ccc(Cl)c(C[S@@](C)=O)c1 ZINC000525250444 930106516 /nfs/dbraw/zinc/10/65/16/930106516.db2.gz LPSWJOBMGQFOCS-HHHXNRCGSA-N 0 3 404.919 4.279 20 0 HIADHN CCCN(C(=O)NCc1ccccc1NC(C)=O)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000525305953 930146317 /nfs/dbraw/zinc/14/63/17/930146317.db2.gz OVDJFJRNHOQAMQ-HSZRJFAPSA-N 0 3 422.573 4.231 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3cccc(OCC(F)(F)F)c3)cc2)CC1 ZINC000525333902 930169363 /nfs/dbraw/zinc/16/93/63/930169363.db2.gz JYARZWFVRLEESX-UHFFFAOYSA-N 0 3 407.436 4.022 20 0 HIADHN CSc1ccc(O[C@H](C)C(=O)N(CCN(C)C)Cc2ccc(F)cc2F)cc1 ZINC000525350429 930189683 /nfs/dbraw/zinc/18/96/83/930189683.db2.gz OVPXORGHTXGFAC-OAHLLOKOSA-N 0 3 408.514 4.044 20 0 HIADHN CSc1ccc(O[C@H](C)C(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)cc1 ZINC000525370777 930202350 /nfs/dbraw/zinc/20/23/50/930202350.db2.gz PODHMBMEMHSVDJ-OAHLLOKOSA-N 0 3 408.514 4.044 20 0 HIADHN C[C@@H]1C[C@@H]1C(=O)Nc1ccc(C(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)cc1 ZINC000525384202 930211581 /nfs/dbraw/zinc/21/15/81/930211581.db2.gz UDVXXQQAWPPKRA-PWHSHALESA-N 0 3 405.542 4.018 20 0 HIADHN COCCn1cc(C(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)c2ccccc21 ZINC000525391821 930214170 /nfs/dbraw/zinc/21/41/70/930214170.db2.gz CMVWNMILAGCOOS-HXUWFJFHSA-N 0 3 405.542 4.024 20 0 HIADHN Cc1ccc(OCCCCNC(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)cc1 ZINC000525421213 930231512 /nfs/dbraw/zinc/23/15/12/930231512.db2.gz JXFZBRFNTSXLHS-JOCHJYFZSA-N 0 3 409.574 4.460 20 0 HIADHN C[C@H](CN1CCC[C@H](C)C1)NC(=O)C(=O)Nc1cccc(CSC2CCCC2)c1 ZINC000525434781 930238107 /nfs/dbraw/zinc/23/81/07/930238107.db2.gz TZBPBBTXRMNYTP-ZWKOTPCHSA-N 0 3 417.619 4.038 20 0 HIADHN Cc1cccc2[nH]cc(CCNC(=O)N3CCCN(Cc4ccccc4)C[C@H]3C)c21 ZINC000525437334 930239709 /nfs/dbraw/zinc/23/97/09/930239709.db2.gz KLKBYBARNUJLBE-HXUWFJFHSA-N 0 3 404.558 4.325 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)Nc1ccccc1OCC1CC1 ZINC000525450303 930248124 /nfs/dbraw/zinc/24/81/24/930248124.db2.gz ACAHTKFJURAUKD-UHFFFAOYSA-N 0 3 403.473 4.349 20 0 HIADHN COc1cccc([C@@H](CNC(=O)NC2(c3cccc(Cl)c3)CC2)N2CCCC2)c1 ZINC000525451844 930248872 /nfs/dbraw/zinc/24/88/72/930248872.db2.gz ARHGLMGUSBQEIK-OAQYLSRUSA-N 0 3 413.949 4.474 20 0 HIADHN CCN1CCCN(C(=O)c2cc(-c3ccccc3C)nc3c2cnn3C(C)C)CC1 ZINC000525499527 930285721 /nfs/dbraw/zinc/28/57/21/930285721.db2.gz NQBRJZIKXGQPPD-UHFFFAOYSA-N 0 3 405.546 4.155 20 0 HIADHN CC(C)C(=O)Nc1ccc(Cl)c(C(=O)NC[C@@H]2CCCN2Cc2ccccc2)c1 ZINC000525499972 930286080 /nfs/dbraw/zinc/28/60/80/930286080.db2.gz JQEIIPHOUBYALF-IBGZPJMESA-N 0 3 413.949 4.329 20 0 HIADHN CN(C(=O)c1ccc(Oc2cccc(Br)c2)cc1)[C@@H]1CCCN(C)C1 ZINC000525525916 930302611 /nfs/dbraw/zinc/30/26/11/930302611.db2.gz JGDVRSFHLLORDR-QGZVFWFLSA-N 0 3 403.320 4.408 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2cc3sccc3s2)cc1)[C@H]1CCCN(C)C1 ZINC000525580162 930342694 /nfs/dbraw/zinc/34/26/94/930342694.db2.gz DDSAUQNTQLGWGO-INIZCTEOSA-N 0 3 413.568 4.381 20 0 HIADHN COc1ccc(Br)cc1C(=O)N[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000525583318 930345016 /nfs/dbraw/zinc/34/50/16/930345016.db2.gz SQBKLYYGJUFDIN-PBHICJAKSA-N 0 3 403.320 4.023 20 0 HIADHN Cc1ccccc1[C@@H](C)CC(=O)Nc1ccc(C(=O)N(C)[C@@H]2CCCN(C)C2)cc1 ZINC000525612145 930362117 /nfs/dbraw/zinc/36/21/17/930362117.db2.gz GNWHEMPZVKRUNN-SIKLNZKXSA-N 0 3 407.558 4.294 20 0 HIADHN Cc1ccc(-c2nn(-c3ccc(F)cc3)cc2C(=O)N(C)[C@H]2CCCN(C)C2)cc1 ZINC000525618164 930364643 /nfs/dbraw/zinc/36/46/43/930364643.db2.gz LWETXVQAKVUTHT-NRFANRHFSA-N 0 3 406.505 4.153 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)cc1CN[C@@H](C)[C@@H]1CN(Cc2ccccc2)CCO1 ZINC000525697252 930408102 /nfs/dbraw/zinc/40/81/02/930408102.db2.gz TWTCQIKJUNVETJ-CYFREDJKSA-N 0 3 424.976 4.213 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(NC(=O)C2CC2)cc1)C(=O)N1CCSc2ccccc21 ZINC000525761770 930435071 /nfs/dbraw/zinc/43/50/71/930435071.db2.gz FCRCRRVTWIALAL-HOTGVXAUSA-N 0 3 409.555 4.213 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(NC(=O)C2CC2)cc1)C(=O)N1CCSc2ccccc21 ZINC000525761772 930435247 /nfs/dbraw/zinc/43/52/47/930435247.db2.gz FCRCRRVTWIALAL-JKSUJKDBSA-N 0 3 409.555 4.213 20 0 HIADHN CN(C(=O)NCc1ccc2ccccc2c1)C1CCN(CCc2ccccn2)CC1 ZINC000525820263 930455810 /nfs/dbraw/zinc/45/58/10/930455810.db2.gz JSDYOEUUVFUBDD-UHFFFAOYSA-N 0 3 402.542 4.083 20 0 HIADHN C[C@H](CN[C@@H](C(N)=O)c1ccc(Br)cc1)c1ccc(C(F)(F)F)cc1 ZINC000525951890 930492629 /nfs/dbraw/zinc/49/26/29/930492629.db2.gz ISLHTVOLDINLFQ-BDJLRTHQSA-N 0 3 415.253 4.388 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3ccc(SC)o3)c(OCC)c2)CC1 ZINC000526069769 930519417 /nfs/dbraw/zinc/51/94/17/930519417.db2.gz OYKLRHQVYPBNRU-UHFFFAOYSA-N 0 3 403.548 4.185 20 0 HIADHN O=C1[C@H](N[C@@H](c2cccnc2)C2CC2)CCCN1Cc1cccc(C(F)(F)F)c1 ZINC000526083844 930522873 /nfs/dbraw/zinc/52/28/73/930522873.db2.gz IMUMYNFMQKHULE-WOJBJXKFSA-N 0 3 403.448 4.332 20 0 HIADHN Cc1ccc2c(CCNC(=O)N(CCN(C)C)Cc3ccc(F)cc3F)c[nH]c2c1 ZINC000526213167 930542768 /nfs/dbraw/zinc/54/27/68/930542768.db2.gz ALWPBVAGHJSQEW-UHFFFAOYSA-N 0 3 414.500 4.070 20 0 HIADHN COc1ccc([C@@H](C)NCc2ccc3c(c2)sc(=O)n3C)cc1Br ZINC000526974329 930560335 /nfs/dbraw/zinc/56/03/35/930560335.db2.gz ZTRVHMQDUZYICT-LLVKDONJSA-N 0 3 407.333 4.222 20 0 HIADHN C[C@@H](NCc1ccc2c(c1)sc(=O)n2C)c1cccc(OCc2ccccn2)c1 ZINC000526981038 930561152 /nfs/dbraw/zinc/56/11/52/930561152.db2.gz NIFPSYKQXJBSAM-MRXNPFEDSA-N 0 3 405.523 4.425 20 0 HIADHN CCCCOc1ccc(CNC(=O)[C@H]2CCCN(Cc3cccnc3)C2)cc1Cl ZINC000527053359 930575851 /nfs/dbraw/zinc/57/58/51/930575851.db2.gz FMILSDYMMDZOKI-FQEVSTJZSA-N 0 3 415.965 4.442 20 0 HIADHN COCC(=O)Nc1cccc(CN[C@H](c2ccc(Br)s2)C2CC2)c1 ZINC000527123313 930596832 /nfs/dbraw/zinc/59/68/32/930596832.db2.gz PVDGHTKGWLFXIE-SFHVURJKSA-N 0 3 409.349 4.336 20 0 HIADHN Cc1cc(N2CCC[C@@H](N[C@@H](c3cccnc3)C3CC3)C2=O)ccc1Br ZINC000527326330 930634385 /nfs/dbraw/zinc/63/43/85/930634385.db2.gz YOYACJKIEVNLGX-WOJBJXKFSA-N 0 3 414.347 4.389 20 0 HIADHN CNC(=O)c1ccc(CN[C@H](c2ccc(F)c(F)c2)C(C)(C)N2CCCC2)cc1 ZINC000527504421 930671007 /nfs/dbraw/zinc/67/10/07/930671007.db2.gz GLLVWEICMFBHLY-OAQYLSRUSA-N 0 3 401.501 4.030 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)CO[C@@H]3CCC[C@@H](C)C3)c(OCC)c2)CC1 ZINC000530348029 930688844 /nfs/dbraw/zinc/68/88/44/930688844.db2.gz CFTWTPDKVBHEPY-TZIWHRDSSA-N 0 3 417.594 4.151 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2cccc(CC(=O)OC(C)(C)C)c2)[C@H]1c1ccccc1 ZINC000530354182 930690804 /nfs/dbraw/zinc/69/08/04/930690804.db2.gz XFMGCGLEXIMKCN-IFMALSPDSA-N 0 3 409.530 4.138 20 0 HIADHN Cc1cc(NC(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)ccc1NC(=O)c1ccco1 ZINC000530409816 930705015 /nfs/dbraw/zinc/70/50/15/930705015.db2.gz OQSALKOHNMJQIR-UNMCSNQZSA-N 0 3 418.497 4.407 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)Nc1cnn(Cc2ccc(Cl)cc2)c1 ZINC000530605868 930769514 /nfs/dbraw/zinc/76/95/14/930769514.db2.gz BGNSDTRSXIQHDS-UHFFFAOYSA-N 0 3 411.937 4.181 20 0 HIADHN CN(C)Cc1ccc(-c2noc(/C=C\c3ccc(I)o3)n2)cc1 ZINC000530632796 930780148 /nfs/dbraw/zinc/78/01/48/930780148.db2.gz LRHAHFTZMXXXKO-NTMALXAHSA-N 0 3 421.238 4.166 20 0 HIADHN Cc1c(-c2nc(-c3ccc(CN(C)C)cc3)no2)nnn1-c1ccc(OC(C)C)cc1 ZINC000530632265 930780392 /nfs/dbraw/zinc/78/03/92/930780392.db2.gz IQQXRFZSPCEKCZ-UHFFFAOYSA-N 0 3 418.501 4.142 20 0 HIADHN C[C@@H](CNC(=O)C(=O)Nc1ccc([C@H](C)Sc2ccccc2)cc1)N1CCCC1 ZINC000530746913 930815487 /nfs/dbraw/zinc/81/54/87/930815487.db2.gz LYIYRRIIXVIUDX-ROUUACIJSA-N 0 3 411.571 4.079 20 0 HIADHN O=C(CC1(N2CCOCC2)CCCC1)Nc1ccc(OCc2ccccc2F)cc1 ZINC000530818298 930831091 /nfs/dbraw/zinc/83/10/91/930831091.db2.gz KVMZFGJOWRLEES-UHFFFAOYSA-N 0 3 412.505 4.378 20 0 HIADHN COc1ccc(-n2ccnc2SCc2nc(-c3ccc(CN(C)C)cc3)no2)cc1 ZINC000530871825 930844717 /nfs/dbraw/zinc/84/47/17/930844717.db2.gz BPDLUKOFRQVBET-UHFFFAOYSA-N 0 3 421.526 4.285 20 0 HIADHN CN(C)Cc1ccc(-c2noc(C[C@@H]3Sc4ccc(Cl)cc4NC3=O)n2)cc1 ZINC000530871848 930844875 /nfs/dbraw/zinc/84/48/75/930844875.db2.gz HRGZDARCTLYQHO-KRWDZBQOSA-N 0 3 414.918 4.107 20 0 HIADHN O=C([C@H]1CC12CCOCC2)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000530906798 930855321 /nfs/dbraw/zinc/85/53/21/930855321.db2.gz FIVLYZCROAAKLR-QGZVFWFLSA-N 0 3 411.373 4.235 20 0 HIADHN CCC[C@H](N[C@H](C)CC(=O)Nc1ccccc1)C(=O)Nc1cccc(N2CCCC2)c1 ZINC000530907398 930855975 /nfs/dbraw/zinc/85/59/75/930855975.db2.gz JYIVOIYWEYATOV-XXBNENTESA-N 0 3 422.573 4.401 20 0 HIADHN CCN(CC)C(=O)c1cccc(NC(=O)[C@H](C)N[C@H](C)[C@H]2Oc3ccccc3[C@@H]2C)c1 ZINC000530972900 930872527 /nfs/dbraw/zinc/87/25/27/930872527.db2.gz KCKGDPOGFXDUBR-FXKZBUDASA-N 0 3 423.557 4.038 20 0 HIADHN CC(C)(C)N1CCCN(C(=O)c2ccc(NC(=O)Nc3ccccc3)s2)CC1 ZINC000531100901 930919917 /nfs/dbraw/zinc/91/99/17/930919917.db2.gz OMPIBYGSFHZSKH-UHFFFAOYSA-N 0 3 400.548 4.339 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)CCC(=O)c3ccc(Cl)cc3)CC2)C[C@H](C)O1 ZINC000531178949 930954378 /nfs/dbraw/zinc/95/43/78/930954378.db2.gz AMKLPBLHAFKEGS-HDICACEKSA-N 0 3 420.981 4.041 20 0 HIADHN COc1ccc(-c2nc(C)c(C(=O)N(CCN(C)C)Cc3cccs3)s2)cc1 ZINC000531217451 930970464 /nfs/dbraw/zinc/97/04/64/930970464.db2.gz ZOPSLUAVDHEBPW-UHFFFAOYSA-N 0 3 415.584 4.393 20 0 HIADHN Cc1sc([C@H](C)NC(=O)N[C@@H]2CCN(C3CC3)C2)nc1-c1ccc(Cl)cc1 ZINC000531263616 930988186 /nfs/dbraw/zinc/98/81/86/930988186.db2.gz YHXLSVOVSHFYNE-BLLLJJGKSA-N 0 3 404.967 4.369 20 0 HIADHN CCNC(=O)COc1ccc(CN[C@H](C)c2ccc(-c3cccnc3)cc2)cc1OC ZINC000531346824 931025485 /nfs/dbraw/zinc/02/54/85/931025485.db2.gz DCGOAXSMIFUGQU-GOSISDBHSA-N 0 3 419.525 4.123 20 0 HIADHN CSc1cccc(N2C[C@@H](c3nc(-c4ccc(CN(C)C)cc4)no3)CC2=O)c1 ZINC000531348706 931026567 /nfs/dbraw/zinc/02/65/67/931026567.db2.gz REQFQIKKKSEOAN-KRWDZBQOSA-N 0 3 408.527 4.041 20 0 HIADHN CCc1nc(-c2nc(-c3ccc(CN(C)C)cc3)no2)nn1-c1ccccc1Cl ZINC000531348464 931026806 /nfs/dbraw/zinc/02/68/06/931026806.db2.gz GSWLCZNTUYWKIJ-UHFFFAOYSA-N 0 3 408.893 4.262 20 0 HIADHN CSc1cccc(N2C[C@H](c3nc(-c4ccc(CN(C)C)cc4)no3)CC2=O)c1 ZINC000531348707 931026869 /nfs/dbraw/zinc/02/68/69/931026869.db2.gz REQFQIKKKSEOAN-QGZVFWFLSA-N 0 3 408.527 4.041 20 0 HIADHN C[C@@H](O)C[C@H](CNCc1nc(-c2cccc(Br)c2)c[nH]1)c1ccccc1 ZINC000531582088 931108816 /nfs/dbraw/zinc/10/88/16/931108816.db2.gz WIMZRZGLSPIIBP-CRAIPNDOSA-N 0 3 414.347 4.484 20 0 HIADHN CC[C@H](NCc1ccc(OCCN2CCOCC2)c(Cl)c1)c1ccc(OC)cc1 ZINC000531583785 931110513 /nfs/dbraw/zinc/11/05/13/931110513.db2.gz FKTBUWHQMSMUDR-QFIPXVFZSA-N 0 3 418.965 4.301 20 0 HIADHN CC(C)(C)OC(=O)C[C@@H]1CCCN(CCc2nc(-c3ccc(Cl)cc3)no2)C1 ZINC000531614932 931128581 /nfs/dbraw/zinc/12/85/81/931128581.db2.gz KTHZCBHOGXLFGG-HNNXBMFYSA-N 0 3 405.926 4.376 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@@H](C)N[C@H]2CCCc3cc(OC)ccc32)cc1 ZINC000531676683 931148021 /nfs/dbraw/zinc/14/80/21/931148021.db2.gz IPGISOBNJHGNFW-HXOBKFHXSA-N 0 3 416.587 4.454 20 0 HIADHN CC[C@@H](C)NC(=O)c1cccc(CN[C@H](C)c2ccc(OCc3nccn3C)cc2)c1 ZINC000531682136 931151075 /nfs/dbraw/zinc/15/10/75/931151075.db2.gz NLLILKOVBYWYSB-RTBURBONSA-N 0 3 420.557 4.378 20 0 HIADHN C[C@@H](NCc1cccc(NC(=O)c2ccccn2)c1)c1ccc2c(c1)CCC(=O)N2 ZINC000531684207 931151568 /nfs/dbraw/zinc/15/15/68/931151568.db2.gz XZIWRVULUCYSMR-MRXNPFEDSA-N 0 3 400.482 4.069 20 0 HIADHN COc1cc(CN[C@H](C)c2ccc([S@@](C)=O)cc2)ccc1OCC(F)(F)F ZINC000531690870 931155084 /nfs/dbraw/zinc/15/50/84/931155084.db2.gz BIPGALCVLVBIIX-PFUSGODGSA-N 0 3 401.450 4.225 20 0 HIADHN C[C@H](NCc1ccc(C(=O)N2CCOCC2)cc1)c1cccc(-c2ccncc2)c1 ZINC000531698706 931162225 /nfs/dbraw/zinc/16/22/25/931162225.db2.gz PJDLPHYENFFQHU-IBGZPJMESA-N 0 3 401.510 4.072 20 0 HIADHN C[C@@H](CC(=O)Nc1ccccc1C(F)(F)F)N[C@@H]1CCCN(c2ccccc2)C1=O ZINC000531711488 931170152 /nfs/dbraw/zinc/17/01/52/931170152.db2.gz JLQRQTMXYBNANS-HNAYVOBHSA-N 0 3 419.447 4.208 20 0 HIADHN C[C@H](N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1)c1ccc2c(c1)OCCO2 ZINC000531715518 931171534 /nfs/dbraw/zinc/17/15/34/931171534.db2.gz SLKSHHFABGCSIL-AVRDEDQJSA-N 0 3 402.494 4.358 20 0 HIADHN COc1ccc([C@H](C)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2=O)cc1OC ZINC000531724077 931174170 /nfs/dbraw/zinc/17/41/70/931174170.db2.gz REVCEKZJTWRBHV-KBXCAEBGSA-N 0 3 420.456 4.151 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(NC(=O)C2CC2)cc1)C(=O)N1c2ccccc2CC[C@H]1C ZINC000531752507 931183176 /nfs/dbraw/zinc/18/31/76/931183176.db2.gz JRRQXNDHDGLHHB-SQNIBIBYSA-N 0 3 405.542 4.442 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)N1c2ccccc2CC[C@@H]1C)c1ccc(NC(=O)C2CC2)cc1 ZINC000531752505 931183327 /nfs/dbraw/zinc/18/33/27/931183327.db2.gz JRRQXNDHDGLHHB-KSZLIROESA-N 0 3 405.542 4.442 20 0 HIADHN CCS(=O)(=O)c1ccc(N2CCC(NCc3ccc(F)cc3Cl)CC2)cc1 ZINC000531754383 931183375 /nfs/dbraw/zinc/18/33/75/931183375.db2.gz JJTUWRHXECNWSL-UHFFFAOYSA-N 0 3 410.942 4.031 20 0 HIADHN Cc1noc(-c2ccc(C)c(NC(=O)N[C@H]3C[C@H](C)N(Cc4ccccc4)C3)c2)n1 ZINC000531812329 931206471 /nfs/dbraw/zinc/20/64/71/931206471.db2.gz JMJUCFJZKHQIJV-JXFKEZNVSA-N 0 3 405.502 4.138 20 0 HIADHN CC(C)c1ccc([C@@H](NC(=O)N2CC[C@H](N3CCN(C(C)C)CC3)C2)C(C)C)cc1 ZINC000531839050 931215112 /nfs/dbraw/zinc/21/51/12/931215112.db2.gz MENNKDJOJOATQQ-ZEQRLZLVSA-N 0 3 414.638 4.317 20 0 HIADHN COc1cccc(-c2nn(C(C)(C)C)cc2CNCc2ccc(NC(N)=O)cc2)c1 ZINC000531850444 931221148 /nfs/dbraw/zinc/22/11/48/931221148.db2.gz BSYKZPZJUUZPEK-UHFFFAOYSA-N 0 3 407.518 4.094 20 0 HIADHN CCOC(=O)C1CCN(C(=O)CN[C@@H](c2cccc(Cl)c2)C2CCCCC2)CC1 ZINC000531859214 931224462 /nfs/dbraw/zinc/22/44/62/931224462.db2.gz KIOTWAPZWBRDFM-JOCHJYFZSA-N 0 3 420.981 4.353 20 0 HIADHN C[C@H](NCc1cccc(Cl)c1)c1ccc(S(=O)(=O)NCc2ccco2)cc1 ZINC000531932652 931251104 /nfs/dbraw/zinc/25/11/04/931251104.db2.gz NXCHWWFQUMOAPS-HNNXBMFYSA-N 0 3 404.919 4.262 20 0 HIADHN C[C@@H](NC[C@@H](c1cccs1)N1CCOCC1)c1sccc1Br ZINC000531931954 931251146 /nfs/dbraw/zinc/25/11/46/931251146.db2.gz XMSXZRWQPWVMPB-OCCSQVGLSA-N 0 3 401.395 4.296 20 0 HIADHN CC[C@H](N[C@H](C)c1ccc(-n2ccnc2C)cc1)c1ccccc1OCC(=O)N(C)C ZINC000531955572 931263487 /nfs/dbraw/zinc/26/34/87/931263487.db2.gz AJJZZPLAZUMDQF-JPYJTQIMSA-N 0 3 420.557 4.450 20 0 HIADHN COc1ccc(OC)c(NC(=O)C[C@@H](C)NCc2ccc(Oc3ccccc3)nc2)c1 ZINC000531963864 931267596 /nfs/dbraw/zinc/26/75/96/931267596.db2.gz GXAZFKUQXREODW-QGZVFWFLSA-N 0 3 421.497 4.398 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CCC[C@H]1c1cccc(C)n1)c1cccc(OC)c1 ZINC000531963194 931267863 /nfs/dbraw/zinc/26/78/63/931267863.db2.gz QFYNJYLNEOTDSX-GOTSBHOMSA-N 0 3 410.562 4.328 20 0 HIADHN COCCC[C@H](NCc1cnn(CC(F)(F)F)c1)c1ccc(Br)cc1 ZINC000531989013 931277135 /nfs/dbraw/zinc/27/71/35/931277135.db2.gz VLQIKKSVJZIAHD-INIZCTEOSA-N 0 3 420.273 4.465 20 0 HIADHN Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)NCc1ccc(N2CCN(C)CC2)nc1 ZINC000531989116 931277809 /nfs/dbraw/zinc/27/78/09/931277809.db2.gz DLLRWBUJYVXIHT-GOSISDBHSA-N 0 3 421.614 4.425 20 0 HIADHN Cc1nc(-c2ccccc2)sc1[C@H](C)NCc1ccc(N2CCN(C)CC2)nc1 ZINC000531989578 931278729 /nfs/dbraw/zinc/27/87/29/931278729.db2.gz NNJFBEHUOIVIGI-KRWDZBQOSA-N 0 3 407.587 4.116 20 0 HIADHN COc1ccc(CNC(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)c(C)c1 ZINC000532000414 931280981 /nfs/dbraw/zinc/28/09/81/931280981.db2.gz QSQLPGAUOGUZAH-UHFFFAOYSA-N 0 3 423.479 4.296 20 0 HIADHN COc1cccc(CN[C@@H]2CCN(c3ncc(C(F)(F)F)cc3Cl)C2)c1OC ZINC000532067034 931301930 /nfs/dbraw/zinc/30/19/30/931301930.db2.gz JHRHCLLLPQLMCZ-CQSZACIVSA-N 0 3 415.843 4.140 20 0 HIADHN Cc1nc2c(c(C(F)(F)F)n1)C[C@@H](c1nc(-c3ccc(CN(C)C)cc3)no1)CC2 ZINC000532079973 931304631 /nfs/dbraw/zinc/30/46/31/931304631.db2.gz AZEWNJZKWQTNRP-HNNXBMFYSA-N 0 3 417.435 4.188 20 0 HIADHN CN(C)Cc1cccc(C(=O)NCc2ccc(NC(=O)c3ccc(F)cc3)cc2)c1 ZINC000532082897 931305735 /nfs/dbraw/zinc/30/57/35/931305735.db2.gz JPGAUXPPSGKPHT-UHFFFAOYSA-N 0 3 405.473 4.070 20 0 HIADHN COc1cc(OC)cc(N2CCCN(Cc3ccc(SC)c(OC)c3)CC2)c1 ZINC000532090607 931308856 /nfs/dbraw/zinc/30/88/56/931308856.db2.gz KABUYBXOMVOOEY-UHFFFAOYSA-N 0 3 402.560 4.147 20 0 HIADHN Cc1c2ccc3ccccc3c2oc1C(=O)N1CC[C@@H](N2CCN(C(C)C)CC2)C1 ZINC000532093377 931309429 /nfs/dbraw/zinc/30/94/29/931309429.db2.gz FQUYFQLAPHCTEE-HXUWFJFHSA-N 0 3 405.542 4.135 20 0 HIADHN Clc1cc(CN[C@@H]2CCCOc3ccccc32)ccc1OCCN1CCOCC1 ZINC000532094306 931310042 /nfs/dbraw/zinc/31/00/42/931310042.db2.gz YATICRGYXMXUBT-OAQYLSRUSA-N 0 3 416.949 4.055 20 0 HIADHN CC(C)N1CCN([C@H]2CCN(C(=O)Nc3cccc(Oc4ccccc4)c3)C2)CC1 ZINC000532097470 931310572 /nfs/dbraw/zinc/31/05/72/931310572.db2.gz JMCQLXDKRBPWCX-NRFANRHFSA-N 0 3 408.546 4.111 20 0 HIADHN CC(C)N1CCN([C@@H]2CCN(C(=O)Nc3ccc4oc5ccccc5c4c3)C2)CC1 ZINC000532097524 931310961 /nfs/dbraw/zinc/31/09/61/931310961.db2.gz MRBNWPJFBGOMAK-LJQANCHMSA-N 0 3 406.530 4.218 20 0 HIADHN CC(C)N(C)S(=O)(=O)c1ccc(CNCc2ccc(Cl)c3cccnc23)cc1 ZINC000532112288 931317071 /nfs/dbraw/zinc/31/70/71/931317071.db2.gz PGYSUINOMAHRIS-UHFFFAOYSA-N 0 3 417.962 4.207 20 0 HIADHN CN1CCN(CCCCNC(=O)N[C@@H](c2cccc(Cl)c2)C2CCCCC2)CC1 ZINC000532118910 931319588 /nfs/dbraw/zinc/31/95/88/931319588.db2.gz DFEZLHNXKVBKRM-JOCHJYFZSA-N 0 3 421.029 4.288 20 0 HIADHN Cc1nn(-c2ccc(F)cc2F)c(C)c1CN[C@@H]1CCN(C(=O)C2CCCCC2)C1 ZINC000532120686 931321056 /nfs/dbraw/zinc/32/10/56/931321056.db2.gz XPJBVQZWRNOKIJ-LJQANCHMSA-N 0 3 416.516 4.038 20 0 HIADHN CC(C)(C)OC(=O)C[C@@H]1CCCN(C[C@@H](O)COc2c(Cl)cccc2Cl)C1 ZINC000532125177 931322884 /nfs/dbraw/zinc/32/28/84/931322884.db2.gz FXZHHMPVFJLAIX-LSDHHAIUSA-N 0 3 418.361 4.177 20 0 HIADHN C[C@@H]1C[C@H](c2ccccc2)CN1CC(=O)NCc1cccc(COCc2ccco2)c1 ZINC000532159887 931333208 /nfs/dbraw/zinc/33/32/08/931333208.db2.gz NZAWKACBWQYSGG-YKSBVNFPSA-N 0 3 418.537 4.491 20 0 HIADHN C[C@@H](N[C@H](C)c1cccc(N2CCCS2(=O)=O)c1)c1ccc(OC(F)F)cc1 ZINC000532197682 931345475 /nfs/dbraw/zinc/34/54/75/931345475.db2.gz XFTNNIPPIBZGAE-HUUCEWRRSA-N 0 3 410.486 4.240 20 0 HIADHN CC[C@@H](NC1CCN(C(=O)c2ccccc2Cl)CC1)c1nnc2n1CCCCC2 ZINC000532218439 931358052 /nfs/dbraw/zinc/35/80/52/931358052.db2.gz ZLUTWTUHEHYLID-LJQANCHMSA-N 0 3 415.969 4.003 20 0 HIADHN C[C@@H](NCc1ccc(NC(=O)c2ccncc2)cc1)c1ccc2c(c1)OCCCO2 ZINC000532219186 931358370 /nfs/dbraw/zinc/35/83/70/931358370.db2.gz GFOYGZCLJGMQRL-QGZVFWFLSA-N 0 3 403.482 4.346 20 0 HIADHN COc1ccc(CN[C@@H](C)CC(=O)Nc2cccc(C(F)(F)F)c2)cc1NC(C)=O ZINC000532219432 931358609 /nfs/dbraw/zinc/35/86/09/931358609.db2.gz XDFICWFWYJVYNM-ZDUSSCGKSA-N 0 3 423.435 4.179 20 0 HIADHN CCOc1ccc(Cl)cc1[C@@H](C)N[C@@H](CN1CCN(C)CC1)c1ccccc1 ZINC000532221238 931359013 /nfs/dbraw/zinc/35/90/13/931359013.db2.gz HIYCGAMGBPOAHT-GCJKJVERSA-N 0 3 401.982 4.378 20 0 HIADHN CC[C@H](N[C@H](CN1CCN(C)CC1)c1ccccc1)c1cc(Cl)ccc1OC ZINC000532221225 931359486 /nfs/dbraw/zinc/35/94/86/931359486.db2.gz DOKGDEJRDQIBTN-FCHUYYIVSA-N 0 3 401.982 4.378 20 0 HIADHN Cc1ccc(-c2ccc(C(=O)N3CC[C@@H](N4CCN(C(C)C)CC4)C3)c(F)c2)cc1C ZINC000532342885 931402611 /nfs/dbraw/zinc/40/26/11/931402611.db2.gz MYVQMRAKMMBOBX-HSZRJFAPSA-N 0 3 423.576 4.350 20 0 HIADHN Cc1cc(C(=O)N2CC[C@@H](N3CCN(C(C)C)CC3)C2)sc1-c1ccc(F)cc1 ZINC000532348462 931404577 /nfs/dbraw/zinc/40/45/77/931404577.db2.gz XVLNLZRBHTZGKR-HXUWFJFHSA-N 0 3 415.578 4.103 20 0 HIADHN CC(C)N(C)S(=O)(=O)c1ccc(CNCc2cc(Cl)cc3cccnc32)cc1 ZINC000532422915 931429621 /nfs/dbraw/zinc/42/96/21/931429621.db2.gz ROMMKZKSBJDJOA-UHFFFAOYSA-N 0 3 417.962 4.207 20 0 HIADHN CN1CCN(c2ccc(CN[C@@H]3CCCSc4ccc(Cl)cc43)cn2)CC1 ZINC000532451685 931440575 /nfs/dbraw/zinc/44/05/75/931440575.db2.gz HNKNOHJDMFIUOJ-LJQANCHMSA-N 0 3 402.995 4.204 20 0 HIADHN C[C@H](NCc1cccc(NC(=O)[C@@H]2CCCO2)c1)c1ccc(Br)cc1 ZINC000532465127 931446623 /nfs/dbraw/zinc/44/66/23/931446623.db2.gz IYHWRTOWTANGAG-LIRRHRJNSA-N 0 3 403.320 4.417 20 0 HIADHN O[C@@H](CN[C@H]1CCSc2c(F)cccc21)COc1cccc(C(F)(F)F)c1 ZINC000532465551 931447557 /nfs/dbraw/zinc/44/75/57/931447557.db2.gz UAKIVBXNTNZTOT-GUYCJALGSA-N 0 3 401.425 4.411 20 0 HIADHN COc1cc(CNC2(c3cccc(Cl)c3)CCCC2)cc(Cl)c1OCC(N)=O ZINC000532471186 931450239 /nfs/dbraw/zinc/45/02/39/931450239.db2.gz ZHYNMRDPIYZWDM-UHFFFAOYSA-N 0 3 423.340 4.425 20 0 HIADHN Cc1cc(CNCc2ccc(Cn3ccccc3=O)cc2)sc1Br ZINC000532479688 931454785 /nfs/dbraw/zinc/45/47/85/931454785.db2.gz LAVOCXOCIWFYAY-UHFFFAOYSA-N 0 3 403.345 4.319 20 0 HIADHN CC[C@@H](C(=O)N[C@H](C)c1sc(-c2ccc(Br)cc2)nc1C)N(C)C ZINC000532494184 931461076 /nfs/dbraw/zinc/46/10/76/931461076.db2.gz AFSVCJVIHOIYQX-ABAIWWIYSA-N 0 3 410.381 4.398 20 0 HIADHN C[C@H](N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)c1ccc(Br)cc1 ZINC000532494868 931461436 /nfs/dbraw/zinc/46/14/36/931461436.db2.gz TXHVBYVFVWETQQ-JXFKEZNVSA-N 0 3 401.348 4.333 20 0 HIADHN O[C@H](CNCc1ccc(F)cc1C(F)(F)F)COc1ccccc1Br ZINC000532496486 931461896 /nfs/dbraw/zinc/46/18/96/931461896.db2.gz YMAKDUJGRLYKGZ-CYBMUJFWSA-N 0 3 422.216 4.137 20 0 HIADHN COc1ccc(S(=O)(=O)[N-]c2cccc(C[NH2+][C@@H](C)Cc3ccsc3)c2)cc1 ZINC000532501240 931464599 /nfs/dbraw/zinc/46/45/99/931464599.db2.gz LEQQSMWOERZABG-INIZCTEOSA-N 0 3 416.568 4.278 20 0 HIADHN NC(=O)CC[C@H]1CCCN(Cc2c(-c3ccc(Cl)cc3)nc3sccn23)C1 ZINC000532524010 931474016 /nfs/dbraw/zinc/47/40/16/931474016.db2.gz DBXZPZHQNMPVJK-CQSZACIVSA-N 0 3 402.951 4.194 20 0 HIADHN COc1ccc([C@H](N[C@H](C)CCc2ccco2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000532531119 931512819 /nfs/dbraw/zinc/51/28/19/931512819.db2.gz OHUXYQNEKPSYKF-HXOBKFHXSA-N 0 3 413.539 4.392 20 0 HIADHN CC(C)(COc1ncccc1C(F)(F)F)NCc1ccc(Br)cn1 ZINC000532569988 931531082 /nfs/dbraw/zinc/53/10/82/931531082.db2.gz YGUJOMJODPSPFD-UHFFFAOYSA-N 0 3 404.230 4.205 20 0 HIADHN C[C@@H](CC(=O)Nc1cccc(N2CCCC2)c1)NCc1cc(-c2ccccc2)n[nH]1 ZINC000532618537 931555849 /nfs/dbraw/zinc/55/58/49/931555849.db2.gz KQZDEPBDQHZYRD-SFHVURJKSA-N 0 3 403.530 4.184 20 0 HIADHN CN(C)C(=O)c1cccc(CN2CCC[C@@H](c3nc(-c4ccc(Cl)cc4)no3)C2)c1 ZINC000532684153 931582816 /nfs/dbraw/zinc/58/28/16/931582816.db2.gz XEJZLJYYWUQXJX-LJQANCHMSA-N 0 3 424.932 4.471 20 0 HIADHN CN(C)C(=O)[C@@H](c1ccccc1)N1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1 ZINC000532685725 931584366 /nfs/dbraw/zinc/58/43/66/931584366.db2.gz KECYEFMGRQPZOA-AZUAARDMSA-N 0 3 424.932 4.399 20 0 HIADHN CCc1ccc([C@H](C)NC(=O)CNC2(c3ccc(Cl)cc3)CCOCC2)cc1 ZINC000532714521 931604671 /nfs/dbraw/zinc/60/46/71/931604671.db2.gz PPVHTGBVKDKANH-KRWDZBQOSA-N 0 3 400.950 4.375 20 0 HIADHN Cc1cccc(C)c1-n1nnnc1CNC(C)(C)Cc1ccc(Br)cc1 ZINC000532715302 931606508 /nfs/dbraw/zinc/60/65/08/931606508.db2.gz CDRCNPJIGKHURF-UHFFFAOYSA-N 0 3 414.351 4.153 20 0 HIADHN c1nc(C2CCCC2)sc1CNc1ccc2nc(CCN3CCOCC3)[nH]c2c1 ZINC000532729335 931614258 /nfs/dbraw/zinc/61/42/58/931614258.db2.gz RDEYAEWWMFWNLA-UHFFFAOYSA-N 0 3 411.575 4.164 20 0 HIADHN CNC(=O)c1ccc(CN2CCC(C(=O)Nc3ccc(Cl)c(Cl)c3)CC2)cc1 ZINC000532732211 931615990 /nfs/dbraw/zinc/61/59/90/931615990.db2.gz UWUNKZCKPAEPFH-UHFFFAOYSA-N 0 3 420.340 4.204 20 0 HIADHN CCc1ccccc1NC(=O)CN(CC)C1CCN(c2cc(C)nc(C(C)C)n2)CC1 ZINC000532733294 931616400 /nfs/dbraw/zinc/61/64/00/931616400.db2.gz TXJOCZLYUVHIPJ-UHFFFAOYSA-N 0 3 423.605 4.400 20 0 HIADHN CC(C)N1CCN([C@H]2CCN(C(=O)C(C)(C)c3ccc(-c4ccccc4)cc3)C2)CC1 ZINC000532783475 931630436 /nfs/dbraw/zinc/63/04/36/931630436.db2.gz OJQSAMLLNRISFJ-VWLOTQADSA-N 0 3 419.613 4.258 20 0 HIADHN C[C@H](Cc1cc(Br)ccc1F)NC(=O)Nc1cccc(CN(C)C)c1 ZINC000532843371 931654121 /nfs/dbraw/zinc/65/41/21/931654121.db2.gz GQBMBUBOEGHCMN-CYBMUJFWSA-N 0 3 408.315 4.403 20 0 HIADHN CCN(C(=O)c1cnc2c(C)cc(F)cc2c1O)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000532863928 931671033 /nfs/dbraw/zinc/67/10/33/931671033.db2.gz IWYCQHUEDFPHOM-YLJYHZDGSA-N 0 3 421.516 4.273 20 0 HIADHN CC(C)[C@@H](NCC(=O)NCc1ccccc1Cn1cccn1)c1ccc(Cl)cc1 ZINC000532902568 931685752 /nfs/dbraw/zinc/68/57/52/931685752.db2.gz DTTWKCBKBLTTOC-HSZRJFAPSA-N 0 3 410.949 4.188 20 0 HIADHN CC(C)Oc1cccc(CNC(=O)CNC2(c3ccc(Cl)cc3)CCOCC2)c1 ZINC000533064125 931760125 /nfs/dbraw/zinc/76/01/25/931760125.db2.gz XXPUOHKXVLWRGL-UHFFFAOYSA-N 0 3 416.949 4.039 20 0 HIADHN CN(C)[C@H](CNC(=O)N1CCC(Oc2ccccc2Cl)CC1)c1ccccc1 ZINC000533163642 931795857 /nfs/dbraw/zinc/79/58/57/931795857.db2.gz UDIOTINXSYQCNO-HXUWFJFHSA-N 0 3 401.938 4.196 20 0 HIADHN CN(CC(=O)Nc1cccc(CN2CCSCC2)c1)[C@@H]1CCCc2ccccc21 ZINC000533222044 931813544 /nfs/dbraw/zinc/81/35/44/931813544.db2.gz XMSKZNQRDWTKOX-HSZRJFAPSA-N 0 3 409.599 4.183 20 0 HIADHN CCN1CCCN(Cc2nc(=O)c3c(-c4ccccc4Cl)csc3[nH]2)CC1 ZINC000533264427 931823266 /nfs/dbraw/zinc/82/32/66/931823266.db2.gz IPSLYJKQLYPHPU-UHFFFAOYSA-N 0 3 402.951 4.245 20 0 HIADHN C[C@H](C(=O)N(C)Cc1ccccc1)N(C)CCCc1cc(-c2ccc(F)cc2)n[nH]1 ZINC000533266424 931823744 /nfs/dbraw/zinc/82/37/44/931823744.db2.gz DPDSBNJZMCIAQN-GOSISDBHSA-N 0 3 408.521 4.127 20 0 HIADHN O=C(NCc1ccccc1-c1ccc(Cn2ccnc2)cc1)c1cccc2nc[nH]c21 ZINC000533326571 931839219 /nfs/dbraw/zinc/83/92/19/931839219.db2.gz UPVSUNKEBIJUTK-UHFFFAOYSA-N 0 3 407.477 4.405 20 0 HIADHN COc1cc(C(C)=O)ccc1OC[C@H](O)CN(Cc1cccc(F)c1)C1CCCC1 ZINC000533349467 931845267 /nfs/dbraw/zinc/84/52/67/931845267.db2.gz DVHXZWHQCQMETN-JOCHJYFZSA-N 0 3 415.505 4.221 20 0 HIADHN Fc1ccc(-c2noc([C@@H]3CCCN(Cc4cnn(-c5ccccc5)c4)C3)n2)cc1 ZINC000533370034 931850769 /nfs/dbraw/zinc/85/07/69/931850769.db2.gz WGMPEMJEPHZQSD-LJQANCHMSA-N 0 3 403.461 4.441 20 0 HIADHN COc1cc2c(cc1OC)CN(C(=O)CN[C@H](c1ccccc1)C1CCCC1)CC2 ZINC000533384545 931854625 /nfs/dbraw/zinc/85/46/25/931854625.db2.gz GYDMGRVTEGDXRD-RUZDIDTESA-N 0 3 408.542 4.110 20 0 HIADHN CCCN(CC(=O)Nc1ccc2[nH]c(C(F)(F)F)nc2c1)[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000533430082 931866200 /nfs/dbraw/zinc/86/62/00/931866200.db2.gz WHRPKAFTJPAXRV-FSPWUOQZSA-N 0 3 424.467 4.046 20 0 HIADHN COc1cc(NC(=O)CCN2CCC[C@@H]2c2cccc(C)n2)c(OC)cc1Cl ZINC000533484038 931881012 /nfs/dbraw/zinc/88/10/12/931881012.db2.gz MTAPAMSFWGVMSO-GOSISDBHSA-N 0 3 403.910 4.226 20 0 HIADHN O=C(CNC1(c2ccccc2)CCOCC1)N[C@@H](c1cccs1)c1ccc(F)cc1 ZINC000533518466 931892319 /nfs/dbraw/zinc/89/23/19/931892319.db2.gz JAMQPCXNXXUGCO-HSZRJFAPSA-N 0 3 424.541 4.388 20 0 HIADHN C/C=C\c1ccc(OC[C@@H](O)CN2CCC(Nc3cccc(C)c3)CC2)c(OC)c1 ZINC000533530305 931895486 /nfs/dbraw/zinc/89/54/86/931895486.db2.gz KZRWXPLPUAQDNH-IUIUGSMNSA-N 0 3 410.558 4.353 20 0 HIADHN COc1cc(N[C@H]2CCCN(Cc3ccc(OC(F)F)c(OC)c3)C2)cc(OC)c1 ZINC000533536616 931896582 /nfs/dbraw/zinc/89/65/82/931896582.db2.gz LELWGGGZVBONFP-INIZCTEOSA-N 0 3 422.472 4.390 20 0 HIADHN CN1CCN([C@H](CNCc2ccc(-c3ccncc3)cc2F)c2cccs2)CC1 ZINC000533565143 931902719 /nfs/dbraw/zinc/90/27/19/931902719.db2.gz OZDDBZHLPQBELK-JOCHJYFZSA-N 0 3 410.562 4.028 20 0 HIADHN Cc1nc2ccccc2n1C[C@@H]1CCCN1CC(=O)N(C)[C@@H](C)c1ccc(F)cc1 ZINC000533760789 932016374 /nfs/dbraw/zinc/01/63/74/932016374.db2.gz HDJKJDNTFXOEIM-UWJYYQICSA-N 0 3 408.521 4.168 20 0 HIADHN Cc1cc(C)c(CC(C(=O)Nc2ccccc2S(C)(=O)=O)C(F)(F)F)c(C)c1 ZINC000533770941 932024211 /nfs/dbraw/zinc/02/42/11/932024211.db2.gz UPNARIQIURGKSE-INIZCTEOSA-N 0 3 413.461 4.375 20 0 HIADHN CN(C)[C@H](CNC(=O)Nc1cccc(NC(=O)c2cccs2)c1)Cc1ccccc1 ZINC000533808506 932041373 /nfs/dbraw/zinc/04/13/73/932041373.db2.gz GYKFUOAJEKBVLA-FQEVSTJZSA-N 0 3 422.554 4.295 20 0 HIADHN Cc1nc(-c2cccc(C)c2)[nH]c1C(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000533843847 932057519 /nfs/dbraw/zinc/05/75/19/932057519.db2.gz UQOPQWIFOALCQT-KDURUIRLSA-N 0 3 424.589 4.045 20 0 HIADHN CN1CC[C@H](NC(=O)NCc2nc3cc(Cl)ccc3s2)[C@@H]1c1ccccc1 ZINC000533893430 932085868 /nfs/dbraw/zinc/08/58/68/932085868.db2.gz XCAFVZXEWVSTEE-KXBFYZLASA-N 0 3 400.935 4.194 20 0 HIADHN COC(=O)c1ccccc1CCC(=O)NC[C@H](c1cccs1)N1CCC(C)CC1 ZINC000533923573 932102162 /nfs/dbraw/zinc/10/21/62/932102162.db2.gz PFXASXGLUADNHE-HXUWFJFHSA-N 0 3 414.571 4.057 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)C(=O)N1CCC[C@@H]1c1ccc(C(C)C)cc1 ZINC000533946352 932120741 /nfs/dbraw/zinc/12/07/41/932120741.db2.gz DXBFRRXPXBYGTC-JOCHJYFZSA-N 0 3 423.557 4.182 20 0 HIADHN CC(C)(C)[C@H](CN1CCc2ccccc2C1)NC(=O)N[C@H](c1cccnc1)C1CC1 ZINC000533967700 932143128 /nfs/dbraw/zinc/14/31/28/932143128.db2.gz YGKZEOVLECEYNZ-GOTSBHOMSA-N 0 3 406.574 4.305 20 0 HIADHN O=C(Nc1ccc2[nH]c(C(F)F)nc2c1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000533967842 932145621 /nfs/dbraw/zinc/14/56/21/932145621.db2.gz ZMGFYZXYLZECDD-CQSZACIVSA-N 0 3 402.420 4.490 20 0 HIADHN O=C(Nc1cccc2c1CN(c1nccs1)C2)N1CCN(C2CCCCC2)CC1 ZINC000534023299 932204745 /nfs/dbraw/zinc/20/47/45/932204745.db2.gz FSGWFEFZZLIOBI-UHFFFAOYSA-N 0 3 411.575 4.146 20 0 HIADHN Clc1cc(Br)cc2c1CC[C@H]2NCc1ccc(N2CCOCC2)nc1 ZINC000534058418 932237045 /nfs/dbraw/zinc/23/70/45/932237045.db2.gz AVOWHDIFNUQKIT-GOSISDBHSA-N 0 3 422.754 4.111 20 0 HIADHN CNC(=O)[C@H](Cc1c[nH]c2ccccc12)N[C@@H]1CCc2c1cc(Cl)cc2Cl ZINC000534059193 932237609 /nfs/dbraw/zinc/23/76/09/932237609.db2.gz KCKNWXDPIHYFKQ-UXHICEINSA-N 0 3 402.325 4.409 20 0 HIADHN CC(C)Cn1ncc(NC(=O)N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)c1C(F)F ZINC000534089633 932269262 /nfs/dbraw/zinc/26/92/62/932269262.db2.gz QFANRTWHWJWSFH-WBVHZDCISA-N 0 3 405.493 4.261 20 0 HIADHN Cc1c(Cl)cc(F)c(NC(=O)N(C)C2CCN(CCc3ccccn3)CC2)c1F ZINC000534173220 932315463 /nfs/dbraw/zinc/31/54/63/932315463.db2.gz TUUWFQQEIORNHR-UHFFFAOYSA-N 0 3 422.907 4.492 20 0 HIADHN Cc1nc(-c2ccc(C)cc2)c(CC(=O)N(CCN(C)C)Cc2cccc(O)c2)s1 ZINC000534190386 932322933 /nfs/dbraw/zinc/32/29/33/932322933.db2.gz CFZYXFWBSRRBPH-UHFFFAOYSA-N 0 3 423.582 4.265 20 0 HIADHN O=C(N[C@@H](CC(F)(F)F)c1ccc(F)cc1)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000534341866 932386751 /nfs/dbraw/zinc/38/67/51/932386751.db2.gz IRVCPXSCHPBBFS-HKUYNNGSSA-N 0 3 409.427 4.243 20 0 HIADHN COc1ccc(C(=O)N(CCN(C)C)Cc2cccc(F)c2)cc1-c1ccccn1 ZINC000534359083 932393147 /nfs/dbraw/zinc/39/31/47/932393147.db2.gz RMWQJEVRJUIILE-UHFFFAOYSA-N 0 3 407.489 4.100 20 0 HIADHN CCN(C[C@@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)Cc1ccc(F)c(Cl)c1 ZINC000534405465 932428334 /nfs/dbraw/zinc/42/83/34/932428334.db2.gz KOHZKIRGAYYMMT-LJQANCHMSA-N 0 3 424.969 4.153 20 0 HIADHN CC(C)(COc1ncccc1Br)NCc1cnc([C@@H]2CCCO2)s1 ZINC000534453444 932468350 /nfs/dbraw/zinc/46/83/50/932468350.db2.gz LEIDUMGXPPYBHD-AWEZNQCLSA-N 0 3 412.353 4.099 20 0 HIADHN CN(C)[C@@H](CNC(=O)c1cnc2ccccc2c1C(F)(F)F)Cc1ccccc1 ZINC000534521313 932543079 /nfs/dbraw/zinc/54/30/79/932543079.db2.gz DOEWWUKZPWEXCA-MRXNPFEDSA-N 0 3 401.432 4.156 20 0 HIADHN Cc1nn(-c2ccc(C(=O)NC[C@@H](Cc3ccccc3)N(C)C)cc2)c(C)c1Cl ZINC000534520556 932543455 /nfs/dbraw/zinc/54/34/55/932543455.db2.gz IRZPZVUQVPFAFE-OAQYLSRUSA-N 0 3 410.949 4.045 20 0 HIADHN CN(C)[C@@H](CNC(=O)N[C@H](c1cccs1)c1ccc(F)cc1)Cc1ccccc1 ZINC000534522528 932544648 /nfs/dbraw/zinc/54/46/48/932544648.db2.gz NBBOLBQZJUXCFJ-IRLDBZIGSA-N 0 3 411.546 4.449 20 0 HIADHN CN(C)CCN(C(=O)c1ccc(C(=O)N(C)c2ccccc2)cc1)c1ccccc1 ZINC000534548455 932556773 /nfs/dbraw/zinc/55/67/73/932556773.db2.gz NNQRVOICYHTIDV-UHFFFAOYSA-N 0 3 401.510 4.172 20 0 HIADHN CCOc1ccc([C@H](C)NC(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)cc1OCC ZINC000534658299 932628472 /nfs/dbraw/zinc/62/84/72/932628472.db2.gz BVEAPMLENPLLMF-XTQVGHSUSA-N 0 3 411.546 4.290 20 0 HIADHN O=C(CCn1ccc2cc(Cl)ccc21)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000534660744 932630779 /nfs/dbraw/zinc/63/07/79/932630779.db2.gz ISNXOINRSNTMGP-UHFFFAOYSA-N 0 3 411.933 4.280 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(Cl)cc2)CC1)C1CCC(F)(F)CC1 ZINC000534699996 932671230 /nfs/dbraw/zinc/67/12/30/932671230.db2.gz GNIVGSZFCUQYNT-UHFFFAOYSA-N 0 3 400.897 4.125 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)C[C@@H]2Sc3ccc(Cl)cc3NC2=O)c1 ZINC000534703743 932675119 /nfs/dbraw/zinc/67/51/19/932675119.db2.gz BLGJPGWPQOMETK-SFHVURJKSA-N 0 3 403.935 4.152 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)Nc3ccc4[nH]c(C(F)F)nc4c3)cc2)CC1 ZINC000534705845 932677296 /nfs/dbraw/zinc/67/72/96/932677296.db2.gz OLOVRKYHBQQAJY-UHFFFAOYSA-N 0 3 413.472 4.283 20 0 HIADHN C[C@@H](Cc1c(Cl)cccc1Cl)NC(=O)N(CCN(C)C)Cc1ccccn1 ZINC000534707396 932678711 /nfs/dbraw/zinc/67/87/11/932678711.db2.gz XYERLNIYJWPBFT-HNNXBMFYSA-N 0 3 409.361 4.093 20 0 HIADHN CC[C@H](NC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1)c1nc(-c2ccccc2)c[nH]1 ZINC000534713656 932682395 /nfs/dbraw/zinc/68/23/95/932682395.db2.gz HEHUWYSKCHRSRI-TUNNFDKTSA-N 0 3 403.530 4.272 20 0 HIADHN CN1CC[C@H](NC(=O)c2ccccc2-c2nc(C(C)(C)C)no2)[C@H]1c1ccccc1 ZINC000534753692 932729990 /nfs/dbraw/zinc/72/99/90/932729990.db2.gz GGBUITGOZLBSIL-VQTJNVASSA-N 0 3 404.514 4.209 20 0 HIADHN CN1CC[C@@H](NC(=O)c2ccccc2-c2nc(C(C)(C)C)no2)[C@H]1c1ccccc1 ZINC000534753694 932730621 /nfs/dbraw/zinc/73/06/21/932730621.db2.gz GGBUITGOZLBSIL-WOJBJXKFSA-N 0 3 404.514 4.209 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cnc(-c2cccnc2)s1)c1cccc(OC)c1 ZINC000534870088 932815580 /nfs/dbraw/zinc/81/55/80/932815580.db2.gz OWDUHEIHPZULDG-LJQANCHMSA-N 0 3 410.543 4.027 20 0 HIADHN COc1ccc(C[C@H](C)CNC(=O)c2oc3ccccc3c2CN(C)C)cc1OC ZINC000534999557 932882508 /nfs/dbraw/zinc/88/25/08/932882508.db2.gz JWUNBDNGPOQYND-INIZCTEOSA-N 0 3 410.514 4.120 20 0 HIADHN CCOc1c(Br)cc(CN(Cc2ccccc2)C[C@@H](C)O)cc1OC ZINC000535079713 932899052 /nfs/dbraw/zinc/89/90/52/932899052.db2.gz CIDXDVPQJNNADC-OAHLLOKOSA-N 0 3 408.336 4.239 20 0 HIADHN CN1CC[C@H](NC(=O)N(Cc2ccccc2)CC2CCOCC2)[C@@H]1c1ccccc1 ZINC000535433622 933133435 /nfs/dbraw/zinc/13/34/35/933133435.db2.gz UWYRBDIVVVOBMG-ZEQRLZLVSA-N 0 3 407.558 4.070 20 0 HIADHN CN(CCc1ccc(Br)cc1)C(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000535437354 933135171 /nfs/dbraw/zinc/13/51/71/933135171.db2.gz QEZOIKFGTNLFCE-PMACEKPBSA-N 0 3 416.363 4.078 20 0 HIADHN CN1CC[C@H](NC(=O)CCc2cc(Br)ccc2F)[C@@H]1c1ccccc1 ZINC000535467270 933156935 /nfs/dbraw/zinc/15/69/35/933156935.db2.gz COTLJNRJAGHYNP-ICSRJNTNSA-N 0 3 405.311 4.082 20 0 HIADHN C[C@H]1CCN(C(=O)Nc2cc3c(cc2Cl)OCO3)CCN1Cc1ccccc1 ZINC000535471397 933162255 /nfs/dbraw/zinc/16/22/55/933162255.db2.gz FBWCFOWKLMIDRH-HNNXBMFYSA-N 0 3 401.894 4.197 20 0 HIADHN C[C@H](CNC(=O)Nc1cccc2c1CN(c1nccs1)C2)N(C)Cc1ccccc1 ZINC000535475947 933168741 /nfs/dbraw/zinc/16/87/41/933168741.db2.gz NTPORRWEIJFIPZ-QGZVFWFLSA-N 0 3 421.570 4.305 20 0 HIADHN CCc1ccc([C@H](CNC(=O)NC[C@H](C)c2nc(-c3ccccc3)no2)N(C)C)cc1 ZINC000535520518 933210922 /nfs/dbraw/zinc/21/09/22/933210922.db2.gz QAJWJOARQOABNU-UWJYYQICSA-N 0 3 421.545 4.005 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)c2cc(N3CCCC3=O)ccc2Cl)C1 ZINC000535527085 933216883 /nfs/dbraw/zinc/21/68/83/933216883.db2.gz ADOABOYEFDMYQZ-FUHWJXTLSA-N 0 3 411.933 4.032 20 0 HIADHN COc1ccnc2c(NC(=O)N(CCN(C)C)Cc3ccc(F)c(F)c3)cccc12 ZINC000535770318 933381485 /nfs/dbraw/zinc/38/14/85/933381485.db2.gz KSRIYWVWVNRROV-UHFFFAOYSA-N 0 3 414.456 4.117 20 0 HIADHN CC[C@@H](c1ccncc1)N(C)C[C@H](O)COc1ccc(Cl)cc1Br ZINC000535788678 933387629 /nfs/dbraw/zinc/38/76/29/933387629.db2.gz AFUMJHZLBFZLEU-RDJZCZTQSA-N 0 3 413.743 4.320 20 0 HIADHN COc1ccccc1COC1CCN(Cc2ccc(OC(F)F)c(OC)c2)CC1 ZINC000535789052 933387720 /nfs/dbraw/zinc/38/77/20/933387720.db2.gz ATYOTMIEIRSOOJ-UHFFFAOYSA-N 0 3 407.457 4.486 20 0 HIADHN COc1ccc(CN([C@H]2CCN(CC(F)(F)F)C2=O)C2CCCCC2)cc1OC ZINC000535792587 933389985 /nfs/dbraw/zinc/38/99/85/933389985.db2.gz SGLBCROBAVKVFQ-KRWDZBQOSA-N 0 3 414.468 4.002 20 0 HIADHN COc1c(Br)cc(CN(C)C[C@@H]2CCCCO2)cc1Br ZINC000535830335 933420437 /nfs/dbraw/zinc/42/04/37/933420437.db2.gz AFVHNWULIXBSPF-LBPRGKRZSA-N 0 3 407.146 4.221 20 0 HIADHN CC(C)[C@@H](Oc1cccc(Cl)c1)C(=O)NC1CCN([C@@H](C)c2ccncc2)CC1 ZINC000535836746 933423239 /nfs/dbraw/zinc/42/32/39/933423239.db2.gz SVFIUXKPNFYNFG-HTAPYJJXSA-N 0 3 415.965 4.480 20 0 HIADHN CC1(C)CCC[C@@H](CC(=O)N2CCC[C@H](CN3CCN(c4ccccn4)CC3)C2)C1 ZINC000535966554 933528863 /nfs/dbraw/zinc/52/88/63/933528863.db2.gz IYQBULOSOKGPSI-FCHUYYIVSA-N 0 3 412.622 4.049 20 0 HIADHN CN(C)[C@@H](CNC(=O)Nc1cccc(C[S@](=O)C(C)(C)C)c1)Cc1ccccc1 ZINC000536016980 933573044 /nfs/dbraw/zinc/57/30/44/933573044.db2.gz GNRPYKHUIKNWDA-PBBNMVCDSA-N 0 3 415.603 4.028 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccc(O)cc1)C(=O)c1csc(-c2ccoc2)n1 ZINC000536033964 933582674 /nfs/dbraw/zinc/58/26/74/933582674.db2.gz APEUKJOYDHIKPB-SFHVURJKSA-N 0 3 411.527 4.235 20 0 HIADHN CN(C)Cc1ccc(C(N)=O)cc1NCc1cc(Cl)ccc1OCc1cccnc1 ZINC000536101354 933654149 /nfs/dbraw/zinc/65/41/49/933654149.db2.gz SWWKSWAYDQOJHZ-UHFFFAOYSA-N 0 3 424.932 4.087 20 0 HIADHN CN(C(=O)CN[C@@H](c1ccc2c(c1)OCCO2)C1CC1)[C@@H]1CCCc2ccccc21 ZINC000537288184 933698479 /nfs/dbraw/zinc/69/84/79/933698479.db2.gz MDWIGIUIFNXSIY-PXDATVDWSA-N 0 3 406.526 4.035 20 0 HIADHN CC[C@@H](NCc1ccc(N2CCO[C@@H](C)C2)nc1)c1cc(F)cc(Br)c1 ZINC000537294939 933702399 /nfs/dbraw/zinc/70/23/99/933702399.db2.gz HGHLFGBHSIZBBU-IFXJQAMLSA-N 0 3 422.342 4.449 20 0 HIADHN O=C1c2ccccc2C(=O)N1[C@H]1CCCC[C@H](NCc2nc(C(F)(F)F)cs2)C1 ZINC000537311833 933711134 /nfs/dbraw/zinc/71/11/34/933711134.db2.gz VOEYLBBADHWDGJ-STQMWFEESA-N 0 3 423.460 4.249 20 0 HIADHN COc1ccccc1-c1csc([C@@H]2CCCN(CCOC[C@H]3CCCO3)C2)n1 ZINC000562493369 945090138 /nfs/dbraw/zinc/09/01/38/945090138.db2.gz MKKWHXFYCGBKFG-QZTJIDSGSA-N 0 3 402.560 4.194 20 0 HIADHN C[C@H](N[C@H]1CCN(C)[C@@H]1c1ccc(Cl)c(F)c1)C(=O)Nc1cc(F)ccc1F ZINC000562907300 945148228 /nfs/dbraw/zinc/14/82/28/945148228.db2.gz DZXZUJFYRLAMQI-WOVYWWTOSA-N 0 3 411.855 4.119 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N(C)Cc3cc(F)c(F)c(F)c3)c(C)c2)CC1 ZINC000537518235 938315100 /nfs/dbraw/zinc/31/51/00/938315100.db2.gz GEWXWKXQGWXSJM-UHFFFAOYSA-N 0 3 420.479 4.218 20 0 HIADHN CCNC(=O)[C@H](C)N[C@@H]1CCCc2nc(-c3ccc(Br)cc3)sc21 ZINC000537520720 938315195 /nfs/dbraw/zinc/31/51/95/938315195.db2.gz CNJWIDUGRNOWLJ-SMDDNHRTSA-N 0 3 408.365 4.064 20 0 HIADHN COc1ccc(NC(=O)[C@H](C)N2CCC[C@@H](c3n[nH]c(C4CCCCC4)n3)C2)cc1 ZINC000537561597 938325027 /nfs/dbraw/zinc/32/50/27/938325027.db2.gz HFDIGUFZGKVVNJ-FUHWJXTLSA-N 0 3 411.550 4.068 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)Nc2cccc(-n3cccn3)c2)N(C)C)cc1 ZINC000563274139 945166013 /nfs/dbraw/zinc/16/60/13/945166013.db2.gz AAXBWNIZXORSFO-JOCHJYFZSA-N 0 3 407.518 4.084 20 0 HIADHN CC(C)(C)N1CCCN(C(=O)c2coc(-c3ccc(Br)cc3F)n2)CC1 ZINC000537609096 938332273 /nfs/dbraw/zinc/33/22/73/938332273.db2.gz QGFXPKDELDOIAD-UHFFFAOYSA-N 0 3 424.314 4.190 20 0 HIADHN COc1cc(CN2CCCN(c3nc(C)ns3)CC2)c(-c2ccccc2)cc1OC ZINC000537621623 938336599 /nfs/dbraw/zinc/33/65/99/938336599.db2.gz ADUICROZVKUNGZ-UHFFFAOYSA-N 0 3 424.570 4.243 20 0 HIADHN Fc1ccc(-c2n[nH]cc2CN2CCC(n3cc(Br)cn3)CC2)cc1 ZINC000537627391 938339055 /nfs/dbraw/zinc/33/90/55/938339055.db2.gz WKHKDUZTEWJCGK-UHFFFAOYSA-N 0 3 404.287 4.012 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(C)c1CN1CCC[C@H](CNC(=O)C(C)(C)C)C1 ZINC000537629523 938340514 /nfs/dbraw/zinc/34/05/14/938340514.db2.gz LJLLZMADAQXEIY-GOSISDBHSA-N 0 3 400.542 4.003 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)Nc2cccc(-n3cccn3)c2)N(C)C)cc1 ZINC000563274140 945166464 /nfs/dbraw/zinc/16/64/64/945166464.db2.gz AAXBWNIZXORSFO-QFIPXVFZSA-N 0 3 407.518 4.084 20 0 HIADHN CCO[C@H]1C[C@@H](O)C12CCN(Cc1cn(-c3ccc(C)cc3)nc1C(C)(C)C)CC2 ZINC000537635476 938342015 /nfs/dbraw/zinc/34/20/15/938342015.db2.gz WQTFTJUFCSMUCT-YADHBBJMSA-N 0 3 411.590 4.230 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(CN3CC[C@@H](C(=O)OC(C)(C)C)C3)c2)cc1 ZINC000537648942 938346481 /nfs/dbraw/zinc/34/64/81/938346481.db2.gz NVUINWIGSJPUGN-LJQANCHMSA-N 0 3 410.514 4.111 20 0 HIADHN CCc1ccc(NC(=O)N2CCC[C@@H](CN3CCN(c4ccccn4)CC3)C2)cc1C ZINC000537671009 938350571 /nfs/dbraw/zinc/35/05/71/938350571.db2.gz LSYYJXWNOCJSPP-NRFANRHFSA-N 0 3 421.589 4.019 20 0 HIADHN F[C@H](C(F)(F)F)C(F)(F)Oc1ccc(CN2CCS[C@H]3COCC[C@@H]32)cc1 ZINC000537707601 938360310 /nfs/dbraw/zinc/36/03/10/938360310.db2.gz FECYGUGMDPGXPH-SOUVJXGZSA-N 0 3 415.399 4.265 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)[C@@H](C)Oc2ccc(SC)cc2)cc1 ZINC000537728229 938363990 /nfs/dbraw/zinc/36/39/90/938363990.db2.gz JCIDLGVEKQUQHT-VGSWGCGISA-N 0 3 414.571 4.138 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)C3(Cc4ccc(Cl)cc4)CC3)CC2)C[C@H](C)O1 ZINC000537762466 938371679 /nfs/dbraw/zinc/37/16/79/938371679.db2.gz JKUCENFBAPWXNW-KDURUIRLSA-N 0 3 419.009 4.401 20 0 HIADHN CN(C)C(=O)COc1cccc(CN[C@@H]2CCCc3ccc(Br)cc32)c1 ZINC000537763359 938371993 /nfs/dbraw/zinc/37/19/93/938371993.db2.gz JVKSNEWINZWFFR-HXUWFJFHSA-N 0 3 417.347 4.083 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)NCc3cc(Cl)sc3Cl)CC2)C[C@@H](C)O1 ZINC000537765386 938372651 /nfs/dbraw/zinc/37/26/51/938372651.db2.gz OKGGYWXXKCGCPF-CHWSQXEVSA-N 0 3 420.406 4.086 20 0 HIADHN COc1cccc(OC)c1OC1CCN(Cc2ccc(-c3cnn(C)c3)s2)CC1 ZINC000563301089 945171628 /nfs/dbraw/zinc/17/16/28/945171628.db2.gz FWGUAHQDAILZDI-UHFFFAOYSA-N 0 3 413.543 4.209 20 0 HIADHN CS[C@H]1CN(C(=O)c2ccc(COc3ccc4ccccc4c3)o2)C[C@H]1N(C)C ZINC000537924068 938415074 /nfs/dbraw/zinc/41/50/74/938415074.db2.gz MUFCTVWZESOTAR-IRLDBZIGSA-N 0 3 410.539 4.129 20 0 HIADHN Cc1cccc(NC(=O)C[C@@H](C)N[C@@H](CO)c2ccc(Br)cc2)c1C ZINC000537941878 938425081 /nfs/dbraw/zinc/42/50/81/938425081.db2.gz HLVCLVLJJMYZRM-KUHUBIRLSA-N 0 3 405.336 4.106 20 0 HIADHN C[C@@H]1C[C@@H](N[C@H]2CCCN(CC(F)(F)F)C2=O)c2cccc(Br)c21 ZINC000537948296 938429007 /nfs/dbraw/zinc/42/90/07/938429007.db2.gz GMLSZXOWECMRSV-DDTOSNHZSA-N 0 3 405.258 4.140 20 0 HIADHN Cc1cc([C@H](N[C@H](C)c2cccc(N3CCCS3(=O)=O)c2)C2CC2)ccc1F ZINC000537952759 938430257 /nfs/dbraw/zinc/43/02/57/938430257.db2.gz RXYZSTOCCCNRIH-OPAMFIHVSA-N 0 3 402.535 4.476 20 0 HIADHN C[C@@H]1Cc2ccccc2[C@@H]1NCc1ccc(Br)cc1N1CCOCC1 ZINC000537957341 938432598 /nfs/dbraw/zinc/43/25/98/938432598.db2.gz BHHCHDLMXAULIR-QVKFZJNVSA-N 0 3 401.348 4.309 20 0 HIADHN C[C@@H](CC(=O)Nc1ccc(Br)cc1)NCc1cccc2c1OCCCO2 ZINC000537964224 938437349 /nfs/dbraw/zinc/43/73/49/938437349.db2.gz JVJRGHJBCZGENQ-AWEZNQCLSA-N 0 3 419.319 4.117 20 0 HIADHN CNS(=O)(=O)c1cccc([C@H](C)N[C@H](Cc2ccccc2)c2cccs2)c1 ZINC000537970511 938440564 /nfs/dbraw/zinc/44/05/64/938440564.db2.gz XVQMVUKPAAXGTM-OXJNMPFZSA-N 0 3 400.569 4.291 20 0 HIADHN C[C@@H](NCc1cccc(OCC(F)F)c1)c1ccc(OCc2nccn2C)cc1 ZINC000537974552 938443972 /nfs/dbraw/zinc/44/39/72/938443972.db2.gz GRKPSSUFMIYMAZ-MRXNPFEDSA-N 0 3 401.457 4.494 20 0 HIADHN COc1cc(F)c([C@@H](C)NCCc2nc(-c3cccc(Cl)c3)no2)cc1OC ZINC000537981326 938446345 /nfs/dbraw/zinc/44/63/45/938446345.db2.gz GPRPXFFWIHRJEY-GFCCVEGCSA-N 0 3 405.857 4.440 20 0 HIADHN Cc1ccc(-c2nc3c(s2)[C@H](N[C@@H]2CCCN(c4ccn(C)n4)C2=O)CCC3)cc1 ZINC000537983720 938447862 /nfs/dbraw/zinc/44/78/62/938447862.db2.gz WCWXAINSSWXPIO-IEBWSBKVSA-N 0 3 421.570 4.015 20 0 HIADHN Cc1ccc(-c2nc3c(s2)[C@H](N[C@H]2CCCN(c4ccn(C)n4)C2=O)CCC3)cc1 ZINC000537983721 938448294 /nfs/dbraw/zinc/44/82/94/938448294.db2.gz WCWXAINSSWXPIO-MJGOQNOKSA-N 0 3 421.570 4.015 20 0 HIADHN Cc1cccc(NC(=O)C[C@H](C)NCc2cccc(C(=O)NCc3ccco3)c2)c1C ZINC000537986355 938448789 /nfs/dbraw/zinc/44/87/89/938448789.db2.gz IOFWJCYJFRIKBU-SFHVURJKSA-N 0 3 419.525 4.333 20 0 HIADHN COC[C@@H](N[C@@H](C)CC(=O)Nc1cccc(Br)c1)c1ccc(F)cc1 ZINC000537986753 938449862 /nfs/dbraw/zinc/44/98/62/938449862.db2.gz JZBKIRHVKLPYRR-SCLBCKFNSA-N 0 3 409.299 4.283 20 0 HIADHN CN(C)S(=O)(=O)c1ccc(CN[C@H]2CCCSc3ccc(Cl)cc32)cc1 ZINC000537989787 938451819 /nfs/dbraw/zinc/45/18/19/938451819.db2.gz DYPMVOIKHZPCFG-SFHVURJKSA-N 0 3 410.992 4.307 20 0 HIADHN COc1cc(CN[C@H](C)c2cccc(-c3ccncc3)c2)ccc1OCC(=O)N(C)C ZINC000537991955 938452936 /nfs/dbraw/zinc/45/29/36/938452936.db2.gz QWZOKPOGLQHNBM-GOSISDBHSA-N 0 3 419.525 4.075 20 0 HIADHN CCN1CC[C@@H](NC(=O)Nc2cccc(CN(C)C)c2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000538003515 938458801 /nfs/dbraw/zinc/45/88/01/938458801.db2.gz ZQEZEQLQKROWJZ-NHCUHLMSSA-N 0 3 418.944 4.498 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)c3ccccc3COC(C)(C)C)CC2)C[C@H](C)O1 ZINC000538019678 938464837 /nfs/dbraw/zinc/46/48/37/938464837.db2.gz FTBWUBCVJRPEFM-PMACEKPBSA-N 0 3 416.606 4.353 20 0 HIADHN CO[C@H](c1ccc(Br)cc1)[C@@H](C)NCc1cc(-c2cccnc2)n[nH]1 ZINC000538022240 938466640 /nfs/dbraw/zinc/46/66/40/938466640.db2.gz GERWQJRXTXILQZ-YJYMSZOUSA-N 0 3 401.308 4.100 20 0 HIADHN COc1cc(OC)cc(OCCCN[C@H](C)c2nc3ccc(Cl)cc3n2C)c1 ZINC000538113177 938505202 /nfs/dbraw/zinc/50/52/02/938505202.db2.gz AAHAJUXZISBBQZ-CQSZACIVSA-N 0 3 403.910 4.364 20 0 HIADHN Cc1ccc2[nH]c([C@H]3CCCN([C@H](C)C(=O)N4CCc5ccccc5C4)C3)nc2c1 ZINC000538120072 938508714 /nfs/dbraw/zinc/50/87/14/938508714.db2.gz MNSLRSZHJVDUPZ-NQIIRXRSSA-N 0 3 402.542 4.024 20 0 HIADHN Cc1ccc2nc([C@H]3CCCN([C@H](C)C(=O)N4CCc5ccccc5C4)C3)[nH]c2c1 ZINC000538120072 938508719 /nfs/dbraw/zinc/50/87/19/938508719.db2.gz MNSLRSZHJVDUPZ-NQIIRXRSSA-N 0 3 402.542 4.024 20 0 HIADHN CC[C@H](N[C@@H](C)C(=O)N(C)Cc1ccc(OC)c(OC)c1)c1cccc(Cl)c1 ZINC000538125112 938512020 /nfs/dbraw/zinc/51/20/20/938512020.db2.gz LZYXTQNUZLHKIK-KXBFYZLASA-N 0 3 404.938 4.445 20 0 HIADHN CCC(=O)Nc1ccc(S(=O)(=O)[N-]c2ccc(C[N@@H+]3CCC[C@H](C)C3)cc2)cc1 ZINC000538132874 938515635 /nfs/dbraw/zinc/51/56/35/938515635.db2.gz UBKQLJZKQIOZCN-KRWDZBQOSA-N 0 3 415.559 4.068 20 0 HIADHN CCC(=O)Nc1ccc(S(=O)(=O)[N-]c2ccc(C[N@H+]3CCC[C@H](C)C3)cc2)cc1 ZINC000538132874 938515640 /nfs/dbraw/zinc/51/56/40/938515640.db2.gz UBKQLJZKQIOZCN-KRWDZBQOSA-N 0 3 415.559 4.068 20 0 HIADHN Cc1ccc(NC(=O)CNC2(c3ccc4c(c3)OCCO4)CCCC2)c(Cl)c1 ZINC000538142145 938518579 /nfs/dbraw/zinc/51/85/79/938518579.db2.gz VZNVEGBAWVBWDS-UHFFFAOYSA-N 0 3 400.906 4.417 20 0 HIADHN CC(C)(C)C[C@@H](NCC(=O)Nc1cc(S(C)(=O)=O)ccc1Cl)c1ccccc1 ZINC000538155800 938526109 /nfs/dbraw/zinc/52/61/09/938526109.db2.gz POIPTBBPDMXZNO-LJQANCHMSA-N 0 3 422.978 4.449 20 0 HIADHN C[C@H](NCC(=O)N(C)[C@@H](C)c1cc2ccccc2o1)c1ccccc1-n1cccn1 ZINC000538159327 938529467 /nfs/dbraw/zinc/52/94/67/938529467.db2.gz BCHCGSWMCAPKGA-ROUUACIJSA-N 0 3 402.498 4.489 20 0 HIADHN CC[C@H](NCC(=O)N(Cc1ccccc1)CC(F)(F)F)c1ccc2c(c1)OCCO2 ZINC000538174743 938535566 /nfs/dbraw/zinc/53/55/66/938535566.db2.gz FTACBRYSRBJQOH-SFHVURJKSA-N 0 3 422.447 4.090 20 0 HIADHN COc1ccc([C@@H](Cc2ccccc2C)NCC(=O)N2CCC(C)CC2)cc1OC ZINC000538175890 938536947 /nfs/dbraw/zinc/53/69/47/938536947.db2.gz UZSYIYXTOSJANO-JOCHJYFZSA-N 0 3 410.558 4.144 20 0 HIADHN O=C1[C@@H](N[C@H](c2ccc(Br)cc2)C2CCC2)CCN1CC(F)(F)F ZINC000538177395 938537584 /nfs/dbraw/zinc/53/75/84/938537584.db2.gz UKVDTTSJNNENLH-GJZGRUSLSA-N 0 3 405.258 4.043 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)Nc1ccccc1Br)c1cccc(-n2cccn2)c1 ZINC000538189307 938545040 /nfs/dbraw/zinc/54/50/40/938545040.db2.gz YPKFIINDRGBDPJ-CABCVRRESA-N 0 3 413.319 4.313 20 0 HIADHN O=C(N[C@H]1CCO[C@H]1c1ccc(Cl)cc1)N1CCCN(Cc2ccccc2)CC1 ZINC000538191530 938547335 /nfs/dbraw/zinc/54/73/35/938547335.db2.gz PELBIKZKCHOTPW-VXKWHMMOSA-N 0 3 413.949 4.088 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)NCC1CCCCC1)c1ccc(NC(=O)c2ccncc2)cc1 ZINC000538195461 938548820 /nfs/dbraw/zinc/54/88/20/938548820.db2.gz UMUYYVRFRAYONE-MSOLQXFVSA-N 0 3 408.546 4.070 20 0 HIADHN O=C(CN[C@@H](c1ccc(Cl)cc1)C1CCC1)NC[C@H]1CCN(c2ccccc2)C1 ZINC000538206639 938554361 /nfs/dbraw/zinc/55/43/61/938554361.db2.gz PXAPCBVPUXPSMU-HOYKHHGWSA-N 0 3 411.977 4.414 20 0 HIADHN COc1ccc(CCNC(=O)CN[C@H](c2ccc(F)cc2)C2CCCC2)cc1OC ZINC000538212136 938558236 /nfs/dbraw/zinc/55/82/36/938558236.db2.gz CUGCPICJXNLUJH-DEOSSOPVSA-N 0 3 414.521 4.023 20 0 HIADHN O=C(CN[C@@H](C[C@@H]1CCOC1)c1ccccc1)Nc1ccccc1Br ZINC000538232534 938566891 /nfs/dbraw/zinc/56/68/91/938566891.db2.gz DFEQGFJRPLTHRW-KXBFYZLASA-N 0 3 403.320 4.145 20 0 HIADHN CN(Cc1ccc(OC(F)F)cc1)C(=O)CN[C@@H](C[C@H]1CCOC1)c1ccccc1 ZINC000538233427 938568110 /nfs/dbraw/zinc/56/81/10/938568110.db2.gz MAHIHKSJEAWFKA-NQIIRXRSSA-N 0 3 418.484 4.004 20 0 HIADHN Cc1cccc([C@@H](NCC(=O)Nc2cc(S(C)(=O)=O)ccc2Cl)C(C)(C)C)c1 ZINC000538236527 938569287 /nfs/dbraw/zinc/56/92/87/938569287.db2.gz RJICCNMMFNQEAQ-HXUWFJFHSA-N 0 3 422.978 4.367 20 0 HIADHN Cc1nc(C2CCCCC2)sc1C(=O)N(CCN(C)C)Cc1cccc(O)c1 ZINC000538271881 938580420 /nfs/dbraw/zinc/58/04/20/938580420.db2.gz XBTORYDQMCKKEJ-UHFFFAOYSA-N 0 3 401.576 4.409 20 0 HIADHN C[C@@H](NCC(=O)N1CCc2[nH]c3ccccc3c2C1)c1cccc(N2CCCC2)c1 ZINC000538277371 938581652 /nfs/dbraw/zinc/58/16/52/938581652.db2.gz SJLIWIQXLQGSBA-GOSISDBHSA-N 0 3 402.542 4.004 20 0 HIADHN O[C@H](CNCc1cn(-c2ccccc2)nc1-c1cccs1)COc1ccccc1 ZINC000538311753 938590197 /nfs/dbraw/zinc/59/01/97/938590197.db2.gz NIRYVXNZDGFBLQ-HXUWFJFHSA-N 0 3 405.523 4.130 20 0 HIADHN COc1ccc([C@@H](N[C@@H](C)C(=O)N(C)Cc2nc3ccccc3s2)C2CC2)cc1 ZINC000538389274 938608785 /nfs/dbraw/zinc/60/87/85/938608785.db2.gz CYVDGLHJHLPKSK-NYHFZMIOSA-N 0 3 409.555 4.393 20 0 HIADHN c1csc(-c2nn(-c3ccccc3)cc2CNCc2cccc(-n3cncn3)c2)c1 ZINC000538418506 938615925 /nfs/dbraw/zinc/61/59/25/938615925.db2.gz KCTCSCKTZFYGOY-UHFFFAOYSA-N 0 3 412.522 4.471 20 0 HIADHN COc1cc2c(c(CN[C@H](C)[C@H](OC3CCOCC3)c3ccccc3)c1)O[C@@H](C)C2 ZINC000538422155 938616761 /nfs/dbraw/zinc/61/67/61/938616761.db2.gz JLMILOAYJOEQSD-RHGYRFJNSA-N 0 3 411.542 4.434 20 0 HIADHN COc1cc2c(c(CN[C@H](C)[C@H](OC3CCOCC3)c3ccccc3)c1)O[C@H](C)C2 ZINC000538422151 938616772 /nfs/dbraw/zinc/61/67/72/938616772.db2.gz JLMILOAYJOEQSD-GGUMNFRJSA-N 0 3 411.542 4.434 20 0 HIADHN Brc1ccc(-c2c[nH]c(CN[C@@H]3[C@H]4CCO[C@H]4C34CCCC4)n2)cc1 ZINC000538422885 938617073 /nfs/dbraw/zinc/61/70/73/938617073.db2.gz SCCPYBROZVWTQB-ATZDWAIDSA-N 0 3 402.336 4.277 20 0 HIADHN C[C@H](CC(=O)NC1CCN(CCc2ccccc2)CC1)C(=O)c1ccc(Cl)cc1 ZINC000538587817 938656144 /nfs/dbraw/zinc/65/61/44/938656144.db2.gz HPUKJKYXSFPHCO-GOSISDBHSA-N 0 3 412.961 4.372 20 0 HIADHN Brc1ccc(OCc2ccccn2)c(CNCCNc2ccccn2)c1 ZINC000538609769 938660632 /nfs/dbraw/zinc/66/06/32/938660632.db2.gz UAJHTYSMBCPPFM-UHFFFAOYSA-N 0 3 413.319 4.020 20 0 HIADHN O=C(Nc1ccc2nc(-c3ccccn3)oc2c1)N1CCN(C2CCCCC2)CC1 ZINC000538625414 938665129 /nfs/dbraw/zinc/66/51/29/938665129.db2.gz VUDHVANUFOESQM-UHFFFAOYSA-N 0 3 405.502 4.372 20 0 HIADHN Cc1cc(-c2nnc(CN3CCC[C@H](c4nc(C5CCCCC5)n[nH]4)C3)o2)c(C)o1 ZINC000538665034 938679172 /nfs/dbraw/zinc/67/91/72/938679172.db2.gz UHZREXXOTOTQKM-KRWDZBQOSA-N 0 3 410.522 4.492 20 0 HIADHN Cc1cc(-c2nnc(CN3CCC[C@H](c4n[nH]c(C5CCCCC5)n4)C3)o2)c(C)o1 ZINC000538665034 938679179 /nfs/dbraw/zinc/67/91/79/938679179.db2.gz UHZREXXOTOTQKM-KRWDZBQOSA-N 0 3 410.522 4.492 20 0 HIADHN Cc1cccc(NC2CCN(Cc3c[nH]nc3-c3ccc4c(c3)OCCO4)CC2)c1 ZINC000538720692 938690666 /nfs/dbraw/zinc/69/06/66/938690666.db2.gz ODZFNKQCGQURFH-UHFFFAOYSA-N 0 3 404.514 4.233 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cc3ccccc3nc2N2CCCCC2)C1)N1CCCC1 ZINC000538730263 938695293 /nfs/dbraw/zinc/69/52/93/938695293.db2.gz VHLLTCRKVUYASG-OAQYLSRUSA-N 0 3 406.574 4.060 20 0 HIADHN COc1cc(N[C@H]2CCCN(Cc3ccc(Oc4cnccn4)cc3)C2)cc(OC)c1 ZINC000538750920 938701560 /nfs/dbraw/zinc/70/15/60/938701560.db2.gz GQCUGSFSSHRDNS-IBGZPJMESA-N 0 3 420.513 4.363 20 0 HIADHN CCN(CC(F)(F)F)C(=O)[C@H]1CCCN(Cc2cnc(-c3ccccc3)s2)C1 ZINC000538751773 938702217 /nfs/dbraw/zinc/70/22/17/938702217.db2.gz MVZXTBNITVCNKZ-INIZCTEOSA-N 0 3 411.493 4.433 20 0 HIADHN O=C(c1ccc2nc[nH]c2n1)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000538837198 938722705 /nfs/dbraw/zinc/72/27/05/938722705.db2.gz RKVASPYBDORBFI-UHFFFAOYSA-N 0 3 418.328 4.003 20 0 HIADHN O=C(Nc1cccnc1)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1 ZINC000538851349 938725159 /nfs/dbraw/zinc/72/51/59/938725159.db2.gz IDIVFDPTRJVJSZ-UHFFFAOYSA-N 0 3 401.514 4.090 20 0 HIADHN CCC[C@H](N[C@H](C)c1sc(CCOC)nc1C)C(=O)N1CCc2sccc2C1 ZINC000538869006 938728388 /nfs/dbraw/zinc/72/83/88/938728388.db2.gz UVMIBHPCZYWIQO-PBHICJAKSA-N 0 3 421.632 4.106 20 0 HIADHN COc1ccc(CNc2cccc(N3CCN(CCc4ccccc4)CC3)c2)cc1O ZINC000538877070 938729786 /nfs/dbraw/zinc/72/97/86/938729786.db2.gz JRAZQHINZPKUAM-UHFFFAOYSA-N 0 3 417.553 4.378 20 0 HIADHN c1csc([C@@H](NCc2ccccc2OCCN2CCOCC2)C2CCCC2)c1 ZINC000538985556 938760090 /nfs/dbraw/zinc/76/00/90/938760090.db2.gz XBSOWFIUECNMMP-QHCPKHFHSA-N 0 3 400.588 4.480 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@@H](C)N[C@H](C)c2cnc3cc(C)nn3c2C)CC1 ZINC000538988035 938760892 /nfs/dbraw/zinc/76/08/92/938760892.db2.gz XGGCAVJZVZSPOM-QZTJIDSGSA-N 0 3 424.568 4.039 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)N[C@@H](c1ccccc1)[C@@H]1CCOC1 ZINC000538996246 938763551 /nfs/dbraw/zinc/76/35/51/938763551.db2.gz GNLYRUZZIFWUJR-HUVFLSCGSA-N 0 3 407.558 4.070 20 0 HIADHN CCOc1ccccc1-c1cccc(C(=O)Nc2cnccc2N2CCN(C)CC2)c1 ZINC000538997334 938764008 /nfs/dbraw/zinc/76/40/08/938764008.db2.gz HFSHWTAXQODQAW-UHFFFAOYSA-N 0 3 416.525 4.151 20 0 HIADHN CCCCOc1ccc([C@H](C)N[C@H](C)Cn2ncc3ccccc3c2=O)cc1OC ZINC000539041704 938778808 /nfs/dbraw/zinc/77/88/08/938778808.db2.gz OHZXPCHSYSYKKC-MSOLQXFVSA-N 0 3 409.530 4.323 20 0 HIADHN Cc1ccc(NC(=O)C[C@@H](C)N[C@H](CO)c2ccc(Br)cc2)c(C)c1 ZINC000539045741 938781293 /nfs/dbraw/zinc/78/12/93/938781293.db2.gz BLLSPJJGFXJRQM-DNVCBOLYSA-N 0 3 405.336 4.106 20 0 HIADHN CCc1ccccc1NC(=O)C[C@H](C)N[C@@H]1CC(=O)N(C)[C@H]1c1ccc(Cl)cc1 ZINC000539049568 938782442 /nfs/dbraw/zinc/78/24/42/938782442.db2.gz UVEYCTGQNOBBMZ-NQKDMWHGSA-N 0 3 413.949 4.181 20 0 HIADHN COc1cccc(C[C@H](NCc2ccc3c(c2)CCS3(=O)=O)c2ccccc2)c1 ZINC000539057262 938786180 /nfs/dbraw/zinc/78/61/80/938786180.db2.gz VTNKJQLAVJPSPY-QHCPKHFHSA-N 0 3 407.535 4.099 20 0 HIADHN Cc1ccc(C(=O)NCCN[C@H](C)c2ccc(OC[C@@H]3CCCCO3)c(F)c2)cc1 ZINC000539067206 938791086 /nfs/dbraw/zinc/79/10/86/938791086.db2.gz CCBZENQIILNNKG-NQIIRXRSSA-N 0 3 414.521 4.163 20 0 HIADHN C[C@@H](N[C@H]1CC(=O)N(c2ccccc2Cl)C1)c1ccc(OCc2nccn2C)cc1 ZINC000539079528 938797362 /nfs/dbraw/zinc/79/73/62/938797362.db2.gz HXSZASZBDFGPTN-AEFFLSMTSA-N 0 3 424.932 4.109 20 0 HIADHN CC[C@H](NC[C@H](OC)c1cccc(Cl)c1)c1ccccc1OCC(=O)N(C)C ZINC000539086737 938799628 /nfs/dbraw/zinc/79/96/28/938799628.db2.gz KQZJTQLTCKEXGS-FPOVZHCZSA-N 0 3 404.938 4.235 20 0 HIADHN COc1cc(OC)cc(N2CC[C@H](N[C@H](C)c3ccc(-c4ccncc4)cc3)C2=O)c1 ZINC000539085450 938799786 /nfs/dbraw/zinc/79/97/86/938799786.db2.gz OBBXPKZKUFBKRC-OSPHWJPCSA-N 0 3 417.509 4.222 20 0 HIADHN CC(C)C[C@H](N[C@@H](C)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1cccs1 ZINC000539091248 938801036 /nfs/dbraw/zinc/80/10/36/938801036.db2.gz HQCVKLWNOMXEMA-PXNSSMCTSA-N 0 3 422.616 4.207 20 0 HIADHN O=S(=O)(c1ccc(CN[C@H]2CCCc3ccc(Cl)cc32)cc1)N1CCCC1 ZINC000539092914 938801689 /nfs/dbraw/zinc/80/16/89/938801689.db2.gz HDQXDJZHQZOKQV-NRFANRHFSA-N 0 3 404.963 4.292 20 0 HIADHN Brc1ccc(N2CC[C@H](CNCc3ccn(-c4ccccc4)n3)C2)cc1 ZINC000539105107 938803777 /nfs/dbraw/zinc/80/37/77/938803777.db2.gz NNQRJCGUHSXRET-QGZVFWFLSA-N 0 3 411.347 4.251 20 0 HIADHN CS(=O)(=O)Nc1ccc(OCCNCc2ccc(-c3ccccc3Cl)o2)cc1 ZINC000539104535 938803794 /nfs/dbraw/zinc/80/37/94/938803794.db2.gz GYRJLLFSZDSNBM-UHFFFAOYSA-N 0 3 420.918 4.140 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc(CN[C@H](c2ccc(OC)cc2)C(C)C)cc1 ZINC000539214741 938819802 /nfs/dbraw/zinc/81/98/02/938819802.db2.gz AFVXRNIFOBXTTO-QFIPXVFZSA-N 0 3 404.576 4.213 20 0 HIADHN CC(C)Oc1ccccc1[C@@H](C)NCCC(=O)Nc1ccc(N2CCCC2=O)cc1 ZINC000539227268 938821699 /nfs/dbraw/zinc/82/16/99/938821699.db2.gz ZSFYJUCZPXFGJL-GOSISDBHSA-N 0 3 409.530 4.280 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)Nc1ccc(OC(F)F)cc1)c1ccccc1-n1cccn1 ZINC000539261102 938829158 /nfs/dbraw/zinc/82/91/58/938829158.db2.gz YTYKHCGLYUHEDN-CABCVRRESA-N 0 3 400.429 4.152 20 0 HIADHN Cc1ccccc1[C@H](CC(C)C)NCC(=O)NCc1ccccc1CN1CCCC1=O ZINC000539262704 938829458 /nfs/dbraw/zinc/82/94/58/938829458.db2.gz MAZMETZKOIVJHC-DEOSSOPVSA-N 0 3 421.585 4.111 20 0 HIADHN Cc1ccc2nc(CN[C@H](c3ccc(Br)cc3)C3CCC3)cc(=O)n2c1 ZINC000539279354 938832482 /nfs/dbraw/zinc/83/24/82/938832482.db2.gz NBDCGRIKLDTHND-NRFANRHFSA-N 0 3 412.331 4.396 20 0 HIADHN COc1ccc2cc(CN(C)C(=O)CN[C@H](c3ccccc3)[C@H]3CCOC3)ccc2c1 ZINC000539288887 938834215 /nfs/dbraw/zinc/83/42/15/938834215.db2.gz GWKSEKZMXBOHFT-JYFHCDHNSA-N 0 3 418.537 4.174 20 0 HIADHN C[C@H](NC[C@@H]1CC[C@@H](C(=O)N(C)C)O1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000539295694 938835665 /nfs/dbraw/zinc/83/56/65/938835665.db2.gz QQYHFYZRCYDCQH-LKTVYLICSA-N 0 3 412.374 4.011 20 0 HIADHN CCOC(=O)c1c2c(sc1NC(=O)[C@H]1CCC(=O)[C@@H](C)C1)C(C)(C)NC(C)(C)C2 ZINC000539298208 938836148 /nfs/dbraw/zinc/83/61/48/938836148.db2.gz PTJMRCBQBQWRCM-STQMWFEESA-N 0 3 420.575 4.028 20 0 HIADHN Cc1ccc(-c2csc(NC(=O)CN[C@@H](c3ccccc3)[C@H]3CCOC3)n2)cc1 ZINC000539298351 938836261 /nfs/dbraw/zinc/83/62/61/938836261.db2.gz PATIVFILENJFRC-UGKGYDQZSA-N 0 3 407.539 4.424 20 0 HIADHN COC(=O)c1ccc(CNC(=O)[C@H](C)N[C@@H](C)c2ccc(SC(C)C)cc2)cc1 ZINC000539300416 938836788 /nfs/dbraw/zinc/83/67/88/938836788.db2.gz GICCQRHOLOXXAD-IRXDYDNUSA-N 0 3 414.571 4.329 20 0 HIADHN CN(C(=O)Nc1c(F)cc(Cl)cc1F)C1CCN(CCc2ccccn2)CC1 ZINC000539307460 938837958 /nfs/dbraw/zinc/83/79/58/938837958.db2.gz YFTFAEYQGKVAPD-UHFFFAOYSA-N 0 3 408.880 4.184 20 0 HIADHN O=C(CN[C@H](c1ccc(F)cc1)C1CCCC1)Nc1ccccc1N1CCCC1=O ZINC000539313715 938839626 /nfs/dbraw/zinc/83/96/26/938839626.db2.gz IEEKQKQGWFCUQV-DEOSSOPVSA-N 0 3 409.505 4.412 20 0 HIADHN O[C@@H](CN[C@H](COc1ccccc1)c1ccccc1)COc1cccc2[nH]ccc21 ZINC000539320379 938840878 /nfs/dbraw/zinc/84/08/78/938840878.db2.gz RUKYEZOWVQRDPO-GBXCKJPGSA-N 0 3 402.494 4.318 20 0 HIADHN CCC[C@@H](NCCCS(=O)(=O)c1ccc(NC(C)=O)cc1)c1ccc(F)cc1F ZINC000539324011 938841329 /nfs/dbraw/zinc/84/13/29/938841329.db2.gz DQOIKKPEDSQSMK-OAQYLSRUSA-N 0 3 424.513 4.218 20 0 HIADHN Cc1nn(C)c(C)c1NC(=O)CN[C@H](c1ccccc1)[C@H]1CCCc2ccccc21 ZINC000539327584 938842186 /nfs/dbraw/zinc/84/21/86/938842186.db2.gz ZFKKAGKGOHTQBU-WIOPSUGQSA-N 0 3 402.542 4.426 20 0 HIADHN C[C@H](NCC(=O)N1CCO[C@H](c2ccc(F)cc2)C1)c1ccc(-c2ccncc2)cc1 ZINC000539336325 938844028 /nfs/dbraw/zinc/84/40/28/938844028.db2.gz HJGOQQLADOHREX-UUOWRZLLSA-N 0 3 419.500 4.138 20 0 HIADHN Cc1ccccc1[C@H](NCC(=O)Nc1cc(S(C)(=O)=O)ccc1Cl)C(C)(C)C ZINC000539361611 938848752 /nfs/dbraw/zinc/84/87/52/938848752.db2.gz ZYWXEHFZGFHPGO-FQEVSTJZSA-N 0 3 422.978 4.367 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)NCC(=O)Nc2ccc(OC(F)(F)F)cc2)cc1 ZINC000539363932 938849064 /nfs/dbraw/zinc/84/90/64/938849064.db2.gz WUFBIANDXXKIDE-CQSZACIVSA-N 0 3 418.419 4.369 20 0 HIADHN O=C(CN[C@@H](c1cccs1)C1CC1)N1c2ccccc2NC(=O)C[C@H]1C(F)(F)F ZINC000539368996 938849818 /nfs/dbraw/zinc/84/98/18/938849818.db2.gz XMVSYOAAAUZRHT-QFBILLFUSA-N 0 3 423.460 4.095 20 0 HIADHN C[C@H](NCC(=O)N1CCC(OCc2ccccc2)CC1)c1cccc(N2CCCC2)c1 ZINC000539377001 938851257 /nfs/dbraw/zinc/85/12/57/938851257.db2.gz MZLHXYBAFASOSV-NRFANRHFSA-N 0 3 421.585 4.145 20 0 HIADHN C[C@H](NCCN1c2cccc3cccc(c23)S1(=O)=O)c1cccc(N2CCCC2)c1 ZINC000539378349 938851465 /nfs/dbraw/zinc/85/14/65/938851465.db2.gz AAINQAVZFIIMPV-SFHVURJKSA-N 0 3 421.566 4.300 20 0 HIADHN C[C@H](CS(=O)(=O)c1ccccc1)NCc1cccc(CN2CCCCCC2)c1 ZINC000539378245 938851593 /nfs/dbraw/zinc/85/15/93/938851593.db2.gz ZAKBLSHTYAVVRZ-HXUWFJFHSA-N 0 3 400.588 4.015 20 0 HIADHN Cc1cc(NC(=O)CN[C@H](C)c2cccc(N3CCCC3)c2)n(-c2ccc(C)cc2)n1 ZINC000539379306 938851775 /nfs/dbraw/zinc/85/17/75/938851775.db2.gz PZCTVAAFHLXBTM-HXUWFJFHSA-N 0 3 417.557 4.379 20 0 HIADHN CS(=O)(=O)C[C@@H](NCC/C=C\c1ccc(Br)cc1)c1ccccc1 ZINC000539378986 938851782 /nfs/dbraw/zinc/85/17/82/938851782.db2.gz NFNBUIIPIRABCK-SUOMESGTSA-N 0 3 408.361 4.228 20 0 HIADHN C[C@@H](N[C@H](C)c1cccc(N2CCCC2)c1)C(=O)NCCc1c[nH]c2ccccc12 ZINC000539379937 938851828 /nfs/dbraw/zinc/85/18/28/938851828.db2.gz JRFPNDUWKIJUAA-RTBURBONSA-N 0 3 404.558 4.166 20 0 HIADHN COc1cc(N[C@H]2CCCN(Cc3cn(C)nc3-c3ccccc3)C2)cc(OC)c1 ZINC000539406137 938855982 /nfs/dbraw/zinc/85/59/82/938855982.db2.gz YAGYQPUTQGHHOG-FQEVSTJZSA-N 0 3 406.530 4.181 20 0 HIADHN C[C@@H](N[C@H](c1ccc2c(c1)OCCO2)C1CC1)C(=O)Nc1ccc(F)cc1Cl ZINC000539492056 938867822 /nfs/dbraw/zinc/86/78/22/938867822.db2.gz XLGROWMQFJGHCK-ODXCJYRJSA-N 0 3 404.869 4.318 20 0 HIADHN Cn1c2nnc(CN[C@@H](CC3CCCCC3)C(C)(C)C)n2c2ccsc2c1=O ZINC000539492564 938868204 /nfs/dbraw/zinc/86/82/04/938868204.db2.gz CDULWKHFCQYKPH-INIZCTEOSA-N 0 3 401.580 4.117 20 0 HIADHN C[C@H](N[C@@H](c1ccc2c(c1)OCCO2)C1CC1)C(=O)Nc1ccccc1OC(F)F ZINC000539493030 938868213 /nfs/dbraw/zinc/86/82/13/938868213.db2.gz GPHDWGNQYSCZMT-RNODOKPDSA-N 0 3 418.440 4.127 20 0 HIADHN COCCNC(=O)[C@H](CC(C)C)N[C@H](C)c1sc(-c2ccc(F)cc2)nc1C ZINC000539689737 938902139 /nfs/dbraw/zinc/90/21/39/938902139.db2.gz PQJSVTBHXFPGJL-KDOFPFPSSA-N 0 3 407.555 4.086 20 0 HIADHN Cc1cc(C(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)nn1-c1ccc(Cl)cc1 ZINC000539759390 938926029 /nfs/dbraw/zinc/92/60/29/938926029.db2.gz HZSBBHQBCMZLIC-OAQYLSRUSA-N 0 3 408.933 4.181 20 0 HIADHN CCCn1nc(C)c(CN2CCC(C(=O)N(Cc3ccccc3)C3CC3)CC2)c1C ZINC000539816961 938940948 /nfs/dbraw/zinc/94/09/48/938940948.db2.gz HAFNGCGOFADHFW-UHFFFAOYSA-N 0 3 408.590 4.313 20 0 HIADHN CCOc1cc(CN(C)[C@@H](CCO)c2ccccc2)cc(Br)c1OC ZINC000539827162 938948104 /nfs/dbraw/zinc/94/81/04/938948104.db2.gz DJNCARWHSFPDEP-SFHVURJKSA-N 0 3 408.336 4.412 20 0 HIADHN COCCOC1CCN(Cc2ccc(Oc3cc(OC)cc(OC)c3)cc2)CC1 ZINC000539827793 938949120 /nfs/dbraw/zinc/94/91/20/938949120.db2.gz BIGRDMINPCYRBK-UHFFFAOYSA-N 0 3 401.503 4.124 20 0 HIADHN O=C(Nc1cccc(CN2CCC(OCCO)CC2)c1)c1ccc(Cl)cc1Cl ZINC000539861981 938960483 /nfs/dbraw/zinc/96/04/83/938960483.db2.gz DJPOCERLALQWOI-UHFFFAOYSA-N 0 3 423.340 4.219 20 0 HIADHN COc1cc(OC)c(OC)cc1CN1CCC[C@@H](c2nc3c(s2)CCCC3)C1 ZINC000539862605 938960844 /nfs/dbraw/zinc/96/08/44/938960844.db2.gz FCHLWETVBCQUIK-OAHLLOKOSA-N 0 3 402.560 4.427 20 0 HIADHN O=C(Nc1cccc(CN2CCS[C@H]3COCC[C@H]32)c1)c1ccc(Cl)cc1 ZINC000539909760 938976138 /nfs/dbraw/zinc/97/61/38/938976138.db2.gz HNIJCARFHJYBKA-UXHICEINSA-N 0 3 402.947 4.299 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)Cc2ccc(C(F)(F)F)cc2)cc1 ZINC000539931845 938978719 /nfs/dbraw/zinc/97/87/19/938978719.db2.gz MVNNWDWRUJRVIO-HXUWFJFHSA-N 0 3 406.448 4.210 20 0 HIADHN CCOc1ccc(C(=O)N[C@@H](CN2CCCC2)c2ccc(OC)cc2)cc1OCC ZINC000539932620 938979075 /nfs/dbraw/zinc/97/90/75/938979075.db2.gz VHEAIVITIOQWAK-NRFANRHFSA-N 0 3 412.530 4.060 20 0 HIADHN COCC(=O)Nc1cccc(CN[C@@H]2CCCc3ccc(Br)cc32)c1 ZINC000539967494 938982448 /nfs/dbraw/zinc/98/24/48/938982448.db2.gz SMRLOIMCDTZDBS-LJQANCHMSA-N 0 3 403.320 4.201 20 0 HIADHN C[C@H](Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1)c1nc(C2CC2)no1 ZINC000539974578 939028140 /nfs/dbraw/zinc/02/81/40/939028140.db2.gz QTLCZBJQTYUFNB-IBGZPJMESA-N 0 3 417.557 4.485 20 0 HIADHN COc1cccc(COc2cccc(Cl)c2CN[C@H]2CCO[C@]3(CCOC3)C2)c1 ZINC000539976868 939028319 /nfs/dbraw/zinc/02/83/19/939028319.db2.gz FNVOOKDIWCANKE-FDDCHVKYSA-N 0 3 417.933 4.355 20 0 HIADHN COCc1ccc(C(=O)Nc2cccc(N3CCN(CCc4ccccc4)CC3)c2)o1 ZINC000540035518 939045367 /nfs/dbraw/zinc/04/53/67/939045367.db2.gz ZIBNFMPYTOBNRH-UHFFFAOYSA-N 0 3 419.525 4.043 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)c1ccc(-c2noc(C(F)F)n2)cc1 ZINC000540067135 939057256 /nfs/dbraw/zinc/05/72/56/939057256.db2.gz UTVLJNGNVUCVMJ-SFHVURJKSA-N 0 3 412.440 4.241 20 0 HIADHN CCOc1ccc([C@H](C)N[C@@H](C)c2cccc(NS(C)(=O)=O)c2)cc1OCC ZINC000540121526 939080431 /nfs/dbraw/zinc/08/04/31/939080431.db2.gz ZKNPGDKTEULSBR-HOTGVXAUSA-N 0 3 406.548 4.267 20 0 HIADHN COc1ccc([C@H](C)N[C@@H]2CC(=O)N(C)[C@@H]2c2ccc(Cl)c(F)c2)cc1OC ZINC000540139076 939088233 /nfs/dbraw/zinc/08/82/33/939088233.db2.gz KEYXWLPKIYXPCG-LKNMKHRSSA-N 0 3 406.885 4.119 20 0 HIADHN C[C@@H](NC[C@@H](C)S(C)(=O)=O)c1ccc(-c2ccc(Br)cc2)s1 ZINC000540141194 939088558 /nfs/dbraw/zinc/08/85/58/939088558.db2.gz YWOKKFMHCSWEBR-VXGBXAGGSA-N 0 3 402.379 4.261 20 0 HIADHN C[C@@H](NCc1ccccc1CS(=O)(=O)N1CCCC1)c1ccc2c(c1)CCCC2 ZINC000540143820 939089217 /nfs/dbraw/zinc/08/92/17/939089217.db2.gz SMHQENJSDBVDRM-LJQANCHMSA-N 0 3 412.599 4.342 20 0 HIADHN Cc1ccc([C@H](Cn2ccnc2)N[C@H](C)c2cccc(N3CCOCC3)c2)c(C)c1 ZINC000540146199 939090715 /nfs/dbraw/zinc/09/07/15/939090715.db2.gz AZSHOASQYCHMLH-BWKNWUBXSA-N 0 3 404.558 4.429 20 0 HIADHN OCC1(CN[C@@H](Cc2ccccc2F)c2ccccc2Br)CCOCC1 ZINC000540146535 939091422 /nfs/dbraw/zinc/09/14/22/939091422.db2.gz HWTJXCCOTDEQFM-FQEVSTJZSA-N 0 3 422.338 4.251 20 0 HIADHN C[C@@H](NCCOc1ncccc1C(F)(F)F)c1ccc(-n2cncn2)cc1Cl ZINC000540150789 939093048 /nfs/dbraw/zinc/09/30/48/939093048.db2.gz KEILALOXFTUPCL-GFCCVEGCSA-N 0 3 411.815 4.064 20 0 HIADHN COc1ccc(CN[C@@H](C)c2ccc(S(=O)(=O)N3CCCCC3)cc2)cc1Cl ZINC000540157684 939095124 /nfs/dbraw/zinc/09/51/24/939095124.db2.gz DIJYLZVAQRXRGY-INIZCTEOSA-N 0 3 422.978 4.374 20 0 HIADHN C[C@H]1C[C@@H](NC[C@@H](O)COc2ccccc2Br)c2ccsc2S1 ZINC000540165924 939098956 /nfs/dbraw/zinc/09/89/56/939098956.db2.gz YYGCKKZRPLKHKW-YWPYICTPSA-N 0 3 414.390 4.466 20 0 HIADHN O=C(NCCN[C@H]1CCCOc2c(Br)cccc21)c1ccccc1Cl ZINC000540181540 939108416 /nfs/dbraw/zinc/10/84/16/939108416.db2.gz MEHXJJIYTUBYKZ-KRWDZBQOSA-N 0 3 423.738 4.336 20 0 HIADHN Cc1c([C@@H](C)NCc2ccc(NS(C)(=O)=O)cc2)cnn1-c1cccc(Cl)c1 ZINC000540189629 939114698 /nfs/dbraw/zinc/11/46/98/939114698.db2.gz VPQIEBIKNAXBND-CQSZACIVSA-N 0 3 418.950 4.056 20 0 HIADHN CC(=O)Nc1cccc(CN[C@H](C)CC(=O)Nc2ccc(OC(F)(F)F)cc2)c1 ZINC000540191908 939117471 /nfs/dbraw/zinc/11/74/71/939117471.db2.gz XBXGSEUSZQPWJV-CYBMUJFWSA-N 0 3 409.408 4.051 20 0 HIADHN COc1ccc(C(=O)NCCN[C@H](C)c2sc(-c3ccccc3F)nc2C)cc1 ZINC000540195433 939120151 /nfs/dbraw/zinc/12/01/51/939120151.db2.gz SYVZWHOLRWBMOP-CQSZACIVSA-N 0 3 413.518 4.347 20 0 HIADHN COc1ccc(CN[C@H](C)[C@@H](OC)c2ccc(Br)cc2)c(OC)c1OC ZINC000540223524 939139002 /nfs/dbraw/zinc/13/90/02/939139002.db2.gz LNBIOHXCSNQDNP-FZKQIMNGSA-N 0 3 424.335 4.341 20 0 HIADHN COC(=O)c1ccc([C@H](C)N2CCCN(Cc3ccc(C(F)(F)F)cc3)CC2)o1 ZINC000540295783 939185818 /nfs/dbraw/zinc/18/58/18/939185818.db2.gz CHIGQAZREGKLLY-HNNXBMFYSA-N 0 3 410.436 4.354 20 0 HIADHN CC(C)[C@@H](NCC(=O)N1CCC(Cc2ccccc2)CC1)c1ccc2[nH]c(=O)oc2c1 ZINC000540314748 939191460 /nfs/dbraw/zinc/19/14/60/939191460.db2.gz WRCHSKOIUOGFMK-XMMPIXPASA-N 0 3 421.541 4.301 20 0 HIADHN COc1ccc([C@@H](C)N[C@H](C)C(=O)N(C)Cc2ccc(Br)cc2)cc1 ZINC000540331251 939197649 /nfs/dbraw/zinc/19/76/49/939197649.db2.gz RRYSAQYBSDURQN-HUUCEWRRSA-N 0 3 405.336 4.155 20 0 HIADHN CC(C)C[C@H](NCC(=O)N1CCC(C(=O)N2CCCCCC2)CC1)c1ccccc1 ZINC000540342536 939200692 /nfs/dbraw/zinc/20/06/92/939200692.db2.gz GFXIWKMXDTZMCG-QHCPKHFHSA-N 0 3 413.606 4.005 20 0 HIADHN CC(C)c1ccc([C@@H](NCC(=O)N2CCC(C(=O)N(C)C(C)C)CC2)C(C)C)cc1 ZINC000540344029 939201421 /nfs/dbraw/zinc/20/14/21/939201421.db2.gz WXFFTSGNOVZPHK-DEOSSOPVSA-N 0 3 415.622 4.202 20 0 HIADHN C[C@H](NCCc1nc2ccccc2n1C)c1cc2c(cc1Br)OCCO2 ZINC000540375309 939215120 /nfs/dbraw/zinc/21/51/20/939215120.db2.gz AUDFUTGJQQDYGV-ZDUSSCGKSA-N 0 3 416.319 4.000 20 0 HIADHN C[C@H](N[C@@H](C)c1cccc(-n2cccn2)c1)C(=O)Nc1ccc(Br)cc1 ZINC000540388638 939226091 /nfs/dbraw/zinc/22/60/91/939226091.db2.gz RYIGVUZRNHHLBY-GJZGRUSLSA-N 0 3 413.319 4.313 20 0 HIADHN O=C(CN[C@H](c1ccccc1)[C@H]1CCOC1)Nc1cc(C2CC2)nn1-c1ccccc1 ZINC000540389554 939227282 /nfs/dbraw/zinc/22/72/82/939227282.db2.gz OEWMQPLDNPMQRX-NBGIEHNGSA-N 0 3 416.525 4.056 20 0 HIADHN CCN(C(=O)[C@H](C)N[C@H](C)c1ccc(NC(=O)c2ccncc2)cc1)c1ccccc1 ZINC000540396979 939233859 /nfs/dbraw/zinc/23/38/59/939233859.db2.gz MHZDVNYTBOKQHC-MOPGFXCFSA-N 0 3 416.525 4.426 20 0 HIADHN Cc1cc(C)cc([C@H](C)NCC(=O)Nc2ccccc2I)c1 ZINC000540406098 939237255 /nfs/dbraw/zinc/23/72/55/939237255.db2.gz APQBBRROFYZTRD-AWEZNQCLSA-N 0 3 408.283 4.197 20 0 HIADHN C[C@@H](NC[C@@H](O)COc1ccc(Cl)cc1Cl)c1cccc(N2CCCC2=O)c1 ZINC000540408454 939238067 /nfs/dbraw/zinc/23/80/67/939238067.db2.gz BYFSLRJDSVUBOR-RDTXWAMCSA-N 0 3 423.340 4.211 20 0 HIADHN Cc1ccccc1-n1nccc1NC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1 ZINC000540418795 939242005 /nfs/dbraw/zinc/24/20/05/939242005.db2.gz NGOJZGPOARFFBQ-FQEVSTJZSA-N 0 3 403.530 4.309 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)NC(=O)Nc1ccccc1F)c1ccc(-c2cccnc2)cc1 ZINC000540424738 939243391 /nfs/dbraw/zinc/24/33/91/939243391.db2.gz WSPAYYRTUWKEIJ-CVEARBPZSA-N 0 3 406.461 4.275 20 0 HIADHN O=C(CN[C@H](C[C@@H]1CCOC1)c1ccccc1)Nc1ccnn1CC1CCCCC1 ZINC000540432645 939246716 /nfs/dbraw/zinc/24/67/16/939246716.db2.gz JWNBUECZVCSVFC-RBBKRZOGSA-N 0 3 410.562 4.159 20 0 HIADHN CN(Cc1c(F)cccc1Cl)C(=O)CN[C@@H](C[C@H]1CCOC1)c1ccccc1 ZINC000540433872 939247425 /nfs/dbraw/zinc/24/74/25/939247425.db2.gz AAIRSLQGDKPWBN-IERDGZPVSA-N 0 3 404.913 4.195 20 0 HIADHN COc1cc(C(C)=O)ccc1OC[C@H](O)CN[C@H](C)c1ccccc1C(F)(F)F ZINC000540443033 939252021 /nfs/dbraw/zinc/25/20/21/939252021.db2.gz GPWYFIAQUMSKNV-CZUORRHYSA-N 0 3 411.420 4.007 20 0 HIADHN COc1cc(OC)c(OC)cc1CNC(=O)CN[C@@H](c1ccccc1C)C(C)(C)C ZINC000540460159 939261130 /nfs/dbraw/zinc/26/11/30/939261130.db2.gz CEDLDZVPYKBCIE-QHCPKHFHSA-N 0 3 414.546 4.014 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)NCC(=O)Nc2ccccc2C(F)(F)F)cc1 ZINC000540460409 939261226 /nfs/dbraw/zinc/26/12/26/939261226.db2.gz KXJIKALYVHWJRG-AWEZNQCLSA-N 0 3 402.420 4.489 20 0 HIADHN CC(C)OCc1ccccc1CNC(=O)CN[C@@H](C)c1cccc(N2CCCC2)c1 ZINC000540476892 939268198 /nfs/dbraw/zinc/26/81/98/939268198.db2.gz LFKDUYKYINSLAD-FQEVSTJZSA-N 0 3 409.574 4.179 20 0 HIADHN CCN(CC)C(=O)c1ccc(NC(=O)CN[C@@H](C)c2cccc(N3CCCC3)c2)cc1 ZINC000540479126 939268869 /nfs/dbraw/zinc/26/88/69/939268869.db2.gz WAVWATDADYFNST-IBGZPJMESA-N 0 3 422.573 4.058 20 0 HIADHN C[C@H](CCCc1ccccc1)C(=O)Nc1ccc(C(=O)N(C)[C@H]2CCCN(C)C2)cc1 ZINC000540499410 939278110 /nfs/dbraw/zinc/27/81/10/939278110.db2.gz HDXYDAPCFDZJIP-YKSBVNFPSA-N 0 3 421.585 4.450 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N(Cc1ccccc1)CC(C)(C)O)c1ccsc1 ZINC000540529955 939291328 /nfs/dbraw/zinc/29/13/28/939291328.db2.gz DFSJULGVUOXCAZ-FQEVSTJZSA-N 0 3 403.592 4.114 20 0 HIADHN CC(C)(C)C[C@@H](NCc1cccnc1N1CCC(C(N)=O)CC1)c1ccc(F)cc1 ZINC000540594567 939314337 /nfs/dbraw/zinc/31/43/37/939314337.db2.gz MWEDLIBPCACHTP-OAQYLSRUSA-N 0 3 412.553 4.190 20 0 HIADHN COc1ccc([C@@H](C)NCCc2cccc(C(=O)N(C)C)c2)c(Br)c1 ZINC000540594241 939314629 /nfs/dbraw/zinc/31/46/29/939314629.db2.gz PTPVOSWAPVYFHB-CQSZACIVSA-N 0 3 405.336 4.053 20 0 HIADHN C[C@@H](N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1)c1ccc2c(c1)COC2 ZINC000540751602 939359138 /nfs/dbraw/zinc/35/91/38/939359138.db2.gz IJWSOQSRQADSPM-CLOONOSVSA-N 0 3 400.522 4.295 20 0 HIADHN C[C@@H](N[C@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O)c1cccc(CO)c1 ZINC000540778036 939368896 /nfs/dbraw/zinc/36/88/96/939368896.db2.gz ACDMKHAENMQAKJ-QRWLVFNGSA-N 0 3 406.448 4.040 20 0 HIADHN COc1ccc(C2(C(=O)NCCCN3CCc4ccccc4C3)CCCC2)cc1OC ZINC000540786360 939372131 /nfs/dbraw/zinc/37/21/31/939372131.db2.gz IAZIUXYKAKDFTJ-UHFFFAOYSA-N 0 3 422.569 4.080 20 0 HIADHN COc1ccc(C2(C(=O)N[C@@H]3CCN(C)[C@H]3c3ccccc3)CCCC2)cc1OC ZINC000540805477 939378581 /nfs/dbraw/zinc/37/85/81/939378581.db2.gz RCMASRWDPPPEKQ-OFNKIYASSA-N 0 3 408.542 4.077 20 0 HIADHN Cc1cc(NC(=O)N(CCN(C)C)Cc2cccs2)nn1-c1cccc(Cl)c1 ZINC000540836643 939389474 /nfs/dbraw/zinc/38/94/74/939389474.db2.gz FTELOVZCFBVGQA-UHFFFAOYSA-N 0 3 417.966 4.491 20 0 HIADHN C[C@@H](C(=O)N(C)Cc1ccccc1)N1CCC[C@@H](c2nc(C3CCCCC3)n[nH]2)C1 ZINC000540865809 939402267 /nfs/dbraw/zinc/40/22/67/939402267.db2.gz NYAKLKYCVXXDOS-GHTZIAJQSA-N 0 3 409.578 4.079 20 0 HIADHN COc1cccc([C@H]2[C@@H](Nc3cc(C)nc(-c4ccccn4)n3)CCN2C2CC2)c1 ZINC000540872469 939405710 /nfs/dbraw/zinc/40/57/10/939405710.db2.gz VMLUFSREDBWZIU-REWPJTCUSA-N 0 3 401.514 4.246 20 0 HIADHN C[C@]1(NCC(=O)Nc2cc3c(cc2Cl)OCCCO3)CCCc2ccccc21 ZINC000540906939 939415157 /nfs/dbraw/zinc/41/51/57/939415157.db2.gz HCQMTSJARVDVIX-QFIPXVFZSA-N 0 3 400.906 4.281 20 0 HIADHN CC(C)[C@@H](NC[C@H](O)COc1ccc2c(c1)CCC(=O)N2)c1ccc(Cl)cc1F ZINC000540990893 939426860 /nfs/dbraw/zinc/42/68/60/939426860.db2.gz XOVYYWQHBVEKPU-KSFYIVLOSA-N 0 3 420.912 4.090 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)N[C@@H](C)C(=O)N2CCSc3ccccc32)cc1 ZINC000541022949 939432701 /nfs/dbraw/zinc/43/27/01/939432701.db2.gz IYNWCMWLWPRRHK-IRXDYDNUSA-N 0 3 406.555 4.359 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)N[C@H](C)C(=O)N2CCSc3ccccc32)cc1 ZINC000541022947 939432976 /nfs/dbraw/zinc/43/29/76/939432976.db2.gz IYNWCMWLWPRRHK-DLBZAZTESA-N 0 3 406.555 4.359 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)N[C@H](C)C(=O)N2CCSc3ccccc32)cc1 ZINC000541022948 939433101 /nfs/dbraw/zinc/43/31/01/939433101.db2.gz IYNWCMWLWPRRHK-IAGOWNOFSA-N 0 3 406.555 4.359 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)NCC(=O)N[C@@H](c2ccc(C)cc2)C2CC2)cc1 ZINC000541026125 939434302 /nfs/dbraw/zinc/43/43/02/939434302.db2.gz SGFUMQGRDISFGH-BVZFJXPGSA-N 0 3 402.542 4.407 20 0 HIADHN CCN(CC)C(=O)CCC1CCN([C@H](C)C(=O)N[C@@H](C)c2ccc(Cl)cc2)CC1 ZINC000541119049 939466974 /nfs/dbraw/zinc/46/69/74/939466974.db2.gz AYVAZCZASDQQOX-ZWKOTPCHSA-N 0 3 422.013 4.266 20 0 HIADHN Cc1cc(C(C)(C)C)ccc1OC[C@H](O)CN[C@@H](C)c1ccc([S@](C)=O)cc1 ZINC000541117884 939467080 /nfs/dbraw/zinc/46/70/80/939467080.db2.gz RFDGMZKWUVZJRQ-MNUVWUGUSA-N 0 3 403.588 4.120 20 0 HIADHN COc1cccc(F)c1[C@H](C)NCC1(CN[C@@H](C)c2c(F)cccc2OC)COC1 ZINC000541123682 939469356 /nfs/dbraw/zinc/46/93/56/939469356.db2.gz ZXHCWMHVYLJNRH-HOTGVXAUSA-N 0 3 420.500 4.000 20 0 HIADHN CC(=O)c1ccc(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2F)cc1Cl ZINC000541179209 939484496 /nfs/dbraw/zinc/48/44/96/939484496.db2.gz OFHYTKVFZWLJNU-UHFFFAOYSA-N 0 3 409.864 4.417 20 0 HIADHN COc1ccc(NC(=O)C[C@H](C)NCc2csc(Br)c2)c(OC)c1 ZINC000541218854 939486151 /nfs/dbraw/zinc/48/61/51/939486151.db2.gz YLZHFAKWBWUFKJ-NSHDSACASA-N 0 3 413.337 4.035 20 0 HIADHN C[C@@H](CNC(=O)N(C)[C@H](c1ccc(Cl)cc1)C1CCCC1)CN1CCN(C)CC1 ZINC000541248613 939487549 /nfs/dbraw/zinc/48/75/49/939487549.db2.gz DMOQJBRIASTFBN-AVRDEDQJSA-N 0 3 421.029 4.096 20 0 HIADHN C[C@H](CNC(=O)N(C)[C@@H](c1ccc(Cl)cc1)C1CCCC1)CN1CCN(C)CC1 ZINC000541248616 939487605 /nfs/dbraw/zinc/48/76/05/939487605.db2.gz DMOQJBRIASTFBN-XMSQKQJNSA-N 0 3 421.029 4.096 20 0 HIADHN COc1cc(Br)ccc1CCCN1CCC([C@H](O)C(F)(F)F)CC1 ZINC000541352444 939495609 /nfs/dbraw/zinc/49/56/09/939495609.db2.gz ZGIOQJWEPAEKFI-INIZCTEOSA-N 0 3 410.274 4.026 20 0 HIADHN COCC[C@H](Cc1ccco1)NCc1nc(-c2ccc(Br)cc2)c[nH]1 ZINC000541381023 939501952 /nfs/dbraw/zinc/50/19/52/939501952.db2.gz RATACCMWWHGCRB-MRXNPFEDSA-N 0 3 404.308 4.170 20 0 HIADHN O=C(NC[C@H]1CCCN(Cc2cccs2)C1)c1nccnc1Sc1ccccc1 ZINC000541425183 939513031 /nfs/dbraw/zinc/51/30/31/939513031.db2.gz LCDVGQSIJVTTBK-QGZVFWFLSA-N 0 3 424.595 4.331 20 0 HIADHN COc1cc(C[C@H](CO)CN[C@@H](c2cccnc2)c2ccc(F)c(C)c2)cc(OC)c1 ZINC000541544531 939549138 /nfs/dbraw/zinc/54/91/38/939549138.db2.gz YWWQRAJHUCGVBK-UQBPGWFLSA-N 0 3 424.516 4.077 20 0 HIADHN Cc1cc([C@@H](NC[C@H](c2cccc(F)c2)N2CCOCC2)c2cccnc2)ccc1F ZINC000541547122 939551133 /nfs/dbraw/zinc/55/11/33/939551133.db2.gz AHXPRPDPOWGAPE-JWQCQUIFSA-N 0 3 423.507 4.421 20 0 HIADHN CC(C)[C@H](CN[C@H](c1ccc(F)cc1)c1cnc2ccccc2c1)N1CCOCC1 ZINC000541549220 939551421 /nfs/dbraw/zinc/55/14/21/939551421.db2.gz QSZRJAYWMHIMKD-LOSJGSFVSA-N 0 3 407.533 4.410 20 0 HIADHN CC(C)[C@H](CN[C@@H](c1ccc(F)cc1)c1cnc2ccccc2c1)N1CCOCC1 ZINC000541549213 939551689 /nfs/dbraw/zinc/55/16/89/939551689.db2.gz QSZRJAYWMHIMKD-DQEYMECFSA-N 0 3 407.533 4.410 20 0 HIADHN Cc1ccccc1[C@H](CN1CCOCC1)NCc1ccc(COCC(F)(F)F)cc1 ZINC000541551614 939552948 /nfs/dbraw/zinc/55/29/48/939552948.db2.gz PIRVQRLRFJYPMV-QFIPXVFZSA-N 0 3 422.491 4.237 20 0 HIADHN Cc1c([C@H](C)NCC[C@@H]2CCO[C@@H](C)C2)nnn1-c1cccc(Br)c1 ZINC000541558146 939555076 /nfs/dbraw/zinc/55/50/76/939555076.db2.gz MGHRVMJISRXCLP-OFQRWUPVSA-N 0 3 407.356 4.194 20 0 HIADHN Cc1cc([C@@H](NC[C@@H]2CC(=O)N(Cc3ccccc3)C2)c2cccnc2)ccc1F ZINC000541565207 939556462 /nfs/dbraw/zinc/55/64/62/939556462.db2.gz COSPKEOECPWBBP-NBGIEHNGSA-N 0 3 403.501 4.257 20 0 HIADHN O=C(CN[C@H](Cc1ccccc1)c1cccs1)Nc1cccc(C(=O)NC2CC2)c1 ZINC000541593448 939562229 /nfs/dbraw/zinc/56/22/29/939562229.db2.gz JLZUQGMEFMTACM-OAQYLSRUSA-N 0 3 419.550 4.152 20 0 HIADHN O=C(CN[C@H](Cc1ccccc1)c1cccs1)Nc1ccc2c(c1)OCCCO2 ZINC000541596194 939562950 /nfs/dbraw/zinc/56/29/50/939562950.db2.gz LJDIFBCPFRBWBJ-LJQANCHMSA-N 0 3 408.523 4.422 20 0 HIADHN O=C(CN[C@@H](Cc1ccccc1)c1cccs1)NC[C@H]1CCN(c2ccccc2)C1 ZINC000541597221 939562987 /nfs/dbraw/zinc/56/29/87/939562987.db2.gz ODABVMVYPIOSAE-GGAORHGYSA-N 0 3 419.594 4.264 20 0 HIADHN Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)NC[C@H](O)COc1c(C)ccc(C)c1C ZINC000541600638 939564650 /nfs/dbraw/zinc/56/46/50/939564650.db2.gz OWLLGDKWRGIFCJ-QAPCUYQASA-N 0 3 413.484 4.078 20 0 HIADHN C[C@@H](NCC(=O)Nc1ccc(NC(=O)c2cccs2)cc1)[C@H]1COc2ccccc21 ZINC000541694993 939606677 /nfs/dbraw/zinc/60/66/77/939606677.db2.gz GNVCHFMTOQESMS-DNVCBOLYSA-N 0 3 421.522 4.093 20 0 HIADHN CC(C)Oc1cccc(CNC(=O)CN(C)[C@@H]2CCO[C@H](c3ccc(F)cc3)C2)c1 ZINC000541700108 939608371 /nfs/dbraw/zinc/60/83/71/939608371.db2.gz TWQMMAROFQNEOM-GGAORHGYSA-N 0 3 414.521 4.081 20 0 HIADHN COc1cc2[nH]c(CCCN[C@H](c3ccccc3)c3cncnc3)cc2c(OC)c1 ZINC000541734738 939616748 /nfs/dbraw/zinc/61/67/48/939616748.db2.gz RCMGURQBKQQBNW-XMMPIXPASA-N 0 3 402.498 4.287 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@@H]2NCc2cccc(Cn3cccn3)c2)cc1 ZINC000541742153 939618490 /nfs/dbraw/zinc/61/84/90/939618490.db2.gz WDBCXAGIDCFEES-BJKOFHAPSA-N 0 3 423.582 4.115 20 0 HIADHN C[C@H](CS(=O)(=O)c1ccccc1)N[C@H]1CCN(c2ccc(Cl)c(Cl)c2)C1 ZINC000541740559 939618524 /nfs/dbraw/zinc/61/85/24/939618524.db2.gz KCTZLNFHFFEQNK-CABCVRRESA-N 0 3 413.370 4.024 20 0 HIADHN COC[C@](C)(CC(=O)OC)NCc1ccc(-c2ccccc2Br)s1 ZINC000541760342 939623293 /nfs/dbraw/zinc/62/32/93/939623293.db2.gz HGZKFFDOJUKGJW-SFHVURJKSA-N 0 3 412.349 4.235 20 0 HIADHN O=C(CCNCc1cnc(-c2ccccn2)s1)Nc1ccc(Br)cc1 ZINC000541761578 939623622 /nfs/dbraw/zinc/62/36/22/939623622.db2.gz HPQZMSZBWYELCS-UHFFFAOYSA-N 0 3 417.332 4.086 20 0 HIADHN Cn1cc(CNCCC(=O)Nc2ccc(Br)cc2)c(C2CCCCC2)n1 ZINC000541763070 939624136 /nfs/dbraw/zinc/62/41/36/939624136.db2.gz ZUQGEVCSWFTSHU-UHFFFAOYSA-N 0 3 419.367 4.349 20 0 HIADHN CN(C(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1)[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000541825885 939643398 /nfs/dbraw/zinc/64/33/98/939643398.db2.gz PMBQZQPIOQAYOS-KAOXLYBCSA-N 0 3 411.521 4.133 20 0 HIADHN C[C@H](NCC[S@](=O)c1cc(Cl)ccc1Cl)c1ccc([S@@](C)=O)cc1 ZINC000542048452 939699072 /nfs/dbraw/zinc/69/90/72/939699072.db2.gz WZCKACIKAHXTMQ-STXRLABZSA-N 0 3 404.384 4.189 20 0 HIADHN CC(C)(C)Oc1c(F)cc(NC(=O)[C@H]2CCCN(Cc3cccnc3)C2)cc1F ZINC000542072115 939702646 /nfs/dbraw/zinc/70/26/46/939702646.db2.gz DIGWYOJOWZKZOZ-INIZCTEOSA-N 0 3 403.473 4.388 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CCC(CCCn2ccnc2)CC1)c1ccsc1 ZINC000542108952 939716667 /nfs/dbraw/zinc/71/66/67/939716667.db2.gz FZTKBSNZAPUYHX-NRFANRHFSA-N 0 3 417.623 4.230 20 0 HIADHN CC(C)n1ccc(C[C@@H](C)N[C@H](C)c2cc3c(cc2Br)OCCO3)n1 ZINC000542143644 939729155 /nfs/dbraw/zinc/72/91/55/939729155.db2.gz WOSGFQPVKVVAHW-ZIAGYGMSSA-N 0 3 408.340 4.280 20 0 HIADHN C[C@@H](Cc1ccsc1)N1CCN(CCCc2nc(-c3cccs3)no2)CC1 ZINC000542151879 939732618 /nfs/dbraw/zinc/73/26/18/939732618.db2.gz VMSYVBUSTVUJDS-INIZCTEOSA-N 0 3 402.589 4.041 20 0 HIADHN CCCc1c(NC(=O)[C@@H]2CCCN(Cc3cccnc3)C2)cnn1-c1ccccc1 ZINC000542173616 939743859 /nfs/dbraw/zinc/74/38/59/939743859.db2.gz DIPPSGSIURNTRP-HXUWFJFHSA-N 0 3 403.530 4.071 20 0 HIADHN C[C@@H](CC(=O)Nc1ccc(NC(=O)C2CC2)cc1)NCc1ccccc1OC1CCC1 ZINC000542186503 939749399 /nfs/dbraw/zinc/74/93/99/939749399.db2.gz UZPOYFVHNNVCKO-KRWDZBQOSA-N 0 3 421.541 4.473 20 0 HIADHN O[C@@H](CCc1ccccc1)CNCc1cccc(Br)c1OC(F)F ZINC000542313419 939795955 /nfs/dbraw/zinc/79/59/55/939795955.db2.gz QRPVSCIOXXETMD-HNNXBMFYSA-N 0 3 400.263 4.134 20 0 HIADHN O=C(c1ccccc1F)N1CCC(N[C@@H](c2ccc(F)cc2)c2cccnc2)CC1 ZINC000542477406 939829907 /nfs/dbraw/zinc/82/99/07/939829907.db2.gz GAQUFMHSASNXOT-QHCPKHFHSA-N 0 3 407.464 4.344 20 0 HIADHN CC(C)[C@H]1OCCC[C@@H]1CNCc1ncc(Br)cc1Br ZINC000542518204 939836365 /nfs/dbraw/zinc/83/63/65/939836365.db2.gz UCWLAEQFVAMIMZ-IAQYHMDHSA-N 0 3 406.162 4.147 20 0 HIADHN Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)NCCC(=O)Nc1cccc(Cl)c1 ZINC000542528659 939837618 /nfs/dbraw/zinc/83/76/18/939837618.db2.gz CSSPAWCOZDJRLH-LLVKDONJSA-N 0 3 402.848 4.395 20 0 HIADHN Cc1cnc([C@H](C)CNC(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)s1 ZINC000542554484 939842707 /nfs/dbraw/zinc/84/27/07/939842707.db2.gz JKGYAWPXBPSUOD-WBVHZDCISA-N 0 3 406.621 4.389 20 0 HIADHN CC[C@H](NCC(=O)N1N=C(c2cccs2)C[C@@H]1c1cccs1)[C@@H]1CCCO1 ZINC000542566822 939844597 /nfs/dbraw/zinc/84/45/97/939844597.db2.gz NJEJQMLKHQRHPD-UAGQMJEPSA-N 0 3 403.573 4.035 20 0 HIADHN Cc1ccc(CN(C(=O)CN(C)[C@@H]2CCO[C@@H](c3ccc(F)cc3)C2)C2CC2)o1 ZINC000542630258 939850260 /nfs/dbraw/zinc/85/02/60/939850260.db2.gz ASRIEVMIISEJKD-IFMALSPDSA-N 0 3 400.494 4.070 20 0 HIADHN C[C@H](NCC(=O)N[C@H](Cc1ccccc1)c1ccccc1)[C@H]1COc2ccccc21 ZINC000542628147 939850270 /nfs/dbraw/zinc/85/02/70/939850270.db2.gz GMCBKSPQHFEQAC-WUMKDDEVSA-N 0 3 400.522 4.241 20 0 HIADHN Cc1ccc(CN(C(=O)CN(C)[C@H]2CCO[C@H](c3ccc(F)cc3)C2)C2CC2)o1 ZINC000542630261 939850494 /nfs/dbraw/zinc/85/04/94/939850494.db2.gz ASRIEVMIISEJKD-UNMCSNQZSA-N 0 3 400.494 4.070 20 0 HIADHN C[C@H]1N(CC(=O)NCc2ccc(-c3ccc(Cl)cc3)o2)CCC12CCOCC2 ZINC000542647778 939851412 /nfs/dbraw/zinc/85/14/12/939851412.db2.gz CQNKCMRSQNAGNC-MRXNPFEDSA-N 0 3 402.922 4.107 20 0 HIADHN Brc1ccc(N2CC[C@H](CN[C@@H](c3ccccc3)c3cncnc3)C2)cc1 ZINC000542668281 939852858 /nfs/dbraw/zinc/85/28/58/939852858.db2.gz HSFVQLWOPOZLQG-VGSWGCGISA-N 0 3 423.358 4.445 20 0 HIADHN CCOCc1ccc(CN[C@H]2CCCC[C@@H]2S(=O)(=O)c2ccc(C)cc2)cc1 ZINC000542669559 939852941 /nfs/dbraw/zinc/85/29/41/939852941.db2.gz MGTQPBHHAKYLIU-GOTSBHOMSA-N 0 3 401.572 4.406 20 0 HIADHN Cc1csc([C@@H](C)CN[C@H](c2ccc(F)cc2)c2cccc(S(C)(=O)=O)c2)n1 ZINC000542682228 939853822 /nfs/dbraw/zinc/85/38/22/939853822.db2.gz SBTPXRYBLRSBFN-VBKZILBWSA-N 0 3 418.559 4.477 20 0 HIADHN CCN(C(=O)Nc1ncn(C2CCCCC2)n1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000542718146 939856397 /nfs/dbraw/zinc/85/63/97/939856397.db2.gz KXSSLCBFKYIIJM-RXVVDRJESA-N 0 3 410.566 4.473 20 0 HIADHN COc1ccccc1[C@H](C)N(C)C(=O)CN[C@H](C)c1ccc(-n2ccnc2C)cc1 ZINC000542883736 939865356 /nfs/dbraw/zinc/86/53/56/939865356.db2.gz WQJHTXLCLCHNSZ-MSOLQXFVSA-N 0 3 406.530 4.060 20 0 HIADHN C[C@@H](NCc1cccc(C(=O)NCc2ccco2)c1)c1cccc(-n2ccnc2)c1 ZINC000542941326 939882706 /nfs/dbraw/zinc/88/27/06/939882706.db2.gz BIAKTFHWFPHZCC-GOSISDBHSA-N 0 3 400.482 4.246 20 0 HIADHN COc1cc(Br)c(CN[C@@H](C)CCc2n[nH]c3ccccc23)cc1OC ZINC000543016749 939895707 /nfs/dbraw/zinc/89/57/07/939895707.db2.gz LIKNFYLDFVGVQQ-ZDUSSCGKSA-N 0 3 418.335 4.454 20 0 HIADHN CC(C)OC(=O)C1(C(=O)OC(C)C)CC(N[C@H](C)c2ccc(-c3cccnc3)cc2)C1 ZINC000543090026 939936898 /nfs/dbraw/zinc/93/68/98/939936898.db2.gz UQWMUXVOTMLHSE-GOSISDBHSA-N 0 3 424.541 4.451 20 0 HIADHN COC(=O)COc1cccc(CN[C@@H]2CCCc3c(Br)cccc32)c1 ZINC000543103631 939945989 /nfs/dbraw/zinc/94/59/89/939945989.db2.gz SINGAUHMINMGCJ-LJQANCHMSA-N 0 3 404.304 4.168 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3ccc(SC4CC4)cc3)CC2)C[C@@H](C)O1 ZINC000543104583 939946008 /nfs/dbraw/zinc/94/60/08/939946008.db2.gz HAYVGQMMENWNTA-QZTJIDSGSA-N 0 3 402.604 4.293 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)CCc2cc(F)ccc2Br)o1 ZINC000543150486 939973345 /nfs/dbraw/zinc/97/33/45/939973345.db2.gz VLETZASTFUGEJI-UHFFFAOYSA-N 0 3 411.315 4.013 20 0 HIADHN COc1ccc(C(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)cc1OC1CCCC1 ZINC000543155684 939978448 /nfs/dbraw/zinc/97/84/48/939978448.db2.gz UVRUAOWBAHPBMO-OAQYLSRUSA-N 0 3 408.542 4.363 20 0 HIADHN C[C@@H](N[C@H](Cc1ccc(F)cc1)C(N)=O)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000543160158 939981044 /nfs/dbraw/zinc/98/10/44/939981044.db2.gz OJLDOOIYECVHQB-WAIKUNEKSA-N 0 3 410.464 4.291 20 0 HIADHN C[C@H](CN(C)CCC(=O)Nc1ccccc1C(=O)c1ccccc1)c1nccs1 ZINC000543238071 940004386 /nfs/dbraw/zinc/00/43/86/940004386.db2.gz IVSNATALFFLQNG-QGZVFWFLSA-N 0 3 407.539 4.438 20 0 HIADHN CN(C(=O)[C@@H]1CCn2c(cnc2C2CCCCC2)C1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000543332393 940033569 /nfs/dbraw/zinc/03/35/69/940033569.db2.gz HJGGJBDOZNISLX-DHIUTWEWSA-N 0 3 420.601 4.226 20 0 HIADHN O=C(NCCCNc1ccccc1F)Nc1ccc(CCN2CCSCC2)cc1 ZINC000543333839 940034227 /nfs/dbraw/zinc/03/42/27/940034227.db2.gz XIHJUWKQTWUTDP-UHFFFAOYSA-N 0 3 416.566 4.041 20 0 HIADHN C[C@@H](CN(C)C(=O)N[C@@H](CN1CCc2ccccc2C1)C(C)(C)C)c1nccs1 ZINC000543338200 940035374 /nfs/dbraw/zinc/03/53/74/940035374.db2.gz IJTHHQRWFUTSDZ-PXNSSMCTSA-N 0 3 414.619 4.361 20 0 HIADHN O=C(C1CCC(N[C@@H](c2ccccc2)c2ccc(F)cn2)CC1)N1CCSCC1 ZINC000543402871 940052836 /nfs/dbraw/zinc/05/28/36/940052836.db2.gz PIZBVDPIVYVNKT-ZNIKRAEXSA-N 0 3 413.562 4.034 20 0 HIADHN O=S1(=O)CCCC[C@H]1CNCc1ccc(-c2ccc(C(F)(F)F)cc2)s1 ZINC000543412719 940057861 /nfs/dbraw/zinc/05/78/61/940057861.db2.gz NMWRHHOMEMYDRM-INIZCTEOSA-N 0 3 403.491 4.491 20 0 HIADHN C[C@@H]1C[C@H](CCN[C@H](c2cccc(S(C)(=O)=O)c2)c2ccc(F)c(F)c2)CCO1 ZINC000543419046 940059211 /nfs/dbraw/zinc/05/92/11/940059211.db2.gz NHKOWWREWMQRPZ-XCGNWRKASA-N 0 3 423.525 4.253 20 0 HIADHN O=C1[C@@H](N[C@@H]2CCCc3nc(-c4ccccc4)sc32)CCCN1Cc1ccccn1 ZINC000543427277 940061505 /nfs/dbraw/zinc/06/15/05/940061505.db2.gz WNBZXUVVULXMSU-CTNGQTDRSA-N 0 3 418.566 4.363 20 0 HIADHN Cc1ccsc1[C@@H](Cc1ccccc1)NCC(=O)Nc1nnc(-c2ccco2)o1 ZINC000543453488 940067749 /nfs/dbraw/zinc/06/77/49/940067749.db2.gz PNNCXEKAWDKEGW-MRXNPFEDSA-N 0 3 408.483 4.212 20 0 HIADHN COc1ccc(Br)cc1-c1nc(CN[C@H](C)[C@H]2CCCOC2)cs1 ZINC000543507059 940088907 /nfs/dbraw/zinc/08/89/07/940088907.db2.gz NLGATRBQCLZGKS-OLZOCXBDSA-N 0 3 411.365 4.486 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)C(=O)Nc2cccc(C(F)F)c2Cl)c1 ZINC000543523058 940095797 /nfs/dbraw/zinc/09/57/97/940095797.db2.gz YGSMYUVFRRMJIW-UHFFFAOYSA-N 0 3 423.891 4.115 20 0 HIADHN C[C@H](NCC(=O)N1CCc2sccc2[C@H]1c1ccccc1)[C@@H]1COc2ccccc21 ZINC000543557440 940107416 /nfs/dbraw/zinc/10/74/16/940107416.db2.gz MGTYYQPXOPIPKF-SBJAYZTMSA-N 0 3 418.562 4.377 20 0 HIADHN Cc1ccc(NC(=O)[C@H](C)N[C@H](C)[C@H]2COc3ccccc32)c(Br)c1 ZINC000543558185 940107665 /nfs/dbraw/zinc/10/76/65/940107665.db2.gz BTGFIGVRCMURKL-IJEWVQPXSA-N 0 3 403.320 4.239 20 0 HIADHN COc1ccc([C@@H]2CCCCCN2C(=O)CN[C@@H](C)[C@H]2COc3ccccc32)cc1 ZINC000543556894 940107691 /nfs/dbraw/zinc/10/76/91/940107691.db2.gz YYTDBNAYHKUPHX-NMNUPHIUSA-N 0 3 408.542 4.293 20 0 HIADHN COc1ccc([C@@H]2CCCCCN2C(=O)CN[C@H](C)[C@H]2COc3ccccc32)cc1 ZINC000543556898 940108023 /nfs/dbraw/zinc/10/80/23/940108023.db2.gz YYTDBNAYHKUPHX-YSZBQJHXSA-N 0 3 408.542 4.293 20 0 HIADHN C[C@H](c1ccc(F)cc1)N(C)C(=O)CN(C)[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000543558960 940108446 /nfs/dbraw/zinc/10/84/46/940108446.db2.gz OQVYOXJIYNIPFT-NPFVIJTESA-N 0 3 402.485 4.336 20 0 HIADHN CC[C@@H](NCCc1ccc(OCC(=O)Nc2ccc(C)cc2)cc1)c1ccn(C)n1 ZINC000543603424 940127713 /nfs/dbraw/zinc/12/77/13/940127713.db2.gz PRXIVTBNXDFPNL-JOCHJYFZSA-N 0 3 406.530 4.029 20 0 HIADHN COc1ccc(C2(C(=O)NC[C@H](c3cccs3)N3CCCC3)CCC2)cc1OC ZINC000543637469 940144848 /nfs/dbraw/zinc/14/48/48/940144848.db2.gz NNUYSUQSVLUEBL-GOSISDBHSA-N 0 3 414.571 4.140 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)Nc3ccc(Br)c(Cl)c3Cl)[C@@H]2C1 ZINC000543647852 940149557 /nfs/dbraw/zinc/14/95/57/940149557.db2.gz MTCKZAIWVQSLSX-JOYOIKCWSA-N 0 3 407.139 4.314 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)CCc2ccc(OC(F)F)cc2)cc1 ZINC000543713866 940168882 /nfs/dbraw/zinc/16/88/82/940168882.db2.gz LMALMKZIFUUPHC-NRFANRHFSA-N 0 3 418.484 4.183 20 0 HIADHN Cc1cc2c(cc1NC(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1)OCO2 ZINC000543765110 940178739 /nfs/dbraw/zinc/17/87/39/940178739.db2.gz FMMSVOQEHXQZTN-UHFFFAOYSA-N 0 3 423.435 4.338 20 0 HIADHN CC(C)Cc1noc(-c2cc(Cl)ccc2NC(=O)N[C@H](C)C2=CCN(C)CC2)n1 ZINC000543766650 940179643 /nfs/dbraw/zinc/17/96/43/940179643.db2.gz ZXIDDFWXTTULOT-CQSZACIVSA-N 0 3 417.941 4.360 20 0 HIADHN CC(=O)Nc1ccc([C@H](C)N[C@H]2CC(=O)N(c3cccc(C(F)(F)F)c3)C2)cc1 ZINC000543775729 940182567 /nfs/dbraw/zinc/18/25/67/940182567.db2.gz JDMAPVIZEYRMNR-UGSOOPFHSA-N 0 3 405.420 4.120 20 0 HIADHN OC[C@H](NCCOc1ccccc1Br)c1ccc(C(F)(F)F)cc1 ZINC000543806657 940191946 /nfs/dbraw/zinc/19/19/46/940191946.db2.gz DDIUOCMYGPONHJ-HNNXBMFYSA-N 0 3 404.226 4.170 20 0 HIADHN CC(=O)Nc1ccc(OC[C@H](O)CN[C@H](c2ccc(Cl)cc2F)C(C)C)cc1 ZINC000543846949 940207339 /nfs/dbraw/zinc/20/73/39/940207339.db2.gz YLFVFMQISPGETB-UTKZUKDTSA-N 0 3 408.901 4.164 20 0 HIADHN CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H](c2ccc(Cl)cc2F)C(C)C)cc1 ZINC000543846950 940207379 /nfs/dbraw/zinc/20/73/79/940207379.db2.gz YLFVFMQISPGETB-UWJYYQICSA-N 0 3 408.901 4.164 20 0 HIADHN C[C@H](NCCS(=O)(=O)c1ccc(C(C)(C)C)cc1)c1cccc(-n2ccnc2)c1 ZINC000543869404 940217576 /nfs/dbraw/zinc/21/75/76/940217576.db2.gz NWYCAXDKASTGOD-SFHVURJKSA-N 0 3 411.571 4.294 20 0 HIADHN CCN1CC[C@H](NCc2cccc3c2OCCCO3)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000543870517 940218127 /nfs/dbraw/zinc/21/81/27/940218127.db2.gz BQNRTZCGOYPDMJ-RXVVDRJESA-N 0 3 406.448 4.190 20 0 HIADHN CN(CCN(Cc1nnc(C2CCC2)n1C)Cc1ccccc1)Cc1ccccc1 ZINC000543962326 940272659 /nfs/dbraw/zinc/27/26/59/940272659.db2.gz GTVPHDLDXBXCRM-UHFFFAOYSA-N 0 3 403.574 4.217 20 0 HIADHN CCc1cnccc1[C@@H](C)NC[C@@H](O)COc1ccc(Cl)cc1Br ZINC000543981170 940281932 /nfs/dbraw/zinc/28/19/32/940281932.db2.gz GQENBWLHZRLAFN-IUODEOHRSA-N 0 3 413.743 4.150 20 0 HIADHN C[C@@H](CC(=O)Nc1cccc(N2CCCC2)c1)NCc1cc(Cl)cc2c1OCC2 ZINC000543991396 940286305 /nfs/dbraw/zinc/28/63/05/940286305.db2.gz UJXBGHKHKCUUGT-INIZCTEOSA-N 0 3 413.949 4.382 20 0 HIADHN C[C@@H](NCCSc1cc(Cl)ccc1Cl)c1cccc(S(N)(=O)=O)c1 ZINC000543990586 940286526 /nfs/dbraw/zinc/28/65/26/940286526.db2.gz MYIGQEGPGISHAY-LLVKDONJSA-N 0 3 405.372 4.084 20 0 HIADHN O=S(=O)(c1ccccc1CNC1CC(c2ccc(F)cc2)C1)N1CCCCC1 ZINC000544002408 940292877 /nfs/dbraw/zinc/29/28/77/940292877.db2.gz MGRMFKIOMKXJNV-UHFFFAOYSA-N 0 3 402.535 4.036 20 0 HIADHN CC(C)(C)OC(=O)CCCN1CCC(C(=O)N(Cc2ccccc2)C2CC2)CC1 ZINC000544069905 940316662 /nfs/dbraw/zinc/31/66/62/940316662.db2.gz WDWCZQVHXASJRN-UHFFFAOYSA-N 0 3 400.563 4.012 20 0 HIADHN O=C(NC1CC1)[C@@H](NCCc1c[nH]c2ccc(Br)cc12)c1ccccc1 ZINC000544069525 940316681 /nfs/dbraw/zinc/31/66/81/940316681.db2.gz ALBOOMLZWDYWNX-FQEVSTJZSA-N 0 3 412.331 4.082 20 0 HIADHN O=C(NC1CC1)c1ccc(-c2noc([C@@H]3CCCN(Cc4cccc(F)c4)C3)n2)cc1 ZINC000544108308 940328313 /nfs/dbraw/zinc/32/83/13/940328313.db2.gz GADXCZHEXLEGLZ-LJQANCHMSA-N 0 3 420.488 4.148 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)[C@H]1CCn2c(cnc2C2CCCCC2)C1 ZINC000544224206 940359676 /nfs/dbraw/zinc/35/96/76/940359676.db2.gz ASMCKAPEVDXGQI-GOTSBHOMSA-N 0 3 420.601 4.274 20 0 HIADHN CC(C)OCCCC(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1 ZINC000544240239 940364524 /nfs/dbraw/zinc/36/45/24/940364524.db2.gz AHGVIGWMVTVSDI-UHFFFAOYSA-N 0 3 409.574 4.195 20 0 HIADHN CCN1CCN(Cc2ccc(CNC(=O)Nc3ccc(-c4ccc[nH]4)cc3)cc2)CC1 ZINC000544255153 940369962 /nfs/dbraw/zinc/36/99/62/940369962.db2.gz KCYRBQOQBXQNCT-UHFFFAOYSA-N 0 3 417.557 4.141 20 0 HIADHN Cc1cc(NC(=O)NC[C@H]2CCCCS2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000544266227 940373076 /nfs/dbraw/zinc/37/30/76/940373076.db2.gz QPZFCNTYXAHTKX-VQTJNVASSA-N 0 3 413.591 4.046 20 0 HIADHN Cn1cc(CN2CCC[C@@H](C(=O)Nc3ccc(Cl)cn3)C2)c(C2CCCCC2)n1 ZINC000544352588 940398109 /nfs/dbraw/zinc/39/81/09/940398109.db2.gz GIPSYKYWGXJCKX-QGZVFWFLSA-N 0 3 415.969 4.367 20 0 HIADHN Cc1cc([C@@H](NC[C@H](c2ccccc2)N2CCOCC2)c2cccnc2)ccc1F ZINC000544359396 940400885 /nfs/dbraw/zinc/40/08/85/940400885.db2.gz ADJYWMLPASXLPK-JWQCQUIFSA-N 0 3 405.517 4.282 20 0 HIADHN CCCCOc1ccc([C@H](C)N[C@H]2CCCN(Cc3ccccn3)C2=O)cc1OC ZINC000544385008 940407558 /nfs/dbraw/zinc/40/75/58/940407558.db2.gz HLHNDRKLBLNUPF-RXVVDRJESA-N 0 3 411.546 4.111 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(C(C)(C)c4ccccc4Cl)n3)cn2)CC1 ZINC000544388165 940408787 /nfs/dbraw/zinc/40/87/87/940408787.db2.gz LVRAIBFLLFNGQE-UHFFFAOYSA-N 0 3 411.937 4.253 20 0 HIADHN COc1ccc([C@H]2CCCN2C(=O)CN[C@@H](c2cccs2)C2CC2)c(OC)c1 ZINC000544400093 940412353 /nfs/dbraw/zinc/41/23/53/940412353.db2.gz POSQVEACGRRYEH-XMSQKQJNSA-N 0 3 400.544 4.170 20 0 HIADHN Cc1cc([C@H](C)NCC(=O)Nc2cccc(CN3CCSCC3)c2)c(C)s1 ZINC000544401005 940412534 /nfs/dbraw/zinc/41/25/34/940412534.db2.gz UERIUCNSAKGAIW-INIZCTEOSA-N 0 3 403.617 4.203 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(-c4cc(C(F)(F)F)ccc4F)n3)cn2)CC1 ZINC000544406586 940414628 /nfs/dbraw/zinc/41/46/28/940414628.db2.gz VZBTYDDQQOUHNI-UHFFFAOYSA-N 0 3 421.398 4.098 20 0 HIADHN COCc1cccc(CNC(=O)CN[C@@H](Cc2ccccc2)c2sccc2C)c1 ZINC000544415703 940417604 /nfs/dbraw/zinc/41/76/04/940417604.db2.gz NUMGZRYPMTZGIW-QFIPXVFZSA-N 0 3 408.567 4.393 20 0 HIADHN COc1ccc(C2(C(=O)NC[C@H](c3ccccc3)N3CCCC3)CCC2)cc1OC ZINC000544465853 940442687 /nfs/dbraw/zinc/44/26/87/940442687.db2.gz VVFVFNJQWUWHSV-OAQYLSRUSA-N 0 3 408.542 4.079 20 0 HIADHN Cc1nccn1CCCCN[C@@H](C)c1nc(-c2ccc(Br)cc2)no1 ZINC000544511449 940463306 /nfs/dbraw/zinc/46/33/06/940463306.db2.gz FPJFHRWUUHSQDA-ZDUSSCGKSA-N 0 3 404.312 4.135 20 0 HIADHN CCOc1ccc([C@@H]2CCCN2C(=O)CN[C@H](C)[C@@H]2Oc3ccccc3[C@H]2C)cc1 ZINC000544517900 940469348 /nfs/dbraw/zinc/46/93/48/940469348.db2.gz IKRSHMLIEMVNGG-DPCXZWJJSA-N 0 3 408.542 4.292 20 0 HIADHN COc1ccc(-c2csc(NC(=O)[C@H](C)N[C@H](C)[C@@H]3COc4ccccc43)n2)cc1 ZINC000544526694 940471773 /nfs/dbraw/zinc/47/17/73/940471773.db2.gz BEMXBEOBQYLMEP-VCBZYWHSSA-N 0 3 423.538 4.300 20 0 HIADHN Cc1ccc([C@H](NC(=O)CN[C@@H](C)[C@H]2COc3ccccc32)c2cccs2)cc1 ZINC000544528184 940472151 /nfs/dbraw/zinc/47/21/51/940472151.db2.gz GXGPIONFTDBKEO-IQOKHDRSSA-N 0 3 406.551 4.416 20 0 HIADHN Cc1cc(Br)ccc1NC(=O)CCNCc1cc(-c2ccccc2)n[nH]1 ZINC000544600592 940487912 /nfs/dbraw/zinc/48/79/12/940487912.db2.gz GBSSUMFZEWVTNZ-UHFFFAOYSA-N 0 3 413.319 4.266 20 0 HIADHN CCS(=O)(=O)N1CCC(CN[C@@H](c2ccc(F)cc2)c2ccccc2Cl)CC1 ZINC000544601914 940488279 /nfs/dbraw/zinc/48/82/79/940488279.db2.gz FAPVXGARRBKMER-NRFANRHFSA-N 0 3 424.969 4.220 20 0 HIADHN COc1cc2c(cc1CN[C@@H](C)[C@@H](OC)c1ccc(Br)cc1)OCO2 ZINC000544709563 940505503 /nfs/dbraw/zinc/50/55/03/940505503.db2.gz DLDKVGOFYITCHY-HXPMCKFVSA-N 0 3 408.292 4.052 20 0 HIADHN CCc1nc2c(s1)[C@H](N(C)C(=O)N[C@H]1CCN(Cc3ccccc3)[C@H]1C)CCC2 ZINC000563963756 945331493 /nfs/dbraw/zinc/33/14/93/945331493.db2.gz IKBXQKFQMSOANB-XKGZKEIXSA-N 0 3 412.603 4.387 20 0 HIADHN CSCc1ccccc1NC(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000545429221 940569420 /nfs/dbraw/zinc/56/94/20/940569420.db2.gz XGXABUDTKFVKRT-HDICACEKSA-N 0 3 405.608 4.293 20 0 HIADHN CCN1C(=O)CCc2cc(NC(=O)NC[C@@H](c3cccs3)N3CCCC3)ccc21 ZINC000545435307 940569897 /nfs/dbraw/zinc/56/98/97/940569897.db2.gz PLGRZUINSPAHBG-IBGZPJMESA-N 0 3 412.559 4.006 20 0 HIADHN COc1ccccc1C1(CNC(=O)N(Cc2ccccc2)C2CCN(C)CC2)CCC1 ZINC000545447847 940570359 /nfs/dbraw/zinc/57/03/59/940570359.db2.gz DTOVMZMAAZSKPU-UHFFFAOYSA-N 0 3 421.585 4.423 20 0 HIADHN CCN(C(=O)c1cccc(NC(=O)[C@@H]2C[C@H]2C)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000545476607 940571388 /nfs/dbraw/zinc/57/13/88/940571388.db2.gz DXFZOSFOYKESFX-SXSPYAJSSA-N 0 3 405.542 4.018 20 0 HIADHN CCN(C(=O)Cc1csc(-c2ccc(C)o2)n1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000545476046 940571423 /nfs/dbraw/zinc/57/14/23/940571423.db2.gz DBMNUDROMXPTFU-HXUWFJFHSA-N 0 3 409.555 4.377 20 0 HIADHN CCN(C(=O)c1ccc(-n2nc(C)cc2C)cc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000545476993 940571428 /nfs/dbraw/zinc/57/14/28/940571428.db2.gz SICBRPQFTPUAME-DEOSSOPVSA-N 0 3 402.542 4.226 20 0 HIADHN CCN(C(=O)Cc1csc(-c2ccc(C)o2)n1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000545476045 940571456 /nfs/dbraw/zinc/57/14/56/940571456.db2.gz DBMNUDROMXPTFU-FQEVSTJZSA-N 0 3 409.555 4.377 20 0 HIADHN CC(C)(C)[C@@H](CCO)NCC(=O)N1N=C(c2cc3ccccc3o2)C[C@H]1c1ccco1 ZINC000545517310 940572853 /nfs/dbraw/zinc/57/28/53/940572853.db2.gz KVTFDZLCIYQQAM-PGRDOPGGSA-N 0 3 423.513 4.090 20 0 HIADHN C[C@@H](c1ccc(Cl)s1)c1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1 ZINC000545650281 940578878 /nfs/dbraw/zinc/57/88/78/940578878.db2.gz ZDDRRWHDKPNSRS-ZDUSSCGKSA-N 0 3 403.939 4.140 20 0 HIADHN CCc1ccc([C@H](C)Cc2nc(-c3ccc(N4CCCN(C)CC4)nc3)no2)cc1 ZINC000545653976 940578978 /nfs/dbraw/zinc/57/89/78/940578978.db2.gz NACKIPSSZMTTRE-GOSISDBHSA-N 0 3 405.546 4.182 20 0 HIADHN COc1ccc(COCc2noc([C@@H]3CCCN(Cc4cccc(F)c4)C3)n2)cc1 ZINC000545681359 940580447 /nfs/dbraw/zinc/58/04/47/940580447.db2.gz RBJRHGGRXKAZIZ-LJQANCHMSA-N 0 3 411.477 4.314 20 0 HIADHN CC(C)c1nc(Cc2noc(-c3ccc(CN4CCSCC4)cc3)n2)cs1 ZINC000545684389 940580552 /nfs/dbraw/zinc/58/05/52/940580552.db2.gz TVPOVYRJVJGTON-UHFFFAOYSA-N 0 3 400.573 4.456 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)c1cn(C)nc1-c1ccc(Cl)s1)c1ccco1 ZINC000563987788 945337715 /nfs/dbraw/zinc/33/77/15/945337715.db2.gz MGXFPOTZOGGUHY-TZMCWYRMSA-N 0 3 406.939 4.254 20 0 HIADHN COc1cccc(CN(Cc2cncc(Br)c2)C2CCC(O)CC2)c1 ZINC000545947635 940663348 /nfs/dbraw/zinc/66/33/48/940663348.db2.gz PXBVDXNOCLASOA-UHFFFAOYSA-N 0 3 405.336 4.158 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@H](c3ccccc3)C(F)(F)F)c2)CC1 ZINC000546038123 940679447 /nfs/dbraw/zinc/67/94/47/940679447.db2.gz HQDGAKUNKNWAHB-LJQANCHMSA-N 0 3 406.452 4.254 20 0 HIADHN Cc1onc(-c2ccccn2)c1C(=O)NC[C@H](c1ccc(CC(C)C)cc1)N(C)C ZINC000563996693 945340650 /nfs/dbraw/zinc/34/06/50/945340650.db2.gz WNTLXBVLRUNCOQ-OAQYLSRUSA-N 0 3 406.530 4.276 20 0 HIADHN CCN1c2ccc(NC(=O)N(CCCc3ccccc3)CCN(C)C)cc2CCC1=O ZINC000546139617 940710777 /nfs/dbraw/zinc/71/07/77/940710777.db2.gz BMWGVTBQVYEMJG-UHFFFAOYSA-N 0 3 422.573 4.014 20 0 HIADHN CCN(C(=O)c1cnn(-c2ccc(F)cc2F)c1C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000546183606 940723191 /nfs/dbraw/zinc/72/31/91/940723191.db2.gz RXHGIBKFCDGPHP-HXUWFJFHSA-N 0 3 424.495 4.196 20 0 HIADHN CCCCSc1ccc(C(=O)NC2CCN(CCOC)CC2)cc1C(F)(F)F ZINC000546200925 940727758 /nfs/dbraw/zinc/72/77/58/940727758.db2.gz JVCKEZWYMRMVAM-UHFFFAOYSA-N 0 3 418.525 4.438 20 0 HIADHN CCO[C@@H]1C[C@@H](NCc2c(C)nn(Cc3ccccc3Cl)c2C)[C@@]12CCCO2 ZINC000546255726 940749852 /nfs/dbraw/zinc/74/98/52/940749852.db2.gz KPKBRSRHNWNZMM-VSKRKVRLSA-N 0 3 403.954 4.018 20 0 HIADHN CCO[C@@H]1C[C@H](NCc2c(C)nn(Cc3ccccc3Cl)c2C)[C@@]12CCCO2 ZINC000546255720 940750047 /nfs/dbraw/zinc/75/00/47/940750047.db2.gz KPKBRSRHNWNZMM-BDTNDASRSA-N 0 3 403.954 4.018 20 0 HIADHN CC1CCN([C@H](CNC(=O)N2CC3(CCC3)[C@@H]2[C@@H]2CCCO2)c2cccs2)CC1 ZINC000564013296 945349403 /nfs/dbraw/zinc/34/94/03/945349403.db2.gz JMRVPKDRLIIBES-DYXWJJEUSA-N 0 3 417.619 4.264 20 0 HIADHN Cc1noc(C)c1CO[C@H]1CCN(Cc2c(-c3ccccc3)nc3ccccn32)C1 ZINC000546588911 940859064 /nfs/dbraw/zinc/85/90/64/940859064.db2.gz LXQNKDGSGKLPMK-FQEVSTJZSA-N 0 3 402.498 4.397 20 0 HIADHN Cc1ccc([C@@H](Cc2ccccc2Br)NC[C@@H](C)S(C)(=O)=O)cc1 ZINC000546626686 940862253 /nfs/dbraw/zinc/86/22/53/940862253.db2.gz HUGYDLHDELNMJD-DNVCBOLYSA-N 0 3 410.377 4.064 20 0 HIADHN CCO[C@@H]1C[C@H](N[C@H](C)c2ccc(OC[C@H]3CCCCO3)c(F)c2)[C@]12CCCO2 ZINC000546869641 940898419 /nfs/dbraw/zinc/89/84/19/940898419.db2.gz FILAJKMKACLLNU-SSPLDBJCSA-N 0 3 407.526 4.151 20 0 HIADHN CCO[C@@H]1C[C@H](N[C@H](C)c2ccc(OC[C@H]3CCCCO3)c(F)c2)[C@@]12CCCO2 ZINC000546869639 940898598 /nfs/dbraw/zinc/89/85/98/940898598.db2.gz FILAJKMKACLLNU-OVMSGKMMSA-N 0 3 407.526 4.151 20 0 HIADHN CS(=O)(=O)Cc1ccc(CN[C@H](Cc2cccnc2)c2ccc(Cl)cc2)cc1 ZINC000546873469 940899164 /nfs/dbraw/zinc/89/91/64/940899164.db2.gz ZJUMPFWWAYALEW-JOCHJYFZSA-N 0 3 414.958 4.353 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(-c4scnc4C4CCCC4)n3)cn2)CC1 ZINC000547069309 940982384 /nfs/dbraw/zinc/98/23/84/940982384.db2.gz RRAFXNZZNLTEDY-UHFFFAOYSA-N 0 3 410.547 4.055 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(-c4ccc(Cl)c(Cl)c4)n3)cn2)CC1 ZINC000547071765 940983575 /nfs/dbraw/zinc/98/35/75/940983575.db2.gz DAKXSRBJOIGYCU-UHFFFAOYSA-N 0 3 404.301 4.247 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)c3cnn(-c4ccccc4)c3C(C)C)c2)CC1 ZINC000547431607 941062138 /nfs/dbraw/zinc/06/21/38/941062138.db2.gz BCJPYMGYAMHBOI-UHFFFAOYSA-N 0 3 417.557 4.390 20 0 HIADHN CCN(C(=O)Nc1ccc(-n2nc(C)cc2C)nc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000547786526 941075876 /nfs/dbraw/zinc/07/58/76/941075876.db2.gz VCWKLNDRIVIAJE-JOCHJYFZSA-N 0 3 418.545 4.012 20 0 HIADHN COC[C@@H](CC(C)C)N[C@H](c1cccc(S(C)(=O)=O)c1)c1ccc(C)cc1C ZINC000547867654 941079275 /nfs/dbraw/zinc/07/92/75/941079275.db2.gz CNPZKPSCRKZDRR-NFBKMPQASA-N 0 3 403.588 4.447 20 0 HIADHN COc1cc(C)ccc1C(=O)Nc1cc(C)nn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000548049795 941084168 /nfs/dbraw/zinc/08/41/68/941084168.db2.gz DHYCCRSRADMQKC-HXUWFJFHSA-N 0 3 404.514 4.208 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccnc2)C1)N1C[C@H](c2ccccc2)[C@H]2CCCC[C@H]21 ZINC000548253304 941092517 /nfs/dbraw/zinc/09/25/17/941092517.db2.gz HAYGXTYWUXBFQI-ZGFBMJKBSA-N 0 3 403.570 4.478 20 0 HIADHN C[C@H](C(=O)Nc1ccc(Oc2ccc(S(C)(=O)=O)cc2)cc1)N1[C@H](C)CC[C@H]1C ZINC000548372862 941098295 /nfs/dbraw/zinc/09/82/95/941098295.db2.gz DZCDCPMESZBHNE-BRWVUGGUSA-N 0 3 416.543 4.082 20 0 HIADHN Cc1cc(Br)c(F)cc1NC(=O)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000548432552 941103661 /nfs/dbraw/zinc/10/36/61/941103661.db2.gz AQQWPQREIFMHPW-OAHLLOKOSA-N 0 3 406.299 4.142 20 0 HIADHN CN(C)C[C@@H](NC(=O)Nc1ccc(N2CCCC2=O)c(F)c1)c1ccc(Cl)cc1 ZINC000548962743 941134767 /nfs/dbraw/zinc/13/47/67/941134767.db2.gz WXLYUASWTJLJPT-GOSISDBHSA-N 0 3 418.900 4.030 20 0 HIADHN CCOC(=O)CCc1ccc(NC(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)cc1 ZINC000548964587 941134883 /nfs/dbraw/zinc/13/48/83/941134883.db2.gz VFSUDIMIVLDBCL-FQEVSTJZSA-N 0 3 417.937 4.260 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1ccc2nnc(C3CCC3)n2c1 ZINC000549002559 941141319 /nfs/dbraw/zinc/14/13/19/941141319.db2.gz IZCXEGBOVUMTPS-GOSISDBHSA-N 0 3 418.545 4.125 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2ccc(NC(=O)CC(F)(F)F)cc2)[C@H]1c1ccccc1 ZINC000549063267 941151251 /nfs/dbraw/zinc/15/12/51/941151251.db2.gz JTKZZKGEUPCLNN-PKOBYXMFSA-N 0 3 420.435 4.144 20 0 HIADHN CCN1CC[C@@H](NCC(=O)Nc2cc(F)ccc2F)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000549111345 941160750 /nfs/dbraw/zinc/16/07/50/941160750.db2.gz PLUOQMOJIVTNAV-XLIONFOSSA-N 0 3 411.855 4.121 20 0 HIADHN CCN1CC[C@@H](NCC(=O)N(C(C)C)C2CCCC2)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000549115288 941161325 /nfs/dbraw/zinc/16/13/25/941161325.db2.gz BFIMMRJUGZVUGG-DENIHFKCSA-N 0 3 411.512 4.008 20 0 HIADHN CCc1ccccc1NC(=O)[C@H](C)N[C@H]1CCN(C2CC2)[C@@H]1c1cccc(OC)c1 ZINC000549118403 941161878 /nfs/dbraw/zinc/16/18/78/941161878.db2.gz HTYBGQGXIJUNRO-YRUKQIKQSA-N 0 3 407.558 4.152 20 0 HIADHN CN(C)C[C@@H](NC(=O)NCc1csc(-c2ccco2)n1)c1ccc(Cl)cc1 ZINC000549127218 941163041 /nfs/dbraw/zinc/16/30/41/941163041.db2.gz BMEMXQZGCIIKDN-MRXNPFEDSA-N 0 3 404.923 4.159 20 0 HIADHN CCOc1c(Cl)cc(CNC[C@@H](O)COc2ccc3ccccc3c2)cc1OC ZINC000549152351 941166064 /nfs/dbraw/zinc/16/60/64/941166064.db2.gz PIROERQKBHQQCS-LJQANCHMSA-N 0 3 415.917 4.430 20 0 HIADHN CCCN(C[C@H]1CCN(C(=O)c2ccccc2)C1)[C@@H](C)C(=O)Nc1ccccc1C ZINC000549172479 941168391 /nfs/dbraw/zinc/16/83/91/941168391.db2.gz JIACMXJVHXGGOH-LEWJYISDSA-N 0 3 407.558 4.196 20 0 HIADHN CCCN(C[C@H]1CCN(C(=O)c2ccccc2)C1)[C@H](C)C(=O)Nc1ccccc1C ZINC000549172480 941168413 /nfs/dbraw/zinc/16/84/13/941168413.db2.gz JIACMXJVHXGGOH-NHCUHLMSSA-N 0 3 407.558 4.196 20 0 HIADHN CN(C)C[C@H](NC(=O)NCc1ccsc1Br)c1ccc(Cl)cc1 ZINC000549181877 941169061 /nfs/dbraw/zinc/16/90/61/941169061.db2.gz CYYBLFAYAGTGIB-AWEZNQCLSA-N 0 3 416.772 4.266 20 0 HIADHN Cc1[nH]c(=O)c(C(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)cc1-c1ccccc1 ZINC000549229669 941172361 /nfs/dbraw/zinc/17/23/61/941172361.db2.gz CLFZPQIJEPVMQF-OAQYLSRUSA-N 0 3 409.917 4.449 20 0 HIADHN COc1cc(C(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)sc1Br ZINC000549242457 941173418 /nfs/dbraw/zinc/17/34/18/941173418.db2.gz YIERYQURSVDSJK-GFCCVEGCSA-N 0 3 417.756 4.205 20 0 HIADHN CC(C)c1noc(Cc2ccc(NC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)cc2)n1 ZINC000549369046 941183310 /nfs/dbraw/zinc/18/33/10/941183310.db2.gz YWJBIMWIOKDHNH-OAQYLSRUSA-N 0 3 419.529 4.180 20 0 HIADHN Cc1ccc2nc(CN(C)[C@@H]3CCCN(Cc4cn5cc(C)ccc5n4)CC3)cn2c1 ZINC000549398006 941185961 /nfs/dbraw/zinc/18/59/61/941185961.db2.gz SRHHFGGMJNGJJO-HSZRJFAPSA-N 0 3 416.573 4.085 20 0 HIADHN Cn1cc(-c2ccc(CN3CCCC[C@H]3CNC(=O)Nc3ccccc3)s2)cn1 ZINC000549401277 941186326 /nfs/dbraw/zinc/18/63/26/941186326.db2.gz WBRFURNLXYQJCK-IBGZPJMESA-N 0 3 409.559 4.325 20 0 HIADHN CC(C)Cn1c(Cc2ccccn2)nnc1N1CCN(Cc2ccccc2)C(C)(C)C1 ZINC000549439972 941190107 /nfs/dbraw/zinc/19/01/07/941190107.db2.gz HMMSWANFTACYBG-UHFFFAOYSA-N 0 3 418.589 4.021 20 0 HIADHN CCOC(=O)[C@H]1CC[C@H](NCc2ccnc(OCC(F)(F)F)c2)c2ccccc21 ZINC000549523793 941197999 /nfs/dbraw/zinc/19/79/99/941197999.db2.gz LNBJDMULYNQOTF-ROUUACIJSA-N 0 3 408.420 4.294 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)c2ccccc2-c2nc(C(C)C)no2)N(C)C)cc1 ZINC000549530853 941198272 /nfs/dbraw/zinc/19/82/72/941198272.db2.gz FQMZHLCTTRDVKY-OAQYLSRUSA-N 0 3 406.530 4.455 20 0 HIADHN CCOC(=O)[C@H]1CC[C@@H](NCc2ccc(S(C)(=O)=O)c(Cl)c2)c2ccccc21 ZINC000549624377 941201908 /nfs/dbraw/zinc/20/19/08/941201908.db2.gz JAJDOTIXFDPZLD-PKOBYXMFSA-N 0 3 421.946 4.015 20 0 HIADHN O=C(NCCN1CCCC1)c1ccc(NCc2cnc(-c3ccccc3)s2)cc1 ZINC000549682548 941204384 /nfs/dbraw/zinc/20/43/84/941204384.db2.gz VEAQYCOBQBNUNP-UHFFFAOYSA-N 0 3 406.555 4.248 20 0 HIADHN CCc1oc(CN2CCC[C@@H](c3nc(-c4ccc(F)cc4)no3)C2)cc1C(=O)OC ZINC000549802603 941207717 /nfs/dbraw/zinc/20/77/17/941207717.db2.gz UQYUYLBYLMYTJO-OAHLLOKOSA-N 0 3 413.449 4.197 20 0 HIADHN C[C@@H](NCc1ccc(I)cc1)c1ccc(-n2cccn2)c(F)c1 ZINC000549841018 941211231 /nfs/dbraw/zinc/21/12/31/941211231.db2.gz RKNUTFZPADHRMZ-CYBMUJFWSA-N 0 3 421.257 4.467 20 0 HIADHN O=S(=O)(CCCNCc1cccc(OC(F)(F)F)c1)c1ccc(Cl)cc1 ZINC000549934337 941242493 /nfs/dbraw/zinc/24/24/93/941242493.db2.gz HRDXCTIYLITTMJ-UHFFFAOYSA-N 0 3 407.841 4.192 20 0 HIADHN Cc1cc(-c2noc([C@@H](C)N[C@H](C)C3CCN(CC(F)(F)F)CC3)n2)ccc1F ZINC000550023998 941267532 /nfs/dbraw/zinc/26/75/32/941267532.db2.gz HZDJCUZLAQWUGO-ZIAGYGMSSA-N 0 3 414.447 4.498 20 0 HIADHN CC(C)[C@]1(CO)CCCN(CC(=O)N2CCC[C@H]2c2ccc(Cl)c(Cl)c2)C1 ZINC000550063366 941277260 /nfs/dbraw/zinc/27/72/60/941277260.db2.gz LQDWZRVBFWDTAY-PZJWPPBQSA-N 0 3 413.389 4.387 20 0 HIADHN O=C(NCCN1CCCC1)c1ccc(NCc2c[nH]nc2-c2ccc(Cl)cc2)cc1 ZINC000550065765 941278274 /nfs/dbraw/zinc/27/82/74/941278274.db2.gz BNZIXHYTLSPXGM-UHFFFAOYSA-N 0 3 423.948 4.168 20 0 HIADHN C[C@H]1CCN(C(=O)c2cc(N(C)C)c3ccccc3n2)CCN1Cc1ccccc1 ZINC000550159316 941291174 /nfs/dbraw/zinc/29/11/74/941291174.db2.gz JFZGBFPXERZOPG-IBGZPJMESA-N 0 3 402.542 4.037 20 0 HIADHN Cc1coc(C)c1C(=O)NCCCCN1CCN(c2cccc(C(F)(F)F)c2)CC1 ZINC000550222281 941301005 /nfs/dbraw/zinc/30/10/05/941301005.db2.gz DMOGNLVYQWPMED-UHFFFAOYSA-N 0 3 423.479 4.247 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)NCc1cc2ccccc2s1 ZINC000550594994 941343728 /nfs/dbraw/zinc/34/37/28/941343728.db2.gz QIOJLORGMVBMRX-UHFFFAOYSA-N 0 3 403.498 4.453 20 0 HIADHN COC1(CCN[C@@H](c2cccc(S(C)(=O)=O)c2)c2ccc(F)c(F)c2)CCC1 ZINC000550858543 941374803 /nfs/dbraw/zinc/37/48/03/941374803.db2.gz ALYDMUYNHWIUTR-FQEVSTJZSA-N 0 3 409.498 4.007 20 0 HIADHN COc1ccc([C@H](C)N[C@@H]2CCCN([C@H](C)c3ccccc3F)C2=O)cc1OC ZINC000550860568 941375453 /nfs/dbraw/zinc/37/54/53/941375453.db2.gz MCYISOQYKXQWTH-RZQQEMMASA-N 0 3 400.494 4.246 20 0 HIADHN C[C@H](NC[C@H](c1ccc(C(F)(F)F)cc1)N1CCOCC1)c1cn2ccccc2n1 ZINC000550885531 941379328 /nfs/dbraw/zinc/37/93/28/941379328.db2.gz GJBIGSLGBBHGBY-OXJNMPFZSA-N 0 3 418.463 4.077 20 0 HIADHN COc1cc2c(cc1OC)[C@H](N[C@@H]1CCCN([C@H](C)c3ccc(F)cc3)C1=O)CC2 ZINC000550894397 941379908 /nfs/dbraw/zinc/37/99/08/941379908.db2.gz FAAZPSGGJLRUBF-IPHXSNPTSA-N 0 3 412.505 4.172 20 0 HIADHN CCO[C@@H]1C[C@H](N[C@@H](C)c2sc(-c3ccc(OC)cc3)nc2C)[C@H]1n1cccn1 ZINC000550947190 941384817 /nfs/dbraw/zinc/38/48/17/941384817.db2.gz ZCMVTTZVRFOCFZ-VVHHDAOASA-N 0 3 412.559 4.393 20 0 HIADHN Cc1cc(N2CCCC[C@@H]2C)ccc1NS(=O)(=O)c1ccc(CN(C)C)cc1 ZINC000551017651 941395769 /nfs/dbraw/zinc/39/57/69/941395769.db2.gz UZVMTJMCEXKFJQ-SFHVURJKSA-N 0 3 401.576 4.236 20 0 HIADHN NS(=O)(=O)c1ccc2c(c1)CCC[C@@H]2NCc1ccc(OC2CCCCC2)cc1 ZINC000551029770 941397532 /nfs/dbraw/zinc/39/75/32/941397532.db2.gz RHIYWNSPRCAFJC-QHCPKHFHSA-N 0 3 414.571 4.213 20 0 HIADHN O=C(Nc1ccc(Oc2cccnc2)nc1)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000551028097 941397595 /nfs/dbraw/zinc/39/75/95/941397595.db2.gz RLUHIKYYTINUCR-NRFANRHFSA-N 0 3 403.486 4.228 20 0 HIADHN C[N@H+](CCCOc1ccccc1)Cc1cccc([N-]S(=O)(=O)c2ccccc2)c1 ZINC000551065875 941403979 /nfs/dbraw/zinc/40/39/79/941403979.db2.gz ZFVZEGAAMIAKHP-UHFFFAOYSA-N 0 3 410.539 4.388 20 0 HIADHN C[N@@H+](CCCOc1ccccc1)Cc1cccc([N-]S(=O)(=O)c2ccccc2)c1 ZINC000551065875 941403980 /nfs/dbraw/zinc/40/39/80/941403980.db2.gz ZFVZEGAAMIAKHP-UHFFFAOYSA-N 0 3 410.539 4.388 20 0 HIADHN CN1CC[C@H](NCC(=O)Nc2cc(Cl)ccc2Cl)[C@H]1c1ccc(F)c(F)c1 ZINC000551097704 941409329 /nfs/dbraw/zinc/40/93/29/941409329.db2.gz QRKZWVLJWXNALG-QFBILLFUSA-N 0 3 414.283 4.245 20 0 HIADHN CN1CC[C@@H](NCC(=O)Nc2cc(Cl)ccc2Cl)[C@H]1c1ccc(F)c(F)c1 ZINC000551097705 941409403 /nfs/dbraw/zinc/40/94/03/941409403.db2.gz QRKZWVLJWXNALG-VQIMIIECSA-N 0 3 414.283 4.245 20 0 HIADHN COc1ccc(-c2nc(C)c(C(=O)Nc3ccccc3CN(C)C)s2)cc1OC ZINC000551101870 941409756 /nfs/dbraw/zinc/40/97/56/941409756.db2.gz WHSFHVUAKMVUGF-UHFFFAOYSA-N 0 3 411.527 4.450 20 0 HIADHN CCCN(C)[C@H](CN[C@H](c1nc[nH]n1)c1ccc(F)cc1)c1ccc(Cl)cc1 ZINC000551197368 941426431 /nfs/dbraw/zinc/42/64/31/941426431.db2.gz NSXVRKZPDMWTNP-UXHICEINSA-N 0 3 401.917 4.359 20 0 HIADHN Cc1n[nH]cc1C1CCN(C(=O)NC[C@@H](c2ccccc2)N2CCC(C)CC2)CC1 ZINC000551268390 941439931 /nfs/dbraw/zinc/43/99/31/941439931.db2.gz CUNJBUHYKFPCHE-QHCPKHFHSA-N 0 3 409.578 4.080 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(Cl)cc2)CC1)c1cc(F)ccc1Cl ZINC000551300722 941446842 /nfs/dbraw/zinc/44/68/42/941446842.db2.gz ZVEWZKYHDLMELI-UHFFFAOYSA-N 0 3 411.304 4.406 20 0 HIADHN CN(C(=O)Nc1ccc(Oc2cccnc2)nc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000551393077 941468604 /nfs/dbraw/zinc/46/86/04/941468604.db2.gz DGDJEIBIMHYULX-NRFANRHFSA-N 0 3 417.513 4.397 20 0 HIADHN Fc1ccc([C@H](NC[C@@H]2CN(Cc3ccccc3)CCCO2)c2ccccn2)cc1 ZINC000551393225 941468626 /nfs/dbraw/zinc/46/86/26/941468626.db2.gz AGJLUXOERZGPBN-NOZRDPDXSA-N 0 3 405.517 4.191 20 0 HIADHN O[C@H](CNCc1cc(Cl)c2c(c1)OCCCO2)COc1ccc2ccccc2c1 ZINC000551523647 941494581 /nfs/dbraw/zinc/49/45/81/941494581.db2.gz AFWXJUZEZIJNHG-LJQANCHMSA-N 0 3 413.901 4.184 20 0 HIADHN CS(=O)(=O)Nc1ccc(CNCc2cnc(-c3ccc(Cl)cc3)s2)cc1 ZINC000551537042 941497626 /nfs/dbraw/zinc/49/76/26/941497626.db2.gz ZKMDRGRYMNUNFB-UHFFFAOYSA-N 0 3 407.948 4.125 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)CCc2nc(C)c(-c3ccccc3)o2)cc1 ZINC000551537307 941497698 /nfs/dbraw/zinc/49/76/98/941497698.db2.gz OQRXOSPDBVRRBK-NRFANRHFSA-N 0 3 407.514 4.010 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)c2cc(-c3ccccn3)ccc2Cl)cc1 ZINC000551537975 941497733 /nfs/dbraw/zinc/49/77/33/941497733.db2.gz DKPKHVHUTQMOIQ-QFIPXVFZSA-N 0 3 409.917 4.443 20 0 HIADHN Cc1ccc(-n2cc(CN3CC[C@H](N4CCCC4=O)C3)c(-c3ccc(F)cc3)n2)cc1 ZINC000551550419 941500099 /nfs/dbraw/zinc/50/00/99/941500099.db2.gz OCYLNEGVEXWNSD-QHCPKHFHSA-N 0 3 418.516 4.184 20 0 HIADHN COc1ccc([C@H](CN(C)C)N[C@H](C)c2ccc(I)cc2)cc1 ZINC000551555403 941500427 /nfs/dbraw/zinc/50/04/27/941500427.db2.gz XHKOYOSHFWWOFQ-KUHUBIRLSA-N 0 3 424.326 4.253 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)c1cc(Cl)c(F)cc1Cl ZINC000551621690 941513942 /nfs/dbraw/zinc/51/39/42/941513942.db2.gz GTXXHCQHHSTNFH-UHFFFAOYSA-N 0 3 411.304 4.019 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N1CCC(CC(F)(F)F)CC1 ZINC000551647377 941518383 /nfs/dbraw/zinc/51/83/83/941518383.db2.gz ASPITLSHZUQKMI-UHFFFAOYSA-N 0 3 415.422 4.166 20 0 HIADHN COC(=O)[C@H](Cc1ccccc1)[C@@H](C)N[C@H](C)C(=O)Nc1cc(Cl)ccc1Cl ZINC000551718113 941532734 /nfs/dbraw/zinc/53/27/34/941532734.db2.gz OPPBREDQUIUBSG-CKEIUWERSA-N 0 3 423.340 4.330 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)C(=O)NCc1ccc(C2CCCCC2)cc1 ZINC000551762864 941541034 /nfs/dbraw/zinc/54/10/34/941541034.db2.gz ULNDMBDKBKBEQO-UHFFFAOYSA-N 0 3 423.557 4.059 20 0 HIADHN CC(C)CO[C@H]1C[C@H](NCc2cc(C(F)(F)F)cc(S(C)(=O)=O)c2)C1(C)C ZINC000551781248 941544451 /nfs/dbraw/zinc/54/44/51/941544451.db2.gz WOHOAHICVCVHKX-IRXDYDNUSA-N 0 3 407.498 4.038 20 0 HIADHN Cc1cc([C@@H](C)N[C@H](CN2CCN(C)CC2)c2ccccc2)sc1Br ZINC000552013696 941568542 /nfs/dbraw/zinc/56/85/42/941568542.db2.gz QFTCDFCVUDDOOK-SJLPKXTDSA-N 0 3 422.436 4.458 20 0 HIADHN C[C@@H](NC[C@H]1CC[C@@H](c2nc(C3CC3)no2)O1)c1nc2ccc(Cl)cc2n1C ZINC000552075136 941580223 /nfs/dbraw/zinc/58/02/23/941580223.db2.gz KTAHLFOBVUDLPR-ZLENFMNRSA-N 0 3 401.898 4.058 20 0 HIADHN OCC1([C@H](NCc2cnc3ccc(Br)cn23)c2ccccc2)CCC1 ZINC000552084853 941581642 /nfs/dbraw/zinc/58/16/42/941581642.db2.gz BRELEWOJUYYXOR-LJQANCHMSA-N 0 3 400.320 4.090 20 0 HIADHN C[C@@H](N[C@H](c1cccc(OC(F)(F)F)c1)C1CC1)c1ccc(S(N)(=O)=O)cc1 ZINC000552085862 941581717 /nfs/dbraw/zinc/58/17/17/941581717.db2.gz OWGXHHKMHOUZAP-XIKOKIGWSA-N 0 3 414.449 4.035 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@H](C)N[C@@H](C)c2ccc3n[nH]cc3c2)cc1 ZINC000552098605 941584587 /nfs/dbraw/zinc/58/45/87/941584587.db2.gz JOLLKKGOWCJXCR-HOTGVXAUSA-N 0 3 400.548 4.005 20 0 HIADHN C[C@@H](NC[C@@H](N1CCOCC1)C(F)(F)F)c1ccc(SCC(F)(F)F)cc1 ZINC000552100789 941585258 /nfs/dbraw/zinc/58/52/58/941585258.db2.gz VTBAZNUDYDUODO-IUODEOHRSA-N 0 3 416.431 4.255 20 0 HIADHN O=C(CSc1nccc2ccccc21)N1CCN(c2ccnc3ccccc32)CC1 ZINC000552149292 941593914 /nfs/dbraw/zinc/59/39/14/941593914.db2.gz CSJOMHBBZVZVPK-UHFFFAOYSA-N 0 3 414.534 4.224 20 0 HIADHN OC[C@H](CN[C@H](c1ncc[nH]1)C1CCCCC1)Cc1ccccc1OC(F)(F)F ZINC000552270759 941619337 /nfs/dbraw/zinc/61/93/37/941619337.db2.gz BIIUWXXQMMUBNL-KXBFYZLASA-N 0 3 411.468 4.371 20 0 HIADHN COc1ccc([C@H](Cc2ccncc2)NCc2nc(-c3ccc(F)cc3)n[nH]2)cc1 ZINC000552275906 941620231 /nfs/dbraw/zinc/62/02/31/941620231.db2.gz DORFXGDNCXZAFW-NRFANRHFSA-N 0 3 403.461 4.088 20 0 HIADHN COc1ccc([C@H](Cc2ccncc2)[NH2+]Cc2nnc(-c3ccc(F)cc3)[n-]2)cc1 ZINC000552275906 941620235 /nfs/dbraw/zinc/62/02/35/941620235.db2.gz DORFXGDNCXZAFW-NRFANRHFSA-N 0 3 403.461 4.088 20 0 HIADHN Cc1cc(I)cc(N[C@H]2CCN(Cc3ccccn3)C[C@H]2C)c1 ZINC000552335338 941635176 /nfs/dbraw/zinc/63/51/76/941635176.db2.gz PAIHAQXSLMSNRH-BEFAXECRSA-N 0 3 421.326 4.317 20 0 HIADHN FC(F)(F)c1ccc(Cn2cc(CN3CC4(CCOCC4)[C@@H]3C3CC3)cn2)cc1 ZINC000552391864 941654510 /nfs/dbraw/zinc/65/45/10/941654510.db2.gz ACRGQEIAILQUKI-FQEVSTJZSA-N 0 3 405.464 4.341 20 0 HIADHN CC(C)C[C@@H](Cc1cccc(Br)c1)C(=O)N1[C@@H]2CC[C@H]1CCN(C)C2 ZINC000552420553 941665766 /nfs/dbraw/zinc/66/57/66/941665766.db2.gz IXQDCJXXNDONAV-YSIASYRMSA-N 0 3 407.396 4.349 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)c2ccc(OC(F)F)c(F)c2)N(C)C)cc1 ZINC000552461698 941677318 /nfs/dbraw/zinc/67/73/18/941677318.db2.gz XSPQMURLZOBWJC-GOSISDBHSA-N 0 3 410.436 4.247 20 0 HIADHN CCc1ccc([C@@H](NCC(=O)Nc2cc(C)nn2-c2nc(C)cc(C)n2)C(C)C)cc1 ZINC000552465557 941678530 /nfs/dbraw/zinc/67/85/30/941678530.db2.gz KWKURKZCBNQCSL-QHCPKHFHSA-N 0 3 420.561 4.075 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@@H](O)C2)c1)c1ccc(-c2nc3ccccc3s2)o1 ZINC000552514726 941691822 /nfs/dbraw/zinc/69/18/22/941691822.db2.gz LSMYCUDXGIROLY-QGZVFWFLSA-N 0 3 419.506 4.375 20 0 HIADHN COc1cc(-c2ccccc2)sc1C(=O)Nc1cccc(CN2CC[C@@H](O)C2)c1 ZINC000552515161 941692066 /nfs/dbraw/zinc/69/20/66/941692066.db2.gz ZTDKHFCOJCWVQI-LJQANCHMSA-N 0 3 408.523 4.243 20 0 HIADHN C[C@H](NCc1ccc(S(=O)(=O)N(C)C)cc1)c1ccc(SCC(F)F)cc1 ZINC000552536448 941701078 /nfs/dbraw/zinc/70/10/78/941701078.db2.gz FOQUUABULANWKN-AWEZNQCLSA-N 0 3 414.543 4.145 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)COc2ccc(Cl)cc2Cl)CC1 ZINC000552614141 941724320 /nfs/dbraw/zinc/72/43/20/941724320.db2.gz JYRRUMPEGKASEE-UHFFFAOYSA-N 0 3 407.341 4.495 20 0 HIADHN CCCOc1ccc(NC(=O)N2CCN(CCN(C)Cc3ccccc3)CC2)c(C)c1 ZINC000552622120 941725769 /nfs/dbraw/zinc/72/57/69/941725769.db2.gz FRPIOAXHXRMMHZ-UHFFFAOYSA-N 0 3 424.589 4.065 20 0 HIADHN C/C=C\c1ccc(OC[C@H](O)CN[C@@H]2CCSc3c(F)cccc32)c(OC)c1 ZINC000552676123 941735262 /nfs/dbraw/zinc/73/52/62/941735262.db2.gz KOWOZMONAMHRRK-IPHHBTQASA-N 0 3 403.519 4.434 20 0 HIADHN C/C=C/c1ccc(OC[C@H](O)CN[C@H]2CCSc3c(F)cccc32)c(OC)c1 ZINC000552676122 941735433 /nfs/dbraw/zinc/73/54/33/941735433.db2.gz KOWOZMONAMHRRK-HSLQUGRPSA-N 0 3 403.519 4.434 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)c2cc(Cl)ccc2Br)cc1 ZINC000552817676 941775894 /nfs/dbraw/zinc/77/58/94/941775894.db2.gz XGKOSJQHUCCYLB-QGZVFWFLSA-N 0 3 411.727 4.144 20 0 HIADHN CC1CCN([C@H](CNC(=O)Cc2cnccc2C(F)(F)F)c2cccs2)CC1 ZINC000552831586 941780298 /nfs/dbraw/zinc/78/02/98/941780298.db2.gz ZEGLGKMYNLLROF-QGZVFWFLSA-N 0 3 411.493 4.294 20 0 HIADHN CC[C@@H]1C[C@H](C(=O)N(Cc2ccncc2)[C@@H]2CCCN(Cc3ccccc3)C2)CCO1 ZINC000552850308 941788040 /nfs/dbraw/zinc/78/80/40/941788040.db2.gz XOZJOICLZXZVIG-UBFVSLLYSA-N 0 3 421.585 4.280 20 0 HIADHN Cc1ccc(SCCNC(=O)CNC2(c3ccc(Cl)cc3)CCOCC2)cc1 ZINC000552968498 941810243 /nfs/dbraw/zinc/81/02/43/941810243.db2.gz HLDWRWWMPLAHPI-UHFFFAOYSA-N 0 3 418.990 4.152 20 0 HIADHN Cc1cc(CN2CCSCC2)ccc1NC(=O)C[C@H](c1ncc[nH]1)c1ccccc1 ZINC000553074383 941828897 /nfs/dbraw/zinc/82/88/97/941828897.db2.gz FOUDKDUYEPELHI-NRFANRHFSA-N 0 3 420.582 4.428 20 0 HIADHN C/C=C\c1ccc(OC[C@H](O)CNCc2ccc(Br)s2)c(OC)c1 ZINC000553199873 941848143 /nfs/dbraw/zinc/84/81/43/941848143.db2.gz VRMGUTBYVMRJSL-VQTKUKTRSA-N 0 3 412.349 4.082 20 0 HIADHN O=C1[C@H](N2CCC(C3CCOCC3)CC2)CCCN1Cc1cccc(C(F)(F)F)c1 ZINC000553708564 941948488 /nfs/dbraw/zinc/94/84/88/941948488.db2.gz KNJVIROWUGUFMT-OAQYLSRUSA-N 0 3 424.507 4.335 20 0 HIADHN Cc1nc2cc(C(=O)N3CCN([C@@H]4C[C@@H]4C)C[C@@H](C)C3)ccc2n1Cc1ccsc1 ZINC000553784138 941968267 /nfs/dbraw/zinc/96/82/67/941968267.db2.gz MVSCXXMWAYDZBZ-SAHWJRBASA-N 0 3 422.598 4.257 20 0 HIADHN C[C@H]1CN(C(=O)c2ccc(-c3ccc4c(c3)OCCO4)s2)CCN(C2CCC2)C1 ZINC000553862235 941986297 /nfs/dbraw/zinc/98/62/97/941986297.db2.gz OHITYTCKUJPNTA-MRXNPFEDSA-N 0 3 412.555 4.133 20 0 HIADHN CCCN(C)[C@H](CNC(=O)N1CCC[C@H](c2ccnn2C)C1)c1ccc(Cl)cc1 ZINC000553895079 941992686 /nfs/dbraw/zinc/99/26/86/941992686.db2.gz LUVXCLRXBZQDGB-GHTZIAJQSA-N 0 3 417.985 4.046 20 0 HIADHN CCCN(C)[C@H](CNC(=O)N[C@@H](CO)c1sccc1C)c1ccc(Cl)cc1 ZINC000553894583 941993016 /nfs/dbraw/zinc/99/30/16/941993016.db2.gz PGUWBXQYHWYPHG-ZWKOTPCHSA-N 0 3 409.983 4.126 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)c2ccc([C@@H]3CCCOC3)cc2)N(C)C)cc1 ZINC000554040395 942023945 /nfs/dbraw/zinc/02/39/45/942023945.db2.gz NKCDPASYWCXWGF-VWNXMTODSA-N 0 3 410.558 4.401 20 0 HIADHN CCCOc1ccc(-c2nc(C(=O)N3CCN([C@@H]4C[C@H]4C)C[C@H](C)C3)cs2)cc1 ZINC000554128228 942043709 /nfs/dbraw/zinc/04/37/09/942043709.db2.gz FRSMEMJDLLYLDR-CSODHUTKSA-N 0 3 413.587 4.401 20 0 HIADHN COc1cc([C@@H](C)N[C@@H](C)c2cccc(NS(C)(=O)=O)c2)ccc1OC(C)C ZINC000554209464 942068325 /nfs/dbraw/zinc/06/83/25/942068325.db2.gz HKQRMKOKOZCLHK-JKSUJKDBSA-N 0 3 406.548 4.266 20 0 HIADHN C[C@H](NC(=O)NC[C@H](c1cccs1)N1CCCC1)c1nccn1-c1ccccc1 ZINC000554219621 942071021 /nfs/dbraw/zinc/07/10/21/942071021.db2.gz ZBXNNQAFBMXVAC-PKOBYXMFSA-N 0 3 409.559 4.131 20 0 HIADHN C[C@H](NCc1ccc(N2CCc3ccccc3C2)nc1)c1cccc(-n2ccnn2)c1 ZINC000554348404 942110268 /nfs/dbraw/zinc/11/02/68/942110268.db2.gz AYAHRWQCNUAELK-IBGZPJMESA-N 0 3 410.525 4.076 20 0 HIADHN COC[C@H](NCC1CCN(C(=O)c2ccccc2)CC1)c1cccc(Cl)c1F ZINC000554361657 942113267 /nfs/dbraw/zinc/11/32/67/942113267.db2.gz FIBFECKTPBENCK-FQEVSTJZSA-N 0 3 404.913 4.309 20 0 HIADHN CC(=O)N1CCc2cc(NC(=O)NC[C@H](c3ccc(CC(C)C)cc3)N(C)C)ccc21 ZINC000554367288 942116250 /nfs/dbraw/zinc/11/62/50/942116250.db2.gz UTHXEXLVNPGARN-XMMPIXPASA-N 0 3 422.573 4.219 20 0 HIADHN C[C@@H](NC1CCC(N2C(=O)c3ccccc3C2=O)CC1)c1nccn1-c1ccccc1 ZINC000554375055 942117524 /nfs/dbraw/zinc/11/75/24/942117524.db2.gz GTOPBMUNGCENSM-PGYGNJIDSA-N 0 3 414.509 4.130 20 0 HIADHN C[C@@H](NC(=O)Nc1nc(CN2CCC[C@@H](C)C2)cs1)[C@@H](c1ccccc1)N(C)C ZINC000554385604 942121751 /nfs/dbraw/zinc/12/17/51/942121751.db2.gz FNQJGNQRNCBJIP-HLIPFELVSA-N 0 3 415.607 4.188 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1ccc(OC[C@H]2CCCO2)cc1)c1ccco1 ZINC000554397680 942125792 /nfs/dbraw/zinc/12/57/92/942125792.db2.gz AHGGMUCKVKOUEH-DBVUQKKJSA-N 0 3 401.507 4.088 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1ccc(OC[C@@H]2CCCO2)cc1)c1ccco1 ZINC000554397681 942125988 /nfs/dbraw/zinc/12/59/88/942125988.db2.gz AHGGMUCKVKOUEH-FFZOFVMBSA-N 0 3 401.507 4.088 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)Nc1cc2c(cc1SC)OCCO2)c1ccco1 ZINC000554421967 942136302 /nfs/dbraw/zinc/13/63/02/942136302.db2.gz FNIRERWBEBTOKB-UKRRQHHQSA-N 0 3 405.520 4.024 20 0 HIADHN Cc1c(NC(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)cccc1C(=O)N1CCCC1 ZINC000554427966 942140431 /nfs/dbraw/zinc/14/04/31/942140431.db2.gz GEXMQGDKVZTTMB-GCJKJVERSA-N 0 3 408.546 4.044 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N2C[C@H](c3ccccc3)[C@@H]3COCC[C@H]32)N(C)C)cc1 ZINC000554451519 942148545 /nfs/dbraw/zinc/14/85/45/942148545.db2.gz ZTAANGHWDCDAEC-RCTAOEEJSA-N 0 3 421.585 4.066 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)Nc1ccc(Br)c(OC)c1)c1ccco1 ZINC000554454799 942150185 /nfs/dbraw/zinc/15/01/85/942150185.db2.gz SZFOSMWDJAJAOU-IUODEOHRSA-N 0 3 410.312 4.302 20 0 HIADHN CC(=O)N1CCc2c1cccc2NC(=O)NC[C@@H](c1ccc(CC(C)C)cc1)N(C)C ZINC000554500497 942159971 /nfs/dbraw/zinc/15/99/71/942159971.db2.gz XBAKQBDJYZLDPB-DEOSSOPVSA-N 0 3 422.573 4.219 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)C1(c2ccccc2Cl)CCOCC1 ZINC000554799310 942245043 /nfs/dbraw/zinc/24/50/43/942245043.db2.gz UTJUXIRXJXTYFL-GOSISDBHSA-N 0 3 400.950 4.025 20 0 HIADHN CO[C@H](C)c1noc(CN2CCCN(C(c3ccccc3)c3ccccc3)CC2)n1 ZINC000554820321 942261109 /nfs/dbraw/zinc/26/11/09/942261109.db2.gz RXLBSRIJKJOFFU-LJQANCHMSA-N 0 3 406.530 4.074 20 0 HIADHN COC(=O)Cc1csc(NC(=O)CN[C@H](c2ccc(C(C)(C)C)cc2)C(C)C)n1 ZINC000554855990 942291010 /nfs/dbraw/zinc/29/10/10/942291010.db2.gz XLAFSCQMKQJYMU-FQEVSTJZSA-N 0 3 417.575 4.082 20 0 HIADHN COC(=O)c1cc(CN[C@@H]2c3cc(Br)ccc3SC[C@H]2C)cn1C ZINC000554855275 942291589 /nfs/dbraw/zinc/29/15/89/942291589.db2.gz OIRAULHRCIFECZ-DIFFPNOSSA-N 0 3 409.349 4.147 20 0 HIADHN Cc1ccc(Cl)cc1NC(=O)CN[C@@H]1CCN(C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000554948761 942329897 /nfs/dbraw/zinc/32/98/97/942329897.db2.gz CEACFRXKUSBPHG-YLJYHZDGSA-N 0 3 410.320 4.414 20 0 HIADHN Cc1c(Cl)cccc1NC(=O)CN[C@H]1CCN(C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000554954640 942331962 /nfs/dbraw/zinc/33/19/62/942331962.db2.gz PZTAOKIBWIXIGV-AZUAARDMSA-N 0 3 410.320 4.414 20 0 HIADHN Cc1c(Cl)cccc1NC(=O)CN[C@@H]1CCN(C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000554954642 942332055 /nfs/dbraw/zinc/33/20/55/942332055.db2.gz PZTAOKIBWIXIGV-QUCCMNQESA-N 0 3 410.320 4.414 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1ccc(-n2ccc(C(F)(F)F)n2)cc1 ZINC000555012103 942356087 /nfs/dbraw/zinc/35/60/87/942356087.db2.gz QQAJJVZABSQSQL-UHFFFAOYSA-N 0 3 421.423 4.080 20 0 HIADHN C[C@H](Cc1cnc2ccccc2n1)C(=O)NC[C@H](c1cccs1)N1CCC(C)CC1 ZINC000555031760 942364130 /nfs/dbraw/zinc/36/41/30/942364130.db2.gz GREMDDIBEQCRRZ-XMSQKQJNSA-N 0 3 422.598 4.459 20 0 HIADHN COCc1ccccc1CNC(=O)CN[C@@H](c1cccc(C(F)(F)F)c1)C1CC1 ZINC000555073844 942377580 /nfs/dbraw/zinc/37/75/80/942377580.db2.gz UBSIHLDWGAIWQC-OAQYLSRUSA-N 0 3 406.448 4.209 20 0 HIADHN COc1cc(F)c([C@H](C)NC(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)cc1OC ZINC000555123589 942391018 /nfs/dbraw/zinc/39/10/18/942391018.db2.gz KXIBGADJCUWZRC-UGSOOPFHSA-N 0 3 423.916 4.159 20 0 HIADHN CCc1ccccc1NC(=O)CN[C@H]1CCN(CC)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000555124919 942391627 /nfs/dbraw/zinc/39/16/27/942391627.db2.gz CQWPZKQFYCVMMJ-UGKGYDQZSA-N 0 3 405.464 4.030 20 0 HIADHN COc1cccc([C@@H]2[C@H](N[C@@H](C)C(=O)Nc3ccc(C)c(F)c3)CCN2C2CC2)c1 ZINC000555126510 942393571 /nfs/dbraw/zinc/39/35/71/942393571.db2.gz WZYLKWKZPQFZNH-PBNUPURSSA-N 0 3 411.521 4.037 20 0 HIADHN COc1cccc([C@H]2[C@@H](NCc3nc4cc(Cl)ccc4c(=O)[nH]3)CCN2C2CC2)c1 ZINC000555130439 942395404 /nfs/dbraw/zinc/39/54/04/942395404.db2.gz TVDVLGBXTRCNLR-UGKGYDQZSA-N 0 3 424.932 4.065 20 0 HIADHN CC(C)N1CC[C@H](NCC(=O)Nc2ccccc2Cl)[C@H]1c1ccc(F)c(F)c1 ZINC000555133850 942398377 /nfs/dbraw/zinc/39/83/77/942398377.db2.gz XKRHNNQTDFABGS-PZJWPPBQSA-N 0 3 407.892 4.370 20 0 HIADHN CCOC(=O)[C@H]1CC[C@@H](NCc2ccc(OCC(F)(F)F)nc2)c2ccccc21 ZINC000555165283 942412201 /nfs/dbraw/zinc/41/22/01/942412201.db2.gz PRNATXUNRYPAFG-ZWKOTPCHSA-N 0 3 408.420 4.294 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@H](N[C@@H](CN2CCCC2=O)c2ccccc2)c2ccccc21 ZINC000555170240 942414667 /nfs/dbraw/zinc/41/46/67/942414667.db2.gz SOTORMKPMJRZIA-VJBWXMMDSA-N 0 3 406.526 4.122 20 0 HIADHN CN(C)C[C@@H](NC(=O)c1cc(NC(=O)C(C)(C)C)ccc1F)c1ccc(Cl)cc1 ZINC000555230951 942438898 /nfs/dbraw/zinc/43/88/98/942438898.db2.gz QRZBPTVUUBCPNJ-LJQANCHMSA-N 0 3 419.928 4.496 20 0 HIADHN O[C@@H](CNCc1ccc(Oc2cccnc2)c(F)c1)COc1cccc2[nH]ccc21 ZINC000555331261 942479796 /nfs/dbraw/zinc/47/97/96/942479796.db2.gz ZDBXFEVAOGTZHV-KRWDZBQOSA-N 0 3 407.445 4.024 20 0 HIADHN O=C(NCCN1CCCC1)c1ccc(NCc2cc(Br)ccc2F)cc1 ZINC000555506841 942610703 /nfs/dbraw/zinc/61/07/03/942610703.db2.gz IXGYKMQFVUYCTG-UHFFFAOYSA-N 0 3 420.326 4.026 20 0 HIADHN Clc1cccc(N2CCOCC2)c1CNC[C@@H](c1ccco1)N1CCCCC1 ZINC000555509780 942613603 /nfs/dbraw/zinc/61/36/03/942613603.db2.gz ARSXPYWSJNTBHN-NRFANRHFSA-N 0 3 403.954 4.086 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)NCCc1cccc2cccnc21 ZINC000555653766 942689021 /nfs/dbraw/zinc/68/90/21/942689021.db2.gz LMDICWQWIQMBHM-UHFFFAOYSA-N 0 3 410.949 4.204 20 0 HIADHN CN(C)CCN(C(=O)c1cc(CNC(=O)C(C)(C)C)ccc1Cl)C1CCCCC1 ZINC000555879388 942762901 /nfs/dbraw/zinc/76/29/01/942762901.db2.gz HHHQPLMFOFYYMG-UHFFFAOYSA-N 0 3 422.013 4.339 20 0 HIADHN O=C(Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)[C@@H]1CCC(=O)c2ccccc21 ZINC000555885713 942766343 /nfs/dbraw/zinc/76/63/43/942766343.db2.gz KHYIINYRGPRVBL-SIKLNZKXSA-N 0 3 414.509 4.029 20 0 HIADHN CC(C)c1ccccc1NC(=O)[C@H](C)N[C@@H]1CCN(C)[C@H]1c1ccc(F)c(F)c1 ZINC000556126825 942808043 /nfs/dbraw/zinc/80/80/43/942808043.db2.gz WTVYYXRGGOEVCS-ARBPTSGCSA-N 0 3 401.501 4.450 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)[C@H](OC1CCOCC1)c1ccccc1 ZINC000556207810 942818874 /nfs/dbraw/zinc/81/88/74/942818874.db2.gz KQOSIHGVDQPNLS-SQJMNOBHSA-N 0 3 422.569 4.046 20 0 HIADHN CCS(=O)(=O)Nc1ccc([C@@H](C)N[C@H](C)c2ccc(-n3cccn3)c(F)c2)cc1 ZINC000556223243 942820749 /nfs/dbraw/zinc/82/07/49/942820749.db2.gz WTNARBFUIGPODN-HZPDHXFCSA-N 0 3 416.522 4.185 20 0 HIADHN C[C@H](c1ccc(F)cc1)N1CCC[C@H](N[C@@H](C)c2ccc(-n3ccnc3)cc2)C1=O ZINC000556241198 942825229 /nfs/dbraw/zinc/82/52/29/942825229.db2.gz QVGOZMAHYQEPQR-IXFSTUDKSA-N 0 3 406.505 4.414 20 0 HIADHN C[C@@H]1CC[C@@H](NCc2cc(Br)ccc2OC(F)F)[C@@H](n2cncn2)C1 ZINC000556260602 942827986 /nfs/dbraw/zinc/82/79/86/942827986.db2.gz FQKVZVGHHHUSGB-DFBGVHRSSA-N 0 3 415.282 4.162 20 0 HIADHN C[C@@H](Cn1cc(Br)ccc1=O)N[C@@H]1CCCOc2cc(Cl)ccc21 ZINC000556264878 942828739 /nfs/dbraw/zinc/82/87/39/942828739.db2.gz WURSSSYGTBRLJZ-BLLLJJGKSA-N 0 3 411.727 4.156 20 0 HIADHN C[C@]1(C2CC2)NC(=O)N(c2cccc(CN[C@H]3CCCCc4ccccc43)c2)C1=O ZINC000556292082 942834023 /nfs/dbraw/zinc/83/40/23/942834023.db2.gz NVZJWERZGOZCBC-WIOPSUGQSA-N 0 3 403.526 4.469 20 0 HIADHN CC[C@H](CNC(=O)Nc1ccc(Oc2cccnc2)nc1)N1CCc2ccccc2C1 ZINC000556307290 942837088 /nfs/dbraw/zinc/83/70/88/942837088.db2.gz BLQLPZQSILHNDN-OAQYLSRUSA-N 0 3 417.513 4.227 20 0 HIADHN CN(C(=O)c1ccc(NCc2cnc(-c3ccco3)s2)cc1)[C@H]1CCCN(C)C1 ZINC000556337016 942844084 /nfs/dbraw/zinc/84/40/84/942844084.db2.gz REOYBAKCADYICY-SFHVURJKSA-N 0 3 410.543 4.181 20 0 HIADHN Cc1cccc(CNc2ccc(C(=O)N(C)[C@@H]3CCCN(C)C3)cc2)c1OC(F)F ZINC000556338849 942845483 /nfs/dbraw/zinc/84/54/83/942845483.db2.gz OPXBWRMUVJLZEP-HXUWFJFHSA-N 0 3 417.500 4.375 20 0 HIADHN Cc1ccc(C)c(Sc2ccc(NC(=O)CN[C@H]3CCC(=O)N[C@@H]3C3CC3)cc2)c1 ZINC000556523043 942891421 /nfs/dbraw/zinc/89/14/21/942891421.db2.gz SZKSBJSVDOBQGN-GBXCKJPGSA-N 0 3 423.582 4.040 20 0 HIADHN COc1cc(CN[C@H](C)c2ccccc2-n2ccnn2)ccc1OCC(F)(F)F ZINC000556865333 942943358 /nfs/dbraw/zinc/94/33/58/942943358.db2.gz FKNVQJMBUWHNJX-CQSZACIVSA-N 0 3 406.408 4.068 20 0 HIADHN COc1ccc([C@@H](Cc2ccncc2)NCc2cccc(N3CCCC3=O)c2)cc1 ZINC000556873243 942946801 /nfs/dbraw/zinc/94/68/01/942946801.db2.gz LZLCZDXITYCSPN-XMMPIXPASA-N 0 3 401.510 4.291 20 0 HIADHN CCOc1cc(CN2CC[C@H](c3ccccc3F)C2)ccc1O[C@@H](C)C(=O)N(C)C ZINC000556883740 942950388 /nfs/dbraw/zinc/95/03/88/942950388.db2.gz XEPSFRHENOMXLN-HKUYNNGSSA-N 0 3 414.521 4.069 20 0 HIADHN CCN(CC)C(=O)Nc1ccc([C@@H](C)NCc2ccc(C[S@](C)=O)cc2)cc1 ZINC000556897921 942957892 /nfs/dbraw/zinc/95/78/92/942957892.db2.gz CWGWRMXNPPWCJN-UULLZXFKSA-N 0 3 401.576 4.290 20 0 HIADHN C[C@@H](Oc1cccc(Cl)c1Cl)C(=O)N(C)CCCN(C)Cc1ccncc1 ZINC000556934853 942972884 /nfs/dbraw/zinc/97/28/84/942972884.db2.gz YZUZPPSIEAQNOC-OAHLLOKOSA-N 0 3 410.345 4.136 20 0 HIADHN COc1cc(C(=O)N2[C@@H]3CC[C@H]2CCN(C)C3)ccc1OCc1ccc(Cl)cc1 ZINC000556963621 942981233 /nfs/dbraw/zinc/98/12/33/942981233.db2.gz XQWGCGQUFSLCSI-VQTJNVASSA-N 0 3 414.933 4.236 20 0 HIADHN CCOCCCn1c([C@H](CC)c2ccccc2)nnc1N1CCN(C)[C@@H](C(C)C)C1 ZINC000556990222 942988469 /nfs/dbraw/zinc/98/84/69/942988469.db2.gz LHTRZAYHZCSXEZ-FGZHOGPDSA-N 0 3 413.610 4.023 20 0 HIADHN CCOCCCn1c([C@H](CC)c2ccccc2)nnc1N1CCN(C)[C@H](C(C)C)C1 ZINC000556990224 942988812 /nfs/dbraw/zinc/98/88/12/942988812.db2.gz LHTRZAYHZCSXEZ-YADHBBJMSA-N 0 3 413.610 4.023 20 0 HIADHN C[C@H](CC(=O)Nc1cccc(CN2CC[C@H](O)C2)c1)c1cccc(C(F)(F)F)c1 ZINC000557021681 942996275 /nfs/dbraw/zinc/99/62/75/942996275.db2.gz AFQRBYLXPLQHJF-QRWLVFNGSA-N 0 3 406.448 4.404 20 0 HIADHN O=C(CCCn1ccc2cc(Cl)ccc21)Nc1cccc(CN2CC[C@@H](O)C2)c1 ZINC000557024527 942997536 /nfs/dbraw/zinc/99/75/36/942997536.db2.gz YRICNZOEOZCGQG-OAQYLSRUSA-N 0 3 411.933 4.280 20 0 HIADHN CN(CCC(F)(F)F)[C@H](CNC(=O)[C@@H]1CCCN1C1CC1)c1ccc(Cl)cc1 ZINC000557088152 943017928 /nfs/dbraw/zinc/01/79/28/943017928.db2.gz CVHAMXYYCWRCIV-ZWKOTPCHSA-N 0 3 417.903 4.008 20 0 HIADHN COc1ccc(CN2CC[C@H](N[C@H](C)c3ccc4ccccc4c3)C2=O)c(OC)c1 ZINC000557447043 943131034 /nfs/dbraw/zinc/13/10/34/943131034.db2.gz XHUBJTYXRHUNBZ-HXOBKFHXSA-N 0 3 404.510 4.309 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(C)c1C(=O)N[C@H]1CCN(Cc2ccccc2)[C@H]1C ZINC000557487782 943162723 /nfs/dbraw/zinc/16/27/23/943162723.db2.gz XXUNOSORZXYNBW-JTSKRJEESA-N 0 3 406.505 4.021 20 0 HIADHN CC(C)(C)N1C[C@@H](C(=O)N2CCC(C(=O)c3ccccc3)CC2)[C@H](C(F)(F)F)C1 ZINC000557490168 943164230 /nfs/dbraw/zinc/16/42/30/943164230.db2.gz OMDLLIHRKKCRKF-QZTJIDSGSA-N 0 3 410.480 4.017 20 0 HIADHN CCCCO[C@@H]1C[C@H](NCC(=O)Nc2c(F)cc(F)cc2Br)C1(C)C ZINC000557520486 943187239 /nfs/dbraw/zinc/18/72/39/943187239.db2.gz HVQMGTGIZSVROQ-LSDHHAIUSA-N 0 3 419.310 4.239 20 0 HIADHN NS(=O)(=O)c1ccc2c(c1)[C@@H](N[C@@H](c1ccc(F)cc1)C1CCCC1)CCC2 ZINC000557531380 943193486 /nfs/dbraw/zinc/19/34/86/943193486.db2.gz XKZWSTOOFUTZJV-FCHUYYIVSA-N 0 3 402.535 4.372 20 0 HIADHN CC[C@H](C)[C@H](NCC(=O)Nc1cccc(C(=O)N(C)C)c1)c1ccc(Cl)cc1 ZINC000557543918 943201483 /nfs/dbraw/zinc/20/14/83/943201483.db2.gz XHHJWOBZWCCAON-BTYIYWSLSA-N 0 3 401.938 4.357 20 0 HIADHN CC(=O)c1cccc(OC[C@@H](O)CNC2(c3cccc(C(F)(F)F)c3)CCC2)c1 ZINC000557547490 943202898 /nfs/dbraw/zinc/20/28/98/943202898.db2.gz PBDYVHIEYPZPHL-IBGZPJMESA-N 0 3 407.432 4.317 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)c1ccc(COc2ccccc2OC)o1 ZINC000557631485 943240496 /nfs/dbraw/zinc/24/04/96/943240496.db2.gz QIUFKUUQXKEOOK-UHFFFAOYSA-N 0 3 400.519 4.205 20 0 HIADHN O=C(C1CC(c2cccc(F)c2)C1)N1CCC[C@H](c2n[nH]cc2CN2CCCC2)C1 ZINC000557646931 943247026 /nfs/dbraw/zinc/24/70/26/943247026.db2.gz MPALAZRIFQCNTP-HDYDNRTBSA-N 0 3 410.537 4.044 20 0 HIADHN C[C@H](CC(=O)Nc1cccc(N2CCCC2)c1)NCc1cnc(-c2ccncc2)s1 ZINC000557781625 943289892 /nfs/dbraw/zinc/28/98/92/943289892.db2.gz CRIXAONMWAKGPG-QGZVFWFLSA-N 0 3 421.570 4.312 20 0 HIADHN CC[C@@H](NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1)c1ccc(OC)c(OC)c1 ZINC000557800958 943295788 /nfs/dbraw/zinc/29/57/88/943295788.db2.gz CTTDHFDPUFFBME-NHCUHLMSSA-N 0 3 411.546 4.119 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)CCc2ccnc3ccccc23)N(C)C)cc1 ZINC000557934553 943333119 /nfs/dbraw/zinc/33/31/19/943333119.db2.gz GGYXTDCIFFPOIH-XMMPIXPASA-N 0 3 405.542 4.374 20 0 HIADHN CCO[C@H](C)c1ncc(C(=O)NC[C@H](c2ccc(CC(C)C)cc2)N(C)C)s1 ZINC000557985749 943347447 /nfs/dbraw/zinc/34/74/47/943347447.db2.gz PJZBVSDPUYGMNB-VQIMIIECSA-N 0 3 403.592 4.472 20 0 HIADHN Cc1nn(Cc2ccc(Cl)cc2)c(C)c1C(=O)N1CCN([C@@H]2C[C@@H]2C)C[C@@H](C)C1 ZINC000558013141 943354673 /nfs/dbraw/zinc/35/46/73/943354673.db2.gz SVHZBRMSDHVOJA-VWKPWSFCSA-N 0 3 414.981 4.004 20 0 HIADHN C[C@@H](CC(=O)NCCc1ccccc1)NC1(c2cccc(Br)c2)CC1 ZINC000558086365 943376427 /nfs/dbraw/zinc/37/64/27/943376427.db2.gz SGRSAMDPBGTSDU-INIZCTEOSA-N 0 3 401.348 4.165 20 0 HIADHN CC(C)CCOC1CCN(CCc2nc3sc4c(c3c(N)n2)CC[C@@H](C)C4)CC1 ZINC000558227117 943445505 /nfs/dbraw/zinc/44/55/05/943445505.db2.gz FKGNZNLCMYJQPM-MRXNPFEDSA-N 0 3 416.635 4.468 20 0 HIADHN COc1cccc(NC2CCN(CCOc3cccc(Br)c3)CC2)c1 ZINC000558244727 943457024 /nfs/dbraw/zinc/45/70/24/943457024.db2.gz BUJRFVCXIRWKPW-UHFFFAOYSA-N 0 3 405.336 4.413 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1cccc(OC[C@@H]2CCCO2)c1)c1ccco1 ZINC000558277055 943476866 /nfs/dbraw/zinc/47/68/66/943476866.db2.gz JLCDMEMKMWDTTK-FFZOFVMBSA-N 0 3 401.507 4.088 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)N[C@@H]1CC[C@@H](c2ccccc2)C[C@H]1OC ZINC000558278364 943479378 /nfs/dbraw/zinc/47/93/78/943479378.db2.gz PEAGLYPIJCLSFA-TXTKFYIRSA-N 0 3 411.546 4.230 20 0 HIADHN CCOc1cc(NC(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)ccc1OC ZINC000558289625 943485283 /nfs/dbraw/zinc/48/52/83/943485283.db2.gz OOBLORHJTNUBEQ-FQEVSTJZSA-N 0 3 415.534 4.306 20 0 HIADHN CC(C)Cc1ccc([C@@H](CNC(=O)Nc2ccc(C(C)(C)C(N)=O)cc2)N(C)C)cc1 ZINC000558376636 943533838 /nfs/dbraw/zinc/53/38/38/943533838.db2.gz ZTCJNRYDZZNUGI-JOCHJYFZSA-N 0 3 424.589 4.072 20 0 HIADHN C[C@H](N[C@@H]1CCN(C)[C@H]1c1ccc(F)c(F)c1)C(=O)Nc1cc(Cl)ccc1F ZINC000558475914 943569402 /nfs/dbraw/zinc/56/94/02/943569402.db2.gz MRPHQJRHLVWELT-JVMOKEISSA-N 0 3 411.855 4.119 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(F)cc2)CC1)[C@H]1C[C@@H]1c1ccccc1Cl ZINC000558503900 943578547 /nfs/dbraw/zinc/57/85/47/943578547.db2.gz HAYGUPXPUSRKRH-RTWAWAEBSA-N 0 3 416.924 4.242 20 0 HIADHN CN1CCC(N(Cc2ccccc2Br)C(=O)Cc2ccsc2)CC1 ZINC000558610480 943617533 /nfs/dbraw/zinc/61/75/33/943617533.db2.gz WACMTBFWHIFFPX-UHFFFAOYSA-N 0 3 407.377 4.176 20 0 HIADHN CN(C)c1noc([C@@H]2CCCN([C@@H]3CCCc4ccc(Br)cc43)C2)n1 ZINC000558728896 943633936 /nfs/dbraw/zinc/63/39/36/943633936.db2.gz BAPNAWCWHVBEOS-RHSMWYFYSA-N 0 3 405.340 4.155 20 0 HIADHN CCN(Cc1cccc(NC(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)c1)C(C)=O ZINC000558755011 943646018 /nfs/dbraw/zinc/64/60/18/943646018.db2.gz YZTWDWNZWIHKLM-NRFANRHFSA-N 0 3 416.953 4.133 20 0 HIADHN Cc1ccc(CNCc2cc(Cl)ccc2N2CCOCC2)c(-c2ccnn2C)c1 ZINC000558780669 943660386 /nfs/dbraw/zinc/66/03/86/943660386.db2.gz FGAQSISMFXBMJV-UHFFFAOYSA-N 0 3 410.949 4.175 20 0 HIADHN Cc1ccc(-c2cncc(F)c2)cc1NC(=O)N(CCN(C)C)Cc1ccccn1 ZINC000558852488 943700875 /nfs/dbraw/zinc/70/08/75/943700875.db2.gz LKGGYQVWTRZIDE-UHFFFAOYSA-N 0 3 407.493 4.187 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cnc4c(F)ccc(F)c4c3)c(C)c2)CC1 ZINC000558858987 943703805 /nfs/dbraw/zinc/70/38/05/943703805.db2.gz OLXOTJGNHYNBHP-UHFFFAOYSA-N 0 3 410.468 4.216 20 0 HIADHN C[C@@H](NC(=O)N[C@H](CN(C)C)c1ccc(Cl)cc1)c1noc(-c2ccccc2)n1 ZINC000558910519 943742650 /nfs/dbraw/zinc/74/26/50/943742650.db2.gz NIJCKJTYUQFKAP-RDTXWAMCSA-N 0 3 413.909 4.053 20 0 HIADHN C[C@@H](NC(=O)N[C@H](CN(C)C)c1ccc(Cl)cc1)c1ccccc1-n1cccn1 ZINC000558914244 943744252 /nfs/dbraw/zinc/74/42/52/943744252.db2.gz PSRRMZKBUKYTLG-OXQOHEQNSA-N 0 3 411.937 4.189 20 0 HIADHN CCOC(=O)[C@H]1CC[C@H](NCc2ccc(-n3nc(C)cc3C)nc2)c2ccccc21 ZINC000558918724 943746694 /nfs/dbraw/zinc/74/66/94/943746694.db2.gz HIBSBXXGYDDLGN-VXKWHMMOSA-N 0 3 404.514 4.156 20 0 HIADHN COCCOc1ccc(C(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)c(Cl)c1 ZINC000558973550 943777401 /nfs/dbraw/zinc/77/74/01/943777401.db2.gz SZPHIZKVVDFRSA-IBGZPJMESA-N 0 3 411.329 4.051 20 0 HIADHN Cc1cn(-c2ccc(F)cc2)nc1C(=O)N[C@H](CN(C)C)c1ccc(Cl)cc1 ZINC000558972921 943777422 /nfs/dbraw/zinc/77/74/22/943777422.db2.gz SGRFCCZURVRQMG-LJQANCHMSA-N 0 3 400.885 4.006 20 0 HIADHN CC(=O)CCc1ccc(O[C@@H](C)C(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)cc1 ZINC000558973573 943777652 /nfs/dbraw/zinc/77/76/52/943777652.db2.gz QRFDZUSJFPHTDX-JTSKRJEESA-N 0 3 416.949 4.048 20 0 HIADHN CCCN(CC(=O)Nc1ccccc1OC)Cc1ccc(C)cc1-c1ccnn1C ZINC000559058347 943818435 /nfs/dbraw/zinc/81/84/35/943818435.db2.gz KOBMDIWEIKMLQM-UHFFFAOYSA-N 0 3 406.530 4.255 20 0 HIADHN COc1cc(CNCc2cccc(N3CCOCC3)c2)ccc1OCc1ccccc1 ZINC000559306214 943893522 /nfs/dbraw/zinc/89/35/22/943893522.db2.gz AVFCZRGIMOWDIE-UHFFFAOYSA-N 0 3 418.537 4.401 20 0 HIADHN O=C(NC[C@H]1CCCOC1)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000559548656 944001615 /nfs/dbraw/zinc/00/16/15/944001615.db2.gz LHMTVBKOTNKDPE-QGZVFWFLSA-N 0 3 414.377 4.027 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)c1cc(Br)cc2cccnc21 ZINC000559682408 944029107 /nfs/dbraw/zinc/02/91/07/944029107.db2.gz VRWTYJLQPWGOSM-UHFFFAOYSA-N 0 3 412.331 4.201 20 0 HIADHN Cc1ccc(NC(=O)[C@H](C)N[C@@H]2CCN(C)[C@H]2c2ccccc2)c(Br)c1 ZINC000559793082 944051125 /nfs/dbraw/zinc/05/11/25/944051125.db2.gz IPFZAOBNNULMPO-BEVDRBHNSA-N 0 3 416.363 4.120 20 0 HIADHN Cc1ccc(NC(=O)[C@H](C)N[C@H]2CCN(C)[C@@H]2c2ccccc2)c(Br)c1 ZINC000559793091 944051226 /nfs/dbraw/zinc/05/12/26/944051226.db2.gz IPFZAOBNNULMPO-RYGJVYDSSA-N 0 3 416.363 4.120 20 0 HIADHN COc1ccc2ccccc2c1-c1cc(CN[C@@H]2CCCC[C@H]2N2CCOCC2)on1 ZINC000559841404 944064368 /nfs/dbraw/zinc/06/43/68/944064368.db2.gz JQZBAMGYBLMZGK-FYYLOGMGSA-N 0 3 421.541 4.236 20 0 HIADHN CCS(=O)(=O)Nc1ccc([C@H](C)NCc2ccc(OC(F)F)c(F)c2)cc1 ZINC000559897969 944078471 /nfs/dbraw/zinc/07/84/71/944078471.db2.gz UGUBGXSONJAWED-LBPRGKRZSA-N 0 3 402.438 4.040 20 0 HIADHN CC[C@@H](Cn1cncn1)N[C@H](c1cccc(F)c1)c1cccc(Br)c1 ZINC000559913401 944083795 /nfs/dbraw/zinc/08/37/95/944083795.db2.gz KMYOUEPRLATKHU-OALUTQOASA-N 0 3 403.299 4.338 20 0 HIADHN CC1(C)CC(CC(=O)NC2CCN(CCOc3ccc(Br)cc3)CC2)C1 ZINC000559913283 944083848 /nfs/dbraw/zinc/08/38/48/944083848.db2.gz RNHIYKLYAFUVQE-UHFFFAOYSA-N 0 3 423.395 4.235 20 0 HIADHN C[C@@H](NCCCS(=O)(=O)c1ccc(Cl)cc1)c1cccc(OC(F)F)c1 ZINC000559919443 944084757 /nfs/dbraw/zinc/08/47/57/944084757.db2.gz NSLHRSSINDRMDI-CYBMUJFWSA-N 0 3 403.878 4.456 20 0 HIADHN CN1CC[C@H](CN[C@@H](c2cn[nH]n2)c2ccc(F)cc2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000559920749 944085486 /nfs/dbraw/zinc/08/54/86/944085486.db2.gz HQQXNWTYXMLORF-IPHXSNPTSA-N 0 3 417.891 4.108 20 0 HIADHN CSCc1cc(F)ccc1CNC(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000559948354 944096611 /nfs/dbraw/zinc/09/66/11/944096611.db2.gz UGGLYPSJFDDUFM-UHFFFAOYSA-N 0 3 415.578 4.495 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)Nc1ccc(Oc2cccnc2)nc1 ZINC000559966721 944103987 /nfs/dbraw/zinc/10/39/87/944103987.db2.gz RYIIMWHIDKCGDT-SFHVURJKSA-N 0 3 409.515 4.289 20 0 HIADHN C[C@H](CCN1CCN(C)CC1)NC(=O)N[C@@H]1CCCCC[C@@H]1c1ccc(Cl)cc1 ZINC000560105298 944161260 /nfs/dbraw/zinc/16/12/60/944161260.db2.gz CATGQZFPJSQFIA-STZQEDGTSA-N 0 3 421.029 4.082 20 0 HIADHN Cc1n[nH]cc1C1CCN(C[C@@H](O)COc2ccc(Oc3ccccc3)cc2)CC1 ZINC000560184220 944190509 /nfs/dbraw/zinc/19/05/09/944190509.db2.gz OQNITVYTJBZUHC-HXUWFJFHSA-N 0 3 407.514 4.130 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)[C@H](C)Cc2ccc(Br)cc2)cc1 ZINC000560248167 944206938 /nfs/dbraw/zinc/20/69/38/944206938.db2.gz CGVCWBIQHISFNV-QRWLVFNGSA-N 0 3 419.363 4.055 20 0 HIADHN COc1ccc2c(c1)[C@@H](NCc1cccc(N3C(=O)N[C@](C)(C4CC4)C3=O)c1)CCC2 ZINC000560266032 944212350 /nfs/dbraw/zinc/21/23/50/944212350.db2.gz UVLIPBGMUXMPFZ-WIOPSUGQSA-N 0 3 419.525 4.087 20 0 HIADHN O[C@H](CNCc1cc(Cl)c2c(c1)OCCCO2)CO[C@H]1CCCc2ccccc21 ZINC000560455061 944233161 /nfs/dbraw/zinc/23/31/61/944233161.db2.gz ULFXLGOYWGARNZ-NQIIRXRSSA-N 0 3 417.933 4.046 20 0 HIADHN COc1ccc(S[C@H](C)C(=O)N2CCN(c3ccnc4ccccc43)CC2)cc1 ZINC000560490045 944238415 /nfs/dbraw/zinc/23/84/15/944238415.db2.gz URAGGBMQQWPZDC-QGZVFWFLSA-N 0 3 407.539 4.073 20 0 HIADHN COc1ncc(CN[C@]2(Cc3ccc(C(F)(F)F)cc3)CCOC2)cc1Cl ZINC000560508959 944239560 /nfs/dbraw/zinc/23/95/60/944239560.db2.gz LPSDXBCMYFXCCL-SFHVURJKSA-N 0 3 400.828 4.254 20 0 HIADHN COc1ccc([C@H](Cc2ccncc2)NCc2ccc(OCC(F)(F)F)nc2)cc1 ZINC000560514488 944240194 /nfs/dbraw/zinc/24/01/94/944240194.db2.gz NRPJRBCOKMZTJC-FQEVSTJZSA-N 0 3 417.431 4.500 20 0 HIADHN CC[C@@H](N[C@@H]1CCCN(Cc2ccccn2)C1=O)c1ccc(OC(F)(F)F)cc1 ZINC000560549812 944251315 /nfs/dbraw/zinc/25/13/15/944251315.db2.gz ZECZOVVDFOPAAL-RTBURBONSA-N 0 3 407.436 4.212 20 0 HIADHN O=C(c1cc(Cl)c[nH]1)N1CCC(N[C@@H](c2ccc(F)cc2)c2cccnc2)CC1 ZINC000560584616 944263350 /nfs/dbraw/zinc/26/33/50/944263350.db2.gz LBVXTKISSLUSRC-NRFANRHFSA-N 0 3 412.896 4.186 20 0 HIADHN CN(CCCN(C)C(=O)[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl)Cc1ccncc1 ZINC000560594268 944267101 /nfs/dbraw/zinc/26/71/01/944267101.db2.gz FZBJHFJYZHZRMV-RBUKOAKNSA-N 0 3 406.357 4.472 20 0 HIADHN Cc1cc(N(C)C)cc(C)c1NC(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000560602405 944270743 /nfs/dbraw/zinc/27/07/43/944270743.db2.gz HVEYXPKWWYCTLN-HXUWFJFHSA-N 0 3 401.501 4.465 20 0 HIADHN Brc1ccc(-n2cc(CN3CC4(CCOCC4)[C@@H]3C3CC3)cn2)cc1 ZINC000560611631 944273595 /nfs/dbraw/zinc/27/35/95/944273595.db2.gz MKFIEVIYDVBZKQ-IBGZPJMESA-N 0 3 402.336 4.026 20 0 HIADHN COc1cccc(C2=CCN(C(=O)[C@H]3CN(Cc4ccccc4)CCC3(F)F)C2)c1 ZINC000560625586 944278780 /nfs/dbraw/zinc/27/87/80/944278780.db2.gz VQZPLUQRMDSLDC-JOCHJYFZSA-N 0 3 412.480 4.078 20 0 HIADHN Cc1cc(C)c(CNC[C@@H](O)COc2ccc(C(C)(C)c3ccccc3)cc2)c(=O)[nH]1 ZINC000560668357 944289203 /nfs/dbraw/zinc/28/92/03/944289203.db2.gz OHAKCAZUTRJGPU-JOCHJYFZSA-N 0 3 420.553 4.259 20 0 HIADHN COC[C@@H](C)Nc1ccccc1NC(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000560699246 944299882 /nfs/dbraw/zinc/29/98/82/944299882.db2.gz MKBSCWVOOAYPIP-IEBWSBKVSA-N 0 3 417.500 4.229 20 0 HIADHN C[C@@H](N[C@H](C)c1cccc(OC(F)(F)F)c1)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000560885488 944364645 /nfs/dbraw/zinc/36/46/45/944364645.db2.gz XBMYIXJELGUKCO-ZIAGYGMSSA-N 0 3 416.465 4.247 20 0 HIADHN CCCOc1ccc([C@H](C)NCc2ccccc2CS(=O)(=O)N2CCCC2)cc1 ZINC000560910355 944368725 /nfs/dbraw/zinc/36/87/25/944368725.db2.gz RIVAQFAQCGTPMI-IBGZPJMESA-N 0 3 416.587 4.252 20 0 HIADHN COc1ccc(Br)c(C(=O)N(Cc2ccccc2)C2CCN(C)CC2)c1 ZINC000560932141 944372314 /nfs/dbraw/zinc/37/23/14/944372314.db2.gz FGCCXZUYPNPVRT-UHFFFAOYSA-N 0 3 417.347 4.194 20 0 HIADHN CC(C)COCCC(=O)N(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000561074103 944429390 /nfs/dbraw/zinc/42/93/90/944429390.db2.gz FWWOYEWEMZTKKE-DEOSSOPVSA-N 0 3 409.574 4.138 20 0 HIADHN CO[C@@H]1CCC[C@@H](C(=O)N(Cc2ccncc2)[C@@H]2CCCN(Cc3ccccc3)C2)C1 ZINC000561076780 944432173 /nfs/dbraw/zinc/43/21/73/944432173.db2.gz YIAZXBCGUUDNDV-UBFVSLLYSA-N 0 3 421.585 4.280 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)COc1ccc(Cl)c2cccnc12)c1ccco1 ZINC000561370262 944563681 /nfs/dbraw/zinc/56/36/81/944563681.db2.gz NGMJTPDQFJXXOT-WMLDXEAASA-N 0 3 401.894 4.106 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Cc1c(C)nn(-c2ccc(F)cc2)c1C)c1ccco1 ZINC000561370774 944564373 /nfs/dbraw/zinc/56/43/73/944564373.db2.gz ZGLDPBKEVUQRFX-BTYIYWSLSA-N 0 3 412.509 4.009 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)NCc2c(F)cccc2N2CCCC2)C1 ZINC000561506542 944642534 /nfs/dbraw/zinc/64/25/34/944642534.db2.gz SAYJTDBQAIXBDE-ICSRJNTNSA-N 0 3 410.537 4.061 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)CSc1ncnc2sc(C)c(C)c21)c1ccco1 ZINC000561610317 944705951 /nfs/dbraw/zinc/70/59/51/944705951.db2.gz KLSWZPPGSUMBPM-WFASDCNBSA-N 0 3 418.588 4.239 20 0 HIADHN CN(C)C[C@H](NC(=O)Cc1ccc(NC(=O)CC(C)(C)C)cc1)c1ccc(F)cc1 ZINC000561616061 944709544 /nfs/dbraw/zinc/70/95/44/944709544.db2.gz YOMPQIFYKNGPTP-NRFANRHFSA-N 0 3 413.537 4.162 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)c2ccc(NC(=O)[C@H]3C[C@@H]3C)cc2)N(C)C)cc1 ZINC000561653936 944729866 /nfs/dbraw/zinc/72/98/66/944729866.db2.gz WPZSZAPFEOHIPS-RTFZILSDSA-N 0 3 423.557 4.101 20 0 HIADHN COc1cccc(Cl)c1CC(=O)NC[C@@H](c1ccc(OC(C)C)cc1)N(C)C ZINC000561653654 944730162 /nfs/dbraw/zinc/73/01/62/944730162.db2.gz RWISUIYEOADBIS-FQEVSTJZSA-N 0 3 404.938 4.097 20 0 HIADHN CC(C)Oc1ccc(-c2nc(C(=O)N3CCN([C@H]4C[C@@H]4C)C[C@H](C)C3)cs2)cc1 ZINC000561762239 944785093 /nfs/dbraw/zinc/78/50/93/944785093.db2.gz LOELSVJPCCQDDL-FIKGOQFSSA-N 0 3 413.587 4.400 20 0 HIADHN CC(C)CC(=O)Nc1ccc(Cl)c(C(=O)N2CCN([C@@H]3C[C@@H]3C)C[C@@H](C)C2)c1 ZINC000561762568 944785592 /nfs/dbraw/zinc/78/55/92/944785592.db2.gz VOJXBPNSYOSEOU-GQIGUUNPSA-N 0 3 405.970 4.127 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)N[C@@H](C)c1c(F)cncc1F)c1ccc(Cl)cc1 ZINC000561878671 944834108 /nfs/dbraw/zinc/83/41/08/944834108.db2.gz VMDLIAYHNFJADN-UGSOOPFHSA-N 0 3 410.896 4.457 20 0 HIADHN C[C@@H](OC[C@H](O)CN(Cc1cccs1)[C@@H]1C=C[C@H](CO)C1)c1ccc(Cl)cc1 ZINC000561910988 944851483 /nfs/dbraw/zinc/85/14/83/944851483.db2.gz LPEZEYXCYXIUDI-HRQSHJORSA-N 0 3 421.990 4.279 20 0 HIADHN COc1ccc([C@@H](C)NCCC(=O)Nc2cc(Br)ccc2C)cc1O ZINC000562082727 944927814 /nfs/dbraw/zinc/92/78/14/944927814.db2.gz ZAFJOTWPZSIFTJ-CYBMUJFWSA-N 0 3 407.308 4.151 20 0 HIADHN COC[C@@]1(CN[C@@H](C)c2cnn(-c3ccc(F)cc3)c2C)OCCc2ccccc21 ZINC000562091045 944933979 /nfs/dbraw/zinc/93/39/79/944933979.db2.gz LVFFNJPVDSLLBF-BXKMTCNYSA-N 0 3 409.505 4.085 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)Nc2cnc3c(cnn3C(C)C)c2)N(C)C)cc1 ZINC000562112667 944946005 /nfs/dbraw/zinc/94/60/05/944946005.db2.gz PCUIXEARZXJFHB-OAQYLSRUSA-N 0 3 424.549 4.224 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)Nc1cc(OC)ccc1Br)c1ccco1 ZINC000562140125 944966856 /nfs/dbraw/zinc/96/68/56/944966856.db2.gz RUOQBFBFBCBELD-WBMJQRKESA-N 0 3 410.312 4.302 20 0 HIADHN C[C@@H](CNC(=O)Nc1ccc(OCc2ccncc2)cc1)N(C)Cc1ccccc1 ZINC000562208180 945019708 /nfs/dbraw/zinc/01/97/08/945019708.db2.gz KMPZCKCNIFLZFX-IBGZPJMESA-N 0 3 404.514 4.303 20 0 HIADHN Cc1cc(NC(=O)c2cnc(-c3cccnc3)s2)cc(N2CCN(C(C)C)CC2)c1 ZINC000562315082 945058287 /nfs/dbraw/zinc/05/82/87/945058287.db2.gz ZMFISOBMHIGOBM-UHFFFAOYSA-N 0 3 421.570 4.296 20 0 HIADHN COc1cccc(Oc2ccc(CN[C@H](C)c3cccc(-n4ccnn4)c3)cn2)c1 ZINC000564093115 945375444 /nfs/dbraw/zinc/37/54/44/945375444.db2.gz MMMVSQZYJXKULL-QGZVFWFLSA-N 0 3 401.470 4.314 20 0 HIADHN Cc1c(NC(=O)N(CCN(C)C)Cc2cccs2)cnn1-c1ccc(Cl)cc1 ZINC000564180258 945421563 /nfs/dbraw/zinc/42/15/63/945421563.db2.gz OIHIJTYNAVJZSK-UHFFFAOYSA-N 0 3 417.966 4.491 20 0 HIADHN CC[C@@H](NC(=O)c1ccccc1)c1noc(C2CCN(Cc3ccccc3)CC2)n1 ZINC000564287095 945499580 /nfs/dbraw/zinc/49/95/80/945499580.db2.gz ZPRVRBMDODQIFR-OAQYLSRUSA-N 0 3 404.514 4.330 20 0 HIADHN C[C@H](c1cccc(N2CCCS2(=O)=O)c1)N(C)C/C=C\c1ccc(F)c(F)c1 ZINC000564302877 945505656 /nfs/dbraw/zinc/50/56/56/945505656.db2.gz VUVQKUIDKVXCNZ-DQOPKJQZSA-N 0 3 406.498 4.211 20 0 HIADHN O=C(NCc1nc2cc(Br)ccc2o1)[C@H]1CCCCN1C1CCCC1 ZINC000564310751 945509232 /nfs/dbraw/zinc/50/92/32/945509232.db2.gz BXFWIEXUNPPXAS-MRXNPFEDSA-N 0 3 406.324 4.004 20 0 HIADHN COC(=O)c1ccc(-c2nc(CN[C@H]3CCN(C)[C@@H]3c3ccccc3)cs2)cc1 ZINC000564393474 945552499 /nfs/dbraw/zinc/55/24/99/945552499.db2.gz NFXXDCPPGPPHHG-LEWJYISDSA-N 0 3 407.539 4.132 20 0 HIADHN COC(=O)c1ccc(-c2nc(CN[C@@H]3CCN(C)[C@@H]3c3ccccc3)cs2)cc1 ZINC000564393477 945552750 /nfs/dbraw/zinc/55/27/50/945552750.db2.gz NFXXDCPPGPPHHG-NHCUHLMSSA-N 0 3 407.539 4.132 20 0 HIADHN CN1CC[C@H](NCC(=O)N(Cc2ccccc2)C2CC2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000564395056 945553082 /nfs/dbraw/zinc/55/30/82/945553082.db2.gz HJUZCBYORJAWQK-GMAHTHKFSA-N 0 3 415.940 4.005 20 0 HIADHN C[C@H](N[C@@H]1CCCc2ccc(S(N)(=O)=O)cc21)c1ccc(-c2cccnc2)cc1 ZINC000564422903 945573753 /nfs/dbraw/zinc/57/37/53/945573753.db2.gz BWAWUVLJKFKPOV-QMHKHESXSA-N 0 3 407.539 4.124 20 0 HIADHN COc1ccc([C@@H](C)N[C@@H]2CCCN(Cc3ccc(F)cc3F)C2=O)c(C)c1OC ZINC000564478412 945611906 /nfs/dbraw/zinc/61/19/06/945611906.db2.gz UCICJROCKAIWGQ-FOIQADDNSA-N 0 3 418.484 4.132 20 0 HIADHN Cc1ccc(CS(=O)(=O)Nc2ccc(CN3CCSCC3)cc2C)cc1C ZINC000564487559 945619020 /nfs/dbraw/zinc/61/90/20/945619020.db2.gz NXQHENUAVGKVMZ-UHFFFAOYSA-N 0 3 404.601 4.103 20 0 HIADHN Brc1ccc([C@@H](Cc2ccccn2)NCc2c[nH]c3nccnc23)cc1 ZINC000564535958 945657441 /nfs/dbraw/zinc/65/74/41/945657441.db2.gz ACGVJKNSGVUOIH-GOSISDBHSA-N 0 3 408.303 4.141 20 0 HIADHN COCCCN(C(=O)CSCc1ccc(Cl)cc1Cl)C1CCN(C)CC1 ZINC000564596205 945693804 /nfs/dbraw/zinc/69/38/04/945693804.db2.gz FNHLXWRJRIFRSU-UHFFFAOYSA-N 0 3 419.418 4.186 20 0 HIADHN CN(C)[C@@H](CNC(=O)N1CCC(c2noc3cc(F)ccc32)CC1)Cc1ccccc1 ZINC000564601155 945698743 /nfs/dbraw/zinc/69/87/43/945698743.db2.gz FLUKSVSUZCIPJR-HXUWFJFHSA-N 0 3 424.520 4.029 20 0 HIADHN CN(C(=O)N[C@H]1CCc2c1cccc2Cl)C1CCN(CCc2ccccn2)CC1 ZINC000564642633 945718431 /nfs/dbraw/zinc/71/84/31/945718431.db2.gz GXUBHLBTDFOPNA-QFIPXVFZSA-N 0 3 412.965 4.071 20 0 HIADHN Cc1nn(-c2ccccn2)c(C)c1CN(C)CCCc1cc(-c2ccccc2)n[nH]1 ZINC000565434523 945828480 /nfs/dbraw/zinc/82/84/80/945828480.db2.gz OHYYVVNFWLBQKW-UHFFFAOYSA-N 0 3 400.530 4.339 20 0 HIADHN CC[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)N1CCN(c2ccncc2OC)CC1 ZINC000565495840 945838576 /nfs/dbraw/zinc/83/85/76/945838576.db2.gz ACRQVDXFLDDFIK-KRWDZBQOSA-N 0 3 421.463 4.027 20 0 HIADHN O=C(NCc1ccsc1Br)NC[C@@H](c1cccs1)N1CCCC1 ZINC000565706301 945871073 /nfs/dbraw/zinc/87/10/73/945871073.db2.gz TXQXINCFSCAQJU-ZDUSSCGKSA-N 0 3 414.394 4.208 20 0 HIADHN Fc1ccc([C@H]2C[C@@H](NCc3cn4ccc(Br)cc4n3)CCO2)cc1 ZINC000565721476 945872136 /nfs/dbraw/zinc/87/21/36/945872136.db2.gz NCUYFKKWAAGJKA-FUHWJXTLSA-N 0 3 404.283 4.246 20 0 HIADHN CN1CCC(N(Cc2ccccc2Br)C(=O)c2ccc(F)cc2)CC1 ZINC000565922921 945928562 /nfs/dbraw/zinc/92/85/62/945928562.db2.gz LJDABTWLWXWDCQ-UHFFFAOYSA-N 0 3 405.311 4.325 20 0 HIADHN COc1cccc([C@@H]2[C@H](NCc3nc4sc(C)c(C)c4c(=O)[nH]3)CCN2C2CC2)c1 ZINC000566022119 945973602 /nfs/dbraw/zinc/97/36/02/945973602.db2.gz SLJHRXDCEZXLOB-WIYYLYMNSA-N 0 3 424.570 4.090 20 0 HIADHN CN(Cc1ccc(Cl)s1)C(=O)CN[C@@H]1c2ccccc2CC12CCOCC2 ZINC000566590679 946051672 /nfs/dbraw/zinc/05/16/72/946051672.db2.gz HEOQIJXWULGKKI-HXUWFJFHSA-N 0 3 404.963 4.044 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)c1cccc(COc2ccc(C)nc2)c1)c1ccco1 ZINC000566639241 946059488 /nfs/dbraw/zinc/05/94/88/946059488.db2.gz JZTLSHQPSQTSEC-HTAPYJJXSA-N 0 3 407.514 4.421 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)c1cccc(COc2ccc(C)nc2)c1)c1ccco1 ZINC000566639243 946061103 /nfs/dbraw/zinc/06/11/03/946061103.db2.gz JZTLSHQPSQTSEC-VGOFRKELSA-N 0 3 407.514 4.421 20 0 HIADHN Cc1nc(-c2ccc(S(=O)(=O)NCC(C)(C)N[C@@H](C)c3ccccc3)cc2)co1 ZINC000566819934 946112738 /nfs/dbraw/zinc/11/27/38/946112738.db2.gz IANPFWQJJKPMEZ-INIZCTEOSA-N 0 3 413.543 4.058 20 0 HIADHN COC(=O)C[C@@H](NC(=O)c1cccc(CN2CCCC2)c1)c1cccc2ccccc21 ZINC000566993866 946206355 /nfs/dbraw/zinc/20/63/55/946206355.db2.gz BETZFDQAMUZJCV-XMMPIXPASA-N 0 3 416.521 4.470 20 0 HIADHN COc1ccc([C@H](Cc2ccccc2)N[C@@H]2CCCN(CC(F)(F)F)C2=O)cc1 ZINC000567003181 946212540 /nfs/dbraw/zinc/21/25/40/946212540.db2.gz VTXDZEKKXATBNP-UXHICEINSA-N 0 3 406.448 4.122 20 0 HIADHN CCC[C@@H]1CN(c2nnc(C3CC3)n2C[C@H]2CCCCO2)CCN1Cc1ccccc1 ZINC000567065282 946230547 /nfs/dbraw/zinc/23/05/47/946230547.db2.gz WIXRXHHRATWTNV-DHIUTWEWSA-N 0 3 423.605 4.216 20 0 HIADHN COc1cccc(CN(C)C(=O)CN[C@H](C)c2ccc(F)c3ccccc32)c1OC ZINC000567080183 946235782 /nfs/dbraw/zinc/23/57/82/946235782.db2.gz CGRZZQCVYMCLNF-MRXNPFEDSA-N 0 3 410.489 4.305 20 0 HIADHN COc1cc2c(cc1CN1CCC[C@H](c3nc(C(F)(F)F)cn3C)C1)O[C@@H](C)C2 ZINC000567084881 946236806 /nfs/dbraw/zinc/23/68/06/946236806.db2.gz DUZWFUCDYWOIMF-KBPBESRZSA-N 0 3 409.452 4.151 20 0 HIADHN CC(C)CN(C(=O)c1ccc(N2CCc3ccccc3C2)cc1)C1CCN(C)CC1 ZINC000567265074 946282448 /nfs/dbraw/zinc/28/24/48/946282448.db2.gz AQZGRTZYFAEFNI-UHFFFAOYSA-N 0 3 405.586 4.442 20 0 HIADHN CCCC[C@H](C)N(C)CC(=O)N(Cc1nnc(-c2ccccc2Cl)o1)C1CC1 ZINC000567314712 946308439 /nfs/dbraw/zinc/30/84/39/946308439.db2.gz RBCDAWCFKSGWTJ-HNNXBMFYSA-N 0 3 404.942 4.392 20 0 HIADHN CN1CC[C@H](NCC(=O)Nc2ccc(Cl)cc2Cl)[C@H]1c1ccc(F)c(F)c1 ZINC000567373745 946319304 /nfs/dbraw/zinc/31/93/04/946319304.db2.gz ZPIUGHHNPWYNDE-PKOBYXMFSA-N 0 3 414.283 4.245 20 0 HIADHN COc1ccc([C@@H](CNC(=O)CN(C)[C@H](C)C2CC2)c2c[nH]c3ccccc32)cc1 ZINC000567718811 946400147 /nfs/dbraw/zinc/40/01/47/946400147.db2.gz UMOVYCDLPONFCZ-VGOFRKELSA-N 0 3 405.542 4.155 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)c2cnn(C(C)(C)C)c2C(F)(F)F)CCN1Cc1ccccc1 ZINC000568313913 946501182 /nfs/dbraw/zinc/50/11/82/946501182.db2.gz IAMGMSBXLRPKRJ-PBHICJAKSA-N 0 3 408.468 4.050 20 0 HIADHN CC[C@@H](C)n1ncc(C(=O)N2CCN(c3ccnc4ccccc43)CC2)c1C1CC1 ZINC000568554643 946592003 /nfs/dbraw/zinc/59/20/03/946592003.db2.gz KBDVTOGMDSWYNV-QGZVFWFLSA-N 0 3 403.530 4.242 20 0 HIADHN C[C@@H](N[C@H]1c2ccccc2CC12CCOCC2)C(=O)Nc1ccc(F)cc1Cl ZINC000568568825 946604101 /nfs/dbraw/zinc/60/41/01/946604101.db2.gz NKHRDPKGJUNKGD-VLIAUNLRSA-N 0 3 402.897 4.490 20 0 HIADHN C[C@H](N[C@@H]1c2ccccc2CC12CCOCC2)C(=O)Nc1ccc(F)cc1Cl ZINC000568568824 946605905 /nfs/dbraw/zinc/60/59/05/946605905.db2.gz NKHRDPKGJUNKGD-VBKZILBWSA-N 0 3 402.897 4.490 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(F)c2ccccc21)C(=O)N1CCN(c2ccccc2O)CC1 ZINC000568690208 946657596 /nfs/dbraw/zinc/65/75/96/946657596.db2.gz ISIJZDYRBANPNH-QZTJIDSGSA-N 0 3 421.516 4.072 20 0 HIADHN CC(C)(C)OC1CC(CCNCc2cn(-c3ccccc3Br)nn2)C1 ZINC000568699243 946665785 /nfs/dbraw/zinc/66/57/85/946665785.db2.gz LOPMHHPFMBZYFI-UHFFFAOYSA-N 0 3 407.356 4.103 20 0 HIADHN Cc1ccccc1[C@H](OC[C@H](O)CN1CC2(CCC2)[C@@H]1[C@H]1CCCO1)c1ccccc1 ZINC000568697998 946666419 /nfs/dbraw/zinc/66/64/19/946666419.db2.gz FHHGHNFAGPFSML-RCOXAODPSA-N 0 3 421.581 4.495 20 0 HIADHN COC(=O)C12CCC(C(=O)NC[C@H](c3ccc(CC(C)C)cc3)N(C)C)(CC1)CC2 ZINC000568895855 946739917 /nfs/dbraw/zinc/73/99/17/946739917.db2.gz SBFLDRXSNMSZBB-BURHJUHKSA-N 0 3 414.590 4.118 20 0 HIADHN O=C(CCC(F)(F)F)N1CCC[C@@H](NCc2ccccc2OCC(F)(F)F)C1 ZINC000568927839 946763581 /nfs/dbraw/zinc/76/35/81/946763581.db2.gz IWUKVNQYIHDEIG-CQSZACIVSA-N 0 3 412.374 4.051 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)c1cccc(OCc2csc(C)n2)c1)c1ccco1 ZINC000569025661 946801522 /nfs/dbraw/zinc/80/15/22/946801522.db2.gz WHGPHVCAAKLYPB-FOIQADDNSA-N 0 3 413.543 4.483 20 0 HIADHN COc1ccc(SC)c(OC)c1C(=O)NC[C@@H](c1ccc(SC)cc1)N(C)C ZINC000569046272 946808306 /nfs/dbraw/zinc/80/83/06/946808306.db2.gz XIKVCLMZUANQAZ-INIZCTEOSA-N 0 3 420.600 4.180 20 0 HIADHN Cc1ccc2c(c1)[C@@H](NCc1cccc(N3C(=O)NC4(CCCC4)C3=O)c1)[C@@H](C)C2 ZINC000569055901 946811850 /nfs/dbraw/zinc/81/18/50/946811850.db2.gz PPXLLKCHKCFKAN-JTSKRJEESA-N 0 3 403.526 4.387 20 0 HIADHN Cc1ccc(NC(=O)NC(=O)[C@H](C)N[C@@H](C[C@@H]2CCOC2)c2ccccc2)c(C)c1 ZINC000569073152 946815511 /nfs/dbraw/zinc/81/55/11/946815511.db2.gz MKTFCPONALCCSE-IPJJNNNSSA-N 0 3 409.530 4.098 20 0 HIADHN CC(C)Cc1ccc([C@@H](CNC(=O)c2ccc(Cn3ccnc3)cc2)N(C)C)cc1 ZINC000569163133 946828772 /nfs/dbraw/zinc/82/87/72/946828772.db2.gz BMXXSSCPBJOFES-XMMPIXPASA-N 0 3 404.558 4.163 20 0 HIADHN COc1ccc(Br)c(NC(=O)N[C@H](C)CN(C)Cc2ccccc2)c1 ZINC000569269401 946845767 /nfs/dbraw/zinc/84/57/67/946845767.db2.gz UFJJXRYXQNTUED-CQSZACIVSA-N 0 3 406.324 4.100 20 0 HIADHN Cc1cc(C)c(NC(=O)CN[C@@H]2CCN(C)[C@@H]2c2ccc(Cl)c(F)c2)c(C)c1 ZINC000569293295 946853406 /nfs/dbraw/zinc/85/34/06/946853406.db2.gz YOVQRECRDHUKHV-DENIHFKCSA-N 0 3 403.929 4.378 20 0 HIADHN C[C@H](N[C@@H]1CCN(C)[C@@H]1c1ccccc1)C(=O)N(c1nccs1)C1CCCCC1 ZINC000569533592 946888260 /nfs/dbraw/zinc/88/82/60/946888260.db2.gz LXZYEORLGYNJIS-IOMROCGXSA-N 0 3 412.603 4.232 20 0 HIADHN C[C@H](N[C@H]1CCN(C)[C@@H]1c1ccccc1)C(=O)N(c1nccs1)C1CCCCC1 ZINC000569533590 946888450 /nfs/dbraw/zinc/88/84/50/946888450.db2.gz LXZYEORLGYNJIS-DZFGPLHGSA-N 0 3 412.603 4.232 20 0 HIADHN O=C(c1ccc(Oc2cccnc2)cc1)N1CCN(c2ccnc3ccccc32)CC1 ZINC000569561216 946890602 /nfs/dbraw/zinc/89/06/02/946890602.db2.gz XRGAUQHYRCCTLI-UHFFFAOYSA-N 0 3 410.477 4.385 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)C(C)(C)c2csc(-c3cc(F)ccc3F)n2)CN1C1CC1 ZINC000569631250 946906604 /nfs/dbraw/zinc/90/66/04/946906604.db2.gz FFVMBJOGASDXON-TZMCWYRMSA-N 0 3 405.514 4.107 20 0 HIADHN C[C@H]1C[C@H](NC(=O)C(C)(C)c2csc(-c3cc(F)ccc3F)n2)CN1C1CC1 ZINC000569631247 946906821 /nfs/dbraw/zinc/90/68/21/946906821.db2.gz FFVMBJOGASDXON-JSGCOSHPSA-N 0 3 405.514 4.107 20 0 HIADHN C[C@@H]1[C@H](NC(=O)N2CCC(c3nc4ccccc4[nH]3)CC2)CCN1Cc1ccccc1 ZINC000569726642 946958224 /nfs/dbraw/zinc/95/82/24/946958224.db2.gz WWHINQZBUGPZFW-WIYYLYMNSA-N 0 3 417.557 4.115 20 0 HIADHN Cc1ccnc2ccc(C(=O)Nc3ccnn3[C@@H]3CCN(Cc4ccccc4)C3)cc12 ZINC000569754716 946987778 /nfs/dbraw/zinc/98/77/78/946987778.db2.gz LSPIKWDJGSXLMH-OAQYLSRUSA-N 0 3 411.509 4.439 20 0 HIADHN C[C@@H]1C[C@H](N2CCCC2)CN1C(=O)c1cc2sc(Nc3ccccc3)nc2s1 ZINC000569857058 947021407 /nfs/dbraw/zinc/02/14/07/947021407.db2.gz JMJUZJIQTWLEBZ-ZBFHGGJFSA-N 0 3 412.584 4.800 20 0 HIADHN CC(=O)c1ccc(NC(=O)N(C)C2CCN(CCc3ccccn3)CC2)cc1Cl ZINC000570002283 947067454 /nfs/dbraw/zinc/06/74/54/947067454.db2.gz RWTBSINXNLWETL-UHFFFAOYSA-N 0 3 414.937 4.108 20 0 HIADHN COc1ccc([C@H](C)NC[C@]2(CO)C[C@H]2c2ccc(F)cc2)c(Br)c1 ZINC000570084469 947090037 /nfs/dbraw/zinc/09/00/37/947090037.db2.gz DRKHCBZDCCUDNE-GMVOTWDCSA-N 0 3 408.311 4.414 20 0 HIADHN CC(=O)N1C[C@@H]2CCC[C@H](N[C@H](C(=O)Nc3cc(C)ccc3C)c3ccccc3)[C@H]2C1 ZINC000570123319 947100421 /nfs/dbraw/zinc/10/04/21/947100421.db2.gz IVAPXKNEJAAPBV-LCXINAFSSA-N 0 3 419.569 4.220 20 0 HIADHN C[C@H](N[C@@H]1CCN(C)[C@@H]1c1ccc(F)c(F)c1)C(=O)Nc1ccc(F)cc1Cl ZINC000570487429 947265065 /nfs/dbraw/zinc/26/50/65/947265065.db2.gz CGWHZCDXBKGMLJ-ZKWAXGPOSA-N 0 3 411.855 4.119 20 0 HIADHN Cc1cc(F)ccc1-c1nc(C(C)(C)C(=O)N[C@@H]2C[C@@H](C)N(C3CC3)C2)cs1 ZINC000570558448 947295514 /nfs/dbraw/zinc/29/55/14/947295514.db2.gz OWOOTIMNEVOBKR-GDBMZVCRSA-N 0 3 401.551 4.277 20 0 HIADHN COc1ccc(C)cc1NC(=O)[C@H](C)N[C@H]1CCN(C)[C@H]1c1ccc(Cl)cc1 ZINC000570731938 947339226 /nfs/dbraw/zinc/33/92/26/947339226.db2.gz MMLLVAXBVIVRSQ-XERREHJYSA-N 0 3 401.938 4.019 20 0 HIADHN CN(C(=O)c1ccc(NCc2ccc(OC(F)(F)F)cc2)cc1)[C@H]1CCCN(C)C1 ZINC000570745714 947344275 /nfs/dbraw/zinc/34/42/75/947344275.db2.gz ILNASMDHCHRUIR-IBGZPJMESA-N 0 3 421.463 4.364 20 0 HIADHN CCOCCC1(CNC(=O)[C@H]2CN(Cc3ccccc3)CCC2(F)F)CCCC1 ZINC000570832925 947365131 /nfs/dbraw/zinc/36/51/31/947365131.db2.gz DAZZEZDXGBKQMF-HXUWFJFHSA-N 0 3 408.533 4.247 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N1CCC(c2c[nH]c3ncccc23)CC1 ZINC000570842902 947366989 /nfs/dbraw/zinc/36/69/89/947366989.db2.gz WETANYPFPGITCW-HXUWFJFHSA-N 0 3 423.586 4.351 20 0 HIADHN CCOC(=O)[C@H]1CC[C@@H](NCc2cc(Cl)c3c(c2)OCCO3)c2ccccc21 ZINC000570855914 947370660 /nfs/dbraw/zinc/37/06/60/947370660.db2.gz SRAVNQYAYNPDCA-PKOBYXMFSA-N 0 3 401.890 4.383 20 0 HIADHN CCC(=O)Nc1ccc(NC(=O)Nc2ccc(N3CCN(CC)CC3)cc2C)cc1 ZINC000570937282 947393004 /nfs/dbraw/zinc/39/30/04/947393004.db2.gz NSBCIGQACMFKIB-UHFFFAOYSA-N 0 3 409.534 4.129 20 0 HIADHN Cc1cc(C)n(Cc2cccc(C(=O)N[C@H](CN(C)C)c3ccc(Cl)cc3)c2)n1 ZINC000571108347 947504674 /nfs/dbraw/zinc/50/46/74/947504674.db2.gz PHHNMKMPAKYEEA-JOCHJYFZSA-N 0 3 410.949 4.234 20 0 HIADHN C[C@H]1[C@H](NC(=O)CCc2ncc(-c3ccccc3F)o2)CCN1Cc1ccccc1 ZINC000571314431 947592265 /nfs/dbraw/zinc/59/22/65/947592265.db2.gz JMYGZCFFVCELAW-LAUBAEHRSA-N 0 3 407.489 4.193 20 0 HIADHN CCCCOc1ccc(CN2CC[C@@](CO)(Cc3ccc(F)cc3)C2)cc1OC ZINC000571365159 947623100 /nfs/dbraw/zinc/62/31/00/947623100.db2.gz JTJKUBJKAFNQRC-XMMPIXPASA-N 0 3 401.522 4.440 20 0 HIADHN O=C(c1ccc(CNCc2ccc(Oc3cccc(F)c3)cc2)cc1)N1CCOCC1 ZINC000571487454 947678186 /nfs/dbraw/zinc/67/81/86/947678186.db2.gz CEUNWVUEWBAWFR-UHFFFAOYSA-N 0 3 420.484 4.380 20 0 HIADHN CSc1ccc([C@@H](CNC(=O)C2(c3ccccc3C)CCOCC2)N(C)C)cc1 ZINC000571596066 947721800 /nfs/dbraw/zinc/72/18/00/947721800.db2.gz JMGOIWHLKNGQDY-JOCHJYFZSA-N 0 3 412.599 4.184 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3c(F)ccc(C)c3F)c(OCC)c2)CC1 ZINC000571749941 947774904 /nfs/dbraw/zinc/77/49/04/947774904.db2.gz YJEHQHGLXPXROM-UHFFFAOYSA-N 0 3 417.500 4.456 20 0 HIADHN CC(C)n1ncc2cc(CN3CCC[C@@H](c4nc(C(F)(F)F)cn4C)C3)cnc21 ZINC000571805460 947790713 /nfs/dbraw/zinc/79/07/13/947790713.db2.gz CYYVGCKXCQXUBL-OAHLLOKOSA-N 0 3 406.456 4.144 20 0 HIADHN CCN1CC[C@H](NCc2cc(-c3cnn(C)c3C)no2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000571823377 947795721 /nfs/dbraw/zinc/79/57/21/947795721.db2.gz ZLSUWIXONRZJNA-PZJWPPBQSA-N 0 3 417.916 4.101 20 0 HIADHN O=C(N[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000571843435 947802738 /nfs/dbraw/zinc/80/27/38/947802738.db2.gz ZMBMXEIFKZHJED-ABSDTBQOSA-N 0 3 404.341 4.273 20 0 HIADHN C[C@H](N[C@H]1c2ccccc2CC12CCOCC2)C(=O)Nc1ccccc1OC(F)F ZINC000571931188 947814963 /nfs/dbraw/zinc/81/49/63/947814963.db2.gz UGPDFIDXELVCEH-YWZLYKJASA-N 0 3 416.468 4.299 20 0 HIADHN CSc1ccc([C@H](CNC(=O)c2cc(-c3ccc4c(c3)CCO4)no2)N(C)C)cc1 ZINC000571954739 947821182 /nfs/dbraw/zinc/82/11/82/947821182.db2.gz NRWBPRIGHALZLB-FQEVSTJZSA-N 0 3 423.538 4.031 20 0 HIADHN COc1ccc(CN2CCC[C@@H](CNC(=O)Nc3cccc(F)c3)C2)c(C)c1OC ZINC000571961196 947822558 /nfs/dbraw/zinc/82/25/58/947822558.db2.gz WJSYXJCNMYBNNO-KRWDZBQOSA-N 0 3 415.509 4.185 20 0 HIADHN C/C(=C/c1ccccc1OC(F)F)CN[C@H]1CCN(Cc2ccc(F)cc2)C1=O ZINC000572084108 947843019 /nfs/dbraw/zinc/84/30/19/947843019.db2.gz YXLWHBHHQPKFME-RYBIEJRYSA-N 0 3 404.432 4.221 20 0 HIADHN CN1CCCN(c2ccc(-c3noc([C@@H]4C[C@@H]4c4ccccc4Cl)n3)cn2)CC1 ZINC000572085612 947843891 /nfs/dbraw/zinc/84/38/91/947843891.db2.gz UMEDVDLYVXCUPH-QZTJIDSGSA-N 0 3 409.921 4.198 20 0 HIADHN CCOC(=O)c1nnc(-c2cccc(C[NH2+]Cc3ccc4cc(OC)ccc4c3)c2)[n-]1 ZINC000572167084 947855236 /nfs/dbraw/zinc/85/52/36/947855236.db2.gz PLPZMNUPSDWPBV-UHFFFAOYSA-N 0 3 416.481 4.100 20 0 HIADHN CCOC(=O)c1nc(-c2cccc(C[NH2+]Cc3ccc4cc(OC)ccc4c3)c2)n[n-]1 ZINC000572167084 947855241 /nfs/dbraw/zinc/85/52/41/947855241.db2.gz PLPZMNUPSDWPBV-UHFFFAOYSA-N 0 3 416.481 4.100 20 0 HIADHN CN(C)C(=O)COc1ccccc1CN1CCC([C@@H](F)c2ccccc2F)CC1 ZINC000572324136 947884867 /nfs/dbraw/zinc/88/48/67/947884867.db2.gz KBOUNIWJAQKCEN-HSZRJFAPSA-N 0 3 402.485 4.216 20 0 HIADHN COc1ccc(-c2nc(CN[C@H]3CCN(C)[C@@H]3c3ccccc3)cs2)cc1OC ZINC000572446102 947909731 /nfs/dbraw/zinc/90/97/31/947909731.db2.gz FCMADSJFMCSPCT-SIKLNZKXSA-N 0 3 409.555 4.362 20 0 HIADHN C[C@H](CN1CCC[C@@H](CNC(=O)CC(F)(F)F)C1)c1cccc(Br)c1 ZINC000572563896 947949710 /nfs/dbraw/zinc/94/97/10/947949710.db2.gz QJXIBFYFQZHNRG-KGLIPLIRSA-N 0 3 421.301 4.333 20 0 HIADHN COc1ccc(-c2n[nH]cc2CN2CC[C@@H](Oc3ccc(C(F)(F)F)cn3)C2)cc1 ZINC000572683032 947985213 /nfs/dbraw/zinc/98/52/13/947985213.db2.gz CXOAGJZDMGTYOQ-GOSISDBHSA-N 0 3 418.419 4.152 20 0 HIADHN CCN(C(C)=O)c1nc(CNC[C@H](c2ccc(CC(C)C)cc2)N(C)C)cs1 ZINC000572796401 948012773 /nfs/dbraw/zinc/01/27/73/948012773.db2.gz HUNYYUZFBFEIHR-OAQYLSRUSA-N 0 3 402.608 4.107 20 0 HIADHN O=C(Nc1nncs1)C1CCN(Cc2ccc(-c3ccccc3F)s2)CC1 ZINC000572921646 948041923 /nfs/dbraw/zinc/04/19/23/948041923.db2.gz SPAIYTMEDQFBTF-UHFFFAOYSA-N 0 3 402.520 4.256 20 0 HIADHN COc1ccc([C@H](NCCC(=O)Nc2ccccn2)C(C)C)c(Br)c1 ZINC000573170700 948099761 /nfs/dbraw/zinc/09/97/61/948099761.db2.gz INOQZTGMRWPJDK-LJQANCHMSA-N 0 3 406.324 4.168 20 0 HIADHN Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)N[C@H](C)[C@H](c1ccccc1)N(C)C ZINC000573350332 948163139 /nfs/dbraw/zinc/16/31/39/948163139.db2.gz RCFZRKXTQRKVOH-WZONZLPQSA-N 0 3 422.573 4.480 20 0 HIADHN C[C@H](C(=O)N(Cc1ccccc1Br)C1CCN(C)CC1)c1cccnc1 ZINC000573379213 948172766 /nfs/dbraw/zinc/17/27/66/948172766.db2.gz WQTPSCPPCXGYGF-INIZCTEOSA-N 0 3 416.363 4.071 20 0 HIADHN c1ncn(-c2ccc(CN(Cc3ccc(OCc4ccccn4)cc3)C3CC3)cc2)n1 ZINC000573508343 948222159 /nfs/dbraw/zinc/22/21/59/948222159.db2.gz MGPDJIKWGNOWCD-UHFFFAOYSA-N 0 3 411.509 4.406 20 0 HIADHN C[C@@H]1[C@H](NC(=O)CCc2nnc(-c3ccc(Cl)cc3)o2)CCN1Cc1ccccc1 ZINC000573552108 948238289 /nfs/dbraw/zinc/23/82/89/948238289.db2.gz VEGBTJAFDZVFLN-OXQOHEQNSA-N 0 3 424.932 4.102 20 0 HIADHN CC(C)N1CC[C@@H](NCC(=O)Nc2cc(C(C)(C)C)no2)[C@@H]1c1ccc(F)c(F)c1 ZINC000573573306 948239225 /nfs/dbraw/zinc/23/92/25/948239225.db2.gz WVNFADRNGXGEQZ-UTKZUKDTSA-N 0 3 420.504 4.002 20 0 HIADHN CCOC(=O)[C@H]1CC[C@H](NCc2ccc(C)cc2N2CCOCC2)c2ccccc21 ZINC000573581370 948241422 /nfs/dbraw/zinc/24/14/22/948241422.db2.gz AFANMQWPMCFWCU-GOTSBHOMSA-N 0 3 408.542 4.103 20 0 HIADHN CC(=O)c1cc(Br)ccc1OCC(=O)Nc1cc(CN(C)C)ccc1C ZINC000573587569 948242388 /nfs/dbraw/zinc/24/23/88/948242388.db2.gz RIWPGQIZMFHKJC-UHFFFAOYSA-N 0 3 419.319 4.039 20 0 HIADHN COc1ccc([C@@H](CNC(=O)NC[C@H]2CC[C@@H](c3ccccc3)O2)N2CCCC2)cc1 ZINC000573852162 948311279 /nfs/dbraw/zinc/31/12/79/948311279.db2.gz BOWNSIHWTKYNKC-SMIHKQSGSA-N 0 3 423.557 4.052 20 0 HIADHN CN(C)C[C@H](NC(=O)NCCc1csc(C(C)(C)C)n1)c1ccc(Cl)cc1 ZINC000573865902 948314690 /nfs/dbraw/zinc/31/46/90/948314690.db2.gz VQXOXZQOHYLWNW-KRWDZBQOSA-N 0 3 408.999 4.239 20 0 HIADHN Cc1cc(NC(=O)[C@@H]2CCCN(Cc3cccnc3)C2)cc(C)c1Br ZINC000574136607 948374336 /nfs/dbraw/zinc/37/43/36/948374336.db2.gz RVRNDYVNJNGBBQ-QGZVFWFLSA-N 0 3 402.336 4.312 20 0 HIADHN CC(C)N1CCCN(C(=O)C(C)(C)c2csc(-c3c(F)cccc3F)n2)CC1 ZINC000574296032 948404091 /nfs/dbraw/zinc/40/40/91/948404091.db2.gz GRHJLQVBLZIPDZ-UHFFFAOYSA-N 0 3 407.530 4.309 20 0 HIADHN Cc1cccc2cc(C(=O)Nc3ccccc3CN3CCC[C@H](C(N)=O)C3)sc21 ZINC000574480409 948453617 /nfs/dbraw/zinc/45/36/17/948453617.db2.gz VXWBKKBEUAFQMH-SFHVURJKSA-N 0 3 407.539 4.159 20 0 HIADHN CN(C(=O)CN[C@@H]1c2ccccc2CC12CCOCC2)[C@H]1CCCc2ccccc21 ZINC000574560907 948474324 /nfs/dbraw/zinc/47/43/24/948474324.db2.gz VDGSJCADJLXXHH-UKILVPOCSA-N 0 3 404.554 4.206 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CC[C@H]1NS(=O)(=O)Cc1ccc2ccccc2c1 ZINC000574606013 948490529 /nfs/dbraw/zinc/49/05/29/948490529.db2.gz AKWRJRCTXCUVOJ-YADARESESA-N 0 3 408.567 4.170 20 0 HIADHN CCN(C[C@@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)Cc1cccc(Cl)c1 ZINC000574789236 948526676 /nfs/dbraw/zinc/52/66/76/948526676.db2.gz LEIPFGMUYHCUKU-HXUWFJFHSA-N 0 3 406.979 4.014 20 0 HIADHN O=C(CN1CCCC2(CCOCC2)C1)N(Cc1ccc(C(F)(F)F)cc1)C1CC1 ZINC000574819051 948536448 /nfs/dbraw/zinc/53/64/48/948536448.db2.gz BLKVXDVWRPNXIW-UHFFFAOYSA-N 0 3 410.480 4.089 20 0 HIADHN CSCc1cccnc1C(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1 ZINC000574949638 948563459 /nfs/dbraw/zinc/56/34/59/948563459.db2.gz KKCZPHFMUYNTHH-UHFFFAOYSA-N 0 3 411.493 4.167 20 0 HIADHN CCCn1c(CNc2ccc(C(=O)N(C)[C@H]3CCCN(C)C3)cc2)nc2ccccc21 ZINC000575007982 948572338 /nfs/dbraw/zinc/57/23/38/948572338.db2.gz YAJYUWKYUMFELL-NRFANRHFSA-N 0 3 419.573 4.225 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)c1nccnc1-c1nc2ccccc2s1)c1ccco1 ZINC000575016598 948573829 /nfs/dbraw/zinc/57/38/29/948573829.db2.gz YKXVCLGIVRWKNA-GOEBONIOSA-N 0 3 421.526 4.206 20 0 HIADHN C[C@@H](NCCC(=O)N1CCc2ccccc2C1)c1ccc(Br)cc1F ZINC000575213827 948632692 /nfs/dbraw/zinc/63/26/92/948632692.db2.gz MYDULTWDEKVOSB-CQSZACIVSA-N 0 3 405.311 4.214 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N[C@H]2c3ccccc3CC23CCOCC3)N(C)C)cc1 ZINC000575794628 948718237 /nfs/dbraw/zinc/71/82/37/948718237.db2.gz CQQXUZAIMBTRID-ZEQRLZLVSA-N 0 3 421.585 4.245 20 0 HIADHN COc1ccc2oc(C(=O)N3CCN(c4ccnc5ccccc54)CC3)c(C)c2c1 ZINC000575822407 948724955 /nfs/dbraw/zinc/72/49/55/948724955.db2.gz SKMXSIJOIHWXIG-UHFFFAOYSA-N 0 3 401.466 4.260 20 0 HIADHN C[C@H](NCc1ccc(C[S@](C)=O)cc1)c1ccc(I)cc1 ZINC000575855706 948743978 /nfs/dbraw/zinc/74/39/78/948743978.db2.gz RKAAULWRWWFPDI-ZSEKCTLFSA-N 0 3 413.324 4.021 20 0 HIADHN CC(C)CN(CCN(C)C)C(=O)c1cc(-c2cccs2)nc2c1cnn2C(C)C ZINC000575890251 948754689 /nfs/dbraw/zinc/75/46/89/948754689.db2.gz IRTNFRWSYHEHBA-UHFFFAOYSA-N 0 3 413.591 4.401 20 0 HIADHN FC(F)(c1cc(Cl)nc(Cl)n1)N1CCC[C@@H]2CN(Cc3ccccc3)C[C@H]21 ZINC001164628743 719056017 /nfs/dbraw/zinc/05/60/17/719056017.db2.gz ZRGRIZFNIFPUFR-HUUCEWRRSA-N 0 3 413.299 4.429 20 0 HIADHN Clc1ccc2nc(Cl)nc(N3CC[C@@H]4[C@@H]3CCN4Cc3cccnc3)c2c1 ZINC001164728521 720329901 /nfs/dbraw/zinc/32/99/01/720329901.db2.gz WANUMUNZAOKVCA-MSOLQXFVSA-N 0 3 400.313 4.185 20 0 HIADHN c1cc2c(nc(-c3ccncc3)nc2N2CC[C@H]3[C@H]2CCN3Cc2cccnc2)s1 ZINC001164723941 720469103 /nfs/dbraw/zinc/46/91/03/720469103.db2.gz DKHGFSNKRMEZQZ-VQTJNVASSA-N 0 3 414.538 4.002 20 0 HIADHN FC(F)(c1c[nH]c2nc(Cl)ccc12)N1CCCn2cnc(CNC3CCC3)c2C1 ZINC001164836346 720738513 /nfs/dbraw/zinc/73/85/13/720738513.db2.gz DPCLYEYEWSAEHA-UHFFFAOYSA-N 0 3 420.895 4.010 20 0 HIADHN FC(F)(c1cc(Cl)nc2c1CCC2)N1CCCn2cnc(CNC3CCC3)c2C1 ZINC001164843932 720741872 /nfs/dbraw/zinc/74/18/72/720741872.db2.gz MSCSGEJVSWWUHR-UHFFFAOYSA-N 0 3 421.923 4.018 20 0 HIADHN Cn1cc(CN2CC[C@H]3CN(c4nc(Cl)ccc4-c4ccccc4)C[C@H]3C2)cn1 ZINC001164765597 721128614 /nfs/dbraw/zinc/12/86/14/721128614.db2.gz JNMHETSSWNDTFK-VQTJNVASSA-N 0 3 407.949 4.094 20 0 HIADHN Cn1cc(CN2CC[C@H]3CN(c4ccc5c(Cl)ccc(Cl)c5n4)C[C@H]3C2)cn1 ZINC001164760717 721235776 /nfs/dbraw/zinc/23/57/76/721235776.db2.gz GHPMEOIHUJUJJQ-JKSUJKDBSA-N 0 3 416.356 4.233 20 0 HIADHN Cc1cc(-c2ccccc2F)nnc1N1CCN2C[C@@H](Oc3cccc(F)c3)C[C@@H]2C1 ZINC001164904672 721564311 /nfs/dbraw/zinc/56/43/11/721564311.db2.gz FDOJKWHRUGKMKI-QUCCMNQESA-N 0 3 422.479 4.072 20 0 HIADHN Cc1ccc2ncnc(N3CCC(F)(F)[C@]4(CCN(Cc5ccccn5)C4)C3)c2c1 ZINC001164907486 721693688 /nfs/dbraw/zinc/69/36/88/721693688.db2.gz UGPJZGBMZWVAGO-QFIPXVFZSA-N 0 3 409.484 4.071 20 0 HIADHN Cc1cc(Cl)c(C)nc1N1CCC(F)(F)[C@]2(CCN(Cc3ccccn3)C2)C1 ZINC001164906653 721714478 /nfs/dbraw/zinc/71/44/78/721714478.db2.gz NOIIYRZTQZMOHK-FQEVSTJZSA-N 0 3 406.908 4.485 20 0 HIADHN Cc1cc2ncnc(N3CCC(F)(F)[C@@]4(CCN(Cc5ccccn5)C4)C3)c2s1 ZINC001164906187 721718436 /nfs/dbraw/zinc/71/84/36/721718436.db2.gz KROOBSHNGWFVFP-HXUWFJFHSA-N 0 3 415.513 4.132 20 0 HIADHN Clc1cccc2c1ccnc2N1CCC2(CC1)COCCN(Cc1ccncc1)C2 ZINC001164964975 722055749 /nfs/dbraw/zinc/05/57/49/722055749.db2.gz ZOCSHEIGQMMKRP-UHFFFAOYSA-N 0 3 422.960 4.402 20 0 HIADHN Clc1cc(N2CC[C@H]3CN(Cc4cccnc4)CCO[C@H]3C2)c2ccccc2n1 ZINC001164980834 722099032 /nfs/dbraw/zinc/09/90/32/722099032.db2.gz KOQXWPCJAOXQQE-AVRDEDQJSA-N 0 3 408.933 4.011 20 0 HIADHN Cc1ccc2nc(Cl)cc(N3CC[C@H]4CN(Cc5cccnc5)CCO[C@H]4C3)c2c1 ZINC001164979814 722109845 /nfs/dbraw/zinc/10/98/45/722109845.db2.gz QFNOEGNXMHMGTB-CVDCTZTESA-N 0 3 422.960 4.319 20 0 HIADHN Cc1ccc2c(c1)nc(Cl)cc2N1CC[C@H]2CN(Cc3cccnc3)CCO[C@H]2C1 ZINC001164971452 722125917 /nfs/dbraw/zinc/12/59/17/722125917.db2.gz CLRIQJQOGYGQRD-CVDCTZTESA-N 0 3 422.960 4.319 20 0 HIADHN Cc1ccc2c(c1)cc(Cl)nc2N1CC[C@@H]2CN(Cc3cccnc3)CCO[C@@H]2C1 ZINC001164974247 722132747 /nfs/dbraw/zinc/13/27/47/722132747.db2.gz CSEBULPFGCCLCQ-DENIHFKCSA-N 0 3 422.960 4.319 20 0 HIADHN CCOC(=O)/C=C/c1ccc(N2CCC[C@]3(CCN3Cc3cccc(F)c3)C2)nc1 ZINC001164995367 722204401 /nfs/dbraw/zinc/20/44/01/722204401.db2.gz MQJSIIQPJHKBMM-DRBUTMMVSA-N 0 3 409.505 4.042 20 0 HIADHN Cc1cc(N2CCC[C@]3(CCN3Cc3cccc(F)c3)C2)nc(-c2ccncc2)n1 ZINC001164996238 722207201 /nfs/dbraw/zinc/20/72/01/722207201.db2.gz RZBIFFMYXOEZCV-DEOSSOPVSA-N 0 3 403.505 4.231 20 0 HIADHN CCCC(O)(CCC)CC(=O)Nc1cc(C)nn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000436010843 861301088 /nfs/dbraw/zinc/30/10/88/861301088.db2.gz MKHYUGLTMZCWLO-OAQYLSRUSA-N 0 3 412.578 4.298 20 0 HIADHN COc1ccc(Cl)cc1N1CC[C@H](NCc2cnn(Cc3ccc(F)cc3)c2)C1 ZINC000436236949 861545359 /nfs/dbraw/zinc/54/53/59/861545359.db2.gz BKVUNOKEACYFJS-FQEVSTJZSA-N 0 3 414.912 4.101 20 0 HIADHN COc1cccc([C@@H]2CCCN2C[C@H](O)COc2ccc(Br)cc2)c1 ZINC000009903187 845602292 /nfs/dbraw/zinc/60/22/92/845602292.db2.gz SHTXEBQPCORRFI-PXNSSMCTSA-N 0 3 406.320 4.035 20 0 HIADHN CC(C)[C@@H](NCC(=O)Nc1ccc(CN2CCOCC2)cc1)c1ccc(Cl)cc1 ZINC000010138969 845623121 /nfs/dbraw/zinc/62/31/21/845623121.db2.gz RNRMDLDWIHKATQ-HSZRJFAPSA-N 0 3 415.965 4.098 20 0 HIADHN Fc1cccc2[nH]c(CNCc3ccc(Br)cc3N3CCOCC3)cc21 ZINC000436283718 861592512 /nfs/dbraw/zinc/59/25/12/861592512.db2.gz KKRHPIKEYHPFCX-UHFFFAOYSA-N 0 3 418.310 4.196 20 0 HIADHN C[C@H](N[C@H]1C[C@H](c2cccc(F)c2)C1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000436286394 861592531 /nfs/dbraw/zinc/59/25/31/861592531.db2.gz HBMQCKOOGDAQFM-JKOKRWQUSA-N 0 3 417.333 4.377 20 0 HIADHN C[C@@H](NCc1cnn(Cc2ccc(F)cc2)c1)[C@H](OC1CCOCC1)c1ccccc1 ZINC000436294888 861600031 /nfs/dbraw/zinc/60/00/31/861600031.db2.gz PIRPOOFYTYXOEK-CLOONOSVSA-N 0 3 423.532 4.486 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)CSCc3ccccc3Cl)cc2)CC1 ZINC000011951067 845843010 /nfs/dbraw/zinc/84/30/10/845843010.db2.gz WHMXBJRBZSAHEC-UHFFFAOYSA-N 0 3 403.979 4.354 20 0 HIADHN CCn1ncc2c1nc(-c1ccccc1)cc2C(=O)NC[C@H](c1ccccc1)N(C)C ZINC000014061969 845921848 /nfs/dbraw/zinc/92/18/48/845921848.db2.gz PMDLZZNHGILXEY-HSZRJFAPSA-N 0 3 413.525 4.151 20 0 HIADHN COc1ccc(CNC(=S)NC[C@@H](c2cccs2)N2CCC(C)CC2)cc1 ZINC000016241517 846141173 /nfs/dbraw/zinc/14/11/73/846141173.db2.gz RPFRXUASSANMKI-IBGZPJMESA-N 0 3 403.617 4.194 20 0 HIADHN COc1cccc([C@@H](CNC(=S)Nc2ccc(OC(F)F)cc2)N2CCCC2)c1 ZINC000016244978 846141348 /nfs/dbraw/zinc/14/13/48/846141348.db2.gz KXYMWXYAWDXRGE-LJQANCHMSA-N 0 3 421.513 4.420 20 0 HIADHN COc1cc(C(=O)NC[C@H](c2ccccc2)N(C)C)ccc1OCc1ccccc1 ZINC000016599310 846189860 /nfs/dbraw/zinc/18/98/60/846189860.db2.gz VXQXJZJISNDMIY-JOCHJYFZSA-N 0 3 404.510 4.307 20 0 HIADHN C=CCn1c(SCC(=O)C(C#N)c2nc(C)cs2)nnc1-c1cccc(C)c1 ZINC000020067887 846378403 /nfs/dbraw/zinc/37/84/03/846378403.db2.gz LTKBRJFKLNLIAT-MRXNPFEDSA-N 0 3 409.540 4.173 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cccc(Br)c1)c1cccc(OC)c1 ZINC000021070931 846402523 /nfs/dbraw/zinc/40/25/23/846402523.db2.gz RZHRKKACGYZFGY-LJQANCHMSA-N 0 3 405.336 4.271 20 0 HIADHN C[C@H](NC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1)c1ccc(Br)s1 ZINC000436357794 861686007 /nfs/dbraw/zinc/68/60/07/861686007.db2.gz JLQHRPJADBDAFC-JDFRZJQESA-N 0 3 408.365 4.316 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)COc3ccc4ccccc4c3)c(C)c2)CC1 ZINC000022067940 846527555 /nfs/dbraw/zinc/52/75/55/846527555.db2.gz WGPICDUJRJXJII-UHFFFAOYSA-N 0 3 403.526 4.308 20 0 HIADHN Cc1noc2nc(-c3ccccc3)cc(C(=O)NC[C@H](Cc3ccccc3)N(C)C)c12 ZINC000022682147 846602664 /nfs/dbraw/zinc/60/26/64/846602664.db2.gz LRYHKBFEMCPIRB-FQEVSTJZSA-N 0 3 414.509 4.101 20 0 HIADHN Cc1noc2nc(-c3ccccc3)cc(C(=O)NC[C@@H](Cc3ccccc3)N(C)C)c12 ZINC000022682144 846602843 /nfs/dbraw/zinc/60/28/43/846602843.db2.gz LRYHKBFEMCPIRB-HXUWFJFHSA-N 0 3 414.509 4.101 20 0 HIADHN O=C(c1cc(Cl)ccc1O)N1CCCN(Cc2ccc(C(F)(F)F)cc2)CC1 ZINC000023188160 846667621 /nfs/dbraw/zinc/66/76/21/846667621.db2.gz VIFFXQOLKOYJNZ-UHFFFAOYSA-N 0 3 412.839 4.413 20 0 HIADHN CC(C)(C)OC(=O)NCc1ccc(C(=O)NC[C@H](c2ccccc2)N2CCCC2)cc1 ZINC000023740809 846744813 /nfs/dbraw/zinc/74/48/13/846744813.db2.gz SXTHKMCTLSTKRP-JOCHJYFZSA-N 0 3 423.557 4.278 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cc(F)ccc3Br)c(C)c2)CC1 ZINC000023793461 846750346 /nfs/dbraw/zinc/75/03/46/846750346.db2.gz PBPUIQPBUWJFBV-UHFFFAOYSA-N 0 3 420.326 4.291 20 0 HIADHN Cc1nc2c3ccccc3nn2c(C)c1CCC(=O)Nc1ccccc1CN(C)C ZINC000024643994 846847547 /nfs/dbraw/zinc/84/75/47/846847547.db2.gz QONZHUVHJQYCCH-UHFFFAOYSA-N 0 3 401.514 4.132 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)COc3cc(C)ccc3Cl)c(C)c2)CC1 ZINC000025185944 846938961 /nfs/dbraw/zinc/93/89/61/846938961.db2.gz JINZRQRFYBCRPI-UHFFFAOYSA-N 0 3 401.938 4.116 20 0 HIADHN COc1ccc(OC)c([C@@H]2CCCN2C[C@@H](O)COCc2ccccc2Cl)c1 ZINC000025232784 846944972 /nfs/dbraw/zinc/94/49/72/846944972.db2.gz MHTQNGOEKSEIDG-UTKZUKDTSA-N 0 3 405.922 4.072 20 0 HIADHN COc1cc(CNCc2ccc3c(c2)OCCO3)ccc1OCc1ccc(F)cc1 ZINC000025262446 846950127 /nfs/dbraw/zinc/95/01/27/846950127.db2.gz NINKEODXAVOHSO-UHFFFAOYSA-N 0 3 409.457 4.474 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(CNCc3ccc(NC(C)=O)cc3)c2)cc1 ZINC000025313002 846959191 /nfs/dbraw/zinc/95/91/91/846959191.db2.gz SBPWIFHDASDLQE-UHFFFAOYSA-N 0 3 403.482 4.196 20 0 HIADHN CN(C)Cc1ccccc1CNC(=O)c1cnn(-c2ccc(F)cc2)c1C(F)(F)F ZINC000025481384 846984917 /nfs/dbraw/zinc/98/49/17/846984917.db2.gz WMRGSULETYEQKH-UHFFFAOYSA-N 0 3 420.410 4.022 20 0 HIADHN CC(C)[C@@H](CNC(=O)c1ccc(OC[C@@H]2CCCO2)cc1)N1CCc2ccccc2C1 ZINC000025534518 846994951 /nfs/dbraw/zinc/99/49/51/846994951.db2.gz OXRTVUAXYFYNJV-LOSJGSFVSA-N 0 3 422.569 4.057 20 0 HIADHN CC(C)(CNC(=O)N[C@@H]1CCSc2ccc(F)cc21)N1CCc2ccccc2C1 ZINC000026163788 847097570 /nfs/dbraw/zinc/09/75/70/847097570.db2.gz AJDWXTFTYFZLQX-HXUWFJFHSA-N 0 3 413.562 4.499 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(CNC[C@H](c3ccco3)N3CCCC3)c2)cc1 ZINC000026307986 847121939 /nfs/dbraw/zinc/12/19/39/847121939.db2.gz VIIHLTJCQHLNEH-HSZRJFAPSA-N 0 3 419.525 4.467 20 0 HIADHN COc1ccc(OC)c([C@@H](C)NC[C@H](O)COc2c(Cl)cccc2Cl)c1 ZINC000026714805 847188516 /nfs/dbraw/zinc/18/85/16/847188516.db2.gz MYEMXWSYKQWLHQ-OLZOCXBDSA-N 0 3 400.302 4.101 20 0 HIADHN O=C(CN1CCN(C2CCCC2)CC1)Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000027117959 847250193 /nfs/dbraw/zinc/25/01/93/847250193.db2.gz HGYLGAKHCRJAGX-UHFFFAOYSA-N 0 3 423.401 4.223 20 0 HIADHN Cc1ccc(C(=O)C2CCN(C[C@H](O)COCc3ccccc3Cl)CC2)c(C)c1 ZINC000027211644 847267274 /nfs/dbraw/zinc/26/72/74/847267274.db2.gz RBEDRGMOAURTAA-NRFANRHFSA-N 0 3 415.961 4.429 20 0 HIADHN CCOc1ccc([C@@H](NCC(=O)Nc2cccnc2Cl)C(C)C)cc1OCC ZINC000027380759 847292687 /nfs/dbraw/zinc/29/26/87/847292687.db2.gz USBXCLXFDYAMBQ-FQEVSTJZSA-N 0 3 405.926 4.458 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CNC(=O)CN[C@H](c1ccccc1)C(C)C ZINC000029117275 847508975 /nfs/dbraw/zinc/50/89/75/847508975.db2.gz PEZUVVPOQMENGX-VWLOTQADSA-N 0 3 404.558 4.151 20 0 HIADHN CC(C)(CNC(=O)Cc1csc(-c2cccc(F)c2)n1)N1CCc2ccccc2C1 ZINC000029161264 847517185 /nfs/dbraw/zinc/51/71/85/847517185.db2.gz HMAUDFSPBFZMPU-UHFFFAOYSA-N 0 3 423.557 4.445 20 0 HIADHN COc1ccc(C(=O)N[C@H](CN2CCCC2)c2ccccc2)cc1Br ZINC000029178449 847520135 /nfs/dbraw/zinc/52/01/35/847520135.db2.gz LJHAHLYBFYEEBF-GOSISDBHSA-N 0 3 403.320 4.025 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)c1ccccc1NC(=O)c1ccccc1 ZINC000029368450 847552937 /nfs/dbraw/zinc/55/29/37/847552937.db2.gz MVCPQCDYETXOJH-UHFFFAOYSA-N 0 3 423.582 4.030 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1)c1ccsc1 ZINC000029414943 847560330 /nfs/dbraw/zinc/56/03/30/847560330.db2.gz PWZHNQMOPHSZOL-FQEVSTJZSA-N 0 3 416.547 4.069 20 0 HIADHN CC[C@@H](CNC(=O)c1ccc(OCc2ccncc2)cc1)N1CCc2ccccc2C1 ZINC000029912766 847649125 /nfs/dbraw/zinc/64/91/25/847649125.db2.gz CGJCTAJQDPYJIF-DEOSSOPVSA-N 0 3 415.537 4.227 20 0 HIADHN CC[C@@H](CNC(=O)CCc1ccc(OC(F)F)cc1)N1CCc2ccccc2C1 ZINC000029912748 847649788 /nfs/dbraw/zinc/64/97/88/847649788.db2.gz RTCDABLJYCCRSW-FQEVSTJZSA-N 0 3 402.485 4.174 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cnn(-c4ccc(C)cc4)c3C)c(C)c2)CC1 ZINC000029962464 847659509 /nfs/dbraw/zinc/65/95/09/847659509.db2.gz AQZUPQCVFNBZSM-UHFFFAOYSA-N 0 3 417.557 4.192 20 0 HIADHN COc1ccc(CNCc2ccc(Cn3cncn3)cc2)cc1OCc1ccccc1 ZINC000030633996 847748669 /nfs/dbraw/zinc/74/86/69/847748669.db2.gz BQQJSZATYQLSLO-UHFFFAOYSA-N 0 3 414.509 4.204 20 0 HIADHN CC[C@@H](CNC(=O)Cc1csc(Cc2ccccc2)n1)N1CCc2ccccc2C1 ZINC000030642168 847750845 /nfs/dbraw/zinc/75/08/45/847750845.db2.gz KSTLTIPZWYMJRZ-QHCPKHFHSA-N 0 3 419.594 4.230 20 0 HIADHN Cc1ccccc1CN1CCCN(C(=O)c2cccc(OCc3cscn3)c2)CC1 ZINC000031765878 847944274 /nfs/dbraw/zinc/94/42/74/847944274.db2.gz KZWNRSXJPUJTTJ-UHFFFAOYSA-N 0 3 421.566 4.379 20 0 HIADHN COc1cc(C(=O)N2CCCN(Cc3ccccc3C)CC2)ccc1OCC(C)C ZINC000031766590 847945983 /nfs/dbraw/zinc/94/59/83/847945983.db2.gz XDHHTTIBBHTZMM-UHFFFAOYSA-N 0 3 410.558 4.387 20 0 HIADHN CCOC(=O)c1cc2cc(C(=O)NC[C@H](c3ccsc3)N(CC)CC)ccc2[nH]1 ZINC000031984130 847974835 /nfs/dbraw/zinc/97/48/35/847974835.db2.gz GTGZCUAWVJSOOR-HXUWFJFHSA-N 0 3 413.543 4.219 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cccc(NC(=O)c2cccnc2)c1)c1ccsc1 ZINC000031983314 847974990 /nfs/dbraw/zinc/97/49/90/847974990.db2.gz MGTKZOCSMANOPZ-OAQYLSRUSA-N 0 3 422.554 4.208 20 0 HIADHN CCN(CC)[C@H](CNC(=O)[C@H](NC(=O)c1ccc(C)cc1)C(C)C)c1ccsc1 ZINC000031987897 847975536 /nfs/dbraw/zinc/97/55/36/847975536.db2.gz DJZGBANKFGFXLD-NHCUHLMSSA-N 0 3 415.603 4.010 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Cc3csc(-c4ccc(C)o4)n3)c(C)c2)CC1 ZINC000032235499 847993687 /nfs/dbraw/zinc/99/36/87/847993687.db2.gz NESAKBBFEBQJRS-UHFFFAOYSA-N 0 3 424.570 4.343 20 0 HIADHN Cc1cc(NC(=O)C(C)(C)C)sc1C(=O)NCCCN1CCc2ccccc2C1 ZINC000032400731 848020459 /nfs/dbraw/zinc/02/04/59/848020459.db2.gz QFDFKTQSBLIABT-UHFFFAOYSA-N 0 3 413.587 4.219 20 0 HIADHN CC[C@H](CNC(=O)Cc1csc(-c2cccc(F)c2)n1)N1CCc2ccccc2C1 ZINC000032446896 848028270 /nfs/dbraw/zinc/02/82/70/848028270.db2.gz ZQWCKSZEHMKWEB-JOCHJYFZSA-N 0 3 423.557 4.445 20 0 HIADHN CC[C@H](CNC(=O)Cc1nc(-c2ccccc2)oc1C)N1CCc2ccccc2C1 ZINC000032447328 848030015 /nfs/dbraw/zinc/03/00/15/848030015.db2.gz SLWOEQNVKAJVFC-JOCHJYFZSA-N 0 3 403.526 4.146 20 0 HIADHN CC(C)(CNC(=O)CCCc1nc(-c2cccs2)no1)N1CCc2ccccc2C1 ZINC000032638311 848058686 /nfs/dbraw/zinc/05/86/86/848058686.db2.gz QXUVDXJLPPUXRD-UHFFFAOYSA-N 0 3 424.570 4.074 20 0 HIADHN CC[C@@H](CNC(=O)CCCc1nc(-c2cccs2)no1)N1CCc2ccccc2C1 ZINC000032650082 848059177 /nfs/dbraw/zinc/05/91/77/848059177.db2.gz GMKCKOMVRJUNLZ-IBGZPJMESA-N 0 3 424.570 4.074 20 0 HIADHN CN1CCN(CCCNC(=O)c2cc(Cl)sc2Cl)[C@@H](c2ccccc2)C1 ZINC000033135784 848112287 /nfs/dbraw/zinc/11/22/87/848112287.db2.gz MUZFTDNTEIUVOM-MRXNPFEDSA-N 0 3 412.386 4.164 20 0 HIADHN Cc1cc(O)c(C(C)C)cc1C(=O)Nc1ccc(C(=O)N(C)[C@@H]2CCCN(C)C2)cc1 ZINC000436607045 861867674 /nfs/dbraw/zinc/86/76/74/861867674.db2.gz RBCDBOPGKVEHEL-HXUWFJFHSA-N 0 3 423.557 4.243 20 0 HIADHN O[C@H](CNCc1cc(Br)ccc1F)c1cccc(Br)c1 ZINC000041065404 848200719 /nfs/dbraw/zinc/20/07/19/848200719.db2.gz CZAIFJUEPVQDHL-OAHLLOKOSA-N 0 3 403.089 4.174 20 0 HIADHN CCN(CC)[C@H](CNC(=O)C[C@@H]1c2ccccc2C=CN1C(C)=O)c1ccsc1 ZINC000041441265 848214669 /nfs/dbraw/zinc/21/46/69/848214669.db2.gz XBHJQPVKDRGIIV-FGZHOGPDSA-N 0 3 411.571 4.211 20 0 HIADHN CCOc1ccccc1C(=O)N1CCC[C@H]1C(=O)C(C#N)c1nc2ccccc2s1 ZINC000041498159 848222804 /nfs/dbraw/zinc/22/28/04/848222804.db2.gz ZYDPBNGTAGQHCA-AEFFLSMTSA-N 0 3 419.506 4.176 20 0 HIADHN N#CC(C(=O)CCCNC(=O)NC1CCCCC1)c1nc2ccccc2n1C(F)F ZINC000041557163 848232001 /nfs/dbraw/zinc/23/20/01/848232001.db2.gz RFXFTLJKMOPNSK-OAHLLOKOSA-N 0 3 417.460 4.020 20 0 HIADHN O=C(Nc1cccc(CNC[C@@H](O)COc2ccccc2)c1)c1ccccc1Cl ZINC000042203360 848299964 /nfs/dbraw/zinc/29/99/64/848299964.db2.gz BCGZDRLHNMDAHW-LJQANCHMSA-N 0 3 410.901 4.122 20 0 HIADHN CCN(Cc1ccc2c(c1)OCO2)C(=O)NC[C@H](c1ccsc1)N(CC)CC ZINC000042346204 848320859 /nfs/dbraw/zinc/32/08/59/848320859.db2.gz SKFKYFJWCYNPCL-GOSISDBHSA-N 0 3 403.548 4.091 20 0 HIADHN COc1ccc(NC(C)=O)cc1NC(=O)[C@@H](C)N[C@@H](C)c1ccc2c(c1)CCCC2 ZINC000042636599 848335762 /nfs/dbraw/zinc/33/57/62/848335762.db2.gz KJPYDCWNHCSAIB-JKSUJKDBSA-N 0 3 409.530 4.210 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCCc3cccc(Cl)c3)c(C)c2)CC1 ZINC000043526511 848436258 /nfs/dbraw/zinc/43/62/58/848436258.db2.gz GCVDACSPKQUIME-UHFFFAOYSA-N 0 3 400.954 4.155 20 0 HIADHN CC(C)C(=O)Nc1ccc(NC(=O)NC[C@@H](c2cccs2)N2CCCC2)cc1 ZINC000043675120 848449170 /nfs/dbraw/zinc/44/91/70/848449170.db2.gz RHOMGQZLVGHUND-SFHVURJKSA-N 0 3 400.548 4.301 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1cc2c(cc1Cl)OCCO2)c1ccsc1 ZINC000043902704 848488884 /nfs/dbraw/zinc/48/88/84/848488884.db2.gz ATKZTLGAIMRNHY-INIZCTEOSA-N 0 3 409.939 4.377 20 0 HIADHN CC(C)(C)NC(=O)c1ccc(NC(=O)NC[C@@H](c2ccccc2)N2CCCC2)cc1 ZINC000044017452 848501867 /nfs/dbraw/zinc/50/18/67/848501867.db2.gz XXXRCJVCKMOBRC-NRFANRHFSA-N 0 3 408.546 4.174 20 0 HIADHN CN(C)C[C@H]1CCc2ccccc2N1C(=O)CCc1nc(-c2ccc(Cl)cc2)no1 ZINC000436727231 861911369 /nfs/dbraw/zinc/91/13/69/861911369.db2.gz YPGPEWCUWDHFHH-LJQANCHMSA-N 0 3 424.932 4.232 20 0 HIADHN CN(C)Cc1cccc(NC(=O)NCCNc2ncc(C(F)(F)F)cc2Cl)c1 ZINC000044293291 848540489 /nfs/dbraw/zinc/54/04/89/848540489.db2.gz JQIVVAVNWZMVBL-UHFFFAOYSA-N 0 3 415.847 4.049 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)c1cccc(OCc2cccnc2)c1 ZINC000044314679 848544918 /nfs/dbraw/zinc/54/49/18/848544918.db2.gz ZSVHYZHDBVALLD-XMMPIXPASA-N 0 3 401.510 4.228 20 0 HIADHN Cc1cc(C)n(Cc2cccc(C(=O)N3c4ccccc4CC[C@H]3CN(C)C)c2)n1 ZINC000436727456 861914774 /nfs/dbraw/zinc/91/47/74/861914774.db2.gz ZSRDQDTVYGITPE-QHCPKHFHSA-N 0 3 402.542 4.071 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1ccc(NC(=O)OC)cc1)c1cccc(OC)c1 ZINC000045304703 848662514 /nfs/dbraw/zinc/66/25/14/848662514.db2.gz PNGIBWJPHPBNFB-FQEVSTJZSA-N 0 3 414.506 4.078 20 0 HIADHN CCCNC(=O)c1cccc(NC(=O)NC[C@@H](c2ccsc2)N(CC)CC)c1 ZINC000045739258 848720786 /nfs/dbraw/zinc/72/07/86/848720786.db2.gz ZMCRDKYPJHCRQO-IBGZPJMESA-N 0 3 402.564 4.093 20 0 HIADHN C[C@@H](C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)N1CCN(C2CCCC2)CC1 ZINC000045753821 848722885 /nfs/dbraw/zinc/72/28/85/848722885.db2.gz SBHKIIMRPRLRLL-ZDUSSCGKSA-N 0 3 403.876 4.246 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)N1CCC(c2nc3ccccc3o2)CC1 ZINC000046428772 848847182 /nfs/dbraw/zinc/84/71/82/848847182.db2.gz OTNKWLURCSWJRL-UHFFFAOYSA-N 0 3 418.541 4.165 20 0 HIADHN C[C@H](Cc1cccc(C(F)(F)F)c1)[NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1 ZINC000436767313 861959842 /nfs/dbraw/zinc/95/98/42/861959842.db2.gz GLQDUOJUDUHVDS-OAHLLOKOSA-N 0 3 406.448 4.236 20 0 HIADHN C[C@@H]1CCCN(CCNC(=O)c2cnn(-c3ccc(Cl)cc3)c2C(F)(F)F)C1 ZINC000046861764 848949261 /nfs/dbraw/zinc/94/92/61/848949261.db2.gz BNFNPJQBIDAGOO-CYBMUJFWSA-N 0 3 414.859 4.006 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)N(C)[C@@H](C)c3cccs3)CC2)c1 ZINC000046867892 848950333 /nfs/dbraw/zinc/95/03/33/848950333.db2.gz IATUEAXISFQJFL-FQEVSTJZSA-N 0 3 414.619 4.361 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCc3cccc(OC(C)C)c3)c(C)c2)CC1 ZINC000047373383 849034009 /nfs/dbraw/zinc/03/40/09/849034009.db2.gz SKKCOPUGEQVHSL-UHFFFAOYSA-N 0 3 410.562 4.246 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)NC[C@@H](c1ccco1)N1CCCCC1 ZINC000047777566 849109692 /nfs/dbraw/zinc/10/96/92/849109692.db2.gz PMKQBBFCPCYNNA-RBUKOAKNSA-N 0 3 416.591 4.004 20 0 HIADHN CCCC(=O)Nc1cccc(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2)c1 ZINC000048085519 849161453 /nfs/dbraw/zinc/16/14/53/849161453.db2.gz XSCDCOCOVZHZBK-UHFFFAOYSA-N 0 3 400.498 4.160 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1ccc(C)c(NC(C)=O)c1)c1cccc(OC)c1 ZINC000048365237 849211774 /nfs/dbraw/zinc/21/17/74/849211774.db2.gz ZFHRGLRLPJHDEB-JOCHJYFZSA-N 0 3 412.534 4.167 20 0 HIADHN Cc1ccc(C(=O)N2CCC([N@H+](C)Cc3cccc(C(F)(F)F)c3)CC2)c([O-])c1 ZINC000436806942 861996401 /nfs/dbraw/zinc/99/64/01/861996401.db2.gz GYNDCQNZSZUMNZ-UHFFFAOYSA-N 0 3 406.448 4.456 20 0 HIADHN Cc1ccc(C(=O)N2CCC([N@@H+](C)Cc3cccc(C(F)(F)F)c3)CC2)c([O-])c1 ZINC000436806942 861996416 /nfs/dbraw/zinc/99/64/16/861996416.db2.gz GYNDCQNZSZUMNZ-UHFFFAOYSA-N 0 3 406.448 4.456 20 0 HIADHN O=C(NCCNCc1cccc(NC(=O)c2ccccc2Cl)c1)c1cccs1 ZINC000048715805 849259172 /nfs/dbraw/zinc/25/91/72/849259172.db2.gz INEJVUYEKMFJLF-UHFFFAOYSA-N 0 3 413.930 4.173 20 0 HIADHN N#CC(C(=O)[C@H]1CCCN(C(=O)Cc2ccc(F)cc2)C1)c1ccc2ccccc2n1 ZINC000048857318 849275715 /nfs/dbraw/zinc/27/57/15/849275715.db2.gz YSGUNVMHBKUEPG-PZJWPPBQSA-N 0 3 415.468 4.031 20 0 HIADHN Cc1cc([C@H]2CCCN2C(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)on1 ZINC000049790444 849329791 /nfs/dbraw/zinc/32/97/91/849329791.db2.gz OYZBXCJUXIXDST-QZTJIDSGSA-N 0 3 402.564 4.364 20 0 HIADHN O=C(c1ccccc1[O-])N1CCC([NH2+][C@@H]2CCc3cc(Br)ccc32)CC1 ZINC000436826506 862007479 /nfs/dbraw/zinc/00/74/79/862007479.db2.gz HLYHCQXRZUTPHS-LJQANCHMSA-N 0 3 415.331 4.036 20 0 HIADHN C[C@@H]([NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1)c1ccc(-c2ccncc2)cc1 ZINC000436832370 862013023 /nfs/dbraw/zinc/01/30/23/862013023.db2.gz VDIJMGJXINYYPH-GOSISDBHSA-N 0 3 401.510 4.410 20 0 HIADHN CCc1ccc(C(=O)N(C[C@@H]2CC[N@H+](Cc3ccccc3)C2)CC(F)(F)F)c([O-])c1 ZINC000436832430 862012660 /nfs/dbraw/zinc/01/26/60/862012660.db2.gz IXUYLISWBSRKIW-LJQANCHMSA-N 0 3 420.475 4.481 20 0 HIADHN CCc1ccc(C(=O)N(C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)CC(F)(F)F)c([O-])c1 ZINC000436832430 862012670 /nfs/dbraw/zinc/01/26/70/862012670.db2.gz IXUYLISWBSRKIW-LJQANCHMSA-N 0 3 420.475 4.481 20 0 HIADHN Cc1ccccc1C(=O)NC1CCN(Cc2ccc(OCc3cccnc3)cc2)CC1 ZINC000050960243 849422613 /nfs/dbraw/zinc/42/26/13/849422613.db2.gz BLAUQRDYRXSAAZ-UHFFFAOYSA-N 0 3 415.537 4.363 20 0 HIADHN COc1ccccc1CN(CCC(=O)Nc1ccccc1Cl)C[C@@H]1CCCO1 ZINC000051799711 849517245 /nfs/dbraw/zinc/51/72/45/849517245.db2.gz ATAZDJKBQGXPFQ-SFHVURJKSA-N 0 3 402.922 4.358 20 0 HIADHN Cc1ccccc1CN1CCCN(C(=O)c2ccc(-n3cc[nH]c3=S)cc2)CC1 ZINC000052777229 849627711 /nfs/dbraw/zinc/62/77/11/849627711.db2.gz NZVJFADPIOKMGV-UHFFFAOYSA-N 0 3 406.555 4.191 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)C1(c2cccc(Cl)c2)CCOCC1 ZINC000052960168 849650501 /nfs/dbraw/zinc/65/05/01/849650501.db2.gz SJQWFAUUABIRNO-IBGZPJMESA-N 0 3 418.990 4.403 20 0 HIADHN Cc1nn(Cc2ccc(C)cc2)c(Cl)c1C(=O)NCCN(C)Cc1ccccc1 ZINC000053349414 849697527 /nfs/dbraw/zinc/69/75/27/849697527.db2.gz ZNDOWGNFWJLUCO-UHFFFAOYSA-N 0 3 410.949 4.063 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Cc1coc(-c2ccccc2)n1)c1cccc(OC)c1 ZINC000053477556 849718200 /nfs/dbraw/zinc/71/82/00/849718200.db2.gz UGCVXBAYZMNJLF-JOCHJYFZSA-N 0 3 407.514 4.092 20 0 HIADHN CN(C)Cc1ccccc1NC(=O)[C@@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O ZINC000053476467 849718352 /nfs/dbraw/zinc/71/83/52/849718352.db2.gz DFTMIAMLRCQIGO-HNNXBMFYSA-N 0 3 406.313 4.047 20 0 HIADHN CC(C)(C)[C@@H](NCc1cc(=O)n2cc(Br)ccc2n1)c1ccccc1 ZINC000053618074 849737677 /nfs/dbraw/zinc/73/76/77/849737677.db2.gz NWQBFHNKWDECFW-IBGZPJMESA-N 0 3 400.320 4.334 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)Nc2ccc(C(=O)NC(C)(C)C)cc2)C1 ZINC000054405675 849861723 /nfs/dbraw/zinc/86/17/23/849861723.db2.gz SGKOSBMWVAPLBX-UWJYYQICSA-N 0 3 408.546 4.172 20 0 HIADHN Cc1ccc(C(=O)C2CCN(C[C@H](O)COCc3ccccc3Cl)CC2)cc1 ZINC000054421725 849864156 /nfs/dbraw/zinc/86/41/56/849864156.db2.gz CDHYOVKSYYIZIV-NRFANRHFSA-N 0 3 401.934 4.121 20 0 HIADHN Cc1cc(C(=O)NC(C)C)ccc1NC(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000054450348 849870566 /nfs/dbraw/zinc/87/05/66/849870566.db2.gz QHZQYZCCSWWOEA-RXVVDRJESA-N 0 3 408.546 4.090 20 0 HIADHN CCOC(=O)N(C)c1ccc(NC(=O)NC[C@H](c2ccccc2)N2CCCC2)cc1 ZINC000054529038 849884312 /nfs/dbraw/zinc/88/43/12/849884312.db2.gz WKFIHLXSNLUASL-OAQYLSRUSA-N 0 3 410.518 4.238 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NC1CCN(c2ccccc2)CC1)c1ccsc1 ZINC000054682666 849908764 /nfs/dbraw/zinc/90/87/64/849908764.db2.gz KPAIRLJNMFNADU-NRFANRHFSA-N 0 3 400.592 4.099 20 0 HIADHN O=C(NC1CCCCC1)NC1CCN(Cc2cccc(OCC(F)(F)F)c2)CC1 ZINC000055030015 849957654 /nfs/dbraw/zinc/95/76/54/849957654.db2.gz NXNNYBXLXSTEFD-UHFFFAOYSA-N 0 3 413.484 4.224 20 0 HIADHN Cc1nn(Cc2ccccc2Cl)c(Cl)c1C(=O)NC[C@@H](C)N1CCCCC1 ZINC000055932160 850210422 /nfs/dbraw/zinc/21/04/22/850210422.db2.gz UHEQIMQXCCOKEB-CQSZACIVSA-N 0 3 409.361 4.151 20 0 HIADHN Cc1nn(Cc2ccccc2Cl)c(Cl)c1C(=O)NC[C@H](C)N1CCCCC1 ZINC000055932161 850210816 /nfs/dbraw/zinc/21/08/16/850210816.db2.gz UHEQIMQXCCOKEB-AWEZNQCLSA-N 0 3 409.361 4.151 20 0 HIADHN C[C@@H](NCc1ccccc1CN1CCN(c2ccccc2)CC1)c1nc(C2CC2)no1 ZINC000056144165 850253454 /nfs/dbraw/zinc/25/34/54/850253454.db2.gz RATWZOLAMOWHRJ-LJQANCHMSA-N 0 3 417.557 4.120 20 0 HIADHN Cc1ccc(CNC(=O)[C@@H](C)N[C@@H](C)c2ccc(OCc3cccnc3)cc2)cc1 ZINC000056144234 850254046 /nfs/dbraw/zinc/25/40/46/850254046.db2.gz ORPGDBLRTRYECA-VQTJNVASSA-N 0 3 403.526 4.325 20 0 HIADHN C[C@H](c1ccc2ccccc2c1)N1CCC(NS(=O)(=O)c2cccs2)CC1 ZINC000056281691 850311275 /nfs/dbraw/zinc/31/12/75/850311275.db2.gz CJSKUPPHUFZKOI-MRXNPFEDSA-N 0 3 400.569 4.405 20 0 HIADHN CCc1ccc([C@H](CNC(=O)Nc2cc(NC(C)=O)ccc2Cl)N(C)C)cc1 ZINC000056693108 850441656 /nfs/dbraw/zinc/44/16/56/850441656.db2.gz FOZPYQGVAIYMSM-FQEVSTJZSA-N 0 3 402.926 4.285 20 0 HIADHN CC[C@@H](CNC(=O)Nc1ccc(-c2csnn2)cc1)N1CCc2ccccc2C1 ZINC000056787629 850482212 /nfs/dbraw/zinc/48/22/12/850482212.db2.gz MBERPLZUEHYTNI-FQEVSTJZSA-N 0 3 407.543 4.164 20 0 HIADHN CCCCOc1ccc(C(=O)N2CCC([N@@H+]3CCc4ccccc4C3)CC2)c([O-])c1 ZINC000436970532 862148244 /nfs/dbraw/zinc/14/82/44/862148244.db2.gz FKBFRXMCBFCMDD-UHFFFAOYSA-N 0 3 408.542 4.234 20 0 HIADHN CCCCOc1ccc(C(=O)N2CCC([N@H+]3CCc4ccccc4C3)CC2)c([O-])c1 ZINC000436970532 862148252 /nfs/dbraw/zinc/14/82/52/862148252.db2.gz FKBFRXMCBFCMDD-UHFFFAOYSA-N 0 3 408.542 4.234 20 0 HIADHN CCC(=O)Nc1ccc(C)c(NC(=O)NC[C@H](c2ccc(OC)cc2)N2CCCC2)c1 ZINC000057542473 850663228 /nfs/dbraw/zinc/66/32/28/850663228.db2.gz MMNFYFBLIDXCHD-JOCHJYFZSA-N 0 3 424.545 4.311 20 0 HIADHN Cc1ccc(NC(=O)C2CC2)cc1NC(=O)NCC(C)(C)N1CCc2ccccc2C1 ZINC000057544140 850665218 /nfs/dbraw/zinc/66/52/18/850665218.db2.gz PYGMNJGDTSRZBQ-UHFFFAOYSA-N 0 3 420.557 4.302 20 0 HIADHN COc1ccc(CN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)[C@@H](C)C2CC2)cc1 ZINC000057601836 850677314 /nfs/dbraw/zinc/67/73/14/850677314.db2.gz BRTOZIIGIFXWIY-IBGZPJMESA-N 0 3 409.574 4.020 20 0 HIADHN Cc1cc(C)n(-c2ccccc2NC(=O)NC[C@@H](c2ccccc2)N2CCCC2)n1 ZINC000058026898 850753457 /nfs/dbraw/zinc/75/34/57/850753457.db2.gz ZUOPNGWMLFCRTG-QHCPKHFHSA-N 0 3 403.530 4.448 20 0 HIADHN CN(C)CCN(C(=O)CCCOc1ccccc1Br)c1ccccc1 ZINC000058297296 850795936 /nfs/dbraw/zinc/79/59/36/850795936.db2.gz VVEIABMIBRLKDD-UHFFFAOYSA-N 0 3 405.336 4.203 20 0 HIADHN CN(C)CCn1c(=O)oc2ccc(NC(=S)Nc3ccc4ccccc4c3)cc21 ZINC000058467831 850832571 /nfs/dbraw/zinc/83/25/71/850832571.db2.gz BCIPMOCRYGCMGG-UHFFFAOYSA-N 0 3 406.511 4.118 20 0 HIADHN C[C@H](Sc1nc2ccc(Cl)cc2[nH]1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000058593204 850863814 /nfs/dbraw/zinc/86/38/14/850863814.db2.gz AGWGIIJOKJLKCQ-YOEHRIQHSA-N 0 3 414.962 4.088 20 0 HIADHN CN(C)CCn1c(=O)oc2ccc(NC(=O)/C=C/c3ccc(C(C)(C)C)cc3)cc21 ZINC000058739057 850907625 /nfs/dbraw/zinc/90/76/25/850907625.db2.gz ZAFXKNYCSGIIRG-MDWZMJQESA-N 0 3 407.514 4.106 20 0 HIADHN CN(C)CCn1c(=O)oc2ccc(NC(=O)c3sc4ccccc4c3Cl)cc21 ZINC000058737741 850907889 /nfs/dbraw/zinc/90/78/89/850907889.db2.gz ATAYARMOIQHOTK-UHFFFAOYSA-N 0 3 415.902 4.277 20 0 HIADHN CCN(CC)C(=O)c1ccc(NC(=O)NC[C@@H](c2ccccc2)N2CCCC2)cc1 ZINC000058864111 850946941 /nfs/dbraw/zinc/94/69/41/850946941.db2.gz IHANDICYECMBJP-QFIPXVFZSA-N 0 3 408.546 4.127 20 0 HIADHN CC[C@@H](c1ccccc1)[C@H]1CCCN1Cc1nnc2n1c1ccc(C)cc1c(=O)n2C ZINC000058956320 850968531 /nfs/dbraw/zinc/96/85/31/850968531.db2.gz KXMWEKAGSDXWPI-PZJWPPBQSA-N 0 3 415.541 4.048 20 0 HIADHN Cc1ccccc1-c1cc(C(=O)NCCN2CCCCC2)c2cnn(C(C)C)c2n1 ZINC000058980215 850971784 /nfs/dbraw/zinc/97/17/84/850971784.db2.gz ODPBAJVMSTVNJV-UHFFFAOYSA-N 0 3 405.546 4.203 20 0 HIADHN COc1cc2c(cc1OC)[C@@H](c1ccccc1)N(CCC(=O)NC1CCCC1)CC2 ZINC000059931230 851025251 /nfs/dbraw/zinc/02/52/51/851025251.db2.gz HQVKUHKNYMKDMD-RUZDIDTESA-N 0 3 408.542 4.100 20 0 HIADHN CCN(CC)C(=O)c1ccc(NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)cc1 ZINC000060061322 851035520 /nfs/dbraw/zinc/03/55/20/851035520.db2.gz GTIQWZKNDLVGEO-HXUWFJFHSA-N 0 3 411.521 4.158 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)C2(c3cccc(Cl)c3)CCOCC2)N(C)C)cc1 ZINC000060155617 851045201 /nfs/dbraw/zinc/04/52/01/851045201.db2.gz FQTRFRRSHLXKKT-OAQYLSRUSA-N 0 3 400.950 4.116 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)[C@@H]1C[C@H]1c1ccc(Br)cc1 ZINC000060300819 851060759 /nfs/dbraw/zinc/06/07/59/851060759.db2.gz UHOWWPCGVXRHMM-ZWKOTPCHSA-N 0 3 423.420 4.030 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)C1(c2ccc(C)c(OC)c2)CC1)c1cccc(OC)c1 ZINC000060322652 851064038 /nfs/dbraw/zinc/06/40/38/851064038.db2.gz KOGUWTIILOFCIB-QFIPXVFZSA-N 0 3 410.558 4.243 20 0 HIADHN Cc1nc(Cl)cc(NCc2ccccc2CN2CCN(c3ccccc3)CC2)n1 ZINC000060372282 851081205 /nfs/dbraw/zinc/08/12/05/851081205.db2.gz WGKJICBEUAESBR-UHFFFAOYSA-N 0 3 407.949 4.373 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)[C@H](C)Oc2ccc(C)cc2Br)o1 ZINC000060407160 851089534 /nfs/dbraw/zinc/08/95/34/851089534.db2.gz AQHPTBQVBQCRIK-INIZCTEOSA-N 0 3 423.351 4.017 20 0 HIADHN O=C1NCCCC[C@@H]1NCc1cn(-c2ccccc2)nc1-c1cc2ccccc2o1 ZINC000060523949 851133968 /nfs/dbraw/zinc/13/39/68/851133968.db2.gz SZAWOHFCONBXRE-FQEVSTJZSA-N 0 3 400.482 4.044 20 0 HIADHN COc1cccc([C@@H](CNC(=O)NCc2cccc3ccccc32)N2CCCC2)c1 ZINC000060574680 851152222 /nfs/dbraw/zinc/15/22/22/851152222.db2.gz CZZJSUOBRNKQBY-XMMPIXPASA-N 0 3 403.526 4.485 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)NCc1cc2ccccc2[nH]1 ZINC000060580698 851154446 /nfs/dbraw/zinc/15/44/46/851154446.db2.gz QOCKFZIEKKNDBQ-UHFFFAOYSA-N 0 3 418.463 4.460 20 0 HIADHN COC(=O)c1ccc(CN(C)C(=O)NC[C@@H](c2ccccc2)N2CCC(C)CC2)cc1 ZINC000060630896 851172728 /nfs/dbraw/zinc/17/27/28/851172728.db2.gz GDTBJXWFBGHNBY-QHCPKHFHSA-N 0 3 423.557 4.088 20 0 HIADHN O=S(=O)(NCC1CCN(Cc2cccs2)CC1)c1cc(Cl)cc(Cl)c1 ZINC000060923493 851249733 /nfs/dbraw/zinc/24/97/33/851249733.db2.gz CFKKVJVJFHXQBE-UHFFFAOYSA-N 0 3 419.399 4.245 20 0 HIADHN Cc1nn(Cc2ccc(Cl)cc2)c(Cl)c1CNC1CCN(CC(F)F)CC1 ZINC000060953628 851257740 /nfs/dbraw/zinc/25/77/40/851257740.db2.gz BTOLRSKQJTYLEI-UHFFFAOYSA-N 0 3 417.331 4.366 20 0 HIADHN Fc1cc(CNCc2ccc(-c3ccc4c(c3)CCO4)cc2)ccc1-n1cncn1 ZINC000060970842 851262867 /nfs/dbraw/zinc/26/28/67/851262867.db2.gz VEXCTLXLOARVIM-UHFFFAOYSA-N 0 3 400.457 4.298 20 0 HIADHN CCOc1cc(CNCc2ccc(C#N)cc2)ccc1OCC(=O)Nc1ccccc1 ZINC000061105950 851295078 /nfs/dbraw/zinc/29/50/78/851295078.db2.gz DXQKYNRJQXBWCQ-UHFFFAOYSA-N 0 3 415.493 4.264 20 0 HIADHN COCCOc1ccc(C(F)(F)F)cc1NC(=O)CN(C1CC1)C1CCCCC1 ZINC000061162700 851307805 /nfs/dbraw/zinc/30/78/05/851307805.db2.gz HTDNINDRLHBBFH-UHFFFAOYSA-N 0 3 414.468 4.466 20 0 HIADHN O=C(NCc1ccnc(OC2CCCC2)c1)NC[C@H](c1cccs1)N1CCCC1 ZINC000061231480 851324181 /nfs/dbraw/zinc/32/41/81/851324181.db2.gz VLTYKHZGORAOLP-LJQANCHMSA-N 0 3 414.575 4.101 20 0 HIADHN O=C(Cc1ccc(-n2cccc2)cc1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000061287956 851339555 /nfs/dbraw/zinc/33/95/55/851339555.db2.gz IXYNAFHHHHGZML-UHFFFAOYSA-N 0 3 405.567 4.250 20 0 HIADHN Cc1cc(C)n(Cc2ccc(C(=O)N(CCN(C)C)Cc3cccc(Cl)c3)cc2)n1 ZINC000061432967 851376014 /nfs/dbraw/zinc/37/60/14/851376014.db2.gz KVMNTRLWIVXDIJ-UHFFFAOYSA-N 0 3 424.976 4.406 20 0 HIADHN COCCCOc1ccccc1NC(=O)NC[C@@H](c1ccc(C)cc1)N1CCCC1 ZINC000061776167 851447876 /nfs/dbraw/zinc/44/78/76/851447876.db2.gz LTMVOVVSPPDMGH-QFIPXVFZSA-N 0 3 411.546 4.369 20 0 HIADHN CN(Cc1ccc(F)c(F)c1)C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000061793516 851455194 /nfs/dbraw/zinc/45/51/94/851455194.db2.gz AKOSIQQYGUPCCC-UHFFFAOYSA-N 0 3 405.514 4.220 20 0 HIADHN CCOc1ccc(OCC)c(NC(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)c1 ZINC000062377764 851534285 /nfs/dbraw/zinc/53/42/85/851534285.db2.gz OWQDOLVTSYYWPE-UHFFFAOYSA-N 0 3 421.488 4.358 20 0 HIADHN CCC(CC)c1nnc(NC(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)s1 ZINC000062378751 851534750 /nfs/dbraw/zinc/53/47/50/851534750.db2.gz VTVZAUGQQOKYJE-UHFFFAOYSA-N 0 3 411.522 4.316 20 0 HIADHN CC(=O)Nc1cccc(NC(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)c1 ZINC000062378282 851534782 /nfs/dbraw/zinc/53/47/82/851534782.db2.gz QYELCNLIFCLXOM-UHFFFAOYSA-N 0 3 422.451 4.260 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)Nc1cccc(Cl)c1N(C)C ZINC000062399219 851540417 /nfs/dbraw/zinc/54/04/17/851540417.db2.gz GUUQDENSYNNBOS-UHFFFAOYSA-N 0 3 410.896 4.280 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)Nc1ccc2c(c1)OC(C)(C)O2 ZINC000062411456 851546200 /nfs/dbraw/zinc/54/62/00/851546200.db2.gz DGNOIUFMCDFBCB-UHFFFAOYSA-N 0 3 405.445 4.068 20 0 HIADHN CC(=O)Nc1cc(NC(=O)N(CCN(C)C)Cc2cccc(Cl)c2)c(F)cc1F ZINC000062412079 851546926 /nfs/dbraw/zinc/54/69/26/851546926.db2.gz JECAOYGGBHBOOH-UHFFFAOYSA-N 0 3 424.879 4.172 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)N[C@H]1CCSc2ccc(F)cc21 ZINC000062476653 851559921 /nfs/dbraw/zinc/55/99/21/851559921.db2.gz OAOZEFUIPGGILH-IBGZPJMESA-N 0 3 423.504 4.414 20 0 HIADHN S=C(N[C@H](c1ccccc1)c1ccncc1)NC1CCN(Cc2ccccc2)CC1 ZINC000063144755 851620452 /nfs/dbraw/zinc/62/04/52/851620452.db2.gz RKHKREVUFCAGFR-XMMPIXPASA-N 0 3 416.594 4.300 20 0 HIADHN CC(C)C(=O)Nc1cccc(NC(=S)NC2CCN(Cc3ccccc3)CC2)c1 ZINC000063149028 851621829 /nfs/dbraw/zinc/62/18/29/851621829.db2.gz WXCAFOCJDVEBOU-UHFFFAOYSA-N 0 3 410.587 4.232 20 0 HIADHN Cc1ccc2c(CN3CCC(C(=O)NCCc4cccs4)CC3)cc(=O)oc2c1C ZINC000063301770 851654611 /nfs/dbraw/zinc/65/46/11/851654611.db2.gz ZJQFLHWNANSQBL-UHFFFAOYSA-N 0 3 424.566 4.042 20 0 HIADHN Cc1cccn2cc(COc3ccc(CNCc4ccc(CO)c(F)c4)cc3)nc12 ZINC000063319071 851658707 /nfs/dbraw/zinc/65/87/07/851658707.db2.gz XUTCQDJXTVUXSJ-UHFFFAOYSA-N 0 3 405.473 4.143 20 0 HIADHN CC[C@@H](CNC(=O)c1cccc(Cn2nc(C)cc2C)c1)N1CCc2ccccc2C1 ZINC000063505059 851705679 /nfs/dbraw/zinc/70/56/79/851705679.db2.gz LDBGBFLFZQXLID-VWLOTQADSA-N 0 3 416.569 4.115 20 0 HIADHN CCc1oc2ccccc2c1CNCc1ccc(S(=O)(=O)N(C)C(C)C)cc1 ZINC000063526108 851707544 /nfs/dbraw/zinc/70/75/44/851707544.db2.gz QLADUIDROSKPOY-UHFFFAOYSA-N 0 3 400.544 4.314 20 0 HIADHN CC(C)(C)N1CCCN(C(=O)c2ccc(-c3ccc4c(c3)OCCO4)s2)CC1 ZINC000063724677 851749105 /nfs/dbraw/zinc/74/91/05/851749105.db2.gz KAOATYGFHCXWTO-UHFFFAOYSA-N 0 3 400.544 4.133 20 0 HIADHN COc1ccccc1NC(=S)N(CCN(C)C)Cc1ccc(Br)cc1 ZINC000063790061 851764733 /nfs/dbraw/zinc/76/47/33/851764733.db2.gz WZILAUNLCVONJX-UHFFFAOYSA-N 0 3 422.392 4.218 20 0 HIADHN COc1ccc2ccc([O-])c(C[N@@H+]3CCC[C@@H](CNC(=O)OC(C)(C)C)C3)c2c1 ZINC000063859140 851780656 /nfs/dbraw/zinc/78/06/56/851780656.db2.gz JLMYQFBFACETGU-INIZCTEOSA-N 0 3 400.519 4.291 20 0 HIADHN COc1ccc2ccc([O-])c(C[N@H+]3CCC[C@@H](CNC(=O)OC(C)(C)C)C3)c2c1 ZINC000063859140 851780661 /nfs/dbraw/zinc/78/06/61/851780661.db2.gz JLMYQFBFACETGU-INIZCTEOSA-N 0 3 400.519 4.291 20 0 HIADHN COC(=O)COc1c(C)cc(CN[C@H](C)c2ccc(Br)cc2)cc1C ZINC000063902477 851789616 /nfs/dbraw/zinc/78/96/16/851789616.db2.gz MEZNLWBNKSGTSE-OAHLLOKOSA-N 0 3 406.320 4.469 20 0 HIADHN COc1ccc(CN(C)C(=O)c2cccc(CN3CCCC3)c2)cc1OC(F)F ZINC000063915460 851793605 /nfs/dbraw/zinc/79/36/05/851793605.db2.gz OSMBANVZFYTHBG-UHFFFAOYSA-N 0 3 404.457 4.165 20 0 HIADHN COC(=O)COc1c(C)cc(CNCc2cccc(NC(=O)C3CCCC3)c2)cc1C ZINC000063915612 851793809 /nfs/dbraw/zinc/79/38/09/851793809.db2.gz AITYVMGXJLUCOZ-UHFFFAOYSA-N 0 3 424.541 4.274 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@H](C)NCc2cccc(CSC)c2)cc1 ZINC000437106850 862293257 /nfs/dbraw/zinc/29/32/57/862293257.db2.gz XLSRWDJXUBIAQY-KRWDZBQOSA-N 0 3 406.617 4.431 20 0 HIADHN COc1cccc(CN(CCC(=O)Nc2ccccc2SC)C[C@@H]2CCCO2)c1 ZINC000064400250 851889158 /nfs/dbraw/zinc/88/91/58/851889158.db2.gz HSAPOPSCADSWHB-FQEVSTJZSA-N 0 3 414.571 4.427 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)Nc1nnc(C2CC2)s1 ZINC000064412315 851891081 /nfs/dbraw/zinc/89/10/81/851891081.db2.gz JCRABQUIFHCTRN-UHFFFAOYSA-N 0 3 413.469 4.030 20 0 HIADHN CCOc1ncccc1NC(=O)N(CCN(C)C)Cc1ccc(C(F)(F)F)cc1 ZINC000064412317 851891383 /nfs/dbraw/zinc/89/13/83/851891383.db2.gz QHOSDRPNHBQYGQ-UHFFFAOYSA-N 0 3 410.440 4.095 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)NCCc1cccc(F)c1 ZINC000064754109 851977757 /nfs/dbraw/zinc/97/77/57/851977757.db2.gz WUNWJBVORSEFNT-UHFFFAOYSA-N 0 3 411.443 4.160 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)NCc1cc(F)cc(F)c1 ZINC000064755167 851977777 /nfs/dbraw/zinc/97/77/77/851977777.db2.gz LCPXJZKZNLELKU-UHFFFAOYSA-N 0 3 415.406 4.257 20 0 HIADHN FC(F)(F)c1cccc(N2CCN(CCCCNc3cncc(Cl)n3)CC2)c1 ZINC000064905936 852017917 /nfs/dbraw/zinc/01/79/17/852017917.db2.gz WYSKUEOHWSTWGI-UHFFFAOYSA-N 0 3 413.875 4.163 20 0 HIADHN CCN(CC)[C@H](CNC(=O)C(=O)Nc1ccc(C)cc1)c1ccc(C(F)(F)F)cc1 ZINC000064960306 852030619 /nfs/dbraw/zinc/03/06/19/852030619.db2.gz WYWDBGQQUXERIU-LJQANCHMSA-N 0 3 421.463 4.152 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)c2cc3ccc(Br)cc3[nH]2)C1 ZINC000065140484 852076073 /nfs/dbraw/zinc/07/60/73/852076073.db2.gz YFZUJRVENYVCDT-KSSFIOAISA-N 0 3 412.331 4.496 20 0 HIADHN CCc1ccc([C@H](CNC(=O)Nc2ccc(C(=O)NCC(C)C)cc2C)N(C)C)cc1 ZINC000065377007 852116520 /nfs/dbraw/zinc/11/65/20/852116520.db2.gz HMBNLAIWNSFHTJ-QHCPKHFHSA-N 0 3 424.589 4.368 20 0 HIADHN Cc1ccc(NC(=O)C(C)C)cc1NC(=O)N1CCN(CC2CCCCC2)CC1 ZINC000065411294 852122501 /nfs/dbraw/zinc/12/25/01/852122501.db2.gz VJMLTYQKCIJORH-UHFFFAOYSA-N 0 3 400.567 4.319 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2ccc(C)cc2OC[C@H]2CCCO2)N(C)C)cc1 ZINC000065416787 852125542 /nfs/dbraw/zinc/12/55/42/852125542.db2.gz DQBKSVRVACCFRZ-IFMALSPDSA-N 0 3 411.546 4.286 20 0 HIADHN Cc1noc2nc(-c3ccccc3)cc(C(=O)NCCN(C)Cc3ccccc3)c12 ZINC000065418294 852125843 /nfs/dbraw/zinc/12/58/43/852125843.db2.gz AIXAEBANVDRRAB-UHFFFAOYSA-N 0 3 400.482 4.060 20 0 HIADHN Cc1ccc([C@H](CNC(=O)NCc2ccc(OCc3ccccn3)cc2)N(C)C)cc1 ZINC000065468561 852145391 /nfs/dbraw/zinc/14/53/91/852145391.db2.gz ZQDOOYIWXCLLBO-DEOSSOPVSA-N 0 3 418.541 4.071 20 0 HIADHN Cc1cc(Oc2ncccn2)ccc1NC(=O)N(CCc1ccccc1)CCN(C)C ZINC000065482061 852153841 /nfs/dbraw/zinc/15/38/41/852153841.db2.gz ODTCFGUYYFSUQW-UHFFFAOYSA-N 0 3 419.529 4.216 20 0 HIADHN COc1ccc2ccccc2c1CNC(=O)N[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000065523576 852168246 /nfs/dbraw/zinc/16/82/46/852168246.db2.gz FNFLOHGOANVQTB-NQIIRXRSSA-N 0 3 403.526 4.483 20 0 HIADHN O=C(Cc1csc(Cc2ccc(F)cc2)n1)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000065585017 852192515 /nfs/dbraw/zinc/19/25/15/852192515.db2.gz TUPVFFYNCKREGS-NRFANRHFSA-N 0 3 423.557 4.196 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N(C)Cc1cscn1)c1ccc(C(F)(F)F)cc1 ZINC000065696736 852222990 /nfs/dbraw/zinc/22/29/90/852222990.db2.gz XOOAJHONBQBUOG-QGZVFWFLSA-N 0 3 414.497 4.386 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)Nc3ccc4oc(C5CC5)nc4c3)cc2)CC1 ZINC000065750067 852244620 /nfs/dbraw/zinc/24/46/20/852244620.db2.gz ALQQTVTUGBTRFR-UHFFFAOYSA-N 0 3 404.514 4.488 20 0 HIADHN COc1cc(Br)cc(C)c1NC(=O)NC[C@@H](c1ccccc1)N(C)C ZINC000065752420 852245672 /nfs/dbraw/zinc/24/56/72/852245672.db2.gz JXOJQYMUPXTKRO-INIZCTEOSA-N 0 3 406.324 4.191 20 0 HIADHN COc1ccc(OCc2ccccn2)c(CNC[C@@H](c2cccc(F)c2)N(C)C)c1 ZINC000065888222 852303901 /nfs/dbraw/zinc/30/39/01/852303901.db2.gz RHXLPIVIEJTEGE-QHCPKHFHSA-N 0 3 409.505 4.201 20 0 HIADHN CN(C)Cc1ccccc1CNC(=O)c1cnn(-c2ccc(Cl)cc2Cl)c1 ZINC000065891408 852305892 /nfs/dbraw/zinc/30/58/92/852305892.db2.gz SBYHFDYJTYIHEJ-UHFFFAOYSA-N 0 3 403.313 4.171 20 0 HIADHN CN(C)[C@H](CNC(=O)c1cnn(-c2ccc(Cl)cc2Cl)c1)c1ccccc1 ZINC000065890838 852305976 /nfs/dbraw/zinc/30/59/76/852305976.db2.gz QECKEBJMAOTJFD-LJQANCHMSA-N 0 3 403.313 4.212 20 0 HIADHN C[C@@H]1C[C@@H]1C(=O)Nc1ccc(C(=O)N(CCN(C)C)Cc2cccc(Cl)c2)cc1 ZINC000065936733 852324958 /nfs/dbraw/zinc/32/49/58/852324958.db2.gz MFHXCTJTMVFZHA-IERDGZPVSA-N 0 3 413.949 4.139 20 0 HIADHN Cc1c(C(=O)N(CCN(C)C)Cc2cccc(Cl)c2)cnn1-c1ccc(F)cc1 ZINC000065936776 852325003 /nfs/dbraw/zinc/32/50/03/852325003.db2.gz BODLZHITAGBENE-UHFFFAOYSA-N 0 3 414.912 4.177 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)c1ccc(Oc2cccnc2)cc1 ZINC000065937396 852326129 /nfs/dbraw/zinc/32/61/29/852326129.db2.gz MEKURSXANJXKTD-UHFFFAOYSA-N 0 3 411.452 4.356 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)/C=C/c1ccc(Br)o1 ZINC000065937255 852326373 /nfs/dbraw/zinc/32/63/73/852326373.db2.gz IIMRHYADAYQZMB-VQHVLOKHSA-N 0 3 411.727 4.299 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)c1cc2ccc(Br)cc2[nH]1 ZINC000065939141 852328112 /nfs/dbraw/zinc/32/81/12/852328112.db2.gz IRRSFAFADWCGOV-UHFFFAOYSA-N 0 3 418.310 4.274 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)c1ccc(COc2ccc(F)cc2)o1 ZINC000065939760 852329393 /nfs/dbraw/zinc/32/93/93/852329393.db2.gz RGEJBEAGVQUSIL-UHFFFAOYSA-N 0 3 414.452 4.341 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)c(C)c1CNCCNC(=O)c1ccc(Cl)cc1 ZINC000065978956 852338290 /nfs/dbraw/zinc/33/82/90/852338290.db2.gz MLFCSHSJJCXEAV-UHFFFAOYSA-N 0 3 417.340 4.316 20 0 HIADHN COc1cc(CNCCNC(=O)c2ccccc2)ccc1OCc1ccc(Cl)cc1 ZINC000065979514 852339023 /nfs/dbraw/zinc/33/90/23/852339023.db2.gz UGAZXWDLPPUTKM-UHFFFAOYSA-N 0 3 424.928 4.447 20 0 HIADHN FC(F)(F)[C@@H](NC(=S)NC1CCN(Cc2ccccc2)CC1)c1ccccc1 ZINC000066007211 852353907 /nfs/dbraw/zinc/35/39/07/852353907.db2.gz BGECWTKJJHQMHT-IBGZPJMESA-N 0 3 407.505 4.419 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3oc4ccc(OC)cc4c3C)c(C)c2)CC1 ZINC000069178734 852386509 /nfs/dbraw/zinc/38/65/09/852386509.db2.gz AOAMVLLGORNWPR-UHFFFAOYSA-N 0 3 407.514 4.452 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3ccccc3Br)c(C)c2)CC1 ZINC000069178890 852386600 /nfs/dbraw/zinc/38/66/00/852386600.db2.gz QCEYWVHDDQLMHI-UHFFFAOYSA-N 0 3 402.336 4.152 20 0 HIADHN CN(C)[C@@H](CNC(=O)CCCOc1cccc(Br)c1)c1ccccc1 ZINC000069344956 852392910 /nfs/dbraw/zinc/39/29/10/852392910.db2.gz WHSPWOAVIDVXPK-IBGZPJMESA-N 0 3 405.336 4.027 20 0 HIADHN C[C@@H](NC(=O)NC[C@@H](c1ccccc1)N1CCCC1)c1ccc(OC(F)F)cc1 ZINC000071913300 852430111 /nfs/dbraw/zinc/43/01/11/852430111.db2.gz GIOLKJKUEKTGSC-UZLBHIALSA-N 0 3 403.473 4.485 20 0 HIADHN COc1ccc([C@@H](CNC(=O)[C@@H]2CCCN2Cc2ccccc2)N2CCCCC2)cc1 ZINC000072015392 852466952 /nfs/dbraw/zinc/46/69/52/852466952.db2.gz IZOSNSQLILUUIK-LOSJGSFVSA-N 0 3 421.585 4.003 20 0 HIADHN COc1ccc(CN(CC(=O)NCCc2nc3ccccc3s2)[C@H](C)C2CC2)cc1 ZINC000096981784 852567721 /nfs/dbraw/zinc/56/77/21/852567721.db2.gz PNONPNQFKNHNRW-QGZVFWFLSA-N 0 3 423.582 4.264 20 0 HIADHN CC[C@H](CNC(=O)c1cc(C)n(-c2nccs2)c1C)N1CCc2ccccc2C1 ZINC000097286224 852597340 /nfs/dbraw/zinc/59/73/40/852597340.db2.gz NZJHJBHUKAQIHK-HXUWFJFHSA-N 0 3 408.571 4.117 20 0 HIADHN CC[C@H](CNC(=O)Nc1c(C)nn(-c2ccccc2)c1C)N1CCc2ccccc2C1 ZINC000097307380 852600657 /nfs/dbraw/zinc/60/06/57/852600657.db2.gz QJLFMZVAHNMKIJ-JOCHJYFZSA-N 0 3 417.557 4.448 20 0 HIADHN CCN(CC)[C@H](CNC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1ccsc1 ZINC000097327267 852601457 /nfs/dbraw/zinc/60/14/57/852601457.db2.gz LSVWLCGVIUDCSZ-ZWKOTPCHSA-N 0 3 419.616 4.004 20 0 HIADHN O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)N1CCC[C@H](c2nc3ccccc3o2)C1 ZINC000097438555 852612626 /nfs/dbraw/zinc/61/26/26/852612626.db2.gz ZAVMLGCAMYBAFK-LEWJYISDSA-N 0 3 418.541 4.381 20 0 HIADHN CC[C@@H](C(=O)NC1CCN(CCOc2ccc(Cl)cc2)CC1)c1ccccc1 ZINC000097577249 852637084 /nfs/dbraw/zinc/63/70/84/852637084.db2.gz CEKCZCOHIYHBJJ-JOCHJYFZSA-N 0 3 400.950 4.493 20 0 HIADHN Cc1nc(Cc2ccc(F)cc2)sc1C(=O)NC[C@@H](Cc1ccccc1)N(C)C ZINC000106118546 852755791 /nfs/dbraw/zinc/75/57/91/852755791.db2.gz NTPKOVMVEZUCPC-HXUWFJFHSA-N 0 3 411.546 4.084 20 0 HIADHN CC1CCN([C@H](CNC(=O)NCc2cnn(-c3ccccc3)c2)c2cccs2)CC1 ZINC000107695621 852787294 /nfs/dbraw/zinc/78/72/94/852787294.db2.gz KICKHHIWCYWBKL-OAQYLSRUSA-N 0 3 423.586 4.206 20 0 HIADHN CC(C)[C@@H]1CN(C(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)CCS1 ZINC000437202341 862393408 /nfs/dbraw/zinc/39/34/08/862393408.db2.gz LLVYMEXRNLHCMC-HKUYNNGSSA-N 0 3 400.510 4.041 20 0 HIADHN CC(=O)Nc1ccc(OC[C@H](O)CN(Cc2ccccc2C(F)(F)F)C2CC2)cc1 ZINC000108086886 852822287 /nfs/dbraw/zinc/82/22/87/852822287.db2.gz NIBUWRLZILWWHI-LJQANCHMSA-N 0 3 422.447 4.068 20 0 HIADHN COc1ccc2oc(C(=O)NCCCCN3CCN(c4ccccc4)CC3)c(C)c2c1 ZINC000108478283 852854776 /nfs/dbraw/zinc/85/47/76/852854776.db2.gz PXHIHQLTAWKQPK-UHFFFAOYSA-N 0 3 421.541 4.082 20 0 HIADHN Cc1nn(-c2ccccc2)cc1CCCNC(=O)c1cccc(CN2CCCC2)c1 ZINC000108706853 852874504 /nfs/dbraw/zinc/87/45/04/852874504.db2.gz YZFDOTMNMWDZIE-UHFFFAOYSA-N 0 3 402.542 4.139 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)CCc2ncc(-c3ccccc3F)o2)C1 ZINC000108817488 852882528 /nfs/dbraw/zinc/88/25/28/852882528.db2.gz SLGRPKODHWTOPM-MJGOQNOKSA-N 0 3 407.489 4.365 20 0 HIADHN CN(C)C(=O)c1ccc(NC(=O)CN2CCC[C@@H]2c2cccc3ccccc32)cc1 ZINC000108982099 852903175 /nfs/dbraw/zinc/90/31/75/852903175.db2.gz TVCSLDCVLSLFHT-HSZRJFAPSA-N 0 3 401.510 4.317 20 0 HIADHN Cc1ccccc1-n1nc(C(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)c2c1CCC2 ZINC000109183068 852931861 /nfs/dbraw/zinc/93/18/61/852931861.db2.gz QEYZODNMDWWFRW-PZJWPPBQSA-N 0 3 414.553 4.235 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CNC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000109339422 852955576 /nfs/dbraw/zinc/95/55/76/852955576.db2.gz WCZHFKQCDBNQJY-NRFANRHFSA-N 0 3 420.532 4.157 20 0 HIADHN O=C(NCc1cc(Br)cs1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000109347441 852956578 /nfs/dbraw/zinc/95/65/78/852956578.db2.gz WRAWNMSXHKXKGW-AWEZNQCLSA-N 0 3 411.340 4.178 20 0 HIADHN Cc1sc(-c2ccco2)nc1C(=O)NC[C@@H]1CCCN(Cc2cccs2)C1 ZINC000109565375 852985861 /nfs/dbraw/zinc/98/58/61/852985861.db2.gz PFLVKJSYSIPJEE-HNNXBMFYSA-N 0 3 401.557 4.415 20 0 HIADHN C[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)N(C)C1CCN(CCc2ccccn2)CC1 ZINC000109795578 853015818 /nfs/dbraw/zinc/01/58/18/853015818.db2.gz RFYOAIPLIUBZBH-FQEVSTJZSA-N 0 3 423.601 4.312 20 0 HIADHN CC(=O)Nc1ccc(C)c(NC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)c1 ZINC000110127016 853064217 /nfs/dbraw/zinc/06/42/17/853064217.db2.gz CGNLVLNOTAEJSK-OAQYLSRUSA-N 0 3 419.447 4.347 20 0 HIADHN CCc1nc(CN(C)C(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)cs1 ZINC000110126201 853064247 /nfs/dbraw/zinc/06/42/47/853064247.db2.gz YGYZISXMJMDYAG-LJQANCHMSA-N 0 3 411.493 4.119 20 0 HIADHN Cc1c(C(=O)N2CCCN(CCCc3ccccc3)CC2)cnn1-c1ccc(F)cc1 ZINC000110200219 853072890 /nfs/dbraw/zinc/07/28/90/853072890.db2.gz CJWKZWPYZSXHBS-UHFFFAOYSA-N 0 3 420.532 4.101 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)c2cc(Br)cnc2Cl)C1 ZINC000110230363 853076971 /nfs/dbraw/zinc/07/69/71/853076971.db2.gz QRGUBTJMOWDTRP-WFASDCNBSA-N 0 3 408.727 4.063 20 0 HIADHN COc1cc(C(C)=O)ccc1OC[C@@H](O)CN(C)Cc1ccccc1-c1ccccc1 ZINC000110306299 853085098 /nfs/dbraw/zinc/08/50/98/853085098.db2.gz FVIRSICXSHAEEN-QHCPKHFHSA-N 0 3 419.521 4.437 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c2sc(C(=O)N3CCC[C@H]3CN3CCCC3)cc12 ZINC000110342246 853089303 /nfs/dbraw/zinc/08/93/03/853089303.db2.gz GSNIPLXRRVDQJY-SFHVURJKSA-N 0 3 412.534 4.235 20 0 HIADHN c1csc(-c2noc(CCCN3CCC(c4nc(-c5ccccn5)no4)CC3)n2)c1 ZINC000110426581 853099230 /nfs/dbraw/zinc/09/92/30/853099230.db2.gz YRLKOZWPYUQJNS-UHFFFAOYSA-N 0 3 422.514 4.055 20 0 HIADHN COc1ccc2cc([C@H](C)C(=O)N3CCC(CN4C[C@@H](C)O[C@@H](C)C4)CC3)ccc2c1 ZINC000110454942 853102148 /nfs/dbraw/zinc/10/21/48/853102148.db2.gz YLBCDOILDGUPPS-ZCNNSNEGSA-N 0 3 424.585 4.300 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)c3cc4c(s3)CCCCCC4)CC2)C[C@@H](C)O1 ZINC000110456901 853102485 /nfs/dbraw/zinc/10/24/85/853102485.db2.gz JXRNYLNHCKNRIP-QZTJIDSGSA-N 0 3 404.620 4.369 20 0 HIADHN Cc1nc(-c2cccs2)sc1C(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000110459903 853102554 /nfs/dbraw/zinc/10/25/54/853102554.db2.gz BYAFDJPDEWPEME-GASCZTMLSA-N 0 3 419.616 4.141 20 0 HIADHN Cc1cc(Br)ccc1NC(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000110718389 853143684 /nfs/dbraw/zinc/14/36/84/853143684.db2.gz WCMYPSOGJQRJAD-HZPDHXFCSA-N 0 3 424.383 4.111 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)NC[C@@H](c2ccccc2)N2CCCC2)c(Cl)c1 ZINC000111217258 853225680 /nfs/dbraw/zinc/22/56/80/853225680.db2.gz VUIAGGIVUSUFEB-FQEVSTJZSA-N 0 3 400.910 4.257 20 0 HIADHN CC(C)(C)[S@@](=O)Cc1cccc(NC(=O)N[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000112637007 853234970 /nfs/dbraw/zinc/23/49/70/853234970.db2.gz ODAUXAZPGGSXGO-KCWXNJEJSA-N 0 3 413.587 4.130 20 0 HIADHN Cc1nc2cc(F)ccc2cc1C(=O)N(CCN(C)C)Cc1ccc(F)c(F)c1 ZINC000116073039 853281556 /nfs/dbraw/zinc/28/15/56/853281556.db2.gz LLVYSTIMEKQSQE-UHFFFAOYSA-N 0 3 401.432 4.165 20 0 HIADHN CCN(CC)c1nc2sc(C(=O)N(CCN(C)C)c3ccccc3)cc2s1 ZINC000116140990 853286053 /nfs/dbraw/zinc/28/60/53/853286053.db2.gz RFFHBOZNFWZIRU-UHFFFAOYSA-N 0 3 402.589 4.412 20 0 HIADHN CC(C)Oc1ccc(CC[C@@H](C)NC(=O)[C@@H]2CCCN(Cc3cccnc3)C2)cc1 ZINC000116394673 853300996 /nfs/dbraw/zinc/30/09/96/853300996.db2.gz JAWYTMKNIKHAQV-NFBKMPQASA-N 0 3 409.574 4.218 20 0 HIADHN C[C@H](NC(=O)OC(C)(C)C)[C@H]1CCCCN1Cc1ccc(C(=O)N2CCCC2)cc1 ZINC000116498350 853309191 /nfs/dbraw/zinc/30/91/91/853309191.db2.gz WGACGBHUMDXMOG-GHTZIAJQSA-N 0 3 415.578 4.190 20 0 HIADHN O=C(Nc1cccc(-c2n[nH]c(C3CC3)n2)c1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000116689325 853325659 /nfs/dbraw/zinc/32/56/59/853325659.db2.gz IRJSPTZNXTXWHW-IBGZPJMESA-N 0 3 419.504 4.339 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)c1cccc2cccnc21 ZINC000116712904 853328323 /nfs/dbraw/zinc/32/83/23/853328323.db2.gz IGYFURUPJIXXGH-UHFFFAOYSA-N 0 3 401.432 4.458 20 0 HIADHN CC(C)[C@H](CNC(=O)c1ccc(NC(=O)[C@H]2C[C@H]2C)cc1)N1CCc2ccccc2C1 ZINC000116959204 853339914 /nfs/dbraw/zinc/33/99/14/853339914.db2.gz PKGLEKJPUXYWIC-DKLXNKCPSA-N 0 3 419.569 4.094 20 0 HIADHN CC(C)NC(=O)Nc1ccc(C(=O)NC[C@@H](C(C)C)N2CCc3ccccc3C2)cc1 ZINC000117409713 853356190 /nfs/dbraw/zinc/35/61/90/853356190.db2.gz UUMAHSJANMFEIP-QHCPKHFHSA-N 0 3 422.573 4.029 20 0 HIADHN CN(Cc1cccc(NC(=O)c2cccc(CN3CCCC3)c2)c1)C(=O)C(F)(F)F ZINC000139263824 853406560 /nfs/dbraw/zinc/40/65/60/853406560.db2.gz XFUSBGRCKSHDKX-UHFFFAOYSA-N 0 3 419.447 4.055 20 0 HIADHN O=C(NCc1ccc(OCc2ccccn2)cc1)c1cccc(CN2CCCC2)c1 ZINC000139325053 853408557 /nfs/dbraw/zinc/40/85/57/853408557.db2.gz BTDJYRGQHBLPQB-UHFFFAOYSA-N 0 3 401.510 4.186 20 0 HIADHN COc1ccc([C@H](C)NC(=O)Nc2ccc(CCN3CCSCC3)cc2)cc1F ZINC000139937328 853427198 /nfs/dbraw/zinc/42/71/98/853427198.db2.gz JYMCPHBFZBQNEX-INIZCTEOSA-N 0 3 417.550 4.308 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)c1ccc(C(F)(F)F)nc1 ZINC000140894304 853456023 /nfs/dbraw/zinc/45/60/23/853456023.db2.gz WJYNCJINLREONP-UHFFFAOYSA-N 0 3 419.369 4.323 20 0 HIADHN CN(C)C(=O)c1cccc(NC(=O)CN2CCC[C@H]2c2cccc3ccccc32)c1 ZINC000142725270 853498935 /nfs/dbraw/zinc/49/89/35/853498935.db2.gz SIUWWMSACTUKSS-QHCPKHFHSA-N 0 3 401.510 4.317 20 0 HIADHN C[C@@H](NCc1ccc(OCc2ccccn2)cc1)c1ccc(N2CCOC2=O)cc1 ZINC000142725907 853498961 /nfs/dbraw/zinc/49/89/61/853498961.db2.gz HZHWFGYPARKYRC-GOSISDBHSA-N 0 3 403.482 4.468 20 0 HIADHN Cc1cc(Oc2ncccn2)ccc1NC(=O)N(CCN(C)C)Cc1ccccc1 ZINC000142836009 853502403 /nfs/dbraw/zinc/50/24/03/853502403.db2.gz TVJFWGKURMSGCT-UHFFFAOYSA-N 0 3 405.502 4.173 20 0 HIADHN Cc1ccccc1-n1nc(C(=O)C(C#N)C(=O)Nc2ccccc2Cl)c2c1CCC2 ZINC000143122262 853508645 /nfs/dbraw/zinc/50/86/45/853508645.db2.gz UYUKMDZRMTXIRG-MRXNPFEDSA-N 0 3 418.884 4.284 20 0 HIADHN CC(=O)N1C=Cc2ccccc2[C@H]1CC(=O)NC[C@@H](c1ccc(C)cc1)N1CCCC1 ZINC000143205605 853509631 /nfs/dbraw/zinc/50/96/31/853509631.db2.gz ZMVIAVIDTHSFQN-RPBOFIJWSA-N 0 3 417.553 4.212 20 0 HIADHN CN(C)Cc1cccc(NC(=O)NCc2ccc(Cn3cnc4ccccc43)cc2)c1 ZINC000143330182 853512748 /nfs/dbraw/zinc/51/27/48/853512748.db2.gz AOTIKDVVHSIUFM-UHFFFAOYSA-N 0 3 413.525 4.468 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3cc(OC)c(OC)cc3C)c(C)c2)CC1 ZINC000144030821 853528247 /nfs/dbraw/zinc/52/82/47/853528247.db2.gz IBDWDNAXCDLIHW-UHFFFAOYSA-N 0 3 412.534 4.107 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=S)Nc2ccccc2Oc2ccccc2)CC1 ZINC000145285510 853549658 /nfs/dbraw/zinc/54/96/58/853549658.db2.gz QSMDILDWOKBBPH-LJQANCHMSA-N 0 3 412.603 4.039 20 0 HIADHN COc1ccc(F)cc1[C@H](C)NC(=S)NC1CCN(Cc2ccccc2)CC1 ZINC000145644327 853553878 /nfs/dbraw/zinc/55/38/78/853553878.db2.gz SZGZAEVEMUMRJD-INIZCTEOSA-N 0 3 401.551 4.024 20 0 HIADHN O=C(OCc1nc2ccccc2o1)C1CCN(c2cc(Cl)ccc2Cl)C1=O ZINC000149162336 853619193 /nfs/dbraw/zinc/61/91/93/853619193.db2.gz WSXSFEFLSKUGOH-GFCCVEGCSA-N 0 3 405.237 4.231 20 0 HIADHN O=C(/C=C/c1ccc(Cl)s1)NCCCCN1CCN(c2ccccc2)CC1 ZINC000195586152 853698065 /nfs/dbraw/zinc/69/80/65/853698065.db2.gz NPVBGLMTUWGJNV-PKNBQFBNSA-N 0 3 403.979 4.133 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(NC(N)=O)cc1)c1ccc(I)cc1 ZINC000195616686 853716008 /nfs/dbraw/zinc/71/60/08/853716008.db2.gz CVTUDELVNAKWNL-NEPJUHHUSA-N 0 3 409.271 4.194 20 0 HIADHN Cc1cc(NC(=O)c2ccc(F)cc2Cl)sc1C(=O)N(C)C1CCN(C)CC1 ZINC000195628085 853725056 /nfs/dbraw/zinc/72/50/56/853725056.db2.gz ARIWMHYALZPHPW-UHFFFAOYSA-N 0 3 423.941 4.268 20 0 HIADHN CC(C)(CNC(=O)NC[C@H]1CCCO[C@H]1c1ccccc1)N1CCc2ccccc2C1 ZINC000195660637 853742334 /nfs/dbraw/zinc/74/23/34/853742334.db2.gz JMXHTYHJVJKYRW-VWNXMTODSA-N 0 3 421.585 4.290 20 0 HIADHN CC[C@H](NCC(=O)NC1CCN(C(=O)C2CCCCC2)CC1)c1ccc(Cl)cc1 ZINC000195669387 853748525 /nfs/dbraw/zinc/74/85/25/853748525.db2.gz ARNQLTSSLDYBFW-NRFANRHFSA-N 0 3 419.997 4.068 20 0 HIADHN O=C(C1CCN(Cc2ccc(OC(F)(F)F)cc2)CC1)N1CCc2ccccc21 ZINC000195684981 853757045 /nfs/dbraw/zinc/75/70/45/853757045.db2.gz WMKHQDQSORKKGT-UHFFFAOYSA-N 0 3 404.432 4.387 20 0 HIADHN CCOc1cc(F)ccc1NC(=O)Nc1ccc(N2CCN(CC)CC2)cc1C ZINC000195701165 853767620 /nfs/dbraw/zinc/76/76/20/853767620.db2.gz HOLILEGRCSRBKU-UHFFFAOYSA-N 0 3 400.498 4.319 20 0 HIADHN CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccccc1SC(F)F ZINC000195702108 853768269 /nfs/dbraw/zinc/76/82/69/853768269.db2.gz RRQUYLXPAGLUDT-UHFFFAOYSA-N 0 3 404.486 4.469 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)c1ccc(N(C)c2ccccc2)nc1 ZINC000195724810 853779294 /nfs/dbraw/zinc/77/92/94/853779294.db2.gz WWVKOUMTUQPDGR-UHFFFAOYSA-N 0 3 424.495 4.332 20 0 HIADHN COc1ccc(CN(Cc2cc(=O)n3ccsc3n2)C2CCCCC2)cc1OC ZINC000195733015 853783795 /nfs/dbraw/zinc/78/37/95/853783795.db2.gz LQYWSBWCHYBTOV-UHFFFAOYSA-N 0 3 413.543 4.108 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2C(=O)N(C)C2CCN(C)CC2)c(C)c1 ZINC000215835789 853838827 /nfs/dbraw/zinc/83/88/27/853838827.db2.gz MYVQWHBNEMYANU-UHFFFAOYSA-N 0 3 402.542 4.322 20 0 HIADHN CC[C@H](C)c1ccccc1NC(=O)[C@@H](C)NC[C@@H](c1cccs1)N1CCOCC1 ZINC000216380605 853850965 /nfs/dbraw/zinc/85/09/65/853850965.db2.gz OBHBNKQQQLCPIM-UEXGIBASSA-N 0 3 415.603 4.252 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)[C@@H](Oc3ccccc3)c3ccccc3)CC2)C[C@@H](C)O1 ZINC000228897415 853890676 /nfs/dbraw/zinc/89/06/76/853890676.db2.gz JPKZLHJMNDQCPX-OTPAQWSUSA-N 0 3 422.569 4.155 20 0 HIADHN c1cn(-c2ccc(CNCc3cn(-c4ccccc4)nc3-c3ccncc3)cc2)cn1 ZINC000236584846 853900355 /nfs/dbraw/zinc/90/03/55/853900355.db2.gz JLRJYMZWFWBKFK-UHFFFAOYSA-N 0 3 406.493 4.410 20 0 HIADHN Cc1nn(-c2ccc(F)cc2F)c(C)c1CNC[C@H](O)c1cccc(OC(C)C)c1 ZINC000236596444 853901357 /nfs/dbraw/zinc/90/13/57/853901357.db2.gz QSQBEHTUUBXOOQ-QHCPKHFHSA-N 0 3 415.484 4.378 20 0 HIADHN CC(=O)Nc1ccc(CCNCc2c(C)nn(-c3ccc(F)cc3)c2Cl)cc1 ZINC000236597714 853901661 /nfs/dbraw/zinc/90/16/61/853901661.db2.gz WZPNBZWAKWIMDX-UHFFFAOYSA-N 0 3 400.885 4.264 20 0 HIADHN CC(=O)N1CCC(N[C@@H](c2ccccc2)c2ccc(Br)cc2F)CC1 ZINC000236612085 853902917 /nfs/dbraw/zinc/90/29/17/853902917.db2.gz CBDFVDNYABKHCH-FQEVSTJZSA-N 0 3 405.311 4.278 20 0 HIADHN Brc1cc(CNCc2ccccc2-n2cccn2)cc2c1OCCCO2 ZINC000236651745 853907016 /nfs/dbraw/zinc/90/70/16/853907016.db2.gz SSOXGKBJGSQYJC-UHFFFAOYSA-N 0 3 414.303 4.086 20 0 HIADHN CC(C)(C)OC(=O)N1CCc2cccc(CNC[C@H](O)c3ccccc3Cl)c21 ZINC000236733781 853917292 /nfs/dbraw/zinc/91/72/92/853917292.db2.gz KLZUWDGFGURNHX-IBGZPJMESA-N 0 3 402.922 4.461 20 0 HIADHN CC(C)c1nn(C)c(Cl)c1CNC[C@@H](c1ccc(Cl)cc1)N1CCOCC1 ZINC000236847955 853928950 /nfs/dbraw/zinc/92/89/50/853928950.db2.gz IRQLLCSBYSEOQE-SFHVURJKSA-N 0 3 411.377 4.013 20 0 HIADHN CCOc1cc(CNC[C@@H](c2ccco2)N2CCCC2)cc(Br)c1OC ZINC000236854971 853930131 /nfs/dbraw/zinc/93/01/31/853930131.db2.gz KSSVASJGFSRCII-KRWDZBQOSA-N 0 3 423.351 4.376 20 0 HIADHN CCOc1cc(CN[C@@H]2CCc3c2cccc3Cl)ccc1O[C@@H](C)C(=O)N(C)C ZINC000236893190 853932842 /nfs/dbraw/zinc/93/28/42/853932842.db2.gz SNDIVTSSMFQBFI-MGPUTAFESA-N 0 3 416.949 4.371 20 0 HIADHN CCOC(=O)N1CCC(NCc2c(C)nn(-c3cccc(Cl)c3)c2Cl)CC1 ZINC000236894834 853933926 /nfs/dbraw/zinc/93/39/26/853933926.db2.gz NNJQNTLWTOLCNT-UHFFFAOYSA-N 0 3 411.333 4.198 20 0 HIADHN CCCOc1c(Cl)cc(CNCc2ccnc(-n3cccn3)c2)cc1OCC ZINC000236911809 853936146 /nfs/dbraw/zinc/93/61/46/853936146.db2.gz OHYPKKQPZJYCPJ-UHFFFAOYSA-N 0 3 400.910 4.398 20 0 HIADHN CCOc1cc(CNCc2ccc(NC(N)=O)cc2)ccc1OCc1ccccc1 ZINC000236968297 853944270 /nfs/dbraw/zinc/94/42/70/853944270.db2.gz BVJGRZVBYAUFBX-UHFFFAOYSA-N 0 3 405.498 4.445 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@H](C)NCc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000236984603 853947641 /nfs/dbraw/zinc/94/76/41/853947641.db2.gz VROGLOPDAXKFHX-HNNXBMFYSA-N 0 3 420.916 4.380 20 0 HIADHN CC[C@@H](NCc1ccc(Br)c(C)c1)c1ccccc1OCC(=O)N(C)C ZINC000237006627 853950334 /nfs/dbraw/zinc/95/03/34/853950334.db2.gz RMGZORWDTLSHFW-LJQANCHMSA-N 0 3 419.363 4.465 20 0 HIADHN CCc1ccccc1CNCc1cc(I)c(OC)c(OC)c1 ZINC000237005771 853950343 /nfs/dbraw/zinc/95/03/43/853950343.db2.gz SVDMRZFBFISNOU-UHFFFAOYSA-N 0 3 411.283 4.161 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@@H](C)NC/C=C/c2ccccc2OC)cc1 ZINC000237007678 853950527 /nfs/dbraw/zinc/95/05/27/853950527.db2.gz BOMFWDNWWGNKCO-SXAWMYDMSA-N 0 3 402.560 4.090 20 0 HIADHN CN(C)Cc1cc(CNCc2cc(Cl)ccc2OC[C@@H]2CCCO2)ccc1F ZINC000237063190 853958720 /nfs/dbraw/zinc/95/87/20/853958720.db2.gz XDQZBYALDSGIRQ-FQEVSTJZSA-N 0 3 406.929 4.388 20 0 HIADHN CC(=O)N(c1nc(CNC[C@@H](Cc2ccccc2)N(C)C)cs1)c1ccc(C)cc1 ZINC000237177187 853976720 /nfs/dbraw/zinc/97/67/20/853976720.db2.gz WRIPYTURGJCMGS-HSZRJFAPSA-N 0 3 422.598 4.399 20 0 HIADHN COc1cc(Br)c(CNC[C@@H](c2ccc(C)o2)N2CCCC2)cc1OC ZINC000237221245 853985701 /nfs/dbraw/zinc/98/57/01/853985701.db2.gz LSRPFFSXHGQMQD-KRWDZBQOSA-N 0 3 423.351 4.294 20 0 HIADHN CNC(=O)c1ccc(CN[C@@H](Cc2ccccc2C)c2ccc(OC)c(OC)c2)cc1 ZINC000237227098 853986695 /nfs/dbraw/zinc/98/66/95/853986695.db2.gz NSYKMJMWNOSEHC-QHCPKHFHSA-N 0 3 418.537 4.445 20 0 HIADHN CN1CCN(c2cccc(Cl)c2CNCc2ccc(Br)cc2)CC1 ZINC000237235698 853987613 /nfs/dbraw/zinc/98/76/13/853987613.db2.gz SDOQIQKZOLGLKX-UHFFFAOYSA-N 0 3 408.771 4.144 20 0 HIADHN COc1ccc(CNCc2ccc3c(c2)OCCCO3)cc1OCc1cccnc1 ZINC000237252649 853991250 /nfs/dbraw/zinc/99/12/50/853991250.db2.gz PPBKILSXKXIKNF-UHFFFAOYSA-N 0 3 406.482 4.120 20 0 HIADHN COc1cc(CNCc2ccc(NC(=O)c3ccc(F)cc3)cc2)cc2c1OCO2 ZINC000237254995 853991791 /nfs/dbraw/zinc/99/17/91/853991791.db2.gz VBVYNWSOTZPFOY-UHFFFAOYSA-N 0 3 408.429 4.105 20 0 HIADHN COc1cc(CNCc2ccc(-c3ccc(Cl)cc3)s2)ccc1OCC(N)=O ZINC000237262281 853993360 /nfs/dbraw/zinc/99/33/60/853993360.db2.gz MYSCOZCOEJWFKB-UHFFFAOYSA-N 0 3 416.930 4.231 20 0 HIADHN COc1cc(CNCc2ccc(-c3ccccc3Cl)s2)ccc1OCC(N)=O ZINC000237264458 853993386 /nfs/dbraw/zinc/99/33/86/853993386.db2.gz YWTRTZXWGBOGQL-UHFFFAOYSA-N 0 3 416.930 4.231 20 0 HIADHN COc1ccc(OC)c(NC(=O)C[C@@H](C)N[C@H]2CCSc3c(F)cccc32)c1 ZINC000237398090 854022608 /nfs/dbraw/zinc/02/26/08/854022608.db2.gz YPZIEFUYAKCYSC-DYVFJYSZSA-N 0 3 404.507 4.387 20 0 HIADHN COc1cc(CN[C@@H](c2ccc(Cl)cc2)C2CC2)cc(Cl)c1OCC(N)=O ZINC000237402327 854024648 /nfs/dbraw/zinc/02/46/48/854024648.db2.gz HSLXSHJZMUDYSF-LJQANCHMSA-N 0 3 409.313 4.107 20 0 HIADHN COc1ccc(OC)c([C@@H](O)CNCC2=Cc3cc(Cl)cc(Cl)c3OC2)c1 ZINC000237409800 854025449 /nfs/dbraw/zinc/02/54/49/854025449.db2.gz JRLYUTSZWVQKML-SFHVURJKSA-N 0 3 410.297 4.110 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2CNCc2ccccc2Br)C[C@@H](C)O1 ZINC000237412997 854026999 /nfs/dbraw/zinc/02/69/99/854026999.db2.gz MPBYHFFLVULCGK-IAGOWNOFSA-N 0 3 403.364 4.348 20 0 HIADHN COc1cc(CN[C@H]2CCCc3ccccc32)cc(I)c1OC ZINC000237416129 854027859 /nfs/dbraw/zinc/02/78/59/854027859.db2.gz UFKVKRPIXYCFOC-KRWDZBQOSA-N 0 3 423.294 4.476 20 0 HIADHN COc1ccc(Br)c(C(=O)NCCCNCc2ccc([C@H]3C[C@@H]3C)o2)c1 ZINC000237419146 854028802 /nfs/dbraw/zinc/02/88/02/854028802.db2.gz NOJZVSCQSODOIZ-BBRMVZONSA-N 0 3 421.335 4.084 20 0 HIADHN COc1ccc(CCCNCc2csc(-c3ccc4c(c3)OCO4)n2)cc1OC ZINC000237517569 854048663 /nfs/dbraw/zinc/04/86/63/854048663.db2.gz LDAGAMZTCMDPRB-UHFFFAOYSA-N 0 3 412.511 4.278 20 0 HIADHN C[C@@H]1CN(C(=O)c2ccc(CNCc3cccc(OC(F)(F)F)c3)cc2)C[C@H](C)O1 ZINC000237548594 854053317 /nfs/dbraw/zinc/05/33/17/854053317.db2.gz GDEANTWJDNSXTJ-IYBDPMFKSA-N 0 3 422.447 4.124 20 0 HIADHN C[C@H]1C[C@@H]1c1ccc(CNCc2cc(C(F)(F)F)ccc2N2CCN(C)CC2)o1 ZINC000237573186 854056130 /nfs/dbraw/zinc/05/61/30/854056130.db2.gz LWDGTSSMWJGAFL-KXBFYZLASA-N 0 3 407.480 4.463 20 0 HIADHN C[C@H](NCc1ccc(CSC(F)F)o1)c1cc(F)ccc1N1CCN(C)CC1 ZINC000237594583 854059497 /nfs/dbraw/zinc/05/94/97/854059497.db2.gz ZOXNRTAMBLNJIU-AWEZNQCLSA-N 0 3 413.509 4.477 20 0 HIADHN C[C@H]1CN(Cc2ccccc2CNCc2ccccc2Br)C[C@H](C)O1 ZINC000237623558 854063523 /nfs/dbraw/zinc/06/35/23/854063523.db2.gz MPBYHFFLVULCGK-IRXDYDNUSA-N 0 3 403.364 4.348 20 0 HIADHN C[C@H]1CN(Cc2ccccc2CNCc2ccc(Br)cc2F)C[C@H](C)O1 ZINC000237621361 854063539 /nfs/dbraw/zinc/06/35/39/854063539.db2.gz LQKIMEXRZKFYGC-HOTGVXAUSA-N 0 3 421.354 4.487 20 0 HIADHN Cc1cc(CNCc2ccccc2CS(C)(=O)=O)cc(C)c1OCc1ccccn1 ZINC000237637670 854065860 /nfs/dbraw/zinc/06/58/60/854065860.db2.gz CGICGTHQPOUACR-UHFFFAOYSA-N 0 3 424.566 4.112 20 0 HIADHN Cc1nn(-c2ccccc2)c(Oc2ccc(F)cc2)c1CNCCCN1CCCC1=O ZINC000237648721 854067835 /nfs/dbraw/zinc/06/78/35/854067835.db2.gz SDBSGFZABAWFSA-UHFFFAOYSA-N 0 3 422.504 4.214 20 0 HIADHN Cc1nn(Cc2ccccc2)c(Cl)c1CNC[C@H](c1ccccc1)N1CCOCC1 ZINC000237657928 854069705 /nfs/dbraw/zinc/06/97/05/854069705.db2.gz OWVWLELMHJZFLF-HSZRJFAPSA-N 0 3 424.976 4.056 20 0 HIADHN Cc1nn(-c2cc(C)ccc2C)c(Cl)c1CNC[C@H]1CCN(CC(F)(F)F)C1 ZINC000237686787 854076016 /nfs/dbraw/zinc/07/60/16/854076016.db2.gz ZDCGXEVCAODRRX-MRXNPFEDSA-N 0 3 414.903 4.425 20 0 HIADHN Cc1ccc(-c2nn(-c3ccc(F)cc3)cc2CNCc2ccc(C(N)=O)cc2)cc1 ZINC000237701485 854079001 /nfs/dbraw/zinc/07/90/01/854079001.db2.gz ZSWMQYOSMAZMKC-UHFFFAOYSA-N 0 3 414.484 4.376 20 0 HIADHN FC(F)(F)c1ccc(N2CCC(NCc3csc(-c4ccccn4)n3)CC2)nc1 ZINC000237723076 854083835 /nfs/dbraw/zinc/08/38/35/854083835.db2.gz CHBLBUSUORVUKE-UHFFFAOYSA-N 0 3 419.476 4.378 20 0 HIADHN Cc1nn(Cc2ccc(Cl)cc2)c(C)c1CNC[C@H](O)COc1cccc(C)c1 ZINC000237771423 854093572 /nfs/dbraw/zinc/09/35/72/854093572.db2.gz YCKVKEPZADQKDJ-NRFANRHFSA-N 0 3 413.949 4.040 20 0 HIADHN Cc1ccc(Br)cc1NC(=O)CCNCc1cc(F)c(F)c(F)c1 ZINC000237788803 854097130 /nfs/dbraw/zinc/09/71/30/854097130.db2.gz SINVVIFKPLCEKJ-UHFFFAOYSA-N 0 3 401.226 4.293 20 0 HIADHN Cc1nn(-c2cccc(C(F)(F)F)c2)c(Cl)c1CNC[C@@H]1CCC[C@H](O)C1 ZINC000237809445 854102310 /nfs/dbraw/zinc/10/23/10/854102310.db2.gz JGARQMRDQZQMIN-CJNGLKHVSA-N 0 3 401.860 4.494 20 0 HIADHN O=C(CCNCc1cccc(NC(=O)c2ccccc2Cl)c1)NCc1ccccc1 ZINC000237858860 854109440 /nfs/dbraw/zinc/10/94/40/854109440.db2.gz MBTJGRLEDVOZLU-UHFFFAOYSA-N 0 3 421.928 4.388 20 0 HIADHN Cc1nn(-c2ccccc2)cc1CNCCC(=O)Nc1ccc(Br)cc1 ZINC000237900472 854116667 /nfs/dbraw/zinc/11/66/67/854116667.db2.gz HDLBPNNLNQFTRN-UHFFFAOYSA-N 0 3 413.319 4.062 20 0 HIADHN Fc1ccc([C@@H](CNCc2ccc(CSC(F)F)o2)N2CCOCC2)cc1 ZINC000237930560 854120814 /nfs/dbraw/zinc/12/08/14/854120814.db2.gz FWMVJHYYNNAXPV-GOSISDBHSA-N 0 3 400.466 4.038 20 0 HIADHN O[C@@H](CNCc1cn(-c2ccccc2)nc1-c1cccnc1)c1c(F)cccc1F ZINC000238073106 854140843 /nfs/dbraw/zinc/14/08/43/854140843.db2.gz FKIRRONDNIZAGB-NRFANRHFSA-N 0 3 406.436 4.036 20 0 HIADHN CC[C@@H]1c2ccsc2CCN1C(=O)CNC1(c2ccc(F)cc2)CCOCC1 ZINC000261440421 854263062 /nfs/dbraw/zinc/26/30/62/854263062.db2.gz MBOVPLAGOUZYOO-LJQANCHMSA-N 0 3 402.535 4.019 20 0 HIADHN COc1ccccc1[C@H](CNc1nc(-c2ccncc2)nc(C)c1C)N1CCCC1 ZINC000301167964 854317654 /nfs/dbraw/zinc/31/76/54/854317654.db2.gz INRQMSROWBWMOR-NRFANRHFSA-N 0 3 403.530 4.413 20 0 HIADHN Cc1nc2ccc(Br)cc2c(N2CCC(NC(=O)C3CC3)CC2)c1C ZINC000301350673 854368329 /nfs/dbraw/zinc/36/83/29/854368329.db2.gz IQKPSEHFMNFCKH-UHFFFAOYSA-N 0 3 402.336 4.109 20 0 HIADHN Cc1ccc([C@H](CNc2nc3c(cnn3-c3ccccc3)c(=O)[nH]2)N2CCCC2)cc1 ZINC000301443858 854395877 /nfs/dbraw/zinc/39/58/77/854395877.db2.gz YSSCHZKINMQLMG-NRFANRHFSA-N 0 3 414.513 4.079 20 0 HIADHN Clc1ccc(-c2cc3ncnc(N4CCN(C[C@H]5CCOC5)CC4)c3s2)cc1 ZINC000301519175 854411352 /nfs/dbraw/zinc/41/13/52/854411352.db2.gz CPQCOWFWHKVPAC-OAHLLOKOSA-N 0 3 414.962 4.170 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(N[C@@H]3CC[N@H+](Cc4ccccc4)[C@@H](C)C3)nc2)n1 ZINC000301532280 854414042 /nfs/dbraw/zinc/41/40/42/854414042.db2.gz KNFGGICKAACYIP-LAUBAEHRSA-N 0 3 403.530 4.272 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(N[C@@H]3CC[N@@H+](Cc4ccccc4)[C@@H](C)C3)nc2)n1 ZINC000301532280 854414046 /nfs/dbraw/zinc/41/40/46/854414046.db2.gz KNFGGICKAACYIP-LAUBAEHRSA-N 0 3 403.530 4.272 20 0 HIADHN C[C@@H]1CN(CCC2CCN(c3nc(C(F)F)nc4ccccc43)CC2)C[C@H](C)O1 ZINC000301536079 854415021 /nfs/dbraw/zinc/41/50/21/854415021.db2.gz IXBYIGNXWVZFLK-IYBDPMFKSA-N 0 3 404.505 4.283 20 0 HIADHN Cc1nc2ccc(Br)cc2c(N2CCC[C@@H](c3nncn3C)C2)c1C ZINC000301989162 854510387 /nfs/dbraw/zinc/51/03/87/854510387.db2.gz OHSDBJQRUSDAGW-CQSZACIVSA-N 0 3 400.324 4.127 20 0 HIADHN CC(C)(C)c1nnc2ccc(N[C@@H]3CCN(Cc4ccc(C(F)(F)F)cc4)C3)nn21 ZINC000302261792 854557781 /nfs/dbraw/zinc/55/77/81/854557781.db2.gz ABJPZLQRWQMBRF-MRXNPFEDSA-N 0 3 418.467 4.127 20 0 HIADHN COc1ccc([C@@H](CNc2ccc3nnc(C(C)(C)C)n3n2)N2CCCCC2)cc1 ZINC000302281267 854559289 /nfs/dbraw/zinc/55/92/89/854559289.db2.gz JCAAGSQKNFDSED-LJQANCHMSA-N 0 3 408.550 4.070 20 0 HIADHN CN(C)[C@H](CNc1ccc2nnc(C(C)(C)C)n2n1)c1cccc(C(F)(F)F)c1 ZINC000302349142 854562686 /nfs/dbraw/zinc/56/26/86/854562686.db2.gz AUWXYCVOXHTSGJ-OAHLLOKOSA-N 0 3 406.456 4.155 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(NC[C@@]3(C)CCC[N@@H+]3Cc3ccccc3)nc2)n1 ZINC000302410967 854569699 /nfs/dbraw/zinc/56/96/99/854569699.db2.gz LNKFHVTYMTXGNQ-XMMPIXPASA-N 0 3 403.530 4.273 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(NC[C@@]3(C)CCC[N@H+]3Cc3ccccc3)nc2)n1 ZINC000302410967 854569706 /nfs/dbraw/zinc/56/97/06/854569706.db2.gz LNKFHVTYMTXGNQ-XMMPIXPASA-N 0 3 403.530 4.273 20 0 HIADHN CN(C)[C@@H](CNc1ncc(Cn2cc(Br)cn2)s1)c1cccc(F)c1 ZINC000302449987 854572115 /nfs/dbraw/zinc/57/21/15/854572115.db2.gz PASBHYALXOMLHE-INIZCTEOSA-N 0 3 424.343 4.004 20 0 HIADHN COc1ccc([C@H](CNc2ncc(Br)cc2Cl)N(C)C)cc1OC ZINC000302711955 854609867 /nfs/dbraw/zinc/60/98/67/854609867.db2.gz IHFIDMGUEHUVEL-AWEZNQCLSA-N 0 3 414.731 4.230 20 0 HIADHN COc1ccc([C@H](NCC(=O)N2CCC[C@@H]2c2ccc3c(c2)OCCO3)C(C)C)cc1 ZINC000302764073 854626097 /nfs/dbraw/zinc/62/60/97/854626097.db2.gz SDALXKIEBKXESR-PXDATVDWSA-N 0 3 424.541 4.117 20 0 HIADHN O=C(Nc1ccccc1)c1ccc(CN[C@H](CN2CCOCC2)c2ccccc2)cc1 ZINC000302771101 854629816 /nfs/dbraw/zinc/62/98/16/854629816.db2.gz ZUSXFCHMUARAOJ-RUZDIDTESA-N 0 3 415.537 4.102 20 0 HIADHN C[C@H](N[C@H](Cc1ccccc1)c1ccccc1)C(=O)Nc1ccc2c(c1)OCCO2 ZINC000302804741 854639896 /nfs/dbraw/zinc/63/98/96/854639896.db2.gz KDRLDMPPSVUKTH-PGRDOPGGSA-N 0 3 402.494 4.358 20 0 HIADHN COc1ccc(SCCC(=O)NC[C@H](c2ccc(OC)cc2)N2CCCC2)cc1 ZINC000302886890 854666362 /nfs/dbraw/zinc/66/63/62/854666362.db2.gz CTIDQAFVSBVKBU-JOCHJYFZSA-N 0 3 414.571 4.139 20 0 HIADHN CN(Cc1ccccc1Br)C(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000302904637 854674212 /nfs/dbraw/zinc/67/42/12/854674212.db2.gz YJLGYRHMGRXOBV-QGZVFWFLSA-N 0 3 422.392 4.489 20 0 HIADHN CC1CCN([C@H](CNC(=O)c2cc(Br)cn2C)c2cccs2)CC1 ZINC000302908929 854675574 /nfs/dbraw/zinc/67/55/74/854675574.db2.gz HWUOPOBLVYESAO-MRXNPFEDSA-N 0 3 410.381 4.052 20 0 HIADHN CN(C)[C@H](CNC(=O)c1cc2c(cc(Br)cc2F)[nH]1)c1ccccc1 ZINC000302927150 854684243 /nfs/dbraw/zinc/68/42/43/854684243.db2.gz DMJUZWNJFNSWLM-GOSISDBHSA-N 0 3 404.283 4.102 20 0 HIADHN Cc1c(C(=O)NC[C@@H](c2ccccc2)N2CCC(C)CC2)cnn1Cc1ccccc1 ZINC000302970222 854702754 /nfs/dbraw/zinc/70/27/54/854702754.db2.gz NXTJZUZINSUPGR-VWLOTQADSA-N 0 3 416.569 4.443 20 0 HIADHN C[C@@H](CN1CCCCC1)NC(=O)c1oc2ccccc2c1CSc1ncccn1 ZINC000302980700 854707464 /nfs/dbraw/zinc/70/74/64/854707464.db2.gz CYZZGDGPMYGGFK-INIZCTEOSA-N 0 3 410.543 4.119 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)c1csc(-c2ccc(F)cc2)n1 ZINC000303001914 854717841 /nfs/dbraw/zinc/71/78/41/854717841.db2.gz OLMVVHLJUDCOFS-UHFFFAOYSA-N 0 3 419.472 4.431 20 0 HIADHN COc1ccc(CC2CCN([C@H](C)C(=O)N[C@H](C)c3ccccc3OC)CC2)cc1 ZINC000303086547 854754427 /nfs/dbraw/zinc/75/44/27/854754427.db2.gz GTXHVHILPCQKJD-RTBURBONSA-N 0 3 410.558 4.224 20 0 HIADHN COc1ccc(CNC(=O)NC[C@H](c2ccc(C)cc2)N(C)C)c(C(F)(F)F)c1 ZINC000303160014 854793497 /nfs/dbraw/zinc/79/34/97/854793497.db2.gz PEUBBZDGMHGHQE-LJQANCHMSA-N 0 3 409.452 4.125 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Cc2ccccc2Br)N2CCCC2)cc1 ZINC000303172968 854800265 /nfs/dbraw/zinc/80/02/65/854800265.db2.gz BQWOZMGMIYIQOJ-FQEVSTJZSA-N 0 3 401.348 4.253 20 0 HIADHN Cc1nn(Cc2ccc(C)cc2)c(C)c1CCC(=O)NC[C@@H](c1ccccc1)N(C)C ZINC000303262245 854840339 /nfs/dbraw/zinc/84/03/39/854840339.db2.gz DEBHEEKMTVJIKX-VWLOTQADSA-N 0 3 418.585 4.208 20 0 HIADHN CCOc1ccc(NC(=O)COc2ccc(CN3CCC=C(C)C3)cc2OC)cc1 ZINC000437337491 862610800 /nfs/dbraw/zinc/61/08/00/862610800.db2.gz MDMANMLHUCLHFH-UHFFFAOYSA-N 0 3 410.514 4.263 20 0 HIADHN CN(C[C@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)c1c(Cl)cccc1Cl ZINC000437340226 862614331 /nfs/dbraw/zinc/61/43/31/862614331.db2.gz JXWNSGJTDKFDAI-MRXNPFEDSA-N 0 3 413.370 4.136 20 0 HIADHN Cc1c(Br)cccc1NC(=O)N1CCC(CN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000303360487 854891949 /nfs/dbraw/zinc/89/19/49/854891949.db2.gz HMTWQBYUWQEBGA-GJZGRUSLSA-N 0 3 424.383 4.111 20 0 HIADHN COc1ccc(S[C@@H](C)C(=O)NCC2(N3CCSCC3)CCCCC2)cc1 ZINC000303435397 854936389 /nfs/dbraw/zinc/93/63/89/854936389.db2.gz GAIOEYABSAZOKP-KRWDZBQOSA-N 0 3 408.633 4.044 20 0 HIADHN C[C@@H](CNC(=O)N(Cc1ccccc1)CC1CCOCC1)N(C)Cc1ccccc1 ZINC000303449134 854948399 /nfs/dbraw/zinc/94/83/99/854948399.db2.gz HVLWDICVCMCCIC-NRFANRHFSA-N 0 3 409.574 4.145 20 0 HIADHN C[C@@H](CNC(=O)NCc1ccc(Oc2ccc(F)cc2)nc1)N(C)Cc1ccccc1 ZINC000303453774 854953364 /nfs/dbraw/zinc/95/33/64/854953364.db2.gz JKOKVLDIHNPIDN-SFHVURJKSA-N 0 3 422.504 4.333 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)[C@H]1C[C@H]1c1cccc(C(F)(F)F)c1 ZINC000303454028 854953706 /nfs/dbraw/zinc/95/37/06/854953706.db2.gz KEBKSASFZVIEEO-SFTDATJTSA-N 0 3 402.460 4.374 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCCC1)c1ccc(F)cc1Br ZINC000303494150 854982700 /nfs/dbraw/zinc/98/27/00/854982700.db2.gz WPWZOAXPWXBJKE-UHFFFAOYSA-N 0 3 415.372 4.070 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)[C@@H](C)Oc3ccc(F)cc3Cl)c(C)c2)CC1 ZINC000303545649 855032171 /nfs/dbraw/zinc/03/21/71/855032171.db2.gz UWGABNKYLCAAIL-MRXNPFEDSA-N 0 3 419.928 4.335 20 0 HIADHN Cc1nc2c(s1)[C@@H](N(C)C(=O)[C@H]1CCCN(Cc3cccc(F)c3)C1)CCC2 ZINC000303576854 855052238 /nfs/dbraw/zinc/05/22/38/855052238.db2.gz ZLOJHFKLESHJPV-PXNSSMCTSA-N 0 3 401.551 4.339 20 0 HIADHN CC(C)n1c2ccccc2nc1[C@H]1CCCN(C[C@@H](O)COc2ccc(F)cc2)C1 ZINC000303577058 855053011 /nfs/dbraw/zinc/05/30/11/855053011.db2.gz QDLQEVYUVVCJRT-AZUAARDMSA-N 0 3 411.521 4.376 20 0 HIADHN CCOc1ccccc1CN(C)CCC(=O)Nc1c(C)nn(-c2ccccc2)c1C ZINC000303588355 855062211 /nfs/dbraw/zinc/06/22/11/855062211.db2.gz GYBAISJTEQNQKH-UHFFFAOYSA-N 0 3 406.530 4.348 20 0 HIADHN O=C(Nc1cccc(OC(=O)[C@H]2CCCN(Cc3ccccc3)C2)c1)c1ccco1 ZINC000303590325 855063021 /nfs/dbraw/zinc/06/30/21/855063021.db2.gz HJTLIBCAEXZSNW-IBGZPJMESA-N 0 3 404.466 4.350 20 0 HIADHN COc1ccc([C@H](CNC(=O)/C=C/c2ccnc3ccccc23)N2CCCC2)cc1 ZINC000303639066 855095965 /nfs/dbraw/zinc/09/59/65/855095965.db2.gz ARZFIZBJCYNYRL-MURVUTHMSA-N 0 3 401.510 4.210 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N2CCC(C(F)(F)F)(C(F)(F)F)C2)N(C)C)cc1 ZINC000303640036 855096842 /nfs/dbraw/zinc/09/68/42/855096842.db2.gz AXAJNOBVNCTXHE-CQSZACIVSA-N 0 3 411.390 4.124 20 0 HIADHN C[C@@H](c1ccccc1)N1CCC(NC(=O)CCC(=O)c2ccc3c(c2)CCC3)CC1 ZINC000303652110 855107163 /nfs/dbraw/zinc/10/71/63/855107163.db2.gz KSAZLTXBSAAFDO-IBGZPJMESA-N 0 3 404.554 4.480 20 0 HIADHN C[C@H](c1ccccc1)N1CCC(NC(=O)CCC(=O)c2ccc3c(c2)CCC3)CC1 ZINC000303652111 855107468 /nfs/dbraw/zinc/10/74/68/855107468.db2.gz KSAZLTXBSAAFDO-LJQANCHMSA-N 0 3 404.554 4.480 20 0 HIADHN O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)N1CCC(C(F)(F)F)(C(F)(F)F)C1 ZINC000303661238 855114092 /nfs/dbraw/zinc/11/40/92/855114092.db2.gz HMTHNRIQCWUWCO-OAHLLOKOSA-N 0 3 423.401 4.177 20 0 HIADHN Cc1ccc(S(=O)(=O)N(C)[C@@H]2CCN(Cc3ccccc3)[C@H](C)C2)cc1Cl ZINC000303788855 855199077 /nfs/dbraw/zinc/19/90/77/855199077.db2.gz JNKHGUQBAIALIH-IEBWSBKVSA-N 0 3 406.979 4.322 20 0 HIADHN Cc1ccc(S(=O)(=O)N(C)[C@H]2CCN(Cc3ccccc3)[C@@H](C)C2)cc1Cl ZINC000303788853 855199522 /nfs/dbraw/zinc/19/95/22/855199522.db2.gz JNKHGUQBAIALIH-HKUYNNGSSA-N 0 3 406.979 4.322 20 0 HIADHN C[C@@H]1C[C@@H](N(C)S(=O)(=O)C2=Cc3ccccc3CC2)CCN1Cc1ccccc1 ZINC000303834110 855232280 /nfs/dbraw/zinc/23/22/80/855232280.db2.gz RLEBFKWLFHCPNS-XXBNENTESA-N 0 3 410.583 4.288 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)CCN3c4ccccc4CC[C@@H]3C)c(C)c2)CC1 ZINC000303837467 855235580 /nfs/dbraw/zinc/23/55/80/855235580.db2.gz IJIKKFBDRFTCGY-NRFANRHFSA-N 0 3 420.601 4.307 20 0 HIADHN Cc1oc(-c2ccccc2)nc1CC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C ZINC000303845550 855242061 /nfs/dbraw/zinc/24/20/61/855242061.db2.gz NQEHDXJADWSJIF-LJQANCHMSA-N 0 3 403.526 4.316 20 0 HIADHN CCOc1ccc(Oc2cc(CNC(=O)c3cccc(CN(C)C)c3)ccn2)cc1 ZINC000303853554 855248620 /nfs/dbraw/zinc/24/86/20/855248620.db2.gz LDHMQPWVDZJOPA-UHFFFAOYSA-N 0 3 405.498 4.264 20 0 HIADHN CC(C)COC[C@@H](NC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C)c1ccco1 ZINC000303858928 855253664 /nfs/dbraw/zinc/25/36/64/855253664.db2.gz PGPVPCYBOFFNJM-RBBKRZOGSA-N 0 3 413.562 4.299 20 0 HIADHN Cc1ccc(S(=O)(=O)N(C)[C@@H]2CCN(Cc3ccccc3)[C@@H](C)C2)c(Cl)c1 ZINC000303860363 855255442 /nfs/dbraw/zinc/25/54/42/855255442.db2.gz WLRYTSFHQROIRE-PKOBYXMFSA-N 0 3 406.979 4.322 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2ccc(CN(C)C(=O)C(C)C)cc2)N2CCCC2)cc1 ZINC000303969888 855329704 /nfs/dbraw/zinc/32/97/04/855329704.db2.gz ZQNHZPAFQKOQQV-XMMPIXPASA-N 0 3 421.585 4.176 20 0 HIADHN COc1ccc(Br)c(CNC2(C)CCN(C(=O)OC(C)(C)C)CC2)c1 ZINC000310601785 855366645 /nfs/dbraw/zinc/36/66/45/855366645.db2.gz HLEFEQNCHUSKGU-UHFFFAOYSA-N 0 3 413.356 4.337 20 0 HIADHN COCC1(CNCc2cccc(Cl)c2F)CCN(C(=O)OC(C)(C)C)CC1 ZINC000312697987 855373043 /nfs/dbraw/zinc/37/30/43/855373043.db2.gz BMOQYUHDQYWVNM-UHFFFAOYSA-N 0 3 400.922 4.232 20 0 HIADHN C[C@H](NCCc1nnc2ccccn21)c1ccc(Br)cc1Br ZINC000315902057 855379301 /nfs/dbraw/zinc/37/93/01/855379301.db2.gz QUVMPULYVIABCF-NSHDSACASA-N 0 3 424.140 4.148 20 0 HIADHN O=C(c1cc(C(F)(F)F)ccc1Br)N1CC[C@@H](N2CCCCC2)C1 ZINC000325552263 855404107 /nfs/dbraw/zinc/40/41/07/855404107.db2.gz VJNWECZVYMSENN-CYBMUJFWSA-N 0 3 405.258 4.168 20 0 HIADHN COc1cc(Br)c(CNCCCN2CCc3ccccc32)cc1OC ZINC000326692390 855411992 /nfs/dbraw/zinc/41/19/92/855411992.db2.gz UHWVYUBYICDOKU-UHFFFAOYSA-N 0 3 405.336 4.009 20 0 HIADHN COc1ccc(Br)c(C(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)c1 ZINC000383043506 855435523 /nfs/dbraw/zinc/43/55/23/855435523.db2.gz DJGROFKRPMFQTJ-INIZCTEOSA-N 0 3 417.347 4.194 20 0 HIADHN COc1ccc(C(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)cc1Br ZINC000383053744 855435638 /nfs/dbraw/zinc/43/56/38/855435638.db2.gz MCBLECRASUEUHK-INIZCTEOSA-N 0 3 417.347 4.194 20 0 HIADHN COc1ccc(Br)c(C(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)c1 ZINC000383043508 855435718 /nfs/dbraw/zinc/43/57/18/855435718.db2.gz DJGROFKRPMFQTJ-MRXNPFEDSA-N 0 3 417.347 4.194 20 0 HIADHN Cc1ccc(Br)cc1C(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C ZINC000383060556 855437251 /nfs/dbraw/zinc/43/72/51/855437251.db2.gz SFECPNHPXJNPPU-KRWDZBQOSA-N 0 3 401.348 4.494 20 0 HIADHN C[C@H]1[C@@H](NC(=O)c2cc(Cl)ccc2Br)CCN1Cc1ccccc1 ZINC000383542409 855438250 /nfs/dbraw/zinc/43/82/50/855438250.db2.gz URLDEZQFNWFRKR-UGSOOPFHSA-N 0 3 407.739 4.495 20 0 HIADHN CN(C(=O)c1cccc(Br)c1Cl)[C@H]1CCN(Cc2ccccc2)C1 ZINC000383626971 855438463 /nfs/dbraw/zinc/43/84/63/855438463.db2.gz WKHNGCIZBBQAMJ-HNNXBMFYSA-N 0 3 407.739 4.449 20 0 HIADHN CN(C(=O)c1ccc(F)cc1Br)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000388937845 855448904 /nfs/dbraw/zinc/44/89/04/855448904.db2.gz WUZUUJNCKHKKGF-QGZVFWFLSA-N 0 3 405.311 4.325 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1cc(Cl)ccc1Br ZINC000389831342 855451185 /nfs/dbraw/zinc/45/11/85/855451185.db2.gz ACCYQPRIWMKSQQ-FZKQIMNGSA-N 0 3 407.739 4.353 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1cc(Cl)ccc1Br ZINC000389831345 855451339 /nfs/dbraw/zinc/45/13/39/855451339.db2.gz ACCYQPRIWMKSQQ-SCLBCKFNSA-N 0 3 407.739 4.353 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1ccc2c(c1)nc(C(F)F)n2C)c1ccsc1 ZINC000409456775 855488333 /nfs/dbraw/zinc/48/83/33/855488333.db2.gz HTDNZFUJHIXVKP-KRWDZBQOSA-N 0 3 406.502 4.385 20 0 HIADHN CSc1cccc(F)c1C(=O)NCCCCN1CCN(c2cccc(C)c2)CC1 ZINC000409459711 855489177 /nfs/dbraw/zinc/48/91/77/855489177.db2.gz OJBLDDAKDBLHGO-UHFFFAOYSA-N 0 3 415.578 4.188 20 0 HIADHN CN(Cc1cc(Br)ccc1F)C(=O)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000409470483 855496320 /nfs/dbraw/zinc/49/63/20/855496320.db2.gz KRZLVRANVGDDLT-SFHVURJKSA-N 0 3 420.326 4.004 20 0 HIADHN CCOCCOc1ccc(Br)cc1CN[C@H]1CCCc2[nH]c(=O)ccc21 ZINC000409471481 855497319 /nfs/dbraw/zinc/49/73/19/855497319.db2.gz XOFUPDFMPOHDCX-KRWDZBQOSA-N 0 3 421.335 4.132 20 0 HIADHN Cc1nc2cc(C(=O)N(CCN(C)C)C3CCCC3)ccc2n1Cc1ccsc1 ZINC000409548800 855537259 /nfs/dbraw/zinc/53/72/59/855537259.db2.gz KURPTOKKWWPLTH-UHFFFAOYSA-N 0 3 410.587 4.401 20 0 HIADHN O=C(NCCCCN1CCN(Cc2ccccc2)CC1)Nc1nc2ccccc2s1 ZINC000409589663 855555610 /nfs/dbraw/zinc/55/56/10/855555610.db2.gz VOFHBGWCKZWWMI-UHFFFAOYSA-N 0 3 423.586 4.016 20 0 HIADHN CN(C)[C@@H](CNC(=O)Nc1cc(Cl)ccc1OC[C@@H]1CCCO1)c1ccccc1 ZINC000409654428 855585928 /nfs/dbraw/zinc/58/59/28/855585928.db2.gz WYVKCHYQGUNGOC-ICSRJNTNSA-N 0 3 417.937 4.322 20 0 HIADHN CC(C)n1ncc2c1nc(C1CC1)cc2C(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000409848421 855685413 /nfs/dbraw/zinc/68/54/13/855685413.db2.gz JJVAAFXEABRMGH-FXAWDEMLSA-N 0 3 417.557 4.455 20 0 HIADHN CN1CC[C@H](NC(=O)[C@@H]2CCO[C@H]2c2ccc(Cl)c(F)c2)[C@@H]1c1ccccc1 ZINC000409884533 855705869 /nfs/dbraw/zinc/70/58/69/855705869.db2.gz TXQLQDNZNPWWNO-SEVLPDGMSA-N 0 3 402.897 4.118 20 0 HIADHN C[C@@H](C(=O)N(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1)c1ccc(C(F)(F)F)cc1 ZINC000409957351 855744735 /nfs/dbraw/zinc/74/47/35/855744735.db2.gz FFBQGFYODKLJBM-BPAFIMBUSA-N 0 3 405.464 4.355 20 0 HIADHN CC(C)(C)[C@H](CN1CCc2ccccc2C1)NC(=O)c1cccc(NC(=O)C2CC2)c1 ZINC000410050529 855800185 /nfs/dbraw/zinc/80/01/85/855800185.db2.gz CWPZHJPPOQOLQZ-QHCPKHFHSA-N 0 3 419.569 4.238 20 0 HIADHN CC1CCN([C@H](CNC(=O)N[C@@H]2CCCC23CCOCC3)c2cccs2)CC1 ZINC000410091247 855814679 /nfs/dbraw/zinc/81/46/79/855814679.db2.gz YTDDCQJLHHQWEE-UYAOXDASSA-N 0 3 405.608 4.170 20 0 HIADHN CC1CCN([C@H](CNC(=O)Nc2ccc(Cl)c(C(N)=O)c2)c2cccs2)CC1 ZINC000410339897 855937555 /nfs/dbraw/zinc/93/75/55/855937555.db2.gz LUCKCPXTPMQUIW-QGZVFWFLSA-N 0 3 420.966 4.095 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@H]2CCCC[C@@H]2NCCc2nc3c(cccc3C)o2)cc1 ZINC000410358028 855947591 /nfs/dbraw/zinc/94/75/91/855947591.db2.gz HIKXBKFWEBSWJC-FPOVZHCZSA-N 0 3 412.555 4.362 20 0 HIADHN COc1cc(CN[C@@H](Cc2cccnc2)c2cccc(Cl)c2)ccc1OCCO ZINC000425921782 856000865 /nfs/dbraw/zinc/00/08/65/856000865.db2.gz JDSQUMHFYDARDG-NRFANRHFSA-N 0 3 412.917 4.188 20 0 HIADHN COc1ccc(NC(=O)[C@H](C(C)C)N(C)C)cc1OCc1ccc2ccccc2n1 ZINC000425937514 856008909 /nfs/dbraw/zinc/00/89/09/856008909.db2.gz MXDGJIUGPVUVNR-QHCPKHFHSA-N 0 3 407.514 4.347 20 0 HIADHN CN1CC[C@H](NC(=O)NCc2nc(-c3ccccc3F)cs2)[C@H]1c1ccccc1 ZINC000425985541 856031124 /nfs/dbraw/zinc/03/11/24/856031124.db2.gz RINOLBAECMUTRC-GHTZIAJQSA-N 0 3 410.518 4.194 20 0 HIADHN C[C@@H](CCCC(F)(F)F)NC(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000426093471 856103594 /nfs/dbraw/zinc/10/35/94/856103594.db2.gz XCDMBTRVFPKGTP-YESZJQIVSA-N 0 3 407.521 4.028 20 0 HIADHN COc1ccc(NC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)c2cccnc12 ZINC000426108871 856112793 /nfs/dbraw/zinc/11/27/93/856112793.db2.gz JTYGFSJLCWOBAM-GOSISDBHSA-N 0 3 404.514 4.372 20 0 HIADHN CCCN(CCN1CCN(CC)CC1)C(=O)c1ccccc1OCc1ccccc1C ZINC000426150335 856141516 /nfs/dbraw/zinc/14/15/16/856141516.db2.gz QZWQCINWNJEPHK-UHFFFAOYSA-N 0 3 423.601 4.064 20 0 HIADHN CC(C)Sc1ccccc1NC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1CO ZINC000426153783 856142553 /nfs/dbraw/zinc/14/25/53/856142553.db2.gz ONWBOCCOELXJAB-UXHICEINSA-N 0 3 413.587 4.192 20 0 HIADHN CC(C)c1nn(C)cc1-c1noc([C@H]2CN(Cc3ccccc3)CCC2(F)F)n1 ZINC000426190503 856165866 /nfs/dbraw/zinc/16/58/66/856165866.db2.gz GBWZOXAOGYQOMG-QGZVFWFLSA-N 0 3 401.461 4.218 20 0 HIADHN Cc1ncc([C@H](C)N[C@@H](Cc2ccc(F)cc2)[C@H]2COc3ccccc3O2)c(C)n1 ZINC000426313704 856239763 /nfs/dbraw/zinc/23/97/63/856239763.db2.gz NSLAAWICTYJVKQ-LYAKXMMSSA-N 0 3 407.489 4.334 20 0 HIADHN COc1ccccc1[C@@H](NC(=O)NC[C@H](C)N(C)Cc1ccccc1)c1ccco1 ZINC000426351078 856256350 /nfs/dbraw/zinc/25/63/50/856256350.db2.gz HLEVBDIUYCRFOX-FDDCHVKYSA-N 0 3 407.514 4.197 20 0 HIADHN COc1ccc(CNC(=O)C2CCN(Cc3ccc4nc(C)sc4c3)CC2)cc1 ZINC000426403732 856276446 /nfs/dbraw/zinc/27/64/46/856276446.db2.gz WZDWJDZPIXWCMB-UHFFFAOYSA-N 0 3 409.555 4.142 20 0 HIADHN CC(C)(C)N1C[C@@H](c2nc(-c3cc(=O)[nH]c4ccccc43)no2)[C@H](C(F)(F)F)C1 ZINC000426577658 856357297 /nfs/dbraw/zinc/35/72/97/856357297.db2.gz PSUGGMLOMIWBFR-ZIAGYGMSSA-N 0 3 406.408 4.367 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)Nc3nc(C(C)(C)C)cs3)CC2)C[C@H](C)O1 ZINC000426633165 856384293 /nfs/dbraw/zinc/38/42/93/856384293.db2.gz CHVLOKKNUDXSPD-HOTGVXAUSA-N 0 3 408.612 4.184 20 0 HIADHN Cc1ccc(F)c(C(=O)Nc2cccc(CN3CCC(O)CC3)c2)c1Br ZINC000426669451 856404998 /nfs/dbraw/zinc/40/49/98/856404998.db2.gz MHNCJFWYRGBIEE-UHFFFAOYSA-N 0 3 421.310 4.106 20 0 HIADHN COCCOc1ccc(C(F)(F)F)cc1NC(=O)[C@H](C)N1C[C@H]2CCCC[C@@H]2C1 ZINC000426769038 856467633 /nfs/dbraw/zinc/46/76/33/856467633.db2.gz FKTBRIYPGHCXSE-ARFHVFGLSA-N 0 3 414.468 4.180 20 0 HIADHN CN(C)C(=O)c1cccc(NC(=O)CN(Cc2ccccc2)[C@H]2CCCC2(C)C)c1 ZINC000426815225 856494399 /nfs/dbraw/zinc/49/43/99/856494399.db2.gz DLMMXLAWYBBDNR-QFIPXVFZSA-N 0 3 407.558 4.408 20 0 HIADHN COc1ccccc1NC(=O)c1ccc(NC(=O)[C@@H](C)N2C[C@@H]3CCCC[C@@H]3C2)cc1 ZINC000426817972 856495230 /nfs/dbraw/zinc/49/52/30/856495230.db2.gz QNMHAVWEBXFURR-RLLQIKCJSA-N 0 3 421.541 4.397 20 0 HIADHN C[C@@H](NC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1)c1nc(C(F)(F)F)cs1 ZINC000426901927 856534223 /nfs/dbraw/zinc/53/42/23/856534223.db2.gz YTDOLOPRFGLEAA-HIFRSBDPSA-N 0 3 412.481 4.139 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)N[C@H]2CCC[C@H]2OCc2ccccc2)CC1 ZINC000426963210 856566064 /nfs/dbraw/zinc/56/60/64/856566064.db2.gz GTADRSODFBZHIZ-XZOQPEGZSA-N 0 3 411.546 4.023 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NC1CCC2(CCOCC2)CC1)c1cccc(OC)c1 ZINC000437461162 862824594 /nfs/dbraw/zinc/82/45/94/862824594.db2.gz SZIMNPXWKLTCRI-QFIPXVFZSA-N 0 3 417.594 4.117 20 0 HIADHN O=C(N[C@@H]1CCOC2(CCCC2)C1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000427274744 856746952 /nfs/dbraw/zinc/74/69/52/856746952.db2.gz NEQHSBICXBGLPJ-WIYYLYMNSA-N 0 3 410.480 4.049 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)C3(c4ccc(Cl)cc4)CC3)CC2)C[C@H](C)O1 ZINC000427290311 856754037 /nfs/dbraw/zinc/75/40/37/856754037.db2.gz AITYUKNCYYYJNU-HDICACEKSA-N 0 3 404.982 4.110 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3csc(-c4ccccc4)n3)CC2)C[C@H](C)O1 ZINC000427292261 856754949 /nfs/dbraw/zinc/75/49/49/856754949.db2.gz OQQYCYJPYAZTLP-HDICACEKSA-N 0 3 413.587 4.162 20 0 HIADHN CC(C)c1cc(C(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)nn1C(C)(C)C ZINC000427291888 856755010 /nfs/dbraw/zinc/75/50/10/856755010.db2.gz KYKZZMLUNPBLTM-RTBURBONSA-N 0 3 418.626 4.113 20 0 HIADHN Cc1ccc(C(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)cc1Br ZINC000427298929 856758946 /nfs/dbraw/zinc/75/89/46/856758946.db2.gz HYVRLTBBQUZNPZ-CALCHBBNSA-N 0 3 423.395 4.109 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)[C@@H]3C[C@H]3c3cccc(Cl)c3)CC2)C[C@H](C)O1 ZINC000427318573 856768566 /nfs/dbraw/zinc/76/85/66/856768566.db2.gz ADAKEULEMHUHJY-DEVSCXNHSA-N 0 3 404.982 4.181 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)CCCOc3ccccc3Cl)CC2)C[C@H](C)O1 ZINC000427331244 856774919 /nfs/dbraw/zinc/77/49/19/856774919.db2.gz OXZLWYGLYUOPLR-OALUTQOASA-N 0 3 422.997 4.237 20 0 HIADHN CC(C)[C@H](Cc1ccccc1)C(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000427342097 856781823 /nfs/dbraw/zinc/78/18/23/856781823.db2.gz LBHWCFPJGQAEJL-LGVFNWMJSA-N 0 3 400.607 4.239 20 0 HIADHN Cc1nc(C2CCCC2)sc1C(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000427362042 856793647 /nfs/dbraw/zinc/79/36/47/856793647.db2.gz IDSDSKGROZJZLS-CALCHBBNSA-N 0 3 419.635 4.461 20 0 HIADHN Cc1ccccc1[C@@H]([C@@H](C)NC(=O)C(=O)Nc1ccc(-c2ccco2)cc1F)N(C)C ZINC000427373652 856799882 /nfs/dbraw/zinc/79/98/82/856799882.db2.gz BOZCIQZVSSFHNU-OPAMFIHVSA-N 0 3 423.488 4.140 20 0 HIADHN Cc1ccc(F)c(C(=O)N(C)C[C@@H]2CCN(C)[C@H]2c2cccnc2)c1Br ZINC000427504979 856843625 /nfs/dbraw/zinc/84/36/25/856843625.db2.gz LYAGEMLRPNXUMG-KXBFYZLASA-N 0 3 420.326 4.057 20 0 HIADHN Cc1cc2c(cc1C)[C@@H](N[C@@H](C)c1ccc(S(=O)(=O)N(C)C)cc1)CCS2 ZINC000427602905 856885024 /nfs/dbraw/zinc/88/50/24/856885024.db2.gz SCNHEWIKDUNOHO-JXFKEZNVSA-N 0 3 404.601 4.441 20 0 HIADHN CCc1noc(-c2ccc(CCN[C@@H](C)c3ncc(Br)cc3F)cc2)n1 ZINC000427710838 856918327 /nfs/dbraw/zinc/91/83/27/856918327.db2.gz QMMWVCPJFNSUCI-LBPRGKRZSA-N 0 3 419.298 4.489 20 0 HIADHN Cc1cc2c(cc1C)[C@H](NCc1ccc(N3CCCS3(=O)=O)cc1)CCS2 ZINC000427885764 856993679 /nfs/dbraw/zinc/99/36/79/856993679.db2.gz KDXIWBBFBIDRKN-HXUWFJFHSA-N 0 3 402.585 4.170 20 0 HIADHN Cc1cc2c(cc1C)[C@@H](NCc1ccc(N3CCCS3(=O)=O)cc1)CCS2 ZINC000427885763 856993765 /nfs/dbraw/zinc/99/37/65/856993765.db2.gz KDXIWBBFBIDRKN-FQEVSTJZSA-N 0 3 402.585 4.170 20 0 HIADHN Fc1cc(Br)ccc1[C@H](N[C@H]1CCn2ccnc2C1)c1ccccc1 ZINC000427886085 856993853 /nfs/dbraw/zinc/99/38/53/856993853.db2.gz YIDWFDIEDMSTPC-OXJNMPFZSA-N 0 3 400.295 4.479 20 0 HIADHN Cc1nc2ccc(Br)cc2c(NCCCc2nnc3n2CCCC3)c1C ZINC000428164483 857093151 /nfs/dbraw/zinc/09/31/51/857093151.db2.gz ZYUPDXZPEULNDA-UHFFFAOYSA-N 0 3 414.351 4.009 20 0 HIADHN CO[C@@H](C)c1nc(CN2CCCN(CCCOc3cc(C)ccc3C)CC2)cs1 ZINC000437539001 862873857 /nfs/dbraw/zinc/87/38/57/862873857.db2.gz QUXHLBXCEVOLTG-FQEVSTJZSA-N 0 3 417.619 4.444 20 0 HIADHN COc1ccc(NC(=O)C2(NCC3=Cc4ccccc4OC3)CCCC2)cc1OC ZINC000428405822 857193398 /nfs/dbraw/zinc/19/33/98/857193398.db2.gz FFIOTSQQAZMIFC-UHFFFAOYSA-N 0 3 408.498 4.021 20 0 HIADHN Cc1ccc(OC(F)F)c(CN(C)[C@@H](C)c2ccc(N3CCCS3(=O)=O)cc2)c1 ZINC000428426536 857200539 /nfs/dbraw/zinc/20/05/39/857200539.db2.gz NEAUMQFJCUCMMQ-INIZCTEOSA-N 0 3 424.513 4.329 20 0 HIADHN Brc1ccc(-c2ncc(CN3CCC(Cn4cncn4)CC3)s2)cc1 ZINC000428476631 857216690 /nfs/dbraw/zinc/21/66/90/857216690.db2.gz CSHKNHRWUMWUOS-UHFFFAOYSA-N 0 3 418.364 4.076 20 0 HIADHN Cc1nc(-c2ccc(C)cc2)c(CC(=O)Nc2cccc(CN3CC[C@H](O)C3)c2)s1 ZINC000428531475 857246071 /nfs/dbraw/zinc/24/60/71/857246071.db2.gz KRBFBCDUWIPULK-NRFANRHFSA-N 0 3 421.566 4.175 20 0 HIADHN CC(C)Cn1ncc(C(=O)Nc2cccc(CN3CC[C@H](O)C3)c2)c1-c1ccccc1 ZINC000428539855 857250482 /nfs/dbraw/zinc/25/04/82/857250482.db2.gz QQEZWCAJIFMSHS-QFIPXVFZSA-N 0 3 418.541 4.025 20 0 HIADHN O=C(CCOc1ccccc1-c1ccccc1)Nc1cccc(CN2CC[C@H](O)C2)c1 ZINC000428538243 857251555 /nfs/dbraw/zinc/25/15/55/857251555.db2.gz WXXTUMJDLNOJSZ-QHCPKHFHSA-N 0 3 416.521 4.328 20 0 HIADHN Cc1cc(Br)cc(Cl)c1C(=O)Nc1cccc(CN2CC[C@@H](O)C2)c1 ZINC000428551702 857260171 /nfs/dbraw/zinc/26/01/71/857260171.db2.gz UFGNSTJZODGFPK-MRXNPFEDSA-N 0 3 423.738 4.230 20 0 HIADHN Cc1cc(Br)cc(Cl)c1C(=O)Nc1cccc(CN2CC[C@H](O)C2)c1 ZINC000428551699 857260359 /nfs/dbraw/zinc/26/03/59/857260359.db2.gz UFGNSTJZODGFPK-INIZCTEOSA-N 0 3 423.738 4.230 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@@H](O)C2)c1)c1cccc(COc2cccc(F)c2)c1 ZINC000428550532 857260585 /nfs/dbraw/zinc/26/05/85/857260585.db2.gz VSOWVGVYYXFINS-HSZRJFAPSA-N 0 3 420.484 4.224 20 0 HIADHN Cn1c(CNC[C@]2(Cc3ccc(F)cc3)CCC[C@H]2O)nc2cc(Cl)ccc21 ZINC000428573951 857269268 /nfs/dbraw/zinc/26/92/68/857269268.db2.gz QJIQXNXUTQWFFF-IFMALSPDSA-N 0 3 401.913 4.229 20 0 HIADHN CC(C)(C)[C@H](CN1CCc2ccccc2C1)NC(=O)N1CCC(c2ccncc2)CC1 ZINC000428586154 857272692 /nfs/dbraw/zinc/27/26/92/857272692.db2.gz FNHSABOXZDYHCJ-DEOSSOPVSA-N 0 3 420.601 4.444 20 0 HIADHN Cc1ccc(-c2ccc(C(=O)N(C)C[C@]3(O)CCN(Cc4ccccc4)C3)s2)o1 ZINC000428693773 857299447 /nfs/dbraw/zinc/29/94/47/857299447.db2.gz MOPCAFRJKDEWNI-HSZRJFAPSA-N 0 3 410.539 4.026 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCC(c2ccncc2)CC1)c1cccc(OC)c1 ZINC000428693662 857299595 /nfs/dbraw/zinc/29/95/95/857299595.db2.gz QXRVTCVUNVLJHH-HSZRJFAPSA-N 0 3 410.562 4.062 20 0 HIADHN O=C(Nc1cc(Cl)ccc1O)C1CCN(Cc2c[nH]nc2-c2ccsc2)CC1 ZINC000437576896 862895391 /nfs/dbraw/zinc/89/53/91/862895391.db2.gz HAEGOLPDELMEIP-UHFFFAOYSA-N 0 3 416.934 4.348 20 0 HIADHN O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)Nc1ccc(C(F)(F)F)cc1 ZINC000428700023 857301354 /nfs/dbraw/zinc/30/13/54/857301354.db2.gz MGPNVKGDMSNMIY-LJQANCHMSA-N 0 3 407.436 4.118 20 0 HIADHN O=S1(=O)CCC2(CCN(CC/C=C/c3ccc(Br)cc3)CC2)CC1 ZINC000428700179 857301548 /nfs/dbraw/zinc/30/15/48/857301548.db2.gz KTKLNOMLQVDGJT-HNQUOIGGSA-N 0 3 412.393 4.143 20 0 HIADHN O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)Nc1ccccc1C(F)(F)F ZINC000428701856 857302211 /nfs/dbraw/zinc/30/22/11/857302211.db2.gz QEUZKEPTGVGYOX-QGZVFWFLSA-N 0 3 407.436 4.118 20 0 HIADHN Cc1cccc(NC(=O)CN2CCN([C@@H]3CC[C@](C)(c4ccccc4)C3)CC2)c1C ZINC000437580063 862896942 /nfs/dbraw/zinc/89/69/42/862896942.db2.gz OXEIAXWZHBYNAD-BVAGGSTKSA-N 0 3 405.586 4.370 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)Nc2cccc(COC(C)(C)CC)c2C)CC1 ZINC000428768917 857327454 /nfs/dbraw/zinc/32/74/54/857327454.db2.gz BKTFVGVQBBVKHI-IBGZPJMESA-N 0 3 418.626 4.095 20 0 HIADHN CCCc1noc(CN(Cc2ccncc2)[C@@H]2CCCN(Cc3ccccc3)C2)n1 ZINC000428797324 857346680 /nfs/dbraw/zinc/34/66/80/857346680.db2.gz BZOWPTHVCFQHKQ-JOCHJYFZSA-N 0 3 405.546 4.084 20 0 HIADHN C[C@H](CC(=O)Nc1cccc(CN2CC[C@@H](O)C2)c1)c1ccc(Br)cc1 ZINC000428821711 857360123 /nfs/dbraw/zinc/36/01/23/857360123.db2.gz LWWJAABXQVKJTA-FOIQADDNSA-N 0 3 417.347 4.148 20 0 HIADHN Cc1cccc(C)c1NC(=O)CN1CCN([C@H]2CC[C@](C)(c3ccccc3)C2)CC1 ZINC000437590497 862902664 /nfs/dbraw/zinc/90/26/64/862902664.db2.gz MMKOIYOKNSZCRL-OZXSUGGESA-N 0 3 405.586 4.370 20 0 HIADHN Fc1ccc2nc(CNC[C@H](c3ccccc3Cl)N3CCOCC3)sc2c1 ZINC000428853415 857372735 /nfs/dbraw/zinc/37/27/35/857372735.db2.gz ZOLZKMMLMXOFPW-GOSISDBHSA-N 0 3 405.926 4.252 20 0 HIADHN CC(C)N(CC(=O)NCc1ccc(C(=O)N2CCCC2)cc1)[C@@H](C)c1ccccc1 ZINC000428864993 857377645 /nfs/dbraw/zinc/37/76/45/857377645.db2.gz FLMTYLPXNOWZPH-FQEVSTJZSA-N 0 3 407.558 4.010 20 0 HIADHN Cc1c(C(=O)N(C)C[C@@]2(O)CCN(Cc3ccccc3)C2)oc2c1c(C)ccc2C ZINC000428974255 857441671 /nfs/dbraw/zinc/44/16/71/857441671.db2.gz ZBLWVKJHIACUPT-VWLOTQADSA-N 0 3 406.526 4.067 20 0 HIADHN C[C@H](c1ccccc1Cl)N(C)C(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000429007421 857454741 /nfs/dbraw/zinc/45/47/41/857454741.db2.gz KAWUTAWXDWHBFE-QUCCMNQESA-N 0 3 415.965 4.334 20 0 HIADHN C/C(=C\c1ccccc1)CN(C)C(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000429019244 857459106 /nfs/dbraw/zinc/45/91/06/857459106.db2.gz IQEXJTXBJQZRLE-MWKGPOOMSA-N 0 3 407.558 4.022 20 0 HIADHN Cc1cc(N2CCCC2)ccc1NC(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000429037850 857468601 /nfs/dbraw/zinc/46/86/01/857468601.db2.gz ZGYZCZFOZMLZKD-HSZRJFAPSA-N 0 3 422.573 4.008 20 0 HIADHN CCO[C@@H]1C[C@@H](O)C12CCN(Cc1cccc3c(Br)cccc13)CC2 ZINC000429046851 857474727 /nfs/dbraw/zinc/47/47/27/857474727.db2.gz JIPUSBSPBLWBRS-WOJBJXKFSA-N 0 3 404.348 4.354 20 0 HIADHN Cc1ccc2cccc(NC(=O)N3CCC(CCN4C[C@H](C)O[C@@H](C)C4)CC3)c2n1 ZINC000429077191 857497078 /nfs/dbraw/zinc/49/70/78/857497078.db2.gz USOLLVYWHPXPDU-OALUTQOASA-N 0 3 410.562 4.286 20 0 HIADHN O=C(NCc1ccc(COCc2ccccc2)cc1)NC[C@@H]1CCCCN1C1CC1 ZINC000429104192 857511027 /nfs/dbraw/zinc/51/10/27/857511027.db2.gz PVJSLVHIDDHZBS-DEOSSOPVSA-N 0 3 407.558 4.220 20 0 HIADHN C[C@@H](NC(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1)c1ccccc1Cl ZINC000429192485 857547964 /nfs/dbraw/zinc/54/79/64/857547964.db2.gz HNYUEXVBMWWVOF-KZNAEPCWSA-N 0 3 407.986 4.322 20 0 HIADHN FC(F)(F)c1cc(Br)ccc1N1CCN(CC[C@@H]2CCOC2)CC1 ZINC000437615549 862931214 /nfs/dbraw/zinc/93/12/14/862931214.db2.gz PPVLIKDKFIBNAU-CYBMUJFWSA-N 0 3 407.274 4.017 20 0 HIADHN C[C@@H](NC(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1)c1cccc(Cl)c1 ZINC000429201304 857550745 /nfs/dbraw/zinc/55/07/45/857550745.db2.gz RVMSOGUCFUNEJY-FGTMMUONSA-N 0 3 407.986 4.322 20 0 HIADHN CCCn1ccnc1CCCN(C)[C@@H](C)C(=O)Nc1cc(C)c(Cl)cc1OC ZINC000429255042 857576487 /nfs/dbraw/zinc/57/64/87/857576487.db2.gz SBHMQEVOJUFDLH-INIZCTEOSA-N 0 3 406.958 4.155 20 0 HIADHN C[C@H]1CN(c2cccc(F)c2)CCN1CCC(=O)Nc1ccccc1Br ZINC000429255403 857577896 /nfs/dbraw/zinc/57/78/96/857577896.db2.gz PRNARRSGQIHPHS-HNNXBMFYSA-N 0 3 420.326 4.128 20 0 HIADHN CSC[C@H]1CCCN(CC(=O)N(C)[C@@H](c2ccccc2)c2ccc(F)cc2)C1 ZINC000429275252 857586396 /nfs/dbraw/zinc/58/63/96/857586396.db2.gz KQMZSSRIILZVBZ-MBSDFSHPSA-N 0 3 400.563 4.449 20 0 HIADHN Cc1nn(C)c(C)c1NC(=O)[C@H](C)N[C@@H]1c2cc(Br)ccc2CC1(C)C ZINC000429296939 857594527 /nfs/dbraw/zinc/59/45/27/857594527.db2.gz TVWHAKPWALLDNM-KPZWWZAWSA-N 0 3 419.367 4.040 20 0 HIADHN O=C(CN[C@H]1Cc2cccc(O)c2C1)N[C@H](c1ccccc1)c1ccc(Cl)cc1 ZINC000429302257 857596589 /nfs/dbraw/zinc/59/65/89/857596589.db2.gz RNMJSBQHAXGPJH-GBXCKJPGSA-N 0 3 406.913 4.008 20 0 HIADHN COC1(C[C@@H](C)N[C@H](c2cccc(S(C)(=O)=O)c2)c2ccc(F)c(F)c2)CCC1 ZINC000429417154 857655389 /nfs/dbraw/zinc/65/53/89/857655389.db2.gz KJQZPSCNCJMRSG-QVKFZJNVSA-N 0 3 423.525 4.395 20 0 HIADHN C[C@@H](NC(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1)[C@H](C)c1ccccc1 ZINC000429440549 857669719 /nfs/dbraw/zinc/66/97/19/857669719.db2.gz HXYIRGABACQGBI-MXEMCNAFSA-N 0 3 401.595 4.100 20 0 HIADHN C[C@@H](NC(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1)[C@@H](C)c1ccccc1 ZINC000429440555 857670140 /nfs/dbraw/zinc/67/01/40/857670140.db2.gz HXYIRGABACQGBI-XRXFAXGQSA-N 0 3 401.595 4.100 20 0 HIADHN CN(C(=O)NC[C@H](c1ccccc1)C(C)(C)CO)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000437621052 862938353 /nfs/dbraw/zinc/93/83/53/862938353.db2.gz CLRYFJPCJFXKKE-DNQXCXABSA-N 0 3 423.601 4.095 20 0 HIADHN Cc1noc(C[C@@H](NCCOc2ccc(OC(F)(F)F)cc2)c2ccccc2)n1 ZINC000429528178 857720550 /nfs/dbraw/zinc/72/05/50/857720550.db2.gz JAMFGCSWJDTDDX-GOSISDBHSA-N 0 3 407.392 4.229 20 0 HIADHN Cc1noc(C[C@H](NCCOc2ccccc2Br)c2ccccc2)n1 ZINC000429534933 857727929 /nfs/dbraw/zinc/72/79/29/857727929.db2.gz AILAFJFUERFMOO-KRWDZBQOSA-N 0 3 402.292 4.093 20 0 HIADHN CCN(C(=O)Nc1cccc(N2CCN(CC)CC2)c1)[C@H](C)Cc1ccsc1 ZINC000429564482 857752118 /nfs/dbraw/zinc/75/21/18/857752118.db2.gz FNDNEAMSMBSKFW-GOSISDBHSA-N 0 3 400.592 4.375 20 0 HIADHN C[C@H]1CC[C@@H](N(C)CC(=O)N(Cc2nnc(-c3ccccc3Cl)o2)C2CC2)C1 ZINC000429570263 857756692 /nfs/dbraw/zinc/75/66/92/857756692.db2.gz UPEJVSAKBUEWGQ-GOEBONIOSA-N 0 3 402.926 4.001 20 0 HIADHN C[C@H](C1CC1)n1cc(NC(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)cn1 ZINC000429628331 857806350 /nfs/dbraw/zinc/80/63/50/857806350.db2.gz KIACMUIZUSJUAO-OAHLLOKOSA-N 0 3 423.483 4.469 20 0 HIADHN C[C@@H](C1CC1)n1cc(NC(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)cn1 ZINC000429628329 857806513 /nfs/dbraw/zinc/80/65/13/857806513.db2.gz KIACMUIZUSJUAO-HNNXBMFYSA-N 0 3 423.483 4.469 20 0 HIADHN CCn1c2ccccc2nc1[C@H]1CCCN1C[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000429678000 857831706 /nfs/dbraw/zinc/83/17/06/857831706.db2.gz MHUPCYWUXAJRRH-WIOPSUGQSA-N 0 3 418.585 4.484 20 0 HIADHN c1cc2n(c1)CCN(C[C@@H]1CN(Cc3ccccc3)CCCO1)[C@H]2c1ccccc1 ZINC000429684448 857833534 /nfs/dbraw/zinc/83/35/34/857833534.db2.gz MQHFAYPFRKDIPP-AHWVRZQESA-N 0 3 401.554 4.184 20 0 HIADHN FC(F)(F)C1(C(F)(F)F)CCN(C[C@H]2CN(Cc3ccccc3)CCCO2)C1 ZINC000429692842 857837029 /nfs/dbraw/zinc/83/70/29/857837029.db2.gz WSOAMGUXYFZINM-MRXNPFEDSA-N 0 3 410.402 4.094 20 0 HIADHN COc1cccc(-c2nc(CN[C@@H]3[C@@H]4CCO[C@H]4C34CCCC4)cs2)c1OC ZINC000429711575 857845873 /nfs/dbraw/zinc/84/58/73/857845873.db2.gz FSIONRNNINZEPC-PWIZWCRZSA-N 0 3 400.544 4.265 20 0 HIADHN CSCCc1ccc(NC(=O)NC[C@H]2CN(Cc3ccccc3)CCCO2)cc1 ZINC000429741751 857864040 /nfs/dbraw/zinc/86/40/40/857864040.db2.gz FQFNSQOFCDHEIL-QFIPXVFZSA-N 0 3 413.587 4.005 20 0 HIADHN Cc1coc(-c2cccc(NC(=O)NC[C@H]3CN(Cc4ccccc4)CCCO3)c2)n1 ZINC000429744784 857865996 /nfs/dbraw/zinc/86/59/96/857865996.db2.gz BOMMXUKXIOCIMK-QFIPXVFZSA-N 0 3 420.513 4.063 20 0 HIADHN Cc1cc(NC(=O)NC[C@@H]2CN(Cc3ccccc3)CCCO2)ccc1OC(C)C ZINC000429750765 857870331 /nfs/dbraw/zinc/87/03/31/857870331.db2.gz VTYDYNYSDHCOAM-JOCHJYFZSA-N 0 3 411.546 4.195 20 0 HIADHN O=C(NC[C@H]1CN(Cc2ccccc2)CCCO1)Nc1cccc(CC(F)(F)F)c1 ZINC000429771102 857879732 /nfs/dbraw/zinc/87/97/32/857879732.db2.gz HNARVCHOVGHUJX-FQEVSTJZSA-N 0 3 421.463 4.204 20 0 HIADHN CC(C)N1CC[C@@H](N[C@@H](C)C(=O)NCc2cccs2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000429777633 857881451 /nfs/dbraw/zinc/88/14/51/857881451.db2.gz WGIMKSWCYSQKRD-KPOBHBOGSA-N 0 3 423.985 4.359 20 0 HIADHN O=C(NC[C@H]1CN(Cc2ccccc2)CCCO1)Nc1ccccc1CC(F)(F)F ZINC000429776349 857882088 /nfs/dbraw/zinc/88/20/88/857882088.db2.gz RICFGHXBRUHWCW-IBGZPJMESA-N 0 3 421.463 4.204 20 0 HIADHN CC(C)N1CC[C@H](NCC(=O)Nc2ccccc2F)[C@H]1c1ccc(Cl)c(F)c1 ZINC000429793780 857887401 /nfs/dbraw/zinc/88/74/01/857887401.db2.gz WHCWBGCWKVRUKV-PZJWPPBQSA-N 0 3 407.892 4.370 20 0 HIADHN CC(C)C(=O)Nc1ccc(NC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)cc1 ZINC000437644274 862973055 /nfs/dbraw/zinc/97/30/55/862973055.db2.gz DYTYSQOXBIXMKX-LJQANCHMSA-N 0 3 408.546 4.409 20 0 HIADHN Cc1cnccc1CNC(=O)N(CCN(C)Cc1ccccc1)Cc1ccccc1 ZINC000430071296 858020620 /nfs/dbraw/zinc/02/06/20/858020620.db2.gz NAMBKNMBWZHHID-UHFFFAOYSA-N 0 3 402.542 4.234 20 0 HIADHN COc1cc(CN2CC[C@H](O)C[C@@H]2C)ccc1OCCOc1ccccc1Cl ZINC000430126463 858042958 /nfs/dbraw/zinc/04/29/58/858042958.db2.gz VNDNHMRCAIUVDJ-WMZOPIPTSA-N 0 3 405.922 4.152 20 0 HIADHN COC(=O)[C@@H]1CN(Cc2cnc(-c3ccco3)s2)C[C@H]1c1ccc(Cl)cc1 ZINC000430125221 858043286 /nfs/dbraw/zinc/04/32/86/858043286.db2.gz MBQSXKVNMJCQEG-DLBZAZTESA-N 0 3 402.903 4.445 20 0 HIADHN CCOC(=O)Cn1nc(C)c(CN2CC[C@H](Sc3cccc(Cl)c3)C2)c1C ZINC000430194564 858076957 /nfs/dbraw/zinc/07/69/57/858076957.db2.gz JVZMSTVVZBHSDN-SFHVURJKSA-N 0 3 407.967 4.083 20 0 HIADHN CNC(=O)[C@@]1(C)CCN([C@H](C)c2nc3cc(Cl)ccc3n2Cc2ccccc2)C1 ZINC000430251037 858096520 /nfs/dbraw/zinc/09/65/20/858096520.db2.gz BVUWZIDSNAPBPR-MWTRTKDXSA-N 0 3 410.949 4.257 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)N1CC[C@H](OCCCc2ccccc2)C1 ZINC000430456799 858174576 /nfs/dbraw/zinc/17/45/76/858174576.db2.gz KGWDDSARIRXANQ-FQEVSTJZSA-N 0 3 406.526 4.358 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N[C@H]2C[C@@H]2c2ccccc2OC(F)F)N(C)C)cc1 ZINC000437655518 862993337 /nfs/dbraw/zinc/99/33/37/862993337.db2.gz NVRHSIKEDPWPIZ-CEXWTWQISA-N 0 3 403.473 4.054 20 0 HIADHN Cc1ccc([C@@H](N[C@@H](C)c2ccc(Br)c(S(N)(=O)=O)c2)C2CC2)cc1 ZINC000430701446 858273184 /nfs/dbraw/zinc/27/31/84/858273184.db2.gz VVBWBLHUWBYVPR-ORAYPTAESA-N 0 3 423.376 4.207 20 0 HIADHN COC1CCN(C(C)(C)CNC(=O)C2(Sc3ccc(C)cc3)CCCC2)CC1 ZINC000430704498 858273960 /nfs/dbraw/zinc/27/39/60/858273960.db2.gz XYESNBGLNJVKJT-UHFFFAOYSA-N 0 3 404.620 4.406 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](NC[C@H]2CCC(F)(F)C2)c2ccc(F)c(F)c2)c1 ZINC000430739837 858282667 /nfs/dbraw/zinc/28/26/67/858282667.db2.gz FLGLLIPBAPTGES-DJJJIMSYSA-N 0 3 415.452 4.483 20 0 HIADHN CN(C(=O)[C@@H]1CCN(Cc2ccc(OCC(F)(F)F)c(F)c2)C1)c1ccccc1 ZINC000430881003 858352454 /nfs/dbraw/zinc/35/24/54/858352454.db2.gz XFJXRFDEUKRQGG-MRXNPFEDSA-N 0 3 410.411 4.252 20 0 HIADHN C[C@H](NC(=O)N1CCC[C@H]1c1ccc(Br)c(F)c1)C1=CCN(C)CC1 ZINC000430892270 858357623 /nfs/dbraw/zinc/35/76/23/858357623.db2.gz CLTBPBUDDFCSDU-UGSOOPFHSA-N 0 3 410.331 4.085 20 0 HIADHN COc1ccc([C@H](CNC(=O)Cc2c[nH]c3cccc(Cl)c23)N2CCCC2)cc1 ZINC000430900899 858360901 /nfs/dbraw/zinc/36/09/01/858360901.db2.gz RLAMJEBUDILGHG-NRFANRHFSA-N 0 3 411.933 4.326 20 0 HIADHN CCN(C(=O)NCc1c(F)cc(F)c(F)c1F)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000430955262 858381051 /nfs/dbraw/zinc/38/10/51/858381051.db2.gz HWAHUNOGNTUWSV-OAHLLOKOSA-N 0 3 409.427 4.049 20 0 HIADHN O=C1N[C@@H](c2ccc(Cl)cc2Cl)C(=O)N1C[C@@H](c1cccs1)N1CCCC1 ZINC000430976220 858388974 /nfs/dbraw/zinc/38/89/74/858388974.db2.gz RDHMOKVTIMWXJC-RDJZCZTQSA-N 0 3 424.353 4.485 20 0 HIADHN CC[C@@H](c1ccccc1)N1CC(=O)N(C[C@@H](c2ccc(OC)cc2)N2CCCC2)C1=O ZINC000430980820 858389949 /nfs/dbraw/zinc/38/99/49/858389949.db2.gz UOSRAFIIFKXNLZ-GOTSBHOMSA-N 0 3 421.541 4.248 20 0 HIADHN CN(Cc1cccnc1)C[C@@H]1CCN(C(=O)N[C@@H]2CC[C@@H](c3ccccc3F)C2)C1 ZINC000431056775 858424058 /nfs/dbraw/zinc/42/40/58/858424058.db2.gz LQXWYEGWVXNIHW-PWRODBHTSA-N 0 3 410.537 4.020 20 0 HIADHN CN(C(=O)Nc1ccc2nc(C3CC3)oc2c1)C1CCN(CCc2ccccn2)CC1 ZINC000431103406 858447680 /nfs/dbraw/zinc/44/76/80/858447680.db2.gz XGDSKXCLQIQTEH-UHFFFAOYSA-N 0 3 419.529 4.271 20 0 HIADHN Cc1ccc([C@H](OC[C@@H](O)CN2CC[C@H](Oc3ccncc3)C2)c2ccccc2)cc1 ZINC000431129367 858459618 /nfs/dbraw/zinc/45/96/18/858459618.db2.gz PYFLXZOABLCDIG-AYRHNUGRSA-N 0 3 418.537 4.010 20 0 HIADHN COCCCOc1cccc(NC(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)c1 ZINC000431138967 858466108 /nfs/dbraw/zinc/46/61/08/858466108.db2.gz PFZPTBSNUHPUCT-QHCPKHFHSA-N 0 3 411.546 4.369 20 0 HIADHN O=C1N[C@@H](c2ccc3ccccc3c2)C(=O)N1C[C@H]1CCCN(Cc2cccs2)C1 ZINC000431166957 858482328 /nfs/dbraw/zinc/48/23/28/858482328.db2.gz MJIFHJMPFNETSX-JTSKRJEESA-N 0 3 419.550 4.406 20 0 HIADHN CC[C@H](c1ccccc1)N1CC(=O)N(C[C@H]2CCCN(Cc3cccs3)C2)C1=O ZINC000431172475 858486248 /nfs/dbraw/zinc/48/62/48/858486248.db2.gz XKIZQJKLUKEHFH-GHTZIAJQSA-N 0 3 411.571 4.376 20 0 HIADHN C[C@H]1C[C@@H](N(C)S(=O)(=O)Cc2cc(Cl)ccc2F)CCN1Cc1ccccc1 ZINC000431284755 858546414 /nfs/dbraw/zinc/54/64/14/858546414.db2.gz WIXXLHYUNLDLEG-JXFKEZNVSA-N 0 3 424.969 4.294 20 0 HIADHN COCCCOc1cccc(NC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)c1 ZINC000431593559 858680217 /nfs/dbraw/zinc/68/02/17/858680217.db2.gz AALJREAEMFDPRY-IBGZPJMESA-N 0 3 400.494 4.092 20 0 HIADHN COc1ccc(NC(=O)[C@H]2CCCCN2C2CCCC2)cc1OCc1ccncc1 ZINC000431907049 858865106 /nfs/dbraw/zinc/86/51/06/858865106.db2.gz LCTUGCSIEDPTCI-OAQYLSRUSA-N 0 3 409.530 4.405 20 0 HIADHN COc1ccc([C@H](CNC(=O)Cc2cscc2Br)N2CCCC2)cc1 ZINC000432056174 858954277 /nfs/dbraw/zinc/95/42/77/858954277.db2.gz YWNAHZFSTUWBMQ-SFHVURJKSA-N 0 3 423.376 4.015 20 0 HIADHN O=C(NCc1ccccc1)[C@@H](NC[C@@H]1CCO[C@H]1c1ccccc1)c1ccccc1 ZINC000432241128 859063307 /nfs/dbraw/zinc/06/33/07/859063307.db2.gz HZSWBTWACOBCTJ-SDHOMARFSA-N 0 3 400.522 4.412 20 0 HIADHN O=C(NC[C@H]1CN(Cc2ccccc2)CCCO1)c1c(Cl)cc(F)cc1Cl ZINC000432291227 859088692 /nfs/dbraw/zinc/08/86/92/859088692.db2.gz HWBFWZCIHUKOAY-INIZCTEOSA-N 0 3 411.304 4.153 20 0 HIADHN COCc1ccc([C@@H]2CCCN2C(=O)NC[C@H](c2cccs2)N2CCCC2)o1 ZINC000467564934 881387697 /nfs/dbraw/zinc/38/76/97/881387697.db2.gz SWQSCPICMUEGKT-ZWKOTPCHSA-N 0 3 403.548 4.171 20 0 HIADHN COc1ccc2c(c1)nc(CNC1CC(c3cccc(Br)c3)C1)n2C ZINC000432410771 859151072 /nfs/dbraw/zinc/15/10/72/859151072.db2.gz RLQAAOOEWNEFBE-UHFFFAOYSA-N 0 3 400.320 4.380 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CC[C@@](C)(c4ccc(F)cc4)C3)c2)CC1 ZINC000432415945 859155258 /nfs/dbraw/zinc/15/52/58/859155258.db2.gz XKGIGTPODWKUCA-XMMPIXPASA-N 0 3 410.537 4.163 20 0 HIADHN O=C(NCC[C@H](c1ccccc1)C(F)(F)F)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000432470919 859180457 /nfs/dbraw/zinc/18/04/57/859180457.db2.gz VVHXHGZNGFBGQT-WOJBJXKFSA-N 0 3 405.464 4.296 20 0 HIADHN COc1ccc([C@@H](CNC(=O)NCc2ccc(C(C)(F)F)cc2)N2CCCC2)cc1 ZINC000432568597 859230908 /nfs/dbraw/zinc/23/09/08/859230908.db2.gz LWZDUAUCRICEKN-OAQYLSRUSA-N 0 3 417.500 4.443 20 0 HIADHN COC(=O)C12CCC(C(=O)NC[C@@H](c3ccccc3)N3CCC(C)CC3)(CC1)CC2 ZINC000432683560 859292021 /nfs/dbraw/zinc/29/20/21/859292021.db2.gz ZKJZCBRUPJFYGP-ANYOXOOPSA-N 0 3 412.574 4.089 20 0 HIADHN COCC1(C)CN(C[C@H](O)COC(c2ccc(Cl)cc2)c2ccc(Cl)cc2)C1 ZINC000432752527 859335120 /nfs/dbraw/zinc/33/51/20/859335120.db2.gz MNIKZNNECXJNJF-FQEVSTJZSA-N 0 3 424.368 4.429 20 0 HIADHN Cc1ccc(-c2cncc(C(=O)N3CCC(CCN4C[C@H](C)O[C@@H](C)C4)CC3)c2)cc1 ZINC000467602036 881409794 /nfs/dbraw/zinc/40/97/94/881409794.db2.gz MVTXQNVPWFMEPE-SFTDATJTSA-N 0 3 421.585 4.409 20 0 HIADHN C[C@H]1CCN(C(=O)NCCC2CC(OC(C)(C)C)C2)CCN1Cc1ccccc1 ZINC000433041309 859495609 /nfs/dbraw/zinc/49/56/09/859495609.db2.gz CBBYKFYLFSHOEC-KPQWGBOZSA-N 0 3 401.595 4.276 20 0 HIADHN Cc1cc(Br)cc(C(=O)Nc2cccc(CN3CCC(CO)CC3)c2)c1 ZINC000467633836 881432601 /nfs/dbraw/zinc/43/26/01/881432601.db2.gz RGBXOCJTKFHHKD-UHFFFAOYSA-N 0 3 417.347 4.214 20 0 HIADHN CCc1ccc([C@@H]2CCN(CC(=O)N3CCC(OCc4ccccc4)CC3)C2)cc1 ZINC000433046943 859499122 /nfs/dbraw/zinc/49/91/22/859499122.db2.gz VUNPZEZUVSQEMC-XMMPIXPASA-N 0 3 406.570 4.246 20 0 HIADHN CCOc1cc(CN2CC[C@@H](c3ccc(CC)cc3)C2)nc2nc(C(F)(F)F)nn21 ZINC000433077958 859513422 /nfs/dbraw/zinc/51/34/22/859513422.db2.gz UDIKXLRMIJAQPN-MRXNPFEDSA-N 0 3 419.451 4.094 20 0 HIADHN CCC(CC)n1nccc1C(=O)NC1CCN(CCOc2ccc(Cl)cc2)CC1 ZINC000433150557 859541658 /nfs/dbraw/zinc/54/16/58/859541658.db2.gz LXUJZNXTUKJFBT-UHFFFAOYSA-N 0 3 418.969 4.171 20 0 HIADHN CCC(CC)n1ccc(C(=O)NC2CCN(CCOc3ccc(Cl)cc3)CC2)n1 ZINC000433151456 859542450 /nfs/dbraw/zinc/54/24/50/859542450.db2.gz ZETKHXKYEITMJU-UHFFFAOYSA-N 0 3 418.969 4.171 20 0 HIADHN CCCOc1c(Br)cc(Br)cc1CNCCC[C@@H](C)O ZINC000433192421 859561502 /nfs/dbraw/zinc/56/15/02/859561502.db2.gz LEYSUEARTWWIEM-LLVKDONJSA-N 0 3 409.162 4.251 20 0 HIADHN COC[C@@H](NCc1ccc(OCc2ccc(Cl)cc2)c(OC)c1)[C@H]1CCCO1 ZINC000433208403 859567512 /nfs/dbraw/zinc/56/75/12/859567512.db2.gz NSRPGMBNQCPCJI-WOJBJXKFSA-N 0 3 405.922 4.211 20 0 HIADHN Cc1ccc(-c2cncc(C(=O)Nc3cccc(CN4CCC(O)CC4)c3)c2)cc1 ZINC000467645598 881441266 /nfs/dbraw/zinc/44/12/66/881441266.db2.gz ZQLAMILBMCMWOL-UHFFFAOYSA-N 0 3 401.510 4.266 20 0 HIADHN C[C@H](NC[C@H](O)COc1ccc(F)cc1)c1ccc(OC[C@@H]2CCCCO2)c(F)c1 ZINC000433397452 859676308 /nfs/dbraw/zinc/67/63/08/859676308.db2.gz IYVQIBPDPCDQLB-LRQRDZAKSA-N 0 3 421.484 4.003 20 0 HIADHN Cc1ccc(C)c(Sc2ccc(NC(=O)C(=O)N3CC[C@H]4CC[C@@H](C3)N4C)cc2)c1 ZINC000467656524 881450354 /nfs/dbraw/zinc/45/03/54/881450354.db2.gz ULIFZICFGGTDMT-UXHICEINSA-N 0 3 423.582 4.088 20 0 HIADHN C[C@@H]1COCC[C@@H]1NC(=O)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000433453098 859708918 /nfs/dbraw/zinc/70/89/18/859708918.db2.gz YCARSFPTJMAVCG-BEFAXECRSA-N 0 3 414.377 4.026 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)NCCC2CC(OC(C)(C)C)C2)CC1 ZINC000433476134 859720984 /nfs/dbraw/zinc/72/09/84/859720984.db2.gz ABKIBZCVVBZHKM-UHFFFAOYSA-N 0 3 401.595 4.276 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)N[C@@H](c1cc(F)ccc1F)C(F)F ZINC000433604168 859805350 /nfs/dbraw/zinc/80/53/50/859805350.db2.gz MROKNFUTCCCEJK-SFHVURJKSA-N 0 3 415.406 4.184 20 0 HIADHN O=C(N[C@@H](c1cc(F)ccc1F)C(F)F)N1CCCN(Cc2ccccc2)CC1 ZINC000433616566 859811955 /nfs/dbraw/zinc/81/19/55/859811955.db2.gz KUZMDENMRSQZLS-IBGZPJMESA-N 0 3 409.427 4.189 20 0 HIADHN COc1cc(NC(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)ccc1Cl ZINC000433637697 859819631 /nfs/dbraw/zinc/81/96/31/859819631.db2.gz GAHFLUMUMKEUFU-IYBDPMFKSA-N 0 3 409.958 4.092 20 0 HIADHN CCN1CCCN(C(=O)Nc2ccc(Oc3ncc(Cl)cn3)c(Cl)c2)CC1 ZINC000433668323 859831795 /nfs/dbraw/zinc/83/17/95/859831795.db2.gz BDGOEUYRNFYFNC-UHFFFAOYSA-N 0 3 410.305 4.135 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(Cl)cc2)CC1)[C@H]1CCCc2sccc21 ZINC000433762639 859881430 /nfs/dbraw/zinc/88/14/30/859881430.db2.gz QZMYXUDAOZIPPR-FQEVSTJZSA-N 0 3 418.990 4.481 20 0 HIADHN Cn1cc(-c2cc(F)ccc2NC(=O)NC[C@@H]2CCCN2Cc2ccccc2)cn1 ZINC000433789680 859893084 /nfs/dbraw/zinc/89/30/84/859893084.db2.gz PFECYWSXMQUNOM-FQEVSTJZSA-N 0 3 407.493 4.012 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@@H](c3cc(F)ccc3F)C(F)F)c2)CC1 ZINC000433823592 859914579 /nfs/dbraw/zinc/91/45/79/859914579.db2.gz PCVDRISQUMYNLC-IBGZPJMESA-N 0 3 424.442 4.235 20 0 HIADHN CC(C)n1nc(-c2ccco2)cc1NC(=O)NCCCN1CCc2ccccc2C1 ZINC000433918412 859969905 /nfs/dbraw/zinc/96/99/05/859969905.db2.gz HXTZLXLIIVCTAC-UHFFFAOYSA-N 0 3 407.518 4.294 20 0 HIADHN Cc1nc(COc2ccccc2C(=O)N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)cs1 ZINC000467692971 881485373 /nfs/dbraw/zinc/48/53/73/881485373.db2.gz WABIGGWSGUMYNZ-YLJYHZDGSA-N 0 3 421.566 4.423 20 0 HIADHN CN(C(=O)c1ccc(-c2nc(C3CC3)no2)cc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000433971773 860009941 /nfs/dbraw/zinc/00/99/41/860009941.db2.gz KDEQWCBJFOWQHG-JOCHJYFZSA-N 0 3 416.525 4.351 20 0 HIADHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1oc2ccccc2c1CSc1ncccn1 ZINC000434027932 860050027 /nfs/dbraw/zinc/05/00/27/860050027.db2.gz OEHAXEJGNFEYPG-SJORKVTESA-N 0 3 422.554 4.214 20 0 HIADHN CC(=O)Nc1ccc(C(=O)N(CCN2CCCC2)Cc2ccc(Cl)cc2)cc1F ZINC000434116112 860117425 /nfs/dbraw/zinc/11/74/25/860117425.db2.gz ONVLVVIIPNQXSX-UHFFFAOYSA-N 0 3 417.912 4.176 20 0 HIADHN CN1CCC[C@@H](CNC(=O)c2cc(-c3ccc4c(c3)CCO4)no2)[C@@H]1c1cccs1 ZINC000434152911 860149602 /nfs/dbraw/zinc/14/96/02/860149602.db2.gz KUCJVWITJMJNGL-HTAPYJJXSA-N 0 3 423.538 4.151 20 0 HIADHN CC(C)[C@H](CNC(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1)c1cccnc1 ZINC000434169263 860164002 /nfs/dbraw/zinc/16/40/02/860164002.db2.gz HOFAWHOJYJUKQK-RBBKRZOGSA-N 0 3 419.491 4.392 20 0 HIADHN C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)c1cn(C(C)(C)C)nc1-c1ccccc1Cl ZINC000467713365 881510972 /nfs/dbraw/zinc/51/09/72/881510972.db2.gz MCORDZMZAIXYEE-AUUYWEPGSA-N 0 3 400.954 4.171 20 0 HIADHN Cc1ccccc1-c1cc(C(=O)N[C@@H]2CN(C3CC3)C[C@@H]2C)c2cnn(C(C)C)c2n1 ZINC000467716570 881515805 /nfs/dbraw/zinc/51/58/05/881515805.db2.gz SXBNVAKYYLWWHN-GAJHUEQPSA-N 0 3 417.557 4.200 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)[C@@H](C)Oc1cccc(C)c1 ZINC000434308882 860271257 /nfs/dbraw/zinc/27/12/57/860271257.db2.gz PZTBPWFOLRFJDV-IFMALSPDSA-N 0 3 418.541 4.353 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)CCCc1csc(C)n1 ZINC000434314954 860276005 /nfs/dbraw/zinc/27/60/05/860276005.db2.gz ICHRRJHIGSWHBT-OAQYLSRUSA-N 0 3 423.586 4.365 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1ccc(C2CC2)cn1 ZINC000434316220 860277372 /nfs/dbraw/zinc/27/73/72/860277372.db2.gz LYRUPEXHMWJART-NRFANRHFSA-N 0 3 401.514 4.163 20 0 HIADHN CC(=O)c1ccc(CC(=O)Nc2c(C)cnn2[C@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000434317006 860277599 /nfs/dbraw/zinc/27/75/99/860277599.db2.gz JWMXNTLHKYPAGB-QHCPKHFHSA-N 0 3 416.525 4.022 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)COc1c(C)cccc1C ZINC000434330871 860293422 /nfs/dbraw/zinc/29/34/22/860293422.db2.gz SKXQQVXGSDHJDL-QFIPXVFZSA-N 0 3 418.541 4.273 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1cc(C)c(F)cc1F ZINC000434332699 860294272 /nfs/dbraw/zinc/29/42/72/860294272.db2.gz JKMBFEPKJYNRRY-SFHVURJKSA-N 0 3 410.468 4.477 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1cncc(OC(C)C)c1 ZINC000434335982 860297373 /nfs/dbraw/zinc/29/73/73/860297373.db2.gz XUERZTDKGIJCIN-OAQYLSRUSA-N 0 3 419.529 4.073 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)CCO[C@@H](C)CC(C)C ZINC000434335094 860297812 /nfs/dbraw/zinc/29/78/12/860297812.db2.gz UEZHYVCBNVJBPM-RBBKRZOGSA-N 0 3 412.578 4.418 20 0 HIADHN CCC(CC)n1ccc(C(=O)Nc2c(C)cnn2[C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000434337740 860298976 /nfs/dbraw/zinc/29/89/76/860298976.db2.gz YIRDUMHEQWNQBG-OAQYLSRUSA-N 0 3 420.561 4.448 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)CCc1cc(F)ccc1F ZINC000434337946 860299074 /nfs/dbraw/zinc/29/90/74/860299074.db2.gz ZSEUDHPDCSCAGV-NRFANRHFSA-N 0 3 424.495 4.488 20 0 HIADHN CCC(CC)n1ccc(C(=O)Nc2c(C)cnn2[C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000434337739 860299139 /nfs/dbraw/zinc/29/91/39/860299139.db2.gz YIRDUMHEQWNQBG-NRFANRHFSA-N 0 3 420.561 4.448 20 0 HIADHN O=C(NC[C@@H]1CCCCN1C1CC1)N1CCC(c2nc3cc(Cl)ccc3o2)CC1 ZINC000434357646 860308761 /nfs/dbraw/zinc/30/87/61/860308761.db2.gz MKLRDWNNGORRJO-SFHVURJKSA-N 0 3 416.953 4.387 20 0 HIADHN Cc1nc(CSc2ccc(C(=O)NC[C@H]3CCCCN3C3CC3)cc2)cs1 ZINC000434427014 860345400 /nfs/dbraw/zinc/34/54/00/860345400.db2.gz XQUSQHUSPAZYSG-LJQANCHMSA-N 0 3 401.601 4.491 20 0 HIADHN Cc1ccc(-c2[nH]nc(NC(=O)c3ccc(N4CCN(C(C)C)CC4)cc3)c2C)o1 ZINC000434497480 860372865 /nfs/dbraw/zinc/37/28/65/860372865.db2.gz DNYOIXZJKBPPRN-UHFFFAOYSA-N 0 3 407.518 4.069 20 0 HIADHN COc1cc(C(C)=O)ccc1OC[C@@H](O)CN(C)[C@@H](c1ccc(F)cc1)C(C)C ZINC000434611778 860428289 /nfs/dbraw/zinc/42/82/89/860428289.db2.gz KUFIPCPUMFOROZ-NZQKXSOJSA-N 0 3 403.494 4.106 20 0 HIADHN COc1ccccc1CN(CCC(=O)Nc1cccc(F)c1C)C[C@@H]1CCCO1 ZINC000434686054 860460972 /nfs/dbraw/zinc/46/09/72/860460972.db2.gz RAKZHJFNEMEERI-IBGZPJMESA-N 0 3 400.494 4.153 20 0 HIADHN Cc1c2cc(Br)ccc2oc1C(=O)NCCCCN1C[C@@H](C)O[C@@H](C)C1 ZINC000434753227 860482325 /nfs/dbraw/zinc/48/23/25/860482325.db2.gz BGQGLKFAVVXEQF-OKILXGFUSA-N 0 3 423.351 4.123 20 0 HIADHN C[C@H](CC(=O)NCCCCN1C[C@@H](C)O[C@@H](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000434759200 860484580 /nfs/dbraw/zinc/48/45/80/860484580.db2.gz NINYYFWKZNFQEI-ZACQAIPSSA-N 0 3 400.485 4.205 20 0 HIADHN COc1cc(-c2ccccc2)sc1C(=O)NCCCCN1C[C@H](C)O[C@@H](C)C1 ZINC000434765157 860487017 /nfs/dbraw/zinc/48/70/17/860487017.db2.gz BDDJOAUSXGPYIZ-IRXDYDNUSA-N 0 3 402.560 4.043 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)CCCc2ccc(Cl)c(Cl)c2)C[C@H](C)O1 ZINC000434782813 860493557 /nfs/dbraw/zinc/49/35/57/860493557.db2.gz FJORRWVZLBXBNV-IYBDPMFKSA-N 0 3 401.378 4.322 20 0 HIADHN COc1cc(NC(=O)NC[C@H](c2cccs2)N2CCCC2)c(OC)c(C)c1OC ZINC000434968431 860579718 /nfs/dbraw/zinc/57/97/18/860579718.db2.gz MGEWJCQQSZUOSD-MRXNPFEDSA-N 0 3 419.547 4.041 20 0 HIADHN O=C(Nc1c[nH]nc1[C@@H]1CCCN(Cc2ccc(-c3cc[nH]n3)o2)C1)c1ccccc1 ZINC000434983364 860585386 /nfs/dbraw/zinc/58/53/86/860585386.db2.gz QHIQVWBGNVLDLW-QGZVFWFLSA-N 0 3 416.485 4.025 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1ccc(NC(=O)N(C)C)cc1Cl)c1ccsc1 ZINC000435051491 860616205 /nfs/dbraw/zinc/61/62/05/860616205.db2.gz ZNNCWXGQJKKUIX-GOSISDBHSA-N 0 3 422.982 4.308 20 0 HIADHN CC(C)[C@H](CNC(=O)Nc1ccc(CCN2CCSCC2)cc1)c1cccnc1 ZINC000435128324 860653802 /nfs/dbraw/zinc/65/38/02/860653802.db2.gz CRWBFILMBUXYFZ-QFIPXVFZSA-N 0 3 412.603 4.234 20 0 HIADHN COc1cc(CN2CCC[C@H](CO)C2)ccc1OCCOc1ccccc1Cl ZINC000435240425 860702844 /nfs/dbraw/zinc/70/28/44/860702844.db2.gz OCQYYEFMQJXXMX-SFHVURJKSA-N 0 3 405.922 4.011 20 0 HIADHN CC[C@H](C)c1cc(C(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)on1 ZINC000435270316 860710626 /nfs/dbraw/zinc/71/06/26/860710626.db2.gz KQIWWQGDNUWOLS-QFBILLFUSA-N 0 3 407.518 4.392 20 0 HIADHN Cc1cc(NC(=O)CSc2ccccc2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435274399 860712364 /nfs/dbraw/zinc/71/23/64/860712364.db2.gz IYGOVXJEWQNMKS-HXUWFJFHSA-N 0 3 406.555 4.369 20 0 HIADHN COc1cc(CC(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)ccc1C ZINC000435275101 860713259 /nfs/dbraw/zinc/71/32/59/860713259.db2.gz OTXJEPQAXLMVSN-QFIPXVFZSA-N 0 3 418.541 4.137 20 0 HIADHN Cc1cc(NC(=O)COc2ccc(C)c(C)c2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435278476 860715019 /nfs/dbraw/zinc/71/50/19/860715019.db2.gz GHLMVYSWFKDPOV-JOCHJYFZSA-N 0 3 418.541 4.273 20 0 HIADHN CSc1cc(C(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)ccn1 ZINC000435284118 860717869 /nfs/dbraw/zinc/71/78/69/860717869.db2.gz DVBFHDYCFJBUAM-LJQANCHMSA-N 0 3 407.543 4.008 20 0 HIADHN CC[C@@H](C(=O)Nc1cc(C)nn1[C@@H]1CCN(Cc2ccccc2)C1)c1c(C)noc1C ZINC000435286385 860718619 /nfs/dbraw/zinc/71/86/19/860718619.db2.gz CXJYABMHKHAPIB-NHCUHLMSSA-N 0 3 421.545 4.376 20 0 HIADHN Cc1cc(NC(=O)c2ccc(OC(C)C)nc2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435284787 860718639 /nfs/dbraw/zinc/71/86/39/860718639.db2.gz LDCKTMJLLJTKON-NRFANRHFSA-N 0 3 419.529 4.073 20 0 HIADHN Cc1cc(NC(=O)c2ccc(C(C)C)nc2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435287725 860720183 /nfs/dbraw/zinc/72/01/83/860720183.db2.gz APTYKRFMVSACHM-OAQYLSRUSA-N 0 3 403.530 4.409 20 0 HIADHN COc1ccc(C(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)cc1F ZINC000435294596 860723911 /nfs/dbraw/zinc/72/39/11/860723911.db2.gz KUUNTDUTDZGUII-LJQANCHMSA-N 0 3 408.477 4.039 20 0 HIADHN COc1ccc(C(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)c(F)c1 ZINC000435296613 860725063 /nfs/dbraw/zinc/72/50/63/860725063.db2.gz SMWXMUCOXPPSCX-GOSISDBHSA-N 0 3 408.477 4.039 20 0 HIADHN Cc1cc(NC(=O)[C@H](C)Oc2ccccc2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435298295 860725928 /nfs/dbraw/zinc/72/59/28/860725928.db2.gz XYVWXGAIWVLYKN-PZJWPPBQSA-N 0 3 404.514 4.045 20 0 HIADHN Cc1cc(NC(=O)c2cc3c(s2)CCOC3)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435298438 860725939 /nfs/dbraw/zinc/72/59/39/860725939.db2.gz LXNIMMFVHDUROK-IBGZPJMESA-N 0 3 422.554 4.025 20 0 HIADHN Cc1cc(NC(=O)c2csc(C3CC3)n2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435299496 860727041 /nfs/dbraw/zinc/72/70/41/860727041.db2.gz QVNLTRMGBYZPOJ-GOSISDBHSA-N 0 3 407.543 4.225 20 0 HIADHN Cc1cc(NC(=O)COc2cc(C)ccc2C)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435301918 860727524 /nfs/dbraw/zinc/72/75/24/860727524.db2.gz KNQZGQRSILHRSQ-QFIPXVFZSA-N 0 3 418.541 4.273 20 0 HIADHN COc1ccccc1CCC(=O)Nc1cc(C)nn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435301766 860727753 /nfs/dbraw/zinc/72/77/53/860727753.db2.gz ZTIPIIDBFLLBDY-QFIPXVFZSA-N 0 3 418.541 4.218 20 0 HIADHN O=C(c1cc(-c2cccs2)[nH]n1)N(CCn1ccnc1)Cc1cccc(Cl)c1 ZINC000435331352 860742506 /nfs/dbraw/zinc/74/25/06/860742506.db2.gz GFZSYJFABDQSSG-UHFFFAOYSA-N 0 3 411.918 4.331 20 0 HIADHN CC(C)c1cccc(OCC(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000435371354 860769159 /nfs/dbraw/zinc/76/91/59/860769159.db2.gz MHUZISWVOGOHCP-JOCHJYFZSA-N 0 3 418.541 4.471 20 0 HIADHN COc1ccc([C@H](C)CC(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000435371614 860769175 /nfs/dbraw/zinc/76/91/75/860769175.db2.gz NZSLIKDTCFDUSN-KNQAVFIVSA-N 0 3 418.541 4.471 20 0 HIADHN Cc1ccccc1SCC(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435371321 860769749 /nfs/dbraw/zinc/76/97/49/860769749.db2.gz UMXUMBFNLZTVDC-FQEVSTJZSA-N 0 3 406.555 4.369 20 0 HIADHN Cc1cccc(C)c1OCCC(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435373129 860770150 /nfs/dbraw/zinc/77/01/50/860770150.db2.gz MELANKBGDXOJTO-JOCHJYFZSA-N 0 3 418.541 4.355 20 0 HIADHN Cc1cccc2c(CC(=O)Nc3ccnn3[C@@H]3CCN(Cc4ccccc4)C3)c[nH]c21 ZINC000435372878 860770521 /nfs/dbraw/zinc/77/05/21/860770521.db2.gz SVFZVPJWGBBBFO-OAQYLSRUSA-N 0 3 413.525 4.301 20 0 HIADHN CC(C)Oc1cccc(CC(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000435372817 860770832 /nfs/dbraw/zinc/77/08/32/860770832.db2.gz KYRKADUIEPEQRH-QFIPXVFZSA-N 0 3 418.541 4.299 20 0 HIADHN Cc1ccc(O[C@H](C)C(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000435373523 860771807 /nfs/dbraw/zinc/77/18/07/860771807.db2.gz DVXUAKUMJRXGFC-TZIWHRDSSA-N 0 3 404.514 4.045 20 0 HIADHN Cc1ccc(C)c(OCCC(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000435373415 860772038 /nfs/dbraw/zinc/77/20/38/860772038.db2.gz URTVTUQVPODLKB-JOCHJYFZSA-N 0 3 418.541 4.355 20 0 HIADHN Cc1ccccc1OCCCC(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435373515 860772081 /nfs/dbraw/zinc/77/20/81/860772081.db2.gz VAPDCKFCEZNOEI-QFIPXVFZSA-N 0 3 418.541 4.436 20 0 HIADHN Cc1cc(C)cc(OCCC(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000435375344 860772775 /nfs/dbraw/zinc/77/27/75/860772775.db2.gz MGOGWEODSCTNEJ-JOCHJYFZSA-N 0 3 418.541 4.355 20 0 HIADHN COc1ccc(SCC(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000435375724 860773644 /nfs/dbraw/zinc/77/36/44/860773644.db2.gz OBPXNMZQYWFVFU-LJQANCHMSA-N 0 3 422.554 4.070 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)[C@H]1C[C@@]12CCc1ccccc12 ZINC000435377973 860775314 /nfs/dbraw/zinc/77/53/14/860775314.db2.gz BQGHLKUCRLAOFE-WHSBFGAESA-N 0 3 412.537 4.173 20 0 HIADHN Cc1cc(NC(=O)N[C@@H]2CCCc3occc32)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435513938 860832923 /nfs/dbraw/zinc/83/29/23/860832923.db2.gz APMVVZNVLORWSK-PZJWPPBQSA-N 0 3 419.529 4.431 20 0 HIADHN Cc1cc(NC(=O)N(C)[C@@H](C)c2ccccn2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435515075 860833003 /nfs/dbraw/zinc/83/30/03/860833003.db2.gz FJORGLGIDORAFQ-FPOVZHCZSA-N 0 3 418.545 4.258 20 0 HIADHN Cc1cc(NC(=O)NCc2ccc(C)cc2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435517707 860834885 /nfs/dbraw/zinc/83/48/85/860834885.db2.gz RDAXMSNWAXCGLI-JOCHJYFZSA-N 0 3 403.530 4.269 20 0 HIADHN Cc1cc([C@H](C)NC(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)ccc1F ZINC000435517917 860835156 /nfs/dbraw/zinc/83/51/56/860835156.db2.gz RUITYYNTIOBZRJ-OTWHNJEPSA-N 0 3 405.558 4.116 20 0 HIADHN CCn1nc(C)c(NC(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)c1C ZINC000435516977 860835270 /nfs/dbraw/zinc/83/52/70/860835270.db2.gz VJFXNYGSBXMJNI-HXUWFJFHSA-N 0 3 421.549 4.116 20 0 HIADHN Cc1cc(NC(=O)N2CCc3sccc3C2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435520652 860837520 /nfs/dbraw/zinc/83/75/20/860837520.db2.gz SJLAGLSQXSATJV-HXUWFJFHSA-N 0 3 421.570 4.290 20 0 HIADHN Cc1cc(NC(=O)NCc2nc(C)c(C)s2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435524331 860841302 /nfs/dbraw/zinc/84/13/02/860841302.db2.gz DUCFKRAXCGUXCT-IBGZPJMESA-N 0 3 424.574 4.034 20 0 HIADHN Cc1cc(NC(=O)NCc2sc(C)nc2C)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435538010 860852199 /nfs/dbraw/zinc/85/21/99/860852199.db2.gz SFCSHVFHVRWZNH-IBGZPJMESA-N 0 3 424.574 4.034 20 0 HIADHN Cc1c(NC(=O)N2CCCN(CCCc3ccccc3)CC2)cnn1-c1ccccc1 ZINC000435541751 860855994 /nfs/dbraw/zinc/85/59/94/860855994.db2.gz JUFWLXLYUFVRNQ-UHFFFAOYSA-N 0 3 417.557 4.353 20 0 HIADHN Cc1c(NC(=O)N(CCCc2ccccc2)CCN(C)C)cnn1-c1ccccc1 ZINC000435543915 860858535 /nfs/dbraw/zinc/85/85/35/860858535.db2.gz NEWAGFIXBNWUAC-UHFFFAOYSA-N 0 3 405.546 4.209 20 0 HIADHN Cc1c(NC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)cnn1-c1ccccc1F ZINC000435546977 860861687 /nfs/dbraw/zinc/86/16/87/860861687.db2.gz ZPRCYZSVCWWYPX-SFHVURJKSA-N 0 3 421.520 4.448 20 0 HIADHN COc1ccc([C@H](CNC(=O)Nc2cnn(-c3ccccc3)c2C)N2CCCC2)cc1 ZINC000435547581 860862760 /nfs/dbraw/zinc/86/27/60/860862760.db2.gz HLMDYOUTCAZFJO-QHCPKHFHSA-N 0 3 419.529 4.148 20 0 HIADHN Cc1c(NC(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)cnn1-c1ccccc1F ZINC000435547261 860863208 /nfs/dbraw/zinc/86/32/08/860863208.db2.gz CWNCNDFJLSYTMO-QFBILLFUSA-N 0 3 407.493 4.277 20 0 HIADHN Cc1c(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2)cnn1-c1ccccc1F ZINC000435558514 860878733 /nfs/dbraw/zinc/87/87/33/860878733.db2.gz MQTSOAHCKVSPLR-UHFFFAOYSA-N 0 3 413.472 4.055 20 0 HIADHN Cc1c(NC(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)cnn1-c1ccccc1 ZINC000435562374 860883873 /nfs/dbraw/zinc/88/38/73/860883873.db2.gz FCKGFFBFTAPWCH-QFIPXVFZSA-N 0 3 403.530 4.309 20 0 HIADHN CCOc1c(Cl)cc(NC(=O)NC2CCN(CCOC(C)C)CC2)cc1Cl ZINC000467779732 881599164 /nfs/dbraw/zinc/59/91/64/881599164.db2.gz FSSGCVGYUWNCLP-UHFFFAOYSA-N 0 3 418.365 4.403 20 0 HIADHN C[C@H]1[C@@H](c2ccccc2)[C@H]1C(=O)NC1CCN(CCOc2ccc(Cl)cc2)CC1 ZINC000435706502 860988807 /nfs/dbraw/zinc/98/88/07/860988807.db2.gz ONKFLMQKTFYPED-RTFZILSDSA-N 0 3 412.961 4.349 20 0 HIADHN CN(c1ccccc1)c1ccc(CNCc2cccc(CN3CCCC3=O)c2)cn1 ZINC000435783703 861057910 /nfs/dbraw/zinc/05/79/10/861057910.db2.gz YYTRKFIFUQPRAF-UHFFFAOYSA-N 0 3 400.526 4.262 20 0 HIADHN O=C1N[C@@]2(CCN(Cc3ccccc3)C2)C(=O)N1Cc1ccc(-c2ccsc2)cc1 ZINC000435797531 861067005 /nfs/dbraw/zinc/06/70/05/861067005.db2.gz DVLZDIICWIMJCD-XMMPIXPASA-N 0 3 417.534 4.112 20 0 HIADHN CC1CCN([C@@H](CNC(=O)c2c[nH]nc2-c2ccsc2)c2cccs2)CC1 ZINC000435814670 861081147 /nfs/dbraw/zinc/08/11/47/861081147.db2.gz YLXQVUHLZZHVTJ-KRWDZBQOSA-N 0 3 400.573 4.403 20 0 HIADHN Cc1cccc2nc(C3CCN(C(=O)N[C@H]4CCN(Cc5ccccc5)C4)CC3)oc21 ZINC000435861603 861119262 /nfs/dbraw/zinc/11/92/62/861119262.db2.gz JZIZDAYVINEGJH-NRFANRHFSA-N 0 3 418.541 4.300 20 0 HIADHN C[C@H]1CN(C2CC2)C[C@@H]1NC(=O)c1ccccc1CSc1nc2ccccc2o1 ZINC000467805365 881630442 /nfs/dbraw/zinc/63/04/42/881630442.db2.gz CLJHKMFBGGCBMW-YWZLYKJASA-N 0 3 407.539 4.333 20 0 HIADHN C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)c1ccccc1CSc1nc2ccccc2[nH]1 ZINC000467806992 881630267 /nfs/dbraw/zinc/63/02/67/881630267.db2.gz VNWPCVWLSZUJKZ-QVKFZJNVSA-N 0 3 406.555 4.068 20 0 HIADHN Cc1cc(-c2cc(C(=O)N[C@@H]3CN(C4CC4)C[C@H]3C)c3c(C)noc3n2)c(C)s1 ZINC000467806596 881631846 /nfs/dbraw/zinc/63/18/46/881631846.db2.gz SGEUXQUBCWEBTE-NSPYISDASA-N 0 3 410.543 4.089 20 0 HIADHN CN(CC/C=C\c1ccc(Br)cc1)[C@@H]1CCCC[C@@H]1S(C)(=O)=O ZINC000437879310 863241028 /nfs/dbraw/zinc/24/10/28/863241028.db2.gz BBJALIHZYDSLSG-CORAPOBDSA-N 0 3 400.382 4.140 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N[C@@H]2C[C@H]2c2ccc(Cl)c(Cl)c2)CC1 ZINC000437889999 863255680 /nfs/dbraw/zinc/25/56/80/863255680.db2.gz DHDUWPUJBBIUNQ-QFBILLFUSA-N 0 3 414.377 4.038 20 0 HIADHN CN(C)Cc1cccc(NC(=O)N(C)[C@@H]2CCOc3ccc(Br)cc32)c1 ZINC000437919574 863294817 /nfs/dbraw/zinc/29/48/17/863294817.db2.gz DTPOIZUQNAHPCD-GOSISDBHSA-N 0 3 418.335 4.498 20 0 HIADHN C[C@H](c1ccc(Cl)cc1)N1CCN(C(=O)Nc2cccc(CN(C)C)c2)CC1 ZINC000437942180 863317272 /nfs/dbraw/zinc/31/72/72/863317272.db2.gz LZVOTSOZEGHDIR-QGZVFWFLSA-N 0 3 400.954 4.312 20 0 HIADHN C[C@@H]1CCN(C(=O)Nc2cccc(-c3nccn3C)c2)CCN1Cc1ccccc1 ZINC000437973209 863342667 /nfs/dbraw/zinc/34/26/67/863342667.db2.gz FYZAQJNGYQERAR-LJQANCHMSA-N 0 3 403.530 4.215 20 0 HIADHN Cc1cc(NC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)ccc1C(=O)NC(C)C ZINC000438055616 863425089 /nfs/dbraw/zinc/42/50/89/863425089.db2.gz YFUVOFRRLCLLBC-HXUWFJFHSA-N 0 3 422.573 4.262 20 0 HIADHN O=C(NCc1coc(-c2ccccc2)n1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000438099583 863508671 /nfs/dbraw/zinc/50/86/71/863508671.db2.gz WUIUPBMGXOHSPO-UHFFFAOYSA-N 0 3 422.554 4.255 20 0 HIADHN C[C@H](N[C@@H]1CCCc2cc(OC(F)F)ccc21)c1cccc(S(=O)(=O)N(C)C)c1 ZINC000467839444 881675951 /nfs/dbraw/zinc/67/59/51/881675951.db2.gz PAVYATUPXFPKMH-VBKZILBWSA-N 0 3 424.513 4.267 20 0 HIADHN CCS(=O)(=O)c1ccc(N2CCC(NCc3ccc(Cl)cc3F)CC2)cc1 ZINC000438211525 863644136 /nfs/dbraw/zinc/64/41/36/863644136.db2.gz GGVHOFLOWYOFAZ-UHFFFAOYSA-N 0 3 410.942 4.031 20 0 HIADHN CC(C)(COc1ccc(C(F)(F)F)cn1)NC(=O)c1cccc(CN2CCCC2)c1 ZINC000438227930 863664009 /nfs/dbraw/zinc/66/40/09/863664009.db2.gz PXBJYUQNCQNMTD-UHFFFAOYSA-N 0 3 421.463 4.284 20 0 HIADHN C[C@H](NC(=O)c1cccc(CN2CCCC2)c1)[C@@H](OC1CCOCC1)c1ccccc1 ZINC000438244807 863704374 /nfs/dbraw/zinc/70/43/74/863704374.db2.gz GOGRQXXPGANIFO-NBGIEHNGSA-N 0 3 422.569 4.338 20 0 HIADHN O=C(Nc1cc(Cl)ccc1SCC(F)(F)F)N1CC[C@@H](N2CC=CC2)C1 ZINC000438251672 863714948 /nfs/dbraw/zinc/71/49/48/863714948.db2.gz ISPVPVZKXLVKJU-CYBMUJFWSA-N 0 3 405.873 4.472 20 0 HIADHN COc1ccc(OC)c(-c2nn(-c3ccccc3)cc2CN2CC[C@@H](O)C(C)(C)C2)c1 ZINC000438337907 863810950 /nfs/dbraw/zinc/81/09/50/863810950.db2.gz OBRUFKYJHWZRTG-HSZRJFAPSA-N 0 3 421.541 4.149 20 0 HIADHN CCOc1cc2c(cc1NC(=O)N(CCN(C)C)Cc1cccs1)O[C@@H](C)C2 ZINC000438358279 863822995 /nfs/dbraw/zinc/82/29/95/863822995.db2.gz UXAMCIAXQMFUKV-HNNXBMFYSA-N 0 3 403.548 4.066 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)Nc1ccc(COCc2ccccc2)cc1 ZINC000438383500 863838308 /nfs/dbraw/zinc/83/83/08/863838308.db2.gz ZDBCTNATDCLHGL-UHFFFAOYSA-N 0 3 418.541 4.394 20 0 HIADHN CCN1CCC[C@@H](CN(C)C(=O)c2ccc(-c3ccc(F)cc3)o2)[C@@H]1c1cnn(C)c1 ZINC000438393361 863843554 /nfs/dbraw/zinc/84/35/54/863843554.db2.gz OQSOWLHZHACDPF-FDDCHVKYSA-N 0 3 424.520 4.364 20 0 HIADHN CC(C)(O)CN1CCc2c(cccc2NC(=O)c2ncsc2-c2ccccc2)C1 ZINC000438446479 863873243 /nfs/dbraw/zinc/87/32/43/863873243.db2.gz FRHMWNJPQOGRGG-UHFFFAOYSA-N 0 3 407.539 4.191 20 0 HIADHN COC(=O)C(C)(C)c1ccc(NC(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)cc1 ZINC000438458393 863882214 /nfs/dbraw/zinc/88/22/14/863882214.db2.gz SQNMGXXIBIZOFD-UTKZUKDTSA-N 0 3 409.530 4.094 20 0 HIADHN COC(=O)C(C)(C)c1ccc(NC(=O)N(CCN(C)C)Cc2cccc(C)c2)cc1 ZINC000438478846 863896060 /nfs/dbraw/zinc/89/60/60/863896060.db2.gz YHTSXDWJZUOSKJ-UHFFFAOYSA-N 0 3 411.546 4.041 20 0 HIADHN Cc1nn(-c2ccc(Cl)c(Cl)c2)c(NC(=O)N2CC[C@H](N3CC=CC3)C2)c1C ZINC000438496789 863916895 /nfs/dbraw/zinc/91/68/95/863916895.db2.gz BUELQLSDJFYEEL-INIZCTEOSA-N 0 3 420.344 4.274 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)NC[C@H]1CCC[C@H](C(F)(F)F)C1 ZINC000438537882 863963789 /nfs/dbraw/zinc/96/37/89/863963789.db2.gz AGSUZNKVIAXRJR-OALUTQOASA-N 0 3 411.512 4.074 20 0 HIADHN CC(=O)CCc1ccc(OCCC(=O)N(Cc2ccccc2)C2CCN(C)CC2)cc1 ZINC000438552411 863982584 /nfs/dbraw/zinc/98/25/84/863982584.db2.gz IDJXMFOTGUSIQG-UHFFFAOYSA-N 0 3 422.569 4.100 20 0 HIADHN CC(C)C(=O)N(C)Cc1ccc(C(=O)N(Cc2ccccc2)C2CCN(C)CC2)cc1 ZINC000438554056 863983712 /nfs/dbraw/zinc/98/37/12/863983712.db2.gz ODBSGIYXDOPGBD-UHFFFAOYSA-N 0 3 421.585 4.038 20 0 HIADHN CN(C(=O)Nc1ncc(C(C)(C)C)s1)C1CCN(CCc2ccccn2)CC1 ZINC000438556888 863988020 /nfs/dbraw/zinc/98/80/20/863988020.db2.gz VRCAIXIENWAJAI-UHFFFAOYSA-N 0 3 401.580 4.006 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3ccc4ccc(Cl)cc4n3)CC2)C[C@H](C)O1 ZINC000438571540 864004362 /nfs/dbraw/zinc/00/43/62/864004362.db2.gz VNYCQQIMRMKFRZ-CALCHBBNSA-N 0 3 415.965 4.240 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Nc1ccc(F)cc1Br ZINC000438625134 864052704 /nfs/dbraw/zinc/05/27/04/864052704.db2.gz FFNQJFGSYSACPN-UHFFFAOYSA-N 0 3 400.317 4.245 20 0 HIADHN CCC(=O)Nc1ccc(Cl)c(NC(=O)N(CCN(C)C)Cc2cccs2)c1 ZINC000438631963 864061096 /nfs/dbraw/zinc/06/10/96/864061096.db2.gz WLSPSNLRLCNZPH-UHFFFAOYSA-N 0 3 408.955 4.346 20 0 HIADHN C[C@H](NCCC(=O)Nc1ccc(C(N)=O)c(Cl)c1)c1ccc(Cl)cc1Cl ZINC000438638949 864073426 /nfs/dbraw/zinc/07/34/26/864073426.db2.gz SYPMNILGPGWLTE-JTQLQIEISA-N 0 3 414.720 4.425 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2c(F)cc(Br)cc2F)N(C)C)cc1 ZINC000438648165 864087943 /nfs/dbraw/zinc/08/79/43/864087943.db2.gz GFMJQXGGXMFASW-INIZCTEOSA-N 0 3 412.278 4.460 20 0 HIADHN CCN(C(=O)C(=O)Nc1ccsc1Cl)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000438653452 864094063 /nfs/dbraw/zinc/09/40/63/864094063.db2.gz FKGXWGOMKGUWCU-GDBMZVCRSA-N 0 3 405.951 4.024 20 0 HIADHN Cc1ccc(NC(=O)N(Cc2ccccc2)C2CCN(C)CC2)cc1C(=O)NC(C)C ZINC000438658236 864104452 /nfs/dbraw/zinc/10/44/52/864104452.db2.gz BBXZXWHFUCCNJC-UHFFFAOYSA-N 0 3 422.573 4.262 20 0 HIADHN CCN(C(=O)C(=O)Nc1ccc(Cl)cc1F)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000438663959 864116697 /nfs/dbraw/zinc/11/66/97/864116697.db2.gz XZYQZEDXCHGVQR-CRAIPNDOSA-N 0 3 417.912 4.102 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3cccc(Oc4ccccn4)c3)CC2)C[C@H](C)O1 ZINC000438666622 864121503 /nfs/dbraw/zinc/12/15/03/864121503.db2.gz VDMIFRKSYRPGPP-KDURUIRLSA-N 0 3 424.545 4.227 20 0 HIADHN CCC[C@@H](N[C@H](C)c1ccc(OC)c(OC)c1)C(=O)N1CCc2sccc2C1 ZINC000467876333 881737735 /nfs/dbraw/zinc/73/77/35/881737735.db2.gz GGECUXSAXFOQLC-CRAIPNDOSA-N 0 3 402.560 4.170 20 0 HIADHN COc1ccc2[nH]cc(C3=CCN(C[C@@H](O)COc4ccccc4Cl)CC3)c2c1 ZINC000438759211 864252190 /nfs/dbraw/zinc/25/21/90/864252190.db2.gz XRPFRYVYAWMNIA-QGZVFWFLSA-N 0 3 412.917 4.359 20 0 HIADHN COc1cc2c(cc1OC)[C@@H](c1ccccc1)N(CCC(=O)N1CCC[C@@H]1C)CC2 ZINC000438790635 864283217 /nfs/dbraw/zinc/28/32/17/864283217.db2.gz LIPMNKVNTWRMOI-AVRWGWEMSA-N 0 3 408.542 4.052 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)Nc1ccc(CC(F)(F)F)cc1 ZINC000438892969 864374174 /nfs/dbraw/zinc/37/41/74/864374174.db2.gz ZFOYWWKHTYPMOI-UHFFFAOYSA-N 0 3 421.463 4.070 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)[C@@H]3C[C@@]34CCCc3ccccc34)c(C)c2)CC1 ZINC000438893555 864375136 /nfs/dbraw/zinc/37/51/36/864375136.db2.gz LFRUZPAPYTVLPZ-JYFHCDHNSA-N 0 3 403.570 4.370 20 0 HIADHN CN(C)CCN(C(=O)Nc1ccc(OC(F)F)cc1OC(F)F)C1CCCC1 ZINC000467896798 881757723 /nfs/dbraw/zinc/75/77/23/881757723.db2.gz CFPGHIUQUCHTQJ-UHFFFAOYSA-N 0 3 407.408 4.228 20 0 HIADHN COc1ccc([C@@H](CNC(=O)Cc2cccc(OC(F)(F)F)c2)N2CCCC2)cc1 ZINC000438898967 864380405 /nfs/dbraw/zinc/38/04/05/864380405.db2.gz AZLBIWXAXDIRMK-HXUWFJFHSA-N 0 3 422.447 4.090 20 0 HIADHN Cc1cc(C(=O)N2CCCC[C@H]2C)ccc1NC(=O)N(CCN(C)C)C1CCCC1 ZINC000467899173 881761455 /nfs/dbraw/zinc/76/14/55/881761455.db2.gz MEYDCYOTTCCIAS-LJQANCHMSA-N 0 3 414.594 4.348 20 0 HIADHN C[C@@H]1CC[C@H](O)[C@@H]([C@H]2CCCCN2Cc2nnc(-c3ccc(Br)o3)o2)C1 ZINC000438993335 864452078 /nfs/dbraw/zinc/45/20/78/864452078.db2.gz JUNZJXYSZGRSRW-TUVASFSCSA-N 0 3 424.339 4.244 20 0 HIADHN O=C(Nc1ccccc1-c1ncc2n1CCCC2)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000439073667 864525120 /nfs/dbraw/zinc/52/51/20/864525120.db2.gz XVJCRYVXJBQQFP-HXUWFJFHSA-N 0 3 415.541 4.282 20 0 HIADHN CC(C)CN1CCCC[C@H]1CNC(=O)N1CCC(C(=O)c2cc(F)ccc2F)CC1 ZINC000439200245 864624510 /nfs/dbraw/zinc/62/45/10/864624510.db2.gz OROSGLUXMPWLHZ-IBGZPJMESA-N 0 3 421.532 4.080 20 0 HIADHN C[C@@H]1C[C@H](c2ccccc2)CCN1CC(=O)N1CCC(C(=O)Nc2ccccc2)CC1 ZINC000439312513 864745361 /nfs/dbraw/zinc/74/53/61/864745361.db2.gz FLQOPCNXHLBLGV-NFBKMPQASA-N 0 3 419.569 4.132 20 0 HIADHN COc1cccc(NC(=O)[C@H](NC2CCC(c3nc(C)no3)CC2)c2ccccc2)c1 ZINC000439514879 864859594 /nfs/dbraw/zinc/85/95/94/864859594.db2.gz BTEDGGHAKPGIPE-OBFZPWGMSA-N 0 3 420.513 4.382 20 0 HIADHN Cc1noc(C2CCC(N[C@H](C(=O)NCc3ccccc3)c3ccccc3)CC2)n1 ZINC000439521668 864862054 /nfs/dbraw/zinc/86/20/54/864862054.db2.gz KQXVQZYEIPSCPI-HRTMPFAESA-N 0 3 404.514 4.052 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(C(F)(F)F)cc1)C(=O)N(C)C[C@H]1COc2ccccc2O1 ZINC000439543315 864871936 /nfs/dbraw/zinc/87/19/36/864871936.db2.gz DOUNLMLQZRSSEL-MPGHIAIKSA-N 0 3 422.447 4.043 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)NC[C@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000439627330 864952655 /nfs/dbraw/zinc/95/26/55/864952655.db2.gz DTKOKQWDTCEBFI-DOTOQJQBSA-N 0 3 403.464 4.268 20 0 HIADHN CC(C)(C)[C@H](CN1CCc2ccccc2C1)NC(=O)N1CCC([C@H]2CCCO2)CC1 ZINC000439641818 864968083 /nfs/dbraw/zinc/96/80/83/864968083.db2.gz GVQKBWICPGANEQ-PKTZIBPZSA-N 0 3 413.606 4.060 20 0 HIADHN Cc1cccc(-c2nc(CC(=O)NC3CCN([C@@H](C)c4ccncc4)CC3)cs2)c1 ZINC000439738369 865071328 /nfs/dbraw/zinc/07/13/28/865071328.db2.gz JBSQDWRHSWSQRV-SFHVURJKSA-N 0 3 420.582 4.398 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)c2cc3c(cccc3OC(F)F)[nH]2)CC1 ZINC000439744300 865075760 /nfs/dbraw/zinc/07/57/60/865075760.db2.gz YIAGMHWBEVCANZ-CQSZACIVSA-N 0 3 414.456 4.120 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)CCCc2ncc(-c3ccccc3)o2)CC1 ZINC000439772000 865097701 /nfs/dbraw/zinc/09/77/01/865097701.db2.gz FMOQVZYAFCQLAH-IBGZPJMESA-N 0 3 418.541 4.401 20 0 HIADHN C[C@@H](C(=O)NCc1ccccc1CN1CCC(O)CC1)c1ccc2ccccc2c1 ZINC000439902651 865213621 /nfs/dbraw/zinc/21/36/21/865213621.db2.gz OCNFTUVYKBQSJI-LJQANCHMSA-N 0 3 402.538 4.216 20 0 HIADHN COc1cccc(CNC(=O)N(CCN(C)C)C2CCCC2)c1OC1CCCC1 ZINC000468017472 881855117 /nfs/dbraw/zinc/85/51/17/881855117.db2.gz SHRNQOYJYWDQAJ-UHFFFAOYSA-N 0 3 403.567 4.032 20 0 HIADHN CC[C@H](C)NC(=O)[C@@H]1C[C@H](C)N(Cc2nc(-c3ccccc3)no2)[C@@H]2CCCC[C@@H]12 ZINC000439990245 865299269 /nfs/dbraw/zinc/29/92/69/865299269.db2.gz UCBHDJPPRJSCID-SQEGATDGSA-N 0 3 410.562 4.421 20 0 HIADHN COc1cc(-c2nnc(CN[C@@H]3CCCC[C@@H]3C(C)(C)C)o2)cc(OC)c1OC ZINC000440047767 865325508 /nfs/dbraw/zinc/32/55/08/865325508.db2.gz CDOKTHAGNPSXPG-JKSUJKDBSA-N 0 3 403.523 4.457 20 0 HIADHN CC(C)N(CCN(C)C)C(=O)NCC1(c2ccc(Cl)cc2Cl)CCOCC1 ZINC000440081506 865346160 /nfs/dbraw/zinc/34/61/60/865346160.db2.gz SEGUBNBZJLWTRN-UHFFFAOYSA-N 0 3 416.393 4.023 20 0 HIADHN COc1ccc2c(c1)[C@@H](N[C@H](C)CC(=O)Nc1ccc(Br)cc1)CCO2 ZINC000468048368 881875158 /nfs/dbraw/zinc/87/51/58/881875158.db2.gz KRIGPZYEIUOPET-ACJLOTCBSA-N 0 3 419.319 4.288 20 0 HIADHN O=C(NCc1cccc(-c2ccccn2)c1)NC[C@@H](c1cccs1)N1CCCC1 ZINC000440199266 865431342 /nfs/dbraw/zinc/43/13/42/865431342.db2.gz IIISIBZWJWMJEG-NRFANRHFSA-N 0 3 406.555 4.446 20 0 HIADHN COc1ccc(-c2nc3c(s2)[C@H](NC(=O)N(CCN(C)C)C(C)C)CCC3)cc1 ZINC000440211443 865444014 /nfs/dbraw/zinc/44/40/14/865444014.db2.gz CHLRWRROZLWZBS-LJQANCHMSA-N 0 3 416.591 4.178 20 0 HIADHN O=C(NCc1cccc(-c2ccccn2)c1)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000440214159 865450574 /nfs/dbraw/zinc/45/05/74/865450574.db2.gz KTHHUCNXRVYZOZ-DEOSSOPVSA-N 0 3 400.526 4.385 20 0 HIADHN C[C@H](CSCc1ccccc1)C(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000440278406 865528826 /nfs/dbraw/zinc/52/88/26/865528826.db2.gz DMVMGQKPLGOEBG-NJDAHSKKSA-N 0 3 418.647 4.294 20 0 HIADHN Cc1[nH]c2ccccc2c1C1CCN(C(=O)CC2(N3CCOCC3)CCCC2)CC1 ZINC000468094142 881899368 /nfs/dbraw/zinc/89/93/68/881899368.db2.gz OZXMKWGHAHKBCI-UHFFFAOYSA-N 0 3 409.574 4.217 20 0 HIADHN O=C(NC[C@@]1(O)CCN(Cc2ccccc2)C1)c1cc2sc3ccccc3c2s1 ZINC000440512586 865801392 /nfs/dbraw/zinc/80/13/92/865801392.db2.gz ATQHFDQSONYDNC-QHCPKHFHSA-N 0 3 422.575 4.483 20 0 HIADHN CCOc1ccc(OCCN2CCC(Nc3cc(OC)cc(OC)c3)CC2)cc1 ZINC000440547439 865814260 /nfs/dbraw/zinc/81/42/60/865814260.db2.gz JBPGTGKHPYJJCO-UHFFFAOYSA-N 0 3 400.519 4.058 20 0 HIADHN COc1ccccc1COC[C@@H](O)CN1CC=C(c2c(C)[nH]c3ccccc32)CC1 ZINC000440609673 865836504 /nfs/dbraw/zinc/83/65/04/865836504.db2.gz FBYDRCYEAQZCDV-NRFANRHFSA-N 0 3 406.526 4.152 20 0 HIADHN COc1cc(NC(=O)CN[C@H]2CC(C)(C)CCc3ccccc32)cc(OC)c1OC ZINC000440642581 865853752 /nfs/dbraw/zinc/85/37/52/865853752.db2.gz YQSLMKNZGREEBE-IBGZPJMESA-N 0 3 412.530 4.344 20 0 HIADHN COc1cc(NC(=O)CN[C@@H]2CC(C)(C)CCc3ccccc32)cc(OC)c1OC ZINC000440642858 865854719 /nfs/dbraw/zinc/85/47/19/865854719.db2.gz YQSLMKNZGREEBE-LJQANCHMSA-N 0 3 412.530 4.344 20 0 HIADHN C[C@H](CCC(=O)N1CCC[C@@H](CN2CCN(c3ccccn3)CC2)C1)c1ccccc1 ZINC000440776103 865902234 /nfs/dbraw/zinc/90/22/34/865902234.db2.gz BEQCAFGLVIRKHJ-PKTZIBPZSA-N 0 3 420.601 4.026 20 0 HIADHN O=C(CN1CCN(C2CCCCC2)CC1)N1c2ccccc2CCc2ccccc21 ZINC000440790355 865914658 /nfs/dbraw/zinc/91/46/58/865914658.db2.gz FDHTZCCAYGSGFV-UHFFFAOYSA-N 0 3 403.570 4.400 20 0 HIADHN CCCCOC1CCN(C(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)CC1 ZINC000440823293 865938177 /nfs/dbraw/zinc/93/81/77/865938177.db2.gz MECBEAXFMXSOKE-OAQYLSRUSA-N 0 3 412.496 4.249 20 0 HIADHN Cc1ccccc1-c1nn(-c2ccccc2)cc1C(=O)N[C@H]1C[C@H](C)N(C2CC2)C1 ZINC000440915814 866010570 /nfs/dbraw/zinc/01/05/70/866010570.db2.gz MDIVNTUXLDBJAI-OALUTQOASA-N 0 3 400.526 4.203 20 0 HIADHN C[C@H]1C[C@H](NC(=O)c2ccc(Cl)c(NC(=O)c3cccs3)c2)CN1C1CC1 ZINC000440920021 866015381 /nfs/dbraw/zinc/01/53/81/866015381.db2.gz GUBIUMLUCQCSFZ-JSGCOSHPSA-N 0 3 403.935 4.009 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)c2ccc(Cl)c(NC(=O)c3cccs3)c2)CN1C1CC1 ZINC000440920020 866015742 /nfs/dbraw/zinc/01/57/42/866015742.db2.gz GUBIUMLUCQCSFZ-GXTWGEPZSA-N 0 3 403.935 4.009 20 0 HIADHN Cc1cc(-c2cc(C(=O)N[C@H]3C[C@H](C)N(C4CC4)C3)c3cnn(C(C)C)c3n2)c(C)o1 ZINC000440924704 866019703 /nfs/dbraw/zinc/01/97/03/866019703.db2.gz JLBWTLMIENYGGM-YOEHRIQHSA-N 0 3 421.545 4.244 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)c2cnn(-c3cccc(C(F)(F)F)c3)c2C2CC2)CN1C1CC1 ZINC000440924997 866021863 /nfs/dbraw/zinc/02/18/63/866021863.db2.gz VXGIZSHXLCYWCJ-CZUORRHYSA-N 0 3 418.463 4.124 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)c2cn(C(C)(C)C)nc2-c2ccccc2Cl)CN1C1CC1 ZINC000440933931 866032380 /nfs/dbraw/zinc/03/23/80/866032380.db2.gz RNAVMRFWGXYMNQ-LSDHHAIUSA-N 0 3 400.954 4.314 20 0 HIADHN Cc1ccc([C@H](OC[C@H](O)CN2CCc3ccccc3[C@@H]2CO)c2ccccc2)cc1 ZINC000440935422 866033802 /nfs/dbraw/zinc/03/38/02/866033802.db2.gz KYHHWUXYGWENSQ-FXVJXKIMSA-N 0 3 417.549 4.054 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)CCc2nnc(-c3ccc(Cl)cc3)o2)C1 ZINC000468115641 881938222 /nfs/dbraw/zinc/93/82/22/881938222.db2.gz RSVDZDQGPNNNMJ-OXJNMPFZSA-N 0 3 424.932 4.274 20 0 HIADHN COCc1nc(CNC(=O)NC[C@@H](c2ccccc2)N(C)C)c(-c2ccccc2)s1 ZINC000441036444 866099237 /nfs/dbraw/zinc/09/92/37/866099237.db2.gz SHLOJZHDMWDZBP-FQEVSTJZSA-N 0 3 424.570 4.059 20 0 HIADHN O=c1[nH]c(CCN2CCC[C@@H](c3nc(C(F)(F)F)cs3)C2)nc2ccccc12 ZINC000441057996 866137521 /nfs/dbraw/zinc/13/75/21/866137521.db2.gz FHMIUHKVMDPWFR-GFCCVEGCSA-N 0 3 408.449 4.233 20 0 HIADHN C[C@@H]1[C@H](c2ccccc2)c2ccccc2CCN1Cc1csc(CC(=O)N(C)C)n1 ZINC000441071137 866160084 /nfs/dbraw/zinc/16/00/84/866160084.db2.gz QDEOTNJNJSZBDD-IQGLISFBSA-N 0 3 419.594 4.353 20 0 HIADHN Cc1ccnc(Oc2ccc(NC(=O)NC[C@@H]3CCCN3Cc3ccccc3)cc2)n1 ZINC000441096660 866191649 /nfs/dbraw/zinc/19/16/49/866191649.db2.gz WICQGVXNAPCWMQ-NRFANRHFSA-N 0 3 417.513 4.363 20 0 HIADHN Cc1ccnc(Oc2ccc(NC(=O)N3CCN(C4CCC(C)CC4)CC3)cc2)n1 ZINC000441120245 866215762 /nfs/dbraw/zinc/21/57/62/866215762.db2.gz PGIGIOGQVVLNRR-UHFFFAOYSA-N 0 3 409.534 4.306 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)Nc2cc(C)ccc2Oc2ccccc2)CC1 ZINC000441125907 866220118 /nfs/dbraw/zinc/22/01/18/866220118.db2.gz YABFKIGCVVXRES-FQEVSTJZSA-N 0 3 410.562 4.182 20 0 HIADHN O=C(CN1CCC[C@@H]([C@H]2CCOC2)C1)NCCC(c1ccccc1)c1ccccc1 ZINC000441216822 866289011 /nfs/dbraw/zinc/28/90/11/866289011.db2.gz KTYACRVYCRJZFB-RPWUZVMVSA-N 0 3 406.570 4.073 20 0 HIADHN CCOc1ccc(-c2nc(CN3CCC[C@@H]([C@@H]4CCOC4)C3)cs2)cc1OC ZINC000441219203 866296221 /nfs/dbraw/zinc/29/62/21/866296221.db2.gz WGKZWLBLOUVEEK-QZTJIDSGSA-N 0 3 402.560 4.466 20 0 HIADHN CO[C@H]1CCCC[C@@H]1NCC(=O)N1N=C(c2cccs2)C[C@H]1c1cccs1 ZINC000441235723 866311215 /nfs/dbraw/zinc/31/12/15/866311215.db2.gz SPKKDDPYYOHUFP-XIRDDKMYSA-N 0 3 403.573 4.035 20 0 HIADHN COCc1nc(C(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)c(-c2ccccc2)s1 ZINC000441278176 866353242 /nfs/dbraw/zinc/35/32/42/866353242.db2.gz MQGYMJUCAFTNDH-XLIONFOSSA-N 0 3 421.566 4.207 20 0 HIADHN COCc1nc(C(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)c(-c2ccccc2)s1 ZINC000441278174 866353311 /nfs/dbraw/zinc/35/33/11/866353311.db2.gz MQGYMJUCAFTNDH-PXNSSMCTSA-N 0 3 421.566 4.207 20 0 HIADHN CCCOc1ccc(CN(CCC)C(=O)N[C@@H]2C[C@@H](C)N(C3CC3)C2)cc1OC ZINC000441287356 866361916 /nfs/dbraw/zinc/36/19/16/866361916.db2.gz PDZKAVIIBQMGQB-IEBWSBKVSA-N 0 3 403.567 4.031 20 0 HIADHN Cn1ccnc1CC1CCN(Cc2ncc(-c3cccc(Br)c3)o2)CC1 ZINC000441305896 866376495 /nfs/dbraw/zinc/37/64/95/866376495.db2.gz AWSPJVWTWKPIEC-UHFFFAOYSA-N 0 3 415.335 4.292 20 0 HIADHN CC[C@@H](Cc1ccc(C)cc1)N(C)CC(=O)N1CCC(C(=O)Nc2ccccc2)CC1 ZINC000441363942 866431992 /nfs/dbraw/zinc/43/19/92/866431992.db2.gz XTGYWNDTCNVDCU-DEOSSOPVSA-N 0 3 421.585 4.125 20 0 HIADHN COC(=O)c1ccc(OCCN2CC[C@@H](COCc3ccccc3)C2)c(Cl)c1 ZINC000441376632 866444612 /nfs/dbraw/zinc/44/46/12/866444612.db2.gz KUDGOUQDAKGCFH-GOSISDBHSA-N 0 3 403.906 4.044 20 0 HIADHN CC(C)N(Cc1cc(Br)ccc1F)C(=O)N[C@@H]1C[C@@H](C)N(C2CC2)C1 ZINC000441378933 866448260 /nfs/dbraw/zinc/44/82/60/866448260.db2.gz CSRPQSGYWBENHO-CZUORRHYSA-N 0 3 412.347 4.133 20 0 HIADHN CC(C)N(Cc1cc(Br)ccc1F)C(=O)N[C@H]1C[C@@H](C)N(C2CC2)C1 ZINC000441378931 866448812 /nfs/dbraw/zinc/44/88/12/866448812.db2.gz CSRPQSGYWBENHO-CJNGLKHVSA-N 0 3 412.347 4.133 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@H](C)N2CCC[C@H]2c2cccc(N(C)C)c2)cc1F ZINC000441386838 866459185 /nfs/dbraw/zinc/45/91/85/866459185.db2.gz XDAOUAASUTZTCH-JTSKRJEESA-N 0 3 413.537 4.084 20 0 HIADHN COc1cc(-c2nnc(CN3CCC[C@@H]3Cc3ccc(C)cc3)o2)cc(OC)c1OC ZINC000441389583 866460836 /nfs/dbraw/zinc/46/08/36/866460836.db2.gz WPCXPLYPZMLWCQ-LJQANCHMSA-N 0 3 423.513 4.278 20 0 HIADHN C[C@H](NC(=O)CN(C[C@@H]1CCCO1)C1CCCC1)c1ccc(Br)cc1 ZINC000441444941 866521854 /nfs/dbraw/zinc/52/18/54/866521854.db2.gz UPJCEPDVJNVBOT-KXBFYZLASA-N 0 3 409.368 4.050 20 0 HIADHN COCCOc1ccc(C(F)(F)F)cc1NC(=O)CN1[C@H](C)C[C@H]2CCCC[C@H]21 ZINC000441459028 866533477 /nfs/dbraw/zinc/53/34/77/866533477.db2.gz QYNQWYDYPUDMPY-IIDMSEBBSA-N 0 3 414.468 4.322 20 0 HIADHN COCCOc1ccc(C(F)(F)F)cc1NC(=O)CN1[C@H](C)C[C@@H]2CCCC[C@@H]21 ZINC000441459031 866533524 /nfs/dbraw/zinc/53/35/24/866533524.db2.gz QYNQWYDYPUDMPY-VKJFTORMSA-N 0 3 414.468 4.322 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)NC[C@]1(C)CCCS1 ZINC000468140052 881993987 /nfs/dbraw/zinc/99/39/87/881993987.db2.gz KJLXPMXPABXALE-SFHVURJKSA-N 0 3 403.514 4.064 20 0 HIADHN COc1cccc([C@@H](CNC(=O)CCc2c[nH]c3ccc(C)cc23)N2CCCC2)c1 ZINC000468140969 881997058 /nfs/dbraw/zinc/99/70/58/881997058.db2.gz XHOLUIYPYLHZNG-XMMPIXPASA-N 0 3 405.542 4.371 20 0 HIADHN CC(C)Sc1c(Cl)cccc1NC(=O)C(=O)NC[C@@H](C)N1CCCC[C@H]1C ZINC000441767852 866844300 /nfs/dbraw/zinc/84/43/00/866844300.db2.gz SXYSOZBMXNTBKR-HUUCEWRRSA-N 0 3 411.999 4.158 20 0 HIADHN Cc1nn(C(C)(C)C)cc1[C@@H](C)NC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000468159184 882025114 /nfs/dbraw/zinc/02/51/14/882025114.db2.gz KZLSXIVZTARLAN-WIYYLYMNSA-N 0 3 411.594 4.314 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)Nc3nc(C4CCC4)cs3)CC2)C[C@H](C)O1 ZINC000442078987 867109965 /nfs/dbraw/zinc/10/99/65/867109965.db2.gz MAEMKSXCCCVZFO-HOTGVXAUSA-N 0 3 406.596 4.154 20 0 HIADHN C[C@@H]1CCN(C)CCN1C(=O)N[C@H]1CCCc2sc(-c3ccc(F)cc3)nc21 ZINC000468172041 882050171 /nfs/dbraw/zinc/05/01/71/882050171.db2.gz ZQXVWLFGRATLRN-PBHICJAKSA-N 0 3 402.539 4.062 20 0 HIADHN C[C@H]1CCN(C)CCN1C(=O)N[C@H]1CCCc2sc(-c3ccc(F)cc3)nc21 ZINC000468172044 882051737 /nfs/dbraw/zinc/05/17/37/882051737.db2.gz ZQXVWLFGRATLRN-YOEHRIQHSA-N 0 3 402.539 4.062 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N[C@@H]1c2ccccc2CC[C@H]1C(C)C ZINC000442549368 867523992 /nfs/dbraw/zinc/52/39/92/867523992.db2.gz YMIIGJYTSPYPON-REWPJTCUSA-N 0 3 407.558 4.071 20 0 HIADHN CN(C(=O)N[C@H]1CC(C)(C)CCc2ccccc21)C1CCN(CCn2cccn2)CC1 ZINC000442608587 867556690 /nfs/dbraw/zinc/55/66/90/867556690.db2.gz KGEUEWHPQHCTDT-QHCPKHFHSA-N 0 3 423.605 4.093 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1ncccc1Oc1ccccc1 ZINC000442690830 867624476 /nfs/dbraw/zinc/62/44/76/867624476.db2.gz CBOIKVYSESWOFE-UHFFFAOYSA-N 0 3 417.509 4.331 20 0 HIADHN COCCC[C@@H](NCc1cccc(N2CCC2=O)c1)c1ccc(Br)cc1 ZINC000442798016 867679581 /nfs/dbraw/zinc/67/95/81/867679581.db2.gz IRHMLZWURSDETJ-HXUWFJFHSA-N 0 3 417.347 4.443 20 0 HIADHN Cc1nc(-c2ccc(C(=O)Nc3cccc4c3CCN(CC(C)(C)O)C4)cc2)cs1 ZINC000442882992 867715330 /nfs/dbraw/zinc/71/53/30/867715330.db2.gz BUWJLXPASMFXFG-UHFFFAOYSA-N 0 3 421.566 4.500 20 0 HIADHN Cc1cc(C(F)(F)F)ccc1CNCc1ccccc1CS(=O)(=O)NC(C)C ZINC000443002902 867788185 /nfs/dbraw/zinc/78/81/85/867788185.db2.gz UBZFYEMTOAUIQN-UHFFFAOYSA-N 0 3 414.493 4.131 20 0 HIADHN COCCOc1ccc(CN[C@H](C)c2ccc(Br)s2)cc1OC ZINC000443012018 867791524 /nfs/dbraw/zinc/79/15/24/867791524.db2.gz RGQBEALJIGFCHL-GFCCVEGCSA-N 0 3 400.338 4.395 20 0 HIADHN CCOc1cc(CN2CC[C@@H](OC)C[C@H]2C)ccc1OCc1ccc(C(=O)OC)o1 ZINC000443065681 867808155 /nfs/dbraw/zinc/80/81/55/867808155.db2.gz IGAZMOSQCBVQQU-SJLPKXTDSA-N 0 3 417.502 4.043 20 0 HIADHN C[C@@H](c1nc(-c2ccc(N(C)C(=O)c3ccncc3)cc2)no1)N1[C@H](C)CC[C@@H]1C ZINC000443201837 867873338 /nfs/dbraw/zinc/87/33/38/867873338.db2.gz JGMNDRXUNRGZPD-BBWFWOEESA-N 0 3 405.502 4.342 20 0 HIADHN CCc1cccc2c(CC(=O)NC3CCN(CCOc4ccc(F)cc4)CC3)c[nH]c21 ZINC000443330574 867908505 /nfs/dbraw/zinc/90/85/05/867908505.db2.gz KCJHSHLQOLOSND-UHFFFAOYSA-N 0 3 423.532 4.072 20 0 HIADHN Cc1ccc(SCC(=O)NC2CCN(CCOc3ccc(F)cc3)CC2)c(C)c1 ZINC000443350121 867920411 /nfs/dbraw/zinc/92/04/11/867920411.db2.gz ZTGWEKWIXDOANF-UHFFFAOYSA-N 0 3 416.562 4.194 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(F)cc2)CC1)c1c(Cl)cccc1Cl ZINC000443349681 867920845 /nfs/dbraw/zinc/92/08/45/867920845.db2.gz YMMYVZVNPRCZOT-UHFFFAOYSA-N 0 3 411.304 4.406 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N(CCCO)[C@@H]1CCc2ccccc21)c1ccsc1 ZINC000443630773 868207042 /nfs/dbraw/zinc/20/70/42/868207042.db2.gz VTEZLMWPBFQUKM-FGZHOGPDSA-N 0 3 415.603 4.213 20 0 HIADHN CC(C)COc1ccc(C(C)(C)C(=O)NCCCCN2C[C@H](C)O[C@@H](C)C2)cc1 ZINC000443648810 868243387 /nfs/dbraw/zinc/24/33/87/868243387.db2.gz FOMWTBSOSCQJMJ-PMACEKPBSA-N 0 3 404.595 4.005 20 0 HIADHN CSc1ccc(Cl)cc1NC(=O)C(=O)N[C@H](C)[C@H](c1ccccc1C)N(C)C ZINC000443840904 868371323 /nfs/dbraw/zinc/37/13/23/868371323.db2.gz YTRRGJRZKAZZRO-AUUYWEPGSA-N 0 3 419.978 4.116 20 0 HIADHN CSc1cccc(N(C(=O)[C@@H]2Cc3cc(C)c(C)cc3O2)C2CCN(C)CC2)c1 ZINC000443876870 868407308 /nfs/dbraw/zinc/40/73/08/868407308.db2.gz AMUOIKKVVPQFLU-QHCPKHFHSA-N 0 3 410.583 4.456 20 0 HIADHN Cn1c2ccc(F)cc2nc1NC(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000443974511 868503338 /nfs/dbraw/zinc/50/33/38/868503338.db2.gz VBOBURNSNCTWJD-HXUWFJFHSA-N 0 3 420.410 4.106 20 0 HIADHN FC(F)(F)c1ncc(CN[C@@H]2CCN(c3ccc(Br)cc3)C2)s1 ZINC000443977618 868505699 /nfs/dbraw/zinc/50/56/99/868505699.db2.gz IYIJLUGJTORXLR-LLVKDONJSA-N 0 3 406.271 4.293 20 0 HIADHN COc1ccc(CNCc2ccc(F)c(CN(C)C)c2)c(OCc2cccnc2)c1 ZINC000444005343 868528816 /nfs/dbraw/zinc/52/88/16/868528816.db2.gz WLKBYMGUXCOAOC-UHFFFAOYSA-N 0 3 409.505 4.160 20 0 HIADHN O=C(CN(C[C@H]1CCCO1)C1CCCC1)N1CC=C(c2c[nH]c3ccccc32)CC1 ZINC000444191044 868658692 /nfs/dbraw/zinc/65/86/92/868658692.db2.gz HTDYETVSNUYVBJ-OAQYLSRUSA-N 0 3 407.558 4.207 20 0 HIADHN CCCN(CC(=O)Nc1c(C)nn(-c2ccc(C)cc2)c1C)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000444232243 868680246 /nfs/dbraw/zinc/68/02/46/868680246.db2.gz OVAIOYOFLZWFJK-TUACAJSNSA-N 0 3 424.589 4.262 20 0 HIADHN COc1cc(NC(=O)CN(C)[C@@H]2CCC[C@H]2c2ccc(C)cc2)cc(OC)c1OC ZINC000444237735 868687641 /nfs/dbraw/zinc/68/76/41/868687641.db2.gz JCDSFVLOTIOWOM-VQTJNVASSA-N 0 3 412.530 4.227 20 0 HIADHN FC(F)(F)Cc1noc(CN2CCN(Cc3ccccc3)C3(CCCCC3)C2)n1 ZINC000444397611 868809493 /nfs/dbraw/zinc/80/94/93/868809493.db2.gz DMJMJGFCXMMRIQ-UHFFFAOYSA-N 0 3 408.468 4.195 20 0 HIADHN COc1ccc(CN(C)C[C@@H](O)CO[C@H](c2ccccc2)c2ccc(C)cc2)cc1O ZINC000444401480 868812218 /nfs/dbraw/zinc/81/22/18/868812218.db2.gz GQJJVQXCJYXQCG-ZEQKJWHPSA-N 0 3 421.537 4.308 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)[C@H]1C[C@H]1c1ccccc1C(F)(F)F ZINC000444448151 868831994 /nfs/dbraw/zinc/83/19/94/868831994.db2.gz BKUHFASFFSBQOL-PMACEKPBSA-N 0 3 418.459 4.404 20 0 HIADHN Cc1nc(-c2ccccc2)sc1C(=O)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000444449467 868833124 /nfs/dbraw/zinc/83/31/24/868833124.db2.gz MPOBRKGMGPZOIC-UHFFFAOYSA-N 0 3 407.539 4.328 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)[C@H](OC1CCCC1)c1ccccc1 ZINC000444461207 868836944 /nfs/dbraw/zinc/83/69/44/868836944.db2.gz PYKAAMVNJHGUHI-XMMPIXPASA-N 0 3 408.542 4.282 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)c1cc(-c2ccc(Cl)s2)on1 ZINC000444460627 868837116 /nfs/dbraw/zinc/83/71/16/868837116.db2.gz LDCPTFFVPIUNOF-UHFFFAOYSA-N 0 3 417.918 4.266 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1ccc(Cl)c2cccnc12 ZINC000444533940 868872193 /nfs/dbraw/zinc/87/21/93/868872193.db2.gz FOGUWPUWKUNMEA-UHFFFAOYSA-N 0 3 409.917 4.345 20 0 HIADHN Cc1cc(Cl)ccc1O[C@@H](C)C(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000444538197 868873975 /nfs/dbraw/zinc/87/39/75/868873975.db2.gz BDZYOMGMXYGYDC-KRWDZBQOSA-N 0 3 416.949 4.259 20 0 HIADHN CCCOc1ccc(CCC(=O)Nc2cccc(CN3CCC(CO)CC3)c2)cc1 ZINC000444543599 868875816 /nfs/dbraw/zinc/87/58/16/868875816.db2.gz FQVZXHXVIUQNJI-UHFFFAOYSA-N 0 3 410.558 4.251 20 0 HIADHN CCCN(CC)c1ccc(C(=O)Nc2cccc(CN3CCC(CO)CC3)c2)cc1 ZINC000444543194 868875995 /nfs/dbraw/zinc/87/59/95/868875995.db2.gz JAWDWCIIOCTPLM-UHFFFAOYSA-N 0 3 409.574 4.380 20 0 HIADHN Cc1cccc(OCCCCC(=O)Nc2cccc(CN3CCC(CO)CC3)c2)c1 ZINC000444545359 868876655 /nfs/dbraw/zinc/87/66/55/868876655.db2.gz GVMICTROQPEEKQ-UHFFFAOYSA-N 0 3 410.558 4.387 20 0 HIADHN CCOc1cc(N2CCOC(C)(C)C2)ccc1NC(=O)[C@@H]1CCCN1C1CCCC1 ZINC000444545152 868876971 /nfs/dbraw/zinc/87/69/71/868876971.db2.gz LBVJPTMRGXMRPD-NRFANRHFSA-N 0 3 415.578 4.046 20 0 HIADHN O=C(CSc1ccccc1Cl)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000444555351 868880353 /nfs/dbraw/zinc/88/03/53/868880353.db2.gz TWNQACRJTADTER-UHFFFAOYSA-N 0 3 404.963 4.275 20 0 HIADHN Cc1ccc2nc(C)c(C(=O)Nc3cccc(CN4CCC(CO)CC4)c3)cc2c1 ZINC000444563304 868883897 /nfs/dbraw/zinc/88/38/97/868883897.db2.gz QBXVJCBSJGYTNF-UHFFFAOYSA-N 0 3 403.526 4.308 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)NC(=O)NC[C@@H](c2ccc(C)cc2)N(C)C)cc1 ZINC000444581694 868889087 /nfs/dbraw/zinc/88/90/87/868889087.db2.gz HFJZDJQPCHSRAZ-MBSDFSHPSA-N 0 3 405.546 4.152 20 0 HIADHN C[C@@H](N[C@@H]1CC(C)(C)OC1(C)C)C(=O)Nc1ccc(NC(=O)c2cccs2)cc1 ZINC000444644633 868928891 /nfs/dbraw/zinc/92/88/91/868928891.db2.gz WMHDXYAYDUVZGI-RDTXWAMCSA-N 0 3 415.559 4.263 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)NCc1cccc(-c2cccnc2)c1 ZINC000468317507 882245031 /nfs/dbraw/zinc/24/50/31/882245031.db2.gz DAQZQGGOSLCSDS-UHFFFAOYSA-N 0 3 406.505 4.161 20 0 HIADHN COCCN1CCC(NC(=O)N([C@H](C)c2cccc(C(F)(F)F)c2)C2CC2)CC1 ZINC000444694752 868961241 /nfs/dbraw/zinc/96/12/41/868961241.db2.gz DBUIUUUAKSPDHI-OAHLLOKOSA-N 0 3 413.484 4.051 20 0 HIADHN CC(C)[C@H]1CCCN(CC(=O)N(Cc2nnc(-c3ccccc3Cl)o2)C2CC2)C1 ZINC000444753921 868987221 /nfs/dbraw/zinc/98/72/21/868987221.db2.gz RJZREJFDMRPPLJ-INIZCTEOSA-N 0 3 416.953 4.249 20 0 HIADHN CC(C)N(Cc1ccccc1)C(=O)[C@H](C)N1CCC(CO)(Cc2ccccc2)CC1 ZINC000444780359 868999562 /nfs/dbraw/zinc/99/95/62/868999562.db2.gz DVXPJLYOGTZYPL-QFIPXVFZSA-N 0 3 408.586 4.129 20 0 HIADHN CN(C)CCN(C(=O)NCc1cccc(COCc2ccccc2)c1)C1CCCC1 ZINC000468326161 882257206 /nfs/dbraw/zinc/25/72/06/882257206.db2.gz GXEIDOBRWRLVOL-UHFFFAOYSA-N 0 3 409.574 4.419 20 0 HIADHN CCN1CCC[C@@H](CN(C)C(=O)Nc2cc3[nH]ccc3cc2C)[C@@H]1c1cnn(C)c1 ZINC000445020935 869171482 /nfs/dbraw/zinc/17/14/82/869171482.db2.gz PDJGXDMRTNJKNT-PGRDOPGGSA-N 0 3 408.550 4.147 20 0 HIADHN C[C@@H](NC(=O)N[C@@H](CN1CCCC1)c1ccccc1)c1cccc(N2CCCC2)c1 ZINC000445503064 869568400 /nfs/dbraw/zinc/56/84/00/869568400.db2.gz JGZBIAALBILMCR-YKSBVNFPSA-N 0 3 406.574 4.484 20 0 HIADHN c1ccc2c(c1)ccnc2Cc1noc(-c2ccc(CN3CCSCC3)cc2)n1 ZINC000445511150 869574066 /nfs/dbraw/zinc/57/40/66/869574066.db2.gz HRHCTPOKEKASDV-UHFFFAOYSA-N 0 3 402.523 4.424 20 0 HIADHN COc1cc(OC)cc(N2CC[C@@H](N(C)CC3CCC(C(F)(F)F)CC3)C2=O)c1 ZINC000468391571 882337241 /nfs/dbraw/zinc/33/72/41/882337241.db2.gz FMXPDNBVXQTNFT-JFIBYHEFSA-N 0 3 414.468 4.110 20 0 HIADHN O=C(Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)C1(Cc2ccc(F)cc2)CC1 ZINC000445782562 869821215 /nfs/dbraw/zinc/82/12/15/869821215.db2.gz JIFRLIYALFUIAJ-QFIPXVFZSA-N 0 3 418.516 4.431 20 0 HIADHN CC(C)(COc1ncccc1C(F)(F)F)NCc1cncn1Cc1ccccc1 ZINC000445806379 869832880 /nfs/dbraw/zinc/83/28/80/869832880.db2.gz VGXINGCJLOYPDL-UHFFFAOYSA-N 0 3 404.436 4.292 20 0 HIADHN COc1cccc(NC(=O)CCN(C)[C@@H]2CCOc3ccc(Br)cc32)c1 ZINC000445877988 869869041 /nfs/dbraw/zinc/86/90/41/869869041.db2.gz DPVYKRWGOJEMIG-GOSISDBHSA-N 0 3 419.319 4.242 20 0 HIADHN O=C(Cc1cccc(C(F)F)c1)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000468412821 882356216 /nfs/dbraw/zinc/35/62/16/882356216.db2.gz WQCRPCDUDUPVQN-FQEVSTJZSA-N 0 3 410.468 4.449 20 0 HIADHN O=C(Cc1ccc(Cl)c(F)c1)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000468412353 882356418 /nfs/dbraw/zinc/35/64/18/882356418.db2.gz SBHCXFXNYXRQDR-GOSISDBHSA-N 0 3 412.896 4.304 20 0 HIADHN CN(C)C(=O)Cc1nc(CN[C@H]2CCC[C@@H]2c2ccccc2C(F)(F)F)cs1 ZINC000446002196 869965509 /nfs/dbraw/zinc/96/55/09/869965509.db2.gz NPXWWKCYALNTKK-WBVHZDCISA-N 0 3 411.493 4.219 20 0 HIADHN CCC[C@]1(COC)CCCN1C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000446114728 870060311 /nfs/dbraw/zinc/06/03/11/870060311.db2.gz VNRIKSJSWIPGBU-JOCHJYFZSA-N 0 3 405.608 4.091 20 0 HIADHN CCCc1c(NC(=O)N(CCN(C)C)Cc2ccco2)cnn1-c1cccc(C)c1 ZINC000446401116 870302821 /nfs/dbraw/zinc/30/28/21/870302821.db2.gz TVXUGGUZMRBEKL-UHFFFAOYSA-N 0 3 409.534 4.322 20 0 HIADHN Cc1cc(-c2cc(C(=O)N(CCN(C)C)Cc3ccco3)c3c(C)noc3n2)c(C)o1 ZINC000446422782 870335094 /nfs/dbraw/zinc/33/50/94/870335094.db2.gz OIJMDOWSDVKVTG-UHFFFAOYSA-N 0 3 422.485 4.205 20 0 HIADHN CC(C)CC(=O)Nc1ccc(Cl)c(C(=O)N(CCN(C)C)Cc2ccco2)c1 ZINC000446425939 870341167 /nfs/dbraw/zinc/34/11/67/870341167.db2.gz WNVHZJCPBALUIV-UHFFFAOYSA-N 0 3 405.926 4.122 20 0 HIADHN COc1cccc([C@H](CNC(=O)N[C@@H](CC(F)(F)F)C(C)C)N2CCCC2)c1 ZINC000446569787 870481978 /nfs/dbraw/zinc/48/19/78/870481978.db2.gz SBFHVSONTGWTQN-ROUUACIJSA-N 0 3 401.473 4.108 20 0 HIADHN COc1ccc2c(c1)[C@H](NCCCS(=O)(=O)Cc1ccccc1)CCCS2 ZINC000446747804 870656728 /nfs/dbraw/zinc/65/67/28/870656728.db2.gz IKIBSOXMXZWKED-HXUWFJFHSA-N 0 3 405.585 4.217 20 0 HIADHN Cc1ccc([C@@H](CCn2cncn2)NCc2cccc(NC(=O)CC(C)C)c2)cc1 ZINC000446755559 870665578 /nfs/dbraw/zinc/66/55/78/870665578.db2.gz WMHONZJDVWTONC-HSZRJFAPSA-N 0 3 405.546 4.492 20 0 HIADHN COc1ccc([C@@H](CCn2cncn2)NCc2cc(Br)cs2)cc1 ZINC000446756254 870668589 /nfs/dbraw/zinc/66/85/89/870668589.db2.gz GDCSBSPOARHQCK-QGZVFWFLSA-N 0 3 407.337 4.032 20 0 HIADHN Cc1ccc([C@H](CN[C@@H](C)c2ccc(Br)cc2F)N2CCOCC2)o1 ZINC000446759971 870673711 /nfs/dbraw/zinc/67/37/11/870673711.db2.gz RIYWXFITMCBZDO-KSSFIOAISA-N 0 3 411.315 4.214 20 0 HIADHN C[C@@H](NCCC(=O)N1CCc2sccc2C1)c1ccc(Br)cc1F ZINC000446834532 870750707 /nfs/dbraw/zinc/75/07/07/870750707.db2.gz KUFWTMWJJQIRAF-GFCCVEGCSA-N 0 3 411.340 4.275 20 0 HIADHN COC(=O)c1ccc(CNC2(c3cccc(OC(F)(F)F)c3)CCOCC2)cc1 ZINC000446845494 870765258 /nfs/dbraw/zinc/76/52/58/870765258.db2.gz NEHSTNQTWPRPJO-UHFFFAOYSA-N 0 3 409.404 4.167 20 0 HIADHN Cc1cccc(-n2ncc(C(=O)NC[C@@H]3N(C)CCCC3(C)C)c2C(F)(F)F)c1 ZINC000468480849 882447505 /nfs/dbraw/zinc/44/75/05/882447505.db2.gz NMWWYYNBPRXFOT-KRWDZBQOSA-N 0 3 408.468 4.050 20 0 HIADHN Cc1ccc(CN[C@@H](C)CC(=O)Nc2ccccc2C(C)C)cc1S(C)(=O)=O ZINC000446898926 870817342 /nfs/dbraw/zinc/81/73/42/870817342.db2.gz OLFTUBPOIQPWQG-KRWDZBQOSA-N 0 3 402.560 4.029 20 0 HIADHN COc1ccc([C@H](CCn2cncn2)N[C@@H]2CC(C)(C)Oc3cc(F)ccc32)cc1 ZINC000446924193 870838230 /nfs/dbraw/zinc/83/82/30/870838230.db2.gz DJFZNJYAKSJRGH-LEWJYISDSA-N 0 3 410.493 4.449 20 0 HIADHN Cc1cc(CN2CCC[C@H]([C@H](O)C(F)(F)F)C2)cc(C)c1OCc1ccccn1 ZINC000446974531 870872408 /nfs/dbraw/zinc/87/24/08/870872408.db2.gz JFWCDEQVCARULT-RXVVDRJESA-N 0 3 408.464 4.413 20 0 HIADHN COC(=O)[C@@](C)(CN[C@H](C)C(=O)Nc1cccc2ccccc21)c1ccc(F)cc1 ZINC000447019910 870895834 /nfs/dbraw/zinc/89/58/34/870895834.db2.gz ZEEGTZMYXFABPN-GYCJOSAFSA-N 0 3 408.473 4.026 20 0 HIADHN COC1(CO)CCN(Cc2cn(-c3ccccc3)nc2-c2cccc(Cl)c2)CC1 ZINC000447067899 870948356 /nfs/dbraw/zinc/94/83/56/870948356.db2.gz MNANWIIPKRORLE-UHFFFAOYSA-N 0 3 411.933 4.166 20 0 HIADHN CN(Cc1cc(C(C)(C)C)n[nH]1)C(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000447073641 870954377 /nfs/dbraw/zinc/95/43/77/870954377.db2.gz XNZJWEVQYMSUBN-OAQYLSRUSA-N 0 3 422.495 4.120 20 0 HIADHN COc1cc(OC)c(NC(=O)N(CCN(C)C)Cc2cccc(Cl)c2)cc1F ZINC000447127653 871029040 /nfs/dbraw/zinc/02/90/40/871029040.db2.gz FIJJOBHMHWQJTF-UHFFFAOYSA-N 0 3 409.889 4.092 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)N[C@H]1CCCc2cc(OC(F)F)ccc21 ZINC000447382039 871287136 /nfs/dbraw/zinc/28/71/36/871287136.db2.gz IACWCWXPMKRAFE-IBGZPJMESA-N 0 3 407.461 4.032 20 0 HIADHN COC(=O)c1coc([C@H](C)NC2CCN(Cc3cccc(C(F)(F)F)c3)CC2)c1 ZINC000447554203 871436625 /nfs/dbraw/zinc/43/66/25/871436625.db2.gz ZJTRXDOWFOMLOW-AWEZNQCLSA-N 0 3 410.436 4.400 20 0 HIADHN O=C(c1ccc(F)cc1)C1CCN(C(=O)[C@H]2CCCN(Cc3ccccc3)C2)CC1 ZINC000447710627 871651180 /nfs/dbraw/zinc/65/11/80/871651180.db2.gz QWMQXECRSYSMJP-QFIPXVFZSA-N 0 3 408.517 4.159 20 0 HIADHN O=C(NC[C@H]1CCCN(c2ccccc2)C1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000447735226 871687084 /nfs/dbraw/zinc/68/70/84/871687084.db2.gz CGYBEVJWVHCRMI-FGZHOGPDSA-N 0 3 409.549 4.071 20 0 HIADHN CCCN(Cc1cnc(C(F)(F)F)s1)C1CCN(c2cc(C)nc(C)n2)CC1 ZINC000447746563 871692610 /nfs/dbraw/zinc/69/26/10/871692610.db2.gz QFFPNDOEKGTJLH-UHFFFAOYSA-N 0 3 413.513 4.450 20 0 HIADHN CCC(CC)(CN[C@@H](C)C(=O)Nc1ccc(Cl)cc1C(F)(F)F)C(=O)OC ZINC000447890528 871803301 /nfs/dbraw/zinc/80/33/01/871803301.db2.gz LTENUEADSWLJPV-NSHDSACASA-N 0 3 408.848 4.255 20 0 HIADHN C[C@@H]1OCC[C@]1(O)CN(Cc1ccccc1)Cc1ccccc1OCC(F)(F)F ZINC000447929742 871816803 /nfs/dbraw/zinc/81/68/03/871816803.db2.gz UWFFRNREDZFHSN-UWJYYQICSA-N 0 3 409.448 4.170 20 0 HIADHN Cc1cc(Br)ccc1NC(=O)CCNCc1ccnn1-c1ccccc1 ZINC000447932245 871817212 /nfs/dbraw/zinc/81/72/12/871817212.db2.gz QIOKJSIITOXYFZ-UHFFFAOYSA-N 0 3 413.319 4.062 20 0 HIADHN CO[C@H]1CCOc2c(NC(=O)N[C@@H](CN(C)Cc3ccccc3)C(C)C)cccc21 ZINC000448052633 871883095 /nfs/dbraw/zinc/88/30/95/871883095.db2.gz DJPJWTDEQLAWQI-VXKWHMMOSA-N 0 3 411.546 4.435 20 0 HIADHN Cc1cc(NC(=O)c2cnc(C(C)C)s2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000448252307 872169382 /nfs/dbraw/zinc/16/93/82/872169382.db2.gz NVMRHPGOGFCUBJ-SFHVURJKSA-N 0 3 409.559 4.471 20 0 HIADHN O=C(C[C@H]1CCCN1C(=O)C1CCN(Cc2ccccc2)CC1)c1ccc(F)cc1 ZINC000448440486 872385243 /nfs/dbraw/zinc/38/52/43/872385243.db2.gz RPHJRSKKSHOXPC-HSZRJFAPSA-N 0 3 408.517 4.302 20 0 HIADHN Cc1cc(C[C@@H](C)NC(=O)c2cccc(CN3CCCC3)c2)n(-c2ccccc2)n1 ZINC000448445785 872388769 /nfs/dbraw/zinc/38/87/69/872388769.db2.gz ITAALPBZWRZMEI-LJQANCHMSA-N 0 3 402.542 4.138 20 0 HIADHN CCN(C(=O)Nc1cccc(N2CCCCC2=O)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000460129594 872612188 /nfs/dbraw/zinc/61/21/88/872612188.db2.gz QYRFRLAEZTVAMO-QHCPKHFHSA-N 0 3 420.557 4.332 20 0 HIADHN C[C@@H](C(=O)Nc1ccc(C(=O)N(C)[C@@H]2CCCN(C)C2)cc1)c1cccc(Cl)c1 ZINC000460215269 872801293 /nfs/dbraw/zinc/80/12/93/872801293.db2.gz JMZMZTPRWCXABN-IIBYNOLFSA-N 0 3 413.949 4.248 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)c1cc(-c2ccccc2)ns1 ZINC000468579580 882655047 /nfs/dbraw/zinc/65/50/47/882655047.db2.gz RVJPFTPRMLSNFG-UHFFFAOYSA-N 0 3 420.582 4.142 20 0 HIADHN CCCN(CCN1CCN(CC)CC1)C(=O)N[C@@H](C)c1cccc(Cl)c1Cl ZINC000460318004 872907170 /nfs/dbraw/zinc/90/71/70/872907170.db2.gz AYOOYLVGHOWDFS-INIZCTEOSA-N 0 3 415.409 4.114 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)N2CCCC[C@@H]2c2nnc(C3CCC3)o2)CN1Cc1ccccc1 ZINC000460366426 873001286 /nfs/dbraw/zinc/00/12/86/873001286.db2.gz ZMNPZZQEQZYMGP-JRGCBEDISA-N 0 3 423.561 4.237 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)NC[C@H](C)Oc3cccc(Cl)c3)cc2)CC1 ZINC000460452566 873129419 /nfs/dbraw/zinc/12/94/19/873129419.db2.gz QYGUJRXYYLRRTP-SFHVURJKSA-N 0 3 415.965 4.068 20 0 HIADHN CCOC(=O)c1csc(CCNCc2ccc(Br)cc2Cl)n1 ZINC000468596870 882691644 /nfs/dbraw/zinc/69/16/44/882691644.db2.gz IPBXFLWECSZKKM-UHFFFAOYSA-N 0 3 403.729 4.068 20 0 HIADHN C[C@@H](CN(C)Cc1ccccc1)NC(=O)N1CCCC[C@H]1c1nnc(C2CCC2)o1 ZINC000460648649 873390028 /nfs/dbraw/zinc/39/00/28/873390028.db2.gz MBJXPPMDQFGKLH-PXNSSMCTSA-N 0 3 411.550 4.094 20 0 HIADHN Cc1cc(C)c(Br)c(C(=O)NCCCN2CCc3ccccc3C2)c1 ZINC000460695235 873462339 /nfs/dbraw/zinc/46/23/39/873462339.db2.gz HFIZDDQXNQMPQH-UHFFFAOYSA-N 0 3 401.348 4.244 20 0 HIADHN Cc1cc(C)c(Br)c(C(=O)N(Cc2ccco2)C2CCN(C)CC2)c1 ZINC000460760607 873601896 /nfs/dbraw/zinc/60/18/96/873601896.db2.gz UDFRQYZDXVVEAJ-UHFFFAOYSA-N 0 3 405.336 4.396 20 0 HIADHN C[C@H]1CCC[C@H]1CNC(=O)N(Cc1ccccc1Br)C1CCN(C)CC1 ZINC000460772357 873622538 /nfs/dbraw/zinc/62/25/38/873622538.db2.gz XWCRFNFBUQAXMT-IRXDYDNUSA-N 0 3 422.411 4.491 20 0 HIADHN CC(C)c1nc(C(=O)NC[C@H](c2ccccc2)N2CCCC2)nn1-c1ccccc1F ZINC000460808241 873684541 /nfs/dbraw/zinc/68/45/41/873684541.db2.gz XEPZHWTVWJRGEN-OAQYLSRUSA-N 0 3 421.520 4.097 20 0 HIADHN COc1ccc2sc(C(=O)N3CCC(CN4C[C@@H](C)O[C@H](C)C4)CC3)c(C)c2c1 ZINC000460862469 873766337 /nfs/dbraw/zinc/76/63/37/873766337.db2.gz JSEWWDXVFAVYKT-HZPDHXFCSA-N 0 3 416.587 4.180 20 0 HIADHN CC1CCN([C@H](CNC(=O)[C@H]2C[C@@H]2c2ccc3c(c2)OCCO3)c2ccccc2)CC1 ZINC000460967218 873863678 /nfs/dbraw/zinc/86/36/78/873863678.db2.gz YQHCWOFLXPETAK-XPWALMASSA-N 0 3 420.553 4.151 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N1CCCC[C@@H]1c1nnc(C2CCC2)o1)c1ccco1 ZINC000461025679 873891609 /nfs/dbraw/zinc/89/16/09/873891609.db2.gz MGAPMSTVTTUUFI-RYQLBKOJSA-N 0 3 415.538 4.296 20 0 HIADHN C[C@@H]1C[C@@H](c2cccc(F)c2)N(C(=O)CCCN2CCN(c3ccccc3)CC2)C1 ZINC000461320681 874328998 /nfs/dbraw/zinc/32/89/98/874328998.db2.gz YQTARLUUGASOGJ-YKSBVNFPSA-N 0 3 409.549 4.338 20 0 HIADHN CN(Cc1nnc(-c2cc3c(s2)CCCC3)o1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000461385106 874391124 /nfs/dbraw/zinc/39/11/24/874391124.db2.gz QQTWGBYRCCZYKE-LJQANCHMSA-N 0 3 408.571 4.383 20 0 HIADHN CN(C)Cc1cccc(C(=O)NCc2nc3c(s2)C[C@H](c2ccccc2)CC3)c1 ZINC000468723513 882829675 /nfs/dbraw/zinc/82/96/75/882829675.db2.gz GKZXLODUCJVUSL-LJQANCHMSA-N 0 3 405.567 4.407 20 0 HIADHN CCOc1ccc(C(=O)CCC(=O)N2C[C@H]3CCN(Cc4ccccc4)C[C@H]3C2)cc1 ZINC000461426924 874462661 /nfs/dbraw/zinc/46/26/61/874462661.db2.gz FKWBECBBEODLHG-PKTZIBPZSA-N 0 3 420.553 4.029 20 0 HIADHN CCCc1c(C(=O)N2C[C@@H]3CCN(Cc4ccccc4)C[C@H]3C2)[nH]c(C)c1C(C)=O ZINC000461443858 874498770 /nfs/dbraw/zinc/49/87/70/874498770.db2.gz CAICHQJOYZBBQB-SFTDATJTSA-N 0 3 407.558 4.072 20 0 HIADHN CC[C@H](CN(C)C(=O)N[C@@H](C)C1=CCN(C)CC1)Oc1ccc(Cl)c(Cl)c1 ZINC000468745764 882839829 /nfs/dbraw/zinc/83/98/29/882839829.db2.gz WEIHURNFXBBTLN-GOEBONIOSA-N 0 3 414.377 4.443 20 0 HIADHN CCCN(C(=O)NCC[C@H](OC)C(F)(F)F)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000468768562 882851492 /nfs/dbraw/zinc/85/14/92/882851492.db2.gz APZXKUJGPLKQEQ-OALUTQOASA-N 0 3 415.500 4.040 20 0 HIADHN CCN1C[C@H](C)N(c2nnc(-c3cccc4ccccc43)n2C[C@H]2CCOC2)C[C@@H]1C ZINC000461704898 874854109 /nfs/dbraw/zinc/85/41/09/874854109.db2.gz RRTXQOAOHRCUGH-SLFFLAALSA-N 0 3 419.573 4.054 20 0 HIADHN CCN1C[C@H](C)N(c2nnc(-c3cccc4ccccc43)n2C[C@@H]2CCOC2)C[C@H]1C ZINC000461704894 874854397 /nfs/dbraw/zinc/85/43/97/874854397.db2.gz RRTXQOAOHRCUGH-AABGKKOBSA-N 0 3 419.573 4.054 20 0 HIADHN CCc1nc2c(s1)[C@@H](N[C@H]1CCCN(Cc3ccc(F)cc3F)C1=O)CCC2 ZINC000468812424 882871673 /nfs/dbraw/zinc/87/16/73/882871673.db2.gz CFYNLJHZJFUWAV-WMZOPIPTSA-N 0 3 405.514 4.142 20 0 HIADHN CCn1c2ccccc2nc1[C@@H]1CCCN1C(=O)N[C@H](C)CN(C)Cc1ccccc1 ZINC000461731965 874878321 /nfs/dbraw/zinc/87/83/21/874878321.db2.gz VLQZTAHEDOKKLH-XXBNENTESA-N 0 3 419.573 4.423 20 0 HIADHN CCn1c2ccccc2nc1[C@H]1CCCN1C(=O)N[C@H](C)CN(C)Cc1ccccc1 ZINC000461731964 874878486 /nfs/dbraw/zinc/87/84/86/874878486.db2.gz VLQZTAHEDOKKLH-AUSIDOKSSA-N 0 3 419.573 4.423 20 0 HIADHN Cc1c([C@H](C)N[C@H](C)c2cc(F)ccc2N2CCN(C)CC2)cnn1C(C)(C)C ZINC000468835339 882883294 /nfs/dbraw/zinc/88/32/94/882883294.db2.gz FVZXNUXIINEJGY-SJORKVTESA-N 0 3 401.574 4.249 20 0 HIADHN CC(C)c1nnc(N2C[C@H](C)N(Cc3ccccc3)C[C@@H]2C)n1C[C@@H]1CCCCO1 ZINC000461874943 875028882 /nfs/dbraw/zinc/02/88/82/875028882.db2.gz MBZSREWPJGZTMP-ONTIZHBOSA-N 0 3 411.594 4.070 20 0 HIADHN Cc1cc(NC(=O)CCN2CCN(c3ccccc3)CC2)ccc1Oc1cccnc1 ZINC000461988408 875108074 /nfs/dbraw/zinc/10/80/74/875108074.db2.gz NMMNBFDVYVWAQF-UHFFFAOYSA-N 0 3 416.525 4.333 20 0 HIADHN O=C(NC[C@H]1CCCN1Cc1ccccc1)N[C@@H]1CCCc2cn(C3CCCC3)nc21 ZINC000461996659 875117347 /nfs/dbraw/zinc/11/73/47/875117347.db2.gz QYKPFRGNRGTUPP-DHIUTWEWSA-N 0 3 421.589 4.339 20 0 HIADHN CC[C@@H](Cc1ccccc1)N(CC)CC(=O)N1CCC(C(=O)Nc2ccccc2)CC1 ZINC000468868514 882899208 /nfs/dbraw/zinc/89/92/08/882899208.db2.gz GVKVDCKPAHGXJW-DEOSSOPVSA-N 0 3 421.585 4.207 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)N(C)[C@@H](C)c3ccc(F)c(F)c3)CC2)c1 ZINC000462030307 875145886 /nfs/dbraw/zinc/14/58/86/875145886.db2.gz ALXQCDYTOUGSMU-SFHVURJKSA-N 0 3 401.501 4.005 20 0 HIADHN Cc1ccc(S(=O)(=O)N2CCC(N[C@@H](C)c3nc(C(C)(C)C)cs3)CC2)cc1 ZINC000462044561 875156109 /nfs/dbraw/zinc/15/61/09/875156109.db2.gz FYSMQEILLJFGBU-INIZCTEOSA-N 0 3 421.632 4.253 20 0 HIADHN Cc1ccccc1-c1cc(NC(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)n(C)n1 ZINC000462088530 875198619 /nfs/dbraw/zinc/19/86/19/875198619.db2.gz NFQSMEPUBFQHQT-QUCCMNQESA-N 0 3 403.530 4.353 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)C1(c2cccc(Cl)c2)CCOCC1 ZINC000462162028 875257047 /nfs/dbraw/zinc/25/70/47/875257047.db2.gz ZKJDZPWDHYSKRK-XMSQKQJNSA-N 0 3 412.961 4.025 20 0 HIADHN CC[C@]1(CNC(=O)N(Cc2ccccc2)C2CCN(C)CC2)OCCc2ccccc21 ZINC000462167000 875263274 /nfs/dbraw/zinc/26/32/74/875263274.db2.gz NNRCQKFFHOSIAD-AREMUKBSSA-N 0 3 421.585 4.171 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)CSCc1coc(-c2ccccc2)n1 ZINC000462173465 875269437 /nfs/dbraw/zinc/26/94/37/875269437.db2.gz CSBRVRNMYBPSCF-AVRDEDQJSA-N 0 3 421.566 4.212 20 0 HIADHN Cc1cc(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)ccc1NC(=O)CC(C)C ZINC000462172776 875269895 /nfs/dbraw/zinc/26/98/95/875269895.db2.gz XTNNTHCLOQMVST-AUSIDOKSSA-N 0 3 407.558 4.230 20 0 HIADHN Cc1ccc(-c2cnc(CCC(=O)N[C@H]3CN(Cc4ccccc4)C[C@@H]3C)o2)cc1 ZINC000462181322 875281316 /nfs/dbraw/zinc/28/13/16/875281316.db2.gz JVCWZFSSFDGIKX-UGKGYDQZSA-N 0 3 403.526 4.219 20 0 HIADHN CC(C)CC(=O)Nc1ccc(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)cc1F ZINC000462188571 875291739 /nfs/dbraw/zinc/29/17/39/875291739.db2.gz NSDNFUJKKCXMCR-VGOFRKELSA-N 0 3 411.521 4.061 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)CCc1ncc(-c2ccccc2F)o1 ZINC000462189606 875293077 /nfs/dbraw/zinc/29/30/77/875293077.db2.gz OGEDUJPCUMMVBI-UWJYYQICSA-N 0 3 407.489 4.050 20 0 HIADHN Cc1ccc(-c2nc(CC(=O)N[C@H]3CN(Cc4ccccc4)C[C@@H]3C)cs2)cc1 ZINC000462189608 875293387 /nfs/dbraw/zinc/29/33/87/875293387.db2.gz OHNLXSIUYNRFNK-AVRDEDQJSA-N 0 3 405.567 4.298 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C)c1nc(C(C)(C)C)cs1 ZINC000462191427 875298333 /nfs/dbraw/zinc/29/83/33/875298333.db2.gz SINFKXCLEBEZKS-XYJFISCASA-N 0 3 400.592 4.321 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C1(c2ccc(Cl)cc2)CCOCC1 ZINC000462195774 875305062 /nfs/dbraw/zinc/30/50/62/875305062.db2.gz MQGYETCWVSPWQX-AVRDEDQJSA-N 0 3 412.961 4.025 20 0 HIADHN C[C@@H]1CCCN(c2cc(C(=O)N(C)[C@@H]3CCCN(Cc4ccccc4)C3)ccn2)C1 ZINC000462196789 875305547 /nfs/dbraw/zinc/30/55/47/875305547.db2.gz BGTPZNZABHHBJI-NFBKMPQASA-N 0 3 406.574 4.055 20 0 HIADHN C[C@@H]1CC[C@H](C)N1CC(=O)Nc1ccc(CC(=O)N2CCCc3ccccc32)cc1 ZINC000468883952 882922044 /nfs/dbraw/zinc/92/20/44/882922044.db2.gz FXVROIDRROHUHZ-KDURUIRLSA-N 0 3 405.542 4.020 20 0 HIADHN CN(C(=O)NC[C@H](Cc1ccccc1)C(F)(F)F)[C@H]1CCN(Cc2ccccc2)C1 ZINC000462223617 875332399 /nfs/dbraw/zinc/33/23/99/875332399.db2.gz IULCTKFOOWWVAR-SFTDATJTSA-N 0 3 419.491 4.324 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)NC[C@@H](Cc2ccccc2)C(F)(F)F)o1 ZINC000462226888 875335711 /nfs/dbraw/zinc/33/57/11/875335711.db2.gz RHSQZGCDFWSETA-GOSISDBHSA-N 0 3 411.468 4.082 20 0 HIADHN CC(C)CC(=O)Nc1ccc(NC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)cc1 ZINC000462241418 875356686 /nfs/dbraw/zinc/35/66/86/875356686.db2.gz ODOAAKPLKLRKAJ-XMSQKQJNSA-N 0 3 408.546 4.313 20 0 HIADHN Cc1nc(C(F)(F)F)sc1C(=O)N(CCN(C)C)Cc1cccc(Cl)c1 ZINC000462246561 875363424 /nfs/dbraw/zinc/36/34/24/875363424.db2.gz NLOFUTXTSGLKIW-UHFFFAOYSA-N 0 3 405.873 4.328 20 0 HIADHN COc1ccc(Br)c(NC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)c1 ZINC000462253585 875375016 /nfs/dbraw/zinc/37/50/16/875375016.db2.gz IEHBOGPSKOFJHJ-AUUYWEPGSA-N 0 3 418.335 4.100 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Nc1cccc(NC(=O)c2ccoc2)c1 ZINC000462256966 875380099 /nfs/dbraw/zinc/38/00/99/875380099.db2.gz UZYKQCJGJCRBHL-VGOFRKELSA-N 0 3 418.497 4.174 20 0 HIADHN CCCN1c2ccc(NC(=O)N[C@@H]3CN(Cc4ccccc4)C[C@@H]3C)cc2CCC1=O ZINC000462287326 875411087 /nfs/dbraw/zinc/41/10/87/875411087.db2.gz CVNDGHPVHGPQDZ-PGRDOPGGSA-N 0 3 420.557 4.018 20 0 HIADHN C[C@@H]1CN(C)CC[C@H]1N(C)S(=O)(=O)c1ccc(Oc2ccccc2Cl)cc1 ZINC000462358383 875471229 /nfs/dbraw/zinc/47/12/29/875471229.db2.gz LKQDWBAKUBUVBR-DNVCBOLYSA-N 0 3 408.951 4.093 20 0 HIADHN CCN(C(=O)c1ccnc(N2CCC[C@@H](C)C2)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000462491417 875602330 /nfs/dbraw/zinc/60/23/30/875602330.db2.gz RALMKBUZAWAZHB-NFBKMPQASA-N 0 3 406.574 4.055 20 0 HIADHN C[C@@H](NCc1cnn([C@]2(C)CCS(=O)(=O)C2)c1)c1ccc(Cl)c2ccccc21 ZINC000462527610 875644465 /nfs/dbraw/zinc/64/44/65/875644465.db2.gz SRUYVQCVOMFOOA-QVKFZJNVSA-N 0 3 417.962 4.074 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@@H]1CCO[C@H](c2ccccc2)C1)c1ccsc1 ZINC000462532313 875651763 /nfs/dbraw/zinc/65/17/63/875651763.db2.gz ZLVNPXUUYRTGAT-NJYVYQBISA-N 0 3 401.576 4.351 20 0 HIADHN CC(C)[C@@H](Oc1ccc(Cl)cc1)C(=O)N(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1 ZINC000462539010 875660322 /nfs/dbraw/zinc/66/03/22/875660322.db2.gz NALKNCIVVGUOHF-YUXAGFNASA-N 0 3 415.965 4.290 20 0 HIADHN CCCN1CCC(N(C)S(=O)(=O)c2ccc3nc(C(C)(C)C)sc3c2)CC1 ZINC000462550318 875676209 /nfs/dbraw/zinc/67/62/09/875676209.db2.gz KHGOSZYEZWBXCM-UHFFFAOYSA-N 0 3 409.621 4.089 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Nc1ccccc1CC(=O)OC(C)(C)C ZINC000462665223 875765931 /nfs/dbraw/zinc/76/59/31/875765931.db2.gz VZEMCAGMPVHDQA-XMSQKQJNSA-N 0 3 423.557 4.213 20 0 HIADHN COc1ccccc1O[C@@H](C)CNCc1cnn(-c2ccc(Br)cc2)c1 ZINC000462737577 875809908 /nfs/dbraw/zinc/80/99/08/875809908.db2.gz IMKGFZCOTBFUCE-HNNXBMFYSA-N 0 3 416.319 4.201 20 0 HIADHN FC(F)Oc1cc2c(cc1CNCCCOc1cccc3cccnc31)OCO2 ZINC000462749555 875816509 /nfs/dbraw/zinc/81/65/09/875816509.db2.gz JQNJNFCFGSHOOC-UHFFFAOYSA-N 0 3 402.397 4.124 20 0 HIADHN COc1cccc([C@H](CNC(=O)CCc2cncc3ccccc32)N2CCCC2)c1 ZINC000462765833 875827403 /nfs/dbraw/zinc/82/74/03/875827403.db2.gz USOCLBUZTVCWFR-DEOSSOPVSA-N 0 3 403.526 4.129 20 0 HIADHN Cc1ncn(-c2ccc(NC(=O)c3ccc(N4CCN(C(C)C)CC4)cc3)cc2)c1C ZINC000462780983 875836225 /nfs/dbraw/zinc/83/62/25/875836225.db2.gz XEWPBXLDZURXRB-UHFFFAOYSA-N 0 3 417.557 4.272 20 0 HIADHN C[C@@H]1CCCN(C(=O)C2CCN(Cc3ccc(C(=O)OC(C)(C)C)cc3)CC2)C1 ZINC000462795581 875844673 /nfs/dbraw/zinc/84/46/73/875844673.db2.gz CUNXEKCHIKGYSO-GOSISDBHSA-N 0 3 400.563 4.112 20 0 HIADHN CCc1ccc([C@H](NC[C@](C)(OC)C2CC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000462811506 875854622 /nfs/dbraw/zinc/85/46/22/875854622.db2.gz XCSGPOLZLNTBDH-GOTSBHOMSA-N 0 3 401.572 4.147 20 0 HIADHN C[C@H](NCCCN1C(=O)c2ccccc2C1=O)c1csc(-c2ccccc2F)n1 ZINC000462816200 875857777 /nfs/dbraw/zinc/85/77/77/875857777.db2.gz QOOITMONSKJTCE-AWEZNQCLSA-N 0 3 409.486 4.286 20 0 HIADHN Cc1ccc(S(=O)(=O)C[C@@H](C)N[C@H]2C[C@H](c3ccc(Br)cc3)C2)cc1 ZINC000462822855 875862255 /nfs/dbraw/zinc/86/22/55/875862255.db2.gz XEQFCUQCEIBZSE-SZVBFZGTSA-N 0 3 422.388 4.456 20 0 HIADHN Fc1cc(CN[C@H](c2cccc(C(F)(F)F)c2)C2CC2)cnc1N1CCOCC1 ZINC000462835865 875870079 /nfs/dbraw/zinc/87/00/79/875870079.db2.gz SAAOZVLOMGFKMR-IBGZPJMESA-N 0 3 409.427 4.317 20 0 HIADHN COc1ccccc1[C@@H](NCc1cccc(N2CCCS2(=O)=O)c1)C1CCCC1 ZINC000462836658 875871391 /nfs/dbraw/zinc/87/13/91/875871391.db2.gz FRARCBOHPGUZLF-QHCPKHFHSA-N 0 3 414.571 4.256 20 0 HIADHN CC(C)COc1ccc([C@H](C)NCc2cccc(N3CCCS3(=O)=O)c2)cc1 ZINC000462853525 875886840 /nfs/dbraw/zinc/88/68/40/875886840.db2.gz OGNHBBYGCCRVDZ-SFHVURJKSA-N 0 3 402.560 4.112 20 0 HIADHN CC[C@H](NCc1cccc(N2CCCS2(=O)=O)c1)c1cccc(Br)c1 ZINC000462858698 875892641 /nfs/dbraw/zinc/89/26/41/875892641.db2.gz ZHLAEIVKVDVCLT-IBGZPJMESA-N 0 3 423.376 4.230 20 0 HIADHN CCN(CC)C(=O)Nc1ccc([C@H](C)N[C@H]2CC(=O)N(c3ccccc3F)C2)cc1 ZINC000462944616 875966694 /nfs/dbraw/zinc/96/66/94/875966694.db2.gz FVVNGNHKRMLDMZ-LPHOPBHVSA-N 0 3 412.509 4.156 20 0 HIADHN O=C1C[C@H](NCc2ccc(Br)c3cccnc23)CN1c1ccccc1F ZINC000463022915 876041108 /nfs/dbraw/zinc/04/11/08/876041108.db2.gz KNVDZEJMZRBXND-AWEZNQCLSA-N 0 3 414.278 4.032 20 0 HIADHN CCOC(=O)c1nn(-c2ccccc2)cc1CN[C@@H]1CCO[C@H](c2ccccc2)C1 ZINC000463056922 876085320 /nfs/dbraw/zinc/08/53/20/876085320.db2.gz NUJYTSBSNCHBIP-IRLDBZIGSA-N 0 3 405.498 4.059 20 0 HIADHN NC(=O)C1CCN(Cc2cccc(NC(=O)C3CCC(c4ccccc4)CC3)c2)CC1 ZINC000463117995 876160015 /nfs/dbraw/zinc/16/00/15/876160015.db2.gz JDBUVPPKTOICHM-UHFFFAOYSA-N 0 3 419.569 4.296 20 0 HIADHN CCN1CC[C@H](NCc2cncc(C(F)(F)F)c2)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000463197091 876256478 /nfs/dbraw/zinc/25/64/78/876256478.db2.gz OEZJXSDNZBFERN-WMZOPIPTSA-N 0 3 403.370 4.443 20 0 HIADHN Cc1ccc(-c2nc(CCNC(=O)N[C@H]3CN(Cc4ccccc4)C[C@@H]3C)co2)cc1 ZINC000463204730 876266333 /nfs/dbraw/zinc/26/63/33/876266333.db2.gz OEYCZXXOOONGEC-CVDCTZTESA-N 0 3 418.541 4.012 20 0 HIADHN C[C@@H](CN(C)Cc1cc(Br)cc(Br)c1N)c1nccs1 ZINC000463244826 876301083 /nfs/dbraw/zinc/30/10/83/876301083.db2.gz WJQMGFWSSUXJSZ-VIFPVBQESA-N 0 3 419.186 4.486 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)cc1C(=O)NC1CCN(Cc2ccccc2)CC1 ZINC000463247665 876305105 /nfs/dbraw/zinc/30/51/05/876305105.db2.gz XJQMFYPREPWXJJ-UHFFFAOYSA-N 0 3 408.933 4.229 20 0 HIADHN C[C@H]1CCCc2ccccc2[C@H]1NC(=O)N(C)C1CCN(CCc2ccccn2)CC1 ZINC000463268418 876325895 /nfs/dbraw/zinc/32/58/95/876325895.db2.gz RSXNKFXKIZVURR-CPJSRVTESA-N 0 3 420.601 4.444 20 0 HIADHN COc1ccccc1[C@H](NC(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C)c1ccco1 ZINC000463272974 876331541 /nfs/dbraw/zinc/33/15/41/876331541.db2.gz WGLQXUICONEZMP-VNZMSGEBSA-N 0 3 419.525 4.197 20 0 HIADHN C[C@@H]1CCN(C(=O)NCc2ccccc2CN2CCC(O)CC2)CC12CCCCC2 ZINC000463299473 876359587 /nfs/dbraw/zinc/35/95/87/876359587.db2.gz AAPIMMGKFOTZBQ-HXUWFJFHSA-N 0 3 413.606 4.145 20 0 HIADHN Clc1cccc(C2CCN(CCc3nnnn3-c3ccccc3)CC2)c1Cl ZINC000463371483 876426908 /nfs/dbraw/zinc/42/69/08/876426908.db2.gz XPECTERQTLVVIP-UHFFFAOYSA-N 0 3 402.329 4.391 20 0 HIADHN CC(C)[C@H](CNC(=O)[C@H]1SCCc2sccc21)N1CCc2ccccc2C1 ZINC000463408585 876462489 /nfs/dbraw/zinc/46/24/89/876462489.db2.gz ZXVOHVITSMXRBS-FPOVZHCZSA-N 0 3 400.613 4.278 20 0 HIADHN CC(C)n1cc(Br)cc1C(=O)NCCCN1CCc2ccccc2C1 ZINC000463415598 876470494 /nfs/dbraw/zinc/47/04/94/876470494.db2.gz KBHBRHAWHQNQMZ-UHFFFAOYSA-N 0 3 404.352 4.010 20 0 HIADHN CCc1ccc([C@H](CNC(=O)c2cc(NC(=O)C(C)(C)C)ccc2F)N(C)C)cc1 ZINC000463434559 876491410 /nfs/dbraw/zinc/49/14/10/876491410.db2.gz NQQDYGSISYXRHL-NRFANRHFSA-N 0 3 413.537 4.405 20 0 HIADHN OC[C@@]1(c2ccccc2)CCN(Cc2ccnc(-c3ccc(Br)cc3)n2)C1 ZINC000463442663 876501084 /nfs/dbraw/zinc/50/10/84/876501084.db2.gz MAYVDOIRXFHNRB-JOCHJYFZSA-N 0 3 424.342 4.042 20 0 HIADHN OC[C@@]1(Cc2ccccc2)CCCN(C[C@H](O)COc2cc(Cl)ccc2Cl)C1 ZINC000463453895 876513169 /nfs/dbraw/zinc/51/31/69/876513169.db2.gz WDLOTOXYJHQNPI-SIKLNZKXSA-N 0 3 424.368 4.050 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)c2cc(Br)cn2C(C)C)c1 ZINC000463497568 876555747 /nfs/dbraw/zinc/55/57/47/876555747.db2.gz VIOZACIJWOUCKR-UHFFFAOYSA-N 0 3 406.368 4.344 20 0 HIADHN C[C@@H](CC(=O)c1ccccc1F)C(=O)N1CCC(N2CCc3ccccc3C2)CC1 ZINC000463522263 876590749 /nfs/dbraw/zinc/59/07/49/876590749.db2.gz YCLDQHHLSFBQLQ-SFHVURJKSA-N 0 3 408.517 4.084 20 0 HIADHN Cc1nc(C2CCCC2)sc1C(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000463558670 876644836 /nfs/dbraw/zinc/64/48/36/876644836.db2.gz RGBXFVQQOQSUIR-HZPDHXFCSA-N 0 3 405.608 4.071 20 0 HIADHN Cc1nc(C2CCCC2)sc1C(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000463558671 876645098 /nfs/dbraw/zinc/64/50/98/876645098.db2.gz RGBXFVQQOQSUIR-IYBDPMFKSA-N 0 3 405.608 4.071 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2cccc(-c3noc(C4CC4)n3)c2)N2CCCC2)cc1 ZINC000463594384 876704664 /nfs/dbraw/zinc/70/46/64/876704664.db2.gz XMVKSDSEFCZMGE-JOCHJYFZSA-N 0 3 416.525 4.489 20 0 HIADHN C[C@@H]1CCN(C(=O)N[C@@H]2CCOc3c(F)ccc(F)c32)CCN1Cc1ccccc1 ZINC000463615171 876734425 /nfs/dbraw/zinc/73/44/25/876734425.db2.gz UYXVTLKDJHMRNX-OXQOHEQNSA-N 0 3 415.484 4.094 20 0 HIADHN CCCN(CCN(C)C)C(=O)CCCc1nnc(-c2ccc(Cl)cc2Cl)o1 ZINC000468999782 883065752 /nfs/dbraw/zinc/06/57/52/883065752.db2.gz QFLVZEDJGOGHRN-UHFFFAOYSA-N 0 3 413.349 4.166 20 0 HIADHN COc1ccc(Cn2nc(C)c(CNCc3ccccc3-n3cccn3)c2C)cc1 ZINC000463738416 876859946 /nfs/dbraw/zinc/85/99/46/876859946.db2.gz IBMUKXOPBGDTHA-UHFFFAOYSA-N 0 3 401.514 4.032 20 0 HIADHN COc1ccc(Cn2nc(C)c(CNCc3ccc(CN(C)C)c(F)c3)c2C)cc1 ZINC000463747131 876869958 /nfs/dbraw/zinc/86/99/58/876869958.db2.gz UAHXEODGMYMAFH-UHFFFAOYSA-N 0 3 410.537 4.047 20 0 HIADHN COc1ccc(Cn2nc(C)c(CNCCOc3ccc(F)c(F)c3)c2C)cc1 ZINC000463747565 876870003 /nfs/dbraw/zinc/87/00/03/876870003.db2.gz SJYQGXIJYTVTML-UHFFFAOYSA-N 0 3 401.457 4.004 20 0 HIADHN Cn1ccc(N2CCC[C@@H](N[C@H](Cc3ccc(Cl)cc3)c3ccccc3)C2=O)n1 ZINC000463895871 877018571 /nfs/dbraw/zinc/01/85/71/877018571.db2.gz LCOLRRPYORQQIC-NHCUHLMSSA-N 0 3 408.933 4.143 20 0 HIADHN Cc1cc(N2CC[C@H](N[C@H](Cc3ccccc3Cl)c3ccccc3)C2=O)n(C)n1 ZINC000463906916 877029154 /nfs/dbraw/zinc/02/91/54/877029154.db2.gz VENHZXGPZYRYEI-LEWJYISDSA-N 0 3 408.933 4.061 20 0 HIADHN Cn1cc(N2CCC[C@H](N[C@H](Cc3ccccc3Cl)c3ccccc3)C2=O)cn1 ZINC000463908911 877030850 /nfs/dbraw/zinc/03/08/50/877030850.db2.gz ZAYMYMKHUOCBTC-FCHUYYIVSA-N 0 3 408.933 4.143 20 0 HIADHN COc1ccc([C@H](CNC(=O)NC[C@@H](C)Sc2ccccc2)N2CCCC2)cc1 ZINC000463951441 877073898 /nfs/dbraw/zinc/07/38/98/877073898.db2.gz ARLPCMAAAFPXAM-GCJKJVERSA-N 0 3 413.587 4.312 20 0 HIADHN COc1ccc([C@H](CNC(=O)NC[C@@H](C)c2ccc(F)cc2F)N2CCCC2)cc1 ZINC000463959208 877082914 /nfs/dbraw/zinc/08/29/14/877082914.db2.gz SPOAROXVVDESEO-ZHRRBRCNSA-N 0 3 417.500 4.213 20 0 HIADHN Cc1nn(C(C)(C)C)cc1[C@H](C)NC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1 ZINC000464151980 877321554 /nfs/dbraw/zinc/32/15/54/877321554.db2.gz LMAUXWDYTTVNTQ-OALUTQOASA-N 0 3 411.594 4.314 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)NCc2cccc(-c3cccnc3)c2)CN1Cc1ccccc1 ZINC000464303764 877494066 /nfs/dbraw/zinc/49/40/66/877494066.db2.gz DAHVEFHXTQMJDX-DVECYGJZSA-N 0 3 400.526 4.211 20 0 HIADHN O=C(c1cc(COc2ccccc2F)on1)N1C[C@@H]2CCCN2Cc2ccccc21 ZINC000464444092 877658992 /nfs/dbraw/zinc/65/89/92/877658992.db2.gz SAQYUQQGQGMBEZ-KRWDZBQOSA-N 0 3 407.445 4.018 20 0 HIADHN Cc1cccc(S(=O)(=O)CCCN[C@H](C)c2ccc(OCC3CC3)c(F)c2)c1 ZINC000464481742 877700513 /nfs/dbraw/zinc/70/05/13/877700513.db2.gz RAGAPOFLSLSKEA-QGZVFWFLSA-N 0 3 405.535 4.438 20 0 HIADHN C[C@@H]1CCCN(c2cc(C(=O)N(Cc3ccccc3)C3CCN(C)CC3)ccn2)C1 ZINC000464502331 877727090 /nfs/dbraw/zinc/72/70/90/877727090.db2.gz OMJZHWDGTXYOTN-HXUWFJFHSA-N 0 3 406.574 4.055 20 0 HIADHN CCN(C(=O)CN(CCCOc1ccccc1)C1CCOCC1)C1CCCCC1 ZINC000464573941 877795458 /nfs/dbraw/zinc/79/54/58/877795458.db2.gz APBLTBVYEXKBGK-UHFFFAOYSA-N 0 3 402.579 4.118 20 0 HIADHN CC(C)CN(C(=O)c1cc(Cl)cc(Br)c1F)C1CCN(C)CC1 ZINC000464582752 877806054 /nfs/dbraw/zinc/80/60/54/877806054.db2.gz PRRGKYFIRBZTEK-UHFFFAOYSA-N 0 3 405.739 4.434 20 0 HIADHN Cc1nn(C(C)(C)C)cc1[C@@H](C)NC[C@H](O)COc1c(Cl)cccc1Cl ZINC000464600982 877829035 /nfs/dbraw/zinc/82/90/35/877829035.db2.gz GMZCWFSSFIHWHS-OCCSQVGLSA-N 0 3 400.350 4.344 20 0 HIADHN COc1ccccc1S(=O)(=O)CCCNC1(c2ccc(Cl)c(Cl)c2)CC1 ZINC000464677765 877894289 /nfs/dbraw/zinc/89/42/89/877894289.db2.gz PIEIZQFESTZLJO-UHFFFAOYSA-N 0 3 414.354 4.445 20 0 HIADHN COCCCN(C(=O)c1ccc(O[C@@H](C)c2ccccc2)cc1)C1CCN(C)CC1 ZINC000464720537 877947494 /nfs/dbraw/zinc/94/74/94/877947494.db2.gz QDLWURAEHAQRDV-FQEVSTJZSA-N 0 3 410.558 4.400 20 0 HIADHN CCS[C@@H]1CC[C@@H](N(C)CC(=O)N(C)Cc2ccc3cc(OC)ccc3c2)C1 ZINC000464768928 878011037 /nfs/dbraw/zinc/01/10/37/878011037.db2.gz COKJSCPKURELBB-IFMALSPDSA-N 0 3 400.588 4.413 20 0 HIADHN CCS[C@@H]1CC[C@H](N(C)CC(=O)N2CCC[C@@H]2c2ccc3c(c2)OCCCO3)C1 ZINC000464777275 878018785 /nfs/dbraw/zinc/01/87/85/878018785.db2.gz UZYGQJMIMSJZDH-XUVXKRRUSA-N 0 3 418.603 4.117 20 0 HIADHN COc1cc(C(C)=O)ccc1OC[C@@H](O)CN1CCCC[C@H]1c1cccc(C)c1C ZINC000464778470 878021929 /nfs/dbraw/zinc/02/19/29/878021929.db2.gz ONIMNPGIJORISW-GMAHTHKFSA-N 0 3 411.542 4.482 20 0 HIADHN CC(C)[C@@H](Cc1ccc(F)cc1)N(C)CC(=O)Nc1cccc(N2CCCC2=O)c1 ZINC000464789824 878035884 /nfs/dbraw/zinc/03/58/84/878035884.db2.gz OZIUFKREESIOCT-JOCHJYFZSA-N 0 3 411.521 4.090 20 0 HIADHN CCN(CC(=O)Nc1cccc(Cl)c1C)CC1CCN(c2ccccn2)CC1 ZINC000464805126 878050186 /nfs/dbraw/zinc/05/01/86/878050186.db2.gz JZFOWGPWMDOVLI-UHFFFAOYSA-N 0 3 400.954 4.220 20 0 HIADHN CCN(CC(=O)Nc1ccc(C)cc1Cl)CC1CCN(c2ccccn2)CC1 ZINC000464812234 878064250 /nfs/dbraw/zinc/06/42/50/878064250.db2.gz UYXIAJACQGNRDA-UHFFFAOYSA-N 0 3 400.954 4.220 20 0 HIADHN Cn1ncc(CN2CCCN(Cc3ccc(C(F)(F)F)cc3)CC2)c1C(F)(F)F ZINC000464865132 878148233 /nfs/dbraw/zinc/14/82/33/878148233.db2.gz VVUOSHYMWHMKBK-UHFFFAOYSA-N 0 3 420.401 4.166 20 0 HIADHN Cc1nc(NC(=O)CN(C(C)C)C2CCOCC2)sc1Cc1ccc(C)cc1 ZINC000464873854 878160845 /nfs/dbraw/zinc/16/08/45/878160845.db2.gz IFJSILXHNWSQNE-UHFFFAOYSA-N 0 3 401.576 4.179 20 0 HIADHN COc1ccc([C@H](CNC(=O)CN2C[C@@H]3CCC[C@@H]3C2)c2c[nH]c3ccccc32)cc1 ZINC000464877353 878169106 /nfs/dbraw/zinc/16/91/06/878169106.db2.gz JEJLCGCAZJIAJN-MZKRTTBSSA-N 0 3 417.553 4.157 20 0 HIADHN C[C@@H]1CCN(C(=O)Cc2ccc(Br)s2)CCN1Cc1ccccc1 ZINC000464885761 878182273 /nfs/dbraw/zinc/18/22/73/878182273.db2.gz MZLIWJDUAHRIBM-OAHLLOKOSA-N 0 3 407.377 4.176 20 0 HIADHN NC(=O)c1ccc(NC(=O)CCN2CCC(=Cc3ccccc3F)CC2)cc1Cl ZINC000464887455 878186353 /nfs/dbraw/zinc/18/63/53/878186353.db2.gz RECNXFZOVIQFDK-UHFFFAOYSA-N 0 3 415.896 4.086 20 0 HIADHN CC(=O)CCc1ccc(O[C@H](C)C(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)cc1 ZINC000464890060 878189293 /nfs/dbraw/zinc/18/92/93/878189293.db2.gz GYPMLWSWJHOCHA-IFMALSPDSA-N 0 3 422.569 4.099 20 0 HIADHN Cc1cc(C)n(-c2ccc(C(=O)N3CC[C@H](C)N(Cc4ccccc4)CC3)cc2F)n1 ZINC000464893593 878196071 /nfs/dbraw/zinc/19/60/71/878196071.db2.gz LTMGLLXEYCAIGL-IBGZPJMESA-N 0 3 420.532 4.365 20 0 HIADHN C[C@H]1CCN(C(=O)CCCOc2ccc(F)cc2F)CCN1Cc1ccccc1 ZINC000464893893 878196485 /nfs/dbraw/zinc/19/64/85/878196485.db2.gz NUBVDVWNJLAAKG-SFHVURJKSA-N 0 3 402.485 4.247 20 0 HIADHN Cc1oc(-c2ccsc2)nc1CC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC000464895298 878198244 /nfs/dbraw/zinc/19/82/44/878198244.db2.gz QOBFOXZHOKGBKI-QGZVFWFLSA-N 0 3 409.555 4.377 20 0 HIADHN COCCn1cc(C(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)c2ccccc21 ZINC000464895409 878198655 /nfs/dbraw/zinc/19/86/55/878198655.db2.gz RJIWYTHXBFIFPR-FQEVSTJZSA-N 0 3 405.542 4.024 20 0 HIADHN C[C@H]1CCN(C(=O)c2cnn(-c3cccc(Cl)c3)c2)CCN1Cc1ccccc1 ZINC000464899494 878207707 /nfs/dbraw/zinc/20/77/07/878207707.db2.gz JJEGLRSRVJZTAC-SFHVURJKSA-N 0 3 408.933 4.262 20 0 HIADHN C[C@H]1CCN(C(=O)Cc2csc(-c3ccccc3)n2)CCN1Cc1ccccc1 ZINC000464899501 878208357 /nfs/dbraw/zinc/20/83/57/878208357.db2.gz JLANGGYJTRSMPP-IBGZPJMESA-N 0 3 405.567 4.476 20 0 HIADHN CC(C)C(=O)N(C)Cc1ccc(C(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)cc1 ZINC000464900891 878210733 /nfs/dbraw/zinc/21/07/33/878210733.db2.gz FDWLPYPFCMUZGO-OAQYLSRUSA-N 0 3 421.585 4.038 20 0 HIADHN Cc1noc2nc(C(C)C)cc(C(=O)N3CC[C@H](C)N(Cc4ccccc4)CC3)c12 ZINC000464902723 878214274 /nfs/dbraw/zinc/21/42/74/878214274.db2.gz BFGYKNBSPCSOJI-KRWDZBQOSA-N 0 3 406.530 4.391 20 0 HIADHN C/C=C\c1ccc(OCC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)c(OC)c1 ZINC000464909491 878225711 /nfs/dbraw/zinc/22/57/11/878225711.db2.gz LRYOBVFNKZDJCX-CWWFIGIMSA-N 0 3 408.542 4.230 20 0 HIADHN CCN(C[C@H]1CCN(Cc2ccccc2)C1)C(=O)CCC(=O)c1ccc(F)cc1F ZINC000464967125 878307487 /nfs/dbraw/zinc/30/74/87/878307487.db2.gz YDXHPTWSSATEIJ-IBGZPJMESA-N 0 3 414.496 4.298 20 0 HIADHN CCN(C[C@@H]1CCN(Cc2ccccc2)C1)C(=O)CCC(=O)c1ccc(F)cc1F ZINC000464967126 878307823 /nfs/dbraw/zinc/30/78/23/878307823.db2.gz YDXHPTWSSATEIJ-LJQANCHMSA-N 0 3 414.496 4.298 20 0 HIADHN Cc1nc(-c2cccc(NC(=O)NC[C@@H](c3cccs3)N3CCC(C)CC3)c2)n[nH]1 ZINC000503359147 912333011 /nfs/dbraw/zinc/33/30/11/912333011.db2.gz JSUORPLPQIUTSU-IBGZPJMESA-N 0 3 424.574 4.436 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)CCc3c[nH]c4cc(C)ccc34)cc2)CC1 ZINC000465029458 878393819 /nfs/dbraw/zinc/39/38/19/878393819.db2.gz REQXODCVDIXUPD-UHFFFAOYSA-N 0 3 404.558 4.185 20 0 HIADHN O[C@@H](COc1c(Cl)cccc1Cl)CN1CCC[C@@H](c2ncc3n2CCCC3)C1 ZINC000503367790 912344673 /nfs/dbraw/zinc/34/46/73/912344673.db2.gz BEHHDKIUDDVYGE-NVXWUHKLSA-N 0 3 424.372 4.146 20 0 HIADHN CSc1ccc(F)cc1CNC(=O)c1ccc(N2CCN(C(C)C)CC2)cc1 ZINC000465193524 878591596 /nfs/dbraw/zinc/59/15/96/878591596.db2.gz DILJCUFDBSKXGA-UHFFFAOYSA-N 0 3 401.551 4.008 20 0 HIADHN Cc1cccc2nc(CN3CCC(c4ccc(Br)cc4)CC3)cc(=O)n12 ZINC000503389645 912373964 /nfs/dbraw/zinc/37/39/64/912373964.db2.gz ZNTAPZHTIQNKFQ-UHFFFAOYSA-N 0 3 412.331 4.145 20 0 HIADHN O[C@H](COc1cc(Cl)ccc1Cl)CN1CCC[C@H](c2ncc3n2CCCC3)C1 ZINC000503402621 912382920 /nfs/dbraw/zinc/38/29/20/912382920.db2.gz BOLFEUFWIBPKMJ-YJBOKZPZSA-N 0 3 424.372 4.146 20 0 HIADHN CCN(CC)c1nc2sc(C(=O)N3CC[C@H]4CC[C@@H](C3)N4C(C)C)cc2s1 ZINC000465356090 878790698 /nfs/dbraw/zinc/79/06/98/878790698.db2.gz FLQYVXMJOHCXMJ-CABCVRRESA-N 0 3 406.621 4.291 20 0 HIADHN COc1ccc(C2CCN(C(=O)[C@H]3CCCN(Cc4cccc(F)c4)C3)CC2)cc1 ZINC000465382273 878823291 /nfs/dbraw/zinc/82/32/91/878823291.db2.gz NOQUORQDTYKKGE-QFIPXVFZSA-N 0 3 410.533 4.453 20 0 HIADHN C[C@H]1CCN(C(=O)NC[C@H](c2ccco2)N2CCCCC2)CCN1Cc1ccccc1 ZINC000465398075 878834584 /nfs/dbraw/zinc/83/45/84/878834584.db2.gz AZVYXGZTMBZECG-JTHBVZDNSA-N 0 3 424.589 4.113 20 0 HIADHN CO[C@]1(C)C[C@@H](N[C@@H](C)C(=O)Nc2cccc(CSc3ccccn3)c2)C1(C)C ZINC000465405458 878841289 /nfs/dbraw/zinc/84/12/89/878841289.db2.gz JIICHGODKPDCJM-XKDCRVNJSA-N 0 3 413.587 4.494 20 0 HIADHN C[C@@H](NC(=O)NC[C@@H](c1cccs1)N1CCCC1)c1nc(C2CCCCC2)no1 ZINC000465419010 878848901 /nfs/dbraw/zinc/84/89/01/878848901.db2.gz AAHNGNKMVAIXGW-WBVHZDCISA-N 0 3 417.579 4.376 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N[C@@H](C)c2ccc(-n3cccn3)cc2)N(C)C)cc1 ZINC000465426160 878856182 /nfs/dbraw/zinc/85/61/82/878856182.db2.gz ROCJDXZNRAITGZ-MBSDFSHPSA-N 0 3 405.546 4.098 20 0 HIADHN C[C@@H]1CN(C(=O)NC[C@@H](c2cccs2)N2CCCC2)C[C@@H](c2ccc(F)cc2)O1 ZINC000465427668 878857928 /nfs/dbraw/zinc/85/79/28/878857928.db2.gz JRMICCJPQIYWID-UXPWSPDFSA-N 0 3 417.550 4.196 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N(Cc1cc[nH]n1)Cc1ccccc1 ZINC000465427583 878858340 /nfs/dbraw/zinc/85/83/40/878858340.db2.gz YKCPKEHTQCRBNC-HXUWFJFHSA-N 0 3 409.559 4.020 20 0 HIADHN COc1ccc([C@@H](CNC(=O)NCc2cc(F)ccc2SC)N2CCCC2)cc1 ZINC000465460352 878891519 /nfs/dbraw/zinc/89/15/19/878891519.db2.gz RQTLOJLTDPKBFZ-HXUWFJFHSA-N 0 3 417.550 4.193 20 0 HIADHN O=C(NCc1ccc(-c2cccnc2)cc1)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000465528611 878983778 /nfs/dbraw/zinc/98/37/78/878983778.db2.gz JXRCJXWFCFLBCM-DEOSSOPVSA-N 0 3 400.526 4.385 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)cc1CN1CCC(C(=O)NC2CCCCC2)CC1 ZINC000512370870 921111125 /nfs/dbraw/zinc/11/11/25/921111125.db2.gz YVODHIZHARANNA-UHFFFAOYSA-N 0 3 414.981 4.495 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)N1CC[C@@H](CSc2ccccc2)C1 ZINC000465552405 879016426 /nfs/dbraw/zinc/01/64/26/879016426.db2.gz VRTGFAZFQQILIB-HXUWFJFHSA-N 0 3 409.599 4.259 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)N2CC[C@H](C)C[C@H]2c2ccco2)CC1 ZINC000465553863 879021585 /nfs/dbraw/zinc/02/15/85/879021585.db2.gz WYSJEGIXLWZUHA-REWPJTCUSA-N 0 3 424.589 4.100 20 0 HIADHN C[C@@H]1CN(C(=O)N[C@H](CN2CCCC2)c2ccccc2)C[C@H](c2ccc(F)cc2)O1 ZINC000465605991 879097922 /nfs/dbraw/zinc/09/79/22/879097922.db2.gz QJISIEGHFFUCHV-SXSPYAJSSA-N 0 3 411.521 4.134 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)N[C@H](CCC(C)C)c2ccc(Cl)cc2)CC1 ZINC000465657820 879185380 /nfs/dbraw/zinc/18/53/80/879185380.db2.gz JYVQEPQHPCLHKT-SIKLNZKXSA-N 0 3 423.045 4.390 20 0 HIADHN C[C@H](NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1)c1nc(C2CCCCC2)no1 ZINC000465703293 879268813 /nfs/dbraw/zinc/26/88/13/879268813.db2.gz YEPTVVQXDOETMS-PXNSSMCTSA-N 0 3 411.550 4.142 20 0 HIADHN C[C@@H](COc1ccc(F)cc1F)NC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC000465742902 879330834 /nfs/dbraw/zinc/33/08/34/879330834.db2.gz VFMHARCCHPDHIA-ZWKOTPCHSA-N 0 3 417.500 4.038 20 0 HIADHN COc1ccc(C2CCN(C(=O)N[C@@H]3CCN([C@H](C)c4ccccc4)C3)CC2)cc1 ZINC000465766227 879365723 /nfs/dbraw/zinc/36/57/23/879365723.db2.gz ZHFJMFZKVRUOTL-AUSIDOKSSA-N 0 3 407.558 4.420 20 0 HIADHN C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1 ZINC000465792707 879399601 /nfs/dbraw/zinc/39/96/01/879399601.db2.gz YVEWLKKJXHIDIU-UXHICEINSA-N 0 3 423.557 4.042 20 0 HIADHN O=C(NC[C@@H]1CCO[C@@H]1c1ccccc1)NC[C@H]1CCCCN1Cc1ccccc1 ZINC000465795129 879404434 /nfs/dbraw/zinc/40/44/34/879404434.db2.gz YYNXTVHCMOSBNS-RBZQAINGSA-N 0 3 407.558 4.118 20 0 HIADHN Cc1ccc(Oc2ccccc2CNC(=O)N(CCN(C)C)C[C@H]2CCCO2)cc1 ZINC000465864654 879513356 /nfs/dbraw/zinc/51/33/56/879513356.db2.gz SNMGDSCJMYRVNA-JOCHJYFZSA-N 0 3 411.546 4.040 20 0 HIADHN C[C@@H](CNC(=O)NC(C)(C)c1nc(C(F)(F)F)cs1)N(C)Cc1ccccc1 ZINC000465880630 879535898 /nfs/dbraw/zinc/53/58/98/879535898.db2.gz SORBHVKTYCOKKU-ZDUSSCGKSA-N 0 3 414.497 4.217 20 0 HIADHN Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)NC(=O)N1CC[C@@H](N2CC=CC2)C1 ZINC000465912522 879575566 /nfs/dbraw/zinc/57/55/66/879575566.db2.gz UPLOUEJLVUCGHG-CRAIPNDOSA-N 0 3 416.978 4.489 20 0 HIADHN COc1cccc([C@@H](NC(=O)N(C)[C@@H]2CCN(C3CC3)C2)c2ccccc2Cl)c1 ZINC000466031469 879719855 /nfs/dbraw/zinc/71/98/55/879719855.db2.gz GBKMORBAXAXEIO-XMSQKQJNSA-N 0 3 413.949 4.316 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)NCc2ccc3ncccc3c2)N(C)C)cc1 ZINC000503459296 912490105 /nfs/dbraw/zinc/49/01/05/912490105.db2.gz CZOROKJDVCWOID-HSZRJFAPSA-N 0 3 406.530 4.124 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)NCc1coc(-c2ccccc2)n1 ZINC000466072858 879778745 /nfs/dbraw/zinc/77/87/45/879778745.db2.gz YLUURKXAFWXUNC-IBGZPJMESA-N 0 3 404.514 4.148 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccc(O)cc1)C(=O)CCC(=O)c1cccc(F)c1 ZINC000503463242 912495192 /nfs/dbraw/zinc/49/51/92/912495192.db2.gz OWPCQRIFYJCDPD-OAQYLSRUSA-N 0 3 412.505 4.007 20 0 HIADHN C[C@@H](NC(=O)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1)[C@H]1CCOC1 ZINC000466118475 879831879 /nfs/dbraw/zinc/83/18/79/879831879.db2.gz SODPCDAWBUZMTA-WBVHZDCISA-N 0 3 414.377 4.026 20 0 HIADHN C[C@@H](CNC(=O)N(CCN(C)C)Cc1cccc(Cl)c1)Oc1ccccc1F ZINC000466163132 879865978 /nfs/dbraw/zinc/86/59/78/879865978.db2.gz GYJQGFFMFDRASV-INIZCTEOSA-N 0 3 407.917 4.020 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)NCCc1c[nH]c2ccc(Cl)cc12 ZINC000466180648 879878170 /nfs/dbraw/zinc/87/81/70/879878170.db2.gz XMOHYIHKDBFCFP-UHFFFAOYSA-N 0 3 416.928 4.276 20 0 HIADHN CC(C)CC(=O)Nc1cccc(CNC(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)c1 ZINC000466245768 879960432 /nfs/dbraw/zinc/96/04/32/879960432.db2.gz BRDDOOSLBPCHPZ-WMZHIEFXSA-N 0 3 422.573 4.133 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)NC[C@H]2CCCO[C@@H]2c2ccccc2)CN1Cc1ccccc1 ZINC000466258240 879984477 /nfs/dbraw/zinc/98/44/77/879984477.db2.gz KMHAOMKSZVZHEM-OUJCMCIWSA-N 0 3 407.558 4.117 20 0 HIADHN Cc1nn(C(C)C)cc1CN[C@H]1CCN(c2ncc(C(F)(F)F)cc2Cl)C1 ZINC000466347204 880104478 /nfs/dbraw/zinc/10/44/78/880104478.db2.gz OMNDIVXKOKDNJF-HNNXBMFYSA-N 0 3 401.864 4.208 20 0 HIADHN C[C@@H](CNC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C)c1ccc(F)cc1F ZINC000466424797 880198157 /nfs/dbraw/zinc/19/81/57/880198157.db2.gz GZPPCETUUJLPEX-ROUUACIJSA-N 0 3 401.501 4.374 20 0 HIADHN FC(F)(F)c1ccc(-c2nc(CNCCc3cn4c(n3)SCC4)cs2)cc1 ZINC000466453187 880232858 /nfs/dbraw/zinc/23/28/58/880232858.db2.gz CLIXZDXMVIAWHG-UHFFFAOYSA-N 0 3 410.490 4.463 20 0 HIADHN CSc1ccc([C@H](C)NC(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)cc1 ZINC000466483163 880263295 /nfs/dbraw/zinc/26/32/95/880263295.db2.gz VNIWKGIWGBJOOK-QRVBRYPASA-N 0 3 419.635 4.390 20 0 HIADHN C[C@H](NC(=O)N[C@H]1C[C@H](C)N(Cc2ccccc2)C1)c1ncc(-c2ccccc2)o1 ZINC000466504685 880279703 /nfs/dbraw/zinc/27/97/03/880279703.db2.gz NJJWMOAWKJXJHB-WFXMLNOXSA-N 0 3 404.514 4.365 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)Nc2cccc(OC[C@@H]3CCCO3)c2)CN1Cc1ccccc1 ZINC000466515621 880289244 /nfs/dbraw/zinc/28/92/44/880289244.db2.gz BZZNXLRUSXYUNC-AAIMPIBUSA-N 0 3 409.530 4.029 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)N(Cc2cccs2)C[C@H]2CCCO2)CN1Cc1ccccc1 ZINC000466516747 880292085 /nfs/dbraw/zinc/29/20/85/880292085.db2.gz SIZAVIJRCWWOIN-HMXCVIKNSA-N 0 3 413.587 4.102 20 0 HIADHN Cc1ccc(NC(=O)C(C)C)cc1NC(=O)N[C@@H]1C[C@@H](C)N(Cc2ccccc2)C1 ZINC000466518130 880293881 /nfs/dbraw/zinc/29/38/81/880293881.db2.gz LCVIZTDOBJDESV-WIYYLYMNSA-N 0 3 408.546 4.374 20 0 HIADHN Cc1ccc(NC(=O)C2CC2)cc1NC(=O)N[C@@H]1C[C@H](C)N(Cc2ccccc2)C1 ZINC000466518628 880295147 /nfs/dbraw/zinc/29/51/47/880295147.db2.gz ZABUGDXHRQSFCC-LAUBAEHRSA-N 0 3 406.530 4.128 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)N2CCC(OCc3ccccc3)CC2)CN1Cc1ccccc1 ZINC000466522174 880298110 /nfs/dbraw/zinc/29/81/10/880298110.db2.gz ZVWNLHYGGMEUMU-OFNKIYASSA-N 0 3 407.558 4.040 20 0 HIADHN CCOCCOCc1cccc(NC(=O)N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)c1 ZINC000466531525 880306803 /nfs/dbraw/zinc/30/68/03/880306803.db2.gz YVVDFEGTUKUNJS-AUSIDOKSSA-N 0 3 411.546 4.024 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)Nc2ccccc2C(=O)N2CCCCC2)CN1Cc1ccccc1 ZINC000466542115 880315611 /nfs/dbraw/zinc/31/56/11/880315611.db2.gz PNDRFZGEYFYUSD-TZIWHRDSSA-N 0 3 420.557 4.097 20 0 HIADHN CCc1nc(C)c([C@H](C)N(C)C(=O)N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)s1 ZINC000466542554 880317291 /nfs/dbraw/zinc/31/72/91/880317291.db2.gz VNZDUWHBPMXFOI-AYBZRNKSSA-N 0 3 400.592 4.379 20 0 HIADHN C[C@@H](NC(=O)N(CCCc1ccccc1)CCN(C)C)c1cccc(-n2cccn2)c1 ZINC000466657009 880435172 /nfs/dbraw/zinc/43/51/72/880435172.db2.gz BTFFLYVSGKKGIY-OAQYLSRUSA-N 0 3 419.573 4.139 20 0 HIADHN COC(=O)c1ccc(C(C)C)c(NC(=O)N(CCN(C)C)Cc2cccs2)c1 ZINC000466669567 880454850 /nfs/dbraw/zinc/45/48/50/880454850.db2.gz SRYNVPJILQYZHT-UHFFFAOYSA-N 0 3 403.548 4.254 20 0 HIADHN Cc1ccc(-c2nc(CNC(=O)N3CC[C@@H](C)N(Cc4ccccc4)CC3)co2)cc1 ZINC000466755130 880535312 /nfs/dbraw/zinc/53/53/12/880535312.db2.gz XJXNOMHXBVLJEY-HXUWFJFHSA-N 0 3 418.541 4.456 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)NCc2ccc(-c3cccnc3)cc2)CC1 ZINC000466937642 880706096 /nfs/dbraw/zinc/70/60/96/880706096.db2.gz GPFLLBNANIHNIP-UHFFFAOYSA-N 0 3 404.514 4.148 20 0 HIADHN Cc1ccc([C@H]2OCCC[C@@H]2CNC(=O)N(CCN(C)C)Cc2ccccc2)cc1 ZINC000466949782 880726178 /nfs/dbraw/zinc/72/61/78/880726178.db2.gz FMWOTRCUPYFIEI-DNQXCXABSA-N 0 3 409.574 4.236 20 0 HIADHN C[C@@H](NC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1)c1ccc(-n2cccn2)cc1 ZINC000466964248 880758146 /nfs/dbraw/zinc/75/81/46/880758146.db2.gz JJRJRSCDILUYOJ-NHCUHLMSSA-N 0 3 417.557 4.239 20 0 HIADHN C[C@@H](NC(=O)N[C@H](CN(C)C)c1ccc(F)cc1)c1ccc(Br)cc1 ZINC000503541237 912603104 /nfs/dbraw/zinc/60/31/04/912603104.db2.gz GHXMQSYUGRJBOI-FZKQIMNGSA-N 0 3 408.315 4.251 20 0 HIADHN Cc1cc(N2CCSCC2)ccc1NC(=O)N[C@@H]1C[C@@H](C)N(Cc2ccccc2)C1 ZINC000467108826 880868514 /nfs/dbraw/zinc/86/85/14/880868514.db2.gz DLGFLDNVGXBNBX-TZIWHRDSSA-N 0 3 424.614 4.333 20 0 HIADHN COC[C@H]1CCCCN([C@H](C)C(=O)Nc2cccc(CSc3ccccn3)c2)C1 ZINC000467121820 880877648 /nfs/dbraw/zinc/87/76/48/880877648.db2.gz GXYXQDXMPQPQRS-QUCCMNQESA-N 0 3 413.587 4.449 20 0 HIADHN CC(C)C[C@@H]1CCN(CC(=O)N(Cc2nnc(-c3ccccc3Cl)o2)C2CC2)C1 ZINC000467173669 880901429 /nfs/dbraw/zinc/90/14/29/880901429.db2.gz BWEIYLNTMIOWPD-INIZCTEOSA-N 0 3 416.953 4.249 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)c1cncc(-c2ccccc2)c1 ZINC000467196192 880925359 /nfs/dbraw/zinc/92/53/59/880925359.db2.gz PBGANUXCWYGCPN-DEOSSOPVSA-N 0 3 400.526 4.270 20 0 HIADHN CC[C@@H](C(=O)Nc1ccc(Oc2ccccc2S(=O)(=O)CC)cc1)N(CC)CC ZINC000467219174 880948247 /nfs/dbraw/zinc/94/82/47/880948247.db2.gz SETZKRUJUVBVNB-IBGZPJMESA-N 0 3 418.559 4.331 20 0 HIADHN Cc1nc(-c2ccc(C)cc2NC(=O)CN2CCC[C@]2(C)Cc2ccccc2)n[nH]1 ZINC000467239360 880963872 /nfs/dbraw/zinc/96/38/72/880963872.db2.gz WFKLXVWNGQBQAL-XMMPIXPASA-N 0 3 403.530 4.124 20 0 HIADHN COC[C@H]1CCCCN(CC(=O)N[C@H](c2ccccc2)c2cccc(Cl)c2)C1 ZINC000467275439 881018541 /nfs/dbraw/zinc/01/85/41/881018541.db2.gz PVNHVLTVSPZZQP-FDDCHVKYSA-N 0 3 400.950 4.294 20 0 HIADHN Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)N1CC[C@H](N2CC=CC2)C1 ZINC000467276333 881021009 /nfs/dbraw/zinc/02/10/09/881021009.db2.gz AJQDWJKUDYOCET-FQEVSTJZSA-N 0 3 424.932 4.379 20 0 HIADHN O=[S@@](CCN(Cc1cccc(Br)c1)C1CCOCC1)c1ccccc1 ZINC000467292419 881040032 /nfs/dbraw/zinc/04/00/32/881040032.db2.gz UDZGCIAYRSNNMO-VWLOTQADSA-N 0 3 422.388 4.238 20 0 HIADHN CN(CCCC1CCOCC1)Cc1cccc(Br)c1OCC(C)(C)O ZINC000467366610 881139142 /nfs/dbraw/zinc/13/91/42/881139142.db2.gz PZHLGNMTGYPZOL-UHFFFAOYSA-N 0 3 414.384 4.237 20 0 HIADHN COc1cc2c(cc1OC)[C@@H](NCc1ccc(I)c(C)c1)CC2 ZINC000467380977 881157750 /nfs/dbraw/zinc/15/77/50/881157750.db2.gz HORVHOOANHBRRM-KRWDZBQOSA-N 0 3 423.294 4.394 20 0 HIADHN C[C@@H](NC1CC(C)(c2ccccc2)C1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000467416204 881204493 /nfs/dbraw/zinc/20/44/93/881204493.db2.gz FNICHONJPUDWPA-RMQJPMRHSA-N 0 3 413.370 4.412 20 0 HIADHN C[C@@H](NCc1cc(Cl)ccc1N1CCOCC1)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000467420355 881209292 /nfs/dbraw/zinc/20/92/92/881209292.db2.gz UNOZQQRUBHVTPW-OAHLLOKOSA-N 0 3 413.949 4.257 20 0 HIADHN C[C@@H]1[C@@H](N[C@H]2CCCc3ncc(C(F)(F)F)cc32)CC(=O)N1Cc1ccccc1 ZINC000467436706 881235279 /nfs/dbraw/zinc/23/52/79/881235279.db2.gz ZGEDREHQPBUKKZ-UAOJZALGSA-N 0 3 403.448 4.257 20 0 HIADHN CCc1noc(-c2ccc(C)c(NC(=O)N[C@@H]3C[C@@H](C)N(Cc4ccccc4)C3)c2)n1 ZINC000467458234 881266940 /nfs/dbraw/zinc/26/69/40/881266940.db2.gz FWYQNDFRPBFMOF-YLJYHZDGSA-N 0 3 419.529 4.392 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)[C@@H]1C[C@H]1c1ccc(F)cc1 ZINC000467476090 881294032 /nfs/dbraw/zinc/29/40/32/881294032.db2.gz NASYOAHUBYKCEC-BHIFYINESA-N 0 3 404.489 4.211 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)CCc1cccc(OC(C)(C)C)n1 ZINC000467518080 881334650 /nfs/dbraw/zinc/33/46/50/881334650.db2.gz ZYSFVNCYZASHQO-HXUWFJFHSA-N 0 3 409.574 4.315 20 0 HIADHN COc1ccc2c(c1)[C@H](N[C@@H]1CCCN(Cc3ccc(F)cc3F)C1=O)CCC2 ZINC000469113199 883203735 /nfs/dbraw/zinc/20/37/35/883203735.db2.gz VOHNTRBFKXSSRL-FGZHOGPDSA-N 0 3 400.469 4.132 20 0 HIADHN CN(C(=O)NCC1(c2cc(C(F)(F)F)ccc2Cl)CC1)[C@H]1CCN(C2CC2)C1 ZINC000469113638 883205762 /nfs/dbraw/zinc/20/57/62/883205762.db2.gz JQISJQAOOYWRAE-HNNXBMFYSA-N 0 3 415.887 4.269 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1c(C)cc(C)[nH]c1=O)c1ccc(C(F)(F)F)cc1 ZINC000469135731 883232117 /nfs/dbraw/zinc/23/21/17/883232117.db2.gz XJXQWWCTLBOIFT-KRWDZBQOSA-N 0 3 409.452 4.236 20 0 HIADHN COc1cccc([C@H](C)CCCC(=O)NCc2ccc(CN3CCN(C)CC3)cc2)c1 ZINC000469155419 883252333 /nfs/dbraw/zinc/25/23/33/883252333.db2.gz YJHXMBCOTUZQQA-OAQYLSRUSA-N 0 3 423.601 4.033 20 0 HIADHN COC(=O)[C@](C)(CN[C@H](C)C(=O)Nc1c(C)cc(C)cc1Cl)c1ccccc1 ZINC000469188167 883288172 /nfs/dbraw/zinc/28/81/72/883288172.db2.gz CTACYSITGHZBAT-OPAMFIHVSA-N 0 3 402.922 4.004 20 0 HIADHN Cc1nc2ccccn2c1CNC1(c2ccc(Br)cc2)CCOCC1 ZINC000469205248 883304997 /nfs/dbraw/zinc/30/49/97/883304997.db2.gz ILWBGSZYWGPRJF-UHFFFAOYSA-N 0 3 400.320 4.201 20 0 HIADHN CCc1n[nH]c(C(=O)N(CC)[C@H]2CCN([C@@H](C)c3ccccc3)C2)c1Br ZINC000469225252 883324274 /nfs/dbraw/zinc/32/42/74/883324274.db2.gz JEQCAXJFPHDNCX-HOCLYGCPSA-N 0 3 419.367 4.032 20 0 HIADHN CCc1n[nH]c(C(=O)N(CC)[C@H]2CCN([C@H](C)c3ccccc3)C2)c1Br ZINC000469225266 883325158 /nfs/dbraw/zinc/32/51/58/883325158.db2.gz JEQCAXJFPHDNCX-ZBFHGGJFSA-N 0 3 419.367 4.032 20 0 HIADHN COCCN1CCC(NC(=O)c2ccc(Oc3ccc(Cl)cc3)c(F)c2)CC1 ZINC000469235763 883334734 /nfs/dbraw/zinc/33/47/34/883334734.db2.gz KNHSBOGSYCEAOB-UHFFFAOYSA-N 0 3 406.885 4.112 20 0 HIADHN C[C@H](C(=O)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)N1CCCCCC1 ZINC000469249228 883346172 /nfs/dbraw/zinc/34/61/72/883346172.db2.gz RAUSEJVMFGYAJL-MRXNPFEDSA-N 0 3 412.405 4.339 20 0 HIADHN C[C@@H](NCc1ccc(S(C)(=O)=O)s1)[C@H](C)Oc1ccc(Cl)cc1Cl ZINC000469269700 883367993 /nfs/dbraw/zinc/36/79/93/883367993.db2.gz UWNSSPXRKHSFRR-MNOVXSKESA-N 0 3 408.372 4.404 20 0 HIADHN CCN(C(=O)c1ccc(OCC(F)(F)F)cn1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000469294516 883392714 /nfs/dbraw/zinc/39/27/14/883392714.db2.gz RFBJYIMAGUUYFS-WMZOPIPTSA-N 0 3 421.463 4.320 20 0 HIADHN CC(C)N(CCN(C)C)C(=O)CCCc1nnc(-c2ccc(Cl)cc2Cl)o1 ZINC000469310437 883409992 /nfs/dbraw/zinc/40/99/92/883409992.db2.gz WULSINKAWXFOGQ-UHFFFAOYSA-N 0 3 413.349 4.165 20 0 HIADHN COc1cccc([C@H](C)CCCC(=O)N2CCC(CN3C[C@H](C)O[C@@H](C)C3)CC2)c1 ZINC000469318095 883420445 /nfs/dbraw/zinc/42/04/45/883420445.db2.gz XBWFSHWSBRGLIF-HKBOAZHASA-N 0 3 416.606 4.317 20 0 HIADHN CN(C(=O)CCCc1nnc(-c2ccc(Cl)cc2Cl)o1)[C@@H]1CCN(C2CC2)C1 ZINC000469324341 883430665 /nfs/dbraw/zinc/43/06/65/883430665.db2.gz HZTQRCFHBSTPSB-OAHLLOKOSA-N 0 3 423.344 4.061 20 0 HIADHN CCN1CC[C@@H](N(C)S(=O)(=O)c2cc(Cl)ccc2OCC2CCC2)C[C@H]1C ZINC000469338993 883452117 /nfs/dbraw/zinc/45/21/17/883452117.db2.gz SOVXSLBUJVNBHQ-CRAIPNDOSA-N 0 3 414.999 4.012 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)Nc3cccc(Br)c3C)CC2)c1 ZINC000469416776 883592387 /nfs/dbraw/zinc/59/23/87/883592387.db2.gz UWSSAKTWABLAPI-UHFFFAOYSA-N 0 3 416.363 4.217 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)N[C@@H](C)c1ccc2c(c1)CCC(=O)N2 ZINC000469423644 883602420 /nfs/dbraw/zinc/60/24/20/883602420.db2.gz CNFBTANFPLTPDA-FDDCHVKYSA-N 0 3 422.573 4.088 20 0 HIADHN COc1ccc(-c2ncc(C(=O)Nc3ccc(C)cc3CN(C)C)s2)cc1OC ZINC000469428369 883611170 /nfs/dbraw/zinc/61/11/70/883611170.db2.gz PMCGMTRGGXXIMY-UHFFFAOYSA-N 0 3 411.527 4.450 20 0 HIADHN COc1cccc(COC[C@H](O)CN2CCC(=Cc3ccc(F)c(F)c3)CC2)c1 ZINC000469470658 883696499 /nfs/dbraw/zinc/69/64/99/883696499.db2.gz NENDCQGKUTYWAW-HXUWFJFHSA-N 0 3 403.469 4.030 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)Cc1csc(-c2ccccn2)n1 ZINC000469501396 883746036 /nfs/dbraw/zinc/74/60/36/883746036.db2.gz JUDKJFZATDFFHD-OAQYLSRUSA-N 0 3 408.571 4.020 20 0 HIADHN Cc1oc(-c2ccccc2)nc1CC(=O)N[C@H](CN(C)Cc1ccccc1)C(C)C ZINC000469504559 883751658 /nfs/dbraw/zinc/75/16/58/883751658.db2.gz HDMLRQFDHXPNGI-HSZRJFAPSA-N 0 3 405.542 4.465 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)c1cccc(Oc2cnccn2)c1 ZINC000469505580 883754992 /nfs/dbraw/zinc/75/49/92/883754992.db2.gz VNMLCPDQLKBLNL-QFIPXVFZSA-N 0 3 404.514 4.155 20 0 HIADHN C[C@H](CC(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1)c1c[nH]c2ccccc21 ZINC000469531358 883802169 /nfs/dbraw/zinc/80/21/69/883802169.db2.gz PUJONBFEHLLGML-VAMGGRTRSA-N 0 3 411.590 4.399 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)c1ccc(Br)c2c1OCCC2 ZINC000469538681 883806434 /nfs/dbraw/zinc/80/64/34/883806434.db2.gz XKTREWRSCOIZAT-UHFFFAOYSA-N 0 3 403.320 4.396 20 0 HIADHN Cc1cccc(NC(=O)N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)c1Br ZINC000469598187 883829249 /nfs/dbraw/zinc/82/92/49/883829249.db2.gz DOPSXJIHPXAUJH-IYBDPMFKSA-N 0 3 424.383 4.111 20 0 HIADHN Cc1ccn(-c2ccccc2NC(=O)N(CCN(C)C)Cc2ccc(F)cc2F)n1 ZINC000469643413 883845923 /nfs/dbraw/zinc/84/59/23/883845923.db2.gz KMXBTPHSHWAGAL-UHFFFAOYSA-N 0 3 413.472 4.055 20 0 HIADHN O=C(NCc1ccccc1-c1ccc(Cn2ccnc2)cc1)[C@H]1CCCc2[nH]cnc21 ZINC000469663225 883857086 /nfs/dbraw/zinc/85/70/86/883857086.db2.gz VNKSZTUZVXILSI-QFIPXVFZSA-N 0 3 411.509 4.058 20 0 HIADHN C[C@@H]1CC[C@@H](C)N1CC(=O)NC1(c2ccc(OCc3ccccc3)cc2)CCOCC1 ZINC000469683374 883867986 /nfs/dbraw/zinc/86/79/86/883867986.db2.gz XNVJNRDEQFWHDL-NHCUHLMSSA-N 0 3 422.569 4.260 20 0 HIADHN C[C@@H](N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1=O)c1cccc(-n2ccnc2)c1 ZINC000469767116 883937886 /nfs/dbraw/zinc/93/78/86/883937886.db2.gz YJVGQEQWLJLERH-DNVCBOLYSA-N 0 3 414.431 4.347 20 0 HIADHN CC[C@H](Cc1ccccc1)N(CC)C(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000469783753 883958636 /nfs/dbraw/zinc/95/86/36/883958636.db2.gz QHIYLKQBYKGQFI-XMMPIXPASA-N 0 3 423.601 4.196 20 0 HIADHN Cc1c2cc(Cl)ccc2oc1C(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000469836759 884018376 /nfs/dbraw/zinc/01/83/76/884018376.db2.gz QTAHJAIILODWBB-LJQANCHMSA-N 0 3 412.917 4.416 20 0 HIADHN O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)c1ccc(-c2ccccc2F)o1 ZINC000469843757 884026504 /nfs/dbraw/zinc/02/65/04/884026504.db2.gz TVVRPSSLINIBDG-LJQANCHMSA-N 0 3 408.473 4.107 20 0 HIADHN Cc1ccn(-c2ccccc2NC(=O)N(Cc2ccccc2)C2CCN(C)CC2)n1 ZINC000469851405 884036145 /nfs/dbraw/zinc/03/61/45/884036145.db2.gz ICLRAMAHQCRXJA-UHFFFAOYSA-N 0 3 403.530 4.309 20 0 HIADHN Cc1nc(-c2ccsc2)ccc1C(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000469857477 884042945 /nfs/dbraw/zinc/04/29/45/884042945.db2.gz VCTVPJJZRZPFNC-OAQYLSRUSA-N 0 3 421.566 4.139 20 0 HIADHN CC1CCN([C@H](CNC(=O)N2CC[C@@H](C)[C@H](n3ccnc3)C2)c2cccs2)CC1 ZINC000469863825 884051072 /nfs/dbraw/zinc/05/10/72/884051072.db2.gz SYJYWSBUGMXJME-VAMGGRTRSA-N 0 3 415.607 4.010 20 0 HIADHN CSc1ccc(Cl)c(C(=O)NC[C@@H]2CN(Cc3ccccc3)CCCO2)c1 ZINC000469868338 884057582 /nfs/dbraw/zinc/05/75/82/884057582.db2.gz AHONPHCEMVACGK-QGZVFWFLSA-N 0 3 404.963 4.083 20 0 HIADHN COc1cccc([C@@H](CNC(=O)NCCCSc2ccccc2)N2CCCC2)c1 ZINC000503692135 912796655 /nfs/dbraw/zinc/79/66/55/912796655.db2.gz IKXZXLCGKYINKZ-JOCHJYFZSA-N 0 3 413.587 4.314 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@H]2NC(=O)N2CCCN(Cc3ccccc3)CC2)cc1 ZINC000470052604 884300693 /nfs/dbraw/zinc/30/06/93/884300693.db2.gz BZEJDJWWOBKIQG-RPWUZVMVSA-N 0 3 407.558 4.133 20 0 HIADHN COc1ccccc1Oc1ccc(NC(=O)N(CCN(C)C)Cc2ccccn2)cc1 ZINC000503752021 912815779 /nfs/dbraw/zinc/81/57/79/912815779.db2.gz YPWNWETZZRSJJE-UHFFFAOYSA-N 0 3 420.513 4.478 20 0 HIADHN CC[C@@H](C)n1ncc(NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)c1C ZINC000470123752 884385555 /nfs/dbraw/zinc/38/55/55/884385555.db2.gz XQGLNMJTWRPVCR-UWTIGNOOSA-N 0 3 401.477 4.089 20 0 HIADHN Cc1ccc(CNCc2ccc(C(=O)OC(C)(C)C)cc2)c(-n2cc(Cl)cn2)n1 ZINC000470138182 884404723 /nfs/dbraw/zinc/40/47/23/884404723.db2.gz YCETWDKZNHJTQS-UHFFFAOYSA-N 0 3 412.921 4.474 20 0 HIADHN Cc1ccc(C2(C(=O)N[C@@H](CN(C)Cc3ccccc3)C(C)C)CCOCC2)cc1 ZINC000470164665 884439771 /nfs/dbraw/zinc/43/97/71/884439771.db2.gz WUVYJVDYNRXYCX-DEOSSOPVSA-N 0 3 408.586 4.316 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)C1(c2ccc(F)cc2)CCOCC1 ZINC000470164787 884440159 /nfs/dbraw/zinc/44/01/59/884440159.db2.gz AJTDCYQJLMTCNF-QHCPKHFHSA-N 0 3 412.549 4.147 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)[C@H](OC1CCOCC1)c1ccccc1 ZINC000470166770 884444908 /nfs/dbraw/zinc/44/49/08/884444908.db2.gz HZIBBXAZHYGJLI-LOSJGSFVSA-N 0 3 424.585 4.196 20 0 HIADHN C[C@H](NC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1)c1ccccc1-n1cccn1 ZINC000470189826 884487392 /nfs/dbraw/zinc/48/73/92/884487392.db2.gz ZEAALIREOWFYPO-SFTDATJTSA-N 0 3 417.557 4.239 20 0 HIADHN CCc1c(C(=O)NC[C@H](c2ccccc2)N2CCCC2)cnn1-c1ccccc1OC ZINC000470207592 884523996 /nfs/dbraw/zinc/52/39/96/884523996.db2.gz DUYVMZAQJRFAJK-HSZRJFAPSA-N 0 3 418.541 4.010 20 0 HIADHN Brc1cc2cccnc2c(CN2CCC[C@@H](c3nnc4ccccn43)C2)c1 ZINC000470211524 884532765 /nfs/dbraw/zinc/53/27/65/884532765.db2.gz IUZPWLCYZOEUSR-MRXNPFEDSA-N 0 3 422.330 4.420 20 0 HIADHN CC1CCN([C@H](CNC(=O)c2ccc(C(F)(F)F)[nH]c2=O)c2cccs2)CC1 ZINC000503853717 912842087 /nfs/dbraw/zinc/84/20/87/912842087.db2.gz BMOFCLBOSUCPQF-CQSZACIVSA-N 0 3 413.465 4.071 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)NCc1nnc(-c2ccccc2)s1 ZINC000470281177 884644632 /nfs/dbraw/zinc/64/46/32/884644632.db2.gz VJDHMKYPRYVFMH-FQEVSTJZSA-N 0 3 423.586 4.161 20 0 HIADHN Cc1coc(-c2ccc(C)c(NC(=O)NCC3(N4CCSCC4)CCCC3)c2)n1 ZINC000470291124 884665598 /nfs/dbraw/zinc/66/55/98/884665598.db2.gz RMQJOQWTEPDGQD-UHFFFAOYSA-N 0 3 414.575 4.442 20 0 HIADHN CC(C)[C@H]1CCC[C@@H](NC(=O)N(C)C2CCN(CCc3ccccn3)CC2)CC1 ZINC000470292978 884667734 /nfs/dbraw/zinc/66/77/34/884667734.db2.gz MFBDDDJHGFHPQS-RBBKRZOGSA-N 0 3 400.611 4.335 20 0 HIADHN Cc1cc(SC2CCCCC2)ccc1NC(=O)N1CCCN([C@H](C)CO)CC1 ZINC000470353604 884746220 /nfs/dbraw/zinc/74/62/20/884746220.db2.gz MJNDVQACCABALK-GOSISDBHSA-N 0 3 405.608 4.340 20 0 HIADHN O=C(CN[C@@H]1CCCc2ccc(Br)cc21)N[C@@H]1CCOc2ccccc21 ZINC000503907475 912860626 /nfs/dbraw/zinc/86/06/26/912860626.db2.gz DPDKHEPNNULLHQ-RTBURBONSA-N 0 3 415.331 4.056 20 0 HIADHN CC(C)N1CCN(CCCSc2nnc(-c3ccco3)n2-c2ccccc2)CC1 ZINC000470459853 884854313 /nfs/dbraw/zinc/85/43/13/884854313.db2.gz SSPTVEQGCAZZJF-UHFFFAOYSA-N 0 3 411.575 4.036 20 0 HIADHN C[C@H]1CN(C2CCOCC2)CCN1C(=O)CCCc1cc(Cl)sc1Cl ZINC000470478800 884867780 /nfs/dbraw/zinc/86/77/80/884867780.db2.gz YMCDQIIUZYPACY-ZDUSSCGKSA-N 0 3 405.391 4.089 20 0 HIADHN CCc1ccccc1NC(=O)C[C@H](C)N[C@H](Cn1ccccc1=O)c1ccccc1 ZINC000503937328 912872696 /nfs/dbraw/zinc/87/26/96/912872696.db2.gz MIJDBIWOTQISCG-WMZHIEFXSA-N 0 3 403.526 4.159 20 0 HIADHN C/C(=C\c1ccccc1C(F)(F)F)CN(C)[C@H](C)c1cccc(S(N)(=O)=O)c1 ZINC000503957114 912884051 /nfs/dbraw/zinc/88/40/51/912884051.db2.gz DXWXZZGHMPUEJY-ATGUSINASA-N 0 3 412.477 4.449 20 0 HIADHN CC(=O)c1cccc(OCCCC(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000470673775 885103157 /nfs/dbraw/zinc/10/31/57/885103157.db2.gz QRCQZLYKUYYKFA-QHCPKHFHSA-N 0 3 408.542 4.171 20 0 HIADHN CC1CCN(c2ccc(C(=O)N(C)[C@@H]3CCCN(Cc4ccccc4)C3)cn2)CC1 ZINC000470678941 885110288 /nfs/dbraw/zinc/11/02/88/885110288.db2.gz RVYMOPQIXUTHTQ-HSZRJFAPSA-N 0 3 406.574 4.055 20 0 HIADHN C[C@H](COc1ccc(F)cc1F)NC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470731072 885183016 /nfs/dbraw/zinc/18/30/16/885183016.db2.gz BTYAEOGDYYAKCN-XLIONFOSSA-N 0 3 417.500 4.038 20 0 HIADHN C[C@@H](C(=O)NCCc1nc2ccccc2s1)N1CCC(Cc2ccccc2)CC1 ZINC000470772574 885239647 /nfs/dbraw/zinc/23/96/47/885239647.db2.gz KXQXIMBTSCHQMF-SFHVURJKSA-N 0 3 407.583 4.298 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)Nc1cccc(CSc2ccccn2)c1 ZINC000504019690 912923653 /nfs/dbraw/zinc/92/36/53/912923653.db2.gz NACVKTVLKSGPNB-UHFFFAOYSA-N 0 3 421.570 4.365 20 0 HIADHN Cc1c(C2CC2)nc2ccc(Br)cc2c1C(=O)N1CCN2CCC1CC2 ZINC000470853504 885350797 /nfs/dbraw/zinc/35/07/97/885350797.db2.gz DXCQTDGKWUJREC-UHFFFAOYSA-N 0 3 414.347 4.103 20 0 HIADHN CO[C@@H](CNC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1)c1ccc(Cl)cc1 ZINC000470894997 885393957 /nfs/dbraw/zinc/39/39/57/885393957.db2.gz PRCLRYZXNIQARG-YADHBBJMSA-N 0 3 415.965 4.334 20 0 HIADHN COc1ccccc1[C@]1(C)C[C@@H]1NC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470895132 885394032 /nfs/dbraw/zinc/39/40/32/885394032.db2.gz RTVIAYFJDVMITN-PBXXJUDPSA-N 0 3 407.558 4.031 20 0 HIADHN C[C@@H](NC(=O)NC[C@@H](c1cccs1)N1CCCC1)c1ccccc1-n1cccn1 ZINC000470898328 885397654 /nfs/dbraw/zinc/39/76/54/885397654.db2.gz RJRYOVBIPZZROA-XLIONFOSSA-N 0 3 409.559 4.131 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCc1nnc(-c2ccccc2)s1)c1ccsc1 ZINC000470905659 885411200 /nfs/dbraw/zinc/41/12/00/885411200.db2.gz HOAJGKPHSJNNIY-KRWDZBQOSA-N 0 3 415.588 4.149 20 0 HIADHN C[C@@H]1[C@@H](C(F)(F)F)CCN1C[C@@H](O)COc1ccc(Cl)cc1Br ZINC000470962840 885461772 /nfs/dbraw/zinc/46/17/72/885461772.db2.gz YKLSTWSEAPWGNP-JLLWLGSASA-N 0 3 416.665 4.115 20 0 HIADHN CN1CCN(CC(=O)Nc2cc(C(F)(F)F)ccc2Cl)C2(CCCCC2)C1 ZINC000471041606 885553401 /nfs/dbraw/zinc/55/34/01/885553401.db2.gz PFHMZQGWUWABQJ-UHFFFAOYSA-N 0 3 403.876 4.248 20 0 HIADHN Cc1nc2cc(C(=O)Nc3ccnn3[C@H]3CCN(Cc4ccccc4)C3)ccc2o1 ZINC000471052215 885565689 /nfs/dbraw/zinc/56/56/89/885565689.db2.gz JEESFAMNBRYHDP-IBGZPJMESA-N 0 3 401.470 4.032 20 0 HIADHN Cc1nc2ccc(C(=O)Nc3ccnn3[C@@H]3CCN(Cc4ccccc4)C3)cc2o1 ZINC000471053206 885567942 /nfs/dbraw/zinc/56/79/42/885567942.db2.gz QTQQVAUPRZQFLY-LJQANCHMSA-N 0 3 401.470 4.032 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)Nc1ccccc1COCc1ccccc1 ZINC000504042289 912949693 /nfs/dbraw/zinc/94/96/93/912949693.db2.gz ZFBAZNQZEJHFKF-UHFFFAOYSA-N 0 3 418.541 4.394 20 0 HIADHN CCCCCc1nnc(NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)s1 ZINC000471128972 885666825 /nfs/dbraw/zinc/66/68/25/885666825.db2.gz JETDVEOCPCCZGM-UHFFFAOYSA-N 0 3 419.517 4.198 20 0 HIADHN C[C@H](NC(=O)C1(c2ccc(Cl)cc2)CCOCC1)[C@@H](c1ccccc1)N(C)C ZINC000471134034 885675488 /nfs/dbraw/zinc/67/54/88/885675488.db2.gz PSVMWQYZQZOLFK-UWJYYQICSA-N 0 3 400.950 4.196 20 0 HIADHN COc1ccc(C2(C(=O)N[C@H](C)[C@H](c3ccccc3)N(C)C)CCCC2)cc1OC ZINC000471139227 885680880 /nfs/dbraw/zinc/68/08/80/885680880.db2.gz DXZVVVXUYKDYPM-WZONZLPQSA-N 0 3 410.558 4.323 20 0 HIADHN COc1ccc(C2(C(=O)N[C@@H](C)[C@H](c3ccccc3)N(C)C)CCCC2)cc1OC ZINC000471139224 885681094 /nfs/dbraw/zinc/68/10/94/885681094.db2.gz DXZVVVXUYKDYPM-FDDCHVKYSA-N 0 3 410.558 4.323 20 0 HIADHN Cc1noc(C)c1CSc1ncccc1C(=O)N[C@H](C)[C@H](c1ccccc1)N(C)C ZINC000471141365 885685313 /nfs/dbraw/zinc/68/53/13/885685313.db2.gz UKUPLLBRJWRLHD-IIBYNOLFSA-N 0 3 424.570 4.400 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3ccc(C)c(OC)c3)c(OCC)c2)CC1 ZINC000471172005 885729937 /nfs/dbraw/zinc/72/99/37/885729937.db2.gz CYQJRTXABJOWKJ-UHFFFAOYSA-N 0 3 411.546 4.187 20 0 HIADHN CCc1ccc([C@H](CNC(=O)c2cc(NC(C)=O)cc(C(F)(F)F)c2)N(C)C)cc1 ZINC000471174320 885733922 /nfs/dbraw/zinc/73/39/22/885733922.db2.gz ZMWLCUQVNZSVJI-FQEVSTJZSA-N 0 3 421.463 4.259 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)CCC(=O)c3ccccc3)c(OCC)c2)CC1 ZINC000471173838 885734870 /nfs/dbraw/zinc/73/48/70/885734870.db2.gz UPNXQXGRKGFGPV-UHFFFAOYSA-N 0 3 423.557 4.219 20 0 HIADHN CCOc1cc(NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)ccc1OC ZINC000471202096 885772153 /nfs/dbraw/zinc/77/21/53/885772153.db2.gz DCBUFCODOGDWCJ-UHFFFAOYSA-N 0 3 415.456 4.021 20 0 HIADHN CCCCCn1cc(CNC(=O)NC[C@H](c2cccs2)N2CCCC2)c(C)n1 ZINC000504072157 912973184 /nfs/dbraw/zinc/97/31/84/912973184.db2.gz ZIBWKVAFUUAJJO-LJQANCHMSA-N 0 3 403.596 4.080 20 0 HIADHN COC1CCC(C)(CNC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)CC1 ZINC000471262430 885840665 /nfs/dbraw/zinc/84/06/65/885840665.db2.gz LZRFNGZTADFRKY-MNLRITNHSA-N 0 3 412.496 4.153 20 0 HIADHN CSc1nc(C(C)(C)C)nc(C)c1C(=O)N[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000471330441 885927136 /nfs/dbraw/zinc/92/71/36/885927136.db2.gz KKJXOYWSTSNGAG-AEFFLSMTSA-N 0 3 412.603 4.370 20 0 HIADHN O=C(c1csc(Cc2cccc(F)c2)n1)N1C[C@H]2CCCN2Cc2ccccc21 ZINC000504089493 912999908 /nfs/dbraw/zinc/99/99/08/912999908.db2.gz GZZDRVLRARTUJP-LJQANCHMSA-N 0 3 407.514 4.498 20 0 HIADHN C[C@H](NC(=O)Cc1csc(Cc2ccc(F)cc2)n1)[C@@H](c1ccccc1)N(C)C ZINC000471557843 886266905 /nfs/dbraw/zinc/26/69/05/886266905.db2.gz VHQNLELCFCEUTF-HJPURHCSSA-N 0 3 411.546 4.223 20 0 HIADHN CC(C)c1ccccc1NC(=O)C[C@H](C)NCc1n[nH]c(COc2ccccc2)n1 ZINC000471583886 886294526 /nfs/dbraw/zinc/29/45/26/886294526.db2.gz CMJOSJWEWSOUDD-KRWDZBQOSA-N 0 3 407.518 4.014 20 0 HIADHN C[C@H](NC(=O)N[C@H]1C[C@@H]1c1ccccc1OC(F)F)[C@@H](c1ccccc1)N(C)C ZINC000504126322 913030323 /nfs/dbraw/zinc/03/03/23/913030323.db2.gz WOJWAEURQHVEBJ-MKNHVETJSA-N 0 3 403.473 4.135 20 0 HIADHN C[C@@H](Cc1ccc(Br)cc1F)[NH2+]Cc1nnc(COc2ccccc2)[n-]1 ZINC000471613321 886328247 /nfs/dbraw/zinc/32/82/47/886328247.db2.gz JESHHKRBESTVKY-ZDUSSCGKSA-N 0 3 419.298 4.006 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)CS[C@H](C)c3nc4ccccc4[nH]3)c2)CC1 ZINC000471635713 886353553 /nfs/dbraw/zinc/35/35/53/886353553.db2.gz PAHREJXJJFMQOQ-QGZVFWFLSA-N 0 3 423.586 4.138 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)c3nccnc3Sc3ccccc3)c2)CC1 ZINC000471644838 886361114 /nfs/dbraw/zinc/36/11/14/886361114.db2.gz WSPRVNFAXPPVTI-UHFFFAOYSA-N 0 3 419.554 4.022 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)Cc3csc(-c4ccc(C)cc4)n3)c2)CC1 ZINC000471656391 886371936 /nfs/dbraw/zinc/37/19/36/886371936.db2.gz RTQVEUIJFMHDAU-UHFFFAOYSA-N 0 3 420.582 4.442 20 0 HIADHN COCCC[C@H](Cc1ccccc1)NC(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000471727772 886444822 /nfs/dbraw/zinc/44/48/22/886444822.db2.gz PSZGPMQTLAASJS-AGILITTLSA-N 0 3 409.574 4.159 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N[C@@H]1CCc2c1cccc2Cl ZINC000471731299 886449907 /nfs/dbraw/zinc/44/99/07/886449907.db2.gz IRLGNZLPKOVBQN-WTNGLUPJSA-N 0 3 415.887 4.432 20 0 HIADHN O=C(NCc1ccc(F)c(Cl)c1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000471825032 886571812 /nfs/dbraw/zinc/57/18/12/886571812.db2.gz IMGNKMMFAYXIHX-UHFFFAOYSA-N 0 3 407.839 4.084 20 0 HIADHN Cc1cn([C@@H](C)c2ccccc2)nc1NC(=O)N(CCN(C)C)Cc1cccs1 ZINC000471841906 886603648 /nfs/dbraw/zinc/60/36/48/886603648.db2.gz AYOLREZNBOAODS-SFHVURJKSA-N 0 3 411.575 4.458 20 0 HIADHN Cc1cn([C@H](C)c2ccccc2)nc1NC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000471855264 886625313 /nfs/dbraw/zinc/62/53/13/886625313.db2.gz FUSFASSYKQAILF-BVYCBKJFSA-N 0 3 403.530 4.368 20 0 HIADHN COC(=O)c1cc(NC(=O)N(Cc2ccccc2)C2CCN(C)CC2)c(C)cc1C ZINC000471876711 886656725 /nfs/dbraw/zinc/65/67/25/886656725.db2.gz YVNXNBYGXPPBOZ-UHFFFAOYSA-N 0 3 409.530 4.218 20 0 HIADHN Cc1ccc(C[C@H](C)NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)s1 ZINC000471913814 886699802 /nfs/dbraw/zinc/69/98/02/886699802.db2.gz ZBHNOKXSPQVQFG-JQRITLKVSA-N 0 3 403.514 4.092 20 0 HIADHN CN1CC[C@H](NC(=O)N[C@@H](c2c(F)cccc2F)C(F)(F)F)[C@H]1c1ccccc1 ZINC000471933000 886726726 /nfs/dbraw/zinc/72/67/26/886726726.db2.gz ZELONHLPCXFVKZ-JQHSSLGASA-N 0 3 413.390 4.313 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2cc(F)c(Br)cc2F)[C@H]1c1ccccc1 ZINC000471933512 886728378 /nfs/dbraw/zinc/72/83/78/886728378.db2.gz SOPXQEVCYYHMMU-DOTOQJQBSA-N 0 3 410.262 4.294 20 0 HIADHN Cc1cc(Br)c(F)cc1NC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000471942956 886742905 /nfs/dbraw/zinc/74/29/05/886742905.db2.gz GAILAZCMBVRANX-WMZOPIPTSA-N 0 3 406.299 4.464 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2ccc(OC(F)F)c3cccnc23)[C@@H]1c1ccccc1 ZINC000471952300 886760220 /nfs/dbraw/zinc/76/02/20/886760220.db2.gz MRPOJGSDNWBBKE-PXNSSMCTSA-N 0 3 412.440 4.403 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2ccccc2CC(=O)OC(C)(C)C)[C@@H]1c1ccccc1 ZINC000471985110 886812932 /nfs/dbraw/zinc/81/29/32/886812932.db2.gz JSKTVQBDMOLHJM-UNMCSNQZSA-N 0 3 409.530 4.138 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2ccc(OCc3ccccn3)c(F)c2)[C@@H]1c1ccccc1 ZINC000471996362 886822362 /nfs/dbraw/zinc/82/23/62/886822362.db2.gz WYMCKYMCVWOEPS-GMAHTHKFSA-N 0 3 420.488 4.367 20 0 HIADHN Cc1csc([C@H](NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)C2CC2)n1 ZINC000471997140 886823226 /nfs/dbraw/zinc/82/32/26/886823226.db2.gz GKUNRXFSGWHTLV-UYSNPLJNSA-N 0 3 416.513 4.007 20 0 HIADHN Cc1csc([C@@H](NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)C2CC2)n1 ZINC000471997137 886823243 /nfs/dbraw/zinc/82/32/43/886823243.db2.gz GKUNRXFSGWHTLV-GPANFISMSA-N 0 3 416.513 4.007 20 0 HIADHN Cc1ccc(CC[C@H](C)NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)o1 ZINC000472002189 886827415 /nfs/dbraw/zinc/82/74/15/886827415.db2.gz LSKDZBGKWGEAOE-IGEOTXOUSA-N 0 3 401.473 4.014 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)NCCc2ccccc2OC(F)F)CC1 ZINC000472019559 886841644 /nfs/dbraw/zinc/84/16/44/886841644.db2.gz AURWHDGCLMCNAL-UHFFFAOYSA-N 0 3 417.500 4.137 20 0 HIADHN CCn1nc(CNCCc2cn3cc(Br)cc(C)c3n2)c2ccccc21 ZINC000472036970 886856277 /nfs/dbraw/zinc/85/62/77/886856277.db2.gz GPUUUFCITAOPPQ-UHFFFAOYSA-N 0 3 412.335 4.107 20 0 HIADHN CCn1nc(CN[C@@H]2CCN(CC)[C@@H]2c2cc(F)c(F)c(F)c2)c2ccccc21 ZINC000472041994 886859127 /nfs/dbraw/zinc/85/91/27/886859127.db2.gz BFNIVUKZLKOVOQ-XMSQKQJNSA-N 0 3 402.464 4.399 20 0 HIADHN CCOCCC1(CNC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)CCCC1 ZINC000472064573 886872477 /nfs/dbraw/zinc/87/24/77/886872477.db2.gz SWWBDRRBRBZPDA-UHFFFAOYSA-N 0 3 419.532 4.078 20 0 HIADHN C[C@H](CCN1CCN(C)CC1)NC(=O)c1cc(Cl)ccc1Sc1ccccc1 ZINC000472096216 886890830 /nfs/dbraw/zinc/89/08/30/886890830.db2.gz RQAHBECZZSQDBQ-QGZVFWFLSA-N 0 3 418.006 4.247 20 0 HIADHN COc1ccc(F)c(C(=O)NC[C@@H](c2ccccc2)N2CCC(C)CC2)c1OC ZINC000472137969 886932063 /nfs/dbraw/zinc/93/20/63/886932063.db2.gz HQCXLTUTXMSNQZ-IBGZPJMESA-N 0 3 400.494 4.046 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)N[C@@H]3CC[N@@H+]([C@H](C)c4ccccc4)C3)cc2)cc(=O)[n-]1 ZINC000504234922 913107051 /nfs/dbraw/zinc/10/70/51/913107051.db2.gz FLTGQPFWSOEDSD-IIBYNOLFSA-N 0 3 417.513 4.115 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)N[C@@H]3CC[N@H+]([C@H](C)c4ccccc4)C3)cc2)cc(=O)[n-]1 ZINC000504234922 913107063 /nfs/dbraw/zinc/10/70/63/913107063.db2.gz FLTGQPFWSOEDSD-IIBYNOLFSA-N 0 3 417.513 4.115 20 0 HIADHN O=C(NC[C@@H]1CCCCN1CCCc1nc(-c2cccs2)no1)c1ccccc1 ZINC000472268434 887083043 /nfs/dbraw/zinc/08/30/43/887083043.db2.gz GZCDYHWFOVYGEX-SFHVURJKSA-N 0 3 410.543 4.015 20 0 HIADHN O=C(CCN1CCCC[C@H]1CNC(=O)c1ccccc1)Nc1ccc(Cl)cc1F ZINC000472277921 887093385 /nfs/dbraw/zinc/09/33/85/887093385.db2.gz OKXMHVFYKIMILN-SFHVURJKSA-N 0 3 417.912 4.092 20 0 HIADHN CC(=O)N(Cc1ccc(NC(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)cc1)C(C)C ZINC000472309671 887137310 /nfs/dbraw/zinc/13/73/10/887137310.db2.gz DKKKDWOOBIMSKP-DHIUTWEWSA-N 0 3 408.546 4.010 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2ccc3oc(C(F)(F)F)nc3c2)[C@H]1c1ccccc1 ZINC000472316220 887148488 /nfs/dbraw/zinc/14/84/88/887148488.db2.gz DTXHOALTRUASFF-RHSMWYFYSA-N 0 3 404.392 4.414 20 0 HIADHN COc1ccc(NC(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)c(Br)c1 ZINC000472319755 887152165 /nfs/dbraw/zinc/15/21/65/887152165.db2.gz VLAYPEOLHZRTEE-MSOLQXFVSA-N 0 3 404.308 4.025 20 0 HIADHN CCN(CC)C(=O)c1ccc(NC(=O)CN2CC[C@H](Cc3ccccc3)[C@@H]2C)cc1 ZINC000472343434 887178898 /nfs/dbraw/zinc/17/88/98/887178898.db2.gz AHFFMPXYTAORKL-SIKLNZKXSA-N 0 3 407.558 4.060 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)NCC1(c2ccc(Cl)cc2)CCCC1 ZINC000504254509 913120136 /nfs/dbraw/zinc/12/01/36/913120136.db2.gz NMLMKNMPOIJQTB-UHFFFAOYSA-N 0 3 414.981 4.320 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)NCc1ccc(Oc2ccccc2)cc1 ZINC000504269677 913129428 /nfs/dbraw/zinc/12/94/28/913129428.db2.gz BVZDLSIDLYYMPB-UHFFFAOYSA-N 0 3 404.514 4.147 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)NCC1(c2ccc(F)cc2)CCCCC1 ZINC000504276922 913131229 /nfs/dbraw/zinc/13/12/29/913131229.db2.gz LLHZBDRVPGJSAE-UHFFFAOYSA-N 0 3 412.553 4.196 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N(Cc1ccccc1F)C1CC1 ZINC000472446600 887298514 /nfs/dbraw/zinc/29/85/14/887298514.db2.gz ADZFKGSWDUFFDD-UHFFFAOYSA-N 0 3 413.459 4.305 20 0 HIADHN CN(CCc1ccc(Cl)cc1)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472455363 887309103 /nfs/dbraw/zinc/30/91/03/887309103.db2.gz UOCVPYUNMHRRIS-UHFFFAOYSA-N 0 3 417.903 4.329 20 0 HIADHN C[C@H]1[C@@H](C(F)(F)F)CCCN1C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472457031 887312657 /nfs/dbraw/zinc/31/26/57/887312657.db2.gz UEBYWBSFYSRKMO-LLGZUXRYSA-N 0 3 415.422 4.164 20 0 HIADHN COCCC[C@H](Cc1ccccc1)NC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C ZINC000472458683 887314878 /nfs/dbraw/zinc/31/48/78/887314878.db2.gz YQCGJQXFNPZCQX-WIOPSUGQSA-N 0 3 423.601 4.330 20 0 HIADHN COCCC[C@H](Cc1ccccc1)NC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000472461517 887319809 /nfs/dbraw/zinc/31/98/09/887319809.db2.gz IDHPTWNDVJLWGC-RPBOFIJWSA-N 0 3 423.601 4.330 20 0 HIADHN Cc1ccc(C[C@H](C)N(C)C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cc1 ZINC000472461824 887319913 /nfs/dbraw/zinc/31/99/13/887319913.db2.gz CXVULCBSJZRFNM-DZIBYMRMSA-N 0 3 411.512 4.373 20 0 HIADHN C[C@@H]1C[C@H](c2ccccc2)CN1C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472467604 887327659 /nfs/dbraw/zinc/32/76/59/887327659.db2.gz ZWHKDILIJATQEC-CAJUJLTQSA-N 0 3 409.496 4.379 20 0 HIADHN CN(CC(=O)Nc1ccccc1C(F)(F)F)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000472473007 887333930 /nfs/dbraw/zinc/33/39/30/887333930.db2.gz YDZVEIVKLZDSBU-SFHVURJKSA-N 0 3 405.464 4.240 20 0 HIADHN Cc1ccc([C@H](NC(=O)N(CCN(C)C)Cc2cccs2)c2ccccn2)cc1 ZINC000472488022 887355631 /nfs/dbraw/zinc/35/56/31/887355631.db2.gz RIXQRRHMJVGXJM-QFIPXVFZSA-N 0 3 408.571 4.314 20 0 HIADHN Cc1[nH]c2ccccc2c1C1=CCN(C[C@H](O)COc2cccc3[nH]ccc32)CC1 ZINC000472580347 887461108 /nfs/dbraw/zinc/46/11/08/887461108.db2.gz JTXIDYQATORLOH-IBGZPJMESA-N 0 3 401.510 4.487 20 0 HIADHN CN(C(=O)Nc1cccc(OC[C@@H]2CCCO2)c1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000472687356 887541298 /nfs/dbraw/zinc/54/12/98/887541298.db2.gz YULVJTJQWKSZFS-VWNXMTODSA-N 0 3 423.557 4.373 20 0 HIADHN CN(C(=O)Nc1cccc(C(=O)NC(C)(C)C)c1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000472694263 887548167 /nfs/dbraw/zinc/54/81/67/887548167.db2.gz UHOPXEXTAZQHNR-JOCHJYFZSA-N 0 3 422.573 4.343 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)[C@H](C)CC(=O)c3ccc(Cl)cc3)c2)CC1 ZINC000472731593 887579558 /nfs/dbraw/zinc/57/95/58/887579558.db2.gz DLQHRYLOFBPWGZ-QGZVFWFLSA-N 0 3 413.949 4.330 20 0 HIADHN CN(C(=O)Nc1ccc(N2CCCC2=O)c(F)c1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000472744887 887589102 /nfs/dbraw/zinc/58/91/02/887589102.db2.gz CVGKKVQWNJFUOA-FQEVSTJZSA-N 0 3 424.520 4.081 20 0 HIADHN CC(C)C(=O)Nc1cccc(NC(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000472765655 887611659 /nfs/dbraw/zinc/61/16/59/887611659.db2.gz RYKZGIOFIVZVLY-JOCHJYFZSA-N 0 3 408.546 4.409 20 0 HIADHN CN1CC[C@H](NC(=O)NCC2(CCOCc3ccccc3)CC2)[C@H]1c1ccccc1 ZINC000472775778 887622049 /nfs/dbraw/zinc/62/20/49/887622049.db2.gz IQNIXXKPBSBAMJ-XZOQPEGZSA-N 0 3 407.558 4.118 20 0 HIADHN CN(C)[C@H](CNC(=O)Nc1ccc(F)cc1-c1nc(C2CC2)no1)Cc1ccccc1 ZINC000472853041 887707286 /nfs/dbraw/zinc/70/72/86/887707286.db2.gz RHCSCNGFGWCTNY-SFHVURJKSA-N 0 3 423.492 4.048 20 0 HIADHN COc1cc(NC(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)ccc1Br ZINC000472863283 887719010 /nfs/dbraw/zinc/71/90/10/887719010.db2.gz NDLUVAWOWUJBHK-RHSMWYFYSA-N 0 3 418.335 4.415 20 0 HIADHN C[C@@H](CCN1CCN(C)CC1)NC(=O)N[C@H](CC(C)(C)C)c1ccc(Cl)cc1 ZINC000472903557 887750638 /nfs/dbraw/zinc/75/06/38/887750638.db2.gz KRIQBXCYJBJYGM-FXAWDEMLSA-N 0 3 409.018 4.143 20 0 HIADHN CC(C)CC[C@H](NC(=O)N[C@H](C)CCN1CCN(C)CC1)c1ccc(Cl)cc1 ZINC000472918299 887764013 /nfs/dbraw/zinc/76/40/13/887764013.db2.gz BAZRHIGQZRIQHO-NQIIRXRSSA-N 0 3 409.018 4.143 20 0 HIADHN C[C@@H](CCN1CCN(C)CC1)NC(=O)N(Cc1ccccc1)[C@@H](C)c1cccs1 ZINC000472920178 887765962 /nfs/dbraw/zinc/76/59/62/887765962.db2.gz VEUWJDUHOIEBHL-PMACEKPBSA-N 0 3 414.619 4.047 20 0 HIADHN CC1CCC(N2CCN([C@H]3CCN(c4ccccc4C(F)(F)F)C3=O)CC2)CC1 ZINC000473053041 887875240 /nfs/dbraw/zinc/87/52/40/887875240.db2.gz RHOQNSZWBZRFEH-UHYCVJNDSA-N 0 3 409.496 4.007 20 0 HIADHN O[C@@H](COc1ccc(Oc2ccccc2)cc1)CN1CC[C@@]2(C1)OCc1ccccc12 ZINC000473159369 887938201 /nfs/dbraw/zinc/93/82/01/887938201.db2.gz HJWNDKYHEAIHPF-RLWLMLJZSA-N 0 3 417.505 4.350 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)C3(Cc4ccccc4Cl)CC3)CC2)C[C@@H](C)O1 ZINC000473185029 887965146 /nfs/dbraw/zinc/96/51/46/887965146.db2.gz VZSYUHBDSBVWNY-QZTJIDSGSA-N 0 3 404.982 4.011 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)CCC(=O)c1ccc(F)cc1F ZINC000473280117 888034960 /nfs/dbraw/zinc/03/49/60/888034960.db2.gz YNRJTVBGMCBHSV-CZKAHXPPSA-N 0 3 414.496 4.201 20 0 HIADHN C[C@@H](CCN1CCN(C)CC1)NC(=O)Nc1ccc(-c2nc3ccccc3s2)cc1 ZINC000473498208 888221374 /nfs/dbraw/zinc/22/13/74/888221374.db2.gz NSLPKCGVLYPUJK-KRWDZBQOSA-N 0 3 423.586 4.111 20 0 HIADHN COc1ccc(C2(C(=O)NC3CC(N4CCC(C(F)(F)F)CC4)C3)CCC2)cc1 ZINC000473514276 888245945 /nfs/dbraw/zinc/24/59/45/888245945.db2.gz RHDRZURHWMEKOG-UHFFFAOYSA-N 0 3 410.480 4.038 20 0 HIADHN C[C@@H]1CCc2c(C(=O)NC3CC(N4CCC(C(F)(F)F)CC4)C3)csc2C1 ZINC000473515666 888247579 /nfs/dbraw/zinc/24/75/79/888247579.db2.gz ZPBIPTDSPMGIOG-LRVUVFPRSA-N 0 3 400.510 4.408 20 0 HIADHN COc1ccc(C2(C(=O)NC3CC(N4CCC(C(F)(F)F)CC4)C3)CCCC2)cc1 ZINC000473520403 888253692 /nfs/dbraw/zinc/25/36/92/888253692.db2.gz HWRHUQAZMSPJBH-UHFFFAOYSA-N 0 3 424.507 4.429 20 0 HIADHN Cc1c(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cnn1C1CCCCC1 ZINC000473522954 888258812 /nfs/dbraw/zinc/25/88/12/888258812.db2.gz MUTYQLLFGJOOPN-UHFFFAOYSA-N 0 3 412.500 4.232 20 0 HIADHN C[C@@H](CC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1ccc(F)cc1F ZINC000473527761 888265034 /nfs/dbraw/zinc/26/50/34/888265034.db2.gz UFVOCTSQZZGHLQ-JQRITLKVSA-N 0 3 404.423 4.380 20 0 HIADHN C[C@@H](Oc1cccc(Cl)c1)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473528634 888265320 /nfs/dbraw/zinc/26/53/20/888265320.db2.gz UEMLSHPBVCUWLL-UWTIGNOOSA-N 0 3 404.860 4.029 20 0 HIADHN O=C(CCCOc1ccccc1Cl)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473528152 888265608 /nfs/dbraw/zinc/26/56/08/888265608.db2.gz HKNKEWFFRCKXNN-UHFFFAOYSA-N 0 3 418.887 4.421 20 0 HIADHN CC(C)CN(C)c1ccc(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cc1 ZINC000473532786 888269809 /nfs/dbraw/zinc/26/98/09/888269809.db2.gz RLMBPQYHOMJKRV-UHFFFAOYSA-N 0 3 411.512 4.314 20 0 HIADHN CCc1nc2cc(CNC(=O)NC[C@@H](N[C@H](C)CC)c3ccco3)ccc2n1C1CC1 ZINC000504417826 913233412 /nfs/dbraw/zinc/23/34/12/913233412.db2.gz FNEOBVQISFNCGB-OXQOHEQNSA-N 0 3 423.561 4.455 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)N[C@H](CC(C)(C)C)c1ccc(F)cc1 ZINC000504423239 913238954 /nfs/dbraw/zinc/23/89/54/913238954.db2.gz XLWCWNLBOJDRKQ-OAQYLSRUSA-N 0 3 400.542 4.471 20 0 HIADHN COc1ccc(SCCCC(=O)N(Cc2ccco2)C2CCN(C)CC2)cc1 ZINC000473620144 888360376 /nfs/dbraw/zinc/36/03/76/888360376.db2.gz SQVAIUVBZFSQQP-UHFFFAOYSA-N 0 3 402.560 4.284 20 0 HIADHN CCOc1cccc2cc([C@@H](C)NC(=O)N(CCN(C)C)Cc3ccccn3)oc21 ZINC000504428659 913241795 /nfs/dbraw/zinc/24/17/95/913241795.db2.gz FQVGONYPFABCND-QGZVFWFLSA-N 0 3 410.518 4.061 20 0 HIADHN C[C@H](CCN1CCN(C)CC1)NC(=O)Nc1ccc(Oc2cccc(Cl)c2)cc1 ZINC000473656422 888406990 /nfs/dbraw/zinc/40/69/90/888406990.db2.gz GHRLSEZWJYRYLD-QGZVFWFLSA-N 0 3 416.953 4.280 20 0 HIADHN Cc1cccc(COc2ccc(NC(=O)N[C@H](C)CCN3CCN(C)CC3)c(C)c2)c1 ZINC000473672894 888434778 /nfs/dbraw/zinc/43/47/78/888434778.db2.gz COCRZAJXYVKUNZ-OAQYLSRUSA-N 0 3 424.589 4.030 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)N[C@H]1C[C@H](c2ccc(OC)c(F)c2)C1)c1ccco1 ZINC000504433445 913245221 /nfs/dbraw/zinc/24/52/21/913245221.db2.gz IIQYNOXYHVSTMY-MYZZLAAOSA-N 0 3 403.498 4.102 20 0 HIADHN CN1CCN(CCC(C)(C)NC(=O)Nc2c(F)cccc2Oc2ccccc2)CC1 ZINC000473685954 888455968 /nfs/dbraw/zinc/45/59/68/888455968.db2.gz KJYPXLFBIGLTCA-UHFFFAOYSA-N 0 3 414.525 4.156 20 0 HIADHN CCCN(C(=O)NCC1(CCOC)CCC1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000473718333 888496230 /nfs/dbraw/zinc/49/62/30/888496230.db2.gz ODGRZPFAAHMJMZ-QFIPXVFZSA-N 0 3 401.595 4.279 20 0 HIADHN Cc1ccc2nc(C3CC3)cc(C(=O)N3CCC(CN4C[C@@H](C)O[C@@H](C)C4)CC3)c2c1 ZINC000473726414 888502963 /nfs/dbraw/zinc/50/29/63/888502963.db2.gz UBPDBBRYZFPQDM-KDURUIRLSA-N 0 3 421.585 4.382 20 0 HIADHN O[C@H](CN1CCN(CCOC(c2ccccc2)c2ccccc2)CC1)C1CCCCC1 ZINC000473772708 888572417 /nfs/dbraw/zinc/57/24/17/888572417.db2.gz XOUOWVPPMLFXEG-AREMUKBSSA-N 0 3 422.613 4.351 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@@H](c3ccccc3)c3ccncc3)c2)CC1 ZINC000473808497 888632865 /nfs/dbraw/zinc/63/28/65/888632865.db2.gz OZWGJBSGQCDBBU-DEOSSOPVSA-N 0 3 415.541 4.135 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CCCCC[C@@H]3c3ccncc3)c2)CC1 ZINC000473820367 888650361 /nfs/dbraw/zinc/65/03/61/888650361.db2.gz PEGAVFRZLXWVCW-HSZRJFAPSA-N 0 3 407.562 4.373 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@H](C)c3ncc(-c4ccccc4)o3)c2)CC1 ZINC000473826150 888659995 /nfs/dbraw/zinc/65/99/95/888659995.db2.gz DLJVUWPDVJWXMP-GOSISDBHSA-N 0 3 419.529 4.366 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CC[C@H](c4c(F)cccc4F)C3)c2)CC1 ZINC000473828421 888661853 /nfs/dbraw/zinc/66/18/53/888661853.db2.gz JWFARIPVJKRQML-KRWDZBQOSA-N 0 3 414.500 4.128 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CCC[C@H]3c3cccc(N(C)C)c3)c2)CC1 ZINC000473829714 888663473 /nfs/dbraw/zinc/66/34/73/888663473.db2.gz NLDITSGYWLGTOE-DEOSSOPVSA-N 0 3 421.589 4.264 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CCC[C@@H]3c3ccccc3OC)c2)CC1 ZINC000473838468 888678644 /nfs/dbraw/zinc/67/86/44/888678644.db2.gz WUABBFMNZLYSRZ-JOCHJYFZSA-N 0 3 408.546 4.206 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@@H](C)c3cccc(N4CCCC4)c3)c2)CC1 ZINC000473839435 888681083 /nfs/dbraw/zinc/68/10/83/888681083.db2.gz IWFPABIHYDUCSC-FQEVSTJZSA-N 0 3 421.589 4.311 20 0 HIADHN CN(C)[C@H](CNC(=O)N[C@H](c1cccc(Cl)c1)c1ccccn1)c1ccccc1 ZINC000473875289 888737329 /nfs/dbraw/zinc/73/73/29/888737329.db2.gz KZWDLWOPBULLFX-FGZHOGPDSA-N 0 3 408.933 4.427 20 0 HIADHN CCOc1cccc2[nH]cc(CC(=O)N(Cc3ccccc3)C3CCN(C)CC3)c21 ZINC000473884900 888751381 /nfs/dbraw/zinc/75/13/81/888751381.db2.gz IVCFLECCLZJDBS-UHFFFAOYSA-N 0 3 405.542 4.232 20 0 HIADHN Cc1ccc(-c2cc(C(=O)N3CCC(CCN4C[C@H](C)O[C@@H](C)C4)CC3)[nH]n2)cc1C ZINC000473918078 888800451 /nfs/dbraw/zinc/80/04/51/888800451.db2.gz AEMXFQRATHQJAD-PMACEKPBSA-N 0 3 424.589 4.045 20 0 HIADHN C[C@H](NC(=O)N(C)C1CCN(CCc2ccccn2)CC1)c1cc2cccc(F)c2o1 ZINC000473928953 888808366 /nfs/dbraw/zinc/80/83/66/888808366.db2.gz RUMMFXTUSMKPGG-KRWDZBQOSA-N 0 3 424.520 4.376 20 0 HIADHN C[C@H](NC(=O)NC(C)(C)CCN1CCN(C)CC1)c1ccccc1Oc1ccccc1 ZINC000473937415 888815636 /nfs/dbraw/zinc/81/56/36/888815636.db2.gz MLIAZCCDVUIIMP-FQEVSTJZSA-N 0 3 424.589 4.255 20 0 HIADHN CC[C@H](NCc1nc2ccc(OC)cc2s1)[C@H](c1ccc(C)cc1)n1cncn1 ZINC000473993054 888853720 /nfs/dbraw/zinc/85/37/20/888853720.db2.gz GTFHIMNYWBFCBI-AVRDEDQJSA-N 0 3 407.543 4.363 20 0 HIADHN Cn1nnc2cc(CN[C@@H](Cc3ccccn3)c3ccc(Br)cc3)ccc21 ZINC000474003309 888861418 /nfs/dbraw/zinc/86/14/18/888861418.db2.gz UKWVHUDYEHRPCY-IBGZPJMESA-N 0 3 422.330 4.199 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N[C@@H](C)c2noc(-c3ccccc3)n2)N2CCCC2)cc1 ZINC000474015761 888870200 /nfs/dbraw/zinc/87/02/00/888870200.db2.gz WHWRMAJKBAHVPG-RXVVDRJESA-N 0 3 419.529 4.242 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N[C@H](C)c2noc(-c3ccccc3)n2)N2CCCC2)cc1 ZINC000474015763 888870580 /nfs/dbraw/zinc/87/05/80/888870580.db2.gz WHWRMAJKBAHVPG-WIYYLYMNSA-N 0 3 419.529 4.242 20 0 HIADHN COc1ccc2c(c1)C(C)(C)C[C@H]2N[C@H](C)c1cccc(S(=O)(=O)N(C)C)c1 ZINC000474048477 888888751 /nfs/dbraw/zinc/88/87/51/888888751.db2.gz WZIXIHIFFITWOE-QVKFZJNVSA-N 0 3 402.560 4.019 20 0 HIADHN C[C@@H](NC(=O)c1ccc2c(c1)[nH]c(=O)n2C1CCCC1)[C@H](c1ccccc1)N(C)C ZINC000474178128 889016483 /nfs/dbraw/zinc/01/64/83/889016483.db2.gz QIOUVTZDKCRIBR-OPAMFIHVSA-N 0 3 406.530 4.278 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N[C@H](CO)c2c(Cl)cccc2Cl)C1 ZINC000474180205 889018471 /nfs/dbraw/zinc/01/84/71/889018471.db2.gz CVIWDFUNNYBILS-IDHHARJASA-N 0 3 422.356 4.162 20 0 HIADHN CC(C)(O)CN1CCc2c(cccc2NC(=O)C2(CCOCc3ccccc3)CC2)C1 ZINC000474228766 889069473 /nfs/dbraw/zinc/06/94/73/889069473.db2.gz UHYOSJDQYBPZHN-UHFFFAOYSA-N 0 3 422.569 4.141 20 0 HIADHN CN(Cc1csc(CC(=O)Nc2ccccc2)n1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000474228083 889069539 /nfs/dbraw/zinc/06/95/39/889069539.db2.gz FJGLKZORBUSNHU-QFIPXVFZSA-N 0 3 420.582 4.031 20 0 HIADHN COc1ccc(CC2CCN([C@@H](C)C(=O)NCCc3c[nH]c4ccccc34)CC2)cc1 ZINC000504528410 913308869 /nfs/dbraw/zinc/30/88/69/913308869.db2.gz VXJRALOOHPLHJQ-IBGZPJMESA-N 0 3 419.569 4.178 20 0 HIADHN Cc1ccc(-c2cc(C(=O)NC3CCN([C@@H](C)c4ccncc4)CC3)[nH]n2)cc1C ZINC000474250743 889102042 /nfs/dbraw/zinc/10/20/42/889102042.db2.gz MQJHPSVKTULIAC-SFHVURJKSA-N 0 3 403.530 4.044 20 0 HIADHN CCO[C@@H](C)c1noc(CN2CCN(C[C@@H](CC(C)C)c3ccccc3)CC2)n1 ZINC000474267682 889129145 /nfs/dbraw/zinc/12/91/45/889129145.db2.gz NODZCXGLXSUVJC-PZJWPPBQSA-N 0 3 400.567 4.115 20 0 HIADHN Cc1c(N[C@H](C)C(C)C)cccc1C(=O)Nc1ccc2oc(=O)n(CCN(C)C)c2c1 ZINC000474289103 889155331 /nfs/dbraw/zinc/15/53/31/889155331.db2.gz CZPZIIYHEKLJJN-QGZVFWFLSA-N 0 3 424.545 4.173 20 0 HIADHN CN(C)Cc1ccccc1CNC(=O)c1ccc(NC(=O)Nc2ccccc2)s1 ZINC000474310462 889177234 /nfs/dbraw/zinc/17/72/34/889177234.db2.gz HBQAXIFNYUSJQL-UHFFFAOYSA-N 0 3 408.527 4.384 20 0 HIADHN COc1ccc2nc(CNC[C@H](c3ccccc3Cl)N3CCOCC3)sc2c1 ZINC000474339721 889212988 /nfs/dbraw/zinc/21/29/88/889212988.db2.gz CAKQCZVCBJHPSB-LJQANCHMSA-N 0 3 417.962 4.121 20 0 HIADHN COc1ccc2nc(CNC3CCN(c4ccc(C(F)(F)F)cn4)CC3)sc2c1 ZINC000474366603 889243769 /nfs/dbraw/zinc/24/37/69/889243769.db2.gz BQXDJTSPLSEVFA-UHFFFAOYSA-N 0 3 422.476 4.477 20 0 HIADHN CCc1onc(-c2ccccc2Cl)c1C(=O)NC[C@H](Cc1ccccc1)N(C)C ZINC000474369414 889247496 /nfs/dbraw/zinc/24/74/96/889247496.db2.gz AUYPZXFOVZVQSQ-KRWDZBQOSA-N 0 3 411.933 4.460 20 0 HIADHN CC(C)c1nc2c([nH]1)C[C@H](C(=O)NC1CCN(Cc3ccc(Cl)cc3)CC1)CC2 ZINC000474393117 889264486 /nfs/dbraw/zinc/26/44/86/889264486.db2.gz WLHCMCONIYHGSH-QGZVFWFLSA-N 0 3 414.981 4.072 20 0 HIADHN CC(C)c1nc2c([nH]1)CC[C@@H](C(=O)NC1CCN(Cc3ccc(Cl)cc3)CC1)C2 ZINC000474393117 889264495 /nfs/dbraw/zinc/26/44/95/889264495.db2.gz WLHCMCONIYHGSH-QGZVFWFLSA-N 0 3 414.981 4.072 20 0 HIADHN Fc1cc2c(cc1Br)[C@@H](NC1CCN(CCC(F)(F)F)CC1)CO2 ZINC000504554383 913328575 /nfs/dbraw/zinc/32/85/75/913328575.db2.gz KXIGTDSEIZMPOA-AWEZNQCLSA-N 0 3 411.237 4.028 20 0 HIADHN CC(C)c1nc2c([nH]1)CC[C@H](C(=O)N[C@H](c1ccccc1)c1ccc3nc[nH]c3c1)C2 ZINC000474428538 889293241 /nfs/dbraw/zinc/29/32/41/889293241.db2.gz UUQWUBIJTAITLY-FDDCHVKYSA-N 0 3 413.525 4.420 20 0 HIADHN C[C@H](NC(=O)Nc1nnc(Cc2cccc(F)c2)s1)[C@@H](c1ccccc1)N(C)C ZINC000474434112 889299103 /nfs/dbraw/zinc/29/91/03/889299103.db2.gz XCIWQBKJGPMLKH-LIRRHRJNSA-N 0 3 413.522 4.081 20 0 HIADHN Cc1cc(NC(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)ccc1OC1CCOCC1 ZINC000474443745 889308916 /nfs/dbraw/zinc/30/89/16/889308916.db2.gz FDTZFIPPXFPVIL-WZONZLPQSA-N 0 3 411.546 4.366 20 0 HIADHN CC(C)Sc1cccc(Cl)c1CNCc1ccc(N2CCN(C)CC2)nc1 ZINC000474471683 889333644 /nfs/dbraw/zinc/33/36/44/889333644.db2.gz UIBXSXAXJJGZHB-UHFFFAOYSA-N 0 3 405.011 4.277 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)CNC(=O)c1ccc(Oc2ccccc2)cc1 ZINC000474484639 889344836 /nfs/dbraw/zinc/34/48/36/889344836.db2.gz LQFDZMNMDJEIRJ-UHFFFAOYSA-N 0 3 417.509 4.217 20 0 HIADHN CC(C)(C)CC(=O)N1CCC(N[C@@H]2COc3cc(F)c(Br)cc32)CC1 ZINC000504575602 913342197 /nfs/dbraw/zinc/34/21/97/913342197.db2.gz PMVFDJRKZYBJOF-MRXNPFEDSA-N 0 3 413.331 4.039 20 0 HIADHN CN(C(=O)Nc1ccc2c(c1)OC1(CCCC1)O2)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000474559094 889435691 /nfs/dbraw/zinc/43/56/91/889435691.db2.gz QSZGYBJHKNOUJC-HXUWFJFHSA-N 0 3 407.514 4.466 20 0 HIADHN Cc1c(Br)cccc1NC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000474599395 889466385 /nfs/dbraw/zinc/46/63/85/889466385.db2.gz LBEQSKMYFYWDKA-QGZVFWFLSA-N 0 3 402.336 4.496 20 0 HIADHN CC(=O)N(Cc1ccc(NC(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)cc1)C(C)C ZINC000474600655 889468802 /nfs/dbraw/zinc/46/88/02/889468802.db2.gz IJYJSGCHXWGLFZ-DEOSSOPVSA-N 0 3 422.573 4.182 20 0 HIADHN Clc1ccc(CNCc2ccc(OCc3ccccn3)cc2)c(-n2cncn2)c1 ZINC000474620842 889483712 /nfs/dbraw/zinc/48/37/12/889483712.db2.gz HURCJSCDXUMTGA-UHFFFAOYSA-N 0 3 405.889 4.185 20 0 HIADHN CN(C(=O)Nc1cccc(OCC(F)(F)F)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000474717664 889575255 /nfs/dbraw/zinc/57/52/55/889575255.db2.gz FXIJADQXGOOTHH-SFHVURJKSA-N 0 3 407.436 4.366 20 0 HIADHN Cc1ccc(NC(=O)C(C)C)cc1NC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000474732169 889588555 /nfs/dbraw/zinc/58/85/55/889588555.db2.gz BUHVUEGSDWSCSD-NRFANRHFSA-N 0 3 408.546 4.328 20 0 HIADHN Cc1ccc(NC(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)c(OC[C@H]2CCCO2)c1 ZINC000474740645 889596335 /nfs/dbraw/zinc/59/63/35/889596335.db2.gz ZHUPPQZRPTYJOZ-FCHUYYIVSA-N 0 3 423.557 4.291 20 0 HIADHN Cc1cc(Oc2ncccn2)ccc1NC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000474744977 889600956 /nfs/dbraw/zinc/60/09/56/889600956.db2.gz ZUMDCQQUVLAJND-FQEVSTJZSA-N 0 3 417.513 4.316 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N[C@@H]1CCCc2ccc(F)cc21 ZINC000474746631 889601956 /nfs/dbraw/zinc/60/19/56/889601956.db2.gz DOJBNCRSYLIKAK-FAFZWHIHSA-N 0 3 413.459 4.308 20 0 HIADHN CN1CCN(CCC(C)(C)NC(=O)CSc2cccc3cccc(Cl)c32)CC1 ZINC000474808612 889661973 /nfs/dbraw/zinc/66/19/73/889661973.db2.gz LRCRLTZWOQSCRI-UHFFFAOYSA-N 0 3 420.022 4.118 20 0 HIADHN C[C@@H](CN1CCC[C@H](C)C1)NC(=O)c1ccc(NC(=O)Nc2ccccc2)s1 ZINC000474826927 889682936 /nfs/dbraw/zinc/68/29/36/889682936.db2.gz YPTBEZNGMALWDB-HOTGVXAUSA-N 0 3 400.548 4.242 20 0 HIADHN Cc1ccc(OCc2ccc(C(=O)NC3CCN(CCOC(C)C)CC3)o2)c(C)c1 ZINC000474867622 889721077 /nfs/dbraw/zinc/72/10/77/889721077.db2.gz GRAIUNGTQGUHJA-UHFFFAOYSA-N 0 3 414.546 4.095 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)c2cccnc2SCC2CCCCC2)CC1 ZINC000474884189 889740497 /nfs/dbraw/zinc/74/04/97/889740497.db2.gz ZHMCGZDDZWDCFY-UHFFFAOYSA-N 0 3 419.635 4.373 20 0 HIADHN CCN(C(=O)Nc1ccc(NC(C)=O)cc1Cl)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475000887 889851749 /nfs/dbraw/zinc/85/17/49/889851749.db2.gz IQAWJMYAHFXJJK-IBGZPJMESA-N 0 3 414.937 4.427 20 0 HIADHN CCN(Cc1ccccc1NC(=O)N(CC)[C@@H]1CCN(Cc2ccccc2)C1)C(C)=O ZINC000475007077 889859061 /nfs/dbraw/zinc/85/90/61/889859061.db2.gz GZDVQSFTJKVREZ-HSZRJFAPSA-N 0 3 422.573 4.183 20 0 HIADHN CN(C(=O)N[C@H](c1ccccc1)c1ccccn1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475009976 889863660 /nfs/dbraw/zinc/86/36/60/889863660.db2.gz RGAFULAEPMIAOF-ISKFKSNPSA-N 0 3 400.526 4.087 20 0 HIADHN CCN(C(=O)Nc1cn(C)nc1-c1ccccc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475017129 889870220 /nfs/dbraw/zinc/87/02/20/889870220.db2.gz POHQVLLDVRZIKS-NRFANRHFSA-N 0 3 403.530 4.215 20 0 HIADHN COc1ccc(CC[C@H]2CCCCN2Cc2nccc(OC)c2OC)cc1OC ZINC000475055914 889900947 /nfs/dbraw/zinc/90/09/47/889900947.db2.gz BAPZVQJUGSVSME-GOSISDBHSA-N 0 3 400.519 4.103 20 0 HIADHN CN(Cc1ccc(-c2c(F)cccc2F)o1)C[C@@H]1C[C@H](F)CN1Cc1ncccn1 ZINC000475101194 889948786 /nfs/dbraw/zinc/94/87/86/889948786.db2.gz MLHIOOQTVUQAML-HOTGVXAUSA-N 0 3 416.447 4.059 20 0 HIADHN CCOc1ccc([C@H](C)NC(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)cc1OC ZINC000475129116 889991981 /nfs/dbraw/zinc/99/19/81/889991981.db2.gz LJGGFQXNJHEDAZ-GHTZIAJQSA-N 0 3 411.546 4.071 20 0 HIADHN C[C@@H](NC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1)c1cccc(OC(F)F)c1 ZINC000475144156 890010164 /nfs/dbraw/zinc/01/01/64/890010164.db2.gz SLNBZBUIFOMMCY-APWZRJJASA-N 0 3 403.473 4.265 20 0 HIADHN CCN(C(=O)N[C@H](C[C@@H]1CCOC1)c1ccccc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475166002 890030830 /nfs/dbraw/zinc/03/08/30/890030830.db2.gz UPQHCIMZHUBWTK-ICDZXHCJSA-N 0 3 421.585 4.460 20 0 HIADHN CCN(C(=O)NCc1cc(-c2ccccc2)on1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475168733 890033793 /nfs/dbraw/zinc/03/37/93/890033793.db2.gz WOVHEGBBIIKLRU-JOCHJYFZSA-N 0 3 404.514 4.148 20 0 HIADHN CCN(C(=O)NCc1nc2ccccc2n1C1CC1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475183978 890053479 /nfs/dbraw/zinc/05/34/79/890053479.db2.gz RUMQWWQPKYGCCP-NRFANRHFSA-N 0 3 417.557 4.177 20 0 HIADHN CCS(=O)(=O)c1ccc(CN[C@H](C)Cc2ccc(Br)cc2F)s1 ZINC000475204085 890074979 /nfs/dbraw/zinc/07/49/79/890074979.db2.gz RIFJUNBPXFLRBR-LLVKDONJSA-N 0 3 420.369 4.164 20 0 HIADHN COc1cc(Br)c(CNCC2CCN(c3ccccc3)CC2)cc1O ZINC000475270077 890166314 /nfs/dbraw/zinc/16/63/14/890166314.db2.gz OSQVYXASMPBZIG-UHFFFAOYSA-N 0 3 405.336 4.170 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@@H]2CNC(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000475279541 890175862 /nfs/dbraw/zinc/17/58/62/890175862.db2.gz KCSZHKNWOHUWBO-SDHSZQHLSA-N 0 3 421.585 4.379 20 0 HIADHN C[C@@H](C(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1)c1ccc(Br)s1 ZINC000475309043 890220710 /nfs/dbraw/zinc/22/07/10/890220710.db2.gz UGILRAXTEMOPOJ-ZBFHGGJFSA-N 0 3 407.377 4.347 20 0 HIADHN C[C@H](C(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1)c1ccc(Br)s1 ZINC000475309042 890221827 /nfs/dbraw/zinc/22/18/27/890221827.db2.gz UGILRAXTEMOPOJ-HOCLYGCPSA-N 0 3 407.377 4.347 20 0 HIADHN CCCc1noc2nc(C3CC3)cc(C(=O)N(C)[C@H]3CCN(Cc4ccccc4)C3)c12 ZINC000475317397 890233976 /nfs/dbraw/zinc/23/39/76/890233976.db2.gz CSLNSVISNGLJLY-IBGZPJMESA-N 0 3 418.541 4.399 20 0 HIADHN COc1ccc([C@H](CNC(=O)N[C@@H](C)c2cc(F)ccc2OC)N2CCCC2)cc1 ZINC000504708418 913441363 /nfs/dbraw/zinc/44/13/63/913441363.db2.gz QUBQWPQCCAMXAD-KKSFZXQISA-N 0 3 415.509 4.040 20 0 HIADHN CCc1c(C(=O)NC[C@@H](c2cccc(OC)c2)N(CC)CC)cnn1C1CCCC1 ZINC000475479253 890386272 /nfs/dbraw/zinc/38/62/72/890386272.db2.gz NLXFXYYOSKEMPU-QHCPKHFHSA-N 0 3 412.578 4.382 20 0 HIADHN CN(C(=O)N[C@H]1CC[C@H](c2cccc(F)c2)C1)C1CCN(CCc2ccccn2)CC1 ZINC000475522458 890444398 /nfs/dbraw/zinc/44/43/98/890444398.db2.gz IFOSFMKDQPINGB-REWPJTCUSA-N 0 3 424.564 4.205 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)Nc2ccc(COC3CCCC3)cc2)CC1 ZINC000475616538 890546663 /nfs/dbraw/zinc/54/66/63/890546663.db2.gz GHTSYYWWZASASD-UHFFFAOYSA-N 0 3 403.567 4.157 20 0 HIADHN COc1cnccc1N1CCN(Cc2cc(Cl)ccc2OCc2cccnc2)CC1 ZINC000475621802 890557342 /nfs/dbraw/zinc/55/73/42/890557342.db2.gz DMHVQECPKZCMNN-UHFFFAOYSA-N 0 3 424.932 4.040 20 0 HIADHN CCCOc1c(CN2CCC[C@@H](N(C)Cc3noc(C)n3)CC2)cccc1OCC ZINC000475625731 890563617 /nfs/dbraw/zinc/56/36/17/890563617.db2.gz UVBRWFFIYHSNHG-HXUWFJFHSA-N 0 3 416.566 4.052 20 0 HIADHN CCN(C(=O)Nc1cc(-n2cccn2)ccc1C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475650360 890594191 /nfs/dbraw/zinc/59/41/91/890594191.db2.gz XOAGHLZRKDPWOO-JOCHJYFZSA-N 0 3 403.530 4.309 20 0 HIADHN CCc1nnc(-c2ccc(NC(=O)N[C@@H]3CCCN(Cc4ccccc4)C3)cc2)o1 ZINC000475676368 890618483 /nfs/dbraw/zinc/61/84/83/890618483.db2.gz BCDKZEMVBIFJFN-HXUWFJFHSA-N 0 3 405.502 4.085 20 0 HIADHN CC(C)C[C@@]1(CO)CCCN1CC(=O)Nc1cccc(CSc2ccccn2)c1 ZINC000475713918 890651326 /nfs/dbraw/zinc/65/13/26/890651326.db2.gz GBCQOBJYTCUPHG-HSZRJFAPSA-N 0 3 413.587 4.185 20 0 HIADHN COC(=O)c1cc2cc(CN3CCC(C(=O)NCc4ccc(C)cc4)CC3)ccc2o1 ZINC000475739320 890680191 /nfs/dbraw/zinc/68/01/91/890680191.db2.gz MIVCEKHBTZBKSH-UHFFFAOYSA-N 0 3 420.509 4.056 20 0 HIADHN COc1ccc2cc(CN(C)C(=O)[C@H](C)N3CCC[C@]4(CCCOC4)C3)ccc2c1 ZINC000475739901 890682088 /nfs/dbraw/zinc/68/20/88/890682088.db2.gz YFSUYCHYYFUYSL-DFBJGRDBSA-N 0 3 410.558 4.088 20 0 HIADHN COc1cccc(Cl)c1-c1noc(C)c1C(=O)N1CC[C@H](N2CCCCC2)C1 ZINC000475776815 890719608 /nfs/dbraw/zinc/71/96/08/890719608.db2.gz PTJYFAJVLSPCMH-HNNXBMFYSA-N 0 3 403.910 4.012 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N3CCCC[C@@H]3c3nc4ccccc4o3)cc2)CC1 ZINC000475802978 890738953 /nfs/dbraw/zinc/73/89/53/890738953.db2.gz HNKPVGNBQLYOBE-JOCHJYFZSA-N 0 3 418.541 4.337 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1cn(C)nc1-c1ccc(Cl)s1 ZINC000475837212 890769462 /nfs/dbraw/zinc/76/94/62/890769462.db2.gz OQDQLVJGZLBDAE-WMLDXEAASA-N 0 3 414.962 4.052 20 0 HIADHN CC1CCN([C@@H](CNC(=O)Nc2ccc([S@@](C)=O)c(F)c2)c2ccccc2)CC1 ZINC000475856160 890791065 /nfs/dbraw/zinc/79/10/65/890791065.db2.gz VSWQEUGNYCTINF-AFJIDDCJSA-N 0 3 417.550 4.158 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N[C@@H](C)c2cc(Cl)ccc2Cl)CC1 ZINC000475904279 890833589 /nfs/dbraw/zinc/83/35/89/890833589.db2.gz YDDBBUJGWGUIIW-AWEZNQCLSA-N 0 3 402.366 4.243 20 0 HIADHN C[C@H](NC(=O)N[C@H]1CCN(Cc2ccccc2)C1)c1ccc(-c2cccnc2)cc1 ZINC000475947147 890869312 /nfs/dbraw/zinc/86/93/12/890869312.db2.gz SGCVMGQHSKOLCG-CYFREDJKSA-N 0 3 400.526 4.383 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1CO)c1cccc2ccccc21 ZINC000475970949 890889042 /nfs/dbraw/zinc/88/90/42/890889042.db2.gz YSUJSIPFKJXXSF-UWUFEASWSA-N 0 3 417.553 4.083 20 0 HIADHN CCc1c(C(=O)N2CCCN(CCCc3ccccc3)CC2)cnn1C1CCCC1 ZINC000476010907 890940749 /nfs/dbraw/zinc/94/07/49/890940749.db2.gz LFXZATGCQFHKDY-UHFFFAOYSA-N 0 3 408.590 4.341 20 0 HIADHN Cc1nc(C)c(CNC(=O)N[C@@H](CN2CCc3ccccc3C2)C(C)(C)C)s1 ZINC000476020504 890953223 /nfs/dbraw/zinc/95/32/23/890953223.db2.gz IEAYFTLSWPPOFR-FQEVSTJZSA-N 0 3 400.592 4.032 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N[C@@H]2CCc3c2ccc(Cl)c3Cl)CC1 ZINC000476029604 890962322 /nfs/dbraw/zinc/96/23/22/890962322.db2.gz GIDDJPOLUIKMBO-GOSISDBHSA-N 0 3 414.377 4.169 20 0 HIADHN O=C(N[C@H]1CCc2ccccc2C1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000504792800 913516218 /nfs/dbraw/zinc/51/62/18/913516218.db2.gz IFKIIZGJBOXJDD-UNMCSNQZSA-N 0 3 402.460 4.115 20 0 HIADHN O=C(CC1CCC(=O)CC1)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1 ZINC000476155023 891079377 /nfs/dbraw/zinc/07/93/77/891079377.db2.gz OYALJPXRLWONHS-UHFFFAOYSA-N 0 3 419.569 4.139 20 0 HIADHN CN(C(=O)N[C@H](c1ccc(Br)cc1)C1CCC1)[C@@H]1CCN(C2CC2)C1 ZINC000476154400 891079441 /nfs/dbraw/zinc/07/94/41/891079441.db2.gz MZDKWPMHHQLWCG-MOPGFXCFSA-N 0 3 406.368 4.168 20 0 HIADHN O=C(N[C@H]1CCCOc2ccccc21)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000504812709 913531908 /nfs/dbraw/zinc/53/19/08/913531908.db2.gz QDJKFWCDIHQPBE-UGKGYDQZSA-N 0 3 418.459 4.471 20 0 HIADHN CCc1onc(-c2ccccc2Cl)c1C(=O)NCCCCN1C[C@@H](C)O[C@H](C)C1 ZINC000476302423 891214984 /nfs/dbraw/zinc/21/49/84/891214984.db2.gz CNBRNGPEDAFRIX-HZPDHXFCSA-N 0 3 419.953 4.177 20 0 HIADHN C[C@H]1CN(CCCCNC(=O)c2ccc3nc(-c4ccccc4)oc3c2)C[C@H](C)O1 ZINC000476305063 891216896 /nfs/dbraw/zinc/21/68/96/891216896.db2.gz IWQHWRZRBUHDNE-ROUUACIJSA-N 0 3 407.514 4.114 20 0 HIADHN CCN(C(=O)Nc1ccc2nnc(C3CCC3)n2c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000476374457 891288849 /nfs/dbraw/zinc/28/88/49/891288849.db2.gz DRMNBEOMNHAJTK-OAQYLSRUSA-N 0 3 418.545 4.125 20 0 HIADHN Cc1cc(NC(=O)c2cc3[nH]ccc3s2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000476418069 891330925 /nfs/dbraw/zinc/33/09/25/891330925.db2.gz XIXSHRNPEAGEOB-KRWDZBQOSA-N 0 3 405.527 4.434 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N2CCCC[C@@H]2c2cc3ccccc3[nH]2)CC1 ZINC000476453260 891364387 /nfs/dbraw/zinc/36/43/87/891364387.db2.gz BZVDXBNOKRDYBH-HSZRJFAPSA-N 0 3 412.578 4.294 20 0 HIADHN CN(C)CCN(C(=O)Nc1nc(SCc2ccccc2)ns1)C1CCCC1 ZINC000476498609 891409950 /nfs/dbraw/zinc/40/99/50/891409950.db2.gz FLIATTQVFSEFAV-UHFFFAOYSA-N 0 3 405.593 4.169 20 0 HIADHN CCCSc1nsc(NC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)n1 ZINC000476514143 891427464 /nfs/dbraw/zinc/42/74/64/891427464.db2.gz WRLHPOARGWWNFM-OAHLLOKOSA-N 0 3 405.593 4.169 20 0 HIADHN CC(C)[C@@H](CNC(=O)Nc1ccc(N2CCCC2=O)cc1)N1CCc2ccccc2C1 ZINC000504837562 913559806 /nfs/dbraw/zinc/55/98/06/913559806.db2.gz UCBYOLPXSVIEAQ-HSZRJFAPSA-N 0 3 420.557 4.018 20 0 HIADHN COc1ccc(-c2[nH]c3ccccc3c2CCC(=O)N(CCN(C)C)C2CC2)cc1 ZINC000476817676 891803099 /nfs/dbraw/zinc/80/30/99/891803099.db2.gz LVPLGSALTANQIR-UHFFFAOYSA-N 0 3 405.542 4.329 20 0 HIADHN CC(C)(C)C1=CCN(CCNC(=O)CCc2nnc(-c3ccc(Cl)cc3)o2)CC1 ZINC000476909202 891861688 /nfs/dbraw/zinc/86/16/88/891861688.db2.gz NRDYDKNPZFOJNK-UHFFFAOYSA-N 0 3 416.953 4.117 20 0 HIADHN CC(C)(C(=O)Nc1cccc(CN2CCC(O)CC2)c1)c1cccc(Cl)c1F ZINC000476917415 891867652 /nfs/dbraw/zinc/86/76/52/891867652.db2.gz VEODINFKZMINPU-UHFFFAOYSA-N 0 3 404.913 4.352 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)NCc1c(C)nn(Cc2ccccc2)c1C)c1ccco1 ZINC000476960752 891891945 /nfs/dbraw/zinc/89/19/45/891891945.db2.gz KKGBMQGHZSGJGC-HTAPYJJXSA-N 0 3 423.561 4.070 20 0 HIADHN COc1cccc(NC(=O)[C@H](NCCc2ccc(OC)c(F)c2)c2ccccc2)c1 ZINC000477101276 892034732 /nfs/dbraw/zinc/03/47/32/892034732.db2.gz QCNQOMPSAPURER-HSZRJFAPSA-N 0 3 408.473 4.355 20 0 HIADHN COc1ccc(NC(=O)[C@@H](NCCc2ccc(OC)c(F)c2)c2ccccc2)cc1 ZINC000477103216 892036478 /nfs/dbraw/zinc/03/64/78/892036478.db2.gz VAVWSXBKJNOUOM-QHCPKHFHSA-N 0 3 408.473 4.355 20 0 HIADHN CCc1noc(-c2ccc(C)c(NC(=O)NC[C@H](N[C@@H](C)CC)c3ccco3)c2)n1 ZINC000477160116 892082745 /nfs/dbraw/zinc/08/27/45/892082745.db2.gz HQORMDNSZOSQHJ-YJBOKZPZSA-N 0 3 411.506 4.451 20 0 HIADHN CN1CC[C@H](NC(=O)N2CCO[C@@H](c3ccc(F)cc3Cl)C2)[C@@H]1c1ccccc1 ZINC000477173481 892094317 /nfs/dbraw/zinc/09/43/17/892094317.db2.gz BWYQZLDSFFUVQW-HBMCJLEFSA-N 0 3 417.912 4.007 20 0 HIADHN Cc1nc([C@H]2CCCN2C(=O)N[C@@H](CN(C)Cc2ccccc2)C(C)C)cs1 ZINC000477213581 892144484 /nfs/dbraw/zinc/14/44/84/892144484.db2.gz GYXNHSDHZYIRLG-PZJWPPBQSA-N 0 3 400.592 4.455 20 0 HIADHN Cc1cccc(NC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)c1C(=O)N1CCCC1 ZINC000504901667 913634771 /nfs/dbraw/zinc/63/47/71/913634771.db2.gz HJDZTEREVHQWTC-NRFANRHFSA-N 0 3 420.557 4.017 20 0 HIADHN CC(C)(C)NC(=O)c1ccc(NC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000504914018 913648637 /nfs/dbraw/zinc/64/86/37/913648637.db2.gz JLECHDWINULFQN-NRFANRHFSA-N 0 3 408.546 4.001 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1ccc2cnn(CC)c2c1)c1cccc(OC)c1 ZINC000477404023 892357210 /nfs/dbraw/zinc/35/72/10/892357210.db2.gz GBIKMJCPXVEIGR-QFIPXVFZSA-N 0 3 409.534 4.269 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)NCc1ccc(F)cc1C(F)(F)F)c1ccco1 ZINC000477608071 892692056 /nfs/dbraw/zinc/69/20/56/892692056.db2.gz BBFRYVTZVACTHU-MLGOLLRUSA-N 0 3 401.404 4.366 20 0 HIADHN O=C(Nc1ccc2c(c1)OCO2)C1CCN(Cc2cnc(-c3ccccc3)s2)CC1 ZINC000477624410 892734633 /nfs/dbraw/zinc/73/46/33/892734633.db2.gz DNDMOHUCDMVRPJ-UHFFFAOYSA-N 0 3 421.522 4.390 20 0 HIADHN CC(C)[C@H](C)NC(=O)CNC1(c2ccc(OCc3ccccc3)cc2)CCOCC1 ZINC000477628906 892746053 /nfs/dbraw/zinc/74/60/53/892746053.db2.gz ADAUTXIVJKDJDV-FQEVSTJZSA-N 0 3 410.558 4.022 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)Cc2nc(-c3ccc(F)cc3)cs2)CC1 ZINC000477697034 892814550 /nfs/dbraw/zinc/81/45/50/892814550.db2.gz DHRXZVSNIOWQJC-MRXNPFEDSA-N 0 3 424.545 4.229 20 0 HIADHN O=C(Cc1c[nH]c2ccc(Cl)cc12)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000477718862 892825165 /nfs/dbraw/zinc/82/51/65/892825165.db2.gz MWRJIIFSOSEQAY-UHFFFAOYSA-N 0 3 411.933 4.207 20 0 HIADHN CCN(C(=O)NCC1(N2CCSCC2)CCCC1)[C@H](C)c1cccc(OC)c1 ZINC000504965878 913702968 /nfs/dbraw/zinc/70/29/68/913702968.db2.gz RZVAFVDKAPBHCU-GOSISDBHSA-N 0 3 405.608 4.149 20 0 HIADHN CCN(C[C@@H]1CCN(Cc2c3ccccc3sc2C(=O)OC)C1)CC(F)(F)F ZINC000477731389 892831189 /nfs/dbraw/zinc/83/11/89/892831189.db2.gz KPGVUFSZERXXFG-AWEZNQCLSA-N 0 3 414.493 4.394 20 0 HIADHN Cc1ccc(Br)c(C(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)c1 ZINC000477732862 892832146 /nfs/dbraw/zinc/83/21/46/892832146.db2.gz ZCDSVBANBXTDFP-IAGOWNOFSA-N 0 3 423.395 4.109 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)[C@H]1C[C@]12CCCc1ccccc12 ZINC000477751904 892844399 /nfs/dbraw/zinc/84/43/99/892844399.db2.gz UICIKTBIHQJNHC-RSXGOPAZSA-N 0 3 404.554 4.124 20 0 HIADHN CC(C)(CNC(=O)N1CCC[C@@H]1c1ccc2c(c1)OCO2)N1CCc2ccccc2C1 ZINC000477755420 892846034 /nfs/dbraw/zinc/84/60/34/892846034.db2.gz SXTAJDWJPMSHDI-OAQYLSRUSA-N 0 3 421.541 4.099 20 0 HIADHN CC(C)(C)[C@H](CN1CCc2ccccc2C1)NC(=O)Nc1cnn(CC(F)(F)F)c1 ZINC000477775156 892859977 /nfs/dbraw/zinc/85/99/77/892859977.db2.gz GQCHNGQQINSPJK-SFHVURJKSA-N 0 3 423.483 4.040 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)N[C@H](C)c1nc2ccccc2n1C(F)F ZINC000477854125 892913478 /nfs/dbraw/zinc/91/34/78/892913478.db2.gz PKXSFOFENBALSM-MRXNPFEDSA-N 0 3 407.509 4.400 20 0 HIADHN COC(=O)c1csc(-c2cccc(CN[C@H](C)c3cnc4cc(C)nn4c3C)c2)n1 ZINC000477868670 892926901 /nfs/dbraw/zinc/92/69/01/892926901.db2.gz VRPVBXGCAKGATQ-CQSZACIVSA-N 0 3 421.526 4.107 20 0 HIADHN C[C@H](NC(=O)NCc1ccc(NC(=O)c2ccco2)cc1)[C@H](c1ccccc1)N(C)C ZINC000477875762 892935557 /nfs/dbraw/zinc/93/55/57/892935557.db2.gz IHMSTYJGLWESRD-HTAPYJJXSA-N 0 3 420.513 4.023 20 0 HIADHN CN(Cc1ccccc1)[C@H](CNC(=O)N1CCC(C(=O)c2ccccc2)CC1)C1CC1 ZINC000478009252 893117890 /nfs/dbraw/zinc/11/78/90/893117890.db2.gz KGNMKUJNYKKBRM-XMMPIXPASA-N 0 3 419.569 4.202 20 0 HIADHN C[C@H]1CN(Cc2ccc(C(=O)Nc3ccc(CN(C)C)c(Cl)c3)cc2)C[C@H](C)O1 ZINC000478032745 893161172 /nfs/dbraw/zinc/16/11/72/893161172.db2.gz XWFUBBMJEIPBSN-IRXDYDNUSA-N 0 3 415.965 4.263 20 0 HIADHN C[C@@H]1CN(Cc2ccc(C(=O)Nc3ccc(CN(C)C)c(Cl)c3)cc2)C[C@H](C)O1 ZINC000478032743 893162244 /nfs/dbraw/zinc/16/22/44/893162244.db2.gz XWFUBBMJEIPBSN-CALCHBBNSA-N 0 3 415.965 4.263 20 0 HIADHN CCCN(C(=O)c1ccc(N2CCOCC2)cc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000505001189 913746314 /nfs/dbraw/zinc/74/63/14/913746314.db2.gz PPKUATGVIIUSTD-RUZDIDTESA-N 0 3 421.585 4.040 20 0 HIADHN Cc1ccc(-c2nc(NCCCN3CCN(C)CC3)nc3sc4c(c32)CCC4)cc1 ZINC000478274787 893472627 /nfs/dbraw/zinc/47/26/27/893472627.db2.gz BYRLGGRZAYZQIM-UHFFFAOYSA-N 0 3 421.614 4.205 20 0 HIADHN COc1ccc(-c2cc(C(=O)N3CCN(c4ccncc4OC)CC3)sc2C)cc1 ZINC000478443057 893751227 /nfs/dbraw/zinc/75/12/27/893751227.db2.gz HMAWWJNPQGRJID-UHFFFAOYSA-N 0 3 423.538 4.098 20 0 HIADHN O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N(CCC(F)(F)F)Cc1ccccc1 ZINC000478450022 893767413 /nfs/dbraw/zinc/76/74/13/893767413.db2.gz AOZBNOWWQBAUKT-HXUWFJFHSA-N 0 3 405.464 4.425 20 0 HIADHN CCOc1c(Cl)cccc1CC(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000478500147 893815158 /nfs/dbraw/zinc/81/51/58/893815158.db2.gz YZBOIESOGCLHEY-HDICACEKSA-N 0 3 422.997 4.019 20 0 HIADHN COc1cc(NC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)c(OC)c(C)c1OC ZINC000478579473 893857672 /nfs/dbraw/zinc/85/76/72/893857672.db2.gz AAMMKTVIDCYEBN-KRWDZBQOSA-N 0 3 416.493 4.011 20 0 HIADHN Cc1sc(CNC(=O)N(CCN(C)C)Cc2ccc(F)cc2F)nc1C(C)C ZINC000478685846 893939364 /nfs/dbraw/zinc/93/93/64/893939364.db2.gz FLACVBIQTYVHGQ-UHFFFAOYSA-N 0 3 410.534 4.127 20 0 HIADHN Cc1c(Br)cccc1CC(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000478749498 894025415 /nfs/dbraw/zinc/02/54/15/894025415.db2.gz WEOQROJMWFCBNI-KRWDZBQOSA-N 0 3 407.377 4.315 20 0 HIADHN CC[C@H](CNC(=O)N1CC2(CCOCC2)c2ccccc21)N1CCc2ccccc2C1 ZINC000478758530 894034493 /nfs/dbraw/zinc/03/44/93/894034493.db2.gz KWPVRADNUQZOEP-JOCHJYFZSA-N 0 3 419.569 4.101 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)N[C@@H](C)c2ccc(OC(F)F)cc2)c1 ZINC000478766471 894041667 /nfs/dbraw/zinc/04/16/67/894041667.db2.gz DBTYBNCXPCDTQM-INIZCTEOSA-N 0 3 421.488 4.131 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2cccc(-n3nc(C)cc3C)c2)c1 ZINC000478780541 894056222 /nfs/dbraw/zinc/05/62/22/894056222.db2.gz BBHKLEIYLDVFLD-UHFFFAOYSA-N 0 3 421.545 4.093 20 0 HIADHN CCC(CC)c1nnc(NC(=O)N(CCN(C)C)Cc2cccc(OC)c2)s1 ZINC000478788413 894065578 /nfs/dbraw/zinc/06/55/78/894065578.db2.gz NTVZEKHBFHPUKN-UHFFFAOYSA-N 0 3 405.568 4.046 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)N[C@H](C)c2cccc(OC(C)C)c2)c1 ZINC000478793215 894068123 /nfs/dbraw/zinc/06/81/23/894068123.db2.gz FLZIAMSUQIMIMY-LJQANCHMSA-N 0 3 413.562 4.317 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1cccc2c1CN(c1ccccn1)C2)c1ccco1 ZINC000479019441 894286269 /nfs/dbraw/zinc/28/62/69/894286269.db2.gz PYFKWNDXAUAZSF-LAUBAEHRSA-N 0 3 419.529 4.446 20 0 HIADHN C[C@@H](NCCOc1ccccc1Br)c1ccc(Br)cn1 ZINC000479060146 894319724 /nfs/dbraw/zinc/31/97/24/894319724.db2.gz LONLXCQUOIIQDY-LLVKDONJSA-N 0 3 400.114 4.336 20 0 HIADHN CCS[C@@H]1CCCC[C@H]1N[C@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479064520 894327058 /nfs/dbraw/zinc/32/70/58/894327058.db2.gz FQHWLULFNPVDEV-VCTAVGKDSA-N 0 3 411.420 4.356 20 0 HIADHN Cc1cc(C)c(S(N)(=O)=O)cc1[C@@H](C)N[C@@H](C)c1ccc(Br)cc1 ZINC000479066185 894328979 /nfs/dbraw/zinc/32/89/79/894328979.db2.gz KIKQEUYAOYGRQQ-UONOGXRCSA-N 0 3 411.365 4.125 20 0 HIADHN CCO[C@@H](CCN[C@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl)C1CCCC1 ZINC000479069873 894334044 /nfs/dbraw/zinc/33/40/44/894334044.db2.gz QCXZRZJAJWTWFY-PXAZEXFGSA-N 0 3 423.406 4.277 20 0 HIADHN CC[C@H](C)NC(=O)[C@@H]1C[C@H](C)N(Cc2nnc(-c3ccco3)o2)[C@H]2CCCC[C@@H]12 ZINC000479106960 894371749 /nfs/dbraw/zinc/37/17/49/894371749.db2.gz KAFYMHDDXRVBIC-TXTZMMAHSA-N 0 3 400.523 4.014 20 0 HIADHN CC[C@H](C)NC(=O)[C@@H]1C[C@H](C)N(Cc2nnc(-c3ccco3)o2)[C@H]2CCCC[C@H]12 ZINC000479106957 894372611 /nfs/dbraw/zinc/37/26/11/894372611.db2.gz KAFYMHDDXRVBIC-AVEIZBFRSA-N 0 3 400.523 4.014 20 0 HIADHN C[C@H](CCc1ccccc1)N[C@@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479333295 894625675 /nfs/dbraw/zinc/62/56/75/894625675.db2.gz WMGRTRZEAHZNQO-OLZOCXBDSA-N 0 3 401.359 4.313 20 0 HIADHN CNS(=O)(=O)c1ccc([C@@H](C)N[C@H]2CCCc3cc(Br)ccc32)cc1 ZINC000479344519 894639279 /nfs/dbraw/zinc/63/92/79/894639279.db2.gz KZZWESAIKGSLFJ-YJYMSZOUSA-N 0 3 423.376 4.085 20 0 HIADHN C[C@@H](NCCc1c[nH]c2ccccc12)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479356806 894654657 /nfs/dbraw/zinc/65/46/57/894654657.db2.gz GGFZJSHMKMQUIR-LLVKDONJSA-N 0 3 412.342 4.015 20 0 HIADHN Cc1c2ccccc2oc1[C@H](C)NC(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000479361998 894662300 /nfs/dbraw/zinc/66/23/00/894662300.db2.gz RBQZSDMVVHJKIQ-SFHVURJKSA-N 0 3 421.541 4.258 20 0 HIADHN CCS(=O)(=O)c1c(Cl)cccc1CNC1CCN([C@@H](C)c2ccccc2)CC1 ZINC000479394789 894697454 /nfs/dbraw/zinc/69/74/54/894697454.db2.gz NDAKYTUTRCAWPB-KRWDZBQOSA-N 0 3 421.006 4.449 20 0 HIADHN C[C@@H](NCCc1nc(-c2cccc(Cl)c2)no1)c1ccc(Br)cn1 ZINC000479400101 894703073 /nfs/dbraw/zinc/70/30/73/894703073.db2.gz XFFHILBOWPJUAQ-LLVKDONJSA-N 0 3 407.699 4.441 20 0 HIADHN CN(Cc1nc(-c2ccccc2)c[nH]1)C(=O)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000479412618 894721827 /nfs/dbraw/zinc/72/18/27/894721827.db2.gz JGOUFUFSPVXMKK-QFIPXVFZSA-N 0 3 403.530 4.055 20 0 HIADHN COc1cc2c(cc1OC)[C@H](N[C@H]1CC(=O)N(C)[C@@H]1c1ccc(Cl)c(F)c1)CC2 ZINC000479415406 894725600 /nfs/dbraw/zinc/72/56/00/894725600.db2.gz YHFGBZRRXVITLZ-KGVIQGDOSA-N 0 3 418.896 4.045 20 0 HIADHN Cc1ccc(CN[C@H]2CCCc3cc(Br)ccc32)cc1S(C)(=O)=O ZINC000479438034 894752644 /nfs/dbraw/zinc/75/26/44/894752644.db2.gz NKGXLLZDRIALQN-SFHVURJKSA-N 0 3 408.361 4.328 20 0 HIADHN Cc1nc2ccc(Br)cc2c(N2CCC(O[C@H]3CCOC3)CC2)c1C ZINC000479448400 894765582 /nfs/dbraw/zinc/76/55/82/894765582.db2.gz CLTPBYJSIVAZDS-KRWDZBQOSA-N 0 3 405.336 4.388 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)NCc2csc(-c3ccco3)n2)N2CCCC2)cc1 ZINC000479496248 894814631 /nfs/dbraw/zinc/81/46/31/894814631.db2.gz AZPZSNDYTLLBFP-LJQANCHMSA-N 0 3 410.543 4.348 20 0 HIADHN CS(=O)(=O)C1(CN[C@H](CCSc2ccc(F)cc2)c2ccc(F)cc2)CC1 ZINC000479501001 894817915 /nfs/dbraw/zinc/81/79/15/894817915.db2.gz IUCJTURLLYPJQW-LJQANCHMSA-N 0 3 411.539 4.355 20 0 HIADHN COCCCC[C@@H](N[C@H](C)c1cc(S(N)(=O)=O)c(C)cc1C)c1ccccc1 ZINC000479500092 894817958 /nfs/dbraw/zinc/81/79/58/894817958.db2.gz PJPLOOXKWQWSIC-WIYYLYMNSA-N 0 3 404.576 4.159 20 0 HIADHN C[C@@H](NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1ncc(Br)s1 ZINC000479502592 894819378 /nfs/dbraw/zinc/81/93/78/894819378.db2.gz PRTPVLCCPCGQMX-OIKLOGQESA-N 0 3 412.319 4.362 20 0 HIADHN Cc1cc(Br)cc2cc([C@H](NCC3(S(C)(=O)=O)CC3)C(C)C)oc21 ZINC000479504661 894820978 /nfs/dbraw/zinc/82/09/78/894820978.db2.gz SYNJWAMFCPUOML-MRXNPFEDSA-N 0 3 414.365 4.368 20 0 HIADHN Cc1ccc([C@@H](NC2CC(N3CCCCC3)C2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000479522203 894832014 /nfs/dbraw/zinc/83/20/14/894832014.db2.gz AVQJIGWZWRTLCP-UBVWURDFSA-N 0 3 412.599 4.094 20 0 HIADHN Cn1cc([C@@H](NCCc2cccc(OCC(F)(F)F)c2)c2cccc(F)c2)cn1 ZINC000479552452 894851088 /nfs/dbraw/zinc/85/10/88/894851088.db2.gz HKMMBZWIBRIKDY-FQEVSTJZSA-N 0 3 407.411 4.422 20 0 HIADHN CCS(=O)(=O)c1c(Cl)cccc1CNC[C@H]1CCCO[C@@H]1c1ccccc1 ZINC000479557021 894855802 /nfs/dbraw/zinc/85/58/02/894855802.db2.gz SBHMGBJGIUZWAO-YLJYHZDGSA-N 0 3 407.963 4.391 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)NCc2csc(-c3ccco3)n2)CC1 ZINC000479584698 894872028 /nfs/dbraw/zinc/87/20/28/894872028.db2.gz BSZUWYNMAVSDHL-UHFFFAOYSA-N 0 3 410.543 4.209 20 0 HIADHN Cc1nn(C)c2ncc(CN[C@@H](c3cc(F)cc(Br)c3)C3CC3)cc12 ZINC000479607132 894882480 /nfs/dbraw/zinc/88/24/80/894882480.db2.gz SEPXQSQBULLJTJ-GOSISDBHSA-N 0 3 403.299 4.419 20 0 HIADHN Cc1ccccc1[C@H](OC[C@@H](O)CN(C)[C@@H](CO)c1ccccc1)c1ccccc1 ZINC000479667622 894944902 /nfs/dbraw/zinc/94/49/02/894944902.db2.gz ROPCTOZSMDGGDZ-AYRHNUGRSA-N 0 3 405.538 4.127 20 0 HIADHN COc1ccc(CCN[C@@H](C)c2nnn(-c3cccc(Cl)c3)c2C)cc1OC ZINC000479768249 895067928 /nfs/dbraw/zinc/06/79/28/895067928.db2.gz OXLLQLVJGIATEW-AWEZNQCLSA-N 0 3 400.910 4.140 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)N1CC2(CCOCC2)c2ccccc21 ZINC000479778877 895080236 /nfs/dbraw/zinc/08/02/36/895080236.db2.gz RCAQDTVRFRIHST-HSZRJFAPSA-N 0 3 421.585 4.421 20 0 HIADHN COc1cc(CN2CCCCC[C@@H]2c2ccncc2)ccc1OCC(=O)N1CCCC1 ZINC000505273960 913932015 /nfs/dbraw/zinc/93/20/15/913932015.db2.gz QORWUBBPCBQCQU-JOCHJYFZSA-N 0 3 423.557 4.209 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1CCN(Cc2ccccc2)[C@H]1C)c1ccc(NC(=O)C2CC2)cc1 ZINC000479819190 895133402 /nfs/dbraw/zinc/13/34/02/895133402.db2.gz SGORATXMNXFJMN-IUKKYPGJSA-N 0 3 420.557 4.058 20 0 HIADHN COc1cccc([C@H](CN[C@H](C)c2nnn(-c3cccc(Cl)c3)c2C)N(C)C)c1 ZINC000479866448 895205379 /nfs/dbraw/zinc/20/53/79/895205379.db2.gz ZYWNVIWRSIEYSH-VFNWGFHPSA-N 0 3 413.953 4.191 20 0 HIADHN C[C@@H](NC[C@@H](c1cccs1)N1CCC(C)CC1)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000479872831 895214796 /nfs/dbraw/zinc/21/47/96/895214796.db2.gz KYVDBVIPUIBLMA-APWZRJJASA-N 0 3 424.607 4.415 20 0 HIADHN COc1ccccc1[C@H](CN[C@@H](C)c1nnn(-c2ccccc2)c1C)N1CCCC1 ZINC000479875096 895216143 /nfs/dbraw/zinc/21/61/43/895216143.db2.gz PPYFKCMYDWGANI-AVRDEDQJSA-N 0 3 405.546 4.072 20 0 HIADHN CC[C@@H](NC[C@H](c1ccc(OC)c(OC)c1)N1CCOCC1)c1cc(F)ccc1F ZINC000479888723 895235008 /nfs/dbraw/zinc/23/50/08/895235008.db2.gz PJOUDUVBGAWCFC-NHCUHLMSSA-N 0 3 420.500 4.096 20 0 HIADHN Cc1c([C@@H](C)NCc2ccccc2CN2CCOCC2)cnn1-c1ccc(F)cc1 ZINC000479897969 895244869 /nfs/dbraw/zinc/24/48/69/895244869.db2.gz NHEOKKIEPFFBBH-GOSISDBHSA-N 0 3 408.521 4.003 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)[C@H]1C[C@H]1c1ccc2ccccc2c1 ZINC000479965792 895320451 /nfs/dbraw/zinc/32/04/51/895320451.db2.gz POLJGRSTMXSRHU-UIOOFZCWSA-N 0 3 414.549 4.216 20 0 HIADHN COC1CCN(C2(CNc3ncc(Cl)cc3Br)CCCC2)CC1 ZINC000479971264 895325311 /nfs/dbraw/zinc/32/53/11/895325311.db2.gz QPMCTLFSFVOSGX-UHFFFAOYSA-N 0 3 402.764 4.333 20 0 HIADHN C[C@@H](NCc1cn(-c2ccccc2)nc1-c1ccccc1)c1ccc(-n2cnnn2)cc1 ZINC000480014606 895364662 /nfs/dbraw/zinc/36/46/62/895364662.db2.gz NNPKCGABQNWKKO-LJQANCHMSA-N 0 3 421.508 4.366 20 0 HIADHN CN(C)Cc1cccc(NC(=O)N[C@H]2CCN(c3ccccc3C(F)(F)F)C2)c1 ZINC000480018353 895367765 /nfs/dbraw/zinc/36/77/65/895367765.db2.gz LGYSVLBBIYKLCI-KRWDZBQOSA-N 0 3 406.452 4.167 20 0 HIADHN C[C@H](NC(=O)Nc1cc(C(C)(C)C)nn1-c1ccccn1)[C@H](c1ccccc1)N(C)C ZINC000480044680 895393506 /nfs/dbraw/zinc/39/35/06/895393506.db2.gz JPNMOCLOJBXBIZ-HTAPYJJXSA-N 0 3 420.561 4.378 20 0 HIADHN Cc1cn2c(n1)[C@H](CN[C@H](c1ccc(Br)cc1)c1cncnc1)CCC2 ZINC000480181403 895574067 /nfs/dbraw/zinc/57/40/67/895574067.db2.gz NWUVEQJSNRJDOK-QFBILLFUSA-N 0 3 412.335 4.001 20 0 HIADHN CC(C)(CN[C@@H]1CCS(=O)(=O)c2ccc(Br)cc21)c1cccs1 ZINC000480248424 895658433 /nfs/dbraw/zinc/65/84/33/895658433.db2.gz DCYFTBGPNLTUJW-CQSZACIVSA-N 0 3 414.390 4.297 20 0 HIADHN Cc1nn(C)c(C)c1[C@H]1OCC[C@@H]1NCc1cc(Br)c(Cl)s1 ZINC000480276333 895682795 /nfs/dbraw/zinc/68/27/95/895682795.db2.gz UYXKDLIGKYUAST-JSGCOSHPSA-N 0 3 404.761 4.134 20 0 HIADHN COc1cc(NCCNCc2cc(Br)c(Cl)s2)cc(OC)c1 ZINC000480311802 895715002 /nfs/dbraw/zinc/71/50/02/895715002.db2.gz UDBKTLCXECBJRY-UHFFFAOYSA-N 0 3 405.745 4.383 20 0 HIADHN CC[C@H](N[C@@H](C)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccc(Cl)cc1 ZINC000480335980 895740761 /nfs/dbraw/zinc/74/07/61/895740761.db2.gz YEBPDZLWYHMTQW-KKSFZXQISA-N 0 3 422.978 4.163 20 0 HIADHN CC(C)N(C)c1ccc(CNCc2cn(-c3ccccc3)nc2-c2ccncc2)cn1 ZINC000480339921 895744274 /nfs/dbraw/zinc/74/42/74/895744274.db2.gz WMIQNFNNGNNDNR-UHFFFAOYSA-N 0 3 412.541 4.464 20 0 HIADHN Cc1ccc(Oc2ccccc2NC(=O)N2CC[C@H](N3CCN(C)CC3)[C@@H](C)C2)cc1 ZINC000480384512 895790777 /nfs/dbraw/zinc/79/07/77/895790777.db2.gz ZGBPDXRWXOGBGP-REWPJTCUSA-N 0 3 422.573 4.277 20 0 HIADHN Cc1ccc(Oc2ccccc2NC(=O)N2CC[C@@H](N3CCN(C)CC3)[C@@H](C)C2)cc1 ZINC000480384505 895790967 /nfs/dbraw/zinc/79/09/67/895790967.db2.gz ZGBPDXRWXOGBGP-NZQKXSOJSA-N 0 3 422.573 4.277 20 0 HIADHN Brc1ccc(CNC2CCN(Cc3coc(-c4ccccc4)n3)CC2)o1 ZINC000480396878 895802369 /nfs/dbraw/zinc/80/23/69/895802369.db2.gz VKCALCHVBNFLHL-UHFFFAOYSA-N 0 3 416.319 4.451 20 0 HIADHN Cc1cccc(Oc2ccccc2NC(=O)N2CC[C@H](N3CCN(C)CC3)[C@H](C)C2)c1 ZINC000480408385 895809354 /nfs/dbraw/zinc/80/93/54/895809354.db2.gz VIXZZWRZCBEECQ-OFNKIYASSA-N 0 3 422.573 4.277 20 0 HIADHN FC(F)(F)Oc1ccc2c(c1)[C@@H](N[C@@H](CN1CCOCC1)c1ccccc1)CC2 ZINC000480415089 895814010 /nfs/dbraw/zinc/81/40/10/895814010.db2.gz JVCLGNIEQPSTFG-SFTDATJTSA-N 0 3 406.448 4.236 20 0 HIADHN COc1ccc([C@H](C)N[C@H](CN2CCOCC2)c2ccccc2)cc1Br ZINC000480437661 895829496 /nfs/dbraw/zinc/82/94/96/895829496.db2.gz PGONZOQDTPERSP-OXJNMPFZSA-N 0 3 419.363 4.182 20 0 HIADHN CCN(CC)C(=O)Nc1ccc([C@@H](C)N[C@@H](CN2CCOCC2)c2ccccc2)cc1 ZINC000480445781 895834432 /nfs/dbraw/zinc/83/44/32/895834432.db2.gz HDDHUDRSVAKRMB-YKSBVNFPSA-N 0 3 424.589 4.284 20 0 HIADHN CCOc1ccc(CNCc2cccc(-c3nc(C(=O)OC)cs3)c2)cc1OC ZINC000480446344 895835638 /nfs/dbraw/zinc/83/56/38/895835638.db2.gz QHJZVNSVEBVSCR-UHFFFAOYSA-N 0 3 412.511 4.294 20 0 HIADHN COc1cc(CNCc2ccc(C3CC3)cc2)cc(I)c1OC ZINC000480448119 895836721 /nfs/dbraw/zinc/83/67/21/895836721.db2.gz WMBLOYDUVQMYLA-UHFFFAOYSA-N 0 3 423.294 4.476 20 0 HIADHN CN(Cc1cccnc1)C[C@@H]1CCN(C(=O)c2cc3c(cc(Cl)cc3Cl)[nH]2)C1 ZINC000480526341 895888604 /nfs/dbraw/zinc/88/86/04/895888604.db2.gz NAKYRWOKWBTOKW-HNNXBMFYSA-N 0 3 417.340 4.464 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)c3cnc(Nc4ccc(Cl)cc4)c(Cl)c3)[C@@H]2C1 ZINC000480577592 895937533 /nfs/dbraw/zinc/93/75/33/895937533.db2.gz IPGAWLUZZDPEFG-SCLBCKFNSA-N 0 3 405.329 4.298 20 0 HIADHN C[C@@H]1CN(c2ccc(CN[C@@H]3CCc4cc(Br)ccc43)cn2)C[C@H](C)O1 ZINC000480609599 895975333 /nfs/dbraw/zinc/97/53/33/895975333.db2.gz HUHPAWFEPSIWFO-QEEYODRMSA-N 0 3 416.363 4.235 20 0 HIADHN CC(C)n1cc([C@H](C)NC[C@H](c2c(F)cccc2Cl)N2CCO[C@H](C)C2)cn1 ZINC000480610999 895977410 /nfs/dbraw/zinc/97/74/10/895977410.db2.gz KAXISKPJJWQCNE-GQIGUUNPSA-N 0 3 408.949 4.369 20 0 HIADHN CN1CCN(C(=O)c2ccc(CN[C@@H]3CCSc4ccc(Cl)cc43)cc2)CC1 ZINC000480619027 895986383 /nfs/dbraw/zinc/98/63/83/895986383.db2.gz XAKMHRAMHOSCPZ-HXUWFJFHSA-N 0 3 415.990 4.054 20 0 HIADHN CC[C@@H](NCc1ccc(N2CCO[C@H](C)C2)nc1)c1ccc(Br)cc1 ZINC000480629214 895996911 /nfs/dbraw/zinc/99/69/11/895996911.db2.gz DKFOXWJEPMRUPF-DNVCBOLYSA-N 0 3 404.352 4.310 20 0 HIADHN CCN(C)c1ccc(CN[C@@H](C)c2ccc(OCc3ccncc3)c(OC)c2)cn1 ZINC000480657086 896025650 /nfs/dbraw/zinc/02/56/50/896025650.db2.gz CLGCHNIBECBCFX-SFHVURJKSA-N 0 3 406.530 4.371 20 0 HIADHN Brc1ccc(N2CC[C@H](CNCc3nccn3-c3ccccc3)C2)cc1 ZINC000480670153 896034820 /nfs/dbraw/zinc/03/48/20/896034820.db2.gz YEYREFQYFFAYND-QGZVFWFLSA-N 0 3 411.347 4.251 20 0 HIADHN COc1cccc(-c2cc(C(=O)Nc3nc(CN4CCC(C)CC4)cs3)[nH]n2)c1 ZINC000480678099 896041412 /nfs/dbraw/zinc/04/14/12/896041412.db2.gz SAOOUEORCWBIRO-UHFFFAOYSA-N 0 3 411.531 4.026 20 0 HIADHN C[C@@H]1CN(Cc2ccccn2)CC[C@H]1Nc1ccc2c(c1)CCC(=O)N2CC1CC1 ZINC000480684656 896047452 /nfs/dbraw/zinc/04/74/52/896047452.db2.gz UNTRHNPDRBYYNW-WZONZLPQSA-N 0 3 404.558 4.093 20 0 HIADHN C[C@@H](NCCc1ccc(OCC(F)(F)F)nc1)c1nc2ccc(Cl)cc2n1C ZINC000480692867 896054055 /nfs/dbraw/zinc/05/40/55/896054055.db2.gz AVZBONTXNFZOAM-GFCCVEGCSA-N 0 3 412.843 4.456 20 0 HIADHN CCNC(=O)COc1ccc(CN[C@H](C)c2cc(Cl)cc(Cl)c2)cc1OC ZINC000480702334 896064107 /nfs/dbraw/zinc/06/41/07/896064107.db2.gz WRXQZUVJTQJSPD-CYBMUJFWSA-N 0 3 411.329 4.368 20 0 HIADHN C[C@@H](NCc1ccnc(N2CCN(C)CC2)c1)c1ccc(SCC(F)(F)F)cc1 ZINC000480705460 896067083 /nfs/dbraw/zinc/06/70/83/896067083.db2.gz HEQIQWMAFQKFNU-MRXNPFEDSA-N 0 3 424.536 4.339 20 0 HIADHN CN1CCN(c2cc(CN[C@H](Cc3cccc(F)c3)c3cccc(F)c3)ccn2)CC1 ZINC000480711652 896072505 /nfs/dbraw/zinc/07/25/05/896072505.db2.gz QSSTZLKPUQLKEC-XMMPIXPASA-N 0 3 422.523 4.185 20 0 HIADHN COc1ccc([C@H](C)N[C@H](C)c2ccc(NC(=O)NC3CC3)cc2)cc1NC(C)=O ZINC000480739054 896099314 /nfs/dbraw/zinc/09/93/14/896099314.db2.gz RRAJAMWQMXNMTI-CABCVRRESA-N 0 3 410.518 4.349 20 0 HIADHN C[C@@H](N[C@@H](C)c1cccc(NC(=O)c2ccccc2)c1)c1ccc(-n2cnnn2)cc1 ZINC000480753316 896116166 /nfs/dbraw/zinc/11/61/66/896116166.db2.gz IKDPASHLVJGIKF-MSOLQXFVSA-N 0 3 412.497 4.326 20 0 HIADHN Cc1ccc(CN2CCC(C(=O)Nc3ccc(Br)cc3)CC2)c(C)n1 ZINC000480755743 896118344 /nfs/dbraw/zinc/11/83/44/896118344.db2.gz MZXVDWBFASQJEQ-UHFFFAOYSA-N 0 3 402.336 4.312 20 0 HIADHN CNS(=O)(=O)c1ccc([C@@H](C)NCc2cccc(COCc3ccccc3)c2)cc1 ZINC000480765002 896127207 /nfs/dbraw/zinc/12/72/07/896127207.db2.gz YPDKKELBSBQYBL-LJQANCHMSA-N 0 3 424.566 4.162 20 0 HIADHN C[C@@H](N[C@@H]1CCCc2c1cnn2C)c1cccc(OCc2cn3ccccc3n2)c1 ZINC000480766443 896129452 /nfs/dbraw/zinc/12/94/52/896129452.db2.gz FMVZSJIFWVJIHA-VGOFRKELSA-N 0 3 401.514 4.375 20 0 HIADHN C[C@H](N[C@@H](c1ccccc1)C(C)(C)C)c1cccc(S(=O)(=O)N2CCOCC2)c1 ZINC000480770416 896133508 /nfs/dbraw/zinc/13/35/08/896133508.db2.gz RSTUUZAWRZHICB-AVRDEDQJSA-N 0 3 416.587 4.146 20 0 HIADHN CC[C@@H](NCc1cccc(NC(=O)CCN2CCOCC2)c1)c1ccc(Cl)cc1 ZINC000480879388 896236827 /nfs/dbraw/zinc/23/68/27/896236827.db2.gz NWCQMGSCRYKHGH-JOCHJYFZSA-N 0 3 415.965 4.242 20 0 HIADHN CCOc1ccc(Oc2cc(CN[C@H](C)c3ccc(-n4cnnn4)cc3)ccn2)cc1 ZINC000480893942 896249733 /nfs/dbraw/zinc/24/97/33/896249733.db2.gz CSKYLLUISBRNDW-QGZVFWFLSA-N 0 3 416.485 4.099 20 0 HIADHN Cc1c([C@H](C)NCc2ccc(CN3CCCC3=O)cc2)cnn1-c1ccc(F)cc1 ZINC000480904554 896258971 /nfs/dbraw/zinc/25/89/71/896258971.db2.gz YXBYXCNQEKHMHY-KRWDZBQOSA-N 0 3 406.505 4.293 20 0 HIADHN Cc1ccc(C(=O)Nc2cccc(CN[C@H](C)c3ccc(-n4cnnn4)cc3)c2)cc1 ZINC000480911874 896270000 /nfs/dbraw/zinc/27/00/00/896270000.db2.gz UTFCEEBUABGVHE-GOSISDBHSA-N 0 3 412.497 4.074 20 0 HIADHN O=C(NCCN[C@@H]1CCSc2c(F)cccc21)c1ccc(Br)cc1 ZINC000480915668 896273965 /nfs/dbraw/zinc/27/39/65/896273965.db2.gz ZXDGRVMVXSQRHR-MRXNPFEDSA-N 0 3 409.324 4.145 20 0 HIADHN COc1cccc([C@@H](C)N[C@H](C)c2ccc(S(=O)(=O)NCc3ccco3)cc2)c1 ZINC000480917099 896276338 /nfs/dbraw/zinc/27/63/38/896276338.db2.gz XOOFGSUGZZLFNB-IAGOWNOFSA-N 0 3 414.527 4.179 20 0 HIADHN COc1ccc([C@H](Cc2ccccc2C)N[C@@H]2CCCN(C(C)C)C2=O)cc1OC ZINC000481064559 896386002 /nfs/dbraw/zinc/38/60/02/896386002.db2.gz VJBVFEPFCDODBU-YADHBBJMSA-N 0 3 410.558 4.285 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)NCc1cc(Br)cs1)c1ccco1 ZINC000481123315 896450008 /nfs/dbraw/zinc/45/00/08/896450008.db2.gz XFQFVEGEQVRMAA-BXUZGUMPSA-N 0 3 400.342 4.032 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)C[C@@H]3CCc4ccccc4C3)CC2)c1 ZINC000481147250 896474881 /nfs/dbraw/zinc/47/48/81/896474881.db2.gz UKFSOYSNTBHDQW-HSZRJFAPSA-N 0 3 419.613 4.209 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NC[C@H]1CCO[C@@H]1c1ccccc1)c1ccsc1 ZINC000481236433 896587079 /nfs/dbraw/zinc/58/70/79/896587079.db2.gz UNHDZNIVBLREPD-HLAWJBBLSA-N 0 3 401.576 4.208 20 0 HIADHN Cc1nc(-c2cc([C@H](C)NCc3cccc(OCC(=O)N(C)C)c3)cs2)cs1 ZINC000481294865 896639882 /nfs/dbraw/zinc/63/98/82/896639882.db2.gz MFVIBERPKBYCJZ-AWEZNQCLSA-N 0 3 415.584 4.498 20 0 HIADHN Cc1c([C@H](C)NC2CCN(Cc3ccc(F)cc3)CC2)nnn1-c1ccc(C)cc1 ZINC000481305300 896650728 /nfs/dbraw/zinc/65/07/28/896650728.db2.gz FGVGBQAHEMINAP-SFHVURJKSA-N 0 3 407.537 4.338 20 0 HIADHN CCC(CC)C(=O)N1CCC(N[C@H](C)c2nnn(-c3cccc(Cl)c3)c2C)CC1 ZINC000481307086 896654857 /nfs/dbraw/zinc/65/48/57/896654857.db2.gz JBGIVNCMNFPGOD-OAHLLOKOSA-N 0 3 417.985 4.307 20 0 HIADHN COc1ccc(-c2nnc(NC(=O)N[C@@H](C)[C@@H](c3ccccc3)N(C)C)s2)cc1 ZINC000481309600 896656932 /nfs/dbraw/zinc/65/69/32/896656932.db2.gz BVNRPIBZGNHPAS-KSSFIOAISA-N 0 3 411.531 4.027 20 0 HIADHN Cc1c([C@H](C)NCc2cccc(CN3CCOCC3)c2)cnn1-c1cc(C)ccc1C ZINC000481311870 896658960 /nfs/dbraw/zinc/65/89/60/896658960.db2.gz LLKFXAQEQCNGKS-NRFANRHFSA-N 0 3 418.585 4.481 20 0 HIADHN Cc1cc(C)n(-c2ccc(CN[C@H](C)c3ccc(OCc4nccn4C)cc3)cn2)n1 ZINC000481315933 896667731 /nfs/dbraw/zinc/66/77/31/896667731.db2.gz ZEGGYURGBJSHTA-LJQANCHMSA-N 0 3 416.529 4.047 20 0 HIADHN CC[C@H](N[C@H](C)c1ccc(-n2cccn2)cc1)c1ccccc1OCC(=O)N(C)C ZINC000481318327 896670988 /nfs/dbraw/zinc/67/09/88/896670988.db2.gz KDUPAXBXYIICFX-GCJKJVERSA-N 0 3 406.530 4.141 20 0 HIADHN CC(C)CN(CCCOc1ccc(S(C)(=O)=O)cc1)[C@@H]1CCCc2cccnc21 ZINC000481323897 896677910 /nfs/dbraw/zinc/67/79/10/896677910.db2.gz XIDHFOLWLDWAGQ-JOCHJYFZSA-N 0 3 416.587 4.290 20 0 HIADHN COc1cc(C)c(NC(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)cc1F ZINC000481412714 896817128 /nfs/dbraw/zinc/81/71/28/896817128.db2.gz STIPUODKTVEJAH-HXUWFJFHSA-N 0 3 403.498 4.354 20 0 HIADHN O=C([C@H]1CCCN(Cc2cccc(F)c2)C1)N1CC2(CCOCC2)c2ccccc21 ZINC000481468601 896859069 /nfs/dbraw/zinc/85/90/69/896859069.db2.gz XUMCNTAVCYDHQA-FQEVSTJZSA-N 0 3 408.517 4.133 20 0 HIADHN COc1cccc([C@H](CNC(=O)Nc2ccnn2[C@H](C)CC(C)C)N2CCCC2)c1 ZINC000481479970 896864167 /nfs/dbraw/zinc/86/41/67/896864167.db2.gz KWBRIJRJXMXHBY-NQIIRXRSSA-N 0 3 413.566 4.457 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)Nc1nnc(-c2ccc(OC)cc2)s1)c1ccco1 ZINC000481486668 896868250 /nfs/dbraw/zinc/86/82/50/896868250.db2.gz RJNFYCVLPCRBHU-CJNGLKHVSA-N 0 3 415.519 4.058 20 0 HIADHN COc1cc([C@@H](C)NCc2cccc(CN3CCO[C@@H](C)C3)c2)ccc1SC ZINC000481553271 896922565 /nfs/dbraw/zinc/92/25/65/896922565.db2.gz RXJASSLCOUEPLO-ZWKOTPCHSA-N 0 3 400.588 4.489 20 0 HIADHN COc1cc([C@H](C)NCc2cccc(CN3CCO[C@@H](C)C3)c2)ccc1SC ZINC000481553269 896923166 /nfs/dbraw/zinc/92/31/66/896923166.db2.gz RXJASSLCOUEPLO-ROUUACIJSA-N 0 3 400.588 4.489 20 0 HIADHN CSc1ccc(CN[C@@H](C)c2ccc(S(=O)(=O)NCc3ccco3)cc2)cc1 ZINC000481554600 896925380 /nfs/dbraw/zinc/92/53/80/896925380.db2.gz BREQUBVNOYAKCH-INIZCTEOSA-N 0 3 416.568 4.331 20 0 HIADHN O=C(Nc1cccc(CN[C@@H]2CCc3ccc(OC(F)(F)F)cc32)c1)[C@H]1CCCO1 ZINC000481561606 896937361 /nfs/dbraw/zinc/93/73/61/896937361.db2.gz KOVPDWWCOUBFSZ-WOJBJXKFSA-N 0 3 420.431 4.480 20 0 HIADHN COc1ccc(C2(CN[C@H](C)c3nnn(-c4ccc(F)cc4)c3C)CCOCC2)cc1 ZINC000481562768 896939671 /nfs/dbraw/zinc/93/96/71/896939671.db2.gz MHBRHUMACWSVMW-QGZVFWFLSA-N 0 3 424.520 4.122 20 0 HIADHN C[C@@H](NCc1ccccc1-n1ccnc1)c1ccc(S(=O)(=O)C2CCCC2)cc1 ZINC000481572870 896952237 /nfs/dbraw/zinc/95/22/37/896952237.db2.gz NFTNCMDTGYIQKF-GOSISDBHSA-N 0 3 409.555 4.439 20 0 HIADHN COc1cc([C@@H](C)NCc2cccc(CN3CCO[C@H](C)C3)c2)ccc1OC(F)F ZINC000481585338 896964950 /nfs/dbraw/zinc/96/49/50/896964950.db2.gz VAZQRMXFEDIFLZ-IAGOWNOFSA-N 0 3 420.500 4.368 20 0 HIADHN COc1cccc([C@@H]2C[C@H]2C(=O)Nc2cc(C)cc(N3CCN(C(C)C)CC3)c2)c1 ZINC000481644616 897029589 /nfs/dbraw/zinc/02/95/89/897029589.db2.gz MEQGGPCEHUVUOH-BJKOFHAPSA-N 0 3 407.558 4.276 20 0 HIADHN Cc1cc(NC(=O)C[C@@H]2CCO[C@@H](C(C)C)C2)cc(N2CCN(C(C)C)CC2)c1 ZINC000481663119 897046623 /nfs/dbraw/zinc/04/66/23/897046623.db2.gz NUCJVTFIFJFEOO-NFBKMPQASA-N 0 3 401.595 4.305 20 0 HIADHN C[C@H](NCCNc1ccc(-c2ccccc2)nn1)c1ccc(-n2cncn2)cc1Cl ZINC000481671062 897054750 /nfs/dbraw/zinc/05/47/50/897054750.db2.gz PJFPRUIIUPDGIW-INIZCTEOSA-N 0 3 419.920 4.140 20 0 HIADHN Brc1ccc(CN[C@H](c2cccnc2)C2CCC2)c(N2CCOCC2)c1 ZINC000481671646 897055177 /nfs/dbraw/zinc/05/51/77/897055177.db2.gz PWSQLZVZWJDHKN-NRFANRHFSA-N 0 3 416.363 4.312 20 0 HIADHN CCOC(=O)C[C@](C)(NCC(=O)Nc1cccc(-c2csc(C)n2)c1)C(C)C ZINC000481688598 897073444 /nfs/dbraw/zinc/07/34/44/897073444.db2.gz SKTQJXUZSCUDTP-NRFANRHFSA-N 0 3 403.548 4.015 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)CCN1CCC[C@@]2(C1)OCc1ccccc12 ZINC000481690208 897075501 /nfs/dbraw/zinc/07/55/01/897075501.db2.gz DRPQFXNBSLGKDB-QFIPXVFZSA-N 0 3 400.906 4.199 20 0 HIADHN CNS(=O)(=O)c1ccc([C@@H](C)NCc2ccc(-c3ccc4c(c3)CCO4)cc2)cc1 ZINC000481716342 897107692 /nfs/dbraw/zinc/10/76/92/897107692.db2.gz KKISIPPGFMTOML-QGZVFWFLSA-N 0 3 422.550 4.047 20 0 HIADHN CC[C@@H](CN(CC)[C@H](C)C(=O)NCC(=O)Nc1c(C)cccc1C)c1ccccc1 ZINC000481734890 897129779 /nfs/dbraw/zinc/12/97/79/897129779.db2.gz LUISRQTXCQABHD-RTWAWAEBSA-N 0 3 409.574 4.262 20 0 HIADHN COC1CCN(C(C)(C)CNC(=O)c2sc(C3CC3)nc2-c2ccccc2)CC1 ZINC000481775636 897160283 /nfs/dbraw/zinc/16/02/83/897160283.db2.gz GBVLBWDUHQMHGF-UHFFFAOYSA-N 0 3 413.587 4.307 20 0 HIADHN CCCN(C(=O)NC1CCN(CCOC(C)C)CC1)[C@@H]1C[C@@H](OCC)C12CCCC2 ZINC000481788022 897169272 /nfs/dbraw/zinc/16/92/72/897169272.db2.gz YSRISVRFJOJAKK-FGZHOGPDSA-N 0 3 423.642 4.035 20 0 HIADHN COCCOc1cc2c(cc1CNC1CC(F)(c3cccc(Cl)c3)C1)OCO2 ZINC000481823650 897194764 /nfs/dbraw/zinc/19/47/64/897194764.db2.gz XUFGHTDDCONFIL-UHFFFAOYSA-N 0 3 407.869 4.211 20 0 HIADHN CN1C[C@@H](NC(=O)Cc2csc(-c3ccc(Cl)cc3)n2)[C@@H](c2ccccc2)C1 ZINC000481847129 897213977 /nfs/dbraw/zinc/21/39/77/897213977.db2.gz MMHYTIRFLLJCGQ-WOJBJXKFSA-N 0 3 411.958 4.220 20 0 HIADHN COc1cccc(N2CC[C@H](CN[C@@H](C)c3nnn(-c4ccc(C)cc4)c3C)C2)c1 ZINC000481934421 897319497 /nfs/dbraw/zinc/31/94/97/897319497.db2.gz RUICWHOGHREACI-AZUAARDMSA-N 0 3 405.546 4.070 20 0 HIADHN COc1ccc(-c2nnc(NC(=O)N[C@@H]3CCN([C@@H](C)c4ccccc4)C3)s2)cc1 ZINC000481974832 897367675 /nfs/dbraw/zinc/36/76/75/897367675.db2.gz SUHPJYQSUQJRPK-MAUKXSAKSA-N 0 3 423.542 4.171 20 0 HIADHN CCCNc1ccc(CN[C@@H](CC)c2ccc(Cl)c(S(=O)(=O)NC)c2)cc1 ZINC000481995478 897391325 /nfs/dbraw/zinc/39/13/25/897391325.db2.gz VKMWTSAJTVRAJL-IBGZPJMESA-N 0 3 409.983 4.311 20 0 HIADHN COc1c(F)ccc(F)c1C(=O)Nc1cc(C)cc(N2CCN(C(C)C)CC2)c1 ZINC000482035159 897449024 /nfs/dbraw/zinc/44/90/24/897449024.db2.gz SETMAXZHARDSLR-UHFFFAOYSA-N 0 3 403.473 4.065 20 0 HIADHN Cc1c(C(=O)Nc2cc(C)cc(N3CCN(C(C)C)CC3)c2)cnn1CCC(C)C ZINC000482043957 897463921 /nfs/dbraw/zinc/46/39/21/897463921.db2.gz PYWGBOIVSHBEJV-UHFFFAOYSA-N 0 3 411.594 4.329 20 0 HIADHN Cc1cc(NC(=O)c2ccc(-c3cnco3)cc2)cc(N2CCN(C(C)C)CC2)c1 ZINC000482052371 897478144 /nfs/dbraw/zinc/47/81/44/897478144.db2.gz WSPFQUXZTYYYLO-UHFFFAOYSA-N 0 3 404.514 4.433 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)NC[C@H]2CCO[C@@H]2c2ccccc2)N2CCCC2)cc1 ZINC000482068205 897503067 /nfs/dbraw/zinc/50/30/67/897503067.db2.gz RNUIASLNAMAPGC-WXFUMESZSA-N 0 3 407.558 4.209 20 0 HIADHN C[C@H](NCc1ccc([C@]2(C)NC(=O)NC2=O)cc1)c1ccc(Oc2ccccc2)cc1 ZINC000482104222 897552797 /nfs/dbraw/zinc/55/27/97/897552797.db2.gz FNVTZKFDUTWFPW-GKVSMKOHSA-N 0 3 415.493 4.384 20 0 HIADHN Cc1nc(-c2cccnc2)sc1[C@@H](C)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1 ZINC000482125097 897582913 /nfs/dbraw/zinc/58/29/13/897582913.db2.gz JCIGPNMWMZCFKA-UTKZUKDTSA-N 0 3 420.582 4.398 20 0 HIADHN CC1(C)C[C@H](NCC(=O)N2N=C(c3cccs3)C[C@H]2c2cccs2)C(C)(C)O1 ZINC000482165395 897630219 /nfs/dbraw/zinc/63/02/19/897630219.db2.gz RHJZNNSBOIJBQJ-YJBOKZPZSA-N 0 3 417.600 4.423 20 0 HIADHN COC(=O)c1ccc(COc2ccc(CNC3(c4ccccc4)CC3)cc2OC)o1 ZINC000482208064 897688187 /nfs/dbraw/zinc/68/81/87/897688187.db2.gz GOMINSKEBPCZMP-UHFFFAOYSA-N 0 3 407.466 4.433 20 0 HIADHN CCC[C@@H](N[C@@H](C)c1cc(OC)c(OC)cc1C)C(=O)N1CCc2sccc2C1 ZINC000482237477 897718516 /nfs/dbraw/zinc/71/85/16/897718516.db2.gz DLOWVLACFNEAAZ-QFBILLFUSA-N 0 3 416.587 4.478 20 0 HIADHN CCC[C@@H](N[C@H](C)c1ccc(-n2ccnc2)cc1)C(=O)N1CCc2sccc2C1 ZINC000482253632 897735134 /nfs/dbraw/zinc/73/51/34/897735134.db2.gz RFFUYMAYLFFBGD-DYESRHJHSA-N 0 3 408.571 4.338 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)N[C@@H](C3CCCCC3)C(F)(F)F)CC2)C[C@@H](C)O1 ZINC000482265739 897751280 /nfs/dbraw/zinc/75/12/80/897751280.db2.gz HAGQLTPIZZERDE-MDZRGWNJSA-N 0 3 419.532 4.028 20 0 HIADHN CCCN(Cc1ccccc1OCC(=O)NCC1CC1)[C@H]1CCCc2cccnc21 ZINC000482290737 897786232 /nfs/dbraw/zinc/78/62/32/897786232.db2.gz XHRPNYJQLJKJGF-QFIPXVFZSA-N 0 3 407.558 4.276 20 0 HIADHN C[C@@H](C(=O)Nc1ccc(C(=O)N(C)[C@H]2CCCN(C)C2)cc1)c1cc2ccccc2o1 ZINC000482318227 897816614 /nfs/dbraw/zinc/81/66/14/897816614.db2.gz SBEFDVCLVZTAMZ-UTKZUKDTSA-N 0 3 419.525 4.341 20 0 HIADHN COc1ccc([C@H](NC(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)C(F)(F)F)cc1 ZINC000482328081 897830981 /nfs/dbraw/zinc/83/09/81/897830981.db2.gz IRDONRZZUJADTK-BPAFIMBUSA-N 0 3 421.463 4.433 20 0 HIADHN COc1ccc([C@@H](NC(=O)N(CCN(C)C)Cc2cccs2)C(F)(F)F)cc1 ZINC000482338236 897844685 /nfs/dbraw/zinc/84/46/85/897844685.db2.gz ZACSYMZGXNHSMK-QGZVFWFLSA-N 0 3 415.481 4.134 20 0 HIADHN COc1ccc([C@@H](NC(=O)N[C@@H](CN2CCCC2)c2ccccc2)C(F)(F)F)cc1 ZINC000482364310 897882285 /nfs/dbraw/zinc/88/22/85/897882285.db2.gz VICOTQWJTWBQDH-VQTJNVASSA-N 0 3 421.463 4.435 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)c2csc(CCc3ccccc3)n2)c1 ZINC000482366507 897887028 /nfs/dbraw/zinc/88/70/28/897887028.db2.gz MYWDLZKLWSITKG-UHFFFAOYSA-N 0 3 423.582 4.141 20 0 HIADHN Cc1c2cc(C)ccc2[nH]c1C(=O)Nc1ccc(C(=O)N(C)[C@H]2CCCN(C)C2)cc1 ZINC000482416684 897965555 /nfs/dbraw/zinc/96/55/55/897965555.db2.gz ROBGLOKGGYTZMB-FQEVSTJZSA-N 0 3 418.541 4.203 20 0 HIADHN COC(=O)c1ccc(C(C)C)c(NC(=O)N[C@@H](CN(C)C)c2ccc(F)cc2)c1 ZINC000482419409 897968916 /nfs/dbraw/zinc/96/89/16/897968916.db2.gz FTQUSEATXAXFRK-FQEVSTJZSA-N 0 3 401.482 4.160 20 0 HIADHN CC(C)CN(CCN(C)C)C(=O)N[C@H](c1ccccc1OC(F)F)C(F)(F)F ZINC000482428921 897984274 /nfs/dbraw/zinc/98/42/74/897984274.db2.gz WAYIONJXFAOTEW-OAHLLOKOSA-N 0 3 411.415 4.121 20 0 HIADHN C[C@H](NC(=O)N[C@H](c1ccccc1C(F)(F)F)C(F)(F)F)C1=CCN(C)CC1 ZINC000482451245 898017215 /nfs/dbraw/zinc/01/72/15/898017215.db2.gz MWSMQVBBYIXHBM-XHDPSFHLSA-N 0 3 409.374 4.258 20 0 HIADHN COc1ccc(CN[C@H](C)c2ccc(NS(C)(=O)=O)cc2)cc1OC1CCCC1 ZINC000482456237 898025104 /nfs/dbraw/zinc/02/51/04/898025104.db2.gz ZDKWTNMPBMNFMZ-MRXNPFEDSA-N 0 3 418.559 4.239 20 0 HIADHN C[C@@H](NC(=O)Nc1cccc2c1CN(CC(F)(F)F)C2)[C@@H](c1ccccc1)N(C)C ZINC000482475212 898050897 /nfs/dbraw/zinc/05/08/97/898050897.db2.gz JIPMWBZQAQNUJG-QRWLVFNGSA-N 0 3 420.479 4.377 20 0 HIADHN CC(C)(C)c1nn(-c2ccccc2)cc1CN1CCC(c2nnc3n2CCCC3)CC1 ZINC000482489955 898068021 /nfs/dbraw/zinc/06/80/21/898068021.db2.gz LUWAHLULQHAUJL-UHFFFAOYSA-N 0 3 418.589 4.477 20 0 HIADHN CCO[C@@H]1C[C@H](NCc2ccccc2OCc2ccncc2)[C@H]1Oc1ccccc1 ZINC000482496264 898076306 /nfs/dbraw/zinc/07/63/06/898076306.db2.gz SOYQXNDPHCGIQR-ICDZXHCJSA-N 0 3 404.510 4.375 20 0 HIADHN CCOc1cc(CN2CCC([C@@H](C)NC(C)=O)CC2)ccc1OCc1ccccc1 ZINC000482534955 898122316 /nfs/dbraw/zinc/12/23/16/898122316.db2.gz VKGDOFIBTWBSIY-LJQANCHMSA-N 0 3 410.558 4.401 20 0 HIADHN CC[C@@H](N[C@@H](C)c1cc(F)ccc1N1CCN(C)CC1)c1ccc2c(c1)OCCO2 ZINC000482565129 898158245 /nfs/dbraw/zinc/15/82/45/898158245.db2.gz MPMXLKGMYSRVLJ-LAUBAEHRSA-N 0 3 413.537 4.151 20 0 HIADHN Cc1c([C@@H](C)NC[C@H](O)COc2ccc(F)c(F)c2)cnn1-c1cccc(Cl)c1 ZINC000482568626 898164063 /nfs/dbraw/zinc/16/40/63/898164063.db2.gz HXOQDVHHMYJZSS-DYVFJYSZSA-N 0 3 421.875 4.203 20 0 HIADHN COc1cc(C(=O)Nc2cc(CN(C)C)ccc2C)ccc1OCc1cscn1 ZINC000482589972 898189586 /nfs/dbraw/zinc/18/95/86/898189586.db2.gz BLTWMHBPPDHYCI-UHFFFAOYSA-N 0 3 411.527 4.353 20 0 HIADHN Cc1ccc(C(=O)Nc2cc(CN(C)C)ccc2C)cc1I ZINC000482604112 898205544 /nfs/dbraw/zinc/20/55/44/898205544.db2.gz IBMQSNHQSKLAHY-UHFFFAOYSA-N 0 3 408.283 4.222 20 0 HIADHN CC[C@@H](C)[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)Nc1cc(CN(C)C)ccc1C ZINC000482627287 898229661 /nfs/dbraw/zinc/22/96/61/898229661.db2.gz GFFVAMAJAWVQCN-QVKFZJNVSA-N 0 3 415.965 4.493 20 0 HIADHN CC[C@H](C)[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)Nc1cc(CN(C)C)ccc1C ZINC000482627285 898229732 /nfs/dbraw/zinc/22/97/32/898229732.db2.gz GFFVAMAJAWVQCN-BTYIYWSLSA-N 0 3 415.965 4.493 20 0 HIADHN Cc1c(C(=O)Nc2cc(CN(C)C)ccc2C)sc2nc3n(c(=O)c12)CCCCC3 ZINC000482631094 898233974 /nfs/dbraw/zinc/23/39/74/898233974.db2.gz OCOKTKAZLAXNAZ-UHFFFAOYSA-N 0 3 424.570 4.115 20 0 HIADHN C[C@H](NCCCN1CCCCC1=O)c1ccc(Br)cc1Br ZINC000482634204 898239135 /nfs/dbraw/zinc/23/91/35/898239135.db2.gz RMQIDCYVRJDMOU-LBPRGKRZSA-N 0 3 418.173 4.265 20 0 HIADHN Cc1cc(C)cc(C(=O)N2CCC[C@H](C(=O)Nc3cc(CN(C)C)ccc3C)C2)c1 ZINC000482638269 898241738 /nfs/dbraw/zinc/24/17/38/898241738.db2.gz ZRIBYUDOFJKYRD-NRFANRHFSA-N 0 3 407.558 4.164 20 0 HIADHN Cc1nc(-c2ccc(C)c(NC(=O)[C@@H]3CCCN(Cc4cccc(F)c4)C3)c2)n[nH]1 ZINC000482765911 898372896 /nfs/dbraw/zinc/37/28/96/898372896.db2.gz IWCPXQLYJKTUKS-LJQANCHMSA-N 0 3 407.493 4.078 20 0 HIADHN CCN1C[C@H](C)N(CCOc2c(Br)cccc2Br)C[C@@H]1C ZINC000482799320 898407918 /nfs/dbraw/zinc/40/79/18/898407918.db2.gz SAJPWWGSGPGRLW-STQMWFEESA-N 0 3 420.189 4.005 20 0 HIADHN C[C@@H](NCCOc1c(Br)cccc1Br)c1ccccn1 ZINC000482825048 898433287 /nfs/dbraw/zinc/43/32/87/898433287.db2.gz KNBUGTQCMLSELS-LLVKDONJSA-N 0 3 400.114 4.336 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCCC1)c1cc(F)ccc1Br ZINC000482830675 898438479 /nfs/dbraw/zinc/43/84/79/898438479.db2.gz YQBADVCJBMAJOJ-UHFFFAOYSA-N 0 3 415.372 4.070 20 0 HIADHN COc1cc(NC(=O)CCN2CCCC[C@H]2c2ccc(F)cc2)cc(OC)c1OC ZINC000482919147 898536219 /nfs/dbraw/zinc/53/62/19/898536219.db2.gz UNPRMYDXOPILEM-IBGZPJMESA-N 0 3 416.493 4.407 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc([S@](C)=O)cc1)c1ccc(NC(=O)c2ccncc2)cc1 ZINC000482941619 898565280 /nfs/dbraw/zinc/56/52/80/898565280.db2.gz AZJIRIUDCKJTDC-HGKJHCCASA-N 0 3 407.539 4.483 20 0 HIADHN CC[C@H](C)Sc1ccc(NC(=O)N2CC[C@@H](N3CCN(C)CC3)[C@H](C)C2)c(C)c1 ZINC000482990580 898633723 /nfs/dbraw/zinc/63/37/23/898633723.db2.gz JHWHKDMQJZQAKX-XQBPLPMBSA-N 0 3 418.651 4.375 20 0 HIADHN CO[C@@]1(C)CCCN(CC(=O)N[C@H](c2ccccc2)c2ccc(Cl)cc2)CC1 ZINC000483028577 898689955 /nfs/dbraw/zinc/68/99/55/898689955.db2.gz QTNGVESRHALOHY-PKTZIBPZSA-N 0 3 400.950 4.437 20 0 HIADHN C[C@@H](NC(=O)c1ccc(-c2noc(C(F)(F)F)n2)cc1)[C@@H](c1ccccc1)N(C)C ZINC000505575033 914280427 /nfs/dbraw/zinc/28/04/27/914280427.db2.gz NVOSOVYXJKSFBT-DYVFJYSZSA-N 0 3 418.419 4.177 20 0 HIADHN COCCOc1ccc(C(F)(F)F)cc1NC(=O)CN(C)[C@@H]1CCC(C)(C)C1 ZINC000483120917 898808726 /nfs/dbraw/zinc/80/87/26/898808726.db2.gz UYAQRPJPMRHQIZ-OAHLLOKOSA-N 0 3 402.457 4.180 20 0 HIADHN C[C@H](N[C@H](CO)Cc1c[nH]c2ccccc12)c1ccccc1I ZINC000483142737 898821462 /nfs/dbraw/zinc/82/14/62/898821462.db2.gz MVIALBMUQUOFBF-ZFWWWQNUSA-N 0 3 420.294 4.027 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)N[C@H](C)c2ccccc2C(F)(F)F)cc1 ZINC000483142636 898821712 /nfs/dbraw/zinc/82/17/12/898821712.db2.gz XILMSDNERQLXIS-KUHUBIRLSA-N 0 3 409.452 4.377 20 0 HIADHN COCCNS(=O)(=O)c1cccc(CN[C@H](C)c2cccc(-c3ccccc3)c2)c1 ZINC000483185730 898847069 /nfs/dbraw/zinc/84/70/69/898847069.db2.gz SANAUNWCXMLVBE-LJQANCHMSA-N 0 3 424.566 4.129 20 0 HIADHN COc1cnccc1N1CCN(Cc2nc(-c3ccccc3Cl)cs2)CC1 ZINC000483215612 898864255 /nfs/dbraw/zinc/86/42/55/898864255.db2.gz RIDUTWOQQVDVGY-UHFFFAOYSA-N 0 3 400.935 4.189 20 0 HIADHN CCCOc1ccc(C(C)(C)NCC(=O)NCCc2nc3ccccc3s2)cc1 ZINC000483278684 898914647 /nfs/dbraw/zinc/91/46/47/898914647.db2.gz CPBXMSUKGDCSHC-UHFFFAOYSA-N 0 3 411.571 4.269 20 0 HIADHN Cc1ccc(NC(=O)NC[C@H]2CCCN(Cc3ccc(N(C)C(C)C)nc3)C2)cc1 ZINC000483281989 898918107 /nfs/dbraw/zinc/91/81/07/898918107.db2.gz OUJQGWWKVYJYFO-HXUWFJFHSA-N 0 3 409.578 4.268 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)NCc1cc(F)cc(Br)c1)c1ccco1 ZINC000483282669 898918594 /nfs/dbraw/zinc/91/85/94/898918594.db2.gz KEQFWTSBPXQQOG-MLGOLLRUSA-N 0 3 412.303 4.110 20 0 HIADHN CCCOc1ccc(C(C)(C)NCC(=O)N2CCc3[nH]c4ccccc4c3C2)cc1 ZINC000483286317 898921708 /nfs/dbraw/zinc/92/17/08/898921708.db2.gz QQDJNCOFFQVOQB-UHFFFAOYSA-N 0 3 405.542 4.366 20 0 HIADHN COCCN(C)c1ccc(CN2CCC[C@@H](COc3ccccc3Cl)C2)cn1 ZINC000483297595 898930695 /nfs/dbraw/zinc/93/06/95/898930695.db2.gz PKBSOVPVELNHJA-LJQANCHMSA-N 0 3 403.954 4.109 20 0 HIADHN O=C(Nc1ccc(-c2noc(C(F)F)n2)cc1)N1CCN(C2CCCCC2)CC1 ZINC000483341552 898972543 /nfs/dbraw/zinc/97/25/43/898972543.db2.gz AKMXTFIDAMXHCF-UHFFFAOYSA-N 0 3 405.449 4.156 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)NCCCCc2ccc(F)c(F)c2)CC1 ZINC000483386186 899021659 /nfs/dbraw/zinc/02/16/59/899021659.db2.gz WTHVBRMNSIEUCU-UHFFFAOYSA-N 0 3 405.489 4.187 20 0 HIADHN CS[C@H]1CN(C(=O)c2sc(-c3ccc(F)c(F)c3)nc2C)C[C@@H]1N1CCCC1 ZINC000483393969 899029081 /nfs/dbraw/zinc/02/90/81/899029081.db2.gz IPBIBSVDSBDPMG-IRXDYDNUSA-N 0 3 423.554 4.049 20 0 HIADHN C[C@@H](NC(=O)C1CCN(c2nc3ccccc3s2)CC1)[C@H](c1ccccc1)N(C)C ZINC000505602849 914308854 /nfs/dbraw/zinc/30/88/54/914308854.db2.gz AJQRGYZPHMWRPH-VGOFRKELSA-N 0 3 422.598 4.320 20 0 HIADHN CN(C)C[C@@H](NC(=O)Nc1cc(F)c(OC(F)F)cc1F)c1ccc(F)cc1 ZINC000483454957 899093044 /nfs/dbraw/zinc/09/30/44/899093044.db2.gz AQZVPSNYQBCRQK-OAHLLOKOSA-N 0 3 403.351 4.130 20 0 HIADHN CC(=O)c1cc(C(=O)Nc2c(C)cnn2[C@H]2CCN(Cc3ccccc3)C2)cs1 ZINC000483467043 899108803 /nfs/dbraw/zinc/10/88/03/899108803.db2.gz GXFGTEIZMULASR-IBGZPJMESA-N 0 3 408.527 4.155 20 0 HIADHN O=C(CN1CCN(C2CCCCC2)CC1)NCCC(c1ccccc1)c1ccccc1 ZINC000483491852 899146565 /nfs/dbraw/zinc/14/65/65/899146565.db2.gz NDPKVMJMRYTSRP-UHFFFAOYSA-N 0 3 419.613 4.275 20 0 HIADHN COCCOC1CCC(C(=O)N(c2cccc(SC)c2)C2CCN(C)CC2)CC1 ZINC000483511105 899173355 /nfs/dbraw/zinc/17/33/55/899173355.db2.gz BQWINCWBUQPRQJ-UHFFFAOYSA-N 0 3 420.619 4.058 20 0 HIADHN C[C@@H](NC(=O)c1c[nH]nc1-c1cccc(OC(F)F)c1)[C@H](c1ccccc1)N(C)C ZINC000505629434 914329048 /nfs/dbraw/zinc/32/90/48/914329048.db2.gz IIMCAFNIDDDLBC-JLTOFOAXSA-N 0 3 414.456 4.099 20 0 HIADHN C[C@@H](NCc1cccc(OCC(N)=O)c1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000483635976 899291361 /nfs/dbraw/zinc/29/13/61/899291361.db2.gz IZAHMAMOOLEUDJ-LLVKDONJSA-N 0 3 420.353 4.439 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)Nc2c(F)cc(F)cc2-c2ccccc2)CC1 ZINC000483645508 899301315 /nfs/dbraw/zinc/30/13/15/899301315.db2.gz BZMBNXCNWHFVKK-QGZVFWFLSA-N 0 3 416.516 4.027 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2ccc3cnn(C(C)C)c3c2)c1 ZINC000483711488 899368223 /nfs/dbraw/zinc/36/82/23/899368223.db2.gz OHEHIODABXQMFG-UHFFFAOYSA-N 0 3 409.534 4.222 20 0 HIADHN COc1cccc(-c2ccc(CN[C@@H](C)c3ccc(S(=O)(=O)N(C)C)cc3)cc2)c1 ZINC000483713657 899371081 /nfs/dbraw/zinc/37/10/81/899371081.db2.gz NHZDKVYDTVZNAF-SFHVURJKSA-N 0 3 424.566 4.463 20 0 HIADHN CO[C@@H]1CCCC[C@H]1NCC(=O)N1N=C(c2ccc(Cl)cc2)C[C@@H]1c1ccco1 ZINC000483718079 899377577 /nfs/dbraw/zinc/37/75/77/899377577.db2.gz CVFUNBLFFGKWOS-MISYRCLQSA-N 0 3 415.921 4.158 20 0 HIADHN Cc1ccc(NC(=O)[C@H](C)Oc2ccc(F)cc2Br)c(CN(C)C)c1 ZINC000505655070 914354017 /nfs/dbraw/zinc/35/40/17/914354017.db2.gz JHWQTUWFPCSNLC-ZDUSSCGKSA-N 0 3 409.299 4.364 20 0 HIADHN COc1cc(Cl)cc(C(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000483800424 899475614 /nfs/dbraw/zinc/47/56/14/899475614.db2.gz LQSMXUIDSTVKER-IBGZPJMESA-N 0 3 410.905 4.244 20 0 HIADHN CC(C)Cc1ccc([C@H](CNC(=O)Nc2cccc(N3CCC3=O)c2)N(C)C)cc1 ZINC000483803729 899479292 /nfs/dbraw/zinc/47/92/92/899479292.db2.gz NQNQWYGPEYIENN-QFIPXVFZSA-N 0 3 408.546 4.046 20 0 HIADHN CN(C(=O)N[C@H]1CCN(C2CC2)C1)[C@H](c1ccc(F)cc1)c1ccc(Cl)cc1 ZINC000483812679 899489474 /nfs/dbraw/zinc/48/94/74/899489474.db2.gz ZDYUWWLFGHBCTO-FPOVZHCZSA-N 0 3 401.913 4.447 20 0 HIADHN CC[C@@H]1Oc2cc([C@H](C)N[C@@H](C)c3ccc(NC(=O)NC4CC4)cc3)ccc2NC1=O ZINC000483848382 899529255 /nfs/dbraw/zinc/52/92/55/899529255.db2.gz KWRZGADCCOBWNF-GXZWQRSESA-N 0 3 422.529 4.492 20 0 HIADHN CC[C@@H]1Oc2cc([C@@H](C)N[C@H](C)c3ccc(NC(=O)NC4CC4)cc3)ccc2NC1=O ZINC000483848383 899529602 /nfs/dbraw/zinc/52/96/02/899529602.db2.gz KWRZGADCCOBWNF-PZPWOCDFSA-N 0 3 422.529 4.492 20 0 HIADHN CC[C@@H](N[C@@H](C)c1cccc(-n2cccn2)c1)c1ccccc1OCC(=O)N(C)C ZINC000483851838 899534103 /nfs/dbraw/zinc/53/41/03/899534103.db2.gz LMUHKFPXDIOJCZ-PGRDOPGGSA-N 0 3 406.530 4.141 20 0 HIADHN CCOc1cc(C(=O)N2CCN(C3CCCCC3)CC2)ccc1OCc1cccnc1 ZINC000483875055 899553033 /nfs/dbraw/zinc/55/30/33/899553033.db2.gz XLDBBEQVPNERGF-UHFFFAOYSA-N 0 3 423.557 4.150 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N[C@@H](c1cc(F)ccc1F)C(F)F)c1ccco1 ZINC000483877991 899555541 /nfs/dbraw/zinc/55/55/41/899555541.db2.gz UHPYIGMRWJXNBW-KCTSRDHCSA-N 0 3 401.404 4.293 20 0 HIADHN CCCN(C)[C@H](CNC(=O)Nc1cccc(N2CCC2=O)c1)c1ccc(Cl)cc1 ZINC000483889128 899563829 /nfs/dbraw/zinc/56/38/29/899563829.db2.gz VOQLRDFFIOWTCC-HXUWFJFHSA-N 0 3 414.937 4.281 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)NC[C@H]2CCCC[C@@H]2C(F)(F)F)CC1 ZINC000484049107 899682318 /nfs/dbraw/zinc/68/23/18/899682318.db2.gz SDMVTJAVTUTHEP-QAPCUYQASA-N 0 3 401.473 4.254 20 0 HIADHN Cc1nn(C)c2nc(-c3ccccc3)cc(C(=O)N3CCN(C4CCCCC4)CC3)c12 ZINC000484117578 899740625 /nfs/dbraw/zinc/74/06/25/899740625.db2.gz RDYIUZKIRJCDHG-UHFFFAOYSA-N 0 3 417.557 4.034 20 0 HIADHN Cc1cc(NC(=O)c2c[nH]c(C(F)(F)F)c2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000484153676 899773775 /nfs/dbraw/zinc/77/37/75/899773775.db2.gz CCUHHUDYMLNQJG-KRWDZBQOSA-N 0 3 417.435 4.238 20 0 HIADHN Cc1cccc(-c2cccc(CNC(=O)C(=O)Nc3cc(CN(C)C)ccc3C)c2)c1 ZINC000484153552 899774260 /nfs/dbraw/zinc/77/42/60/899774260.db2.gz AZSCKJSHGMCICZ-UHFFFAOYSA-N 0 3 415.537 4.287 20 0 HIADHN Cc1cc(NC(=O)c2oc(C(C)C)nc2C)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000484160635 899780672 /nfs/dbraw/zinc/78/06/72/899780672.db2.gz PMPCTYQUFLYOQS-LJQANCHMSA-N 0 3 407.518 4.311 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N1CCCC[C@@H]1c1cc2ccccc2[nH]1 ZINC000484184071 899800512 /nfs/dbraw/zinc/80/05/12/899800512.db2.gz BENZGWPIFKUEMS-HSZRJFAPSA-N 0 3 418.541 4.230 20 0 HIADHN Cc1ccc(Oc2ccccc2)c(NC(=O)N2CC[C@H](N3CCN(C)CC3)[C@@H](C)C2)c1 ZINC000484225291 899821837 /nfs/dbraw/zinc/82/18/37/899821837.db2.gz XGLRKXNECGQXMD-REWPJTCUSA-N 0 3 422.573 4.277 20 0 HIADHN CSc1cccc(N(C(=O)COc2ccc(F)cc2F)C2CCN(C)CC2)c1 ZINC000484282198 899849675 /nfs/dbraw/zinc/84/96/75/899849675.db2.gz JTPFGYSUZZWGKK-UHFFFAOYSA-N 0 3 406.498 4.193 20 0 HIADHN COc1cc2[nH]c(CCCN[C@@H](C)c3nnn(-c4ccccc4)c3C)cc2c(OC)c1 ZINC000484292962 899856525 /nfs/dbraw/zinc/85/65/25/899856525.db2.gz JMFZATJMPJQAEI-INIZCTEOSA-N 0 3 419.529 4.358 20 0 HIADHN CSc1cccc(N(C(=O)Cn2nc(C)c(Cl)c2C)C2CCN(C)CC2)c1 ZINC000484297672 899860109 /nfs/dbraw/zinc/86/01/09/899860109.db2.gz QWURAZNPNZFPIY-UHFFFAOYSA-N 0 3 406.983 4.003 20 0 HIADHN COc1cccc2c1OCC(C(=O)N(c1cccc(SC)c1)C1CCN(C)CC1)=C2 ZINC000484410268 899932072 /nfs/dbraw/zinc/93/20/72/899932072.db2.gz SFMOSAQBZDRUGN-UHFFFAOYSA-N 0 3 424.566 4.320 20 0 HIADHN Cc1ccc([C@H](CN2C(=O)[C@@H]3CC[C@@H](c4ccccc4)N3C2=O)N2CCCC2)cc1 ZINC000484442911 899947822 /nfs/dbraw/zinc/94/78/22/899947822.db2.gz GIKJCAQOHHLKFN-VABKMULXSA-N 0 3 403.526 4.300 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2ccc3[nH]c(C(F)F)nc3c2)c1 ZINC000484493226 899984651 /nfs/dbraw/zinc/98/46/51/899984651.db2.gz BPYZYEGGFARMGR-UHFFFAOYSA-N 0 3 417.460 4.105 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(OCC2CC2)c(F)c1)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000484508453 899999012 /nfs/dbraw/zinc/99/90/12/899999012.db2.gz PIOIQJWCLNLVCP-HOTGVXAUSA-N 0 3 420.550 4.277 20 0 HIADHN O=C(C1CCCCC1)N1CC[C@H](N[C@H]2CCCOc3cc(Br)ccc32)C1 ZINC000484520753 900008870 /nfs/dbraw/zinc/00/88/70/900008870.db2.gz URUYNNMZJQNATO-HKUYNNGSSA-N 0 3 421.379 4.434 20 0 HIADHN CC(C)n1cc([C@@H](C)N[C@H]2CCN(c3ncc(C(F)(F)F)cc3Cl)C2)cn1 ZINC000484523627 900011693 /nfs/dbraw/zinc/01/16/93/900011693.db2.gz VVHYJGZRJPDGDC-DOMZBBRYSA-N 0 3 401.864 4.461 20 0 HIADHN O=[S@@](CCN[C@H](Cn1cnc2ccccc21)c1ccc(F)cc1)c1ccccc1 ZINC000484557522 900034416 /nfs/dbraw/zinc/03/44/16/900034416.db2.gz VHKRFMWGFDJZPH-MNNSJKJDSA-N 0 3 407.514 4.314 20 0 HIADHN Brc1cc2c(cc1CN[C@H]1CCCC[C@@H]1n1cccn1)OCCCO2 ZINC000484614606 900070698 /nfs/dbraw/zinc/07/06/98/900070698.db2.gz KKTKCNBCIURJNO-IRXDYDNUSA-N 0 3 406.324 4.080 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N(C[C@@H](C)c2ccccc2)[C@@H](C)CO)C1 ZINC000484692102 900129438 /nfs/dbraw/zinc/12/94/38/900129438.db2.gz WPSWMBHQLSMEQO-WHLIWEHUSA-N 0 3 409.574 4.018 20 0 HIADHN CCc1nc(C2CCN([C@H](c3nc(-c4ccccc4)no3)c3ccccc3)CC2)n[nH]1 ZINC000484709247 900142686 /nfs/dbraw/zinc/14/26/86/900142686.db2.gz VNRBSWZDBZLJNC-NRFANRHFSA-N 0 3 414.513 4.386 20 0 HIADHN CCc1n[nH]c(C2CCN([C@H](c3nc(-c4ccccc4)no3)c3ccccc3)CC2)n1 ZINC000484709247 900142690 /nfs/dbraw/zinc/14/26/90/900142690.db2.gz VNRBSWZDBZLJNC-NRFANRHFSA-N 0 3 414.513 4.386 20 0 HIADHN CCc1nnc(C2CCN([C@H](c3nc(-c4ccccc4)no3)c3ccccc3)CC2)[nH]1 ZINC000484709247 900142693 /nfs/dbraw/zinc/14/26/93/900142693.db2.gz VNRBSWZDBZLJNC-NRFANRHFSA-N 0 3 414.513 4.386 20 0 HIADHN COc1ccc([C@H](C)NC(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)c(C)c1OC ZINC000484742722 900165294 /nfs/dbraw/zinc/16/52/94/900165294.db2.gz ZCVWGHOUYGOBLQ-BJLQDIEVSA-N 0 3 411.546 4.208 20 0 HIADHN C[C@@H](NCC(=O)NC(=O)NC1CC1)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 ZINC000484796509 900201498 /nfs/dbraw/zinc/20/14/98/900201498.db2.gz LACZHFRQDUWZQF-LLVKDONJSA-N 0 3 411.449 4.073 20 0 HIADHN CCc1c(NC(=O)N2CC[C@H]3CCN(C)C[C@@H]32)cnn1-c1ccc(C(F)(F)F)cc1 ZINC000484816883 900219548 /nfs/dbraw/zinc/21/95/48/900219548.db2.gz AKTGWWDYZVPGGY-KUHUBIRLSA-N 0 3 421.467 4.011 20 0 HIADHN Cc1cccc(C(=O)N2CCCN(CCCC(=O)Nc3c(C)cccc3C)CC2)c1 ZINC000484983004 900339530 /nfs/dbraw/zinc/33/95/30/900339530.db2.gz ALSJFJNIEUGGMF-UHFFFAOYSA-N 0 3 407.558 4.179 20 0 HIADHN CC[C@@H](C(=O)Nc1c(-c2ccc(Br)cc2)nc(C)n1C)N(CC)CC ZINC000484993367 900346968 /nfs/dbraw/zinc/34/69/68/900346968.db2.gz CXFDMJCLWPNLCJ-INIZCTEOSA-N 0 3 407.356 4.217 20 0 HIADHN COc1ccc(NC(=O)CCN(Cc2cccs2)C[C@@H]2CCCO2)cc1Cl ZINC000484995349 900348483 /nfs/dbraw/zinc/34/84/83/900348483.db2.gz MDAZZGPDWCCGHN-INIZCTEOSA-N 0 3 408.951 4.420 20 0 HIADHN COc1cc(Cl)c(Cl)cc1NC(=O)NC1CCN(CCOC(C)C)CC1 ZINC000485004299 900356793 /nfs/dbraw/zinc/35/67/93/900356793.db2.gz UZIUPSOGLZBVDL-UHFFFAOYSA-N 0 3 404.338 4.013 20 0 HIADHN CCOc1ccc(NC(=O)CCN2CCC(C(=O)c3cc(F)ccc3F)CC2)cc1 ZINC000485047507 900381459 /nfs/dbraw/zinc/38/14/59/900381459.db2.gz DBUULFHBJAVCIA-UHFFFAOYSA-N 0 3 416.468 4.287 20 0 HIADHN CC(C)CC(=O)Nc1cccc(CNC(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)c1 ZINC000485342126 900632743 /nfs/dbraw/zinc/63/27/43/900632743.db2.gz CZFOZNHGKDSQFA-MBSDFSHPSA-N 0 3 410.562 4.162 20 0 HIADHN CC[C@@H](C)n1ncc(NC(=O)NC[C@H](c2cccc(OC)c2)N(CC)CC)c1C ZINC000485350949 900644446 /nfs/dbraw/zinc/64/44/46/900644446.db2.gz QVDLVFPDDAVXRJ-IIBYNOLFSA-N 0 3 401.555 4.376 20 0 HIADHN CCc1c(NC(=O)N(CCN(C)C)Cc2ccccc2)cnn1-c1ccccc1C ZINC000485358148 900652925 /nfs/dbraw/zinc/65/29/25/900652925.db2.gz NIHIFWWVCWCSQU-UHFFFAOYSA-N 0 3 405.546 4.339 20 0 HIADHN CCc1c(NC(=O)NCC2(N3CCSCC3)CCCC2)cnn1C(CC)CC ZINC000485363884 900658791 /nfs/dbraw/zinc/65/87/91/900658791.db2.gz GMALKNMTRYNNJP-UHFFFAOYSA-N 0 3 407.628 4.290 20 0 HIADHN COc1ccc(NC(=O)CCN(C)[C@@H](C)c2ccc([S@](C)=O)cc2)cc1Cl ZINC000485404810 900703658 /nfs/dbraw/zinc/70/36/58/900703658.db2.gz LMSWERZNKKNQRU-PWFNWSNSSA-N 0 3 408.951 4.108 20 0 HIADHN O=C(Nc1ccc(C(=O)NCCN2CCCC2)cc1)c1cc2c(s1)CCCCC2 ZINC000485496039 900785463 /nfs/dbraw/zinc/78/54/63/900785463.db2.gz JUOJRCIBUOYCLI-UHFFFAOYSA-N 0 3 411.571 4.095 20 0 HIADHN CCCN(CC)c1ccc(C(=O)Nc2ccc(C(=O)NCCN3CCCC3)cc2)cc1 ZINC000485501178 900789418 /nfs/dbraw/zinc/78/94/18/900789418.db2.gz FJBAVQBLRIGBFA-UHFFFAOYSA-N 0 3 422.573 4.001 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)C1(CC)CCOCC1)c1ccc(C(F)(F)F)cc1 ZINC000485602196 900862203 /nfs/dbraw/zinc/86/22/03/900862203.db2.gz DIGJITIHKRWIFQ-SFHVURJKSA-N 0 3 400.485 4.411 20 0 HIADHN CC(=O)Nc1ccc(OC[C@@H](O)CN(Cc2cc(F)cc(Cl)c2)C(C)C)cc1 ZINC000485696165 900945713 /nfs/dbraw/zinc/94/57/13/900945713.db2.gz NVFYQEKOGOTSOM-FQEVSTJZSA-N 0 3 408.901 4.088 20 0 HIADHN CC[C@@H](NC[C@@H](O)COc1ccc(C(C)=O)cc1)c1cc(F)cc(Br)c1 ZINC000485830129 901076643 /nfs/dbraw/zinc/07/66/43/901076643.db2.gz DISZIYLACUQJER-UYAOXDASSA-N 0 3 424.310 4.271 20 0 HIADHN COc1ccc([C@@H](NCCc2ccc(C)cc2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000486028575 901234863 /nfs/dbraw/zinc/23/48/63/901234863.db2.gz LCPYFZUKUJQQBM-XMMPIXPASA-N 0 3 409.551 4.329 20 0 HIADHN O=C(Nc1sc2c(c1C(=O)c1ccc(F)cc1)CCC2)C1CCN(C2CC2)CC1 ZINC000486120240 901307695 /nfs/dbraw/zinc/30/76/95/901307695.db2.gz MHCVRPWIGXHROU-UHFFFAOYSA-N 0 3 412.530 4.420 20 0 HIADHN Cc1ccc(S(=O)(=O)N[C@@H](CCN2CCC(C(F)F)CC2)c2ccccc2)cc1 ZINC000486125296 901312159 /nfs/dbraw/zinc/31/21/59/901312159.db2.gz IACUVZPWCHSDOW-NRFANRHFSA-N 0 3 422.541 4.382 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)NC[C@@H](c2ccccc2)C(F)(F)F)C1 ZINC000486141347 901329469 /nfs/dbraw/zinc/32/94/69/901329469.db2.gz CBGBTBWQWUGAEN-UXPWSPDFSA-N 0 3 405.464 4.467 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](NCCc2cccs2)c2ccc(F)c(F)c2)c1 ZINC000486149161 901337493 /nfs/dbraw/zinc/33/74/93/901337493.db2.gz QPNKLUFUJNTPOU-FQEVSTJZSA-N 0 3 407.507 4.352 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)c1cc2ccccc2n1CC(F)(F)F ZINC000486186117 901372352 /nfs/dbraw/zinc/37/23/52/901372352.db2.gz IQETYEGVMMMZQF-UHFFFAOYSA-N 0 3 409.477 4.469 20 0 HIADHN C[C@@H](C(=O)Nc1nc(-c2ccc(F)cc2)cs1)N1CCN(C2CCCCC2)CC1 ZINC000486243141 901425357 /nfs/dbraw/zinc/42/53/57/901425357.db2.gz JGTRHCFDARMFBF-INIZCTEOSA-N 0 3 416.566 4.227 20 0 HIADHN Cc1cc(NC(=O)[C@@H](C)N2CCN(C3CCCCC3)CC2)ccc1Br ZINC000486248048 901431405 /nfs/dbraw/zinc/43/14/05/901431405.db2.gz CDXQDXKFSDTUBN-MRXNPFEDSA-N 0 3 408.384 4.035 20 0 HIADHN COc1ccc(Cl)cc1S(=O)(=O)N(C)[C@H]1CCN(Cc2ccccc2)[C@@H](C)C1 ZINC000486250951 901434608 /nfs/dbraw/zinc/43/46/08/901434608.db2.gz GZUPVJOISWMOBD-LPHOPBHVSA-N 0 3 422.978 4.022 20 0 HIADHN C[C@@H](NC(=O)NCC1(N2CCSCC2)CCCC1)c1ccc2ncsc2c1 ZINC000486263083 901447288 /nfs/dbraw/zinc/44/72/88/901447288.db2.gz YHUJVEUYPLNUKH-OAHLLOKOSA-N 0 3 404.605 4.018 20 0 HIADHN CCCc1nc(C)c(NC(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)s1 ZINC000486322659 901499888 /nfs/dbraw/zinc/49/98/88/901499888.db2.gz KCVQLVMZSZXRAB-HZPDHXFCSA-N 0 3 408.612 4.147 20 0 HIADHN COc1ccc([C@@H](CNC(=O)[C@@H]2C[C@H]2c2ccc(Cl)s2)N2CCCC2)cc1 ZINC000486358480 901528655 /nfs/dbraw/zinc/52/86/55/901528655.db2.gz DITLMSNEVWJWOM-KZNAEPCWSA-N 0 3 404.963 4.467 20 0 HIADHN Cc1cc(C)c(NC(=O)N(CCN(C)C)Cc2ccccn2)cc1Br ZINC000486372351 901539132 /nfs/dbraw/zinc/53/91/32/901539132.db2.gz ZPOGQMOKUNACRR-UHFFFAOYSA-N 0 3 405.340 4.057 20 0 HIADHN CCOc1ccc(CN2C[C@H]3CCC[C@@]3(c3nc(CC4CC4)no3)C2)cc1OCC ZINC000486466818 901628003 /nfs/dbraw/zinc/62/80/03/901628003.db2.gz IQWFNTCRJQMUCU-NTKDMRAZSA-N 0 3 411.546 4.373 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)[C@H]1CCO[C@@H]1c1ccnn1-c1ccccc1C ZINC000486534782 901685036 /nfs/dbraw/zinc/68/50/36/901685036.db2.gz VBTORORXCHFZEG-RDPSFJRHSA-N 0 3 418.541 4.267 20 0 HIADHN CC(C)([C@H](NC(=O)CCCOc1cccnc1)c1ccc(F)c(F)c1)N1CCCC1 ZINC000486560038 901705877 /nfs/dbraw/zinc/70/58/77/901705877.db2.gz ATWFPXFGYWSOQZ-JOCHJYFZSA-N 0 3 417.500 4.251 20 0 HIADHN CC(C)([C@@H](NC(=O)c1cccc2nccnc21)c1ccc(F)c(F)c1)N1CCCC1 ZINC000486569023 901713527 /nfs/dbraw/zinc/71/35/27/901713527.db2.gz WETRHMRLWTUJFK-NRFANRHFSA-N 0 3 410.468 4.254 20 0 HIADHN CN(C)Cc1ccccc1C(=O)NCc1ccc(C(=O)Nc2ccc(F)cc2)cc1 ZINC000486618976 901754371 /nfs/dbraw/zinc/75/43/71/901754371.db2.gz FTGNJBHWHKVGKJ-UHFFFAOYSA-N 0 3 405.473 4.070 20 0 HIADHN CN(C)CCN(CC1CCCCC1)C(=O)c1cc(NC(=O)N(C)C)ccc1Cl ZINC000505920525 914566334 /nfs/dbraw/zinc/56/63/34/914566334.db2.gz DEWVOLNUMLWPOR-UHFFFAOYSA-N 0 3 408.974 4.018 20 0 HIADHN C[C@H]1CN(C2CCOCC2)CCN1C(=O)Nc1cc(C(F)(F)F)ccc1Cl ZINC000486762274 901837560 /nfs/dbraw/zinc/83/75/60/901837560.db2.gz NVZGQKYZRFPGAV-LBPRGKRZSA-N 0 3 405.848 4.076 20 0 HIADHN C[C@@H]1CN(C2CCOCC2)CCN1C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 ZINC000486770682 901843750 /nfs/dbraw/zinc/84/37/50/901843750.db2.gz JHFYFQOHHFNYSK-GFCCVEGCSA-N 0 3 405.848 4.076 20 0 HIADHN CC(C)c1c(NC(=O)N[C@H]2CCN(Cc3ccccc3)C2)cnn1-c1ccccc1 ZINC000486856932 901902297 /nfs/dbraw/zinc/90/22/97/901902297.db2.gz JVMOWGBFYNLUTN-FQEVSTJZSA-N 0 3 403.530 4.392 20 0 HIADHN FC(F)(F)c1ccc(-c2n[nH]cc2CNCc2ccccc2N2CCOCC2)cc1 ZINC000486965047 901992121 /nfs/dbraw/zinc/99/21/21/901992121.db2.gz IYYYJIBFKMUKEU-UHFFFAOYSA-N 0 3 416.447 4.222 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3ccc(C(=O)C4CCC4)cc3)CC2)C[C@@H](C)O1 ZINC000487062726 902043706 /nfs/dbraw/zinc/04/37/06/902043706.db2.gz ZAPDHBIDJRSRTI-QZTJIDSGSA-N 0 3 413.562 4.023 20 0 HIADHN CCCN1CCN(c2ccccc2CNc2cc(NC(=O)NCC)ccc2C)CC1 ZINC000487150087 902076770 /nfs/dbraw/zinc/07/67/70/902076770.db2.gz BSVAWFJTLAUHAR-UHFFFAOYSA-N 0 3 409.578 4.281 20 0 HIADHN FC(F)(F)c1ncc(CN[C@@H]2CCN(c3cccc(Br)c3)C2)s1 ZINC000487190252 902094642 /nfs/dbraw/zinc/09/46/42/902094642.db2.gz QXUMBAXTEUXFSJ-LLVKDONJSA-N 0 3 406.271 4.293 20 0 HIADHN Cc1nn(C)c(C)c1CCC(=O)N(CCN(C)Cc1ccccc1)Cc1ccccc1 ZINC000487407305 902189958 /nfs/dbraw/zinc/18/99/58/902189958.db2.gz ACWHVIFKZASCMO-UHFFFAOYSA-N 0 3 418.585 4.130 20 0 HIADHN Cc1nc(-c2ccc(C)cc2NC(=O)CN2CCC[C@@H]2Cc2ccc(C)cc2)n[nH]1 ZINC000487409982 902191483 /nfs/dbraw/zinc/19/14/83/902191483.db2.gz MFNWUNBDMLQQLA-HXUWFJFHSA-N 0 3 403.530 4.043 20 0 HIADHN CCCOc1ccc(Cl)cc1C(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000487739532 902331843 /nfs/dbraw/zinc/33/18/43/902331843.db2.gz MWHVZUTWIXUVPE-IAGOWNOFSA-N 0 3 408.970 4.090 20 0 HIADHN CCN(Cc1ccn(-c2ccc(F)cc2F)n1)CC1CCN(c2ccccn2)CC1 ZINC000487921379 902454117 /nfs/dbraw/zinc/45/41/17/902454117.db2.gz VUKKOYRIJLEJLC-UHFFFAOYSA-N 0 3 411.500 4.284 20 0 HIADHN Cc1ccc2nc(-c3ccc(NC(=O)CN4CCN(C)[C@H](C(C)C)C4)cc3)sc2c1 ZINC000488051965 902565656 /nfs/dbraw/zinc/56/56/56/902565656.db2.gz MGDAVSDXFNGYGO-NRFANRHFSA-N 0 3 422.598 4.482 20 0 HIADHN CC(C)c1nc(C2CCN(C[C@@H](O)CO[C@@H](C)c3ccc(Cl)cc3)CC2)no1 ZINC000505982265 914646367 /nfs/dbraw/zinc/64/63/67/914646367.db2.gz PEUUSVVHGKIENN-HNAYVOBHSA-N 0 3 407.942 4.165 20 0 HIADHN O=C(NCc1nc2ccccc2s1)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000505986206 914653224 /nfs/dbraw/zinc/65/32/24/914653224.db2.gz GQHVTNFKJXKGQS-INIZCTEOSA-N 0 3 401.482 4.070 20 0 HIADHN C[C@@H]1CN(C2CCOCC2)CCN1C(=O)Nc1c(F)cccc1Oc1ccccc1 ZINC000488291492 902753324 /nfs/dbraw/zinc/75/33/24/902753324.db2.gz HJJHOOYBALQCCF-QGZVFWFLSA-N 0 3 413.493 4.335 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)CCC(=O)c1ccc2c(c1)CCC2 ZINC000488480539 902847455 /nfs/dbraw/zinc/84/74/55/902847455.db2.gz CVSHWMXFTKDQFM-NTKDMRAZSA-N 0 3 404.554 4.165 20 0 HIADHN Cc1ccc(NC(=O)N2CCN(C3CCOCC3)C[C@H]2C)cc1OCCC(C)C ZINC000488503868 902859811 /nfs/dbraw/zinc/85/98/11/902859811.db2.gz OWMXFEBUARKODL-LJQANCHMSA-N 0 3 403.567 4.137 20 0 HIADHN CCOc1ccc(C(=O)CCC(=O)N[C@H]2CCN(Cc3ccccc3)C[C@@H]2C)cc1 ZINC000488515018 902865050 /nfs/dbraw/zinc/86/50/50/902865050.db2.gz KRSJRYAZPANBNQ-CVDCTZTESA-N 0 3 408.542 4.075 20 0 HIADHN Cc1cc(OCc2ccccc2)ccc1NC(=O)N1CCN(C2CCOCC2)C[C@@H]1C ZINC000488550226 902880104 /nfs/dbraw/zinc/88/01/04/902880104.db2.gz WWHHRRRYKJRZLV-FQEVSTJZSA-N 0 3 423.557 4.291 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)NC[C@H]3CCCO[C@@H]3c3ccccc3)cc2)CC1 ZINC000488627542 902907255 /nfs/dbraw/zinc/90/72/55/902907255.db2.gz MPAMDUWSEPSYOO-ILBGXUMGSA-N 0 3 421.585 4.115 20 0 HIADHN COc1ccc2c(c1)CCC[C@H]2CC(=O)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000488664379 902928885 /nfs/dbraw/zinc/92/88/85/902928885.db2.gz IPBCAACIIFICSV-FQEVSTJZSA-N 0 3 408.542 4.101 20 0 HIADHN Cc1ccccc1[C@H](C(C)C)N(C)CC(=O)N1CCC(C(=O)NCCC(C)C)CC1 ZINC000488675104 902935190 /nfs/dbraw/zinc/93/51/90/902935190.db2.gz VUIUPQZHVAEASK-DEOSSOPVSA-N 0 3 415.622 4.025 20 0 HIADHN O=C(CCSc1ccc(Cl)cc1)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000488694810 902948246 /nfs/dbraw/zinc/94/82/46/902948246.db2.gz GPMLWXKJIGSWOJ-UHFFFAOYSA-N 0 3 404.963 4.418 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)[C@H](Oc1ccccc1)c1ccccc1 ZINC000488699131 902950838 /nfs/dbraw/zinc/95/08/38/902950838.db2.gz GKGKMGLGXVMGKB-RUZDIDTESA-N 0 3 416.521 4.402 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)NCc3ccccc3C(F)(F)F)cc2)CC1 ZINC000488843235 903037213 /nfs/dbraw/zinc/03/72/13/903037213.db2.gz YJGWSEIJQKGJSY-UHFFFAOYSA-N 0 3 405.464 4.166 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)CC1 ZINC000489007630 903117642 /nfs/dbraw/zinc/11/76/42/903117642.db2.gz FTWRGLZFKZOPAY-UHFFFAOYSA-N 0 3 420.557 4.051 20 0 HIADHN C[C@H](N[C@@H](COc1ccccc1F)C(C)(C)C)C(=O)N1CCc2sccc2C1 ZINC000489034371 903141059 /nfs/dbraw/zinc/14/10/59/903141059.db2.gz KEHFDXKFKSGHDO-YWZLYKJASA-N 0 3 404.551 4.244 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)NCc2cccc(OCC(F)F)c2)CC1 ZINC000489137691 903224898 /nfs/dbraw/zinc/22/48/98/903224898.db2.gz KWHUWKROXRBMCN-UHFFFAOYSA-N 0 3 417.500 4.137 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)NCc1ccc(Br)c(F)c1)c1ccco1 ZINC000489177248 903245114 /nfs/dbraw/zinc/24/51/14/903245114.db2.gz QNHFKHTYGZXYQA-WBMJQRKESA-N 0 3 412.303 4.110 20 0 HIADHN CCC[C@H](NC(=O)NCc1ccccc1CN1CCC(O)CC1)C1CCCCC1 ZINC000489220105 903271628 /nfs/dbraw/zinc/27/16/28/903271628.db2.gz PCYNEHVUZHRZOD-QHCPKHFHSA-N 0 3 401.595 4.192 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)NCc2nc(C(C)(C)C)cs2)CC1 ZINC000489233521 903277076 /nfs/dbraw/zinc/27/70/76/903277076.db2.gz RFQBXWXHIHZGOY-UHFFFAOYSA-N 0 3 400.592 4.247 20 0 HIADHN O=C(Nc1ccccc1F)Nc1cccc2c1CCN(C[C@H](O)Cc1ccccc1)C2 ZINC000489290762 903311985 /nfs/dbraw/zinc/31/19/85/903311985.db2.gz JZWKEYCDRDTJER-HXUWFJFHSA-N 0 3 419.500 4.431 20 0 HIADHN COc1ccc([C@H](NC(=O)N(Cc2ccccc2)C2CCN(C)CC2)C2CC2)cc1 ZINC000489321094 903329040 /nfs/dbraw/zinc/32/90/40/903329040.db2.gz FZHIAZGTEIQXMA-XMMPIXPASA-N 0 3 407.558 4.452 20 0 HIADHN COCCN(Cc1c(-c2ccc(Cl)cc2)nc2sccn12)[C@@H]1CCO[C@H]1C ZINC000489437030 903383719 /nfs/dbraw/zinc/38/37/19/903383719.db2.gz FTBZIFGLTPTFME-WMLDXEAASA-N 0 3 405.951 4.342 20 0 HIADHN CNC(=O)[C@H](Cc1c[nH]c2ccccc12)N[C@H](C)c1ccc(Br)c(F)c1 ZINC000489505742 903428524 /nfs/dbraw/zinc/42/85/24/903428524.db2.gz FFXKEPZBSYVIMI-BLVKFPJESA-N 0 3 418.310 4.077 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)Nc2cc(-c3cccc(Cl)c3)on2)CC1 ZINC000489534467 903445383 /nfs/dbraw/zinc/44/53/83/903445383.db2.gz UIDOVNPYQCDCAD-UHFFFAOYSA-N 0 3 406.914 4.006 20 0 HIADHN CC(C)(CNC(=O)N[C@@H](c1ccccc1)c1cccnc1)N1CCc2ccccc2C1 ZINC000489538220 903449557 /nfs/dbraw/zinc/44/95/57/903449557.db2.gz OPEXOMLNLCQVBZ-DEOSSOPVSA-N 0 3 414.553 4.307 20 0 HIADHN C[C@H](N[C@@H]1CCN(C(=O)CCc2ccccc2)C1)c1ccc(Br)c(F)c1 ZINC000489552939 903460468 /nfs/dbraw/zinc/46/04/68/903460468.db2.gz NQXPLUQKHDCSJE-MAUKXSAKSA-N 0 3 419.338 4.473 20 0 HIADHN CCC[C@H](CCc1ccccc1)NC(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000489592729 903483805 /nfs/dbraw/zinc/48/38/05/903483805.db2.gz CGUGPBLQAFECFM-XMMPIXPASA-N 0 3 423.601 4.244 20 0 HIADHN Cc1ccc(C)n1-c1nc(CC(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)cs1 ZINC000489675777 903537555 /nfs/dbraw/zinc/53/75/55/903537555.db2.gz HZUPHTJRSNNXEG-JOCHJYFZSA-N 0 3 422.598 4.355 20 0 HIADHN CC(C)(C)[C@@H]1CCCN(C(=O)NCc2ccccc2CN2CCC(O)CC2)CC1 ZINC000489807989 903607113 /nfs/dbraw/zinc/60/71/13/903607113.db2.gz MSJMFVQEYBVLGL-OAQYLSRUSA-N 0 3 401.595 4.001 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)CCc2ccc3ccccc3n2)N(C)C)cc1 ZINC000489944978 903691020 /nfs/dbraw/zinc/69/10/20/903691020.db2.gz HLXVKQRICMVYQX-XMMPIXPASA-N 0 3 405.542 4.374 20 0 HIADHN CCCN(CCC(=O)N1CCc2ccccc2C1)[C@H](C)C(=O)Nc1ccccc1C ZINC000490025654 903729698 /nfs/dbraw/zinc/72/96/98/903729698.db2.gz IEXGIRCFVSFAHL-HXUWFJFHSA-N 0 3 407.558 4.009 20 0 HIADHN CCCN(CCCCN1C(=O)c2ccccc2C1=O)[C@H](C)C(=O)Nc1ccccc1C ZINC000490088382 903764732 /nfs/dbraw/zinc/76/47/32/903764732.db2.gz ICLDIWCUVLMBMS-LJQANCHMSA-N 0 3 421.541 4.110 20 0 HIADHN Cc1ccc([C@@H](NCCCOCC(F)(F)F)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000490114668 903773910 /nfs/dbraw/zinc/77/39/10/903773910.db2.gz RRJFLFUACMBULV-LJQANCHMSA-N 0 3 415.477 4.047 20 0 HIADHN CNC(=O)CN1CCC(N[C@H](c2ccccc2Cl)c2cccc3ccccc32)CC1 ZINC000490129197 903782531 /nfs/dbraw/zinc/78/25/31/903782531.db2.gz CSINCLBQMYNXEX-VWLOTQADSA-N 0 3 421.972 4.383 20 0 HIADHN CC(=O)N1CC[C@H](NCc2cccc(NC(=O)C3CCCC3)c2)c2ccccc2C1 ZINC000490147971 903793300 /nfs/dbraw/zinc/79/33/00/903793300.db2.gz BEPDTUZZIVXGKN-DEOSSOPVSA-N 0 3 405.542 4.398 20 0 HIADHN CCN1CCN(c2ccc(CN[C@H](c3ccccc3)c3ccc(C)cc3)cn2)CC1 ZINC000490158440 903800263 /nfs/dbraw/zinc/80/02/63/903800263.db2.gz RTZGKCYRFCFJND-AREMUKBSSA-N 0 3 400.570 4.411 20 0 HIADHN COc1cccc(CCN[C@H](c2ccc(C)cc2)c2cccc(S(C)(=O)=O)c2)c1 ZINC000490189656 903817514 /nfs/dbraw/zinc/81/75/14/903817514.db2.gz AGWGJFRGQNSCKP-XMMPIXPASA-N 0 3 409.551 4.329 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)Cc3csc(-c4ccc(Cl)cc4Cl)n3)[C@H]2C1 ZINC000490212630 903830061 /nfs/dbraw/zinc/83/00/61/903830061.db2.gz MHCSUKJPVPTQSI-SJCJKPOMSA-N 0 3 410.370 4.212 20 0 HIADHN CC1CCN([C@H](CNC(=O)c2cccc(CN3CCCC3=O)c2)c2ccccc2)CC1 ZINC000490225477 903836386 /nfs/dbraw/zinc/83/63/86/903836386.db2.gz SZXNTSRJARCTPB-XMMPIXPASA-N 0 3 419.569 4.012 20 0 HIADHN CCN(C(=O)Nc1cc(-c2ccsc2)nn1C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000490235163 903843892 /nfs/dbraw/zinc/84/38/92/903843892.db2.gz DINSPXXWLHVGMQ-IBGZPJMESA-N 0 3 409.559 4.277 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N[C@@H](c2ccccc2)c2cccnc2)C1 ZINC000490249566 903854199 /nfs/dbraw/zinc/85/41/99/903854199.db2.gz PXELHNOABFLXHX-FOVJLYNBSA-N 0 3 400.526 4.306 20 0 HIADHN COc1ccc(NC(=O)NC[C@H](C)N(C)Cc2ccccc2)cc1Br ZINC000490299193 903886289 /nfs/dbraw/zinc/88/62/89/903886289.db2.gz KVCORKRNWLKDSH-AWEZNQCLSA-N 0 3 406.324 4.100 20 0 HIADHN COc1cc(C)ccc1Oc1ccc(NC(=O)N2CC[C@@H]3CCN(C)C[C@@H]32)cc1F ZINC000490326095 903909369 /nfs/dbraw/zinc/90/93/69/903909369.db2.gz FQXZMMVGUPSTAE-LPHOPBHVSA-N 0 3 413.493 4.493 20 0 HIADHN COc1ccc(Cn2ccc(NC(=O)c3oc4ccccc4c3CN(C)C)n2)cc1 ZINC000490371592 903964394 /nfs/dbraw/zinc/96/43/94/903964394.db2.gz DJCZMFQZYNXYFF-UHFFFAOYSA-N 0 3 404.470 4.000 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2ccc(CN3CCCC3=O)cc2)N2CCCC2)cc1 ZINC000490671625 904165921 /nfs/dbraw/zinc/16/59/21/904165921.db2.gz OKWCWPXDPFVMFE-QHCPKHFHSA-N 0 3 420.557 4.076 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)NCCc1coc(-c2ccc(F)cc2)n1)c1ccco1 ZINC000490754322 904210524 /nfs/dbraw/zinc/21/05/24/904210524.db2.gz DMEZDOBGZCCRAM-KXBFYZLASA-N 0 3 414.481 4.045 20 0 HIADHN O=C(NCCc1ccc2ccccc2n1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000490981482 904348986 /nfs/dbraw/zinc/34/89/86/904348986.db2.gz XZQZLZNLIAWRML-UHFFFAOYSA-N 0 3 420.582 4.190 20 0 HIADHN CCCc1nc(C)c(CNC(=O)NC[C@@H](c2ccc(Cl)cc2)N(C)CCC)o1 ZINC000490986923 904352347 /nfs/dbraw/zinc/35/23/47/904352347.db2.gz IUCADBWMLUTDTQ-SFHVURJKSA-N 0 3 406.958 4.471 20 0 HIADHN CCN(CCN[C@H](c1cccc(S(C)(=O)=O)c1)c1ccc(C)cc1C)C(C)C ZINC000491003671 904364789 /nfs/dbraw/zinc/36/47/89/904364789.db2.gz GHPWFNLAFCLQPD-HSZRJFAPSA-N 0 3 402.604 4.116 20 0 HIADHN Cc1ccc([C@@H](NC[C@@H](O)C2CCCCC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000491008932 904367408 /nfs/dbraw/zinc/36/74/08/904367408.db2.gz QDAMKENMAPMDPQ-DHIUTWEWSA-N 0 3 401.572 4.019 20 0 HIADHN CCCc1c(C(=O)N(CC)C[C@@H]2CCN(Cc3ccccc3)C2)[nH]c(C)c1C(C)=O ZINC000491030590 904382806 /nfs/dbraw/zinc/38/28/06/904382806.db2.gz WWHNGWNJIXLUBI-OAQYLSRUSA-N 0 3 409.574 4.462 20 0 HIADHN CN(C)C(=O)C1CCN(Cc2cn(-c3ccccc3Cl)nc2C(C)(C)C)CC1 ZINC000506112710 914808713 /nfs/dbraw/zinc/80/87/13/914808713.db2.gz NAUTZDBBSLAVMO-UHFFFAOYSA-N 0 3 402.970 4.123 20 0 HIADHN Cc1ccc([C@H](N[C@H]2CCN(C3CCCC3)C2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000491056488 904399324 /nfs/dbraw/zinc/39/93/24/904399324.db2.gz UZEGNLSKKOQMMY-URXFXBBRSA-N 0 3 412.599 4.094 20 0 HIADHN Cc1ccc([C@@H](N[C@@H]2CCN(c3ccccc3)C2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000491062114 904404609 /nfs/dbraw/zinc/40/46/09/904404609.db2.gz USDGMVZCGGFCLS-RCZVLFRGSA-N 0 3 420.578 4.356 20 0 HIADHN CN(C)C[C@H](NC(=O)NCc1cccc(COC(C)(C)C)c1)c1ccc(F)cc1 ZINC000491152172 904460372 /nfs/dbraw/zinc/46/03/72/904460372.db2.gz YUYLFENNNNUZDY-NRFANRHFSA-N 0 3 401.526 4.243 20 0 HIADHN OC1CCN(Cc2cn(-c3ccccc3)nc2-c2cccc(Br)c2)CC1 ZINC000506127078 914814438 /nfs/dbraw/zinc/81/44/38/914814438.db2.gz XCXIHJCEOXETSS-UHFFFAOYSA-N 0 3 412.331 4.259 20 0 HIADHN COc1ccccc1NC(=O)c1ccc(NC(=O)[C@H](C)N2CC[C@H](C3CC3)C2)cc1 ZINC000491218181 904488444 /nfs/dbraw/zinc/48/84/44/904488444.db2.gz ONDLQVKOGBASAP-LPHOPBHVSA-N 0 3 407.514 4.006 20 0 HIADHN COc1ccc([C@H](CN[C@@H](c2cnn(C)c2)c2cccc(F)c2)N2CCCC2)cc1 ZINC000491258679 904506600 /nfs/dbraw/zinc/50/66/00/904506600.db2.gz FUOMGCHXZNNNEN-BJKOFHAPSA-N 0 3 408.521 4.084 20 0 HIADHN CC(C)(C)c1n[nH]cc1CN1CCC[C@H](c2nnc3ccc(C(F)(F)F)cn32)C1 ZINC000506136541 914818109 /nfs/dbraw/zinc/81/81/09/914818109.db2.gz KZERCJUHYZWOCT-ZDUSSCGKSA-N 0 3 406.456 4.148 20 0 HIADHN CC(=O)Nc1ccccc1CN1CCC[C@H](c2nnc3ccc(C(F)(F)F)cn32)C1 ZINC000506141074 914820456 /nfs/dbraw/zinc/82/04/56/914820456.db2.gz ORDXLSMFVWVNST-INIZCTEOSA-N 0 3 417.435 4.086 20 0 HIADHN CC(C)N(CCN[C@H](c1cccc(S(C)(=O)=O)c1)c1ccc(F)c(F)c1)C(C)C ZINC000491357335 904554887 /nfs/dbraw/zinc/55/48/87/904554887.db2.gz YFYMYYHBWGZKJU-JOCHJYFZSA-N 0 3 424.557 4.166 20 0 HIADHN C[C@]1(C2CC2)NC(=O)N(c2cccc(CNCc3ccc4c(c3)CCCC4)c2)C1=O ZINC000491357932 904556438 /nfs/dbraw/zinc/55/64/38/904556438.db2.gz CCQVDKJJRIIIFB-RUZDIDTESA-N 0 3 403.526 4.080 20 0 HIADHN Cc1ccc([C@@H](NC[C@@H]2Cc3ccccc3O2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000491392585 904574137 /nfs/dbraw/zinc/57/41/37/904574137.db2.gz AUQMRKNSJLYSQR-OFVILXPXSA-N 0 3 421.562 4.390 20 0 HIADHN CCN(CC)[C@@H](CN[C@@H](c1cnn(C)c1)c1cccc(F)c1)c1cccc(OC)c1 ZINC000491425160 904590473 /nfs/dbraw/zinc/59/04/73/904590473.db2.gz ZCSPWADZSICKOL-BJKOFHAPSA-N 0 3 410.537 4.330 20 0 HIADHN CN(C(=O)Nc1cc(F)c(OC(F)F)cc1F)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000491444880 904600326 /nfs/dbraw/zinc/60/03/26/904600326.db2.gz HMJMQHJWZGZBOJ-CQSZACIVSA-N 0 3 411.399 4.304 20 0 HIADHN O=C(Nc1ccccc1O)C1CCN(Cc2ccccc2OCc2ccccn2)CC1 ZINC000506153768 914826804 /nfs/dbraw/zinc/82/68/04/914826804.db2.gz SEIFDVKLSFODJS-UHFFFAOYSA-N 0 3 417.509 4.217 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)Nc2cccc(NC(=O)c3ccoc3)c2)c1 ZINC000491516318 904631821 /nfs/dbraw/zinc/63/18/21/904631821.db2.gz VMZOONKDWCYQIB-UHFFFAOYSA-N 0 3 420.513 4.436 20 0 HIADHN O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCC[C@@H](c2nc3ccc(F)cc3o2)C1 ZINC000506166775 914830899 /nfs/dbraw/zinc/83/08/99/914830899.db2.gz QDLGFTWSENALSW-UYAOXDASSA-N 0 3 422.504 4.130 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)Nc2cc(NC(=O)C3CC3)ccc2C)c1 ZINC000491755536 904691584 /nfs/dbraw/zinc/69/15/84/904691584.db2.gz CIJSAKFAYLZBDU-UHFFFAOYSA-N 0 3 408.546 4.248 20 0 HIADHN CN(C)[C@@H](CNC(=O)N1CCC[C@H](c2nc3ccc(F)cc3o2)C1)Cc1ccccc1 ZINC000506183671 914836699 /nfs/dbraw/zinc/83/66/99/914836699.db2.gz NCXPLTGJGWBUCN-AZUAARDMSA-N 0 3 424.520 4.029 20 0 HIADHN O=C(c1ccc([C@@H]2CCCOC2)cc1)N1CCCN(CCCc2ccccc2)CC1 ZINC000506188103 914838128 /nfs/dbraw/zinc/83/81/28/914838128.db2.gz FCKNEBZWWNZOPX-RUZDIDTESA-N 0 3 406.570 4.361 20 0 HIADHN O=C(c1ccc([C@H]2CCCOC2)cc1)N1CCCN(CCCc2ccccc2)CC1 ZINC000506188105 914838400 /nfs/dbraw/zinc/83/84/00/914838400.db2.gz FCKNEBZWWNZOPX-VWLOTQADSA-N 0 3 406.570 4.361 20 0 HIADHN CCN1CCCC[C@@H]1CN[C@@H](c1cccc(S(C)(=O)=O)c1)c1ccc(C)cc1C ZINC000492194769 904812887 /nfs/dbraw/zinc/81/28/87/904812887.db2.gz HGKKGADUTPWMGL-QPPBQGQZSA-N 0 3 414.615 4.260 20 0 HIADHN CCN1CCCC[C@@H]1CN[C@H](c1cccc(S(C)(=O)=O)c1)c1ccc(C)cc1C ZINC000492194772 904813103 /nfs/dbraw/zinc/81/31/03/904813103.db2.gz HGKKGADUTPWMGL-ZJSXRUAMSA-N 0 3 414.615 4.260 20 0 HIADHN COCCN(C)c1ccc(CN[C@H]2c3cccc(Br)c3CC2(C)C)cn1 ZINC000492258974 904824877 /nfs/dbraw/zinc/82/48/77/904824877.db2.gz OCNGPSANQPNWQN-FQEVSTJZSA-N 0 3 418.379 4.340 20 0 HIADHN COc1cc(OC)c(OC)cc1CNC1(Cc2ccccc2Br)CC1 ZINC000492273611 904827525 /nfs/dbraw/zinc/82/75/25/904827525.db2.gz LFVJKCDRDUONJL-UHFFFAOYSA-N 0 3 406.320 4.340 20 0 HIADHN CC[C@@H](CNC(=O)c1cccc(Oc2ccncc2)c1)N1CCc2ccccc2C1 ZINC000492491332 904859438 /nfs/dbraw/zinc/85/94/38/904859438.db2.gz SETAARIELIEFOV-QFIPXVFZSA-N 0 3 401.510 4.441 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)Nc2nc(C3CCOCC3)cs2)N(C)C)cc1 ZINC000492561843 904869310 /nfs/dbraw/zinc/86/93/10/904869310.db2.gz XDDWVCJXXZCSBU-LJQANCHMSA-N 0 3 402.564 4.024 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)C(=O)Nc1ccccc1SC)c1ccc(Cl)cc1 ZINC000506235320 914856589 /nfs/dbraw/zinc/85/65/89/914856589.db2.gz SSVONONJUPTRML-SFHVURJKSA-N 0 3 419.978 4.200 20 0 HIADHN CNC(=O)C1CCN(Cc2cn(Cc3ccc(C)cc3)nc2-c2ccc(C)cc2)CC1 ZINC000506246106 914861411 /nfs/dbraw/zinc/86/14/11/914861411.db2.gz OITQQTYAVITNCS-UHFFFAOYSA-N 0 3 416.569 4.173 20 0 HIADHN COc1ccc(NC(=O)c2ccc(CN3CCC(CO)CC3)cc2)c(C(F)(F)F)c1 ZINC000493030810 904994341 /nfs/dbraw/zinc/99/43/41/904994341.db2.gz ZLKNVZAPKLOKDI-UHFFFAOYSA-N 0 3 422.447 4.171 20 0 HIADHN NC(=O)C1(CN[C@@H](c2cccc(F)c2)c2cccc(Br)c2)CCCC1 ZINC000493107189 905022512 /nfs/dbraw/zinc/02/25/12/905022512.db2.gz WTBHUCRRIVEEQJ-GOSISDBHSA-N 0 3 405.311 4.313 20 0 HIADHN CCCC(O)(CCC)CN[C@@H](c1ccc(C)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000493202602 905045665 /nfs/dbraw/zinc/04/56/65/905045665.db2.gz HBUGGEFACAFOBK-QFIPXVFZSA-N 0 3 403.588 4.409 20 0 HIADHN COc1cc2[nH]c(CCCN[C@@H](c3cnn(C)c3)c3cccc(F)c3)cc2c(OC)c1 ZINC000493235678 905060874 /nfs/dbraw/zinc/06/08/74/905060874.db2.gz XWRQMMIAXVXCBN-XMMPIXPASA-N 0 3 422.504 4.370 20 0 HIADHN Cc1ccc([C@@H](NC[C@@H](CCO)CC(C)C)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000493254137 905068584 /nfs/dbraw/zinc/06/85/84/905068584.db2.gz ZZRGYMYQDVOGOJ-WMZHIEFXSA-N 0 3 403.588 4.122 20 0 HIADHN CC(C)Cn1ncc(C(=O)NC[C@]2(C)CCCN2Cc2ccccc2)c1C(F)F ZINC000493311239 905083478 /nfs/dbraw/zinc/08/34/78/905083478.db2.gz SFNAOGUUHQLNBH-QFIPXVFZSA-N 0 3 404.505 4.261 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)CCc3c4cc(F)ccc4[nH]c3-c3ccccc3)[C@@H]2C1 ZINC000493462424 905127084 /nfs/dbraw/zinc/12/70/84/905127084.db2.gz JFILEJBZTRKXGB-GAJHUEQPSA-N 0 3 405.517 4.459 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)CCc3c4ccccc4[nH]c3-c3ccc(F)cc3)[C@H]2C1 ZINC000493536803 905152727 /nfs/dbraw/zinc/15/27/27/905152727.db2.gz MPJYPAWZENCHHB-SBUREZEXSA-N 0 3 405.517 4.459 20 0 HIADHN COc1cc(-c2noc(CN[C@H]3CCC[C@H]3Cc3ccccc3)n2)cc(OC)c1OC ZINC000493541082 905156080 /nfs/dbraw/zinc/15/60/80/905156080.db2.gz DHTDISZBHYVOKI-HKUYNNGSSA-N 0 3 423.513 4.263 20 0 HIADHN O=C1CCCN1C[C@@H](N[C@H]1CCc2ccccc2OC1)c1cccc(C(F)(F)F)c1 ZINC000493821977 905227559 /nfs/dbraw/zinc/22/75/59/905227559.db2.gz PPWXJYZYLFBQEB-VQTJNVASSA-N 0 3 418.459 4.352 20 0 HIADHN Cc1cc(Br)cc2c1[C@@H](NCc1ccc(N3CCO[C@@H](C)C3)nc1)CC2 ZINC000493882185 905243091 /nfs/dbraw/zinc/24/30/91/905243091.db2.gz HVXYSUJLLVXPKS-KXBFYZLASA-N 0 3 416.363 4.155 20 0 HIADHN O=C(NCc1ccccc1)N(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000493915162 905265068 /nfs/dbraw/zinc/26/50/68/905265068.db2.gz COMCDNLUWGSNGQ-VWLOTQADSA-N 0 3 414.553 4.458 20 0 HIADHN O=C(NCc1ccco1)N(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000493917220 905267458 /nfs/dbraw/zinc/26/74/58/905267458.db2.gz PUPWOPKINIZCKG-JOCHJYFZSA-N 0 3 404.514 4.051 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)c2cccc(OCc3cccnc3)c2)N(C)C)cc1 ZINC000493940349 905293669 /nfs/dbraw/zinc/29/36/69/905293669.db2.gz UZZYLSCZEJLVEG-XMMPIXPASA-N 0 3 403.526 4.256 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](NC[C@@H]2[C@@H]3Cc4ccccc4[C@H]23)c2ccc(F)cc2)c1 ZINC000493997270 905338408 /nfs/dbraw/zinc/33/84/08/905338408.db2.gz UTAJHBGXHXEWOK-FQUZAXHOSA-N 0 3 421.537 4.494 20 0 HIADHN C[C@H]1[C@H](NC(=O)c2ccccc2-c2nc(C(C)(C)C)no2)CCN1Cc1ccccc1 ZINC000493997775 905338500 /nfs/dbraw/zinc/33/85/00/905338500.db2.gz BIAAUNHIWSOPRL-LAUBAEHRSA-N 0 3 418.541 4.427 20 0 HIADHN Cc1cc(C(=O)N[C@@H]2CCN(Cc3ccccc3)[C@@H]2C)ccc1NC(=O)CC(C)C ZINC000493998515 905341890 /nfs/dbraw/zinc/34/18/90/905341890.db2.gz DODVWYFPMCRMEV-AUSIDOKSSA-N 0 3 407.558 4.372 20 0 HIADHN C[C@H]1[C@@H](NC(=O)c2ccccc2OCc2cscn2)CCN1Cc1ccccc1 ZINC000494006251 905346910 /nfs/dbraw/zinc/34/69/10/905346910.db2.gz HFKPGDCOLROMFT-UWJYYQICSA-N 0 3 407.539 4.115 20 0 HIADHN CC(C)C(=O)Nc1ccc(Cl)c(C(=O)N[C@H]2CCN(Cc3ccccc3)[C@H]2C)c1 ZINC000494007147 905349134 /nfs/dbraw/zinc/34/91/34/905349134.db2.gz OPIBEEFYFZQLMJ-KKSFZXQISA-N 0 3 413.949 4.327 20 0 HIADHN Cn1cc([C@@H](NCCCc2nc(-c3ccncc3)cs2)c2cccc(F)c2)cn1 ZINC000494010245 905350744 /nfs/dbraw/zinc/35/07/44/905350744.db2.gz CTYPFJCZOCQXEN-QFIPXVFZSA-N 0 3 407.518 4.390 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)c2ccc(OCc3ccncc3)cc2)CCN1Cc1ccccc1 ZINC000494027405 905368329 /nfs/dbraw/zinc/36/83/29/905368329.db2.gz MLECDKPOFNZKNH-DVECYGJZSA-N 0 3 401.510 4.053 20 0 HIADHN C[C@H]1[C@@H](NC(=O)c2cccc(NC(=O)c3cccs3)c2)CCN1Cc1ccccc1 ZINC000494037881 905377835 /nfs/dbraw/zinc/37/78/35/905377835.db2.gz LZOQODQFFZWQLJ-UWJYYQICSA-N 0 3 419.550 4.393 20 0 HIADHN Cn1cc([C@H](NC[C@H](CO)Cc2ccc(C(F)(F)F)cc2)c2cccc(F)c2)cn1 ZINC000494037534 905378767 /nfs/dbraw/zinc/37/87/67/905378767.db2.gz HEZKIMSTPNIROS-IIBYNOLFSA-N 0 3 421.438 4.108 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)c2ccc(NC(=O)c3ccccc3)cc2)CCN1Cc1ccccc1 ZINC000494061552 905399200 /nfs/dbraw/zinc/39/92/00/905399200.db2.gz XQFRAYJIXBZXPY-DVECYGJZSA-N 0 3 413.521 4.332 20 0 HIADHN CCCC(=O)NC[C@H]1CCCN(Cc2ccc(OC)c(OCc3ccccc3)c2)C1 ZINC000512411335 921144249 /nfs/dbraw/zinc/14/42/49/921144249.db2.gz XVUAXHWSSLKWIP-JOCHJYFZSA-N 0 3 410.558 4.403 20 0 HIADHN CCCC(=O)NC[C@H]1CCCN(Cc2cn(Cc3ccccc3)nc2C(C)(C)C)C1 ZINC000512416771 921144822 /nfs/dbraw/zinc/14/48/22/921144822.db2.gz VPVBLECKRANHDL-OAQYLSRUSA-N 0 3 410.606 4.357 20 0 HIADHN COCCOc1cccc(CN2CCC[C@@H](CNC(=O)Nc3ccc(C)cc3)C2)c1 ZINC000512425512 921153054 /nfs/dbraw/zinc/15/30/54/921153054.db2.gz AVBMUVNLQUEQTB-NRFANRHFSA-N 0 3 411.546 4.054 20 0 HIADHN O=C(Nc1ccccc1OC1CCCC1)N[C@H]1CCN(Cc2ccccc2)C[C@H]1CO ZINC000494203449 905535102 /nfs/dbraw/zinc/53/51/02/905535102.db2.gz CQKAYYFIWFFOSK-UNMCSNQZSA-N 0 3 423.557 4.013 20 0 HIADHN C[C@H](O)C[C@@H]1CCCCCN1CC(=O)Nc1cccc(CSc2ccccn2)c1 ZINC000512434172 921158505 /nfs/dbraw/zinc/15/85/05/921158505.db2.gz UZLDAVXYYUWODA-RXVVDRJESA-N 0 3 413.587 4.328 20 0 HIADHN Cc1ccc(F)c(C(=O)NCCCN2CCc3ccccc3C2)c1Br ZINC000494293332 905614381 /nfs/dbraw/zinc/61/43/81/905614381.db2.gz OGXMQRGCIJYRGX-UHFFFAOYSA-N 0 3 405.311 4.075 20 0 HIADHN Clc1cc(CNCc2cccc(CN3CCOCC3)c2)ccc1Br ZINC000494296116 905617209 /nfs/dbraw/zinc/61/72/09/905617209.db2.gz QSZWMDDYIPIVAB-UHFFFAOYSA-N 0 3 409.755 4.225 20 0 HIADHN COCCOc1ccc(CN2CCC[C@H](CNC(=O)Nc3ccc(C)cc3)C2)cc1 ZINC000512444575 921165850 /nfs/dbraw/zinc/16/58/50/921165850.db2.gz QASHMBAACWPUIX-OAQYLSRUSA-N 0 3 411.546 4.054 20 0 HIADHN CC(C)Oc1ccc(NC(=O)c2ccc(CN3CCC(CO)CC3)cc2)c(F)c1 ZINC000494442533 905726824 /nfs/dbraw/zinc/72/68/24/905726824.db2.gz KREZCBMUBJKEMD-UHFFFAOYSA-N 0 3 400.494 4.070 20 0 HIADHN C[C@H](N[C@@H]1CCO[C@@H]1c1ccc(Cl)cc1)C(=O)NC12CC3CC(CC(C3)C1)C2 ZINC000494466121 905748689 /nfs/dbraw/zinc/74/86/89/905748689.db2.gz OMPSBVRDDLYUSR-HDYWEBCVSA-N 0 3 402.966 4.233 20 0 HIADHN COC[C@@H](N[C@H](C)CC(=O)Nc1cc(OC)ccc1OC)c1ccc(Cl)cc1 ZINC000494480505 905761843 /nfs/dbraw/zinc/76/18/43/905761843.db2.gz ZSWIKPXZNWJPPJ-AUUYWEPGSA-N 0 3 406.910 4.052 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)c(C)c1CN1CCC[C@H](CNC(=O)C(C)C)C1 ZINC000512458100 921174766 /nfs/dbraw/zinc/17/47/66/921174766.db2.gz XRMNZTGBRKSZPR-GOSISDBHSA-N 0 3 402.970 4.127 20 0 HIADHN CCOc1ccc(CN2CCC[C@@H](CNC(=O)Nc3cccc(F)c3)C2)cc1OC ZINC000512462642 921177417 /nfs/dbraw/zinc/17/74/17/921177417.db2.gz LOOWGULTEFSLLR-SFHVURJKSA-N 0 3 415.509 4.267 20 0 HIADHN O=C(NCc1ccco1)c1cccc(CN[C@@H]2CCO[C@H]2c2ccc(Cl)cc2)c1 ZINC000494499167 905788713 /nfs/dbraw/zinc/78/87/13/905788713.db2.gz XXCVXHGZPHYIRC-YADHBBJMSA-N 0 3 410.901 4.483 20 0 HIADHN FC(F)(F)c1ccc(Cn2cc(CNCc3cccc(-n4ccnc4)c3)cn2)cc1 ZINC000494596802 905855238 /nfs/dbraw/zinc/85/52/38/905855238.db2.gz NZYWCOHAQRVUHS-UHFFFAOYSA-N 0 3 411.431 4.426 20 0 HIADHN CN(C)[C@H](CNCc1cnn(Cc2ccc(C(F)(F)F)cc2)c1)c1ccsc1 ZINC000494611734 905861642 /nfs/dbraw/zinc/86/16/42/905861642.db2.gz DMGFQVJZNXITBP-LJQANCHMSA-N 0 3 408.493 4.404 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)N[C@H](c2nccs2)c2ccccc2)CCN1Cc1ccccc1 ZINC000494652635 905885481 /nfs/dbraw/zinc/88/54/81/905885481.db2.gz XYMZWLUVLSGIBN-QMMLZNLJSA-N 0 3 406.555 4.195 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1)c1nc(C(F)(F)F)cs1 ZINC000494704752 905909747 /nfs/dbraw/zinc/90/97/47/905909747.db2.gz WRUFQRGDOJPQLH-DZGCQCFKSA-N 0 3 412.481 4.187 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)Nc2c(C)cc(OC)c(C)c2C)CC1 ZINC000494727283 905927975 /nfs/dbraw/zinc/92/79/75/905927975.db2.gz ATIKQXLIOIBQMU-UHFFFAOYSA-N 0 3 424.589 4.080 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)NCc1ccc(-c2ccccc2)cc1F ZINC000494759787 905957609 /nfs/dbraw/zinc/95/76/09/905957609.db2.gz JUQWUVRMDKAIDN-UHFFFAOYSA-N 0 3 406.505 4.161 20 0 HIADHN C[C@H]1CCN(C)CCN1C(=O)NC[C@@H](OCc1ccccc1)c1ccc(Cl)cc1 ZINC000494782593 905981847 /nfs/dbraw/zinc/98/18/47/905981847.db2.gz CEWNWESIADUZIQ-PGRDOPGGSA-N 0 3 415.965 4.334 20 0 HIADHN COc1ccc([C@H]2CCCCCN2C(=O)CN2CCN(C)CC23CCCCC3)cc1 ZINC000494885975 906064064 /nfs/dbraw/zinc/06/40/64/906064064.db2.gz LILIMNZQSZDYBW-HSZRJFAPSA-N 0 3 413.606 4.089 20 0 HIADHN FC(F)(F)c1ccn(-c2ccc(CN[C@H](c3nnc[nH]3)C3CCCCC3)cc2)n1 ZINC000494899477 906074015 /nfs/dbraw/zinc/07/40/15/906074015.db2.gz BJDUWNZDKXQBPI-SFHVURJKSA-N 0 3 404.440 4.420 20 0 HIADHN Cc1cccc(Oc2ccccc2CNC(=O)N2CCN(C3CCOCC3)C[C@@H]2C)c1 ZINC000494910536 906084362 /nfs/dbraw/zinc/08/43/62/906084362.db2.gz QXDWFKDWWCEHBS-FQEVSTJZSA-N 0 3 423.557 4.182 20 0 HIADHN CCC(CC)(CO)CN[C@@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000494967029 906135690 /nfs/dbraw/zinc/13/56/90/906135690.db2.gz DMEAUBRNMSYNJS-FQEVSTJZSA-N 0 3 409.979 4.221 20 0 HIADHN COc1ccc([C@H](NC[C@@H]2C[C@H](O)CN2Cc2ccccc2)c2ccccc2)cc1 ZINC000494968880 906137992 /nfs/dbraw/zinc/13/79/92/906137992.db2.gz LMHLKQYBKIULHH-KYPHJKQUSA-N 0 3 402.538 4.010 20 0 HIADHN COc1ccc([C@H](NC[C@@H]2C[C@@H](O)CN2Cc2ccccc2)c2ccc(F)cc2)cc1 ZINC000494971223 906139475 /nfs/dbraw/zinc/13/94/75/906139475.db2.gz PGOGMDPWMCCUSH-BFLUCZKCSA-N 0 3 420.528 4.149 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(C(=O)N(C)C)cc1)c1ccc(NC(=O)c2ccncc2)cc1 ZINC000495046807 906202264 /nfs/dbraw/zinc/20/22/64/906202264.db2.gz HCOPUVAXXYEVIJ-QZTJIDSGSA-N 0 3 416.525 4.448 20 0 HIADHN NC(=O)COc1cccc(CN[C@@H](Cc2ccccc2Cl)c2cccs2)c1 ZINC000495045960 906202560 /nfs/dbraw/zinc/20/25/60/906202560.db2.gz NEJICDUREVDGKZ-IBGZPJMESA-N 0 3 400.931 4.339 20 0 HIADHN COc1cc(C)c(NC(=O)NC[C@H]2CN(Cc3ccccc3)CCCO2)c(C)c1C ZINC000495049079 906203309 /nfs/dbraw/zinc/20/33/09/906203309.db2.gz OCVFMSPOUUIBPZ-NRFANRHFSA-N 0 3 411.546 4.033 20 0 HIADHN Cc1ccc([C@H](CNC(=O)NCc2nc(-c3ccccc3F)cs2)N(C)C)cc1 ZINC000495169176 906282933 /nfs/dbraw/zinc/28/29/33/906282933.db2.gz BDCFWKNUUOYXIL-FQEVSTJZSA-N 0 3 412.534 4.360 20 0 HIADHN Cc1ccccc1NC(=O)C[C@@H](C)N[C@@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O ZINC000495181157 906290259 /nfs/dbraw/zinc/29/02/59/906290259.db2.gz CFKHJSWTRZDHKL-AUUYWEPGSA-N 0 3 420.340 4.414 20 0 HIADHN C[C@@H](C(=O)NCCCN1CCN(C)C[C@H]1c1ccccc1)c1ccc(Cl)s1 ZINC000495182638 906293297 /nfs/dbraw/zinc/29/32/97/906293297.db2.gz HVICHHIHZSCPIL-AEFFLSMTSA-N 0 3 405.995 4.000 20 0 HIADHN Cc1c2ccc(F)cc2sc1C(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000495330836 906381333 /nfs/dbraw/zinc/38/13/33/906381333.db2.gz CTTIWMGHHYQMJH-GASCZTMLSA-N 0 3 404.551 4.310 20 0 HIADHN CCCOc1cc(F)ccc1NC(=O)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000495360873 906402945 /nfs/dbraw/zinc/40/29/45/906402945.db2.gz QHESDQOMNXLXSN-UHFFFAOYSA-N 0 3 400.494 4.071 20 0 HIADHN CC(C)[C@H](NCC(=O)Nc1cccc(Br)c1)c1ccc2[nH]c(=O)oc2c1 ZINC000495369101 906409409 /nfs/dbraw/zinc/40/94/09/906409409.db2.gz NYLRZNSPNVSZJU-SFHVURJKSA-N 0 3 418.291 4.221 20 0 HIADHN O=C(CCN1CCCN(C(=O)c2cccc(F)c2)CC1)Nc1cccc2ccccc21 ZINC000495391661 906423606 /nfs/dbraw/zinc/42/36/06/906423606.db2.gz QZCMWAXDFVJCCM-UHFFFAOYSA-N 0 3 419.500 4.156 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)C[C@H](C)NCc1ccc(OC(C)(C)C)nc1 ZINC000495439613 906452293 /nfs/dbraw/zinc/45/22/93/906452293.db2.gz MNJWMQLOXQBNCT-AWEZNQCLSA-N 0 3 405.926 4.428 20 0 HIADHN O=C(NC[C@]1(O)CCN(Cc2ccccc2)C1)Nc1cccc(-c2ccccc2)c1 ZINC000495560221 906502612 /nfs/dbraw/zinc/50/26/12/906502612.db2.gz DIEADRHGNVWPBQ-RUZDIDTESA-N 0 3 401.510 4.112 20 0 HIADHN C[C@@H](NCc1cccc(NC(=O)CCN2CCOCC2)c1)c1ccc2ccccc2c1 ZINC000495588491 906507240 /nfs/dbraw/zinc/50/72/40/906507240.db2.gz AQFMGJCFZQIRDG-HXUWFJFHSA-N 0 3 417.553 4.351 20 0 HIADHN C[C@@H](NC1CCN(CC(=O)Nc2ccccc2)CC1)c1ccccc1Br ZINC000495595287 906511326 /nfs/dbraw/zinc/51/13/26/906511326.db2.gz WJBMBMKWGGLFKC-MRXNPFEDSA-N 0 3 416.363 4.203 20 0 HIADHN CCCC[C@H](N[C@@H]1CCN(c2cc(Cl)ccc2OC)C1)C(=O)Nc1cc(C)on1 ZINC000495725086 906535283 /nfs/dbraw/zinc/53/52/83/906535283.db2.gz PNGKRMFHYRHXKJ-SJORKVTESA-N 0 3 420.941 4.011 20 0 HIADHN CC(C)c1nc(C(=O)N(CCN(C)C)C(C)C)nn1-c1c(Cl)cccc1Cl ZINC000495917763 906577689 /nfs/dbraw/zinc/57/76/89/906577689.db2.gz QTVFDBDOVSYGRV-UHFFFAOYSA-N 0 3 412.365 4.110 20 0 HIADHN CC(C)N(CCN(C)C)C(=O)[C@H](C)SCc1ncc(-c2ccc(Cl)cc2)o1 ZINC000495954753 906585825 /nfs/dbraw/zinc/58/58/25/906585825.db2.gz SJNRMLLZKISLPN-HNNXBMFYSA-N 0 3 409.983 4.415 20 0 HIADHN Cc1cc(NC(=O)C(C)(C)C)sc1C(=O)N(CCN(C)C)Cc1ccccc1 ZINC000495964979 906589259 /nfs/dbraw/zinc/58/92/59/906589259.db2.gz HEOLEEKDYBNOCE-UHFFFAOYSA-N 0 3 401.576 4.245 20 0 HIADHN Cc1ccc(-c2cc(C(=O)N(CCN(C)C)C(C)C)c3cnn(C(C)C)c3n2)cc1 ZINC000495982116 906591541 /nfs/dbraw/zinc/59/15/41/906591541.db2.gz MJBAQURCLUVLLP-UHFFFAOYSA-N 0 3 407.562 4.400 20 0 HIADHN CC(C)N(CCN(C)C)C(=O)c1csc(-c2ccc(Br)s2)n1 ZINC000496014960 906597933 /nfs/dbraw/zinc/59/79/33/906597933.db2.gz RCGGVZXATIVJSA-UHFFFAOYSA-N 0 3 402.383 4.046 20 0 HIADHN CC(C)N(CCN(C)C)C(=O)c1cc(Oc2cccc(Br)c2)ccn1 ZINC000496030054 906602890 /nfs/dbraw/zinc/60/28/90/906602890.db2.gz TWMPOADHKNHBNU-UHFFFAOYSA-N 0 3 406.324 4.049 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)CCc1cccc(Br)c1 ZINC000496224899 906631905 /nfs/dbraw/zinc/63/19/05/906631905.db2.gz IYGRFJLUCAXINL-UHFFFAOYSA-N 0 3 407.327 4.111 20 0 HIADHN CCCN(CCN(C)C)C(=O)c1cc(-c2ccc(F)cc2)nc2onc(C3CC3)c21 ZINC000496224548 906632530 /nfs/dbraw/zinc/63/25/30/906632530.db2.gz HSALLPBMYBOUBH-UHFFFAOYSA-N 0 3 410.493 4.320 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)CCC(=O)c1ccc(Cl)cc1 ZINC000496264056 906642641 /nfs/dbraw/zinc/64/26/41/906642641.db2.gz QLNGNTUTPDHTIT-NRFANRHFSA-N 0 3 413.949 4.211 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)c1ccc(Br)s1 ZINC000496272514 906645137 /nfs/dbraw/zinc/64/51/37/906645137.db2.gz OHRHWIDSULCAHE-HNNXBMFYSA-N 0 3 408.365 4.032 20 0 HIADHN O=C(NCc1ccsc1Br)NC[C@H](c1ccccc1)N1CCCC1 ZINC000512611781 921260292 /nfs/dbraw/zinc/26/02/92/921260292.db2.gz CHGWVZAHZBBMPA-MRXNPFEDSA-N 0 3 408.365 4.147 20 0 HIADHN CSc1cccc(NC(=O)N(CCN(C)C)Cc2ccc(Br)cc2)n1 ZINC000496719585 906741993 /nfs/dbraw/zinc/74/19/93/906741993.db2.gz DZEXFILDMMMZFE-UHFFFAOYSA-N 0 3 423.380 4.162 20 0 HIADHN O=C(CSCc1cscn1)N(CCN1CCCC1)Cc1ccc(Cl)cc1 ZINC000496828735 906764145 /nfs/dbraw/zinc/76/41/45/906764145.db2.gz BOWJGOBKYMMJRS-UHFFFAOYSA-N 0 3 410.008 4.154 20 0 HIADHN CO[C@@H](c1ccccc1Cl)[C@@H](C)NCc1ccccc1OCC(=O)N1CCCC1 ZINC000497154221 906812977 /nfs/dbraw/zinc/81/29/77/906812977.db2.gz ZVWMITAIHZJTJI-UZUQRXQVSA-N 0 3 416.949 4.207 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)CCCc2ccc(Br)s2)o1 ZINC000497400970 906881862 /nfs/dbraw/zinc/88/18/62/906881862.db2.gz KNTASRWDMMUQFM-UHFFFAOYSA-N 0 3 413.381 4.325 20 0 HIADHN Cc1cc(NC(=O)N(CCN(C)C)Cc2ccccc2)c(F)cc1Br ZINC000497452342 906928375 /nfs/dbraw/zinc/92/83/75/906928375.db2.gz VCVCCDDZCPPBPB-UHFFFAOYSA-N 0 3 408.315 4.492 20 0 HIADHN CCOCc1cc(CN2CCC(C(=O)NCc3ccc(C)cc3)CC2)ccc1OC ZINC000512663025 921279559 /nfs/dbraw/zinc/27/95/59/921279559.db2.gz FDYSSBQLZZUOBZ-UHFFFAOYSA-N 0 3 410.558 4.069 20 0 HIADHN Cc1nn(-c2ccccc2)cc1CN1CCC(C(=O)NCc2ccc(C)cc2)CC1 ZINC000512663730 921280322 /nfs/dbraw/zinc/28/03/22/921280322.db2.gz PKUVJILNIYHOIJ-UHFFFAOYSA-N 0 3 402.542 4.018 20 0 HIADHN CN(CCCN1CCN(C)CC1)C(=O)N[C@H](CC(C)(C)C)c1ccc(Cl)cc1 ZINC000497499007 906984849 /nfs/dbraw/zinc/98/48/49/906984849.db2.gz XRMPQZNBGYIXST-HXUWFJFHSA-N 0 3 409.018 4.096 20 0 HIADHN COc1cccc([C@@H]2CCCN2C[C@H](O)COc2cccc(Br)c2)c1 ZINC000497611692 907089495 /nfs/dbraw/zinc/08/94/95/907089495.db2.gz PHAFTJCOTNMOHE-PXNSSMCTSA-N 0 3 406.320 4.035 20 0 HIADHN CCOC1CC2(C1)CCN(C(=O)N[C@H](CN1CCc3ccccc3C1)C(C)(C)C)C2 ZINC000497617436 907095487 /nfs/dbraw/zinc/09/54/87/907095487.db2.gz QOCVUWYSCXMSDA-SMCIBBBJSA-N 0 3 413.606 4.060 20 0 HIADHN Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)NC(=O)N1CC[C@@H]2CCN(C)C[C@@H]21 ZINC000497635900 907119888 /nfs/dbraw/zinc/11/98/88/907119888.db2.gz CHTQXQIIAFWMJM-MPGHIAIKSA-N 0 3 402.539 4.054 20 0 HIADHN Cc1noc(C)c1C[C@@H](C)NC(=O)NC[C@@H](c1ccc(CC(C)C)cc1)N(C)C ZINC000497732164 907230633 /nfs/dbraw/zinc/23/06/33/907230633.db2.gz WIHNRTACCINYCA-ZHRRBRCNSA-N 0 3 400.567 4.023 20 0 HIADHN CCc1nc(C)c([C@H](C)N(C)CC(O)CN(C)[C@@H](C)c2sc(CC)nc2C)s1 ZINC000497750091 907242196 /nfs/dbraw/zinc/24/21/96/907242196.db2.gz KEQBLHKSOQAJGI-HOTGVXAUSA-N 0 3 424.680 4.388 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1ccc(-n2nccc2C)cc1)c1cccc(OC)c1 ZINC000497752950 907244769 /nfs/dbraw/zinc/24/47/69/907244769.db2.gz JVUHCDFOWRGVRQ-QHCPKHFHSA-N 0 3 406.530 4.002 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)N(C)Cc2cc(F)c(F)c(F)c2)N(C)C)cc1 ZINC000512802917 921314699 /nfs/dbraw/zinc/31/46/99/921314699.db2.gz PUBBGJBCOQVMGF-HXUWFJFHSA-N 0 3 423.479 4.335 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)N2CCC(CC(F)(F)F)CC2)N(C)C)cc1 ZINC000512814712 921319726 /nfs/dbraw/zinc/31/97/26/921319726.db2.gz OMFOVNLCBXOCJE-IBGZPJMESA-N 0 3 415.500 4.451 20 0 HIADHN CCN(C(=O)c1ccc(NC(=O)C2CC2)cc1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000497950639 907420832 /nfs/dbraw/zinc/42/08/32/907420832.db2.gz JMHTXWRISUQLGY-JPYJTQIMSA-N 0 3 405.542 4.333 20 0 HIADHN CCOC(=O)c1c(C)[nH]c(C(=O)N(CC)[C@@H]2CCN([C@H](C)c3ccccc3)C2)c1C ZINC000497956296 907426265 /nfs/dbraw/zinc/42/62/65/907426265.db2.gz ATHGBRQFTZSIPJ-UYAOXDASSA-N 0 3 411.546 4.106 20 0 HIADHN CN1CC[C@H](NC(=O)N[C@@H](c2cccc(F)c2)c2ccccn2)[C@H]1c1ccccc1 ZINC000497958295 907429749 /nfs/dbraw/zinc/42/97/49/907429749.db2.gz OFIDFYVOJUSVLI-RJGXRXQPSA-N 0 3 404.489 4.055 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)c3ccc(OCC4CC4)cc3)CC2)c1 ZINC000497964433 907432631 /nfs/dbraw/zinc/43/26/31/907432631.db2.gz BOMWLSWMSJJDKF-UHFFFAOYSA-N 0 3 421.585 4.116 20 0 HIADHN CCCCN1C(=O)C[C@@H](C(=O)Nc2cccc(CN(C)C)c2)[C@H]1c1ccc(OC)cc1 ZINC000497972265 907443493 /nfs/dbraw/zinc/44/34/93/907443493.db2.gz XTSCFQCNPYNYFI-ISKFKSNPSA-N 0 3 423.557 4.085 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)c3ccc(Cl)c4ncccc34)CC2)C[C@H](C)O1 ZINC000512822262 921326636 /nfs/dbraw/zinc/32/66/36/921326636.db2.gz QEPJNBMXFMYNTG-IRXDYDNUSA-N 0 3 415.965 4.240 20 0 HIADHN Cc1onc(-c2ccccc2Cl)c1C(=O)NCCCN1CCc2ccccc2C1 ZINC000498039367 907545996 /nfs/dbraw/zinc/54/59/96/907545996.db2.gz VBXASDPTDUYNHK-UHFFFAOYSA-N 0 3 409.917 4.482 20 0 HIADHN Cc1csc([C@@H](NC(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)C2CC2)n1 ZINC000498046737 907558307 /nfs/dbraw/zinc/55/83/07/907558307.db2.gz MFSDPHLMEWMFMW-UXHICEINSA-N 0 3 416.591 4.292 20 0 HIADHN CC[C@@H](OC1CCCC1)C(=O)N(CCN(C)C)Cc1ccc(Br)cc1 ZINC000498101622 907611214 /nfs/dbraw/zinc/61/12/14/907611214.db2.gz MIPDUHWXEXEJPC-LJQANCHMSA-N 0 3 411.384 4.077 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)N[C@@H]1CCCOc2c(F)cccc21 ZINC000498112648 907623013 /nfs/dbraw/zinc/62/30/13/907623013.db2.gz VYIRLHTZPFBAAG-MSOLQXFVSA-N 0 3 403.523 4.237 20 0 HIADHN Cc1c2cccc(C)c2oc1C(=O)NCCCN1CCN(C)C[C@@H]1c1ccccc1 ZINC000498140484 907661087 /nfs/dbraw/zinc/66/10/87/907661087.db2.gz OMHSWFCPWUZMFT-JOCHJYFZSA-N 0 3 405.542 4.158 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)N[C@H](c1cccc(F)c1)c1ccccn1 ZINC000498241919 907777480 /nfs/dbraw/zinc/77/74/80/907777480.db2.gz CEDZXCOQOPYJGZ-LADGPHEKSA-N 0 3 418.516 4.274 20 0 HIADHN Cc1cccc([C@@H](NC(=O)NC[C@@H]2CCCN2Cc2ccccc2)c2ccccn2)c1 ZINC000498244485 907781358 /nfs/dbraw/zinc/78/13/58/907781358.db2.gz UQQLZXAZLXPWEJ-UKILVPOCSA-N 0 3 414.553 4.443 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N[C@H](c2cccc(F)c2)c2ccccn2)N(C)C)cc1 ZINC000498250048 907786986 /nfs/dbraw/zinc/78/69/86/907786986.db2.gz HEWIGQIYRQXRBB-DHIUTWEWSA-N 0 3 406.505 4.221 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N[C@@H](c2cccc(C)c2)c2ccccn2)N(C)C)cc1 ZINC000498253065 907790149 /nfs/dbraw/zinc/79/01/49/907790149.db2.gz OZKXEEOUKKKIEM-RPWUZVMVSA-N 0 3 402.542 4.390 20 0 HIADHN C[C@@H](SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)NCCN1CCC[C@H](C)C1 ZINC000498344431 907849581 /nfs/dbraw/zinc/84/95/81/907849581.db2.gz MTROSQXORSGYFC-JKSUJKDBSA-N 0 3 421.994 4.465 20 0 HIADHN CC[C@H](NCc1ccc(OCc2ccc(F)cc2)c(OC)c1)[C@H](O)C(F)(F)F ZINC000498353209 907853956 /nfs/dbraw/zinc/85/39/56/907853956.db2.gz LQTPQMJPJACDGT-LPHOPBHVSA-N 0 3 401.400 4.205 20 0 HIADHN COc1ccc([C@@H](NC(=O)N2CCN3CCC2CC3)c2ccccc2Cl)c(C)c1 ZINC000498378466 907867750 /nfs/dbraw/zinc/86/77/50/907867750.db2.gz XRGWCYDMNPKJEU-JOCHJYFZSA-N 0 3 413.949 4.236 20 0 HIADHN CCOC(=O)[C@@H](Cc1ccccc1)N(C(=O)c1cccc(CN2CCCC2)c1)C1CC1 ZINC000498402625 907883509 /nfs/dbraw/zinc/88/35/09/907883509.db2.gz DVFUHRYNTQUXAH-XMMPIXPASA-N 0 3 420.553 4.061 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)c2cc3sc4ccccc4c3s2)CC1 ZINC000498424922 907896136 /nfs/dbraw/zinc/89/61/36/907896136.db2.gz JKGRZLFWGMTOIU-OAHLLOKOSA-N 0 3 401.601 4.119 20 0 HIADHN Cc1noc2nc(-c3ccc(C)cc3)cc(C(=O)N(CCN(C)C)C3CCCC3)c12 ZINC000498452938 907916367 /nfs/dbraw/zinc/91/63/67/907916367.db2.gz PAUARNYEOBCQHX-UHFFFAOYSA-N 0 3 406.530 4.453 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)[C@@H]1C[C@H]1c1cccc(Br)c1 ZINC000498492454 907966353 /nfs/dbraw/zinc/96/63/53/907966353.db2.gz YJLPWSUYQDYVPK-ZWKOTPCHSA-N 0 3 423.420 4.030 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N2CCC([C@H](F)c3ccccc3F)CC2)CC1 ZINC000498589641 908040861 /nfs/dbraw/zinc/04/08/61/908040861.db2.gz SEILPQFXOIRVRT-QFIPXVFZSA-N 0 3 423.548 4.147 20 0 HIADHN CCc1ccc([C@H]2CCCN(C(=O)NC3CCN(CCOC(C)C)CC3)C2)cc1 ZINC000498594197 908043860 /nfs/dbraw/zinc/04/38/60/908043860.db2.gz SIBCUPQKYFMWMO-QFIPXVFZSA-N 0 3 401.595 4.027 20 0 HIADHN C[C@@H]1CC[C@H](C)N1CC(=O)NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1 ZINC000498622620 908069036 /nfs/dbraw/zinc/06/90/36/908069036.db2.gz ZNHGNGGROBIRPB-HDICACEKSA-N 0 3 406.505 4.167 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)c1csc(-c2ccccc2F)n1 ZINC000498725382 908151399 /nfs/dbraw/zinc/15/13/99/908151399.db2.gz VWGAOSNIGWDYTF-GOSISDBHSA-N 0 3 424.545 4.471 20 0 HIADHN C[C@H](NCc1ccc(-c2ccc(Br)cc2)s1)C1(S(C)(=O)=O)CC1 ZINC000512890473 921384499 /nfs/dbraw/zinc/38/44/99/921384499.db2.gz LAQZUKMLNSUKSQ-LBPRGKRZSA-N 0 3 414.390 4.233 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2C(=O)N2CCN(C)CC[C@@H]2C)cc1C ZINC000498729277 908156233 /nfs/dbraw/zinc/15/62/33/908156233.db2.gz VOXCBJPQUREVEC-FQEVSTJZSA-N 0 3 402.542 4.322 20 0 HIADHN CS(=O)(=O)Nc1cccc(CN[C@H](c2cccc(OC(F)(F)F)c2)C2CC2)c1 ZINC000512894433 921387423 /nfs/dbraw/zinc/38/74/23/921387423.db2.gz JIBXUKFHQYIIKL-SFHVURJKSA-N 0 3 414.449 4.198 20 0 HIADHN C[C@@H](NC(=O)C(C)(C)c1csc(-c2c(F)cccc2F)n1)C1=CCN(C)CC1 ZINC000498795171 908206568 /nfs/dbraw/zinc/20/65/68/908206568.db2.gz BXMJRZKRSDWTMV-CYBMUJFWSA-N 0 3 405.514 4.133 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)N[C@@H]1CCCOc2c(F)cccc21 ZINC000498820045 908227271 /nfs/dbraw/zinc/22/72/71/908227271.db2.gz WSJHDBWNOHDNGS-HXUWFJFHSA-N 0 3 421.463 4.091 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)NC[C@@H](c2cccnc2)C(C)C)N(C)C)cc1 ZINC000498901159 908308960 /nfs/dbraw/zinc/30/89/60/908308960.db2.gz YYVIEFDAYAKVAM-PKTZIBPZSA-N 0 3 412.578 4.211 20 0 HIADHN C[C@H](NC(=O)CN1CCC[C@@H](c2n[nH]c(C3CC3)n2)C1)c1ccc(Cl)cc1Cl ZINC000498915091 908322954 /nfs/dbraw/zinc/32/29/54/908322954.db2.gz FFYIROFXIWXXPE-GXTWGEPZSA-N 0 3 422.360 4.046 20 0 HIADHN Cc1cc(CN2CCC[C@H](c3nnc(C4CC4)[nH]3)C2)nc(-c2ccc(Cl)cc2)n1 ZINC000498916800 908326222 /nfs/dbraw/zinc/32/62/22/908326222.db2.gz IPWAMHTVNIEDNM-KRWDZBQOSA-N 0 3 408.937 4.481 20 0 HIADHN Cc1cc(C(=O)[C@@H](C)N2CCC[C@@H](c3nc(C4CC4)n[nH]3)C2)c(C)n1Cc1ccco1 ZINC000498928980 908338023 /nfs/dbraw/zinc/33/80/23/908338023.db2.gz LSEWYXOVYDYFGS-IEBWSBKVSA-N 0 3 421.545 4.193 20 0 HIADHN Cc1cc(C(=O)[C@@H](C)N2CCC[C@@H](c3n[nH]c(C4CC4)n3)C2)c(C)n1Cc1ccco1 ZINC000498928980 908338035 /nfs/dbraw/zinc/33/80/35/908338035.db2.gz LSEWYXOVYDYFGS-IEBWSBKVSA-N 0 3 421.545 4.193 20 0 HIADHN CCN1C[C@H](C)N(Cc2csc(N(C(C)=O)c3cccc(Cl)c3)n2)C[C@H]1C ZINC000498928607 908338395 /nfs/dbraw/zinc/33/83/95/908338395.db2.gz ZEKXLRXXKVLPOH-CABCVRRESA-N 0 3 406.983 4.396 20 0 HIADHN O=C(Nc1ccccc1)[C@@H](c1ccccc1)N1CCC[C@@H](c2nc(C3CC3)n[nH]2)C1 ZINC000498935728 908343749 /nfs/dbraw/zinc/34/37/49/908343749.db2.gz AEBYMIKUOKZMAB-TZIWHRDSSA-N 0 3 401.514 4.242 20 0 HIADHN C[C@H](NC(=O)[C@H](C)N1CCC[C@H](c2nc(C3CC3)n[nH]2)C1)c1cccc2ccccc21 ZINC000498935719 908344460 /nfs/dbraw/zinc/34/44/60/908344460.db2.gz ADAOXGFDDNAPLL-ZWOKBUDYSA-N 0 3 417.557 4.281 20 0 HIADHN C[C@H](NC(=O)[C@H](C)N1CCC[C@H](c2n[nH]c(C3CC3)n2)C1)c1cccc2ccccc21 ZINC000498935719 908344476 /nfs/dbraw/zinc/34/44/76/908344476.db2.gz ADAOXGFDDNAPLL-ZWOKBUDYSA-N 0 3 417.557 4.281 20 0 HIADHN O=C(Nc1ccccc1)[C@H](c1ccccc1)N1CCC[C@H](c2nc(C3CC3)n[nH]2)C1 ZINC000498935726 908344624 /nfs/dbraw/zinc/34/46/24/908344624.db2.gz AEBYMIKUOKZMAB-FPOVZHCZSA-N 0 3 401.514 4.242 20 0 HIADHN CCN1C[C@@H](C)N(Cc2csc(N(C(C)=O)c3ccc(Cl)cc3)n2)C[C@H]1C ZINC000498940302 908348010 /nfs/dbraw/zinc/34/80/10/908348010.db2.gz XLJXEASPMKXPGF-HUUCEWRRSA-N 0 3 406.983 4.396 20 0 HIADHN CC[C@H](C)Sc1ccc(NC(=O)C(=O)NC[C@@H](C)N2CCC[C@@H](C)C2)c(C)c1 ZINC000498948031 908351222 /nfs/dbraw/zinc/35/12/22/908351222.db2.gz AQDWFZNGESKBEN-NXHRZFHOSA-N 0 3 405.608 4.061 20 0 HIADHN Cc1cccc([C@H](NC(=O)N(CCN(C)C)Cc2ccccc2)c2ccccn2)c1 ZINC000499013019 908388826 /nfs/dbraw/zinc/38/88/26/908388826.db2.gz JTXLQNLPNABKQH-DEOSSOPVSA-N 0 3 402.542 4.253 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)N(CCc2nccs2)C(C)C)N(C)C)cc1 ZINC000512918876 921413260 /nfs/dbraw/zinc/41/32/60/921413260.db2.gz UVAIJZCFTFUINS-HXUWFJFHSA-N 0 3 418.607 4.196 20 0 HIADHN Cc1ccc(-n2ncc(C(=O)NC[C@@H](C)N3CCC(C)CC3)c2C(F)(F)F)cc1 ZINC000499132759 908489151 /nfs/dbraw/zinc/48/91/51/908489151.db2.gz ABZLNRTYIWOZES-MRXNPFEDSA-N 0 3 408.468 4.050 20 0 HIADHN Cc1cc(NC(=O)C(C)(C)C)sc1C(=O)NC[C@H](c1ccc(C)cc1)N(C)C ZINC000499132991 908489388 /nfs/dbraw/zinc/48/93/88/908489388.db2.gz BJHPFHGQEQHGSV-QGZVFWFLSA-N 0 3 401.576 4.382 20 0 HIADHN Cc1cc(CSc2ncccc2C(=O)NC[C@@H](c2ccc(C)cc2)N(C)C)no1 ZINC000499167486 908519560 /nfs/dbraw/zinc/51/95/60/908519560.db2.gz KYFGQZXTMQYGDR-FQEVSTJZSA-N 0 3 410.543 4.011 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)N[C@@H](c1cccc(F)c1)c1ccccn1 ZINC000499305478 908679014 /nfs/dbraw/zinc/67/90/14/908679014.db2.gz GVAZFHXBMFHWBE-QHCPKHFHSA-N 0 3 424.495 4.223 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)c1coc(Br)c1 ZINC000499357383 908723846 /nfs/dbraw/zinc/72/38/46/908723846.db2.gz ONDSBFCRTDMBJA-UHFFFAOYSA-N 0 3 419.241 4.265 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2nn(-c3ccccc3)c3c2CCC3)N2CCCC2)cc1 ZINC000499419418 908785711 /nfs/dbraw/zinc/78/57/11/908785711.db2.gz UTTIXCKPSYGJMY-XMMPIXPASA-N 0 3 414.553 4.236 20 0 HIADHN CN(C)[C@H](CNC(=O)Cc1csc(-c2ccc(Cl)s2)n1)c1ccccc1 ZINC000512966571 921442814 /nfs/dbraw/zinc/44/28/14/921442814.db2.gz JZPLUCVXETXIEN-OAHLLOKOSA-N 0 3 405.976 4.487 20 0 HIADHN C[C@H]1CN(c2ccc(CNCc3cccc(OCc4ccc(F)cc4)c3)cn2)CCO1 ZINC000499705807 908882767 /nfs/dbraw/zinc/88/27/67/908882767.db2.gz MFJCPANESITAMW-IBGZPJMESA-N 0 3 421.516 4.315 20 0 HIADHN Cc1nn(-c2ccccc2)c(Oc2cccc(F)c2)c1CN[C@@H](C)CC[S@@](C)=O ZINC000499709308 908884678 /nfs/dbraw/zinc/88/46/78/908884678.db2.gz WVVGXHKFFNOLRI-GUNSETOZSA-N 0 3 415.534 4.359 20 0 HIADHN CCN(C(=O)c1ccn(-c2ccccc2F)n1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000500004186 909453298 /nfs/dbraw/zinc/45/32/98/909453298.db2.gz KKTNWSYIPCUUOQ-UYAOXDASSA-N 0 3 406.505 4.309 20 0 HIADHN Cc1ccc(C)c(OCCCCC(=O)N(C)C2CCN(CCc3ccccn3)CC2)c1 ZINC000500030281 909488632 /nfs/dbraw/zinc/48/86/32/909488632.db2.gz OXYDPFVRDAYIFW-UHFFFAOYSA-N 0 3 423.601 4.413 20 0 HIADHN CN(C(=O)CCc1ccc(C(C)(C)C)cc1)C1CCN(CCc2ccccn2)CC1 ZINC000500067316 909535714 /nfs/dbraw/zinc/53/57/14/909535714.db2.gz YYDIAWWGOUCNDA-UHFFFAOYSA-N 0 3 407.602 4.477 20 0 HIADHN O=C(NC[C@@H]1CCCN(Cc2ccc(OCc3ccccn3)cc2)C1)c1ccccc1 ZINC000513045525 921504224 /nfs/dbraw/zinc/50/42/24/921504224.db2.gz FQIRDANNVOJPSM-QFIPXVFZSA-N 0 3 415.537 4.303 20 0 HIADHN COc1cc(Br)cc(NC(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000500088399 909566917 /nfs/dbraw/zinc/56/69/17/909566917.db2.gz MZOXPAFSJDEZMS-SFHVURJKSA-N 0 3 418.335 4.196 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)N[C@H]2CC(C)(C)Oc3cc(F)ccc32)cc1 ZINC000500131558 909613099 /nfs/dbraw/zinc/61/30/99/909613099.db2.gz NBHMEARIFBVHEG-VQTJNVASSA-N 0 3 415.509 4.039 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N[C@H]1CC(C)(C)Oc2cc(F)ccc21)c1ccco1 ZINC000500152918 909630120 /nfs/dbraw/zinc/63/01/20/909630120.db2.gz CUJAYFZOJZTOEO-WBAXXEDZSA-N 0 3 403.498 4.450 20 0 HIADHN COc1ccccc1[C@H](NC(=O)N[C@@H]1CCN(Cc2ccccc2)[C@H]1C)c1ccco1 ZINC000500153856 909632789 /nfs/dbraw/zinc/63/27/89/909632789.db2.gz ZHCFCPHBRKOPND-VNZMSGEBSA-N 0 3 419.525 4.340 20 0 HIADHN COc1ccccc1[C@H](NC(=O)N[C@H](CN(C)C)c1ccc(F)cc1)c1ccco1 ZINC000500164130 909646879 /nfs/dbraw/zinc/64/68/79/909646879.db2.gz PQXXDQUHZWLQFN-KNQAVFIVSA-N 0 3 411.477 4.119 20 0 HIADHN CCc1nnc(NC(=O)[C@H](C)[C@H](C)NCc2c(Cl)cccc2N2CCCC2)s1 ZINC000513064569 921521046 /nfs/dbraw/zinc/52/10/46/921521046.db2.gz QJFCSPZNCGCNOF-KGLIPLIRSA-N 0 3 421.998 4.107 20 0 HIADHN COc1ccccc1CCNC(=O)CNC/C(C)=C\c1ccccc1C(F)(F)F ZINC000500362448 909812609 /nfs/dbraw/zinc/81/26/09/909812609.db2.gz DAOSALGUMBPMRX-SSZFMOIBSA-N 0 3 406.448 4.066 20 0 HIADHN O=C(NC[C@@H]1CCCN(Cc2cccc(OCC(F)(F)F)c2)C1)c1ccccc1 ZINC000513073082 921526579 /nfs/dbraw/zinc/52/65/79/921526579.db2.gz AZYXLILLKTUZSF-SFHVURJKSA-N 0 3 406.448 4.270 20 0 HIADHN C/C(=C\c1ccccc1C(F)(F)F)CNCc1cnc(N2CCOCC2)c(F)c1 ZINC000500398554 909836439 /nfs/dbraw/zinc/83/64/39/909836439.db2.gz DEOQSZVBXQMIGC-XNTDXEJSSA-N 0 3 409.427 4.269 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)c2cnc(-c3ccccc3)nc2C)cc1 ZINC000500410378 909842884 /nfs/dbraw/zinc/84/28/84/909842884.db2.gz OPNJGIVEJJEMEY-QHCPKHFHSA-N 0 3 416.525 4.028 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)c2ccc(OCC(F)(F)F)cc2)cc1 ZINC000500420938 909846728 /nfs/dbraw/zinc/84/67/28/909846728.db2.gz NBGZNFTZLLYSLZ-FQEVSTJZSA-N 0 3 422.447 4.203 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)c2cnn(-c3cccc(C)c3)c2C)cc1 ZINC000500425552 909849656 /nfs/dbraw/zinc/84/96/56/909849656.db2.gz UETRIAXUYVIQKH-XMMPIXPASA-N 0 3 418.541 4.065 20 0 HIADHN O=S(=O)(c1csc(-c2ccccc2)n1)N1CCCN(CC2CCCCC2)CC1 ZINC000500437540 909857114 /nfs/dbraw/zinc/85/71/14/909857114.db2.gz DCCATYIIDXYLGZ-UHFFFAOYSA-N 0 3 419.616 4.087 20 0 HIADHN CCc1nnc(NC(=O)[C@H](C)[C@@H](C)NCc2ccc(-c3ccc(F)cc3)o2)s1 ZINC000513075071 921529232 /nfs/dbraw/zinc/52/92/32/921529232.db2.gz JWXRJHSVJUIOPT-CHWSQXEVSA-N 0 3 402.495 4.253 20 0 HIADHN C/C(=C\c1ccccc1C(F)(F)F)CNCC(=O)N[C@@H]1CCOc2ccccc21 ZINC000500527360 909907536 /nfs/dbraw/zinc/90/75/36/909907536.db2.gz KMTIOGKMPQVHJI-LBKOFNPBSA-N 0 3 404.432 4.338 20 0 HIADHN C/C(=C/c1ccccc1C(F)(F)F)CNCC(=O)N[C@H]1CCOc2ccccc21 ZINC000500527363 909907787 /nfs/dbraw/zinc/90/77/87/909907787.db2.gz KMTIOGKMPQVHJI-RYBIEJRYSA-N 0 3 404.432 4.338 20 0 HIADHN CCc1nnc(NC(=O)[C@@H](C)[C@@H](C)NCc2cc(Cl)cc(Cl)c2OC)s1 ZINC000513089854 921539605 /nfs/dbraw/zinc/53/96/05/921539605.db2.gz PTEOMOFPVDBZER-VHSXEESVSA-N 0 3 417.362 4.169 20 0 HIADHN CCc1nnc(NC(=O)[C@H](C)[C@@H](C)NCc2cc(Cl)ccc2OC(F)F)s1 ZINC000513081850 921534748 /nfs/dbraw/zinc/53/47/48/921534748.db2.gz HNIWSICLPSAJAW-NXEZZACHSA-N 0 3 418.897 4.108 20 0 HIADHN CCN1CCN(Cc2ccc(CNC(=O)Nc3ccc(Cl)cc3Cl)cc2)CC1 ZINC000500636175 909981579 /nfs/dbraw/zinc/98/15/79/909981579.db2.gz SRKWXNVIHXYYRQ-UHFFFAOYSA-N 0 3 421.372 4.453 20 0 HIADHN CCOc1cc(CNC(=O)N(CCN(C)C)Cc2cccc(Cl)c2)ccc1OC ZINC000513090130 921539930 /nfs/dbraw/zinc/53/99/30/921539930.db2.gz RWIJAEZEVGJOLG-UHFFFAOYSA-N 0 3 419.953 4.021 20 0 HIADHN C[S@](=O)Cc1ccc(CNCc2c[nH]nc2-c2ccc(C(F)(F)F)cc2)cc1 ZINC000513089459 921540149 /nfs/dbraw/zinc/54/01/49/921540149.db2.gz OFOGLYPQFNFJAG-NDEPHWFRSA-N 0 3 407.461 4.264 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)N[C@H](c2ccccc2)C(C)C)CC1 ZINC000500683253 910018189 /nfs/dbraw/zinc/01/81/89/910018189.db2.gz MUVDVIUJSKDCPE-DEOSSOPVSA-N 0 3 408.590 4.021 20 0 HIADHN CC(C)CN(C(=O)CCCOc1cccc(Br)c1)C1CCN(C)CC1 ZINC000500726115 910044777 /nfs/dbraw/zinc/04/47/77/910044777.db2.gz AZWXMBUWUGVLJB-UHFFFAOYSA-N 0 3 411.384 4.187 20 0 HIADHN Cc1c(C(=O)N(C)C2CCN(CCc3ccccn3)CC2)sc2nccc(C)c12 ZINC000500774495 910071252 /nfs/dbraw/zinc/07/12/52/910071252.db2.gz TWGBRMUTNGRKGL-UHFFFAOYSA-N 0 3 408.571 4.087 20 0 HIADHN O=C(NC[C@H]1CCCN(Cc2ccccc2OCc2cccnc2)C1)c1ccccc1 ZINC000513100062 921548241 /nfs/dbraw/zinc/54/82/41/921548241.db2.gz FYLFRXLEPQEJOK-OAQYLSRUSA-N 0 3 415.537 4.303 20 0 HIADHN COc1cccc([C@H](CNC(=O)N[C@@H](C)c2cccc(F)c2F)N2CCCC2)c1 ZINC000500834538 910110538 /nfs/dbraw/zinc/11/05/38/910110538.db2.gz REBBTBYHTKUHEH-YWZLYKJASA-N 0 3 403.473 4.171 20 0 HIADHN Cc1c2cc(Br)ccc2oc1C(=O)N(CCN(C)C)Cc1ccccn1 ZINC000500848112 910122184 /nfs/dbraw/zinc/12/21/84/910122184.db2.gz BAZYHBFBHHMFTL-UHFFFAOYSA-N 0 3 416.319 4.103 20 0 HIADHN O=C(NC[C@@H]1CCCN(Cc2ccc(OCC(F)(F)F)cc2)C1)c1ccccc1 ZINC000513101545 921550419 /nfs/dbraw/zinc/55/04/19/921550419.db2.gz SFIWWAOOJLIPNS-SFHVURJKSA-N 0 3 406.448 4.270 20 0 HIADHN Cc1nc(-c2cccc(Cl)c2)sc1C(=O)N(CCN(C)C)Cc1ccccn1 ZINC000500851746 910124561 /nfs/dbraw/zinc/12/45/61/910124561.db2.gz HONUUTMRFJRFBU-UHFFFAOYSA-N 0 3 414.962 4.371 20 0 HIADHN COc1ccc(-c2cc(NC(=O)N3CCCN(C)CC3)ccc2OC(F)F)cc1 ZINC000501015621 910234724 /nfs/dbraw/zinc/23/47/24/910234724.db2.gz CATXXPNJLJOQAC-UHFFFAOYSA-N 0 3 405.445 4.133 20 0 HIADHN COc1cccc(CNC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)c1OC1CCCC1 ZINC000501043474 910257079 /nfs/dbraw/zinc/25/70/79/910257079.db2.gz FINUCKRSUGSGBR-OAQYLSRUSA-N 0 3 423.557 4.090 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N[C@H](c1cccc(F)c1)c1ccccn1)c1ccco1 ZINC000501087222 910284461 /nfs/dbraw/zinc/28/44/61/910284461.db2.gz LTPNKXPTJFWGAT-XUEUYAKLSA-N 0 3 410.493 4.332 20 0 HIADHN C[C@H](NC(=O)N[C@@H](c1cccc(F)c1)c1ccccn1)[C@H](c1ccccc1)N(C)C ZINC000501093652 910292451 /nfs/dbraw/zinc/29/24/51/910292451.db2.gz ZBHBURAWOYJCLD-PDIWNELESA-N 0 3 406.505 4.301 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CN1CCC2(C[C@@H]2C(=O)N2CCCCC2)CC1 ZINC000501147624 910322404 /nfs/dbraw/zinc/32/24/04/910322404.db2.gz JTZLJQYPGJBWJO-HSZRJFAPSA-N 0 3 406.574 4.104 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCc1cc(Cl)c2c(c1)OCCO2)c1ccsc1 ZINC000501155202 910327726 /nfs/dbraw/zinc/32/77/26/910327726.db2.gz TTZCYNMHIPKVIJ-KRWDZBQOSA-N 0 3 423.966 4.055 20 0 HIADHN Cc1cc(C)c(CNCc2ccc(S(=O)(=O)N3CCC[C@H](C)C3)cc2)cc1C ZINC000513126754 921570317 /nfs/dbraw/zinc/57/03/17/921570317.db2.gz XUUMMZCRDGTHSH-KRWDZBQOSA-N 0 3 400.588 4.322 20 0 HIADHN CC[C@@H](C)NC(=O)CCNCc1cc(Br)ccc1OCc1ccccc1 ZINC000513132347 921575626 /nfs/dbraw/zinc/57/56/26/921575626.db2.gz SPODJTJKMFGFRZ-MRXNPFEDSA-N 0 3 419.363 4.423 20 0 HIADHN CC(=O)CCc1ccc(OCC(=O)NC[C@@H](c2ccccc2)N2CCC(C)CC2)cc1 ZINC000501342394 910480046 /nfs/dbraw/zinc/48/00/46/910480046.db2.gz HSVIODWTCVVTBX-VWLOTQADSA-N 0 3 422.569 4.176 20 0 HIADHN CC[C@@H](CNC(=O)Nc1cccc(N2CCCCC2=O)c1)N1CCc2ccccc2C1 ZINC000501348798 910486702 /nfs/dbraw/zinc/48/67/02/910486702.db2.gz FGHRQDDIXRBRPO-QFIPXVFZSA-N 0 3 420.557 4.162 20 0 HIADHN C/C(=C\c1ccccc1C(F)(F)F)CNCc1cccnc1N1CCN(C)CC1 ZINC000501377930 910507948 /nfs/dbraw/zinc/50/79/48/910507948.db2.gz NIJOGWOBCCHSSC-SAPNQHFASA-N 0 3 404.480 4.045 20 0 HIADHN COC(=O)CCC[C@@H]1CCC[C@@H](N[C@@H](C)c2nc(-c3ccccc3OC)no2)C1 ZINC000513157664 921591221 /nfs/dbraw/zinc/59/12/21/921591221.db2.gz CPZIPLHTNWCHBB-YESZJQIVSA-N 0 3 401.507 4.298 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N[C@H]1CCO[C@@H]1c1ccc(Cl)c(F)c1)c1ccco1 ZINC000501585911 910691763 /nfs/dbraw/zinc/69/17/63/910691763.db2.gz RKIDPOQEJNYULA-RDOJZNBBSA-N 0 3 423.916 4.331 20 0 HIADHN CC(C)Cn1ncc(NC(=O)CCCN2CCN(c3ccccc3)CC2)c1C(C)C ZINC000501622864 910724388 /nfs/dbraw/zinc/72/43/88/910724388.db2.gz VHTJCRURWOFOKB-UHFFFAOYSA-N 0 3 411.594 4.203 20 0 HIADHN O=C(Nc1c[nH]nc1[C@H]1CCCN(Cc2c[nH]nc2-c2cccs2)C1)C1CCCC1 ZINC000501692713 910763197 /nfs/dbraw/zinc/76/31/97/910763197.db2.gz CWQXLQNDWVLKER-INIZCTEOSA-N 0 3 424.574 4.370 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)c3csc(-c4ccc(C)o4)n3)cc2)CC1 ZINC000513186889 921609320 /nfs/dbraw/zinc/60/93/20/921609320.db2.gz QKLYIFSTXUKUDD-UHFFFAOYSA-N 0 3 410.543 4.101 20 0 HIADHN CN(C(=O)c1ccc(CCC(F)(F)F)cc1)C1CCN(CCc2ccccn2)CC1 ZINC000501735780 910798065 /nfs/dbraw/zinc/79/80/65/910798065.db2.gz UIBPJCOOYIIAKH-UHFFFAOYSA-N 0 3 419.491 4.356 20 0 HIADHN CC(=O)Nc1c[nH]nc1[C@H]1CCCN(Cc2cn(-c3ccccc3)nc2C(C)(C)C)C1 ZINC000501746424 910806023 /nfs/dbraw/zinc/80/60/23/910806023.db2.gz XYVLGSIKMBNBCX-SFHVURJKSA-N 0 3 420.561 4.231 20 0 HIADHN CC(C)[C@](C)(NCc1ccc2c(c1)NC(=O)CO2)c1ccc(Br)cc1 ZINC000513182248 921606278 /nfs/dbraw/zinc/60/62/78/921606278.db2.gz FWSOQAPPGTZDFU-FQEVSTJZSA-N 0 3 403.320 4.441 20 0 HIADHN C[C@H](NCC(=O)N1Cc2ccccc2[C@H](c2ccccc2)C1)c1ccc2n[nH]cc2c1 ZINC000513184816 921608088 /nfs/dbraw/zinc/60/80/88/921608088.db2.gz VHHGOHHOPWEJKK-UUOWRZLLSA-N 0 3 410.521 4.388 20 0 HIADHN CCN(Cc1ccccc1NC(=O)N[C@H](CN1CCCC1)c1ccccc1)C(C)=O ZINC000501783965 910837492 /nfs/dbraw/zinc/83/74/92/910837492.db2.gz GWZCDJJSSQKZKK-HSZRJFAPSA-N 0 3 408.546 4.014 20 0 HIADHN O=C(Nc1cc2c(cc1Cl)OCCO2)N[C@H](CN1CCCC1)c1ccccc1 ZINC000501807124 910858334 /nfs/dbraw/zinc/85/83/34/910858334.db2.gz ZZAQGIYUUNAGRV-GOSISDBHSA-N 0 3 401.894 4.070 20 0 HIADHN C[C@@H](NC(=O)N[C@H](CN1CCCC1)c1ccccc1)c1ccc(NC(=O)C2CC2)cc1 ZINC000501834882 910876546 /nfs/dbraw/zinc/87/65/46/910876546.db2.gz ZTDXPSUOXJQLTH-WZONZLPQSA-N 0 3 420.557 4.232 20 0 HIADHN CN(Cc1cc(Br)cs1)C(=O)N[C@H](CN1CCCC1)c1ccccc1 ZINC000501851185 910884271 /nfs/dbraw/zinc/88/42/71/910884271.db2.gz VOIRRWZSSZDWOK-GOSISDBHSA-N 0 3 422.392 4.489 20 0 HIADHN CCN(Cc1cccc(NC(=O)N[C@H](CN2CCCC2)c2ccccc2)c1)C(C)=O ZINC000501853176 910886227 /nfs/dbraw/zinc/88/62/27/910886227.db2.gz YRTWJFQQTUAYAS-HSZRJFAPSA-N 0 3 408.546 4.014 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)N[C@H]2CCCc3cn(C4CCCC4)nc32)CCN1Cc1ccccc1 ZINC000501921286 910919338 /nfs/dbraw/zinc/91/93/38/910919338.db2.gz ZCBXXWQZKQRTDL-LEOXJPRUSA-N 0 3 421.589 4.338 20 0 HIADHN CCN(C(=O)c1ccc2c(c1)NC(=O)CS2)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000501953991 910941437 /nfs/dbraw/zinc/94/14/37/910941437.db2.gz CUKUVQCTWBOEJW-APWZRJJASA-N 0 3 409.555 4.028 20 0 HIADHN CCN(C(=O)c1ccc(-n2nc(C)cc2C)nc1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000501955979 910943159 /nfs/dbraw/zinc/94/31/59/910943159.db2.gz IBGPLQUSQZXESN-REWPJTCUSA-N 0 3 417.557 4.182 20 0 HIADHN CCN(C(=O)c1ccc(CN2CCCC2=O)cc1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000501959143 910946042 /nfs/dbraw/zinc/94/60/42/910946042.db2.gz FYCKEUULHOOMQV-YKSBVNFPSA-N 0 3 419.569 4.107 20 0 HIADHN O=C(Cn1ccc2ccc(Cl)cc21)NCCCCN1CCN(c2ccccc2)CC1 ZINC000502033381 910989557 /nfs/dbraw/zinc/98/95/57/910989557.db2.gz CZMZHYGYUAOHDX-UHFFFAOYSA-N 0 3 424.976 4.013 20 0 HIADHN C[C@@H](NC[C@@H]1CN(C(=O)c2ccccc2)[C@H]2CCN1C2)c1cc(Cl)ccc1Cl ZINC000502038248 910992843 /nfs/dbraw/zinc/99/28/43/910992843.db2.gz VKLMXLRFKMHTSX-AYOQOUSVSA-N 0 3 418.368 4.243 20 0 HIADHN COc1ccccc1C[C@H]1CCCN1C(=O)c1ccc(N2CCN(C(C)C)CC2)cc1 ZINC000502067680 911012834 /nfs/dbraw/zinc/01/28/34/911012834.db2.gz WVCGIYFANJTCDK-XMMPIXPASA-N 0 3 421.585 4.073 20 0 HIADHN O=C(NC[C@H]1CCCN1Cc1ccccc1)C1(c2cccc(Cl)c2)CCOCC1 ZINC000513216834 921631092 /nfs/dbraw/zinc/63/10/92/921631092.db2.gz HKBCUQYQJSHOMX-JOCHJYFZSA-N 0 3 412.961 4.169 20 0 HIADHN Cc1cc([C@H](C)NC(=O)NCCCN2CCN(C)C[C@H]2c2ccccc2)c(C)s1 ZINC000502191043 911128146 /nfs/dbraw/zinc/12/81/46/911128146.db2.gz YXCVALJTVPZTQB-AVRDEDQJSA-N 0 3 414.619 4.104 20 0 HIADHN O=C(NC[C@H]1CCCN1Cc1ccccc1)c1cnn(-c2ccccc2)c1C1CC1 ZINC000513231165 921643644 /nfs/dbraw/zinc/64/36/44/921643644.db2.gz CCTPTHODOUZGLG-JOCHJYFZSA-N 0 3 400.526 4.144 20 0 HIADHN COc1cc(C)c([C@@H](C)NC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)cc1OC ZINC000502282105 911233467 /nfs/dbraw/zinc/23/34/67/911233467.db2.gz JCMNRASKWWXQDM-UYAOXDASSA-N 0 3 411.546 4.037 20 0 HIADHN COc1ccc(NC(=O)C[C@H](C)N[C@@H]2CCOc3c(Br)cccc32)cc1 ZINC000502335224 911315019 /nfs/dbraw/zinc/31/50/19/911315019.db2.gz BDPOLRZDABBIMK-SCLBCKFNSA-N 0 3 419.319 4.288 20 0 HIADHN C[C@@H]1CCCC[C@@H]1OCCN1CCC[C@H](c2n[nH]cc2NC(=O)C2CCCC2)C1 ZINC000502339817 911318401 /nfs/dbraw/zinc/31/84/01/911318401.db2.gz OPOIZAFQXSJJMV-LMNJBCLMSA-N 0 3 402.583 4.313 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)c1cc(F)ccc1Br ZINC000502358330 911343385 /nfs/dbraw/zinc/34/33/85/911343385.db2.gz RQGPTCYAKODLKL-UHFFFAOYSA-N 0 3 407.327 4.225 20 0 HIADHN COc1cc(C)c(C[C@@H](C)N[C@@H](CCO)c2ccccc2Br)cc1OC ZINC000502474874 911466045 /nfs/dbraw/zinc/46/60/45/911466045.db2.gz IIOSKXBSZRPDNK-BEFAXECRSA-N 0 3 422.363 4.419 20 0 HIADHN COc1ccc(OC)c(NC(=O)C[C@@H](C)N[C@@H](C)c2ccccc2OC(F)F)c1 ZINC000502499162 911500512 /nfs/dbraw/zinc/50/05/12/911500512.db2.gz FOXZKFZAZAESEB-KGLIPLIRSA-N 0 3 408.445 4.373 20 0 HIADHN CC(C)[C@@H](N[C@@H](C)C(=O)N[C@@H](C)c1ccc2c(c1)OCCO2)c1ccc(F)cc1 ZINC000502507316 911510903 /nfs/dbraw/zinc/51/09/03/911510903.db2.gz GTICGSRJCZHNAI-PONJGIIJSA-N 0 3 400.494 4.150 20 0 HIADHN CCOC(=O)c1c2c(sc1NC(=O)[C@@H]1CCO[C@H](CC)C1)C(C)(C)NC(C)(C)C2 ZINC000502519091 911524094 /nfs/dbraw/zinc/52/40/94/911524094.db2.gz MAODJOBHHUZJRS-ZIAGYGMSSA-N 0 3 422.591 4.228 20 0 HIADHN O=C(CCN(CCO)Cc1ccc(Cl)c(Cl)c1)Nc1ccccc1Cl ZINC000502540643 911546678 /nfs/dbraw/zinc/54/66/78/911546678.db2.gz NGRBUXPFNSEPLB-UHFFFAOYSA-N 0 3 401.721 4.470 20 0 HIADHN CC(C)[C@@H](NCC(=O)N1CCC[C@H]1c1ccc2c(c1)OCCO2)c1ccc(F)cc1 ZINC000502593655 911598864 /nfs/dbraw/zinc/59/88/64/911598864.db2.gz TXBWDQSPNUPJOP-GBXCKJPGSA-N 0 3 412.505 4.247 20 0 HIADHN CC(C)N(CCC(=O)Nc1c(Cl)cccc1Cl)CC(=O)N1CCCCCC1 ZINC000513273541 921675306 /nfs/dbraw/zinc/67/53/06/921675306.db2.gz YGXWZXIZKYNVEF-UHFFFAOYSA-N 0 3 414.377 4.435 20 0 HIADHN Cc1nc(-c2ccccc2)ncc1C(=O)Nc1cccc(N2CCN(C(C)C)CC2)c1 ZINC000502902908 911893077 /nfs/dbraw/zinc/89/30/77/911893077.db2.gz GPMLZHIAKVTOCQ-UHFFFAOYSA-N 0 3 415.541 4.235 20 0 HIADHN CCCN(CC(=O)Nc1cc(C)nn1C(C)(C)C)[C@H](C)CC(=O)Nc1ccccc1 ZINC000502934703 911921512 /nfs/dbraw/zinc/92/15/12/911921512.db2.gz HSCWIGVOZREXAJ-GOSISDBHSA-N 0 3 413.566 4.014 20 0 HIADHN CCN(CC)c1nc2sc(C(=O)N3CCCC[C@H](N4CCCC4)C3)cc2s1 ZINC000502935320 911921600 /nfs/dbraw/zinc/92/16/00/911921600.db2.gz LKBJVVOWRIVHAC-HNNXBMFYSA-N 0 3 406.621 4.295 20 0 HIADHN COc1ccc(C(=O)CCC(=O)NCc2ccccc2CN2CCCC2)c(Cl)c1 ZINC000502965392 911946236 /nfs/dbraw/zinc/94/62/36/911946236.db2.gz OFNFCJVUMNWPSC-UHFFFAOYSA-N 0 3 414.933 4.224 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NC(C)(C)c1ccccc1OC)c1cccc(OC)c1 ZINC000502976326 911956839 /nfs/dbraw/zinc/95/68/39/911956839.db2.gz OUJLFRDIISWBKQ-OAQYLSRUSA-N 0 3 413.562 4.321 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N[C@@H](c2ccccc2)c2ccncc2)N(C)C)cc1 ZINC000503024791 911996166 /nfs/dbraw/zinc/99/61/66/911996166.db2.gz OHJOFTFYPMPCPS-ZEQRLZLVSA-N 0 3 402.542 4.336 20 0 HIADHN CCOc1ccc(-c2nc(CN(C)CCCn3ccnc3C)cs2)cc1OC ZINC000503052458 912015796 /nfs/dbraw/zinc/01/57/96/912015796.db2.gz YJIPVNMYOOJIIW-UHFFFAOYSA-N 0 3 400.548 4.244 20 0 HIADHN CCC[C@@H]1C[C@H](C(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)CCO1 ZINC000503068470 912034189 /nfs/dbraw/zinc/03/41/89/912034189.db2.gz KESBTQBZKPWSLR-IEBWSBKVSA-N 0 3 400.485 4.191 20 0 HIADHN CC(C)Cc1ccc([C@H](CNC(=O)N2CCC3(CCOCC3)[C@H]2C)N(C)C)cc1 ZINC000513340464 921724980 /nfs/dbraw/zinc/72/49/80/921724980.db2.gz KHMUOAFRNMYCBJ-KNQAVFIVSA-N 0 3 401.595 4.088 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)N(C)[C@@H]3CCC[C@H](C)C3)CC2)c1 ZINC000503200641 912179402 /nfs/dbraw/zinc/17/94/02/912179402.db2.gz BZTWKXQJUXEGEO-RBBKRZOGSA-N 0 3 400.611 4.117 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)N(Cc3ccccc3)C3CC3)CC2)c1 ZINC000503218340 912201726 /nfs/dbraw/zinc/20/17/26/912201726.db2.gz QYFOYHQFWRZFSR-UHFFFAOYSA-N 0 3 420.601 4.271 20 0 HIADHN Brc1ccc2c(c1)C=C(CN1CCN(CCc3ccccc3)CC1)CO2 ZINC000506278269 914879746 /nfs/dbraw/zinc/87/97/46/914879746.db2.gz BZZOCNSDFTWHFS-UHFFFAOYSA-N 0 3 413.359 4.085 20 0 HIADHN COc1ccc(Br)cc1NC(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000506279820 914880093 /nfs/dbraw/zinc/88/00/93/914880093.db2.gz GPEBVWYYFAFIDJ-RHSMWYFYSA-N 0 3 418.335 4.415 20 0 HIADHN O=C(NC1CCN(Cc2c[nH]nc2-c2cccc(Cl)c2)CC1)c1ccc(F)cc1 ZINC000506404170 915019043 /nfs/dbraw/zinc/01/90/43/915019043.db2.gz PXWFNBGYJPFBFQ-UHFFFAOYSA-N 0 3 412.896 4.264 20 0 HIADHN O=C(Nc1cccc(CN2CCCCC2=O)c1)N[C@H](CN1CCCC1)c1ccccc1 ZINC000506514988 915142316 /nfs/dbraw/zinc/14/23/16/915142316.db2.gz WWFZROZVCXQLIH-HSZRJFAPSA-N 0 3 420.557 4.158 20 0 HIADHN CCc1ccc([C@H](CNC(=O)Nc2cc(OC)ccc2Br)N(C)C)cc1 ZINC000506514179 915142410 /nfs/dbraw/zinc/14/24/10/915142410.db2.gz TXTNZRBWTQUNED-IBGZPJMESA-N 0 3 420.351 4.445 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(C)c1CN1CCC[C@H](c2nnc3n2CCCCC3)C1 ZINC000506616976 915272683 /nfs/dbraw/zinc/27/26/83/915272683.db2.gz GUBFPGVQHHJFAJ-IBGZPJMESA-N 0 3 422.552 4.326 20 0 HIADHN COc1ccc([C@@H]2CCCN2Cc2ccc(OCc3nccn3C)cc2)cc1OC ZINC000506630358 915297275 /nfs/dbraw/zinc/29/72/75/915297275.db2.gz DBHCKPDRLCOFBC-NRFANRHFSA-N 0 3 407.514 4.353 20 0 HIADHN COc1cc(CCC2CCN(Cc3cnn(CC(F)(F)F)c3)CC2)cc(OC)c1 ZINC000506635971 915305309 /nfs/dbraw/zinc/30/53/09/915305309.db2.gz YYWLBOFHHKPIMX-UHFFFAOYSA-N 0 3 411.468 4.307 20 0 HIADHN Cn1cc(CN2CCN(C3c4ccccc4-c4ccccc43)CC2)c(-c2cccnc2)n1 ZINC000506652978 915324924 /nfs/dbraw/zinc/32/49/24/915324924.db2.gz IQVHBJQRIGMDQP-UHFFFAOYSA-N 0 3 421.548 4.370 20 0 HIADHN CC[C@H](N[C@@H](C)C(=O)NC12CC3CC(CC(C3)C1)C2)c1ccc(OC)c(OC)c1 ZINC000506662093 915336717 /nfs/dbraw/zinc/33/67/17/915336717.db2.gz KWMTWDUKFJQKSW-HNVJMHORSA-N 0 3 400.563 4.218 20 0 HIADHN COc1cccc(C[C@H](NCc2csc(CNC(=O)c3ccccc3)n2)C2CC2)c1 ZINC000513404715 921772992 /nfs/dbraw/zinc/77/29/92/921772992.db2.gz OCFXODBIWZKFJG-QFIPXVFZSA-N 0 3 421.566 4.193 20 0 HIADHN CCN(Cc1ccc(OCc2ccncc2)c(OC)c1)C[C@@H]1COc2ccccc2O1 ZINC000506806126 915554789 /nfs/dbraw/zinc/55/47/89/915554789.db2.gz PDFMACYAXSGBJV-OAQYLSRUSA-N 0 3 420.509 4.331 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2ccc(F)cc2OCC(F)(F)F)N(C)C)cc1 ZINC000506899295 915696478 /nfs/dbraw/zinc/69/64/78/915696478.db2.gz OBEKJKQSUFWJRL-KRWDZBQOSA-N 0 3 413.415 4.500 20 0 HIADHN CCOC(=O)c1c(C)csc1NC(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000506971892 915778113 /nfs/dbraw/zinc/77/81/13/915778113.db2.gz WNEKIVMHFHYNOG-UHFFFAOYSA-N 0 3 415.559 4.362 20 0 HIADHN CCCCNC(=O)C1CCN(Cc2cn(-c3ccccc3)nc2-c2ccncc2)CC1 ZINC000507009060 915819049 /nfs/dbraw/zinc/81/90/49/915819049.db2.gz USIHXILADLQSQQ-UHFFFAOYSA-N 0 3 417.557 4.063 20 0 HIADHN CC1CCN([C@H](CNC(=O)c2cn(C)nc2-c2cccs2)c2cccs2)CC1 ZINC000507037314 915834493 /nfs/dbraw/zinc/83/44/93/915834493.db2.gz RTGNWSGWUDJSQU-QGZVFWFLSA-N 0 3 414.600 4.413 20 0 HIADHN O=C(CSc1nc2ccccc2o1)N1CCCN(CCCc2ccccc2)CC1 ZINC000507097156 915867582 /nfs/dbraw/zinc/86/75/82/915867582.db2.gz NLWGIURWWWELMJ-UHFFFAOYSA-N 0 3 409.555 4.087 20 0 HIADHN Cc1ccc(CNC(=O)C2CCN(Cc3cnc(-c4ccccc4)[nH]3)CC2)cc1F ZINC000507142466 915887390 /nfs/dbraw/zinc/88/73/90/915887390.db2.gz JKCRIWXJPDCLAZ-UHFFFAOYSA-N 0 3 406.505 4.053 20 0 HIADHN C[C@H]1C[C@H]1C(=O)Nc1ccc(C(=O)N2CCCN(CCCc3ccccc3)CC2)cc1 ZINC000507147656 915890225 /nfs/dbraw/zinc/89/02/25/915890225.db2.gz CPUKZIZHAIASBD-GBXCKJPGSA-N 0 3 419.569 4.062 20 0 HIADHN O=C(c1cccc(OC[C@@H]2CCCO2)c1)N1CCCN(CCCc2ccccc2)CC1 ZINC000507147992 915890427 /nfs/dbraw/zinc/89/04/27/915890427.db2.gz FMZIKAUEQHMLJU-VWLOTQADSA-N 0 3 422.569 4.025 20 0 HIADHN CC(C)c1noc2ncc(C(=O)N3CCCN(CCCc4ccccc4)CC3)cc21 ZINC000507154093 915894721 /nfs/dbraw/zinc/89/47/21/915894721.db2.gz AAANCEBQNSPWBN-UHFFFAOYSA-N 0 3 406.530 4.127 20 0 HIADHN CCOCCCNC(=O)C1CCN(Cc2ccc(-c3ccc(F)cc3C)o2)CC1 ZINC000507156853 915896105 /nfs/dbraw/zinc/89/61/05/915896105.db2.gz VLNSKONNZDSDRW-UHFFFAOYSA-N 0 3 402.510 4.149 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N2CCO[C@@H](c3ccccc3Cl)C2)C1 ZINC000507343422 916097725 /nfs/dbraw/zinc/09/77/25/916097725.db2.gz XBLHBWFCFIPJAA-SFGWALBWSA-N 0 3 413.949 4.258 20 0 HIADHN Cc1cccc(-c2nn(-c3ccc(F)cc3)cc2C(=O)N(C)C2CCN(C)CC2)c1 ZINC000507370142 916124871 /nfs/dbraw/zinc/12/48/71/916124871.db2.gz HKAIIFNMESBBOQ-UHFFFAOYSA-N 0 3 406.505 4.153 20 0 HIADHN COC1CCN(C(C)(C)CNC(=O)c2cc3cc(Br)cc(C)c3o2)CC1 ZINC000507401494 916166537 /nfs/dbraw/zinc/16/65/37/916166537.db2.gz IVIVCEPYKISFSN-UHFFFAOYSA-N 0 3 423.351 4.123 20 0 HIADHN COCCSc1ccc([C@H](C)N[C@H](C)C(=O)Nc2cccc(NC(C)=O)c2)cc1 ZINC000507451861 916222575 /nfs/dbraw/zinc/22/25/75/916222575.db2.gz SBGRLLRJQBWTTH-JKSUJKDBSA-N 0 3 415.559 4.061 20 0 HIADHN Cc1nc(-c2ccc(Br)cc2)sc1[C@@H](C)N[C@H]1CCCCNC1=O ZINC000507482353 916249539 /nfs/dbraw/zinc/24/95/39/916249539.db2.gz QSALJHKDWHHCFY-ABAIWWIYSA-N 0 3 408.365 4.200 20 0 HIADHN COc1cc(NC2CCN(CCC(F)(F)F)CC2)cc(OC)c1Br ZINC000507525582 916284758 /nfs/dbraw/zinc/28/47/58/916284758.db2.gz KVKPCAALULREPX-UHFFFAOYSA-N 0 3 411.262 4.295 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)Cc3c(F)cccc3F)c(OCC)c2)CC1 ZINC000507592619 916346283 /nfs/dbraw/zinc/34/62/83/916346283.db2.gz FQTSDNQGLMXNAT-UHFFFAOYSA-N 0 3 417.500 4.077 20 0 HIADHN Cc1sc(Br)c(C(=O)NCCCN2CCc3ccccc3C2)c1C ZINC000507601796 916357031 /nfs/dbraw/zinc/35/70/31/916357031.db2.gz SAQCDVGZKIKYOK-UHFFFAOYSA-N 0 3 407.377 4.306 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)c2nn(-c3ccc(F)cc3)c3c2CCC3)C1 ZINC000507606396 916362410 /nfs/dbraw/zinc/36/24/10/916362410.db2.gz POMNNYZXUPNLCW-PXNSSMCTSA-N 0 3 418.516 4.065 20 0 HIADHN CCCc1c(C(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)cnn1Cc1ccccc1 ZINC000507615232 916373469 /nfs/dbraw/zinc/37/34/69/916373469.db2.gz YAZUIOVFHTVKDS-REWPJTCUSA-N 0 3 416.569 4.449 20 0 HIADHN C[C@H](N[C@H]1CCc2nnc(-c3ccc(F)cc3)n2C1)c1ccc(F)cc1OC(F)F ZINC000507624574 916384248 /nfs/dbraw/zinc/38/42/48/916384248.db2.gz ZUEPXIWPPJIGJS-LRDDRELGSA-N 0 3 420.410 4.490 20 0 HIADHN CC[C@@H]1C[C@@H](CN2CCN(Cc3csc(-c4ccc(F)cc4)n3)CC2)CCO1 ZINC000507802837 916586610 /nfs/dbraw/zinc/58/66/10/916586610.db2.gz IMBMEEKXOQOCMU-LAUBAEHRSA-N 0 3 403.567 4.272 20 0 HIADHN COc1cc(CN[C@H]2CC(=O)N(C)[C@@H]2c2ccc(Cl)cc2)cc(Cl)c1OC ZINC000507848150 916666367 /nfs/dbraw/zinc/66/63/67/916666367.db2.gz SANMRTMRCUFYDL-QFBILLFUSA-N 0 3 409.313 4.072 20 0 HIADHN CC(C)(C)n1cc(CNCc2ccccc2-c2ccc(Cn3cncn3)cc2)cn1 ZINC000507854850 916680845 /nfs/dbraw/zinc/68/08/45/916680845.db2.gz HYFPFHQVYIFFEV-UHFFFAOYSA-N 0 3 400.530 4.235 20 0 HIADHN CC(C)COc1cccc(OCC(=O)NC[C@@H](c2cccs2)N2CCCC2)c1 ZINC000507914810 916792927 /nfs/dbraw/zinc/79/29/27/916792927.db2.gz QOJXLHMJQPBNME-FQEVSTJZSA-N 0 3 402.560 4.115 20 0 HIADHN Cc1ccc(NC(=O)[C@@H]2CCCN(Cc3c[nH]nc3-c3ccc(Cl)cc3)C2)nc1 ZINC000507995486 916837031 /nfs/dbraw/zinc/83/70/31/916837031.db2.gz SUVGQJZIELWKSJ-QGZVFWFLSA-N 0 3 409.921 4.284 20 0 HIADHN Cc1ccc(NC(=O)[C@H]2CCCN(Cc3c[nH]nc3-c3ccc(Cl)cc3)C2)nc1 ZINC000507995485 916837267 /nfs/dbraw/zinc/83/72/67/916837267.db2.gz SUVGQJZIELWKSJ-KRWDZBQOSA-N 0 3 409.921 4.284 20 0 HIADHN COC(=O)c1cccc(-c2noc([C@@H]3CN(Cc4ccccc4)CCC3(F)F)n2)c1 ZINC000508023610 916858795 /nfs/dbraw/zinc/85/87/95/916858795.db2.gz YMAFUQOCEJFZFX-SFHVURJKSA-N 0 3 413.424 4.148 20 0 HIADHN Brc1ccc(-c2ccc(CN3CCN(C4CCOCC4)CC3)s2)cc1 ZINC000508026819 916861579 /nfs/dbraw/zinc/86/15/79/916861579.db2.gz OCASGYLQISEANG-UHFFFAOYSA-N 0 3 421.404 4.474 20 0 HIADHN O=C(COc1cc(Cl)ccc1Cl)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000508052894 916878550 /nfs/dbraw/zinc/87/85/50/916878550.db2.gz HYEDPCQXFUJJED-UHFFFAOYSA-N 0 3 423.340 4.215 20 0 HIADHN COc1ccc(NC(=O)[C@@H](C)N2[C@H](C)CC[C@@H]2C)cc1NC(=O)c1cccc(F)c1 ZINC000508203204 917022019 /nfs/dbraw/zinc/02/20/19/917022019.db2.gz CCEVUVODXBAGJW-OWCLPIDISA-N 0 3 413.493 4.286 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)N1CCC[C@@H]1/C=C\c1ccccc1 ZINC000508296484 917106045 /nfs/dbraw/zinc/10/60/45/917106045.db2.gz DBCILZRICARHPZ-JPFBCYGGSA-N 0 3 419.569 4.031 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)[C@@H](C)Cc2cncc3ccccc32)c1 ZINC000508467931 917253550 /nfs/dbraw/zinc/25/35/50/917253550.db2.gz KBZCOWCNKSLFEB-IBGZPJMESA-N 0 3 405.542 4.012 20 0 HIADHN CCSc1ccc([C@H](C)NC(=O)N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)cc1 ZINC000508580398 917351145 /nfs/dbraw/zinc/35/11/45/917351145.db2.gz FZRLYRSPUYDHCA-OTWHNJEPSA-N 0 3 419.635 4.390 20 0 HIADHN CN(C(=O)NCCCc1c[nH]c2ccc(F)cc12)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000508618681 917386789 /nfs/dbraw/zinc/38/67/89/917386789.db2.gz CSPPTFHSJJMKTJ-OAQYLSRUSA-N 0 3 408.521 4.156 20 0 HIADHN Clc1ccc([C@@H](Cc2cccnc2)NCc2ccccc2Cn2cncn2)cc1 ZINC000508725157 917485921 /nfs/dbraw/zinc/48/59/21/917485921.db2.gz XKJHMQRSJQFYPD-HSZRJFAPSA-N 0 3 403.917 4.448 20 0 HIADHN Brc1ccc2c(c1)[C@@H](NCc1ccccc1Cn1cncn1)CCS2 ZINC000508735127 917494985 /nfs/dbraw/zinc/49/49/85/917494985.db2.gz UQBKIYHNILFLHE-SFHVURJKSA-N 0 3 415.360 4.416 20 0 HIADHN COc1ccc(C)cc1CCNC(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000508772072 917525902 /nfs/dbraw/zinc/52/59/02/917525902.db2.gz VCAKOKPYTFGIGH-JOCHJYFZSA-N 0 3 420.475 4.117 20 0 HIADHN C[C@H](NC(=O)N1CCC(OC2CCC(C)CC2)CC1)[C@@H](c1ccccc1)N(C)C ZINC000508850587 917602529 /nfs/dbraw/zinc/60/25/29/917602529.db2.gz FRCSQSBBEDCFLS-PXRUNISOSA-N 0 3 401.595 4.447 20 0 HIADHN C[C@H](NC(=O)Nc1ccccc1OC[C@@H]1CCCCO1)[C@H](c1ccccc1)N(C)C ZINC000508853425 917605901 /nfs/dbraw/zinc/60/59/01/917605901.db2.gz RBTATUVYYUEMLH-GREBRCKQSA-N 0 3 411.546 4.447 20 0 HIADHN C[C@H](NC(=O)N1CCC(c2ncccc2Cl)CC1)[C@H](c1ccccc1)N(C)C ZINC000508875210 917628657 /nfs/dbraw/zinc/62/86/57/917628657.db2.gz BQRJJOMQUYELLU-HRAATJIYSA-N 0 3 400.954 4.315 20 0 HIADHN Cc1cccc(NC(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)c1C(=O)N1CCCC1 ZINC000508889927 917644382 /nfs/dbraw/zinc/64/43/82/917644382.db2.gz DXBANKRTIPTNEP-PGRDOPGGSA-N 0 3 408.546 4.044 20 0 HIADHN C[C@H](NC(=O)N1CCC2(CC1)OCCc1ccsc12)[C@@H](c1ccccc1)N(C)C ZINC000508891081 917645532 /nfs/dbraw/zinc/64/55/32/917645532.db2.gz GIWWMCUXSYHSOQ-PXNSSMCTSA-N 0 3 413.587 4.013 20 0 HIADHN COCCOc1ccc(NC(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)cc1Cl ZINC000508893040 917647360 /nfs/dbraw/zinc/64/73/60/917647360.db2.gz DLOZARSFGLWYEJ-YWZLYKJASA-N 0 3 405.926 4.178 20 0 HIADHN C[C@H](NC(=O)N(C)Cc1ccccc1Br)[C@H](c1ccccc1)N(C)C ZINC000508898520 917655041 /nfs/dbraw/zinc/65/50/41/917655041.db2.gz LQVZAZCQWBIKCW-HNAYVOBHSA-N 0 3 404.352 4.282 20 0 HIADHN C[C@H](NC(=O)N1CCO[C@@H](c2ccc(F)cc2Cl)C1)[C@@H](c1ccccc1)N(C)C ZINC000508907773 917663854 /nfs/dbraw/zinc/66/38/54/917663854.db2.gz QZGYLSWZVFKGCF-RVHYNSKXSA-N 0 3 419.928 4.253 20 0 HIADHN C[C@@H](NC(=O)N1CCC(C(F)(F)F)(C(F)(F)F)C1)[C@H](c1ccccc1)N(C)C ZINC000508909052 917665355 /nfs/dbraw/zinc/66/53/55/917665355.db2.gz UHPZSEOUTBOSDI-TZMCWYRMSA-N 0 3 411.390 4.204 20 0 HIADHN C[C@H]1CCN(C(=O)c2cn3cc(Cl)cc(Cl)c3n2)CCN1Cc1ccccc1 ZINC000508986645 917740210 /nfs/dbraw/zinc/74/02/10/917740210.db2.gz UPBHXSOVNRDVCU-HNNXBMFYSA-N 0 3 417.340 4.378 20 0 HIADHN CN(Cc1nc2cc(Br)ccc2o1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000509007732 917761713 /nfs/dbraw/zinc/76/17/13/917761713.db2.gz JNVWTZISZVUYFS-KRWDZBQOSA-N 0 3 400.320 4.297 20 0 HIADHN O=C(N[C@H]1CCCOc2ccccc21)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000509063222 917811237 /nfs/dbraw/zinc/81/12/37/917811237.db2.gz LRNOTCFGVWYJEY-PMACEKPBSA-N 0 3 400.469 4.174 20 0 HIADHN CN(C)[C@@H](CNC(=O)c1cccc(NC(=O)c2ccc(F)cc2)c1)c1ccccc1 ZINC000509094575 917835926 /nfs/dbraw/zinc/83/59/26/917835926.db2.gz BONZJGFRIZGWDO-QFIPXVFZSA-N 0 3 405.473 4.111 20 0 HIADHN CN(C)[C@H](CNC(=O)c1cccc(NC(=O)C2CCCCC2)c1)Cc1ccccc1 ZINC000509098149 917838584 /nfs/dbraw/zinc/83/85/84/917838584.db2.gz QADLJEXEFFLGOD-QHCPKHFHSA-N 0 3 407.558 4.108 20 0 HIADHN CN(Cc1ccc(OC[C@H]2CCCO2)cc1)[C@@H](CO)c1cccc(Br)c1 ZINC000509100467 917839933 /nfs/dbraw/zinc/83/99/33/917839933.db2.gz ZLVWTQUNYBPFOB-RTWAWAEBSA-N 0 3 420.347 4.172 20 0 HIADHN CCc1cc(C(=O)NC2CCN(Cc3ccccc3)CC2)c2c(n1)onc2C(C)C ZINC000509131014 917861131 /nfs/dbraw/zinc/86/11/31/917861131.db2.gz DIUNIAWBQBEIEY-UHFFFAOYSA-N 0 3 406.530 4.303 20 0 HIADHN CCCOc1ccc(CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)cc1OC ZINC000509354790 918019608 /nfs/dbraw/zinc/01/96/08/918019608.db2.gz BPLJXDMQNCKGBS-UHFFFAOYSA-N 0 3 417.937 4.383 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N1CCO[C@@H](c2ccccc2Cl)C1 ZINC000509365743 918029891 /nfs/dbraw/zinc/02/98/91/918029891.db2.gz LIDFKHBDZYVMSW-RTBURBONSA-N 0 3 419.978 4.322 20 0 HIADHN Cc1noc([C@H]2CCCN(Cc3cn(-c4ccccc4)nc3-c3ccncc3)C2)n1 ZINC000509365438 918030445 /nfs/dbraw/zinc/03/04/45/918030445.db2.gz JZNHDHZWTVHFSO-IBGZPJMESA-N 0 3 400.486 4.005 20 0 HIADHN Cc1nn(C(C)(C)C)c(C)c1CN1CCC[C@@H](C(=O)Nc2ccc(Cl)cn2)C1 ZINC000509391016 918055828 /nfs/dbraw/zinc/05/58/28/918055828.db2.gz XLVBBBYDECOFRH-MRXNPFEDSA-N 0 3 403.958 4.154 20 0 HIADHN COc1cccc(-c2c[nH]cc2C(=O)NCC(C)(C)N2CCc3ccccc3C2)c1 ZINC000509396616 918063013 /nfs/dbraw/zinc/06/30/13/918063013.db2.gz LEQFVBLQWNDBJT-UHFFFAOYSA-N 0 3 403.526 4.257 20 0 HIADHN Cn1cc(-c2ccc(CN[C@@H]3CCCN(c4ccccc4Cl)C3=O)s2)cn1 ZINC000509463612 918112774 /nfs/dbraw/zinc/11/27/74/918112774.db2.gz LZLPJVSOEUYQPV-QGZVFWFLSA-N 0 3 400.935 4.087 20 0 HIADHN CSc1cccc(N(C(=O)c2coc(C3CCOCC3)n2)C2CCN(C)CC2)c1 ZINC000509486101 918131884 /nfs/dbraw/zinc/13/18/84/918131884.db2.gz LBDKFYRGRGZXOS-UHFFFAOYSA-N 0 3 415.559 4.032 20 0 HIADHN CCCOc1ccc(CN2CCC(C(=O)N3CCC[C@@H](C)C3)CC2)cc1OCC ZINC000509533384 918180819 /nfs/dbraw/zinc/18/08/19/918180819.db2.gz QVMNRYNLZXLNOE-LJQANCHMSA-N 0 3 402.579 4.345 20 0 HIADHN Cn1cc(-c2ccc(CNCc3ccc(OCCOc4ccccc4)nc3)s2)cn1 ZINC000509533301 918181497 /nfs/dbraw/zinc/18/14/97/918181497.db2.gz QGJOVTMPXPKJQI-UHFFFAOYSA-N 0 3 420.538 4.291 20 0 HIADHN Cc1nn(CC(=O)OC(C)C)c(C)c1CN1CC=C(c2c[nH]c3cc(F)ccc32)CC1 ZINC000509537589 918186394 /nfs/dbraw/zinc/18/63/94/918186394.db2.gz CZBYSURVNMYLDR-UHFFFAOYSA-N 0 3 424.520 4.361 20 0 HIADHN C[C@@H]1CCCN(C(=O)C2CCN(Cc3c[nH]nc3-c3cccc(Cl)c3)CC2)C1 ZINC000509542884 918191034 /nfs/dbraw/zinc/19/10/34/918191034.db2.gz NUEFTGIOAVVUHH-MRXNPFEDSA-N 0 3 400.954 4.201 20 0 HIADHN CCOc1cc(CN2CCC(C(=O)N(C)C(C)C)CC2)ccc1OCC(F)(F)F ZINC000509554357 918204083 /nfs/dbraw/zinc/20/40/83/918204083.db2.gz GMTKXZBZSVREQF-UHFFFAOYSA-N 0 3 416.484 4.105 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)N1CCC(c2c[nH]c3ncccc23)CC1)c1ccco1 ZINC000509568446 918217118 /nfs/dbraw/zinc/21/71/18/918217118.db2.gz LJYKROVZRDRMBY-OXQOHEQNSA-N 0 3 409.534 4.174 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)N(C)Cc1nc(C(F)(F)F)cs1)c1ccco1 ZINC000509569130 918219791 /nfs/dbraw/zinc/21/97/91/918219791.db2.gz NBHPLSLOHYJXKR-VXGBXAGGSA-N 0 3 404.458 4.026 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N[C@H]1c2ccccc2CC[C@H]1n1ccnc1)c1ccco1 ZINC000509569493 918219981 /nfs/dbraw/zinc/21/99/81/918219981.db2.gz NEHFWKYBBSQKIO-HWLQVEPHSA-N 0 3 421.545 4.133 20 0 HIADHN CC[C@@H](NC(=O)N(CCN(C)C)Cc1ccccc1F)c1ccc(OC)c(OC)c1 ZINC000509569134 918220284 /nfs/dbraw/zinc/22/02/84/918220284.db2.gz NBROHYPFMORABI-HXUWFJFHSA-N 0 3 417.525 4.067 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N1CCC[C@H]1c1ccc2c(c1)OCCO2)c1ccco1 ZINC000509571311 918221752 /nfs/dbraw/zinc/22/17/52/918221752.db2.gz RYSJCJBWEFKBDE-UHOSZYNNSA-N 0 3 413.518 4.027 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N1CCCCC[C@@H]1c1c(C)n[nH]c1C)c1ccco1 ZINC000509575327 918225425 /nfs/dbraw/zinc/22/54/25/918225425.db2.gz VPJQGERYRHSEMS-KFKAGJAMSA-N 0 3 401.555 4.376 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)N(C)Cc1ccccc1Br)c1ccco1 ZINC000509584441 918234062 /nfs/dbraw/zinc/23/40/62/918234062.db2.gz CKVGWDDNYGKOFP-RHSMWYFYSA-N 0 3 408.340 4.313 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N(CCCO)[C@H]1CCCc2ccccc21)c1ccco1 ZINC000509587091 918236531 /nfs/dbraw/zinc/23/65/31/918236531.db2.gz JFLCPPNZHHGVAL-BWAGFHJFSA-N 0 3 413.562 4.180 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N(Cc1cccc(F)c1)C[C@H]1CCCO1)c1ccco1 ZINC000509589140 918238799 /nfs/dbraw/zinc/23/87/99/918238799.db2.gz YNEXYZGQDBEYJZ-IOMROCGXSA-N 0 3 417.525 4.239 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N1CCC(OC2CCC(C)CC2)CC1)c1ccco1 ZINC000509592337 918240525 /nfs/dbraw/zinc/24/05/25/918240525.db2.gz ABTVTCGPAOBGKN-LQPXBXSXSA-N 0 3 405.583 4.478 20 0 HIADHN COc1ccccc1NC(=O)C1CCN(Cc2c[nH]nc2-c2cccc(C)c2)CC1 ZINC000509591677 918240707 /nfs/dbraw/zinc/24/07/07/918240707.db2.gz KGJYJSPFBQIAOQ-UHFFFAOYSA-N 0 3 404.514 4.244 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCO[C@@]2(CCc3ccccc32)C1)c1ccsc1 ZINC000509791052 918399163 /nfs/dbraw/zinc/39/91/63/918399163.db2.gz RWWTXIFAHJPDHU-GGAORHGYSA-N 0 3 413.587 4.015 20 0 HIADHN CC[C@@H](CNC(=O)N[C@H](COCC(C)C)c1ccco1)N1CCc2ccccc2C1 ZINC000509872064 918473837 /nfs/dbraw/zinc/47/38/37/918473837.db2.gz VVDLXJFHTFRXTI-FCHUYYIVSA-N 0 3 413.562 4.129 20 0 HIADHN CC[NH+](CC)[C@@H](CNC(=O)Nc1ccc(-c2cc(=O)[n-]c(C)n2)cc1)c1ccccc1 ZINC000509881999 918484096 /nfs/dbraw/zinc/48/40/96/918484096.db2.gz PMGAKZUHDBWEJE-QFIPXVFZSA-N 0 3 419.529 4.362 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)NC[C@H](C(C)C)[NH+]3CCCCCC3)cc2)cc(=O)[n-]1 ZINC000509891825 918494234 /nfs/dbraw/zinc/49/42/34/918494234.db2.gz XQHYVGQPRGRPNC-OAQYLSRUSA-N 0 3 411.550 4.180 20 0 HIADHN O=C(N[C@H]1C[C@H]1c1ccccc1C(F)(F)F)N1CCCN(Cc2ccccc2)CC1 ZINC000509900122 918502475 /nfs/dbraw/zinc/50/24/75/918502475.db2.gz GHIXNQPNDZKWBI-FPOVZHCZSA-N 0 3 417.475 4.479 20 0 HIADHN Cc1ccc(NC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)c2n[nH]cc21 ZINC000509926457 918525272 /nfs/dbraw/zinc/52/52/72/918525272.db2.gz QACRUJPFWGLDPI-FQEVSTJZSA-N 0 3 402.420 4.264 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)Nc3ccc4[nH]ccc4c3)CC2)c1 ZINC000509939443 918536693 /nfs/dbraw/zinc/53/66/93/918536693.db2.gz MMTQUNZCKLFLDD-UHFFFAOYSA-N 0 3 405.546 4.200 20 0 HIADHN Cc1cn(-c2ccc(F)cc2)nc1C(=O)NC[C@H]1CCCN(C)[C@H]1c1cccs1 ZINC000509977039 918566495 /nfs/dbraw/zinc/56/64/95/918566495.db2.gz KGIOJUBSWWKPCU-IIBYNOLFSA-N 0 3 412.534 4.194 20 0 HIADHN O=C(Cc1c[nH]c2cccc(Cl)c12)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000509981885 918568714 /nfs/dbraw/zinc/56/87/14/918568714.db2.gz JJNCPGCCXCQKJF-UHFFFAOYSA-N 0 3 413.871 4.285 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1cccc(F)c1Br ZINC000509982937 918570781 /nfs/dbraw/zinc/57/07/81/918570781.db2.gz OKGDWUPHNOFWMV-UHFFFAOYSA-N 0 3 423.248 4.123 20 0 HIADHN O=C(Nc1ccccc1)N1CC[C@H](NCc2ccccc2OCc2ccncc2)C1 ZINC000510004936 918587226 /nfs/dbraw/zinc/58/72/26/918587226.db2.gz LCJKEUNEVLCPLI-QFIPXVFZSA-N 0 3 402.498 4.057 20 0 HIADHN Cc1cccc(C)c1NC(=O)CNC(=O)[C@@H](C)N1CCC[C@@](C)(c2ccccc2)CC1 ZINC000510077126 918645815 /nfs/dbraw/zinc/64/58/15/918645815.db2.gz AYFHESBYAHOKMM-QFQXNSOFSA-N 0 3 421.585 4.190 20 0 HIADHN CCN(Cc1c(F)cccc1F)C(=O)Nc1ccc(N2CCN(CC)CC2)cc1C ZINC000510090680 918656003 /nfs/dbraw/zinc/65/60/03/918656003.db2.gz XMAZUBUUAZKNED-UHFFFAOYSA-N 0 3 416.516 4.469 20 0 HIADHN CN(Cc1c[nH]nc1-c1ccccc1F)C[C@H](O)COc1ccc(C(F)(F)F)cc1 ZINC000510192881 918741408 /nfs/dbraw/zinc/74/14/08/918741408.db2.gz OQLQPHBXPMBRPD-INIZCTEOSA-N 0 3 423.410 4.106 20 0 HIADHN CN(C)C[C@@H](NC(=O)c1ccc(-c2noc(C(F)F)n2)cc1)c1ccc(Cl)cc1 ZINC000510294364 918812926 /nfs/dbraw/zinc/81/29/26/918812926.db2.gz GZKZHNFYOXYGFZ-MRXNPFEDSA-N 0 3 420.847 4.360 20 0 HIADHN CCN(CC)C(=O)Cc1ccc(NC(=O)c2oc3ccccc3c2CN(C)C)cc1 ZINC000510299633 918816271 /nfs/dbraw/zinc/81/62/71/918816271.db2.gz QZAQWDWCFQEGBO-UHFFFAOYSA-N 0 3 407.514 4.158 20 0 HIADHN O=C(N[C@@H](CC(F)(F)F)c1ccc(F)cc1)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000510385811 918865971 /nfs/dbraw/zinc/86/59/71/918865971.db2.gz DJXNAPOGEPYMJF-MOPGFXCFSA-N 0 3 409.427 4.393 20 0 HIADHN Cc1nccn1-c1ccc(CNC(=O)c2oc3ccccc3c2CN(C)C)cc1F ZINC000510389400 918868052 /nfs/dbraw/zinc/86/80/52/918868052.db2.gz PZYXTFGVHHOZCC-UHFFFAOYSA-N 0 3 406.461 4.058 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3ccc4[nH]c(-c5ccco5)nc4c3)cc2)CC1 ZINC000510401788 918874470 /nfs/dbraw/zinc/87/44/70/918874470.db2.gz KDBXIPNPBWPJDR-UHFFFAOYSA-N 0 3 415.497 4.217 20 0 HIADHN O[C@H](COc1cc(Cl)ccc1Cl)CN1CC[C@H](n2ncc3ccccc32)C1 ZINC000510403960 918877107 /nfs/dbraw/zinc/87/71/07/918877107.db2.gz XXBVFEMTUJPLMA-IRXDYDNUSA-N 0 3 406.313 4.030 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(C)c1CN1CCC(C(=O)N2CCC(C)CC2)CC1 ZINC000510422485 918887115 /nfs/dbraw/zinc/88/71/15/918887115.db2.gz WFCVZPZDNNSFQH-UHFFFAOYSA-N 0 3 412.553 4.099 20 0 HIADHN C[C@H](c1ncc(-c2ccc(Cl)cc2Cl)o1)N1CC[C@@H](CN2CCOCC2)C1 ZINC000510431573 918894036 /nfs/dbraw/zinc/89/40/36/918894036.db2.gz WVISGHQUBCSHKR-CABCVRRESA-N 0 3 410.345 4.364 20 0 HIADHN C[C@@H](c1ncc(-c2ccc(Cl)cc2Cl)o1)N1CC[C@H](CN2CCOCC2)C1 ZINC000510431576 918894114 /nfs/dbraw/zinc/89/41/14/918894114.db2.gz WVISGHQUBCSHKR-LSDHHAIUSA-N 0 3 410.345 4.364 20 0 HIADHN Cc1n[nH]c(C)c1[C@H]1CCCCCN1C(=O)NCCCN1CCc2ccccc2C1 ZINC000510476316 918930247 /nfs/dbraw/zinc/93/02/47/918930247.db2.gz DDWTYSVBBJTHPX-JOCHJYFZSA-N 0 3 409.578 4.102 20 0 HIADHN O=C(Nc1cccc(Cl)c1-n1cccn1)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000510480686 918933340 /nfs/dbraw/zinc/93/33/40/918933340.db2.gz UGONCWKXEJMKRT-FQEVSTJZSA-N 0 3 409.921 4.484 20 0 HIADHN Cc1n[nH]c(C)c1[C@H]1CCCCCN1C(=O)NCC(C)(C)N1CCc2ccccc2C1 ZINC000510488887 918938619 /nfs/dbraw/zinc/93/86/19/918938619.db2.gz IPQPUANCQBHRTM-JOCHJYFZSA-N 0 3 423.605 4.490 20 0 HIADHN O=C(CC1CCN(Cc2cc3ccccc3nc2N2CCCCC2)CC1)N1CCCC1 ZINC000510500049 918949232 /nfs/dbraw/zinc/94/92/32/918949232.db2.gz BYWCYBPHRRJWNT-UHFFFAOYSA-N 0 3 420.601 4.450 20 0 HIADHN COc1ccc(CN(C)CCCc2cc(-c3ccc(F)cc3)n[nH]2)c(OC)c1OC ZINC000510504510 918953052 /nfs/dbraw/zinc/95/30/52/918953052.db2.gz ZICYZWAMWBVCSP-UHFFFAOYSA-N 0 3 413.493 4.306 20 0 HIADHN C[C@@H](NC(=O)N[C@H](c1ccc(Br)cc1)C1CCC1)C1=CCN(C)CC1 ZINC000510518756 918964422 /nfs/dbraw/zinc/96/44/22/918964422.db2.gz BIUHDRHOJQDDNW-KUHUBIRLSA-N 0 3 406.368 4.240 20 0 HIADHN CN(C)[C@H](CNC(=O)Nc1ccc(C(=O)NC2CCCCC2)cc1)Cc1ccccc1 ZINC000510522446 918967831 /nfs/dbraw/zinc/96/78/31/918967831.db2.gz HWCVCMCARMAEIM-QHCPKHFHSA-N 0 3 422.573 4.044 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)Nc1ccc(OC[C@H]2CCCO2)cc1 ZINC000510563822 919006288 /nfs/dbraw/zinc/00/62/88/919006288.db2.gz CPHBWOBLRMGKSU-UXHICEINSA-N 0 3 415.559 4.265 20 0 HIADHN COc1ccc(C[C@H](NCc2ccc3c(c2)oc(=O)n3C)c2ccccc2)cc1OC ZINC000510626903 919069501 /nfs/dbraw/zinc/06/95/01/919069501.db2.gz BBIFMUIPSFLXHT-FQEVSTJZSA-N 0 3 418.493 4.222 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1ccc(C(=O)NCC(C)C)cc1)c1ccsc1 ZINC000510678376 919117991 /nfs/dbraw/zinc/11/79/91/919117991.db2.gz CRHFQQGVUZGHCQ-HXUWFJFHSA-N 0 3 416.591 4.339 20 0 HIADHN CC(C)[C@@H]([NH2+][C@@H](C)CCc1ccc(C(F)(F)F)cc1)c1nc(-c2nc[n-]n2)no1 ZINC000510680846 919119272 /nfs/dbraw/zinc/11/92/72/919119272.db2.gz JFPUCIGHTNDHKS-SWLSCSKDSA-N 0 3 408.428 4.182 20 0 HIADHN Cc1cccc([C@@H](NCc2ccc(N3CCN(C)CC3)nc2)c2cccc(F)c2)c1 ZINC000510683490 919123156 /nfs/dbraw/zinc/12/31/56/919123156.db2.gz GMECTHKSTGGWQM-RUZDIDTESA-N 0 3 404.533 4.160 20 0 HIADHN CC(C)(CNC(=O)Nc1ccc(OC(F)F)c(F)c1)N1CCc2ccccc2C1 ZINC000510687360 919125796 /nfs/dbraw/zinc/12/57/96/919125796.db2.gz WJJDTQNIUTYWSJ-UHFFFAOYSA-N 0 3 407.436 4.386 20 0 HIADHN COC(=O)CCCOc1ccc(NC(=O)c2oc3ccccc3c2CN(C)C)cc1 ZINC000510712071 919151395 /nfs/dbraw/zinc/15/13/95/919151395.db2.gz DJOAIGROXDSYIN-UHFFFAOYSA-N 0 3 410.470 4.079 20 0 HIADHN Cc1ncsc1CCN(C)Cc1cccc(Br)c1OCC(C)(C)O ZINC000510767020 919221586 /nfs/dbraw/zinc/22/15/86/919221586.db2.gz VMJWPLAYBXVQTP-UHFFFAOYSA-N 0 3 413.381 4.038 20 0 HIADHN OC[C@]1(Cc2ccccc2)CCCN1Cc1nc2cc(Br)ccc2o1 ZINC000510781948 919244705 /nfs/dbraw/zinc/24/47/05/919244705.db2.gz PTNRAZWSEARPOR-HXUWFJFHSA-N 0 3 401.304 4.160 20 0 HIADHN C[C@@H](C(=O)Nc1ccc(CC(=O)N2CCc3ccccc32)cc1)N1CCCCCC1 ZINC000510799301 919269466 /nfs/dbraw/zinc/26/94/66/919269466.db2.gz NQCFMPNPCDJQCV-IBGZPJMESA-N 0 3 405.542 4.021 20 0 HIADHN COc1ccccc1CCN(C)C(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1 ZINC000510827673 919307310 /nfs/dbraw/zinc/30/73/10/919307310.db2.gz PLVKCYXUBTWPHS-FQEVSTJZSA-N 0 3 415.603 4.414 20 0 HIADHN CC(C)CN(C(=O)C1CCN(c2nc3ccccc3s2)CC1)C1CCN(C)CC1 ZINC000511029964 919609716 /nfs/dbraw/zinc/60/97/16/919609716.db2.gz MSFGFAVSAGQVES-UHFFFAOYSA-N 0 3 414.619 4.092 20 0 HIADHN COc1cccc(OC)c1OC[C@@H](O)CN1CCC([C@H](F)c2ccccc2F)CC1 ZINC000511090285 919692791 /nfs/dbraw/zinc/69/27/91/919692791.db2.gz MLJONZFDFOAIJQ-JTSKRJEESA-N 0 3 421.484 4.005 20 0 HIADHN Cc1cc(Cl)ccc1CN1CCN(CC2CCN(C(=O)C(C)(C)C)CC2)CC1 ZINC000511094633 919699370 /nfs/dbraw/zinc/69/93/70/919699370.db2.gz YLZOEBUCMHKWQN-UHFFFAOYSA-N 0 3 406.014 4.051 20 0 HIADHN C[C@@H]1CCCN(CCNC(=O)c2cccnc2Oc2ccc(Br)cc2)C1 ZINC000511157826 919777919 /nfs/dbraw/zinc/77/79/19/919777919.db2.gz DATGPNLVEBHGFU-OAHLLOKOSA-N 0 3 418.335 4.098 20 0 HIADHN C[C@H](NC(=O)NCc1cc(Cl)cc(Cl)c1OC(F)F)C1=CCN(C)CC1 ZINC000511251162 919853986 /nfs/dbraw/zinc/85/39/86/919853986.db2.gz SWKGGUDLYNLXGU-JTQLQIEISA-N 0 3 408.276 4.044 20 0 HIADHN C[C@H](NC(=O)N(C)[C@@H]1CCSc2ccc(Br)cc21)C1=CCN(C)CC1 ZINC000511254692 919856666 /nfs/dbraw/zinc/85/66/66/919856666.db2.gz ROUMRZCFEVJTMC-SUMWQHHRSA-N 0 3 424.408 4.278 20 0 HIADHN C[C@H](NC(=O)N[C@H](c1ccccc1)c1ccc2c(c1)CCCO2)C1=CCN(C)CC1 ZINC000511275019 919871273 /nfs/dbraw/zinc/87/12/73/919871273.db2.gz UCQQWTXWMNISCN-MHECFPHRSA-N 0 3 405.542 4.051 20 0 HIADHN COc1ccc(-c2nc(C)c([C@@H](C)NC(=O)N[C@@H](C)C3=CCN(C)CC3)s2)cc1 ZINC000511275461 919871379 /nfs/dbraw/zinc/87/13/79/919871379.db2.gz VXYQSACNSNJZNC-GOEBONIOSA-N 0 3 414.575 4.138 20 0 HIADHN Cc1ccc(-c2nnc(-c3ccc(C(=O)N[C@@H](C)C4=CCN(C)CC4)cc3)o2)cc1 ZINC000511344236 919934041 /nfs/dbraw/zinc/93/40/41/919934041.db2.gz NLNAIELTUASQNF-KRWDZBQOSA-N 0 3 402.498 4.092 20 0 HIADHN O=C(Cc1cn2cc(Cl)cc(Cl)c2n1)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000511391001 919998500 /nfs/dbraw/zinc/99/85/00/919998500.db2.gz NDDMZHLNDXIXLB-IBGZPJMESA-N 0 3 417.340 4.137 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N2CC[C@H](n3ncc4ccccc43)C2)N2CCCC2)cc1 ZINC000511417851 920031702 /nfs/dbraw/zinc/03/17/02/920031702.db2.gz JUXCNUAFYIRBGY-LADGPHEKSA-N 0 3 417.557 4.138 20 0 HIADHN CCN1CCC[C@@H](CN(C)C(=O)N[C@@H]2CCC[C@H]2c2ccccc2)[C@@H]1c1cnn(C)c1 ZINC000511505296 920121427 /nfs/dbraw/zinc/12/14/27/920121427.db2.gz JZHSQWAEKZYJRC-IQFVJIFQSA-N 0 3 423.605 4.171 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)c1cnn(C2CCCCC2)c1C ZINC000511541834 920168102 /nfs/dbraw/zinc/16/81/02/920168102.db2.gz QMJSXMRBFCNFIJ-JOCHJYFZSA-N 0 3 409.578 4.218 20 0 HIADHN CN(C)[C@@H](CNC(=O)Nc1ccc(C(=O)N2CCCCCC2)cc1)c1ccccc1 ZINC000511563595 920206108 /nfs/dbraw/zinc/20/61/08/920206108.db2.gz BZHBPZSUASNIFL-QFIPXVFZSA-N 0 3 408.546 4.127 20 0 HIADHN Cc1cc(C)n(-c2cccc(NC(=O)N(CCN(C)C)Cc3ccc(F)cc3)c2)n1 ZINC000511624063 920282568 /nfs/dbraw/zinc/28/25/68/920282568.db2.gz JCUAAYHAVFAGLC-UHFFFAOYSA-N 0 3 409.509 4.224 20 0 HIADHN O=C(CCN1CC[C@@H](C(F)(F)F)[C@@H](CO)C1)Nc1ccccc1Oc1ccccc1 ZINC000511640918 920304876 /nfs/dbraw/zinc/30/48/76/920304876.db2.gz PHAMDEDPQPYRCX-SJLPKXTDSA-N 0 3 422.447 4.300 20 0 HIADHN CSc1nccn1-c1ccc(C(=O)NC[C@H](c2cccs2)N2CCCC2)cc1 ZINC000511755119 920435297 /nfs/dbraw/zinc/43/52/97/920435297.db2.gz QJYCMQDUNAVMJQ-GOSISDBHSA-N 0 3 412.584 4.223 20 0 HIADHN CC(C)[C@H](NC(=O)CN1C[C@H](c2ccccc2)[C@@H]2COCC[C@H]21)c1ccc(F)cc1 ZINC000511758094 920438464 /nfs/dbraw/zinc/43/84/64/920438464.db2.gz QOMDLXAFROCTRQ-QENXHYHDSA-N 0 3 410.533 4.144 20 0 HIADHN O=C(CN1C[C@H](c2ccccc2)[C@@H]2COCC[C@@H]21)Nc1cccc(C(F)(F)F)c1 ZINC000511759061 920440723 /nfs/dbraw/zinc/44/07/23/920440723.db2.gz SSFYYKKIXAJRAZ-AABGKKOBSA-N 0 3 404.432 4.148 20 0 HIADHN O=C(NC1CCCCC1)NC1CCN(Cc2c[nH]nc2-c2ccc(Cl)cc2)CC1 ZINC000511761441 920442987 /nfs/dbraw/zinc/44/29/87/920442987.db2.gz JCJVAXNZFYKPLZ-UHFFFAOYSA-N 0 3 415.969 4.326 20 0 HIADHN O=C(Nc1ccccc1)NC1CCN(Cc2ccc(Oc3cnccn3)cc2)CC1 ZINC000511765689 920449120 /nfs/dbraw/zinc/44/91/20/920449120.db2.gz VFWXENZUHPQMKL-UHFFFAOYSA-N 0 3 403.486 4.055 20 0 HIADHN CN(C)Cc1ccc(C(=O)Nc2ccc(CC(=O)N(C)c3ccccc3)cc2)cc1 ZINC000511771780 920460804 /nfs/dbraw/zinc/46/08/04/920460804.db2.gz PEXPFDKJCYKKAA-UHFFFAOYSA-N 0 3 401.510 4.206 20 0 HIADHN Cn1c(CN2C[C@H](c3ccccc3)[C@H]3COCC[C@H]32)nnc1-c1ccc(Cl)cc1 ZINC000511775767 920464707 /nfs/dbraw/zinc/46/47/07/920464707.db2.gz SQKHBXNXZWYXAQ-NJDAHSKKSA-N 0 3 408.933 4.140 20 0 HIADHN CC(=O)c1c(C)[nH]c(C(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)c1C(C)C ZINC000511783480 920475778 /nfs/dbraw/zinc/47/57/78/920475778.db2.gz GTEIVXXSDOZMBY-IRXDYDNUSA-N 0 3 417.594 4.001 20 0 HIADHN O=c1[nH]c(CN2C[C@H](c3ccccc3)[C@H]3COCC[C@H]32)nc2c3ccccc3oc21 ZINC000511797606 920491222 /nfs/dbraw/zinc/49/12/22/920491222.db2.gz PAHYZARLGRDTIP-GUDVDZBRSA-N 0 3 401.466 4.086 20 0 HIADHN CCOC(=O)c1c(C)oc2nc(CN3C[C@H](c4ccccc4)[C@H]4CCC[C@@H]43)nc(N)c21 ZINC000511821781 920519103 /nfs/dbraw/zinc/51/91/03/920519103.db2.gz FTLUPCJGTAVHBA-KURKYZTESA-N 0 3 420.513 4.058 20 0 HIADHN Cc1cc([C@H](C)N[C@H]2CCCN(Cc3ccccn3)C2=O)sc1Br ZINC000511924663 920670488 /nfs/dbraw/zinc/67/04/88/920670488.db2.gz BDAGCJWHVHBOAP-ZFWWWQNUSA-N 0 3 408.365 4.056 20 0 HIADHN CCc1nn(C)cc1CN[C@H](C)CC(=O)Nc1cc(C(F)(F)F)ccc1Cl ZINC000511957975 920719928 /nfs/dbraw/zinc/71/99/28/920719928.db2.gz RHKWMZYSQQIWNL-LLVKDONJSA-N 0 3 402.848 4.162 20 0 HIADHN C[C@@H](CC(=O)Nc1cc(C(F)(F)F)ccc1Cl)NCC(=O)NC1CCCCC1 ZINC000512027053 920801254 /nfs/dbraw/zinc/80/12/54/920801254.db2.gz SSOIPNJGTIMNQJ-LBPRGKRZSA-N 0 3 419.875 4.114 20 0 HIADHN CNC(=O)[C@H](Cc1c[nH]c2ccccc12)N[C@@H](C)c1cc(C)c(Br)s1 ZINC000512068637 920835437 /nfs/dbraw/zinc/83/54/37/920835437.db2.gz SVDFCMLKWJYWCI-LRDDRELGSA-N 0 3 420.376 4.308 20 0 HIADHN O=C(N[C@@H]1CCN(Cc2ccccc2)C1)c1cc2ccc(OC(F)(F)F)cc2[nH]1 ZINC000512075329 920840909 /nfs/dbraw/zinc/84/09/09/920840909.db2.gz STHPQOQYRGTHLX-MRXNPFEDSA-N 0 3 403.404 4.071 20 0 HIADHN COc1cccc(OC)c1CNC[C@H]1CCN(c2cccc(Br)c2)C1 ZINC000512098888 920859510 /nfs/dbraw/zinc/85/95/10/920859510.db2.gz JEVRKEFYLYSWMJ-OAHLLOKOSA-N 0 3 405.336 4.082 20 0 HIADHN Cc1ccc(-c2nn(-c3ccc(F)cc3)cc2C(=O)N[C@@H](C)C2=CCN(C)CC2)cc1 ZINC000512120886 920872627 /nfs/dbraw/zinc/87/26/27/920872627.db2.gz CFDBTSMJDJTDRB-SFHVURJKSA-N 0 3 418.516 4.367 20 0 HIADHN CC(=O)Nc1cccc(OCCNCc2cnn(-c3ccc(C(F)(F)F)cc3)c2)c1 ZINC000512131445 920879158 /nfs/dbraw/zinc/87/91/58/920879158.db2.gz RHZRAIVFHDVCTF-UHFFFAOYSA-N 0 3 418.419 4.018 20 0 HIADHN Cc1cccc(-c2nn(-c3ccccc3)cc2C(=O)N[C@@H](C)C2=CCN(C)CC2)c1 ZINC000512139819 920886358 /nfs/dbraw/zinc/88/63/58/920886358.db2.gz TUYBXSXQOWKNSI-IBGZPJMESA-N 0 3 400.526 4.228 20 0 HIADHN CN(CCc1nc(-c2ccccc2)no1)Cc1cccc(C(=O)N2CCCCC2)c1 ZINC000512150069 920891887 /nfs/dbraw/zinc/89/18/87/920891887.db2.gz UFMUTWICSIHLJD-UHFFFAOYSA-N 0 3 404.514 4.037 20 0 HIADHN COc1ccc(C(=O)c2ccccc2C(=O)N2CC[C@H]3CC[C@@H](C2)N3C(C)C)cc1 ZINC000512160941 920898732 /nfs/dbraw/zinc/89/87/32/920898732.db2.gz SVTGHJWMOBUVHN-UXHICEINSA-N 0 3 406.526 4.014 20 0 HIADHN Cc1cccc(S(=O)(=O)CCCN[C@H](CCO)c2ccc(Cl)c(Cl)c2)c1 ZINC000512165013 920901000 /nfs/dbraw/zinc/90/10/00/920901000.db2.gz KMCYUWPMRYKLAG-LJQANCHMSA-N 0 3 416.370 4.179 20 0 HIADHN CN(CCc1nc(-c2ccccc2)no1)CCc1nc(-c2cccc(Cl)c2)no1 ZINC000512197042 920943475 /nfs/dbraw/zinc/94/34/75/920943475.db2.gz PVDPBGVBZBDAFY-UHFFFAOYSA-N 0 3 409.877 4.157 20 0 HIADHN CCN(CC)C(=O)C1CCN(Cc2cn(-c3ccccc3)nc2-c2cccnc2)CC1 ZINC000512219570 920968915 /nfs/dbraw/zinc/96/89/15/920968915.db2.gz OXLBGUZKYYYGIG-UHFFFAOYSA-N 0 3 417.557 4.015 20 0 HIADHN CC(C)(CN[C@H](C(=O)NCc1ccc2c(c1)OCO2)c1ccccc1)c1cccs1 ZINC000512246348 921003925 /nfs/dbraw/zinc/00/39/25/921003925.db2.gz YWUBIGNVWTVEHV-QFIPXVFZSA-N 0 3 422.550 4.402 20 0 HIADHN CCOCc1cc(CN2CCC(C(=O)N3CCc4ccccc43)CC2)ccc1OC ZINC000512299795 921054996 /nfs/dbraw/zinc/05/49/96/921054996.db2.gz OUTIALUKQNTLCG-UHFFFAOYSA-N 0 3 408.542 4.033 20 0 HIADHN FC(F)(F)[C@@]1(c2nc(-c3ccc4c(c3)CCO4)no2)CCN(Cc2ccccc2)C1 ZINC000512317492 921068442 /nfs/dbraw/zinc/06/84/42/921068442.db2.gz XPDSQWCMHRFANZ-NRFANRHFSA-N 0 3 415.415 4.378 20 0 HIADHN Brc1ccc(CN[C@H]2CCO[C@@H]2c2cccnc2)cc1Br ZINC000512359612 921102945 /nfs/dbraw/zinc/10/29/45/921102945.db2.gz JNDMDPCCMLANQC-JKSUJKDBSA-N 0 3 412.125 4.226 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)Nc1ccc(-c2cc(=O)[nH]c(C)n2)cc1)c1ccco1 ZINC000513497497 921846900 /nfs/dbraw/zinc/84/69/00/921846900.db2.gz XPVMKPIYHPRTOR-AUUYWEPGSA-N 0 3 409.490 4.002 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)Cc1csc(-c2cccs2)n1 ZINC000513504926 921854150 /nfs/dbraw/zinc/85/41/50/921854150.db2.gz GQXLAKONBGSXEP-UHFFFAOYSA-N 0 3 421.538 4.283 20 0 HIADHN Cc1noc(C)c1COc1ccccc1C(=O)NC[C@@H]1CCCN1Cc1ccccc1 ZINC000513564785 921898634 /nfs/dbraw/zinc/89/86/34/921898634.db2.gz AQFQGADEQVHWIJ-NRFANRHFSA-N 0 3 419.525 4.265 20 0 HIADHN COc1ccccc1[C@H]1CCN(C(=O)[C@H]2CN(Cc3ccccc3)CCC2(F)F)C1 ZINC000513596003 921926212 /nfs/dbraw/zinc/92/62/12/921926212.db2.gz VNLXOZJBWZPHHM-PZJWPPBQSA-N 0 3 414.496 4.169 20 0 HIADHN CC(C)(C)c1nn(-c2ccccc2)cc1CN1CCC[C@@H](c2nnc3n2CCC3)C1 ZINC000513643414 921967129 /nfs/dbraw/zinc/96/71/29/921967129.db2.gz UTCPUIPCKIFGEO-GOSISDBHSA-N 0 3 404.562 4.087 20 0 HIADHN Cc1nn(Cc2ccccc2Cl)c(C)c1CN1CCC[C@@H](c2nnc3n2CCC3)C1 ZINC000513654790 921975895 /nfs/dbraw/zinc/97/58/95/921975895.db2.gz JUOFVWXAIVMARO-LJQANCHMSA-N 0 3 424.980 4.119 20 0 HIADHN CC[C@H](NCc1ccc(S(=O)(=O)N(C)C)cc1)c1ccc(OC(F)(F)F)cc1 ZINC000513666121 921990487 /nfs/dbraw/zinc/99/04/87/921990487.db2.gz JYXDGTQPCFUCEN-SFHVURJKSA-N 0 3 416.465 4.076 20 0 HIADHN COc1ccc2[nH]cc(C3CCN([C@H](C)C(=O)NCCc4ccccc4C)CC3)c2c1 ZINC000513671679 921993243 /nfs/dbraw/zinc/99/32/43/921993243.db2.gz FHFKRWOVZLPXLH-LJQANCHMSA-N 0 3 419.569 4.412 20 0 HIADHN O=C1CCCN1C1CCN(Cc2ccc(OC(F)(F)[C@@H](F)C(F)(F)F)cc2)CC1 ZINC000513725093 922043901 /nfs/dbraw/zinc/04/39/01/922043901.db2.gz LSOSIHGNCWTCES-KRWDZBQOSA-N 0 3 424.385 4.145 20 0 HIADHN O=C1CCCN1C1CCN(Cc2ccc(-c3cccc(Br)c3)o2)CC1 ZINC000513726321 922046512 /nfs/dbraw/zinc/04/65/12/922046512.db2.gz YSLQLSHPQVGULA-UHFFFAOYSA-N 0 3 403.320 4.296 20 0 HIADHN C[C@H](NCc1ccc(CN2CCc3ccccc32)cc1)c1ccc2c(c1)OCC(=O)N2 ZINC000513758620 922078464 /nfs/dbraw/zinc/07/84/64/922078464.db2.gz AKBZDAWLKKYFLR-SFHVURJKSA-N 0 3 413.521 4.431 20 0 HIADHN COc1cccc([C@@H](CNC(=O)Cc2cccc3ccc(OC)cc32)N2CCCC2)c1 ZINC000513805425 922129928 /nfs/dbraw/zinc/12/99/28/922129928.db2.gz QITNXWFXOWNJBP-RUZDIDTESA-N 0 3 418.537 4.353 20 0 HIADHN C[C@@H](N[C@@H]1CCc2c1cccc2Br)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000513861821 922187919 /nfs/dbraw/zinc/18/79/19/922187919.db2.gz NSMUUTHBNLVLPZ-BFUOFWGJSA-N 0 3 423.376 4.038 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)NC[C@@H]1CCCO[C@H]1c1ccccc1 ZINC000513911257 922233837 /nfs/dbraw/zinc/23/38/37/922233837.db2.gz MUBIGPKRWNWZLF-HJOGWXRNSA-N 0 3 407.558 4.291 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)Nc1ccc2scnc2c1 ZINC000513971832 922291901 /nfs/dbraw/zinc/29/19/01/922291901.db2.gz QXICWWDAAHKPTE-UHFFFAOYSA-N 0 3 409.559 4.020 20 0 HIADHN COCCN1CCC(NC(=O)N[C@H](CCCc2ccccc2)c2ccccc2)CC1 ZINC000514028693 922352360 /nfs/dbraw/zinc/35/23/60/922352360.db2.gz IPAVTYWSOZXMJC-XMMPIXPASA-N 0 3 409.574 4.161 20 0 HIADHN CC(C)[C@H](NC(=O)N[C@H]1CCN([C@H](C)c2ccccc2)C1)c1nc2ccccc2[nH]1 ZINC000514068686 922392680 /nfs/dbraw/zinc/39/26/80/922392680.db2.gz NWOQYQGQSYTPKH-LZNRXBQRSA-N 0 3 405.546 4.395 20 0 HIADHN O=C(Nc1ccccc1)[C@@H](NC[C@H]1CCN(C(=O)c2ccccc2)C1)c1ccccc1 ZINC000514076340 922398108 /nfs/dbraw/zinc/39/81/08/922398108.db2.gz WUHTUVMQSFNVKT-YKSBVNFPSA-N 0 3 413.521 4.118 20 0 HIADHN C[C@H]1Oc2ccc(C(=O)C3CCN(Cc4coc5ccccc45)CC3)cc2NC1=O ZINC000514104669 922433189 /nfs/dbraw/zinc/43/31/89/922433189.db2.gz LWLUOSLTLYJGBB-OAHLLOKOSA-N 0 3 404.466 4.247 20 0 HIADHN Cc1cc([C@@H](C)NC(=O)NCCCCN2CCN(c3cccc(C)c3)CC2)c(C)o1 ZINC000514134417 922469223 /nfs/dbraw/zinc/46/92/23/922469223.db2.gz MCHIHTKBYKUQCN-HXUWFJFHSA-N 0 3 412.578 4.167 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)N[C@@H](C)c2cccc(N3CCCC3=O)c2)N(C)C)cc1 ZINC000514161838 922501239 /nfs/dbraw/zinc/50/12/39/922501239.db2.gz FYRAWKBBZMTVAV-FDDCHVKYSA-N 0 3 422.573 4.039 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)N1CCC(Nc2ccc(F)cc2)CC1 ZINC000514178646 922516282 /nfs/dbraw/zinc/51/62/82/922516282.db2.gz ABRIOMDQKQOAND-FQEVSTJZSA-N 0 3 416.566 4.310 20 0 HIADHN Cc1ccccc1C[C@@H]1CCCN1CC(=O)N1CCC[C@H]1c1ccc2c(c1)OCCO2 ZINC000514185711 922523410 /nfs/dbraw/zinc/52/34/10/922523410.db2.gz KITPFIDIOLBNKX-GOTSBHOMSA-N 0 3 420.553 4.137 20 0 HIADHN COc1ccc(OC)c([C@H]2CCCN2C(=O)CN2CCC[C@H]2Cc2ccccc2C)c1 ZINC000514187654 922527197 /nfs/dbraw/zinc/52/71/97/922527197.db2.gz ZCAIDHWRQVADHS-XUZZJYLKSA-N 0 3 422.569 4.383 20 0 HIADHN COCCN(CCC(=O)Nc1cccc2ccccc21)Cc1ccc2c(c1)OCO2 ZINC000514188660 922528892 /nfs/dbraw/zinc/52/88/92/922528892.db2.gz GGLVTLGJZWGSPW-UHFFFAOYSA-N 0 3 406.482 4.046 20 0 HIADHN CN(Cc1cccc(Br)c1)C(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000514190049 922530155 /nfs/dbraw/zinc/53/01/55/922530155.db2.gz MOYCKDXUSICDHC-QGZVFWFLSA-N 0 3 422.392 4.489 20 0 HIADHN CC(C)[C@@H]1C[C@H](CC(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)CCO1 ZINC000514194691 922533642 /nfs/dbraw/zinc/53/36/42/922533642.db2.gz KUTOUYWXJZQOHU-XLIONFOSSA-N 0 3 414.512 4.437 20 0 HIADHN CC(C)[C@H]1C[C@@H](CC(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)CCO1 ZINC000514194689 922534066 /nfs/dbraw/zinc/53/40/66/922534066.db2.gz KUTOUYWXJZQOHU-FXAWDEMLSA-N 0 3 414.512 4.437 20 0 HIADHN O=C(CCCc1ncc(-c2ccccc2)o1)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000514408172 922613907 /nfs/dbraw/zinc/61/39/07/922613907.db2.gz ZKHTXNPVZFTLKP-QFIPXVFZSA-N 0 3 403.526 4.445 20 0 HIADHN CC(=O)N1C[C@@H]2CCC[C@@H](NCc3csc(Cc4ccc(Cl)cc4)n3)[C@H]2C1 ZINC000514411498 922614172 /nfs/dbraw/zinc/61/41/72/922614172.db2.gz FKXHNSLQLIRYHH-FFZOFVMBSA-N 0 3 403.979 4.124 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N(Cc2cccs2)C[C@@H]2CCCO2)N(C)C)cc1 ZINC000514564150 922702252 /nfs/dbraw/zinc/70/22/52/922702252.db2.gz ADSRKPUHXDMTDJ-UNMCSNQZSA-N 0 3 415.603 4.304 20 0 HIADHN Cc1ccc(-c2n[nH]cc2CNCc2cccc(-c3nc(CC(F)(F)F)no3)c2)o1 ZINC000514635581 922739268 /nfs/dbraw/zinc/73/92/68/922739268.db2.gz CGFFQVFXTDUJPM-UHFFFAOYSA-N 0 3 417.391 4.423 20 0 HIADHN CCn1c2ccccc2nc1[C@@H]1CCCN1C[C@H]1CCN(C(=O)c2ccccc2)C1 ZINC000514680160 922750700 /nfs/dbraw/zinc/75/07/00/922750700.db2.gz QIUGOPDMLFQAFE-XXBNENTESA-N 0 3 402.542 4.355 20 0 HIADHN CCn1c2ccccc2nc1[C@H]1CCCN1C[C@H]1CCN(C(=O)c2ccccc2)C1 ZINC000514680157 922751070 /nfs/dbraw/zinc/75/10/70/922751070.db2.gz QIUGOPDMLFQAFE-AUSIDOKSSA-N 0 3 402.542 4.355 20 0 HIADHN CC(C)Oc1ccc([C@@H](C)N[C@@H]2CCCN(S(=O)(=O)c3cccs3)C2)cc1 ZINC000515082003 922897738 /nfs/dbraw/zinc/89/77/38/922897738.db2.gz SREIXJNPMZBCRR-SJLPKXTDSA-N 0 3 408.589 4.039 20 0 HIADHN CSc1ccc([C@@H](CNC(=O)c2cc(F)cc3nc(C)c(C)nc32)N(C)C)cc1 ZINC000515087507 922899845 /nfs/dbraw/zinc/89/98/45/922899845.db2.gz PKEOQEBBHKIQAS-HXUWFJFHSA-N 0 3 412.534 4.140 20 0 HIADHN Cc1cccc(C)c1NC(=O)CNC(=O)[C@H](C)N[C@H](C)c1ccc(F)c2ccccc21 ZINC000515090119 922901770 /nfs/dbraw/zinc/90/17/70/922901770.db2.gz RXMPPCMMMMJIOD-MSOLQXFVSA-N 0 3 421.516 4.390 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1ccc(-n2cccn2)cc1)c1cccc(OC)c1 ZINC000515119778 922934172 /nfs/dbraw/zinc/93/41/72/922934172.db2.gz WLMKINFCQHVRLZ-JOCHJYFZSA-N 0 3 407.518 4.086 20 0 HIADHN C[C@H](NC(=O)[C@H]1CCCN(Cc2cccnc2)C1)c1ccc(Br)cc1F ZINC000515160894 922963103 /nfs/dbraw/zinc/96/31/03/922963103.db2.gz YHWCETVJFNKTOP-HOCLYGCPSA-N 0 3 420.326 4.073 20 0 HIADHN CN(C)[C@H](CNC(=O)Nc1cccc(NC(=O)c2cccs2)c1)c1ccccc1 ZINC000515388966 923076460 /nfs/dbraw/zinc/07/64/60/923076460.db2.gz VJIODKYHSFUINA-LJQANCHMSA-N 0 3 408.527 4.425 20 0 HIADHN COc1cccc([C@@H](CNC(=O)N[C@@H](C)c2c(F)cccc2F)N2CCCC2)c1 ZINC000515821055 923373583 /nfs/dbraw/zinc/37/35/83/923373583.db2.gz HPEYMZPNZUBMHM-MGPUTAFESA-N 0 3 403.473 4.171 20 0 HIADHN O=C(NCc1cc(F)cc(Br)c1)NC[C@H](c1ccccc1)N1CCCC1 ZINC000515869208 923402429 /nfs/dbraw/zinc/40/24/29/923402429.db2.gz ZIPBZQSREOCLAF-LJQANCHMSA-N 0 3 420.326 4.225 20 0 HIADHN CC1CCN([C@H](CNC(=O)c2cccc(NC(=O)NC3CC3)c2)c2ccccc2)CC1 ZINC000515979977 923477112 /nfs/dbraw/zinc/47/71/12/923477112.db2.gz KNLPBJOAEUXDBX-HSZRJFAPSA-N 0 3 420.557 4.174 20 0 HIADHN COc1cc(C(=O)NC[C@@H](c2ccccc2)N2CCC(C)CC2)ccc1OC(F)F ZINC000515982815 923479158 /nfs/dbraw/zinc/47/91/58/923479158.db2.gz CSRHATWSEOKNTP-IBGZPJMESA-N 0 3 418.484 4.500 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)cc1OC ZINC000516164952 923584949 /nfs/dbraw/zinc/58/49/49/923584949.db2.gz IHPLPVNYHGNMLQ-BWAGFHJFSA-N 0 3 423.557 4.386 20 0 HIADHN COc1ccccc1[C@H](C)NC(=O)[C@H](C)N1CCC(CCc2ccc(O)cc2)CC1 ZINC000516298243 923652588 /nfs/dbraw/zinc/65/25/88/923652588.db2.gz BPLAXPQQKJDPNR-OALUTQOASA-N 0 3 410.558 4.311 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CNC(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000516578698 923800139 /nfs/dbraw/zinc/80/01/39/923800139.db2.gz JVZYGRBYUCXBBZ-DENIHFKCSA-N 0 3 417.557 4.124 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)NCc2ccc(F)cc2C(F)(F)F)C1 ZINC000516578892 923800849 /nfs/dbraw/zinc/80/08/49/923800849.db2.gz YJIDRGMPCBNMJK-KBXCAEBGSA-N 0 3 409.427 4.479 20 0 HIADHN COc1ccc([C@H]2C[C@H](NCc3cn4ccc(Br)cc4n3)C2)cc1F ZINC000516606615 923812890 /nfs/dbraw/zinc/81/28/90/923812890.db2.gz NPHUYZQHYSYZEQ-CTYIDZIISA-N 0 3 404.283 4.280 20 0 HIADHN COc1ccc2[nH]cc(C3CCN(C(=O)NC[C@@H](c4ccccc4)N(C)C)CC3)c2c1 ZINC000516656069 923830740 /nfs/dbraw/zinc/83/07/40/923830740.db2.gz WDLLTACPTGVGMV-DEOSSOPVSA-N 0 3 420.557 4.368 20 0 HIADHN CC[C@@H](NCc1cccc(NC(=O)c2ccncc2)c1)c1ccc(C(=O)OC)cc1 ZINC000516669474 923836689 /nfs/dbraw/zinc/83/66/89/923836689.db2.gz SCIGEWIGYQWMQC-JOCHJYFZSA-N 0 3 403.482 4.361 20 0 HIADHN COc1ccc(Cl)cc1NCCC(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000516773981 923883399 /nfs/dbraw/zinc/88/33/99/923883399.db2.gz NNTTWMFUPGGSOI-QGZVFWFLSA-N 0 3 407.967 4.165 20 0 HIADHN CCOC(=O)[C@H]1CC[C@@H](Nc2ccc(CN3CCN(CC)CC3)cc2)c2ccccc21 ZINC000516789233 923887296 /nfs/dbraw/zinc/88/72/96/923887296.db2.gz UJSKXOJFXFQVNV-LOSJGSFVSA-N 0 3 421.585 4.418 20 0 HIADHN CCOC(=O)[C@H]1CC[C@H](Nc2ccc(CN3CCN(CC)CC3)cc2)c2ccccc21 ZINC000516789231 923887632 /nfs/dbraw/zinc/88/76/32/923887632.db2.gz UJSKXOJFXFQVNV-DQEYMECFSA-N 0 3 421.585 4.418 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3nc(C(C)C)oc3C)c(OCC)c2)CC1 ZINC000516796431 923889676 /nfs/dbraw/zinc/88/96/76/923889676.db2.gz FGMUFVGCEIDTFW-UHFFFAOYSA-N 0 3 414.550 4.289 20 0 HIADHN C[C@H](Nc1cnn(-c2ccc(F)cc2F)c(=O)c1Cl)[C@H](c1ccccc1)N(C)C ZINC000516899916 923935141 /nfs/dbraw/zinc/93/51/41/923935141.db2.gz OIELEGHRLMJRQW-RNODOKPDSA-N 0 3 418.875 4.267 20 0 HIADHN C[C@H](CNC(=O)CSc1nnc(-c2ccc3ccccc3c2)o1)N1CCC[C@@H](C)C1 ZINC000517090328 923991712 /nfs/dbraw/zinc/99/17/12/923991712.db2.gz LUNUKTACYPPYCR-IAGOWNOFSA-N 0 3 424.570 4.219 20 0 HIADHN CCC[C@H]1CN(c2nnc(C(C)C)n2C[C@H]2CCCO2)CCN1Cc1ccccc1 ZINC000517248745 924059323 /nfs/dbraw/zinc/05/93/23/924059323.db2.gz AQAXYTVDXGSRDP-FCHUYYIVSA-N 0 3 411.594 4.071 20 0 HIADHN CCC(CC)[C@H](NC(=O)C(=O)Nc1cc(CN(C)C)ccc1OC)c1cccs1 ZINC000517319898 924100343 /nfs/dbraw/zinc/10/03/43/924100343.db2.gz YZQKNRUZJMHDGA-FQEVSTJZSA-N 0 3 417.575 4.051 20 0 HIADHN C[C@H](NC(=O)NCCCN1CCc2ccccc2C1)c1nc(C(C)(C)C)cs1 ZINC000517335367 924110273 /nfs/dbraw/zinc/11/02/73/924110273.db2.gz SDTJYTICRINAIP-INIZCTEOSA-N 0 3 400.592 4.249 20 0 HIADHN COc1ccc(-c2nc3c(s2)[C@H](NCC2(S(C)(=O)=O)CCCC2)CCC3)cc1 ZINC000517344456 924116530 /nfs/dbraw/zinc/11/65/30/924116530.db2.gz HDALYQPJZVPWFY-QGZVFWFLSA-N 0 3 420.600 4.143 20 0 HIADHN Cc1ccc(NC(=O)C(C)C)cc1NC(=O)N[C@@H]1CCN(Cc2ccccc2)[C@H]1C ZINC000517420484 924170796 /nfs/dbraw/zinc/17/07/96/924170796.db2.gz FDMCWTSQNRBISU-GHTZIAJQSA-N 0 3 408.546 4.374 20 0 HIADHN CCOc1cc(NC(=O)NCC2(N3CCOC(C)(C)C3)CCCCC2)ccc1OC ZINC000517504624 924233823 /nfs/dbraw/zinc/23/38/23/924233823.db2.gz QFPTYQMTBOEKJH-UHFFFAOYSA-N 0 3 419.566 4.029 20 0 HIADHN CCN(C(=O)NC[C@H](c1ccccc1)N1CCCC1)[C@@H](C)Cc1ccc(OC)cc1 ZINC000517532020 924249889 /nfs/dbraw/zinc/24/98/89/924249889.db2.gz IPFWTIRYNHAPMK-GBXCKJPGSA-N 0 3 409.574 4.495 20 0 HIADHN CC(C)OC(=O)C[C@H](NC(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1)c1ccccc1 ZINC000517543758 924255188 /nfs/dbraw/zinc/25/51/88/924255188.db2.gz JZALOQKZKUXION-VJBMBRPKSA-N 0 3 423.557 4.204 20 0 HIADHN COCCn1ccc2ccc(NC(=O)N[C@@H]3CCN(Cc4ccccc4)[C@H]3C)cc21 ZINC000517620424 926728776 /nfs/dbraw/zinc/72/87/76/926728776.db2.gz XKYCMWUEHFYNSC-PGRDOPGGSA-N 0 3 406.530 4.072 20 0 HIADHN Cc1cc(-c2cc(C(=O)N(C)[C@H]3CN4CCC3CC4)c3cnn(C(C)C)c3n2)c(C)o1 ZINC000517697479 926800676 /nfs/dbraw/zinc/80/06/76/926800676.db2.gz QWWKQXSMRZRURW-QFIPXVFZSA-N 0 3 421.545 4.055 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)Nc1c(C)cccc1C(=O)N1CCCC1)c1ccco1 ZINC000517768831 926828686 /nfs/dbraw/zinc/82/86/86/926828686.db2.gz PKSLBOYHMLYRIZ-IEBWSBKVSA-N 0 3 412.534 4.075 20 0 HIADHN CCO[C@@H]1C[C@@H](N[C@@H](C)C(=O)Nc2c(C)nn(-c3ccccc3)c2C)C12CCCC2 ZINC000517781826 926834016 /nfs/dbraw/zinc/83/40/16/926834016.db2.gz IIMQUIAGEYDHCX-IOMROCGXSA-N 0 3 410.562 4.144 20 0 HIADHN COc1ccc(Br)cc1-c1nc(CN[C@@H](CO)C2CCCC2)cs1 ZINC000517786310 926835863 /nfs/dbraw/zinc/83/58/63/926835863.db2.gz UJRSIQKNMXJARF-INIZCTEOSA-N 0 3 411.365 4.222 20 0 HIADHN CC(C)N(Cc1ccco1)C[C@H](O)COc1ccc(Cl)cc1Br ZINC000518001340 926940941 /nfs/dbraw/zinc/94/09/41/926940941.db2.gz DNAKZNLDWUNWOZ-AWEZNQCLSA-N 0 3 402.716 4.346 20 0 HIADHN O=C(N[C@@H](COc1ccccc1)c1ccccc1)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000518070607 927005767 /nfs/dbraw/zinc/00/57/67/927005767.db2.gz IMWRQAPVHKCHMB-ZCYQVOJMSA-N 0 3 415.537 4.230 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)c1csc(-c2cnn(-c3ccccc3)c2)n1 ZINC000518148859 927047682 /nfs/dbraw/zinc/04/76/82/927047682.db2.gz QCIWPKCBYBUIHC-UHFFFAOYSA-N 0 3 423.586 4.334 20 0 HIADHN O[C@@H](CNCc1cccc(OC(F)(F)F)c1)COc1cccc(Cl)c1Cl ZINC000518277305 927134997 /nfs/dbraw/zinc/13/49/97/927134997.db2.gz FWHJWXRZNFVSHV-LBPRGKRZSA-N 0 3 410.219 4.422 20 0 HIADHN Brc1ccc2c(c1)C=C(CNCc1ccc(OCC3CC3)nc1)CO2 ZINC000518279294 927136914 /nfs/dbraw/zinc/13/69/14/927136914.db2.gz MEVDYGHUNNOJQT-UHFFFAOYSA-N 0 3 401.304 4.199 20 0 HIADHN Cc1ccc(NC(=O)N2CCC(CN3C[C@H](C)O[C@@H](C)C3)CC2)cc1C(F)(F)F ZINC000518313743 927176506 /nfs/dbraw/zinc/17/65/06/927176506.db2.gz IHTLBXXCBCGQBC-HOTGVXAUSA-N 0 3 413.484 4.367 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)c1cc2ccc(F)cc2nc1C ZINC000518316853 927180241 /nfs/dbraw/zinc/18/02/41/927180241.db2.gz YWGPJIADPUGXJG-OAQYLSRUSA-N 0 3 406.505 4.204 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)N1CCCCC[C@@H]1c1ccncc1 ZINC000518357257 927218544 /nfs/dbraw/zinc/21/85/44/927218544.db2.gz LJZFHYFNBJGIIR-XMMPIXPASA-N 0 3 406.574 4.128 20 0 HIADHN CC(C)c1ccccc1OCCNC(=O)c1ccc(N2CCN(C(C)C)CC2)cc1 ZINC000518361585 927220613 /nfs/dbraw/zinc/22/06/13/927220613.db2.gz DAZAHMNQWABBQB-UHFFFAOYSA-N 0 3 409.574 4.149 20 0 HIADHN CCCOc1ccc(CNC(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)cc1OC ZINC000518402988 927243228 /nfs/dbraw/zinc/24/32/28/927243228.db2.gz XRNFJDAWBZSOFR-WIYYLYMNSA-N 0 3 411.546 4.119 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N(C)Cc2ccc(Br)cc2)C1 ZINC000518403407 927245332 /nfs/dbraw/zinc/24/53/32/927245332.db2.gz NUCSCSQIVWTNCU-OXQOHEQNSA-N 0 3 416.363 4.426 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)N(C)Cc2ccc(Br)o2)C1 ZINC000518409655 927250099 /nfs/dbraw/zinc/25/00/99/927250099.db2.gz MCLGNTGGJIGZQD-GOEBONIOSA-N 0 3 406.324 4.019 20 0 HIADHN C[C@H](CNC(=O)c1ccc2c(c1)[nH]c(=O)n2C1CCCC1)N(C)Cc1ccccc1 ZINC000518435952 927269893 /nfs/dbraw/zinc/26/98/93/927269893.db2.gz UUNWSWMKKQGXAF-QGZVFWFLSA-N 0 3 406.530 4.107 20 0 HIADHN OC[C@@]1(CNCc2cc(Br)ccc2OC(F)F)C[C@H]1c1ccccc1 ZINC000518445217 927278160 /nfs/dbraw/zinc/27/81/60/927278160.db2.gz CRPXFHWCMYVYOF-LPHOPBHVSA-N 0 3 412.274 4.306 20 0 HIADHN CN(C)Cc1cccc(NC(=O)c2cccc(NC(=O)c3ccc4[nH]cnc4c3)c2)c1 ZINC000518466240 927293013 /nfs/dbraw/zinc/29/30/13/927293013.db2.gz LVZXRTRJFGLAMF-UHFFFAOYSA-N 0 3 413.481 4.129 20 0 HIADHN COc1ccc([C@H](NC(=O)N(CCN(C)C)CC(C)C)c2ccc(F)cc2)cc1 ZINC000518495728 927307904 /nfs/dbraw/zinc/30/79/04/927307904.db2.gz BCKONJXGBUSVGU-JOCHJYFZSA-N 0 3 401.526 4.153 20 0 HIADHN COc1cccc(OC)c1OC[C@@H](O)CN(C)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000518512214 927318425 /nfs/dbraw/zinc/31/84/25/927318425.db2.gz MQBIMOUKHXLAJO-YOEHRIQHSA-N 0 3 413.436 4.155 20 0 HIADHN C[C@@H](NC(=O)N(Cc1ccco1)C1CCN(C)CC1)c1nc(C(C)(C)C)cs1 ZINC000518541062 927336636 /nfs/dbraw/zinc/33/66/36/927336636.db2.gz QRJMRELSRKEYFB-OAHLLOKOSA-N 0 3 404.580 4.401 20 0 HIADHN CCCN(C)CC(=O)NC[C@H](c1ccc(SC)cc1)N1CCc2sccc2C1 ZINC000518575760 927356535 /nfs/dbraw/zinc/35/65/35/927356535.db2.gz OTQCIFFWAMDGIF-HXUWFJFHSA-N 0 3 417.644 4.027 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N2CCC(OC3CCC(C)CC3)CC2)N(C)C)cc1 ZINC000518666162 927417747 /nfs/dbraw/zinc/41/77/47/927417747.db2.gz ZZKNMDLFLPFBFK-POOLCLQXSA-N 0 3 401.595 4.367 20 0 HIADHN COc1ccc([C@@H](CNc2nc(C(F)F)nc3ccccc32)N(C)C)cc1OC ZINC000518705808 927446956 /nfs/dbraw/zinc/44/69/56/927446956.db2.gz BQZAONSCGWZZEX-MRXNPFEDSA-N 0 3 402.445 4.299 20 0 HIADHN CN1CCN([C@@H](CNCc2csc(-c3cccs3)n2)c2cccs2)CC1 ZINC000518748774 927474296 /nfs/dbraw/zinc/47/42/96/927474296.db2.gz BDWYVYKZXOHXRZ-INIZCTEOSA-N 0 3 404.630 4.011 20 0 HIADHN CCOc1c(OC)cc(CNC2(c3ccc4c(c3)OCCO4)CCCC2)cc1OC ZINC000518772818 927486186 /nfs/dbraw/zinc/48/61/86/927486186.db2.gz GJFVRGGLDHIARG-UHFFFAOYSA-N 0 3 413.514 4.433 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)c(Cl)c1 ZINC000518812474 927507990 /nfs/dbraw/zinc/50/79/90/927507990.db2.gz PQISZFACFSWQEB-KSSFIOAISA-N 0 3 400.910 4.255 20 0 HIADHN CCN(C(=O)c1ccc2c(c1)SCC(=O)N2)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000518847525 927549091 /nfs/dbraw/zinc/54/90/91/927549091.db2.gz PVWLRCLRAWDRGZ-APWZRJJASA-N 0 3 409.555 4.028 20 0 HIADHN CCN(C(=O)CCCN1CCN(c2ccccc2)CC1)[C@H](C)c1cccc(OC)c1 ZINC000518887706 927599202 /nfs/dbraw/zinc/59/92/02/927599202.db2.gz QIWSLJCRZSHJPW-OAQYLSRUSA-N 0 3 409.574 4.207 20 0 HIADHN Cc1ccc(C2(C(=O)NC[C@@H](C(C)C)N3CCc4ccccc4C3)CCOCC2)cc1 ZINC000518920327 927628212 /nfs/dbraw/zinc/62/82/12/927628212.db2.gz RVRMGPQIDMLLDO-VWLOTQADSA-N 0 3 420.597 4.242 20 0 HIADHN C[C@@H](CNC(=O)C(=O)Nc1ccc(Sc2ccccc2Cl)cc1)N1CCCC1 ZINC000518943487 927647922 /nfs/dbraw/zinc/64/79/22/927647922.db2.gz QHWLYUKIOQLRMH-HNNXBMFYSA-N 0 3 417.962 4.030 20 0 HIADHN CC(C)c1cccc(O[C@H](C(=O)N(C)CCCN2CCN(C)CC2)c2ccccc2)c1 ZINC000518948488 927649841 /nfs/dbraw/zinc/64/98/41/927649841.db2.gz NGKZMKVDHNMRBZ-VWLOTQADSA-N 0 3 423.601 4.026 20 0 HIADHN C[C@@H](CNC(=O)c1[nH]c2ccccc2c1Br)N(C)Cc1ccccc1 ZINC000518964478 927661182 /nfs/dbraw/zinc/66/11/82/927661182.db2.gz VCDRMLFVEKRZER-AWEZNQCLSA-N 0 3 400.320 4.181 20 0 HIADHN COCCOc1ccc(C(F)(F)F)cc1NC(=O)CN(C)[C@@H]1CCC[C@H](C)C1 ZINC000519001693 927682276 /nfs/dbraw/zinc/68/22/76/927682276.db2.gz NTGYLJMAMVACPN-GOEBONIOSA-N 0 3 402.457 4.180 20 0 HIADHN C[C@@H](NC(=O)C(=O)Nc1cccc(-c2ccccc2)c1)[C@@H](c1ccccc1)N(C)C ZINC000519007437 927685898 /nfs/dbraw/zinc/68/58/98/927685898.db2.gz SQGGHGTZAVANRL-JPYJTQIMSA-N 0 3 401.510 4.100 20 0 HIADHN CC(C)CN(CCc1ccccc1)CC(=O)N1CCC(C(=O)Nc2ccccc2)CC1 ZINC000519054864 927731251 /nfs/dbraw/zinc/73/12/51/927731251.db2.gz DSFMYAKNSCSMRL-UHFFFAOYSA-N 0 3 421.585 4.064 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)N2CCN(CCC(C)(C)C)CC2)c(C)c1 ZINC000519053886 927732440 /nfs/dbraw/zinc/73/24/40/927732440.db2.gz XUBCVMXMVLPZLX-SFHVURJKSA-N 0 3 402.583 4.109 20 0 HIADHN C[C@H](O)CN(CC(=O)N1N=C(c2ccco2)C[C@@H]1c1cccs1)C1CCCCC1 ZINC000519201638 927824611 /nfs/dbraw/zinc/82/46/11/927824611.db2.gz RMZHCAIVXKUIEE-QFBILLFUSA-N 0 3 415.559 4.034 20 0 HIADHN C[C@H](NCC(C)(C)c1c(Cl)cccc1Cl)C(=O)N1CC(=O)Nc2ccccc21 ZINC000519228235 927836942 /nfs/dbraw/zinc/83/69/42/927836942.db2.gz LOFSKYGJJKLHOA-ZDUSSCGKSA-N 0 3 420.340 4.234 20 0 HIADHN CN(C(=O)Nc1cc(Cl)cc2cccnc21)C1CCN(CCc2ccccn2)CC1 ZINC000519256886 927850555 /nfs/dbraw/zinc/85/05/55/927850555.db2.gz TYGFUUDBKJCPMC-UHFFFAOYSA-N 0 3 423.948 4.454 20 0 HIADHN COc1ccc([C@H](CNC(=O)Cc2ccc(OCC(C)C)cc2)N2CCCC2)cc1 ZINC000519333824 927886158 /nfs/dbraw/zinc/88/61/58/927886158.db2.gz ICDMPXSBPYVUTJ-DEOSSOPVSA-N 0 3 410.558 4.226 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)c1cc2ccccc2n1C ZINC000519414486 927933038 /nfs/dbraw/zinc/93/30/38/927933038.db2.gz NOGFVDLCGKQTQF-UHFFFAOYSA-N 0 3 403.448 4.401 20 0 HIADHN COc1ccc(C)cc1NC(=O)[C@H](C)N[C@H]1CCN(C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000519481339 927980023 /nfs/dbraw/zinc/98/00/23/927980023.db2.gz IQROQBHCCJIEAU-DHUIEDIVSA-N 0 3 419.928 4.158 20 0 HIADHN Cc1ccc(NC(=O)N[C@@H](CN2CCCC2)c2ccccc2)cc1C(=O)NC(C)C ZINC000519497164 927992438 /nfs/dbraw/zinc/99/24/38/927992438.db2.gz ZRBXNPXIXKFBSJ-QFIPXVFZSA-N 0 3 408.546 4.092 20 0 HIADHN Cc1c(NC(=O)N[C@@H]2CCN(Cc3ccccc3)[C@H]2C)cnn1-c1ccccc1F ZINC000519551900 928011342 /nfs/dbraw/zinc/01/13/42/928011342.db2.gz CSJGWTAJPHQPAY-OXJNMPFZSA-N 0 3 407.493 4.104 20 0 HIADHN C[C@H]1C[C@H]1N1CCN(C(=O)c2ccccc2SCc2cscn2)C[C@@H](C)C1 ZINC000519765363 928069414 /nfs/dbraw/zinc/06/94/14/928069414.db2.gz HTIAJEVLMKQJBB-TXPKVOOTSA-N 0 3 401.601 4.238 20 0 HIADHN COC(=O)c1c(F)ccc(NC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)c1C ZINC000519859823 928099945 /nfs/dbraw/zinc/09/99/45/928099945.db2.gz JOXJHOOBQLRBPJ-MRXNPFEDSA-N 0 3 413.493 4.049 20 0 HIADHN Cc1cc(N2CCCC2)ccc1NC(=O)c1ccc(N2CCN(C(C)C)CC2)cc1 ZINC000519930738 928164548 /nfs/dbraw/zinc/16/45/48/928164548.db2.gz LCCBVUDJLJQORD-UHFFFAOYSA-N 0 3 406.574 4.378 20 0 HIADHN COc1cccc(CN(CCC(=O)Nc2cccc(Cl)c2)C[C@H]2CCCO2)c1 ZINC000519941242 928176004 /nfs/dbraw/zinc/17/60/04/928176004.db2.gz JXDJOXRZEZHOOA-OAQYLSRUSA-N 0 3 402.922 4.358 20 0 HIADHN COc1cccc(CN(CCC(=O)Nc2ccccc2Cl)C[C@H]2CCCO2)c1 ZINC000519941139 928176394 /nfs/dbraw/zinc/17/63/94/928176394.db2.gz BWLUBYVHPJTTTA-LJQANCHMSA-N 0 3 402.922 4.358 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)c(C)c1 ZINC000519989233 928214593 /nfs/dbraw/zinc/21/45/93/928214593.db2.gz JHDUUHIJKGCQDA-JQVVWYNYSA-N 0 3 422.573 4.480 20 0 HIADHN O=C(Nc1cccc(OCC(F)(F)F)c1)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000520049190 928273290 /nfs/dbraw/zinc/27/32/90/928273290.db2.gz SLZCLVWABDONPT-GOSISDBHSA-N 0 3 407.436 4.414 20 0 HIADHN COCCOc1c(Cl)cccc1NC(=O)N(CCN(C)C)Cc1ccc(F)cc1 ZINC000520049697 928273993 /nfs/dbraw/zinc/27/39/93/928273993.db2.gz GRAQTJVISQKXRV-UHFFFAOYSA-N 0 3 423.916 4.100 20 0 HIADHN COCCOc1c(Cl)cccc1NC(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000520050758 928275226 /nfs/dbraw/zinc/27/52/26/928275226.db2.gz ANFBERYPTAOSTM-FUHWJXTLSA-N 0 3 417.937 4.322 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1ccn(Cc2ccccc2)n1)c1cccc(OC)c1 ZINC000520050667 928275268 /nfs/dbraw/zinc/27/52/68/928275268.db2.gz VLHIRHAHPWJCJN-QFIPXVFZSA-N 0 3 421.545 4.145 20 0 HIADHN COCCOc1c(Cl)cccc1NC(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000520050759 928276382 /nfs/dbraw/zinc/27/63/82/928276382.db2.gz ANFBERYPTAOSTM-SJLPKXTDSA-N 0 3 417.937 4.322 20 0 HIADHN Cc1nc(SCC(=O)NC[C@@H](c2ccc(C)cc2)N(C)C)[nH]c1Cc1ccccc1 ZINC000520062451 928287559 /nfs/dbraw/zinc/28/75/59/928287559.db2.gz YARAPHSXGBPLFW-QFIPXVFZSA-N 0 3 422.598 4.129 20 0 HIADHN Cc1[nH]c(SCC(=O)NC[C@@H](c2ccc(C)cc2)N(C)C)nc1Cc1ccccc1 ZINC000520062451 928287576 /nfs/dbraw/zinc/28/75/76/928287576.db2.gz YARAPHSXGBPLFW-QFIPXVFZSA-N 0 3 422.598 4.129 20 0 HIADHN Cc1nc(SCC(=O)NC[C@H](c2ccc(C)cc2)N(C)C)[nH]c1Cc1ccccc1 ZINC000520062450 928288479 /nfs/dbraw/zinc/28/84/79/928288479.db2.gz YARAPHSXGBPLFW-JOCHJYFZSA-N 0 3 422.598 4.129 20 0 HIADHN Cc1[nH]c(SCC(=O)NC[C@H](c2ccc(C)cc2)N(C)C)nc1Cc1ccccc1 ZINC000520062450 928288499 /nfs/dbraw/zinc/28/84/99/928288499.db2.gz YARAPHSXGBPLFW-JOCHJYFZSA-N 0 3 422.598 4.129 20 0 HIADHN O=C(Nc1nc(-c2ccc3c(c2)OCO3)cs1)c1cccc(CN2CCCC2)c1 ZINC000520104700 928313804 /nfs/dbraw/zinc/31/38/04/928313804.db2.gz WLZXIIRYPPJQFC-UHFFFAOYSA-N 0 3 407.495 4.387 20 0 HIADHN CC(C)n1ncc2c1nc(C1CC1)cc2C(=O)N(CCN(C)C)Cc1ccc(F)cc1 ZINC000520106172 928314737 /nfs/dbraw/zinc/31/47/37/928314737.db2.gz FILNMELOZBVKQT-UHFFFAOYSA-N 0 3 423.536 4.233 20 0 HIADHN CN(CCCc1cc(-c2ccccc2)n(C)n1)C(=O)c1cccc(CN2CCCC2)c1 ZINC000520122732 928322837 /nfs/dbraw/zinc/32/28/37/928322837.db2.gz QZBUXALYJCRTLF-UHFFFAOYSA-N 0 3 416.569 4.388 20 0 HIADHN CCOc1cccc([C@@H](C)NC(=O)NC[C@@H](c2ccc(OC)cc2)N2CCCC2)c1 ZINC000520135744 928331638 /nfs/dbraw/zinc/33/16/38/928331638.db2.gz JGXFNOWMAXMAGF-JPYJTQIMSA-N 0 3 411.546 4.291 20 0 HIADHN CC[C@H](NCc1ccnc2ccccc12)c1ccccc1OCC(=O)N1CCCC1 ZINC000520201884 928386728 /nfs/dbraw/zinc/38/67/28/928386728.db2.gz ZJLXRNVNCXRYQR-QFIPXVFZSA-N 0 3 403.526 4.477 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)Nc1ccc(F)cc1Br ZINC000520310291 928471920 /nfs/dbraw/zinc/47/19/20/928471920.db2.gz MKSMEGHVZQPNHL-UHFFFAOYSA-N 0 3 420.326 4.129 20 0 HIADHN CCN1CCCC[C@H]1CNC(=O)c1ccc(COc2cccc(Br)c2)o1 ZINC000520312304 928473958 /nfs/dbraw/zinc/47/39/58/928473958.db2.gz XNBASRMEFFOPLE-INIZCTEOSA-N 0 3 421.335 4.225 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)N1CC=C(c2ccc(F)cc2)CC1 ZINC000520322194 928486371 /nfs/dbraw/zinc/48/63/71/928486371.db2.gz AUEDYVBTWGNPCC-UHFFFAOYSA-N 0 3 407.533 4.044 20 0 HIADHN C[C@@H](NC(=O)NC[C@H](C)N(C)Cc1ccccc1)c1nc2ccccc2n1C(F)F ZINC000520380584 928533211 /nfs/dbraw/zinc/53/32/11/928533211.db2.gz BIQOVYPZVXBWRU-JKSUJKDBSA-N 0 3 415.488 4.312 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)NCCOC1CCCCC1 ZINC000520417501 928554889 /nfs/dbraw/zinc/55/48/89/928554889.db2.gz PGLVPPGGCHXCGV-UHFFFAOYSA-N 0 3 415.500 4.128 20 0 HIADHN C[C@@H](Cc1ccc(O)cc1)NC(=O)N(CCN(C)C)Cc1ccc(C(F)(F)F)cc1 ZINC000520439655 928566202 /nfs/dbraw/zinc/56/62/02/928566202.db2.gz IOZBOBBSQZEHBR-INIZCTEOSA-N 0 3 423.479 4.115 20 0 HIADHN CC(C)(C)c1csc(CCNC(=O)N[C@H](CN2CCCC2)c2ccccc2)n1 ZINC000520560984 928641963 /nfs/dbraw/zinc/64/19/63/928641963.db2.gz ZYEZTHDKKURZIB-GOSISDBHSA-N 0 3 400.592 4.119 20 0 HIADHN CN1CCC(N(Cc2ccccc2Br)C(=O)c2ccoc2Cl)CC1 ZINC000520675666 928721827 /nfs/dbraw/zinc/72/18/27/928721827.db2.gz ZEUSNQMAEPYABJ-UHFFFAOYSA-N 0 3 411.727 4.432 20 0 HIADHN O=C([C@@H](Sc1cc(F)ccc1F)c1ccccc1)N1CC[C@H](N2CCCC2)C1 ZINC000520734530 928783836 /nfs/dbraw/zinc/78/38/36/928783836.db2.gz FPLLHKXNDNTLIT-RXVVDRJESA-N 0 3 402.510 4.495 20 0 HIADHN COCCOc1c(Cl)cccc1NC(=O)N[C@@H]1CCN(Cc2ccccc2)[C@H]1C ZINC000520882571 928858035 /nfs/dbraw/zinc/85/80/35/928858035.db2.gz AUSWUKRBHBGPKA-QFBILLFUSA-N 0 3 417.937 4.150 20 0 HIADHN NC(=O)C[C@@H](NCc1csc(-c2ccc(Br)cc2)n1)C1CCCCC1 ZINC000520893477 928864732 /nfs/dbraw/zinc/86/47/32/928864732.db2.gz VFXNFLZJQXYCLR-QGZVFWFLSA-N 0 3 422.392 4.487 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N(C)CCCc2cc(-c3ccccc3)n[nH]2)N(C)C)cc1 ZINC000520934669 928881680 /nfs/dbraw/zinc/88/16/80/928881680.db2.gz FWJHQXQRRRLFEX-XMMPIXPASA-N 0 3 419.573 4.262 20 0 HIADHN CC(C)Oc1ccc([C@H](C)NC(=O)N(C)C2CCN(CCc3ccccn3)CC2)cc1 ZINC000521006036 928922430 /nfs/dbraw/zinc/92/24/30/928922430.db2.gz FXXKGHIFDNQXPA-FQEVSTJZSA-N 0 3 424.589 4.278 20 0 HIADHN O=C(N[C@@H](c1ccc2c(c1)OCCO2)C1CC1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000521011954 928929084 /nfs/dbraw/zinc/92/90/84/928929084.db2.gz RBJSRRQXUIXEOL-GBXCKJPGSA-N 0 3 424.516 4.076 20 0 HIADHN O=C(NC[C@@H]1CCCO[C@H]1c1ccccc1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000521014492 928931293 /nfs/dbraw/zinc/93/12/93/928931293.db2.gz WEZCJWAAONDNSZ-FIXSFTCYSA-N 0 3 410.533 4.322 20 0 HIADHN CN(C(=O)c1ccccc1-c1ncc(-c2ccccc2F)o1)[C@@H]1CCN(C2CC2)C1 ZINC000521151820 929027410 /nfs/dbraw/zinc/02/74/10/929027410.db2.gz UXGYLZDVMLAXPR-QGZVFWFLSA-N 0 3 405.473 4.456 20 0 HIADHN C[C@H](Cc1ccc(C(F)(F)F)cc1)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000521167577 929040530 /nfs/dbraw/zinc/04/05/30/929040530.db2.gz VOPXUSBXNKHYOT-OXQOHEQNSA-N 0 3 405.464 4.210 20 0 HIADHN COc1cc(CN(C)C(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)ccc1SC ZINC000521203328 929059484 /nfs/dbraw/zinc/05/94/84/929059484.db2.gz MPTRQGZKSFNGPH-FXAWDEMLSA-N 0 3 413.587 4.394 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1cccc(-c2noc(C)n2)c1)c1cccc(OC)c1 ZINC000521269415 929090775 /nfs/dbraw/zinc/09/07/75/929090775.db2.gz AQHZFCKXSNOSKB-OAQYLSRUSA-N 0 3 423.517 4.258 20 0 HIADHN CN(C)C[C@H](NC(=O)N[C@H](c1ccccc1)c1ccccn1)c1ccc(Cl)cc1 ZINC000521276166 929094787 /nfs/dbraw/zinc/09/47/87/929094787.db2.gz WPJZDNDBHHUBQG-FCHUYYIVSA-N 0 3 408.933 4.427 20 0 HIADHN CCN1CCCN(C(=O)C(C)(C)c2csc(-c3c(F)cccc3Cl)n2)CC1 ZINC000521323259 929136652 /nfs/dbraw/zinc/13/66/52/929136652.db2.gz JYWNUMYPIIIMHS-UHFFFAOYSA-N 0 3 409.958 4.434 20 0 HIADHN COc1cc2c(cc1OC)CN(C(=O)CN1CCCCC[C@H]1c1ccccc1)CC2 ZINC000521425921 929216936 /nfs/dbraw/zinc/21/69/36/929216936.db2.gz RQKWFBBCKBMITF-QFIPXVFZSA-N 0 3 408.542 4.206 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)N[C@@H](c1ccc(F)cc1)[C@H]1CCCO1 ZINC000521456298 929230181 /nfs/dbraw/zinc/23/01/81/929230181.db2.gz ZCDYNJFJGUFDBQ-ZLNRFVROSA-N 0 3 411.521 4.182 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2ccc(NC(=O)c3cccs3)cc2)N(C)C)cc1 ZINC000521490650 929249908 /nfs/dbraw/zinc/24/99/08/929249908.db2.gz SZSSCWZJOADVEG-HXUWFJFHSA-N 0 3 407.539 4.342 20 0 HIADHN O=C(NCC1CCN(Cc2ccccc2Cl)CC1)N1CCCC[C@H]1c1ncc[nH]1 ZINC000521622212 929331681 /nfs/dbraw/zinc/33/16/81/929331681.db2.gz ODIQPYCXZDWATC-FQEVSTJZSA-N 0 3 415.969 4.212 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)NCCOC1CCCCC1 ZINC000521685704 929365366 /nfs/dbraw/zinc/36/53/66/929365366.db2.gz IGRLIBXTZOMVRF-UHFFFAOYSA-N 0 3 415.500 4.128 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)NC[C@H]2CCCCN2Cc2ccccc2)c(Cl)c1 ZINC000521853950 929503992 /nfs/dbraw/zinc/50/39/92/929503992.db2.gz NHQDOKOHBWTYEL-LJQANCHMSA-N 0 3 414.937 4.475 20 0 HIADHN CC(C)CCc1ccccc1NC(=O)NCc1ccc(CN2CCN(C)CC2)cc1 ZINC000521857398 929509751 /nfs/dbraw/zinc/50/97/51/929509751.db2.gz UOVZBIRCXBXYPQ-UHFFFAOYSA-N 0 3 408.590 4.344 20 0 HIADHN CCCCOc1cccc(NC(=O)N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)c1 ZINC000521876638 929523663 /nfs/dbraw/zinc/52/36/63/929523663.db2.gz OBYTYGNQWMUJGW-KDURUIRLSA-N 0 3 403.567 4.219 20 0 HIADHN C[C@@H](C(=O)N1CCc2ccccc2C1)N(C)CCCc1cc(-c2cccc(F)c2)n[nH]1 ZINC000521880162 929529984 /nfs/dbraw/zinc/52/99/84/929529984.db2.gz HWOVQRARGZYJHN-SFHVURJKSA-N 0 3 420.532 4.054 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N[C@H]3CCSc4ccc(F)cc43)cc2)CC1 ZINC000521931404 929571905 /nfs/dbraw/zinc/57/19/05/929571905.db2.gz VGMDNWBFMABYRQ-NRFANRHFSA-N 0 3 413.562 4.323 20 0 HIADHN CN(C(=O)Cc1csc(-c2ccc(Cl)cc2Cl)n1)[C@H]1CCN(C2CC2)C1 ZINC000521932448 929573164 /nfs/dbraw/zinc/57/31/64/929573164.db2.gz QFVPHHNKPHYKRU-HNNXBMFYSA-N 0 3 410.370 4.355 20 0 HIADHN COc1ccc([C@H](Cc2ccccc2C)NCc2c[nH]c3nccnc23)cc1OC ZINC000521947134 929582670 /nfs/dbraw/zinc/58/26/70/929582670.db2.gz XULOPJGGSJHPFF-FQEVSTJZSA-N 0 3 402.498 4.309 20 0 HIADHN O=S(=O)(CCCNCc1cnc(-c2ccsc2)s1)c1ccc(Cl)cc1 ZINC000521984830 929611624 /nfs/dbraw/zinc/61/16/24/929611624.db2.gz MITFCEFZKJHNRW-UHFFFAOYSA-N 0 3 412.989 4.479 20 0 HIADHN CN(Cc1ccc(F)cc1Cl)C(=O)CCCN1CCN(c2ccccc2)CC1 ZINC000522067718 929627530 /nfs/dbraw/zinc/62/75/30/929627530.db2.gz ODXDUQZCOHSHRL-UHFFFAOYSA-N 0 3 403.929 4.040 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@@H](C)N2CCC[C@@H](Cc3ccccc3)C2)cc1OC ZINC000524485766 929633670 /nfs/dbraw/zinc/63/36/70/929633670.db2.gz JAMSGIDUEPWXJH-CTNGQTDRSA-N 0 3 410.558 4.005 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@@H](C)N2CCC[C@H](Cc3ccccc3)C2)cc1OC ZINC000524485769 929633911 /nfs/dbraw/zinc/63/39/11/929633911.db2.gz JAMSGIDUEPWXJH-TZIWHRDSSA-N 0 3 410.558 4.005 20 0 HIADHN CCN(C(=O)N[C@@H]1CCN(C2CC2)C1)[C@@H]1CCSc2ccc(Br)cc21 ZINC000524493565 929641140 /nfs/dbraw/zinc/64/11/40/929641140.db2.gz ZICOVQYZFSSCMN-RHSMWYFYSA-N 0 3 424.408 4.254 20 0 HIADHN CCCN(C(=O)NC[C@H](c1ccc(C)cc1)N1CCCC1)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000524628315 929737062 /nfs/dbraw/zinc/73/70/62/929737062.db2.gz RRXFNUBGWFKDEK-ODAXIHTASA-N 0 3 413.606 4.367 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)N[C@@H](c1ccccc1)c1ccccn1 ZINC000524630525 929738874 /nfs/dbraw/zinc/73/88/74/929738874.db2.gz KKUBSWPMLXHREM-OFVILXPXSA-N 0 3 414.553 4.477 20 0 HIADHN CN(C)CCN(CC1CCCCC1)C(=O)Cc1csc(Cc2ccc(F)cc2)n1 ZINC000524709176 929806170 /nfs/dbraw/zinc/80/61/70/929806170.db2.gz ROFFXEOYXOBKLN-UHFFFAOYSA-N 0 3 417.594 4.386 20 0 HIADHN Cc1cc(NC(=O)c2ccc(F)cc2Cl)sc1C(=O)NCCN1CC[C@@H](C)C1 ZINC000524719382 929809197 /nfs/dbraw/zinc/80/91/97/929809197.db2.gz KDMYNNDECPSRJK-GFCCVEGCSA-N 0 3 423.941 4.173 20 0 HIADHN O=C(NCc1ccc(-c2ccncc2)cc1)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000524827890 929848185 /nfs/dbraw/zinc/84/81/85/929848185.db2.gz BADXMPQPOKNPEN-DEOSSOPVSA-N 0 3 400.526 4.212 20 0 HIADHN Cc1cc(C(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)c(C)n1Cc1ccccn1 ZINC000524875751 929868082 /nfs/dbraw/zinc/86/80/82/929868082.db2.gz RRTIHQCYXZMOEP-OAQYLSRUSA-N 0 3 416.569 4.285 20 0 HIADHN CCCN(CC(=O)Nc1ccc(OC(F)F)c(Cl)c1)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000524893817 929876393 /nfs/dbraw/zinc/87/63/93/929876393.db2.gz PAOLLPXEWXWJNN-XWIAVFTESA-N 0 3 416.896 4.405 20 0 HIADHN CCCN(CC(=O)Nc1ccc(OC(F)F)c(Cl)c1)[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC000524893816 929876708 /nfs/dbraw/zinc/87/67/08/929876708.db2.gz PAOLLPXEWXWJNN-VHSSKADRSA-N 0 3 416.896 4.405 20 0 HIADHN Cc1ccc(NC(=O)[C@@H]2CCCN(Cc3cccnc3)C2)cc1OCC1CCOCC1 ZINC000524952853 929914556 /nfs/dbraw/zinc/91/45/56/929914556.db2.gz QHFSMLMVHGNBBC-JOCHJYFZSA-N 0 3 423.557 4.046 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)[C@@H]2C[C@H]2c2ccccc2OC(F)(F)F)o1 ZINC000524959025 929922365 /nfs/dbraw/zinc/92/23/65/929922365.db2.gz IJISZDZREHTLGD-ZWKOTPCHSA-N 0 3 410.436 4.181 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)[C@H]1C[C@H]1c1ccccc1OC(F)(F)F ZINC000524969341 929932586 /nfs/dbraw/zinc/93/25/86/929932586.db2.gz WAMZMXOAIGBDOE-IHPCNDPISA-N 0 3 418.459 4.470 20 0 HIADHN O=C(NC[C@]1(O)CCN(Cc2ccccc2)C1)Nc1ccc(Oc2ccccc2)cc1 ZINC000524994093 929960682 /nfs/dbraw/zinc/96/06/82/929960682.db2.gz NHJVBJULJOSSRH-RUZDIDTESA-N 0 3 417.509 4.237 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)C2CC(c3cccc(F)c3)C2)cc1)[C@@H]1CCCN(C)C1 ZINC000525065871 930013629 /nfs/dbraw/zinc/01/36/29/930013629.db2.gz YSDWJYVLNLJOMO-YABDQXBESA-N 0 3 423.532 4.124 20 0 HIADHN COc1cc(C(=O)N(C)[C@@H]2CCCN(C)C2)ccc1OCc1ccccc1Cl ZINC000525101415 930036057 /nfs/dbraw/zinc/03/60/57/930036057.db2.gz QBCMSEYYWXATKQ-GOSISDBHSA-N 0 3 402.922 4.094 20 0 HIADHN COC(=O)c1cc2cc(CN3CCC(c4nc(-c5ccccn5)no4)CC3)ccc2o1 ZINC000525119566 930048263 /nfs/dbraw/zinc/04/82/63/930048263.db2.gz OVJXHRMCXWDOID-UHFFFAOYSA-N 0 3 418.453 4.044 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@@H](C)N[C@@H](C)c2ccc(OC(C)C)cc2)cc1OC ZINC000525244401 930103048 /nfs/dbraw/zinc/10/30/48/930103048.db2.gz SQXZXIHZDSAAHF-ZWKOTPCHSA-N 0 3 414.546 4.189 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N[C@@H]3C[C@H]3c3c(F)cccc3Cl)cc2)CC1 ZINC000525338205 930175992 /nfs/dbraw/zinc/17/59/92/930175992.db2.gz ATGNKIHWVILTJN-WIYYLYMNSA-N 0 3 415.940 4.295 20 0 HIADHN CCCN(CCN(C)C)C(=O)c1cc(-c2ccco2)n(-c2ccc(Cl)cc2)n1 ZINC000525352036 930190432 /nfs/dbraw/zinc/19/04/32/930190432.db2.gz YGOTUFSYGZTOKE-UHFFFAOYSA-N 0 3 400.910 4.200 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)Cc1ccc(Br)s1 ZINC000525383002 930210503 /nfs/dbraw/zinc/21/05/03/930210503.db2.gz ODWBZGAYPNMUGD-HNNXBMFYSA-N 0 3 407.377 4.176 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)N[C@H]1CCCOc2ccc(F)cc21 ZINC000525394275 930215663 /nfs/dbraw/zinc/21/56/63/930215663.db2.gz LSGQKQZUWHKIQX-AVRDEDQJSA-N 0 3 411.521 4.345 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)N[C@H]1C[C@H]1c1c(F)cccc1Cl ZINC000525445132 930243395 /nfs/dbraw/zinc/24/33/95/930243395.db2.gz APFWGONRIJCPQD-BEFAXECRSA-N 0 3 407.892 4.248 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)NCc1ccc(OC(F)F)cc1 ZINC000525448867 930246557 /nfs/dbraw/zinc/24/65/57/930246557.db2.gz ZPKBOYODZPSZRY-QGZVFWFLSA-N 0 3 403.473 4.094 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)NCc1coc(-c2cccs2)n1 ZINC000525449989 930247235 /nfs/dbraw/zinc/24/72/35/930247235.db2.gz IUISBZOZILPGMD-QGZVFWFLSA-N 0 3 410.543 4.209 20 0 HIADHN Cc1ccc(NC(=O)CCSc2ccc3c(c2)OCCCO3)c(CN(C)C)c1 ZINC000525482039 930270719 /nfs/dbraw/zinc/27/07/19/930270719.db2.gz YBCLFZYIBXJUDL-UHFFFAOYSA-N 0 3 400.544 4.339 20 0 HIADHN Cc1ccc2cccc(C(=O)NC3CCN(CCOc4ccc(Cl)cc4)CC3)c2n1 ZINC000525483377 930272166 /nfs/dbraw/zinc/27/21/66/930272166.db2.gz ONJAAQVFPVXXTO-UHFFFAOYSA-N 0 3 423.944 4.470 20 0 HIADHN CN(C)Cc1cccc(C(=O)Nc2cccc(COc3ccc4c(c3)OCO4)c2)c1 ZINC000525490109 930277185 /nfs/dbraw/zinc/27/71/85/930277185.db2.gz DZXMURBEYIKNKT-UHFFFAOYSA-N 0 3 404.466 4.308 20 0 HIADHN O=C(NC[C@]1(O)CCN(Cc2ccccc2)C1)Nc1ccccc1-c1ccccc1 ZINC000525504379 930289123 /nfs/dbraw/zinc/28/91/23/930289123.db2.gz IXOMGCXBRLNOQK-RUZDIDTESA-N 0 3 401.510 4.112 20 0 HIADHN O=C(NC[C@]1(O)CCN(Cc2ccccc2)C1)Nc1ccc(OC2CCCCC2)cc1 ZINC000525515958 930296263 /nfs/dbraw/zinc/29/62/63/930296263.db2.gz RLUUVPCZHRZHML-RUZDIDTESA-N 0 3 423.557 4.157 20 0 HIADHN CC(C)(C)CC(=O)Nc1ccc(CC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000525581494 930343643 /nfs/dbraw/zinc/34/36/43/930343643.db2.gz BVZZJZQJIFSIFI-HSZRJFAPSA-N 0 3 421.585 4.385 20 0 HIADHN Cc1cc(C(=O)NCC2(N3CCSCC3)CCCC2)ccc1NC(=O)CC(C)C ZINC000525658700 930389866 /nfs/dbraw/zinc/38/98/66/930389866.db2.gz LGWRNQUWRIWYSO-UHFFFAOYSA-N 0 3 417.619 4.071 20 0 HIADHN Cc1cccc(-c2nn(-c3ccc(F)cc3)cc2CNCCNC(=O)C(C)(C)C)c1 ZINC000525695937 930406880 /nfs/dbraw/zinc/40/68/80/930406880.db2.gz QIFCKPJXYINPBE-UHFFFAOYSA-N 0 3 408.521 4.239 20 0 HIADHN CC(=O)Nc1cccc(OCCNCc2cc(Cl)ccc2OC[C@@H]2CCCO2)c1 ZINC000525759181 930433412 /nfs/dbraw/zinc/43/34/12/930433412.db2.gz RRJUCGUYOVLOQA-NRFANRHFSA-N 0 3 418.921 4.025 20 0 HIADHN CCN1CCCC[C@H]1C(=O)N1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1 ZINC000525763293 930435208 /nfs/dbraw/zinc/43/52/08/930435208.db2.gz VDQJHPGFLBQWNX-SFHVURJKSA-N 0 3 412.361 4.045 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)CN2CC[C@@H](c3ccccc3)[C@H](C)C2)c(OC)c1 ZINC000525787149 930444581 /nfs/dbraw/zinc/44/45/81/930444581.db2.gz RFHROJROZAKWQA-CKUXNOBLSA-N 0 3 422.569 4.493 20 0 HIADHN CC(C)(C)OC(=O)CCc1cccc(NC(=O)[C@H]2CCCN(Cc3cccnc3)C2)c1 ZINC000525942811 930491307 /nfs/dbraw/zinc/49/13/07/930491307.db2.gz DZXRHEUVAAJHLT-NRFANRHFSA-N 0 3 423.557 4.207 20 0 HIADHN COc1ccc([C@H](CCn2cncn2)NCc2ccc(OC3CCCCC3)nc2)cc1 ZINC000526110272 930537074 /nfs/dbraw/zinc/53/70/74/930537074.db2.gz OZVOLQXQWIHDKN-QHCPKHFHSA-N 0 3 421.545 4.314 20 0 HIADHN CCN(C(=O)C(=O)Nc1cc(F)ccc1Cl)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000526123236 930539777 /nfs/dbraw/zinc/53/97/77/930539777.db2.gz RGGGKKVAHHRYQP-CRAIPNDOSA-N 0 3 417.912 4.102 20 0 HIADHN O=C(NCCCOC1CC[NH+](Cc2ccccc2)CC1)c1cc([O-])c2ccccc2c1 ZINC000526910035 930548903 /nfs/dbraw/zinc/54/89/03/930548903.db2.gz UOFOZRAYELFYOM-UHFFFAOYSA-N 0 3 418.537 4.347 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCc1ncccc1F)c1ccc(C(F)(F)F)cc1 ZINC000527215898 930614586 /nfs/dbraw/zinc/61/45/86/930614586.db2.gz GJADACPBEXRZDG-SFHVURJKSA-N 0 3 412.431 4.122 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3cccc4[nH]ccc43)c(OCC)c2)CC1 ZINC000527310739 930632005 /nfs/dbraw/zinc/63/20/05/930632005.db2.gz GVACBUWOOCOJEZ-UHFFFAOYSA-N 0 3 406.530 4.351 20 0 HIADHN COc1ccc(CCNC(=O)[C@H](C)N[C@H](C)c2cc3ccccc3s2)cc1OC ZINC000527484808 930666438 /nfs/dbraw/zinc/66/64/38/930666438.db2.gz HSTVDYRSESDQPE-CVEARBPZSA-N 0 3 412.555 4.317 20 0 HIADHN Cn1c2ccc(CNCc3ccc(-c4ccc5c(c4)CCO5)cc3)cc2sc1=O ZINC000527523705 930673783 /nfs/dbraw/zinc/67/37/83/930673783.db2.gz PMOPJUSXUZUBBI-UHFFFAOYSA-N 0 3 402.519 4.492 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2ccc(C(=O)N3CCCCCC3)cc2)[C@@H]1c1ccccc1 ZINC000530356918 930692773 /nfs/dbraw/zinc/69/27/73/930692773.db2.gz RJSHNVHDESKSLX-PKTZIBPZSA-N 0 3 420.557 4.270 20 0 HIADHN Cc1ccc(C)c(NC(=O)[C@H](N[C@H]2CCCC[C@@H]2N2CCOCC2)c2ccccc2)c1 ZINC000530366636 930696589 /nfs/dbraw/zinc/69/65/89/930696589.db2.gz PTCJYDBURUFRKC-ZKMPZPQNSA-N 0 3 421.585 4.216 20 0 HIADHN C[C@@H]1CCCCN1C(=O)c1ccc(NC(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)cc1 ZINC000530409870 930705329 /nfs/dbraw/zinc/70/53/29/930705329.db2.gz VZPAYNMUOGKDOU-YSZBQJHXSA-N 0 3 420.557 4.268 20 0 HIADHN C[C@@H]1CCCCN1C(=O)c1ccc(NC(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)cc1 ZINC000530409867 930705381 /nfs/dbraw/zinc/70/53/81/930705381.db2.gz VZPAYNMUOGKDOU-LEOXJPRUSA-N 0 3 420.557 4.268 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2ccccc2OC[C@H]2CCCCO2)[C@H]1c1ccccc1 ZINC000530462600 930719255 /nfs/dbraw/zinc/71/92/55/930719255.db2.gz PMHISMGMECXBLC-UNWVZKJWSA-N 0 3 409.530 4.201 20 0 HIADHN COc1ccc(NC(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)cc1OCC(F)(F)F ZINC000530515588 930734430 /nfs/dbraw/zinc/73/44/30/930734430.db2.gz ZDESXXYAXWINRL-APWZRJJASA-N 0 3 423.435 4.203 20 0 HIADHN C[C@H](NC(=O)[C@@H]1CCCN(Cc2cccnc2)C1)c1ccc(-c2cccnc2)cc1 ZINC000530619211 930774852 /nfs/dbraw/zinc/77/48/52/930774852.db2.gz NZTBNEOZPWKSGB-YADARESESA-N 0 3 400.526 4.233 20 0 HIADHN CN(C)Cc1ccc(-c2noc(-c3csc(-c4ccc5c(c4)OCO5)n3)n2)cc1 ZINC000530632501 930780177 /nfs/dbraw/zinc/78/01/77/930780177.db2.gz NPTUZKYWBGWJPY-UHFFFAOYSA-N 0 3 406.467 4.317 20 0 HIADHN COc1cccc(-n2ccnc2SCc2nc(-c3ccc(CN(C)C)cc3)no2)c1 ZINC000530632976 930780460 /nfs/dbraw/zinc/78/04/60/930780460.db2.gz LNLAEOCEQAKRBU-UHFFFAOYSA-N 0 3 421.526 4.285 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)Cc2csc(Cc3ccccc3)n2)CC1 ZINC000530680078 930796558 /nfs/dbraw/zinc/79/65/58/930796558.db2.gz YZLRPKMOPWUSIJ-UHFFFAOYSA-N 0 3 419.594 4.399 20 0 HIADHN Cc1[nH]c(=O)c(C(=O)NC[C@H](c2cccs2)N2CCCC2)cc1-c1ccccc1 ZINC000530700391 930801328 /nfs/dbraw/zinc/80/13/28/930801328.db2.gz ZECDPQHWHYWNPS-HXUWFJFHSA-N 0 3 407.539 4.391 20 0 HIADHN CC(C)(C)[C@@H](CN1CCc2ccccc2C1)NC(=O)N1CCC[C@@H]1c1ccccn1 ZINC000530709290 930803255 /nfs/dbraw/zinc/80/32/55/930803255.db2.gz DIMZGOOZLQHQDE-DHIUTWEWSA-N 0 3 406.574 4.401 20 0 HIADHN O=C([C@H]1CCCN(Cc2cccnc2)C1)N1CCC[C@]2(CCCc3ccccc32)C1 ZINC000530759222 930818193 /nfs/dbraw/zinc/81/81/93/930818193.db2.gz GTBFRSWCVQAZCG-JYFHCDHNSA-N 0 3 403.570 4.190 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(F)cc2)CC1)c1cc2sccc2s1 ZINC000530774276 930820775 /nfs/dbraw/zinc/82/07/75/930820775.db2.gz HJKMZCVNDSDBQX-UHFFFAOYSA-N 0 3 404.532 4.375 20 0 HIADHN CCCOc1ccc(C[NH2+]Cc2nnc(-c3ccc(Br)cc3)[n-]2)cc1 ZINC000530779950 930821659 /nfs/dbraw/zinc/82/16/59/930821659.db2.gz MMTRBNVBEHSCQN-UHFFFAOYSA-N 0 3 401.308 4.313 20 0 HIADHN Cc1cccn2cc(COc3ccc(CN[C@H](CO)c4ccccc4C)cc3)nc12 ZINC000530856413 930841272 /nfs/dbraw/zinc/84/12/72/930841272.db2.gz DHDZCRBGYYKDQJ-XMMPIXPASA-N 0 3 401.510 4.353 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)CCSc3ccc(F)cc3)CC2)C[C@H](C)O1 ZINC000530940952 930862882 /nfs/dbraw/zinc/86/28/82/930862882.db2.gz SGBDTOLUQPZLOQ-ROUUACIJSA-N 0 3 408.583 4.046 20 0 HIADHN Ic1cccc(OCCCN2CCC[C@H]2c2ccccn2)c1 ZINC000530963308 930869409 /nfs/dbraw/zinc/86/94/09/930869409.db2.gz NDTXUHZEBXWDKA-SFHVURJKSA-N 0 3 408.283 4.292 20 0 HIADHN CC[C@H](C(=O)Nc1ccc(CN2C(=O)Cc3ccc(Cl)cc32)cc1)N(CC)CC ZINC000531048097 930897546 /nfs/dbraw/zinc/89/75/46/930897546.db2.gz SDECVGJQWBMJDS-HXUWFJFHSA-N 0 3 413.949 4.488 20 0 HIADHN Cc1c(C(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)cnn1-c1ccc(F)cc1F ZINC000531062686 930902851 /nfs/dbraw/zinc/90/28/51/930902851.db2.gz KRVCAAHOPWOOMX-HXUWFJFHSA-N 0 3 424.495 4.196 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)c2c(Cl)cccc2Cl)CC1 ZINC000531091889 930916582 /nfs/dbraw/zinc/91/65/82/930916582.db2.gz AOCNAIFQNSAEEP-UHFFFAOYSA-N 0 3 406.357 4.061 20 0 HIADHN CC(C)n1cc([C@@H](C)NC(=O)N[C@H](CN2CCc3ccccc3C2)C(C)(C)C)cn1 ZINC000531107873 930921767 /nfs/dbraw/zinc/92/17/67/930921767.db2.gz ABWLLRBRZIHPAE-XMSQKQJNSA-N 0 3 411.594 4.297 20 0 HIADHN COc1ccc(Br)cc1Cc1nc(-c2ccc(CN(C)C)cc2)no1 ZINC000531109513 930922682 /nfs/dbraw/zinc/92/26/82/930922682.db2.gz QJEVSQOUBDZISD-UHFFFAOYSA-N 0 3 402.292 4.160 20 0 HIADHN CO[C@H](C)c1nc(CN2CCCN(Cc3cc(C)nc4ccccc34)CC2)cs1 ZINC000531231063 930976008 /nfs/dbraw/zinc/97/60/08/930976008.db2.gz CFZGAWRGIIOYAF-GOSISDBHSA-N 0 3 410.587 4.415 20 0 HIADHN O=C(CCN1CCN(c2ccccc2)CC1)N[C@@H](c1cccs1)c1ccc(F)cc1 ZINC000531290903 931003800 /nfs/dbraw/zinc/00/38/00/931003800.db2.gz DRJNZQGBUXTSGC-XMMPIXPASA-N 0 3 423.557 4.305 20 0 HIADHN CC(C)Oc1ccc(C[NH2+]Cc2nnc(-c3ccc(Br)cc3)[n-]2)cc1 ZINC000531495517 931079296 /nfs/dbraw/zinc/07/92/96/931079296.db2.gz TYFPSBSETLEGGT-UHFFFAOYSA-N 0 3 401.308 4.311 20 0 HIADHN CN(C)[C@@H](CNC(=O)NCCc1nc2cc(Cl)ccc2s1)c1ccccc1 ZINC000531523113 931090943 /nfs/dbraw/zinc/09/09/43/931090943.db2.gz ZPLFGGAPLRAOEK-KRWDZBQOSA-N 0 3 402.951 4.094 20 0 HIADHN C[C@H]1CN([C@@H](CNCc2cnc(C3CC3)s2)c2c(F)cccc2Cl)CCO1 ZINC000531630198 931132661 /nfs/dbraw/zinc/13/26/61/931132661.db2.gz WXMDUABMOPYPPB-UGSOOPFHSA-N 0 3 409.958 4.365 20 0 HIADHN COc1cccc(C(=O)NCCN[C@H](C)c2csc(-c3csc(C)n3)c2)c1 ZINC000531696780 931161192 /nfs/dbraw/zinc/16/11/92/931161192.db2.gz CFOUKAXSBXZKNJ-CYBMUJFWSA-N 0 3 401.557 4.269 20 0 HIADHN COc1ccc(C[C@H](NCC(=O)N(C)Cc2ccccc2)c2ccc(OC)cc2)cc1 ZINC000531698882 931162782 /nfs/dbraw/zinc/16/27/82/931162782.db2.gz GZSLBDFRYKBDDO-VWLOTQADSA-N 0 3 418.537 4.236 20 0 HIADHN C[C@@H](NCc1ccc(NC(=O)c2cccnc2)cc1)c1ccc2c(c1)OCCCO2 ZINC000531708540 931167814 /nfs/dbraw/zinc/16/78/14/931167814.db2.gz FGKHAIMAAYFELT-QGZVFWFLSA-N 0 3 403.482 4.346 20 0 HIADHN C[C@H]1C[C@@H](NCc2cccc(CS(C)(=O)=O)c2)c2cccc(Br)c21 ZINC000531707569 931168042 /nfs/dbraw/zinc/16/80/42/931168042.db2.gz FKIXJMUSFPJXLG-SCLBCKFNSA-N 0 3 408.361 4.332 20 0 HIADHN FC(F)(F)c1ccc(OCCNCc2ccccc2OCc2ccccn2)nc1 ZINC000531864010 931226773 /nfs/dbraw/zinc/22/67/73/931226773.db2.gz UUKHNESGGLLKFT-UHFFFAOYSA-N 0 3 403.404 4.243 20 0 HIADHN Cc1ccc(NC(=O)c2cc(I)ccc2C)c(CN(C)C)c1 ZINC000531912728 931244355 /nfs/dbraw/zinc/24/43/55/931244355.db2.gz DODYIYRIVIROBQ-UHFFFAOYSA-N 0 3 408.283 4.222 20 0 HIADHN CC(C)Oc1ccc(CN[C@H](C)CC(=O)Nc2cccc(Br)c2)cn1 ZINC000531937538 931253832 /nfs/dbraw/zinc/25/38/32/931253832.db2.gz NUOSVQUNAZJEEE-CQSZACIVSA-N 0 3 406.324 4.138 20 0 HIADHN COCC(=O)Nc1cccc(CN[C@H]2C[C@@H](C)c3c2cccc3Br)c1 ZINC000531943181 931255962 /nfs/dbraw/zinc/25/59/62/931255962.db2.gz WKVYQGHSCWDRAC-ACJLOTCBSA-N 0 3 403.320 4.372 20 0 HIADHN C[C@@H]1C[C@H](NCc2ccc(N3CCOCC3)nc2)c2cccc(Br)c21 ZINC000531945273 931257491 /nfs/dbraw/zinc/25/74/91/931257491.db2.gz UFDOVOWSTVYIMW-KDOFPFPSSA-N 0 3 402.336 4.019 20 0 HIADHN C[C@@H](NCc1ccc(-n2ccc(C(F)(F)F)n2)cc1)c1ccc([S@@](C)=O)cc1 ZINC000531948704 931260098 /nfs/dbraw/zinc/26/00/98/931260098.db2.gz FYIJDGMXKRNBQQ-GMYLUUGSSA-N 0 3 407.461 4.479 20 0 HIADHN C[C@@H](CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)N[C@@H]1c2ccccc2C[C@@H]1O ZINC000531953288 931262417 /nfs/dbraw/zinc/26/24/17/931262417.db2.gz KMQLZKWFWPUQIG-WOVYWWTOSA-N 0 3 412.839 4.324 20 0 HIADHN CC(C)NS(=O)(=O)Cc1ccccc1CN[C@H]1c2cccc(F)c2CC[C@H]1C ZINC000531958220 931264507 /nfs/dbraw/zinc/26/45/07/931264507.db2.gz TZEUQFLQCSVYEK-OPAMFIHVSA-N 0 3 404.551 4.067 20 0 HIADHN C[C@@H](NCc1cccc(CS(C)(=O)=O)c1)c1ccc(OCC(F)(F)F)cc1 ZINC000531963362 931267351 /nfs/dbraw/zinc/26/73/51/931267351.db2.gz ANRAQEDKPLVHFP-CQSZACIVSA-N 0 3 401.450 4.023 20 0 HIADHN C[C@H](N[C@H](CN1CCN(C)CC1)c1ccccc1)c1ccc(F)cc1Br ZINC000531965883 931268299 /nfs/dbraw/zinc/26/82/99/931268299.db2.gz RCDCTZZCKAZMST-HRAATJIYSA-N 0 3 420.370 4.228 20 0 HIADHN C[C@@H](N[C@H](CN1CCN(C)CC1)c1ccccc1)c1ccccc1Br ZINC000531965888 931268753 /nfs/dbraw/zinc/26/87/53/931268753.db2.gz RKZKSHNUMFFANM-DYESRHJHSA-N 0 3 402.380 4.088 20 0 HIADHN C[C@H](NCc1ccccc1CN(C)Cc1ccco1)c1ccc(S(C)(=O)=O)cc1 ZINC000531980883 931274958 /nfs/dbraw/zinc/27/49/58/931274958.db2.gz ZNNXBRMJQDGGCX-SFHVURJKSA-N 0 3 412.555 4.166 20 0 HIADHN CN1CCN(c2ccc(CN[C@H]3CCCc4nc(-c5ccccc5)sc43)cn2)CC1 ZINC000531989924 931278447 /nfs/dbraw/zinc/27/84/47/931278447.db2.gz XPXJJPLVJKHFST-FQEVSTJZSA-N 0 3 419.598 4.124 20 0 HIADHN COc1ccc(-c2ccccc2)cc1CNCCCS(=O)(=O)Cc1ccccc1 ZINC000532045952 931296026 /nfs/dbraw/zinc/29/60/26/931296026.db2.gz NEHBKIIDDUYWIK-UHFFFAOYSA-N 0 3 409.551 4.457 20 0 HIADHN Cc1cccnc1[C@H](NCc1ccc(OCCN2CCOCC2)c(Cl)c1)C(C)C ZINC000532092409 931308837 /nfs/dbraw/zinc/30/88/37/931308837.db2.gz YSGNJMXGXKSDME-JOCHJYFZSA-N 0 3 417.981 4.241 20 0 HIADHN COc1cccc(C[C@H](NCc2ccc(N3CCOCC3)nc2)c2ccccc2)c1 ZINC000532200949 931347385 /nfs/dbraw/zinc/34/73/85/931347385.db2.gz RRNSFXBTPOUCGN-DEOSSOPVSA-N 0 3 403.526 4.000 20 0 HIADHN COc1cccc(C(=O)NCCN[C@@H](C)c2sc(-c3ccccc3F)nc2C)c1 ZINC000532208381 931351854 /nfs/dbraw/zinc/35/18/54/931351854.db2.gz SQACWTNNNRGZJC-AWEZNQCLSA-N 0 3 413.518 4.347 20 0 HIADHN C[C@H](NCc1ccc(NC(=O)c2ccncc2)cc1)c1ccc2c(c1)CCC(=O)N2 ZINC000532219664 931358308 /nfs/dbraw/zinc/35/83/08/931358308.db2.gz DKTYOFDTVZEMST-INIZCTEOSA-N 0 3 400.482 4.069 20 0 HIADHN CCOc1ccc(Cl)cc1[C@H](C)N[C@@H](CN1CCN(C)CC1)c1ccccc1 ZINC000532221237 931359765 /nfs/dbraw/zinc/35/97/65/931359765.db2.gz HIYCGAMGBPOAHT-AVRDEDQJSA-N 0 3 401.982 4.378 20 0 HIADHN CC[C@H](C(=O)N[C@H](C)c1sc(-c2ccccc2Br)nc1C)N(C)C ZINC000532226261 931361675 /nfs/dbraw/zinc/36/16/75/931361675.db2.gz RKCPGXQVVXZUJO-IAQYHMDHSA-N 0 3 410.381 4.398 20 0 HIADHN O=C([C@H]1CCCN(Cc2cccnc2)C1)N1CCc2c(Cl)cc(Cl)cc2C1 ZINC000532244860 931369975 /nfs/dbraw/zinc/36/99/75/931369975.db2.gz DSADLBPHORQDPB-INIZCTEOSA-N 0 3 404.341 4.185 20 0 HIADHN COc1cc(-c2noc(CN3CC[C@H](C)[C@H]4CCCC[C@H]43)n2)cc(OC)c1OC ZINC000532266928 931376832 /nfs/dbraw/zinc/37/68/32/931376832.db2.gz QAPYPVRWQDUGPK-USXIJHARSA-N 0 3 401.507 4.163 20 0 HIADHN COc1ccc(CN[C@@H]2CCN(c3ncc(C(F)(F)F)cc3Cl)C2)c(OC)c1 ZINC000532321619 931396518 /nfs/dbraw/zinc/39/65/18/931396518.db2.gz JVFKLEQNZRLISK-CQSZACIVSA-N 0 3 415.843 4.140 20 0 HIADHN Cc1ccc(-c2ccc(C(=O)N3CC[C@H](N4CCN(C(C)C)CC4)C3)c(F)c2)cc1C ZINC000532342886 931402465 /nfs/dbraw/zinc/40/24/65/931402465.db2.gz MYVQMRAKMMBOBX-QHCPKHFHSA-N 0 3 423.576 4.350 20 0 HIADHN CC(C)N1CCN([C@@H]2CCN(C(=O)Nc3ccc(OC4CCCCC4)cc3)C2)CC1 ZINC000532351088 931404697 /nfs/dbraw/zinc/40/46/97/931404697.db2.gz IVNKPPDMXPQSRQ-OAQYLSRUSA-N 0 3 414.594 4.030 20 0 HIADHN C[C@@H]1CN(C(=O)c2ccc(CNCc3ccc(Cl)c4cccnc34)cc2)C[C@@H](C)O1 ZINC000532367497 931411049 /nfs/dbraw/zinc/41/10/49/931411049.db2.gz XCIWLVFKIPVTFQ-IAGOWNOFSA-N 0 3 423.944 4.427 20 0 HIADHN CC(=O)Nc1cc(C(=O)N(CCN2CCCC2)c2ccccc2)cc(C(F)(F)F)c1 ZINC000532372957 931413201 /nfs/dbraw/zinc/41/32/01/931413201.db2.gz QLBNQEYUNPAUCO-UHFFFAOYSA-N 0 3 419.447 4.406 20 0 HIADHN COCCOc1ccc(CN[C@H](C)c2sc(-c3ccc(OC)cc3)nc2C)cn1 ZINC000532448116 931438805 /nfs/dbraw/zinc/43/88/05/931438805.db2.gz JTKCGZVSIJFVFR-OAHLLOKOSA-N 0 3 413.543 4.398 20 0 HIADHN CC[C@H](N[C@@H](C)c1ccc(NC(=O)C2CC2)cc1)c1ccccc1OCC(=O)N(C)C ZINC000532455181 931442913 /nfs/dbraw/zinc/44/29/13/931442913.db2.gz AUYTWERKPFVXDG-JTSKRJEESA-N 0 3 423.557 4.304 20 0 HIADHN C[C@H](NCc1cccc(NC(=O)[C@H]2CCCO2)c1)c1ccc(Br)cc1 ZINC000532465124 931446814 /nfs/dbraw/zinc/44/68/14/931446814.db2.gz IYHWRTOWTANGAG-IFXJQAMLSA-N 0 3 403.320 4.417 20 0 HIADHN CC[C@@H](C(=O)N[C@@H](C)c1sc(-c2ccc(Br)cc2)nc1C)N(C)C ZINC000532494186 931461344 /nfs/dbraw/zinc/46/13/44/931461344.db2.gz AFSVCJVIHOIYQX-NHYWBVRUSA-N 0 3 410.381 4.398 20 0 HIADHN Cc1cccc([C@H]2CCCN2C(=O)Nc2ccc(CCN3CCSCC3)cc2)n1 ZINC000532502422 931464770 /nfs/dbraw/zinc/46/47/70/931464770.db2.gz HIHBIHGDQXZNQV-JOCHJYFZSA-N 0 3 410.587 4.350 20 0 HIADHN CC(C)(C)OC(=O)C1CCN(CCC(=O)NC(c2ccccc2)c2ccccc2)CC1 ZINC000532518613 931472133 /nfs/dbraw/zinc/47/21/33/931472133.db2.gz ZTIJEKCZSBQKOJ-UHFFFAOYSA-N 0 3 422.569 4.336 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)N[C@@H](C)c2ccc(S(C)(=O)=O)c(F)c2)cc1 ZINC000532519173 931472618 /nfs/dbraw/zinc/47/26/18/931472618.db2.gz MXCGBSXAWMZAFY-CABCVRRESA-N 0 3 401.507 4.135 20 0 HIADHN Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)NCc1cccc(OCC(N)=O)c1 ZINC000532524520 931475009 /nfs/dbraw/zinc/47/50/09/931475009.db2.gz BXPFKOVXBGGMEL-ZDUSSCGKSA-N 0 3 415.946 4.487 20 0 HIADHN O=C(CC1CCCC1)NC1CCN(Cc2ccc(OCc3ccccn3)cc2)CC1 ZINC000532554019 931520629 /nfs/dbraw/zinc/52/06/29/931520629.db2.gz TVALRLRWLNCGAQ-UHFFFAOYSA-N 0 3 407.558 4.322 20 0 HIADHN C[C@H]1CN(CC(=O)N(Cc2nnc(-c3ccccc3Cl)o2)C2CC2)C(C)(C)C1 ZINC000532568720 931529582 /nfs/dbraw/zinc/52/95/82/931529582.db2.gz VNOHRFYFJWKFHX-CQSZACIVSA-N 0 3 402.926 4.001 20 0 HIADHN COc1ccc([C@@H](Cc2ccc(F)cc2)N[C@@H]2CCCN(CC(F)(F)F)C2=O)cc1 ZINC000532588290 931544370 /nfs/dbraw/zinc/54/43/70/931544370.db2.gz RLTPNRQBUCHHSK-WOJBJXKFSA-N 0 3 424.438 4.261 20 0 HIADHN COc1ccc([C@H](Cc2ccc(F)cc2)N[C@@H]2CCCN(CC(F)(F)F)C2=O)cc1 ZINC000532588288 931544996 /nfs/dbraw/zinc/54/49/96/931544996.db2.gz RLTPNRQBUCHHSK-UXHICEINSA-N 0 3 424.438 4.261 20 0 HIADHN O=C(Nc1ccc(Br)c(Cl)c1)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000532595075 931549671 /nfs/dbraw/zinc/54/96/71/931549671.db2.gz KEKQUSHQNBDZRW-CQSZACIVSA-N 0 3 408.727 4.348 20 0 HIADHN CO[C@@H](C)c1noc(CN2CCCN([C@H](C)c3ccc(C(C)(C)C)cc3)CC2)n1 ZINC000532645364 931565957 /nfs/dbraw/zinc/56/59/57/931565957.db2.gz SGPGRPONRZXBTE-MSOLQXFVSA-N 0 3 400.567 4.343 20 0 HIADHN C[C@@H](NC[C@@H](CO)Cc1ccco1)c1ccc(Br)cc1Br ZINC000532647945 931567556 /nfs/dbraw/zinc/56/75/56/931567556.db2.gz BSWVJRHRCICVIG-NEPJUHHUSA-N 0 3 417.141 4.306 20 0 HIADHN C[C@@H]1CC[C@H](C)N1[C@H]1CCCN(CCS(=O)(=O)c2cc(Cl)ccc2Cl)C1 ZINC000532700258 931593761 /nfs/dbraw/zinc/59/37/61/931593761.db2.gz NKZLUYAOJVJAFH-UXLLHSPISA-N 0 3 419.418 4.104 20 0 HIADHN C[C@H](N[C@H](c1ccc(F)cc1)C1CCC1)C(=O)Nc1cccc(N2CCCC2=O)c1 ZINC000532701529 931595529 /nfs/dbraw/zinc/59/55/29/931595529.db2.gz DPRKOTKBVDNWIC-HJPURHCSSA-N 0 3 409.505 4.411 20 0 HIADHN CCOc1ccc([C@@H]2CCCN2C(=O)CNC2(c3ccccc3)CCOCC2)cc1 ZINC000532708833 931600872 /nfs/dbraw/zinc/60/08/72/931600872.db2.gz NIAKEOREVDWFOL-QHCPKHFHSA-N 0 3 408.542 4.044 20 0 HIADHN CC(C)c1cc(N2CCN(C3c4ccccc4-c4ccccc43)CC2)n2ncnc2n1 ZINC000532781411 931629568 /nfs/dbraw/zinc/62/95/68/931629568.db2.gz UKHIQSZBIBXYPY-UHFFFAOYSA-N 0 3 410.525 4.140 20 0 HIADHN Cc1cc(C(=O)N(CCN2CCCC2)c2ccccc2)nn1-c1ccc(F)cc1F ZINC000532785706 931631167 /nfs/dbraw/zinc/63/11/67/931631167.db2.gz VSVZHGACUDFIGS-UHFFFAOYSA-N 0 3 410.468 4.202 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)NCC(=O)Nc2ccc(Br)cc2)cc1 ZINC000532881703 931677350 /nfs/dbraw/zinc/67/73/50/931677350.db2.gz SYBSIJCJXQBDDW-AWEZNQCLSA-N 0 3 413.319 4.233 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1cc2ccccc2n1C ZINC000532911094 931690285 /nfs/dbraw/zinc/69/02/85/931690285.db2.gz NGUUPFDCQGFSNT-OAQYLSRUSA-N 0 3 413.525 4.383 20 0 HIADHN CCC1CCC(N(Cc2nc(=O)c3c(C)c(C(=O)OC)sc3[nH]2)C2CC2)CC1 ZINC000532918455 931693109 /nfs/dbraw/zinc/69/31/09/931693109.db2.gz DNQLUOSOMTUGDE-UHFFFAOYSA-N 0 3 403.548 4.013 20 0 HIADHN Cc1occc1C(=O)NC1CCN(CCC(=O)Nc2c(Cl)cccc2Cl)CC1 ZINC000532941870 931705205 /nfs/dbraw/zinc/70/52/05/931705205.db2.gz FKGVGJSWXRNUJX-UHFFFAOYSA-N 0 3 424.328 4.118 20 0 HIADHN O=C(CCN1CCCN(C(=O)c2ccc(F)cc2)CC1)Nc1cccc2ccccc21 ZINC000532960536 931713777 /nfs/dbraw/zinc/71/37/77/931713777.db2.gz QXCBJUNVTSPEJZ-UHFFFAOYSA-N 0 3 419.500 4.156 20 0 HIADHN COC1CCC(N(C)CC(=O)N2N=C(c3ccc(C)cc3)C[C@H]2c2ccco2)CC1 ZINC000532977224 931722925 /nfs/dbraw/zinc/72/29/25/931722925.db2.gz WUWZAMMQVIFUFZ-AOMIVXANSA-N 0 3 409.530 4.155 20 0 HIADHN C[C@@H]1C[C@@H](c2ccc(F)cc2)CN1CC(=O)N1CCC(OCc2ccccc2)CC1 ZINC000532977017 931723119 /nfs/dbraw/zinc/72/31/19/931723119.db2.gz JLXHOXZFZBJYHV-DENIHFKCSA-N 0 3 410.533 4.211 20 0 HIADHN Brc1ccc(Cc2noc([C@H]3CCCN3CCN3CCCCC3)n2)cc1 ZINC000532982631 931726313 /nfs/dbraw/zinc/72/63/13/931726313.db2.gz RHKMLJRDTJIZHN-GOSISDBHSA-N 0 3 419.367 4.046 20 0 HIADHN COc1cc([C@@H](C)N[C@H]2CCCN(CC(F)(F)F)C2=O)ccc1OCCC(C)C ZINC000532990080 931728712 /nfs/dbraw/zinc/72/87/12/931728712.db2.gz RBQVAZCAGRDBIW-WBVHZDCISA-N 0 3 416.484 4.324 20 0 HIADHN C/C=C\c1ccc(OC[C@H](O)CN2CC=C(c3c[nH]c4ncccc34)CC2)c(OC)c1 ZINC000533022036 931740612 /nfs/dbraw/zinc/74/06/12/931740612.db2.gz AXGFERCPCGPQJR-MNKBLEIRSA-N 0 3 419.525 4.134 20 0 HIADHN C/C=C/c1ccc(OC[C@H](O)CN2CC=C(c3c[nH]c4ncccc34)CC2)c(OC)c1 ZINC000533022035 931740940 /nfs/dbraw/zinc/74/09/40/931740940.db2.gz AXGFERCPCGPQJR-HQMUEHRGSA-N 0 3 419.525 4.134 20 0 HIADHN Cc1cc(C)n(-c2ccc(CN3CCC(NC(=O)c4ccccc4C)CC3)cc2)n1 ZINC000533036814 931748493 /nfs/dbraw/zinc/74/84/93/931748493.db2.gz RGVOJTABIPGQCW-UHFFFAOYSA-N 0 3 402.542 4.192 20 0 HIADHN Cc1cccc(NC2CCN(C[C@H](O)COc3cccc(C(F)(F)F)c3)CC2)c1 ZINC000533072866 931763332 /nfs/dbraw/zinc/76/33/32/931763332.db2.gz VVEGQKSDRVUZND-FQEVSTJZSA-N 0 3 408.464 4.330 20 0 HIADHN Cc1ccc(NC(=O)c2cccc(F)c2I)c(CN(C)C)c1 ZINC000533085238 931767674 /nfs/dbraw/zinc/76/76/74/931767674.db2.gz AMUYCKJCFQDFJL-UHFFFAOYSA-N 0 3 412.246 4.053 20 0 HIADHN COCCN1CCC[C@@H]1CNCc1nc(-c2cc(Cl)ccc2Cl)cs1 ZINC000533149337 931787530 /nfs/dbraw/zinc/78/75/30/931787530.db2.gz OYHHLFJTSBUIBP-CQSZACIVSA-N 0 3 400.375 4.317 20 0 HIADHN CC[C@@H](c1ccccc1)N(CC)CC(=O)N1CCC(NC(=O)c2ccccc2C)CC1 ZINC000533256622 931820759 /nfs/dbraw/zinc/82/07/59/931820759.db2.gz ZMPJHKIRJZYUGE-DEOSSOPVSA-N 0 3 421.585 4.189 20 0 HIADHN CCC[C@H](Cc1ccccc1)N(CCC)Cc1nnc2n1c1ccsc1c(=O)n2C ZINC000533262114 931822188 /nfs/dbraw/zinc/82/21/88/931822188.db2.gz GIXWTQYPUAWKQN-GOSISDBHSA-N 0 3 423.586 4.266 20 0 HIADHN CCCN(CC(=O)Nc1ccc(C)cc1Br)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000533293760 931831675 /nfs/dbraw/zinc/83/16/75/931831675.db2.gz SJAULWWSHKDOIS-GDIGMMSISA-N 0 3 409.368 4.222 20 0 HIADHN CC1(C)CCCN(CC(=O)N(Cc2nnc(-c3ccccc3Cl)o2)C2CC2)CC1 ZINC000533301811 931833848 /nfs/dbraw/zinc/83/38/48/931833848.db2.gz QLNZIUNXFVCAQT-UHFFFAOYSA-N 0 3 416.953 4.393 20 0 HIADHN COc1cc(OC)c(OC)cc1CNC(C)(C)COc1ncccc1C(F)(F)F ZINC000533315364 931837015 /nfs/dbraw/zinc/83/70/15/931837015.db2.gz OQDBOJPUIWQHNY-UHFFFAOYSA-N 0 3 414.424 4.073 20 0 HIADHN O[C@@H](COc1cccc2[nH]ccc21)CN1CCC[C@H](c2nc3ccccc3s2)C1 ZINC000533334970 931841121 /nfs/dbraw/zinc/84/11/21/931841121.db2.gz ZEVAGKMMLDTYFJ-DLBZAZTESA-N 0 3 407.539 4.397 20 0 HIADHN O=c1cc(CN(C2CC2)[C@@H]2CCc3ccccc32)nc2ccc(Br)cn12 ZINC000533353149 931846856 /nfs/dbraw/zinc/84/68/56/931846856.db2.gz RNVKBFPQVNUKRJ-LJQANCHMSA-N 0 3 410.315 4.109 20 0 HIADHN C[C@H](c1cccc(F)c1)N1CCC(C(=O)Nc2ccc(Br)cn2)CC1 ZINC000533354984 931847494 /nfs/dbraw/zinc/84/74/94/931847494.db2.gz QKXQEPATTDIGRS-CYBMUJFWSA-N 0 3 406.299 4.395 20 0 HIADHN Cc1cc(C)n(-c2ccc(CN3CC[C@H](NC(=O)Nc4ccc(F)cc4)C3)cc2)n1 ZINC000533364560 931848979 /nfs/dbraw/zinc/84/89/79/931848979.db2.gz QJVFOQMQROUNRH-NRFANRHFSA-N 0 3 407.493 4.024 20 0 HIADHN COc1cc(C)c([C@H](C)NC(=O)CN[C@@H](c2ccc(F)cc2)C2CCC2)cc1OC ZINC000533367896 931850159 /nfs/dbraw/zinc/85/01/59/931850159.db2.gz ZZSHDWMFBREHDL-UPCLLVRISA-N 0 3 414.521 4.460 20 0 HIADHN NC(=O)c1ccc(NC(=O)CCN2CCCC[C@@H]2c2ccccc2C(F)(F)F)cc1 ZINC000533369259 931850971 /nfs/dbraw/zinc/85/09/71/931850971.db2.gz HPNAROWCEPWMFM-LJQANCHMSA-N 0 3 419.447 4.360 20 0 HIADHN O=C(Nc1ccc(O)cc1)C1CCN(CCOc2cc(Cl)cc(Cl)c2)CC1 ZINC000533496590 931884818 /nfs/dbraw/zinc/88/48/18/931884818.db2.gz UTYXAVUOOJTDFO-UHFFFAOYSA-N 0 3 409.313 4.429 20 0 HIADHN Fc1cccc(-c2noc([C@H]3CCCN(Cc4cnn(-c5ccccc5)c4)C3)n2)c1 ZINC000533507219 931888150 /nfs/dbraw/zinc/88/81/50/931888150.db2.gz LFQOIKGVUNRMHG-IBGZPJMESA-N 0 3 403.461 4.441 20 0 HIADHN O=C(CNC1(c2ccccc2)CCOCC1)N1CC=C(c2c[nH]c3ccccc32)CC1 ZINC000533518882 931892547 /nfs/dbraw/zinc/89/25/47/931892547.db2.gz VLGFPYJYWYAUSM-UHFFFAOYSA-N 0 3 415.537 4.079 20 0 HIADHN Cc1nc2c(s1)[C@@H](N(C)C[C@@H](O)COc1cccc(C(F)(F)F)c1)CCC2 ZINC000533522977 931893843 /nfs/dbraw/zinc/89/38/43/931893843.db2.gz FYPLJWGVRNIGOI-PBHICJAKSA-N 0 3 400.466 4.219 20 0 HIADHN CCN(Cc1nc2ccccc2n1C)C1CCN(c2cc(C)nc(C(C)C)n2)CC1 ZINC000533533387 931896018 /nfs/dbraw/zinc/89/60/18/931896018.db2.gz QVJGTHHFSGTATJ-UHFFFAOYSA-N 0 3 406.578 4.286 20 0 HIADHN Cc1ccc(C2=NN(C(=O)CN(C(C)C)C3CCOCC3)[C@@H](c3ccco3)C2)cc1 ZINC000533533248 931896067 /nfs/dbraw/zinc/89/60/67/931896067.db2.gz UIHDZFUEILAPMW-JOCHJYFZSA-N 0 3 409.530 4.155 20 0 HIADHN Cc1cccc2nc(CN(C)[C@@H]3CCCN(Cc4cn5c(cccc5C)n4)CC3)cn21 ZINC000533606298 931919336 /nfs/dbraw/zinc/91/93/36/931919336.db2.gz KQUQBWOICCUTDJ-HSZRJFAPSA-N 0 3 416.573 4.085 20 0 HIADHN FC(F)(F)Oc1cccc(N2CC[C@H](NCc3cnc([C@@H]4CCCO4)s3)C2)c1 ZINC000533742785 932003537 /nfs/dbraw/zinc/00/35/37/932003537.db2.gz GVAIMBUNICHBCJ-GUYCJALGSA-N 0 3 413.465 4.262 20 0 HIADHN C[C@H](NCc1cnc([C@H]2CCCO2)s1)[C@H](OC1CCOCC1)c1ccccc1 ZINC000533756612 932011985 /nfs/dbraw/zinc/01/19/85/932011985.db2.gz NDAHIDUPYHPVSK-DQLDELGASA-N 0 3 402.560 4.410 20 0 HIADHN Cc1nc(-c2cccc(C)c2)[nH]c1C(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000533843849 932057375 /nfs/dbraw/zinc/05/73/75/932057375.db2.gz UQOPQWIFOALCQT-RTBURBONSA-N 0 3 424.589 4.045 20 0 HIADHN CN1CC[C@H](NC(=O)NCc2cccc(NC(=O)C3CCCC3)c2)[C@H]1c1ccccc1 ZINC000533890789 932083709 /nfs/dbraw/zinc/08/37/09/932083709.db2.gz IORQJFWCWZZRQC-XZOQPEGZSA-N 0 3 420.557 4.060 20 0 HIADHN CN1CC[C@@H](NC(=O)NCc2nc3cc(Cl)ccc3s2)[C@H]1c1ccccc1 ZINC000533893424 932085944 /nfs/dbraw/zinc/08/59/44/932085944.db2.gz XCAFVZXEWVSTEE-DNVCBOLYSA-N 0 3 400.935 4.194 20 0 HIADHN CN1CC[C@@H](NC(=O)NCCc2nc3cc(Cl)ccc3s2)[C@@H]1c1ccccc1 ZINC000533913789 932096622 /nfs/dbraw/zinc/09/66/22/932096622.db2.gz XLNXCOGDWRPYRO-UZLBHIALSA-N 0 3 414.962 4.237 20 0 HIADHN CN(Cc1csc(Br)c1)C(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000533945248 932118363 /nfs/dbraw/zinc/11/83/63/932118363.db2.gz SXJPTMQMWBCLGN-WBVHZDCISA-N 0 3 408.365 4.097 20 0 HIADHN CN(Cc1csc(Br)c1)C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000533945246 932118990 /nfs/dbraw/zinc/11/89/90/932118990.db2.gz SXJPTMQMWBCLGN-NVXWUHKLSA-N 0 3 408.365 4.097 20 0 HIADHN CN1CC[C@H](NC(=O)N2CCC[C@H](c3nc4ccc(F)cc4o3)C2)[C@H]1c1ccccc1 ZINC000533949291 932123491 /nfs/dbraw/zinc/12/34/91/932123491.db2.gz OFOSIICHYDDYGV-RBDMOPTHSA-N 0 3 422.504 4.301 20 0 HIADHN CSc1cccc(N(C(=O)c2ccc3c(c2)CCC(=O)N3C)C2CCN(C)CC2)c1 ZINC000534000303 932182254 /nfs/dbraw/zinc/18/22/54/932182254.db2.gz JEXKNTZYACYSPC-UHFFFAOYSA-N 0 3 423.582 4.059 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1cc2c(cc1Cl)OCO2)c1cccc(OC)c1 ZINC000534024624 932205370 /nfs/dbraw/zinc/20/53/70/932205370.db2.gz FWWJAICIIWOOCX-SFHVURJKSA-N 0 3 419.909 4.282 20 0 HIADHN CN(C(=O)Nc1cc2c(cc1Cl)OCO2)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000534027991 932208066 /nfs/dbraw/zinc/20/80/66/932208066.db2.gz WJIJRJSVMOFOIW-INIZCTEOSA-N 0 3 401.894 4.197 20 0 HIADHN Cc1cc(CN2CCC(OC[C@@H]3CCOC3)CC2)nc(-c2ccc(Cl)cc2)n1 ZINC000534129743 932294135 /nfs/dbraw/zinc/29/41/35/932294135.db2.gz QMSMSJAYXDVPJR-QGZVFWFLSA-N 0 3 401.938 4.123 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)CCCc3cc(F)ccc3F)c(C)c2)CC1 ZINC000534140993 932300361 /nfs/dbraw/zinc/30/03/61/932300361.db2.gz CZESAIDBJWMHNC-UHFFFAOYSA-N 0 3 401.501 4.377 20 0 HIADHN Cc1c2cccc(Cl)c2oc1C(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1CO ZINC000534181800 932319055 /nfs/dbraw/zinc/31/90/55/932319055.db2.gz MAKJKMMYLZASSX-YLJYHZDGSA-N 0 3 412.917 4.007 20 0 HIADHN CN(C)CCN(Cc1cccc(O)c1)C(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000534190412 932323179 /nfs/dbraw/zinc/32/31/79/932323179.db2.gz DPJUCOPCSPTJBY-VQTJNVASSA-N 0 3 406.448 4.105 20 0 HIADHN CCNC(=O)COc1ccc(CN[C@@H]2CCCc3ccc(Cl)cc32)cc1OC ZINC000534237022 932357321 /nfs/dbraw/zinc/35/73/21/932357321.db2.gz HKPBPHWQZZYJGS-LJQANCHMSA-N 0 3 402.922 4.031 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cn(C)nc1C(F)F)c1ccc(C(F)(F)F)cc1 ZINC000534359986 932393913 /nfs/dbraw/zinc/39/39/13/932393913.db2.gz OBLRSEHSVZCJIA-HNNXBMFYSA-N 0 3 418.410 4.189 20 0 HIADHN Cc1cc(C)c(CC(C(=O)Nc2ccc(OCCC(N)=O)cc2)C(F)(F)F)c(C)c1 ZINC000534401080 932425330 /nfs/dbraw/zinc/42/53/30/932425330.db2.gz CGMKXDUXQGPXBJ-LJQANCHMSA-N 0 3 422.447 4.226 20 0 HIADHN CC[C@@H](NCc1nc2cc(Cl)ccc2n1C)[C@H](c1ccc(C)cc1)n1cncn1 ZINC000534453873 932468640 /nfs/dbraw/zinc/46/86/40/932468640.db2.gz UKVUQMBQCSNAOA-GCJKJVERSA-N 0 3 408.937 4.284 20 0 HIADHN Cc1cc(C)c(CC(C(=O)Nc2cc(-c3nccn3C)[nH]n2)C(F)(F)F)c(C)c1 ZINC000534494088 932529984 /nfs/dbraw/zinc/52/99/84/932529984.db2.gz VGYIJWIORBGKQH-OAHLLOKOSA-N 0 3 405.424 4.095 20 0 HIADHN CN(C)[C@@H](CNC(=O)C1(c2ccc(Br)cc2)CCC1)Cc1ccccc1 ZINC000534521255 932543433 /nfs/dbraw/zinc/54/34/33/932543433.db2.gz ANELVKZVTFRQEO-HXUWFJFHSA-N 0 3 415.375 4.160 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cc(OC)c(Br)s1)c1ccsc1 ZINC000534652803 932624100 /nfs/dbraw/zinc/62/41/00/932624100.db2.gz RJSBCFPFZCCZRU-LBPRGKRZSA-N 0 3 417.394 4.394 20 0 HIADHN CN(Cc1ccc(Br)s1)C(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000534681647 932652281 /nfs/dbraw/zinc/65/22/81/932652281.db2.gz KBPKANCOFULHGF-WBVHZDCISA-N 0 3 408.365 4.097 20 0 HIADHN CN1CC[C@H](NC(=O)N2CCn3cccc3[C@H]2c2ccccc2)[C@@H]1c1ccccc1 ZINC000534721025 932689007 /nfs/dbraw/zinc/68/90/07/932689007.db2.gz ITTJXYBGNXTISH-OEMFJLHTSA-N 0 3 400.526 4.048 20 0 HIADHN CN1CC[C@@H](NC(=O)NC2(c3cccc(Br)c3)CC2)[C@H]1c1ccccc1 ZINC000534724186 932693151 /nfs/dbraw/zinc/69/31/51/932693151.db2.gz SIBBIWSVVDYAIK-RTBURBONSA-N 0 3 414.347 4.183 20 0 HIADHN Cc1cc(C(=O)N(CCN(C)C)Cc2ccco2)ccc1NC(=O)c1cccs1 ZINC000534725288 932694012 /nfs/dbraw/zinc/69/40/12/932694012.db2.gz HODMACRDKSSSSJ-UHFFFAOYSA-N 0 3 411.527 4.106 20 0 HIADHN Cc1ccc(-c2ncco2)cc1NC(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000534739323 932708785 /nfs/dbraw/zinc/70/87/85/932708785.db2.gz QPWQKFMMFJMEHS-QZTJIDSGSA-N 0 3 412.534 4.003 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1cc2c(cc1Cl)OCO2 ZINC000534759645 932737454 /nfs/dbraw/zinc/73/74/54/932737454.db2.gz BMZUYGYYBOHMEH-OAHLLOKOSA-N 0 3 401.894 4.197 20 0 HIADHN CC(=O)c1ccc(Oc2ccc(C(=O)NCCCCN3C[C@@H](C)O[C@H](C)C3)cc2)cc1 ZINC000534883024 932821738 /nfs/dbraw/zinc/82/17/38/932821738.db2.gz SIOSZGZSTKQFGZ-RTBURBONSA-N 0 3 424.541 4.301 20 0 HIADHN COc1ccc(C[C@@H](C)CN(C)[C@H](C)C(=O)Nc2ccccc2OC(F)F)cc1 ZINC000534913511 932836565 /nfs/dbraw/zinc/83/65/65/932836565.db2.gz ZMLHJSQKBVKEPR-HZPDHXFCSA-N 0 3 406.473 4.434 20 0 HIADHN CN(C)CCN(Cc1cccc(O)c1)C(=O)CSc1cccc(C(F)(F)F)c1 ZINC000534925513 932841172 /nfs/dbraw/zinc/84/11/72/932841172.db2.gz LQEPSGPSUBBXJU-UHFFFAOYSA-N 0 3 412.477 4.094 20 0 HIADHN CCOc1ccc(C2=CCN(C(=O)[C@H]3CCCN(Cc4cccnc4)C3)CC2)cc1 ZINC000535072994 932897456 /nfs/dbraw/zinc/89/74/56/932897456.db2.gz KPQZMLWVDCOPTG-QHCPKHFHSA-N 0 3 405.542 4.008 20 0 HIADHN O=C1NCCN1[C@H]1CCCN(Cc2ccc(-c3cccc(Br)c3)s2)C1 ZINC000535083196 932899814 /nfs/dbraw/zinc/89/98/14/932899814.db2.gz PWZOJXUETTYEPF-INIZCTEOSA-N 0 3 420.376 4.167 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)Nc1cccnc1-c1ccccc1 ZINC000535110975 932927481 /nfs/dbraw/zinc/92/74/81/932927481.db2.gz KWWQXLYYMOTVPD-UHFFFAOYSA-N 0 3 416.525 4.027 20 0 HIADHN C[C@H](Cc1cccc(Cl)c1)C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000535135256 932955284 /nfs/dbraw/zinc/95/52/84/932955284.db2.gz UOJPRYALQARLEO-QGZVFWFLSA-N 0 3 418.940 4.317 20 0 HIADHN CN(C)CCn1cc(NC(=O)c2sc3cc(Cl)ccc3c2Cl)ccc1=O ZINC000535230330 933029519 /nfs/dbraw/zinc/02/95/19/933029519.db2.gz RTXCVCAHLKABAI-UHFFFAOYSA-N 0 3 410.326 4.184 20 0 HIADHN Cc1nc(C(C)C)sc1[C@@H](C)N(C)C(=O)NC[C@H](Cc1ccccc1)N(C)C ZINC000535266576 933042589 /nfs/dbraw/zinc/04/25/89/933042589.db2.gz XACAMUFQBDBCEY-MJGOQNOKSA-N 0 3 402.608 4.450 20 0 HIADHN Cc1cc(C)c(CC(C(=O)Nc2cc(C(=O)N(C)C)ccn2)C(F)(F)F)c(C)c1 ZINC000535269928 933043744 /nfs/dbraw/zinc/04/37/44/933043744.db2.gz NANNQVKPUWNIDR-QGZVFWFLSA-N 0 3 407.436 4.068 20 0 HIADHN CC1CCN([C@@H](CNC(=O)N2CC=C(C(F)(F)F)CC2)c2cccs2)CC1 ZINC000535273102 933044903 /nfs/dbraw/zinc/04/49/03/933044903.db2.gz XDQAARVIQRPKEX-INIZCTEOSA-N 0 3 401.498 4.425 20 0 HIADHN Cc1cc(C(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)ccc1Br ZINC000535287604 933050899 /nfs/dbraw/zinc/05/08/99/933050899.db2.gz JKDJBBHGPYJBFZ-CALCHBBNSA-N 0 3 423.395 4.109 20 0 HIADHN O=C(NC[C@@H]1CCCN(Cc2cccs2)C1)c1ccn(-c2ccc(Cl)cc2)n1 ZINC000535300630 933058576 /nfs/dbraw/zinc/05/85/76/933058576.db2.gz ZVPSSQXGFKUKCC-INIZCTEOSA-N 0 3 414.962 4.229 20 0 HIADHN CN1CC[C@H](NC(=O)NCc2ccc(Oc3cccc(F)c3)nc2)[C@@H]1c1ccccc1 ZINC000535338654 933081118 /nfs/dbraw/zinc/08/11/18/933081118.db2.gz BEFNNKUGWOXHFA-GMAHTHKFSA-N 0 3 420.488 4.258 20 0 HIADHN Cc1cc(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)ccc1NC(=O)c1cccs1 ZINC000535372238 933099049 /nfs/dbraw/zinc/09/90/49/933099049.db2.gz FTSGMXWSDDHIPI-FQEVSTJZSA-N 0 3 419.550 4.313 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)c2nccnc2C(=O)Nc2ccc(Cl)cc2)c1 ZINC000535415240 933124319 /nfs/dbraw/zinc/12/43/19/933124319.db2.gz UPQOYNPFUUNMEK-UHFFFAOYSA-N 0 3 423.904 4.005 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)c2cc(=O)[nH]c3c(Br)cccc23)c1 ZINC000535421058 933127815 /nfs/dbraw/zinc/12/78/15/933127815.db2.gz HBDARTQWRQVZKX-UHFFFAOYSA-N 0 3 414.303 4.325 20 0 HIADHN CN1CC[C@H](NC(=O)NCc2ccnc(Oc3ccc(F)cc3)c2)[C@@H]1c1ccccc1 ZINC000535432087 933131883 /nfs/dbraw/zinc/13/18/83/933131883.db2.gz HWHXGFHUHBQYPM-GMAHTHKFSA-N 0 3 420.488 4.258 20 0 HIADHN CCc1ccc([C@H](CNC(=O)NC[C@@H](C)c2nc(-c3ccccc3)no2)N(C)C)cc1 ZINC000535520516 933210887 /nfs/dbraw/zinc/21/08/87/933210887.db2.gz QAJWJOARQOABNU-UTKZUKDTSA-N 0 3 421.545 4.005 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)NC[C@@H](C)c2nc(-c3ccccc3)no2)N(C)C)cc1 ZINC000535520512 933210949 /nfs/dbraw/zinc/21/09/49/933210949.db2.gz QAJWJOARQOABNU-DYESRHJHSA-N 0 3 421.545 4.005 20 0 HIADHN COc1ccc(-c2nn(Cc3ccccc3)cc2CNC[C@@](C)(O)C(F)(F)F)cc1 ZINC000535543319 933234286 /nfs/dbraw/zinc/23/42/86/933234286.db2.gz OJPXVNNXZUHQQX-OAQYLSRUSA-N 0 3 419.447 4.010 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)c1cccc([C@H]2CCOC2)c1 ZINC000535606910 933264938 /nfs/dbraw/zinc/26/49/38/933264938.db2.gz VWLBHZVKRMHCQQ-XZOQPEGZSA-N 0 3 416.525 4.086 20 0 HIADHN C[C@H](Oc1ccc(C(=O)N(CCN(C)C)Cc2cccc(O)c2)cn1)c1ccccc1 ZINC000535638413 933279270 /nfs/dbraw/zinc/27/92/70/933279270.db2.gz POIARSKPNVBATP-IBGZPJMESA-N 0 3 419.525 4.131 20 0 HIADHN Cc1ccc2[nH]c([C@H]3CCCN([C@@H](C)C(=O)N(C)Cc4cccc(F)c4)C3)nc2c1 ZINC000535666571 933312256 /nfs/dbraw/zinc/31/22/56/933312256.db2.gz VVWBNTIGKLLOBB-HKUYNNGSSA-N 0 3 408.521 4.237 20 0 HIADHN Cc1ccc2nc([C@H]3CCCN([C@@H](C)C(=O)N(C)Cc4cccc(F)c4)C3)[nH]c2c1 ZINC000535666571 933312262 /nfs/dbraw/zinc/31/22/62/933312262.db2.gz VVWBNTIGKLLOBB-HKUYNNGSSA-N 0 3 408.521 4.237 20 0 HIADHN CCN(CC)[C@@H](C(=O)N(C)CCCn1ccnc1C)c1cccc(C(F)(F)F)c1 ZINC000535837328 933423589 /nfs/dbraw/zinc/42/35/89/933423589.db2.gz QBKIYJIUYFWIIV-LJQANCHMSA-N 0 3 410.484 4.142 20 0 HIADHN COc1ccc(C(=O)N(Cc2ccco2)C2CCN(C)CC2)cc1-c1ccccn1 ZINC000535847859 933430429 /nfs/dbraw/zinc/43/04/29/933430429.db2.gz OQURGAFYBJTIHU-UHFFFAOYSA-N 0 3 405.498 4.087 20 0 HIADHN COc1ccc(C(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)cc1-c1ccccn1 ZINC000535854204 933438215 /nfs/dbraw/zinc/43/82/15/933438215.db2.gz HATRPNSPSXEPNO-FQEVSTJZSA-N 0 3 415.537 4.494 20 0 HIADHN CNC(=O)COc1ccc(NC(=O)C(Cc2c(C)cc(C)cc2C)C(F)(F)F)cc1 ZINC000535909421 933485528 /nfs/dbraw/zinc/48/55/28/933485528.db2.gz HEXPVPHWYBITKX-IBGZPJMESA-N 0 3 422.447 4.096 20 0 HIADHN O[C@@H](CNCc1ccc(F)c(C(F)(F)F)c1)COc1ccccc1Br ZINC000535941866 933509065 /nfs/dbraw/zinc/50/90/65/933509065.db2.gz FEQWNEFPZABITA-LBPRGKRZSA-N 0 3 422.216 4.137 20 0 HIADHN Cc1nc2ccccc2n1C[C@H]1CCCN1CC(=O)N[C@@H]1CCCc2ccccc21 ZINC000535965811 933527787 /nfs/dbraw/zinc/52/77/87/933527787.db2.gz NDHHKRVCPFDQHW-IFMALSPDSA-N 0 3 402.542 4.003 20 0 HIADHN Cc1nc(-c2ccc(C)cc2)c(CC(=O)NC[C@@H](Cc2ccccc2)N(C)C)s1 ZINC000536013640 933570929 /nfs/dbraw/zinc/57/09/29/933570929.db2.gz DIRCDZDBQNRTMV-OAQYLSRUSA-N 0 3 407.583 4.259 20 0 HIADHN CCOc1ccc(-c2nc(CC(=O)NC[C@H](Cc3ccccc3)N(C)C)cs2)cc1 ZINC000536013717 933571517 /nfs/dbraw/zinc/57/15/17/933571517.db2.gz JQQXQTQYMHCUIW-NRFANRHFSA-N 0 3 423.582 4.040 20 0 HIADHN O=C(NC[C@@H]1CCCCN1Cc1ccccc1)[C@@H](OC1CCOCC1)c1ccccc1 ZINC000536093696 933642659 /nfs/dbraw/zinc/64/26/59/933642659.db2.gz AYBWNPCQXBUEIA-ZCYQVOJMSA-N 0 3 422.569 4.094 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)c1ncccc1C(F)(F)F ZINC000536113565 933663797 /nfs/dbraw/zinc/66/37/97/933663797.db2.gz QEEJUPDATDAPQK-UHFFFAOYSA-N 0 3 419.369 4.323 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)c1ccc(C(=O)Nc2ccccc2)cc1 ZINC000536166848 933692378 /nfs/dbraw/zinc/69/23/78/933692378.db2.gz ABLAWNKMAOQDDM-UHFFFAOYSA-N 0 3 423.582 4.030 20 0 HIADHN C[C@H](N[C@@H](c1ccc2c(c1)OCCO2)C1CC1)C(=O)N1CCC[C@@H]1c1cccs1 ZINC000537289810 933699586 /nfs/dbraw/zinc/69/95/86/933699586.db2.gz JPVJNMTWSLGOSN-QXATTWAWSA-N 0 3 412.555 4.312 20 0 HIADHN C[C@H](NCc1ccc([C@@]2(C)NC(=O)NC2=O)cc1)c1cc2c(ccc3ccccc23)o1 ZINC000537293358 933700732 /nfs/dbraw/zinc/70/07/32/933700732.db2.gz ODJSTPXBBPPVQI-ODCWNRFASA-N 0 3 413.477 4.491 20 0 HIADHN CCC1(CC)[C@H](N[C@@H](c2ccccc2)c2cccc(S(C)(=O)=O)c2)C[C@@H]1OC ZINC000537296952 933703456 /nfs/dbraw/zinc/70/34/56/933703456.db2.gz ZMPPGDASEHGAEG-FSSWDIPSSA-N 0 3 401.572 4.363 20 0 HIADHN CC[C@H](N[C@H]1CCO[C@@H]1c1ccc(F)c(F)c1)c1ccccc1OCC(=O)N(C)C ZINC000537303164 933705538 /nfs/dbraw/zinc/70/55/38/933705538.db2.gz CVKMKRBSGNJHLE-SXWKCWPCSA-N 0 3 418.484 4.003 20 0 HIADHN CC1CCN([C@@H](CNC(=O)N2CCC[C@@H]2C2CCOCC2)c2cccs2)CC1 ZINC000537413299 933763760 /nfs/dbraw/zinc/76/37/60/933763760.db2.gz JXGSCEOMKUBFIM-UXHICEINSA-N 0 3 405.608 4.122 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)C[C@@H](C)NC1(c2ccc3c(c2)OCO3)CC1 ZINC000537448757 933777895 /nfs/dbraw/zinc/77/78/95/933777895.db2.gz FGRWCSVROUVIPE-CYBMUJFWSA-N 0 3 402.878 4.073 20 0 HIADHN CCCN(C)[C@H](CNC(=O)Nc1nc2c(s1)COCC2)c1ccc(Cl)cc1 ZINC000562877963 945137955 /nfs/dbraw/zinc/13/79/55/945137955.db2.gz IUODJAVKCIPDLK-MRXNPFEDSA-N 0 3 408.955 4.074 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)N[C@@H]1CCCOc2cc(F)ccc21 ZINC000537564801 938326626 /nfs/dbraw/zinc/32/66/26/938326626.db2.gz JKWHAWALYBKRHM-MSOLQXFVSA-N 0 3 403.523 4.237 20 0 HIADHN COc1cc(OC)cc(Oc2ccc(CN3CCC(N4CCCCC4=O)CC3)cc2)c1 ZINC000537619532 938335170 /nfs/dbraw/zinc/33/51/70/938335170.db2.gz GQXYDWZAVBTOQB-UHFFFAOYSA-N 0 3 424.541 4.473 20 0 HIADHN C[NH+](C)CCOc1ccc([N-]S(=O)(=O)c2ccc3oc4ccccc4c3c2)cc1 ZINC000537621660 938336879 /nfs/dbraw/zinc/33/68/79/938336879.db2.gz BMKDPRKQMSLKCX-UHFFFAOYSA-N 0 3 410.495 4.327 20 0 HIADHN COCCOC1CCN(Cc2cn(-c3ccccc3)nc2-c2ccc(F)cc2)CC1 ZINC000537629049 938340214 /nfs/dbraw/zinc/34/02/14/938340214.db2.gz JLPLKDIKLSJDMA-UHFFFAOYSA-N 0 3 409.505 4.306 20 0 HIADHN CCCN1CCN(c2ccccc2CN(CC)CC(=O)Nc2c(C)cccc2C)CC1 ZINC000537632841 938341401 /nfs/dbraw/zinc/34/14/01/938341401.db2.gz USJWKIMYOVGWMK-UHFFFAOYSA-N 0 3 422.617 4.296 20 0 HIADHN CC(C)(C)c1nn(-c2ccccc2)cc1CN1CCC(CN2CCCCC2=O)CC1 ZINC000537636073 938342536 /nfs/dbraw/zinc/34/25/36/938342536.db2.gz JZEDEHCURYHJMY-UHFFFAOYSA-N 0 3 408.590 4.394 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)CCn2c3ccccc3nc2C2CC2)CC1 ZINC000537672445 938350825 /nfs/dbraw/zinc/35/08/25/938350825.db2.gz XCKUZQZKDFWQTR-GOSISDBHSA-N 0 3 417.557 4.041 20 0 HIADHN CC(C)(C)OC(=O)C1CCC(NC(=O)NC[C@H](c2cccs2)N2CCCC2)CC1 ZINC000537689735 938355198 /nfs/dbraw/zinc/35/51/98/938355198.db2.gz VVYSCMAFDGINMQ-DAWZGUTISA-N 0 3 421.607 4.085 20 0 HIADHN CCOC(=O)c1c2c(sc1NC(=O)C1C[C@@H](C)O[C@H](C)C1)C(C)(C)NC(C)(C)C2 ZINC000537710520 938361273 /nfs/dbraw/zinc/36/12/73/938361273.db2.gz PWJSFJJWILEDTH-CHWSQXEVSA-N 0 3 422.591 4.226 20 0 HIADHN Cc1ccc(Cl)cc1NC(=O)C[C@@H](C)N[C@H]1CC(=O)N(c2c(F)cccc2F)C1 ZINC000537765758 938372655 /nfs/dbraw/zinc/37/26/55/938372655.db2.gz STUCYHHLEFGVHO-HIFRSBDPSA-N 0 3 421.875 4.039 20 0 HIADHN Cc1ccc(NC(=O)C[C@@H](C)N[C@H]2CC(=O)N(c3c(F)cccc3F)C2)c(Cl)c1 ZINC000537767594 938372906 /nfs/dbraw/zinc/37/29/06/938372906.db2.gz KHAJHSRFJRNGMX-KGLIPLIRSA-N 0 3 421.875 4.039 20 0 HIADHN C[C@H](C(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1)C(F)(F)F ZINC000537827153 938385063 /nfs/dbraw/zinc/38/50/63/938385063.db2.gz FOEYBJRVALAJJL-QGZVFWFLSA-N 0 3 405.464 4.188 20 0 HIADHN CC1CCN([C@@H](CNC(=O)c2cn(C)nc2-c2ccccc2)c2cccs2)CC1 ZINC000537855953 938391387 /nfs/dbraw/zinc/39/13/87/938391387.db2.gz SDPARHXQXQHALU-FQEVSTJZSA-N 0 3 408.571 4.352 20 0 HIADHN CSc1cc(CNC(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)ccn1 ZINC000537868470 938395084 /nfs/dbraw/zinc/39/50/84/938395084.db2.gz JCUJGLAHEMISMC-QGZVFWFLSA-N 0 3 404.605 4.137 20 0 HIADHN CC[C@H](N[C@@H](C)c1ccc(NC(C)=O)cc1OC)[C@H](c1ccc(C)cc1)n1cncn1 ZINC000537948965 938428757 /nfs/dbraw/zinc/42/87/57/938428757.db2.gz NEUSXZLCJQLALV-OWSXEPHWSA-N 0 3 421.545 4.272 20 0 HIADHN Cc1cc([C@H](N[C@@H](C)c2cccc(N3CCCS3(=O)=O)c2)C2CC2)ccc1F ZINC000537952758 938430755 /nfs/dbraw/zinc/43/07/55/938430755.db2.gz RXYZSTOCCCNRIH-KSFYIVLOSA-N 0 3 402.535 4.476 20 0 HIADHN COc1ccc([C@H](C)NC(=O)NC[C@H](c2cccs2)N2CCCC2)c(C)c1OC ZINC000563308156 945173958 /nfs/dbraw/zinc/17/39/58/945173958.db2.gz PWQLORZVUULPDB-FUHWJXTLSA-N 0 3 417.575 4.271 20 0 HIADHN C[C@@H](N[C@@H]1CCc2ccc(F)cc21)c1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000537975706 938443555 /nfs/dbraw/zinc/44/35/55/938443555.db2.gz ZFQPJKFHTKAHMN-OPAMFIHVSA-N 0 3 402.535 4.338 20 0 HIADHN C[C@H](N[C@H]1CCc2c1cccc2Br)c1cccc(NS(C)(=O)=O)c1 ZINC000537976007 938443593 /nfs/dbraw/zinc/44/35/93/938443593.db2.gz JDQXYFNKPMGQAS-SGTLLEGYSA-N 0 3 409.349 4.159 20 0 HIADHN CCc1noc(-c2ccc(CCN[C@@H](C)c3nnn(-c4ccc(F)cc4)c3C)cc2)n1 ZINC000537976449 938443870 /nfs/dbraw/zinc/44/38/70/938443870.db2.gz XPTUDXQAVDVEPR-HNNXBMFYSA-N 0 3 420.492 4.221 20 0 HIADHN COc1cc(F)c([C@H](C)NCCc2nc(-c3cccc(Cl)c3)no2)cc1OC ZINC000537981327 938446472 /nfs/dbraw/zinc/44/64/72/938446472.db2.gz GPRPXFFWIHRJEY-LBPRGKRZSA-N 0 3 405.857 4.440 20 0 HIADHN COc1cc(NC(C)=O)ccc1[C@H](C)NCCOc1cccc(Br)c1 ZINC000537985710 938449265 /nfs/dbraw/zinc/44/92/65/938449265.db2.gz DPMLQGQVVHFFRF-ZDUSSCGKSA-N 0 3 407.308 4.146 20 0 HIADHN C[C@@H](NCCCOC1CCOCC1)c1ccc(Br)cc1Br ZINC000537987186 938449936 /nfs/dbraw/zinc/44/99/36/938449936.db2.gz NSIXLSXHOMSBFN-GFCCVEGCSA-N 0 3 421.173 4.448 20 0 HIADHN C[C@H](NCc1ccc(C(=O)N2C[C@@H](C)O[C@H](C)C2)cc1)c1ccc(OC(F)F)cc1 ZINC000537990011 938451271 /nfs/dbraw/zinc/45/12/71/938451271.db2.gz FOAIGCRLYMCSSB-ZACQAIPSSA-N 0 3 418.484 4.388 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)Nc3ccc(F)cc3OCC(F)F)cc2)CC1 ZINC000537995091 938455369 /nfs/dbraw/zinc/45/53/69/938455369.db2.gz KUEYTPYWLBFREZ-UHFFFAOYSA-N 0 3 421.463 4.252 20 0 HIADHN C[C@@H](N[C@@H]1CC(=O)N(c2cccc(C(F)(F)F)c2)C1)c1ccc2c(c1)CCC(=O)N2 ZINC000538021833 938466423 /nfs/dbraw/zinc/46/64/23/938466423.db2.gz UZZCTWLMSRTFTD-CXAGYDPISA-N 0 3 417.431 4.046 20 0 HIADHN CCCN1c2ccc(NC(=O)NC[C@@H](C)N(C)Cc3ccccc3)cc2CCC1=O ZINC000538031394 938473123 /nfs/dbraw/zinc/47/31/23/938473123.db2.gz BJLJHYCMCAGDSQ-GOSISDBHSA-N 0 3 408.546 4.018 20 0 HIADHN CCOc1ccc([C@@H](N[C@H](C)c2cccc(S(N)(=O)=O)c2)C(C)C)cc1OCC ZINC000538061506 938491530 /nfs/dbraw/zinc/49/15/30/938491530.db2.gz UHNFCTBKKCQSIF-ZHRRBRCNSA-N 0 3 420.575 4.179 20 0 HIADHN CC(C)[C@@H](NCc1ccc(N2C[C@@H](C)O[C@@H](C)C2)nc1)c1ccc2[nH]c(=O)oc2c1 ZINC000538062032 938491580 /nfs/dbraw/zinc/49/15/80/938491580.db2.gz KLEWFIZKUFFBHJ-ZMPRRUGASA-N 0 3 410.518 4.029 20 0 HIADHN COc1ccc([C@@H](NCc2ccc(S(=O)(=O)N3CCCCC3)cc2)C(C)C)cc1 ZINC000538114812 938506006 /nfs/dbraw/zinc/50/60/06/938506006.db2.gz GTFNKGTWGWUXFP-QHCPKHFHSA-N 0 3 416.587 4.357 20 0 HIADHN Cc1nnnn1-c1ccc(F)c(NC(=O)CN[C@@H](c2ccc(C(C)C)cc2)C(C)C)c1 ZINC000538139967 938517331 /nfs/dbraw/zinc/51/73/31/938517331.db2.gz IEPPRQGAFRZTGZ-HSZRJFAPSA-N 0 3 424.524 4.159 20 0 HIADHN Cc1ccc([C@@H](CN2CCOCC2)NCc2ccc(OCc3cccnc3)cc2)cc1 ZINC000538141598 938517718 /nfs/dbraw/zinc/51/77/18/938517718.db2.gz SAQYUSIWDLXEJY-AREMUKBSSA-N 0 3 417.553 4.132 20 0 HIADHN O=C(CNC1(c2ccc3c(c2)OCCO3)CCCC1)Nc1ccccc1C(F)(F)F ZINC000538141473 938518288 /nfs/dbraw/zinc/51/82/88/938518288.db2.gz OAXVFKUHGCCLKD-UHFFFAOYSA-N 0 3 420.431 4.474 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@H](C)N[C@@H](CCOC)c2ccccc2)cc1 ZINC000538144417 938519415 /nfs/dbraw/zinc/51/94/15/938519415.db2.gz PUUCLCCDGPLXKT-AVRDEDQJSA-N 0 3 404.576 4.146 20 0 HIADHN CC[C@@H](NCC(=O)N1c2ccccc2NC(=O)C[C@@H]1C(F)(F)F)c1ccc(C)cc1 ZINC000538155053 938526355 /nfs/dbraw/zinc/52/63/55/938526355.db2.gz IVJAYXXNKWGLSZ-VQIMIIECSA-N 0 3 419.447 4.342 20 0 HIADHN Cc1ccccc1-n1nccc1NC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C ZINC000538158313 938528653 /nfs/dbraw/zinc/52/86/53/938528653.db2.gz SYKVLNGWBZMNLU-FQEVSTJZSA-N 0 3 403.530 4.309 20 0 HIADHN C[C@@H](NCC(=O)N(C)[C@H](C)c1cc2ccccc2o1)c1ccccc1-n1cccn1 ZINC000538159325 938528763 /nfs/dbraw/zinc/52/87/63/938528763.db2.gz BCHCGSWMCAPKGA-QZTJIDSGSA-N 0 3 402.498 4.489 20 0 HIADHN CCC(CC)[C@@H](NCC(=O)NCC(=O)Nc1c(C)cc(C)cc1C)c1cccs1 ZINC000538177631 938539335 /nfs/dbraw/zinc/53/93/35/938539335.db2.gz ZKPGFTIJGWPFCA-HSZRJFAPSA-N 0 3 415.603 4.495 20 0 HIADHN CC(C)(C)C[C@@H](NCC(=O)Nc1ccc(CN2CCOCC2)cc1)c1ccccc1 ZINC000538179105 938540012 /nfs/dbraw/zinc/54/00/12/938540012.db2.gz KHWLTEJBMYYIQB-HSZRJFAPSA-N 0 3 409.574 4.224 20 0 HIADHN O=C(N[C@@H]1CCO[C@H]1c1ccc(Cl)cc1)N1CCCN(Cc2ccccc2)CC1 ZINC000538191531 938547116 /nfs/dbraw/zinc/54/71/16/938547116.db2.gz PELBIKZKCHOTPW-YADHBBJMSA-N 0 3 413.949 4.088 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(NC(=O)c2ccncc2)cc1)C(=O)N(C)Cc1ccccc1 ZINC000538194804 938548766 /nfs/dbraw/zinc/54/87/66/938548766.db2.gz LQCFEEQOUPHANB-RBUKOAKNSA-N 0 3 416.525 4.032 20 0 HIADHN CC[C@@H]1CCCCN1C(=O)[C@H](C)N[C@@H](C)c1ccc(NC(=O)c2ccncc2)cc1 ZINC000538197815 938550160 /nfs/dbraw/zinc/55/01/60/938550160.db2.gz LLOQTHGWPUNMNC-NPPFBWRTSA-N 0 3 408.546 4.164 20 0 HIADHN O=C(CN[C@H](c1ccc(Cl)cc1)C1CCCC1)Nc1nnc(-c2ccco2)o1 ZINC000538205079 938553779 /nfs/dbraw/zinc/55/37/79/938553779.db2.gz DQMGCEAJQPJZRR-SFHVURJKSA-N 0 3 400.866 4.443 20 0 HIADHN C[C@@H](NC[C@@H](O)COc1cc(Cl)ccc1Cl)c1cccc(N2CCCC2=O)c1 ZINC000538208482 938555917 /nfs/dbraw/zinc/55/59/17/938555917.db2.gz QAZBIPMEYVSONN-RDTXWAMCSA-N 0 3 423.340 4.211 20 0 HIADHN O=C1CCCN1CCN[C@@H](COc1cccc(F)c1)c1cccc(C(F)(F)F)c1 ZINC000538219141 938561796 /nfs/dbraw/zinc/56/17/96/938561796.db2.gz AIDNZZQNIKUMTD-IBGZPJMESA-N 0 3 410.411 4.177 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(-n2ccnn2)cc1)C(=O)Nc1cccc(Cl)c1Cl ZINC000538232383 938566994 /nfs/dbraw/zinc/56/69/94/938566994.db2.gz AXZXPCHOOZWALB-QWHCGFSZSA-N 0 3 404.301 4.252 20 0 HIADHN COc1ccc([C@H](NC(=O)CN[C@H](C)c2ccc(-n3cccn3)cc2)C(C)C)cc1 ZINC000538236438 938569461 /nfs/dbraw/zinc/56/94/61/938569461.db2.gz MSSRVLMBAIHCCP-HOYKHHGWSA-N 0 3 406.530 4.045 20 0 HIADHN CCOc1ccc(NC(=O)CN[C@H](C)c2cccc(N3CCCC3)c2)cc1OCC ZINC000538279403 938582184 /nfs/dbraw/zinc/58/21/84/938582184.db2.gz JJHKLPQYFXISHE-GOSISDBHSA-N 0 3 411.546 4.374 20 0 HIADHN CCC[C@H]1CN(c2ccc(-c3nc(CC)cc(=O)[n-]3)cn2)CC[N@@H+]1Cc1ccccc1 ZINC000538291143 938584210 /nfs/dbraw/zinc/58/42/10/938584210.db2.gz RAMMXQFKKUJIHV-QFIPXVFZSA-N 0 3 417.557 4.298 20 0 HIADHN CCC[C@H]1CN(c2ccc(-c3nc(CC)cc(=O)[n-]3)cn2)CC[N@H+]1Cc1ccccc1 ZINC000538291143 938584211 /nfs/dbraw/zinc/58/42/11/938584211.db2.gz RAMMXQFKKUJIHV-QFIPXVFZSA-N 0 3 417.557 4.298 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@@H](C)N[C@H](c2ccc(F)c(C)c2)C2CC2)cc1OC ZINC000538323119 938592547 /nfs/dbraw/zinc/59/25/47/938592547.db2.gz JWHZKQSBSMUERC-MWTRTKDXSA-N 0 3 414.521 4.239 20 0 HIADHN CO[C@H](c1ccccc1F)[C@H](C)NC(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000538372804 938606150 /nfs/dbraw/zinc/60/61/50/938606150.db2.gz KFOBBJSKHHZPRS-CVAIRZPRSA-N 0 3 405.539 4.100 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CNC(=O)CN[C@@H](c1ccccc1C)C1CC1 ZINC000538389986 938609108 /nfs/dbraw/zinc/60/91/08/938609108.db2.gz MVLTVURFBJHUSJ-RUZDIDTESA-N 0 3 402.542 4.155 20 0 HIADHN C[C@@H](N[C@@H](c1ccc2c(c1)OCCO2)C1CC1)C(=O)N1CCSc2ccccc21 ZINC000538390633 938609637 /nfs/dbraw/zinc/60/96/37/938609637.db2.gz WGHRUVBFCUMXJZ-IVZQSRNASA-N 0 3 410.539 4.026 20 0 HIADHN COc1ccc([C@H](C)NC2CCN(c3cc(C)nc(C)n3)CC2)c(Br)c1 ZINC000538395682 938610771 /nfs/dbraw/zinc/61/07/71/938610771.db2.gz KNOOXSXEJYBIMM-AWEZNQCLSA-N 0 3 419.367 4.184 20 0 HIADHN CCc1cc(N2CCC(N[C@@H](C)c3ccc(OC)cc3Br)CC2)ncn1 ZINC000538395983 938610828 /nfs/dbraw/zinc/61/08/28/938610828.db2.gz USSGCRZDCAIEDX-AWEZNQCLSA-N 0 3 419.367 4.130 20 0 HIADHN Cn1nc(C(C)(C)C)cc1NC(=O)CN[C@@H](c1cccc(C(F)(F)F)c1)C1CC1 ZINC000563468480 945192510 /nfs/dbraw/zinc/19/25/10/945192510.db2.gz WLHNJYJTIWHFQU-LJQANCHMSA-N 0 3 408.468 4.416 20 0 HIADHN C[C@@H](N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1)c1ccc2c(c1)OCCO2 ZINC000538552942 938647686 /nfs/dbraw/zinc/64/76/86/938647686.db2.gz ZRPQYKIIDAKTRL-XXBNENTESA-N 0 3 416.521 4.036 20 0 HIADHN COc1ccc([C@H](C)N[C@H](Cc2ccccc2)C(=O)NCc2ccccc2)cc1OC ZINC000538553338 938647745 /nfs/dbraw/zinc/64/77/45/938647745.db2.gz DEMRTPDYVCIAGS-WMZHIEFXSA-N 0 3 418.537 4.282 20 0 HIADHN Cc1nc2c(s1)[C@H](N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1)CCC2 ZINC000538554268 938647753 /nfs/dbraw/zinc/64/77/53/938647753.db2.gz QXLVMNIIINBMGL-FGZHOGPDSA-N 0 3 405.567 4.346 20 0 HIADHN Cc1cc(C(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)nn1-c1cccc(F)c1 ZINC000538662847 938677697 /nfs/dbraw/zinc/67/76/97/938677697.db2.gz UTGDIAPOCRENBD-LJQANCHMSA-N 0 3 406.505 4.056 20 0 HIADHN C[C@H](c1ccccc1)N(C)C(=O)CN1CCC[C@@H](c2nc(C3CCCCC3)n[nH]2)C1 ZINC000538664907 938678754 /nfs/dbraw/zinc/67/87/54/938678754.db2.gz CGSYUXZMBCHGFS-WIYYLYMNSA-N 0 3 409.578 4.251 20 0 HIADHN C[C@H](c1ccccc1)N(C)C(=O)CN1CCC[C@@H](c2n[nH]c(C3CCCCC3)n2)C1 ZINC000538664907 938678757 /nfs/dbraw/zinc/67/87/57/938678757.db2.gz CGSYUXZMBCHGFS-WIYYLYMNSA-N 0 3 409.578 4.251 20 0 HIADHN Cc1cc(C(=O)N(C)C2CCN(Cc3ccccc3)CC2)nn1-c1cccc(F)c1 ZINC000538667485 938680563 /nfs/dbraw/zinc/68/05/63/938680563.db2.gz LFEJIWORKDOHCX-UHFFFAOYSA-N 0 3 406.505 4.056 20 0 HIADHN Cc1nc(COc2ccc(CN3CC[C@@H](OCCCc4ccccc4)C3)cc2)no1 ZINC000538724281 938691854 /nfs/dbraw/zinc/69/18/54/938691854.db2.gz AYUDKMWUPXXJMZ-HSZRJFAPSA-N 0 3 407.514 4.181 20 0 HIADHN CN(Cc1ccc(OCC(F)F)cc1)[C@@H](CO)c1cccc(Br)c1 ZINC000538724179 938692196 /nfs/dbraw/zinc/69/21/96/938692196.db2.gz WPJNABKNABGXHM-KRWDZBQOSA-N 0 3 400.263 4.258 20 0 HIADHN CN(Cc1ccc(OCC(F)F)cc1)[C@H](CO)c1cccc(Br)c1 ZINC000538724180 938692266 /nfs/dbraw/zinc/69/22/66/938692266.db2.gz WPJNABKNABGXHM-QGZVFWFLSA-N 0 3 400.263 4.258 20 0 HIADHN COC(=O)[C@@H]1CC12CCN(Cc1cn(Cc3ccccc3)nc1-c1cccs1)CC2 ZINC000538726857 938693506 /nfs/dbraw/zinc/69/35/06/938693506.db2.gz BMSZYMPNVZBQLD-FQEVSTJZSA-N 0 3 421.566 4.435 20 0 HIADHN COc1ccc(CN(CCO)[C@@H]2CCc3ccccc32)cc1OCc1cccnc1 ZINC000538732509 938695526 /nfs/dbraw/zinc/69/55/26/938695526.db2.gz SVJMSUGVCUYYEK-HSZRJFAPSA-N 0 3 404.510 4.151 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)NC2CCC(C(=O)OC(C)(C)C)CC2)C1 ZINC000538781401 938709137 /nfs/dbraw/zinc/70/91/37/938709137.db2.gz ZPVLJIJWZMGINJ-VWEINGBSSA-N 0 3 415.578 4.022 20 0 HIADHN CNC(=O)CCOC1CCN(Cc2ccc(-c3ccc(Cl)c(Cl)c3)o2)CC1 ZINC000538793082 938713046 /nfs/dbraw/zinc/71/30/46/938713046.db2.gz TXSSIZLGGSFOEZ-UHFFFAOYSA-N 0 3 411.329 4.371 20 0 HIADHN Cc1nn(-c2ccc(Br)cc2)cc1CN1CC[C@@H](C)[C@H](n2ccnc2)C1 ZINC000538827296 938720748 /nfs/dbraw/zinc/72/07/48/938720748.db2.gz UGMSSBDHZYRCGT-FOIQADDNSA-N 0 3 414.351 4.223 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)CSc2ccc(F)c(F)c2)cc1 ZINC000538830736 938721743 /nfs/dbraw/zinc/72/17/43/938721743.db2.gz NSQPTBDJOVCHQT-HXUWFJFHSA-N 0 3 406.498 4.019 20 0 HIADHN O=C([C@H]1CC12CCN(CCOc1cc(Cl)cc(Cl)c1)CC2)N1CCCCC1 ZINC000538901724 938733864 /nfs/dbraw/zinc/73/38/64/938733864.db2.gz XHXVTVGLLBGFTM-LJQANCHMSA-N 0 3 411.373 4.487 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)Nc1ccc2[nH]c(C(F)F)nc2c1 ZINC000538982089 938758761 /nfs/dbraw/zinc/75/87/61/938758761.db2.gz CUOWIKDLYYLWLQ-UHFFFAOYSA-N 0 3 423.414 4.374 20 0 HIADHN CC(C)N(Cc1cccnc1)C[C@H](O)COc1ccc(Cl)cc1Br ZINC000538996592 938763426 /nfs/dbraw/zinc/76/34/26/938763426.db2.gz BLLTVFDYUFFVBM-INIZCTEOSA-N 0 3 413.743 4.148 20 0 HIADHN Cc1nc(Cc2ccccc2)sc1[C@H](C)NCc1ccc(NS(C)(=O)=O)cc1 ZINC000539020270 938771151 /nfs/dbraw/zinc/77/11/51/938771151.db2.gz CZOWDIYYBFSWMD-HNNXBMFYSA-N 0 3 415.584 4.265 20 0 HIADHN CCc1nc2c(s1)[C@@H](NCc1cc(Br)c3c(c1)OCCO3)CCC2 ZINC000539039820 938777817 /nfs/dbraw/zinc/77/78/17/938777817.db2.gz DVYKGWAKECDGFD-ZDUSSCGKSA-N 0 3 409.349 4.406 20 0 HIADHN CCOc1ccc([C@@H](CC)N[C@H]2CCCN(CC(F)(F)F)C2=O)cc1OCC ZINC000539052563 938784211 /nfs/dbraw/zinc/78/42/11/938784211.db2.gz MHIZICRIYQQOLZ-CVEARBPZSA-N 0 3 402.457 4.078 20 0 HIADHN O=C1c2ccccc2C(=O)N1[C@@H]1CCCC[C@@H](NCc2ccn(C3CCCC3)n2)C1 ZINC000539061442 938788449 /nfs/dbraw/zinc/78/84/49/938788449.db2.gz MHIPNBNKTYOGNJ-YLJYHZDGSA-N 0 3 406.530 4.085 20 0 HIADHN C[C@@H](N[C@@H](C)c1nc(-c2ccncc2)cs1)[C@@H](c1ccccc1)N1CCOCC1 ZINC000539070180 938793309 /nfs/dbraw/zinc/79/33/09/938793309.db2.gz IFDFTHQOJOACPE-FGSXEWAUSA-N 0 3 408.571 4.318 20 0 HIADHN C[C@@H](NCc1cccc(OC(F)F)c1)c1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000539076501 938795997 /nfs/dbraw/zinc/79/59/97/938795997.db2.gz MHLVNYHJEAAJGW-MRXNPFEDSA-N 0 3 424.513 4.313 20 0 HIADHN C[C@@H](N[C@@H]1CCN(CC(F)(F)F)C1=O)c1ccc(SCC(F)(F)F)cc1 ZINC000539080602 938798157 /nfs/dbraw/zinc/79/81/57/938798157.db2.gz VOWWTLIPRAWOID-ZWNOBZJWSA-N 0 3 400.388 4.155 20 0 HIADHN Cc1ccccc1COc1ccc([C@H](C)N[C@H]2CCCN(c3ccn(C)n3)C2=O)cc1 ZINC000539089069 938800352 /nfs/dbraw/zinc/80/03/52/938800352.db2.gz JELRVGOWIGPZDT-CVDCTZTESA-N 0 3 418.541 4.154 20 0 HIADHN Cc1nc(-c2ccccc2)sc1[C@@H](C)NCc1ccc(NS(C)(=O)=O)cc1 ZINC000539089413 938800511 /nfs/dbraw/zinc/80/05/11/938800511.db2.gz CFPUDBZCDZUSLL-CQSZACIVSA-N 0 3 401.557 4.341 20 0 HIADHN COc1ccc2c(c1)[C@H](NCc1ccc(C(=O)N3C[C@@H](C)O[C@H](C)C3)cc1)CCC2 ZINC000539091078 938801118 /nfs/dbraw/zinc/80/11/18/938801118.db2.gz FWAGTXBUDKCYIH-QZTZHPFYSA-N 0 3 408.542 4.112 20 0 HIADHN C[C@@H]1CC[C@@H](NCc2ccccc2OCC(=O)NC[C@H]2CCCO2)c2ccccc21 ZINC000539091757 938801424 /nfs/dbraw/zinc/80/14/24/938801424.db2.gz WHSJMAIGKCQACS-KKLQWCBXSA-N 0 3 408.542 4.089 20 0 HIADHN COc1cc(CN[C@H]2CCCCc3ccc(Cl)cc32)ccc1OCC(=O)N(C)C ZINC000539092577 938801807 /nfs/dbraw/zinc/80/18/07/938801807.db2.gz BSBDZFIXUJTOHS-FQEVSTJZSA-N 0 3 416.949 4.373 20 0 HIADHN Brc1cccc2c1CC[C@@H]2N[C@@H](CN1CCOCC1)c1ccccc1 ZINC000539164753 938814763 /nfs/dbraw/zinc/81/47/63/938814763.db2.gz XXPKPEKFFVQCDL-SFTDATJTSA-N 0 3 401.348 4.100 20 0 HIADHN COc1cc(OC)cc(N2CC[C@H](N[C@@H](C)c3nc4ccc(Cl)cc4n3C)C2)c1 ZINC000539214100 938819661 /nfs/dbraw/zinc/81/96/61/938819661.db2.gz YHKPFPLHJYCOHP-HOCLYGCPSA-N 0 3 414.937 4.173 20 0 HIADHN COc1ccc([C@H](CN[C@H](C)c2nc3ccc(Cl)cc3n2C)N(C)C)cc1OC ZINC000539217545 938820248 /nfs/dbraw/zinc/82/02/48/938820248.db2.gz XUJUKACSQKLNEH-KUHUBIRLSA-N 0 3 416.953 4.197 20 0 HIADHN COc1ccc(NC(=O)[C@H](NC[C@@H]2CCC[C@H]2OC)c2ccccc2)cc1Cl ZINC000539239467 938823773 /nfs/dbraw/zinc/82/37/73/938823773.db2.gz OLGZXQWTJIUWSA-LDQXTDLNSA-N 0 3 402.922 4.433 20 0 HIADHN CC[C@@H]1c2ccsc2CCN1C(=O)CN[C@H](c1ccc2c(c1)OCCO2)C(C)C ZINC000539241016 938824108 /nfs/dbraw/zinc/82/41/08/938824108.db2.gz MZVVDVOKUJGIRI-JPYJTQIMSA-N 0 3 414.571 4.342 20 0 HIADHN COc1ccc(NC(=O)[C@H](C)N[C@@H](C)c2ccc(NC(=O)c3ccncc3)cc2)cc1 ZINC000539299946 938836485 /nfs/dbraw/zinc/83/64/85/938836485.db2.gz OJVJYOXLPRZRHI-IRXDYDNUSA-N 0 3 418.497 4.020 20 0 HIADHN O[C@@H](CN[C@@H](COc1ccccc1)c1ccccc1)COc1cccc2[nH]ccc21 ZINC000539320383 938840850 /nfs/dbraw/zinc/84/08/50/938840850.db2.gz RUKYEZOWVQRDPO-RDPSFJRHSA-N 0 3 402.494 4.318 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1NC(=O)CN[C@@H](C[C@H]1CCOC1)c1ccccc1 ZINC000539326902 938841961 /nfs/dbraw/zinc/84/19/61/938841961.db2.gz ZFHKHENHMXXSTF-OFNKIYASSA-N 0 3 418.541 4.185 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)NCC(=O)Nc2ccccc2OC(F)F)cc1 ZINC000539368173 938849911 /nfs/dbraw/zinc/84/99/11/938849911.db2.gz GMLVKBQYONCUHY-AWEZNQCLSA-N 0 3 400.429 4.071 20 0 HIADHN Cc1sc(CCN[C@@H](C)CS(=O)(=O)c2ccccc2)nc1-c1ccccc1 ZINC000539394724 938854014 /nfs/dbraw/zinc/85/40/14/938854014.db2.gz IYUAKTWCJITILE-INIZCTEOSA-N 0 3 400.569 4.113 20 0 HIADHN Cc1cc([C@H](N[C@H](C)C(=O)N[C@@H](C)c2ccc3c(c2)OCCO3)C2CC2)ccc1F ZINC000539421492 938858148 /nfs/dbraw/zinc/85/81/48/938858148.db2.gz CYAQALMCNBGYMG-NXHTTZLHSA-N 0 3 412.505 4.212 20 0 HIADHN CCO[C@@H]1C[C@@H](N[C@H](c2ccc(C)cc2)c2cccc(S(C)(=O)=O)c2)C12CCC2 ZINC000539494863 938868519 /nfs/dbraw/zinc/86/85/19/938868519.db2.gz SGLVQCNJTVFBHK-DNVJHFABSA-N 0 3 413.583 4.425 20 0 HIADHN CCO[C@@H]1C[C@@H](N[C@@H](c2ccc(C)cc2)c2cccc(S(C)(=O)=O)c2)C12CCC2 ZINC000539494865 938868620 /nfs/dbraw/zinc/86/86/20/938868620.db2.gz SGLVQCNJTVFBHK-ZLNRFVROSA-N 0 3 413.583 4.425 20 0 HIADHN CO[C@@H](c1ccc(Br)cc1)[C@@H](C)NCc1c(C)nc2sc(C)nn12 ZINC000539545546 938877451 /nfs/dbraw/zinc/87/74/51/938877451.db2.gz VDVSCNRNZQIFJR-BDJLRTHQSA-N 0 3 409.353 4.036 20 0 HIADHN COc1cc(CN2CCC[C@@H]2C2CCOCC2)cc(Br)c1OC(F)F ZINC000539669762 938897830 /nfs/dbraw/zinc/89/78/30/938897830.db2.gz HEDYKUTYQGFALW-OAHLLOKOSA-N 0 3 420.294 4.450 20 0 HIADHN COCCNC(=O)[C@H](CC(C)C)N[C@@H]1CCCc2nc(-c3ccc(F)cc3)sc21 ZINC000539691577 938902638 /nfs/dbraw/zinc/90/26/38/938902638.db2.gz JIRALRQFTCLVIK-MJGOQNOKSA-N 0 3 419.566 4.094 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](NCCCCn2ccnc2)c2ccc(Cl)cc2)c1 ZINC000539809393 938939196 /nfs/dbraw/zinc/93/91/96/938939196.db2.gz NDIURIWHWJBHHM-NRFANRHFSA-N 0 3 417.962 4.099 20 0 HIADHN CCOc1ccc(CN2CCC(C(=O)N(Cc3ccccc3)C3CC3)CC2)cc1OC ZINC000539817076 938940992 /nfs/dbraw/zinc/94/09/92/938940992.db2.gz BLNLFCWZXUFPPE-UHFFFAOYSA-N 0 3 422.569 4.497 20 0 HIADHN CC(=O)N1C[C@@H]2CCC[C@H](N[C@@H](C)c3nc(-c4cccc(C(F)(F)F)c4)no3)[C@@H]2C1 ZINC000563566198 945217448 /nfs/dbraw/zinc/21/74/48/945217448.db2.gz SRWJVFKBCQXRQM-HZCDGDGTSA-N 0 3 422.451 4.053 20 0 HIADHN O=C(CC1CCCC1)NC1CCN(Cc2c[nH]nc2-c2cccc(Cl)c2)CC1 ZINC000539830756 938950605 /nfs/dbraw/zinc/95/06/05/938950605.db2.gz SIYXWFZVUXAOOF-UHFFFAOYSA-N 0 3 400.954 4.391 20 0 HIADHN O=C(CCCOc1ccccc1)Nc1ccc(CNCc2cccc3nccn32)cc1 ZINC000539854498 938958865 /nfs/dbraw/zinc/95/88/65/938958865.db2.gz BINIPKDZHFHKJB-UHFFFAOYSA-N 0 3 414.509 4.422 20 0 HIADHN Brc1ccc(-c2ncc(CN3CCC[C@@H](Cn4ccnn4)C3)s2)cc1 ZINC000539895728 938970507 /nfs/dbraw/zinc/97/05/07/938970507.db2.gz FTJIGFSKKACQBG-CQSZACIVSA-N 0 3 418.364 4.076 20 0 HIADHN CC(C)c1ccccc1NC(=O)C[C@H](C)N[C@@H]1CC(=O)N(c2c(F)cccc2F)C1 ZINC000539967481 938982374 /nfs/dbraw/zinc/98/23/74/938982374.db2.gz SHHKVGVWAOPGNF-JKSUJKDBSA-N 0 3 415.484 4.200 20 0 HIADHN CCc1nnc([C@@H](C)Nc2cccc(N3CCN(CCc4ccccc4)CC3)c2)o1 ZINC000539974420 939027744 /nfs/dbraw/zinc/02/77/44/939027744.db2.gz PFOLYIDGUCXMOH-LJQANCHMSA-N 0 3 405.546 4.170 20 0 HIADHN Brc1cccc(-c2nc(CN[C@@H]3CCO[C@]4(CCOC4)C3)cs2)c1 ZINC000539976971 939028262 /nfs/dbraw/zinc/02/82/62/939028262.db2.gz JXFYQZUXKUYHIG-CRAIPNDOSA-N 0 3 409.349 4.000 20 0 HIADHN O=C([C@H]1CC12CCN(Cc1ccc(OCC(F)(F)F)cc1)CC2)N1CCCCC1 ZINC000540004823 939036708 /nfs/dbraw/zinc/03/67/08/939036708.db2.gz IGSFOOXPYIVYDA-LJQANCHMSA-N 0 3 410.480 4.242 20 0 HIADHN COCCn1cc2c(n1)[C@H](N[C@@H](C)Cc1ccc(F)cc1Br)CCC2 ZINC000563613964 945226111 /nfs/dbraw/zinc/22/61/11/945226111.db2.gz PLGSIQMDBYACDC-SCLBCKFNSA-N 0 3 410.331 4.029 20 0 HIADHN C[C@@H](N[C@H]1CCc2cc(F)ccc21)c1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000540139337 939088172 /nfs/dbraw/zinc/08/81/72/939088172.db2.gz QYULZVXPMFBQTH-ZHRRBRCNSA-N 0 3 402.535 4.338 20 0 HIADHN Cc1cc(S(=O)(=O)NCCN[C@H](C)c2ccc(-c3ccncc3)cc2)c(C)s1 ZINC000540147689 939091395 /nfs/dbraw/zinc/09/13/95/939091395.db2.gz OXMMCXGYECOVEI-MRXNPFEDSA-N 0 3 415.584 4.056 20 0 HIADHN Cc1cccc(COc2ccc([C@@H](C)N[C@@H]3CCN(CC(F)(F)F)C3=O)cc2)c1 ZINC000540173215 939103271 /nfs/dbraw/zinc/10/32/71/939103271.db2.gz AQKDNLLLBFYUMQ-OXQOHEQNSA-N 0 3 406.448 4.388 20 0 HIADHN CCS(=O)(=O)Nc1ccc([C@H](C)NCc2cc(Cl)c3c(c2)OCCCO3)cc1 ZINC000540173303 939103842 /nfs/dbraw/zinc/10/38/42/939103842.db2.gz MWVVAHHWQDPWKK-AWEZNQCLSA-N 0 3 424.950 4.114 20 0 HIADHN COc1ccc([C@H](CN[C@@H](C)c2ccccc2Br)N(C)C)cc1OC ZINC000540175541 939104666 /nfs/dbraw/zinc/10/46/66/939104666.db2.gz JXDLANMIOPPBBX-KSSFIOAISA-N 0 3 407.352 4.420 20 0 HIADHN COc1ccc(-c2nc3c(s2)[C@H](NCc2ccc(OCCO)cc2)CCC3)cc1 ZINC000540175414 939104848 /nfs/dbraw/zinc/10/48/48/939104848.db2.gz HWFLGPDZZKCGTO-HXUWFJFHSA-N 0 3 410.539 4.357 20 0 HIADHN COc1ccc([C@@H](CN[C@H](C)c2ccccc2Br)N(C)C)cc1OC ZINC000540175545 939104935 /nfs/dbraw/zinc/10/49/35/939104935.db2.gz JXDLANMIOPPBBX-RDTXWAMCSA-N 0 3 407.352 4.420 20 0 HIADHN C[C@@H](N[C@H]1CC(=O)N(c2ccccc2Cl)C1)c1ccc(NC(=O)NC2CC2)cc1 ZINC000540180455 939107255 /nfs/dbraw/zinc/10/72/55/939107255.db2.gz DTTVTTHGFQSCNJ-KDOFPFPSSA-N 0 3 412.921 4.080 20 0 HIADHN Cc1cccc(COc2ccc([C@H](C)N[C@@H]3CCCN(c4ccn(C)n4)C3=O)cc2)c1 ZINC000540181409 939108802 /nfs/dbraw/zinc/10/88/02/939108802.db2.gz GGNYELKVXBYTEA-WMZHIEFXSA-N 0 3 418.541 4.154 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)c2ccccc2COC(C)(C)C)CC1 ZINC000540209922 939128945 /nfs/dbraw/zinc/12/89/45/939128945.db2.gz VDACRXPISCUXEH-UHFFFAOYSA-N 0 3 423.601 4.069 20 0 HIADHN CCNC(=O)COc1cccc(CN[C@@H]2CCCc3nc(-c4ccccc4)sc32)c1 ZINC000540219995 939136197 /nfs/dbraw/zinc/13/61/97/939136197.db2.gz OMSQTTGFZWFTGO-HXUWFJFHSA-N 0 3 421.566 4.492 20 0 HIADHN Cc1ccccc1NC(=O)C[C@H](C)N[C@H]1CC(=O)N(c2cccc(C(F)(F)F)c2)C1 ZINC000540223638 939139701 /nfs/dbraw/zinc/13/97/01/939139701.db2.gz ONHPKFRWTOQVDW-RDJZCZTQSA-N 0 3 419.447 4.126 20 0 HIADHN Cc1cc([C@H](NCc2ccc(S(=O)(=O)N(C)C(C)C)cc2)C2CC2)ccc1F ZINC000540300635 939187083 /nfs/dbraw/zinc/18/70/83/939187083.db2.gz PRQHFYOKPGTFRS-JOCHJYFZSA-N 0 3 404.551 4.404 20 0 HIADHN CCCc1ccc([C@H](NCc2cccnc2N2CCC(C(N)=O)CC2)C(C)C)cc1 ZINC000540300357 939187236 /nfs/dbraw/zinc/18/72/36/939187236.db2.gz BPFYWIAUXIYBQY-HSZRJFAPSA-N 0 3 408.590 4.223 20 0 HIADHN Cc1cc([C@@H](NCc2ccc(S(=O)(=O)N(C)C(C)C)cc2)C2CC2)ccc1F ZINC000540300636 939187254 /nfs/dbraw/zinc/18/72/54/939187254.db2.gz PRQHFYOKPGTFRS-QFIPXVFZSA-N 0 3 404.551 4.404 20 0 HIADHN CC(C)[C@H](NCc1cccnc1N1CCN(C)CC1)c1cccc(C(F)(F)F)c1 ZINC000540302738 939187922 /nfs/dbraw/zinc/18/79/22/939187922.db2.gz SJUSDZCISMBTPP-FQEVSTJZSA-N 0 3 406.496 4.339 20 0 HIADHN Cc1cc([C@H](NCc2ccc(S(=O)(=O)N3CCCC3)cc2)C2CC2)ccc1F ZINC000540317619 939191883 /nfs/dbraw/zinc/19/18/83/939191883.db2.gz YVHPCSDICLZTCR-JOCHJYFZSA-N 0 3 402.535 4.160 20 0 HIADHN Cc1ccc([C@H](C)NCC(=O)Nc2cc(C(F)(F)F)ccc2N2CCOCC2)cc1 ZINC000540330696 939197024 /nfs/dbraw/zinc/19/70/24/939197024.db2.gz ZEQUBRATFYZSIR-INIZCTEOSA-N 0 3 421.463 4.140 20 0 HIADHN Cc1cc(C)c(S(=O)(=O)Nc2ccc(CN3CCSCC3)cc2C)c(C)c1 ZINC000540332058 939197629 /nfs/dbraw/zinc/19/76/29/939197629.db2.gz WPKRQJDOIWNFBT-UHFFFAOYSA-N 0 3 404.601 4.270 20 0 HIADHN CCOC(=O)C1CCN(C(=O)CN[C@@H](CC2CCCCC2)c2ccccc2)CC1 ZINC000540355668 939206130 /nfs/dbraw/zinc/20/61/30/939206130.db2.gz NZPNFTIJWBROBT-QFIPXVFZSA-N 0 3 400.563 4.089 20 0 HIADHN COCc1cccc(CNC(=O)CN[C@H](c2cccc(C(F)(F)F)c2)C(C)C)c1 ZINC000540358805 939208420 /nfs/dbraw/zinc/20/84/20/939208420.db2.gz MGMHUNABWPINPE-NRFANRHFSA-N 0 3 408.464 4.455 20 0 HIADHN COc1ccc(NC(=O)CN[C@H](Cc2ccc(OC)c(OC)c2)c2ccccc2)cc1 ZINC000540359905 939209430 /nfs/dbraw/zinc/20/94/30/939209430.db2.gz MCZHRYSRABDPKP-JOCHJYFZSA-N 0 3 420.509 4.225 20 0 HIADHN CCC(CC)[C@@H](NCC(=O)N1CCc2cc(OC)c(OC)cc2C1)c1cccs1 ZINC000540377204 939216871 /nfs/dbraw/zinc/21/68/71/939216871.db2.gz WODCRQPXJWZZAX-HSZRJFAPSA-N 0 3 416.587 4.417 20 0 HIADHN CCC(CC)[C@@H](NCC(=O)Nc1cc(S(C)(=O)=O)ccc1Cl)c1ccccc1 ZINC000540381803 939221463 /nfs/dbraw/zinc/22/14/63/939221463.db2.gz XAQHFSPVUOWACQ-OAQYLSRUSA-N 0 3 422.978 4.449 20 0 HIADHN C[C@H](NCC(=O)Nc1ccc(Br)cc1F)c1cccc(-n2cccn2)c1 ZINC000540388160 939225733 /nfs/dbraw/zinc/22/57/33/939225733.db2.gz JJGQTAPULOPRPN-ZDUSSCGKSA-N 0 3 417.282 4.063 20 0 HIADHN O=C(CN[C@H](c1ccccc1)[C@H]1CCOC1)N[C@H](Cc1ccccc1)c1ccccc1 ZINC000540389984 939227340 /nfs/dbraw/zinc/22/73/40/939227340.db2.gz LBASRISBVQEWOY-ZWEKWIFMSA-N 0 3 414.549 4.454 20 0 HIADHN Cc1ccc(NC(=O)CN[C@H](c2ccccc2)[C@H]2CCOC2)c(Br)c1 ZINC000540390348 939228451 /nfs/dbraw/zinc/22/84/51/939228451.db2.gz OMCAUUMOVBPAQW-OXJNMPFZSA-N 0 3 403.320 4.063 20 0 HIADHN Cc1ccc(NC(=O)CN[C@@H](c2ccccc2)[C@H]2CCOC2)c(Br)c1 ZINC000540390347 939229274 /nfs/dbraw/zinc/22/92/74/939229274.db2.gz OMCAUUMOVBPAQW-JXFKEZNVSA-N 0 3 403.320 4.063 20 0 HIADHN CCN(C(=O)[C@H](C)N[C@@H](C)c1ccc(NC(=O)c2ccncc2)cc1)c1ccccc1 ZINC000540396984 939233831 /nfs/dbraw/zinc/23/38/31/939233831.db2.gz MHZDVNYTBOKQHC-OALUTQOASA-N 0 3 416.525 4.426 20 0 HIADHN O=C(CN[C@H](c1ccccc1)[C@@H]1CCOC1)N1CC=C(c2c[nH]c3ccccc32)CC1 ZINC000540398460 939234527 /nfs/dbraw/zinc/23/45/27/939234527.db2.gz QKWAWOJGDWFYHP-QFQXNSOFSA-N 0 3 415.537 4.151 20 0 HIADHN CCCC[C@H](NCC(=O)Nc1ccccc1N1CCCC1=O)c1ccc(OC)cc1 ZINC000540401299 939235536 /nfs/dbraw/zinc/23/55/36/939235536.db2.gz UXIAXVPIDVXGAF-FQEVSTJZSA-N 0 3 409.530 4.282 20 0 HIADHN COc1cccc(OC)c1OC[C@H](O)CN[C@@H](c1ccc(F)cc1F)C(C)(C)C ZINC000540425988 939244999 /nfs/dbraw/zinc/24/49/99/939244999.db2.gz PXWHBADSONOORZ-VFNWGFHPSA-N 0 3 409.473 4.099 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(-n2cccn2)cc1)C(=O)Nc1cccc(Br)c1 ZINC000540433326 939246928 /nfs/dbraw/zinc/24/69/28/939246928.db2.gz CJSPKYGKLCPKPU-LSDHHAIUSA-N 0 3 413.319 4.313 20 0 HIADHN COc1cc(CNC(=O)CN[C@H](c2ccccc2C)C(C)(C)C)cc(OC)c1OC ZINC000540455590 939257729 /nfs/dbraw/zinc/25/77/29/939257729.db2.gz LULYITLYNHKQBL-HSZRJFAPSA-N 0 3 414.546 4.014 20 0 HIADHN CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H](Cc2ccccc2)c2ccccc2F)cc1 ZINC000540458355 939259353 /nfs/dbraw/zinc/25/93/53/939259353.db2.gz OBNDMCPRAVRMBN-SQJMNOBHSA-N 0 3 422.500 4.097 20 0 HIADHN CC[C@H]1Oc2cc([C@@H](C)NCc3ccc(-n4nc(C)cc4C)cc3)ccc2NC1=O ZINC000540457922 939259825 /nfs/dbraw/zinc/25/98/25/939259825.db2.gz KCEWTVBKDJYQKP-VGOFRKELSA-N 0 3 404.514 4.449 20 0 HIADHN CC[C@H](NCCC(=O)Nc1ccc(N2CCCC2=O)cc1)c1cc(F)ccc1F ZINC000540459224 939260194 /nfs/dbraw/zinc/26/01/94/939260194.db2.gz PGTLJWJSOKEPMG-FQEVSTJZSA-N 0 3 401.457 4.161 20 0 HIADHN CN(C)CCN(C(=O)c1cc(OC(F)F)cc(OC(F)F)c1)c1ccccc1 ZINC000540495373 939275885 /nfs/dbraw/zinc/27/58/85/939275885.db2.gz VUFOQVVETQYGEA-UHFFFAOYSA-N 0 3 400.372 4.098 20 0 HIADHN O=C(CCCc1ccc2ccccc2c1)NCc1ccccc1CN1CCC(O)CC1 ZINC000540502723 939279467 /nfs/dbraw/zinc/27/94/67/939279467.db2.gz PDIZIKLZCFFPSD-UHFFFAOYSA-N 0 3 416.565 4.436 20 0 HIADHN COc1ccc(CNC(=O)[C@H](C)N[C@H](c2ccc(Cl)cc2)[C@@H]2C[C@H]2C)cc1OC ZINC000540523167 939286581 /nfs/dbraw/zinc/28/65/81/939286581.db2.gz LWSIBLGFRFGBLI-DAMNHTQYSA-N 0 3 416.949 4.349 20 0 HIADHN Cc1cc([C@@H](N[C@H](C)C(=O)Nc2cccc(N3CCCC3=O)c2)C2CC2)ccc1F ZINC000540521770 939286716 /nfs/dbraw/zinc/28/67/16/939286716.db2.gz VJEDJZNKBRLNLK-MWTRTKDXSA-N 0 3 409.505 4.329 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)c3ccccc3NC3CCCCC3)CC2)C[C@H](C)O1 ZINC000540545979 939300055 /nfs/dbraw/zinc/30/00/55/939300055.db2.gz VYLVNUVGLNAHBK-BGYRXZFFSA-N 0 3 413.606 4.393 20 0 HIADHN Cc1ccccc1[C@H](NCC(=O)N1CCC[C@H]1c1ccc2c(c1)OCCO2)C1CC1 ZINC000540588855 939312446 /nfs/dbraw/zinc/31/24/46/939312446.db2.gz JOKBTRQCKQQYET-SQJMNOBHSA-N 0 3 406.526 4.171 20 0 HIADHN CCN(C(=O)CN[C@H](c1ccc2c(c1)OCCO2)C1CC1)[C@H](C)c1ccc(F)cc1 ZINC000540590234 939313080 /nfs/dbraw/zinc/31/30/80/939313080.db2.gz DFKKPWXGNXNSOU-GYCJOSAFSA-N 0 3 412.505 4.247 20 0 HIADHN C[C@@H](NC(=O)CN[C@@H](c1ccc2c(c1)OCCO2)C1CC1)c1ccccc1Cl ZINC000540589835 939313108 /nfs/dbraw/zinc/31/31/08/939313108.db2.gz BDXZCBJMWAHDOQ-JLCFBVMHSA-N 0 3 400.906 4.029 20 0 HIADHN C[C@H](NCc1ccc(C(=O)N2CCN(C)CC2)cc1)c1cc2cc(Cl)ccc2o1 ZINC000540597119 939315442 /nfs/dbraw/zinc/31/54/42/939315442.db2.gz JGMXURBGSWSLNY-INIZCTEOSA-N 0 3 411.933 4.325 20 0 HIADHN COc1sc(CNCCOc2ccc(C(F)(F)F)cn2)cc1Br ZINC000540613014 939319510 /nfs/dbraw/zinc/31/95/10/939319510.db2.gz UCXHDCJFZTTXFX-UHFFFAOYSA-N 0 3 411.243 4.102 20 0 HIADHN COc1cc(OC)cc(N2CC[C@H](NCc3ccccc3OCc3ccncc3)C2)c1 ZINC000540699787 939343378 /nfs/dbraw/zinc/34/33/78/939343378.db2.gz IXRQSURMOZUURX-NRFANRHFSA-N 0 3 419.525 4.046 20 0 HIADHN CCc1ccc([C@H](NC(=O)CN2CCC[C@@H]2C2CCOCC2)c2cccs2)cc1 ZINC000540826670 939385987 /nfs/dbraw/zinc/38/59/87/939385987.db2.gz BIJCORKBMMPOGJ-QPPBQGQZSA-N 0 3 412.599 4.407 20 0 HIADHN Cc1nc(-c2ccc(F)c(F)c2)sc1C(=O)N(CCN(C)C)Cc1ccco1 ZINC000540857391 939397571 /nfs/dbraw/zinc/39/75/71/939397571.db2.gz HRPQWHKAUIKGPE-UHFFFAOYSA-N 0 3 405.470 4.194 20 0 HIADHN COC(=O)c1ccc(CN2CCC[C@H](c3nnc(C4CCCCC4)[nH]3)C2)cc1F ZINC000540862297 939399287 /nfs/dbraw/zinc/39/92/87/939399287.db2.gz DZCVFOYWKODLAA-KRWDZBQOSA-N 0 3 400.498 4.158 20 0 HIADHN C[C@H](C(=O)N(C)Cc1ccccc1)N1CCC[C@@H](c2nc(C3CCCCC3)n[nH]2)C1 ZINC000540865813 939401858 /nfs/dbraw/zinc/40/18/58/939401858.db2.gz NYAKLKYCVXXDOS-WIYYLYMNSA-N 0 3 409.578 4.079 20 0 HIADHN C[C@H](C(=O)N1CCc2ccccc2C1)N1CCC[C@@H](c2nc(C3CCCCC3)n[nH]2)C1 ZINC000540866491 939403398 /nfs/dbraw/zinc/40/33/98/939403398.db2.gz VHQOERYZLVJPTQ-XMSQKQJNSA-N 0 3 421.589 4.005 20 0 HIADHN C[C@@H](NC(=O)Nc1ccc(C(F)(F)F)cc1Br)C1=CCN(C)CC1 ZINC000540981494 939424873 /nfs/dbraw/zinc/42/48/73/939424873.db2.gz VNJYVUMAHMBBDG-SNVBAGLBSA-N 0 3 406.246 4.240 20 0 HIADHN Cc1c2cccc(Br)c2oc1C(=O)NC1CCN(CCOC(C)C)CC1 ZINC000541102636 939461050 /nfs/dbraw/zinc/46/10/50/939461050.db2.gz LKKSHDDYIJIPTG-UHFFFAOYSA-N 0 3 423.351 4.123 20 0 HIADHN CC[C@H](N[C@H]1CCCc2ccc(Br)cc21)c1cccc(S(N)(=O)=O)c1 ZINC000541202048 939485422 /nfs/dbraw/zinc/48/54/22/939485422.db2.gz ZTLGNIACRBFRTC-OALUTQOASA-N 0 3 423.376 4.215 20 0 HIADHN CC(=O)Nc1ccc(CN[C@@H]2CC(=O)N(C(C)C)[C@@H]2c2ccc(Cl)c(F)c2)cc1 ZINC000541203865 939485515 /nfs/dbraw/zinc/48/55/15/939485515.db2.gz JMDJAIXZVGFNOZ-IFMALSPDSA-N 0 3 417.912 4.278 20 0 HIADHN Cc1ccc2c(c1C)OC[C@H]2N[C@@H](C)CC(=O)Nc1ccc(NC(=O)C2CC2)cc1 ZINC000541213314 939485999 /nfs/dbraw/zinc/48/59/99/939485999.db2.gz KNFVLSBXNZWCAB-YCRPNKLZSA-N 0 3 407.514 4.092 20 0 HIADHN CCCCN1Cc2cccc(N[C@@H](Cc3ccc(C(F)(F)F)cc3)C(N)=O)c2C1 ZINC000541259972 939488153 /nfs/dbraw/zinc/48/81/53/939488153.db2.gz WWBQXEWSTVYWPV-FQEVSTJZSA-N 0 3 405.464 4.330 20 0 HIADHN COc1ccc(Oc2ccc(CN[C@@H]3CCCN(Cc4ccccn4)C3=O)cc2)cc1 ZINC000541386291 939502984 /nfs/dbraw/zinc/50/29/84/939502984.db2.gz MZSHTMCEGISMDE-XMMPIXPASA-N 0 3 417.509 4.163 20 0 HIADHN Cc1cc(C)cc([C@H]2CCN(CC(=O)N3CCC(OCc4ccccc4)CC3)C2)c1 ZINC000541389497 939503518 /nfs/dbraw/zinc/50/35/18/939503518.db2.gz PLOSROIESRBJPO-QHCPKHFHSA-N 0 3 406.570 4.301 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)[C@H]2CCn3c(cnc3C3CCCCC3)C2)N(C)C)cc1 ZINC000541406708 939507750 /nfs/dbraw/zinc/50/77/50/939507750.db2.gz PBFSHVHMLZYSEN-LADGPHEKSA-N 0 3 422.617 4.475 20 0 HIADHN CC(C)(C)n1cnc(NC(=O)N2CCN(Cc3ccccc3)C3(CCCCC3)C2)n1 ZINC000541508396 939539837 /nfs/dbraw/zinc/53/98/37/939539837.db2.gz NGEOTUNMBLLJSU-UHFFFAOYSA-N 0 3 410.566 4.086 20 0 HIADHN NC(=O)C1CCN(C[C@H](NCc2cccc(Cl)c2)c2ccc(Cl)cc2)CC1 ZINC000541547788 939551108 /nfs/dbraw/zinc/55/11/08/939551108.db2.gz VQYCRHRYPDWLCG-FQEVSTJZSA-N 0 3 406.357 4.022 20 0 HIADHN O=S1(=O)CCC(CCN[C@H](c2ccc(F)cc2)c2cnc3ccccc3c2)CC1 ZINC000541566388 939556643 /nfs/dbraw/zinc/55/66/43/939556643.db2.gz QUYLNKJLGCKDFN-HSZRJFAPSA-N 0 3 412.530 4.268 20 0 HIADHN Cc1cc([C@H](NC[C@H]2CC(=O)N(Cc3ccccc3)C2)c2cccnc2)ccc1F ZINC000541565208 939556657 /nfs/dbraw/zinc/55/66/57/939556657.db2.gz COSPKEOECPWBBP-NLFFAJNJSA-N 0 3 403.501 4.257 20 0 HIADHN CC(C)([C@H](NCC(=O)Nc1ccc(F)cc1F)c1ccc(F)c(F)c1)N1CCCC1 ZINC000541588916 939561332 /nfs/dbraw/zinc/56/13/32/939561332.db2.gz QSWYYHWXQQJNID-OAQYLSRUSA-N 0 3 423.454 4.387 20 0 HIADHN CC[C@H](NCCCOc1cccc(I)c1)c1nccs1 ZINC000541596984 939562878 /nfs/dbraw/zinc/56/28/78/939562878.db2.gz QJGGMTYOUTZGGJ-AWEZNQCLSA-N 0 3 402.301 4.258 20 0 HIADHN COc1ccccc1C[C@H](NCc1nnc(-c2ccc(Br)o2)o1)C(C)C ZINC000541627796 939574774 /nfs/dbraw/zinc/57/47/74/939574774.db2.gz AVPHRDJORYMYRA-AWEZNQCLSA-N 0 3 420.307 4.458 20 0 HIADHN Cc1cc(I)ccc1NC(=O)CNC(C)(C)c1cccs1 ZINC000541645602 939585292 /nfs/dbraw/zinc/58/52/92/939585292.db2.gz UEOHCPSPJQUBGF-UHFFFAOYSA-N 0 3 414.312 4.125 20 0 HIADHN COc1ccccc1[C@H](C)N(C)C(=O)CN(C)[C@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000541700083 939608582 /nfs/dbraw/zinc/60/85/82/939608582.db2.gz SHUGBVXUTVHYAZ-NYDSKATKSA-N 0 3 414.521 4.206 20 0 HIADHN C[C@H]1N(CC(=O)Nc2ccc(N3CCc4ccccc43)cc2)CCC12CCOCC2 ZINC000541717928 939613126 /nfs/dbraw/zinc/61/31/26/939613126.db2.gz JFZTYOTUJCENQB-LJQANCHMSA-N 0 3 405.542 4.210 20 0 HIADHN CCC[C@H](NCc1ccc(Br)cc1N1CCOCC1)c1cccnc1 ZINC000541742021 939618510 /nfs/dbraw/zinc/61/85/10/939618510.db2.gz OTZXUCYRINEUCF-IBGZPJMESA-N 0 3 404.352 4.312 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@@H]2NCc2ccccc2-n2cccn2)cc1 ZINC000541768375 939625791 /nfs/dbraw/zinc/62/57/91/939625791.db2.gz UEXMYQKCUCWFEP-JTHBVZDNSA-N 0 3 409.555 4.055 20 0 HIADHN CN(C(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1)[C@@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000541825992 939643278 /nfs/dbraw/zinc/64/32/78/939643278.db2.gz PMBQZQPIOQAYOS-WZYRSQIMSA-N 0 3 411.521 4.133 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@H](C)N[C@H](C)c2ccc(NC(C)=O)cc2)cc1 ZINC000541912949 939651915 /nfs/dbraw/zinc/65/19/15/939651915.db2.gz RIMBQPOEOZLHIA-SJORKVTESA-N 0 3 417.575 4.087 20 0 HIADHN CSC[C@@H](NCc1ccc(NS(C)(=O)=O)cc1)c1ccc(C(F)(F)F)cc1 ZINC000541917126 939653325 /nfs/dbraw/zinc/65/33/25/939653325.db2.gz BNOLQEMISTVBGB-QGZVFWFLSA-N 0 3 418.506 4.271 20 0 HIADHN O=C(C1CCN(Cc2ccc(-c3cccc(C(F)(F)F)c3)o2)CC1)N1CCOCC1 ZINC000541926566 939656170 /nfs/dbraw/zinc/65/61/70/939656170.db2.gz UIQXRKAQIBVVMD-UHFFFAOYSA-N 0 3 422.447 4.036 20 0 HIADHN COc1ccccc1[C@H](C)NC(=O)[C@@H](C)N[C@H](C)c1ccc(-n2ccnc2C)cc1 ZINC000541955960 939661468 /nfs/dbraw/zinc/66/14/68/939661468.db2.gz YYMIDHOUOAWRJP-FGTMMUONSA-N 0 3 406.530 4.106 20 0 HIADHN CC(C)N(CCN(C)C)C(=O)Nc1ccc(NC(=O)c2ccc(Cl)cc2)cc1 ZINC000541971827 939665902 /nfs/dbraw/zinc/66/59/02/939665902.db2.gz MTFJYLIOETVYIZ-UHFFFAOYSA-N 0 3 402.926 4.396 20 0 HIADHN Cc1ccccc1[C@H](CO)NC[C@@H](O)CO[C@@H](c1ccccc1)c1ccccc1C ZINC000541982234 939669827 /nfs/dbraw/zinc/66/98/27/939669827.db2.gz IAJBMGJBLGFRIE-RZFJZAQRSA-N 0 3 405.538 4.094 20 0 HIADHN O=C(CCN1CCc2c(cccc2NC(=O)Nc2ccccc2F)C1)N1CCCCC1 ZINC000541985735 939670191 /nfs/dbraw/zinc/67/01/91/939670191.db2.gz LGAHKLWGBFSOOE-UHFFFAOYSA-N 0 3 424.520 4.230 20 0 HIADHN CS[C@H]1CN(C(=O)c2nc(-c3ccc(Cl)c(Cl)c3)oc2C)C[C@H]1N(C)C ZINC000541991233 939672242 /nfs/dbraw/zinc/67/22/42/939672242.db2.gz IXDHLWPQOUGLTF-CABCVRRESA-N 0 3 414.358 4.074 20 0 HIADHN CCN1CC[C@H](NCc2cnn(Cc3ccccc3)c2)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000541993906 939672927 /nfs/dbraw/zinc/67/29/27/939672927.db2.gz GECVVDCVZHPOEB-JTHBVZDNSA-N 0 3 414.475 4.274 20 0 HIADHN COC(=O)[C@@H](N[C@@H](CN1CCCC1)c1ccccc1)c1ccccc1C(F)(F)F ZINC000542100941 939713228 /nfs/dbraw/zinc/71/32/28/939713228.db2.gz YQTFHWOVEINXII-PMACEKPBSA-N 0 3 406.448 4.346 20 0 HIADHN CN(CC[C@@H]1CCCCN1C)C(=O)c1ccccc1C(=O)c1ccc(F)c(F)c1 ZINC000542145649 939729672 /nfs/dbraw/zinc/72/96/72/939729672.db2.gz OACPHUVLDVOLQW-KRWDZBQOSA-N 0 3 400.469 4.142 20 0 HIADHN CCOC(=O)C1CCN(C(=O)C[C@@H](C)N[C@@H](c2ccc(F)cc2F)C(C)(C)C)CC1 ZINC000542147727 939730771 /nfs/dbraw/zinc/73/07/71/939730771.db2.gz ITORYGNURSPOFT-VFNWGFHPSA-N 0 3 424.532 4.222 20 0 HIADHN Cc1ccc(NC(=O)C2CCN(CCCc3ccccc3Br)CC2)nc1 ZINC000542212166 939758903 /nfs/dbraw/zinc/75/89/03/939758903.db2.gz FVODHEFNOKCABF-UHFFFAOYSA-N 0 3 416.363 4.436 20 0 HIADHN COc1cccc(NC2CCN(C[C@@H](O)COc3ccccc3C(F)(F)F)CC2)c1 ZINC000542277951 939782630 /nfs/dbraw/zinc/78/26/30/939782630.db2.gz XBADATJQFUAKGU-GOSISDBHSA-N 0 3 424.463 4.030 20 0 HIADHN Brc1cnc(CNCCc2c[nH]c3ccc(Br)cc23)s1 ZINC000542314078 939797155 /nfs/dbraw/zinc/79/71/55/939797155.db2.gz JWIBSUCMQXZLOO-UHFFFAOYSA-N 0 3 415.154 4.482 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3cc(F)c(OC(C)C)c(F)c3)cc2)CC1 ZINC000542367697 939808704 /nfs/dbraw/zinc/80/87/04/939808704.db2.gz STRWCAAKSPGKQT-UHFFFAOYSA-N 0 3 403.473 4.146 20 0 HIADHN CN(C)[C@@H](CNC(=O)N1CCC[C@H](c2nnc(C3CCCCC3)[nH]2)C1)c1ccccc1 ZINC000542376530 939810310 /nfs/dbraw/zinc/81/03/10/939810310.db2.gz NTVUSGVQOYCYBS-SFTDATJTSA-N 0 3 424.593 4.044 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Nc1nc(Cc2ccccc2)cs1 ZINC000542392724 939813012 /nfs/dbraw/zinc/81/30/12/939813012.db2.gz ZNOQFBXPGPIFDC-UHFFFAOYSA-N 0 3 400.573 4.391 20 0 HIADHN C[C@@H]1C[C@@H](CCN[C@H](c2ccc(F)cc2)c2cccc(S(C)(=O)=O)c2)CCO1 ZINC000542486425 939831891 /nfs/dbraw/zinc/83/18/91/939831891.db2.gz IUJGBJLWCDHYPL-HYFFOGBASA-N 0 3 405.535 4.113 20 0 HIADHN CCCN(CCN1CCCC1)C(=O)c1ccc2c(c1)nc(C)n2Cc1ccsc1 ZINC000563739177 945275594 /nfs/dbraw/zinc/27/55/94/945275594.db2.gz MXRQMDSXGZHUGF-UHFFFAOYSA-N 0 3 410.587 4.403 20 0 HIADHN Cc1cc([C@@H](NC2CCN(C(=O)CC(F)(F)F)CC2)c2cccnc2)ccc1F ZINC000542493900 939832716 /nfs/dbraw/zinc/83/27/16/939832716.db2.gz HUMYJLUSVXDLNX-HXUWFJFHSA-N 0 3 409.427 4.152 20 0 HIADHN C[C@@H]1C[C@H](N[C@@H]2CCCN(Cc3ccccn3)C2=O)c2cccc(Br)c21 ZINC000542499016 939833198 /nfs/dbraw/zinc/83/31/98/939833198.db2.gz MPIYCRFDVUVZSO-ZMYBRWDISA-N 0 3 414.347 4.173 20 0 HIADHN CCNC(=O)c1cccc(NC(=O)CN[C@H](Cc2ccccc2)c2sccc2C)c1 ZINC000542522997 939836899 /nfs/dbraw/zinc/83/68/99/939836899.db2.gz POYCDBGQMGCWIB-OAQYLSRUSA-N 0 3 421.566 4.318 20 0 HIADHN O=C(CNC1(C2CC2)CC1)Nc1ccc(Oc2ccc(Br)cc2)nc1 ZINC000542524988 939837184 /nfs/dbraw/zinc/83/71/84/939837184.db2.gz GOWYYMORVHUDTL-UHFFFAOYSA-N 0 3 402.292 4.107 20 0 HIADHN COCc1cccc(OCC2(CN[C@@H](c3nnc4ccccn43)C(C)C)CCC2)c1 ZINC000542545765 939841580 /nfs/dbraw/zinc/84/15/80/939841580.db2.gz SRLVNHFAPVKYIX-JOCHJYFZSA-N 0 3 408.546 4.412 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@H](C)N[C@@H](CC(C)C)c2cccs2)cc1OC ZINC000542557278 939843258 /nfs/dbraw/zinc/84/32/58/939843258.db2.gz OHVVALWZPFVILN-WMZOPIPTSA-N 0 3 404.576 4.489 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@@H](C)N[C@@H](CC(C)C)c2cccs2)cc1OC ZINC000542557266 939843287 /nfs/dbraw/zinc/84/32/87/939843287.db2.gz OHVVALWZPFVILN-AEFFLSMTSA-N 0 3 404.576 4.489 20 0 HIADHN Cc1csc([C@@H](C)CNC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)n1 ZINC000542582284 939846076 /nfs/dbraw/zinc/84/60/76/939846076.db2.gz SFUVAHXECAFPNM-IFXJQAMLSA-N 0 3 411.493 4.126 20 0 HIADHN CCOc1cccc2cc([C@H](C)NCCCS(=O)(=O)c3ccc(F)cc3)oc21 ZINC000542586867 939846651 /nfs/dbraw/zinc/84/66/51/939846651.db2.gz JRJGJUMSVRKEEQ-HNNXBMFYSA-N 0 3 405.491 4.485 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1NC(=O)[C@H](C)N[C@H](C)[C@H]1Oc2ccccc2[C@H]1C ZINC000542610724 939848279 /nfs/dbraw/zinc/84/82/79/939848279.db2.gz LQCLSKALYHNLKG-MUZNYLCMSA-N 0 3 418.541 4.359 20 0 HIADHN COc1ccccc1O[C@H](C)CN[C@H]1CCCC[C@@H]1S(=O)(=O)c1ccc(C)cc1 ZINC000542664024 939852395 /nfs/dbraw/zinc/85/23/95/939852395.db2.gz CAGHSSZGIRXJCY-RFWXGWTQSA-N 0 3 417.571 4.146 20 0 HIADHN Brc1ccc(N2CC[C@@H](CN[C@H](c3ccccc3)c3cncnc3)C2)cc1 ZINC000542668274 939852961 /nfs/dbraw/zinc/85/29/61/939852961.db2.gz HSFVQLWOPOZLQG-HTAPYJJXSA-N 0 3 423.358 4.445 20 0 HIADHN Cc1cnc([C@@H](C)CN[C@@H](c2ccc(F)cc2)c2cccc(S(C)(=O)=O)c2)s1 ZINC000542698031 939855023 /nfs/dbraw/zinc/85/50/23/939855023.db2.gz ZLHCYGHZBWGDLI-XOBRGWDASA-N 0 3 418.559 4.477 20 0 HIADHN CC(C)NS(=O)(=O)Cc1ccc(CN[C@@H](c2ccc(F)c(F)c2)C(C)C)cc1 ZINC000542846346 939862712 /nfs/dbraw/zinc/86/27/12/939862712.db2.gz LKOYEECQONQSFG-OAQYLSRUSA-N 0 3 410.530 4.280 20 0 HIADHN CC(=O)Nc1ccc([C@H](C)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2=O)cc1 ZINC000542848876 939862891 /nfs/dbraw/zinc/86/28/91/939862891.db2.gz IAZGGPYWULVTSA-XOBRGWDASA-N 0 3 417.456 4.093 20 0 HIADHN OCC[C@H](NCCCc1nc(-c2ccccc2)no1)c1ccccc1Br ZINC000542879155 939864848 /nfs/dbraw/zinc/86/48/48/939864848.db2.gz KOASVYTVAWQWSS-SFHVURJKSA-N 0 3 416.319 4.145 20 0 HIADHN COc1cccc(OC)c1OC[C@@H](O)CN[C@H](c1ccc(Cl)cc1F)C(C)C ZINC000542919180 939877667 /nfs/dbraw/zinc/87/76/67/939877667.db2.gz KZMKIGJRXJUHRU-YWZLYKJASA-N 0 3 411.901 4.223 20 0 HIADHN CCN1CC[C@H](NCc2cnc(-c3ccccc3)nc2)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000542942934 939882973 /nfs/dbraw/zinc/88/29/73/939882973.db2.gz XRBCGABBURRNTG-RBBKRZOGSA-N 0 3 412.459 4.486 20 0 HIADHN COC1CCN(C(C)(C)CNC(=O)c2oc3c(cccc3Br)c2C)CC1 ZINC000543011590 939895003 /nfs/dbraw/zinc/89/50/03/939895003.db2.gz JNXYPXOBKWQYTE-UHFFFAOYSA-N 0 3 423.351 4.123 20 0 HIADHN CCOC(=O)C1CCN(C(=O)C[C@H](C)N[C@@H](C)c2cccc(Cl)c2Cl)CC1 ZINC000543066968 939919583 /nfs/dbraw/zinc/91/95/83/939919583.db2.gz NOLHKLNUMZXVQL-KBPBESRZSA-N 0 3 415.361 4.224 20 0 HIADHN COC(=O)c1cccc(NC(=O)C[C@@H](C)N[C@@H](C)c2ccccc2OC(F)F)c1 ZINC000543066736 939919624 /nfs/dbraw/zinc/91/96/24/939919624.db2.gz MEIWUIVOBXYIGA-KGLIPLIRSA-N 0 3 406.429 4.143 20 0 HIADHN O=C(NCc1ccccc1)C1CCN(CCCc2ccccc2Br)CC1 ZINC000543140917 939966759 /nfs/dbraw/zinc/96/67/59/939966759.db2.gz XHJARRDXALPXKQ-UHFFFAOYSA-N 0 3 415.375 4.410 20 0 HIADHN NC(=O)[C@@H](Cc1ccc(C(F)(F)F)cc1)NCCOc1cccc(Cl)c1Cl ZINC000543163492 939982244 /nfs/dbraw/zinc/98/22/44/939982244.db2.gz KINAKOGTYMENKC-CQSZACIVSA-N 0 3 421.246 4.077 20 0 HIADHN COc1cccc([C@H]2C[C@H](C)CN2CC(=O)N2CCc3[nH]c4ccccc4c3C2)c1 ZINC000543181047 939987706 /nfs/dbraw/zinc/98/77/06/939987706.db2.gz IIDSSKUSTGHLNJ-BXKMTCNYSA-N 0 3 403.526 4.144 20 0 HIADHN FC(F)(F)c1ccc([C@@H]2CCC[C@H]2NCc2cn(Cc3cccnc3)nn2)cc1 ZINC000543240396 940005222 /nfs/dbraw/zinc/00/52/22/940005222.db2.gz XOGQLMIEUZCBDY-VQTJNVASSA-N 0 3 401.436 4.166 20 0 HIADHN Clc1ccc(-n2cc(CN[C@H]3CCOC4(CCSCC4)C3)nn2)cc1Cl ZINC000543242000 940005699 /nfs/dbraw/zinc/00/56/99/940005699.db2.gz UPCCDDZSYULUSB-ZDUSSCGKSA-N 0 3 413.374 4.109 20 0 HIADHN Cc1cc(-c2nc(C3CC3)no2)ccc1NC(=O)NC[C@H](c1ccccc1)N(C)C ZINC000543348752 940037730 /nfs/dbraw/zinc/03/77/30/940037730.db2.gz GGLOZFWPGKYVCN-HXUWFJFHSA-N 0 3 405.502 4.347 20 0 HIADHN COc1cc(OC)cc(N2CC[C@@H](CN[C@@H](c3ccccc3)c3ccc(F)cn3)C2)c1 ZINC000543404906 940054230 /nfs/dbraw/zinc/05/42/30/940054230.db2.gz LQDVMPYEDREIPL-BVZFJXPGSA-N 0 3 421.516 4.443 20 0 HIADHN COc1cc(CN[C@@H]2CCC(=O)Nc3ccccc32)cc(Br)c1OC ZINC000543425216 940060866 /nfs/dbraw/zinc/06/08/66/940060866.db2.gz WSCIUOISRMDHML-OAHLLOKOSA-N 0 3 405.292 4.030 20 0 HIADHN O=C1[C@@H](N[C@H]2CCCc3nc(-c4ccccc4)sc32)CCCN1Cc1ccccn1 ZINC000543427278 940061174 /nfs/dbraw/zinc/06/11/74/940061174.db2.gz WNBZXUVVULXMSU-FPOVZHCZSA-N 0 3 418.566 4.363 20 0 HIADHN O=C1[C@H](N[C@H]2CCCc3nc(-c4ccccc4)sc32)CCCN1Cc1ccccn1 ZINC000543427279 940061319 /nfs/dbraw/zinc/06/13/19/940061319.db2.gz WNBZXUVVULXMSU-PZJWPPBQSA-N 0 3 418.566 4.363 20 0 HIADHN CCN(C[C@@H]1CCN(Cc2ccccc2)C1)C(=O)[C@@H](C)CC(=O)c1ccc(OC)cc1 ZINC000543431412 940062314 /nfs/dbraw/zinc/06/23/14/940062314.db2.gz HKMGNHHSQPYVHE-RBBKRZOGSA-N 0 3 422.569 4.275 20 0 HIADHN O=C(N[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000543464752 940072494 /nfs/dbraw/zinc/07/24/94/940072494.db2.gz MGPHSUKXTJMCME-XPWALMASSA-N 0 3 411.521 4.010 20 0 HIADHN CC(C)C[C@H](N[C@@H](C)C(=O)N[C@H](C)c1ccc2c(c1)OCCO2)c1cccs1 ZINC000543485947 940080032 /nfs/dbraw/zinc/08/00/32/940080032.db2.gz PNPOUFPMDDKQIO-RYRKJORJSA-N 0 3 402.560 4.462 20 0 HIADHN CC(C)CN(CC(F)(F)F)C(=O)CN(C)[C@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000543560661 940109238 /nfs/dbraw/zinc/10/92/38/940109238.db2.gz MWTOPCWMCIETDH-ZWKOTPCHSA-N 0 3 404.448 4.025 20 0 HIADHN CN(Cc1ccc(Cl)s1)C(=O)CN(C)[C@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000543560972 940109606 /nfs/dbraw/zinc/10/96/06/940109606.db2.gz RNWOTVVIGTULQC-WMZOPIPTSA-N 0 3 410.942 4.351 20 0 HIADHN C[C@@H]1N(CC(=O)N[C@H](c2ccccc2)c2ccc(Cl)cc2)CCC12CCOCC2 ZINC000543574857 940116070 /nfs/dbraw/zinc/11/60/70/940116070.db2.gz RMOYEBJXHPDZEG-FDDCHVKYSA-N 0 3 412.961 4.437 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)Nc3ccc(Br)c(Cl)c3Cl)[C@H]2C1 ZINC000543647853 940149631 /nfs/dbraw/zinc/14/96/31/940149631.db2.gz MTCKZAIWVQSLSX-SKDRFNHKSA-N 0 3 407.139 4.314 20 0 HIADHN CS[C@@H]1CN(C(=O)c2ccc(-c3nc4ccccc4s3)o2)C[C@@H]1N1CCCC1 ZINC000543700136 940163990 /nfs/dbraw/zinc/16/39/90/940163990.db2.gz YYAGLRPZQNZGBQ-HNAYVOBHSA-N 0 3 413.568 4.208 20 0 HIADHN Cc1c2cc(Cl)ccc2oc1C(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1CO ZINC000543707088 940167068 /nfs/dbraw/zinc/16/70/68/940167068.db2.gz JQJODWRRMHJGFO-YLJYHZDGSA-N 0 3 412.917 4.007 20 0 HIADHN C[C@@H](Cc1ccccc1C(F)(F)F)NC(=O)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000543744038 940173178 /nfs/dbraw/zinc/17/31/78/940173178.db2.gz WOMXOZNXXHJLRG-QFBILLFUSA-N 0 3 405.464 4.060 20 0 HIADHN CC(C)[C@@H](NCc1ccccc1CS(=O)(=O)N1CCCC1)c1ccc(F)c(F)c1 ZINC000543773698 940181882 /nfs/dbraw/zinc/18/18/82/940181882.db2.gz MGFGGMZBPSLQPT-JOCHJYFZSA-N 0 3 422.541 4.377 20 0 HIADHN CSC[C@H](NCCNC(=O)c1ccccc1F)c1ccc(C(F)(F)F)cc1 ZINC000543776566 940182661 /nfs/dbraw/zinc/18/26/61/940182661.db2.gz LVGQUIIZLFVYPL-KRWDZBQOSA-N 0 3 400.441 4.268 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)NCC(=O)NCc2cccc(COC(C)C)c2)cc1 ZINC000543811795 940193944 /nfs/dbraw/zinc/19/39/44/940193944.db2.gz IOHDHQLPHJLBDT-LJQANCHMSA-N 0 3 420.557 4.073 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)NCC(=O)Nc2ccc(N3CCCC3)cc2C)cc1 ZINC000543811980 940195162 /nfs/dbraw/zinc/19/51/62/940195162.db2.gz OQBMNBCYSOBTRJ-IBGZPJMESA-N 0 3 417.557 4.379 20 0 HIADHN C[C@H](C(=O)N1CCC[C@H]1c1cccs1)N1CCC(CCCn2ccnc2)CC1 ZINC000543987777 940284136 /nfs/dbraw/zinc/28/41/36/940284136.db2.gz INFUPFXDJIZPDD-QUCCMNQESA-N 0 3 400.592 4.189 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)CC3CCC(C(F)(F)F)CC3)CC2)C[C@@H](C)O1 ZINC000544031099 940305102 /nfs/dbraw/zinc/30/51/02/940305102.db2.gz XHUCKRWPDDNFIZ-NXMBOHNASA-N 0 3 418.544 4.483 20 0 HIADHN Cc1ccc(C(=O)Nc2ccc(=O)n(CCN(C)C)c2)c(Sc2ccccc2)c1 ZINC000544085577 940322499 /nfs/dbraw/zinc/32/24/99/940322499.db2.gz RVHWIDMQJYTNOR-UHFFFAOYSA-N 0 3 407.539 4.122 20 0 HIADHN C[C@H](C[S@](C)=O)NCc1cn(Cc2ccccc2Cl)nc1-c1ccccc1 ZINC000544168117 940342227 /nfs/dbraw/zinc/34/22/27/940342227.db2.gz BHGUQPMZJBAXSS-JWIGPWBQSA-N 0 3 401.963 4.108 20 0 HIADHN CC(C)Oc1ccc(-c2nn(-c3ccccc3)cc2CN[C@H](C)C[S@](C)=O)cc1 ZINC000544169152 940342726 /nfs/dbraw/zinc/34/27/26/940342726.db2.gz MGGDKENEUHGNAK-LBEKAKSKSA-N 0 3 411.571 4.183 20 0 HIADHN O=S1(=O)CCCC[C@H]1CNCc1ccc(-c2ccccc2Br)s1 ZINC000544178033 940344910 /nfs/dbraw/zinc/34/49/10/940344910.db2.gz BRWJDEPQSPFXBU-AWEZNQCLSA-N 0 3 414.390 4.235 20 0 HIADHN CC1CCC(N2CCN(C(=O)[C@H]3CCn4c(cnc4C4CCCCC4)C3)CC2)CC1 ZINC000544225711 940360135 /nfs/dbraw/zinc/36/01/35/940360135.db2.gz ZCXBOONDOYHCDX-IRQNMHNUSA-N 0 3 412.622 4.216 20 0 HIADHN CSc1c(F)cc(NC(=O)N2CCC(CN3C[C@H](C)O[C@@H](C)C3)CC2)cc1F ZINC000544273804 940375802 /nfs/dbraw/zinc/37/58/02/940375802.db2.gz SPHIURHBSGKWAY-KBPBESRZSA-N 0 3 413.534 4.040 20 0 HIADHN CN1CCCN(c2ccc(-c3noc([C@H]4C[C@@H]4c4cccc(Cl)c4)n3)cn2)CC1 ZINC000544346421 940396053 /nfs/dbraw/zinc/39/60/53/940396053.db2.gz QEAOVMBDDHCVFL-MOPGFXCFSA-N 0 3 409.921 4.198 20 0 HIADHN COc1ccc(CN[C@@H](CN2CCOCC2)c2ccccc2C)c(C(F)(F)F)c1 ZINC000544356644 940399304 /nfs/dbraw/zinc/39/93/04/940399304.db2.gz HVIVCSUITTXZBA-NRFANRHFSA-N 0 3 408.464 4.186 20 0 HIADHN NC(=O)C1CCN(C[C@H](NCc2ccccc2Cl)c2ccc(Cl)cc2)CC1 ZINC000544362897 940402279 /nfs/dbraw/zinc/40/22/79/940402279.db2.gz QPTRKATVWNMZQP-FQEVSTJZSA-N 0 3 406.357 4.022 20 0 HIADHN CCOC(=O)C[C@@H](C)N(C)Cc1cc(Br)ccc1OCc1ccccn1 ZINC000544368615 940403603 /nfs/dbraw/zinc/40/36/03/940403603.db2.gz NSIYECGTOOOXKM-OAHLLOKOSA-N 0 3 421.335 4.197 20 0 HIADHN c1ccc2nc(N3CCCCC3)c(CN3CCC(OC[C@H]4CCOC4)CC3)cc2c1 ZINC000544372162 940404483 /nfs/dbraw/zinc/40/44/83/940404483.db2.gz XIPFHNOISBAQGL-FQEVSTJZSA-N 0 3 409.574 4.243 20 0 HIADHN COc1ccc(C(=O)C[C@@H](C)C(=O)NCc2ccccc2CN2CCCCC2)cc1 ZINC000544375702 940405562 /nfs/dbraw/zinc/40/55/62/940405562.db2.gz HWYOJMBEGKUIIP-LJQANCHMSA-N 0 3 408.542 4.206 20 0 HIADHN CCCCOc1ccc([C@H](C)N[C@@H]2CCCN(Cc3ccccn3)C2=O)cc1OC ZINC000544385003 940407687 /nfs/dbraw/zinc/40/76/87/940407687.db2.gz HLHNDRKLBLNUPF-GHTZIAJQSA-N 0 3 411.546 4.111 20 0 HIADHN Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)NC[C@H](O)COc1cc(C)ccc1Cl ZINC000544421209 940420490 /nfs/dbraw/zinc/42/04/90/940420490.db2.gz IWKWMGGQPUURAZ-DOMZBBRYSA-N 0 3 419.875 4.115 20 0 HIADHN CC(C)[C@H](NC(=O)CNC(C)(C)c1cccs1)c1ccc2c(c1)OCCCO2 ZINC000544471264 940446156 /nfs/dbraw/zinc/44/61/56/940446156.db2.gz NEIYVFOICGMZPU-NRFANRHFSA-N 0 3 402.560 4.248 20 0 HIADHN Cc1nn(Cc2ccccc2)c2sc(C(=O)N3CCN(C4CCC4)C[C@@H](C)C3)cc12 ZINC000563906322 945322307 /nfs/dbraw/zinc/32/23/07/945322307.db2.gz NGMQMLIFRFGMDU-QGZVFWFLSA-N 0 3 422.598 4.401 20 0 HIADHN C[C@H](NCC(=O)N(C)Cc1cc(Br)cs1)[C@H]1Oc2ccccc2[C@@H]1C ZINC000544514111 940466068 /nfs/dbraw/zinc/46/60/68/940466068.db2.gz HRUUHGOJBPTLGD-JMERFSKESA-N 0 3 423.376 4.012 20 0 HIADHN Cc1ccc(SCCNC(=O)CN(C)[C@H]2CCO[C@H](c3ccc(F)cc3)C2)cc1 ZINC000544525613 940471290 /nfs/dbraw/zinc/47/12/90/940471290.db2.gz KMSPAIBXJPQXKV-UNMCSNQZSA-N 0 3 416.562 4.195 20 0 HIADHN CC(C)c1ccc(CCNC(=O)CN(C)[C@@H]2CCO[C@H](c3ccc(F)cc3)C2)cc1 ZINC000544530437 940472976 /nfs/dbraw/zinc/47/29/76/940472976.db2.gz UETUZFVYTXWGMX-RPWUZVMVSA-N 0 3 412.549 4.460 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)Nc1ncn(C2CCCCC2)n1 ZINC000544630942 940494488 /nfs/dbraw/zinc/49/44/88/940494488.db2.gz QAJWDLCTAGRDRQ-UHFFFAOYSA-N 0 3 404.946 4.032 20 0 HIADHN O[C@H](CNCc1cc(F)cc(F)c1)COC(c1ccc(F)cc1)c1ccc(F)cc1 ZINC000563920433 945326215 /nfs/dbraw/zinc/32/62/15/945326215.db2.gz CNOLEDFAKKEKQR-JOCHJYFZSA-N 0 3 419.418 4.500 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N(C)[C@@H]2CCO[C@H](c3ccc(F)cc3)C2)N(C)C)cc1 ZINC000544662661 940500026 /nfs/dbraw/zinc/50/00/26/940500026.db2.gz OCTBCXZXLQLTNC-VJBWXMMDSA-N 0 3 413.537 4.299 20 0 HIADHN Cc1ccc(C(=O)CCCCC(=O)NCc2ccccc2CN2CCC(O)CC2)cc1 ZINC000544744643 940510166 /nfs/dbraw/zinc/51/01/66/940510166.db2.gz RRUYAJXIMYQOTO-UHFFFAOYSA-N 0 3 422.569 4.011 20 0 HIADHN COc1ccc2[nH]c3c(c2c1)C[C@@H](N[C@@H](c1nc(-c2cccnc2)no1)C(C)C)CC3 ZINC000545191451 940555190 /nfs/dbraw/zinc/55/51/90/940555190.db2.gz LBOVQVJCTGISLJ-KSFYIVLOSA-N 0 3 417.513 4.466 20 0 HIADHN Cc1ccc(-c2nc(NC(=O)[C@@]3(O)CCN(Cc4ccccc4)C3)sc2C)s1 ZINC000545266867 940559278 /nfs/dbraw/zinc/55/92/78/940559278.db2.gz MEHSADVIPUYSBB-OAQYLSRUSA-N 0 3 413.568 4.064 20 0 HIADHN C[C@H](CCN1C(=O)c2ccccc2C1=O)N[C@H](CC(F)(F)F)c1ccc(F)cc1 ZINC000545302461 940560804 /nfs/dbraw/zinc/56/08/04/940560804.db2.gz PMFGWNGCIRAZIQ-FZKQIMNGSA-N 0 3 408.395 4.484 20 0 HIADHN CCO[C@@H]1C[C@@H](NCc2c(C)nn(Cc3ccc(Cl)cc3)c2C)[C@@]12CCCO2 ZINC000545349785 940563771 /nfs/dbraw/zinc/56/37/71/940563771.db2.gz GTMMWEDMUPOJHI-VSKRKVRLSA-N 0 3 403.954 4.018 20 0 HIADHN Cc1cc(C)n(-c2ccc(CNCc3cnccc3N(C)C)c(C(F)(F)F)c2)n1 ZINC000545368960 940566260 /nfs/dbraw/zinc/56/62/60/940566260.db2.gz OYJYQCWPMIQKBU-UHFFFAOYSA-N 0 3 403.452 4.259 20 0 HIADHN COC(=O)[C@@H](C)Cc1ccc(NC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)cc1 ZINC000545428544 940569423 /nfs/dbraw/zinc/56/94/23/940569423.db2.gz LOFDLVBALUUORQ-PMACEKPBSA-N 0 3 423.557 4.167 20 0 HIADHN CCC(CC)(C(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1)c1ccc(OC)c(OC)c1 ZINC000545443527 940570153 /nfs/dbraw/zinc/57/01/53/940570153.db2.gz ZNUNXLYVRJZBLN-NZQKXSOJSA-N 0 3 410.558 4.323 20 0 HIADHN CCC(CC)(C(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1)c1ccc(OC)c(OC)c1 ZINC000545443528 940570216 /nfs/dbraw/zinc/57/02/16/940570216.db2.gz ZNUNXLYVRJZBLN-OFNKIYASSA-N 0 3 410.558 4.323 20 0 HIADHN COc1cc(-c2noc([C@@H]3CCCN(Cc4cccnc4)C3)n2)ccc1OC(C)C ZINC000545530704 940573488 /nfs/dbraw/zinc/57/34/88/940573488.db2.gz CXMXIDKMZKMOLP-LJQANCHMSA-N 0 3 408.502 4.307 20 0 HIADHN FC(F)(F)[C@]1(c2nc(-c3ccc4c(c3)OCO4)no2)CCN(Cc2ccccc2)C1 ZINC000545581862 940575805 /nfs/dbraw/zinc/57/58/05/940575805.db2.gz VKSITWVCMSFYOR-HXUWFJFHSA-N 0 3 417.387 4.171 20 0 HIADHN CCCOc1ccc(/C=C/c2nc(-c3ccc(N4CCCN(C)CC4)nc3)no2)cc1 ZINC000545650786 940578913 /nfs/dbraw/zinc/57/89/13/940578913.db2.gz HEBATQJDSQOVQZ-KPKJPENVSA-N 0 3 419.529 4.233 20 0 HIADHN COc1ccc(COCc2noc([C@H]3CCCN(Cc4cccc(F)c4)C3)n2)cc1 ZINC000545681358 940580406 /nfs/dbraw/zinc/58/04/06/940580406.db2.gz RBJRHGGRXKAZIZ-IBGZPJMESA-N 0 3 411.477 4.314 20 0 HIADHN Fc1cccc(CN2CCC[C@@H](c3nc(-c4cccc(-n5cccn5)c4)no3)C2)c1 ZINC000545691503 940580989 /nfs/dbraw/zinc/58/09/89/940580989.db2.gz LNZAFIJZQMWMCH-LJQANCHMSA-N 0 3 403.461 4.441 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)c1cn(C)nc1-c1ccc(Cl)s1)c1ccco1 ZINC000563987786 945336418 /nfs/dbraw/zinc/33/64/18/945336418.db2.gz MGXFPOTZOGGUHY-JSGCOSHPSA-N 0 3 406.939 4.254 20 0 HIADHN FC(F)(F)c1ccc(-c2nc(CNC3CCN(c4cnccn4)CC3)cs2)cc1 ZINC000545905710 940656267 /nfs/dbraw/zinc/65/62/67/940656267.db2.gz XTYOWMIEWOFVRH-UHFFFAOYSA-N 0 3 419.476 4.378 20 0 HIADHN COc1cc(OC)cc(Oc2ccc(CN3CCOC4(CCOCC4)CC3)cc2)c1 ZINC000546010439 940673898 /nfs/dbraw/zinc/67/38/98/940673898.db2.gz OREIMOCRIYJNRO-UHFFFAOYSA-N 0 3 413.514 4.268 20 0 HIADHN CC(=O)[C@@H]1C[C@H](CC(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)C1(C)C ZINC000546123624 940705791 /nfs/dbraw/zinc/70/57/91/940705791.db2.gz SCTQHLBHZAMPIZ-FSSWDIPSSA-N 0 3 422.573 4.218 20 0 HIADHN COc1ccccc1Oc1ccc(NC(=O)N2C[C@@H](SC)[C@@H](N(C)C)C2)cc1F ZINC000546131458 940708411 /nfs/dbraw/zinc/70/84/11/940708411.db2.gz CVVGXNGJRWXPQY-OXJNMPFZSA-N 0 3 419.522 4.136 20 0 HIADHN COc1ccccc1Oc1ccc(NC(=O)N2C[C@@H](N(C)C)[C@@H](SC)C2)cc1F ZINC000546131460 940708441 /nfs/dbraw/zinc/70/84/41/940708441.db2.gz CVVGXNGJRWXPQY-UZLBHIALSA-N 0 3 419.522 4.136 20 0 HIADHN O=C(Nc1ccncc1F)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000546147666 940713415 /nfs/dbraw/zinc/71/34/15/940713415.db2.gz OIKFAAIJDGQLFE-UHFFFAOYSA-N 0 3 411.308 4.079 20 0 HIADHN COc1ccc(NC(=O)CCCN2CCN(c3ccccc3)CC2)cc1OC(C)C ZINC000546160667 940717331 /nfs/dbraw/zinc/71/73/31/940717331.db2.gz FSJTXDBUYYQWIQ-UHFFFAOYSA-N 0 3 411.546 4.023 20 0 HIADHN CCN(C(=O)c1cnc(-c2ccccc2)nc1C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000546185395 940724466 /nfs/dbraw/zinc/72/44/66/940724466.db2.gz HMGWEQAJBADUBK-QFIPXVFZSA-N 0 3 400.526 4.189 20 0 HIADHN COCCn1cc2c(n1)[C@@H](N[C@H](C)Cc1ccc(Br)c(F)c1)CCC2 ZINC000546227790 940735700 /nfs/dbraw/zinc/73/57/00/940735700.db2.gz QBKOYCSVUHTUGF-ACJLOTCBSA-N 0 3 410.331 4.029 20 0 HIADHN COCCn1cc2c(n1)[C@@H](N[C@@H](C)Cc1ccc(Br)c(F)c1)CCC2 ZINC000546227793 940735756 /nfs/dbraw/zinc/73/57/56/940735756.db2.gz QBKOYCSVUHTUGF-UGSOOPFHSA-N 0 3 410.331 4.029 20 0 HIADHN COCCn1cc2c(n1)[C@H](N[C@@H](C)Cc1ccc(Br)cc1F)CCC2 ZINC000546227230 940735802 /nfs/dbraw/zinc/73/58/02/940735802.db2.gz FOJZWTOXWUIJCL-SCLBCKFNSA-N 0 3 410.331 4.029 20 0 HIADHN CCc1ccccc1-n1cnnc1SCc1nc(-c2ccc(CN(C)C)cc2)no1 ZINC000546245812 940745448 /nfs/dbraw/zinc/74/54/48/940745448.db2.gz KUODPGGMTZUVOT-UHFFFAOYSA-N 0 3 420.542 4.234 20 0 HIADHN COc1ccc(C[C@@H](C)CN2CCCN(C(=O)c3ccc(F)cc3)CC2)cc1F ZINC000546308179 940776030 /nfs/dbraw/zinc/77/60/30/940776030.db2.gz VSAHZEBSLZWZJC-QGZVFWFLSA-N 0 3 402.485 4.000 20 0 HIADHN Cc1ccc2c(Cc3nc(-c4ccc(N5CCCN(C)CC5)nc4)no3)coc2c1C ZINC000546369103 940803516 /nfs/dbraw/zinc/80/35/16/940803516.db2.gz JOFQRHRCUVURRC-UHFFFAOYSA-N 0 3 417.513 4.227 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)c2ccc(-c3ccccc3)[nH]c2=O)N(C)C)cc1 ZINC000564017906 945351034 /nfs/dbraw/zinc/35/10/34/945351034.db2.gz SWHKYXVXFXSIEF-HSZRJFAPSA-N 0 3 419.525 4.274 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)NCc2nc3ccccc3n2C2CC2)C1 ZINC000546763159 940878444 /nfs/dbraw/zinc/87/84/44/940878444.db2.gz ZNPMGZYXGIPCCP-HKUYNNGSSA-N 0 3 403.530 4.006 20 0 HIADHN Cc1nc(C(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)c(-c2ccccc2)o1 ZINC000546853970 940895494 /nfs/dbraw/zinc/89/54/94/940895494.db2.gz WXCYRQRMRFVYCY-ROUUACIJSA-N 0 3 411.546 4.002 20 0 HIADHN Cc1c([C@@H](C)NCCC[C@H]2CCCCO2)nnn1-c1cccc(Br)c1 ZINC000546872018 940898884 /nfs/dbraw/zinc/89/88/84/940898884.db2.gz WLGSXJTUPCIPHJ-RDTXWAMCSA-N 0 3 407.356 4.338 20 0 HIADHN CS(=O)(=O)Cc1cccc(CN[C@@H](Cc2cccnc2)c2ccc(Cl)cc2)c1 ZINC000546873611 940899270 /nfs/dbraw/zinc/89/92/70/940899270.db2.gz RMDKOQFBPBEPDU-QFIPXVFZSA-N 0 3 414.958 4.353 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CNC(=O)CN[C@@H](C)c1c(C)cccc1C ZINC000546931356 940917760 /nfs/dbraw/zinc/91/77/60/940917760.db2.gz VNBMYLOEHFKVMW-FQEVSTJZSA-N 0 3 404.558 4.132 20 0 HIADHN C[C@H](Cc1ccccc1Cl)c1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1 ZINC000547063611 940980071 /nfs/dbraw/zinc/98/00/71/940980071.db2.gz QOHZXAPPTRYRHX-MRXNPFEDSA-N 0 3 411.937 4.273 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(-c4cc5cc(Cl)ccc5o4)n3)cn2)CC1 ZINC000547064402 940980510 /nfs/dbraw/zinc/98/05/10/940980510.db2.gz HYRYYCBPYCJCOE-UHFFFAOYSA-N 0 3 409.877 4.340 20 0 HIADHN C[C@H](Oc1ccccc1Cl)c1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1 ZINC000547069965 940982554 /nfs/dbraw/zinc/98/25/54/940982554.db2.gz YGZAZLASIUAWGT-HNNXBMFYSA-N 0 3 413.909 4.067 20 0 HIADHN CC(C)c1ccc(CCc2nc(-c3ccc(N4CCCN(C)CC4)nc3)no2)cc1 ZINC000547071211 940983319 /nfs/dbraw/zinc/98/33/19/940983319.db2.gz XXIOTINPCHSJQO-UHFFFAOYSA-N 0 3 405.546 4.182 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(CSc4ccc5c(c4)CCC5)n3)cn2)CC1 ZINC000547073370 940984030 /nfs/dbraw/zinc/98/40/30/940984030.db2.gz ZTQZZVAUBNUXGP-UHFFFAOYSA-N 0 3 421.570 4.055 20 0 HIADHN O=C(c1cc(Oc2ccccc2)ccn1)N1CCN(c2ccnc3ccccc32)CC1 ZINC000564055807 945365247 /nfs/dbraw/zinc/36/52/47/945365247.db2.gz LKVGLKVXZAZBSI-UHFFFAOYSA-N 0 3 410.477 4.385 20 0 HIADHN COCCCOc1cc(C)ccc1-c1noc([C@H]2CCCN(Cc3cccnc3)C2)n1 ZINC000547167045 941018359 /nfs/dbraw/zinc/01/83/59/941018359.db2.gz IIIUNFCEFRYQKU-FQEVSTJZSA-N 0 3 422.529 4.235 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N[C@@H](C(C)(C)C)C(F)(F)F)c(C)c2)CC1 ZINC000547532258 941067788 /nfs/dbraw/zinc/06/77/88/941067788.db2.gz LLYKIUZZMHTEQL-KRWDZBQOSA-N 0 3 400.489 4.235 20 0 HIADHN CC(C)([C@@H](NC(=O)Cc1ccc2c(c1)COC2)c1ccc(F)c(F)c1)N1CCCC1 ZINC000547622138 941068882 /nfs/dbraw/zinc/06/88/82/941068882.db2.gz MYGQWEJOHJYQAH-QHCPKHFHSA-N 0 3 414.496 4.269 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3coc(C4CCCCC4)n3)CC2)C[C@@H](C)O1 ZINC000547948211 941080050 /nfs/dbraw/zinc/08/00/50/941080050.db2.gz CFNIJBMBWSTBML-QZTJIDSGSA-N 0 3 403.567 4.074 20 0 HIADHN CC(C)(C)[C@H](NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1)C(F)(F)F ZINC000548066598 941085007 /nfs/dbraw/zinc/08/50/07/941085007.db2.gz GGYJORQAXJDGNM-BPCQOVAHSA-N 0 3 403.411 4.068 20 0 HIADHN C[C@H](N[C@@H]1CCCc2ncc(C(F)(F)F)cc21)[C@@H]1CN(Cc2ccccc2)CCO1 ZINC000548306526 941094930 /nfs/dbraw/zinc/09/49/30/941094930.db2.gz POAAPJKDDMSATB-USCONSEESA-N 0 3 419.491 4.357 20 0 HIADHN C[C@H](NCCCCN1C(=O)c2ccccc2C1=O)c1nc2ccccc2n1C(F)F ZINC000548403649 941100056 /nfs/dbraw/zinc/10/00/56/941100056.db2.gz YZBKSMVTTCPHAU-AWEZNQCLSA-N 0 3 412.440 4.158 20 0 HIADHN CCOC(=O)CCc1ccc(NC(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)cc1 ZINC000548964592 941134984 /nfs/dbraw/zinc/13/49/84/941134984.db2.gz VFSUDIMIVLDBCL-HXUWFJFHSA-N 0 3 417.937 4.260 20 0 HIADHN Cc1nn(-c2ccccn2)c(C)c1CNCc1ccccc1CN(C)Cc1ccco1 ZINC000548982046 941138507 /nfs/dbraw/zinc/13/85/07/941138507.db2.gz PQASVJNZZOGOLS-UHFFFAOYSA-N 0 3 415.541 4.399 20 0 HIADHN CO[C@H](CN[C@H](CO)c1ccc(Br)cc1C(F)(F)F)c1ccccc1 ZINC000549035922 941146935 /nfs/dbraw/zinc/14/69/35/941146935.db2.gz FHGAXSUNMYJCEJ-IAGOWNOFSA-N 0 3 418.253 4.479 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)Nc1ccc(OC(F)F)cc1F ZINC000549049373 941148448 /nfs/dbraw/zinc/14/84/48/941148448.db2.gz KIHWKPYCGLMJIH-UHFFFAOYSA-N 0 3 417.378 4.301 20 0 HIADHN COc1ccc([C@H](NC(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)C2CC2)cc1 ZINC000549104306 941159470 /nfs/dbraw/zinc/15/94/70/941159470.db2.gz RGZHAEUSJHRUNU-NHCUHLMSSA-N 0 3 401.938 4.402 20 0 HIADHN COc1cccc([C@@H]2[C@@H](NCC(=O)Nc3ccc(Cl)cc3C)CCN2C2CC2)c1 ZINC000549111517 941160776 /nfs/dbraw/zinc/16/07/76/941160776.db2.gz CNAPBTQITVLGEF-JTHBVZDNSA-N 0 3 413.949 4.163 20 0 HIADHN CC(C)(C)N1CC[C@@H](NCc2cn3cccnc3n2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000549112775 941160941 /nfs/dbraw/zinc/16/09/41/941160941.db2.gz GMVWVVRGYWANIC-RTBURBONSA-N 0 3 401.917 4.226 20 0 HIADHN COc1cccc([C@@H]2[C@H](N[C@@H](C)C(=O)Nc3ccccc3Cl)CCN2C2CC2)c1 ZINC000549112870 941160944 /nfs/dbraw/zinc/16/09/44/941160944.db2.gz MELJHUNWBBDVIB-ITEAAPOESA-N 0 3 413.949 4.243 20 0 HIADHN Cc1cc(NC(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)ccc1C(=O)NC(C)C ZINC000549230727 941172486 /nfs/dbraw/zinc/17/24/86/941172486.db2.gz BDBDCVPLKIXQJT-FQEVSTJZSA-N 0 3 416.953 4.211 20 0 HIADHN CN(C)C[C@H](NC(=O)Cc1coc(-c2ccc(F)cc2)n1)c1ccc(Cl)cc1 ZINC000549232616 941172851 /nfs/dbraw/zinc/17/28/51/941172851.db2.gz KETQCLODGJFEFQ-IBGZPJMESA-N 0 3 401.869 4.096 20 0 HIADHN COc1ccc(Br)c(C(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)c1 ZINC000549244607 941173786 /nfs/dbraw/zinc/17/37/86/941173786.db2.gz HJSWKDRHUOTGSW-KRWDZBQOSA-N 0 3 411.727 4.144 20 0 HIADHN COc1ccc(CN(Cc2ccc(-n3cncn3)c(F)c2)[C@@H](C)C2CC2)c(OC)c1 ZINC000549423768 941188394 /nfs/dbraw/zinc/18/83/94/941188394.db2.gz JURQSJNRLAPBAS-INIZCTEOSA-N 0 3 410.493 4.224 20 0 HIADHN CCn1c(CSc2ccc(Cl)cc2)nnc1N1CCN(C2CCCC2)CC1 ZINC000549437032 941189802 /nfs/dbraw/zinc/18/98/02/941189802.db2.gz VKQNGZZEQBPHGD-UHFFFAOYSA-N 0 3 405.999 4.308 20 0 HIADHN Cc1ccc(C)c(NC(=O)CN[C@@H]2CCN(C(C)C)[C@@H]2c2ccc(F)c(F)c2)c1 ZINC000549469475 941192919 /nfs/dbraw/zinc/19/29/19/941192919.db2.gz UGMKOAWMDSJZHB-NFBKMPQASA-N 0 3 401.501 4.334 20 0 HIADHN CCN1CC[C@@H](NCC(=O)Nc2c(C)cccc2C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000549470498 941193311 /nfs/dbraw/zinc/19/33/11/941193311.db2.gz CURJURQURTWINQ-KNQAVFIVSA-N 0 3 403.929 4.460 20 0 HIADHN CC(C)N1CC[C@@H](N[C@@H](C)C(=O)Nc2c(F)cccc2F)[C@@H]1c1ccc(F)c(F)c1 ZINC000549471649 941193358 /nfs/dbraw/zinc/19/33/58/941193358.db2.gz NMAIAYMXLRYPFN-NQZBTDCJSA-N 0 3 423.454 4.384 20 0 HIADHN CN(CC(F)(F)F)C(=O)CN[C@@H]1CCN(C(C)(C)C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000549479069 941194821 /nfs/dbraw/zinc/19/48/21/941194821.db2.gz XGRMHHNIEUVNCY-WBVHZDCISA-N 0 3 423.882 4.003 20 0 HIADHN CCN1CC[C@H](N[C@@H](C)C(=O)N(C)C2CCCCC2)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000549482085 941195204 /nfs/dbraw/zinc/19/52/04/941195204.db2.gz KWOFZBCGQLELQP-JBYOLUDKSA-N 0 3 411.512 4.008 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@@H](NCc2ccnc(OCC(F)(F)F)c2)c2ccccc21 ZINC000549523792 941198038 /nfs/dbraw/zinc/19/80/38/941198038.db2.gz LNBJDMULYNQOTF-QZTJIDSGSA-N 0 3 408.420 4.294 20 0 HIADHN COCCc1ccc(OC[C@H](O)CN2CCCC[C@@H]2c2cc3ccccc3[nH]2)cc1 ZINC000549527824 941198132 /nfs/dbraw/zinc/19/81/32/941198132.db2.gz VXVSHTILOAWHOJ-PXDATVDWSA-N 0 3 408.542 4.324 20 0 HIADHN CN(C)C[C@@H](NC(=O)c1cccc(OCc2cccnc2)c1)c1ccc(Cl)cc1 ZINC000549618011 941201479 /nfs/dbraw/zinc/20/14/79/941201479.db2.gz WNXCPBSGVMJBCK-JOCHJYFZSA-N 0 3 409.917 4.347 20 0 HIADHN CN(C)C[C@H](NC(=O)c1cccc(NC(=O)c2cccnc2)c1)c1ccc(Cl)cc1 ZINC000549618479 941201518 /nfs/dbraw/zinc/20/15/18/941201518.db2.gz STSMDNCTHRGTOH-NRFANRHFSA-N 0 3 422.916 4.020 20 0 HIADHN CN1CCN(CCCSc2nnc(-c3ccccc3Cl)n2C2CCCC2)CC1 ZINC000549619774 941201645 /nfs/dbraw/zinc/20/16/45/941201645.db2.gz ORQLVVWDXAJSTA-UHFFFAOYSA-N 0 3 420.026 4.443 20 0 HIADHN COc1cc2c(cc1F)CC[C@H]2NC(=O)N[C@H](CN(C)C)c1ccc(Cl)cc1 ZINC000549624071 941201839 /nfs/dbraw/zinc/20/18/39/941201839.db2.gz FDIOULUTMLDAMP-RTBURBONSA-N 0 3 405.901 4.077 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@@H](NCc2ccc(S(C)(=O)=O)c(Cl)c2)c2ccccc21 ZINC000549624375 941201857 /nfs/dbraw/zinc/20/18/57/941201857.db2.gz JAJDOTIXFDPZLD-IEBWSBKVSA-N 0 3 421.946 4.015 20 0 HIADHN C[C@]1(C(=O)NCCCCN2CCN(c3cccc(C(F)(F)F)c3)CC2)C[C@H]2C[C@H]2C1 ZINC000549721284 941205645 /nfs/dbraw/zinc/20/56/45/941205645.db2.gz CXPUNKGZISTUHT-OEWRPIJISA-N 0 3 423.523 4.160 20 0 HIADHN COc1ccc(CCNCc2cc(O)ccc2Br)c(Cl)c1OC ZINC000549842194 941211501 /nfs/dbraw/zinc/21/15/01/941211501.db2.gz NSAUQAQDYPIDDL-UHFFFAOYSA-N 0 3 400.700 4.158 20 0 HIADHN CC(C)[C@]1(CO)CCCN(CC(=O)N2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)C1 ZINC000550063367 941277348 /nfs/dbraw/zinc/27/73/48/941277348.db2.gz LQDWZRVBFWDTAY-TZIWHRDSSA-N 0 3 413.389 4.387 20 0 HIADHN O=C(c1ccc(OC(F)F)c(F)c1)N1CCCN(CCCc2ccccc2)CC1 ZINC000550444757 941328227 /nfs/dbraw/zinc/32/82/27/941328227.db2.gz QKYLCZUQRBSEGO-UHFFFAOYSA-N 0 3 406.448 4.208 20 0 HIADHN Brc1cc2c(s1)CC[C@@H]2NCc1ccccc1CN1CCOCC1 ZINC000550608491 941346171 /nfs/dbraw/zinc/34/61/71/941346171.db2.gz IJQJMARYBOFFEA-KRWDZBQOSA-N 0 3 407.377 4.120 20 0 HIADHN CN(C)[C@H](CNC(=O)c1cc(Cl)cc(F)c1Br)Cc1ccccc1 ZINC000550650696 941350504 /nfs/dbraw/zinc/35/05/04/941350504.db2.gz UWSKNACZKBIAGR-AWEZNQCLSA-N 0 3 413.718 4.144 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)c1cc(Cl)cc(F)c1Br ZINC000550655422 941350682 /nfs/dbraw/zinc/35/06/82/941350682.db2.gz CQFAGXLPUHEOFB-UHFFFAOYSA-N 0 3 403.679 4.039 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)NCC1(c2ccc(F)cc2)CC1 ZINC000550660363 941351231 /nfs/dbraw/zinc/35/12/31/941351231.db2.gz MLZJQVVVKBVZBU-UHFFFAOYSA-N 0 3 403.929 4.284 20 0 HIADHN Cc1cc(C)c(NC(=O)CN[C@@H]2CCN(C)[C@@H]2c2ccc(F)c(F)c2)c(Cl)c1 ZINC000550714526 941357457 /nfs/dbraw/zinc/35/74/57/941357457.db2.gz XQFUQRLLSIOQQQ-WIYYLYMNSA-N 0 3 407.892 4.209 20 0 HIADHN CN(C)Cc1cccc(NC(=O)N[C@@H](c2cncc(Br)c2)C2CC2)c1 ZINC000551019512 941395801 /nfs/dbraw/zinc/39/58/01/941395801.db2.gz KYJAXSHTTBVHTD-GOSISDBHSA-N 0 3 403.324 4.179 20 0 HIADHN CN1CC[C@@H](NCC(=O)Nc2ccc(Br)cc2Cl)[C@H]1c1ccccc1 ZINC000551098010 941409310 /nfs/dbraw/zinc/40/93/10/941409310.db2.gz UYBNMNARSSSTFX-IEBWSBKVSA-N 0 3 422.754 4.076 20 0 HIADHN CCCN(C)[C@@H](CN[C@@H](c1nc[nH]n1)c1ccc(F)cc1)c1ccc(Cl)cc1 ZINC000551197369 941426557 /nfs/dbraw/zinc/42/65/57/941426557.db2.gz NSXVRKZPDMWTNP-VQTJNVASSA-N 0 3 401.917 4.359 20 0 HIADHN CC(=O)c1cc(C(=O)N(C[C@@H]2CCN(Cc3ccccc3)C2)CC(F)(F)F)cs1 ZINC000551276212 941442038 /nfs/dbraw/zinc/44/20/38/941442038.db2.gz GFTMXMMXTZJXLQ-QGZVFWFLSA-N 0 3 424.488 4.477 20 0 HIADHN CC[C@@H](Cn1cncn1)N[C@H](c1ccc(OC)cc1)c1ccc(C(F)(F)F)cc1 ZINC000551293217 941445043 /nfs/dbraw/zinc/44/50/43/941445043.db2.gz AXLSLZSUFXVEDE-ICSRJNTNSA-N 0 3 404.436 4.463 20 0 HIADHN Cn1ccc(C(=O)NC2CCN(CCOc3ccc(Cl)cc3)CC2)c1C1CCC1 ZINC000551300061 941446368 /nfs/dbraw/zinc/44/63/68/941446368.db2.gz CFPQHCLCNINPBU-UHFFFAOYSA-N 0 3 415.965 4.219 20 0 HIADHN Cc1cc(Br)c(NS(=O)(=O)c2ccc(CN(C)C)cc2)cc1Cl ZINC000551385791 941466263 /nfs/dbraw/zinc/46/62/63/941466263.db2.gz PLZDINZQGJVVNT-UHFFFAOYSA-N 0 3 417.756 4.273 20 0 HIADHN Fc1ccc([C@H](NC[C@H]2CN(Cc3ccccc3)CCCO2)c2ccccn2)cc1 ZINC000551393227 941468479 /nfs/dbraw/zinc/46/84/79/941468479.db2.gz AGJLUXOERZGPBN-ZCYQVOJMSA-N 0 3 405.517 4.191 20 0 HIADHN Cc1nnc(SC[C@@H]2CN(Cc3ccccc3)CCCO2)n1Cc1ccccc1 ZINC000551415418 941474378 /nfs/dbraw/zinc/47/43/78/941474378.db2.gz QGBYBPRNXHVCFC-QFIPXVFZSA-N 0 3 408.571 4.018 20 0 HIADHN CCCCO[C@@H]1C[C@H](NCc2cc(C(F)(F)F)cc(S(C)(=O)=O)c2)C1(C)C ZINC000551517100 941493202 /nfs/dbraw/zinc/49/32/02/941493202.db2.gz DZDGDRGMPCIUTM-DLBZAZTESA-N 0 3 407.498 4.182 20 0 HIADHN COc1ccc([C@@H](CN(C)C)N[C@@H](C)c2ccc(I)cc2)cc1 ZINC000551555402 941500545 /nfs/dbraw/zinc/50/05/45/941500545.db2.gz XHKOYOSHFWWOFQ-IFXJQAMLSA-N 0 3 424.326 4.253 20 0 HIADHN COc1ccc2c(c1)CCC[C@@H]2NCc1cccc(N2C(=O)N[C@](C)(C3CC3)C2=O)c1 ZINC000551572512 941504948 /nfs/dbraw/zinc/50/49/48/941504948.db2.gz ZPTUOFNXNGHGTA-WIOPSUGQSA-N 0 3 419.525 4.087 20 0 HIADHN Cc1ccc(Br)c(C)c1C(=O)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000551739454 941536613 /nfs/dbraw/zinc/53/66/13/941536613.db2.gz COUADXVNXNCGKX-UHFFFAOYSA-N 0 3 417.347 4.275 20 0 HIADHN CCc1nc(C(C)C)ccc1C(=O)N1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000551750542 941538500 /nfs/dbraw/zinc/53/85/00/941538500.db2.gz RYEJXQQPZZHJTB-OALUTQOASA-N 0 3 401.595 4.119 20 0 HIADHN CC(C)CO[C@H]1C[C@@H](NCc2cc(C(F)(F)F)cc(S(C)(=O)=O)c2)C1(C)C ZINC000551781249 941544355 /nfs/dbraw/zinc/54/43/55/941544355.db2.gz WOHOAHICVCVHKX-SJORKVTESA-N 0 3 407.498 4.038 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)c2cccc(COc3ccc(C)nc3)c2)cc1 ZINC000551793710 941545939 /nfs/dbraw/zinc/54/59/39/941545939.db2.gz GPVXKKGSDSUZHW-DEOSSOPVSA-N 0 3 419.525 4.010 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)c2sc(-c3cccs3)nc2C)cc1 ZINC000551793197 941546257 /nfs/dbraw/zinc/54/62/57/941546257.db2.gz HYVJTKPANUVOON-INIZCTEOSA-N 0 3 401.557 4.221 20 0 HIADHN CC(C)(C)c1ncc(CNCCSCCOc2cccc(Br)c2)cn1 ZINC000551799344 941547392 /nfs/dbraw/zinc/54/73/92/941547392.db2.gz UJVBLGCGJPZDRA-UHFFFAOYSA-N 0 3 424.408 4.438 20 0 HIADHN C[C@H]1CN([C@@H](CNCc2cnc(C(C)(C)C)nc2)c2c(F)cccc2Cl)CCO1 ZINC000551799250 941547410 /nfs/dbraw/zinc/54/74/10/941547410.db2.gz OZFLHWOOXIDFLQ-KXBFYZLASA-N 0 3 420.960 4.118 20 0 HIADHN COCC[C@H](N[C@H](C)c1ccc(S(N)(=O)=O)cc1)c1ccc(Cl)c(Cl)c1 ZINC000551812497 941550040 /nfs/dbraw/zinc/55/00/40/941550040.db2.gz FKYBENMRGPZZFR-XIKOKIGWSA-N 0 3 417.358 4.069 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@H](N[C@H](C)c2ccc(S(=O)(=O)CC)cc2)c2ccccc21 ZINC000551812742 941550070 /nfs/dbraw/zinc/55/00/70/941550070.db2.gz NHKLBNUAQKLSAI-HVETUWLQSA-N 0 3 415.555 4.313 20 0 HIADHN O=C(c1ccc(F)cc1Br)N1CCN(c2ccnc3ccccc32)CC1 ZINC000552008435 941567896 /nfs/dbraw/zinc/56/78/96/941567896.db2.gz BKAIRBGMFOVXHG-UHFFFAOYSA-N 0 3 414.278 4.099 20 0 HIADHN CC[C@H](NCc1ccc(C(=O)N2CCOCC2)cc1)c1ccc(OC(F)(F)F)cc1 ZINC000552040684 941572129 /nfs/dbraw/zinc/57/21/29/941572129.db2.gz LSEKMNNEPFOZJR-FQEVSTJZSA-N 0 3 422.447 4.299 20 0 HIADHN CNC(=O)COc1cccc(CN[C@@H](C)c2ccc(OCc3ccccc3)cc2)c1 ZINC000552074733 941580264 /nfs/dbraw/zinc/58/02/64/941580264.db2.gz YZFJFBLKKJCAMO-IBGZPJMESA-N 0 3 404.510 4.241 20 0 HIADHN COc1cc(OC)cc(Oc2ccc(CN3CCC(O[C@H]4CCOC4)CC3)cc2)c1 ZINC000552080102 941581079 /nfs/dbraw/zinc/58/10/79/941581079.db2.gz VZWVTPFJXMYSSU-NRFANRHFSA-N 0 3 413.514 4.266 20 0 HIADHN OCC1([C@H](NCc2cc(Br)c3c(c2)OCCO3)c2ccccc2)CCC1 ZINC000552085261 941581630 /nfs/dbraw/zinc/58/16/30/941581630.db2.gz WWFUJOMZCZCMIO-HXUWFJFHSA-N 0 3 418.331 4.214 20 0 HIADHN CCc1nnc(NC(=O)[C@H](C)[C@H](C)N[C@H](C)c2ccc(F)cc2OC(F)F)s1 ZINC000552089174 941582621 /nfs/dbraw/zinc/58/26/21/941582621.db2.gz CABYFXSIHRFORR-OUAUKWLOSA-N 0 3 416.469 4.155 20 0 HIADHN COc1ccc([C@@H](Cc2ccc(F)cc2)NCC2(S(C)(=O)=O)CCCC2)cc1 ZINC000552099529 941584765 /nfs/dbraw/zinc/58/47/65/941584765.db2.gz LOWLCPFXDZCSPK-OAQYLSRUSA-N 0 3 405.535 4.065 20 0 HIADHN COc1ccccc1-c1ccc([C@H](C)NC[C@H](N2CCOCC2)C(F)(F)F)cc1 ZINC000552097219 941584822 /nfs/dbraw/zinc/58/48/22/941584822.db2.gz WTNFIEUSKZYFRK-KKSFZXQISA-N 0 3 408.464 4.276 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@@H](C)N[C@@H](C)c2ccc3n[nH]cc3c2)cc1 ZINC000552098604 941584838 /nfs/dbraw/zinc/58/48/38/941584838.db2.gz JOLLKKGOWCJXCR-CVEARBPZSA-N 0 3 400.548 4.005 20 0 HIADHN COc1ccccc1-c1ccc([C@@H](C)NC[C@H](N2CCOCC2)C(F)(F)F)cc1 ZINC000552097217 941584904 /nfs/dbraw/zinc/58/49/04/941584904.db2.gz WTNFIEUSKZYFRK-IERDGZPVSA-N 0 3 408.464 4.276 20 0 HIADHN COc1cccc(NC(=O)C[C@H](C)N[C@@H](CCO)c2ccc(Cl)c(Cl)c2)c1 ZINC000552100723 941585148 /nfs/dbraw/zinc/58/51/48/941585148.db2.gz SLVIKSRNRVMRJY-DJJJIMSYSA-N 0 3 411.329 4.432 20 0 HIADHN COc1ccc(Nc2ccccc2C(=O)Nc2cccc(CN3CC[C@@H](O)C3)c2)cc1 ZINC000552200697 941600889 /nfs/dbraw/zinc/60/08/89/941600889.db2.gz MNVLAEZEHVZORF-OAQYLSRUSA-N 0 3 417.509 4.258 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)[C@H]1C[C@@H]1c1cc(Cl)cc(Cl)c1 ZINC000552200469 941600942 /nfs/dbraw/zinc/60/09/42/941600942.db2.gz FKMBUWIUNLNJRM-ZCNNSNEGSA-N 0 3 405.325 4.302 20 0 HIADHN O=C(CCCCc1nc2ccccc2s1)Nc1cccc(CN2CC[C@H](O)C2)c1 ZINC000552200885 941600988 /nfs/dbraw/zinc/60/09/88/941600988.db2.gz UKGSMYXJNHKXOX-IBGZPJMESA-N 0 3 409.555 4.214 20 0 HIADHN O=C(Nc1ccc(Nc2ncccn2)cc1)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000552212849 941604597 /nfs/dbraw/zinc/60/45/97/941604597.db2.gz UPWZUSZKARZFKQ-HXUWFJFHSA-N 0 3 423.467 4.316 20 0 HIADHN COc1cc(NC(=O)[C@@H]2CN(Cc3ccccc3)CCC2(F)F)c(C)c(OC)c1 ZINC000552212838 941604905 /nfs/dbraw/zinc/60/49/05/941604905.db2.gz ULRIKWPVVWRVOI-SFHVURJKSA-N 0 3 404.457 4.108 20 0 HIADHN OC[C@@H](CN[C@@H](c1ncc[nH]1)C1CCCCC1)Cc1cccc(OC(F)(F)F)c1 ZINC000552246407 941613011 /nfs/dbraw/zinc/61/30/11/941613011.db2.gz SZHYFMWRQJBRTE-VQIMIIECSA-N 0 3 411.468 4.371 20 0 HIADHN COc1cc(CN[C@@H](C)c2ccc(OC)c(OC)c2C)cc(Br)c1O ZINC000552247764 941613419 /nfs/dbraw/zinc/61/34/19/941613419.db2.gz ZIDRBXNQXBDYSR-LBPRGKRZSA-N 0 3 410.308 4.340 20 0 HIADHN COc1ccc(Oc2cc(CN[C@H](C)c3ccccc3-n3ccnn3)ccn2)cc1 ZINC000552255527 941614909 /nfs/dbraw/zinc/61/49/09/941614909.db2.gz JSLWWRZMNNRPSR-QGZVFWFLSA-N 0 3 401.470 4.314 20 0 HIADHN Fc1cc(CN2CCC[C@@H](c3nc(C(F)(F)F)cs3)C2)ccc1-n1cncn1 ZINC000552304676 941628058 /nfs/dbraw/zinc/62/80/58/941628058.db2.gz XJQOVODAGDYZRV-CYBMUJFWSA-N 0 3 411.428 4.261 20 0 HIADHN Cc1nc(-c2cc([C@@H](C)NC[C@@H](N3CCOCC3)C(F)(F)F)cs2)cs1 ZINC000552338971 941638077 /nfs/dbraw/zinc/63/80/77/941638077.db2.gz UXYYGNCDKOJNJC-BDJLRTHQSA-N 0 3 405.511 4.094 20 0 HIADHN CC(C)[C@H](CNC(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F)c1cccnc1 ZINC000552341548 941638184 /nfs/dbraw/zinc/63/81/84/941638184.db2.gz MZFXLIZSJQSVCP-SFTDATJTSA-N 0 3 401.501 4.095 20 0 HIADHN O=C(N[C@H]1CCOC2(CCCCC2)C1)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000552388646 941653344 /nfs/dbraw/zinc/65/33/44/941653344.db2.gz MPOMNLLFTOXDQB-PMACEKPBSA-N 0 3 406.517 4.142 20 0 HIADHN CC(=O)c1ccccc1NC(=O)CCCN1CCC[C@H]1c1ccc2c(c1)OCCO2 ZINC000552461674 941676892 /nfs/dbraw/zinc/67/68/92/941676892.db2.gz XADRWZWUYOIPCC-NRFANRHFSA-N 0 3 408.498 4.216 20 0 HIADHN Cc1cccc(COc2cccc(C(=O)Nc3cccc(CN4CC[C@H](O)C4)c3)c2)c1 ZINC000552517962 941693597 /nfs/dbraw/zinc/69/35/97/941693597.db2.gz QWJNTYYCCDJDED-DEOSSOPVSA-N 0 3 416.521 4.393 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)c1ccc(OCc2ccncc2)cc1 ZINC000552540998 941702345 /nfs/dbraw/zinc/70/23/45/941702345.db2.gz AOWYFCQHYRWVDG-XMMPIXPASA-N 0 3 401.510 4.228 20 0 HIADHN O[C@H](CN[C@H]1CCSc2c(F)cccc21)COc1cccc(Br)c1 ZINC000552679915 941735938 /nfs/dbraw/zinc/73/59/38/941735938.db2.gz WTISINRMWRYJBE-DYVFJYSZSA-N 0 3 412.324 4.155 20 0 HIADHN O[C@@H](CN[C@H]1CCSc2c(F)cccc21)COc1cccc(Br)c1 ZINC000552679916 941736017 /nfs/dbraw/zinc/73/60/17/941736017.db2.gz WTISINRMWRYJBE-GUYCJALGSA-N 0 3 412.324 4.155 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)c2oc3ccc(CCC(C)=O)cc3c2C)cc1 ZINC000552815084 941774109 /nfs/dbraw/zinc/77/41/09/941774109.db2.gz CROKLZBIXYQRIR-JOCHJYFZSA-N 0 3 422.525 4.304 20 0 HIADHN CN(C(=O)Nc1ccc2oc(C3CC3)nc2c1)C1CCN(CCc2ccccn2)CC1 ZINC000552825745 941779662 /nfs/dbraw/zinc/77/96/62/941779662.db2.gz RNYYQNXAHPKJLL-UHFFFAOYSA-N 0 3 419.529 4.271 20 0 HIADHN COc1ccc(CN(Cc2cc(=O)c(OC)co2)[C@H]2CCCC[C@@H]2C)cc1OC ZINC000552835458 941782365 /nfs/dbraw/zinc/78/23/65/941782365.db2.gz MPPOBVBGDWKWIF-LPHOPBHVSA-N 0 3 401.503 4.247 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccc(F)c2)C1)N1C[C@H](c2ccccc2)[C@@H]2COCC[C@H]21 ZINC000553040811 941822721 /nfs/dbraw/zinc/82/27/21/941822721.db2.gz OOGLYGKMTHLDMA-MJTJJFPGSA-N 0 3 422.544 4.069 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)C[C@@H](c1ncc[nH]1)c1ccccc1 ZINC000553143239 941840024 /nfs/dbraw/zinc/84/00/24/941840024.db2.gz DFLLRTJGWWBSOH-NZQKXSOJSA-N 0 3 402.542 4.055 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)c1ccc(-c2noc(C(F)(F)F)n2)cc1 ZINC000553152597 941841036 /nfs/dbraw/zinc/84/10/36/941841036.db2.gz YOIRZHIBQHLGJM-UHFFFAOYSA-N 0 3 410.440 4.094 20 0 HIADHN O=C(CCc1ccncc1)N(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000553196325 941847341 /nfs/dbraw/zinc/84/73/41/941847341.db2.gz KAJDJUZRYUIHBB-VWLOTQADSA-N 0 3 414.553 4.103 20 0 HIADHN C[C@@H](C(=O)N(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1)C(C)(F)F ZINC000553196098 941847481 /nfs/dbraw/zinc/84/74/81/941847481.db2.gz CTAWYTMNHGWZSR-GHTZIAJQSA-N 0 3 401.501 4.366 20 0 HIADHN O=C1c2ccccc2C(=O)N1[C@H]1CCCC[C@@H](NCc2cc(-c3ccccc3)on2)C1 ZINC000553382264 941877180 /nfs/dbraw/zinc/87/71/80/941877180.db2.gz LCFBFAZNPBMIDA-QUCCMNQESA-N 0 3 415.493 4.429 20 0 HIADHN O=C1c2ccccc2C(=O)N1[C@@H]1CCCC[C@@H](NCc2cc(-c3ccccc3)on2)C1 ZINC000553382265 941877370 /nfs/dbraw/zinc/87/73/70/941877370.db2.gz LCFBFAZNPBMIDA-UYAOXDASSA-N 0 3 415.493 4.429 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N[C@@H](C)c1nccn1-c1ccccc1)c1ccsc1 ZINC000553412562 941881418 /nfs/dbraw/zinc/88/14/18/941881418.db2.gz SDMNTRMIGLMUPO-PXNSSMCTSA-N 0 3 411.575 4.377 20 0 HIADHN Cc1sc2nc(C)nc(SCC(=O)N3CCN(C4CCC4)C[C@H](C)C3)c2c1C ZINC000553526327 941903205 /nfs/dbraw/zinc/90/32/05/941903205.db2.gz SCCBTZOFZAYRAV-ZDUSSCGKSA-N 0 3 418.632 4.041 20 0 HIADHN Cc1nc2cc(C(=O)N3CCN([C@@H]4C[C@H]4C)C[C@H](C)C3)ccc2n1Cc1ccsc1 ZINC000553784140 941968580 /nfs/dbraw/zinc/96/85/80/941968580.db2.gz MVSCXXMWAYDZBZ-YGKZAACZSA-N 0 3 422.598 4.257 20 0 HIADHN OC[C@@H](NC[C@H](O)Cc1cccc(Cl)c1)c1ccc(Cl)cc1C(F)(F)F ZINC000553893604 941992102 /nfs/dbraw/zinc/99/21/02/941992102.db2.gz AGCLUQPKPRSTKD-RHSMWYFYSA-N 0 3 408.247 4.239 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)N(C)Cc1cnc(C(C)C)nc1)c1ccc(Cl)cc1 ZINC000553897043 941993752 /nfs/dbraw/zinc/99/37/52/941993752.db2.gz WULZEPZHPHKSLJ-FQEVSTJZSA-N 0 3 417.985 4.478 20 0 HIADHN CCN(C)C(=O)c1cccc(C(=O)NC[C@H](c2ccc(CC(C)C)cc2)N(C)C)c1 ZINC000554079613 942031615 /nfs/dbraw/zinc/03/16/15/942031615.db2.gz WXIPCZSKFVPBJK-HSZRJFAPSA-N 0 3 409.574 4.010 20 0 HIADHN C[C@H](N[C@@H]1CCN(c2ccc(Cl)cc2Cl)C1=O)c1cccc(-n2ccnn2)c1 ZINC000554090279 942034494 /nfs/dbraw/zinc/03/44/94/942034494.db2.gz PLMQHZBLMWFMIC-SCLBCKFNSA-N 0 3 416.312 4.030 20 0 HIADHN COc1cc([C@@H](C)N[C@H](C)c2cccc(NS(C)(=O)=O)c2)ccc1OC(C)C ZINC000554209463 942068467 /nfs/dbraw/zinc/06/84/67/942068467.db2.gz HKQRMKOKOZCLHK-HZPDHXFCSA-N 0 3 406.548 4.266 20 0 HIADHN C[C@@H](NCc1ccc(N2CCc3ccccc3C2)nc1)c1cccc(-n2ccnn2)c1 ZINC000554348405 942109778 /nfs/dbraw/zinc/10/97/78/942109778.db2.gz AYAHRWQCNUAELK-LJQANCHMSA-N 0 3 410.525 4.076 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)Nc1cccc(C(=O)N2CCCCC2)c1)c1ccco1 ZINC000554418576 942134755 /nfs/dbraw/zinc/13/47/55/942134755.db2.gz BQMHXLBGWHHTGC-YLJYHZDGSA-N 0 3 412.534 4.157 20 0 HIADHN CCCNC(=O)c1ccc(NC(=O)N[C@@H](CN(C)C)c2ccc(F)cc2)cc1Cl ZINC000554435259 942142023 /nfs/dbraw/zinc/14/20/23/942142023.db2.gz OFMRZTOHERMZOC-IBGZPJMESA-N 0 3 420.916 4.043 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1ccc(Br)c(OC)c1)c1ccco1 ZINC000554454800 942150000 /nfs/dbraw/zinc/15/00/00/942150000.db2.gz SZFOSMWDJAJAOU-SWLSCSKDSA-N 0 3 410.312 4.302 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1ccc(OC2CCOCC2)c(C)c1)c1ccco1 ZINC000554464469 942152511 /nfs/dbraw/zinc/15/25/11/942152511.db2.gz JWMSGYZICPPUQW-FXAWDEMLSA-N 0 3 415.534 4.397 20 0 HIADHN COC[C@H](NC(=O)N[C@H]1CCN([C@H](C)c2ccccc2)C1)c1cccc(Cl)c1 ZINC000554692643 942201254 /nfs/dbraw/zinc/20/12/54/942201254.db2.gz ZLCDWHWXMGGXDH-CZAAIQMYSA-N 0 3 401.938 4.162 20 0 HIADHN C[C@@H](NCC(=O)Nc1cccc(C(=O)NC2CC2)c1)c1ccc(F)c2ccccc21 ZINC000554742243 942217361 /nfs/dbraw/zinc/21/73/61/942217361.db2.gz CCUNCTNGSIWUOC-OAHLLOKOSA-N 0 3 405.473 4.160 20 0 HIADHN COCCN1CC[C@H](NC(=O)Nc2ccc(Oc3ccccc3)cc2C(F)(F)F)C1 ZINC000554785222 942235471 /nfs/dbraw/zinc/23/54/71/942235471.db2.gz JHRMPYSZKZSVES-HNNXBMFYSA-N 0 3 423.435 4.340 20 0 HIADHN COC(=O)c1cc(CN[C@H]2c3cc(Br)ccc3SC[C@@H]2C)cn1C ZINC000554855273 942290898 /nfs/dbraw/zinc/29/08/98/942290898.db2.gz OIRAULHRCIFECZ-APPDUMDISA-N 0 3 409.349 4.147 20 0 HIADHN CN(C)C[C@H](NC(=O)Nc1cccc(OC[C@H]2CCCO2)c1)c1ccc(Cl)cc1 ZINC000554871294 942301856 /nfs/dbraw/zinc/30/18/56/942301856.db2.gz RIPDLLZTVDZXOM-RTWAWAEBSA-N 0 3 417.937 4.322 20 0 HIADHN CC(C)CCOc1ccc(CN2CCC[C@@H](CNC(=O)CC(F)(F)F)C2)cc1 ZINC000554871887 942302364 /nfs/dbraw/zinc/30/23/64/942302364.db2.gz NVTGFOAGEOHMDT-SFHVURJKSA-N 0 3 400.485 4.392 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1ncc(C(F)(F)F)s1)c1cccc(OC)c1 ZINC000554942571 942326995 /nfs/dbraw/zinc/32/69/95/942326995.db2.gz ISZAGHDDPHFLBO-CQSZACIVSA-N 0 3 416.469 4.375 20 0 HIADHN CCOc1cc(CNCc2ccc3sccc3c2)ccc1O[C@H](C)C(=O)N(C)C ZINC000554965671 942336386 /nfs/dbraw/zinc/33/63/86/942336386.db2.gz LZCAEDWTZCVUNQ-MRXNPFEDSA-N 0 3 412.555 4.445 20 0 HIADHN COc1ccc([C@H](Cc2ccccc2)NCc2ccc(CS(C)(=O)=O)cc2)cc1 ZINC000554997557 942349030 /nfs/dbraw/zinc/34/90/30/942349030.db2.gz NCDQWYOXFJOFMY-DEOSSOPVSA-N 0 3 409.551 4.313 20 0 HIADHN CC(C)N1CC[C@H](NCc2cn(C)nc2C(F)F)[C@H]1c1ccc(Cl)c(F)c1 ZINC000555004677 942351746 /nfs/dbraw/zinc/35/17/46/942351746.db2.gz QKFZVILWVMQCEG-FUHWJXTLSA-N 0 3 400.876 4.464 20 0 HIADHN COc1ccccc1CN(C)C(=O)CN[C@@H](c1cccc(C(F)(F)F)c1)C1CC1 ZINC000555076863 942378502 /nfs/dbraw/zinc/37/85/02/942378502.db2.gz OKBRURGMAOJFOK-OAQYLSRUSA-N 0 3 406.448 4.413 20 0 HIADHN COc1cccc([C@@H]2[C@H](NCc3ccc(Oc4ccccc4)nn3)CCN2C2CC2)c1 ZINC000555128656 942394866 /nfs/dbraw/zinc/39/48/66/942394866.db2.gz KGKHFVXKGCYYCN-ILBGXUMGSA-N 0 3 416.525 4.345 20 0 HIADHN CCc1ccc(NC(=O)CN[C@@H]2CCN(CC)[C@@H]2c2cc(F)c(F)c(F)c2)cc1 ZINC000555132212 942396420 /nfs/dbraw/zinc/39/64/20/942396420.db2.gz TWTLSMYQXLTBGB-DENIHFKCSA-N 0 3 405.464 4.030 20 0 HIADHN CCN1CC[C@H](NCC(=O)Nc2cc(C)ccc2C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000555132449 942396707 /nfs/dbraw/zinc/39/67/07/942396707.db2.gz ISPKUBRYHFPAJD-SIKLNZKXSA-N 0 3 403.929 4.460 20 0 HIADHN CCN1CC[C@H](N[C@H](C)C(=O)Nc2c(C)cccc2C)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000555133013 942397500 /nfs/dbraw/zinc/39/75/00/942397500.db2.gz YAPZXXHDDJXXED-QOEFQVSFSA-N 0 3 419.491 4.473 20 0 HIADHN Cc1ncsc1CN(C)C[C@@H]1CCN(c2noc3ccc(Br)cc32)C1 ZINC000555159452 942410641 /nfs/dbraw/zinc/41/06/41/942410641.db2.gz PPQVKUQNYPYLRF-ZDUSSCGKSA-N 0 3 421.364 4.314 20 0 HIADHN Cc1cc(C)c(C(=O)N(Cc2ccccc2Br)C2CCN(C)CC2)o1 ZINC000555161549 942411252 /nfs/dbraw/zinc/41/12/52/942411252.db2.gz MJTYUABIMLTPBI-UHFFFAOYSA-N 0 3 405.336 4.396 20 0 HIADHN Cc1cccc(C)c1CS(=O)(=O)N(C)[C@H]1CCN(Cc2ccccc2)[C@H](C)C1 ZINC000555317088 942474442 /nfs/dbraw/zinc/47/44/42/942474442.db2.gz MXLQRSWPOFVWSR-IRLDBZIGSA-N 0 3 400.588 4.118 20 0 HIADHN CC(C)C1CCC(N2CCN([C@@H]3CCN([C@H](C)c4ccc(F)cc4)C3=O)CC2)CC1 ZINC000555379622 942504281 /nfs/dbraw/zinc/50/42/81/942504281.db2.gz BEHCLAIHUFWORZ-MHWOCTGESA-N 0 3 415.597 4.320 20 0 HIADHN CCN(C)c1ccc(CNC2(c3cccc(Br)c3)CCOCC2)cn1 ZINC000555392225 942511434 /nfs/dbraw/zinc/51/14/34/942511434.db2.gz BPAWBUKUNQRTIR-UHFFFAOYSA-N 0 3 404.352 4.096 20 0 HIADHN O=S(=O)(CCCNCc1csc(Br)c1)c1ccc(Cl)cc1 ZINC000555643792 942685314 /nfs/dbraw/zinc/68/53/14/942685314.db2.gz FFJUOYQHHODJIM-UHFFFAOYSA-N 0 3 408.770 4.118 20 0 HIADHN C[C@@H](NC1(Cc2ccc(F)cc2Cl)CCOCC1)C(=O)c1c[nH]c2ncccc12 ZINC000555696599 942703498 /nfs/dbraw/zinc/70/34/98/942703498.db2.gz IFXNPJWBRHWLBK-CQSZACIVSA-N 0 3 415.896 4.308 20 0 HIADHN C[C@H](N[C@@H]1CCCN([C@@H](C)c2ccc(F)cc2)C1=O)c1ccc(-n2ccnc2)cc1 ZINC000556241192 942825247 /nfs/dbraw/zinc/82/52/47/942825247.db2.gz QVGOZMAHYQEPQR-IUKKYPGJSA-N 0 3 406.505 4.414 20 0 HIADHN COCCCn1nccc1CN[C@H](c1cccc(C(F)(F)F)c1)C1CCOCC1 ZINC000556429403 942864711 /nfs/dbraw/zinc/86/47/11/942864711.db2.gz DVBGSPKVLGPHAY-FQEVSTJZSA-N 0 3 411.468 4.196 20 0 HIADHN CC(C)[C@H](CCc1ccccc1)C(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000556431954 942865193 /nfs/dbraw/zinc/86/51/93/942865193.db2.gz GZSUITYRJUJWBT-VWLOTQADSA-N 0 3 408.586 4.165 20 0 HIADHN CCC[C@H](NCC(=O)NCc1c(C)nn(Cc2ccccc2)c1C)c1ccccc1 ZINC000556498464 942885790 /nfs/dbraw/zinc/88/57/90/942885790.db2.gz BPZWEPPOXKHQFN-DEOSSOPVSA-N 0 3 404.558 4.295 20 0 HIADHN Cc1cc(-c2noc([C@H](C)NC[C@H]3CN(Cc4ccccc4)CCCO3)n2)ccc1F ZINC000556503015 942886566 /nfs/dbraw/zinc/88/65/66/942886566.db2.gz YUTSZASVVJJUKU-RXVVDRJESA-N 0 3 424.520 4.126 20 0 HIADHN C[C@@H]1CCCC[C@H]1NC(=O)CN[C@@H](c1cccc(C(F)(F)F)c1)C1CCOCC1 ZINC000556515429 942889546 /nfs/dbraw/zinc/88/95/46/942889546.db2.gz VJSPCWRWDURWQU-QFIXIFRTSA-N 0 3 412.496 4.458 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@@H](C)N[C@@H](C)c2cnc(OC)c(Cl)c2)CC1 ZINC000556582651 942905939 /nfs/dbraw/zinc/90/59/39/942905939.db2.gz CDAVZKPUMBMOSM-JKSUJKDBSA-N 0 3 420.960 4.436 20 0 HIADHN O=C(c1ccc(OCc2ccccc2)nc1)N1CCN(c2ccnc3ccccc32)CC1 ZINC000556833212 942937550 /nfs/dbraw/zinc/93/75/50/942937550.db2.gz XVFPFJRIHDTHEL-UHFFFAOYSA-N 0 3 424.504 4.171 20 0 HIADHN CO[C@@H]1C[C@H](c2ccccc2)CC[C@H]1NCC(=O)Nc1nc(-c2ccco2)cs1 ZINC000556875384 942947898 /nfs/dbraw/zinc/94/78/98/942947898.db2.gz AKBOKXCJTULEOO-MBOZVWFJSA-N 0 3 411.527 4.283 20 0 HIADHN CO[C@@H]1C[C@@H](c2ccccc2)CC[C@@H]1NCC(=O)N(C)c1nc2ccccc2s1 ZINC000556881467 942948614 /nfs/dbraw/zinc/94/86/14/942948614.db2.gz SOBHVRPKMGZHJI-CMKODMSKSA-N 0 3 409.555 4.200 20 0 HIADHN CN(C)CCN(C)C(=O)C(C)(C)c1csc(-c2c(Cl)cccc2Cl)n1 ZINC000556895745 942955486 /nfs/dbraw/zinc/95/54/86/942955486.db2.gz NVZRUBOIYISNEJ-UHFFFAOYSA-N 0 3 400.375 4.415 20 0 HIADHN Brc1ccc(-c2ccc(CN3CCC(O[C@@H]4CCOC4)CC3)o2)cc1 ZINC000556904135 942960151 /nfs/dbraw/zinc/96/01/51/942960151.db2.gz JYELSKXMYRGUDZ-LJQANCHMSA-N 0 3 406.320 4.479 20 0 HIADHN c1csc(-c2nn(-c3ccccc3)cc2CN2CCC(O[C@@H]3CCOC3)CC2)c1 ZINC000556906439 942960201 /nfs/dbraw/zinc/96/02/01/942960201.db2.gz XBKDECIWQGDOPE-OAQYLSRUSA-N 0 3 409.555 4.371 20 0 HIADHN COc1cc(Br)c(CNC2(Cc3ccc(F)cc3)CCOCC2)cc1O ZINC000556908263 942961004 /nfs/dbraw/zinc/96/10/04/942961004.db2.gz DULVIDDMTFKOHP-UHFFFAOYSA-N 0 3 424.310 4.184 20 0 HIADHN CNC(=O)COc1cccc(CN[C@@H](Cc2cccc(F)c2)c2cccc(F)c2)c1 ZINC000556912283 942963303 /nfs/dbraw/zinc/96/33/03/942963303.db2.gz PYBBSPVHRCPPBC-QHCPKHFHSA-N 0 3 410.464 4.163 20 0 HIADHN CC(C)c1cc(C(=O)N(C)CCCN(C)Cc2ccncc2)c2cnn(C(C)C)c2n1 ZINC000556934653 942972442 /nfs/dbraw/zinc/97/24/42/942972442.db2.gz ZLXMJINHLXCARF-UHFFFAOYSA-N 0 3 422.577 4.125 20 0 HIADHN CN(CCCN(C)C(=O)c1cccc(OCc2cccs2)c1)Cc1ccncc1 ZINC000556933738 942972726 /nfs/dbraw/zinc/97/27/26/942972726.db2.gz LHLDAKDQABBTHK-UHFFFAOYSA-N 0 3 409.555 4.316 20 0 HIADHN CC(C)(C)c1nc(CCNC(=O)[C@H]2CN(Cc3ccccc3)CCC2(F)F)cs1 ZINC000556946163 942976909 /nfs/dbraw/zinc/97/69/09/942976909.db2.gz ODBJFIBZTAVRKH-GOSISDBHSA-N 0 3 421.557 4.257 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)[C@@H](C)Cc2cnc3ccccc3n2)N(C)C)cc1 ZINC000556989404 942988500 /nfs/dbraw/zinc/98/85/00/942988500.db2.gz CRBAYRKIYFIARZ-MHECFPHRSA-N 0 3 420.557 4.015 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)c1ccccc1OCc1ccc(F)cc1 ZINC000557022162 942996444 /nfs/dbraw/zinc/99/64/44/942996444.db2.gz DSOWDBLHPMPSIC-QFIPXVFZSA-N 0 3 420.484 4.224 20 0 HIADHN CCCOc1ccc(C(=O)Nc2cccc(CN3CC[C@@H](O)C3)c2)cc1OCCC ZINC000557023108 942996606 /nfs/dbraw/zinc/99/66/06/942996606.db2.gz GINGLTZEEYXTHB-OAQYLSRUSA-N 0 3 412.530 4.083 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@@H](O)C2)c1)c1cc2c(s1)-c1ccccc1CC2 ZINC000557024539 942997595 /nfs/dbraw/zinc/99/75/95/942997595.db2.gz YYYBBLWCGUBIRJ-HXUWFJFHSA-N 0 3 404.535 4.333 20 0 HIADHN O=c1ccccn1Cc1ccc(CN[C@H]2CCCOc3cc4c(cc32)CCC4)cc1 ZINC000557256313 943061948 /nfs/dbraw/zinc/06/19/48/943061948.db2.gz YBHVBKCQUHQFGZ-DEOSSOPVSA-N 0 3 400.522 4.389 20 0 HIADHN COc1cc([C@@H](C)NCCOc2ccccc2C(C)(C)C)ccc1S(C)(=O)=O ZINC000557262887 943063331 /nfs/dbraw/zinc/06/33/31/943063331.db2.gz QASWLLSHEWAWHN-MRXNPFEDSA-N 0 3 405.560 4.126 20 0 HIADHN Cc1ccc(CC2CCN(C(=O)[C@H]3CCCN(Cc4cccnc4)C3)CC2)cc1C ZINC000557293824 943067378 /nfs/dbraw/zinc/06/73/78/943067378.db2.gz GLDNZFDCOLOGNC-VWLOTQADSA-N 0 3 405.586 4.392 20 0 HIADHN O[C@H](CN[C@H]1CCSc2c(F)cccc21)COc1ccc(Br)cc1 ZINC000557340009 943078063 /nfs/dbraw/zinc/07/80/63/943078063.db2.gz BADFHMBONINTHL-DYVFJYSZSA-N 0 3 412.324 4.155 20 0 HIADHN Cc1ccn(C)c1C(=O)N(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000557449439 943133953 /nfs/dbraw/zinc/13/39/53/943133953.db2.gz RYYJLZVEMBDRAF-HSZRJFAPSA-N 0 3 402.542 4.036 20 0 HIADHN COCCC[C@H](C)C(=O)N(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000557449269 943134040 /nfs/dbraw/zinc/13/40/40/943134040.db2.gz SKKHIWVBFFMLHB-XUZZJYLKSA-N 0 3 409.574 4.138 20 0 HIADHN NS(=O)(=O)c1ccc2c(c1)[C@@H](N[C@H](c1ccc(F)cc1)C1CCCC1)CCC2 ZINC000557531386 943193827 /nfs/dbraw/zinc/19/38/27/943193827.db2.gz XKZWSTOOFUTZJV-VXKWHMMOSA-N 0 3 402.535 4.372 20 0 HIADHN CC[C@@H](C)[C@@H](NCC(=O)Nc1cccc(C(=O)N(C)C)c1)c1ccc(Cl)cc1 ZINC000557543923 943201604 /nfs/dbraw/zinc/20/16/04/943201604.db2.gz XHHJWOBZWCCAON-QVKFZJNVSA-N 0 3 401.938 4.357 20 0 HIADHN CC[C@@H](C)N[C@H](CNc1cc(C(F)(F)F)nc(-c2ccncc2)n1)c1ccco1 ZINC000557695095 943261087 /nfs/dbraw/zinc/26/10/87/943261087.db2.gz SUMKJDYAJPJRGI-UKRRQHHQSA-N 0 3 405.424 4.114 20 0 HIADHN Cc1nn(Cc2ccc(Cl)cc2)c(C)c1C(=O)N1CCN([C@@H]2C[C@@H]2C)C[C@H](C)C1 ZINC000558013139 943355077 /nfs/dbraw/zinc/35/50/77/943355077.db2.gz SVHZBRMSDHVOJA-CKJXQJPGSA-N 0 3 414.981 4.004 20 0 HIADHN C[C@@H]1C[C@H]1N1CCN(C(=O)c2ncoc2-c2cccc(C(F)(F)F)c2)C[C@@H](C)C1 ZINC000558021422 943357951 /nfs/dbraw/zinc/35/79/51/943357951.db2.gz CYVUAIVXAORTIF-JJRVBVJISA-N 0 3 407.436 4.163 20 0 HIADHN C[C@@H]1C[C@@H]1N1CCN(C(=O)c2cc(C(F)(F)F)ccc2Br)C[C@@H](C)C1 ZINC000558026744 943359322 /nfs/dbraw/zinc/35/93/22/943359322.db2.gz YEWFUTZATWNHHX-OZVIIMIRSA-N 0 3 419.285 4.270 20 0 HIADHN Cc1onc(-c2c(F)cccc2Cl)c1C(=O)N1CCN([C@@H]2C[C@@H]2C)C[C@H](C)C1 ZINC000558026645 943359704 /nfs/dbraw/zinc/35/97/04/943359704.db2.gz XRNKDNOYJCPDDH-GDZNZVCISA-N 0 3 405.901 4.245 20 0 HIADHN COc1cc(C(=O)N2CCN([C@@H]3C[C@@H]3C)C[C@H](C)C2)cc(Cl)c1OCC(C)C ZINC000558026435 943359978 /nfs/dbraw/zinc/35/99/78/943359978.db2.gz RCJGQEUFTDNMES-TXPKVOOTSA-N 0 3 408.970 4.186 20 0 HIADHN O=C(NCc1nc2cc(Br)ccc2o1)c1cccc(CN2CCCC2)c1 ZINC000558056926 943368534 /nfs/dbraw/zinc/36/85/34/943368534.db2.gz LWQKBJONVKSERE-UHFFFAOYSA-N 0 3 414.303 4.116 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)N1CCC[C@@H](c2nc(C)no2)C1)c1ccc(Cl)cc1 ZINC000558107353 943381189 /nfs/dbraw/zinc/38/11/89/943381189.db2.gz LOIILMCRRWHFAQ-MJGOQNOKSA-N 0 3 419.957 4.004 20 0 HIADHN CCCN1CCN(c2ccccc2CN[C@@H](C)c2nccn2-c2ccccc2)CC1 ZINC000558119792 943385623 /nfs/dbraw/zinc/38/56/23/943385623.db2.gz NSFGGILAKDVPMV-NRFANRHFSA-N 0 3 403.574 4.255 20 0 HIADHN Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)N[C@@H](Cc1ccc(F)cc1)C(N)=O ZINC000558122685 943386568 /nfs/dbraw/zinc/38/65/68/943386568.db2.gz QTDUVBQWAGYZBD-SGTLLEGYSA-N 0 3 401.482 4.144 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)Nc1ccc(C(=O)NC2CCCC2)cc1 ZINC000558192851 943425240 /nfs/dbraw/zinc/42/52/40/943425240.db2.gz PFIABVIPQROHSW-GOSISDBHSA-N 0 3 408.546 4.001 20 0 HIADHN CCSc1ccc([C@@H](C)N[C@@H]2CCN(Cc3ccc(OC)cc3OC)C2=O)cc1 ZINC000558231878 943448701 /nfs/dbraw/zinc/44/87/01/943448701.db2.gz OTRTWLNCTHCTPS-IIBYNOLFSA-N 0 3 414.571 4.268 20 0 HIADHN Cc1cccc(C(=O)N2CCCC2)c1NC(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C ZINC000558268263 943469397 /nfs/dbraw/zinc/46/93/97/943469397.db2.gz ROSXZUBNTYSBTH-PGRDOPGGSA-N 0 3 408.546 4.044 20 0 HIADHN CCOc1cc(NC(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)ccc1OC ZINC000558289626 943485412 /nfs/dbraw/zinc/48/54/12/943485412.db2.gz OOBLORHJTNUBEQ-HXUWFJFHSA-N 0 3 415.534 4.306 20 0 HIADHN C[C@@H](NC(=O)Nc1ccc(-c2noc(C(F)F)n2)cc1)[C@@H](c1ccccc1)N(C)C ZINC000558352062 943521338 /nfs/dbraw/zinc/52/13/38/943521338.db2.gz LDCFBVGASCRNNZ-DYVFJYSZSA-N 0 3 415.444 4.487 20 0 HIADHN CN(C)C[C@@H](NC(=O)Nc1ccccc1CC(=O)OC(C)(C)C)c1ccc(F)cc1 ZINC000558378518 943534858 /nfs/dbraw/zinc/53/48/58/943534858.db2.gz BFTNZJFNUQVBOP-HXUWFJFHSA-N 0 3 415.509 4.134 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)CNC(C)(C)c2ccc(Br)c(C)c2)cc1 ZINC000558475494 943569085 /nfs/dbraw/zinc/56/90/85/943569085.db2.gz KHQIXFWVACIXNZ-UHFFFAOYSA-N 0 3 418.335 4.179 20 0 HIADHN NC(=O)C1CCN(Cc2cccc(NC(=O)c3cscc3-c3ccccc3)c2)CC1 ZINC000558481970 943570956 /nfs/dbraw/zinc/57/09/56/943570956.db2.gz GIRWZXIUADJQMM-UHFFFAOYSA-N 0 3 419.550 4.365 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(F)cc2)CC1)[C@H]1C[C@H]1c1ccccc1Cl ZINC000558503901 943578285 /nfs/dbraw/zinc/57/82/85/943578285.db2.gz HAYGUPXPUSRKRH-SFTDATJTSA-N 0 3 416.924 4.242 20 0 HIADHN O=C1NC2(CCCC2)C(=O)N1c1cccc(CN[C@@H](c2ccc(F)cc2)C2CC2)c1 ZINC000558507774 943580068 /nfs/dbraw/zinc/58/00/68/943580068.db2.gz PSDZDQUZSJYHNS-OAQYLSRUSA-N 0 3 407.489 4.436 20 0 HIADHN COCCCN(C(=O)c1cccc2cccc(Br)c21)C1CCN(C)CC1 ZINC000558612993 943617350 /nfs/dbraw/zinc/61/73/50/943617350.db2.gz PUQKXQLSWACREV-UHFFFAOYSA-N 0 3 419.363 4.175 20 0 HIADHN O[C@H](CNC[C@H](c1ccc(Cl)cc1)N1CCc2sccc2C1)C(F)(F)F ZINC000558628625 943621075 /nfs/dbraw/zinc/62/10/75/943621075.db2.gz NMRYLTPQMFEESW-NVXWUHKLSA-N 0 3 404.885 4.014 20 0 HIADHN CCC(CC)[C@H](NC(=O)N1CC[C@@H](N2CCN(C(C)C)CC2)C1)c1cccs1 ZINC000558694534 943629982 /nfs/dbraw/zinc/62/99/82/943629982.db2.gz FBZOHRXJKCGNRE-CTNGQTDRSA-N 0 3 406.640 4.035 20 0 HIADHN CCN(CC)C(=O)c1ccc(NC(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)cc1 ZINC000558755768 943646723 /nfs/dbraw/zinc/64/67/23/943646723.db2.gz RXIQLJYXZZDLIQ-FQEVSTJZSA-N 0 3 416.953 4.246 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N1CC[C@@](F)(c2ccccc2F)C1 ZINC000558884301 943718279 /nfs/dbraw/zinc/71/82/79/943718279.db2.gz AXBMIFFNDNSHQX-NQIIRXRSSA-N 0 3 405.514 4.304 20 0 HIADHN CCN1CC[C@H](NCC(=O)N[C@@H](C)c2ccccc2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000558891550 943724492 /nfs/dbraw/zinc/72/44/92/943724492.db2.gz HFVYZTXXCUPGDE-LVWPNOBMSA-N 0 3 403.929 4.081 20 0 HIADHN CCN1CC[C@H](N[C@H](C)C(=O)Nc2ccnn2C(C)C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000558896592 943730818 /nfs/dbraw/zinc/73/08/18/943730818.db2.gz QFTIZAKYOHJBFK-HEFCMCLBSA-N 0 3 421.948 4.009 20 0 HIADHN CC(C)(C)N1CC[C@@H](NCC(=O)NCc2cccs2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000558901335 943736504 /nfs/dbraw/zinc/73/65/04/943736504.db2.gz JDXKSNUBAKDKFE-UYAOXDASSA-N 0 3 423.985 4.361 20 0 HIADHN CCN1CC[C@H](NCC(=O)Nc2c(C)cc(C)cc2C)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000558902497 943736575 /nfs/dbraw/zinc/73/65/75/943736575.db2.gz ZGUHHVOJWXFEOO-CVDCTZTESA-N 0 3 419.491 4.393 20 0 HIADHN CSc1cccc(NC(=O)CN[C@@H]2CCN(C(C)C)[C@@H]2c2ccc(F)c(F)c2)c1 ZINC000558902637 943737512 /nfs/dbraw/zinc/73/75/12/943737512.db2.gz SRJXEXPKYYGJFP-IFMALSPDSA-N 0 3 419.541 4.439 20 0 HIADHN Cc1c(C(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)cnn1-c1ccccc1F ZINC000558972440 943777050 /nfs/dbraw/zinc/77/70/50/943777050.db2.gz QPRWHQXCSKTUEJ-IBGZPJMESA-N 0 3 400.885 4.006 20 0 HIADHN CC(=O)CCc1ccc(O[C@H](C)C(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)cc1 ZINC000558973575 943777074 /nfs/dbraw/zinc/77/70/74/943777074.db2.gz QRFDZUSJFPHTDX-VGOFRKELSA-N 0 3 416.949 4.048 20 0 HIADHN Cc1c(C(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)cnn1-c1ccccc1F ZINC000558972447 943777273 /nfs/dbraw/zinc/77/72/73/943777273.db2.gz QPRWHQXCSKTUEJ-LJQANCHMSA-N 0 3 400.885 4.006 20 0 HIADHN COCCO[C@H]1CCCN(Cc2cn(Cc3ccccc3)nc2-c2ccccc2)C1 ZINC000559073062 943825770 /nfs/dbraw/zinc/82/57/70/943825770.db2.gz VUBXZCFIWJNDFY-DEOSSOPVSA-N 0 3 405.542 4.226 20 0 HIADHN CC[C@@H](c1nnc(N2CCN(C3CCCC3)CC2)n1C[C@@H]1CCCO1)c1ccccc1 ZINC000559137635 943851792 /nfs/dbraw/zinc/85/17/92/943851792.db2.gz KUDMOOIILJDLQY-XZOQPEGZSA-N 0 3 423.605 4.064 20 0 HIADHN O=c1c2ccccc2nc(S[C@H]2CCN(Cc3ccccc3)C2)n1Cc1ccco1 ZINC000559194857 943868890 /nfs/dbraw/zinc/86/88/90/943868890.db2.gz NFRGEUDMJZKESC-FQEVSTJZSA-N 0 3 417.534 4.404 20 0 HIADHN COCCN(C)CCNC(=O)c1oc2ccccc2c1CSc1ccc(F)cc1 ZINC000559266716 943887910 /nfs/dbraw/zinc/88/79/10/943887910.db2.gz BAFYZRDGOVVCIB-UHFFFAOYSA-N 0 3 416.518 4.172 20 0 HIADHN CC1CCN(S(=O)(=O)Cc2ccccc2CN[C@@H]2CCCc3ccccc32)CC1 ZINC000559304455 943893877 /nfs/dbraw/zinc/89/38/77/943893877.db2.gz HPHMAPXHMDFIDO-XMMPIXPASA-N 0 3 412.599 4.416 20 0 HIADHN COc1cc(CN[C@@H]2CCC[C@@H]2F)ccc1OCC(=O)Nc1ccc(F)c(Cl)c1 ZINC000559358177 943907268 /nfs/dbraw/zinc/90/72/68/943907268.db2.gz HGWCICAFIKEQAR-ZWKOTPCHSA-N 0 3 424.875 4.485 20 0 HIADHN CCS(=O)(=O)c1ccc([C@H](C)N[C@H](C)c2ccc(NC(=O)NC(C)C)cc2)cc1 ZINC000559421235 943943795 /nfs/dbraw/zinc/94/37/95/943943795.db2.gz WCAVBSQXZYSVIY-SJORKVTESA-N 0 3 417.575 4.422 20 0 HIADHN CN1CC[C@@H](NCC(=O)Nc2c(Cl)cccc2Cl)[C@H]1c1ccc(F)c(F)c1 ZINC000559793020 944051600 /nfs/dbraw/zinc/05/16/00/944051600.db2.gz JDEMHABCQQYMDG-VQIMIIECSA-N 0 3 414.283 4.245 20 0 HIADHN COCC1(CCN[C@@H](c2ccc(F)cc2)c2cccc(S(C)(=O)=O)c2)CCC1 ZINC000559879901 944072566 /nfs/dbraw/zinc/07/25/66/944072566.db2.gz XDGWUXIDTBZLOV-NRFANRHFSA-N 0 3 405.535 4.115 20 0 HIADHN COCC1(CCN[C@H](c2ccc(F)cc2)c2cccc(S(C)(=O)=O)c2)CCC1 ZINC000559879902 944072707 /nfs/dbraw/zinc/07/27/07/944072707.db2.gz XDGWUXIDTBZLOV-OAQYLSRUSA-N 0 3 405.535 4.115 20 0 HIADHN C[C@H](c1ccc(F)cc1)N1CCC[C@@H](N[C@@H](C)c2ccc3c(c2)C(C)(C)C(=O)N3)C1=O ZINC000559897865 944079133 /nfs/dbraw/zinc/07/91/33/944079133.db2.gz SNASPPGDZPWJPX-WJONJSRFSA-N 0 3 423.532 4.458 20 0 HIADHN CCO[C@@H]1C[C@H](N[C@H](C)c2ccc(OC[C@@H]3CCCCO3)c(F)c2)[C@@H]1n1cccn1 ZINC000559924020 944087040 /nfs/dbraw/zinc/08/70/40/944087040.db2.gz DSWBPAQPAKTGBM-AZBWNHGDSA-N 0 3 417.525 4.039 20 0 HIADHN CN(C(=O)c1ccc(NCc2cnc(C(C)(C)C)s2)cc1)[C@H]1CCCN(C)C1 ZINC000559996666 944118483 /nfs/dbraw/zinc/11/84/83/944118483.db2.gz OESDXXHGENXAPH-SFHVURJKSA-N 0 3 400.592 4.219 20 0 HIADHN COc1ccc(C[C@@H](C)CN(C)CC(=O)N2CCC(OCc3ccccc3)CC2)cc1 ZINC000560110451 944162780 /nfs/dbraw/zinc/16/27/80/944162780.db2.gz IWFMAUQAVOAQCA-OAQYLSRUSA-N 0 3 424.585 4.013 20 0 HIADHN CN(C)Cc1ccccc1NC(=O)c1ccc(I)cc1Cl ZINC000560136439 944173840 /nfs/dbraw/zinc/17/38/40/944173840.db2.gz GMOBHDUVKZQLHM-UHFFFAOYSA-N 0 3 414.674 4.259 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)c2ccc(Br)cc2Cl)cc1 ZINC000560246599 944205637 /nfs/dbraw/zinc/20/56/37/944205637.db2.gz FSBCHAAWHNPSTF-QGZVFWFLSA-N 0 3 411.727 4.144 20 0 HIADHN C[C@H](N[C@H](c1cncc(Br)c1)C1CC1)c1cccc(NS(C)(=O)=O)c1 ZINC000560267069 944213360 /nfs/dbraw/zinc/21/33/60/944213360.db2.gz UVHPPCGGLILITP-SGTLLEGYSA-N 0 3 424.364 4.018 20 0 HIADHN C[C@H](N[C@H](c1cncc(Br)c1)C1CC1)c1cccc(N2CCOCC2)c1 ZINC000560269710 944214063 /nfs/dbraw/zinc/21/40/63/944214063.db2.gz XNSMAVXUWQTSEP-BTYIYWSLSA-N 0 3 416.363 4.483 20 0 HIADHN CCc1ccccc1NC(=O)C[C@@H](C)N[C@@H](C)c1ccc(S(=O)(=O)CC)cc1 ZINC000560270336 944214874 /nfs/dbraw/zinc/21/48/74/944214874.db2.gz METTZPIKTSSHPL-SJORKVTESA-N 0 3 402.560 4.111 20 0 HIADHN Cc1ccc([C@@H](NCc2cccc(N3C(=O)N[C@](C)(C4CC4)C3=O)c2)C2CC2)cc1 ZINC000560270916 944215037 /nfs/dbraw/zinc/21/50/37/944215037.db2.gz UPHMSFGEDXMMAY-RCZVLFRGSA-N 0 3 403.526 4.461 20 0 HIADHN Cc1ccc(-c2nc(C(=O)N3CCN(c4ccnc5ccccc54)CC3)cs2)o1 ZINC000560489313 944237422 /nfs/dbraw/zinc/23/74/22/944237422.db2.gz KMAHLPPMXVPTES-UHFFFAOYSA-N 0 3 404.495 4.222 20 0 HIADHN COc1ncc(CN[C@@]2(Cc3ccc(C(F)(F)F)cc3)CCOC2)cc1Cl ZINC000560508956 944238918 /nfs/dbraw/zinc/23/89/18/944238918.db2.gz LPSDXBCMYFXCCL-GOSISDBHSA-N 0 3 400.828 4.254 20 0 HIADHN CCOc1c(Br)cc(CN(CCO)[C@H]2CCc3ccccc32)cc1OC ZINC000560523984 944241480 /nfs/dbraw/zinc/24/14/80/944241480.db2.gz KYVOGXTYXYXBND-IBGZPJMESA-N 0 3 420.347 4.338 20 0 HIADHN Brc1ccc(-c2ncc(CN3CCC(O[C@@H]4CCOC4)CC3)s2)cc1 ZINC000560564493 944256033 /nfs/dbraw/zinc/25/60/33/944256033.db2.gz WAJXXPNPAGEOPN-QGZVFWFLSA-N 0 3 423.376 4.343 20 0 HIADHN Cc1c([C@@H](C)N[C@H]2CCCN(C(=O)N3CCCC3)C2)cnn1-c1cccc(Cl)c1 ZINC000560573060 944258949 /nfs/dbraw/zinc/25/89/49/944258949.db2.gz DHWGPCXLOIHLIN-APWZRJJASA-N 0 3 415.969 4.165 20 0 HIADHN Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)NC[C@H](N1CCOCC1)C(F)(F)F ZINC000560580761 944262156 /nfs/dbraw/zinc/26/21/56/944262156.db2.gz JRVVMDSEYPNEHK-YOEHRIQHSA-N 0 3 413.509 4.341 20 0 HIADHN CCCN(C)[C@H](CNC(=O)Cc1ccc(NC(C)=O)cc1)c1ccc(Cl)cc1 ZINC000560709240 944304158 /nfs/dbraw/zinc/30/41/58/944304158.db2.gz TYEKXUVEEXZYNZ-OAQYLSRUSA-N 0 3 401.938 4.040 20 0 HIADHN CCCN(C)[C@H](CNC(=O)[C@H]1CC(=O)Nc2cc(F)ccc21)c1ccc(Cl)cc1 ZINC000560710825 944305150 /nfs/dbraw/zinc/30/51/50/944305150.db2.gz WYLJLTAMDUVYSR-AZUAARDMSA-N 0 3 417.912 4.104 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)COC(c2ccccc2)c2ccccc2)cc1 ZINC000560845261 944355867 /nfs/dbraw/zinc/35/58/67/944355867.db2.gz DNRPJNUOOCEXSG-DEOSSOPVSA-N 0 3 418.537 4.220 20 0 HIADHN Cc1ncccc1CC(=O)N(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000561076902 944432092 /nfs/dbraw/zinc/43/20/92/944432092.db2.gz ZXIGMJARVOQREV-VWLOTQADSA-N 0 3 414.553 4.021 20 0 HIADHN CN(C)CCN(C(=O)c1ccc2c(c1)nc(Cc1cccs1)n2C)C1CCCC1 ZINC000561151622 944483815 /nfs/dbraw/zinc/48/38/15/944483815.db2.gz JCQOXJAYCHZIHF-UHFFFAOYSA-N 0 3 410.587 4.172 20 0 HIADHN CC[C@@H](NCC(=O)Nc1cccc(CN2CCSCC2)c1)c1ccc(F)cc1F ZINC000561159540 944488664 /nfs/dbraw/zinc/48/86/64/944488664.db2.gz DCUXIEFEBAHNBN-OAQYLSRUSA-N 0 3 419.541 4.193 20 0 HIADHN CN(C)S(=O)(=O)c1ccc(CNC2(c3cccc(C(F)(F)F)c3)CCC2)cc1 ZINC000561160902 944491174 /nfs/dbraw/zinc/49/11/74/944491174.db2.gz QHAWYYPPNBZDQM-UHFFFAOYSA-N 0 3 412.477 4.125 20 0 HIADHN CCCN(CCN1CCCC1)C(=O)c1[nH]c(-c2cccc(C(F)(F)F)c2)nc1C ZINC000561201335 944511600 /nfs/dbraw/zinc/51/16/00/944511600.db2.gz YJWUVTJMBROYDO-UHFFFAOYSA-N 0 3 408.468 4.352 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)c1cccc(C(=O)N(C)c2ccccc2)c1 ZINC000561269054 944534526 /nfs/dbraw/zinc/53/45/26/944534526.db2.gz KIXBFMXDFAKAII-UHFFFAOYSA-N 0 3 407.558 4.301 20 0 HIADHN CC[C@H](C)N[C@@H](CNc1cc(C(F)(F)F)nc(-c2cccnc2)n1)c1ccco1 ZINC000561357291 944561481 /nfs/dbraw/zinc/56/14/81/944561481.db2.gz ZANZPWIWIFQXAV-ZFWWWQNUSA-N 0 3 405.424 4.692 20 0 HIADHN CC[C@H](C)N[C@H](CNc1cc(C(F)(F)F)nc(-c2cccnc2)n1)c1ccco1 ZINC000561357288 944561556 /nfs/dbraw/zinc/56/15/56/944561556.db2.gz ZANZPWIWIFQXAV-DZGCQCFKSA-N 0 3 405.424 4.692 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2ccccc2N2C[C@@H](C)O[C@@H](C)C2)N(C)C)cc1 ZINC000561355766 944561614 /nfs/dbraw/zinc/56/16/14/944561614.db2.gz KLTABFPQMQARRK-YYDVJCTNSA-N 0 3 410.562 4.033 20 0 HIADHN CCOC(=O)c1ccn(-c2cccc(CNCc3cc4cc(OC)ccc4o3)c2)n1 ZINC000561395263 944577957 /nfs/dbraw/zinc/57/79/57/944577957.db2.gz BGZNCUVQZOAKEP-UHFFFAOYSA-N 0 3 405.454 4.094 20 0 HIADHN C[C@@H](NC(=O)NC[C@H](c1cccs1)N1CCC(C)CC1)c1c(F)cncc1F ZINC000561434801 944595831 /nfs/dbraw/zinc/59/58/31/944595831.db2.gz MUNTYRKVHDQRJP-RHSMWYFYSA-N 0 3 408.518 4.255 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)Cc2ccc(OC(F)F)cc2)N(C)C)cc1 ZINC000561658333 944732577 /nfs/dbraw/zinc/73/25/77/944732577.db2.gz VUOHWWAJVRCENC-FQEVSTJZSA-N 0 3 406.473 4.037 20 0 HIADHN CSc1ccc([C@@H](CNC(=O)c2ccc3[nH]c(C(F)F)nc3c2)N(C)C)cc1 ZINC000561728145 944767014 /nfs/dbraw/zinc/76/70/14/944767014.db2.gz NVCIQMPOERLCSA-QGZVFWFLSA-N 0 3 404.486 4.255 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)N[C@@H]2CCN(Cc3ccccc3)[C@H]2C)c(Cl)c1 ZINC000561800393 944802614 /nfs/dbraw/zinc/80/26/14/944802614.db2.gz TYGZASOALMUKAW-IFXJQAMLSA-N 0 3 400.910 4.083 20 0 HIADHN COC(=O)c1cc(CN[C@@H]2CCCc3nc(-c4ccc(OC)cc4)sc32)cn1C ZINC000561949441 944871196 /nfs/dbraw/zinc/87/11/96/944871196.db2.gz VEPJKJRYZSIHDZ-QGZVFWFLSA-N 0 3 411.527 4.111 20 0 HIADHN COC(=O)c1ccc(COc2ccccc2CN[C@H]2CCCc3[nH]c(=O)ccc32)cc1 ZINC000561971946 944881184 /nfs/dbraw/zinc/88/11/84/944881184.db2.gz UWVJYWNIJIBIPZ-NRFANRHFSA-N 0 3 418.493 4.320 20 0 HIADHN COc1ccc(NC(=O)CNC(C)(C)c2ccc(Br)c(C)c2)cc1OC ZINC000562056884 944914513 /nfs/dbraw/zinc/91/45/13/944914513.db2.gz PDDMGQQSFBOUDJ-UHFFFAOYSA-N 0 3 421.335 4.238 20 0 HIADHN O=C(CN[C@H]1c2ccccc2CC12CCOCC2)Nc1ccc(C(F)(F)F)cc1 ZINC000562075138 944924632 /nfs/dbraw/zinc/92/46/32/944924632.db2.gz UVPMYWZUNLJGJQ-FQEVSTJZSA-N 0 3 404.432 4.328 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](NC2CC(C(F)(F)F)C2)c2ccc(F)cc2)c1 ZINC000562107984 944943386 /nfs/dbraw/zinc/94/33/86/944943386.db2.gz NQYPFHAYOIKWEH-PVARCSIZSA-N 0 3 401.425 4.249 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](NC2CC(C(F)(F)F)C2)c2ccc(F)cc2)c1 ZINC000562107983 944943552 /nfs/dbraw/zinc/94/35/52/944943552.db2.gz NQYPFHAYOIKWEH-JFUPDXTOSA-N 0 3 401.425 4.249 20 0 HIADHN O=C(NCCN1CCCC1)c1ccc(CNC(=O)c2ccc(C3=CCCC3)cc2)cc1 ZINC000562117744 944951350 /nfs/dbraw/zinc/95/13/50/944951350.db2.gz SXHPPEMMEDMAKE-UHFFFAOYSA-N 0 3 417.553 4.010 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)Nc1cc(OC)ccc1Br)c1ccco1 ZINC000562140124 944968043 /nfs/dbraw/zinc/96/80/43/944968043.db2.gz RUOQBFBFBCBELD-MLGOLLRUSA-N 0 3 410.312 4.302 20 0 HIADHN COc1ccc(NC(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)cc1Br ZINC000562171849 945000575 /nfs/dbraw/zinc/00/05/75/945000575.db2.gz UCZQBKLXPICSDI-SCLBCKFNSA-N 0 3 406.324 4.271 20 0 HIADHN COc1ccc(NC(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)cc1Br ZINC000562171850 945000651 /nfs/dbraw/zinc/00/06/51/945000651.db2.gz UCZQBKLXPICSDI-UGSOOPFHSA-N 0 3 406.324 4.271 20 0 HIADHN CC[C@@H](C)n1ncc(C(=O)NC[C@H](c2ccc(SC)cc2)N(C)C)c1C1CC1 ZINC000564092499 945375014 /nfs/dbraw/zinc/37/50/14/945375014.db2.gz FXKMUDFZELMIJX-FOIQADDNSA-N 0 3 400.592 4.486 20 0 HIADHN CSc1ccc([C@H](CNC(=O)c2nn(-c3ccc(F)cc3)cc2C)N(C)C)cc1 ZINC000564092827 945375088 /nfs/dbraw/zinc/37/50/88/945375088.db2.gz JPDJDUVORQXUDS-FQEVSTJZSA-N 0 3 412.534 4.074 20 0 HIADHN CSc1ccc([C@@H](CNC(=O)c2nn(-c3ccc(F)cc3)cc2C)N(C)C)cc1 ZINC000564092835 945375940 /nfs/dbraw/zinc/37/59/40/945375940.db2.gz JPDJDUVORQXUDS-HXUWFJFHSA-N 0 3 412.534 4.074 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)Nc1ccc(OC[C@@H]2CCCO2)cc1 ZINC000564118596 945387612 /nfs/dbraw/zinc/38/76/12/945387612.db2.gz ZZVSRKINRMUIMS-GMAHTHKFSA-N 0 3 409.530 4.031 20 0 HIADHN Fc1ccc([C@H]2C[C@H](N[C@H](c3nnc[nH]3)c3ccccc3)C2)cc1Br ZINC000564149456 945401889 /nfs/dbraw/zinc/40/18/89/945401889.db2.gz VBAUEMDZTXVXBR-MPGHIAIKSA-N 0 3 401.283 4.332 20 0 HIADHN Cc1ccc(CN[C@@H]2CCCc3c4cc(Br)ccc4[nH]c32)c(=O)n1C ZINC000564152545 945403094 /nfs/dbraw/zinc/40/30/94/945403094.db2.gz OJKYVRFODUZZRV-GOSISDBHSA-N 0 3 400.320 4.105 20 0 HIADHN C[C@@H](c1ccccc1F)N1CCC[C@@H](NCc2ccc(-c3cnn(C)c3)s2)C1=O ZINC000564229613 945445045 /nfs/dbraw/zinc/44/50/45/945445045.db2.gz FAHAUENFNDXQQS-MGPUTAFESA-N 0 3 412.534 4.130 20 0 HIADHN CC(C)N1CC[C@@H](NCC(=O)N(C)[C@H](C)c2ccccc2)[C@H]1c1ccc(F)c(F)c1 ZINC000564232159 945446962 /nfs/dbraw/zinc/44/69/62/945446962.db2.gz UWIZCYCKCVOXTN-CUHUQNRHSA-N 0 3 415.528 4.298 20 0 HIADHN COc1cc(Br)c(CN2C[C@H](c3ccccc3)[C@H]3COCC[C@H]32)cc1O ZINC000564307136 945508395 /nfs/dbraw/zinc/50/83/95/945508395.db2.gz BEXSCLHUIXGFTJ-ZHALLVOQSA-N 0 3 418.331 4.168 20 0 HIADHN Cc1nn(Cc2ccc(C)cc2)c(C)c1CN1CC[C@@](CO)(Cc2ccc(F)cc2)C1 ZINC000564330977 945518457 /nfs/dbraw/zinc/51/84/57/945518457.db2.gz UYKSHLGLIDWNHC-AREMUKBSSA-N 0 3 421.560 4.423 20 0 HIADHN Fc1ccc(OC(F)F)cc1-c1noc([C@H]2CCCN(Cc3cccnc3)C2)n1 ZINC000564360052 945526199 /nfs/dbraw/zinc/52/61/99/945526199.db2.gz ZFHMSGNSGXUDEP-AWEZNQCLSA-N 0 3 404.392 4.252 20 0 HIADHN FC(F)(F)c1cccc(CN2CCC(N[C@H](c3nc[nH]n3)c3ccccc3)CC2)c1 ZINC000564368027 945533067 /nfs/dbraw/zinc/53/30/67/945533067.db2.gz GEKAKLQTFFRGKH-FQEVSTJZSA-N 0 3 415.463 4.167 20 0 HIADHN C[C@@]1(NCC(=O)Nc2ccccc2I)CCCc2ccccc21 ZINC000564480113 945613524 /nfs/dbraw/zinc/61/35/24/945613524.db2.gz PFDKQTHRCPYTDJ-LJQANCHMSA-N 0 3 420.294 4.071 20 0 HIADHN O[C@H](CNCc1cc(F)cc(Br)c1)COc1cccc2ccccc21 ZINC000564484960 945615331 /nfs/dbraw/zinc/61/53/31/945615331.db2.gz GXRFGAHDENVPTK-GOSISDBHSA-N 0 3 404.279 4.271 20 0 HIADHN CN(C)Cc1ccccc1NC(=O)[C@H]1CCN(c2cc(Cl)ccc2Cl)C1=O ZINC000564524398 945650789 /nfs/dbraw/zinc/65/07/89/945650789.db2.gz HAJFQEMCBCRUBW-OAHLLOKOSA-N 0 3 406.313 4.047 20 0 HIADHN Brc1ccc([C@H](Cc2ccccn2)NCc2c[nH]c3nccnc23)cc1 ZINC000564535962 945659423 /nfs/dbraw/zinc/65/94/23/945659423.db2.gz ACGVJKNSGVUOIH-SFHVURJKSA-N 0 3 408.303 4.141 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)[C@H]1CCn2c(cnc2C2CCCCC2)C1)c1ccco1 ZINC000564678464 945725469 /nfs/dbraw/zinc/72/54/69/945725469.db2.gz BMEZKXZRNIZRGN-CUWPLCDZSA-N 0 3 412.578 4.332 20 0 HIADHN COc1ccc([C@@H]2CCCCCN2C(=O)CN[C@@H]2CCN(C)[C@H]2c2ccccc2)cc1 ZINC000564760062 945752490 /nfs/dbraw/zinc/75/24/90/945752490.db2.gz ICXBHBKVZHSKAM-USZFVNFHSA-N 0 3 421.585 4.174 20 0 HIADHN Cc1cc(NC(=O)c2cccc3[nH]c(C)nc32)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000565077102 945769597 /nfs/dbraw/zinc/76/95/97/945769597.db2.gz LWCWHFWXLZEONJ-IBGZPJMESA-N 0 3 414.513 4.076 20 0 HIADHN CCCN(C)[C@H](CNC(=O)C[C@H](NC(C)=O)c1ccccc1)c1ccc(Cl)cc1 ZINC000565131735 945782324 /nfs/dbraw/zinc/78/23/24/945782324.db2.gz GQEVWKMPSCGICX-FCHUYYIVSA-N 0 3 415.965 4.107 20 0 HIADHN COCCOc1ccc(NC(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)c(C)c1 ZINC000565259744 945793704 /nfs/dbraw/zinc/79/37/04/945793704.db2.gz KWIGPSFUBDYLLY-FQEVSTJZSA-N 0 3 405.926 4.098 20 0 HIADHN CC[C@H](NC(=O)NC[C@H](c1cccs1)N1CCCC1)c1ccc(OC)c(OC)c1 ZINC000565321701 945809242 /nfs/dbraw/zinc/80/92/42/945809242.db2.gz HIXHIADNQFCHDH-ZWKOTPCHSA-N 0 3 417.575 4.353 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)c1cc(NC(C)=O)cc(C(F)(F)F)c1)c1ccco1 ZINC000565500082 945839924 /nfs/dbraw/zinc/83/99/24/945839924.db2.gz GBQXNMYGTKZDLP-SJCJKPOMSA-N 0 3 411.424 4.116 20 0 HIADHN Cc1ccc2cc(CNCc3cccc(N4C(=O)NC5(CCCC5)C4=O)c3)ccc2n1 ZINC000565510009 945842806 /nfs/dbraw/zinc/84/28/06/945842806.db2.gz RJHMLIUMXFGIFJ-UHFFFAOYSA-N 0 3 414.509 4.202 20 0 HIADHN Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)N[C@@H]1CCCN(S(=O)(=O)C2CC2)C1 ZINC000565790673 945883658 /nfs/dbraw/zinc/88/36/58/945883658.db2.gz IOCUVICPICQCOW-CRAIPNDOSA-N 0 3 419.616 4.034 20 0 HIADHN C[C@H](CCCOc1ccccc1C(N)=O)NCc1nc(-c2ccccc2F)cs1 ZINC000566041754 945993307 /nfs/dbraw/zinc/99/33/07/945993307.db2.gz XZXPGEXTVNMOTH-OAHLLOKOSA-N 0 3 413.518 4.385 20 0 HIADHN COc1cccc([C@H]2[C@H](NCC(=O)Nc3c(C)cccc3Cl)CCN2C2CC2)c1 ZINC000566400551 946022374 /nfs/dbraw/zinc/02/23/74/946022374.db2.gz HRYUUVHDQBKADO-OFNKIYASSA-N 0 3 413.949 4.163 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)CSc2nc3ccccc3o2)N(C)C)cc1 ZINC000566670472 946070691 /nfs/dbraw/zinc/07/06/91/946070691.db2.gz YTZMCNMXAVQNIO-IBGZPJMESA-N 0 3 413.543 4.126 20 0 HIADHN CC[C@@H](NCc1cccc(NC(=O)c2ccccn2)c1)c1ccc(C(=O)OC)cc1 ZINC000566692855 946073304 /nfs/dbraw/zinc/07/33/04/946073304.db2.gz HSCNGAIMTUTJAK-OAQYLSRUSA-N 0 3 403.482 4.361 20 0 HIADHN CSc1ccc([C@H](CNC(=O)c2ccc(OCC(F)(F)F)cc2)N(C)C)cc1 ZINC000566919792 946166549 /nfs/dbraw/zinc/16/65/49/946166549.db2.gz VSCIWHDABDIUJV-SFHVURJKSA-N 0 3 412.477 4.382 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3cc4cc(Cl)sc4[nH]3)CC2)C[C@@H](C)O1 ZINC000566946841 946185270 /nfs/dbraw/zinc/18/52/70/946185270.db2.gz CLLZHJIJXZKXQH-ZIAGYGMSSA-N 0 3 409.983 4.234 20 0 HIADHN C/C(=C\c1ccccc1OC(F)F)CNCc1ccncc1OC[C@H]1CCOC1 ZINC000567033942 946223053 /nfs/dbraw/zinc/22/30/53/946223053.db2.gz JBJRQZNSAIQIQR-KGZWWPETSA-N 0 3 404.457 4.291 20 0 HIADHN CCC[C@H]1CN(c2nnc(C3CC3)n2C[C@H]2CCCCO2)CCN1Cc1ccccc1 ZINC000567065285 946230384 /nfs/dbraw/zinc/23/03/84/946230384.db2.gz WIXRXHHRATWTNV-XZOQPEGZSA-N 0 3 423.605 4.216 20 0 HIADHN Cc1cccn2cc(COc3ccc(CNCc4ccc5cnn(C)c5c4)cc3)nc12 ZINC000567094425 946242098 /nfs/dbraw/zinc/24/20/98/946242098.db2.gz LQLYXHNKEVDHEG-UHFFFAOYSA-N 0 3 411.509 4.398 20 0 HIADHN CCCN(C)[C@H](CNC(=O)c1csc(-c2cnn(C)c2)n1)c1ccc(Cl)cc1 ZINC000567258562 946280985 /nfs/dbraw/zinc/28/09/85/946280985.db2.gz HGRDTASNUNMUOC-GOSISDBHSA-N 0 3 417.966 4.010 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1ccnc(Sc2ccccn2)c1)c1ccco1 ZINC000567301042 946302129 /nfs/dbraw/zinc/30/21/29/946302129.db2.gz KHAOLCKKBZHFPA-DOTOQJQBSA-N 0 3 411.531 4.472 20 0 HIADHN CC(C)OC(=O)c1ccc(NC(=O)[C@H](C)N[C@H](C[C@H]2CCOC2)c2ccccc2)cc1 ZINC000567335424 946314377 /nfs/dbraw/zinc/31/43/77/946314377.db2.gz PBNFKVBWQQEMJZ-YCRNBWNJSA-N 0 3 424.541 4.336 20 0 HIADHN C[C@H]1[C@H](NC(=O)c2cnn(-c3ccccc3)c2C2CC2)CCN1Cc1ccccc1 ZINC000567780743 946406347 /nfs/dbraw/zinc/40/63/47/946406347.db2.gz HOODYRKGIKNVRL-FDDCHVKYSA-N 0 3 400.526 4.143 20 0 HIADHN COCC[C@@H](NC[C@@H](O)COc1ccccc1F)c1ccc(Cl)c(Cl)c1 ZINC000567904260 946422166 /nfs/dbraw/zinc/42/21/66/946422166.db2.gz VNBCTMMDFJYUMS-RDTXWAMCSA-N 0 3 402.293 4.240 20 0 HIADHN CCC(CC)[C@H](c1ccc(Cl)cc1)N(C)C(=O)C(=O)N[C@@H](C)C1=CCN(C)CC1 ZINC000567966383 946432245 /nfs/dbraw/zinc/43/22/45/946432245.db2.gz YIQAYDSKGNEYGT-HRAATJIYSA-N 0 3 419.997 4.042 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2ccc(OC(F)F)cc2F)c1 ZINC000568089595 946460219 /nfs/dbraw/zinc/46/02/19/946460219.db2.gz FRVFWJNDEPCGKO-UHFFFAOYSA-N 0 3 411.424 4.031 20 0 HIADHN CSc1ccc([C@@H](CNC(=O)c2cnn(CC(C)C)c2C(F)F)N(C)C)cc1 ZINC000568132222 946474205 /nfs/dbraw/zinc/47/42/05/946474205.db2.gz PYWAWXIWIKHTDG-QGZVFWFLSA-N 0 3 410.534 4.231 20 0 HIADHN COc1ccc([C@H](C)NCc2ccc(C)nc2-n2cc(Cl)cn2)c(C)c1OC ZINC000568375959 946526803 /nfs/dbraw/zinc/52/68/03/946526803.db2.gz TUTCDWRDNQKQFT-HNNXBMFYSA-N 0 3 400.910 4.406 20 0 HIADHN Cc1ccccc1NC(=O)[C@H](C)N[C@H]1CCN(C(C)C)[C@H]1c1ccc(F)c(F)c1 ZINC000568416829 946532192 /nfs/dbraw/zinc/53/21/92/946532192.db2.gz JOGLMNVUOPWTLB-SSKFGXFMSA-N 0 3 401.501 4.414 20 0 HIADHN Cc1ccc(C(=O)C2CCN(C[C@H]3CN(Cc4ccccc4)CCCO3)CC2)cc1 ZINC000568423394 946537943 /nfs/dbraw/zinc/53/79/43/946537943.db2.gz QYMIQUKKIKOMRL-VWLOTQADSA-N 0 3 406.570 4.181 20 0 HIADHN CSc1ccc([C@@H](CNC(=O)c2cc(-c3csc(C)n3)c[nH]2)N(C)C)cc1 ZINC000568555195 946592477 /nfs/dbraw/zinc/59/24/77/946592477.db2.gz HXXKEQFDHJBKLQ-LJQANCHMSA-N 0 3 400.573 4.201 20 0 HIADHN CC(C)[C@@H]1OCCC[C@H]1CNCc1c(Br)cncc1Br ZINC000568692181 946659142 /nfs/dbraw/zinc/65/91/42/946659142.db2.gz XNAHIPJUTIITBZ-NHYWBVRUSA-N 0 3 406.162 4.147 20 0 HIADHN CC(C)[C@@H]1OCCC[C@@H]1CNCc1c(Br)cncc1Br ZINC000568692174 946659820 /nfs/dbraw/zinc/65/98/20/946659820.db2.gz XNAHIPJUTIITBZ-ABAIWWIYSA-N 0 3 406.162 4.147 20 0 HIADHN CN1CC[C@H](NCC(=O)Nc2cccc(Cl)c2Cl)[C@H]1c1ccc(F)c(F)c1 ZINC000568698314 946666288 /nfs/dbraw/zinc/66/62/88/946666288.db2.gz KJZPHYSYXILIEU-QFBILLFUSA-N 0 3 414.283 4.245 20 0 HIADHN CN(C)C[C@H](NC(=O)Nc1ccccc1C(=O)N1CCCC1)c1ccc(Cl)cc1 ZINC000568770971 946681300 /nfs/dbraw/zinc/68/13/00/946681300.db2.gz WXFSQZBOFIANDV-FQEVSTJZSA-N 0 3 414.937 4.000 20 0 HIADHN C[C@H](NC[C@H](Cc1ccccc1)C(F)(F)F)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000568805856 946705042 /nfs/dbraw/zinc/70/50/42/946705042.db2.gz CAQCXRXJGCAPDI-BBRMVZONSA-N 0 3 403.441 4.301 20 0 HIADHN CCN(CC(=O)N1N=C(c2ccco2)C[C@H]1c1cccs1)[C@H]1CCOC(C)(C)C1 ZINC000568919525 946758758 /nfs/dbraw/zinc/75/87/58/946758758.db2.gz BBWWSENUZORRHD-WMZOPIPTSA-N 0 3 415.559 4.298 20 0 HIADHN C[C@H](c1ccc(F)cc1)N1CC[C@H](N[C@H]2c3ccccc3CC23CCOCC3)C1=O ZINC000569007381 946794683 /nfs/dbraw/zinc/79/46/83/946794683.db2.gz WGSYVMQWFCPSKI-VSDWSMLSSA-N 0 3 408.517 4.171 20 0 HIADHN Cc1ccoc1C(=O)NCCCNCc1cc(C(F)(F)F)ccc1Br ZINC000569038962 946804907 /nfs/dbraw/zinc/80/49/07/946804907.db2.gz YKQQDQODXWPIBZ-UHFFFAOYSA-N 0 3 419.241 4.279 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)N[C@H]2c3ccccc3CC23CCOCC3)CN1Cc1ccccc1 ZINC000569048678 946809286 /nfs/dbraw/zinc/80/92/86/946809286.db2.gz PRKIARVEKWTJKB-CKUXNOBLSA-N 0 3 419.569 4.043 20 0 HIADHN Cc1ccc(NC(=O)NC(=O)[C@H](C)N[C@H](C[C@@H]2CCOC2)c2ccccc2)c(C)c1 ZINC000569073151 946815372 /nfs/dbraw/zinc/81/53/72/946815372.db2.gz MKTFCPONALCCSE-CNNODRBYSA-N 0 3 409.530 4.098 20 0 HIADHN CCN(C[C@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)Cc1ccc(C(F)F)cc1 ZINC000569242445 946839951 /nfs/dbraw/zinc/83/99/51/946839951.db2.gz UWSZFPGTXBTLRE-FQEVSTJZSA-N 0 3 422.541 4.298 20 0 HIADHN C[C@H]1[C@@H](NC(=O)Nc2cccc(OCc3cccnc3)c2)CCN1Cc1ccccc1 ZINC000569261039 946841816 /nfs/dbraw/zinc/84/18/16/946841816.db2.gz OXVGXEQNLLGIPX-CYFREDJKSA-N 0 3 416.525 4.445 20 0 HIADHN Cc1ccc(C(=O)N[C@H](C)CN(C)Cc2ccccc2)cc1NC(=O)NC(C)(C)C ZINC000569280282 946848252 /nfs/dbraw/zinc/84/82/52/946848252.db2.gz JBJSXOPZVSKBIW-GOSISDBHSA-N 0 3 410.562 4.165 20 0 HIADHN Cc1nc(CCN[C@H](C)c2cccc(S(=O)(=O)NC3CCCCCC3)c2)c(C)o1 ZINC000569368425 946861125 /nfs/dbraw/zinc/86/11/25/946861125.db2.gz NRWXKQKVLIPYOZ-MRXNPFEDSA-N 0 3 419.591 4.186 20 0 HIADHN CN1CC[C@@H](NCC(=O)Nc2ccccc2Oc2ccccc2)[C@@H]1c1ccccc1 ZINC000569386877 946863463 /nfs/dbraw/zinc/86/34/63/946863463.db2.gz POOLJSPQZCCDRV-RDGATRHJSA-N 0 3 401.510 4.452 20 0 HIADHN CC[C@@H](NCc1cccc(N2C(=O)N[C@](C)(C3CC3)C2=O)c1)c1cccc(OC)c1 ZINC000569389125 946864395 /nfs/dbraw/zinc/86/43/95/946864395.db2.gz QVWPHJVBHJAKFM-ZJSXRUAMSA-N 0 3 407.514 4.161 20 0 HIADHN CCN(C(=O)CN[C@@H]1CCN(C)[C@H]1c1ccc(F)c(F)c1)[C@H](C)c1ccc(F)cc1 ZINC000569510872 946882553 /nfs/dbraw/zinc/88/25/53/946882553.db2.gz QIGCPJFOKWSOTJ-AECOYVPUSA-N 0 3 419.491 4.048 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)N1CCC(OC2CCC(C)CC2)CC1 ZINC000569643734 946917077 /nfs/dbraw/zinc/91/70/77/946917077.db2.gz OSYTXJBQOZWHPZ-SNCIUUNGSA-N 0 3 401.595 4.276 20 0 HIADHN O=C([C@H]1CCCN(Cc2cccc(F)c2)C1)N1CCCn2c(cc3ccccc32)C1 ZINC000569730159 946957573 /nfs/dbraw/zinc/95/75/73/946957573.db2.gz HLPFGSWMOBTLJZ-NRFANRHFSA-N 0 3 405.517 4.425 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)CSc1cccc(Br)c1)c1ccco1 ZINC000569842523 947017292 /nfs/dbraw/zinc/01/72/92/947017292.db2.gz KGCKOCAUOPYSJE-XJKSGUPXSA-N 0 3 411.365 4.380 20 0 HIADHN Cc1ccnc(Oc2ccc(NC(=O)N[C@H]3CCN(Cc4ccccc4)[C@@H]3C)cc2)n1 ZINC000570033393 947078235 /nfs/dbraw/zinc/07/82/35/947078235.db2.gz SQUXMFOZVQEJKX-GCJKJVERSA-N 0 3 417.513 4.362 20 0 HIADHN CN(C)C[C@@H](NC(=O)c1cnc(Cc2ccccc2F)s1)c1ccc(F)cc1 ZINC000570191806 947128700 /nfs/dbraw/zinc/12/87/00/947128700.db2.gz XORWJCRQVPPUGG-GOSISDBHSA-N 0 3 401.482 4.045 20 0 HIADHN OC12C[C@@H]3C[C@H](C1)CC(NCc1nc(-c4cccc(Br)c4)c[nH]1)(C3)C2 ZINC000570288377 947180203 /nfs/dbraw/zinc/18/02/03/947180203.db2.gz CXRFDJOLJITXLJ-LWYUSKRHSA-N 0 3 402.336 4.013 20 0 HIADHN CN(C)C[C@H](NC(=O)N[C@H]1CCO[C@@H]1c1ccc(F)c(F)c1)c1ccc(Cl)cc1 ZINC000570380186 947228252 /nfs/dbraw/zinc/22/82/52/947228252.db2.gz JLNIHPPPQOCCJQ-SLFFLAALSA-N 0 3 423.891 4.050 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)N1CCC2(CCOCC2)[C@H]1C)c1ccc(Cl)cc1 ZINC000570433445 947245011 /nfs/dbraw/zinc/24/50/11/947245011.db2.gz OGVRGYFDNZFULG-XLIONFOSSA-N 0 3 407.986 4.324 20 0 HIADHN CC[C@]1(CNCc2cn3ccc(Br)cc3n2)OCCc2ccccc21 ZINC000570438734 947248824 /nfs/dbraw/zinc/24/88/24/947248824.db2.gz MZMAIFYLQRYSNM-HXUWFJFHSA-N 0 3 400.320 4.065 20 0 HIADHN C[C@H]1CN(CCOC2CCN(Cc3cnc(C4CCCCC4)s3)CC2)C[C@H](C)O1 ZINC000570551707 947291007 /nfs/dbraw/zinc/29/10/07/947291007.db2.gz NGKOLKOEHOJCJT-OALUTQOASA-N 0 3 421.651 4.281 20 0 HIADHN Cc1cc(CSc2ncccc2C(=O)N[C@@H]2CCN(Cc3ccccc3)[C@H]2C)no1 ZINC000570595375 947307198 /nfs/dbraw/zinc/30/71/98/947307198.db2.gz LUHPFYHFCMPTIH-LAUBAEHRSA-N 0 3 422.554 4.063 20 0 HIADHN C/C(=C/c1cccc(C(F)(F)F)c1)CNCc1cccc(C(=O)N2CCOCC2)c1 ZINC000570599732 947309402 /nfs/dbraw/zinc/30/94/02/947309402.db2.gz VZNLSNHZWQWLOP-ATVHPVEESA-N 0 3 418.459 4.371 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N1CC[C@@](F)(c2ccccc2)C1 ZINC000570828392 947362968 /nfs/dbraw/zinc/36/29/68/947362968.db2.gz JJPFXJBZZHVQLC-QLOJAFMTSA-N 0 3 413.459 4.072 20 0 HIADHN COc1ccc(F)c2[nH]c(C(=O)NC[C@H](c3ccc(OC(C)C)cc3)N(C)C)cc21 ZINC000570878392 947380459 /nfs/dbraw/zinc/38/04/59/947380459.db2.gz DHUPWCFFJVBMMO-HXUWFJFHSA-N 0 3 413.493 4.136 20 0 HIADHN F[C@]1(c2ccccc2)CCN(CC2(CN3CC[C@](F)(c4ccccc4)C3)COC2)C1 ZINC000571181603 947533083 /nfs/dbraw/zinc/53/30/83/947533083.db2.gz OYQDROLXMSIBAH-JWQCQUIFSA-N 0 3 412.524 4.144 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Cc1cc(Cl)ccc1Br)c1ccco1 ZINC000571236888 947559674 /nfs/dbraw/zinc/55/96/74/947559674.db2.gz NDCTYCQOOZSPRX-LRDDRELGSA-N 0 3 413.743 4.484 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)CCc2ncc(-c3ccccc3F)o2)CCN1Cc1ccccc1 ZINC000571314433 947590633 /nfs/dbraw/zinc/59/06/33/947590633.db2.gz JMYGZCFFVCELAW-UTKZUKDTSA-N 0 3 407.489 4.193 20 0 HIADHN Cc1cc(Cl)ccc1NC(=O)[C@H](C)N[C@@H]1CCN(C)[C@H]1c1ccc(F)c(F)c1 ZINC000571366726 947622779 /nfs/dbraw/zinc/62/27/79/947622779.db2.gz KPPHUCGUXTXJEG-SVIJTADQSA-N 0 3 407.892 4.289 20 0 HIADHN COc1ccc(CN2CCC(c3ncc4n3CCCC4)CC2)c(Br)c1 ZINC000571447605 947653681 /nfs/dbraw/zinc/65/36/81/947653681.db2.gz FWPIDQAOGJGANX-UHFFFAOYSA-N 0 3 404.352 4.370 20 0 HIADHN FC(F)(F)c1ccnn1-c1ccc(NC2CCN(Cc3ccncc3)CC2)cc1 ZINC000571791612 947785765 /nfs/dbraw/zinc/78/57/65/947785765.db2.gz AFAWBUPJKKXFTE-UHFFFAOYSA-N 0 3 401.436 4.363 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)c1nc2ccccc2cc1Br)c1ccco1 ZINC000571843107 947802892 /nfs/dbraw/zinc/80/28/92/947802892.db2.gz RKSJUNGENQBEBV-SUMWQHHRSA-N 0 3 416.319 4.450 20 0 HIADHN CC(C)(C)N(Cc1ccccn1)C(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000572278834 947874951 /nfs/dbraw/zinc/87/49/51/947874951.db2.gz FDVXOKXWRJHTMC-FQEVSTJZSA-N 0 3 401.501 4.366 20 0 HIADHN CN(C)Cc1ccccc1NC(=O)c1nn(-c2ccc(F)cc2)cc1Br ZINC000572279979 947875302 /nfs/dbraw/zinc/87/53/02/947875302.db2.gz BSTLYXOXCRTKMH-UHFFFAOYSA-N 0 3 417.282 4.088 20 0 HIADHN O=[N+]([O-])c1ccc(-c2noc([C@@H]3CN(Cc4ccccc4)CCC3(F)F)n2)s1 ZINC000572284503 947875749 /nfs/dbraw/zinc/87/57/49/947875749.db2.gz OTFYATINXQNNFA-ZDUSSCGKSA-N 0 3 406.414 4.331 20 0 HIADHN Cc1ccncc1CCCN(C)Cc1cccc(Br)c1OCC(C)(C)O ZINC000572286650 947876478 /nfs/dbraw/zinc/87/64/78/947876478.db2.gz UCEXGTBKHWDRAP-UHFFFAOYSA-N 0 3 421.379 4.367 20 0 HIADHN COCCOc1ccc(CN[C@H](c2cncc(Br)c2)C2CC2)cc1OC ZINC000572385376 947891423 /nfs/dbraw/zinc/89/14/23/947891423.db2.gz IUYRBOAVRHVESQ-FQEVSTJZSA-N 0 3 421.335 4.119 20 0 HIADHN C[C@@H](NC[C@@H](CO)Cc1cc(F)c(F)c(F)c1)c1sccc1Br ZINC000572451688 947911296 /nfs/dbraw/zinc/91/12/96/947911296.db2.gz SVEPSYYMAXJPLE-KOLCDFICSA-N 0 3 408.283 4.430 20 0 HIADHN O=S(=O)(Cc1ccc(C(F)F)cc1)NC1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1 ZINC000572501039 947916121 /nfs/dbraw/zinc/91/61/21/947916121.db2.gz ZBGYQTAHPCPGGZ-SEJPIABJSA-N 0 3 420.525 4.239 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc(CN[C@H](C)c2ccc(OC(C)C)cc2)cc1 ZINC000572507589 947920471 /nfs/dbraw/zinc/92/04/71/947920471.db2.gz XQCVWFQJCIXBFW-GOSISDBHSA-N 0 3 404.576 4.355 20 0 HIADHN CC(C)Cc1ccc([C@@H](CNC(=O)c2ccc(CN3CCCC3=O)cc2)N(C)C)cc1 ZINC000572624592 947959149 /nfs/dbraw/zinc/95/91/49/947959149.db2.gz RHTFXIFNGMTWGF-XMMPIXPASA-N 0 3 421.585 4.040 20 0 HIADHN CC[C@H](C)[C@@H](C)N(CC(=O)N1c2ccccc2NC(=O)C[C@H]1C(F)(F)F)C1CC1 ZINC000572626582 947960617 /nfs/dbraw/zinc/96/06/17/947960617.db2.gz QQKHEURALLMHFF-IYOUNJFTSA-N 0 3 411.468 4.192 20 0 HIADHN CCN(CC)[C@@H](CNCc1cn2ccc(Br)cc2n1)c1ccsc1 ZINC000572651808 947968561 /nfs/dbraw/zinc/96/85/61/947968561.db2.gz UCFKEZWAXLQUFE-KRWDZBQOSA-N 0 3 407.381 4.331 20 0 HIADHN COCc1cccc(CNC(=O)CNC(C)(C)c2ccc(Br)c(C)c2)c1 ZINC000572685312 947984844 /nfs/dbraw/zinc/98/48/44/947984844.db2.gz OHUNMDYUHHPYRR-UHFFFAOYSA-N 0 3 419.363 4.045 20 0 HIADHN Cc1cc([N-]S(=O)(=O)c2ccc(C(F)F)cc2)ccc1OCC[NH+]1CCCC1 ZINC000572756449 948001394 /nfs/dbraw/zinc/00/13/94/948001394.db2.gz YDJDKDHPILYOEQ-UHFFFAOYSA-N 0 3 410.486 4.208 20 0 HIADHN C[C@H]1[C@H](NC(=O)Nc2ccc(OCC3CCOCC3)cc2)CCN1Cc1ccccc1 ZINC000572758098 948003150 /nfs/dbraw/zinc/00/31/50/948003150.db2.gz JAAMHGSFMMBXRS-YADARESESA-N 0 3 423.557 4.277 20 0 HIADHN O[C@H](COc1ccc(Cl)cc1)CN1CCC(c2noc3cc(F)ccc32)CC1 ZINC000572767658 948005425 /nfs/dbraw/zinc/00/54/25/948005425.db2.gz RNQWVJVCMIJMFU-KRWDZBQOSA-N 0 3 404.869 4.240 20 0 HIADHN CN(C)CCn1nccc1NC(=O)c1cccc(Oc2ccc(Cl)c(Cl)c2)n1 ZINC000572792996 948012058 /nfs/dbraw/zinc/01/20/58/948012058.db2.gz STWDSPOWEXIDFZ-UHFFFAOYSA-N 0 3 420.300 4.191 20 0 HIADHN CCOC(=O)CC(C)(C)CC(=O)N(c1cccc(SC)c1)C1CCN(C)CC1 ZINC000572878192 948028178 /nfs/dbraw/zinc/02/81/78/948028178.db2.gz SRKLDLFGQVXEGJ-UHFFFAOYSA-N 0 3 406.592 4.205 20 0 HIADHN CCN1CC[C@H](NCc2cc(C(=O)OC)sc2C)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000573147829 948091119 /nfs/dbraw/zinc/09/11/19/948091119.db2.gz PAIOAKXRLZNMFL-QFBILLFUSA-N 0 3 412.477 4.186 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCC(C)(OC)CC1)c1ccc(C(F)(F)F)cc1 ZINC000573228754 948113802 /nfs/dbraw/zinc/11/38/02/948113802.db2.gz IGRLPLHVZHOMMP-GOSISDBHSA-N 0 3 415.500 4.299 20 0 HIADHN CCOC(=O)c1cccc(OC[C@H](O)CN[C@H]2CCSc3ccc(Cl)cc32)c1 ZINC000573231218 948113891 /nfs/dbraw/zinc/11/38/91/948113891.db2.gz YVRUWSNXDOKIRU-APWZRJJASA-N 0 3 421.946 4.083 20 0 HIADHN Cc1ccncc1CCC[N@@H+](C)Cc1cccc([N-]S(=O)(=O)c2ccccc2)c1 ZINC000573248404 948120870 /nfs/dbraw/zinc/12/08/70/948120870.db2.gz QYSCOOJAKCCBFZ-UHFFFAOYSA-N 0 3 409.555 4.255 20 0 HIADHN Cc1ccncc1CCC[N@H+](C)Cc1cccc([N-]S(=O)(=O)c2ccccc2)c1 ZINC000573248404 948120876 /nfs/dbraw/zinc/12/08/76/948120876.db2.gz QYSCOOJAKCCBFZ-UHFFFAOYSA-N 0 3 409.555 4.255 20 0 HIADHN COc1ccc2cc([C@H](C)C(=O)Nc3cccc(CN4CC[C@H](O)C4)c3)ccc2c1 ZINC000573273573 948135135 /nfs/dbraw/zinc/13/51/35/948135135.db2.gz NOLCJTUZBRQWCL-SBUREZEXSA-N 0 3 404.510 4.157 20 0 HIADHN NS(=O)(=O)c1ccc2c(c1)[C@@H](NCc1ccc(OC3CCCCC3)cc1)CCC2 ZINC000573292235 948148068 /nfs/dbraw/zinc/14/80/68/948148068.db2.gz VCPQFUMSXBNLEM-QHCPKHFHSA-N 0 3 414.571 4.213 20 0 HIADHN O=C(Nc1ccc2c(c1)OCO2)C1CCN(CCc2ccc(F)cc2Cl)CC1 ZINC000573332107 948157764 /nfs/dbraw/zinc/15/77/64/948157764.db2.gz MJCLNSDRSPOKDT-UHFFFAOYSA-N 0 3 404.869 4.101 20 0 HIADHN CCOc1ccc(C(=O)NC[C@@H](c2ccc(SC)cc2)N(C)C)cc1OCC ZINC000573359512 948165884 /nfs/dbraw/zinc/16/58/84/948165884.db2.gz WQCHCUYZWBOOBD-IBGZPJMESA-N 0 3 402.560 4.239 20 0 HIADHN CNC(=O)COc1cccc(CN[C@@H]2CCCc3nc(-c4ccc(C)cc4)sc32)c1 ZINC000573391074 948177135 /nfs/dbraw/zinc/17/71/35/948177135.db2.gz MLGIPVQFHGVVRB-HXUWFJFHSA-N 0 3 421.566 4.411 20 0 HIADHN CN(C(=O)c1ccc(Oc2ccccc2)cn1)C1CCN(CCc2ccccn2)CC1 ZINC000573460290 948207122 /nfs/dbraw/zinc/20/71/22/948207122.db2.gz YRNDIYXAQAPAEP-UHFFFAOYSA-N 0 3 416.525 4.048 20 0 HIADHN CC(=O)c1oc2ccccc2c1NC(=O)[C@H](C)N(C)CCCN(C)Cc1ccco1 ZINC000573512008 948224802 /nfs/dbraw/zinc/22/48/02/948224802.db2.gz PVGOQHAWVIDSRF-INIZCTEOSA-N 0 3 411.502 4.009 20 0 HIADHN CCN1CC[C@@H](NCC(=O)N(C)Cc2ccccc2F)[C@H]1c1ccc(Cl)c(F)c1 ZINC000573627099 948254916 /nfs/dbraw/zinc/25/49/16/948254916.db2.gz CGTSWQJREGZLLJ-IFMALSPDSA-N 0 3 421.919 4.002 20 0 HIADHN CCN1CC[C@@H](NCC(=O)N(C)Cc2ccccc2F)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000573627103 948255480 /nfs/dbraw/zinc/25/54/80/948255480.db2.gz CGTSWQJREGZLLJ-IRLDBZIGSA-N 0 3 421.919 4.002 20 0 HIADHN CN1CCN(C[C@H](NCc2ccc(-c3cccc(F)c3F)o2)c2ccccc2)CC1 ZINC000573656200 948269806 /nfs/dbraw/zinc/26/98/06/948269806.db2.gz QKIZRNXAYAVJKN-QFIPXVFZSA-N 0 3 411.496 4.303 20 0 HIADHN Cc1noc(C)c1COc1ccc(CC(=O)N[C@H](C)CN(C)Cc2ccccc2)cc1 ZINC000573720370 948281450 /nfs/dbraw/zinc/28/14/50/948281450.db2.gz VBJALPBFLPNCHR-GOSISDBHSA-N 0 3 421.541 4.050 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)[C@H]2C[C@H]2c2ccccc2OC(F)(F)F)cc1 ZINC000573737018 948285469 /nfs/dbraw/zinc/28/54/69/948285469.db2.gz XXZMAXHQECSWSL-FHWLQOOXSA-N 0 3 422.447 4.116 20 0 HIADHN COc1cc(Br)c(CNC2(Cc3cccc(F)c3)CCOCC2)cc1O ZINC000573824696 948303118 /nfs/dbraw/zinc/30/31/18/948303118.db2.gz ODQHHOIHPRRIEP-UHFFFAOYSA-N 0 3 424.310 4.184 20 0 HIADHN COc1ccc(OCc2ccccn2)c(CNC[C@]2(C)OCCc3sccc32)c1 ZINC000574005440 948347188 /nfs/dbraw/zinc/34/71/88/948347188.db2.gz MSBSSHDARYQHQF-QHCPKHFHSA-N 0 3 410.539 4.308 20 0 HIADHN CC[C@@H](c1cccc(OC)c1)N(C)C(=O)CCCN1CCN(c2ccccc2)CC1 ZINC000574072330 948357006 /nfs/dbraw/zinc/35/70/06/948357006.db2.gz SLPZYZTZGHDYGK-DEOSSOPVSA-N 0 3 409.574 4.207 20 0 HIADHN CC(C)CC(=O)N1Cc2ccccc2C[C@@H]1c1nc(-c2ccc(CN(C)C)cc2)no1 ZINC000574118269 948369141 /nfs/dbraw/zinc/36/91/41/948369141.db2.gz SOOZHPORYKJHCJ-JOCHJYFZSA-N 0 3 418.541 4.470 20 0 HIADHN CN(C)C[C@@H](NC(=O)c1ccc(C(=O)N(C)c2ccccc2)cc1)c1ccc(F)cc1 ZINC000574190464 948383058 /nfs/dbraw/zinc/38/30/58/948383058.db2.gz ZOIMFNVLFUBYQS-HSZRJFAPSA-N 0 3 419.500 4.135 20 0 HIADHN Cc1cc(CN[C@@H](CN2CCC(C(N)=O)CC2)c2ccc(Cl)cc2)ccc1Cl ZINC000574203375 948386887 /nfs/dbraw/zinc/38/68/87/948386887.db2.gz XIOZOOMKFJMCIN-NRFANRHFSA-N 0 3 420.384 4.330 20 0 HIADHN CN(Cc1c(F)cccc1Cl)C(=O)CN[C@@H]1CCN(C)[C@@H]1c1ccc(Cl)cc1 ZINC000574488541 948456547 /nfs/dbraw/zinc/45/65/47/948456547.db2.gz BCNBZBOPBHXYAE-TZIWHRDSSA-N 0 3 424.347 4.126 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)[C@H](C)N[C@H]1c2ccccc2CC12CCOCC2 ZINC000574489757 948457568 /nfs/dbraw/zinc/45/75/68/948457568.db2.gz RJISIYGTQGPZMK-BTYIYWSLSA-N 0 3 414.933 4.359 20 0 HIADHN C[C@H](N[C@@H]1CCCN(Cc2nccn2C)C1=O)c1ccc(-c2c(F)cccc2F)cc1 ZINC000574490368 948457711 /nfs/dbraw/zinc/45/77/11/948457711.db2.gz PXAODIFPAJNMFX-HRAATJIYSA-N 0 3 424.495 4.207 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)[C@H](C)N[C@@H]1c2ccccc2CC12CCOCC2 ZINC000574489760 948458012 /nfs/dbraw/zinc/45/80/12/948458012.db2.gz RJISIYGTQGPZMK-YCRPNKLZSA-N 0 3 414.933 4.359 20 0 HIADHN O=C(Cc1ccsc1)N(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000574541628 948466452 /nfs/dbraw/zinc/46/64/52/948466452.db2.gz YVPXBOOOMUAUOM-HSZRJFAPSA-N 0 3 405.567 4.379 20 0 HIADHN CSC1(CN(C)Cc2cccc(Br)c2OC[C@@H]2CCCO2)CC1 ZINC000574797196 948529241 /nfs/dbraw/zinc/52/92/41/948529241.db2.gz SYYIYWHIDYDKAG-HNNXBMFYSA-N 0 3 400.382 4.334 20 0 HIADHN C[C@H](NC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1)c1nccn1-c1ccccc1 ZINC000574937192 948557893 /nfs/dbraw/zinc/55/78/93/948557893.db2.gz XKMPBSZODGDZCP-ICSRJNTNSA-N 0 3 406.505 4.101 20 0 HIADHN O=C(Nc1c[nH]nc1[C@@H]1CCCN(C[C@H]2CCC3(CCCC3)O2)C1)C1CCCC1 ZINC000575021528 948574955 /nfs/dbraw/zinc/57/49/55/948574955.db2.gz XHYUAZGODLIZGR-RTBURBONSA-N 0 3 400.567 4.210 20 0 HIADHN COc1cc(CN(C)[C@@H](C)[C@H]2Cc3ccccc3O2)cc(OC)c1OCC(F)F ZINC000575095099 948591670 /nfs/dbraw/zinc/59/16/70/948591670.db2.gz XCMRREXSCUJOSQ-KBXCAEBGSA-N 0 3 407.457 4.172 20 0 HIADHN COC(=O)c1ccc(CNCCCn2c(C)nc3ccccc32)c(Br)c1 ZINC000575144201 948603206 /nfs/dbraw/zinc/60/32/06/948603206.db2.gz OIVLVJLOKVORCL-UHFFFAOYSA-N 0 3 416.319 4.074 20 0 HIADHN O=c1[n-]c(CN2C[C@@H]3C[N@@H+](Cc4ccccc4)CC[C@@H]3C2)nc2c3ccccc3oc21 ZINC000575166312 948614289 /nfs/dbraw/zinc/61/42/89/948614289.db2.gz DEDLZNSAJMOKBF-MOPGFXCFSA-N 0 3 414.509 4.036 20 0 HIADHN O=c1[n-]c(CN2C[C@@H]3C[N@H+](Cc4ccccc4)CC[C@@H]3C2)nc2c3ccccc3oc21 ZINC000575166312 948614299 /nfs/dbraw/zinc/61/42/99/948614299.db2.gz DEDLZNSAJMOKBF-MOPGFXCFSA-N 0 3 414.509 4.036 20 0 HIADHN CC(C)c1ccc(-c2cc(C(F)(F)N3CC[C@@H]4NCCO[C@@H]4C3)c(Cl)nn2)cc1 ZINC001164389314 718826134 /nfs/dbraw/zinc/82/61/34/718826134.db2.gz HIQXMGYGKHGPEP-PKOBYXMFSA-N 0 3 422.907 4.032 20 0 HIADHN C[C@H]1CN(c2cc(-c3ccc(Cl)nc3)ccc2C2OCCCO2)[C@@H](C)CN1C ZINC001164632854 719225678 /nfs/dbraw/zinc/22/56/78/719225678.db2.gz BXRHGZXKDZARLW-HOTGVXAUSA-N 0 3 401.938 4.366 20 0 HIADHN Clc1ccc2[nH]c3ncnc(N4CC[C@@H]5[C@H]4CCN5Cc4cccnc4)c3c2c1 ZINC001164729384 720426374 /nfs/dbraw/zinc/42/63/74/720426374.db2.gz HIHXWNYAMUKPSU-RTBURBONSA-N 0 3 404.905 4.013 20 0 HIADHN Cn1cc(CN2CC[C@H]3CN(c4cc(SCc5ccccc5)ccn4)C[C@H]3C2)cn1 ZINC001164770672 721213680 /nfs/dbraw/zinc/21/36/80/721213680.db2.gz OCYLBBDKNLDBSP-FCHUYYIVSA-N 0 3 419.598 4.066 20 0 HIADHN Cc1cc2c(nc(Cl)nc2N2CCN3C[C@H](Oc4cccc(F)c4)C[C@@H]3C2)s1 ZINC001164899184 721525498 /nfs/dbraw/zinc/52/54/98/721525498.db2.gz KREHVAYGURNIQK-GDBMZVCRSA-N 0 3 418.925 4.134 20 0 HIADHN Cc1cc(-c2cccc(F)c2)nnc1N1CCN2C[C@@H](Oc3cccc(F)c3)C[C@@H]2C1 ZINC001164911675 721564264 /nfs/dbraw/zinc/56/42/64/721564264.db2.gz ZKOOGEFEHYKWIK-IRLDBZIGSA-N 0 3 422.479 4.072 20 0 HIADHN Cc1nc2ccsc2c(N2CCC(F)(F)[C@@]3(CCN(Cc4ccccn4)C3)C2)n1 ZINC001164906048 721583761 /nfs/dbraw/zinc/58/37/61/721583761.db2.gz YPWWOOIWCIXFDR-HXUWFJFHSA-N 0 3 415.513 4.132 20 0 HIADHN Cc1cncc(COC[C@@]23CCC[C@@H]2CN(c2ncccc2CN2CCCC2)C3)c1 ZINC001164803626 721601669 /nfs/dbraw/zinc/60/16/69/721601669.db2.gz WIUBTNXPTKOBGX-NOZRDPDXSA-N 0 3 406.574 4.204 20 0 HIADHN CSc1cnc(N2CCC(F)(F)[C@@]3(CCN(Cc4ccccn4)C3)C2)c(C)c1 ZINC001164906112 721720289 /nfs/dbraw/zinc/72/02/89/721720289.db2.gz JYKJGYOZZDLANZ-HXUWFJFHSA-N 0 3 404.530 4.245 20 0 HIADHN Clc1ccc2ccnc(N3CC[C@@H]4CN(Cc5cccnc5)CCO[C@H]4C3)c2c1 ZINC001164981103 722110136 /nfs/dbraw/zinc/11/01/36/722110136.db2.gz SOIFAELBPRCCEG-KNQAVFIVSA-N 0 3 408.933 4.011 20 0 HIADHN COC(=O)c1ccc2ccnc(N3CCC[C@]4(CCN4Cc4cccc(F)c4)C3)c2c1 ZINC001164995557 722197980 /nfs/dbraw/zinc/19/79/80/722197980.db2.gz VJCKXXLOMLEYOD-VWLOTQADSA-N 0 3 419.500 4.405 20 0 HIADHN CCOC(=O)/C=C/c1ccc(N2CCC[C@@]3(CCN3Cc3cccc(F)c3)C2)nc1 ZINC001164995369 722204662 /nfs/dbraw/zinc/20/46/62/722204662.db2.gz MQJSIIQPJHKBMM-PVOYRIJTSA-N 0 3 409.505 4.042 20 0 HIADHN COC(=O)c1cccc2nc(N3CCC[C@]4(CCN4Cc4cccc(F)c4)C3)ccc21 ZINC001164995084 722210523 /nfs/dbraw/zinc/21/05/23/722210523.db2.gz GFQGYVOPHKXSGD-VWLOTQADSA-N 0 3 419.500 4.405 20 0 HIADHN Fc1cccc(OCc2noc([C@]3(C(F)(F)F)CCN(Cc4ccccc4)C3)n2)c1 ZINC000435990393 861268502 /nfs/dbraw/zinc/26/85/02/861268502.db2.gz BVDQMDYUABJUHZ-FQEVSTJZSA-N 0 3 421.394 4.494 20 0 HIADHN Fc1ccccc1OCc1noc([C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)n1 ZINC000436008914 861298971 /nfs/dbraw/zinc/29/89/71/861298971.db2.gz BMFDNXWIIHZWRF-HXUWFJFHSA-N 0 3 421.394 4.494 20 0 HIADHN Fc1ccc(Cn2cc(CNC3(c4ccc5c(c4)OCCO5)CCCC3)cn2)cc1 ZINC000436225203 861528149 /nfs/dbraw/zinc/52/81/49/861528149.db2.gz DVEGOSPYESOWAS-UHFFFAOYSA-N 0 3 407.489 4.401 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)CN(C)c3ccc4ccccc4c3)cc2)CC1 ZINC000007213979 845285208 /nfs/dbraw/zinc/28/52/08/845285208.db2.gz VEBRQXUFXVZOBE-UHFFFAOYSA-N 0 3 402.542 4.057 20 0 HIADHN O=C(N[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)N[C@@H]1CCN(C2CC2)C1 ZINC000436261535 861573492 /nfs/dbraw/zinc/57/34/92/861573492.db2.gz PDIMLYGDYBACIM-UKRRQHHQSA-N 0 3 409.374 4.235 20 0 HIADHN O=C(N[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)N[C@H]1CCN(C2CC2)C1 ZINC000436261536 861573826 /nfs/dbraw/zinc/57/38/26/861573826.db2.gz PDIMLYGDYBACIM-ZFWWWQNUSA-N 0 3 409.374 4.235 20 0 HIADHN COc1cc(C(=O)NCc2ccccc2CN(C)C)ccc1OCc1ccccc1 ZINC000009917171 845603644 /nfs/dbraw/zinc/60/36/44/845603644.db2.gz IZFGVRDBQKSBLV-UHFFFAOYSA-N 0 3 404.510 4.266 20 0 HIADHN C[C@H]1CCCN(S(=O)(=O)c2ccc(CNCc3cc4c(cccc4F)[nH]3)cc2)C1 ZINC000436277622 861585744 /nfs/dbraw/zinc/58/57/44/861585744.db2.gz YNDJZVQSASMLQV-INIZCTEOSA-N 0 3 415.534 4.017 20 0 HIADHN COc1ccc(CNC(=O)[C@H](C)N[C@H](c2ccc(Cl)cc2)C(C)C)cc1OC ZINC000011103624 845754477 /nfs/dbraw/zinc/75/44/77/845754477.db2.gz GJXJBXMLBBVALQ-BTYIYWSLSA-N 0 3 404.938 4.349 20 0 HIADHN O=C1c2ccccc2C(=O)N1C1CCC(NCc2csc(-c3ccco3)n2)CC1 ZINC000436298061 861604837 /nfs/dbraw/zinc/60/48/37/861604837.db2.gz YNMIIFNEPATFGI-UHFFFAOYSA-N 0 3 407.495 4.100 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cc(-c4ccc(Cl)cc4)on3)cc2)CC1 ZINC000014347817 845939892 /nfs/dbraw/zinc/93/98/92/845939892.db2.gz XRVRWOAADUFQIN-UHFFFAOYSA-N 0 3 410.905 4.389 20 0 HIADHN O=S(=O)([N-]Cc1ccccc1C[NH+]1CCCCC1)c1c(Cl)cccc1Cl ZINC000015360772 846040139 /nfs/dbraw/zinc/04/01/39/846040139.db2.gz XLRPELIDXAFTTQ-UHFFFAOYSA-N 0 3 413.370 4.458 20 0 HIADHN CN(C)[C@H](CNC(=O)COc1ccc(C2SCCCS2)cc1)c1ccccc1 ZINC000016599625 846189419 /nfs/dbraw/zinc/18/94/19/846189419.db2.gz SHQSOHLVBGOBBN-HXUWFJFHSA-N 0 3 416.612 4.353 20 0 HIADHN CC(C)CN1CCO[C@H](CNCc2cccc(NC(=O)c3ccccc3Cl)c2)C1 ZINC000017317907 846245919 /nfs/dbraw/zinc/24/59/19/846245919.db2.gz FZWIYNKWGJJEJI-HXUWFJFHSA-N 0 3 415.965 4.039 20 0 HIADHN CCOc1ccc(NC(=S)NC[C@H](c2cccc(OC)c2)N(CC)CC)cc1 ZINC000017516612 846256038 /nfs/dbraw/zinc/25/60/38/846256038.db2.gz NSZZVZDINMIQQE-OAQYLSRUSA-N 0 3 401.576 4.463 20 0 HIADHN O=C(CCN1CCN(CCc2ccccc2)CC1)Nc1cc(Cl)ccc1Cl ZINC000022200141 846544814 /nfs/dbraw/zinc/54/48/14/846544814.db2.gz CBBCLZKGBMSBJF-UHFFFAOYSA-N 0 3 406.357 4.182 20 0 HIADHN CN1CCN([C@@H](CNCc2csc(-c3ccc(F)cc3)n2)c2cccs2)CC1 ZINC000022742541 846613599 /nfs/dbraw/zinc/61/35/99/846613599.db2.gz QIRPRYQRYKOAJT-IBGZPJMESA-N 0 3 416.591 4.089 20 0 HIADHN O=S(=O)(NCC1CCN(Cc2cccs2)CC1)c1cc(Cl)ccc1Cl ZINC000023000359 846646781 /nfs/dbraw/zinc/64/67/81/846646781.db2.gz GTEAOSLKOSDLDB-UHFFFAOYSA-N 0 3 419.399 4.245 20 0 HIADHN C[C@@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000023737694 846744310 /nfs/dbraw/zinc/74/43/10/846744310.db2.gz LZKGZECADWEWJQ-XXBNENTESA-N 0 3 421.585 4.056 20 0 HIADHN CC(C)[C@H](CNC(=O)c1cccc(NC(=O)[C@@H]2C[C@@H]2C)c1)N1CCc2ccccc2C1 ZINC000024622395 846844437 /nfs/dbraw/zinc/84/44/37/846844437.db2.gz GHJJDJPGOGWXHA-GLYQVZKVSA-N 0 3 419.569 4.094 20 0 HIADHN Cc1c(C(=O)N[C@H](CN2CCCC2)c2ccccc2)cnn1-c1cccc(Cl)c1 ZINC000024984311 846899920 /nfs/dbraw/zinc/89/99/20/846899920.db2.gz RAWSXVMGPHDXOP-JOCHJYFZSA-N 0 3 408.933 4.401 20 0 HIADHN COc1ccc([C@@H]2CCCN2C[C@@H](O)COc2cccc3ccccc32)c(OC)c1 ZINC000025301214 846956524 /nfs/dbraw/zinc/95/65/24/846956524.db2.gz IVLIBZBRVCYRBP-XXBNENTESA-N 0 3 407.510 4.434 20 0 HIADHN Cc1cc(C)n(-c2ccc(C(=O)NCC(C)(C)N3CCc4ccccc4C3)cc2)n1 ZINC000025460758 846982100 /nfs/dbraw/zinc/98/21/00/846982100.db2.gz RUBMDLHRKWLPEP-UHFFFAOYSA-N 0 3 402.542 4.056 20 0 HIADHN Cc1oc(-c2ccccc2)nc1CC(=O)NC[C@@H](C(C)C)N1CCc2ccccc2C1 ZINC000025540489 846996211 /nfs/dbraw/zinc/99/62/11/846996211.db2.gz YSESBTCTGCJNBH-DEOSSOPVSA-N 0 3 417.553 4.392 20 0 HIADHN O=C(Nc1ccccc1C(=O)NC1CCN(Cc2ccccc2)CC1)c1cccs1 ZINC000025595980 847004860 /nfs/dbraw/zinc/00/48/60/847004860.db2.gz CVKRQLCHAKJEPR-UHFFFAOYSA-N 0 3 419.550 4.395 20 0 HIADHN Cn1c2ccc(C(F)(F)F)cc2nc1CNC[C@]1(O)CCC[C@@H](C(F)(F)F)C1 ZINC000436408775 861759184 /nfs/dbraw/zinc/75/91/84/861759184.db2.gz WWPPWEUCVVDULJ-WBMJQRKESA-N 0 3 409.374 4.165 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3ccc(OC(F)(F)F)cc3)c(C)c2)CC1 ZINC000026908616 847220854 /nfs/dbraw/zinc/22/08/54/847220854.db2.gz XLTQKEBNFVDUGB-UHFFFAOYSA-N 0 3 407.436 4.288 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)c3cc(F)c(F)cc3Cl)CC2)c1 ZINC000026963997 847227622 /nfs/dbraw/zinc/22/76/22/847227622.db2.gz XVSCULZIXCTTPG-UHFFFAOYSA-N 0 3 421.919 4.259 20 0 HIADHN Cc1ccc(OCc2nc(CNCC3CCN(CC(F)(F)F)CC3)cs2)cc1 ZINC000436416823 861769491 /nfs/dbraw/zinc/76/94/91/861769491.db2.gz YXTCPDHAIHMDEV-UHFFFAOYSA-N 0 3 413.509 4.394 20 0 HIADHN C[C@H](C(=O)Nc1ccc(OCc2ccccc2)cc1)N1CCN(C2CCCC2)CC1 ZINC000027118787 847250689 /nfs/dbraw/zinc/25/06/89/847250689.db2.gz MLQAYHOKDQFAIV-HXUWFJFHSA-N 0 3 407.558 4.153 20 0 HIADHN COc1cccc([C@H](CNC(=O)CCCc2c[nH]c3ccccc23)N2CCCC2)c1 ZINC000027340825 847286461 /nfs/dbraw/zinc/28/64/61/847286461.db2.gz IHHHEYYZDNZULV-DEOSSOPVSA-N 0 3 405.542 4.453 20 0 HIADHN Cc1ccccc1CN1CCCN(C(=O)c2cc(-c3ccccc3Cl)n[nH]2)CC1 ZINC000027390661 847295211 /nfs/dbraw/zinc/29/52/11/847295211.db2.gz BNEGUCVGFZQCOE-UHFFFAOYSA-N 0 3 408.933 4.387 20 0 HIADHN COc1ccc2nc(C)c(C(=O)N3CCCN(Cc4ccccc4C)CC3)cc2c1 ZINC000027389234 847295290 /nfs/dbraw/zinc/29/52/90/847295290.db2.gz HYFQUUZRYKZWBS-UHFFFAOYSA-N 0 3 403.526 4.208 20 0 HIADHN CN(C)[C@H](CNC(=O)COC(c1ccccc1)c1ccccc1)Cc1ccccc1 ZINC000027583559 847323366 /nfs/dbraw/zinc/32/33/66/847323366.db2.gz XJEJJCGJSUVFDE-DEOSSOPVSA-N 0 3 402.538 4.082 20 0 HIADHN COCc1c(C(=O)NC[C@H](Cc2ccccc2)N(C)C)sc2cccc(F)c21 ZINC000027585006 847325048 /nfs/dbraw/zinc/32/50/48/847325048.db2.gz JHWGDNHEJHHERJ-INIZCTEOSA-N 0 3 400.519 4.090 20 0 HIADHN COc1ccc(NC(C)=O)cc1NC(=O)[C@@H](C)N(C)CC12CC3CC(CC(C3)C1)C2 ZINC000027930330 847365690 /nfs/dbraw/zinc/36/56/90/847365690.db2.gz DQYUINPSEUIJGO-SZMHJPNOSA-N 0 3 413.562 4.129 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)CCCOc3ccc(C(C)=O)cc3)c(C)c2)CC1 ZINC000028731921 847453831 /nfs/dbraw/zinc/45/38/31/847453831.db2.gz WSXPXADCAFETBR-UHFFFAOYSA-N 0 3 423.557 4.137 20 0 HIADHN COc1ccc(NC(=O)[C@H](C)N[C@H](C)c2ccc(Br)cc2)cc1OC ZINC000028893870 847474300 /nfs/dbraw/zinc/47/43/00/847474300.db2.gz FAIVWXWBTKIXFJ-OLZOCXBDSA-N 0 3 407.308 4.144 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)c1ccc(Cl)c(N2CCCC2=O)c1 ZINC000029178530 847520345 /nfs/dbraw/zinc/52/03/45/847520345.db2.gz HPCAOSKZGDJXSJ-FQEVSTJZSA-N 0 3 411.933 4.034 20 0 HIADHN O=C(Cn1c2ccccc2nc1C(F)(F)F)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000029177816 847520477 /nfs/dbraw/zinc/52/04/77/847520477.db2.gz ITFWZNWWPOHAKO-SFHVURJKSA-N 0 3 416.447 4.008 20 0 HIADHN Cc1noc(C)c1COc1cccc(C(=O)N[C@H](CN2CCCC2)c2ccccc2)c1 ZINC000029177732 847520513 /nfs/dbraw/zinc/52/05/13/847520513.db2.gz PEGZJKUVRYHXHE-XMMPIXPASA-N 0 3 419.525 4.437 20 0 HIADHN C[C@H](Oc1ccc(Br)cc1)C(=O)N[C@H](CN1CCCC1)c1ccccc1 ZINC000029177983 847521013 /nfs/dbraw/zinc/52/10/13/847521013.db2.gz HDASUWDYWRVBGD-OXJNMPFZSA-N 0 3 417.347 4.170 20 0 HIADHN Cc1c(C(=O)NC[C@H](c2ccccc2)N2CCCC2)cnn1-c1ccc(Cl)cc1 ZINC000029192807 847523286 /nfs/dbraw/zinc/52/32/86/847523286.db2.gz WOAXEQYWOGJNDJ-JOCHJYFZSA-N 0 3 408.933 4.401 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)c1ccccc1SC(F)(F)F ZINC000029370680 847554245 /nfs/dbraw/zinc/55/42/45/847554245.db2.gz LJNABXWCLVGRSN-UHFFFAOYSA-N 0 3 404.523 4.390 20 0 HIADHN CC(C)C(=O)Nc1ccc(C(=O)NC[C@@H](C(C)C)N2CCc3ccccc3C2)cc1 ZINC000029666129 847599377 /nfs/dbraw/zinc/59/93/77/847599377.db2.gz JHYBUVCEYUZWOQ-QHCPKHFHSA-N 0 3 407.558 4.094 20 0 HIADHN CC(C)n1ncc2c1nc(-c1ccco1)cc2C(=O)NCc1ccccc1CN(C)C ZINC000029705432 847603578 /nfs/dbraw/zinc/60/35/78/847603578.db2.gz OJEAURPAZKMQLN-UHFFFAOYSA-N 0 3 417.513 4.264 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)COc3ccc(Cl)c(Cl)c3)c(C)c2)CC1 ZINC000029761354 847614525 /nfs/dbraw/zinc/61/45/25/847614525.db2.gz ZBQPCUZGONXBCP-UHFFFAOYSA-N 0 3 422.356 4.461 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cnn(-c4ccc(Cl)cc4)c3C)cc2)CC1 ZINC000029798857 847621422 /nfs/dbraw/zinc/62/14/22/847621422.db2.gz IXFYANPTQJKGAD-UHFFFAOYSA-N 0 3 423.948 4.228 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)c1ccc(NC(=O)c2ccccc2)cc1 ZINC000029842040 847630885 /nfs/dbraw/zinc/63/08/85/847630885.db2.gz ONPJCPCZYRGOEE-UHFFFAOYSA-N 0 3 413.521 4.117 20 0 HIADHN Cc1cccc(C(=O)N2CCCN(CCC(=O)Nc3cccc4ccccc43)CC2)c1 ZINC000029851297 847634792 /nfs/dbraw/zinc/63/47/92/847634792.db2.gz OWRRLLLPYICDSL-UHFFFAOYSA-N 0 3 415.537 4.325 20 0 HIADHN CC[C@H](CNC(=O)CCCOc1ccc(C(C)=O)cc1)N1CCc2ccccc2C1 ZINC000029912393 847649013 /nfs/dbraw/zinc/64/90/13/847649013.db2.gz QENILWDLMRWQQH-HSZRJFAPSA-N 0 3 408.542 4.001 20 0 HIADHN CC(C)Oc1ccc(S(=O)(=O)NCc2ccccc2CN(C)C)c2ccccc12 ZINC000030325111 847703642 /nfs/dbraw/zinc/70/36/42/847703642.db2.gz IKLZVQTUGSSYFP-UHFFFAOYSA-N 0 3 412.555 4.167 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3csc(Br)c3)c(C)c2)CC1 ZINC000030565415 847737509 /nfs/dbraw/zinc/73/75/09/847737509.db2.gz PFNTZXQSWOOFOY-UHFFFAOYSA-N 0 3 408.365 4.213 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Cc3nc(-c4cccs4)oc3C)cc2)CC1 ZINC000030669646 847755132 /nfs/dbraw/zinc/75/51/32/847755132.db2.gz LMNSZCOHAHZXIG-UHFFFAOYSA-N 0 3 410.543 4.035 20 0 HIADHN O=C(NCc1ccc(OC(F)(F)F)cc1)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000031040279 847813183 /nfs/dbraw/zinc/81/31/83/847813183.db2.gz AOVGSNHFNTYFIN-IBGZPJMESA-N 0 3 407.436 4.222 20 0 HIADHN CC(C)(CNC(=O)N[C@@H]1CCSc2c(F)cccc21)N1CCc2ccccc2C1 ZINC000031106555 847824221 /nfs/dbraw/zinc/82/42/21/847824221.db2.gz JDEGIFRNKYVATH-HXUWFJFHSA-N 0 3 413.562 4.499 20 0 HIADHN CN(C)Cc1ccccc1NC(=O)C[C@@H](NC(=O)c1ccccc1)c1ccccc1 ZINC000031233416 847847746 /nfs/dbraw/zinc/84/77/46/847847746.db2.gz QKQKADKEXLXOOE-HSZRJFAPSA-N 0 3 401.510 4.248 20 0 HIADHN C[C@@H](NC(=O)c1ccccc1NC(=O)CN([C@@H](C)C1CC1)C1CC1)c1ccccc1 ZINC000031654503 847923271 /nfs/dbraw/zinc/92/32/71/847923271.db2.gz WZFDQENLBWRZGD-MSOLQXFVSA-N 0 3 405.542 4.379 20 0 HIADHN Cc1ccccc1CN1CCCN(C(=O)c2ccc(OCc3cccnc3)cc2)CC1 ZINC000031765270 847944947 /nfs/dbraw/zinc/94/49/47/847944947.db2.gz RWPCDTKHUIDNIA-UHFFFAOYSA-N 0 3 415.537 4.317 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)c3cc(C)nc4ccccc43)CC2)c1 ZINC000032067333 847984765 /nfs/dbraw/zinc/98/47/65/847984765.db2.gz GQXVGZHREYFDAZ-UHFFFAOYSA-N 0 3 416.569 4.184 20 0 HIADHN CC[NH+]1CCC(n2nccc2NC(=O)c2cc(OCc3ccccc3)ccc2[O-])CC1 ZINC000436570270 861855745 /nfs/dbraw/zinc/85/57/45/861855745.db2.gz OHTQTFCYPVWJHO-UHFFFAOYSA-N 0 3 420.513 4.077 20 0 HIADHN CC[C@@H](CNC(=O)CCc1ncc(-c2ccccc2F)o1)N1CCc2ccccc2C1 ZINC000032447173 848028520 /nfs/dbraw/zinc/02/85/20/848028520.db2.gz PXDUFQVPSSBNKK-FQEVSTJZSA-N 0 3 421.516 4.366 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CC(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000032761761 848072804 /nfs/dbraw/zinc/07/28/04/848072804.db2.gz ZHILNNCVIHVJNL-OAQYLSRUSA-N 0 3 408.571 4.046 20 0 HIADHN O=C(Cc1csc(Cc2ccccc2)n1)NC[C@H](c1cccs1)N1CCCC1 ZINC000032762968 848073869 /nfs/dbraw/zinc/07/38/69/848073869.db2.gz DUPGTOPOSFBMOK-LJQANCHMSA-N 0 3 411.596 4.291 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)C1(c2ccc(Br)cc2)CC1 ZINC000032762604 848073917 /nfs/dbraw/zinc/07/39/17/848073917.db2.gz SAZMWYVZQDPHAM-QGZVFWFLSA-N 0 3 419.388 4.496 20 0 HIADHN Cc1nc(-c2ccc(C)cc2)c(CC(=O)N[C@H]2CCN(Cc3ccccc3)C2)s1 ZINC000036877031 848170545 /nfs/dbraw/zinc/17/05/45/848170545.db2.gz OOIBEBDZTQXWPO-NRFANRHFSA-N 0 3 405.567 4.360 20 0 HIADHN O[C@@H](CNCc1cc(Br)ccc1F)c1cccc(Br)c1 ZINC000041065405 848200413 /nfs/dbraw/zinc/20/04/13/848200413.db2.gz CZAIFJUEPVQDHL-HNNXBMFYSA-N 0 3 403.089 4.174 20 0 HIADHN CCn1c2ccccc2n(CC(=O)C(C#N)c2nc(-c3ccc(C)cc3)cs2)c1=O ZINC000041512584 848223612 /nfs/dbraw/zinc/22/36/12/848223612.db2.gz OPPUJKSXDDIENT-QGZVFWFLSA-N 0 3 416.506 4.131 20 0 HIADHN Cc1noc(C)c1COc1ccc(CC(=O)C(C#N)c2nc3ccccc3o2)cc1 ZINC000041546703 848229463 /nfs/dbraw/zinc/22/94/63/848229463.db2.gz NSINPHHKOVZVON-SFHVURJKSA-N 0 3 401.422 4.431 20 0 HIADHN Cc1ncsc1CN(C)C[C@@H]1CCN(C(=O)c2cc(C(C)C)c(O)cc2C)C1 ZINC000436657994 861883602 /nfs/dbraw/zinc/88/36/02/861883602.db2.gz KHTJDOUPUFKHTD-KRWDZBQOSA-N 0 3 401.576 4.183 20 0 HIADHN Cc1cc(C(=O)N2CCCN(Cc3ccccc3C)CC2)c(C)n1Cc1ccccn1 ZINC000042058714 848279702 /nfs/dbraw/zinc/27/97/02/848279702.db2.gz ZCTSKAULPHRPQJ-UHFFFAOYSA-N 0 3 416.569 4.205 20 0 HIADHN O[C@@H](COc1c(Cl)cccc1Cl)CN1CCC([C@H](O)c2ccccc2)CC1 ZINC000042635037 848334978 /nfs/dbraw/zinc/33/49/78/848334978.db2.gz XRFQUUGIZMLDRI-YLJYHZDGSA-N 0 3 410.341 4.179 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cc(C4CC4)n(C(C)(C)C)n3)c(C)c2)CC1 ZINC000042738598 848350284 /nfs/dbraw/zinc/35/02/84/848350284.db2.gz MENVTDZDNPOHDK-UHFFFAOYSA-N 0 3 409.578 4.218 20 0 HIADHN CN(Cc1ccc(Br)cc1)Cc1ccc(OCc2nccn2C)cc1 ZINC000042743585 848351037 /nfs/dbraw/zinc/35/10/37/848351037.db2.gz LIUWLIATJKLDHD-UHFFFAOYSA-N 0 3 400.320 4.394 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)N(Cc1cccs1)C[C@H]1CCCO1 ZINC000042813358 848356508 /nfs/dbraw/zinc/35/65/08/848356508.db2.gz FBJFVSQTLXIZHY-IFMALSPDSA-N 0 3 413.587 4.276 20 0 HIADHN CC(C)[C@@H](NC(=O)N1CCCN(Cc2ccccc2)CC1)c1nc2ccccc2[nH]1 ZINC000043105836 848384939 /nfs/dbraw/zinc/38/49/39/848384939.db2.gz KMDFAGHDPURIRO-JOCHJYFZSA-N 0 3 405.546 4.178 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N(C)Cc3ccccc3Cl)c(C)c2)CC1 ZINC000043522975 848435632 /nfs/dbraw/zinc/43/56/32/848435632.db2.gz WHGFHLGRUUOEGR-UHFFFAOYSA-N 0 3 400.954 4.454 20 0 HIADHN CCOc1ccc(CN(C)C(=O)Nc2ccc(N3CCN(CC)CC3)cc2C)cc1 ZINC000043523013 848436070 /nfs/dbraw/zinc/43/60/70/848436070.db2.gz YXYLCAKQTCEXTL-UHFFFAOYSA-N 0 3 410.562 4.200 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3CCC[C@H]3Cc3ccccc3)c(C)c2)CC1 ZINC000043522444 848436312 /nfs/dbraw/zinc/43/63/12/848436312.db2.gz RJYSZBZNXTUCLA-QHCPKHFHSA-N 0 3 406.574 4.376 20 0 HIADHN CCOc1ccc([C@H](C)NC(=O)Nc2ccc(N3CCN(CC)CC3)cc2C)cc1 ZINC000043522611 848436380 /nfs/dbraw/zinc/43/63/80/848436380.db2.gz RCNPMJCBTNHWIH-IBGZPJMESA-N 0 3 410.562 4.418 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1ccccc1N1CCCC1=O)c1ccsc1 ZINC000043852250 848478900 /nfs/dbraw/zinc/47/89/00/848478900.db2.gz PIEYGNFGEZKDAK-IBGZPJMESA-N 0 3 400.548 4.080 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)Nc1cc2c(cc1Cl)OCCO2 ZINC000043903774 848488847 /nfs/dbraw/zinc/48/88/47/848488847.db2.gz NHWIAWPRSSZAAH-GOSISDBHSA-N 0 3 401.894 4.070 20 0 HIADHN CC(C)(C)NC(=O)c1ccc(NC(=O)NC[C@@H](c2cccs2)N2CCCC2)cc1 ZINC000044017450 848501286 /nfs/dbraw/zinc/50/12/86/848501286.db2.gz XIYJFFYBLPWCFL-SFHVURJKSA-N 0 3 414.575 4.235 20 0 HIADHN Cc1cc(C)n(Cc2cccc(C(=O)N3c4ccccc4CC[C@@H]3CN(C)C)c2)n1 ZINC000436727455 861910205 /nfs/dbraw/zinc/91/02/05/861910205.db2.gz ZSRDQDTVYGITPE-HSZRJFAPSA-N 0 3 402.542 4.071 20 0 HIADHN CC(=O)Nc1ccc(F)c(NC(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)c1 ZINC000044078160 848511823 /nfs/dbraw/zinc/51/18/23/848511823.db2.gz LOYKBGXYUWGAGP-IBGZPJMESA-N 0 3 418.538 4.440 20 0 HIADHN Cc1cccc(NC(=S)NCCCCN2CCN(Cc3ccccc3)CC2)c1C ZINC000044238503 848535782 /nfs/dbraw/zinc/53/57/82/848535782.db2.gz FASFFSUOXNRSJN-UHFFFAOYSA-N 0 3 410.631 4.188 20 0 HIADHN Cc1ccc(NC(=O)NC(=O)[C@@H](C)N[C@@H](C)c2ccc(OC(F)F)cc2)c(C)c1 ZINC000044803497 848605976 /nfs/dbraw/zinc/60/59/76/848605976.db2.gz BSAOQJAFRCEXJZ-LSDHHAIUSA-N 0 3 405.445 4.292 20 0 HIADHN CCN(Cc1ccccc1NC(=O)NC[C@H](c1ccccc1)N1CCCC1)C(C)=O ZINC000045686167 848713480 /nfs/dbraw/zinc/71/34/80/848713480.db2.gz NBHYNICSVLBYMT-HSZRJFAPSA-N 0 3 408.546 4.014 20 0 HIADHN Cc1nn(CC(C)C)c(C)c1CC(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1 ZINC000045820291 848735011 /nfs/dbraw/zinc/73/50/11/848735011.db2.gz GHCAJMFTPIMWGR-NRFANRHFSA-N 0 3 416.635 4.349 20 0 HIADHN O=C(NCc1ccnc(Oc2ccccc2)c1)N1CCCN(Cc2ccccc2)CC1 ZINC000045997546 848769170 /nfs/dbraw/zinc/76/91/70/848769170.db2.gz NKUGBYQREAWYJF-UHFFFAOYSA-N 0 3 416.525 4.291 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)N1CCC[C@H](c2nc3ccccc3o2)C1 ZINC000046428126 848846343 /nfs/dbraw/zinc/84/63/43/848846343.db2.gz IGJUBDYMEOQWCT-NRFANRHFSA-N 0 3 418.541 4.165 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)C1(c2ccc(Br)cc2)CC1 ZINC000046917383 848959624 /nfs/dbraw/zinc/95/96/24/848959624.db2.gz XRMVOEOPWWPBIJ-HXUWFJFHSA-N 0 3 413.359 4.434 20 0 HIADHN CCc1ccccc1-n1cnnc1SCC(=O)C(C#N)c1nc2ccccc2s1 ZINC000047365355 849033730 /nfs/dbraw/zinc/03/37/30/849033730.db2.gz MXRHDZBSSKUZLC-HNNXBMFYSA-N 0 3 419.535 4.408 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N(Cc3cccc(F)c3)C3CC3)c(C)c2)CC1 ZINC000047373689 849034580 /nfs/dbraw/zinc/03/45/80/849034580.db2.gz BJJLBDSLWDHCSP-UHFFFAOYSA-N 0 3 410.537 4.473 20 0 HIADHN CCn1c(SCC(=O)Nc2cccc(CN(C)C)c2)nnc1-c1ccccc1C ZINC000047453201 849050833 /nfs/dbraw/zinc/05/08/33/849050833.db2.gz QKNUATFAXSPFDD-UHFFFAOYSA-N 0 3 409.559 4.066 20 0 HIADHN O=C(NCCCCN1CCN(c2cccc(C(F)(F)F)c2)CC1)[C@H]1CC=CCC1 ZINC000047460968 849051641 /nfs/dbraw/zinc/05/16/41/849051641.db2.gz UVGHNNPRXBSTGI-SFHVURJKSA-N 0 3 409.496 4.080 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)N[C@@H](c2ccccc2)c2ccccn2)N(C)C)cc1 ZINC000047937418 849140676 /nfs/dbraw/zinc/14/06/76/849140676.db2.gz QNAPBNRLTZTHIT-RPWUZVMVSA-N 0 3 402.542 4.336 20 0 HIADHN CCOc1ccc([C@H](C)NC(=O)NC[C@@H](c2cccs2)N2CCCC2)cc1OC ZINC000047956429 849143775 /nfs/dbraw/zinc/14/37/75/849143775.db2.gz YQLGQGKLCSFWSV-WMZOPIPTSA-N 0 3 417.575 4.353 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N[C@H](c1ccccc1)c1ccccn1 ZINC000047950487 849144094 /nfs/dbraw/zinc/14/40/94/849144094.db2.gz ACFTXAOIFKLJJM-IFMALSPDSA-N 0 3 406.555 4.369 20 0 HIADHN CCOC(=O)c1ccc(NC(=S)NC[C@@H](c2cccs2)N2CCCC2)cc1 ZINC000048037454 849152337 /nfs/dbraw/zinc/15/23/37/849152337.db2.gz AJHUXEZXRCPVAP-KRWDZBQOSA-N 0 3 403.573 4.048 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3cnn(Cc4ccccc4)c3)c(C)c2)CC1 ZINC000048056056 849156338 /nfs/dbraw/zinc/15/63/38/849156338.db2.gz RLRYHXPNKCAMQF-UHFFFAOYSA-N 0 3 418.545 4.026 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1sccc1Br)c1cccc(OC)c1 ZINC000048095222 849163464 /nfs/dbraw/zinc/16/34/64/849163464.db2.gz YWQDGVXPZKTGGQ-INIZCTEOSA-N 0 3 411.365 4.332 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)[C@@H](C)Sc2ccc(NC(C)=O)cc2)N(C)C)cc1 ZINC000048184798 849186658 /nfs/dbraw/zinc/18/66/58/849186658.db2.gz ZBGDSLRYPWVDDX-OPAMFIHVSA-N 0 3 413.587 4.107 20 0 HIADHN O=C(Nc1cccc(NC(=O)c2ccccc2)c1)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000048481405 849230632 /nfs/dbraw/zinc/23/06/32/849230632.db2.gz XSTCQEDGWCSVNM-HSZRJFAPSA-N 0 3 414.509 4.335 20 0 HIADHN Cc1nn(-c2ccc(F)cc2F)c(C)c1CNC[C@@H](c1ccco1)N1CCCC1 ZINC000048681189 849253820 /nfs/dbraw/zinc/25/38/20/849253820.db2.gz HWUQTAJWSLTPMB-NRFANRHFSA-N 0 3 400.473 4.287 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2CNCCNC(=O)c2cccs2)o1 ZINC000048715799 849259190 /nfs/dbraw/zinc/25/91/90/849259190.db2.gz ZDRGDXVXUBIQCE-UHFFFAOYSA-N 0 3 406.511 4.022 20 0 HIADHN C[C@H](NCc1ccc(OC(F)(F)F)cc1)c1ccc(OCC(=O)NC2CC2)cc1 ZINC000048744890 849262135 /nfs/dbraw/zinc/26/21/35/849262135.db2.gz JACVPSTVZYKTIT-AWEZNQCLSA-N 0 3 408.420 4.093 20 0 HIADHN Cc1cc(Cl)cc2c1OCCC[C@@H]2[NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1 ZINC000436825019 862005350 /nfs/dbraw/zinc/00/53/50/862005350.db2.gz BYEBMVGEFXCBQY-FQEVSTJZSA-N 0 3 414.933 4.462 20 0 HIADHN O=C(c1ccccc1[O-])N1CCC([NH2+][C@H]2CCSc3ccc(Cl)cc32)CC1 ZINC000436833245 862013126 /nfs/dbraw/zinc/01/31/26/862013126.db2.gz XMIAQHPNLNSUTO-SFHVURJKSA-N 0 3 402.947 4.477 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2ccc(N3CCSCC3)cc2C)N(C)C)cc1 ZINC000051648733 849497732 /nfs/dbraw/zinc/49/77/32/849497732.db2.gz RBALOYWSGGFIOA-JOCHJYFZSA-N 0 3 412.603 4.281 20 0 HIADHN CCCCN(C)C(=O)C1CCN(Cc2ccc(C(=O)Nc3ccccc3)cc2)CC1 ZINC000052186327 849559430 /nfs/dbraw/zinc/55/94/30/849559430.db2.gz WUAAWSSXBNCPCT-UHFFFAOYSA-N 0 3 407.558 4.409 20 0 HIADHN C[C@H](c1cccc(NC(=O)c2ccccc2)c1)N1CCC(C(=O)N2CCCC2)CC1 ZINC000052328015 849571692 /nfs/dbraw/zinc/57/16/92/849571692.db2.gz KSPOBZHOVRJBHT-LJQANCHMSA-N 0 3 405.542 4.334 20 0 HIADHN CC(C)(CNC(=O)c1ccc(-n2cc[nH]c2=S)cc1)N1CCc2ccccc2C1 ZINC000052530033 849592833 /nfs/dbraw/zinc/59/28/33/849592833.db2.gz JGJYPZYCMMWWNX-UHFFFAOYSA-N 0 3 406.555 4.102 20 0 HIADHN Cc1ccc(NC(=O)C2CCN(Cc3ccc(OCC(F)(F)F)cc3)CC2)nc1 ZINC000052863837 849634125 /nfs/dbraw/zinc/63/41/25/849634125.db2.gz GOKKLNJULTZBGN-UHFFFAOYSA-N 0 3 407.436 4.182 20 0 HIADHN CCN(CC)[C@H](CNC(=O)[C@@H](C)Sc1ccc(NC(C)=O)cc1)c1ccsc1 ZINC000052877958 849638503 /nfs/dbraw/zinc/63/85/03/849638503.db2.gz ZKDJWUGQVMSGHT-FOIQADDNSA-N 0 3 419.616 4.386 20 0 HIADHN CCN(Cc1cc(=O)n2cc(Br)ccc2n1)[C@H](C)c1ccc(F)cc1 ZINC000053087997 849663268 /nfs/dbraw/zinc/66/32/68/849663268.db2.gz IQGYFWXGQQURJI-CYBMUJFWSA-N 0 3 404.283 4.179 20 0 HIADHN CN(C)CCN(C(=O)COc1ccc(C2SCCCS2)cc1)C1CCCC1 ZINC000053152321 849672279 /nfs/dbraw/zinc/67/22/79/849672279.db2.gz YBNKHSXXEUIMMA-UHFFFAOYSA-N 0 3 408.633 4.267 20 0 HIADHN CC(C)CN(C(=O)c1cc(-c2ccc(Br)cc2)n[nH]1)C1CCN(C)CC1 ZINC000053222800 849681185 /nfs/dbraw/zinc/68/11/85/849681185.db2.gz RKBYOGMXWRISPX-UHFFFAOYSA-N 0 3 419.367 4.032 20 0 HIADHN CC(C)CN(C(=O)c1ccc(-c2ccc3c(c2)OCCO3)s1)C1CCN(C)CC1 ZINC000053230762 849682747 /nfs/dbraw/zinc/68/27/47/849682747.db2.gz ZWTUOTLWAMVBBS-UHFFFAOYSA-N 0 3 414.571 4.379 20 0 HIADHN O=C(c1ccccc1[O-])N1CCC([NH2+]Cc2cc(Cl)ccc2OCC2CC2)CC1 ZINC000436869511 862045787 /nfs/dbraw/zinc/04/57/87/862045787.db2.gz AYEMTYVJIGJDRY-UHFFFAOYSA-N 0 3 414.933 4.229 20 0 HIADHN CC1CCN([C@H](CNC(=O)N(C)Cc2ccc3c(c2)OCO3)c2cccs2)CC1 ZINC000053537121 849727722 /nfs/dbraw/zinc/72/77/22/849727722.db2.gz UPTCHKMIEYAYFJ-GOSISDBHSA-N 0 3 415.559 4.091 20 0 HIADHN Cc1ccc2c(CN3CCC(C(=O)Nc4ccc(Cl)cn4)CC3)cc(=O)oc2c1 ZINC000054214272 849827809 /nfs/dbraw/zinc/82/78/09/849827809.db2.gz WCOBWQDGJCOLRT-UHFFFAOYSA-N 0 3 411.889 4.001 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)Nc2cc3c(cc2Cl)OCCO3)C1 ZINC000054386602 849856630 /nfs/dbraw/zinc/85/66/30/849856630.db2.gz KDZVPHBSTIYVIQ-HOCLYGCPSA-N 0 3 401.894 4.068 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)N2CC=C(c3c[nH]c4ncccc34)CC2)C1 ZINC000054717491 849912776 /nfs/dbraw/zinc/91/27/76/849912776.db2.gz VNCKFVSDTMEWDP-RXVVDRJESA-N 0 3 415.541 4.197 20 0 HIADHN O=C(NCc1ccco1)c1cccc(CN2CCC[C@@H](C(=O)Nc3ccccc3)C2)c1 ZINC000055900416 850200734 /nfs/dbraw/zinc/20/07/34/850200734.db2.gz HNWVNTQLKQUOSV-OAQYLSRUSA-N 0 3 417.509 4.060 20 0 HIADHN CC(C)(C)CCN1CCN(CC(=O)N[C@@H](c2cccs2)c2ccc(F)cc2)CC1 ZINC000055934945 850210022 /nfs/dbraw/zinc/21/00/22/850210022.db2.gz XINVZRGGOICZIN-JOCHJYFZSA-N 0 3 417.594 4.147 20 0 HIADHN Cc1ccc(NC(=O)[C@@H](C)N2CCN(CCC(C)(C)C)CC2)c(Br)c1 ZINC000055934438 850210596 /nfs/dbraw/zinc/21/05/96/850210596.db2.gz YCFIICWEJKWDKP-MRXNPFEDSA-N 0 3 410.400 4.138 20 0 HIADHN Cc1c([O-])ccc2c(CNCc3ccccc3C[N@H+]3CCC[C@@H](C)C3)cc(=O)oc12 ZINC000056156175 850261737 /nfs/dbraw/zinc/26/17/37/850261737.db2.gz DSZBGOCTIGOPLW-QGZVFWFLSA-N 0 3 406.526 4.329 20 0 HIADHN Cc1c([O-])ccc2c(CNCc3ccccc3C[N@@H+]3CCC[C@@H](C)C3)cc(=O)oc12 ZINC000056156175 850261740 /nfs/dbraw/zinc/26/17/40/850261740.db2.gz DSZBGOCTIGOPLW-QGZVFWFLSA-N 0 3 406.526 4.329 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(NC(=O)c2ccc(F)cc2)cc1)C(=O)NCc1ccccc1 ZINC000056207207 850283688 /nfs/dbraw/zinc/28/36/88/850283688.db2.gz GFKKRYDRAPSQGV-ROUUACIJSA-N 0 3 419.500 4.434 20 0 HIADHN O=C(c1ccccc1[O-])N1CCC([NH2+][C@H](C[C@@H]2CCCO2)c2ccc(F)cc2)CC1 ZINC000436942057 862119688 /nfs/dbraw/zinc/11/96/88/862119688.db2.gz UBAPXCODZDJFCG-RBBKRZOGSA-N 0 3 412.505 4.036 20 0 HIADHN COc1ccc([C@H]([NH2+]C2CCN(C(=O)c3ccccc3[O-])CC2)c2ccccc2)cc1 ZINC000436946756 862123134 /nfs/dbraw/zinc/12/31/34/862123134.db2.gz KDYSAWOFTLDXSZ-RUZDIDTESA-N 0 3 416.521 4.385 20 0 HIADHN COc1cc(-c2noc([C@]3(C(F)(F)F)CCN(Cc4ccccc4)C3)n2)ccc1O ZINC000436950704 862128675 /nfs/dbraw/zinc/12/86/75/862128675.db2.gz OHVHQUBVGKNDDY-FQEVSTJZSA-N 0 3 419.403 4.157 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1ccc(-c2csnn2)cc1)c1ccsc1 ZINC000056787621 850482247 /nfs/dbraw/zinc/48/22/47/850482247.db2.gz QOHCWZJKKOBBNP-GOSISDBHSA-N 0 3 401.561 4.471 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)[C@H]1CCC[C@H](C(F)(F)F)C1 ZINC000057114004 850550859 /nfs/dbraw/zinc/55/08/59/850550859.db2.gz JAKGHBWGDJYQME-OALUTQOASA-N 0 3 411.512 4.074 20 0 HIADHN COc1ccccc1OCc1ccc(C(=O)N2C[C@H]3CCCN3Cc3ccccc32)o1 ZINC000057349158 850612079 /nfs/dbraw/zinc/61/20/79/850612079.db2.gz RPTWSWGVYYJELU-LJQANCHMSA-N 0 3 418.493 4.492 20 0 HIADHN Cc1ccccc1CN1CCCN(C(=O)Nc2cc(NC(=O)C3CC3)ccc2C)CC1 ZINC000057543078 850662779 /nfs/dbraw/zinc/66/27/79/850662779.db2.gz FZIUJPSIXZFVNA-UHFFFAOYSA-N 0 3 420.557 4.392 20 0 HIADHN COc1ccc(CN(CC(=O)N(C)Cc2ccc(OC)c(F)c2)[C@@H](C)C2CC2)cc1 ZINC000057602189 850677799 /nfs/dbraw/zinc/67/77/99/850677799.db2.gz DIJVPGKPAJFAKO-KRWDZBQOSA-N 0 3 414.521 4.102 20 0 HIADHN CC(=O)N1CCC(NC(=O)CN[C@H](c2ccc(C3CCCCC3)cc2)C(C)C)CC1 ZINC000057644935 850688170 /nfs/dbraw/zinc/68/81/70/850688170.db2.gz DDZNATAAPBZDRO-VWLOTQADSA-N 0 3 413.606 4.148 20 0 HIADHN COc1ccc(Br)cc1NC(=O)N(CCN(C)C)Cc1ccc(F)cc1 ZINC000057784607 850714845 /nfs/dbraw/zinc/71/48/45/850714845.db2.gz WOIRLGNXRQIFIL-UHFFFAOYSA-N 0 3 424.314 4.193 20 0 HIADHN O=C(NCCN1CCCCC1)c1ccccc1Sc1ccc(Br)cn1 ZINC000058458243 850830803 /nfs/dbraw/zinc/83/08/03/850830803.db2.gz DVIIOCFCTLEOLP-UHFFFAOYSA-N 0 3 420.376 4.211 20 0 HIADHN CC[C@@H](c1ccccc1)[C@H]1CCCN1Cc1ccc(S(=O)(=O)N2CCCC2)o1 ZINC000058523837 850845248 /nfs/dbraw/zinc/84/52/48/850845248.db2.gz DUSMQKIXNRLAKZ-LEWJYISDSA-N 0 3 402.560 4.222 20 0 HIADHN COc1cc(CN(C)C(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)ccc1SC ZINC000058572421 850859297 /nfs/dbraw/zinc/85/92/97/850859297.db2.gz MPTRQGZKSFNGPH-PXNSSMCTSA-N 0 3 413.587 4.394 20 0 HIADHN CCc1c(C(=O)NC[C@H](c2cccc(OC)c2)N(CC)CC)cnn1-c1ccccc1 ZINC000058678805 850886051 /nfs/dbraw/zinc/88/60/51/850886051.db2.gz JTFDJVZFPQLYGU-XMMPIXPASA-N 0 3 420.557 4.256 20 0 HIADHN CN(C)CCn1c2cc(NC(=O)c3ccc(Oc4ccccc4)cc3)ccc2oc1=O ZINC000058737429 850907776 /nfs/dbraw/zinc/90/77/76/850907776.db2.gz DNTBSVXOEHQEBV-UHFFFAOYSA-N 0 3 417.465 4.201 20 0 HIADHN CC(C)c1ccc(SCC(=O)Nc2ccc3oc(=O)n(CCN(C)C)c3c2)cc1 ZINC000058739406 850908813 /nfs/dbraw/zinc/90/88/13/850908813.db2.gz CLXCLJSFXJXDCN-UHFFFAOYSA-N 0 3 413.543 4.010 20 0 HIADHN COc1ccccc1-c1nc(C(=O)N(CCN(C)C)Cc2ccc(F)cc2)cs1 ZINC000058879888 850950342 /nfs/dbraw/zinc/95/03/42/850950342.db2.gz PRIRKHMWHARHFC-UHFFFAOYSA-N 0 3 413.518 4.162 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)CCCC[C@H]3CCSS3)cc2)CC1 ZINC000058954403 850968030 /nfs/dbraw/zinc/96/80/30/850968030.db2.gz LHZMCWYMDNRFEW-FQEVSTJZSA-N 0 3 407.649 4.477 20 0 HIADHN COc1ccc(-c2[nH]c3ccccc3c2CCC(=O)NCCN2CCCCC2)cc1 ZINC000058980481 850971481 /nfs/dbraw/zinc/97/14/81/850971481.db2.gz WSRREBMPVSAIOD-UHFFFAOYSA-N 0 3 405.542 4.378 20 0 HIADHN C[C@](Cc1nc2ccccc2s1)(C(=O)NCCN1CCCCC1)c1ccccc1 ZINC000059280402 850991781 /nfs/dbraw/zinc/99/17/81/850991781.db2.gz ROQFUYSUQNHTLA-XMMPIXPASA-N 0 3 407.583 4.399 20 0 HIADHN O=C(Cc1ccc(Cl)c(Cl)c1)NCCCCN1CCN(c2ccccc2)CC1 ZINC000059850386 851018567 /nfs/dbraw/zinc/01/85/67/851018567.db2.gz XPKVAFJKVIDWOE-UHFFFAOYSA-N 0 3 420.384 4.255 20 0 HIADHN CC1CCN(Cc2csc(NC(=O)[C@H]3CCCN(Cc4ccccc4)C3)n2)CC1 ZINC000059951666 851027394 /nfs/dbraw/zinc/02/73/94/851027394.db2.gz OLVBREHLUMFRHJ-FQEVSTJZSA-N 0 3 412.603 4.226 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)/C=C/c1ccc2c(c1)OCO2 ZINC000060100888 851042418 /nfs/dbraw/zinc/04/24/18/851042418.db2.gz QYSFZKHOROPDGR-UXBLZVDNSA-N 0 3 420.431 4.038 20 0 HIADHN CCN(CC)[C@H](CNC(=O)C1(c2ccc(C)c(OC)c2)CC1)c1cccc(OC)c1 ZINC000060322653 851063787 /nfs/dbraw/zinc/06/37/87/851063787.db2.gz KOGUWTIILOFCIB-JOCHJYFZSA-N 0 3 410.558 4.243 20 0 HIADHN O=C(c1cc(-c2ccco2)n(-c2cccc(Cl)c2)n1)N1CC[C@@H](N2CCCC2)C1 ZINC000060374173 851082246 /nfs/dbraw/zinc/08/22/46/851082246.db2.gz DMXQGERETKPWOW-GOSISDBHSA-N 0 3 410.905 4.096 20 0 HIADHN O=C(c1cnc(NCCCN2CCc3ccccc3C2)c(Cl)c1)N1CCCCC1 ZINC000060446352 851102268 /nfs/dbraw/zinc/10/22/68/851102268.db2.gz HXQGZHSBFAAMKF-UHFFFAOYSA-N 0 3 412.965 4.221 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2C(=O)N[C@@H]2CCN(C3CC3)C2)c(C)c1 ZINC000060470232 851110579 /nfs/dbraw/zinc/11/05/79/851110579.db2.gz BSXYIEUSIXAJMF-LJQANCHMSA-N 0 3 400.526 4.123 20 0 HIADHN O=C(Nc1cc2c(cc1Br)OCCO2)c1cccc(CN2CCCC2)c1 ZINC000060551205 851144576 /nfs/dbraw/zinc/14/45/76/851144576.db2.gz GFQROSUXHYJRHK-UHFFFAOYSA-N 0 3 417.303 4.068 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N(C)Cc2cc(Br)ccc2F)N(C)C)cc1 ZINC000060563610 851148472 /nfs/dbraw/zinc/14/84/72/851148472.db2.gz IQCJRPFABPIFBD-IBGZPJMESA-N 0 3 422.342 4.341 20 0 HIADHN COc1cc(C(=O)N2c3ccc(C)cc3[C@@H]3CN(C)CC[C@H]32)ccc1OC(F)F ZINC000060848012 851229436 /nfs/dbraw/zinc/22/94/36/851229436.db2.gz ARVYOEOXXPOGJK-FUHWJXTLSA-N 0 3 402.441 4.053 20 0 HIADHN Cn1cc(CNCc2cn(-c3ccccc3)nc2-c2ccncc2)c(-c2cccnc2)n1 ZINC000060971038 851263113 /nfs/dbraw/zinc/26/31/13/851263113.db2.gz SJSKDQWWAABERZ-UHFFFAOYSA-N 0 3 421.508 4.020 20 0 HIADHN Ic1ccccc1CNC[C@@H](c1cccs1)N1CCCC1 ZINC000061015212 851273763 /nfs/dbraw/zinc/27/37/63/851273763.db2.gz GKGJIBOHYPWGDL-INIZCTEOSA-N 0 3 412.340 4.279 20 0 HIADHN C[C@@H](NC(=O)NC[C@H](c1ccccc1)N1CCCC1)c1ccc(NC(=O)C2CC2)cc1 ZINC000061230416 851324370 /nfs/dbraw/zinc/32/43/70/851324370.db2.gz OLLLMOWPYUAIGD-WZONZLPQSA-N 0 3 420.557 4.232 20 0 HIADHN COc1cccc(C(=O)Nc2ccc(CCN3CCSCC3)cc2)c1OC(F)F ZINC000061289086 851339315 /nfs/dbraw/zinc/33/93/15/851339315.db2.gz RYXBVFNHUXFPAK-UHFFFAOYSA-N 0 3 422.497 4.140 20 0 HIADHN C[C@H]1C[C@H]1C(=O)Nc1ccc(C(=O)Nc2ccc(CCN3CCSCC3)cc2)cc1 ZINC000061287944 851340182 /nfs/dbraw/zinc/34/01/82/851340182.db2.gz MMRWBXGKARXEEG-HTAPYJJXSA-N 0 3 423.582 4.125 20 0 HIADHN COc1ccc(S[C@@H](C)C(=O)Nc2ccc(CCN3CCSCC3)cc2)cc1 ZINC000061287587 851340193 /nfs/dbraw/zinc/34/01/93/851340193.db2.gz OPMLSLJEKNWEEH-KRWDZBQOSA-N 0 3 416.612 4.406 20 0 HIADHN Cc1ccc(Cn2cc(C(=O)NC3CCN(C)CC3)c(-c3ccc(C)cc3)n2)cc1 ZINC000061497896 851389007 /nfs/dbraw/zinc/38/90/07/851389007.db2.gz VAPDJNCCOGRHAP-UHFFFAOYSA-N 0 3 402.542 4.039 20 0 HIADHN CC(C)CN(CCN(C)C)C(=O)Cc1csc(-c2cccc(Br)c2)n1 ZINC000061553255 851402003 /nfs/dbraw/zinc/40/20/03/851402003.db2.gz QJHZOTFPEOMBBS-UHFFFAOYSA-N 0 3 424.408 4.161 20 0 HIADHN CC(C)OC(=O)C[C@@H](NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1)c1ccccc1 ZINC000061577580 851409381 /nfs/dbraw/zinc/40/93/81/851409381.db2.gz OOGVHBLBTJRYBA-XZOQPEGZSA-N 0 3 423.557 4.033 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)c1csc(-c2ccccn2)n1 ZINC000061637074 851418142 /nfs/dbraw/zinc/41/81/42/851418142.db2.gz KNXANZDRYYRDOY-UHFFFAOYSA-N 0 3 410.568 4.049 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2cccc(CN3CCCC3=O)c2)N2CCCC2)cc1 ZINC000061750324 851439830 /nfs/dbraw/zinc/43/98/30/851439830.db2.gz QSTGZGAVZPDFOD-QHCPKHFHSA-N 0 3 420.557 4.076 20 0 HIADHN CC(C)Oc1ccc(CNC(=O)Nc2ccc(CCN3CCSCC3)cc2)cc1 ZINC000061792343 851453859 /nfs/dbraw/zinc/45/38/59/851453859.db2.gz JRRZNVFAIRIVPJ-UHFFFAOYSA-N 0 3 413.587 4.387 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)cc1 ZINC000062378225 851535261 /nfs/dbraw/zinc/53/52/61/851535261.db2.gz GFUXAWKPTKFVGR-UHFFFAOYSA-N 0 3 422.451 4.260 20 0 HIADHN COCCOc1cc(C)ccc1NC(=O)N(CCN(C)C)Cc1cccc(Cl)c1 ZINC000062401948 851542087 /nfs/dbraw/zinc/54/20/87/851542087.db2.gz WXRNYEICRPQUQU-UHFFFAOYSA-N 0 3 419.953 4.269 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)Nc1cccc2c1OCCO2 ZINC000062405105 851543930 /nfs/dbraw/zinc/54/39/30/851543930.db2.gz ZEOUKQBQYACCDR-UHFFFAOYSA-N 0 3 423.435 4.072 20 0 HIADHN CC(C)OCCOCc1cccc(NC(=O)N2CCN(CCC(C)(C)C)CC2)c1 ZINC000062415694 851547326 /nfs/dbraw/zinc/54/73/26/851547326.db2.gz VHVGIMGFQGDCMM-UHFFFAOYSA-N 0 3 405.583 4.214 20 0 HIADHN COc1cc(Br)c(CNC[C@H](c2ccc(C)cc2)N(C)C)cc1OC ZINC000062423396 851549267 /nfs/dbraw/zinc/54/92/67/851549267.db2.gz DVFNQZLBZNCLSM-GOSISDBHSA-N 0 3 407.352 4.167 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N[C@@H](C)CCc3ccc(OC)cc3)c(C)c2)CC1 ZINC000062429473 851550561 /nfs/dbraw/zinc/55/05/61/851550561.db2.gz ZIQRVOSSBOYKSW-FQEVSTJZSA-N 0 3 424.589 4.288 20 0 HIADHN C[C@H](CCc1ccco1)NC(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1 ZINC000062475382 851558566 /nfs/dbraw/zinc/55/85/66/851558566.db2.gz VZAPUIMRULHOSA-MRXNPFEDSA-N 0 3 411.468 4.393 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)NCCCSc1ccccc1 ZINC000062474311 851558678 /nfs/dbraw/zinc/55/86/78/851558678.db2.gz NJNZRMMIUTWQAT-UHFFFAOYSA-N 0 3 407.530 4.220 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)N[C@H](c1ccco1)c1ccccc1 ZINC000062476265 851560371 /nfs/dbraw/zinc/56/03/71/851560371.db2.gz SDMGVZBWUUVONN-QFIPXVFZSA-N 0 3 413.468 4.421 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)NCc1ccc(-c2ccccc2)o1 ZINC000062498635 851566121 /nfs/dbraw/zinc/56/61/21/851566121.db2.gz LFQUFZKXOKIIHE-UHFFFAOYSA-N 0 3 413.468 4.498 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)C(=O)Nc1ccc(-c2ccccc2)cc1 ZINC000062593805 851580111 /nfs/dbraw/zinc/58/01/11/851580111.db2.gz KBCMYRMQBVQEDI-UHFFFAOYSA-N 0 3 419.500 4.022 20 0 HIADHN CC(C)C(=O)Nc1ccc(NC(=S)NC2CCN(Cc3ccccc3)CC2)cc1 ZINC000063144150 851620220 /nfs/dbraw/zinc/62/02/20/851620220.db2.gz GBQFOCMZTRNAFX-UHFFFAOYSA-N 0 3 410.587 4.232 20 0 HIADHN COc1ccc([C@@H](C)NC(=S)NC2CCN(Cc3ccccc3)CC2)cc1F ZINC000063145255 851621389 /nfs/dbraw/zinc/62/13/89/851621389.db2.gz RVSCZGZZTQEXQT-MRXNPFEDSA-N 0 3 401.551 4.024 20 0 HIADHN CCN(CCCNC(=S)NC1CCN(Cc2ccccc2)CC1)c1ccccc1 ZINC000063145376 851621625 /nfs/dbraw/zinc/62/16/25/851621625.db2.gz HVTUMRIRQPWGTD-UHFFFAOYSA-N 0 3 410.631 4.032 20 0 HIADHN CC(C)Oc1ccc(C#N)cc1NC(=S)NC1CCN(Cc2ccccc2)CC1 ZINC000063150799 851623248 /nfs/dbraw/zinc/62/32/48/851623248.db2.gz YGRZKEAWOIJUDE-UHFFFAOYSA-N 0 3 408.571 4.296 20 0 HIADHN S=C(NCc1cc(Br)cs1)NC1CCN(Cc2ccccc2)CC1 ZINC000063149518 851623454 /nfs/dbraw/zinc/62/34/54/851623454.db2.gz DKOLYRXEMSPJRL-UHFFFAOYSA-N 0 3 424.433 4.139 20 0 HIADHN Cc1cccn2cc(COc3ccc(CN[C@@H]4CCCc5c4cnn5C)cc3)nc12 ZINC000063313206 851658634 /nfs/dbraw/zinc/65/86/34/851658634.db2.gz YACYTOSWDONUNK-JOCHJYFZSA-N 0 3 401.514 4.122 20 0 HIADHN COc1ccccc1C(C)(C)CNC(=O)N(CCN(C)C)Cc1ccc(F)cc1F ZINC000063408307 851681739 /nfs/dbraw/zinc/68/17/39/851681739.db2.gz BHUNDDPVZIJLSP-UHFFFAOYSA-N 0 3 419.516 4.024 20 0 HIADHN COc1ccc2cc(CNCc3ccc(S(=O)(=O)N(C)C(C)C)cc3)ccc2c1 ZINC000063526197 851707357 /nfs/dbraw/zinc/70/73/57/851707357.db2.gz KOIKPRKDBAXWPE-UHFFFAOYSA-N 0 3 412.555 4.167 20 0 HIADHN O=C(NCCc1ccc(F)c(Br)c1)c1cccc(CN2CCCC2)c1 ZINC000064026928 851817513 /nfs/dbraw/zinc/81/75/13/851817513.db2.gz FQANCQRVTMOVKV-UHFFFAOYSA-N 0 3 405.311 4.157 20 0 HIADHN O=C(N1CCN(CC2CCCCC2)CC1)C1(c2cccc(Cl)c2)CCOCC1 ZINC000064126020 851831739 /nfs/dbraw/zinc/83/17/39/851831739.db2.gz RBAZZLBZVMBJPU-UHFFFAOYSA-N 0 3 404.982 4.113 20 0 HIADHN Cc1ccc([C@H](CNC(=O)NCc2ccccc2N2CCCC2)N2CCCC2)cc1 ZINC000064236921 851855164 /nfs/dbraw/zinc/85/51/64/851855164.db2.gz RAPKXRPYKICLPH-DEOSSOPVSA-N 0 3 406.574 4.232 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@@H](C)NCc2cccc(CSC)c2)cc1 ZINC000437106854 862293579 /nfs/dbraw/zinc/29/35/79/862293579.db2.gz XLSRWDJXUBIAQY-QGZVFWFLSA-N 0 3 406.617 4.431 20 0 HIADHN COc1cccc(NC(=S)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)c1 ZINC000064371332 851880549 /nfs/dbraw/zinc/88/05/49/851880549.db2.gz MHVVSDWJNGKYDO-UHFFFAOYSA-N 0 3 411.493 4.475 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)NCCc1ccc(F)cc1 ZINC000064412270 851891348 /nfs/dbraw/zinc/89/13/48/851891348.db2.gz GFBFQQXHOUSMQU-UHFFFAOYSA-N 0 3 411.443 4.160 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)Nc2cccc(COC(C)C)c2)CC1 ZINC000064534521 851924550 /nfs/dbraw/zinc/92/45/50/851924550.db2.gz GDNQCPAUKJKSFA-UHFFFAOYSA-N 0 3 424.589 4.071 20 0 HIADHN CCN1CCN(Cc2ccc(CNC(=O)Nc3cccc(COC(C)C)c3)cc2)CC1 ZINC000064534519 851924571 /nfs/dbraw/zinc/92/45/71/851924571.db2.gz ISUIEJQZXDZKES-UHFFFAOYSA-N 0 3 424.589 4.071 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)c1ccn(-c2ccccc2Cl)n1 ZINC000065127830 852075226 /nfs/dbraw/zinc/07/52/26/852075226.db2.gz NJYQUHSBGXFTLU-UHFFFAOYSA-N 0 3 418.875 4.008 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(C)c1CC(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000065140346 852076313 /nfs/dbraw/zinc/07/63/13/852076313.db2.gz QUEWCEGWARHZHG-AVRDEDQJSA-N 0 3 420.532 4.122 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)Nc2ccc(OC[C@H]3CCCO3)cc2)C1 ZINC000065447902 852136497 /nfs/dbraw/zinc/13/64/97/852136497.db2.gz JEJWVQONZLZTAO-JMUQELJHSA-N 0 3 409.530 4.201 20 0 HIADHN CC(C)CC(=O)Nc1cccc(CNC(=O)N2CCN(CC3CCCCC3)CC2)c1 ZINC000065461252 852142618 /nfs/dbraw/zinc/14/26/18/852142618.db2.gz PFGUKJLQGGLKSO-UHFFFAOYSA-N 0 3 414.594 4.079 20 0 HIADHN CC[C@@H](C)C(=O)Nc1cccc(CNC(=O)N2CCN(CC3CCCCC3)CC2)c1 ZINC000065458604 852143083 /nfs/dbraw/zinc/14/30/83/852143083.db2.gz QGRWJOHCZQOKEP-LJQANCHMSA-N 0 3 414.594 4.079 20 0 HIADHN CC[C@@H](C)NC(=O)c1ccc(NC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000065459129 852143130 /nfs/dbraw/zinc/14/31/30/852143130.db2.gz FHYRNTUYIPVEJX-GCJKJVERSA-N 0 3 408.546 4.001 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N(C)Cc2ccc(N3CCCCC3)cc2)N(C)C)cc1 ZINC000065466944 852144182 /nfs/dbraw/zinc/14/41/82/852144182.db2.gz QGCZWAYZMDFIGQ-DEOSSOPVSA-N 0 3 408.590 4.430 20 0 HIADHN CCOc1ccc([C@H](C)NC(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)cc1OC ZINC000065522753 852167233 /nfs/dbraw/zinc/16/72/33/852167233.db2.gz TWOGSTZPSFASTB-UEXGIBASSA-N 0 3 411.546 4.290 20 0 HIADHN COc1cc(CNC(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)ccc1C ZINC000065543637 852171474 /nfs/dbraw/zinc/17/14/74/852171474.db2.gz FLZDDRQSQFJEBD-IBGZPJMESA-N 0 3 401.576 4.338 20 0 HIADHN C[C@@H](CNC(=O)C(=O)Nc1ccccc1Sc1ccccc1)N1CCC(C)CC1 ZINC000065601938 852196380 /nfs/dbraw/zinc/19/63/80/852196380.db2.gz FDDSCYRNVIZECZ-SFHVURJKSA-N 0 3 411.571 4.013 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NNc1cccc(C#N)c1)c1ccc(C(F)(F)F)cc1 ZINC000065696688 852223284 /nfs/dbraw/zinc/22/32/84/852223284.db2.gz MPRFPUZRHJDCDP-LJQANCHMSA-N 0 3 419.451 4.286 20 0 HIADHN CCN1CCN(c2ccccc2CNc2ccc(C(=O)NC(C)(C)CC)cc2)CC1 ZINC000437141446 862333779 /nfs/dbraw/zinc/33/37/79/862333779.db2.gz KMKQJWXBYDQLOE-UHFFFAOYSA-N 0 3 408.590 4.359 20 0 HIADHN COc1ccc([C@H]2CCCN2C(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)cc1 ZINC000065742423 852240677 /nfs/dbraw/zinc/24/06/77/852240677.db2.gz IMABYHWEVSIACR-XMMPIXPASA-N 0 3 407.558 4.203 20 0 HIADHN COc1cccc([C@@H]2CCCN2C(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)c1 ZINC000065742487 852241455 /nfs/dbraw/zinc/24/14/55/852241455.db2.gz ODMGSPRTJIQIRJ-DEOSSOPVSA-N 0 3 407.558 4.203 20 0 HIADHN COc1cccc(C[C@H]2CCCN2C(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)c1 ZINC000065874435 852297113 /nfs/dbraw/zinc/29/71/13/852297113.db2.gz ZDLJDHPOLUGIJD-JTHBVZDNSA-N 0 3 410.533 4.280 20 0 HIADHN COc1ccc(S(=O)(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)c2ccccc12 ZINC000065885917 852301941 /nfs/dbraw/zinc/30/19/41/852301941.db2.gz IULDHMKAYKXNMC-HXUWFJFHSA-N 0 3 424.566 4.039 20 0 HIADHN Cc1nc(-c2ccccn2)sc1C(=O)N(CCN(C)C)Cc1cccc(Cl)c1 ZINC000065936997 852325129 /nfs/dbraw/zinc/32/51/29/852325129.db2.gz RVRDEKRORACPIL-UHFFFAOYSA-N 0 3 414.962 4.371 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)Cc1ccc(C(F)(F)F)cc1 ZINC000065937911 852326005 /nfs/dbraw/zinc/32/60/05/852326005.db2.gz MVAAMLIDYQCDPT-UHFFFAOYSA-N 0 3 400.391 4.117 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)c1ccc(SC(F)F)cc1 ZINC000065937799 852326035 /nfs/dbraw/zinc/32/60/35/852326035.db2.gz FIIPTZQHEIATNH-UHFFFAOYSA-N 0 3 400.441 4.484 20 0 HIADHN CC(C)Oc1ncc(C(=O)N(CCN(C)C)Cc2ccc(F)cc2F)cc1Cl ZINC000065937490 852326046 /nfs/dbraw/zinc/32/60/46/852326046.db2.gz KKVBIEQSQAJHLR-UHFFFAOYSA-N 0 3 411.880 4.004 20 0 HIADHN Cc1oc(-c2ccccc2)nc1CC(=O)N(CCN(C)C)Cc1ccc(F)cc1F ZINC000065937826 852326877 /nfs/dbraw/zinc/32/68/77/852326877.db2.gz AARXWSNAJDPLKL-UHFFFAOYSA-N 0 3 413.468 4.061 20 0 HIADHN CCN(C(=S)NC1CCN(Cc2ccccc2)CC1)[C@H](C)c1ccc(C#N)cc1 ZINC000066008176 852354201 /nfs/dbraw/zinc/35/42/01/852354201.db2.gz JERLGZJNUSBSCA-LJQANCHMSA-N 0 3 406.599 4.480 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cc4ccc(OC)cc4nc3C)c(C)c2)CC1 ZINC000071812912 852410221 /nfs/dbraw/zinc/41/02/21/852410221.db2.gz POHHUTYXMPQSDI-UHFFFAOYSA-N 0 3 418.541 4.254 20 0 HIADHN COc1cccc([C@H](CNC(=O)CCOc2ccccc2Cl)N2CCCC2)c1 ZINC000071897983 852426088 /nfs/dbraw/zinc/42/60/88/852426088.db2.gz DOMYGTMHMGUUJQ-FQEVSTJZSA-N 0 3 402.922 4.071 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1ccccc1NC(=O)NC(C)C)c1ccsc1 ZINC000072008766 852463450 /nfs/dbraw/zinc/46/34/50/852463450.db2.gz DDRXSGAINWLCPJ-LJQANCHMSA-N 0 3 402.564 4.091 20 0 HIADHN CC[C@H](C)c1ccc([C@@H](NCC(=O)NC2CCC3(CC2)OCCO3)C(C)C)cc1 ZINC000072016025 852466608 /nfs/dbraw/zinc/46/66/08/852466608.db2.gz MDWKAOVGMASROF-MBSDFSHPSA-N 0 3 402.579 4.289 20 0 HIADHN CCCCNC(=O)[C@@H]1CC[C@@H](C)N(CC(=O)N[C@@H](C)c2cccc3ccccc32)C1 ZINC000072031909 852474353 /nfs/dbraw/zinc/47/43/53/852474353.db2.gz XDPBRCHUJHXAAP-SVFBPWRDSA-N 0 3 409.574 4.034 20 0 HIADHN CCOC(=O)/C=C/c1ccc(NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)cc1 ZINC000072035510 852478266 /nfs/dbraw/zinc/47/82/66/852478266.db2.gz XCONMECMQUQWSG-XEDBTPMOSA-N 0 3 410.489 4.253 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)CSc1nc2ccccc2s1 ZINC000072045718 852484619 /nfs/dbraw/zinc/48/46/19/852484619.db2.gz WHRSQYNFPIPUKK-UHFFFAOYSA-N 0 3 421.538 4.257 20 0 HIADHN C[C@H](CN1CCCCC1)NC(=O)c1ccc(Oc2ccc(Br)cc2)nc1 ZINC000078957129 852536522 /nfs/dbraw/zinc/53/65/22/852536522.db2.gz VSIDRIAVYCWSQH-OAHLLOKOSA-N 0 3 418.335 4.241 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccc(F)c2)C1)N1CCN(c2cccc(Cl)c2)CC1 ZINC000096626729 852552632 /nfs/dbraw/zinc/55/26/32/852552632.db2.gz FVVGIBZHQXENGH-LJQANCHMSA-N 0 3 415.940 4.040 20 0 HIADHN Cc1cc(C(=O)NCC(C)(C)N2CCc3ccccc3C2)c(C)n1Cc1ccccn1 ZINC000097286084 852596485 /nfs/dbraw/zinc/59/64/85/852596485.db2.gz OBHMUYJSHGLDIL-UHFFFAOYSA-N 0 3 416.569 4.115 20 0 HIADHN O[C@@H](CNCc1ccc(OCc2ccccc2)c(Br)c1)c1ccco1 ZINC000097287511 852597824 /nfs/dbraw/zinc/59/78/24/852597824.db2.gz YNLVHMCJVKBSOG-SFHVURJKSA-N 0 3 402.288 4.444 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cc(C)ccc1N1CCCC1)c1cccc(OC)c1 ZINC000097573917 852635360 /nfs/dbraw/zinc/63/53/60/852635360.db2.gz XYGYYYCIPWOZII-XMMPIXPASA-N 0 3 409.574 4.417 20 0 HIADHN C[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)NCC1(N2CCSCC2)CCCC1 ZINC000097592658 852640415 /nfs/dbraw/zinc/64/04/15/852640415.db2.gz IORONZDWXCGHKF-INIZCTEOSA-N 0 3 414.537 4.362 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)CSc1ccc(F)c(F)c1)c1cccc(OC)c1 ZINC000105289437 852696741 /nfs/dbraw/zinc/69/67/41/852696741.db2.gz NHNWHVRFPRRJNB-FQEVSTJZSA-N 0 3 408.514 4.265 20 0 HIADHN C[C@@H](C(=O)Nc1ccccc1C(F)(F)F)N1CCCN(Cc2ccccc2)CC1 ZINC000105523856 852710536 /nfs/dbraw/zinc/71/05/36/852710536.db2.gz OKIBDDOHMWCUQT-KRWDZBQOSA-N 0 3 405.464 4.240 20 0 HIADHN Cc1nn(C)c2nc(-c3cccs3)cc(C(=O)NC[C@H](c3ccccc3)N(C)C)c12 ZINC000105597265 852716189 /nfs/dbraw/zinc/71/61/89/852716189.db2.gz PUJDXPJSTLHIHB-LJQANCHMSA-N 0 3 419.554 4.038 20 0 HIADHN C[C@H]1CCCN(CCNC(=O)c2cnn(-c3cccc(C(F)(F)F)c3)c2C2CC2)C1 ZINC000107632027 852783421 /nfs/dbraw/zinc/78/34/21/852783421.db2.gz FBNVPQQFCGBJSH-HNNXBMFYSA-N 0 3 420.479 4.230 20 0 HIADHN O=C(NCCCCN1CCN(Cc2ccccc2)CC1)c1ccc(Cl)cc1Cl ZINC000108483059 852854702 /nfs/dbraw/zinc/85/47/02/852854702.db2.gz HZRQDUHGBWMILE-UHFFFAOYSA-N 0 3 420.384 4.321 20 0 HIADHN O=C(Nc1ccc(I)cc1)c1cccc(CN2CCCC2)c1 ZINC000108704046 852874168 /nfs/dbraw/zinc/87/41/68/852874168.db2.gz FKUYBHJGERATTA-UHFFFAOYSA-N 0 3 406.267 4.139 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)c2cccc(OCc3cscn3)c2)C1 ZINC000108817922 852882565 /nfs/dbraw/zinc/88/25/65/852882565.db2.gz SRDOVEOYYDZASV-PXNSSMCTSA-N 0 3 407.539 4.287 20 0 HIADHN Cc1ccc(C)c(OC2CCN(C(=O)N[C@H]3CCN(Cc4ccccc4)C3)CC2)c1 ZINC000108921104 852892086 /nfs/dbraw/zinc/89/20/86/852892086.db2.gz YSPBJFKFRMCTHE-QFIPXVFZSA-N 0 3 407.558 4.131 20 0 HIADHN COc1ccccc1[C@H](CNC(=O)[C@@H]1CCCN1Cc1ccccc1)N1CCCCC1 ZINC000108934210 852895552 /nfs/dbraw/zinc/89/55/52/852895552.db2.gz DXTZVTYDYJYJJM-ZEQRLZLVSA-N 0 3 421.585 4.003 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2ccc(NC(=O)c3ccccc3)cc2)N(C)C)cc1 ZINC000109289018 852947359 /nfs/dbraw/zinc/94/73/59/852947359.db2.gz SOXVMXPFFNDVSR-HSZRJFAPSA-N 0 3 401.510 4.280 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccc(F)c2)C1)N1CCn2cccc2[C@H]1c1ccccc1 ZINC000109346091 852956500 /nfs/dbraw/zinc/95/65/00/852956500.db2.gz ITNUAMSUQHNITC-RCZVLFRGSA-N 0 3 417.528 4.471 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)c1ccc2c(c1)OCCCO2 ZINC000109358643 852957590 /nfs/dbraw/zinc/95/75/90/852957590.db2.gz MYDSEEPEUAVTOH-UHFFFAOYSA-N 0 3 422.447 4.071 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)NCc3ccc(C(F)(F)F)cc3)cc2)CC1 ZINC000109490418 852975779 /nfs/dbraw/zinc/97/57/79/852975779.db2.gz HFRPJJZREBJAKK-UHFFFAOYSA-N 0 3 405.464 4.166 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)[C@@H]1C[C@@H]1c1cccc(Br)c1 ZINC000109566222 852986235 /nfs/dbraw/zinc/98/62/35/852986235.db2.gz WKJXVZRHVSTFOY-RTBURBONSA-N 0 3 419.338 4.282 20 0 HIADHN Cc1cc(C)n(Cc2cccc(C(=O)NC[C@@H](c3ccc(C)cc3)N3CCCC3)c2)n1 ZINC000109782697 853014082 /nfs/dbraw/zinc/01/40/82/853014082.db2.gz BHEOBCMLWHOESB-VWLOTQADSA-N 0 3 416.569 4.424 20 0 HIADHN Cc1[nH]ncc1CCCNC(=O)c1ccc(SCc2cn3ccccc3n2)cc1 ZINC000110012988 853046997 /nfs/dbraw/zinc/04/69/97/853046997.db2.gz KLBHBWVNYNDFGL-UHFFFAOYSA-N 0 3 405.527 4.021 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CC[C@H](c2ccc(OC)cc2)C1)c1ccsc1 ZINC000110066726 853054987 /nfs/dbraw/zinc/05/49/87/853054987.db2.gz MOXHYZHWBPPNSY-GHTZIAJQSA-N 0 3 401.576 4.339 20 0 HIADHN Cc1cc(C)n(-c2ccc(C(=O)N3CCCN(CCCc4ccccc4)CC3)cc2)n1 ZINC000110196298 853071369 /nfs/dbraw/zinc/07/13/69/853071369.db2.gz MTCNJPRDGFHRTF-UHFFFAOYSA-N 0 3 416.569 4.270 20 0 HIADHN CCOc1ccc(-c2nc(CN3CCC(CCN4CCOCC4)CC3)cs2)cc1 ZINC000110243556 853080121 /nfs/dbraw/zinc/08/01/21/853080121.db2.gz QNPUGLQKNFURHX-UHFFFAOYSA-N 0 3 415.603 4.143 20 0 HIADHN CCCN(CC(=O)Nc1ccccc1OCC)C1CCN(C(=O)c2ccccc2)CC1 ZINC000110295131 853084783 /nfs/dbraw/zinc/08/47/83/853084783.db2.gz ZXGLNINOIFJTDQ-UHFFFAOYSA-N 0 3 423.557 4.041 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)CCc3ccc(-c4ccccc4)o3)CC2)C[C@H](C)O1 ZINC000110411511 853096582 /nfs/dbraw/zinc/09/65/82/853096582.db2.gz HUPRUJWEDDOEGC-PMACEKPBSA-N 0 3 410.558 4.227 20 0 HIADHN CC(C)Cn1cc(C(=O)N2CCC(CN3C[C@@H](C)O[C@H](C)C3)CC2)c2ccccc21 ZINC000110417430 853097686 /nfs/dbraw/zinc/09/76/86/853097686.db2.gz SBVSAUZTFQZKCL-WOJBJXKFSA-N 0 3 411.590 4.259 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)CCc3ccc(Cl)cc3Cl)CC2)C[C@H](C)O1 ZINC000110453829 853101137 /nfs/dbraw/zinc/10/11/37/853101137.db2.gz JSJOQSRKJXAHOB-HOTGVXAUSA-N 0 3 413.389 4.274 20 0 HIADHN Cc1ccc(SCCC(=O)N2CCC(CN3C[C@@H](C)O[C@H](C)C3)CC2)cc1C ZINC000110452075 853101215 /nfs/dbraw/zinc/10/12/15/853101215.db2.gz ASCVLOXBZDLGCT-WOJBJXKFSA-N 0 3 404.620 4.133 20 0 HIADHN Cc1ccc(-c2nc(C(=O)N3CCC(CN4C[C@H](C)O[C@@H](C)C4)CC3)cs2)cc1 ZINC000110456177 853102306 /nfs/dbraw/zinc/10/23/06/853102306.db2.gz RAMVRISFWQGXDC-ROUUACIJSA-N 0 3 413.587 4.080 20 0 HIADHN Cc1nc(-c2cccs2)sc1C(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000110459905 853102327 /nfs/dbraw/zinc/10/23/27/853102327.db2.gz BYAFDJPDEWPEME-HUUCEWRRSA-N 0 3 419.616 4.141 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)c3ccc(COc4ccccc4)cc3)CC2)C[C@H](C)O1 ZINC000110454984 853102425 /nfs/dbraw/zinc/10/24/25/853102425.db2.gz WUVLAOHNNLQXID-SFTDATJTSA-N 0 3 422.569 4.227 20 0 HIADHN C[C@@H](Sc1ccc(Cl)cc1)C(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000110456402 853102438 /nfs/dbraw/zinc/10/24/38/853102438.db2.gz OTPQADYYPKXQKG-BRWVUGGUSA-N 0 3 411.011 4.168 20 0 HIADHN Cc1nc(CC(C)C)sc1C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000110597225 853124865 /nfs/dbraw/zinc/12/48/65/853124865.db2.gz YDHPWCRJHLGLDD-UHFFFAOYSA-N 0 3 403.617 4.494 20 0 HIADHN CC(C)OCCCNC(=O)C1CCN(Cc2ccccc2Oc2cccnc2)CC1 ZINC000110917191 853168650 /nfs/dbraw/zinc/16/86/50/853168650.db2.gz IOGLEBMXKDQKIG-UHFFFAOYSA-N 0 3 411.546 4.017 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)[C@@H](c1ccccc1)N1CCCCC1=O)c1ccsc1 ZINC000110934602 853170588 /nfs/dbraw/zinc/17/05/88/853170588.db2.gz BKPKKQJVXSCFTK-RBBKRZOGSA-N 0 3 413.587 4.001 20 0 HIADHN C[C@H]1Cc2ccccc2N1Cc1occc1C(=O)NCCN(C)Cc1ccccc1 ZINC000111144384 853208393 /nfs/dbraw/zinc/20/83/93/853208393.db2.gz XFHGWUQBSQLMQG-IBGZPJMESA-N 0 3 403.526 4.093 20 0 HIADHN CN(C)[C@H](CNc1ncc(C(=O)N2CCCCC2)cc1Cl)c1cccc(F)c1 ZINC000111221286 853227080 /nfs/dbraw/zinc/22/70/80/853227080.db2.gz YWEKVZVJULYDLA-LJQANCHMSA-N 0 3 404.917 4.215 20 0 HIADHN Cc1cc(C)n(Cc2ccc(C(=O)NC[C@@H](c3cccs3)N3CCCC3)cc2)n1 ZINC000139679529 853418545 /nfs/dbraw/zinc/41/85/45/853418545.db2.gz GJMWTVYCXQXQMR-NRFANRHFSA-N 0 3 408.571 4.177 20 0 HIADHN COc1ccccc1-c1cc(C(=O)NC[C@H]2CCCN(Cc3cccs3)C2)no1 ZINC000140085487 853433370 /nfs/dbraw/zinc/43/33/70/853433370.db2.gz LVKKHGHCJCEGDA-MRXNPFEDSA-N 0 3 411.527 4.054 20 0 HIADHN COC(=O)N1CCC(N[C@@H](C(=O)Nc2ccc(C)c(Cl)c2)c2ccccc2)CC1 ZINC000140588753 853448839 /nfs/dbraw/zinc/44/88/39/853448839.db2.gz QHIUGUQMODXGNK-HXUWFJFHSA-N 0 3 415.921 4.149 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2ccc(NC(=O)NC(C)C)cc2)N2CCCC2)cc1 ZINC000143044939 853507480 /nfs/dbraw/zinc/50/74/80/853507480.db2.gz APABJZXVMIRBBC-JOCHJYFZSA-N 0 3 408.546 4.092 20 0 HIADHN Cc1oc(-c2ccccc2)nc1CC(=O)NC[C@@H](c1ccc(C)cc1)N1CCCC1 ZINC000143157265 853509401 /nfs/dbraw/zinc/50/94/01/853509401.db2.gz IJPRMAVGZCSGEM-QHCPKHFHSA-N 0 3 403.526 4.454 20 0 HIADHN CC(=O)N1C=Cc2ccccc2[C@H]1CC(=O)NC[C@H](c1ccc(C)cc1)N1CCCC1 ZINC000143205403 853509604 /nfs/dbraw/zinc/50/96/04/853509604.db2.gz ZMVIAVIDTHSFQN-JWQCQUIFSA-N 0 3 417.553 4.212 20 0 HIADHN CCOc1ccc(Oc2ccc(NC(=O)NC3CCN(CCOC)CC3)cc2)cc1 ZINC000143573577 853517683 /nfs/dbraw/zinc/51/76/83/853517683.db2.gz YLBHUXFCUNGAGK-UHFFFAOYSA-N 0 3 413.518 4.110 20 0 HIADHN COc1ccc([C@@H](CNC(=O)Nc2cc(OC)ccc2Cl)N2CCCC2)cc1 ZINC000144899150 853542401 /nfs/dbraw/zinc/54/24/01/853542401.db2.gz LGLGUTOROQZURI-HXUWFJFHSA-N 0 3 403.910 4.316 20 0 HIADHN C[C@H](NC(=S)NC1CCN(Cc2ccccc2)CC1)c1cccc(OC(F)F)c1 ZINC000145595296 853553512 /nfs/dbraw/zinc/55/35/12/853553512.db2.gz WCHHQBDTIZEDRW-INIZCTEOSA-N 0 3 419.541 4.478 20 0 HIADHN COc1ccccc1N1CCC(N[C@H](C(=O)N2CCCCC2)c2ccccc2)CC1 ZINC000146708584 853575577 /nfs/dbraw/zinc/57/55/77/853575577.db2.gz BAKGQLZMFZIIQX-DEOSSOPVSA-N 0 3 407.558 4.007 20 0 HIADHN Cc1cc(C)n(Cc2ccc(C(=O)N[C@@H]3CCN([C@@H](C)c4ccccc4)C3)cc2)n1 ZINC000149911302 853633650 /nfs/dbraw/zinc/63/36/50/853633650.db2.gz SQUGHITUBINRMK-GBXCKJPGSA-N 0 3 402.542 4.114 20 0 HIADHN Cc1cc(C)n(Cc2ccc(C(=O)N[C@H]3CCN([C@@H](C)c4ccccc4)C3)cc2)n1 ZINC000149911509 853633789 /nfs/dbraw/zinc/63/37/89/853633789.db2.gz SQUGHITUBINRMK-RDPSFJRHSA-N 0 3 402.542 4.114 20 0 HIADHN COc1ccc2[nH]cc(C3CCN([C@H](C)C(=O)N4CCc5ccccc5C4)CC3)c2c1 ZINC000195653867 853739536 /nfs/dbraw/zinc/73/95/36/853739536.db2.gz IZJBECKDKHGTEH-GOSISDBHSA-N 0 3 417.553 4.329 20 0 HIADHN C[C@@H](NC[C@@H](O)COc1ccccc1F)c1cccc(NC(=O)c2ccccc2)c1 ZINC000195662309 853744759 /nfs/dbraw/zinc/74/47/59/853744759.db2.gz KRJYGCVROKUEEF-DYESRHJHSA-N 0 3 408.473 4.169 20 0 HIADHN CCOc1ccc([C@@H]2CCCN2C(=O)CN[C@@H](c2ccc(OC)cc2)C2CC2)cc1 ZINC000195667946 853747717 /nfs/dbraw/zinc/74/77/17/853747717.db2.gz QKOLFYPRNJOCCA-UKILVPOCSA-N 0 3 408.542 4.498 20 0 HIADHN Cc1ccc2c(CN3CCC(C(=O)N4CCc5ccccc54)CC3)cc(=O)oc2c1C ZINC000195685590 853757940 /nfs/dbraw/zinc/75/79/40/853757940.db2.gz IDZMZTJTWRPKBT-UHFFFAOYSA-N 0 3 416.521 4.211 20 0 HIADHN C[C@@H](N[C@@H](C)c1cccc(C(F)(F)F)c1)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000195702187 853768594 /nfs/dbraw/zinc/76/85/94/853768594.db2.gz WKPWRNUEFPQDEC-KGLIPLIRSA-N 0 3 400.466 4.368 20 0 HIADHN Cc1cc(C(=O)N(CCCc2ccccc2)CCN(C)C)c2c(n1)onc2C(C)C ZINC000195713215 853773894 /nfs/dbraw/zinc/77/38/94/853773894.db2.gz OVGMEHUMYLASTJ-UHFFFAOYSA-N 0 3 408.546 4.291 20 0 HIADHN Cc1cc(C(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)c2c(n1)onc2C(C)C ZINC000195724804 853779392 /nfs/dbraw/zinc/77/93/92/853779392.db2.gz AVAAXMBHOYKZOC-UHFFFAOYSA-N 0 3 416.472 4.137 20 0 HIADHN O=C(NCc1ccc(Br)c(F)c1)N[C@H](CN1CCCC1)c1ccccc1 ZINC000195736313 853786961 /nfs/dbraw/zinc/78/69/61/853786961.db2.gz CCONIIHCHUGXPS-LJQANCHMSA-N 0 3 420.326 4.225 20 0 HIADHN O=C(NCc1ccc(Br)c(F)c1)NC[C@H](c1ccccc1)N1CCCC1 ZINC000195740864 853788419 /nfs/dbraw/zinc/78/84/19/853788419.db2.gz IUTBQJTVPCBECJ-LJQANCHMSA-N 0 3 420.326 4.225 20 0 HIADHN Cc1cc(NC(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)n(-c2ccc(F)cc2)n1 ZINC000195742356 853789208 /nfs/dbraw/zinc/78/92/08/853789208.db2.gz ZMKYOVLRHVDALW-UHFFFAOYSA-N 0 3 421.520 4.103 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)[C@@H]2C[C@H]2c2cccc(Br)c2)CC1 ZINC000195747720 853791659 /nfs/dbraw/zinc/79/16/59/853791659.db2.gz LGGKLEFDYLZJDV-VQTJNVASSA-N 0 3 417.347 4.269 20 0 HIADHN O=C(Nc1ccccc1O)C1CCN(CCOc2ccccc2C(F)(F)F)CC1 ZINC000215884276 853839632 /nfs/dbraw/zinc/83/96/32/853839632.db2.gz QKQOKVHKSGHGSP-UHFFFAOYSA-N 0 3 408.420 4.141 20 0 HIADHN Cc1nn(Cc2ccccc2Cl)c2sc(C(=O)N(C)C3CCN(C)CC3)cc12 ZINC000216389210 853851945 /nfs/dbraw/zinc/85/19/45/853851945.db2.gz ZBCIEOXTHUPCQP-UHFFFAOYSA-N 0 3 416.978 4.274 20 0 HIADHN CCN(CC)C(=O)c1cccc(NC(=O)[C@@H](C)N[C@@H](c2ccc(OC)cc2)C2CC2)c1 ZINC000218865610 853865235 /nfs/dbraw/zinc/86/52/35/853865235.db2.gz GHHMNRARKOGERZ-UZUQRXQVSA-N 0 3 423.557 4.245 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)CCCc2nnc(-c3ccccc3)o2)C1 ZINC000227390192 853885984 /nfs/dbraw/zinc/88/59/84/853885984.db2.gz QEXRLRYJXQQPDW-GHTZIAJQSA-N 0 3 404.514 4.011 20 0 HIADHN COc1c(Br)cc(Br)cc1CNC[C@H](O)CC(C)(C)C ZINC000227373831 853886250 /nfs/dbraw/zinc/88/62/50/853886250.db2.gz ACKPAHWIFAEPOZ-GFCCVEGCSA-N 0 3 409.162 4.107 20 0 HIADHN Cc1nn(Cc2ccc(C)cc2)c(Cl)c1CNCCCc1nc(C(C)C)no1 ZINC000236631400 853905202 /nfs/dbraw/zinc/90/52/02/853905202.db2.gz XIRSKLOAZHRWFJ-UHFFFAOYSA-N 0 3 401.942 4.430 20 0 HIADHN CC(=O)Nc1cccc(OCCNCc2cc3ccccc3nc2N2CCCCC2)c1 ZINC000236639323 853906019 /nfs/dbraw/zinc/90/60/19/853906019.db2.gz RFLYIKRMKOLONC-UHFFFAOYSA-N 0 3 418.541 4.352 20 0 HIADHN CCCCOc1ccc(CNCc2ccc(C(=O)N3C[C@@H](C)O[C@@H](C)C3)cc2)cc1 ZINC000236733729 853917197 /nfs/dbraw/zinc/91/71/97/853917197.db2.gz ILVCTEIWAGTJHD-BGYRXZFFSA-N 0 3 410.558 4.405 20 0 HIADHN CCCN1CCN(c2ccccc2CNc2ccc(CN(C)C(=O)OC)cc2)CC1 ZINC000236804616 853925428 /nfs/dbraw/zinc/92/54/28/853925428.db2.gz BAAQVMBJCPEMLH-UHFFFAOYSA-N 0 3 410.562 4.029 20 0 HIADHN Cc1ccc([C@H](CNCc2cc3cnn(C(C)C)c3nc2Cl)N2CCCC2)o1 ZINC000236846030 853929025 /nfs/dbraw/zinc/92/90/25/853929025.db2.gz FQGNNIALDHIFHM-SFHVURJKSA-N 0 3 401.942 4.494 20 0 HIADHN CCOc1ccccc1CNCc1cc(C(F)(F)F)ccc1N1CCN(C)CC1 ZINC000236938777 853940430 /nfs/dbraw/zinc/94/04/30/853940430.db2.gz DNFTWKTWYJJCIB-UHFFFAOYSA-N 0 3 407.480 4.146 20 0 HIADHN CC[C@@H]1Oc2cc([C@H](C)NCc3ccc(OC(F)F)c(OC)c3)ccc2NC1=O ZINC000236976693 853945241 /nfs/dbraw/zinc/94/52/41/853945241.db2.gz NUVOHMXIFYWGHR-LRDDRELGSA-N 0 3 406.429 4.257 20 0 HIADHN CC[C@@H](C#N)Oc1cccc(C[NH2+]Cc2cc(Br)cc(OC)c2[O-])c1 ZINC000237019868 853952724 /nfs/dbraw/zinc/95/27/24/853952724.db2.gz UAFBYIXYBRIYLB-INIZCTEOSA-N 0 3 405.292 4.134 20 0 HIADHN CC(=O)N(c1nc(CN[C@@H](Cc2ccccc2)CN(C)C)cs1)c1ccc(C)cc1 ZINC000237029189 853953364 /nfs/dbraw/zinc/95/33/64/853953364.db2.gz FKSAOQDPVGDDLA-NRFANRHFSA-N 0 3 422.598 4.399 20 0 HIADHN CN(C(=O)c1ccncc1)c1ccc(CNCc2ccc(OCC(F)F)cc2)cc1 ZINC000237094467 853962803 /nfs/dbraw/zinc/96/28/03/853962803.db2.gz AEEUNXRMGSXQDU-UHFFFAOYSA-N 0 3 411.452 4.292 20 0 HIADHN COc1ccccc1CC(=O)N1CCC(NCc2csc(-c3ccccc3)n2)CC1 ZINC000237130576 853969748 /nfs/dbraw/zinc/96/97/48/853969748.db2.gz BNLVDDNOJAEFIB-UHFFFAOYSA-N 0 3 421.566 4.142 20 0 HIADHN COc1cc(CNCc2ccccc2-n2cccn2)ccc1OCc1ccncc1 ZINC000237222612 853985746 /nfs/dbraw/zinc/98/57/46/853985746.db2.gz ZXHDTJYNDGMSKA-UHFFFAOYSA-N 0 3 400.482 4.145 20 0 HIADHN CNC(=O)c1ccc(CNCc2ccc(OCc3ccc(F)cc3)c(OC)c2)cc1 ZINC000237223021 853985863 /nfs/dbraw/zinc/98/58/63/853985863.db2.gz QSJNNZSNEYUCQE-UHFFFAOYSA-N 0 3 408.473 4.063 20 0 HIADHN COc1cc(CNCc2ccc(C3OCCO3)cc2)ccc1OCc1ccncc1 ZINC000237240681 853988970 /nfs/dbraw/zinc/98/89/70/853988970.db2.gz NICUOAQSNCYDQD-UHFFFAOYSA-N 0 3 406.482 4.004 20 0 HIADHN COc1cc(CNCc2ccc3c(c2)OCCCO3)ccc1OCc1ccncc1 ZINC000237272051 853994993 /nfs/dbraw/zinc/99/49/93/853994993.db2.gz KUJDJXDAGHPMIT-UHFFFAOYSA-N 0 3 406.482 4.120 20 0 HIADHN COc1ccc(NC(=O)C[C@@H](C)N[C@H](c2ccccc2)c2ccncc2)c(OC)c1 ZINC000237292776 853999306 /nfs/dbraw/zinc/99/93/06/853999306.db2.gz JJKADRVLRHCYCP-MZNJEOGPSA-N 0 3 405.498 4.195 20 0 HIADHN COc1ccc(NC(=O)C[C@@H](C)N[C@@H]2CCSc3ccc(F)cc32)c(OC)c1 ZINC000237291726 853999642 /nfs/dbraw/zinc/99/96/42/853999642.db2.gz HISUYOJOQCKHCQ-CXAGYDPISA-N 0 3 404.507 4.387 20 0 HIADHN COc1ccc(NC(=O)C[C@H](C)N[C@H](c2nc3ccccc3[nH]2)C(C)C)c(OC)c1 ZINC000237305179 854002795 /nfs/dbraw/zinc/00/27/95/854002795.db2.gz LWCJPZLIHXKVDJ-NYHFZMIOSA-N 0 3 410.518 4.284 20 0 HIADHN COc1cc(CN2CC[C@H](NCc3ccc(CSC(F)F)o3)C2)cc(OC)c1 ZINC000237307720 854003856 /nfs/dbraw/zinc/00/38/56/854003856.db2.gz TWDBJAAVCBPRDP-HNNXBMFYSA-N 0 3 412.502 4.117 20 0 HIADHN COc1cc(CN[C@@H](C)c2cc3ccccc3s2)cc(Cl)c1OCC(N)=O ZINC000237318526 854005949 /nfs/dbraw/zinc/00/59/49/854005949.db2.gz FFNUXTFGQDOULC-LBPRGKRZSA-N 0 3 404.919 4.278 20 0 HIADHN COc1ccc([C@H](Cc2ccc(F)cc2)NCc2cnc3c(c2)c(C)nn3C)cc1 ZINC000237359097 854013868 /nfs/dbraw/zinc/01/38/68/854013868.db2.gz MFBOHIMVKYCOLE-QHCPKHFHSA-N 0 3 404.489 4.498 20 0 HIADHN COc1ccc(CN[C@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)c(OC)c1OC ZINC000237371218 854016524 /nfs/dbraw/zinc/01/65/24/854016524.db2.gz XCGQPGFXSXTPMH-SFHVURJKSA-N 0 3 424.463 4.095 20 0 HIADHN COc1cc(CN[C@@H](c2ccc3c(c2)OCCO3)C2CC2)cc(Br)c1O ZINC000237431151 854031740 /nfs/dbraw/zinc/03/17/40/854031740.db2.gz VOIMJEDROZZINV-LJQANCHMSA-N 0 3 420.303 4.175 20 0 HIADHN COc1ccc(OCc2ccccn2)c(CNC[C@H](c2cccc(F)c2)N(C)C)c1 ZINC000237436009 854033497 /nfs/dbraw/zinc/03/34/97/854033497.db2.gz RHXLPIVIEJTEGE-HSZRJFAPSA-N 0 3 409.505 4.201 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(CNCCOc3ccc(F)cc3F)c2)cc1 ZINC000237463826 854038010 /nfs/dbraw/zinc/03/80/10/854038010.db2.gz RWXYVFCBFYCYJW-UHFFFAOYSA-N 0 3 412.436 4.394 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(OCCNCc3c[nH]nc3C(C)(C)C)c2)cc1 ZINC000237475469 854041297 /nfs/dbraw/zinc/04/12/97/854041297.db2.gz KVEUPMRCEMEXGY-UHFFFAOYSA-N 0 3 422.529 4.137 20 0 HIADHN C[C@@H](C#N)Oc1ccc(CN[C@@H](Cc2ccccc2)C(=O)N(C)c2ccccc2)cc1 ZINC000237500716 854046270 /nfs/dbraw/zinc/04/62/70/854046270.db2.gz NHKWVWWPROIBCI-CPJSRVTESA-N 0 3 413.521 4.341 20 0 HIADHN CC(=O)Nc1cccc([C@H](C)NCCC(=O)Nc2ccc(Br)cc2)c1 ZINC000237544701 854052282 /nfs/dbraw/zinc/05/22/82/854052282.db2.gz ZGCBHBOJHQMXGU-ZDUSSCGKSA-N 0 3 404.308 4.087 20 0 HIADHN COc1ccc(COCCCNCc2csc(-c3ccc4c(c3)OCO4)n2)cc1 ZINC000237553358 854053584 /nfs/dbraw/zinc/05/35/84/854053584.db2.gz IYTJDFISLUZYBC-UHFFFAOYSA-N 0 3 412.511 4.244 20 0 HIADHN Cc1noc(C)c1CCNCc1cc(Br)ccc1OCc1ccccn1 ZINC000237602592 854060323 /nfs/dbraw/zinc/06/03/23/854060323.db2.gz YCGPTHPDKUVPAK-UHFFFAOYSA-N 0 3 416.319 4.360 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2CNCc2ccc(Br)s2)C[C@H](C)O1 ZINC000237621392 854063824 /nfs/dbraw/zinc/06/38/24/854063824.db2.gz DKQAKKDCOBFKPE-GASCZTMLSA-N 0 3 409.393 4.410 20 0 HIADHN Cc1nn(Cc2ccccc2)c(Cl)c1CNCCCC(=O)N1Cc2ccccc2C1 ZINC000237654685 854068548 /nfs/dbraw/zinc/06/85/48/854068548.db2.gz NWTZGZRNCRCVPJ-UHFFFAOYSA-N 0 3 422.960 4.305 20 0 HIADHN Cc1nccn1-c1ccc(CNCc2cccc(OCc3ccccc3C#N)c2)cn1 ZINC000237653099 854068565 /nfs/dbraw/zinc/06/85/65/854068565.db2.gz QWWYCQYPLBQPGV-UHFFFAOYSA-N 0 3 409.493 4.316 20 0 HIADHN Cn1nncc1CNC[C@H](c1ccc(Cl)c(Cl)c1)N1CCc2sccc2C1 ZINC000237683982 854075492 /nfs/dbraw/zinc/07/54/92/854075492.db2.gz MNAPYBVOZMHKNP-GOSISDBHSA-N 0 3 422.385 4.073 20 0 HIADHN Cc1nn(-c2ccc(Br)cc2)c(C)c1CNC[C@H](O)c1ccc(F)cc1 ZINC000237701072 854078821 /nfs/dbraw/zinc/07/88/21/854078821.db2.gz WPIMYTQYBKFVHB-FQEVSTJZSA-N 0 3 418.310 4.214 20 0 HIADHN N#Cc1ccccc1COc1cccc(CNCc2ccc(C3OCCO3)cc2)c1 ZINC000237838781 854106428 /nfs/dbraw/zinc/10/64/28/854106428.db2.gz LNDARMJUPGQUOG-UHFFFAOYSA-N 0 3 400.478 4.472 20 0 HIADHN O=C(CC1CCCC1)NCCNCc1cccc(NC(=O)c2ccccc2Cl)c1 ZINC000237859985 854109591 /nfs/dbraw/zinc/10/95/91/854109591.db2.gz CWBNZISGZFUVLF-UHFFFAOYSA-N 0 3 413.949 4.378 20 0 HIADHN Cc1nn(Cc2ccc(Cl)cc2)c(C)c1CNCc1ccnc(-n2ccnc2)c1 ZINC000237886562 854114866 /nfs/dbraw/zinc/11/48/66/854114866.db2.gz WQHNYKQZSXFMCO-UHFFFAOYSA-N 0 3 406.921 4.072 20 0 HIADHN O=C(NCCNCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1)c1cccs1 ZINC000237919653 854118915 /nfs/dbraw/zinc/11/89/15/854118915.db2.gz SENREXBXOSETJR-UHFFFAOYSA-N 0 3 420.513 4.260 20 0 HIADHN Cc1ccccc1C(=O)N[C@H](CC(C)C)C(=O)N[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000251167132 854196419 /nfs/dbraw/zinc/19/64/19/854196419.db2.gz NTXBBNJMIYUZEC-JCTONOIOSA-N 0 3 421.585 4.091 20 0 HIADHN COc1ccc([C@@H](CNC(=O)/C=C/c2ccc(OC)c(OC)c2)N2CCCCC2)cc1 ZINC000255943286 854225986 /nfs/dbraw/zinc/22/59/86/854225986.db2.gz ACYKALGACDNJPW-NGANZDCNSA-N 0 3 424.541 4.069 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3c(C)onc3-c3ccccc3)c(C)c2)CC1 ZINC000255946519 854226629 /nfs/dbraw/zinc/22/66/29/854226629.db2.gz GBYGIUNJJGEIQQ-UHFFFAOYSA-N 0 3 404.514 4.353 20 0 HIADHN CN1CCN(C[C@H](Nc2nc(-c3ccncc3)nc3ccccc32)c2ccccc2)CC1 ZINC000301148361 854311898 /nfs/dbraw/zinc/31/18/98/854311898.db2.gz IAIBEQAWKONWOB-DEOSSOPVSA-N 0 3 424.552 4.092 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(NC[C@H](c3ccc(C)cc3)[NH+]3CCCC3)nc2)n1 ZINC000301157102 854314727 /nfs/dbraw/zinc/31/47/27/854314727.db2.gz BZDFFZMACBHMJN-OAQYLSRUSA-N 0 3 403.530 4.364 20 0 HIADHN FC(F)(F)c1cc(NC[C@H](c2ccco2)N2CCCC2)nc(-c2ccncc2)n1 ZINC000301299297 854351523 /nfs/dbraw/zinc/35/15/23/854351523.db2.gz UCZXDFFSNHRGOE-OAHLLOKOSA-N 0 3 403.408 4.399 20 0 HIADHN CCO[C@@H]1C[C@H](O)C12CCN(c1c(C)c(C)nc3ccc(Br)cc31)CC2 ZINC000301395277 854381315 /nfs/dbraw/zinc/38/13/15/854381315.db2.gz LHPCAMGMEBDKRC-RBUKOAKNSA-N 0 3 419.363 4.370 20 0 HIADHN Cc1nc2ccc(Br)cc2c(N[C@H]2CCC[C@H](S(C)(=O)=O)C2)c1C ZINC000301407915 854385379 /nfs/dbraw/zinc/38/53/79/854385379.db2.gz VZPQOVXWAWKUCJ-GJZGRUSLSA-N 0 3 411.365 4.382 20 0 HIADHN Cc1ccccc1[C@@H](C)NCC(=O)Nc1ccc(I)cc1C ZINC000301504731 854408825 /nfs/dbraw/zinc/40/88/25/854408825.db2.gz BXCWWPWHODBGNG-CQSZACIVSA-N 0 3 408.283 4.197 20 0 HIADHN CC(C)c1ccc(-c2ncc(CN3CCC(C(=O)N4CCOCC4)CC3)s2)cc1 ZINC000301583341 854424402 /nfs/dbraw/zinc/42/44/02/854424402.db2.gz WWNJUIIITXSDFN-UHFFFAOYSA-N 0 3 413.587 4.004 20 0 HIADHN C[C@@H](CCN1CCN(C)CC1)Nc1ccc2cc(Br)cc(Cl)c2n1 ZINC000302238076 854555138 /nfs/dbraw/zinc/55/51/38/854555138.db2.gz GVJNLIYSEHUSBN-ZDUSSCGKSA-N 0 3 411.775 4.089 20 0 HIADHN C[N@@H+]1CC[C@@H](Nc2nc(C(F)(F)F)nc3[n-]cnc32)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000302836775 854650953 /nfs/dbraw/zinc/65/09/53/854650953.db2.gz WVUWPTVBSXRLQG-YPMHNXCESA-N 0 3 414.794 4.022 20 0 HIADHN C[N@H+]1CC[C@@H](Nc2nc(C(F)(F)F)nc3[n-]cnc32)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000302836775 854650957 /nfs/dbraw/zinc/65/09/57/854650957.db2.gz WVUWPTVBSXRLQG-YPMHNXCESA-N 0 3 414.794 4.022 20 0 HIADHN CN1CC[C@@H](Nc2nc(C(F)(F)F)nc3[nH]cnc32)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000302836775 854650960 /nfs/dbraw/zinc/65/09/60/854650960.db2.gz WVUWPTVBSXRLQG-YPMHNXCESA-N 0 3 414.794 4.022 20 0 HIADHN COCc1ccc(C(=O)Nc2ccc(N3CCN(Cc4ccccc4)CC3)cc2)o1 ZINC000302855356 854658363 /nfs/dbraw/zinc/65/83/63/854658363.db2.gz HUWLXJUJZBSFGD-UHFFFAOYSA-N 0 3 405.498 4.001 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cc([N+](=O)[O-])ccc1Cl)c1cccc(OC)c1 ZINC000302877188 854664397 /nfs/dbraw/zinc/66/43/97/854664397.db2.gz GDGMOGOTKVIACF-LJQANCHMSA-N 0 3 405.882 4.070 20 0 HIADHN CC(C)CN1CCN(CC(=O)Nc2ccc(Oc3ccccc3Cl)cc2)CC1 ZINC000302923022 854682330 /nfs/dbraw/zinc/68/23/30/854682330.db2.gz YUWOQKCQFBBHLM-UHFFFAOYSA-N 0 3 401.938 4.344 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2cccc(OC[C@H]3CCCO3)c2)N2CCCC2)cc1 ZINC000303035062 854732921 /nfs/dbraw/zinc/73/29/21/854732921.db2.gz OVBBQDOMQTWSTB-RPWUZVMVSA-N 0 3 408.542 4.120 20 0 HIADHN COCCN1CCC(NC(=O)c2cc(-c3ccccc3Cl)nc3ccccc32)CC1 ZINC000303045691 854737070 /nfs/dbraw/zinc/73/70/70/854737070.db2.gz QRMHDGTZTWTFBM-UHFFFAOYSA-N 0 3 423.944 4.396 20 0 HIADHN Cc1cc(C)n(Cc2cccc(C(=O)N[C@@H](CN3CCCC3)c3ccccc3)c2)n1 ZINC000303052633 854739372 /nfs/dbraw/zinc/73/93/72/854739372.db2.gz VVRFAPFUYJGCBH-DEOSSOPVSA-N 0 3 402.542 4.115 20 0 HIADHN Cc1noc2nc(C3CC3)cc(C(=O)NC[C@@H](c3ccc(C)cc3)N3CCCC3)c12 ZINC000303051140 854739535 /nfs/dbraw/zinc/73/95/35/854739535.db2.gz RQVRRVJRZSKKCH-NRFANRHFSA-N 0 3 404.514 4.284 20 0 HIADHN Cc1ccc([C@H](CNC(=O)[C@H]2C[C@@H]2c2ccc(Br)cc2)N(C)C)cc1 ZINC000303054710 854740220 /nfs/dbraw/zinc/74/02/20/854740220.db2.gz WIRZMEXXUYFCMI-AABGKKOBSA-N 0 3 401.348 4.280 20 0 HIADHN O=C(NCc1ccc(OCC(F)(F)F)cc1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000303077591 854750814 /nfs/dbraw/zinc/75/08/14/854750814.db2.gz SAMUOVGJMKAWAN-SFHVURJKSA-N 0 3 424.438 4.295 20 0 HIADHN COc1ccccc1CN(C)C(=O)CN(Cc1ccc2c(c1)CCO2)C1CCCC1 ZINC000303125562 854772545 /nfs/dbraw/zinc/77/25/45/854772545.db2.gz AZIDCOJDUDKEBE-UHFFFAOYSA-N 0 3 408.542 4.033 20 0 HIADHN C[C@@H]1CCCC[N@@H+]1Cc1ccc(NC(=O)[C@H]2CCCN2C(=O)c2ccccc2[O-])cc1 ZINC000303136726 854778524 /nfs/dbraw/zinc/77/85/24/854778524.db2.gz AJIXTENRAIRDPQ-XMSQKQJNSA-N 0 3 421.541 4.010 20 0 HIADHN C[C@@H]1CCCC[N@H+]1Cc1ccc(NC(=O)[C@H]2CCCN2C(=O)c2ccccc2[O-])cc1 ZINC000303136726 854778532 /nfs/dbraw/zinc/77/85/32/854778532.db2.gz AJIXTENRAIRDPQ-XMSQKQJNSA-N 0 3 421.541 4.010 20 0 HIADHN O=C(NCc1ccco1)c1cccc(CN2CCC(c3nc4ccccc4[nH]3)CC2)c1 ZINC000303450740 854949596 /nfs/dbraw/zinc/94/95/96/854949596.db2.gz IKECPWLJAJKXSK-UHFFFAOYSA-N 0 3 414.509 4.466 20 0 HIADHN CCOc1ccc(-c2nc(C)c(C(=O)N(CCN(C)C)C3CCCC3)s2)cc1 ZINC000303502800 854990913 /nfs/dbraw/zinc/99/09/13/854990913.db2.gz BXIBKALRJADSJQ-UHFFFAOYSA-N 0 3 401.576 4.464 20 0 HIADHN C[C@@H](C(=O)NCC1(c2cccc(C(F)(F)F)c2)CCOCC1)N1CCCCCC1 ZINC000303511560 854999494 /nfs/dbraw/zinc/99/94/94/854999494.db2.gz CKOGFYLNJUYPLS-KRWDZBQOSA-N 0 3 412.496 4.134 20 0 HIADHN Cc1ccc2nc(COc3cccc(C(=O)N(CCN(C)C)C4CCCC4)c3)cn2c1 ZINC000303529192 855015235 /nfs/dbraw/zinc/01/52/35/855015235.db2.gz GEPUIYMRYDRLQE-UHFFFAOYSA-N 0 3 420.557 4.168 20 0 HIADHN CCN(CC)[C@H](CNC(=O)[C@@H]1C[C@@H]1c1ccc(F)cc1F)c1cccc(OC)c1 ZINC000303554798 855036680 /nfs/dbraw/zinc/03/66/80/855036680.db2.gz WDIJHVXPVFZFJE-KCZVDYSFSA-N 0 3 402.485 4.276 20 0 HIADHN CN(C)CCN(C(=O)CSc1nnc(-c2ccc3ccccc3c2)o1)C1CCCC1 ZINC000303642897 855099027 /nfs/dbraw/zinc/09/90/27/855099027.db2.gz VUQAQTOYPNYWKV-UHFFFAOYSA-N 0 3 424.570 4.315 20 0 HIADHN C[C@H](CNC(=O)c1ccn(-c2cccc(C(F)(F)F)c2)n1)N(C)Cc1ccccc1 ZINC000303699469 855140250 /nfs/dbraw/zinc/14/02/50/855140250.db2.gz AVRAADHVQHYZEW-MRXNPFEDSA-N 0 3 416.447 4.141 20 0 HIADHN Cc1c(Cl)cccc1S(=O)(=O)N(C)[C@@H]1CCN(Cc2ccccc2)[C@@H](C)C1 ZINC000303760801 855179999 /nfs/dbraw/zinc/17/99/99/855179999.db2.gz FAWQGLZJHZHWBR-QFBILLFUSA-N 0 3 406.979 4.322 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C ZINC000303801130 855205541 /nfs/dbraw/zinc/20/55/41/855205541.db2.gz GVXDRUCQJGLHJI-HXUWFJFHSA-N 0 3 416.569 4.155 20 0 HIADHN COc1ccc2cc(NC(=O)N3CCCN(Cc4ccccc4)C[C@@H]3C)ccc2n1 ZINC000303822212 855223684 /nfs/dbraw/zinc/22/36/84/855223684.db2.gz FTWFNSFXYCPXOL-SFHVURJKSA-N 0 3 404.514 4.372 20 0 HIADHN CCc1ccccc1NC(=O)CNC(=O)CN(CC1CCC1)[C@@H](C)c1ccccc1 ZINC000303823361 855224554 /nfs/dbraw/zinc/22/45/54/855224554.db2.gz KLHMWQGKGKRORA-IBGZPJMESA-N 0 3 407.558 4.167 20 0 HIADHN C[C@H]1C[C@@H](N(C)S(=O)(=O)Cc2cccc3cccnc32)CCN1Cc1ccccc1 ZINC000303868567 855260734 /nfs/dbraw/zinc/26/07/34/855260734.db2.gz XJUOIKUEHHMDGQ-CVDCTZTESA-N 0 3 423.582 4.050 20 0 HIADHN CC(C)C(=O)N(C)Cc1ccc(C(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)cc1 ZINC000303914074 855286332 /nfs/dbraw/zinc/28/63/32/855286332.db2.gz RSBAVVGSXWFSLV-OAQYLSRUSA-N 0 3 421.585 4.038 20 0 HIADHN Cc1cc(=O)oc2cc(OCCN3CCC[C@H]3c3cccc4c3OCCO4)ccc12 ZINC000303913743 855286424 /nfs/dbraw/zinc/28/64/24/855286424.db2.gz UTOXKKRHYAALJT-FQEVSTJZSA-N 0 3 407.466 4.089 20 0 HIADHN CC(C)C(=O)Nc1ccc(Cl)c(C(=O)N(CCN(C)C)Cc2ccccc2F)c1 ZINC000303916410 855288209 /nfs/dbraw/zinc/28/82/09/855288209.db2.gz SDWRWCOEIYUMCK-UHFFFAOYSA-N 0 3 419.928 4.278 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)[C@@H]1C[C@@H]1c1cc(F)ccc1F ZINC000303928374 855297294 /nfs/dbraw/zinc/29/72/94/855297294.db2.gz UWJGKOPZPFJQOG-UYAOXDASSA-N 0 3 402.510 4.298 20 0 HIADHN CCOC(=O)Nc1ccc(NC(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)cc1 ZINC000303935030 855302264 /nfs/dbraw/zinc/30/22/64/855302264.db2.gz WHXAVJNCOCJYGJ-SFHVURJKSA-N 0 3 410.518 4.383 20 0 HIADHN CC(C)[C@H](Cc1ccccc1)C(=O)Nc1ccc(C(=O)N(C)[C@@H]2CCCN(C)C2)cc1 ZINC000303963653 855325845 /nfs/dbraw/zinc/32/58/45/855325845.db2.gz XMDOMTIKEKPACV-RPWUZVMVSA-N 0 3 421.585 4.306 20 0 HIADHN C[C@@H]1[C@H](NC(=O)c2ccc(Cl)cc2Br)CCN1Cc1ccccc1 ZINC000310326022 855366136 /nfs/dbraw/zinc/36/61/36/855366136.db2.gz YUHJMVGFAMQKGW-FZKQIMNGSA-N 0 3 407.739 4.495 20 0 HIADHN CC(C)(C)OC(=O)N1CCC(CNCc2cccc(F)c2Br)CC1 ZINC000382698910 855433732 /nfs/dbraw/zinc/43/37/32/855433732.db2.gz CJCQTHSJWYABHY-UHFFFAOYSA-N 0 3 401.320 4.325 20 0 HIADHN CCn1cc(Br)cc1C(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000388779994 855447531 /nfs/dbraw/zinc/44/75/31/855447531.db2.gz HEQDEBOTQAYKFN-SFHVURJKSA-N 0 3 404.352 4.007 20 0 HIADHN COc1ccc(Br)c(C(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000388590347 855448216 /nfs/dbraw/zinc/44/82/16/855448216.db2.gz SPVAFKDUPIZGRC-QGZVFWFLSA-N 0 3 417.347 4.194 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1ccc(Cl)cc1Br ZINC000389849653 855452810 /nfs/dbraw/zinc/45/28/10/855452810.db2.gz SSSKOQLJYDFQTJ-SCLBCKFNSA-N 0 3 407.739 4.353 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)C1(c2cncc(Br)c2)CC1)c1ccsc1 ZINC000409460753 855490318 /nfs/dbraw/zinc/49/03/18/855490318.db2.gz VNIPCNHXQNRSPL-KRWDZBQOSA-N 0 3 422.392 4.137 20 0 HIADHN CN(C)Cc1ccccc1CNC(=O)[C@@H]1C[C@]12CCc1cc(Br)ccc12 ZINC000409479601 855502279 /nfs/dbraw/zinc/50/22/79/855502279.db2.gz MNYZXBYZBNAZLN-UNMCSNQZSA-N 0 3 413.359 4.031 20 0 HIADHN O=C(NCc1ccc(-c2cccnc2)cc1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000437378529 862687282 /nfs/dbraw/zinc/68/72/82/862687282.db2.gz YKUIITJDCKWCCM-QHCPKHFHSA-N 0 3 403.501 4.416 20 0 HIADHN COc1ccccc1-n1ncc(C(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)c1C ZINC000409608295 855562864 /nfs/dbraw/zinc/56/28/64/855562864.db2.gz NJUFAVSOLRGJFD-HSZRJFAPSA-N 0 3 418.541 4.065 20 0 HIADHN Cc1ccc(NC(=O)NCCCCN2CCN(c3ccccc3)CC2)c(Cl)c1 ZINC000409703918 855610693 /nfs/dbraw/zinc/61/06/93/855610693.db2.gz WIBNZSNZLHJRKU-UHFFFAOYSA-N 0 3 400.954 4.372 20 0 HIADHN CCOc1cc2c(cc1[C@@H]1C[C@H]1C(=O)N(CCN(C)C)C1CCCCC1)O[C@H](C)C2 ZINC000409882019 855704940 /nfs/dbraw/zinc/70/49/40/855704940.db2.gz GZIFDEVYWGAGQJ-PIPMEXSNSA-N 0 3 414.590 4.235 20 0 HIADHN CN1CC[C@@H](NC(=O)C(C)(C)c2ccccc2Br)[C@@H]1c1ccccc1 ZINC000409882346 855704958 /nfs/dbraw/zinc/70/49/58/855704958.db2.gz JMQRAWVONKRWFN-MOPGFXCFSA-N 0 3 401.348 4.288 20 0 HIADHN Cc1nn(CC(C)C)c(C)c1CC(=O)N[C@@H](CN1CCc2ccccc2C1)C(C)(C)C ZINC000410051253 855801539 /nfs/dbraw/zinc/80/15/39/855801539.db2.gz GCJVRLROHNVAEL-DEOSSOPVSA-N 0 3 424.633 4.288 20 0 HIADHN CC(C)(C)[C@H](CN1CCc2ccccc2C1)NC(=O)c1ccc(N2CCCC2=O)cc1 ZINC000410055065 855803171 /nfs/dbraw/zinc/80/31/71/855803171.db2.gz UBRWONAQMJBALA-QHCPKHFHSA-N 0 3 419.569 4.016 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)N1CCC[C@@H](c2ncc3n2CCCC3)C1 ZINC000410253592 855882782 /nfs/dbraw/zinc/88/27/82/855882782.db2.gz CWEUAJHGXYGSNX-QGZVFWFLSA-N 0 3 406.530 4.047 20 0 HIADHN C[C@@H]1CN(c2ccc(CN[C@@H](Cc3cccnc3)c3cccc(Cl)c3)cn2)CCO1 ZINC000425949229 856014460 /nfs/dbraw/zinc/01/44/60/856014460.db2.gz GXHYIYGJXFQHQY-JPYJTQIMSA-N 0 3 422.960 4.429 20 0 HIADHN Cc1ccc([C@@H]2C[C@H](C)N(C(=O)NCc3ccccc3CN3CCC(O)CC3)C2)cc1 ZINC000426041625 856066621 /nfs/dbraw/zinc/06/66/21/856066621.db2.gz GNDRFGPVCGZRKN-GBXCKJPGSA-N 0 3 421.585 4.039 20 0 HIADHN CCCN(CCN1CCN(CC)CC1)C(=O)C1(c2cccc(Cl)c2)CCCC1 ZINC000426165629 856148700 /nfs/dbraw/zinc/14/87/00/856148700.db2.gz ZTZGAWHIBBSVKU-UHFFFAOYSA-N 0 3 406.014 4.028 20 0 HIADHN COc1ccc([C@H](C)CC(=O)NCCCCN2CCN(c3cccc(C)c3)CC2)cc1 ZINC000426177574 856156588 /nfs/dbraw/zinc/15/65/88/856156588.db2.gz GVFIWQPSIYJBFZ-JOCHJYFZSA-N 0 3 423.601 4.216 20 0 HIADHN Cc1cc(F)cc2c(O)c(C(=O)NC[C@H](c3ccccc3)N3CCC(C)CC3)cnc12 ZINC000426215658 856181886 /nfs/dbraw/zinc/18/18/86/856181886.db2.gz KEUYFMNHAONXAM-JOCHJYFZSA-N 0 3 421.516 4.179 20 0 HIADHN C[C@@H](CC(=O)Nc1ccc(C(=O)NCCN2CCCC2)cc1)c1c[nH]c2ccccc21 ZINC000426288217 856222816 /nfs/dbraw/zinc/22/28/16/856222816.db2.gz BAGUCBDRCNOYJY-SFHVURJKSA-N 0 3 418.541 4.126 20 0 HIADHN CS(=O)(=O)[C@@H]1CCCC[C@H]1N[C@H]1CCc2c1cc(Cl)cc2Br ZINC000426330106 856248449 /nfs/dbraw/zinc/24/84/49/856248449.db2.gz KVTVNHCSYIKGDK-ARFHVFGLSA-N 0 3 406.773 4.035 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(Cl)cc2)CC1)c1ccc(F)c(F)c1F ZINC000426483680 856315584 /nfs/dbraw/zinc/31/55/84/856315584.db2.gz QJWISMNWJXWLER-UHFFFAOYSA-N 0 3 412.839 4.031 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)N[C@H]1CCOC2(CCCCC2)C1 ZINC000426521412 856331651 /nfs/dbraw/zinc/33/16/51/856331651.db2.gz HHMIXOROKKQANE-FQEVSTJZSA-N 0 3 407.986 4.295 20 0 HIADHN CC(C)CN(CCN(C)C)C(=O)Nc1ccc(NC(=O)c2ccco2)c(Cl)c1 ZINC000426580467 856358497 /nfs/dbraw/zinc/35/84/97/856358497.db2.gz RCWHALIUHTVHDS-UHFFFAOYSA-N 0 3 406.914 4.237 20 0 HIADHN Cc1cn2c(nc(C)c2-c2noc(-c3ccc(CN4CCSCC4)cc3)n2)s1 ZINC000426614518 856374664 /nfs/dbraw/zinc/37/46/64/856374664.db2.gz CSMAJAAIRLPACH-UHFFFAOYSA-N 0 3 411.556 4.278 20 0 HIADHN CCN(C(=O)c1cc(C)nc(C(F)(F)F)n1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000426640136 856389580 /nfs/dbraw/zinc/38/95/80/856389580.db2.gz QEVJGJRQQYGGCM-DOTOQJQBSA-N 0 3 406.452 4.101 20 0 HIADHN Cc1ccc(NC(=O)[C@H](C)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)c(Cl)c1 ZINC000426789990 856479062 /nfs/dbraw/zinc/47/90/62/856479062.db2.gz ZJYMYRPGNQZVDD-QRVBRYPASA-N 0 3 422.013 4.187 20 0 HIADHN FC(F)(F)Oc1ccc(OCCN2CCC(OC[C@H]3CCCCO3)CC2)cc1 ZINC000426835881 856506297 /nfs/dbraw/zinc/50/62/97/856506297.db2.gz SVKXUWKEEOUWRQ-LJQANCHMSA-N 0 3 403.441 4.014 20 0 HIADHN Cc1ccc(-c2cc(C(=O)Nc3cccc(CN4CCC(CO)CC4)c3)n[nH]2)c(C)c1 ZINC000427164966 856683584 /nfs/dbraw/zinc/68/35/84/856683584.db2.gz ZAMMGSFPCTYXMW-UHFFFAOYSA-N 0 3 418.541 4.150 20 0 HIADHN O=C(N[C@@H]1CCOC2(CCCCC2)C1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000427266808 856744146 /nfs/dbraw/zinc/74/41/46/856744146.db2.gz VGHUXUHDHRLMGB-KNQAVFIVSA-N 0 3 424.507 4.439 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)c3ccc(Oc4ccccc4)nc3)CC2)C[C@H](C)O1 ZINC000427289613 856753667 /nfs/dbraw/zinc/75/36/67/856753667.db2.gz VWBCWTUJZPQNGZ-PMACEKPBSA-N 0 3 423.557 4.225 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)CCSc3ccccc3F)CC2)C[C@H](C)O1 ZINC000427290301 856753824 /nfs/dbraw/zinc/75/38/24/856753824.db2.gz AGRGSVZYSFYHEA-HDICACEKSA-N 0 3 408.583 4.046 20 0 HIADHN Cc1cccc2c(CCC(=O)N3CCC(CCN4C[C@H](C)O[C@@H](C)C4)CC3)c[nH]c21 ZINC000427291384 856755453 /nfs/dbraw/zinc/75/54/53/856755453.db2.gz FUEBQNNAHIXZPK-PMACEKPBSA-N 0 3 411.590 4.147 20 0 HIADHN CSc1ccc(Cl)c(C(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)c1 ZINC000427298798 856758276 /nfs/dbraw/zinc/75/82/76/856758276.db2.gz GSKSXLMUAYTSBG-HOTGVXAUSA-N 0 3 411.011 4.413 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3cc4cc(Cl)ccc4o3)CC2)C[C@H](C)O1 ZINC000427297653 856758720 /nfs/dbraw/zinc/75/87/20/856758720.db2.gz VPHVKZWASJWYMZ-IYBDPMFKSA-N 0 3 404.938 4.438 20 0 HIADHN C[C@@H]1C[C@H]1c1ccc([C@H]2C[C@H]2C(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)o1 ZINC000427320002 856768883 /nfs/dbraw/zinc/76/88/83/856768883.db2.gz JCZRMBNVMRZCAV-OHLMWPLVSA-N 0 3 414.590 4.244 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Cc3c[nH]c4cc(Cl)ccc34)CC2)C[C@H](C)O1 ZINC000427320954 856769750 /nfs/dbraw/zinc/76/97/50/856769750.db2.gz NVTJDWIPFBGKJG-CALCHBBNSA-N 0 3 417.981 4.102 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)c3ccc(Oc4cccnc4)cc3)CC2)C[C@H](C)O1 ZINC000427321955 856770168 /nfs/dbraw/zinc/77/01/68/856770168.db2.gz RUBSMIUZVKUPCT-PMACEKPBSA-N 0 3 423.557 4.225 20 0 HIADHN CCCOc1ccc(CCC(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)cc1 ZINC000427321749 856770468 /nfs/dbraw/zinc/77/04/68/856770468.db2.gz QSXIWDHAUOEZOB-OYRHEFFESA-N 0 3 416.606 4.146 20 0 HIADHN CC[C@H](Sc1ccccc1)C(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000427323291 856771255 /nfs/dbraw/zinc/77/12/55/856771255.db2.gz XBPHCENFGXOUTB-JQVVWYNYSA-N 0 3 404.620 4.295 20 0 HIADHN CC(C)[C@@H](Cc1ccccc1)C(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000427342099 856781572 /nfs/dbraw/zinc/78/15/72/856781572.db2.gz LBHWCFPJGQAEJL-ZFGGDYGUSA-N 0 3 400.607 4.239 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)[C@@H]3C[C@H]3c3c(F)cccc3Cl)CC2)C[C@@H](C)O1 ZINC000427341275 856781919 /nfs/dbraw/zinc/78/19/19/856781919.db2.gz CFJLMPNWXWLGAM-PSBWJHGTSA-N 0 3 422.972 4.321 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)CCCc3ccc(Cl)cc3)CC2)C[C@@H](C)O1 ZINC000427356520 856789734 /nfs/dbraw/zinc/78/97/34/856789734.db2.gz FWTCSNYZVVIIGO-RTBURBONSA-N 0 3 406.998 4.401 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)c1occc1Br ZINC000427370951 856798906 /nfs/dbraw/zinc/79/89/06/856798906.db2.gz XDFTUKZILQHUAP-UHFFFAOYSA-N 0 3 419.241 4.265 20 0 HIADHN C[C@@H]1CCN(C(=O)c2ccc(C(=O)NCC(C)(C)C)cc2)CCN1Cc1ccccc1 ZINC000437483141 862840790 /nfs/dbraw/zinc/84/07/90/862840790.db2.gz LFWHRUDIUZSFCB-HXUWFJFHSA-N 0 3 421.585 4.199 20 0 HIADHN Cc1cc2c(cc1C)[C@H](N[C@H](C)c1ccc(S(=O)(=O)N(C)C)cc1)CCS2 ZINC000427602907 856885373 /nfs/dbraw/zinc/88/53/73/856885373.db2.gz SCNHEWIKDUNOHO-OXQOHEQNSA-N 0 3 404.601 4.441 20 0 HIADHN C[C@H](NCC(C)(C)N1CCc2ccccc2C1)c1ncc(Br)cc1F ZINC000427615892 856888059 /nfs/dbraw/zinc/88/80/59/856888059.db2.gz RAYLZDKBKHNELS-AWEZNQCLSA-N 0 3 406.343 4.471 20 0 HIADHN CSc1ccc(S(=O)(=O)Nc2ccnc(N3CCc4ccccc4C3)c2)cc1 ZINC000427653423 856897688 /nfs/dbraw/zinc/89/76/88/856897688.db2.gz ZAHFNNPFANQYBI-UHFFFAOYSA-N 0 3 411.552 4.167 20 0 HIADHN O[C@H](C(F)F)[C@H](Cc1ccccc1)N[C@H]1CCCc2ncc(C(F)(F)F)cc21 ZINC000427687333 856908505 /nfs/dbraw/zinc/90/85/05/856908505.db2.gz VJTSYQGBWOJNID-BZSNNMDCSA-N 0 3 400.391 4.305 20 0 HIADHN C[C@@H]1C[C@H]1C(=O)Nc1cccc(C(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)c1 ZINC000437492412 862849961 /nfs/dbraw/zinc/84/99/61/862849961.db2.gz GAYHDVZOSNXHLZ-DNVFCKCGSA-N 0 3 405.542 4.018 20 0 HIADHN CCSc1cc(CN[C@@H](C)CC(=O)Nc2cccc(Br)c2)ccn1 ZINC000427846254 856978357 /nfs/dbraw/zinc/97/83/57/856978357.db2.gz RLULQZUNXRXQEX-ZDUSSCGKSA-N 0 3 408.365 4.463 20 0 HIADHN C[C@H]1CN(C2CCOCC2)CCN1C(=O)c1cn(Cc2ccccc2)c2ccccc12 ZINC000427906000 857001408 /nfs/dbraw/zinc/00/14/08/857001408.db2.gz PAHNQHFHGHPRHO-FQEVSTJZSA-N 0 3 417.553 4.015 20 0 HIADHN CN(C)Cc1cccc(NC(=O)C(=O)N(Cc2ccc(Cl)c(Cl)c2)C2CC2)c1 ZINC000437514391 862861309 /nfs/dbraw/zinc/86/13/09/862861309.db2.gz CDMXDZCWNYUFBQ-UHFFFAOYSA-N 0 3 420.340 4.185 20 0 HIADHN Cc1ccc([C@H](NC[C@H]2CCC(C)(C)O2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000427979813 857030991 /nfs/dbraw/zinc/03/09/91/857030991.db2.gz QGPQTUMOTGZNAK-DENIHFKCSA-N 0 3 401.572 4.344 20 0 HIADHN C[C@H](C(=O)NC[C@H](c1cccs1)N1CCC(C)CC1)c1ccc2c(c1)OCO2 ZINC000428006581 857038283 /nfs/dbraw/zinc/03/82/83/857038283.db2.gz PCAADJKLESDHNB-FUHWJXTLSA-N 0 3 400.544 4.170 20 0 HIADHN C[C@H](Cn1cc(Br)ccc1=O)N[C@@H]1CCSc2ccc(Cl)cc21 ZINC000428249877 857126400 /nfs/dbraw/zinc/12/64/00/857126400.db2.gz YRPZXBQAEMAIAJ-IAQYHMDHSA-N 0 3 413.768 4.479 20 0 HIADHN CC[C@@]1(O)CCN(Cc2ccc(OCCOc3ccccc3Cl)c(OC)c2)C1 ZINC000428422634 857199497 /nfs/dbraw/zinc/19/94/97/857199497.db2.gz MUOJBDXDFZUVOL-JOCHJYFZSA-N 0 3 405.922 4.153 20 0 HIADHN Cc1cccc(-c2cncc(C(=O)NC[C@@H]3CN(Cc4ccccc4)CCCO3)c2)c1 ZINC000428441736 857205064 /nfs/dbraw/zinc/20/50/64/857205064.db2.gz ILPDPHAHONVQRZ-RUZDIDTESA-N 0 3 415.537 4.078 20 0 HIADHN COc1cc(CN2CC[C@@H](O)[C@H](C)C2)ccc1OCc1ccc(Br)cc1 ZINC000428473629 857215073 /nfs/dbraw/zinc/21/50/73/857215073.db2.gz NMZCSFCIGJLHDM-DNVCBOLYSA-N 0 3 420.347 4.239 20 0 HIADHN C[C@H](c1cccc(N2CCCS2(=O)=O)c1)N(C)Cc1ccc2c(c1)CC(C)(C)O2 ZINC000428477658 857217379 /nfs/dbraw/zinc/21/73/79/857217379.db2.gz GTNAKCYKCZERIF-QGZVFWFLSA-N 0 3 414.571 4.133 20 0 HIADHN C[C@@H](c1cccc(N2CCCS2(=O)=O)c1)N(C)C/C=C/c1ccc(F)cc1F ZINC000428481413 857219742 /nfs/dbraw/zinc/21/97/42/857219742.db2.gz NJPIYOMPFDOJEQ-RRGWEWPQSA-N 0 3 406.498 4.211 20 0 HIADHN O=C(NCC(F)(F)F)[C@H]1CCN(Cc2ccc(-c3nc4ccccc4s3)o2)C1 ZINC000428485549 857222893 /nfs/dbraw/zinc/22/28/93/857222893.db2.gz SBXJQYHABKRNCA-LBPRGKRZSA-N 0 3 409.433 4.057 20 0 HIADHN CCN(CC)C(=O)c1cccc(NC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)c1 ZINC000437563314 862887444 /nfs/dbraw/zinc/88/74/44/862887444.db2.gz WWFDKMPAOLOVOI-HXUWFJFHSA-N 0 3 422.573 4.297 20 0 HIADHN CN(C(=O)c1cc(Br)c(F)cc1F)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000428527221 857240945 /nfs/dbraw/zinc/24/09/45/857240945.db2.gz KTGWAXVWQIUCAB-CQSZACIVSA-N 0 3 409.274 4.074 20 0 HIADHN COc1ccc2nc(CNC[C@H](CO)Cc3cccc(Br)c3)sc2c1 ZINC000428532135 857246302 /nfs/dbraw/zinc/24/63/02/857246302.db2.gz GTAYWYZSSPTZMF-CQSZACIVSA-N 0 3 421.360 4.008 20 0 HIADHN C[C@@H]1CCC[C@H](OCCCCCC(=O)Nc2cccc(CN3CC[C@@H](O)C3)c2)C1 ZINC000428533046 857246519 /nfs/dbraw/zinc/24/65/19/857246519.db2.gz IEIUFLFTIKJTMN-PTUXOGIPSA-N 0 3 402.579 4.347 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@@H](O)C2)c1)c1cnc2ccccc2c1C(F)(F)F ZINC000428542570 857254937 /nfs/dbraw/zinc/25/49/37/857254937.db2.gz GGHJWKKGRSHDOE-MRXNPFEDSA-N 0 3 415.415 4.073 20 0 HIADHN CCCCOc1ccc(C(=O)Nc2cccc(CN3CC[C@H](O)C3)c2)cc1OCC ZINC000428547527 857258581 /nfs/dbraw/zinc/25/85/81/857258581.db2.gz PGOYBASTUFANPJ-NRFANRHFSA-N 0 3 412.530 4.083 20 0 HIADHN Cn1c(CNC[C@]2(Cc3ccc(F)cc3)CCC[C@@H]2O)nc2ccc(Cl)cc21 ZINC000428564112 857267808 /nfs/dbraw/zinc/26/78/08/857267808.db2.gz IJXJUIZHAJUOQJ-RBBKRZOGSA-N 0 3 401.913 4.229 20 0 HIADHN CC[C@H](NC(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1)c1cc(F)ccc1F ZINC000428584413 857271993 /nfs/dbraw/zinc/27/19/93/857271993.db2.gz VKSQOVKABYIYDH-UGKGYDQZSA-N 0 3 417.500 4.006 20 0 HIADHN CCCOc1cc(O)ccc1NC(=O)Nc1ccc(N2CCN(CC)CC2)cc1C ZINC000428689251 857297230 /nfs/dbraw/zinc/29/72/30/857297230.db2.gz PXTZAKWCRVEWBV-UHFFFAOYSA-N 0 3 412.534 4.275 20 0 HIADHN Cc1cc([C@H](C)NC(=O)NC[C@@H]2CN(Cc3ccccc3)CCCO2)c(C)s1 ZINC000428691024 857298574 /nfs/dbraw/zinc/29/85/74/857298574.db2.gz GQESOYFKULOIIV-FXAWDEMLSA-N 0 3 401.576 4.016 20 0 HIADHN Clc1ccc(-n2cc(CNC[C@@H]3CCO[C@H]3c3ccccc3)nn2)cc1Cl ZINC000428695626 857300499 /nfs/dbraw/zinc/30/04/99/857300499.db2.gz XCQNKQCDNSNLDI-YWZLYKJASA-N 0 3 403.313 4.442 20 0 HIADHN COc1cccc(CN(Cc2ccncc2)[C@@H]2CCCN(Cc3ccccc3)C2)n1 ZINC000428812655 857356483 /nfs/dbraw/zinc/35/64/83/857356483.db2.gz BGBRCUUXDHIFDH-XMMPIXPASA-N 0 3 402.542 4.152 20 0 HIADHN C[C@@H](NC(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1)c1c(F)cccc1Cl ZINC000428818197 857358998 /nfs/dbraw/zinc/35/89/98/857358998.db2.gz MKGZUYGECXLBMG-AEFFLSMTSA-N 0 3 419.928 4.130 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@@H](O)C2)c1)C1(c2cc(F)cc(C(F)(F)F)c2)CC1 ZINC000428828364 857363086 /nfs/dbraw/zinc/36/30/86/857363086.db2.gz WCAVYMPJEZIBHM-LJQANCHMSA-N 0 3 422.422 4.081 20 0 HIADHN CCOc1ccccc1[C@H](C)NC(=O)N1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000428835499 857366486 /nfs/dbraw/zinc/36/64/86/857366486.db2.gz YSXJKUCJDDSQSA-UFYCRDLUSA-N 0 3 417.594 4.067 20 0 HIADHN C[C@H](C(=O)Nc1cccc(F)c1)N1CCN([C@@H]2CC[C@](C)(c3ccccc3)C2)CC1 ZINC000437590450 862903482 /nfs/dbraw/zinc/90/34/82/862903482.db2.gz MIZPCMDXPVWMDY-NIDLKEISSA-N 0 3 409.549 4.281 20 0 HIADHN C[C@H](c1ccccc1)[C@H](NCc1cn(-c2ccccc2)nc1-c1ccccc1)C(N)=O ZINC000428846144 857370489 /nfs/dbraw/zinc/37/04/89/857370489.db2.gz AVFIUNPWLQLLDQ-DVECYGJZSA-N 0 3 410.521 4.287 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)N[C@@H]3CCSc4ccccc43)CC2)C[C@H](C)O1 ZINC000428917970 857413005 /nfs/dbraw/zinc/41/30/05/857413005.db2.gz SLKMIZZJKFQYFW-LVCYWYKZSA-N 0 3 417.619 4.144 20 0 HIADHN CC(C)c1cc(C(=O)N(C)C[C@@]2(O)CCN(Cc3ccccc3)C2)c2ccccc2n1 ZINC000428959611 857435160 /nfs/dbraw/zinc/43/51/60/857435160.db2.gz YVCXLPOVPZRNSM-SANMLTNESA-N 0 3 417.553 4.067 20 0 HIADHN CO[C@H](CN[C@H](CO)c1ccc(Br)c(F)c1)c1ccc(Cl)cc1 ZINC000428992632 857447171 /nfs/dbraw/zinc/44/71/71/857447171.db2.gz KLRHICJKYBPNQO-IAGOWNOFSA-N 0 3 402.691 4.252 20 0 HIADHN CCN(Cc1ccc(Cl)s1)C(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000429005386 857452798 /nfs/dbraw/zinc/45/27/98/857452798.db2.gz GENGQIOWWKXLQU-SFHVURJKSA-N 0 3 421.994 4.224 20 0 HIADHN CC(C)COc1ccccc1NC(=O)N1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000429044723 857473538 /nfs/dbraw/zinc/47/35/38/857473538.db2.gz DSLIIKKZIGRJLS-PMACEKPBSA-N 0 3 417.594 4.465 20 0 HIADHN CCOc1ccc(NC(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)c(C)c1 ZINC000429049991 857477859 /nfs/dbraw/zinc/47/78/59/857477859.db2.gz WLSBWFDLARPTRP-KDURUIRLSA-N 0 3 403.567 4.137 20 0 HIADHN O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)Nc1cccc(-c2nccs2)c1 ZINC000429053944 857480027 /nfs/dbraw/zinc/48/00/27/857480027.db2.gz OPENFIFIYQNNSN-OAQYLSRUSA-N 0 3 422.554 4.223 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)Nc3ccc4ncsc4c3)CC2)C[C@H](C)O1 ZINC000429076211 857497167 /nfs/dbraw/zinc/49/71/67/857497167.db2.gz MMCXMFIVUQZHRO-HOTGVXAUSA-N 0 3 402.564 4.040 20 0 HIADHN O=C(NCc1cccc(NC(=O)C2CCCCC2)c1)NC[C@@H]1CCCCN1C1CC1 ZINC000429098161 857508705 /nfs/dbraw/zinc/50/87/05/857508705.db2.gz YSYHTKDAKNVSJS-QFIPXVFZSA-N 0 3 412.578 4.022 20 0 HIADHN CC(C)Oc1ccc(NC(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)cc1 ZINC000429102074 857509597 /nfs/dbraw/zinc/50/95/97/857509597.db2.gz YNIFJRZUUUAKAX-KDURUIRLSA-N 0 3 403.567 4.217 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)Nc3cccc(OC(F)F)c3)CC2)C[C@H](C)O1 ZINC000429102575 857509816 /nfs/dbraw/zinc/50/98/16/857509816.db2.gz AJPQMPQKCPNZIN-HOTGVXAUSA-N 0 3 411.493 4.031 20 0 HIADHN CC(=O)N1CCC(N(CCCOc2ccc(C)c(C)c2)Cc2cncs2)CC1 ZINC000429148881 857532510 /nfs/dbraw/zinc/53/25/10/857532510.db2.gz DPIUCWKBANSRCL-UHFFFAOYSA-N 0 3 401.576 4.042 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3ccccc3N3CCCC3)CC2)C[C@H](C)O1 ZINC000429205285 857553111 /nfs/dbraw/zinc/55/31/11/857553111.db2.gz BXACCKFRMOBSCE-BGYRXZFFSA-N 0 3 414.594 4.030 20 0 HIADHN CCCn1ccnc1CCCN(C)[C@H](C)C(=O)Nc1ccc(Br)c(C)c1 ZINC000429239803 857568959 /nfs/dbraw/zinc/56/89/59/857568959.db2.gz VEYAYWXJRDLXBE-MRXNPFEDSA-N 0 3 421.383 4.256 20 0 HIADHN CCCOc1cccc(NC(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)c1 ZINC000429249554 857574643 /nfs/dbraw/zinc/57/46/43/857574643.db2.gz BVWCRBXUYTZQOJ-RTBURBONSA-N 0 3 403.567 4.219 20 0 HIADHN C[C@@H]1CN(c2cccc(F)c2)CCN1CCC(=O)Nc1ccccc1Br ZINC000429255405 857577557 /nfs/dbraw/zinc/57/75/57/857577557.db2.gz PRNARRSGQIHPHS-OAHLLOKOSA-N 0 3 420.326 4.128 20 0 HIADHN O=C(Nc1ccc(OC(F)F)c(Cc2ccccc2)c1)N1CC[C@@H](N2CC=CC2)C1 ZINC000437614097 862930290 /nfs/dbraw/zinc/93/02/90/862930290.db2.gz YSQJMVHDJPSFQL-HXUWFJFHSA-N 0 3 413.468 4.357 20 0 HIADHN C[C@@H](C(=O)Nc1ccccc1C(=O)c1ccccc1)N1CCN(C2CCC2)C[C@H](C)C1 ZINC000429387788 857636694 /nfs/dbraw/zinc/63/66/94/857636694.db2.gz SONRILCXEJSLTL-UXHICEINSA-N 0 3 419.569 4.051 20 0 HIADHN COc1ccccc1NC(=O)CN1CCN(CCCc2ccccc2)C[C@H]1CC(C)C ZINC000429398626 857642638 /nfs/dbraw/zinc/64/26/38/857642638.db2.gz VNCHUTRSHKGFKC-HSZRJFAPSA-N 0 3 423.601 4.299 20 0 HIADHN CC(C)n1nccc1NC(=O)[C@H](C)N[C@@H]1c2cccc(Br)c2CC1(C)C ZINC000429412306 857651700 /nfs/dbraw/zinc/65/17/00/857651700.db2.gz ZREYCKMJVIIAPC-SCLBCKFNSA-N 0 3 419.367 4.467 20 0 HIADHN Cn1cc([C@H](NC[C@@]2(Cc3ccc(F)cc3)CCC[C@H]2O)c2cccc(F)c2)cn1 ZINC000429453478 857678227 /nfs/dbraw/zinc/67/82/27/857678227.db2.gz OYZWZUXPCIQDNT-SMIHKQSGSA-N 0 3 411.496 4.151 20 0 HIADHN Cc1c(CNC(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)oc2ccccc12 ZINC000429486626 857692377 /nfs/dbraw/zinc/69/23/77/857692377.db2.gz DCVYUNWMZPQIJQ-QZTJIDSGSA-N 0 3 413.562 4.162 20 0 HIADHN CC(C)(C)[C@@H](CN1CCc2ccccc2C1)NC(=O)N(Cc1ccccn1)C1CC1 ZINC000429492156 857694629 /nfs/dbraw/zinc/69/46/29/857694629.db2.gz FTNOYDUJEMKVTA-HSZRJFAPSA-N 0 3 406.574 4.229 20 0 HIADHN CN1CCN(c2cc(CN[C@H](Cc3ccccc3F)c3ccccc3)ccn2)CC1 ZINC000429518206 857712882 /nfs/dbraw/zinc/71/28/82/857712882.db2.gz IEEFXSDIWGDYQO-XMMPIXPASA-N 0 3 404.533 4.046 20 0 HIADHN CN1CCN(c2ncccc2CN[C@H](Cc2ccccc2F)c2ccccc2)CC1 ZINC000429520278 857713832 /nfs/dbraw/zinc/71/38/32/857713832.db2.gz XKTOIBABWCTSSL-XMMPIXPASA-N 0 3 404.533 4.046 20 0 HIADHN CO[C@@H]1CCCC[C@H]1NCC(=O)N1N=C(c2cccs2)C[C@H]1c1cccs1 ZINC000429530452 857723354 /nfs/dbraw/zinc/72/33/54/857723354.db2.gz SPKKDDPYYOHUFP-HYVNUMGLSA-N 0 3 403.573 4.035 20 0 HIADHN Cc1noc(C[C@@H](NCC[S@@](=O)c2cc(Cl)ccc2Cl)c2ccccc2)n1 ZINC000429547460 857739046 /nfs/dbraw/zinc/73/90/46/857739046.db2.gz JMKUXYQANLUJDD-XGCWNURASA-N 0 3 424.353 4.366 20 0 HIADHN CCOC(=O)c1csc(C2CCN(Cc3ccc(-n4ccnc4)cc3C)CC2)n1 ZINC000429566763 857753246 /nfs/dbraw/zinc/75/32/46/857753246.db2.gz LNELFQSMFMQIEQ-UHFFFAOYSA-N 0 3 410.543 4.194 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1ccnn1Cc1ccc(F)cc1)c1ccsc1 ZINC000429573998 857759496 /nfs/dbraw/zinc/75/94/96/857759496.db2.gz DGGBTJNREITURI-LJQANCHMSA-N 0 3 415.538 4.337 20 0 HIADHN O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)Nc1cc(-c2ccccc2)ns1 ZINC000429760028 857875358 /nfs/dbraw/zinc/87/53/58/857875358.db2.gz VYCVXSNOOUEQLW-HXUWFJFHSA-N 0 3 422.554 4.223 20 0 HIADHN COC(=O)c1c(CN[C@H]2CCC[C@@H]2CCO)nc2ccccc2c1-c1ccccc1 ZINC000429775468 857880395 /nfs/dbraw/zinc/88/03/95/857880395.db2.gz PHWUSQDMASQAOB-XLIONFOSSA-N 0 3 404.510 4.329 20 0 HIADHN CCO[C@H]1C[C@@H](NCC(=O)Nc2cc(OC)c(Cl)cc2OC)C12CCCCC2 ZINC000429784401 857883955 /nfs/dbraw/zinc/88/39/55/857883955.db2.gz JCWBLCXHQBCWAB-MOPGFXCFSA-N 0 3 410.942 4.013 20 0 HIADHN Cc1nc([C@@H]2CCCOC2)sc1C(=O)N(CCN(C)C)Cc1cccc(Cl)c1 ZINC000429814352 857895130 /nfs/dbraw/zinc/89/51/30/857895130.db2.gz ZIJJDPUCJYCCGP-QGZVFWFLSA-N 0 3 421.994 4.203 20 0 HIADHN Cc1nn(C(C)C)c(C)c1CC(=O)N[C@@H](CN1CCc2ccccc2C1)C(C)(C)C ZINC000429899561 857935104 /nfs/dbraw/zinc/93/51/04/857935104.db2.gz ZJJFHSIRUOSXIX-QHCPKHFHSA-N 0 3 410.606 4.213 20 0 HIADHN Cc1cc(CNC(=O)NC2CCN(CCOC(C)C)CC2)ccc1-c1ccccc1 ZINC000430031921 858003718 /nfs/dbraw/zinc/00/37/18/858003718.db2.gz AKGTXEORTUMYBZ-UHFFFAOYSA-N 0 3 409.574 4.351 20 0 HIADHN CCOC1(C)CCN(Cc2ccc(OCc3ccc(C(=O)OC)o3)c(OC)c2)CC1 ZINC000430098494 858030756 /nfs/dbraw/zinc/03/07/56/858030756.db2.gz DFQJBHGVWDLFFF-UHFFFAOYSA-N 0 3 417.502 4.045 20 0 HIADHN Cc1ccc(NC(=O)C[C@@H](C)N[C@H](CO)c2ccc(Br)c(F)c2)c(C)c1 ZINC000430125246 858043443 /nfs/dbraw/zinc/04/34/43/858043443.db2.gz MGOCZPDZAAIGRQ-AUUYWEPGSA-N 0 3 423.326 4.245 20 0 HIADHN O=C(N[C@H]1C[C@@H]1c1ccccc1OC(F)F)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000437649224 862980959 /nfs/dbraw/zinc/98/09/59/862980959.db2.gz IYKTZQGIEMTAHF-RLLQIKCJSA-N 0 3 415.484 4.108 20 0 HIADHN CCOc1cccc2[nH]cc(CC(=O)NC[C@H](c3ccc(OC)cc3)N3CCCC3)c21 ZINC000437650640 862983046 /nfs/dbraw/zinc/98/30/46/862983046.db2.gz MBAJYIXJLSHEBC-JOCHJYFZSA-N 0 3 421.541 4.071 20 0 HIADHN CN(C(=O)c1cccc(CN2CCCC2)c1)[C@H]1c2cc(Cl)cc(Cl)c2C[C@H]1O ZINC000430423428 858154411 /nfs/dbraw/zinc/15/44/11/858154411.db2.gz GCYGOBRSYGBUFY-RTWAWAEBSA-N 0 3 419.352 4.320 20 0 HIADHN O=C(N1CCC(c2ccncc2)CC1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000430543560 858212351 /nfs/dbraw/zinc/21/23/51/858212351.db2.gz SECQJTOXNDWLKG-JOCHJYFZSA-N 0 3 417.475 4.242 20 0 HIADHN Cc1ccc(CCCC(=O)Nc2ccc(C(=O)N(C)[C@H]3CCCN(C)C3)cc2)s1 ZINC000430589214 858229041 /nfs/dbraw/zinc/22/90/41/858229041.db2.gz CXUVBMJMZOPXDT-FQEVSTJZSA-N 0 3 413.587 4.184 20 0 HIADHN C[C@@H](N[C@H](c1ccccc1)C1CCC1)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000430720338 858278054 /nfs/dbraw/zinc/27/80/54/858278054.db2.gz MOFOALHCTBJVFT-BFUOFWGJSA-N 0 3 423.376 4.289 20 0 HIADHN CC1CCN([C@@H](CN2C(=O)CN(CCc3ccccc3)C2=O)c2cccs2)CC1 ZINC000430951179 858380525 /nfs/dbraw/zinc/38/05/25/858380525.db2.gz UQXKSTNCEBJETG-FQEVSTJZSA-N 0 3 411.571 4.028 20 0 HIADHN COc1ccc([C@H](CN2C(=O)CN([C@H](C)c3ccccc3)C2=O)N2CCCCC2)cc1 ZINC000430953531 858381138 /nfs/dbraw/zinc/38/11/38/858381138.db2.gz HHZHACUYSVLLAJ-XXBNENTESA-N 0 3 421.541 4.248 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](N2C(=O)N[C@@H](c3ccc(Cl)cc3Cl)C2=O)C1 ZINC000431031839 858410430 /nfs/dbraw/zinc/41/04/30/858410430.db2.gz DUQGZECKOGRLPL-AZOIQLNYSA-N 0 3 418.324 4.422 20 0 HIADHN COCCCOc1cccc(NC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)c1 ZINC000431104585 858447701 /nfs/dbraw/zinc/44/77/01/858447701.db2.gz UXAJPCBFPZDITQ-HXUWFJFHSA-N 0 3 411.546 4.230 20 0 HIADHN CCc1noc(-c2ccc(C)c(NC(=O)NCCCN3CCc4ccccc4C3)c2)n1 ZINC000431129127 858459802 /nfs/dbraw/zinc/45/98/02/858459802.db2.gz UGVXLJGFWDSIIG-UHFFFAOYSA-N 0 3 419.529 4.177 20 0 HIADHN Cc1cc(Cl)cc2c1OCCC[C@H]2NCCCS(=O)(=O)Cc1ccccc1 ZINC000431354066 858576771 /nfs/dbraw/zinc/57/67/71/858576771.db2.gz XQGFRWCXTBNJOU-HXUWFJFHSA-N 0 3 407.963 4.457 20 0 HIADHN COc1cnccc1N1CCN(C(=O)Nc2ccc(Oc3ccccc3)cc2)CC1 ZINC000431419624 858605711 /nfs/dbraw/zinc/60/57/11/858605711.db2.gz PTVOFOWDCLUKPB-UHFFFAOYSA-N 0 3 404.470 4.237 20 0 HIADHN C[C@@H](NC(=O)[C@@H]1CCCCN1C1CCCC1)c1noc(-c2ccc(Cl)cc2)n1 ZINC000431865367 858844991 /nfs/dbraw/zinc/84/49/91/858844991.db2.gz POQTZPRUHSOOSG-KDOFPFPSSA-N 0 3 402.926 4.364 20 0 HIADHN COc1cccc([C@H](CNC(=O)Cc2cscc2Br)N2CCCC2)c1 ZINC000432057460 858955821 /nfs/dbraw/zinc/95/58/21/858955821.db2.gz MZQOWHAGBRYTAB-SFHVURJKSA-N 0 3 423.376 4.015 20 0 HIADHN COc1ccccc1-c1cccc(NC(=O)N2CCN(c3ccncc3OC)CC2)c1 ZINC000432059340 858957454 /nfs/dbraw/zinc/95/74/54/858957454.db2.gz BAJBOBRFIKNUNE-UHFFFAOYSA-N 0 3 418.497 4.120 20 0 HIADHN COc1cnccc1N1CCN(C(=O)Nc2ccc3oc(CC(C)(C)C)nc3c2)CC1 ZINC000432087399 858980569 /nfs/dbraw/zinc/98/05/69/858980569.db2.gz DOVVSSCGHKKCJT-UHFFFAOYSA-N 0 3 423.517 4.174 20 0 HIADHN COc1cnccc1N1CCN(C(=O)Nc2ccc(C(F)(F)F)cc2Cl)CC1 ZINC000432091619 858982371 /nfs/dbraw/zinc/98/23/71/858982371.db2.gz WBIAMBFCHYKESJ-UHFFFAOYSA-N 0 3 414.815 4.117 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)c1cnnn1-c1c(Cl)cccc1Cl ZINC000432120161 859000801 /nfs/dbraw/zinc/00/08/01/859000801.db2.gz NAYPXTDJBUPMNU-UHFFFAOYSA-N 0 3 404.301 4.196 20 0 HIADHN O=C(Nc1ccc(Cl)cc1C(=O)c1ccc[nH]1)NC1CC(N2CCCCC2)C1 ZINC000432275145 859079795 /nfs/dbraw/zinc/07/97/95/859079795.db2.gz AWPZUQDMKXPJGD-UHFFFAOYSA-N 0 3 400.910 4.038 20 0 HIADHN Cc1cc(NC(=O)N[C@@H]2C[C@@H]2c2ccccc2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000432276917 859080927 /nfs/dbraw/zinc/08/09/27/859080927.db2.gz KRJFNYFDVWNDGU-YTFSRNRJSA-N 0 3 415.541 4.316 20 0 HIADHN O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)c1c(Cl)cc(F)cc1Cl ZINC000432291228 859088201 /nfs/dbraw/zinc/08/82/01/859088201.db2.gz HWBFWZCIHUKOAY-MRXNPFEDSA-N 0 3 411.304 4.153 20 0 HIADHN COCC[C@@H]1CCCCN(C(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)C1 ZINC000467559353 881382434 /nfs/dbraw/zinc/38/24/34/881382434.db2.gz GDVYKZXTXCDOCM-PMACEKPBSA-N 0 3 407.624 4.369 20 0 HIADHN Cc1nn(C(C)(C)C)cc1[C@@H](C)NC(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000467565346 881388101 /nfs/dbraw/zinc/38/81/01/881388101.db2.gz UMUNLAPOGDJEAU-CRAIPNDOSA-N 0 3 403.596 4.205 20 0 HIADHN CCOc1cc(CN2CCCO[C@H](CC)C2)ccc1OCc1ccc(C(=O)OC)o1 ZINC000467566876 881389029 /nfs/dbraw/zinc/38/90/29/881389029.db2.gz XWUBRDJXZICJSM-GOSISDBHSA-N 0 3 417.502 4.045 20 0 HIADHN COc1cnccc1N1CCN(C(=O)Nc2ccc(C(C)(C)C(F)(F)F)cc2)CC1 ZINC000432594144 859245384 /nfs/dbraw/zinc/24/53/84/859245384.db2.gz QRWMWPITRWCALK-UHFFFAOYSA-N 0 3 422.451 4.284 20 0 HIADHN CCN(CC)[C@H](CNC(=O)C1(Cc2cccc(F)c2)CCOCC1)c1ccsc1 ZINC000432712759 859312616 /nfs/dbraw/zinc/31/26/16/859312616.db2.gz BHYFRTQOTGPDJB-OAQYLSRUSA-N 0 3 418.578 4.426 20 0 HIADHN Cc1ccc(-c2cccnc2)cc1NC(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000432792420 859362662 /nfs/dbraw/zinc/36/26/62/859362662.db2.gz KPYBFBLOXSWFNU-BGYRXZFFSA-N 0 3 422.573 4.410 20 0 HIADHN CN(C)[C@H]1CCOc2c(Nc3cc(C(F)(F)F)nc(-c4ccncc4)n3)cccc21 ZINC000432914369 859428190 /nfs/dbraw/zinc/42/81/90/859428190.db2.gz AYHFGLINSOHYNK-INIZCTEOSA-N 0 3 415.419 4.108 20 0 HIADHN CN(C)Cc1ccc(S(=O)(=O)N2CCc3sccc3[C@H]2c2cccs2)cc1 ZINC000432944121 859440324 /nfs/dbraw/zinc/44/03/24/859440324.db2.gz LFVOJYSSRHEAMK-FQEVSTJZSA-N 0 3 418.609 4.208 20 0 HIADHN CC(=O)Nc1cccc(NC(=O)[C@H](SCCN(C)Cc2ccccc2)C(C)C)c1 ZINC000433021474 859483435 /nfs/dbraw/zinc/48/34/35/859483435.db2.gz XGJPEBXUZUDUOS-JOCHJYFZSA-N 0 3 413.587 4.473 20 0 HIADHN C[C@H]1CN(CCCCNC(=O)c2cncc(-c3ccc(Cl)cc3)c2)C[C@H](C)O1 ZINC000467629984 881429532 /nfs/dbraw/zinc/42/95/32/881429532.db2.gz OHZNIUOONKRTJZ-IRXDYDNUSA-N 0 3 401.938 4.021 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)[C@H]1C[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000467635507 881433441 /nfs/dbraw/zinc/43/34/41/881433441.db2.gz YTVLIGNUGXYCPK-MOPGFXCFSA-N 0 3 418.459 4.050 20 0 HIADHN COc1ccccc1-c1noc(C2CCN(Cc3cccc(NC(C)=O)c3)CC2)n1 ZINC000433160929 859547038 /nfs/dbraw/zinc/54/70/38/859547038.db2.gz IJEMHNAYQBQQIP-UHFFFAOYSA-N 0 3 406.486 4.083 20 0 HIADHN CC(C)(C)c1nnc(CN(Cc2ccncc2)[C@@H]2CCCN(Cc3ccccc3)C2)[nH]1 ZINC000433207069 859567364 /nfs/dbraw/zinc/56/73/64/859567364.db2.gz PQUSBSQIRCFACW-JOCHJYFZSA-N 0 3 418.589 4.164 20 0 HIADHN C[C@H](NC[C@H](O)COc1ccc(F)cc1)c1ccc(OC[C@H]2CCCCO2)c(F)c1 ZINC000433397453 859675562 /nfs/dbraw/zinc/67/55/62/859675562.db2.gz IYVQIBPDPCDQLB-NBHGPNQESA-N 0 3 421.484 4.003 20 0 HIADHN Cc1cccc(Cl)c1NC(=O)NCCCCN1CCN(c2ccccc2)CC1 ZINC000467656217 881450375 /nfs/dbraw/zinc/45/03/75/881450375.db2.gz RCOCCHCMGXCYHY-UHFFFAOYSA-N 0 3 400.954 4.372 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N(C)Cc1cc(F)cc(F)c1)c1cccc(OC)c1 ZINC000433562609 859779733 /nfs/dbraw/zinc/77/97/33/859779733.db2.gz BFCFEEOTTBBWIG-NRFANRHFSA-N 0 3 405.489 4.198 20 0 HIADHN O=C(N1CCc2ccc(F)cc2C1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000433566388 859782555 /nfs/dbraw/zinc/78/25/55/859782555.db2.gz ZSWHTGTVEZYULB-NRFANRHFSA-N 0 3 406.423 4.165 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CC[C@H](CC(F)(F)F)C1)c1cccc(OC)c1 ZINC000433566533 859782617 /nfs/dbraw/zinc/78/26/17/859782617.db2.gz UFYPMLPYFOKXSM-QAPCUYQASA-N 0 3 401.473 4.062 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)Cc2cc(Br)ccc2F)C1 ZINC000433718488 859852046 /nfs/dbraw/zinc/85/20/46/859852046.db2.gz NCVLAKHLMZXZKL-KDOFPFPSSA-N 0 3 405.311 4.082 20 0 HIADHN Cc1c(Br)ccc(NC(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)c1F ZINC000433728187 859858258 /nfs/dbraw/zinc/85/82/58/859858258.db2.gz AFPBHLYYDJGFMT-AEFFLSMTSA-N 0 3 406.299 4.464 20 0 HIADHN Cn1cc(-c2cc(F)ccc2NC(=O)N[C@@H](CN2CCCC2)c2ccccc2)cn1 ZINC000433791424 859893898 /nfs/dbraw/zinc/89/38/98/859893898.db2.gz CVJWGZVDPXCADO-QFIPXVFZSA-N 0 3 407.493 4.185 20 0 HIADHN C[C@H]1CCN(C(=O)Nc2ccc(F)cc2-c2cnn(C)c2)CCN1Cc1ccccc1 ZINC000433797979 859897722 /nfs/dbraw/zinc/89/77/22/859897722.db2.gz CJKVVUNNEDNJSV-SFHVURJKSA-N 0 3 421.520 4.355 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3c4c(ccc3Cl)OCC4)c(C)c2)CC1 ZINC000433800012 859898222 /nfs/dbraw/zinc/89/82/22/859898222.db2.gz AXZHNDXESYKVJQ-UHFFFAOYSA-N 0 3 414.937 4.369 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)Nc2ccc(F)cc2-c2cnn(C)c2)C1 ZINC000433807653 859903255 /nfs/dbraw/zinc/90/32/55/859903255.db2.gz JOVVOSPGTFURLD-UZLBHIALSA-N 0 3 407.493 4.183 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)Nc2ccc(F)cc2-c2cnn(C)c2)C1 ZINC000433807652 859903653 /nfs/dbraw/zinc/90/36/53/859903653.db2.gz JOVVOSPGTFURLD-OXQOHEQNSA-N 0 3 407.493 4.183 20 0 HIADHN C[C@H]1C[C@H](NC(=O)c2ccccc2OCc2cscn2)CN1Cc1ccccc1 ZINC000467689597 881480993 /nfs/dbraw/zinc/48/09/93/881480993.db2.gz WGGQKMRTVHNLMS-HKUYNNGSSA-N 0 3 407.539 4.115 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)c2ccccc2OCc2cscn2)CN1Cc1ccccc1 ZINC000467689599 881481537 /nfs/dbraw/zinc/48/15/37/881481537.db2.gz WGGQKMRTVHNLMS-MJGOQNOKSA-N 0 3 407.539 4.115 20 0 HIADHN C[C@H]1C[C@H](NC(=O)c2ccc(NC(=O)c3cccs3)cc2)CN1Cc1ccccc1 ZINC000467693419 881487111 /nfs/dbraw/zinc/48/71/11/881487111.db2.gz BCNOGTVKWKBSSJ-UWJYYQICSA-N 0 3 419.550 4.393 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)c2cn(C)nc2-c2ccccc2Cl)CN1Cc1ccccc1 ZINC000467693699 881487411 /nfs/dbraw/zinc/48/74/11/881487411.db2.gz BQPCMKPWGWHIMI-FUHWJXTLSA-N 0 3 408.933 4.133 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)c2ccc(NC(=O)c3cccs3)cc2)CN1Cc1ccccc1 ZINC000467693418 881487622 /nfs/dbraw/zinc/48/76/22/881487622.db2.gz BCNOGTVKWKBSSJ-UTKZUKDTSA-N 0 3 419.550 4.393 20 0 HIADHN Cc1cc(C(=O)N(CCN(C)C)C2CCCC2)c2ccc(Br)cc2n1 ZINC000433980025 860013316 /nfs/dbraw/zinc/01/33/16/860013316.db2.gz GIASINQXRHOQPO-UHFFFAOYSA-N 0 3 404.352 4.252 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)c2ccc(NC(=O)c3ccccc3)cc2)CN1Cc1ccccc1 ZINC000467698547 881494280 /nfs/dbraw/zinc/49/42/80/881494280.db2.gz QNYXNVVBIQZOPC-NTKDMRAZSA-N 0 3 413.521 4.332 20 0 HIADHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(-c2nnc(-c3cccc(C)c3)o2)cc1 ZINC000434062377 860073358 /nfs/dbraw/zinc/07/33/58/860073358.db2.gz JYYGTLOWXOFJTB-YADHBBJMSA-N 0 3 416.525 4.411 20 0 HIADHN O=C(Nc1cccc(-c2noc(C3CC3)n2)c1)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000434066024 860075850 /nfs/dbraw/zinc/07/58/50/860075850.db2.gz AHICIGBXQMRMPE-NRFANRHFSA-N 0 3 417.513 4.400 20 0 HIADHN C[C@H](CNC(=O)Nc1cccc(-c2noc(C3CC3)n2)c1)N(C)Cc1ccccc1 ZINC000434067128 860077057 /nfs/dbraw/zinc/07/70/57/860077057.db2.gz TZQLWDUFDAYGAD-MRXNPFEDSA-N 0 3 405.502 4.256 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)N(CCCO)Cc1cccc(Cl)c1 ZINC000434076067 860084515 /nfs/dbraw/zinc/08/45/15/860084515.db2.gz VEFKJWIOVMYTJZ-JOCHJYFZSA-N 0 3 415.965 4.071 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)Nc1cccc2c1CCO2 ZINC000434123405 860123590 /nfs/dbraw/zinc/12/35/90/860123590.db2.gz JHMJZMDDEMNWSN-UHFFFAOYSA-N 0 3 407.436 4.236 20 0 HIADHN COc1ccccc1CCC(=O)Nc1c(C)cnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000434313125 860274784 /nfs/dbraw/zinc/27/47/84/860274784.db2.gz STVPOMZWANGDOS-JOCHJYFZSA-N 0 3 418.541 4.218 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1cc(C(C)(C)C)on1 ZINC000434315685 860275655 /nfs/dbraw/zinc/27/56/55/860275655.db2.gz KHJDXTTUZJSTON-GOSISDBHSA-N 0 3 407.518 4.176 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)CCc1ccc(F)cc1 ZINC000434315669 860275940 /nfs/dbraw/zinc/27/59/40/860275940.db2.gz KFEBSJAEQGFITI-JOCHJYFZSA-N 0 3 406.505 4.349 20 0 HIADHN CSc1cc(C(=O)Nc2c(C)cnn2[C@H]2CCN(Cc3ccccc3)C2)ccn1 ZINC000434316139 860277563 /nfs/dbraw/zinc/27/75/63/860277563.db2.gz LITAIUUSYYZGPU-IBGZPJMESA-N 0 3 407.543 4.008 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1cc2nc(C)ccc2o1 ZINC000434321044 860281049 /nfs/dbraw/zinc/28/10/49/860281049.db2.gz JDENIVXBYUPJPT-LJQANCHMSA-N 0 3 415.497 4.340 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)Cc1ccc(F)c(F)c1 ZINC000434323830 860284704 /nfs/dbraw/zinc/28/47/04/860284704.db2.gz BKVYZDQHPNUBSW-LJQANCHMSA-N 0 3 410.468 4.098 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1ccc2c(c1)CCC2 ZINC000434331261 860293282 /nfs/dbraw/zinc/29/32/82/860293282.db2.gz ZBBZZWXGZQSBRP-QHCPKHFHSA-N 0 3 400.526 4.380 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1cncc2ccccc21 ZINC000434336905 860298677 /nfs/dbraw/zinc/29/86/77/860298677.db2.gz RPRDLBPIPYTYOQ-OAQYLSRUSA-N 0 3 411.509 4.439 20 0 HIADHN O=C(NC[C@H]1CCCN1Cc1ccccc1)c1ccccc1NCc1cccnc1 ZINC000434395922 860332601 /nfs/dbraw/zinc/33/26/01/860332601.db2.gz PAQHGQQHCFQRNW-JOCHJYFZSA-N 0 3 400.526 4.088 20 0 HIADHN Cc1ccc(-c2nnc(-c3ccc(C(=O)NC[C@H]4CCCCN4C4CC4)cc3)o2)cc1 ZINC000434418084 860341821 /nfs/dbraw/zinc/34/18/21/860341821.db2.gz YLMWXHFWLVEETJ-JOCHJYFZSA-N 0 3 416.525 4.459 20 0 HIADHN O=C(NC[C@H]1CCCCN1C1CC1)c1cnc2ccc(Oc3ccccc3)cc2c1O ZINC000434498860 860374691 /nfs/dbraw/zinc/37/46/91/860374691.db2.gz JUMRWIUTGHLXSN-GOSISDBHSA-N 0 3 417.509 4.067 20 0 HIADHN O=C(c1ccc(F)cc1)C1CCN(C[C@@H](O)CO[C@@H]2CCCc3ccccc32)CC1 ZINC000434661894 860450483 /nfs/dbraw/zinc/45/04/83/860450483.db2.gz GYEUCRDYEGPSEE-ISKFKSNPSA-N 0 3 411.517 4.176 20 0 HIADHN C[C@@H](NC(=O)[C@H](C)N1CCC(c2ncc3n2CCCC3)CC1)c1cc2ccccc2o1 ZINC000434685069 860459702 /nfs/dbraw/zinc/45/97/02/860459702.db2.gz MGCYMKRDZUKIEF-MSOLQXFVSA-N 0 3 420.557 4.411 20 0 HIADHN C[C@H](Oc1ccc(-c2ccccc2)cc1)C(=O)NCCCCN1C[C@@H](C)O[C@H](C)C1 ZINC000434754614 860482354 /nfs/dbraw/zinc/48/23/54/860482354.db2.gz GKFYKKCJFXNHGW-NJYVYQBISA-N 0 3 410.558 4.127 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)c2ccc(-c3nc4ccccc4s3)o2)C[C@@H](C)O1 ZINC000434761874 860485389 /nfs/dbraw/zinc/48/53/89/860485389.db2.gz CNWUJYCJHMIZDW-HZPDHXFCSA-N 0 3 413.543 4.176 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)Cc2csc(-c3ccccc3Cl)n2)C[C@@H](C)O1 ZINC000434786430 860494964 /nfs/dbraw/zinc/49/49/64/860494964.db2.gz ONNNVBLHLFGUTD-HZPDHXFCSA-N 0 3 421.994 4.012 20 0 HIADHN COc1cccc(CN(CCC(=O)Nc2cccc(F)c2C)C[C@H]2CCCO2)c1 ZINC000434833351 860512349 /nfs/dbraw/zinc/51/23/49/860512349.db2.gz JUVFIXAWZNNFDN-HXUWFJFHSA-N 0 3 400.494 4.153 20 0 HIADHN COc1cccc(NC(=O)CCN2CCC[C@H](c3nc(C(F)(F)F)cs3)C2)c1 ZINC000434883109 860533333 /nfs/dbraw/zinc/53/33/33/860533333.db2.gz LFKIYCGKSPCMPS-ZDUSSCGKSA-N 0 3 413.465 4.379 20 0 HIADHN COc1cccc(OC)c1OC[C@H](O)CN(Cc1cc(F)ccc1F)C1CCCC1 ZINC000434904807 860547723 /nfs/dbraw/zinc/54/77/23/860547723.db2.gz GYAUUCYPDIBRSL-LJQANCHMSA-N 0 3 421.484 4.167 20 0 HIADHN CCN1CCN(Cc2ccccc2CN[C@@H](C)c2nc(C(F)(F)F)cs2)CC1 ZINC000467748309 881552454 /nfs/dbraw/zinc/55/24/54/881552454.db2.gz XXQDCUQTHTYVSI-HNNXBMFYSA-N 0 3 412.525 4.150 20 0 HIADHN c1cc(-c2ccc(CNCc3ccccc3-c3ccc(Cn4cncn4)cc3)o2)n[nH]1 ZINC000434984879 860586007 /nfs/dbraw/zinc/58/60/07/860586007.db2.gz CPTSTZWVZYQXRN-UHFFFAOYSA-N 0 3 410.481 4.266 20 0 HIADHN CN(C)C(=O)Nc1ccc(C(=O)N[C@@H](CN2CCCC2)c2ccccc2)c(Cl)c1 ZINC000435042122 860612373 /nfs/dbraw/zinc/61/23/73/860612373.db2.gz LSUPMGVEOQOQOT-FQEVSTJZSA-N 0 3 414.937 4.000 20 0 HIADHN COc1cccc(-c2nn(C(C)(C)C)cc2CN2CC[C@@H](Oc3ccncc3)C2)c1 ZINC000435058046 860620090 /nfs/dbraw/zinc/62/00/90/860620090.db2.gz RZXVQNNGVCISEV-JOCHJYFZSA-N 0 3 406.530 4.362 20 0 HIADHN C[C@H](CN1CCOCC1)N(C)Cc1cn(C(C)(C)C)nc1-c1ccccc1Cl ZINC000435058408 860620262 /nfs/dbraw/zinc/62/02/62/860620262.db2.gz SRPPWHINAXBTFV-QGZVFWFLSA-N 0 3 404.986 4.111 20 0 HIADHN C[C@H]1C[C@H](NC(=O)c2ccccc2-c2nc(C(C)(C)C)no2)CN1Cc1ccccc1 ZINC000467756508 881570029 /nfs/dbraw/zinc/57/00/29/881570029.db2.gz VGNKTISRMDGRIG-HKUYNNGSSA-N 0 3 418.541 4.427 20 0 HIADHN CC[C@H](C)c1cc(C(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)on1 ZINC000435270313 860710813 /nfs/dbraw/zinc/71/08/13/860710813.db2.gz KQIWWQGDNUWOLS-LPHOPBHVSA-N 0 3 407.518 4.392 20 0 HIADHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc(COc2ccc(Cl)cc2Cl)on1 ZINC000435271750 860711737 /nfs/dbraw/zinc/71/17/37/860711737.db2.gz XYYOUNXCWPAXLV-CABCVRRESA-N 0 3 424.328 4.259 20 0 HIADHN Cc1cc(NC(=O)c2ncccc2OC(C)C)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435272121 860711781 /nfs/dbraw/zinc/71/17/81/860711781.db2.gz ZKGGFKHAWFSWFS-FQEVSTJZSA-N 0 3 419.529 4.073 20 0 HIADHN Cc1cc(NC(=O)c2ccc(F)c(F)c2F)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435280762 860716365 /nfs/dbraw/zinc/71/63/65/860716365.db2.gz UCWNATFCWMTAMP-MRXNPFEDSA-N 0 3 414.431 4.308 20 0 HIADHN CCC(CC)n1ccc(C(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435288756 860721412 /nfs/dbraw/zinc/72/14/12/860721412.db2.gz KXQWIWGCAKISGA-OAQYLSRUSA-N 0 3 420.561 4.448 20 0 HIADHN CCOc1ccccc1C(=O)Nc1cc(C)nn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435295344 860724319 /nfs/dbraw/zinc/72/43/19/860724319.db2.gz OSYNOAINHKYHFX-FQEVSTJZSA-N 0 3 404.514 4.290 20 0 HIADHN CC(C)Cc1nc(C(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)cs1 ZINC000435368251 860766037 /nfs/dbraw/zinc/76/60/37/860766037.db2.gz HIWNHNGXDXGKIR-GOSISDBHSA-N 0 3 409.559 4.237 20 0 HIADHN CCO[C@@H](CC(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)C1=CCCC1 ZINC000435368395 860766248 /nfs/dbraw/zinc/76/62/48/860766248.db2.gz HUWLRYRSTIBEAG-YADHBBJMSA-N 0 3 408.546 4.174 20 0 HIADHN CCCOc1cccc(C(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000435369568 860767258 /nfs/dbraw/zinc/76/72/58/860767258.db2.gz FDISGRMMYNKJLG-OAQYLSRUSA-N 0 3 404.514 4.371 20 0 HIADHN COc1ccc([C@H](C)CC(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000435371613 860769132 /nfs/dbraw/zinc/76/91/32/860769132.db2.gz NZSLIKDTCFDUSN-DENIHFKCSA-N 0 3 418.541 4.471 20 0 HIADHN C[C@@H](Oc1cccc(Cl)c1)C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435371725 860769375 /nfs/dbraw/zinc/76/93/75/860769375.db2.gz XBKHEQWLNBWPFN-YLJYHZDGSA-N 0 3 424.932 4.390 20 0 HIADHN CSCc1ccc(C(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000435371429 860769659 /nfs/dbraw/zinc/76/96/59/860769659.db2.gz UQEZBRCPSBPUIP-OAQYLSRUSA-N 0 3 406.555 4.445 20 0 HIADHN CCC(CC)n1nccc1C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435372293 860770781 /nfs/dbraw/zinc/77/07/81/860770781.db2.gz JLRDOOLUFCKIQO-FQEVSTJZSA-N 0 3 406.534 4.140 20 0 HIADHN O=C(Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)c1ccc2ncsc2c1 ZINC000435374302 860772499 /nfs/dbraw/zinc/77/24/99/860772499.db2.gz QBRCIYLLNFUFNO-SFHVURJKSA-N 0 3 403.511 4.192 20 0 HIADHN C[C@@H](OC1CCCCCC1)C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435374953 860772621 /nfs/dbraw/zinc/77/26/21/860772621.db2.gz KGZLPUNGVLQSHX-TZIWHRDSSA-N 0 3 410.562 4.397 20 0 HIADHN O=C(CCCOc1cccc(F)c1)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435374984 860773060 /nfs/dbraw/zinc/77/30/60/860773060.db2.gz KOFDDFKLRQKAFX-NRFANRHFSA-N 0 3 422.504 4.267 20 0 HIADHN CC[C@H](Oc1ccccc1C)C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435378070 860774903 /nfs/dbraw/zinc/77/49/03/860774903.db2.gz GYBMIIWBUQYZNW-YADHBBJMSA-N 0 3 418.541 4.435 20 0 HIADHN CC[C@@H](Oc1ccccc1C)C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435378068 860775286 /nfs/dbraw/zinc/77/52/86/860775286.db2.gz GYBMIIWBUQYZNW-FGZHOGPDSA-N 0 3 418.541 4.435 20 0 HIADHN Cc1cc(NC(=O)N(C)[C@H](C)c2ccccn2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435515074 860832740 /nfs/dbraw/zinc/83/27/40/860832740.db2.gz FJORGLGIDORAFQ-CTNGQTDRSA-N 0 3 418.545 4.258 20 0 HIADHN Cc1cc(NC(=O)N[C@@H]2CCCc3occc32)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435513940 860833119 /nfs/dbraw/zinc/83/31/19/860833119.db2.gz APMVVZNVLORWSK-TZIWHRDSSA-N 0 3 419.529 4.431 20 0 HIADHN Cc1cc(NC(=O)NC[C@@]2(C)CCCS2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435528829 860844550 /nfs/dbraw/zinc/84/45/50/860844550.db2.gz WKNRWGRTKSYVGM-DENIHFKCSA-N 0 3 413.591 4.046 20 0 HIADHN C[C@H](C(=O)N1CCc2ccccc2C1)N(C)CCCc1cc(-c2ccc(F)cc2)n[nH]1 ZINC000435576156 860892883 /nfs/dbraw/zinc/89/28/83/860892883.db2.gz FVOGJEJQJZFTSA-GOSISDBHSA-N 0 3 420.532 4.054 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)c1cc2cc(F)ccc2[nH]1 ZINC000435637688 860929031 /nfs/dbraw/zinc/92/90/31/860929031.db2.gz RKBZVTNQVOREKK-LJQANCHMSA-N 0 3 403.461 4.203 20 0 HIADHN Cc1c(C)c(C)c(CNC(=O)N(C)C2CCN(CCc3ccccn3)CC2)c(C)c1C ZINC000435763804 861040807 /nfs/dbraw/zinc/04/08/07/861040807.db2.gz WPIHIJDTRRIFIK-UHFFFAOYSA-N 0 3 422.617 4.472 20 0 HIADHN COc1cc([C@H](C)NCc2ccc(N(C)c3ccccc3)nc2)ccc1OCCO ZINC000435776280 861051790 /nfs/dbraw/zinc/05/17/90/861051790.db2.gz CRZBCYMWOBTCGK-SFHVURJKSA-N 0 3 407.514 4.080 20 0 HIADHN CN(c1ccccc1)c1ccc(CN[C@@H]2CCN(C(=O)CCc3ccccc3)C2)cn1 ZINC000435779075 861052549 /nfs/dbraw/zinc/05/25/49/861052549.db2.gz PHFFFRUWIKPHEA-HSZRJFAPSA-N 0 3 414.553 4.173 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)CCNc3ccccc3C)c(OCC)c2)CC1 ZINC000435837429 861100588 /nfs/dbraw/zinc/10/05/88/861100588.db2.gz UYHASAQBBWMGTN-UHFFFAOYSA-N 0 3 424.589 4.366 20 0 HIADHN Cc1ccc([C@@H](NCCCC(=O)Nc2c(C)cccc2C)[C@@H](C)S(C)(=O)=O)cc1 ZINC000435903116 861161032 /nfs/dbraw/zinc/16/10/32/861161032.db2.gz PMWBHRYWZPCCMD-XXBNENTESA-N 0 3 416.587 4.095 20 0 HIADHN C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)[C@](C)(Cc1nc2ccccc2s1)c1ccccc1 ZINC000467803095 881628723 /nfs/dbraw/zinc/62/87/23/881628723.db2.gz MZJPHKDNXVBNBF-FTGWLVSGSA-N 0 3 419.594 4.396 20 0 HIADHN C[C@H]1CN(C2CC2)C[C@@H]1NC(=O)c1ccccc1-c1nc(-c2cccc(Cl)c2)no1 ZINC000467811402 881638961 /nfs/dbraw/zinc/63/89/61/881638961.db2.gz KMYPTDUCJRQWSH-XOBRGWDASA-N 0 3 422.916 4.270 20 0 HIADHN CC(C)(C)c1cc(NC(=O)N2CC[C@@H](N3CC=CC3)C2)n(-c2cccc(Cl)c2)n1 ZINC000437870414 863231153 /nfs/dbraw/zinc/23/11/53/863231153.db2.gz UPGAEEAIURUBQE-GOSISDBHSA-N 0 3 413.953 4.301 20 0 HIADHN C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)c1ccccc1-c1nc(-c2cccc(Cl)c2)no1 ZINC000467811399 881639282 /nfs/dbraw/zinc/63/92/82/881639282.db2.gz KMYPTDUCJRQWSH-JLTOFOAXSA-N 0 3 422.916 4.270 20 0 HIADHN Cc1csc([C@@H](NC(=O)Nc2ccc(CCN3CCSCC3)cc2)C2CC2)n1 ZINC000438095987 863500893 /nfs/dbraw/zinc/50/08/93/863500893.db2.gz IIQLHDNIBNQJDN-IBGZPJMESA-N 0 3 416.616 4.316 20 0 HIADHN CN(C)Cc1cccc(NC(=O)C(=O)NCc2ccc(Sc3ccccc3)cc2)c1 ZINC000438396547 863844954 /nfs/dbraw/zinc/84/49/54/863844954.db2.gz IBQJEUOSRFJDES-UHFFFAOYSA-N 0 3 419.550 4.154 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)N[C@H]1C[C@@H]1c1ccccc1OC(F)F ZINC000438400020 863847903 /nfs/dbraw/zinc/84/79/03/863847903.db2.gz HLWCKEBHBBEFFC-MOPGFXCFSA-N 0 3 421.463 4.056 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)CCc1nnc(-c2cc3ccccc3o2)o1 ZINC000438470519 863889638 /nfs/dbraw/zinc/88/96/38/863889638.db2.gz IWPJXOZBKNYJPI-UHFFFAOYSA-N 0 3 424.526 4.067 20 0 HIADHN CC(C)Cn1cc(NC(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)cn1 ZINC000438553421 863984632 /nfs/dbraw/zinc/98/46/32/863984632.db2.gz RCFXIPYMTNNECL-UHFFFAOYSA-N 0 3 411.472 4.154 20 0 HIADHN COCCO[C@@H]1CCN(Cc2cccc(NC(=O)c3ccc(Cl)cc3Cl)c2)C1 ZINC000438556825 863987203 /nfs/dbraw/zinc/98/72/03/863987203.db2.gz XRASOLLXEIMHIR-GOSISDBHSA-N 0 3 423.340 4.483 20 0 HIADHN Cc1cc(C(=O)N(Cc2ccccc2)C2CCN(C)CC2)c2cnn(C(C)C)c2n1 ZINC000438559893 863992813 /nfs/dbraw/zinc/99/28/13/863992813.db2.gz CMBUPBKBHZNCSN-UHFFFAOYSA-N 0 3 405.546 4.057 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)Nc1cccc(CC(F)(F)F)c1 ZINC000438571374 864004278 /nfs/dbraw/zinc/00/42/78/864004278.db2.gz ZWPUCHYIELZUCI-UHFFFAOYSA-N 0 3 401.498 4.275 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)N1CCc2c(F)ccc(F)c2C1 ZINC000438588950 864018639 /nfs/dbraw/zinc/01/86/39/864018639.db2.gz SGBKEACZGGGOEA-UHFFFAOYSA-N 0 3 417.525 4.146 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Nc1cccc(C[S@@](=O)C(C)(C)C)c1 ZINC000438644552 864083125 /nfs/dbraw/zinc/08/31/25/864083125.db2.gz AZEQQZLBINIGQB-MUUNZHRXSA-N 0 3 421.632 4.391 20 0 HIADHN O[C@H](CO[C@@H]1CCCc2ccccc21)CN1CC=C(c2c[nH]c3ncccc23)CC1 ZINC000438650376 864090948 /nfs/dbraw/zinc/09/09/48/864090948.db2.gz POEWPESXFYQYCQ-GBXCKJPGSA-N 0 3 403.526 4.107 20 0 HIADHN C[C@@H](OC[C@H](O)CN1CC=C(c2c[nH]c3ncccc23)CC1)c1ccc(Cl)cc1 ZINC000438651314 864092832 /nfs/dbraw/zinc/09/28/32/864092832.db2.gz MKNASJUPYJKAOT-OXQOHEQNSA-N 0 3 411.933 4.444 20 0 HIADHN CC(C)(C)Oc1ccccc1NC(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000438653162 864093729 /nfs/dbraw/zinc/09/37/29/864093729.db2.gz ZKSMQMBYOSIRBV-UHFFFAOYSA-N 0 3 411.546 4.142 20 0 HIADHN CCOc1cc(C)ccc1NC(=O)C(=O)N(CC)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000438665202 864116234 /nfs/dbraw/zinc/11/62/34/864116234.db2.gz CINGLMUYVSDZRC-CTNGQTDRSA-N 0 3 423.557 4.016 20 0 HIADHN CCN(C(=O)C(=O)Nc1cccc(C(F)F)c1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000438665438 864119307 /nfs/dbraw/zinc/11/93/07/864119307.db2.gz QALKOEPFAQDSID-JXFKEZNVSA-N 0 3 415.484 4.247 20 0 HIADHN CCN(C(=O)C(=O)Nc1ccccc1SC)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000438666548 864121571 /nfs/dbraw/zinc/12/15/71/864121571.db2.gz ICSBYYDJJACVQU-IEBWSBKVSA-N 0 3 411.571 4.031 20 0 HIADHN O[C@@H](COc1ccccc1F)CN1CCC(c2nc3cc(Cl)ccc3o2)CC1 ZINC000438756755 864249750 /nfs/dbraw/zinc/24/97/50/864249750.db2.gz QIIGLTDNMYUDKY-MRXNPFEDSA-N 0 3 404.869 4.240 20 0 HIADHN CCOc1cc(CN(C)CCC(=O)Nc2cc(F)cc(F)c2)ccc1OC(F)F ZINC000438838067 864331357 /nfs/dbraw/zinc/33/13/57/864331357.db2.gz KAFMJOZMSDRIQF-UHFFFAOYSA-N 0 3 414.399 4.426 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)Nc2cnn(Cc3ccccc3)c2)CC1 ZINC000438889829 864373149 /nfs/dbraw/zinc/37/31/49/864373149.db2.gz JBFINOCONHVAJX-UHFFFAOYSA-N 0 3 403.530 4.060 20 0 HIADHN COc1ccc([C@H](CNC(=O)[C@@H]2C[C@@]23CCCc2ccccc23)N2CCCC2)cc1 ZINC000438917700 864396623 /nfs/dbraw/zinc/39/66/23/864396623.db2.gz MNCJIQNISYPEAP-KYPHJKQUSA-N 0 3 404.554 4.243 20 0 HIADHN O[C@@H]1CCCC[C@H]1[C@@H]1CCCCN1Cc1csc(-c2ccc3c(c2)OCO3)n1 ZINC000439015693 864466641 /nfs/dbraw/zinc/46/66/41/864466641.db2.gz SZSYRWUPLQOFNP-GBESFXJTSA-N 0 3 400.544 4.444 20 0 HIADHN CCN(C[C@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)c1cc(F)ccc1Cl ZINC000439237501 864653774 /nfs/dbraw/zinc/65/37/74/864653774.db2.gz OBFCYOLMRHXXCL-KRWDZBQOSA-N 0 3 410.942 4.012 20 0 HIADHN Cc1ccsc1[C@@H]1C[C@H]1C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000439286677 864706707 /nfs/dbraw/zinc/70/67/07/864706707.db2.gz NUTXWGYSGYBVKZ-VAMGGRTRSA-N 0 3 406.555 4.442 20 0 HIADHN O=C(Nc1ccccc1OCC(F)F)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000467933608 881806578 /nfs/dbraw/zinc/80/65/78/881806578.db2.gz NWRAZJIXCWSJOU-UHFFFAOYSA-N 0 3 421.410 4.257 20 0 HIADHN C[C@@H](C(=O)N(C)Cc1nc2ccccc2s1)N(C)CCCOCc1ccccc1 ZINC000439471095 864843637 /nfs/dbraw/zinc/84/36/37/864843637.db2.gz QSDLXZKBFAHZNM-SFHVURJKSA-N 0 3 411.571 4.182 20 0 HIADHN Clc1ccc(OC[C@@H]2CCCO2)c(CNCCc2ccn(-c3ccccc3)n2)c1 ZINC000439470052 864843693 /nfs/dbraw/zinc/84/36/93/864843693.db2.gz NWLCIFCNOWPDFI-QFIPXVFZSA-N 0 3 411.933 4.416 20 0 HIADHN C[C@H](C(=O)Nc1ccc(CCn2cc(Br)cn2)cc1)N1[C@H](C)CC[C@H]1C ZINC000439480943 864846418 /nfs/dbraw/zinc/84/64/18/864846418.db2.gz WXFRHEZOIDQEAD-BZUAXINKSA-N 0 3 419.367 4.088 20 0 HIADHN CCCCCc1ccc(NC(=O)C(=O)NC2CCN([C@@H](C)c3ccncc3)CC2)cc1 ZINC000439503605 864856952 /nfs/dbraw/zinc/85/69/52/864856952.db2.gz ISSAOYLDRHYSBW-IBGZPJMESA-N 0 3 422.573 4.095 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)NC[C@H]2CCC[C@@H](C(F)(F)F)C2)CC1 ZINC000439580985 864903209 /nfs/dbraw/zinc/90/32/09/864903209.db2.gz KVMXKVMPPJCUNS-JKSUJKDBSA-N 0 3 401.473 4.254 20 0 HIADHN Cc1ccccc1CN(C)C(=O)[C@H](C)NCc1ccccc1CN(C)Cc1ccco1 ZINC000439594293 864915273 /nfs/dbraw/zinc/91/52/73/864915273.db2.gz KMUHXAZXHADXIA-NRFANRHFSA-N 0 3 419.569 4.357 20 0 HIADHN CO[C@H](C)c1nc(CN2CCCN(CCSc3ccc(F)cc3)CC2)cs1 ZINC000439610649 864932192 /nfs/dbraw/zinc/93/21/92/864932192.db2.gz CEHLVBMFYUTUOC-MRXNPFEDSA-N 0 3 409.596 4.290 20 0 HIADHN Cc1nc(NC(=O)[C@@H](C)NCc2ccccc2CN(C)Cc2ccco2)sc1C ZINC000439612906 864936814 /nfs/dbraw/zinc/93/68/14/864936814.db2.gz ULPSPLMAFULUEQ-MRXNPFEDSA-N 0 3 412.559 4.102 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)NC[C@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000439631109 864956924 /nfs/dbraw/zinc/95/69/24/864956924.db2.gz DGRQSOFPUBNFBA-GOEBONIOSA-N 0 3 421.454 4.407 20 0 HIADHN COC(=O)c1ccc(C)c(NC(=O)[C@@H](C)NCC(C)(C)c2c(F)cccc2Cl)c1 ZINC000439644368 864970840 /nfs/dbraw/zinc/97/08/40/864970840.db2.gz IVRVUPLPNNVXIY-CQSZACIVSA-N 0 3 420.912 4.469 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@@H]2CN[C@@H](C(N)=O)c2ccc(Br)cc2)cc1 ZINC000439659205 864987803 /nfs/dbraw/zinc/98/78/03/864987803.db2.gz DQTXREHCWDKISW-RLLQIKCJSA-N 0 3 417.347 4.041 20 0 HIADHN Cc1ccc(C(=O)NCC2CC2)cc1NC(=O)NC[C@H](c1ccccc1)N1CCCC1 ZINC000439678378 865013616 /nfs/dbraw/zinc/01/36/16/865013616.db2.gz CBPDBFZXEPJFPK-HSZRJFAPSA-N 0 3 420.557 4.093 20 0 HIADHN CC[C@@H](Oc1ccccc1Cl)C(=O)NC1CCN([C@@H](C)c2ccncc2)CC1 ZINC000439737901 865069386 /nfs/dbraw/zinc/06/93/86/865069386.db2.gz ZAXJAUBSMZNTDE-OXJNMPFZSA-N 0 3 401.938 4.234 20 0 HIADHN Cc1ccc(-c2cnc(CCC(=O)NC3CCN([C@@H](C)c4ccncc4)CC3)o2)cc1 ZINC000439743038 865075973 /nfs/dbraw/zinc/07/59/73/865075973.db2.gz ILMZEKXFUUDYFE-IBGZPJMESA-N 0 3 418.541 4.319 20 0 HIADHN COc1cc(CCC(=O)NC2CCN([C@H](C)c3ccncc3)CC2)ccc1Cl ZINC000439746399 865077812 /nfs/dbraw/zinc/07/78/12/865077812.db2.gz NBBGUTZYVBVFPQ-MRXNPFEDSA-N 0 3 401.938 4.018 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)[C@H](OC2CCCC2)c2ccccc2)CC1 ZINC000439748108 865079563 /nfs/dbraw/zinc/07/95/63/865079563.db2.gz SXLCGKLVLBNDKC-NTKDMRAZSA-N 0 3 407.558 4.424 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)[C@H](C)Oc2ccc(Cl)c(Cl)c2)CC1 ZINC000439764205 865088495 /nfs/dbraw/zinc/08/84/95/865088495.db2.gz JPIHXLXXZPMQRE-CABCVRRESA-N 0 3 422.356 4.498 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)Cc2coc3cc4c(cc23)CCC4)CC1 ZINC000439765229 865090253 /nfs/dbraw/zinc/09/02/53/865090253.db2.gz JCFRZAKBFWGJBT-QGZVFWFLSA-N 0 3 403.526 4.201 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)C(C)(C)Oc2cccc(Cl)c2)CC1 ZINC000439764792 865090741 /nfs/dbraw/zinc/09/07/41/865090741.db2.gz IPXGPDYYYJJVGH-INIZCTEOSA-N 0 3 401.938 4.234 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)COc2ccc(Cl)c(Cl)c2)CC1 ZINC000439765471 865091056 /nfs/dbraw/zinc/09/10/56/865091056.db2.gz GOUQUVABNXQGBE-CQSZACIVSA-N 0 3 408.329 4.109 20 0 HIADHN COc1ccc2c(c1)CCC[C@@H]2CC(=O)NC1CCN([C@H](C)c2ccncc2)CC1 ZINC000439767585 865091811 /nfs/dbraw/zinc/09/18/11/865091811.db2.gz KQHUYXDGEMANFE-WIYYLYMNSA-N 0 3 407.558 4.242 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)C2(c3cccc(C(F)(F)F)c3)CC2)CC1 ZINC000439767072 865092840 /nfs/dbraw/zinc/09/28/40/865092840.db2.gz JOKCOIUZVKMHDA-MRXNPFEDSA-N 0 3 417.475 4.474 20 0 HIADHN Cc1cc(CCCC(=O)Nc2ccccc2CN2CCC[C@@H](C(N)=O)C2)c(C)s1 ZINC000439796247 865116017 /nfs/dbraw/zinc/11/60/17/865116017.db2.gz XSDDHBRMKYJGPC-HXUWFJFHSA-N 0 3 413.587 4.024 20 0 HIADHN CCN(C(=O)c1ccc(-c2nnc(C)o2)cc1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000467991465 881837624 /nfs/dbraw/zinc/83/76/24/881837624.db2.gz ZLCRHBQNNOVDKH-VGSWGCGISA-N 0 3 404.514 4.343 20 0 HIADHN CCCCOc1ccc(NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cn1 ZINC000468011782 881850701 /nfs/dbraw/zinc/85/07/01/881850701.db2.gz NDQNYBJYCOQWLQ-UHFFFAOYSA-N 0 3 414.472 4.187 20 0 HIADHN O=C(Nc1cccc(OCc2cn3ccccc3n2)c1)[C@@H]1CCCN1C1CCCC1 ZINC000439951985 865245503 /nfs/dbraw/zinc/24/55/03/865245503.db2.gz BQXGRLAAKFDLND-QFIPXVFZSA-N 0 3 404.514 4.259 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)Nc2cc(-c3ccnn3C)ccc2C)c1 ZINC000439958982 865252263 /nfs/dbraw/zinc/25/22/63/865252263.db2.gz IVZCHYLFDQCMQR-UHFFFAOYSA-N 0 3 405.546 4.300 20 0 HIADHN Cc1ccc(-c2ccnn2C)cc1NC(=O)NC[C@@H]1CCCN1Cc1ccccc1 ZINC000439960368 865253652 /nfs/dbraw/zinc/25/36/52/865253652.db2.gz ZVQBQRLSJWHAGJ-NRFANRHFSA-N 0 3 403.530 4.182 20 0 HIADHN O=C(N[C@H]1CCN(C2CC2)C1)N(Cc1cccc(C(F)(F)F)c1)Cc1ccccn1 ZINC000468019653 881855699 /nfs/dbraw/zinc/85/56/99/881855699.db2.gz BXPHAXGPMLQHRZ-IBGZPJMESA-N 0 3 418.463 4.049 20 0 HIADHN CC(C)C1CCC(N2CCN(C(=O)CCc3nnc(-c4ccsc4)o3)CC2)CC1 ZINC000439989122 865296195 /nfs/dbraw/zinc/29/61/95/865296195.db2.gz LOXRADZEACMBEM-UHFFFAOYSA-N 0 3 416.591 4.090 20 0 HIADHN COc1ccc([C@@H](C)N[C@H]2CC(=O)N(Cc3ccccc3C(F)(F)F)C2)cc1OC ZINC000468031730 881863455 /nfs/dbraw/zinc/86/34/55/881863455.db2.gz XLDOHJYZJNWVSR-PBHICJAKSA-N 0 3 422.447 4.174 20 0 HIADHN COc1ccc([C@@H](C)N[C@@H]2CC(=O)N(Cc3ccccc3C(F)(F)F)C2)cc1OC ZINC000468031731 881863693 /nfs/dbraw/zinc/86/36/93/881863693.db2.gz XLDOHJYZJNWVSR-RHSMWYFYSA-N 0 3 422.447 4.174 20 0 HIADHN CN(C(=O)Cc1ccc(NC(=O)[C@@H]2CCCN2C2CCCC2)cc1)c1ccccc1 ZINC000440122087 865370675 /nfs/dbraw/zinc/37/06/75/865370675.db2.gz XDZUDQPNGWTUNB-QHCPKHFHSA-N 0 3 405.542 4.238 20 0 HIADHN O=C(NCc1ccc(F)cc1)c1ccc(NC(=O)[C@H]2CCCN2C2CCCC2)cc1 ZINC000440122573 865371468 /nfs/dbraw/zinc/37/14/68/865371468.db2.gz PWVWBFVVBDGJAB-JOCHJYFZSA-N 0 3 409.505 4.101 20 0 HIADHN COc1ccc2c(c1)[C@@H](N[C@H](C)CC(=O)Nc1ccc(OC(F)(F)F)cc1)CCO2 ZINC000468033524 881864642 /nfs/dbraw/zinc/86/46/42/881864642.db2.gz LKTBBNDLHHZGBT-ACJLOTCBSA-N 0 3 424.419 4.424 20 0 HIADHN CCc1nc(C)c([C@@H](C)N[C@H]2CC(=O)N(Cc3ccccc3C(F)(F)F)C2)s1 ZINC000468050019 881875227 /nfs/dbraw/zinc/87/52/27/881875227.db2.gz WQHLJKCOOHMOMZ-DOMZBBRYSA-N 0 3 411.493 4.484 20 0 HIADHN CC(=O)Nc1ccc([C@@H](C)N[C@H]2CC(=O)N(Cc3ccccc3C(F)(F)F)C2)cc1 ZINC000468051851 881877629 /nfs/dbraw/zinc/87/76/29/881877629.db2.gz XBHQVEYWEBQHLY-KUHUBIRLSA-N 0 3 419.447 4.116 20 0 HIADHN CC(C)n1cnnc1-c1ccccc1NC(=O)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000440297224 865554810 /nfs/dbraw/zinc/55/48/10/865554810.db2.gz QSHJFKNKIGIKLY-QFIPXVFZSA-N 0 3 418.545 4.485 20 0 HIADHN CN(C)[C@H](CNC(=O)N1CCC[C@@H]1c1nc2ccc(Cl)cc2[nH]1)c1cccs1 ZINC000440499932 865797608 /nfs/dbraw/zinc/79/76/08/865797608.db2.gz ABBDJKABUXDZLW-IAGOWNOFSA-N 0 3 417.966 4.427 20 0 HIADHN Cc1ccc(/C=C/CC(=O)Nc2ccc(C(=O)N(C)[C@H]3CCCN(C)C3)cc2)cc1 ZINC000440566771 865820965 /nfs/dbraw/zinc/82/09/65/865820965.db2.gz SDOIXDMLLYDCGN-DOHLAZSCSA-N 0 3 405.542 4.203 20 0 HIADHN COCc1nc(C(=O)N2CCN(C3CCC(C)CC3)CC2)c(-c2ccccc2)s1 ZINC000440628010 865846423 /nfs/dbraw/zinc/84/64/23/865846423.db2.gz RPRVRIMZKBTRCH-UHFFFAOYSA-N 0 3 413.587 4.293 20 0 HIADHN CCOc1ccccc1OCCN1CCC(C(=O)N(Cc2ccccc2)C2CC2)CC1 ZINC000440650709 865856796 /nfs/dbraw/zinc/85/67/96/865856796.db2.gz JAKMUYLCGMGJEW-UHFFFAOYSA-N 0 3 422.569 4.367 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)c2cc(F)c(F)cc2Br)C1 ZINC000440793504 865915971 /nfs/dbraw/zinc/91/59/71/865915971.db2.gz CQTMAYXLOLOMQF-JSGCOSHPSA-N 0 3 409.274 4.293 20 0 HIADHN CN(C(=O)c1cc(F)c(F)cc1Br)C1CCN(Cc2ccccc2)CC1 ZINC000440843504 865952912 /nfs/dbraw/zinc/95/29/12/865952912.db2.gz HZQFGECCUNVUJH-UHFFFAOYSA-N 0 3 423.301 4.464 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)c2ccc(-c3csc(C)n3)cc2)c1 ZINC000440884266 865980153 /nfs/dbraw/zinc/98/01/53/865980153.db2.gz FAOWMYCYIJTJKG-UHFFFAOYSA-N 0 3 409.555 4.331 20 0 HIADHN Cc1ccccc1-c1nn(-c2ccccc2)cc1C(=O)N[C@H]1C[C@@H](C)N(C2CC2)C1 ZINC000440915813 866010651 /nfs/dbraw/zinc/01/06/51/866010651.db2.gz MDIVNTUXLDBJAI-MOPGFXCFSA-N 0 3 400.526 4.203 20 0 HIADHN Cc1cccc(-c2nnc(-c3ccc(C(=O)N[C@H]4C[C@H](C)N(C5CC5)C4)cc3)o2)c1 ZINC000440925158 866022470 /nfs/dbraw/zinc/02/24/70/866022470.db2.gz LGIBKEGAKSXXDS-JXFKEZNVSA-N 0 3 402.498 4.067 20 0 HIADHN C[C@H]1C[C@H](NC(=O)c2cc(-c3ccc(F)cc3)nc3onc(C4CC4)c32)CN1C1CC1 ZINC000440927529 866024057 /nfs/dbraw/zinc/02/40/57/866024057.db2.gz KUNNQGSDCGJQIH-GUYCJALGSA-N 0 3 420.488 4.261 20 0 HIADHN CN(C)[C@@H](CNC(=O)N1CCC[C@H]1c1nc2ccc(Cl)cc2[nH]1)c1ccsc1 ZINC000441242698 866316552 /nfs/dbraw/zinc/31/65/52/866316552.db2.gz GCFXKLFIYXCFEY-ROUUACIJSA-N 0 3 417.966 4.427 20 0 HIADHN C[C@H](NC(=O)CN1CC[C@H](COCc2ccccc2)C1)c1ccc2c(c1)CCCC2 ZINC000441319811 866390733 /nfs/dbraw/zinc/39/07/33/866390733.db2.gz AMMREWXUOFDYSA-UNMCSNQZSA-N 0 3 406.570 4.281 20 0 HIADHN Cc1ccc([C@@H]2CCC[C@H]2N(C)CC(=O)NC[C@H]2CCN(c3ccccc3)C2)cc1 ZINC000441339843 866411113 /nfs/dbraw/zinc/41/11/13/866411113.db2.gz IYMIJKYRORAVKE-IEZKXTBUSA-N 0 3 405.586 4.206 20 0 HIADHN COc1cc2c(cc1OC)CN(C(=O)CN(C)[C@H]1CCC[C@H]1c1ccc(C)cc1)CC2 ZINC000441352043 866422494 /nfs/dbraw/zinc/42/24/94/866422494.db2.gz JUKISXPFSAMNTG-GOTSBHOMSA-N 0 3 422.569 4.165 20 0 HIADHN COc1ccc(CN(C)C(=O)CN(C)[C@H]2CCC[C@H]2c2ccc(C)cc2)cc1OC ZINC000441361467 866430853 /nfs/dbraw/zinc/43/08/53/866430853.db2.gz SVFILEOIATZZDE-VXKWHMMOSA-N 0 3 410.558 4.239 20 0 HIADHN C[C@@H](C(=O)NCCc1c[nH]c2ccccc12)N1CCC[C@@H]1c1cccc(N(C)C)c1 ZINC000441364926 866433995 /nfs/dbraw/zinc/43/39/95/866433995.db2.gz NUQJMHMYUNIHLM-MHECFPHRSA-N 0 3 404.558 4.118 20 0 HIADHN CN(Cc1ccc(Cl)c(Cl)c1)C(=O)CN1CC[C@@H](COCc2ccccc2)C1 ZINC000441373928 866441330 /nfs/dbraw/zinc/44/13/30/866441330.db2.gz CWWNWDZDGSUABG-LJQANCHMSA-N 0 3 421.368 4.491 20 0 HIADHN COc1cccc(CN(C)C(=O)CN(C)[C@H]2CCC[C@@H]2c2ccc(C)cc2)c1OC ZINC000441376934 866446546 /nfs/dbraw/zinc/44/65/46/866446546.db2.gz LFOAFIYCNYOWKU-YADHBBJMSA-N 0 3 410.558 4.239 20 0 HIADHN C[C@@H](CCC(=O)Nc1ccc(C(=O)N(C)[C@H]2CCCN(C)C2)cc1)c1ccccc1 ZINC000441461528 866537844 /nfs/dbraw/zinc/53/78/44/866537844.db2.gz GUWAVHSSIDJJPD-CVDCTZTESA-N 0 3 407.558 4.375 20 0 HIADHN C[C@@H](CCC(=O)Nc1ccc(C(=O)N(C)[C@@H]2CCCN(C)C2)cc1)c1ccccc1 ZINC000441461529 866538586 /nfs/dbraw/zinc/53/85/86/866538586.db2.gz GUWAVHSSIDJJPD-WMZHIEFXSA-N 0 3 407.558 4.375 20 0 HIADHN CCCN(C(=O)NCc1nnc(C(C)C)s1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000468147274 882007446 /nfs/dbraw/zinc/00/74/46/882007446.db2.gz SXCMKBBFOBJUCT-LJQANCHMSA-N 0 3 415.607 4.248 20 0 HIADHN CCC(C)(C)OCc1cccc(NC(=O)C(=O)Nc2cccc(CN(C)C)c2)c1C ZINC000441853598 866917456 /nfs/dbraw/zinc/91/74/56/866917456.db2.gz ALKTZNYMUNYTKB-UHFFFAOYSA-N 0 3 411.546 4.339 20 0 HIADHN CC[C@@H](C)[C@@H](NC(=O)C(=O)Nc1cccc(CN(C)C)c1)c1ccc(Cl)cc1 ZINC000442144312 867166099 /nfs/dbraw/zinc/16/60/99/867166099.db2.gz HWJOKBREBHZPTB-FOIQADDNSA-N 0 3 401.938 4.244 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)Nc1cc(Cl)cc(F)c1F ZINC000442186987 867210093 /nfs/dbraw/zinc/21/00/93/867210093.db2.gz FONIAGSUGQYSGX-UHFFFAOYSA-N 0 3 403.807 4.492 20 0 HIADHN Cc1ncc(-c2ccc(NC(=O)CCN3CCN(c4cccc(C)c4)CC3)cc2)o1 ZINC000468185760 882061740 /nfs/dbraw/zinc/06/17/40/882061740.db2.gz HSKIPSCGRSIGBL-UHFFFAOYSA-N 0 3 404.514 4.109 20 0 HIADHN Cc1c(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2F)cnn1CCC(C)C ZINC000442231797 867264144 /nfs/dbraw/zinc/26/41/44/867264144.db2.gz VUVWHIJLGZOWLD-UHFFFAOYSA-N 0 3 407.509 4.112 20 0 HIADHN COc1ccc([C@@H](CNC(=O)Nc2cnn(CCC(C)C)c2C)N2CCCC2)cc1 ZINC000442231243 867264633 /nfs/dbraw/zinc/26/46/33/867264633.db2.gz UDGXXZMMPRCSND-JOCHJYFZSA-N 0 3 413.566 4.205 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)Nc3ccc(N4CCCC4)cc3C)CC2)c1 ZINC000468201040 882080068 /nfs/dbraw/zinc/08/00/68/882080068.db2.gz KEZULXNZKWUSQO-UHFFFAOYSA-N 0 3 406.574 4.054 20 0 HIADHN Cc1ccc(OCc2ccccc2)c(NC(=O)N2CCN(C3CCOCC3)C[C@@H]2C)c1 ZINC000442469355 867453287 /nfs/dbraw/zinc/45/32/87/867453287.db2.gz DVRLWCSQLYRMIF-FQEVSTJZSA-N 0 3 423.557 4.291 20 0 HIADHN CSc1ccccc1[C@H](C)NC(=O)N1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000442592681 867549162 /nfs/dbraw/zinc/54/91/62/867549162.db2.gz HCSKAZZEVIUJFC-FHWLQOOXSA-N 0 3 419.635 4.390 20 0 HIADHN CN(C(=O)NCCN1CCN(C)C(C)(C)C1)[C@H](c1ccc(Cl)cc1)C1CCCC1 ZINC000442611026 867557215 /nfs/dbraw/zinc/55/72/15/867557215.db2.gz RDSWIGIRWHIDNY-NRFANRHFSA-N 0 3 421.029 4.239 20 0 HIADHN C[C@@H](c1ccc2ccccc2c1)N(C(=O)NCCN1CCN(C)C(C)(C)C1)C1CC1 ZINC000442618930 867563866 /nfs/dbraw/zinc/56/38/66/867563866.db2.gz HFFOGEQQKUMJIX-IBGZPJMESA-N 0 3 408.590 4.101 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3ncccc3Oc3ccccc3)CC2)C[C@H](C)O1 ZINC000442692248 867626905 /nfs/dbraw/zinc/62/69/05/867626905.db2.gz NMRCWROHIMKGPR-BGYRXZFFSA-N 0 3 423.557 4.225 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3ccncc3Oc3ccccc3)CC2)C[C@H](C)O1 ZINC000442693566 867628521 /nfs/dbraw/zinc/62/85/21/867628521.db2.gz PPFVDEUAGQKAOQ-BGYRXZFFSA-N 0 3 423.557 4.225 20 0 HIADHN COCCC[C@H](NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)nc1)c1ccc(F)cc1 ZINC000442710201 867641131 /nfs/dbraw/zinc/64/11/31/867641131.db2.gz BXYBEFWUBJOTBI-SPEDKVCISA-N 0 3 401.526 4.092 20 0 HIADHN COC1CCN(C2(CNC(=O)CC(C)(C)CC(=O)c3ccccc3)CCCC2)CC1 ZINC000442743742 867659308 /nfs/dbraw/zinc/65/93/08/867659308.db2.gz CIZZOZYJMQASNZ-UHFFFAOYSA-N 0 3 414.590 4.216 20 0 HIADHN COCCC[C@@H](NCc1cccc(NC(=O)[C@@H]2CCCO2)c1)c1ccc(F)cc1 ZINC000442789430 867675769 /nfs/dbraw/zinc/67/57/69/867675769.db2.gz GVNDQRFSXGACEM-YADHBBJMSA-N 0 3 400.494 4.201 20 0 HIADHN CC(C)[C@H]([NH2+][C@@H]1CC[C@H](c2ccc(C(F)(F)F)cc2)C1)c1nc(-c2nc[n-]n2)no1 ZINC000442850435 867697156 /nfs/dbraw/zinc/69/71/56/867697156.db2.gz PKMGLHDLEXKHPL-IMJJTQAJSA-N 0 3 420.439 4.497 20 0 HIADHN COC(=O)[C@@H](C)Sc1ccccc1C(=O)NCCN1CCC2(CCCCC2)CC1 ZINC000442980575 867776652 /nfs/dbraw/zinc/77/66/52/867776652.db2.gz RQBQMDCYZOHOHB-GOSISDBHSA-N 0 3 418.603 4.116 20 0 HIADHN C[C@H](CC(=O)Nc1ccc(NC(=O)C2CC2)cc1)N[C@H]1CCOc2c(F)cccc21 ZINC000443220103 867880124 /nfs/dbraw/zinc/88/01/24/867880124.db2.gz HUXOQXQMOMOSAK-VLIAUNLRSA-N 0 3 411.477 4.005 20 0 HIADHN C[C@@H](CCc1ccccc1F)C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000443334869 867910186 /nfs/dbraw/zinc/91/01/86/867910186.db2.gz NNWIXDPPLMHDBU-SFHVURJKSA-N 0 3 416.512 4.193 20 0 HIADHN CC(C)OCc1ccc(C(=O)NC2CCN(CCOc3ccc(F)cc3)CC2)cc1 ZINC000443340363 867911569 /nfs/dbraw/zinc/91/15/69/867911569.db2.gz AVBAOPZWUSENKP-UHFFFAOYSA-N 0 3 414.521 4.024 20 0 HIADHN C[C@]1(C(=O)NC2CCN(CCOc3ccc(F)cc3)CC2)CCCc2ccccc21 ZINC000443339556 867912215 /nfs/dbraw/zinc/91/22/15/867912215.db2.gz CYVXHYNNDPYZBI-VWLOTQADSA-N 0 3 410.533 4.079 20 0 HIADHN CCn1cc(C(=O)NC2CCN(CCOc3ccc(F)cc3)CC2)c2ccccc21 ZINC000443351821 867920253 /nfs/dbraw/zinc/92/02/53/867920253.db2.gz NKFUJLICEUJLBX-UHFFFAOYSA-N 0 3 409.505 4.074 20 0 HIADHN COc1ccc2c(c1)CCC[C@H]2CNC(=O)N(Cc1ccco1)C1CCN(C)CC1 ZINC000468239206 882134217 /nfs/dbraw/zinc/13/42/17/882134217.db2.gz CWEQYVUREAFMGQ-IBGZPJMESA-N 0 3 411.546 4.014 20 0 HIADHN Cc1cc(NC(=O)Nc2ccc(O)cc2C)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000443594872 868149281 /nfs/dbraw/zinc/14/92/81/868149281.db2.gz RMCMZJGCAYWBDR-IBGZPJMESA-N 0 3 405.502 4.297 20 0 HIADHN CCN1CCN(C(=O)CC2CCN([C@H](C)c3cc(Cl)ccc3Cl)CC2)CC1 ZINC000443610059 868174712 /nfs/dbraw/zinc/17/47/12/868174712.db2.gz NOWUCCYBJNAOAW-MRXNPFEDSA-N 0 3 412.405 4.321 20 0 HIADHN CCN1CCN(C(=O)CC2CCN([C@@H](C)c3cc(Cl)ccc3Cl)CC2)CC1 ZINC000443610058 868175753 /nfs/dbraw/zinc/17/57/53/868175753.db2.gz NOWUCCYBJNAOAW-INIZCTEOSA-N 0 3 412.405 4.321 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)c2ccccc2SCc2cscn2)C[C@@H](C)O1 ZINC000443658045 868258747 /nfs/dbraw/zinc/25/87/47/868258747.db2.gz UROPVOKSUUBHBH-IAGOWNOFSA-N 0 3 419.616 4.055 20 0 HIADHN Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)NCCCCN1C[C@@H](C)O[C@@H](C)C1 ZINC000443669255 868274922 /nfs/dbraw/zinc/27/49/22/868274922.db2.gz XTWOOQXNYZTVNF-GASCZTMLSA-N 0 3 421.994 4.391 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)COc2cc(Cl)c(Cl)cc2Cl)C[C@@H](C)O1 ZINC000443677519 868284197 /nfs/dbraw/zinc/28/41/97/868284197.db2.gz XXRUCVLBZOSFPO-CHWSQXEVSA-N 0 3 423.768 4.031 20 0 HIADHN CCCn1ccc2cc(NC(=O)C(=O)N[C@@H](C)[C@H](c3ccccc3C)N(C)C)ccc21 ZINC000443836186 868366878 /nfs/dbraw/zinc/36/68/78/868366878.db2.gz CCELSKSHAXDVNX-FDDCHVKYSA-N 0 3 420.557 4.106 20 0 HIADHN Cc1ccccc1[C@H]([C@@H](C)NC(=O)C(=O)Nc1ccc(C)c(C(F)(F)F)c1)N(C)C ZINC000443839215 868369017 /nfs/dbraw/zinc/36/90/17/868369017.db2.gz KUYXCRJHCPXNGR-BEFAXECRSA-N 0 3 421.463 4.068 20 0 HIADHN Cc1ccccc1[C@@H]([C@@H](C)NC(=O)C(=O)Nc1ccc(C(F)(F)F)c(C)c1)N(C)C ZINC000443846507 868375507 /nfs/dbraw/zinc/37/55/07/868375507.db2.gz WAOSFULIRHOHPU-DNVCBOLYSA-N 0 3 421.463 4.068 20 0 HIADHN Cc1ccc(C(F)(F)F)cc1NC(=O)C(=O)N[C@@H](C)[C@@H](c1ccccc1C)N(C)C ZINC000443848168 868379163 /nfs/dbraw/zinc/37/91/63/868379163.db2.gz ZXQCTRDNSMBSOJ-KXBFYZLASA-N 0 3 421.463 4.068 20 0 HIADHN CCN1CCCN(C(=O)N[C@H](CC(F)(F)F)c2ccc(C(F)(F)F)cc2)CC1 ZINC000444015385 868538646 /nfs/dbraw/zinc/53/86/46/868538646.db2.gz TUXUDSMGTMZYKU-OAHLLOKOSA-N 0 3 411.390 4.436 20 0 HIADHN COc1ccc(C2(NCc3ccc(OC[C@H]4CCCO4)cc3)CCOCC2)cc1F ZINC000444016095 868540685 /nfs/dbraw/zinc/54/06/85/868540685.db2.gz CNYIKKDMPWUWKW-OAQYLSRUSA-N 0 3 415.505 4.188 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)NCC1(c2ccc(C(F)(F)F)cc2)CC1 ZINC000444150416 868639676 /nfs/dbraw/zinc/63/96/76/868639676.db2.gz XJNCTRPLEUDHEK-UHFFFAOYSA-N 0 3 409.452 4.103 20 0 HIADHN O=C(CN(C[C@@H]1CCCO1)C1CCCC1)N1CC=C(c2c[nH]c3ccccc32)CC1 ZINC000444191043 868658275 /nfs/dbraw/zinc/65/82/75/868658275.db2.gz HTDYETVSNUYVBJ-NRFANRHFSA-N 0 3 407.558 4.207 20 0 HIADHN C[C@H](Oc1cccc2ccccc21)C(=O)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000444274510 868709842 /nfs/dbraw/zinc/70/98/42/868709842.db2.gz CAADKUMTPFVYPH-SFHVURJKSA-N 0 3 404.510 4.203 20 0 HIADHN C[C@@H](Oc1cccc2ccccc21)C(=O)Nc1cccc2c1CCN(CC(C)(C)O)C2 ZINC000444394483 868807579 /nfs/dbraw/zinc/80/75/79/868807579.db2.gz UERHHVUNOSPHSL-GOSISDBHSA-N 0 3 418.537 4.375 20 0 HIADHN O=C(N[C@H]1CCOc2c(F)cccc21)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000468307035 882232378 /nfs/dbraw/zinc/23/23/78/882232378.db2.gz OEXDSQNCFDTJSR-RXVVDRJESA-N 0 3 422.422 4.220 20 0 HIADHN Cc1onc(-c2ccccc2)c1C(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000444539763 868873890 /nfs/dbraw/zinc/87/38/90/868873890.db2.gz FNKNYENJCJDEKR-UHFFFAOYSA-N 0 3 405.498 4.107 20 0 HIADHN CCOc1cc(CN(C)CCC(=O)N2CCc3ccccc3C2)ccc1OC(F)F ZINC000444580485 868889408 /nfs/dbraw/zinc/88/94/08/868889408.db2.gz COVCNWRNRZADQP-UHFFFAOYSA-N 0 3 418.484 4.094 20 0 HIADHN COc1ccc(-c2csc(NC(=O)[C@@H](C)N[C@H]3CC(C)(C)OC3(C)C)n2)cc1 ZINC000444637950 868925383 /nfs/dbraw/zinc/92/53/83/868925383.db2.gz HKGVRIPVRDVURW-DYVFJYSZSA-N 0 3 403.548 4.081 20 0 HIADHN CO[C@@H](C)c1noc(CN2CCCN(Cc3ccc(-c4ccsc4)cc3)CC2)n1 ZINC000444653263 868932897 /nfs/dbraw/zinc/93/28/97/868932897.db2.gz ZFWDPMCKWXZJIH-KRWDZBQOSA-N 0 3 412.559 4.213 20 0 HIADHN CN(C)CCN(C(=O)NCc1cccnc1Oc1cccc(F)c1)C1CCCC1 ZINC000468320517 882251016 /nfs/dbraw/zinc/25/10/16/882251016.db2.gz MGPOFTXKFMVVAV-UHFFFAOYSA-N 0 3 400.498 4.029 20 0 HIADHN O=C(NCc1ccco1)c1cccc(CN2CCC(CO)(Cc3ccccc3)CC2)c1 ZINC000444782199 869001370 /nfs/dbraw/zinc/00/13/70/869001370.db2.gz ICNHVRMRTLTCSJ-UHFFFAOYSA-N 0 3 418.537 4.027 20 0 HIADHN Cc1cc(OC[C@@H](O)CN2CCC[C@@H](c3nccn3C)C2)c(C(C)C)cc1Cl ZINC000444789298 869006147 /nfs/dbraw/zinc/00/61/47/869006147.db2.gz DKVXKGBIDWDKRP-MSOLQXFVSA-N 0 3 405.970 4.125 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N2CCCC[C@H]2c2cccc(Cl)c2)CC1 ZINC000445126067 869232236 /nfs/dbraw/zinc/23/22/36/869232236.db2.gz OSHJHPHGYMAKGA-NRFANRHFSA-N 0 3 407.986 4.466 20 0 HIADHN CC(C)c1n[nH]cc1C(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1 ZINC000445134999 869235840 /nfs/dbraw/zinc/23/58/40/869235840.db2.gz MCVPDTHRZGITAA-UHFFFAOYSA-N 0 3 417.557 4.150 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)[C@H]2C[C@@H]2c2cc(F)c(F)c(F)c2)cc1 ZINC000468341524 882277076 /nfs/dbraw/zinc/27/70/76/882277076.db2.gz VEGRYRNZXLSKDD-LQWHRVPQSA-N 0 3 418.459 4.169 20 0 HIADHN CCO[C@H](CNC(=O)Nc1ccc(CCN2CCSCC2)cc1)c1ccccc1 ZINC000445243556 869300266 /nfs/dbraw/zinc/30/02/66/869300266.db2.gz XKZKFKPCVSKZKU-JOCHJYFZSA-N 0 3 413.587 4.177 20 0 HIADHN CCOc1ccc(NC(=O)Cc2noc(C3CCN(Cc4ccccc4)CC3)n2)cc1 ZINC000445354892 869421015 /nfs/dbraw/zinc/42/10/15/869421015.db2.gz WLIHAEJRWJFBCI-UHFFFAOYSA-N 0 3 420.513 4.029 20 0 HIADHN Fc1cccc(CN2CCC[C@@H](c3nc(-c4ccc(-c5nnco5)cc4)no3)C2)c1 ZINC000445403894 869488228 /nfs/dbraw/zinc/48/82/28/869488228.db2.gz PBZHYXHNIKBGLY-GOSISDBHSA-N 0 3 405.433 4.305 20 0 HIADHN COc1ccc([C@H](CNC(=O)N[C@H](CC(F)(F)F)C(C)C)N2CCCC2)cc1 ZINC000445547051 869605519 /nfs/dbraw/zinc/60/55/19/869605519.db2.gz FLVYCERMYBWZNL-MSOLQXFVSA-N 0 3 401.473 4.108 20 0 HIADHN c1cncc(COc2cccc(-c3noc([C@H]4CCCN4C4CCOCC4)n3)c2)c1 ZINC000445562483 869619134 /nfs/dbraw/zinc/61/91/34/869619134.db2.gz CSIZVJJSDAMTFW-OAQYLSRUSA-N 0 3 406.486 4.027 20 0 HIADHN COc1cc(C)c(C(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)cc1OC ZINC000445643860 869714008 /nfs/dbraw/zinc/71/40/08/869714008.db2.gz CXXGRLYJXOBXAZ-SFHVURJKSA-N 0 3 402.560 4.277 20 0 HIADHN Cc1ccc(Oc2ccc(Cl)cc2NC(=O)CN[C@H]2CCCC[C@@H]2C(N)=O)cc1 ZINC000445766787 869810651 /nfs/dbraw/zinc/81/06/51/869810651.db2.gz MECOMKRCCFXHGN-ROUUACIJSA-N 0 3 415.921 4.013 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)CCCc3ccc(F)c(F)c3)CC2)C[C@H](C)O1 ZINC000445948063 869910455 /nfs/dbraw/zinc/91/04/55/869910455.db2.gz DBCGMERHFHMRAH-ROUUACIJSA-N 0 3 408.533 4.025 20 0 HIADHN Cn1c(CN[C@H]2CCC[C@@H]2c2ccc(C(F)(F)F)cc2)nc2ccccc2c1=O ZINC000445982330 869946114 /nfs/dbraw/zinc/94/61/14/869946114.db2.gz MTHZJRPKZOJJTK-AEFFLSMTSA-N 0 3 401.432 4.378 20 0 HIADHN COc1cc(-c2noc(CN[C@@H]3CCC[C@H]3c3ccccc3)n2)cc(OC)c1OC ZINC000445993717 869956323 /nfs/dbraw/zinc/95/63/23/869956323.db2.gz TYFNEMDZXLOECX-ZWKOTPCHSA-N 0 3 409.486 4.188 20 0 HIADHN Fc1cccc(CN2CCC[C@@H](c3nc(-c4nnc(-c5ccccc5)o4)no3)C2)c1 ZINC000445998983 869962142 /nfs/dbraw/zinc/96/21/42/869962142.db2.gz PZHOULCTPZPZEH-QGZVFWFLSA-N 0 3 405.433 4.305 20 0 HIADHN CC(C)CC1(C(=O)N2CCC[C@H](CN3CCN(c4ccccn4)CC3)C2)CCCC1 ZINC000446145021 870087377 /nfs/dbraw/zinc/08/73/77/870087377.db2.gz KOTHECPIBILIIU-JOCHJYFZSA-N 0 3 412.622 4.049 20 0 HIADHN COc1cc(SC)ccc1NC(=O)N(CCN(C)C)Cc1ccc(F)cc1F ZINC000446400996 870302649 /nfs/dbraw/zinc/30/26/49/870302649.db2.gz RSCRUTZOJMRJRK-UHFFFAOYSA-N 0 3 409.502 4.291 20 0 HIADHN O=C(NCCCCN1CCN(Cc2ccccc2)CC1)Nc1ccsc1Cl ZINC000446480945 870392729 /nfs/dbraw/zinc/39/27/29/870392729.db2.gz VYBOSDXMZFWIBY-UHFFFAOYSA-N 0 3 406.983 4.121 20 0 HIADHN COc1cccc([C@@H](CNC(=O)N[C@H](CC(F)(F)F)C(C)C)N2CCCC2)c1 ZINC000446569786 870481606 /nfs/dbraw/zinc/48/16/06/870481606.db2.gz SBFHVSONTGWTQN-QZTJIDSGSA-N 0 3 401.473 4.108 20 0 HIADHN COc1ccc([C@H](CCn2cncn2)NCc2ccc(OC)cc2C(F)(F)F)cc1 ZINC000446844066 870763433 /nfs/dbraw/zinc/76/34/33/870763433.db2.gz QZICKEQBKXSTAU-FQEVSTJZSA-N 0 3 420.435 4.235 20 0 HIADHN COC1(CO)CCN(Cc2cn(-c3ccccc3)nc2-c2ccc(Cl)cc2)CC1 ZINC000447056158 870936160 /nfs/dbraw/zinc/93/61/60/870936160.db2.gz KMPGXOJTDVJWHC-UHFFFAOYSA-N 0 3 411.933 4.166 20 0 HIADHN COc1ccccc1-c1csc([C@@H]2CCCN(Cc3cccc(C(N)=O)c3)C2)n1 ZINC000447060667 870940314 /nfs/dbraw/zinc/94/03/14/870940314.db2.gz PSVZBAJZDHJDSR-GOSISDBHSA-N 0 3 407.539 4.297 20 0 HIADHN COc1ccccc1-c1csc([C@H]2CCCN(Cc3cc(C(N)=O)cs3)C2)n1 ZINC000447070026 870950162 /nfs/dbraw/zinc/95/01/62/870950162.db2.gz VFOQXHAIAWQAHT-AWEZNQCLSA-N 0 3 413.568 4.359 20 0 HIADHN CCc1ccc(-c2nn(-c3ccccc3)cc2CN2CCC(CO)(OC)CC2)cc1 ZINC000447079024 870965580 /nfs/dbraw/zinc/96/55/80/870965580.db2.gz WKUNRRXTJUABLW-UHFFFAOYSA-N 0 3 405.542 4.075 20 0 HIADHN C[C@H](CC(=O)Nc1ccccc1)NCc1cnn(-c2ccc(Br)cc2)c1 ZINC000447089676 870982868 /nfs/dbraw/zinc/98/28/68/870982868.db2.gz JNXXMDBGFMVMCI-OAHLLOKOSA-N 0 3 413.319 4.142 20 0 HIADHN Cc1sc([C@H](C)NC(=O)N2CC[C@H](N3CC=CC3)C2)nc1-c1ccc(Cl)cc1 ZINC000447118967 871020508 /nfs/dbraw/zinc/02/05/08/871020508.db2.gz HXPYOEXKUIJXMI-KSSFIOAISA-N 0 3 416.978 4.489 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)Nc1ccc(Cl)c(Br)c1 ZINC000447135412 871037177 /nfs/dbraw/zinc/03/71/77/871037177.db2.gz CMSOXORXUXQUDC-UHFFFAOYSA-N 0 3 411.731 4.093 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)N[C@@H](C)c2cccc(N3CCCC3)c2)c1 ZINC000447232818 871118480 /nfs/dbraw/zinc/11/84/80/871118480.db2.gz ZVFLEJIFKWLRPA-NRFANRHFSA-N 0 3 408.590 4.430 20 0 HIADHN Cc1nc(-c2ccc(CCNC(=O)N(CCN(C)C)Cc3ccco3)s2)cs1 ZINC000447236385 871122216 /nfs/dbraw/zinc/12/22/16/871122216.db2.gz KYSPQHGXGQKAAM-UHFFFAOYSA-N 0 3 418.588 4.089 20 0 HIADHN C[C@@H](C1CCCCC1)N(C)CC(=O)Nc1ccccc1I ZINC000447397425 871308528 /nfs/dbraw/zinc/30/85/28/871308528.db2.gz OWUZNJBOJYFMFL-ZDUSSCGKSA-N 0 3 400.304 4.130 20 0 HIADHN Cc1c(F)cccc1NC(=O)CCN1CCN(c2cccc3cnccc32)C[C@H]1C ZINC000447400232 871310224 /nfs/dbraw/zinc/31/02/24/871310224.db2.gz NMBQDSFNKOPJQF-QGZVFWFLSA-N 0 3 406.505 4.222 20 0 HIADHN CC(C)NS(=O)(=O)Cc1ccccc1CN[C@H]1C[C@@H](C(C)C)c2ccccc21 ZINC000447538175 871403252 /nfs/dbraw/zinc/40/32/52/871403252.db2.gz AXCHIDBKPDBXAK-GOTSBHOMSA-N 0 3 400.588 4.489 20 0 HIADHN COC(=O)c1coc([C@@H](C)NC[C@@H]2CCN(c3cccc(Br)c3)C2)c1 ZINC000447545261 871412718 /nfs/dbraw/zinc/41/27/18/871412718.db2.gz WZTFLNPSTXZSNE-KGLIPLIRSA-N 0 3 407.308 4.006 20 0 HIADHN C[C@@H](N[C@@H](C)c1cccc(N2CCCS2(=O)=O)c1)c1ccc(Br)cc1 ZINC000447561181 871451105 /nfs/dbraw/zinc/45/11/05/871451105.db2.gz YAEIDTSPUFGQQC-CABCVRRESA-N 0 3 423.376 4.401 20 0 HIADHN CCOc1ccc([C@@H](CC)NCc2ccc(C)c(S(C)(=O)=O)c2)cc1OCC ZINC000447576284 871476552 /nfs/dbraw/zinc/47/65/52/871476552.db2.gz ARYGXTHDVKSXQK-LJQANCHMSA-N 0 3 405.560 4.437 20 0 HIADHN Cn1nccc1N1CCC[C@H](N[C@@H](c2ccc(F)cc2)c2cnc3ccccc3c2)C1 ZINC000447578555 871478167 /nfs/dbraw/zinc/47/81/67/871478167.db2.gz LBPJJULAFQOKDJ-DHLKQENFSA-N 0 3 415.516 4.455 20 0 HIADHN CC(=O)c1cc(C(=O)Nc2c(C)cnn2[C@H]2CCN(Cc3ccccc3)C2)ccc1C ZINC000447581415 871486752 /nfs/dbraw/zinc/48/67/52/871486752.db2.gz SWDALNRAURXIDL-QFIPXVFZSA-N 0 3 416.525 4.402 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)N1CCC(F)(c2ccccc2)CC1 ZINC000447610390 871520787 /nfs/dbraw/zinc/52/07/87/871520787.db2.gz HRFMQMUEWMYTJX-UHFFFAOYSA-N 0 3 409.549 4.076 20 0 HIADHN Cc1cc(NC(=O)C2CCN(Cc3ccc(Oc4cccc(F)c4)cc3)CC2)no1 ZINC000447748581 871692378 /nfs/dbraw/zinc/69/23/78/871692378.db2.gz XCBPUHUBZHCELA-UHFFFAOYSA-N 0 3 409.461 4.765 20 0 HIADHN Cc1ccc(-c2cccc(CNC(=O)N(CCN(C)C)Cc3ccccn3)c2)cc1 ZINC000468523432 882537852 /nfs/dbraw/zinc/53/78/52/882537852.db2.gz LYVYSPCXUQUXTC-UHFFFAOYSA-N 0 3 402.542 4.330 20 0 HIADHN C[C@H](N[C@H](C[C@@H]1CCOC1)c1ccccc1)C(=O)Nc1ccc(OC(F)F)cc1 ZINC000447885922 871800604 /nfs/dbraw/zinc/80/06/04/871800604.db2.gz LQRLWXZXGZLILI-TWOQFEAHSA-N 0 3 404.457 4.373 20 0 HIADHN O=C1[C@H](N[C@@H](c2ccccc2)[C@H]2CCCc3ccccc32)CCN1C1CCOCC1 ZINC000447888378 871801951 /nfs/dbraw/zinc/80/19/51/871801951.db2.gz JUIIXVGQXJTSJF-GVAUOCQISA-N 0 3 404.554 4.217 20 0 HIADHN Cc1nn(C)c(CNCC2(c3cccc(Br)c3)CC2)c1Br ZINC000447928284 871815808 /nfs/dbraw/zinc/81/58/08/871815808.db2.gz DCWQAKKRGHDNAE-UHFFFAOYSA-N 0 3 413.157 4.075 20 0 HIADHN C[C@H]1OCC[C@@]1(O)CN(Cc1ccccc1)Cc1ccccc1OCC(F)(F)F ZINC000447929736 871817072 /nfs/dbraw/zinc/81/70/72/871817072.db2.gz UWFFRNREDZFHSN-DYESRHJHSA-N 0 3 409.448 4.170 20 0 HIADHN O=C(CN1CCC[C@@H]2CCC[C@H]21)N(Cc1nnc(-c2ccccc2Cl)o1)C1CC1 ZINC000448023834 871864838 /nfs/dbraw/zinc/86/48/38/871864838.db2.gz VFZWIPIVHGGBKB-HNAYVOBHSA-N 0 3 414.937 4.146 20 0 HIADHN CSc1nc(C2CC2)nc(C)c1C(=O)NC[C@@H](C(C)C)N1CCc2ccccc2C1 ZINC000468532153 882558629 /nfs/dbraw/zinc/55/86/29/882558629.db2.gz WBNYQYFUMANMBG-FQEVSTJZSA-N 0 3 424.614 4.197 20 0 HIADHN O=S(=O)(c1c(Cl)ccc2ccccc21)N1CC[C@H]2[C@H](CCCN2C2CC2)C1 ZINC000448163630 872040169 /nfs/dbraw/zinc/04/01/69/872040169.db2.gz IETWPOPMOOSIPA-UZLBHIALSA-N 0 3 404.963 4.131 20 0 HIADHN CCOc1c(Br)cc(CN(CCOC)[C@H]2CCCSC2)cc1OC ZINC000448361525 872310540 /nfs/dbraw/zinc/31/05/40/872310540.db2.gz XJUPCUXIGTVVEP-HNNXBMFYSA-N 0 3 418.397 4.200 20 0 HIADHN CCN(C(=O)Nc1cc(OC)c(Cl)cc1OC)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000460115715 872584304 /nfs/dbraw/zinc/58/43/04/872584304.db2.gz WCHZIUUVZKJCQT-QGZVFWFLSA-N 0 3 417.937 4.486 20 0 HIADHN CCN(C(=O)Nc1ccc(NC(=O)C2CC2)cc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000460126780 872604062 /nfs/dbraw/zinc/60/40/62/872604062.db2.gz ZEDUCVQQOKPYRI-QFIPXVFZSA-N 0 3 406.530 4.163 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)N1CCCC[C@H]1c1nnc(C2CCC2)o1 ZINC000460163061 872707353 /nfs/dbraw/zinc/70/73/53/872707353.db2.gz BEKDXBRYWNFDRH-RTWAWAEBSA-N 0 3 423.561 4.411 20 0 HIADHN C[C@@H](CC(=O)NCCCCN1CCN(c2ccccc2)CC1)Cc1cccc(F)c1 ZINC000468574803 882644168 /nfs/dbraw/zinc/64/41/68/882644168.db2.gz DQSFYKQMAHRZMQ-OAQYLSRUSA-N 0 3 411.565 4.113 20 0 HIADHN Cc1ccccc1[C@H]1CN(C(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)[C@H](C)CO1 ZINC000460380079 873020328 /nfs/dbraw/zinc/02/03/28/873020328.db2.gz LAVGWTJXENSMRI-PXDATVDWSA-N 0 3 421.585 4.128 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)Nc3ccc(F)cc3OC(F)F)cc2)CC1 ZINC000460484523 873171568 /nfs/dbraw/zinc/17/15/68/873171568.db2.gz FWHDFAHUJRREAD-UHFFFAOYSA-N 0 3 407.436 4.210 20 0 HIADHN CC(C)Cn1c(Cc2ccccn2)nnc1N1C[C@H](C)N(Cc2ccccc2)C[C@@H]1C ZINC000460604035 873345871 /nfs/dbraw/zinc/34/58/71/873345871.db2.gz TYTWXLGPFZCPRC-SFTDATJTSA-N 0 3 418.589 4.019 20 0 HIADHN O=S1(=O)CCCN1c1ccc(CN[C@H]2CCc3c2cc(Cl)cc3Cl)cc1 ZINC000460676285 873424064 /nfs/dbraw/zinc/42/40/64/873424064.db2.gz WPLHLJCKHJYIMF-IBGZPJMESA-N 0 3 411.354 4.310 20 0 HIADHN C[C@@H](CN1CCCCC1)NC(=O)c1ccc(Oc2cccc(Cl)c2Cl)nn1 ZINC000460730143 873540724 /nfs/dbraw/zinc/54/07/24/873540724.db2.gz ZPZOYSPUQYFNOO-ZDUSSCGKSA-N 0 3 409.317 4.180 20 0 HIADHN C[C@H](C(=O)NCCCCN1CCN(Cc2ccccc2)CC1)c1cccc(Cl)c1 ZINC000460741452 873567451 /nfs/dbraw/zinc/56/74/51/873567451.db2.gz SGTZZZLIGCILBI-FQEVSTJZSA-N 0 3 413.993 4.158 20 0 HIADHN C[C@@H]1CC[C@H](CNC(=O)N(Cc2ccccc2Br)C2CCN(C)CC2)C1 ZINC000460743913 873573251 /nfs/dbraw/zinc/57/32/51/873573251.db2.gz XVBFILOHIIHJTN-SJORKVTESA-N 0 3 422.411 4.491 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)c1ccc(OCc2ccccn2)cc1 ZINC000460784071 873640324 /nfs/dbraw/zinc/64/03/24/873640324.db2.gz RCIGHOAURYSYCI-OAQYLSRUSA-N 0 3 407.539 4.289 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)c1c[nH]cc1-c1ccc2c(c1)OCCO2 ZINC000460785389 873644641 /nfs/dbraw/zinc/64/46/41/873644641.db2.gz XCJYGEMMOCNCST-LJQANCHMSA-N 0 3 423.538 4.081 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)c2ccc(OCc3ccccn3)cc2)N(C)C)cc1 ZINC000460788307 873649416 /nfs/dbraw/zinc/64/94/16/873649416.db2.gz GXYSJKXZFMAUDQ-XMMPIXPASA-N 0 3 403.526 4.256 20 0 HIADHN C[C@@H](CNC(=O)c1ccc(Oc2cccc(Cl)c2Cl)nn1)N1CCC(C)CC1 ZINC000460925641 873830050 /nfs/dbraw/zinc/83/00/50/873830050.db2.gz OJVAVBOWZUKOFQ-AWEZNQCLSA-N 0 3 423.344 4.426 20 0 HIADHN O=C(NC[C@@H]1CCCCN1Cc1ccccc1)c1ccc(OCc2ccccn2)cc1 ZINC000460928974 873833033 /nfs/dbraw/zinc/83/30/33/873833033.db2.gz VQRXZPNEOMAAAG-DEOSSOPVSA-N 0 3 415.537 4.445 20 0 HIADHN C[C@@H](NCc1ccc(N2CCCS2(=O)=O)cc1)c1cc2cc(Cl)ccc2o1 ZINC000461087321 874000945 /nfs/dbraw/zinc/00/09/45/874000945.db2.gz YKSPEEALXCXURT-CQSZACIVSA-N 0 3 404.919 4.477 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)N1CCCC2(CCCCC2)CC1 ZINC000468695506 882817507 /nfs/dbraw/zinc/81/75/07/882817507.db2.gz SOBSEPQWFJJMOQ-UHFFFAOYSA-N 0 3 413.606 4.289 20 0 HIADHN CCOc1cc(CN2CCCC[C@@H](CCOC)C2)cc(Br)c1OC ZINC000468697693 882819010 /nfs/dbraw/zinc/81/90/10/882819010.db2.gz WSKOCQFWXQMYMD-HNNXBMFYSA-N 0 3 400.357 4.495 20 0 HIADHN COc1ccc([C@@H](Cc2ccccc2C)NC(=O)CN2[C@H](C)CC[C@@H]2C)cc1OC ZINC000468704487 882822690 /nfs/dbraw/zinc/82/26/90/882822690.db2.gz VIQMLTBEKDSBLB-XQBPLPMBSA-N 0 3 410.558 4.285 20 0 HIADHN O=C(CCC(=O)N1C[C@H]2CCN(Cc3ccccc3)C[C@H]2C1)c1ccc2c(c1)CCC2 ZINC000461439509 874492782 /nfs/dbraw/zinc/49/27/82/874492782.db2.gz RUFCLBAASREBPF-RPBOFIJWSA-N 0 3 416.565 4.119 20 0 HIADHN Cc1nn(C)c(C)c1[C@H](C)C(=O)N1CCN(Cc2ccccc2)C2(CCCCC2)C1 ZINC000461578381 874682963 /nfs/dbraw/zinc/68/29/63/874682963.db2.gz LNKHLRLXWLSOES-IBGZPJMESA-N 0 3 408.590 4.188 20 0 HIADHN CCc1nc2c(s1)[C@@H](N(C)C(=O)N[C@H](C)CN(C)Cc1ccccc1)CCC2 ZINC000461725309 874872240 /nfs/dbraw/zinc/87/22/40/874872240.db2.gz KUMIYUJLMOHXOD-APWZRJJASA-N 0 3 400.592 4.245 20 0 HIADHN CN(C)C[C@@H](NC(=O)NC[C@H]1CC[C@H](c2ccccc2)O1)c1ccc(Cl)cc1 ZINC000461773418 874902351 /nfs/dbraw/zinc/90/23/51/874902351.db2.gz OTVXACKVDUTVDQ-NJDAHSKKSA-N 0 3 401.938 4.162 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2NC(=O)c2ccc(Nc3ccncc3)cc2)C[C@@H](C)O1 ZINC000461875335 875028437 /nfs/dbraw/zinc/02/84/37/875028437.db2.gz GJYSWMWCXNGYKR-RTBURBONSA-N 0 3 416.525 4.109 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3ncc(Cc4ccccc4F)s3)cc2)CC1 ZINC000461887794 875038259 /nfs/dbraw/zinc/03/82/59/875038259.db2.gz SSVKQZHJHVKNDJ-UHFFFAOYSA-N 0 3 424.545 4.267 20 0 HIADHN Cc1ccc(CN2CCSCC2)cc1NC(=O)c1ccc(Nc2ccncc2)cc1 ZINC000468853660 882891062 /nfs/dbraw/zinc/89/10/62/882891062.db2.gz FRLHWWZWTHLJRX-UHFFFAOYSA-N 0 3 418.566 4.357 20 0 HIADHN CN1CC[C@H](NC(=O)N[C@@H]2CCCc3cn(C4CCCC4)nc32)[C@@H]1c1ccccc1 ZINC000461944104 875076935 /nfs/dbraw/zinc/07/69/35/875076935.db2.gz ADLDOAMQDMWJNV-GIWBLDEGSA-N 0 3 407.562 4.120 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)N[C@H]2CCCc3cn(C4CCCC4)nc32)CN1Cc1ccccc1 ZINC000461965260 875089941 /nfs/dbraw/zinc/08/99/41/875089941.db2.gz MYKSSXFBMJIPGO-AAIMPIBUSA-N 0 3 421.589 4.338 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N[C@@H]2CCCc3cn(C4CCCC4)nc32)N(C)C)cc1 ZINC000462007786 875127933 /nfs/dbraw/zinc/12/79/33/875127933.db2.gz NGAUCWYAMDKWCP-YADHBBJMSA-N 0 3 409.578 4.286 20 0 HIADHN Cc1nc(C(F)(F)F)sc1C(=O)NC[C@@H]1CCCN(C)[C@@H]1c1cccs1 ZINC000462137179 875236722 /nfs/dbraw/zinc/23/67/22/875236722.db2.gz ASHCLLBAFDZIQX-AAEUAGOBSA-N 0 3 403.495 4.345 20 0 HIADHN CN(C(=O)N[C@@H]1CCCc2cn(C3CCCC3)nc21)[C@H]1CCN(Cc2ccccc2)C1 ZINC000462154730 875251411 /nfs/dbraw/zinc/25/14/11/875251411.db2.gz JZHRMPIQJRIJJF-XZOQPEGZSA-N 0 3 421.589 4.292 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)C1(c2cccc(Cl)c2)CCOCC1 ZINC000462162027 875257649 /nfs/dbraw/zinc/25/76/49/875257649.db2.gz ZKJDZPWDHYSKRK-PGRDOPGGSA-N 0 3 412.961 4.025 20 0 HIADHN Cc1nc(COc2cccc(C(=O)N[C@H]3CN(Cc4ccccc4)C[C@H]3C)c2)cs1 ZINC000462166201 875263840 /nfs/dbraw/zinc/26/38/40/875263840.db2.gz FAXKTBKSUZXPQX-HXOBKFHXSA-N 0 3 421.566 4.281 20 0 HIADHN Cc1ccc(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)cc1NC(=O)c1ccco1 ZINC000462185853 875289079 /nfs/dbraw/zinc/28/90/79/875289079.db2.gz BMJFCTAYVYFKMS-PGRDOPGGSA-N 0 3 417.509 4.091 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1ccc(NC(=O)c2ccccc2)cc1 ZINC000462192709 875298960 /nfs/dbraw/zinc/29/89/60/875298960.db2.gz UIDNLQDITVXFBX-NTKDMRAZSA-N 0 3 413.521 4.189 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1ccc(NC(=O)c2ccccc2)cc1 ZINC000462192710 875299103 /nfs/dbraw/zinc/29/91/03/875299103.db2.gz UIDNLQDITVXFBX-YADARESESA-N 0 3 413.521 4.189 20 0 HIADHN C[C@H](C(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C)c1ccc(Br)s1 ZINC000462194543 875302920 /nfs/dbraw/zinc/30/29/20/875302920.db2.gz IPEZIEANLRYTOP-DZKIICNBSA-N 0 3 407.377 4.251 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)c2cc(-c3ccccc3C(F)(F)F)on2)o1 ZINC000462197372 875306560 /nfs/dbraw/zinc/30/65/60/875306560.db2.gz UCTUOOMLEOWRCV-UHFFFAOYSA-N 0 3 421.419 4.466 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)NC[C@@H](Cc1ccccc1)C(F)(F)F ZINC000462223812 875333630 /nfs/dbraw/zinc/33/36/30/875333630.db2.gz QMUAIWYAZFVSEM-HXUWFJFHSA-N 0 3 407.480 4.181 20 0 HIADHN Cc1ccc(NC(=O)C(C)C)cc1NC(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C ZINC000462239439 875354093 /nfs/dbraw/zinc/35/40/93/875354093.db2.gz FYRRFVQUEAPSED-AVRDEDQJSA-N 0 3 408.546 4.232 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)Nc1cccc(NC(=O)c2ccoc2)c1 ZINC000462256965 875379857 /nfs/dbraw/zinc/37/98/57/875379857.db2.gz UZYKQCJGJCRBHL-JTSKRJEESA-N 0 3 418.497 4.174 20 0 HIADHN COc1ccc(NC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)c(Br)c1 ZINC000462263141 875388644 /nfs/dbraw/zinc/38/86/44/875388644.db2.gz WGWQUOZBCDEQAC-AUUYWEPGSA-N 0 3 418.335 4.100 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Nc1cccc(-c2noc(C3CC3)n2)c1 ZINC000462271393 875399167 /nfs/dbraw/zinc/39/91/67/875399167.db2.gz SZITTYNDIGAJKI-IIBYNOLFSA-N 0 3 417.513 4.256 20 0 HIADHN CC(C)Cn1ncc(NC(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)c1C(F)F ZINC000462273318 875401073 /nfs/dbraw/zinc/40/10/73/875401073.db2.gz BQYPDQZARSVQFD-YJBOKZPZSA-N 0 3 405.493 4.119 20 0 HIADHN CCN1CC[C@@H](N(C)S(=O)(=O)c2ccc3nc(C(C)(C)C)sc3c2)C[C@@H]1C ZINC000462334380 875450863 /nfs/dbraw/zinc/45/08/63/875450863.db2.gz JMCOTVCNDRWMPN-LSDHHAIUSA-N 0 3 409.621 4.087 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)[C@@H](C)c2cccc(Br)c2)c1 ZINC000462345411 875458742 /nfs/dbraw/zinc/45/87/42/875458742.db2.gz XQWPSEQAEHXQHD-INIZCTEOSA-N 0 3 419.363 4.152 20 0 HIADHN CCN(C(=O)c1ccnc(N2CCC[C@H](C)C2)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000462491418 875602005 /nfs/dbraw/zinc/60/20/05/875602005.db2.gz RALMKBUZAWAZHB-NZQKXSOJSA-N 0 3 406.574 4.055 20 0 HIADHN Cc1cccc2c1ncc(C)c2NCc1csc(CNC(=O)c2ccccc2)n1 ZINC000462507563 875624854 /nfs/dbraw/zinc/62/48/54/875624854.db2.gz ZJOWHTTWZFPOMC-UHFFFAOYSA-N 0 3 402.523 4.272 20 0 HIADHN COc1ccccc1-c1ccc(CNCc2cccc(N3CCCS3(=O)=O)c2)cc1 ZINC000462542940 875664451 /nfs/dbraw/zinc/66/44/51/875664451.db2.gz PWDJIGPPZRDXQV-UHFFFAOYSA-N 0 3 422.550 4.192 20 0 HIADHN Brc1cc2c(c(CNCCc3nc(-c4ccccn4)cs3)c1)OCC2 ZINC000462547119 875671018 /nfs/dbraw/zinc/67/10/18/875671018.db2.gz HZDCJUYFDVSXBW-UHFFFAOYSA-N 0 3 416.344 4.235 20 0 HIADHN Clc1cc(Br)ccc1CNC[C@H](c1cccs1)N1CCOCC1 ZINC000462659198 875764474 /nfs/dbraw/zinc/76/44/74/875764474.db2.gz QCWFCWHCWUNHPJ-MRXNPFEDSA-N 0 3 415.784 4.327 20 0 HIADHN CCOc1c(Br)cc(Br)cc1CNCC[C@@H](O)C(C)C ZINC000462729809 875806073 /nfs/dbraw/zinc/80/60/73/875806073.db2.gz CSZLYTSDALFWGZ-CQSZACIVSA-N 0 3 409.162 4.107 20 0 HIADHN COc1cccc(Cl)c1CNC[C@@H](CO)Cc1ccccc1OC(F)(F)F ZINC000462740512 875811136 /nfs/dbraw/zinc/81/11/36/875811136.db2.gz RTCDVFNLFAHOLX-ZDUSSCGKSA-N 0 3 403.828 4.188 20 0 HIADHN O=C(CCc1cncc2ccccc21)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000462778803 875834946 /nfs/dbraw/zinc/83/49/46/875834946.db2.gz SLRNGLTURIQEEP-UHFFFAOYSA-N 0 3 403.526 4.010 20 0 HIADHN COC(=O)c1cc(CN[C@H](Cc2ccc(OC)c(OC)c2)c2ccccc2)n(C)c1C ZINC000462798264 875847603 /nfs/dbraw/zinc/84/76/03/875847603.db2.gz MOYIRUFHCMGQQJ-JOCHJYFZSA-N 0 3 422.525 4.211 20 0 HIADHN COc1ccc(C[C@H](NCc2c3c(nn2C)CCCC3)c2ccc(OC)cc2)cc1 ZINC000462811711 875854652 /nfs/dbraw/zinc/85/46/52/875854652.db2.gz KTLBMYFPCDCKJR-DEOSSOPVSA-N 0 3 405.542 4.390 20 0 HIADHN Cc1ccc(S(=O)(=O)C[C@H](C)N[C@H]2C[C@H](c3ccc(Br)cc3)C2)cc1 ZINC000462822854 875861759 /nfs/dbraw/zinc/86/17/59/875861759.db2.gz XEQFCUQCEIBZSE-IEZWGBDMSA-N 0 3 422.388 4.456 20 0 HIADHN Cc1nc2ccc(Br)cc2c(N2CCC[C@@H](C(=O)N3CCCC3)C2)c1C ZINC000462834165 875868925 /nfs/dbraw/zinc/86/89/25/875868925.db2.gz OXDMVDKOSQXRKB-MRXNPFEDSA-N 0 3 416.363 4.453 20 0 HIADHN CCc1ccc([C@H](N[C@H]2CCO[C@H](C3CC3)C2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000462838713 875873436 /nfs/dbraw/zinc/87/34/36/875873436.db2.gz ZHISVQJYFZFNNA-XWGVYQGASA-N 0 3 413.583 4.289 20 0 HIADHN C[C@@H](NC[C@H](O)CN1CCc2ccccc2C1)c1csc(-c2ccccc2F)n1 ZINC000462885106 875911881 /nfs/dbraw/zinc/91/18/81/875911881.db2.gz UDJSVPPZJLXFBZ-APWZRJJASA-N 0 3 411.546 4.019 20 0 HIADHN CCN(CC)C(=O)Nc1ccc([C@H](C)N[C@@H]2CC(=O)N(c3ccccc3F)C2)cc1 ZINC000462944617 875966542 /nfs/dbraw/zinc/96/65/42/875966542.db2.gz FVVNGNHKRMLDMZ-QFBILLFUSA-N 0 3 412.509 4.156 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)N[C@@H]1CCO[C@H](c2ccccc2)C1 ZINC000463006320 876020199 /nfs/dbraw/zinc/02/01/99/876020199.db2.gz BDIKYFFRCDWYRT-HUVFLSCGSA-N 0 3 407.558 4.213 20 0 HIADHN CC[C@H](O[C@@H]1CCC[C@@H](C)C1)C(=O)Nc1ccc(CN2CCN(CC)CC2)cc1 ZINC000463106805 876145058 /nfs/dbraw/zinc/14/50/58/876145058.db2.gz BDUFKUDOBLVEBF-PTUXOGIPSA-N 0 3 401.595 4.137 20 0 HIADHN CC(C)Cn1ccc2c1cccc2C(=O)N(C)C1CCN(CCc2ccccn2)CC1 ZINC000468934694 882998302 /nfs/dbraw/zinc/99/83/02/882998302.db2.gz JZCFVIFPNFJFQM-UHFFFAOYSA-N 0 3 418.585 4.471 20 0 HIADHN CN(Cc1nc2ccc(Br)cc2o1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000463114733 876155109 /nfs/dbraw/zinc/15/51/09/876155109.db2.gz VAJFDZQIKLMEIY-QGZVFWFLSA-N 0 3 400.320 4.297 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)N[C@@H]1CCO[C@@H](c2ccccc2)C1 ZINC000463229399 876285845 /nfs/dbraw/zinc/28/58/45/876285845.db2.gz XUJOAHFHFZYVNR-FGZHOGPDSA-N 0 3 415.965 4.334 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)N[C@H](C)c2ccc(Cl)c3ccccc32)CC1 ZINC000463263475 876322103 /nfs/dbraw/zinc/32/21/03/876322103.db2.gz SUACKXPOKPGSDT-ZWKOTPCHSA-N 0 3 416.997 4.127 20 0 HIADHN COC(=O)CCCN1CCC(Nc2cccc(OCc3ccc(F)cc3)c2)CC1 ZINC000463279175 876335875 /nfs/dbraw/zinc/33/58/75/876335875.db2.gz IPCRYUKMXMBOFN-UHFFFAOYSA-N 0 3 400.494 4.234 20 0 HIADHN CO[C@H](CN[C@@H](C)c1ccc(Br)cc1OCCCO)c1ccccc1 ZINC000463359510 876413075 /nfs/dbraw/zinc/41/30/75/876413075.db2.gz QQVBDGZQOBSAHD-MGPUTAFESA-N 0 3 408.336 4.249 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](NCCc2ccc(F)c(F)c2)c2ccc(F)cc2)c1 ZINC000468973669 883040392 /nfs/dbraw/zinc/04/03/92/883040392.db2.gz MPBMMMXANNMAEY-JOCHJYFZSA-N 0 3 419.468 4.429 20 0 HIADHN Cc1nn(C)c(Sc2ccccc2)c1C(=O)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000463503417 876563287 /nfs/dbraw/zinc/56/32/87/876563287.db2.gz GPOWINDEGCZTIM-NRFANRHFSA-N 0 3 420.582 4.447 20 0 HIADHN COc1ccc(-c2ncc(C(=O)N(CCCc3ccccc3)CCN(C)C)s2)cc1 ZINC000463514071 876578310 /nfs/dbraw/zinc/57/83/10/876578310.db2.gz PRLHZVPACXEQSW-UHFFFAOYSA-N 0 3 423.582 4.455 20 0 HIADHN Cc1nn(C)c(Sc2ccccc2)c1C(=O)NC[C@H](c1ccc(C)cc1)N(C)C ZINC000463533391 876611069 /nfs/dbraw/zinc/61/10/69/876611069.db2.gz PVHKDCDNWASZIV-HXUWFJFHSA-N 0 3 408.571 4.221 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)c1cc2cc(C(F)(F)F)ccc2n1C ZINC000463535349 876613857 /nfs/dbraw/zinc/61/38/57/876613857.db2.gz ZOMQBNASUWQLGR-UHFFFAOYSA-N 0 3 403.448 4.401 20 0 HIADHN CCc1ccc(-c2ccc(C(=O)N3CCC(CN4C[C@@H](C)O[C@@H](C)C4)CC3)o2)cc1 ZINC000463558314 876645422 /nfs/dbraw/zinc/64/54/22/876645422.db2.gz PBVBHFBIEPTWPA-KDURUIRLSA-N 0 3 410.558 4.470 20 0 HIADHN Cc1nn(C)c(Sc2ccccc2)c1C(=O)N[C@@H]1C[C@H](C)N(Cc2ccccc2)C1 ZINC000463576603 876674010 /nfs/dbraw/zinc/67/40/10/876674010.db2.gz ODMJIGUJEGOOSH-FXAWDEMLSA-N 0 3 420.582 4.273 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)[C@@H]3C[C@@H]3c3cc(F)c(F)c(F)c3)c2)CC1 ZINC000463595197 876706563 /nfs/dbraw/zinc/70/65/63/876706563.db2.gz LEVRZQKEILZTKP-RTBURBONSA-N 0 3 417.475 4.377 20 0 HIADHN NC(=O)[C@@H]1CCCN(Cc2ccccc2NC(=O)C2CCC(c3ccccc3)CC2)C1 ZINC000463643872 876762498 /nfs/dbraw/zinc/76/24/98/876762498.db2.gz NEALIJLBHQZPOF-YDPRHXJPSA-N 0 3 419.569 4.296 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)N3C[C@@H](C)C[C@@H]3c3ccccc3F)CC2)c1 ZINC000469000023 883065488 /nfs/dbraw/zinc/06/54/88/883065488.db2.gz QTUKVEBSLNUVQL-GBXCKJPGSA-N 0 3 409.549 4.256 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)N3C[C@@H](C)C[C@H]3c3ccccc3F)CC2)c1 ZINC000469000351 883067169 /nfs/dbraw/zinc/06/71/69/883067169.db2.gz QTUKVEBSLNUVQL-RDPSFJRHSA-N 0 3 409.549 4.256 20 0 HIADHN CN(CCNC(=O)Nc1cccc(-c2ncc3n2CCCC3)c1)Cc1ccccc1 ZINC000463713954 876833268 /nfs/dbraw/zinc/83/32/68/876833268.db2.gz JHNATGVLVLKQTA-UHFFFAOYSA-N 0 3 403.530 4.140 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)CCc1nc(-c2ccsc2)no1 ZINC000469002473 883069899 /nfs/dbraw/zinc/06/98/99/883069899.db2.gz PHXUWCVMVNNDMG-LJQANCHMSA-N 0 3 412.559 4.004 20 0 HIADHN COc1ccc(Cn2nc(C)c(CNCc3ccc(Cn4cccn4)cc3)c2C)cc1 ZINC000463743843 876866243 /nfs/dbraw/zinc/86/62/43/876866243.db2.gz FJGXYMRURYZXSI-UHFFFAOYSA-N 0 3 415.541 4.091 20 0 HIADHN C[C@@H]1CCN(C(=O)[C@H]2C[C@H]2c2cc(F)c(F)c(F)c2)CCN1Cc1ccccc1 ZINC000463769777 876891550 /nfs/dbraw/zinc/89/15/50/876891550.db2.gz PLMHAORDFMGNJH-MNEFBYGVSA-N 0 3 402.460 4.330 20 0 HIADHN Cn1cc(NC(=O)N2CCN(Cc3ccccc3)C3(CCCCC3)C2)c(C2CC2)n1 ZINC000463813594 876928098 /nfs/dbraw/zinc/92/80/98/876928098.db2.gz BZAQHFSWCMGNJW-UHFFFAOYSA-N 0 3 407.562 4.350 20 0 HIADHN CC(C)CN(CCN(C)C)C(=O)c1ccc(-c2noc(-c3ccc(F)cc3)n2)cc1 ZINC000463876150 876996484 /nfs/dbraw/zinc/99/64/84/876996484.db2.gz HKQSMGBDLYSOID-UHFFFAOYSA-N 0 3 410.493 4.203 20 0 HIADHN COc1cccc([C@@H](Cc2cc(C)cc(C)c2)N[C@H](C)C(=O)NCC(F)(F)F)c1 ZINC000463918166 877039797 /nfs/dbraw/zinc/03/97/97/877039797.db2.gz BHVBHBTXRRQSTI-OXQOHEQNSA-N 0 3 408.464 4.252 20 0 HIADHN COc1ccc([C@@H](CNC(=O)N[C@@H](C)c2c(F)cccc2OC)N2CCCC2)cc1 ZINC000463956130 877078320 /nfs/dbraw/zinc/07/83/20/877078320.db2.gz WYYAWEQYOVWJFJ-OXJNMPFZSA-N 0 3 415.509 4.040 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1ccc2c(c1)nn(C)c2C)c1cccc(OC)c1 ZINC000464062125 877208347 /nfs/dbraw/zinc/20/83/47/877208347.db2.gz ALFIPXWYPKKIGP-JOCHJYFZSA-N 0 3 409.534 4.095 20 0 HIADHN Cc1noc2nc(-c3ccc(C)cc3)cc(C(=O)N(CCN(C)C)Cc3ccco3)c12 ZINC000464270109 877454059 /nfs/dbraw/zinc/45/40/59/877454059.db2.gz YMQMOVRGGXDLJN-UHFFFAOYSA-N 0 3 418.497 4.304 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)NCc2cccc(-c3cccnc3)c2)CN1Cc1ccccc1 ZINC000464303765 877494250 /nfs/dbraw/zinc/49/42/50/877494250.db2.gz DAHVEFHXTQMJDX-NTKDMRAZSA-N 0 3 400.526 4.211 20 0 HIADHN C[C@@H](NC(=O)N[C@@H]1CCCc2sc(-c3ccc(F)cc3)nc21)C1=CCN(C)CC1 ZINC000464308136 877498716 /nfs/dbraw/zinc/49/87/16/877498716.db2.gz OQHUHCCPOJTXCC-RDTXWAMCSA-N 0 3 414.550 4.276 20 0 HIADHN Cc1nn(C)c(Sc2ccccc2)c1C(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000464402116 877604152 /nfs/dbraw/zinc/60/41/52/877604152.db2.gz XIGKVQDUTUDZCT-HXUWFJFHSA-N 0 3 420.582 4.226 20 0 HIADHN CCN(C(=O)N[C@@H]1CCOc2c(F)ccc(F)c21)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000464507766 877730448 /nfs/dbraw/zinc/73/04/48/877730448.db2.gz CQABBKHZCMOGHP-YLJYHZDGSA-N 0 3 415.484 4.094 20 0 HIADHN CC[C@@H](C)c1ccc(S(=O)(=O)[N-]c2ccc(C)c(NC(=O)CC[NH+](C)C)c2)cc1 ZINC000464543132 877757638 /nfs/dbraw/zinc/75/76/38/877757638.db2.gz KVZHUAFJAUNQNH-MRXNPFEDSA-N 0 3 417.575 4.200 20 0 HIADHN COc1cc(Cl)c(Br)cc1C(=O)N(CC(C)C)C1CCN(C)CC1 ZINC000464566291 877785317 /nfs/dbraw/zinc/78/53/17/877785317.db2.gz ABQLLBTZDNPRKU-UHFFFAOYSA-N 0 3 417.775 4.304 20 0 HIADHN CC(C)CN(C(=O)c1ccnc(Oc2ccc(F)cc2F)c1)C1CCN(C)CC1 ZINC000464575693 877798995 /nfs/dbraw/zinc/79/89/95/877798995.db2.gz BQDMWXRUAVNWIR-UHFFFAOYSA-N 0 3 403.473 4.345 20 0 HIADHN CC(C)CN(C(=O)[C@@H](C)Cc1ccc(F)c(Br)c1)C1CCN(C)CC1 ZINC000464580672 877804283 /nfs/dbraw/zinc/80/42/83/877804283.db2.gz KSMGROFFVYTFIT-HNNXBMFYSA-N 0 3 413.375 4.346 20 0 HIADHN CC(C)CN(C(=O)c1cc(Br)cc(OC(C)C)c1)C1CCN(C)CC1 ZINC000464580249 877804676 /nfs/dbraw/zinc/80/46/76/877804676.db2.gz ZXNQWGHGLVKNHR-UHFFFAOYSA-N 0 3 411.384 4.429 20 0 HIADHN Cc1cc(C(F)(F)F)ncc1NC(=O)c1ccc(N2CCN(C(C)C)CC2)cc1 ZINC000464657333 877878918 /nfs/dbraw/zinc/87/89/18/877878918.db2.gz AMDSLYRYRDVBLY-UHFFFAOYSA-N 0 3 406.452 4.192 20 0 HIADHN COc1cc(F)c(F)cc1NC(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000464669484 877889335 /nfs/dbraw/zinc/88/93/35/877889335.db2.gz ZPGUURUILRUPOU-IBGZPJMESA-N 0 3 414.374 4.367 20 0 HIADHN C[C@@H](C(=O)NCCc1c[nH]c2ccccc12)N1CC[C@H](CSc2ccccc2)C1 ZINC000464754049 877991029 /nfs/dbraw/zinc/99/10/29/877991029.db2.gz CTFVIUXHZVFXIP-OALUTQOASA-N 0 3 407.583 4.329 20 0 HIADHN CCS[C@H]1CC[C@H](N(C)CC(=O)Nc2ccc3nc(C(F)(F)F)[nH]c3c2)C1 ZINC000464780635 878025975 /nfs/dbraw/zinc/02/59/75/878025975.db2.gz VXIYHEXDUNTBHE-STQMWFEESA-N 0 3 400.470 4.126 20 0 HIADHN COc1cccc(CN(C)C(=O)CN(C)[C@@H](Cc2ccc(F)cc2)C(C)C)c1OC ZINC000464786360 878033479 /nfs/dbraw/zinc/03/34/79/878033479.db2.gz XFJAZTGHNDZBNQ-NRFANRHFSA-N 0 3 416.537 4.000 20 0 HIADHN Cc1ccc(OC(F)F)c(CNC(=O)N2CCCN(Cc3ccccc3)CC2)c1 ZINC000464815097 878067023 /nfs/dbraw/zinc/06/70/23/878067023.db2.gz SCAGFAUQCKRBCZ-UHFFFAOYSA-N 0 3 403.473 4.014 20 0 HIADHN C[C@H]1CCCN1CC(=O)N[C@H](c1ccccc1)c1ccc2[nH]c(C(F)(F)F)nc2c1 ZINC000464840375 878109871 /nfs/dbraw/zinc/10/98/71/878109871.db2.gz UODXDGWEBKBQSB-VBKZILBWSA-N 0 3 416.447 4.272 20 0 HIADHN C[C@H]1CCCN1CC(=O)N[C@H](c1ccccc1)c1ccc2nc(C(F)(F)F)[nH]c2c1 ZINC000464840375 878109880 /nfs/dbraw/zinc/10/98/80/878109880.db2.gz UODXDGWEBKBQSB-VBKZILBWSA-N 0 3 416.447 4.272 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1C(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC000464891062 878192135 /nfs/dbraw/zinc/19/21/35/878192135.db2.gz IVRRHIOOKLRFDP-LJQANCHMSA-N 0 3 402.542 4.226 20 0 HIADHN C[C@@H]1CCN(C(=O)c2cc(C3CC3)nn2-c2ccccc2)CCN1Cc1ccccc1 ZINC000464898362 878205940 /nfs/dbraw/zinc/20/59/40/878205940.db2.gz USYZQDHQZIRPNL-HXUWFJFHSA-N 0 3 414.553 4.486 20 0 HIADHN CC(=O)c1cccc(OCCCC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)c1 ZINC000464903205 878214882 /nfs/dbraw/zinc/21/48/82/878214882.db2.gz VAUVEKFONFCFAW-HXUWFJFHSA-N 0 3 408.542 4.171 20 0 HIADHN Cc1cc(C(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)c(C)n1Cc1ccccn1 ZINC000464904363 878219328 /nfs/dbraw/zinc/21/93/28/878219328.db2.gz ZAIZUPGLZXXAHQ-HXUWFJFHSA-N 0 3 416.569 4.285 20 0 HIADHN Cc1noc2nc(C3CC3)cc(C(=O)N3CC[C@H](C)N(Cc4ccccc4)CC3)c12 ZINC000464905814 878219663 /nfs/dbraw/zinc/21/96/63/878219663.db2.gz LANKKSJOAMIMMI-INIZCTEOSA-N 0 3 404.514 4.145 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)NCCc1ccccc1OC(F)(F)F ZINC000465081161 878443311 /nfs/dbraw/zinc/44/33/11/878443311.db2.gz TXPNKOAECQJURU-UHFFFAOYSA-N 0 3 406.404 4.366 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)c1cc(Oc2ccccc2)ccn1 ZINC000465178882 878566373 /nfs/dbraw/zinc/56/63/73/878566373.db2.gz YGSBBBOUTOXDJJ-UHFFFAOYSA-N 0 3 411.452 4.356 20 0 HIADHN C[C@H](SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)N1CC[C@H]2CC[C@@H](C1)N2C ZINC000465223848 878639676 /nfs/dbraw/zinc/63/96/76/878639676.db2.gz HFQXWNNPKUWNLA-QGTPRVQTSA-N 0 3 419.978 4.312 20 0 HIADHN O=C(Nc1ccc(Cl)c(-n2nnnc2C2CC2)c1)c1cccc(CN2CCCC2)c1 ZINC000465277249 878710597 /nfs/dbraw/zinc/71/05/97/878710597.db2.gz VVUSXFZCQDLAAC-UHFFFAOYSA-N 0 3 422.920 4.041 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)c1cnc(-c2ccc(F)c(F)c2)s1 ZINC000503400677 912380443 /nfs/dbraw/zinc/38/04/43/912380443.db2.gz ZAKOHSSDBAZSLM-UHFFFAOYSA-N 0 3 407.511 4.354 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N3CCN(CC4CC4)c4ccccc43)cc2)CC1 ZINC000465378440 878820959 /nfs/dbraw/zinc/82/09/59/878820959.db2.gz RXJUOIYCDUTWIW-UHFFFAOYSA-N 0 3 418.585 4.094 20 0 HIADHN C[C@H](CNC(=O)NC[C@H](c1cccs1)N1CCCC1)Oc1ccccc1Cl ZINC000465424665 878854599 /nfs/dbraw/zinc/85/45/99/878854599.db2.gz PJUKRRFKGJWTKR-NVXWUHKLSA-N 0 3 407.967 4.305 20 0 HIADHN C[C@H](NC(=O)NC[C@@H](c1ccccc1)N1CCCC1)c1nc(-c2cccc(F)c2)no1 ZINC000465426660 878855952 /nfs/dbraw/zinc/85/59/52/878855952.db2.gz HPRCMBONDWXQGO-JXFKEZNVSA-N 0 3 423.492 4.073 20 0 HIADHN CCO[C@H](C)c1nc(CN(C)C(=O)NC[C@@H](c2ccccc2)N2CCCC2)cs1 ZINC000465436606 878869864 /nfs/dbraw/zinc/86/98/64/878869864.db2.gz AVJORTVURWGPNP-XLIONFOSSA-N 0 3 416.591 4.219 20 0 HIADHN C[C@H](NC(=O)NC[C@@H](c1ccccc1)N1CCCC1)c1nc(C2CCCCC2)no1 ZINC000465443414 878874770 /nfs/dbraw/zinc/87/47/70/878874770.db2.gz SXJZYBJEVUQZBZ-PXNSSMCTSA-N 0 3 411.550 4.315 20 0 HIADHN CN(C)[C@H](CNC(=O)N(Cc1ccc2c(c1)CCO2)C1CCCC1)c1ccccc1 ZINC000465452467 878882178 /nfs/dbraw/zinc/88/21/78/878882178.db2.gz HDZICZCNKXVMKC-HSZRJFAPSA-N 0 3 407.558 4.379 20 0 HIADHN CC1CCN(CCSc2nnc(SCCN3CCC(C)CC3)s2)CC1 ZINC000465471469 878908423 /nfs/dbraw/zinc/90/84/23/878908423.db2.gz SKBGENGGHAGQCT-UHFFFAOYSA-N 0 3 400.683 4.186 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N[C@@H](c1nc(C)cs1)C1CC1)c1cccc(OC)c1 ZINC000465507051 878945626 /nfs/dbraw/zinc/94/56/26/878945626.db2.gz AWDAMNLIDXBYFX-VQTJNVASSA-N 0 3 416.591 4.294 20 0 HIADHN CC[C@@H](CNC(=O)NCc1ccc(-c2cccnc2)cc1)N1CCc2ccccc2C1 ZINC000465544134 879007143 /nfs/dbraw/zinc/00/71/43/879007143.db2.gz PRKNJSGQBKFDFF-VWLOTQADSA-N 0 3 414.553 4.385 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)CSc1ccc(O)cc1 ZINC000465551868 879017161 /nfs/dbraw/zinc/01/71/61/879017161.db2.gz ZKAJZQLNQZDZSL-UHFFFAOYSA-N 0 3 412.477 4.094 20 0 HIADHN C[C@@H]1CN(C(=O)N[C@H](CN2CCCC2)c2ccccc2)C[C@@H](c2ccc(F)cc2)O1 ZINC000465605995 879097860 /nfs/dbraw/zinc/09/78/60/879097860.db2.gz QJISIEGHFFUCHV-YSZBQJHXSA-N 0 3 411.521 4.134 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)N[C@@H](CCC(C)C)c2ccc(Cl)cc2)CC1 ZINC000465657819 879185875 /nfs/dbraw/zinc/18/58/75/879185875.db2.gz JYVQEPQHPCLHKT-KNQAVFIVSA-N 0 3 423.045 4.390 20 0 HIADHN C[C@H]1CCN(C(=O)NCCCCOCCc2ccccc2)CCN1Cc1ccccc1 ZINC000465665218 879198423 /nfs/dbraw/zinc/19/84/23/879198423.db2.gz ZEIXRWNWMIAAOI-QHCPKHFHSA-N 0 3 423.601 4.332 20 0 HIADHN C[C@H]1CCN(C(=O)NCc2ccc(Br)s2)CCN1Cc1ccccc1 ZINC000465692979 879246028 /nfs/dbraw/zinc/24/60/28/879246028.db2.gz NSBVPIMQBBKADR-HNNXBMFYSA-N 0 3 422.392 4.317 20 0 HIADHN Cc1cccc(-c2nn(-c3ccc(F)cc3)cc2CN2CCC(n3cncn3)CC2)c1 ZINC000512370882 921111418 /nfs/dbraw/zinc/11/14/18/921111418.db2.gz YYHAGLUUJQTQSO-UHFFFAOYSA-N 0 3 416.504 4.415 20 0 HIADHN C[C@@H](NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1)c1nc(C2CCCCC2)no1 ZINC000465703295 879267952 /nfs/dbraw/zinc/26/79/52/879267952.db2.gz YEPTVVQXDOETMS-YLJYHZDGSA-N 0 3 411.550 4.142 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N[C@@H](C)c2cccc(-n3cccn3)c2)C1 ZINC000465758404 879352793 /nfs/dbraw/zinc/35/27/93/879352793.db2.gz PAAQACGYAIQITL-NNMXDRDESA-N 0 3 403.530 4.068 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)NCc2c(F)cccc2OC(F)F)C1 ZINC000465759449 879354597 /nfs/dbraw/zinc/35/45/97/879354597.db2.gz PBCFPDUESOGLTB-GOEBONIOSA-N 0 3 407.436 4.062 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)NCCc2c[nH]c3ccc(Cl)cc23)C1 ZINC000465765091 879364244 /nfs/dbraw/zinc/36/42/44/879364244.db2.gz VAWQIESTARWBES-OXJNMPFZSA-N 0 3 410.949 4.499 20 0 HIADHN Cc1ccc(COc2ccc(C[C@@H](C)NC(=O)N3CC[C@H](N4CC=CC4)C3)cc2)cc1 ZINC000465851389 879493992 /nfs/dbraw/zinc/49/39/92/879493992.db2.gz UPYABSATKHYZMZ-QPPBQGQZSA-N 0 3 419.569 4.161 20 0 HIADHN CN(C)CCN(C[C@H]1CCCO1)C(=O)N[C@@H](c1ccc(Cl)cc1)C1CCCC1 ZINC000465890265 879546235 /nfs/dbraw/zinc/54/62/35/879546235.db2.gz LMWAQTIUMDHMLY-NHCUHLMSSA-N 0 3 407.986 4.324 20 0 HIADHN Cc1sc(CNC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)nc1C(C)C ZINC000465899879 879560162 /nfs/dbraw/zinc/56/01/62/879560162.db2.gz ZRLQVBUPUXWNSD-KRWDZBQOSA-N 0 3 400.592 4.381 20 0 HIADHN Cc1ccccc1[C@H](NC(=O)NC[C@H](C)CN1CCN(C)CC1)[C@H]1CCC[C@@H](C)C1 ZINC000465935177 879600603 /nfs/dbraw/zinc/60/06/03/879600603.db2.gz UPLKTJDAZPVPGW-CETSDDCJSA-N 0 3 414.638 4.045 20 0 HIADHN C[C@H](CNC(=O)N[C@@H](CC(C)(C)C)c1ccc(Cl)cc1)CN1CCN(C)CC1 ZINC000465964865 879632438 /nfs/dbraw/zinc/63/24/38/879632438.db2.gz CRNTWQURJIYINW-XLIONFOSSA-N 0 3 409.018 4.000 20 0 HIADHN C[C@@H]1CCN(C(=O)NC[C@H]2CCCO[C@H]2C(C)(C)C)CCN1Cc1ccccc1 ZINC000465982287 879652738 /nfs/dbraw/zinc/65/27/38/879652738.db2.gz IEGYNCBGUANAJC-CEMLEFRQSA-N 0 3 401.595 4.134 20 0 HIADHN COc1cccc([C@H](NC(=O)N2CCN(C)CC[C@H]2C)c2ccccc2Cl)c1 ZINC000466041222 879729766 /nfs/dbraw/zinc/72/97/66/879729766.db2.gz OPUSVGKWQGFXHA-IERDGZPVSA-N 0 3 401.938 4.174 20 0 HIADHN CC[C@H](C)[C@H](NC(=O)N1CCN(CC2CCOCC2)CC1)c1ccc(Cl)cc1 ZINC000466062668 879759620 /nfs/dbraw/zinc/75/96/20/879759620.db2.gz CFJPJDCGQUTDDI-UWJYYQICSA-N 0 3 407.986 4.181 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCc3coc(-c4ccccc4)n3)c(C)c2)CC1 ZINC000466068991 879768962 /nfs/dbraw/zinc/76/89/62/879768962.db2.gz ZORMQQICNSGTNF-UHFFFAOYSA-N 0 3 419.529 4.114 20 0 HIADHN CC[C@H](C)[C@H](NC(=O)NC[C@H](C)CN1CCN(CC)CC1)c1ccc(Cl)cc1 ZINC000466085600 879804669 /nfs/dbraw/zinc/80/46/69/879804669.db2.gz MZAKKTGXUNPCHF-WFXMLNOXSA-N 0 3 409.018 4.000 20 0 HIADHN CCCN(C(=O)NC[C@H](C)CN1CCN(CC)CC1)[C@H](C)c1cc2ccccc2o1 ZINC000466108141 879824063 /nfs/dbraw/zinc/82/40/63/879824063.db2.gz GGXDMUUIRGZOIU-VQTJNVASSA-N 0 3 414.594 4.189 20 0 HIADHN CCCN(C(=O)NC[C@@H](C)CN1CCN(CC)CC1)[C@H](C)c1cc2ccccc2o1 ZINC000466108142 879824312 /nfs/dbraw/zinc/82/43/12/879824312.db2.gz GGXDMUUIRGZOIU-WOJBJXKFSA-N 0 3 414.594 4.189 20 0 HIADHN C[C@H](CNC(=O)N(Cc1cccc2ccccc21)C1CCCC1)CN1CCN(C)CC1 ZINC000466150524 879856960 /nfs/dbraw/zinc/85/69/60/879856960.db2.gz YTNPCPUOZWJRQH-OAQYLSRUSA-N 0 3 422.617 4.178 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)N[C@H](c1ccccc1)c1cccnc1 ZINC000503471832 912506734 /nfs/dbraw/zinc/50/67/34/912506734.db2.gz IWIXSWMRDTVNSR-DNQXCXABSA-N 0 3 400.526 4.307 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)N[C@H]2COc3c2ccc(Cl)c3Cl)CC1 ZINC000466222393 879920361 /nfs/dbraw/zinc/92/03/61/879920361.db2.gz WWEYWNXWLRZPJT-KRWDZBQOSA-N 0 3 424.328 4.326 20 0 HIADHN COc1ccc(-c2ccc(CNC(=O)N(CCN(C)C)Cc3ccccn3)cc2)cc1 ZINC000466224135 879922565 /nfs/dbraw/zinc/92/25/65/879922565.db2.gz IREZLOHDJITPRW-UHFFFAOYSA-N 0 3 418.541 4.031 20 0 HIADHN COc1ccc([C@@H](CNC(=O)Nc2ccc(N3CCCCC3)nc2)N2CCCC2)cc1 ZINC000503493857 912540177 /nfs/dbraw/zinc/54/01/77/912540177.db2.gz LAPTWUDUPAHSBZ-JOCHJYFZSA-N 0 3 423.561 4.039 20 0 HIADHN C[C@@H](CNC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C)c1ccc(F)cc1F ZINC000466424799 880198365 /nfs/dbraw/zinc/19/83/65/880198365.db2.gz GZPPCETUUJLPEX-ZWKOTPCHSA-N 0 3 401.501 4.374 20 0 HIADHN COc1cc(CN[C@@H]2CC(=O)N(Cc3ccccc3C(F)(F)F)C2)ccc1SC ZINC000466445321 880221870 /nfs/dbraw/zinc/22/18/70/880221870.db2.gz GGYZAWOBPNWLBR-MRXNPFEDSA-N 0 3 424.488 4.327 20 0 HIADHN CCOc1cc(CN[C@@H]2CC(=O)N(Cc3ccccc3C(F)(F)F)C2)ccc1OC ZINC000466453717 880232664 /nfs/dbraw/zinc/23/26/64/880232664.db2.gz ITBDJBFNGNQXMP-QGZVFWFLSA-N 0 3 422.447 4.003 20 0 HIADHN Clc1cc(CN[C@H]2CCCc3sccc32)ccc1OCCN1CCOCC1 ZINC000466455344 880234730 /nfs/dbraw/zinc/23/47/30/880234730.db2.gz LPFGKKZAIVVXHT-IBGZPJMESA-N 0 3 406.979 4.280 20 0 HIADHN CCOc1cc(CN[C@H]2CCCc3sccc32)ccc1O[C@H](C)C(=O)N(C)C ZINC000466461283 880242279 /nfs/dbraw/zinc/24/22/79/880242279.db2.gz GYMVTRXBXAVRLD-QAPCUYQASA-N 0 3 402.560 4.170 20 0 HIADHN Cc1nc(COc2ccc(CN[C@@H]3CC(=O)N(Cc4ccccc4)[C@@H]3C)cc2)cs1 ZINC000466476859 880258374 /nfs/dbraw/zinc/25/83/74/880258374.db2.gz BHOPGFGJAPKBSS-UZUQRXQVSA-N 0 3 421.566 4.310 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)N[C@H](c1ccccc1)c1cccnc1 ZINC000503503106 912549643 /nfs/dbraw/zinc/54/96/43/912549643.db2.gz MMGFWNRYVRDXBO-RBBKRZOGSA-N 0 3 406.555 4.369 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)Nc2ccc(OC[C@H]3CCCO3)cc2)CN1Cc1ccccc1 ZINC000466514318 880287604 /nfs/dbraw/zinc/28/76/04/880287604.db2.gz KXSFVRZVDDGNHO-RZFNWQHOSA-N 0 3 409.530 4.029 20 0 HIADHN Cc1cccc(NC(=O)N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)c1C(=O)N1CCCC1 ZINC000466515771 880290099 /nfs/dbraw/zinc/29/00/99/880290099.db2.gz PHYLXHNRAVHIKK-FPOVZHCZSA-N 0 3 420.557 4.016 20 0 HIADHN COc1ccc(NC(=O)N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)c(C(F)(F)F)c1 ZINC000466521207 880297139 /nfs/dbraw/zinc/29/71/39/880297139.db2.gz GRNDUOLMQBEVOF-HOCLYGCPSA-N 0 3 407.436 4.499 20 0 HIADHN Cc1cccc(C(=O)N2CCCC2)c1NC(=O)N[C@H]1C[C@H](C)N(Cc2ccccc2)C1 ZINC000466522202 880298474 /nfs/dbraw/zinc/29/84/74/880298474.db2.gz JTSAPKKVOOPEKM-FPOVZHCZSA-N 0 3 420.557 4.016 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)N2CCC(c3c[nH]c4ncccc34)CC2)CN1Cc1ccccc1 ZINC000466523152 880299887 /nfs/dbraw/zinc/29/98/87/880299887.db2.gz UFVVJMXRWNTDEG-NQIIRXRSSA-N 0 3 417.557 4.115 20 0 HIADHN C[C@H]1C[C@H](NC(=O)Nc2ccc(NC(=O)c3ccco3)cc2)CN1Cc1ccccc1 ZINC000466538878 880313784 /nfs/dbraw/zinc/31/37/84/880313784.db2.gz JMLFOFQAERAPNK-UWJYYQICSA-N 0 3 418.497 4.316 20 0 HIADHN Cc1nn(-c2ccncc2)cc1CNc1ccc(CN(C)C)c(Br)c1 ZINC000466724750 880510871 /nfs/dbraw/zinc/51/08/71/880510871.db2.gz LFGCKSPULCSWLB-UHFFFAOYSA-N 0 3 400.324 4.012 20 0 HIADHN COc1ccc2[nH]cc(C3CCN(Cc4cc(-c5cnn(C)c5C)no4)CC3)c2c1 ZINC000466839960 880609057 /nfs/dbraw/zinc/60/90/57/880609057.db2.gz FEBSQCCFKWMIGI-UHFFFAOYSA-N 0 3 405.502 4.253 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)NC[C@H]2CCCO[C@@H]2c2ccc(C)cc2)o1 ZINC000466952761 880732978 /nfs/dbraw/zinc/73/29/78/880732978.db2.gz GVDJTBVKFWHSLT-FYYLOGMGSA-N 0 3 413.562 4.138 20 0 HIADHN C[C@H](NC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C)c1ccc(-n2cccn2)cc1 ZINC000466956923 880740751 /nfs/dbraw/zinc/74/07/51/880740751.db2.gz COLBVTROMPEALX-RTWAWAEBSA-N 0 3 417.557 4.239 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)C1(Cc2ccccc2)CCC1 ZINC000466991535 880803443 /nfs/dbraw/zinc/80/34/43/880803443.db2.gz PLDIBDLUZILJOV-UHFFFAOYSA-N 0 3 405.586 4.118 20 0 HIADHN C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)[C@@H](Sc1ccc(F)c(F)c1)c1ccccc1 ZINC000467023316 880824050 /nfs/dbraw/zinc/82/40/50/880824050.db2.gz KPJQMDNTADMINF-IFZYUDKTSA-N 0 3 402.510 4.397 20 0 HIADHN Cc1ccc(C(=O)N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)cc1NC(=O)c1ccco1 ZINC000467024040 880824985 /nfs/dbraw/zinc/82/49/85/880824985.db2.gz SFIIMUOVWCRUOI-WIYYLYMNSA-N 0 3 417.509 4.233 20 0 HIADHN CN(C)[C@@H](CNC(=O)NCc1cc2cc(Br)ccc2[nH]1)c1ccccc1 ZINC000467041422 880838275 /nfs/dbraw/zinc/83/82/75/880838275.db2.gz UCVAFSJSQLAPAK-IBGZPJMESA-N 0 3 415.335 4.033 20 0 HIADHN Cc1cc(CSc2ncccc2C(=O)N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)no1 ZINC000467048958 880841572 /nfs/dbraw/zinc/84/15/72/880841572.db2.gz UXCDLPKYVWCRRL-LPHOPBHVSA-N 0 3 422.554 4.063 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)Cc2coc(-c3ccc(Cl)cc3)n2)CN1Cc1ccccc1 ZINC000467049970 880842082 /nfs/dbraw/zinc/84/20/82/880842082.db2.gz YLYGNOIHMCCNRY-OXQOHEQNSA-N 0 3 409.917 4.317 20 0 HIADHN C[C@H]1CN(C2CC2)C[C@H]1NC(=O)Cc1csc(-c2ccc(Cl)cc2Cl)n1 ZINC000467050091 880842120 /nfs/dbraw/zinc/84/21/20/880842120.db2.gz WTGHUOCNPVPRQU-APPDUMDISA-N 0 3 410.370 4.258 20 0 HIADHN Cc1noc(C)c1COc1cccc(C(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)c1 ZINC000467054422 880844400 /nfs/dbraw/zinc/84/44/00/880844400.db2.gz STBGLAMFYWYWDD-HTAPYJJXSA-N 0 3 419.525 4.263 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)Nc2cccc(NC(=O)c3ccoc3)c2)CN1Cc1ccccc1 ZINC000467114005 880872734 /nfs/dbraw/zinc/87/27/34/880872734.db2.gz KBTNSVXPRLOCCT-HTAPYJJXSA-N 0 3 418.497 4.316 20 0 HIADHN COCc1ccc([C@H]2CCCN2CCC(=O)Nc2cccc(Br)c2)o1 ZINC000467120957 880876925 /nfs/dbraw/zinc/87/69/25/880876925.db2.gz RXKJQXKVSXNMDF-QGZVFWFLSA-N 0 3 407.308 4.354 20 0 HIADHN O=C(CN1CCC(c2ncc[nH]2)CC1)N1CCC[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000467155718 880890126 /nfs/dbraw/zinc/89/01/26/880890126.db2.gz RZTFHHNDGLJFGA-SFHVURJKSA-N 0 3 407.345 4.260 20 0 HIADHN Cc1nn(C)c(=O)c(-c2nc(CN3CCC[C@]3(C)Cc3ccccc3)cs2)c1C ZINC000467235126 880962308 /nfs/dbraw/zinc/96/23/08/880962308.db2.gz IOLFSBWMIAAYEA-HSZRJFAPSA-N 0 3 408.571 4.118 20 0 HIADHN C[C@H](NCC(=O)Nc1cccc(CN2CCSCC2)c1)c1cc2ccccc2o1 ZINC000467278922 881023344 /nfs/dbraw/zinc/02/33/44/881023344.db2.gz BMZHFKVAOSZWPF-KRWDZBQOSA-N 0 3 409.555 4.271 20 0 HIADHN COC[C@H]1CCCCN([C@@H](C)C(=O)Nc2ccc3c(c2)OC2(CCCCC2)O3)C1 ZINC000467298614 881045747 /nfs/dbraw/zinc/04/57/47/881045747.db2.gz FSENUTANRQIQCQ-ROUUACIJSA-N 0 3 402.535 4.194 20 0 HIADHN COc1cc2c(cc1F)CC[C@H]2N[C@@H](C)c1cc(F)ccc1N1CCN(C)CC1 ZINC000467341315 881092257 /nfs/dbraw/zinc/09/22/57/881092257.db2.gz DLCNQOCWRSGXAZ-YCRPNKLZSA-N 0 3 401.501 4.063 20 0 HIADHN Brc1cccc([C@@H](NCc2cccc3c2OCO3)C2CCOCC2)c1 ZINC000467401924 881185574 /nfs/dbraw/zinc/18/55/74/881185574.db2.gz DMYGENMXTDPVFS-IBGZPJMESA-N 0 3 404.304 4.435 20 0 HIADHN CN(C(=O)CN[C@@H](c1cccc(Br)c1)C1CCOCC1)C1CCCCC1 ZINC000467412180 881199434 /nfs/dbraw/zinc/19/94/34/881199434.db2.gz RFLFJSQLXNMHKS-OAQYLSRUSA-N 0 3 423.395 4.298 20 0 HIADHN COc1ccc2c(c1)[C@@H](NC[C@@H](O)COc1ccc(C(F)(F)F)cc1)CCS2 ZINC000467420118 881208600 /nfs/dbraw/zinc/20/86/00/881208600.db2.gz QOSWNKHXQWTRDH-KDOFPFPSSA-N 0 3 413.461 4.280 20 0 HIADHN COc1ccc2c(c1)[C@@H](NC[C@H](O)COc1ccc(C(F)(F)F)cc1)CCS2 ZINC000467420119 881209382 /nfs/dbraw/zinc/20/93/82/881209382.db2.gz QOSWNKHXQWTRDH-KSSFIOAISA-N 0 3 413.461 4.280 20 0 HIADHN CNC(=O)c1cccc(CN[C@H](c2cccc(Br)c2)C2CCOCC2)c1 ZINC000467427448 881218504 /nfs/dbraw/zinc/21/85/04/881218504.db2.gz GJJYWHRULLZYBQ-FQEVSTJZSA-N 0 3 417.347 4.066 20 0 HIADHN C[C@@H]1C[C@H](C)CN(C(=O)c2ccccc2NC(=O)N(CCN(C)C)C2CCCC2)C1 ZINC000467437290 881235427 /nfs/dbraw/zinc/23/54/27/881235427.db2.gz GSTBKXQEYWMXRG-KDURUIRLSA-N 0 3 414.594 4.143 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)Nc2ccc(OCc3ccncc3)cc2)CN1Cc1ccccc1 ZINC000467464869 881276208 /nfs/dbraw/zinc/27/62/08/881276208.db2.gz QSPPASWLHLNZNM-AUSIDOKSSA-N 0 3 416.525 4.445 20 0 HIADHN Cc1ccnc(-c2ccc(NC(=O)N[C@H]3C[C@H](C)N(Cc4ccccc4)C3)cc2)n1 ZINC000467474041 881293472 /nfs/dbraw/zinc/29/34/72/881293472.db2.gz TYWJHIPGQIRSHE-AVRDEDQJSA-N 0 3 401.514 4.237 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)Nc2ccc(OCC3CCOCC3)cc2)CN1Cc1ccccc1 ZINC000467476126 881294395 /nfs/dbraw/zinc/29/43/95/881294395.db2.gz NKPQOBCPBQARLC-XXBNENTESA-N 0 3 423.557 4.277 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)c1ccc(-c2ccccc2Cl)o1 ZINC000467508406 881321307 /nfs/dbraw/zinc/32/13/07/881321307.db2.gz RRXRGFWUYCNBDS-UHFFFAOYSA-N 0 3 424.928 4.487 20 0 HIADHN CCN(C(=O)CCN1CCN(c2cccc(C)c2)CC1)[C@H](C)c1cccc(OC)c1 ZINC000467522223 881339658 /nfs/dbraw/zinc/33/96/58/881339658.db2.gz OFPBTYXQHCAXMV-OAQYLSRUSA-N 0 3 409.574 4.125 20 0 HIADHN CCOC(=O)c1csc(CCN[C@H](C)c2cc(Br)ccc2F)n1 ZINC000469066320 883143619 /nfs/dbraw/zinc/14/36/19/883143619.db2.gz VYGRWTAEDQMMHL-SNVBAGLBSA-N 0 3 401.301 4.115 20 0 HIADHN Cc1c2cc(C)ccc2sc1C(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000469073429 883156241 /nfs/dbraw/zinc/15/62/41/883156241.db2.gz SFJRFYWMQBYMKZ-CALCHBBNSA-N 0 3 400.588 4.480 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)c1cccc(Br)c1F ZINC000469091947 883181169 /nfs/dbraw/zinc/18/11/69/883181169.db2.gz WHODZGLFULKSFP-UHFFFAOYSA-N 0 3 423.351 4.432 20 0 HIADHN CCCC[C@H](C)C(=O)NC1CCN(CCOc2ccc(Br)cc2)CC1 ZINC000503594389 912683474 /nfs/dbraw/zinc/68/34/74/912683474.db2.gz NDNQSUUCUOKVSG-INIZCTEOSA-N 0 3 411.384 4.235 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3CC[C@@H](C(F)(F)F)C3(C)C)c(C)c2)CC1 ZINC000469153033 883250831 /nfs/dbraw/zinc/25/08/31/883250831.db2.gz UDMUZJFQFLCXAZ-GOSISDBHSA-N 0 3 412.500 4.332 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)NCC3(c4cc(C(F)(F)F)ccc4Cl)CC3)[C@@H]2C1 ZINC000469180997 883280439 /nfs/dbraw/zinc/28/04/39/883280439.db2.gz GBLDYKFQRAWINQ-CXAGYDPISA-N 0 3 415.887 4.126 20 0 HIADHN Cc1ccc(CN[C@H](C)c2ccc3c(c2)C(C)(C)C(=O)N3)c(-n2cc(Cl)cn2)n1 ZINC000469208407 883307782 /nfs/dbraw/zinc/30/77/82/883307782.db2.gz LGJRBKHVBZDFQG-CQSZACIVSA-N 0 3 409.921 4.310 20 0 HIADHN Cc1cccc(CNC(=O)N(CCN(C)C)Cc2cccs2)c1Br ZINC000469233335 883332839 /nfs/dbraw/zinc/33/28/39/883332839.db2.gz IZXGIPFOCMOMEZ-UHFFFAOYSA-N 0 3 410.381 4.092 20 0 HIADHN COc1cccc([C@H](C)CCCC(=O)NC[C@@H]2CN(Cc3ccccc3)CCCO2)c1 ZINC000469235397 883335705 /nfs/dbraw/zinc/33/57/05/883335705.db2.gz SVFRQDURCGBDCN-PXDATVDWSA-N 0 3 424.585 4.376 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N3CCC(Cc4ccc(F)cc4)CC3)cc2)CC1 ZINC000469279841 883378261 /nfs/dbraw/zinc/37/82/61/883378261.db2.gz NYVRQGYIRQPBSY-UHFFFAOYSA-N 0 3 409.549 4.063 20 0 HIADHN O=C1[C@@H](NCc2ccc(Br)cc2)CCCN1Cc1ccc(F)cc1F ZINC000469291338 883388729 /nfs/dbraw/zinc/38/87/29/883388729.db2.gz ZSOVXOONTGQICA-SFHVURJKSA-N 0 3 409.274 4.008 20 0 HIADHN CC1(C)OCc2cc(CN3CCC(C(=O)N4CCc5ccccc54)CC3)ccc2O1 ZINC000469347797 883467057 /nfs/dbraw/zinc/46/70/57/883467057.db2.gz XVFDXKGRLBBIEA-UHFFFAOYSA-N 0 3 406.526 4.133 20 0 HIADHN CCN(Cc1ccccc1NC(=O)N[C@H](CN(C)Cc1ccccc1)C(C)C)C(C)=O ZINC000469464442 883677186 /nfs/dbraw/zinc/67/71/86/883677186.db2.gz JBQUNRXVVNPIBL-XMMPIXPASA-N 0 3 424.589 4.333 20 0 HIADHN CC(=O)Nc1cc(NC(=O)N[C@@H](CN(C)Cc2ccccc2)C(C)C)ccc1F ZINC000469473994 883702482 /nfs/dbraw/zinc/70/24/82/883702482.db2.gz HAIMHSLMPKNJMB-NRFANRHFSA-N 0 3 400.498 4.062 20 0 HIADHN O=C(CCC(=O)c1ccc(Cl)cn1)NC1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1 ZINC000469490365 883727511 /nfs/dbraw/zinc/72/75/11/883727511.db2.gz RIZXEUQHPPPEAS-IHWFROFDSA-N 0 3 411.933 4.010 20 0 HIADHN C[C@H](c1ccccc1Br)N(C)C(=O)CC1(N2CCOCC2)CCCC1 ZINC000503639882 912744922 /nfs/dbraw/zinc/74/49/22/912744922.db2.gz QEYBRQVKQFBTEN-MRXNPFEDSA-N 0 3 409.368 4.004 20 0 HIADHN Cn1cc(-c2cc(CN3CCC(C)(c4cccc(Br)c4)CC3)on2)cn1 ZINC000469521351 883788215 /nfs/dbraw/zinc/78/82/15/883788215.db2.gz ZSDWHHYRVLOFRA-UHFFFAOYSA-N 0 3 415.335 4.391 20 0 HIADHN Cc1ccc(C)n1C1CCN([C@H]2CCCN(Cc3ccc(F)cc3F)C2=O)CC1 ZINC000469609414 883833472 /nfs/dbraw/zinc/83/34/72/883833472.db2.gz PRKNGWMIHVIPHN-QFIPXVFZSA-N 0 3 401.501 4.211 20 0 HIADHN COc1cccc(-n2c3ccccc3nc2NC(=O)c2cccc(CN(C)C)c2)c1 ZINC000469630148 883841167 /nfs/dbraw/zinc/84/11/67/883841167.db2.gz FIUWSTGQTOXPHG-UHFFFAOYSA-N 0 3 400.482 4.348 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)Nc1cc(C(F)(F)F)c[nH]c1=O ZINC000469664197 883857074 /nfs/dbraw/zinc/85/70/74/883857074.db2.gz TUPBVUXFYQWIBZ-KRWDZBQOSA-N 0 3 410.440 4.084 20 0 HIADHN CCN(C(=O)c1ccc2nnc(C(C)(C)C)n2c1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000469710013 883882202 /nfs/dbraw/zinc/88/22/02/883882202.db2.gz NAQIRDDMHDTDCT-RXVVDRJESA-N 0 3 419.573 4.324 20 0 HIADHN O=C1[C@H](N2CCC(c3nc4ccccc4[nH]3)CC2)CCCN1Cc1ccc(F)cc1F ZINC000469711607 883882461 /nfs/dbraw/zinc/88/24/61/883882461.db2.gz FKNKBICBNJYQRR-JOCHJYFZSA-N 0 3 424.495 4.212 20 0 HIADHN Fc1cccc(-c2noc([C@H]3CCCN(CCOCC(F)(F)C(F)(F)F)C3)n2)c1 ZINC000469718169 883884564 /nfs/dbraw/zinc/88/45/64/883884564.db2.gz PZFNMNBTRBIPSL-ZDUSSCGKSA-N 0 3 423.357 4.269 20 0 HIADHN O=C(c1ncncc1Cl)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000503659490 912762860 /nfs/dbraw/zinc/76/28/60/912762860.db2.gz QINMWIRHBFXGEK-UHFFFAOYSA-N 0 3 413.736 4.175 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)NCCc1ccc(F)cc1Cl ZINC000503662211 912765652 /nfs/dbraw/zinc/76/56/52/912765652.db2.gz GFBIRLIXNLKQMY-UHFFFAOYSA-N 0 3 413.871 4.073 20 0 HIADHN CC(=O)Nc1ccc(Cl)c(C(=O)N[C@H](CN(C)Cc2ccccc2)C(C)C)c1 ZINC000469770709 883945177 /nfs/dbraw/zinc/94/51/77/883945177.db2.gz VYSPSHSCQDZJNC-OAQYLSRUSA-N 0 3 401.938 4.185 20 0 HIADHN CCS[C@H]1CCCC[C@H]1NCC(=O)Nc1c(F)cc(F)cc1Br ZINC000469773677 883949122 /nfs/dbraw/zinc/94/91/22/883949122.db2.gz AFDJNEIUPPFUDL-KGLIPLIRSA-N 0 3 407.324 4.320 20 0 HIADHN C[C@H](NC(=O)CCCc1nnc(-c2ccc(Cl)cc2Cl)o1)C1=CCN(C)CC1 ZINC000469801140 883976307 /nfs/dbraw/zinc/97/63/07/883976307.db2.gz QAJQTILFGYJULG-ZDUSSCGKSA-N 0 3 423.344 4.133 20 0 HIADHN C[C@@H](c1cccc(NS(C)(=O)=O)c1)N1CCC(Cc2ccc(F)c(F)c2)CC1 ZINC000469809427 883984644 /nfs/dbraw/zinc/98/46/44/883984644.db2.gz NHSSITUZOKJMCL-HNNXBMFYSA-N 0 3 408.514 4.352 20 0 HIADHN CCN(C[C@@H]1CCN(Cc2ccccc2)C1)C(=O)CCC(=O)c1ccc(Cl)cn1 ZINC000469815200 883992074 /nfs/dbraw/zinc/99/20/74/883992074.db2.gz BEILLNWBLVRDRI-LJQANCHMSA-N 0 3 413.949 4.069 20 0 HIADHN C[C@@H](NC(=O)N(CCN(C)C)Cc1ccco1)c1ccc(OCC2CC2)c(F)c1 ZINC000469834299 884015222 /nfs/dbraw/zinc/01/52/22/884015222.db2.gz MUUQGHSPLINHLB-MRXNPFEDSA-N 0 3 403.498 4.042 20 0 HIADHN Cc1nc(C2CCCC2)sc1C(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000469841556 884022633 /nfs/dbraw/zinc/02/26/33/884022633.db2.gz KXXPLLWFFVLAQU-FQEVSTJZSA-N 0 3 413.587 4.130 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3ccc4c(c3)CC(C)(C)O4)CC2)C[C@H](C)O1 ZINC000469845374 884028253 /nfs/dbraw/zinc/02/82/53/884028253.db2.gz BRRXLGZINKTTOL-HDICACEKSA-N 0 3 415.578 4.143 20 0 HIADHN CCC[C@@H]1C[C@@H](C(=O)Nc2c(C)cnn2[C@H]2CCN(Cc3ccccc3)C2)CCO1 ZINC000503670192 912778738 /nfs/dbraw/zinc/77/87/38/912778738.db2.gz KNJMRALZSYCFAL-FDFHNCONSA-N 0 3 410.562 4.172 20 0 HIADHN Cc1c2cc(F)ccc2sc1C(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000469868459 884057482 /nfs/dbraw/zinc/05/74/82/884057482.db2.gz CIXNOVHVZLGWSC-IBGZPJMESA-N 0 3 412.530 4.370 20 0 HIADHN CC(C)(C)C[C@H](NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1)C(F)(F)F ZINC000469930435 884122993 /nfs/dbraw/zinc/12/29/93/884122993.db2.gz WDEOOZOVEHFQPF-RUXDESIVSA-N 0 3 417.438 4.458 20 0 HIADHN O=C(Nc1ccc(-c2ncco2)cc1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000469930686 884125760 /nfs/dbraw/zinc/12/57/60/884125760.db2.gz YKBJSCOPBPTLLY-UHFFFAOYSA-N 0 3 408.424 4.268 20 0 HIADHN O=C(CC1(N2CCOCC2)CCCC1)N1CCC(c2c[nH]c3cc(F)ccc32)CC1 ZINC000469966150 884175155 /nfs/dbraw/zinc/17/51/55/884175155.db2.gz WYQWNILSHFPFIH-UHFFFAOYSA-N 0 3 413.537 4.048 20 0 HIADHN COc1cccc([C@H](CNC(=O)NCCCSc2ccccc2)N2CCCC2)c1 ZINC000503692136 912796344 /nfs/dbraw/zinc/79/63/44/912796344.db2.gz IKXZXLCGKYINKZ-QFIPXVFZSA-N 0 3 413.587 4.314 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1C[C@@H](c2ccsc2)O[C@@H](C)C1)c1ccsc1 ZINC000470042787 884283441 /nfs/dbraw/zinc/28/34/41/884283441.db2.gz OBJBKGUFZORXTK-IPELMVKDSA-N 0 3 407.605 4.364 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@@H]2NC(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)cc1 ZINC000470071100 884325348 /nfs/dbraw/zinc/32/53/48/884325348.db2.gz IATOXEMZAYNHPL-DLTYFMDKSA-N 0 3 407.558 4.350 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@@H]2NC(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)cc1 ZINC000470071103 884325798 /nfs/dbraw/zinc/32/57/98/884325798.db2.gz IATOXEMZAYNHPL-UQAQOTMJSA-N 0 3 407.558 4.350 20 0 HIADHN Cc1ccc([C@H]2OCCC[C@@H]2NC(=O)N(CCN(C)C)Cc2cccc(C)c2)cc1 ZINC000470072545 884327904 /nfs/dbraw/zinc/32/79/04/884327904.db2.gz DDZKZKLNXGKYEM-BJKOFHAPSA-N 0 3 409.574 4.297 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@H]2NC(=O)N(CCN(C)C)Cc2cccc(C)c2)cc1 ZINC000470072547 884328013 /nfs/dbraw/zinc/32/80/13/884328013.db2.gz DDZKZKLNXGKYEM-RPWUZVMVSA-N 0 3 409.574 4.297 20 0 HIADHN Brc1cc2cccnc2c(CN2CCC[C@H](c3nnc4ccccn43)C2)c1 ZINC000470211523 884532665 /nfs/dbraw/zinc/53/26/65/884532665.db2.gz IUZPWLCYZOEUSR-INIZCTEOSA-N 0 3 422.330 4.420 20 0 HIADHN COc1cccc(C[C@@H](NCC(=O)N[C@H]2CCOc3ccccc32)c2ccccc2)c1 ZINC000503858804 912844343 /nfs/dbraw/zinc/84/43/43/912844343.db2.gz LQJFZZJRKWSAPJ-BJKOFHAPSA-N 0 3 416.521 4.209 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@@H]2NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)cc1 ZINC000470268592 884620251 /nfs/dbraw/zinc/62/02/51/884620251.db2.gz NHFSLNRPCWBQMZ-NHTMILBNSA-N 0 3 410.533 4.383 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@H]2NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)cc1 ZINC000470268591 884620674 /nfs/dbraw/zinc/62/06/74/884620674.db2.gz NHFSLNRPCWBQMZ-JRFVFWCSSA-N 0 3 410.533 4.383 20 0 HIADHN CC(C)[C@H]1CCC[C@H](NC(=O)N(C)C2CCN(CCc3ccccn3)CC2)CC1 ZINC000470292979 884668436 /nfs/dbraw/zinc/66/84/36/884668436.db2.gz MFBDDDJHGFHPQS-UNMCSNQZSA-N 0 3 400.611 4.335 20 0 HIADHN C[C@@H](CO)N1CCCN(C(=O)Nc2ccc(Oc3cccc(Cl)c3)cc2)CC1 ZINC000470343965 884734749 /nfs/dbraw/zinc/73/47/49/884734749.db2.gz JHROVGXYSKBNPY-INIZCTEOSA-N 0 3 403.910 4.053 20 0 HIADHN C[C@@H](CO)N1CCCN(C(=O)Nc2ccc(Sc3ccccc3)c(Cl)c2)CC1 ZINC000470364750 884759259 /nfs/dbraw/zinc/75/92/59/884759259.db2.gz MTBDTZCWEAMAEN-INIZCTEOSA-N 0 3 419.978 4.412 20 0 HIADHN O=C(CN[C@@H]1CCCc2c(Br)cccc21)N[C@H]1CCOc2ccccc21 ZINC000503910557 912861413 /nfs/dbraw/zinc/86/14/13/912861413.db2.gz MNQWEDWYHUACPR-MOPGFXCFSA-N 0 3 415.331 4.056 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCCc3nc4ccccc4s3)c(C)c2)CC1 ZINC000503911114 912861639 /nfs/dbraw/zinc/86/16/39/912861639.db2.gz OLIZXKQZLVNREV-UHFFFAOYSA-N 0 3 423.586 4.111 20 0 HIADHN Cc1cnccc1OC1CCN(C(=O)[C@@H](C)N2CCC(Cc3ccccc3)CC2)CC1 ZINC000470403418 884807937 /nfs/dbraw/zinc/80/79/37/884807937.db2.gz JPHJRHFIMKXFHO-OAQYLSRUSA-N 0 3 421.585 4.103 20 0 HIADHN COC[C@H](C)Oc1ccc(Cl)cc1NC(=O)NC[C@@H](c1ccccc1)N(C)C ZINC000470535073 884935859 /nfs/dbraw/zinc/93/58/59/884935859.db2.gz XUXKBNVWRXJTHS-KXBFYZLASA-N 0 3 405.926 4.178 20 0 HIADHN COc1ccccc1-c1noc([C@@H](C)NC(=O)c2oc3ccccc3c2CN(C)C)n1 ZINC000470546620 884955828 /nfs/dbraw/zinc/95/58/28/884955828.db2.gz LUAZVVRPRMRVJR-CQSZACIVSA-N 0 3 420.469 4.044 20 0 HIADHN CC[C@@H](C)n1ncc2c1nc(C)cc2C(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470656347 885078038 /nfs/dbraw/zinc/07/80/38/885078038.db2.gz HGYJELALZWJHLG-CTNGQTDRSA-N 0 3 419.573 4.447 20 0 HIADHN Cc1cc(C)n(Cc2ccc(C(=O)N(C)[C@@H]3CCCN(Cc4ccccc4)C3)cc2)n1 ZINC000470655796 885078752 /nfs/dbraw/zinc/07/87/52/885078752.db2.gz CDSQRSXOKWVJIE-RUZDIDTESA-N 0 3 416.569 4.285 20 0 HIADHN CC[C@@H](C)n1ncc2c1nc(C)cc2C(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470656356 885078824 /nfs/dbraw/zinc/07/88/24/885078824.db2.gz HGYJELALZWJHLG-TZIWHRDSSA-N 0 3 419.573 4.447 20 0 HIADHN CN(C(=O)Cc1ccccc1Br)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470658611 885082345 /nfs/dbraw/zinc/08/23/45/885082345.db2.gz JOGKTOICFDYFMI-IBGZPJMESA-N 0 3 401.348 4.115 20 0 HIADHN Cc1cc(C)n(-c2ccc(C(=O)N(C)[C@@H]3CCCN(Cc4ccccc4)C3)cc2)n1 ZINC000470664071 885090726 /nfs/dbraw/zinc/09/07/26/885090726.db2.gz ULKIZIPVEHPXIY-XMMPIXPASA-N 0 3 402.542 4.226 20 0 HIADHN CN(C(=O)Cc1csc(-c2ccccc2)n1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470667002 885093684 /nfs/dbraw/zinc/09/36/84/885093684.db2.gz LAZKYWAKJARQTP-JOCHJYFZSA-N 0 3 405.567 4.476 20 0 HIADHN COCCn1cc(C(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)c2ccccc21 ZINC000470675640 885107138 /nfs/dbraw/zinc/10/71/38/885107138.db2.gz SLHHUDKNHBMQSD-OAQYLSRUSA-N 0 3 405.542 4.024 20 0 HIADHN Cc1noc2nc(C3CC3)cc(C(=O)N(C)[C@@H]3CCCN(Cc4ccccc4)C3)c12 ZINC000470681474 885114450 /nfs/dbraw/zinc/11/44/50/885114450.db2.gz ICTQIUULNMUWLN-LJQANCHMSA-N 0 3 404.514 4.145 20 0 HIADHN CN(C(=O)N[C@@H]1CCOc2c(Cl)cccc21)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470718867 885160515 /nfs/dbraw/zinc/16/05/15/885160515.db2.gz YMAGIXWUGYUQHX-WIYYLYMNSA-N 0 3 413.949 4.470 20 0 HIADHN C[C@@H]1CN(C(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)C[C@H](c2ccsc2)O1 ZINC000470735993 885191137 /nfs/dbraw/zinc/19/11/37/885191137.db2.gz IAQSHWZCSAEWHR-PLMTUMEDSA-N 0 3 402.535 4.088 20 0 HIADHN CN(C(=O)NC[C@@H](c1ccco1)N1CCCCC1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470737114 885194034 /nfs/dbraw/zinc/19/40/34/885194034.db2.gz MVDOOOHUFUEYOI-PKTZIBPZSA-N 0 3 424.589 4.113 20 0 HIADHN COc1ccc([C@H](NC(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)C2CC2)cc1 ZINC000470740993 885201920 /nfs/dbraw/zinc/20/19/20/885201920.db2.gz RXFPIZXMBVPEHP-ISKFKSNPSA-N 0 3 407.558 4.452 20 0 HIADHN CN(C(=O)N[C@@H](c1ccccc1)c1ccccn1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470750181 885214801 /nfs/dbraw/zinc/21/48/01/885214801.db2.gz CFYGLSYNLJCMJP-ZCYQVOJMSA-N 0 3 414.553 4.477 20 0 HIADHN CN(C(=O)c1ccccc1OCc1cscn1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470812289 885300432 /nfs/dbraw/zinc/30/04/32/885300432.db2.gz LHGDTUAFMIHLOH-OAQYLSRUSA-N 0 3 421.566 4.459 20 0 HIADHN CCc1c(C(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)cnn1-c1ccc(F)cc1 ZINC000470819776 885307134 /nfs/dbraw/zinc/30/71/34/885307134.db2.gz GYUJCKPRBIWJQI-QFIPXVFZSA-N 0 3 420.532 4.310 20 0 HIADHN COC(=O)c1ccc(CN2C[C@H]3CCC[C@@]3(c3nc(-c4ccccc4)no3)C2)c(F)c1 ZINC000470865615 885356160 /nfs/dbraw/zinc/35/61/60/885356160.db2.gz HOBUVLZZONMOQG-NTKDMRAZSA-N 0 3 421.472 4.216 20 0 HIADHN CO[C@H](CNC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1)c1cccc(Cl)c1 ZINC000470885917 885380118 /nfs/dbraw/zinc/38/01/18/885380118.db2.gz JEGYKSCXMIJNOU-FCHUYYIVSA-N 0 3 415.965 4.334 20 0 HIADHN Cc1ccc(-c2nc(CNC(=O)N(C)[C@@H]3CCCN(Cc4ccccc4)C3)co2)cc1 ZINC000470891024 885388401 /nfs/dbraw/zinc/38/84/01/885388401.db2.gz XDYYWGWETNYTOH-HSZRJFAPSA-N 0 3 418.541 4.456 20 0 HIADHN CN(C(=O)NCc1nc(C(C)(C)C)cs1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470894297 885391520 /nfs/dbraw/zinc/39/15/20/885391520.db2.gz FMXCHXSDWFDIPM-SFHVURJKSA-N 0 3 400.592 4.247 20 0 HIADHN Cc1cccc(-c2n[nH]cc2CNCc2cc(Br)c3c(c2)OCCO3)c1 ZINC000504031511 912934002 /nfs/dbraw/zinc/93/40/02/912934002.db2.gz GXVVBMVZJGJPNN-UHFFFAOYSA-N 0 3 414.303 4.209 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)N1CC[C@@H](c2ccccc2F)C1 ZINC000504034223 912937301 /nfs/dbraw/zinc/93/73/01/912937301.db2.gz HKFAANCEXUJHID-LJQANCHMSA-N 0 3 413.562 4.438 20 0 HIADHN CN1CCN(CC(=O)Nc2ccc(OCc3ccccc3)cc2)C2(CCCCC2)C1 ZINC000471036414 885544960 /nfs/dbraw/zinc/54/49/60/885544960.db2.gz AEHMYIFOCCEYBP-UHFFFAOYSA-N 0 3 407.558 4.154 20 0 HIADHN C[C@@H](NC(=O)C1(c2ccc(Cl)cc2)CCOCC1)[C@H](c1ccccc1)N(C)C ZINC000471134031 885674577 /nfs/dbraw/zinc/67/45/77/885674577.db2.gz PSVMWQYZQZOLFK-DYESRHJHSA-N 0 3 400.950 4.196 20 0 HIADHN CSc1nc(C(C)(C)C)nc(C)c1C(=O)N[C@H](C)[C@H](c1ccccc1)N(C)C ZINC000471137188 885677165 /nfs/dbraw/zinc/67/71/65/885677165.db2.gz OFKKCGXGJFJBPW-CRAIPNDOSA-N 0 3 400.592 4.226 20 0 HIADHN Cc1ccc(NC(=O)[C@@H]2CCCN(Cc3ccccc3Oc3cccnc3)C2)nc1 ZINC000471147994 885695773 /nfs/dbraw/zinc/69/57/73/885695773.db2.gz JLOWZUORERPLEJ-HXUWFJFHSA-N 0 3 402.498 4.428 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)[C@@H](C)Oc3ccccc3)c(OCC)c2)CC1 ZINC000471161694 885715788 /nfs/dbraw/zinc/71/57/88/885715788.db2.gz PTYVCVNPCKFVPA-LJQANCHMSA-N 0 3 411.546 4.023 20 0 HIADHN O=C(Nc1cnc(-c2ccccc2)nc1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000471193549 885762880 /nfs/dbraw/zinc/76/28/80/885762880.db2.gz HLCAFYVOZLZXJR-UHFFFAOYSA-N 0 3 419.451 4.070 20 0 HIADHN Cc1nc2[nH]ccc2c(NCc2ccccc2CN2CCN(c3ccccc3)CC2)n1 ZINC000471247254 885824865 /nfs/dbraw/zinc/82/48/65/885824865.db2.gz OTNQVDXSEHAJHF-UHFFFAOYSA-N 0 3 412.541 4.201 20 0 HIADHN CC(=O)Nc1cc(C(=O)NC[C@@H]2CCCN2Cc2ccccc2)cc(C(F)(F)F)c1 ZINC000471307698 885896263 /nfs/dbraw/zinc/89/62/63/885896263.db2.gz YCRZVKYBDAYHKL-FQEVSTJZSA-N 0 3 419.447 4.058 20 0 HIADHN Cc1c(NC(=O)NC[C@H](c2cccs2)N2CCCC2)cccc1NC(=O)N(C)C ZINC000471353946 885972878 /nfs/dbraw/zinc/97/28/78/885972878.db2.gz PRGDTDBWGBZKGW-GOSISDBHSA-N 0 3 415.563 4.109 20 0 HIADHN COc1cccc([C@H](CNC(=O)[C@@H](C(C)C)N(C)C)c2c[nH]c3ccccc32)c1OC ZINC000471401020 886051684 /nfs/dbraw/zinc/05/16/84/886051684.db2.gz HXYPGGQGZZHCCK-NZQKXSOJSA-N 0 3 423.557 4.019 20 0 HIADHN Cc1cc(NC(=O)N(CCN(C)C)Cc2ccccn2)ccc1Oc1cccnc1 ZINC000504093069 913004765 /nfs/dbraw/zinc/00/47/65/913004765.db2.gz FTSMPDHQCVRMPE-UHFFFAOYSA-N 0 3 405.502 4.173 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)N[C@H](C)c2ccccc2-n2cccn2)c1 ZINC000471475804 886169357 /nfs/dbraw/zinc/16/93/57/886169357.db2.gz LVRBMYPKOCYPIY-HXUWFJFHSA-N 0 3 405.546 4.015 20 0 HIADHN CCN(C(=O)Nc1cc(OC)cc(-n2cccn2)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000471486380 886183833 /nfs/dbraw/zinc/18/38/33/886183833.db2.gz YYPHVXPCDGFHKB-NRFANRHFSA-N 0 3 419.529 4.009 20 0 HIADHN CC(=O)Nc1cc(C(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)cc(C(F)(F)F)c1 ZINC000471528751 886232897 /nfs/dbraw/zinc/23/28/97/886232897.db2.gz GILQRNALZDWGNU-YJYMSZOUSA-N 0 3 407.436 4.085 20 0 HIADHN FC(F)Oc1ccccc1CCNCc1csc(-c2ccc3c(c2)OCO3)n1 ZINC000471541857 886248274 /nfs/dbraw/zinc/24/82/74/886248274.db2.gz RVCNEXVAHFBTRD-UHFFFAOYSA-N 0 3 404.438 4.473 20 0 HIADHN COc1ccc([C@H](NC(=O)N2CCN(C3CCCC3)CC2)c2ccc(F)cc2)cc1 ZINC000504117159 913023956 /nfs/dbraw/zinc/02/39/56/913023956.db2.gz FBCQUSMKIRWUDN-HSZRJFAPSA-N 0 3 411.521 4.194 20 0 HIADHN C[C@@H](NC(=O)c1ccc(NC(=O)c2ccccc2)cc1)[C@@H](c1ccccc1)N(C)C ZINC000471575165 886285466 /nfs/dbraw/zinc/28/54/66/886285466.db2.gz VYSZUIKHIKHRII-JPYJTQIMSA-N 0 3 401.510 4.360 20 0 HIADHN C[C@H](NC(=O)[C@@H]1C[C@H]1c1ccccc1OC(F)(F)F)[C@H](c1ccccc1)N(C)C ZINC000471575712 886287915 /nfs/dbraw/zinc/28/79/15/886287915.db2.gz ZFIGMAIRZKZCKY-FEUVXWNVSA-N 0 3 406.448 4.496 20 0 HIADHN Cc1ccc([C@H](NC(=O)NCCCN2CCc3ccccc3C2)c2ccccn2)cc1 ZINC000471590986 886302578 /nfs/dbraw/zinc/30/25/78/886302578.db2.gz POMOOUFFNZLNMZ-VWLOTQADSA-N 0 3 414.553 4.227 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)c3cnn(-c4cccc(Cl)c4)c3C)c2)CC1 ZINC000471620833 886338008 /nfs/dbraw/zinc/33/80/08/886338008.db2.gz UKMHNSRVMACXTL-UHFFFAOYSA-N 0 3 423.948 4.228 20 0 HIADHN O=C(NC[C@H]1CCCc2ccccc21)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000471647302 886362541 /nfs/dbraw/zinc/36/25/41/886362541.db2.gz GHQDOGOTPKHDMX-IPJUCJBFSA-N 0 3 409.496 4.211 20 0 HIADHN Cc1ccccc1C(C)(C)CNC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000471822645 886567662 /nfs/dbraw/zinc/56/76/62/886567662.db2.gz AWERTXXJSJGIFO-UHFFFAOYSA-N 0 3 411.512 4.377 20 0 HIADHN COc1ccc(NC(=O)[C@H](C)N[C@@H]2C[C@@H](OCc3ccccc3)C2(C)C)c(OC)c1 ZINC000471855396 886625744 /nfs/dbraw/zinc/62/57/44/886625744.db2.gz GBSSDBWOHNTOGC-KNXBSLHKSA-N 0 3 412.530 4.004 20 0 HIADHN Cc1ccc(C[C@H](C)NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)c(C)c1 ZINC000471860138 886632945 /nfs/dbraw/zinc/63/29/45/886632945.db2.gz LVNBNSHQWNQQTM-DZIBYMRMSA-N 0 3 411.512 4.339 20 0 HIADHN C[C@@]1(NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)CCCc2ccccc21 ZINC000471897036 886679086 /nfs/dbraw/zinc/67/90/86/886679086.db2.gz QLXGSIPTIQVELU-WIXQSORDSA-N 0 3 409.496 4.343 20 0 HIADHN COc1ccc([C@H](NC(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)C(F)(F)F)cc1 ZINC000471917089 886704727 /nfs/dbraw/zinc/70/47/27/886704727.db2.gz FHAZLVYLCXNGAM-OTWHNJEPSA-N 0 3 407.436 4.043 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)c1cncc(-c2ccc(N(C)C)cc2)c1 ZINC000471924987 886714974 /nfs/dbraw/zinc/71/49/74/886714974.db2.gz YJGCIUYBWDZIOZ-UHFFFAOYSA-N 0 3 408.571 4.080 20 0 HIADHN CN1CC[C@H](NC(=O)N[C@H](c2cccc(F)c2F)C(F)(F)F)[C@H]1c1ccccc1 ZINC000471935209 886732847 /nfs/dbraw/zinc/73/28/47/886732847.db2.gz ZZQKKWVPWHZNSV-CGTJXYLNSA-N 0 3 413.390 4.313 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2cccc3c2CN(c2nccs2)C3)[C@@H]1c1ccccc1 ZINC000471964250 886790733 /nfs/dbraw/zinc/79/07/33/886790733.db2.gz ILQOVKMPWAIMSV-RTWAWAEBSA-N 0 3 419.554 4.230 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2cc(F)cc(F)c2Br)[C@H]1c1ccccc1 ZINC000471967930 886796720 /nfs/dbraw/zinc/79/67/20/886796720.db2.gz SZLZIGZTGKYGNR-RHSMWYFYSA-N 0 3 410.262 4.294 20 0 HIADHN CC(=O)Nc1cc(C(=O)N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)cc(C(F)(F)F)c1 ZINC000471970191 886801299 /nfs/dbraw/zinc/80/12/99/886801299.db2.gz WJXUPZNVKYHBCL-VLIAUNLRSA-N 0 3 419.447 4.057 20 0 HIADHN Cc1ccc(NC(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)c(-c2nc(C3CC3)no2)c1 ZINC000471990471 886816177 /nfs/dbraw/zinc/81/61/77/886816177.db2.gz FIBQKWUGBXGUNE-RTWAWAEBSA-N 0 3 417.513 4.489 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2ccc(OCc3ccccn3)c(F)c2)[C@H]1c1ccccc1 ZINC000471996360 886821606 /nfs/dbraw/zinc/82/16/06/886821606.db2.gz WYMCKYMCVWOEPS-FYYLOGMGSA-N 0 3 420.488 4.367 20 0 HIADHN Cc1ccc(NC(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)cc1OCC1CCOCC1 ZINC000472004706 886829261 /nfs/dbraw/zinc/82/92/61/886829261.db2.gz BIYUAPKHMKPSQV-UPVQGACJSA-N 0 3 423.557 4.367 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2cccc(-c3noc(C4CC4)n3)c2)[C@H]1c1ccccc1 ZINC000472010214 886833663 /nfs/dbraw/zinc/83/36/63/886833663.db2.gz CJEMSSOPRBWHSX-VQTJNVASSA-N 0 3 403.486 4.181 20 0 HIADHN CCN(C(=O)c1ccc(OCCOC)cc1Cl)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000472024347 886846967 /nfs/dbraw/zinc/84/69/67/886846967.db2.gz FXIJPIDFKVZMSE-LJQANCHMSA-N 0 3 416.949 4.102 20 0 HIADHN CCN(C(=O)c1ccc(OCCOC)cc1Cl)[C@H]1CCN(Cc2ccccc2)C1 ZINC000472024345 886847134 /nfs/dbraw/zinc/84/71/34/886847134.db2.gz FXIJPIDFKVZMSE-IBGZPJMESA-N 0 3 416.949 4.102 20 0 HIADHN Cc1ccc2[nH]c(CNCc3ccc(C(=O)N4C[C@H](C)O[C@@H](C)C4)cc3)cc2c1C ZINC000472040755 886857745 /nfs/dbraw/zinc/85/77/45/886857745.db2.gz ILXSLJNTYBWZOL-ROUUACIJSA-N 0 3 405.542 4.324 20 0 HIADHN CC(C)c1cccc(O[C@H](C(=O)N[C@@H](C)CCN2CCN(C)CC2)c2ccccc2)c1 ZINC000472084361 886884823 /nfs/dbraw/zinc/88/48/23/886884823.db2.gz APHUWDPIQLXGKK-OFVILXPXSA-N 0 3 423.601 4.072 20 0 HIADHN C[C@@H](CCN1CCN(C)CC1)NC(=O)c1cc(Cl)ccc1SC1CCCC1 ZINC000472118342 886904879 /nfs/dbraw/zinc/90/48/79/886904879.db2.gz SSYHIADPKMHWBK-INIZCTEOSA-N 0 3 410.027 4.131 20 0 HIADHN CCCc1cc(C(=O)Nc2ccc3oc(=O)n(CCN(C)C)c3c2)ccc1Cl ZINC000472232810 887039417 /nfs/dbraw/zinc/03/94/17/887039417.db2.gz VEHVCZGHKQUXCF-UHFFFAOYSA-N 0 3 401.894 4.014 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)NCC(C)(C)c1cccc(C(F)(F)F)c1 ZINC000504248125 913114512 /nfs/dbraw/zinc/11/45/12/913114512.db2.gz SQFQHHSOXLZBKO-UHFFFAOYSA-N 0 3 422.495 4.151 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2ccc(OCc3ccncc3)cc2)[C@@H]1c1ccccc1 ZINC000472309639 887137343 /nfs/dbraw/zinc/13/73/43/887137343.db2.gz CWZFTDPRRQJODN-GOTSBHOMSA-N 0 3 402.498 4.228 20 0 HIADHN CCOCCOc1c(Cl)cccc1NC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000472321272 887153489 /nfs/dbraw/zinc/15/34/89/887153489.db2.gz YLGDTKFYAURBOB-QUCCMNQESA-N 0 3 417.937 4.322 20 0 HIADHN CCOCCOc1c(Cl)cccc1NC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000472321273 887154149 /nfs/dbraw/zinc/15/41/49/887154149.db2.gz YLGDTKFYAURBOB-UYAOXDASSA-N 0 3 417.937 4.322 20 0 HIADHN CC(C)(C)c1cnc(CNC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)o1 ZINC000472368684 887207021 /nfs/dbraw/zinc/20/70/21/887207021.db2.gz KOMANTMDXAQDIK-HXUWFJFHSA-N 0 3 409.452 4.043 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N1CCC[C@@H]1c1ccc(F)cc1 ZINC000472449449 887302027 /nfs/dbraw/zinc/30/20/27/887302027.db2.gz QUHUQAAWXVGXPS-CTWPCTMYSA-N 0 3 413.459 4.478 20 0 HIADHN C[C@H]1[C@H](C(F)(F)F)CCCN1C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472457032 887312439 /nfs/dbraw/zinc/31/24/39/887312439.db2.gz UEBYWBSFYSRKMO-VYESFELBSA-N 0 3 415.422 4.164 20 0 HIADHN COCCCC[C@H](NC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1)c1ccccc1 ZINC000472458990 887316609 /nfs/dbraw/zinc/31/66/09/887316609.db2.gz YWDLFSCKJWXKEK-ZEQRLZLVSA-N 0 3 409.574 4.460 20 0 HIADHN C[C@H]1[C@H](c2ccccc2)CCN1C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472462629 887321553 /nfs/dbraw/zinc/32/15/53/887321553.db2.gz HRCXHYXWBLKVRR-VUVIGMMVSA-N 0 3 409.496 4.379 20 0 HIADHN C[C@H](Oc1ccc2ccccc2c1)C(=O)Nc1cccc2c1CCN(CC(C)(C)O)C2 ZINC000472494024 887363303 /nfs/dbraw/zinc/36/33/03/887363303.db2.gz FPMVDAQTWLUOAO-SFHVURJKSA-N 0 3 418.537 4.375 20 0 HIADHN Cc1nn(C)c(=O)c(-c2nc(CN[C@@H]3CCC[C@H]3Cc3ccccc3)cs2)c1C ZINC000472630053 887494916 /nfs/dbraw/zinc/49/49/16/887494916.db2.gz MOXPNMXOIPXSEH-AZUAARDMSA-N 0 3 408.571 4.022 20 0 HIADHN CN(C(=O)Nc1cccc(-c2nccn2C)c1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000472736658 887582530 /nfs/dbraw/zinc/58/25/30/887582530.db2.gz SDYLNXSOSWSESI-JOCHJYFZSA-N 0 3 403.530 4.215 20 0 HIADHN CCCCCn1cc(CNC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)c(C)n1 ZINC000504318706 913164828 /nfs/dbraw/zinc/16/48/28/913164828.db2.gz PATABOMHTLZDPA-HXUWFJFHSA-N 0 3 400.542 4.049 20 0 HIADHN CN(C)[C@@H](CNC(=O)Nc1ccc(F)cc1-c1nc(C2CC2)no1)Cc1ccccc1 ZINC000472853039 887707151 /nfs/dbraw/zinc/70/71/51/887707151.db2.gz RHCSCNGFGWCTNY-GOSISDBHSA-N 0 3 423.492 4.048 20 0 HIADHN Cc1ccc(NC(=O)NC[C@@H](Cc2ccccc2)N(C)C)c(-c2nc(C3CC3)no2)c1 ZINC000472869751 887723270 /nfs/dbraw/zinc/72/32/70/887723270.db2.gz BIORWJRLGGUVCD-LJQANCHMSA-N 0 3 419.529 4.217 20 0 HIADHN C[C@H](CCN1CCN(C)CC1)NC(=O)N[C@@H](c1cccc(Cl)c1)C1CCCCC1 ZINC000472905788 887752249 /nfs/dbraw/zinc/75/22/49/887752249.db2.gz WPKDMUSJJBCHCW-XMSQKQJNSA-N 0 3 421.029 4.287 20 0 HIADHN C[C@H](CCN1CCN(C)CC1)NC(=O)N(C)[C@H](C)c1ccc(-c2ccccc2)cc1 ZINC000472913804 887759034 /nfs/dbraw/zinc/75/90/34/887759034.db2.gz KNKBVELULYTGFG-NHCUHLMSSA-N 0 3 408.590 4.082 20 0 HIADHN COc1ccc(Cn2nc(C)c(CN3CC[C@]4(C3)OCc3ccccc34)c2C)cc1 ZINC000473056659 887877547 /nfs/dbraw/zinc/87/75/47/887877547.db2.gz XJXIFPFXYOETSR-RUZDIDTESA-N 0 3 403.526 4.188 20 0 HIADHN Cc1ccc(C(F)(F)F)cc1NC(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000473070326 887890259 /nfs/dbraw/zinc/89/02/59/887890259.db2.gz DDBRYYDLLWOAPZ-IYBDPMFKSA-N 0 3 413.484 4.367 20 0 HIADHN COc1ccc(C(=O)CC(C)(C)CC(=O)NC[C@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000473309498 888057679 /nfs/dbraw/zinc/05/76/79/888057679.db2.gz UQESHGSWDQRUAK-OAQYLSRUSA-N 0 3 422.569 4.323 20 0 HIADHN CC(C)(NCCC(=O)Nc1ccc(N2CCCC2=O)cc1)c1cccc(Cl)c1F ZINC000473435052 888155827 /nfs/dbraw/zinc/15/58/27/888155827.db2.gz QTCUOOIYZVCAKE-UHFFFAOYSA-N 0 3 417.912 4.459 20 0 HIADHN CC(C)(C)c1ncsc1C(=O)NC1CCN(CCOc2ccc(Cl)cc2)CC1 ZINC000473515083 888245162 /nfs/dbraw/zinc/24/51/62/888245162.db2.gz VFYYBFPYTWKBCF-UHFFFAOYSA-N 0 3 421.994 4.367 20 0 HIADHN Cc1cc(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)nn1C1CCCCC1 ZINC000473517809 888249815 /nfs/dbraw/zinc/24/98/15/888249815.db2.gz BJDNRIGSKWPQOU-UHFFFAOYSA-N 0 3 412.500 4.232 20 0 HIADHN COc1cc(CCC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)ccc1Cl ZINC000473518339 888250078 /nfs/dbraw/zinc/25/00/78/888250078.db2.gz DCYXAEJFQBNNEV-UHFFFAOYSA-N 0 3 418.887 4.203 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1ccc(OC(F)(F)F)cc1 ZINC000473517988 888250328 /nfs/dbraw/zinc/25/03/28/888250328.db2.gz CMUHMISWPHLOOY-UHFFFAOYSA-N 0 3 410.358 4.120 20 0 HIADHN CC(C)(C)O[C@H](C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1ccccc1 ZINC000473518605 888250774 /nfs/dbraw/zinc/25/07/74/888250774.db2.gz MLAQLLAALGBTOG-ACBHZAAOSA-N 0 3 412.496 4.464 20 0 HIADHN C[C@H](Oc1ccccc1Cl)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473522307 888256752 /nfs/dbraw/zinc/25/67/52/888256752.db2.gz FFZWTDJVRINAIG-GRTSSRMGSA-N 0 3 404.860 4.029 20 0 HIADHN COc1ccc2cccc(CC(=O)NC3CC(N4CCC(C(F)(F)F)CC4)C3)c2c1 ZINC000473523189 888258576 /nfs/dbraw/zinc/25/85/76/888258576.db2.gz GXYDZMKILLGGKR-UHFFFAOYSA-N 0 3 420.475 4.312 20 0 HIADHN Cc1nc(C(C)(C)C)sc1C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473523047 888259047 /nfs/dbraw/zinc/25/90/47/888259047.db2.gz RHSSRCGAEICKQD-UHFFFAOYSA-N 0 3 403.514 4.284 20 0 HIADHN C[C@@H]1C[C@@H]1c1ccc([C@H]2C[C@@H]2C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)o1 ZINC000473523924 888260186 /nfs/dbraw/zinc/26/01/86/888260186.db2.gz HJJYCHBYBFTXHI-LHUAKYKHSA-N 0 3 410.480 4.428 20 0 HIADHN O=C(CCCCC(=O)c1ccccc1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473523691 888260303 /nfs/dbraw/zinc/26/03/03/888260303.db2.gz MTLNUGHAFFQWMS-UHFFFAOYSA-N 0 3 410.480 4.351 20 0 HIADHN O=C(CCCc1cc(F)ccc1F)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473524219 888260648 /nfs/dbraw/zinc/26/06/48/888260648.db2.gz WPJHMRVBOLKTDO-UHFFFAOYSA-N 0 3 404.423 4.209 20 0 HIADHN Cc1ccc2nc(C)c(C(=O)NC3CC(N4CCC(C(F)(F)F)CC4)C3)cc2c1 ZINC000473526129 888263582 /nfs/dbraw/zinc/26/35/82/888263582.db2.gz LIPRJQSAZADHOO-UHFFFAOYSA-N 0 3 405.464 4.387 20 0 HIADHN O=C(Cc1c(Cl)cccc1Cl)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473529718 888266427 /nfs/dbraw/zinc/26/64/27/888266427.db2.gz OBSOCPGJPAGMEB-UHFFFAOYSA-N 0 3 409.279 4.457 20 0 HIADHN Cc1ccc(-c2cc(C(=O)NC3CC(N4CCC(C(F)(F)F)CC4)C3)[nH]n2)cc1C ZINC000473533348 888270000 /nfs/dbraw/zinc/27/00/00/888270000.db2.gz SKSNNQVWWBSLRR-UHFFFAOYSA-N 0 3 420.479 4.229 20 0 HIADHN COc1ccc2c(c1)CCC[C@H]2CC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473534394 888271213 /nfs/dbraw/zinc/27/12/13/888271213.db2.gz YIAYKVGPWTZZDC-IVMQYODDSA-N 0 3 424.507 4.427 20 0 HIADHN CC[C@H](O[C@@H]1CCC[C@H](C)C1)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473534063 888271469 /nfs/dbraw/zinc/27/14/69/888271469.db2.gz UMBKGSAOFSPFGP-HFDQKHQFSA-N 0 3 404.517 4.282 20 0 HIADHN COCCC[C@H](Cc1ccccc1)NC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000473537063 888276246 /nfs/dbraw/zinc/27/62/46/888276246.db2.gz YZENITPSZQOFES-LADGPHEKSA-N 0 3 412.549 4.192 20 0 HIADHN CN1CCN(CCC(C)(C)NC(=O)Nc2ccc(OCC3CCCCC3)cc2)CC1 ZINC000473657528 888409121 /nfs/dbraw/zinc/40/91/21/888409121.db2.gz DWHPBSZSEORSEP-UHFFFAOYSA-N 0 3 416.610 4.183 20 0 HIADHN CCN(C(=O)c1nn(-c2ccccc2)cc1C)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000473758592 888549553 /nfs/dbraw/zinc/54/95/53/888549553.db2.gz PYSHAAFHNBLDSI-REWPJTCUSA-N 0 3 402.542 4.478 20 0 HIADHN CCN(C(=O)Nc1nnc(-c2ccco2)s1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000473777926 888581031 /nfs/dbraw/zinc/58/10/31/888581031.db2.gz XLJQBYIXOMLBMY-DOTOQJQBSA-N 0 3 411.531 4.487 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@@H](C[C@H]3CCOC3)c3ccccc3)c2)CC1 ZINC000473819980 888650106 /nfs/dbraw/zinc/65/01/06/888650106.db2.gz PBCBRJOUNFPVQJ-YKSBVNFPSA-N 0 3 422.573 4.118 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CC[C@@H](Cc4ccc(F)cc4)C3)c2)CC1 ZINC000473821880 888653583 /nfs/dbraw/zinc/65/35/83/888653583.db2.gz ZBNZKTFRKGMCIM-FQEVSTJZSA-N 0 3 410.537 4.064 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N(C)CCOc3ccc(Cl)cc3)c2)CC1 ZINC000473828274 888661788 /nfs/dbraw/zinc/66/17/88/888661788.db2.gz XKHPLUOLFHGJTH-UHFFFAOYSA-N 0 3 416.953 4.025 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CC[C@@H](c4c(F)cccc4F)C3)c2)CC1 ZINC000473828422 888662020 /nfs/dbraw/zinc/66/20/20/888662020.db2.gz JWFARIPVJKRQML-QGZVFWFLSA-N 0 3 414.500 4.128 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@H](c3ccc(F)cc3)C(F)(F)F)c2)CC1 ZINC000473829559 888663205 /nfs/dbraw/zinc/66/32/05/888663205.db2.gz MISQUMZULFJSQC-LJQANCHMSA-N 0 3 424.442 4.393 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N(Cc3ccc(F)cc3F)C3CC3)c2)CC1 ZINC000473830509 888665361 /nfs/dbraw/zinc/66/53/61/888665361.db2.gz POQSFNCXYNDCLQ-UHFFFAOYSA-N 0 3 414.500 4.303 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N(C)C[C@@H](C)Cc3ccc(OC)cc3)c2)CC1 ZINC000473833784 888670572 /nfs/dbraw/zinc/67/05/72/888670572.db2.gz DCKGHCFSMKXRBJ-FQEVSTJZSA-N 0 3 424.589 4.180 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)NC[C@@H]3CCCC[C@@H]3C(F)(F)F)c2)CC1 ZINC000473835063 888672521 /nfs/dbraw/zinc/67/25/21/888672521.db2.gz HFEHKVNYHRPJHK-LPHOPBHVSA-N 0 3 412.500 4.319 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N(C)Cc3cccc(OC(C)C)c3)c2)CC1 ZINC000473838239 888678376 /nfs/dbraw/zinc/67/83/76/888678376.db2.gz UXFJCVDBUZDLNS-UHFFFAOYSA-N 0 3 410.562 4.280 20 0 HIADHN CCCc1ccc([C@H](NC(=O)NC(C)(C)CCN2CCN(C)CC2)C(C)C)cc1 ZINC000473900816 888777129 /nfs/dbraw/zinc/77/71/29/888777129.db2.gz ILFTZHZKQMVCKA-JOCHJYFZSA-N 0 3 402.627 4.052 20 0 HIADHN COc1ccc([C@@H]2CCN(CC(=O)Nc3ccc4nc(C(F)(F)F)[nH]c4c3)C2)cc1 ZINC000504488477 913280291 /nfs/dbraw/zinc/28/02/91/913280291.db2.gz LRCXIYMMCLPGSC-CQSZACIVSA-N 0 3 418.419 4.018 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N2CCSC[C@H]2c2nccs2)N2CCCC2)cc1 ZINC000473942058 888819567 /nfs/dbraw/zinc/81/95/67/888819567.db2.gz DKOSDSGXMJRNBI-OALUTQOASA-N 0 3 416.616 4.088 20 0 HIADHN COc1ccc2c(c1)C(C)(C)C[C@@H]2NCc1ccccc1CS(=O)(=O)NC(C)C ZINC000474033741 888880841 /nfs/dbraw/zinc/88/08/41/888880841.db2.gz LRZSROGJDOZEIS-QFIPXVFZSA-N 0 3 416.587 4.035 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)N[C@H](CO)c1c(Cl)cccc1Cl ZINC000474037411 888882792 /nfs/dbraw/zinc/88/27/92/888882792.db2.gz VLTLNLLEYJURGR-RBUKOAKNSA-N 0 3 422.356 4.163 20 0 HIADHN COc1ccc2c(c1)C(C)(C)C[C@@H]2N[C@H](C)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000474070456 888898686 /nfs/dbraw/zinc/89/86/86/888898686.db2.gz BJQTZTZLDUCZIZ-VFNWGFHPSA-N 0 3 402.560 4.019 20 0 HIADHN COc1ccc2c(c1)C(C)(C)C[C@@H]2N[C@@H](C)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000474070454 888898723 /nfs/dbraw/zinc/89/87/23/888898723.db2.gz BJQTZTZLDUCZIZ-BTYIYWSLSA-N 0 3 402.560 4.019 20 0 HIADHN CCN(C)C(=O)[C@@H](C)N[C@@H]1CCCc2nc(-c3ccccc3Br)sc21 ZINC000474101788 888924459 /nfs/dbraw/zinc/92/44/59/888924459.db2.gz ZVKUJFQQFPAGJB-IUODEOHRSA-N 0 3 422.392 4.406 20 0 HIADHN CCN(C)C(=O)[C@H](C)N[C@@H]1CCCc2nc(-c3ccc(Br)cc3)sc21 ZINC000474108284 888929043 /nfs/dbraw/zinc/92/90/43/888929043.db2.gz WATORKNHTZYNOK-SWLSCSKDSA-N 0 3 422.392 4.406 20 0 HIADHN C[C@H](NC(=O)c1[nH]c2ccccc2c1Br)[C@H](c1ccccc1)N(C)C ZINC000474172216 889012126 /nfs/dbraw/zinc/01/21/26/889012126.db2.gz RNTCAFZUAGURFE-ORAYPTAESA-N 0 3 400.320 4.352 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N[C@@H](C)c2ccc(Br)cn2)C1 ZINC000474180833 889020379 /nfs/dbraw/zinc/02/03/79/889020379.db2.gz FWLKVUACIOQRAC-DAYGRLMNSA-N 0 3 417.351 4.040 20 0 HIADHN Cc1cnccc1C(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1 ZINC000474198553 889035842 /nfs/dbraw/zinc/03/58/42/889035842.db2.gz OREFVVGWOZAILN-UHFFFAOYSA-N 0 3 400.526 4.007 20 0 HIADHN CC(C)c1nc2c([nH]1)C[C@H](C(=O)NC[C@H](c1cccs1)N1CCC(C)CC1)CC2 ZINC000474203507 889040493 /nfs/dbraw/zinc/04/04/93/889040493.db2.gz IOWGQRFHDWNZFQ-YLJYHZDGSA-N 0 3 414.619 4.289 20 0 HIADHN CC(C)c1nc2c([nH]1)CC[C@@H](C(=O)NC[C@H](c1cccs1)N1CCC(C)CC1)C2 ZINC000474203507 889040512 /nfs/dbraw/zinc/04/05/12/889040512.db2.gz IOWGQRFHDWNZFQ-YLJYHZDGSA-N 0 3 414.619 4.289 20 0 HIADHN Cn1c2ccc(CN3CCC[C@@H](c4nc(-c5ccc(F)cc5)no4)C3)cc2sc1=O ZINC000474263718 889125389 /nfs/dbraw/zinc/12/53/89/889125389.db2.gz FLYPLDUTUFJLSK-MRXNPFEDSA-N 0 3 424.501 4.169 20 0 HIADHN COc1ccc2c(c1)CN(Cc1cnc(-c3cnn(C)c3)nc1)[C@@H](C1CCCCC1)C2 ZINC000474282900 889148080 /nfs/dbraw/zinc/14/80/80/889148080.db2.gz LEOIBEBBZCRWLV-XMMPIXPASA-N 0 3 417.557 4.393 20 0 HIADHN CC[C@H]1CCCCN1CCNC(=O)c1ccc(NC(=O)Nc2ccccc2)s1 ZINC000474301925 889168936 /nfs/dbraw/zinc/16/89/36/889168936.db2.gz KGOUVCQDCNUGHQ-KRWDZBQOSA-N 0 3 400.548 4.386 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1NC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000474330346 889203216 /nfs/dbraw/zinc/20/32/16/889203216.db2.gz LRIFEQQFVSCVHN-QFIPXVFZSA-N 0 3 403.530 4.227 20 0 HIADHN COc1ccc2nc(CNCc3ccc(CN4C[C@@H](C)O[C@@H](C)C4)cc3)sc2c1 ZINC000474353202 889230939 /nfs/dbraw/zinc/23/09/39/889230939.db2.gz NMRFJRSKWIJUBR-CALCHBBNSA-N 0 3 411.571 4.204 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3ccccc3OCC(F)F)c(C)c2)CC1 ZINC000474354222 889232970 /nfs/dbraw/zinc/23/29/70/889232970.db2.gz JIJYLYBSBKDBSQ-UHFFFAOYSA-N 0 3 418.488 4.425 20 0 HIADHN Cc1cc(Oc2ncccn2)ccc1NC(=O)N[C@H](C)[C@@H](c1ccccc1)N(C)C ZINC000474427373 889292897 /nfs/dbraw/zinc/29/28/97/889292897.db2.gz AJSIGEJADDEZKR-UTKZUKDTSA-N 0 3 405.502 4.390 20 0 HIADHN C[C@@H](NC(=O)Nc1nnc(Cc2cccc(F)c2)s1)[C@@H](c1ccccc1)N(C)C ZINC000474434111 889299372 /nfs/dbraw/zinc/29/93/72/889299372.db2.gz XCIWQBKJGPMLKH-KUHUBIRLSA-N 0 3 413.522 4.081 20 0 HIADHN CC(C)n1cnnc1-c1ccccc1NC(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C ZINC000474440373 889305748 /nfs/dbraw/zinc/30/57/48/889305748.db2.gz SBEDNHPRTNUWJY-LAUBAEHRSA-N 0 3 406.534 4.339 20 0 HIADHN O=C(NCCNCc1ccc(Br)cc1C(F)(F)F)c1cccs1 ZINC000474475947 889336997 /nfs/dbraw/zinc/33/69/97/889336997.db2.gz XEVBEVONONGRTG-UHFFFAOYSA-N 0 3 407.255 4.049 20 0 HIADHN Cc1cc(Br)cc2c(C(=O)NCCCCN3C[C@@H](C)O[C@@H](C)C3)coc21 ZINC000474494439 889354551 /nfs/dbraw/zinc/35/45/51/889354551.db2.gz GPFWYQYESGEFGX-GASCZTMLSA-N 0 3 423.351 4.123 20 0 HIADHN C[C@H]1CN(CCCCNC(=O)CCCc2cccc(C(F)(F)F)c2)C[C@H](C)O1 ZINC000474495575 889356108 /nfs/dbraw/zinc/35/61/08/889356108.db2.gz MYGGGBXJDCCVDX-IRXDYDNUSA-N 0 3 400.485 4.034 20 0 HIADHN CCCCn1cc(C(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)c(C)n1 ZINC000474531850 889403496 /nfs/dbraw/zinc/40/34/96/889403496.db2.gz ACVOYHYXJFSFCW-OAQYLSRUSA-N 0 3 420.561 4.196 20 0 HIADHN Cc1nc2ccccc2n1C1CCN(C(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)CC1 ZINC000474537721 889412645 /nfs/dbraw/zinc/41/26/45/889412645.db2.gz HCGZSBISGVDVJJ-UPVQGACJSA-N 0 3 417.557 4.137 20 0 HIADHN COCc1cccc2sc(NC(=O)N(C)[C@@H]3CCN(Cc4ccccc4)C3)nc21 ZINC000474631635 889494547 /nfs/dbraw/zinc/49/45/47/889494547.db2.gz SWRMQRVJPRDNDU-GOSISDBHSA-N 0 3 410.543 4.181 20 0 HIADHN CN(C(=O)Nc1ccc(C(=O)NC2CCCC2)cc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000474729534 889585478 /nfs/dbraw/zinc/58/54/78/889585478.db2.gz WYSDABLTATVJKW-HSZRJFAPSA-N 0 3 420.557 4.097 20 0 HIADHN C[C@@H]1CN(c2ccccc2NC(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)C[C@H](C)O1 ZINC000474730983 889586956 /nfs/dbraw/zinc/58/69/56/889586956.db2.gz ZVRXFMZUMMVMQW-RZUBCFFCSA-N 0 3 422.573 4.038 20 0 HIADHN Cc1ccc(NC(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)c(OC[C@H]2CCCO2)c1 ZINC000474740646 889596575 /nfs/dbraw/zinc/59/65/75/889596575.db2.gz ZHUPPQZRPTYJOZ-FGZHOGPDSA-N 0 3 423.557 4.291 20 0 HIADHN COCCOc1c(Cl)cccc1NC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000474742760 889599544 /nfs/dbraw/zinc/59/95/44/889599544.db2.gz LQRSOECXKVJSSY-GOSISDBHSA-N 0 3 417.937 4.103 20 0 HIADHN O=C(c1ccccc1)N1CCC(CNCc2c(F)cccc2Br)CC1 ZINC000474796987 889650509 /nfs/dbraw/zinc/65/05/09/889650509.db2.gz XICPTHXSRAMLBX-UHFFFAOYSA-N 0 3 405.311 4.230 20 0 HIADHN CN1CCN(CCC(C)(C)NC(=O)c2sc3cc(Cl)ccc3c2Cl)CC1 ZINC000474808029 889660720 /nfs/dbraw/zinc/66/07/20/889660720.db2.gz DYHOIFWIRQIVLC-UHFFFAOYSA-N 0 3 414.402 4.354 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N[C@@H](C)c3ccc(-c4cccnc4)cc3)cc2)CC1 ZINC000474868282 889722677 /nfs/dbraw/zinc/72/26/77/889722677.db2.gz KAHVXWHORZORMF-FQEVSTJZSA-N 0 3 414.553 4.382 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)C[C@H](C)c2cccc(C(F)(F)F)c2)CC1 ZINC000474871240 889724787 /nfs/dbraw/zinc/72/47/87/889724787.db2.gz FBHRQJOQTKRTDS-INIZCTEOSA-N 0 3 400.485 4.205 20 0 HIADHN FC(F)(F)COCc1cccc(CNCc2ccc(Cl)cc2-n2cncn2)c1 ZINC000474878627 889733840 /nfs/dbraw/zinc/73/38/40/889733840.db2.gz KUKJTVRDZGFNPI-UHFFFAOYSA-N 0 3 410.827 4.289 20 0 HIADHN CCN(C(=O)Nc1ccccc1-c1nncn1CC)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000474999182 889850448 /nfs/dbraw/zinc/85/04/48/889850448.db2.gz FNTZANFIWZOVNV-HXUWFJFHSA-N 0 3 418.545 4.093 20 0 HIADHN CCN(C(=O)Nc1ccc(OCC(F)F)cc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475008493 889862452 /nfs/dbraw/zinc/86/24/52/889862452.db2.gz OGHBCKQAKXEWIF-LJQANCHMSA-N 0 3 403.473 4.459 20 0 HIADHN CCOc1ccc(F)c(NC(=O)N(CC)[C@H]2CCN(Cc3ccccc3)C2)c1F ZINC000475016269 889869929 /nfs/dbraw/zinc/86/99/29/889869929.db2.gz UMNNDMZTMVATIX-KRWDZBQOSA-N 0 3 403.473 4.492 20 0 HIADHN CCN1CCN(c2cccc(NCc3csc(-c4ccc5c(c4)OCO5)n3)c2)CC1 ZINC000475085091 889930933 /nfs/dbraw/zinc/93/09/33/889930933.db2.gz DLGGBXQFCDIJSZ-UHFFFAOYSA-N 0 3 422.554 4.293 20 0 HIADHN CN(C(=O)NCc1ccc(-c2ccncc2)cc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475104451 889952778 /nfs/dbraw/zinc/95/27/78/889952778.db2.gz SQHMTXMGYQQJLS-XMMPIXPASA-N 0 3 400.526 4.165 20 0 HIADHN CN(C(=O)N[C@H](c1nccs1)c1ccccc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475105228 889954391 /nfs/dbraw/zinc/95/43/91/889954391.db2.gz BJVGBPLXDXZGJG-SFTDATJTSA-N 0 3 406.555 4.148 20 0 HIADHN CCN(C(=O)c1ncccc1Br)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000475105574 889954666 /nfs/dbraw/zinc/95/46/66/889954666.db2.gz DRMHQROJORRICB-DOTOQJQBSA-N 0 3 402.336 4.142 20 0 HIADHN CN(C(=O)NCc1ccc(Oc2ccccc2)nc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475113545 889964806 /nfs/dbraw/zinc/96/48/06/889964806.db2.gz VRGHCQLAAZBHLS-QFIPXVFZSA-N 0 3 416.525 4.290 20 0 HIADHN C[C@H](NC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1)c1cccc(OC(F)F)c1 ZINC000475144160 890011935 /nfs/dbraw/zinc/01/19/35/890011935.db2.gz SLNBZBUIFOMMCY-QFBILLFUSA-N 0 3 403.473 4.265 20 0 HIADHN CCN(C(=O)N[C@H](C)c1cccc(NC(C)=O)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475162328 890027859 /nfs/dbraw/zinc/02/78/59/890027859.db2.gz KADRROWAIGCGCR-JPYJTQIMSA-N 0 3 408.546 4.012 20 0 HIADHN CCN(C(=O)NC[C@@H]1CCCO[C@@H]1c1ccccc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475172752 890039607 /nfs/dbraw/zinc/03/96/07/890039607.db2.gz GCTRFJLEDBNHOR-ISJGIBHGSA-N 0 3 421.585 4.460 20 0 HIADHN C[C@@H](NC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1)c1nc(C2CCCCC2)no1 ZINC000475269199 890164188 /nfs/dbraw/zinc/16/41/88/890164188.db2.gz KUGHXDUGMXTWFY-XLIONFOSSA-N 0 3 411.550 4.094 20 0 HIADHN CN(C(=O)NCc1ccc(-c2cccnc2)cc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475274150 890168847 /nfs/dbraw/zinc/16/88/47/890168847.db2.gz HXOXEFBHKWAADR-DEOSSOPVSA-N 0 3 400.526 4.165 20 0 HIADHN CC[C@H](C)n1ncc2c1nc(C)cc2C(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475303418 890211894 /nfs/dbraw/zinc/21/18/94/890211894.db2.gz ICFJHKUFGOEMDY-AZUAARDMSA-N 0 3 405.546 4.057 20 0 HIADHN CN(C(=O)c1ccc(OCc2ccccc2)nc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475314012 890230456 /nfs/dbraw/zinc/23/04/56/890230456.db2.gz GQONQMQMNQPQID-HSZRJFAPSA-N 0 3 401.510 4.007 20 0 HIADHN CN(C(=O)CSCc1coc(-c2ccccc2)n1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475315673 890231013 /nfs/dbraw/zinc/23/10/13/890231013.db2.gz AVYCGVTYBLKEBO-JOCHJYFZSA-N 0 3 421.566 4.308 20 0 HIADHN Cc1ccc(C(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)cc1NC(=O)c1ccco1 ZINC000475316110 890232117 /nfs/dbraw/zinc/23/21/17/890232117.db2.gz LHANSRPDYFDDJJ-NRFANRHFSA-N 0 3 417.509 4.187 20 0 HIADHN C[C@H]1C(=O)CC[C@H]1CC(=O)N1CCC(N(C)Cc2cccc(C(F)(F)F)c2)CC1 ZINC000475329384 890247409 /nfs/dbraw/zinc/24/74/09/890247409.db2.gz UDALWMNJPUOSQL-WBVHZDCISA-N 0 3 410.480 4.134 20 0 HIADHN COC(=O)[C@H]1CCN(Cc2cccc(NC(=O)c3ccccc3Cl)c2)C[C@@H]1C ZINC000475364679 890292731 /nfs/dbraw/zinc/29/27/31/890292731.db2.gz AGKYSGJBOGECBA-YJBOKZPZSA-N 0 3 400.906 4.223 20 0 HIADHN COC(=O)[C@H]1CCN(Cc2cn(Cc3ccccc3)nc2-c2ccccc2)C[C@@H]1C ZINC000475370547 890300891 /nfs/dbraw/zinc/30/08/91/890300891.db2.gz NTDWOCRAJDTXBA-CVDCTZTESA-N 0 3 403.526 4.229 20 0 HIADHN Cc1nc(COc2ccccc2C(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)cs1 ZINC000475420536 890342372 /nfs/dbraw/zinc/34/23/72/890342372.db2.gz HCINBNOVKBUSSY-NRFANRHFSA-N 0 3 421.566 4.377 20 0 HIADHN C[C@H](Cc1ccc(C(F)(F)F)cc1)N[C@@H](C(N)=O)c1cccc(Br)c1 ZINC000475434647 890354375 /nfs/dbraw/zinc/35/43/75/890354375.db2.gz OWASKXVUYJPBEY-BDJLRTHQSA-N 0 3 415.253 4.215 20 0 HIADHN O=C1c2ccccc2C(=O)N1CCC1=CCN(Cc2cc(F)cc3cccnc32)CC1 ZINC000475494641 890401917 /nfs/dbraw/zinc/40/19/17/890401917.db2.gz QUXVMHXHSRUPNN-UHFFFAOYSA-N 0 3 415.468 4.192 20 0 HIADHN CCOc1cc(CN[C@@H]2CCCc3ccc(F)cc32)ccc1O[C@@H](C)C(=O)N(C)C ZINC000475517370 890436256 /nfs/dbraw/zinc/43/62/56/890436256.db2.gz SYCCVJAQPGFINC-HRAATJIYSA-N 0 3 414.521 4.247 20 0 HIADHN COc1ccc(CN(CCc2ccccn2)Cc2ccc3c(c2)sc(=O)n3C)cc1 ZINC000475577603 890508406 /nfs/dbraw/zinc/50/84/06/890508406.db2.gz ZUWOKPJOHFEXRF-UHFFFAOYSA-N 0 3 419.550 4.249 20 0 HIADHN CC1CCN([C@H](CNC(=O)Nc2ccc([S@@](C)=O)cc2)c2cccs2)CC1 ZINC000475626026 890563141 /nfs/dbraw/zinc/56/31/41/890563141.db2.gz PSIAOKMTANIJTM-DNOBIOAJSA-N 0 3 405.589 4.080 20 0 HIADHN CCCCOc1ccc(CN2CCC[C@@H](N(C)Cc3noc(C)n3)CC2)cc1OC ZINC000475627164 890565518 /nfs/dbraw/zinc/56/55/18/890565518.db2.gz OQYIXVBZOBTARM-HXUWFJFHSA-N 0 3 416.566 4.052 20 0 HIADHN C[C@@H](CC(=O)Nc1ccccc1)N[C@H](CO)c1ccc(Cl)cc1C(F)(F)F ZINC000475638465 890579436 /nfs/dbraw/zinc/57/94/36/890579436.db2.gz PECYSAVIIMIIPJ-YVEFUNNKSA-N 0 3 400.828 4.399 20 0 HIADHN CCOc1ccc(NC(=O)NC2CCN(CCOC(C)C)CC2)c(C(F)(F)F)c1 ZINC000475655109 890599427 /nfs/dbraw/zinc/59/94/27/890599427.db2.gz IAGMANXYBMCOBQ-UHFFFAOYSA-N 0 3 417.472 4.115 20 0 HIADHN CCc1nnc(-c2ccc(NC(=O)N(CCCc3ccccc3)CCN(C)C)cc2)o1 ZINC000475697531 890636861 /nfs/dbraw/zinc/63/68/61/890636861.db2.gz GEGIEZAFGCWBTB-UHFFFAOYSA-N 0 3 421.545 4.327 20 0 HIADHN CN(C)[C@H]1Cc2ccccc2N(C(=O)c2cc3sc(N4CCCC4)nc3s2)C1 ZINC000475802421 890737163 /nfs/dbraw/zinc/73/71/63/890737163.db2.gz ZKNMCAZMHBFIMU-HNNXBMFYSA-N 0 3 412.584 4.091 20 0 HIADHN CC(C)C[C@H](NC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1CO)c1cccs1 ZINC000475916824 890844687 /nfs/dbraw/zinc/84/46/87/890844687.db2.gz ONBQESMKYLLBED-HBMCJLEFSA-N 0 3 415.603 4.018 20 0 HIADHN Cc1nc([C@H](C)NC(=O)N[C@@H](CN2CCc3ccccc3C2)C(C)(C)C)cs1 ZINC000476052551 890982471 /nfs/dbraw/zinc/98/24/71/890982471.db2.gz UNFFOAKBXINYDL-YWZLYKJASA-N 0 3 400.592 4.285 20 0 HIADHN Cn1cc(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)c(-c2ccc(Cl)s2)n1 ZINC000476062515 890991150 /nfs/dbraw/zinc/99/11/50/890991150.db2.gz ONGLJADBMZXHBW-INIZCTEOSA-N 0 3 414.962 4.196 20 0 HIADHN O=C(CN1CC[C@@H](c2ccccc2)C1)N1CCC[C@H]1c1ccc2c(c1)OCCCO2 ZINC000476241932 891165564 /nfs/dbraw/zinc/16/55/64/891165564.db2.gz MWHABZCWYOICMG-YADHBBJMSA-N 0 3 406.526 4.001 20 0 HIADHN O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)N(Cc1ccccc1)CC1CCOCC1 ZINC000476269247 891190375 /nfs/dbraw/zinc/19/03/75/891190375.db2.gz RGLKMULPHFFHKB-RUZDIDTESA-N 0 3 421.585 4.289 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N(C)[C@H](C)[C@H](C)c2ccc(Cl)cc2)CC1 ZINC000476437678 891350062 /nfs/dbraw/zinc/35/00/62/891350062.db2.gz RVMBKBSHVYHCEV-ZWKOTPCHSA-N 0 3 410.002 4.363 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N(C)Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000476439924 891353069 /nfs/dbraw/zinc/35/30/69/891353069.db2.gz ZQZOCGZBTKEVFA-UHFFFAOYSA-N 0 3 402.366 4.024 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N2Cc3ccccc3C[C@H]2c2ccccc2)CC1 ZINC000476448838 891360698 /nfs/dbraw/zinc/36/06/98/891360698.db2.gz VBTAIUABKNQSCW-VWLOTQADSA-N 0 3 421.585 4.385 20 0 HIADHN CCCSc1nsc(NC(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)n1 ZINC000476502759 891416502 /nfs/dbraw/zinc/41/65/02/891416502.db2.gz HHCATWGEOUCASP-HNNXBMFYSA-N 0 3 405.593 4.169 20 0 HIADHN CCN(C[C@H]1CCN(CC(=O)N(C)[C@H](C)c2ccc(Cl)cc2)C1)CC(F)(F)F ZINC000476579998 891504800 /nfs/dbraw/zinc/50/48/00/891504800.db2.gz WIAJSYNADVMCET-HZPDHXFCSA-N 0 3 419.919 4.066 20 0 HIADHN CCc1onc(-c2ccccc2)c1C(=O)Nc1cccc2c1CCN(CC(C)(C)O)C2 ZINC000476646323 891586581 /nfs/dbraw/zinc/58/65/81/891586581.db2.gz RKQVWBYSJOXGHV-UHFFFAOYSA-N 0 3 419.525 4.285 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)C3(Cc4cccc(F)c4)CCC3)CC2)C[C@H](C)O1 ZINC000476649991 891592428 /nfs/dbraw/zinc/59/24/28/891592428.db2.gz VMZIZYVJALDXEG-BGYRXZFFSA-N 0 3 416.581 4.276 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)NCc1ccc(-c2csc(C)n2)o1)c1ccco1 ZINC000476813570 891800627 /nfs/dbraw/zinc/80/06/27/891800627.db2.gz JOTOELSQEUREAP-XJKSGUPXSA-N 0 3 402.520 4.233 20 0 HIADHN Cc1nc(-c2ccc(CNC(=O)N[C@H]3CCCN(Cc4ccccc4)C3)o2)cs1 ZINC000504888178 913620146 /nfs/dbraw/zinc/62/01/46/913620146.db2.gz HNMYGOHGSSKHPL-SFHVURJKSA-N 0 3 410.543 4.175 20 0 HIADHN COCCN1CCC[C@@H]1CNC(=O)N(Cc1ccc(C)cc1)[C@@H]1CCc2ccccc21 ZINC000477112295 892044343 /nfs/dbraw/zinc/04/43/43/892044343.db2.gz UVQJNNIAWUGHDZ-ILBGXUMGSA-N 0 3 421.585 4.305 20 0 HIADHN Cc1ccnc(Oc2ccc(NC(=O)N[C@H](CN(C)C)c3ccc(F)cc3)cc2)n1 ZINC000477135307 892063802 /nfs/dbraw/zinc/06/38/02/892063802.db2.gz PSVFJEDNOJBJIS-HXUWFJFHSA-N 0 3 409.465 4.141 20 0 HIADHN CCN(Cc1ccc(OCc2ccccn2)cc1)Cc1ccc(C(=O)N(C)C)cc1 ZINC000477158214 892080307 /nfs/dbraw/zinc/08/03/07/892080307.db2.gz FUYKRIIEWWFOLP-UHFFFAOYSA-N 0 3 403.526 4.385 20 0 HIADHN Cc1ccnc(Oc2ccc(NC(=O)N[C@H](C)[C@@H](c3ccccc3)N(C)C)cc2)n1 ZINC000477183888 892104123 /nfs/dbraw/zinc/10/41/23/892104123.db2.gz AJZPIBJAVFZSOY-UTKZUKDTSA-N 0 3 405.502 4.390 20 0 HIADHN O=C(N[C@H]1CCCN(Cc2ccccc2)C1)N1CCC(c2nc3ccccc3[nH]2)CC1 ZINC000504900607 913632181 /nfs/dbraw/zinc/63/21/81/913632181.db2.gz AIXSDXCSVRCLOI-NRFANRHFSA-N 0 3 417.557 4.117 20 0 HIADHN Cc1cccc2c1[C@H](C)C[C@H]2NCc1ccccc1OCC(=O)NC[C@H]1CCCO1 ZINC000504900228 913632535 /nfs/dbraw/zinc/63/25/35/913632535.db2.gz UFZWKUMKCKKYIK-SYYKKAFVSA-N 0 3 408.542 4.007 20 0 HIADHN C[C@@H](C(=O)N(C)Cc1ccc(Br)cc1)N1CC[C@@H](c2ccccc2)C1 ZINC000477242226 892190810 /nfs/dbraw/zinc/19/08/10/892190810.db2.gz HELZMCPRBACXOW-QFBILLFUSA-N 0 3 401.348 4.286 20 0 HIADHN CC[C@@H](C)n1ncc(NC(=O)CCCN2CCN(c3ccccc3)CC2)c1C1CC1 ZINC000477245305 892194708 /nfs/dbraw/zinc/19/47/08/892194708.db2.gz UCHKJSLCGPXYIA-LJQANCHMSA-N 0 3 409.578 4.272 20 0 HIADHN Cc1nc([C@H](C)N2CCN(CC3CCOCC3)CC2)oc1-c1ccc(Cl)cc1 ZINC000477263513 892216974 /nfs/dbraw/zinc/21/69/74/892216974.db2.gz IFPCSYWCSMGUQI-KRWDZBQOSA-N 0 3 403.954 4.409 20 0 HIADHN COc1ccc([C@H](N[C@@H](C)C(=O)N[C@@H](C)c2cc(OC)ccc2OC)C2CC2)cc1 ZINC000477326739 892293645 /nfs/dbraw/zinc/29/36/45/892293645.db2.gz WHBBAICGRFRELY-PBPSECFOSA-N 0 3 412.530 4.019 20 0 HIADHN Cc1cc(Br)ccc1CNC(=O)N(CCN(C)C)Cc1ccccc1F ZINC000477358384 892324528 /nfs/dbraw/zinc/32/45/28/892324528.db2.gz ISGBYWUUHCIBMH-UHFFFAOYSA-N 0 3 422.342 4.170 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCc3nc(C(C)C)cs3)c(C)c2)CC1 ZINC000477412097 892364508 /nfs/dbraw/zinc/36/45/08/892364508.db2.gz DYFYLCMUJKOWEA-UHFFFAOYSA-N 0 3 401.580 4.039 20 0 HIADHN CCn1ncc2ccc(NC(=O)NC[C@@H](c3ccc(OC)cc3)N3CCCC3)cc21 ZINC000477416174 892370125 /nfs/dbraw/zinc/37/01/25/892370125.db2.gz ITVWPNJIWGFZIJ-QFIPXVFZSA-N 0 3 407.518 4.023 20 0 HIADHN CN(Cc1ccccc1N1CCCC1)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000504923298 913660996 /nfs/dbraw/zinc/66/09/96/913660996.db2.gz GJQCYCFDPCRARR-HSZRJFAPSA-N 0 3 406.574 4.093 20 0 HIADHN O[C@H](COc1ccc(Cl)cc1Cl)CN1CCC[C@@H]1c1ccc2c(c1)OCO2 ZINC000477462761 892430826 /nfs/dbraw/zinc/43/08/26/892430826.db2.gz GCPZFHOAIOKRBE-DOTOQJQBSA-N 0 3 410.297 4.299 20 0 HIADHN C/C=C/c1ccc(OC[C@H](O)CN2CCC[C@@H]2c2ccc3c(c2)OCO3)c(OC)c1 ZINC000477465037 892434668 /nfs/dbraw/zinc/43/46/68/892434668.db2.gz PFSCEEKDIWADTJ-YGXGPUHLSA-N 0 3 411.498 4.034 20 0 HIADHN Cc1cc(C(=O)NCc2ccccc2CN(C)C)c2ccc(Br)cc2n1 ZINC000512380570 921117714 /nfs/dbraw/zinc/11/77/14/921117714.db2.gz DHGSFWUZTKEARH-UHFFFAOYSA-N 0 3 412.331 4.297 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)N[C@H](C)c2ccc(C(F)(F)F)cc2)cc1 ZINC000477623191 892729872 /nfs/dbraw/zinc/72/98/72/892729872.db2.gz QPWNGUBDXMDPBI-KUHUBIRLSA-N 0 3 409.452 4.377 20 0 HIADHN CC1CCN(C(=O)CNC2(c3ccc(OCc4ccccc4)cc3)CCOCC2)CC1 ZINC000477653561 892783400 /nfs/dbraw/zinc/78/34/00/892783400.db2.gz SCZXXOOUJOWXKZ-UHFFFAOYSA-N 0 3 422.569 4.119 20 0 HIADHN Cc1nn(C)c(C)c1NC(=O)CNC1(c2cccc(Br)c2)CCCCC1 ZINC000477662414 892800547 /nfs/dbraw/zinc/80/05/47/892800547.db2.gz NEXAXKZHVSTNLY-UHFFFAOYSA-N 0 3 419.367 4.187 20 0 HIADHN CCC(C)(C)NC(=O)CNC1(c2ccc(OCc3ccccc3)cc2)CCOCC1 ZINC000477668093 892802992 /nfs/dbraw/zinc/80/29/92/892802992.db2.gz WPLCWZRPZDAZQE-UHFFFAOYSA-N 0 3 410.558 4.166 20 0 HIADHN COc1ccc(CCCCC(=O)Nc2cccc(CN3CCC(CO)CC3)c2)cc1 ZINC000477724183 892826977 /nfs/dbraw/zinc/82/69/77/892826977.db2.gz WZEVANVOBOMWIA-UHFFFAOYSA-N 0 3 410.558 4.251 20 0 HIADHN COc1cc(C2(C(=O)Nc3cccc(CN4CCC(CO)CC4)c3)CCC2)ccc1C ZINC000477724207 892827081 /nfs/dbraw/zinc/82/70/81/892827081.db2.gz YBBSEZGNJZEHHY-UHFFFAOYSA-N 0 3 422.569 4.268 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1c[nH]cc1-c1ccc(F)cc1 ZINC000477743949 892838801 /nfs/dbraw/zinc/83/88/01/892838801.db2.gz KDIBXHXFBQWHTG-UHFFFAOYSA-N 0 3 407.489 4.277 20 0 HIADHN C[C@H](NC(=O)c1oc2ccccc2c1CN(C)C)c1ccc(Br)cn1 ZINC000477792129 892870028 /nfs/dbraw/zinc/87/00/28/892870028.db2.gz AAJAOWGSVAELJR-LBPRGKRZSA-N 0 3 402.292 4.143 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N(C)Cc2nc(-c3ccccc3)c[nH]2)C1 ZINC000477817704 892885704 /nfs/dbraw/zinc/88/57/04/892885704.db2.gz GQNQZRULKFMLBB-WIYYLYMNSA-N 0 3 403.530 4.054 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)NCCc1ccc(Br)s1)c1ccco1 ZINC000477844410 892903137 /nfs/dbraw/zinc/90/31/37/892903137.db2.gz MLBSRHBZAJIKQR-JSGCOSHPSA-N 0 3 414.369 4.075 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)N[C@H]1CCCc2[nH]c(=O)ccc21)c1ccc(Cl)cc1 ZINC000477881136 892946346 /nfs/dbraw/zinc/94/63/46/892946346.db2.gz QNNVHORSOBINQT-PMACEKPBSA-N 0 3 416.953 4.200 20 0 HIADHN COc1cc(NC(=O)N(CCN(C)C)Cc2cccc(Cl)c2)c(C)c(OC)c1 ZINC000504993579 913737232 /nfs/dbraw/zinc/73/72/32/913737232.db2.gz DNCAYOOYJCWIEN-UHFFFAOYSA-N 0 3 405.926 4.261 20 0 HIADHN CCc1c(C(=O)NC2CCN(Cc3ccccc3)CC2)cnn1-c1ccccc1Cl ZINC000478059676 893217750 /nfs/dbraw/zinc/21/77/50/893217750.db2.gz OPHJWIBJEQUQBP-UHFFFAOYSA-N 0 3 422.960 4.483 20 0 HIADHN Cc1c(NC(=O)N[C@H](CN(C)C)c2ccc(F)cc2)cnn1-c1cc(C)ccc1C ZINC000478068506 893229757 /nfs/dbraw/zinc/22/97/57/893229757.db2.gz CYLZLJJNOJMCLF-OAQYLSRUSA-N 0 3 409.509 4.361 20 0 HIADHN CCCN(C(=O)CCc1c(C)noc1Cl)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000505005770 913749337 /nfs/dbraw/zinc/74/93/37/913749337.db2.gz NPGRGJFFSWTBRX-IBGZPJMESA-N 0 3 403.954 4.472 20 0 HIADHN Cc1ccc(-c2nc(NC[C@H](C)N3CCN(C)CC3)nc3sc4c(c32)CCC4)cc1 ZINC000478256517 893434904 /nfs/dbraw/zinc/43/49/04/893434904.db2.gz JSDLZFRAYWQQMQ-KRWDZBQOSA-N 0 3 421.614 4.203 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2CNCc2nc3ccc(Cl)cc3n2C)C[C@@H](C)O1 ZINC000478312976 893536628 /nfs/dbraw/zinc/53/66/28/893536628.db2.gz LEBBBFXLPGOFOC-IAGOWNOFSA-N 0 3 412.965 4.126 20 0 HIADHN Cc1ccc(C(=O)N[C@@H]2CN(C)C[C@@H]2c2ccccc2)cc1NC(=O)c1ccccc1 ZINC000478372282 893637304 /nfs/dbraw/zinc/63/73/04/893637304.db2.gz PUUPJKAJQJVZLV-ISKFKSNPSA-N 0 3 413.521 4.075 20 0 HIADHN CN1C[C@H](NC(=O)CCc2ncc(-c3ccc(Cl)cc3)o2)[C@H](c2ccccc2)C1 ZINC000478377312 893642762 /nfs/dbraw/zinc/64/27/62/893642762.db2.gz YRRCGFKCWMSMLX-PMACEKPBSA-N 0 3 409.917 4.142 20 0 HIADHN O=C(CC1(N2CCOCC2)CCCC1)N1CC=C(c2ccccc2C(F)(F)F)CC1 ZINC000478402102 893688036 /nfs/dbraw/zinc/68/80/36/893688036.db2.gz AODILDKYALMECS-UHFFFAOYSA-N 0 3 422.491 4.356 20 0 HIADHN COc1cnccc1N1CCN(C(=O)c2cc(C3CC3)nc3ccc(Cl)cc32)CC1 ZINC000478438215 893742604 /nfs/dbraw/zinc/74/26/04/893742604.db2.gz KRFJXABNXNGVLC-UHFFFAOYSA-N 0 3 422.916 4.132 20 0 HIADHN CN1C[C@H](NC(=O)CCc2ncc(-c3ccccc3Cl)o2)[C@@H](c2ccccc2)C1 ZINC000478453021 893770509 /nfs/dbraw/zinc/77/05/09/893770509.db2.gz SGWGSXOTWHFIFU-QUCCMNQESA-N 0 3 409.917 4.142 20 0 HIADHN CN1CCN(CCC(C)(C)NC(=O)c2ccc(Sc3ccc(Cl)cc3)o2)CC1 ZINC000478596262 893865879 /nfs/dbraw/zinc/86/58/79/893865879.db2.gz JZQWAWMJSNOXOH-UHFFFAOYSA-N 0 3 421.994 4.230 20 0 HIADHN CCOc1ccc(NC(=O)N(CCN(C)C)Cc2cccc(OC)c2)cc1Cl ZINC000478788222 894063821 /nfs/dbraw/zinc/06/38/21/894063821.db2.gz LLCFSKSHQYCIRO-UHFFFAOYSA-N 0 3 405.926 4.343 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N2CC3(CCOCC3)c3ccccc32)C1 ZINC000478793313 894068940 /nfs/dbraw/zinc/06/89/40/894068940.db2.gz IMOLWIMELVQWRL-CTNGQTDRSA-N 0 3 405.542 4.100 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)c2ccccc2NCc2cccnc2)N(C)C)cc1 ZINC000478800834 894074946 /nfs/dbraw/zinc/07/49/46/894074946.db2.gz RXCCMKIDSAZZQQ-XMMPIXPASA-N 0 3 402.542 4.289 20 0 HIADHN Cc1ccc(C(C)C)c(O[C@@H](C)C(=O)NCc2ccccc2CN2CCC(O)CC2)c1 ZINC000478869810 894147790 /nfs/dbraw/zinc/14/77/90/894147790.db2.gz RROXGSDSIAXJAE-FQEVSTJZSA-N 0 3 424.585 4.159 20 0 HIADHN CN(C)Cc1cccc(NC(=O)[C@@H]2CC(=O)N(C)[C@@H]2c2ccc(Cl)c(Cl)c2)c1 ZINC000478904036 894184286 /nfs/dbraw/zinc/18/42/86/894184286.db2.gz SNFSWGZZANYGDL-OXQOHEQNSA-N 0 3 420.340 4.213 20 0 HIADHN CN(C)Cc1cccc(NC(=O)N[C@H](CO)c2ccc(Cl)cc2C(F)(F)F)c1 ZINC000478907878 894188465 /nfs/dbraw/zinc/18/84/65/894188465.db2.gz NHGCYDFAQJYPSM-QGZVFWFLSA-N 0 3 415.843 4.276 20 0 HIADHN NC(=O)[C@H](NCCCCOc1ccc(Cl)cc1)c1cccc(Br)c1 ZINC000479016613 894282764 /nfs/dbraw/zinc/28/27/64/894282764.db2.gz VAVZLTIWLHYAPA-QGZVFWFLSA-N 0 3 411.727 4.078 20 0 HIADHN NC(=O)[C@@H](NCCCCOc1ccc(Cl)cc1)c1cccc(Br)c1 ZINC000479015748 894282874 /nfs/dbraw/zinc/28/28/74/894282874.db2.gz VAVZLTIWLHYAPA-KRWDZBQOSA-N 0 3 411.727 4.078 20 0 HIADHN Cc1cc(C)c(S(N)(=O)=O)cc1[C@@H](C)N[C@H](C)c1ccc(-c2cccnc2)cc1 ZINC000479062421 894321757 /nfs/dbraw/zinc/32/17/57/894321757.db2.gz BDIWAFYJRDHBQE-QZTJIDSGSA-N 0 3 409.555 4.425 20 0 HIADHN Cc1cc(C)c(S(N)(=O)=O)cc1[C@@H](C)N[C@@H](C)c1ccc(-c2cccnc2)cc1 ZINC000479062424 894322246 /nfs/dbraw/zinc/32/22/46/894322246.db2.gz BDIWAFYJRDHBQE-ZWKOTPCHSA-N 0 3 409.555 4.425 20 0 HIADHN C[C@@H](NC[C@@H](C)c1ccc(F)cc1F)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479066747 894330609 /nfs/dbraw/zinc/33/06/09/894330609.db2.gz VCHGHGAEMOHSAL-NXEZZACHSA-N 0 3 423.312 4.373 20 0 HIADHN CC[C@H](C)NC(=O)[C@@H]1C[C@H](C)N(CC(=O)N[C@H](C)c2cccs2)[C@@H]2CCCC[C@@H]12 ZINC000479111035 894379125 /nfs/dbraw/zinc/37/91/25/894379125.db2.gz VLPYRQJLEDTQRE-AXGBLAMUSA-N 0 3 419.635 4.109 20 0 HIADHN CC[C@H](C)NC(=O)[C@@H]1C[C@H](C)N(Cc2nc(-c3ccsc3)no2)[C@@H]2CCCC[C@@H]12 ZINC000479114290 894382073 /nfs/dbraw/zinc/38/20/73/894382073.db2.gz IGXGGZLOAITQNC-WAARBJQMSA-N 0 3 416.591 4.482 20 0 HIADHN CC[C@H](C)NC(=O)[C@@H]1C[C@H](C)N(Cc2nc(-c3ccsc3)no2)[C@H]2CCCC[C@H]12 ZINC000479114289 894382228 /nfs/dbraw/zinc/38/22/28/894382228.db2.gz IGXGGZLOAITQNC-OBQKDBCYSA-N 0 3 416.591 4.482 20 0 HIADHN COC(=O)c1ccc([C@@H](NC(=O)c2cccc(CN3CCCC3)c2)C(F)(F)F)cc1 ZINC000479121878 894390567 /nfs/dbraw/zinc/39/05/67/894390567.db2.gz QXDRDRKFQYDGJL-LJQANCHMSA-N 0 3 420.431 4.102 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)Nc2ccc(C(F)(F)F)nc2)N(C)C)cc1 ZINC000479129899 894397392 /nfs/dbraw/zinc/39/73/92/894397392.db2.gz GRMVVZCHRSJAQY-KRWDZBQOSA-N 0 3 410.440 4.312 20 0 HIADHN CC[C@@H](C)n1nc(C(=O)Nc2c(C)cnn2[C@H]2CCN(Cc3ccccc3)C2)cc1C ZINC000479184270 894450838 /nfs/dbraw/zinc/45/08/38/894450838.db2.gz HZGPUDHFKIMHFW-NQIIRXRSSA-N 0 3 420.561 4.367 20 0 HIADHN CC[C@H](C)n1nc(C(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)cc1C ZINC000479184330 894451489 /nfs/dbraw/zinc/45/14/89/894451489.db2.gz IHDHCFDDPBIHJV-PXNSSMCTSA-N 0 3 406.534 4.058 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N(CCc3cccc(F)c3)C3CC3)cc2)CC1 ZINC000505206146 913883256 /nfs/dbraw/zinc/88/32/56/913883256.db2.gz ZBENTOGGFIIYBZ-UHFFFAOYSA-N 0 3 409.549 4.203 20 0 HIADHN C[C@@H]1CN(Cc2cccc(CN[C@H]3CCCc4nn(-c5ccccc5)cc43)c2)CCO1 ZINC000479344127 894638041 /nfs/dbraw/zinc/63/80/41/894638041.db2.gz AWHJVMKLOMWVSE-NLFFAJNJSA-N 0 3 416.569 4.260 20 0 HIADHN COCCOc1ccc([C@@H](C)N[C@@H]2CCc3cc(OC)c(OC)cc32)cc1OC ZINC000479344761 894639903 /nfs/dbraw/zinc/63/99/03/894639903.db2.gz DBSMFKCRVQILMZ-DNVCBOLYSA-N 0 3 401.503 4.076 20 0 HIADHN COc1cc(CN[C@H]2CC(C)(C)c3ccc(Br)cc32)ccc1OCCO ZINC000479365692 894664209 /nfs/dbraw/zinc/66/42/09/894664209.db2.gz UEJLOJZYDVTWKH-SFHVURJKSA-N 0 3 420.347 4.341 20 0 HIADHN Cc1cc(C)c(S(N)(=O)=O)cc1[C@H](C)NCc1ccc(COc2ccccc2)cc1 ZINC000479385872 894687434 /nfs/dbraw/zinc/68/74/34/894687434.db2.gz GSIUKZMCNSSLPO-IBGZPJMESA-N 0 3 424.566 4.381 20 0 HIADHN C[C@@H](N[C@H]1CCOC2(CCCCC2)C1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479385883 894687958 /nfs/dbraw/zinc/68/79/58/894687958.db2.gz FZWYHPRYZUNHDZ-OLZOCXBDSA-N 0 3 421.390 4.173 20 0 HIADHN CCS(=O)(=O)c1c(Cl)cccc1CNC1CCN([C@H](C)c2ccccc2)CC1 ZINC000479394790 894697533 /nfs/dbraw/zinc/69/75/33/894697533.db2.gz NDAKYTUTRCAWPB-QGZVFWFLSA-N 0 3 421.006 4.449 20 0 HIADHN COc1c(Br)cccc1CNCCc1nc(-c2ccncc2)cs1 ZINC000479431076 894745467 /nfs/dbraw/zinc/74/54/67/894745467.db2.gz YDOIIZIUXAJZJY-UHFFFAOYSA-N 0 3 404.333 4.309 20 0 HIADHN CCS(=O)(=O)c1c(Cl)cccc1CNC[C@H](c1ccccc1)C(C)(C)CO ZINC000479436195 894751717 /nfs/dbraw/zinc/75/17/17/894751717.db2.gz JDXQOESVVKSGPI-GOSISDBHSA-N 0 3 409.979 4.026 20 0 HIADHN CCc1nc2c(s1)[C@H](N(C)C(=O)NCC1(N3CCSCC3)CCCC1)CCC2 ZINC000479436816 894753228 /nfs/dbraw/zinc/75/32/28/894753228.db2.gz KXPIZDUZZHEMSU-QGZVFWFLSA-N 0 3 422.664 4.086 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCc1ccc(F)cn1)c1ccc(C(F)(F)F)cc1 ZINC000479460398 894781960 /nfs/dbraw/zinc/78/19/60/894781960.db2.gz YTYXYGZGPGLPHX-SFHVURJKSA-N 0 3 412.431 4.122 20 0 HIADHN Cc1ccc([C@H](NCCc2cccc(C)n2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000479466017 894788257 /nfs/dbraw/zinc/78/82/57/894788257.db2.gz UCTDNDUCDVJMQI-XMMPIXPASA-N 0 3 408.567 4.332 20 0 HIADHN CCc1ccc([C@H](NCCc2cccc(C)n2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000479466507 894789646 /nfs/dbraw/zinc/78/96/46/894789646.db2.gz VHRUEIIXDSQARQ-DEOSSOPVSA-N 0 3 408.567 4.278 20 0 HIADHN Cc1c([C@@H](C)NC2CC(N3CCC(C(F)(F)F)CC3)C2)nnn1-c1ccc(C)cc1 ZINC000479472019 894794105 /nfs/dbraw/zinc/79/41/05/894794105.db2.gz BRFQOIHRGZJTEQ-MYWSLZCHSA-N 0 3 421.511 4.340 20 0 HIADHN CC(=O)N1CCC[C@@H](CN[C@H](c2ccccc2)c2ccccc2Br)C1 ZINC000479474482 894798138 /nfs/dbraw/zinc/79/81/38/894798138.db2.gz DFYKXHRKPBQIRA-LAUBAEHRSA-N 0 3 401.348 4.387 20 0 HIADHN C[C@H](NCc1ccc2ncccc2c1)c1ccc(S(=O)(=O)NCc2ccco2)cc1 ZINC000479489233 894810836 /nfs/dbraw/zinc/81/08/36/894810836.db2.gz MEJOEQVWLCEJBR-KRWDZBQOSA-N 0 3 421.522 4.157 20 0 HIADHN O=C(CN[C@H]1CCCc2nc(-c3ccc(F)cc3)sc21)N1Cc2ccccc2C1 ZINC000479518115 894829339 /nfs/dbraw/zinc/82/93/39/894829339.db2.gz ZIGXQIJNNGPYHB-IBGZPJMESA-N 0 3 407.514 4.459 20 0 HIADHN CCc1nc2c(s1)[C@H](N(C)C(=O)NC[C@@H](C)N(C)Cc1ccccc1)CCC2 ZINC000479525114 894833768 /nfs/dbraw/zinc/83/37/68/894833768.db2.gz DIWQBCOCYKLWBY-VQIMIIECSA-N 0 3 400.592 4.245 20 0 HIADHN Cc1cc2[nH]c(CNCc3ccc(C(=O)N4C[C@@H](C)O[C@@H](C)C4)cc3)cc2c(C)c1 ZINC000479560531 894857933 /nfs/dbraw/zinc/85/79/33/894857933.db2.gz AZWMWSKUWJOFSH-KDURUIRLSA-N 0 3 405.542 4.324 20 0 HIADHN C[C@H](OC[C@H](O)CN1CCC[C@H]1c1ccc2c(c1)OCO2)c1ccc(Cl)cc1 ZINC000479617287 894887527 /nfs/dbraw/zinc/88/75/27/894887527.db2.gz LOKIJIUPVNAQDT-BEVDRBHNSA-N 0 3 403.906 4.344 20 0 HIADHN COc1cc(NC(=O)N(CCN2CCCC2)Cc2ccc(Cl)cc2)cc(OC)c1 ZINC000479657458 894930612 /nfs/dbraw/zinc/93/06/12/894930612.db2.gz FEKNRVRJLPTAPG-UHFFFAOYSA-N 0 3 417.937 4.487 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3ccc(Br)cc3)CC2)C[C@H](C)O1 ZINC000479685070 894970632 /nfs/dbraw/zinc/97/06/32/894970632.db2.gz KYCSACPVRWFNSP-IYBDPMFKSA-N 0 3 424.383 4.192 20 0 HIADHN CN(Cc1ccc(F)cc1Br)C(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000479729342 895027750 /nfs/dbraw/zinc/02/77/50/895027750.db2.gz LJJDLQYGVAMCER-OALUTQOASA-N 0 3 420.326 4.175 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)NCCc1ccc(-n2nc(C)cc2C)cc1)c1ccco1 ZINC000479758363 895058459 /nfs/dbraw/zinc/05/84/59/895058459.db2.gz LBLURZKCBOBRGO-JTSKRJEESA-N 0 3 423.561 4.053 20 0 HIADHN Cc1nn(C)c(C)c1C[C@@H](C)C(=O)N1CCN(Cc2ccccc2)C2(CCCCC2)C1 ZINC000479856452 895191621 /nfs/dbraw/zinc/19/16/21/895191621.db2.gz YDAZAJHZKMHZED-HXUWFJFHSA-N 0 3 422.617 4.263 20 0 HIADHN COc1ccc(CN[C@H]2CCCOc3ccc(I)cc32)cc1 ZINC000479862469 895199589 /nfs/dbraw/zinc/19/95/89/895199589.db2.gz PDWZETPJRHCROZ-KRWDZBQOSA-N 0 3 409.267 4.303 20 0 HIADHN C[C@H](NCc1ccc(CN2CCOCC2)cc1)c1ccc(F)c(Br)c1 ZINC000479886680 895233342 /nfs/dbraw/zinc/23/33/42/895233342.db2.gz QDNDTQZJUJKTBM-HNNXBMFYSA-N 0 3 407.327 4.271 20 0 HIADHN CC[C@@H](NC[C@@H](c1ccc(OC)c(OC)c1)N1CCOCC1)c1cc(F)ccc1F ZINC000479888725 895234322 /nfs/dbraw/zinc/23/43/22/895234322.db2.gz PJOUDUVBGAWCFC-RTWAWAEBSA-N 0 3 420.500 4.096 20 0 HIADHN C[C@@H]1CCN(C(=O)Nc2nnc(-c3ccccc3)s2)CCN1Cc1ccccc1 ZINC000479951567 895305185 /nfs/dbraw/zinc/30/51/85/895305185.db2.gz AIFLHNCMZUZBAD-QGZVFWFLSA-N 0 3 407.543 4.333 20 0 HIADHN CC(C)Cn1cc(C(=O)NCc2ccccc2CN2CCC(O)CC2)c2ccccc21 ZINC000479979783 895332826 /nfs/dbraw/zinc/33/28/26/895332826.db2.gz KIWXDYAYUQNVKI-UHFFFAOYSA-N 0 3 419.569 4.184 20 0 HIADHN CC[C@H](c1ccccc1)[C@H]1CCCN1Cc1nnc2n1c1ccc(C)cc1c(=O)n2C ZINC000480018197 895368878 /nfs/dbraw/zinc/36/88/78/895368878.db2.gz KXMWEKAGSDXWPI-TZIWHRDSSA-N 0 3 415.541 4.048 20 0 HIADHN CCCc1c(NC(=O)NC[C@@H](N[C@@H](C)CC)c2ccco2)cnn1-c1cc(C)ccn1 ZINC000480077482 895429997 /nfs/dbraw/zinc/42/99/97/895429997.db2.gz LETSMJKJZOLUDB-PKOBYXMFSA-N 0 3 424.549 4.372 20 0 HIADHN COc1cccc([C@@H](CN[C@@H](C)c2nnn(-c3ccc(F)cc3)c2C)N2CCCC2)c1 ZINC000480081452 895437757 /nfs/dbraw/zinc/43/77/57/895437757.db2.gz FOFHEOUPKLZTLB-GAJHUEQPSA-N 0 3 423.536 4.211 20 0 HIADHN CNC(=O)c1ccc(CNCc2ccc(Br)cc2C(F)(F)F)cc1 ZINC000480129610 895504562 /nfs/dbraw/zinc/50/45/62/895504562.db2.gz ZZOYGCPHLIWQFP-UHFFFAOYSA-N 0 3 401.226 4.117 20 0 HIADHN CCC(CC)[C@H](CCN[C@H]1CCS(=O)(=O)c2ccc(Br)cc21)OC ZINC000480167564 895557438 /nfs/dbraw/zinc/55/74/38/895557438.db2.gz DHRGECLWEWXRAY-IRXDYDNUSA-N 0 3 418.397 4.099 20 0 HIADHN C[C@H](c1ccccc1)[C@H](C)N[C@@H]1CCS(=O)(=O)c2ccc(Br)cc21 ZINC000480167647 895558392 /nfs/dbraw/zinc/55/83/92/895558392.db2.gz JLZBEGJZQDUPCU-SUNYJGFJSA-N 0 3 408.361 4.449 20 0 HIADHN CC1(CN[C@@H]2CCS(=O)(=O)c3ccc(Br)cc32)Cc2ccccc2C1 ZINC000480170612 895560779 /nfs/dbraw/zinc/56/07/79/895560779.db2.gz ZASDXUDLVXDDGZ-GOSISDBHSA-N 0 3 420.372 4.062 20 0 HIADHN CCc1ccc(CCN[C@H]2CCS(=O)(=O)c3ccc(Br)cc32)cc1 ZINC000480179752 895572983 /nfs/dbraw/zinc/57/29/83/895572983.db2.gz KOQFSTXIPSJNDA-SFHVURJKSA-N 0 3 408.361 4.062 20 0 HIADHN C[C@H](CN[C@H]1CCS(=O)(=O)c2ccc(Br)cc21)Cc1cccs1 ZINC000480189757 895584898 /nfs/dbraw/zinc/58/48/98/895584898.db2.gz JTKCYQQIJBBWGZ-LRDDRELGSA-N 0 3 414.390 4.198 20 0 HIADHN COc1ccc(OC)c([C@H](C)NC[C@@H](c2ccccc2Cl)N2CCOCC2)c1 ZINC000480262498 895670477 /nfs/dbraw/zinc/67/04/77/895670477.db2.gz KNLZUJPVWUMMCV-KKSFZXQISA-N 0 3 404.938 4.081 20 0 HIADHN CC[C@@H](NCc1ccc(N(C)CCOC)nc1)c1cc(F)cc(Br)c1 ZINC000480267711 895676152 /nfs/dbraw/zinc/67/61/52/895676152.db2.gz RCHPHBYIACXMDU-GOSISDBHSA-N 0 3 410.331 4.307 20 0 HIADHN Brc1cc(CNCc2ccc(OCC3CC3)cc2)cc2c1OCCO2 ZINC000480353644 895760754 /nfs/dbraw/zinc/76/07/54/895760754.db2.gz CRTFZMJJQKQNNJ-UHFFFAOYSA-N 0 3 404.304 4.299 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@H](C)NCc2nccn2-c2ccccc2)CC1 ZINC000480385718 895792130 /nfs/dbraw/zinc/79/21/30/895792130.db2.gz RETTXKYAEOGSAS-IBGZPJMESA-N 0 3 407.537 4.004 20 0 HIADHN COc1cc([C@H](C)N[C@H](CN2CCOCC2)c2ccc(C)cc2)ccc1SC ZINC000480413314 895812708 /nfs/dbraw/zinc/81/27/08/895812708.db2.gz FTLIEUYQFWIPSK-GHTZIAJQSA-N 0 3 400.588 4.450 20 0 HIADHN OC[C@H](Cc1ccc(F)cc1)NCc1cc(Cl)ccc1OCc1cccnc1 ZINC000480482296 895859214 /nfs/dbraw/zinc/85/92/14/895859214.db2.gz KZPHKGCJZHTQIS-NRFANRHFSA-N 0 3 400.881 4.146 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)c3cnc(Nc4ccc(Cl)cc4)c(Cl)c3)[C@H]2C1 ZINC000480577593 895937149 /nfs/dbraw/zinc/93/71/49/895937149.db2.gz IPGAWLUZZDPEFG-UGSOOPFHSA-N 0 3 405.329 4.298 20 0 HIADHN CC(C)CCOc1ccc([C@@H](C)NCc2ccc(C(=O)N3CCN(C)CC3)cc2)cc1 ZINC000480605681 895971616 /nfs/dbraw/zinc/97/16/16/895971616.db2.gz FWNDDDCXUHRUPU-OAQYLSRUSA-N 0 3 423.601 4.350 20 0 HIADHN CCc1ccc(CN[C@H](C)c2ccc(S(=O)(=O)NCc3ccco3)cc2)s1 ZINC000480614386 895980866 /nfs/dbraw/zinc/98/08/66/895980866.db2.gz SPCLKOZUCWHHCD-OAHLLOKOSA-N 0 3 404.557 4.233 20 0 HIADHN CCOc1ccc([C@@H](CC)NCc2ccc(N3CCO[C@@H](C)C3)nc2)cc1OCC ZINC000480627713 895995441 /nfs/dbraw/zinc/99/54/41/895995441.db2.gz UQCHKQQWBJWEKS-GHTZIAJQSA-N 0 3 413.562 4.345 20 0 HIADHN C[C@@H]1C[C@H](N(C)S(=O)(=O)Cc2ccc(Cl)c(F)c2)CCN1Cc1ccccc1 ZINC000480639125 896009361 /nfs/dbraw/zinc/00/93/61/896009361.db2.gz KZGXFGGJSPKLEH-VQIMIIECSA-N 0 3 424.969 4.294 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)N1Cc2ccccc2C2(CC2)C1 ZINC000480650228 896018742 /nfs/dbraw/zinc/01/87/42/896018742.db2.gz TVSXHYKNZQJQST-UHFFFAOYSA-N 0 3 407.583 4.357 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)N1CCC[C@@H]1c1ccc2c(c1)OCO2 ZINC000480652832 896021482 /nfs/dbraw/zinc/02/14/82/896021482.db2.gz XPPOEBRGFIWQQS-NHCUHLMSSA-N 0 3 407.514 4.099 20 0 HIADHN CCN(C)c1ccc(CN[C@H](C)c2ccc(OCc3ccncc3)c(OC)c2)cn1 ZINC000480657083 896026722 /nfs/dbraw/zinc/02/67/22/896026722.db2.gz CLGCHNIBECBCFX-GOSISDBHSA-N 0 3 406.530 4.371 20 0 HIADHN C[C@@H](c1ccccc1)N1CCC(NS(=O)(=O)Cc2ccc(Cl)c(F)c2)CC1 ZINC000480660111 896028066 /nfs/dbraw/zinc/02/80/66/896028066.db2.gz OGBHQMJAOXQFQQ-HNNXBMFYSA-N 0 3 410.942 4.124 20 0 HIADHN COC1(CN[C@@H](c2ccc(C)cc2)c2cccc(S(C)(=O)=O)c2)CCCCC1 ZINC000480695049 896058001 /nfs/dbraw/zinc/05/80/01/896058001.db2.gz IWWBBSRJJWLKOP-QFIPXVFZSA-N 0 3 401.572 4.427 20 0 HIADHN CN(CCCc1cc(-c2ccccc2)no1)C(=O)[C@@H]1CCCN1Cc1ccccc1 ZINC000505369697 914032044 /nfs/dbraw/zinc/03/20/44/914032044.db2.gz CCDWFNXBDVOLEU-DEOSSOPVSA-N 0 3 403.526 4.397 20 0 HIADHN O=S1(=O)CCCN1c1ccc(CN[C@H]2CCCc3c(Cl)cccc32)cc1F ZINC000480721988 896083721 /nfs/dbraw/zinc/08/37/21/896083721.db2.gz WRRHGLLQHPNQTC-IBGZPJMESA-N 0 3 408.926 4.186 20 0 HIADHN CC[C@H](NCc1ccc(N2CCN(CC)CC2)nc1)c1ccccc1Br ZINC000480735426 896094995 /nfs/dbraw/zinc/09/49/95/896094995.db2.gz FPCDGBULXCPVPZ-FQEVSTJZSA-N 0 3 417.395 4.227 20 0 HIADHN CN1CCN(c2cc(CN[C@@H]3CCCSc4ccc(Cl)cc43)ccn2)CC1 ZINC000480740011 896100923 /nfs/dbraw/zinc/10/09/23/896100923.db2.gz VAWWDPFLIKHKBY-LJQANCHMSA-N 0 3 402.995 4.204 20 0 HIADHN C[C@@H](NCCCCN1C(=O)NC2(CCCC2)C1=O)c1cc(F)c(Cl)cc1Cl ZINC000480745863 896107068 /nfs/dbraw/zinc/10/70/68/896107068.db2.gz PFAUHAUFSSWMRZ-GFCCVEGCSA-N 0 3 416.324 4.428 20 0 HIADHN CNS(=O)(=O)c1ccc([C@@H](C)NCc2ccc(OCc3cccc(C)c3)cc2)cc1 ZINC000480764590 896127114 /nfs/dbraw/zinc/12/71/14/896127114.db2.gz XOVIYYTYFRREKE-LJQANCHMSA-N 0 3 424.566 4.333 20 0 HIADHN CCCNC(=O)CN1CCC(N[C@@H]2CCCc3c(Cl)sc(Cl)c32)CC1 ZINC000480768959 896131480 /nfs/dbraw/zinc/13/14/80/896131480.db2.gz HCBAQSIRCAVWIW-CQSZACIVSA-N 0 3 404.407 4.013 20 0 HIADHN CC[C@@H](NCc1cccc(NC(=O)CCN2CCOCC2)c1)c1ccc(Cl)s1 ZINC000480877238 896236641 /nfs/dbraw/zinc/23/66/41/896236641.db2.gz KVFCWHNQAPMCGM-GOSISDBHSA-N 0 3 421.994 4.303 20 0 HIADHN COc1cc(CN[C@H]2C[C@@H](C)c3c2cccc3Br)ccc1OCCO ZINC000480887192 896244384 /nfs/dbraw/zinc/24/43/84/896244384.db2.gz DGGJLEJFUOLXNT-DYVFJYSZSA-N 0 3 406.320 4.167 20 0 HIADHN CCS[C@H]1CCCCN(CC(=O)NCc2cccc(COCc3ccco3)c2)C1 ZINC000480895285 896252320 /nfs/dbraw/zinc/25/23/20/896252320.db2.gz SZOARRDRNDQYHL-QFIPXVFZSA-N 0 3 416.587 4.220 20 0 HIADHN Cc1ccc(CN2CC[C@@H](NCc3ccc(Br)c4cccnc34)C2=O)cc1 ZINC000480911777 896267323 /nfs/dbraw/zinc/26/73/23/896267323.db2.gz RAMSDFRCXWDXLP-HXUWFJFHSA-N 0 3 424.342 4.196 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)N1CCc2cc(Br)ccc2C1 ZINC000480966270 896306487 /nfs/dbraw/zinc/30/64/87/896306487.db2.gz YNYUMJQDRCXKBG-UHFFFAOYSA-N 0 3 413.315 4.455 20 0 HIADHN COC(=O)c1cc(NC(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)cc(Cl)c1F ZINC000480971394 896309868 /nfs/dbraw/zinc/30/98/68/896309868.db2.gz NNPULICFYOHAKT-XIKOKIGWSA-N 0 3 407.873 4.079 20 0 HIADHN CNS(=O)(=O)c1cccc([C@@H](C)NCCSCc2cccc3ccccc32)c1 ZINC000481032502 896359671 /nfs/dbraw/zinc/35/96/71/896359671.db2.gz FBSRNJQWGGQPNE-QGZVFWFLSA-N 0 3 414.596 4.332 20 0 HIADHN CCOc1ccc([C@H](C)NC(=O)N[C@H]2CCN(Cc3ccccc3)[C@@H]2C)cc1OC ZINC000481117490 896442959 /nfs/dbraw/zinc/44/29/59/896442959.db2.gz XVJKGNMYGXABGX-UEXGIBASSA-N 0 3 411.546 4.117 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)NCc1cc(Br)cs1)c1ccco1 ZINC000481123318 896449826 /nfs/dbraw/zinc/44/98/26/896449826.db2.gz XFQFVEGEQVRMAA-RISCZKNCSA-N 0 3 400.342 4.032 20 0 HIADHN C[C@H](Cc1ccc(F)c(Br)c1)NC(=O)Nc1cccc(CN(C)C)c1 ZINC000481153641 896484927 /nfs/dbraw/zinc/48/49/27/896484927.db2.gz JOQWIFPDNMDLAS-CYBMUJFWSA-N 0 3 408.315 4.403 20 0 HIADHN Cc1c([C@@H](C)NCC2(c3ccc(F)cc3)CCOCC2)nnn1-c1ccc(F)cc1 ZINC000481167523 896500922 /nfs/dbraw/zinc/50/09/22/896500922.db2.gz CTLRFTKEHDEZMY-MRXNPFEDSA-N 0 3 412.484 4.253 20 0 HIADHN COc1cc([C@H](C)N[C@H]2CCc3cc(Br)ccc32)ccc1OCCO ZINC000481173803 896509608 /nfs/dbraw/zinc/50/96/08/896509608.db2.gz GXUQWHPWGHAGFT-UGSOOPFHSA-N 0 3 406.320 4.167 20 0 HIADHN Fc1cc(Br)cc2c1CC[C@@H]2NCc1ccccc1N1CCOCC1 ZINC000481190713 896542123 /nfs/dbraw/zinc/54/21/23/896542123.db2.gz LRIXAFCDEUJRDN-IBGZPJMESA-N 0 3 405.311 4.202 20 0 HIADHN O=C(CN[C@H](CC1CCC1)c1ccccc1)N1CCC(C(=O)Nc2ccccc2)CC1 ZINC000481210763 896565035 /nfs/dbraw/zinc/56/50/35/896565035.db2.gz MSIUIVDOGAAUMT-XMMPIXPASA-N 0 3 419.569 4.385 20 0 HIADHN C[C@H](N[C@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O)c1ccc(-n2cncn2)cc1 ZINC000481235030 896585420 /nfs/dbraw/zinc/58/54/20/896585420.db2.gz JNLYMSRNAFAABZ-DJJJIMSYSA-N 0 3 416.312 4.030 20 0 HIADHN Cc1nc(-c2ccccc2)sc1[C@H](C)NCc1cccnc1N1CCN(C)CC1 ZINC000481246875 896599044 /nfs/dbraw/zinc/59/90/44/896599044.db2.gz PCQCMZWBDKWZNH-KRWDZBQOSA-N 0 3 407.587 4.116 20 0 HIADHN C[C@@H](N[C@@H]1CC2(CCC2)Oc2ccccc21)c1ccc(OCC(=O)NC2CC2)cc1 ZINC000481309959 896656923 /nfs/dbraw/zinc/65/69/23/896656923.db2.gz SLRGIDZHSUEHOK-VGOFRKELSA-N 0 3 406.526 4.441 20 0 HIADHN CCc1nc2c(s1)[C@H](N[C@@H](CC)c1ccccc1OCC(=O)N(C)C)CCC2 ZINC000481317709 896670112 /nfs/dbraw/zinc/67/01/12/896670112.db2.gz UNZPDOPZGOIHON-DLBZAZTESA-N 0 3 401.576 4.291 20 0 HIADHN CC[C@@H](N[C@@H](C)c1ccc2c(c1)OCCO2)c1ccccc1OCC(=O)N1CCCC1 ZINC000481319977 896673308 /nfs/dbraw/zinc/67/33/08/896673308.db2.gz USZAFMYMQZKVRL-GHTZIAJQSA-N 0 3 424.541 4.261 20 0 HIADHN CC[C@H](N[C@H](C)c1ccc2c(c1)OCO2)c1ccccc1OCC(=O)N1CCCC1 ZINC000481327593 896686459 /nfs/dbraw/zinc/68/64/59/896686459.db2.gz JWCHEFYJBYTBLA-XLIONFOSSA-N 0 3 410.514 4.218 20 0 HIADHN COc1ccc([C@@H](NC(=O)N[C@@H](CN(C)C)c2ccc(F)cc2)C(F)(F)F)cc1 ZINC000481331105 896691464 /nfs/dbraw/zinc/69/14/64/896691464.db2.gz OJQYIXBZOBZFIC-ZWKOTPCHSA-N 0 3 413.415 4.040 20 0 HIADHN CC[C@H](c1ccccc1OC)N(C)C(=O)Nc1cccc(N2CCN(CC)CC2)c1 ZINC000481387369 896787728 /nfs/dbraw/zinc/78/77/28/896787728.db2.gz BLDVPXPOPMRNGE-JOCHJYFZSA-N 0 3 410.562 4.452 20 0 HIADHN Cc1nc(Cc2ccccc2)sc1[C@H](C)NC[C@H](O)COc1ccc(F)cc1 ZINC000481534766 896895630 /nfs/dbraw/zinc/89/56/30/896895630.db2.gz NQNARMIXRFGVTD-KXBFYZLASA-N 0 3 400.519 4.272 20 0 HIADHN COc1ccc2ccccc2c1-c1cc(CN2CCC([C@@H](C)NC(C)=O)CC2)on1 ZINC000481577463 896957790 /nfs/dbraw/zinc/95/77/90/896957790.db2.gz AZHBFQXNXAFDCN-MRXNPFEDSA-N 0 3 407.514 4.240 20 0 HIADHN Cc1cc(NC(=O)c2cc(COC(C)(C)C)on2)cc(N2CCN(C(C)C)CC2)c1 ZINC000481634147 897019739 /nfs/dbraw/zinc/01/97/39/897019739.db2.gz PUSYGLGAFJWXBX-UHFFFAOYSA-N 0 3 414.550 4.081 20 0 HIADHN Cc1cc(NC(=O)C[C@@H]2CCO[C@H](C(C)C)C2)cc(N2CCN(C(C)C)CC2)c1 ZINC000481663126 897046849 /nfs/dbraw/zinc/04/68/49/897046849.db2.gz NUCJVTFIFJFEOO-OFNKIYASSA-N 0 3 401.595 4.305 20 0 HIADHN CCOc1ccc(C(=O)Nc2cc(C)cc(N3CCN(C(C)C)CC3)c2)cc1OC ZINC000481666793 897050339 /nfs/dbraw/zinc/05/03/39/897050339.db2.gz RWVOAHBLXWIUGF-UHFFFAOYSA-N 0 3 411.546 4.185 20 0 HIADHN CCOCCOc1ccc(Cl)cc1NC(=O)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000481690872 897075753 /nfs/dbraw/zinc/07/57/53/897075753.db2.gz ZOPMLBOREHMBBK-IBGZPJMESA-N 0 3 417.937 4.151 20 0 HIADHN CNS(=O)(=O)c1ccc([C@H](C)NCc2ccc(-c3ccc4c(c3)CCO4)cc2)cc1 ZINC000481716341 897107972 /nfs/dbraw/zinc/10/79/72/897107972.db2.gz KKISIPPGFMTOML-KRWDZBQOSA-N 0 3 422.550 4.047 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1ccc2c(c1)CCC(=O)N2CC1CC1)c1ccco1 ZINC000481717000 897110573 /nfs/dbraw/zinc/11/05/73/897110573.db2.gz UWPOTKSSSUTFMO-OXJNMPFZSA-N 0 3 424.545 4.220 20 0 HIADHN CC(C)C[C@@H]1OCCC[C@H]1NCC(=O)Nc1cccc(CSc2ccccn2)c1 ZINC000481769988 897155516 /nfs/dbraw/zinc/15/55/16/897155516.db2.gz VYBKGBJAIUFOJB-RTWAWAEBSA-N 0 3 413.587 4.496 20 0 HIADHN C[C@H](NCc1ccc(S(=O)(=O)N2CCCC2)o1)C1(c2ccccc2)CCCC1 ZINC000481825879 897197207 /nfs/dbraw/zinc/19/72/07/897197207.db2.gz SVMZIZVTTHRVRR-SFHVURJKSA-N 0 3 402.560 4.054 20 0 HIADHN COc1cc2nc(CN[C@H](C)C3(c4ccccc4)CCCC3)[nH]c(=O)c2cc1OC ZINC000481841491 897206910 /nfs/dbraw/zinc/20/69/10/897206910.db2.gz WXEUHUPZKAJRDY-MRXNPFEDSA-N 0 3 407.514 4.343 20 0 HIADHN CC1(C)CC[C@H](NC[C@@H]2CCCCS2(=O)=O)c2cc(Br)ccc21 ZINC000481991046 897386921 /nfs/dbraw/zinc/38/69/21/897386921.db2.gz GYGMOBGLXZEFGT-YOEHRIQHSA-N 0 3 400.382 4.119 20 0 HIADHN CC[C@@H](N[C@H](CC(F)(F)F)C(C)C)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000481992468 897388492 /nfs/dbraw/zinc/38/84/92/897388492.db2.gz OJPCHYDLFANPSW-ZIAGYGMSSA-N 0 3 400.894 4.266 20 0 HIADHN COc1c(Br)cccc1CN(C)C1CCN(C(=O)c2ccccc2)CC1 ZINC000482009042 897407244 /nfs/dbraw/zinc/40/72/44/897407244.db2.gz TXTHBMTYBPDCFO-UHFFFAOYSA-N 0 3 417.347 4.194 20 0 HIADHN COc1ccc2cc([C@H](C)NCc3ccccc3N3CCN(C(C)=O)CC3)ccc2c1 ZINC000482033054 897445297 /nfs/dbraw/zinc/44/52/97/897445297.db2.gz NGBNFKCPVINMFT-IBGZPJMESA-N 0 3 417.553 4.368 20 0 HIADHN Cc1noc2nc(-c3ccc(F)cc3)cc(C(=O)N3CCN(C4CCCCC4)CC3)c12 ZINC000482051224 897476523 /nfs/dbraw/zinc/47/65/23/897476523.db2.gz AYZNSZSHBGBJJD-UHFFFAOYSA-N 0 3 422.504 4.428 20 0 HIADHN Cc1cc(NC(=O)c2cc(=O)[nH]c3ccc(F)cc32)cc(N2CCN(C(C)C)CC2)c1 ZINC000482050613 897476716 /nfs/dbraw/zinc/47/67/16/897476716.db2.gz CYRSVODUJODMDD-UHFFFAOYSA-N 0 3 422.504 4.171 20 0 HIADHN C[C@H](N[C@H](Cc1ccccc1)C(=O)N1CCCC1)c1ccc(OC(F)(F)F)cc1 ZINC000482108281 897557380 /nfs/dbraw/zinc/55/73/80/897557380.db2.gz HNOXEKPOISLURN-OXJNMPFZSA-N 0 3 406.448 4.470 20 0 HIADHN C[C@H](NCc1ccc(OCC2CC2)nc1)c1ccc(I)cc1 ZINC000482135093 897593400 /nfs/dbraw/zinc/59/34/00/897593400.db2.gz MMMAUWWNHGKLDK-ZDUSSCGKSA-N 0 3 408.283 4.326 20 0 HIADHN CCO[C@@H]1C[C@@H](N[C@@H](C)C(=O)Nc2c(C)nn(-c3ccccc3)c2C)C1(CC)CC ZINC000482142248 897602113 /nfs/dbraw/zinc/60/21/13/897602113.db2.gz WFFBNFDQLFRDNQ-IOMROCGXSA-N 0 3 412.578 4.390 20 0 HIADHN COc1ccc(-c2ccncc2)cc1CN1CCC2(C[C@@H]2C(=O)N2CCCCC2)CC1 ZINC000482142556 897602548 /nfs/dbraw/zinc/60/25/48/897602548.db2.gz XAXDDJWLKKUJOX-HSZRJFAPSA-N 0 3 419.569 4.372 20 0 HIADHN Cn1c(CN[C@@H](CN2CCc3ccccc3C2)C(C)(C)C)nnc1-c1ccccc1 ZINC000482164177 897627801 /nfs/dbraw/zinc/62/78/01/897627801.db2.gz NOECGPANGZTKMB-QFIPXVFZSA-N 0 3 403.574 4.045 20 0 HIADHN Cc1ccc(-c2nnc([C@H](C)NCC3(N4CCSCC4)CCCCC3)o2)cc1 ZINC000482172916 897640317 /nfs/dbraw/zinc/64/03/17/897640317.db2.gz ZSVPRYFXSNPOKV-SFHVURJKSA-N 0 3 400.592 4.447 20 0 HIADHN C[C@H]1Cc2ccccc2N1Cc1ccoc1C(=O)NC[C@H](c1ccccc1)N(C)C ZINC000482189892 897661291 /nfs/dbraw/zinc/66/12/91/897661291.db2.gz ADYLLHZYPMHXGM-FDDCHVKYSA-N 0 3 403.526 4.264 20 0 HIADHN COC(=O)c1ccc(COc2ccc(CN[C@H]3CCc4c3cccc4O)cc2OC)o1 ZINC000482201525 897678347 /nfs/dbraw/zinc/67/83/47/897678347.db2.gz XYDISXPCIQCDIE-IBGZPJMESA-N 0 3 423.465 4.137 20 0 HIADHN COC(=O)c1ccc(COc2ccc(CNCc3ccc(C)s3)cc2OC)o1 ZINC000482203203 897680112 /nfs/dbraw/zinc/68/01/12/897680112.db2.gz FHFDTXJTSGOKCI-UHFFFAOYSA-N 0 3 401.484 4.314 20 0 HIADHN COC(=O)c1ccccc1-c1ccc(CN[C@H](Cc2ccccc2)[C@H](O)C(F)F)o1 ZINC000482210675 897689835 /nfs/dbraw/zinc/68/98/35/897689835.db2.gz IXVFXLVUNXIVEN-CTNGQTDRSA-N 0 3 415.436 4.060 20 0 HIADHN CCC[C@@H](N[C@H](C)c1ccc(-n2cccn2)cc1)C(=O)N1CCc2sccc2C1 ZINC000482251612 897733554 /nfs/dbraw/zinc/73/35/54/897733554.db2.gz ZCAMSGZNUWVWHA-DYESRHJHSA-N 0 3 408.571 4.338 20 0 HIADHN OC1(Cc2ccc(F)cc2)CCN(Cc2cccc(OCc3ccccn3)c2)CC1 ZINC000482304636 897801886 /nfs/dbraw/zinc/80/18/86/897801886.db2.gz GNBPRPAHUIQQJF-UHFFFAOYSA-N 0 3 406.501 4.369 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)CCc2nc(C)c(-c3ccccc3)o2)c1 ZINC000482341960 897849442 /nfs/dbraw/zinc/84/94/42/897849442.db2.gz GGBVDZWJIPTETK-UHFFFAOYSA-N 0 3 421.541 4.182 20 0 HIADHN COc1ccc([C@H](NC(=O)N[C@@H](CN2CCCC2)c2ccccc2)C(F)(F)F)cc1 ZINC000482364308 897882503 /nfs/dbraw/zinc/88/25/03/897882503.db2.gz VICOTQWJTWBQDH-PMACEKPBSA-N 0 3 421.463 4.435 20 0 HIADHN Cc1c(C(=O)N(Cc2ccco2)C2CCN(C)CC2)cnn1-c1ccccc1Cl ZINC000482423414 897975532 /nfs/dbraw/zinc/97/55/32/897975532.db2.gz OAXQCKZCKQZIQD-UHFFFAOYSA-N 0 3 412.921 4.164 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1cc(C(=O)OC)ccc1C(C)C)c1ccco1 ZINC000482425849 897979318 /nfs/dbraw/zinc/97/93/18/897979318.db2.gz YBLYYSNRMWZAFI-KXBFYZLASA-N 0 3 401.507 4.441 20 0 HIADHN C[C@@H](C1CC1)n1nccc1NC(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1 ZINC000482451053 898017873 /nfs/dbraw/zinc/01/78/73/898017873.db2.gz KHFAMFDKCJXIEQ-HNNXBMFYSA-N 0 3 423.483 4.469 20 0 HIADHN CC(C)C[C@H](NCc1cccnc1N1CCC(C(N)=O)CC1)c1ccc(Cl)cc1 ZINC000482456416 898027360 /nfs/dbraw/zinc/02/73/60/898027360.db2.gz SGNCIKDXIDCFBH-NRFANRHFSA-N 0 3 414.981 4.314 20 0 HIADHN CC(=O)Nc1ccc(CCN[C@H](C)c2ccccc2I)cc1 ZINC000482461433 898034591 /nfs/dbraw/zinc/03/45/91/898034591.db2.gz RVUIFAAFBDZXHU-CYBMUJFWSA-N 0 3 408.283 4.143 20 0 HIADHN CCN(Cc1cnc(-c2cnn(C)c2)nc1)[C@@H](C)Cc1ccccc1C(F)(F)F ZINC000482463373 898038046 /nfs/dbraw/zinc/03/80/46/898038046.db2.gz ZAKKSKHSSPZOGU-HNNXBMFYSA-N 0 3 403.452 4.349 20 0 HIADHN CN(C)C[C@H](NC(=O)Nc1cc(Br)c(F)cc1F)c1ccc(F)cc1 ZINC000482473137 898049004 /nfs/dbraw/zinc/04/90/04/898049004.db2.gz GCLLVDMJCNOYRQ-INIZCTEOSA-N 0 3 416.241 4.291 20 0 HIADHN CCO[C@@H]1C[C@@H](NCc2ccccc2OCc2ccccn2)[C@@H]1Oc1ccccc1 ZINC000482494817 898073236 /nfs/dbraw/zinc/07/32/36/898073236.db2.gz GJPTVPYMWJUZJZ-GPXOXTDOSA-N 0 3 404.510 4.375 20 0 HIADHN Cc1nn(Cc2ccc(C)cc2)c(C)c1CN1CCC(c2nnc3n2CCCC3)CC1 ZINC000482498827 898079479 /nfs/dbraw/zinc/07/94/79/898079479.db2.gz LRRBFFWDLPIBOP-UHFFFAOYSA-N 0 3 418.589 4.164 20 0 HIADHN CC(=O)N[C@H](C)C1CCN(Cc2cn(Cc3ccccc3)nc2-c2cccs2)CC1 ZINC000482505973 898087867 /nfs/dbraw/zinc/08/78/67/898087867.db2.gz OREGSKZXMBKMLT-GOSISDBHSA-N 0 3 422.598 4.397 20 0 HIADHN CC(=O)N[C@H](C)C1CCN(Cc2cn(-c3ccccc3)nc2-c2ccc(C)o2)CC1 ZINC000482509772 898093012 /nfs/dbraw/zinc/09/30/12/898093012.db2.gz KWTQYDVMCLDSKB-GOSISDBHSA-N 0 3 406.530 4.177 20 0 HIADHN COc1cc(CN2CCC([C@@H](C)NC(C)=O)CC2)ccc1OCc1cccs1 ZINC000482531045 898117889 /nfs/dbraw/zinc/11/78/89/898117889.db2.gz PWBBHFMOZJGSTC-MRXNPFEDSA-N 0 3 402.560 4.072 20 0 HIADHN Cc1nc(Cc2ccccc2)sc1[C@H](C)NC[C@H](O)COc1ccc(F)c(F)c1 ZINC000482538196 898125461 /nfs/dbraw/zinc/12/54/61/898125461.db2.gz PTGOEWBICRDOND-YOEHRIQHSA-N 0 3 418.509 4.411 20 0 HIADHN C[C@@H](N[C@@H](C)c1cc(F)ccc1N1CCN(C)CC1)c1ccc(-n2cccn2)cc1 ZINC000482542726 898131688 /nfs/dbraw/zinc/13/16/88/898131688.db2.gz YQQFFRUBAAGWQU-MOPGFXCFSA-N 0 3 407.537 4.175 20 0 HIADHN COc1ccc([C@H](C)N[C@H](C)c2cc(F)ccc2N2CCN(C)CC2)c(OC)c1 ZINC000482551203 898142135 /nfs/dbraw/zinc/14/21/35/898142135.db2.gz QOSCVKHTIMUYMC-DLBZAZTESA-N 0 3 401.526 4.007 20 0 HIADHN COc1cc(F)c([C@@H](C)N[C@@H](C)c2cc(F)ccc2N2CCN(C)CC2)cc1OC ZINC000482558430 898150504 /nfs/dbraw/zinc/15/05/04/898150504.db2.gz SVXAZGXSORINRS-CVEARBPZSA-N 0 3 419.516 4.146 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@H](C)N[C@@H](C)c2ccc(OC)cc2OC)CC1 ZINC000482570414 898165711 /nfs/dbraw/zinc/16/57/11/898165711.db2.gz WNNIAMORQMADQT-ROUUACIJSA-N 0 3 415.553 4.397 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)c1cnn(-c2ncccc2Cl)c1C(F)F ZINC000482593004 898193002 /nfs/dbraw/zinc/19/30/02/898193002.db2.gz MUILAKCNLJMCET-UHFFFAOYSA-N 0 3 419.863 4.481 20 0 HIADHN Cc1ccc(CNC(=O)N[C@@H](CC(C)C)C(=O)Nc2cc(CN(C)C)ccc2C)cc1 ZINC000482597165 898198373 /nfs/dbraw/zinc/19/83/73/898198373.db2.gz LQCHSHYIDMMZKD-QHCPKHFHSA-N 0 3 424.589 4.218 20 0 HIADHN COc1ccc2oc(CNCCC(=O)Nc3ccc(Br)cc3)cc2c1 ZINC000482600137 898201419 /nfs/dbraw/zinc/20/14/19/898201419.db2.gz BUMKFVDVLHYVKZ-UHFFFAOYSA-N 0 3 403.276 4.322 20 0 HIADHN Cc1sc2ncnc(SCC(=O)Nc3cc(CN(C)C)ccc3C)c2c1C ZINC000482614860 898217294 /nfs/dbraw/zinc/21/72/94/898217294.db2.gz HFHUKUFGEAVROZ-UHFFFAOYSA-N 0 3 400.573 4.409 20 0 HIADHN Cc1cccc(NC(=O)N2CCC[C@@H](C(=O)Nc3cc(CN(C)C)ccc3C)C2)c1 ZINC000482619282 898220915 /nfs/dbraw/zinc/22/09/15/898220915.db2.gz UUONCSPFTPILRX-HXUWFJFHSA-N 0 3 408.546 4.248 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)N1CCC[C@]2(C1)OCc1ccccc12 ZINC000482619384 898221324 /nfs/dbraw/zinc/22/13/24/898221324.db2.gz KRZXHXLLALINFL-NZQKXSOJSA-N 0 3 411.571 4.116 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N1CCC[C@]2(C1)OCc1ccccc12 ZINC000482619383 898221560 /nfs/dbraw/zinc/22/15/60/898221560.db2.gz KRZXHXLLALINFL-NFBKMPQASA-N 0 3 411.571 4.116 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)[C@@H](C)Oc1ccc(F)cc1Br ZINC000482620352 898223155 /nfs/dbraw/zinc/22/31/55/898223155.db2.gz SVGFBZFYLDHSQL-CYBMUJFWSA-N 0 3 409.299 4.364 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C[C@@H]1Sc2ccc(Cl)cc2NC1=O ZINC000482634741 898238805 /nfs/dbraw/zinc/23/88/05/898238805.db2.gz ZZHWOZYQHFHKAH-SFHVURJKSA-N 0 3 403.935 4.152 20 0 HIADHN CN1C(=O)C[C@@H](NCc2ccc(OCc3ccccn3)cc2)[C@H]1c1ccc(F)c(F)c1 ZINC000482688311 898287934 /nfs/dbraw/zinc/28/79/34/898287934.db2.gz CPWKYSHBKVJWOY-ISKFKSNPSA-N 0 3 423.463 4.000 20 0 HIADHN CN1C(=O)C[C@H](NCc2ccc(OCc3ccncc3)cc2)[C@@H]1c1ccc(F)c(F)c1 ZINC000482727553 898328533 /nfs/dbraw/zinc/32/85/33/898328533.db2.gz XJURCXNLTOXCLF-UPVQGACJSA-N 0 3 423.463 4.000 20 0 HIADHN CCCN(C(=O)NCCCN1CCc2ccccc2C1)[C@H]1CCCc2cccnc21 ZINC000482769506 898377756 /nfs/dbraw/zinc/37/77/56/898377756.db2.gz RHVRSGBJYZEWLI-QHCPKHFHSA-N 0 3 406.574 4.329 20 0 HIADHN COc1ccccc1CCC[NH+]1CCC(C(=O)Nc2cc(Cl)ccc2[O-])CC1 ZINC000505555029 914258242 /nfs/dbraw/zinc/25/82/42/914258242.db2.gz GYQNBSIRCRJXJC-UHFFFAOYSA-N 0 3 402.922 4.338 20 0 HIADHN COc1cccc([C@H](C)NCc2ccccc2CN2C(=O)NC3(CCCCC3)C2=O)c1 ZINC000482964057 898593784 /nfs/dbraw/zinc/59/37/84/898593784.db2.gz RKHLQSDMWKWXLS-SFHVURJKSA-N 0 3 421.541 4.301 20 0 HIADHN Cc1cc(C(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)nn1-c1cccc(F)c1 ZINC000482970451 898604179 /nfs/dbraw/zinc/60/41/79/898604179.db2.gz JSNIVWDJNMDQGE-UHFFFAOYSA-N 0 3 421.520 4.103 20 0 HIADHN CC1CCN(C(=O)c2ccc(NC(=O)N3CCN(C4CCCCC4)CC3)cc2)CC1 ZINC000483004458 898655159 /nfs/dbraw/zinc/65/51/59/898655159.db2.gz OBAPNERRXREWLH-UHFFFAOYSA-N 0 3 412.578 4.041 20 0 HIADHN CCCN(CCC)C(=O)c1ccc(NC(=O)N2CCN(C3CCCCC3)CC2)cc1 ZINC000483054255 898728031 /nfs/dbraw/zinc/72/80/31/898728031.db2.gz ZOLXVFUWRFXSRZ-UHFFFAOYSA-N 0 3 414.594 4.431 20 0 HIADHN Cc1n[nH]c(C)c1NC(=O)CN[C@](C)(CC(C)C)c1cccc(Br)c1 ZINC000483055317 898729586 /nfs/dbraw/zinc/72/95/86/898729586.db2.gz SCWBTTXFMPTHDY-LJQANCHMSA-N 0 3 407.356 4.279 20 0 HIADHN COc1c(Br)c(C)sc1C(=O)N[C@H](C)[C@H](c1ccccc1)N(C)C ZINC000505573823 914280156 /nfs/dbraw/zinc/28/01/56/914280156.db2.gz FDIORYQSMDAXDX-IAQYHMDHSA-N 0 3 411.365 4.249 20 0 HIADHN Cc1c([C@H](C)N[C@H](Cc2ccccc2)[C@H](O)C(F)F)cnn1-c1ccc(F)cc1 ZINC000483131618 898814372 /nfs/dbraw/zinc/81/43/72/898814372.db2.gz BRDPRAZCZJGFKW-DLPLYFIVSA-N 0 3 403.448 4.208 20 0 HIADHN CN(C)C[C@@H](NC(=O)Nc1ccc(OCC(F)(F)F)c(F)c1)c1ccc(F)cc1 ZINC000483138784 898818270 /nfs/dbraw/zinc/81/82/70/898818270.db2.gz ZJTQXJUWZRDPKD-MRXNPFEDSA-N 0 3 417.378 4.330 20 0 HIADHN COc1ccc(S(=O)(=O)Nc2cccc(CN[C@@H](C)c3cccc(F)c3)c2)cc1 ZINC000483146660 898825014 /nfs/dbraw/zinc/82/50/14/898825014.db2.gz YDKGERBPWUNCRJ-INIZCTEOSA-N 0 3 414.502 4.486 20 0 HIADHN CS[C@@H]1CN(C(=O)[C@H](C)c2cccc(C(=O)c3ccccc3)c2)C[C@@H]1N1CCCC1 ZINC000483398339 899032279 /nfs/dbraw/zinc/03/22/79/899032279.db2.gz XQHREEINDAUHLX-YFXJRYMSSA-N 0 3 422.594 4.059 20 0 HIADHN CO[C@@H](c1ccccc1Cl)[C@H](C)NC(=O)N(CCN(C)C)Cc1cccs1 ZINC000483415372 899044557 /nfs/dbraw/zinc/04/45/57/899044557.db2.gz WIQKHCHIGXOQGM-HNAYVOBHSA-N 0 3 409.983 4.251 20 0 HIADHN O=C1CCCN1[C@@H]1CCN(Cc2ccc(-c3cccc(Br)c3)s2)C1 ZINC000483435822 899067703 /nfs/dbraw/zinc/06/77/03/899067703.db2.gz RQRKMSDMWBBQRU-MRXNPFEDSA-N 0 3 405.361 4.374 20 0 HIADHN C[C@@H](NC(=O)c1c[nH]c2ccc(Br)cc12)[C@@H](c1ccccc1)N(C)C ZINC000505605903 914310943 /nfs/dbraw/zinc/31/09/43/914310943.db2.gz JATYTHPSMPJYBG-YJYMSZOUSA-N 0 3 400.320 4.352 20 0 HIADHN O=C1CCCN1[C@@H]1CCN(Cc2ccc(OCc3c(F)cccc3Cl)cc2)C1 ZINC000483449152 899085761 /nfs/dbraw/zinc/08/57/61/899085761.db2.gz YIOSXLODDNEGOO-QGZVFWFLSA-N 0 3 402.897 4.255 20 0 HIADHN Cc1ccc(NC(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)cc1C(=O)N(C)C(C)C ZINC000483450686 899087499 /nfs/dbraw/zinc/08/74/99/899087499.db2.gz WYHNPPGOPKZKLE-AVRDEDQJSA-N 0 3 410.562 4.288 20 0 HIADHN CCc1ccc([C@@H](N[C@@H](COC)CC(C)C)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000483453343 899089396 /nfs/dbraw/zinc/08/93/96/899089396.db2.gz GYRBLBCWWKWFBG-FYYLOGMGSA-N 0 3 403.588 4.393 20 0 HIADHN COCCOc1ccc(CN2CCC(c3noc(-c4ccccc4OC)n3)CC2)cc1 ZINC000483452804 899090329 /nfs/dbraw/zinc/09/03/29/899090329.db2.gz YWWLKJOMHHDZPC-UHFFFAOYSA-N 0 3 423.513 4.150 20 0 HIADHN CCCN(CCC)C(=O)c1cccc(C(=O)N(CCN(C)C)C2CCCCC2)c1 ZINC000483474018 899117832 /nfs/dbraw/zinc/11/78/32/899117832.db2.gz WXKMTPLVGVAUAU-UHFFFAOYSA-N 0 3 401.595 4.285 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)N[C@@H](c1ccc(F)cc1)C(F)(F)F)c1ccco1 ZINC000483501202 899159997 /nfs/dbraw/zinc/15/99/97/899159997.db2.gz IRTYYUAREQGWBX-VMGRFDJRSA-N 0 3 401.404 4.451 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)Nc1ccc(C)c(C(=O)N(C)C(C)C)c1)c1ccco1 ZINC000483571912 899226109 /nfs/dbraw/zinc/22/61/09/899226109.db2.gz DBPXZZSBTTYLAF-XLIONFOSSA-N 0 3 414.550 4.319 20 0 HIADHN CCOc1cc2c(cc1[C@@H]1C[C@@H]1C(=O)N[C@H](C)[C@H](c1ccccc1)N(C)C)O[C@@H](C)C2 ZINC000505629408 914329387 /nfs/dbraw/zinc/32/93/87/914329387.db2.gz IFMHSUONIRBVEC-QBAZUSKOSA-N 0 3 422.569 4.320 20 0 HIADHN Cc1ccccc1COc1ccc([C@@H](C)NCc2cccc(OCC(N)=O)c2)cc1 ZINC000483630990 899283690 /nfs/dbraw/zinc/28/36/90/899283690.db2.gz AAGJBKLCIRELGB-LJQANCHMSA-N 0 3 404.510 4.289 20 0 HIADHN C[C@@H](NC(=O)Cc1ccc(NC(=O)CC(C)(C)C)cc1)[C@H](c1ccccc1)N(C)C ZINC000505634837 914334098 /nfs/dbraw/zinc/33/40/98/914334098.db2.gz RGECJWNBWNAJEA-HOYKHHGWSA-N 0 3 409.574 4.411 20 0 HIADHN CCOC(=O)C1CCC(N[C@@H](C)c2nc(-c3ccc(Br)cc3)no2)CC1 ZINC000483657048 899316877 /nfs/dbraw/zinc/31/68/77/899316877.db2.gz SJTYYMKONXAKIL-YGONEPDPSA-N 0 3 422.323 4.272 20 0 HIADHN CNC(=O)[C@H](Cc1c[nH]c2ccccc12)N[C@H]1CCc2c1ccc(Cl)c2Cl ZINC000483710073 899366106 /nfs/dbraw/zinc/36/61/06/899366106.db2.gz HDPIECOBTRDYJG-OALUTQOASA-N 0 3 402.325 4.409 20 0 HIADHN COc1ccc([C@@H](CNC(=O)NC2(c3ccc(Cl)cc3)CC2)N2CCCC2)cc1 ZINC000483729821 899390431 /nfs/dbraw/zinc/39/04/31/899390431.db2.gz HOQVZVKFHZRXDT-OAQYLSRUSA-N 0 3 413.949 4.474 20 0 HIADHN C[C@H](N[C@@H]1CCCN(c2ccccc2Cl)C1=O)c1cccc(N2CCOCC2)c1 ZINC000483735072 899396247 /nfs/dbraw/zinc/39/62/47/899396247.db2.gz XGRSFCJHIPTJSO-LAUBAEHRSA-N 0 3 413.949 4.023 20 0 HIADHN CC(C)n1cc([C@H](C)NCc2cc(C(F)(F)F)ccc2N2CCN(C)CC2)cn1 ZINC000483747888 899411214 /nfs/dbraw/zinc/41/12/14/899411214.db2.gz VXKHRUHKQWTEDA-INIZCTEOSA-N 0 3 409.500 4.085 20 0 HIADHN COc1ccc(C(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)cc1Cl ZINC000483802086 899477235 /nfs/dbraw/zinc/47/72/35/899477235.db2.gz OKTHLGNWVWFUQJ-GOSISDBHSA-N 0 3 410.905 4.244 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2cc(-c3ccccc3)ns2)c1 ZINC000483809381 899485364 /nfs/dbraw/zinc/48/53/64/899485364.db2.gz VOKGCUIEQYFXLH-UHFFFAOYSA-N 0 3 410.543 4.414 20 0 HIADHN Cc1ccc(C(=O)N2CCN(C3CCCCC3)CC2)cc1NC(=O)c1ccccc1F ZINC000483839154 899518753 /nfs/dbraw/zinc/51/87/53/899518753.db2.gz JGWLAHCQVYGBPQ-UHFFFAOYSA-N 0 3 423.532 4.477 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)Nc1cccc(N2CCC2=O)c1)c1ccc(Cl)cc1 ZINC000483889126 899564231 /nfs/dbraw/zinc/56/42/31/899564231.db2.gz VOQLRDFFIOWTCC-FQEVSTJZSA-N 0 3 414.937 4.281 20 0 HIADHN Cc1c(NC(=O)N[C@@H](CN(C)C)c2ccc(F)cc2)noc1-c1ccccc1F ZINC000483945698 899599016 /nfs/dbraw/zinc/59/90/16/899599016.db2.gz UXGOXQCRBATFDN-SFHVURJKSA-N 0 3 400.429 4.353 20 0 HIADHN O=C(c1ccnc(C2CC2)n1)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000484141293 899760905 /nfs/dbraw/zinc/76/09/05/899760905.db2.gz VEZUQQCYFXOWIR-UHFFFAOYSA-N 0 3 419.356 4.399 20 0 HIADHN CC(=O)c1cc(C(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)cs1 ZINC000484164677 899783622 /nfs/dbraw/zinc/78/36/22/899783622.db2.gz WLMCOMILWHVSMZ-LJQANCHMSA-N 0 3 408.527 4.155 20 0 HIADHN Cc1noc([C@@H]2CCCCN2C(=O)NC[C@H](c2ccccc2)N2CCC(C)CC2)n1 ZINC000484165367 899785425 /nfs/dbraw/zinc/78/54/25/899785425.db2.gz SMPMVTZTWHGFCW-LEWJYISDSA-N 0 3 411.550 4.088 20 0 HIADHN CCCCN(Cc1ccccc1Cl)C(=O)C(=O)Nc1cc(CN(C)C)ccc1C ZINC000484218871 899818521 /nfs/dbraw/zinc/81/85/21/899818521.db2.gz HVJRCUBYCBGYRX-UHFFFAOYSA-N 0 3 415.965 4.477 20 0 HIADHN Cc1c([C@@H](C)NCC2(CCO)CCCCC2)nnn1-c1cccc(Br)c1 ZINC000484278464 899847340 /nfs/dbraw/zinc/84/73/40/899847340.db2.gz OUZCMCJXGKTKBL-OAHLLOKOSA-N 0 3 421.383 4.322 20 0 HIADHN CC[S@](=O)[C@@H]1CCC[C@H](N[C@@H](C)c2ccccc2I)C1 ZINC000484290526 899855229 /nfs/dbraw/zinc/85/52/29/899855229.db2.gz FAZONYQRZAMTCS-YGGLWSGOSA-N 0 3 405.345 4.022 20 0 HIADHN CSc1cccc(N(C(=O)c2ccn(-c3ccccc3)n2)C2CCN(C)CC2)c1 ZINC000484295138 899859054 /nfs/dbraw/zinc/85/90/54/899859054.db2.gz KLBGLJBERWOVTD-UHFFFAOYSA-N 0 3 406.555 4.335 20 0 HIADHN CC[C@@H](N[C@@H]1CCCc2nc(-c3ccc(Cl)cc3)sc21)C(=O)N1CCOCC1 ZINC000484314609 899873660 /nfs/dbraw/zinc/87/36/60/899873660.db2.gz XDLGWMVKACJYOL-IAGOWNOFSA-N 0 3 419.978 4.068 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)NCc1cc(F)ccc1Br)c1ccco1 ZINC000484337970 899889703 /nfs/dbraw/zinc/88/97/03/899889703.db2.gz INVDRNPDRKJAJR-WBMJQRKESA-N 0 3 412.303 4.110 20 0 HIADHN COc1ccc(CC(=O)N(c2cccc(SC)c2)C2CCN(C)CC2)cc1F ZINC000484405162 899929245 /nfs/dbraw/zinc/92/92/45/899929245.db2.gz IYBDTRSMKDOGQO-UHFFFAOYSA-N 0 3 402.535 4.226 20 0 HIADHN CSc1cccc(N(C(=O)c2cnc3c(cnn3C(C)C)c2)C2CCN(C)CC2)c1 ZINC000484404558 899929302 /nfs/dbraw/zinc/92/93/02/899929302.db2.gz ICJZYXSULCSEMC-UHFFFAOYSA-N 0 3 423.586 4.475 20 0 HIADHN COc1ccc([C@H](CN2C(=O)[C@@H]3CC[C@@H](c4ccccc4)N3C2=O)N2CCCC2)cc1 ZINC000484438734 899945235 /nfs/dbraw/zinc/94/52/35/899945235.db2.gz ZCZKRASSCHQKCZ-VABKMULXSA-N 0 3 419.525 4.000 20 0 HIADHN CCc1cc(N2CCC(N[C@@H](C)c3ccc(F)cc3Br)CC2)ncn1 ZINC000484470653 899963812 /nfs/dbraw/zinc/96/38/12/899963812.db2.gz GJMLCOWFDPNBRW-ZDUSSCGKSA-N 0 3 407.331 4.260 20 0 HIADHN Cc1ccc(NC(=O)C[C@@H](C)NCC(=O)N2CCC(Cc3ccccc3)CC2)c(C)c1 ZINC000484481953 899974693 /nfs/dbraw/zinc/97/46/93/899974693.db2.gz XINYPIKMJZIXOL-OAQYLSRUSA-N 0 3 421.585 4.091 20 0 HIADHN CNS(=O)(=O)c1ccc([C@H](C)NCc2cc(-c3ccc(OC)cc3)cs2)cc1 ZINC000484483627 899975962 /nfs/dbraw/zinc/97/59/62/899975962.db2.gz AESFJZKZESWVRF-HNNXBMFYSA-N 0 3 416.568 4.183 20 0 HIADHN COc1cc(OC)cc(N2CC[C@@H](N[C@H](C)c3ccc(F)cc3OC(F)F)C2)c1 ZINC000484491819 899984596 /nfs/dbraw/zinc/98/45/96/899984596.db2.gz JAFHVFFKSPTRBE-UKRRQHHQSA-N 0 3 410.436 4.374 20 0 HIADHN CNS(=O)(=O)c1ccc([C@@H](C)NCc2ccc(-c3ccc(OC)cc3)s2)cc1 ZINC000484495931 899987355 /nfs/dbraw/zinc/98/73/55/899987355.db2.gz CGYFJSHQFRERRE-OAHLLOKOSA-N 0 3 416.568 4.183 20 0 HIADHN Cc1ccc(CN[C@@H](C)c2cccc(N3CCOCC3)c2)c(OC[C@@H]2CCCO2)c1 ZINC000484497988 899988976 /nfs/dbraw/zinc/98/89/76/899988976.db2.gz KCWOOUBQJOAKFP-RDPSFJRHSA-N 0 3 410.558 4.240 20 0 HIADHN C[C@@H](NC[C@@H](C[C@H](C)O)c1ccccc1)c1ccccc1I ZINC000484502895 899993746 /nfs/dbraw/zinc/99/37/46/899993746.db2.gz QJBWTNRMYYSRSW-ZMSDIMECSA-N 0 3 409.311 4.497 20 0 HIADHN CN1CCC[C@@H](N[C@H]2CCCc3nc(-c4ccccc4Br)sc32)C1=O ZINC000484506074 899996628 /nfs/dbraw/zinc/99/66/28/899996628.db2.gz UGVBROXSFFWYIU-GOEBONIOSA-N 0 3 420.376 4.160 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(OCC2CC2)c(F)c1)c1cccc(NS(C)(=O)=O)c1 ZINC000484510297 900001843 /nfs/dbraw/zinc/00/18/43/900001843.db2.gz WOUHRHVWXUAFEA-GJZGRUSLSA-N 0 3 406.523 4.398 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2cccc(-c3nc(C)co3)c2)c1 ZINC000484532791 900018369 /nfs/dbraw/zinc/01/83/69/900018369.db2.gz PIACTCYJRNIXLB-UHFFFAOYSA-N 0 3 408.502 4.254 20 0 HIADHN CCOc1cn(-c2ccccc2)nc1C(=O)NC[C@@H](c1ccsc1)N(CC)CC ZINC000484703019 900138543 /nfs/dbraw/zinc/13/85/43/900138543.db2.gz DUKMVHKBRHJESZ-IBGZPJMESA-N 0 3 412.559 4.145 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)NCc2ccccc2OC2CCCC2)cc1 ZINC000484763466 900177801 /nfs/dbraw/zinc/17/78/01/900177801.db2.gz OFAZGIZXJFSQKM-JOCHJYFZSA-N 0 3 411.546 4.119 20 0 HIADHN C[C@@H]1CC(C)(C)C[C@@](CO)(NCC(=O)Nc2c(Cl)cccc2C(F)(F)F)C1 ZINC000485056678 900385843 /nfs/dbraw/zinc/38/58/43/900385843.db2.gz CMKXRYZKHFSMGN-XIKOKIGWSA-N 0 3 406.876 4.464 20 0 HIADHN CNC(=O)[C@@H]1Cc2ccccc2N1C(=O)C(Cc1c(C)cc(C)cc1C)C(F)(F)F ZINC000485134930 900436739 /nfs/dbraw/zinc/43/67/39/900436739.db2.gz PDSGJGRGFMAJAY-QUCCMNQESA-N 0 3 418.459 4.037 20 0 HIADHN CCc1c(NC(=O)N(C)C[C@@H]2CCN(C)[C@H]2c2cccnc2)cnn1C(CC)CC ZINC000485174763 900472115 /nfs/dbraw/zinc/47/21/15/900472115.db2.gz CJBDKOOANKLBOV-AVRDEDQJSA-N 0 3 412.582 4.358 20 0 HIADHN CCC[C@@H](NCC(=O)Nc1ccccc1I)c1ccccc1 ZINC000485280215 900558078 /nfs/dbraw/zinc/55/80/78/900558078.db2.gz BVEWAGQSJGLLPL-MRXNPFEDSA-N 0 3 408.283 4.361 20 0 HIADHN CCc1c(NC(=O)N(CCN(C)C)C2CCCC2)cnn1-c1ccccc1Cl ZINC000485345875 900637822 /nfs/dbraw/zinc/63/78/22/900637822.db2.gz DCLZUIBCQNYTMR-UHFFFAOYSA-N 0 3 403.958 4.426 20 0 HIADHN O=C(NCCSCc1ccccc1F)NC[C@@H](c1cccs1)N1CCCC1 ZINC000505797737 914462926 /nfs/dbraw/zinc/46/29/26/914462926.db2.gz WWUNBIZVVBGWNF-SFHVURJKSA-N 0 3 407.580 4.257 20 0 HIADHN CCc1c(NC(=O)NCCN2CCCCC2)cnn1-c1cccc(C(F)(F)F)c1 ZINC000485358841 900654587 /nfs/dbraw/zinc/65/45/87/900654587.db2.gz QAJRSUKLZOPBSX-UHFFFAOYSA-N 0 3 409.456 4.061 20 0 HIADHN CCn1ccnc1[C@@H]1CCCCN1C(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000485376943 900674106 /nfs/dbraw/zinc/67/41/06/900674106.db2.gz CCUIXWYJCGNOII-ROUUACIJSA-N 0 3 401.580 4.038 20 0 HIADHN COc1ccc(NC(=O)CCN2CCC[C@@H]2CC(=O)c2cccs2)cc1Cl ZINC000485410629 900707653 /nfs/dbraw/zinc/70/76/53/900707653.db2.gz QVMRAPQXLZXYRU-OAHLLOKOSA-N 0 3 406.935 4.476 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)Cc2ccc(F)cc2Br)C1 ZINC000485456315 900750655 /nfs/dbraw/zinc/75/06/55/900750655.db2.gz RPOMLHHFFOQIGN-KBXCAEBGSA-N 0 3 405.311 4.082 20 0 HIADHN CC[C@H](C)[C@@H](C(=O)Nc1ccc(C(=O)NCCN2CCCC2)cc1)c1ccccc1 ZINC000485521829 900805174 /nfs/dbraw/zinc/80/51/74/900805174.db2.gz RWYMJRRQDSIRHY-WMZHIEFXSA-N 0 3 407.558 4.281 20 0 HIADHN CCOC(=O)c1cc(NC(=O)NC[C@H](N[C@@H](C)CC)c2ccco2)c(F)cc1C ZINC000485572289 900840407 /nfs/dbraw/zinc/84/04/07/900840407.db2.gz CJJVSGSGXVTJJJ-KSSFIOAISA-N 0 3 405.470 4.155 20 0 HIADHN O=C(N[C@H](c1ccccc1)c1cccnc1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000485604065 900863318 /nfs/dbraw/zinc/86/33/18/900863318.db2.gz UZNDENJUTZPOEA-LADGPHEKSA-N 0 3 403.501 4.339 20 0 HIADHN C[C@H](NC(=O)CCCN1CCN(c2ccccc2)CC1)c1ccc2ncsc2c1 ZINC000485669738 900919597 /nfs/dbraw/zinc/91/95/97/900919597.db2.gz KZLIZHMKETXTIC-SFHVURJKSA-N 0 3 408.571 4.076 20 0 HIADHN CN(C)CCN(C(=O)Nc1ccc(F)cc1OCCC(F)(F)F)C1CCCC1 ZINC000505849078 914497449 /nfs/dbraw/zinc/49/74/49/914497449.db2.gz DHEGJVSBNOXBLA-UHFFFAOYSA-N 0 3 405.436 4.495 20 0 HIADHN CN(C)Cc1ccccc1C(=O)Nc1ccc(C(=O)NCc2ccc(F)cc2)cc1 ZINC000485793861 901045785 /nfs/dbraw/zinc/04/57/85/901045785.db2.gz VLQBHJJAOJDFNI-UHFFFAOYSA-N 0 3 405.473 4.070 20 0 HIADHN CC(C)Oc1ccccc1CN(C)[C@@H](C)c1ccc(N2CCCS2(=O)=O)cc1 ZINC000485824065 901070980 /nfs/dbraw/zinc/07/09/80/901070980.db2.gz YSUQHQFRHTUFGS-SFHVURJKSA-N 0 3 402.560 4.207 20 0 HIADHN CC[C@@H](NC[C@H](O)COc1cccc(C(C)=O)c1)c1cc(F)cc(Br)c1 ZINC000485848237 901092461 /nfs/dbraw/zinc/09/24/61/901092461.db2.gz VGTZGIWHBYAWIK-AZUAARDMSA-N 0 3 424.310 4.271 20 0 HIADHN COc1cc(NC(=O)CN2C[C@H](c3ccccc3)[C@@H]3CCCC[C@@H]32)cc(OC)c1OC ZINC000485885194 901119130 /nfs/dbraw/zinc/11/91/30/901119130.db2.gz ZKPJELNYFTURQR-HBMCJLEFSA-N 0 3 424.541 4.309 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3cccc(Br)c3)CC2)C[C@@H](C)O1 ZINC000485976792 901195206 /nfs/dbraw/zinc/19/52/06/901195206.db2.gz HZZXKMNGCFNVNM-HZPDHXFCSA-N 0 3 424.383 4.192 20 0 HIADHN COc1ccc(Cl)cc1S(=O)(=O)N(C)[C@H]1CCN(Cc2ccccc2)[C@H](C)C1 ZINC000486250949 901434003 /nfs/dbraw/zinc/43/40/03/901434003.db2.gz GZUPVJOISWMOBD-APWZRJJASA-N 0 3 422.978 4.022 20 0 HIADHN Cc1cc(C)c(NC(=O)NC2CCN(CCOC(C)C)CC2)cc1Br ZINC000486357325 901527265 /nfs/dbraw/zinc/52/72/65/901527265.db2.gz XJJUSBULKJRWRK-UHFFFAOYSA-N 0 3 412.372 4.077 20 0 HIADHN Cc1ccc(OC(F)F)c(CN2C[C@H]3CCC[C@@]3(c3nc(CC4CC4)no3)C2)c1 ZINC000486435976 901595064 /nfs/dbraw/zinc/59/50/64/901595064.db2.gz RQPKFKVTCQSMMR-VGOFRKELSA-N 0 3 403.473 4.486 20 0 HIADHN COc1ccccc1[C@H](CNc1ccc(C(=O)N2CCC(C)CC2)cn1)N1CCCC1 ZINC000486445312 901603858 /nfs/dbraw/zinc/60/38/58/901603858.db2.gz BJCNXYGHZPUODP-QFIPXVFZSA-N 0 3 422.573 4.211 20 0 HIADHN O=C([C@H]1CCCCCC(=O)C1)N(C[C@H]1CCN(Cc2ccccc2)C1)CC(F)(F)F ZINC000486549228 901697056 /nfs/dbraw/zinc/69/70/56/901697056.db2.gz SIBZHNAOILIGKM-PMACEKPBSA-N 0 3 424.507 4.439 20 0 HIADHN C[C@H](Cc1cncc2ccccc21)C(=O)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000486566169 901711584 /nfs/dbraw/zinc/71/15/84/901711584.db2.gz OKULKLIKMMSGCT-GOSISDBHSA-N 0 3 403.526 4.009 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)[C@H](C)Oc2ccccc2Br)C1 ZINC000486720368 901812709 /nfs/dbraw/zinc/81/27/09/901812709.db2.gz GHPAKSJAFDHCAB-SOLBZPMBSA-N 0 3 417.347 4.168 20 0 HIADHN O=C(CCOc1ccc2ccccc2c1)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000486722210 901814199 /nfs/dbraw/zinc/81/41/99/901814199.db2.gz IWEVCZOZZIMCDC-UHFFFAOYSA-N 0 3 418.537 4.452 20 0 HIADHN Cc1nn(-c2ccncc2)cc1CN[C@@H]1CSc2ccc(Br)cc21 ZINC000486808538 901867474 /nfs/dbraw/zinc/86/74/74/901867474.db2.gz KVCZMIISTIPNIT-QGZVFWFLSA-N 0 3 401.333 4.275 20 0 HIADHN CC(C)CC[C@@H]1CCCN1CC(=O)N(C)CC(=O)Nc1ccccc1C(F)(F)F ZINC000486810457 901867567 /nfs/dbraw/zinc/86/75/67/901867567.db2.gz QZFVEDPZOPMZQX-INIZCTEOSA-N 0 3 413.484 4.003 20 0 HIADHN C[C@@H](c1nc2ccccc2o1)N1C[C@H]2CCC[C@@]2(c2nc(-c3cccnc3)no2)C1 ZINC000486829592 901881266 /nfs/dbraw/zinc/88/12/66/901881266.db2.gz WHCLUNBPPUZLNJ-XSSDXNQZSA-N 0 3 401.470 4.388 20 0 HIADHN CO[C@@H](C)c1nc(C)c(C(=O)Nc2ccc(CCN3CCSCC3)cc2)s1 ZINC000486871960 901916935 /nfs/dbraw/zinc/91/69/35/901916935.db2.gz ICBSCNCBKGQMHW-HNNXBMFYSA-N 0 3 405.589 4.003 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N2C[C@H](c3ccccc3)[C@H]3CCCC[C@@H]32)CC1 ZINC000486878530 901923876 /nfs/dbraw/zinc/92/38/76/901923876.db2.gz ITAMWDRBKYPUDD-SMIHKQSGSA-N 0 3 413.606 4.244 20 0 HIADHN CC(C)c1c(NC(=O)NC[C@@H](Cc2ccccc2)N(C)C)cnn1-c1ccccc1 ZINC000486889084 901934153 /nfs/dbraw/zinc/93/41/53/901934153.db2.gz UWGJIZUKOICHQZ-OAQYLSRUSA-N 0 3 405.546 4.290 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)Nc1nnc(/C=C\c2ccco2)s1 ZINC000486899933 901944405 /nfs/dbraw/zinc/94/44/05/901944405.db2.gz LIGXBVJVQCACQE-KTKRTIGZSA-N 0 3 415.494 4.036 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)Nc2nnc(/C=C/c3ccco3)s2)CN1Cc1ccccc1 ZINC000486942131 901979184 /nfs/dbraw/zinc/97/91/84/901979184.db2.gz LGTKWQHPPCLYHY-FKLRVFMWSA-N 0 3 409.515 4.086 20 0 HIADHN CN(C(=O)NC[C@@H](c1ccccc1)C(F)(F)F)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000486987283 902003834 /nfs/dbraw/zinc/00/38/34/902003834.db2.gz LXLXXVRPKSWQNN-UXHICEINSA-N 0 3 405.464 4.248 20 0 HIADHN CN(C(=O)NC[C@H](c1ccccc1)C(F)(F)F)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000486987285 902004372 /nfs/dbraw/zinc/00/43/72/902004372.db2.gz LXLXXVRPKSWQNN-WOJBJXKFSA-N 0 3 405.464 4.248 20 0 HIADHN Cc1[nH]nc(-c2ccccc2)c1NC(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000487056066 902040742 /nfs/dbraw/zinc/04/07/42/902040742.db2.gz HHWPKUWFYVUTOS-IBGZPJMESA-N 0 3 410.468 4.481 20 0 HIADHN Cc1n[nH]c(C)c1[C@H](C)C(=O)N[C@@H](c1ccc(F)c(F)c1)C(C)(C)N1CCCC1 ZINC000487138208 902069291 /nfs/dbraw/zinc/06/92/91/902069291.db2.gz NAKVJKHRRUCXME-RBZFPXEDSA-N 0 3 404.505 4.140 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2c(F)cc(F)cc2Br)[C@H]1c1ccccc1 ZINC000487193583 902096605 /nfs/dbraw/zinc/09/66/05/902096605.db2.gz HEEVNRBIBWUMBH-DOTOQJQBSA-N 0 3 410.262 4.294 20 0 HIADHN Cc1nc(-c2ccc(C)cc2NC(=O)CNC2(c3ccc(F)cc3)CCCC2)n[nH]1 ZINC000487416437 902198373 /nfs/dbraw/zinc/19/83/73/902198373.db2.gz XBKUVHNKRFSOPM-UHFFFAOYSA-N 0 3 407.493 4.225 20 0 HIADHN Cc1cc(NC(=O)c2ccc(F)cc2Cl)sc1C(=O)N(C)CCN1CCCC1 ZINC000487623961 902256276 /nfs/dbraw/zinc/25/62/76/902256276.db2.gz SDKIVYLGCPTYFY-UHFFFAOYSA-N 0 3 423.941 4.269 20 0 HIADHN CN(C(=O)N[C@H]1CCC[C@H](c2ccccc2)C1)C1CCN(CCc2ccccn2)CC1 ZINC000487731835 902325529 /nfs/dbraw/zinc/32/55/29/902325529.db2.gz AUOSWDFYFVVLKG-UPVQGACJSA-N 0 3 420.601 4.456 20 0 HIADHN COCCSCCCN1CCC[C@H]1c1ccccc1I ZINC000487914109 902447428 /nfs/dbraw/zinc/44/74/28/902447428.db2.gz HKZUAPTVIFZACI-INIZCTEOSA-N 0 3 405.345 4.198 20 0 HIADHN C[C@H]1CN(C2CCOCC2)CCN1C(=O)c1ccc(N2CCCc3ccccc32)cc1 ZINC000488054480 902568946 /nfs/dbraw/zinc/56/89/46/902568946.db2.gz VGSQTEUMLZCNLX-FQEVSTJZSA-N 0 3 419.569 4.096 20 0 HIADHN C[C@@H]1CC[C@@H](CN2CCC(c3nc(-c4ccccc4Br)no3)CC2)O1 ZINC000488171829 902661059 /nfs/dbraw/zinc/66/10/59/902661059.db2.gz UHRNZYASFXKSBY-HIFRSBDPSA-N 0 3 406.324 4.246 20 0 HIADHN OCCN(Cc1ccc(OC[C@@H]2CCCO2)cc1)Cc1cccc(Br)c1 ZINC000488181948 902669793 /nfs/dbraw/zinc/66/97/93/902669793.db2.gz KLRKIHOEHZCCSP-NRFANRHFSA-N 0 3 420.347 4.001 20 0 HIADHN CCCCOCCN1CCC(c2nc(-c3ccccc3Br)no2)CC1 ZINC000488238007 902714192 /nfs/dbraw/zinc/71/41/92/902714192.db2.gz VTNAOOJMZLUVJI-UHFFFAOYSA-N 0 3 408.340 4.495 20 0 HIADHN COc1cc(CNC(=O)NC[C@H](c2ccccc2)N(C)C)ccc1OC1CCCC1 ZINC000505984185 914651215 /nfs/dbraw/zinc/65/12/15/914651215.db2.gz JITWGPHIIPHTKH-OAQYLSRUSA-N 0 3 411.546 4.119 20 0 HIADHN CCn1cc([C@@H]2NC(=O)CC[C@H]2N[C@H](C)c2cc3c(ccc4ccccc34)o2)cn1 ZINC000488488117 902850876 /nfs/dbraw/zinc/85/08/76/902850876.db2.gz QPLFVFUHOVHCTQ-VEQVNTQVSA-N 0 3 402.498 4.473 20 0 HIADHN COc1cc(C(=O)Nc2cccc(CN3CCC(O)CC3)c2)ccc1OC1CCCC1 ZINC000488662329 902925641 /nfs/dbraw/zinc/92/56/41/902925641.db2.gz WXWJEGUUESZQKL-UHFFFAOYSA-N 0 3 424.541 4.226 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CC(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000488678015 902940017 /nfs/dbraw/zinc/94/00/17/902940017.db2.gz QYYJEUMGZTYFNW-UHFFFAOYSA-N 0 3 416.569 4.155 20 0 HIADHN Cc1ccc(C)c(OCCCCC(=O)Nc2cccc(CN3CCC(O)CC3)c2)c1 ZINC000488682859 902944709 /nfs/dbraw/zinc/94/47/09/902944709.db2.gz CXWZJFBCNCHJLJ-UHFFFAOYSA-N 0 3 410.558 4.448 20 0 HIADHN Cc1cc(C)n(Cc2cccc(C(=O)N(Cc3ccccc3)C3CCN(C)CC3)c2)n1 ZINC000488692860 902945495 /nfs/dbraw/zinc/94/54/95/902945495.db2.gz KGCRVQFAAPJYDW-UHFFFAOYSA-N 0 3 416.569 4.285 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)c2csc(Cc3ccccc3)n2)CC1 ZINC000488692850 902946936 /nfs/dbraw/zinc/94/69/36/902946936.db2.gz KFFVPCQFHCMERO-UHFFFAOYSA-N 0 3 405.567 4.471 20 0 HIADHN CC(C)c1ccc(/C=C\CC(=O)Nc2ccc3oc(=O)n(CCN(C)C)c3c2)cc1 ZINC000488700139 902950646 /nfs/dbraw/zinc/95/06/46/902950646.db2.gz MTGVLNAMLNRGLL-WAYWQWQTSA-N 0 3 407.514 4.322 20 0 HIADHN CN(C)CCn1c(=O)oc2ccc(NC(=O)CCCCCc3ccc(F)cc3)cc21 ZINC000488704880 902955003 /nfs/dbraw/zinc/95/50/03/902955003.db2.gz TYBOGEXRZMZYKO-UHFFFAOYSA-N 0 3 413.493 4.037 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1ccc(F)cc1OC1CCOCC1)c1ccco1 ZINC000488711488 902960001 /nfs/dbraw/zinc/96/00/01/902960001.db2.gz WQPDLVPVBTZSRW-KXBFYZLASA-N 0 3 419.497 4.227 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cscc1Br)c1cccc(OC)c1 ZINC000506000033 914672795 /nfs/dbraw/zinc/67/27/95/914672795.db2.gz SXVBSIGDSMWDNH-KRWDZBQOSA-N 0 3 411.365 4.332 20 0 HIADHN Cc1ccccc1[C@H](C(C)C)N(C)CC(=O)NCc1ccccc1CN1CCCC1=O ZINC000488802348 903006647 /nfs/dbraw/zinc/00/66/47/903006647.db2.gz XDMFHYCLJWFLNU-SANMLTNESA-N 0 3 421.585 4.063 20 0 HIADHN CCC(C)(C)OCc1cccc(NC(=O)N2CCN(C3CCOCC3)C[C@@H]2C)c1C ZINC000488916910 903075866 /nfs/dbraw/zinc/07/58/66/903075866.db2.gz VGIRITJIAIIJDN-SFHVURJKSA-N 0 3 417.594 4.417 20 0 HIADHN CC(=O)c1cccc(NC(=O)[C@H](C)N[C@@H](COc2ccccc2F)C(C)(C)C)c1 ZINC000489042041 903148318 /nfs/dbraw/zinc/14/83/18/903148318.db2.gz YCQWTSCPGJBYQK-BTYIYWSLSA-N 0 3 400.494 4.439 20 0 HIADHN CC[C@H](C)[C@@](C)(O)CNCc1cc(Br)cc(Br)c1OC ZINC000489062562 903165480 /nfs/dbraw/zinc/16/54/80/903165480.db2.gz GNQGOFIOLCYAAL-BONVTDFDSA-N 0 3 409.162 4.107 20 0 HIADHN CN(CCN(Cc1ccccc1)C(=O)NCc1cccc(CO)c1)Cc1ccccc1 ZINC000489193782 903252339 /nfs/dbraw/zinc/25/23/39/903252339.db2.gz QRMBYMQZBLCAEU-UHFFFAOYSA-N 0 3 417.553 4.023 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)NCC2(c3ccccc3)CCOCC2)CC1 ZINC000489276827 903302632 /nfs/dbraw/zinc/30/26/32/903302632.db2.gz KIQIKXNSTMRISZ-UHFFFAOYSA-N 0 3 421.585 4.041 20 0 HIADHN COc1ccc([C@@H](NC(=O)N(Cc2ccccc2)C2CCN(C)CC2)C2CC2)cc1 ZINC000489321091 903329806 /nfs/dbraw/zinc/32/98/06/903329806.db2.gz FZHIAZGTEIQXMA-DEOSSOPVSA-N 0 3 407.558 4.452 20 0 HIADHN CC1(C)CC[C@@H](NC(=O)NCc2ccccc2CN2CCC(O)CC2)c2ccccc21 ZINC000489407069 903372243 /nfs/dbraw/zinc/37/22/43/903372243.db2.gz LTUXGDXALSVUKC-XMMPIXPASA-N 0 3 421.585 4.255 20 0 HIADHN C[C@@H]1C[C@H]1C(=O)Nc1ccc(C(=O)Nc2ccc(CCN3CCSCC3)cc2)cc1 ZINC000489418526 903375673 /nfs/dbraw/zinc/37/56/73/903375673.db2.gz MMRWBXGKARXEEG-VGOFRKELSA-N 0 3 423.582 4.125 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)NCc2ccc(OC(F)(F)F)cc2)c1 ZINC000489457667 903395886 /nfs/dbraw/zinc/39/58/86/903395886.db2.gz OPOCFTQRUQFPRF-UHFFFAOYSA-N 0 3 409.452 4.167 20 0 HIADHN O=C(Nc1ccc(F)cc1)[C@H](N[C@@H]1CCO[C@]2(CCSC2)C1)c1ccccc1 ZINC000489477963 903408581 /nfs/dbraw/zinc/40/85/81/903408581.db2.gz NEMQNBGLQQEAJZ-KCZVDYSFSA-N 0 3 400.519 4.150 20 0 HIADHN c1cc(CN2CCOCC2)ccc1CN[C@H]1CCCOc2cc3c(cc21)CCCC3 ZINC000489548857 903457536 /nfs/dbraw/zinc/45/75/36/903457536.db2.gz GUXZOCRZIQTZHN-VWLOTQADSA-N 0 3 406.570 4.401 20 0 HIADHN Cc1ccc(NC(=O)N(C)C2CCN(CCc3ccccn3)CC2)cc1OC(C)C ZINC000489591085 903481906 /nfs/dbraw/zinc/48/19/06/903481906.db2.gz YYBSIXMQLIUVIX-UHFFFAOYSA-N 0 3 410.562 4.348 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2cccc(NC(=O)[C@H]3C[C@H]3C)c2)N2CCCC2)cc1 ZINC000489600053 903490059 /nfs/dbraw/zinc/49/00/59/903490059.db2.gz UATPXRXRWQVZRD-LEOXJPRUSA-N 0 3 405.542 4.156 20 0 HIADHN COc1cc(CNC(=O)N(Cc2ccccc2)C2CCN(C)CC2)c2ccccc2n1 ZINC000489617215 903499610 /nfs/dbraw/zinc/49/96/10/903499610.db2.gz BPWJWGAOGSFRGC-UHFFFAOYSA-N 0 3 418.541 4.049 20 0 HIADHN COc1cc([C@H](C)N[C@H](C)c2ccc(Br)c(F)c2)ccc1OCCO ZINC000489631826 903508274 /nfs/dbraw/zinc/50/82/74/903508274.db2.gz ORAGBNHIIJQDRP-OLZOCXBDSA-N 0 3 412.299 4.380 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)Nc1cc(-c2ccsc2)nn1C ZINC000489725213 903560381 /nfs/dbraw/zinc/56/03/81/903560381.db2.gz CFDNRCSGLQVDHB-UHFFFAOYSA-N 0 3 417.966 4.398 20 0 HIADHN CCN(C(=O)NCc1ccccc1CN1CCC(O)CC1)[C@@H](C)c1ccc(F)cc1 ZINC000489750794 903578306 /nfs/dbraw/zinc/57/83/06/903578306.db2.gz ANTLWHGGBAVPLM-SFHVURJKSA-N 0 3 413.537 4.075 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)Nc1cccc(OC2CCCC2)c1 ZINC000489789698 903599817 /nfs/dbraw/zinc/59/98/17/903599817.db2.gz KNKPXFPIMWOPGD-UHFFFAOYSA-N 0 3 423.557 4.286 20 0 HIADHN CCOc1cc(CN(CC)Cc2cccc(F)c2)ccc1O[C@@H](C)C(=O)N(C)C ZINC000506054889 914753159 /nfs/dbraw/zinc/75/31/59/914753159.db2.gz DXJUNTPNDAUAFH-KRWDZBQOSA-N 0 3 402.510 4.102 20 0 HIADHN CC(C)C[C@H](CN[C@@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1)N(C)C ZINC000490135134 903784397 /nfs/dbraw/zinc/78/43/97/903784397.db2.gz FGSDKCOWMWQGBV-IRLDBZIGSA-N 0 3 423.022 4.399 20 0 HIADHN CC(=O)N1CC[C@@H](NCc2cccc(NC(=O)C3CCCC3)c2)c2ccccc2C1 ZINC000490147972 903793526 /nfs/dbraw/zinc/79/35/26/903793526.db2.gz BEPDTUZZIVXGKN-XMMPIXPASA-N 0 3 405.542 4.398 20 0 HIADHN CCc1ccc([C@H](NCC2CCN(S(C)(=O)=O)CC2)c2ccccc2Cl)cc1 ZINC000490168692 903806640 /nfs/dbraw/zinc/80/66/40/903806640.db2.gz YQTVJSHYKYRVLK-QFIPXVFZSA-N 0 3 421.006 4.253 20 0 HIADHN CCc1ccc([C@H](NCCN2CCCC[C@@H]2C)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000490168108 903806656 /nfs/dbraw/zinc/80/66/56/903806656.db2.gz RHQATTVXVZAAFH-CYFREDJKSA-N 0 3 414.615 4.206 20 0 HIADHN Cc1ccc(C)c([C@@H](NCC2CCN(S(C)(=O)=O)CC2)c2ccccc2Cl)c1 ZINC000490171230 903807952 /nfs/dbraw/zinc/80/79/52/903807952.db2.gz AWELDWPGTZILJR-QFIPXVFZSA-N 0 3 421.006 4.307 20 0 HIADHN CCN1CCN([C@@H](C)CN[C@@H](c2cccc(SC)c2)c2cc(F)ccc2F)CC1 ZINC000490171582 903808872 /nfs/dbraw/zinc/80/88/72/903808872.db2.gz FUYKAGHDSRXHIQ-SBUREZEXSA-N 0 3 419.585 4.392 20 0 HIADHN CC[C@@H](CN[C@@H](c1cccc(S(C)(=O)=O)c1)c1ccc(C)cc1C)N1CCCC1 ZINC000490171851 903809003 /nfs/dbraw/zinc/80/90/03/903809003.db2.gz JBINJEFEKYNVOI-URXFXBBRSA-N 0 3 414.615 4.260 20 0 HIADHN Cc1ccc(NC(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1C(=O)N1CCCCC1 ZINC000490231334 903840173 /nfs/dbraw/zinc/84/01/73/903840173.db2.gz QJSAJYXXOLATPG-QFIPXVFZSA-N 0 3 420.557 4.017 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N[C@H](c2ccccc2)c2ccncc2)C1 ZINC000490234128 903842421 /nfs/dbraw/zinc/84/24/21/903842421.db2.gz AAMXQNBIWIHZOX-VEXUSMLFSA-N 0 3 400.526 4.306 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N[C@@H](c2ccccc2)c2ccncc2)C1 ZINC000490234130 903842615 /nfs/dbraw/zinc/84/26/15/903842615.db2.gz AAMXQNBIWIHZOX-YGOYIFOWSA-N 0 3 400.526 4.306 20 0 HIADHN COc1ccc(NC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)cc1Br ZINC000490315096 903895580 /nfs/dbraw/zinc/89/55/80/903895580.db2.gz RPFHVWGDOWGYGQ-QGZVFWFLSA-N 0 3 418.335 4.244 20 0 HIADHN CCNC(=O)Nc1ccc(C)c(NC(=O)NC[C@@H](CC)N2CCc3ccccc3C2)c1 ZINC000490337568 903926938 /nfs/dbraw/zinc/92/69/38/903926938.db2.gz OUWPBALJLGXNNU-OAQYLSRUSA-N 0 3 423.561 4.095 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3ccc(-c4ccco4)cc3F)CC2)C[C@H](C)O1 ZINC000490510426 904060029 /nfs/dbraw/zinc/06/00/29/904060029.db2.gz SZACVYDEPKCBDF-CALCHBBNSA-N 0 3 415.509 4.439 20 0 HIADHN CC[C@H](CNC(=O)N(Cc1ccccc1)C1CCN(C)CC1)Oc1ccccc1C ZINC000490520205 904068524 /nfs/dbraw/zinc/06/85/24/904068524.db2.gz JCTVTCYGVAYXMP-HSZRJFAPSA-N 0 3 409.574 4.458 20 0 HIADHN COC(=O)c1cc(NC(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)c(F)cc1F ZINC000490658824 904159277 /nfs/dbraw/zinc/15/92/77/904159277.db2.gz DBMFSGQXESWMOX-FQEVSTJZSA-N 0 3 417.456 4.018 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2ccc(CN3CCCC3=O)cc2)N2CCCC2)cc1 ZINC000490671616 904166527 /nfs/dbraw/zinc/16/65/27/904166527.db2.gz OKWCWPXDPFVMFE-HSZRJFAPSA-N 0 3 420.557 4.076 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2cccc(C(=O)NC(C)(C)C)c2)N2CCCC2)cc1 ZINC000490685397 904172936 /nfs/dbraw/zinc/17/29/36/904172936.db2.gz UHMMRAUONRGQIT-JOCHJYFZSA-N 0 3 422.573 4.482 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)NCc1ccc(OC)cc1C(F)(F)F)c1ccco1 ZINC000490729410 904196170 /nfs/dbraw/zinc/19/61/70/904196170.db2.gz CSYPOBPQKGYWIR-GUYCJALGSA-N 0 3 413.440 4.236 20 0 HIADHN Cc1nc(COc2ccc(CN3CCC[C@@H]3c3ccc4c(c3)OCCO4)cc2)no1 ZINC000506085745 914793529 /nfs/dbraw/zinc/79/35/29/914793529.db2.gz MBQOSGGBMVGCRA-HXUWFJFHSA-N 0 3 407.470 4.065 20 0 HIADHN Cc1ccc(NC(=O)Nc2ccccc2)cc1NC(=O)N1CC[C@H]2CCN(C)C[C@@H]21 ZINC000490805606 904253036 /nfs/dbraw/zinc/25/30/36/904253036.db2.gz LYMCGFCPQQUAMV-UTKZUKDTSA-N 0 3 407.518 4.197 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)c1c[nH]nc1-c1ccc(F)cc1 ZINC000490870846 904297558 /nfs/dbraw/zinc/29/75/58/904297558.db2.gz NXHLOUOWEVNKON-UHFFFAOYSA-N 0 3 410.518 4.059 20 0 HIADHN CN(CCNC(=O)N1CCCC[C@@H]1c1nc(-c2ccccc2)no1)Cc1ccccc1 ZINC000490931296 904323838 /nfs/dbraw/zinc/32/38/38/904323838.db2.gz DXXUNKQPJBLRJX-OAQYLSRUSA-N 0 3 419.529 4.105 20 0 HIADHN CSc1cccc([C@H](N[C@@H](C)CN2CCN(C)CC2)c2cc(F)ccc2F)c1 ZINC000491019373 904371649 /nfs/dbraw/zinc/37/16/49/904371649.db2.gz KTKQEQUOIKZYCP-AOMKIAJQSA-N 0 3 405.558 4.002 20 0 HIADHN CCc1ccc([C@H](CNC(=O)NCc2cccc(NC(=O)[C@H](C)CC)c2)N(C)C)cc1 ZINC000506103863 914805151 /nfs/dbraw/zinc/80/51/51/914805151.db2.gz CYYOLKVMOSQKJU-JPYJTQIMSA-N 0 3 424.589 4.336 20 0 HIADHN CC[C@@H](C)N(C)CCN[C@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000491050967 904395099 /nfs/dbraw/zinc/39/50/99/904395099.db2.gz IKNXKYNMIJFFCD-IIBYNOLFSA-N 0 3 408.995 4.153 20 0 HIADHN Cc1ccc([C@H](N[C@H]2CCN(c3ccccc3)C2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000491062113 904404819 /nfs/dbraw/zinc/40/48/19/904404819.db2.gz USDGMVZCGGFCLS-DHLKQENFSA-N 0 3 420.578 4.356 20 0 HIADHN Cc1ccccc1-c1nn(-c2ccccc2)cc1CN1CCC(C(=O)N(C)C)CC1 ZINC000506116113 914809560 /nfs/dbraw/zinc/80/95/60/914809560.db2.gz PTOHVLPGVXTJQC-UHFFFAOYSA-N 0 3 402.542 4.148 20 0 HIADHN COc1ccccc1-c1ncc(CNCCc2nc(-c3ccccn3)cs2)cn1 ZINC000491234729 904494519 /nfs/dbraw/zinc/49/45/19/904494519.db2.gz HUCFSSGYNWIZAI-UHFFFAOYSA-N 0 3 403.511 4.003 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)Nc3ccc(Br)c(C(F)(F)F)c3)[C@@H]2C1 ZINC000491297188 904523967 /nfs/dbraw/zinc/52/39/67/904523967.db2.gz SXLRYGIDSCZWAO-QMTHXVAHSA-N 0 3 406.246 4.026 20 0 HIADHN COc1cccc([C@@H](CN[C@@H](c2cnn(C)c2)c2cccc(F)c2)N2CCCC2)c1 ZINC000491309887 904528493 /nfs/dbraw/zinc/52/84/93/904528493.db2.gz ZPGQOPMZJCGLSD-DNQXCXABSA-N 0 3 408.521 4.084 20 0 HIADHN CC(C)Oc1ccc([C@@H](CN2C(=O)CN([C@@H](C)c3ccccc3)C2=O)N(C)C)cc1 ZINC000491313680 904532215 /nfs/dbraw/zinc/53/22/15/904532215.db2.gz BBEZBOCSPWWHTK-PGRDOPGGSA-N 0 3 409.530 4.102 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](N[C@H]2CCc3ccccc3C2)c2ccc(F)cc2)c1 ZINC000491344118 904547967 /nfs/dbraw/zinc/54/79/67/904547967.db2.gz WQGVNRNDZWZAAH-UPVQGACJSA-N 0 3 409.526 4.466 20 0 HIADHN COc1ccc(CCN[C@@H](c2ccc(F)cc2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000491377938 904567261 /nfs/dbraw/zinc/56/72/61/904567261.db2.gz ABBKHYJSSJLOKG-QHCPKHFHSA-N 0 3 413.514 4.160 20 0 HIADHN COc1ccc(CCN[C@@H](c2ccc(C)cc2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000491384654 904570483 /nfs/dbraw/zinc/57/04/83/904570483.db2.gz UTUYHCCNEGAJDH-DEOSSOPVSA-N 0 3 409.551 4.329 20 0 HIADHN COc1ccccc1-c1ncc(CN[C@]2(Cc3ccc(Cl)cc3)CCOC2)cn1 ZINC000491388046 904572590 /nfs/dbraw/zinc/57/25/90/904572590.db2.gz JUSKDFAQAJFDFV-QHCPKHFHSA-N 0 3 409.917 4.297 20 0 HIADHN C[C@@H](c1cccc(N2CCCS2(=O)=O)c1)N(C)Cc1cccc(OC(F)F)c1 ZINC000491390533 904574349 /nfs/dbraw/zinc/57/43/49/904574349.db2.gz VZKAZEIPTRWXRE-HNNXBMFYSA-N 0 3 410.486 4.021 20 0 HIADHN COc1ccc([C@H](NCc2ccccc2CN2CCOCC2)c2ccccc2)cc1 ZINC000491421550 904586336 /nfs/dbraw/zinc/58/63/36/904586336.db2.gz FKTATNXNWVOALU-AREMUKBSSA-N 0 3 402.538 4.407 20 0 HIADHN C[C@H]1C[C@@H]1C(=O)Nc1cccc(C(=O)NC[C@H](c2ccccc2)N2CCC(C)CC2)c1 ZINC000491423952 904590268 /nfs/dbraw/zinc/59/02/68/904590268.db2.gz OOLGKKFVCATHGL-WDJPJFJCSA-N 0 3 419.569 4.484 20 0 HIADHN Cc1ccc(C)c([C@@H](NCc2ccc(N3CCN(C)CC3)nc2)c2ccccc2)c1 ZINC000491424989 904590723 /nfs/dbraw/zinc/59/07/23/904590723.db2.gz YJDBDYOYPNRIAR-SANMLTNESA-N 0 3 400.570 4.329 20 0 HIADHN CCCCOc1cc(CN2CCC(C(=O)Nc3ccccc3O)CC2)ccc1OC ZINC000506152748 914825810 /nfs/dbraw/zinc/82/58/10/914825810.db2.gz HQIZHLWQVGSOQU-UHFFFAOYSA-N 0 3 412.530 4.430 20 0 HIADHN COc1cc(CN(Cc2ccc(-n3cncn3)c(C)c2)C2CC2)ccc1OC(F)F ZINC000506164941 914830772 /nfs/dbraw/zinc/83/07/72/914830772.db2.gz QLQKUFFDLJVWNM-UHFFFAOYSA-N 0 3 414.456 4.350 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)Nc2cc(NC(=O)C(C)C)ccc2C)c1 ZINC000491723875 904690071 /nfs/dbraw/zinc/69/00/71/904690071.db2.gz XMUMDMUNIHAGPF-UHFFFAOYSA-N 0 3 410.562 4.494 20 0 HIADHN CN(C)[C@@H](CNC(=O)N1CCC[C@@H](c2nc3ccc(F)cc3o2)C1)Cc1ccccc1 ZINC000506183674 914837074 /nfs/dbraw/zinc/83/70/74/914837074.db2.gz NCXPLTGJGWBUCN-UYAOXDASSA-N 0 3 424.520 4.029 20 0 HIADHN Cc1ccc(-c2nc3cc(F)ccc3n2C)cc1NC(=O)N1CC[C@@H]2CCN(C)C[C@H]21 ZINC000492001334 904757691 /nfs/dbraw/zinc/75/76/91/904757691.db2.gz RCBUQBLQEKFPQH-KSFYIVLOSA-N 0 3 421.520 4.246 20 0 HIADHN CCCCOc1ccc([C@H](C)NC(=O)N2CCN(C3CCCC3)CC2)cc1OC ZINC000506199525 914842987 /nfs/dbraw/zinc/84/29/87/914842987.db2.gz IKZRJHFAGXCHCE-SFHVURJKSA-N 0 3 403.567 4.205 20 0 HIADHN Cc1csc(Sc2ccc(NC(=O)N3CC[C@@H]4CCN(C)C[C@@H]43)c(C)c2)n1 ZINC000492176683 904809820 /nfs/dbraw/zinc/80/98/20/904809820.db2.gz BTZKLUFAAHFPRR-YJBOKZPZSA-N 0 3 402.589 4.469 20 0 HIADHN COC(=O)c1scc(-c2ccc(C)cc2)c1NC(=O)N[C@H](C)C1=CCN(C)CC1 ZINC000492289156 904828968 /nfs/dbraw/zinc/82/89/68/904828968.db2.gz HZRRNPRVDRGUOG-OAHLLOKOSA-N 0 3 413.543 4.282 20 0 HIADHN C[C@@H]1[C@H](NC(=O)N[C@@H](c2ccccc2)c2cccnc2)CCN1Cc1ccccc1 ZINC000492489952 904858702 /nfs/dbraw/zinc/85/87/02/904858702.db2.gz NOUDKBRSVRTMFX-FOVJLYNBSA-N 0 3 400.526 4.133 20 0 HIADHN Cn1nc(-c2cccc(C(F)(F)F)c2)cc1NC(=O)N1CCN(C2CCCC2)CC1 ZINC000492511794 904860760 /nfs/dbraw/zinc/86/07/60/904860760.db2.gz JDKMBHQHFNLWTH-UHFFFAOYSA-N 0 3 421.467 4.198 20 0 HIADHN CCCN(C)[C@H](CNC(=O)C(=O)Nc1cccc2cccnc21)c1ccc(Cl)cc1 ZINC000506232500 914855142 /nfs/dbraw/zinc/85/51/42/914855142.db2.gz MGQQDEJMILPTEA-HXUWFJFHSA-N 0 3 424.932 4.026 20 0 HIADHN COC(=O)c1c(C)csc1NC(=O)N(CCN(C)C)Cc1cccc(Cl)c1 ZINC000492989121 904976417 /nfs/dbraw/zinc/97/64/17/904976417.db2.gz DJVSLEZEYNWWBE-UHFFFAOYSA-N 0 3 409.939 4.092 20 0 HIADHN Cc1ccc([C@@H](NCC2(CCO)CCCCC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000493033460 904995146 /nfs/dbraw/zinc/99/51/46/904995146.db2.gz FOSRODGEZSNWTC-HSZRJFAPSA-N 0 3 415.599 4.410 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)c1cc2ccc(OC(F)(F)F)cc2[nH]1 ZINC000493072683 905010939 /nfs/dbraw/zinc/01/09/39/905010939.db2.gz UUQJQXZRSSMOHY-UHFFFAOYSA-N 0 3 405.420 4.271 20 0 HIADHN COc1ccc([C@@H](NCCNc2nccc(C(F)(F)F)n2)c2ccc(F)cc2)cc1 ZINC000493126830 905024887 /nfs/dbraw/zinc/02/48/87/905024887.db2.gz HLYADTJJAJNSSD-IBGZPJMESA-N 0 3 420.410 4.434 20 0 HIADHN CCC(CC)(CCO)CN[C@H](c1ccc(C)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000493134683 905029202 /nfs/dbraw/zinc/02/92/02/905029202.db2.gz ZZOHAFSJYZDFJQ-JOCHJYFZSA-N 0 3 403.588 4.266 20 0 HIADHN COC(=O)c1scc(-c2ccc(C)cc2)c1NC(=O)N1CC[C@H]2CCN(C)C[C@@H]21 ZINC000493157092 905035443 /nfs/dbraw/zinc/03/54/43/905035443.db2.gz XWJWAFQKUKNTJT-AEFFLSMTSA-N 0 3 413.543 4.068 20 0 HIADHN Cc1ccc([C@H](NC[C@]2(C)CCCC[C@@H]2O)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000493175765 905039082 /nfs/dbraw/zinc/03/90/82/905039082.db2.gz LSVSUMWKUJVZGY-VABKMULXSA-N 0 3 401.572 4.019 20 0 HIADHN CCCN(CC)CCN[C@H](c1cccc(S(C)(=O)=O)c1)c1ccc(C)cc1C ZINC000493207081 905049882 /nfs/dbraw/zinc/04/98/82/905049882.db2.gz RVPFLTXCUWMZLB-HSZRJFAPSA-N 0 3 402.604 4.118 20 0 HIADHN Cc1ccc([C@@H](NC2CC(OC(C)(C)C)C2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000493245432 905064549 /nfs/dbraw/zinc/06/45/49/905064549.db2.gz BRCJYJFQOXQLQO-QETWGEEDSA-N 0 3 401.572 4.424 20 0 HIADHN CCc1ccc([C@H](NC2CCN(C(=O)COC)CC2)c2ccccc2Cl)cc1 ZINC000493247086 905065256 /nfs/dbraw/zinc/06/52/56/905065256.db2.gz JTSQUYNIUVSZIL-QHCPKHFHSA-N 0 3 400.950 4.219 20 0 HIADHN CCN(CC)[C@H](CNC(=O)[C@H]1CCCc2sc(C)nc21)c1cccc(OC)c1 ZINC000493253074 905070547 /nfs/dbraw/zinc/07/05/47/905070547.db2.gz JIYFEUGKHUVCRG-RBUKOAKNSA-N 0 3 401.576 4.079 20 0 HIADHN Cc1cn2c(n1)[C@@H](CN[C@@H](c1ccc(C)cc1)c1cccc(S(C)(=O)=O)c1)CCC2 ZINC000493306745 905081709 /nfs/dbraw/zinc/08/17/09/905081709.db2.gz UDYNAHKAULCMPK-GGAORHGYSA-N 0 3 423.582 4.160 20 0 HIADHN CN(C)Cc1cccc(C(=O)N[C@H](c2ccccc2OC(F)F)C(F)(F)F)c1 ZINC000493572062 905165891 /nfs/dbraw/zinc/16/58/91/905165891.db2.gz GTBJAVIYPWTVQT-MRXNPFEDSA-N 0 3 402.363 4.383 20 0 HIADHN COc1cc(-c2nnc(CN[C@H]3CCC[C@@H]3CCC(C)C)o2)cc(OC)c1OC ZINC000493604269 905172325 /nfs/dbraw/zinc/17/23/25/905172325.db2.gz LCLUBAIFSLWBAB-WBVHZDCISA-N 0 3 403.523 4.457 20 0 HIADHN c1csc(-c2nn(Cc3ccccc3)cc2CN2CCC(n3cncn3)CC2)c1 ZINC000512389732 921126009 /nfs/dbraw/zinc/12/60/09/921126009.db2.gz RARIIHOGZGWZOJ-UHFFFAOYSA-N 0 3 404.543 4.089 20 0 HIADHN CC(=O)N1CCN(c2ccccc2CN[C@H](C)c2cc(Br)cs2)CC1 ZINC000493769390 905216261 /nfs/dbraw/zinc/21/62/61/905216261.db2.gz RFXMAFNRGNOIDK-CQSZACIVSA-N 0 3 422.392 4.030 20 0 HIADHN COc1cc([C@H](C)N[C@@H](C)c2cc(Br)cs2)ccc1OCCO ZINC000493810595 905224953 /nfs/dbraw/zinc/22/49/53/905224953.db2.gz AWUVCYSLXBJCCQ-RYUDHWBXSA-N 0 3 400.338 4.302 20 0 HIADHN Cc1ccc([C@H](N[C@H]2CCc3ccccc3OC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000493891071 905248220 /nfs/dbraw/zinc/24/82/20/905248220.db2.gz JVOZOAYIZPJABM-DHLKQENFSA-N 0 3 421.562 4.471 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](N[C@H]2CCc3ccccc3OC2)c2ccccc2)c1 ZINC000493892640 905250418 /nfs/dbraw/zinc/25/04/18/905250418.db2.gz XUWIGRSQHZMFSS-XUZZJYLKSA-N 0 3 407.535 4.163 20 0 HIADHN O=C(NCCc1c[nH]c2ccccc12)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000493905015 905258217 /nfs/dbraw/zinc/25/82/17/905258217.db2.gz QWDUKODDOPFDLK-QFIPXVFZSA-N 0 3 415.459 4.281 20 0 HIADHN Cc1cc(NC(=O)N2CC[C@H]3CCN(C)C[C@H]32)nn1-c1ccc(Cl)cc1Cl ZINC000493982249 905325033 /nfs/dbraw/zinc/32/50/33/905325033.db2.gz IVWYISRGFNNYBG-CXAGYDPISA-N 0 3 408.333 4.045 20 0 HIADHN C[C@H]1[C@H](NC(=O)CCCc2ncc(-c3ccccc3)o2)CCN1Cc1ccccc1 ZINC000493999415 905341632 /nfs/dbraw/zinc/34/16/32/905341632.db2.gz IVHOOMRQDRZODT-SIKLNZKXSA-N 0 3 403.526 4.444 20 0 HIADHN C[C@@H]1[C@H](NC(=O)c2ccc(OCc3ccccn3)cc2)CCN1Cc1ccccc1 ZINC000493999509 905342284 /nfs/dbraw/zinc/34/22/84/905342284.db2.gz JGLCWIQNPFHKGP-NTKDMRAZSA-N 0 3 401.510 4.053 20 0 HIADHN C[C@H]1[C@H](NC(=O)c2cn(C)nc2-c2ccc(Cl)s2)CCN1Cc1ccccc1 ZINC000494006413 905348730 /nfs/dbraw/zinc/34/87/30/905348730.db2.gz IRUYGDJFCMOXSD-WMLDXEAASA-N 0 3 414.962 4.195 20 0 HIADHN Cc1ccc([C@@H](NCC(C)(C)C[C@H](C)O)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000494019022 905357371 /nfs/dbraw/zinc/35/73/71/905357371.db2.gz GRBNSHBUBIXHAC-AVRDEDQJSA-N 0 3 403.588 4.183 20 0 HIADHN C[C@@H](O)CC(C)(C)CN[C@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000494021783 905364282 /nfs/dbraw/zinc/36/42/82/905364282.db2.gz ZVNMNVCJWIIXME-FOIQADDNSA-N 0 3 409.979 4.220 20 0 HIADHN C[C@@H]1[C@H](NC(=O)CCn2c3ccccc3nc2C2CC2)CCN1Cc1ccccc1 ZINC000494036592 905375709 /nfs/dbraw/zinc/37/57/09/905375709.db2.gz GAXKTHAHUSZUJX-WIYYLYMNSA-N 0 3 402.542 4.083 20 0 HIADHN Cn1cc([C@H](NC[C@@H](CO)Cc2ccc(C(F)(F)F)cc2)c2cccc(F)c2)cn1 ZINC000494037532 905377768 /nfs/dbraw/zinc/37/77/68/905377768.db2.gz HEZKIMSTPNIROS-HRAATJIYSA-N 0 3 421.438 4.108 20 0 HIADHN O=C(NC[C@@H]1CCCN(Cc2cccc(OC(F)F)c2)C1)Nc1cccc(F)c1 ZINC000512426118 921152833 /nfs/dbraw/zinc/15/28/33/921152833.db2.gz FBLKCRNKVWHKOW-INIZCTEOSA-N 0 3 407.436 4.461 20 0 HIADHN C[C@H](CC(=O)NCCCN1CCN(C)C[C@@H]1c1ccccc1)c1c[nH]c2ccccc21 ZINC000494312984 905627227 /nfs/dbraw/zinc/62/72/27/905627227.db2.gz OALFDFRTKRQBGY-CJFMBICVSA-N 0 3 418.585 4.157 20 0 HIADHN Cc1ccnc(-c2n[nH]c([C@H](C)N[C@@H](C)Cc3ccc(Br)c(F)c3)n2)c1 ZINC000494374218 905672157 /nfs/dbraw/zinc/67/21/57/905672157.db2.gz IXRZTYUKFKXPRI-STQMWFEESA-N 0 3 418.314 4.359 20 0 HIADHN Cc1nn(-c2ccccc2)c(Oc2ccc(F)cc2)c1CN[C@@H]1CCn2ccnc2C1 ZINC000494414636 905704136 /nfs/dbraw/zinc/70/41/36/905704136.db2.gz WPEMHTQGOOXFNU-LJQANCHMSA-N 0 3 417.488 4.413 20 0 HIADHN C[C@@H](Cn1cc(Br)cn1)N[C@H]1CSc2ccc(Br)cc21 ZINC000494485427 905767787 /nfs/dbraw/zinc/76/77/87/905767787.db2.gz RPICQXZOMNRHLA-ZANVPECISA-N 0 3 417.170 4.233 20 0 HIADHN Cc1ccc(N[C@@H]2CCN(Cc3ccccn3)C[C@@H]2C)cc1C(=O)N1CCCCC1 ZINC000494484315 905768638 /nfs/dbraw/zinc/76/86/38/905768638.db2.gz PURBTVRUGGXLOG-GBXCKJPGSA-N 0 3 406.574 4.339 20 0 HIADHN Cc1ccc(NC(=O)NC(=O)[C@H](C)N[C@@H]2CCO[C@H]2c2ccc(Cl)cc2)c(C)c1 ZINC000494493157 905779348 /nfs/dbraw/zinc/77/93/48/905779348.db2.gz HZVNNNXYJPMCSD-BEVDRBHNSA-N 0 3 415.921 4.113 20 0 HIADHN COC[C@@H](N[C@H](C)CC(=O)Nc1ccc(OC)cc1OC)c1ccc(Cl)cc1 ZINC000494510858 905801890 /nfs/dbraw/zinc/80/18/90/905801890.db2.gz PFAJOJAUWDBFNU-AUUYWEPGSA-N 0 3 406.910 4.052 20 0 HIADHN C[C@H](NCc1ccnc(Oc2ccccc2F)c1)c1ccc(NS(C)(=O)=O)cc1 ZINC000494527340 905812176 /nfs/dbraw/zinc/81/21/76/905812176.db2.gz NDNXSYZUILWXLW-HNNXBMFYSA-N 0 3 415.490 4.235 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)Nc2nc(C3CCOCC3)cs2)CC1 ZINC000494551659 905829906 /nfs/dbraw/zinc/82/99/06/905829906.db2.gz CIIADDOPSKIAAS-UHFFFAOYSA-N 0 3 414.575 4.165 20 0 HIADHN COC(=O)c1ccc(CN[C@@H]2CCc3cc(Br)cc(C)c32)cc1OC ZINC000494606892 905860180 /nfs/dbraw/zinc/86/01/80/905860180.db2.gz YAASIASIQGUAKW-QGZVFWFLSA-N 0 3 404.304 4.330 20 0 HIADHN O=C(Nc1scnc1-c1ccccc1)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000494663108 905889302 /nfs/dbraw/zinc/88/93/02/905889302.db2.gz CVIINVPCSLIYFO-UHFFFAOYSA-N 0 3 407.539 4.267 20 0 HIADHN Cc1nn(C(C)(C)C)c(C)c1CN1CCC[C@H](CNC(=O)Nc2cccc(F)c2)C1 ZINC000512478734 921188359 /nfs/dbraw/zinc/18/83/59/921188359.db2.gz DNZGXPLYKMNNCB-GOSISDBHSA-N 0 3 415.557 4.428 20 0 HIADHN C[C@H]1CN(C2CCOCC2)CCN1C(=O)N[C@H](CCc1ccccc1)c1ccccc1 ZINC000494703994 905909888 /nfs/dbraw/zinc/90/98/88/905909888.db2.gz PFHLZQKDFQPEHV-SQJMNOBHSA-N 0 3 421.585 4.255 20 0 HIADHN CCCn1nc(C)c(CN2CCC[C@H](CNC(=O)Nc3cccc(F)c3)C2)c1C ZINC000512479393 921190117 /nfs/dbraw/zinc/19/01/17/921190117.db2.gz GLAKJZATPQRXIU-GOSISDBHSA-N 0 3 401.530 4.083 20 0 HIADHN Cc1ccc([C@@H](NCC(C)(C)[C@H](O)C(C)C)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000494715191 905919181 /nfs/dbraw/zinc/91/91/81/905919181.db2.gz MPYFWOZLFZDMMZ-XZOQPEGZSA-N 0 3 417.615 4.429 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)c1ccnc(SCC(F)(F)F)c1 ZINC000494747656 905947011 /nfs/dbraw/zinc/94/70/11/905947011.db2.gz RXLTWDTYDRTJAQ-UHFFFAOYSA-N 0 3 415.456 4.079 20 0 HIADHN Cc1nn(C)c(OCC(F)(F)F)c1CNCCn1ccc2cc(Cl)ccc21 ZINC000512497400 921200835 /nfs/dbraw/zinc/20/08/35/921200835.db2.gz UTQKZRORJZPSOR-UHFFFAOYSA-N 0 3 400.832 4.068 20 0 HIADHN Cc1cc(NC(=O)NC2CCN(CCOC(C)C)CC2)cc(C)c1Br ZINC000494874464 906054497 /nfs/dbraw/zinc/05/44/97/906054497.db2.gz BMVAFHLLDKBAEM-UHFFFAOYSA-N 0 3 412.372 4.077 20 0 HIADHN COc1ccc(CN2CCCN(C(=O)c3cc(-c4ccc(C)cc4C)[nH]n3)CC2)cc1 ZINC000494896600 906070870 /nfs/dbraw/zinc/07/08/70/906070870.db2.gz YILYBWYZVSUZEL-UHFFFAOYSA-N 0 3 418.541 4.050 20 0 HIADHN O=C(Nc1cccc(Br)c1)C1CCN(C/C=C\c2ccncc2)CC1 ZINC000494927782 906098707 /nfs/dbraw/zinc/09/87/07/906098707.db2.gz BCYGUNLRKRCXFR-IHWYPQMZSA-N 0 3 400.320 4.208 20 0 HIADHN COC(=O)c1csc(-c2cccc(CN[C@@H](C)c3ccc(C(=O)N(C)C)cc3)c2)n1 ZINC000494936264 906107833 /nfs/dbraw/zinc/10/78/33/906107833.db2.gz ZGVNSZWLYLBOIS-HNNXBMFYSA-N 0 3 423.538 4.149 20 0 HIADHN CC1(C)C[C@H](N[C@@H](c2ccc(Cl)cc2)c2cccc(S(C)(=O)=O)c2)CCO1 ZINC000494945584 906118483 /nfs/dbraw/zinc/11/84/83/906118483.db2.gz AVPJBLBTRMPKSW-QUCCMNQESA-N 0 3 407.963 4.380 20 0 HIADHN CCN(C(=O)N[C@H](C)[C@H]1OCCc2sccc21)[C@H]1CCN(Cc2ccccc2)C1 ZINC000494952352 906123172 /nfs/dbraw/zinc/12/31/72/906123172.db2.gz OVZOHHQUWVEIAI-ZWCUEREDSA-N 0 3 413.587 4.056 20 0 HIADHN C[C@H](NCc1cc2cc(Br)ccc2[nH]1)c1ccc(C(=O)N(C)C)cc1 ZINC000494956189 906127600 /nfs/dbraw/zinc/12/76/00/906127600.db2.gz IPDRJHMZZDCXKK-ZDUSSCGKSA-N 0 3 400.320 4.483 20 0 HIADHN COc1ccc([C@H](N[C@H]2CCO[C@@]3(CCOC3)C2)c2ccccc2Cl)cc1OC ZINC000495045526 906201581 /nfs/dbraw/zinc/20/15/81/906201581.db2.gz HQSPWWDNXGBHOY-RTFZILSDSA-N 0 3 417.933 4.374 20 0 HIADHN COc1cc(CN[C@H](C)c2ccc(C(=O)N(C)C)cc2)cc(Br)c1OC ZINC000495063460 906215630 /nfs/dbraw/zinc/21/56/30/906215630.db2.gz BNAHLOIXFPILBH-CYBMUJFWSA-N 0 3 421.335 4.019 20 0 HIADHN O=C(CN[C@@H](C[C@@H]1CCOC1)c1ccc(F)cc1)N1CCC(Cc2ccccc2)CC1 ZINC000495081080 906227617 /nfs/dbraw/zinc/22/76/17/906227617.db2.gz SNEJNJHUPNSHRM-DHLKQENFSA-N 0 3 424.560 4.364 20 0 HIADHN Cc1ccccc1NC(=O)C[C@H](C)N[C@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O ZINC000495181160 906289931 /nfs/dbraw/zinc/28/99/31/906289931.db2.gz CFKHJSWTRZDHKL-LIRRHRJNSA-N 0 3 420.340 4.414 20 0 HIADHN CN(C)Cc1cccc(NC(=O)c2cc(=O)[nH]c3c(Br)cccc23)c1 ZINC000495215594 906313494 /nfs/dbraw/zinc/31/34/94/906313494.db2.gz QZGPVCQAYWEYBJ-UHFFFAOYSA-N 0 3 400.276 4.017 20 0 HIADHN CC(C)C[C@H](NC(=O)N1CCN(C2CCOCC2)C[C@@H]1C)c1ccc(Cl)cc1 ZINC000495253973 906342056 /nfs/dbraw/zinc/34/20/56/906342056.db2.gz XELSIIRNSWLAGP-UWJYYQICSA-N 0 3 407.986 4.322 20 0 HIADHN Cc1ccc2cccc(NC(=O)N(C)C3CCN(CCc4ccccn4)CC3)c2n1 ZINC000512548306 921229097 /nfs/dbraw/zinc/22/90/97/921229097.db2.gz AGJZVAGRZJESDI-UHFFFAOYSA-N 0 3 403.530 4.109 20 0 HIADHN COc1cc(NC(=O)N(CCN(C)C)Cc2cccs2)cc(OC)c1C(C)C ZINC000495304522 906366922 /nfs/dbraw/zinc/36/69/22/906366922.db2.gz HABFWJIOTQHSBD-UHFFFAOYSA-N 0 3 405.564 4.484 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)Cc2c[nH]c3cccc(Cl)c23)cc1 ZINC000495344901 906391544 /nfs/dbraw/zinc/39/15/44/906391544.db2.gz FNJYSHBAUQJNPA-OAQYLSRUSA-N 0 3 411.933 4.326 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CN1CCC(c2nc(-c3ccccn3)no2)CC1 ZINC000512552957 921231775 /nfs/dbraw/zinc/23/17/75/921231775.db2.gz WOSZQBVUXAROBT-UHFFFAOYSA-N 0 3 414.513 4.314 20 0 HIADHN COc1cccc([C@@H]2[C@H](N[C@@H](C)c3cc(OC)c(OC)cc3F)CCN2C2CC2)c1 ZINC000495407939 906432295 /nfs/dbraw/zinc/43/22/95/906432295.db2.gz KFVULJABNFLJID-BXKTYXQLSA-N 0 3 414.521 4.480 20 0 HIADHN Cc1ccc(-c2ccsc2C(=O)NCc2ccc(CN3CCN(C)CC3)cc2)cc1 ZINC000495502318 906491831 /nfs/dbraw/zinc/49/18/31/906491831.db2.gz PUPQUFGJNLJGIS-UHFFFAOYSA-N 0 3 419.594 4.401 20 0 HIADHN C[C@H](NC1CCN(CC(=O)Nc2ccccc2)CC1)c1ccccc1Br ZINC000495595286 906510719 /nfs/dbraw/zinc/51/07/19/906510719.db2.gz WJBMBMKWGGLFKC-INIZCTEOSA-N 0 3 416.363 4.203 20 0 HIADHN Cc1ccc(-c2cc(C(=O)N(CCN(C)C)C(C)C)c3cnn(C(C)C)c3n2)s1 ZINC000496028683 906600510 /nfs/dbraw/zinc/60/05/10/906600510.db2.gz NHRCVOCJDMNWKI-UHFFFAOYSA-N 0 3 413.591 4.461 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)Nc1cnn(C)c1-c1ccccc1 ZINC000496841232 906765840 /nfs/dbraw/zinc/76/58/40/906765840.db2.gz RSAILJYWFCKXGD-UHFFFAOYSA-N 0 3 405.546 4.115 20 0 HIADHN COc1ccc([C@@H]2CCCN2C[C@H](O)CO[C@H]2CCCc3ccccc32)cc1OC ZINC000497096233 906805613 /nfs/dbraw/zinc/80/56/13/906805613.db2.gz HXHVGNOXJJPUDE-PMVMPFDFSA-N 0 3 411.542 4.296 20 0 HIADHN COc1ccc(OC(F)F)c(CN[C@H]2CCCN(Cc3c(F)cccc3F)C2)c1 ZINC000497319171 906832828 /nfs/dbraw/zinc/83/28/28/906832828.db2.gz FRKFLPYUWHTKCY-HNNXBMFYSA-N 0 3 412.427 4.329 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)c2ccc(Br)cc2Cl)CC1 ZINC000497353943 906847438 /nfs/dbraw/zinc/84/74/38/906847438.db2.gz XTGOTLUXDLKPKG-UHFFFAOYSA-N 0 3 411.727 4.432 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)CCc2cccc(Br)c2)CC1 ZINC000497353408 906847665 /nfs/dbraw/zinc/84/76/65/906847665.db2.gz HRQRFIHWYZJBON-UHFFFAOYSA-N 0 3 405.336 4.098 20 0 HIADHN CC(C)(C)C(=O)NC[C@H]1CCCN(Cc2ccc(C(=O)Nc3ccccc3)cc2)C1 ZINC000497372371 906861522 /nfs/dbraw/zinc/86/15/22/906861522.db2.gz SQPLPZOQHNTNOP-HXUWFJFHSA-N 0 3 407.558 4.313 20 0 HIADHN CO[C@H]1CCC[C@@H](C(=O)Nc2cccc(N3CCN(CCc4ccccc4)CC3)c2)C1 ZINC000497398552 906880367 /nfs/dbraw/zinc/88/03/67/906880367.db2.gz FQHKIIGKHKHSIG-RDGATRHJSA-N 0 3 421.585 4.195 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)c2cccc(OCc3csc(C)n3)c2)o1 ZINC000497399307 906880531 /nfs/dbraw/zinc/88/05/31/906880531.db2.gz AKEURMGLGIGZLM-UHFFFAOYSA-N 0 3 413.543 4.136 20 0 HIADHN COc1ccc(CNC(=O)C2CCN(Cc3c(C)cc(Cl)cc3C)CC2)cc1 ZINC000512651883 921275138 /nfs/dbraw/zinc/27/51/38/921275138.db2.gz DJSRFCGWNLHZEB-UHFFFAOYSA-N 0 3 400.950 4.494 20 0 HIADHN Cc1cc(C(=O)N[C@H]2CN(C)C[C@H]2c2ccccc2)ccc1NC(=O)c1cccs1 ZINC000497416818 906892223 /nfs/dbraw/zinc/89/22/23/906892223.db2.gz LLOALBYXTNYFGT-FPOVZHCZSA-N 0 3 419.550 4.136 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccc(F)c2)C1)N1CCC(OC2CCCCC2)CC1 ZINC000497474541 906955970 /nfs/dbraw/zinc/95/59/70/906955970.db2.gz VXWGSKNHTJDRCV-HXUWFJFHSA-N 0 3 402.554 4.378 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N[C@@H](C)c2cc(F)c(Cl)cc2Cl)CC1 ZINC000497496468 906981396 /nfs/dbraw/zinc/98/13/96/906981396.db2.gz PRMSDOPVZNOALQ-ZDUSSCGKSA-N 0 3 420.356 4.382 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N[C@H](C)c2cc(F)c(Cl)cc2Cl)CC1 ZINC000497496465 906981861 /nfs/dbraw/zinc/98/18/61/906981861.db2.gz PRMSDOPVZNOALQ-CYBMUJFWSA-N 0 3 420.356 4.382 20 0 HIADHN FC(F)(F)COc1ccc(CCNCc2ccc(Sc3ccccn3)o2)cn1 ZINC000512673930 921283501 /nfs/dbraw/zinc/28/35/01/921283501.db2.gz RYMZIRILZZOUNM-UHFFFAOYSA-N 0 3 409.433 4.494 20 0 HIADHN COc1cc(CN2CCC[C@@H](CCC(N)=O)C2)ccc1OCc1ccc(Cl)cc1 ZINC000512685224 921286476 /nfs/dbraw/zinc/28/64/76/921286476.db2.gz ASKFXDGPQXAJFV-KRWDZBQOSA-N 0 3 416.949 4.405 20 0 HIADHN Cc1nc2c(s1)[C@H](N(C)C(=O)[C@@H]1CN(Cc3ccccc3)CCC1(F)F)CCC2 ZINC000512689997 921288545 /nfs/dbraw/zinc/28/85/45/921288545.db2.gz KKAOQBDTDSAYAE-PKOBYXMFSA-N 0 3 419.541 4.445 20 0 HIADHN NC(=O)CC[C@@H]1CCCN(Cc2cnc(-c3ccc(Br)cc3)s2)C1 ZINC000512692633 921289403 /nfs/dbraw/zinc/28/94/03/921289403.db2.gz GNNFLNWQSRCEOU-ZDUSSCGKSA-N 0 3 408.365 4.050 20 0 HIADHN CCOc1ccc(OC[C@H](O)CN2CC=C(c3c[nH]c4ccc(OC)cc43)CC2)cc1 ZINC000497597260 907076883 /nfs/dbraw/zinc/07/68/83/907076883.db2.gz YHYZQQSAMCWICI-LJQANCHMSA-N 0 3 422.525 4.104 20 0 HIADHN CC(C)(C)[C@H](CN1CCc2ccccc2C1)NC(=O)N1CCCC[C@@H]1c1cc[nH]n1 ZINC000497610028 907089619 /nfs/dbraw/zinc/08/96/19/907089619.db2.gz LXVVVENPXHQTPQ-YADHBBJMSA-N 0 3 409.578 4.119 20 0 HIADHN CCOC1CC2(C1)CCN(C(=O)N[C@@H](CN1CCc3ccccc3C1)C(C)(C)C)C2 ZINC000497617440 907094777 /nfs/dbraw/zinc/09/47/77/907094777.db2.gz QOCVUWYSCXMSDA-YGWFNULRSA-N 0 3 413.606 4.060 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)N[C@H](c3cccc(F)c3)c3cccc(Cl)c3)[C@@H]2C1 ZINC000497619047 907098145 /nfs/dbraw/zinc/09/81/45/907098145.db2.gz WGWATWJUHJEZCO-LPTQZCDUSA-N 0 3 401.913 4.304 20 0 HIADHN Cc1ccc(C[C@H](NC(=O)N[C@@H](CN(C)C)c2ccc(F)cc2)c2ccccn2)cc1 ZINC000497635202 907117843 /nfs/dbraw/zinc/11/78/43/907117843.db2.gz XYSAHUQKLDXZSO-ZEQRLZLVSA-N 0 3 420.532 4.415 20 0 HIADHN CS[C@H]1CN(C(=O)Nc2ccc(Sc3nc(C)cs3)cc2)C[C@H]1N(C)C ZINC000497674658 907177503 /nfs/dbraw/zinc/17/75/03/907177503.db2.gz AYAVZYNDBAAMNH-CVEARBPZSA-N 0 3 408.618 4.112 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1CCN(Cc2ccccc2)[C@@H]1C)c1ncc(-c2ccccc2)o1 ZINC000497724192 907222283 /nfs/dbraw/zinc/22/22/83/907222283.db2.gz ADYZRXZANGGIIW-WAOWUJCRSA-N 0 3 404.514 4.365 20 0 HIADHN C[C@H](NC(=O)N[C@H]1CCN(Cc2ccccc2)[C@H]1C)c1ncc(-c2ccccc2)o1 ZINC000497724193 907223685 /nfs/dbraw/zinc/22/36/85/907223685.db2.gz ADYZRXZANGGIIW-WFXMLNOXSA-N 0 3 404.514 4.365 20 0 HIADHN Cc1ccc([C@H](OC[C@@H](O)CN(C)Cc2ccc3c(c2)OCO3)c2ccccc2)cc1 ZINC000497731033 907228813 /nfs/dbraw/zinc/22/88/13/907228813.db2.gz ZFVGOXGCGIWZGH-JYFHCDHNSA-N 0 3 419.521 4.323 20 0 HIADHN O[C@H](CO[C@H]1CCCc2ccccc21)CN(Cc1cccc(F)c1)C[C@@H]1CCCO1 ZINC000497736171 907234282 /nfs/dbraw/zinc/23/42/82/907234282.db2.gz RPPSPFALYCTUTF-LSQMVHIFSA-N 0 3 413.533 4.262 20 0 HIADHN CCc1ccc([C@H](CNC(=O)c2ccccc2SCc2nc(C)no2)N(C)C)cc1 ZINC000497804489 907290382 /nfs/dbraw/zinc/29/03/82/907290382.db2.gz FJTKQRQRBGMWEL-FQEVSTJZSA-N 0 3 424.570 4.265 20 0 HIADHN C[C@@H]1CN(CCCN[C@@H](c2ccco2)c2ccc(Br)cc2)C[C@H](C)O1 ZINC000497830164 907312012 /nfs/dbraw/zinc/31/20/12/907312012.db2.gz YGXNVGVFIPHVLG-GQIGUUNPSA-N 0 3 407.352 4.220 20 0 HIADHN CCCCOC1CCN(C(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)CC1 ZINC000512807694 921315721 /nfs/dbraw/zinc/31/57/21/921315721.db2.gz JHXBKGZMGBJXGI-QFIPXVFZSA-N 0 3 405.583 4.067 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)Cc3ccccc3OC(C)C)CC2)c1 ZINC000497945311 907413577 /nfs/dbraw/zinc/41/35/77/907413577.db2.gz WAFASOIHWYQFQR-UHFFFAOYSA-N 0 3 423.601 4.043 20 0 HIADHN Cc1cccc([C@H](NC(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)c2ccccn2)c1 ZINC000497958589 907430562 /nfs/dbraw/zinc/43/05/62/907430562.db2.gz PXNZVRVEWKNZSX-KMDXXIMOSA-N 0 3 400.526 4.224 20 0 HIADHN CCN(C(=O)c1ccc(N2CCCC2=O)cc1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000497966879 907435072 /nfs/dbraw/zinc/43/50/72/907435072.db2.gz SAVYVEQXZHRHRC-WMZHIEFXSA-N 0 3 405.542 4.111 20 0 HIADHN Cc1oc(-c2ccco2)nc1CC(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1 ZINC000497993339 907472319 /nfs/dbraw/zinc/47/23/19/907472319.db2.gz MEKNIRZFBWPRQW-SFHVURJKSA-N 0 3 413.543 4.436 20 0 HIADHN CCN(C(=O)CSCc1c(C)noc1C)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000498004709 907492269 /nfs/dbraw/zinc/49/22/69/907492269.db2.gz PMVIDYAUHCWNTC-YLJYHZDGSA-N 0 3 401.576 4.209 20 0 HIADHN CCOC1CC2(C1)CCN(CC(=O)N(CCc1ccccc1)Cc1ccccc1)C2 ZINC000512823762 921328115 /nfs/dbraw/zinc/32/81/15/921328115.db2.gz MRQSEPMDVVMYOA-UHFFFAOYSA-N 0 3 406.570 4.149 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)NCc2coc(-c3ccccc3)n2)N(C)C)cc1 ZINC000498033482 907537779 /nfs/dbraw/zinc/53/77/79/907537779.db2.gz VFSAGMHWQLINDP-QFIPXVFZSA-N 0 3 422.529 4.231 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)c3cc(NCc4ccccc4)nc4ccccc43)[C@@H]2C1 ZINC000498105419 907612454 /nfs/dbraw/zinc/61/24/54/907612454.db2.gz KLIUAGIIKXEYLK-AUSIDOKSSA-N 0 3 400.526 4.013 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)c1ccc(OCc2ccccc2)nc1 ZINC000498120883 907632785 /nfs/dbraw/zinc/63/27/85/907632785.db2.gz JSDMSJZZLXFMRG-UHFFFAOYSA-N 0 3 407.489 4.004 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)c1cccc2ncccc21 ZINC000498124800 907639964 /nfs/dbraw/zinc/63/99/64/907639964.db2.gz IBFIDPDLWNMHEL-UHFFFAOYSA-N 0 3 401.432 4.458 20 0 HIADHN Cc1cc(C(=O)NCCCCN2CCN(c3cccc(C(F)(F)F)c3)CC2)c(C)o1 ZINC000498153944 907679780 /nfs/dbraw/zinc/67/97/80/907679780.db2.gz PFOSPDSGOCNCPK-UHFFFAOYSA-N 0 3 423.479 4.247 20 0 HIADHN O=C(N[C@H](c1cccc(F)c1)c1ccccn1)N[C@H](CN1CCCC1)c1ccccc1 ZINC000498237007 907770388 /nfs/dbraw/zinc/77/03/88/907770388.db2.gz BUKUKINPLGVKFM-DNQXCXABSA-N 0 3 418.516 4.446 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)NCCc2csc(C(C)(C)C)n2)C1 ZINC000498240852 907776276 /nfs/dbraw/zinc/77/62/76/907776276.db2.gz WQIJLWFKFYUTJA-WMZOPIPTSA-N 0 3 400.592 4.118 20 0 HIADHN COc1ccc(F)cc1[C@H](C)NC(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000498273439 907810277 /nfs/dbraw/zinc/81/02/77/907810277.db2.gz BPEBFVFPAUEFOW-YCRPNKLZSA-N 0 3 424.438 4.466 20 0 HIADHN C[C@@H](NCc1ccc(OCc2c(F)cccc2Cl)cc1)C1(S(C)(=O)=O)CC1 ZINC000512852324 921357042 /nfs/dbraw/zinc/35/70/42/921357042.db2.gz ULYXYOXKIOQXHM-CQSZACIVSA-N 0 3 411.926 4.113 20 0 HIADHN CCOc1cccc2c1OCC(C(=O)NC[C@H](c1ccsc1)N(CC)CC)=C2 ZINC000498370012 907861693 /nfs/dbraw/zinc/86/16/93/907861693.db2.gz ZTZRUTFNYWFFFO-LJQANCHMSA-N 0 3 400.544 4.122 20 0 HIADHN CCC(CC)[C@@H]1C[C@@H](NC(=O)N(CCN(C)C)Cc2cccc(Cl)c2)CCO1 ZINC000498392400 907876701 /nfs/dbraw/zinc/87/67/01/907876701.db2.gz QJZYDIMTYSUKFF-SFTDATJTSA-N 0 3 410.002 4.397 20 0 HIADHN CCC(CC)[C@@H]1C[C@H](NC(=O)N(Cc2ccccc2)C2CCN(C)CC2)CCO1 ZINC000498396944 907879400 /nfs/dbraw/zinc/87/94/00/907879400.db2.gz OLHDQTQWRUMRBB-GGAORHGYSA-N 0 3 401.595 4.276 20 0 HIADHN CCC(CC)[C@@H]1C[C@@H](NC(=O)N(Cc2ccccc2)C2CCN(C)CC2)CCO1 ZINC000498396945 907879717 /nfs/dbraw/zinc/87/97/17/907879717.db2.gz OLHDQTQWRUMRBB-GMAHTHKFSA-N 0 3 401.595 4.276 20 0 HIADHN c1c2ccccc2oc1[C@@H](NCCCc1nnc2n1CCCCC2)c1cccnc1 ZINC000498414125 907890092 /nfs/dbraw/zinc/89/00/92/907890092.db2.gz NPFAIXOXXXOVIJ-DEOSSOPVSA-N 0 3 401.514 4.458 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)CCCc2ncc(-c3ccccc3)o2)CC1 ZINC000498450754 907913119 /nfs/dbraw/zinc/91/31/19/907913119.db2.gz DLCXJQXNFHHBPY-UHFFFAOYSA-N 0 3 407.514 4.380 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N[C@H](C)c2ccc(F)c3ccccc32)CC1 ZINC000498596876 908045426 /nfs/dbraw/zinc/04/54/26/908045426.db2.gz XNIYMLAGGNLRCY-QGZVFWFLSA-N 0 3 401.526 4.229 20 0 HIADHN CC(C)c1ccc(CN2CCN(C(=O)c3cccc(CN4CCCC4)c3)CC2)cc1 ZINC000498600922 908050746 /nfs/dbraw/zinc/05/07/46/908050746.db2.gz XPQPEOGSCWPQFL-UHFFFAOYSA-N 0 3 405.586 4.364 20 0 HIADHN Cc1ccc(-c2nn(Cc3ccccc3)cc2C(=O)N2CCN(C)CC[C@@H]2C)cc1 ZINC000498705548 908131373 /nfs/dbraw/zinc/13/13/73/908131373.db2.gz ARKGMPOKFGMHBB-FQEVSTJZSA-N 0 3 402.542 4.073 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1 ZINC000498709806 908136671 /nfs/dbraw/zinc/13/66/71/908136671.db2.gz BQNKHNYNGNOFND-RBUKOAKNSA-N 0 3 419.338 4.282 20 0 HIADHN Cc1cccc(-c2nn(-c3ccc(F)cc3)cc2C(=O)N2CCN(C)CC[C@H]2C)c1 ZINC000498725684 908151812 /nfs/dbraw/zinc/15/18/12/908151812.db2.gz IUSCPDQDSKOWLF-GOSISDBHSA-N 0 3 406.505 4.153 20 0 HIADHN CCCO[C@H]1CCCN(C(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)CC1 ZINC000512903379 921395904 /nfs/dbraw/zinc/39/59/04/921395904.db2.gz YUDPHJJKJHZPKS-UNMCSNQZSA-N 0 3 405.583 4.067 20 0 HIADHN CCN1C[C@@H](C)N(CC(=O)Nc2nc(-c3c(C)cc(C)cc3C)cs2)C[C@H]1C ZINC000498910054 908319233 /nfs/dbraw/zinc/31/92/33/908319233.db2.gz BRIGKSXMYFKJLY-QZTJIDSGSA-N 0 3 400.592 4.088 20 0 HIADHN CC[C@H](C)Sc1ccc(NC(=O)C(=O)NC[C@H](C)N2CCC[C@@H](C)C2)c(C)c1 ZINC000498948029 908351601 /nfs/dbraw/zinc/35/16/01/908351601.db2.gz AQDWFZNGESKBEN-NJAFHUGGSA-N 0 3 405.608 4.061 20 0 HIADHN Cc1cccc([C@@H](NC(=O)N(CCN(C)C)Cc2ccccc2)c2ccccn2)c1 ZINC000499013021 908388858 /nfs/dbraw/zinc/38/88/58/908388858.db2.gz JTXLQNLPNABKQH-XMMPIXPASA-N 0 3 402.542 4.253 20 0 HIADHN Cc1cccc([C@H](NC(=O)N(CCN(C)C)Cc2cccs2)c2ccccn2)c1 ZINC000499020504 908395870 /nfs/dbraw/zinc/39/58/70/908395870.db2.gz FBMBVYUNNVRWTI-QFIPXVFZSA-N 0 3 408.571 4.314 20 0 HIADHN Cc1cccc([C@@H](NC(=O)N(CCN(C)C)Cc2cccc(F)c2)c2ccccn2)c1 ZINC000499029176 908404155 /nfs/dbraw/zinc/40/41/55/908404155.db2.gz PVOCGOJGGVNJPT-XMMPIXPASA-N 0 3 420.532 4.392 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)Nc1ccc(Cl)cc1Cl)c1ccc(-n2cncn2)cc1 ZINC000499074824 908440570 /nfs/dbraw/zinc/44/05/70/908440570.db2.gz YJVSWFSHZVHKSH-OLZOCXBDSA-N 0 3 404.301 4.252 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)N(C)[C@H](C)Cc2ccc(O)cc2)N(C)C)cc1 ZINC000512916613 921410221 /nfs/dbraw/zinc/41/02/21/921410221.db2.gz DXDKNMYGDWZLPI-JPYJTQIMSA-N 0 3 413.562 4.055 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)N[C@@H](c2cccc(F)c2)c2ccccn2)N(C)C)cc1 ZINC000499086187 908449087 /nfs/dbraw/zinc/44/90/87/908449087.db2.gz YBMOCKDJZBECIR-RPWUZVMVSA-N 0 3 420.532 4.475 20 0 HIADHN CN1CCC(CCO)(NC(=O)c2sc3cc(Cl)cc(Cl)c3c2Cl)CC1 ZINC000499121716 908478114 /nfs/dbraw/zinc/47/81/14/908478114.db2.gz MDOPMOOEBODLFX-UHFFFAOYSA-N 0 3 421.777 4.438 20 0 HIADHN Cc1ccc(-n2ncc(C(=O)NC[C@H](C)N3CCC(C)CC3)c2C(F)(F)F)cc1 ZINC000499132755 908489715 /nfs/dbraw/zinc/48/97/15/908489715.db2.gz ABZLNRTYIWOZES-INIZCTEOSA-N 0 3 408.468 4.050 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)c1cc2c(cccc2OC(F)F)[nH]1 ZINC000499370042 908737771 /nfs/dbraw/zinc/73/77/71/908737771.db2.gz RMBDTMPACLCHMF-UHFFFAOYSA-N 0 3 423.410 4.252 20 0 HIADHN Cc1cn(-c2ccccc2Cl)nc1C(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000499369278 908738052 /nfs/dbraw/zinc/73/80/52/908738052.db2.gz OPTTUQHWPQLFHS-PKOBYXMFSA-N 0 3 408.933 4.399 20 0 HIADHN CC(=O)c1cccc(OCCCC(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)c1 ZINC000499400794 908763700 /nfs/dbraw/zinc/76/37/00/908763700.db2.gz RSFKUZUBJXYRHQ-XMMPIXPASA-N 0 3 408.542 4.310 20 0 HIADHN COc1ccc(C(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)cc1Br ZINC000499402028 908765095 /nfs/dbraw/zinc/76/50/95/908765095.db2.gz ZOTOYCMTDNTGSG-LJQANCHMSA-N 0 3 417.347 4.333 20 0 HIADHN Cc1cc(C)n(Cc2ccc(C(=O)NC[C@@H](c3ccc(C)cc3)N3CCCC3)cc2)n1 ZINC000499406073 908771004 /nfs/dbraw/zinc/77/10/04/908771004.db2.gz UPAICALBWIRWLU-VWLOTQADSA-N 0 3 416.569 4.424 20 0 HIADHN CN(C(=O)c1c[nH]nc1-c1ccc(Cl)cc1)C1CCN(Cc2ccccc2)CC1 ZINC000499644959 908864079 /nfs/dbraw/zinc/86/40/79/908864079.db2.gz ADMYVODXSBVXNR-UHFFFAOYSA-N 0 3 408.933 4.467 20 0 HIADHN Cc1nn(-c2ccccc2)c(Oc2ccc(F)cc2)c1CNCCn1ccnc1C ZINC000499664301 908869610 /nfs/dbraw/zinc/86/96/10/908869610.db2.gz NOXQVAPEWMKVSK-UHFFFAOYSA-N 0 3 405.477 4.407 20 0 HIADHN O=C1[C@H](NCc2cccc(OCc3ccc(F)cc3)c2)CCCN1CC(F)(F)F ZINC000499698684 908880100 /nfs/dbraw/zinc/88/01/00/908880100.db2.gz CTICIBNNEJBILS-LJQANCHMSA-N 0 3 410.411 4.048 20 0 HIADHN Cc1nn2c(CNCCc3nc(-c4cccc(Cl)c4)no3)c(C(C)C)nc2s1 ZINC000499707553 908884087 /nfs/dbraw/zinc/88/40/87/908884087.db2.gz VHKXLBSBYJZKGC-UHFFFAOYSA-N 0 3 416.938 4.258 20 0 HIADHN COc1cc(CNCCn2cc(Br)cn2)ccc1OCc1ccccc1 ZINC000512977509 921448913 /nfs/dbraw/zinc/44/89/13/921448913.db2.gz NIGHLNOICCUUAA-UHFFFAOYSA-N 0 3 416.319 4.023 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)c1cccc([C@@H]2CCCOC2)c1 ZINC000499724569 908891257 /nfs/dbraw/zinc/89/12/57/908891257.db2.gz IGTJSSTXROEJSO-HXUWFJFHSA-N 0 3 402.485 4.063 20 0 HIADHN O=C(NCc1ccc(OC2CCCC2)nc1)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000499801320 908934534 /nfs/dbraw/zinc/93/45/34/908934534.db2.gz OVJKLMDYXCXKOS-QFIPXVFZSA-N 0 3 408.546 4.039 20 0 HIADHN COc1ccc(C(=O)CCCC(=O)N(C)C[C@@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000499850333 908984065 /nfs/dbraw/zinc/98/40/65/908984065.db2.gz SKDMZZBOYKSVOD-NRFANRHFSA-N 0 3 408.542 4.029 20 0 HIADHN CCS(=O)(=O)c1ccc(N2CCC(NCc3cc(Cl)ccc3F)CC2)cc1 ZINC000512994930 921461902 /nfs/dbraw/zinc/46/19/02/921461902.db2.gz ZLTJTRBOSNELAT-UHFFFAOYSA-N 0 3 410.942 4.031 20 0 HIADHN C[C@@H]1CCC[C@H](OCCCCCC(=O)N2CCC(CN3C[C@@H](C)O[C@H](C)C3)CC2)C1 ZINC000499930471 909037473 /nfs/dbraw/zinc/03/74/73/909037473.db2.gz MQLUMMSJZATFCH-AZKZNFPZSA-N 0 3 422.654 4.490 20 0 HIADHN CN(C(=O)Nc1nc2c(ccc(F)c2F)s1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000499968480 909413511 /nfs/dbraw/zinc/41/35/11/909413511.db2.gz QSOULHGUQIBIPY-AWEZNQCLSA-N 0 3 402.470 4.313 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)Nc1nc2c(ccc(F)c2F)s1 ZINC000500041139 909504525 /nfs/dbraw/zinc/50/45/25/909504525.db2.gz WDTBFMSXOJYZBM-UHFFFAOYSA-N 0 3 408.449 4.309 20 0 HIADHN COc1cc(Br)cc(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2)c1 ZINC000500044079 909506161 /nfs/dbraw/zinc/50/61/61/909506161.db2.gz YTAAAXBEWNZYNP-UHFFFAOYSA-N 0 3 424.314 4.193 20 0 HIADHN CN(C(=O)c1ccc(-c2ccccc2F)o1)C1CCN(CCc2ccccn2)CC1 ZINC000500060580 909524607 /nfs/dbraw/zinc/52/46/07/909524607.db2.gz FGDNKFGOHVXMMO-UHFFFAOYSA-N 0 3 407.489 4.260 20 0 HIADHN CN(C(=O)c1cc(-c2ccc(Cl)cc2)on1)C1CCN(CCc2ccccn2)CC1 ZINC000500065935 909531948 /nfs/dbraw/zinc/53/19/48/909531948.db2.gz UVISDVXZPIWBQU-UHFFFAOYSA-N 0 3 424.932 4.169 20 0 HIADHN CCc1nnc(NC(=O)[C@@H](C)[C@H](C)NCc2cc(C)c(C)cc2OC(F)F)s1 ZINC000513046133 921504247 /nfs/dbraw/zinc/50/42/47/921504247.db2.gz JJVINOGMCUHPIL-STQMWFEESA-N 0 3 412.506 4.072 20 0 HIADHN Cc1ccc([C@H](Cn2ccnc2)NC(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)c(C)c1 ZINC000500099600 909579038 /nfs/dbraw/zinc/57/90/38/909579038.db2.gz BNHIZAIWXPHWPV-OYDLWJJNSA-N 0 3 419.573 4.232 20 0 HIADHN CNC(=O)[C@@H]1CCC[C@@H]1NCc1c(C)nn(-c2ccccc2)c1Oc1ccc(F)cc1 ZINC000500232476 909721502 /nfs/dbraw/zinc/72/15/02/909721502.db2.gz VZNLFSIUGRSFFL-IRLDBZIGSA-N 0 3 422.504 4.116 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)cc1CN1CCC[C@@H](CNC(=O)c2ccccc2)C1 ZINC000513067060 921522660 /nfs/dbraw/zinc/52/26/60/921522660.db2.gz BVZCIQOLJJVASW-IBGZPJMESA-N 0 3 422.960 4.476 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)cc1CN1CCC[C@H](CNC(=O)c2ccccc2)C1 ZINC000513067061 921523529 /nfs/dbraw/zinc/52/35/29/921523529.db2.gz BVZCIQOLJJVASW-LJQANCHMSA-N 0 3 422.960 4.476 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NCc2c(F)ccc(Br)c2F)CC1 ZINC000500369249 909818691 /nfs/dbraw/zinc/81/86/91/909818691.db2.gz GSXBLYLZIAVUFO-CYBMUJFWSA-N 0 3 410.306 4.438 20 0 HIADHN CN(C)Cc1ccc(C(N)=O)cc1NCC(c1ccc(F)cc1)c1ccc(F)cc1 ZINC000500436107 909856382 /nfs/dbraw/zinc/85/63/82/909856382.db2.gz ZWILTKJBAANCGW-UHFFFAOYSA-N 0 3 409.480 4.369 20 0 HIADHN C[C@@H]1[C@H](NC(=O)N[C@H](C[C@H]2CCOC2)c2ccccc2)CCN1Cc1ccccc1 ZINC000500589515 909951063 /nfs/dbraw/zinc/95/10/63/909951063.db2.gz IBHDTDIQVZQOJX-WDWDUUAGSA-N 0 3 407.558 4.117 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)Nc2cc(Cl)ccc2Cl)CC1 ZINC000500632501 909979902 /nfs/dbraw/zinc/97/99/02/909979902.db2.gz NYBVWEXWNUKJGI-UHFFFAOYSA-N 0 3 421.372 4.453 20 0 HIADHN CCN1CCN(Cc2ccc(CNC(=O)N(C)[C@H](C)c3ccc(C)cc3)cc2)CC1 ZINC000500664425 910005783 /nfs/dbraw/zinc/00/57/83/910005783.db2.gz NXUADOBAVQLARL-OAQYLSRUSA-N 0 3 408.590 4.035 20 0 HIADHN CCN1CCN(Cc2ccc(CNC(=O)N3CCC[C@H]3c3ccc(C)cc3)cc2)CC1 ZINC000500668443 910008731 /nfs/dbraw/zinc/00/87/31/910008731.db2.gz WONMPAQTCROJIJ-VWLOTQADSA-N 0 3 420.601 4.179 20 0 HIADHN CN(C(=O)c1ccc2c(c1)Cc1ccccc1-2)C1CCN(CCc2ccccn2)CC1 ZINC000500779390 910075223 /nfs/dbraw/zinc/07/52/23/910075223.db2.gz AMLHGRBWERIZGQ-UHFFFAOYSA-N 0 3 411.549 4.432 20 0 HIADHN Cc1ccccc1C1(C(=O)Nc2ccc(CCN3CCSCC3)cc2)CCOCC1 ZINC000500829546 910109526 /nfs/dbraw/zinc/10/95/26/910109526.db2.gz CZYRXVWOZHHLNL-UHFFFAOYSA-N 0 3 424.610 4.273 20 0 HIADHN COc1cccc([C@@H](CNC(=O)N[C@@H](C)c2cccc(F)c2F)N2CCCC2)c1 ZINC000500834536 910110856 /nfs/dbraw/zinc/11/08/56/910110856.db2.gz REBBTBYHTKUHEH-MGPUTAFESA-N 0 3 403.473 4.171 20 0 HIADHN CN(Cc1cnn(-c2ccc(Cl)cc2)c1)C1CCN(C(=O)c2ccccc2)CC1 ZINC000513105727 921552777 /nfs/dbraw/zinc/55/27/77/921552777.db2.gz AREQRUZCCXVVNU-UHFFFAOYSA-N 0 3 408.933 4.262 20 0 HIADHN C[C@@H](NC(=O)N(CCN(C)C)Cc1ccccn1)[C@H](C)c1ccccc1C(F)(F)F ZINC000500892436 910163713 /nfs/dbraw/zinc/16/37/13/910163713.db2.gz KBUZTLRXMPKRDJ-DLBZAZTESA-N 0 3 422.495 4.366 20 0 HIADHN COc1cccc(CN(Cc2cc(OC)c(OC)cc2OC)C2CCC(O)CC2)c1 ZINC000513116439 921561656 /nfs/dbraw/zinc/56/16/56/921561656.db2.gz FMXUBJVWVUUMDE-UHFFFAOYSA-N 0 3 415.530 4.027 20 0 HIADHN CCCOc1ccc(CN2CCC3(C[C@@H]3C(=O)N3CCCCC3)CC2)cc1OCC ZINC000501135714 910315575 /nfs/dbraw/zinc/31/55/75/910315575.db2.gz SURWQYKNFNMFAU-OAQYLSRUSA-N 0 3 414.590 4.489 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCC1(c2ccccc2)CCOCC1)c1ccsc1 ZINC000501136044 910316854 /nfs/dbraw/zinc/31/68/54/910316854.db2.gz QRJUSNPTZHBWOZ-NRFANRHFSA-N 0 3 415.603 4.179 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCC1(c2ccccc2)CCOCC1)c1ccsc1 ZINC000501136045 910317746 /nfs/dbraw/zinc/31/77/46/910317746.db2.gz QRJUSNPTZHBWOZ-OAQYLSRUSA-N 0 3 415.603 4.179 20 0 HIADHN CCc1ccc([C@H](CNC(=O)Nc2cccc(C(=O)N3CCCC3)c2C)N(C)C)cc1 ZINC000501163144 910333652 /nfs/dbraw/zinc/33/36/52/910333652.db2.gz IJXHRHZLGCFIML-QHCPKHFHSA-N 0 3 422.573 4.218 20 0 HIADHN CCNC(=O)c1ccc(C)c(NC(=O)NC[C@H](c2ccsc2)N(CC)CC)c1 ZINC000501168328 910337393 /nfs/dbraw/zinc/33/73/93/910337393.db2.gz XPIJNBRDIDBTHJ-LJQANCHMSA-N 0 3 402.564 4.011 20 0 HIADHN C[C@@H](CC(=O)c1ccccc1F)C(=O)N[C@H]1CCN(Cc2ccccc2)CC1(C)C ZINC000513126316 921570547 /nfs/dbraw/zinc/57/05/47/921570547.db2.gz RCRJIETZLFDGBX-MBSDFSHPSA-N 0 3 410.533 4.452 20 0 HIADHN CN(C)CCN(CC1CCCCC1)C(=O)CCc1ncc(-c2ccccc2F)o1 ZINC000501235967 910392759 /nfs/dbraw/zinc/39/27/59/910392759.db2.gz DLGKBWJIMIBRJB-UHFFFAOYSA-N 0 3 401.526 4.384 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)c2cnn(Cc3ccccc3Cl)c2)C1 ZINC000501258912 910419553 /nfs/dbraw/zinc/41/95/53/910419553.db2.gz RFQMGJPFIMJXEI-DYESRHJHSA-N 0 3 408.933 4.150 20 0 HIADHN CC[C@H](CNC(=O)Nc1cccc(OC[C@@H]2CCCO2)c1)N1CCc2ccccc2C1 ZINC000501333475 910475089 /nfs/dbraw/zinc/47/50/89/910475089.db2.gz OCNGOPUIFBWAJD-VWNXMTODSA-N 0 3 423.557 4.203 20 0 HIADHN CC[C@@H](CNC(=O)NCc1cc(Br)cs1)N1CCc2ccccc2C1 ZINC000501408027 910542377 /nfs/dbraw/zinc/54/23/77/910542377.db2.gz SSPXCDRCCMNLCZ-KRWDZBQOSA-N 0 3 422.392 4.147 20 0 HIADHN O=C(Nc1ccc(F)cc1)C1CCN(Cc2ccc(Oc3cnccn3)cc2)CC1 ZINC000513153798 921588062 /nfs/dbraw/zinc/58/80/62/921588062.db2.gz LSOJJVWSFGIIRF-UHFFFAOYSA-N 0 3 406.461 4.259 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)C[C@H](c1cccs1)n1cccc1 ZINC000501733711 910796028 /nfs/dbraw/zinc/79/60/28/910796028.db2.gz UITVEYPZSQMGTC-HXUWFJFHSA-N 0 3 417.525 4.398 20 0 HIADHN CC(C)Cc1ccc(CCC(=O)Nc2cccc(CN3CCC(C(N)=O)CC3)c2)cc1 ZINC000501777604 910833097 /nfs/dbraw/zinc/83/30/97/910833097.db2.gz FQFKBDPCXSVEBG-UHFFFAOYSA-N 0 3 421.585 4.154 20 0 HIADHN COc1ccc(Cl)cc1CN(C)C(=O)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000501801196 910851649 /nfs/dbraw/zinc/85/16/49/910851649.db2.gz FMZVOZGJSNDXMK-FQEVSTJZSA-N 0 3 401.938 4.327 20 0 HIADHN COc1cc(NC(=O)N[C@H](CN2CCCC2)c2ccccc2)c(OC)cc1Cl ZINC000501802777 910853889 /nfs/dbraw/zinc/85/38/89/910853889.db2.gz OKQHZXXZHMYXII-GOSISDBHSA-N 0 3 403.910 4.316 20 0 HIADHN CCOc1cc2c(cc1CNC(=O)N[C@H](CN1CCCC1)c1ccccc1)O[C@H](C)C2 ZINC000501852119 910884757 /nfs/dbraw/zinc/88/47/57/910884757.db2.gz UCEIDLJJFMTFTJ-XMSQKQJNSA-N 0 3 423.557 4.045 20 0 HIADHN FC(F)(F)c1ccc(C[C@@]2(NCc3cncn3Cc3ccccc3)CCOC2)cc1 ZINC000513196903 921616048 /nfs/dbraw/zinc/61/60/48/921616048.db2.gz RWMXYIRJIAEPNE-QFIPXVFZSA-N 0 3 415.459 4.442 20 0 HIADHN CCN(C(=O)c1cccc(N2CCCC2=O)c1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000501947361 910933861 /nfs/dbraw/zinc/93/38/61/910933861.db2.gz NYZZDESBUGYMPX-XXBNENTESA-N 0 3 405.542 4.111 20 0 HIADHN CCN(C(=O)c1ccc(CN2CCCC2=O)cc1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000501959140 910945642 /nfs/dbraw/zinc/94/56/42/910945642.db2.gz FYCKEUULHOOMQV-GBXCKJPGSA-N 0 3 419.569 4.107 20 0 HIADHN C[C@@H](C[NH2+][C@H](c1nc(-c2nc[n-]n2)no1)C(C)(C)C)c1ccc(C(F)(F)F)cc1 ZINC000502020900 910980485 /nfs/dbraw/zinc/98/04/85/910980485.db2.gz FNYQYQAVIKUFQQ-SMDDNHRTSA-N 0 3 408.428 4.354 20 0 HIADHN C[C@@H](CN[C@H](c1nc(-c2nc[nH]n2)no1)C(C)(C)C)c1ccc(C(F)(F)F)cc1 ZINC000502020900 910980498 /nfs/dbraw/zinc/98/04/98/910980498.db2.gz FNYQYQAVIKUFQQ-SMDDNHRTSA-N 0 3 408.428 4.354 20 0 HIADHN C[C@@H](NC[C@@H]1CN(C(=O)c2ccccc2)[C@H]2CCN1C2)c1ccc(Cl)cc1Cl ZINC000502035698 910991336 /nfs/dbraw/zinc/99/13/36/910991336.db2.gz LKPNBXFFMIBTFS-AYOQOUSVSA-N 0 3 418.368 4.243 20 0 HIADHN O=C(Cc1cc(Cl)ccc1Cl)NCCCCN1CCN(c2ccccc2)CC1 ZINC000502036856 910991935 /nfs/dbraw/zinc/99/19/35/910991935.db2.gz ZLXFURBUCWIPLZ-UHFFFAOYSA-N 0 3 420.384 4.255 20 0 HIADHN C[C@H](NC[C@H]1CN(C(=O)c2ccccc2)[C@H]2CCN1C2)c1ccc(Cl)cc1Cl ZINC000502035702 910991964 /nfs/dbraw/zinc/99/19/64/910991964.db2.gz LKPNBXFFMIBTFS-SNRMKQJTSA-N 0 3 418.368 4.243 20 0 HIADHN C[C@H](NC[C@@H]1CN(C(=O)c2ccccc2)[C@H]2CCN1C2)c1ccc(-c2ccccc2)o1 ZINC000502063697 911008961 /nfs/dbraw/zinc/00/89/61/911008961.db2.gz ZEWRSKMERVJNAL-AJSBUHFISA-N 0 3 415.537 4.196 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)N[C@H](C)[C@@H](OC)c2ccccc2Cl)cc1 ZINC000502105913 911041929 /nfs/dbraw/zinc/04/19/29/911041929.db2.gz PBXXRYGLIZZNCN-GQWLDOHISA-N 0 3 419.953 4.027 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)N[C@@H](C)[C@H](OC)c2ccccc2Cl)cc1 ZINC000502105915 911042834 /nfs/dbraw/zinc/04/28/34/911042834.db2.gz PBXXRYGLIZZNCN-JHVJFLLYSA-N 0 3 419.953 4.027 20 0 HIADHN C[C@H]1CCN(C(=O)Nc2cn(C)nc2-c2ccccc2)CCN1Cc1ccccc1 ZINC000502171793 911095308 /nfs/dbraw/zinc/09/53/08/911095308.db2.gz KXJNWCJQFOZDSW-IBGZPJMESA-N 0 3 403.530 4.215 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)Nc1cn(C)nc1-c1ccccc1 ZINC000502172287 911095703 /nfs/dbraw/zinc/09/57/03/911095703.db2.gz ILTGEBCLHJVKQA-UHFFFAOYSA-N 0 3 411.937 4.336 20 0 HIADHN Cc1ccc(OCc2cccc(C(=O)NC[C@H]3CCCN3Cc3ccccc3)c2)cn1 ZINC000513219580 921634925 /nfs/dbraw/zinc/63/49/25/921634925.db2.gz UVTJQVJTDKRXOZ-XMMPIXPASA-N 0 3 415.537 4.363 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)[C@@H]1C[C@H]1c1ccc(Br)cc1 ZINC000513224469 921638576 /nfs/dbraw/zinc/63/85/76/921638576.db2.gz SYEXVXMNCUCYSE-PCCBWWKXSA-N 0 3 413.359 4.333 20 0 HIADHN C[C@H](c1ccccc1)N(C)C(=O)CNC(C)(C)COc1ncccc1C(F)(F)F ZINC000502236973 911187318 /nfs/dbraw/zinc/18/73/18/911187318.db2.gz AMBCXUNVGFYNLR-OAHLLOKOSA-N 0 3 409.452 4.067 20 0 HIADHN O=C(Cc1ccc(Br)c(F)c1)NC[C@H](c1cccs1)N1CCCC1 ZINC000502277002 911225894 /nfs/dbraw/zinc/22/58/94/911225894.db2.gz RWTRYSFGDBBZOJ-MRXNPFEDSA-N 0 3 411.340 4.146 20 0 HIADHN Cn1ccnc1COc1ccc(CN2CCC(N3CCc4ccccc43)CC2)cc1 ZINC000502303290 911263811 /nfs/dbraw/zinc/26/38/11/911263811.db2.gz SVZWHXIFNQOTPL-UHFFFAOYSA-N 0 3 402.542 4.026 20 0 HIADHN c1cc(Sc2ccccn2)oc1CNC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000513235316 921648986 /nfs/dbraw/zinc/64/89/86/921648986.db2.gz AQGQOYXDMJNKJA-NRFANRHFSA-N 0 3 409.555 4.207 20 0 HIADHN COCCn1cc(CN[C@@H](C)COc2ccc3cc(Br)ccc3c2)cn1 ZINC000502327278 911302734 /nfs/dbraw/zinc/30/27/34/911302734.db2.gz QOJXNXTUYUVFPQ-HNNXBMFYSA-N 0 3 418.335 4.002 20 0 HIADHN C[C@H](NC(=O)NCC1(N2CCSCC2)CCCC1)c1ccc(OC(F)F)cc1 ZINC000502337298 911316620 /nfs/dbraw/zinc/31/66/20/911316620.db2.gz XDMCNJPXQITBFX-HNNXBMFYSA-N 0 3 413.534 4.010 20 0 HIADHN Cc1cc(C)n(Cc2cccc(C(=O)N(CCCc3ccccc3)CCN(C)C)c2)n1 ZINC000502361099 911345103 /nfs/dbraw/zinc/34/51/03/911345103.db2.gz RQPMNAKTCYCGOM-UHFFFAOYSA-N 0 3 418.585 4.185 20 0 HIADHN COc1cc(C)c(C[C@@H](C)N[C@H](CO)c2ccccc2OC(F)(F)F)cc1OC ZINC000502373854 911358449 /nfs/dbraw/zinc/35/84/49/911358449.db2.gz NOULOUCWEOZZBU-RHSMWYFYSA-N 0 3 413.436 4.165 20 0 HIADHN Cc1c(C(=O)N(CCCc2ccccc2)CCN(C)C)cnn1-c1ccccc1C ZINC000502397338 911381317 /nfs/dbraw/zinc/38/13/17/911381317.db2.gz CUHCAQDQPYBVMZ-UHFFFAOYSA-N 0 3 404.558 4.126 20 0 HIADHN COCC[C@@H]1CCC[C@H]1N[C@@H](c1cccc(S(C)(=O)=O)c1)c1ccc(F)c(F)c1 ZINC000502404593 911388390 /nfs/dbraw/zinc/38/83/90/911388390.db2.gz QOAMPKFGHHDXSD-ARBPTSGCSA-N 0 3 423.525 4.253 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCC[C@@H]1C[C@H](C)O)c1ccc(C(F)(F)F)cc1 ZINC000502468938 911460100 /nfs/dbraw/zinc/46/01/00/911460100.db2.gz AISGNKHSORPQOD-KFKAGJAMSA-N 0 3 415.500 4.033 20 0 HIADHN COC1CCN(C2(CNC(=O)c3cnc(-c4ccccc4F)s3)CCCC2)CC1 ZINC000502485863 911481538 /nfs/dbraw/zinc/48/15/38/911481538.db2.gz LJFFSLQQSDKNRR-UHFFFAOYSA-N 0 3 417.550 4.103 20 0 HIADHN CC(C)Oc1ccc2ccccc2c1CN1CCC(S(=O)(=O)N2CCCC2)CC1 ZINC000502493040 911492269 /nfs/dbraw/zinc/49/22/69/911492269.db2.gz GIWQWQGIAJCVAE-UHFFFAOYSA-N 0 3 416.587 4.017 20 0 HIADHN OC[C@@H](CNCc1ccc(Sc2ccccn2)o1)Cc1cc(F)c(F)c(F)c1 ZINC000513261591 921666743 /nfs/dbraw/zinc/66/67/43/921666743.db2.gz OQWGWSOAMPUTAQ-CQSZACIVSA-N 0 3 408.445 4.184 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)[C@H](C)n1nc(C)cc1C)c1ccc(C(F)(F)F)cc1 ZINC000502506918 911511081 /nfs/dbraw/zinc/51/10/81/911511081.db2.gz LKBLRUZULUYANP-LPHOPBHVSA-N 0 3 410.484 4.279 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)CN[C@H](c2ccc(F)cc2)C(C)C)c(OC)c1 ZINC000502508404 911514244 /nfs/dbraw/zinc/51/42/44/911514244.db2.gz IGUOOGJLFJPGLO-URXFXBBRSA-N 0 3 414.521 4.493 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1ccc([C@@H]2CCCOC2)cc1)c1cccc(OC)c1 ZINC000502526670 911530591 /nfs/dbraw/zinc/53/05/91/911530591.db2.gz NOUQSVHEHCAZOU-VWNXMTODSA-N 0 3 410.558 4.402 20 0 HIADHN CN(Cc1ccc(Cl)s1)C(=O)CN[C@]1(Cc2ccc(Cl)cc2)CCOC1 ZINC000502548523 911557428 /nfs/dbraw/zinc/55/74/28/911557428.db2.gz VXOIXLZQFZNZPY-IBGZPJMESA-N 0 3 413.370 4.005 20 0 HIADHN CCc1ccccc1NC(=O)CN(C)C(=O)[C@H](C)N[C@@H](c1ccc(F)cc1)C(C)C ZINC000502552429 911559182 /nfs/dbraw/zinc/55/91/82/911559182.db2.gz PRANIAIRZQJJMV-GAJHUEQPSA-N 0 3 413.537 4.160 20 0 HIADHN O=C(CN[C@@H]1CCCC[C@H]1OC(F)F)Nc1ccc(OCc2ccccc2)cc1 ZINC000502562151 911566561 /nfs/dbraw/zinc/56/65/61/911566561.db2.gz GEYKOAGMLKKYHY-WOJBJXKFSA-N 0 3 404.457 4.344 20 0 HIADHN COCCN1CCC(NC(=O)N[C@@H](c2ccccc2)[C@@H]2CCCc3ccccc32)CC1 ZINC000502564208 911570764 /nfs/dbraw/zinc/57/07/64/911570764.db2.gz UJVXKYGMJWTWIL-RPBOFIJWSA-N 0 3 421.585 4.258 20 0 HIADHN COC1CCN(C2(CNC(=O)c3sc(-c4cccs4)nc3C)CCCC2)CC1 ZINC000502579470 911587355 /nfs/dbraw/zinc/58/73/55/911587355.db2.gz PRNPLBZNWBUJSL-UHFFFAOYSA-N 0 3 419.616 4.333 20 0 HIADHN COc1cc([C@H](C)NC(=O)NC[C@H](Cc2ccccc2)N(C)C)ccc1OC(C)C ZINC000502629420 911656845 /nfs/dbraw/zinc/65/68/45/911656845.db2.gz WZCUULPNVAHHBU-RXVVDRJESA-N 0 3 413.562 4.016 20 0 HIADHN NC(=O)[C@@H]1CCCN(Cc2ccccc2NC(=O)c2cc(F)c(Cl)cc2Cl)C1 ZINC000502714488 911747347 /nfs/dbraw/zinc/74/73/47/911747347.db2.gz WDLOMNHWASOVSW-CYBMUJFWSA-N 0 3 424.303 4.082 20 0 HIADHN CCN1CCC[C@@H](CN(C)C(=O)c2ccc(C(C)(F)F)cc2)[C@@H]1c1cnn(C)c1 ZINC000502731602 911757740 /nfs/dbraw/zinc/75/77/40/911757740.db2.gz FIDALLCZFAZKEL-FXAWDEMLSA-N 0 3 404.505 4.077 20 0 HIADHN CCc1cccc2c(CC(=O)Nc3cccc(N4CCN(C(C)C)CC4)c3)c[nH]c21 ZINC000502868186 911874229 /nfs/dbraw/zinc/87/42/29/911874229.db2.gz HNHTYKZNCZWKAV-UHFFFAOYSA-N 0 3 404.558 4.442 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)NCC(C)(C)c2ccc(F)cc2Cl)o1 ZINC000502873408 911877107 /nfs/dbraw/zinc/87/71/07/911877107.db2.gz YATMGLXKGCKWOB-UHFFFAOYSA-N 0 3 409.933 4.432 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)c3cnc4onc(C(C)(C)C)c4c3)c2)CC1 ZINC000502881811 911882820 /nfs/dbraw/zinc/88/28/20/911882820.db2.gz PTKCCLXLBGJQLM-UHFFFAOYSA-N 0 3 421.545 4.303 20 0 HIADHN Cc1c(C(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)cnn1-c1ccccc1C ZINC000502890956 911887191 /nfs/dbraw/zinc/88/71/91/911887191.db2.gz SCDCGKXRBCYEBH-UHFFFAOYSA-N 0 3 417.557 4.272 20 0 HIADHN CC(C)c1noc2ncc(C(=O)Nc3cccc(N4CCN(C(C)C)CC4)c3)cc21 ZINC000502900350 911891175 /nfs/dbraw/zinc/89/11/75/911891175.db2.gz ZTAYETUTOPHCDS-UHFFFAOYSA-N 0 3 407.518 4.129 20 0 HIADHN CCc1csc(CC(=O)NC[C@@H](c2ccc(C(F)(F)F)cc2)N(CC)CC)n1 ZINC000513310489 921703014 /nfs/dbraw/zinc/70/30/14/921703014.db2.gz OVLRGNGIARHXPR-KRWDZBQOSA-N 0 3 413.509 4.466 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)c1cnc(-c2ccc(F)c(F)c2)s1 ZINC000503069590 912036248 /nfs/dbraw/zinc/03/62/48/912036248.db2.gz SHZCBIFSKNKBAJ-UHFFFAOYSA-N 0 3 419.472 4.431 20 0 HIADHN O=C(COc1ccccc1OCc1ccccc1)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000503141280 912103121 /nfs/dbraw/zinc/10/31/21/912103121.db2.gz QALGDNLHTBEDKQ-HSZRJFAPSA-N 0 3 416.521 4.035 20 0 HIADHN COc1ccc([C@@H](CNC(=O)N2CCN(C)CC[C@H]2C)c2c[nH]c3ccccc32)cc1 ZINC000503151457 912116128 /nfs/dbraw/zinc/11/61/28/912116128.db2.gz KIMVYLDJBOCFGO-XMSQKQJNSA-N 0 3 420.557 4.044 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)c1csc(Cc2cccc(F)c2)n1 ZINC000503156560 912122664 /nfs/dbraw/zinc/12/26/64/912122664.db2.gz KMAAFYKIEOSERG-UHFFFAOYSA-N 0 3 415.509 4.216 20 0 HIADHN CC1CCN([C@H](CNC(=O)Nc2nnc(C(F)(F)F)s2)c2cccs2)CC1 ZINC000503160968 912129572 /nfs/dbraw/zinc/12/95/72/912129572.db2.gz RGNLOHXGUUJOOT-LLVKDONJSA-N 0 3 419.498 4.213 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)N(C)[C@H]3CCC[C@H](C)C3)CC2)c1 ZINC000503200643 912180598 /nfs/dbraw/zinc/18/05/98/912180598.db2.gz BZTWKXQJUXEGEO-UNMCSNQZSA-N 0 3 400.611 4.117 20 0 HIADHN CC(C)(C)c1cccc(OCCNCc2ccccc2OCC(=O)N2CCCC2)c1 ZINC000506284573 914883672 /nfs/dbraw/zinc/88/36/72/914883672.db2.gz KZHYYXGDGKTICF-UHFFFAOYSA-N 0 3 410.558 4.154 20 0 HIADHN COC(=O)c1cc2cc(NC(=O)N[C@@H]3CCN([C@H](C)c4ccccc4)C3)ccc2o1 ZINC000506294894 914889740 /nfs/dbraw/zinc/88/97/40/914889740.db2.gz MYNSARXJYSSWGI-DNVCBOLYSA-N 0 3 407.470 4.176 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)Nc2ccccc2N2C[C@@H](C)O[C@H](C)C2)C1 ZINC000506295443 914890944 /nfs/dbraw/zinc/89/09/44/914890944.db2.gz QQNNTPJZPIGZTI-XWSHUIEDSA-N 0 3 422.573 4.257 20 0 HIADHN O=C(Nc1ccc(CNC(=O)c2cccc(CN3CCCC3)c2)cc1)c1ccco1 ZINC000513348992 921730365 /nfs/dbraw/zinc/73/03/65/921730365.db2.gz ZKVYOIFLSMLZBJ-UHFFFAOYSA-N 0 3 403.482 4.058 20 0 HIADHN CCCNC(=O)C1CCN(Cc2ccc(OCc3cccs3)c(OC)c2)CC1 ZINC000506339330 914958009 /nfs/dbraw/zinc/95/80/09/914958009.db2.gz IUKRZMMWVNITCG-UHFFFAOYSA-N 0 3 402.560 4.074 20 0 HIADHN c1[nH]nc(-c2cccnc2)c1CN1CCN(C2c3ccccc3-c3ccccc32)CC1 ZINC000506687654 915364377 /nfs/dbraw/zinc/36/43/77/915364377.db2.gz DWPAQYHELWCJJP-UHFFFAOYSA-N 0 3 407.521 4.359 20 0 HIADHN COc1ccc([C@H](CNC(=O)c2c[nH]cc2-c2cccc(OC)c2)N2CCCC2)cc1 ZINC000513403029 921771170 /nfs/dbraw/zinc/77/11/70/921771170.db2.gz PQUFHGYYUDYGQE-DEOSSOPVSA-N 0 3 419.525 4.266 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3ccc(Oc4ccccn4)cc3)CC2)C[C@@H](C)O1 ZINC000506860201 915644234 /nfs/dbraw/zinc/64/42/34/915644234.db2.gz QGBGAVXKODOVEQ-RTBURBONSA-N 0 3 424.545 4.227 20 0 HIADHN CCCCCNC(=O)C1CCN(Cc2cn(-c3ccc(Cl)cc3)nc2C)CC1 ZINC000506909369 915707639 /nfs/dbraw/zinc/70/76/39/915707639.db2.gz PIKLUKXGIOAIKU-UHFFFAOYSA-N 0 3 402.970 4.353 20 0 HIADHN CCOC(=O)c1cc(CC)sc1NC(=O)N(CCN(C)C)Cc1cccs1 ZINC000506970526 915776727 /nfs/dbraw/zinc/77/67/27/915776727.db2.gz IRIAKEWCMGFZIQ-UHFFFAOYSA-N 0 3 409.577 4.144 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N(Cc1ccccc1Cl)CC1CC1 ZINC000506974632 915781946 /nfs/dbraw/zinc/78/19/46/915781946.db2.gz RFKAYMSKFOHRFT-UHFFFAOYSA-N 0 3 413.949 4.087 20 0 HIADHN CCCn1nccc1C1CCN(C(=O)N[C@@H](CN2CCCC2)c2ccccc2)CC1 ZINC000507097973 915868450 /nfs/dbraw/zinc/86/84/50/915868450.db2.gz TVESGMKHYKDMTI-QFIPXVFZSA-N 0 3 409.578 4.019 20 0 HIADHN O=C(CSc1ccc(F)c(F)c1)N1CCCN(CCCc2ccccc2)CC1 ZINC000507097975 915868744 /nfs/dbraw/zinc/86/87/44/915868744.db2.gz TVQDJTYQSGZLOQ-UHFFFAOYSA-N 0 3 404.526 4.224 20 0 HIADHN Cc1ccc(CNC(=O)C2CCN(Cc3ccc(OCC(F)F)cc3)CC2)cc1F ZINC000507132282 915882820 /nfs/dbraw/zinc/88/28/20/915882820.db2.gz PTLXVYSKUYKOJH-UHFFFAOYSA-N 0 3 420.475 4.306 20 0 HIADHN C[C@H]1C[C@@H]1C(=O)Nc1ccc(C(=O)N2CCCN(CCCc3ccccc3)CC2)cc1 ZINC000507147661 915890762 /nfs/dbraw/zinc/89/07/62/915890762.db2.gz CPUKZIZHAIASBD-RDPSFJRHSA-N 0 3 419.569 4.062 20 0 HIADHN Cc1ccc(-c2nc(CC(=O)N3CCCN(CCCc4ccccc4)CC3)cs2)o1 ZINC000507160127 915897872 /nfs/dbraw/zinc/89/78/72/915897872.db2.gz ZQUVHJZMQSTFQH-UHFFFAOYSA-N 0 3 423.582 4.421 20 0 HIADHN Cc1ccc(CNC(=O)C2CCN(Cc3ccccc3OCC3CC3)CC2)cc1F ZINC000507168566 915909948 /nfs/dbraw/zinc/90/99/48/915909948.db2.gz QYWCQLHIWXIULA-UHFFFAOYSA-N 0 3 410.533 4.451 20 0 HIADHN COc1cc(CN(Cc2ccc(F)cc2)C(C)C)ccc1OCC(=O)N1CCCC1 ZINC000507170607 915912085 /nfs/dbraw/zinc/91/20/85/915912085.db2.gz OWEYRXRAARXFSX-UHFFFAOYSA-N 0 3 414.521 4.246 20 0 HIADHN CCOc1cc(CN(Cc2cccc(F)c2)C(C)C)ccc1O[C@H](C)C(=O)N(C)C ZINC000507172200 915914083 /nfs/dbraw/zinc/91/40/83/915914083.db2.gz ZOWGJCMPLWCINU-GOSISDBHSA-N 0 3 416.537 4.491 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)CN2CC[C@H](c3ccccc3C)C2)cc1OC ZINC000507218568 915969751 /nfs/dbraw/zinc/96/97/51/915969751.db2.gz LGOSAAXRUFFEMQ-UNMCSNQZSA-N 0 3 408.542 4.165 20 0 HIADHN Cc1cc(NC(=O)[C@@H](C)N[C@H](C)c2ccc3n[nH]cc3c2)ccc1Br ZINC000507243681 916003849 /nfs/dbraw/zinc/00/38/49/916003849.db2.gz NOZJDGXQRVKXEF-CHWSQXEVSA-N 0 3 401.308 4.312 20 0 HIADHN O[C@H](COc1c(Cl)cccc1Cl)CN1CCC(Nc2ccc(F)cc2)CC1 ZINC000507256876 916017842 /nfs/dbraw/zinc/01/78/42/916017842.db2.gz WSKFRZQIPXOOTQ-KRWDZBQOSA-N 0 3 413.320 4.449 20 0 HIADHN CC(C)Cn1ncc(C(=O)N2CCCN(CCCc3ccccc3)CC2)c1C1CC1 ZINC000507273094 916036787 /nfs/dbraw/zinc/03/67/87/916036787.db2.gz PBXOISYWSFDIHX-UHFFFAOYSA-N 0 3 408.590 4.197 20 0 HIADHN NC(=O)CN(CCC(=O)Nc1c(Cl)cccc1Cl)CCC1CCCCC1 ZINC000507405244 916173969 /nfs/dbraw/zinc/17/39/69/916173969.db2.gz KWAPNAANJSIAGT-UHFFFAOYSA-N 0 3 400.350 4.080 20 0 HIADHN CN(Cc1ccccc1-c1ccnn1C)[C@@H]1c2cc(Cl)cc(Cl)c2C[C@H]1O ZINC000507531041 916288368 /nfs/dbraw/zinc/28/83/68/916288368.db2.gz LUGKTILNEQQSQO-NHCUHLMSSA-N 0 3 402.325 4.484 20 0 HIADHN CN1CCC[C@@H](CNC(=O)c2csc(-c3ncccc3F)n2)[C@@H]1c1cccs1 ZINC000507545361 916303141 /nfs/dbraw/zinc/30/31/41/916303141.db2.gz FJOIEQBBRSLKSG-SCLBCKFNSA-N 0 3 416.547 4.219 20 0 HIADHN CC[C@@H]1C[C@@]1(NC(=O)NCc1ccccc1CN1CCC(O)CC1)c1cccc(C)c1 ZINC000507581704 916335900 /nfs/dbraw/zinc/33/59/00/916335900.db2.gz CWXZJKCZSKYAQS-GJZUVCINSA-N 0 3 421.585 4.076 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)CCCC(F)(F)F)c(OCC)c2)CC1 ZINC000507601566 916356711 /nfs/dbraw/zinc/35/67/11/916356711.db2.gz MMTPUIGJAUSMNT-UHFFFAOYSA-N 0 3 401.473 4.288 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)Cc3ccc(F)cc3F)c(OCC)c2)CC1 ZINC000507604383 916359899 /nfs/dbraw/zinc/35/98/99/916359899.db2.gz HOSUJFIDNFIVTO-UHFFFAOYSA-N 0 3 417.500 4.077 20 0 HIADHN COc1ccc(Cl)cc1[C@@H](C)N[C@@H]1CCc2nnc(-c3ccc(F)cc3)n2C1 ZINC000507609048 916366294 /nfs/dbraw/zinc/36/62/94/916366294.db2.gz BWXXMJMIMJCLDN-CXAGYDPISA-N 0 3 400.885 4.412 20 0 HIADHN COc1ccc(Cl)cc1[C@@H](C)N[C@H]1CCc2nnc(-c3ccc(F)cc3)n2C1 ZINC000507609049 916366796 /nfs/dbraw/zinc/36/67/96/916366796.db2.gz BWXXMJMIMJCLDN-DYVFJYSZSA-N 0 3 400.885 4.412 20 0 HIADHN CC[C@@H](CC(=O)Nc1ccc(C(=O)NCCN2CCCC2)cc1)c1ccc(OC)cc1 ZINC000507702880 916484840 /nfs/dbraw/zinc/48/48/40/916484840.db2.gz AOCNJLYFMSCBHL-IBGZPJMESA-N 0 3 423.557 4.043 20 0 HIADHN CC[C@H](CC(=O)Nc1ccc(C(=O)NCCN2CCCC2)cc1)c1ccc(OC)cc1 ZINC000507702881 916485532 /nfs/dbraw/zinc/48/55/32/916485532.db2.gz AOCNJLYFMSCBHL-LJQANCHMSA-N 0 3 423.557 4.043 20 0 HIADHN CC[C@@H](C)NC(=O)c1ccc(NC(=O)NC[C@H](c2ccsc2)N(CC)CC)cc1 ZINC000507765850 916549148 /nfs/dbraw/zinc/54/91/48/916549148.db2.gz GXXYOBHOHAHUJZ-OXQOHEQNSA-N 0 3 416.591 4.481 20 0 HIADHN CCS(=O)(=O)c1ccc(N2CCC(N[C@@H]3CCc4c3c(F)ccc4F)CC2)cc1 ZINC000507810075 916598993 /nfs/dbraw/zinc/59/89/93/916598993.db2.gz SXRPTVCCSLJWFC-OAQYLSRUSA-N 0 3 420.525 4.004 20 0 HIADHN Fc1ccc(-c2nnc3n2C[C@H](NCc2cc(Cl)ccc2OC(F)F)CC3)cc1 ZINC000507887157 916732612 /nfs/dbraw/zinc/73/26/12/916732612.db2.gz NXKXEPMWCLAZNZ-MRXNPFEDSA-N 0 3 422.838 4.444 20 0 HIADHN COc1cc(C[NH2+]C2CCC(C(=O)OC(C)(C)C)CC2)cc(Br)c1[O-] ZINC000507894068 916748870 /nfs/dbraw/zinc/74/88/70/916748870.db2.gz NQWOXRWRVORTIL-UHFFFAOYSA-N 0 3 414.340 4.153 20 0 HIADHN O=C(Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1)c1cc(C2CC2)no1 ZINC000507913769 916789993 /nfs/dbraw/zinc/78/99/93/916789993.db2.gz MXZCNSBLAZBIEG-UHFFFAOYSA-N 0 3 416.525 4.169 20 0 HIADHN Cc1ccc(NC(=O)C2CCN(Cc3ccccc3OCC(F)(F)F)CC2)nc1 ZINC000507986634 916830080 /nfs/dbraw/zinc/83/00/80/916830080.db2.gz VDCFFAFXVNEWNN-UHFFFAOYSA-N 0 3 407.436 4.182 20 0 HIADHN CCOc1cc(CN2CCC[C@H](C(=O)Nc3cccc(C)n3)C2)ccc1OC(F)F ZINC000508024853 916860570 /nfs/dbraw/zinc/86/05/70/916860570.db2.gz HJRRJOSDAWMJBU-KRWDZBQOSA-N 0 3 419.472 4.241 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CN1CCC[C@@H](C(=O)Nc2cccc(C)n2)C1 ZINC000508037797 916867689 /nfs/dbraw/zinc/86/76/89/916867689.db2.gz LHJXOYAZHWHECS-JOCHJYFZSA-N 0 3 417.557 4.102 20 0 HIADHN CC[C@H](C)c1ccccc1OCC(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000508071665 916893474 /nfs/dbraw/zinc/89/34/74/916893474.db2.gz OOIUJDANWCUBQX-IBGZPJMESA-N 0 3 410.558 4.422 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@@H](C)[C@@H]1CCCOC1)c1ccc(C(F)(F)F)cc1 ZINC000508159146 916979608 /nfs/dbraw/zinc/97/96/08/916979608.db2.gz FAVVWQYERJUKTH-KVSKMBFKSA-N 0 3 415.500 4.203 20 0 HIADHN CCCN(C(=O)c1ccc2c(c1)OCCCO2)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000508460687 917245404 /nfs/dbraw/zinc/24/54/04/917245404.db2.gz ZVTFTZZMBQRYLK-JOCHJYFZSA-N 0 3 408.542 4.365 20 0 HIADHN O=C(N[C@H]1CCc2cc(F)ccc21)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000508605852 917375465 /nfs/dbraw/zinc/37/54/65/917375465.db2.gz WKKUFSUHFWVWEI-FPOVZHCZSA-N 0 3 406.423 4.384 20 0 HIADHN CN(C)CCN(C[C@@H]1CCCO1)C(=O)c1cccc(OCc2ccc(Cl)cc2)c1 ZINC000508620442 917388453 /nfs/dbraw/zinc/38/84/53/917388453.db2.gz PTXJAQIXNNBCDV-QFIPXVFZSA-N 0 3 416.949 4.102 20 0 HIADHN COc1cccc(C2(F)CCN(C(=O)N[C@H](C)[C@H](c3ccccc3)N(C)C)CC2)c1 ZINC000508842553 917594935 /nfs/dbraw/zinc/59/49/35/917594935.db2.gz BZBGKFQFTNOSJM-XMSQKQJNSA-N 0 3 413.537 4.357 20 0 HIADHN C[C@@H](NC(=O)N(C)CCCc1cc(-c2ccccc2)n[nH]1)[C@H](c1ccccc1)N(C)C ZINC000508851812 917604479 /nfs/dbraw/zinc/60/44/79/917604479.db2.gz IBAWHCBLYBIEPH-NTKDMRAZSA-N 0 3 419.573 4.342 20 0 HIADHN C[C@H](NC(=O)N1CCO[C@H](c2cccc(Cl)c2)C1)[C@H](c1ccccc1)N(C)C ZINC000508878696 917632242 /nfs/dbraw/zinc/63/22/42/917632242.db2.gz IHNGJAICWGKSDX-ORYQWCPZSA-N 0 3 401.938 4.114 20 0 HIADHN C[C@H](NC(=O)N1CCO[C@H](c2ccc(Cl)cc2)C1)[C@@H](c1ccccc1)N(C)C ZINC000508893124 917649504 /nfs/dbraw/zinc/64/95/04/917649504.db2.gz DSMRZXZHUOOAON-NDXORKPFSA-N 0 3 401.938 4.114 20 0 HIADHN Brc1cnn(C2CCN(Cc3ccc(OC[C@@H]4CCCO4)cc3)CC2)c1 ZINC000508896392 917650825 /nfs/dbraw/zinc/65/08/25/917650825.db2.gz YYNBPXBIQRBMMX-FQEVSTJZSA-N 0 3 420.351 4.041 20 0 HIADHN C[C@@H](NC(=O)N(C)Cc1cccc(Br)c1)[C@@H](c1ccccc1)N(C)C ZINC000508905647 917661980 /nfs/dbraw/zinc/66/19/80/917661980.db2.gz MJWXOIWTUPPOMD-BEFAXECRSA-N 0 3 404.352 4.282 20 0 HIADHN COc1cc(CN(C)C(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)ccc1SC ZINC000508907775 917663619 /nfs/dbraw/zinc/66/36/19/917663619.db2.gz QZTJXTYHNAZMMO-HRAATJIYSA-N 0 3 401.576 4.250 20 0 HIADHN C[C@H](NC(=O)N1CCO[C@@H](c2ccc(F)c(Cl)c2)C1)[C@@H](c1ccccc1)N(C)C ZINC000508925982 917684538 /nfs/dbraw/zinc/68/45/38/917684538.db2.gz UPVUOCAKJAFJAI-RVHYNSKXSA-N 0 3 419.928 4.253 20 0 HIADHN COCc1ccccc1/C=C(/C)CN1CCc2cc(OC)c(OC)c(OC)c2CC1 ZINC000508969926 917725433 /nfs/dbraw/zinc/72/54/33/917725433.db2.gz ZJNGJTVLQBIYCF-JXAWBTAJSA-N 0 3 411.542 4.363 20 0 HIADHN C[C@@H]1CCN(C(=O)c2cn3cc(Cl)cc(Cl)c3n2)CCN1Cc1ccccc1 ZINC000508986646 917739916 /nfs/dbraw/zinc/73/99/16/917739916.db2.gz UPBHXSOVNRDVCU-OAHLLOKOSA-N 0 3 417.340 4.378 20 0 HIADHN O=C(Nc1cccc(-c2nnco2)c1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000509016228 917770408 /nfs/dbraw/zinc/77/04/08/917770408.db2.gz MXUCUYYMJAMWGD-HXUWFJFHSA-N 0 3 416.403 4.130 20 0 HIADHN O=C(N[C@H]1CCCOc2ccccc21)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000509063223 917811776 /nfs/dbraw/zinc/81/17/76/917811776.db2.gz LRNOTCFGVWYJEY-UXHICEINSA-N 0 3 400.469 4.174 20 0 HIADHN CN(C)CCN(Cc1cccc(O)c1)C(=O)c1cccc(Br)c1Cl ZINC000509273392 917958824 /nfs/dbraw/zinc/95/88/24/917958824.db2.gz GTBVOSPSWNMRSW-UHFFFAOYSA-N 0 3 411.727 4.012 20 0 HIADHN Cc1cccc(-c2n[nH]cc2CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)c1 ZINC000509360310 918025389 /nfs/dbraw/zinc/02/53/89/918025389.db2.gz VGZACIMGRJYMBJ-UHFFFAOYSA-N 0 3 409.921 4.284 20 0 HIADHN Cn1cnnc1C1CCN(Cc2cn(-c3ccccc3)nc2-c2ccc(F)cc2)CC1 ZINC000509398419 918065348 /nfs/dbraw/zinc/06/53/48/918065348.db2.gz FNJLBPLRCFUHHU-UHFFFAOYSA-N 0 3 416.504 4.187 20 0 HIADHN CCCc1nc(C(=O)NC[C@H]2CCCN(C)[C@H]2c2ccc(C(F)(F)F)cc2)co1 ZINC000509401765 918067370 /nfs/dbraw/zinc/06/73/70/918067370.db2.gz OXRJQSGGTPNCIY-BEFAXECRSA-N 0 3 409.452 4.459 20 0 HIADHN Brc1cccc(-c2ccc(CNCCc3nnnn3-c3ccccc3)o2)c1 ZINC000509437629 918094491 /nfs/dbraw/zinc/09/44/91/918094491.db2.gz IONLGXIKBKLHEA-UHFFFAOYSA-N 0 3 424.302 4.017 20 0 HIADHN Cc1ccc(NC(=O)[C@H](C)N[C@H]2CCc3ccccc3OC2)c(Br)c1 ZINC000509530195 918177370 /nfs/dbraw/zinc/17/73/70/918177370.db2.gz XUCQHBDMYHAOEK-HOCLYGCPSA-N 0 3 403.320 4.068 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CN1CCC(C(=O)N2CCC[C@@H](C)C2)CC1 ZINC000509535020 918183676 /nfs/dbraw/zinc/18/36/76/918183676.db2.gz ZMICQBGMZVBFEE-LJQANCHMSA-N 0 3 408.590 4.019 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N1CCC[C@@H]1Cn1c(C)nc2ccccc21)c1ccco1 ZINC000509556908 918207012 /nfs/dbraw/zinc/20/70/12/918207012.db2.gz NYOCWNBEHHKVQX-FBBABVLZSA-N 0 3 423.561 4.241 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N1CCC(Oc2ccc(F)cc2)CC1)c1ccco1 ZINC000509561745 918211193 /nfs/dbraw/zinc/21/11/93/918211193.db2.gz ZCBCEFFSQQIIOM-OXJNMPFZSA-N 0 3 403.498 4.101 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N(Cc1cccs1)C[C@@H]1CCCO1)c1ccco1 ZINC000509565769 918216365 /nfs/dbraw/zinc/21/63/65/918216365.db2.gz BCPIAMMGOSQDMF-LNLFQRSKSA-N 0 3 405.564 4.161 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N(C)CCc1ccc(Br)cc1)c1ccco1 ZINC000509572217 918221271 /nfs/dbraw/zinc/22/12/71/918221271.db2.gz ULZXEDPGGPSJKP-MAUKXSAKSA-N 0 3 422.367 4.355 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N(Cc1ccc(F)cc1)C1CCOCC1)c1ccco1 ZINC000509574863 918224772 /nfs/dbraw/zinc/22/47/72/918224772.db2.gz UDWAVSPCXCEBSV-LAUBAEHRSA-N 0 3 417.525 4.239 20 0 HIADHN COc1ccc(C[C@@H](NCc2ccc3c(c2)oc(=O)n3C)c2ccc(OC)cc2)cc1 ZINC000509584140 918233863 /nfs/dbraw/zinc/23/38/63/918233863.db2.gz MJAWENPFMLLSHK-JOCHJYFZSA-N 0 3 418.493 4.222 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N(CCCO)[C@@H]1CCCc2ccccc21)c1ccco1 ZINC000509587093 918237568 /nfs/dbraw/zinc/23/75/68/918237568.db2.gz JFLCPPNZHHGVAL-VLCRHTCISA-N 0 3 413.562 4.180 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N1CC[C@H](C(F)(F)F)C2(CCC2)C1)c1ccco1 ZINC000509592641 918240456 /nfs/dbraw/zinc/24/04/56/918240456.db2.gz UNVPSQMVCAQTDU-UXLLHSPISA-N 0 3 401.473 4.473 20 0 HIADHN CC[C@H](NC(=O)N[C@@H]1CCN(Cc2ccccc2)[C@H]1C)c1ccc(OC)c(OC)c1 ZINC000509612371 918258178 /nfs/dbraw/zinc/25/81/78/918258178.db2.gz XVNTXBWDHJWPEI-DZFGPLHGSA-N 0 3 411.546 4.117 20 0 HIADHN CC[C@@H](NC(=O)N(Cc1ccco1)C1CCN(C)CC1)c1ccc(OC)c(OC)c1 ZINC000509611978 918258878 /nfs/dbraw/zinc/25/88/78/918258878.db2.gz VZWHWNMTDQEZDB-HXUWFJFHSA-N 0 3 415.534 4.054 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N(Cc1ccccc1)CC1(O)CCCC1)c1ccco1 ZINC000509613069 918261154 /nfs/dbraw/zinc/26/11/54/918261154.db2.gz IAXYCDNGDQOJJI-PZJWPPBQSA-N 0 3 413.562 4.226 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N1CCO[C@@H](c2ccc(F)cc2Cl)C1)c1ccco1 ZINC000509613654 918261669 /nfs/dbraw/zinc/26/16/69/918261669.db2.gz NUIFNMFSIYVMBH-BOUXLOLZSA-N 0 3 423.916 4.284 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N(C)[C@H]1CCO[C@@H](c2ccc(F)cc2)C1)c1ccco1 ZINC000509617387 918266095 /nfs/dbraw/zinc/26/60/95/918266095.db2.gz YNANZQSMTLMDKC-VRBBWPEWSA-N 0 3 417.525 4.410 20 0 HIADHN CCN1CCC[C@@H](CN(C)c2ncnc3c4ccccc4oc32)[C@@H]1c1cnn(C)c1 ZINC000509623452 918270095 /nfs/dbraw/zinc/27/00/95/918270095.db2.gz FPPXQSRCQUVVQG-HRAATJIYSA-N 0 3 404.518 4.019 20 0 HIADHN FC(F)(F)C1(C(F)(F)F)CCN(CCCN2CCN(c3ccccc3)CC2)C1 ZINC000509668786 918300472 /nfs/dbraw/zinc/30/04/72/918300472.db2.gz DHCUREBNYRUAGJ-UHFFFAOYSA-N 0 3 409.418 4.015 20 0 HIADHN O=C(NCCCCN1CCN(c2cccc(C(F)(F)F)c2)CC1)C(C1CC1)C1CC1 ZINC000509697568 918327834 /nfs/dbraw/zinc/32/78/34/918327834.db2.gz JKKPTGZPMLSWLG-UHFFFAOYSA-N 0 3 423.523 4.160 20 0 HIADHN CC(C)(CNC(=O)N[C@H](C[C@@H]1CCOC1)c1ccccc1)N1CCc2ccccc2C1 ZINC000509760728 918374975 /nfs/dbraw/zinc/37/49/75/918374975.db2.gz HITOAQIBEYWOQJ-GBXCKJPGSA-N 0 3 421.585 4.290 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)N[C@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000509778070 918389250 /nfs/dbraw/zinc/38/92/50/918389250.db2.gz SMEVLDLJLXADGU-OEMFJLHTSA-N 0 3 407.558 4.118 20 0 HIADHN CCN(C(=O)NC[C@@H]1CCCN1C)[C@@H]1CCSc2ccc(Br)cc21 ZINC000509787140 918395896 /nfs/dbraw/zinc/39/58/96/918395896.db2.gz NITTUVPQJWKFAE-GOEBONIOSA-N 0 3 412.397 4.112 20 0 HIADHN CCN(CC(=O)Nc1c(Cl)cccc1Cl)C(=O)[C@H](C)N1CCCCCC1 ZINC000509827248 918427509 /nfs/dbraw/zinc/42/75/09/918427509.db2.gz TZOCMHUGZJLICZ-AWEZNQCLSA-N 0 3 400.350 4.045 20 0 HIADHN CC[C@H](CNC(=O)N[C@H](COCC(C)C)c1ccco1)N1CCc2ccccc2C1 ZINC000509872065 918473576 /nfs/dbraw/zinc/47/35/76/918473576.db2.gz VVDLXJFHTFRXTI-FGZHOGPDSA-N 0 3 413.562 4.129 20 0 HIADHN CCC(=O)Nc1ccc(Cl)c(NC(=O)N[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000509947316 918542470 /nfs/dbraw/zinc/54/24/70/918542470.db2.gz CGFBSNVPEZZBAO-KRWDZBQOSA-N 0 3 400.910 4.085 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)Nc1ccc(Cl)c(F)c1 ZINC000509965045 918555973 /nfs/dbraw/zinc/55/59/73/918555973.db2.gz ZZCGPHRUTSFPSK-UHFFFAOYSA-N 0 3 404.917 4.203 20 0 HIADHN C[C@@H]1CCN(C(=O)c2cc(N(C)C)nc3ccccc32)CCN1Cc1ccccc1 ZINC000510027881 918603603 /nfs/dbraw/zinc/60/36/03/918603603.db2.gz ITHNTNBVBHLWGU-LJQANCHMSA-N 0 3 402.542 4.037 20 0 HIADHN CCc1cccc2c1OCC[C@H]2NC(=O)Nc1ccc(N2CCN(CC)CC2)cc1C ZINC000510060658 918630169 /nfs/dbraw/zinc/63/01/69/918630169.db2.gz KXRPZILBCLMSGT-HSZRJFAPSA-N 0 3 422.573 4.345 20 0 HIADHN COc1ccc([C@@H](CNC(=O)c2cc(C)ccc2-n2ccnc2)N2CCCCC2)cc1 ZINC000510183565 918734090 /nfs/dbraw/zinc/73/40/90/918734090.db2.gz VGGANPQRZMWNPJ-XMMPIXPASA-N 0 3 418.541 4.146 20 0 HIADHN CCCN(Cc1nnc(-c2ccc(C)cc2)o1)C1CCN(c2cc(C)nc(C)n2)CC1 ZINC000510247286 918784396 /nfs/dbraw/zinc/78/43/96/918784396.db2.gz WWFBMJWNGQDZPZ-UHFFFAOYSA-N 0 3 420.561 4.333 20 0 HIADHN C[C@@H](C(=O)N[C@@H](Cn1cnc2ccccc21)c1ccc(F)cc1)N1CCCCCC1 ZINC000510390429 918868989 /nfs/dbraw/zinc/86/89/89/918868989.db2.gz XYBRSKNXDWCYEB-AVRDEDQJSA-N 0 3 408.521 4.297 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3ccc(N(C)C)cc3C(F)(F)F)cc2)CC1 ZINC000510403571 918876321 /nfs/dbraw/zinc/87/63/21/918876321.db2.gz VZEIZBWSAYOWHG-UHFFFAOYSA-N 0 3 420.479 4.166 20 0 HIADHN O[C@H](COc1c(Cl)cccc1Cl)CN1CC[C@@H](n2ncc3ccccc32)C1 ZINC000510419052 918886230 /nfs/dbraw/zinc/88/62/30/918886230.db2.gz CFQKOMMQSDKSJR-CVEARBPZSA-N 0 3 406.313 4.030 20 0 HIADHN Cc1noc(C2(C)CCN(C[C@@H](O)COc3cc(C)c(Cl)cc3C(C)C)CC2)n1 ZINC000510425399 918889630 /nfs/dbraw/zinc/88/96/30/918889630.db2.gz NSZZCNDFWNKKIH-QGZVFWFLSA-N 0 3 421.969 4.257 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)NCc1cc(F)ccc1Br ZINC000510433332 918894096 /nfs/dbraw/zinc/89/40/96/918894096.db2.gz AKPPMOVWBALBJM-UHFFFAOYSA-N 0 3 405.267 4.326 20 0 HIADHN COc1cc([C@@H](C)NC(=O)N[C@@H](C)C2=CCN(C)CC2)ccc1OC1CCCC1 ZINC000510499697 918947977 /nfs/dbraw/zinc/94/79/77/918947977.db2.gz ITNXCGKBJCIHRK-DLBZAZTESA-N 0 3 401.551 4.027 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)NCc2ccc(OCC(F)(F)F)cc2)C1 ZINC000510532655 918979018 /nfs/dbraw/zinc/97/90/18/918979018.db2.gz WBVTYMSKFCSWAK-LPHOPBHVSA-N 0 3 421.463 4.262 20 0 HIADHN Cc1ccc(NC(=O)NC[C@H](Cc2ccccc2)N(C)C)c(OCC(F)(F)F)c1 ZINC000510536965 918982536 /nfs/dbraw/zinc/98/25/36/918982536.db2.gz ZPNZRCAJARQEFL-KRWDZBQOSA-N 0 3 409.452 4.231 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CC[C@H](n2ncc3ccccc32)C1)c1ccsc1 ZINC000510539925 918985202 /nfs/dbraw/zinc/98/52/02/918985202.db2.gz OECCBGMSGHWMEV-PZJWPPBQSA-N 0 3 411.575 4.137 20 0 HIADHN Cc1cccc(NC(=O)Nc2cccc(CNC(=O)N[C@@H](C)C3=CCN(C)CC3)c2)c1 ZINC000510541637 918987034 /nfs/dbraw/zinc/98/70/34/918987034.db2.gz SNCLLRPFNLNZAV-SFHVURJKSA-N 0 3 421.545 4.089 20 0 HIADHN Cc1sc(CNC(=O)N[C@@H](C)C2=CCN(C)CC2)nc1-c1ccc(Cl)cc1 ZINC000510544600 918989814 /nfs/dbraw/zinc/98/98/14/918989814.db2.gz DRRYCWISHDPFHC-ZDUSSCGKSA-N 0 3 404.967 4.222 20 0 HIADHN Cc1cc(Br)cc(C)c1N1CCC[C@H](N2CC[C@]3(C2)CCCOC3)C1=O ZINC000510615529 919057295 /nfs/dbraw/zinc/05/72/95/919057295.db2.gz CHRCAXORIOVFDW-RXVVDRJESA-N 0 3 421.379 4.064 20 0 HIADHN CCOC(=O)c1cnn(C2CCN(C[C@@H](OC)c3ccc(Cl)cc3)CC2)c1C ZINC000510634163 919074878 /nfs/dbraw/zinc/07/48/78/919074878.db2.gz OQCWIKLELQLNKK-HXUWFJFHSA-N 0 3 405.926 4.046 20 0 HIADHN CSc1ccccc1NC(=O)CN(C)C(=O)CN[C@@H](C)c1cccc2ccccc21 ZINC000510633168 919074955 /nfs/dbraw/zinc/07/49/55/919074955.db2.gz JRKKLEAQCGFUJE-KRWDZBQOSA-N 0 3 421.566 4.309 20 0 HIADHN O=C(Nc1cccc(CN[C@@H]2CCc3ccc(Br)cc32)c1)[C@H]1CCCO1 ZINC000510656078 919097834 /nfs/dbraw/zinc/09/78/34/919097834.db2.gz KNFOBDUPXWKNDG-WOJBJXKFSA-N 0 3 415.331 4.344 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3cc(Cl)c(OC)c(Cl)c3)cc2)CC1 ZINC000510662811 919103334 /nfs/dbraw/zinc/10/33/34/919103334.db2.gz YSINEZVHDMLGJM-UHFFFAOYSA-N 0 3 408.329 4.396 20 0 HIADHN CN(Cc1c(-c2ccccc2)nc2ccccn21)C[C@@H](O)COCc1ccccc1 ZINC000510691456 919127419 /nfs/dbraw/zinc/12/74/19/919127419.db2.gz SKXZNMOZJDWFSL-JOCHJYFZSA-N 0 3 401.510 4.011 20 0 HIADHN CCN(CC)C(=O)c1ccc(NC(=O)CN[C@H](c2ccc(OC)cc2)C(C)C)cc1 ZINC000510706785 919146094 /nfs/dbraw/zinc/14/60/94/919146094.db2.gz ZAQUVNLZSLUNRF-QHCPKHFHSA-N 0 3 411.546 4.103 20 0 HIADHN CCCOc1ccc(NC(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)cc1 ZINC000510710778 919149729 /nfs/dbraw/zinc/14/97/29/919149729.db2.gz FSMKWYOHYIHIBG-OALUTQOASA-N 0 3 403.567 4.219 20 0 HIADHN COc1ccc(-c2nc3c(s2)[C@H](NCc2ccc4c(c2)oc(=O)n4C)CCC3)cc1 ZINC000510713980 919155476 /nfs/dbraw/zinc/15/54/76/919155476.db2.gz CUNYBEYAXDRPGP-QGZVFWFLSA-N 0 3 421.522 4.431 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)Nc1ccccc1OC[C@H]1CCCCO1 ZINC000510747223 919197478 /nfs/dbraw/zinc/19/74/78/919197478.db2.gz GZQBXDFFICCFEM-JOCHJYFZSA-N 0 3 423.557 4.204 20 0 HIADHN FC(F)Cn1cc(CNCc2ccccc2-c2ccc(Cn3ccnc3)cc2)cn1 ZINC000510797599 919266922 /nfs/dbraw/zinc/26/69/22/919266922.db2.gz PGYHIGUGDLYAGY-UHFFFAOYSA-N 0 3 407.468 4.350 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)N1CCC(C(=O)Nc2ccc(F)cc2)CC1 ZINC000510836456 919317685 /nfs/dbraw/zinc/31/76/85/919317685.db2.gz LISBVZGGUMMNKV-UHFFFAOYSA-N 0 3 423.488 4.124 20 0 HIADHN C[C@@H](c1ccc(S(N)(=O)=O)cc1)N(C)CCSc1cc(Cl)ccc1Cl ZINC000510857655 919347236 /nfs/dbraw/zinc/34/72/36/919347236.db2.gz QEZBVIFKKRZPEN-LBPRGKRZSA-N 0 3 419.399 4.426 20 0 HIADHN CCN(CC)C(=O)c1cccc(NC(=O)CN[C@@H](C)c2ccc3c(c2)CCCC3)c1 ZINC000510857079 919348370 /nfs/dbraw/zinc/34/83/70/919348370.db2.gz NMANRKPFFSFWML-SFHVURJKSA-N 0 3 407.558 4.337 20 0 HIADHN O=C(CC(F)(F)F)NC[C@H]1CCCN(CCOc2cc(Cl)cc(Cl)c2)C1 ZINC000510873298 919367882 /nfs/dbraw/zinc/36/78/82/919367882.db2.gz DQVHKJFXHMWOSH-GFCCVEGCSA-N 0 3 413.267 4.153 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@H](C)N[C@@H]2CCc3cc(F)c(OC)cc32)cc1 ZINC000510962059 919501950 /nfs/dbraw/zinc/50/19/50/919501950.db2.gz YWJNSCDZQIQAJA-YCRPNKLZSA-N 0 3 420.550 4.203 20 0 HIADHN O=C(COc1ccccc1)N1CC[C@@H](N[C@H]2CCSc3c(Cl)cccc32)C1 ZINC000510979659 919532219 /nfs/dbraw/zinc/53/22/19/919532219.db2.gz PFRKSWJBJITYJH-BEFAXECRSA-N 0 3 402.947 4.146 20 0 HIADHN Cc1c(C(=O)NCC2(N3CCSCC3)CCCCC2)cnn1C1CCCCC1 ZINC000510985362 919539194 /nfs/dbraw/zinc/53/91/94/919539194.db2.gz JTBRXXGKALYGOY-UHFFFAOYSA-N 0 3 404.624 4.178 20 0 HIADHN COc1cccc(NC(=O)[C@H](N[C@@H](Cc2ccccc2)CN(C)C)c2ccccc2)c1 ZINC000511012080 919580095 /nfs/dbraw/zinc/58/00/95/919580095.db2.gz RQZYBLZWEWKEEJ-UKILVPOCSA-N 0 3 417.553 4.138 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)c1ccc2c(c1)[nH]c(=O)n2C1CCCC1 ZINC000511079107 919679734 /nfs/dbraw/zinc/67/97/34/919679734.db2.gz YXKLPAOPBKSFGU-QHCPKHFHSA-N 0 3 418.541 4.424 20 0 HIADHN CC[C@H](C)n1ncc2c1nc(C)cc2C(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000511087066 919691019 /nfs/dbraw/zinc/69/10/19/919691019.db2.gz XGEBQWYKBHAVLN-LPHOPBHVSA-N 0 3 411.575 4.339 20 0 HIADHN CN(CCCc1cc(-c2ccc(F)cc2)n[nH]1)C(=O)[C@H]1CCCN1Cc1ccccc1 ZINC000511105824 919712440 /nfs/dbraw/zinc/71/24/40/919712440.db2.gz KLDGMTKBVIFIHI-XMMPIXPASA-N 0 3 420.532 4.271 20 0 HIADHN CCCCc1ccc([C@H](NC(=O)CCN2CCN(CC)CC2)c2cccs2)cc1 ZINC000511114025 919724044 /nfs/dbraw/zinc/72/40/44/919724044.db2.gz GCVOJJRNOZAVSH-DEOSSOPVSA-N 0 3 413.631 4.324 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Nc1cc(F)c(Br)cc1F ZINC000511120321 919731674 /nfs/dbraw/zinc/73/16/74/919731674.db2.gz KWBHZBQRDGDUJF-UHFFFAOYSA-N 0 3 418.307 4.385 20 0 HIADHN C[C@@H](NC(=O)NCc1ccc(Oc2ccccc2F)c(F)c1)C1=CCN(C)CC1 ZINC000511266677 919864679 /nfs/dbraw/zinc/86/46/79/919864679.db2.gz FZIFSFQUHOFCST-OAHLLOKOSA-N 0 3 401.457 4.207 20 0 HIADHN C[C@@H](NC(=O)N[C@H]1CCCc2nc(-c3ccc(F)cc3)sc21)C1=CCN(C)CC1 ZINC000511293334 919890412 /nfs/dbraw/zinc/89/04/12/919890412.db2.gz ZAAYYDXTKAICRD-KUHUBIRLSA-N 0 3 414.550 4.276 20 0 HIADHN C[C@H]1CCCCN1C(=O)c1ccc(NC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000511298829 919895066 /nfs/dbraw/zinc/89/50/66/919895066.db2.gz WQOPMELHXNOLMS-WMZHIEFXSA-N 0 3 420.557 4.097 20 0 HIADHN C[C@@H](NC(=O)C1(c2cccc(Br)c2)CCCCC1)C1=CCN(C)CC1 ZINC000511335424 919926372 /nfs/dbraw/zinc/92/63/72/919926372.db2.gz VGHSSJGEJDSJGA-MRXNPFEDSA-N 0 3 405.380 4.418 20 0 HIADHN CCn1ncc2c1nc(-c1ccccc1)cc2C(=O)N(CCN(C)C)C1CCCCC1 ZINC000511339411 919930701 /nfs/dbraw/zinc/93/07/01/919930701.db2.gz IZTMZYGEHLUABX-UHFFFAOYSA-N 0 3 419.573 4.455 20 0 HIADHN C[C@H](NC(=O)c1cc(-c2ccco2)n(-c2cccc(Cl)c2)n1)C1=CCN(C)CC1 ZINC000511343679 919935284 /nfs/dbraw/zinc/93/52/84/919935284.db2.gz KOESFYZQTVHKRB-HNNXBMFYSA-N 0 3 410.905 4.166 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)N[C@H](c3ccc(F)cc3)C3CCC3)CC2)C[C@@H](C)O1 ZINC000511349218 919944038 /nfs/dbraw/zinc/94/40/38/919944038.db2.gz CSCWPLSAIBTENP-PNCHPQGNSA-N 0 3 417.569 4.198 20 0 HIADHN Cc1ccc(NC(=O)CSc2ccccc2C(=O)N[C@@H](C)C2=CCN(C)CC2)cc1 ZINC000511376889 919976665 /nfs/dbraw/zinc/97/66/65/919976665.db2.gz GQEOOTSPDHDDNX-SFHVURJKSA-N 0 3 423.582 4.106 20 0 HIADHN O[C@@H](CN[C@@H](Cc1ccc(Cl)cc1)c1ccccn1)COc1ccc(F)cc1 ZINC000511381226 919982986 /nfs/dbraw/zinc/98/29/86/919982986.db2.gz IHJDMLGHFOWRNC-UGKGYDQZSA-N 0 3 400.881 4.187 20 0 HIADHN CC(C)[C@H](CNC(=O)N(CCN(C)C)Cc1ccccn1)c1ccc(Cl)cc1 ZINC000511388775 919991468 /nfs/dbraw/zinc/99/14/68/919991468.db2.gz WIDJRICMUWHWBX-NRFANRHFSA-N 0 3 402.970 4.248 20 0 HIADHN CN(C)CCN(CC1CCCCC1)C(=O)N[C@@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000511390458 919997406 /nfs/dbraw/zinc/99/74/06/919997406.db2.gz IQGBWCHEUPOTMR-GMAHTHKFSA-N 0 3 401.595 4.308 20 0 HIADHN CN(C(=O)N[C@H](C[C@H]1CCOC1)c1ccccc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000511398716 920012005 /nfs/dbraw/zinc/01/20/05/920012005.db2.gz NXRSXVCWFSSWCR-GMKZXUHWSA-N 0 3 407.558 4.070 20 0 HIADHN COc1cc(OC)c(OC)cc1CN(C)CCCc1cc(-c2cccc(F)c2)n[nH]1 ZINC000511509831 920126992 /nfs/dbraw/zinc/12/69/92/920126992.db2.gz XHOCQPSEHXFPES-UHFFFAOYSA-N 0 3 413.493 4.306 20 0 HIADHN CN(C)[C@H](CNC(=O)Nc1ccc(C(=O)N2CCCCCC2)cc1)c1ccccc1 ZINC000511563594 920206956 /nfs/dbraw/zinc/20/69/56/920206956.db2.gz BZHBPZSUASNIFL-JOCHJYFZSA-N 0 3 408.546 4.127 20 0 HIADHN O=C(CN[C@H](c1cccc(OC(F)(F)F)c1)C1CC1)N1CCC[C@H](C(F)(F)F)C1 ZINC000511589225 920237824 /nfs/dbraw/zinc/23/78/24/920237824.db2.gz WUHGNPHJELWLSP-YOEHRIQHSA-N 0 3 424.385 4.427 20 0 HIADHN Cc1ccc2c(CN[C@](C)(CO)c3ccc(Br)cc3)ccc(O)c2n1 ZINC000511597199 920244357 /nfs/dbraw/zinc/24/43/57/920244357.db2.gz UJZLKFBQVJDAFW-HXUWFJFHSA-N 0 3 401.304 4.009 20 0 HIADHN CN(Cc1ccc(OC(F)F)cc1)C[C@@H](O)COc1ccc(C(F)(F)F)cc1 ZINC000511597912 920245963 /nfs/dbraw/zinc/24/59/63/920245963.db2.gz JRFGJMHSJMTQLU-OAHLLOKOSA-N 0 3 405.363 4.179 20 0 HIADHN O=C1[C@@H](N[C@@H](c2cccc(OC(F)(F)F)c2)C2CC2)CCCN1CC(F)(F)F ZINC000511622762 920278291 /nfs/dbraw/zinc/27/82/91/920278291.db2.gz LIAYXUOKLHRADW-LSDHHAIUSA-N 0 3 410.358 4.179 20 0 HIADHN O=C1[C@H](N[C@@H](c2cccc(OC(F)(F)F)c2)C2CC2)CCCN1CC(F)(F)F ZINC000511622760 920279893 /nfs/dbraw/zinc/27/98/93/920279893.db2.gz LIAYXUOKLHRADW-HUUCEWRRSA-N 0 3 410.358 4.179 20 0 HIADHN FC(F)(F)c1ccc(CN2CC[C@@H](Nc3cc(N4CCCCC4)ncn3)C2)cc1 ZINC000511670087 920336903 /nfs/dbraw/zinc/33/69/03/920336903.db2.gz FRLBDVNFVRHAMV-GOSISDBHSA-N 0 3 405.468 4.172 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)c2ccc(OCc3ccccc3)nc2)C1 ZINC000511678275 920342348 /nfs/dbraw/zinc/34/23/48/920342348.db2.gz XROXSAWAOYFLLC-AUSIDOKSSA-N 0 3 401.510 4.226 20 0 HIADHN O=C(COc1ccc(Cl)cc1)NC1CCC(NCc2nc(C3CC3)cs2)CC1 ZINC000511695984 920361911 /nfs/dbraw/zinc/36/19/11/920361911.db2.gz RPONQROLDIMKHV-UHFFFAOYSA-N 0 3 419.978 4.270 20 0 HIADHN C[C@@H](Sc1ccc(Br)cc1)C(=O)NC[C@H](c1ccccc1)N(C)C ZINC000511711509 920377720 /nfs/dbraw/zinc/37/77/20/920377720.db2.gz BNOOLBBIHIQFPM-RDTXWAMCSA-N 0 3 407.377 4.349 20 0 HIADHN CC(C)[C@H](NC(=O)CN1C[C@H](c2ccccc2)[C@@H]2COCC[C@@H]21)c1ccc(F)cc1 ZINC000511758092 920439212 /nfs/dbraw/zinc/43/92/12/920439212.db2.gz QOMDLXAFROCTRQ-FVEXOFTDSA-N 0 3 410.533 4.144 20 0 HIADHN Fc1cc(-c2noc(CN3C[C@H](c4ccccc4)[C@H]4COCC[C@H]43)n2)cc(F)c1F ZINC000511761408 920443583 /nfs/dbraw/zinc/44/35/83/920443583.db2.gz IMVUUSWRWCDZIR-GPMSIDNRSA-N 0 3 415.415 4.158 20 0 HIADHN O=C(CN1C[C@H](c2ccccc2)[C@@H]2COCC[C@@H]21)N(Cc1ccco1)c1ccccc1 ZINC000511764801 920447565 /nfs/dbraw/zinc/44/75/65/920447565.db2.gz ZILRIXNFGYHHNA-DSITVLBTSA-N 0 3 416.521 4.317 20 0 HIADHN C[C@H](CC(=O)Nc1cc(C(F)(F)F)ccc1Cl)N[C@@H](C)C(=O)N1CCCCC1 ZINC000511780462 920470304 /nfs/dbraw/zinc/47/03/04/920470304.db2.gz HXVKMKPLLGIPSG-OLZOCXBDSA-N 0 3 419.875 4.067 20 0 HIADHN Nc1nc(CN2C[C@H](c3ccccc3)[C@H]3COCC[C@H]32)nc2sc3c(c21)CCCC3 ZINC000511786288 920479385 /nfs/dbraw/zinc/47/93/85/920479385.db2.gz MHZCTWLTFCJAEF-GUDVDZBRSA-N 0 3 420.582 4.157 20 0 HIADHN O=C(CN1C[C@H](c2ccccc2)[C@@H]2CCC[C@@H]21)Nc1cccc(N2CCCC2=O)c1 ZINC000511839765 920551379 /nfs/dbraw/zinc/55/13/79/920551379.db2.gz WMWLNNODEJLXTK-ZRBLBEILSA-N 0 3 403.526 4.020 20 0 HIADHN CCOc1cc(CNC(=O)[C@H](C)N2CCC(Cc3ccccc3)CC2)ccc1OC ZINC000511865508 920593363 /nfs/dbraw/zinc/59/33/63/920593363.db2.gz YWUNWYHVUILFMZ-IBGZPJMESA-N 0 3 410.558 4.053 20 0 HIADHN Cc1nn(C)c(=O)c(-c2nc(CN3C[C@H](c4ccccc4)[C@H]4CCC[C@@H]43)cs2)c1C ZINC000511869718 920599212 /nfs/dbraw/zinc/59/92/12/920599212.db2.gz AGHWWDQLKYXUOQ-NJYVYQBISA-N 0 3 420.582 4.289 20 0 HIADHN CC(C)Cc1ccc([C@@H](CNC(=O)N[C@H](C)c2c(F)cncc2F)N(C)C)cc1 ZINC000511873535 920603198 /nfs/dbraw/zinc/60/31/98/920603198.db2.gz FZDVSPOBJUOAHA-FOIQADDNSA-N 0 3 404.505 4.221 20 0 HIADHN COc1cc(Cl)c(C)cc1NC(=O)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000511883268 920617916 /nfs/dbraw/zinc/61/79/16/920617916.db2.gz CWOWYYVZSAIQNA-UHFFFAOYSA-N 0 3 402.922 4.114 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)c2cnn(C3CCCCC3)c2C)cc1 ZINC000512003092 920770821 /nfs/dbraw/zinc/77/08/21/920770821.db2.gz VIEIUANQKPMIDQ-QHCPKHFHSA-N 0 3 410.562 4.272 20 0 HIADHN C[C@@H](CC(=O)Nc1cc(C(F)(F)F)ccc1Cl)N[C@@H](CO)c1ccccc1 ZINC000512031189 920804365 /nfs/dbraw/zinc/80/43/65/920804365.db2.gz OBIYIMUVRZTTHR-SJCJKPOMSA-N 0 3 400.828 4.399 20 0 HIADHN Ic1cnc(CNC[C@H]2CCCO[C@@H]2c2ccccc2)s1 ZINC000512082907 920846910 /nfs/dbraw/zinc/84/69/10/920846910.db2.gz MIBQBLPJFTUZEC-CZUORRHYSA-N 0 3 414.312 4.005 20 0 HIADHN COc1cc(CN[C@@H](C)c2cc(C)c(Br)s2)ccc1OCCO ZINC000512085616 920849282 /nfs/dbraw/zinc/84/92/82/920849282.db2.gz XHWYHFHKRBTIJO-LBPRGKRZSA-N 0 3 400.338 4.050 20 0 HIADHN COc1cc(CN[C@H](C)c2cc(C)c(Br)s2)ccc1OCCO ZINC000512085615 920849438 /nfs/dbraw/zinc/84/94/38/920849438.db2.gz XHWYHFHKRBTIJO-GFCCVEGCSA-N 0 3 400.338 4.050 20 0 HIADHN C[C@H](CC(=O)Nc1cc(C(F)(F)F)ccc1Cl)NCc1cccnc1N(C)C ZINC000512100243 920860580 /nfs/dbraw/zinc/86/05/80/920860580.db2.gz RLSAWUGCZWTBND-GFCCVEGCSA-N 0 3 414.859 4.327 20 0 HIADHN FC(F)(F)c1ccc(-n2cc(CNCc3ccc(Cn4ccnc4)cc3)cn2)cc1 ZINC000512128288 920877366 /nfs/dbraw/zinc/87/73/66/920877366.db2.gz GKSCQELOSKNFFV-UHFFFAOYSA-N 0 3 411.431 4.426 20 0 HIADHN Cc1cc([C@H](C)NCCCS(=O)(=O)c2ccccc2)sc1Br ZINC000512147005 920889738 /nfs/dbraw/zinc/88/97/38/920889738.db2.gz RVEHUQVKLAYLNN-ZDUSSCGKSA-N 0 3 402.379 4.334 20 0 HIADHN C[C@@H]1CSC[C@H]1NCC(=O)N1N=C(c2cc3ccccc3o2)C[C@H]1c1ccco1 ZINC000512171844 920908233 /nfs/dbraw/zinc/90/82/33/920908233.db2.gz ZFFGVTHHSSGJAB-OLMNPRSZSA-N 0 3 409.511 4.045 20 0 HIADHN CCN(CC)C(=O)C1CCN(Cc2ccc(OCc3cccs3)c(OC)c2)CC1 ZINC000512199837 920944734 /nfs/dbraw/zinc/94/47/34/920944734.db2.gz FDTUXACWGDWDCO-UHFFFAOYSA-N 0 3 416.587 4.416 20 0 HIADHN FC(F)(F)c1ccc(CN2CC[C@@H](NCc3cccc4c3OCCCO4)C2)cc1 ZINC000512244416 921000302 /nfs/dbraw/zinc/00/03/02/921000302.db2.gz POALRHFKAKBECQ-LJQANCHMSA-N 0 3 406.448 4.231 20 0 HIADHN CCN1CCN(CCC(=O)N(Cc2ccc(-c3ccccc3C)s2)C(C)C)CC1 ZINC000512280487 921036142 /nfs/dbraw/zinc/03/61/42/921036142.db2.gz KTCHLRXVDATPBZ-UHFFFAOYSA-N 0 3 413.631 4.488 20 0 HIADHN CCCN(Cc1nc2cc(F)ccc2n1CC)C1CCN(c2cc(C)nc(C)n2)CC1 ZINC000512283833 921039502 /nfs/dbraw/zinc/03/95/02/921039502.db2.gz URWHMSLNIVVAHB-UHFFFAOYSA-N 0 3 424.568 4.483 20 0 HIADHN C[C@@H](C(=O)Nc1ccc(CC(=O)N2CCc3ccccc32)cc1)N1[C@H](C)CC[C@H]1C ZINC000512295279 921052540 /nfs/dbraw/zinc/05/25/40/921052540.db2.gz ONDQTQSILJBKQN-QRVBRYPASA-N 0 3 405.542 4.018 20 0 HIADHN CN(CC(=O)N1CCC[C@H]1c1ccc2c(c1)OCCCO2)[C@@H]1CCc2ccccc2C1 ZINC000512323100 921074841 /nfs/dbraw/zinc/07/48/41/921074841.db2.gz LLNZIXHMLUNRPH-PKTZIBPZSA-N 0 3 420.553 4.001 20 0 HIADHN CCn1ccnc1[C@H]1OCC[C@@H]1NCc1ccc(OC)c(OCc2ccccc2)c1 ZINC000512344358 921088528 /nfs/dbraw/zinc/08/85/28/921088528.db2.gz WWSRTBAUVBBTJL-REWPJTCUSA-N 0 3 407.514 4.110 20 0 HIADHN CCn1ccnc1[C@H]1OCC[C@@H]1NCc1ccc(OCc2ccccc2)c(OC)c1 ZINC000512354758 921099763 /nfs/dbraw/zinc/09/97/63/921099763.db2.gz JZVGQMDBONZLLY-REWPJTCUSA-N 0 3 407.514 4.110 20 0 HIADHN Cc1ccc(-c2nc(CC(=O)N(CCN(C)C)Cc3ccc(F)c(F)c3)cs2)o1 ZINC000513494061 921845084 /nfs/dbraw/zinc/84/50/84/921845084.db2.gz FCEOABJMWLLTBB-UHFFFAOYSA-N 0 3 419.497 4.123 20 0 HIADHN O=C(NC[C@H]1CCCN1Cc1ccccc1)c1[nH]c2ccccc2c1Br ZINC000513555795 921891733 /nfs/dbraw/zinc/89/17/33/921891733.db2.gz YRQHAQCZPSDTAV-MRXNPFEDSA-N 0 3 412.331 4.325 20 0 HIADHN Cc1ccccc1C[C@H]1CCCN1C(=O)c1ccc(N2CCN(C(C)C)CC2)cc1 ZINC000513561350 921895849 /nfs/dbraw/zinc/89/58/49/921895849.db2.gz WCURKVIRFRKFDY-RUZDIDTESA-N 0 3 405.586 4.373 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2CNCc2csc(Br)c2)C[C@@H](C)O1 ZINC000513587812 921919584 /nfs/dbraw/zinc/91/95/84/921919584.db2.gz BDXBUJRLPSNQIZ-HUUCEWRRSA-N 0 3 409.393 4.410 20 0 HIADHN C[C@H]1CN(Cc2ccccc2CNCc2ccccc2OC(F)(F)F)C[C@H](C)O1 ZINC000513588050 921920405 /nfs/dbraw/zinc/92/04/05/921920405.db2.gz GVQCUSBGEKKPRL-IRXDYDNUSA-N 0 3 408.464 4.484 20 0 HIADHN CCCN(C)[C@H](CNC(=O)Nc1cccc(C(=O)N(C)C)c1)c1ccc(Cl)cc1 ZINC000513601561 921934459 /nfs/dbraw/zinc/93/44/59/921934459.db2.gz WAFRASUETOHBFQ-HXUWFJFHSA-N 0 3 416.953 4.246 20 0 HIADHN CCOc1ccc(CNCc2cc(Br)c(O)c(OCC)c2)cc1OC ZINC000513605313 921937623 /nfs/dbraw/zinc/93/76/23/921937623.db2.gz RBUJHXWHCACMGN-UHFFFAOYSA-N 0 3 410.308 4.251 20 0 HIADHN CNC(=O)COc1cccc(CNCc2cccc(OCc3ccccc3Cl)c2)c1 ZINC000513627012 921954698 /nfs/dbraw/zinc/95/46/98/921954698.db2.gz IVNGYUFUSLKBRD-UHFFFAOYSA-N 0 3 424.928 4.334 20 0 HIADHN COc1cc(CN[C@H](C)c2ccc3c(c2)OCC(=O)N3)ccc1OCc1ccccc1 ZINC000513660486 921983150 /nfs/dbraw/zinc/98/31/50/921983150.db2.gz IJGSTYKYBJAOIV-QGZVFWFLSA-N 0 3 418.493 4.456 20 0 HIADHN COc1ccc([C@H](C)N[C@@H](C)c2ccc3c(c2)OCC(=O)N3)cc1Br ZINC000513667533 921990262 /nfs/dbraw/zinc/99/02/62/921990262.db2.gz ROIPFSWVXFPHEC-RYUDHWBXSA-N 0 3 405.292 4.200 20 0 HIADHN COc1ccc([C@H](Cc2ccncc2)NCc2cc(OC)c(OC)c(OC)c2)cc1 ZINC000513666246 921990579 /nfs/dbraw/zinc/99/05/79/921990579.db2.gz KIADKLFSKDLWSC-NRFANRHFSA-N 0 3 408.498 4.190 20 0 HIADHN COc1ccc([C@H](C)N[C@H](C)c2ccccc2-n2ccnn2)cc1Br ZINC000513673703 921995195 /nfs/dbraw/zinc/99/51/95/921995195.db2.gz WEGSLFZSBKPKGI-UONOGXRCSA-N 0 3 401.308 4.450 20 0 HIADHN COc1cc(CN2CCC[C@H](c3nnc4n3CCC4)C2)ccc1OCc1cccs1 ZINC000513673355 921995806 /nfs/dbraw/zinc/99/58/06/921995806.db2.gz PQKKSGDJDSWUHW-SFHVURJKSA-N 0 3 424.570 4.253 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(OCCN[C@@H](C)c3cc(C)ccn3)c2)cc1 ZINC000513697317 922018589 /nfs/dbraw/zinc/01/85/89/922018589.db2.gz MBYFLTQDVYCWLY-SFHVURJKSA-N 0 3 405.498 4.381 20 0 HIADHN COc1ccc([C@H](Cc2ccncc2)N[C@@H]2CC(=O)N(c3ccccc3Cl)C2)cc1 ZINC000513707377 922026763 /nfs/dbraw/zinc/02/67/63/922026763.db2.gz BXGAIRXLYLUPEJ-KNQAVFIVSA-N 0 3 421.928 4.423 20 0 HIADHN O=C(Nc1cccc(CN2CCCN(c3cccnn3)CC2)c1)c1ccc(Cl)cc1 ZINC000513707967 922027054 /nfs/dbraw/zinc/02/70/54/922027054.db2.gz KYMPFHKIVGLOJJ-UHFFFAOYSA-N 0 3 421.932 4.095 20 0 HIADHN O=C(c1cnc(NC[C@H]2CCCN2Cc2ccccc2)c(Cl)c1)N1CCCCC1 ZINC000513762188 922080107 /nfs/dbraw/zinc/08/01/07/922080107.db2.gz YEYWLDKECVQWRM-HXUWFJFHSA-N 0 3 412.965 4.438 20 0 HIADHN CCc1cc(C(=O)N(C)C[C@@H]2CCN(C)[C@H]2c2cccnc2)c2c(n1)onc2C(C)C ZINC000513828929 922154721 /nfs/dbraw/zinc/15/47/21/922154721.db2.gz SDNIWBSNPOVVFE-JTSKRJEESA-N 0 3 421.545 4.069 20 0 HIADHN O=C(Nc1cccc(CN[C@@H]2CCc3c2cccc3Br)c1)[C@H]1CCCO1 ZINC000513873517 922203006 /nfs/dbraw/zinc/20/30/06/922203006.db2.gz ZELFQAJBFAHEOE-WOJBJXKFSA-N 0 3 415.331 4.344 20 0 HIADHN O=C(NCCc1ccc(Br)s1)NC[C@H](c1ccccc1)N1CCCC1 ZINC000513889145 922218098 /nfs/dbraw/zinc/21/80/98/922218098.db2.gz NJZMDWJSCZPSFN-QGZVFWFLSA-N 0 3 422.392 4.189 20 0 HIADHN CCOc1cc2c(cc1OCC)CN(C[C@H]1CCN(C(=O)c3ccccc3)C1)CC2 ZINC000513899601 922223695 /nfs/dbraw/zinc/22/36/95/922223695.db2.gz FZQKZJXPGULJPT-LJQANCHMSA-N 0 3 408.542 4.004 20 0 HIADHN COc1ccc(Br)cc1CN(C)C[C@H]1CCN(C(=O)c2ccccc2)C1 ZINC000513962573 922282054 /nfs/dbraw/zinc/28/20/54/922282054.db2.gz AJBMUECDSANVPH-MRXNPFEDSA-N 0 3 417.347 4.052 20 0 HIADHN C[C@@H](Cc1ccccc1Cl)C(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000514009547 922333846 /nfs/dbraw/zinc/33/38/46/922333846.db2.gz IBIRGRMQBFGLHH-KRWDZBQOSA-N 0 3 400.950 4.362 20 0 HIADHN C[C@H](Cc1ccccc1Cl)C(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000514009548 922334181 /nfs/dbraw/zinc/33/41/81/922334181.db2.gz IBIRGRMQBFGLHH-QGZVFWFLSA-N 0 3 400.950 4.362 20 0 HIADHN C[C@@H](Cc1ccccc1Cl)C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000514012751 922337011 /nfs/dbraw/zinc/33/70/11/922337011.db2.gz GIWCVSCXJWALJL-KRWDZBQOSA-N 0 3 418.940 4.317 20 0 HIADHN CCc1nn(C)c(CC)c1CN1CCC([C@@H]2c3ccc(Cl)cc3NC2=O)CC1 ZINC000514091534 922413893 /nfs/dbraw/zinc/41/38/93/922413893.db2.gz ZLGBFJAEDWFHIG-OAQYLSRUSA-N 0 3 400.954 4.146 20 0 HIADHN Cc1cccn2c(=O)cc(CN(Cc3ccc(Br)cc3)C(C)C)nc12 ZINC000514092888 922416292 /nfs/dbraw/zinc/41/62/92/922416292.db2.gz GYKOROIKEDGZLT-UHFFFAOYSA-N 0 3 400.320 4.176 20 0 HIADHN COc1ccc(C[C@@H](C)N[C@@H](CCSC)c2nnc3ccccn32)c(C)c1OC ZINC000514096199 922422513 /nfs/dbraw/zinc/42/25/13/922422513.db2.gz VCNFHGZBXZLBMI-QAPCUYQASA-N 0 3 414.575 4.070 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N[C@@H](C)c2ccc(NC(=O)C3CC3)cc2)N(C)C)cc1 ZINC000514101359 922429259 /nfs/dbraw/zinc/42/92/59/922429259.db2.gz DXWQRHURVYLLJM-JTSKRJEESA-N 0 3 408.546 4.007 20 0 HIADHN CCOc1cccc([C@H](C)NC(=O)NC[C@H](c2cccc(OC)c2)N2CCCC2)c1 ZINC000514154319 922491693 /nfs/dbraw/zinc/49/16/93/922491693.db2.gz SBKUSWHTVMUONF-FDDCHVKYSA-N 0 3 411.546 4.291 20 0 HIADHN O=C(NCc1ccnc(Oc2ccc(F)cc2)c1)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000514157303 922494558 /nfs/dbraw/zinc/49/45/58/922494558.db2.gz DBEKSSSECYGMGV-NRFANRHFSA-N 0 3 420.488 4.087 20 0 HIADHN CC(C)COc1cccc(CNC(=O)NC[C@@H](c2cccs2)N2CCCC2)c1 ZINC000514158848 922496516 /nfs/dbraw/zinc/49/65/16/922496516.db2.gz XBSUKQQJBHRWEE-FQEVSTJZSA-N 0 3 401.576 4.419 20 0 HIADHN CCn1c2ccccc2nc1[C@H]1CCCN1C(=O)NC[C@@H](Cc1ccccc1)N(C)C ZINC000514161503 922500078 /nfs/dbraw/zinc/50/00/78/922500078.db2.gz BEWKHYXQCNINPA-NFBKMPQASA-N 0 3 419.573 4.076 20 0 HIADHN COc1ccc([C@H]2CCCN2C(=O)CN2CCC[C@@H]2Cc2ccccc2C)c(OC)c1 ZINC000514171182 922509688 /nfs/dbraw/zinc/50/96/88/922509688.db2.gz YVIDBJHISVXASC-ZJSXRUAMSA-N 0 3 422.569 4.383 20 0 HIADHN CCC1CCC(N(CCCS(=O)(=O)c2ccc(NC(C)=O)cc2)C2CC2)CC1 ZINC000514227235 922562420 /nfs/dbraw/zinc/56/24/20/922562420.db2.gz OLHAJAAGGRTLFY-UHFFFAOYSA-N 0 3 406.592 4.242 20 0 HIADHN O=C(Nc1ccc(Br)cn1)[C@H]1CCCN(C/C=C/c2ccccc2)C1 ZINC000514231358 922568118 /nfs/dbraw/zinc/56/81/18/922568118.db2.gz WUUCPMTUEJJOOS-AUNFYEFLSA-N 0 3 400.320 4.208 20 0 HIADHN COc1cc(Br)ccc1CNCCc1nc(-c2cccc(Cl)c2)no1 ZINC000514249670 922590945 /nfs/dbraw/zinc/59/09/45/922590945.db2.gz IZQUUWQZUGJSHH-UHFFFAOYSA-N 0 3 422.710 4.493 20 0 HIADHN COc1ccc([C@H]2CCCN2C[C@H](O)COCc2ccccc2Cl)c(OC)c1 ZINC000514317597 922595465 /nfs/dbraw/zinc/59/54/65/922595465.db2.gz OAPRQRDSHVBIHL-LAUBAEHRSA-N 0 3 405.922 4.072 20 0 HIADHN C[C@H](NC(=O)NC[C@H](c1ccccc1)N(C)C)c1ccc(OCc2cccnc2)cc1 ZINC000514447040 922629691 /nfs/dbraw/zinc/62/96/91/922629691.db2.gz VUUIFLUOMIWPKX-YADARESESA-N 0 3 418.541 4.324 20 0 HIADHN COc1cccc([C@@H](CNC(=O)NCCc2cccc(Cl)c2)N2CCCC2)c1 ZINC000514458102 922635931 /nfs/dbraw/zinc/63/59/31/922635931.db2.gz CVSJLKJXBUHKDK-OAQYLSRUSA-N 0 3 401.938 4.027 20 0 HIADHN CCc1ccc([C@H](CNC(=O)Nc2cc(Cl)c(OC)cc2OC)N(C)C)cc1 ZINC000514508214 922660841 /nfs/dbraw/zinc/66/08/41/922660841.db2.gz AJRPTVKGNQVXHF-SFHVURJKSA-N 0 3 405.926 4.344 20 0 HIADHN CSc1ccc([C@@H](CNC[C@@H](O)C(F)(F)F)N2CCc3sccc3C2)cc1 ZINC000514700724 922765651 /nfs/dbraw/zinc/76/56/51/922765651.db2.gz LFAKDCPCHFEXAE-SJLPKXTDSA-N 0 3 416.534 4.082 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)c1cccc(-n2ccc(C(F)(F)F)n2)c1)c1ccco1 ZINC000514750653 922782290 /nfs/dbraw/zinc/78/22/90/922782290.db2.gz ZURUBKYQOWRNGI-RHSMWYFYSA-N 0 3 420.435 4.343 20 0 HIADHN COc1ccc(OC)c([C@H]2CCCN2C(=O)CN2CCC[C@@H]2Cc2ccccc2)c1 ZINC000514944275 922849308 /nfs/dbraw/zinc/84/93/08/922849308.db2.gz OCFGRJWFQACGHL-NFBKMPQASA-N 0 3 408.542 4.074 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)c1cn(C)c(=O)c2ccccc12)c1ccc(Cl)cc1 ZINC000514957394 922852983 /nfs/dbraw/zinc/85/29/83/922852983.db2.gz GRPQTTDYTNMIRY-NRFANRHFSA-N 0 3 411.933 4.005 20 0 HIADHN COc1ccc(OC(F)F)c(NC(=O)N[C@H]2CCN(Cc3ccccc3)[C@@H]2C)c1 ZINC000514962146 922854778 /nfs/dbraw/zinc/85/47/78/922854778.db2.gz CQQACEIFFJSWBT-PBHICJAKSA-N 0 3 405.445 4.081 20 0 HIADHN CC[C@H](CNC(=O)Nc1nnc(-c2ccccc2)s1)N1CCc2ccccc2C1 ZINC000515233475 923007518 /nfs/dbraw/zinc/00/75/18/923007518.db2.gz IBZZLHRUNROJTB-LJQANCHMSA-N 0 3 407.543 4.164 20 0 HIADHN CC(=O)N1C[C@@H]2CCC[C@H](N[C@@H](C)c3nnc(-c4ccc(Cl)c(Cl)c4)o3)[C@H]2C1 ZINC000515249776 923016392 /nfs/dbraw/zinc/01/63/92/923016392.db2.gz NFQPTIKCMCFHNL-HEWDHTHVSA-N 0 3 423.344 4.341 20 0 HIADHN COc1ccc([C@H](Cc2ccccc2)NCc2ccc(N3CCO[C@@H](C)C3)nc2)cc1 ZINC000515257046 923021429 /nfs/dbraw/zinc/02/14/29/923021429.db2.gz JKOLYQLJGZXTDU-CPJSRVTESA-N 0 3 417.553 4.389 20 0 HIADHN O=C(CCCc1ccccc1Cl)NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000515259483 923023210 /nfs/dbraw/zinc/02/32/10/923023210.db2.gz ROWYTCLPENXBGJ-NRFANRHFSA-N 0 3 400.950 4.070 20 0 HIADHN CN(Cc1ccc(OC(F)F)cc1)C(=O)CN1CCC[C@H]1Cc1ccc(F)cc1 ZINC000515508860 923141510 /nfs/dbraw/zinc/14/15/10/923141510.db2.gz MIOJJYBHJJJWDM-IBGZPJMESA-N 0 3 406.448 4.093 20 0 HIADHN COc1cccc([C@@H](C)N[C@@H](C)C(=O)N(C)Cc2ccc(Br)cc2)c1 ZINC000515736648 923312973 /nfs/dbraw/zinc/31/29/73/923312973.db2.gz OGQAKBNILFCXAU-CABCVRRESA-N 0 3 405.336 4.155 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)N[C@@H](C)c2nc3ccccc3n2C(F)F)o1 ZINC000515787706 923349712 /nfs/dbraw/zinc/34/97/12/923349712.db2.gz KRYSSKJXLONNJA-HNNXBMFYSA-N 0 3 419.476 4.167 20 0 HIADHN COc1ccc([C@H](CNC(=O)N[C@H](C)c2c(F)cccc2F)N2CCCC2)cc1 ZINC000515825739 923376458 /nfs/dbraw/zinc/37/64/58/923376458.db2.gz YCBVHYQMVVCQHZ-QRWLVFNGSA-N 0 3 403.473 4.171 20 0 HIADHN Cc1ccc(-n2ncc(C(=O)N3CCN([C@@H]4C[C@H]4C)C[C@@H](C)C3)c2C(F)(F)F)cc1 ZINC000515891519 923418284 /nfs/dbraw/zinc/41/82/84/923418284.db2.gz RPYHKWVCQYKJEI-GPMSIDNRSA-N 0 3 420.479 4.002 20 0 HIADHN Cc1cc(-c2noc(CCC(=O)N[C@H](CN3CCCC3)c3ccccc3)n2)ccc1F ZINC000516042725 923517195 /nfs/dbraw/zinc/51/71/95/923517195.db2.gz FVXWZOAMVYMOHE-OAQYLSRUSA-N 0 3 422.504 4.070 20 0 HIADHN COCCOc1ccc(NC(=O)NC[C@H](c2ccccc2)N2CCCC2)cc1Cl ZINC000516086183 923536796 /nfs/dbraw/zinc/53/67/96/923536796.db2.gz JJEAQLMBNKXYFM-HXUWFJFHSA-N 0 3 417.937 4.324 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)Nc2ccc(OCCOC)c(Cl)c2)N(C)C)cc1 ZINC000516086115 923537073 /nfs/dbraw/zinc/53/70/73/923537073.db2.gz GSGJTZZLHWSGSU-HXUWFJFHSA-N 0 3 419.953 4.352 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)NCc2cc(F)cc(Br)c2)C1 ZINC000516165067 923584352 /nfs/dbraw/zinc/58/43/52/923584352.db2.gz LWOYMHXKGUFDKP-IFXJQAMLSA-N 0 3 420.326 4.223 20 0 HIADHN COc1ccc([C@H](CNC(=O)N[C@@H]2CCc3c2cccc3Cl)N2CCCC2)cc1 ZINC000516226051 923613982 /nfs/dbraw/zinc/61/39/82/923613982.db2.gz RIJKTPWZBKKGJC-YADHBBJMSA-N 0 3 413.949 4.472 20 0 HIADHN Cc1ccc(C(=O)C2CCN(C(=O)N[C@@H](C)CN3C[C@H](C)C[C@H](C)C3)CC2)c(C)c1 ZINC000516242343 923623296 /nfs/dbraw/zinc/62/32/96/923623296.db2.gz FDMNNWHYXHEUJO-ZVDOUQERSA-N 0 3 413.606 4.274 20 0 HIADHN COc1ccc([C@H]2CCCCCN2C(=O)[C@H]2CCCN(Cc3cccnc3)C2)cc1 ZINC000516331371 923670179 /nfs/dbraw/zinc/67/01/79/923670179.db2.gz VYLSCUDYYLLWNQ-LADGPHEKSA-N 0 3 407.558 4.446 20 0 HIADHN C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000516437366 923731803 /nfs/dbraw/zinc/73/18/03/923731803.db2.gz CNFLASWUIVBORU-OIISXLGYSA-N 0 3 404.423 4.333 20 0 HIADHN O=C(CSc1ccc(Cl)cc1)NCCCCN1CCN(c2ccccc2)CC1 ZINC000516525808 923779362 /nfs/dbraw/zinc/77/93/62/923779362.db2.gz IABXXIAWOLFKPW-UHFFFAOYSA-N 0 3 418.006 4.151 20 0 HIADHN O=C(N[C@H]1CCCN(Cc2ccccc2)C1)N(Cc1ccccc1)C[C@H]1CCCO1 ZINC000516590058 923804832 /nfs/dbraw/zinc/80/48/32/923804832.db2.gz KSTLCBXRCGXATL-BJKOFHAPSA-N 0 3 407.558 4.042 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)CCCc3ccccc3Cl)CC2)C[C@@H](C)O1 ZINC000516607797 923814524 /nfs/dbraw/zinc/81/45/24/923814524.db2.gz BHLBKRQILGMHFI-RTBURBONSA-N 0 3 406.998 4.401 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)N(C)Cc2csc(Br)c2)C1 ZINC000516709001 923857125 /nfs/dbraw/zinc/85/71/25/923857125.db2.gz RTOZJLDHSGXSKB-WMLDXEAASA-N 0 3 422.392 4.488 20 0 HIADHN C[C@@H](C(=O)N1Cc2cnn(-c3ccccc3)c2C1)N1CCC(Cc2ccccc2)CC1 ZINC000516890150 923928541 /nfs/dbraw/zinc/92/85/41/923928541.db2.gz WTKZTURINHFCCY-FQEVSTJZSA-N 0 3 414.553 4.058 20 0 HIADHN CC(C)n1cnnc1-c1ccccc1NC(=O)N[C@H](C)CN(C)Cc1ccccc1 ZINC000516993634 923957219 /nfs/dbraw/zinc/95/72/19/923957219.db2.gz ABIQTLHWZSGDOU-GOSISDBHSA-N 0 3 406.534 4.168 20 0 HIADHN Cc1cc(=O)[nH]c2cc(C(=O)NC[C@@H](c3ccccc3)N3CCC(C)CC3)ccc12 ZINC000517055726 923977510 /nfs/dbraw/zinc/97/75/10/923977510.db2.gz SIJFFQMOIVMERM-QHCPKHFHSA-N 0 3 403.526 4.452 20 0 HIADHN COc1cccc(OC)c1OCCCCN1CCN([C@@H](C)c2ccsc2)CC1 ZINC000517257681 924064217 /nfs/dbraw/zinc/06/42/17/924064217.db2.gz AISZPTSIMQDPED-SFHVURJKSA-N 0 3 404.576 4.303 20 0 HIADHN COc1cccc([C@H]2C[C@@H]2C(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)c1 ZINC000517335816 924109856 /nfs/dbraw/zinc/10/98/56/924109856.db2.gz SCXYOERJIRLFFX-RTWAWAEBSA-N 0 3 420.475 4.408 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)NCc2ccc(Br)cc2)C1 ZINC000517340690 924113253 /nfs/dbraw/zinc/11/32/53/924113253.db2.gz BMZXCELVJFZWPK-DNVCBOLYSA-N 0 3 402.336 4.084 20 0 HIADHN COCCN(CCN(C)C)C(=O)N[C@H](C)c1sc(-c2ccc(Cl)cc2)nc1C ZINC000517368584 924138487 /nfs/dbraw/zinc/13/84/87/924138487.db2.gz SOUSBIWRUHZYOH-OAHLLOKOSA-N 0 3 424.998 4.053 20 0 HIADHN C[C@H](NC(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1)c1nc(C(C)(C)C)cs1 ZINC000517373104 924141371 /nfs/dbraw/zinc/14/13/71/924141371.db2.gz HSZXZFXCKAXSTO-BBWFWOEESA-N 0 3 422.639 4.032 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)COc1ccccc1OCc1ccccc1 ZINC000517389991 924153454 /nfs/dbraw/zinc/15/34/54/924153454.db2.gz YZYNFBCYQKMYFW-UHFFFAOYSA-N 0 3 420.509 4.353 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)NCCCc1c[nH]c2ccccc12 ZINC000517424408 924173867 /nfs/dbraw/zinc/17/38/67/924173867.db2.gz NQRKYLQVQJCSPQ-UHFFFAOYSA-N 0 3 414.500 4.152 20 0 HIADHN COc1ccccc1[C@H](NC(=O)NC[C@@H](c1ccccc1)N(C)C)c1ccccc1 ZINC000517474742 924216722 /nfs/dbraw/zinc/21/67/22/924216722.db2.gz UWULWDDEORIBSB-LADGPHEKSA-N 0 3 403.526 4.387 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)NCc2ccccc2OCC(F)(F)F)C1 ZINC000517542943 924254988 /nfs/dbraw/zinc/25/49/88/924254988.db2.gz GWEQULQUIOODDO-APWZRJJASA-N 0 3 421.463 4.262 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)NCc2ccccc2OCC(F)(F)F)C1 ZINC000517542946 924255489 /nfs/dbraw/zinc/25/54/89/924255489.db2.gz GWEQULQUIOODDO-LPHOPBHVSA-N 0 3 421.463 4.262 20 0 HIADHN O=C([C@H](Cc1ccccc1)NCc1ccc(-n2cnc3ccccc32)cc1)N1CCCC1 ZINC000517544370 924256834 /nfs/dbraw/zinc/25/68/34/924256834.db2.gz JQXPGQSTKUZQPJ-VWLOTQADSA-N 0 3 424.548 4.349 20 0 HIADHN Cc1[nH]c2c(cc(C)cc2CNCc2ccccc2OCC(=O)N2CCCC2)c1C ZINC000517547395 924258027 /nfs/dbraw/zinc/25/80/27/924258027.db2.gz QPQMCXGANFSJOP-UHFFFAOYSA-N 0 3 405.542 4.384 20 0 HIADHN COc1c(Cl)cc(Cl)cc1CNC[C@@H](c1cccc(F)c1)N1CCOCC1 ZINC000517549928 924260286 /nfs/dbraw/zinc/26/02/86/924260286.db2.gz DHDXHBFUVFAHSC-IBGZPJMESA-N 0 3 413.320 4.304 20 0 HIADHN O=C(c1ccc(CNCc2cccc(Oc3ccccc3)c2)cc1)N1CCOCC1 ZINC000517550920 924261625 /nfs/dbraw/zinc/26/16/25/924261625.db2.gz UJUZWEUYNVASDX-UHFFFAOYSA-N 0 3 402.494 4.241 20 0 HIADHN Cc1ccc(C(=O)C2CCN(C(=O)NCC(C)(C)N3CCC[C@@H](C)C3)CC2)c(C)c1 ZINC000517589860 926700685 /nfs/dbraw/zinc/70/06/85/926700685.db2.gz CEVYRQSXCPIUKL-LJQANCHMSA-N 0 3 413.606 4.418 20 0 HIADHN C[C@@H](C(=O)N1CCCCC1)N(C)CCCCCc1cc(-c2cccc(F)c2)n[nH]1 ZINC000517599225 926708373 /nfs/dbraw/zinc/70/83/73/926708373.db2.gz VUDHMXGLCTWFGV-SFHVURJKSA-N 0 3 400.542 4.261 20 0 HIADHN Cc1ccc(-c2cc(C(=O)N(C)[C@H]3CCN(C4CC4)C3)c3cnn(C(C)C)c3n2)s1 ZINC000517648803 926755882 /nfs/dbraw/zinc/75/58/82/926755882.db2.gz XPNSQBBAROLOKL-KRWDZBQOSA-N 0 3 423.586 4.358 20 0 HIADHN COc1cccc(CCNCc2nc(-c3cccc(Br)c3)c[nH]2)c1OC ZINC000517711353 926807501 /nfs/dbraw/zinc/80/75/01/926807501.db2.gz KCQNBXNGOYKIJA-UHFFFAOYSA-N 0 3 416.319 4.189 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N1CCC[C@H]1Cc1ccc(F)cc1 ZINC000517724089 926814807 /nfs/dbraw/zinc/81/48/07/926814807.db2.gz GMSVGEPRDLENAK-VQTJNVASSA-N 0 3 401.551 4.441 20 0 HIADHN COCCCN(C(=O)C[C@@H](C)c1cccc(C(F)(F)F)c1)C1CCN(C)CC1 ZINC000517792486 926839272 /nfs/dbraw/zinc/83/92/72/926839272.db2.gz VBQYGZTVACUQPA-MRXNPFEDSA-N 0 3 400.485 4.158 20 0 HIADHN CN(C)CCN(CC1CCCCC1)C(=O)CCCc1nc(-c2cccs2)no1 ZINC000517823834 926852866 /nfs/dbraw/zinc/85/28/66/926852866.db2.gz IAOJJCXRKTVPCA-UHFFFAOYSA-N 0 3 404.580 4.091 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)NC[C@@H]1CCCO[C@H]1C(C)(C)C ZINC000518002920 926943119 /nfs/dbraw/zinc/94/31/19/926943119.db2.gz QFOFXKFSUDAMRQ-FCHUYYIVSA-N 0 3 403.611 4.034 20 0 HIADHN CC(C)N1CC[C@@H](NCc2cc(F)cc3c2OCOC3)[C@H]1c1ccc(F)c(F)c1 ZINC000518221985 927086822 /nfs/dbraw/zinc/08/68/22/927086822.db2.gz LAXMCTFBYQEBSD-NHCUHLMSSA-N 0 3 406.448 4.284 20 0 HIADHN CCN(C(=O)c1ccc(N2CCN(C(C)C)CC2)cc1)[C@H](C)Cc1ccc(OC)cc1 ZINC000518233756 927095879 /nfs/dbraw/zinc/09/58/79/927095879.db2.gz NUUBHYPDGJLFOL-OAQYLSRUSA-N 0 3 423.601 4.319 20 0 HIADHN c1ncn(-c2ccc(CNCc3cn(-c4ccccc4)nc3-c3ccccc3)cc2)n1 ZINC000518269770 927128168 /nfs/dbraw/zinc/12/81/68/927128168.db2.gz QLYRJSYJVPFULY-UHFFFAOYSA-N 0 3 406.493 4.410 20 0 HIADHN Cc1cc(OC(C)C)ccc1NC(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000518315933 927178971 /nfs/dbraw/zinc/17/89/71/927178971.db2.gz KQCQAISVJLLVAH-KDURUIRLSA-N 0 3 403.567 4.135 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)N(Cc1ccccc1)c1ccccn1 ZINC000518371083 927226358 /nfs/dbraw/zinc/22/63/58/927226358.db2.gz NFHNWMXBDFRNGQ-UHFFFAOYSA-N 0 3 414.553 4.217 20 0 HIADHN CC(=O)Nc1cccc([C@H](C)NC(=O)[C@@H](C)N2CCC(Cc3ccccc3)CC2)c1 ZINC000518389243 927234790 /nfs/dbraw/zinc/23/47/90/927234790.db2.gz KVVZYHXMUZHPSA-RBUKOAKNSA-N 0 3 407.558 4.165 20 0 HIADHN CC(=O)Nc1cccc([C@@H](C)NC(=O)[C@H](C)N2CCC(Cc3ccccc3)CC2)c1 ZINC000518389241 927235676 /nfs/dbraw/zinc/23/56/76/927235676.db2.gz KVVZYHXMUZHPSA-MOPGFXCFSA-N 0 3 407.558 4.165 20 0 HIADHN CC[C@H](NC(=O)N[C@H]1CCN([C@H](C)c2ccccc2)C1)c1ccc2c(c1)OCCO2 ZINC000518406876 927247265 /nfs/dbraw/zinc/24/72/65/927247265.db2.gz JTCIYGHYRXCRJZ-QMMLZNLJSA-N 0 3 409.530 4.044 20 0 HIADHN C[C@H](CNC(=O)NCc1cccc(NC(=O)C2CCCC2)c1)N(C)Cc1ccccc1 ZINC000518452592 927285526 /nfs/dbraw/zinc/28/55/26/927285526.db2.gz MXLJWMPEPZTLRS-LJQANCHMSA-N 0 3 422.573 4.135 20 0 HIADHN CC(C)[C@@H](CNC(=O)Cc1coc(-c2cccs2)n1)N1CCc2ccccc2C1 ZINC000518501012 927312106 /nfs/dbraw/zinc/31/21/06/927312106.db2.gz MDVUIFJPWAOXLX-HXUWFJFHSA-N 0 3 409.555 4.145 20 0 HIADHN Cc1ccccc1CN1CCCN(C(=O)CN(C)[C@H](C)c2cc(F)ccc2F)CC1 ZINC000518513025 927318558 /nfs/dbraw/zinc/31/85/58/927318558.db2.gz MHBXLVNMBHTQSN-LJQANCHMSA-N 0 3 415.528 4.001 20 0 HIADHN CCOc1c(OC)cc(CN[C@H](c2ccc3[nH]c(=O)oc3c2)C(C)C)cc1OC ZINC000518584658 927363831 /nfs/dbraw/zinc/36/38/31/927363831.db2.gz LCPFLVVCILZZPP-FQEVSTJZSA-N 0 3 400.475 4.436 20 0 HIADHN Cc1cc(SCC(=O)N2CC[C@@H](N3CCCCC3)C2)c(C)cc1Br ZINC000518637673 927395687 /nfs/dbraw/zinc/39/56/87/927395687.db2.gz UPPJNEVKKVSLMF-MRXNPFEDSA-N 0 3 411.409 4.245 20 0 HIADHN O=C(NCc1ccc(COc2ccccc2)cc1)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000518644033 927398745 /nfs/dbraw/zinc/39/87/45/927398745.db2.gz POONGANUNRHLBY-XMMPIXPASA-N 0 3 415.537 4.189 20 0 HIADHN O=C(NCc1ccc(COc2ccccc2)cc1)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000518644032 927399261 /nfs/dbraw/zinc/39/92/61/927399261.db2.gz POONGANUNRHLBY-DEOSSOPVSA-N 0 3 415.537 4.189 20 0 HIADHN Cc1ccc(-n2nc(C(=O)NC[C@H](c3ccccc3)N(C)C)c3c2CCCC3)cc1 ZINC000518644777 927399947 /nfs/dbraw/zinc/39/99/47/927399947.db2.gz MANYQOMTAYRMBS-HSZRJFAPSA-N 0 3 402.542 4.092 20 0 HIADHN COc1ccc([C@H](CNc2nc(C(F)F)nc3ccccc32)N(C)C)cc1OC ZINC000518705807 927447700 /nfs/dbraw/zinc/44/77/00/927447700.db2.gz BQZAONSCGWZZEX-INIZCTEOSA-N 0 3 402.445 4.299 20 0 HIADHN COC(=O)c1cc(C)nc(NC[C@H]2CCCN(C)[C@@H]2c2ccc(C(F)(F)F)cc2)n1 ZINC000518809209 927506963 /nfs/dbraw/zinc/50/69/63/927506963.db2.gz JKQDEECJCQFOCK-CRAIPNDOSA-N 0 3 422.451 4.085 20 0 HIADHN CN(CCCCCc1cc(-c2cccc(F)c2)n[nH]1)CC(=O)N1CCCCCC1 ZINC000518837071 927535164 /nfs/dbraw/zinc/53/51/64/927535164.db2.gz CAXPONQYXQFPEX-UHFFFAOYSA-N 0 3 400.542 4.263 20 0 HIADHN OCCCN(Cc1ccc(Cl)c(Cl)c1)C[C@@H](O)COc1ccccc1Cl ZINC000518839864 927540614 /nfs/dbraw/zinc/54/06/14/927540614.db2.gz XRHCAGUJZKFTKZ-OAHLLOKOSA-N 0 3 418.748 4.271 20 0 HIADHN CSc1ccc(O[C@H](C)C(=O)N2CCN(c3ccnc4ccccc43)CC2)cc1 ZINC000518853708 927557615 /nfs/dbraw/zinc/55/76/15/927557615.db2.gz MQUJERVSFPEVQA-QGZVFWFLSA-N 0 3 407.539 4.073 20 0 HIADHN O=C(c1cnn(-c2ccccc2)c1)N(CCN1CCCC1)Cc1ccc(Cl)cc1 ZINC000518879850 927592931 /nfs/dbraw/zinc/59/29/31/927592931.db2.gz HQKMHPBGPNMREM-UHFFFAOYSA-N 0 3 408.933 4.264 20 0 HIADHN O=C(c1cc(F)cc2nc[nH]c21)N(CCN1CCCC1)Cc1ccc(Cl)cc1 ZINC000518942009 927645807 /nfs/dbraw/zinc/64/58/07/927645807.db2.gz PNJCXWHRHXKFSR-UHFFFAOYSA-N 0 3 400.885 4.094 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)Nc2cccc(OC[C@H]3CCCO3)c2)N(C)C)cc1 ZINC000519011328 927691558 /nfs/dbraw/zinc/69/15/58/927691558.db2.gz YHFUNRJRAFZTGX-DHIUTWEWSA-N 0 3 411.546 4.231 20 0 HIADHN COCCOc1c(Cl)cccc1NC(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000519244158 927844457 /nfs/dbraw/zinc/84/44/57/927844457.db2.gz AEKFKICTAICUOM-QGZVFWFLSA-N 0 3 423.966 4.385 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2nccnc2-c2nc3ccccc3s2)N(C)C)cc1 ZINC000519279475 927861575 /nfs/dbraw/zinc/86/15/75/927861575.db2.gz UKZBKQUQSMALNZ-GOSISDBHSA-N 0 3 417.538 4.094 20 0 HIADHN Cc1nc(COc2ccc(F)cc2)sc1C(=O)NCCN1[C@H](C)CCC[C@@H]1C ZINC000519360032 927897052 /nfs/dbraw/zinc/89/70/52/927897052.db2.gz IKGUPYCWXBAMRC-GASCZTMLSA-N 0 3 405.539 4.162 20 0 HIADHN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N(CCN(C)C)Cc1cccc(Cl)c1 ZINC000519412314 927931443 /nfs/dbraw/zinc/93/14/43/927931443.db2.gz CDIUZUBDNGWTLA-OAHLLOKOSA-N 0 3 421.950 4.319 20 0 HIADHN O=C(CS(=O)(=O)c1ccc(Cl)cc1)Nc1ccc(CN2CCCCCC2)cc1 ZINC000519434641 927945778 /nfs/dbraw/zinc/94/57/78/927945778.db2.gz XEXPSSCXLVCVNO-UHFFFAOYSA-N 0 3 420.962 4.128 20 0 HIADHN O=C([C@H]1CCCN(Cc2cccc(F)c2)C1)N1CCC(c2c[nH]c3ncccc23)CC1 ZINC000519445808 927953535 /nfs/dbraw/zinc/95/35/35/927953535.db2.gz YPIGMOJXYAQBID-FQEVSTJZSA-N 0 3 420.532 4.320 20 0 HIADHN Cc1ccc(Cc2nnc(NC(=O)NC[C@H](c3ccc(C)cc3)N(C)C)s2)cc1 ZINC000519451206 927958687 /nfs/dbraw/zinc/95/86/87/927958687.db2.gz TYNGNTARPIXQQA-LJQANCHMSA-N 0 3 409.559 4.170 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)Nc1nc(C(F)(F)F)cs1 ZINC000519503753 927996824 /nfs/dbraw/zinc/99/68/24/927996824.db2.gz FHJAZFVLBLVCDO-UHFFFAOYSA-N 0 3 408.396 4.036 20 0 HIADHN COc1ccc(CN[C@H](Cc2ccccc2)C(=O)NCc2ccccc2)c(C)c1OC ZINC000519559112 928015337 /nfs/dbraw/zinc/01/53/37/928015337.db2.gz PSQPPOHCQQFYCW-HSZRJFAPSA-N 0 3 418.537 4.030 20 0 HIADHN CN(C(=O)c1ccc(NCc2ccc(Br)s2)cc1)[C@@H]1CCCN(C)C1 ZINC000519770417 928069910 /nfs/dbraw/zinc/06/99/10/928069910.db2.gz ZRDFJBUKYHDYQO-MRXNPFEDSA-N 0 3 422.392 4.289 20 0 HIADHN Cc1cccc(CN(CC(C)C)C(=O)NCc2ccc(CN3CCN(C)CC3)cc2)c1 ZINC000519896902 928130319 /nfs/dbraw/zinc/13/03/19/928130319.db2.gz KPRRQMQMUANRJC-UHFFFAOYSA-N 0 3 422.617 4.110 20 0 HIADHN O[C@H](COC(c1ccc(Cl)cc1)c1ccc(Cl)cc1)CN1CCCOCC1 ZINC000519906267 928140101 /nfs/dbraw/zinc/14/01/01/928140101.db2.gz UJEUJVBUHCGICT-FQEVSTJZSA-N 0 3 410.341 4.183 20 0 HIADHN Cc1ccc(C(=O)C2CCN(C(=O)[C@H]3CCCN(Cc4ccccc4)C3)CC2)cc1 ZINC000519920252 928152827 /nfs/dbraw/zinc/15/28/27/928152827.db2.gz MEJCFADSOLGWTQ-DEOSSOPVSA-N 0 3 404.554 4.329 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)NCc2ccc(OC(F)F)cc2)N2CCCC2)cc1 ZINC000519935845 928170518 /nfs/dbraw/zinc/17/05/18/928170518.db2.gz FGHBVVPTSVMSLD-HXUWFJFHSA-N 0 3 403.473 4.233 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N2CCC(Oc3ccc(F)cc3F)CC2)N(C)C)cc1 ZINC000520068322 928292148 /nfs/dbraw/zinc/29/21/48/928292148.db2.gz METSFVLOGAKUSF-NRFANRHFSA-N 0 3 417.500 4.129 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)c1cnc2onc(C(C)(C)C)c2c1 ZINC000520105386 928314324 /nfs/dbraw/zinc/31/43/24/928314324.db2.gz GDYQMQOUHMUMBP-UHFFFAOYSA-N 0 3 416.472 4.003 20 0 HIADHN CCN(Cc1ccc(OC)cc1OC)C(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000520153801 928345904 /nfs/dbraw/zinc/34/59/04/928345904.db2.gz XVFNUDCCACLVCB-RXVVDRJESA-N 0 3 411.546 4.071 20 0 HIADHN CC(C)Oc1ccc([C@H](C)NC(=O)N(CCN(C)C)Cc2cccc(F)c2)cc1 ZINC000520263672 928428615 /nfs/dbraw/zinc/42/86/15/928428615.db2.gz DVUZXNPAUMWQBA-SFHVURJKSA-N 0 3 401.526 4.447 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)NCC1(Sc2ccccc2)CC1 ZINC000520286670 928448578 /nfs/dbraw/zinc/44/85/78/928448578.db2.gz RGICZNVJMCCANN-UHFFFAOYSA-N 0 3 419.541 4.363 20 0 HIADHN C[C@H](C(=O)NC1CCC(C)CC1)N(C)CCCc1cc(-c2cccc(F)c2)n[nH]1 ZINC000520287671 928449665 /nfs/dbraw/zinc/44/96/65/928449665.db2.gz BNJYNUBMTUWUJL-OHTSDLOESA-N 0 3 400.542 4.164 20 0 HIADHN Clc1ccc(-c2cc(-c3nc(-c4ccc(CN5CCOCC5)cc4)no3)[nH]n2)cc1 ZINC000520298536 928460272 /nfs/dbraw/zinc/46/02/72/928460272.db2.gz MNBGCKLGKMDXIR-UHFFFAOYSA-N 0 3 421.888 4.279 20 0 HIADHN COc1ccc(-c2[nH]c3ccccc3c2CCC(=O)N(C)[C@H]2CCN(C3CC3)C2)cc1 ZINC000520318608 928480943 /nfs/dbraw/zinc/48/09/43/928480943.db2.gz YCFLGMDOPPLNAW-FQEVSTJZSA-N 0 3 417.553 4.471 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1ccccc1-c1nncn1CC)c1ccsc1 ZINC000520331008 928494681 /nfs/dbraw/zinc/49/46/81/928494681.db2.gz JMRLLCQPOHBLIL-LJQANCHMSA-N 0 3 412.563 4.231 20 0 HIADHN C[C@@H](NC(=O)NC[C@@H](C)N(C)Cc1ccccc1)c1nc2ccccc2n1C(F)F ZINC000520380583 928532996 /nfs/dbraw/zinc/53/29/96/928532996.db2.gz BIQOVYPZVXBWRU-HZPDHXFCSA-N 0 3 415.488 4.312 20 0 HIADHN COc1cc2c(cc1OC)CN(C(=O)CN1CCC[C@@H]1c1ccc(C)c(C)c1)CC2 ZINC000520386188 928539455 /nfs/dbraw/zinc/53/94/55/928539455.db2.gz SZEYPYCNMZIEKT-JOCHJYFZSA-N 0 3 408.542 4.042 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1c(C)nsc1NC)c1ccc(C(F)(F)F)cc1 ZINC000520450035 928571888 /nfs/dbraw/zinc/57/18/88/928571888.db2.gz ZLKVXAXKIACXGF-OAHLLOKOSA-N 0 3 414.497 4.325 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1c[nH]c2ncccc12)c1ccc(C(F)(F)F)cc1 ZINC000520449979 928572129 /nfs/dbraw/zinc/57/21/29/928572129.db2.gz PMBYTRAOYQMIEV-SFHVURJKSA-N 0 3 404.436 4.395 20 0 HIADHN CCN1CCN(Cc2ccc(CNC(=O)N(Cc3ccco3)C3CCCC3)cc2)CC1 ZINC000520621836 928680180 /nfs/dbraw/zinc/68/01/80/928680180.db2.gz ROHISKILRQZTHC-UHFFFAOYSA-N 0 3 424.589 4.072 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2cc(F)ccc2OC[C@@H]2CCCO2)N(C)C)cc1 ZINC000520786768 928818574 /nfs/dbraw/zinc/81/85/74/928818574.db2.gz HGJQCOFAKNMKQO-PZJWPPBQSA-N 0 3 415.509 4.116 20 0 HIADHN CN1CCN(Cc2ccc(CNC(=O)N3CCCCC[C@@H]3c3ccccc3)cc2)CC1 ZINC000520797588 928823240 /nfs/dbraw/zinc/82/32/40/928823240.db2.gz JKAIIDWKFIYVFH-RUZDIDTESA-N 0 3 420.601 4.261 20 0 HIADHN Cn1c2ccccc2nc1[C@H]1CCCN1C(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000520813443 928830217 /nfs/dbraw/zinc/83/02/17/928830217.db2.gz GQRQQXNEXNYRCS-WMZHIEFXSA-N 0 3 420.532 4.288 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2cccc(OCc3cccnc3)c2)N(C)C)cc1 ZINC000520831236 928836151 /nfs/dbraw/zinc/83/61/51/928836151.db2.gz YZXFPGFALIWYRI-HSZRJFAPSA-N 0 3 404.514 4.393 20 0 HIADHN Cc1cc(NC(=O)c2cccc(F)c2)sc1C(=O)NC[C@@H](C)N1CCC(C)CC1 ZINC000520867767 928852179 /nfs/dbraw/zinc/85/21/79/928852179.db2.gz NRKSAABQVURNIY-MRXNPFEDSA-N 0 3 417.550 4.298 20 0 HIADHN CC[C@H](C)C(=O)Nc1cccc(CNC(=O)NC[C@@H](c2ccc(C)cc2)N(C)C)c1 ZINC000520892743 928863392 /nfs/dbraw/zinc/86/33/92/928863392.db2.gz MYNXUWDCUVUEBU-AVRDEDQJSA-N 0 3 410.562 4.082 20 0 HIADHN CC[C@H](C)C(=O)Nc1cccc(CNC(=O)N2CCN(CC3CCCCC3)CC2)c1 ZINC000520938918 928883435 /nfs/dbraw/zinc/88/34/35/928883435.db2.gz QGRWJOHCZQOKEP-IBGZPJMESA-N 0 3 414.594 4.079 20 0 HIADHN CC[C@@H](C)[C@H](NCc1ccc2[nH]cnc2c1)C(=O)Nc1cccc(N2CCCC2)c1 ZINC000520964027 928891733 /nfs/dbraw/zinc/89/17/33/928891733.db2.gz ABDPAJLEMRUMDO-HXOBKFHXSA-N 0 3 405.546 4.306 20 0 HIADHN CC[C@@H](C)[C@@H](NCc1ccc2[nH]cnc2c1)C(=O)Nc1cccc(N2CCCC2)c1 ZINC000520964029 928891891 /nfs/dbraw/zinc/89/18/91/928891891.db2.gz ABDPAJLEMRUMDO-UZUQRXQVSA-N 0 3 405.546 4.306 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)NC[C@H]3CCC[N@@H+]3CC3CCCCC3)cc2)cc(=O)[n-]1 ZINC000520971670 928897162 /nfs/dbraw/zinc/89/71/62/928897162.db2.gz SQKJPZSSNLZVKA-OAQYLSRUSA-N 0 3 423.561 4.324 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)NC[C@H]3CCC[N@H+]3CC3CCCCC3)cc2)cc(=O)[n-]1 ZINC000520971670 928897166 /nfs/dbraw/zinc/89/71/66/928897166.db2.gz SQKJPZSSNLZVKA-OAQYLSRUSA-N 0 3 423.561 4.324 20 0 HIADHN Cc1c(C(=O)N(CCN(C)C)Cc2ccc(F)cc2F)sc2nccc(C)c12 ZINC000520987974 928906479 /nfs/dbraw/zinc/90/64/79/928906479.db2.gz OIXBHDTVOREULQ-UHFFFAOYSA-N 0 3 403.498 4.395 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)c1cc2cc(Br)ccc2[nH]1 ZINC000520989814 928906917 /nfs/dbraw/zinc/90/69/17/928906917.db2.gz OTNKXPNEXHEGLW-UHFFFAOYSA-N 0 3 418.310 4.274 20 0 HIADHN O=C(NCc1ccc2c(c1)OCO2)[C@@H](NCCCc1cccc(F)c1)c1ccccc1 ZINC000521012739 928927877 /nfs/dbraw/zinc/92/78/77/928927877.db2.gz SXPSKFWNEOSFHX-DEOSSOPVSA-N 0 3 420.484 4.134 20 0 HIADHN CC(C)N(C)c1cccc(NC(=O)NCCCCN2CCN(c3ccccc3)CC2)c1 ZINC000521027139 928943493 /nfs/dbraw/zinc/94/34/93/928943493.db2.gz DYZAFGOGTZAGNM-UHFFFAOYSA-N 0 3 423.605 4.255 20 0 HIADHN CC[C@H](NC(=O)N(CCN(C)C)Cc1ccc(F)cc1F)c1ccc(OC)cc1 ZINC000521061917 928967923 /nfs/dbraw/zinc/96/79/23/928967923.db2.gz SFXOOOAJOBMPMN-NRFANRHFSA-N 0 3 405.489 4.198 20 0 HIADHN CO[C@H](CNC(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1)c1ccccc1 ZINC000521067547 928970178 /nfs/dbraw/zinc/97/01/78/928970178.db2.gz YVDKUYKIPMLUNH-HXUWFJFHSA-N 0 3 423.479 4.166 20 0 HIADHN O=C(NCCc1cccnc1)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000521071142 928972563 /nfs/dbraw/zinc/97/25/63/928972563.db2.gz PBYRLAHOTJYZQS-UHFFFAOYSA-N 0 3 421.372 4.239 20 0 HIADHN CC[C@@H](CNC(=O)N(CCOC)[C@H](C)c1ccccc1)N1CCc2ccccc2C1 ZINC000521167296 929039487 /nfs/dbraw/zinc/03/94/87/929039487.db2.gz STDNJRBHLAWARS-YKSBVNFPSA-N 0 3 409.574 4.243 20 0 HIADHN CCN1CCN(Cc2ccc(CNC(=O)N(Cc3ccccc3)CC(C)C)cc2)CC1 ZINC000521170397 929041648 /nfs/dbraw/zinc/04/16/48/929041648.db2.gz KBHISRGLBBXNON-UHFFFAOYSA-N 0 3 422.617 4.192 20 0 HIADHN CO[C@H](C)c1cccc(NC(=O)NCC2(N3CCOC(C)(C)C3)CCCCC2)c1 ZINC000521308114 929118137 /nfs/dbraw/zinc/11/81/37/929118137.db2.gz NVDRLMDTTZTLCN-GOSISDBHSA-N 0 3 403.567 4.329 20 0 HIADHN O=C(N[C@H](c1ccc(F)cc1)[C@H]1CCCO1)N[C@H](CN1CCCC1)c1ccccc1 ZINC000521456295 929230006 /nfs/dbraw/zinc/23/00/06/929230006.db2.gz ZCDYNJFJGUFDBQ-DNVJHFABSA-N 0 3 411.521 4.182 20 0 HIADHN CC(C)[C@H](N[C@H]1CCCc2cc(S(N)(=O)=O)ccc21)c1ccc(Cl)cc1F ZINC000521471462 929237053 /nfs/dbraw/zinc/23/70/53/929237053.db2.gz FPNCUUPISIHMFU-PMACEKPBSA-N 0 3 410.942 4.491 20 0 HIADHN O=C(NCc1ccccc1Br)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000521532370 929278724 /nfs/dbraw/zinc/27/87/24/929278724.db2.gz KUHBMRCOUOQTCL-KRWDZBQOSA-N 0 3 405.311 4.117 20 0 HIADHN CC(C)Sc1ccc(Cl)cc1NC(=O)C(=O)N[C@@H](C)CN1CCC[C@@H](C)C1 ZINC000521545409 929288262 /nfs/dbraw/zinc/28/82/62/929288262.db2.gz MWFSELFNLYLMHU-CABCVRRESA-N 0 3 411.999 4.016 20 0 HIADHN CC(=O)c1ccc(-c2ccc(C(=O)N(CCN(C)C)Cc3ccc(F)cc3)o2)cc1 ZINC000521573503 929305131 /nfs/dbraw/zinc/30/51/31/929305131.db2.gz XTYDYZUWGQUUIK-UHFFFAOYSA-N 0 3 408.473 4.492 20 0 HIADHN CCOc1ccc(CNC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)cc1F ZINC000521574314 929305777 /nfs/dbraw/zinc/30/57/77/929305777.db2.gz BPFSQENSOYTSFB-OAQYLSRUSA-N 0 3 424.438 4.295 20 0 HIADHN O=C(NC[C@H]1CCCCO1)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000521602458 929322794 /nfs/dbraw/zinc/32/27/94/929322794.db2.gz DOFJRLDCUXVMSK-QGZVFWFLSA-N 0 3 414.377 4.170 20 0 HIADHN COCCCn1nccc1CN[C@H]1CCCc2c3cc(Br)ccc3[nH]c21 ZINC000521674394 929359171 /nfs/dbraw/zinc/35/91/71/929359171.db2.gz GDQMZAKMQQKDMM-IBGZPJMESA-N 0 3 417.351 4.331 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)NCc1ccc(C(F)(F)F)cc1 ZINC000521686222 929366460 /nfs/dbraw/zinc/36/64/60/929366460.db2.gz YYYKGXZZVFXTBY-UHFFFAOYSA-N 0 3 415.406 4.257 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)N[C@H]1CCOc2c(Cl)cccc21 ZINC000521687829 929367227 /nfs/dbraw/zinc/36/72/27/929367227.db2.gz YUHVFMZFAMKNPB-IBGZPJMESA-N 0 3 423.891 4.215 20 0 HIADHN C[C@H](CNC(=O)c1oc2ccccc2c1CSc1ncccn1)N1CCC[C@H](C)C1 ZINC000521706159 929377890 /nfs/dbraw/zinc/37/78/90/929377890.db2.gz ZLOVNRYJIYSJKW-DLBZAZTESA-N 0 3 424.570 4.365 20 0 HIADHN C[C@H](c1cccs1)N(Cc1ccccc1)C(=O)NCCCCN1CCN(C)CC1 ZINC000521783003 929442961 /nfs/dbraw/zinc/44/29/61/929442961.db2.gz GBLVIWPSLNUOJH-HXUWFJFHSA-N 0 3 414.619 4.049 20 0 HIADHN O=C(CN(CCc1ccccc1F)C1CCCC1)Nc1cccc(N2CCCC2=O)c1 ZINC000521816430 929473411 /nfs/dbraw/zinc/47/34/11/929473411.db2.gz QLJBPVCJKZEDRC-UHFFFAOYSA-N 0 3 423.532 4.378 20 0 HIADHN CC(=O)Nc1ccc(OC[C@H](O)CN(Cc2ccccc2)Cc2ccc(F)cc2)cc1 ZINC000521815716 929474062 /nfs/dbraw/zinc/47/40/62/929474062.db2.gz WAJUWEGYLZPXCA-XMMPIXPASA-N 0 3 422.500 4.226 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)Nc1ccnn1-c1cccc(Cl)c1 ZINC000521930556 929570071 /nfs/dbraw/zinc/57/00/71/929570071.db2.gz SAENMVHNNNFIMN-UHFFFAOYSA-N 0 3 423.948 4.067 20 0 HIADHN CCCc1c(C(=O)NC[C@@H](C)N(C)Cc2ccccc2)cnn1Cc1ccccc1 ZINC000521957203 929593539 /nfs/dbraw/zinc/59/35/39/929593539.db2.gz WRETUYUSDCKINC-HXUWFJFHSA-N 0 3 404.558 4.134 20 0 HIADHN CCN1CC[C@@H](NCC(=O)Nc2c(C)cccc2C)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000522008811 929617586 /nfs/dbraw/zinc/61/75/86/929617586.db2.gz ZXRWWCJHRBWTMJ-GCJKJVERSA-N 0 3 405.464 4.084 20 0 HIADHN CC(C)[C@H](NC(=O)N(Cc1ccco1)C1CCN(C)CC1)c1nc2ccccc2[nH]1 ZINC000524527987 929666322 /nfs/dbraw/zinc/66/63/22/929666322.db2.gz NYPVAQKORCHHFM-NRFANRHFSA-N 0 3 409.534 4.159 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1ccc(=O)n(CC)c1)c1ccc(C(F)(F)F)cc1 ZINC000524546285 929677066 /nfs/dbraw/zinc/67/70/66/929677066.db2.gz KGQSLVQEHUEZRZ-GOSISDBHSA-N 0 3 424.467 4.092 20 0 HIADHN CCOc1ccc(S(=O)(=O)N(C)[C@H]2CCN(Cc3ccccc3)[C@H](C)C2)c(C)c1 ZINC000524587702 929701110 /nfs/dbraw/zinc/70/11/10/929701110.db2.gz XZXLDGLPLLGLHA-CTNGQTDRSA-N 0 3 416.587 4.067 20 0 HIADHN Cc1cccc(C)c1CN1CCN(Cc2nc3sc4c(c3c(=O)[nH]2)CCCC4)CC1 ZINC000524591880 929703116 /nfs/dbraw/zinc/70/31/16/929703116.db2.gz VTHOJUCTDJPLMD-UHFFFAOYSA-N 0 3 422.598 4.210 20 0 HIADHN CC1CCC(OC2CCN(C(=O)N[C@@H]3CCCN(Cc4ccccc4)C3)CC2)CC1 ZINC000524614778 929723897 /nfs/dbraw/zinc/72/38/97/929723897.db2.gz ZMXFWMXFUCMYRG-GTMAMOSYSA-N 0 3 413.606 4.420 20 0 HIADHN CCCN(CC(=O)Nc1cccc(NC(C)=O)c1)[C@H]1C[C@@H](OCC)C12CCCC2 ZINC000524619706 929728468 /nfs/dbraw/zinc/72/84/68/929728468.db2.gz FVSXRFOIWWLGRA-LEWJYISDSA-N 0 3 401.551 4.033 20 0 HIADHN CCCN(C(=O)NC[C@H](c1cccs1)N1CCCC1)[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC000524630443 929739415 /nfs/dbraw/zinc/73/94/15/929739415.db2.gz GJDAZPHPLBUBBS-CUDHKJQZSA-N 0 3 405.608 4.120 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)N[C@@H](c1ccccc1)c1ccccn1 ZINC000524630523 929740033 /nfs/dbraw/zinc/74/00/33/929740033.db2.gz KKUBSWPMLXHREM-BWKNWUBXSA-N 0 3 414.553 4.477 20 0 HIADHN CC[C@H](CNC(=O)NCc1ccc(-c2ccncc2)cc1)N1CCc2ccccc2C1 ZINC000524724066 929811080 /nfs/dbraw/zinc/81/10/80/929811080.db2.gz SAZFDZLFORXQRH-RUZDIDTESA-N 0 3 414.553 4.385 20 0 HIADHN CCCC(=O)Nc1cccc(CNC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)c1 ZINC000524740827 929815796 /nfs/dbraw/zinc/81/57/96/929815796.db2.gz QSLNDXZMHLIUHU-FQEVSTJZSA-N 0 3 422.573 4.231 20 0 HIADHN CC(C)C[C@H](C(=O)Nc1ccc(C(=O)NCCN2CCCC2)cc1)c1ccccc1 ZINC000524821422 929843625 /nfs/dbraw/zinc/84/36/25/929843625.db2.gz RIVMUFIJHUBFSV-QHCPKHFHSA-N 0 3 407.558 4.281 20 0 HIADHN O=C(NCc1ccc(-c2ccncc2)cc1)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000524829180 929848938 /nfs/dbraw/zinc/84/89/38/929848938.db2.gz DGSORLNMOXRQLR-DEOSSOPVSA-N 0 3 400.526 4.385 20 0 HIADHN COc1ccc2nc(NC(=O)N3CCCN(Cc4ccccc4)C[C@@H]3C)sc2c1 ZINC000524892339 929875838 /nfs/dbraw/zinc/87/58/38/929875838.db2.gz AQEXCNPRFOIZDX-INIZCTEOSA-N 0 3 410.543 4.433 20 0 HIADHN CCCN(Cc1nnc(-c2ccc(Br)o2)o1)[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC000524893041 929876607 /nfs/dbraw/zinc/87/66/07/929876607.db2.gz XJRBPEGWEGDKFM-XZJROXQQSA-N 0 3 410.312 4.118 20 0 HIADHN Cc1ccc(NC(=O)C2CC2)cc1NC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C ZINC000524896343 929877470 /nfs/dbraw/zinc/87/74/70/929877470.db2.gz QZWNDOPXHYVTNO-LJQANCHMSA-N 0 3 420.557 4.472 20 0 HIADHN CCCCCC(=O)NC1CCN(CCc2nc(-c3cccc(Cl)c3)no2)CC1 ZINC000524907238 929883413 /nfs/dbraw/zinc/88/34/13/929883413.db2.gz LWSAYXTVTWKGKG-UHFFFAOYSA-N 0 3 404.942 4.093 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)NCCc1c[nH]c2cc(F)ccc12 ZINC000524929884 929895764 /nfs/dbraw/zinc/89/57/64/929895764.db2.gz BLHIWJPEGUCMBL-GOSISDBHSA-N 0 3 408.521 4.156 20 0 HIADHN CN(C)[C@H](CNC(=O)NC1(c2cccc(Br)c2)CC1)c1ccccc1 ZINC000524930903 929896288 /nfs/dbraw/zinc/89/62/88/929896288.db2.gz HNJGOQRETDSMLZ-GOSISDBHSA-N 0 3 402.336 4.040 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)N[C@@H](c1ccccc1)[C@H]1CCCO1 ZINC000524932443 929897049 /nfs/dbraw/zinc/89/70/49/929897049.db2.gz YNPNFGNFGLNZJF-HUVFLSCGSA-N 0 3 407.558 4.213 20 0 HIADHN COc1ccc(NC(=O)[C@H](N[C@@H]2[C@@H]3CCO[C@@H]3C2(C)C)c2ccccc2)cc1Cl ZINC000524944428 929907077 /nfs/dbraw/zinc/90/70/77/929907077.db2.gz FIBXPCZPRPPOLS-ZXNZYJFHSA-N 0 3 414.933 4.432 20 0 HIADHN CN(C)Cc1cccc(C(=O)Nc2ccccc2CN(C)C(=O)c2cccs2)c1 ZINC000524974087 929938320 /nfs/dbraw/zinc/93/83/20/929938320.db2.gz ZYAZFVZPBKIWIO-UHFFFAOYSA-N 0 3 407.539 4.334 20 0 HIADHN C[C@@H](CNC(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1)Cc1cccs1 ZINC000525016459 929976997 /nfs/dbraw/zinc/97/69/97/929976997.db2.gz MHZSLHUXCPVHIZ-OXQOHEQNSA-N 0 3 410.505 4.498 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)Cc2csc3ccccc23)cc1)[C@H]1CCCN(C)C1 ZINC000525065535 930012838 /nfs/dbraw/zinc/01/28/38/930012838.db2.gz ILTQHRGIQOHAMT-FQEVSTJZSA-N 0 3 421.566 4.249 20 0 HIADHN CC[C@@](C)(NC(=O)c1ccc(N2CCN(C(C)C)CC2)cc1)c1nc(C)cs1 ZINC000525065989 930013233 /nfs/dbraw/zinc/01/32/33/930013233.db2.gz AAIAFQHXFZOIOC-JOCHJYFZSA-N 0 3 400.592 4.037 20 0 HIADHN CCc1ccc(CC(=O)NC2CCN(CCOc3ccc(Cl)cc3)CC2)cc1 ZINC000525071804 930017681 /nfs/dbraw/zinc/01/76/81/930017681.db2.gz PTTHHIUGRMWZPM-UHFFFAOYSA-N 0 3 400.950 4.105 20 0 HIADHN COC(=O)C(C)(C)c1ccc(NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)cc1 ZINC000525090722 930029087 /nfs/dbraw/zinc/02/90/87/930029087.db2.gz HHYNEGMMHLMTSE-GOSISDBHSA-N 0 3 412.505 4.127 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2[nH]c3ccccc3c2Cl)cc1)[C@@H]1CCCN(C)C1 ZINC000525099237 930034054 /nfs/dbraw/zinc/03/40/54/930034054.db2.gz XFBHDBCCTUOHFI-QGZVFWFLSA-N 0 3 424.932 4.240 20 0 HIADHN COc1ccc2c(c1)[C@@H](N(CCC(=O)NC1CCCC1)Cc1ccccc1)CCO2 ZINC000525124720 930049555 /nfs/dbraw/zinc/04/95/55/930049555.db2.gz GJAXTFRUASBSJZ-QHCPKHFHSA-N 0 3 408.542 4.470 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@H](C)N2CC[C@@H](c3ccccc3)[C@H](C)C2)cc1OC ZINC000525126131 930049833 /nfs/dbraw/zinc/04/98/33/930049833.db2.gz PXLJYBQCHMJNTB-XQBPLPMBSA-N 0 3 410.558 4.176 20 0 HIADHN CC(C)CN(CCN(C)C)C(=O)CCc1nc2cc(Br)ccc2s1 ZINC000525206587 930086655 /nfs/dbraw/zinc/08/66/55/930086655.db2.gz RVHYKKJBYCENOQ-UHFFFAOYSA-N 0 3 412.397 4.038 20 0 HIADHN Cc1c(C(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)cnn1-c1ccc(F)cc1F ZINC000525224511 930092838 /nfs/dbraw/zinc/09/28/38/930092838.db2.gz AEKNAZLHTHWCLU-QGZVFWFLSA-N 0 3 424.495 4.196 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N2CCC(OCC3CCCCC3)CC2)N(C)C)cc1 ZINC000525254484 930108642 /nfs/dbraw/zinc/10/86/42/930108642.db2.gz XBPIMPWTWDHZGA-QHCPKHFHSA-N 0 3 401.595 4.369 20 0 HIADHN COc1cc(-c2nnc(CN3C[C@@H](c4ccccc4C)C[C@@H]3C)o2)cc(OC)c1OC ZINC000525272606 930124195 /nfs/dbraw/zinc/12/41/95/930124195.db2.gz AGYKFKUJNWONRW-WMZOPIPTSA-N 0 3 423.513 4.449 20 0 HIADHN O=C(CCSc1ccc(Cl)cc1)NCc1ccccc1CN1CCC(O)CC1 ZINC000525311026 930150162 /nfs/dbraw/zinc/15/01/62/930150162.db2.gz PCNAVNJVMMYEOI-UHFFFAOYSA-N 0 3 418.990 4.095 20 0 HIADHN CC[C@@H](C)[C@@H]1CCCCN1CC(=O)N(C)CC(=O)Nc1ccccc1C(F)(F)F ZINC000525327767 930165011 /nfs/dbraw/zinc/16/50/11/930165011.db2.gz HIBKHFMTEOVZIQ-QAPCUYQASA-N 0 3 413.484 4.003 20 0 HIADHN CSc1ncc(C(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)n1-c1ccccc1 ZINC000525382401 930208762 /nfs/dbraw/zinc/20/87/62/930208762.db2.gz SUDUGRBVWVBPOO-IBGZPJMESA-N 0 3 420.582 4.331 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)Cc1csc(Cc2ccccc2)n1 ZINC000525382404 930209428 /nfs/dbraw/zinc/20/94/28/930209428.db2.gz RHGNTMCXVZIZHC-FQEVSTJZSA-N 0 3 419.594 4.399 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)N[C@H]1CCCOc2ccc(F)cc21 ZINC000525394276 930215542 /nfs/dbraw/zinc/21/55/42/930215542.db2.gz LSGQKQZUWHKIQX-GCJKJVERSA-N 0 3 411.521 4.345 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)N[C@@H]1CCCOc2ccc(F)cc21 ZINC000525394277 930215860 /nfs/dbraw/zinc/21/58/60/930215860.db2.gz LSGQKQZUWHKIQX-PGRDOPGGSA-N 0 3 411.521 4.345 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)NCc1ccccc1OC(F)F ZINC000525399505 930218647 /nfs/dbraw/zinc/21/86/47/930218647.db2.gz RFVYZKKHGKBFPX-QGZVFWFLSA-N 0 3 403.473 4.094 20 0 HIADHN CSC[C@H](CCO)NCc1cc(Br)ccc1OCc1ccccc1 ZINC000525402728 930221107 /nfs/dbraw/zinc/22/11/07/930221107.db2.gz YVOARFMPECQFTL-SFHVURJKSA-N 0 3 410.377 4.232 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)N[C@@H]1C[C@@H]1c1c(F)cccc1Cl ZINC000525423507 930232964 /nfs/dbraw/zinc/23/29/64/930232964.db2.gz AVTRGSNFOOSCKK-GHTZIAJQSA-N 0 3 415.940 4.054 20 0 HIADHN CCCNC(=O)c1cccc(C(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)c1 ZINC000525430229 930235396 /nfs/dbraw/zinc/23/53/96/930235396.db2.gz RMXCNXQMRQGTHA-HXUWFJFHSA-N 0 3 413.587 4.091 20 0 HIADHN C[C@@H](CN1CCC[C@@H](C)C1)NC(=O)C(=O)Nc1cccc(CSC2CCCC2)c1 ZINC000525434778 930237862 /nfs/dbraw/zinc/23/78/62/930237862.db2.gz TZBPBBTXRMNYTP-MSOLQXFVSA-N 0 3 417.619 4.038 20 0 HIADHN CC[C@H](NC(=O)N(CCN(C)C)Cc1ccc(F)c(F)c1)c1cc(F)ccc1F ZINC000525442335 930242498 /nfs/dbraw/zinc/24/24/98/930242498.db2.gz OYMOELOOSFCXMC-FQEVSTJZSA-N 0 3 411.443 4.468 20 0 HIADHN COc1cc(CN(C)C(=O)c2cccc(CN3CCCC3)c2)c(SC)cc1OC ZINC000525467223 930258048 /nfs/dbraw/zinc/25/80/48/930258048.db2.gz CBYYGMRRHHVNGA-UHFFFAOYSA-N 0 3 414.571 4.294 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)CCc2cc(Cl)cs2)cc1)[C@H]1CCCN(C)C1 ZINC000525579373 930341492 /nfs/dbraw/zinc/34/14/92/930341492.db2.gz QCQXUYTZQZSDDK-SFHVURJKSA-N 0 3 419.978 4.139 20 0 HIADHN CC[C@@H](CC(=O)Nc1ccc(C(=O)N(C)[C@H]2CCCN(C)C2)cc1)c1ccccc1 ZINC000525581096 930343631 /nfs/dbraw/zinc/34/36/31/930343631.db2.gz GQEBUWQKLCRMJA-CVDCTZTESA-N 0 3 407.558 4.375 20 0 HIADHN Cc1ccccc1[C@H](C)CC(=O)Nc1ccc(C(=O)N(C)[C@H]2CCCN(C)C2)cc1 ZINC000525612144 930362445 /nfs/dbraw/zinc/36/24/45/930362445.db2.gz GNWHEMPZVKRUNN-KNQAVFIVSA-N 0 3 407.558 4.294 20 0 HIADHN C[C@@H](c1cccc(C(F)(F)F)c1)N(CCN1C(=O)NC2(CCCC2)C1=O)C1CC1 ZINC000525633201 930374597 /nfs/dbraw/zinc/37/45/97/930374597.db2.gz RZUJXWPPXSRBAE-AWEZNQCLSA-N 0 3 409.452 4.095 20 0 HIADHN C[C@H](NC(=O)[C@H](C)N1CC[C@H](c2ccccc2)[C@@H](C)C1)c1ccc2c(c1)OCCO2 ZINC000525635835 930376011 /nfs/dbraw/zinc/37/60/11/930376011.db2.gz SHMHOYBEMBAOAG-OZIGNCPNSA-N 0 3 408.542 4.149 20 0 HIADHN Cc1c(N[C@H](C)C(C)C)cccc1C(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000525641866 930378856 /nfs/dbraw/zinc/37/88/56/930378856.db2.gz INUVCZYHWJLDEH-SVFBPWRDSA-N 0 3 415.622 4.413 20 0 HIADHN Cc1c(N[C@H](C)C(C)C)cccc1C(=O)N1CCC(CN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000525641864 930379218 /nfs/dbraw/zinc/37/92/18/930379218.db2.gz INUVCZYHWJLDEH-IRFCIJBXSA-N 0 3 415.622 4.413 20 0 HIADHN O=C(CC1(N2CCOCC2)CCCC1)N(Cc1ccc(C(F)(F)F)cc1)C1CC1 ZINC000525691127 930404892 /nfs/dbraw/zinc/40/48/92/930404892.db2.gz VCVYKMXAJVSVPP-UHFFFAOYSA-N 0 3 410.480 4.232 20 0 HIADHN CC(C)(C)c1noc(-c2ccccc2C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)n1 ZINC000525726426 930416896 /nfs/dbraw/zinc/41/68/96/930416896.db2.gz IADBQSCIDVKKOS-LJQANCHMSA-N 0 3 418.541 4.429 20 0 HIADHN C[C@@H]1CCN(C(=O)c2cnn(-c3ccccc3Cl)c2)CCN1Cc1ccccc1 ZINC000525737566 930420795 /nfs/dbraw/zinc/42/07/95/930420795.db2.gz OZHKRHRWMUQYCX-GOSISDBHSA-N 0 3 408.933 4.262 20 0 HIADHN COc1cc(CN(C)C(=O)c2oc3ccccc3c2CN(C)C)ccc1OC(F)F ZINC000525748329 930426599 /nfs/dbraw/zinc/42/65/99/930426599.db2.gz YVHXCHPWTZKCFC-UHFFFAOYSA-N 0 3 418.440 4.377 20 0 HIADHN CC(C)[C@H](CNC(=O)CCCCc1ccc(C(C)(C)C)cc1)N1CCN(C)CC1 ZINC000525773482 930439406 /nfs/dbraw/zinc/43/94/06/930439406.db2.gz GLOBBCNKMFYRNB-QHCPKHFHSA-N 0 3 401.639 4.085 20 0 HIADHN COc1cc(-c2nnc(CN3CCC[C@H](C(C)(C)C)CC3)o2)cc(OC)c1OC ZINC000525784409 930443731 /nfs/dbraw/zinc/44/37/31/930443731.db2.gz GSEDXHHYLHWAHG-INIZCTEOSA-N 0 3 403.523 4.411 20 0 HIADHN C[C@@H](NCc1ccc2c(c1)sc(=O)n2C)c1ccc(OCc2cccnc2)cc1 ZINC000525981969 930502018 /nfs/dbraw/zinc/50/20/18/930502018.db2.gz ZXGONZVWZARVKJ-MRXNPFEDSA-N 0 3 405.523 4.425 20 0 HIADHN C[C@@H](NCC(=O)Nc1cc(Cl)ccc1-n1cncn1)c1cc2ccccc2s1 ZINC000526945054 930554003 /nfs/dbraw/zinc/55/40/03/930554003.db2.gz ZNQIOZNGKRRRHK-CYBMUJFWSA-N 0 3 411.918 4.425 20 0 HIADHN Cc1ccccc1[C@@H]([C@H](C)NC(=O)C(=O)Nc1ccc2oc(C(C)C)nc2c1)N(C)C ZINC000526957888 930558303 /nfs/dbraw/zinc/55/83/03/930558303.db2.gz VXJKDDJCEIZZAW-HRAATJIYSA-N 0 3 422.529 4.006 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)C(=O)N1CCCC[C@H]1c1cccc(C)c1C ZINC000527146218 930601978 /nfs/dbraw/zinc/60/19/78/930601978.db2.gz VZDNTVAOYGLQAM-QFIPXVFZSA-N 0 3 423.557 4.066 20 0 HIADHN O=C(NCC1CCN(c2ccccc2)CC1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000527185690 930608582 /nfs/dbraw/zinc/60/85/82/930608582.db2.gz WAFYLAHIRWFORL-QFIPXVFZSA-N 0 3 409.549 4.071 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1ccc2[nH]c(C(F)F)nc2c1 ZINC000527194774 930610476 /nfs/dbraw/zinc/61/04/76/930610476.db2.gz PNVOPUFNBXCWAG-UHFFFAOYSA-N 0 3 416.394 4.036 20 0 HIADHN C[C@H]1CCCN(S(=O)(=O)c2ccc(CNCc3ccc(C(F)F)cc3)cc2)C1 ZINC000527228787 930616673 /nfs/dbraw/zinc/61/66/73/930616673.db2.gz ULOGRKCUKPKPMP-INIZCTEOSA-N 0 3 408.514 4.335 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)C(=O)Nc1cccc(Oc2ccccc2)c1 ZINC000527336578 930637866 /nfs/dbraw/zinc/63/78/66/930637866.db2.gz LAPACAFURXYVJB-UHFFFAOYSA-N 0 3 419.481 4.126 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)Nc3ccc(C(F)(F)F)c(Br)c3)[C@H]2C1 ZINC000530343707 930687921 /nfs/dbraw/zinc/68/79/21/930687921.db2.gz RXWTXACAJCMHAH-YGRLFVJLSA-N 0 3 406.246 4.026 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)CO[C@@H]3CCC[C@H](C)C3)c(OCC)c2)CC1 ZINC000530348028 930688639 /nfs/dbraw/zinc/68/86/39/930688639.db2.gz CFTWTPDKVBHEPY-PZJWPPBQSA-N 0 3 417.594 4.151 20 0 HIADHN Cc1ccc(C)c(NC(=O)[C@H](N[C@@H]2CCCC[C@H]2N2CCOCC2)c2ccccc2)c1 ZINC000530366635 930696875 /nfs/dbraw/zinc/69/68/75/930696875.db2.gz PTCJYDBURUFRKC-QLBJFCOMSA-N 0 3 421.585 4.216 20 0 HIADHN CCCCOc1ccc([C@@H](C)NC(=O)CC2(N3CCOCC3)CCCC2)cc1OC ZINC000530573235 930755272 /nfs/dbraw/zinc/75/52/72/930755272.db2.gz UWTACZRFNNILME-LJQANCHMSA-N 0 3 418.578 4.086 20 0 HIADHN Cc1cc(NC(=O)c2cccc(CN(C)C)c2)n(-c2cccc(Br)c2)n1 ZINC000530575512 930755768 /nfs/dbraw/zinc/75/57/68/930755768.db2.gz NNALOLYMBHBNSU-UHFFFAOYSA-N 0 3 413.319 4.257 20 0 HIADHN Cc1c(C(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)cnn1-c1ccc(C)cc1 ZINC000530585737 930759539 /nfs/dbraw/zinc/75/95/39/930759539.db2.gz MUGZWQISAXCZBX-QHCPKHFHSA-N 0 3 402.542 4.226 20 0 HIADHN COc1cc(Cl)c(C)cc1NC(=O)CCNCc1cnc2ccc(Cl)cn12 ZINC000530630793 930778828 /nfs/dbraw/zinc/77/88/28/930778828.db2.gz KMLWWIHBBZKUHU-UHFFFAOYSA-N 0 3 407.301 4.077 20 0 HIADHN O=C(CC1(N2CCOCC2)CCCC1)N(Cc1ccc(F)cc1F)C1CCCC1 ZINC000530816389 930830616 /nfs/dbraw/zinc/83/06/16/930830616.db2.gz SYMSRTAMYPWIHK-UHFFFAOYSA-N 0 3 406.517 4.271 20 0 HIADHN CN(C)Cc1ccc(-c2noc(-c3ccccc3I)n2)cc1 ZINC000530872342 930844890 /nfs/dbraw/zinc/84/48/90/930844890.db2.gz KXYYUMOEFWHGSP-UHFFFAOYSA-N 0 3 405.239 4.070 20 0 HIADHN CC(C)c1nc(-c2nc(-c3ccc(CN(C)C)cc3)no2)nn1-c1ccccc1F ZINC000530871688 930844904 /nfs/dbraw/zinc/84/49/04/930844904.db2.gz WVSNFYFKTCWBJC-UHFFFAOYSA-N 0 3 406.465 4.308 20 0 HIADHN CN(C[C@H](O)COC[C@H]1CCCO1)[C@@H](c1ccc(F)cc1)c1ccc(Cl)cc1 ZINC000530901572 930854528 /nfs/dbraw/zinc/85/45/28/930854528.db2.gz QOEKLQRUMGTWBD-BHDDXSALSA-N 0 3 407.913 4.057 20 0 HIADHN COC(=O)c1cc2c(o1)c(OC)ccc2CNCc1cccc(OCC(F)(F)F)c1 ZINC000530904413 930855192 /nfs/dbraw/zinc/85/51/92/930855192.db2.gz MAWHOBOMFDALOY-UHFFFAOYSA-N 0 3 423.387 4.459 20 0 HIADHN COC[C@](C)(CCO)NCc1cn(-c2ccccc2)nc1-c1cc2ccccc2o1 ZINC000530933531 930862413 /nfs/dbraw/zinc/86/24/13/930862413.db2.gz HTRROFQMUUTMBE-DEOSSOPVSA-N 0 3 405.498 4.163 20 0 HIADHN CCN(CC)C(=O)c1cccc(NC(=O)[C@H](C)N[C@H](C)[C@H]2Oc3ccccc3[C@H]2C)c1 ZINC000530972902 930872565 /nfs/dbraw/zinc/87/25/65/930872565.db2.gz KCKGDPOGFXDUBR-ZHSNQQFMSA-N 0 3 423.557 4.038 20 0 HIADHN CC(C)c1nc2cc(NC(=O)NCc3ccccc3CN3CCC(O)CC3)ccc2o1 ZINC000530982687 930875283 /nfs/dbraw/zinc/87/52/83/930875283.db2.gz SPCUPPSNRURCFV-UHFFFAOYSA-N 0 3 422.529 4.230 20 0 HIADHN C[C@H](Oc1ccc(C(=O)N(CCN(C)C)Cc2cccs2)cn1)c1ccccc1 ZINC000530988238 930877791 /nfs/dbraw/zinc/87/77/91/930877791.db2.gz PASDDRWQSMVUPR-SFHVURJKSA-N 0 3 409.555 4.487 20 0 HIADHN CCSc1ccccc1C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000531012326 930884563 /nfs/dbraw/zinc/88/45/63/930884563.db2.gz WDWDRIZMGFZRCP-UHFFFAOYSA-N 0 3 402.535 4.211 20 0 HIADHN CCCN(Cc1ccccc1Br)C(=O)CC1(N2CCOCC2)CCCC1 ZINC000531049318 930898140 /nfs/dbraw/zinc/89/81/40/930898140.db2.gz DARDKINOVDZQLS-UHFFFAOYSA-N 0 3 423.395 4.223 20 0 HIADHN COc1cc(Cl)c(C)cc1NC(=O)CCNCc1cnn(-c2ccc(F)cc2)c1 ZINC000531108666 930923639 /nfs/dbraw/zinc/92/36/39/930923639.db2.gz MXIGNSSWEONRNQ-UHFFFAOYSA-N 0 3 416.884 4.100 20 0 HIADHN CCc1ccc([C@H](CNC(=O)c2cc(-c3ccccc3)c(C)[nH]c2=O)N(C)C)cc1 ZINC000531176286 930953409 /nfs/dbraw/zinc/95/34/09/930953409.db2.gz DZQPLQXPXVOCAO-QHCPKHFHSA-N 0 3 403.526 4.358 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)c(C)c1CNCc1n[nH]c(-c2ccc(F)cc2)n1 ZINC000531256948 930984293 /nfs/dbraw/zinc/98/42/93/930984293.db2.gz YHRIAZXJXSVHHD-UHFFFAOYSA-N 0 3 410.884 4.357 20 0 HIADHN CN(C(=O)c1cnc(Cc2ccccc2)s1)C1CCN(Cc2ccccc2)CC1 ZINC000531266174 930988933 /nfs/dbraw/zinc/98/89/33/930988933.db2.gz FYOVSIBAQFSUNA-UHFFFAOYSA-N 0 3 405.567 4.471 20 0 HIADHN COc1ccc([C@H](CNC(=O)[C@H]2CCCCN2Cc2ccccc2)N2CCCC2)cc1 ZINC000531281678 930999693 /nfs/dbraw/zinc/99/96/93/930999693.db2.gz XZYVKKFYFUIDNW-RPBOFIJWSA-N 0 3 421.585 4.003 20 0 HIADHN Cc1nnc(-c2cccc(C(=O)NC[C@@H](c3ccccc3)N3CCC(C)CC3)c2)o1 ZINC000531284969 931001045 /nfs/dbraw/zinc/00/10/45/931001045.db2.gz ZZHFDCLFSMZIRB-QFIPXVFZSA-N 0 3 404.514 4.248 20 0 HIADHN O=C(CC1(N2CCOCC2)CCCC1)Nc1cccc(CSC2CCOCC2)c1 ZINC000531301119 931007066 /nfs/dbraw/zinc/00/70/66/931007066.db2.gz FAXLVDJSECFOEY-UHFFFAOYSA-N 0 3 418.603 4.072 20 0 HIADHN Cc1cc(-c2noc(CCc3nc(-c4ccc(CN(C)C)cc4)no3)n2)ccc1F ZINC000531348869 931026296 /nfs/dbraw/zinc/02/62/96/931026296.db2.gz OVGPXZXPIBFSAM-UHFFFAOYSA-N 0 3 407.449 4.081 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)c2cc(Cl)c3c(c2)OCCCO3)CC1 ZINC000531395892 931043139 /nfs/dbraw/zinc/04/31/39/931043139.db2.gz IMPZSJMQHDQOCY-UHFFFAOYSA-N 0 3 414.933 4.238 20 0 HIADHN Cc1[nH]c(=O)c(C(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)cc1-c1ccccc1 ZINC000531407824 931045950 /nfs/dbraw/zinc/04/59/50/931045950.db2.gz XHFSLFIPGYVPDX-LJQANCHMSA-N 0 3 415.537 4.499 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)c3ccnc(Oc4ccccc4)c3)CC2)C[C@H](C)O1 ZINC000531417714 931049630 /nfs/dbraw/zinc/04/96/30/931049630.db2.gz IOBSKGZLIATNKQ-PMACEKPBSA-N 0 3 423.557 4.225 20 0 HIADHN O=C(N[C@H](c1cccc(Cl)c1)c1ccccn1)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000531618419 931129531 /nfs/dbraw/zinc/12/95/31/931129531.db2.gz IBXXOBAMHCOHRL-NZQKXSOJSA-N 0 3 420.944 4.248 20 0 HIADHN CC(C)c1ccc([C@H](C)NCc2cccc(NC(=O)CCN3CCOCC3)c2)cc1 ZINC000531683856 931151820 /nfs/dbraw/zinc/15/18/20/931151820.db2.gz KGBYEHHOSDIHBB-FQEVSTJZSA-N 0 3 409.574 4.322 20 0 HIADHN Cc1c2ccccc2oc1[C@H](C)NCc1ccc(CS(=O)(=O)NC(C)C)cc1 ZINC000531694780 931157022 /nfs/dbraw/zinc/15/70/22/931157022.db2.gz HVHXWFQMYNPGMV-KRWDZBQOSA-N 0 3 400.544 4.420 20 0 HIADHN CC(C)NS(=O)(=O)Cc1ccc(CN[C@@H]2CCCOc3ccc(Cl)cc32)cc1 ZINC000531695436 931158949 /nfs/dbraw/zinc/15/89/49/931158949.db2.gz UNJZSTKTDXGAIE-HXUWFJFHSA-N 0 3 422.978 4.171 20 0 HIADHN C[C@H](NCCNS(=O)(=O)c1cccc(Cl)c1)c1ccc(-c2ccncc2)cc1 ZINC000531696503 931160123 /nfs/dbraw/zinc/16/01/23/931160123.db2.gz GLDZDLGSRKKFQI-INIZCTEOSA-N 0 3 415.946 4.031 20 0 HIADHN C[C@@H](Cn1cc(Br)cn1)NCc1cccc(NC(=O)C2CCCCC2)c1 ZINC000531701054 931163795 /nfs/dbraw/zinc/16/37/95/931163795.db2.gz ZHXCYAKLYVSZAF-HNNXBMFYSA-N 0 3 419.367 4.343 20 0 HIADHN Fc1ccc(N2CCN(c3cc(CN[C@@H]4CCc5ccccc54)ccn3)CC2)cc1 ZINC000531699742 931164103 /nfs/dbraw/zinc/16/41/03/931164103.db2.gz FLITYSNYKTYMMD-XMMPIXPASA-N 0 3 402.517 4.324 20 0 HIADHN CC(C)c1ccc2c(c1)[C@H](NCc1ccc(C(=O)N3CCOCC3)cc1)CCCO2 ZINC000531759651 931186168 /nfs/dbraw/zinc/18/61/68/931186168.db2.gz SJYMWIDOLMAUEV-HSZRJFAPSA-N 0 3 408.542 4.286 20 0 HIADHN Cc1noc(-c2ccc(C)c(NC(=O)N[C@H]3C[C@@H](C)N(Cc4ccccc4)C3)c2)n1 ZINC000531812332 931206619 /nfs/dbraw/zinc/20/66/19/931206619.db2.gz JMJUCFJZKHQIJV-UZLBHIALSA-N 0 3 405.502 4.138 20 0 HIADHN C[C@H](NC(=O)N(CCN(C)C)C1CCCC1)c1ccc(OCc2cccnc2)cc1 ZINC000531818957 931208340 /nfs/dbraw/zinc/20/83/40/931208340.db2.gz SXLPHVYZJCOBSO-IBGZPJMESA-N 0 3 410.562 4.237 20 0 HIADHN CC(C)N1CCN([C@H]2CCN(C(=O)c3cc4c(s3)CC[C@H](C(C)(C)C)C4)C2)CC1 ZINC000531832312 931211950 /nfs/dbraw/zinc/21/19/50/931211950.db2.gz TZHOKVFXSCGPIW-PMACEKPBSA-N 0 3 417.663 4.140 20 0 HIADHN CC(C)N1CCN([C@H]2CCN(C(=O)c3cc4c(s3)CC[C@@H](C(C)(C)C)C4)C2)CC1 ZINC000531832313 931212290 /nfs/dbraw/zinc/21/22/90/931212290.db2.gz TZHOKVFXSCGPIW-UXHICEINSA-N 0 3 417.663 4.140 20 0 HIADHN C[C@H](NC(=O)[C@H]1CCCN(Cc2cccnc2)C1)c1ccc(OCC2CC2)c(F)c1 ZINC000531834829 931214140 /nfs/dbraw/zinc/21/41/40/931214140.db2.gz NCGRGGSQZUURSQ-UWJYYQICSA-N 0 3 411.521 4.099 20 0 HIADHN CC(C)c1ccc([C@H](NC(=O)N2CC[C@@H](N3CCN(C(C)C)CC3)C2)C(C)C)cc1 ZINC000531839048 931214358 /nfs/dbraw/zinc/21/43/58/931214358.db2.gz MENNKDJOJOATQQ-DNQXCXABSA-N 0 3 414.638 4.317 20 0 HIADHN CSc1cc(C)ccc1CNCc1ccc(OCCN2CCOCC2)c(Cl)c1 ZINC000531836002 931214931 /nfs/dbraw/zinc/21/49/31/931214931.db2.gz BMIDZWKUSXGNDM-UHFFFAOYSA-N 0 3 421.006 4.371 20 0 HIADHN CC(C)(C)c1nn(-c2ccccc2)cc1CN[C@H]1CCN(C(=O)C2CCCCC2)C1 ZINC000531863891 931226101 /nfs/dbraw/zinc/22/61/01/931226101.db2.gz SICMUTUPEFIVJL-NRFANRHFSA-N 0 3 408.590 4.441 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@@H](C)N[C@H]2CCc3ccc(OC)cc32)cc1 ZINC000531931030 931250001 /nfs/dbraw/zinc/25/00/01/931250001.db2.gz DPJOYQJWKCAYBZ-ZHRRBRCNSA-N 0 3 402.560 4.064 20 0 HIADHN C[C@H](NC[C@@H](c1cccs1)N1CCOCC1)c1sccc1Br ZINC000531931953 931251282 /nfs/dbraw/zinc/25/12/82/931251282.db2.gz XMSXZRWQPWVMPB-JSGCOSHPSA-N 0 3 401.395 4.296 20 0 HIADHN COc1ccc(CNc2cc(NCc3ccc(OC)c(OC)c3)nc(C)n2)cc1OC ZINC000531935015 931252115 /nfs/dbraw/zinc/25/21/15/931252115.db2.gz GJKAKTSVNSUBFV-UHFFFAOYSA-N 0 3 424.501 4.044 20 0 HIADHN Fc1ccccc1-c1nc2c(s1)[C@@H](NCc1ccc(N3CCOCC3)nc1)CCC2 ZINC000531944685 931256753 /nfs/dbraw/zinc/25/67/53/931256753.db2.gz UTMAPPROAKMERN-IBGZPJMESA-N 0 3 424.545 4.348 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)N[C@H](CN2CCOCC2)c2ccc(C)cc2)cc1 ZINC000531945922 931257479 /nfs/dbraw/zinc/25/74/79/931257479.db2.gz YQTFSEDZZVYEAG-NBGIEHNGSA-N 0 3 404.558 4.213 20 0 HIADHN C[C@@H](NCc1ccc(N2CCCC2)nc1)c1ccc(NC(=O)c2ccncc2)cc1 ZINC000532077198 931304113 /nfs/dbraw/zinc/30/41/13/931304113.db2.gz XFYXYMCGQMXJRO-GOSISDBHSA-N 0 3 401.514 4.180 20 0 HIADHN Cc1cccc(Nc2ccccc2C(=O)N2CC[C@H](N3CCN(C(C)C)CC3)C2)c1C ZINC000532087921 931307546 /nfs/dbraw/zinc/30/75/46/931307546.db2.gz OAZSNYBFHBQNAH-QFIPXVFZSA-N 0 3 420.601 4.288 20 0 HIADHN Cc1sc(C(=O)N2CC[C@@H](N3CCN(C(C)C)CC3)C2)cc1-c1ccc(F)cc1 ZINC000532088708 931307818 /nfs/dbraw/zinc/30/78/18/931307818.db2.gz FNIKJVDVPWCOOX-HXUWFJFHSA-N 0 3 415.578 4.103 20 0 HIADHN Fc1ccc(CNCc2cc(Br)c3c(c2)OCCO3)c2ncccc12 ZINC000532092198 931308881 /nfs/dbraw/zinc/30/88/81/931308881.db2.gz ONURMDUCSIKUJQ-UHFFFAOYSA-N 0 3 403.251 4.197 20 0 HIADHN CSc1cc(C(=O)Nc2cnccc2N2CCN(C)CC2)c(Cl)cc1Cl ZINC000532112664 931318163 /nfs/dbraw/zinc/31/81/63/931318163.db2.gz FDDADDQHSCREPQ-UHFFFAOYSA-N 0 3 411.358 4.114 20 0 HIADHN CC(C)(C)OC(=O)C[C@H]1CCCN(C(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)C1 ZINC000532126368 931322718 /nfs/dbraw/zinc/32/27/18/931322718.db2.gz BGDZHFKEGKRXMN-WOJBJXKFSA-N 0 3 418.553 4.008 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@H](C)N[C@H]2CCc3c2cccc3OC)cc1 ZINC000532187119 931341265 /nfs/dbraw/zinc/34/12/65/931341265.db2.gz KFGMMITTWHLXKB-KKSFZXQISA-N 0 3 402.560 4.064 20 0 HIADHN COc1ccc2oc([C@@H](C)N[C@@H](CN3CCN(C)CC3)c3ccccc3)c(C)c2c1 ZINC000532213673 931354935 /nfs/dbraw/zinc/35/49/35/931354935.db2.gz UJBQRROKERCPGK-XXBNENTESA-N 0 3 407.558 4.389 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@@H](C)NCc2cc(-c3ccccc3)n[nH]2)CC1 ZINC000532265235 931375274 /nfs/dbraw/zinc/37/52/74/931375274.db2.gz KPNZCHGAXBLPPD-GOSISDBHSA-N 0 3 407.537 4.209 20 0 HIADHN Cc1ccc(C)c(Oc2ccc(CNC(=O)N(CCN(C)C)Cc3ccco3)cn2)c1 ZINC000532287862 931385194 /nfs/dbraw/zinc/38/51/94/931385194.db2.gz SUSPIGHXDULEBC-UHFFFAOYSA-N 0 3 422.529 4.357 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NCc2nnc3c(Cl)cc(C(F)(F)F)cn23)C1 ZINC000532296300 931389192 /nfs/dbraw/zinc/38/91/92/931389192.db2.gz VBXRIZXPPPVENT-CJNGLKHVSA-N 0 3 423.870 4.327 20 0 HIADHN COc1ccc(-c2cncc(C(=O)N(CCN3CCCC3)c3ccccc3)c2)cc1 ZINC000532332985 931399267 /nfs/dbraw/zinc/39/92/67/931399267.db2.gz QTEABKIXGPUCDH-UHFFFAOYSA-N 0 3 401.510 4.500 20 0 HIADHN CC(C)(C)[C@H](NC(=O)[C@H]1CCCN(Cc2cccnc2)C1)c1ccc(F)cc1F ZINC000532339117 931400032 /nfs/dbraw/zinc/40/00/32/931400032.db2.gz JHNSDMJFBJTNKV-LAUBAEHRSA-N 0 3 401.501 4.475 20 0 HIADHN CC(C)N1CCN([C@@H]2CCN(C(=O)c3ccc(-c4ccc(Cl)cc4)s3)C2)CC1 ZINC000532342255 931401393 /nfs/dbraw/zinc/40/13/93/931401393.db2.gz RYWZESFXGCOTEG-LJQANCHMSA-N 0 3 418.006 4.309 20 0 HIADHN Fc1ccc(C[NH2+]Cc2nnc(-c3ccc(Br)cc3)[n-]2)c2ncccc12 ZINC000532346406 931403574 /nfs/dbraw/zinc/40/35/74/931403574.db2.gz GUFQBHQPHPLPRM-UHFFFAOYSA-N 0 3 412.266 4.211 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(CNCCOc3ncccc3Cl)c2)cc1 ZINC000532373543 931414242 /nfs/dbraw/zinc/41/42/42/931414242.db2.gz IVCGIWGZCNBOJM-UHFFFAOYSA-N 0 3 411.889 4.165 20 0 HIADHN CC(C)(C)OC(=O)C[C@H]1CCCN(CCc2nc(-c3cccc(Cl)c3)no2)C1 ZINC000532379352 931416406 /nfs/dbraw/zinc/41/64/06/931416406.db2.gz HWAQRHFPNLUHSZ-OAHLLOKOSA-N 0 3 405.926 4.376 20 0 HIADHN Cc1nc(N2CC[C@@H](Nc3ccccc3)C2)cc(N2CC[C@H](Nc3ccccc3)C2)n1 ZINC000532444803 931436494 /nfs/dbraw/zinc/43/64/94/931436494.db2.gz LGYGAVVQQAOXTJ-ZRZAMGCNSA-N 0 3 414.557 4.167 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)N1CCC(Nc2ccc(F)cc2)CC1 ZINC000532445301 931437667 /nfs/dbraw/zinc/43/76/67/931437667.db2.gz VBNGRANKQFKEAA-QHCPKHFHSA-N 0 3 410.537 4.076 20 0 HIADHN COCCOc1ccc(CN[C@@H](C)c2sc(-c3ccc(OC)cc3)nc2C)cn1 ZINC000532448115 931438557 /nfs/dbraw/zinc/43/85/57/931438557.db2.gz JTKCGZVSIJFVFR-HNNXBMFYSA-N 0 3 413.543 4.398 20 0 HIADHN COc1ccc([C@@H](C)N[C@H](C)c2ccc(S(=O)(=O)N3CCCCC3)cc2)cc1F ZINC000532454557 931442397 /nfs/dbraw/zinc/44/23/97/931442397.db2.gz TWTNQCSKZLOAKZ-IAGOWNOFSA-N 0 3 420.550 4.421 20 0 HIADHN C[C@@H](NCc1cccc(NC(=O)[C@H]2CCCO2)c1)c1ccc(Br)cc1 ZINC000532465107 931446487 /nfs/dbraw/zinc/44/64/87/931446487.db2.gz IYHWRTOWTANGAG-AUUYWEPGSA-N 0 3 403.320 4.417 20 0 HIADHN O[C@H](CN[C@H]1CCSc2c(F)cccc21)COc1cccc(C(F)(F)F)c1 ZINC000532465548 931447496 /nfs/dbraw/zinc/44/74/96/931447496.db2.gz UAKIVBXNTNZTOT-DYVFJYSZSA-N 0 3 401.425 4.411 20 0 HIADHN O[C@H](CN[C@@H]1CCSc2c(F)cccc21)COc1cccc(C(F)(F)F)c1 ZINC000532465544 931447886 /nfs/dbraw/zinc/44/78/86/931447886.db2.gz UAKIVBXNTNZTOT-CXAGYDPISA-N 0 3 401.425 4.411 20 0 HIADHN CC(C)NS(=O)(=O)Cc1ccc(CN[C@@H]2C[C@H](C)Sc3sccc32)cc1 ZINC000532468235 931449177 /nfs/dbraw/zinc/44/91/77/931449177.db2.gz ZJWHFOYSJGDLPZ-KBXCAEBGSA-N 0 3 410.630 4.291 20 0 HIADHN CCCCOc1ccc([C@@H](C)N[C@@H](C)c2ccc(S(=O)(=O)NC)cc2)cc1OC ZINC000532471938 931450683 /nfs/dbraw/zinc/45/06/83/931450683.db2.gz PIIFVLPCUUUYLM-DLBZAZTESA-N 0 3 420.575 4.194 20 0 HIADHN COc1ccc2cc([C@@H](C)NCc3ccc(C(=O)N4CCOCC4)cc3)ccc2c1 ZINC000532471985 931451190 /nfs/dbraw/zinc/45/11/90/931451190.db2.gz WDRMQPGDRVSLMV-GOSISDBHSA-N 0 3 404.510 4.172 20 0 HIADHN CC(C)NS(=O)(=O)Cc1ccccc1CN[C@H](C)c1ccccc1C(F)(F)F ZINC000532482790 931456368 /nfs/dbraw/zinc/45/63/68/931456368.db2.gz IRRQLNPYPUDKAZ-OAHLLOKOSA-N 0 3 414.493 4.384 20 0 HIADHN C[C@@H](N[C@H](C)c1cc(F)ccc1N1CCN(C)CC1)c1ccc2c(c1)OCCCO2 ZINC000532483200 931456613 /nfs/dbraw/zinc/45/66/13/931456613.db2.gz WGCNAPBBOBOUGX-QZTJIDSGSA-N 0 3 413.537 4.151 20 0 HIADHN CC(C)(CN[C@@H]1CCc2ccccc21)S(=O)(=O)c1ccc(Br)cc1 ZINC000532500539 931463994 /nfs/dbraw/zinc/46/39/94/931463994.db2.gz NLGOSPUHSIRDRN-GOSISDBHSA-N 0 3 408.361 4.279 20 0 HIADHN Cc1ccc(NC(=O)C[C@@H](C)NCc2ccnc(OC3CCOCC3)c2)c(Cl)c1 ZINC000532511726 931468557 /nfs/dbraw/zinc/46/85/57/931468557.db2.gz QUEBRFGQKALUOB-MRXNPFEDSA-N 0 3 417.937 4.108 20 0 HIADHN O=C(CN1CCC[C@H](c2ccccc2)CC1)N1CCC(OCc2ccccc2)CC1 ZINC000532519569 931472469 /nfs/dbraw/zinc/47/24/69/931472469.db2.gz SGNKQZHEMRDYKY-DEOSSOPVSA-N 0 3 406.570 4.464 20 0 HIADHN COc1ccc([C@H](N[C@@H](C)Cc2ccsc2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000532531081 931512493 /nfs/dbraw/zinc/51/24/93/931512493.db2.gz KHSIFIDRDNVGII-AOMKIAJQSA-N 0 3 415.580 4.470 20 0 HIADHN CSc1nnc(CCCNCc2ccc(F)cc2Br)n1CC(C)C ZINC000532615485 931555187 /nfs/dbraw/zinc/55/51/87/931555187.db2.gz LNAJQQIUEFGADU-UHFFFAOYSA-N 0 3 415.376 4.280 20 0 HIADHN O=c1cc(CN2CCC[C@H](c3nc4ccccc4s3)C2)nc2ccc(Cl)cn12 ZINC000532626948 931558362 /nfs/dbraw/zinc/55/83/62/931558362.db2.gz XJKHHPXMXPSXTD-AWEZNQCLSA-N 0 3 410.930 4.337 20 0 HIADHN O=C(CN[C@@H](c1ccccc1)C1CCC1)N1CCC[C@@H]1c1ccc2c(c1)OCCO2 ZINC000532701620 931595561 /nfs/dbraw/zinc/59/55/61/931595561.db2.gz MFPJOOITYZSATJ-BWKNWUBXSA-N 0 3 406.526 4.252 20 0 HIADHN CCN(CC(=O)N(C)[C@@H](C)CC(C)C)C1CCN(c2cc(C)nc(C(C)C)n2)CC1 ZINC000532732602 931616346 /nfs/dbraw/zinc/61/63/46/931616346.db2.gz PDCMWLQPDWIOAQ-FQEVSTJZSA-N 0 3 417.642 4.092 20 0 HIADHN COC(=O)CCC1CCN(Cc2ccnc(-c3ccc(Br)cc3)n2)CC1 ZINC000532756218 931623098 /nfs/dbraw/zinc/62/30/98/931623098.db2.gz WWIGQYHTWIHLJV-UHFFFAOYSA-N 0 3 418.335 4.071 20 0 HIADHN C[C@@H](Cc1cc(Br)ccc1F)NCc1ccc(Br)cn1 ZINC000532859127 931667628 /nfs/dbraw/zinc/66/76/28/931667628.db2.gz ZNTOLXHGGPCCQC-JTQLQIEISA-N 0 3 402.105 4.467 20 0 HIADHN COc1ccc(CNC[C@@H](CO)Cc2ccccc2C(F)(F)F)c(Cl)c1OC ZINC000532868054 931673309 /nfs/dbraw/zinc/67/33/09/931673309.db2.gz NHIFUAARQRSUND-ZDUSSCGKSA-N 0 3 417.855 4.317 20 0 HIADHN O=C(CC1CCCC1)NC1CCN(Cc2ccc(OCc3cccnc3)cc2)CC1 ZINC000532959963 931714729 /nfs/dbraw/zinc/71/47/29/931714729.db2.gz CSRCQVKWDVQHJD-UHFFFAOYSA-N 0 3 407.558 4.322 20 0 HIADHN COc1cc2c(cc1CN[C@H](C)[C@@H](OC1CCOCC1)c1ccccc1)O[C@@H](C)C2 ZINC000533007323 931733811 /nfs/dbraw/zinc/73/38/11/931733811.db2.gz HVZYCCZMWJRMOD-YYULODDRSA-N 0 3 411.542 4.434 20 0 HIADHN COc1ccc(CN[C@@H](C)[C@H](OC2CCOCC2)c2ccccc2)c(OC)c1OC ZINC000533007345 931733935 /nfs/dbraw/zinc/73/39/35/931733935.db2.gz MQCUJVNMTJSFED-JTSKRJEESA-N 0 3 415.530 4.127 20 0 HIADHN COC(=O)c1ccc(CN2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)cc1 ZINC000533059333 931758027 /nfs/dbraw/zinc/75/80/27/931758027.db2.gz AIJJVNDDPYYLPD-UHFFFAOYSA-N 0 3 404.869 4.116 20 0 HIADHN Cn1c(CNC[C@@H](CO)Cc2ccc(C(F)(F)F)cc2)nc2cc(Cl)ccc21 ZINC000533106130 931772569 /nfs/dbraw/zinc/77/25/69/931772569.db2.gz JIFQIHAIZFAECA-AWEZNQCLSA-N 0 3 411.855 4.186 20 0 HIADHN Brc1cccc(-c2c[nH]c(CN[C@@H]3[C@@H]4CCO[C@@H]4C34CCCC4)n2)c1 ZINC000533179459 931803059 /nfs/dbraw/zinc/80/30/59/931803059.db2.gz NPHTVDQGMXNEQC-IPELMVKDSA-N 0 3 402.336 4.277 20 0 HIADHN COc1ccc([C@H]2CCCN2C(=O)CN2CCC[C@H]2Cc2ccccc2)cc1OC ZINC000533221945 931813618 /nfs/dbraw/zinc/81/36/18/931813618.db2.gz ZTCNMNWRUHRYSQ-FCHUYYIVSA-N 0 3 408.542 4.074 20 0 HIADHN COc1ccc(CCC2CCN(CC(=O)N3CCC[C@@H](C(F)(F)F)C3)CC2)cc1 ZINC000533235632 931815859 /nfs/dbraw/zinc/81/58/59/931815859.db2.gz CEWZHXXXTQHGRV-LJQANCHMSA-N 0 3 412.496 4.141 20 0 HIADHN Fc1ccc(CNc2ccc3nc(CCN4CCOCC4)[nH]c3c2)c(C(F)(F)F)c1 ZINC000533253260 931819852 /nfs/dbraw/zinc/81/98/52/931819852.db2.gz UKDZJGDHJQCOEO-UHFFFAOYSA-N 0 3 422.426 4.208 20 0 HIADHN O=C(Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)c1cnc(-c2ccccc2)nc1 ZINC000533260208 931821808 /nfs/dbraw/zinc/82/18/08/931821808.db2.gz WHFKKJNDZYOGDY-QFIPXVFZSA-N 0 3 424.508 4.039 20 0 HIADHN O=C(CNC1(c2ccccc2)CCC1)N1CCC[C@@H]1c1ccc2c(c1)OCCCO2 ZINC000533351719 931846108 /nfs/dbraw/zinc/84/61/08/931846108.db2.gz YSCWDBVTFQPPDQ-OAQYLSRUSA-N 0 3 406.526 4.180 20 0 HIADHN Clc1ccc(OC[C@H]2CCCO2)c(CNCCc2nnc(-c3ccccc3)o2)c1 ZINC000533361113 931848282 /nfs/dbraw/zinc/84/82/82/931848282.db2.gz JZAUFCSCPBTVNI-LJQANCHMSA-N 0 3 413.905 4.280 20 0 HIADHN CCCN(Cc1nc(C)c2ccccc2n1)C1CCN(C(=O)c2ccccc2)CC1 ZINC000533372767 931852232 /nfs/dbraw/zinc/85/22/32/931852232.db2.gz QBHBDXSINNTFFH-UHFFFAOYSA-N 0 3 402.542 4.455 20 0 HIADHN Cc1cc(C)c(NC(=O)CNC(=O)CN[C@@H](c2ccccc2)C2CCCC2)c(C)c1 ZINC000533384011 931854660 /nfs/dbraw/zinc/85/46/60/931854660.db2.gz AAEVOABQLLSSEC-VWLOTQADSA-N 0 3 407.558 4.188 20 0 HIADHN CCN(CC(=O)Nc1ccc(N2CCCC2)cc1C)[C@H](C)Cc1ccc(OC)cc1 ZINC000533418893 931862571 /nfs/dbraw/zinc/86/25/71/931862571.db2.gz QMZRTLIFCDMEEL-HXUWFJFHSA-N 0 3 409.574 4.495 20 0 HIADHN CCc1ccc([C@H](NCC(=O)N2CCC(C(=O)Nc3ccccc3)CC2)C(C)C)cc1 ZINC000533471966 931877765 /nfs/dbraw/zinc/87/77/65/931877765.db2.gz XECMFNXBYDCCGQ-RUZDIDTESA-N 0 3 421.585 4.413 20 0 HIADHN Cc1cccc([C@@H]2CCCN2CCc2nc3sc4c(c3c(N)n2)CC[C@H](C)C4)n1 ZINC000533483218 931881234 /nfs/dbraw/zinc/88/12/34/931881234.db2.gz PUCBMZGKJQVQSN-KSSFIOAISA-N 0 3 407.587 4.481 20 0 HIADHN O=c1cc(CN(C2CC2)[C@@H]2CCCc3ccccc32)nc2ccc(Br)cn12 ZINC000533487009 931882362 /nfs/dbraw/zinc/88/23/62/931882362.db2.gz LACYISOKYYWNOH-HXUWFJFHSA-N 0 3 424.342 4.499 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CNC(=O)CN[C@@H](c1ccc(F)cc1)C1CCC1 ZINC000533513779 931890591 /nfs/dbraw/zinc/89/05/91/931890591.db2.gz UAJVIRYMPDAIOD-RUZDIDTESA-N 0 3 420.532 4.375 20 0 HIADHN Cc1cccnc1[C@H](NCC(=O)Nc1ccc2nc(C(F)(F)F)[nH]c2c1)C(C)C ZINC000533518658 931892493 /nfs/dbraw/zinc/89/24/93/931892493.db2.gz RWLCXWGPAWDGMP-QGZVFWFLSA-N 0 3 405.424 4.211 20 0 HIADHN Cc1cccc2nc(CN(C)[C@H]3CCCN(Cc4cn5c(cccc5C)n4)CC3)cn21 ZINC000533606303 931920383 /nfs/dbraw/zinc/92/03/83/931920383.db2.gz KQUQBWOICCUTDJ-QHCPKHFHSA-N 0 3 416.573 4.085 20 0 HIADHN COc1cccc(NC(=O)[C@H](N[C@@H]2[C@H]3CCO[C@H]3C23CCCC3)c2ccccc2)c1 ZINC000533635919 931938255 /nfs/dbraw/zinc/93/82/55/931938255.db2.gz QBABCULEWZLTCF-SSGKUCQKSA-N 0 3 406.526 4.312 20 0 HIADHN COc1ccc(C(=O)N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)cc1-c1ccccn1 ZINC000533650423 931946640 /nfs/dbraw/zinc/94/66/40/931946640.db2.gz WZSCICKKTBEEME-NQIIRXRSSA-N 0 3 401.510 4.150 20 0 HIADHN COc1ccc(C(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)cc1-c1ccccn1 ZINC000533650806 931946710 /nfs/dbraw/zinc/94/67/10/931946710.db2.gz HMDXYMKNQPEGAA-HXUWFJFHSA-N 0 3 415.537 4.494 20 0 HIADHN COc1ccc(C(=O)N[C@@H](CN2CCCC2)c2ccccc2)cc1-c1ccccn1 ZINC000533657137 931951724 /nfs/dbraw/zinc/95/17/24/931951724.db2.gz XDUHMFXZPVYNLC-QHCPKHFHSA-N 0 3 401.510 4.324 20 0 HIADHN COc1ccccc1[C@@H](C)N(C)C(=O)CN1CCC[C@H]1Cn1c(C)nc2ccccc21 ZINC000533758176 932014086 /nfs/dbraw/zinc/01/40/86/932014086.db2.gz BONZTNVHNRSRIW-QUCCMNQESA-N 0 3 420.557 4.037 20 0 HIADHN Cc1cc(C)c(CC(C(=O)Nc2ccccc2S(C)(=O)=O)C(F)(F)F)c(C)c1 ZINC000533770943 932023726 /nfs/dbraw/zinc/02/37/26/932023726.db2.gz UPNARIQIURGKSE-MRXNPFEDSA-N 0 3 413.461 4.375 20 0 HIADHN COc1ccc2cc(CN(C)C(=O)NC[C@@H](Cc3ccccc3)N(C)C)ccc2c1 ZINC000533809418 932042472 /nfs/dbraw/zinc/04/24/72/932042472.db2.gz NKGASEKMEPRAPF-HSZRJFAPSA-N 0 3 405.542 4.163 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)c2ccc(C(=O)N(C)c3ccccc3)cc2)o1 ZINC000533851564 932060651 /nfs/dbraw/zinc/06/06/51/932060651.db2.gz IAWRNWCDHOXKKV-UHFFFAOYSA-N 0 3 419.525 4.069 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2cccc3c2CN(c2ccccn2)C3)N(C)C)cc1 ZINC000533882378 932079495 /nfs/dbraw/zinc/07/94/95/932079495.db2.gz ZUWVWFWKOXVIOM-QHCPKHFHSA-N 0 3 415.541 4.335 20 0 HIADHN Cc1ccc([C@H](CNC(=O)[C@@H](OC2CCOCC2)c2ccccc2)N2CCCC2)cc1 ZINC000533907138 932093542 /nfs/dbraw/zinc/09/35/42/932093542.db2.gz NUKQFQKQKNZTOV-DQEYMECFSA-N 0 3 422.569 4.185 20 0 HIADHN COCC1(O)CCN(Cc2cn(-c3ccccc3)nc2-c2ccc(Cl)cc2)CC1 ZINC000533931180 932107338 /nfs/dbraw/zinc/10/73/38/932107338.db2.gz IIFHSBKRWRKVSU-UHFFFAOYSA-N 0 3 411.933 4.166 20 0 HIADHN CN(Cc1cccc(OC(F)(F)F)c1)C(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000533944384 932117254 /nfs/dbraw/zinc/11/72/54/932117254.db2.gz KBZKWGAJJZPQSD-OALUTQOASA-N 0 3 407.436 4.172 20 0 HIADHN Cc1nc(-c2ccc(CNC(=O)N[C@H]3CCN(C)[C@H]3c3ccccc3)cc2)cs1 ZINC000533945624 932118494 /nfs/dbraw/zinc/11/84/94/932118494.db2.gz SBSNOAOLUMUBPO-UNMCSNQZSA-N 0 3 406.555 4.363 20 0 HIADHN CCCN(C(=O)c1cc(C2CCCCC2)[nH]n1)C1CCN(c2cc(C)nc(C)n2)CC1 ZINC000533945837 932119367 /nfs/dbraw/zinc/11/93/67/932119367.db2.gz YXYVJZXYFIDBLD-UHFFFAOYSA-N 0 3 424.593 4.385 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)c2cc(I)ccc2C)c1 ZINC000533968811 932145406 /nfs/dbraw/zinc/14/54/06/932145406.db2.gz MZQIZHQZMTYWBF-UHFFFAOYSA-N 0 3 408.283 4.222 20 0 HIADHN CN1CC[C@H](NC(=O)c2cccc(-n3nccc3C(F)(F)F)c2)[C@H]1c1ccccc1 ZINC000534018414 932199189 /nfs/dbraw/zinc/19/91/89/932199189.db2.gz DENPDOCUBAGLAA-AZUAARDMSA-N 0 3 414.431 4.066 20 0 HIADHN Cc1ccc(C(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)cc1NC(=O)NC(C)(C)C ZINC000534018838 932200956 /nfs/dbraw/zinc/20/09/56/932200956.db2.gz LNGOAEYLXYKLHU-CTNGQTDRSA-N 0 3 408.546 4.090 20 0 HIADHN CN1CC[C@H](NC(=O)Cc2cc(Cl)ccc2Br)[C@H]1c1ccccc1 ZINC000534019433 932201175 /nfs/dbraw/zinc/20/11/75/932201175.db2.gz QLQHAHZHINJAJI-PKOBYXMFSA-N 0 3 407.739 4.207 20 0 HIADHN CC(C)n1ncc2c1nc(C1CC1)cc2C(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000534020409 932202901 /nfs/dbraw/zinc/20/29/01/932202901.db2.gz VKWVNALKCXXSIB-UNMCSNQZSA-N 0 3 403.530 4.065 20 0 HIADHN CC(C)c1cc(C(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)c2cnn(C(C)C)c2n1 ZINC000534020735 932202987 /nfs/dbraw/zinc/20/29/87/932202987.db2.gz VRPOQVGCODIDGD-IFMALSPDSA-N 0 3 405.546 4.311 20 0 HIADHN CCOc1ccc(F)c(NC(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)c1F ZINC000534034165 932212247 /nfs/dbraw/zinc/21/22/47/932212247.db2.gz AAPARBDCJRNRBC-UHFFFAOYSA-N 0 3 403.473 4.146 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cc(C)n(C(F)F)n1)c1ccc(C(F)(F)F)cc1 ZINC000534150944 932303835 /nfs/dbraw/zinc/30/38/35/932303835.db2.gz PCRQAPPOHCZAQH-INIZCTEOSA-N 0 3 418.410 4.418 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)c2cc3ccccc3cc2OC(F)F)C[C@@H](C)O1 ZINC000534162024 932309321 /nfs/dbraw/zinc/30/93/21/932309321.db2.gz BXGUCJJENSJUDH-HZPDHXFCSA-N 0 3 406.473 4.060 20 0 HIADHN O=C(NC1CCCCC1)N1CCC(NCc2cc(F)ccc2Br)CC1 ZINC000534165084 932311121 /nfs/dbraw/zinc/31/11/21/932311121.db2.gz AWISIAFXXLCZOV-UHFFFAOYSA-N 0 3 412.347 4.185 20 0 HIADHN O=C(N[C@@H]1CCN(Cc2ccccc2)C[C@H]1CO)c1cccc(Oc2ccccc2)c1 ZINC000534181063 932318851 /nfs/dbraw/zinc/31/88/51/932318851.db2.gz AFHPRIGBUQJWJJ-WIOPSUGQSA-N 0 3 416.521 4.092 20 0 HIADHN O=C(N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1CO)c1cccc(Oc2ccccc2)c1 ZINC000534181060 932319034 /nfs/dbraw/zinc/31/90/34/932319034.db2.gz AFHPRIGBUQJWJJ-RCZVLFRGSA-N 0 3 416.521 4.092 20 0 HIADHN CCN1CC[C@H](N(C)C(=O)Nc2ccc(Cl)cc2C(=O)c2ccc[nH]2)[C@H](C)C1 ZINC000534213810 932336269 /nfs/dbraw/zinc/33/62/69/932336269.db2.gz YXQPRFSHGBFZKI-KUHUBIRLSA-N 0 3 402.926 4.093 20 0 HIADHN CC[C@@H](C)n1ncc(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2)c1C1CC1 ZINC000534253864 932367289 /nfs/dbraw/zinc/36/72/89/932367289.db2.gz LEPDJKMEESZKLZ-MRXNPFEDSA-N 0 3 401.530 4.466 20 0 HIADHN O=C(Nc1cc(Cl)c(OCC(F)(F)F)c(Cl)c1)N1CC[C@H](N2CC=CC2)C1 ZINC000534257513 932368405 /nfs/dbraw/zinc/36/84/05/932368405.db2.gz YAAUUNZFQUQGCB-LBPRGKRZSA-N 0 3 424.250 4.413 20 0 HIADHN CC[C@@H](C)CN(C)c1ccc(F)cc1CN1CCC(C(=O)NCC(F)(F)F)CC1 ZINC000534341638 932386501 /nfs/dbraw/zinc/38/65/01/932386501.db2.gz KKRRKEKCMFBWPD-OAHLLOKOSA-N 0 3 417.491 4.199 20 0 HIADHN Cc1cc(C)c(CC(C(=O)Nc2ccc(OCCC(N)=O)cc2)C(F)(F)F)c(C)c1 ZINC000534401079 932424992 /nfs/dbraw/zinc/42/49/92/932424992.db2.gz CGMKXDUXQGPXBJ-IBGZPJMESA-N 0 3 422.447 4.226 20 0 HIADHN Cc1nc2ccccc2n1C[C@H]1CCCN1CC(=O)NC1(c2ccccc2)CCC1 ZINC000534473911 932503257 /nfs/dbraw/zinc/50/32/57/932503257.db2.gz ZQCWRYCMXGASLW-OAQYLSRUSA-N 0 3 402.542 4.005 20 0 HIADHN Cc1cc(Cl)cc(C)c1CNCc1ccc(C(=O)N2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000534560849 932564910 /nfs/dbraw/zinc/56/49/10/932564910.db2.gz KSFHTUIIMYLCCP-HDICACEKSA-N 0 3 400.950 4.496 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2ccc(C(=O)N(C)c3ccccc3)cc2)N(C)C)cc1 ZINC000534564553 932566583 /nfs/dbraw/zinc/56/65/83/932566583.db2.gz AUIPOCYRZMXXRV-DEOSSOPVSA-N 0 3 415.537 4.304 20 0 HIADHN CCOc1ccc(-c2noc(CCC(=O)Nc3cc(C)cc(CN(C)C)c3)n2)cc1 ZINC000534707108 932679029 /nfs/dbraw/zinc/67/90/29/932679029.db2.gz UYVAQFILSAXRGF-UHFFFAOYSA-N 0 3 408.502 4.077 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)[C@H]2CCCN(C(=O)c3ccc(Cl)cc3)C2)c1 ZINC000534710756 932679561 /nfs/dbraw/zinc/67/95/61/932679561.db2.gz RJPDSBUIOCGADR-IBGZPJMESA-N 0 3 413.949 4.201 20 0 HIADHN CCOc1ccc(F)c(NC(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)c1F ZINC000534781282 932761779 /nfs/dbraw/zinc/76/17/79/932761779.db2.gz UJYBMCLWKDPUJS-KRWDZBQOSA-N 0 3 403.473 4.492 20 0 HIADHN O[C@@H](COc1ccc(-c2ccccc2)cc1)CN1CCC(Nc2ccccn2)CC1 ZINC000534862454 932812136 /nfs/dbraw/zinc/81/21/36/932812136.db2.gz JFJINUNZCBKCPG-HSZRJFAPSA-N 0 3 403.526 4.065 20 0 HIADHN COc1ccc(OC2CCN(Cc3ccc(OCc4noc(C)n4)cc3)CC2)cc1 ZINC000535071676 932897397 /nfs/dbraw/zinc/89/73/97/932897397.db2.gz BDUFEJOVAPICJD-UHFFFAOYSA-N 0 3 409.486 4.009 20 0 HIADHN CCCCCOc1ccc(Br)cc1CN(C)C[C@@H]1CCN(C(C)=O)C1 ZINC000535091727 932904361 /nfs/dbraw/zinc/90/43/61/932904361.db2.gz HFZFLFDSCJBWGM-KRWDZBQOSA-N 0 3 411.384 4.318 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)c2cc(-c3ccccn3)ccc2Cl)C[C@@H](C)O1 ZINC000535096614 932912426 /nfs/dbraw/zinc/91/24/26/932912426.db2.gz VJMYNZLUBDAFJG-IAGOWNOFSA-N 0 3 401.938 4.021 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCc2ccc(C(C)=O)cc2CC1)c1ccsc1 ZINC000535215846 933020948 /nfs/dbraw/zinc/02/09/48/933020948.db2.gz KLYHHAYGHYQCHX-JOCHJYFZSA-N 0 3 413.587 4.144 20 0 HIADHN Cc1cc(NC(=O)NCCSCC(C)C)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000535218999 933023426 /nfs/dbraw/zinc/02/34/26/933023426.db2.gz GAQTXJFEEDLPLZ-HXUWFJFHSA-N 0 3 415.607 4.149 20 0 HIADHN Cc1nc(-c2cccc(C)c2)[nH]c1C(=O)NC1CCN([C@H](C)c2ccncc2)CC1 ZINC000535249858 933035423 /nfs/dbraw/zinc/03/54/23/933035423.db2.gz BZZCKNPEKQXIMD-GOSISDBHSA-N 0 3 403.530 4.044 20 0 HIADHN CC(C)Cn1ncc(C(=O)NC[C@H]2CCCN(Cc3cccs3)C2)c1C(F)F ZINC000535349919 933087156 /nfs/dbraw/zinc/08/71/56/933087156.db2.gz MUQVDGNSPWOACR-OAHLLOKOSA-N 0 3 410.534 4.180 20 0 HIADHN CN1CC[C@@H](NC(=O)NCc2cc(Cl)ccc2OC(F)F)[C@@H]1c1ccccc1 ZINC000535358930 933090783 /nfs/dbraw/zinc/09/07/83/933090783.db2.gz WMRIPQUNUDWAQU-AEFFLSMTSA-N 0 3 409.864 4.186 20 0 HIADHN CN(C)Cc1ccc(-c2noc([C@H]3COc4ccc(Br)cc43)n2)cc1 ZINC000535406357 933120250 /nfs/dbraw/zinc/12/02/50/933120250.db2.gz OKESZPSOZDXNAZ-INIZCTEOSA-N 0 3 400.276 4.085 20 0 HIADHN COc1ccccc1[C@H](NC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1)c1ccco1 ZINC000535429504 933130668 /nfs/dbraw/zinc/13/06/68/933130668.db2.gz HJLXWKYOFGDCRZ-WTIAFYNJSA-N 0 3 405.498 4.122 20 0 HIADHN O=C(Nc1cccc2c1CN(c1nccs1)C2)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000535473386 933165257 /nfs/dbraw/zinc/16/52/57/933165257.db2.gz BFZDMVGQPZJWDF-IBGZPJMESA-N 0 3 419.554 4.059 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)c1cccc([C@@H]2CCOC2)c1 ZINC000535606903 933264890 /nfs/dbraw/zinc/26/48/90/933264890.db2.gz VWLBHZVKRMHCQQ-DHIUTWEWSA-N 0 3 416.525 4.086 20 0 HIADHN COc1ccc(C[C@H](C)CN(C)CC(=O)Nc2ccccc2Br)cc1 ZINC000535615604 933269867 /nfs/dbraw/zinc/26/98/67/933269867.db2.gz DRLPOLRAJLXMBR-HNNXBMFYSA-N 0 3 405.336 4.207 20 0 HIADHN COc1ccc(-c2nnc([N-]C(=O)c3oc4ccccc4c3C[NH+](C)C)s2)cc1 ZINC000535711983 933364293 /nfs/dbraw/zinc/36/42/93/933364293.db2.gz ZVMIJJNVHXBZOK-UHFFFAOYSA-N 0 3 408.483 4.274 20 0 HIADHN CC(C)(C)c1nn(-c2ccccc2)cc1CN1CCC(C(=O)NCC(F)(F)F)CC1 ZINC000535794248 933392436 /nfs/dbraw/zinc/39/24/36/933392436.db2.gz GNQDTDWEBGPOFH-UHFFFAOYSA-N 0 3 422.495 4.060 20 0 HIADHN C[C@@H](C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)N1CC[C@@H](C2CCOCC2)C1 ZINC000535870336 933452217 /nfs/dbraw/zinc/45/22/17/933452217.db2.gz LZLKHIGMPDVGFJ-GXTWGEPZSA-N 0 3 404.860 4.434 20 0 HIADHN C[C@H](C(=O)Nc1ccc2c(c1)OC1(CCCCC1)O2)N1CC[C@@H](C2CCOCC2)C1 ZINC000535871354 933453387 /nfs/dbraw/zinc/45/33/87/933453387.db2.gz SQMJTQWBTZPLMJ-IEBWSBKVSA-N 0 3 414.546 4.194 20 0 HIADHN CC1(C)CCC[C@H](CC(=O)N2CCC[C@H](CN3CCN(c4ccccn4)CC3)C2)C1 ZINC000535966555 933529245 /nfs/dbraw/zinc/52/92/45/933529245.db2.gz IYQBULOSOKGPSI-FGZHOGPDSA-N 0 3 412.622 4.049 20 0 HIADHN O=C(CCN1CCC[C@@H](c2nncn2C2CC2)C1)Nc1cc(Cl)ccc1Cl ZINC000536029905 933579170 /nfs/dbraw/zinc/57/91/70/933579170.db2.gz SQOGBCJIABOHLJ-CYBMUJFWSA-N 0 3 408.333 4.128 20 0 HIADHN CC[C@](C)(COc1ncccc1Cl)NCC(=O)Nc1ccc(OC(F)F)cc1 ZINC000536030047 933579501 /nfs/dbraw/zinc/57/95/01/933579501.db2.gz WMZCBRVVXIUBPP-LJQANCHMSA-N 0 3 413.852 4.112 20 0 HIADHN C[C@H](NC(=O)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1)c1cn[nH]c1 ZINC000536048355 933594825 /nfs/dbraw/zinc/59/48/25/933594825.db2.gz SDDCFFLWEWGHKJ-AWEZNQCLSA-N 0 3 410.349 4.085 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)CCc2ncc(-c3ccccc3)o2)cc1 ZINC000536096513 933648418 /nfs/dbraw/zinc/64/84/18/933648418.db2.gz RTPFESJRMVXIEJ-JOCHJYFZSA-N 0 3 419.525 4.236 20 0 HIADHN O=C(CN[C@H](c1ccccc1)C1CC1)N1CCC[C@H]1c1ccc2c(c1)OCCCO2 ZINC000537288362 933698860 /nfs/dbraw/zinc/69/88/60/933698860.db2.gz UTCCGLTUXSTUBE-SQJMNOBHSA-N 0 3 406.526 4.252 20 0 HIADHN COc1ccc([C@H](C)NCCc2cc(F)cc3c2OCOC3)c(Br)c1 ZINC000537294328 933700906 /nfs/dbraw/zinc/70/09/06/933700906.db2.gz CBKAUWIYYIDJQN-LBPRGKRZSA-N 0 3 410.283 4.357 20 0 HIADHN C[C@@H](N[C@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O)c1ccc2c(c1)OCO2 ZINC000537346649 933728732 /nfs/dbraw/zinc/72/87/32/933728732.db2.gz BYVDQLDLIQFVQO-KDOFPFPSSA-N 0 3 420.431 4.276 20 0 HIADHN COC(=O)c1ccc(CNc2cccc(N3CCN(CCc4ccccc4)CC3)c2)o1 ZINC000537350596 933730840 /nfs/dbraw/zinc/73/08/40/933730840.db2.gz XKZFYGPLROIVMP-UHFFFAOYSA-N 0 3 419.525 4.043 20 0 HIADHN Cc1cc(NC(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)nn1-c1cccc(F)c1 ZINC000537378850 933745289 /nfs/dbraw/zinc/74/52/89/933745289.db2.gz XTXNANWSKVMVRD-OAQYLSRUSA-N 0 3 407.493 4.058 20 0 HIADHN O=C(CCNCc1cccc(NC(=O)c2ccc(Cl)cc2)c1)Nc1ccccn1 ZINC000537506712 933796849 /nfs/dbraw/zinc/79/68/49/933796849.db2.gz AKNSUHANKJHODR-UHFFFAOYSA-N 0 3 408.889 4.106 20 0 HIADHN c1sc(-c2ccccc2)nc1CNc1ccc2nc(CCN3CCOCC3)[nH]c2c1 ZINC000537505794 933797361 /nfs/dbraw/zinc/79/73/61/933797361.db2.gz JAHLGVRWAXFMRA-UHFFFAOYSA-N 0 3 419.554 4.173 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@H](NCc2cccc(C(=O)N[C@@H](C)CC)c2)c2ccccc21 ZINC000562758476 945116322 /nfs/dbraw/zinc/11/63/22/945116322.db2.gz SEBCGKGTSCSZBG-IMRHEYAYSA-N 0 3 408.542 4.486 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)Nc1nc2c(s1)COCC2)c1ccc(Cl)cc1 ZINC000562877962 945138362 /nfs/dbraw/zinc/13/83/62/945138362.db2.gz IUODJAVKCIPDLK-INIZCTEOSA-N 0 3 408.955 4.074 20 0 HIADHN Cc1nc([C@H]2CCCN([C@H](C(=O)Nc3cc(C)ccc3C)c3ccccc3)C2)n[nH]1 ZINC000537564335 938326296 /nfs/dbraw/zinc/32/62/96/938326296.db2.gz SVDLRTFFECSQED-UNMCSNQZSA-N 0 3 403.530 4.289 20 0 HIADHN Cc1n[nH]c([C@H]2CCCN([C@H](C(=O)Nc3cc(C)ccc3C)c3ccccc3)C2)n1 ZINC000537564335 938326299 /nfs/dbraw/zinc/32/62/99/938326299.db2.gz SVDLRTFFECSQED-UNMCSNQZSA-N 0 3 403.530 4.289 20 0 HIADHN Cc1nnc([C@H]2CCCN([C@H](C(=O)Nc3cc(C)ccc3C)c3ccccc3)C2)[nH]1 ZINC000537564335 938326301 /nfs/dbraw/zinc/32/63/01/938326301.db2.gz SVDLRTFFECSQED-UNMCSNQZSA-N 0 3 403.530 4.289 20 0 HIADHN Cc1nc(-c2ccc(F)c(F)c2)sc1C(=O)NC[C@H](c1ccccc1)N(C)C ZINC000537593259 938330543 /nfs/dbraw/zinc/33/05/43/938330543.db2.gz XTYRFAWBSXBOSI-GOSISDBHSA-N 0 3 401.482 4.429 20 0 HIADHN CCC1(O)CCN(Cc2cn(-c3ccccc3)nc2-c2cc(OC)ccc2OC)CC1 ZINC000537619036 938335459 /nfs/dbraw/zinc/33/54/59/938335459.db2.gz WTXIYVRESPQGPS-UHFFFAOYSA-N 0 3 421.541 4.293 20 0 HIADHN Cc1ccccc1-c1nn(-c2ccccc2)cc1CN1CCC[C@@H](N2CCCC2=O)C1 ZINC000537631134 938341112 /nfs/dbraw/zinc/34/11/12/938341112.db2.gz KKQKHGWKHOUKPD-HSZRJFAPSA-N 0 3 414.553 4.435 20 0 HIADHN Brc1ccc(OCc2ccccn2)c(CN2CC[C@H]([C@@H]3CCOC3)C2)c1 ZINC000537647993 938345742 /nfs/dbraw/zinc/34/57/42/938345742.db2.gz FZEVRYGKQQQFTQ-DLBZAZTESA-N 0 3 417.347 4.282 20 0 HIADHN C[C@H]1CCN(C(=O)CCn2c3ccccc3nc2C2CC2)CCN1Cc1ccccc1 ZINC000537672857 938350816 /nfs/dbraw/zinc/35/08/16/938350816.db2.gz HPQSNIYBWOVTDZ-FQEVSTJZSA-N 0 3 416.569 4.427 20 0 HIADHN C[C@@H]1CCN(C(=O)CCn2c3ccccc3nc2C2CC2)CCN1Cc1ccccc1 ZINC000537672858 938350887 /nfs/dbraw/zinc/35/08/87/938350887.db2.gz HPQSNIYBWOVTDZ-HXUWFJFHSA-N 0 3 416.569 4.427 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)[C@H](C)Oc2ccccc2Cl)cc1 ZINC000537731297 938364985 /nfs/dbraw/zinc/36/49/85/938364985.db2.gz TUJGFKOUDGIWLG-JXFKEZNVSA-N 0 3 402.922 4.069 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)c2cc(Br)ccc2F)cc1 ZINC000537729670 938364999 /nfs/dbraw/zinc/36/49/99/938364999.db2.gz HULQKVBEOUPPLC-IBGZPJMESA-N 0 3 421.310 4.164 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)[C@@H]2C[C@H]2c2c(F)cccc2F)cc1 ZINC000537731499 938365409 /nfs/dbraw/zinc/36/54/09/938365409.db2.gz UQTYWHKUDXZTCL-OPYAIIAOSA-N 0 3 400.469 4.030 20 0 HIADHN COCCc1nc(C)c([C@H](C)N[C@H](C)c2ccc(NC(=O)NC3CC3)cc2)s1 ZINC000537765370 938372511 /nfs/dbraw/zinc/37/25/11/938372511.db2.gz OIAAIQCDMWAAGN-KGLIPLIRSA-N 0 3 402.564 4.336 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N2CCC(Cc3cccnc3)CC2)N2CCCC2)cc1 ZINC000537817800 938383663 /nfs/dbraw/zinc/38/36/63/938383663.db2.gz LJIKILISPMKGHK-DEOSSOPVSA-N 0 3 406.574 4.191 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)N[C@@H](c2ccccc2)[C@@H]2CCOC2)CC1 ZINC000537895080 938402879 /nfs/dbraw/zinc/40/28/79/938402879.db2.gz SFNLYDPGMQEXML-VWNXMTODSA-N 0 3 407.558 4.070 20 0 HIADHN C[C@@H](N[C@@H]1CCc2cc(F)ccc21)c1ccc(S(=O)(=O)NCc2ccco2)cc1 ZINC000537937423 938422308 /nfs/dbraw/zinc/42/23/08/938422308.db2.gz KMONHKAIQQQCLM-IVZQSRNASA-N 0 3 414.502 4.235 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc([S@](C)=O)cc1)c1ccc(I)cc1 ZINC000537939221 938424335 /nfs/dbraw/zinc/42/43/35/938424335.db2.gz IIHBKOHHHVQNPQ-BYVOGVQKSA-N 0 3 413.324 4.440 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc([S@@](C)=O)cc1)c1ccc(I)cc1 ZINC000537939223 938424541 /nfs/dbraw/zinc/42/45/41/938424541.db2.gz IIHBKOHHHVQNPQ-OYMPBJRDSA-N 0 3 413.324 4.440 20 0 HIADHN CC(C)C[C@H](NCc1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1)c1ccccc1 ZINC000537939027 938424567 /nfs/dbraw/zinc/42/45/67/938424567.db2.gz ZUBLHWDUAOPTEP-GGAORHGYSA-N 0 3 416.587 4.021 20 0 HIADHN C[C@H](NCc1ccccc1CS(=O)(=O)N1CCCC1)c1cc2c(s1)CCC2 ZINC000537941730 938425679 /nfs/dbraw/zinc/42/56/79/938425679.db2.gz BEMHBFIUNKPWFX-INIZCTEOSA-N 0 3 404.601 4.013 20 0 HIADHN COC(=O)c1ccc(CN[C@@H](C)CC(=O)Nc2cccc(C(F)(F)F)c2)cc1OC ZINC000537942593 938426248 /nfs/dbraw/zinc/42/62/48/938426248.db2.gz IURRJGULWRAFKN-ZDUSSCGKSA-N 0 3 424.419 4.008 20 0 HIADHN Cc1c([C@@H](C)NC2CCC(C(=O)OC(C)(C)C)CC2)nnn1-c1ccc(F)cc1 ZINC000537950688 938429678 /nfs/dbraw/zinc/42/96/78/938429678.db2.gz IOCOAKVSBBVXAZ-MXWWQKGMSA-N 0 3 402.514 4.266 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(S(C)(=O)=O)cc1)[C@@H](OC1CCOCC1)c1ccccc1 ZINC000537949211 938429944 /nfs/dbraw/zinc/42/99/44/938429944.db2.gz WSKAZRARSGOLKM-YZZKKUAISA-N 0 3 417.571 4.066 20 0 HIADHN C[C@@H](NCc1ccc(COC2CCOCC2)cc1)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000537951787 938430805 /nfs/dbraw/zinc/43/08/05/938430805.db2.gz BTRHVQQKHOVWTR-QGZVFWFLSA-N 0 3 408.542 4.463 20 0 HIADHN C[C@H](NC[C@H](O)COc1ccccc1Br)c1ccc2ccccc2n1 ZINC000537959351 938434850 /nfs/dbraw/zinc/43/48/50/938434850.db2.gz CSUYDELJLAJUQW-HOCLYGCPSA-N 0 3 401.304 4.088 20 0 HIADHN CCc1nc([C@@H](C)N[C@H](C)CC(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)n[nH]1 ZINC000537961404 938435365 /nfs/dbraw/zinc/43/53/65/938435365.db2.gz JFWGAIMEQACADU-NXEZZACHSA-N 0 3 403.836 4.107 20 0 HIADHN Cc1ccccc1NC(=O)C[C@H](C)N[C@H](c1ccc(Cl)cc1)[C@H]1CN(C)CCO1 ZINC000537963369 938436568 /nfs/dbraw/zinc/43/65/68/938436568.db2.gz JMTKJMFQHHBPET-AMHTUMDSSA-N 0 3 415.965 4.027 20 0 HIADHN C[C@H](NCCCOC1CCOCC1)c1ccc(Br)cc1Br ZINC000537987187 938449572 /nfs/dbraw/zinc/44/95/72/938449572.db2.gz NSIXLSXHOMSBFN-LBPRGKRZSA-N 0 3 421.173 4.448 20 0 HIADHN COc1cc(CN[C@@H](C)c2cccc(NS(C)(=O)=O)c2)ccc1OC1CCCC1 ZINC000537992109 938454098 /nfs/dbraw/zinc/45/40/98/938454098.db2.gz RWEJOBZLCLELTN-INIZCTEOSA-N 0 3 418.559 4.239 20 0 HIADHN COc1ccc2c(c1)[C@@H](NCc1nnc(-c3ccc(Br)cc3)[nH]1)CCC2 ZINC000538018330 938464242 /nfs/dbraw/zinc/46/42/42/938464242.db2.gz OPVQVIKJUGAHQM-SFHVURJKSA-N 0 3 413.319 4.410 20 0 HIADHN COc1ccc2c(c1)[C@@H]([NH2+]Cc1nnc(-c3ccc(Br)cc3)[n-]1)CCC2 ZINC000538018330 938464251 /nfs/dbraw/zinc/46/42/51/938464251.db2.gz OPVQVIKJUGAHQM-SFHVURJKSA-N 0 3 413.319 4.410 20 0 HIADHN C[C@@H](Cc1ccccc1)n1cccc1C(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000538020531 938465849 /nfs/dbraw/zinc/46/58/49/938465849.db2.gz GWNMBFQFGZMXEL-BHDDXSALSA-N 0 3 423.601 4.253 20 0 HIADHN CCCN1c2ccc(NC(=O)N(CCN(C)C)Cc3cccc(C)c3)cc2CCC1=O ZINC000538031781 938473910 /nfs/dbraw/zinc/47/39/10/938473910.db2.gz BTQLSBPLFDPETK-UHFFFAOYSA-N 0 3 422.573 4.280 20 0 HIADHN COc1cc(OC)cc(OCCCN[C@@H](C)c2nc3ccc(Cl)cc3n2C)c1 ZINC000538113174 938505345 /nfs/dbraw/zinc/50/53/45/938505345.db2.gz AAHAJUXZISBBQZ-AWEZNQCLSA-N 0 3 403.910 4.364 20 0 HIADHN C[C@@H](NCc1cc(F)cc(Br)c1)c1ccc(OCC(=O)NC2CC2)cc1 ZINC000538123457 938510256 /nfs/dbraw/zinc/51/02/56/938510256.db2.gz PXFVPFLGRVUSGA-CYBMUJFWSA-N 0 3 421.310 4.096 20 0 HIADHN CC[C@H](N[C@H](C)C(=O)Nc1cc(NC(C)=O)ccc1OC)c1cccc(Cl)c1 ZINC000538128886 938513179 /nfs/dbraw/zinc/51/31/79/938513179.db2.gz PHAKEUJAEDUIGE-ACJLOTCBSA-N 0 3 403.910 4.375 20 0 HIADHN O=S(=O)(Cc1cccc(C(F)(F)F)c1)N1C[C@H]2CCCN2Cc2ccccc21 ZINC000538132986 938515882 /nfs/dbraw/zinc/51/58/82/938515882.db2.gz WTBIRVBSAXDPSW-GOSISDBHSA-N 0 3 410.461 4.020 20 0 HIADHN CC[C@@H](NCc1cccc(Br)c1C)c1ccccc1OCC(=O)N(C)C ZINC000538149483 938521956 /nfs/dbraw/zinc/52/19/56/938521956.db2.gz AMRJTPUVISCICA-LJQANCHMSA-N 0 3 419.363 4.465 20 0 HIADHN C[C@@H](N[C@@H](C)c1cccc(-n2cccn2)c1)C(=O)Nc1ccccc1Br ZINC000538189312 938544692 /nfs/dbraw/zinc/54/46/92/938544692.db2.gz YPKFIINDRGBDPJ-LSDHHAIUSA-N 0 3 413.319 4.313 20 0 HIADHN COC[C@H](NC[C@@H](CO)Cc1ccccc1C(F)(F)F)c1ccc(F)c(F)c1 ZINC000538195877 938549755 /nfs/dbraw/zinc/54/97/55/938549755.db2.gz UJOIELPHRALPPH-DJJJIMSYSA-N 0 3 403.391 4.112 20 0 HIADHN CCOc1ccc(CN(C)C(=O)CN[C@H](C)c2ccc(-c3ccncc3)cc2)cc1 ZINC000538240191 938570886 /nfs/dbraw/zinc/57/08/86/938570886.db2.gz WTRFKGZFJQNMNQ-LJQANCHMSA-N 0 3 403.526 4.457 20 0 HIADHN C[C@@H](N[C@H](C)c1cccc(N2CCCC2)c1)C(=O)Nc1ccc2c(c1)OCCCO2 ZINC000538279142 938581933 /nfs/dbraw/zinc/58/19/33/938581933.db2.gz KBUYTQHGJCSRDQ-QZTJIDSGSA-N 0 3 409.530 4.126 20 0 HIADHN CC(C)(C)[C@H](COc1ccccc1F)NCc1cc(=O)n2cc(Cl)ccc2n1 ZINC000538392776 938609876 /nfs/dbraw/zinc/60/98/76/938609876.db2.gz MWZGFDAKPXFETB-SFHVURJKSA-N 0 3 403.885 4.070 20 0 HIADHN COc1ccc([C@@H](C)NCCc2ccc(OC)c(OC)c2OC)c(Br)c1 ZINC000538393543 938609988 /nfs/dbraw/zinc/60/99/88/938609988.db2.gz NUXNEYNUMKLNKI-CYBMUJFWSA-N 0 3 424.335 4.377 20 0 HIADHN Cc1noc(CCNCc2cccc(NC(=O)c3ccc(Cl)cc3Cl)c2)n1 ZINC000538404246 938612556 /nfs/dbraw/zinc/61/25/56/938612556.db2.gz XNWNFSGXEJNWOY-UHFFFAOYSA-N 0 3 405.285 4.269 20 0 HIADHN COc1ccc([C@@H](C)NCCc2nc3c(cccc3F)n2C)c(Br)c1 ZINC000538408780 938613362 /nfs/dbraw/zinc/61/33/62/938613362.db2.gz QPIIWNBMXZYKEV-GFCCVEGCSA-N 0 3 406.299 4.377 20 0 HIADHN COc1cc(Cl)c(C)cc1NC(=O)CCNCc1c(C2CC2)nc2sccn12 ZINC000538430009 938617779 /nfs/dbraw/zinc/61/77/79/938617779.db2.gz JLQOLSOYXXGHDJ-UHFFFAOYSA-N 0 3 418.950 4.362 20 0 HIADHN COc1cc(OC)c(CNC[C@@H]2CCN(C)[C@@H]2c2ccc(Cl)c(F)c2)c(OC)c1 ZINC000538463708 938628046 /nfs/dbraw/zinc/62/80/46/938628046.db2.gz FHBMBULTCGJDPP-OYHNWAKOSA-N 0 3 422.928 4.288 20 0 HIADHN Cc1cc(C(=O)N2CC[C@@H](N3CCCCC3)C2)nn1-c1ccc(Cl)cc1Cl ZINC000538491551 938633938 /nfs/dbraw/zinc/63/39/38/938633938.db2.gz HEMMTZNLKFGUNX-MRXNPFEDSA-N 0 3 407.345 4.188 20 0 HIADHN O=C(CCc1ccccc1)N1CC[C@@H](N[C@@H]2CCCOc3cc4c(cc32)CCC4)C1 ZINC000538560758 938649609 /nfs/dbraw/zinc/64/96/09/938649609.db2.gz VAKWTIYFWMKNKW-ISKFKSNPSA-N 0 3 404.554 4.212 20 0 HIADHN Cc1cc(C(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)nn1[C@H](C)C1CC1 ZINC000538565723 938650788 /nfs/dbraw/zinc/65/07/88/938650788.db2.gz CSXORDUNNYCUBL-WIYYLYMNSA-N 0 3 418.545 4.058 20 0 HIADHN Cc1ccc(C)c(NC(=O)Cc2nc(CN3CCC[C@@H]3C3CCOCC3)cs2)c1 ZINC000538627295 938666497 /nfs/dbraw/zinc/66/64/97/938666497.db2.gz KAQCLYAKKVYWFP-OAQYLSRUSA-N 0 3 413.587 4.332 20 0 HIADHN C[C@]1(C2CCN(Cc3ccc(-c4ccc(Cl)c(Cl)c4)o3)CC2)NC(=O)NC1=O ZINC000538725078 938692509 /nfs/dbraw/zinc/69/25/09/938692509.db2.gz TVTBSOIVAQHJNV-HXUWFJFHSA-N 0 3 422.312 4.064 20 0 HIADHN CCN(CC)[C@H](CNC(=O)[C@@H]1C[C@@H](C)O[C@@H](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000538744614 938699577 /nfs/dbraw/zinc/69/95/77/938699577.db2.gz FBVFZSYXCBIMIA-LORHWOILSA-N 0 3 400.485 4.408 20 0 HIADHN COc1ccccc1COC1CCN(C[C@@H](O)COc2ccc3ccccc3c2)CC1 ZINC000538786783 938710781 /nfs/dbraw/zinc/71/07/81/938710781.db2.gz MWPPMXFBQCRGNS-HSZRJFAPSA-N 0 3 421.537 4.269 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)Cc2cccc(OCc3cccnc3)c2)C1 ZINC000538839836 938723220 /nfs/dbraw/zinc/72/32/20/938723220.db2.gz BGFFFYAPUUMQEU-HYBUGGRVSA-N 0 3 415.537 4.155 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N[C@H](c2ccccc2)[C@H]2CCOC2)N2CCCC2)cc1 ZINC000538999079 938764658 /nfs/dbraw/zinc/76/46/58/938764658.db2.gz RIPDZCNJRAJCQU-KMDXXIMOSA-N 0 3 407.558 4.209 20 0 HIADHN Cc1cc(NC(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)nn1-c1ccccc1 ZINC000539017076 938770034 /nfs/dbraw/zinc/77/00/34/938770034.db2.gz XVUHQJQWXKSFJD-HXUWFJFHSA-N 0 3 403.530 4.309 20 0 HIADHN CC[C@@H](NCc1ccc(S(=O)(=O)N2CCCCC2)cc1)c1cccc(OC)c1 ZINC000539019615 938771096 /nfs/dbraw/zinc/77/10/96/938771096.db2.gz LTILXHROEXLBPK-JOCHJYFZSA-N 0 3 402.560 4.111 20 0 HIADHN CCOc1ccc([C@@H](C)N[C@H](C)c2ccc(S(=O)(=O)N(C)C)cc2)cc1OCC ZINC000539021193 938771262 /nfs/dbraw/zinc/77/12/62/938771262.db2.gz VVUOZTNGCUKYMW-IAGOWNOFSA-N 0 3 420.575 4.146 20 0 HIADHN CCC[C@H](NC[C@@H](O)CS(=O)(=O)c1cccs1)c1cccc(C(F)(F)F)c1 ZINC000539049061 938782642 /nfs/dbraw/zinc/78/26/42/938782642.db2.gz ACTLIEVKVUYORE-CVEARBPZSA-N 0 3 421.506 4.033 20 0 HIADHN CCN(CC)C(=O)Nc1ccc([C@@H](C)NCc2nc(-c3ccc(F)cc3)n[nH]2)cc1 ZINC000539056498 938785561 /nfs/dbraw/zinc/78/55/61/938785561.db2.gz NLIKMYLPZXDIAQ-OAHLLOKOSA-N 0 3 410.497 4.335 20 0 HIADHN CCN(CC)C(=O)Nc1ccc([C@@H](C)[NH2+]Cc2nnc(-c3ccc(F)cc3)[n-]2)cc1 ZINC000539056498 938785563 /nfs/dbraw/zinc/78/55/63/938785563.db2.gz NLIKMYLPZXDIAQ-OAHLLOKOSA-N 0 3 410.497 4.335 20 0 HIADHN O[C@@H](CN[C@H]1CCSc2c(F)cccc21)COc1ccccc1Br ZINC000539060311 938787562 /nfs/dbraw/zinc/78/75/62/938787562.db2.gz UBNMBELQVHFSDW-LRDDRELGSA-N 0 3 412.324 4.155 20 0 HIADHN O=C1c2ccccc2C(=O)N1[C@H]1CCCC[C@H](NCc2ccn(C3CCCC3)n2)C1 ZINC000539061431 938787608 /nfs/dbraw/zinc/78/76/08/938787608.db2.gz MHIPNBNKTYOGNJ-PXNSSMCTSA-N 0 3 406.530 4.085 20 0 HIADHN CC(C)NC(=O)Nc1ccc([C@@H](C)NCc2cccc(CN3CCCC3=O)c2)cc1 ZINC000539075597 938795301 /nfs/dbraw/zinc/79/53/01/938795301.db2.gz JJJGGDWCTIXOOO-GOSISDBHSA-N 0 3 408.546 4.190 20 0 HIADHN C[C@H](NC1CCN(C(=O)CC(F)(F)F)CC1)c1ccc(F)cc1Br ZINC000539076542 938796268 /nfs/dbraw/zinc/79/62/68/938796268.db2.gz GNGOYPYROGFZAE-JTQLQIEISA-N 0 3 411.237 4.182 20 0 HIADHN C[C@H](NCc1cccc(OC(F)F)c1)c1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000539076493 938796304 /nfs/dbraw/zinc/79/63/04/938796304.db2.gz MHLVNYHJEAAJGW-INIZCTEOSA-N 0 3 424.513 4.313 20 0 HIADHN C[C@@H](NCc1ccc(C(=O)N2C[C@@H](C)O[C@H](C)C2)cc1)c1cnc2ccsc2c1 ZINC000539089581 938800400 /nfs/dbraw/zinc/80/04/00/938800400.db2.gz AYYLGJBRXUBNEP-BRWVUGGUSA-N 0 3 409.555 4.397 20 0 HIADHN C[C@@H](NCc1ccc(-n2cncn2)cc1)c1cccc(OCc2cn3ccccc3n2)c1 ZINC000539088667 938800550 /nfs/dbraw/zinc/80/05/50/938800550.db2.gz XPYAJOANSBICPO-LJQANCHMSA-N 0 3 424.508 4.345 20 0 HIADHN CCc1nc2c(s1)[C@H](NCc1ccc(C(=O)N3C[C@@H](C)O[C@@H](C)C3)cc1)CCC2 ZINC000539091680 938801334 /nfs/dbraw/zinc/80/13/34/938801334.db2.gz JNAYLXLIJVKXAL-JTDSTZFVSA-N 0 3 413.587 4.122 20 0 HIADHN C[C@@H]1CC[C@H](NCc2ccccc2OCC(=O)NC[C@H]2CCCO2)c2ccccc21 ZINC000539091763 938801337 /nfs/dbraw/zinc/80/13/37/938801337.db2.gz WHSJMAIGKCQACS-XQFWAAQXSA-N 0 3 408.542 4.089 20 0 HIADHN C[C@H]1Cc2ccc(F)cc2[C@H]1[NH2+]Cc1nnc(-c2ccc(Br)cc2)[n-]1 ZINC000539121108 938805795 /nfs/dbraw/zinc/80/57/95/938805795.db2.gz AINSGIGKXZPQOV-VOJFVSQTSA-N 0 3 401.283 4.396 20 0 HIADHN C[C@@H]1CN(c2ccc(CN[C@@H](c3ccc(Br)cc3)C3CC3)cn2)CCO1 ZINC000539159393 938813986 /nfs/dbraw/zinc/81/39/86/938813986.db2.gz PGBOCWSJLHDKCA-QVKFZJNVSA-N 0 3 416.363 4.310 20 0 HIADHN CCOc1ccc([C@H](C)NC(=O)CCCN[C@H](C)c2nc3ccccc3n2C)cc1 ZINC000539216257 938819821 /nfs/dbraw/zinc/81/98/21/938819821.db2.gz BIYFCKSKSDESQH-ZWKOTPCHSA-N 0 3 408.546 4.280 20 0 HIADHN C[C@@H](N[C@@H](c1ccc(Br)cc1)C1CCC1)c1cccc(S(N)(=O)=O)c1 ZINC000539216831 938820084 /nfs/dbraw/zinc/82/00/84/938820084.db2.gz KLNSVWKKKQUCNM-BFUOFWGJSA-N 0 3 423.376 4.289 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(Br)cc1)C(=O)N[C@H]1CCOc2ccccc21 ZINC000539246539 938825257 /nfs/dbraw/zinc/82/52/57/938825257.db2.gz MYTXNSTWHUBTOF-LBTNJELSSA-N 0 3 403.320 4.128 20 0 HIADHN C[C@H](N[C@@H](C)c1ccccc1-n1cccn1)C(=O)Nc1ccc(OC(F)F)cc1 ZINC000539261103 938829299 /nfs/dbraw/zinc/82/92/99/938829299.db2.gz YTYKHCGLYUHEDN-GJZGRUSLSA-N 0 3 400.429 4.152 20 0 HIADHN CN(Cc1cc(Cl)cc(Cl)c1)C(=O)CN[C@@H](c1ccccc1)[C@H]1CCOC1 ZINC000539290059 938834382 /nfs/dbraw/zinc/83/43/82/938834382.db2.gz UNQIYTAOVAPCCC-UWJYYQICSA-N 0 3 407.341 4.319 20 0 HIADHN C[C@@H](NCCSCc1ccc(Cl)cc1Cl)c1cccc(S(N)(=O)=O)c1 ZINC000539297631 938835830 /nfs/dbraw/zinc/83/58/30/938835830.db2.gz HZUCYUNPMDZBCQ-GFCCVEGCSA-N 0 3 419.399 4.225 20 0 HIADHN Cc1ccccc1NC(=O)[C@@H](C)N[C@@H](C)c1ccc(NC(=O)c2ccncc2)cc1 ZINC000539297328 938835999 /nfs/dbraw/zinc/83/59/99/938835999.db2.gz QSJJLBDMHRHBCA-ZWKOTPCHSA-N 0 3 402.498 4.320 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)N[C@@H]1CCO[C@H]1c1ccc(Cl)cc1 ZINC000539299896 938836543 /nfs/dbraw/zinc/83/65/43/938836543.db2.gz VFXWIGQMXPUBRM-VSKRKVRLSA-N 0 3 413.949 4.306 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)N[C@H]1CCO[C@H]1c1ccc(Cl)cc1 ZINC000539305535 938837619 /nfs/dbraw/zinc/83/76/19/938837619.db2.gz KKEBAIRJPDMNOD-PXNSSMCTSA-N 0 3 403.910 4.062 20 0 HIADHN CC[C@@H](NCCc1ccc(OCC(=O)Nc2ccc(C)cc2)cc1)c1nccn1C ZINC000539315003 938839785 /nfs/dbraw/zinc/83/97/85/938839785.db2.gz RYEOMXSWYJDXOL-JOCHJYFZSA-N 0 3 406.530 4.029 20 0 HIADHN C[C@H](NCC(=O)N[C@@H](C)c1ccc(Cl)c(Cl)c1)c1ccc(-n2ccnn2)cc1 ZINC000539330517 938842859 /nfs/dbraw/zinc/84/28/59/938842859.db2.gz QZCCYEPCDODZKX-KBPBESRZSA-N 0 3 418.328 4.102 20 0 HIADHN C[C@H](NCC(=O)N(Cc1ccccc1)CC(F)(F)F)c1ccc(-n2cccn2)cc1 ZINC000539337430 938844319 /nfs/dbraw/zinc/84/43/19/938844319.db2.gz RRCJNEHCEDPUSV-KRWDZBQOSA-N 0 3 416.447 4.114 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(-n2cccn2)cc1)C(=O)Nc1ccccc1Br ZINC000539337139 938844410 /nfs/dbraw/zinc/84/44/10/938844410.db2.gz ONDQJTQXAJVIBB-LSDHHAIUSA-N 0 3 413.319 4.313 20 0 HIADHN O=C(Nc1ccc(-n2ncc3ccccc32)cc1)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000539420471 938857888 /nfs/dbraw/zinc/85/78/88/938857888.db2.gz VVXPRAPYEXTLGW-NRFANRHFSA-N 0 3 411.509 4.271 20 0 HIADHN Cc1cc([C@H](N[C@H](C)C(=O)N[C@H](C)c2ccc3c(c2)OCCO3)C2CC2)ccc1F ZINC000539421491 938857955 /nfs/dbraw/zinc/85/79/55/938857955.db2.gz CYAQALMCNBGYMG-CKNGIIGNSA-N 0 3 412.505 4.212 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)CN[C@H](COc2c(C)cccc2C)C(C)(C)C)cc1 ZINC000539422534 938858193 /nfs/dbraw/zinc/85/81/93/938858193.db2.gz RMYKYEVYTPWRPV-OAQYLSRUSA-N 0 3 411.546 4.284 20 0 HIADHN Cc1cc([C@@H](NCC(=O)NCCc2ccc(OC(F)F)cc2)C2CC2)ccc1F ZINC000539423416 938858508 /nfs/dbraw/zinc/85/85/08/938858508.db2.gz MLVPYMXDNKLGKJ-NRFANRHFSA-N 0 3 406.448 4.135 20 0 HIADHN CC(C)n1cnnc1[C@@H]1CCCN(CCc2cc(Cl)c3c(c2)OCCCO3)C1 ZINC000539456901 938863533 /nfs/dbraw/zinc/86/35/33/938863533.db2.gz WMRWGZGZSOZKPZ-QGZVFWFLSA-N 0 3 404.942 4.096 20 0 HIADHN COc1ccc([C@@H](NCC(=O)N[C@@H](c2nccs2)c2ccccc2)C2CC2)cc1 ZINC000539491737 938867871 /nfs/dbraw/zinc/86/78/71/938867871.db2.gz ZBFYPLPYGBQBBC-FCHUYYIVSA-N 0 3 407.539 4.098 20 0 HIADHN C[C@@H](c1cc2ccccc2o1)N(C)C(=O)CN[C@@H](c1ccc2c(c1)OCCO2)C1CC1 ZINC000539493268 938868224 /nfs/dbraw/zinc/86/82/24/938868224.db2.gz QRBCSXRVXICCAF-IVCQMTBJSA-N 0 3 420.509 4.464 20 0 HIADHN CCO[C@@H]1C[C@H](N[C@H](c2ccc(C)cc2)c2cccc(S(C)(=O)=O)c2)C12CCC2 ZINC000539494864 938868546 /nfs/dbraw/zinc/86/85/46/938868546.db2.gz SGLVQCNJTVFBHK-YTFSRNRJSA-N 0 3 413.583 4.425 20 0 HIADHN CC(C)(C)c1nn(Cc2ccccc2)cc1CN[C@H]1CCN(c2ncccc2F)C1 ZINC000539521842 938872956 /nfs/dbraw/zinc/87/29/56/938872956.db2.gz UGYLCXYWTILYQH-FQEVSTJZSA-N 0 3 407.537 4.132 20 0 HIADHN C[C@@H](CC(=O)Nc1ccccc1C(F)(F)F)NC1(c2ccc3c(c2)OCO3)CC1 ZINC000539651839 938894249 /nfs/dbraw/zinc/89/42/49/938894249.db2.gz WIBKJMXTDVGZPW-ZDUSSCGKSA-N 0 3 406.404 4.430 20 0 HIADHN CC[C@@H](C)Oc1cc(C(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)ccn1 ZINC000539665616 938897048 /nfs/dbraw/zinc/89/70/48/938897048.db2.gz DOERZKSSJKDMLM-WIYYLYMNSA-N 0 3 419.529 4.155 20 0 HIADHN CCN(CC)c1ccc(C(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000539688229 938901488 /nfs/dbraw/zinc/90/14/88/938901488.db2.gz JGZCUCTYWKXWLB-QHCPKHFHSA-N 0 3 417.557 4.429 20 0 HIADHN COCCNC(=O)[C@H](CC(C)C)N[C@@H](C)c1sc(-c2ccc(F)cc2)nc1C ZINC000539689752 938901960 /nfs/dbraw/zinc/90/19/60/938901960.db2.gz PQJSVTBHXFPGJL-KSSFIOAISA-N 0 3 407.555 4.086 20 0 HIADHN O=C(Nc1ccc2nc(-c3ccccn3)oc2c1)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000539726041 938914068 /nfs/dbraw/zinc/91/40/68/938914068.db2.gz QHBHMXURTROYNZ-LJQANCHMSA-N 0 3 413.481 4.286 20 0 HIADHN COc1ccc([C@@H](C)Nc2cccc([C@H]3CNC(=O)C3)c2)cc1CN1CCCCC1 ZINC000539736679 938917140 /nfs/dbraw/zinc/91/71/40/938917140.db2.gz AUNXUOLQUPHUFR-WIYYLYMNSA-N 0 3 407.558 4.458 20 0 HIADHN Cc1nc([C@H]2CCCN([C@H](c3nc(-c4ccccc4)no3)c3ccccc3)C2)n[nH]1 ZINC000539762787 938927719 /nfs/dbraw/zinc/92/77/19/938927719.db2.gz ABWDRUNRSYXJGS-PMACEKPBSA-N 0 3 400.486 4.132 20 0 HIADHN Cc1n[nH]c([C@H]2CCCN([C@H](c3nc(-c4ccccc4)no3)c3ccccc3)C2)n1 ZINC000539762787 938927723 /nfs/dbraw/zinc/92/77/23/938927723.db2.gz ABWDRUNRSYXJGS-PMACEKPBSA-N 0 3 400.486 4.132 20 0 HIADHN Cc1nnc([C@H]2CCCN([C@H](c3nc(-c4ccccc4)no3)c3ccccc3)C2)[nH]1 ZINC000539762787 938927726 /nfs/dbraw/zinc/92/77/26/938927726.db2.gz ABWDRUNRSYXJGS-PMACEKPBSA-N 0 3 400.486 4.132 20 0 HIADHN Cc1nc([C@@H]2CCCN([C@H](C)c3nnc(-c4ccc(Cl)cc4Cl)o3)C2)n[nH]1 ZINC000539765338 938928731 /nfs/dbraw/zinc/92/87/31/938928731.db2.gz FNIDZTKAMWCOJL-ZYHUDNBSSA-N 0 3 407.305 4.411 20 0 HIADHN Cc1n[nH]c([C@@H]2CCCN([C@H](C)c3nnc(-c4ccc(Cl)cc4Cl)o3)C2)n1 ZINC000539765338 938928738 /nfs/dbraw/zinc/92/87/38/938928738.db2.gz FNIDZTKAMWCOJL-ZYHUDNBSSA-N 0 3 407.305 4.411 20 0 HIADHN Cc1nnc([C@@H]2CCCN([C@H](C)c3nnc(-c4ccc(Cl)cc4Cl)o3)C2)[nH]1 ZINC000539765338 938928747 /nfs/dbraw/zinc/92/87/47/938928747.db2.gz FNIDZTKAMWCOJL-ZYHUDNBSSA-N 0 3 407.305 4.411 20 0 HIADHN Cn1cc(CN2CCC([C@H]3C(=O)Nc4cc(Cl)ccc43)CC2)c(-c2ccncc2)n1 ZINC000539839403 938953637 /nfs/dbraw/zinc/95/36/37/938953637.db2.gz KPNBCZXHSMHRSF-OAQYLSRUSA-N 0 3 421.932 4.083 20 0 HIADHN O=C(C1CCN(CC2=Cc3ccccc3OC2)CC1)N(Cc1ccccc1)C1CC1 ZINC000539838170 938953837 /nfs/dbraw/zinc/95/38/37/938953837.db2.gz AVOOVOXMUIWOJT-UHFFFAOYSA-N 0 3 402.538 4.366 20 0 HIADHN CC[C@H](C)[C@@H](NCc1cccc2nccn21)C(=O)Nc1cccc(N2CCCC2)c1 ZINC000539853394 938958099 /nfs/dbraw/zinc/95/80/99/938958099.db2.gz BQUBZUAHUJQLQU-FDDCHVKYSA-N 0 3 405.546 4.078 20 0 HIADHN Cn1cc(CN2CC[C@@H](Oc3ccc(Cl)c(Cl)c3)C2)c(-c2ccncc2)n1 ZINC000539861821 938960969 /nfs/dbraw/zinc/96/09/69/938960969.db2.gz DYJJGVJBTXKLKM-QGZVFWFLSA-N 0 3 403.313 4.442 20 0 HIADHN Brc1ccc2c(c1)[C@H](N1CCC[C@@H](c3nnc4n3CCC4)C1)CCC2 ZINC000539882904 938965139 /nfs/dbraw/zinc/96/51/39/938965139.db2.gz YSCVAPXLIKCJOB-CRAIPNDOSA-N 0 3 401.352 4.244 20 0 HIADHN COc1cc(NC(=O)CCN2[C@@H](C)Cc3cc(F)ccc3[C@@H]2C)cc(OC)c1OC ZINC000539887803 938966055 /nfs/dbraw/zinc/96/60/55/938966055.db2.gz YBGPMDPSAVIOLV-GJZGRUSLSA-N 0 3 416.493 4.188 20 0 HIADHN CO[C@H](C)c1noc(CN2CCCN(Cc3cccc(-c4ccc(C)cc4)c3)CC2)n1 ZINC000539893012 938969209 /nfs/dbraw/zinc/96/92/09/938969209.db2.gz LCUYVRFNGMKPMD-HXUWFJFHSA-N 0 3 420.557 4.460 20 0 HIADHN Brc1cc(CN[C@H](c2ccccc2)[C@@H]2CCOC2)cc2c1OCCO2 ZINC000540067489 939057352 /nfs/dbraw/zinc/05/73/52/939057352.db2.gz CDTRDSASFIWPLX-VQIMIIECSA-N 0 3 404.304 4.088 20 0 HIADHN Brc1cc(CN[C@@H](c2ccccc2)[C@H]2CCOC2)cc2c1OCCO2 ZINC000540067487 939057485 /nfs/dbraw/zinc/05/74/85/939057485.db2.gz CDTRDSASFIWPLX-LPHOPBHVSA-N 0 3 404.304 4.088 20 0 HIADHN C[C@H](NCCCNC(=O)c1cccc(Br)c1)c1nc2c(s1)CCCC2 ZINC000540084038 939064046 /nfs/dbraw/zinc/06/40/46/939064046.db2.gz XEDQHJGQMGJVNX-ZDUSSCGKSA-N 0 3 422.392 4.255 20 0 HIADHN CCCN(C(=O)N[C@@H]1CCO[C@@H](C(C)C)C1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000540085313 939064675 /nfs/dbraw/zinc/06/46/75/939064675.db2.gz WKQATSNAHYSMIM-DNVJHFABSA-N 0 3 401.595 4.276 20 0 HIADHN CCN(CC)C(=O)Nc1ccc([C@H](C)N[C@H]2CCN(Cc3ccccc3)C2=O)cc1 ZINC000540145908 939090889 /nfs/dbraw/zinc/09/08/89/939090889.db2.gz ZJBYUHFZMZTRLK-AVRDEDQJSA-N 0 3 408.546 4.012 20 0 HIADHN C[C@H](NCCOc1ncccc1C(F)(F)F)c1ccc(-n2cncn2)cc1Cl ZINC000540150790 939093113 /nfs/dbraw/zinc/09/31/13/939093113.db2.gz KEILALOXFTUPCL-LBPRGKRZSA-N 0 3 411.815 4.064 20 0 HIADHN C[C@H]([NH2+]Cc1nnc(-c2ccc(Br)cc2)[n-]1)c1ccccc1N(C)C ZINC000540155409 939093938 /nfs/dbraw/zinc/09/39/38/939093938.db2.gz MCVULRFIHYHTMK-ZDUSSCGKSA-N 0 3 400.324 4.151 20 0 HIADHN COc1ccc2c(c1)[C@@H](NCc1ccc(Br)cc1N1CCOCC1)CC2 ZINC000540156979 939094611 /nfs/dbraw/zinc/09/46/11/939094611.db2.gz TZPLBCKVHUXHAL-FQEVSTJZSA-N 0 3 417.347 4.071 20 0 HIADHN COc1ccc(C[C@H](N[C@H]2CCN(C(C)=O)C2)c2cc(Cl)ccc2Cl)cc1 ZINC000540161720 939097417 /nfs/dbraw/zinc/09/74/17/939097417.db2.gz VJSFXDSTWGQKMA-UWJYYQICSA-N 0 3 407.341 4.496 20 0 HIADHN C[C@@H](CC(=O)Nc1ccccc1C(F)(F)F)NCc1cccc2c1OCCCO2 ZINC000540163574 939098339 /nfs/dbraw/zinc/09/83/39/939098339.db2.gz GRSOMEISJWSWSR-AWEZNQCLSA-N 0 3 408.420 4.374 20 0 HIADHN Cc1nn(C)cc1[C@H](C)NCCOc1ccc(Br)cc1C(F)(F)F ZINC000540165587 939099022 /nfs/dbraw/zinc/09/90/22/939099022.db2.gz TWOIDCKOLVSLIV-JTQLQIEISA-N 0 3 406.246 4.239 20 0 HIADHN COc1ccc(-c2nc3c(s2)[C@@H](NCc2ccc(OCCO)cc2)CCC3)cc1 ZINC000540175413 939104816 /nfs/dbraw/zinc/10/48/16/939104816.db2.gz HWFLGPDZZKCGTO-FQEVSTJZSA-N 0 3 410.539 4.357 20 0 HIADHN C[C@H](CC(=O)N1CCCCCC1)NCc1cc(Br)ccc1OC(F)F ZINC000540176295 939105623 /nfs/dbraw/zinc/10/56/23/939105623.db2.gz AJZJTBJWIQVJLX-CYBMUJFWSA-N 0 3 419.310 4.321 20 0 HIADHN COc1ccc(CN2CC[C@H](N[C@@H](C)c3ccc4cc(OC)ccc4c3)C2=O)cc1 ZINC000540181163 939108535 /nfs/dbraw/zinc/10/85/35/939108535.db2.gz FGNPHJMYLWSBIR-XDHUDOTRSA-N 0 3 404.510 4.309 20 0 HIADHN Cn1c2cccc(F)c2nc1CCN[C@@H]1CCc2c1c(Br)ccc2F ZINC000540181394 939108621 /nfs/dbraw/zinc/10/86/21/939108621.db2.gz FORMOVYEXSNEOV-OAHLLOKOSA-N 0 3 406.274 4.434 20 0 HIADHN Cc1cc(C)c([C@@H](C)NCc2ccccc2OCC(=O)NC[C@H]2CCCO2)cc1C ZINC000540191631 939116129 /nfs/dbraw/zinc/11/61/29/939116129.db2.gz SRCRPQMFWGIFBF-IFMALSPDSA-N 0 3 410.558 4.137 20 0 HIADHN Fc1ccc(N2CCC(NCc3nn(-c4ccccc4)c4c3CCC4)CC2)c(F)c1 ZINC000540192181 939117481 /nfs/dbraw/zinc/11/74/81/939117481.db2.gz BTPUVRBWAJJISA-UHFFFAOYSA-N 0 3 408.496 4.398 20 0 HIADHN COc1ccc(C(=O)NCCN[C@@H](C)c2sc(-c3ccccc3F)nc2C)cc1 ZINC000540195432 939119472 /nfs/dbraw/zinc/11/94/72/939119472.db2.gz SYVZWHOLRWBMOP-AWEZNQCLSA-N 0 3 413.518 4.347 20 0 HIADHN O=C(CCN1CCCN(CC(F)F)CC1)Nc1ccccc1Oc1ccccc1 ZINC000540198786 939122596 /nfs/dbraw/zinc/12/25/96/939122596.db2.gz YMSBJPLGBHWKTB-UHFFFAOYSA-N 0 3 403.473 4.080 20 0 HIADHN Cc1nc(-c2ccc(Br)cc2)sc1[C@H](C)N[C@H]1CC(=O)N(C2CC2)C1 ZINC000540219650 939135804 /nfs/dbraw/zinc/13/58/04/939135804.db2.gz JOCZEYWYJWDFAZ-NHYWBVRUSA-N 0 3 420.376 4.295 20 0 HIADHN CCN1CCCN(C(=O)Nc2ccc(Oc3ccc(C(F)(F)F)cc3)nc2)CC1 ZINC000540225745 939142893 /nfs/dbraw/zinc/14/28/93/939142893.db2.gz RGDKPLJSSLIPEO-UHFFFAOYSA-N 0 3 408.424 4.452 20 0 HIADHN CCCN1c2ccc(NC(=O)N3CCN(CC4CCCCC4)CC3)cc2CCC1=O ZINC000540232156 939151688 /nfs/dbraw/zinc/15/16/88/939151688.db2.gz NRZLQRRAYZUZBX-UHFFFAOYSA-N 0 3 412.578 4.106 20 0 HIADHN C[C@H]1CCCN(S(=O)(=O)c2ccc(CN[C@@H]3CCCNc4ccccc43)cc2)C1 ZINC000563647905 945232798 /nfs/dbraw/zinc/23/27/98/945232798.db2.gz CBZPJZSYRBTPJB-FDDCHVKYSA-N 0 3 413.587 4.144 20 0 HIADHN CC[C@@H](CS(=O)(=O)c1ccccc1)N[C@@H]1CCc2c1cccc2Br ZINC000540314800 939190965 /nfs/dbraw/zinc/19/09/65/939190965.db2.gz YTLGCTHZDHYULN-IFXJQAMLSA-N 0 3 408.361 4.279 20 0 HIADHN O=C1CCCN1C[C@@H](NCCOc1ccccc1F)c1cccc(C(F)(F)F)c1 ZINC000540322764 939194491 /nfs/dbraw/zinc/19/44/91/939194491.db2.gz PSQBSKNPUCQAQI-GOSISDBHSA-N 0 3 410.411 4.177 20 0 HIADHN Cc1cc(CN2CCC[C@@H](c3nncn3C3CC3)C2)nc(-c2ccc(Cl)cc2)n1 ZINC000540340705 939200399 /nfs/dbraw/zinc/20/03/99/939200399.db2.gz SIGCROGNIBXQGE-QGZVFWFLSA-N 0 3 408.937 4.411 20 0 HIADHN C[C@@H](NCc1ccc(I)cc1)c1ccc(NC(=O)C2CC2)cc1 ZINC000540352031 939203557 /nfs/dbraw/zinc/20/35/57/939203557.db2.gz MHDVAURMNCSYQE-CYBMUJFWSA-N 0 3 420.294 4.491 20 0 HIADHN C[C@H](NCC(=O)N(Cc1ccccc1)CC(F)(F)F)c1ccccc1-n1cccn1 ZINC000540359618 939208688 /nfs/dbraw/zinc/20/86/88/939208688.db2.gz DSKYDVBNJBLZPD-KRWDZBQOSA-N 0 3 416.447 4.114 20 0 HIADHN Cc1ccc(NC(=O)CN[C@@H](C)c2ccccc2-n2cccn2)c(Br)c1 ZINC000540360650 939209115 /nfs/dbraw/zinc/20/91/15/939209115.db2.gz TZJXZEOXLBVBHB-HNNXBMFYSA-N 0 3 413.319 4.233 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(OCC(F)(F)F)cc1)C(=O)N(C)Cc1cccc(F)c1 ZINC000540361529 939210425 /nfs/dbraw/zinc/21/04/25/939210425.db2.gz IBTROCROJDMZRI-GJZGRUSLSA-N 0 3 412.427 4.465 20 0 HIADHN CC[C@H](C)[C@@H](NCC(=O)Nc1ccc(C(=O)N(C)C)cc1)c1ccc(Cl)cc1 ZINC000540387296 939223306 /nfs/dbraw/zinc/22/33/06/939223306.db2.gz VQABBSOWEUVAEC-YCRPNKLZSA-N 0 3 401.938 4.357 20 0 HIADHN Cc1cc(Br)ccc1NC(=O)CN[C@@H](c1ccccc1)[C@@H]1CCOC1 ZINC000540389789 939227665 /nfs/dbraw/zinc/22/76/65/939227665.db2.gz TTWMKIIYDKUTPA-UZLBHIALSA-N 0 3 403.320 4.063 20 0 HIADHN O=C(CN[C@@H](c1ccccc1)[C@H]1CCOC1)N1CC=C(c2c[nH]c3ccccc32)CC1 ZINC000540398454 939234302 /nfs/dbraw/zinc/23/43/02/939234302.db2.gz QKWAWOJGDWFYHP-LVXARBLLSA-N 0 3 415.537 4.151 20 0 HIADHN COCc1ccc(CNC(=O)CN[C@H](c2ccc(C(F)(F)F)cc2)C(C)C)cc1 ZINC000540424386 939243526 /nfs/dbraw/zinc/24/35/26/939243526.db2.gz AAHZDIITCOLAHD-NRFANRHFSA-N 0 3 408.464 4.455 20 0 HIADHN O=C(CN[C@H](CC1CCCC1)c1ccccc1)Nc1cccc(C(=O)NC2CC2)c1 ZINC000540432337 939246675 /nfs/dbraw/zinc/24/66/75/939246675.db2.gz FUGHPYSIAOZCTF-HSZRJFAPSA-N 0 3 405.542 4.429 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(-n2cccn2)cc1)C(=O)Nc1cccc(Br)c1 ZINC000540433325 939246822 /nfs/dbraw/zinc/24/68/22/939246822.db2.gz CJSPKYGKLCPKPU-HUUCEWRRSA-N 0 3 413.319 4.313 20 0 HIADHN O=C(CN[C@H](C[C@H]1CCOC1)c1ccccc1)NCCc1cccc(Cl)c1Cl ZINC000540433900 939247527 /nfs/dbraw/zinc/24/75/27/939247527.db2.gz AXNSHOABSHEKJR-OXQOHEQNSA-N 0 3 421.368 4.410 20 0 HIADHN Cc1cccc([C@H](NCC(=O)Nc2ccc(CN3CCOCC3)cc2)C(C)(C)C)c1 ZINC000540435967 939248221 /nfs/dbraw/zinc/24/82/21/939248221.db2.gz YJRYGBSNVORETD-DEOSSOPVSA-N 0 3 409.574 4.143 20 0 HIADHN Cc1cc(N2CCCC2)ccc1NC(=O)CN[C@@H](C)c1ccc(-n2cccn2)cc1 ZINC000540440163 939250384 /nfs/dbraw/zinc/25/03/84/939250384.db2.gz QFMXVEGTONKICK-IBGZPJMESA-N 0 3 403.530 4.070 20 0 HIADHN COc1ccc(NC(=O)[C@H](C)N[C@@H](C)c2ccc(-c3ccncc3)cc2)cc1OC ZINC000540440241 939251393 /nfs/dbraw/zinc/25/13/93/939251393.db2.gz RSESNVDPCYQIRY-IRXDYDNUSA-N 0 3 405.498 4.444 20 0 HIADHN CC(C)[C@H](NC(=O)CN[C@@H](c1cccs1)C1CC1)c1ccc2c(c1)OCCCO2 ZINC000540466556 939263753 /nfs/dbraw/zinc/26/37/53/939263753.db2.gz KIPNHRHCELFMLF-XZOQPEGZSA-N 0 3 414.571 4.464 20 0 HIADHN CN(C)CCN(Cc1cccc(O)c1)C(=O)c1ccc(C(F)(F)F)cc1Cl ZINC000540473246 939266318 /nfs/dbraw/zinc/26/63/18/939266318.db2.gz XLKVQRMQDJZELD-UHFFFAOYSA-N 0 3 400.828 4.268 20 0 HIADHN Cc1ccc([C@H](NCc2ccc(CS(=O)(=O)NC(C)C)cc2)C2CCCC2)o1 ZINC000540474657 939266429 /nfs/dbraw/zinc/26/64/29/939266429.db2.gz GEUNITYVHXWCDB-JOCHJYFZSA-N 0 3 404.576 4.437 20 0 HIADHN CC(C)OCc1ccccc1CNC(=O)CN[C@H](C)c1cccc(N2CCCC2)c1 ZINC000540476893 939268414 /nfs/dbraw/zinc/26/84/14/939268414.db2.gz LFKDUYKYINSLAD-HXUWFJFHSA-N 0 3 409.574 4.179 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)c1cc(OC(F)F)cc(OC(F)F)c1 ZINC000540488993 939272381 /nfs/dbraw/zinc/27/23/81/939272381.db2.gz CITLIZTYRRNCAM-UHFFFAOYSA-N 0 3 420.428 4.155 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@H]1CCO[C@@H]1c1ccc(F)c(F)c1)c1ccsc1 ZINC000540494029 939275053 /nfs/dbraw/zinc/27/50/53/939275053.db2.gz RIQXVGJGZUPCET-XUVXKRRUSA-N 0 3 423.529 4.239 20 0 HIADHN COc1cc(N[C@@H]2CCCN(Cc3cn(C)nc3-c3cccs3)C2)cc(OC)c1 ZINC000540503844 939280073 /nfs/dbraw/zinc/28/00/73/939280073.db2.gz QAWYEFIJVQTAJE-QGZVFWFLSA-N 0 3 412.559 4.242 20 0 HIADHN CC[C@H](NCc1ccc(NS(C)(=O)=O)cc1)c1cc(F)cc(Br)c1 ZINC000540595085 939314111 /nfs/dbraw/zinc/31/41/11/939314111.db2.gz ULEZVZCVYXRYHK-KRWDZBQOSA-N 0 3 415.328 4.201 20 0 HIADHN CC(C)(C)C[C@H](NCc1cccnc1N1CCC(C(N)=O)CC1)c1ccc(F)cc1 ZINC000540594566 939314524 /nfs/dbraw/zinc/31/45/24/939314524.db2.gz MWEDLIBPCACHTP-NRFANRHFSA-N 0 3 412.553 4.190 20 0 HIADHN CC[C@@H](NCc1ccc(NS(C)(=O)=O)cc1)c1cc(F)cc(Br)c1 ZINC000540595087 939314563 /nfs/dbraw/zinc/31/45/63/939314563.db2.gz ULEZVZCVYXRYHK-QGZVFWFLSA-N 0 3 415.328 4.201 20 0 HIADHN CC(C)(C)c1nn(-c2ccccc2)cc1CNCCNC(=O)c1ccccc1Cl ZINC000540598636 939316143 /nfs/dbraw/zinc/31/61/43/939316143.db2.gz GNFHMXGIFBJNOH-UHFFFAOYSA-N 0 3 410.949 4.343 20 0 HIADHN CC[C@H](N[C@@H]1CCCN(CC(F)(F)F)C1=O)c1cc(F)cc(Br)c1 ZINC000540605990 939317423 /nfs/dbraw/zinc/31/74/23/939317423.db2.gz JGZRCNWFOVPPSN-UONOGXRCSA-N 0 3 411.237 4.182 20 0 HIADHN CCN(CC)c1ncc(CN[C@H](C)[C@@H](OC2CCOCC2)c2ccccc2)s1 ZINC000540622003 939322167 /nfs/dbraw/zinc/32/21/67/939322167.db2.gz NERMMSSVPXTJCF-DYESRHJHSA-N 0 3 403.592 4.404 20 0 HIADHN C[C@H](Nc1cccc(CN2CCSCC2)c1)[C@H](c1ccccc1)N1CCOCC1 ZINC000540787121 939372173 /nfs/dbraw/zinc/37/21/73/939372173.db2.gz CCZIQYUOYYDSPI-GBXCKJPGSA-N 0 3 411.615 4.109 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)N[C@H]1CCCOc2cc(F)ccc21 ZINC000540861630 939399377 /nfs/dbraw/zinc/39/93/77/939399377.db2.gz LJGIBDULBBWZRK-FQEVSTJZSA-N 0 3 421.463 4.091 20 0 HIADHN C[C@@H](C(=O)N(C)Cc1ccccc1)N1CCC[C@H](c2nc(C3CCCCC3)n[nH]2)C1 ZINC000540865811 939402963 /nfs/dbraw/zinc/40/29/63/939402963.db2.gz NYAKLKYCVXXDOS-RXVVDRJESA-N 0 3 409.578 4.079 20 0 HIADHN Cn1c(CN2CCC[C@@H](c3n[nH]c(C4CCCCC4)n3)C2)nnc1-c1ccccc1 ZINC000540866155 939403528 /nfs/dbraw/zinc/40/35/28/939403528.db2.gz ZODAESXBDRSNDY-LJQANCHMSA-N 0 3 405.550 4.028 20 0 HIADHN CC(C)[C@@H](NCc1ccc(S(=O)(=O)N2CCCC2)cc1)c1ccc(F)c(F)c1 ZINC000540987076 939425160 /nfs/dbraw/zinc/42/51/60/939425160.db2.gz ISZRDBPOUQETTJ-OAQYLSRUSA-N 0 3 408.514 4.236 20 0 HIADHN CC(=O)Nc1ccc([C@H](C)N[C@@H]2CC(=O)N(C)[C@H]2c2ccc(Cl)c(F)c2)cc1 ZINC000540987094 939425270 /nfs/dbraw/zinc/42/52/70/939425270.db2.gz SFZLWIBVZNYZQQ-DKIOLRDMSA-N 0 3 403.885 4.060 20 0 HIADHN COc1ccc(CN(C(=O)CN[C@H](C)c2ccc(-n3ccnc3C)cc2)C2CC2)cc1 ZINC000541027038 939434115 /nfs/dbraw/zinc/43/41/15/939434115.db2.gz NKJTWZKUDWIXIO-GOSISDBHSA-N 0 3 418.541 4.031 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)NCC(=O)N[C@H](c2ccc(C)cc2)C2CC2)cc1 ZINC000541026123 939434536 /nfs/dbraw/zinc/43/45/36/939434536.db2.gz SGFUMQGRDISFGH-AVRWGWEMSA-N 0 3 402.542 4.407 20 0 HIADHN Cc1ccnc(OC2CCN(C[C@@H](O)CO[C@H](C)c3ccc(Cl)cc3)CC2)c1 ZINC000541117524 939465573 /nfs/dbraw/zinc/46/55/73/939465573.db2.gz DGQIOVLFCIWUJJ-YLJYHZDGSA-N 0 3 404.938 4.025 20 0 HIADHN CC(C)[C@@H](CNC(=O)c1cc(-c2cnn(C)c2)ccc1F)N1CCc2ccccc2C1 ZINC000541151443 939476997 /nfs/dbraw/zinc/47/69/97/939476997.db2.gz WTZUVEDCFIVLQE-XMMPIXPASA-N 0 3 420.532 4.039 20 0 HIADHN CCN1CC[C@H](N[C@@H](C)c2nc3ccccc3n2C)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000541175803 939484392 /nfs/dbraw/zinc/48/43/92/939484392.db2.gz FHTCEYOJCJOESN-FPSMJMQUSA-N 0 3 402.464 4.477 20 0 HIADHN CC(C)OC(=O)C1(C(=O)OC(C)C)CC(N[C@H](c2ccc(F)cc2)C2CCC2)C1 ZINC000541216880 939486113 /nfs/dbraw/zinc/48/61/13/939486113.db2.gz YFEYCRRMIVBKLK-FQEVSTJZSA-N 0 3 405.510 4.309 20 0 HIADHN CC(C)(C)[C@@H](CN1CCc2ccccc2C1)NC(=O)c1cnn(CCC(F)(F)F)c1 ZINC000541297157 939489953 /nfs/dbraw/zinc/48/99/53/939489953.db2.gz ZBRUVWMUPWVRHN-LJQANCHMSA-N 0 3 422.495 4.038 20 0 HIADHN CCc1cnc(CNCCc2ccc(OCC(=O)Nc3ccc(C)cc3)cc2)s1 ZINC000541318783 939490705 /nfs/dbraw/zinc/49/07/05/939490705.db2.gz QKCZAWDHDKMKHQ-UHFFFAOYSA-N 0 3 409.555 4.364 20 0 HIADHN COCCOc1ccc(C(F)(F)F)cc1NC(=O)[C@@H](C)N(C)C[C@@H]1CC=CCC1 ZINC000541320357 939490761 /nfs/dbraw/zinc/49/07/61/939490761.db2.gz VFUAGOHLPKULQJ-HZPDHXFCSA-N 0 3 414.468 4.346 20 0 HIADHN C[C@H](NC[C@@H](O)COc1ccccc1C(F)(F)F)c1ccccc1OC(F)F ZINC000541325318 939490944 /nfs/dbraw/zinc/49/09/44/939490944.db2.gz KIIDWRSKXJILGT-QWHCGFSZSA-N 0 3 405.363 4.397 20 0 HIADHN CCN(C(=O)c1cnn(CCC(F)(F)F)c1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000541393708 939504387 /nfs/dbraw/zinc/50/43/87/939504387.db2.gz MCIPXIHWJWOFQT-QFBILLFUSA-N 0 3 408.468 4.133 20 0 HIADHN COC(=O)COc1ccccc1[C@@H](C)NCc1ccc(-n2cnc3ccccc32)cc1 ZINC000541545005 939549280 /nfs/dbraw/zinc/54/92/80/939549280.db2.gz CMGQVALZTHPROE-GOSISDBHSA-N 0 3 415.493 4.428 20 0 HIADHN O=C1CC[C@H](NCc2cn(-c3ccccc3)nc2-c2ccncc2)c2ccccc2N1 ZINC000541544376 939549287 /nfs/dbraw/zinc/54/92/87/939549287.db2.gz SFZYEAJTZRNSCL-QFIPXVFZSA-N 0 3 409.493 4.498 20 0 HIADHN Cc1ccccc1[C@@H](CN1CCOCC1)NCc1ccc(OCC(F)(F)F)cc1 ZINC000541549968 939552545 /nfs/dbraw/zinc/55/25/45/939552545.db2.gz MSGHSGDRUUGBAM-OAQYLSRUSA-N 0 3 408.464 4.099 20 0 HIADHN O=C1[C@H](NCc2cc(-n3ccnc3)cs2)CCN1c1ccc(Cl)c(Cl)c1 ZINC000541555066 939554476 /nfs/dbraw/zinc/55/44/76/939554476.db2.gz JYTNCCYZAFKDCP-QGZVFWFLSA-N 0 3 407.326 4.136 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)Cc1nc(-c2ccc(F)cc2)cs1 ZINC000541575578 939558647 /nfs/dbraw/zinc/55/86/47/939558647.db2.gz SLYGEHPLMZJXSZ-UHFFFAOYSA-N 0 3 415.509 4.221 20 0 HIADHN O=C(CN[C@H](c1cccs1)C1CC1)NC1(c2ccc3c(c2)OCCO3)CCCC1 ZINC000541580011 939559402 /nfs/dbraw/zinc/55/94/02/939559402.db2.gz NGWJJRQJKRDLDF-QFIPXVFZSA-N 0 3 412.555 4.146 20 0 HIADHN O=C(CNC1(C2CC2)CC1)Nc1cccc(C(=O)Nc2cccc(C(F)(F)F)c2)c1 ZINC000541594810 939562646 /nfs/dbraw/zinc/56/26/46/939562646.db2.gz LAIMPWLDEKRUEF-UHFFFAOYSA-N 0 3 417.431 4.428 20 0 HIADHN CC[C@@H](NCCCOc1cccc(I)c1)c1nccs1 ZINC000541596985 939563042 /nfs/dbraw/zinc/56/30/42/939563042.db2.gz QJGGMTYOUTZGGJ-CQSZACIVSA-N 0 3 402.301 4.258 20 0 HIADHN COC(=O)c1cc2cc(CN[C@@H](C)c3c(C)nn(CC(F)(F)F)c3C)ccc2o1 ZINC000541600541 939564678 /nfs/dbraw/zinc/56/46/78/939564678.db2.gz KYHVLIMEVWBQNJ-NSHDSACASA-N 0 3 409.408 4.446 20 0 HIADHN C[C@@H](N[C@H](CC(N)=O)C1CCCCC1)C(=O)Nc1ccc(Cl)cc1C(F)(F)F ZINC000541637369 939579558 /nfs/dbraw/zinc/57/95/58/939579558.db2.gz WULAIIICUOXERM-BDJLRTHQSA-N 0 3 419.875 4.100 20 0 HIADHN CC(C)(NCC(=O)N1CCC[C@@H]1c1ccc2c(c1)OCCCO2)c1cccs1 ZINC000541643349 939583474 /nfs/dbraw/zinc/58/34/74/939583474.db2.gz UNGWSXBSRQFOKG-QGZVFWFLSA-N 0 3 400.544 4.098 20 0 HIADHN C[C@H](NCC(=O)NCCC(c1ccccc1)c1ccccc1)[C@H]1COc2ccccc21 ZINC000541700549 939608544 /nfs/dbraw/zinc/60/85/44/939608544.db2.gz RJXZMCBNVCADDQ-NBGIEHNGSA-N 0 3 414.549 4.479 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@H]2NCc2ccccc2-c2cnn(C)c2)cc1 ZINC000541767150 939625540 /nfs/dbraw/zinc/62/55/40/939625540.db2.gz SIDLCBRIBUITLH-DNQXCXABSA-N 0 3 423.582 4.270 20 0 HIADHN C[C@H](CC(=O)Nc1cccc(N2CCCC2)c1)NCc1cnc2ccc(Cl)cn12 ZINC000541772730 939626891 /nfs/dbraw/zinc/62/68/91/939626891.db2.gz KBQGKTONFYFYME-MRXNPFEDSA-N 0 3 411.937 4.095 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(N[C@H](c2ccn(C)n2)c2ccc(Cl)cc2)CC1 ZINC000541779544 939628244 /nfs/dbraw/zinc/62/82/44/939628244.db2.gz WOQRQGYYJNCEHC-SBUREZEXSA-N 0 3 409.965 4.373 20 0 HIADHN COc1cc(-c2ccccc2)sc1C(=O)N1C[C@H](SC)[C@@H](N2CCCC2)C1 ZINC000541842761 939645970 /nfs/dbraw/zinc/64/59/70/939645970.db2.gz LCKODKVTPWCITD-LPHOPBHVSA-N 0 3 402.585 4.076 20 0 HIADHN COc1ccccc1COC1CCN(Cc2ccc(OC[C@@H]3CCCO3)cc2)CC1 ZINC000541853476 939647185 /nfs/dbraw/zinc/64/71/85/939647185.db2.gz NBANKAZTKDIJHW-DEOSSOPVSA-N 0 3 411.542 4.434 20 0 HIADHN Clc1ccc(-c2cnc(CN3CCC(CCCN4CCOCC4)CC3)o2)cc1 ZINC000541880870 939649012 /nfs/dbraw/zinc/64/90/12/939649012.db2.gz PQZNPUPYYJIVCX-UHFFFAOYSA-N 0 3 403.954 4.319 20 0 HIADHN COc1ccccc1[C@H](C)NC(=O)[C@H](C)N[C@@H](C)c1ccc(-n2ccnc2C)cc1 ZINC000541955959 939661730 /nfs/dbraw/zinc/66/17/30/939661730.db2.gz YYMIDHOUOAWRJP-BZSNNMDCSA-N 0 3 406.530 4.106 20 0 HIADHN CCOc1ccccc1[C@@H](CC)NC(=O)CN[C@H](C)c1ccc(-n2ccnc2C)cc1 ZINC000541958859 939662768 /nfs/dbraw/zinc/66/27/68/939662768.db2.gz SWGCBWVCUIEGER-WZONZLPQSA-N 0 3 420.557 4.498 20 0 HIADHN CC[C@@H]1C[C@@H](CC(=O)Nc2c(C)cnn2[C@H]2CCN(Cc3ccccc3)C2)CCO1 ZINC000541964664 939664481 /nfs/dbraw/zinc/66/44/81/939664481.db2.gz OGWPMDQQVITAIK-FDFHNCONSA-N 0 3 410.562 4.172 20 0 HIADHN OC[C@@H]1CN(Cc2ccccc2)CC[C@@H]1Nc1cnc2cc(Cl)c(Cl)cc2n1 ZINC000542042888 939697468 /nfs/dbraw/zinc/69/74/68/939697468.db2.gz PVBOUJRSUXWRLW-YJBOKZPZSA-N 0 3 417.340 4.232 20 0 HIADHN C[C@H](NCC[S@@](=O)c1cc(Cl)ccc1Cl)c1ccc([S@@](C)=O)cc1 ZINC000542048440 939699231 /nfs/dbraw/zinc/69/92/31/939699231.db2.gz WZCKACIKAHXTMQ-GCRCYNSTSA-N 0 3 404.384 4.189 20 0 HIADHN O[C@@H](COc1ccc2ccccc2c1)CN1CCC[C@H](n2ccc(C(F)(F)F)n2)C1 ZINC000542055072 939700481 /nfs/dbraw/zinc/70/04/81/939700481.db2.gz LTJZQRBERZJRBU-RBUKOAKNSA-N 0 3 419.447 4.132 20 0 HIADHN COC(=O)[C@@H](N[C@H](CN1CCCC1)c1ccccc1)c1ccccc1C(F)(F)F ZINC000542100942 939713069 /nfs/dbraw/zinc/71/30/69/939713069.db2.gz YQTFHWOVEINXII-UXHICEINSA-N 0 3 406.448 4.346 20 0 HIADHN Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)N[C@@H]1CCCN(Cc2nccn2C)C1=O ZINC000542158310 939736145 /nfs/dbraw/zinc/73/61/45/939736145.db2.gz VSKYEMXZPRZLJH-VQIMIIECSA-N 0 3 423.586 4.002 20 0 HIADHN C[C@@H](N[C@@H]1CCCN(Cc2nccn2C)C1=O)c1ccc(-c2ccccc2F)s1 ZINC000542159658 939736869 /nfs/dbraw/zinc/73/68/69/939736869.db2.gz BTXALVAWXAHUBC-CRAIPNDOSA-N 0 3 412.534 4.130 20 0 HIADHN CC(C)OC(=O)C1(C(=O)OC(C)C)CC(N[C@@H]2c3cccc(F)c3CC[C@@H]2C)C1 ZINC000542165102 939740093 /nfs/dbraw/zinc/74/00/93/939740093.db2.gz VKSIGFPVUBALKN-YWZLYKJASA-N 0 3 405.510 4.091 20 0 HIADHN Cc1nc2c(s1)[C@H](N(C)C[C@H](O)COc1ccccc1C(F)(F)F)CCC2 ZINC000542212006 939758800 /nfs/dbraw/zinc/75/88/00/939758800.db2.gz BDHQAUAQTIAWOG-XJKSGUPXSA-N 0 3 400.466 4.219 20 0 HIADHN C[C@@H](N[C@H](Cc1ccc(C(F)(F)F)cc1)C(N)=O)c1ccc(Br)cc1 ZINC000542256501 939774172 /nfs/dbraw/zinc/77/41/72/939774172.db2.gz PGEDNWNBFRBHRY-BDJLRTHQSA-N 0 3 415.253 4.215 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)CN2CC[C@@H](c3cccc(C)c3)C2)cc1OC ZINC000542318941 939799053 /nfs/dbraw/zinc/79/90/53/939799053.db2.gz BRAJJHDWFNAWPZ-YADHBBJMSA-N 0 3 408.542 4.165 20 0 HIADHN Cc1ccc([C@@H]2CCN(CC(=O)N3CCC[C@H]3c3ccc4c(c3)OCCCO4)C2)cc1 ZINC000542323109 939800368 /nfs/dbraw/zinc/80/03/68/939800368.db2.gz PINQMURUDZSCMU-PKTZIBPZSA-N 0 3 420.553 4.309 20 0 HIADHN CN(C)[C@H](CNC(=O)N1CCC[C@@H](c2nnc(C3CCCCC3)[nH]2)C1)c1ccccc1 ZINC000542376528 939810384 /nfs/dbraw/zinc/81/03/84/939810384.db2.gz NTVUSGVQOYCYBS-NHCUHLMSSA-N 0 3 424.593 4.044 20 0 HIADHN Cc1ccnn1-c1ccccc1NC(=O)N(CCN(C)C)Cc1cccc(Cl)c1 ZINC000542428119 939820905 /nfs/dbraw/zinc/82/09/05/939820905.db2.gz WRUBUGLQWJJHCO-UHFFFAOYSA-N 0 3 411.937 4.430 20 0 HIADHN Cc1ccnn1-c1ccccc1NC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C ZINC000542429398 939821320 /nfs/dbraw/zinc/82/13/20/939821320.db2.gz XSUMLMCUQYTIQO-HXUWFJFHSA-N 0 3 403.530 4.309 20 0 HIADHN COc1cc(OC)cc(N2CC[C@@H](CN[C@@H](c3ccc(F)cc3)c3ccccn3)C2)c1 ZINC000542475079 939829455 /nfs/dbraw/zinc/82/94/55/939829455.db2.gz PGKGMEOHDGIAFQ-BVZFJXPGSA-N 0 3 421.516 4.443 20 0 HIADHN COC(=O)COc1ccccc1[C@H](C)N[C@@H]1CCO[C@H]1c1ccc(Cl)c(F)c1 ZINC000542493474 939832592 /nfs/dbraw/zinc/83/25/92/939832592.db2.gz CVOBRCXBQBLFOY-NVMYHKGLSA-N 0 3 407.869 4.212 20 0 HIADHN COC(=O)COc1ccccc1[C@H](C)N[C@H]1CCO[C@H]1c1ccc(Cl)c(F)c1 ZINC000542493472 939832668 /nfs/dbraw/zinc/83/26/68/939832668.db2.gz CVOBRCXBQBLFOY-FPSMJMQUSA-N 0 3 407.869 4.212 20 0 HIADHN c1ccc(C(OCCN2CCN(CC[C@@H]3CCCCO3)CC2)c2ccccc2)cc1 ZINC000542506219 939834332 /nfs/dbraw/zinc/83/43/32/939834332.db2.gz IIFXVDRBXHVZBH-VWLOTQADSA-N 0 3 408.586 4.369 20 0 HIADHN O=C(CN[C@@H](c1cccs1)C1CC1)Nc1c(F)cc(F)cc1Br ZINC000542509028 939834564 /nfs/dbraw/zinc/83/45/64/939834564.db2.gz GNSFUXHZFUANLT-OAHLLOKOSA-N 0 3 401.276 4.468 20 0 HIADHN C[C@@H](NCc1csc(-c2ccc(S(C)(=O)=O)cc2)n1)[C@H](C)c1ccccc1 ZINC000542542585 939841238 /nfs/dbraw/zinc/84/12/38/939841238.db2.gz AECIMHURBZVYHN-JKSUJKDBSA-N 0 3 400.569 4.495 20 0 HIADHN CS(=O)(=O)c1ccc(-c2nc(CN[C@H](Cc3ccccc3)C3CC3)cs2)cc1 ZINC000542548479 939842101 /nfs/dbraw/zinc/84/21/01/939842101.db2.gz KAPLVJHMTPNKBA-OAQYLSRUSA-N 0 3 412.580 4.325 20 0 HIADHN CSc1ccc(CN(C)C(=O)CN(C)[C@H]2CCO[C@@H](c3ccc(F)cc3)C2)cc1 ZINC000542626563 939850114 /nfs/dbraw/zinc/85/01/14/939850114.db2.gz IVXJXUAQJNEIQN-RBBKRZOGSA-N 0 3 416.562 4.358 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)c2cc(Cl)ccc2SC2CCCC2)CC1 ZINC000542761443 939859532 /nfs/dbraw/zinc/85/95/32/939859532.db2.gz WYJMINSFWWZLNB-QGZVFWFLSA-N 0 3 424.054 4.378 20 0 HIADHN CS[C@H]1CN(C(=O)c2csc(-c3ccc(Cl)s3)n2)C[C@@H]1N1CCCC1 ZINC000542772626 939860126 /nfs/dbraw/zinc/86/01/26/939860126.db2.gz YCEASFWHYGHFDJ-JSGCOSHPSA-N 0 3 414.021 4.177 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)CC3CCC(C(F)(F)F)CC3)CC2)C[C@H](C)O1 ZINC000543073438 939924252 /nfs/dbraw/zinc/92/42/52/939924252.db2.gz WRBUSCCCATZQEE-XNYRCJLNSA-N 0 3 404.517 4.093 20 0 HIADHN Cc1cc(NC(=O)c2ccnc(C3CC3)c2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000543077891 939928913 /nfs/dbraw/zinc/92/89/13/939928913.db2.gz UQRMBSYWQQRYCB-NRFANRHFSA-N 0 3 401.514 4.163 20 0 HIADHN Cc1cc(F)ccc1-n1ccc(C(=O)N(Cc2ccccc2)C2CCN(C)CC2)n1 ZINC000543101072 939944227 /nfs/dbraw/zinc/94/42/27/939944227.db2.gz GTFNKCNEXGOKTA-UHFFFAOYSA-N 0 3 406.505 4.056 20 0 HIADHN COC(=O)COc1cccc(CN[C@H]2CCCc3c(Br)cccc32)c1 ZINC000543103630 939946556 /nfs/dbraw/zinc/94/65/56/939946556.db2.gz SINGAUHMINMGCJ-IBGZPJMESA-N 0 3 404.304 4.168 20 0 HIADHN Cc1cn(C2CCCCC2)nc1NC(=O)c1ccc(N2CCN(C(C)C)CC2)cc1 ZINC000543134646 939963912 /nfs/dbraw/zinc/96/39/12/939963912.db2.gz PIIXFJZWIPJJMC-UHFFFAOYSA-N 0 3 409.578 4.479 20 0 HIADHN CC(C)(C)OC(=O)CCCC[NH+]1CCC(C(=O)Nc2cc(Cl)ccc2[O-])CC1 ZINC000543139103 939966296 /nfs/dbraw/zinc/96/62/96/939966296.db2.gz KWRZPWROSHLEMN-UHFFFAOYSA-N 0 3 410.942 4.208 20 0 HIADHN COc1ccc(Oc2ccc(CNc3cc(C(N)=O)ccc3CN(C)C)cc2)cc1 ZINC000543238648 940004529 /nfs/dbraw/zinc/00/45/29/940004529.db2.gz JQDVEQVUZYFYCL-UHFFFAOYSA-N 0 3 405.498 4.260 20 0 HIADHN Cc1cc(C[NH2+]Cc2nnc(-c3ccc(Br)cc3)[n-]2)cc2cccnc12 ZINC000543239087 940004791 /nfs/dbraw/zinc/00/47/91/940004791.db2.gz HUQZRDUSCCJWBC-UHFFFAOYSA-N 0 3 408.303 4.381 20 0 HIADHN c1c(CNC[C@@H]2CC3c4ccccc4C2c2ccccc23)nnn1Cc1cccnc1 ZINC000543246592 940007400 /nfs/dbraw/zinc/00/74/00/940007400.db2.gz VKZNGLLPOLWBPI-RAYWSRASSA-N 0 3 407.521 4.108 20 0 HIADHN Cc1n[nH]c(C)c1[C@@H](C)C(=O)N(CCN(C)Cc1ccccc1)Cc1ccccc1 ZINC000543279769 940016405 /nfs/dbraw/zinc/01/64/05/940016405.db2.gz AKAWJOQEPQONQD-LJQANCHMSA-N 0 3 404.558 4.291 20 0 HIADHN Cc1cc(NC(=O)N(C)C[C@H]2CC=CCC2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000543314601 940026659 /nfs/dbraw/zinc/02/66/59/940026659.db2.gz BQFCIERBTZCCFZ-RBBKRZOGSA-N 0 3 407.562 4.459 20 0 HIADHN Cc1cc(NC(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)nn1[C@@H](C)C1CC1 ZINC000543319179 940028058 /nfs/dbraw/zinc/02/80/58/940028058.db2.gz YWOPUMXEWCVQBV-HNNXBMFYSA-N 0 3 405.493 4.036 20 0 HIADHN CN(C)Cc1ccc(CNC(=O)c2cccc(CN(C)Cc3ccccc3)c2)cc1F ZINC000543373844 940045426 /nfs/dbraw/zinc/04/54/26/940045426.db2.gz FZLKDYIAYQKCQD-UHFFFAOYSA-N 0 3 419.544 4.449 20 0 HIADHN CC[C@@H](N[C@H]1CCCN(Cc2ccccn2)C1=O)c1ccc2cc(OC)ccc2c1 ZINC000543426999 940061428 /nfs/dbraw/zinc/06/14/28/940061428.db2.gz PTQOAYWEZXAODF-RPWUZVMVSA-N 0 3 403.526 4.475 20 0 HIADHN C[C@H](c1ccc(Cl)cc1)N1CCN(CC2CCN(C(=O)C(C)(C)C)CC2)CC1 ZINC000543444860 940065645 /nfs/dbraw/zinc/06/56/45/940065645.db2.gz AVHYNONBTUJQQQ-GOSISDBHSA-N 0 3 406.014 4.303 20 0 HIADHN Cc1cc(C(=O)N(CCN2CCCC2)Cc2ccc(Cl)c(Cl)c2)nc(C)n1 ZINC000543482913 940079093 /nfs/dbraw/zinc/07/90/93/940079093.db2.gz ABTPVPISOJZDKJ-UHFFFAOYSA-N 0 3 407.345 4.138 20 0 HIADHN CC(=O)c1cccc(OC[C@H](O)CN[C@H](C)c2sc(-c3ccccc3)nc2C)c1 ZINC000543520168 940094741 /nfs/dbraw/zinc/09/47/41/940094741.db2.gz UFSIGJJSLPQNLO-FOIQADDNSA-N 0 3 410.539 4.412 20 0 HIADHN C[C@@H](NCC(=O)Nc1nc(-c2ccc(F)c(F)c2)cs1)[C@H]1COc2ccccc21 ZINC000543550517 940105610 /nfs/dbraw/zinc/10/56/10/940105610.db2.gz AFHSCOQQRZSYIL-IUODEOHRSA-N 0 3 415.465 4.181 20 0 HIADHN C[C@H](NCC(=O)Nc1nc(-c2ccc(F)c(F)c2)cs1)[C@@H]1COc2ccccc21 ZINC000543550521 940105695 /nfs/dbraw/zinc/10/56/95/940105695.db2.gz AFHSCOQQRZSYIL-WFASDCNBSA-N 0 3 415.465 4.181 20 0 HIADHN CCCOc1ccc(CNC(=O)CN(C)[C@H]2CCO[C@@H](c3ccc(F)cc3)C2)cc1 ZINC000543555806 940106833 /nfs/dbraw/zinc/10/68/33/940106833.db2.gz XIHHBYPHMDZYDR-JTHBVZDNSA-N 0 3 414.521 4.083 20 0 HIADHN C[C@H]1N(CC(=O)N[C@@H](c2ccccc2)c2ccc(Cl)cc2)CCC12CCOCC2 ZINC000543574859 940115888 /nfs/dbraw/zinc/11/58/88/940115888.db2.gz RMOYEBJXHPDZEG-JPYJTQIMSA-N 0 3 412.961 4.437 20 0 HIADHN O=S(=O)(c1ccc(CN[C@H]2CCCc3c(Cl)cccc32)cc1)N1CCCC1 ZINC000543591706 940123387 /nfs/dbraw/zinc/12/33/87/940123387.db2.gz LHULEXYPQBYANW-NRFANRHFSA-N 0 3 404.963 4.292 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@H]2CCCC[C@H]2NCc2cn(C)nc2-c2ccccc2)cc1 ZINC000543598245 940125424 /nfs/dbraw/zinc/12/54/24/940125424.db2.gz UZEAFZWUBCRKQT-PKTZIBPZSA-N 0 3 423.582 4.270 20 0 HIADHN COc1cc(Br)c(CN[C@@H]2CCO[C@H](c3ccc(F)cc3)C2)cc1O ZINC000543617678 940133663 /nfs/dbraw/zinc/13/36/63/940133663.db2.gz DJFNPWOYDBGBBB-QAPCUYQASA-N 0 3 410.283 4.312 20 0 HIADHN Cc1cc(NC(=O)NC[C@H](C)c2nccs2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000543631902 940143517 /nfs/dbraw/zinc/14/35/17/940143517.db2.gz UEBXMGICOQHXBT-QFBILLFUSA-N 0 3 424.574 4.020 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N[C@H]2CCO[C@H](c3ccc(F)cc3)C2)N(C)C)cc1 ZINC000543654657 940151204 /nfs/dbraw/zinc/15/12/04/940151204.db2.gz YAQWPBOQMUEOSW-VABKMULXSA-N 0 3 413.537 4.210 20 0 HIADHN C[C@@H](CNC(=O)N[C@H](CN1CCc2ccccc2C1)C(C)(C)C)c1nccs1 ZINC000543673568 940157474 /nfs/dbraw/zinc/15/74/74/940157474.db2.gz CZHCGTRZLXBWRO-QFBILLFUSA-N 0 3 400.592 4.019 20 0 HIADHN O=C(CN[C@@H](C[C@@H]1CCOC1)c1ccccc1)Nc1cccc(Br)c1 ZINC000543704928 940165928 /nfs/dbraw/zinc/16/59/28/940165928.db2.gz SZUOPLGSGLPHCR-KXBFYZLASA-N 0 3 403.320 4.145 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)CCc2ccc(OC(F)F)cc2)cc1 ZINC000543713867 940168738 /nfs/dbraw/zinc/16/87/38/940168738.db2.gz LMALMKZIFUUPHC-OAQYLSRUSA-N 0 3 418.484 4.183 20 0 HIADHN O=C(CN[C@@H](CO)C1CCCCC1)N1N=C(c2cccs2)C[C@@H]1c1cccs1 ZINC000543839367 940205391 /nfs/dbraw/zinc/20/53/91/940205391.db2.gz JCTAQRTZULDMHF-ZWKOTPCHSA-N 0 3 417.600 4.018 20 0 HIADHN CCN1CC[C@H](NCc2cnn(-c3ccccc3)c2)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000543849131 940207600 /nfs/dbraw/zinc/20/76/00/940207600.db2.gz LXZQHPMCRIKZOA-UNMCSNQZSA-N 0 3 400.448 4.215 20 0 HIADHN CN(C)c1ncc(CN[C@H]2CCN(C(C)(C)C)[C@@H]2c2ccc(Cl)c(F)c2)cn1 ZINC000543850670 940208302 /nfs/dbraw/zinc/20/83/02/940208302.db2.gz WGKWFWZKTZQPNN-RBUKOAKNSA-N 0 3 405.949 4.039 20 0 HIADHN Cc1cc2cc(C(=O)NC3CCN(CCOC(C)C)CC3)oc2c(Br)c1 ZINC000543889246 940226971 /nfs/dbraw/zinc/22/69/71/940226971.db2.gz GUXGBDRQJSXMHS-UHFFFAOYSA-N 0 3 423.351 4.123 20 0 HIADHN C[C@H](NC[C@@H](O)COc1ccc(-c2ccccc2)cc1)c1ccc([S@@](C)=O)cc1 ZINC000543898398 940232020 /nfs/dbraw/zinc/23/20/20/940232020.db2.gz ZPCOMGKLUHGZSB-JFCALYOJSA-N 0 3 409.551 4.182 20 0 HIADHN Cc1cc(C2CCN([C@@H]3CCCN(Cc4cccc(C(F)(F)F)c4)C3=O)CC2)n[nH]1 ZINC000543902209 940233794 /nfs/dbraw/zinc/23/37/94/940233794.db2.gz SPHOVBIZDRMPNH-HXUWFJFHSA-N 0 3 420.479 4.108 20 0 HIADHN Cc1cc(C2CCN([C@@H]3CCCN(Cc4cccc(C(F)(F)F)c4)C3=O)CC2)[nH]n1 ZINC000543902209 940233798 /nfs/dbraw/zinc/23/37/98/940233798.db2.gz SPHOVBIZDRMPNH-HXUWFJFHSA-N 0 3 420.479 4.108 20 0 HIADHN CN(C)C[C@H](NC(=O)Nc1cccc(C(=O)N2CCCC2)c1)c1ccc(Cl)cc1 ZINC000563824212 945305298 /nfs/dbraw/zinc/30/52/98/945305298.db2.gz WOUMLPZGVSACLO-FQEVSTJZSA-N 0 3 414.937 4.000 20 0 HIADHN CCc1cnccc1[C@H](C)NC[C@@H](O)COc1ccc(Cl)cc1Br ZINC000543981171 940282367 /nfs/dbraw/zinc/28/23/67/940282367.db2.gz GQENBWLHZRLAFN-SWLSCSKDSA-N 0 3 413.743 4.150 20 0 HIADHN C[C@]1(NCC(=O)Nc2cc(C3CCCC3)nn2-c2ccccc2)CCO[C@H]1C1CC1 ZINC000544175574 940344425 /nfs/dbraw/zinc/34/44/25/940344425.db2.gz NAPZNMYWDHIYRY-ZEQRLZLVSA-N 0 3 408.546 4.016 20 0 HIADHN Cc1cc(NC(=O)NC[C@@H]2CCCCS2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000544266223 940373008 /nfs/dbraw/zinc/37/30/08/940373008.db2.gz QPZFCNTYXAHTKX-PMACEKPBSA-N 0 3 413.591 4.046 20 0 HIADHN CSc1c(F)cc(NC(=O)N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)cc1F ZINC000544273805 940375878 /nfs/dbraw/zinc/37/58/78/940375878.db2.gz SPHIURHBSGKWAY-OKILXGFUSA-N 0 3 413.534 4.040 20 0 HIADHN Cc1cc(N2CCC(N[C@H](c3cccnc3)c3ccc(F)c(C)c3)CC2)nc(C)n1 ZINC000544358274 940399943 /nfs/dbraw/zinc/39/99/43/940399943.db2.gz NPIGHBJGOVPAAE-DEOSSOPVSA-N 0 3 405.521 4.284 20 0 HIADHN CCCCOc1ccc([C@@H](C)N[C@H]2CCCN(Cc3ccccn3)C2=O)cc1OC ZINC000544385005 940407525 /nfs/dbraw/zinc/40/75/25/940407525.db2.gz HLHNDRKLBLNUPF-NQIIRXRSSA-N 0 3 411.546 4.111 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(COc4ccccc4C(C)(C)C)n3)cn2)CC1 ZINC000544388334 940408828 /nfs/dbraw/zinc/40/88/28/940408828.db2.gz PFTCXMNDMHLGGE-UHFFFAOYSA-N 0 3 421.545 4.150 20 0 HIADHN COc1ccc(C(=O)C[C@@H](C)C(=O)NC2C[C@H]3CC[C@@H](C2)N3Cc2ccccc2)cc1 ZINC000544394992 940410763 /nfs/dbraw/zinc/41/07/63/940410763.db2.gz BMARPBCIUGIZHN-JJXTWPQTSA-N 0 3 420.553 4.216 20 0 HIADHN CN1CCCN(c2ccc(-c3noc([C@H]4CCC[C@@H](C(F)(F)F)C4)n3)cn2)CC1 ZINC000544397173 940411518 /nfs/dbraw/zinc/41/15/18/940411518.db2.gz YAHDWVCINBBBLQ-GOEBONIOSA-N 0 3 409.456 4.110 20 0 HIADHN CN1CCCN(c2ccc(-c3noc([C@H]4CCC[C@H](C(F)(F)F)C4)n3)cn2)CC1 ZINC000544397174 940411550 /nfs/dbraw/zinc/41/15/50/940411550.db2.gz YAHDWVCINBBBLQ-HOCLYGCPSA-N 0 3 409.456 4.110 20 0 HIADHN COc1ccc(CNC(=O)CN[C@@H](Cc2ccccc2)c2sccc2C)cc1OC ZINC000544415077 940417084 /nfs/dbraw/zinc/41/70/84/940417084.db2.gz NPAWGFKGBQWKNB-FQEVSTJZSA-N 0 3 424.566 4.264 20 0 HIADHN Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)NC[C@H](O)COc1cccc2ccccc21 ZINC000544420864 940420676 /nfs/dbraw/zinc/42/06/76/940420676.db2.gz FEAAOMITYRGJKY-KSSFIOAISA-N 0 3 421.463 4.306 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(C4(c5ccccc5F)CCCC4)n3)cn2)CC1 ZINC000544425833 940424285 /nfs/dbraw/zinc/42/42/85/940424285.db2.gz YRQPGADXUYLDIC-UHFFFAOYSA-N 0 3 421.520 4.273 20 0 HIADHN C[C@@H](N[C@H](CC(N)=O)C1CCCCC1)C(=O)Nc1ccccc1Cc1ccccc1 ZINC000544455461 940438399 /nfs/dbraw/zinc/43/83/99/940438399.db2.gz AYCRFTATCPGXMM-WZONZLPQSA-N 0 3 407.558 4.018 20 0 HIADHN C[C@H](N[C@H](CC(N)=O)C1CCCCC1)C(=O)Nc1ccc(OCc2ccccc2)cc1 ZINC000544460616 940440358 /nfs/dbraw/zinc/44/03/58/940440358.db2.gz ROVWSMXLOHTTNX-FDDCHVKYSA-N 0 3 423.557 4.007 20 0 HIADHN CCOc1ccc([C@@H]2CCCN2C(=O)CN[C@H](C)[C@H]2Oc3ccccc3[C@@H]2C)cc1 ZINC000544517902 940469075 /nfs/dbraw/zinc/46/90/75/940469075.db2.gz IKRSHMLIEMVNGG-UZIDKSDLSA-N 0 3 408.542 4.292 20 0 HIADHN c1ccc([C@H](NCC2(c3ccc4c(c3)OCCO4)CCCC2)c2cncnc2)cc1 ZINC000544568328 940480967 /nfs/dbraw/zinc/48/09/67/940480967.db2.gz FVFJXBJEWFKZKP-DEOSSOPVSA-N 0 3 401.510 4.439 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)N1CCO[C@H](C2CCCCC2)C1 ZINC000544578971 940483597 /nfs/dbraw/zinc/48/35/97/940483597.db2.gz KXFDLMSORJNYFS-QFIPXVFZSA-N 0 3 417.619 4.091 20 0 HIADHN CCCCN1CCCC[C@@H]1CNC(=O)c1cn(CC)c2ccc(Cl)cc2c1=O ZINC000544596701 940486988 /nfs/dbraw/zinc/48/69/88/940486988.db2.gz SAGLFVRMXJXGSP-QGZVFWFLSA-N 0 3 403.954 4.059 20 0 HIADHN Fc1cccc(CN2CCC[C@H](c3nc(-c4ccc(N5CCCC5)nc4)no3)C2)c1 ZINC000544810701 940516407 /nfs/dbraw/zinc/51/64/07/940516407.db2.gz MZZBHTMFRKPWBI-IBGZPJMESA-N 0 3 407.493 4.251 20 0 HIADHN CCN(C(=O)c1cc(C)n(-c2ccc(F)cc2)n1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000544848026 940518966 /nfs/dbraw/zinc/51/89/66/940518966.db2.gz ZYZXDSXYPATGGZ-QFIPXVFZSA-N 0 3 406.505 4.056 20 0 HIADHN CCN(C(=O)Cc1nc(-c2cccs2)oc1C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000544849233 940519127 /nfs/dbraw/zinc/51/91/27/940519127.db2.gz PSJXJFKKHDIGEE-LJQANCHMSA-N 0 3 409.555 4.377 20 0 HIADHN CCN(C(=O)c1ccc(NC(=O)[C@@H]2C[C@H]2C)cc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000544871738 940520735 /nfs/dbraw/zinc/52/07/35/940520735.db2.gz LWNVWQICWVSSQS-YFXJRYMSSA-N 0 3 405.542 4.018 20 0 HIADHN C[C@H](NCC(=O)N1CCC(OCc2ccccc2)CC1)c1ccc2c(c1)CCCC2 ZINC000544893457 940522531 /nfs/dbraw/zinc/52/25/31/940522531.db2.gz DXWNMAFAZYYCCJ-FQEVSTJZSA-N 0 3 406.570 4.424 20 0 HIADHN Cc1cccc2[nH]c(Cc3noc(-c4ccc(CN5CCSCC5)cc4)n3)nc21 ZINC000544995022 940531798 /nfs/dbraw/zinc/53/17/98/940531798.db2.gz WPXWPQBRTVPYEI-UHFFFAOYSA-N 0 3 405.527 4.061 20 0 HIADHN O=C(c1ccoc1)N1CCC(NCc2nc3c(s2)C[C@H](c2ccccc2)CC3)CC1 ZINC000545220513 940556770 /nfs/dbraw/zinc/55/67/70/940556770.db2.gz BSHNZBKUJLYJEH-GOSISDBHSA-N 0 3 421.566 4.403 20 0 HIADHN CS[C@@H]1CN(C(=O)Nc2ccc(Br)cc2C(C)C)C[C@@H]1N(C)C ZINC000545442852 940570086 /nfs/dbraw/zinc/57/00/86/940570086.db2.gz YYPUKHUTRGYJLS-JKSUJKDBSA-N 0 3 400.386 4.082 20 0 HIADHN NC(=O)[C@@H](Cc1ccc(Cl)cc1)NCc1cccc(COCc2ccccc2)c1 ZINC000545474766 940571312 /nfs/dbraw/zinc/57/13/12/940571312.db2.gz KOFYKFCTDBGCMU-HSZRJFAPSA-N 0 3 408.929 4.243 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(-c4[nH]c5ccccc5c4Cl)n3)cn2)CC1 ZINC000545660727 940579406 /nfs/dbraw/zinc/57/94/06/940579406.db2.gz WLABECZPAWHNBT-UHFFFAOYSA-N 0 3 408.893 4.075 20 0 HIADHN Fc1cccc(CN2CCC[C@H](c3nc(-c4cccc(-n5cccn5)c4)no3)C2)c1 ZINC000545691501 940580999 /nfs/dbraw/zinc/58/09/99/940580999.db2.gz LNZAFIJZQMWMCH-IBGZPJMESA-N 0 3 403.461 4.441 20 0 HIADHN Cc1onc(-c2ccccn2)c1C(=O)NC[C@@H](c1ccc(CC(C)C)cc1)N(C)C ZINC000563996677 945340690 /nfs/dbraw/zinc/34/06/90/945340690.db2.gz WNTLXBVLRUNCOQ-NRFANRHFSA-N 0 3 406.530 4.276 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)C1(c2ccccc2Br)CC1)c1ccco1 ZINC000563986307 945336728 /nfs/dbraw/zinc/33/67/28/945336728.db2.gz VHIQHAGOUTYTKT-YOEHRIQHSA-N 0 3 405.336 4.319 20 0 HIADHN Cc1cc(C(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)c(C)n1Cc1ccncc1 ZINC000545856356 940639893 /nfs/dbraw/zinc/63/98/93/940639893.db2.gz DUTMEAFROICGMF-XMMPIXPASA-N 0 3 416.569 4.285 20 0 HIADHN CCC(CC)n1nc(C)cc1C(=O)NC[C@@H](c1ccc(OC(C)C)cc1)N(C)C ZINC000563991320 945338898 /nfs/dbraw/zinc/33/88/98/945338898.db2.gz LRZUWQSLTTVICG-QFIPXVFZSA-N 0 3 400.567 4.373 20 0 HIADHN Cc1ccccc1C1(C(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)CCOCC1 ZINC000563992956 945339759 /nfs/dbraw/zinc/33/97/59/945339759.db2.gz OEJXNHVCYLDVQJ-DEOSSOPVSA-N 0 3 424.585 4.250 20 0 HIADHN COc1ccc(C(=O)CC(C)(C)CC(=O)N2CCCN(C3CCCC3)CC2)cc1 ZINC000546095089 940698508 /nfs/dbraw/zinc/69/85/08/940698508.db2.gz YNXSQKFJKBJQGJ-UHFFFAOYSA-N 0 3 400.563 4.161 20 0 HIADHN CC(=O)[C@@H]1C[C@H](CC(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)C1(C)C ZINC000546123625 940706051 /nfs/dbraw/zinc/70/60/51/940706051.db2.gz SCTQHLBHZAMPIZ-VSKRKVRLSA-N 0 3 422.573 4.218 20 0 HIADHN CCN(C(=O)c1cc2cnn(C(C)C)c2nc1C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000546182508 940723213 /nfs/dbraw/zinc/72/32/13/940723213.db2.gz DYSJTEDEENFGML-OAQYLSRUSA-N 0 3 405.546 4.057 20 0 HIADHN CCN(C(=O)c1cc(C)n(-c2ccc(F)cc2F)n1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000546183573 940723656 /nfs/dbraw/zinc/72/36/56/940723656.db2.gz POEGKARWLKWLPC-FQEVSTJZSA-N 0 3 424.495 4.196 20 0 HIADHN CC[C@@H](CC(F)(F)F)NC(=O)N(CCN(C)C)Cc1ccc(Br)cc1 ZINC000546200955 940727782 /nfs/dbraw/zinc/72/77/82/940727782.db2.gz KOBJIKJUWBPXKV-HNNXBMFYSA-N 0 3 424.305 4.253 20 0 HIADHN CCN(Cc1nc2c3ccccc3oc2c(=O)[n-]1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000546224768 940734999 /nfs/dbraw/zinc/73/49/99/940734999.db2.gz MZUUVRZNSJTSFR-SFHVURJKSA-N 0 3 402.498 4.178 20 0 HIADHN CCN(Cc1nc2c3ccccc3oc2c(=O)[n-]1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000546224768 940735000 /nfs/dbraw/zinc/73/50/00/940735000.db2.gz MZUUVRZNSJTSFR-SFHVURJKSA-N 0 3 402.498 4.178 20 0 HIADHN Cc1cccc(C)c1[C@H](C)NCC(=O)Nc1cc(C(F)(F)F)ccc1-n1cncn1 ZINC000546225012 940735180 /nfs/dbraw/zinc/73/51/80/940735180.db2.gz ZGAWERMQGVRBLP-HNNXBMFYSA-N 0 3 417.435 4.192 20 0 HIADHN CCSCc1ccc(-c2nc(-c3ccc(N4CCCN(C)CC4)nc3)no2)cc1 ZINC000546355800 940800565 /nfs/dbraw/zinc/80/05/65/940800565.db2.gz HQLLVKMZZPUOMD-UHFFFAOYSA-N 0 3 409.559 4.194 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)c2ccc(-c3ccccc3)[nH]c2=O)N(C)C)cc1 ZINC000564017907 945351512 /nfs/dbraw/zinc/35/15/12/945351512.db2.gz SWHKYXVXFXSIEF-QHCPKHFHSA-N 0 3 419.525 4.274 20 0 HIADHN Cc1cc(C(=O)N[C@H](CN2CCCC2)c2ccccc2)c(C)n1Cc1ccncc1 ZINC000546582233 940857540 /nfs/dbraw/zinc/85/75/40/940857540.db2.gz XHWXAHACSXJUIJ-XMMPIXPASA-N 0 3 402.542 4.115 20 0 HIADHN Cc1[nH]c(=O)c(C(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)cc1-c1ccccc1 ZINC000546614238 940860956 /nfs/dbraw/zinc/86/09/56/940860956.db2.gz MKCITSHLYIWAHN-HXOBKFHXSA-N 0 3 401.510 4.013 20 0 HIADHN Fc1ccccc1COc1ccc(CNCc2ccc(-n3cncn3)c(F)c2)cc1 ZINC000546626789 940862365 /nfs/dbraw/zinc/86/23/65/940862365.db2.gz DLZOHCSLGMPKLP-UHFFFAOYSA-N 0 3 406.436 4.414 20 0 HIADHN Cc1c([C@H](C)NCCC[C@H]2CCCCO2)nnn1-c1cccc(Br)c1 ZINC000546872012 940898879 /nfs/dbraw/zinc/89/88/79/940898879.db2.gz WLGSXJTUPCIPHJ-KBXCAEBGSA-N 0 3 407.356 4.338 20 0 HIADHN CCN(C(=O)c1ccc(OC(F)F)c(OC)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000546893590 940904941 /nfs/dbraw/zinc/90/49/41/940904941.db2.gz XKHIWZDSCBTJGY-GOSISDBHSA-N 0 3 404.457 4.033 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CNC(=O)CN[C@H](C)c1c(C)cccc1C ZINC000546931361 940917539 /nfs/dbraw/zinc/91/75/39/940917539.db2.gz VNBMYLOEHFKVMW-HXUWFJFHSA-N 0 3 404.558 4.132 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNc2ncccc2C(=O)N2CCCCC2)N(C)C)cc1 ZINC000564056599 945365675 /nfs/dbraw/zinc/36/56/75/945365675.db2.gz UYTPZUSQTHSBSN-JOCHJYFZSA-N 0 3 410.562 4.210 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(/C=C/c4nc5ccccc5s4)n3)cn2)CC1 ZINC000547062040 940979149 /nfs/dbraw/zinc/97/91/49/940979149.db2.gz HULQZOKRAOWIKL-MDZDMXLPSA-N 0 3 418.526 4.054 20 0 HIADHN C[C@H](SCc1ccccc1)c1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1 ZINC000547064738 940980827 /nfs/dbraw/zinc/98/08/27/940980827.db2.gz UHEFNMHMLOCSIG-KRWDZBQOSA-N 0 3 409.559 4.268 20 0 HIADHN C[C@H](Cc1cccc(Cl)c1)c1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1 ZINC000547069114 940982342 /nfs/dbraw/zinc/98/23/42/940982342.db2.gz PJCJBJHOZPCJHX-MRXNPFEDSA-N 0 3 411.937 4.273 20 0 HIADHN c1ccc(CCOCCCc2noc(-c3ccc(CN4CCSCC4)cc3)n2)cc1 ZINC000547149348 941011787 /nfs/dbraw/zinc/01/17/87/941011787.db2.gz ONKAFSFREJJSCW-UHFFFAOYSA-N 0 3 423.582 4.477 20 0 HIADHN C[C@H](c1noc([C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)n1)c1ccncc1 ZINC000547220883 941036119 /nfs/dbraw/zinc/03/61/19/941036119.db2.gz GJBIKYDHKOGPFD-MGPUTAFESA-N 0 3 402.420 4.322 20 0 HIADHN CCN(C(=O)c1cnn(-c2ccccc2C)c1N)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000547388723 941060023 /nfs/dbraw/zinc/06/00/23/941060023.db2.gz BPGLRNPCUCXXQJ-FPOVZHCZSA-N 0 3 417.557 4.061 20 0 HIADHN COc1ccc(NC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)c2ncccc12 ZINC000547452922 941063647 /nfs/dbraw/zinc/06/36/47/941063647.db2.gz AQMCJMHDMJYOOR-GOSISDBHSA-N 0 3 404.514 4.372 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CCO[C@H](c2ccc(F)cc2F)C1)c1ccsc1 ZINC000547628967 941069364 /nfs/dbraw/zinc/06/93/64/941069364.db2.gz JLHDJUCQUSUQES-PMACEKPBSA-N 0 3 423.529 4.192 20 0 HIADHN C[C@H](c1ccc(N2CCCS2(=O)=O)cc1)N(C)Cc1cccc2c1OC(C)(C)C2 ZINC000547928482 941079717 /nfs/dbraw/zinc/07/97/17/941079717.db2.gz HPQMAXSGQNQYIM-QGZVFWFLSA-N 0 3 414.571 4.133 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3coc(C4CCCCC4)n3)CC2)C[C@H](C)O1 ZINC000547948210 941080085 /nfs/dbraw/zinc/08/00/85/941080085.db2.gz CFNIJBMBWSTBML-HDICACEKSA-N 0 3 403.567 4.074 20 0 HIADHN COC(=O)CCC1CCN(Cc2cnn(Cc3ccc(C(F)(F)F)cc3)c2)CC1 ZINC000547981792 941081786 /nfs/dbraw/zinc/08/17/86/941081786.db2.gz YSGKMRLZJMATBF-UHFFFAOYSA-N 0 3 409.452 4.115 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)N[C@H](c1ccccc1)C(F)(F)F ZINC000548171261 941090414 /nfs/dbraw/zinc/09/04/14/941090414.db2.gz XCOWVPWGHABZAF-GOSISDBHSA-N 0 3 415.406 4.342 20 0 HIADHN C[C@H](N[C@H]1CCCc2ncc(C(F)(F)F)cc21)[C@@H]1CN(Cc2ccccc2)CCO1 ZINC000548306525 941094857 /nfs/dbraw/zinc/09/48/57/941094857.db2.gz POAAPJKDDMSATB-SSKFGXFMSA-N 0 3 419.491 4.357 20 0 HIADHN Cc1cccc2nc(C3CCN(C(=O)[C@H]4CCCN(Cc5cccnc5)C4)CC3)oc21 ZINC000548385761 941098914 /nfs/dbraw/zinc/09/89/14/941098914.db2.gz HDABKHNPMALQBJ-NRFANRHFSA-N 0 3 418.541 4.149 20 0 HIADHN COc1ccc(-c2ccncc2)cc1CN[C@H](C)[C@@H]1CN(Cc2ccccc2)CCO1 ZINC000548477336 941107132 /nfs/dbraw/zinc/10/71/32/941107132.db2.gz FHPNFNMWUULLLL-IBVKSMDESA-N 0 3 417.553 4.136 20 0 HIADHN CCc1ccc([C@H](N[C@@H]2CCC23CCOCC3)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000548791842 941124060 /nfs/dbraw/zinc/12/40/60/941124060.db2.gz YSRHTKXXWVUURZ-PKTZIBPZSA-N 0 3 413.583 4.291 20 0 HIADHN CC1CCN([C@@H](CNC(=O)c2ccc3c(c2)NC(=O)C3(C)C)c2cccs2)CC1 ZINC000549052626 941149274 /nfs/dbraw/zinc/14/92/74/941149274.db2.gz MCOMBIVFEMWNQK-IBGZPJMESA-N 0 3 411.571 4.181 20 0 HIADHN CC1CCN([C@H](CNC(=O)c2ccc3c(c2)NC(=O)C3(C)C)c2cccs2)CC1 ZINC000549052627 941149298 /nfs/dbraw/zinc/14/92/98/941149298.db2.gz MCOMBIVFEMWNQK-LJQANCHMSA-N 0 3 411.571 4.181 20 0 HIADHN CO[C@@H](CN[C@H](CN1CCCC1=O)c1cccc(C(F)(F)F)c1)c1ccccc1 ZINC000549066373 941151806 /nfs/dbraw/zinc/15/18/06/941151806.db2.gz VECPUIMSWQCKFD-UXHICEINSA-N 0 3 406.448 4.346 20 0 HIADHN Clc1cc(CN(Cc2ccc(-n3cncn3)cc2)C2CC2)cc2c1OCCCO2 ZINC000549076293 941153319 /nfs/dbraw/zinc/15/33/19/941153319.db2.gz DGQSCWCKJBLXQA-UHFFFAOYSA-N 0 3 410.905 4.247 20 0 HIADHN CCN1CC[C@H](NCC(=O)Nc2cccc(Cl)c2)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000549116260 941161653 /nfs/dbraw/zinc/16/16/53/941161653.db2.gz MQFRCMZPHMLZQV-PXNSSMCTSA-N 0 3 411.855 4.121 20 0 HIADHN CCN1CC[C@H](NCC(=O)Nc2cccc(Cl)c2)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000549116258 941161662 /nfs/dbraw/zinc/16/16/62/941161662.db2.gz MQFRCMZPHMLZQV-FXAWDEMLSA-N 0 3 411.855 4.121 20 0 HIADHN CCOC(=O)[C@H]1CC[C@@H](NCc2cc(OC)c(OCC)c(OC)c2)c2ccccc21 ZINC000549118372 941161889 /nfs/dbraw/zinc/16/18/89/941161889.db2.gz GHXYCTPAJOHFMD-VQTJNVASSA-N 0 3 413.514 4.374 20 0 HIADHN CC[C@@H](C)Oc1cc(CNC(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)ccn1 ZINC000549122075 941162352 /nfs/dbraw/zinc/16/23/52/941162352.db2.gz FAHBMPMTQVGMTF-BEFAXECRSA-N 0 3 404.942 4.014 20 0 HIADHN CN(C)C[C@H](NC(=O)NCc1sccc1Br)c1ccc(Cl)cc1 ZINC000549175573 941168480 /nfs/dbraw/zinc/16/84/80/941168480.db2.gz HVZLNYMDVVLJPQ-AWEZNQCLSA-N 0 3 416.772 4.266 20 0 HIADHN CN(C)C[C@H](NC(=O)c1cc(NC(=O)N(C)C)ccc1Cl)c1ccc(Cl)cc1 ZINC000549233332 941172844 /nfs/dbraw/zinc/17/28/44/941172844.db2.gz UBDHXVBLYJMFBE-SFHVURJKSA-N 0 3 423.344 4.120 20 0 HIADHN CN(C)C[C@@H](NC(=O)c1csc(-c2ncccc2F)n1)c1ccc(Cl)cc1 ZINC000549245153 941173817 /nfs/dbraw/zinc/17/38/17/941173817.db2.gz MVJAVISRGQDJGO-OAHLLOKOSA-N 0 3 404.898 4.030 20 0 HIADHN Cc1cc(Br)cn2c(CN[C@H](CN(C)C)c3ccc(Cl)cc3)cnc12 ZINC000549266677 941175496 /nfs/dbraw/zinc/17/54/96/941175496.db2.gz CVUCCDGKRUCFKR-GOSISDBHSA-N 0 3 421.770 4.451 20 0 HIADHN CC(C)COc1ccccc1CN1CCC(C(=O)NCCc2cccs2)CC1 ZINC000549376713 941183924 /nfs/dbraw/zinc/18/39/24/941183924.db2.gz AGVATTSOHQVNQW-UHFFFAOYSA-N 0 3 400.588 4.354 20 0 HIADHN O=C(COc1ccccc1CN1CC[C@H](C(F)(F)F)C2(CCC2)C1)NCC1CC1 ZINC000549425380 941188701 /nfs/dbraw/zinc/18/87/01/941188701.db2.gz NFLWOIHVZATOCF-IBGZPJMESA-N 0 3 410.480 4.146 20 0 HIADHN CC(C)[C@H](NCC(=O)N1CCO[C@H](c2ccc(F)cc2)C1)c1ccc(Cl)cc1 ZINC000549466638 941192759 /nfs/dbraw/zinc/19/27/59/941192759.db2.gz XOMTYKZCIIQXHY-UNMCSNQZSA-N 0 3 404.913 4.366 20 0 HIADHN CCN1CC[C@H](NCc2ccc(C(F)(F)F)cn2)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000549471668 941193343 /nfs/dbraw/zinc/19/33/43/941193343.db2.gz OADSEVGPRQAEIY-FUHWJXTLSA-N 0 3 403.370 4.443 20 0 HIADHN CCN1CC[C@H](NCC(=O)Nc2c(F)cccc2F)[C@H]1c1ccc(Cl)c(F)c1 ZINC000549471410 941193475 /nfs/dbraw/zinc/19/34/75/941193475.db2.gz IUXUYPAKUYUPHG-FXAWDEMLSA-N 0 3 411.855 4.121 20 0 HIADHN CC[C@H](C)c1nnc(N2CCN(Cc3ccccc3)C(C)(C)C2)n1C[C@H]1CCCO1 ZINC000549473606 941193846 /nfs/dbraw/zinc/19/38/46/941193846.db2.gz NYINAISAAULZNF-PZJWPPBQSA-N 0 3 411.594 4.071 20 0 HIADHN CN(C)C[C@@H](NC(=O)NC1CCC(C(=O)OC(C)(C)C)CC1)c1ccc(Cl)cc1 ZINC000549490546 941195851 /nfs/dbraw/zinc/19/58/51/941195851.db2.gz SPBDUQDZVCMEFZ-NKELODKYSA-N 0 3 423.985 4.142 20 0 HIADHN CN(C)C[C@H](NC(=O)NCc1nc2ccccc2n1C1CC1)c1ccc(Cl)cc1 ZINC000549496997 941196483 /nfs/dbraw/zinc/19/64/83/941196483.db2.gz QTVTWPDQLLEQEW-IBGZPJMESA-N 0 3 411.937 4.127 20 0 HIADHN Cc1nn(CC(C)C)c(C)c1CCC(=O)N[C@@H](CN(C)C)c1ccc(Cl)cc1 ZINC000549615308 941201425 /nfs/dbraw/zinc/20/14/25/941201425.db2.gz CLPPWOYRJQWTLX-NRFANRHFSA-N 0 3 404.986 4.161 20 0 HIADHN Cc1cc(C)n(Cc2ccc(C(=O)N[C@H](CN(C)C)c3ccc(Cl)cc3)cc2)n1 ZINC000549616470 941201531 /nfs/dbraw/zinc/20/15/31/941201531.db2.gz CMOJJGCGHGCGTF-JOCHJYFZSA-N 0 3 410.949 4.234 20 0 HIADHN Cc1sc2nc([C@H](C)N[C@@H](C)C3CCN(CC(F)(F)F)CC3)nc(N)c2c1C ZINC000549633614 941202224 /nfs/dbraw/zinc/20/22/24/941202224.db2.gz NPQYDAPXUPAKAT-RYUDHWBXSA-N 0 3 415.529 4.204 20 0 HIADHN O=C(NCCN1CCCC1)c1ccc(NCc2cccc(-c3ccccn3)c2)cc1 ZINC000549681583 941204319 /nfs/dbraw/zinc/20/43/19/941204319.db2.gz NPMXMLDLLCBAMJ-UHFFFAOYSA-N 0 3 400.526 4.186 20 0 HIADHN CN(C)Cc1ccc(C(=O)Nc2ccc3nc(-c4cc(F)ccc4F)[nH]c3c2)cn1 ZINC000549756823 941206566 /nfs/dbraw/zinc/20/65/66/941206566.db2.gz JJNAVBABCRJDGH-UHFFFAOYSA-N 0 3 407.424 4.217 20 0 HIADHN COCCCn1nccc1CN1CCC(C)(c2cccc(Br)c2)CC1 ZINC000549778227 941207148 /nfs/dbraw/zinc/20/71/48/941207148.db2.gz GBWMKAQREVNIIQ-UHFFFAOYSA-N 0 3 406.368 4.236 20 0 HIADHN CC(C)Cn1c(COCc2ccccc2)nnc1N1CCN(C2CCCCC2)CC1 ZINC000549842455 941212090 /nfs/dbraw/zinc/21/20/90/941212090.db2.gz JKQJFINEUCTOIV-UHFFFAOYSA-N 0 3 411.594 4.106 20 0 HIADHN C[C@@H](c1ccc(F)cc1)N1CCC[C@@H](NCc2ccc(Oc3cnccn3)cc2)C1=O ZINC000550292748 941310216 /nfs/dbraw/zinc/31/02/16/941310216.db2.gz CBUKGHXVVDRHJT-HTAPYJJXSA-N 0 3 420.488 4.250 20 0 HIADHN COC(=O)CCC[C@@H]1CCC[C@H](N[C@@H](c2nc(-c3ccncc3)no2)C(C)C)C1 ZINC000550643669 941348870 /nfs/dbraw/zinc/34/88/70/941348870.db2.gz CISNPYREXHZXQU-XKGZKEIXSA-N 0 3 400.523 4.320 20 0 HIADHN C[C@@H]1CN(c2ccccc2CNCc2ccc(COCC(F)(F)F)cc2)CCO1 ZINC000550751335 941363326 /nfs/dbraw/zinc/36/33/26/941363326.db2.gz WTZJZLBRFHPYGU-QGZVFWFLSA-N 0 3 408.464 4.280 20 0 HIADHN CN(C)[C@H](CNC(=O)NC1(c2cccc(C(F)(F)F)c2)CC1)Cc1ccccc1 ZINC000550774297 941365509 /nfs/dbraw/zinc/36/55/09/941365509.db2.gz BZWFJOIJHXAIES-IBGZPJMESA-N 0 3 405.464 4.167 20 0 HIADHN O=S1(=O)CC[C@@H](NC[C@H](c2ccccc2)C2CC2)c2cc(Br)ccc21 ZINC000550848385 941374077 /nfs/dbraw/zinc/37/40/77/941374077.db2.gz UMDBMKWLDUICBK-RTBURBONSA-N 0 3 420.372 4.451 20 0 HIADHN CCO[C@@H]1C[C@H](N[C@H](C)c2sc(-c3ccc(OC)cc3)nc2C)[C@H]1n1cccn1 ZINC000550947192 941384545 /nfs/dbraw/zinc/38/45/45/941384545.db2.gz ZCMVTTZVRFOCFZ-ZVEHZALQSA-N 0 3 412.559 4.393 20 0 HIADHN NS(=O)(=O)c1ccc2c(c1)CCC[C@@H]2N[C@@H]1CCSc2ccc(Cl)cc21 ZINC000551015036 941395307 /nfs/dbraw/zinc/39/53/07/941395307.db2.gz TWMYEMGVXZUZFO-ZWKOTPCHSA-N 0 3 408.976 4.192 20 0 HIADHN Cc1cc(CNc2ccc(C(=O)N(C)[C@H]3CCCN(C)C3)cc2)cc2cccnc12 ZINC000551091585 941408568 /nfs/dbraw/zinc/40/85/68/941408568.db2.gz YBCRDLBHFGFFHX-QHCPKHFHSA-N 0 3 402.542 4.322 20 0 HIADHN C[C@@H](N[C@@H]1CCCc2cc(S(N)(=O)=O)ccc21)c1ccc(Oc2cccnc2)cc1 ZINC000551198319 941426467 /nfs/dbraw/zinc/42/64/67/941426467.db2.gz MGIHMNXLIPOBOS-WAIKUNEKSA-N 0 3 423.538 4.250 20 0 HIADHN C[C@H](N[C@H]1CCCc2cc(S(N)(=O)=O)ccc21)c1ccc(Oc2cccnc2)cc1 ZINC000551198305 941426603 /nfs/dbraw/zinc/42/66/03/941426603.db2.gz MGIHMNXLIPOBOS-HJPURHCSSA-N 0 3 423.538 4.250 20 0 HIADHN COc1cccc(C(=O)CCCC(=O)N(C)C[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000551245720 941435122 /nfs/dbraw/zinc/43/51/22/941435122.db2.gz KJVMVGVYIYWIRX-OAQYLSRUSA-N 0 3 408.542 4.029 20 0 HIADHN COc1ccc([C@H](C)N[C@H]2CCCN([C@H](C)c3ccc(F)cc3)C2=O)cc1OC ZINC000551275062 941441639 /nfs/dbraw/zinc/44/16/39/941441639.db2.gz YNXJDUBPRZPCKC-YRNRMSPPSA-N 0 3 400.494 4.246 20 0 HIADHN C[C@H](N[C@H]1CCC(=O)N[C@@H]1C1CC1)c1nc2cc(Cl)ccc2n1Cc1ccccc1 ZINC000551368807 941463252 /nfs/dbraw/zinc/46/32/52/941463252.db2.gz RBIWTSPXVSBADE-IGCHPXFFSA-N 0 3 422.960 4.446 20 0 HIADHN CN(C)Cc1ccc(S(=O)(=O)N(C)[C@H](c2ccc(Cl)cc2)C(F)(F)F)cc1 ZINC000551386862 941466747 /nfs/dbraw/zinc/46/67/47/941466747.db2.gz XRMXEAMQKUVVHG-QGZVFWFLSA-N 0 3 420.884 4.326 20 0 HIADHN c1ccc(CN2CCCO[C@H](CSc3nnc4sc5ccccc5n34)C2)cc1 ZINC000551389480 941467595 /nfs/dbraw/zinc/46/75/95/941467595.db2.gz UEBGPRKSTGMSJC-KRWDZBQOSA-N 0 3 410.568 4.327 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)Nc1ccc(Oc2cccnc2)nc1 ZINC000551392881 941468399 /nfs/dbraw/zinc/46/83/99/941468399.db2.gz UJTGEHKTYJYICL-UHFFFAOYSA-N 0 3 409.465 4.004 20 0 HIADHN COc1cc(CNc2ccc(C(=O)N(C)[C@H]3CCCN(C)C3)cc2)ccc1SC ZINC000551450303 941482050 /nfs/dbraw/zinc/48/20/50/941482050.db2.gz BBTHVNDADQRGBE-FQEVSTJZSA-N 0 3 413.587 4.195 20 0 HIADHN CCOc1ccc([C@H](NCc2ccc(S(C)(=O)=O)cc2)C(C)C)cc1OCC ZINC000551537838 941497684 /nfs/dbraw/zinc/49/76/84/941497684.db2.gz CSNKXBCCJWYARM-JOCHJYFZSA-N 0 3 405.560 4.374 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)[C@@H]2C[C@H]2c2ccc(C(F)(F)F)cc2)cc1 ZINC000551540918 941498071 /nfs/dbraw/zinc/49/80/71/941498071.db2.gz SMMLFSYGEBCGBJ-ZCNNSNEGSA-N 0 3 406.448 4.237 20 0 HIADHN C[C@H](NCc1ccc(OC2CCCC2)cc1)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000551566697 941502976 /nfs/dbraw/zinc/50/29/76/941502976.db2.gz MTRUSAMHNPGKJM-KRWDZBQOSA-N 0 3 402.560 4.109 20 0 HIADHN COc1cc(CN2CCN(C)[C@H](Cc3ccccc3)C2)ccc1OCc1ccncc1 ZINC000551602516 941510116 /nfs/dbraw/zinc/51/01/16/941510116.db2.gz KKXUBEXHTBXMMF-XMMPIXPASA-N 0 3 417.553 4.028 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)c2ccc(C(F)(F)F)cc2Cl)cc1 ZINC000551791473 941546063 /nfs/dbraw/zinc/54/60/63/941546063.db2.gz MLAPOFHHUACDJF-QGZVFWFLSA-N 0 3 400.828 4.400 20 0 HIADHN O=C(c1ccc(Br)cc1F)N1CCN(c2ccnc3ccccc32)CC1 ZINC000552006860 941567689 /nfs/dbraw/zinc/56/76/89/941567689.db2.gz LMNXLISCJPNWFC-UHFFFAOYSA-N 0 3 414.278 4.099 20 0 HIADHN COc1ccc(C[C@@H](C)N[C@@H](c2nc(-c3cccnc3)no2)C(C)C)c(C)c1OC ZINC000552045799 941573454 /nfs/dbraw/zinc/57/34/54/941573454.db2.gz PLPBLDMVKVJJBP-FOIQADDNSA-N 0 3 410.518 4.375 20 0 HIADHN C[C@@H](NC(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F)c1ccc(-n2cccn2)cc1 ZINC000552068910 941578801 /nfs/dbraw/zinc/57/88/01/941578801.db2.gz UFMRQAWKPWAISS-GCJKJVERSA-N 0 3 424.495 4.207 20 0 HIADHN C[C@@H](NC(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F)c1ccc(-n2cccn2)cc1 ZINC000552068912 941579278 /nfs/dbraw/zinc/57/92/78/941579278.db2.gz UFMRQAWKPWAISS-XMSQKQJNSA-N 0 3 424.495 4.207 20 0 HIADHN CCCN(Cc1nc2ccccc2n1CC)C1CCN(c2cc(C)nc(C)n2)CC1 ZINC000552076937 941580754 /nfs/dbraw/zinc/58/07/54/941580754.db2.gz NYLBPVLQBPPYEK-UHFFFAOYSA-N 0 3 406.578 4.344 20 0 HIADHN C[C@H](N[C@H](c1cccc(OC(F)(F)F)c1)C1CC1)c1ccc(S(N)(=O)=O)cc1 ZINC000552085861 941581578 /nfs/dbraw/zinc/58/15/78/941581578.db2.gz OWGXHHKMHOUZAP-SGTLLEGYSA-N 0 3 414.449 4.035 20 0 HIADHN CCc1nnc(NC(=O)[C@H](C)[C@@H](C)N[C@H](C)c2ccc(F)cc2OC(F)F)s1 ZINC000552089172 941582804 /nfs/dbraw/zinc/58/28/04/941582804.db2.gz CABYFXSIHRFORR-GMTAPVOTSA-N 0 3 416.469 4.155 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)c3cscc3Br)c2)CC1 ZINC000552125804 941589749 /nfs/dbraw/zinc/58/97/49/941589749.db2.gz LXEJJDDHKAMTEA-UHFFFAOYSA-N 0 3 408.365 4.293 20 0 HIADHN O=C(c1ccc(F)cc1C(F)(F)F)N1CCN(c2ccnc3ccccc32)CC1 ZINC000552147533 941593950 /nfs/dbraw/zinc/59/39/50/941593950.db2.gz KXGXJECBXFUXMH-UHFFFAOYSA-N 0 3 403.379 4.355 20 0 HIADHN Cc1ccc(-c2nc(C(=O)Nc3cccc(CN4CC[C@@H](O)C4)c3)cs2)c(C)c1 ZINC000552200024 941600949 /nfs/dbraw/zinc/60/09/49/941600949.db2.gz RQTYETPGVBQJQQ-LJQANCHMSA-N 0 3 407.539 4.246 20 0 HIADHN O[C@@H](CN[C@@H]1CCOc2c(Cl)cccc21)COc1cc(Cl)ccc1Cl ZINC000552226848 941608505 /nfs/dbraw/zinc/60/85/05/941608505.db2.gz QUHIWARAAGBHSC-BLLLJJGKSA-N 0 3 402.705 4.500 20 0 HIADHN C[C@H](N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1)c1ccccc1-n1ccnn1 ZINC000552249816 941614142 /nfs/dbraw/zinc/61/41/42/941614142.db2.gz LJJRCVSOKHWQSB-WMZHIEFXSA-N 0 3 411.509 4.168 20 0 HIADHN COc1ccc(NC(=O)CN[C@@H]2CC[C@@H](c3ccccc3)C[C@@H]2OC)cc1Cl ZINC000552258627 941615715 /nfs/dbraw/zinc/61/57/15/941615715.db2.gz RNQJQZVTQKBCNU-BSIFCXSSSA-N 0 3 402.922 4.228 20 0 HIADHN CC[C@@H](NCC(=O)N[C@@H]1CCOc2ccccc21)c1ccc(OC(F)(F)F)cc1 ZINC000552260466 941616555 /nfs/dbraw/zinc/61/65/55/941616555.db2.gz COSBYUNENHFKPZ-QZTJIDSGSA-N 0 3 408.420 4.266 20 0 HIADHN C[C@@H](NC[C@H](c1ccc(Cl)cc1)N(C)CCC(F)(F)F)c1ccc(=O)[nH]n1 ZINC000552266701 941617668 /nfs/dbraw/zinc/61/76/68/941617668.db2.gz ZMWPRGDUGHPKCN-MLGOLLRUSA-N 0 3 402.848 4.112 20 0 HIADHN C[C@H](C(=O)N(c1nccs1)C1CCCCC1)N(C)CCCN(C)Cc1ccco1 ZINC000552270950 941619171 /nfs/dbraw/zinc/61/91/71/941619171.db2.gz LYFSZAOFMXMVLZ-GOSISDBHSA-N 0 3 418.607 4.244 20 0 HIADHN Cc1ccc(NC(=O)C[C@@H](C)N[C@@H](CC(=O)N(C)C)c2ccccc2)cc1Cl ZINC000552295628 941624980 /nfs/dbraw/zinc/62/49/80/941624980.db2.gz RNGDIXGXOZHEEC-UZLBHIALSA-N 0 3 401.938 4.175 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)Nc1cnc2c(Br)cccn12 ZINC000552298092 941625715 /nfs/dbraw/zinc/62/57/15/941625715.db2.gz QURFZLHJPQRCLF-UHFFFAOYSA-N 0 3 413.275 4.157 20 0 HIADHN Cc1nc(-c2cc([C@@H](C)NC[C@H](N3CCOCC3)C(F)(F)F)cs2)cs1 ZINC000552338972 941637923 /nfs/dbraw/zinc/63/79/23/941637923.db2.gz UXYYGNCDKOJNJC-BZNIZROVSA-N 0 3 405.511 4.094 20 0 HIADHN C[C@H](N[C@@H]1CCC(C)(C)c2ccc(Br)cc21)C1(S(C)(=O)=O)CC1 ZINC000552341147 941638155 /nfs/dbraw/zinc/63/81/55/941638155.db2.gz GRMPOVYUFKRWIW-BLLLJJGKSA-N 0 3 400.382 4.117 20 0 HIADHN Cc1cc(C(=O)N(C)CCCN(C)Cc2ccncc2)nc(-c2ccc(Cl)cc2)n1 ZINC000552360580 941644381 /nfs/dbraw/zinc/64/43/81/941644381.db2.gz KOPHAUNJEXPMFU-UHFFFAOYSA-N 0 3 423.948 4.095 20 0 HIADHN CN1CC[C@H](NC(=O)C2(c3cc(F)cc(Br)c3)CC2)[C@@H]1c1ccccc1 ZINC000552397973 941657004 /nfs/dbraw/zinc/65/70/04/941657004.db2.gz SATDXFMXHVDZLN-OALUTQOASA-N 0 3 417.322 4.181 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)[C@@H]1C[C@@H]1c1ccc(Cl)cc1Cl ZINC000552516147 941692034 /nfs/dbraw/zinc/69/20/34/941692034.db2.gz JSLTWHUILPMYKT-QXAKKESOSA-N 0 3 405.325 4.302 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)[C@@H]1C[C@H]1c1cccc(Cl)c1Cl ZINC000552515910 941692440 /nfs/dbraw/zinc/69/24/40/941692440.db2.gz CTJJUGCPVQGGQF-RYQLBKOJSA-N 0 3 405.325 4.302 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)NCc1cc(F)ccc1F ZINC000552686006 941737368 /nfs/dbraw/zinc/73/73/68/941737368.db2.gz UETRSRMVASGACC-UHFFFAOYSA-N 0 3 415.406 4.257 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)Cc2csc(-c3ccc(C)cc3)n2)cc1 ZINC000552815264 941774844 /nfs/dbraw/zinc/77/48/44/941774844.db2.gz JWAHKDHBHMCULP-OAQYLSRUSA-N 0 3 409.555 4.089 20 0 HIADHN O=C(Cc1cccc(F)c1)N(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000552852209 941789174 /nfs/dbraw/zinc/78/91/74/941789174.db2.gz NHIKMBJKTXUSGS-VWLOTQADSA-N 0 3 417.528 4.457 20 0 HIADHN Cc1cc(NC(=O)CN[C@H](C[C@@H]2CCOC2)c2ccccc2)n(-c2ccccc2F)n1 ZINC000553063476 941826745 /nfs/dbraw/zinc/82/67/45/941826745.db2.gz XSILMEFAZKOKGY-GHTZIAJQSA-N 0 3 422.504 4.016 20 0 HIADHN O=C([C@@H]1CCCC[C@@H]1C(F)(F)F)N1CCC[C@@H](c2n[nH]cc2CN2CCCC2)C1 ZINC000553180833 941845590 /nfs/dbraw/zinc/84/55/90/941845590.db2.gz JYLHIRYLTVKVOB-NXHRZFHOSA-N 0 3 412.500 4.080 20 0 HIADHN O=C(CC1(O)CCCCC1)N(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000553197473 941847784 /nfs/dbraw/zinc/84/77/84/941847784.db2.gz MHSNIDNEXQWPCQ-XMMPIXPASA-N 0 3 421.585 4.160 20 0 HIADHN Cc1cc(Br)c(C(=O)N(CCN(C)C)Cc2ccccn2)cc1Cl ZINC000553289591 941861595 /nfs/dbraw/zinc/86/15/95/941861595.db2.gz BINITDJLVLLISS-UHFFFAOYSA-N 0 3 410.743 4.010 20 0 HIADHN Cc1cc(Cl)ccc1NC(=O)[C@@H](C)N[C@H](c1ccc2c(c1)OCCO2)C1CC1 ZINC000553315090 941866396 /nfs/dbraw/zinc/86/63/96/941866396.db2.gz PAZCEMRBSIYJJB-SZNDQCEHSA-N 0 3 400.906 4.488 20 0 HIADHN CN(C)Cc1ccccc1C(=O)NCC1(c2ccccc2Br)CCC1 ZINC000553322940 941867563 /nfs/dbraw/zinc/86/75/63/941867563.db2.gz LGDCFKHLOZBRAZ-UHFFFAOYSA-N 0 3 401.348 4.362 20 0 HIADHN CCOc1cc(CN[C@@H]2CCCc3[nH]c(=O)ccc32)cc(Br)c1OC ZINC000553398012 941879049 /nfs/dbraw/zinc/87/90/49/941879049.db2.gz GSZYRRFJPHUHGJ-OAHLLOKOSA-N 0 3 407.308 4.124 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@H](C)c1nccn1-c1ccccc1)c1ccsc1 ZINC000553412564 941881295 /nfs/dbraw/zinc/88/12/95/941881295.db2.gz SDMNTRMIGLMUPO-YLJYHZDGSA-N 0 3 411.575 4.377 20 0 HIADHN Cc1c([C@H]2OCC[C@@H]2Nc2ccnc3ccc(Oc4ccccc4)cc32)cnn1C ZINC000553542715 941905672 /nfs/dbraw/zinc/90/56/72/941905672.db2.gz JFPRIJPQNVRRMY-BJKOFHAPSA-N 0 3 400.482 4.433 20 0 HIADHN C[C@H]1C[C@H]1N1CCN(C(=O)c2ccc(Br)cc2C(F)(F)F)C[C@@H](C)C1 ZINC000553781485 941967134 /nfs/dbraw/zinc/96/71/34/941967134.db2.gz AAMWFNZBOBUXAJ-MQIPJXDCSA-N 0 3 419.285 4.270 20 0 HIADHN Cc1c2cccc(Br)c2oc1C(=O)N1CCN(C2CCC2)C[C@@H](C)C1 ZINC000553865189 941986659 /nfs/dbraw/zinc/98/66/59/941986659.db2.gz IAIGEXNWYHINNN-CYBMUJFWSA-N 0 3 405.336 4.450 20 0 HIADHN CCCN(C)[C@H](CNC(=O)NCc1c(C)nn(CC)c1C)c1ccc(Cl)cc1 ZINC000553872226 941988706 /nfs/dbraw/zinc/98/87/06/941988706.db2.gz USMLLGNTWCXDNY-HXUWFJFHSA-N 0 3 405.974 4.056 20 0 HIADHN c1ccc(CN2CCCO[C@@H](CN3CCCC[C@H]3c3nnc(C4CCC4)o3)C2)cc1 ZINC000553923709 941999736 /nfs/dbraw/zinc/99/97/36/941999736.db2.gz AXZZFBSBQDKOEA-YADHBBJMSA-N 0 3 410.562 4.155 20 0 HIADHN CC[C@H](CNC(=O)[C@@H](C)Cc1cncc2ccccc21)N1CCc2ccccc2C1 ZINC000553964014 942008510 /nfs/dbraw/zinc/00/85/10/942008510.db2.gz OGRJSWIKALFYRF-YADARESESA-N 0 3 401.554 4.367 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2F)N(C)C)cc1 ZINC000554015327 942019482 /nfs/dbraw/zinc/01/94/82/942019482.db2.gz MSDCLYJGMVPGCJ-VWPQPMDRSA-N 0 3 402.485 4.275 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)c2cccc([C@@H]3CCCOC3)c2)N(C)C)cc1 ZINC000554012829 942019503 /nfs/dbraw/zinc/01/95/03/942019503.db2.gz QKOWCDVUHJBQSP-ISKFKSNPSA-N 0 3 410.558 4.401 20 0 HIADHN C[C@H]1CCc2c(sc3nc(CCN(C)C[C@@H]4OCCc5ccccc54)nc(N)c32)C1 ZINC000554030539 942022376 /nfs/dbraw/zinc/02/23/76/942022376.db2.gz ICXGOYFZVOPCRE-KXBFYZLASA-N 0 3 422.598 4.187 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)Nc1cccc(C(=O)N(CC)CC)c1)c1ccco1 ZINC000554112008 942038693 /nfs/dbraw/zinc/03/86/93/942038693.db2.gz FTWIIDNYNGYRPI-APWZRJJASA-N 0 3 400.523 4.013 20 0 HIADHN C[C@H](NC(=O)Nc1cccc(OCc2cccnc2)c1)[C@@H](c1ccccc1)N(C)C ZINC000554138130 942047071 /nfs/dbraw/zinc/04/70/71/942047071.db2.gz JNBWCPULSPOHNK-MBSDFSHPSA-N 0 3 404.514 4.474 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1ccc(C(=O)NC2CCCC2)cc1)c1ccco1 ZINC000554147316 942050012 /nfs/dbraw/zinc/05/00/12/942050012.db2.gz VXQAZJRGMNXPBG-OXJNMPFZSA-N 0 3 412.534 4.203 20 0 HIADHN CN(C)[C@@H](CNC(=O)N[C@@H](CCO)c1ccc(Cl)c(Cl)c1)c1ccccc1 ZINC000554216606 942070372 /nfs/dbraw/zinc/07/03/72/942070372.db2.gz LBSHMBCIBXDWIF-OALUTQOASA-N 0 3 410.345 4.019 20 0 HIADHN CCOc1ccc([C@@H](C)NC(=O)N[C@@H](CN(C)C)c2ccc(F)cc2)cc1OCC ZINC000554254020 942080331 /nfs/dbraw/zinc/08/03/31/942080331.db2.gz WIUPYDHUIVCSPG-UZLBHIALSA-N 0 3 417.525 4.286 20 0 HIADHN CSc1ccc([C@@H](C)N[C@@H]2CCCN(S(=O)(=O)c3cccs3)C2)cc1F ZINC000554369758 942116842 /nfs/dbraw/zinc/11/68/42/942116842.db2.gz CHYXZEBFYMGYGV-UKRRQHHQSA-N 0 3 414.593 4.113 20 0 HIADHN COc1cc(OC)c([C@@H](C)N[C@@H]2CCCN(C(=O)CCC(F)(F)F)C2)cc1Cl ZINC000554374744 942117651 /nfs/dbraw/zinc/11/76/51/942117651.db2.gz YRFHHQZCCCGUAI-CHWSQXEVSA-N 0 3 422.875 4.341 20 0 HIADHN CCN1CCN(c2ccc(N[C@H]3CCN(c4ccccc4Cl)C3=O)c(C)c2)CC1 ZINC000554384494 942120837 /nfs/dbraw/zinc/12/08/37/942120837.db2.gz QMNYSXAWHJFFRP-NRFANRHFSA-N 0 3 412.965 4.008 20 0 HIADHN CC(C)Cc1ccc([C@@H](CNC(=O)Nc2ccc(C(=O)N(C)C)cc2)N(C)C)cc1 ZINC000554384900 942121668 /nfs/dbraw/zinc/12/16/68/942121668.db2.gz NOBSPPKPFMNVAY-JOCHJYFZSA-N 0 3 410.562 4.011 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)Nc1ccc(NC(=O)c2ccco2)cc1)c1ccco1 ZINC000554400833 942127481 /nfs/dbraw/zinc/12/74/81/942127481.db2.gz FJPXYCXZEMPEAW-CRAIPNDOSA-N 0 3 410.474 4.376 20 0 HIADHN Cc1c(NC(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)cccc1C(=O)N1CCCC1 ZINC000554427963 942140285 /nfs/dbraw/zinc/14/02/85/942140285.db2.gz GEXMQGDKVZTTMB-AVRDEDQJSA-N 0 3 408.546 4.044 20 0 HIADHN COC[C@@H](NC(=O)N[C@H](CN1CCCC1)c1ccccc1)c1cccc(Cl)c1 ZINC000554696323 942203180 /nfs/dbraw/zinc/20/31/80/942203180.db2.gz XGPPWQUMLUFTTC-NHCUHLMSSA-N 0 3 401.938 4.164 20 0 HIADHN CN(C)CCN(C[C@@H]1CCCO1)C(=O)Nc1ccc(F)cc1-c1ccc(F)cc1 ZINC000554783358 942235352 /nfs/dbraw/zinc/23/53/52/942235352.db2.gz QIUSUNKHLBISFP-IBGZPJMESA-N 0 3 403.473 4.206 20 0 HIADHN COCCCOc1ccccc1NC(=O)N[C@@H](CN(C)C)c1ccc(Cl)cc1 ZINC000554905377 942313962 /nfs/dbraw/zinc/31/39/62/942313962.db2.gz HETDDQIHBWXIQG-IBGZPJMESA-N 0 3 405.926 4.180 20 0 HIADHN COC(=O)[C@H](C)Cc1ccc(NC(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)cc1 ZINC000554914996 942317400 /nfs/dbraw/zinc/31/74/00/942317400.db2.gz JHQLZIOXMVUAHC-QRWLVFNGSA-N 0 3 417.937 4.116 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)Nc2ccc3nnc(C4CCC4)n3c2)CC1 ZINC000554957736 942333340 /nfs/dbraw/zinc/33/33/40/942333340.db2.gz XFZXAWXBMHMNTC-UHFFFAOYSA-N 0 3 418.545 4.125 20 0 HIADHN Cc1nc(C(F)(F)F)ccc1NC(=O)N(CCN(C)C)Cc1ccc(F)cc1F ZINC000555015870 942357494 /nfs/dbraw/zinc/35/74/94/942357494.db2.gz GREAUGVZTXKIJE-UHFFFAOYSA-N 0 3 416.394 4.283 20 0 HIADHN O=c1cc(CN[C@@H](c2cccc(C(F)(F)F)c2)C2CCCCC2)[nH]c2ccnn21 ZINC000555069551 942376174 /nfs/dbraw/zinc/37/61/74/942376174.db2.gz HWEBCCSODUHSAU-HXUWFJFHSA-N 0 3 404.436 4.453 20 0 HIADHN COc1cccc([C@@H]2[C@@H](NCc3ccc(Oc4ccccc4)nn3)CCN2C2CC2)c1 ZINC000555128663 942394851 /nfs/dbraw/zinc/39/48/51/942394851.db2.gz KGKHFVXKGCYYCN-UKILVPOCSA-N 0 3 416.525 4.345 20 0 HIADHN CCc1cccc(NC(=O)CN[C@@H]2CCN(CC)[C@H]2c2cc(F)c(F)c(F)c2)c1 ZINC000555132174 942396696 /nfs/dbraw/zinc/39/66/96/942396696.db2.gz IDCNMEQYDYZXJY-KNQAVFIVSA-N 0 3 405.464 4.030 20 0 HIADHN CCN1CC[C@H](NCC(=O)Nc2ccccc2Cl)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000555132348 942396729 /nfs/dbraw/zinc/39/67/29/942396729.db2.gz KGDMQZLYVURTIP-FXAWDEMLSA-N 0 3 411.855 4.121 20 0 HIADHN CCOc1ccccc1NC(=O)CN[C@@H]1CCN(C(C)C)[C@H]1c1ccc(F)c(F)c1 ZINC000555132952 942397619 /nfs/dbraw/zinc/39/76/19/942397619.db2.gz LZWWQARZYZJTJP-OFNKIYASSA-N 0 3 417.500 4.116 20 0 HIADHN COc1cccc([C@@H]2[C@H](N[C@@H](C)C(=O)Nc3cccc(C)c3C)CCN2C2CC2)c1 ZINC000555133576 942397781 /nfs/dbraw/zinc/39/77/81/942397781.db2.gz UNSVVMBOORAIAS-NTUVXCKYSA-N 0 3 407.558 4.207 20 0 HIADHN Cc1cc(-c2nnc(N3CCN(C4CCCC4)CC3)n2Cc2ccccc2)c(C)o1 ZINC000555184254 942421816 /nfs/dbraw/zinc/42/18/16/942421816.db2.gz MHBJLKRVTGWFLC-UHFFFAOYSA-N 0 3 405.546 4.268 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@@H](N[C@H](Cn2ccccc2=O)c2ccccc2)c2ccccc21 ZINC000555236108 942440439 /nfs/dbraw/zinc/44/04/39/942440439.db2.gz QWOFMHXBRYKINB-WXFUMESZSA-N 0 3 416.521 4.361 20 0 HIADHN CO[C@H](C)CCNC(=O)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000555276192 942459404 /nfs/dbraw/zinc/45/94/04/942459404.db2.gz GAFANEYIWRTQPB-OAHLLOKOSA-N 0 3 402.366 4.026 20 0 HIADHN O=C(COc1ccccc1CN1CC[C@H](C(F)(F)F)C2(CCC2)C1)N1CCCC1 ZINC000555350660 942488218 /nfs/dbraw/zinc/48/82/18/942488218.db2.gz WYSPFKOKQUWEOB-IBGZPJMESA-N 0 3 410.480 4.242 20 0 HIADHN O=C(COc1ccccc1CN1CC[C@@H](C(F)(F)F)C2(CCC2)C1)N1CCCC1 ZINC000555350665 942488848 /nfs/dbraw/zinc/48/88/48/942488848.db2.gz WYSPFKOKQUWEOB-LJQANCHMSA-N 0 3 410.480 4.242 20 0 HIADHN COCCc1ccc(OC[C@@H](O)CN2CC=C(c3cccc(Cl)c3)CC2)cc1 ZINC000555462367 942564515 /nfs/dbraw/zinc/56/45/15/942564515.db2.gz NUJKMXJTIVEZFB-QFIPXVFZSA-N 0 3 401.934 4.058 20 0 HIADHN COc1c(Br)cc(CN[C@H](C)c2cc[nH]c(=O)c2)cc1Br ZINC000555606449 942665207 /nfs/dbraw/zinc/66/52/07/942665207.db2.gz KNQJKXRPNKDQLT-SECBINFHSA-N 0 3 416.113 4.172 20 0 HIADHN COc1cc(CN[C@H](C)c2ccc(-n3cccn3)c(F)c2)cc(Br)c1O ZINC000555606456 942665745 /nfs/dbraw/zinc/66/57/45/942665745.db2.gz KUTQVWDHHJXEIY-GFCCVEGCSA-N 0 3 420.282 4.339 20 0 HIADHN CCN(C(=O)c1cc(Cc2ccccc2)n[nH]1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000555787892 942733335 /nfs/dbraw/zinc/73/33/35/942733335.db2.gz INNVSMMBHQWKTQ-WMZHIEFXSA-N 0 3 402.542 4.298 20 0 HIADHN CCN1CCCC[C@H]1CNC(=O)C(C)(C)c1csc(-c2c(F)cccc2F)n1 ZINC000556026501 942787886 /nfs/dbraw/zinc/78/78/86/942787886.db2.gz DVRFBFHKTYZKAU-AWEZNQCLSA-N 0 3 407.530 4.357 20 0 HIADHN C[C@H](NCc1cccc(NC(=O)CCN2CCOCC2)c1)c1cccc(C2CC2)c1 ZINC000556058588 942798127 /nfs/dbraw/zinc/79/81/27/942798127.db2.gz MTWMFQLPDYCPPW-IBGZPJMESA-N 0 3 407.558 4.076 20 0 HIADHN O=C(CCc1ccccc1)N1CC[C@@H](N[C@@H]2CCc3sc(Br)cc32)C1 ZINC000556104543 942805826 /nfs/dbraw/zinc/80/58/26/942805826.db2.gz YDERSGIHBQPNTE-NVXWUHKLSA-N 0 3 419.388 4.321 20 0 HIADHN CC(C)c1ccccc1NC(=O)[C@H](C)N[C@H]1CCN(C)[C@H]1c1ccc(F)c(F)c1 ZINC000556126827 942808240 /nfs/dbraw/zinc/80/82/40/942808240.db2.gz WTVYYXRGGOEVCS-RXYZOABWSA-N 0 3 401.501 4.450 20 0 HIADHN Fc1ccc([C@H]2C[C@H](N[C@H](c3cccs3)c3nnc[nH]3)C2)cc1Br ZINC000556177947 942814533 /nfs/dbraw/zinc/81/45/33/942814533.db2.gz AMNKKZVOMTXTBO-XHBSWPGZSA-N 0 3 407.312 4.393 20 0 HIADHN Brc1ccc2c(c1)[C@@H](NCc1cccc(N3CCOCC3)c1)CCCO2 ZINC000556222461 942820922 /nfs/dbraw/zinc/82/09/22/942820922.db2.gz UJMSOATZZZLHHS-FQEVSTJZSA-N 0 3 417.347 4.289 20 0 HIADHN C[C@H](c1ccccc1F)N1CCC[C@@H](N[C@@H](C)c2ccc3c(c2)OCCCO3)C1=O ZINC000556223960 942821317 /nfs/dbraw/zinc/82/13/17/942821317.db2.gz LVXLXFPQFFMKJK-CSODHUTKSA-N 0 3 412.505 4.390 20 0 HIADHN CCCOc1ccc(Oc2ncccc2CN[C@@H]2CCC[C@@H](S(C)(=O)=O)C2)cc1 ZINC000556236931 942824317 /nfs/dbraw/zinc/82/43/17/942824317.db2.gz XIRGEGKGPKUHQL-WIYYLYMNSA-N 0 3 418.559 4.108 20 0 HIADHN CN1CCN(c2ncccc2CNCc2ccc(-c3ccc(Cl)cc3)cc2)CC1 ZINC000556386046 942854306 /nfs/dbraw/zinc/85/43/06/942854306.db2.gz LGQFNLZWRMMNPR-UHFFFAOYSA-N 0 3 406.961 4.444 20 0 HIADHN CCOc1cc(C[NH2+]CCOc2cccc(Br)c2)cc(Cl)c1[O-] ZINC000556388085 942854760 /nfs/dbraw/zinc/85/47/60/942854760.db2.gz RUYPWXXQMXJJBJ-UHFFFAOYSA-N 0 3 400.700 4.375 20 0 HIADHN CN(CCC(F)(F)F)[C@@H](CNCc1cc(C(N)=O)cs1)c1ccc(Cl)cc1 ZINC000556413559 942860261 /nfs/dbraw/zinc/86/02/61/942860261.db2.gz ZTPMGBIRJMKASZ-INIZCTEOSA-N 0 3 419.900 4.216 20 0 HIADHN C[C@H]1CCN(C(=O)C2(Cc3ccc(F)cc3)CCOCC2)CCN1Cc1ccccc1 ZINC000556419768 942861230 /nfs/dbraw/zinc/86/12/30/942861230.db2.gz XFZGSEQEPFDPBG-NRFANRHFSA-N 0 3 424.560 4.288 20 0 HIADHN CN1CCC(N(Cc2ccccc2Br)C(=O)CCC2CCOCC2)CC1 ZINC000556484480 942882445 /nfs/dbraw/zinc/88/24/45/942882445.db2.gz LYQOGPUWLJBSFW-UHFFFAOYSA-N 0 3 423.395 4.079 20 0 HIADHN Cc1ccc2c(c1)[C@H](NCc1cccc(N3C(=O)N[C@](C)(C4CC4)C3=O)c1)CCC2 ZINC000556609885 942914145 /nfs/dbraw/zinc/91/41/45/942914145.db2.gz BUCLPTNYQCIKQQ-RCZVLFRGSA-N 0 3 403.526 4.387 20 0 HIADHN C[C@H](NC(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1)c1nc2ccccc2[nH]1 ZINC000556613391 942916191 /nfs/dbraw/zinc/91/61/91/942916191.db2.gz WYGMPWNCQSMNSP-BTYIYWSLSA-N 0 3 416.447 4.195 20 0 HIADHN O=C(C[C@H](c1cccs1)n1cccc1)N1CCN(c2ccnc3ccccc32)CC1 ZINC000556833436 942937388 /nfs/dbraw/zinc/93/73/88/942937388.db2.gz MGUKDFFGWZAGSG-JOCHJYFZSA-N 0 3 416.550 4.426 20 0 HIADHN O[C@@H](CN[C@H]1CCOc2c(Cl)cccc21)COc1ccc(Cl)cc1Cl ZINC000556859916 942942212 /nfs/dbraw/zinc/94/22/12/942942212.db2.gz QVOFZTVKFPCLDE-LRDDRELGSA-N 0 3 402.705 4.500 20 0 HIADHN CC[C@H](NCc1cccc(CS(C)(=O)=O)c1)c1ccc(OC(F)(F)F)cc1 ZINC000556871669 942945690 /nfs/dbraw/zinc/94/56/90/942945690.db2.gz LEVNOKOXHRBSCU-SFHVURJKSA-N 0 3 401.450 4.371 20 0 HIADHN CO[C@@H]1C[C@H](c2ccccc2)CC[C@@H]1NCC(=O)N(C)c1nc2ccccc2s1 ZINC000556881470 942948717 /nfs/dbraw/zinc/94/87/17/942948717.db2.gz SOBHVRPKMGZHJI-WSTZPKSXSA-N 0 3 409.555 4.200 20 0 HIADHN C[C@H](NCc1cc2cc(Br)ccc2[nH]1)c1ccc2c(c1)OCC(=O)N2 ZINC000556889832 942953035 /nfs/dbraw/zinc/95/30/35/942953035.db2.gz GVRMQCPTYBLVPO-NSHDSACASA-N 0 3 400.276 4.112 20 0 HIADHN Brc1ccc(-c2ccc(CN3CCC(O[C@H]4CCOC4)CC3)o2)cc1 ZINC000556904134 942959696 /nfs/dbraw/zinc/95/96/96/942959696.db2.gz JYELSKXMYRGUDZ-IBGZPJMESA-N 0 3 406.320 4.479 20 0 HIADHN Cc1nc(-c2ccccc2F)sc1[C@H](C)NC[C@@H](N1CCOCC1)C(F)(F)F ZINC000556924829 942967990 /nfs/dbraw/zinc/96/79/90/942967990.db2.gz WPJYCXIHFOESIZ-BLLLJJGKSA-N 0 3 417.472 4.171 20 0 HIADHN Cc1nn(-c2ccc(Br)cc2)cc1CN1CC2(CCOCC2)[C@H]1C1CC1 ZINC000556950360 942977507 /nfs/dbraw/zinc/97/75/07/942977507.db2.gz VCNPNQRQMDSYFI-HXUWFJFHSA-N 0 3 416.363 4.334 20 0 HIADHN CC(C)(C)C1=CCN(CCNC(=O)CCc2nnc(-c3cc4ccccc4o3)o2)CC1 ZINC000556992672 942989813 /nfs/dbraw/zinc/98/98/13/942989813.db2.gz QWKDPNLBABZANE-UHFFFAOYSA-N 0 3 422.529 4.210 20 0 HIADHN C[C@@H](CC(=O)Nc1cccc(CN2CC[C@H](O)C2)c1)c1cccc(C(F)(F)F)c1 ZINC000557021683 942996516 /nfs/dbraw/zinc/99/65/16/942996516.db2.gz AFQRBYLXPLQHJF-YWZLYKJASA-N 0 3 406.448 4.404 20 0 HIADHN CCn1ccnc1[C@H]1CCCCN1C(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000557061386 943009441 /nfs/dbraw/zinc/00/94/41/943009441.db2.gz JOQRQUWAHLXWNI-WOJBJXKFSA-N 0 3 416.516 4.114 20 0 HIADHN CCn1ccnc1[C@@H]1CCCCN1C(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000557061379 943009867 /nfs/dbraw/zinc/00/98/67/943009867.db2.gz JOQRQUWAHLXWNI-UXHICEINSA-N 0 3 416.516 4.114 20 0 HIADHN CO[C@@H]1CCCC[C@@H]1C(=O)N(Cc1ccccc1Br)C1CCN(C)CC1 ZINC000557160031 943035117 /nfs/dbraw/zinc/03/51/17/943035117.db2.gz HQGBEUILSFTRPD-AZUAARDMSA-N 0 3 423.395 4.077 20 0 HIADHN O[C@H](CNCc1ccc(-n2ccnc2)c(F)c1)COc1ccc(-c2ccccc2)cc1 ZINC000557221687 943055377 /nfs/dbraw/zinc/05/53/77/943055377.db2.gz UACHIKLUIVNSHS-JOCHJYFZSA-N 0 3 417.484 4.208 20 0 HIADHN CCOc1cc(C[NH2+]CCCc2nc3ccccc3[nH]2)cc(Br)c1[O-] ZINC000557334721 943075025 /nfs/dbraw/zinc/07/50/25/943075025.db2.gz RGEUOFLIQHUMBW-UHFFFAOYSA-N 0 3 404.308 4.152 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)NCc1ccncc1OCc1ccccc1 ZINC000557362758 943087471 /nfs/dbraw/zinc/08/74/71/943087471.db2.gz GQVQDISVNDEVMT-UHFFFAOYSA-N 0 3 415.493 4.398 20 0 HIADHN Cc1ccccc1C1CCN(Cc2cc(=O)n3cc(Br)ccc3n2)CC1 ZINC000557374398 943091775 /nfs/dbraw/zinc/09/17/75/943091775.db2.gz MCAJSPLLTDRCRX-UHFFFAOYSA-N 0 3 412.331 4.145 20 0 HIADHN O=C(N[C@@H](c1c[nH]c2ccccc21)C(F)(F)F)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000557629704 943239118 /nfs/dbraw/zinc/23/91/18/943239118.db2.gz CMJHDAWEPSKGOT-UZLBHIALSA-N 0 3 416.447 4.195 20 0 HIADHN CC1CCN([C@H](CNC(=O)NCC2(c3ccccn3)CCC2)c2cccs2)CC1 ZINC000557748303 943278400 /nfs/dbraw/zinc/27/84/00/943278400.db2.gz NQQKMPQJLGBWNT-LJQANCHMSA-N 0 3 412.603 4.337 20 0 HIADHN Cc1nn(-c2ccccc2)c2sc(C(=O)N3CCN(C4CCC4)C[C@@H](C)C3)cc12 ZINC000557837072 943309059 /nfs/dbraw/zinc/30/90/59/943309059.db2.gz MMIMHHCEWJHGOB-MRXNPFEDSA-N 0 3 408.571 4.342 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)c1sc(C)c(Br)c1OC)c1ccco1 ZINC000557911274 943326880 /nfs/dbraw/zinc/32/68/80/943326880.db2.gz DHCKKLVQKMGUBH-PWSUYJOCSA-N 0 3 415.353 4.280 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)[C@H]1C[C@@H]1c1cccc(Br)c1)c1ccco1 ZINC000557911314 943327000 /nfs/dbraw/zinc/32/70/00/943327000.db2.gz FHVTZXZMMSFFMZ-HNONPPJISA-N 0 3 405.336 4.391 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)c1cccc(C(=O)N(C)CC(C)(C)C)c1)c1ccco1 ZINC000557916819 943328300 /nfs/dbraw/zinc/32/83/00/943328300.db2.gz SDFYPMJZBLXLIC-XLIONFOSSA-N 0 3 413.562 4.257 20 0 HIADHN CC(C)Cc1ccc([C@@H](CNC(=O)c2cccc(NC(=O)N(C)C)c2)N(C)C)cc1 ZINC000557989212 943347924 /nfs/dbraw/zinc/34/79/24/943347924.db2.gz VELYVNJKISXHJQ-JOCHJYFZSA-N 0 3 410.562 4.011 20 0 HIADHN CC1CCN([C@@H](CNC(=O)N2CCCC[C@@H]2c2ccnn2C)c2cccs2)CC1 ZINC000558003569 943351995 /nfs/dbraw/zinc/35/19/95/943351995.db2.gz QSQPSRIDPCNPQM-UXHICEINSA-N 0 3 415.607 4.191 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)Nc2ccccc2-n2cccn2)N(C)C)cc1 ZINC000558306291 943495846 /nfs/dbraw/zinc/49/58/46/943495846.db2.gz PNQHWYMTDSSYHF-JOCHJYFZSA-N 0 3 407.518 4.084 20 0 HIADHN CC(=O)Nc1ccc(C)c(NC(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)c1 ZINC000558311225 943498250 /nfs/dbraw/zinc/49/82/50/943498250.db2.gz KBPYZNKOKQXVTE-QFIPXVFZSA-N 0 3 412.534 4.165 20 0 HIADHN COc1cccc([C@H](CNC(=O)NCc2ccc3[nH]c(C)cc3c2)N2CCCC2)c1 ZINC000558366485 943528163 /nfs/dbraw/zinc/52/81/63/943528163.db2.gz YXZLKLCSDYXDSF-QHCPKHFHSA-N 0 3 406.530 4.121 20 0 HIADHN CN(C)c1noc([C@H]2CCCN([C@H]3CCCc4ccc(Br)cc43)C2)n1 ZINC000558728899 943633876 /nfs/dbraw/zinc/63/38/76/943633876.db2.gz BAPNAWCWHVBEOS-YOEHRIQHSA-N 0 3 405.340 4.155 20 0 HIADHN COc1cccc([C@@H]2[C@H](NCC(=O)Nc3cccc4ccccc43)CCN2C2CC2)c1 ZINC000558894286 943727376 /nfs/dbraw/zinc/72/73/76/943727376.db2.gz GLNIHMNURPXOKB-AOYPEHQESA-N 0 3 415.537 4.355 20 0 HIADHN CN(C)C[C@H](NC(=O)N[C@@H](c1ccccc1)[C@H]1CCOC1)c1ccc(Cl)cc1 ZINC000558906295 943738888 /nfs/dbraw/zinc/73/88/88/943738888.db2.gz OCDMLASOBFFWHX-JBACZVJFSA-N 0 3 401.938 4.020 20 0 HIADHN CN(C)C[C@H](NC(=O)N[C@H](c1ccccc1)[C@@H]1CCOC1)c1ccc(Cl)cc1 ZINC000558906294 943739378 /nfs/dbraw/zinc/73/93/78/943739378.db2.gz OCDMLASOBFFWHX-HLAWJBBLSA-N 0 3 401.938 4.020 20 0 HIADHN C[C@@H](NC(=O)N[C@@H](CN(C)C)c1ccc(Cl)cc1)c1noc(-c2ccccc2)n1 ZINC000558910517 943742531 /nfs/dbraw/zinc/74/25/31/943742531.db2.gz NIJCKJTYUQFKAP-KDOFPFPSSA-N 0 3 413.909 4.053 20 0 HIADHN CC[C@@H](N[C@H]1CCc2cccc(Br)c2C1)c1nnc2n1CCCCC2 ZINC000559259918 943887045 /nfs/dbraw/zinc/88/70/45/943887045.db2.gz MISJXYMMIVMUDU-MAUKXSAKSA-N 0 3 403.368 4.365 20 0 HIADHN CC[C@H](N[C@H]1CCc2cccc(Br)c2C1)c1nnc2n1CCCCC2 ZINC000559259920 943887052 /nfs/dbraw/zinc/88/70/52/943887052.db2.gz MISJXYMMIVMUDU-YJBOKZPZSA-N 0 3 403.368 4.365 20 0 HIADHN COc1cc(CNCCc2ccc(Cl)c(OC)c2)c(Br)cc1O ZINC000559351960 943905807 /nfs/dbraw/zinc/90/58/07/943905807.db2.gz PLMBPEFHYUOPGJ-UHFFFAOYSA-N 0 3 400.700 4.158 20 0 HIADHN C[C@H](Cc1cccc(O)c1)NC(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1 ZINC000559547658 944001397 /nfs/dbraw/zinc/00/13/97/944001397.db2.gz PNLCFNSXHCWCIT-MRXNPFEDSA-N 0 3 423.479 4.115 20 0 HIADHN COc1ccc2cc(CN(C)C(=O)[C@@H](C)N3CCC(C4CCOCC4)CC3)ccc2c1 ZINC000559815589 944059455 /nfs/dbraw/zinc/05/94/55/944059455.db2.gz UJVLIIHSCGWHHG-LJQANCHMSA-N 0 3 424.585 4.334 20 0 HIADHN C[C@H]1CCN(C)CCN1C(=O)Nc1ccc(N(C)C(=O)c2ccc(Cl)cc2)cc1 ZINC000559848695 944067246 /nfs/dbraw/zinc/06/72/46/944067246.db2.gz DKMKWWGDQPSXIH-INIZCTEOSA-N 0 3 414.937 4.175 20 0 HIADHN COCCOc1ccc([C@H](C)N[C@H]2CCCN([C@@H](C)c3ccccc3F)C2=O)cc1 ZINC000559878863 944072906 /nfs/dbraw/zinc/07/29/06/944072906.db2.gz OKLXKHIXBOREBR-BSRJHKFKSA-N 0 3 414.521 4.254 20 0 HIADHN CN1CCC[C@H](CNC(=O)c2ncoc2C2CC2)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000559908188 944082315 /nfs/dbraw/zinc/08/23/15/944082315.db2.gz IWFKVROXEPQDSN-CRAIPNDOSA-N 0 3 407.436 4.384 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)Nc2ccc(Oc3cccnc3)nc2)C1 ZINC000559966160 944102894 /nfs/dbraw/zinc/10/28/94/944102894.db2.gz NZNZMIWHGFSGHM-YLJYHZDGSA-N 0 3 403.486 4.226 20 0 HIADHN CC[C@H]1CCCN1CC(=O)NC[C@@H](c1c[nH]c2ccccc21)c1ccc(OC)cc1 ZINC000559986053 944112490 /nfs/dbraw/zinc/11/24/90/944112490.db2.gz LBVAKNMKABIPOK-SIKLNZKXSA-N 0 3 405.542 4.299 20 0 HIADHN CN(C(=O)c1ccc(NCc2cnc(C(C)(C)C)s2)cc1)[C@@H]1CCCN(C)C1 ZINC000559996664 944119935 /nfs/dbraw/zinc/11/99/35/944119935.db2.gz OESDXXHGENXAPH-GOSISDBHSA-N 0 3 400.592 4.219 20 0 HIADHN FC(F)(F)c1cccc([C@H](NCc2cnc(N3CCCC3)nc2)C2CCOCC2)c1 ZINC000560094209 944156715 /nfs/dbraw/zinc/15/67/15/944156715.db2.gz LKTXMAPBCRPGFH-HXUWFJFHSA-N 0 3 420.479 4.353 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)Cc2sc(C)nc2-c2ccc(C)cc2)cc1 ZINC000560247759 944206194 /nfs/dbraw/zinc/20/61/94/944206194.db2.gz BOKPLJBKZKLXCT-NRFANRHFSA-N 0 3 423.582 4.397 20 0 HIADHN COCc1c(C(=O)N[C@H](CN(C)C)c2ccc(OC)cc2)sc2cccc(F)c21 ZINC000560252072 944207462 /nfs/dbraw/zinc/20/74/62/944207462.db2.gz UNFSYVHEJJFKEE-GOSISDBHSA-N 0 3 416.518 4.228 20 0 HIADHN C[C@H](N[C@H](c1cncc(Br)c1)C1CC1)c1ccc(NS(C)(=O)=O)cc1 ZINC000560268042 944212926 /nfs/dbraw/zinc/21/29/26/944212926.db2.gz IMJOPGOGMKEGQP-SGTLLEGYSA-N 0 3 424.364 4.018 20 0 HIADHN CCc1ccccc1NC(=O)C[C@H](C)N[C@@H](C)c1ccc(S(=O)(=O)CC)cc1 ZINC000560270335 944214993 /nfs/dbraw/zinc/21/49/93/944214993.db2.gz METTZPIKTSSHPL-IRXDYDNUSA-N 0 3 402.560 4.111 20 0 HIADHN O[C@@H](CNCc1cc(Cl)c2c(c1)OCCCO2)CO[C@H]1CCCc2ccccc21 ZINC000560455062 944232932 /nfs/dbraw/zinc/23/29/32/944232932.db2.gz ULFXLGOYWGARNZ-RXVVDRJESA-N 0 3 417.933 4.046 20 0 HIADHN COc1cccc(Oc2ccc(CN[C@@H](C)c3ccccc3-n3ccnn3)cn2)c1 ZINC000560531510 944244667 /nfs/dbraw/zinc/24/46/67/944244667.db2.gz ACIRTPQOWQFROE-KRWDZBQOSA-N 0 3 401.470 4.314 20 0 HIADHN C[C@H](NCc1ccc(NC(=O)c2ccc(F)cc2)cc1)c1ccc2c(c1)OCC(=O)N2 ZINC000560531065 944244815 /nfs/dbraw/zinc/24/48/15/944244815.db2.gz YNJXDPMYLQAVAX-HNNXBMFYSA-N 0 3 419.456 4.260 20 0 HIADHN Cc1cccc(CCCN[C@@H](c2ccc(F)cc2)c2cccc(S(C)(=O)=O)c2)n1 ZINC000560569352 944257063 /nfs/dbraw/zinc/25/70/63/944257063.db2.gz CSFAPAYJGCCANB-QHCPKHFHSA-N 0 3 412.530 4.244 20 0 HIADHN CSC[C@@H](NCCn1cc(Br)cn1)c1ccc(C(F)(F)F)cc1 ZINC000560579594 944262100 /nfs/dbraw/zinc/26/21/00/944262100.db2.gz CFOGURLAXMLMFK-CQSZACIVSA-N 0 3 408.287 4.358 20 0 HIADHN C[C@@H](CC(=O)NCCc1ccccc1)N[C@H](CCO)c1ccc(Cl)c(Cl)c1 ZINC000560584296 944263472 /nfs/dbraw/zinc/26/34/72/944263472.db2.gz CVQPTBFRYCDJLK-MGPUTAFESA-N 0 3 409.357 4.144 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)C1CCC(OC(F)F)CC1 ZINC000560597837 944268679 /nfs/dbraw/zinc/26/86/79/944268679.db2.gz NOEYSMZJMDEKFM-JLAWEPINSA-N 0 3 418.488 4.067 20 0 HIADHN CN(CCCN(C)C(=O)[C@H]1C[C@H]1c1ccccc1OC(F)(F)F)Cc1ccncc1 ZINC000560596296 944268705 /nfs/dbraw/zinc/26/87/05/944268705.db2.gz MSBXHNWPCGMULD-OALUTQOASA-N 0 3 421.463 4.064 20 0 HIADHN COc1cccc(CCC(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)c1F ZINC000560598392 944269743 /nfs/dbraw/zinc/26/97/43/944269743.db2.gz PYJQAFFYXYXGRT-FQEVSTJZSA-N 0 3 422.504 4.049 20 0 HIADHN CC(=O)Nc1ccc(OC[C@H](O)CN(Cc2ccccc2Cl)C2CCCC2)cc1 ZINC000560684631 944294770 /nfs/dbraw/zinc/29/47/70/944294770.db2.gz SSZDGHBSHVJIKG-OAQYLSRUSA-N 0 3 416.949 4.483 20 0 HIADHN CC(=O)Nc1ccc(OC[C@@H](O)CN(Cc2ccccc2Cl)C2CCCC2)cc1 ZINC000560684628 944294820 /nfs/dbraw/zinc/29/48/20/944294820.db2.gz SSZDGHBSHVJIKG-NRFANRHFSA-N 0 3 416.949 4.483 20 0 HIADHN Cc1cc(Br)ccc1NC(=O)CN[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000560890995 944365723 /nfs/dbraw/zinc/36/57/23/944365723.db2.gz HFEWZRBYIZRJML-QFBILLFUSA-N 0 3 416.363 4.121 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)c1ccc(-c2ccccn2)[nH]c1=O)c1ccc(Cl)cc1 ZINC000560967634 944378374 /nfs/dbraw/zinc/37/83/74/944378374.db2.gz XUNCHEKFZXKODH-NRFANRHFSA-N 0 3 424.932 4.316 20 0 HIADHN CO[C@@H]1CCC[C@H](C(=O)N(Cc2ccncc2)[C@@H]2CCCN(Cc3ccccc3)C2)C1 ZINC000561076776 944432533 /nfs/dbraw/zinc/43/25/33/944432533.db2.gz YIAZXBCGUUDNDV-ISJGIBHGSA-N 0 3 421.585 4.280 20 0 HIADHN COC(=O)c1ccccc1CC1CCN(C(=O)c2cccc(CN3CCCC3)c2)CC1 ZINC000561111214 944459116 /nfs/dbraw/zinc/45/91/16/944459116.db2.gz KQFBBPJJMDQJKL-UHFFFAOYSA-N 0 3 420.553 4.164 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)c1ccccc1SCc1nc(C)no1 ZINC000561267308 944534628 /nfs/dbraw/zinc/53/46/28/944534628.db2.gz BZDYPWLLBVQFPE-UHFFFAOYSA-N 0 3 402.564 4.008 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)c1cccnc1SCc1cc(C)on1 ZINC000561268549 944534763 /nfs/dbraw/zinc/53/47/63/944534763.db2.gz PFZAZOLGHXONIO-UHFFFAOYSA-N 0 3 402.564 4.008 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)Cc1c(C)nn(-c2ccc(F)cc2)c1C)c1ccco1 ZINC000561370776 944564953 /nfs/dbraw/zinc/56/49/53/944564953.db2.gz ZGLDPBKEVUQRFX-QVKFZJNVSA-N 0 3 412.509 4.009 20 0 HIADHN O=C(Nc1ccc2nc(C(F)F)sc2c1)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000561389924 944574479 /nfs/dbraw/zinc/57/44/79/944574479.db2.gz GOHAYXRLBIDIRZ-CQSZACIVSA-N 0 3 402.470 4.480 20 0 HIADHN COc1ccc(OC)c([C@H](C)NC(=O)[C@H](C)N2C[C@@H](c3ccc(F)cc3)C[C@H]2C)c1 ZINC000561391290 944574523 /nfs/dbraw/zinc/57/45/23/944574523.db2.gz AQPUMWVHQOMUSD-DFEOGRTESA-N 0 3 414.521 4.287 20 0 HIADHN COc1cc(-c2noc([C@H]3CN(Cc4ccccc4)CCC3(F)F)n2)cc(C)n1 ZINC000561392176 944575400 /nfs/dbraw/zinc/57/54/00/944575400.db2.gz VYVVTRSDIWMALQ-QGZVFWFLSA-N 0 3 400.429 4.073 20 0 HIADHN CCN(CC)CCN(Cc1cccs1)S(=O)(=O)c1ccc(C(F)F)cc1 ZINC000561476593 944622383 /nfs/dbraw/zinc/62/23/83/944622383.db2.gz DTOROFLDXJCSLZ-UHFFFAOYSA-N 0 3 402.532 4.218 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)NCc2c(F)cccc2N2CCCC2)C1 ZINC000561506546 944642155 /nfs/dbraw/zinc/64/21/55/944642155.db2.gz SAYJTDBQAIXBDE-UYAOXDASSA-N 0 3 410.537 4.061 20 0 HIADHN COC(=O)[C@H](C)Oc1ccc(CNC2(c3cccc(Br)c3)CC2)cc1 ZINC000561522372 944653360 /nfs/dbraw/zinc/65/33/60/944653360.db2.gz GSFWYWDCNLTSAZ-AWEZNQCLSA-N 0 3 404.304 4.168 20 0 HIADHN CC(=O)Nc1ccc(Cl)c(NC(=O)N[C@H]2CCN(Cc3ccccc3)[C@H]2C)c1 ZINC000561591113 944693983 /nfs/dbraw/zinc/69/39/83/944693983.db2.gz QOLCPJHDZMBYFS-LIRRHRJNSA-N 0 3 400.910 4.083 20 0 HIADHN CN(C)CCn1nccc1NC(=O)CCc1c2cc(F)ccc2[nH]c1-c1ccccc1 ZINC000561607767 944703749 /nfs/dbraw/zinc/70/37/49/944703749.db2.gz OIEDWRHRQUYRPE-UHFFFAOYSA-N 0 3 419.504 4.303 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)CSc1ncnc2sc(C)c(C)c21)c1ccco1 ZINC000561610315 944705913 /nfs/dbraw/zinc/70/59/13/944705913.db2.gz KLSWZPPGSUMBPM-SWLSCSKDSA-N 0 3 418.588 4.239 20 0 HIADHN CN(C)C[C@@H](NC(=O)Cc1ccc(NC(=O)CC(C)(C)C)cc1)c1ccc(F)cc1 ZINC000561616063 944709642 /nfs/dbraw/zinc/70/96/42/944709642.db2.gz YOMPQIFYKNGPTP-OAQYLSRUSA-N 0 3 413.537 4.162 20 0 HIADHN CC(=O)Nc1cc(C(=O)N[C@H]2CCN(Cc3ccccc3)[C@H]2C)cc(C(F)(F)F)c1 ZINC000561624122 944713557 /nfs/dbraw/zinc/71/35/57/944713557.db2.gz LHADDBNBNNMOKE-XOBRGWDASA-N 0 3 419.447 4.057 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)[C@H]2C[C@@H]2c2cc(F)c(F)c(F)c2)N(C)C)cc1 ZINC000561650629 944727092 /nfs/dbraw/zinc/72/70/92/944727092.db2.gz JNXKCVSBDVRYLV-LQWHRVPQSA-N 0 3 420.475 4.414 20 0 HIADHN COc1ccc2c(CC(=O)NC[C@@H](c3ccc(OC(C)C)cc3)N(C)C)coc2c1 ZINC000561650486 944727132 /nfs/dbraw/zinc/72/71/32/944727132.db2.gz CJRBTHVKMMUCDE-QFIPXVFZSA-N 0 3 410.514 4.190 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)c2ccc(-c3cncnc3)cc2F)N(C)C)cc1 ZINC000561681191 944744365 /nfs/dbraw/zinc/74/43/65/944744365.db2.gz FSVMRCCHADVWEI-HSZRJFAPSA-N 0 3 422.504 4.103 20 0 HIADHN CC(C)Cc1ccc([C@@H](CNC(=O)c2ccc(C(F)(F)F)[nH]c2=O)N(C)C)cc1 ZINC000561711007 944758006 /nfs/dbraw/zinc/75/80/06/944758006.db2.gz YULADMZCGONZQS-QGZVFWFLSA-N 0 3 409.452 4.037 20 0 HIADHN Cc1oc(-c2ccco2)nc1CC(=O)NC[C@@H](c1ccc(CC(C)C)cc1)N(C)C ZINC000561718158 944761873 /nfs/dbraw/zinc/76/18/73/944761873.db2.gz WJVOEGNLYNPJDA-NRFANRHFSA-N 0 3 409.530 4.403 20 0 HIADHN Cc1nc(-c2cccc(C(F)(F)F)c2)[nH]c1C(=O)N1CCN([C@@H]2C[C@H]2C)C[C@@H](C)C1 ZINC000561761325 944783285 /nfs/dbraw/zinc/78/32/85/944783285.db2.gz FVGCWTPRZKUPMU-HBUWYVDXSA-N 0 3 420.479 4.206 20 0 HIADHN Cc1nc(-c2cccc(C(F)(F)F)c2)[nH]c1C(=O)N1CCN([C@@H]2C[C@H]2C)C[C@H](C)C1 ZINC000561761326 944783585 /nfs/dbraw/zinc/78/35/85/944783585.db2.gz FVGCWTPRZKUPMU-PMUMKWKESA-N 0 3 420.479 4.206 20 0 HIADHN C[C@H]1C[C@H]1N1CCN(C(=O)c2cccc(-c3noc(CC(C)(C)C)n3)c2)C[C@@H](C)C1 ZINC000561761968 944784921 /nfs/dbraw/zinc/78/49/21/944784921.db2.gz PBALVGDGKZEISJ-ABSDTBQOSA-N 0 3 410.562 4.128 20 0 HIADHN CC(C)Oc1ccc(-c2nc(C(=O)N3CCN([C@@H]4C[C@H]4C)C[C@H](C)C3)cs2)cc1 ZINC000561762238 944785486 /nfs/dbraw/zinc/78/54/86/944785486.db2.gz LOELSVJPCCQDDL-CSODHUTKSA-N 0 3 413.587 4.400 20 0 HIADHN CN(C(=O)c1cc(-c2ccc(F)cc2)nc2onc(C3CC3)c21)[C@@H]1CCN(C2CC2)C1 ZINC000561862635 944825157 /nfs/dbraw/zinc/82/51/57/944825157.db2.gz JIQFNUHPRBJSAV-GOSISDBHSA-N 0 3 420.488 4.215 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)N1CCC(c2nc(C)no2)CC1)c1ccc(Cl)cc1 ZINC000561875103 944832487 /nfs/dbraw/zinc/83/24/87/944832487.db2.gz BFTWUAHTTPPSMR-IBGZPJMESA-N 0 3 419.957 4.004 20 0 HIADHN O=C([C@H]1CCCN(Cc2cccnc2)C1)N1CC[C@H](Sc2cccc(Cl)c2)C1 ZINC000561888119 944838415 /nfs/dbraw/zinc/83/84/15/944838415.db2.gz ORUXIALLVJPLBL-RXVVDRJESA-N 0 3 415.990 4.340 20 0 HIADHN Cc1cc(C(=O)N(C)CCCN(C)Cc2ccncc2)cc(Cl)c1Br ZINC000561970637 944881272 /nfs/dbraw/zinc/88/12/72/944881272.db2.gz BXQBBKLGPAPLHP-UHFFFAOYSA-N 0 3 424.770 4.400 20 0 HIADHN Cc1ccncc1CCCN(CCn1ccnc1)Cc1ccc(Br)o1 ZINC000561980687 944884552 /nfs/dbraw/zinc/88/45/52/944884552.db2.gz IKRQPGXHNJLIRT-UHFFFAOYSA-N 0 3 403.324 4.077 20 0 HIADHN c1ccc(CCCOc2cccc(CNCc3ccnc(N4CCOCC4)c3)c2)cc1 ZINC000562075488 944924729 /nfs/dbraw/zinc/92/47/29/944924729.db2.gz QDVZWHGTPIYLBM-UHFFFAOYSA-N 0 3 417.553 4.220 20 0 HIADHN CC(=O)NC1CCC(N[C@H](C)c2ccc(Br)cc2Br)CC1 ZINC000562088118 944931164 /nfs/dbraw/zinc/93/11/64/944931164.db2.gz XXIKRWXTKQUWSR-GWMXKSKGSA-N 0 3 418.173 4.310 20 0 HIADHN OCc1cn(CCCN[C@H](c2ccccc2Cl)c2cccc3ccccc32)nn1 ZINC000562090552 944933637 /nfs/dbraw/zinc/93/36/37/944933637.db2.gz JAAIYSPIOCPNHB-QHCPKHFHSA-N 0 3 406.917 4.346 20 0 HIADHN COc1ccc2c(c1)[C@H](NCc1cccc(N3C(=O)NC4(CCCC4)C3=O)c1)CCC2 ZINC000562098181 944937297 /nfs/dbraw/zinc/93/72/97/944937297.db2.gz VHYBBYUJSASAQX-JOCHJYFZSA-N 0 3 419.525 4.231 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)Nc2cccc(N3CCCC3)c2)N(C)C)cc1 ZINC000562128066 944958888 /nfs/dbraw/zinc/95/88/88/944958888.db2.gz OFJGIJLWNWOXMC-HSZRJFAPSA-N 0 3 410.562 4.498 20 0 HIADHN Cc1cc(N2CCSCC2)ccc1NC(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C ZINC000562141876 944970928 /nfs/dbraw/zinc/97/09/28/944970928.db2.gz HGHKCVJIRPFRTH-AVRDEDQJSA-N 0 3 412.603 4.361 20 0 HIADHN COC(C)(C)c1nc(C)c(C(=O)N[C@@H](CN(C)Cc2ccccc2)C(C)C)s1 ZINC000562170479 944998710 /nfs/dbraw/zinc/99/87/10/944998710.db2.gz FWNPCZZRWFRDLI-SFHVURJKSA-N 0 3 403.592 4.219 20 0 HIADHN C[C@H](N[C@@H]1CCN(C)[C@@H]1c1ccc(Cl)c(F)c1)C(=O)Nc1ccccc1Cl ZINC000564069877 945371153 /nfs/dbraw/zinc/37/11/53/945371153.db2.gz KKGVNRUCNVSGSH-GESALYCCSA-N 0 3 410.320 4.495 20 0 HIADHN CCS(=O)(=O)N1CCC([C@H](C)N(C)Cc2nc(-c3ccc(C)cc3)cs2)CC1 ZINC000564153504 945402750 /nfs/dbraw/zinc/40/27/50/945402750.db2.gz UCIFBQVYXHNRJT-KRWDZBQOSA-N 0 3 421.632 4.001 20 0 HIADHN CCc1nnc(-c2ccc(NC(=O)N[C@H]3CCN(Cc4ccccc4)[C@@H]3C)cc2)o1 ZINC000564165773 945411605 /nfs/dbraw/zinc/41/16/05/945411605.db2.gz NSAVMZHULBGTDX-UZLBHIALSA-N 0 3 405.502 4.084 20 0 HIADHN CCN(CCOC)c1cccc(CN2CCC[C@@H](c3nc4ccc(F)cc4o3)C2)n1 ZINC000564316036 945512818 /nfs/dbraw/zinc/51/28/18/945512818.db2.gz UJJKOMFCACKDOY-QGZVFWFLSA-N 0 3 412.509 4.214 20 0 HIADHN Cc1c(C(=O)N[C@H](CN(C)C)c2ccc(F)cc2)cnn1-c1ccc(Cl)cc1 ZINC000564360747 945527897 /nfs/dbraw/zinc/52/78/97/945527897.db2.gz AXYCUSWNAKRSBU-HXUWFJFHSA-N 0 3 400.885 4.006 20 0 HIADHN CCc1ccc([C@H](C)NC(=O)[C@H](C)N[C@@H]2c3ccccc3CC23CCOCC3)cc1 ZINC000564407373 945560421 /nfs/dbraw/zinc/56/04/21/945560421.db2.gz CRBVLYGRFBFCEM-AXHZCLLHSA-N 0 3 406.570 4.499 20 0 HIADHN COc1ccc(-c2ocnc2C(=O)NC[C@@H](c2ccc(SC)cc2)N(C)C)cc1 ZINC000564484975 945616112 /nfs/dbraw/zinc/61/61/12/945616112.db2.gz AHTGVNKKRQDISI-IBGZPJMESA-N 0 3 411.527 4.105 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1ccc2c(c1)CCCCC2=O ZINC000564527757 945654470 /nfs/dbraw/zinc/65/44/70/945654470.db2.gz DRTORNCOYMUZGL-UHFFFAOYSA-N 0 3 408.464 4.131 20 0 HIADHN C[C@@H]1C[C@@H](Nc2ccc(-n3ncc(Cl)c(Cl)c3=O)cc2Cl)CN1C1CC1 ZINC000564567987 945681643 /nfs/dbraw/zinc/68/16/43/945681643.db2.gz NGRGGPPONPNLHR-GHMZBOCLSA-N 0 3 413.736 4.230 20 0 HIADHN CC[C@@H]1C[C@@H](C(=O)N(Cc2ccccc2Br)C2CCN(C)CC2)CCO1 ZINC000564590973 945691611 /nfs/dbraw/zinc/69/16/11/945691611.db2.gz QRZGZROGCILIHV-QFBILLFUSA-N 0 3 423.395 4.077 20 0 HIADHN COc1ccc([C@@H]2CCCCCN2C(=O)CN[C@H]2CCN(C)[C@H]2c2ccccc2)cc1 ZINC000564760059 945752325 /nfs/dbraw/zinc/75/23/25/945752325.db2.gz ICXBHBKVZHSKAM-GNKBHMEESA-N 0 3 421.585 4.174 20 0 HIADHN NC(=O)[C@H]1CCCN(Cc2ccccc2NC(=O)c2ccc(C3CCCC3)cc2)C1 ZINC000565632359 945859897 /nfs/dbraw/zinc/85/98/97/945859897.db2.gz YSRQEITYXHRALK-QFIPXVFZSA-N 0 3 405.542 4.294 20 0 HIADHN CN(C)S(=O)(=O)c1ccc(CN[C@H](Cc2ccc(F)cc2)c2ccccc2)cc1 ZINC000565648496 945861005 /nfs/dbraw/zinc/86/10/05/945861005.db2.gz IBJUYPANIMTHJD-HSZRJFAPSA-N 0 3 412.530 4.150 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)c1ccc(NC(=O)c2ccccc2)cc1)c1ccco1 ZINC000565679162 945865737 /nfs/dbraw/zinc/86/57/37/945865737.db2.gz QZJRFMUARLQKAT-LAUBAEHRSA-N 0 3 405.498 4.391 20 0 HIADHN Cc1ccc(C(=O)N[C@H]2CCN(Cc3ccccc3)[C@@H]2C)cc1NC(=O)c1ccco1 ZINC000565971074 945949684 /nfs/dbraw/zinc/94/96/84/945949684.db2.gz FQIUEQZTKUSPFI-NQIIRXRSSA-N 0 3 417.509 4.233 20 0 HIADHN CCCN(C)[C@H](CNC(=O)N[C@@H](C)c1ccncc1OC)c1ccc(Cl)cc1 ZINC000566553835 946039617 /nfs/dbraw/zinc/03/96/17/946039617.db2.gz YGESXGSFHZBPJG-HNAYVOBHSA-N 0 3 404.942 4.187 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)Nc2ccccc2O[C@H](C)C(F)(F)F)CC1 ZINC000566624935 946057215 /nfs/dbraw/zinc/05/72/15/946057215.db2.gz PWRDHXBSGYYELN-OAHLLOKOSA-N 0 3 417.472 4.027 20 0 HIADHN CSc1ccc([C@H](CNC(=O)c2csc(Nc3ccccn3)n2)N(C)C)cc1 ZINC000566640790 946060049 /nfs/dbraw/zinc/06/00/49/946060049.db2.gz FUZIMTYWBDHJIP-KRWDZBQOSA-N 0 3 413.572 4.036 20 0 HIADHN C[C@H](C(=O)N(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1)c1cccnc1 ZINC000566847876 946130779 /nfs/dbraw/zinc/13/07/79/946130779.db2.gz YWBNURWRRKHLKH-SQJMNOBHSA-N 0 3 414.553 4.274 20 0 HIADHN Cc1n[nH]c(C)c1CCC(=O)N1CCN(CCCc2ccccc2)C[C@@H]1CC(C)C ZINC000566874028 946141738 /nfs/dbraw/zinc/14/17/38/946141738.db2.gz XELDGENIISWOKR-QHCPKHFHSA-N 0 3 410.606 4.151 20 0 HIADHN CCc1cccc(C)c1NC(=O)CN[C@@H]1CCN(C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000566885167 946154421 /nfs/dbraw/zinc/15/44/21/946154421.db2.gz ZLUDXHAVZXKLDZ-DENIHFKCSA-N 0 3 403.929 4.323 20 0 HIADHN CN(C)Cc1ccc(-c2noc([C@@H]3CCCN3c3ncnc4sccc43)n2)cc1 ZINC000566998942 946209830 /nfs/dbraw/zinc/20/98/30/946209830.db2.gz ZSRKIZQSQQMZKV-KRWDZBQOSA-N 0 3 406.515 4.144 20 0 HIADHN COc1cc(Br)ccc1OC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000567002420 946212199 /nfs/dbraw/zinc/21/21/99/946212199.db2.gz PETRLYVODRVPKN-GOSISDBHSA-N 0 3 406.320 4.128 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@@H](O)C2)c1)c1ccc2[nH]c3c(c2c1)CCCCC3 ZINC000567102722 946243117 /nfs/dbraw/zinc/24/31/17/946243117.db2.gz WZAZVIBBWGXLHN-HXUWFJFHSA-N 0 3 403.526 4.256 20 0 HIADHN CCCC[C@@H](C)N(C)CC(=O)N(Cc1nnc(-c2ccccc2Cl)o1)C1CC1 ZINC000567314713 946308885 /nfs/dbraw/zinc/30/88/85/946308885.db2.gz RBCDAWCFKSGWTJ-OAHLLOKOSA-N 0 3 404.942 4.392 20 0 HIADHN CC(C)OC(=O)c1ccc(NC(=O)[C@H](C)N[C@@H](C[C@@H]2CCOC2)c2ccccc2)cc1 ZINC000567335425 946313977 /nfs/dbraw/zinc/31/39/77/946313977.db2.gz PBNFKVBWQQEMJZ-YDHSSHFGSA-N 0 3 424.541 4.336 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)Nc1ccc(CN(C(C)=O)C2CC2)cc1)c1ccco1 ZINC000567480238 946346539 /nfs/dbraw/zinc/34/65/39/946346539.db2.gz ABDYWLFPYBVFOA-IERDGZPVSA-N 0 3 412.534 4.041 20 0 HIADHN C[C@H](c1ccccc1)N(C)C(=O)CN[C@@H]1CCN(C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000567548924 946373093 /nfs/dbraw/zinc/37/30/93/946373093.db2.gz YXAYGZXLJSWUSI-RBQRDFNRSA-N 0 3 403.929 4.034 20 0 HIADHN CC[C@H](NCc1cccc(N2C(=O)NC3(CCCC3)C2=O)c1)c1cccc(OC)c1 ZINC000567799740 946414880 /nfs/dbraw/zinc/41/48/80/946414880.db2.gz DCQACSFJURSFRD-NRFANRHFSA-N 0 3 407.514 4.305 20 0 HIADHN CCn1nccc1N1CCC[C@H](NC/C(C)=C/c2cccc(C(F)(F)F)c2)C1=O ZINC000568132109 946473833 /nfs/dbraw/zinc/47/38/33/946473833.db2.gz LEFUDGVHQWNKCS-XOVFHRFOSA-N 0 3 406.452 4.110 20 0 HIADHN Cc1ccccc1NC(=O)[C@H](C)N[C@@H]1CCN(C(C)C)[C@H]1c1ccc(F)c(F)c1 ZINC000568416830 946531933 /nfs/dbraw/zinc/53/19/33/946531933.db2.gz JOGLMNVUOPWTLB-USCONSEESA-N 0 3 401.501 4.414 20 0 HIADHN COc1c(F)cc(NC(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)cc1F ZINC000568429167 946541099 /nfs/dbraw/zinc/54/10/99/946541099.db2.gz FWEROIWHUCEPEY-IBGZPJMESA-N 0 3 407.461 4.185 20 0 HIADHN CC(C)Cn1cc(NC(=O)N[C@H]2CCN(Cc3ccccc3)[C@H]2C)c(C(F)F)n1 ZINC000568524647 946576959 /nfs/dbraw/zinc/57/69/59/946576959.db2.gz APRZCTCNCGOCOX-RDJZCZTQSA-N 0 3 405.493 4.261 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)Nc3ccnc4ccc(Oc5ccccc5)cc43)[C@@H]2C1 ZINC000568803557 946702295 /nfs/dbraw/zinc/70/22/95/946702295.db2.gz RVNQKQUEEZDSDD-GAJHUEQPSA-N 0 3 402.498 4.007 20 0 HIADHN C[C@@H](NC[C@H](Cc1ccccc1)C(F)(F)F)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000568805861 946704791 /nfs/dbraw/zinc/70/47/91/946704791.db2.gz CAQCXRXJGCAPDI-CJNGLKHVSA-N 0 3 403.441 4.301 20 0 HIADHN COc1ccccc1[C@@H](CC(C)C)N[C@@H]1CCCc2cc(S(N)(=O)=O)ccc21 ZINC000568908024 946745417 /nfs/dbraw/zinc/74/54/17/946745417.db2.gz QNWIMHTYOVXLIC-NHCUHLMSSA-N 0 3 402.560 4.097 20 0 HIADHN COc1cccc(OC)c1OCCCCN1CCN(c2ccc3ccccc3n2)CC1 ZINC000569167396 946830378 /nfs/dbraw/zinc/83/03/78/946830378.db2.gz YXWMIENNSMTIBY-UHFFFAOYSA-N 0 3 421.541 4.233 20 0 HIADHN COc1ccc(C[C@@](C)(O)CNCc2ccc(F)c(Cl)c2Cl)cc1OC ZINC000569395816 946866144 /nfs/dbraw/zinc/86/61/44/946866144.db2.gz LVVJTUIEYGYTNP-LJQANCHMSA-N 0 3 402.293 4.233 20 0 HIADHN COc1ccc([C@H](C)NC[C@@H](c2c(F)cccc2Cl)N2CCO[C@@H](C)C2)cc1O ZINC000569512799 946883216 /nfs/dbraw/zinc/88/32/16/946883216.db2.gz HRFBESDVEOWZSQ-DOXZYTNZSA-N 0 3 422.928 4.306 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2ccc(SC)cc2OC)c1 ZINC000569553071 946890080 /nfs/dbraw/zinc/89/00/80/946890080.db2.gz SEHRWBBNGGUUKO-UHFFFAOYSA-N 0 3 403.548 4.021 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)C(C)(C)c2csc(-c3cc(F)ccc3F)n2)CN1C1CC1 ZINC000569631244 946906127 /nfs/dbraw/zinc/90/61/27/946906127.db2.gz FFVMBJOGASDXON-GXTWGEPZSA-N 0 3 405.514 4.107 20 0 HIADHN C[C@H](NCCNc1ccc2ccccc2n1)c1ccc(S(=O)(=O)C2CCCC2)cc1 ZINC000569636757 946912319 /nfs/dbraw/zinc/91/23/19/946912319.db2.gz SPVLPMHRTITLAU-SFHVURJKSA-N 0 3 423.582 4.714 20 0 HIADHN CN(CCCN(C)C(=O)C(C)(C)c1ccc(Br)cc1)Cc1ccncc1 ZINC000569643643 946916499 /nfs/dbraw/zinc/91/64/99/946916499.db2.gz QAGXFCDHFKIGNQ-UHFFFAOYSA-N 0 3 418.379 4.102 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)CSc1cccc(Br)c1)c1ccco1 ZINC000569842522 947017701 /nfs/dbraw/zinc/01/77/01/947017701.db2.gz KGCKOCAUOPYSJE-CZUORRHYSA-N 0 3 411.365 4.380 20 0 HIADHN C[C@@H](NC(=O)N1CCC(OCC2CCCCC2)CC1)[C@H](c1ccccc1)N(C)C ZINC000569998887 947066953 /nfs/dbraw/zinc/06/69/53/947066953.db2.gz KBYMHVWPBOBMQT-AUSIDOKSSA-N 0 3 401.595 4.449 20 0 HIADHN C[C@H](c1ccc(F)cc1)N1CCC[C@H](N[C@@H](C)c2ccc3c(c2)OCCCO3)C1=O ZINC000570111089 947096509 /nfs/dbraw/zinc/09/65/09/947096509.db2.gz IBERXOWWFISPEG-FVJLSDCUSA-N 0 3 412.505 4.390 20 0 HIADHN C[C@H](N[C@@H]1CCCN([C@@H](C)c2ccc(F)cc2)C1=O)c1ccc2c(c1)OCCCO2 ZINC000570111090 947096551 /nfs/dbraw/zinc/09/65/51/947096551.db2.gz IBERXOWWFISPEG-XGHQBKJUSA-N 0 3 412.505 4.390 20 0 HIADHN CC[C@@H](c1ccccc1)N1CC(=O)N(C2CC(N3CCC(C(F)(F)F)CC3)C2)C1=O ZINC000570116059 947098366 /nfs/dbraw/zinc/09/83/66/947098366.db2.gz ZODQNBNZTCUYOV-ACBHZAAOSA-N 0 3 423.479 4.207 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@H](C)C1NS(=O)(=O)c1ccc(C(F)F)cc1 ZINC000570116062 947098644 /nfs/dbraw/zinc/09/86/44/947098644.db2.gz UFUOYCCKPTUBFL-HOTGVXAUSA-N 0 3 408.514 4.059 20 0 HIADHN Cc1csc(NC(=O)CN[C@@H](c2cccc(C(F)(F)F)c2)C2CCOCC2)n1 ZINC000570230442 947153794 /nfs/dbraw/zinc/15/37/94/947153794.db2.gz CSJDREAVCJKWKM-QGZVFWFLSA-N 0 3 413.465 4.166 20 0 HIADHN CC(C)(C)C[C@H](O)CC(=O)N(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000570234493 947156449 /nfs/dbraw/zinc/15/64/49/947156449.db2.gz XLTJPQJSPJUJNA-DNQXCXABSA-N 0 3 423.601 4.262 20 0 HIADHN CC(=O)Nc1ccc([C@@H](C)NCc2ccc(OCCOc3ccccc3)nc2)cc1 ZINC000570238177 947160166 /nfs/dbraw/zinc/16/01/66/947160166.db2.gz RHZVDGNHNWYTIF-GOSISDBHSA-N 0 3 405.498 4.349 20 0 HIADHN COc1cc(CN(CCO)[C@@H]2CCCc3ccccc32)cc(OC)c1OCC(F)F ZINC000570247510 947167807 /nfs/dbraw/zinc/16/78/07/947167807.db2.gz GHNFVKNEFAPTBC-LJQANCHMSA-N 0 3 421.484 4.220 20 0 HIADHN C[C@]1(C2CC2)NC(=O)N(c2cccc(CN[C@@H](c3ccc(F)cc3)C3CC3)c2)C1=O ZINC000570299061 947182935 /nfs/dbraw/zinc/18/29/35/947182935.db2.gz CUXGZDFWVQILLO-ZJSXRUAMSA-N 0 3 407.489 4.292 20 0 HIADHN CCCN(C)[C@H](CNC(=O)N1CCC2(CCOCC2)[C@@H]1C)c1ccc(Cl)cc1 ZINC000570433443 947243948 /nfs/dbraw/zinc/24/39/48/947243948.db2.gz OGVRGYFDNZFULG-FXAWDEMLSA-N 0 3 407.986 4.324 20 0 HIADHN Cc1ccc(C)c(NC(=O)[C@H](C)N[C@H]2CCN(C)[C@@H]2c2ccc(Cl)c(F)c2)c1 ZINC000570438503 947247761 /nfs/dbraw/zinc/24/77/61/947247761.db2.gz HQTFCJILKHFELB-PAXLWEDBSA-N 0 3 403.929 4.458 20 0 HIADHN CCOc1ccc(NC(=O)CN[C@@H]2c3ccccc3CC23CCOCC3)cc1OCC ZINC000570731841 947338992 /nfs/dbraw/zinc/33/89/92/947338992.db2.gz VOYXIPCPWWQIMZ-XMMPIXPASA-N 0 3 424.541 4.106 20 0 HIADHN CCOC(=O)[C@H]1CC[C@H](NCc2cc(Cl)c3c(c2)OCCO3)c2ccccc21 ZINC000570855909 947370980 /nfs/dbraw/zinc/37/09/80/947370980.db2.gz SRAVNQYAYNPDCA-HKUYNNGSSA-N 0 3 401.890 4.383 20 0 HIADHN Cn1cncc1CN[C@H]1CCCc2nc(-c3ccc(Br)cc3)sc21 ZINC000570888793 947385916 /nfs/dbraw/zinc/38/59/16/947385916.db2.gz CHHZNMAMRVCHBD-HNNXBMFYSA-N 0 3 403.349 4.473 20 0 HIADHN Cc1nn(C)c2sc([C@H](C)N[C@@H]3CCCN([C@@H](C)c4ccccc4F)C3=O)cc12 ZINC000571067150 947465851 /nfs/dbraw/zinc/46/58/51/947465851.db2.gz MSKBSOOUPAJYNC-YZVOILCLSA-N 0 3 414.550 4.485 20 0 HIADHN CC1(C)CN(c2nnc(C3CCCC3)n2C[C@@H]2CCOC2)CCN1Cc1ccccc1 ZINC000571180622 947533017 /nfs/dbraw/zinc/53/30/17/947533017.db2.gz KNFNZHDGDQNYGB-NRFANRHFSA-N 0 3 423.605 4.073 20 0 HIADHN CN(C)C[C@@H](NC(=O)Nc1cccc(C[S@](=O)C(C)(C)C)c1)c1ccc(F)cc1 ZINC000571311543 947591518 /nfs/dbraw/zinc/59/15/18/947591518.db2.gz MVLQVIMMDPVRFP-OLILMLBXSA-N 0 3 419.566 4.297 20 0 HIADHN CN(C)C[C@@H](NC(=O)Nc1cccc(C[S@@](=O)C(C)(C)C)c1)c1ccc(F)cc1 ZINC000571311541 947591853 /nfs/dbraw/zinc/59/18/53/947591853.db2.gz MVLQVIMMDPVRFP-ACSYHNTCSA-N 0 3 419.566 4.297 20 0 HIADHN CN(C)C[C@H](NC(=O)Nc1cccc(C[S@](=O)C(C)(C)C)c1)c1ccc(F)cc1 ZINC000571311545 947592303 /nfs/dbraw/zinc/59/23/03/947592303.db2.gz MVLQVIMMDPVRFP-WRONEBCDSA-N 0 3 419.566 4.297 20 0 HIADHN CC(C)CN(C(=O)NCCCCN1CCN(C)CC1)[C@H](C)c1ccccc1Cl ZINC000571353904 947615110 /nfs/dbraw/zinc/61/51/10/947615110.db2.gz WPWJAFXJUJEXKC-LJQANCHMSA-N 0 3 409.018 4.096 20 0 HIADHN Cc1cc(Cl)ccc1NC(=O)[C@H](C)N[C@H]1CCN(C)[C@H]1c1ccc(F)c(F)c1 ZINC000571366724 947623938 /nfs/dbraw/zinc/62/39/38/947623938.db2.gz KPPHUCGUXTXJEG-MRFFXTKBSA-N 0 3 407.892 4.289 20 0 HIADHN CO[C@@H]1C[C@H](c2ccccc2)CC[C@H]1N[C@@H](C)C(=O)Nc1ccc(-c2c[nH]cn2)cc1 ZINC000571588822 947718351 /nfs/dbraw/zinc/71/83/51/947718351.db2.gz VIGBESNQBUQXOV-RAHFMFPQSA-N 0 3 418.541 4.345 20 0 HIADHN O=C(Nc1nncs1)C1CCN(Cc2ccc(Oc3cccc(F)c3)cc2)CC1 ZINC000571602424 947725530 /nfs/dbraw/zinc/72/55/30/947725530.db2.gz GIJROWIGSRDODA-UHFFFAOYSA-N 0 3 412.490 4.320 20 0 HIADHN Cc1cn(-c2ccc(F)cc2)nc1C(=O)NC[C@H](c1ccc(OC(C)C)cc1)N(C)C ZINC000571710197 947757712 /nfs/dbraw/zinc/75/77/12/947757712.db2.gz KKLZAOGKDMPBJS-JOCHJYFZSA-N 0 3 424.520 4.140 20 0 HIADHN Cc1[nH]c(=O)c(C(=O)N[C@H]2CCN(Cc3ccccc3)[C@H]2C)cc1-c1ccccc1 ZINC000571736851 947771012 /nfs/dbraw/zinc/77/10/12/947771012.db2.gz WIQVBOIMNLRWJX-MBSDFSHPSA-N 0 3 401.510 4.155 20 0 HIADHN CNS(=O)(=O)c1cccc([C@H](C)NC/C(C)=C\c2cccc(C(F)(F)F)c2)c1 ZINC000571955034 947821409 /nfs/dbraw/zinc/82/14/09/947821409.db2.gz WRJHNZOMRACECF-LTBFUDJGSA-N 0 3 412.477 4.368 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)Nc2ccc(NC(=O)c3ccco3)cc2)CCN1Cc1ccccc1 ZINC000572273127 947872981 /nfs/dbraw/zinc/87/29/81/947872981.db2.gz LBLQOXXZUKGYAT-UTKZUKDTSA-N 0 3 418.497 4.316 20 0 HIADHN Cn1c(-c2ccc3ccccc3c2)nnc1N1CCCN(Cc2ccc(C#N)cc2)CC1 ZINC000572287122 947876552 /nfs/dbraw/zinc/87/65/52/947876552.db2.gz CMWIWXCDNQKSLV-UHFFFAOYSA-N 0 3 422.536 4.219 20 0 HIADHN C[C@H](NC[C@H](c1ccccc1Cl)N1CCOCC1)c1ccc(Br)cn1 ZINC000572352448 947888891 /nfs/dbraw/zinc/88/88/91/947888891.db2.gz CEMUNJFLMZVOGV-IFXJQAMLSA-N 0 3 424.770 4.222 20 0 HIADHN C[C@@H](NC[C@@H](c1ccccc1Cl)N1CCOCC1)c1ccc(Br)cn1 ZINC000572352449 947889169 /nfs/dbraw/zinc/88/91/69/947889169.db2.gz CEMUNJFLMZVOGV-KUHUBIRLSA-N 0 3 424.770 4.222 20 0 HIADHN C[C@@H](NC(=O)c1nccnc1-c1nc2ccccc2s1)[C@@H](c1ccccc1)N(C)C ZINC000572631122 947961583 /nfs/dbraw/zinc/96/15/83/947961583.db2.gz LXLUFWQTEKCIEX-VFNWGFHPSA-N 0 3 417.538 4.175 20 0 HIADHN Cc1cc(NC(=O)C(C)(C)C)sc1C(=O)N[C@H](C)CN(C)Cc1ccccc1 ZINC000572638648 947963977 /nfs/dbraw/zinc/96/39/77/947963977.db2.gz OAOSNAAWHRAFIQ-MRXNPFEDSA-N 0 3 401.576 4.291 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)c2c(C)c(C)sc2Br)cc1 ZINC000572786746 948010483 /nfs/dbraw/zinc/01/04/83/948010483.db2.gz OEZBMKJSNYVAPS-HNNXBMFYSA-N 0 3 411.365 4.169 20 0 HIADHN CN(CCCN(C)C(=O)c1ccccc1N(C)c1ccccc1)Cc1ccncc1 ZINC000572906831 948035734 /nfs/dbraw/zinc/03/57/34/948035734.db2.gz MYIKCMHAXZOKJN-UHFFFAOYSA-N 0 3 402.542 4.444 20 0 HIADHN OC[C@]1(CNCc2cc(Cl)ccc2OC[C@@H]2CCCO2)C[C@H]1c1ccccc1 ZINC000573254787 948125870 /nfs/dbraw/zinc/12/58/70/948125870.db2.gz XQTXDBNMQZHEAK-QNWVGRARSA-N 0 3 401.934 4.154 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@H]2NC[C@H](c2ccco2)N2CCCC2)cc1 ZINC000573289167 948147060 /nfs/dbraw/zinc/14/70/60/948147060.db2.gz SDQWDTLOOMKNHZ-MQSCRBSSSA-N 0 3 416.587 4.100 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)N2CCC(C(F)(F)F)(C(F)(F)F)C2)CCN1Cc1ccccc1 ZINC000573474673 948211826 /nfs/dbraw/zinc/21/18/26/948211826.db2.gz CKPAFLBADICKEB-HIFRSBDPSA-N 0 3 423.401 4.176 20 0 HIADHN CCSc1cccc(F)c1NC(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000573647543 948266006 /nfs/dbraw/zinc/26/60/06/948266006.db2.gz GYEJKYZFVLYZDA-GOSISDBHSA-N 0 3 417.550 4.350 20 0 HIADHN Cc1cc(Br)c(C(=O)NCCCCN2C[C@@H](C)O[C@H](C)C2)cc1Cl ZINC000573705680 948277794 /nfs/dbraw/zinc/27/77/94/948277794.db2.gz GQBCSEQMDHQKKM-ZIAGYGMSSA-N 0 3 417.775 4.030 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)Nc1cc(Cl)ccc1N1CCOCC1)c1ccco1 ZINC000573751920 948289158 /nfs/dbraw/zinc/28/91/58/948289158.db2.gz OECIVWWYXDGEGB-CRAIPNDOSA-N 0 3 420.941 4.021 20 0 HIADHN Cc1nn(C(C)(C)C)c(C)c1CNc1ccc(C(=O)N(C)[C@H]2CCCN(C)C2)cc1 ZINC000573854702 948312162 /nfs/dbraw/zinc/31/21/62/948312162.db2.gz VYUPXGGZVBTURX-NRFANRHFSA-N 0 3 411.594 4.033 20 0 HIADHN CC(C)N(C)c1ccc(CNCc2cccc(-c3nc(CC(F)(F)F)no3)c2)cn1 ZINC000573886273 948320768 /nfs/dbraw/zinc/32/07/68/948320768.db2.gz JAONQMKWBKESTK-UHFFFAOYSA-N 0 3 419.451 4.371 20 0 HIADHN Cc1ccc([C@H](NCCCc2cccc(C)n2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000574062285 948355530 /nfs/dbraw/zinc/35/55/30/948355530.db2.gz PKBSDDQRKCYYKE-DEOSSOPVSA-N 0 3 408.567 4.414 20 0 HIADHN CC(C)CC(=O)N1Cc2ccccc2C[C@H]1c1nc(-c2ccc(CN(C)C)cc2)no1 ZINC000574118270 948369189 /nfs/dbraw/zinc/36/91/89/948369189.db2.gz SOOZHPORYKJHCJ-QFIPXVFZSA-N 0 3 418.541 4.470 20 0 HIADHN C[C@H](NC(=O)c1nc2ccccc2cc1Br)[C@@H](c1ccccc1)N(C)C ZINC000574117930 948369467 /nfs/dbraw/zinc/36/94/67/948369467.db2.gz WRBDCBIJKRDVTK-XOBRGWDASA-N 0 3 412.331 4.419 20 0 HIADHN C[C@H]1[C@H](NC(=O)N2CC=C(c3c[nH]c4ncccc34)CC2)CCN1Cc1ccccc1 ZINC000574306959 948407244 /nfs/dbraw/zinc/40/72/44/948407244.db2.gz NLJKUNNMDBJGLN-FDDCHVKYSA-N 0 3 415.541 4.025 20 0 HIADHN C[C@@H]1[C@H](NC(=O)N2CC=C(c3c[nH]c4ncccc34)CC2)CCN1Cc1ccccc1 ZINC000574306962 948407470 /nfs/dbraw/zinc/40/74/70/948407470.db2.gz NLJKUNNMDBJGLN-WZONZLPQSA-N 0 3 415.541 4.025 20 0 HIADHN COc1coc(CN[C@@H]2CCN(C(C)(C)C)[C@H]2c2ccc(Cl)c(F)c2)cc1=O ZINC000574341605 948416132 /nfs/dbraw/zinc/41/61/32/948416132.db2.gz CSOIYIXVMCSCGU-XLIONFOSSA-N 0 3 408.901 4.145 20 0 HIADHN CC(C)N1CC[C@H](N[C@H]2CCN(c3ccccc3F)C2=O)[C@@H]1c1ccc(F)c(F)c1 ZINC000574587758 948483985 /nfs/dbraw/zinc/48/39/85/948483985.db2.gz XZOSDKQZCBUGQU-ONTIZHBOSA-N 0 3 417.475 4.023 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NS(=O)(=O)Cc1ccc2ccccc2c1 ZINC000574606006 948490742 /nfs/dbraw/zinc/49/07/42/948490742.db2.gz AKWRJRCTXCUVOJ-CYFREDJKSA-N 0 3 408.567 4.170 20 0 HIADHN CC[C@@H](C)C(=O)Nc1cccc(CNC[C@H](O)COc2cc(C)ccc2Cl)c1 ZINC000574726135 948514141 /nfs/dbraw/zinc/51/41/41/948514141.db2.gz USEHDMLMGOAXGL-APWZRJJASA-N 0 3 404.938 4.163 20 0 HIADHN CCN(C[C@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)Cc1cccc(Cl)c1 ZINC000574789235 948526435 /nfs/dbraw/zinc/52/64/35/948526435.db2.gz LEIPFGMUYHCUKU-FQEVSTJZSA-N 0 3 406.979 4.014 20 0 HIADHN Cc1cc(C(=O)N(C)CCCN(C)Cc2ccncc2)c(C)cc1Br ZINC000574790547 948526853 /nfs/dbraw/zinc/52/68/53/948526853.db2.gz BDGLHYSYCRUZAM-UHFFFAOYSA-N 0 3 404.352 4.055 20 0 HIADHN CC[C@@H](C(=O)N1CCC(c2nnc(-c3ccccc3)[n-]2)CC1)[N@H+](C)Cc1ccccc1 ZINC000574795951 948528799 /nfs/dbraw/zinc/52/87/99/948528799.db2.gz WOKSQMHJONINRY-QFIPXVFZSA-N 0 3 417.557 4.088 20 0 HIADHN CC[C@@H](C(=O)N1CCC(c2nnc(-c3ccccc3)[n-]2)CC1)[N@@H+](C)Cc1ccccc1 ZINC000574795951 948528807 /nfs/dbraw/zinc/52/88/07/948528807.db2.gz WOKSQMHJONINRY-QFIPXVFZSA-N 0 3 417.557 4.088 20 0 HIADHN COc1cccc([C@H]2[C@H](NCc3nc4cc(Cl)ccc4n3C)CCN2C2CC2)c1 ZINC000574827389 948537337 /nfs/dbraw/zinc/53/73/37/948537337.db2.gz YJXJFQHYULWPAI-XXBNENTESA-N 0 3 410.949 4.303 20 0 HIADHN CCN(C(=O)[C@H](C)N[C@H]1CCN(C2CC2)[C@H]1c1cccc(OC)c1)c1ccccc1 ZINC000574859547 948545404 /nfs/dbraw/zinc/54/54/04/948545404.db2.gz JASBTOQJABQSHR-NWVWQQAFSA-N 0 3 407.558 4.004 20 0 HIADHN CC[C@H]1CC[C@@H](C)N1CC(=O)N(Cc1nnc(-c2ccccc2Cl)o1)C1CC1 ZINC000575079998 948586156 /nfs/dbraw/zinc/58/61/56/948586156.db2.gz XUVTWEMIGOHKQF-CABCVRRESA-N 0 3 402.926 4.144 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2CN2CCC[C@H](c3ccnc(N)n3)C2)o1 ZINC000575094582 948591885 /nfs/dbraw/zinc/59/18/85/948591885.db2.gz FPPIOWXWXQBZCC-SFHVURJKSA-N 0 3 414.513 4.193 20 0 HIADHN O=C(NCCCN[C@H](c1ncc[nH]1)C1CCCCC1)c1cccc(Br)c1 ZINC000575735969 948688261 /nfs/dbraw/zinc/68/82/61/948688261.db2.gz VHWGNPAPDPOTSI-SFHVURJKSA-N 0 3 419.367 4.203 20 0 HIADHN CCOc1cc(CN2CCC[C@@H](c3nnc(C4CC4)[nH]3)C2)ccc1OCC(F)(F)F ZINC000575855433 948743200 /nfs/dbraw/zinc/74/32/00/948743200.db2.gz AHSPTZHUKRLWJM-MRXNPFEDSA-N 0 3 424.467 4.402 20 0 HIADHN CC[C@H]1c2ccsc2CCN1C(=O)CN[C@H]1c2ccccc2CC12CCOCC2 ZINC000575958248 948802060 /nfs/dbraw/zinc/80/20/60/948802060.db2.gz HPJDCQUBCAAMKL-REWPJTCUSA-N 0 3 410.583 4.268 20 0 HIADHN FC(F)(c1cnc(Cl)nc1Cl)N1CCC[C@H]2CN(Cc3ccccc3)C[C@@H]21 ZINC001164626446 719055484 /nfs/dbraw/zinc/05/54/84/719055484.db2.gz RFBZCFCRSAVZTF-HOCLYGCPSA-N 0 3 413.299 4.429 20 0 HIADHN FC(F)(c1nc2ccc(Cl)nc2[nH]1)N1CCC[C@H]2CN(Cc3ccccc3)C[C@H]21 ZINC001164630417 719102659 /nfs/dbraw/zinc/10/26/59/719102659.db2.gz WGEYIZSACBSZCO-DOTOQJQBSA-N 0 3 417.891 4.257 20 0 HIADHN CC(C)N(C)Cc1nn(C(F)(F)c2ccc3c(ccnc3Cl)c2)c2c1CCNC2 ZINC001164680626 719644308 /nfs/dbraw/zinc/64/43/08/719644308.db2.gz ZEXDACHUYWPPRK-UHFFFAOYSA-N 0 3 419.907 4.168 20 0 HIADHN Clc1ccc2nc(Cl)nc(N3CC[C@@H]4[C@H]3CCN4Cc3cccnc3)c2c1 ZINC001164728524 720330689 /nfs/dbraw/zinc/33/06/89/720330689.db2.gz WANUMUNZAOKVCA-QZTJIDSGSA-N 0 3 400.313 4.185 20 0 HIADHN C[C@@H]1CCc2c(sc3ncnc(N4CC[C@H]5[C@@H]4CCN5Cc4cccnc4)c23)C1 ZINC001164725077 720380934 /nfs/dbraw/zinc/38/09/34/720380934.db2.gz LPYPMRJFBOHDHA-MNEFBYGVSA-N 0 3 405.571 4.064 20 0 HIADHN c1cc2c(nc(-c3ccncc3)nc2N2CC[C@@H]3[C@H]2CCN3Cc2cccnc2)s1 ZINC001164723944 720467745 /nfs/dbraw/zinc/46/77/45/720467745.db2.gz DKHGFSNKRMEZQZ-WOJBJXKFSA-N 0 3 414.538 4.002 20 0 HIADHN Fc1ccc(F)c2c(N3CC[C@H]4[C@H]3CCN4Cc3cccnc3)cc(Cl)nc12 ZINC001164727645 720480530 /nfs/dbraw/zinc/48/05/30/720480530.db2.gz NRMYJYQHMKUHGB-DLBZAZTESA-N 0 3 400.860 4.415 20 0 HIADHN COc1cc2c(cc1F)cc(Cl)nc2N1CC[C@H]2[C@@H]1CCN2Cc1cccnc1 ZINC001164724152 720489098 /nfs/dbraw/zinc/48/90/98/720489098.db2.gz DYRWQFXLIDNLQI-OALUTQOASA-N 0 3 412.896 4.284 20 0 HIADHN Cc1noc(C)c1CN1CCOC[C@]2(CCCN(c3nccc4cccc(C)c43)C2)C1 ZINC001164780273 721370654 /nfs/dbraw/zinc/37/06/54/721370654.db2.gz FLSORICIBYADBV-RUZDIDTESA-N 0 3 420.557 4.267 20 0 HIADHN Cc1cc2c(nc(Cl)nc2N2CCN3C[C@@H](Oc4cccc(F)c4)C[C@H]3C2)s1 ZINC001164899191 721525212 /nfs/dbraw/zinc/52/52/12/721525212.db2.gz KREHVAYGURNIQK-HOCLYGCPSA-N 0 3 418.925 4.134 20 0 HIADHN Fc1cccc(O[C@@H]2C[C@@H]3CN(c4ccc(-c5ccccc5Cl)nn4)CCN3C2)c1 ZINC001164903402 721544054 /nfs/dbraw/zinc/54/40/54/721544054.db2.gz CJXAGEBSSTYDCV-IEBWSBKVSA-N 0 3 424.907 4.278 20 0 HIADHN COc1ccc2nc(N3CCC(F)(F)[C@]4(CCN(Cc5ccccn5)C4)C3)ccc2c1 ZINC001164907903 721697886 /nfs/dbraw/zinc/69/78/86/721697886.db2.gz WHXZDZWQLMTMQK-QHCPKHFHSA-N 0 3 424.495 4.376 20 0 HIADHN Cc1nc(Cl)cc(N2CCC(F)(F)[C@@]3(CCN(Cc4ccccn4)C3)C2)c1C ZINC001164908143 721707741 /nfs/dbraw/zinc/70/77/41/721707741.db2.gz VZLDLPKVCYRFFK-HXUWFJFHSA-N 0 3 406.908 4.485 20 0 HIADHN COc1ccc2ccc(N3CCC(F)(F)[C@]4(CCN(Cc5ccccn5)C4)C3)nc2c1 ZINC001164904338 721711551 /nfs/dbraw/zinc/71/15/51/721711551.db2.gz BVBZXOXFAKBBCZ-QHCPKHFHSA-N 0 3 424.495 4.376 20 0 HIADHN Cc1cc(N2CCC3(CC2)COCCN(Cc2ccncc2)C3)nc2ccccc12 ZINC001164963861 722055936 /nfs/dbraw/zinc/05/59/36/722055936.db2.gz OQEFBXUVUYVGKD-UHFFFAOYSA-N 0 3 402.542 4.057 20 0 HIADHN Cc1ccc(F)c2cc(C)c(N3CC[C@H]4CN(Cc5cccnc5)CCO[C@@H]4C3)nc12 ZINC001164976443 722128416 /nfs/dbraw/zinc/12/84/16/722128416.db2.gz LOSMSEHBZJDKKZ-NZQKXSOJSA-N 0 3 420.532 4.113 20 0 HIADHN Cc1cc(N2CC[C@@H]3CN(Cc4cccnc4)CCO[C@H]3C2)nc2c(Cl)cccc12 ZINC001164984656 722133139 /nfs/dbraw/zinc/13/31/39/722133139.db2.gz YGGYPQNWHBOKRV-KNQAVFIVSA-N 0 3 422.960 4.319 20 0 HIADHN COc1cc2ncnc(N3CCC[C@]4(CCN4Cc4cccc(F)c4)C3)c2cc1OC ZINC001164995894 722194857 /nfs/dbraw/zinc/19/48/57/722194857.db2.gz ZCCUGLZINNMAGD-DEOSSOPVSA-N 0 3 422.504 4.031 20 0 HIADHN COc1cc2ncnc(N3CCC[C@@]4(CCN4Cc4cccc(F)c4)C3)c2cc1OC ZINC001164995895 722195104 /nfs/dbraw/zinc/19/51/04/722195104.db2.gz ZCCUGLZINNMAGD-XMMPIXPASA-N 0 3 422.504 4.031 20 0 HIADHN CC[C@@H](Nc1ccccc1)C(=O)Nc1cc(C)nn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000436007659 861297292 /nfs/dbraw/zinc/29/72/92/861297292.db2.gz YTAFDDPXCRCBLA-XZOQPEGZSA-N 0 3 417.557 4.468 20 0 HIADHN CSc1c(F)cccc1C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000436161191 861461474 /nfs/dbraw/zinc/46/14/74/861461474.db2.gz BEKKIFQQVDKLHH-KRWDZBQOSA-N 0 3 410.518 4.443 20 0 HIADHN Fc1ccc(Cn2cc(CN[C@@H]3CCN(c4ccccc4OC(F)F)C3)cn2)cc1 ZINC000436239501 861547493 /nfs/dbraw/zinc/54/74/93/861547493.db2.gz GTOXGORUORCWFF-LJQANCHMSA-N 0 3 416.447 4.040 20 0 HIADHN CC(C)c1ccc([C@@H](NCC(=O)Nc2cccc(S(C)(=O)=O)c2)C(C)C)cc1 ZINC000007804718 845417450 /nfs/dbraw/zinc/41/74/50/845417450.db2.gz OXRQCMUNJPDICB-QFIPXVFZSA-N 0 3 402.560 4.139 20 0 HIADHN CCc1ccc([C@H](NCC(=O)Nc2ccc(CN3CCOCC3)cc2)C(C)C)cc1 ZINC000007873011 845437262 /nfs/dbraw/zinc/43/72/62/845437262.db2.gz HURSWIZRNKCYKQ-RUZDIDTESA-N 0 3 409.574 4.007 20 0 HIADHN CC(C)[C@@H](NCC(=O)Nc1ccccc1I)c1ccccc1 ZINC000008003342 845459384 /nfs/dbraw/zinc/45/93/84/845459384.db2.gz RVTSYHRFOOGUCX-GOSISDBHSA-N 0 3 408.283 4.217 20 0 HIADHN CC(C)[C@H](NCC(=O)Nc1ccccc1I)c1ccccc1 ZINC000008003340 845459970 /nfs/dbraw/zinc/45/99/70/845459970.db2.gz RVTSYHRFOOGUCX-SFHVURJKSA-N 0 3 408.283 4.217 20 0 HIADHN CCOc1ccccc1OCCCC(=O)N1c2ccc(C)cc2[C@H]2CN(C)CC[C@H]21 ZINC000010045409 845614794 /nfs/dbraw/zinc/61/47/94/845614794.db2.gz ROWGFJWSSZWNSX-IFMALSPDSA-N 0 3 408.542 4.387 20 0 HIADHN COc1ccc([C@@H](CNC(=O)/C=C/c2nc3ccccc3s2)N2CCCC2)cc1 ZINC000015387671 846043039 /nfs/dbraw/zinc/04/30/39/846043039.db2.gz ZVVCSCCNCFTHKA-DRUFCSCSSA-N 0 3 407.539 4.271 20 0 HIADHN CC(C)n1ncc2c1nc(C1CC1)cc2C(=O)NC1CCN(Cc2ccccc2)CC1 ZINC000017362972 846250322 /nfs/dbraw/zinc/25/03/22/846250322.db2.gz FUSOJKHECJQJQA-UHFFFAOYSA-N 0 3 417.557 4.284 20 0 HIADHN C=CCn1c(SCC(=O)C(C#N)c2nc(C)cs2)nnc1-c1cccc(C)c1 ZINC000020067888 846379113 /nfs/dbraw/zinc/37/91/13/846379113.db2.gz LTKBRJFKLNLIAT-INIZCTEOSA-N 0 3 409.540 4.173 20 0 HIADHN CC1CCN([C@@H](CNC(=O)c2c[nH]nc2-c2ccc(F)cc2)c2cccs2)CC1 ZINC000022681464 846602600 /nfs/dbraw/zinc/60/26/00/846602600.db2.gz OAJCTSRPQFUKLH-IBGZPJMESA-N 0 3 412.534 4.480 20 0 HIADHN CCc1ccc([C@H](CNC(=O)c2ccc(OC)c(Br)c2)N(C)C)cc1 ZINC000022684077 846602952 /nfs/dbraw/zinc/60/29/52/846602952.db2.gz XRYNQLQXZOTXOG-SFHVURJKSA-N 0 3 405.336 4.053 20 0 HIADHN CCNC(=O)COc1ccc(CN[C@@H](C)c2cccc(C(F)(F)F)c2)cc1OC ZINC000022784551 846620692 /nfs/dbraw/zinc/62/06/92/846620692.db2.gz PJOSKHKLKFICID-AWEZNQCLSA-N 0 3 410.436 4.080 20 0 HIADHN O=C(CN1CCCN(Cc2ccccc2)CC1)N[C@H](c1cccs1)c1ccccc1 ZINC000022808076 846623898 /nfs/dbraw/zinc/62/38/98/846623898.db2.gz GHJPLBSIPFDVKX-VWLOTQADSA-N 0 3 419.594 4.162 20 0 HIADHN Cc1c(C(=O)NCc2ccccc2CN(C)C)cnn1-c1cccc(C(F)(F)F)c1 ZINC000022991072 846645170 /nfs/dbraw/zinc/64/51/70/846645170.db2.gz RSUSGBMYGDFEBX-UHFFFAOYSA-N 0 3 416.447 4.191 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)[C@H](C)N1CCCN(Cc2ccc(C)cc2)CC1 ZINC000022995380 846646641 /nfs/dbraw/zinc/64/66/41/846646641.db2.gz LBMNYQJBUXHVQN-SFHVURJKSA-N 0 3 415.965 4.192 20 0 HIADHN Cc1cc(C)c(C)c(S(=O)(=O)NCC2CCN(Cc3cccs3)CC2)c1C ZINC000023000360 846646712 /nfs/dbraw/zinc/64/67/12/846646712.db2.gz CVUHAYMZVNTSBW-UHFFFAOYSA-N 0 3 406.617 4.172 20 0 HIADHN COc1ccc([C@H](CNC(=O)Cc2ccc(C(F)(F)F)cc2)N2CCCC2)cc1 ZINC000023487765 846707145 /nfs/dbraw/zinc/70/71/45/846707145.db2.gz WGEQTQLPQAMOJK-FQEVSTJZSA-N 0 3 406.448 4.210 20 0 HIADHN CCCOc1c(Br)cc(CNC[C@H]2COc3ccccc3O2)cc1OC ZINC000025261619 846949145 /nfs/dbraw/zinc/94/91/45/846949145.db2.gz CGNZZJWSEMRPAK-HNNXBMFYSA-N 0 3 422.319 4.176 20 0 HIADHN CCCOc1c(Br)cc(CNC[C@@H]2COc3ccccc3O2)cc1OC ZINC000025261617 846949384 /nfs/dbraw/zinc/94/93/84/846949384.db2.gz CGNZZJWSEMRPAK-OAHLLOKOSA-N 0 3 422.319 4.176 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)c1c[nH]nc1-c1ccc(Cl)cc1 ZINC000025383979 846971874 /nfs/dbraw/zinc/97/18/74/846971874.db2.gz TWORCFJQCMSZCJ-KRWDZBQOSA-N 0 3 400.935 4.359 20 0 HIADHN Cc1nc2ccccc2c(C)c1CC(=O)NCC(C)(C)N1CCc2ccccc2C1 ZINC000025460029 846981815 /nfs/dbraw/zinc/98/18/15/846981815.db2.gz PZQYFQLUFYLGBM-UHFFFAOYSA-N 0 3 401.554 4.347 20 0 HIADHN O=C(NC1CCN(Cc2c(-c3ccccc3)nc3ccccn32)CC1)c1ccccc1 ZINC000025828590 847043820 /nfs/dbraw/zinc/04/38/20/847043820.db2.gz ROJXZXNVUZJQCV-UHFFFAOYSA-N 0 3 410.521 4.396 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cc2cnn(C(C)C)c2nc1C)c1cccc(OC)c1 ZINC000025862713 847048126 /nfs/dbraw/zinc/04/81/26/847048126.db2.gz DSAHINHYTYYIOH-QFIPXVFZSA-N 0 3 423.561 4.142 20 0 HIADHN COCCOc1ccc(C(F)(F)F)cc1NC(=O)CN(C)[C@H]1CCC[C@@H](C)C1 ZINC000026475506 847155994 /nfs/dbraw/zinc/15/59/94/847155994.db2.gz NTGYLJMAMVACPN-ZBFHGGJFSA-N 0 3 402.457 4.180 20 0 HIADHN O[C@H](COc1ccc2ccccc2c1)CN1CCC[C@@H]1c1ccc2c(c1)OCCO2 ZINC000026480958 847156122 /nfs/dbraw/zinc/15/61/22/847156122.db2.gz LDJOEOKUZKKKQU-JTHBVZDNSA-N 0 3 405.494 4.188 20 0 HIADHN O=C(CN1CCN(C2CCCC2)CC1)Nc1cc(C2CCCC2)nn1-c1ccccc1 ZINC000027120170 847250259 /nfs/dbraw/zinc/25/02/59/847250259.db2.gz MPUSGQORWXMUCY-UHFFFAOYSA-N 0 3 421.589 4.029 20 0 HIADHN COc1ccc(CN(C)C[C@H](O)COc2cccc3ccccc32)cc1OC(F)F ZINC000027210025 847266574 /nfs/dbraw/zinc/26/65/74/847266574.db2.gz FIZMJSMNVCRAQP-SFHVURJKSA-N 0 3 417.452 4.322 20 0 HIADHN COc1cccc([C@@H](CNC(=O)Cc2c(Cl)cccc2Cl)N2CCCC2)c1 ZINC000027340969 847286270 /nfs/dbraw/zinc/28/62/70/847286270.db2.gz ZZQJASJJNWJCQO-HXUWFJFHSA-N 0 3 407.341 4.498 20 0 HIADHN C=CCOc1ccc(/C=C/C(=O)N2CCCN(Cc3ccccc3C)CC2)cc1OC ZINC000027387311 847294071 /nfs/dbraw/zinc/29/40/71/847294071.db2.gz PPZFHOPOEGNTPI-ACCUITESSA-N 0 3 420.553 4.316 20 0 HIADHN CC1CCN([C@@H](CNC(=O)Cc2ccc(OC(F)F)cc2)c2cccs2)CC1 ZINC000027574110 847322388 /nfs/dbraw/zinc/32/23/88/847322388.db2.gz XUTHXOVZKPFLCJ-SFHVURJKSA-N 0 3 408.514 4.481 20 0 HIADHN CC(C)c1ccc(-c2noc(CCC(=O)NC[C@@H](Cc3ccccc3)N(C)C)n2)cc1 ZINC000027589062 847324612 /nfs/dbraw/zinc/32/46/12/847324612.db2.gz KVNWXRHEESDEQS-JOCHJYFZSA-N 0 3 420.557 4.082 20 0 HIADHN CCc1ccc([C@H](CNC(=O)c2ccccc2OCc2c(C)noc2C)N(C)C)cc1 ZINC000027598137 847325959 /nfs/dbraw/zinc/32/59/59/847325959.db2.gz KBEQOEJRGMICQH-QHCPKHFHSA-N 0 3 421.541 4.466 20 0 HIADHN CC(=O)c1ccc(OCCCC(=O)NC[C@H](c2cccs2)N2CCCC2)cc1 ZINC000027608323 847327065 /nfs/dbraw/zinc/32/70/65/847327065.db2.gz XPUZLGBULUJJNK-HXUWFJFHSA-N 0 3 400.544 4.063 20 0 HIADHN Cn1cc(CNCc2ccc(OC(F)F)cc2)c(-c2ccc3c(c2)OCCCO3)n1 ZINC000028306920 847405325 /nfs/dbraw/zinc/40/53/25/847405325.db2.gz HZJCQNNPABQKAS-UHFFFAOYSA-N 0 3 415.440 4.140 20 0 HIADHN O=C(c1ccc(CN2CCN(Cc3cccc4ccccc43)CC2)cc1)N1CCCC1 ZINC000028736493 847453293 /nfs/dbraw/zinc/45/32/93/847453293.db2.gz WQOUFVGULUTDCM-UHFFFAOYSA-N 0 3 413.565 4.394 20 0 HIADHN COc1cc(CN(C)CCC(=O)N[C@@H]2CCCc3ccccc32)ccc1OC(F)F ZINC000028852858 847469692 /nfs/dbraw/zinc/46/96/92/847469692.db2.gz KWSCECPMOWTFCO-LJQANCHMSA-N 0 3 418.484 4.312 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)N[C@@H](c3cccs3)c3ccccc3)CC2)c1 ZINC000028892115 847473165 /nfs/dbraw/zinc/47/31/65/847473165.db2.gz KZLOIYHWHBYXFZ-RUZDIDTESA-N 0 3 419.594 4.474 20 0 HIADHN O=C(CN[C@@H](CCCc1ccccc1)c1ccccc1)Nc1ccc2[nH]c(=O)[nH]c2c1 ZINC000029148327 847514251 /nfs/dbraw/zinc/51/42/51/847514251.db2.gz YLYGDRWAFOZIBX-NRFANRHFSA-N 0 3 414.509 4.149 20 0 HIADHN Cc1ccc(C(=O)N[C@@H](CN2CCCC2)c2ccccc2)cc1NC(=O)c1ccco1 ZINC000029177590 847520412 /nfs/dbraw/zinc/52/04/12/847520412.db2.gz VNOYCINOCHCGTB-QFIPXVFZSA-N 0 3 417.509 4.407 20 0 HIADHN COc1ccc(C(=O)N[C@@H](CN2CCCC2)c2ccccc2)cc1Br ZINC000029178448 847520780 /nfs/dbraw/zinc/52/07/80/847520780.db2.gz LJHAHLYBFYEEBF-SFHVURJKSA-N 0 3 403.320 4.025 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)c1cc2c([nH]c(=O)cc2C(F)(F)F)o1 ZINC000029179586 847521797 /nfs/dbraw/zinc/52/17/97/847521797.db2.gz KGRLGYQDBVGRPG-INIZCTEOSA-N 0 3 419.403 4.119 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cnn(Cc2ccccc2Cl)c1)c1ccsc1 ZINC000029415102 847560307 /nfs/dbraw/zinc/56/03/07/847560307.db2.gz USOBNZAYWBBXFT-HXUWFJFHSA-N 0 3 416.978 4.459 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cnn(-c4cccc(C)c4)c3C)c(C)c2)CC1 ZINC000029597227 847585329 /nfs/dbraw/zinc/58/53/29/847585329.db2.gz QJPQKXWKOKMBLL-UHFFFAOYSA-N 0 3 417.557 4.192 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCc1nc2ccccc2s1)c1cccc(OC)c1 ZINC000029722933 847609215 /nfs/dbraw/zinc/60/92/15/847609215.db2.gz YLUNMHVCDUDPPE-LJQANCHMSA-N 0 3 412.559 4.187 20 0 HIADHN N#Cc1c2[nH]c3ccccc3n2c(=O)cc1CN1CCC[C@@H](c2nc3ccccc3o2)C1 ZINC000029833109 847628473 /nfs/dbraw/zinc/62/84/73/847628473.db2.gz YUBOMSSXOOCXAM-SJLPKXTDSA-N 0 3 423.476 4.244 20 0 HIADHN CC[C@H](CNC(=O)CCc1ccc(OC(F)F)cc1)N1CCc2ccccc2C1 ZINC000029912752 847649620 /nfs/dbraw/zinc/64/96/20/847649620.db2.gz RTCDABLJYCCRSW-HXUWFJFHSA-N 0 3 402.485 4.174 20 0 HIADHN Clc1cccc(N2CCOCC2)c1CN1CC[C@H](COCc2ccccc2)C1 ZINC000436471615 861817211 /nfs/dbraw/zinc/81/72/11/861817211.db2.gz PJJIVWIOMFGWDF-FQEVSTJZSA-N 0 3 400.950 4.215 20 0 HIADHN Cc1ccccc1CN1CCCN(CC(=O)Nc2ccc(N3CCCC3)cc2C)CC1 ZINC000030154044 847683723 /nfs/dbraw/zinc/68/37/23/847683723.db2.gz ZIGMKKYFVPGGQG-UHFFFAOYSA-N 0 3 420.601 4.050 20 0 HIADHN Cc1nc(NC(=O)N(CCN(C)C)Cc2ccco2)sc1Cc1ccc(F)cc1 ZINC000436491713 861822660 /nfs/dbraw/zinc/82/26/60/861822660.db2.gz SMTXPXRYMFJXTH-UHFFFAOYSA-N 0 3 416.522 4.370 20 0 HIADHN Cc1c(CN[C@@H](CN2CCOCC2)c2ccc(C)cc2)sc2nc(C)nc(C)c12 ZINC000030628463 847747401 /nfs/dbraw/zinc/74/74/01/847747401.db2.gz PGCPWRAHGOPFJQ-FQEVSTJZSA-N 0 3 410.587 4.088 20 0 HIADHN COc1cc(CNCc2ccc(Cn3cncn3)cc2)ccc1OCc1ccccc1 ZINC000030634024 847748715 /nfs/dbraw/zinc/74/87/15/847748715.db2.gz YYEBRCFFQWASBB-UHFFFAOYSA-N 0 3 414.509 4.204 20 0 HIADHN Cc1ccc(COc2ccc(CNCc3ccc(N4CCOCC4)nc3)cc2)cc1 ZINC000030636719 847750004 /nfs/dbraw/zinc/75/00/04/847750004.db2.gz YKSAPTOBZIIQRO-UHFFFAOYSA-N 0 3 403.526 4.095 20 0 HIADHN CNC(=O)c1ccc(CNCc2ccc(OC(F)(F)[C@H](F)C(F)(F)F)cc2)cc1 ZINC000030671826 847756154 /nfs/dbraw/zinc/75/61/54/847756154.db2.gz LFRWIGAJPQKRGL-QGZVFWFLSA-N 0 3 420.353 4.208 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N(C)CC(=O)Nc1c(C)cccc1C)c1ccsc1 ZINC000031194728 847841072 /nfs/dbraw/zinc/84/10/72/847841072.db2.gz WTKIJQJXUQWHDB-IBGZPJMESA-N 0 3 416.591 4.028 20 0 HIADHN Cc1[nH]c2ccc(Br)cc2c1CC(=O)NC[C@@H](c1ccccc1)N(C)C ZINC000031519778 847899582 /nfs/dbraw/zinc/89/95/82/847899582.db2.gz HZADLVKYBKRNTJ-FQEVSTJZSA-N 0 3 414.347 4.200 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)COc3cc(Cl)cc(Cl)c3)cc2)CC1 ZINC000031671429 847926364 /nfs/dbraw/zinc/92/63/64/847926364.db2.gz ZHBAPKWDCVYEKZ-UHFFFAOYSA-N 0 3 408.329 4.153 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1ccccc1OC[C@@H]1CCCO1)c1ccsc1 ZINC000031984371 847974792 /nfs/dbraw/zinc/97/47/92/847974792.db2.gz YWYOQRYVITXENP-ICSRJNTNSA-N 0 3 402.560 4.119 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1[nH]c(C)c(C(=O)OC(C)C)c1C)c1ccsc1 ZINC000031987003 847975781 /nfs/dbraw/zinc/97/57/81/847975781.db2.gz AZHPQAJPZUDXHV-QGZVFWFLSA-N 0 3 405.564 4.071 20 0 HIADHN CCCOc1c(Cl)cc(C(=O)NCCCN2CCc3ccccc3C2)cc1OC ZINC000032399665 848019043 /nfs/dbraw/zinc/01/90/43/848019043.db2.gz FTTZPQYGKIHTHD-UHFFFAOYSA-N 0 3 416.949 4.316 20 0 HIADHN CC[C@@H](CNC(=O)Cc1nc(-c2cccs2)oc1C)N1CCc2ccccc2C1 ZINC000032447525 848029585 /nfs/dbraw/zinc/02/95/85/848029585.db2.gz AGYKSACTSBNGPB-IBGZPJMESA-N 0 3 409.555 4.207 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)CCCc2nnc(-c3ccccc3)o2)N(C)C)cc1 ZINC000032484004 848037497 /nfs/dbraw/zinc/03/74/97/848037497.db2.gz FXCOCOCHDLWOIY-OAQYLSRUSA-N 0 3 406.530 4.041 20 0 HIADHN O=C(c1ccccc1[O-])N1CCC([NH2+][C@H]2CCc3ccc(Br)cc32)CC1 ZINC000436595909 861863240 /nfs/dbraw/zinc/86/32/40/861863240.db2.gz OGGJCBOSPUNTNY-IBGZPJMESA-N 0 3 415.331 4.036 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3csc(Cc4ccccc4)n3)c(C)c2)CC1 ZINC000032710742 848066544 /nfs/dbraw/zinc/06/65/44/848066544.db2.gz NNYDZBSALCMSMS-UHFFFAOYSA-N 0 3 420.582 4.437 20 0 HIADHN Cc1nc(COc2ccc(F)cc2)sc1C(=O)NC[C@H](C)N1CCCC[C@H]1C ZINC000032737034 848069046 /nfs/dbraw/zinc/06/90/46/848069046.db2.gz KREUNOMWVRHGOE-CABCVRRESA-N 0 3 405.539 4.162 20 0 HIADHN CCOc1c(Cl)cc(C(=O)NC[C@H](c2ccc(CC)cc2)N(C)C)cc1OC ZINC000032733115 848069453 /nfs/dbraw/zinc/06/94/53/848069453.db2.gz PZDORADRMHIDFJ-LJQANCHMSA-N 0 3 404.938 4.342 20 0 HIADHN Cc1cc(C(=O)NCc2ccccc2CN(C)C)cc(C)c1OCc1cccnc1 ZINC000033221829 848128048 /nfs/dbraw/zinc/12/80/48/848128048.db2.gz XJMTULAZKFVYIF-UHFFFAOYSA-N 0 3 403.526 4.269 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3ccc(OC(C)C)c(OC)c3)c(C)c2)CC1 ZINC000036632483 848150892 /nfs/dbraw/zinc/15/08/92/848150892.db2.gz ULGFTQUGNTXMEU-UHFFFAOYSA-N 0 3 411.546 4.185 20 0 HIADHN COc1ccc2c(C)c(CCC(=O)C(C#N)c3nc4ccccc4o3)c(=O)oc2c1 ZINC000041542177 848228909 /nfs/dbraw/zinc/22/89/09/848228909.db2.gz GWXNSZBOZKZXQK-QGZVFWFLSA-N 0 3 402.406 4.060 20 0 HIADHN C[C@H](NC(=O)c1ccccc1)C(=O)C(C#N)c1nc2cc(C(F)(F)F)ccc2s1 ZINC000041549354 848230775 /nfs/dbraw/zinc/23/07/75/848230775.db2.gz VTCKNBXQKYRRPW-SMDDNHRTSA-N 0 3 417.412 4.310 20 0 HIADHN N#CC(C(=O)CCCNC(=O)NC1CCCCC1)c1nc2ccccc2n1C(F)F ZINC000041557161 848231465 /nfs/dbraw/zinc/23/14/65/848231465.db2.gz RFXFTLJKMOPNSK-HNNXBMFYSA-N 0 3 417.460 4.020 20 0 HIADHN N#CC(C(=O)CC[C@H]1Cc2ccccc2NC1=O)c1nc2ccccc2n1C(F)F ZINC000041557286 848231480 /nfs/dbraw/zinc/23/14/80/848231480.db2.gz TYBCBFCHPMJPAA-LSDHHAIUSA-N 0 3 408.408 4.199 20 0 HIADHN CCc1ccccc1NC(=S)NCCCCN1CCN(c2cccc(C)c2)CC1 ZINC000041741230 848241712 /nfs/dbraw/zinc/24/17/12/848241712.db2.gz DMQCENPOMIHFAM-UHFFFAOYSA-N 0 3 410.631 4.446 20 0 HIADHN O[C@H](COc1c(Cl)cccc1Cl)CN1CCC([C@H](O)c2ccccc2)CC1 ZINC000042635035 848334902 /nfs/dbraw/zinc/33/49/02/848334902.db2.gz XRFQUUGIZMLDRI-FXAWDEMLSA-N 0 3 410.341 4.179 20 0 HIADHN COc1ccc(NC(C)=O)cc1NC(=O)[C@H](C)N[C@H](C)c1ccc2c(c1)CCCC2 ZINC000042636598 848336378 /nfs/dbraw/zinc/33/63/78/848336378.db2.gz KJPYDCWNHCSAIB-CVEARBPZSA-N 0 3 409.530 4.210 20 0 HIADHN O=C(N[C@H](c1ccccc1)c1ccccn1)N1CCCN(Cc2ccccc2)CC1 ZINC000043296492 848406132 /nfs/dbraw/zinc/40/61/32/848406132.db2.gz HFSVOEOIVPGTEB-XMMPIXPASA-N 0 3 400.526 4.089 20 0 HIADHN CC(=O)Nc1cc(NC(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)ccc1F ZINC000044016049 848500797 /nfs/dbraw/zinc/50/07/97/848500797.db2.gz FARSNUWMQHKHCG-LJQANCHMSA-N 0 3 418.538 4.440 20 0 HIADHN C=CCNc1nnc(SCC(=O)C(C#N)c2nc(-c3ccccc3)cs2)s1 ZINC000046581815 848879115 /nfs/dbraw/zinc/87/91/15/848879115.db2.gz GAJKXALFSXNROW-CYBMUJFWSA-N 0 3 413.553 4.228 20 0 HIADHN CC1CCN(CCNC(=O)c2cnn(-c3ccc(Cl)cc3)c2C(F)(F)F)CC1 ZINC000046956209 848964633 /nfs/dbraw/zinc/96/46/33/848964633.db2.gz SBDUSCHDQAZBRJ-UHFFFAOYSA-N 0 3 414.859 4.006 20 0 HIADHN Cc1nn(Cc2ccccc2Cl)c(Cl)c1C(=O)NCCN1CCC[C@@H](C)C1 ZINC000047148455 848992965 /nfs/dbraw/zinc/99/29/65/848992965.db2.gz LEVSWNBWRQCNON-CQSZACIVSA-N 0 3 409.361 4.008 20 0 HIADHN Cc1nn(Cc2ccccc2Cl)c(Cl)c1C(=O)NCCN1CCCC[C@@H]1C ZINC000047145162 848993257 /nfs/dbraw/zinc/99/32/57/848993257.db2.gz WEYVMFRETZEHSV-AWEZNQCLSA-N 0 3 409.361 4.151 20 0 HIADHN CC(C)CNC(=O)c1ccc(NC(=O)NC[C@@H](c2cccs2)N2CCCC2)cc1 ZINC000047729791 849100400 /nfs/dbraw/zinc/10/04/00/849100400.db2.gz RRHUKUBEHKBFJR-IBGZPJMESA-N 0 3 414.575 4.093 20 0 HIADHN COc1ccc(OC(F)F)c(NC(=O)NC[C@@H](c2ccccc2)N2CCCC2)c1 ZINC000047921066 849138411 /nfs/dbraw/zinc/13/84/11/849138411.db2.gz MAKGOTGMRLNDDP-SFHVURJKSA-N 0 3 405.445 4.255 20 0 HIADHN CCOC(=O)Nc1ccc(NC(=O)NCC(C)(C)N2CCc3ccccc3C2)cc1 ZINC000047946929 849143196 /nfs/dbraw/zinc/14/31/96/849143196.db2.gz ZCGKOACNTYFTFG-UHFFFAOYSA-N 0 3 410.518 4.213 20 0 HIADHN O=C(NCc1csc(Br)c1)NC[C@H](c1cccs1)N1CCCC1 ZINC000047956419 849143961 /nfs/dbraw/zinc/14/39/61/849143961.db2.gz GWQBOLRWXNXBBW-CYBMUJFWSA-N 0 3 414.394 4.208 20 0 HIADHN CCOc1ccc([C@@H](C)NC(=O)NC[C@@H](c2cccs2)N2CCCC2)cc1OC ZINC000047956428 849144140 /nfs/dbraw/zinc/14/41/40/849144140.db2.gz YQLGQGKLCSFWSV-AEFFLSMTSA-N 0 3 417.575 4.353 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1cc(C(=O)NC2CC2)ccc1C)c1ccsc1 ZINC000047985406 849147672 /nfs/dbraw/zinc/14/76/72/849147672.db2.gz HMGDTDHVKGPSAX-HXUWFJFHSA-N 0 3 414.575 4.153 20 0 HIADHN COc1cc(OC)c(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2)cc1Cl ZINC000048054525 849155615 /nfs/dbraw/zinc/15/56/15/849155615.db2.gz VVUPZBFARAIFET-UHFFFAOYSA-N 0 3 409.889 4.092 20 0 HIADHN CCCOc1ccc(CNCc2cn(C)nc2-c2ccc3c(c2)OCCCO3)cc1 ZINC000048715513 849259255 /nfs/dbraw/zinc/25/92/55/849259255.db2.gz YXAGSPXKBPRRCN-UHFFFAOYSA-N 0 3 407.514 4.327 20 0 HIADHN C[C@H](NC(=O)C(=O)Nc1cccc(CN(C)C)c1)c1cc(F)c(Cl)cc1Cl ZINC000048842709 849273514 /nfs/dbraw/zinc/27/35/14/849273514.db2.gz LKCGBUQKJGNJQM-NSHDSACASA-N 0 3 412.292 4.010 20 0 HIADHN Cc1cc(C)n(-c2ccc(CCNC(=O)c3cccc(CN4CCCC4)c3)cc2)n1 ZINC000050032081 849343028 /nfs/dbraw/zinc/34/30/28/849343028.db2.gz ROKISUCRRDVCBW-UHFFFAOYSA-N 0 3 402.542 4.057 20 0 HIADHN O=C(c1ccccc1[O-])N1CCC([NH2+][C@H]2CCSc3c(Cl)cccc32)CC1 ZINC000436828406 862009286 /nfs/dbraw/zinc/00/92/86/862009286.db2.gz MHMKQNYMERJEAJ-SFHVURJKSA-N 0 3 402.947 4.477 20 0 HIADHN Cc1nc(C(C)(C)C)sc1[C@@H](C)[NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1 ZINC000436829870 862009324 /nfs/dbraw/zinc/00/93/24/862009324.db2.gz PRXVCZFZYOGBSC-CQSZACIVSA-N 0 3 401.576 4.410 20 0 HIADHN COc1cc(NC(=O)CN[C@@H](c2ccc(Cl)cc2)C2CC2)cc(OC)c1OC ZINC000050273590 849366228 /nfs/dbraw/zinc/36/62/28/849366228.db2.gz TTWUOSICICPABV-HXUWFJFHSA-N 0 3 404.894 4.045 20 0 HIADHN Cc1nc(-c2cccnc2)sc1[C@H](C)[NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1 ZINC000436831806 862011890 /nfs/dbraw/zinc/01/18/90/862011890.db2.gz TZRLLANKLWKIES-HNNXBMFYSA-N 0 3 422.554 4.175 20 0 HIADHN N#CC(C(=O)CCC(=O)c1ccc(-c2ccccc2)cc1)C(=O)NC1CCCCC1 ZINC000050682039 849403028 /nfs/dbraw/zinc/40/30/28/849403028.db2.gz PETXSYNQVSXIPL-JOCHJYFZSA-N 0 3 402.494 4.474 20 0 HIADHN Cc1ccc(NC(=O)C2CCN(Cc3ccc(OCc4cccnc4)cc3)CC2)nc1 ZINC000050961163 849423285 /nfs/dbraw/zinc/42/32/85/849423285.db2.gz FDBMRHVNNVVSHW-UHFFFAOYSA-N 0 3 416.525 4.215 20 0 HIADHN CC(=O)NC1CCN(Cc2cn(-c3ccccc3)nc2-c2ccc(Cl)cc2)CC1 ZINC000050992011 849424357 /nfs/dbraw/zinc/42/43/57/849424357.db2.gz WEWSPBSBIBGZKR-UHFFFAOYSA-N 0 3 408.933 4.293 20 0 HIADHN CNC(=O)c1ccc(CN(C)[C@H](C)c2cccc(NC(=O)c3ccccc3)c2)cc1 ZINC000052073697 849547243 /nfs/dbraw/zinc/54/72/43/849547243.db2.gz DPRXEGDMJANYIN-GOSISDBHSA-N 0 3 401.510 4.492 20 0 HIADHN COc1cc(NC(=O)CN[C@H](c2ccc(F)cc2)C(C)(C)C)cc(OC)c1OC ZINC000053644336 849741323 /nfs/dbraw/zinc/74/13/23/849741323.db2.gz XGHNIMYHVCWBJQ-OAQYLSRUSA-N 0 3 404.482 4.167 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)c2cccc(OCc3cccnc3)c2)C1 ZINC000054223014 849829041 /nfs/dbraw/zinc/82/90/41/849829041.db2.gz KXEUIAZRDQUGAP-XXBNENTESA-N 0 3 401.510 4.226 20 0 HIADHN Cc1cc(NC(=O)c2ccco2)sc1C(=O)N(CCN(C)C)Cc1ccccc1 ZINC000054277411 849838787 /nfs/dbraw/zinc/83/87/87/849838787.db2.gz AWWYQKQKEZPANT-UHFFFAOYSA-N 0 3 411.527 4.106 20 0 HIADHN CCN(CC)C(=O)c1cccc(NC(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)c1 ZINC000054382515 849855250 /nfs/dbraw/zinc/85/52/50/849855250.db2.gz PGNJLWPGRMXGQY-PGRDOPGGSA-N 0 3 408.546 4.126 20 0 HIADHN CN(CCNC(=O)Nc1cccc(NC(=O)c2cccs2)c1)Cc1ccccc1 ZINC000054387576 849856528 /nfs/dbraw/zinc/85/65/28/849856528.db2.gz WFGOQNAGZKZYSI-UHFFFAOYSA-N 0 3 408.527 4.254 20 0 HIADHN Cc1ccc(C(=O)C2CCN(C[C@H](O)CO[C@@H]3CCCc4ccccc43)CC2)cc1 ZINC000054421804 849863550 /nfs/dbraw/zinc/86/35/50/849863550.db2.gz WCWFDNRFPVANAG-UKILVPOCSA-N 0 3 407.554 4.345 20 0 HIADHN CN(CCNC(=O)Nc1cccc(C(=O)N(C)c2ccccc2)c1)Cc1ccccc1 ZINC000054440929 849868077 /nfs/dbraw/zinc/86/80/77/849868077.db2.gz QMHMSVPRHSEDHV-UHFFFAOYSA-N 0 3 416.525 4.217 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N(Cc2cccs2)C[C@@H]2CCCO2)C1 ZINC000054698840 849910028 /nfs/dbraw/zinc/91/00/28/849910028.db2.gz OARMBNWXJQZMFL-GIVPXCGWSA-N 0 3 413.587 4.274 20 0 HIADHN C[C@@H](NC(=O)NCCN(C)Cc1ccccc1)c1cccc(OCc2ccccn2)c1 ZINC000054761375 849919000 /nfs/dbraw/zinc/91/90/00/849919000.db2.gz FMOBTGKCOLSBJF-HXUWFJFHSA-N 0 3 418.541 4.153 20 0 HIADHN Cc1nn(Cc2ccccc2Cl)c(Cl)c1C(=O)NCCN1CCC(C)CC1 ZINC000054779615 849921247 /nfs/dbraw/zinc/92/12/47/849921247.db2.gz NAKUIFCTLGEGBZ-UHFFFAOYSA-N 0 3 409.361 4.008 20 0 HIADHN O=C(Nc1ccccc1)NC1CCN(Cc2ccc(OCC(F)(F)F)cc2)CC1 ZINC000055032737 849959692 /nfs/dbraw/zinc/95/96/92/849959692.db2.gz CUHFRETXIGJUME-UHFFFAOYSA-N 0 3 407.436 4.414 20 0 HIADHN CNC(=O)c1cccc(NC(=O)[C@@H](C)N[C@H](CCc2ccccc2)c2ccccc2)c1 ZINC000055152980 849978203 /nfs/dbraw/zinc/97/82/03/849978203.db2.gz GXKJVIYTDAERBM-NTKDMRAZSA-N 0 3 415.537 4.337 20 0 HIADHN C[C@H](N[C@@H](CCc1ccccc1)c1ccccc1)C(=O)Nc1ccc(C(N)=O)cc1 ZINC000055152996 849978416 /nfs/dbraw/zinc/97/84/16/849978416.db2.gz GYTSNKYZESSZPT-MBSDFSHPSA-N 0 3 401.510 4.076 20 0 HIADHN Cc1cc(NC(=O)c2ccccc2Cl)sc1C(=O)NCCN1CCC[C@H](C)C1 ZINC000055377529 850009294 /nfs/dbraw/zinc/00/92/94/850009294.db2.gz UQGDPRYDRAKLLU-AWEZNQCLSA-N 0 3 419.978 4.424 20 0 HIADHN CN(C)c1cc(Cl)cc(Cl)c1C[NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1 ZINC000436920650 862100591 /nfs/dbraw/zinc/10/05/91/862100591.db2.gz QDSWXIFIIBUHRB-UHFFFAOYSA-N 0 3 422.356 4.159 20 0 HIADHN C/C(=C\c1ccccc1OC(F)F)C[NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1 ZINC000436919846 862100897 /nfs/dbraw/zinc/10/08/97/862100897.db2.gz MVXNCDBGKLKLMQ-JQIJEIRASA-N 0 3 416.468 4.291 20 0 HIADHN CC(C)(C)CCN1CCN(CC(=O)Nc2cc(C(F)(F)F)ccc2Cl)CC1 ZINC000055936486 850209983 /nfs/dbraw/zinc/20/99/83/850209983.db2.gz JOYYSUQRJQTDGQ-UHFFFAOYSA-N 0 3 405.892 4.351 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)CSc2ccc(C(F)(F)F)cn2)C1 ZINC000056168505 850268490 /nfs/dbraw/zinc/26/84/90/850268490.db2.gz AXRGUKJMFORCHX-YOEHRIQHSA-N 0 3 409.477 4.144 20 0 HIADHN O=C(c1ccccc1[O-])N1CCC([NH2+][C@@H](C[C@H]2CCCO2)c2ccc(F)cc2)CC1 ZINC000436942055 862120199 /nfs/dbraw/zinc/12/01/99/862120199.db2.gz UBAPXCODZDJFCG-IRLDBZIGSA-N 0 3 412.505 4.036 20 0 HIADHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)Nc1cc(F)ccc1F ZINC000056524341 850383848 /nfs/dbraw/zinc/38/38/48/850383848.db2.gz UNMFQXXPCAWMGV-UHFFFAOYSA-N 0 3 412.278 4.323 20 0 HIADHN O=C(Nc1ccccc1OC[C@@H]1CCCCO1)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000056554817 850391921 /nfs/dbraw/zinc/39/19/21/850391921.db2.gz DIUKCWVHVVRDKV-SFTDATJTSA-N 0 3 409.530 4.031 20 0 HIADHN CC(=O)Nc1ccc(Cl)c(NC(=O)NC[C@@H](c2ccccc2)N2CCCC2)c1 ZINC000056693112 850441830 /nfs/dbraw/zinc/44/18/30/850441830.db2.gz IFXYJVKXKLZBCW-FQEVSTJZSA-N 0 3 400.910 4.257 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)[C@@H](C)Cc1ccccc1 ZINC000436959532 862141720 /nfs/dbraw/zinc/14/17/20/862141720.db2.gz AGVFGVLEDDBJQE-WMZHIEFXSA-N 0 3 402.542 4.456 20 0 HIADHN CC[C@H](NC(=O)NC[C@H](c1ccc(OC)cc1)N1CCCC1)c1ccc(OC)cc1 ZINC000057769044 850711065 /nfs/dbraw/zinc/71/10/65/850711065.db2.gz LJYXDOKMMNRPBA-XZOQPEGZSA-N 0 3 411.546 4.291 20 0 HIADHN CC[C@@H](CNC(=O)Nc1nnc(-c2ccsc2)s1)N1CCc2ccccc2C1 ZINC000057787559 850715392 /nfs/dbraw/zinc/71/53/92/850715392.db2.gz DPTAUWMEPDYLSS-KRWDZBQOSA-N 0 3 413.572 4.225 20 0 HIADHN CN(C)[C@H](CNC(=O)N(C)CCCc1cc(-c2cccc(F)c2)n[nH]1)c1ccccc1 ZINC000057791382 850717084 /nfs/dbraw/zinc/71/70/84/850717084.db2.gz DOLFQMUDPWPZLW-HSZRJFAPSA-N 0 3 423.536 4.093 20 0 HIADHN Cc1cccc(NC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)c1C(=O)N1CCCC1 ZINC000058549829 850852899 /nfs/dbraw/zinc/85/28/99/850852899.db2.gz HJDZTEREVHQWTC-OAQYLSRUSA-N 0 3 420.557 4.017 20 0 HIADHN CC(=O)CCc1ccc(OCCC(=O)N2c3ccc(C)cc3[C@H]3CN(C)CC[C@@H]32)cc1 ZINC000058651226 850880036 /nfs/dbraw/zinc/88/00/36/850880036.db2.gz CDTADQRFPSTEGH-NOZRDPDXSA-N 0 3 420.553 4.120 20 0 HIADHN COc1cc(NC(=O)NC[C@@H](c2cccs2)N2CCCC2)c(OC)cc1Cl ZINC000058863391 850946774 /nfs/dbraw/zinc/94/67/74/850946774.db2.gz NETOOLGGPOTWHU-HNNXBMFYSA-N 0 3 409.939 4.377 20 0 HIADHN CC(C)CN(CCN(C)C)C(=O)c1ccc(COc2cccc(Br)c2)o1 ZINC000058882761 850951275 /nfs/dbraw/zinc/95/12/75/850951275.db2.gz SUEUXSFJSNMEHO-UHFFFAOYSA-N 0 3 423.351 4.281 20 0 HIADHN Cc1ccc([C@@H](CC(=O)OC(C)C)NC(=O)c2cccc(CN3CCCC3)c2)cc1 ZINC000059951456 851026893 /nfs/dbraw/zinc/02/68/93/851026893.db2.gz KQVQENLIWXOLRC-HSZRJFAPSA-N 0 3 408.542 4.404 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)CCc2ncc(-c3ccc(Cl)cc3)o2)o1 ZINC000060407367 851089728 /nfs/dbraw/zinc/08/97/28/851089728.db2.gz KWPGWLKXOMJFFA-UHFFFAOYSA-N 0 3 415.921 4.419 20 0 HIADHN COc1cccc([C@H](CNc2ncc(C(=O)N3CCCCC3)cc2Cl)N(C)C)c1 ZINC000060445874 851102363 /nfs/dbraw/zinc/10/23/63/851102363.db2.gz DUTYPIRENCJJQN-FQEVSTJZSA-N 0 3 416.953 4.085 20 0 HIADHN Cc1nn(Cc2ccccc2)c(Cl)c1C(=O)N(CCc1ccccc1)CCN(C)C ZINC000060713769 851196513 /nfs/dbraw/zinc/19/65/13/851196513.db2.gz FMMGAIFEFOGUCP-UHFFFAOYSA-N 0 3 424.976 4.140 20 0 HIADHN O=S(=O)(/C=C/c1ccc(Cl)cc1)NCC1CCN(Cc2cccs2)CC1 ZINC000060923518 851249314 /nfs/dbraw/zinc/24/93/14/851249314.db2.gz ZAMPUVIQPAUITH-UKTHLTGXSA-N 0 3 410.992 4.204 20 0 HIADHN O[C@@H](CNCc1ccccc1OCc1ccccn1)c1ccc(OC(F)(F)F)cc1 ZINC000060952999 851256735 /nfs/dbraw/zinc/25/67/35/851256735.db2.gz MFNVPFHINOJKMS-FQEVSTJZSA-N 0 3 418.415 4.382 20 0 HIADHN COc1ccc([C@H](NC(=O)NC[C@@H](c2ccccc2)N(C)C)c2ccccc2)cc1 ZINC000060954424 851257385 /nfs/dbraw/zinc/25/73/85/851257385.db2.gz WISNVAHRGDGFOJ-BJKOFHAPSA-N 0 3 403.526 4.387 20 0 HIADHN CN(Cc1cc(Br)cs1)C[C@H](O)COCc1ccccc1Cl ZINC000061042522 851281800 /nfs/dbraw/zinc/28/18/00/851281800.db2.gz PTTJAAALEQASJR-AWEZNQCLSA-N 0 3 404.757 4.174 20 0 HIADHN COc1ccc2ccccc2c1CNC(=O)c1ccc(N2CCN(C(C)C)CC2)cc1 ZINC000061137976 851301884 /nfs/dbraw/zinc/30/18/84/851301884.db2.gz RIFHBNBXTZHYGN-UHFFFAOYSA-N 0 3 417.553 4.309 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N(Cc1cccc(Cl)c1)C(C)C ZINC000437038972 862229164 /nfs/dbraw/zinc/22/91/64/862229164.db2.gz GHGBZCOPTVRSBV-UHFFFAOYSA-N 0 3 401.938 4.086 20 0 HIADHN CCCc1c(C(=O)Nc2ccc(CCN3CCSCC3)cc2)[nH]c(C)c1C(C)=O ZINC000061287475 851338140 /nfs/dbraw/zinc/33/81/40/851338140.db2.gz HPNNRBVPRJOLBC-UHFFFAOYSA-N 0 3 413.587 4.322 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)c1cc(F)cc(Br)c1 ZINC000061287768 851339415 /nfs/dbraw/zinc/33/94/15/851339415.db2.gz FPVMGFFUTGDAAW-UHFFFAOYSA-N 0 3 423.351 4.432 20 0 HIADHN O=C(CSc1ccc(F)c(F)c1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000061288798 851339931 /nfs/dbraw/zinc/33/99/31/851339931.db2.gz ADKRUIUELDNMAL-UHFFFAOYSA-N 0 3 408.539 4.287 20 0 HIADHN Cc1ccc(C)n1-c1nc(CC(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)cs1 ZINC000061502704 851390896 /nfs/dbraw/zinc/39/08/96/851390896.db2.gz HZUPHTJRSNNXEG-QFIPXVFZSA-N 0 3 422.598 4.355 20 0 HIADHN Cc1ccc([C@H](CNC(=O)CCc2cnn(-c3ccccc3)c2)N2CCCC2)cc1 ZINC000061503069 851391579 /nfs/dbraw/zinc/39/15/79/851391579.db2.gz LEBYYAXIMHZFFI-DEOSSOPVSA-N 0 3 402.542 4.067 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000061572379 851408961 /nfs/dbraw/zinc/40/89/61/851408961.db2.gz SIDRETDNCDLMOA-UHFFFAOYSA-N 0 3 420.582 4.333 20 0 HIADHN Cc1cc(C)n(Cc2ccc(C(=O)N(CCCc3ccccc3)CCN(C)C)cc2)n1 ZINC000061638055 851418447 /nfs/dbraw/zinc/41/84/47/851418447.db2.gz LPJZKMNEGDHYFI-UHFFFAOYSA-N 0 3 418.585 4.185 20 0 HIADHN O=C1CCc2cc(NC3CCN(CCC(F)(F)F)CC3)ccc2N1CC(F)(F)F ZINC000437049710 862242477 /nfs/dbraw/zinc/24/24/77/862242477.db2.gz YTDAOMHRBIPDKL-UHFFFAOYSA-N 0 3 423.401 4.357 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2cccc(C(=O)NC(C)(C)C)c2)N2CCCC2)cc1 ZINC000061772284 851446363 /nfs/dbraw/zinc/44/63/63/851446363.db2.gz UHMMRAUONRGQIT-QFIPXVFZSA-N 0 3 422.573 4.482 20 0 HIADHN CCCNC(=O)c1ccc(NC(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)cc1 ZINC000061774913 851447861 /nfs/dbraw/zinc/44/78/61/851447861.db2.gz ICMCYJRGJANULH-QFIPXVFZSA-N 0 3 408.546 4.093 20 0 HIADHN O=C(NCCOc1cccc(Cl)c1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000061791508 851454193 /nfs/dbraw/zinc/45/41/93/851454193.db2.gz JLEBSFVFNDJPQX-UHFFFAOYSA-N 0 3 419.978 4.132 20 0 HIADHN O=C(NCCc1ccc(Cl)s1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000061791370 851454390 /nfs/dbraw/zinc/45/43/90/851454390.db2.gz AHKUOJOEBLQGQX-UHFFFAOYSA-N 0 3 410.008 4.357 20 0 HIADHN CC(C)(CNC(=O)C(=O)Nc1ccc(SC2CCCC2)cc1)N1CCCCC1 ZINC000061866154 851463218 /nfs/dbraw/zinc/46/32/18/851463218.db2.gz PGHBZKRZQYOMBK-UHFFFAOYSA-N 0 3 403.592 4.041 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)C(=O)Nc1ccc(C)c(C(F)(F)F)c1)c1ccccc1 ZINC000061878966 851467620 /nfs/dbraw/zinc/46/76/20/851467620.db2.gz WQHNDOIAKCUXQW-IBGZPJMESA-N 0 3 421.463 4.152 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)Nc1ccc(Br)cc1 ZINC000062368169 851530617 /nfs/dbraw/zinc/53/06/17/851530617.db2.gz BQYGNSMNVDSFJX-UHFFFAOYSA-N 0 3 412.278 4.323 20 0 HIADHN CCN(c1ccc(NC(=O)N(CCN(C)C)Cc2cccc(C#N)c2)cc1)C(C)C ZINC000062374688 851531506 /nfs/dbraw/zinc/53/15/06/851531506.db2.gz DWIPGHWRBZJAKQ-UHFFFAOYSA-N 0 3 407.562 4.389 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)Nc1cccc(N2CCCC2=O)c1 ZINC000062379578 851535227 /nfs/dbraw/zinc/53/52/27/851535227.db2.gz RHTRRNXIEMQMIL-UHFFFAOYSA-N 0 3 414.937 4.063 20 0 HIADHN CC(=O)Nc1ccc(F)c(NC(=O)N(CCN(C)C)Cc2cccc(Cl)c2)c1 ZINC000062385221 851538184 /nfs/dbraw/zinc/53/81/84/851538184.db2.gz QDKBOTZFNCVNRZ-UHFFFAOYSA-N 0 3 406.889 4.033 20 0 HIADHN Cc1ccc(Br)cc1NC(=O)N(CCN(C)C)Cc1cccc(F)c1 ZINC000062399478 851540714 /nfs/dbraw/zinc/54/07/14/851540714.db2.gz CNIMMMJXGVLIJZ-UHFFFAOYSA-N 0 3 408.315 4.492 20 0 HIADHN CC(=O)Nc1ccc(Cl)c(NC(=O)N(CCN(C)C)Cc2cccc(F)c2)c1 ZINC000062404527 851542707 /nfs/dbraw/zinc/54/27/07/851542707.db2.gz SDMNHBGFEKXGFJ-UHFFFAOYSA-N 0 3 406.889 4.033 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)Nc1ccc2c(c1)OC(C)(C)O2 ZINC000062411466 851545805 /nfs/dbraw/zinc/54/58/05/851545805.db2.gz PRPNQTJRSRFPSV-UHFFFAOYSA-N 0 3 403.910 4.443 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)Nc1nnc(C(F)F)s1 ZINC000062411271 851546237 /nfs/dbraw/zinc/54/62/37/851546237.db2.gz NAUBIIVAWBGXRY-UHFFFAOYSA-N 0 3 423.411 4.090 20 0 HIADHN CC[C@@H](NC(=O)N(CCN(C)C)Cc1ccc(F)cc1F)c1ccc(OC)cc1 ZINC000062475353 851558864 /nfs/dbraw/zinc/55/88/64/851558864.db2.gz SFXOOOAJOBMPMN-OAQYLSRUSA-N 0 3 405.489 4.198 20 0 HIADHN COc1ccc([C@H](NC(=O)N(CCN(C)C)Cc2ccc(F)cc2F)C(C)C)cc1 ZINC000062476212 851560366 /nfs/dbraw/zinc/56/03/66/851560366.db2.gz PDCNMSABVYSSTJ-JOCHJYFZSA-N 0 3 419.516 4.444 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)NCc1ccc(N2CCCC2)cc1 ZINC000062487341 851564238 /nfs/dbraw/zinc/56/42/38/851564238.db2.gz OBYSPCKKDOWMJD-UHFFFAOYSA-N 0 3 414.981 4.214 20 0 HIADHN COc1cc(NC(=S)NC2CCN(Cc3ccccc3)CC2)c(OC)cc1Cl ZINC000063143928 851619890 /nfs/dbraw/zinc/61/98/90/851619890.db2.gz GHNHITGGCWFHJF-UHFFFAOYSA-N 0 3 419.978 4.308 20 0 HIADHN CN1CCC(NC(=S)NCCCN2c3ccccc3Sc3ccccc32)CC1 ZINC000063149154 851621232 /nfs/dbraw/zinc/62/12/32/851621232.db2.gz ZEOJNWWHLWVJSH-UHFFFAOYSA-N 0 3 412.628 4.238 20 0 HIADHN CN1CCC(NC(=S)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)CC1 ZINC000063150475 851623718 /nfs/dbraw/zinc/62/37/18/851623718.db2.gz BYDRDKDHVMKVPW-UHFFFAOYSA-N 0 3 400.935 4.385 20 0 HIADHN Cc1ccc(OCCCCNC(=S)NC2CCN(Cc3ccccc3)CC2)cc1 ZINC000063149487 851623855 /nfs/dbraw/zinc/62/38/55/851623855.db2.gz CQNOXIFEIAOZHZ-UHFFFAOYSA-N 0 3 411.615 4.283 20 0 HIADHN O=C(NCCc1cccs1)C1CCN(Cc2ccc(OC(F)(F)F)cc2)CC1 ZINC000063301247 851654562 /nfs/dbraw/zinc/65/45/62/851654562.db2.gz YYVXOGCSMMQAJT-UHFFFAOYSA-N 0 3 412.477 4.218 20 0 HIADHN CCCCOc1ccc(CNCc2ccc(S(=O)(=O)N(C)C(C)C)cc2)cc1 ZINC000063546363 851711946 /nfs/dbraw/zinc/71/19/46/851711946.db2.gz GCTYFLBFYINCOH-UHFFFAOYSA-N 0 3 404.576 4.184 20 0 HIADHN O[C@H](COc1cccc(C(F)(F)F)c1)CN(Cc1ccccc1)C[C@@H]1CCCO1 ZINC000063559268 851713766 /nfs/dbraw/zinc/71/37/66/851713766.db2.gz PIDIPTWEXRJVCW-FPOVZHCZSA-N 0 3 409.448 4.126 20 0 HIADHN C[C@@H]1CN(C(=O)c2ccc(CNCc3cc(Br)cs3)cc2)C[C@@H](C)O1 ZINC000063561018 851714843 /nfs/dbraw/zinc/71/48/43/851714843.db2.gz QKIBLKFZTOCBMT-ZIAGYGMSSA-N 0 3 423.376 4.050 20 0 HIADHN CCc1ccc2c(CN3CCC[C@@H](CNC(=O)OC(C)(C)C)C3)cc(=O)oc2c1 ZINC000063626484 851728963 /nfs/dbraw/zinc/72/89/63/851728963.db2.gz WURCDRUHIJUOLD-KRWDZBQOSA-N 0 3 400.519 4.092 20 0 HIADHN Cc1nn(Cc2ccccc2Cl)c(Cl)c1C(=O)N1CCCN(C(C)(C)C)CC1 ZINC000063725022 851749199 /nfs/dbraw/zinc/74/91/99/851749199.db2.gz KUFZYFVMGIBWNT-UHFFFAOYSA-N 0 3 423.388 4.493 20 0 HIADHN COc1ccc(NC(=S)N(CCN(C)C)Cc2ccc(Br)cc2)cc1 ZINC000063790062 851764562 /nfs/dbraw/zinc/76/45/62/851764562.db2.gz HSVGLLWYGLAHDT-UHFFFAOYSA-N 0 3 422.392 4.218 20 0 HIADHN O=C(NCc1ccco1)Nc1ccc(NC(=O)c2cccc(CN3CCCC3)c2)cc1 ZINC000063915012 851792441 /nfs/dbraw/zinc/79/24/41/851792441.db2.gz SXVOSPJVINCKGR-UHFFFAOYSA-N 0 3 418.497 4.449 20 0 HIADHN COC(=O)COc1c(C)cc(CNCc2ccc(Oc3ccc(F)cc3)nc2)cc1C ZINC000063915144 851792548 /nfs/dbraw/zinc/79/25/48/851792548.db2.gz XJBFQBBMLHLSIO-UHFFFAOYSA-N 0 3 424.472 4.471 20 0 HIADHN C[C@@H](OC(=O)C1CCN(c2ccc(Cl)cc2)C1=O)c1nnc(-c2cccs2)o1 ZINC000064002100 851813056 /nfs/dbraw/zinc/81/30/56/851813056.db2.gz XKBXTVHIBATJLD-BXUZGUMPSA-N 0 3 417.874 4.109 20 0 HIADHN Cc1ccc([C@H](CNC(=O)NCc2ccc(OC(F)F)cc2)N2CCCC2)cc1 ZINC000064237534 851855193 /nfs/dbraw/zinc/85/51/93/851855193.db2.gz FGHBVVPTSVMSLD-FQEVSTJZSA-N 0 3 403.473 4.233 20 0 HIADHN CCN(Cc1ccc(N(C)C)cc1)C(=O)NC[C@@H](c1ccc(C)cc1)N1CCCC1 ZINC000064237546 851855557 /nfs/dbraw/zinc/85/55/57/851855557.db2.gz QXTXNFZORZOTQG-DEOSSOPVSA-N 0 3 408.590 4.430 20 0 HIADHN Cc1ccc(NC(=O)[C@H](c2ccccc2)N2CCC(CCN3CCOCC3)CC2)cc1 ZINC000064344461 851875645 /nfs/dbraw/zinc/87/56/45/851875645.db2.gz AEWJUZDISSVWLV-VWLOTQADSA-N 0 3 421.585 4.109 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=S)NCCc1ccccc1 ZINC000064371322 851880740 /nfs/dbraw/zinc/88/07/40/851880740.db2.gz YJWOUXYOTMJTOV-UHFFFAOYSA-N 0 3 409.521 4.186 20 0 HIADHN Cc1ccc([C@H](CNC(=O)[C@H]2C[C@H]2c2cccc(Br)c2)N(C)C)cc1 ZINC000064497309 851913867 /nfs/dbraw/zinc/91/38/67/851913867.db2.gz UVTRTRACAHJHCE-UFYCRDLUSA-N 0 3 401.348 4.280 20 0 HIADHN Cc1oc(-c2cccs2)nc1C(=O)NC[C@H]1CCCN(Cc2cccs2)C1 ZINC000064521406 851918918 /nfs/dbraw/zinc/91/89/18/851918918.db2.gz BTRBPOPYFQOFMH-OAHLLOKOSA-N 0 3 401.557 4.415 20 0 HIADHN COc1ccc([C@H](CNC(=O)Nc2ccc3c(c2)CCCN3C)N2CCCC2)cc1 ZINC000064561810 851930616 /nfs/dbraw/zinc/93/06/16/851930616.db2.gz CHWVQXGGMNXWNT-QHCPKHFHSA-N 0 3 408.546 4.036 20 0 HIADHN COc1ccc(CN(CC(=O)N2CCc3[nH]c4ccccc4c3C2)[C@H](C)C2CC2)cc1 ZINC000064641465 851944673 /nfs/dbraw/zinc/94/46/73/851944673.db2.gz UORASYWEPRDRHA-GOSISDBHSA-N 0 3 417.553 4.362 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)[C@H]2C[C@H]2c2cccc(Br)c2)o1 ZINC000064666577 851950549 /nfs/dbraw/zinc/95/05/49/851950549.db2.gz GQEASJMTBYHJLT-OALUTQOASA-N 0 3 405.336 4.044 20 0 HIADHN C[C@H](NC(=O)OC(C)(C)C)C(=O)C(C#N)c1nc(-c2c(F)cccc2F)cs1 ZINC000064715163 851965008 /nfs/dbraw/zinc/96/50/08/851965008.db2.gz YHXBAXWJYARABC-QWRGUYRKSA-N 0 3 407.442 4.178 20 0 HIADHN Cc1ccc(-c2n[nH]cc2CNCc2ccc(-n3ccc(C(F)(F)F)n3)cc2)o1 ZINC000065014573 852039873 /nfs/dbraw/zinc/03/98/73/852039873.db2.gz GRBAPBJOBWXMIS-UHFFFAOYSA-N 0 3 401.392 4.472 20 0 HIADHN CCc1nc(CC(=O)NC[C@@H](c2ccc(C(F)(F)F)cc2)N(CC)CC)cs1 ZINC000065121571 852070895 /nfs/dbraw/zinc/07/08/95/852070895.db2.gz WWRVCLMUPVNGJI-KRWDZBQOSA-N 0 3 413.509 4.466 20 0 HIADHN CCN(CC)[C@H](CNC(=O)CCc1c(C)nn(C)c1C)c1ccc(C(F)(F)F)cc1 ZINC000065121806 852071745 /nfs/dbraw/zinc/07/17/45/852071745.db2.gz FFVITCFRIZQKMY-HXUWFJFHSA-N 0 3 424.511 4.188 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1ccc2c(c1)OCCO2)c1ccc(C(F)(F)F)cc1 ZINC000065121945 852072225 /nfs/dbraw/zinc/07/22/25/852072225.db2.gz UJBYYFJYNMOAAY-SFHVURJKSA-N 0 3 422.447 4.290 20 0 HIADHN COc1ccc(C2=NN(C(=O)CN(C)C(C3CC3)C3CC3)[C@H](c3ccco3)C2)cc1 ZINC000065243523 852091929 /nfs/dbraw/zinc/09/19/29/852091929.db2.gz QWPQDDWHSBUTLS-NRFANRHFSA-N 0 3 407.514 4.086 20 0 HIADHN Cc1ccc(NC(=O)N2CCN(CC3CCCCC3)CC2)c(OC[C@H]2CCCO2)c1 ZINC000065416784 852125795 /nfs/dbraw/zinc/12/57/95/852125795.db2.gz POJHONZSNHTNGR-OAQYLSRUSA-N 0 3 415.578 4.283 20 0 HIADHN Cc1noc(C2CCN(C[C@@H](O)CO[C@H](c3ccccc3)c3ccc(C)cc3)CC2)n1 ZINC000065433628 852130690 /nfs/dbraw/zinc/13/06/90/852130690.db2.gz JSDLYONZCXPCCX-DNQXCXABSA-N 0 3 421.541 4.033 20 0 HIADHN Cc1cccc(C(=O)N2CCCC2)c1NC(=O)N[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000065443033 852135159 /nfs/dbraw/zinc/13/51/59/852135159.db2.gz LZMAJYHXFPOLCD-CTNGQTDRSA-N 0 3 420.557 4.188 20 0 HIADHN CCN(CC)C(=O)c1ccc(NC(=O)NCCN(C)Cc2ccccc2)cc1Cl ZINC000065443086 852135205 /nfs/dbraw/zinc/13/52/05/852135205.db2.gz LFIAPRMWCFCDJL-UHFFFAOYSA-N 0 3 416.953 4.076 20 0 HIADHN Cc1ccc(NC(=O)C2CC2)cc1NC(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000065446172 852136602 /nfs/dbraw/zinc/13/66/02/852136602.db2.gz XNRWEGFFCYHMFU-UWJYYQICSA-N 0 3 406.530 4.301 20 0 HIADHN Cc1ccc([C@H](CNC(=O)NCc2cccc(OCC(F)(F)F)c2)N(C)C)cc1 ZINC000065469877 852145190 /nfs/dbraw/zinc/14/51/90/852145190.db2.gz ZTYXJANTWKTMEJ-IBGZPJMESA-N 0 3 409.452 4.038 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)Nc1cccc(COCC2CC2)c1 ZINC000065472765 852147298 /nfs/dbraw/zinc/14/72/98/852147298.db2.gz XHEOFOWXFLHRPH-UHFFFAOYSA-N 0 3 403.592 4.096 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N[C@@H](C)c2ccc(NC(=O)C3CC3)cc2)C1 ZINC000065522667 852166727 /nfs/dbraw/zinc/16/67/27/852166727.db2.gz AVRMUYOCUOUYCV-IXFSTUDKSA-N 0 3 420.557 4.231 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N[C@H](c2ccc(F)cc2)[C@@H]2CCCO2)C1 ZINC000065521167 852167347 /nfs/dbraw/zinc/16/73/47/852167347.db2.gz MQAUGJCNQLMOCV-LMDOGRNLSA-N 0 3 411.521 4.181 20 0 HIADHN CC(C)N(C(=O)CNC1(c2cccc(Br)c2)CCOCC1)C1CCCC1 ZINC000065604529 852197124 /nfs/dbraw/zinc/19/71/24/852197124.db2.gz MUPXJFFUDZNCJF-UHFFFAOYSA-N 0 3 423.395 4.224 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=S)NCCc1ccccc1 ZINC000065704458 852226290 /nfs/dbraw/zinc/22/62/90/852226290.db2.gz RIKAMWVDDBNDPN-UHFFFAOYSA-N 0 3 409.521 4.186 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3nc(-c4ccccc4)ns3)c(C)c2)CC1 ZINC000065775188 852251927 /nfs/dbraw/zinc/25/19/27/852251927.db2.gz YONOYKOOZYPLKF-UHFFFAOYSA-N 0 3 422.558 4.299 20 0 HIADHN CN(C)CCN(Cc1cccc(C#N)c1)C(=S)Nc1cccc(C(F)(F)F)c1 ZINC000065850260 852283554 /nfs/dbraw/zinc/28/35/54/852283554.db2.gz FCMXZLRHJDBBKQ-UHFFFAOYSA-N 0 3 406.477 4.338 20 0 HIADHN C[C@H](NCc1cccc(OCc2ccccc2)c1)c1ccc(NS(C)(=O)=O)cc1 ZINC000065932797 852322290 /nfs/dbraw/zinc/32/22/90/852322290.db2.gz KPLUTUFELSEHIV-SFHVURJKSA-N 0 3 410.539 4.488 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)c1[nH]c2ccccc2c1Br ZINC000065931567 852322610 /nfs/dbraw/zinc/32/26/10/852322610.db2.gz TWXTWDZDYVMIKT-UHFFFAOYSA-N 0 3 418.310 4.274 20 0 HIADHN COc1ccc(OC)c(CCNCc2c(C)nn(Cc3ccc(F)cc3)c2Cl)c1 ZINC000065934078 852323095 /nfs/dbraw/zinc/32/30/95/852323095.db2.gz UODKBCDLRFWRBB-UHFFFAOYSA-N 0 3 417.912 4.382 20 0 HIADHN COc1cc(C(=O)N(CCN(C)C)Cc2cccc(Cl)c2)ccc1OC(F)F ZINC000065937142 852325031 /nfs/dbraw/zinc/32/50/31/852325031.db2.gz ZBSKCCPZXLAQJN-UHFFFAOYSA-N 0 3 412.864 4.154 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)Cc1cn(C)c2ccccc12 ZINC000065936313 852325230 /nfs/dbraw/zinc/32/52/30/852325230.db2.gz LRWFSKMFKMTIRI-UHFFFAOYSA-N 0 3 417.475 4.330 20 0 HIADHN Cc1nn(CC(C)C)c(C)c1CCC(=O)N(CCN(C)C)Cc1cccc(Cl)c1 ZINC000065936994 852325338 /nfs/dbraw/zinc/32/53/38/852325338.db2.gz OSMUXCMUXZFUIW-UHFFFAOYSA-N 0 3 419.013 4.332 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)c1ccc(OCC(F)(F)F)cc1 ZINC000065937854 852326073 /nfs/dbraw/zinc/32/60/73/852326073.db2.gz QZAJDZTVSUKQFC-UHFFFAOYSA-N 0 3 416.390 4.110 20 0 HIADHN CCOc1ccc(C(=O)N(CCN(C)C)Cc2cccc(Cl)c2)cc1OCC ZINC000065937241 852326596 /nfs/dbraw/zinc/32/65/96/852326596.db2.gz SDSSTLLOBHDGRU-UHFFFAOYSA-N 0 3 404.938 4.341 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)c1ccc(Br)cc1F ZINC000065937931 852326737 /nfs/dbraw/zinc/32/67/37/852326737.db2.gz RIHKMLFAOXNFPQ-UHFFFAOYSA-N 0 3 415.253 4.070 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)c1cc(Br)c[nH]1 ZINC000065939006 852327852 /nfs/dbraw/zinc/32/78/52/852327852.db2.gz VPYGSMJWRUMASD-UHFFFAOYSA-N 0 3 418.257 4.000 20 0 HIADHN C[C@@H](C(=O)N1CCN(c2ccccc2)CC1)N1CCC(c2cc3ccccc3[nH]2)CC1 ZINC000065966088 852335472 /nfs/dbraw/zinc/33/54/72/852335472.db2.gz DWLWCMOLDDJKEK-FQEVSTJZSA-N 0 3 416.569 4.085 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)Nc1ccc2c(c1)OCCO2 ZINC000065984152 852339710 /nfs/dbraw/zinc/33/97/10/852339710.db2.gz UXAGGIGREPGDKY-UHFFFAOYSA-N 0 3 423.435 4.072 20 0 HIADHN COc1ccc2cc(CNC(=O)N(CCN(C)C)Cc3cccc(F)c3)ccc2c1 ZINC000065984225 852339902 /nfs/dbraw/zinc/33/99/02/852339902.db2.gz UPQANFGSJOBCJG-UHFFFAOYSA-N 0 3 409.505 4.261 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)Nc1nnc(C2CC2)s1 ZINC000065984159 852339958 /nfs/dbraw/zinc/33/99/58/852339958.db2.gz AQNROJRFHYKBRL-UHFFFAOYSA-N 0 3 413.469 4.030 20 0 HIADHN COc1cc(C(=O)NC[C@@H](c2ccccc2)N(C)C)cc(Cl)c1OCC(C)C ZINC000069344215 852393179 /nfs/dbraw/zinc/39/31/79/852393179.db2.gz LUGJKYZMEJULQN-IBGZPJMESA-N 0 3 404.938 4.416 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1ccc(Br)s1)c1cccc(OC)c1 ZINC000071812076 852408901 /nfs/dbraw/zinc/40/89/01/852408901.db2.gz WFGLCDGRZHBFJV-OAHLLOKOSA-N 0 3 411.365 4.332 20 0 HIADHN O=C(NCc1ccc(OC2CCCC2)nc1)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000071919670 852431127 /nfs/dbraw/zinc/43/11/27/852431127.db2.gz VJPNJLDOIOFKRT-QFIPXVFZSA-N 0 3 408.546 4.039 20 0 HIADHN COc1ccc(OCCC[NH+]2CCC(C(=O)Nc3cc(Cl)ccc3[O-])CC2)cc1 ZINC000071957787 852446469 /nfs/dbraw/zinc/44/64/69/852446469.db2.gz VOQZNEWASNOSOJ-UHFFFAOYSA-N 0 3 418.921 4.174 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@H](c1ccc(F)cc1)[C@@H]1CCCO1)c1ccsc1 ZINC000071999377 852457842 /nfs/dbraw/zinc/45/78/42/852457842.db2.gz VXHOKXOPYOHGDG-QHAWAJNXSA-N 0 3 419.566 4.490 20 0 HIADHN COc1cccc(CN2CCC(NC(=O)COc3cc(C)ccc3C(C)C)CC2)c1 ZINC000072005157 852460090 /nfs/dbraw/zinc/46/00/90/852460090.db2.gz GJMAROALPGGKRG-UHFFFAOYSA-N 0 3 410.558 4.287 20 0 HIADHN CCOC(=O)/C=C/c1ccc(NC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)cc1 ZINC000072035511 852478179 /nfs/dbraw/zinc/47/81/79/852478179.db2.gz XCONMECMQUQWSG-YPNIWSFNSA-N 0 3 410.489 4.253 20 0 HIADHN COc1ccc(OC)c([C@H]2CCCN2C(=O)NC[C@H](c2ccc(C)cc2)N(C)C)c1 ZINC000072044331 852484646 /nfs/dbraw/zinc/48/46/46/852484646.db2.gz VZGBYTASOCBGAD-FGZHOGPDSA-N 0 3 411.546 4.162 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N(C)Cc2ccc(Br)s2)N(C)C)cc1 ZINC000072044321 852484814 /nfs/dbraw/zinc/48/48/14/852484814.db2.gz KRQWQOAYGYUWJD-MRXNPFEDSA-N 0 3 410.381 4.263 20 0 HIADHN COCCN(CCN(C)C)C(=O)c1cc(-c2ccc(Cl)cc2)nc2ccccc21 ZINC000078512040 852517960 /nfs/dbraw/zinc/51/79/60/852517960.db2.gz BJDARJOYGIOEQV-UHFFFAOYSA-N 0 3 411.933 4.205 20 0 HIADHN C[C@@H](CN1CCN(C)CC1)Nc1nc(C2CC2)nc2scc(-c3ccccc3)c21 ZINC000078604236 852519476 /nfs/dbraw/zinc/51/94/76/852519476.db2.gz LHKRLEQXMYZEBD-INIZCTEOSA-N 0 3 407.587 4.284 20 0 HIADHN CN(C)[C@H](CNC(=O)COc1ccccc1OCc1ccccc1)c1ccccc1 ZINC000078658147 852524128 /nfs/dbraw/zinc/52/41/28/852524128.db2.gz NCOSGAPRMRQFQN-JOCHJYFZSA-N 0 3 404.510 4.064 20 0 HIADHN CN(C)[C@@H](CNC(=O)COc1ccccc1OCc1ccccc1)c1ccccc1 ZINC000078658143 852524308 /nfs/dbraw/zinc/52/43/08/852524308.db2.gz NCOSGAPRMRQFQN-QFIPXVFZSA-N 0 3 404.510 4.064 20 0 HIADHN CCOc1ccc(NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)cc1OCC ZINC000096626850 852552845 /nfs/dbraw/zinc/55/28/45/852552845.db2.gz RWPYCYIQHDIEKD-GOSISDBHSA-N 0 3 400.494 4.474 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cccc4c5c([nH]c43)CCCC5)cc2)CC1 ZINC000096604203 852553066 /nfs/dbraw/zinc/55/30/66/852553066.db2.gz PWKPCWBUZIWKEG-UHFFFAOYSA-N 0 3 402.542 4.441 20 0 HIADHN CCc1ccccc1N(C(C)=O)c1nc(CN2CCN(CC(C)C)CC2)cs1 ZINC000096955300 852562046 /nfs/dbraw/zinc/56/20/46/852562046.db2.gz XCGZALKTDOUJDE-UHFFFAOYSA-N 0 3 400.592 4.164 20 0 HIADHN CC(C)c1ccc(-c2ncc(CN3CCC[C@@H](C(=O)N4CCOCC4)C3)s2)cc1 ZINC000097024897 852574440 /nfs/dbraw/zinc/57/44/40/852574440.db2.gz TYYNPBFVTNIMTJ-HXUWFJFHSA-N 0 3 413.587 4.004 20 0 HIADHN O=C(NCc1ccc(Br)s1)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000097206259 852589621 /nfs/dbraw/zinc/58/96/21/852589621.db2.gz XKZFHVJOKFGBQF-INIZCTEOSA-N 0 3 408.365 4.147 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)[C@H]1C[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000097261429 852593758 /nfs/dbraw/zinc/59/37/58/852593758.db2.gz UGLVFNSQTKJVJR-MSOLQXFVSA-N 0 3 412.521 4.287 20 0 HIADHN CC(C)[C@@H](NC(=O)N[C@H](CN1CCCC1)c1ccccc1)c1nc2ccccc2[nH]1 ZINC000097394684 852607892 /nfs/dbraw/zinc/60/78/92/852607892.db2.gz FUEUXJYQUNMUDK-FGZHOGPDSA-N 0 3 405.546 4.396 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cc(C)ccc1N1CCCC1)c1cccc(OC)c1 ZINC000097573916 852635107 /nfs/dbraw/zinc/63/51/07/852635107.db2.gz XYGYYYCIPWOZII-DEOSSOPVSA-N 0 3 409.574 4.417 20 0 HIADHN Cc1noc2nc(-c3ccc(F)cc3)cc(C(=O)NC[C@H](c3ccccc3)N(C)C)c12 ZINC000105435589 852705408 /nfs/dbraw/zinc/70/54/08/852705408.db2.gz GSWFSBFMMZMMBK-OAQYLSRUSA-N 0 3 418.472 4.370 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)c2cc(Cl)cc(Br)c2)CC1 ZINC000437193900 862386445 /nfs/dbraw/zinc/38/64/45/862386445.db2.gz JOZUQCAENHPTEH-UHFFFAOYSA-N 0 3 411.727 4.432 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)C(=O)Nc3c(C)cccc3C(C)C)c(C)c2)CC1 ZINC000437197121 862387744 /nfs/dbraw/zinc/38/77/44/862387744.db2.gz WJJFNCGTBSVJKI-UHFFFAOYSA-N 0 3 422.573 4.146 20 0 HIADHN Cc1cccc(-c2nnc(-c3ccc(C(=O)NCCN4CCC[C@H](C)C4)cc3)o2)c1 ZINC000107632891 852783384 /nfs/dbraw/zinc/78/33/84/852783384.db2.gz BTECAFRFROVWSH-SFHVURJKSA-N 0 3 404.514 4.174 20 0 HIADHN CC(C)[C@H]1CN(C(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)CCS1 ZINC000437202342 862392903 /nfs/dbraw/zinc/39/29/03/862392903.db2.gz LLVYMEXRNLHCMC-IEBWSBKVSA-N 0 3 400.510 4.041 20 0 HIADHN CC(C)OCc1ccccc1CNC(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000107695573 852787430 /nfs/dbraw/zinc/78/74/30/852787430.db2.gz ZSUFCNQCZDGRDJ-HXUWFJFHSA-N 0 3 401.576 4.309 20 0 HIADHN CC(=O)Nc1ccc(OC[C@@H](O)CN(Cc2ccccc2C(F)(F)F)C2CC2)cc1 ZINC000108086889 852821859 /nfs/dbraw/zinc/82/18/59/852821859.db2.gz NIBUWRLZILWWHI-IBGZPJMESA-N 0 3 422.447 4.068 20 0 HIADHN Cc1nn(C)c2nc(-c3ccccc3)cc(C(=O)N3CCN(CCC(C)(C)C)CC3)c12 ZINC000108396544 852846294 /nfs/dbraw/zinc/84/62/94/852846294.db2.gz VOCVOKWXXBWORV-UHFFFAOYSA-N 0 3 419.573 4.138 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)c1cccc(OCc2cscn2)c1 ZINC000108680404 852871314 /nfs/dbraw/zinc/87/13/14/852871314.db2.gz CDWQQTZMEWNCAN-UHFFFAOYSA-N 0 3 413.518 4.065 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)c1ccnc(OCc2ccccc2)c1 ZINC000108756801 852877439 /nfs/dbraw/zinc/87/74/39/852877439.db2.gz IEFYDIQBLFURCF-QHCPKHFHSA-N 0 3 401.510 4.228 20 0 HIADHN O=C(NC1CCN(Cc2c(-c3ccccc3)nc3ccccn32)CC1)c1ccsc1 ZINC000108980490 852903505 /nfs/dbraw/zinc/90/35/05/852903505.db2.gz AJEZFWXOTRUPBV-UHFFFAOYSA-N 0 3 416.550 4.457 20 0 HIADHN Cc1nn(-c2cccc(Cl)c2)c(Cl)c1CNCCc1nnc2n1CCCCC2 ZINC000109213143 852936981 /nfs/dbraw/zinc/93/69/81/852936981.db2.gz YXIMIERDWZKSMJ-UHFFFAOYSA-N 0 3 419.360 4.138 20 0 HIADHN CCC(=O)Nc1ccc(C)c(NC(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)c1 ZINC000109219633 852937978 /nfs/dbraw/zinc/93/79/78/852937978.db2.gz OKCQWFMDTDVNFV-UHFFFAOYSA-N 0 3 408.546 4.126 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)CC1CCN(C(=O)OC(C)(C)C)CC1)c1ccsc1 ZINC000109292966 852948303 /nfs/dbraw/zinc/94/83/03/852948303.db2.gz IOOBURNCQALRHS-IBGZPJMESA-N 0 3 423.623 4.284 20 0 HIADHN CN(Cc1ccc(Br)cc1)C(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000109338762 852955002 /nfs/dbraw/zinc/95/50/02/852955002.db2.gz JHVAYJNIKGUYBF-SFHVURJKSA-N 0 3 419.338 4.459 20 0 HIADHN Cc1cc(C(=O)Nc2ccc3oc(=O)n(CCN(C)C)c3c2)c(C)n1C1CCCCC1 ZINC000109466038 852973975 /nfs/dbraw/zinc/97/39/75/852973975.db2.gz WJFJEJSCWTWGIT-UHFFFAOYSA-N 0 3 424.545 4.332 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2cc(F)ccc2Br)N2CCCC2)cc1 ZINC000109503839 852978055 /nfs/dbraw/zinc/97/80/55/852978055.db2.gz SHZPEDTXWANMEG-IBGZPJMESA-N 0 3 405.311 4.464 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1 ZINC000109770648 853011768 /nfs/dbraw/zinc/01/17/68/853011768.db2.gz IGVKFHUJLPXETN-VQTJNVASSA-N 0 3 419.338 4.282 20 0 HIADHN CN(C(=O)c1ccc(-c2ccc(F)cc2)o1)C1CCN(CCc2ccccn2)CC1 ZINC000109795255 853015982 /nfs/dbraw/zinc/01/59/82/853015982.db2.gz RNGZEIRYPVBFFB-UHFFFAOYSA-N 0 3 407.489 4.260 20 0 HIADHN COc1ccc(N(C)C(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)cc1OC ZINC000110121490 853062607 /nfs/dbraw/zinc/06/26/07/853062607.db2.gz BOFGNAYAJQMCDL-OAQYLSRUSA-N 0 3 422.447 4.121 20 0 HIADHN Cc1nc(-c2ccccc2)ccc1C(=O)N1CCC(CN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000110413822 853096662 /nfs/dbraw/zinc/09/66/62/853096662.db2.gz YPKLALQJHXPVQW-OALUTQOASA-N 0 3 407.558 4.018 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)c3ccc4[nH]c5c(c4c3)CCCC5)CC2)C[C@H](C)O1 ZINC000110458792 853102545 /nfs/dbraw/zinc/10/25/45/853102545.db2.gz VDYTTWIROBKMFR-ROUUACIJSA-N 0 3 409.574 4.008 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1ccc2[nH]c(C(F)F)nc2c1)c1cccc(OC)c1 ZINC000110674578 853136581 /nfs/dbraw/zinc/13/65/81/853136581.db2.gz ATFWXJCZZBWDFO-LJQANCHMSA-N 0 3 416.472 4.322 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3cc(Cl)cc(Cl)c3)CC2)C[C@H](C)O1 ZINC000110715655 853142521 /nfs/dbraw/zinc/14/25/21/853142521.db2.gz ZULDPTTVXAJXHB-OKILXGFUSA-N 0 3 400.350 4.347 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)Nc3cc(Cl)cc(Cl)c3)CC2)C[C@H](C)O1 ZINC000110715658 853142624 /nfs/dbraw/zinc/14/26/24/853142624.db2.gz ZULDPTTVXAJXHB-KBPBESRZSA-N 0 3 400.350 4.347 20 0 HIADHN CN(CCN1CCCC1)C(=O)c1ccccc1Oc1cccc(Br)c1 ZINC000110908813 853167194 /nfs/dbraw/zinc/16/71/94/853167194.db2.gz SGXBDMJWWLXCCL-UHFFFAOYSA-N 0 3 403.320 4.409 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)[C@@H](c2ccccc2)N2CCCCC2=O)N2CCCC2)cc1 ZINC000111199196 853220649 /nfs/dbraw/zinc/22/06/49/853220649.db2.gz APQYQQWLAOTWOG-ILBGXUMGSA-N 0 3 419.569 4.002 20 0 HIADHN C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCCCN1Cc1ccc(C(=O)N2CCCC2)cc1 ZINC000116498346 853308956 /nfs/dbraw/zinc/30/89/56/853308956.db2.gz WGACGBHUMDXMOG-RXVVDRJESA-N 0 3 415.578 4.190 20 0 HIADHN O=C(NC1CCN(Cc2ccc(OCc3cccnc3)cc2)CC1)c1ccccc1 ZINC000139197661 853404847 /nfs/dbraw/zinc/40/48/47/853404847.db2.gz PSJVIALUADBINJ-UHFFFAOYSA-N 0 3 401.510 4.055 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2ccccc2N2CCCC2=O)N2CCCC2)cc1 ZINC000139275163 853407416 /nfs/dbraw/zinc/40/74/16/853407416.db2.gz WILOGMAGPBMVHN-JOCHJYFZSA-N 0 3 406.530 4.080 20 0 HIADHN Cc1ccc(Cl)cc1NC(=O)[C@@H](C)N[C@H](C)c1ccc(N2CCOCC2)cc1 ZINC000140194638 853437725 /nfs/dbraw/zinc/43/77/25/853437725.db2.gz ZACRFPJHXFZGEI-IAGOWNOFSA-N 0 3 401.938 4.163 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(N2CCOCC2)cc1)C(=O)Nc1ccc2ccccc2c1 ZINC000140202453 853437883 /nfs/dbraw/zinc/43/78/83/853437883.db2.gz ZWYVDJLTZIUBIN-OALUTQOASA-N 0 3 403.526 4.354 20 0 HIADHN O=C([C@@H](NCC1(c2ccc(F)cc2)CCOCC1)c1ccccc1)N1CCCCC1 ZINC000140279557 853441142 /nfs/dbraw/zinc/44/11/42/853441142.db2.gz VXCHKAGQGKVYDX-QHCPKHFHSA-N 0 3 410.533 4.217 20 0 HIADHN Cc1ccc2nc([C@H]3CCCN3C(=O)NC[C@@H](c3ccc(F)cc3)N(C)C)[nH]c2c1 ZINC000140958722 853458712 /nfs/dbraw/zinc/45/87/12/853458712.db2.gz KMVIIDKCSOPXAT-RTWAWAEBSA-N 0 3 409.509 4.160 20 0 HIADHN C[C@@H](NCc1ccc(OCc2ccccn2)cc1)c1cccc(N2CCOC2=O)c1 ZINC000142694231 853497988 /nfs/dbraw/zinc/49/79/88/853497988.db2.gz BAJRNZIODDXADQ-GOSISDBHSA-N 0 3 403.482 4.468 20 0 HIADHN O=C(CN1CCC[C@@H]1c1cccc2ccccc21)Nc1ccc(N2CCOCC2)cc1 ZINC000142728352 853498561 /nfs/dbraw/zinc/49/85/61/853498561.db2.gz NVSWKCTXNWYUPZ-RUZDIDTESA-N 0 3 415.537 4.452 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=S)Nc2c(C(C)C)cccc2C(C)C)CC1 ZINC000145284248 853548619 /nfs/dbraw/zinc/54/86/19/853548619.db2.gz RTMPAQFQRCPLPM-IBGZPJMESA-N 0 3 404.668 4.493 20 0 HIADHN CC(=O)Nc1ccc(NC(=S)NC2CCN(Cc3ccccc3)CC2)cc1Cl ZINC000145528225 853552434 /nfs/dbraw/zinc/55/24/34/853552434.db2.gz PXNROYYTNCPHIC-UHFFFAOYSA-N 0 3 416.978 4.249 20 0 HIADHN COc1ccc(NC(=O)C(C#N)C(=O)c2sc(C(C)(C)C)nc2C)cc1Cl ZINC000147138948 853583187 /nfs/dbraw/zinc/58/31/87/853583187.db2.gz DHDOIBCWMXKFQP-GFCCVEGCSA-N 0 3 405.907 4.372 20 0 HIADHN COc1cc(NC(=O)Nc2cccc(CN(C)C)c2)ccc1NC(=O)c1cccnc1 ZINC000150245255 853641808 /nfs/dbraw/zinc/64/18/08/853641808.db2.gz HIMMGETUSRCRSI-UHFFFAOYSA-N 0 3 419.485 4.048 20 0 HIADHN C[C@@H]1CN(C(=O)c2ccc(CNCc3ccccc3C(F)(F)F)cc2)C[C@H](C)O1 ZINC000165979369 853653613 /nfs/dbraw/zinc/65/36/13/853653613.db2.gz WKLAFDUSXUYZHL-IYBDPMFKSA-N 0 3 406.448 4.245 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)c2cc(Cl)ccc2Br)CC1 ZINC000195540977 853674517 /nfs/dbraw/zinc/67/45/17/853674517.db2.gz CSZBKJZVCFYVAO-UHFFFAOYSA-N 0 3 411.727 4.432 20 0 HIADHN Cc1[nH]c2ccccc2c1C1CCN(C(=O)NCCN(C)Cc2ccccc2)CC1 ZINC000195614389 853715004 /nfs/dbraw/zinc/71/50/04/853715004.db2.gz SWIHGKOPVWAAIC-UHFFFAOYSA-N 0 3 404.558 4.497 20 0 HIADHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)N[C@H]1CCCc2occc21 ZINC000195635281 853728985 /nfs/dbraw/zinc/72/89/85/853728985.db2.gz JQDHOINXBOBUOA-SFHVURJKSA-N 0 3 420.351 4.193 20 0 HIADHN C[C@@H](NC[C@H](O)COc1ccccc1F)c1cccc(NC(=O)c2ccccc2)c1 ZINC000195662312 853744088 /nfs/dbraw/zinc/74/40/88/853744088.db2.gz KRJYGCVROKUEEF-UTKZUKDTSA-N 0 3 408.473 4.169 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cc(C)nc2onc(C(C)C)c21)c1cccc(OC)c1 ZINC000195691203 853761145 /nfs/dbraw/zinc/76/11/45/853761145.db2.gz LTCZZMDYTYHGIA-FQEVSTJZSA-N 0 3 424.545 4.476 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3cccc(NC(=O)C4CC4)c3)c(C)c2)CC1 ZINC000195700898 853767496 /nfs/dbraw/zinc/76/74/96/853767496.db2.gz VTEJCDVHCRGXKX-UHFFFAOYSA-N 0 3 421.545 4.129 20 0 HIADHN CCOC(=O)/C=C\c1ccc(NC(=O)NC[C@@H](c2ccccc2)N2CCCC2)cc1 ZINC000206818877 853799518 /nfs/dbraw/zinc/79/95/18/853799518.db2.gz QGWNHAACFPUFDC-QKWZMAAQSA-N 0 3 407.514 4.222 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)/C=C\c1ccc2c(c1)OCO2 ZINC000207671598 853803797 /nfs/dbraw/zinc/80/37/97/853803797.db2.gz QYSFZKHOROPDGR-POHAHGRESA-N 0 3 420.431 4.038 20 0 HIADHN Cc1cc(C)n(-c2ccc(CN3CCC(NC(=O)c4ccc(C)s4)CC3)cc2)n1 ZINC000215899943 853839446 /nfs/dbraw/zinc/83/94/46/853839446.db2.gz PWLWTAKXVSJRBE-UHFFFAOYSA-N 0 3 408.571 4.253 20 0 HIADHN Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000215958880 853841328 /nfs/dbraw/zinc/84/13/28/853841328.db2.gz OAINJBVIBDTLRZ-QHCPKHFHSA-N 0 3 422.573 4.339 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)CCc2ncc(-c3ccccc3F)o2)C1 ZINC000227382717 853886044 /nfs/dbraw/zinc/88/60/44/853886044.db2.gz SLGRPKODHWTOPM-PKOBYXMFSA-N 0 3 407.489 4.365 20 0 HIADHN O=[N+]([O-])c1ccc(-c2ccc(CNCCOc3cccnc3)o2)c(Br)c1 ZINC000236568552 853898871 /nfs/dbraw/zinc/89/88/71/853898871.db2.gz WLVGKGCPKHLNFC-UHFFFAOYSA-N 0 3 418.247 4.181 20 0 HIADHN CC(=O)Nc1ccc(CCNCc2c(C)nn(Cc3ccc(F)cc3)c2Cl)cc1 ZINC000236597547 853901495 /nfs/dbraw/zinc/90/14/95/853901495.db2.gz UIMLCECGKSEWDQ-UHFFFAOYSA-N 0 3 414.912 4.323 20 0 HIADHN c1c(CNCc2ccc3c(c2)OCCCO3)c(-c2ccncc2)nn1-c1ccccc1 ZINC000236633595 853905904 /nfs/dbraw/zinc/90/59/04/853905904.db2.gz DVCWDFVCGWUTDH-UHFFFAOYSA-N 0 3 412.493 4.385 20 0 HIADHN Cc1ccc([C@H](CNCc2cn(-c3ccccc3)nc2C(C)C)N2CCOCC2)o1 ZINC000236647953 853907097 /nfs/dbraw/zinc/90/70/97/853907097.db2.gz HIFQGCDNUIBLFL-QFIPXVFZSA-N 0 3 408.546 4.060 20 0 HIADHN Brc1cccc(-c2c[nH]c(CNCCc3cnn(-c4ccccc4)c3)n2)c1 ZINC000236661536 853908489 /nfs/dbraw/zinc/90/84/89/853908489.db2.gz HHRKKLBCUALYCK-UHFFFAOYSA-N 0 3 422.330 4.357 20 0 HIADHN CC(C)COc1ccc(CNCc2ccc(S(=O)(=O)N(C)C(C)C)cc2)cc1 ZINC000236682622 853911116 /nfs/dbraw/zinc/91/11/16/853911116.db2.gz FWZHQZDDKRZVIF-UHFFFAOYSA-N 0 3 404.576 4.040 20 0 HIADHN CC(C)COc1ccc(CNCc2ccc(C(=O)N3C[C@@H](C)O[C@@H](C)C3)cc2)cc1 ZINC000236716986 853915536 /nfs/dbraw/zinc/91/55/36/853915536.db2.gz CMCCBXPNJDSGCK-BGYRXZFFSA-N 0 3 410.558 4.261 20 0 HIADHN CC(C)NS(=O)(=O)Cc1ccc(CNCc2ccc(-c3ccccc3)cc2)cc1 ZINC000236729910 853916317 /nfs/dbraw/zinc/91/63/17/853916317.db2.gz DGUYKCDCJJNFEQ-UHFFFAOYSA-N 0 3 408.567 4.471 20 0 HIADHN CC(C)(C)OC(=O)N1CCc2cccc(CNC[C@@](C)(O)c3ccc(F)cc3F)c21 ZINC000236733601 853917373 /nfs/dbraw/zinc/91/73/73/853917373.db2.gz ZAWSQXNHJLYPBW-HSZRJFAPSA-N 0 3 418.484 4.260 20 0 HIADHN CCCCOc1ccc(CNCc2ccc(C(=O)N3C[C@H](C)O[C@@H](C)C3)cc2)cc1 ZINC000236733698 853917381 /nfs/dbraw/zinc/91/73/81/853917381.db2.gz ILVCTEIWAGTJHD-PMACEKPBSA-N 0 3 410.558 4.405 20 0 HIADHN Cc1nn(Cc2ccc(Cl)cc2)c(Cl)c1CNC1CCN(C(=O)C(C)C)CC1 ZINC000236780613 853922513 /nfs/dbraw/zinc/92/25/13/853922513.db2.gz CXKNTDSAGXALCU-UHFFFAOYSA-N 0 3 423.388 4.283 20 0 HIADHN CCOc1cc(CNCc2ccc(N(C)C(=O)c3ccncc3)cc2)ccc1OC ZINC000236865720 853930112 /nfs/dbraw/zinc/93/01/12/853930112.db2.gz PWOWNRZKZDZZID-UHFFFAOYSA-N 0 3 405.498 4.055 20 0 HIADHN CCCNC(=O)c1cccc(CN[C@H](C)CC(=O)Nc2ccccc2C(F)(F)F)c1 ZINC000236887309 853932078 /nfs/dbraw/zinc/93/20/78/853932078.db2.gz OLOJKUJBJPLCER-OAHLLOKOSA-N 0 3 421.463 4.352 20 0 HIADHN CCOc1ccc(CNCc2cn(C)nc2-c2ccc3c(c2)OCCCO3)cc1F ZINC000236970592 853944386 /nfs/dbraw/zinc/94/43/86/853944386.db2.gz ONSUCQGJOPOOEF-UHFFFAOYSA-N 0 3 411.477 4.076 20 0 HIADHN CCNC(=O)c1ccc(CNCc2ccc(OCc3ccccc3)c(OC)c2)cc1 ZINC000236979008 853946499 /nfs/dbraw/zinc/94/64/99/853946499.db2.gz XBHHCVRFTPMBSP-UHFFFAOYSA-N 0 3 404.510 4.314 20 0 HIADHN CCOc1c(CNCCc2coc(-c3ccc(F)cc3)n2)c(C)nn1CC(C)C ZINC000237019082 853952743 /nfs/dbraw/zinc/95/27/43/853952743.db2.gz PMBCNSXNWCZLHB-UHFFFAOYSA-N 0 3 400.498 4.373 20 0 HIADHN Cc1nn(Cc2ccc(Cl)cc2Cl)c(Cl)c1CNCCCC(=O)N(C)C ZINC000237139465 853971592 /nfs/dbraw/zinc/97/15/92/853971592.db2.gz BTIWIKWQQWJVIY-UHFFFAOYSA-N 0 3 417.768 4.158 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)C[C@H](C)NCc1cnn(Cc2ccccc2)c1 ZINC000237147755 853972552 /nfs/dbraw/zinc/97/25/52/853972552.db2.gz LASXDNDUGZHADK-INIZCTEOSA-N 0 3 412.921 4.100 20 0 HIADHN COc1cc(Br)cc(C[NH2+]C[C@H](O)c2c(Cl)cccc2Cl)c1[O-] ZINC000237213284 853983387 /nfs/dbraw/zinc/98/33/87/853983387.db2.gz RQPMTWKWSJEGDQ-ZDUSSCGKSA-N 0 3 421.118 4.293 20 0 HIADHN COc1cc(Br)c(CNC[C@H](c2ccc(C)o2)N2CCCC2)cc1OC ZINC000237220331 853985790 /nfs/dbraw/zinc/98/57/90/853985790.db2.gz LSRPFFSXHGQMQD-QGZVFWFLSA-N 0 3 423.351 4.294 20 0 HIADHN COc1ccc(CNCc2ccc(F)c(CN(C)C)c2)cc1OCc1cccnc1 ZINC000237227075 853986415 /nfs/dbraw/zinc/98/64/15/853986415.db2.gz YEUJOORHGYRCQE-UHFFFAOYSA-N 0 3 409.505 4.160 20 0 HIADHN COc1cc(CNC[C@@H](O)c2c(F)cccc2F)ccc1OCc1cccs1 ZINC000237230311 853986604 /nfs/dbraw/zinc/98/66/04/853986604.db2.gz LXALSQIPNPBPSR-GOSISDBHSA-N 0 3 405.466 4.437 20 0 HIADHN COc1cc(CNC[C@H](O)c2c(F)cccc2F)ccc1OCc1cccs1 ZINC000237269951 853994473 /nfs/dbraw/zinc/99/44/73/853994473.db2.gz LXALSQIPNPBPSR-SFHVURJKSA-N 0 3 405.466 4.437 20 0 HIADHN COc1cc(CNCc2cccc(CN3CCCC3=O)c2)ccc1OCC(F)(F)F ZINC000237275470 853995448 /nfs/dbraw/zinc/99/54/48/853995448.db2.gz HVOWFFDPORRVMW-UHFFFAOYSA-N 0 3 422.447 4.049 20 0 HIADHN COc1cc(CNCc2cccc(-c3cccc(C)c3)c2)cc(Cl)c1OCC(N)=O ZINC000237285217 853997210 /nfs/dbraw/zinc/99/72/10/853997210.db2.gz VGYFELJCIBRVTQ-UHFFFAOYSA-N 0 3 424.928 4.478 20 0 HIADHN COc1ccc(OCc2ccccn2)c(CNC[C@@H](c2ccc(C)o2)N2CCCC2)c1 ZINC000237292808 853999695 /nfs/dbraw/zinc/99/96/95/853999695.db2.gz OFCHMYGZHFDUDI-QHCPKHFHSA-N 0 3 421.541 4.497 20 0 HIADHN COc1cc(CNC2(c3ccc(F)cc3)CCOCC2)cc(Br)c1O ZINC000237342254 854009315 /nfs/dbraw/zinc/00/93/15/854009315.db2.gz WNTRPUCLVUUMBZ-UHFFFAOYSA-N 0 3 410.283 4.098 20 0 HIADHN COc1ccc([C@H](C)NCc2cn(C)nc2-c2ccc3c(c2)OCCCO3)cc1F ZINC000237349539 854010446 /nfs/dbraw/zinc/01/04/46/854010446.db2.gz BUOXWJPQKPTXMA-HNNXBMFYSA-N 0 3 411.477 4.247 20 0 HIADHN COc1ccccc1-c1ccc(CN[C@H](C)c2ccc(S(=O)(=O)N(C)C)cc2)cc1 ZINC000237344226 854010814 /nfs/dbraw/zinc/01/08/14/854010814.db2.gz MDGJOCSFTZVPRH-GOSISDBHSA-N 0 3 424.566 4.463 20 0 HIADHN COc1ccc([C@H](O)CNCc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)cc1 ZINC000237369312 854016970 /nfs/dbraw/zinc/01/69/70/854016970.db2.gz OSPNKJYVUWVURL-OAQYLSRUSA-N 0 3 412.417 4.358 20 0 HIADHN COc1ccc(CNCCc2nc(-c3ccc(Cl)cc3)no2)c(OC(F)F)c1 ZINC000237396268 854022596 /nfs/dbraw/zinc/02/25/96/854022596.db2.gz OALOLMKZMVJDEY-UHFFFAOYSA-N 0 3 409.820 4.332 20 0 HIADHN COc1cc(CN[C@H](C)c2cccc(N3CCOC3=O)c2)ccc1OCC(F)(F)F ZINC000237395531 854022841 /nfs/dbraw/zinc/02/28/41/854022841.db2.gz PHZZQXNJSZOUEZ-CQSZACIVSA-N 0 3 424.419 4.444 20 0 HIADHN COc1ccc(CNCc2ccccc2CN2C[C@H](C)O[C@@H](C)C2)cc1OC(F)F ZINC000237441024 854033617 /nfs/dbraw/zinc/03/36/17/854033617.db2.gz BBQBUJPHUMUTCE-IRXDYDNUSA-N 0 3 420.500 4.196 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(CNC[C@@](C)(O)c3cc(C)oc3C)c2)cc1 ZINC000237465838 854037900 /nfs/dbraw/zinc/03/79/00/854037900.db2.gz SCOXLZMJGTYLKQ-XMMPIXPASA-N 0 3 408.498 4.155 20 0 HIADHN C[C@@](O)(CNCc1cc(Br)ccc1OCc1ccccn1)c1ccco1 ZINC000237465597 854038297 /nfs/dbraw/zinc/03/82/97/854038297.db2.gz DOXGJQDQQVGCJF-HXUWFJFHSA-N 0 3 417.303 4.013 20 0 HIADHN COc1ccc(-c2nn(-c3ccccc3)cc2CNCC[S@@](=O)C(C)(C)C)cc1 ZINC000237496690 854045034 /nfs/dbraw/zinc/04/50/34/854045034.db2.gz KYHXUPDIISKRTI-GDLZYMKVSA-N 0 3 411.571 4.185 20 0 HIADHN C[C@@H]1CN(C(=O)c2ccc(CNCc3ccc(OC(F)(F)F)cc3)cc2)C[C@H](C)O1 ZINC000237547427 854053482 /nfs/dbraw/zinc/05/34/82/854053482.db2.gz UAHSKVGYQODQPI-IYBDPMFKSA-N 0 3 422.447 4.124 20 0 HIADHN C[C@H](NCc1ccc(Br)c([N+](=O)[O-])c1)c1ccc(N2CCOCC2)cc1 ZINC000237583125 854058195 /nfs/dbraw/zinc/05/81/95/854058195.db2.gz UJZDNHZFTBYBBC-AWEZNQCLSA-N 0 3 420.307 4.045 20 0 HIADHN Cc1ccc(NC(=O)C[C@H](C)NCc2cccc(C(=O)NCc3ccco3)c2)c(C)c1 ZINC000237584501 854059849 /nfs/dbraw/zinc/05/98/49/854059849.db2.gz MZGHDNRATPHREP-IBGZPJMESA-N 0 3 419.525 4.333 20 0 HIADHN C[C@@H]1CN(CCCNCc2csc(-c3cccc(Br)c3)n2)C[C@H](C)O1 ZINC000237614871 854062766 /nfs/dbraw/zinc/06/27/66/854062766.db2.gz FKYSTQRZKVIFAJ-GASCZTMLSA-N 0 3 424.408 4.162 20 0 HIADHN Cc1nn(Cc2ccc(Cl)cc2)c(C)c1CNCCNC(=O)c1ccc(C)cc1 ZINC000237629193 854065096 /nfs/dbraw/zinc/06/50/96/854065096.db2.gz CEYAEBHDQKXAIG-UHFFFAOYSA-N 0 3 410.949 4.030 20 0 HIADHN Cc1nccn1-c1ccc(CNCc2cn(-c3ccccc3)nc2-c2cccnc2)cn1 ZINC000237655492 854068584 /nfs/dbraw/zinc/06/85/84/854068584.db2.gz ZPNQEWHLNVBWEL-UHFFFAOYSA-N 0 3 421.508 4.113 20 0 HIADHN Cc1nn(-c2ccc(F)cc2F)c(C)c1CNC[C@](C)(O)c1ccc(F)cc1F ZINC000237791708 854098215 /nfs/dbraw/zinc/09/82/15/854098215.db2.gz CMELRMAZLWWWIX-NRFANRHFSA-N 0 3 407.411 4.043 20 0 HIADHN Cc1nn(C)c(N2CCOCC2)c1CN[C@@H](CCCc1ccccc1)c1ccccc1 ZINC000237827931 854104255 /nfs/dbraw/zinc/10/42/55/854104255.db2.gz GSIRTCDNWTYDPC-VWLOTQADSA-N 0 3 418.585 4.419 20 0 HIADHN Cn1c(CCNCc2cc(Cl)ccc2OC[C@@H]2CCCO2)nc2cc(F)ccc21 ZINC000237852457 854107653 /nfs/dbraw/zinc/10/76/53/854107653.db2.gz VWPJMUHKXJEZOV-SFHVURJKSA-N 0 3 417.912 4.256 20 0 HIADHN Cc1cc([C@](C)(O)CNCc2c(C)nn(Cc3ccc(Cl)cc3)c2C)c(C)o1 ZINC000237879085 854112589 /nfs/dbraw/zinc/11/25/89/854112589.db2.gz UYVGTDWTEWKSEF-JOCHJYFZSA-N 0 3 401.938 4.409 20 0 HIADHN Cc1cc([C@@](C)(O)CNCc2c(C)nn(Cc3ccc(Cl)cc3)c2C)c(C)o1 ZINC000237876609 854112791 /nfs/dbraw/zinc/11/27/91/854112791.db2.gz UYVGTDWTEWKSEF-QFIPXVFZSA-N 0 3 401.938 4.409 20 0 HIADHN O=[N+]([O-])c1ccc(Cl)c(CNC[C@@H](c2cccc(Cl)c2)N2CCOCC2)c1 ZINC000237880752 854113762 /nfs/dbraw/zinc/11/37/62/854113762.db2.gz QXWQWUPXNYZSMW-IBGZPJMESA-N 0 3 410.301 4.065 20 0 HIADHN Cc1nn(Cc2ccc(Cl)cc2)c(C)c1CNCc1ccc(-n2cncn2)cc1 ZINC000237885962 854114714 /nfs/dbraw/zinc/11/47/14/854114714.db2.gz UZZKYOKTIVYATH-UHFFFAOYSA-N 0 3 406.921 4.072 20 0 HIADHN O=C(NC1CCCCC1)N1CCC(NCc2csc(-c3ccsc3)n2)CC1 ZINC000237928385 854120947 /nfs/dbraw/zinc/12/09/47/854120947.db2.gz MYSLSJMISAFGKV-UHFFFAOYSA-N 0 3 404.605 4.468 20 0 HIADHN O=C(CC1CCCCC1)NCCNCc1cn(-c2ccccc2)nc1-c1ccncc1 ZINC000238124838 854145461 /nfs/dbraw/zinc/14/54/61/854145461.db2.gz FWEHVNTVEDCIGO-UHFFFAOYSA-N 0 3 417.557 4.111 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)[C@H]1C[C@H]1c1cccc(Br)c1 ZINC000247442632 854158148 /nfs/dbraw/zinc/15/81/48/854158148.db2.gz XQZZJWLHOMUNLG-SFTDATJTSA-N 0 3 413.359 4.117 20 0 HIADHN COc1ccc(CNC(=O)[C@H](C)N[C@H](Cc2ccccc2)c2ccccc2)cc1OC ZINC000248237741 854186973 /nfs/dbraw/zinc/18/69/73/854186973.db2.gz FJZGRDMRXZSKMB-WMZHIEFXSA-N 0 3 418.537 4.282 20 0 HIADHN Cc1c(C(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)cnn1-c1cccc(Cl)c1 ZINC000250887678 854195475 /nfs/dbraw/zinc/19/54/75/854195475.db2.gz JVFRJFYBDVJGPA-OXQOHEQNSA-N 0 3 408.933 4.399 20 0 HIADHN Cc1ccc(C[C@H]2CCCN2CC(=O)N2CCC[C@H]2c2ccc3c(c2)OCCO3)cc1 ZINC000251496627 854198528 /nfs/dbraw/zinc/19/85/28/854198528.db2.gz VCINOUOQNNORTH-PKTZIBPZSA-N 0 3 420.553 4.137 20 0 HIADHN CCCN(CCN(C)C)C(=O)c1cc(-c2cc(C)oc2C)nc2c1cnn2C(C)C ZINC000261415891 854254505 /nfs/dbraw/zinc/25/45/05/854254505.db2.gz CUUHSGFQDFPYML-UHFFFAOYSA-N 0 3 411.550 4.303 20 0 HIADHN CCCO[C@H]1CCCN(CC(=O)N2Cc3ccccc3[C@H](c3ccccc3)C2)CC1 ZINC000261421077 854256290 /nfs/dbraw/zinc/25/62/90/854256290.db2.gz DMSDAWHTKFMOMT-ZCYQVOJMSA-N 0 3 406.570 4.442 20 0 HIADHN CC(C)CN(C(=O)c1cc2c(cc(Br)cc2F)[nH]1)C1CCN(C)CC1 ZINC000261444402 854264783 /nfs/dbraw/zinc/26/47/83/854264783.db2.gz CFJGBQGJPCLFQJ-UHFFFAOYSA-N 0 3 410.331 4.262 20 0 HIADHN Cc1nn(C)c2ncc(CN(C[C@H](O)COc3cccc4ccccc43)C(C)C)cc12 ZINC000261456395 854269284 /nfs/dbraw/zinc/26/92/84/854269284.db2.gz NTKJJWCXAPOKFD-NRFANRHFSA-N 0 3 418.541 4.080 20 0 HIADHN CCCc1cc(=O)n2nc(NC[C@H](c3cccs3)N3CCC(C)CC3)sc2n1 ZINC000301102475 854296934 /nfs/dbraw/zinc/29/69/34/854296934.db2.gz POVCKILIUSLZBH-MRXNPFEDSA-N 0 3 417.604 4.050 20 0 HIADHN COc1ccc([C@H](CNc2ncnc3nc(SC)sc32)N2CCCC2)cc1 ZINC000301158271 854314417 /nfs/dbraw/zinc/31/44/17/854314417.db2.gz SFHAVZLAZFKLBA-HNNXBMFYSA-N 0 3 401.561 4.066 20 0 HIADHN O=c1[nH]c(N2CCCN(Cc3ccc(C(F)(F)F)cc3)CC2)nc2ccccc21 ZINC000301162082 854316579 /nfs/dbraw/zinc/31/65/79/854316579.db2.gz CJNOBCSTNOTSDS-UHFFFAOYSA-N 0 3 402.420 4.067 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(NC[C@H]3CCC[N@H+](Cc4cccs4)C3)nc2)n1 ZINC000301175435 854320448 /nfs/dbraw/zinc/32/04/48/854320448.db2.gz LZYPSZVMTYUQLW-MRXNPFEDSA-N 0 3 409.559 4.192 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(NC[C@H]3CCC[N@@H+](Cc4cccs4)C3)nc2)n1 ZINC000301175435 854320452 /nfs/dbraw/zinc/32/04/52/854320452.db2.gz LZYPSZVMTYUQLW-MRXNPFEDSA-N 0 3 409.559 4.192 20 0 HIADHN CN(C)[C@@H](CNc1cc(C(F)(F)F)nc(-c2ccncc2)n1)c1ccc(F)cc1 ZINC000301350017 854367673 /nfs/dbraw/zinc/36/76/73/854367673.db2.gz IPBMWUJAYPUDNA-INIZCTEOSA-N 0 3 405.399 4.411 20 0 HIADHN O=c1c(Cl)c(N[C@H](CN2CCCC2)c2ccccc2)cnn1Cc1ccccc1 ZINC000301371801 854373596 /nfs/dbraw/zinc/37/35/96/854373596.db2.gz VMZQHSFLGWUIJC-OAQYLSRUSA-N 0 3 408.933 4.194 20 0 HIADHN CC1CCN([C@H](CNC(=O)/C=C/c2cnc3ccccc3n2)c2cccs2)CC1 ZINC000301383983 854377988 /nfs/dbraw/zinc/37/79/88/854377988.db2.gz DUEDGOSNFHYDAS-MHNQQFQPSA-N 0 3 406.555 4.294 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(Nc2ncnc3ccc(Br)cc32)CC1 ZINC000301797996 854466598 /nfs/dbraw/zinc/46/65/98/854466598.db2.gz RKUIQRCPWHMBKF-AWEZNQCLSA-N 0 3 412.335 4.425 20 0 HIADHN CC(C)(C)OC(=O)N[C@H](CNCc1cncc(Br)c1)c1ccccc1 ZINC000301818682 854469972 /nfs/dbraw/zinc/46/99/72/854469972.db2.gz WLRJZIGZMZTZAD-QGZVFWFLSA-N 0 3 406.324 4.200 20 0 HIADHN COc1cccc([C@H](CNc2ncnc3nc(SC)sc32)N2CCCC2)c1 ZINC000301933836 854496480 /nfs/dbraw/zinc/49/64/80/854496480.db2.gz QYZWUFUBWLSNPY-HNNXBMFYSA-N 0 3 401.561 4.066 20 0 HIADHN C[C@H]1C[C@H](N(C)c2nn3cc(-c4cccnc4)nc3s2)CCN1Cc1ccccc1 ZINC000302152442 854538213 /nfs/dbraw/zinc/53/82/13/854538213.db2.gz HYNCJQJCXAVAQE-FXAWDEMLSA-N 0 3 418.570 4.342 20 0 HIADHN C[C@@H]1C[C@@H](NCc2ccc(F)cc2Br)CCN1C(=O)OC(C)(C)C ZINC000302152135 854538326 /nfs/dbraw/zinc/53/83/26/854538326.db2.gz AWRBVLNDKZTGLV-DOMZBBRYSA-N 0 3 401.320 4.466 20 0 HIADHN C[C@H]1C[C@@H](Nc2nn3cc(-c4cccnc4)nc3s2)CCN1Cc1ccccc1 ZINC000302200003 854549151 /nfs/dbraw/zinc/54/91/51/854549151.db2.gz UUDUZWVCEOHZNZ-LPHOPBHVSA-N 0 3 404.543 4.318 20 0 HIADHN COc1ccc([C@H](NCC(=O)N2CCC[C@H]2c2ccc3c(c2)OCCO3)C(C)C)cc1 ZINC000302764075 854625636 /nfs/dbraw/zinc/62/56/36/854625636.db2.gz SDALXKIEBKXESR-SQJMNOBHSA-N 0 3 424.541 4.117 20 0 HIADHN COc1cccc([C@@H](CNC(=O)c2ccc(OC)c3ccccc23)N2CCCC2)c1 ZINC000302803314 854638665 /nfs/dbraw/zinc/63/86/65/854638665.db2.gz PCIVNZCWIJRQJM-HSZRJFAPSA-N 0 3 404.510 4.424 20 0 HIADHN COc1ccc([C@@H](CNC(=O)N[C@H](C)c2ccc(F)cc2F)N2CCCC2)cc1 ZINC000302816658 854644669 /nfs/dbraw/zinc/64/46/69/854644669.db2.gz VDCKKDQUIFMCKB-QVKFZJNVSA-N 0 3 403.473 4.171 20 0 HIADHN Cc1nc2ccc(Br)cc2c(N2CCC(C)(C)S(=O)(=O)CC2)c1C ZINC000302832586 854648584 /nfs/dbraw/zinc/64/85/84/854648584.db2.gz ROOQAHZKLOMKGT-UHFFFAOYSA-N 0 3 411.365 4.018 20 0 HIADHN COc1ccc([C@H](CNC(=O)CCSc2ccccc2F)N2CCCC2)cc1 ZINC000302837811 854650294 /nfs/dbraw/zinc/65/02/94/854650294.db2.gz OKQFCDVAYFIDKB-FQEVSTJZSA-N 0 3 402.535 4.270 20 0 HIADHN COc1ccc([C@H](CNC(=O)NCc2ccc(C(F)(F)F)cc2)N2CCCC2)cc1 ZINC000302852238 854657573 /nfs/dbraw/zinc/65/75/73/854657573.db2.gz SASIZGGMUCOHLD-FQEVSTJZSA-N 0 3 421.463 4.350 20 0 HIADHN COc1ccc([C@H](CNC(=O)N[C@H](c2ccc(OC)cc2)C2CC2)N2CCCC2)cc1 ZINC000302896756 854670248 /nfs/dbraw/zinc/67/02/48/854670248.db2.gz LVZNWRFOFXVWIU-ZEQRLZLVSA-N 0 3 423.557 4.291 20 0 HIADHN CN(Cc1ccc(Br)cc1)C(=O)NC[C@H](c1ccccc1)N1CCCC1 ZINC000302898670 854671477 /nfs/dbraw/zinc/67/14/77/854671477.db2.gz NRENPUKWEHTCJX-HXUWFJFHSA-N 0 3 416.363 4.428 20 0 HIADHN Cc1ccc(-n2c(=S)n(CN3CCN(CC(C)C)CC3)nc2-c2ccncc2)cc1 ZINC000302912178 854676346 /nfs/dbraw/zinc/67/63/46/854676346.db2.gz DBPKGICKVDIQNW-UHFFFAOYSA-N 0 3 422.602 4.005 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N2CCCN(c3ccccc3)CC2)N2CCCC2)cc1 ZINC000302976374 854705595 /nfs/dbraw/zinc/70/55/95/854705595.db2.gz CFBZKAGMHNEYEL-XMMPIXPASA-N 0 3 406.574 4.054 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N2CCCN(c3ccccc3)CC2)N2CCCC2)cc1 ZINC000302976371 854705714 /nfs/dbraw/zinc/70/57/14/854705714.db2.gz CFBZKAGMHNEYEL-DEOSSOPVSA-N 0 3 406.574 4.054 20 0 HIADHN C[C@H](Oc1cccc(C(C)(C)C)c1)C(=O)N(C)C1CCN(CCc2ccccn2)CC1 ZINC000302989035 854711293 /nfs/dbraw/zinc/71/12/93/854711293.db2.gz FOXAVTMWFKWMSZ-FQEVSTJZSA-N 0 3 423.601 4.312 20 0 HIADHN Cc1cc(C)n(Cc2ccc(C(=O)N[C@@H](CN3CCCC3)c3ccccc3)cc2)n1 ZINC000303039210 854734230 /nfs/dbraw/zinc/73/42/30/854734230.db2.gz ZIKKKVSFUJYUTP-DEOSSOPVSA-N 0 3 402.542 4.115 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2ccccc2OC[C@@H]2CCCO2)N2CCCC2)cc1 ZINC000303048532 854738507 /nfs/dbraw/zinc/73/85/07/854738507.db2.gz RBZQCMADFCBKQF-JTHBVZDNSA-N 0 3 408.542 4.120 20 0 HIADHN Cc1noc2nc(C3CC3)cc(C(=O)NC[C@H](c3ccc(C)cc3)N3CCCC3)c12 ZINC000303051143 854739635 /nfs/dbraw/zinc/73/96/35/854739635.db2.gz RQVRRVJRZSKKCH-OAQYLSRUSA-N 0 3 404.514 4.284 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)c3ccc(F)c(C(F)(F)F)c3)cc2)CC1 ZINC000303079933 854751268 /nfs/dbraw/zinc/75/12/68/854751268.db2.gz UJJNQSXYOARMCY-UHFFFAOYSA-N 0 3 409.427 4.234 20 0 HIADHN Cc1ccc(NC(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)cc1OCC(F)F ZINC000303107569 854763945 /nfs/dbraw/zinc/76/39/45/854763945.db2.gz FJGJPLNQKIBACR-UHFFFAOYSA-N 0 3 417.500 4.422 20 0 HIADHN Cc1ccc([C@H](CNC(=O)NC[C@H]2CCN(c3ccc(F)cc3)C2)N2CCCC2)cc1 ZINC000303120261 854770001 /nfs/dbraw/zinc/77/00/01/854770001.db2.gz IFWIJUHAJGZTHG-YKSBVNFPSA-N 0 3 424.564 4.097 20 0 HIADHN Cc1c(Br)cccc1NC(=O)NCC1(N2CCSCC2)CCCC1 ZINC000303157812 854791648 /nfs/dbraw/zinc/79/16/48/854791648.db2.gz OJDMNACWWGKBRV-UHFFFAOYSA-N 0 3 412.397 4.241 20 0 HIADHN c1sc(-c2ccc3c(c2)OCO3)nc1CNC[C@H](c1ccccc1)N1CCCC1 ZINC000303176554 854801918 /nfs/dbraw/zinc/80/19/18/854801918.db2.gz JQTALKASXIZDAU-HXUWFJFHSA-N 0 3 407.539 4.466 20 0 HIADHN COc1ccc(CNC(=O)N[C@@H](CN2CCCC2)c2ccccc2)c(C(F)(F)F)c1 ZINC000303180165 854803811 /nfs/dbraw/zinc/80/38/11/854803811.db2.gz SQWPTVUXYDMAQI-FQEVSTJZSA-N 0 3 421.463 4.350 20 0 HIADHN COCCN1CCC[C@H]1CNC(=O)c1ccc(CSc2ccc(Cl)cc2)cc1 ZINC000303231456 854827748 /nfs/dbraw/zinc/82/77/48/854827748.db2.gz XZDGQUJETGYEON-FQEVSTJZSA-N 0 3 418.990 4.473 20 0 HIADHN CC(C)CN(CCN(C)C)C(=O)N[C@@H](c1ccccc1)c1ccc2c(c1)CCCO2 ZINC000303264693 854841822 /nfs/dbraw/zinc/84/18/22/854841822.db2.gz DXXHPWYGPBKBTG-DEOSSOPVSA-N 0 3 409.574 4.330 20 0 HIADHN COc1cccc([C@@H](CNC(=O)C[C@H](C)Cc2ccccc2OC)N2CCCC2)c1 ZINC000303288898 854854445 /nfs/dbraw/zinc/85/44/45/854854445.db2.gz KHUGXUPCFULFDE-AUSIDOKSSA-N 0 3 410.558 4.226 20 0 HIADHN COc1ccsc1C(=O)Nc1ccc(N2CCN(Cc3ccccc3)CC2)cc1 ZINC000303312030 854866833 /nfs/dbraw/zinc/86/68/33/854866833.db2.gz SIBFXFGCUVTWNU-UHFFFAOYSA-N 0 3 407.539 4.331 20 0 HIADHN CCc1cccc2c(CC(=O)NC[C@H](c3ccc(OC)cc3)N3CCCC3)c[nH]c21 ZINC000303332543 854876930 /nfs/dbraw/zinc/87/69/30/854876930.db2.gz BVZLKMSXAHKLMP-HSZRJFAPSA-N 0 3 405.542 4.235 20 0 HIADHN CC(C)CCN(CCC(C)C)S(=O)(=O)N(C)C[C@@H]1CCN(Cc2ccccc2)C1 ZINC000437341845 862617084 /nfs/dbraw/zinc/61/70/84/862617084.db2.gz XOBWXWSQSUCYJE-QHCPKHFHSA-N 0 3 423.667 4.079 20 0 HIADHN CCCO[C@H]1CCCN([C@@H](C)C(=O)N(C)Cc2ccc3cc(OC)ccc3c2)CC1 ZINC000303417199 854919107 /nfs/dbraw/zinc/91/91/07/854919107.db2.gz WXMAODYLBUOKED-CVDCTZTESA-N 0 3 412.574 4.476 20 0 HIADHN CCN1CCN(Cc2ccc(CNC(=O)N(C)[C@@H](c3ccccc3)C(C)C)cc2)CC1 ZINC000303452511 854952363 /nfs/dbraw/zinc/95/23/63/854952363.db2.gz CZVLDRZUXPCVQO-RUZDIDTESA-N 0 3 422.617 4.363 20 0 HIADHN O=C(NC[C@@H](O)c1ccc(Cl)cc1Cl)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000303456590 854956508 /nfs/dbraw/zinc/95/65/08/854956508.db2.gz KESSQBGDFJVIAV-VQTJNVASSA-N 0 3 422.356 4.163 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2cccc(COc3ccc(C)nc3)c2)N(C)C)cc1 ZINC000303544836 855030593 /nfs/dbraw/zinc/03/05/93/855030593.db2.gz KOBRSMMFISIOQG-DEOSSOPVSA-N 0 3 403.526 4.310 20 0 HIADHN Cc1ccc(NS(=O)(=O)C2=Cc3ccc(OC(F)F)cc3CC2)c(CN(C)C)c1 ZINC000303583467 855056824 /nfs/dbraw/zinc/05/68/24/855056824.db2.gz RTIBCECCMWOOLG-UHFFFAOYSA-N 0 3 422.497 4.387 20 0 HIADHN C[C@@H](CNC(=O)/C=C/c1ccc(-c2ccccc2Cl)s1)CN1CCN(C)CC1 ZINC000303617100 855079457 /nfs/dbraw/zinc/07/94/57/855079457.db2.gz ZZWHJHHAIXOIGP-VMSUTVGLSA-N 0 3 418.006 4.081 20 0 HIADHN O=C(N[C@@H]1C[C@H]1c1cc(F)c(F)c(F)c1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000437357435 862640158 /nfs/dbraw/zinc/64/01/58/862640158.db2.gz GQRSLFWPFAKBGL-CFLQYTFWSA-N 0 3 406.423 4.127 20 0 HIADHN O=C(N[C@@H]1C[C@H]1c1cc(F)c(F)c(F)c1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000437357437 862640857 /nfs/dbraw/zinc/64/08/57/862640857.db2.gz GQRSLFWPFAKBGL-GZRFBZBPSA-N 0 3 406.423 4.127 20 0 HIADHN Cc1ccc(CN2CCOCC2)cc1NC(=O)c1cc(-c2ccccc2Cl)n[nH]1 ZINC000303772845 855188752 /nfs/dbraw/zinc/18/87/52/855188752.db2.gz QYHZKISFNKGODF-UHFFFAOYSA-N 0 3 410.905 4.123 20 0 HIADHN COc1ccc([C@@H]2CCCN2CCOc2ccc3c(C)cc(=O)oc3c2)c(OC)c1 ZINC000303782637 855195940 /nfs/dbraw/zinc/19/59/40/855195940.db2.gz DBWOBTOMSVIGEA-NRFANRHFSA-N 0 3 409.482 4.335 20 0 HIADHN Cc1cc(C(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)c(C)n1-c1nccs1 ZINC000303789177 855199165 /nfs/dbraw/zinc/19/91/65/855199165.db2.gz FBWMEHWMNYHLID-SFHVURJKSA-N 0 3 408.571 4.287 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)[C@@H]3C[C@@H]3c3c(F)cccc3Cl)cc2)CC1 ZINC000303797840 855203889 /nfs/dbraw/zinc/20/38/89/855203889.db2.gz GHDMWMUOAPQEHO-RBUKOAKNSA-N 0 3 415.940 4.359 20 0 HIADHN C/C(=C/C(=O)Nc1ccc(C(=O)N(C)[C@@H]2CCCN(C)C2)cc1)c1cccc(F)c1 ZINC000303826168 855226699 /nfs/dbraw/zinc/22/66/99/855226699.db2.gz ATAVRBGERCAGQZ-SLYOHQAMSA-N 0 3 409.505 4.034 20 0 HIADHN CN(C)Cc1cccc(C(=O)NC[C@H](c2ccccc2)N2CCc3sccc3C2)c1 ZINC000303828336 855228582 /nfs/dbraw/zinc/22/85/82/855228582.db2.gz GUUMHPAKCHWPNI-HSZRJFAPSA-N 0 3 419.594 4.339 20 0 HIADHN C[C@H]1C[C@@H](N(C)S(=O)(=O)C2=Cc3ccccc3CC2)CCN1Cc1ccccc1 ZINC000303834106 855232404 /nfs/dbraw/zinc/23/24/04/855232404.db2.gz RLEBFKWLFHCPNS-CVDCTZTESA-N 0 3 410.583 4.288 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2cccc(Cl)c2Cl)cc1)[C@H]1CCCN(C)C1 ZINC000303853054 855249075 /nfs/dbraw/zinc/24/90/75/855249075.db2.gz FYZDGUMHDCILAF-INIZCTEOSA-N 0 3 420.340 4.412 20 0 HIADHN C[C@@H]1C[C@H](N(C)S(=O)(=O)Cc2cccc3cccnc32)CCN1Cc1ccccc1 ZINC000303868561 855260438 /nfs/dbraw/zinc/26/04/38/855260438.db2.gz XJUOIKUEHHMDGQ-AUSIDOKSSA-N 0 3 423.582 4.050 20 0 HIADHN CCc1ccc([C@H]2COCCN2C(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)o1 ZINC000303880254 855266398 /nfs/dbraw/zinc/26/63/98/855266398.db2.gz QYIHWWCAENXXMJ-FGZHOGPDSA-N 0 3 411.546 4.070 20 0 HIADHN C[C@@H](c1ccccc1)N(CC(=O)Nc1ccc(N2CCOCC2)cc1)CC1CCC1 ZINC000303908420 855282227 /nfs/dbraw/zinc/28/22/27/855282227.db2.gz UCWPSUAHZZMDNQ-FQEVSTJZSA-N 0 3 407.558 4.325 20 0 HIADHN O=C(Nc1ccc(OCC2CCOCC2)cc1)N1CCCN(Cc2ccccc2)CC1 ZINC000303935185 855302350 /nfs/dbraw/zinc/30/23/50/855302350.db2.gz XUHJDMLPSITNOM-UHFFFAOYSA-N 0 3 423.557 4.232 20 0 HIADHN CC(C)[C@H](Cc1ccccc1)C(=O)Nc1ccc(C(=O)N(C)[C@H]2CCCN(C)C2)cc1 ZINC000303963654 855325752 /nfs/dbraw/zinc/32/57/52/855325752.db2.gz XMDOMTIKEKPACV-ZEQRLZLVSA-N 0 3 421.585 4.306 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N3CC[C@H](c4ccccc4)[C@H](C)C3)cc2)CC1 ZINC000303967071 855327367 /nfs/dbraw/zinc/32/73/67/855327367.db2.gz DEXFGBLXNZFPTB-BWKNWUBXSA-N 0 3 405.586 4.483 20 0 HIADHN O=C(OCc1ccccc1)N1CCC(NCc2cc(F)ccc2Br)CC1 ZINC000304371659 855355801 /nfs/dbraw/zinc/35/58/01/855355801.db2.gz JHVXHAWTMYNYQP-UHFFFAOYSA-N 0 3 421.310 4.479 20 0 HIADHN Brc1ccc(CNCc2cccc(I)c2)s1 ZINC000304541016 855357406 /nfs/dbraw/zinc/35/74/06/855357406.db2.gz SJZLFTGJFHBIOO-UHFFFAOYSA-N 0 3 408.102 4.405 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)c2ccc(Cl)cc2Br)CCN1Cc1ccccc1 ZINC000310326021 855365835 /nfs/dbraw/zinc/36/58/35/855365835.db2.gz YUHJMVGFAMQKGW-ACJLOTCBSA-N 0 3 407.739 4.495 20 0 HIADHN C[C@H]1[C@@H](NC(=O)c2ccc(Cl)cc2Br)CCN1Cc1ccccc1 ZINC000310326024 855366475 /nfs/dbraw/zinc/36/64/75/855366475.db2.gz YUHJMVGFAMQKGW-UGSOOPFHSA-N 0 3 407.739 4.495 20 0 HIADHN COc1ccc(CNCC[C@H]2CCN(C(=O)OC(C)(C)C)C2)c(Br)c1 ZINC000310687112 855367761 /nfs/dbraw/zinc/36/77/61/855367761.db2.gz PLBFFOMXWYYIRA-AWEZNQCLSA-N 0 3 413.356 4.194 20 0 HIADHN CC(C)(C)OC(=O)N1CCC(C)(CNCc2cc(O)ccc2Br)CC1 ZINC000315134402 855378330 /nfs/dbraw/zinc/37/83/30/855378330.db2.gz PVWHUJBONYLZOW-UHFFFAOYSA-N 0 3 413.356 4.282 20 0 HIADHN COc1ccc(Br)c(C(=O)N2CCN(Cc3ccccc3)C[C@H](C)C2)c1 ZINC000324010987 855397651 /nfs/dbraw/zinc/39/76/51/855397651.db2.gz LIQBRVALEZCRNS-INIZCTEOSA-N 0 3 417.347 4.052 20 0 HIADHN FC(F)(F)Oc1ccc(CNCc2ccc3c(c2)OCO3)cc1Br ZINC000326388324 855409724 /nfs/dbraw/zinc/40/97/24/855409724.db2.gz JWLIQZIBWWDSSM-UHFFFAOYSA-N 0 3 404.182 4.366 20 0 HIADHN CC[C@@H](C)[C@@H](CNCc1cc(Br)cc(Br)c1OC)OC ZINC000381106565 855430327 /nfs/dbraw/zinc/43/03/27/855430327.db2.gz BEKMEDAWUXGJHM-QMTHXVAHSA-N 0 3 409.162 4.371 20 0 HIADHN COc1ccc(Br)cc1CNC[C@H](NC(=O)OC(C)(C)C)C(C)C ZINC000382748655 855434811 /nfs/dbraw/zinc/43/48/11/855434811.db2.gz OIYSPSZDFXNCNH-HNNXBMFYSA-N 0 3 401.345 4.097 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)c1cnc(Cl)c(Br)c1 ZINC000383033677 855434819 /nfs/dbraw/zinc/43/48/19/855434819.db2.gz BPCQYIQEHRUFHH-AWEZNQCLSA-N 0 3 422.754 4.234 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)c1cc(F)ccc1Br ZINC000383056897 855436967 /nfs/dbraw/zinc/43/69/67/855436967.db2.gz OPDNHROVNVHHDB-OAHLLOKOSA-N 0 3 405.311 4.325 20 0 HIADHN COc1ccc(C(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)cc1Br ZINC000388623082 855447936 /nfs/dbraw/zinc/44/79/36/855447936.db2.gz ZXUIKCGSBCUJPP-SFHVURJKSA-N 0 3 417.347 4.194 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1cc(Cl)cc(Br)c1 ZINC000389850518 855452630 /nfs/dbraw/zinc/45/26/30/855452630.db2.gz URKRFMUNIBXRTG-UGSOOPFHSA-N 0 3 407.739 4.353 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1cccc(Br)c1Cl ZINC000389851799 855452701 /nfs/dbraw/zinc/45/27/01/855452701.db2.gz WBFWFTMOHBJIQY-DYVFJYSZSA-N 0 3 407.739 4.353 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)c1c(F)cc(Br)cc1F ZINC000393057755 855467819 /nfs/dbraw/zinc/46/78/19/855467819.db2.gz OOTGRZMJKQOHPP-QGZVFWFLSA-N 0 3 409.274 4.294 20 0 HIADHN O=C(NCC1(O)CCN(Cc2ccccc2)CC1)Nc1cc(Cl)cc(Cl)c1 ZINC000397538275 855473009 /nfs/dbraw/zinc/47/30/09/855473009.db2.gz KMIKXXUJJRGDON-UHFFFAOYSA-N 0 3 408.329 4.142 20 0 HIADHN C[C@H]1C[C@H](NC(=O)c2cc(Cl)ccc2Br)CN1Cc1ccccc1 ZINC000398058940 855475029 /nfs/dbraw/zinc/47/50/29/855475029.db2.gz BFMMTUXGDDRDGN-BBRMVZONSA-N 0 3 407.739 4.495 20 0 HIADHN COc1c(Br)cc(Br)cc1CNCCc1ncccc1C ZINC000404995449 855481691 /nfs/dbraw/zinc/48/16/91/855481691.db2.gz KUGDBGOMOKFCHH-UHFFFAOYSA-N 0 3 414.141 4.256 20 0 HIADHN C[C@@]1(NC(=O)c2ccc(Cl)c(Br)c2)CCN(Cc2ccccc2)C1 ZINC000406032640 855482775 /nfs/dbraw/zinc/48/27/75/855482775.db2.gz NYGHLPHAGDAITP-LJQANCHMSA-N 0 3 407.739 4.497 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)NCc3ccc(-c4cccnc4)cc3)cc2)CC1 ZINC000437377291 862684933 /nfs/dbraw/zinc/68/49/33/862684933.db2.gz UQOGUBKSULHWPC-UHFFFAOYSA-N 0 3 414.553 4.209 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)[C@@H]2CCO[C@H]2c2ccc(Cl)c(F)c2)N(C)C)cc1 ZINC000409587040 855554472 /nfs/dbraw/zinc/55/44/72/855554472.db2.gz NIGDEDLBBUGHRS-UIFIKXQLSA-N 0 3 404.913 4.284 20 0 HIADHN Cc1cc(Cl)ccc1NC(=O)NCCCCN1CCN(c2ccccc2)CC1 ZINC000409691263 855603730 /nfs/dbraw/zinc/60/37/30/855603730.db2.gz WGPQRSXWKAJTGS-UHFFFAOYSA-N 0 3 400.954 4.372 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)Nc1ccc(Cl)cc1F ZINC000409704730 855611668 /nfs/dbraw/zinc/61/16/68/855611668.db2.gz BLKDNIYRJWOAAJ-UHFFFAOYSA-N 0 3 404.917 4.203 20 0 HIADHN O=C(CC1CC(c2ccccc2)C1)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000409724857 855620945 /nfs/dbraw/zinc/62/09/45/855620945.db2.gz ZCDCYIXKDUFCFA-UHFFFAOYSA-N 0 3 410.533 4.369 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2cccc(C3CCC3)c2)cc1)[C@@H]1CCCN(C)C1 ZINC000409743166 855631312 /nfs/dbraw/zinc/63/13/12/855631312.db2.gz UAJJQHCYOKIXKS-HSZRJFAPSA-N 0 3 405.542 4.373 20 0 HIADHN Cc1ccc(Cl)cc1NC(=O)NCCCCN1CCN(c2ccccc2)CC1 ZINC000409753094 855636691 /nfs/dbraw/zinc/63/66/91/855636691.db2.gz QESANSPEEGHYIB-UHFFFAOYSA-N 0 3 400.954 4.372 20 0 HIADHN O=C(N[C@H]1CCCN(Cc2ccccc2)C1)[C@@H]1CCO[C@H]1c1ccc(Cl)c(F)c1 ZINC000409754373 855636749 /nfs/dbraw/zinc/63/67/49/855636749.db2.gz TZKHDTLSJHUVHH-JQVVWYNYSA-N 0 3 416.924 4.338 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)C2(c3ccccc3Cl)CCOCC2)C1 ZINC000409849786 855686241 /nfs/dbraw/zinc/68/62/41/855686241.db2.gz QZRFOEDITYZYPQ-QUCCMNQESA-N 0 3 412.961 4.340 20 0 HIADHN O=C(NCc1ccc2c(c1)OCO2)[C@H](NCC1CCC(F)(F)CC1)c1ccccc1 ZINC000409858340 855691586 /nfs/dbraw/zinc/69/15/86/855691586.db2.gz PCOPNUGSIISNBK-OAQYLSRUSA-N 0 3 416.468 4.188 20 0 HIADHN CCCN(C(=O)c1ccc(-c2ncon2)cc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000409909804 855718725 /nfs/dbraw/zinc/71/87/25/855718725.db2.gz VJNMTJQPCMTIET-QFIPXVFZSA-N 0 3 404.514 4.253 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)[C@@H](C)c2ccc(C(F)(F)F)cc2)c1 ZINC000409983908 855761607 /nfs/dbraw/zinc/76/16/07/855761607.db2.gz ZDBKLSJXMFROMV-INIZCTEOSA-N 0 3 408.464 4.408 20 0 HIADHN CC(C)(C)[C@H](CN1CCc2ccccc2C1)NC(=O)Cc1coc(-c2ccccc2)n1 ZINC000410050188 855800628 /nfs/dbraw/zinc/80/06/28/855800628.db2.gz BHMGPRIXQQIPMC-QHCPKHFHSA-N 0 3 417.553 4.473 20 0 HIADHN O=C(NCc1ccc(F)cc1C(F)(F)F)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000410200580 855859951 /nfs/dbraw/zinc/85/99/51/855859951.db2.gz UNUPLMYWURLSIG-IBGZPJMESA-N 0 3 409.427 4.481 20 0 HIADHN COc1cc(C(=O)NCCCN2CCc3ccccc3C2)ccc1OC1CCCC1 ZINC000410320424 855926498 /nfs/dbraw/zinc/92/64/98/855926498.db2.gz ZTHZMHPVEIGFKT-UHFFFAOYSA-N 0 3 408.542 4.195 20 0 HIADHN CN1CCN(Cc2ccc(CNC(=O)Nc3ccc4c5c(cccc53)CC4)cc2)CC1 ZINC000410371261 855956774 /nfs/dbraw/zinc/95/67/74/855956774.db2.gz SPMVDFTWRPHVMW-UHFFFAOYSA-N 0 3 414.553 4.008 20 0 HIADHN CC(C)C[C@@H](NC(=O)NCc1ccc(CN2CCN(C)CC2)cc1)c1ccccc1 ZINC000410374253 855958657 /nfs/dbraw/zinc/95/86/57/855958657.db2.gz MRDAKOJWQLROKF-XMMPIXPASA-N 0 3 408.590 4.021 20 0 HIADHN COc1cc(CN[C@H](Cc2cccnc2)c2cccc(Cl)c2)ccc1OCCO ZINC000425921788 856000875 /nfs/dbraw/zinc/00/08/75/856000875.db2.gz JDSQUMHFYDARDG-OAQYLSRUSA-N 0 3 412.917 4.188 20 0 HIADHN COC(=O)COc1cccc(CN[C@@H](Cc2cccnc2)c2cccc(Cl)c2)c1 ZINC000426048455 856071933 /nfs/dbraw/zinc/07/19/33/856071933.db2.gz HISSHIVZCAYHPF-QFIPXVFZSA-N 0 3 410.901 4.360 20 0 HIADHN C[C@@H](NC1CCN(S(=O)(=O)C(C)(C)C)CC1)c1cc(F)c(Cl)cc1Cl ZINC000426056469 856077505 /nfs/dbraw/zinc/07/75/05/856077505.db2.gz AUHGOQAEIDDAKS-LLVKDONJSA-N 0 3 411.370 4.376 20 0 HIADHN COc1ccc(NC(=O)N(Cc2ccccc2)C2CCN(C)CC2)c2cccnc12 ZINC000426073618 856088737 /nfs/dbraw/zinc/08/87/37/856088737.db2.gz BJBAMQHMKHOPEF-UHFFFAOYSA-N 0 3 404.514 4.372 20 0 HIADHN C[C@@H](C(=O)NCCCCN1CCN(c2ccccc2)CC1)c1ccc(Cl)s1 ZINC000426084646 856097483 /nfs/dbraw/zinc/09/74/83/856097483.db2.gz MCPXYUHATIHNMF-QGZVFWFLSA-N 0 3 405.995 4.224 20 0 HIADHN CSc1ccc(Cl)cc1NC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1CO ZINC000426098068 856105752 /nfs/dbraw/zinc/10/57/52/856105752.db2.gz FEIMIWOZPIPZPO-AEFFLSMTSA-N 0 3 419.978 4.066 20 0 HIADHN Cc1cc(CNC(=O)N2CCN(C3CCOCC3)C[C@@H]2C)ccc1-c1ccccc1 ZINC000426210752 856178332 /nfs/dbraw/zinc/17/83/32/856178332.db2.gz NSRLQLXLUXTNDG-FQEVSTJZSA-N 0 3 407.558 4.057 20 0 HIADHN COc1cccc([C@H](CNC(=O)N[C@H]2CCOC3(CCCCC3)C2)N2CCCC2)c1 ZINC000426242397 856197750 /nfs/dbraw/zinc/19/77/50/856197750.db2.gz XEKHCSQEUSFVPB-UNMCSNQZSA-N 0 3 415.578 4.013 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N[C@H]2c3ccccc3CC[C@H]2n2ccnc2)N(C)C)cc1 ZINC000426304543 856233663 /nfs/dbraw/zinc/23/36/63/856233663.db2.gz CWACNSFDVCYYPR-SGNDLWITSA-N 0 3 417.557 4.022 20 0 HIADHN C[C@H](N[C@@H]1c2cc(Br)ccc2CC1(C)C)c1cccc(S(N)(=O)=O)c1 ZINC000426331991 856249705 /nfs/dbraw/zinc/24/97/05/856249705.db2.gz BRJUTPJKDYEKMI-KPZWWZAWSA-N 0 3 423.376 4.071 20 0 HIADHN CCOc1cc(CN2CCS[C@H](C)CC2)ccc1OCc1ccc(C(=O)OC)o1 ZINC000426391812 856271746 /nfs/dbraw/zinc/27/17/46/856271746.db2.gz SQXNEXRZADGIMM-MRXNPFEDSA-N 0 3 419.543 4.371 20 0 HIADHN COc1ccc(Cc2noc([C@@H]3CN(C(C)(C)C)C[C@H]3C(F)(F)F)n2)c(F)c1 ZINC000426447012 856294769 /nfs/dbraw/zinc/29/47/69/856294769.db2.gz FQSZNBUOTBZJAD-ZIAGYGMSSA-N 0 3 401.404 4.184 20 0 HIADHN CC(C)CN(CCN(C)C)C(=O)Nc1ccc(OCc2ccccn2)c(Cl)c1 ZINC000426610116 856372645 /nfs/dbraw/zinc/37/26/45/856372645.db2.gz JIJUJORWIXAIFP-UHFFFAOYSA-N 0 3 404.942 4.366 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)Nc3nc4c(s3)CCCCC4)CC2)C[C@H](C)O1 ZINC000426635954 856386402 /nfs/dbraw/zinc/38/64/02/856386402.db2.gz YFPUNLLGIVBLQU-IRXDYDNUSA-N 0 3 420.623 4.155 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3ccccc3C(F)(F)F)CC2)C[C@@H](C)O1 ZINC000426646657 856392140 /nfs/dbraw/zinc/39/21/40/856392140.db2.gz MJOSHESUNJNGDM-HZPDHXFCSA-N 0 3 413.484 4.449 20 0 HIADHN C[C@H](CSc1ccc(F)cc1)C(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000426656075 856397638 /nfs/dbraw/zinc/39/76/38/856397638.db2.gz WHIIPRKPPUSBCW-QRVBRYPASA-N 0 3 422.610 4.292 20 0 HIADHN Cc1ccc(NC(=O)[C@H](C)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)c(Cl)c1 ZINC000426789988 856478887 /nfs/dbraw/zinc/47/88/87/856478887.db2.gz ZJYMYRPGNQZVDD-FHWLQOOXSA-N 0 3 422.013 4.187 20 0 HIADHN COc1ccccc1[C@H](NC(=O)N(CCN(C)C)Cc1cccs1)c1ccco1 ZINC000426821377 856497088 /nfs/dbraw/zinc/49/70/88/856497088.db2.gz SCEFQXZMXMTWSG-NRFANRHFSA-N 0 3 413.543 4.213 20 0 HIADHN Cc1cccc(-c2cncc(C(=O)Nc3cccc(CN4CCC(O)CC4)c3)c2)c1 ZINC000426879145 856524100 /nfs/dbraw/zinc/52/41/00/856524100.db2.gz PEBVCQRMQMUGNS-UHFFFAOYSA-N 0 3 401.510 4.266 20 0 HIADHN C[C@H](CC(=O)NC1CCN(CCOc2ccc(F)cc2)CC1)c1c[nH]c2ccccc21 ZINC000426880670 856525147 /nfs/dbraw/zinc/52/51/47/856525147.db2.gz AQSMDHDRUQPMAU-GOSISDBHSA-N 0 3 423.532 4.460 20 0 HIADHN Cc1ccccc1CN(Cc1ccccc1)C(=O)C(=O)Nc1cccc(CN(C)C)c1 ZINC000437450492 862816098 /nfs/dbraw/zinc/81/60/98/862816098.db2.gz RSYGFEKYQYGYPB-UHFFFAOYSA-N 0 3 415.537 4.224 20 0 HIADHN Cc1ccc(-c2c[nH]cc2C(=O)N2CCC(CN3C[C@H](C)O[C@@H](C)C3)CC2)s1 ZINC000427125798 856655265 /nfs/dbraw/zinc/65/52/65/856655265.db2.gz HNVGUYSMVRVELB-HOTGVXAUSA-N 0 3 401.576 4.013 20 0 HIADHN Cc1ccc(C2(C(=O)N3CC[C@H](C)N(Cc4ccccc4)CC3)CCOCC2)cc1 ZINC000437460785 862823215 /nfs/dbraw/zinc/82/32/15/862823215.db2.gz SBEZXGLGRNIZTQ-QFIPXVFZSA-N 0 3 406.570 4.166 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3ccc4c5c(cccc53)CC4)CC2)C[C@H](C)O1 ZINC000427292675 856756064 /nfs/dbraw/zinc/75/60/64/856756064.db2.gz SOKQPXHCHCUCGO-KDURUIRLSA-N 0 3 406.570 4.290 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)[C@@H]3CCC[C@H](C(F)(F)F)C3)CC2)C[C@H](C)O1 ZINC000427297339 856758103 /nfs/dbraw/zinc/75/81/03/856758103.db2.gz STPGAAYSAJAXTN-JFRXWTBNSA-N 0 3 404.517 4.093 20 0 HIADHN COc1ccc2cc(C(=O)N3CC[C@H](C)N(Cc4ccccc4)CC3)c(C)nc2c1 ZINC000437472904 862834289 /nfs/dbraw/zinc/83/42/89/862834289.db2.gz FWSYUHSVWZHGQM-SFHVURJKSA-N 0 3 403.526 4.288 20 0 HIADHN CCn1ncc(C(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)c1-c1ccccc1 ZINC000427356631 856790495 /nfs/dbraw/zinc/79/04/95/856790495.db2.gz HCDDBKFLJVQWDA-FQEVSTJZSA-N 0 3 402.542 4.307 20 0 HIADHN CC(C)(O)CN1CCc2c(cccc2NC(=O)c2c[nH]cc2-c2ccccc2F)C1 ZINC000427460216 856829843 /nfs/dbraw/zinc/82/98/43/856829843.db2.gz RNQWHHMMWCQYOA-UHFFFAOYSA-N 0 3 407.489 4.202 20 0 HIADHN CCN1CCN(Cc2ccc(N[C@H](C)c3ncc(Br)cc3F)cc2)CC1 ZINC000427527740 856851268 /nfs/dbraw/zinc/85/12/68/856851268.db2.gz LPHJWGCYTBKTFI-OAHLLOKOSA-N 0 3 421.358 4.294 20 0 HIADHN C[C@H]1CCN(C(=O)c2ccccc2OCc2cscn2)CCN1Cc1ccccc1 ZINC000437488139 862845768 /nfs/dbraw/zinc/84/57/68/862845768.db2.gz CHDJLSPRDNFEQU-IBGZPJMESA-N 0 3 421.566 4.459 20 0 HIADHN O=C1CCCN1Cc1ccc(CN[C@H]2CCCc3ncc(C(F)(F)F)cc32)cc1 ZINC000427598578 856882834 /nfs/dbraw/zinc/88/28/34/856882834.db2.gz GMKXPZDTBPAFAJ-IBGZPJMESA-N 0 3 403.448 4.390 20 0 HIADHN COc1ccccc1N1CC[C@@H](CN[C@@H](C)c2ncc(Br)cc2F)C1 ZINC000427686479 856908432 /nfs/dbraw/zinc/90/84/32/856908432.db2.gz RGKXFNBQBJLQMX-KBPBESRZSA-N 0 3 408.315 4.169 20 0 HIADHN Fc1ccccc1[C@H](N[C@H]1CCn2ccnc2C1)c1ccc(Br)cc1 ZINC000427865887 856987040 /nfs/dbraw/zinc/98/70/40/856987040.db2.gz OGZGOKWSAKKHDP-OXJNMPFZSA-N 0 3 400.295 4.479 20 0 HIADHN CCOC(=O)C1CCN(C(=O)C[C@@H](C)N[C@H](C)c2cc(Cl)ccc2Cl)CC1 ZINC000427871320 856989562 /nfs/dbraw/zinc/98/95/62/856989562.db2.gz AHOVPKQFIJLGCT-ZIAGYGMSSA-N 0 3 415.361 4.224 20 0 HIADHN Cc1cc(C)c(CC(C(=O)Nc2ccc3c(c2)N(C(N)=O)CC3)C(F)(F)F)c(C)c1 ZINC000428027162 857048254 /nfs/dbraw/zinc/04/82/54/857048254.db2.gz KPWGFZUDOMGVLU-GOSISDBHSA-N 0 3 419.447 4.413 20 0 HIADHN Cn1nccc1[C@H]1CCCN(Cc2cnn(Cc3ccc(C(F)(F)F)cc3)c2)C1 ZINC000428242891 857124140 /nfs/dbraw/zinc/12/41/40/857124140.db2.gz MNELJJCNSXFUSA-SFHVURJKSA-N 0 3 403.452 4.063 20 0 HIADHN Cc1c(C(=O)NC[C@@H]2CN(Cc3ccccc3)CCCO2)cccc1-c1ccccn1 ZINC000428435375 857203159 /nfs/dbraw/zinc/20/31/59/857203159.db2.gz CFPFBFBCOXDWJM-JOCHJYFZSA-N 0 3 415.537 4.078 20 0 HIADHN COc1ccc(C2(C(=O)Nc3cccc(CN4CC[C@@H](O)C4)c3)CC3(CCC3)C2)cc1 ZINC000428531285 857244254 /nfs/dbraw/zinc/24/42/54/857244254.db2.gz AQRJHIFTOHNXID-JOCHJYFZSA-N 0 3 420.553 4.102 20 0 HIADHN CCCn1c(C)c(C(=O)Nc2cccc(CN3CC[C@H](O)C3)c2)c2cc(OC)ccc21 ZINC000428549613 857258340 /nfs/dbraw/zinc/25/83/40/857258340.db2.gz QEQNWTVEUDIYDN-FQEVSTJZSA-N 0 3 421.541 4.187 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)c1ccc(Oc2ccncc2)c(Cl)c1 ZINC000428550653 857260068 /nfs/dbraw/zinc/26/00/68/857260068.db2.gz ROYGFBBPTURGCR-IBGZPJMESA-N 0 3 423.900 4.346 20 0 HIADHN C[C@@H](Cc1ccccc1)n1cccc1C(=O)Nc1cccc(CN2CC[C@H](O)C2)c1 ZINC000428553911 857262291 /nfs/dbraw/zinc/26/22/91/857262291.db2.gz YHNZUGHFKLBPAN-CVDCTZTESA-N 0 3 403.526 4.111 20 0 HIADHN CC[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)Nc1cccc(CN2CC[C@@H](O)C2)c1 ZINC000428555204 857264243 /nfs/dbraw/zinc/26/42/43/857264243.db2.gz XKQLIBZHLLBFNM-WIYYLYMNSA-N 0 3 420.475 4.479 20 0 HIADHN COc1ccc2nc(CNC[C@]3(Cc4ccc(F)cc4)CCC[C@H]3O)sc2c1 ZINC000428571140 857268966 /nfs/dbraw/zinc/26/89/66/857268966.db2.gz JFLTVWOMADCDLH-IFMALSPDSA-N 0 3 400.519 4.308 20 0 HIADHN Cc1ccc(-c2ccc(C(=O)N(C)C[C@@]3(O)CCN(Cc4ccccc4)C3)s2)o1 ZINC000428693775 857299714 /nfs/dbraw/zinc/29/97/14/857299714.db2.gz MOPCAFRJKDEWNI-QHCPKHFHSA-N 0 3 410.539 4.026 20 0 HIADHN CCSc1ccc(Cl)cc1C(=O)N(C)C[C@]1(O)CCN(Cc2ccccc2)C1 ZINC000428704122 857302398 /nfs/dbraw/zinc/30/23/98/857302398.db2.gz ZEGGEPCIRIOPCD-JOCHJYFZSA-N 0 3 418.990 4.161 20 0 HIADHN CCN1CCCN(C(=O)NC[C@H](c2c[nH]c3ccccc32)c2ccc(OC)cc2)CC1 ZINC000428703933 857302565 /nfs/dbraw/zinc/30/25/65/857302565.db2.gz VWDZEXHRBTWFAS-QFIPXVFZSA-N 0 3 420.557 4.046 20 0 HIADHN C[C@]1(c2ccccc2)CC[C@@H](N2CCN(CC(=O)Nc3ccccc3Cl)CC2)C1 ZINC000437578157 862896082 /nfs/dbraw/zinc/89/60/82/862896082.db2.gz LASBFHOLTKBYCF-YKSBVNFPSA-N 0 3 411.977 4.407 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)N2CCC(c3ncccc3Cl)CC2)CN1Cc1ccccc1 ZINC000428809622 857353679 /nfs/dbraw/zinc/35/36/79/857353679.db2.gz VZVYNURRNOWJNT-FXAWDEMLSA-N 0 3 412.965 4.287 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)N2CCC(c3ncccc3Cl)CC2)CN1Cc1ccccc1 ZINC000428809626 857353952 /nfs/dbraw/zinc/35/39/52/857353952.db2.gz VZVYNURRNOWJNT-XLIONFOSSA-N 0 3 412.965 4.287 20 0 HIADHN COc1cncc(CN(Cc2ccncc2)[C@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000428814736 857358219 /nfs/dbraw/zinc/35/82/19/857358219.db2.gz SSCJJKATHASQIQ-DEOSSOPVSA-N 0 3 402.542 4.152 20 0 HIADHN FC(F)(F)c1ccc(CNc2ccc3nc(CCN4CCOCC4)[nH]c3c2)s1 ZINC000428869227 857380225 /nfs/dbraw/zinc/38/02/25/857380225.db2.gz UTEASXVXCQNWQB-UHFFFAOYSA-N 0 3 410.465 4.130 20 0 HIADHN Fc1ccc2nc(CNC[C@@H](c3cccc(Cl)c3)N3CCOCC3)sc2c1 ZINC000428889326 857393231 /nfs/dbraw/zinc/39/32/31/857393231.db2.gz QZSXDQQADIEUND-SFHVURJKSA-N 0 3 405.926 4.252 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3ccc(OCC4CC4)cc3)CC2)C[C@H](C)O1 ZINC000428890628 857394159 /nfs/dbraw/zinc/39/41/59/857394159.db2.gz VGXMCMZLCRHAKD-KDURUIRLSA-N 0 3 415.578 4.219 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)Nc3ccc(OCC4CC4)cc3)CC2)C[C@H](C)O1 ZINC000428890630 857394558 /nfs/dbraw/zinc/39/45/58/857394558.db2.gz VGXMCMZLCRHAKD-OALUTQOASA-N 0 3 415.578 4.219 20 0 HIADHN CO[C@H](C)c1nc(CNC(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)cs1 ZINC000428918605 857414339 /nfs/dbraw/zinc/41/43/39/857414339.db2.gz GOUCZJUHZSNRRM-WBVHZDCISA-N 0 3 422.620 4.184 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N1CCC(c2ncccc2Cl)CC1 ZINC000429013230 857457303 /nfs/dbraw/zinc/45/73/03/857457303.db2.gz WIILPWKAXSMCPU-LAUBAEHRSA-N 0 3 412.965 4.145 20 0 HIADHN Cc1ccc([C@H](C)N(C)C(=O)NC[C@H]2CN(Cc3ccccc3)CCCO2)c(C)c1 ZINC000429017751 857460083 /nfs/dbraw/zinc/46/00/83/857460083.db2.gz GMBHNDMVBUZCFW-GMAHTHKFSA-N 0 3 409.574 4.297 20 0 HIADHN C[C@@H](CNC(=O)N(Cc1ccco1)C1CCN(C)CC1)Oc1ccc(Cl)cc1 ZINC000429036801 857468781 /nfs/dbraw/zinc/46/87/81/857468781.db2.gz RLWTVBLSBNKSII-INIZCTEOSA-N 0 3 405.926 4.006 20 0 HIADHN CCN(C(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1)[C@@H](C)Cc1ccsc1 ZINC000429040681 857471844 /nfs/dbraw/zinc/47/18/44/857471844.db2.gz IWKDDRSPZWBYBM-SIKLNZKXSA-N 0 3 415.603 4.002 20 0 HIADHN C[C@H](C1CC1)N(Cc1ccccc1)C(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000429054200 857480229 /nfs/dbraw/zinc/48/02/29/857480229.db2.gz PKXMWNIDQGHOFP-BWKNWUBXSA-N 0 3 421.585 4.288 20 0 HIADHN CCOc1ccc(NC(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)cc1Cl ZINC000429113697 857515599 /nfs/dbraw/zinc/51/55/99/857515599.db2.gz XUCUOJLVGSWMRN-CALCHBBNSA-N 0 3 423.985 4.482 20 0 HIADHN CN(C)[C@H](CNC(=O)N(C)[C@H](c1ccc(Cl)cc1)c1cnccn1)c1ccccc1 ZINC000429191379 857546947 /nfs/dbraw/zinc/54/69/47/857546947.db2.gz GOMWVMUYAPDNNY-FGZHOGPDSA-N 0 3 423.948 4.164 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)N[C@@H]3CCC[C@@H](C(F)(F)F)C3)CC2)C[C@H](C)O1 ZINC000429211631 857557113 /nfs/dbraw/zinc/55/71/13/857557113.db2.gz DVVSQFVKULMUAH-UKBAYJJMSA-N 0 3 419.532 4.028 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3cccc(C(F)(F)F)c3)CC2)C[C@@H](C)O1 ZINC000429213528 857557430 /nfs/dbraw/zinc/55/74/30/857557430.db2.gz UJCMIWVLKFCJCT-HZPDHXFCSA-N 0 3 413.484 4.449 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)N[C@@H]3CCC[C@H](C(F)(F)F)C3)CC2)C[C@H](C)O1 ZINC000429211629 857557619 /nfs/dbraw/zinc/55/76/19/857557619.db2.gz DVVSQFVKULMUAH-OGWHTMIXSA-N 0 3 419.532 4.028 20 0 HIADHN CCCn1ccnc1CCCN(C)Cc1nc(-c2ccc(Br)s2)no1 ZINC000429234035 857566824 /nfs/dbraw/zinc/56/68/24/857566824.db2.gz GBXMWFRUIUFPFX-UHFFFAOYSA-N 0 3 424.368 4.232 20 0 HIADHN O=C(CN[C@H]1Cc2cccc(O)c2C1)N1CCC[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000429297825 857595923 /nfs/dbraw/zinc/59/59/23/857595923.db2.gz UTKLPUJFHFTFJS-KXBFYZLASA-N 0 3 405.325 4.120 20 0 HIADHN FC(F)(F)Cn1nnnc1CN[C@H]1CCCCC[C@H]1c1ccccc1C(F)(F)F ZINC000429328469 857604880 /nfs/dbraw/zinc/60/48/80/857604880.db2.gz JCXCMYSOWJPRIP-ZFWWWQNUSA-N 0 3 421.389 4.460 20 0 HIADHN CCO[C@@H]1C[C@@H](NCC(=O)Nc2c(F)cc(F)cc2Br)C1(CC)CC ZINC000429329639 857604917 /nfs/dbraw/zinc/60/49/17/857604917.db2.gz AYYZGRDWIWKDEQ-HUUCEWRRSA-N 0 3 419.310 4.239 20 0 HIADHN C[C@@H](NC[C@@H](CO)Cc1ccc(Br)cc1)c1nc2c(s1)CCCC2 ZINC000429412954 857652958 /nfs/dbraw/zinc/65/29/58/857652958.db2.gz RDSUFEOQPSKYIQ-HIFRSBDPSA-N 0 3 409.393 4.286 20 0 HIADHN OC[C@@H](CN[C@H](c1ccccc1)c1ccccn1)Cc1ccc(Br)cc1 ZINC000429417532 857655391 /nfs/dbraw/zinc/65/53/91/857655391.db2.gz GVCNJTIYJXPYDS-XMSQKQJNSA-N 0 3 411.343 4.374 20 0 HIADHN C[C@H](CNC(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1)Sc1ccccc1 ZINC000429427151 857661069 /nfs/dbraw/zinc/66/10/69/857661069.db2.gz OOWYDBZIFSWGRJ-VAMGGRTRSA-N 0 3 419.635 4.088 20 0 HIADHN CCNC(=O)COc1cccc(CN[C@H](Cc2ccccc2F)c2ccccc2)c1 ZINC000429428964 857662252 /nfs/dbraw/zinc/66/22/52/857662252.db2.gz VIBPCFYAPDHZJH-XMMPIXPASA-N 0 3 406.501 4.414 20 0 HIADHN CCNC(=O)COc1cccc(CN[C@@H](Cc2ccccc2F)c2ccccc2)c1 ZINC000429428961 857662437 /nfs/dbraw/zinc/66/24/37/857662437.db2.gz VIBPCFYAPDHZJH-DEOSSOPVSA-N 0 3 406.501 4.414 20 0 HIADHN COc1cc(F)c([C@@H](C)NC[C@@H]2CSCCN2Cc2ccccc2)cc1OC ZINC000429446049 857673707 /nfs/dbraw/zinc/67/37/07/857673707.db2.gz GJKWDJDOJYDCBV-SJLPKXTDSA-N 0 3 404.551 4.111 20 0 HIADHN C[C@H](NC[C@@H](CO)Cc1cccc(Br)c1)c1nc2c(s1)CCCC2 ZINC000429456816 857679760 /nfs/dbraw/zinc/67/97/60/857679760.db2.gz RHSGZGHPAJNDJE-ZFWWWQNUSA-N 0 3 409.393 4.286 20 0 HIADHN COCCS(=O)(=O)c1ccc(CN[C@@H](C)c2cccc(-c3ccncc3)c2)cc1 ZINC000429455271 857679885 /nfs/dbraw/zinc/67/98/85/857679885.db2.gz PVTKWHGMJQXQNS-SFHVURJKSA-N 0 3 410.539 4.020 20 0 HIADHN Cc1cccc([C@@H](C)CNC(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)c1 ZINC000429460495 857682799 /nfs/dbraw/zinc/68/27/99/857682799.db2.gz YYARLBZMZGSWLJ-PCCBWWKXSA-N 0 3 401.595 4.019 20 0 HIADHN CC(C)N(Cc1cccnc1)C(=O)N[C@H](CN1CCc2ccccc2C1)C(C)(C)C ZINC000429481394 857690270 /nfs/dbraw/zinc/69/02/70/857690270.db2.gz BKQAHNVARWDVAL-HSZRJFAPSA-N 0 3 408.590 4.475 20 0 HIADHN CC(C)(C)[C@@H](CN1CCc2ccccc2C1)NC(=O)N1CCC[C@H]1c1cccnc1 ZINC000429495327 857697181 /nfs/dbraw/zinc/69/71/81/857697181.db2.gz VGLBGYOQKSEBKF-XZOQPEGZSA-N 0 3 406.574 4.401 20 0 HIADHN Cc1cccnc1[C@@H](NC(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1)C(C)C ZINC000429499424 857699297 /nfs/dbraw/zinc/69/92/97/857699297.db2.gz UDVXJTGNLROJNA-VWPQPMDRSA-N 0 3 416.610 4.008 20 0 HIADHN Cc1noc(C[C@H](NC[C@H](O)COc2ccc(C(C)(C)C)cc2C)c2ccccc2)n1 ZINC000429530835 857723620 /nfs/dbraw/zinc/72/36/20/857723620.db2.gz QNBYIAOENRFLKC-VXKWHMMOSA-N 0 3 423.557 4.297 20 0 HIADHN COC(=O)c1ccc(COc2ccccc2CN2CCC[C@@H](n3cccn3)C2)cc1 ZINC000437628360 862950452 /nfs/dbraw/zinc/95/04/52/862950452.db2.gz WCVDSPYWQNOMHQ-JOCHJYFZSA-N 0 3 405.498 4.086 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1ncc(F)cc1F)c1ccc(C(F)(F)F)cc1 ZINC000429647649 857816998 /nfs/dbraw/zinc/81/69/98/857816998.db2.gz ROLLWXATSFDACB-INIZCTEOSA-N 0 3 401.379 4.192 20 0 HIADHN Cc1ccc([C@H](CNC(=O)NC[C@H](c2ccccc2)C(C)(C)CO)N2CCCC2)cc1 ZINC000437629705 862955227 /nfs/dbraw/zinc/95/52/27/862955227.db2.gz PJASZCZYQRJGPU-RPWUZVMVSA-N 0 3 423.601 4.233 20 0 HIADHN CN(C)CCN(C(=O)Nc1ccnn1Cc1ccc(Cl)c(F)c1)C1CCCC1 ZINC000429706303 857843670 /nfs/dbraw/zinc/84/36/70/857843670.db2.gz VLSDPXJTYBMANZ-UHFFFAOYSA-N 0 3 407.921 4.062 20 0 HIADHN COC(=O)c1c(CN[C@@H]2CCC[C@@H]2CCO)nc2ccccc2c1-c1ccccc1 ZINC000429775469 857880756 /nfs/dbraw/zinc/88/07/56/857880756.db2.gz PHWUSQDMASQAOB-YLJYHZDGSA-N 0 3 404.510 4.329 20 0 HIADHN C[C@H](Oc1ccccc1NC(=O)C(=O)N(CCN(C)C)C1CCCC1)c1ccccc1 ZINC000429779639 857881939 /nfs/dbraw/zinc/88/19/39/857881939.db2.gz NVXNNCLTNBCWEH-IBGZPJMESA-N 0 3 423.557 4.098 20 0 HIADHN CC(C)N1CC[C@H](N[C@@H](C)C(=O)NCc2cccs2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000429777631 857882073 /nfs/dbraw/zinc/88/20/73/857882073.db2.gz WGIMKSWCYSQKRD-GKCIPKSASA-N 0 3 423.985 4.359 20 0 HIADHN C[C@H](C(=O)Nc1ccc(CCN2CCSCC2)cc1)[C@@H]1OCCc2sccc21 ZINC000429890925 857930572 /nfs/dbraw/zinc/93/05/72/857930572.db2.gz PZXYEMSTIVPJAJ-KKSFZXQISA-N 0 3 416.612 4.228 20 0 HIADHN CCN1CCN(c2cccc(NCc3cccc(OCc4ccccn4)c3)c2)CC1 ZINC000430009076 857994625 /nfs/dbraw/zinc/99/46/25/857994625.db2.gz JELMLFYYZDQZSF-UHFFFAOYSA-N 0 3 402.542 4.415 20 0 HIADHN COC(=O)[C@@]1(c2ccccc2)CCN(Cc2cn(C)nc2-c2ccccc2Cl)C1 ZINC000430086747 858024698 /nfs/dbraw/zinc/02/46/98/858024698.db2.gz QITZJTWSJXSIQB-QHCPKHFHSA-N 0 3 409.917 4.057 20 0 HIADHN COC(=O)[C@@H]1CCO[C@H]1C1CCN(Cc2ccccc2OCc2ccccc2)CC1 ZINC000430100973 858032215 /nfs/dbraw/zinc/03/22/15/858032215.db2.gz BTVWIFFEIFCJDS-VWNXMTODSA-N 0 3 409.526 4.056 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)N[C@@H](CC3CC3)c3cc(F)cc(Br)c3)[C@H]2C1 ZINC000430298931 858113785 /nfs/dbraw/zinc/11/37/85/858113785.db2.gz GXOKUJUOCFVAIN-CCKFTAQKSA-N 0 3 424.358 4.165 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)Nc3ccc4nc(C5CC5)oc4c3)cc2)CC1 ZINC000430439555 858164939 /nfs/dbraw/zinc/16/49/39/858164939.db2.gz OIUGYCAMZZULCX-UHFFFAOYSA-N 0 3 404.514 4.488 20 0 HIADHN Cc1nc(NC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)cc(C2CC2)n1 ZINC000430498522 858201856 /nfs/dbraw/zinc/20/18/56/858201856.db2.gz XAMSHIPWWMHXLR-HXUWFJFHSA-N 0 3 404.436 4.056 20 0 HIADHN CCn1ccnc1[C@H]1CCCCN1C(=O)NC[C@H](c1ccc(C)cc1)N1CCCC1 ZINC000430543508 858212747 /nfs/dbraw/zinc/21/27/47/858212747.db2.gz YQBSNUYUOXJJIA-FGZHOGPDSA-N 0 3 409.578 4.285 20 0 HIADHN CCn1ccnc1[C@H]1CCCCN1C(=O)NC[C@@H](c1ccc(C)cc1)N1CCCC1 ZINC000430543512 858212897 /nfs/dbraw/zinc/21/28/97/858212897.db2.gz YQBSNUYUOXJJIA-YADHBBJMSA-N 0 3 409.578 4.285 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)CCC(=O)c2ccc(F)cc2F)CCN1Cc1ccccc1 ZINC000430685687 858269015 /nfs/dbraw/zinc/26/90/15/858269015.db2.gz RZYORTWKPNMRSF-LPHOPBHVSA-N 0 3 400.469 4.097 20 0 HIADHN CC[C@H](N[C@@H](C)c1ccc(Br)c(S(N)(=O)=O)c1)c1ccc(C)cc1 ZINC000430692909 858271646 /nfs/dbraw/zinc/27/16/46/858271646.db2.gz XFPWMNCOVHIMKP-GUYCJALGSA-N 0 3 411.365 4.207 20 0 HIADHN CC(C)[C@H](N[C@@H](C)c1ccc(Br)c(S(N)(=O)=O)c1)c1ccccc1 ZINC000430694433 858272403 /nfs/dbraw/zinc/27/24/03/858272403.db2.gz DOGCHZZRZLNVDD-UGSOOPFHSA-N 0 3 411.365 4.144 20 0 HIADHN C[C@H](N[C@H]1CC(C)(C)c2ccccc21)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000430704711 858274035 /nfs/dbraw/zinc/27/40/35/858274035.db2.gz JJRZUKPHHCQVMR-SJCJKPOMSA-N 0 3 423.376 4.170 20 0 HIADHN Cc1cc([C@@H]2CCCN2C(=O)N[C@H](C)C2=CCN(C)CC2)ccc1Br ZINC000430886522 858354812 /nfs/dbraw/zinc/35/48/12/858354812.db2.gz UJHDJBOPFGGKKN-BEFAXECRSA-N 0 3 406.368 4.254 20 0 HIADHN COc1ccc([C@H](CNC(=O)N[C@H](c2ccccc2)C(F)F)N2CCCC2)cc1 ZINC000430953113 858381364 /nfs/dbraw/zinc/38/13/64/858381364.db2.gz GBFGSRDSJZZXCX-VQTJNVASSA-N 0 3 403.473 4.138 20 0 HIADHN CC1CCN([C@H](CN2C(=O)[C@H](Cc3ccccc3)N(C)C2=O)c2cccs2)CC1 ZINC000430955317 858381479 /nfs/dbraw/zinc/38/14/79/858381479.db2.gz LXPSLGXORASVJQ-VQTJNVASSA-N 0 3 411.571 4.026 20 0 HIADHN CC[C@@H](c1ccccc1)N1CC(=O)N(C[C@H](c2cccc(OC)c2)N2CCCC2)C1=O ZINC000430955515 858382449 /nfs/dbraw/zinc/38/24/49/858382449.db2.gz AUGQIFWPFYXELL-XZOQPEGZSA-N 0 3 421.541 4.248 20 0 HIADHN O=S(=O)(Cc1ccc(F)c(Cl)c1)NCc1ccccc1CN1CCCCC1 ZINC000431066957 858431156 /nfs/dbraw/zinc/43/11/56/858431156.db2.gz BOGULBNRXVBOID-UHFFFAOYSA-N 0 3 410.942 4.085 20 0 HIADHN O=C1N[C@@H](c2ccc3ccccc3c2)C(=O)N1C[C@@H]1CCCN(Cc2cccs2)C1 ZINC000431166960 858482602 /nfs/dbraw/zinc/48/26/02/858482602.db2.gz MJIFHJMPFNETSX-VGSWGCGISA-N 0 3 419.550 4.406 20 0 HIADHN O=C1N[C@@H](c2ccc(Cl)c(F)c2)C(=O)N1C[C@@H]1CCCN(Cc2cccs2)C1 ZINC000431169645 858484049 /nfs/dbraw/zinc/48/40/49/858484049.db2.gz MWAYWTFKTVYOBB-ACJLOTCBSA-N 0 3 421.925 4.046 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)c1ccc(-c2cc[nH]n2)s1 ZINC000431499049 858644617 /nfs/dbraw/zinc/64/46/17/858644617.db2.gz CFNNPKISXKROCS-UHFFFAOYSA-N 0 3 422.476 4.361 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)N[C@H]1C[C@@H]1c1ccccc1OC(F)F ZINC000437723613 863053387 /nfs/dbraw/zinc/05/33/87/863053387.db2.gz KTBRFGQXIMSXDU-SXLOBPIMSA-N 0 3 415.484 4.108 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)C1(Cc2ccc(F)cc2)CCOCC1 ZINC000431683054 858737240 /nfs/dbraw/zinc/73/72/40/858737240.db2.gz WXRXJDXJLNMEOJ-HXUWFJFHSA-N 0 3 416.562 4.180 20 0 HIADHN O=C(c1cccc(OCC(F)(F)F)c1)N1CCCN(CCCc2ccccc2)CC1 ZINC000431947377 858882970 /nfs/dbraw/zinc/88/29/70/858882970.db2.gz YXVSCJBYGABBKS-UHFFFAOYSA-N 0 3 420.475 4.408 20 0 HIADHN COc1cccc(C2(F)CCN(Cc3c[nH]nc3-c3ccc4c(c3)OCCO4)CC2)c1 ZINC000467540099 881362659 /nfs/dbraw/zinc/36/26/59/881362659.db2.gz OALSPXAIGOIIIH-UHFFFAOYSA-N 0 3 423.488 4.317 20 0 HIADHN COCCN(C)CCNC(=O)c1c(-c2c(Cl)cccc2Cl)noc1C(C)C ZINC000431956700 858886938 /nfs/dbraw/zinc/88/69/38/858886938.db2.gz UZRNESXORFEEFS-UHFFFAOYSA-N 0 3 414.333 4.080 20 0 HIADHN CC(C)CN(CCN(C)C)C(=O)c1cc(COc2c(Cl)cccc2Cl)on1 ZINC000467537803 881358001 /nfs/dbraw/zinc/35/80/01/881358001.db2.gz ZSLNHWYCPAIVIS-UHFFFAOYSA-N 0 3 414.333 4.220 20 0 HIADHN COC(=O)C12CCC(C(=O)NC[C@@H](c3cccs3)N3CCC(C)CC3)(CC1)CC2 ZINC000432039162 858944905 /nfs/dbraw/zinc/94/49/05/858944905.db2.gz DDIAFHKCRYONII-NWLLBJEDSA-N 0 3 418.603 4.151 20 0 HIADHN Cc1ccc(NC(=O)N(CCN(C)C)C2CCCC2)cc1OCC1CCOCC1 ZINC000467546865 881368051 /nfs/dbraw/zinc/36/80/51/881368051.db2.gz CQYWZXWBLWXULR-UHFFFAOYSA-N 0 3 403.567 4.139 20 0 HIADHN CCOc1cc(CN2CCCO[C@H](CC)C2)ccc1OCC(=O)N(C(C)C)C(C)C ZINC000467563608 881385527 /nfs/dbraw/zinc/38/55/27/881385527.db2.gz PTOZNYDQJVQOFP-OAQYLSRUSA-N 0 3 420.594 4.110 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Cc1cscc1Br)c1ccsc1 ZINC000432403360 859147103 /nfs/dbraw/zinc/14/71/03/859147103.db2.gz RTSHJOZTYNTYLF-HNNXBMFYSA-N 0 3 401.395 4.314 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Cc1cscc1Br)c1ccsc1 ZINC000432403361 859147759 /nfs/dbraw/zinc/14/77/59/859147759.db2.gz RTSHJOZTYNTYLF-OAHLLOKOSA-N 0 3 401.395 4.314 20 0 HIADHN CC[C@@H](CNC(=O)C1(Cc2cccc(F)c2)CCOCC1)N1CCc2ccccc2C1 ZINC000432501771 859196222 /nfs/dbraw/zinc/19/62/22/859196222.db2.gz MZRILSYHASFSIT-DEOSSOPVSA-N 0 3 424.560 4.118 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)N[C@@H](c1ccccc1)C(F)F ZINC000432768112 859348121 /nfs/dbraw/zinc/34/81/21/859348121.db2.gz MZOWGJFBJZDKKA-IBGZPJMESA-N 0 3 405.514 4.406 20 0 HIADHN c1ccc(C(OCCN2CCN(CCC3CCOCC3)CC2)c2ccccc2)cc1 ZINC000432827314 859376203 /nfs/dbraw/zinc/37/62/03/859376203.db2.gz CVSDYFVEIPIYPB-UHFFFAOYSA-N 0 3 408.586 4.227 20 0 HIADHN Cc1ccc(-c2ccc(C)c(NC(=O)NC[C@]3(O)CCN(Cc4ccccc4)C3)c2)o1 ZINC000432978638 859460578 /nfs/dbraw/zinc/46/05/78/859460578.db2.gz JXLFISWFNJFDSM-RUZDIDTESA-N 0 3 419.525 4.322 20 0 HIADHN Cc1ccc(-c2ccc(C)c(NC(=O)N3CC[C@@H](N4CCN(C)CC4)[C@H](C)C3)c2)o1 ZINC000432992954 859468155 /nfs/dbraw/zinc/46/81/55/859468155.db2.gz KXDGCBFOAWQTDR-XMSQKQJNSA-N 0 3 410.562 4.053 20 0 HIADHN CCc1ccc([C@@H]2CCN(Cc3nnc(-c4cc(OC)c(OC)c(OC)c4)o3)C2)cc1 ZINC000433044843 859496848 /nfs/dbraw/zinc/49/68/48/859496848.db2.gz KNLAIVFZQYTQDP-GOSISDBHSA-N 0 3 423.513 4.314 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)CN2CCC[C@@H](c3ccccc3)C2)cc1OC ZINC000433077182 859512116 /nfs/dbraw/zinc/51/21/16/859512116.db2.gz NFTZLTIZYOJSPL-YADHBBJMSA-N 0 3 408.542 4.247 20 0 HIADHN CCCc1c(NC(=O)N(CCN(C)C)Cc2ccco2)cnn1-c1ccc(C)cc1 ZINC000433112126 859525903 /nfs/dbraw/zinc/52/59/03/859525903.db2.gz ZWLGWFIVGMWVMT-UHFFFAOYSA-N 0 3 409.534 4.322 20 0 HIADHN Cc1cnc(C2CCN(C[C@H](O)COc3cccc(C(F)(F)F)c3)CC2)s1 ZINC000433161369 859547187 /nfs/dbraw/zinc/54/71/87/859547187.db2.gz QYBBJTBTLOMYQR-INIZCTEOSA-N 0 3 400.466 4.090 20 0 HIADHN NC(=O)c1ccc(NC(=O)CCN2CCC[C@H]2c2ccc(Cl)cc2)cc1Cl ZINC000433297680 859624037 /nfs/dbraw/zinc/62/40/37/859624037.db2.gz WYEVULOQBBSVCI-SFHVURJKSA-N 0 3 406.313 4.258 20 0 HIADHN O=C(COc1cccc(NC(=O)[C@@H]2CCCCN2C2CCCC2)c1)Nc1ccccc1 ZINC000433306086 859629140 /nfs/dbraw/zinc/62/91/40/859629140.db2.gz RBIXUZUDTFUZCO-QHCPKHFHSA-N 0 3 421.541 4.440 20 0 HIADHN CCCN(C(=O)c1cc2ccccc2c(=O)o1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000433355290 859658588 /nfs/dbraw/zinc/65/85/88/859658588.db2.gz VPCHRNQTDJKBNK-NRFANRHFSA-N 0 3 404.510 4.310 20 0 HIADHN CCCN(C(=O)c1cc2ccccc2c(=O)o1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000433355293 859658880 /nfs/dbraw/zinc/65/88/80/859658880.db2.gz VPCHRNQTDJKBNK-OAQYLSRUSA-N 0 3 404.510 4.310 20 0 HIADHN NC(=O)c1cccc(Oc2ccc(NC(=O)[C@@H]3CCCCN3C3CCCC3)cc2)c1 ZINC000433358862 859660049 /nfs/dbraw/zinc/66/00/49/859660049.db2.gz FGHXIKOQQVXDMC-QFIPXVFZSA-N 0 3 407.514 4.313 20 0 HIADHN C[C@@H]1C[C@@]2(CCN1Cc1ccccc1)Nc1ccc(Br)cc1C(=O)N2C ZINC000433373687 859662845 /nfs/dbraw/zinc/66/28/45/859662845.db2.gz KKJOMGYNFHGMSP-VFNWGFHPSA-N 0 3 414.347 4.327 20 0 HIADHN C[C@H]1C[C@@]2(CCN1Cc1ccccc1)Nc1ccc(Br)cc1C(=O)N2C ZINC000433373678 859663528 /nfs/dbraw/zinc/66/35/28/859663528.db2.gz KKJOMGYNFHGMSP-BTYIYWSLSA-N 0 3 414.347 4.327 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N[C@H](c2cc(F)ccc2F)C(F)F)C1 ZINC000433628206 859816501 /nfs/dbraw/zinc/81/65/01/859816501.db2.gz JIDRDSWPVKHZQU-ACWOFJMJSA-N 0 3 409.427 4.406 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)N[C@H](c1cc(F)ccc1F)C(F)F ZINC000433647217 859823081 /nfs/dbraw/zinc/82/30/81/859823081.db2.gz CDRXCIBZCJJURH-RBUKOAKNSA-N 0 3 409.427 4.407 20 0 HIADHN CCN(C(=O)Nc1ccc(F)cc1-c1cnn(C)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000433781492 859890431 /nfs/dbraw/zinc/89/04/31/859890431.db2.gz WZQFMTXIWMOJEG-NRFANRHFSA-N 0 3 421.520 4.355 20 0 HIADHN Cn1cc(-c2cc(F)ccc2NC(=O)NC[C@H](c2cccs2)N2CCCC2)cn1 ZINC000433797529 859896572 /nfs/dbraw/zinc/89/65/72/859896572.db2.gz AUJLRUPIARVQPQ-LJQANCHMSA-N 0 3 413.522 4.246 20 0 HIADHN CN(C)Cc1cccc(NC(=O)C(=O)N[C@H](c2cccc(Cl)c2)C2CCCC2)c1 ZINC000433886335 859951225 /nfs/dbraw/zinc/95/12/25/859951225.db2.gz CCHGDWNBTCENIW-NRFANRHFSA-N 0 3 413.949 4.388 20 0 HIADHN Cc1c(NC(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)noc1-c1ccccc1F ZINC000433894493 859954445 /nfs/dbraw/zinc/95/44/45/859954445.db2.gz RTTMUYPQGHAPOB-KRWDZBQOSA-N 0 3 422.504 4.917 20 0 HIADHN O=C(NC[C@@H]1CCCCN1C1CC1)N1CCC[C@@H](c2nc(C(F)(F)F)cs2)C1 ZINC000433955525 860000813 /nfs/dbraw/zinc/00/08/13/860000813.db2.gz ONQKQZDLIUHYKP-HIFRSBDPSA-N 0 3 416.513 4.068 20 0 HIADHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(Oc2cccc(Cl)c2Cl)nn1 ZINC000434020804 860044546 /nfs/dbraw/zinc/04/45/46/860044546.db2.gz IJUODEMUCMNDAJ-KGLIPLIRSA-N 0 3 421.328 4.275 20 0 HIADHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(-c2ccc(OC)cc2F)cc1F ZINC000434055986 860068662 /nfs/dbraw/zinc/06/86/62/860068662.db2.gz BRMHRVMZHDTEQY-SJORKVTESA-N 0 3 400.469 4.339 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)CCCc2ncc(-c3ccccc3)o2)CN1Cc1ccccc1 ZINC000467701300 881497738 /nfs/dbraw/zinc/49/77/38/881497738.db2.gz TYVAUWUISWIKSZ-KNQAVFIVSA-N 0 3 403.526 4.444 20 0 HIADHN C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)CSc1ncnc2scc(-c3ccccc3)c21 ZINC000467714001 881510924 /nfs/dbraw/zinc/51/09/24/881510924.db2.gz KUJKNQJXZHCFJX-RDTXWAMCSA-N 0 3 424.595 4.049 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)c1ccc(-c2nc(C3CC3)no2)cc1 ZINC000434217998 860202965 /nfs/dbraw/zinc/20/29/65/860202965.db2.gz OSHIGDMQODPWAP-NRFANRHFSA-N 0 3 402.498 4.181 20 0 HIADHN Cc1ccccc1-c1cc(C(=O)N[C@H]2CN(C3CC3)C[C@@H]2C)c2cnn(C(C)C)c2n1 ZINC000467716572 881514998 /nfs/dbraw/zinc/51/49/98/881514998.db2.gz SXBNVAKYYLWWHN-SBUREZEXSA-N 0 3 417.557 4.200 20 0 HIADHN Cc1ccccc1-c1cc(C(=O)N[C@@H]2CN(C3CC3)C[C@H]2C)c2cnn(C(C)C)c2n1 ZINC000467716573 881515309 /nfs/dbraw/zinc/51/53/09/881515309.db2.gz SXBNVAKYYLWWHN-UZUQRXQVSA-N 0 3 417.557 4.200 20 0 HIADHN Cc1ccccc1-c1nn(-c2ccccc2)cc1C(=O)N[C@@H]1CN(C2CC2)C[C@H]1C ZINC000467718891 881518272 /nfs/dbraw/zinc/51/82/72/881518272.db2.gz VDKCUHFIJAAVKO-WZONZLPQSA-N 0 3 400.526 4.060 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)[C@@H](C)Oc1cccc(C)c1 ZINC000434308883 860270723 /nfs/dbraw/zinc/27/07/23/860270723.db2.gz PZTBPWFOLRFJDV-IRLDBZIGSA-N 0 3 418.541 4.353 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)CSCCC(C)C ZINC000434319908 860279624 /nfs/dbraw/zinc/27/96/24/860279624.db2.gz WZJJWZJBALLWBN-HXUWFJFHSA-N 0 3 400.592 4.356 20 0 HIADHN CC(=O)c1ccc(C(=O)Nc2c(C)cnn2[C@@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000434320558 860281072 /nfs/dbraw/zinc/28/10/72/860281072.db2.gz DDCOTINEESQQCK-JOCHJYFZSA-N 0 3 402.498 4.093 20 0 HIADHN COc1ccc(CCC(=O)Nc2c(C)cnn2[C@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000434323501 860285063 /nfs/dbraw/zinc/28/50/63/860285063.db2.gz JOMDZWVOCFFHHB-QFIPXVFZSA-N 0 3 418.541 4.218 20 0 HIADHN Cc1cc(C)n([C@@H](C)CC(=O)Nc2c(C)cnn2[C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000434324444 860285841 /nfs/dbraw/zinc/28/58/41/860285841.db2.gz DEGHEODPCRIMEX-RBBKRZOGSA-N 0 3 420.561 4.042 20 0 HIADHN CCO[C@@H](CC(=O)Nc1c(C)cnn1[C@H]1CCN(Cc2ccccc2)C1)C1=CCCC1 ZINC000434333127 860295168 /nfs/dbraw/zinc/29/51/68/860295168.db2.gz DKJDYFMTLLGDOU-GOTSBHOMSA-N 0 3 422.573 4.483 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1cncc(OC(C)C)c1 ZINC000434335981 860297644 /nfs/dbraw/zinc/29/76/44/860297644.db2.gz XUERZTDKGIJCIN-NRFANRHFSA-N 0 3 419.529 4.073 20 0 HIADHN CCc1ccc(CC(=O)Nc2c(C)cnn2[C@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000434337911 860298801 /nfs/dbraw/zinc/29/88/01/860298801.db2.gz ZGNCSKZMQWBFFX-QHCPKHFHSA-N 0 3 402.542 4.382 20 0 HIADHN Cc1ccc(C(=O)NC[C@H]2CCCCN2C2CC2)cc1NC(=O)c1ccccc1F ZINC000434426441 860345685 /nfs/dbraw/zinc/34/56/85/860345685.db2.gz VNPJBWNQAOGZJV-LJQANCHMSA-N 0 3 409.505 4.133 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)NC[C@H]2CCCN(c3ccccc3)C2)CC1 ZINC000434507477 860379151 /nfs/dbraw/zinc/37/91/51/860379151.db2.gz ZQQYLQFSSMFYDT-HSZRJFAPSA-N 0 3 420.601 4.209 20 0 HIADHN C[C@H](C(=O)Nc1cccc(C(F)(F)F)c1)N1CCC(c2ncc3n2CCCC3)CC1 ZINC000434663251 860450515 /nfs/dbraw/zinc/45/05/15/860450515.db2.gz FGGNDOHKTYNNPF-OAHLLOKOSA-N 0 3 420.479 4.445 20 0 HIADHN C[C@@H](C(=O)Nc1ccc(C(F)(F)F)cc1)N1CCC(c2ncc3n2CCCC3)CC1 ZINC000434682875 860458090 /nfs/dbraw/zinc/45/80/90/860458090.db2.gz BIPXRBGOCWFYOG-HNNXBMFYSA-N 0 3 420.479 4.445 20 0 HIADHN C[C@@H](c1ccc(Cl)cc1)N(C)C(=O)CN1CCC(c2ncc3n2CCCC3)CC1 ZINC000434686261 860460824 /nfs/dbraw/zinc/46/08/24/860460824.db2.gz SCGWEONYYOJHLV-KRWDZBQOSA-N 0 3 414.981 4.272 20 0 HIADHN C[C@@H](CC(=O)NCCCCN1C[C@@H](C)O[C@@H](C)C1)c1cccc(C(F)(F)F)c1 ZINC000434779348 860492411 /nfs/dbraw/zinc/49/24/11/860492411.db2.gz USGSIWHJKGWIQF-YESZJQIVSA-N 0 3 400.485 4.205 20 0 HIADHN O[C@@H](COc1c(Cl)cccc1Cl)CN1CCC(OCC2CCCC2)CC1 ZINC000434904444 860547569 /nfs/dbraw/zinc/54/75/69/860547569.db2.gz FCVHCVWIIARWBI-MRXNPFEDSA-N 0 3 402.362 4.404 20 0 HIADHN Cc1cnc(C(NC(=O)C(=O)Nc2nc(C3CC4CCC3C4)cs2)C2CC2)s1 ZINC000434931414 860560294 /nfs/dbraw/zinc/56/02/94/860560294.db2.gz NFYIANSFWJQRIS-YYWXWVFPSA-N 0 3 416.572 4.018 20 0 HIADHN COc1ccccc1-c1nc(C2CCN(Cc3ccc(-c4cc[nH]n4)o3)CC2)no1 ZINC000434986825 860587053 /nfs/dbraw/zinc/58/70/53/860587053.db2.gz JFFQJJBDZCIZLO-UHFFFAOYSA-N 0 3 405.458 4.108 20 0 HIADHN CC(C)c1ccc(C(=O)N(CCN(C)C)Cc2ccc(Br)cc2)cn1 ZINC000435011959 860597200 /nfs/dbraw/zinc/59/72/00/860597200.db2.gz FTFDYJHAOLDSJB-UHFFFAOYSA-N 0 3 404.352 4.172 20 0 HIADHN c1c(CN2CC[C@@H](Oc3ccncc3)C2)c(-c2cccnc2)nn1Cc1ccccc1 ZINC000435048509 860615012 /nfs/dbraw/zinc/61/50/12/860615012.db2.gz BEQHYQAWECYXQG-XMMPIXPASA-N 0 3 411.509 4.042 20 0 HIADHN Cc1cc(NC(=O)CCOCc2ccccc2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435273403 860711483 /nfs/dbraw/zinc/71/14/83/860711483.db2.gz ZFZWSWFJFNVVDR-QHCPKHFHSA-N 0 3 418.541 4.184 20 0 HIADHN CCn1nc(C(C)C)cc1C(=O)Nc1cc(C)nn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435272544 860711869 /nfs/dbraw/zinc/71/18/69/860711869.db2.gz RVBMQIKAWHRYOP-HXUWFJFHSA-N 0 3 420.561 4.231 20 0 HIADHN CCCc1ncc(C(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)s1 ZINC000435280991 860716146 /nfs/dbraw/zinc/71/61/46/860716146.db2.gz PCHCVJMIPXZXOE-SFHVURJKSA-N 0 3 409.559 4.300 20 0 HIADHN Cc1cc(NC(=O)Cc2ccc(F)cc2F)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435292376 860722428 /nfs/dbraw/zinc/72/24/28/860722428.db2.gz RMVLDHRTAIOMLQ-HXUWFJFHSA-N 0 3 410.468 4.098 20 0 HIADHN CCC(=O)c1ccc(C(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000435293256 860723086 /nfs/dbraw/zinc/72/30/86/860723086.db2.gz WTNKDWJUGDJUKF-QFIPXVFZSA-N 0 3 416.525 4.484 20 0 HIADHN Cc1cc(NC(=O)Cc2ccc3c(c2)CCC3)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435298697 860725948 /nfs/dbraw/zinc/72/59/48/860725948.db2.gz ZATQHFUQOLXIAP-XMMPIXPASA-N 0 3 414.553 4.308 20 0 HIADHN Cc1cc(NC(=O)COc2cccc(Cl)c2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435303620 860728761 /nfs/dbraw/zinc/72/87/61/860728761.db2.gz ZPUVAEIVGGVTOJ-HXUWFJFHSA-N 0 3 424.932 4.309 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)c2[nH]c3ccccc3c2Br)CN1Cc1ccccc1 ZINC000467757668 881573920 /nfs/dbraw/zinc/57/39/20/881573920.db2.gz ITCOFDWAJZYFGL-GOEBONIOSA-N 0 3 412.331 4.323 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)Nc2c3c(ccc2Cl)CC(C)(C)O3)CC1 ZINC000435335064 860745722 /nfs/dbraw/zinc/74/57/22/860745722.db2.gz JJGGACKRUNXCDH-UHFFFAOYSA-N 0 3 409.958 4.064 20 0 HIADHN COc1ccc(Cl)cc1C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435368521 860766283 /nfs/dbraw/zinc/76/62/83/860766283.db2.gz IMFGSDVDGJSNHF-SFHVURJKSA-N 0 3 410.905 4.244 20 0 HIADHN O=C(Cc1c[nH]c2cc(F)ccc12)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435370639 860768113 /nfs/dbraw/zinc/76/81/13/860768113.db2.gz PTLONGKEKNFVKF-HXUWFJFHSA-N 0 3 417.488 4.132 20 0 HIADHN Cc1nc2ccccc2cc1C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435371871 860769438 /nfs/dbraw/zinc/76/94/38/860769438.db2.gz XTKAALLSKQVNJM-OAQYLSRUSA-N 0 3 411.509 4.439 20 0 HIADHN CCCOc1cccc(CC(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000435372687 860770545 /nfs/dbraw/zinc/77/05/45/860770545.db2.gz BNAFKJKEFHHMPZ-JOCHJYFZSA-N 0 3 418.541 4.300 20 0 HIADHN CCCOc1cccc(CC(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000435372688 860770712 /nfs/dbraw/zinc/77/07/12/860770712.db2.gz BNAFKJKEFHHMPZ-QFIPXVFZSA-N 0 3 418.541 4.300 20 0 HIADHN C[C@H](Oc1ccccc1Cl)C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435375299 860773199 /nfs/dbraw/zinc/77/31/99/860773199.db2.gz LRGDOFVGCCONLT-HKUYNNGSSA-N 0 3 424.932 4.390 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)[C@H]1C[C@H]1c1ccc(F)cc1F ZINC000435375804 860773956 /nfs/dbraw/zinc/77/39/56/860773956.db2.gz WTGGGYBXPSMIFN-GIVPXCGWSA-N 0 3 422.479 4.351 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)[C@@H]1C[C@@H]1c1cc(F)ccc1F ZINC000435378135 860774835 /nfs/dbraw/zinc/77/48/35/860774835.db2.gz CDDKUFVRSCSMCF-SFHLNBCPSA-N 0 3 422.479 4.351 20 0 HIADHN Cc1cc2ccccc2n1CC(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435377300 860775118 /nfs/dbraw/zinc/77/51/18/860775118.db2.gz ZZRBHFMLXIUNAH-QFIPXVFZSA-N 0 3 413.525 4.232 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)c1cc(F)c(F)c(F)c1F ZINC000435379031 860776014 /nfs/dbraw/zinc/77/60/14/860776014.db2.gz HLDZTCNEOMODHD-CQSZACIVSA-N 0 3 418.394 4.139 20 0 HIADHN Cc1cc(NC(=O)NCc2ccc(F)cc2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435513495 860831299 /nfs/dbraw/zinc/83/12/99/860831299.db2.gz DQQGDWRKUQCLBP-NRFANRHFSA-N 0 3 407.493 4.099 20 0 HIADHN Cc1cc(NC(=O)N(C)Cc2ccccc2F)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435512816 860831752 /nfs/dbraw/zinc/83/17/52/860831752.db2.gz AYECRGDYMTYJKN-NRFANRHFSA-N 0 3 421.520 4.442 20 0 HIADHN Cc1cc(NC(=O)N2CCC[C@H]2C2CCC2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435517151 860835062 /nfs/dbraw/zinc/83/50/62/860835062.db2.gz OVNBBZUOWDAMPN-YADHBBJMSA-N 0 3 407.562 4.435 20 0 HIADHN Cc1cc(NC(=O)NCc2ccc(C)cc2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435517708 860835291 /nfs/dbraw/zinc/83/52/91/860835291.db2.gz RDAXMSNWAXCGLI-QFIPXVFZSA-N 0 3 403.530 4.269 20 0 HIADHN Cc1cc(NC(=O)N(C)[C@H](C)c2ccncc2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435521787 860838503 /nfs/dbraw/zinc/83/85/03/860838503.db2.gz YBECLMSXJGYVLU-KNQAVFIVSA-N 0 3 418.545 4.258 20 0 HIADHN CCSCC[C@@H](C)NC(=O)Nc1cc(C)nn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435521690 860838738 /nfs/dbraw/zinc/83/87/38/860838738.db2.gz IOOWBFBYLIQCKU-YLJYHZDGSA-N 0 3 415.607 4.292 20 0 HIADHN Cc1cc(NC(=O)N[C@H]2CCc3ccccc32)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435526828 860843622 /nfs/dbraw/zinc/84/36/22/860843622.db2.gz JRHYOKBOMFZNQL-GMAHTHKFSA-N 0 3 415.541 4.448 20 0 HIADHN CCN(Cc1ccncc1)C(=O)Nc1cc(C)nn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435536653 860850555 /nfs/dbraw/zinc/85/05/55/860850555.db2.gz UWFKTMYWMCSUBD-QFIPXVFZSA-N 0 3 418.545 4.088 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCC(c2cnc[nH]2)CC1)c1ccccc1Cl ZINC000435580796 860896187 /nfs/dbraw/zinc/89/61/87/860896187.db2.gz SGQBNWUGGGPPNP-HXUWFJFHSA-N 0 3 403.958 4.035 20 0 HIADHN Cc1cc(NC(=O)[C@@H](C)Sc2ccccn2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435689550 860971743 /nfs/dbraw/zinc/97/17/43/860971743.db2.gz AZVHQVXAIKHAQZ-UYAOXDASSA-N 0 3 421.570 4.153 20 0 HIADHN Cc1ccc(NC(=O)[C@H](N[C@H]2CC[C@@H](C(=O)N3CCCC3)C2)c2ccccc2)cc1 ZINC000435792331 861063916 /nfs/dbraw/zinc/06/39/16/861063916.db2.gz UXUSASRBGNMMQG-AKIFATBCSA-N 0 3 405.542 4.056 20 0 HIADHN Cc1ccc([C@H](NCCCC(=O)Nc2c(C)cccc2C)[C@H](C)S(C)(=O)=O)cc1 ZINC000435903114 861160966 /nfs/dbraw/zinc/16/09/66/861160966.db2.gz PMWBHRYWZPCCMD-WMZHIEFXSA-N 0 3 416.587 4.095 20 0 HIADHN C[C@@H]1CCN(C(=O)Nc2ccc(OC[C@@H]3CCCO3)cc2)CCN1Cc1ccccc1 ZINC000437742519 863069372 /nfs/dbraw/zinc/06/93/72/863069372.db2.gz GCIRORBPAUPQMQ-YKSBVNFPSA-N 0 3 423.557 4.373 20 0 HIADHN COCCOc1cc(C)ccc1NC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC000437807622 863131880 /nfs/dbraw/zinc/13/18/80/863131880.db2.gz WNFIDANQCXCZJN-HXUWFJFHSA-N 0 3 411.546 4.149 20 0 HIADHN COCCOc1ccc(NC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)c(C)c1 ZINC000437813733 863145896 /nfs/dbraw/zinc/14/58/96/863145896.db2.gz BZGOJJMXOMBAIQ-HXUWFJFHSA-N 0 3 411.546 4.149 20 0 HIADHN COCCCOc1ccccc1NC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1 ZINC000437850605 863210485 /nfs/dbraw/zinc/21/04/85/863210485.db2.gz XAZFALKUARICKR-FQEVSTJZSA-N 0 3 411.546 4.230 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)N[C@@H]3C[C@H]3c3ccc4ccccc4c3)CC2)C[C@@H](C)O1 ZINC000437896821 863266356 /nfs/dbraw/zinc/26/63/56/863266356.db2.gz QSPKKPIAODQMLT-ZSVMJGIMSA-N 0 3 421.585 4.227 20 0 HIADHN COc1ccc2cc(NC(=O)N3CC[C@H](C)N(Cc4ccccc4)CC3)ccc2n1 ZINC000437966182 863336530 /nfs/dbraw/zinc/33/65/30/863336530.db2.gz VRXWKIMMESHABJ-SFHVURJKSA-N 0 3 404.514 4.372 20 0 HIADHN Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)NC[C@H](C)CN1CCN(C)CC1 ZINC000437990797 863353060 /nfs/dbraw/zinc/35/30/60/863353060.db2.gz XKZIMPGXUOFYIV-FPOVZHCZSA-N 0 3 424.589 4.140 20 0 HIADHN O=C(N[C@H]1C[C@@H]1c1ccccc1OC(F)F)N1CCCN(Cc2ccccc2)CC1 ZINC000438036765 863395869 /nfs/dbraw/zinc/39/58/69/863395869.db2.gz PETPNWYQSGSIHG-UXHICEINSA-N 0 3 415.484 4.061 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)N[C@H]3C[C@H](c4cccc(Cl)c4)C3)CC2)C[C@H](C)O1 ZINC000438071820 863455659 /nfs/dbraw/zinc/45/56/59/863455659.db2.gz KNNWPZJVOIUUBK-WSYLDTRHSA-N 0 3 419.997 4.117 20 0 HIADHN C[C@@H]1CCC[C@H](OCc2cccc(NC(=O)N(CCN(C)C)C[C@@H]3CCCO3)c2)C1 ZINC000438074767 863459413 /nfs/dbraw/zinc/45/94/13/863459413.db2.gz DUEMBPUUVZWLFH-OIBXWCBGSA-N 0 3 417.594 4.356 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)N[C@H]1C[C@@H]1c1ccccc1OC(F)F ZINC000438202467 863631558 /nfs/dbraw/zinc/63/15/58/863631558.db2.gz NJYMODCXCVPYME-IKGGRYGDSA-N 0 3 421.513 4.342 20 0 HIADHN Cc1ccc2cc(CNCc3ccc(C(=O)N4C[C@@H](C)O[C@H](C)C4)cc3)ccc2n1 ZINC000438203214 863633074 /nfs/dbraw/zinc/63/30/74/863633074.db2.gz PIVIONHPYDWXIQ-RTBURBONSA-N 0 3 403.526 4.082 20 0 HIADHN Cc1nc(-c2cccc(NC(=O)N3CC[C@H](C)N(Cc4ccccc4)CC3)c2)no1 ZINC000438221741 863655817 /nfs/dbraw/zinc/65/58/17/863655817.db2.gz BNBGNEACDMQEKK-KRWDZBQOSA-N 0 3 405.502 4.173 20 0 HIADHN CN(C)CCN(C[C@@H]1CCCO1)C(=O)Nc1ccc(Oc2ccc(Cl)cc2)nc1 ZINC000438232205 863672054 /nfs/dbraw/zinc/67/20/54/863672054.db2.gz PIRIIFJHCAOYPG-IBGZPJMESA-N 0 3 418.925 4.102 20 0 HIADHN Cc1ccc(SCC(F)(F)F)c(NC(=O)N(CCN(C)C)C[C@H]2CCCO2)c1 ZINC000438316963 863795998 /nfs/dbraw/zinc/79/59/98/863795998.db2.gz XKJBBKMCSXDDHE-OAHLLOKOSA-N 0 3 419.513 4.224 20 0 HIADHN C[C@H](NCCC(=O)N(C)Cc1ccccc1Br)c1ccc(F)c(F)c1 ZINC000467849688 881696624 /nfs/dbraw/zinc/69/66/24/881696624.db2.gz HHJLWHHELPXBEG-ZDUSSCGKSA-N 0 3 411.290 4.427 20 0 HIADHN CCN1CCC[C@@H](CN(C)C(=O)c2ncsc2-c2ccccc2)[C@@H]1c1cnn(C)c1 ZINC000438351500 863819285 /nfs/dbraw/zinc/81/92/85/863819285.db2.gz DUEPAVDIEZDMCK-GHTZIAJQSA-N 0 3 423.586 4.089 20 0 HIADHN CCOc1cc2c(cc1NC(=O)N(CCN(C)C)Cc1cccs1)O[C@H](C)C2 ZINC000438358282 863823185 /nfs/dbraw/zinc/82/31/85/863823185.db2.gz UXAMCIAXQMFUKV-OAHLLOKOSA-N 0 3 403.548 4.066 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)Nc1ccc(CC(F)(F)F)cc1 ZINC000438368457 863829970 /nfs/dbraw/zinc/82/99/70/863829970.db2.gz BGUWYGIXWAKTQG-UHFFFAOYSA-N 0 3 401.498 4.275 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)N[C@H]1C[C@H](c2ccccc2F)C1 ZINC000438416310 863855960 /nfs/dbraw/zinc/85/59/60/863855960.db2.gz HVJGTTUQMFSARS-SAABIXHNSA-N 0 3 405.464 4.123 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)N[C@H]2C[C@H](c3cc(F)cc(F)c3)C2)CC1 ZINC000438448532 863874237 /nfs/dbraw/zinc/87/42/37/863874237.db2.gz RLTFFDIZQPBOKP-RUCARUNLSA-N 0 3 403.473 4.110 20 0 HIADHN COC(=O)C(C)(C)c1ccc(NC(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)cc1 ZINC000438458388 863881734 /nfs/dbraw/zinc/88/17/34/863881734.db2.gz SQNMGXXIBIZOFD-DYESRHJHSA-N 0 3 409.530 4.094 20 0 HIADHN COc1ccc(-c2nc(C(=O)N(CCN(C)C)Cc3cccs3)cs2)cc1 ZINC000438462073 863883971 /nfs/dbraw/zinc/88/39/71/863883971.db2.gz PSACCFNCRMWSJU-UHFFFAOYSA-N 0 3 401.557 4.084 20 0 HIADHN COc1cc(C(=O)N(CCN(C)C)Cc2cccs2)ccc1OC1CCCC1 ZINC000438468173 863888267 /nfs/dbraw/zinc/88/82/67/863888267.db2.gz RTQZKVMDADAMKT-UHFFFAOYSA-N 0 3 402.560 4.282 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)c1ccc(COc2ccc(F)cc2)o1 ZINC000438548579 863977818 /nfs/dbraw/zinc/97/78/18/863977818.db2.gz SRYVXLNARDHBCC-UHFFFAOYSA-N 0 3 402.491 4.263 20 0 HIADHN C[C@H](N(C)CC(=O)N(Cc1nnc(-c2ccccc2Cl)o1)C1CC1)C1(C)CC1 ZINC000438566480 864001056 /nfs/dbraw/zinc/00/10/56/864001056.db2.gz JNUGOYQJGPMXFL-AWEZNQCLSA-N 0 3 402.926 4.001 20 0 HIADHN Cc1cc(N2CCSCC2)ccc1NC(=O)N(CCN(C)C)Cc1cccs1 ZINC000438580025 864011567 /nfs/dbraw/zinc/01/15/67/864011567.db2.gz COASNDGLJJCKOK-UHFFFAOYSA-N 0 3 418.632 4.205 20 0 HIADHN C[C@H](NC(=O)Nc1ccc(CCN2CCSCC2)cc1)c1ccc(F)cc1F ZINC000438590738 864019610 /nfs/dbraw/zinc/01/96/10/864019610.db2.gz YFGGEVLGXZPWHO-HNNXBMFYSA-N 0 3 405.514 4.439 20 0 HIADHN Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)N(CCN(C)C)Cc1cccs1 ZINC000438595098 864023483 /nfs/dbraw/zinc/02/34/83/864023483.db2.gz FZAWTGQUBSAHFJ-UHFFFAOYSA-N 0 3 416.591 4.038 20 0 HIADHN COCCOc1ccc(NC(=O)N(Cc2ccccc2)C2CCN(C)CC2)c(C)c1 ZINC000438636660 864070548 /nfs/dbraw/zinc/07/05/48/864070548.db2.gz ZBFVTNMEZBAZER-UHFFFAOYSA-N 0 3 411.546 4.149 20 0 HIADHN CCN(C(=O)C(=O)Nc1ccc(F)cc1Cl)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000438645050 864083386 /nfs/dbraw/zinc/08/33/86/864083386.db2.gz BYAAWEFIECJLDS-QAPCUYQASA-N 0 3 417.912 4.102 20 0 HIADHN CCCOc1cccc(NC(=O)C(=O)N(CC)[C@H]2CCN([C@@H](C)c3ccccc3)C2)c1 ZINC000438646950 864086251 /nfs/dbraw/zinc/08/62/51/864086251.db2.gz FWRXBJAYEXUXTF-UGKGYDQZSA-N 0 3 423.557 4.098 20 0 HIADHN COc1ccc(NC(=O)N(CCN(C)C)Cc2cccs2)cc1Br ZINC000438648552 864089579 /nfs/dbraw/zinc/08/95/79/864089579.db2.gz KANKWHKRHZRACJ-UHFFFAOYSA-N 0 3 412.353 4.115 20 0 HIADHN CCN(C(=O)C(=O)Nc1cccc(Cl)c1F)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000438663305 864113454 /nfs/dbraw/zinc/11/34/54/864113454.db2.gz CZCFVFZYADMYEE-DOTOQJQBSA-N 0 3 417.912 4.102 20 0 HIADHN CCN(C(=O)C(=O)Nc1cccc(C(F)F)c1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000438665439 864118942 /nfs/dbraw/zinc/11/89/42/864118942.db2.gz QALKOEPFAQDSID-OXJNMPFZSA-N 0 3 415.484 4.247 20 0 HIADHN CCN(C(=O)C(=O)Nc1cccc(SC)c1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000438667418 864125302 /nfs/dbraw/zinc/12/53/02/864125302.db2.gz XIKVIMSTWNOBBD-XLIONFOSSA-N 0 3 411.571 4.031 20 0 HIADHN COC(=O)c1cc2cc(NC(=O)N(Cc3ccccc3)C3CCN(C)CC3)ccc2o1 ZINC000438690954 864156684 /nfs/dbraw/zinc/15/66/84/864156684.db2.gz KVXIOURJGTYBSI-UHFFFAOYSA-N 0 3 421.497 4.348 20 0 HIADHN CCc1noc(-c2ccc(C)c(NC(=O)N(CCN(C)C)Cc3cccs3)c2)n1 ZINC000438859599 864353016 /nfs/dbraw/zinc/35/30/16/864353016.db2.gz DOQBKRXHOOQJGQ-UHFFFAOYSA-N 0 3 413.547 4.265 20 0 HIADHN COc1ccc(Nc2nc(C(=O)N(CCN(C)C)Cc3cccs3)cs2)cc1 ZINC000439029235 864485383 /nfs/dbraw/zinc/48/53/83/864485383.db2.gz VJHVJTPBLYSPFE-UHFFFAOYSA-N 0 3 416.572 4.161 20 0 HIADHN CC1CCN([C@H](CNC(=O)N2CCC([C@H]3CCCO3)CC2)c2cccs2)CC1 ZINC000439112597 864550432 /nfs/dbraw/zinc/55/04/32/864550432.db2.gz BRGKDMQMJWCXHW-WOJBJXKFSA-N 0 3 405.608 4.122 20 0 HIADHN CN(C)CCN(C(=O)Nc1cc(Cl)ccc1OC[C@H]1CCCO1)C1CCCC1 ZINC000467912931 881780709 /nfs/dbraw/zinc/78/07/09/881780709.db2.gz XHOBGMPATYAMBF-GOSISDBHSA-N 0 3 409.958 4.236 20 0 HIADHN CC[C@@H](C)C(=O)Nc1cccc(CNC(=O)N(CCN(C)C)Cc2cccs2)c1 ZINC000439162338 864592339 /nfs/dbraw/zinc/59/23/39/864592339.db2.gz CNFFSLRHIIATSE-QGZVFWFLSA-N 0 3 416.591 4.006 20 0 HIADHN C[C@H](NC(=O)N(CCN(C)C)Cc1cccs1)c1nc(C2CCCCC2)no1 ZINC000439329087 864765922 /nfs/dbraw/zinc/76/59/22/864765922.db2.gz OYHZFVYPSFDTAT-HNNXBMFYSA-N 0 3 405.568 4.013 20 0 HIADHN Cc1ncc(NC(=O)N[C@H](CN2CCc3ccccc3C2)C(C)(C)C)c(C2CC2)n1 ZINC000439417376 864824645 /nfs/dbraw/zinc/82/46/45/864824645.db2.gz TYIUJASDMGKYIR-OAQYLSRUSA-N 0 3 407.562 4.257 20 0 HIADHN Cc1ccc([C@H]2OCCC[C@@H]2NC(=O)N(CCN(C)C)Cc2cccs2)cc1 ZINC000439501349 864855668 /nfs/dbraw/zinc/85/56/68/864855668.db2.gz DDBMSEUXJIXGDI-LEWJYISDSA-N 0 3 401.576 4.050 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(Cl)cc2)CC1)[C@@H]1C[C@@]12CCc1ccccc12 ZINC000439536507 864869030 /nfs/dbraw/zinc/86/90/30/864869030.db2.gz VQNKXVDRZYTRSV-UKILVPOCSA-N 0 3 424.972 4.204 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)N(C)C[C@H]1COc2ccccc2O1)c1ccc(C(F)(F)F)cc1 ZINC000439543319 864871714 /nfs/dbraw/zinc/87/17/14/864871714.db2.gz DOUNLMLQZRSSEL-VKJFTORMSA-N 0 3 422.447 4.043 20 0 HIADHN CCN(C(=O)[C@H](C)NCc1ccccc1CN(C)Cc1ccco1)c1ccccc1 ZINC000439594763 864917942 /nfs/dbraw/zinc/91/79/42/864917942.db2.gz KQRKIRCELYMDMC-FQEVSTJZSA-N 0 3 405.542 4.443 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1cc(F)c(Br)cc1Cl ZINC000439647283 864973862 /nfs/dbraw/zinc/97/38/62/864973862.db2.gz NJRLTFYKPBFCRB-UHFFFAOYSA-N 0 3 418.694 4.430 20 0 HIADHN CCO[C@@H]1C[C@H](N[C@H](C)C(=O)Nc2ccc(C)cc2Br)C12CCCC2 ZINC000439653961 864981128 /nfs/dbraw/zinc/98/11/28/864981128.db2.gz VZWXLKBYVMDAGD-FHLIZLRMSA-N 0 3 409.368 4.412 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)CCc2ccc(Br)cc2)CC1 ZINC000439729181 865061256 /nfs/dbraw/zinc/06/12/56/865061256.db2.gz FXMNQPFZXVCXHM-INIZCTEOSA-N 0 3 416.363 4.119 20 0 HIADHN Cc1cc(OCC(=O)NC2CCN([C@H](C)c3ccncc3)CC2)cc(C)c1Cl ZINC000439735520 865067617 /nfs/dbraw/zinc/06/76/17/865067617.db2.gz SFYPZJMKPSYLEX-QGZVFWFLSA-N 0 3 401.938 4.072 20 0 HIADHN Cc1cc(O[C@H](C)C(=O)NC2CCN([C@@H](C)c3ccncc3)CC2)ccc1Cl ZINC000439750789 865080334 /nfs/dbraw/zinc/08/03/34/865080334.db2.gz VNVRCCKWNSRKFD-DLBZAZTESA-N 0 3 401.938 4.153 20 0 HIADHN Cc1cc(O[C@H](C)C(=O)NC2CCN([C@H](C)c3ccncc3)CC2)ccc1Cl ZINC000439750790 865080388 /nfs/dbraw/zinc/08/03/88/865080388.db2.gz VNVRCCKWNSRKFD-IAGOWNOFSA-N 0 3 401.938 4.153 20 0 HIADHN Cc1nc(CCC(=O)NC2CCN([C@H](C)c3ccncc3)CC2)oc1-c1ccccc1 ZINC000439751076 865080563 /nfs/dbraw/zinc/08/05/63/865080563.db2.gz WFUJCSAYABENJB-LJQANCHMSA-N 0 3 418.541 4.319 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)Cc2csc(Cc3ccccc3)n2)CC1 ZINC000439764048 865089221 /nfs/dbraw/zinc/08/92/21/865089221.db2.gz BJGADNLHYNUWLJ-SFHVURJKSA-N 0 3 420.582 4.013 20 0 HIADHN COc1cccc(C2(C(=O)NC3CCN([C@@H](C)c4ccncc4)CC3)CCCC2)c1 ZINC000439765079 865091093 /nfs/dbraw/zinc/09/10/93/865091093.db2.gz DUDDIDMYLLXVCJ-IBGZPJMESA-N 0 3 407.558 4.244 20 0 HIADHN C[C@H](CSc1ccc(F)cc1)C(=O)NC1CCN([C@@H](C)c2ccncc2)CC1 ZINC000439776998 865101413 /nfs/dbraw/zinc/10/14/13/865101413.db2.gz ZAZDUCAJEQFMHP-SJORKVTESA-N 0 3 401.551 4.291 20 0 HIADHN CC(=O)Nc1cccc(C(=O)N(CCN2CCCC2)Cc2ccc(Cl)cc2)c1C ZINC000468015563 881854073 /nfs/dbraw/zinc/85/40/73/881854073.db2.gz DBZOQYSRNXJBGL-UHFFFAOYSA-N 0 3 413.949 4.345 20 0 HIADHN CC[C@H](C)NC(=O)[C@@H]1C[C@H](C)N(Cc2nc(-c3ccccc3)no2)[C@H]2CCCC[C@@H]12 ZINC000439990246 865299788 /nfs/dbraw/zinc/29/97/88/865299788.db2.gz UCBHDJPPRJSCID-UGKANONSSA-N 0 3 410.562 4.421 20 0 HIADHN COc1ccc2c(c1)[C@@H](N[C@@H](C)CC(=O)Nc1ccc(Br)cc1)CCO2 ZINC000468048369 881875401 /nfs/dbraw/zinc/87/54/01/881875401.db2.gz KRIGPZYEIUOPET-UGSOOPFHSA-N 0 3 419.319 4.288 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)Nc2ccccc2-c2nncn2C(C)C)c1 ZINC000440283233 865534020 /nfs/dbraw/zinc/53/40/20/865534020.db2.gz OEOVYNDNBDKAMT-UHFFFAOYSA-N 0 3 420.561 4.430 20 0 HIADHN CC(C)C1CCC(N2CCN([C@H](C)C(=O)Nc3ccccc3OC(F)F)CC2)CC1 ZINC000440330955 865609580 /nfs/dbraw/zinc/60/95/80/865609580.db2.gz YMLJKQGWRWFAHP-LMDPOFIKSA-N 0 3 423.548 4.447 20 0 HIADHN C[C@H](C(=O)N1[C@H](C)CCC[C@@H]1C)N1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1 ZINC000440468942 865773393 /nfs/dbraw/zinc/77/33/93/865773393.db2.gz YFOQTHSXOPISOO-OWCLPIDISA-N 0 3 423.960 4.308 20 0 HIADHN O=C(NC[C@]1(O)CCN(Cc2ccccc2)C1)c1ccccc1Sc1ccccc1 ZINC000440521642 865803831 /nfs/dbraw/zinc/80/38/31/865803831.db2.gz XUEIGKGSHYOADB-RUZDIDTESA-N 0 3 418.562 4.205 20 0 HIADHN C[C@H](NC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1)c1ccc(-n2cccn2)cc1 ZINC000440596647 865829922 /nfs/dbraw/zinc/82/99/22/865829922.db2.gz ABXRBANDDNVAMY-GHTZIAJQSA-N 0 3 406.505 4.101 20 0 HIADHN C[C@H](CCC(=O)N1CCC[C@H](CN2CCN(c3ccccn3)CC2)C1)c1ccccc1 ZINC000440776099 865903015 /nfs/dbraw/zinc/90/30/15/865903015.db2.gz BEQCAFGLVIRKHJ-DHIUTWEWSA-N 0 3 420.601 4.026 20 0 HIADHN O=C(NC[C@H]1CCCN1Cc1ccccc1)c1cc(F)c(F)cc1Br ZINC000440879036 865975894 /nfs/dbraw/zinc/97/58/94/865975894.db2.gz OLQFCJSTZHDREX-CQSZACIVSA-N 0 3 409.274 4.122 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)c2cc(-c3ccc(F)cc3)nc3onc(C4CC4)c32)CN1C1CC1 ZINC000440927526 866023011 /nfs/dbraw/zinc/02/30/11/866023011.db2.gz KUNNQGSDCGJQIH-DYVFJYSZSA-N 0 3 420.488 4.261 20 0 HIADHN CC(C)n1ncc2c1nc(-c1cccs1)cc2C(=O)N[C@@H]1C[C@@H](C)N(C2CC2)C1 ZINC000440930722 866026089 /nfs/dbraw/zinc/02/60/89/866026089.db2.gz IDLBJIQVSUONJU-HUUCEWRRSA-N 0 3 409.559 4.096 20 0 HIADHN CC(=O)CCc1ccc(OCc2cccc(C(=O)N[C@@H]3C[C@@H](C)N(C4CC4)C3)c2)cc1 ZINC000440931903 866028537 /nfs/dbraw/zinc/02/85/37/866028537.db2.gz LRZCDDCTGZGZFJ-WZONZLPQSA-N 0 3 420.553 4.142 20 0 HIADHN Cc1ccccc1NC(=O)CCN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1 ZINC000440932387 866030894 /nfs/dbraw/zinc/03/08/94/866030894.db2.gz YZYCBCODJXNALG-QHCPKHFHSA-N 0 3 415.537 4.371 20 0 HIADHN C[C@@H](c1cccs1)N(Cc1ccccc1)C(=O)NCCN1CCN(C)C(C)(C)C1 ZINC000440979738 866062811 /nfs/dbraw/zinc/06/28/11/866062811.db2.gz HWKKTINUDKXXKX-IBGZPJMESA-N 0 3 414.619 4.047 20 0 HIADHN Cc1ccnc(Oc2ccc(NC(=O)N(CCN(C)C)Cc3ccc(F)cc3)cc2)n1 ZINC000441093879 866189664 /nfs/dbraw/zinc/18/96/64/866189664.db2.gz RCWZJNYAIWVQPD-UHFFFAOYSA-N 0 3 423.492 4.312 20 0 HIADHN CO[C@H]1CCCC[C@@H]1NCC(=O)N1N=C(c2ccc(Cl)cc2)C[C@@H]1c1ccco1 ZINC000441273496 866347975 /nfs/dbraw/zinc/34/79/75/866347975.db2.gz CVFUNBLFFGKWOS-SXLOBPIMSA-N 0 3 415.921 4.158 20 0 HIADHN O=C(CN1CCC[C@H]([C@@H]2CCOC2)C1)N[C@H](c1ccccc1)c1cccc(Cl)c1 ZINC000441286014 866360976 /nfs/dbraw/zinc/36/09/76/866360976.db2.gz YZAJEORIZPFGJO-YZUZCNPQSA-N 0 3 412.961 4.294 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)N(C)[C@H]2CCSc3ccc(Br)cc32)CN1C1CC1 ZINC000441303695 866375877 /nfs/dbraw/zinc/37/58/77/866375877.db2.gz QBTJNKUCGFBKOS-IFIJOSMWSA-N 0 3 424.408 4.253 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)N2CCC(c3nc4cc(Cl)ccc4s3)CC2)CN1C1CC1 ZINC000441346528 866417859 /nfs/dbraw/zinc/41/78/59/866417859.db2.gz APPHRGFJUHEAKG-CJNGLKHVSA-N 0 3 418.994 4.464 20 0 HIADHN CN(Cc1ccc(Cl)c(Cl)c1)C(=O)CN1CC[C@H](COCc2ccccc2)C1 ZINC000441373927 866440981 /nfs/dbraw/zinc/44/09/81/866440981.db2.gz CWWNWDZDGSUABG-IBGZPJMESA-N 0 3 421.368 4.491 20 0 HIADHN CN(C(=O)c1cc(F)c(F)cc1Br)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000441447577 866523971 /nfs/dbraw/zinc/52/39/71/866523971.db2.gz DRXOXKUPNLUPDK-CQSZACIVSA-N 0 3 409.274 4.074 20 0 HIADHN COc1ccc(Br)cc1-c1nc(CN2CC[C@@H]([C@@H]3CCOC3)C2)cs1 ZINC000441658710 866774219 /nfs/dbraw/zinc/77/42/19/866774219.db2.gz WOZDIWMIZMMIJF-ZIAGYGMSSA-N 0 3 423.376 4.440 20 0 HIADHN C[C@@H](NC(=O)C(=O)Nc1cccc(-c2cccs2)c1)[C@H](c1ccccc1)N(C)C ZINC000441682680 866803421 /nfs/dbraw/zinc/80/34/21/866803421.db2.gz BIFGACXQXYRRSU-IIBYNOLFSA-N 0 3 407.539 4.161 20 0 HIADHN CC(C)Cn1ccc2cc(NC(=O)C(=O)N[C@@H](C)[C@H](c3ccccc3)N(C)C)ccc21 ZINC000441698054 866810579 /nfs/dbraw/zinc/81/05/79/866810579.db2.gz GMRVQUMSPRBESW-FDDCHVKYSA-N 0 3 420.557 4.043 20 0 HIADHN Cc1cc(Cl)c(NC(=O)C(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)cc1Cl ZINC000441706474 866814350 /nfs/dbraw/zinc/81/43/50/866814350.db2.gz XHXMPDLCHZWISK-FZKQIMNGSA-N 0 3 408.329 4.048 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)Nc1cccc(COC(C)(C)C)c1C ZINC000441842153 866900712 /nfs/dbraw/zinc/90/07/12/866900712.db2.gz BDSMMYBWHRDWLA-UHFFFAOYSA-N 0 3 411.546 4.257 20 0 HIADHN CC[C@@H]1CCc2nc(NC(=O)N(C)C[C@@H]3CCN(C)[C@H]3c3cccnc3)sc2C1 ZINC000441935500 867001496 /nfs/dbraw/zinc/00/14/96/867001496.db2.gz OOAXBQPPDGPVQY-SYNHAJSKSA-N 0 3 413.591 4.210 20 0 HIADHN Cc1cccc(C(C)C)c1NC(=O)C(=O)Nc1cccc(N2CCN(C(C)C)CC2)c1 ZINC000442185670 867208275 /nfs/dbraw/zinc/20/82/75/867208275.db2.gz BLPDQXNMQXYGSZ-UHFFFAOYSA-N 0 3 422.573 4.226 20 0 HIADHN CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)NC1CC(c2cccc(Cl)c2)C1 ZINC000442668934 867603880 /nfs/dbraw/zinc/60/38/80/867603880.db2.gz FWVDIUUWJYEBLB-JBFBMEKISA-N 0 3 412.965 4.315 20 0 HIADHN Cc1nc(-c2ccc(C(=O)NCc3ccccc3CN3CCC(O)CC3)cc2)cs1 ZINC000442689739 867624726 /nfs/dbraw/zinc/62/47/26/867624726.db2.gz PROHOGAHWXLIHT-UHFFFAOYSA-N 0 3 421.566 4.005 20 0 HIADHN COCCC[C@H](NCc1ccc(N2C[C@@H](C)O[C@@H](C)C2)nc1)c1ccc(F)cc1 ZINC000442710203 867640157 /nfs/dbraw/zinc/64/01/57/867640157.db2.gz BXYBEFWUBJOTBI-SVMVAKDDSA-N 0 3 401.526 4.092 20 0 HIADHN CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)c1ncccc1Oc1ccccc1 ZINC000442743059 867659461 /nfs/dbraw/zinc/65/94/61/867659461.db2.gz DSDAPCQWZDIMPJ-CVDCTZTESA-N 0 3 402.498 4.034 20 0 HIADHN CC(C)[C@H]([NH2+][C@H]1CC[C@H](c2ccc(C(F)(F)F)cc2)C1)c1nc(-c2nc[n-]n2)no1 ZINC000442850431 867697133 /nfs/dbraw/zinc/69/71/33/867697133.db2.gz PKMGLHDLEXKHPL-BPUTZDHNSA-N 0 3 420.439 4.497 20 0 HIADHN Cc1nccn1CCCN(C)Cc1cccc(Br)c1OC[C@@H]1CCCO1 ZINC000442892105 867723954 /nfs/dbraw/zinc/72/39/54/867723954.db2.gz UBHNOOSPIQXNOL-SFHVURJKSA-N 0 3 422.367 4.034 20 0 HIADHN CN1CCN(CCNC(=O)c2ccccc2-c2ccc(C(F)(F)F)cc2)CC1(C)C ZINC000442966894 867769039 /nfs/dbraw/zinc/76/90/39/867769039.db2.gz OYZPPFIJAXVMMF-UHFFFAOYSA-N 0 3 419.491 4.128 20 0 HIADHN CC(C)NC(=O)Nc1ccc([C@@H](C)N[C@@H]2CCCN(C3CCCCC3)C2=O)cc1 ZINC000443102705 867819375 /nfs/dbraw/zinc/81/93/75/867819375.db2.gz MRYCQEYOVSGQCD-DYESRHJHSA-N 0 3 400.567 4.191 20 0 HIADHN Cc1cc2c(o1)c(C(=O)NCCCCN1C[C@@H](C)O[C@H](C)C1)ccc2Br ZINC000443287863 867891408 /nfs/dbraw/zinc/89/14/08/867891408.db2.gz KTQKREVVJBTHOP-HUUCEWRRSA-N 0 3 423.351 4.123 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(F)cc2)CC1)[C@@H]1C[C@]12CCCc1ccccc12 ZINC000443341784 867914518 /nfs/dbraw/zinc/91/45/18/867914518.db2.gz JHEVLONZWQFHBO-AHWVRZQESA-N 0 3 422.544 4.079 20 0 HIADHN CC(C)[C@H](Cc1ccccc1)C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000443343339 867914653 /nfs/dbraw/zinc/91/46/53/867914653.db2.gz IZLOVGHMPMZNEO-DEOSSOPVSA-N 0 3 412.549 4.300 20 0 HIADHN CC[C@H](Sc1ccccc1)C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000443343245 867915135 /nfs/dbraw/zinc/91/51/35/867915135.db2.gz IKVRKEQQWQJYCD-QFIPXVFZSA-N 0 3 416.562 4.356 20 0 HIADHN C[C@@H](CCc1cccc(F)c1)C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000443343534 867916583 /nfs/dbraw/zinc/91/65/83/867916583.db2.gz PJXZZBUHKANWRU-SFHVURJKSA-N 0 3 416.512 4.193 20 0 HIADHN C[C@H](CC(=O)NC1CCN(CCOc2ccc(F)cc2)CC1)c1cccc(F)c1 ZINC000443351023 867920679 /nfs/dbraw/zinc/92/06/79/867920679.db2.gz KQCUQPAUIPWXPB-QGZVFWFLSA-N 0 3 402.485 4.118 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)N[C@H]1CCOc2c(F)cccc21 ZINC000443571263 868126543 /nfs/dbraw/zinc/12/65/43/868126543.db2.gz QYAQMVMVMHOUEJ-FQEVSTJZSA-N 0 3 415.534 4.062 20 0 HIADHN COc1cccc(OCCN2CCC([C@H]3C(=O)Nc4cc(Cl)ccc43)CC2)c1 ZINC000443621852 868191169 /nfs/dbraw/zinc/19/11/69/868191169.db2.gz AONRJXAYJDJDHB-OAQYLSRUSA-N 0 3 400.906 4.175 20 0 HIADHN C[C@H](c1ncc(-c2ccc(Cl)cc2)o1)N1CCC(CCN2CCOCC2)CC1 ZINC000443634156 868212458 /nfs/dbraw/zinc/21/24/58/868212458.db2.gz UTQIAUAJSYCECP-QGZVFWFLSA-N 0 3 403.954 4.490 20 0 HIADHN CC1CCN([C@@H](CNC(=O)NCc2cc(=O)[nH]c3ccccc23)c2cccs2)CC1 ZINC000443652598 868249371 /nfs/dbraw/zinc/24/93/71/868249371.db2.gz LNVZNBQLNHGZLR-FQEVSTJZSA-N 0 3 424.570 4.274 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)C2(c3ccc(Cl)c(Cl)c3)CCC2)C[C@H](C)O1 ZINC000443673859 868280790 /nfs/dbraw/zinc/28/07/90/868280790.db2.gz KUWXBJOYDDKUPE-IYBDPMFKSA-N 0 3 413.389 4.421 20 0 HIADHN CC[C@H](C(=O)NCCCCN1C[C@H](C)O[C@@H](C)C1)c1cccc(C(F)(F)F)c1 ZINC000443675865 868283552 /nfs/dbraw/zinc/28/35/52/868283552.db2.gz OSMBJLAVXJDKBE-BXWFABGCSA-N 0 3 400.485 4.205 20 0 HIADHN Cc1ccccc1[C@H]([C@H](C)NC(=O)C(=O)Nc1ccc(C)c(C(F)(F)F)c1)N(C)C ZINC000443839223 868369378 /nfs/dbraw/zinc/36/93/78/868369378.db2.gz KUYXCRJHCPXNGR-KXBFYZLASA-N 0 3 421.463 4.068 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N3CCC[C@H]3CC(=O)c3ccccc3)cc2)CC1 ZINC000443840165 868370919 /nfs/dbraw/zinc/37/09/19/868370919.db2.gz MFOBFUOXQHZOLM-DEOSSOPVSA-N 0 3 419.569 4.095 20 0 HIADHN CSc1ccc(NC(=O)C(=O)N[C@H](C)[C@@H](c2ccccc2C)N(C)C)cc1Cl ZINC000443847000 868376958 /nfs/dbraw/zinc/37/69/58/868376958.db2.gz ZAEZVBRSDKNVNC-KUHUBIRLSA-N 0 3 419.978 4.116 20 0 HIADHN Cc1ccc(C(F)(F)F)cc1NC(=O)C(=O)N[C@@H](C)[C@H](c1ccccc1C)N(C)C ZINC000443848167 868378844 /nfs/dbraw/zinc/37/88/44/868378844.db2.gz ZXQCTRDNSMBSOJ-HNAYVOBHSA-N 0 3 421.463 4.068 20 0 HIADHN CCCOc1c(Br)cc(Br)cc1CN(C)CC1CC(O)C1 ZINC000443851492 868382494 /nfs/dbraw/zinc/38/24/94/868382494.db2.gz IZTJLCRMUVNHHP-UHFFFAOYSA-N 0 3 421.173 4.203 20 0 HIADHN Cc1cc(Cl)c(NC(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@@H]2CO)cc1Cl ZINC000443942506 868478710 /nfs/dbraw/zinc/47/87/10/868478710.db2.gz QLDCJHDDQYVWCR-VQIMIIECSA-N 0 3 422.356 4.306 20 0 HIADHN CS(=O)(=O)Nc1ccc(CNCc2ccc(Oc3cccc(F)c3)cc2)cc1 ZINC000443961258 868495024 /nfs/dbraw/zinc/49/50/24/868495024.db2.gz HMNDJOGXNMCFMD-UHFFFAOYSA-N 0 3 400.475 4.279 20 0 HIADHN COc1ccc(CNC[C@@H](c2ccco2)N2CCCC2)c(OCc2cccnc2)c1 ZINC000443976452 868504735 /nfs/dbraw/zinc/50/47/35/868504735.db2.gz ADKWHMDDJCFDEJ-QFIPXVFZSA-N 0 3 407.514 4.189 20 0 HIADHN FC(F)(F)Oc1cccc(N2CC[C@@H](NCc3cnc(C(F)(F)F)s3)C2)c1 ZINC000443986964 868510956 /nfs/dbraw/zinc/51/09/56/868510956.db2.gz JCTZSIWKZPBQCJ-SNVBAGLBSA-N 0 3 411.371 4.429 20 0 HIADHN CCN1CCCN(C(=O)N[C@@H](CC(F)(F)F)c2ccc(C(F)(F)F)cc2)CC1 ZINC000444015383 868537832 /nfs/dbraw/zinc/53/78/32/868537832.db2.gz TUXUDSMGTMZYKU-HNNXBMFYSA-N 0 3 411.390 4.436 20 0 HIADHN CCN(C(=O)Cc1ccc(NC(=O)N(CCN(C)C)CC(C)C)cc1)c1ccccc1 ZINC000444035076 868570858 /nfs/dbraw/zinc/57/08/58/868570858.db2.gz QMKCTESNKSOSOW-UHFFFAOYSA-N 0 3 424.589 4.334 20 0 HIADHN CN(CCC(=O)Nc1cc(F)cc(F)c1)[C@H]1c2cc(Cl)cc(Cl)c2C[C@@H]1O ZINC000444046980 868583795 /nfs/dbraw/zinc/58/37/95/868583795.db2.gz ZXGRAUKLNQOLJD-HKUYNNGSSA-N 0 3 415.267 4.190 20 0 HIADHN CCOc1ccc([C@@H]2CCCN2C(=O)CN2CC[C@H](COCc3ccccc3)C2)cc1 ZINC000444186760 868656962 /nfs/dbraw/zinc/65/69/62/868656962.db2.gz RJWOFMXLUPQNCL-DHLKQENFSA-N 0 3 422.569 4.288 20 0 HIADHN CN(C)CCN(C(=O)NCc1ccnc(Oc2ccc(F)cc2)c1)C1CCCC1 ZINC000468292976 882216963 /nfs/dbraw/zinc/21/69/63/882216963.db2.gz XEAVFBUGNCURBP-UHFFFAOYSA-N 0 3 400.498 4.029 20 0 HIADHN CN(C)CCN(C(=O)N[C@@H](c1nc2ccccc2n1C)c1ccccc1)C1CCCC1 ZINC000468305663 882229525 /nfs/dbraw/zinc/22/95/25/882229525.db2.gz FRYUGTQHUQZBSR-HSZRJFAPSA-N 0 3 419.573 4.179 20 0 HIADHN COc1ccc(CN(C)C[C@@H](O)CO[C@@H](c2ccccc2)c2ccccc2C)cc1O ZINC000444404385 868814005 /nfs/dbraw/zinc/81/40/05/868814005.db2.gz SOHQAGXMQAMHAY-GJZUVCINSA-N 0 3 421.537 4.308 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)c1cc(Cl)ccc1OC(F)F ZINC000444454023 868833603 /nfs/dbraw/zinc/83/36/03/868833603.db2.gz LRLINJNLRQMUOS-UHFFFAOYSA-N 0 3 410.848 4.150 20 0 HIADHN Cc1c(C(=O)Nc2cccc(CN3CCC(O)CC3)c2)cnn1-c1ccc(Cl)cc1 ZINC000444458001 868835781 /nfs/dbraw/zinc/83/57/81/868835781.db2.gz ZDUJWXUNDHZOKX-UHFFFAOYSA-N 0 3 424.932 4.043 20 0 HIADHN C[C@@H](Oc1ccc(F)cc1Cl)C(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000444549360 868878417 /nfs/dbraw/zinc/87/84/17/868878417.db2.gz LCFFENHPWOJWRU-OAHLLOKOSA-N 0 3 420.912 4.089 20 0 HIADHN COCCN1CCC[C@H]1CNC(=O)N([C@H](C)c1cccc(C(F)(F)F)c1)C1CC1 ZINC000444718660 868973749 /nfs/dbraw/zinc/97/37/49/868973749.db2.gz WHQJEHHYOWZHGL-BEFAXECRSA-N 0 3 413.484 4.051 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)NCc1cccc(-c2cccnc2)c1 ZINC000468319697 882249628 /nfs/dbraw/zinc/24/96/28/882249628.db2.gz KDERIFSWNTWBTH-UHFFFAOYSA-N 0 3 416.569 4.455 20 0 HIADHN COc1ccc([C@H](CNC(=O)CN2CCCC23CCC3)c2c[nH]c3ccccc32)cc1 ZINC000444780988 868999630 /nfs/dbraw/zinc/99/96/30/868999630.db2.gz OCXSIJIWDGGKDE-QFIPXVFZSA-N 0 3 417.553 4.443 20 0 HIADHN Cn1ccnc1[C@@H]1CCCN(Cc2ccnc(-c3ccc(Br)cc3)n2)C1 ZINC000444806286 869018853 /nfs/dbraw/zinc/01/88/53/869018853.db2.gz XCUVVUICTQHENT-MRXNPFEDSA-N 0 3 412.335 4.019 20 0 HIADHN Cc1cc(NC(=O)Nc2c(C)noc2C2CC2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000444877213 869072313 /nfs/dbraw/zinc/07/23/13/869072313.db2.gz OZGFNXYQPQHXAC-IBGZPJMESA-N 0 3 420.517 4.456 20 0 HIADHN CC1CCN([C@H](CNC(=O)N(C)Cc2cc(C(C)(C)C)n[nH]2)c2cccs2)CC1 ZINC000444886950 869077323 /nfs/dbraw/zinc/07/73/23/869077323.db2.gz MAQPFQIJAWZQMG-GOSISDBHSA-N 0 3 417.623 4.383 20 0 HIADHN C[C@H](NC(=O)N[C@H](CN1CCCC1)c1ccccc1)c1cccc(N2CCCC2)c1 ZINC000445503061 869567775 /nfs/dbraw/zinc/56/77/75/869567775.db2.gz JGZBIAALBILMCR-GBXCKJPGSA-N 0 3 406.574 4.484 20 0 HIADHN CC[C@@H](NC(=O)Cc1noc(C2CCN(Cc3ccccc3)CC2)n1)c1ccccc1 ZINC000445720430 869778933 /nfs/dbraw/zinc/77/89/33/869778933.db2.gz DSYMQBZVCURMHB-JOCHJYFZSA-N 0 3 418.541 4.259 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)c1c[nH]nc1-c1ccccc1Cl ZINC000445757079 869803328 /nfs/dbraw/zinc/80/33/28/869803328.db2.gz DWENZIQZQGPJNV-KRWDZBQOSA-N 0 3 400.935 4.359 20 0 HIADHN C[C@H](N[C@H]1CCCC[C@@H]1C(N)=O)c1nc2cc(Cl)ccc2n1Cc1ccccc1 ZINC000445788204 869824960 /nfs/dbraw/zinc/82/49/60/869824960.db2.gz YPISJWOKFNWTSC-SNRMKQJTSA-N 0 3 410.949 4.433 20 0 HIADHN CC(C)n1cnnc1[C@@H]1CCCN(CCOc2cc(F)cc(Br)c2)C1 ZINC000445804736 869832053 /nfs/dbraw/zinc/83/20/53/869832053.db2.gz CIDFYMHJOMIPTQ-CQSZACIVSA-N 0 3 411.319 4.019 20 0 HIADHN COc1ccc(CC(=O)N(c2cccc(SC)c2)C2CCN(C)CC2)c(F)c1 ZINC000445830222 869849796 /nfs/dbraw/zinc/84/97/96/869849796.db2.gz RPSKXXWXPQWKMJ-UHFFFAOYSA-N 0 3 402.535 4.226 20 0 HIADHN Cn1c(CN[C@H]2CCC[C@H]2c2ccc(C(F)(F)F)cc2)nc2ccccc2c1=O ZINC000445982333 869946357 /nfs/dbraw/zinc/94/63/57/869946357.db2.gz MTHZJRPKZOJJTK-WMZOPIPTSA-N 0 3 401.432 4.378 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)c1cc(F)cc(C(F)(F)F)c1 ZINC000445985556 869950093 /nfs/dbraw/zinc/95/00/93/869950093.db2.gz MEHHXZSPDKAEDN-IBGZPJMESA-N 0 3 409.427 4.366 20 0 HIADHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc(-c2cccs2)n(-c2ccccc2)n1 ZINC000446202307 870135641 /nfs/dbraw/zinc/13/56/41/870135641.db2.gz QPCYHAMOKRPGDU-MJGOQNOKSA-N 0 3 406.555 4.300 20 0 HIADHN Cc1c2ccc(C(F)(F)F)nc2sc1C(=O)N(CCN(C)C)Cc1ccco1 ZINC000446428597 870345808 /nfs/dbraw/zinc/34/58/08/870345808.db2.gz WPWTUBHJAAMQOF-UHFFFAOYSA-N 0 3 411.449 4.421 20 0 HIADHN Cc1ccc(C(=O)N(CCN(C)C)Cc2ccco2)cc1NC(=O)Nc1ccccc1 ZINC000446438473 870357397 /nfs/dbraw/zinc/35/73/97/870357397.db2.gz PYPOIUBVRIYQHA-UHFFFAOYSA-N 0 3 420.513 4.436 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Cc1csc(-c2ccc(Cl)s2)n1 ZINC000446443139 870363071 /nfs/dbraw/zinc/36/30/71/870363071.db2.gz BFAOQULQIQFOSR-UHFFFAOYSA-N 0 3 409.964 4.251 20 0 HIADHN CC(C)N(C)c1ccccc1CNC(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000446567028 870478646 /nfs/dbraw/zinc/47/86/46/870478646.db2.gz VNRPMRSJWBXSQC-FQEVSTJZSA-N 0 3 400.592 4.229 20 0 HIADHN CN(C(=O)N[C@H]1CC[C@H](Cc2ccccc2)C1)C1CCN(CCc2ccccn2)CC1 ZINC000446634992 870542396 /nfs/dbraw/zinc/54/23/96/870542396.db2.gz QTJGEYIWELXQIC-VWNXMTODSA-N 0 3 420.601 4.141 20 0 HIADHN COc1ccc2c(c1)[C@@H](N[C@H](C)c1ccc(OCCO)c(OC)c1)CCCS2 ZINC000446742741 870650113 /nfs/dbraw/zinc/65/01/13/870650113.db2.gz BVJPNPQOGDJIMV-BEFAXECRSA-N 0 3 403.544 4.353 20 0 HIADHN CCOC(=O)c1nnc(C2CC[NH+](Cc3cccc(-c4ccccc4C)c3)CC2)[n-]1 ZINC000446835086 870751064 /nfs/dbraw/zinc/75/10/64/870751064.db2.gz ZSTNBPGHNMCLKV-UHFFFAOYSA-N 0 3 404.514 4.336 20 0 HIADHN CCOC(=O)c1n[n-]c(C2CC[NH+](Cc3cccc(-c4ccccc4C)c3)CC2)n1 ZINC000446835086 870751080 /nfs/dbraw/zinc/75/10/80/870751080.db2.gz ZSTNBPGHNMCLKV-UHFFFAOYSA-N 0 3 404.514 4.336 20 0 HIADHN C[C@H]([NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1)c1ccc(Br)cc1F ZINC000446841517 870759734 /nfs/dbraw/zinc/75/97/34/870759734.db2.gz QOFDKUGQRNIUOI-ZDUSSCGKSA-N 0 3 421.310 4.249 20 0 HIADHN CN(C)c1noc([C@@H]2CCCN(Cc3cn(Cc4ccccc4)nc3C(C)(C)C)C2)n1 ZINC000446976038 870873876 /nfs/dbraw/zinc/87/38/76/870873876.db2.gz UYDLIMCESIZFIP-LJQANCHMSA-N 0 3 422.577 4.058 20 0 HIADHN Cc1nc(-c2ccc(C)c(NC(=O)NCC(C)(C)N3CCc4ccccc4C3)c2)n[nH]1 ZINC000447054944 870934225 /nfs/dbraw/zinc/93/42/25/870934225.db2.gz CHCDWDYDAWFUIU-UHFFFAOYSA-N 0 3 418.545 4.047 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1ccc(Cl)cc1OCC(F)(F)F ZINC000447058127 870938140 /nfs/dbraw/zinc/93/81/40/870938140.db2.gz GIDRJINTDHSEGI-UHFFFAOYSA-N 0 3 419.831 4.470 20 0 HIADHN CC(C)Sc1cc(Br)ccc1CN1CCC2(CCN(C)C2=O)CC1 ZINC000447067271 870946633 /nfs/dbraw/zinc/94/66/33/870946633.db2.gz HYEYZVBLVYQQII-UHFFFAOYSA-N 0 3 411.409 4.394 20 0 HIADHN CN1CCC2(CCN(Cc3ccc(OC(F)(F)[C@H](F)C(F)(F)F)cc3)CC2)C1=O ZINC000447084505 870976132 /nfs/dbraw/zinc/97/61/32/870976132.db2.gz FNTCLDBCFSKCKB-OAHLLOKOSA-N 0 3 424.385 4.003 20 0 HIADHN CN1CCCC(C)(C)[C@H]1CNC(=O)CSc1nnc(-c2ccc3ccccc3c2)o1 ZINC000468492004 882472939 /nfs/dbraw/zinc/47/29/39/882472939.db2.gz LATRBAVWPCPSHQ-LJQANCHMSA-N 0 3 424.570 4.219 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1cccn(Cc2ccccc2)c1=O)c1ccsc1 ZINC000447197020 871089984 /nfs/dbraw/zinc/08/99/84/871089984.db2.gz ZMTAKPOCTHPRIX-NRFANRHFSA-N 0 3 424.570 4.163 20 0 HIADHN C[C@@H](NC(=O)N(CCN(C)C)Cc1cccs1)c1cccc(N2CCCC2)c1 ZINC000447228355 871114982 /nfs/dbraw/zinc/11/49/82/871114982.db2.gz VTNBVUMNPBLTKU-GOSISDBHSA-N 0 3 400.592 4.183 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)NCc1ccc(-c2nc3ccccc3s2)o1 ZINC000447234218 871119904 /nfs/dbraw/zinc/11/99/04/871119904.db2.gz JAHPUWPCXRYFNV-UHFFFAOYSA-N 0 3 424.526 4.423 20 0 HIADHN COc1cccc(C2(NCCOc3ccccc3Br)CCOCC2)c1F ZINC000447362651 871268340 /nfs/dbraw/zinc/26/83/40/871268340.db2.gz GVMGQEYULSOEGX-UHFFFAOYSA-N 0 3 424.310 4.271 20 0 HIADHN O=C(CCN1CCC(Oc2ncccc2F)CC1)Nc1ccccc1C(F)(F)F ZINC000447362325 871269605 /nfs/dbraw/zinc/26/96/05/871269605.db2.gz CYNKUNTXKQTROE-UHFFFAOYSA-N 0 3 411.399 4.112 20 0 HIADHN COC(=O)c1coc([C@@H](C)NCC2(c3cc(Cl)ccc3OC)CCOCC2)c1 ZINC000447533155 871398171 /nfs/dbraw/zinc/39/81/71/871398171.db2.gz WUJQOLUSUVTBOE-CQSZACIVSA-N 0 3 407.894 4.127 20 0 HIADHN COC(=O)c1coc([C@@H](C)NC[C@H]2CCN(c3cccc(Br)c3)C2)c1 ZINC000447545263 871410246 /nfs/dbraw/zinc/41/02/46/871410246.db2.gz WZTFLNPSTXZSNE-ZIAGYGMSSA-N 0 3 407.308 4.006 20 0 HIADHN O=C(c1cccc(CN[C@@H](Cc2ccc(F)cc2)c2ccccc2)c1)N1CCOCC1 ZINC000447545312 871411935 /nfs/dbraw/zinc/41/19/35/871411935.db2.gz QZIMBLLEYJCUKG-VWLOTQADSA-N 0 3 418.512 4.372 20 0 HIADHN CC(=O)c1cc(C(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)ccc1C ZINC000447552135 871432361 /nfs/dbraw/zinc/43/23/61/871432361.db2.gz MKYNRWUGZAXPHK-NRFANRHFSA-N 0 3 402.498 4.093 20 0 HIADHN COc1cccc(C[C@@H](NCc2ccc(C)c(S(C)(=O)=O)c2)c2ccccc2)c1 ZINC000447567473 871465585 /nfs/dbraw/zinc/46/55/85/871465585.db2.gz BSKHXFRKMPUCCF-HSZRJFAPSA-N 0 3 409.551 4.481 20 0 HIADHN Fc1cccc([C@@H](NCC2(N3CCOCC3)CC2)c2cccc(Br)c2)c1 ZINC000447599056 871504423 /nfs/dbraw/zinc/50/44/23/871504423.db2.gz IWZCNMMQZLVOCH-FQEVSTJZSA-N 0 3 419.338 4.132 20 0 HIADHN C[C@@H](NC[C@@H](CO)Cc1cc(F)c(F)c(F)c1)c1nc2ccc(Cl)cc2n1C ZINC000447604368 871512563 /nfs/dbraw/zinc/51/25/63/871512563.db2.gz AFNMWXOBVPQDBM-YPMHNXCESA-N 0 3 411.855 4.146 20 0 HIADHN Cc1cc([C@@H](NC[C@H](CO)Cc2cc(F)c(F)c(F)c2)c2cccnc2)ccc1F ZINC000447607368 871517309 /nfs/dbraw/zinc/51/73/09/871517309.db2.gz RSTCNYIEPOHBOX-WAIKUNEKSA-N 0 3 418.434 4.477 20 0 HIADHN COc1cccc(-c2nc(C(=O)Nc3cccc4c3OCC[C@@H]4N(C)C)c(C)[nH]2)c1 ZINC000447728917 871676665 /nfs/dbraw/zinc/67/66/65/871676665.db2.gz MQYPGDIUFCJJRN-IBGZPJMESA-N 0 3 406.486 4.031 20 0 HIADHN COc1cccc(-c2nc(C)c(C(=O)Nc3cccc4c3OCC[C@@H]4N(C)C)[nH]2)c1 ZINC000447728917 871676682 /nfs/dbraw/zinc/67/66/82/871676682.db2.gz MQYPGDIUFCJJRN-IBGZPJMESA-N 0 3 406.486 4.031 20 0 HIADHN C[C@H]1OCC[C@]12CN(CCC(=O)Nc1ccccc1Oc1ccccc1)C[C@@H](C)O2 ZINC000447844210 871767663 /nfs/dbraw/zinc/76/76/63/871767663.db2.gz LAKQSDXEDUBXJL-IECBHUPTSA-N 0 3 410.514 4.076 20 0 HIADHN COc1ccccc1-c1ccc(CN(C(C)C)[C@@H]2CCN(C3CCOCC3)C2=O)cc1 ZINC000447853762 871774553 /nfs/dbraw/zinc/77/45/53/871774553.db2.gz IJMULODOJKJKJH-XMMPIXPASA-N 0 3 422.569 4.353 20 0 HIADHN C[C@@H]1OCC[C@@]1(O)CN(Cc1ccccc1)Cc1ccccc1OCC(F)(F)F ZINC000447929738 871816956 /nfs/dbraw/zinc/81/69/56/871816956.db2.gz UWFFRNREDZFHSN-LAUBAEHRSA-N 0 3 409.448 4.170 20 0 HIADHN CO[C@@H]1CCOc2c(NC(=O)N[C@H](CN(C)Cc3ccccc3)C(C)C)cccc21 ZINC000448052632 871882938 /nfs/dbraw/zinc/88/29/38/871882938.db2.gz DJPJWTDEQLAWQI-FGZHOGPDSA-N 0 3 411.546 4.435 20 0 HIADHN CO[C@@H]1CCOc2c(NC(=O)N3CC[C@H](C)N(Cc4ccccc4)CC3)cccc21 ZINC000448055049 871884413 /nfs/dbraw/zinc/88/44/13/871884413.db2.gz FDFQOANMOGMSDG-PGRDOPGGSA-N 0 3 409.530 4.285 20 0 HIADHN CCN(C(=O)Nc1ccccc1-n1ccc(C)n1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000460127596 872605258 /nfs/dbraw/zinc/60/52/58/872605258.db2.gz MXAGRQXGDVZJIK-NRFANRHFSA-N 0 3 403.530 4.309 20 0 HIADHN CCCN(CCN1CCN(CC)CC1)C(=O)N[C@H](CC(C)(C)C)c1ccc(F)cc1 ZINC000460133160 872619740 /nfs/dbraw/zinc/61/97/40/872619740.db2.gz VOOICHZXWSNXHV-JOCHJYFZSA-N 0 3 420.617 4.362 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N3CCC(=Cc4cccc(F)c4)CC3)cc2)CC1 ZINC000468571883 882634952 /nfs/dbraw/zinc/63/49/52/882634952.db2.gz OMFDFRYEMUCINZ-UHFFFAOYSA-N 0 3 407.533 4.287 20 0 HIADHN Cc1nnc(-c2ccc(C(=O)N[C@@H](CN3CCc4ccccc4C3)C(C)(C)C)cc2)o1 ZINC000468575154 882642541 /nfs/dbraw/zinc/64/25/41/882642541.db2.gz LPFOSGDSBFJZPB-QFIPXVFZSA-N 0 3 418.541 4.248 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)N1CCCC[C@@H]1c1nnc(C2CCC2)o1 ZINC000460165488 872714306 /nfs/dbraw/zinc/71/43/06/872714306.db2.gz CUAVQJODECDYQE-OAQYLSRUSA-N 0 3 423.561 4.022 20 0 HIADHN CCn1c(COc2ccccc2-c2ccccc2)nnc1N(C)[C@@H]1CCN(C2CC2)C1 ZINC000460189978 872757487 /nfs/dbraw/zinc/75/74/87/872757487.db2.gz PSNIBXWNFNSHBT-OAQYLSRUSA-N 0 3 417.557 4.217 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)[C@@H]2CCSc3ccccc32)cc1)[C@H]1CCCN(C)C1 ZINC000460214080 872800048 /nfs/dbraw/zinc/80/00/48/872800048.db2.gz GGIGTSZOQAHZDC-PZJWPPBQSA-N 0 3 423.582 4.071 20 0 HIADHN C[C@H](CNC(=O)N1CCCC[C@@H]1c1nnc(C2CCC2)o1)N(C)Cc1ccccc1 ZINC000460277885 872865979 /nfs/dbraw/zinc/86/59/79/872865979.db2.gz VOBCJXBAKDYVPD-YLJYHZDGSA-N 0 3 411.550 4.094 20 0 HIADHN COc1ccc(-n2c3ccccc3nc2NC(=O)c2ccc(CN(C)C)cc2)cc1 ZINC000460389337 873034545 /nfs/dbraw/zinc/03/45/45/873034545.db2.gz BZQNTPWAQJYWRA-UHFFFAOYSA-N 0 3 400.482 4.348 20 0 HIADHN CCCN(CCN1CCN(CC)CC1)C(=O)N[C@H](c1ccccc1C)C(C)(C)C ZINC000460487745 873174036 /nfs/dbraw/zinc/17/40/36/873174036.db2.gz ILVGCKRGJCINGG-JOCHJYFZSA-N 0 3 402.627 4.141 20 0 HIADHN CN1CCC(N(Cc2ccccc2Br)C(=O)NCC2(C)CCC2)CC1 ZINC000460490284 873177135 /nfs/dbraw/zinc/17/71/35/873177135.db2.gz MDTYZCJEVZERMA-UHFFFAOYSA-N 0 3 408.384 4.245 20 0 HIADHN Cc1ccc(CC[C@@H](C)NC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)o1 ZINC000460508340 873195258 /nfs/dbraw/zinc/19/52/58/873195258.db2.gz FDNPWHHLYPCHRB-IERDGZPVSA-N 0 3 408.464 4.480 20 0 HIADHN COc1cc(CNCc2ccc(C)nc2-n2cc(Cl)cn2)ccc1OC(C)C ZINC000468600787 882697305 /nfs/dbraw/zinc/69/73/05/882697305.db2.gz WZOYZYYTXAJYGR-UHFFFAOYSA-N 0 3 400.910 4.315 20 0 HIADHN C[C@H]1CCC[C@@H]1CNC(=O)N(Cc1ccccc1Br)C1CCN(C)CC1 ZINC000460772355 873621909 /nfs/dbraw/zinc/62/19/09/873621909.db2.gz XWCRFNFBUQAXMT-DLBZAZTESA-N 0 3 422.411 4.491 20 0 HIADHN COc1ccc([C@H](CNC(=O)c2c[nH]cc2-c2ccc(F)cc2)N2CCCC2)cc1 ZINC000460819071 873700999 /nfs/dbraw/zinc/70/09/99/873700999.db2.gz XDAUXDHNZGZSRI-QHCPKHFHSA-N 0 3 407.489 4.396 20 0 HIADHN CCSc1cc(Cl)ccc1C(=O)N1CCC(CN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000460982015 873873095 /nfs/dbraw/zinc/87/30/95/873873095.db2.gz QATSDACDHPYWCR-HOTGVXAUSA-N 0 3 411.011 4.413 20 0 HIADHN O=S1(=O)CCCN1c1ccc(CNC2c3ccccc3CCc3ccccc32)cc1 ZINC000461094602 874009647 /nfs/dbraw/zinc/00/96/47/874009647.db2.gz ZSNZVRWHAMBLOE-UHFFFAOYSA-N 0 3 418.562 4.204 20 0 HIADHN C[C@H](NC(=O)N1CCCC[C@@H]1c1nnc(C2CCC2)o1)[C@@H](c1ccccc1)N(C)C ZINC000461208432 874210603 /nfs/dbraw/zinc/21/06/03/874210603.db2.gz JRYQVIUTHVNIIR-DBVUQKKJSA-N 0 3 411.550 4.265 20 0 HIADHN CCOc1ccc(C(=O)CCC(=O)N2C[C@H]3CN(Cc4ccccc4)CC[C@@H]3C2)cc1 ZINC000461426917 874461268 /nfs/dbraw/zinc/46/12/68/874461268.db2.gz FKWBECBBEODLHG-DHIUTWEWSA-N 0 3 420.553 4.029 20 0 HIADHN Cc1cc(C(=O)CCC(=O)N2C[C@@H]3CCN(Cc4ccccc4)C[C@@H]3C2)c(C)s1 ZINC000461444500 874500239 /nfs/dbraw/zinc/50/02/39/874500239.db2.gz LJLBOHRCHKPMMD-LEWJYISDSA-N 0 3 410.583 4.308 20 0 HIADHN COc1cc(Br)ccc1[C@@H](C)NC(=O)Nc1cccc(CN(C)C)c1 ZINC000468789525 882861136 /nfs/dbraw/zinc/86/11/36/882861136.db2.gz BLERBCUIIZLSEE-CYBMUJFWSA-N 0 3 406.324 4.402 20 0 HIADHN COC[C@@H](NC(=O)N(Cc1ccccc1)C1CCN(C)CC1)c1cccc(Cl)c1 ZINC000461717177 874866289 /nfs/dbraw/zinc/86/62/89/874866289.db2.gz IBNBUQYBULLZAV-JOCHJYFZSA-N 0 3 415.965 4.334 20 0 HIADHN CN1CC[C@H](NC(=O)N[C@H]2CCCc3cn(C4CCCC4)nc32)[C@@H]1c1ccccc1 ZINC000461944102 875076606 /nfs/dbraw/zinc/07/66/06/875076606.db2.gz ADLDOAMQDMWJNV-FUDKSRODSA-N 0 3 407.562 4.120 20 0 HIADHN CCOC(=O)[C@@](C)(CN[C@H](C)C(=O)Nc1cc(Cl)ccc1C)c1ccccc1 ZINC000468865468 882897595 /nfs/dbraw/zinc/89/75/95/882897595.db2.gz FFAWDPMZICWPJF-ZHRRBRCNSA-N 0 3 402.922 4.086 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)N(C)[C@H](C)c3cc4ccccc4o3)CC2)c1 ZINC000462023033 875139680 /nfs/dbraw/zinc/13/96/80/875139680.db2.gz IRVZTCPWFQQBTD-HXUWFJFHSA-N 0 3 405.542 4.473 20 0 HIADHN C[C@@H]1CCCN(c2cc(C(=O)N3CCCN(CCCc4ccccc4)CC3)ccn2)C1 ZINC000462023997 875141070 /nfs/dbraw/zinc/14/10/70/875141070.db2.gz AMJIMSSTHFTCQG-JOCHJYFZSA-N 0 3 420.601 4.099 20 0 HIADHN C[C@H](NC(=O)CCN1CCN(c2ccccc2)CC1)c1ccc(C(F)(F)F)cc1 ZINC000462038819 875151479 /nfs/dbraw/zinc/15/14/79/875151479.db2.gz LXHXURHIMFCQKO-KRWDZBQOSA-N 0 3 405.464 4.095 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)Nc3ccc(-c4nccs4)cc3)CC2)c1 ZINC000462045136 875158791 /nfs/dbraw/zinc/15/87/91/875158791.db2.gz NCQHWZCGJUIFLO-UHFFFAOYSA-N 0 3 406.555 4.269 20 0 HIADHN CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)N[C@H]1CCc2sc(Cl)cc21 ZINC000462050991 875163678 /nfs/dbraw/zinc/16/36/78/875163678.db2.gz COIDOHSUCIHILS-QOKNQOGYSA-N 0 3 404.967 4.118 20 0 HIADHN O=C(c1ccc(N2CCCC2)nc1)N1CCN(Cc2ccccc2)C2(CCCCC2)C1 ZINC000462074746 875185069 /nfs/dbraw/zinc/18/50/69/875185069.db2.gz PPMXRBUDVQGIIV-UHFFFAOYSA-N 0 3 418.585 4.343 20 0 HIADHN Cc1ccccc1-c1cc(NC(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)n(C)n1 ZINC000462087944 875196470 /nfs/dbraw/zinc/19/64/70/875196470.db2.gz ZSQODXRHHGTDKU-HXUWFJFHSA-N 0 3 403.530 4.134 20 0 HIADHN O=C(CCN1CCN(c2ccccc2)CC1)Nc1cccc(Oc2ccncc2)c1 ZINC000462092678 875202975 /nfs/dbraw/zinc/20/29/75/875202975.db2.gz MMYZKBXPXMZKLJ-UHFFFAOYSA-N 0 3 402.498 4.025 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)Cc1csc(Cc2ccc(F)cc2)n1 ZINC000462165146 875261703 /nfs/dbraw/zinc/26/17/03/875261703.db2.gz ACYCFYDSMQLLQH-VGSWGCGISA-N 0 3 423.557 4.052 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)CSCc1coc(-c2ccccc2)n1 ZINC000462173466 875270003 /nfs/dbraw/zinc/27/00/03/875270003.db2.gz CSBRVRNMYBPSCF-GCJKJVERSA-N 0 3 421.566 4.212 20 0 HIADHN Cc1nc(CCC(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)oc1-c1ccccc1 ZINC000462180886 875280178 /nfs/dbraw/zinc/28/01/78/875280178.db2.gz OIVNXEALLPVGQP-GCJKJVERSA-N 0 3 403.526 4.219 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)Cc1coc(-c2ccc(Cl)cc2)n1 ZINC000462183244 875282522 /nfs/dbraw/zinc/28/25/22/875282522.db2.gz BPEZPOUBVQBLTQ-IERDGZPVSA-N 0 3 409.917 4.174 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Cc1coc(-c2ccc(Cl)cc2)n1 ZINC000462183243 875282921 /nfs/dbraw/zinc/28/29/21/875282921.db2.gz BPEZPOUBVQBLTQ-HRAATJIYSA-N 0 3 409.917 4.174 20 0 HIADHN CC(C)n1ncc2c1nc(C1CC1)cc2C(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C ZINC000462186868 875288669 /nfs/dbraw/zinc/28/86/69/875288669.db2.gz GOYXCVBOQHOKPK-SBUREZEXSA-N 0 3 417.557 4.140 20 0 HIADHN CCN(C(=O)c1ccc(COCCOC)cc1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000462242595 875358774 /nfs/dbraw/zinc/35/87/74/875358774.db2.gz BPUCERUFKGJDOB-HYBUGGRVSA-N 0 3 410.558 4.147 20 0 HIADHN O=C1NC2(CCCC2)C(=O)N1CCN[C@@H](c1ccccc1)c1ccc2ccccc2c1 ZINC000462251097 875371900 /nfs/dbraw/zinc/37/19/00/875371900.db2.gz ZFDIXJXIPQHFOJ-QHCPKHFHSA-N 0 3 413.521 4.383 20 0 HIADHN C[C@@H](CC(=O)N(CCN(C)C)Cc1ccccn1)c1ccc(F)c(Br)c1 ZINC000462254269 875377336 /nfs/dbraw/zinc/37/73/36/875377336.db2.gz PGMICWSTXJSTGU-HNNXBMFYSA-N 0 3 422.342 4.067 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N[C@@H]3CCO[C@H](c4ccccc4)C3)c(C)c2)CC1 ZINC000462257147 875379918 /nfs/dbraw/zinc/37/99/18/875379918.db2.gz NDLWCEAFYQQQKJ-QPPBQGQZSA-N 0 3 422.573 4.179 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)c(C)c1 ZINC000462258457 875381895 /nfs/dbraw/zinc/38/18/95/875381895.db2.gz LMSATGLMCQKPIW-MSYCTHLASA-N 0 3 422.573 4.165 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCc3ccc(C(F)F)cc3)c(C)c2)CC1 ZINC000462258835 875381938 /nfs/dbraw/zinc/38/19/38/875381938.db2.gz QQZQQFCZVVOSNZ-UHFFFAOYSA-N 0 3 402.489 4.396 20 0 HIADHN COc1ccc(NC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)c(Br)c1 ZINC000462263142 875388388 /nfs/dbraw/zinc/38/83/88/875388388.db2.gz WGWQUOZBCDEQAC-IFXJQAMLSA-N 0 3 418.335 4.100 20 0 HIADHN Cc1cc(N2CCSCC2)ccc1NC(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C ZINC000462271191 875399790 /nfs/dbraw/zinc/39/97/90/875399790.db2.gz WNGSMYGNEXYASQ-XXBNENTESA-N 0 3 424.614 4.190 20 0 HIADHN C[C@H](CC(=O)N[C@H]1CN(C)C[C@H]1c1ccccc1)c1ccc(F)c(Br)c1 ZINC000462282878 875408802 /nfs/dbraw/zinc/40/88/02/875408802.db2.gz XVDZBPHARYODOS-LIVBEALHSA-N 0 3 419.338 4.296 20 0 HIADHN O=C(NC[C@@H]1CCCCN1Cc1ccccc1)N[C@@H]1CCO[C@H](c2ccccc2)C1 ZINC000462317598 875437702 /nfs/dbraw/zinc/43/77/02/875437702.db2.gz ZDNPZDXPGZDKRF-SGNDLWITSA-N 0 3 407.558 4.261 20 0 HIADHN COc1ccc([C@H](Cc2ccccc2)NC(=O)N(CCN(C)C)Cc2ccco2)cc1 ZINC000462346133 875460185 /nfs/dbraw/zinc/46/01/85/875460185.db2.gz CKUSFLFOLZXFKF-DEOSSOPVSA-N 0 3 421.541 4.345 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@@H]1CCO[C@@H](c2ccccc2)C1)c1ccsc1 ZINC000462532312 875651060 /nfs/dbraw/zinc/65/10/60/875651060.db2.gz ZLVNPXUUYRTGAT-NJDAHSKKSA-N 0 3 401.576 4.351 20 0 HIADHN CC(C)[C@@H](Oc1ccc(Cl)cc1)C(=O)N1CC[C@H](CN(C)Cc2cccnc2)C1 ZINC000462536062 875655016 /nfs/dbraw/zinc/65/50/16/875655016.db2.gz DTMSUSQKKRPXCS-DENIHFKCSA-N 0 3 415.965 4.119 20 0 HIADHN C[C@@H](N[C@@H]1CCCN(Cc2ccc(F)cc2F)C1=O)c1ccc(OC(F)F)cc1 ZINC000468906324 882959904 /nfs/dbraw/zinc/95/99/04/882959904.db2.gz HVYNVKOXQKLXPQ-BFUOFWGJSA-N 0 3 410.411 4.408 20 0 HIADHN CCc1noc(-c2ccc(C)c(NC(=O)N[C@H]3CN(Cc4ccccc4)C[C@@H]3C)c2)n1 ZINC000462686081 875778508 /nfs/dbraw/zinc/77/85/08/875778508.db2.gz SYKZPHDKLSULGI-UWJYYQICSA-N 0 3 419.529 4.249 20 0 HIADHN COc1cc(NC(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)cc(OC)c1C(C)C ZINC000462705277 875791243 /nfs/dbraw/zinc/79/12/43/875791243.db2.gz PBSQWMZXGWJYBP-XLIONFOSSA-N 0 3 411.546 4.469 20 0 HIADHN OC[C@@H](CNCc1ccccc1Br)Cc1ccccc1OC(F)(F)F ZINC000462736182 875808777 /nfs/dbraw/zinc/80/87/77/875808777.db2.gz DIWVDUXZYXRRNR-CYBMUJFWSA-N 0 3 418.253 4.289 20 0 HIADHN CC(C)Oc1ccc(CN[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2=O)cc1 ZINC000462740737 875811158 /nfs/dbraw/zinc/81/11/58/875811158.db2.gz RJIBPRACNAOABU-HXUWFJFHSA-N 0 3 404.457 4.360 20 0 HIADHN CO[C@H](CNCc1cc(Br)c2c(c1)OCCO2)c1cccc(Cl)c1 ZINC000462756472 875820891 /nfs/dbraw/zinc/82/08/91/875820891.db2.gz NKPJULKZTNFJQJ-QGZVFWFLSA-N 0 3 412.711 4.351 20 0 HIADHN COc1ccc(F)cc1CNC[C@H](c1ccc(C(F)(F)F)cc1)N1CCOCC1 ZINC000462780373 875835982 /nfs/dbraw/zinc/83/59/82/875835982.db2.gz VUTUDRPQWRTEPF-LJQANCHMSA-N 0 3 412.427 4.016 20 0 HIADHN COc1ccc(C[C@H](NCc2cn(C)nc2C(F)F)c2ccc(OC)cc2)cc1 ZINC000462785693 875838394 /nfs/dbraw/zinc/83/83/94/875838394.db2.gz RDXLSXFBWSAUJV-FQEVSTJZSA-N 0 3 401.457 4.449 20 0 HIADHN FC(F)(F)c1cc(Cl)c2nnc(CN[C@@H]3CCC[C@@H]([C@@H]4CCOC4)C3)n2c1 ZINC000462791869 875843228 /nfs/dbraw/zinc/84/32/28/875843228.db2.gz SSTCJWXJCGQBLP-YRGRVCCFSA-N 0 3 402.848 4.086 20 0 HIADHN CC(C)(C)OC(=O)c1ccc(CN2CCC(NC(=O)c3ccc(F)cc3)CC2)cc1 ZINC000462799789 875848658 /nfs/dbraw/zinc/84/86/58/875848658.db2.gz XSNOVXNWVXBVCE-UHFFFAOYSA-N 0 3 412.505 4.175 20 0 HIADHN CO[C@](C)(CN[C@H](c1cccc(S(C)(=O)=O)c1)c1ccc(C)cc1C)C1CC1 ZINC000462802920 875851594 /nfs/dbraw/zinc/85/15/94/875851594.db2.gz IQIQPEDBCQFYPN-DHIUTWEWSA-N 0 3 401.572 4.201 20 0 HIADHN Cc1noc(C)c1COc1ccccc1C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C ZINC000462812403 875856243 /nfs/dbraw/zinc/85/62/43/875856243.db2.gz NLTRRXCTDXCXPN-GAJHUEQPSA-N 0 3 419.525 4.121 20 0 HIADHN C[C@@H](NCCCN1C(=O)c2ccccc2C1=O)c1csc(-c2ccccc2F)n1 ZINC000462816202 875857391 /nfs/dbraw/zinc/85/73/91/875857391.db2.gz QOOITMONSKJTCE-CQSZACIVSA-N 0 3 409.486 4.286 20 0 HIADHN O=S1(=O)CCCN1c1cccc(CN[C@H](c2cccc(C(F)(F)F)c2)C2CC2)c1 ZINC000462846958 875881639 /nfs/dbraw/zinc/88/16/39/875881639.db2.gz CWTACTJGGFHCBT-FQEVSTJZSA-N 0 3 424.488 4.486 20 0 HIADHN CC(C)COc1ccc([C@@H](C)NCc2cccc(N3CCCS3(=O)=O)c2)cc1 ZINC000462853524 875887072 /nfs/dbraw/zinc/88/70/72/875887072.db2.gz OGNHBBYGCCRVDZ-GOSISDBHSA-N 0 3 402.560 4.112 20 0 HIADHN Cc1cc(Cl)c2ccccc2c1NC(=O)N1CC[C@@H](N2CCN(C)CC2)[C@H](C)C1 ZINC000462853158 875887173 /nfs/dbraw/zinc/88/71/73/875887173.db2.gz ITPZHMCSGZNDNG-DYESRHJHSA-N 0 3 414.981 4.291 20 0 HIADHN Cc1nc([C@H](C)NCCCN2CCN(c3cccc(C(F)(F)F)c3)CC2)cs1 ZINC000462884347 875912022 /nfs/dbraw/zinc/91/20/22/875912022.db2.gz PIOOTVFSCBHQCO-HNNXBMFYSA-N 0 3 412.525 4.333 20 0 HIADHN COC(=O)c1cc(CN[C@@H](c2cc(F)cc(Br)c2)C2CC2)n(C)c1C ZINC000462917028 875944449 /nfs/dbraw/zinc/94/44/49/875944449.db2.gz NDDXTPSVPQFFKM-GOSISDBHSA-N 0 3 409.299 4.263 20 0 HIADHN O=c1c(Cl)c(N[C@@H]2CCN(CC3CCCC3)C2)cnn1-c1ccc(Cl)cc1 ZINC000462947433 875967643 /nfs/dbraw/zinc/96/76/43/875967643.db2.gz UICUZVYGEXSEOH-MRXNPFEDSA-N 0 3 407.345 4.216 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)[C@@H](c3ccccc3)C(C)C)CC2)c1 ZINC000463095682 876129231 /nfs/dbraw/zinc/12/92/31/876129231.db2.gz FLCLQQQUTIPRSN-RUZDIDTESA-N 0 3 407.602 4.453 20 0 HIADHN FC(F)(F)c1ccnc(Cc2noc(C3CCN(Cc4ccccc4)CC3)n2)c1 ZINC000463119777 876163642 /nfs/dbraw/zinc/16/36/42/876163642.db2.gz LVEZZUXJJKJPRG-UHFFFAOYSA-N 0 3 402.420 4.454 20 0 HIADHN CC(C)[C@@H](C(=O)NCCCCN1CCN(Cc2ccccc2)CC1)c1ccccc1 ZINC000463133873 876182037 /nfs/dbraw/zinc/18/20/37/876182037.db2.gz WKRLQWOSAQYBSQ-RUZDIDTESA-N 0 3 407.602 4.140 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)c2cccc(-c3noc(C4CC4)n3)c2)C1 ZINC000463155166 876208162 /nfs/dbraw/zinc/20/81/62/876208162.db2.gz HFJHGHAGXBFGLE-IIBYNOLFSA-N 0 3 402.498 4.179 20 0 HIADHN C[C@H](c1ccsc1)N1CCN(C(=O)NC[C@H](c2cccs2)N2CCCC2)CC1 ZINC000463158131 876211244 /nfs/dbraw/zinc/21/12/44/876211244.db2.gz CJIZBDAKHXLHTM-IEBWSBKVSA-N 0 3 418.632 4.035 20 0 HIADHN C[C@@H]1CC[C@H](O)[C@H]([C@@H]2CCCCN2Cc2csc(-c3ccc(C(N)=O)cc3)n2)C1 ZINC000463196060 876255660 /nfs/dbraw/zinc/25/56/60/876255660.db2.gz ARUIQJMLZSAONC-DVMWJLJYSA-N 0 3 413.587 4.061 20 0 HIADHN CCN1CC[C@H](NCc2cncc(C(F)(F)F)c2)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000463197089 876255845 /nfs/dbraw/zinc/25/58/45/876255845.db2.gz OEZJXSDNZBFERN-FUHWJXTLSA-N 0 3 403.370 4.443 20 0 HIADHN Cc1cc(N2CCCC2)ccc1NC(=O)CN1CCCC[C@@H]1[C@@H]1C[C@H](C)CC[C@@H]1O ZINC000463217884 876276307 /nfs/dbraw/zinc/27/63/07/876276307.db2.gz GUZPJQIZVRFSGC-LJAMWKNPSA-N 0 3 413.606 4.185 20 0 HIADHN CCOC(=O)c1ccc2c(c1)nc(CN1CCCC[C@@H]1[C@@H]1CCCC[C@H]1O)n2CC ZINC000463218321 876277256 /nfs/dbraw/zinc/27/72/56/876277256.db2.gz JUZMBDMVSMMMDO-CZTZKLFOSA-N 0 3 413.562 4.139 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)N[C@H]2CCO[C@H](c3ccccc3)C2)CC1 ZINC000463256825 876313459 /nfs/dbraw/zinc/31/34/59/876313459.db2.gz GDXAAAZEHSGDDR-UPVQGACJSA-N 0 3 407.558 4.213 20 0 HIADHN C[C@H]1CCCc2ccccc2[C@@H]1NC(=O)N(C)C1CCN(CCc2ccccn2)CC1 ZINC000463268419 876326452 /nfs/dbraw/zinc/32/64/52/876326452.db2.gz RSXNKFXKIZVURR-NBGIEHNGSA-N 0 3 420.601 4.444 20 0 HIADHN COC(=O)CCCN1CCC(Nc2cccc(NC(=O)C3CCCCC3)c2)CC1 ZINC000463281183 876338288 /nfs/dbraw/zinc/33/82/88/876338288.db2.gz ONODPERZEYLAEX-UHFFFAOYSA-N 0 3 401.551 4.035 20 0 HIADHN CC(C)N(Cc1ccccc1)C(=O)[C@@H](C)N1CCC[C@](CO)(Cc2ccccc2)C1 ZINC000463433542 876489989 /nfs/dbraw/zinc/48/99/89/876489989.db2.gz DSPDNGPFENDFGZ-GJZUVCINSA-N 0 3 408.586 4.129 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)c1cccc(-c2cscn2)c1 ZINC000463524985 876594229 /nfs/dbraw/zinc/59/42/29/876594229.db2.gz HCSMFIITVBKTAO-UHFFFAOYSA-N 0 3 401.482 4.292 20 0 HIADHN CCN1CCN(CCC(=O)N(Cc2ccccc2C(F)(F)F)C2CCCC2)CC1 ZINC000468983154 883050105 /nfs/dbraw/zinc/05/01/05/883050105.db2.gz OWJUIETVAVDYKB-UHFFFAOYSA-N 0 3 411.512 4.004 20 0 HIADHN CN1CCC(Oc2ccc(NC(=O)CCc3cccc(C(F)(F)F)c3)cn2)CC1 ZINC000463579789 876677887 /nfs/dbraw/zinc/67/78/87/876677887.db2.gz WESOSSHQUAUTFW-UHFFFAOYSA-N 0 3 407.436 4.145 20 0 HIADHN COc1cccc([C@@H](C)N2CCN(C(=O)c3oc4ccccc4c3CN(C)C)CC2)c1 ZINC000468991828 883058801 /nfs/dbraw/zinc/05/88/01/883058801.db2.gz OYWAGYFKHJJFPC-GOSISDBHSA-N 0 3 421.541 4.022 20 0 HIADHN COc1cc(CNCc2ccc(OCc3ccccc3F)cc2)cc2c1OCCO2 ZINC000463728556 876849413 /nfs/dbraw/zinc/84/94/13/876849413.db2.gz MBJVVZLFFHVHFT-UHFFFAOYSA-N 0 3 409.457 4.474 20 0 HIADHN COc1ccc(Cn2nc(C)c(CNCc3ccccc3-n3ccnc3)c2C)cc1 ZINC000463745781 876868888 /nfs/dbraw/zinc/86/88/88/876868888.db2.gz LYNCAOCXUGDJBY-UHFFFAOYSA-N 0 3 401.514 4.032 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)[C@@H]1C[C@H]1c1cc(F)c(F)c(F)c1 ZINC000463769031 876890276 /nfs/dbraw/zinc/89/02/76/876890276.db2.gz MSGDGBSSLQJSRB-AYOQOUSVSA-N 0 3 402.460 4.330 20 0 HIADHN COc1ccc(-c2ncc(C(=O)N(Cc3ccco3)C3CCN(C)CC3)s2)cc1 ZINC000463822444 876936911 /nfs/dbraw/zinc/93/69/11/876936911.db2.gz BZQKGIWMRBXULR-UHFFFAOYSA-N 0 3 411.527 4.148 20 0 HIADHN CCN1CCCC[C@@H]1CNC(=O)c1ccc(-c2noc(-c3ccc(F)cc3)n2)cc1 ZINC000463859507 876980562 /nfs/dbraw/zinc/98/05/62/876980562.db2.gz WHZXXBBFPPHCQH-HXUWFJFHSA-N 0 3 408.477 4.147 20 0 HIADHN Cc1cc(N2CC[C@H](N[C@@H](CCCc3ccccc3)c3ccccc3)C2=O)n(C)n1 ZINC000463898735 877020712 /nfs/dbraw/zinc/02/07/12/877020712.db2.gz UEWLXYNCBZWMRG-GOTSBHOMSA-N 0 3 402.542 4.188 20 0 HIADHN COc1cccc([C@H](Cc2cc(C)cc(C)c2)N[C@@H](C)C(=O)NCC(F)(F)F)c1 ZINC000463918164 877039499 /nfs/dbraw/zinc/03/94/99/877039499.db2.gz BHVBHBTXRRQSTI-JXFKEZNVSA-N 0 3 408.464 4.252 20 0 HIADHN COc1ccc([C@@H](CNC(=O)N[C@H](c2nc(C)cs2)C2CC2)N2CCCC2)cc1 ZINC000463956014 877078392 /nfs/dbraw/zinc/07/83/92/877078392.db2.gz SSWKZWSJKCNEBN-UXHICEINSA-N 0 3 414.575 4.048 20 0 HIADHN COc1ccc([C@@H](CNC(=O)NC[C@H](C)Cc2cccs2)N2CCCC2)cc1 ZINC000463967583 877092922 /nfs/dbraw/zinc/09/29/22/877092922.db2.gz XFSGNSXXVOYPRR-DYESRHJHSA-N 0 3 401.576 4.072 20 0 HIADHN CCC(CC)c1cc(CNC(=O)NC[C@@H](c2ccc(OC)cc2)N2CCCC2)on1 ZINC000463973625 877101135 /nfs/dbraw/zinc/10/11/35/877101135.db2.gz MVGACLLYKZUQGO-QFIPXVFZSA-N 0 3 414.550 4.223 20 0 HIADHN O=C(NCc1cccc(-c2cccnc2)c1)NC[C@H]1CCCN1Cc1ccccc1 ZINC000464146512 877314225 /nfs/dbraw/zinc/31/42/25/877314225.db2.gz PFELHLVLAPEGPQ-XMMPIXPASA-N 0 3 400.526 4.212 20 0 HIADHN CCOc1cc2c(cc1[C@@H]1C[C@@H]1C(=O)N(CC(C)C)C1CCN(C)CC1)O[C@@H](C)C2 ZINC000503239906 912218724 /nfs/dbraw/zinc/21/87/24/912218724.db2.gz LIYYZDIOSIWMDG-XJABCFGWSA-N 0 3 414.590 4.091 20 0 HIADHN Cc1nn(C)c(Sc2ccccc2)c1C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C ZINC000464168153 877334964 /nfs/dbraw/zinc/33/49/64/877334964.db2.gz NIBBEIRVCGZVDG-DYESRHJHSA-N 0 3 420.582 4.130 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1cnn(C(C)(C)C)c1C ZINC000464190952 877362110 /nfs/dbraw/zinc/36/21/10/877362110.db2.gz XGRUWOBGLBWOKL-HXUWFJFHSA-N 0 3 420.561 4.151 20 0 HIADHN O=C(Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)c1ccoc1C(F)(F)F ZINC000464203703 877374008 /nfs/dbraw/zinc/37/40/08/877374008.db2.gz ILKJYGJANOJHRJ-HNNXBMFYSA-N 0 3 404.392 4.194 20 0 HIADHN CCN(C[C@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)c1c(F)cccc1Cl ZINC000464211440 877382228 /nfs/dbraw/zinc/38/22/28/877382228.db2.gz IADAURDFSGXOJL-KRWDZBQOSA-N 0 3 410.942 4.012 20 0 HIADHN Cc1c([C@@H](C)NCCCS(=O)(=O)c2cccc(C)c2)cnn1-c1ccc(F)cc1 ZINC000464479549 877698661 /nfs/dbraw/zinc/69/86/61/877698661.db2.gz ISRBWAYFGWUAMX-QGZVFWFLSA-N 0 3 415.534 4.143 20 0 HIADHN CCN1CCC[C@@H](CN(C)C(=O)N[C@@H]2CCCCC23CCCC3)[C@@H]1c1cnn(C)c1 ZINC000464561970 877780815 /nfs/dbraw/zinc/78/08/15/877780815.db2.gz SLSSHGDSDLBGSR-KSEOMHKRSA-N 0 3 415.626 4.338 20 0 HIADHN CC(C)N(C(=O)CN(CCCOc1ccccc1)C1CCOCC1)c1ccccc1 ZINC000464570157 877791427 /nfs/dbraw/zinc/79/14/27/877791427.db2.gz ASENFACYMHVZEX-UHFFFAOYSA-N 0 3 410.558 4.378 20 0 HIADHN CC(C)CN(C(=O)c1cc(F)c(Br)cc1Cl)C1CCN(C)CC1 ZINC000464580692 877804002 /nfs/dbraw/zinc/80/40/02/877804002.db2.gz KZUQRLSKNHXYPR-UHFFFAOYSA-N 0 3 405.739 4.434 20 0 HIADHN COCCCN(C(=O)c1cc(-c2ccc(F)cc2)c(C)s1)C1CCN(C)CC1 ZINC000464724592 877956526 /nfs/dbraw/zinc/95/65/26/877956526.db2.gz SPSUKIFXLVSJJJ-UHFFFAOYSA-N 0 3 404.551 4.436 20 0 HIADHN CCOc1ccccc1-c1cccc(C(=O)N(CCCOC)C2CCN(C)CC2)c1 ZINC000464725782 877958782 /nfs/dbraw/zinc/95/87/82/877958782.db2.gz ZLXSFPVVOSTLEH-UHFFFAOYSA-N 0 3 410.558 4.325 20 0 HIADHN O=C(CN1CC[C@@H](CSc2ccccc2)C1)N1CCC(OCc2ccccc2)CC1 ZINC000464759300 877999303 /nfs/dbraw/zinc/99/93/03/877999303.db2.gz XDSDGBJHRWQWPA-JOCHJYFZSA-N 0 3 424.610 4.308 20 0 HIADHN C[C@@H]1CCN(CC(=O)Nc2ccccc2C(F)(F)F)CCN1Cc1ccccc1 ZINC000464842329 878112917 /nfs/dbraw/zinc/11/29/17/878112917.db2.gz GHDRICFECHGIKE-QGZVFWFLSA-N 0 3 405.464 4.240 20 0 HIADHN CCc1ccc([C@@H]2C[C@@H](C)CCN2C[C@@H](O)COc2ccc(NC(C)=O)cc2)o1 ZINC000464856251 878136533 /nfs/dbraw/zinc/13/65/33/878136533.db2.gz UPWTUFFPBJIHDD-NBCNXNJRSA-N 0 3 400.519 4.013 20 0 HIADHN C[C@H]1CCN(C(=O)c2cccc(-c3noc(C4CC4)n3)c2)CCN1Cc1ccccc1 ZINC000464889028 878186876 /nfs/dbraw/zinc/18/68/76/878186876.db2.gz CZUBUNNNONKXHI-SFHVURJKSA-N 0 3 416.525 4.351 20 0 HIADHN C[C@@H]1CCN(C(=O)c2ccc(CNC(=O)C(C)(C)C)cc2)CCN1Cc1ccccc1 ZINC000464887995 878187101 /nfs/dbraw/zinc/18/71/01/878187101.db2.gz SFWHXFFMBJSMPF-HXUWFJFHSA-N 0 3 421.585 4.086 20 0 HIADHN C[C@@H]1CCN(C(=O)c2cccc(-c3noc(C4CC4)n3)c2)CCN1Cc1ccccc1 ZINC000464889023 878187651 /nfs/dbraw/zinc/18/76/51/878187651.db2.gz CZUBUNNNONKXHI-GOSISDBHSA-N 0 3 416.525 4.351 20 0 HIADHN Cc1nc2cc(F)cc(C(=O)N3CC[C@H](C)N(Cc4ccccc4)CC3)c2nc1C ZINC000464898763 878206695 /nfs/dbraw/zinc/20/66/95/878206695.db2.gz YSASOMAIJUEXNR-INIZCTEOSA-N 0 3 406.505 4.122 20 0 HIADHN CCc1c(C(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)cnn1Cc1ccccc1 ZINC000464899545 878207813 /nfs/dbraw/zinc/20/78/13/878207813.db2.gz AMOMQHUGCYSAIK-NRFANRHFSA-N 0 3 416.569 4.230 20 0 HIADHN C[C@@H]1CCN(C(=O)c2cnn(-c3cccc(Cl)c3)c2)CCN1Cc1ccccc1 ZINC000464899491 878208276 /nfs/dbraw/zinc/20/82/76/878208276.db2.gz JJEGLRSRVJZTAC-GOSISDBHSA-N 0 3 408.933 4.262 20 0 HIADHN C[C@@H]1CCN(C(=O)c2cc(-c3ccc(Cl)cc3)n[nH]2)CCN1Cc1ccccc1 ZINC000464900691 878209148 /nfs/dbraw/zinc/20/91/48/878209148.db2.gz MNRPVDRCJCDSBA-QGZVFWFLSA-N 0 3 408.933 4.467 20 0 HIADHN C[C@H]1CCN(C(=O)CCOc2ccc(F)cc2Cl)CCN1Cc1ccccc1 ZINC000464900754 878209577 /nfs/dbraw/zinc/20/95/77/878209577.db2.gz NBNSMUYQUXGSOF-KRWDZBQOSA-N 0 3 404.913 4.371 20 0 HIADHN C[C@H]1CCN(C(=O)c2cc(-c3ccc(Cl)cc3)n[nH]2)CCN1Cc1ccccc1 ZINC000464900690 878210485 /nfs/dbraw/zinc/21/04/85/878210485.db2.gz MNRPVDRCJCDSBA-KRWDZBQOSA-N 0 3 408.933 4.467 20 0 HIADHN COc1cccc(C(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)c1OC(F)F ZINC000464909866 878227394 /nfs/dbraw/zinc/22/73/94/878227394.db2.gz NCAMOIMGXPQKEL-INIZCTEOSA-N 0 3 404.457 4.033 20 0 HIADHN COc1ccc([C@@H](CNC(=O)CCc2c[nH]c3cc(C)ccc23)N2CCCC2)cc1 ZINC000465053405 878416153 /nfs/dbraw/zinc/41/61/53/878416153.db2.gz LOAFDONLOZSPNV-XMMPIXPASA-N 0 3 405.542 4.371 20 0 HIADHN C[C@@H](SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)N1CC[C@H]2CC[C@@H](C1)N2C ZINC000465223846 878639970 /nfs/dbraw/zinc/63/99/70/878639970.db2.gz HFQXWNNPKUWNLA-OLMNPRSZSA-N 0 3 419.978 4.312 20 0 HIADHN Cc1nn(-c2ccccc2Cl)c2sc(C(=O)N3CC[C@H]4CC[C@@H](C3)N4C)cc12 ZINC000465229827 878647301 /nfs/dbraw/zinc/64/73/01/878647301.db2.gz CCBRUGQASRWCOV-CABCVRRESA-N 0 3 414.962 4.358 20 0 HIADHN CCc1cnc(CCNC(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)s1 ZINC000465421960 878850844 /nfs/dbraw/zinc/85/08/44/878850844.db2.gz MJLVBMUMXUSKNX-QGZVFWFLSA-N 0 3 406.621 4.082 20 0 HIADHN CCc1ccc([C@@H](COC)NC(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)o1 ZINC000465426684 878855969 /nfs/dbraw/zinc/85/59/69/878855969.db2.gz DGWKNARDBRJTQE-RTBURBONSA-N 0 3 419.591 4.363 20 0 HIADHN CCc1ccc([C@H](CNC(=O)NCc2coc(-c3ccc(C)cc3)n2)N(C)C)cc1 ZINC000465427299 878857804 /nfs/dbraw/zinc/85/78/04/878857804.db2.gz DXIXNLQAKUYZQZ-QFIPXVFZSA-N 0 3 406.530 4.315 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)NCc2ccc(-c3cccnc3)cc2)N(C)C)cc1 ZINC000465438498 878871572 /nfs/dbraw/zinc/87/15/72/878871572.db2.gz XSPIITBYBKGXGN-XMMPIXPASA-N 0 3 402.542 4.413 20 0 HIADHN COc1ccc(C2CCN(C(=O)NC[C@@H](c3ccccc3)N3CCCC3)CC2)cc1 ZINC000465445652 878876132 /nfs/dbraw/zinc/87/61/32/878876132.db2.gz XVYMJLIAKJPPER-DEOSSOPVSA-N 0 3 407.558 4.421 20 0 HIADHN C[C@H]1CCN(C(=O)NCc2coc(-c3cccs3)n2)CCN1Cc1ccccc1 ZINC000465483171 878923117 /nfs/dbraw/zinc/92/31/17/878923117.db2.gz LOKXPKYPLRBDAZ-KRWDZBQOSA-N 0 3 410.543 4.209 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@H](C)c1cccc(-n2cccn2)c1)c1ccsc1 ZINC000465520234 878969109 /nfs/dbraw/zinc/96/91/09/878969109.db2.gz ABFNKTOFCHPYCO-DYESRHJHSA-N 0 3 411.575 4.377 20 0 HIADHN COc1ccc(C2CCN(C(=O)N[C@H](CN3CCCC3)c3ccccc3)CC2)cc1 ZINC000465531494 878987788 /nfs/dbraw/zinc/98/77/88/878987788.db2.gz RSYHCPUTOSLYJT-XMMPIXPASA-N 0 3 407.558 4.421 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NC[C@@H](OC)c1cccc(Cl)c1)c1ccsc1 ZINC000465532507 878990097 /nfs/dbraw/zinc/99/00/97/878990097.db2.gz FWGZSARFNVIDBF-RBUKOAKNSA-N 0 3 409.983 4.471 20 0 HIADHN Cc1cccc([C@@H]2CCCN2C(=O)NCc2ccc(CN3CCN(C)CC3)cc2)c1C ZINC000465558376 879028668 /nfs/dbraw/zinc/02/86/68/879028668.db2.gz PBMAZNDTYRHEJZ-VWLOTQADSA-N 0 3 420.601 4.098 20 0 HIADHN C[C@@H](NC(=O)N[C@H](CN1CCCC1)c1ccccc1)c1nc(-c2cccc(F)c2)no1 ZINC000465611307 879107655 /nfs/dbraw/zinc/10/76/55/879107655.db2.gz XBFVKTSILVMFHM-OXQOHEQNSA-N 0 3 423.492 4.073 20 0 HIADHN CN(C)CCN(C[C@@H]1CCCO1)C(=O)N[C@@H](c1ccccc1)c1cccc(Cl)c1 ZINC000465623426 879131898 /nfs/dbraw/zinc/13/18/98/879131898.db2.gz CGOZCKKDPTYELO-VXKWHMMOSA-N 0 3 415.965 4.182 20 0 HIADHN C[C@@H]1CCN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)[C@H](c2ccco2)C1 ZINC000465670246 879207218 /nfs/dbraw/zinc/20/72/18/879207218.db2.gz WWTPVOBVURPINW-GGAORHGYSA-N 0 3 424.589 4.365 20 0 HIADHN O=C(NCc1ccc(-c2cccnc2)cc1)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000465701904 879264137 /nfs/dbraw/zinc/26/41/37/879264137.db2.gz YPFJNPAIWCKIKW-XMMPIXPASA-N 0 3 400.526 4.212 20 0 HIADHN CCO[C@H](C)c1nc(CN(C)C(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)cs1 ZINC000465760005 879356316 /nfs/dbraw/zinc/35/63/16/879356316.db2.gz QJEBPJOSVUMEDB-ZHALLVOQSA-N 0 3 416.591 4.218 20 0 HIADHN CO[C@H](CNC(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1)c1cccc(Cl)c1 ZINC000465761298 879357045 /nfs/dbraw/zinc/35/70/45/879357045.db2.gz QNBMBHIDEQJQQG-ORYQWCPZSA-N 0 3 401.938 4.162 20 0 HIADHN C[C@@H]1CCN(C(=O)NCc2cccc(Br)c2)CCN1Cc1ccccc1 ZINC000465768373 879367407 /nfs/dbraw/zinc/36/74/07/879367407.db2.gz BWQMGTOLVLZOMB-QGZVFWFLSA-N 0 3 416.363 4.255 20 0 HIADHN C[C@@H](NC(=O)N(CCN(C)C)C[C@@H]1CCCO1)c1ccccc1Oc1ccccc1 ZINC000465807146 879423407 /nfs/dbraw/zinc/42/34/07/879423407.db2.gz QXMDPLSCDWSUET-CTNGQTDRSA-N 0 3 411.546 4.292 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N[C@H](C)c2ccc(-n3cccn3)cc2)N2CCCC2)cc1 ZINC000465825104 879455490 /nfs/dbraw/zinc/45/54/90/879455490.db2.gz BHWOYTQOYBGCFG-HYBUGGRVSA-N 0 3 417.557 4.378 20 0 HIADHN CCCc1nc(C)c(C(=O)N(Cc2ccc(O)cc2)C[C@H]2CCCN2CC)s1 ZINC000503454807 912480379 /nfs/dbraw/zinc/48/03/79/912480379.db2.gz SEZAPAPOJJQELI-GOSISDBHSA-N 0 3 401.576 4.236 20 0 HIADHN C[C@H]1CCN(C(=O)NCc2ccccc2OCC2CC2)CCN1Cc1ccccc1 ZINC000465987002 879661622 /nfs/dbraw/zinc/66/16/22/879661622.db2.gz XCMVPMGEKJUFLM-FQEVSTJZSA-N 0 3 407.558 4.281 20 0 HIADHN Cc1cccc2c(CCNC(=O)N(CCN(C)C)Cc3ccc(F)cc3F)c[nH]c21 ZINC000466005374 879685110 /nfs/dbraw/zinc/68/51/10/879685110.db2.gz LXUKTPSRDUZDEV-UHFFFAOYSA-N 0 3 414.500 4.070 20 0 HIADHN CCCN(C(=O)NCCCCn1ccnc1C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000466011845 879691454 /nfs/dbraw/zinc/69/14/54/879691454.db2.gz QXZYIAXUPQDONG-HSZRJFAPSA-N 0 3 411.594 4.058 20 0 HIADHN COc1cccc([C@@H](Cc2cc(C)cc(C)c2)NC(=O)N2CCN(C)CC[C@@H]2C)c1 ZINC000466036674 879725436 /nfs/dbraw/zinc/72/54/36/879725436.db2.gz OVLVCRURDXOFCX-GBXCKJPGSA-N 0 3 409.574 4.331 20 0 HIADHN COc1cccc([C@H](Cc2cc(C)cc(C)c2)NC(=O)N2CC[C@@H](N3CC=CC3)C2)c1 ZINC000466049617 879738166 /nfs/dbraw/zinc/73/81/66/879738166.db2.gz LOMCYKXJARRPJR-NOZRDPDXSA-N 0 3 419.569 4.252 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccc(O)cc1)C(=O)c1cc(Br)cs1 ZINC000503461580 912493136 /nfs/dbraw/zinc/49/31/36/912493136.db2.gz LTZMWIVENKWPJT-INIZCTEOSA-N 0 3 423.376 4.343 20 0 HIADHN C[C@@H]1CCN(C(=O)NCc2coc(-c3ccccc3)n2)CCN1Cc1ccccc1 ZINC000466073533 879777922 /nfs/dbraw/zinc/77/79/22/879777922.db2.gz SEMAFSWXNOWZOS-LJQANCHMSA-N 0 3 404.514 4.148 20 0 HIADHN Cc1csc([C@H](NC(=O)N(CCCc2ccccc2)CCN(C)C)C2CC2)n1 ZINC000466095909 879815172 /nfs/dbraw/zinc/81/51/72/879815172.db2.gz UPJOIBXSNZBCMT-HXUWFJFHSA-N 0 3 400.592 4.109 20 0 HIADHN Cc1nc(C)c(CNC(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)s1 ZINC000466116991 879830670 /nfs/dbraw/zinc/83/06/70/879830670.db2.gz OXORUMQSECSUHL-UHFFFAOYSA-N 0 3 414.497 4.052 20 0 HIADHN C[C@H](NC(=O)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1)[C@@H]1CCOC1 ZINC000466118469 879831695 /nfs/dbraw/zinc/83/16/95/879831695.db2.gz SODPCDAWBUZMTA-DOTOQJQBSA-N 0 3 414.377 4.026 20 0 HIADHN COc1cccc(F)c1[C@H](C)NC(=O)N(CCN(C)C)Cc1cccc(Cl)c1 ZINC000466131540 879843224 /nfs/dbraw/zinc/84/32/24/879843224.db2.gz LZOHIUHSAQXQHK-HNNXBMFYSA-N 0 3 407.917 4.322 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NC[C@@H](C)Oc3cccc(C)c3)c(C)c2)CC1 ZINC000466220034 879916259 /nfs/dbraw/zinc/91/62/59/879916259.db2.gz DEQVFTIJRPNRMO-HXUWFJFHSA-N 0 3 410.562 4.034 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)N[C@@H]2COc3c2ccc(Cl)c3Cl)CC1 ZINC000466222394 879920243 /nfs/dbraw/zinc/92/02/43/879920243.db2.gz WWEYWNXWLRZPJT-QGZVFWFLSA-N 0 3 424.328 4.326 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)N[C@H](c2ccccc2)c2ccncc2)CN1Cc1ccccc1 ZINC000466262623 879992571 /nfs/dbraw/zinc/99/25/71/879992571.db2.gz YKLBVHAZFQCSFI-CTUHWIOQSA-N 0 3 400.526 4.133 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccc(O)cc1)C(=O)c1coc(-c2ccccc2)n1 ZINC000503478944 912520019 /nfs/dbraw/zinc/52/00/19/912520019.db2.gz KAUBDZHQOZXUCH-FQEVSTJZSA-N 0 3 405.498 4.174 20 0 HIADHN CCC(CC)(CNC(=O)N1CCC(CN2C[C@H](C)O[C@@H](C)C2)CC1)c1ccccc1 ZINC000466350595 880107939 /nfs/dbraw/zinc/10/79/39/880107939.db2.gz UPMVHZHRCAGLRR-SFTDATJTSA-N 0 3 415.622 4.275 20 0 HIADHN C[C@@H](NCc1cncc(Br)c1)[C@@H](OC1CCOCC1)c1ccccc1 ZINC000466362206 880120541 /nfs/dbraw/zinc/12/05/41/880120541.db2.gz JQXFUKYKLOKQDH-FOIQADDNSA-N 0 3 405.336 4.259 20 0 HIADHN CCN1CCC[C@@H](CN(C)C(=O)NCC[C@H](C)c2ccccc2)[C@@H]1c1cnn(C)c1 ZINC000466383211 880142971 /nfs/dbraw/zinc/14/29/71/880142971.db2.gz KWWWDBOKVDQGAS-IEIRFRATSA-N 0 3 411.594 4.028 20 0 HIADHN COc1ccc([C@@H](CNC(=O)Nc2cc(Cl)ccc2OC)N2CCCC2)cc1 ZINC000503492198 912538582 /nfs/dbraw/zinc/53/85/82/912538582.db2.gz VCFRUQCACVWWEU-LJQANCHMSA-N 0 3 403.910 4.316 20 0 HIADHN C[C@@H](CNC(=O)N(CCN(C)C)Cc1ccc(F)c(F)c1)c1ccc(F)cc1F ZINC000466420489 880193529 /nfs/dbraw/zinc/19/35/29/880193529.db2.gz BMJWKQNLUNLNKC-AWEZNQCLSA-N 0 3 411.443 4.120 20 0 HIADHN C[C@@H](C(=O)Nc1ccc2c(c1)OC1(CCCCC1)O2)N(C)CCC1CCOCC1 ZINC000466464618 880246500 /nfs/dbraw/zinc/24/65/00/880246500.db2.gz LSKRHONFWLVHLO-KRWDZBQOSA-N 0 3 402.535 4.194 20 0 HIADHN CCc1ccc([C@@H](NC(=O)CN(C)CCC2CCOCC2)c2cccs2)cc1 ZINC000466471605 880253554 /nfs/dbraw/zinc/25/35/54/880253554.db2.gz UIGWGPCQYHBCLD-HSZRJFAPSA-N 0 3 400.588 4.265 20 0 HIADHN O=C1C[C@@H](NCc2c[nH]nc2-c2cccs2)CN1Cc1ccccc1C(F)(F)F ZINC000466473760 880255487 /nfs/dbraw/zinc/25/54/87/880255487.db2.gz LCGUSUGHUGYUPJ-OAHLLOKOSA-N 0 3 420.460 4.048 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)N[C@@H](c2ccccc2)c2cccnc2)N(C)C)cc1 ZINC000503500412 912548822 /nfs/dbraw/zinc/54/88/22/912548822.db2.gz YCGRLMABWGWNBH-RPWUZVMVSA-N 0 3 402.542 4.336 20 0 HIADHN C[C@H](C(=O)Nc1ccc(NC(=O)c2cccs2)cc1)N(C)CCC1CCOCC1 ZINC000466489009 880267615 /nfs/dbraw/zinc/26/76/15/880267615.db2.gz PZKQHUJLQZBBMG-MRXNPFEDSA-N 0 3 415.559 4.076 20 0 HIADHN CN(CCC1CCOCC1)CC(=O)NC[C@H](c1c[nH]c2ccccc21)c1ccccc1 ZINC000466495735 880273099 /nfs/dbraw/zinc/27/30/99/880273099.db2.gz NHCVYFJSLSAXPG-QHCPKHFHSA-N 0 3 419.569 4.165 20 0 HIADHN CCC(=O)Nc1ccc(Cl)c(NC(=O)N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)c1 ZINC000466518399 880293107 /nfs/dbraw/zinc/29/31/07/880293107.db2.gz YTHCHNINZNMZLG-CRAIPNDOSA-N 0 3 414.937 4.473 20 0 HIADHN COc1ccc(NC(=O)N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)c(C(F)(F)F)c1 ZINC000466521208 880296123 /nfs/dbraw/zinc/29/61/23/880296123.db2.gz GRNDUOLMQBEVOF-ZBFHGGJFSA-N 0 3 407.436 4.499 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)N2CCC(c3nc4ccccc4[nH]3)CC2)CN1Cc1ccccc1 ZINC000466521272 880296383 /nfs/dbraw/zinc/29/63/83/880296383.db2.gz WIQAYNZWGQYFAQ-GHTZIAJQSA-N 0 3 417.557 4.115 20 0 HIADHN COc1cc(CN(C)C(=O)N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)ccc1SC ZINC000466524537 880301890 /nfs/dbraw/zinc/30/18/90/880301890.db2.gz DRHQPWXJJMTZHU-YLJYHZDGSA-N 0 3 413.587 4.222 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)Nc2ccccc2N2C[C@@H](C)O[C@H](C)C2)CN1Cc1ccccc1 ZINC000466530050 880305436 /nfs/dbraw/zinc/30/54/36/880305436.db2.gz UMONKAQYRHXBOK-GPQLQYNLSA-N 0 3 422.573 4.085 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)NCc2ccc(-c3ccncc3)cc2)CN1Cc1ccccc1 ZINC000466534514 880309248 /nfs/dbraw/zinc/30/92/48/880309248.db2.gz QKKPTRMAYWFRPE-YADARESESA-N 0 3 400.526 4.211 20 0 HIADHN COc1ccc([C@H](CNC(=O)Nc2ccccc2N2CCCC2)N2CCCC2)cc1 ZINC000503505947 912554364 /nfs/dbraw/zinc/55/43/64/912554364.db2.gz WUPAMQAYGJQNBO-QHCPKHFHSA-N 0 3 408.546 4.254 20 0 HIADHN CCc1c(NC(=O)N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)cnn1-c1ccccc1 ZINC000466653740 880430873 /nfs/dbraw/zinc/43/08/73/880430873.db2.gz DHRDWUJHQICLAP-QUCCMNQESA-N 0 3 403.530 4.219 20 0 HIADHN CCc1c(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2)cnn1-c1ccccc1 ZINC000466663395 880444876 /nfs/dbraw/zinc/44/48/76/880444876.db2.gz FEWMYTZTRGQCOJ-UHFFFAOYSA-N 0 3 409.509 4.170 20 0 HIADHN CCc1c(NC(=O)NC[C@@H](c2cccs2)N2CCCC2)cnn1-c1ccccc1 ZINC000466678427 880465266 /nfs/dbraw/zinc/46/52/66/880465266.db2.gz SLRPMVMLWPGFOR-FQEVSTJZSA-N 0 3 409.559 4.455 20 0 HIADHN C[C@H](NC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1)c1cccc(-n2cccn2)c1 ZINC000466684594 880474261 /nfs/dbraw/zinc/47/42/61/880474261.db2.gz UARZLEPSKYUNRI-RTWAWAEBSA-N 0 3 417.557 4.239 20 0 HIADHN CC[C@H]1C[C@H](C(=O)Nc2cccc(N3CCN(CCc4ccccc4)CC3)c2)CCO1 ZINC000503528918 912582568 /nfs/dbraw/zinc/58/25/68/912582568.db2.gz WVRMYIAAMLVOLX-RDGATRHJSA-N 0 3 421.585 4.195 20 0 HIADHN CCN(C(=O)c1ccc(C(=O)NC(C)C)cc1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000503530933 912586579 /nfs/dbraw/zinc/58/65/79/912586579.db2.gz OUKGJCXTUDXKSD-XXBNENTESA-N 0 3 407.558 4.122 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)Nc3cc(F)ccc3Br)cc2)CC1 ZINC000466901586 880668082 /nfs/dbraw/zinc/66/80/82/880668082.db2.gz RELRZVASQXHBCJ-UHFFFAOYSA-N 0 3 420.326 4.371 20 0 HIADHN CC(=O)Nc1nc(CN(CCN(C)Cc2ccccc2)Cc2ccccc2)cs1 ZINC000466941187 880712039 /nfs/dbraw/zinc/71/20/39/880712039.db2.gz ULLLVQAUKQMQLF-UHFFFAOYSA-N 0 3 408.571 4.236 20 0 HIADHN C[C@H](NC(=O)N(CCCc1ccccc1)CCN(C)C)c1ccc(-n2cccn2)cc1 ZINC000466972053 880772651 /nfs/dbraw/zinc/77/26/51/880772651.db2.gz BKYAZPMNJKKVHA-NRFANRHFSA-N 0 3 419.573 4.139 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)c2cccc(-c3noc(C4CC4)n3)c2)CN1Cc1ccccc1 ZINC000467021321 880823099 /nfs/dbraw/zinc/82/30/99/880823099.db2.gz GDTXNHVYHWXBMC-HRAATJIYSA-N 0 3 402.498 4.007 20 0 HIADHN Cc1ccc(C(=O)N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)cc1NC(=O)c1ccco1 ZINC000467024038 880824818 /nfs/dbraw/zinc/82/48/18/880824818.db2.gz SFIIMUOVWCRUOI-NQIIRXRSSA-N 0 3 417.509 4.233 20 0 HIADHN CCSCC[C@@H](C)NC(=O)N(CCN(C)C)Cc1ccc(Br)cc1 ZINC000467035657 880833916 /nfs/dbraw/zinc/83/39/16/880833916.db2.gz UXZPESDNQSTYSC-OAHLLOKOSA-N 0 3 416.429 4.054 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)c2ccc(-c3nc(C4CC4)no3)cc2)CN1Cc1ccccc1 ZINC000467039015 880836325 /nfs/dbraw/zinc/83/63/25/880836325.db2.gz TXYOSVRFDDINKT-IIBYNOLFSA-N 0 3 402.498 4.007 20 0 HIADHN C[C@H]1C[C@H](NC(=O)c2ccc(-c3nc(C4CC4)no3)cc2)CN1Cc1ccccc1 ZINC000467039016 880836441 /nfs/dbraw/zinc/83/64/41/880836441.db2.gz TXYOSVRFDDINKT-KKSFZXQISA-N 0 3 402.498 4.007 20 0 HIADHN CN(C)[C@H](CNC(=O)NCc1cc2cc(Br)ccc2[nH]1)c1ccccc1 ZINC000467041423 880837886 /nfs/dbraw/zinc/83/78/86/880837886.db2.gz UCVAFSJSQLAPAK-LJQANCHMSA-N 0 3 415.335 4.033 20 0 HIADHN COCc1ccc([C@H]2CCCN2CCC(=O)Nc2cc(OC)c(Cl)cc2OC)o1 ZINC000467041330 880838256 /nfs/dbraw/zinc/83/82/56/880838256.db2.gz SPPCOAQQUIVOAX-QGZVFWFLSA-N 0 3 422.909 4.262 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)[C@@H]2C[C@H]2c2ccccc2OC(F)F)CN1Cc1ccccc1 ZINC000467044484 880839777 /nfs/dbraw/zinc/83/97/77/880839777.db2.gz JFVFIRAXHDOUCR-DJABAAGCSA-N 0 3 400.469 4.171 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)Cc2coc(-c3ccc(Cl)cc3)n2)CN1Cc1ccccc1 ZINC000467049971 880842347 /nfs/dbraw/zinc/84/23/47/880842347.db2.gz YLYGNOIHMCCNRY-UZLBHIALSA-N 0 3 409.917 4.317 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)c2cccc(OCc3cscn3)c2)CN1Cc1ccccc1 ZINC000467052668 880842890 /nfs/dbraw/zinc/84/28/90/880842890.db2.gz AUXCEEPFELUATP-FXAWDEMLSA-N 0 3 407.539 4.115 20 0 HIADHN CN(C(=O)NCc1csc(-c2ccc(C(F)(F)F)cc2)n1)[C@H]1CCN(C2CC2)C1 ZINC000467060729 880847105 /nfs/dbraw/zinc/84/71/05/880847105.db2.gz ZIBWSXPDKFXJIY-KRWDZBQOSA-N 0 3 424.492 4.207 20 0 HIADHN COC[C@H]1CCCCN([C@H](C)C(=O)Nc2ccc(NC(=O)c3cccs3)cc2)C1 ZINC000467120093 880876512 /nfs/dbraw/zinc/87/65/12/880876512.db2.gz DNBNBDBFGCVCTR-SJORKVTESA-N 0 3 415.559 4.076 20 0 HIADHN CCOC(=O)c1nc(-c2ccccc2)oc1CN1CCCN(Cc2ccccc2)CC1 ZINC000467193665 880923666 /nfs/dbraw/zinc/92/36/66/880923666.db2.gz HBHFRRHAXGTEMW-UHFFFAOYSA-N 0 3 419.525 4.226 20 0 HIADHN Cc1cccc(NC(=O)C[C@H](C)NCc2cc(Cl)ccc2N2CCOCC2)c1C ZINC000467336905 881087616 /nfs/dbraw/zinc/08/76/16/881087616.db2.gz SNDOWAXHUQIVGN-KRWDZBQOSA-N 0 3 415.965 4.300 20 0 HIADHN CC(C)CCOc1ccc(NC(=O)N2CCC(CN3C[C@H](C)O[C@@H](C)C3)CC2)cc1 ZINC000467371340 881144749 /nfs/dbraw/zinc/14/47/49/881144749.db2.gz UKQOAQCSLINOHC-PMACEKPBSA-N 0 3 417.594 4.465 20 0 HIADHN COc1ccc([C@@H](C)NCc2ccc(I)c(C)c2)cc1OC ZINC000467380442 881158196 /nfs/dbraw/zinc/15/81/96/881158196.db2.gz FGXQPKGLJNTHRU-CYBMUJFWSA-N 0 3 411.283 4.468 20 0 HIADHN Cc1cccnc1[C@H]1CCC[C@@H](Nc2ccc3nc(CCN4CCOCC4)[nH]c3c2)C1 ZINC000467391210 881174681 /nfs/dbraw/zinc/17/46/81/881174681.db2.gz RLLDRIGZJOJTPV-VQTJNVASSA-N 0 3 419.573 4.279 20 0 HIADHN CC(C)(C)OC(=O)Cc1ccccc1NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000467399329 881181787 /nfs/dbraw/zinc/18/17/87/881181787.db2.gz FIWVXLQACNFTCV-NRFANRHFSA-N 0 3 423.557 4.357 20 0 HIADHN CN(C)c1ncccc1CN[C@@H](c1cccc(Br)c1)C1CCOCC1 ZINC000467399505 881182177 /nfs/dbraw/zinc/18/21/77/881182177.db2.gz FZTBZJFAASEJCU-LJQANCHMSA-N 0 3 404.352 4.168 20 0 HIADHN Cc1ccc(NC(=O)C[C@H](C)NCc2cc(Cl)ccc2N2CCOCC2)c(C)c1 ZINC000467414741 881203689 /nfs/dbraw/zinc/20/36/89/881203689.db2.gz WMWGTMFNQOWVNO-SFHVURJKSA-N 0 3 415.965 4.300 20 0 HIADHN C[C@H](NC1CC(C)(c2ccccc2)C1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000467416205 881205132 /nfs/dbraw/zinc/20/51/32/881205132.db2.gz FNICHONJPUDWPA-YXZFSOQLSA-N 0 3 413.370 4.412 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)Nc2ccccc2CC(=O)OC(C)(C)C)CN1Cc1ccccc1 ZINC000467462411 881271809 /nfs/dbraw/zinc/27/18/09/881271809.db2.gz YUMCPDVJJPSCOS-GHTZIAJQSA-N 0 3 423.557 4.355 20 0 HIADHN C[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000467494796 881313329 /nfs/dbraw/zinc/31/33/29/881313329.db2.gz QXWNMDSNXLMTBC-IBGZPJMESA-N 0 3 424.585 4.025 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)Nc3cccc(CC(F)(F)F)c3)CC2)c1 ZINC000469046812 883119424 /nfs/dbraw/zinc/11/94/24/883119424.db2.gz UOPYBDJUXXSODI-UHFFFAOYSA-N 0 3 405.464 4.251 20 0 HIADHN C[C@@H](N[C@H]1CCCN(Cc2ccc(F)cc2F)C1=O)c1cccc(OC(F)F)c1 ZINC000469104246 883195282 /nfs/dbraw/zinc/19/52/82/883195282.db2.gz WSTDZOMHRIDBNO-YJYMSZOUSA-N 0 3 410.411 4.408 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)c3cc(-c4ccc(Cl)cc4)c[nH]3)CC2)C[C@H](C)O1 ZINC000469114252 883206312 /nfs/dbraw/zinc/20/63/12/883206312.db2.gz WFFKAWJVBQSQLK-CALCHBBNSA-N 0 3 415.965 4.297 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1c(C)cc(C)[nH]c1=O)c1ccc(C(F)(F)F)cc1 ZINC000469135864 883231397 /nfs/dbraw/zinc/23/13/97/883231397.db2.gz XJXQWWCTLBOIFT-QGZVFWFLSA-N 0 3 409.452 4.236 20 0 HIADHN Cc1cc(C(=O)N(Cc2ccccc2)C2CCN(C)CC2)nn1-c1c(F)cccc1F ZINC000469154346 883251962 /nfs/dbraw/zinc/25/19/62/883251962.db2.gz ZSEPHAIDQBZXKZ-UHFFFAOYSA-N 0 3 424.495 4.196 20 0 HIADHN C[C@@H](N[C@H]1CCCN(Cc2ccc(F)cc2F)C1=O)c1cccc(N2CCCC2)c1 ZINC000469164245 883262659 /nfs/dbraw/zinc/26/26/59/883262659.db2.gz ZXCIWEUYGGBHRR-HXOBKFHXSA-N 0 3 413.512 4.407 20 0 HIADHN Cc1ccc(C(=O)Nc2ccc(C(=O)N(C)[C@H]3CCCN(C)C3)cc2)c(F)c1Cl ZINC000469232075 883332315 /nfs/dbraw/zinc/33/23/15/883332315.db2.gz UHVQWQJDDASRMN-KRWDZBQOSA-N 0 3 417.912 4.206 20 0 HIADHN CO[C@@H](CCN[C@@H](c1ccc(C)cc1)c1cccc(S(C)(=O)=O)c1)C(F)(F)F ZINC000469314149 883415662 /nfs/dbraw/zinc/41/56/62/883415662.db2.gz FDDICKBXUQYYCO-OALUTQOASA-N 0 3 415.477 4.045 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)c1oc(-c2ccccc2)nc1C ZINC000469352446 883471160 /nfs/dbraw/zinc/47/11/60/883471160.db2.gz YEDRVFMWVUGQES-OAQYLSRUSA-N 0 3 404.514 4.172 20 0 HIADHN CCCc1noc2nc(CC)cc(C(=O)N(C)C3CCN(Cc4ccccc4)CC3)c12 ZINC000503622634 912721317 /nfs/dbraw/zinc/72/13/17/912721317.db2.gz QKIQXDXWTPFUSF-UHFFFAOYSA-N 0 3 420.557 4.474 20 0 HIADHN O=C(NC[C@H]1CCCN1Cc1ccccc1)c1c(F)ccc(Br)c1F ZINC000469424731 883605591 /nfs/dbraw/zinc/60/55/91/883605591.db2.gz RKTDANRIQKPERE-CQSZACIVSA-N 0 3 409.274 4.122 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)Nc1ccc(C(=O)N2CCCC2)cc1 ZINC000469470205 883692584 /nfs/dbraw/zinc/69/25/84/883692584.db2.gz HAEIWURHDCIJTR-HSZRJFAPSA-N 0 3 422.573 4.201 20 0 HIADHN CN(CCN(Cc1cc(-c2cnn(C)c2)no1)Cc1ccccc1)Cc1ccccc1 ZINC000469513619 883774957 /nfs/dbraw/zinc/77/49/57/883774957.db2.gz KLAWKPJOHGHAPB-UHFFFAOYSA-N 0 3 415.541 4.209 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)c2ccc(C(C)(C)C(F)(F)F)cc2)CC1 ZINC000469535341 883804422 /nfs/dbraw/zinc/80/44/22/883804422.db2.gz KVNRVJCQJSVNRH-UHFFFAOYSA-N 0 3 400.485 4.146 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)c2cc(Br)c(F)cc2F)CC1 ZINC000469554268 883811984 /nfs/dbraw/zinc/81/19/84/883811984.db2.gz MXVPYYLGIORSHH-UHFFFAOYSA-N 0 3 423.301 4.464 20 0 HIADHN CCOc1nc2cc(C(=O)Nc3ccc(CN4CCSCC4)cc3C)ccc2[nH]1 ZINC000469629363 883841071 /nfs/dbraw/zinc/84/10/71/883841071.db2.gz GCWQARQDEUIDLN-UHFFFAOYSA-N 0 3 410.543 4.071 20 0 HIADHN Cc1cccc(NC(=O)N(CCN(C)C)Cc2cccc(F)c2)c1Br ZINC000469661505 883855788 /nfs/dbraw/zinc/85/57/88/883855788.db2.gz NIFPHHORJQTERH-UHFFFAOYSA-N 0 3 408.315 4.492 20 0 HIADHN CC(=O)N1CCCc2cc(NC(=O)N[C@@H](CN(C)Cc3ccccc3)C(C)C)ccc21 ZINC000469665981 883858795 /nfs/dbraw/zinc/85/87/95/883858795.db2.gz UVLRLGQNQHVHSZ-QHCPKHFHSA-N 0 3 422.573 4.264 20 0 HIADHN CCOc1cc(Cl)ccc1NC(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000469671396 883862101 /nfs/dbraw/zinc/86/21/01/883862101.db2.gz RGZFWCFNCPRDJD-CALCHBBNSA-N 0 3 423.985 4.482 20 0 HIADHN C[C@@H](Oc1cccc2ccccc21)C(=O)NC1CCN([C@@H](C)c2ccncc2)CC1 ZINC000469692514 883873885 /nfs/dbraw/zinc/87/38/85/883873885.db2.gz ISURDYMSZCGNHQ-RBUKOAKNSA-N 0 3 403.526 4.344 20 0 HIADHN COc1ccc2c(c1)[C@H](N(Cc1ccccc1)C(=O)CN1[C@H](C)CC[C@@H]1C)CCO2 ZINC000469699523 883878019 /nfs/dbraw/zinc/87/80/19/883878019.db2.gz IETYLDRKRPZQJY-SELNLUPBSA-N 0 3 408.542 4.420 20 0 HIADHN O=C1[C@@H](N2CCC(c3nc4ccccc4[nH]3)CC2)CCCN1Cc1ccc(F)cc1F ZINC000469711608 883882379 /nfs/dbraw/zinc/88/23/79/883882379.db2.gz FKNKBICBNJYQRR-QFIPXVFZSA-N 0 3 424.495 4.212 20 0 HIADHN Cc1nn(CC(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)cc1-c1ccccc1 ZINC000469735038 883892896 /nfs/dbraw/zinc/89/28/96/883892896.db2.gz RAVMGVSYSUYOJN-UHFFFAOYSA-N 0 3 417.557 4.028 20 0 HIADHN CC(C)c1nc([C@H](C)NCC2CCN(S(=O)(=O)c3ccccc3)CC2)cs1 ZINC000469781627 883957120 /nfs/dbraw/zinc/95/71/20/883957120.db2.gz WGLMSNDQKUPFDH-INIZCTEOSA-N 0 3 407.605 4.018 20 0 HIADHN CC[C@@H](Cc1ccccc1)N(CC)C(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000469783752 883959396 /nfs/dbraw/zinc/95/93/96/883959396.db2.gz QHIYLKQBYKGQFI-DEOSSOPVSA-N 0 3 423.601 4.196 20 0 HIADHN COc1ccc(C(=O)N2CCC(N[C@@H](C)c3csc(C(C)C)n3)CC2)cc1OC ZINC000469786518 883961089 /nfs/dbraw/zinc/96/10/89/883961089.db2.gz OEMDJKSHXMQPME-HNNXBMFYSA-N 0 3 417.575 4.239 20 0 HIADHN C[C@@H]1C[C@H](N(C)C(=O)CCC(=O)c2ccc(Cl)cn2)CCN1Cc1ccccc1 ZINC000469808648 883982906 /nfs/dbraw/zinc/98/29/06/883982906.db2.gz KIOBLXGTKVMPKA-YLJYHZDGSA-N 0 3 413.949 4.209 20 0 HIADHN C[C@@H](CC(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1)c1c[nH]c2ccccc21 ZINC000469849803 884031868 /nfs/dbraw/zinc/03/18/68/884031868.db2.gz AMSVEXVQGJTKIG-PZJWPPBQSA-N 0 3 405.542 4.069 20 0 HIADHN O=C(CCCc1nc2ccccc2s1)NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000469849947 884034453 /nfs/dbraw/zinc/03/44/53/884034453.db2.gz UGFGYYZADAKBPC-FQEVSTJZSA-N 0 3 423.582 4.026 20 0 HIADHN O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)C1(Cc2ccccc2Cl)CC1 ZINC000469851195 884035506 /nfs/dbraw/zinc/03/55/06/884035506.db2.gz HNNDWMGHTVUZBL-OAQYLSRUSA-N 0 3 412.961 4.070 20 0 HIADHN Cc1nc(-c2ccsc2)ccc1C(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000469857476 884043556 /nfs/dbraw/zinc/04/35/56/884043556.db2.gz VCTVPJJZRZPFNC-NRFANRHFSA-N 0 3 421.566 4.139 20 0 HIADHN O=C(CC1CCC(C(F)(F)F)CC1)NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000469863434 884051434 /nfs/dbraw/zinc/05/14/34/884051434.db2.gz GXXNAFUIMGPXQO-UUKMXZOPSA-N 0 3 412.496 4.153 20 0 HIADHN Cc1c(C(=O)NC[C@@H]2CN(Cc3ccccc3)CCCO2)sc2cccc(F)c12 ZINC000469863226 884051746 /nfs/dbraw/zinc/05/17/46/884051746.db2.gz BYTBUQJVTHFQIC-GOSISDBHSA-N 0 3 412.530 4.370 20 0 HIADHN Cc1nc(-c2ccccc2)ccc1C(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000469866050 884056141 /nfs/dbraw/zinc/05/61/41/884056141.db2.gz XCLYOYGFBUYTCO-QHCPKHFHSA-N 0 3 415.537 4.078 20 0 HIADHN Cc1nc(-c2cccc(C(=O)NC[C@@H]3CN(Cc4ccccc4)CCCO3)c2)cs1 ZINC000469873912 884064793 /nfs/dbraw/zinc/06/47/93/884064793.db2.gz VNJXPZVMLMECHM-JOCHJYFZSA-N 0 3 421.566 4.139 20 0 HIADHN Cc1ccc(C)c(Sc2ccc(NC(=O)N3CCCN([C@H](C)CO)CC3)cc2)c1 ZINC000469916052 884106693 /nfs/dbraw/zinc/10/66/93/884106693.db2.gz IIAHTLUNVKKZGK-LJQANCHMSA-N 0 3 413.587 4.375 20 0 HIADHN CCc1c(C(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)cnn1-c1ccccc1OC ZINC000469924266 884117433 /nfs/dbraw/zinc/11/74/33/884117433.db2.gz CLHDGLNSIFTFRR-UYAOXDASSA-N 0 3 418.541 4.009 20 0 HIADHN C[C@@H]1CN(Cc2ccccn2)CC[C@@H]1NCc1csc(CCc2ccccc2)n1 ZINC000469979454 884192451 /nfs/dbraw/zinc/19/24/51/884192451.db2.gz XASYXLQWEHSWNH-XXBNENTESA-N 0 3 406.599 4.324 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@@H]2NC(=O)NC[C@H](c2cccs2)N2CCCC2)cc1 ZINC000470025436 884245946 /nfs/dbraw/zinc/24/59/46/884245946.db2.gz WSFKTBTTZUWXEH-VWPQPMDRSA-N 0 3 413.587 4.413 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@H]2NC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000470026307 884248520 /nfs/dbraw/zinc/24/85/20/884248520.db2.gz DRFFXEWJLXEERP-VXNXHJTFSA-N 0 3 407.558 4.179 20 0 HIADHN Cc1ccc([C@H]2OCCC[C@@H]2NC(=O)N(CCN(C)C)Cc2ccc(F)cc2)cc1 ZINC000470048520 884292796 /nfs/dbraw/zinc/29/27/96/884292796.db2.gz WYOWMZRLPRKTEM-XZOQPEGZSA-N 0 3 413.537 4.128 20 0 HIADHN CC1CCN([C@H](CNC(=O)N[C@@H]2CCCC[C@@H]2n2cccn2)c2cccs2)CC1 ZINC000470049594 884294577 /nfs/dbraw/zinc/29/45/77/884294577.db2.gz GFBGHZFGBPYJGH-HSALFYBXSA-N 0 3 415.607 4.201 20 0 HIADHN CC(C)[C@@H]1CCC[C@H](NC(=O)NCc2ccccc2CN2CCC(O)CC2)CC1 ZINC000470163880 884439845 /nfs/dbraw/zinc/43/98/45/884439845.db2.gz PCZQKXCRPSCFSN-KNQAVFIVSA-N 0 3 401.595 4.047 20 0 HIADHN O=C(NC[C@@H]1CCCCN1C1CC1)c1cc(C(F)(F)F)ccc1Br ZINC000470167534 884443600 /nfs/dbraw/zinc/44/36/00/884443600.db2.gz RIMYKNZDJOYXNM-ZDUSSCGKSA-N 0 3 405.258 4.215 20 0 HIADHN C[C@H](NC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C)c1ccccc1-n1cccn1 ZINC000470178249 884460795 /nfs/dbraw/zinc/46/07/95/884460795.db2.gz JFLDJZVKWFXGBS-SFTDATJTSA-N 0 3 417.557 4.239 20 0 HIADHN O=C(CN[C@H]1CCCc2cc(Br)ccc21)N[C@H]1CCOc2ccccc21 ZINC000503852910 912841335 /nfs/dbraw/zinc/84/13/35/912841335.db2.gz BBGXUQPDYSJOHL-OALUTQOASA-N 0 3 415.331 4.056 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)N(Cc1cc[nH]n1)Cc1ccccc1 ZINC000470283568 884649387 /nfs/dbraw/zinc/64/93/87/884649387.db2.gz BYYGRCLYJCSVAN-XMMPIXPASA-N 0 3 419.573 4.278 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)NCc1ncc(-c2ccccc2)cn1 ZINC000470285396 884653591 /nfs/dbraw/zinc/65/35/91/884653591.db2.gz IDLGEQPIABOMKD-HSZRJFAPSA-N 0 3 417.557 4.099 20 0 HIADHN O=C(CN[C@H](c1cccc(C(F)(F)F)c1)C1CC1)N[C@H]1CCOc2ccccc21 ZINC000503886524 912850587 /nfs/dbraw/zinc/85/05/87/912850587.db2.gz NSZFXKZKTXKATQ-RXVVDRJESA-N 0 3 404.432 4.386 20 0 HIADHN Cc1ccc(C)c([C@@H](NCC2(OCCO)CCOCC2)c2ccccc2Cl)c1 ZINC000503887221 912850814 /nfs/dbraw/zinc/85/08/14/912850814.db2.gz QQHUGYQYXCFSFY-QFIPXVFZSA-N 0 3 403.950 4.194 20 0 HIADHN CCN(C(=O)c1cc(OC)c(OC)cc1F)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000470341318 884728263 /nfs/dbraw/zinc/72/82/63/884728263.db2.gz ZOAHJVNUCRVMFA-WMZOPIPTSA-N 0 3 400.494 4.141 20 0 HIADHN C[C@H](CO)N1CCCN(C(=O)Nc2cccc(Sc3ccc(Cl)cc3)c2)CC1 ZINC000470386774 884787373 /nfs/dbraw/zinc/78/73/73/884787373.db2.gz APWLWRZWRQPIFA-MRXNPFEDSA-N 0 3 419.978 4.412 20 0 HIADHN Cc1cc(NC(=O)NCCc2ccccc2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000470387821 884789996 /nfs/dbraw/zinc/78/99/96/884789996.db2.gz FWYYLLDAAJZSFE-QFIPXVFZSA-N 0 3 403.530 4.003 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](NCCc2ccccc2)c2ccc(F)c(F)c2)c1 ZINC000503934486 912871846 /nfs/dbraw/zinc/87/18/46/912871846.db2.gz MXLWYUOZJBXPFP-QFIPXVFZSA-N 0 3 401.478 4.290 20 0 HIADHN C[C@@H](NC(=O)NC[C@H](Cc1ccccc1)N(C)C)c1ccc(-c2ccncc2)cc1 ZINC000470471259 884862699 /nfs/dbraw/zinc/86/26/99/884862699.db2.gz VWGOFTUKLWXIFJ-DVECYGJZSA-N 0 3 402.542 4.282 20 0 HIADHN CCN(C[C@H]1CCN(Cc2ccccc2)C1)C(=O)C[C@H](C)C(=O)c1cccc(F)c1 ZINC000470530557 884928751 /nfs/dbraw/zinc/92/87/51/884928751.db2.gz RDQMDKTYPKIVNZ-FPOVZHCZSA-N 0 3 410.533 4.405 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)Nc1nc2cc(Br)ccc2[nH]1 ZINC000470535219 884936071 /nfs/dbraw/zinc/93/60/71/884936071.db2.gz ZWXGCKNLOOCCJT-UHFFFAOYSA-N 0 3 413.275 4.386 20 0 HIADHN CCN1CCN(c2ccc(C(=O)NC[C@@H]3CCCO[C@H]3c3ccc(C)cc3)cc2)CC1 ZINC000470542094 884947561 /nfs/dbraw/zinc/94/75/61/884947561.db2.gz DWLOLCNVXJVVIR-ZCYQVOJMSA-N 0 3 421.585 4.035 20 0 HIADHN COc1ccccc1-c1noc([C@H](C)NC(=O)c2oc3ccccc3c2CN(C)C)n1 ZINC000470546619 884956798 /nfs/dbraw/zinc/95/67/98/884956798.db2.gz LUAZVVRPRMRVJR-AWEZNQCLSA-N 0 3 420.469 4.044 20 0 HIADHN Cc1ccc(C(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)cc1NC(=O)c1ccco1 ZINC000503955562 912882832 /nfs/dbraw/zinc/88/28/32/912882832.db2.gz HQKDKNYBRGKHSW-WIYYLYMNSA-N 0 3 417.509 4.406 20 0 HIADHN Cc1cc(C(=O)N[C@H](CN(C)Cc2ccccc2)C(C)C)c(C)n1Cc1ccncc1 ZINC000470588304 885005322 /nfs/dbraw/zinc/00/53/22/885005322.db2.gz QBPCHHKLXQZPBT-RUZDIDTESA-N 0 3 418.585 4.435 20 0 HIADHN CN(C(=O)c1ccc(OCC(F)(F)F)cc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470666528 885093829 /nfs/dbraw/zinc/09/38/29/885093829.db2.gz GRBWEFZDNUVNBU-IBGZPJMESA-N 0 3 406.448 4.364 20 0 HIADHN CC(C)N1CCC[C@@H](NC(=O)c2ccc(SCc3cn4ccccc4n3)cc2)C1 ZINC000470669393 885098259 /nfs/dbraw/zinc/09/82/59/885098259.db2.gz KCXCTUPVXXOQBQ-LJQANCHMSA-N 0 3 408.571 4.229 20 0 HIADHN Cc1c(C(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)cnn1-c1ccccc1F ZINC000470673929 885102704 /nfs/dbraw/zinc/10/27/04/885102704.db2.gz ITVKLESEQANTJO-FQEVSTJZSA-N 0 3 406.505 4.056 20 0 HIADHN Cc1noc2nc(C(C)C)cc(C(=O)N(C)[C@H]3CCCN(Cc4ccccc4)C3)c12 ZINC000470681492 885113884 /nfs/dbraw/zinc/11/38/84/885113884.db2.gz IEGRZHBUYGJJLF-IBGZPJMESA-N 0 3 406.530 4.391 20 0 HIADHN CC(C)C(=O)N(C)Cc1ccc(C(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000470682625 885115926 /nfs/dbraw/zinc/11/59/26/885115926.db2.gz MYFQANGNOYRRSA-XMMPIXPASA-N 0 3 421.585 4.038 20 0 HIADHN CN(C(=O)N[C@H]1CCCOc2ccc(F)cc21)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470720284 885164458 /nfs/dbraw/zinc/16/44/58/885164458.db2.gz RWXCCCBVMOFLNT-UNMCSNQZSA-N 0 3 411.521 4.345 20 0 HIADHN CCc1cccc2c1OCC[C@H]2NC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470719901 885164610 /nfs/dbraw/zinc/16/46/10/885164610.db2.gz MWFGTPFTIJPMBT-FYYLOGMGSA-N 0 3 407.558 4.379 20 0 HIADHN Cc1cccc2[nH]cc(CCNC(=O)N(C)[C@@H]3CCCN(Cc4ccccc4)C3)c21 ZINC000470720582 885166777 /nfs/dbraw/zinc/16/67/77/885166777.db2.gz WTOMETYYQZXWJG-JOCHJYFZSA-N 0 3 404.558 4.325 20 0 HIADHN CC[C@H](NC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1)c1ccc2c(c1)OCCO2 ZINC000470722257 885168828 /nfs/dbraw/zinc/16/88/28/885168828.db2.gz HRZRNENMTZPXRY-VXKWHMMOSA-N 0 3 423.557 4.215 20 0 HIADHN CC[C@@H](NC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1)c1ccc2c(c1)OCCO2 ZINC000470722256 885169685 /nfs/dbraw/zinc/16/96/85/885169685.db2.gz HRZRNENMTZPXRY-FGZHOGPDSA-N 0 3 423.557 4.215 20 0 HIADHN Cc1[nH]c2ccccc2c1CCNC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470725064 885173408 /nfs/dbraw/zinc/17/34/08/885173408.db2.gz ANVMLQZGQXWACI-OAQYLSRUSA-N 0 3 404.558 4.325 20 0 HIADHN CN(C(=O)NCc1cccc(Br)c1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470731948 885184909 /nfs/dbraw/zinc/18/49/09/885184909.db2.gz GARBZIAMDYWMGO-HXUWFJFHSA-N 0 3 416.363 4.255 20 0 HIADHN CC(=O)Nc1cccc([C@@H](C)NC(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000470736106 885191503 /nfs/dbraw/zinc/19/15/03/885191503.db2.gz GLHUUCORYMUZED-WZONZLPQSA-N 0 3 408.546 4.012 20 0 HIADHN CN(Cc1nc(C(F)(F)F)cs1)C(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000470744871 885207641 /nfs/dbraw/zinc/20/76/41/885207641.db2.gz QMTKJCRFFSKWBR-GFCCVEGCSA-N 0 3 418.510 4.202 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)c2cc3cc(Br)ccc3o2)o1 ZINC000504007642 912912887 /nfs/dbraw/zinc/91/28/87/912912887.db2.gz GNDFJSLTIJNHBK-UHFFFAOYSA-N 0 3 405.292 4.301 20 0 HIADHN CC(=O)c1c(C)cc(C)c(CN(C)C[C@@H]2C[C@H](F)CN2Cc2nccs2)c1C ZINC000470802474 885291036 /nfs/dbraw/zinc/29/10/36/885291036.db2.gz AXADRMCTHLKSMB-OALUTQOASA-N 0 3 403.567 4.315 20 0 HIADHN CN(C(=O)c1cc(C2CC2)nn1-c1ccccc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470820424 885309405 /nfs/dbraw/zinc/30/94/05/885309405.db2.gz JEISQTIZVQUGHI-QHCPKHFHSA-N 0 3 414.553 4.486 20 0 HIADHN CN(C(=O)NCc1nc(C(C)(C)C)cs1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470894296 885392175 /nfs/dbraw/zinc/39/21/75/885392175.db2.gz FMXCHXSDWFDIPM-GOSISDBHSA-N 0 3 400.592 4.247 20 0 HIADHN O=C(c1cccc(CN2CCCC2)c1)N(CCO)Cc1ccc(Cl)c(Cl)c1 ZINC000504037756 912946234 /nfs/dbraw/zinc/94/62/34/912946234.db2.gz WJJQYQYNGBJTGL-UHFFFAOYSA-N 0 3 407.341 4.224 20 0 HIADHN CC(C)c1nn(-c2ccccc2)cc1CNC(=O)N(CCN(C)C)Cc1ccccc1 ZINC000471068230 885585272 /nfs/dbraw/zinc/58/52/72/885585272.db2.gz CQANEZHSZLDKSA-UHFFFAOYSA-N 0 3 419.573 4.269 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)NCc2cn(-c3ccccc3)nc2C(C)C)o1 ZINC000471068713 885587408 /nfs/dbraw/zinc/58/74/08/885587408.db2.gz IPXFJCLCUGVZKF-UHFFFAOYSA-N 0 3 423.561 4.171 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)NCc2nnc(-c3ccccc3)s2)CC1 ZINC000471071598 885590908 /nfs/dbraw/zinc/59/09/08/885590908.db2.gz FKKJNPDIPFZXDK-UHFFFAOYSA-N 0 3 421.570 4.011 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000471124004 885660907 /nfs/dbraw/zinc/66/09/07/885660907.db2.gz IYIQSAUJNSSVBP-UHFFFAOYSA-N 0 3 405.848 4.275 20 0 HIADHN C[C@H](NC(=O)C1(c2ccc(Br)cc2)CC1)[C@@H](c1ccccc1)N(C)C ZINC000471137142 885677537 /nfs/dbraw/zinc/67/75/37/885677537.db2.gz NQUBEQHBWBGQCF-KXBFYZLASA-N 0 3 401.348 4.288 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3cccc4cc[nH]c43)c(OCC)c2)CC1 ZINC000471167586 885724115 /nfs/dbraw/zinc/72/41/15/885724115.db2.gz DDLQFBRQXJCWIL-UHFFFAOYSA-N 0 3 406.530 4.351 20 0 HIADHN COc1cccc([C@@H](CNC(=O)N[C@@H]2CCSc3ccccc32)N2CCCC2)c1 ZINC000504087515 912996046 /nfs/dbraw/zinc/99/60/46/912996046.db2.gz NZAPDHKGJLXDSE-NHCUHLMSSA-N 0 3 411.571 4.368 20 0 HIADHN COc1cccc2c1CC[C@@H]2NC(=O)N(CCN(C)C)Cc1cccc(Cl)c1 ZINC000471484848 886181688 /nfs/dbraw/zinc/18/16/88/886181688.db2.gz MCOATIYRZKEEQD-FQEVSTJZSA-N 0 3 401.938 4.109 20 0 HIADHN CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)Nc1ncc(-c2ccccc2)s1 ZINC000471493289 886191914 /nfs/dbraw/zinc/19/19/14/886191914.db2.gz MSZGIUVLOYOILK-ICSRJNTNSA-N 0 3 407.543 4.362 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)NCC1CCN(c2ccccc2)CC1 ZINC000471498544 886200182 /nfs/dbraw/zinc/20/01/82/886200182.db2.gz ZLCSVCILPBCCHH-DEOSSOPVSA-N 0 3 406.574 4.039 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N[C@@H]1CC[C@H]2CCCC[C@@H]2C1 ZINC000471506810 886207696 /nfs/dbraw/zinc/20/76/96/886207696.db2.gz JRBKLULEDYMYQN-RXZNSZBDSA-N 0 3 401.517 4.450 20 0 HIADHN Cc1ccc([C@H](NC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)c2ccccn2)cc1 ZINC000471530389 886234092 /nfs/dbraw/zinc/23/40/92/886234092.db2.gz QYKIGTPGGMNYBS-VWNXMTODSA-N 0 3 400.526 4.053 20 0 HIADHN O=C(N[C@@H](c1cccs1)C1CC1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000471542217 886247775 /nfs/dbraw/zinc/24/77/75/886247775.db2.gz SMWYSKPBKAOUEP-VMBOVVBDSA-N 0 3 401.498 4.304 20 0 HIADHN COc1ccc(CCC(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)cc1Br ZINC000471543122 886249910 /nfs/dbraw/zinc/24/99/10/886249910.db2.gz XDDLFEPJGPNDEB-YCRPNKLZSA-N 0 3 419.363 4.198 20 0 HIADHN Cc1c(I)cccc1C(=O)N[C@H](C)[C@@H](c1ccccc1)N(C)C ZINC000471545505 886252336 /nfs/dbraw/zinc/25/23/36/886252336.db2.gz GHUPCTFETANHJW-KDOFPFPSSA-N 0 3 422.310 4.021 20 0 HIADHN Cc1ccc(I)c(C(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)c1 ZINC000471569380 886279626 /nfs/dbraw/zinc/27/96/26/886279626.db2.gz GUYQRTCBQVBZBR-KBXCAEBGSA-N 0 3 422.310 4.021 20 0 HIADHN COc1ccccc1[C@H](CN[C@H](C)c1ccc(NC(C)=O)cc1OC)OC(C)C ZINC000471593930 886306321 /nfs/dbraw/zinc/30/63/21/886306321.db2.gz NPGCBPGTUXSDMZ-MWTRTKDXSA-N 0 3 400.519 4.479 20 0 HIADHN O=C(NCC1CCN(c2ccccc2)CC1)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000471599689 886312514 /nfs/dbraw/zinc/31/25/14/886312514.db2.gz VHBOLMHORPGWNV-DEOSSOPVSA-N 0 3 406.574 4.039 20 0 HIADHN C[C@H](CCCCN1C(=O)c2ccccc2C1=O)NCc1coc(-c2cccs2)n1 ZINC000471606676 886321122 /nfs/dbraw/zinc/32/11/22/886321122.db2.gz PGQKYONZHLVNGL-OAHLLOKOSA-N 0 3 409.511 4.348 20 0 HIADHN FC(F)(F)c1ccc(C2CC([NH2+]Cc3nnc(COc4ccccc4)[n-]3)C2)cc1 ZINC000471617321 886333926 /nfs/dbraw/zinc/33/39/26/886333926.db2.gz FTFISCACQJJFGD-UHFFFAOYSA-N 0 3 402.420 4.438 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)c3cc(C4CC4)nn3-c3ccccc3)c2)CC1 ZINC000471641445 886356856 /nfs/dbraw/zinc/35/68/56/886356856.db2.gz DZHGCLPRZWHJOJ-UHFFFAOYSA-N 0 3 415.541 4.144 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)CCc3ccc(Cl)c(OC)c3)c2)CC1 ZINC000471661023 886373008 /nfs/dbraw/zinc/37/30/08/886373008.db2.gz ZFZUZSLTEHAUCV-UHFFFAOYSA-N 0 3 401.938 4.062 20 0 HIADHN CC(=O)Nc1cc(C(=O)N(CCN(C)C)Cc2cccc(C)c2)cc(C(F)(F)F)c1 ZINC000471699653 886406199 /nfs/dbraw/zinc/40/61/99/886406199.db2.gz BAJIJFKBKGXYHV-UHFFFAOYSA-N 0 3 421.463 4.176 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1C[C@H]1c1ccc(OC(F)F)cc1)[C@H](c1ccccc1)N(C)C ZINC000504146185 913044521 /nfs/dbraw/zinc/04/45/21/913044521.db2.gz UDCBMLRUNFOKDJ-VVHHDAOASA-N 0 3 403.473 4.135 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)c3cc(F)ccc3-c3ccoc3)cc2)CC1 ZINC000471750205 886479465 /nfs/dbraw/zinc/47/94/65/886479465.db2.gz WQJOQRSXHMCJQX-UHFFFAOYSA-N 0 3 407.489 4.476 20 0 HIADHN O=C(NCc1cccc2ccccc21)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000471773254 886505480 /nfs/dbraw/zinc/50/54/80/886505480.db2.gz QAHGEJOKXLVJCE-UHFFFAOYSA-N 0 3 405.464 4.444 20 0 HIADHN CCSCc1cc(C(=O)N(CCN2CCCC2)Cc2ccc(Cl)cc2)no1 ZINC000471803722 886540541 /nfs/dbraw/zinc/54/05/41/886540541.db2.gz JLAHLNNORMVFIX-UHFFFAOYSA-N 0 3 407.967 4.319 20 0 HIADHN CCN(C(=O)c1noc(-c2cccc(OC)c2)n1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000471807017 886544585 /nfs/dbraw/zinc/54/45/85/886544585.db2.gz BCGBFLFQUYDUPI-YLJYHZDGSA-N 0 3 420.513 4.043 20 0 HIADHN Cc1ccc([C@H](NC(=O)N(CCN(C)C)Cc2ccccn2)c2ccccc2)cc1 ZINC000504190146 913073044 /nfs/dbraw/zinc/07/30/44/913073044.db2.gz MCTOULBSPFRAHV-XMMPIXPASA-N 0 3 402.542 4.253 20 0 HIADHN C[C@@H](NC(=O)N(CCN(C)C)Cc1ccccc1)c1ccc(OCC(F)(F)F)cc1 ZINC000504186057 913069318 /nfs/dbraw/zinc/06/93/18/913069318.db2.gz UYLCIFNKDGBMED-QGZVFWFLSA-N 0 3 423.479 4.462 20 0 HIADHN Cc1cn([C@@H](C)c2ccccc2)nc1NC(=O)NC[C@H](Cc1ccccc1)N(C)C ZINC000471915584 886703044 /nfs/dbraw/zinc/70/30/44/886703044.db2.gz RMWQVHFRFBCJDL-UGKGYDQZSA-N 0 3 405.546 4.095 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2cc(C(C)(C)C)nn2-c2ccccn2)[C@@H]1c1ccccc1 ZINC000471943942 886744925 /nfs/dbraw/zinc/74/49/25/886744925.db2.gz PBKQUCCNMJMPLX-GCJKJVERSA-N 0 3 418.545 4.132 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3cc(C(F)(F)F)ccc3F)CC2)C[C@@H](C)O1 ZINC000471945512 886747190 /nfs/dbraw/zinc/74/71/90/886747190.db2.gz WXZLWVOHUVTYIU-HUUCEWRRSA-N 0 3 416.459 4.196 20 0 HIADHN Cn1nc(C(F)F)c2cc(C(=O)NC[C@H]3CCCN(Cc4cccs4)C3)sc21 ZINC000471945820 886748558 /nfs/dbraw/zinc/74/85/58/886748558.db2.gz ZOAJKZGQLHKJDN-GFCCVEGCSA-N 0 3 424.542 4.276 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)[C@@H](c3cccc(Cl)c3)N(C)C)c2)CC1 ZINC000504199060 913079914 /nfs/dbraw/zinc/07/99/14/913079914.db2.gz IPBBVWVWWRPNDA-JOCHJYFZSA-N 0 3 414.981 4.112 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2cc(Br)c(F)cc2F)[C@H]1c1ccccc1 ZINC000471964426 886790648 /nfs/dbraw/zinc/79/06/48/886790648.db2.gz IYRLVSGFIZBQQR-DOTOQJQBSA-N 0 3 410.262 4.294 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2cc(Br)c(F)cc2F)[C@H]1c1ccccc1 ZINC000471964427 886791962 /nfs/dbraw/zinc/79/19/62/886791962.db2.gz IYRLVSGFIZBQQR-NVXWUHKLSA-N 0 3 410.262 4.294 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2c(F)cc(Br)cc2F)[C@H]1c1ccccc1 ZINC000471978052 886808016 /nfs/dbraw/zinc/80/80/16/886808016.db2.gz KEUYZUYFLPFKBY-NVXWUHKLSA-N 0 3 410.262 4.294 20 0 HIADHN CCO[C@@H](CCNC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1)C1CCCC1 ZINC000471985523 886813088 /nfs/dbraw/zinc/81/30/88/886813088.db2.gz SGGYJXBLIONLBM-ACBHZAAOSA-N 0 3 419.532 4.076 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2-c2nc(C3CC3)no2)[C@H]1c1ccccc1 ZINC000471992160 886818623 /nfs/dbraw/zinc/81/86/23/886818623.db2.gz MVEAFLTZIPSTQM-WOJBJXKFSA-N 0 3 421.476 4.320 20 0 HIADHN CCC(CC)c1cc(CNC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)on1 ZINC000471997365 886823273 /nfs/dbraw/zinc/82/32/73/886823273.db2.gz DGHOTPLXKKGHEU-UHFFFAOYSA-N 0 3 416.488 4.183 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)c3cc(F)ccc3-c3ccoc3)CC2)C[C@H](C)O1 ZINC000472027660 886850009 /nfs/dbraw/zinc/85/00/09/886850009.db2.gz AKXYKDGZGQSUCK-CALCHBBNSA-N 0 3 400.494 4.047 20 0 HIADHN CCn1nc(CNC2CCN(c3ccc(C(F)(F)F)cn3)CC2)c2ccccc21 ZINC000472036975 886855844 /nfs/dbraw/zinc/85/58/44/886855844.db2.gz GTAPUZGYRGSJDL-UHFFFAOYSA-N 0 3 403.452 4.229 20 0 HIADHN COc1ccc(OC)c([C@@H]2C[C@@H]2C(=O)NC[C@@H](C(C)C)N2CCc3ccccc3C2)c1 ZINC000472121571 886910659 /nfs/dbraw/zinc/91/06/59/886910659.db2.gz DUPYMEPOUWZXFY-XWGVYQGASA-N 0 3 422.569 4.006 20 0 HIADHN COc1ccc([C@H](NC[C@H](O)CCOC(C)C)c2ccccc2)cc1Br ZINC000472165011 886962746 /nfs/dbraw/zinc/96/27/46/886962746.db2.gz WOIMEINPADNOMK-WIYYLYMNSA-N 0 3 422.363 4.313 20 0 HIADHN COc1ccc(OC)c([C@@H]2C[C@H]2C(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)c1 ZINC000472230722 887038514 /nfs/dbraw/zinc/03/85/14/887038514.db2.gz HIKCBDDRUVTHKG-MDNUFGMLSA-N 0 3 408.542 4.069 20 0 HIADHN COc1ccc(OC)c([C@@H]2C[C@@H]2C(=O)N[C@@H](CN(C)Cc2ccccc2)C(C)C)c1 ZINC000472253491 887063318 /nfs/dbraw/zinc/06/33/18/887063318.db2.gz DEJROKXTZAIAKG-PMVMPFDFSA-N 0 3 410.558 4.080 20 0 HIADHN C[C@H](Oc1cnc2ccccc2c1)C(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000472260081 887072930 /nfs/dbraw/zinc/07/29/30/887072930.db2.gz PZJHOQJEBYNHLM-IBGZPJMESA-N 0 3 403.526 4.125 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2cccc(OCc3cscn3)c2)[C@@H]1c1ccccc1 ZINC000472304257 887128393 /nfs/dbraw/zinc/12/83/93/887128393.db2.gz HCXXQAOGVQFRDL-RTWAWAEBSA-N 0 3 408.527 4.289 20 0 HIADHN Cc1cc(N2CCSCC2)ccc1NC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000472311037 887139610 /nfs/dbraw/zinc/13/96/10/887139610.db2.gz BYDULLRNFUJBIA-YADHBBJMSA-N 0 3 410.587 4.115 20 0 HIADHN COc1cc(-c2nnc(CN3CC[C@@H](Cc4ccccc4)[C@H]3C)o2)cc(OC)c1OC ZINC000472324816 887158636 /nfs/dbraw/zinc/15/86/36/887158636.db2.gz ILXCZHJRKZSWBA-AEFFLSMTSA-N 0 3 423.513 4.216 20 0 HIADHN Cc1cc(Oc2ncccn2)ccc1NC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000472329492 887164241 /nfs/dbraw/zinc/16/42/41/887164241.db2.gz QOTNFRHOYIXVCJ-NHCUHLMSSA-N 0 3 403.486 4.144 20 0 HIADHN CC[C@@H]1CN(C(C)=O)[C@@H](CC)CN1CCC(=O)Nc1c(Cl)cccc1Cl ZINC000472334922 887171455 /nfs/dbraw/zinc/17/14/55/887171455.db2.gz AWGAEHMBFFANAP-CABCVRRESA-N 0 3 400.350 4.043 20 0 HIADHN CCc1ccc(-c2noc([C@@H](C)NC(=O)c3cccc(CN4CCCC4)c3)n2)cc1 ZINC000472397897 887245597 /nfs/dbraw/zinc/24/55/97/887245597.db2.gz XOJJAYHLRSCPFM-QGZVFWFLSA-N 0 3 404.514 4.386 20 0 HIADHN CCN1CCN(CCC(=O)NCc2ccccc2-c2ccc(Cl)cc2Cl)CC1 ZINC000472440351 887290044 /nfs/dbraw/zinc/29/00/44/887290044.db2.gz SBYVBUUCOXLODU-UHFFFAOYSA-N 0 3 420.384 4.304 20 0 HIADHN CN(Cc1cc2ccccc2o1)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472446262 887299084 /nfs/dbraw/zinc/29/90/84/887299084.db2.gz JCLWRENWQNKPCH-UHFFFAOYSA-N 0 3 409.452 4.380 20 0 HIADHN Cc1ccc(F)c(CN(C)C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)c1 ZINC000472457059 887313101 /nfs/dbraw/zinc/31/31/01/887313101.db2.gz UGBWYMRZHBFVSH-UHFFFAOYSA-N 0 3 401.448 4.081 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N1CC[C@@H](Cc2ccccc2)C1 ZINC000472461455 887319834 /nfs/dbraw/zinc/31/98/34/887319834.db2.gz ZNIINGBKLKARJM-KKXNLOMOSA-N 0 3 409.496 4.066 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)N[C@@H](c2ccc(C)cc2)c2ccccn2)o1 ZINC000472471298 887331582 /nfs/dbraw/zinc/33/15/82/887331582.db2.gz SEAJKRAEAACOEA-QHCPKHFHSA-N 0 3 406.530 4.154 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)N[C@H](c2ccc(C)cc2)c2ccccn2)o1 ZINC000472471297 887331839 /nfs/dbraw/zinc/33/18/39/887331839.db2.gz SEAJKRAEAACOEA-HSZRJFAPSA-N 0 3 406.530 4.154 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)[C@@H](C)CC(=O)c3ccc(Cl)cc3)c2)CC1 ZINC000472731590 887579749 /nfs/dbraw/zinc/57/97/49/887579749.db2.gz DLQHRYLOFBPWGZ-KRWDZBQOSA-N 0 3 413.949 4.330 20 0 HIADHN Cc1ccc(NC(=O)NC[C@H](c2ccccc2)N(C)C)c(-c2nc(C3CC3)no2)c1 ZINC000472841367 887694382 /nfs/dbraw/zinc/69/43/82/887694382.db2.gz SCWJISUGAFZNHL-HXUWFJFHSA-N 0 3 405.502 4.347 20 0 HIADHN CN(C)[C@H](CNC(=O)Nc1ccc(F)cc1-c1nc(C2CC2)no1)c1ccccc1 ZINC000472933520 887783927 /nfs/dbraw/zinc/78/39/27/887783927.db2.gz YWRYHFRNKCRPPP-LJQANCHMSA-N 0 3 409.465 4.178 20 0 HIADHN O=C(CCN1CC[C@]2(C1)OCc1ccccc12)N[C@H](c1cccs1)c1ccccc1 ZINC000473155589 887932757 /nfs/dbraw/zinc/93/27/57/887932757.db2.gz AWBHWPFSKKEXTM-LOSJGSFVSA-N 0 3 418.562 4.475 20 0 HIADHN O=C(N1CCO[C@H](c2cccs2)C1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000473181727 887961794 /nfs/dbraw/zinc/96/17/94/887961794.db2.gz JQYXVHOZZMKBBT-PXNSSMCTSA-N 0 3 424.488 4.103 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3cc(C(C)=O)cs3)c(OCC)c2)CC1 ZINC000473224364 887998811 /nfs/dbraw/zinc/99/88/11/887998811.db2.gz FFGPEGTUUUDSIU-UHFFFAOYSA-N 0 3 415.559 4.134 20 0 HIADHN C[C@H](CC(=O)N[C@H]1[C@H](C)CN(Cc2ccccc2)C[C@@H]1C)C(=O)c1cccc(F)c1 ZINC000473283399 888038467 /nfs/dbraw/zinc/03/84/67/888038467.db2.gz WZDXQSXAGBEMDC-FVJVTNMWSA-N 0 3 410.533 4.307 20 0 HIADHN O=C(CCC(=O)c1ccc2ccccc2c1)NC[C@H]1CCN(Cc2ccccc2)C1 ZINC000473298088 888049754 /nfs/dbraw/zinc/04/97/54/888049754.db2.gz HESKPCWTEHTFNJ-OAQYLSRUSA-N 0 3 400.522 4.441 20 0 HIADHN COc1ccc(C(=O)CC(C)(C)CC(=O)NC[C@@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000473309496 888057133 /nfs/dbraw/zinc/05/71/33/888057133.db2.gz UQESHGSWDQRUAK-NRFANRHFSA-N 0 3 422.569 4.323 20 0 HIADHN CCOc1ccc(CNC(=O)N(CCN(C)C)Cc2cccc(OC)c2)cc1Cl ZINC000504394449 913214988 /nfs/dbraw/zinc/21/49/88/913214988.db2.gz DTQGGLVTKZQRBL-UHFFFAOYSA-N 0 3 419.953 4.021 20 0 HIADHN C[C@@H](CCN1CCN(C)CC1)NC(=O)Nc1ccccc1Oc1ccccc1Cl ZINC000473499914 888225654 /nfs/dbraw/zinc/22/56/54/888225654.db2.gz VEWINDIGHYIKDT-KRWDZBQOSA-N 0 3 416.953 4.280 20 0 HIADHN O=C(CCC(=O)N1CC[C@]2(C1)CCCN(Cc1ccccc1)C2)c1ccc(F)cc1 ZINC000473504478 888231364 /nfs/dbraw/zinc/23/13/64/888231364.db2.gz JQZJFYNPVPPUMK-RUZDIDTESA-N 0 3 408.517 4.303 20 0 HIADHN O=C(Cc1ccccc1C(F)(F)F)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473512234 888240475 /nfs/dbraw/zinc/24/04/75/888240475.db2.gz JJFSRSUKQSKFMX-UHFFFAOYSA-N 0 3 408.386 4.169 20 0 HIADHN COc1cccc(-c2c[nH]cc2C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)c1 ZINC000473513022 888242397 /nfs/dbraw/zinc/24/23/97/888242397.db2.gz MAHKHNIWJWJLDT-UHFFFAOYSA-N 0 3 421.463 4.225 20 0 HIADHN Cc1nc(-c2ccccn2)sc1C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473516790 888249117 /nfs/dbraw/zinc/24/91/17/888249117.db2.gz DKPNTUOOEVNFNH-UHFFFAOYSA-N 0 3 424.492 4.049 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1csc(-c2cccs2)n1 ZINC000473518396 888249754 /nfs/dbraw/zinc/24/97/54/888249754.db2.gz LTAGJNHWFZRNFZ-UHFFFAOYSA-N 0 3 415.506 4.407 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)[C@@H]1CCC[C@H](C(F)(F)F)C1 ZINC000473518000 888250269 /nfs/dbraw/zinc/25/02/69/888250269.db2.gz KIXSMRBFQZJABA-WSYDAFBYSA-N 0 3 400.407 4.277 20 0 HIADHN CC(C)[C@@H](C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1ccc(F)cc1 ZINC000473521705 888256610 /nfs/dbraw/zinc/25/66/10/888256610.db2.gz RGXBDCYIIKIPDR-CTWPCTMYSA-N 0 3 400.460 4.487 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1cc(F)cc(Br)c1 ZINC000473523568 888258433 /nfs/dbraw/zinc/25/84/33/888258433.db2.gz MOHRMDKAXRAKII-UHFFFAOYSA-N 0 3 423.248 4.123 20 0 HIADHN O=C(CCc1ncc(-c2ccccc2)o1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473523130 888258983 /nfs/dbraw/zinc/25/89/83/888258983.db2.gz GLOCSHMQECQWPL-UHFFFAOYSA-N 0 3 421.463 4.196 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1cc(Cl)cc2cccnc21 ZINC000473525268 888261339 /nfs/dbraw/zinc/26/13/39/888261339.db2.gz YKZZCGFZQFJNQT-UHFFFAOYSA-N 0 3 411.855 4.423 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1ccc(Oc2cccnc2)cc1 ZINC000473525136 888262074 /nfs/dbraw/zinc/26/20/74/888262074.db2.gz OTFGYBVKRIOZIA-UHFFFAOYSA-N 0 3 419.447 4.409 20 0 HIADHN Cn1cc(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)c(C2CCCCC2)n1 ZINC000473527784 888265728 /nfs/dbraw/zinc/26/57/28/888265728.db2.gz SAUJZOIBMMCFBY-UHFFFAOYSA-N 0 3 412.500 4.003 20 0 HIADHN C[C@@H](CCN1CCN(C)CC1)NC(=O)Nc1ccc(Oc2cccc(Cl)c2)cc1 ZINC000473656421 888406729 /nfs/dbraw/zinc/40/67/29/888406729.db2.gz GHRLSEZWJYRYLD-KRWDZBQOSA-N 0 3 416.953 4.280 20 0 HIADHN C[C@@H](N[C@@H]1CCN(c2ccc(Cl)cc2Cl)C1=O)c1ccc(-n2ccnn2)cc1 ZINC000473680483 888447634 /nfs/dbraw/zinc/44/76/34/888447634.db2.gz VNUQHDOBPGPHNE-FZKQIMNGSA-N 0 3 416.312 4.030 20 0 HIADHN CC(C)Sc1c(Cl)cccc1NC(=O)NC(C)(C)CCN1CCN(C)CC1 ZINC000473704854 888482550 /nfs/dbraw/zinc/48/25/50/888482550.db2.gz GIYPEJWSPGJRHN-UHFFFAOYSA-N 0 3 413.031 4.378 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)CC3(CSc4ccccc4)CC3)CC2)C[C@H](C)O1 ZINC000473722150 888499614 /nfs/dbraw/zinc/49/96/14/888499614.db2.gz DICJWROSVMBQAI-PMACEKPBSA-N 0 3 416.631 4.297 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CCCCC[C@@H]3c3c(C)n[nH]c3C)c2)CC1 ZINC000473812401 888638540 /nfs/dbraw/zinc/63/85/40/888638540.db2.gz XXKJAEQFTCNAEL-JOCHJYFZSA-N 0 3 424.593 4.318 20 0 HIADHN Cc1c(NC(=O)N2CCC(CN3C[C@@H](C)O[C@H](C)C3)CC2)cccc1C(F)(F)F ZINC000473818272 888646943 /nfs/dbraw/zinc/64/69/43/888646943.db2.gz KQHZGFWAWMXLTH-HUUCEWRRSA-N 0 3 413.484 4.367 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)NC[C@H](C)c3ccc(F)cc3F)c2)CC1 ZINC000473818249 888647156 /nfs/dbraw/zinc/64/71/56/888647156.db2.gz NHPAHHQBVYMDIV-INIZCTEOSA-N 0 3 402.489 4.032 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@H]3CCOc4c(Cl)cccc43)c2)CC1 ZINC000473820658 888650443 /nfs/dbraw/zinc/65/04/43/888650443.db2.gz WJERVHUIQQDRJM-FQEVSTJZSA-N 0 3 414.937 4.127 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CCCCC[C@H]3c3ccncc3)c2)CC1 ZINC000473820368 888650573 /nfs/dbraw/zinc/65/05/73/888650573.db2.gz PEGAVFRZLXWVCW-QHCPKHFHSA-N 0 3 407.562 4.373 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)Nc3cnn(CC(C)C)c3C(F)F)c2)CC1 ZINC000473822659 888653545 /nfs/dbraw/zinc/65/35/45/888653545.db2.gz VFRIKAJWXLKUBE-UHFFFAOYSA-N 0 3 420.508 4.263 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)NC3(c4nc(C)cs4)CCCC3)c2)CC1 ZINC000473825159 888658636 /nfs/dbraw/zinc/65/86/36/888658636.db2.gz BZLGDAUBXANNPV-UHFFFAOYSA-N 0 3 413.591 4.184 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)NCc3cccc(-c4ccccn4)c3)c2)CC1 ZINC000473830241 888663524 /nfs/dbraw/zinc/66/35/24/888663524.db2.gz OXUMZESZYLIVEC-UHFFFAOYSA-N 0 3 415.541 4.212 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3C[C@H](C)C[C@H]3c3cccc(OC)c3)c2)CC1 ZINC000473831651 888667089 /nfs/dbraw/zinc/66/70/89/888667089.db2.gz WSCZQFORINCDOF-DVECYGJZSA-N 0 3 422.573 4.452 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)Nc3cnn(CC(C)C)c3C(C)C)c2)CC1 ZINC000473832870 888668160 /nfs/dbraw/zinc/66/81/60/888668160.db2.gz XFNIQWMAZFPNLM-UHFFFAOYSA-N 0 3 412.582 4.448 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)NCC[C@H](C)c3ccc(OC)cc3)c2)CC1 ZINC000473832529 888668194 /nfs/dbraw/zinc/66/81/94/888668194.db2.gz WIUZQTYVYUEKGH-IBGZPJMESA-N 0 3 410.562 4.152 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CCC[C@@H]3Cc3ccc(C)cc3)c2)CC1 ZINC000473838656 888678561 /nfs/dbraw/zinc/67/85/61/888678561.db2.gz YBLMJGMDTXICSZ-XMMPIXPASA-N 0 3 406.574 4.376 20 0 HIADHN COc1cccc(C(=O)c2ccc(C(=O)N3CCCN(C4CCCC4)CC3)cc2)c1 ZINC000473839970 888680296 /nfs/dbraw/zinc/68/02/96/888680296.db2.gz BPAPKCZTTUDVIQ-UHFFFAOYSA-N 0 3 406.526 4.017 20 0 HIADHN Cc1cc(S(=O)(=O)[N-]C2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)sc1Cl ZINC000473861325 888714300 /nfs/dbraw/zinc/71/43/00/888714300.db2.gz IWRFPFMCLVEROC-ALOPSCKCSA-N 0 3 410.992 4.184 20 0 HIADHN Cc1cc(S(=O)(=O)[N-]C2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)sc1Cl ZINC000473861325 888714313 /nfs/dbraw/zinc/71/43/13/888714313.db2.gz IWRFPFMCLVEROC-ALOPSCKCSA-N 0 3 410.992 4.184 20 0 HIADHN CN(C)[C@@H](CNC(=O)N[C@@H](c1cccc(Cl)c1)c1ccccn1)c1ccccc1 ZINC000473875290 888737436 /nfs/dbraw/zinc/73/74/36/888737436.db2.gz KZWDLWOPBULLFX-VXKWHMMOSA-N 0 3 408.933 4.427 20 0 HIADHN O=C(N[C@H](c1cccc(Cl)c1)c1ccccn1)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000473880791 888748104 /nfs/dbraw/zinc/74/81/04/888748104.db2.gz BQRUWGSAFSIBJZ-FYYLOGMGSA-N 0 3 420.944 4.398 20 0 HIADHN Cn1cc(CCNC(=O)NC[C@@H](c2cccs2)N2CCCC2)c2ccc(F)cc21 ZINC000473893384 888763244 /nfs/dbraw/zinc/76/32/44/888763244.db2.gz HDWKWEDGWCNDAA-FQEVSTJZSA-N 0 3 414.550 4.058 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)C3(Cc4ccccc4Cl)CC3)CC2)C[C@H](C)O1 ZINC000473921945 888802427 /nfs/dbraw/zinc/80/24/27/888802427.db2.gz KYIKFBRWLSTPKS-KDURUIRLSA-N 0 3 419.009 4.401 20 0 HIADHN O=C(Nc1ccccc1-c1cccs1)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1CO ZINC000473976841 888842330 /nfs/dbraw/zinc/84/23/30/888842330.db2.gz STIVVTGAYWZANB-TZIWHRDSSA-N 0 3 421.566 4.420 20 0 HIADHN C[C@H](NC(=O)NC[C@H](c1cccs1)N1CCCC1)c1ccc(Br)cn1 ZINC000473984857 888846293 /nfs/dbraw/zinc/84/62/93/888846293.db2.gz YPLICKRKVOYJOY-XJKSGUPXSA-N 0 3 423.380 4.103 20 0 HIADHN O=C1[C@@H](NCc2ccc(-n3ccnc3)cc2)CCN1c1ccc(Cl)cc1Cl ZINC000473988969 888850177 /nfs/dbraw/zinc/85/01/77/888850177.db2.gz JRPIONUYBLHXDS-SFHVURJKSA-N 0 3 401.297 4.074 20 0 HIADHN O=C1[C@H](NCc2cc(-n3ccnc3)cs2)CCN1c1ccc(Cl)cc1Cl ZINC000474007513 888865174 /nfs/dbraw/zinc/86/51/74/888865174.db2.gz JBYALIPWCXHLDV-MRXNPFEDSA-N 0 3 407.326 4.136 20 0 HIADHN COc1cccc(Cl)c1-c1noc(C)c1C(=O)NC[C@H](c1ccccc1)N(C)C ZINC000474208699 889047008 /nfs/dbraw/zinc/04/70/08/889047008.db2.gz DYSWRLFMUAHVBZ-QGZVFWFLSA-N 0 3 413.905 4.345 20 0 HIADHN CCOc1ccc([C@H]2CCCN2C(=O)CN2CC[C@@H](c3ccc(OC)cc3)C2)cc1 ZINC000504533933 913313585 /nfs/dbraw/zinc/31/35/85/913313585.db2.gz PFDNOHXGEYGQSJ-ZJSXRUAMSA-N 0 3 408.542 4.247 20 0 HIADHN CCO[C@H](C)c1noc(CN2CCN(C[C@H](CC(C)C)c3ccccc3)CC2)n1 ZINC000474267680 889130550 /nfs/dbraw/zinc/13/05/50/889130550.db2.gz NODZCXGLXSUVJC-CTNGQTDRSA-N 0 3 400.567 4.115 20 0 HIADHN CCN1CCN(Cc2ccc(CNC(=O)c3c(Cl)cccc3Cl)cc2)CC1 ZINC000474327668 889198433 /nfs/dbraw/zinc/19/84/33/889198433.db2.gz DLUYQIHVYFMDPH-UHFFFAOYSA-N 0 3 406.357 4.061 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N3CC=C(c4c(F)cccc4F)CC3)cc2)CC1 ZINC000474418487 889282455 /nfs/dbraw/zinc/28/24/55/889282455.db2.gz VRPVCHXUDVSZEC-UHFFFAOYSA-N 0 3 411.496 4.036 20 0 HIADHN C[C@@H](NC(=O)Nc1cccc(CN2CCCCC2=O)c1)[C@@H](c1ccccc1)N(C)C ZINC000474425965 889290207 /nfs/dbraw/zinc/29/02/07/889290207.db2.gz IRDOAECXHSUPOS-JPYJTQIMSA-N 0 3 408.546 4.012 20 0 HIADHN Cc1cc(Oc2ncccn2)ccc1NC(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C ZINC000474427374 889292638 /nfs/dbraw/zinc/29/26/38/889292638.db2.gz AJSIGEJADDEZKR-UWJYYQICSA-N 0 3 405.502 4.390 20 0 HIADHN COc1ccc([C@H](C)N[C@@H]2CCN([C@H](C(=O)OC(C)(C)C)c3ccccc3)C2=O)cc1 ZINC000474433820 889298954 /nfs/dbraw/zinc/29/89/54/889298954.db2.gz QQFMTPFDENZAGC-WTOYTKOKSA-N 0 3 424.541 4.030 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)CCCc2cccc(C(F)(F)F)c2)C[C@H](C)O1 ZINC000474495571 889356354 /nfs/dbraw/zinc/35/63/54/889356354.db2.gz MYGGGBXJDCCVDX-CALCHBBNSA-N 0 3 400.485 4.034 20 0 HIADHN CCCCn1cc(C(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)c(C)n1 ZINC000474531849 889403566 /nfs/dbraw/zinc/40/35/66/889403566.db2.gz ACVOYHYXJFSFCW-NRFANRHFSA-N 0 3 420.561 4.196 20 0 HIADHN COc1cc(NC(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)c(OC)cc1Cl ZINC000474540380 889416240 /nfs/dbraw/zinc/41/62/40/889416240.db2.gz NOPAGHOMBQBMAY-MRXNPFEDSA-N 0 3 403.910 4.095 20 0 HIADHN CN(C(=O)Nc1cccc(NC(=O)c2ccoc2)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000474593292 889461090 /nfs/dbraw/zinc/46/10/90/889461090.db2.gz REGSCBIASZCBOS-QFIPXVFZSA-N 0 3 418.497 4.270 20 0 HIADHN Cc1ccccc1-n1nccc1CNCCC(=O)Nc1ccc(Br)cc1 ZINC000474617142 889480321 /nfs/dbraw/zinc/48/03/21/889480321.db2.gz AAWHZLZVJREZPO-UHFFFAOYSA-N 0 3 413.319 4.062 20 0 HIADHN Cc1ccnc(-c2cccc(NC(=O)N(C)[C@H]3CCN(Cc4ccccc4)C3)c2)n1 ZINC000474616396 889480622 /nfs/dbraw/zinc/48/06/22/889480622.db2.gz SWWZFZVMLFSHGZ-QFIPXVFZSA-N 0 3 401.514 4.190 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)Nc1ncccc1-c1ccccc1 ZINC000504594973 913352626 /nfs/dbraw/zinc/35/26/26/913352626.db2.gz YYZQNEAXYDHFOP-UHFFFAOYSA-N 0 3 400.526 4.290 20 0 HIADHN Cc1cc(C)n(-c2ccccc2NC(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000474716798 889574330 /nfs/dbraw/zinc/57/43/30/889574330.db2.gz ZMFTVFSGZADRLG-NRFANRHFSA-N 0 3 403.530 4.227 20 0 HIADHN Cc1nc(-c2cccnc2)nc(NC2CCN(CCOc3ccc(F)cc3)CC2)c1C ZINC000474785176 889641594 /nfs/dbraw/zinc/64/15/94/889641594.db2.gz XAFUDMYZSRFIMJ-UHFFFAOYSA-N 0 3 421.520 4.250 20 0 HIADHN COc1cccc([C@@H](N[C@@H](C)C2CCS(=O)(=O)CC2)c2ccccc2Cl)c1 ZINC000474804454 889657011 /nfs/dbraw/zinc/65/70/11/889657011.db2.gz OUZKFGITLDTSGV-YCRPNKLZSA-N 0 3 407.963 4.241 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)C2(c3cccc(C(F)(F)F)c3)CCC2)CC1 ZINC000474872063 889726445 /nfs/dbraw/zinc/72/64/45/889726445.db2.gz HKVBEBSHYCXSFY-UHFFFAOYSA-N 0 3 412.496 4.133 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)c2ccccc2SCc2cscn2)CC1 ZINC000474880882 889736763 /nfs/dbraw/zinc/73/67/63/889736763.db2.gz GPZKSIAEVMYFBI-UHFFFAOYSA-N 0 3 419.616 4.055 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)c2csc(-c3ccc(Cl)cc3)n2)CC1 ZINC000474886147 889742334 /nfs/dbraw/zinc/74/23/34/889742334.db2.gz XGXXQSXDXIIRQU-UHFFFAOYSA-N 0 3 407.967 4.083 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)NCc2c(F)cccc2OC(F)F)CC1 ZINC000474991690 889844657 /nfs/dbraw/zinc/84/46/57/889844657.db2.gz NZHKEMBBDHXEOB-UHFFFAOYSA-N 0 3 421.463 4.233 20 0 HIADHN CCN(C(=O)Nc1ccc(C(=O)NC(C)(C)C)cc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000474997416 889849550 /nfs/dbraw/zinc/84/95/50/889849550.db2.gz FAAIVLOLLUYZEX-JOCHJYFZSA-N 0 3 422.573 4.343 20 0 HIADHN CCN(C(=O)Nc1ccccc1-c1nncn1CC)[C@H]1CCN(Cc2ccccc2)C1 ZINC000474999181 889850549 /nfs/dbraw/zinc/85/05/49/889850549.db2.gz FNTZANFIWZOVNV-FQEVSTJZSA-N 0 3 418.545 4.093 20 0 HIADHN CCN(C(=O)Nc1ccc(OCC(F)F)cc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475008492 889861990 /nfs/dbraw/zinc/86/19/90/889861990.db2.gz OGHBCKQAKXEWIF-IBGZPJMESA-N 0 3 403.473 4.459 20 0 HIADHN COc1ccc([C@H](CNC(=O)Nc2ccccc2OCC(F)F)N2CCCC2)cc1 ZINC000475041777 889893482 /nfs/dbraw/zinc/89/34/82/889893482.db2.gz HHBRAYJSVZHISM-IBGZPJMESA-N 0 3 419.472 4.298 20 0 HIADHN COc1ccc([C@@H](CNC(=O)Nc2ccccc2OCC(F)F)N2CCCC2)cc1 ZINC000475041778 889894025 /nfs/dbraw/zinc/89/40/25/889894025.db2.gz HHBRAYJSVZHISM-LJQANCHMSA-N 0 3 419.472 4.298 20 0 HIADHN O=C(NC(CCc1ccccc1)CCc1ccccc1)N1CC[C@H](N2CC=CC2)C1 ZINC000475069371 889914524 /nfs/dbraw/zinc/91/45/24/889914524.db2.gz YADGQANDEPPGJV-VWLOTQADSA-N 0 3 403.570 4.276 20 0 HIADHN CN(C(=O)NCCCCCOC1CCCCC1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475097999 889944403 /nfs/dbraw/zinc/94/44/03/889944403.db2.gz AOWUAASWVQCHAM-JOCHJYFZSA-N 0 3 401.595 4.422 20 0 HIADHN COc1ccc(-c2ccccc2)cc1CN(C)C[C@@H]1C[C@H](F)CN1Cc1ncccn1 ZINC000475098672 889945536 /nfs/dbraw/zinc/94/55/36/889945536.db2.gz UQZKSUDDZAYBEC-GOTSBHOMSA-N 0 3 420.532 4.197 20 0 HIADHN CN(C(=O)NC[C@@H]1CCCO[C@@H]1c1ccccc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475127333 889988612 /nfs/dbraw/zinc/98/86/12/889988612.db2.gz BFDQUHKGMZLXJB-RBZQAINGSA-N 0 3 407.558 4.070 20 0 HIADHN CC[C@@H](C)C(=O)Nc1cccc(CNC(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000475131504 889995020 /nfs/dbraw/zinc/99/50/20/889995020.db2.gz DFJBMQUARDIVRK-AUSIDOKSSA-N 0 3 422.573 4.087 20 0 HIADHN CCN(C(=O)NCCc1cccc2cccnc21)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475165839 890030870 /nfs/dbraw/zinc/03/08/70/890030870.db2.gz LZRIGRMYTOMUJT-QHCPKHFHSA-N 0 3 402.542 4.083 20 0 HIADHN CCN(C(=O)NCc1cc(Br)cs1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475179329 890049310 /nfs/dbraw/zinc/04/93/10/890049310.db2.gz BVTANDDGSCCMDZ-KRWDZBQOSA-N 0 3 422.392 4.317 20 0 HIADHN C[C@@H](NC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1)c1nc(C2CCCCC2)no1 ZINC000475269200 890163395 /nfs/dbraw/zinc/16/33/95/890163395.db2.gz KUGHXDUGMXTWFY-YLJYHZDGSA-N 0 3 411.550 4.094 20 0 HIADHN CCOc1cc(CN2CCC[C@@](C)(OC)C2)ccc1OCc1ccc(C(=O)OC)o1 ZINC000475291268 890195087 /nfs/dbraw/zinc/19/50/87/890195087.db2.gz NTCPOOOTAAJGJT-HSZRJFAPSA-N 0 3 417.502 4.045 20 0 HIADHN CCS(=O)(=O)c1c(Cl)cccc1CNCC1CCN(c2ccccc2)CC1 ZINC000475292701 890197385 /nfs/dbraw/zinc/19/73/85/890197385.db2.gz HJQWISUWNDXYFL-UHFFFAOYSA-N 0 3 406.979 4.140 20 0 HIADHN CC[C@@H](C)n1ncc2c1nc(C)cc2C(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475303425 890213469 /nfs/dbraw/zinc/21/34/69/890213469.db2.gz ICFJHKUFGOEMDY-UYAOXDASSA-N 0 3 405.546 4.057 20 0 HIADHN CN(C(=O)c1cc(NC(=O)C(C)(C)C)ccc1F)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475314144 890230211 /nfs/dbraw/zinc/23/02/11/890230211.db2.gz RSNURVDWFISLJX-LJQANCHMSA-N 0 3 411.521 4.157 20 0 HIADHN Cc1nc(CCC(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)oc1-c1ccccc1 ZINC000475316055 890231949 /nfs/dbraw/zinc/23/19/49/890231949.db2.gz KTBFIIVOUPKSIC-JOCHJYFZSA-N 0 3 403.526 4.316 20 0 HIADHN CC(C)n1ncc2c1nc(C1CC1)cc2C(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475322671 890242005 /nfs/dbraw/zinc/24/20/05/890242005.db2.gz QTRNRLHUBPAFST-HXUWFJFHSA-N 0 3 417.557 4.236 20 0 HIADHN COCCC[C@@H](Cc1ccccc1)[NH2+]Cc1cc(Br)c([O-])c(OC)c1 ZINC000475332750 890252900 /nfs/dbraw/zinc/25/29/00/890252900.db2.gz LKEUBQFJIMRRQH-KRWDZBQOSA-N 0 3 408.336 4.291 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)NCCOc1ncc(Cl)cc1Cl ZINC000475418131 890341503 /nfs/dbraw/zinc/34/15/03/890341503.db2.gz OYOFAINUJOSEHU-UHFFFAOYSA-N 0 3 408.285 4.005 20 0 HIADHN Cc1nc(CN(C)[C@H]2CCCN(Cc3cnc(-c4cccs4)s3)CC2)no1 ZINC000475614724 890543189 /nfs/dbraw/zinc/54/31/89/890543189.db2.gz HEYSAEJXYNHSBC-HNNXBMFYSA-N 0 3 403.577 4.050 20 0 HIADHN Cc1ccc(-n2cccn2)cc1NC(=O)N(CCCc1ccccc1)CCN(C)C ZINC000475656514 890601118 /nfs/dbraw/zinc/60/11/18/890601118.db2.gz PZRVDGOMZOZIEJ-UHFFFAOYSA-N 0 3 405.546 4.209 20 0 HIADHN COC(=O)c1ccc(-c2nc(CN3CCC[C@@]3(CO)Cc3ccccc3)cs2)cc1 ZINC000475672606 890617589 /nfs/dbraw/zinc/61/75/89/890617589.db2.gz MEQAPYJCZXNCHH-DEOSSOPVSA-N 0 3 422.550 4.166 20 0 HIADHN OC[C@]1(Cc2ccccc2)CCCN1Cc1nc(-c2ccc(C(F)(F)F)cc2)no1 ZINC000475684598 890625644 /nfs/dbraw/zinc/62/56/44/890625644.db2.gz BUBKTHNWYYZMLM-OAQYLSRUSA-N 0 3 417.431 4.325 20 0 HIADHN CCc1nnc(-c2ccc(NC(=O)N(CCN(C)C)Cc3cccc(F)c3)cc2)o1 ZINC000475704527 890641627 /nfs/dbraw/zinc/64/16/27/890641627.db2.gz HIXDFCLGLFKIMT-UHFFFAOYSA-N 0 3 411.481 4.034 20 0 HIADHN COc1cccc(CN(C)C(=O)CNC(C)(C)c2ccc(OC(F)(F)F)cc2)c1 ZINC000475722933 890661681 /nfs/dbraw/zinc/66/16/81/890661681.db2.gz UKJRHCMXHMLURZ-UHFFFAOYSA-N 0 3 410.436 4.077 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)CCN(C)[C@@H](C)c1ccc([S@](C)=O)cc1 ZINC000475743717 890686138 /nfs/dbraw/zinc/68/61/38/890686138.db2.gz KJZCXSHWKZPXGH-PWFNWSNSSA-N 0 3 408.951 4.108 20 0 HIADHN C[C@H](c1ccc([S@@](C)=O)cc1)N(C)CCc1nc(-c2ccc(Cl)cc2)no1 ZINC000475746133 890689522 /nfs/dbraw/zinc/68/95/22/890689522.db2.gz IHCFAZHMNIRYOA-LOKFHWFJSA-N 0 3 403.935 4.363 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N[C@H](C)c2cc(Cl)ccc2Cl)CC1 ZINC000475904281 890833679 /nfs/dbraw/zinc/83/36/79/890833679.db2.gz YDDBBUJGWGUIIW-CQSZACIVSA-N 0 3 402.366 4.243 20 0 HIADHN Cc1onc(-c2ccccc2C)c1C(=O)NCC1(N2CCSCC2)CCCCC1 ZINC000475930090 890854300 /nfs/dbraw/zinc/85/43/00/890854300.db2.gz NVJLRRURLFBGFJ-UHFFFAOYSA-N 0 3 413.587 4.440 20 0 HIADHN COc1ccc(-c2ccc(CNC(=O)N(CCN(C)C)Cc3ccccn3)s2)cc1 ZINC000475945411 890868101 /nfs/dbraw/zinc/86/81/01/890868101.db2.gz JCKPBGZDMKEPMC-UHFFFAOYSA-N 0 3 424.570 4.092 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N[C@H](c2ccc(Cl)cc2)[C@@H]2C[C@@H]2C)CC1 ZINC000476037604 890968345 /nfs/dbraw/zinc/96/83/45/890968345.db2.gz ZEVDPMPMWCKUGM-ZLGUVYLKSA-N 0 3 407.986 4.226 20 0 HIADHN O=C(N[C@@H]1CCc2ccccc2C1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000504792798 913516415 /nfs/dbraw/zinc/51/64/15/913516415.db2.gz IFKIIZGJBOXJDD-IRLDBZIGSA-N 0 3 402.460 4.115 20 0 HIADHN Cc1ccc(Cn2cccc(NC(=O)N[C@@H](C)[C@H](c3ccccc3)N(C)C)c2=O)cc1 ZINC000476140138 891061738 /nfs/dbraw/zinc/06/17/38/891061738.db2.gz IIEYZQIBKKRYSE-WMZHIEFXSA-N 0 3 418.541 4.018 20 0 HIADHN Cc1ccc(Cn2cccc(NC(=O)N[C@H](C)[C@@H](c3ccccc3)N(C)C)c2=O)cc1 ZINC000476140147 891062506 /nfs/dbraw/zinc/06/25/06/891062506.db2.gz IIEYZQIBKKRYSE-XXBNENTESA-N 0 3 418.541 4.018 20 0 HIADHN C[C@H](NC(=O)N(C)[C@H]1CCN(C2CC2)C1)c1ccc(NC(=O)c2ccc(F)cc2)cc1 ZINC000476152448 891075758 /nfs/dbraw/zinc/07/57/58/891075758.db2.gz MBEAIEKQAZOAOA-AOMKIAJQSA-N 0 3 424.520 4.017 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)Nc1ccc(OCC2CCOCC2)cc1)c1ccco1 ZINC000476162258 891088365 /nfs/dbraw/zinc/08/83/65/891088365.db2.gz QABVSCUJTQBJFB-UTKZUKDTSA-N 0 3 415.534 4.336 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)C(C)(C)c2cccc(Cl)c2F)CC1 ZINC000476258517 891181422 /nfs/dbraw/zinc/18/14/22/891181422.db2.gz PVTGTTWEYXYGBL-HNNXBMFYSA-N 0 3 403.929 4.494 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)[C@@H]1CCCc2c(O)cccc21 ZINC000476334481 891239083 /nfs/dbraw/zinc/23/90/83/891239083.db2.gz PYCHDWWPYJUKGD-DENIHFKCSA-N 0 3 416.525 4.094 20 0 HIADHN COc1ccc([C@H]2CCCCCN2C(=O)NC2CCN(CCOC(C)C)CC2)cc1 ZINC000476437252 891349696 /nfs/dbraw/zinc/34/96/96/891349696.db2.gz QQWIQSFQNLLUED-HSZRJFAPSA-N 0 3 417.594 4.211 20 0 HIADHN Cc1ccc([C@@H]2CCC[C@@H]2N(C)C(=O)NC2CCN(CCOC(C)C)CC2)cc1 ZINC000476456254 891367420 /nfs/dbraw/zinc/36/74/20/891367420.db2.gz YWDKEHQZXFVELN-GOTSBHOMSA-N 0 3 401.595 4.162 20 0 HIADHN Cc1ccc([C@H]2[C@H](C)CCCN2C(=O)NC2CCN(CCOC(C)C)CC2)cc1 ZINC000476455761 891368350 /nfs/dbraw/zinc/36/83/50/891368350.db2.gz XRHSFQJZZOCSOB-NFBKMPQASA-N 0 3 401.595 4.367 20 0 HIADHN CC[C@@H](Cc1ccc(C)cc1)N(CC)C(=O)NC1CCN(CCOC(C)C)CC1 ZINC000476456238 891368634 /nfs/dbraw/zinc/36/86/34/891368634.db2.gz YRLYXZIUSMITHA-QHCPKHFHSA-N 0 3 403.611 4.237 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N(Cc2c(F)cccc2F)C2CCCC2)CC1 ZINC000476462824 891375743 /nfs/dbraw/zinc/37/57/43/891375743.db2.gz QZKYQVGFHGFWMR-UHFFFAOYSA-N 0 3 423.548 4.308 20 0 HIADHN COc1cc(F)c(NC(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)cc1F ZINC000476623441 891559334 /nfs/dbraw/zinc/55/93/34/891559334.db2.gz HAMIMXDUFCCMNC-IBGZPJMESA-N 0 3 407.461 4.185 20 0 HIADHN CN(C(=O)NC[C@@H](c1c[nH]c2ccccc21)c1ccccc1)[C@H]1CCN(C2CC2)C1 ZINC000476654286 891597374 /nfs/dbraw/zinc/59/73/74/891597374.db2.gz LCCUEKSIVLDFKB-RBBKRZOGSA-N 0 3 402.542 4.178 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CC[C@@](F)(c4ccccc4C)C3)c2)CC1 ZINC000504850132 913576304 /nfs/dbraw/zinc/57/63/04/913576304.db2.gz BUWQNJSVTJPWFC-DEOSSOPVSA-N 0 3 410.537 4.240 20 0 HIADHN CCc1onc(-c2ccccc2)c1C(=O)Nc1cccc(N2CCN(CC)CC2)c1 ZINC000476720473 891683566 /nfs/dbraw/zinc/68/35/66/891683566.db2.gz IBLVIOFUCYJJDY-UHFFFAOYSA-N 0 3 404.514 4.298 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)c3c(C)onc3-c3ccccc3C)c2)CC1 ZINC000476729776 891696765 /nfs/dbraw/zinc/69/67/65/891696765.db2.gz URMBCBKVJAEART-UHFFFAOYSA-N 0 3 404.514 4.353 20 0 HIADHN CN(C)Cc1cccc(NC(=O)c2cc(N3CCCC3=O)cc(C(F)(F)F)c2)c1 ZINC000476730114 891697701 /nfs/dbraw/zinc/69/77/01/891697701.db2.gz DHCOPVRJVKFKTE-UHFFFAOYSA-N 0 3 405.420 4.146 20 0 HIADHN CC1(C)CCC[C@@H]1C(=O)NC1CCN(CCOc2ccc(Br)cc2)CC1 ZINC000476755799 891726971 /nfs/dbraw/zinc/72/69/71/891726971.db2.gz NXMKJCLWAMBGOE-LJQANCHMSA-N 0 3 423.395 4.235 20 0 HIADHN CCCc1nc(C)c(C(=O)Nc2ccc(N3CCN(CCC)CC3)cc2OCC)o1 ZINC000504870683 913598829 /nfs/dbraw/zinc/59/88/29/913598829.db2.gz OSRAFJFPJCBJOS-UHFFFAOYSA-N 0 3 414.550 4.119 20 0 HIADHN O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)N1CC=C(c2c[nH]c3ncccc23)CC1 ZINC000504884235 913615042 /nfs/dbraw/zinc/61/50/42/913615042.db2.gz ZLEKBXJNRWEXNZ-OAQYLSRUSA-N 0 3 415.541 4.026 20 0 HIADHN CC(=O)c1c(C)[nH]c(C(=O)[C@H](C)N2CC[C@]3(C2)CCCN(Cc2ccccc2)C3)c1C ZINC000477059693 891993284 /nfs/dbraw/zinc/99/32/84/891993284.db2.gz CFJYKENQEIWUAR-RXFWQSSRSA-N 0 3 421.585 4.393 20 0 HIADHN Cc1nc(-c2ccc(CNC(=O)N[C@@H]3CCCN(Cc4ccccc4)C3)o2)cs1 ZINC000504888177 913619740 /nfs/dbraw/zinc/61/97/40/913619740.db2.gz HNMYGOHGSSKHPL-GOSISDBHSA-N 0 3 410.543 4.175 20 0 HIADHN CCOc1ccc(Oc2ccc(NC(=O)NC[C@@H]3CCCN3CCOC)cc2)cc1 ZINC000477133596 892061075 /nfs/dbraw/zinc/06/10/75/892061075.db2.gz MSPBECAOQXJRLS-IBGZPJMESA-N 0 3 413.518 4.110 20 0 HIADHN CC[C@H](c1ccccc1)[C@@H]1CCCN1Cc1ccc(S(=O)(=O)N2CCCC2)o1 ZINC000477184845 892105389 /nfs/dbraw/zinc/10/53/89/892105389.db2.gz DUSMQKIXNRLAKZ-RTWAWAEBSA-N 0 3 402.560 4.222 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCc3ncoc3-c3ccccc3)c(C)c2)CC1 ZINC000477327184 892296234 /nfs/dbraw/zinc/29/62/34/892296234.db2.gz DXIUPYZPXQJFNM-UHFFFAOYSA-N 0 3 419.529 4.114 20 0 HIADHN Cc1cc(Br)ccc1CNC(=O)N(CCN(C)C)Cc1ccc(F)cc1 ZINC000477340426 892309110 /nfs/dbraw/zinc/30/91/10/892309110.db2.gz KEHGGKPCUTZZII-UHFFFAOYSA-N 0 3 422.342 4.170 20 0 HIADHN CN(Cc1ccc(OC(F)F)cc1)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000504922416 913658789 /nfs/dbraw/zinc/65/87/89/913658789.db2.gz ATKWAFXXVXYSAU-IBGZPJMESA-N 0 3 403.473 4.094 20 0 HIADHN Cc1ccc2c(C3=CCN(S(=O)(=O)c4ccc(CN(C)C)cc4)CC3)c[nH]c2c1 ZINC000477540921 892578310 /nfs/dbraw/zinc/57/83/10/892578310.db2.gz WQQVBORSAOMCRD-UHFFFAOYSA-N 0 3 409.555 4.016 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)N[C@H](C)c2ccc(C(F)(F)F)cc2)cc1 ZINC000477623186 892730161 /nfs/dbraw/zinc/73/01/61/892730161.db2.gz QPWNGUBDXMDPBI-AUUYWEPGSA-N 0 3 409.452 4.377 20 0 HIADHN Cc1nn(C)c(C)c1NC(=O)CNC1(c2cccc(C(F)(F)F)c2)CCCCC1 ZINC000477640495 892763256 /nfs/dbraw/zinc/76/32/56/892763256.db2.gz LUHRTJHDYIGHME-UHFFFAOYSA-N 0 3 408.468 4.443 20 0 HIADHN C[C@@H](c1cc2ccccc2o1)N(C)C(=O)NCC1(N2CCSCC2)CCCC1 ZINC000504959979 913698065 /nfs/dbraw/zinc/69/80/65/913698065.db2.gz RZOIEKLXYLTMRP-KRWDZBQOSA-N 0 3 401.576 4.497 20 0 HIADHN Cc1cccc2c(CCC(=O)Nc3cccc(CN4CCC(CO)CC4)c3)c[nH]c21 ZINC000477722500 892826433 /nfs/dbraw/zinc/82/64/33/892826433.db2.gz UUXSETISFRZZPK-UHFFFAOYSA-N 0 3 405.542 4.252 20 0 HIADHN CN(C)C[C@H](NC(=O)Nc1cc(F)c(Br)cc1F)c1ccc(F)cc1 ZINC000477733328 892831775 /nfs/dbraw/zinc/83/17/75/892831775.db2.gz CAWOJLQBTDCINW-INIZCTEOSA-N 0 3 416.241 4.291 20 0 HIADHN O=C(COc1c(Cl)cccc1Cl)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000477744181 892838768 /nfs/dbraw/zinc/83/87/68/892838768.db2.gz OCZZAAONJMNGQX-UHFFFAOYSA-N 0 3 423.340 4.215 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N2CCC[C@@H]2c2ccc3c(c2)OCO3)C1 ZINC000477746104 892840632 /nfs/dbraw/zinc/84/06/32/892840632.db2.gz FMAJCEVQVRIBTH-DUXKGJEZSA-N 0 3 407.514 4.097 20 0 HIADHN Cc1cc(C(=O)Nc2cccc(CN3CCC(CO)CC3)c2)c(Br)s1 ZINC000477747351 892841378 /nfs/dbraw/zinc/84/13/78/892841378.db2.gz OVVGTRLSPIWZIF-UHFFFAOYSA-N 0 3 423.376 4.276 20 0 HIADHN Cc1oc(-c2ccccc2)nc1C(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000477749815 892842284 /nfs/dbraw/zinc/84/22/84/892842284.db2.gz VXCUMZXPQBEDIH-UHFFFAOYSA-N 0 3 405.498 4.107 20 0 HIADHN O=C(CSc1ccc2c(c1)CCC2)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000477749842 892842603 /nfs/dbraw/zinc/84/26/03/892842603.db2.gz WAPMUXUIPICLJA-UHFFFAOYSA-N 0 3 410.583 4.110 20 0 HIADHN CC(C)(C)[C@@H](CN1CCc2ccccc2C1)NC(=O)Nc1nnc(C(F)F)s1 ZINC000477764861 892852905 /nfs/dbraw/zinc/85/29/05/892852905.db2.gz IAQOBRXFPNKGLH-CQSZACIVSA-N 0 3 409.506 4.070 20 0 HIADHN CC(=O)N(C)c1cccc(NC(=O)N[C@@H](CN2CCc3ccccc3C2)C(C)(C)C)c1 ZINC000477779202 892862795 /nfs/dbraw/zinc/86/27/95/892862795.db2.gz IASDKCVWLVBCDZ-QHCPKHFHSA-N 0 3 422.573 4.264 20 0 HIADHN Cc1nc(CCNC(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)sc1C ZINC000477814574 892883768 /nfs/dbraw/zinc/88/37/68/892883768.db2.gz AAKWXMZJKZYTFE-KRWDZBQOSA-N 0 3 406.621 4.136 20 0 HIADHN Cc1c(NC(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)cnn1CCC(C)C ZINC000477823311 892889575 /nfs/dbraw/zinc/88/95/75/892889575.db2.gz LJURGWYVGYTNQT-QFIPXVFZSA-N 0 3 415.582 4.449 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)Nc1ccc(OC(F)(F)F)cc1 ZINC000504970900 913709961 /nfs/dbraw/zinc/70/99/61/913709961.db2.gz KVQOSBBSVGFNQL-UHFFFAOYSA-N 0 3 403.470 4.068 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)NCc2ccccc2OC(F)F)N(C)C)cc1 ZINC000477851005 892909854 /nfs/dbraw/zinc/90/98/54/892909854.db2.gz MFUPRCSTELUGOZ-IBGZPJMESA-N 0 3 421.488 4.177 20 0 HIADHN C[C@H](NC(=O)NCc1ccc(COCC(F)(F)F)cc1)[C@H](c1ccccc1)N(C)C ZINC000477853920 892912874 /nfs/dbraw/zinc/91/28/74/892912874.db2.gz YNFIZEQZKDWEBZ-OXJNMPFZSA-N 0 3 423.479 4.256 20 0 HIADHN C[C@H](NC(=O)NCc1ccc(COCC(F)(F)F)cc1)[C@@H](c1ccccc1)N(C)C ZINC000477853919 892913988 /nfs/dbraw/zinc/91/39/88/892913988.db2.gz YNFIZEQZKDWEBZ-JXFKEZNVSA-N 0 3 423.479 4.256 20 0 HIADHN C[C@@H](NC(=O)N[C@@H](C)c1nc2ccccc2n1C(F)F)[C@H](c1ccccc1)N(C)C ZINC000477877585 892939375 /nfs/dbraw/zinc/93/93/75/892939375.db2.gz KQXMHFMPDNOMRK-ZRGWGRIASA-N 0 3 415.488 4.483 20 0 HIADHN C[C@H](NC(=O)NCc1ccc(OCC(F)(F)F)cc1)[C@@H](c1ccccc1)N(C)C ZINC000477902779 892975455 /nfs/dbraw/zinc/97/54/55/892975455.db2.gz BFEUHIJQISJBEC-KXBFYZLASA-N 0 3 409.452 4.118 20 0 HIADHN Cc1ccc(CN2CC[C@@H](N[C@H](C)CC(=O)Nc3ccc(C)cc3Cl)C2=O)cc1 ZINC000477917342 893000804 /nfs/dbraw/zinc/00/08/04/893000804.db2.gz NSLVMJXIURFTEM-DYESRHJHSA-N 0 3 413.949 4.065 20 0 HIADHN CN(C)[C@@H](CNC(=O)Nc1ccc(OCC(F)(F)F)c(F)c1)Cc1ccccc1 ZINC000504982914 913725073 /nfs/dbraw/zinc/72/50/73/913725073.db2.gz LFTGEJCPARLTMK-MRXNPFEDSA-N 0 3 413.415 4.061 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1cc(OC)cc(OC)c1C)c1cccc(OC)c1 ZINC000504988053 913732270 /nfs/dbraw/zinc/73/22/70/913732270.db2.gz HDIJHPWPRUKUEW-NRFANRHFSA-N 0 3 415.534 4.225 20 0 HIADHN CCCN(C(=O)c1ccc(N2CCOCC2)cc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000505001190 913746107 /nfs/dbraw/zinc/74/61/07/913746107.db2.gz PPKUATGVIIUSTD-VWLOTQADSA-N 0 3 421.585 4.040 20 0 HIADHN Cc1noc(-c2ccccc2)c1NC(=O)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000478078142 893241616 /nfs/dbraw/zinc/24/16/16/893241616.db2.gz DGQQFJJXZHHMQP-UHFFFAOYSA-N 0 3 405.498 4.107 20 0 HIADHN Cc1n[nH]c(C)c1CC(=O)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000478190847 893354288 /nfs/dbraw/zinc/35/42/88/893354288.db2.gz PTJAZKXDXVRVBI-UHFFFAOYSA-N 0 3 409.361 4.000 20 0 HIADHN CCCN(C(=O)CCCNC(=O)c1ccccc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000505024702 913763836 /nfs/dbraw/zinc/76/38/36/913763836.db2.gz VLKYDHLEIAZXHN-DEOSSOPVSA-N 0 3 421.585 4.100 20 0 HIADHN O=S(=O)(C1CC1)N1CCC(NCc2c(Cl)cccc2Oc2ccccc2)CC1 ZINC000478273502 893468844 /nfs/dbraw/zinc/46/88/44/893468844.db2.gz NCIRGEXOZSVDLE-UHFFFAOYSA-N 0 3 420.962 4.179 20 0 HIADHN CN1C[C@@H](c2ccccc2)[C@H](NC(=O)COC(c2ccccc2)c2ccccc2)C1 ZINC000478449643 893763734 /nfs/dbraw/zinc/76/37/34/893763734.db2.gz MHHJUIWCXIXCNH-BJKOFHAPSA-N 0 3 400.522 4.007 20 0 HIADHN CN1C[C@H](NC(=O)COC(c2ccccc2)c2ccccc2)[C@H](c2ccccc2)C1 ZINC000478449650 893763787 /nfs/dbraw/zinc/76/37/87/893763787.db2.gz MHHJUIWCXIXCNH-ZEQRLZLVSA-N 0 3 400.522 4.007 20 0 HIADHN CCOc1ccccc1-c1cccc(C(=O)N2CCN(c3ccncc3OC)CC2)c1 ZINC000478452774 893769309 /nfs/dbraw/zinc/76/93/09/893769309.db2.gz DPZNLNMDWPKTLF-UHFFFAOYSA-N 0 3 417.509 4.118 20 0 HIADHN CCc1c(C(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)cnn1C(CC)CC ZINC000478477343 893802843 /nfs/dbraw/zinc/80/28/43/893802843.db2.gz FIHSGUOBCTTYMX-RTBURBONSA-N 0 3 418.626 4.158 20 0 HIADHN COc1cnccc1N1CCN(C(=O)c2cc(C)c(-c3ccc(F)cc3)s2)CC1 ZINC000478488383 893808926 /nfs/dbraw/zinc/80/89/26/893808926.db2.gz ZOMZKZWNPDWHMT-UHFFFAOYSA-N 0 3 411.502 4.229 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3ccc(C)c(-c4nc(C)co4)c3)cc2)CC1 ZINC000478489150 893809779 /nfs/dbraw/zinc/80/97/79/893809779.db2.gz KYLAKRPYUMHNDN-UHFFFAOYSA-N 0 3 404.514 4.353 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)N[C@H](c2nc3ccccc3[nH]2)C(C)C)c1 ZINC000478491112 893810340 /nfs/dbraw/zinc/81/03/40/893810340.db2.gz LGAFQGOAQSABSN-QFIPXVFZSA-N 0 3 423.561 4.042 20 0 HIADHN CCCN(C)[C@H](CNC(=O)Nc1c(C)nn(CCOC)c1C)c1ccc(Cl)cc1 ZINC000478605365 893870680 /nfs/dbraw/zinc/87/06/80/893870680.db2.gz SHQXGVJEBUUXHE-LJQANCHMSA-N 0 3 421.973 4.004 20 0 HIADHN CCOc1c(Cl)cccc1CC(=O)Nc1ccc(CN2CCN(CC)CC2)cc1 ZINC000478673623 893924295 /nfs/dbraw/zinc/92/42/95/893924295.db2.gz IWDCCDYSAFSNHW-UHFFFAOYSA-N 0 3 415.965 4.057 20 0 HIADHN CC(C)(COCc1ccccc1)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000505105856 913819563 /nfs/dbraw/zinc/81/95/63/913819563.db2.gz WRWNHMUOLZOQJX-UHFFFAOYSA-N 0 3 412.496 4.151 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1ccc(Cl)cc1Br ZINC000478753648 894030195 /nfs/dbraw/zinc/03/01/95/894030195.db2.gz LIVHVZILNMQWKE-UHFFFAOYSA-N 0 3 400.704 4.291 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)N[C@@H](C)c2ccccc2OC(F)F)c1 ZINC000478763231 894037921 /nfs/dbraw/zinc/03/79/21/894037921.db2.gz FTMXNDUDSRKTAB-INIZCTEOSA-N 0 3 421.488 4.131 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)NCc1cccc(NC(=O)c2ccccc2)c1 ZINC000478905300 894186726 /nfs/dbraw/zinc/18/67/26/894186726.db2.gz RXWZQMHCJASNIM-UHFFFAOYSA-N 0 3 422.573 4.346 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)NCc2cc(Br)cs2)N(C)C)cc1 ZINC000505155950 913848040 /nfs/dbraw/zinc/84/80/40/913848040.db2.gz BHBXUMQZISVNBK-QGZVFWFLSA-N 0 3 410.381 4.175 20 0 HIADHN C[C@@H](NCCOc1cccc(Br)c1)c1ccc(Br)cn1 ZINC000479058839 894317550 /nfs/dbraw/zinc/31/75/50/894317550.db2.gz KGIDQNHDZXLSKK-LLVKDONJSA-N 0 3 400.114 4.336 20 0 HIADHN C[C@@H](NC(=O)Nc1cccc2c1CN(c1ccccn1)C2)[C@@H](c1ccccc1)N(C)C ZINC000479062998 894323269 /nfs/dbraw/zinc/32/32/69/894323269.db2.gz YYLVQGCCDQZHAU-KOSHJBKYSA-N 0 3 415.541 4.415 20 0 HIADHN C[C@H](NCC1(c2cccc(F)c2)CC1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479063132 894324750 /nfs/dbraw/zinc/32/47/50/894324750.db2.gz BWSIMLVNCDONMV-NSHDSACASA-N 0 3 417.333 4.162 20 0 HIADHN Cc1cc(C)c(S(N)(=O)=O)cc1[C@@H](C)N[C@H](C)c1ccc(Br)cc1 ZINC000479066187 894328625 /nfs/dbraw/zinc/32/86/25/894328625.db2.gz KIKQEUYAOYGRQQ-ZIAGYGMSSA-N 0 3 411.365 4.125 20 0 HIADHN C[C@H](NCCCc1cccc(F)c1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479067202 894330918 /nfs/dbraw/zinc/33/09/18/894330918.db2.gz VOTQAVYXHDJHAV-NSHDSACASA-N 0 3 405.322 4.063 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)Nc2cncc(Br)c2)N(C)C)cc1 ZINC000479076733 894341792 /nfs/dbraw/zinc/34/17/92/894341792.db2.gz DPVCLCOCMROEAF-GOSISDBHSA-N 0 3 421.339 4.056 20 0 HIADHN O=C1CCCN1Cc1ccc(CN[C@@H]2CCCc3nn(-c4ccccc4)cc32)cc1 ZINC000479330795 894623714 /nfs/dbraw/zinc/62/37/14/894623714.db2.gz MGFJDNHGSKGJHL-HSZRJFAPSA-N 0 3 400.526 4.162 20 0 HIADHN Cc1cc(C)c(S(N)(=O)=O)cc1[C@@H](C)N[C@H](C)c1ccc(C(F)(F)F)cc1 ZINC000479332238 894626052 /nfs/dbraw/zinc/62/60/52/894626052.db2.gz SLOBOJMAZGVAFV-ZIAGYGMSSA-N 0 3 400.466 4.381 20 0 HIADHN CS(=O)(=O)Cc1ccc(CN[C@@H]2CCCc3cc(Br)ccc32)cc1 ZINC000479331894 894626146 /nfs/dbraw/zinc/62/61/46/894626146.db2.gz SCQSNMXIMXRVDL-LJQANCHMSA-N 0 3 408.361 4.161 20 0 HIADHN CCCN(C(=O)CCCN1CCN(c2ccccc2)CC1)[C@H]1CCCc2cccnc21 ZINC000479345626 894641196 /nfs/dbraw/zinc/64/11/96/894641196.db2.gz CNODWCAXNXBFSH-DEOSSOPVSA-N 0 3 420.601 4.300 20 0 HIADHN CC1(C)C[C@@H](NCc2cccc(NS(C)(=O)=O)c2)c2cc(Br)ccc21 ZINC000479355542 894652352 /nfs/dbraw/zinc/65/23/52/894652352.db2.gz DCYIKUHRYCOCLG-GOSISDBHSA-N 0 3 423.376 4.333 20 0 HIADHN COc1ccc(-c2ccncc2)cc1CNc1ccccc1CN1CCC(O)CC1 ZINC000479373739 894675143 /nfs/dbraw/zinc/67/51/43/894675143.db2.gz VGLJDJQKYFNAQK-UHFFFAOYSA-N 0 3 403.526 4.326 20 0 HIADHN COc1ccc(CN2CCCN(Cc3ccc(OC)c(OC(F)F)c3)CC2)cc1 ZINC000505229557 913894610 /nfs/dbraw/zinc/89/46/10/913894610.db2.gz JCFMVMUOVDSWKC-UHFFFAOYSA-N 0 3 406.473 4.013 20 0 HIADHN O[C@H](COC(c1ccccc1)c1ccccc1)CN1CCC[C@H](c2nccs2)C1 ZINC000505233468 913896063 /nfs/dbraw/zinc/89/60/63/913896063.db2.gz NYOWFFHTPPKCFL-VXKWHMMOSA-N 0 3 408.567 4.490 20 0 HIADHN CCC(CC)[C@H](CCN[C@@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl)OC ZINC000479421844 894733046 /nfs/dbraw/zinc/73/30/46/894733046.db2.gz SJBPRXNUFCTXHO-ZBEGNZNMSA-N 0 3 411.395 4.133 20 0 HIADHN CCc1nc2c(s1)[C@H](N(C)C(=O)N[C@@H]1CCCN(Cc3ccccc3)C1)CCC2 ZINC000479426656 894739843 /nfs/dbraw/zinc/73/98/43/894739843.db2.gz RNQDTWRWCYFZEQ-UYAOXDASSA-N 0 3 412.603 4.389 20 0 HIADHN CCS(=O)(=O)c1c(Cl)cccc1CNC[C@@H](c1ccccc1)C(C)(C)CO ZINC000479436198 894751565 /nfs/dbraw/zinc/75/15/65/894751565.db2.gz JDXQOESVVKSGPI-SFHVURJKSA-N 0 3 409.979 4.026 20 0 HIADHN CCc1nc2c(s1)[C@@H](N(C)C(=O)NCCCN1CCc3ccccc3C1)CCC2 ZINC000479442256 894756356 /nfs/dbraw/zinc/75/63/56/894756356.db2.gz WGXGIGXLTUOTIZ-FQEVSTJZSA-N 0 3 412.603 4.173 20 0 HIADHN CCc1nc2c(s1)[C@H](N(C)C(=O)NCCCN1CCc3ccccc3C1)CCC2 ZINC000479442258 894756708 /nfs/dbraw/zinc/75/67/08/894756708.db2.gz WGXGIGXLTUOTIZ-HXUWFJFHSA-N 0 3 412.603 4.173 20 0 HIADHN CS(=O)(=O)C1(CN[C@@H]2CCCc3nc(-c4ccc(Cl)cc4)sc32)CCC1 ZINC000479477031 894800264 /nfs/dbraw/zinc/80/02/64/894800264.db2.gz QWZYDADJVFYGCZ-OAHLLOKOSA-N 0 3 410.992 4.398 20 0 HIADHN CC[C@@H](NCC1(S(C)(=O)=O)CC1)c1ccc(Br)cc1C(F)(F)F ZINC000479494867 894814491 /nfs/dbraw/zinc/81/44/91/894814491.db2.gz DSXJFPZCVGAQFI-CYBMUJFWSA-N 0 3 414.287 4.086 20 0 HIADHN Cc1cc2[nH]c(CNCc3ccc(S(=O)(=O)N4CCCCC4)cc3)cc2c(C)c1 ZINC000479540568 894843669 /nfs/dbraw/zinc/84/36/69/894843669.db2.gz GFCJUFGAWBICPZ-UHFFFAOYSA-N 0 3 411.571 4.249 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3CCc4cc(Cl)ccc4C3)c(C)c2)CC1 ZINC000479550984 894849982 /nfs/dbraw/zinc/84/99/82/894849982.db2.gz BUWXWTOHYYHOTG-UHFFFAOYSA-N 0 3 412.965 4.381 20 0 HIADHN CCS(=O)(=O)c1c(Cl)cccc1CNC[C@@H]1CCCO[C@H]1c1ccccc1 ZINC000479557019 894855765 /nfs/dbraw/zinc/85/57/65/894855765.db2.gz SBHMGBJGIUZWAO-PXNSSMCTSA-N 0 3 407.963 4.391 20 0 HIADHN CC(C)(O)CN1CCc2c(cccc2NC(=O)Nc2ccc(Br)cc2)C1 ZINC000479659305 894934391 /nfs/dbraw/zinc/93/43/91/894934391.db2.gz BOSOHLPRRDDESW-UHFFFAOYSA-N 0 3 418.335 4.222 20 0 HIADHN CCCN(Cc1csc(N(CC)C(C)=O)n1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000479696691 894987658 /nfs/dbraw/zinc/98/76/58/894987658.db2.gz ZYJBTFFUMPCMFE-QFIPXVFZSA-N 0 3 414.619 4.393 20 0 HIADHN CN(Cc1ccc(F)cc1Br)C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000479729344 895026835 /nfs/dbraw/zinc/02/68/35/895026835.db2.gz LJJDLQYGVAMCER-RTBURBONSA-N 0 3 420.326 4.175 20 0 HIADHN Cc1ccc(-c2nnc(-c3ccc(C(=O)NCCN4CCCC[C@H]4C)cc3)o2)cc1 ZINC000479755561 895056344 /nfs/dbraw/zinc/05/63/44/895056344.db2.gz XOWOQEGPKQQCEY-GOSISDBHSA-N 0 3 404.514 4.316 20 0 HIADHN CC[C@H](NC(=O)N[C@H](CN(C)C)c1ccc(OC)cc1)c1ccccc1OC(F)F ZINC000479760642 895062159 /nfs/dbraw/zinc/06/21/59/895062159.db2.gz UBGWDTQPOJGTJU-RBUKOAKNSA-N 0 3 421.488 4.350 20 0 HIADHN C[C@@H](CN1CCCCCC1)NC(=O)c1ccc(NC(=O)Nc2ccccc2)s1 ZINC000479804108 895109563 /nfs/dbraw/zinc/10/95/63/895109563.db2.gz LBSRTPFRZYQGGX-INIZCTEOSA-N 0 3 400.548 4.386 20 0 HIADHN Fc1cc(Br)cc2c1CC[C@H]2NCc1ccc(CN2CCOCC2)cc1 ZINC000479882777 895228213 /nfs/dbraw/zinc/22/82/13/895228213.db2.gz GEUOERWBRGIDSP-OAQYLSRUSA-N 0 3 419.338 4.198 20 0 HIADHN Fc1cc(Br)cc2c1CC[C@@H]2NCc1ccc(CN2CCOCC2)cc1 ZINC000479882774 895228628 /nfs/dbraw/zinc/22/86/28/895228628.db2.gz GEUOERWBRGIDSP-NRFANRHFSA-N 0 3 419.338 4.198 20 0 HIADHN CS(=O)(=O)CCCCN[C@H](c1ccccc1)c1ccc(Br)cc1F ZINC000479951652 895304791 /nfs/dbraw/zinc/30/47/91/895304791.db2.gz CUOARIPOKKJSTE-GOSISDBHSA-N 0 3 414.340 4.092 20 0 HIADHN COc1ccc2sc(C(=O)NCc3ccccc3CN3CCC(O)CC3)c(C)c2c1 ZINC000479957457 895310462 /nfs/dbraw/zinc/31/04/62/895310462.db2.gz BPANFKFABXYXDX-UHFFFAOYSA-N 0 3 424.566 4.105 20 0 HIADHN Cc1nc(-c2ccccc2)c(C(=O)NCc2ccccc2CN2CCC(O)CC2)s1 ZINC000479972624 895326741 /nfs/dbraw/zinc/32/67/41/895326741.db2.gz YVCPPIZZVBWWRG-UHFFFAOYSA-N 0 3 421.566 4.005 20 0 HIADHN CC[C@H](C)n1ncc(C(=O)NC2CCN(CCOc3ccc(Cl)cc3)CC2)c1C ZINC000480005404 895357870 /nfs/dbraw/zinc/35/78/70/895357870.db2.gz HKXCYMWUODMRDK-INIZCTEOSA-N 0 3 418.969 4.089 20 0 HIADHN COc1cccc([C@H](CN[C@H](C)c2cc(OC)c(OC)cc2F)N2CCCC2)c1 ZINC000480080240 895435234 /nfs/dbraw/zinc/43/52/34/895435234.db2.gz AAMAKJQXUJEGSZ-IERDGZPVSA-N 0 3 402.510 4.339 20 0 HIADHN Cc1onc(-c2ccc(C(F)(F)F)cc2)c1C(=O)N1CC[C@H](N2CCCCC2)C1 ZINC000480082614 895440321 /nfs/dbraw/zinc/44/03/21/895440321.db2.gz OCVAVVPMVQKOKC-KRWDZBQOSA-N 0 3 407.436 4.369 20 0 HIADHN Cc1onc(-c2ccc(C(F)(F)F)cc2)c1C(=O)N1CC[C@@H](N2CCCCC2)C1 ZINC000480082615 895441198 /nfs/dbraw/zinc/44/11/98/895441198.db2.gz OCVAVVPMVQKOKC-QGZVFWFLSA-N 0 3 407.436 4.369 20 0 HIADHN COc1ccc([C@@H](CN[C@H](C)c2ccc(F)cc2OC(F)F)N2CCOCC2)cc1 ZINC000480082990 895441306 /nfs/dbraw/zinc/44/13/06/895441306.db2.gz FWVPXWZVGBSEKP-FOIQADDNSA-N 0 3 424.463 4.160 20 0 HIADHN O=S1(=O)CC[C@@H](N[C@H](Cc2ccccc2)C2CC2)c2cc(Br)ccc21 ZINC000480159222 895545413 /nfs/dbraw/zinc/54/54/13/895545413.db2.gz KYQBGRLDYQOYNR-RTBURBONSA-N 0 3 420.372 4.279 20 0 HIADHN CC1(C)CCC(CN[C@H]2CCS(=O)(=O)c3ccc(Br)cc32)CC1 ZINC000480173345 895564175 /nfs/dbraw/zinc/56/41/75/895564175.db2.gz VZGSIAZNTSSKLP-INIZCTEOSA-N 0 3 400.382 4.474 20 0 HIADHN O=S1(=O)CC[C@H](NCC2(c3cccc(F)c3)CC2)c2cc(Br)ccc21 ZINC000480189614 895586266 /nfs/dbraw/zinc/58/62/66/895586266.db2.gz BQFVMLFWVBNVBK-KRWDZBQOSA-N 0 3 424.335 4.128 20 0 HIADHN CC[C@H](Cc1ccccc1)N[C@H]1CCS(=O)(=O)c2ccc(Br)cc21 ZINC000480206571 895608819 /nfs/dbraw/zinc/60/88/19/895608819.db2.gz ACMAJNHWBFSWMI-AEFFLSMTSA-N 0 3 408.361 4.279 20 0 HIADHN C[C@H](NCc1ccc(CN2C[C@@H](C)O[C@H](C)C2)cc1)c1cccc(N2CCCC2=O)c1 ZINC000480225431 895629030 /nfs/dbraw/zinc/62/90/30/895629030.db2.gz KMHXIVIXGVPQMC-NJYVYQBISA-N 0 3 421.585 4.273 20 0 HIADHN C[C@@H](NCc1ccc(CN2C[C@@H](C)O[C@H](C)C2)cc1)c1cccc(N2CCCC2=O)c1 ZINC000480225430 895629672 /nfs/dbraw/zinc/62/96/72/895629672.db2.gz KMHXIVIXGVPQMC-NJDAHSKKSA-N 0 3 421.585 4.273 20 0 HIADHN CNS(=O)(=O)c1ccc([C@H](C)N[C@@H](C)c2ccc(-c3csc(C)n3)cc2)cc1 ZINC000480235233 895641955 /nfs/dbraw/zinc/64/19/55/895641955.db2.gz YEFYRVOULOEFMK-GJZGRUSLSA-N 0 3 415.584 4.438 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)Nc1cc(C(C)(C)C)nn1-c1ccccn1)c1ccco1 ZINC000480237344 895646784 /nfs/dbraw/zinc/64/67/84/895646784.db2.gz PTUUIJWBXQVKGI-SJORKVTESA-N 0 3 424.549 4.409 20 0 HIADHN Cc1cc([C@H]2CN(C(=O)N[C@H](CN3CCCC3)c3ccccc3)CCO2)ccc1F ZINC000480264414 895671817 /nfs/dbraw/zinc/67/18/17/895671817.db2.gz YIGYABBPFUJMML-DHIUTWEWSA-N 0 3 411.521 4.054 20 0 HIADHN CCN(Cc1cccc(Br)c1)C(=O)NC[C@@H](c1ccccc1)N(C)C ZINC000480298841 895704850 /nfs/dbraw/zinc/70/48/50/895704850.db2.gz ZMWFKSLMWZEHMP-IBGZPJMESA-N 0 3 404.352 4.284 20 0 HIADHN O=S1(=O)CC[C@H](NC[C@H]2CCCc3ccccc32)c2cc(Br)ccc21 ZINC000480327023 895728747 /nfs/dbraw/zinc/72/87/47/895728747.db2.gz LWJPAFDXVSCGCF-BEFAXECRSA-N 0 3 420.372 4.377 20 0 HIADHN CC[C@H](N[C@H](C)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccc(Cl)cc1 ZINC000480335976 895740423 /nfs/dbraw/zinc/74/04/23/895740423.db2.gz YEBPDZLWYHMTQW-IERDGZPVSA-N 0 3 422.978 4.163 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)[C@H](C)c2c(C)nn(CC(F)(F)F)c2C)N(C)C)cc1 ZINC000480399486 895803416 /nfs/dbraw/zinc/80/34/16/895803416.db2.gz XFQIZCQVRZPJLM-AUUYWEPGSA-N 0 3 424.511 4.147 20 0 HIADHN C[C@H](N[C@@H](CN1CCOCC1)c1ccccc1)c1ccc(F)c(Br)c1 ZINC000480446632 895835475 /nfs/dbraw/zinc/83/54/75/895835475.db2.gz LEYGYVNROJBMTH-YWZLYKJASA-N 0 3 407.327 4.312 20 0 HIADHN COc1cc(Br)c(CNC[C@@](C)(Cc2ccccc2)[C@@H](C)O)cc1OC ZINC000480448039 895836347 /nfs/dbraw/zinc/83/63/47/895836347.db2.gz VEPONCFIYAPQKI-QVKFZJNVSA-N 0 3 422.363 4.186 20 0 HIADHN C[C@@H](NCc1cccnc1N1CCOCC1)[C@@H](C)Oc1ccc(Cl)cc1Cl ZINC000480533931 895896246 /nfs/dbraw/zinc/89/62/46/895896246.db2.gz CYUCYLUPSZVMJH-HUUCEWRRSA-N 0 3 410.345 4.171 20 0 HIADHN CCc1cc(C(=O)NC[C@H](c2ccc(C(F)(F)F)cc2)N(CC)CC)cc(=O)[nH]1 ZINC000480567589 895928173 /nfs/dbraw/zinc/92/81/73/895928173.db2.gz HMAUSATVYZSHLF-GOSISDBHSA-N 0 3 409.452 4.181 20 0 HIADHN COCc1cccc(CN[C@H]2CCCOc3ccc(I)cc32)c1 ZINC000480615836 895982493 /nfs/dbraw/zinc/98/24/93/895982493.db2.gz TZXYKCYERAUMKF-SFHVURJKSA-N 0 3 423.294 4.441 20 0 HIADHN C[C@@H](NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)nc1)c1ccc(OC(F)(F)F)cc1 ZINC000480622694 895990822 /nfs/dbraw/zinc/99/08/22/895990822.db2.gz WAUUNWLFCWKWBR-BZUAXINKSA-N 0 3 409.452 4.445 20 0 HIADHN COc1cc([C@@H](C)NCc2ccc(N3C[C@@H](C)O[C@@H](C)C3)nc2)ccc1OC(F)F ZINC000480627096 895993846 /nfs/dbraw/zinc/99/38/46/895993846.db2.gz RCQIXQLZEUQYKP-OWCLPIDISA-N 0 3 421.488 4.156 20 0 HIADHN CCOc1ccc([C@@H](CC)NCc2ccc(N3CCO[C@H](C)C3)nc2)cc1OCC ZINC000480627716 895995925 /nfs/dbraw/zinc/99/59/25/895995925.db2.gz UQCHKQQWBJWEKS-WIYYLYMNSA-N 0 3 413.562 4.345 20 0 HIADHN C[C@@H](N[C@H](C)c1cccc(N2CCCS2(=O)=O)c1)c1cccc(OC(F)F)c1 ZINC000480630857 895999231 /nfs/dbraw/zinc/99/92/31/895999231.db2.gz NUIBVFZHPONIAR-HUUCEWRRSA-N 0 3 410.486 4.240 20 0 HIADHN C[C@H]1CN(C(=O)c2ccc(CNCc3ccc(OCC4CC4)cc3)cc2)C[C@H](C)O1 ZINC000480641608 896010854 /nfs/dbraw/zinc/01/08/54/896010854.db2.gz XFISMVMRQMQBQU-OALUTQOASA-N 0 3 408.542 4.015 20 0 HIADHN CC(C)c1cccc(CN[C@H](CN2CCC(C(N)=O)CC2)c2ccc(Cl)cc2)c1 ZINC000480666726 896030783 /nfs/dbraw/zinc/03/07/83/896030783.db2.gz IFJKVCDVNPBAEC-HSZRJFAPSA-N 0 3 413.993 4.492 20 0 HIADHN COc1ccc(-c2cc(C(=O)Nc3nc(CN4CCC[C@H](C)C4)cs3)[nH]n2)cc1 ZINC000480672122 896036995 /nfs/dbraw/zinc/03/69/95/896036995.db2.gz OFHJEZXRJRVWKT-AWEZNQCLSA-N 0 3 411.531 4.026 20 0 HIADHN CCC[C@H](NCc1ccc(N2CCCS2(=O)=O)c(F)c1)c1ccc(OC)cc1 ZINC000480677663 896040299 /nfs/dbraw/zinc/04/02/99/896040299.db2.gz RAFJJFFGLBNIHJ-FQEVSTJZSA-N 0 3 406.523 4.005 20 0 HIADHN COCCOc1ccc([C@H](C)NCc2ccc(N3CCCCCC3)nc2)cc1OC ZINC000480697056 896058721 /nfs/dbraw/zinc/05/87/21/896058721.db2.gz KJAVAMVKAZOBSY-IBGZPJMESA-N 0 3 413.562 4.347 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)N1CCC[C@@H]1c1ccc2c(c1)OCO2 ZINC000480701604 896064258 /nfs/dbraw/zinc/06/42/58/896064258.db2.gz KPDAAFBIZKHCNS-MSOLQXFVSA-N 0 3 413.543 4.160 20 0 HIADHN CCNC(=O)COc1ccc(CN[C@@H]2CCCCc3ccc(Cl)cc32)cc1OC ZINC000480727386 896088919 /nfs/dbraw/zinc/08/89/19/896088919.db2.gz JIJKGNYAQOWHCG-HXUWFJFHSA-N 0 3 416.949 4.421 20 0 HIADHN CCNC(=O)COc1ccc(CN[C@H](C)c2cc3c(s2)CCCC3)cc1OC ZINC000480732455 896092905 /nfs/dbraw/zinc/09/29/05/896092905.db2.gz YSXUNMGGCPSHRB-OAHLLOKOSA-N 0 3 402.560 4.001 20 0 HIADHN Cc1nc(-c2ccccc2)sc1[C@@H](C)NCc1ccnc(N2CCN(C)CC2)c1 ZINC000480739891 896100388 /nfs/dbraw/zinc/10/03/88/896100388.db2.gz OEAOXKODHWHBBH-QGZVFWFLSA-N 0 3 407.587 4.116 20 0 HIADHN CCN1CCN(c2ccc(CN[C@@H](c3ccccc3)c3ccc(F)cc3)cn2)CC1 ZINC000480790764 896158627 /nfs/dbraw/zinc/15/86/27/896158627.db2.gz JEIAAVIVIZVYDB-VWLOTQADSA-N 0 3 404.533 4.242 20 0 HIADHN C[C@@H]1CN(C(=O)Nc2ccc(SC3CCCC3)cc2)CC[C@H]1N1CCN(C)CC1 ZINC000480806645 896173614 /nfs/dbraw/zinc/17/36/14/896173614.db2.gz NGVOUVIFXSWUQV-XMSQKQJNSA-N 0 3 416.635 4.211 20 0 HIADHN COc1cc([C@H](C)NCc2ccc(CN3CCCC3=O)cc2)ccc1OC(F)F ZINC000480894621 896250688 /nfs/dbraw/zinc/25/06/88/896250688.db2.gz FNNKBOCNPOWZBE-HNNXBMFYSA-N 0 3 404.457 4.270 20 0 HIADHN CCN(CC)c1ccc(CN[C@@H](C)c2ccc(I)cc2)cn1 ZINC000480905039 896262239 /nfs/dbraw/zinc/26/22/39/896262239.db2.gz GYGGYYSZCYMJAJ-AWEZNQCLSA-N 0 3 409.315 4.383 20 0 HIADHN C[C@H](NCc1cccc(NC(=O)C2CCCC2)c1)c1ccc(NS(C)(=O)=O)cc1 ZINC000480908806 896263704 /nfs/dbraw/zinc/26/37/04/896263704.db2.gz MGNVMOIDVUNJRL-INIZCTEOSA-N 0 3 415.559 4.038 20 0 HIADHN C[C@@H]1C[C@@H](NCc2ccc(CS(C)(=O)=O)cc2)c2cccc(Br)c21 ZINC000480910291 896266007 /nfs/dbraw/zinc/26/60/07/896266007.db2.gz ORUSEJSHDKEVAP-FZKQIMNGSA-N 0 3 408.361 4.332 20 0 HIADHN C[C@@H](NCc1ccc(CN2CCN(C)CC2)cc1)c1nc(-c2ccccc2)cs1 ZINC000480920813 896279296 /nfs/dbraw/zinc/27/92/96/896279296.db2.gz NJQIOXMHRJGZGV-LJQANCHMSA-N 0 3 406.599 4.408 20 0 HIADHN CCN1CCC[C@@H](CN(C)C(=O)c2csc3cc(C)ccc23)[C@@H]1c1cnn(C)c1 ZINC000481067087 896387887 /nfs/dbraw/zinc/38/78/87/896387887.db2.gz DVHGOFNVIKIUPJ-HTAPYJJXSA-N 0 3 410.587 4.488 20 0 HIADHN CC[C@H](c1cccc(OC)c1)N(C)C(=O)NCC1(N2CCSCC2)CCCC1 ZINC000481084704 896404367 /nfs/dbraw/zinc/40/43/67/896404367.db2.gz ZLEUYDUOLWGHHK-HXUWFJFHSA-N 0 3 405.608 4.149 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Cc1csc2nccn12)c1ccc(C(F)(F)F)cc1 ZINC000481145083 896472922 /nfs/dbraw/zinc/47/29/22/896472922.db2.gz PTLXKVQFNHERJM-QGZVFWFLSA-N 0 3 424.492 4.156 20 0 HIADHN CC(=O)N[C@@H](C)C1CCN(Cc2ccc(-c3ccc(Br)cc3)o2)CC1 ZINC000481154553 896488559 /nfs/dbraw/zinc/48/85/59/896488559.db2.gz MMRMRMXLYBIZAX-AWEZNQCLSA-N 0 3 405.336 4.446 20 0 HIADHN CC(=O)N[C@H](C)C1CCN(Cc2c(-c3ccc(Cl)cc3)nc3sccn23)CC1 ZINC000481157301 896490472 /nfs/dbraw/zinc/49/04/72/896490472.db2.gz VBTJBTOBSOOQGX-CQSZACIVSA-N 0 3 416.978 4.453 20 0 HIADHN Cc1c([C@H](C)NC[C@@H](O)COCC(C)C)cnn1-c1ccc(Cl)cc1Cl ZINC000481165190 896497793 /nfs/dbraw/zinc/49/77/93/896497793.db2.gz CWMYRWVZPKUOOB-XJKSGUPXSA-N 0 3 400.350 4.172 20 0 HIADHN CNS(=O)(=O)c1ccc([C@H](C)N[C@@H]2C[C@@H](C)c3c2cccc3Br)cc1 ZINC000481176985 896511114 /nfs/dbraw/zinc/51/11/14/896511114.db2.gz PIYZYWLFBHSQQK-FHSNZYRGSA-N 0 3 423.376 4.256 20 0 HIADHN COc1ccccc1-c1ccc([C@H](C)NCc2cccnc2N2CCN(C)CC2)cc1 ZINC000481203702 896556685 /nfs/dbraw/zinc/55/66/85/896556685.db2.gz CBDAQLBPJDDYGB-FQEVSTJZSA-N 0 3 416.569 4.360 20 0 HIADHN Cc1nn(-c2ccccc2)cc1CCCNC(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C ZINC000481224878 896576393 /nfs/dbraw/zinc/57/63/93/896576393.db2.gz IFBWUKFBSNTZSI-RDPSFJRHSA-N 0 3 419.573 4.104 20 0 HIADHN O=C(CN[C@@H](CC1CCC1)c1ccccc1)NCc1ccc(C(=O)N2CCCC2)cc1 ZINC000481229903 896579813 /nfs/dbraw/zinc/57/98/13/896579813.db2.gz BQVAEDQTLHBEOM-DEOSSOPVSA-N 0 3 419.569 4.060 20 0 HIADHN O=S(=O)(CCCN[C@H]1CCCOc2c(Br)cccc21)c1ccccc1 ZINC000481246799 896599249 /nfs/dbraw/zinc/59/92/49/896599249.db2.gz OCBOQXGSRAXGRJ-SFHVURJKSA-N 0 3 424.360 4.116 20 0 HIADHN CN1CCN(c2ncccc2CN[C@@H]2CCCc3nc(-c4ccccc4)sc32)CC1 ZINC000481265788 896615004 /nfs/dbraw/zinc/61/50/04/896615004.db2.gz WOCNMTJYNQIEIJ-HXUWFJFHSA-N 0 3 419.598 4.124 20 0 HIADHN O=C(CN[C@@H](CC1CCC1)c1ccccc1)NCCc1cnn(-c2ccccc2)c1 ZINC000481279505 896626567 /nfs/dbraw/zinc/62/65/67/896626567.db2.gz DRSZQXXESYGXDP-DEOSSOPVSA-N 0 3 402.542 4.052 20 0 HIADHN CCOc1ccc([C@H](C)NCc2ccc(S(=O)(=O)N3CCC[C@@H](C)C3)cc2)cc1 ZINC000481302783 896648542 /nfs/dbraw/zinc/64/85/42/896648542.db2.gz DWQXRAJQYJGACM-MOPGFXCFSA-N 0 3 416.587 4.357 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1ccc(-c2cncnc2)cc1F)c1cccc(OC)c1 ZINC000481303914 896650571 /nfs/dbraw/zinc/65/05/71/896650571.db2.gz GOADDZPUEMXIDC-QHCPKHFHSA-N 0 3 422.504 4.104 20 0 HIADHN Cc1nc(Cc2ccccc2)sc1[C@@H](C)NCc1cccc(OCC(=O)N(C)C)c1 ZINC000481308159 896654625 /nfs/dbraw/zinc/65/46/25/896654625.db2.gz AUWNLHVODHLBNU-QGZVFWFLSA-N 0 3 423.582 4.360 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(OCC(=O)NC2CC2)cc1)c1cnn(Cc2ccccc2)c1 ZINC000481309313 896656392 /nfs/dbraw/zinc/65/63/92/896656392.db2.gz OOQDRZFFSBDPBF-RBUKOAKNSA-N 0 3 418.541 4.001 20 0 HIADHN C[C@@H](N[C@@H](C)c1cnn(Cc2ccccc2)c1)c1ccc(OCC(=O)NC2CC2)cc1 ZINC000481309310 896656523 /nfs/dbraw/zinc/65/65/23/896656523.db2.gz OOQDRZFFSBDPBF-MOPGFXCFSA-N 0 3 418.541 4.001 20 0 HIADHN COc1cc([C@H](C)N[C@H](C)c2ccc(OCC(=O)NC3CC3)cc2)ccc1SC ZINC000481317665 896670396 /nfs/dbraw/zinc/67/03/96/896670396.db2.gz YVNFEJHQEBRWSI-CVEARBPZSA-N 0 3 414.571 4.486 20 0 HIADHN C[C@@H]1CCCN(S(=O)(=O)c2ccc(CN[C@@H]3CCSc4ccccc43)cc2)C1 ZINC000481321686 896676635 /nfs/dbraw/zinc/67/66/35/896676635.db2.gz LHYSGBFZFZJSFK-DYESRHJHSA-N 0 3 416.612 4.434 20 0 HIADHN CC[C@@H](NCc1cccc(OCC(=O)N(C)C)c1)c1cccc(Br)c1 ZINC000481323389 896677731 /nfs/dbraw/zinc/67/77/31/896677731.db2.gz VDBUIOFLWIXVPX-LJQANCHMSA-N 0 3 405.336 4.157 20 0 HIADHN C[C@@H](N[C@H](C)c1cccc(OCc2ccccn2)c1)c1ccc(-n2cnnn2)cc1 ZINC000481330797 896691572 /nfs/dbraw/zinc/69/15/72/896691572.db2.gz GSLKIBGZROAOKL-QZTJIDSGSA-N 0 3 400.486 4.048 20 0 HIADHN CN(C)C[C@@H](NC(=O)N[C@@H](c1c(F)cccc1F)C(F)(F)F)c1ccc(F)cc1 ZINC000481357778 896734472 /nfs/dbraw/zinc/73/44/72/896734472.db2.gz GFXHXVLSCQVIOO-WBVHZDCISA-N 0 3 419.369 4.309 20 0 HIADHN Cc1nc(NC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)ccc1Br ZINC000481362308 896743013 /nfs/dbraw/zinc/74/30/13/896743013.db2.gz FECPLNSODNFZIF-OAHLLOKOSA-N 0 3 417.351 4.281 20 0 HIADHN Cc1cc(Br)c(F)cc1NC(=O)N[C@@H](CN(C)C)c1ccc(F)cc1 ZINC000481383160 896782311 /nfs/dbraw/zinc/78/23/11/896782311.db2.gz QZGRVSNHDUHSKO-KRWDZBQOSA-N 0 3 412.278 4.460 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)Nc2ccc(Br)c(C)n2)c1 ZINC000481392357 896796982 /nfs/dbraw/zinc/79/69/82/896796982.db2.gz LNQNJUMFFUJDNI-UHFFFAOYSA-N 0 3 405.340 4.057 20 0 HIADHN COc1ccc([C@H](CNC(=O)Nc2ccnn2[C@H](C)CC(C)C)N2CCCC2)cc1 ZINC000481452095 896848065 /nfs/dbraw/zinc/84/80/65/896848065.db2.gz SLMMOQZMIRTRKY-NQIIRXRSSA-N 0 3 413.566 4.457 20 0 HIADHN Cc1nc(-c2ccccc2)ncc1C(=O)N(CCCc1ccccc1)CCN(C)C ZINC000481500029 896873643 /nfs/dbraw/zinc/87/36/43/896873643.db2.gz DOHGYBUFDHVXGS-UHFFFAOYSA-N 0 3 402.542 4.089 20 0 HIADHN CC(C)(CNC(=O)C[C@@H](c1cccs1)n1cccc1)N1CCc2ccccc2C1 ZINC000481520882 896886614 /nfs/dbraw/zinc/88/66/14/896886614.db2.gz WDJKUZMLSARMHW-NRFANRHFSA-N 0 3 407.583 4.482 20 0 HIADHN Cc1nc(Cc2ccccc2)sc1[C@@H](C)NC[C@@H](O)COc1ccc(F)cc1 ZINC000481534764 896895495 /nfs/dbraw/zinc/89/54/95/896895495.db2.gz NQNARMIXRFGVTD-DNVCBOLYSA-N 0 3 400.519 4.272 20 0 HIADHN COc1cc([C@H](C)NCc2ccc(S(=O)(=O)N(C)C(C)C)cc2)ccc1SC ZINC000481548814 896912065 /nfs/dbraw/zinc/91/20/65/896912065.db2.gz VTJXHGLWAOVGBH-INIZCTEOSA-N 0 3 422.616 4.297 20 0 HIADHN Cc1c([C@@H](C)NC[C@@H](O)COc2ccc(F)cc2)cnn1-c1cccc(Cl)c1 ZINC000481555313 896926598 /nfs/dbraw/zinc/92/65/98/896926598.db2.gz DRKMKAWDAUPNKN-AUUYWEPGSA-N 0 3 403.885 4.064 20 0 HIADHN C[C@@H]1CCCCN(CC(=O)N(Cc2nnc(-c3ccccc3Cl)o2)C2CC2)C1 ZINC000481584641 896964443 /nfs/dbraw/zinc/96/44/43/896964443.db2.gz FXQKSVUVRLMSMF-OAHLLOKOSA-N 0 3 402.926 4.003 20 0 HIADHN CCOCCOc1ccc(Cl)cc1NC(=O)NC[C@H](c1ccc(C)cc1)N(C)C ZINC000481685141 897069546 /nfs/dbraw/zinc/06/95/46/897069546.db2.gz OAYNUKPPWOTEFN-HXUWFJFHSA-N 0 3 419.953 4.488 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)CCN1CCC[C@]2(C1)OCc1ccccc12 ZINC000481690206 897075293 /nfs/dbraw/zinc/07/52/93/897075293.db2.gz DRPQFXNBSLGKDB-JOCHJYFZSA-N 0 3 400.906 4.199 20 0 HIADHN CC(C)C[C@@H]1OCCC[C@@H]1NCC(=O)N1N=C(c2ccco2)C[C@@H]1c1cccs1 ZINC000481725054 897119891 /nfs/dbraw/zinc/11/98/91/897119891.db2.gz NSVSMTMVRNKUAZ-HQRMLTQVSA-N 0 3 415.559 4.202 20 0 HIADHN Cc1cc(Br)cc(C)c1CN[C@H](C)c1cccc(NS(C)(=O)=O)c1 ZINC000481727589 897121719 /nfs/dbraw/zinc/12/17/19/897121719.db2.gz QWRBFIOFOILHIY-CQSZACIVSA-N 0 3 411.365 4.288 20 0 HIADHN C[C@@H](N[C@@H]1CCCc2cc(OC(F)F)ccc21)c1cccc(NS(C)(=O)=O)c1 ZINC000481733549 897127691 /nfs/dbraw/zinc/12/76/91/897127691.db2.gz HYDOMGWAAFXXLJ-BFUOFWGJSA-N 0 3 410.486 4.388 20 0 HIADHN O=C(CNC1(c2ccc(C(F)(F)F)cc2)CCCC1)NCC(=O)c1cccs1 ZINC000505471293 914144820 /nfs/dbraw/zinc/14/48/20/914144820.db2.gz JAMJXUHMVVEITD-UHFFFAOYSA-N 0 3 410.461 4.125 20 0 HIADHN CN(C)CCN(C(=O)Nc1cccc(-n2cc(C(F)(F)F)cn2)c1)C1CCCC1 ZINC000481937610 897322913 /nfs/dbraw/zinc/32/29/13/897322913.db2.gz APSHSWKPHYUBQE-UHFFFAOYSA-N 0 3 409.456 4.229 20 0 HIADHN COc1ccc(-c2nnc(NC(=O)N[C@@H](CN3CCCC3)c3ccccc3)s2)cc1 ZINC000481973893 897365857 /nfs/dbraw/zinc/36/58/57/897365857.db2.gz ASSRUDOUMQBSJG-IBGZPJMESA-N 0 3 423.542 4.172 20 0 HIADHN COC(=O)c1ccc(-c2ccc(CNc3ccccc3CN3CCC(O)CC3)o2)cc1 ZINC000481982100 897375732 /nfs/dbraw/zinc/37/57/32/897375732.db2.gz NMSIMXSGGDRHOE-UHFFFAOYSA-N 0 3 420.509 4.302 20 0 HIADHN CC1(C)CC[C@@H](NC[C@@H]2CCCCS2(=O)=O)c2cc(Br)ccc21 ZINC000481991044 897385848 /nfs/dbraw/zinc/38/58/48/897385848.db2.gz GYGMOBGLXZEFGT-WMLDXEAASA-N 0 3 400.382 4.119 20 0 HIADHN CC[C@@H](NCc1ccccc1N1CCN(C(C)=O)CC1)c1ccc(OC(F)F)cc1 ZINC000482036487 897451076 /nfs/dbraw/zinc/45/10/76/897451076.db2.gz NTQRLSVAAROVSL-OAQYLSRUSA-N 0 3 417.500 4.197 20 0 HIADHN Cc1cc(NC(=O)c2ccnc(N3CC[C@@H](C)C3)c2)cc(N2CCN(C(C)C)CC2)c1 ZINC000482038707 897454947 /nfs/dbraw/zinc/45/49/47/897454947.db2.gz ZLIQYOOHZBHTQO-LJQANCHMSA-N 0 3 421.589 4.019 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)Nc2ncc(C(F)(F)F)s2)N(C)C)cc1 ZINC000482052646 897478129 /nfs/dbraw/zinc/47/81/29/897478129.db2.gz SZIIUWHVCIDSMC-AWEZNQCLSA-N 0 3 416.469 4.374 20 0 HIADHN O=C(CCCc1nc(-c2ccc(Cl)cc2)no1)N1CCN(C2CCCCC2)CC1 ZINC000482061025 897491623 /nfs/dbraw/zinc/49/16/23/897491623.db2.gz MCRLFJXKYXRISD-UHFFFAOYSA-N 0 3 416.953 4.190 20 0 HIADHN Cc1ccc([C@H](Cc2ccccc2Br)NCC(=O)NCC(F)F)cc1 ZINC000482069581 897504386 /nfs/dbraw/zinc/50/43/86/897504386.db2.gz NJZFTNGHEDMBLD-KRWDZBQOSA-N 0 3 411.290 4.012 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)Nc1ccc(Cl)cn1 ZINC000482091572 897534575 /nfs/dbraw/zinc/53/45/75/897534575.db2.gz WRUKXYZPOMNABX-UHFFFAOYSA-N 0 3 400.832 4.350 20 0 HIADHN C[C@H](C(=O)NCCCCN1CCN(Cc2ccccc2)CC1)c1cc2ccccc2o1 ZINC000482112261 897563222 /nfs/dbraw/zinc/56/32/22/897563222.db2.gz GGPMCSOQFJLELO-NRFANRHFSA-N 0 3 419.569 4.251 20 0 HIADHN C[C@@H](NCc1ccc(NC(=O)c2cccnc2)cc1)c1cccc(N2CCCC2=O)c1 ZINC000482112503 897563348 /nfs/dbraw/zinc/56/33/48/897563348.db2.gz FPUMQQPVRAZIEX-GOSISDBHSA-N 0 3 414.509 4.312 20 0 HIADHN CC[C@@H](NCc1ccc(NC(=O)c2cccnc2)cc1)c1ccc2c(c1)OCCO2 ZINC000482112250 897563576 /nfs/dbraw/zinc/56/35/76/897563576.db2.gz UREGEVFTKPRHPC-OAQYLSRUSA-N 0 3 403.482 4.346 20 0 HIADHN C[C@@H](NCCc1nccs1)c1cccc(S(=O)(=O)NC2CCCCCC2)c1 ZINC000482119358 897572874 /nfs/dbraw/zinc/57/28/74/897572874.db2.gz LLANLFKSUPKJSD-MRXNPFEDSA-N 0 3 407.605 4.038 20 0 HIADHN C[C@@H](NCc1ccc(NC(=O)c2ccncc2)cc1)c1cccc(N2CCCC2=O)c1 ZINC000482124200 897581518 /nfs/dbraw/zinc/58/15/18/897581518.db2.gz QYJUCJNVVDMXFE-GOSISDBHSA-N 0 3 414.509 4.312 20 0 HIADHN Cc1nc(-c2cccnc2)sc1[C@H](C)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1 ZINC000482125099 897583150 /nfs/dbraw/zinc/58/31/50/897583150.db2.gz JCIGPNMWMZCFKA-UWJYYQICSA-N 0 3 420.582 4.398 20 0 HIADHN COC(=O)c1ccc(-c2ccc(CN[C@H]3CCN(C(=O)C4CCCCC4)C3)o2)cc1 ZINC000482212183 897693135 /nfs/dbraw/zinc/69/31/35/897693135.db2.gz PRRJMHJAUPPCSO-FQEVSTJZSA-N 0 3 410.514 4.004 20 0 HIADHN CCC[C@@H](N[C@@H](CC)c1ccc2c(c1)OCCO2)C(=O)N1CCc2sccc2C1 ZINC000482241252 897721865 /nfs/dbraw/zinc/72/18/65/897721865.db2.gz IFDACBIDTFPWEK-RBUKOAKNSA-N 0 3 414.571 4.314 20 0 HIADHN OC1(Cc2ccc(F)cc2)CCN(Cc2ccccc2OCc2ccccn2)CC1 ZINC000482303896 897800306 /nfs/dbraw/zinc/80/03/06/897800306.db2.gz DZWNASAIUYKEME-UHFFFAOYSA-N 0 3 406.501 4.369 20 0 HIADHN COc1cc([C@H](C)NCc2cc(C)cc3c(C)c(C)[nH]c32)ccc1S(C)(=O)=O ZINC000482327465 897829348 /nfs/dbraw/zinc/82/93/48/897829348.db2.gz OMOSMRAECTWKAY-INIZCTEOSA-N 0 3 400.544 4.356 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)c2csc(-c3ccccc3F)n2)c1 ZINC000482353688 897867617 /nfs/dbraw/zinc/86/76/17/897867617.db2.gz BUUODUGNQCGAKT-UHFFFAOYSA-N 0 3 413.518 4.162 20 0 HIADHN COc1ccc([C@@H](NC(=O)N(CCN(C)C)Cc2cccc(C)c2)C(F)(F)F)cc1 ZINC000482356912 897872092 /nfs/dbraw/zinc/87/20/92/897872092.db2.gz AIZHATFSDKPYJD-HXUWFJFHSA-N 0 3 423.479 4.380 20 0 HIADHN CC(C)N(CCN(C)C)C(=O)N[C@@H](c1ccc(OC(F)(F)F)cc1)C(F)(F)F ZINC000482359024 897875065 /nfs/dbraw/zinc/87/50/65/897875065.db2.gz BHIGLPSXESUILK-AWEZNQCLSA-N 0 3 415.378 4.170 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)c2ccc(C)c(Oc3ccncc3)c2)c1 ZINC000482382864 897912470 /nfs/dbraw/zinc/91/24/70/897912470.db2.gz SEYVLUWSDUWNGY-UHFFFAOYSA-N 0 3 419.525 4.395 20 0 HIADHN COC[C@H](C)Oc1ccc(Cl)cc1NC(=O)N[C@H](CN(C)C)c1ccc(F)cc1 ZINC000482393863 897927353 /nfs/dbraw/zinc/92/73/53/897927353.db2.gz PKYXSLMRQLVMFF-IFXJQAMLSA-N 0 3 423.916 4.317 20 0 HIADHN CN(C)C[C@H](NC(=O)Nc1cc(F)cc(F)c1Br)c1ccc(F)cc1 ZINC000482396754 897933172 /nfs/dbraw/zinc/93/31/72/897933172.db2.gz SBWUWVDSCQBVPY-HNNXBMFYSA-N 0 3 416.241 4.291 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)N[C@H](c3ccccc3C(F)(F)F)C(F)(F)F)[C@@H]2C1 ZINC000482404069 897945137 /nfs/dbraw/zinc/94/51/37/897945137.db2.gz MIDSBWPNGARCNK-KCPJHIHWSA-N 0 3 409.374 4.044 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)N[C@H](c1cccc(F)c1F)C(F)(F)F ZINC000482444881 898008188 /nfs/dbraw/zinc/00/81/88/898008188.db2.gz OFAXIMZQAZWYAR-GOSISDBHSA-N 0 3 415.406 4.342 20 0 HIADHN CCC[C@H](NCc1cccnc1N1CCC(C(N)=O)CC1)c1ccc(Cl)cc1 ZINC000482445716 898008895 /nfs/dbraw/zinc/00/88/95/898008895.db2.gz OWCWKTWJGROGBJ-FQEVSTJZSA-N 0 3 400.954 4.068 20 0 HIADHN C[C@@H](NC(=O)N[C@@H](c1ccccc1C(F)(F)F)C(F)(F)F)C1=CCN(C)CC1 ZINC000482451242 898016803 /nfs/dbraw/zinc/01/68/03/898016803.db2.gz MWSMQVBBYIXHBM-ABAIWWIYSA-N 0 3 409.374 4.258 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccc(F)c2)C1)N1CCC[C@@]2(C1)OCc1ccccc12 ZINC000482473124 898047083 /nfs/dbraw/zinc/04/70/83/898047083.db2.gz BFGAQQSUFVULOH-NLFFAJNJSA-N 0 3 408.517 4.086 20 0 HIADHN CCO[C@@H]1C[C@@H](NCc2ccccc2OCc2ccncc2)[C@@H]1Oc1ccccc1 ZINC000482496262 898075690 /nfs/dbraw/zinc/07/56/90/898075690.db2.gz SOYQXNDPHCGIQR-GPXOXTDOSA-N 0 3 404.510 4.375 20 0 HIADHN COc1ccc(CN2CCC(c3nnc4n3CCCC4)CC2)cc1OCCC(C)C ZINC000482501425 898083174 /nfs/dbraw/zinc/08/31/74/898083174.db2.gz CBGXELPYEFSKLU-UHFFFAOYSA-N 0 3 412.578 4.428 20 0 HIADHN Cc1c([C@H](C)N[C@@H](C)Cc2ccc(O)cc2)nnn1-c1cccc(Br)c1 ZINC000482502455 898084420 /nfs/dbraw/zinc/08/44/20/898084420.db2.gz COLPWRPWELMXRO-KBPBESRZSA-N 0 3 415.335 4.326 20 0 HIADHN CCO[C@@H]1C[C@@H](NCc2cc(OC)c(OC)cc2SC)[C@@H]1Oc1ccccc1 ZINC000482513183 898098115 /nfs/dbraw/zinc/09/81/15/898098115.db2.gz RZQOSVZPXWAFFZ-ZNLUXHQJSA-N 0 3 403.544 4.140 20 0 HIADHN O=C(Nc1ccc2c(c1)CCC(=O)N2CC1CC1)N1CCN(CC2CCCCC2)CC1 ZINC000482613333 898215095 /nfs/dbraw/zinc/21/50/95/898215095.db2.gz JTMJVAJDWOKEJE-UHFFFAOYSA-N 0 3 424.589 4.106 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N1CCC[C@@]2(C1)OCc1ccccc12 ZINC000482619385 898220948 /nfs/dbraw/zinc/22/09/48/898220948.db2.gz KRZXHXLLALINFL-OFNKIYASSA-N 0 3 411.571 4.116 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)Nc1ccc2c(c1)CCC(=O)N2CC1CC1 ZINC000482620521 898222964 /nfs/dbraw/zinc/22/29/64/898222964.db2.gz CQOVUKLDPDAWMQ-GOSISDBHSA-N 0 3 420.557 4.018 20 0 HIADHN COc1ccc([C@H](CCO)NCc2ccc(-n3ccc(C(F)(F)F)n3)cc2)cc1 ZINC000482637562 898242393 /nfs/dbraw/zinc/24/23/93/898242393.db2.gz RIOQHWBBFFDTIM-IBGZPJMESA-N 0 3 405.420 4.113 20 0 HIADHN CC[C@H](C)C(=O)Nc1cccc(CNC(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)c1 ZINC000482638441 898242528 /nfs/dbraw/zinc/24/25/28/898242528.db2.gz XDDYIFQILKKEMF-NPPFBWRTSA-N 0 3 410.562 4.162 20 0 HIADHN Cc1nc(-c2cc([C@H](C)NCCOc3ccc(S(C)(=O)=O)cc3)cs2)cs1 ZINC000482653671 898256824 /nfs/dbraw/zinc/25/68/24/898256824.db2.gz YIAYBPKACWWPIL-ZDUSSCGKSA-N 0 3 422.597 4.313 20 0 HIADHN O=C(CCc1ccc(F)cc1F)NC1CCN(CCOc2ccc(Cl)cc2)CC1 ZINC000505543678 914242368 /nfs/dbraw/zinc/24/23/68/914242368.db2.gz USZCQLFUHQFMSU-UHFFFAOYSA-N 0 3 422.903 4.210 20 0 HIADHN CCc1c(NC(=O)c2ccc(N3CCN(CC)CC3)cc2)cnn1-c1ccccc1C ZINC000482743180 898348106 /nfs/dbraw/zinc/34/81/06/898348106.db2.gz GUEFZQFAGDUTFZ-UHFFFAOYSA-N 0 3 417.557 4.137 20 0 HIADHN CC(C)c1nn(-c2ccc(Br)cc2)cc1CNCC[C@@H](C)[S@@](C)=O ZINC000482787011 898395863 /nfs/dbraw/zinc/39/58/63/898395863.db2.gz IXFWJTNMWAMEKZ-JBEBIEQOSA-N 0 3 412.397 4.005 20 0 HIADHN Cn1c(CNC[C@H](c2cccc(Cl)c2)N2CCOCC2)nc2ccc(Cl)cc21 ZINC000482809987 898420274 /nfs/dbraw/zinc/42/02/74/898420274.db2.gz DHIYGOGZTLZQGC-HXUWFJFHSA-N 0 3 419.356 4.043 20 0 HIADHN CC(C)[C@H](CC(=O)Nc1cccc(CN2CCC(C(N)=O)CC2)c1)c1ccccc1 ZINC000482849954 898461424 /nfs/dbraw/zinc/46/14/24/898461424.db2.gz RKKOBBKTYSYXSD-QHCPKHFHSA-N 0 3 407.558 4.152 20 0 HIADHN CN(C)Cc1cccc(NC(=O)c2cc(C(=O)OC(C)(C)C)n(-c3ccccc3)n2)c1 ZINC000482866477 898477883 /nfs/dbraw/zinc/47/78/83/898477883.db2.gz GUDLKVBPDAHUSI-UHFFFAOYSA-N 0 3 420.513 4.142 20 0 HIADHN COc1ccccc1[C@H](C)NCCC(=O)N(C)Cc1ccccc1Br ZINC000482884964 898499381 /nfs/dbraw/zinc/49/93/81/898499381.db2.gz CUDOJNMXCQMSCV-HNNXBMFYSA-N 0 3 405.336 4.157 20 0 HIADHN COc1ccccc1[C@@H](C)NCCC(=O)N(C)Cc1ccccc1Br ZINC000482884965 898499538 /nfs/dbraw/zinc/49/95/38/898499538.db2.gz CUDOJNMXCQMSCV-OAHLLOKOSA-N 0 3 405.336 4.157 20 0 HIADHN CN(C)C(=O)[C@@H](Cc1ccccc1)N[C@@H]1CCCc2nc(-c3ccccc3)sc21 ZINC000482895238 898514521 /nfs/dbraw/zinc/51/45/21/898514521.db2.gz SLCKSZMSTAZRPW-TZIWHRDSSA-N 0 3 405.567 4.477 20 0 HIADHN COc1ccc2c(c1)[C@@H](NCc1cccc(NC(=O)NCc3ccncc3)c1)CC2 ZINC000482940512 898563117 /nfs/dbraw/zinc/56/31/17/898563117.db2.gz BCWNWKFCJFUTNU-QHCPKHFHSA-N 0 3 402.498 4.189 20 0 HIADHN O=C1NC2(CCCCC2)C(=O)N1Cc1ccccc1CN[C@@H]1CCc2ccc(F)cc21 ZINC000482952479 898580659 /nfs/dbraw/zinc/58/06/59/898580659.db2.gz BVSWELQRJHVGLN-JOCHJYFZSA-N 0 3 421.516 4.358 20 0 HIADHN C[C@@H](NC[C@H](O)Cc1ccccc1C(F)(F)F)c1ccc(Br)cn1 ZINC000482964579 898595085 /nfs/dbraw/zinc/59/50/85/898595085.db2.gz RZYAUSJCRCGNIW-BXUZGUMPSA-N 0 3 403.242 4.117 20 0 HIADHN C[C@H](NCc1ccccc1CN1C(=O)NC2(CCCCC2)C1=O)c1ccc(F)cc1 ZINC000482970796 898603735 /nfs/dbraw/zinc/60/37/35/898603735.db2.gz LNOGIEAAGMJQBU-KRWDZBQOSA-N 0 3 409.505 4.431 20 0 HIADHN Cc1cccc(C)c1NC(=O)CCCN[C@H](CO)c1ccccc1OC(F)(F)F ZINC000483070525 898752908 /nfs/dbraw/zinc/75/29/08/898752908.db2.gz NSBQBQBCPNZSHZ-QGZVFWFLSA-N 0 3 410.436 4.244 20 0 HIADHN CCCC[C@](C)(N[C@@H]1CCN(C2CCOCC2)C1=O)c1cccc(Br)c1 ZINC000483082946 898768113 /nfs/dbraw/zinc/76/81/13/898768113.db2.gz BIRPZDUAXPNSAY-CTNGQTDRSA-N 0 3 423.395 4.224 20 0 HIADHN COc1ccc([C@H](C)N[C@@H](Cc2ccccc2)[C@H](O)C(F)F)cc1Br ZINC000483125886 898811066 /nfs/dbraw/zinc/81/10/66/898811066.db2.gz JWKNFPPZKLAJGW-IWEFOYFVSA-N 0 3 414.290 4.346 20 0 HIADHN CC(C)(C)OC(=O)Cc1ccccc1NC(=O)N1CCN(C2CCCCC2)CC1 ZINC000483193915 898851332 /nfs/dbraw/zinc/85/13/32/898851332.db2.gz JFXBSWAQVLSOSY-UHFFFAOYSA-N 0 3 401.551 4.053 20 0 HIADHN C[C@H](NC(=O)Cc1cccc(OCc2cccnc2)c1)[C@@H](c1ccccc1)N(C)C ZINC000505590817 914296954 /nfs/dbraw/zinc/29/69/54/914296954.db2.gz KGSVJFXAMRIYPH-DFBJGRDBSA-N 0 3 403.526 4.011 20 0 HIADHN C[C@@H](NC(=O)c1ccc(C(=O)Nc2ccccc2)cc1)[C@H](c1ccccc1)N(C)C ZINC000505587803 914293626 /nfs/dbraw/zinc/29/36/26/914293626.db2.gz OYCMSROVTPKTQF-WZONZLPQSA-N 0 3 401.510 4.360 20 0 HIADHN CN(Cc1cc(Br)c(Cl)s1)C1CCN(c2cccnn2)CC1 ZINC000483255764 898897347 /nfs/dbraw/zinc/89/73/47/898897347.db2.gz QOYDZUWZFUZZMZ-UHFFFAOYSA-N 0 3 401.761 4.055 20 0 HIADHN COc1ccc(C2=NN(C(=O)CN(CC3CC3)C3CCC3)[C@H](c3ccco3)C2)cc1 ZINC000483303177 898934001 /nfs/dbraw/zinc/93/40/01/898934001.db2.gz DMPNBNPKHRUXNW-QFIPXVFZSA-N 0 3 407.514 4.230 20 0 HIADHN C[C@@H](NC(=O)c1ccc(-c2noc(C(F)F)n2)cc1)[C@H](c1ccccc1)N(C)C ZINC000505591229 914297904 /nfs/dbraw/zinc/29/79/04/914297904.db2.gz MAPSVULZQCMUJJ-CXAGYDPISA-N 0 3 400.429 4.095 20 0 HIADHN Cc1nn(C)c(Sc2ccccc2)c1C(=O)N[C@H](C)[C@H](c1ccccc1)N(C)C ZINC000505592038 914298913 /nfs/dbraw/zinc/29/89/13/914298913.db2.gz QRIPKPFTYZMIFB-DYESRHJHSA-N 0 3 408.571 4.301 20 0 HIADHN CS[C@H]1CN(C(=O)c2cc3cc(Br)cc(C)c3o2)C[C@@H]1N1CCCC1 ZINC000483379623 899015712 /nfs/dbraw/zinc/01/57/12/899015712.db2.gz GERCDNHSDVDGLB-RDJZCZTQSA-N 0 3 423.376 4.156 20 0 HIADHN CS[C@H]1CN(C(=O)c2sc(C3CC3)nc2-c2ccccc2)C[C@@H]1N1CCCC1 ZINC000483399541 899031878 /nfs/dbraw/zinc/03/18/78/899031878.db2.gz CHYZMWGJVHYLBT-ROUUACIJSA-N 0 3 413.612 4.339 20 0 HIADHN CO[C@@H](c1ccccc1Cl)[C@@H](C)NC(=O)N(CCN(C)C)Cc1ccc(C)o1 ZINC000483436176 899070478 /nfs/dbraw/zinc/07/04/78/899070478.db2.gz ZCQZOCWTOMNHGP-OXQOHEQNSA-N 0 3 407.942 4.091 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)Nc2cc(Br)ccn2)N(C)C)cc1 ZINC000483450974 899087530 /nfs/dbraw/zinc/08/75/30/899087530.db2.gz XPQKGQQRKKAHCQ-QGZVFWFLSA-N 0 3 421.339 4.056 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)Nc1ccc(C)c(C(=O)N2CCCCC2)c1 ZINC000483456816 899095504 /nfs/dbraw/zinc/09/55/04/899095504.db2.gz HKXTVLSYHOMQSA-UHFFFAOYSA-N 0 3 414.594 4.351 20 0 HIADHN CCn1c2ccc(Br)cc2nc1CN[C@H](C)Cc1ccn(C(C)C)n1 ZINC000483489418 899142446 /nfs/dbraw/zinc/14/24/46/899142446.db2.gz XAYCFCKMEXSTIY-CQSZACIVSA-N 0 3 404.356 4.317 20 0 HIADHN CSc1cccc(N(C(=O)c2ccc3nc(C)n(C)c3c2)C2CCN(C)CC2)c1 ZINC000483516392 899177378 /nfs/dbraw/zinc/17/73/78/899177378.db2.gz GWJFYQOHVPCYLU-UHFFFAOYSA-N 0 3 408.571 4.345 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)Nc1ccc(C)c(C(=O)N(C)C(C)C)c1)c1ccco1 ZINC000483571914 899225575 /nfs/dbraw/zinc/22/55/75/899225575.db2.gz DBPXZZSBTTYLAF-YLJYHZDGSA-N 0 3 414.550 4.319 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1ccc(OCC(F)F)cc1 ZINC000483595391 899245488 /nfs/dbraw/zinc/24/54/88/899245488.db2.gz AYFRNUXSPWMBSC-KRWDZBQOSA-N 0 3 403.473 4.459 20 0 HIADHN C[C@H](NC(=O)c1cccc(C(=O)N(C)c2ccccc2)c1)[C@@H](c1ccccc1)N(C)C ZINC000505635293 914335955 /nfs/dbraw/zinc/33/59/55/914335955.db2.gz SEOJJVBOIFXTDK-CYFREDJKSA-N 0 3 415.537 4.384 20 0 HIADHN Cc1ccc(NC(=O)[C@@H]2CCCN(C(=O)c3ccc(Cl)cc3)C2)c(CN(C)C)c1 ZINC000505636300 914336082 /nfs/dbraw/zinc/33/60/82/914336082.db2.gz PXTWUKBPBBYADV-GOSISDBHSA-N 0 3 413.949 4.201 20 0 HIADHN CNC(=O)[C@H](Cc1c[nH]c2ccccc12)N[C@@H](C)c1ccc2cc(OC)ccc2c1 ZINC000483711525 899367714 /nfs/dbraw/zinc/36/77/14/899367714.db2.gz JNLIPEGQKYNXBS-FYSMJZIKSA-N 0 3 401.510 4.338 20 0 HIADHN CNC(=O)[C@H](Cc1c[nH]c2ccccc12)N[C@@H](C)c1ccc(OC(F)(F)F)cc1 ZINC000483716042 899373776 /nfs/dbraw/zinc/37/37/76/899373776.db2.gz RUZRXGOAMBMFDD-DJJJIMSYSA-N 0 3 405.420 4.074 20 0 HIADHN CC(C)N(CCN(C)C)C(=O)N[C@H](c1cc(F)cc(Br)c1)C1CC1 ZINC000483794989 899465834 /nfs/dbraw/zinc/46/58/34/899465834.db2.gz RXKJYFGHZBHOAH-KRWDZBQOSA-N 0 3 400.336 4.021 20 0 HIADHN COc1cccc2c1[C@H](C(=O)Nc1ccnn1[C@H]1CCN(Cc3ccccc3)C1)CC2 ZINC000483794829 899466547 /nfs/dbraw/zinc/46/65/47/899466547.db2.gz CITDNFBVCSDICG-LEWJYISDSA-N 0 3 416.525 4.007 20 0 HIADHN CCN1CCN(c2cccc(NCc3c(C)nn(-c4ccc(F)cc4)c3C)c2)CC1 ZINC000483820863 899500059 /nfs/dbraw/zinc/50/00/59/899500059.db2.gz LRDKBPRXYNOHFX-UHFFFAOYSA-N 0 3 407.537 4.382 20 0 HIADHN CC[C@H](N[C@H](C)c1cccc(-n2cccn2)c1)c1ccccc1OCC(=O)N(C)C ZINC000483851835 899534375 /nfs/dbraw/zinc/53/43/75/899534375.db2.gz LMUHKFPXDIOJCZ-GCJKJVERSA-N 0 3 406.530 4.141 20 0 HIADHN Cc1c(C(=O)NCCCN2CCN(C)C[C@H]2c2ccccc2)sc2nccc(C)c12 ZINC000505670019 914365664 /nfs/dbraw/zinc/36/56/64/914365664.db2.gz QUOJNVINRHTYBD-FQEVSTJZSA-N 0 3 422.598 4.022 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)Nc2nnc(/C=C/c3ccco3)s2)CC1 ZINC000484116681 899740451 /nfs/dbraw/zinc/74/04/51/899740451.db2.gz UPFIBROMLYBTTM-MDZDMXLPSA-N 0 3 423.542 4.430 20 0 HIADHN C[C@@H](N[C@@H](CCCO)c1ccccc1)c1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000484135437 899756876 /nfs/dbraw/zinc/75/68/76/899756876.db2.gz QJCDEINTPIXZRO-XXBNENTESA-N 0 3 416.587 4.026 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1ccnc(C2CC2)n1)c1ccc(C(F)(F)F)cc1 ZINC000484144328 899765645 /nfs/dbraw/zinc/76/56/45/899765645.db2.gz ZZRUXSUVPIIFQX-GOSISDBHSA-N 0 3 406.452 4.186 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N(C)[C@@H](C)c1ccc(C(F)(F)F)cc1 ZINC000484166132 899785392 /nfs/dbraw/zinc/78/53/92/899785392.db2.gz QVNBXCDTDAPTFJ-HNNXBMFYSA-N 0 3 421.463 4.234 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)NC1(c2ccc(Cl)c(Cl)c2)CC1 ZINC000484177612 899795506 /nfs/dbraw/zinc/79/55/06/899795506.db2.gz NUVHDRNEQGGWQH-UHFFFAOYSA-N 0 3 420.340 4.107 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2ccc(OC(F)F)c(F)c2)c1 ZINC000484180668 899798034 /nfs/dbraw/zinc/79/80/34/899798034.db2.gz ODNOIWFZPAWILT-UHFFFAOYSA-N 0 3 411.424 4.031 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N[C@@H](C)Cc1ccc(Cl)cc1Cl ZINC000484224393 899821790 /nfs/dbraw/zinc/82/17/90/899821790.db2.gz QRFUSIITLJCEMO-AWEZNQCLSA-N 0 3 422.356 4.049 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)N[C@@H](CC(F)(F)F)c2ccccc2)cc1 ZINC000484284473 899850807 /nfs/dbraw/zinc/85/08/07/899850807.db2.gz PDQOXQWFLUNJTF-OALUTQOASA-N 0 3 409.452 4.291 20 0 HIADHN COc1ccccc1-c1nc(C2CCN(CCCC(=O)OC(C)(C)C)CC2)no1 ZINC000484298347 899859980 /nfs/dbraw/zinc/85/99/80/899859980.db2.gz XCQMRTJAKKFXPD-UHFFFAOYSA-N 0 3 401.507 4.047 20 0 HIADHN COc1cc([C@@H](C)N[C@@H](C)c2ccc(-n3ccnc3C)cc2)ccc1S(C)(=O)=O ZINC000484306546 899866683 /nfs/dbraw/zinc/86/66/83/899866683.db2.gz XBKAJWCQGRQCKL-JKSUJKDBSA-N 0 3 413.543 4.005 20 0 HIADHN CCOc1ccccc1OCCN1CCC(c2noc(-c3ccccc3OC)n2)CC1 ZINC000484308494 899868945 /nfs/dbraw/zinc/86/89/45/899868945.db2.gz MTTWDMSUWGXZCH-UHFFFAOYSA-N 0 3 423.513 4.402 20 0 HIADHN Cc1ccc2nc(CN[C@@](C)(c3ccc(Br)cc3)C(C)C)cc(=O)n2c1 ZINC000484330687 899884165 /nfs/dbraw/zinc/88/41/65/899884165.db2.gz NEFYSLXPQWQVPI-OAQYLSRUSA-N 0 3 414.347 4.426 20 0 HIADHN COCCOc1ccccc1C(=O)N(c1cccc(SC)c1)C1CCN(C)CC1 ZINC000484402690 899927205 /nfs/dbraw/zinc/92/72/05/899927205.db2.gz KPGUNICJCKHHIM-UHFFFAOYSA-N 0 3 414.571 4.175 20 0 HIADHN CSc1cccc(N(C(=O)c2cncc(Br)c2)C2CCN(C)CC2)c1 ZINC000484404255 899928969 /nfs/dbraw/zinc/92/89/69/899928969.db2.gz MOWJWYRZVLIGOG-UHFFFAOYSA-N 0 3 420.376 4.307 20 0 HIADHN Cc1c([C@@H](C)NCCC2CCN(CC(F)(F)F)CC2)nnn1-c1ccc(F)cc1 ZINC000484468989 899962519 /nfs/dbraw/zinc/96/25/19/899962519.db2.gz CLIJLXZKTZTDAN-CQSZACIVSA-N 0 3 413.463 4.030 20 0 HIADHN O[C@]1(CN[C@@H](Cc2ccccc2F)c2ccccc2Br)CCSC1 ZINC000484473196 899966840 /nfs/dbraw/zinc/96/68/40/899966840.db2.gz MBGHRBUFRJCXHB-OALUTQOASA-N 0 3 410.352 4.330 20 0 HIADHN CN1CCC[C@H](N[C@H]2CCCc3nc(-c4ccc(Br)cc4)sc32)C1=O ZINC000484479814 899971524 /nfs/dbraw/zinc/97/15/24/899971524.db2.gz ZMYBZNLNFGCGFK-HOCLYGCPSA-N 0 3 420.376 4.160 20 0 HIADHN Cc1c([C@H](C)NCCC2CCN(CC(F)(F)F)CC2)nnn1-c1ccc(C)cc1 ZINC000484502366 899993951 /nfs/dbraw/zinc/99/39/51/899993951.db2.gz WRGLMSJAUMAWCZ-INIZCTEOSA-N 0 3 409.500 4.199 20 0 HIADHN Cc1c([C@@H](C)N[C@H](C)Cc2ccncc2)nnn1-c1cccc(Br)c1 ZINC000484505512 899996648 /nfs/dbraw/zinc/99/66/48/899996648.db2.gz SURSFCNWLTYCTH-ZIAGYGMSSA-N 0 3 400.324 4.015 20 0 HIADHN O=C(C1CCCCC1)N1CC[C@H](N[C@@H]2CCCOc3ccc(Br)cc32)C1 ZINC000484510241 900001755 /nfs/dbraw/zinc/00/17/55/900001755.db2.gz WMLRSDZBLZDGTP-PKOBYXMFSA-N 0 3 421.379 4.434 20 0 HIADHN Cc1ccc(CN[C@@H](C)c2cccc(N3CCOCC3)c2)c(OC[C@@H]2CCOC2)c1 ZINC000484616080 900072630 /nfs/dbraw/zinc/07/26/30/900072630.db2.gz KRUPZKFEVQBTKX-LEWJYISDSA-N 0 3 410.558 4.098 20 0 HIADHN Brc1ccccc1-n1nnnc1CN[C@@H]1CCCC[C@@H]1c1ccccc1 ZINC000484633622 900083739 /nfs/dbraw/zinc/08/37/39/900083739.db2.gz AHQQMYPXXSMWBR-SJLPKXTDSA-N 0 3 412.335 4.241 20 0 HIADHN C[C@@H](N[C@H](C)c1cccc(N2CCCS2(=O)=O)c1)c1cccc(N2CCCC2)c1 ZINC000484644057 900089789 /nfs/dbraw/zinc/08/97/89/900089789.db2.gz TUGKBDNRBFDIOJ-RTBURBONSA-N 0 3 413.587 4.239 20 0 HIADHN CC(C)(C)OC(=O)[C@@](C)(O)CNCc1cn(C(C)(C)C)nc1-c1ccccc1Cl ZINC000484754645 900172365 /nfs/dbraw/zinc/17/23/65/900172365.db2.gz SIPNCVSZWNJNHF-QFIPXVFZSA-N 0 3 421.969 4.141 20 0 HIADHN CCOc1cc(CNC(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)ccc1OC(F)F ZINC000484764338 900179474 /nfs/dbraw/zinc/17/94/74/900179474.db2.gz PSCDGOSAOVIILC-QRWLVFNGSA-N 0 3 421.488 4.177 20 0 HIADHN CCOCCNC(=O)CN[C@@H](C)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 ZINC000484794581 900200287 /nfs/dbraw/zinc/20/02/87/900200287.db2.gz IIGIUBZJWHZHJE-ZDUSSCGKSA-N 0 3 400.466 4.237 20 0 HIADHN Cc1ccccc1C1(CNC(=O)N[C@@H]2CCN(Cc3ccccc3)[C@@H]2C)CCOCC1 ZINC000484893728 900277216 /nfs/dbraw/zinc/27/72/16/900277216.db2.gz WOCBUQVRZBJIME-ZJSXRUAMSA-N 0 3 421.585 4.005 20 0 HIADHN C[C@H]1Cc2ccccc2N1Cc1ccoc1C(=O)NC[C@H](Cc1ccccc1)N(C)C ZINC000484919443 900294780 /nfs/dbraw/zinc/29/47/80/900294780.db2.gz UKRYSTPGILHZNK-CVDCTZTESA-N 0 3 417.553 4.134 20 0 HIADHN Cc1ccccc1[C@H](C)N1CCN(Cc2nc3sc4c(c3c(=O)[nH]2)CCCC4)CC1 ZINC000484984657 900340922 /nfs/dbraw/zinc/34/09/22/900340922.db2.gz GRWCMSHYMBHUPI-KRWDZBQOSA-N 0 3 422.598 4.463 20 0 HIADHN Cc1nn(C)c2cc(NC(=O)[C@]3(C(F)(F)F)CCN(Cc4ccccc4)C3)ccc12 ZINC000485023505 900367978 /nfs/dbraw/zinc/36/79/78/900367978.db2.gz RROGFLRRMAXJTL-NRFANRHFSA-N 0 3 416.447 4.275 20 0 HIADHN COc1ccccc1-c1csc(C2CCN(C[C@H](O)COCC(C)C)CC2)n1 ZINC000485105477 900412961 /nfs/dbraw/zinc/41/29/61/900412961.db2.gz JRMCTHCSERALID-SFHVURJKSA-N 0 3 404.576 4.032 20 0 HIADHN C[C@@H](c1ccc([S@@](C)=O)cc1)N(C)CCC(=O)Nc1cccc(C(F)(F)F)c1 ZINC000485410338 900707851 /nfs/dbraw/zinc/70/78/51/900707851.db2.gz UWTHFTTUVGLJAS-HJFSHJIFSA-N 0 3 412.477 4.464 20 0 HIADHN Cc1ccnc(C)c1NC(=O)N(CCN(C)C)Cc1ccc(Br)cc1 ZINC000485472251 900765542 /nfs/dbraw/zinc/76/55/42/900765542.db2.gz DIISPIBWLBBSPY-UHFFFAOYSA-N 0 3 405.340 4.057 20 0 HIADHN CC(C)[C@H](CC(=O)Nc1ccc(C(=O)NCCN2CCCC2)cc1)c1ccccc1 ZINC000485473820 900767254 /nfs/dbraw/zinc/76/72/54/900767254.db2.gz JWDGKYWMCIDGRT-QHCPKHFHSA-N 0 3 407.558 4.281 20 0 HIADHN O=C(NCCc1cccc(F)c1F)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000485505337 900793199 /nfs/dbraw/zinc/79/31/99/900793199.db2.gz OKJVFJOLUUXUEA-FQEVSTJZSA-N 0 3 412.402 4.078 20 0 HIADHN Cc1cc(Br)ccc1CC(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000485531461 900810901 /nfs/dbraw/zinc/81/09/01/900810901.db2.gz YSPSFZICFZIPAN-UHFFFAOYSA-N 0 3 415.375 4.423 20 0 HIADHN COc1cc(NC(=O)CN2C[C@H](c3ccccc3)[C@@H]3CCCC[C@H]32)cc(OC)c1OC ZINC000485885201 901119728 /nfs/dbraw/zinc/11/97/28/901119728.db2.gz ZKPJELNYFTURQR-PWRODBHTSA-N 0 3 424.541 4.309 20 0 HIADHN C[C@H]1C[C@@H](C(=O)N2CCC(N(C)Cc3cccc(C(F)(F)F)c3)CC2)CCC1=O ZINC000485943066 901162797 /nfs/dbraw/zinc/16/27/97/901162797.db2.gz GXZZOZIIALIGSP-RDJZCZTQSA-N 0 3 410.480 4.134 20 0 HIADHN CN(C)Cc1ccccc1C(=O)NCc1cccc(NC(=O)c2ccc(F)cc2)c1 ZINC000485973522 901191437 /nfs/dbraw/zinc/19/14/37/901191437.db2.gz LTFUWVPAIRWPIU-UHFFFAOYSA-N 0 3 405.473 4.070 20 0 HIADHN CCOC(=O)c1c(C)c2ccccc2nc1N(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1 ZINC000485999782 901216390 /nfs/dbraw/zinc/21/63/90/901216390.db2.gz CMXOUFNDACVKQH-CVDCTZTESA-N 0 3 418.541 4.244 20 0 HIADHN CC[C@H](NC(=O)N1CCN(C2CCCCC2)CC1)c1nc(C(F)(F)F)cs1 ZINC000486088626 901277167 /nfs/dbraw/zinc/27/71/67/901277167.db2.gz CJKZBSPTIZZLHJ-AWEZNQCLSA-N 0 3 404.502 4.273 20 0 HIADHN CN(C)Cc1ccccc1C(=O)Nc1cc(-c2nnc3n2CCCCC3)ccc1F ZINC000486096430 901284586 /nfs/dbraw/zinc/28/45/86/901284586.db2.gz YTADACMDESKJHX-UHFFFAOYSA-N 0 3 407.493 4.125 20 0 HIADHN O=C(N[C@@H]1CCN(Cc2ccccc2)C1)C1(c2cc(F)cc(Br)c2)CC1 ZINC000505881898 914526842 /nfs/dbraw/zinc/52/68/42/914526842.db2.gz VOVXCWTVMBEWAR-LJQANCHMSA-N 0 3 417.322 4.011 20 0 HIADHN O=C(CN1CCN(C2CCCCC2)CC1)N1CCc2sccc2[C@H]1c1ccccc1 ZINC000486229361 901413223 /nfs/dbraw/zinc/41/32/23/901413223.db2.gz JBBXGTXLNDZPFW-RUZDIDTESA-N 0 3 423.626 4.173 20 0 HIADHN O=C(CN1CCN(C2CCCCC2)CC1)Nc1ccc2c(c1)OC1(CCCCC1)O2 ZINC000486240383 901421732 /nfs/dbraw/zinc/42/17/32/901421732.db2.gz BABDORXRTJMYPR-UHFFFAOYSA-N 0 3 413.562 4.007 20 0 HIADHN CCCOc1ccc(CN2C[C@H]3CCC[C@@]3(c3nc(CC4CC4)no3)C2)cc1OC ZINC000486471917 901632675 /nfs/dbraw/zinc/63/26/75/901632675.db2.gz SNSMEWKMWYDEQL-NTKDMRAZSA-N 0 3 411.546 4.373 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)[C@H](C)Oc2ccccc2Br)C1 ZINC000486720367 901812852 /nfs/dbraw/zinc/81/28/52/901812852.db2.gz GHPAKSJAFDHCAB-RYRKJORJSA-N 0 3 417.347 4.168 20 0 HIADHN C[C@H](Oc1ccccc1Br)C(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000486720369 901813033 /nfs/dbraw/zinc/81/30/33/901813033.db2.gz GHPAKSJAFDHCAB-XYJFISCASA-N 0 3 417.347 4.168 20 0 HIADHN CN(C)Cc1ccccc1C(=O)N1CCCN(c2ccc(Cl)c(Cl)c2)CC1 ZINC000486888583 901934572 /nfs/dbraw/zinc/93/45/72/901934572.db2.gz SSUJKOSNZAYPNP-UHFFFAOYSA-N 0 3 406.357 4.408 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)Nc2nnc(/C=C\c3ccco3)s2)c1 ZINC000486892556 901935958 /nfs/dbraw/zinc/93/59/58/901935958.db2.gz ZYJFGFLHZARFRD-KTKRTIGZSA-N 0 3 411.531 4.206 20 0 HIADHN CC(C)([C@H](NC(=O)Cc1n[nH]c2ccccc21)c1ccc(F)c(F)c1)N1CCCC1 ZINC000487099759 902057958 /nfs/dbraw/zinc/05/79/58/902057958.db2.gz MTGASCDNQTUTBA-JOCHJYFZSA-N 0 3 412.484 4.116 20 0 HIADHN CC[C@H](Cc1ccccc1Br)NCc1c(Br)cnn1C ZINC000487304988 902143396 /nfs/dbraw/zinc/14/33/96/902143396.db2.gz BJQIKPPMESLAKH-GFCCVEGCSA-N 0 3 401.146 4.056 20 0 HIADHN Cc1[nH]c2ccc(Cl)cc2c1C(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000487321767 902152070 /nfs/dbraw/zinc/15/20/70/902152070.db2.gz NXWRJZQUJURMLU-UHFFFAOYSA-N 0 3 411.933 4.016 20 0 HIADHN C[C@H](SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)N(C)CCN1CCCC1 ZINC000487626173 902258241 /nfs/dbraw/zinc/25/82/41/902258241.db2.gz SGUIXZKQGQRMSI-HNNXBMFYSA-N 0 3 407.967 4.171 20 0 HIADHN COC1CCN(C(C)(C)CNC(=O)c2ccc(C)nc2Sc2ccccc2)CC1 ZINC000487650561 902274094 /nfs/dbraw/zinc/27/40/94/902274094.db2.gz WKZJRJJLSGEGGT-UHFFFAOYSA-N 0 3 413.587 4.160 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NC[C@H]3SCCc4ccccc43)c(C)c2)CC1 ZINC000487718108 902313526 /nfs/dbraw/zinc/31/35/26/902313526.db2.gz GZZXJUWNNBDJRQ-HSZRJFAPSA-N 0 3 424.614 4.289 20 0 HIADHN CN(C(=O)N[C@H]1CCC[C@@H](c2ccccc2)C1)C1CCN(CCc2ccccn2)CC1 ZINC000487731836 902325977 /nfs/dbraw/zinc/32/59/77/902325977.db2.gz AUOSWDFYFVVLKG-VWNXMTODSA-N 0 3 420.601 4.456 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@@H](C)[C@H]1OCCc2sccc21)c1ccsc1 ZINC000487858818 902410058 /nfs/dbraw/zinc/41/00/58/902410058.db2.gz NNTPRYXLINLWCH-POZUXBRTSA-N 0 3 407.605 4.194 20 0 HIADHN COc1ccccc1CNC(=O)[C@@H](C)N[C@@H](C)c1ccc(Oc2cccnc2)cc1 ZINC000487937407 902467005 /nfs/dbraw/zinc/46/70/05/902467005.db2.gz XZKISVVQCLRVDX-ZWKOTPCHSA-N 0 3 405.498 4.238 20 0 HIADHN Cc1ccccc1COc1cccc(NC(=O)N2CCN(C3CCOCC3)C[C@@H]2C)c1 ZINC000488009876 902528938 /nfs/dbraw/zinc/52/89/38/902528938.db2.gz OLTPQGNSVUDYOP-FQEVSTJZSA-N 0 3 423.557 4.291 20 0 HIADHN Cc1ccnc(Oc2cc(NC(=O)N3CCN(C4CCOCC4)C[C@@H]3C)ccc2C)c1 ZINC000488498097 902855774 /nfs/dbraw/zinc/85/57/74/902855774.db2.gz BUYMVDSXLXKXIE-IBGZPJMESA-N 0 3 424.545 4.208 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N[C@H](C)[C@H]2OCCc3sccc32)N2CCCC2)cc1 ZINC000488508166 902861793 /nfs/dbraw/zinc/86/17/93/902861793.db2.gz ABYISEIHRNFCCV-PIPMEXSNSA-N 0 3 413.587 4.195 20 0 HIADHN CCCOc1ccc(C(=O)CCC(=O)N[C@H]2CCN(Cc3ccccc3)C[C@H]2C)cc1 ZINC000488519883 902867539 /nfs/dbraw/zinc/86/75/39/902867539.db2.gz VCRBKDSPHZULDQ-YKSBVNFPSA-N 0 3 422.569 4.465 20 0 HIADHN Cc1cc(Br)ccc1CC(=O)N(Cc1ccco1)C1CCN(C)CC1 ZINC000488681387 902941255 /nfs/dbraw/zinc/94/12/55/902941255.db2.gz HKBDLENHUJAWGQ-UHFFFAOYSA-N 0 3 405.336 4.016 20 0 HIADHN C[C@H](NC(=O)Nc1ccc(F)cc1OC1CCOCC1)[C@H](c1ccccc1)N(C)C ZINC000488701726 902952077 /nfs/dbraw/zinc/95/20/77/902952077.db2.gz YPDMIWQDAATWGX-KSFYIVLOSA-N 0 3 415.509 4.196 20 0 HIADHN CCC(C)(C)OCc1ccccc1NC(=O)N1CCN(C2CCOCC2)C[C@H]1C ZINC000488802869 903009263 /nfs/dbraw/zinc/00/92/63/903009263.db2.gz RPXXFDYUIUCDLG-GOSISDBHSA-N 0 3 403.567 4.109 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N(Cc3ccco3)CC(F)(F)F)cc2)CC1 ZINC000488826281 903026680 /nfs/dbraw/zinc/02/66/80/903026680.db2.gz JJHCKORRQQGSLX-UHFFFAOYSA-N 0 3 409.452 4.015 20 0 HIADHN COc1ccccc1-c1nc(CN2CCC(CCCN3CCOCC3)CC2)cs1 ZINC000506011597 914686844 /nfs/dbraw/zinc/68/68/44/914686844.db2.gz CBXYIQFUZWQZOY-UHFFFAOYSA-N 0 3 415.603 4.143 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)Nc1ccc(-c2nccs2)cc1 ZINC000489008025 903117103 /nfs/dbraw/zinc/11/71/03/903117103.db2.gz AXCKAFHGUJYNOT-UHFFFAOYSA-N 0 3 422.554 4.089 20 0 HIADHN CC(=O)Nc1cccc(NC(=O)[C@@H](C)N[C@H](COc2ccccc2F)C(C)(C)C)c1 ZINC000489026536 903131151 /nfs/dbraw/zinc/13/11/51/903131151.db2.gz IWAVOAQGAQRXMO-QVKFZJNVSA-N 0 3 415.509 4.194 20 0 HIADHN COc1ccccc1[C@H](C)NC(=O)[C@H](C)N[C@@H](COc1ccccc1F)C(C)(C)C ZINC000489029398 903134583 /nfs/dbraw/zinc/13/45/83/903134583.db2.gz ZICOFUKLCJFRCH-HOIFWPIMSA-N 0 3 416.537 4.483 20 0 HIADHN CC(=O)c1ccc(NC(=O)[C@@H](C)N[C@H](COc2ccccc2F)C(C)(C)C)cc1 ZINC000489033660 903139146 /nfs/dbraw/zinc/13/91/46/903139146.db2.gz IEJWBNSSPXRLSJ-QVKFZJNVSA-N 0 3 400.494 4.439 20 0 HIADHN O=C(NC[C@H](OCc1ccccc1)c1ccc(Cl)cc1)N[C@@H]1CCN(C2CC2)C1 ZINC000489049392 903155004 /nfs/dbraw/zinc/15/50/04/903155004.db2.gz VGEMZFLSEWKZAW-IRLDBZIGSA-N 0 3 413.949 4.134 20 0 HIADHN CCOc1c(Br)cc(Br)cc1CNC[C@@H](O)[C@@H](C)CC ZINC000489064029 903166856 /nfs/dbraw/zinc/16/68/56/903166856.db2.gz JGNZTZRTNIKKRM-IINYFYTJSA-N 0 3 409.162 4.107 20 0 HIADHN CCOc1ccccc1CN(CCCn1ccnc1)Cc1ccc2c(c1)OCCO2 ZINC000506018083 914697028 /nfs/dbraw/zinc/69/70/28/914697028.db2.gz XZQXOHOXRMHNBU-UHFFFAOYSA-N 0 3 407.514 4.146 20 0 HIADHN C[C@H](N[C@@H](COc1ccccc1F)C(C)(C)C)C(=O)Nc1ccc2c(c1)OCCO2 ZINC000489142826 903227670 /nfs/dbraw/zinc/22/76/70/903227670.db2.gz WLZDDMLUGDPQRT-BTYIYWSLSA-N 0 3 416.493 4.007 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)NCCCCOc2ccc(F)cc2)CC1 ZINC000489360356 903345264 /nfs/dbraw/zinc/34/52/64/903345264.db2.gz YCKRFGNYZYHARO-UHFFFAOYSA-N 0 3 413.537 4.291 20 0 HIADHN CCCCC1CCC(NC(=O)NCc2ccccc2CN2CCC(O)CC2)CC1 ZINC000489369224 903347901 /nfs/dbraw/zinc/34/79/01/903347901.db2.gz MVFKZIUUEOKOBF-UHFFFAOYSA-N 0 3 401.595 4.192 20 0 HIADHN CCCCOc1ncccc1CNC(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000489386368 903357859 /nfs/dbraw/zinc/35/78/59/903357859.db2.gz FSJAXVIKLOZLEX-UHFFFAOYSA-N 0 3 410.562 4.067 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)Nc2nc(CN3CCCCC3)cs2)c1 ZINC000489428511 903379448 /nfs/dbraw/zinc/37/94/48/903379448.db2.gz YDVFMWCKNKBSQQ-UHFFFAOYSA-N 0 3 415.607 4.033 20 0 HIADHN C[C@H](NC(=O)NCc1ccccc1CN1CCC(O)CC1)[C@@H](C)C1CCCCC1 ZINC000489492622 903420195 /nfs/dbraw/zinc/42/01/95/903420195.db2.gz QVBKJUPFWGBVLD-MOPGFXCFSA-N 0 3 401.595 4.047 20 0 HIADHN CCOc1ccc(-c2nc(CN3CCC(CCCN4CCOCC4)CC3)co2)cc1 ZINC000506031553 914715731 /nfs/dbraw/zinc/71/57/31/914715731.db2.gz MFDUAFXVXRSBIK-UHFFFAOYSA-N 0 3 413.562 4.065 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NC(C)(C)c3ccccc3OC)c(C)c2)CC1 ZINC000489540736 903452817 /nfs/dbraw/zinc/45/28/17/903452817.db2.gz WYYBFWRIGLHJHA-UHFFFAOYSA-N 0 3 410.562 4.202 20 0 HIADHN c1ccc(CN2CCOCC2)c(CN[C@H]2CCCOc3cc4c(cc32)CCCC4)c1 ZINC000489549799 903458204 /nfs/dbraw/zinc/45/82/04/903458204.db2.gz IKXLROSJKWFILK-VWLOTQADSA-N 0 3 406.570 4.401 20 0 HIADHN c1cc(CN[C@H]2CCCOc3cc4c(cc32)CCCC4)cc(CN2CCOCC2)c1 ZINC000489574621 903472771 /nfs/dbraw/zinc/47/27/71/903472771.db2.gz SJVZLTGGIZHBAM-VWLOTQADSA-N 0 3 406.570 4.401 20 0 HIADHN C[C@@H](NCCCS(=O)(=O)c1ccccc1)c1ccc(Br)c(F)c1 ZINC000489576533 903474253 /nfs/dbraw/zinc/47/42/53/903474253.db2.gz ZWMKZPSTMDHCHX-CYBMUJFWSA-N 0 3 400.313 4.103 20 0 HIADHN C[C@H](c1nc2ccccc2n1C(F)F)N1CCC(CCCN2CCOCC2)CC1 ZINC000506035320 914721287 /nfs/dbraw/zinc/72/12/87/914721287.db2.gz FRJONJOKZXESTN-QGZVFWFLSA-N 0 3 406.521 4.317 20 0 HIADHN CCCN(C(=O)NCc1ccccc1CN1CCC(O)CC1)[C@@H]1CCc2ccccc21 ZINC000489710215 903552361 /nfs/dbraw/zinc/55/23/61/903552361.db2.gz HUGUUYLAVYLHQX-RUZDIDTESA-N 0 3 421.585 4.252 20 0 HIADHN Cc1ccc(C)c([C@@H](C)N(C)C(=O)NCc2ccccc2CN2CCC(O)CC2)c1 ZINC000489763275 903587264 /nfs/dbraw/zinc/58/72/64/903587264.db2.gz MRGQHRVZMQWOCX-HXUWFJFHSA-N 0 3 409.574 4.163 20 0 HIADHN Cc1ccc(C)c([C@H](C)N(C)C(=O)NCc2ccccc2CN2CCC(O)CC2)c1 ZINC000489763274 903587671 /nfs/dbraw/zinc/58/76/71/903587671.db2.gz MRGQHRVZMQWOCX-FQEVSTJZSA-N 0 3 409.574 4.163 20 0 HIADHN CC(C)c1ccc([C@H](NC(=O)N2CC[C@H](N3CCN(C)CC3)[C@@H](C)C2)C(C)C)cc1 ZINC000489867538 903640523 /nfs/dbraw/zinc/64/05/23/903640523.db2.gz AXJJDRKMSMELJP-NKKJXINNSA-N 0 3 414.638 4.175 20 0 HIADHN CNC(=O)[C@H](CCSC)N[C@H]1CCCc2nc(-c3ccc(Cl)cc3)sc21 ZINC000489907356 903665301 /nfs/dbraw/zinc/66/53/01/903665301.db2.gz LCCGYIWYHMAGHT-HOCLYGCPSA-N 0 3 410.008 4.298 20 0 HIADHN Cc1cccc2c1[C@H](C)C[C@H]2CC(=O)Nc1ccccc1CN1CCC[C@H](C(N)=O)C1 ZINC000489909155 903666963 /nfs/dbraw/zinc/66/69/63/903666963.db2.gz GRQSDDFJRRSULD-GIVPXCGWSA-N 0 3 419.569 4.312 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)CCCCC(=O)c3ccc(F)cc3)c2)CC1 ZINC000490103261 903772004 /nfs/dbraw/zinc/77/20/04/903772004.db2.gz ZZXZDGOZZJPIQN-UHFFFAOYSA-N 0 3 411.521 4.349 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](NCCc2ccc(O)cc2)c2ccc(Cl)cc2)c1 ZINC000490142790 903789409 /nfs/dbraw/zinc/78/94/09/903789409.db2.gz JWYZEAMOZCDEQU-JOCHJYFZSA-N 0 3 415.942 4.371 20 0 HIADHN CN(C)C(=O)[C@@H]1CCCN1CCCN[C@H](c1ccc(F)cc1)c1ccccc1Cl ZINC000490158057 903800015 /nfs/dbraw/zinc/80/00/15/903800015.db2.gz QAEIIPGQHGVIID-FCHUYYIVSA-N 0 3 417.956 4.101 20 0 HIADHN CN(C)C(=O)[C@H]1CCCN1CCCN[C@@H](c1ccc(F)cc1)c1ccccc1Cl ZINC000490158060 903800414 /nfs/dbraw/zinc/80/04/14/903800414.db2.gz QAEIIPGQHGVIID-YADHBBJMSA-N 0 3 417.956 4.101 20 0 HIADHN CCCS(=O)(=O)N1CCC(N[C@H](c2ccc(F)cc2)c2ccccc2Cl)CC1 ZINC000490167993 903806713 /nfs/dbraw/zinc/80/67/13/903806713.db2.gz PZHMMPSOSFFDFY-OAQYLSRUSA-N 0 3 424.969 4.362 20 0 HIADHN Cc1ccc([C@H](NC[C@@H](C(C)C)N2CCCC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000490172562 903810401 /nfs/dbraw/zinc/81/04/01/903810401.db2.gz ONVFAWQZAXVAOE-ZEQRLZLVSA-N 0 3 414.615 4.198 20 0 HIADHN CC[C@@H](CN[C@@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1)N1CCCC1 ZINC000490173521 903810718 /nfs/dbraw/zinc/81/07/18/903810718.db2.gz WAMNKSGSUHKOEZ-UNMCSNQZSA-N 0 3 421.006 4.297 20 0 HIADHN CCc1ccc([C@H](NCCN2CCC(C)CC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000490191323 903818817 /nfs/dbraw/zinc/81/88/17/903818817.db2.gz RNWJMZACKXNJOJ-DEOSSOPVSA-N 0 3 414.615 4.063 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)Cc3csc(-c4ccc(Cl)cc4Cl)n3)[C@H]2C1 ZINC000490212629 903830096 /nfs/dbraw/zinc/83/00/96/903830096.db2.gz MHCSUKJPVPTQSI-PXAZEXFGSA-N 0 3 410.370 4.212 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)Cc3csc(-c4ccc(Cl)cc4Cl)n3)[C@@H]2C1 ZINC000490212632 903830187 /nfs/dbraw/zinc/83/01/87/903830187.db2.gz MHCSUKJPVPTQSI-YVEFUNNKSA-N 0 3 410.370 4.212 20 0 HIADHN Cc1ccc2nc([C@@H]3CCCN3C(=O)NC[C@@H](C)N3CCc4ccccc4C3)[nH]c2c1 ZINC000490303143 903891037 /nfs/dbraw/zinc/89/10/37/903891037.db2.gz ZYSQHVJXLLXLAE-JPYJTQIMSA-N 0 3 417.557 4.165 20 0 HIADHN CC(C)(NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1ccccc1F ZINC000490356435 903949059 /nfs/dbraw/zinc/94/90/59/903949059.db2.gz YZNOWEUFTSJHPI-UHFFFAOYSA-N 0 3 401.448 4.165 20 0 HIADHN CCCN(CCC)C(=O)c1cccc(C(=O)N(CC(C)C)C2CCN(C)CC2)c1 ZINC000490435002 904007704 /nfs/dbraw/zinc/00/77/04/904007704.db2.gz RKQHCNLLEOLWSO-UHFFFAOYSA-N 0 3 401.595 4.141 20 0 HIADHN O=C(NC[C@H]1CN(Cc2ccccc2)CCCO1)Nc1ccc(-c2ccco2)cc1F ZINC000490510599 904060141 /nfs/dbraw/zinc/06/01/41/904060141.db2.gz VMYBZRZZKKQZEN-FQEVSTJZSA-N 0 3 423.488 4.498 20 0 HIADHN CN(C(=O)Nc1cc(F)cc(Br)c1F)[C@H]1CCN(Cc2ccccc2)C1 ZINC000490509547 904060358 /nfs/dbraw/zinc/06/03/58/904060358.db2.gz JCYGHDZHWMQGRN-HNNXBMFYSA-N 0 3 424.289 4.466 20 0 HIADHN Cn1nc(-c2ccc(Cl)s2)cc1NC(=O)N1CCN(C2CCCCC2)CC1 ZINC000490557955 904099070 /nfs/dbraw/zinc/09/90/70/904099070.db2.gz RPCOQNPLNIXCEZ-UHFFFAOYSA-N 0 3 407.971 4.284 20 0 HIADHN O=C1C[C@@H]([C@@H]2CCCCN2Cc2csc(-c3cccc(Br)c3)n2)CN1 ZINC000490668637 904164539 /nfs/dbraw/zinc/16/45/39/904164539.db2.gz CKYPCJDQKMSZSB-PBHICJAKSA-N 0 3 420.376 4.063 20 0 HIADHN C[C@H](CNC(=O)Nc1ccc(CCN2CCSCC2)cc1)c1ccc(F)cc1 ZINC000490952966 904332780 /nfs/dbraw/zinc/33/27/80/904332780.db2.gz TXQFLMFLCQBQPJ-QGZVFWFLSA-N 0 3 401.551 4.342 20 0 HIADHN C[C@@H](CNC(=O)Nc1ccc(CCN2CCSCC2)cc1)c1ccc(F)cc1 ZINC000490952961 904332811 /nfs/dbraw/zinc/33/28/11/904332811.db2.gz TXQFLMFLCQBQPJ-KRWDZBQOSA-N 0 3 401.551 4.342 20 0 HIADHN CCc1ccc([C@@H](NC[C@H](O)C2CCCCC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000491005392 904365605 /nfs/dbraw/zinc/36/56/05/904365605.db2.gz KQOJGSDLEITBNM-BJKOFHAPSA-N 0 3 415.599 4.273 20 0 HIADHN CCOc1ccc([C@@H](N[C@@H](C)CN2CCN(C)CC2)c2ccccc2Cl)cc1 ZINC000491024568 904374701 /nfs/dbraw/zinc/37/47/01/904374701.db2.gz UEFHSIQMLYSHPN-FDDCHVKYSA-N 0 3 401.982 4.054 20 0 HIADHN COCCN1CCC[C@@H]1CN[C@@H](c1ccc(OC)c(OC)c1)c1ccccc1Cl ZINC000491027462 904378637 /nfs/dbraw/zinc/37/86/37/904378637.db2.gz BABDXGJCLLDYAD-JPYJTQIMSA-N 0 3 418.965 4.147 20 0 HIADHN CCc1ccc([C@H](NCCN(C)C2CCCC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000491033705 904385396 /nfs/dbraw/zinc/38/53/96/904385396.db2.gz FUYJZXKWXOWHEC-DEOSSOPVSA-N 0 3 414.615 4.206 20 0 HIADHN CCc1ccc([C@@H](NCCN(C)C2CCCC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000491033707 904386030 /nfs/dbraw/zinc/38/60/30/904386030.db2.gz FUYJZXKWXOWHEC-XMMPIXPASA-N 0 3 414.615 4.206 20 0 HIADHN CC[C@H](C)N(C)CCN[C@@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000491050969 904394982 /nfs/dbraw/zinc/39/49/82/904394982.db2.gz IKNXKYNMIJFFCD-KKSFZXQISA-N 0 3 408.995 4.153 20 0 HIADHN CC[C@@H](C)N(C)CCN[C@@H](c1cccc(S(C)(=O)=O)c1)c1ccc(C)cc1C ZINC000491050409 904396023 /nfs/dbraw/zinc/39/60/23/904396023.db2.gz HPJUCVGRTOTHFS-XXBNENTESA-N 0 3 402.604 4.116 20 0 HIADHN C[C@H](CN[C@@H](c1ccccc1Cl)c1cc(F)ccc1F)CN1CCN(C)CC1 ZINC000491061574 904405328 /nfs/dbraw/zinc/40/53/28/904405328.db2.gz RQYOBUWMOZTAIS-ZHRRBRCNSA-N 0 3 407.936 4.181 20 0 HIADHN O=C(C1CCN(Cc2ccc(-c3cccc(Cl)c3Cl)o2)CC1)N1CCOCC1 ZINC000506116316 914809293 /nfs/dbraw/zinc/80/92/93/914809293.db2.gz VCEBBMLYJBZTKF-UHFFFAOYSA-N 0 3 423.340 4.324 20 0 HIADHN O=C(Nc1cc(F)c(OC(F)F)cc1F)N1CCN(CC2CCCCC2)CC1 ZINC000491246935 904500559 /nfs/dbraw/zinc/50/05/59/904500559.db2.gz LVWZXEHIRIJSOL-UHFFFAOYSA-N 0 3 403.420 4.296 20 0 HIADHN Cc1ccc([C@@H](NC2CCN(C3CC3)CC2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000491270912 904512821 /nfs/dbraw/zinc/51/28/21/904512821.db2.gz LCRNNEQRVNAOFU-DEOSSOPVSA-N 0 3 412.599 4.013 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)Nc2cc(F)c(OC(F)F)cc2F)c1 ZINC000491299792 904523934 /nfs/dbraw/zinc/52/39/34/904523934.db2.gz VDIXVOAJAQOCRN-UHFFFAOYSA-N 0 3 413.415 4.470 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)Nc3ccc(Br)c(C(F)(F)F)c3)[C@H]2C1 ZINC000491297189 904524443 /nfs/dbraw/zinc/52/44/43/904524443.db2.gz SXLRYGIDSCZWAO-YGRLFVJLSA-N 0 3 406.246 4.026 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](NCCc2ccccn2)c2ccc(Cl)cc2)c1 ZINC000491306686 904527359 /nfs/dbraw/zinc/52/73/59/904527359.db2.gz OXUTWOFQANBNIR-OAQYLSRUSA-N 0 3 400.931 4.060 20 0 HIADHN CC[C@H](C)[C@H](NC(=O)N1CC[C@H](N2CCN(C)CC2)[C@@H](C)C1)c1ccc(Cl)cc1 ZINC000491313026 904530531 /nfs/dbraw/zinc/53/05/31/904530531.db2.gz RROISDKEDITUEV-GPHNJDIKSA-N 0 3 421.029 4.095 20 0 HIADHN COc1ccc(CN2CCC[C@@H](c3nnc4ccc(C(F)(F)F)cn43)C2)c(OC)c1 ZINC000506141308 914820771 /nfs/dbraw/zinc/82/07/71/914820771.db2.gz TZZONUIHAQNNDP-OAHLLOKOSA-N 0 3 420.435 4.145 20 0 HIADHN COc1ccc([C@@H](CN[C@@H](c2cnn(C)c2)c2cccc(F)c2)N2CCCCC2)cc1 ZINC000491370360 904561906 /nfs/dbraw/zinc/56/19/06/904561906.db2.gz ZSVPBJOARPUCBN-JWQCQUIFSA-N 0 3 422.548 4.474 20 0 HIADHN COc1ccccc1-c1ncc(CNC[C@@H](OC(C)C)c2ccccc2OC)cn1 ZINC000491390295 904573925 /nfs/dbraw/zinc/57/39/25/904573925.db2.gz SZFCQRAXRCAPDV-HSZRJFAPSA-N 0 3 407.514 4.417 20 0 HIADHN Cc1ccc([C@H](NC[C@H]2Cc3ccccc3O2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000491392922 904574211 /nfs/dbraw/zinc/57/42/11/904574211.db2.gz BIFXEUBNLRFLOG-QPPBQGQZSA-N 0 3 407.535 4.081 20 0 HIADHN CCc1ccc([C@@H](NCCN2CCCCCC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000491395157 904575882 /nfs/dbraw/zinc/57/58/82/904575882.db2.gz INEFONPJVVTOPZ-XMMPIXPASA-N 0 3 414.615 4.208 20 0 HIADHN Cc1nc2ccccn2c1CN1CCC[C@H](c2nnc3ccc(C(F)(F)F)cn32)C1 ZINC000506148127 914824244 /nfs/dbraw/zinc/82/42/44/914824244.db2.gz PAIFOWJLTSGGHR-HNNXBMFYSA-N 0 3 414.435 4.084 20 0 HIADHN COc1ccc([C@@H](NC[C@H](c2ccc(C)o2)N2CCOCC2)c2ccc(F)cc2)cc1 ZINC000491410827 904583306 /nfs/dbraw/zinc/58/33/06/904583306.db2.gz RZZJDXYNMHAONC-NOZRDPDXSA-N 0 3 424.516 4.488 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Nc1cc(F)c(OC(F)F)cc1F ZINC000491413551 904585841 /nfs/dbraw/zinc/58/58/41/904585841.db2.gz MQLQWTSDCGKOTR-UHFFFAOYSA-N 0 3 405.417 4.223 20 0 HIADHN Cc1ccc2ncc(CN3CCC[C@H](c4nnc5ccc(C(F)(F)F)cn54)C3)n2c1 ZINC000506149063 914825012 /nfs/dbraw/zinc/82/50/12/914825012.db2.gz VVCBCJNHFOUDPW-HNNXBMFYSA-N 0 3 414.435 4.084 20 0 HIADHN COc1ccc([C@@H](NCc2ccc(CN3CCOCC3)cc2)c2ccccc2)cc1 ZINC000491425212 904591647 /nfs/dbraw/zinc/59/16/47/904591647.db2.gz ZZZFXDJPDCBXOL-SANMLTNESA-N 0 3 402.538 4.407 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)N(CCN(C)C)Cc2cccc(C)c2)c(C)c1 ZINC000491479869 904616847 /nfs/dbraw/zinc/61/68/47/904616847.db2.gz NLMLNYMXVLZPLK-FQEVSTJZSA-N 0 3 424.589 4.427 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)Nc2cccc(C(=O)NC(C)(C)C)c2)c1 ZINC000491493068 904624494 /nfs/dbraw/zinc/62/44/94/904624494.db2.gz YMUOJPPXGRUZJM-UHFFFAOYSA-N 0 3 410.562 4.119 20 0 HIADHN C[C@@H](c1ccccc1Br)N(C)C(=O)NC[C@@H](c1ccccc1)N(C)C ZINC000506167259 914831467 /nfs/dbraw/zinc/83/14/67/914831467.db2.gz UVBYILDENVXFPD-KXBFYZLASA-N 0 3 404.352 4.454 20 0 HIADHN COc1ccc([C@@H](CNC(=O)NCc2ccc3[nH]c(C)cc3c2)N2CCCC2)cc1 ZINC000506172721 914833134 /nfs/dbraw/zinc/83/31/34/914833134.db2.gz FYJPNQPCWYGVIS-HSZRJFAPSA-N 0 3 406.530 4.121 20 0 HIADHN Cc1noc(C)c1[C@@H](C)CNC(=O)NC[C@H](c1cccs1)N1CCC(C)CC1 ZINC000506182374 914836731 /nfs/dbraw/zinc/83/67/31/914836731.db2.gz FWYMONBBMOIWSN-MAUKXSAKSA-N 0 3 404.580 4.229 20 0 HIADHN CCN(CC)C(=O)Cc1ccc(NC(=O)N(CCN(C)C)Cc2cccc(C)c2)cc1 ZINC000491869129 904716435 /nfs/dbraw/zinc/71/64/35/904716435.db2.gz UUWLYCDFVLSYBG-UHFFFAOYSA-N 0 3 424.589 4.002 20 0 HIADHN COC[C@@H](NCc1ccccc1CN1C[C@@H](C)O[C@@H](C)C1)c1ccc(Cl)cc1 ZINC000491906976 904726819 /nfs/dbraw/zinc/72/68/19/904726819.db2.gz CBUUMSMWWMKATH-IEGUWTFLSA-N 0 3 402.966 4.427 20 0 HIADHN C[C@@H]1[C@H](NC(=O)N[C@H](c2ccccc2)c2ccncc2)CCN1Cc1ccccc1 ZINC000491997523 904754822 /nfs/dbraw/zinc/75/48/22/904754822.db2.gz ILSFZDHVGHEDSQ-CTUHWIOQSA-N 0 3 400.526 4.133 20 0 HIADHN CNC(=O)c1cc(Oc2cccc(NC3CCN(CCC(F)(F)F)CC3)c2)ccn1 ZINC000492021087 904762931 /nfs/dbraw/zinc/76/29/31/904762931.db2.gz DVAIVQBBATYNIL-UHFFFAOYSA-N 0 3 422.451 4.062 20 0 HIADHN CC[C@H](C)[C@@](C)(O)CN[C@@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000492177786 904811113 /nfs/dbraw/zinc/81/11/13/904811113.db2.gz INCBPPZZTDLUMZ-JHVJFLLYSA-N 0 3 409.979 4.220 20 0 HIADHN Cc1nc(C)c(CCN[C@@H](c2ccc(C)cc2)c2cccc(S(C)(=O)=O)c2)s1 ZINC000492196270 904813933 /nfs/dbraw/zinc/81/39/33/904813933.db2.gz NARCMVFZLVMUIX-QFIPXVFZSA-N 0 3 414.596 4.394 20 0 HIADHN COc1ccc(CN[C@@H]2CCN(c3ccccc3F)C2)c(OCc2cccnc2)c1 ZINC000492206308 904814828 /nfs/dbraw/zinc/81/48/28/904814828.db2.gz CFIJCDGNRHABGS-HXUWFJFHSA-N 0 3 407.489 4.177 20 0 HIADHN CC[C@H](C)[C@@](C)(O)CN[C@H](c1cccc(S(C)(=O)=O)c1)c1ccc(C)cc1C ZINC000492227159 904819677 /nfs/dbraw/zinc/81/96/77/904819677.db2.gz YFXNJOLCGLIVPR-NMNUPHIUSA-N 0 3 403.588 4.183 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)Nc3ccc(Oc4cccc(C(F)(F)F)n4)cc3)[C@@H]2C1 ZINC000492236523 904820638 /nfs/dbraw/zinc/82/06/38/904820638.db2.gz IBUKSLTUWZGLKD-WMLDXEAASA-N 0 3 420.435 4.451 20 0 HIADHN COCCc1ccc(Oc2ccc(NC(=O)N3CC[C@@H]4CCN(C)C[C@@H]43)cc2)cc1 ZINC000492236724 904822115 /nfs/dbraw/zinc/82/21/15/904822115.db2.gz KTKBFHMGUMLLEZ-CVDCTZTESA-N 0 3 409.530 4.226 20 0 HIADHN CCNC(=O)COc1ccc(CN[C@H]2CCCc3sc(Cl)cc32)cc1OC ZINC000492336708 904836866 /nfs/dbraw/zinc/83/68/66/904836866.db2.gz WVSHDPQQFUMAMH-HNNXBMFYSA-N 0 3 408.951 4.092 20 0 HIADHN CCCN(C)[C@H](CNC(=O)C(=O)Nc1cnc2ccccc2c1)c1ccc(Cl)cc1 ZINC000506223610 914851002 /nfs/dbraw/zinc/85/10/02/914851002.db2.gz MQUJTEMHPZBIJZ-OAQYLSRUSA-N 0 3 424.932 4.026 20 0 HIADHN CN(C)c1nc2sc(C(=O)NC[C@@H]3CCCN(Cc4cccs4)C3)cc2s1 ZINC000492728768 904895246 /nfs/dbraw/zinc/89/52/46/904895246.db2.gz PXSLVCYARMVODN-ZDUSSCGKSA-N 0 3 420.629 4.127 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](NCCc2ccncc2)c2ccc(Cl)cc2)c1 ZINC000493074907 905009723 /nfs/dbraw/zinc/00/97/23/905009723.db2.gz AHRDIQPTBNHPOM-OAQYLSRUSA-N 0 3 400.931 4.060 20 0 HIADHN Cc1nc(CCN[C@H](c2ccc(C)cc2)c2cccc(S(C)(=O)=O)c2)sc1C ZINC000493077896 905011663 /nfs/dbraw/zinc/01/16/63/905011663.db2.gz IQXXVTVMGZCNOU-JOCHJYFZSA-N 0 3 414.596 4.394 20 0 HIADHN COc1cccc(CCN[C@@H](c2cccc(S(C)(=O)=O)c2)c2ccc(C)cc2C)n1 ZINC000493103549 905018899 /nfs/dbraw/zinc/01/88/99/905018899.db2.gz JAYDPLRIZXUJJN-DEOSSOPVSA-N 0 3 424.566 4.032 20 0 HIADHN CCC(CC)(CCO)CN[C@H](c1ccc(F)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000493132083 905027218 /nfs/dbraw/zinc/02/72/18/905027218.db2.gz RPQKPKMYJCAVPW-OAQYLSRUSA-N 0 3 407.551 4.097 20 0 HIADHN Cc1ccc([C@H](NC[C@@]2(C)CCCC[C@@H]2O)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000493176850 905040655 /nfs/dbraw/zinc/04/06/55/905040655.db2.gz PIUJVDMZSXJPCL-RBZQAINGSA-N 0 3 415.599 4.327 20 0 HIADHN C[C@]1(CN[C@@H](c2ccc(Cl)cc2)c2cccc(S(C)(=O)=O)c2)CCCC[C@@H]1O ZINC000493180066 905042607 /nfs/dbraw/zinc/04/26/07/905042607.db2.gz XQJXJPOVGMATMV-FDFHNCONSA-N 0 3 421.990 4.364 20 0 HIADHN COc1cc(CN2CCN(CCc3ccccc3)CC2)ccc1OCc1ccncc1 ZINC000506257989 914868092 /nfs/dbraw/zinc/86/80/92/914868092.db2.gz DFQYJLAXDLEFMH-UHFFFAOYSA-N 0 3 417.553 4.030 20 0 HIADHN COCC(=O)N1CCC(N[C@H](c2ccc(F)c(C)c2)c2ccccc2Cl)CC1 ZINC000493245803 905066184 /nfs/dbraw/zinc/06/61/84/905066184.db2.gz FLBZLWLRLSCFMP-JOCHJYFZSA-N 0 3 404.913 4.104 20 0 HIADHN CC(C)(CO)CCCN[C@@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000493275746 905071599 /nfs/dbraw/zinc/07/15/99/905071599.db2.gz BQDAJWSKZKHDML-FQEVSTJZSA-N 0 3 409.979 4.221 20 0 HIADHN Fc1cccc([C@@H](NCCCO[C@@H]2CCOC2)c2cccc(Br)c2)c1 ZINC000493275676 905071947 /nfs/dbraw/zinc/07/19/47/905071947.db2.gz AVSRSEONBOJSPM-UXHICEINSA-N 0 3 408.311 4.463 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)c2ccnc(SCC(F)(F)F)c2)C1 ZINC000493387816 905102413 /nfs/dbraw/zinc/10/24/13/905102413.db2.gz RKJCUPMMTABYKO-PBHICJAKSA-N 0 3 409.477 4.301 20 0 HIADHN Cc1cc(-c2cc(C(=O)N3CC[C@H]4CCN(C)C[C@@H]43)c3cnn(C(C)C)c3n2)c(C)o1 ZINC000493481813 905138523 /nfs/dbraw/zinc/13/85/23/905138523.db2.gz QRDYSKMUSXUDFQ-VGSWGCGISA-N 0 3 421.545 4.055 20 0 HIADHN Cc1ccc(-c2cc(C(=O)N3CC[C@H]4CCN(C)C[C@H]43)c3cnn(C(C)C)c3n2)cc1 ZINC000493533786 905150477 /nfs/dbraw/zinc/15/04/77/905150477.db2.gz DCJDWLBAWTZGDW-AUSIDOKSSA-N 0 3 417.557 4.154 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)CCc3c4ccccc4[nH]c3-c3ccc(F)cc3)[C@H]2C1 ZINC000493536802 905152027 /nfs/dbraw/zinc/15/20/27/905152027.db2.gz MPJYPAWZENCHHB-HXOBKFHXSA-N 0 3 405.517 4.459 20 0 HIADHN COc1cc(C(=O)N2CC[C@H]3CCN(C)C[C@@H]32)ccc1OCc1ccccc1Cl ZINC000493556358 905160635 /nfs/dbraw/zinc/16/06/35/905160635.db2.gz PZQIHACJVIJISW-UZLBHIALSA-N 0 3 414.933 4.094 20 0 HIADHN Cc1cc(NC(=O)N2CC[C@@H]3CCN(C)C[C@H]32)nn1-c1ccc(Cl)c(Cl)c1 ZINC000493984640 905327312 /nfs/dbraw/zinc/32/73/12/905327312.db2.gz UHZIKNPABFYSQR-SUMWQHHRSA-N 0 3 408.333 4.045 20 0 HIADHN CC(C)c1noc(-c2ccccc2C(=O)N[C@@H]2CCN(Cc3ccccc3)[C@@H]2C)n1 ZINC000493997612 905339328 /nfs/dbraw/zinc/33/93/28/905339328.db2.gz ATVQAOMRCCFPJZ-DYESRHJHSA-N 0 3 404.514 4.253 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](N[C@@H]2CCOC3(CCCC3)C2)c2ccc(F)cc2)c1 ZINC000494003753 905344501 /nfs/dbraw/zinc/34/45/01/905344501.db2.gz LYDNDUWGXSQNFN-IFMALSPDSA-N 0 3 417.546 4.400 20 0 HIADHN Cc1ccc([C@H](NCC(C)(C)C[C@H](C)O)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000494019024 905356420 /nfs/dbraw/zinc/35/64/20/905356420.db2.gz GRBNSHBUBIXHAC-PGRDOPGGSA-N 0 3 403.588 4.183 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)c2cccc(NC(=O)c3cccs3)c2)CCN1Cc1ccccc1 ZINC000494037880 905378833 /nfs/dbraw/zinc/37/88/33/905378833.db2.gz LZOQODQFFZWQLJ-UTKZUKDTSA-N 0 3 419.550 4.393 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)[C@H]2CCn3c(cnc3C3CCCCC3)C2)CCN1Cc1ccccc1 ZINC000494039991 905383151 /nfs/dbraw/zinc/38/31/51/905383151.db2.gz WEZBRWFRHUXUEY-UCFCWBNQSA-N 0 3 420.601 4.272 20 0 HIADHN Cc1nc(C(F)(F)F)ccc1NC(=O)c1ccc(N2CCN(C(C)C)CC2)cc1 ZINC000512410565 921142773 /nfs/dbraw/zinc/14/27/73/921142773.db2.gz HUPVIRBQHQYGTB-UHFFFAOYSA-N 0 3 406.452 4.192 20 0 HIADHN Cc1ccc(C(F)(F)F)cc1NC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1CO ZINC000494109501 905450850 /nfs/dbraw/zinc/45/08/50/905450850.db2.gz UMKGBMIHFKFDRP-PKOBYXMFSA-N 0 3 421.463 4.018 20 0 HIADHN C[C@@H]1CN(C(=O)c2csc(-c3ccc(Cl)cc3)c2)CC[C@@H]1N1CCN(C)CC1 ZINC000494131093 905476571 /nfs/dbraw/zinc/47/65/71/905476571.db2.gz PENFYEQJBOOHQM-UZLBHIALSA-N 0 3 418.006 4.167 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)N[C@@H](C)c2nc(C(F)(F)F)cs2)N(C)C)cc1 ZINC000494175637 905512058 /nfs/dbraw/zinc/51/20/58/905512058.db2.gz JMABFJHSVMAQSI-SWLSCSKDSA-N 0 3 414.497 4.387 20 0 HIADHN CC1(C)Cc2ccc(Br)cc2[C@@H]1NCc1cnc(N2CCOCC2)s1 ZINC000494310546 905625369 /nfs/dbraw/zinc/62/53/69/905625369.db2.gz KKMOHNJYZNIMPZ-KRWDZBQOSA-N 0 3 422.392 4.155 20 0 HIADHN COCCN(C)c1ccc(CN[C@@H]2c3cc(Br)ccc3CC2(C)C)cn1 ZINC000494325250 905636622 /nfs/dbraw/zinc/63/66/22/905636622.db2.gz DBSOTKCYJCCGML-HXUWFJFHSA-N 0 3 418.379 4.340 20 0 HIADHN O=C(NC[C@@H]1CCCN(Cc2c[nH]nc2-c2cccs2)C1)Nc1cccc(F)c1 ZINC000512444634 921166354 /nfs/dbraw/zinc/16/63/54/921166354.db2.gz QRZHODVEZWZJSY-HNNXBMFYSA-N 0 3 413.522 4.311 20 0 HIADHN Cc1ccnc(-c2n[nH]c([C@H](C)N[C@H](C)Cc3ccc(Br)cc3)n2)c1 ZINC000494407743 905697807 /nfs/dbraw/zinc/69/78/07/905697807.db2.gz UWBUXYSNSSRVPS-KGLIPLIRSA-N 0 3 400.324 4.219 20 0 HIADHN O=C(Nc1cnccc1Oc1ccccc1)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000494442894 905726736 /nfs/dbraw/zinc/72/67/36/905726736.db2.gz OXKYMAQQYAJFBZ-UHFFFAOYSA-N 0 3 417.509 4.331 20 0 HIADHN CC(C)S(=O)(=O)c1ccc(CN[C@H]2CCO[C@H]2c2ccc(Cl)c(F)c2)cc1 ZINC000494478071 905758511 /nfs/dbraw/zinc/75/85/11/905758511.db2.gz RWALYPPOGNPCJD-PMACEKPBSA-N 0 3 411.926 4.281 20 0 HIADHN Cc1ccc(N[C@H]2CCN(Cc3ccccn3)C[C@H]2C)cc1C(=O)N1CCCCC1 ZINC000494484318 905768369 /nfs/dbraw/zinc/76/83/69/905768369.db2.gz PURBTVRUGGXLOG-YKSBVNFPSA-N 0 3 406.574 4.339 20 0 HIADHN CC(C)CNC(=O)c1cccc(CN[C@@H]2CCO[C@H]2c2ccc(Cl)c(F)c2)c1 ZINC000494490141 905775150 /nfs/dbraw/zinc/77/51/50/905775150.db2.gz XQZYLZFRADKQQD-RTWAWAEBSA-N 0 3 404.913 4.485 20 0 HIADHN CC[C@H](N[C@H]1CCO[C@@H]1c1ccc(Cl)c(F)c1)C(=O)Nc1ccc(OC)cc1 ZINC000494499333 905787817 /nfs/dbraw/zinc/78/78/17/905787817.db2.gz ZFFIWGBQHMSPRL-SLFFLAALSA-N 0 3 406.885 4.325 20 0 HIADHN Cc1ccc(NC(=O)NC[C@H]2CCCN(Cc3cnc(-c4ccccc4)[nH]3)C2)cc1 ZINC000512464370 921178947 /nfs/dbraw/zinc/17/89/47/921178947.db2.gz WXBKRTNZBXBWGH-LJQANCHMSA-N 0 3 403.530 4.419 20 0 HIADHN CCN(Cc1ccc(OCc2cccs2)c(OC)c1)C(=O)[C@H]1CCCN1C1CC1 ZINC000494583014 905848943 /nfs/dbraw/zinc/84/89/43/905848943.db2.gz COKGVNRAMGAAOZ-HXUWFJFHSA-N 0 3 414.571 4.311 20 0 HIADHN CCSc1ccc([C@H](C)NC(=O)N[C@@H](CN(C)C)c2ccc(OC)cc2)cc1 ZINC000494599792 905856368 /nfs/dbraw/zinc/85/63/68/905856368.db2.gz HRORIEYCWXUAIC-KKSFZXQISA-N 0 3 401.576 4.470 20 0 HIADHN CC(C)c1ccc(/C=C/CC(=O)NCc2ccccc2CN2CCC(O)CC2)cc1 ZINC000494632335 905874539 /nfs/dbraw/zinc/87/45/39/905874539.db2.gz RPGWMJFLRJTWLP-AATRIKPKSA-N 0 3 406.570 4.486 20 0 HIADHN Cc1cc(NC(=O)Nc2cc(C(C)C)[nH]n2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000494649785 905882464 /nfs/dbraw/zinc/88/24/64/905882464.db2.gz NTPMGVZCJBRDBS-GOSISDBHSA-N 0 3 407.522 4.129 20 0 HIADHN COc1ccccc1SC[C@@H](C)CNC(=O)N[C@H](CN(C)C)c1ccc(F)cc1 ZINC000494695574 905902863 /nfs/dbraw/zinc/90/28/63/905902863.db2.gz DPEDIPTVSRZCBH-QFBILLFUSA-N 0 3 419.566 4.165 20 0 HIADHN CCOc1cc(CN2CCC[C@@H](CNC(=O)Nc3cccc(F)c3)C2)ccc1OC ZINC000512480516 921189288 /nfs/dbraw/zinc/18/92/88/921189288.db2.gz OLUKRSWUSDXONR-SFHVURJKSA-N 0 3 415.509 4.267 20 0 HIADHN C[C@H]1CN(C2CCOCC2)CCN1C(=O)N[C@@H](CCc1ccccc1)c1ccccc1 ZINC000494703992 905908926 /nfs/dbraw/zinc/90/89/26/905908926.db2.gz PFHLZQKDFQPEHV-OFVILXPXSA-N 0 3 421.585 4.255 20 0 HIADHN CC(C)[C@H](O)C(C)(C)CN[C@@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000494711389 905914785 /nfs/dbraw/zinc/91/47/85/905914785.db2.gz BDGCNOHDLSEDBO-SFTDATJTSA-N 0 3 424.006 4.466 20 0 HIADHN Cc1ccc([C@@H](NCC(C)(C)[C@@H](O)C(C)C)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000494715189 905918589 /nfs/dbraw/zinc/91/85/89/905918589.db2.gz MPYFWOZLFZDMMZ-GOTSBHOMSA-N 0 3 417.615 4.429 20 0 HIADHN O=C(NC[C@H]1CCCN(Cc2cnc(-c3ccccc3)[nH]2)C1)Nc1cccc(F)c1 ZINC000512479921 921190196 /nfs/dbraw/zinc/19/01/96/921190196.db2.gz JSKGCGZUTSKRIY-QGZVFWFLSA-N 0 3 407.493 4.250 20 0 HIADHN C[C@H]1CCN(C)CCN1C(=O)NC[C@H](OCc1ccccc1)c1ccc(Cl)cc1 ZINC000494782591 905982904 /nfs/dbraw/zinc/98/29/04/905982904.db2.gz CEWNWESIADUZIQ-AVRDEDQJSA-N 0 3 415.965 4.334 20 0 HIADHN CSCC[C@H](NCCc1cccc(OC(F)(F)F)c1)c1nnc2ccccn21 ZINC000494787888 905989830 /nfs/dbraw/zinc/98/98/30/905989830.db2.gz MYMLHWOMQFXEBF-INIZCTEOSA-N 0 3 410.465 4.254 20 0 HIADHN C[C@@H]1CN(C2CCOCC2)CCN1C(=O)N[C@H](c1ccc(Cl)cc1)C1CCC1 ZINC000494857026 906040657 /nfs/dbraw/zinc/04/06/57/906040657.db2.gz DJRTWGROEGQQGK-IERDGZPVSA-N 0 3 405.970 4.076 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3cc(Cl)c(F)c(Cl)c3)CC2)C[C@H](C)O1 ZINC000494890612 906066995 /nfs/dbraw/zinc/06/69/95/906066995.db2.gz GZDJATPIEJQOII-BETUJISGSA-N 0 3 418.340 4.486 20 0 HIADHN O=C(Nc1cccc(CN[C@H](C[C@H]2CCOC2)c2ccc(F)cc2)c1)[C@@H]1CCCO1 ZINC000494901981 906077956 /nfs/dbraw/zinc/07/79/56/906077956.db2.gz HIJILTHKFKRJRT-YSZBQJHXSA-N 0 3 412.505 4.201 20 0 HIADHN CN1CCN(CC(=O)Nc2c(Cl)cccc2C(F)(F)F)C2(CCCCC2)C1 ZINC000494917384 906090389 /nfs/dbraw/zinc/09/03/89/906090389.db2.gz XFNQNPICFFEPAN-UHFFFAOYSA-N 0 3 403.876 4.248 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)c1c[nH]nc1-c1ccc(Cl)s1 ZINC000494925190 906097904 /nfs/dbraw/zinc/09/79/04/906097904.db2.gz QJXZEDLBONITNZ-ZDUSSCGKSA-N 0 3 406.964 4.420 20 0 HIADHN COC(=O)c1csc(-c2cccc(CN[C@H](C)c3ccc(C(=O)N(C)C)cc3)c2)n1 ZINC000494936266 906107652 /nfs/dbraw/zinc/10/76/52/906107652.db2.gz ZGVNSZWLYLBOIS-OAHLLOKOSA-N 0 3 423.538 4.149 20 0 HIADHN C[C@H](CCO)C1(CN[C@@H](c2ccc(F)cc2)c2cccc(S(C)(=O)=O)c2)CCC1 ZINC000494959892 906129902 /nfs/dbraw/zinc/12/99/02/906129902.db2.gz YVZYVROPGGIQQR-VGSWGCGISA-N 0 3 419.562 4.097 20 0 HIADHN C[C@H](NC(=O)N[C@H](CN(C)C)c1ccc(Cl)cc1)[C@H]1OCCc2sccc21 ZINC000494959291 906130138 /nfs/dbraw/zinc/13/01/38/906130138.db2.gz MTUKXRRCZGNSIX-BOFPYLFWSA-N 0 3 407.967 4.006 20 0 HIADHN CO[C@@H]1CCC[C@@H]1CN[C@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000494966799 906135914 /nfs/dbraw/zinc/13/59/14/906135914.db2.gz BHSGMXRFXDCTGC-DUXKGJEZSA-N 0 3 407.963 4.238 20 0 HIADHN Cc1cc(CN[C@@H](C)c2ccc(C(=O)N(C)C)cc2)ccc1I ZINC000494970192 906139494 /nfs/dbraw/zinc/13/94/94/906139494.db2.gz FSYSQWIBGGLKSI-AWEZNQCLSA-N 0 3 422.310 4.152 20 0 HIADHN C[C@@H](NC(=O)N(Cc1ccccc1)C1CCN(C)CC1)[C@@H]1OCCc2sccc21 ZINC000494970570 906139523 /nfs/dbraw/zinc/13/95/23/906139523.db2.gz CZOXGWQAWYSIFY-VGSWGCGISA-N 0 3 413.587 4.056 20 0 HIADHN COc1ccc([C@@H](NCCC2CCS(=O)(=O)CC2)c2ccccc2Cl)cc1 ZINC000494986077 906149827 /nfs/dbraw/zinc/14/98/27/906149827.db2.gz ASBPVYYONDEROU-OAQYLSRUSA-N 0 3 407.963 4.243 20 0 HIADHN C[C@H](NC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C)[C@H]1OCCc2sccc21 ZINC000494986368 906150365 /nfs/dbraw/zinc/15/03/65/906150365.db2.gz PTRDLDBMTICCPP-KGVIQGDOSA-N 0 3 413.587 4.056 20 0 HIADHN COc1ccccc1[C@H](NC(=O)N[C@H]1C[C@H](C)N(Cc2ccccc2)C1)c1ccco1 ZINC000495009102 906169002 /nfs/dbraw/zinc/16/90/02/906169002.db2.gz TUBNSMBYBQYSMY-WXVUKLJWSA-N 0 3 419.525 4.340 20 0 HIADHN COc1cc(C)c(NC(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)c(C)c1C ZINC000495008549 906169483 /nfs/dbraw/zinc/16/94/83/906169483.db2.gz MHFUAUVSCPKFSX-QZTJIDSGSA-N 0 3 417.594 4.364 20 0 HIADHN O=C(CCN1CCN(c2ccccc2)CC1)Nc1ccc(Oc2cccnc2)cc1 ZINC000495020745 906179042 /nfs/dbraw/zinc/17/90/42/906179042.db2.gz SOZDSEZWOXHWFC-UHFFFAOYSA-N 0 3 402.498 4.025 20 0 HIADHN Cc1c2ccccc2oc1[C@@H](NC(=O)N1CCN(C2CCOCC2)C[C@@H]1C)C(C)C ZINC000495037624 906193223 /nfs/dbraw/zinc/19/32/23/906193223.db2.gz LPQBCLVJTGETQM-JTSKRJEESA-N 0 3 413.562 4.333 20 0 HIADHN COc1ccc([C@H](N[C@H]2CCO[C@]3(CCOC3)C2)c2ccccc2Cl)cc1OC ZINC000495045525 906201977 /nfs/dbraw/zinc/20/19/77/906201977.db2.gz HQSPWWDNXGBHOY-PDIWNELESA-N 0 3 417.933 4.374 20 0 HIADHN CCOc1c(OC)cc(CN[C@@H](C[C@@H]2CCOC2)c2ccc(F)cc2)cc1OC ZINC000495054662 906208225 /nfs/dbraw/zinc/20/82/25/906208225.db2.gz VVJCUFUXEVHGSK-JXFKEZNVSA-N 0 3 403.494 4.499 20 0 HIADHN FC(F)(F)c1ccc2nnc([C@@H]3CCCN(Cc4scnc4C4CC4)C3)n2c1 ZINC000495058953 906212459 /nfs/dbraw/zinc/21/24/59/906212459.db2.gz LEGBLHSFGWQSOF-CYBMUJFWSA-N 0 3 407.465 4.462 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)c1c[nH]cc1-c1ccccc1F ZINC000495084357 906229027 /nfs/dbraw/zinc/22/90/27/906229027.db2.gz MGRJOFFTFCLPTI-UHFFFAOYSA-N 0 3 420.532 4.153 20 0 HIADHN CCOCc1cc(CN2CCC(c3nc(-c4ccccc4)n[nH]3)CC2)ccc1OC ZINC000512531519 921219232 /nfs/dbraw/zinc/21/92/32/921219232.db2.gz GOXWJSZHGSAXBE-UHFFFAOYSA-N 0 3 406.530 4.396 20 0 HIADHN COc1cc(OC)cc(Oc2cccc(CNCc3ccc4c(c3)nnn4C)c2)c1 ZINC000512537206 921222233 /nfs/dbraw/zinc/22/22/33/921222233.db2.gz OQBDYRLGBSRLEE-UHFFFAOYSA-N 0 3 404.470 4.068 20 0 HIADHN CC1CCN(C(=O)c2ccc(N3CCN(Cc4ccccc4)C(C)(C)C3)nc2)CC1 ZINC000495338606 906386409 /nfs/dbraw/zinc/38/64/09/906386409.db2.gz RHLZEZVEDOAIEF-UHFFFAOYSA-N 0 3 406.574 4.055 20 0 HIADHN Cc1c(NC(=O)c2ccc(CN3CCC(CO)CC3)cc2)cccc1C(F)(F)F ZINC000495360765 906400890 /nfs/dbraw/zinc/40/08/90/906400890.db2.gz NTQUIUUMWNXQNV-UHFFFAOYSA-N 0 3 406.448 4.470 20 0 HIADHN CCOc1cc(Cl)ccc1NC(=O)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000495370943 906411128 /nfs/dbraw/zinc/41/11/28/906411128.db2.gz VWEOLXJGXDSFTC-UHFFFAOYSA-N 0 3 402.922 4.195 20 0 HIADHN COCC[C@@H](N[C@@H](C)CC(=O)Nc1cccc(Br)c1)c1ccc(C)o1 ZINC000495400894 906429087 /nfs/dbraw/zinc/42/90/87/906429087.db2.gz GUWFKJQXTRVSJD-SUMWQHHRSA-N 0 3 409.324 4.435 20 0 HIADHN COc1cccc([C@@H]2[C@@H](N[C@H](C)c3cc(OC)c(OC)cc3F)CCN2C2CC2)c1 ZINC000495407940 906432282 /nfs/dbraw/zinc/43/22/82/906432282.db2.gz KFVULJABNFLJID-OECQAKIHSA-N 0 3 414.521 4.480 20 0 HIADHN CC(=O)NCCc1ccc([C@@H](C)N[C@@H](C)c2c(C)nn(CC(F)(F)F)c2C)cc1 ZINC000495421940 906442724 /nfs/dbraw/zinc/44/27/24/906442724.db2.gz WQPQFWYNNQLHOP-KGLIPLIRSA-N 0 3 410.484 4.153 20 0 HIADHN CCC[C@@H](C)NC(=O)[C@H]1CCCN(Cc2ccc(OCC(F)(F)F)c(OC)c2)C1 ZINC000512561598 921238111 /nfs/dbraw/zinc/23/81/11/921238111.db2.gz LXXFHCVCXQZYIF-WBVHZDCISA-N 0 3 416.484 4.153 20 0 HIADHN CCC[C@@H](C)NC(=O)[C@@H]1CCCN(Cc2ccc(OCC(F)(F)F)c(OC)c2)C1 ZINC000512561596 921238421 /nfs/dbraw/zinc/23/84/21/921238421.db2.gz LXXFHCVCXQZYIF-NVXWUHKLSA-N 0 3 416.484 4.153 20 0 HIADHN CCS(=O)(=O)c1ccc2oc(CN[C@@H](Cc3ccc(F)cc3)C(C)C)nc2c1 ZINC000495499919 906488224 /nfs/dbraw/zinc/48/82/24/906488224.db2.gz QDHMFHKZQIPMPO-SFHVURJKSA-N 0 3 404.507 4.117 20 0 HIADHN O=C(Nc1cccc(-c2ccccc2)c1)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1CO ZINC000495580150 906507596 /nfs/dbraw/zinc/50/75/96/906507596.db2.gz ZGBFILKNOZNADQ-NOZRDPDXSA-N 0 3 415.537 4.358 20 0 HIADHN CS[C@@H]1CN(C(=O)c2csc(-c3ccc(Cl)c(Cl)c3)n2)C[C@@H]1N(C)C ZINC000495681354 906523383 /nfs/dbraw/zinc/52/33/83/906523383.db2.gz GTVCFWXIBUPXRD-LSDHHAIUSA-N 0 3 416.399 4.235 20 0 HIADHN CCCC[C@@H](N[C@H]1CCN(c2cc(Cl)ccc2OC)C1)C(=O)Nc1cc(C)on1 ZINC000495725080 906534768 /nfs/dbraw/zinc/53/47/68/906534768.db2.gz PNGKRMFHYRHXKJ-DLBZAZTESA-N 0 3 420.941 4.011 20 0 HIADHN CCCC[C@H](N[C@H]1CCN(c2cc(Cl)ccc2OC)C1)C(=O)Nc1cc(C)on1 ZINC000495725084 906534953 /nfs/dbraw/zinc/53/49/53/906534953.db2.gz PNGKRMFHYRHXKJ-IRXDYDNUSA-N 0 3 420.941 4.011 20 0 HIADHN CCOc1ccc(SCC(=O)N(Cc2ccncc2)C[C@H]2CCCN2CC)cc1 ZINC000496224842 906632069 /nfs/dbraw/zinc/63/20/69/906632069.db2.gz INMCEOPRMTTXJH-HXUWFJFHSA-N 0 3 413.587 4.086 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)CCC(=O)c1ccc(C)c(C)c1 ZINC000496261417 906640427 /nfs/dbraw/zinc/64/04/27/906640427.db2.gz IBKPMZPDYUBKAM-HSZRJFAPSA-N 0 3 407.558 4.174 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)c1cc2ccc(OC(F)(F)F)cc2[nH]1 ZINC000496266252 906642757 /nfs/dbraw/zinc/64/27/57/906642757.db2.gz YMEWWIYAIQNNNR-UHFFFAOYSA-N 0 3 423.410 4.410 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)c1cc2c(cccc2OC(F)F)[nH]1 ZINC000496357307 906664939 /nfs/dbraw/zinc/66/49/39/906664939.db2.gz MURBDJJTQJUIIP-UHFFFAOYSA-N 0 3 405.420 4.112 20 0 HIADHN COc1ccc(-c2cnc(CCC(=O)N3CCCN(Cc4ccccc4)CC3)o2)cc1 ZINC000496438693 906681314 /nfs/dbraw/zinc/68/13/14/906681314.db2.gz SUMLIBDVVPYEMQ-UHFFFAOYSA-N 0 3 419.525 4.017 20 0 HIADHN Cc1cccc(-c2nc(CC(=O)N(CCN(C)C)Cc3ccccc3F)cs2)c1 ZINC000496446821 906683194 /nfs/dbraw/zinc/68/31/94/906683194.db2.gz GJTCONWXYMVJCN-UHFFFAOYSA-N 0 3 411.546 4.391 20 0 HIADHN O=C(c1cccc(Cn2ccnc2)c1)N(CCN1CCCC1)Cc1ccc(Cl)cc1 ZINC000496914890 906779060 /nfs/dbraw/zinc/77/90/60/906779060.db2.gz KYJSUTADQWIDFP-UHFFFAOYSA-N 0 3 422.960 4.323 20 0 HIADHN CCCCOc1ccc(CN2CCC(C(=O)Nc3ccc(O)cc3)CC2)cc1OC ZINC000512633574 921268999 /nfs/dbraw/zinc/26/89/99/921268999.db2.gz OLWIWOVDUAENRL-UHFFFAOYSA-N 0 3 412.530 4.430 20 0 HIADHN COc1cc(C(=O)N(Cc2ccco2)C2CCN(C)CC2)ccc1OCCC(C)C ZINC000497355733 906849183 /nfs/dbraw/zinc/84/91/83/906849183.db2.gz BVBYVSMPLCJMDS-UHFFFAOYSA-N 0 3 414.546 4.450 20 0 HIADHN COc1ccc(CC[C@@H]2CCCCN2Cc2ccc([S@@](C)=O)cc2)cc1OC ZINC000512644042 921272328 /nfs/dbraw/zinc/27/23/28/921272328.db2.gz IHVOWBIUIJABEJ-WTYVLRPYSA-N 0 3 401.572 4.429 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)c2cc(C(C)C)nc3c2cnn3C(C)C)o1 ZINC000497379082 906867367 /nfs/dbraw/zinc/86/73/67/906867367.db2.gz UKJSCQXALCTMPA-UHFFFAOYSA-N 0 3 411.550 4.241 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)CCCOc2ccccc2Br)o1 ZINC000497391146 906875292 /nfs/dbraw/zinc/87/52/92/906875292.db2.gz VVGJIBSNFZFQGR-UHFFFAOYSA-N 0 3 423.351 4.100 20 0 HIADHN CCCN1CCN(c2ccccc2CNc2ccc(C(=O)NC(C)(C)C)cc2)CC1 ZINC000512648785 921274245 /nfs/dbraw/zinc/27/42/45/921274245.db2.gz QLHKHWNGBHUHAZ-UHFFFAOYSA-N 0 3 408.590 4.359 20 0 HIADHN CC(C)[C@@H](c1ccccc1)N(C)CC(=O)N1CCC(C(=O)Nc2ccccc2)CC1 ZINC000497395307 906877880 /nfs/dbraw/zinc/87/78/80/906877880.db2.gz YYEAZTYGLWRXPB-DEOSSOPVSA-N 0 3 407.558 4.193 20 0 HIADHN CN1C[C@@H](c2ccccc2)[C@H](NC(=O)c2ccc(Oc3ccncc3)c(Cl)c2)C1 ZINC000497415983 906890968 /nfs/dbraw/zinc/89/09/68/906890968.db2.gz IQTQGMYMFYALMI-PZJWPPBQSA-N 0 3 407.901 4.355 20 0 HIADHN CCCOc1ccc(CC(=O)N[C@H]2CN(C)C[C@@H]2c2ccccc2)cc1OCCC ZINC000497415945 906891203 /nfs/dbraw/zinc/89/12/03/906891203.db2.gz JEOJMOJOAVAFGA-YADHBBJMSA-N 0 3 410.558 4.021 20 0 HIADHN COc1ccc([C@H](C)NC(=O)NC[C@H]2CCCN2Cc2ccccc2)c(C)c1OC ZINC000497445259 906918120 /nfs/dbraw/zinc/91/81/20/906918120.db2.gz WNGOZJMKBAVKJY-AZUAARDMSA-N 0 3 411.546 4.037 20 0 HIADHN COc1ccc(CCCN(C)[C@H](C)C(=O)Nc2ccccc2Br)cc1 ZINC000497469882 906951245 /nfs/dbraw/zinc/95/12/45/906951245.db2.gz DSGCBJWCEDUAJW-OAHLLOKOSA-N 0 3 405.336 4.349 20 0 HIADHN Cc1cn(-c2ccc(F)cc2)nc1C(=O)NC[C@@H]1CCCN(Cc2cccs2)C1 ZINC000512686046 921287144 /nfs/dbraw/zinc/28/71/44/921287144.db2.gz RPNBOPFSQAPESR-KRWDZBQOSA-N 0 3 412.534 4.023 20 0 HIADHN COc1ccc(CNC(=O)C2CCN(Cc3cnc(-c4ccccc4)s3)CC2)cc1 ZINC000512693182 921289828 /nfs/dbraw/zinc/28/98/28/921289828.db2.gz KRYOQCWRAGZBOP-UHFFFAOYSA-N 0 3 421.566 4.347 20 0 HIADHN O[C@@H](COc1cc(Cl)ccc1Cl)CN1CCC[C@H]1c1ccc2c(c1)OCCO2 ZINC000497587613 907068524 /nfs/dbraw/zinc/06/85/24/907068524.db2.gz UFVHFZPLLCCBHD-AEFFLSMTSA-N 0 3 424.324 4.341 20 0 HIADHN COc1ccc(C[C@@H](NCc2cccc(C(=O)N(C)C)c2)c2ccc(OC)cc2)cc1 ZINC000497587830 907068582 /nfs/dbraw/zinc/06/85/82/907068582.db2.gz WXQARQOPCTTYND-RUZDIDTESA-N 0 3 418.537 4.479 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)NCc2ccc3ccccc3n2)N(C)C)cc1 ZINC000497606988 907084632 /nfs/dbraw/zinc/08/46/32/907084632.db2.gz BHLIJQRKLQRMEL-HSZRJFAPSA-N 0 3 406.530 4.124 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)c1csc(-c2ccc(C)o2)n1 ZINC000512704607 921292966 /nfs/dbraw/zinc/29/29/66/921292966.db2.gz RNGGVHOXXSVQRL-GOSISDBHSA-N 0 3 410.543 4.233 20 0 HIADHN CC(C)(C)[C@H](CN1CCc2ccccc2C1)NC(=O)N1CCC=C(c2ccncc2)C1 ZINC000497616060 907093067 /nfs/dbraw/zinc/09/30/67/907093067.db2.gz BWDQYLCQHXISTC-DEOSSOPVSA-N 0 3 418.585 4.353 20 0 HIADHN CC1CCN([C@@H](CNc2ncc(C(=O)N(C)C)cc2Cl)c2ccccc2)CC1 ZINC000497637309 907120571 /nfs/dbraw/zinc/12/05/71/907120571.db2.gz IEMIHHMSJIJAOC-FQEVSTJZSA-N 0 3 400.954 4.322 20 0 HIADHN Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)NC(=O)N1CC[C@@H]2CCN(C)C[C@H]21 ZINC000497635901 907120722 /nfs/dbraw/zinc/12/07/22/907120722.db2.gz CHTQXQIIAFWMJM-RLFYNMQTSA-N 0 3 402.539 4.054 20 0 HIADHN CCc1nc(C(=O)NC[C@@H]2CCCN(C)[C@@H]2c2ccc(C(F)(F)F)cc2)c(C)o1 ZINC000512734110 921299096 /nfs/dbraw/zinc/29/90/96/921299096.db2.gz IVDLZNNLVVEQLF-HNAYVOBHSA-N 0 3 409.452 4.377 20 0 HIADHN Cc1ccccc1[C@H](NC(=O)N(C)CCCN1CCN(C)CC1)[C@H]1CCC[C@H](C)C1 ZINC000497666836 907162851 /nfs/dbraw/zinc/16/28/51/907162851.db2.gz ABAWJVBVPIBCEP-ODGPQVTHSA-N 0 3 414.638 4.141 20 0 HIADHN COc1cc(C)c([C@@H](C)NC(=O)NC[C@H]2CCCN2Cc2ccccc2)cc1OC ZINC000497668528 907166617 /nfs/dbraw/zinc/16/66/17/907166617.db2.gz LIAZCEPOKOLQRW-UYAOXDASSA-N 0 3 411.546 4.037 20 0 HIADHN CCOc1cc(C[NH2+]C[C@H](c2ccc(OC)cc2)N2CCCC2)cc(Cl)c1[O-] ZINC000497675083 907176907 /nfs/dbraw/zinc/17/69/07/907176907.db2.gz CQYBAADLRAIVHW-HXUWFJFHSA-N 0 3 404.938 4.380 20 0 HIADHN COc1ccc(CNC(=O)C2CCN(Cc3c(Cl)ccc4cccnc43)CC2)cc1 ZINC000512754487 921302216 /nfs/dbraw/zinc/30/22/16/921302216.db2.gz CWUPKLQBNSUNOP-UHFFFAOYSA-N 0 3 423.944 4.425 20 0 HIADHN CCOc1cc(C[NH2+]C[C@@H](c2ccccc2OC)N2CCCC2)cc(Cl)c1[O-] ZINC000497704504 907208414 /nfs/dbraw/zinc/20/84/14/907208414.db2.gz IFOZQYORJIQOMI-IBGZPJMESA-N 0 3 404.938 4.380 20 0 HIADHN C[C@@H]1[C@H](NC(=O)NCc2ccc(-c3ccncc3)cc2)CCN1Cc1ccccc1 ZINC000497706999 907212738 /nfs/dbraw/zinc/21/27/38/907212738.db2.gz XZTAKXQSNTYYOX-NTKDMRAZSA-N 0 3 400.526 4.211 20 0 HIADHN CC(C)(C)c1ccc(C(=O)NCCC(=O)N[C@@H](CN2CCCC2)c2ccccc2)cc1 ZINC000497723215 907222832 /nfs/dbraw/zinc/22/28/32/907222832.db2.gz REGFSLCDBVVRFC-QHCPKHFHSA-N 0 3 421.585 4.057 20 0 HIADHN O[C@H](COCc1ccccc1Cl)CN(Cc1cccc(F)c1)C[C@H]1CCCO1 ZINC000497739165 907235155 /nfs/dbraw/zinc/23/51/55/907235155.db2.gz KWCIYMGFCJMSPR-LEWJYISDSA-N 0 3 407.913 4.038 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)N[C@@H](C)c2nccn2-c2ccccc2)c1 ZINC000512787399 921311493 /nfs/dbraw/zinc/31/14/93/921311493.db2.gz IGALJBVQDJQHCM-FQEVSTJZSA-N 0 3 405.546 4.015 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)N2CCC(OC3CCCC3)CC2)N(C)C)cc1 ZINC000512808783 921315776 /nfs/dbraw/zinc/31/57/76/921315776.db2.gz RHBQBLPIJPOAPZ-HSZRJFAPSA-N 0 3 417.594 4.210 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)N2CC[C@@H](C(F)(F)F)[C@@H]2C)N(C)C)cc1 ZINC000512809809 921316712 /nfs/dbraw/zinc/31/67/12/921316712.db2.gz WGFIKCZTWMTPFE-QGTPRVQTSA-N 0 3 401.473 4.059 20 0 HIADHN CCN(CC)[C@H](CNC(=O)C(=O)Nc1cc(C(F)F)ccc1Cl)c1ccccc1 ZINC000497878733 907353707 /nfs/dbraw/zinc/35/37/07/907353707.db2.gz BJVTUZHNPZFPIK-GOSISDBHSA-N 0 3 423.891 4.415 20 0 HIADHN CC[C@@H](C)[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)Nc1cccc(CN(C)C)c1 ZINC000497963462 907431350 /nfs/dbraw/zinc/43/13/50/907431350.db2.gz BKXJUQSPWKOLCR-FOIQADDNSA-N 0 3 401.938 4.185 20 0 HIADHN CC[C@@H](C)[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)Nc1cccc(CN(C)C)c1 ZINC000497963464 907432743 /nfs/dbraw/zinc/43/27/43/907432743.db2.gz BKXJUQSPWKOLCR-QRWLVFNGSA-N 0 3 401.938 4.185 20 0 HIADHN COc1ccc(CCC(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)cc1F ZINC000497978620 907452597 /nfs/dbraw/zinc/45/25/97/907452597.db2.gz MIJNNUBDUKQLSQ-LJQANCHMSA-N 0 3 404.551 4.418 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)Nc2ccc(C(=O)NCC(C)C)cc2C)N(C)C)cc1 ZINC000497996299 907476375 /nfs/dbraw/zinc/47/63/75/907476375.db2.gz HMBNLAIWNSFHTJ-HSZRJFAPSA-N 0 3 424.589 4.368 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3ccc(Cl)c4ncccc34)CC2)C[C@@H](C)O1 ZINC000512822260 921326938 /nfs/dbraw/zinc/32/69/38/921326938.db2.gz QEPJNBMXFMYNTG-IAGOWNOFSA-N 0 3 415.965 4.240 20 0 HIADHN COc1ccc(NC(=O)c2ccc(NC(=O)c3ccccc3CN(C)C)cc2)cc1 ZINC000498005604 907492328 /nfs/dbraw/zinc/49/23/28/907492328.db2.gz HZLSYLUNUQQOMV-UHFFFAOYSA-N 0 3 403.482 4.261 20 0 HIADHN CC(C)(c1ccccc1)c1ccc(OC[C@H](O)CN2CC[C@@H](COC(F)F)C2)cc1 ZINC000512824986 921329046 /nfs/dbraw/zinc/32/90/46/921329046.db2.gz ZVGFAIYYJAAIOQ-WIYYLYMNSA-N 0 3 419.512 4.313 20 0 HIADHN CCN(C(=O)c1ccc(OCC(F)(F)F)nc1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000498019392 907515996 /nfs/dbraw/zinc/51/59/96/907515996.db2.gz QTABJHXREYCUQF-APWZRJJASA-N 0 3 421.463 4.320 20 0 HIADHN CCN(C(=O)c1ccn(-c2ccc(F)cc2)n1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000498020073 907519100 /nfs/dbraw/zinc/51/91/00/907519100.db2.gz WDRUUBGOXDHXPW-AVRDEDQJSA-N 0 3 406.505 4.309 20 0 HIADHN Cc1cn(-c2ccc(F)cc2)nc1C(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000512829049 921332864 /nfs/dbraw/zinc/33/28/64/921332864.db2.gz RRYRCXHINAGYIX-UHFFFAOYSA-N 0 3 406.505 4.056 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)N2CC=C(c3ccc(O)cc3)CC2)N(C)C)cc1 ZINC000512831329 921335348 /nfs/dbraw/zinc/33/53/48/921335348.db2.gz FVYCQTUSMYHCRU-XMMPIXPASA-N 0 3 423.557 4.281 20 0 HIADHN O=C(c1ccc(Cl)cc1)C1CCN(C[C@@H](O)COCc2ccccc2Cl)CC1 ZINC000498101590 907611333 /nfs/dbraw/zinc/61/13/33/907611333.db2.gz NNOXQALOWKPAHC-HXUWFJFHSA-N 0 3 422.352 4.466 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)N[C@H]1CCCOc2c(F)cccc21 ZINC000498112651 907623086 /nfs/dbraw/zinc/62/30/86/907623086.db2.gz VYIRLHTZPFBAAG-ROUUACIJSA-N 0 3 403.523 4.237 20 0 HIADHN CCC(CC)[C@@H]1C[C@H](NC(=O)NC[C@@H](c2cccc(OC)c2)N2CCCC2)CCO1 ZINC000498116901 907627635 /nfs/dbraw/zinc/62/76/35/907627635.db2.gz HBUTYNDPLCHXEG-PUHATCMVSA-N 0 3 417.594 4.115 20 0 HIADHN CN1CCN(CCCNC(=O)c2cc(Cl)sc2Cl)[C@H](c2ccccc2)C1 ZINC000498125248 907640546 /nfs/dbraw/zinc/64/05/46/907640546.db2.gz MUZFTDNTEIUVOM-INIZCTEOSA-N 0 3 412.386 4.164 20 0 HIADHN O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)[C@@H]1C[C@H]1c1ccc(Br)cc1 ZINC000498161883 907688637 /nfs/dbraw/zinc/68/86/37/907688637.db2.gz HKDQYWNYDCEQEF-QHAWAJNXSA-N 0 3 413.359 4.333 20 0 HIADHN Cc1cccc([C@@H](NC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)c2ccccn2)c1 ZINC000498231856 907764683 /nfs/dbraw/zinc/76/46/83/907764683.db2.gz QGFWADLFZWJNDG-ILBGXUMGSA-N 0 3 414.553 4.443 20 0 HIADHN CSc1cccc([C@@H](NC(=O)N2CCN3CCC2CC3)c2cc(F)ccc2F)c1 ZINC000498268300 907805486 /nfs/dbraw/zinc/80/54/86/907805486.db2.gz TTYBZPGZGOYZQU-OAQYLSRUSA-N 0 3 417.525 4.266 20 0 HIADHN CSc1cccc([C@H](NC(=O)N2CCN3CCC2CC3)c2ccc(F)c(F)c2)c1 ZINC000498286063 907818963 /nfs/dbraw/zinc/81/89/63/907818963.db2.gz PVPUERHXPKZDQS-NRFANRHFSA-N 0 3 417.525 4.266 20 0 HIADHN C[C@H](SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)NCCN1CCC[C@@H](C)C1 ZINC000498344423 907849769 /nfs/dbraw/zinc/84/97/69/907849769.db2.gz MTROSQXORSGYFC-CVEARBPZSA-N 0 3 421.994 4.465 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)c2cccc(Cl)c2Cl)CC1 ZINC000498370010 907861619 /nfs/dbraw/zinc/86/16/19/907861619.db2.gz ZSABKYHAUQQYRJ-UHFFFAOYSA-N 0 3 406.357 4.061 20 0 HIADHN CCC(CC)[C@H]1C[C@@H](NC(=O)N(Cc2ccccc2)C2CCN(C)CC2)CCO1 ZINC000498396946 907879603 /nfs/dbraw/zinc/87/96/03/907879603.db2.gz OLHDQTQWRUMRBB-JTHBVZDNSA-N 0 3 401.595 4.276 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)c2cc(-c3ccc(Cl)s3)on2)CC1 ZINC000498450773 907913951 /nfs/dbraw/zinc/91/39/51/907913951.db2.gz DPCFKXXJRYYTTP-UHFFFAOYSA-N 0 3 405.907 4.386 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCc2sccc2C1)c1n[nH]c2ccccc21 ZINC000498480905 907951527 /nfs/dbraw/zinc/95/15/27/907951527.db2.gz LKGVREOQSXGOGA-HXUWFJFHSA-N 0 3 402.523 4.154 20 0 HIADHN CC[C@@H](NCc1cc(Br)c(O)c(OC)c1)c1ccc(OC)c(OC)c1 ZINC000512885347 921380943 /nfs/dbraw/zinc/38/09/43/921380943.db2.gz OHZMSPBXPHRKMO-OAHLLOKOSA-N 0 3 410.308 4.421 20 0 HIADHN C[C@H]1CCN(C)CCN1C(=O)c1cn(-c2ccccc2)nc1-c1ccc(Cl)cc1 ZINC000498715128 908140196 /nfs/dbraw/zinc/14/01/96/908140196.db2.gz IYNMTKJKCFENEV-KRWDZBQOSA-N 0 3 408.933 4.359 20 0 HIADHN C[C@H]1CCN(C)CCN1C(=O)c1cn(Cc2ccccc2)nc1-c1ccc(Cl)cc1 ZINC000498725924 908151219 /nfs/dbraw/zinc/15/12/19/908151219.db2.gz AUQNPTYXFHBNPT-SFHVURJKSA-N 0 3 422.960 4.418 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)c1cc(Br)cs1 ZINC000498729873 908156538 /nfs/dbraw/zinc/15/65/38/908156538.db2.gz QRCCQFNCPKSOLJ-INIZCTEOSA-N 0 3 408.365 4.032 20 0 HIADHN COc1ccc(-c2[nH]c3ccccc3c2CCC(=O)N2CCN(C)CC[C@@H]2C)cc1 ZINC000498732336 908160399 /nfs/dbraw/zinc/16/03/99/908160399.db2.gz ADEJAQVNBNPMED-SFHVURJKSA-N 0 3 405.542 4.329 20 0 HIADHN C[C@@H]1CCN(C)CCN1C(=O)Cc1cn(-c2ccccc2)nc1-c1ccc(Cl)cc1 ZINC000498738724 908166654 /nfs/dbraw/zinc/16/66/54/908166654.db2.gz RDZCHSVLKCXQNJ-GOSISDBHSA-N 0 3 422.960 4.288 20 0 HIADHN CC(C)c1ccc(NC(=O)N2CCC[C@@H](CN3CCN(c4ccccn4)CC3)C2)cc1 ZINC000498827188 908235975 /nfs/dbraw/zinc/23/59/75/908235975.db2.gz DCYLFIGGFGTOIQ-NRFANRHFSA-N 0 3 421.589 4.271 20 0 HIADHN O=C(N[C@H](c1cccc(F)c1)c1ccccn1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000498888437 908291647 /nfs/dbraw/zinc/29/16/47/908291647.db2.gz CXAPGSHXOYNNKF-HYBUGGRVSA-N 0 3 421.491 4.478 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)NC[C@H](c2cccnc2)C(C)C)N(C)C)cc1 ZINC000498901160 908308420 /nfs/dbraw/zinc/30/84/20/908308420.db2.gz YYVIEFDAYAKVAM-XZOQPEGZSA-N 0 3 412.578 4.211 20 0 HIADHN Cc1cc(C(=O)NC[C@@H]2CCCCN2Cc2ccccc2)c2cnn(C(C)C)c2n1 ZINC000498914296 908323674 /nfs/dbraw/zinc/32/36/74/908323674.db2.gz IPJMERAHEODXOW-FQEVSTJZSA-N 0 3 405.546 4.105 20 0 HIADHN Clc1cccc(Cl)c1-c1nnc(CN2CCC[C@H](c3nc(C4CC4)n[nH]3)C2)o1 ZINC000498921087 908329778 /nfs/dbraw/zinc/32/97/78/908329778.db2.gz ASDRVWRFNRMIGI-LBPRGKRZSA-N 0 3 419.316 4.419 20 0 HIADHN Clc1cccc(Cl)c1-c1nnc(CN2CCC[C@H](c3n[nH]c(C4CC4)n3)C2)o1 ZINC000498921087 908329793 /nfs/dbraw/zinc/32/97/93/908329793.db2.gz ASDRVWRFNRMIGI-LBPRGKRZSA-N 0 3 419.316 4.419 20 0 HIADHN CCCCOc1ccc(-c2nnc(CN3CCC[C@@H](c4nc(C5CC5)n[nH]4)C3)o2)cc1 ZINC000498924243 908333505 /nfs/dbraw/zinc/33/35/05/908333505.db2.gz UHWDSBMJBASRAW-GOSISDBHSA-N 0 3 422.533 4.291 20 0 HIADHN CCCCOc1ccc(-c2nnc(CN3CCC[C@@H](c4n[nH]c(C5CC5)n4)C3)o2)cc1 ZINC000498924243 908333526 /nfs/dbraw/zinc/33/35/26/908333526.db2.gz UHWDSBMJBASRAW-GOSISDBHSA-N 0 3 422.533 4.291 20 0 HIADHN CCN1C[C@H](C)N(Cc2csc(N(C(C)=O)c3ccc(C)cc3C)n2)C[C@H]1C ZINC000498928540 908337576 /nfs/dbraw/zinc/33/75/76/908337576.db2.gz YDIQJFMUWRBDCD-MSOLQXFVSA-N 0 3 400.592 4.359 20 0 HIADHN CCN1C[C@H](C)N(Cc2csc(N(C(C)=O)c3ccc(Cl)cc3)n2)C[C@@H]1C ZINC000498940297 908348631 /nfs/dbraw/zinc/34/86/31/908348631.db2.gz XLJXEASPMKXPGF-GJZGRUSLSA-N 0 3 406.983 4.396 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)N[C@@H](c2cccc(F)c2)c2ccccn2)CN1Cc1ccccc1 ZINC000499025389 908400337 /nfs/dbraw/zinc/40/03/37/908400337.db2.gz GTUSGFHACWELIB-OUOWLKGYSA-N 0 3 418.516 4.272 20 0 HIADHN CC[C@H](NC(=O)NC[C@@H](c1ccc(OC(C)C)cc1)N(C)C)c1nc2ccccc2[nH]1 ZINC000512913855 921407709 /nfs/dbraw/zinc/40/77/09/921407709.db2.gz XOCAQLULJUGPIY-UGKGYDQZSA-N 0 3 423.561 4.403 20 0 HIADHN COc1ccc([C@@H](C)N(C)C(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)cc1 ZINC000512918553 921411958 /nfs/dbraw/zinc/41/19/58/921411958.db2.gz QQXRHYJWGNCWIS-JPYJTQIMSA-N 0 3 413.562 4.488 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cccc([C@H]4CCCOC4)c3)c(C)c2)CC1 ZINC000499128270 908485886 /nfs/dbraw/zinc/48/58/86/908485886.db2.gz QCKDEPZYISGGMJ-QFIPXVFZSA-N 0 3 407.558 4.283 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N[C@H](C)c3cccc(F)c3F)c(C)c2)CC1 ZINC000499167896 908520476 /nfs/dbraw/zinc/52/04/76/908520476.db2.gz NGQHMCJKMULQOU-MRXNPFEDSA-N 0 3 402.489 4.298 20 0 HIADHN Cc1c2ccc(F)cc2sc1C(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000499176978 908531596 /nfs/dbraw/zinc/53/15/96/908531596.db2.gz NQICGNVASFCFRZ-UHFFFAOYSA-N 0 3 412.530 4.236 20 0 HIADHN CC(C)(C)[C@@H]1CCN(Cc2cn(Cc3ccccc3)nc2-c2cccnc2)C[C@H]1O ZINC000499254390 908629507 /nfs/dbraw/zinc/62/95/07/908629507.db2.gz KRXJXHTVKHEAAA-DHIUTWEWSA-N 0 3 404.558 4.222 20 0 HIADHN CN(C(=O)N[C@H](c1cccc(F)c1)c1ccccn1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000499317039 908688934 /nfs/dbraw/zinc/68/89/34/908688934.db2.gz QCIRTVZYLIRGCL-LADGPHEKSA-N 0 3 418.516 4.226 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)NCCc1csc(-c2ccccc2)n1)c1ccco1 ZINC000499333575 908708491 /nfs/dbraw/zinc/70/84/91/908708491.db2.gz FPAZMUUYGSENSW-VQIMIIECSA-N 0 3 412.559 4.374 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCCC1)c1cccc([C@@H]2CCCOC2)c1 ZINC000499371272 908740065 /nfs/dbraw/zinc/74/00/65/908740065.db2.gz WJDGKGKCPTZHDN-OAQYLSRUSA-N 0 3 402.604 4.062 20 0 HIADHN Cc1ccc(-c2nnc(-c3ccc(C(=O)N[C@@H](C)CN4CCCCC4)cc3)o2)cc1 ZINC000512959325 921437514 /nfs/dbraw/zinc/43/75/14/921437514.db2.gz XSLKYYQOQHTXAY-SFHVURJKSA-N 0 3 404.514 4.316 20 0 HIADHN O=C(NCc1cccc(OCC(F)(F)F)c1)N1CCCN(Cc2ccccc2)CC1 ZINC000499505217 908820907 /nfs/dbraw/zinc/82/09/07/908820907.db2.gz UXWYJMRNEICRDS-UHFFFAOYSA-N 0 3 421.463 4.045 20 0 HIADHN CN(C(=O)c1ccn(-c2cccc(Cl)c2)n1)C1CCN(Cc2ccccc2)CC1 ZINC000499511129 908823457 /nfs/dbraw/zinc/82/34/57/908823457.db2.gz RGDAVCGQZIGXAX-UHFFFAOYSA-N 0 3 408.933 4.262 20 0 HIADHN Cc1c(C(=O)N(C)C2CCN(Cc3ccccc3)CC2)cnn1-c1cccc(C)c1 ZINC000499529878 908830840 /nfs/dbraw/zinc/83/08/40/908830840.db2.gz ABDIOBUCPWOOIN-UHFFFAOYSA-N 0 3 402.542 4.226 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2CNCC2(S(C)(=O)=O)CCCC2)cc1 ZINC000512971693 921445754 /nfs/dbraw/zinc/44/57/54/921445754.db2.gz KFOYZHBPZLJYHQ-UHFFFAOYSA-N 0 3 423.582 4.295 20 0 HIADHN Cc1nn(-c2ccccc2)c(Oc2ccc(F)cc2)c1CN[C@@H]1CCc2c[nH]nc2C1 ZINC000499681197 908875357 /nfs/dbraw/zinc/87/53/57/908875357.db2.gz HJIHZQOMXIBFSN-LJQANCHMSA-N 0 3 417.488 4.482 20 0 HIADHN Cc1nn2c(CNCCOc3ccc(Br)cc3)c(C(C)C)nc2s1 ZINC000499683571 908876612 /nfs/dbraw/zinc/87/66/12/908876612.db2.gz WMEHLORKOOMLHK-UHFFFAOYSA-N 0 3 409.353 4.154 20 0 HIADHN Cc1nn(-c2ccccc2)c(Oc2cccc(F)c2)c1CNCC[C@@H](C)[S@](C)=O ZINC000499698142 908880608 /nfs/dbraw/zinc/88/06/08/908880608.db2.gz ABBQITNSVUKBDW-BCOMRZATSA-N 0 3 415.534 4.359 20 0 HIADHN CS(=O)(=O)Cc1ccccc1CNCc1cccc(OCc2ccc(F)cc2)c1 ZINC000499700641 908881146 /nfs/dbraw/zinc/88/11/46/908881146.db2.gz MYFYZYDIUIXSSD-UHFFFAOYSA-N 0 3 413.514 4.239 20 0 HIADHN CSC[C@@H](CCO)NCc1c(C)nn(-c2ccccc2)c1Oc1cccc(F)c1 ZINC000499707825 908884046 /nfs/dbraw/zinc/88/40/46/908884046.db2.gz SZRWPXDAKSEGLN-GOSISDBHSA-N 0 3 415.534 4.316 20 0 HIADHN CN(C)CCN(C[C@H]1CCCO1)C(=O)c1sc2cc(Cl)ccc2c1Cl ZINC000499917444 909031771 /nfs/dbraw/zinc/03/17/71/909031771.db2.gz CYPAGISMBQAYQH-CYBMUJFWSA-N 0 3 401.359 4.391 20 0 HIADHN CCOc1cc2c(cc1[C@@H]1C[C@H]1C(=O)N(CCN(C)C)Cc1ccccc1)O[C@H](C)C2 ZINC000499936976 909044784 /nfs/dbraw/zinc/04/47/84/909044784.db2.gz QZTWPDNPUCYOJV-RZFNWQHOSA-N 0 3 422.569 4.103 20 0 HIADHN C[C@H](CNC(=O)c1oc2ccccc2c1CSc1ncccn1)N1CCC(C)CC1 ZINC000499952447 909055680 /nfs/dbraw/zinc/05/56/80/909055680.db2.gz OVRCKHXSAAUAMO-QGZVFWFLSA-N 0 3 424.570 4.365 20 0 HIADHN Brc1ccc(-n2cc(CN3CCC[C@H](c4nccs4)C3)cn2)cc1 ZINC000513026780 921487428 /nfs/dbraw/zinc/48/74/28/921487428.db2.gz FTABSVCBAXFPRA-HNNXBMFYSA-N 0 3 403.349 4.471 20 0 HIADHN COc1ccc(CN2CCC[C@@H](CNC(=O)c3ccccc3)C2)cc1OCC(C)C ZINC000513034403 921493598 /nfs/dbraw/zinc/49/35/98/921493598.db2.gz AAJUHRHJVWABAN-NRFANRHFSA-N 0 3 410.558 4.372 20 0 HIADHN COc1ccccc1C[C@@H](C)CC(=O)N(CCN(C)C)Cc1ccc(F)cc1F ZINC000499973449 909414486 /nfs/dbraw/zinc/41/44/86/909414486.db2.gz BYYNRPKSKLXZFY-QGZVFWFLSA-N 0 3 404.501 4.133 20 0 HIADHN Cc1ccc(C(C)C)c(O[C@H](C)C(=O)N(C)C2CCN(CCc3ccccn3)CC2)c1 ZINC000500027072 909483490 /nfs/dbraw/zinc/48/34/90/909483490.db2.gz RIFYNJXIXKAXGL-OAQYLSRUSA-N 0 3 423.601 4.446 20 0 HIADHN CN(C(=O)CCc1ccc2ccccc2c1)C1CCN(CCc2ccccn2)CC1 ZINC000500029037 909486457 /nfs/dbraw/zinc/48/64/57/909486457.db2.gz YYLXTZCGPINAHM-UHFFFAOYSA-N 0 3 401.554 4.333 20 0 HIADHN CCc1nnc(NC(=O)[C@H](C)[C@@H](C)NCc2ccccc2OC2CCCC2)s1 ZINC000513039995 921500027 /nfs/dbraw/zinc/50/00/27/921500027.db2.gz FFWVUZPBSPQXFJ-HUUCEWRRSA-N 0 3 402.564 4.175 20 0 HIADHN CC(C)[C@@H]1CC[C@@H](C)C[C@@H]1OCC(=O)N(C)C1CCN(CCc2ccccn2)CC1 ZINC000500063106 909528996 /nfs/dbraw/zinc/52/89/96/909528996.db2.gz LZZSZDYPRSCMPQ-QDSKXPNFSA-N 0 3 415.622 4.024 20 0 HIADHN CC(C)(C)OC(=O)c1cccc(CN2CCC(C(=O)Nc3ccc(O)cc3)CC2)c1 ZINC000500131572 909611649 /nfs/dbraw/zinc/61/16/49/909611649.db2.gz WSVSALBOORKWAN-UHFFFAOYSA-N 0 3 410.514 4.198 20 0 HIADHN COc1ccccc1[C@H](NC(=O)N[C@H]1CCN(Cc2ccccc2)[C@@H]1C)c1ccco1 ZINC000500153858 909632918 /nfs/dbraw/zinc/63/29/18/909632918.db2.gz ZHCFCPHBRKOPND-ZHRMCQFGSA-N 0 3 419.525 4.340 20 0 HIADHN COCCN1CCC(NC(=O)[C@H](Oc2cccc(C(C)C)c2)c2ccccc2)CC1 ZINC000500178298 909669822 /nfs/dbraw/zinc/66/98/22/909669822.db2.gz VWAVEYGEVKKYPR-XMMPIXPASA-N 0 3 410.558 4.157 20 0 HIADHN CCc1nnc(NC(=O)[C@H](C)[C@@H](C)NCc2cc(C(F)(F)F)ccc2F)s1 ZINC000513059888 921515721 /nfs/dbraw/zinc/51/57/21/921515721.db2.gz XMVPIKMRALFAPN-NXEZZACHSA-N 0 3 404.433 4.011 20 0 HIADHN O=C(CN1CCC[C@H](Cc2ccccc2)C1)N1CCC(OCc2ccccc2)CC1 ZINC000500214708 909705309 /nfs/dbraw/zinc/70/53/09/909705309.db2.gz KEVZCWWZWVWIKW-XMMPIXPASA-N 0 3 406.570 4.149 20 0 HIADHN CNC(=O)[C@@H]1CCC[C@H]1NCc1c(C)nn(-c2ccccc2)c1Oc1ccc(F)cc1 ZINC000500232475 909721757 /nfs/dbraw/zinc/72/17/57/909721757.db2.gz VZNLFSIUGRSFFL-IFMALSPDSA-N 0 3 422.504 4.116 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCCc1nc2c(cccc2C)o1)c1ccsc1 ZINC000500265083 909746910 /nfs/dbraw/zinc/74/69/10/909746910.db2.gz XAJUMFLUWZEXFM-KRWDZBQOSA-N 0 3 400.548 4.123 20 0 HIADHN O=C(NC[C@@H]1CCCN(Cc2cccs2)C1)c1nn(-c2ccccc2)c2c1CCC2 ZINC000500275969 909754716 /nfs/dbraw/zinc/75/47/16/909754716.db2.gz QSKGBVIWMAZCMY-SFHVURJKSA-N 0 3 420.582 4.065 20 0 HIADHN C[C@@H]1C[C@@H]1c1ccc([C@@H]2C[C@H]2C(=O)N(C)C2CCN(CCc3ccccn3)CC2)o1 ZINC000500330849 909790504 /nfs/dbraw/zinc/79/05/04/909790504.db2.gz CIQVFXURLRMQSR-XYEHWOGUSA-N 0 3 407.558 4.067 20 0 HIADHN C[C@@H](NC(=O)N1CCCN(Cc2ccccc2)CC1)c1ccccc1OC(F)F ZINC000500400314 909836379 /nfs/dbraw/zinc/83/63/79/909836379.db2.gz GRCGZPRMNHOUPB-QGZVFWFLSA-N 0 3 403.473 4.267 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)c2ccc(N3CCCC3)c(F)c2)cc1 ZINC000500408338 909841342 /nfs/dbraw/zinc/84/13/42/909841342.db2.gz MXNVWOAASJDPPB-JOCHJYFZSA-N 0 3 411.521 4.001 20 0 HIADHN Cc1ccccc1NC(=O)C[C@H](C)NCc1cccc(C(=O)NCc2ccco2)c1 ZINC000513076565 921529060 /nfs/dbraw/zinc/52/90/60/921529060.db2.gz RIVDZVITWQWJGX-SFHVURJKSA-N 0 3 405.498 4.025 20 0 HIADHN O=C(NC[C@H]1CCCN(Cc2ccccc2OCc2ccccn2)C1)c1ccccc1 ZINC000513077053 921530477 /nfs/dbraw/zinc/53/04/77/921530477.db2.gz RUYLMDJRVKDIAX-OAQYLSRUSA-N 0 3 415.537 4.303 20 0 HIADHN COc1ccc(C(=O)CCCC(=O)N[C@@H]2CCN(Cc3ccccc3)[C@H](C)C2)cc1 ZINC000500494792 909890175 /nfs/dbraw/zinc/89/01/75/909890175.db2.gz ABSQLHWEXQBYAQ-DENIHFKCSA-N 0 3 408.542 4.218 20 0 HIADHN Cc1ccc([C@@H](CN2CCOCC2)NCc2ccc(OCc3ccccn3)cc2)cc1 ZINC000500536080 909913525 /nfs/dbraw/zinc/91/35/25/909913525.db2.gz RGIDHULUATUQAR-AREMUKBSSA-N 0 3 417.553 4.132 20 0 HIADHN CCN1CCN(Cc2ccc(CNC(=O)Nc3ccccc3C(F)(F)F)cc2)CC1 ZINC000500619773 909970035 /nfs/dbraw/zinc/97/00/35/909970035.db2.gz KDGVTDXZTUJHNJ-UHFFFAOYSA-N 0 3 420.479 4.165 20 0 HIADHN CC(C)CN(C(=O)c1cccc(OCc2cn3ccccc3n2)c1)C1CCN(C)CC1 ZINC000500666678 910006961 /nfs/dbraw/zinc/00/69/61/910006961.db2.gz BUYLMMDDEFPUPX-UHFFFAOYSA-N 0 3 420.557 4.106 20 0 HIADHN CC(C)CN(C(=O)C[C@H](NC(=O)c1ccccc1)c1ccccc1)C1CCN(C)CC1 ZINC000500677730 910015354 /nfs/dbraw/zinc/01/53/54/910015354.db2.gz JIIHFIRISYXARS-DEOSSOPVSA-N 0 3 421.585 4.127 20 0 HIADHN CCN1CCN(Cc2ccc(CNC(=O)N[C@H](C)c3cc4ccccc4o3)cc2)CC1 ZINC000500689089 910024192 /nfs/dbraw/zinc/02/41/92/910024192.db2.gz QVPPZJDLRANKEQ-LJQANCHMSA-N 0 3 420.557 4.131 20 0 HIADHN Cc1ccc2nc(C)c(C(=O)N(C)C3CCN(CCc4ccccn4)CC3)cc2c1 ZINC000500786685 910078945 /nfs/dbraw/zinc/07/89/45/910078945.db2.gz TXGUWNBVUFZOHV-UHFFFAOYSA-N 0 3 402.542 4.026 20 0 HIADHN COc1cc(C(C)=O)ccc1OCCCC(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000500835081 910112935 /nfs/dbraw/zinc/11/29/35/910112935.db2.gz CHZWCQOWOSFWCQ-XMSQKQJNSA-N 0 3 424.541 4.009 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)Cc2ccc(F)c(Br)c2)C1 ZINC000500870268 910143202 /nfs/dbraw/zinc/14/32/02/910143202.db2.gz VCBYYUKIZXZGKD-RHSMWYFYSA-N 0 3 405.311 4.082 20 0 HIADHN COc1cc(Br)ccc1C(=O)N[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000500880855 910154315 /nfs/dbraw/zinc/15/43/15/910154315.db2.gz QODFVSNXWGPTJW-PBHICJAKSA-N 0 3 403.320 4.023 20 0 HIADHN COc1cc(Br)ccc1C(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000500880858 910154337 /nfs/dbraw/zinc/15/43/37/910154337.db2.gz QODFVSNXWGPTJW-YOEHRIQHSA-N 0 3 403.320 4.023 20 0 HIADHN CC(C)CN(C(=O)C1CCC(NC(=O)CC2CCCCC2)CC1)C1CCN(C)CC1 ZINC000513105192 921553155 /nfs/dbraw/zinc/55/31/55/921553155.db2.gz SOBCDXPIOVANKR-UHFFFAOYSA-N 0 3 419.654 4.211 20 0 HIADHN COCCCOc1cccc(CN2CCC(C(=O)Nc3ccc(F)cc3)CC2)c1 ZINC000513111964 921558995 /nfs/dbraw/zinc/55/89/95/921558995.db2.gz QAVOVWBTDUTYSR-UHFFFAOYSA-N 0 3 400.494 4.092 20 0 HIADHN COc1cccc(CNC(=O)NC[C@H](c2ccccc2)N(C)C)c1OC1CCCC1 ZINC000501029849 910246407 /nfs/dbraw/zinc/24/64/07/910246407.db2.gz TYZVQASNJRAYCH-OAQYLSRUSA-N 0 3 411.546 4.119 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1ccc(NC(=O)C2CC2)cc1)c1ccsc1 ZINC000501089464 910289399 /nfs/dbraw/zinc/28/93/99/910289399.db2.gz JMMVENHQMBGHID-IBGZPJMESA-N 0 3 400.548 4.301 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCc1ccnc(N2CCCCC2)c1)c1ccsc1 ZINC000501110587 910299253 /nfs/dbraw/zinc/29/92/53/910299253.db2.gz VJEDUJCZNDMUCQ-FQEVSTJZSA-N 0 3 415.607 4.016 20 0 HIADHN C[C@@H]1[C@H](NC(=O)N[C@@H](c2cccc(F)c2)c2ccccn2)CCN1Cc1ccccc1 ZINC000501111217 910299776 /nfs/dbraw/zinc/29/97/76/910299776.db2.gz AEDFQHUNZLIRQH-XANCMCCPSA-N 0 3 418.516 4.272 20 0 HIADHN CCOc1ccccc1Oc1ccc(CNCc2ccc(-n3cncn3)cc2)cn1 ZINC000513120376 921566399 /nfs/dbraw/zinc/56/63/99/921566399.db2.gz MXDFEDPTESNKPP-UHFFFAOYSA-N 0 3 401.470 4.143 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCc1cc(Br)cs1)c1ccsc1 ZINC000501139341 910318565 /nfs/dbraw/zinc/31/85/65/910318565.db2.gz BKXPIWAMELFQQV-OAHLLOKOSA-N 0 3 416.410 4.454 20 0 HIADHN Cc1cc(N(C)C)cc(C)c1NC(=O)N(CCN(C)C)Cc1ccc(F)cc1F ZINC000501223235 910385508 /nfs/dbraw/zinc/38/55/08/910385508.db2.gz RDKBKLVKBNWXSI-UHFFFAOYSA-N 0 3 404.505 4.243 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)CCc2nc(-c3ccc(Cl)cc3)no2)C1 ZINC000501236925 910394888 /nfs/dbraw/zinc/39/48/88/910394888.db2.gz VINCCCNEJFFXLR-OXQOHEQNSA-N 0 3 424.932 4.274 20 0 HIADHN CN(C(=O)c1ccc(-c2noc(C(F)F)n2)cc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000501282409 910445095 /nfs/dbraw/zinc/44/50/95/910445095.db2.gz XZLFEULMMIBLJY-GOSISDBHSA-N 0 3 412.440 4.021 20 0 HIADHN O=C(Nc1ccccc1)NC1CCN(CCOc2ccc(C(F)(F)F)cc2)CC1 ZINC000501326201 910471590 /nfs/dbraw/zinc/47/15/90/910471590.db2.gz DWBPOUNXKCOIBI-UHFFFAOYSA-N 0 3 407.436 4.370 20 0 HIADHN CC(C)c1ccc(C[C@@H](C)NC(=O)N(C)C2CCN(CCc3ccccn3)CC2)cc1 ZINC000501334664 910474681 /nfs/dbraw/zinc/47/46/81/910474681.db2.gz TUOLQZQXFSKABV-OAQYLSRUSA-N 0 3 422.617 4.485 20 0 HIADHN CCCC(=O)Nc1ccc(CNC(=O)NC[C@@H](CC)N2CCc3ccccc3C2)cc1 ZINC000501334170 910475183 /nfs/dbraw/zinc/47/51/83/910475183.db2.gz PWLQKYDAMGIDSR-HSZRJFAPSA-N 0 3 422.573 4.061 20 0 HIADHN CC[C@@H](CNC(=O)Nc1cc2c(cc1Cl)OCCO2)N1CCc2ccccc2C1 ZINC000501346697 910484098 /nfs/dbraw/zinc/48/40/98/910484098.db2.gz GWGJDRQKHLBWRV-KRWDZBQOSA-N 0 3 415.921 4.070 20 0 HIADHN Cc1nc(C(=O)N(Cc2ccco2)C2CCN(C)CC2)nn1-c1ccccc1C(C)C ZINC000501381645 910512657 /nfs/dbraw/zinc/51/26/57/910512657.db2.gz NMKDMRSUFXJOPD-UHFFFAOYSA-N 0 3 421.545 4.029 20 0 HIADHN CC(C)[C@@H]1CN(C)CCN1C(=O)Nc1ccc2nc(C(F)(F)C(F)(F)F)[nH]c2c1 ZINC000501401418 910531832 /nfs/dbraw/zinc/53/18/32/910531832.db2.gz UDIRVZMMWGAOQN-AWEZNQCLSA-N 0 3 419.398 4.021 20 0 HIADHN CC[C@H](CNC(=O)N1CCC(c2ccc(O)cc2)CC1)N1CCc2ccccc2C1 ZINC000501402402 910534198 /nfs/dbraw/zinc/53/41/98/910534198.db2.gz BFURWDLFCVBSCV-HSZRJFAPSA-N 0 3 407.558 4.118 20 0 HIADHN CCCOc1cc(CN2CCC(C(=O)Nc3ccc(F)cc3)CC2)ccc1OC ZINC000513150845 921586662 /nfs/dbraw/zinc/58/66/62/921586662.db2.gz SJWGBDJODBSLQJ-UHFFFAOYSA-N 0 3 400.494 4.474 20 0 HIADHN C[C@H](NCC(c1ccc(F)cc1)c1ccc(F)cc1)c1nnnn1-c1ccccc1 ZINC000501432013 910563122 /nfs/dbraw/zinc/56/31/22/910563122.db2.gz CJOMQODYBBNLRM-INIZCTEOSA-N 0 3 405.452 4.423 20 0 HIADHN COc1ccccc1N1CC[C@@H](CNCc2c(F)ccc(Br)c2F)C1 ZINC000501449718 910576931 /nfs/dbraw/zinc/57/69/31/910576931.db2.gz ZQVBCFSUBYVZMV-ZDUSSCGKSA-N 0 3 411.290 4.352 20 0 HIADHN Fc1ccc(Br)c(F)c1CNCCC1CCN(CC(F)(F)F)CC1 ZINC000501461922 910583501 /nfs/dbraw/zinc/58/35/01/910583501.db2.gz MXAAVBXYMQRWPA-UHFFFAOYSA-N 0 3 415.244 4.481 20 0 HIADHN O=C(NCc1nc(CN[C@@H]2CCC[C@H](c3cccnc3)C2)cs1)c1ccccc1 ZINC000501474620 910590134 /nfs/dbraw/zinc/59/01/34/910590134.db2.gz QVSKGDHRZGIIMS-AZUAARDMSA-N 0 3 406.555 4.284 20 0 HIADHN CCc1ccc(Cl)c(CC)c1NC(=O)CCCN1CCCN(CC(F)F)CC1 ZINC000501528477 910639148 /nfs/dbraw/zinc/63/91/48/910639148.db2.gz PZRTWBIJLXGOSD-UHFFFAOYSA-N 0 3 415.956 4.456 20 0 HIADHN CSc1ccccc1[C@@H](C)NCC(=O)Nc1cccc(CN2CCSCC2)c1 ZINC000501536139 910644112 /nfs/dbraw/zinc/64/41/12/910644112.db2.gz OUOKFYZONIYTPJ-QGZVFWFLSA-N 0 3 415.628 4.247 20 0 HIADHN CCCn1nccc1C1CCN(C[C@@H](O)COc2ccc(Cl)cc2Cl)CC1 ZINC000501560058 910665522 /nfs/dbraw/zinc/66/55/22/910665522.db2.gz DLVWVNFXPQFZTR-QGZVFWFLSA-N 0 3 412.361 4.219 20 0 HIADHN C[C@@H](NCC1(c2cccc(Cl)c2)CCCC1)C(=O)N1CC(=O)Nc2ccccc21 ZINC000513168903 921598306 /nfs/dbraw/zinc/59/83/06/921598306.db2.gz XULFIDKEXRWGDS-MRXNPFEDSA-N 0 3 411.933 4.115 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)Cc2ccc(OCc3ccccn3)cc2)C1 ZINC000501677485 910750040 /nfs/dbraw/zinc/75/00/40/910750040.db2.gz GYYUJYGFNGXGRR-NFBKMPQASA-N 0 3 415.537 4.155 20 0 HIADHN CC(C)[C@H](NC(=O)NCCCN1CCc2ccccc2C1)c1nc2ccccc2[nH]1 ZINC000501707696 910775187 /nfs/dbraw/zinc/77/51/87/910775187.db2.gz DJWWPACESJMJGJ-QFIPXVFZSA-N 0 3 405.546 4.008 20 0 HIADHN COCc1cccc(CN2CCC[C@@H](c3n[nH]cc3NC(=O)c3ccccc3)C2)c1 ZINC000501714820 910783783 /nfs/dbraw/zinc/78/37/83/910783783.db2.gz FCICTVGQEDZMII-OAQYLSRUSA-N 0 3 404.514 4.188 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)c1ccnc(-c2ccc(Cl)cc2)n1 ZINC000501736079 910798086 /nfs/dbraw/zinc/79/80/86/910798086.db2.gz QFKJGCFXGBCLQU-UHFFFAOYSA-N 0 3 412.896 4.140 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)c2ccc(-c3noc(C(F)F)n3)cc2)c1 ZINC000501745594 910806230 /nfs/dbraw/zinc/80/62/30/910806230.db2.gz NRLXIMJYSHDYAY-UHFFFAOYSA-N 0 3 414.456 4.187 20 0 HIADHN CCOc1cccc(CN2CCC[C@@H](c3n[nH]cc3NC(=O)c3ccccc3)C2)c1 ZINC000501763159 910818696 /nfs/dbraw/zinc/81/86/96/910818696.db2.gz NRLRABUKDIRLKA-HXUWFJFHSA-N 0 3 404.514 4.440 20 0 HIADHN COc1ccc(C)cc1CN1CCC[C@H](c2n[nH]cc2NC(=O)c2ccccc2)C1 ZINC000501774870 910829154 /nfs/dbraw/zinc/82/91/54/910829154.db2.gz VGAHPWPMIOHLMK-IBGZPJMESA-N 0 3 404.514 4.359 20 0 HIADHN Cc1cc(NC(=O)[C@H](C)Cc2ccccc2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000501773652 910829620 /nfs/dbraw/zinc/82/96/20/910829620.db2.gz XAUFRCQZCBLJDT-AUSIDOKSSA-N 0 3 402.542 4.456 20 0 HIADHN O=C(Nc1ccc(OC[C@H]2CCCO2)cc1)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000501804291 910854971 /nfs/dbraw/zinc/85/49/71/910854971.db2.gz JSSHIZYSERFVCC-PKTZIBPZSA-N 0 3 409.530 4.203 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)N[C@H](c1ccccc1)c1ccccn1 ZINC000501807799 910858161 /nfs/dbraw/zinc/85/81/61/910858161.db2.gz VMGGZBCUCCEHNJ-BJKOFHAPSA-N 0 3 400.526 4.307 20 0 HIADHN C[C@@H](NC(=O)N1CCc2nc(-c3ccccc3Cl)sc2C1)C1=CCN(C)CC1 ZINC000501819205 910867008 /nfs/dbraw/zinc/86/70/08/910867008.db2.gz BQOSVVVFLUGWJV-CQSZACIVSA-N 0 3 416.978 4.182 20 0 HIADHN CC(C)OC(=O)C[C@@H](NC(=O)N[C@H](CN1CCCC1)c1ccccc1)c1ccccc1 ZINC000501849383 910882720 /nfs/dbraw/zinc/88/27/20/910882720.db2.gz JFAFRAWVZUJBIJ-DHIUTWEWSA-N 0 3 423.557 4.206 20 0 HIADHN O=C(NCc1cc(Br)cs1)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000501848122 910883075 /nfs/dbraw/zinc/88/30/75/910883075.db2.gz IAVGIUJFFYQEIW-KRWDZBQOSA-N 0 3 408.365 4.147 20 0 HIADHN CC(C)(C)NC(=O)c1ccc(NC(=O)N[C@@H](CN2CCCC2)c2ccccc2)cc1 ZINC000501851249 910884213 /nfs/dbraw/zinc/88/42/13/910884213.db2.gz VXXRMPIVDLUZML-NRFANRHFSA-N 0 3 408.546 4.174 20 0 HIADHN O=C(CCc1ncc(-c2ccc(F)cc2F)o1)N1CCN(CC2CCCCC2)CC1 ZINC000501860758 910890338 /nfs/dbraw/zinc/89/03/38/910890338.db2.gz HAIOAXZNDRCMOD-UHFFFAOYSA-N 0 3 417.500 4.277 20 0 HIADHN COc1cc(C(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)cc(OC)c1C ZINC000502008438 910976140 /nfs/dbraw/zinc/97/61/40/910976140.db2.gz SLTNXPMJSGVBOI-UHFFFAOYSA-N 0 3 424.463 4.235 20 0 HIADHN Cc1ccc(OCc2cccc(C(=O)NC[C@@H]3CCCN3Cc3ccccc3)c2)cn1 ZINC000513219574 921634772 /nfs/dbraw/zinc/63/47/72/921634772.db2.gz UVTJQVJTDKRXOZ-DEOSSOPVSA-N 0 3 415.537 4.363 20 0 HIADHN CC[C@H](C)n1ncc2c1nc(C)cc2C(=O)NC[C@H]1CCCN1Cc1ccccc1 ZINC000513222953 921636918 /nfs/dbraw/zinc/63/69/18/921636918.db2.gz KJTFGSSUWSSHOL-AZUAARDMSA-N 0 3 405.546 4.105 20 0 HIADHN COCCN(Cc1ccc(F)cc1Cl)C(=O)NC[C@H](c1ccc(C)cc1)N(C)C ZINC000502197480 911139998 /nfs/dbraw/zinc/13/99/98/911139998.db2.gz NOIRJJIHLSATRA-OAQYLSRUSA-N 0 3 421.944 4.248 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)c3cc(F)cc4cccnc43)CC2)c1 ZINC000502205021 911148267 /nfs/dbraw/zinc/14/82/67/911148267.db2.gz AYVDNDLKXUKNRD-UHFFFAOYSA-N 0 3 420.532 4.015 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)c1ccc(NC(=O)c2ccccc2)cc1 ZINC000513225932 921640572 /nfs/dbraw/zinc/64/05/72/921640572.db2.gz FJJAPJNPKZPSHX-DEOSSOPVSA-N 0 3 413.521 4.333 20 0 HIADHN COc1cccc([C@H](CNC(=O)C[C@H](C)c2ccc(F)cc2F)N2CCCC2)c1 ZINC000502269633 911217937 /nfs/dbraw/zinc/21/79/37/911217937.db2.gz PIQXNKHSISCBEA-AOMKIAJQSA-N 0 3 402.485 4.420 20 0 HIADHN COc1cc(C)c(C[C@@H](C)N[C@H](CCSC)c2nnc3ccccn32)cc1OC ZINC000502280618 911231222 /nfs/dbraw/zinc/23/12/22/911231222.db2.gz WKNACZHTKZDSFL-SJLPKXTDSA-N 0 3 414.575 4.070 20 0 HIADHN CC(=O)Nc1c[nH]nc1[C@@H]1CCCN(CCOc2ccc(Oc3ccccc3)cc2)C1 ZINC000502313019 911281733 /nfs/dbraw/zinc/28/17/33/911281733.db2.gz ASBKSWWIRGQMSX-LJQANCHMSA-N 0 3 420.513 4.419 20 0 HIADHN O=C(Nc1cccc(C(=O)NC[C@@H]2CCCN2Cc2ccccc2)c1)c1cccs1 ZINC000513239382 921650280 /nfs/dbraw/zinc/65/02/80/921650280.db2.gz XSXSKZPNAJSWHV-NRFANRHFSA-N 0 3 419.550 4.395 20 0 HIADHN Cc1cc(CSc2ncccc2C(=O)NC[C@@H]2CCCN2Cc2ccccc2)no1 ZINC000513237635 921650524 /nfs/dbraw/zinc/65/05/24/921650524.db2.gz CNMMFMSKSMQPJY-FQEVSTJZSA-N 0 3 422.554 4.065 20 0 HIADHN C[C@@H](CC(=O)Nc1cccc(F)c1)N[C@@H]1CCOc2c(Br)cccc21 ZINC000502346455 911328330 /nfs/dbraw/zinc/32/83/30/911328330.db2.gz PTYBLWLULWABBI-YVEFUNNKSA-N 0 3 407.283 4.419 20 0 HIADHN CCN(CC)[C@H](CNC(=O)[C@H](C)n1nc(C)cc1C)c1ccc(C(F)(F)F)cc1 ZINC000502506919 911512251 /nfs/dbraw/zinc/51/22/51/911512251.db2.gz LKBLRUZULUYANP-QFBILLFUSA-N 0 3 410.484 4.279 20 0 HIADHN CCOc1cc(C[NH2+]C[C@H](C)N2CCc3ccccc3C2)cc(Br)c1[O-] ZINC000502516913 911521716 /nfs/dbraw/zinc/52/17/16/911521716.db2.gz FFGMIDWHRXNPSG-HNNXBMFYSA-N 0 3 419.363 4.090 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1ccc2c(c1)CCCN2C(C)=O)c1ccsc1 ZINC000502585224 911590179 /nfs/dbraw/zinc/59/01/79/911590179.db2.gz NHVFOGFQGFOULM-OAQYLSRUSA-N 0 3 414.575 4.252 20 0 HIADHN O=C(NC[C@H]1CCCN1Cc1ccccc1)C1(c2ccccc2Cl)CCOCC1 ZINC000513263821 921667521 /nfs/dbraw/zinc/66/75/21/921667521.db2.gz SKXATRPIYPLLKT-HXUWFJFHSA-N 0 3 412.961 4.169 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3ccc(-c4csnn4)cc3)c(C)c2)CC1 ZINC000502592542 911594325 /nfs/dbraw/zinc/59/43/25/911594325.db2.gz FLANXTBEPBXFSZ-UHFFFAOYSA-N 0 3 422.558 4.299 20 0 HIADHN COc1ccccc1OCc1ccc(C(=O)NC[C@@H]2CCCN2Cc2ccccc2)o1 ZINC000513274779 921675354 /nfs/dbraw/zinc/67/53/54/921675354.db2.gz XCNZYMYKLIGTML-FQEVSTJZSA-N 0 3 420.509 4.262 20 0 HIADHN Cn1nccc1-c1ccccc1CNCc1cnn(-c2ccc(Br)cc2)c1 ZINC000513282475 921682469 /nfs/dbraw/zinc/68/24/69/921682469.db2.gz ZCIDYDSFEGCESQ-UHFFFAOYSA-N 0 3 422.330 4.325 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3ccccc3N3CCCC3)c(C)c2)CC1 ZINC000502661761 911703749 /nfs/dbraw/zinc/70/37/49/911703749.db2.gz KQKKJSXHNLNGRO-UHFFFAOYSA-N 0 3 407.562 4.381 20 0 HIADHN COc1ccc(NC(=O)[C@H](N[C@@H](C)[C@H]2CCCOC2)c2ccccc2)cc1Cl ZINC000502668487 911710694 /nfs/dbraw/zinc/71/06/94/911710694.db2.gz ZRLVNKKHZRAYQH-HZUJVAHNSA-N 0 3 402.922 4.433 20 0 HIADHN CCCc1noc2nc(-c3ccco3)cc(C(=O)N(CCN(C)C)C3CCCC3)c12 ZINC000502794237 911816582 /nfs/dbraw/zinc/81/65/82/911816582.db2.gz RSSSTWXKDJEGBB-UHFFFAOYSA-N 0 3 410.518 4.382 20 0 HIADHN C[C@@H]1CCN(C)CCN1C(=O)N[C@H](c1ccccc1)c1ccc(Br)cc1 ZINC000502811066 911827945 /nfs/dbraw/zinc/82/79/45/911827945.db2.gz HQPZOECWPUSANX-OXQOHEQNSA-N 0 3 416.363 4.274 20 0 HIADHN Cc1noc2nc(C3CC3)cc(C(=O)Nc3cccc(N4CCN(C(C)C)CC4)c3)c12 ZINC000502880446 911881127 /nfs/dbraw/zinc/88/11/27/911881127.db2.gz JBUBMMYPARVJFC-UHFFFAOYSA-N 0 3 419.529 4.191 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)Cc3coc(-c4cccs4)n3)c2)CC1 ZINC000502893911 911888420 /nfs/dbraw/zinc/88/84/20/911888420.db2.gz VQYWIQFZZVVTAQ-UHFFFAOYSA-N 0 3 410.543 4.115 20 0 HIADHN CCCN(CC(=O)NCc1ccc(Cl)s1)[C@H](C)CC(=O)Nc1ccccc1 ZINC000502920958 911906188 /nfs/dbraw/zinc/90/61/88/911906188.db2.gz VYYXQFXRSLYLRX-OAHLLOKOSA-N 0 3 407.967 4.147 20 0 HIADHN CCN1CCN([C@H](C)CNC(=O)[C@H](Oc2cccc(C(C)C)c2)c2ccccc2)CC1 ZINC000503010791 911983744 /nfs/dbraw/zinc/98/37/44/911983744.db2.gz BPFVDDKOEZZNRN-PXDATVDWSA-N 0 3 423.601 4.072 20 0 HIADHN CCN1CCN(CCCNC(=O)[C@H](Oc2cccc(C(C)C)c2)c2ccccc2)CC1 ZINC000503022525 911994574 /nfs/dbraw/zinc/99/45/74/911994574.db2.gz SZOKXXKXTSCHID-RUZDIDTESA-N 0 3 423.601 4.074 20 0 HIADHN Cc1nccn1CCCN(C)CC(=O)Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000503082033 912051416 /nfs/dbraw/zinc/05/14/16/912051416.db2.gz WQOSEWHLLYBDOG-UHFFFAOYSA-N 0 3 422.373 4.190 20 0 HIADHN CC(C)Oc1ccc(CNC(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)cn1 ZINC000503102832 912072608 /nfs/dbraw/zinc/07/26/08/912072608.db2.gz UMSAMXIEESHNTI-LJQANCHMSA-N 0 3 416.591 4.203 20 0 HIADHN O=C(CCN1CCCN(c2nccs2)CC1)Nc1ccccc1-c1ccccc1 ZINC000513338788 921725428 /nfs/dbraw/zinc/72/54/28/921725428.db2.gz BDIDIGLSFQCPNS-UHFFFAOYSA-N 0 3 406.555 4.351 20 0 HIADHN CCN(Cc1cccs1)C(=O)NCCCCN1CCN(c2cccc(C)c2)CC1 ZINC000503207914 912188944 /nfs/dbraw/zinc/18/89/44/912188944.db2.gz KATDRYDTVJMBPE-UHFFFAOYSA-N 0 3 414.619 4.190 20 0 HIADHN COc1ccc(Br)cc1NC(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000506279821 914880501 /nfs/dbraw/zinc/88/05/01/914880501.db2.gz GPEBVWYYFAFIDJ-WMLDXEAASA-N 0 3 418.335 4.415 20 0 HIADHN CCOC1CC2(C1)CCN(C(=O)NC[C@@H](c1ccc(CC(C)C)cc1)N(C)C)C2 ZINC000513346357 921729118 /nfs/dbraw/zinc/72/91/18/921729118.db2.gz UBBANIPWQBBTTL-MHIUNMELSA-N 0 3 401.595 4.088 20 0 HIADHN Cc1ncsc1CCN[C@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000506294553 914889575 /nfs/dbraw/zinc/88/95/75/914889575.db2.gz LOSRXRBXXJYDLZ-HXUWFJFHSA-N 0 3 420.987 4.430 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)Nc2ccccc2N2C[C@@H](C)O[C@@H](C)C2)C1 ZINC000506295442 914890563 /nfs/dbraw/zinc/89/05/63/914890563.db2.gz QQNNTPJZPIGZTI-XAPVIXHLSA-N 0 3 422.573 4.257 20 0 HIADHN Cc1cc(C)n2c(CN3CCCN(Cc4ccc(C(F)(F)F)cc4)CC3)cnc2n1 ZINC000506297430 914891777 /nfs/dbraw/zinc/89/17/77/914891777.db2.gz JWRKRDWTDKETQE-UHFFFAOYSA-N 0 3 417.479 4.073 20 0 HIADHN Cc1cc(NC(=O)C2CCN(Cc3cn(-c4ccccc4)nc3C(C)C)CC2)no1 ZINC000506313692 914902652 /nfs/dbraw/zinc/90/26/52/914902652.db2.gz YAAOHMMBLLXRRB-UHFFFAOYSA-N 0 3 407.518 4.143 20 0 HIADHN COc1cc(OC)c(NC(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)cc1Cl ZINC000506312739 914903206 /nfs/dbraw/zinc/90/32/06/914903206.db2.gz QFSOHYYNLLIQTQ-GDBMZVCRSA-N 0 3 403.910 4.314 20 0 HIADHN CC(C)Cc1ccc([C@H](CNC(=O)N(C)C[C@H](C)c2nccs2)N(C)C)cc1 ZINC000513356094 921735315 /nfs/dbraw/zinc/73/53/15/921735315.db2.gz BWNHRZAHLBTMDU-PXNSSMCTSA-N 0 3 402.608 4.389 20 0 HIADHN CCCNC(=O)C1CCN(Cc2cnc(-c3ccc(Br)cc3)s2)CC1 ZINC000506354591 914975686 /nfs/dbraw/zinc/97/56/86/914975686.db2.gz DESNQVJUIYOYEJ-UHFFFAOYSA-N 0 3 422.392 4.311 20 0 HIADHN C[C@H](Cc1ccc(Br)cc1)NC(=O)c1cccc(CN2CCCC2)c1 ZINC000513367973 921741374 /nfs/dbraw/zinc/74/13/74/921741374.db2.gz SMZCURXCSSZBGA-MRXNPFEDSA-N 0 3 401.348 4.406 20 0 HIADHN C[C@@H](Cc1ccc(Br)cc1)NC(=O)c1cccc(CN2CCCC2)c1 ZINC000513367968 921742358 /nfs/dbraw/zinc/74/23/58/921742358.db2.gz SMZCURXCSSZBGA-INIZCTEOSA-N 0 3 401.348 4.406 20 0 HIADHN COc1ccc(Br)c(NC(=O)N(CCN(C)C)Cc2cccc(F)c2)c1 ZINC000506501541 915121692 /nfs/dbraw/zinc/12/16/92/915121692.db2.gz CSWPIXBPRICXQT-UHFFFAOYSA-N 0 3 424.314 4.193 20 0 HIADHN O=C(Nc1ccnc(Sc2ccccn2)c1)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000506531503 915174083 /nfs/dbraw/zinc/17/40/83/915174083.db2.gz GKQFGARJIIDZIC-IBGZPJMESA-N 0 3 405.527 4.024 20 0 HIADHN COc1cc(Cl)c(C)cc1NC(=O)CCN[C@@H](Cc1ccccn1)c1cccnc1 ZINC000513377563 921751410 /nfs/dbraw/zinc/75/14/10/921751410.db2.gz MUDPLPJXTPULEW-FQEVSTJZSA-N 0 3 424.932 4.349 20 0 HIADHN CC(C)c1nc(C2CCN(CCC(=O)Nc3ccccc3Br)CC2)no1 ZINC000506583392 915233519 /nfs/dbraw/zinc/23/35/19/915233519.db2.gz BORDMTNHXGCLIU-UHFFFAOYSA-N 0 3 421.339 4.164 20 0 HIADHN Cc1n[nH]c(C)c1[C@H]1CCCN1C(=O)NC[C@H](c1ccc(CC(C)C)cc1)N(C)C ZINC000513385265 921757898 /nfs/dbraw/zinc/75/78/98/921757898.db2.gz VKMZYJMMJWLQHO-FGZHOGPDSA-N 0 3 411.594 4.374 20 0 HIADHN Cc1nc(COc2ccc(CN3CC=C(c4c[nH]c5ncccc45)CC3)cc2)no1 ZINC000506619629 915277424 /nfs/dbraw/zinc/27/74/24/915277424.db2.gz XWESQQWQFYDMKD-UHFFFAOYSA-N 0 3 401.470 4.123 20 0 HIADHN CCCN(C(=O)NC[C@H](C)c1c(C)noc1C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000506644906 915315137 /nfs/dbraw/zinc/31/51/37/915315137.db2.gz FLTRVBSGIVKGMX-PGRDOPGGSA-N 0 3 412.578 4.481 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)Nc1cccc(N2CCCC2)c1 ZINC000506676643 915353205 /nfs/dbraw/zinc/35/32/05/915353205.db2.gz FIAWYGSAOYZGPP-UHFFFAOYSA-N 0 3 402.489 4.161 20 0 HIADHN COc1ccc2oc(CN3CCC(C(=O)Nc4ccc5c(c4)OCO5)CC3)cc2c1 ZINC000506708159 915384604 /nfs/dbraw/zinc/38/46/04/915384604.db2.gz SNIBVYOYCQOPBC-UHFFFAOYSA-N 0 3 408.454 4.021 20 0 HIADHN CCCCOc1ccc(CN2CCC(C(=O)NCc3ccccc3)CC2)cc1OC ZINC000506709279 915387497 /nfs/dbraw/zinc/38/74/97/915387497.db2.gz XVWZAVORXKSTMB-UHFFFAOYSA-N 0 3 410.558 4.403 20 0 HIADHN CN(C)Cc1cccc(NC(=O)C(=O)Nc2cccc(COc3ccc(F)cc3)c2)c1 ZINC000506732689 915418239 /nfs/dbraw/zinc/41/82/39/915418239.db2.gz QISJJNIRFPGAMW-UHFFFAOYSA-N 0 3 421.472 4.044 20 0 HIADHN CC(C)n1ncc2cc(CN(C)CCOc3ccc(Br)cc3)cnc21 ZINC000506759415 915459025 /nfs/dbraw/zinc/45/90/25/915459025.db2.gz QEUCWQXPNIPBTK-UHFFFAOYSA-N 0 3 403.324 4.286 20 0 HIADHN CCOc1cc(CN(C)Cc2ccc(Cl)cc2)ccc1O[C@@H](C)C(=O)N(C)C ZINC000506766907 915472481 /nfs/dbraw/zinc/47/24/81/915472481.db2.gz JNHJBCJLBIUZAE-INIZCTEOSA-N 0 3 404.938 4.226 20 0 HIADHN CCc1ccc([C@H]2CCCN(C[C@H](O)COc3ccc(C(C)=O)cc3OC)C2)cc1 ZINC000513406915 921774978 /nfs/dbraw/zinc/77/49/78/921774978.db2.gz ZEOYVBNXZHQZPY-GOTSBHOMSA-N 0 3 411.542 4.080 20 0 HIADHN COC(=O)c1c(C2CC2)csc1NC(=O)N(CCN(C)C)Cc1cccs1 ZINC000506870394 915659753 /nfs/dbraw/zinc/65/97/53/915659753.db2.gz ALYXCXWXWXXPMG-UHFFFAOYSA-N 0 3 407.561 4.069 20 0 HIADHN COc1ccc(CN(C)C(=O)CN[C@H](c2ccc(F)cc2)C(C)(C)C)cc1OC ZINC000507041723 915836700 /nfs/dbraw/zinc/83/67/00/915836700.db2.gz UFWHWVPUTKUDOG-JOCHJYFZSA-N 0 3 402.510 4.178 20 0 HIADHN Cc1ccccc1C(=O)NC1CCN(Cc2c[nH]nc2-c2ccc(Cl)cc2)CC1 ZINC000507117847 915876573 /nfs/dbraw/zinc/87/65/73/915876573.db2.gz RVHSPXXDIMTIGH-UHFFFAOYSA-N 0 3 408.933 4.433 20 0 HIADHN COc1ccc(S[C@@H](C)C(=O)N2CCCN(CCCc3ccccc3)CC2)cc1 ZINC000507164705 915903972 /nfs/dbraw/zinc/90/39/72/915903972.db2.gz ZRXWBPLJFOTREX-FQEVSTJZSA-N 0 3 412.599 4.343 20 0 HIADHN COCCOc1ccc(NC(=O)[C@@H]2CN(Cc3ccccc3)CCC2(F)F)c(C)c1 ZINC000507191945 915941635 /nfs/dbraw/zinc/94/16/35/915941635.db2.gz QLCSOCYGFQKWKC-FQEVSTJZSA-N 0 3 418.484 4.116 20 0 HIADHN CCc1nnc(NC(=O)[C@H](C)[C@H](C)N[C@@H](C)c2ccccc2Br)s1 ZINC000507206812 915955711 /nfs/dbraw/zinc/95/57/11/915955711.db2.gz ANPYSEQQVIRRRK-WOPDTQHZSA-N 0 3 411.369 4.177 20 0 HIADHN CCNC(=O)COc1ccc(CN(C)[C@@H](C)c2cccc(C(F)(F)F)c2)cc1OC ZINC000507214971 915965668 /nfs/dbraw/zinc/96/56/68/915965668.db2.gz RNIWTUFAGDBHII-HNNXBMFYSA-N 0 3 424.463 4.422 20 0 HIADHN O=C(NC[C@H]1CN(Cc2ccccc2)CCCO1)c1cc(Cl)c(F)cc1Cl ZINC000507221090 915975330 /nfs/dbraw/zinc/97/53/30/915975330.db2.gz FDTDIJFIZQTQGO-HNNXBMFYSA-N 0 3 411.304 4.153 20 0 HIADHN C[C@H](N[C@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O)c1ccc2n[nH]cc2c1 ZINC000507225619 915979127 /nfs/dbraw/zinc/97/91/27/915979127.db2.gz AKRIITCMXNGUJD-XOBRGWDASA-N 0 3 416.447 4.424 20 0 HIADHN C[C@@H](N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1=O)c1ccc2n[nH]cc2c1 ZINC000507233225 915992430 /nfs/dbraw/zinc/99/24/30/915992430.db2.gz QCPCJAPUBZPPSL-YJYMSZOUSA-N 0 3 400.429 4.011 20 0 HIADHN CN(C(=O)c1cn(-c2ccccc2)nc1-c1ccc(Cl)cc1)C1CCN(C)CC1 ZINC000507356844 916112662 /nfs/dbraw/zinc/11/26/62/916112662.db2.gz ZJSNUCQGNZYJKP-UHFFFAOYSA-N 0 3 408.933 4.359 20 0 HIADHN O=C1NCCCC[C@H]1N[C@H]1CCCc2nc(-c3ccccc3Br)sc21 ZINC000507441559 916211445 /nfs/dbraw/zinc/21/14/45/916211445.db2.gz ICPNBVFRSXCLPI-GOEBONIOSA-N 0 3 420.376 4.208 20 0 HIADHN COCCSc1ccc([C@H](C)N[C@@H](C)C(=O)N[C@H](C)c2ccc(F)cc2)cc1 ZINC000507468360 916237154 /nfs/dbraw/zinc/23/71/54/916237154.db2.gz ZRKCYPKCXWTREU-BBWFWOEESA-N 0 3 404.551 4.481 20 0 HIADHN Cc1cc(Br)cc2cc(C(=O)NC3CCN(CCOC(C)C)CC3)oc21 ZINC000507487876 916255557 /nfs/dbraw/zinc/25/55/57/916255557.db2.gz SNLWREGFPKMNNY-UHFFFAOYSA-N 0 3 423.351 4.123 20 0 HIADHN COc1cc(N2CCOC(C)(C)C2)ccc1NC1CCN(CCC(F)(F)F)CC1 ZINC000507491354 916256347 /nfs/dbraw/zinc/25/63/47/916256347.db2.gz BHRNDYIFVLGRFA-UHFFFAOYSA-N 0 3 415.500 4.139 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)CO[C@@H]3CCCC[C@H]3C)c(OCC)c2)CC1 ZINC000507605334 916361465 /nfs/dbraw/zinc/36/14/65/916361465.db2.gz JXIVYXVQADKLNK-DENIHFKCSA-N 0 3 417.594 4.151 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3ccc(OC)cc3C)c(OCC)c2)CC1 ZINC000507607662 916363943 /nfs/dbraw/zinc/36/39/43/916363943.db2.gz RPRRSYZXCCYCJA-UHFFFAOYSA-N 0 3 411.546 4.187 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3ccc4cc[nH]c4c3)c(OCC)c2)CC1 ZINC000507611024 916367957 /nfs/dbraw/zinc/36/79/57/916367957.db2.gz MTKDKHLYKHAULG-UHFFFAOYSA-N 0 3 406.530 4.351 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](NCC[C@H]2CCCCO2)c2ccc(Cl)cc2)c1 ZINC000507610802 916368203 /nfs/dbraw/zinc/36/82/03/916368203.db2.gz LRDBOHCBXDQBMS-CTNGQTDRSA-N 0 3 407.963 4.382 20 0 HIADHN Cc1ccc([C@@H](NCC[C@H]2CCCCO2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000507610436 916368247 /nfs/dbraw/zinc/36/82/47/916368247.db2.gz JZVOWNSEAQUYFZ-OFNKIYASSA-N 0 3 401.572 4.345 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](NCC[C@@H]2CCCCO2)c2ccc(Cl)cc2)c1 ZINC000507610804 916368933 /nfs/dbraw/zinc/36/89/33/916368933.db2.gz LRDBOHCBXDQBMS-PZJWPPBQSA-N 0 3 407.963 4.382 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)[C@@H](C)c3ccccc3F)c(OCC)c2)CC1 ZINC000507610258 916369058 /nfs/dbraw/zinc/36/90/58/916369058.db2.gz JAZZOQGBVQOTJY-SFHVURJKSA-N 0 3 413.537 4.499 20 0 HIADHN CC[C@H]1C[C@H](CN2CCN(Cc3csc(-c4ccc(OC)cc4)n3)CC2)CCO1 ZINC000507615848 916373670 /nfs/dbraw/zinc/37/36/70/916373670.db2.gz BNCFMPVXTJUOHR-NQIIRXRSSA-N 0 3 415.603 4.142 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)C[C@H]3CCC[C@@H](OC)C3)c(OCC)c2)CC1 ZINC000507623648 916382716 /nfs/dbraw/zinc/38/27/16/916382716.db2.gz WFDSGECMONWDMN-PZJWPPBQSA-N 0 3 417.594 4.151 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)C[C@@H]3CCC[C@H](OC)C3)c(OCC)c2)CC1 ZINC000507623644 916383429 /nfs/dbraw/zinc/38/34/29/916383429.db2.gz WFDSGECMONWDMN-CTNGQTDRSA-N 0 3 417.594 4.151 20 0 HIADHN C[C@H](N[C@@H]1CCc2nnc(-c3ccc(F)cc3)n2C1)c1ccc(F)cc1OC(F)F ZINC000507624572 916384968 /nfs/dbraw/zinc/38/49/68/916384968.db2.gz ZUEPXIWPPJIGJS-BLLLJJGKSA-N 0 3 420.410 4.490 20 0 HIADHN CCCN(CC(=O)Nc1ccccc1CC)C1CCN(C(=O)c2ccccc2)CC1 ZINC000507634466 916392835 /nfs/dbraw/zinc/39/28/35/916392835.db2.gz ICLKJPMQRVDODI-UHFFFAOYSA-N 0 3 407.558 4.204 20 0 HIADHN OCCn1nccc1C1CCN(CCSc2cc(Cl)ccc2Cl)CC1 ZINC000507673176 916442003 /nfs/dbraw/zinc/44/20/03/916442003.db2.gz DGEXPSIDXHPNAU-UHFFFAOYSA-N 0 3 400.375 4.154 20 0 HIADHN CC[C@H](C)N(CC(=O)N1CCC(NC(=O)c2ccccc2C)CC1)Cc1ccccc1 ZINC000507678438 916448717 /nfs/dbraw/zinc/44/87/17/916448717.db2.gz OLMISOHGMSUJIF-NRFANRHFSA-N 0 3 421.585 4.017 20 0 HIADHN COc1cc(CN(C)C[C@H](O)COc2cccc(C(F)(F)F)c2)ccc1SC ZINC000507684204 916455986 /nfs/dbraw/zinc/45/59/86/916455986.db2.gz QTPKWQCEBLSYBF-INIZCTEOSA-N 0 3 415.477 4.308 20 0 HIADHN Cc1cc(C(=O)N2C[C@H](N(C)C)Cc3ccccc32)nc(-c2ccc(Cl)cc2)n1 ZINC000507711620 916503633 /nfs/dbraw/zinc/50/36/33/916503633.db2.gz YMOFMZYTIPTTMZ-LJQANCHMSA-N 0 3 406.917 4.239 20 0 HIADHN COc1cc(CN[C@H]2CCc3c2cc(Cl)cc3Cl)ccc1OCC(=O)N(C)C ZINC000507796615 916580548 /nfs/dbraw/zinc/58/05/48/916580548.db2.gz WJUVHCOFLJOOEH-SFHVURJKSA-N 0 3 423.340 4.246 20 0 HIADHN CN1C(=O)C[C@@H](NCc2cccc(OCc3ccccn3)c2)[C@H]1c1ccc(Cl)cc1 ZINC000507818823 916614488 /nfs/dbraw/zinc/61/44/88/916614488.db2.gz JYBVIWGCHJLUDQ-ISKFKSNPSA-N 0 3 421.928 4.376 20 0 HIADHN Fc1ccc(-c2nnc3n2C[C@H](NCc2cc(C(F)(F)F)ccc2F)CC3)cc1 ZINC000507874190 916710514 /nfs/dbraw/zinc/71/05/14/916710514.db2.gz JLSILNMMENBFQE-MRXNPFEDSA-N 0 3 408.374 4.347 20 0 HIADHN O=C(NCCNCc1cc2ccccc2nc1N1CCCCC1)c1ccc(Cl)cc1 ZINC000507941699 916809210 /nfs/dbraw/zinc/80/92/10/916809210.db2.gz NXKLGKUJSAALTR-UHFFFAOYSA-N 0 3 422.960 4.398 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CN1CCC[C@@H](C(=O)Nc2cccc(C)n2)C1 ZINC000507987044 916829682 /nfs/dbraw/zinc/82/96/82/916829682.db2.gz ROPOCDFVKJNQGU-HXUWFJFHSA-N 0 3 403.530 4.043 20 0 HIADHN Cc1ccc(NC(=O)[C@H]2CCCN(Cc3ccc(OCc4ccncc4)cc3)C2)nc1 ZINC000507996375 916836618 /nfs/dbraw/zinc/83/66/18/916836618.db2.gz CYOSSEALESYVNZ-QFIPXVFZSA-N 0 3 416.525 4.215 20 0 HIADHN Cc1cccc(C(=O)NCCNCc2cc3ccccc3nc2N2CCCCC2)c1 ZINC000508106747 916922254 /nfs/dbraw/zinc/92/22/54/916922254.db2.gz YWAQJJBBSNAUGT-UHFFFAOYSA-N 0 3 402.542 4.053 20 0 HIADHN Cn1c(-c2cccc3cccnc32)nnc1N1CCN(Cc2ccccc2)C(C)(C)C1 ZINC000508154416 916974762 /nfs/dbraw/zinc/97/47/62/916974762.db2.gz IWABZPXDSCIBMB-UHFFFAOYSA-N 0 3 412.541 4.131 20 0 HIADHN Cc1ccc2[nH]c([C@H]3CCCN(C(=O)[C@H]4CCCN4Cc4ccccc4)C3)nc2c1 ZINC000508245658 917062566 /nfs/dbraw/zinc/06/25/66/917062566.db2.gz DNCSQWCTWBXCBX-NZQKXSOJSA-N 0 3 402.542 4.242 20 0 HIADHN Cc1ccc2nc([C@H]3CCCN(C(=O)[C@H]4CCCN4Cc4ccccc4)C3)[nH]c2c1 ZINC000508245658 917062577 /nfs/dbraw/zinc/06/25/77/917062577.db2.gz DNCSQWCTWBXCBX-NZQKXSOJSA-N 0 3 402.542 4.242 20 0 HIADHN CC(=O)Nc1cc(NC(=O)[C@@H]2CN(Cc3ccccc3)CCC2(F)F)ccc1Cl ZINC000508441195 917226793 /nfs/dbraw/zinc/22/67/93/917226793.db2.gz GCUIGFPUIJOHOL-KRWDZBQOSA-N 0 3 421.875 4.394 20 0 HIADHN CN(C(=O)c1ccc(NCc2cscc2Br)cc1)[C@H]1CCCN(C)C1 ZINC000508505734 917292073 /nfs/dbraw/zinc/29/20/73/917292073.db2.gz QIYMILFGMHRPIU-KRWDZBQOSA-N 0 3 422.392 4.289 20 0 HIADHN Cc1ccc(-c2nn(-c3ccc(F)cc3)cc2CN2CCC(CC(N)=O)CC2)cc1 ZINC000508593343 917364712 /nfs/dbraw/zinc/36/47/12/917364712.db2.gz FKBCAKZEJYISQK-UHFFFAOYSA-N 0 3 406.505 4.074 20 0 HIADHN CCOc1cc(CN2CCCSCC2)ccc1OCC(=O)Nc1ccccc1 ZINC000508627815 917393602 /nfs/dbraw/zinc/39/36/02/917393602.db2.gz CPSNHMYSNBKHFV-UHFFFAOYSA-N 0 3 400.544 4.042 20 0 HIADHN Fc1cc(Br)cc2c1CC[C@@H]2NCc1ccccc1Cn1cncn1 ZINC000508723523 917486646 /nfs/dbraw/zinc/48/66/46/917486646.db2.gz JPLVCAYQZQXTQX-IBGZPJMESA-N 0 3 401.283 4.005 20 0 HIADHN Cc1c([C@@H](C)NCc2ccccc2Cn2cncn2)cnn1-c1cc(C)ccc1C ZINC000508748562 917507441 /nfs/dbraw/zinc/50/74/41/917507441.db2.gz RECCBTDMIFWYFN-LJQANCHMSA-N 0 3 400.530 4.288 20 0 HIADHN O=C(N1CCC[C@H](C(F)(F)F)C1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000508777268 917531357 /nfs/dbraw/zinc/53/13/57/917531357.db2.gz HQACEJYKVJWIFB-DOTOQJQBSA-N 0 3 408.386 4.242 20 0 HIADHN C[C@@H](NC(=O)N(C)Cc1ccc(Br)s1)[C@H](c1ccccc1)N(C)C ZINC000508851433 917603972 /nfs/dbraw/zinc/60/39/72/917603972.db2.gz HGJDIRRWJZRDSE-CXAGYDPISA-N 0 3 410.381 4.343 20 0 HIADHN CCO[C@H](C)c1nc(CN(C)C(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)cs1 ZINC000508871856 917624866 /nfs/dbraw/zinc/62/48/66/917624866.db2.gz QPJMAHBMSXVRJS-FRQCXROJSA-N 0 3 404.580 4.073 20 0 HIADHN C[C@@H](NC(=O)Nc1ccccc1CN1C[C@@H](C)O[C@@H](C)C1)[C@@H](c1ccccc1)N(C)C ZINC000508877255 917630032 /nfs/dbraw/zinc/63/00/32/917630032.db2.gz XUFQSMGTNYVYBD-ZSTWQFLISA-N 0 3 424.589 4.109 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)c(C(F)(F)F)c1 ZINC000508876588 917630091 /nfs/dbraw/zinc/63/00/91/917630091.db2.gz DGKIUDKVSIMZOM-YJYMSZOUSA-N 0 3 422.451 4.477 20 0 HIADHN Cc1nc2ccccc2n1C1CCN(C(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)CC1 ZINC000508891795 917647853 /nfs/dbraw/zinc/64/78/53/917647853.db2.gz CDPIYCHXRVBDHU-UUOWRZLLSA-N 0 3 419.573 4.383 20 0 HIADHN Cc1ccc(NC(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)c(OC[C@H]2CCCO2)c1 ZINC000508905446 917662192 /nfs/dbraw/zinc/66/21/92/917662192.db2.gz KWBCKWDQLUHALY-XQFWAAQXSA-N 0 3 411.546 4.366 20 0 HIADHN COc1ccc(NC(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)cc1N1CCCCC1=O ZINC000508925661 917684825 /nfs/dbraw/zinc/68/48/25/917684825.db2.gz SWBCOUVRDUOBEO-UZUQRXQVSA-N 0 3 424.545 4.025 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)N1CCCC[C@@H]1c1ccnn1C)c1ccc(Cl)cc1 ZINC000509025005 917778113 /nfs/dbraw/zinc/77/81/13/917778113.db2.gz SOOUAPNCMOKCDJ-RTWAWAEBSA-N 0 3 417.985 4.393 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)NCc1noc2c1CCCC2)c1ccc(Cl)cc1 ZINC000509040440 917794230 /nfs/dbraw/zinc/79/42/30/917794230.db2.gz RYRJNTVKWIWORO-IBGZPJMESA-N 0 3 404.942 4.089 20 0 HIADHN CC(C)Oc1cc(Br)ccc1C(=O)N(CCN(C)C)c1ccccc1 ZINC000509115357 917851635 /nfs/dbraw/zinc/85/16/35/917851635.db2.gz QJSFUJYMMBUZOZ-UHFFFAOYSA-N 0 3 405.336 4.445 20 0 HIADHN Cc1nc2sccn2c(=O)c1CCN1CCC[C@H]1c1ccc(Br)cc1 ZINC000509261443 917949891 /nfs/dbraw/zinc/94/98/91/917949891.db2.gz BXRYQPAUZNBYNB-KRWDZBQOSA-N 0 3 418.360 4.207 20 0 HIADHN CCCN(CCc1c(C)nc2sccn2c1=O)Cc1ccccc1Br ZINC000509328836 917998986 /nfs/dbraw/zinc/99/89/86/917998986.db2.gz VAGCVTZBPCVLIN-UHFFFAOYSA-N 0 3 420.376 4.282 20 0 HIADHN Cc1noc([C@H]2CCCN(Cc3cn(-c4ccccc4)nc3-c3cccnc3)C2)n1 ZINC000509346561 918011344 /nfs/dbraw/zinc/01/13/44/918011344.db2.gz WZFXXJVMGGGDLZ-IBGZPJMESA-N 0 3 400.486 4.005 20 0 HIADHN Cn1cnnc1C1CCN(Cc2cn(Cc3ccccc3)nc2-c2ccccc2)CC1 ZINC000509358482 918022500 /nfs/dbraw/zinc/02/25/00/918022500.db2.gz OVXKGMDJWDFGIM-UHFFFAOYSA-N 0 3 412.541 4.107 20 0 HIADHN CCOCc1cc(CN2CCC[C@@H](C(=O)Nc3ccc(Cl)cn3)C2)ccc1OC ZINC000509358669 918024600 /nfs/dbraw/zinc/02/46/00/918024600.db2.gz PCDICCQDIKIVRQ-QGZVFWFLSA-N 0 3 417.937 4.131 20 0 HIADHN CC(=O)N(c1nc(CN2CCN(CC3CC3)CC2)cs1)c1ccc(Cl)cc1 ZINC000509378143 918044841 /nfs/dbraw/zinc/04/48/41/918044841.db2.gz HVDQMZARLVVWFK-UHFFFAOYSA-N 0 3 404.967 4.009 20 0 HIADHN CCC(C)(C)c1ccc(CN2CCCN(Cc3nc([C@@H](C)OC)no3)CC2)cc1 ZINC000509391200 918058373 /nfs/dbraw/zinc/05/83/73/918058373.db2.gz XTTLGMNMTATNMQ-GOSISDBHSA-N 0 3 400.567 4.173 20 0 HIADHN Cc1ccc(-c2n[nH]cc2CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)cc1 ZINC000509408620 918072706 /nfs/dbraw/zinc/07/27/06/918072706.db2.gz SICPNEHWPJPLCF-UHFFFAOYSA-N 0 3 409.921 4.284 20 0 HIADHN O=C(N1CCO[C@H](c2ccccc2)C1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000509421801 918083092 /nfs/dbraw/zinc/08/30/92/918083092.db2.gz IMLKHCKWEULBIR-UNMCSNQZSA-N 0 3 418.459 4.041 20 0 HIADHN CCOc1ccc(CN2CCC(C(=O)Nc3ccccc3OC)CC2)cc1OCC ZINC000509550606 918200730 /nfs/dbraw/zinc/20/07/30/918200730.db2.gz WVYSKYVFRXBPJA-UHFFFAOYSA-N 0 3 412.530 4.343 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N1CCO[C@@H](c2ccc(F)c(Cl)c2)C1)c1ccco1 ZINC000509566727 918215564 /nfs/dbraw/zinc/21/55/64/918215564.db2.gz GSXOXFLOTDWUHR-ADLFWFRXSA-N 0 3 423.916 4.284 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)N1CCC(n2c(C)nc3ccccc32)CC1)c1ccco1 ZINC000509565934 918215974 /nfs/dbraw/zinc/21/59/74/918215974.db2.gz BZAKKNBSFUEJBJ-DYESRHJHSA-N 0 3 423.561 4.414 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N1CCC(F)(c2cccc(OC)c2)CC1)c1ccco1 ZINC000509568129 918217736 /nfs/dbraw/zinc/21/77/36/918217736.db2.gz LGKUUECTZJDYJY-FXAWDEMLSA-N 0 3 417.525 4.388 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N[C@@H](C)c1ccc(OC)c(OC)c1C)c1ccco1 ZINC000509572283 918221324 /nfs/dbraw/zinc/22/13/24/918221324.db2.gz VBXUMOOBRJLHDY-QILLFSRXSA-N 0 3 403.523 4.095 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)N1CCC(Nc2ccc(F)cc2)CC1)c1ccco1 ZINC000509570206 918221427 /nfs/dbraw/zinc/22/14/27/918221427.db2.gz OSWOVWRDXAZEMD-OXQOHEQNSA-N 0 3 402.514 4.134 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N1CCCCC[C@@H]1c1c(C)n[nH]c1C)c1ccco1 ZINC000509575329 918225055 /nfs/dbraw/zinc/22/50/55/918225055.db2.gz VPJQGERYRHSEMS-ZYSHUDEJSA-N 0 3 401.555 4.376 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)N1CCC(Oc2ccc(F)cc2F)CC1)c1ccco1 ZINC000509580687 918229328 /nfs/dbraw/zinc/22/93/28/918229328.db2.gz ZJDSAFOILCXRQP-BEFAXECRSA-N 0 3 421.488 4.240 20 0 HIADHN CCN1CCC[C@@H](CN(C)c2nc(C(F)F)nc3ccccc32)[C@@H]1c1cnn(C)c1 ZINC000509593273 918242027 /nfs/dbraw/zinc/24/20/27/918242027.db2.gz PELSSNIIKXFOEK-HNAYVOBHSA-N 0 3 414.504 4.210 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)N(C)Cc1cc(Br)cs1)c1ccco1 ZINC000509593418 918242448 /nfs/dbraw/zinc/24/24/48/918242448.db2.gz CUBNZXBGZMHXII-IUODEOHRSA-N 0 3 414.369 4.374 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N(C)Cc1cc(Br)cs1)c1ccco1 ZINC000509593420 918242520 /nfs/dbraw/zinc/24/25/20/918242520.db2.gz CUBNZXBGZMHXII-SWLSCSKDSA-N 0 3 414.369 4.374 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)N1CCC(OCCc2ccccc2)CC1)c1ccco1 ZINC000509595671 918246362 /nfs/dbraw/zinc/24/63/62/918246362.db2.gz ISIBRLWACDEUOO-DENIHFKCSA-N 0 3 413.562 4.142 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N1CCC(c2ncccc2Cl)CC1)c1ccco1 ZINC000509599063 918250533 /nfs/dbraw/zinc/25/05/33/918250533.db2.gz FEKHKYXJYUYFRN-MAUKXSAKSA-N 0 3 404.942 4.346 20 0 HIADHN Cc1cc(-c2noc([C@H](C)NCCCN3CCN(c4ccccc4)CC3)n2)ccc1F ZINC000509605174 918253286 /nfs/dbraw/zinc/25/32/86/918253286.db2.gz OWHKIYVIZKGVCT-IBGZPJMESA-N 0 3 423.536 4.047 20 0 HIADHN COc1cc(CN[C@H](C)c2ccc3c(c2)CCC(=O)N3)ccc1OCC(F)(F)F ZINC000509610673 918256644 /nfs/dbraw/zinc/25/66/44/918256644.db2.gz WYSVLNONIRECJG-CYBMUJFWSA-N 0 3 408.420 4.372 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N1CC[C@H](Oc2ccccc2Cl)C1)c1ccco1 ZINC000509611982 918258718 /nfs/dbraw/zinc/25/87/18/918258718.db2.gz VZWPDGBIPAQVGH-XYJFISCASA-N 0 3 405.926 4.225 20 0 HIADHN O=C(N[C@H](C[C@H]1CCOC1)c1ccccc1)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000509782695 918392218 /nfs/dbraw/zinc/39/22/18/918392218.db2.gz UTHFOPIAZVXGMC-GMKZXUHWSA-N 0 3 407.558 4.118 20 0 HIADHN O=C(N[C@@H](C[C@@H]1CCOC1)c1ccccc1)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000509782698 918392531 /nfs/dbraw/zinc/39/25/31/918392531.db2.gz UTHFOPIAZVXGMC-QTJGBDASSA-N 0 3 407.558 4.118 20 0 HIADHN Cc1cccn2cc(COc3ccc(CN[C@@H]4CCCc5nn(C)cc54)cc3)nc12 ZINC000509958177 918551013 /nfs/dbraw/zinc/55/10/13/918551013.db2.gz MMNWQQRNQTYRDQ-JOCHJYFZSA-N 0 3 401.514 4.122 20 0 HIADHN C[C@@H](NS(=O)(=O)c1csc2ccccc21)[C@H]1CCN(Cc2ccccc2)C1 ZINC000509973467 918562948 /nfs/dbraw/zinc/56/29/48/918562948.db2.gz DYJSFPKUYQYVOJ-AEFFLSMTSA-N 0 3 400.569 4.090 20 0 HIADHN O=C(Nc1ccccc1)N1CC[C@H](NCc2ccc(OCC(F)(F)F)c(F)c2)C1 ZINC000510005757 918589367 /nfs/dbraw/zinc/58/93/67/918589367.db2.gz PELABNRCUDPWDR-INIZCTEOSA-N 0 3 411.399 4.163 20 0 HIADHN CC[C@@H](NCc1cc2c(c(Br)c1)OCO2)c1ccc(OC)c(OC)c1 ZINC000510205919 918755291 /nfs/dbraw/zinc/75/52/91/918755291.db2.gz ALMSKLVXTJABFK-OAHLLOKOSA-N 0 3 408.292 4.436 20 0 HIADHN CCCN(CC(=O)Nc1cc(C)cc(C)c1)C1CCN(c2cc(C)nc(C)n2)CC1 ZINC000510238252 918777187 /nfs/dbraw/zinc/77/71/87/918777187.db2.gz BVURACWQQCPMFP-UHFFFAOYSA-N 0 3 409.578 4.030 20 0 HIADHN CCCN(CC(=O)Nc1cccc(Cl)c1)C1CCN(c2cc(C)nc(C)n2)CC1 ZINC000510242074 918780128 /nfs/dbraw/zinc/78/01/28/918780128.db2.gz XLANDSMQJUWDFJ-UHFFFAOYSA-N 0 3 415.969 4.066 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)NCC1(C(F)(F)F)CC1 ZINC000510311984 918823616 /nfs/dbraw/zinc/82/36/16/918823616.db2.gz GAJBRJRJPYEFFI-UHFFFAOYSA-N 0 3 411.390 4.121 20 0 HIADHN CCOc1ccc(NC(=O)N(CCN(C)C)Cc2ccc(Br)cc2)cc1 ZINC000510391929 918869945 /nfs/dbraw/zinc/86/99/45/918869945.db2.gz CHILFNZURMPIAD-UHFFFAOYSA-N 0 3 420.351 4.444 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)Nc1ccc(C(=O)NC2CCCC2)cc1 ZINC000510425495 918890964 /nfs/dbraw/zinc/89/09/64/918890964.db2.gz OFDJEPOLKKDHBV-UHFFFAOYSA-N 0 3 405.498 4.419 20 0 HIADHN CCCN(C(=O)c1ccc(N2CCN(CC)CC2)cc1)[C@@H]1CCc2ccccc2C1 ZINC000510452395 918909124 /nfs/dbraw/zinc/90/91/24/918909124.db2.gz PNLKAZQCDXOBKS-RUZDIDTESA-N 0 3 405.586 4.238 20 0 HIADHN CCOCCOCc1cccc(NC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000510460923 918916572 /nfs/dbraw/zinc/91/65/72/918916572.db2.gz LTEHDUVOUCQTGX-QHCPKHFHSA-N 0 3 411.546 4.026 20 0 HIADHN Cc1ccccc1C1(CNC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)CCOCC1 ZINC000510531480 918977150 /nfs/dbraw/zinc/97/71/50/918977150.db2.gz CNJJSNFUPCGNDS-HSZRJFAPSA-N 0 3 421.585 4.007 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)NCc2ccc(OCC(F)(F)F)cc2)C1 ZINC000510532654 918978505 /nfs/dbraw/zinc/97/85/05/918978505.db2.gz WBVTYMSKFCSWAK-APWZRJJASA-N 0 3 421.463 4.262 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)N[C@H](c1nccs1)c1ccccc1 ZINC000510595099 919038108 /nfs/dbraw/zinc/03/81/08/919038108.db2.gz FIORACXRFWYYMC-FQEVSTJZSA-N 0 3 412.534 4.145 20 0 HIADHN CN(C)Cc1cccc(NC(=O)[C@@H](c2cc(Cl)cc(Cl)c2)N2CCOCC2)c1 ZINC000510604986 919046641 /nfs/dbraw/zinc/04/66/41/919046641.db2.gz HBQUUESMAJKLEB-HXUWFJFHSA-N 0 3 422.356 4.067 20 0 HIADHN CCCN(C(=O)Nc1ccc2c(c1)OCCO2)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000510635630 919077336 /nfs/dbraw/zinc/07/73/36/919077336.db2.gz UFTYDXLDHXKIFL-NRFANRHFSA-N 0 3 409.530 4.366 20 0 HIADHN CC[C@H](C)n1ncc2c1nc(C)cc2C(=O)NCC(C)(C)N1CCc2ccccc2C1 ZINC000510785556 919249510 /nfs/dbraw/zinc/24/95/10/919249510.db2.gz VDGNRUYKVHYFGJ-SFHVURJKSA-N 0 3 419.573 4.277 20 0 HIADHN C[C@@H](NC(=O)[C@H](Oc1ccc(F)cc1Cl)c1ccccc1)C1=CCN(C)CC1 ZINC000510787335 919252858 /nfs/dbraw/zinc/25/28/58/919252858.db2.gz KLLCTZBEZDCKDR-QVKFZJNVSA-N 0 3 402.897 4.366 20 0 HIADHN CC1CCN(CCNC(=O)Cc2csc(-c3cccc(C(F)(F)F)c3)n2)CC1 ZINC000510803793 919276724 /nfs/dbraw/zinc/27/67/24/919276724.db2.gz QCOSGHQFTBGMSY-UHFFFAOYSA-N 0 3 411.493 4.220 20 0 HIADHN Cc1c(C(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)cnn1C1CCCCC1 ZINC000510854481 919343320 /nfs/dbraw/zinc/34/33/20/919343320.db2.gz YUQHXMRRQDVMQI-KDURUIRLSA-N 0 3 416.610 4.048 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)NCC(=O)Nc1cccc2ccccc21 ZINC000510881866 919377787 /nfs/dbraw/zinc/37/77/87/919377787.db2.gz QSTWDBQQRZDFIR-UHFFFAOYSA-N 0 3 401.466 4.016 20 0 HIADHN COc1ccc(C[C@@H](C)C(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)cc1OC ZINC000510883602 919380172 /nfs/dbraw/zinc/38/01/72/919380172.db2.gz YQMNBAZERWBVDW-UXHICEINSA-N 0 3 410.558 4.005 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N2CC=C(c3ccccc3Cl)CC2)CC1 ZINC000510946188 919475085 /nfs/dbraw/zinc/47/50/85/919475085.db2.gz BYYZVYOUZHQEAK-UHFFFAOYSA-N 0 3 405.970 4.028 20 0 HIADHN C[C@@H]1CN(Cc2ccccn2)CC[C@H]1Nc1ccc(NC(=O)CC(F)(F)F)cc1 ZINC000510974525 919522382 /nfs/dbraw/zinc/52/23/82/919522382.db2.gz GMSDNROYZSNHPG-DNVCBOLYSA-N 0 3 406.452 4.295 20 0 HIADHN O=C(COc1ccccc1)N1CC[C@@H](N[C@@H]2CCSc3c(Cl)cccc32)C1 ZINC000510979661 919532285 /nfs/dbraw/zinc/53/22/85/919532285.db2.gz PFRKSWJBJITYJH-DNVCBOLYSA-N 0 3 402.947 4.146 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](NCCCOC(F)F)c2ccc(Cl)cc2)c1 ZINC000510981354 919533367 /nfs/dbraw/zinc/53/33/67/919533367.db2.gz CRVXZQHKPIKSPT-QGZVFWFLSA-N 0 3 403.878 4.052 20 0 HIADHN CC[C@H](N[C@H]1CCN(C(=O)COc2ccccc2)C1)c1ccccc1OC(F)F ZINC000511016409 919584480 /nfs/dbraw/zinc/58/44/80/919584480.db2.gz PCWDIGFCUTWQAM-LPHOPBHVSA-N 0 3 404.457 4.009 20 0 HIADHN O=C(COc1ccccc1)N1CC[C@@H](N[C@H]2CCSc3ccc(Cl)cc32)C1 ZINC000511045961 919636442 /nfs/dbraw/zinc/63/64/42/919636442.db2.gz JOODZRCPUMRFEF-APWZRJJASA-N 0 3 402.947 4.146 20 0 HIADHN CC(C)[C@H](NCC(=O)N1CCC[C@@H]1c1ccc2c(c1)OCCCO2)c1ccccc1 ZINC000511047084 919639585 /nfs/dbraw/zinc/63/95/85/919639585.db2.gz TXDJFCJPXSNJHV-BWKNWUBXSA-N 0 3 408.542 4.498 20 0 HIADHN C[C@@H]1CN(c2ccccc2NC(=O)NC[C@H](c2ccccc2)N2CCCC2)C[C@@H](C)O1 ZINC000511086943 919687896 /nfs/dbraw/zinc/68/78/96/919687896.db2.gz VULLMWKKUSDHML-YOSAUDMPSA-N 0 3 422.573 4.259 20 0 HIADHN C[C@@H]1CN(c2ccccc2NC(=O)NC[C@@H](c2ccccc2)N2CCCC2)C[C@H](C)O1 ZINC000511086942 919688808 /nfs/dbraw/zinc/68/88/08/919688808.db2.gz VULLMWKKUSDHML-ROKPMTFOSA-N 0 3 422.573 4.259 20 0 HIADHN CC(=O)c1ccc(NC(=O)CCN(C)Cc2ccc(OCC(F)(F)F)cc2)cc1 ZINC000511090874 919694758 /nfs/dbraw/zinc/69/47/58/919694758.db2.gz NYPVICODMIEKDM-UHFFFAOYSA-N 0 3 408.420 4.291 20 0 HIADHN CC[C@@H](C)c1ccc([C@@H](NC(=O)CCN2CCN(CC)CC2)c2cccs2)cc1 ZINC000511107859 919714496 /nfs/dbraw/zinc/71/44/96/919714496.db2.gz SROHKPWMRBKBNA-NTKDMRAZSA-N 0 3 413.631 4.495 20 0 HIADHN CSCc1ccc(CNC(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)cc1 ZINC000511157285 919775625 /nfs/dbraw/zinc/77/56/25/919775625.db2.gz RPOINNHVEWEDEW-UHFFFAOYSA-N 0 3 407.530 4.101 20 0 HIADHN CCOc1cc2c(cc1NC(=O)N(CCN(C)C)Cc1ccc(F)cc1)O[C@H](C)C2 ZINC000511179205 919802107 /nfs/dbraw/zinc/80/21/07/919802107.db2.gz ZHTKEIVGPRWYQO-MRXNPFEDSA-N 0 3 415.509 4.144 20 0 HIADHN CCCOc1ccc(CN(CCC)C(=O)N[C@H](C)C2=CCN(C)CC2)cc1OC ZINC000511217072 919826915 /nfs/dbraw/zinc/82/69/15/919826915.db2.gz NWGNHMVUTFFGFT-GOSISDBHSA-N 0 3 403.567 4.056 20 0 HIADHN C[C@@H](NC(=O)N1CCCC[C@@H]1c1nc(-c2cccc(F)c2)c[nH]1)C1=CCN(C)CC1 ZINC000511249867 919851783 /nfs/dbraw/zinc/85/17/83/919851783.db2.gz PYTCAOJGLKSKCY-IIBYNOLFSA-N 0 3 411.525 4.103 20 0 HIADHN Cc1cc(C)n(-c2ccc(C(F)(F)F)cc2NC(=O)N[C@H](C)C2=CCN(C)CC2)n1 ZINC000511265201 919862633 /nfs/dbraw/zinc/86/26/33/919862633.db2.gz KNLFLXQOWZXBNQ-OAHLLOKOSA-N 0 3 421.467 4.280 20 0 HIADHN COc1ccccc1C[C@@H](C)N(Cc1ccccc1)C(=O)N[C@@H](C)C1=CCN(C)CC1 ZINC000511287681 919884445 /nfs/dbraw/zinc/88/44/45/919884445.db2.gz OINQXXVPTWIVDC-RTWAWAEBSA-N 0 3 421.585 4.488 20 0 HIADHN COc1cc(C(=O)N[C@H](C)C2=CCN(C)CC2)ccc1OCc1ccc(Cl)cc1 ZINC000511332338 919922955 /nfs/dbraw/zinc/92/29/55/919922955.db2.gz IHAOXFRSNRJMBM-MRXNPFEDSA-N 0 3 414.933 4.308 20 0 HIADHN C[C@@H](NC(=O)c1cc(-c2ccc(F)cc2)nc2onc(C3CC3)c21)C1=CCN(C)CC1 ZINC000511344735 919938178 /nfs/dbraw/zinc/93/81/78/919938178.db2.gz OUATYCPDBKJQCZ-CQSZACIVSA-N 0 3 420.488 4.287 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)N[C@@H](C[C@@H]2CCOC2)c2ccccc2)c1 ZINC000511373080 919969878 /nfs/dbraw/zinc/96/98/78/919969878.db2.gz VOJAAKGHTKZEIB-UPVQGACJSA-N 0 3 409.574 4.236 20 0 HIADHN CN1CCO[C@@H]([C@H](NCCc2nc(C(F)(F)F)cs2)c2ccc(Cl)cc2)C1 ZINC000511383480 919986410 /nfs/dbraw/zinc/98/64/10/919986410.db2.gz YCDYIQBRIMNFQI-RHSMWYFYSA-N 0 3 419.900 4.019 20 0 HIADHN CN(C)CCN(CC1CCCCC1)C(=O)N[C@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000511390459 919996774 /nfs/dbraw/zinc/99/67/74/919996774.db2.gz IQGBWCHEUPOTMR-JTHBVZDNSA-N 0 3 401.595 4.308 20 0 HIADHN COc1ccc(CN(C)C(=O)CN[C@H](c2cccc(OC(F)(F)F)c2)C2CC2)cc1 ZINC000511545127 920172879 /nfs/dbraw/zinc/17/28/79/920172879.db2.gz IYWAVSZZJGWHJT-NRFANRHFSA-N 0 3 422.447 4.293 20 0 HIADHN Cc1c(C(=O)N2CCCN(CCCc3ccccc3)CC2)cnn1C1CCCCC1 ZINC000511570950 920213889 /nfs/dbraw/zinc/21/38/89/920213889.db2.gz JXRPYWSWUZKJIZ-UHFFFAOYSA-N 0 3 408.590 4.477 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)CN[C@@H](c2cccc(OC(F)(F)F)c2)C2CC2)cc1 ZINC000511589061 920234674 /nfs/dbraw/zinc/23/46/74/920234674.db2.gz UZYAVHABDNILBB-HXUWFJFHSA-N 0 3 421.419 4.223 20 0 HIADHN Cc1ccc(Br)cc1NC(=O)N(CCN(C)C)Cc1ccc(F)cc1 ZINC000511589948 920236752 /nfs/dbraw/zinc/23/67/52/920236752.db2.gz CBTVQQWTNYVFMN-UHFFFAOYSA-N 0 3 408.315 4.492 20 0 HIADHN CN(Cc1cccc(OC(F)F)c1)C[C@H](O)COc1ccc(C(F)(F)F)cc1 ZINC000511590047 920237041 /nfs/dbraw/zinc/23/70/41/920237041.db2.gz DRVABYKGOPCEQG-HNNXBMFYSA-N 0 3 405.363 4.179 20 0 HIADHN C[C@H](N[C@@H](c1cccc(OC(F)(F)F)c1)C1CC1)C(=O)NCCc1cccs1 ZINC000511623847 920280983 /nfs/dbraw/zinc/28/09/83/920280983.db2.gz OJDRGGZDRBUBAB-SCLBCKFNSA-N 0 3 412.477 4.435 20 0 HIADHN CCc1ccc([C@H](CNC(=O)Nc2cccc(C(=O)N3CCCCC3)c2)N(C)C)cc1 ZINC000511624103 920281987 /nfs/dbraw/zinc/28/19/87/920281987.db2.gz BWEBZDWESJSVOX-QHCPKHFHSA-N 0 3 422.573 4.300 20 0 HIADHN COc1ccc(C(=O)C2CCN(C(=O)C3CCN(Cc4ccccc4)CC3)CC2)cc1 ZINC000511632664 920295832 /nfs/dbraw/zinc/29/58/32/920295832.db2.gz YELKDQIZPDUPLS-UHFFFAOYSA-N 0 3 420.553 4.029 20 0 HIADHN CC(C)(C)CCN1CCN(C(=O)C2CCC(NC(=O)CC3CCCCC3)CC2)CC1 ZINC000511677697 920341700 /nfs/dbraw/zinc/34/17/00/920341700.db2.gz OYWIMVAHXNXFIR-UHFFFAOYSA-N 0 3 419.654 4.212 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)c2cc3c(cccc3Br)[nH]2)C1 ZINC000511677284 920342079 /nfs/dbraw/zinc/34/20/79/920342079.db2.gz JEMAVJKLPQTEID-ZBFHGGJFSA-N 0 3 412.331 4.496 20 0 HIADHN Cc1cc(C(=O)CN2C[C@H](c3ccccc3)[C@H]3COCC[C@@H]32)c(C)n1CC(F)(F)F ZINC000511754332 920432803 /nfs/dbraw/zinc/43/28/03/920432803.db2.gz JBTLWIQMKVIRCD-NJYVYQBISA-N 0 3 420.475 4.354 20 0 HIADHN CC(C)[C@H](NC(=O)CN1C[C@H](c2ccccc2)[C@H]2COCC[C@@H]21)c1ccc(F)cc1 ZINC000511758091 920439520 /nfs/dbraw/zinc/43/95/20/920439520.db2.gz QOMDLXAFROCTRQ-AHCIIZGASA-N 0 3 410.533 4.144 20 0 HIADHN O=C(CN1C[C@H](c2ccccc2)[C@@H]2COCC[C@@H]21)Nc1ccccc1C(F)(F)F ZINC000511757481 920439656 /nfs/dbraw/zinc/43/96/56/920439656.db2.gz PBKHXXDQPQKIJB-UWVAXJGDSA-N 0 3 404.432 4.148 20 0 HIADHN Fc1cccc([C@@H]2CC[C@@H](NCc3ncc(I)s3)C2)c1 ZINC000511763795 920446800 /nfs/dbraw/zinc/44/68/00/920446800.db2.gz VDWVTIZWPJWXFE-DGCLKSJQSA-N 0 3 402.276 4.313 20 0 HIADHN O=C(CN1C[C@H](c2ccccc2)[C@@H]2COCC[C@H]21)Nc1ccc(OC(F)(F)F)cc1 ZINC000511766917 920451230 /nfs/dbraw/zinc/45/12/30/920451230.db2.gz ASKVGEAOKSACNN-HSALFYBXSA-N 0 3 420.431 4.028 20 0 HIADHN O=C(NC1CCCCC1)NC1CCN(Cc2c[nH]nc2-c2cccc(Cl)c2)CC1 ZINC000511776446 920465164 /nfs/dbraw/zinc/46/51/64/920465164.db2.gz KJGNYOJGPACFDZ-UHFFFAOYSA-N 0 3 415.969 4.326 20 0 HIADHN CCOc1ccccc1[C@H](CC)NC(=O)CN1C[C@H](c2ccccc2)[C@H]2COCC[C@@H]21 ZINC000511779065 920468291 /nfs/dbraw/zinc/46/82/91/920468291.db2.gz DVLPMHFTMKKASZ-LWSSLDFYSA-N 0 3 422.569 4.157 20 0 HIADHN FC(F)(F)c1ccn(-c2ccc(CN3CCCN(c4nccs4)CC3)cc2)n1 ZINC000511778313 920469016 /nfs/dbraw/zinc/46/90/16/920469016.db2.gz ZGFPXJPJTUCHCL-UHFFFAOYSA-N 0 3 407.465 4.060 20 0 HIADHN OC[C@@H](CNCc1cscc1Br)Cc1ccc(Br)cc1 ZINC000511786909 920481548 /nfs/dbraw/zinc/48/15/48/920481548.db2.gz OJYZPMQIZQBLBV-GFCCVEGCSA-N 0 3 419.182 4.214 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)c(C)c1CC(=O)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000511810496 920506171 /nfs/dbraw/zinc/50/61/71/920506171.db2.gz XUVPWJNWPDPVHQ-OAQYLSRUSA-N 0 3 422.960 4.076 20 0 HIADHN CCN(CC)C(=O)c1cccc(NC(=O)CN2C[C@H](c3ccccc3)[C@H]3CCC[C@H]32)c1 ZINC000511897295 920634620 /nfs/dbraw/zinc/63/46/20/920634620.db2.gz RYOGNWMTBJQXIL-WXFUMESZSA-N 0 3 419.569 4.375 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3cn(-c4ccccc4)nc3C)c(C)c2)CC1 ZINC000511919908 920663852 /nfs/dbraw/zinc/66/38/52/920663852.db2.gz OXOIMYJXWRLBFT-UHFFFAOYSA-N 0 3 418.545 4.275 20 0 HIADHN Cc1cc([C@@H](C)N[C@H](C)Cn2ncc3ccccc3c2=O)sc1Br ZINC000511924524 920669953 /nfs/dbraw/zinc/66/99/53/920669953.db2.gz AALXEULQPQGGTH-CHWSQXEVSA-N 0 3 406.349 4.268 20 0 HIADHN CCC1(C(=O)Nc2cc(C)cc(CN(C)C)c2)CCN(C(=O)c2ccccc2)CC1 ZINC000511993629 920761663 /nfs/dbraw/zinc/76/16/63/920761663.db2.gz QXDHXECPBNFBDD-UHFFFAOYSA-N 0 3 407.558 4.328 20 0 HIADHN C[C@@H](CC(=O)Nc1cc(C(F)(F)F)ccc1Cl)N[C@@H]1CCCc2c[nH]nc21 ZINC000512005283 920776309 /nfs/dbraw/zinc/77/63/09/920776309.db2.gz GOCRYBHNLVDVOX-IINYFYTJSA-N 0 3 400.832 4.466 20 0 HIADHN C[C@@H]1CC[C@@H](C)N1CC(=O)N1CCC[C@@H](Cc2nc(C3CCCCCC3)no2)C1 ZINC000512022990 920798235 /nfs/dbraw/zinc/79/82/35/920798235.db2.gz DIUMJXHDLUXCOA-QRVBRYPASA-N 0 3 402.583 4.161 20 0 HIADHN CCNC(=O)COc1cccc(CN[C@@H](C)c2cc(C)c(Br)s2)c1 ZINC000512046335 920816694 /nfs/dbraw/zinc/81/66/94/920816694.db2.gz SREGIWIHWUEKMN-ZDUSSCGKSA-N 0 3 411.365 4.185 20 0 HIADHN CCc1nc([C@@H](C)N[C@H](C)CC(=O)Nc2cc(C(F)(F)F)ccc2Cl)n[nH]1 ZINC000512068343 920835005 /nfs/dbraw/zinc/83/50/05/920835005.db2.gz QZUCGWRWXNYJJD-NXEZZACHSA-N 0 3 403.836 4.107 20 0 HIADHN Cc1cc([C@@H](C)NCCCS(=O)(=O)Cc2ccccc2)sc1Br ZINC000512083619 920848066 /nfs/dbraw/zinc/84/80/66/920848066.db2.gz RLVFAHZGPXGZFF-CQSZACIVSA-N 0 3 416.406 4.475 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)Nc3nc4cc(F)c(F)cc4s3)cc2)CC1 ZINC000512089008 920852689 /nfs/dbraw/zinc/85/26/89/920852689.db2.gz LAIWSRWFUSZLCL-UHFFFAOYSA-N 0 3 416.497 4.357 20 0 HIADHN C[C@@H]1CN(Cc2ccc(CNCc3cscc3Br)cc2)C[C@H](C)O1 ZINC000512088940 920852758 /nfs/dbraw/zinc/85/27/58/920852758.db2.gz PXAKANIWIUSIJL-GASCZTMLSA-N 0 3 409.393 4.410 20 0 HIADHN COc1cccc(N2CC[C@H](NCc3cnn(-c4ccc(C(F)(F)F)cc4)c3)C2)c1 ZINC000512096735 920857697 /nfs/dbraw/zinc/85/76/97/920857697.db2.gz ADGFXUIWBCCNIM-SFHVURJKSA-N 0 3 416.447 4.268 20 0 HIADHN Cc1cc([C@@H](C)NCc2ccc(NS(C)(=O)=O)cc2)sc1Br ZINC000512101273 920861486 /nfs/dbraw/zinc/86/14/86/920861486.db2.gz SMXYGDWAEJZTJF-LLVKDONJSA-N 0 3 403.367 4.041 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)NCc2ccsc2Br)C1 ZINC000512112521 920866995 /nfs/dbraw/zinc/86/69/95/920866995.db2.gz OBPZMJROINVTKR-CJNGLKHVSA-N 0 3 408.365 4.145 20 0 HIADHN COCc1ccccc1/C=C(\C)CNc1ccc2nc(CCN3CCOCC3)[nH]c2c1 ZINC000512153279 920894710 /nfs/dbraw/zinc/89/47/10/920894710.db2.gz RYBUMDDVFANVGF-XDJHFCHBSA-N 0 3 420.557 4.099 20 0 HIADHN CN(C)Cc1cccc(NC(=O)N[C@@H]2CCN(c3cccc(OC(F)(F)F)c3)C2)c1 ZINC000512216089 920964024 /nfs/dbraw/zinc/96/40/24/920964024.db2.gz AJSZDYZCFSCXJZ-QGZVFWFLSA-N 0 3 422.451 4.047 20 0 HIADHN Cc1ccc(S(=O)(=O)CCCN[C@@H](CCO)c2ccc(Cl)c(Cl)c2)cc1 ZINC000512229191 920980891 /nfs/dbraw/zinc/98/08/91/920980891.db2.gz QNGOJHDITJYIEU-IBGZPJMESA-N 0 3 416.370 4.179 20 0 HIADHN CCN(CC)C(=O)C1CCN(Cc2cn(-c3ccccc3)nc2-c2ccncc2)CC1 ZINC000512236097 920989309 /nfs/dbraw/zinc/98/93/09/920989309.db2.gz FLBOUYCURQKJHY-UHFFFAOYSA-N 0 3 417.557 4.015 20 0 HIADHN CCC[C@@]1(NCC(=O)N2N=C(c3cccs3)C[C@H]2c2cccs2)CCOC1 ZINC000512237670 920991865 /nfs/dbraw/zinc/99/18/65/920991865.db2.gz UWMBQRDDHIEXPQ-OXJNMPFZSA-N 0 3 403.573 4.036 20 0 HIADHN CCC[C@]1(NCC(=O)N2N=C(c3cccs3)C[C@@H]2c2cccs2)CCOC1 ZINC000512237672 920993357 /nfs/dbraw/zinc/99/33/57/920993357.db2.gz UWMBQRDDHIEXPQ-UZLBHIALSA-N 0 3 403.573 4.036 20 0 HIADHN FC(F)(F)c1ccc(CN2CC[C@H](NCc3cn4cc(Cl)ccc4n3)C2)cc1 ZINC000512242944 920998448 /nfs/dbraw/zinc/99/84/48/920998448.db2.gz NQGCANXDSKKFAN-KRWDZBQOSA-N 0 3 408.855 4.371 20 0 HIADHN O=C(N[C@H](C[C@H]1CCOC1)c1ccccc1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000512250149 921008733 /nfs/dbraw/zinc/00/87/33/921008733.db2.gz OOXJOBMFCPOLFU-KIFXHHALSA-N 0 3 410.533 4.322 20 0 HIADHN CCC[C@@]1(NCC(=O)N2N=C(c3cc4ccccc4o3)C[C@H]2c2ccco2)CCOC1 ZINC000512292969 921048143 /nfs/dbraw/zinc/04/81/43/921048143.db2.gz RGWXXCDLPGUOLY-YADARESESA-N 0 3 421.497 4.252 20 0 HIADHN CCOc1ccc(CN2CCC(C(=O)N3CCc4ccccc43)CC2)cc1OCC ZINC000512293783 921048984 /nfs/dbraw/zinc/04/89/84/921048984.db2.gz UTZZTHZXBQYSBF-UHFFFAOYSA-N 0 3 408.542 4.285 20 0 HIADHN CN(C)C(=O)c1cccc(CN(C)CCOc2ccc(OCc3ccccc3)cc2)c1 ZINC000512325112 921075781 /nfs/dbraw/zinc/07/57/81/921075781.db2.gz TVKXFBFPYUIIIV-UHFFFAOYSA-N 0 3 418.537 4.478 20 0 HIADHN Fc1ccc(-c2nnc3n2C[C@@H](NCc2ccc(Sc4ccccn4)o2)CC3)cc1 ZINC000512343783 921089149 /nfs/dbraw/zinc/08/91/49/921089149.db2.gz RVBHBKXBVGXJEC-KRWDZBQOSA-N 0 3 421.501 4.328 20 0 HIADHN CCOC(=O)c1c2c(sc1NC(=O)CCc1nccs1)C(C)(C)NC(C)(C)C2 ZINC000512354589 921099965 /nfs/dbraw/zinc/09/99/65/921099965.db2.gz GQHOCPLUHUJJON-UHFFFAOYSA-N 0 3 421.588 4.112 20 0 HIADHN O=C(NC[C@@H]1CCO[C@@H]1c1ccccc1)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000513449114 921815719 /nfs/dbraw/zinc/81/57/19/921815719.db2.gz XQMOBTSZZZUIQD-FDFHNCONSA-N 0 3 414.496 4.038 20 0 HIADHN CC(=O)c1cccc(OC[C@@H](O)CN(Cc2cccc(Br)c2)C(C)C)c1 ZINC000513491472 921843836 /nfs/dbraw/zinc/84/38/36/921843836.db2.gz UDYIJBASKWGCJM-FQEVSTJZSA-N 0 3 420.347 4.302 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)c1cnc(-c2ccccc2)s1 ZINC000513495757 921845795 /nfs/dbraw/zinc/84/57/95/921845795.db2.gz USCNNPFSLUDUAH-UHFFFAOYSA-N 0 3 401.482 4.292 20 0 HIADHN C[C@H](c1ccc(F)c(F)c1)N(C)C[C@H](O)COc1ccc(Br)cc1 ZINC000513496857 921847219 /nfs/dbraw/zinc/84/72/19/921847219.db2.gz MHNYDMPBMUTNJG-DOMZBBRYSA-N 0 3 400.263 4.160 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2CN[C@@H](Cc2ccccn2)c2cccnc2)C[C@@H](C)O1 ZINC000513498531 921848640 /nfs/dbraw/zinc/84/86/40/921848640.db2.gz AMTIQPGAEIPMCR-YPCDYVTLSA-N 0 3 416.569 4.159 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)c1[nH]c2ccccc2c1Br ZINC000513555794 921891537 /nfs/dbraw/zinc/89/15/37/921891537.db2.gz YRQHAQCZPSDTAV-INIZCTEOSA-N 0 3 412.331 4.325 20 0 HIADHN C[C@H]1CN(Cc2ccccc2CNCc2csc(Br)c2)C[C@H](C)O1 ZINC000513587811 921919972 /nfs/dbraw/zinc/91/99/72/921919972.db2.gz BDXBUJRLPSNQIZ-GJZGRUSLSA-N 0 3 409.393 4.410 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)c1ccc(OCc2ccncc2)cc1 ZINC000513591549 921921536 /nfs/dbraw/zinc/92/15/36/921921536.db2.gz HEHIXULOGYKQNC-QHCPKHFHSA-N 0 3 401.510 4.055 20 0 HIADHN Cc1ccc([C@H](CNCc2ccc(Br)cc2F)N2CCOCC2)cc1 ZINC000513631818 921958145 /nfs/dbraw/zinc/95/81/45/921958145.db2.gz IADFWGCCXKOYAT-FQEVSTJZSA-N 0 3 407.327 4.060 20 0 HIADHN Clc1cccc([C@@H](CN[C@H](c2ncc[nH]2)C2CCCCC2)N2CCOCC2)c1 ZINC000513656031 921977611 /nfs/dbraw/zinc/97/76/11/921977611.db2.gz PUWZLPJGJXKQDM-RTWAWAEBSA-N 0 3 402.970 4.348 20 0 HIADHN Clc1cccc([C@@H](CN[C@@H](c2ncc[nH]2)C2CCCCC2)N2CCOCC2)c1 ZINC000513656029 921978469 /nfs/dbraw/zinc/97/84/69/921978469.db2.gz PUWZLPJGJXKQDM-NHCUHLMSSA-N 0 3 402.970 4.348 20 0 HIADHN CC(=O)Nc1ccc(OC[C@H](O)CN(Cc2ccc([C@@H]3C[C@H]3C)o2)C(C)C)cc1 ZINC000513703514 922024462 /nfs/dbraw/zinc/02/44/62/922024462.db2.gz WQZGRKYSFXCQPA-ZWDAVXSWSA-N 0 3 400.519 4.012 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N(CCc3nccs3)C(C)C)c(C)c2)CC1 ZINC000513769933 922089406 /nfs/dbraw/zinc/08/94/06/922089406.db2.gz RQLSLNQFBQNLQE-UHFFFAOYSA-N 0 3 415.607 4.078 20 0 HIADHN CS(=O)(=O)Nc1ccc(CN[C@H]2CC3(CCCCC3)Oc3ccccc32)cc1 ZINC000513786288 922112874 /nfs/dbraw/zinc/11/28/74/922112874.db2.gz CYMCNPGSWNABIC-FQEVSTJZSA-N 0 3 400.544 4.374 20 0 HIADHN CN(CCN(Cc1ccccc1)C(=O)c1nc2cccnc2s1)Cc1ccccc1 ZINC000513832572 922159819 /nfs/dbraw/zinc/15/98/19/922159819.db2.gz MIIZUKRQLLHFDA-UHFFFAOYSA-N 0 3 416.550 4.466 20 0 HIADHN COCCOc1ccc(CN[C@H]2CCc3c2cccc3Br)cc1OC ZINC000513858858 922186549 /nfs/dbraw/zinc/18/65/49/922186549.db2.gz FEMIYSMIXQAHDQ-SFHVURJKSA-N 0 3 406.320 4.260 20 0 HIADHN O=C(NCc1ccsc1Br)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000514010788 922335358 /nfs/dbraw/zinc/33/53/58/922335358.db2.gz FPMSXMCNQXLELN-OAHLLOKOSA-N 0 3 411.340 4.178 20 0 HIADHN O=C(NCc1ccsc1Br)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000514010787 922335633 /nfs/dbraw/zinc/33/56/33/922335633.db2.gz FPMSXMCNQXLELN-HNNXBMFYSA-N 0 3 411.340 4.178 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)NCc2cc(Br)ccc2F)C1 ZINC000514044758 922365570 /nfs/dbraw/zinc/36/55/70/922365570.db2.gz PJPFZZXSVPPHRZ-RDTXWAMCSA-N 0 3 420.326 4.223 20 0 HIADHN O=C(Nc1ccccc1)[C@@H](NC[C@@H]1CCN(C(=O)c2ccccc2)C1)c1ccccc1 ZINC000514076339 922398377 /nfs/dbraw/zinc/39/83/77/922398377.db2.gz WUHTUVMQSFNVKT-RDPSFJRHSA-N 0 3 413.521 4.118 20 0 HIADHN C[C@@H]1CN(c2ccc(CN[C@H](c3cccc(OC(F)(F)F)c3)C3CC3)cn2)CCO1 ZINC000514096423 922422362 /nfs/dbraw/zinc/42/23/62/922422362.db2.gz VVARJOBIBRLPTR-VFNWGFHPSA-N 0 3 421.463 4.446 20 0 HIADHN Cn1cc(CN(CCc2ccccn2)Cc2ccc(F)cc2)c(-c2ccncc2)n1 ZINC000514103457 922431155 /nfs/dbraw/zinc/43/11/55/922431155.db2.gz CENODWUEPIPGED-UHFFFAOYSA-N 0 3 401.489 4.261 20 0 HIADHN COc1cc2c(c(OC)c1OC)CCN(C[C@H](OC)c1ccc(Cl)cc1)CC2 ZINC000514118236 922452379 /nfs/dbraw/zinc/45/23/79/922452379.db2.gz GQQLHFOCWCUPBM-FQEVSTJZSA-N 0 3 405.922 4.154 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)N[C@H]3CCc4cc(F)ccc43)CC2)c1 ZINC000514139160 922473197 /nfs/dbraw/zinc/47/31/97/922473197.db2.gz XFKBERZUCUZMJX-DEOSSOPVSA-N 0 3 424.564 4.023 20 0 HIADHN COc1cccc([C@@H](CNC(=O)N[C@H]2CCCOc3ccccc32)N2CCCC2)c1 ZINC000514173093 922511828 /nfs/dbraw/zinc/51/18/28/922511828.db2.gz UHCDSHJHSPYOBP-FCHUYYIVSA-N 0 3 409.530 4.045 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N1CCC(Nc2ccc(F)cc2)CC1 ZINC000514178647 922516696 /nfs/dbraw/zinc/51/66/96/922516696.db2.gz ABRIOMDQKQOAND-HXUWFJFHSA-N 0 3 416.566 4.310 20 0 HIADHN O=C(NCc1ccccc1Br)NC[C@@H](c1cccs1)N1CCCC1 ZINC000514180671 922520211 /nfs/dbraw/zinc/52/02/11/922520211.db2.gz UYXHVGKXUCOYKW-INIZCTEOSA-N 0 3 408.365 4.147 20 0 HIADHN Cc1ccccc1C[C@@H]1CCCN1CC(=O)N1CCC(OCc2ccccc2)CC1 ZINC000514191527 922532147 /nfs/dbraw/zinc/53/21/47/922532147.db2.gz YTOMHNKOGPQSMY-DEOSSOPVSA-N 0 3 406.570 4.210 20 0 HIADHN C[C@@H](NC(=O)NC[C@@H](Cc1ccccc1)N(C)C)c1ccc(OCC(F)(F)F)cc1 ZINC000514202029 922539826 /nfs/dbraw/zinc/53/98/26/922539826.db2.gz QKWYSTGDBRMYSP-VQIMIIECSA-N 0 3 423.479 4.161 20 0 HIADHN O=C(NCc1cccc(Br)c1)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000514220605 922554494 /nfs/dbraw/zinc/55/44/94/922554494.db2.gz ZLSXVITXHWFTNG-IBGZPJMESA-N 0 3 402.336 4.085 20 0 HIADHN CC(=O)Nc1ccc(S(=O)(=O)CCCN2CCC[C@H]2CC2CCCCC2)cc1 ZINC000514223705 922559321 /nfs/dbraw/zinc/55/93/21/922559321.db2.gz SIJYKJRTTSKHBW-NRFANRHFSA-N 0 3 406.592 4.244 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCc1ccccc1Br)c1ccsc1 ZINC000514226336 922562710 /nfs/dbraw/zinc/56/27/10/922562710.db2.gz SRXPEQXNXJNGRD-KRWDZBQOSA-N 0 3 410.381 4.393 20 0 HIADHN CC(=O)Nc1ccc(S(=O)(=O)CCCN(Cc2ccccc2)[C@H](C)C2CC2)cc1 ZINC000514230706 922566515 /nfs/dbraw/zinc/56/65/15/922566515.db2.gz MJTQXIHUEACIBO-GOSISDBHSA-N 0 3 414.571 4.110 20 0 HIADHN CC(C)n1ncc2c1nc(C1CC1)cc2C(=O)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000514317696 922596907 /nfs/dbraw/zinc/59/69/07/922596907.db2.gz YALPGYKVXUJRET-QHCPKHFHSA-N 0 3 417.557 4.457 20 0 HIADHN Cc1nc(C(C)C)sc1[C@H](C)N(C)C(=O)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000514407090 922613850 /nfs/dbraw/zinc/61/38/50/922613850.db2.gz OCPOCCHISMXBPK-HKUYNNGSSA-N 0 3 400.592 4.402 20 0 HIADHN CC(=O)N1C[C@@H]2CCC[C@H](NCc3csc(Cc4ccc(Cl)cc4)n3)[C@H]2C1 ZINC000514411500 922615941 /nfs/dbraw/zinc/61/59/41/922615941.db2.gz FKXHNSLQLIRYHH-VDGAXYAQSA-N 0 3 403.979 4.124 20 0 HIADHN C[C@H](NC(=O)N(CCN(C)C)Cc1ccccc1)c1ccc(Br)cc1 ZINC000514438925 922626339 /nfs/dbraw/zinc/62/63/39/922626339.db2.gz YMWPIRIIKQQLDR-INIZCTEOSA-N 0 3 404.352 4.284 20 0 HIADHN CC(C)c1c(C(=O)NCC2(N3CCSCC3)CCCC2)cnn1-c1ccccc1 ZINC000514498801 922650663 /nfs/dbraw/zinc/65/06/63/922650663.db2.gz CJDMQRBYQTUIRN-UHFFFAOYSA-N 0 3 412.603 4.087 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N(Cc2cccs2)C[C@H]2CCCO2)N(C)C)cc1 ZINC000514564148 922702828 /nfs/dbraw/zinc/70/28/28/922702828.db2.gz ADSRKPUHXDMTDJ-IRLDBZIGSA-N 0 3 415.603 4.304 20 0 HIADHN COc1ccc([C@H]2CCCN2C(=O)NC[C@@H](c2ccccc2)N2CCCC2)cc1OC ZINC000514566769 922704396 /nfs/dbraw/zinc/70/43/96/922704396.db2.gz NRGSXIQHVBVJMB-YADHBBJMSA-N 0 3 423.557 4.387 20 0 HIADHN CS(=O)(=O)C1(CN[C@@H]2CCc3c2cc(Br)cc3Cl)CCCC1 ZINC000514622493 922727857 /nfs/dbraw/zinc/72/78/57/922727857.db2.gz ZYNSALSQDVRSBX-OAHLLOKOSA-N 0 3 406.773 4.037 20 0 HIADHN Clc1ccc(CN2CCC[C@@H](c3nc(-c4ccccc4)n[nH]3)C2)c(-n2cncn2)c1 ZINC000514635049 922737515 /nfs/dbraw/zinc/73/75/15/922737515.db2.gz QNNUDDAQYOYQQV-GOSISDBHSA-N 0 3 419.920 4.085 20 0 HIADHN COc1cccc([C@H](CNC(=O)c2c3c(nc4ccccc42)CCC3)N2CCCC2)c1 ZINC000514775118 922798494 /nfs/dbraw/zinc/79/84/94/922798494.db2.gz QLJQIWQXSAFKOH-DEOSSOPVSA-N 0 3 415.537 4.299 20 0 HIADHN CSc1ccc([C@H](CNC(=O)[C@@H]2C[C@H]2c2cc(F)c(F)c(F)c2)N(C)C)cc1 ZINC000514786126 922802696 /nfs/dbraw/zinc/80/26/96/922802696.db2.gz WTMRELFRUOJIOB-FCEWJHQRSA-N 0 3 408.489 4.348 20 0 HIADHN C[C@@H]1[C@H](NC(=O)Cc2csc(-c3cccc(F)c3)n2)CCN1Cc1ccccc1 ZINC000514810516 922809143 /nfs/dbraw/zinc/80/91/43/922809143.db2.gz QAITUDTYHGKXJJ-IIBYNOLFSA-N 0 3 409.530 4.271 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)c1ccc(C)c(NC(=O)NC(C)(C)C)c1)c1ccco1 ZINC000514962431 922855405 /nfs/dbraw/zinc/85/54/05/922855405.db2.gz HJAPBVFYXAONKX-APWZRJJASA-N 0 3 414.550 4.367 20 0 HIADHN Cc1cc(C)n(-c2ccccc2NC(=O)NC[C@H](c2ccccc2)N2CCCC2)n1 ZINC000515118657 922931884 /nfs/dbraw/zinc/93/18/84/922931884.db2.gz ZUOPNGWMLFCRTG-HSZRJFAPSA-N 0 3 403.530 4.448 20 0 HIADHN COc1cccc([C@H](CNC(=O)Nc2ccccc2N2CCCC2)N2CCCC2)c1 ZINC000515384425 923073052 /nfs/dbraw/zinc/07/30/52/923073052.db2.gz DGSDFLGBQMXLFW-QHCPKHFHSA-N 0 3 408.546 4.254 20 0 HIADHN CN(C)[C@@H](CNC(=O)Nc1cccc(NC(=O)c2cccs2)c1)c1ccccc1 ZINC000515388865 923076504 /nfs/dbraw/zinc/07/65/04/923076504.db2.gz VJIODKYHSFUINA-IBGZPJMESA-N 0 3 408.527 4.425 20 0 HIADHN CN(Cc1ccc(OC(F)F)cc1)C(=O)CN1CCC[C@@H]1Cc1ccc(F)cc1 ZINC000515508863 923142603 /nfs/dbraw/zinc/14/26/03/923142603.db2.gz MIOJJYBHJJJWDM-LJQANCHMSA-N 0 3 406.448 4.093 20 0 HIADHN C[C@H](N[C@H](Cc1ccc(C(F)(F)F)cc1)C(N)=O)c1ccc(C(F)(F)F)cc1 ZINC000515559364 923177952 /nfs/dbraw/zinc/17/79/52/923177952.db2.gz OYKOBADCCLZFSW-MEDUHNTESA-N 0 3 404.354 4.471 20 0 HIADHN Cc1ccc(NC(=O)[C@H](N[C@@H](Cc2ccccc2)CN(C)C)c2ccccc2)cc1 ZINC000515737743 923312262 /nfs/dbraw/zinc/31/22/62/923312262.db2.gz HIYFRRAHNAICOS-LOSJGSFVSA-N 0 3 401.554 4.437 20 0 HIADHN Cc1cccc([C@H]2CCCN2C(=O)NCCCCN2CCN(c3ccccc3)CC2)c1 ZINC000515791302 923351115 /nfs/dbraw/zinc/35/11/15/923351115.db2.gz SEEKBKSFIXXXGG-RUZDIDTESA-N 0 3 420.601 4.444 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)NCc3ccc([C@H]4C[C@H]4C)o3)CC2)c1 ZINC000515794318 923353983 /nfs/dbraw/zinc/35/39/83/923353983.db2.gz KRLXLABMNPNYCD-OFNKIYASSA-N 0 3 424.589 4.113 20 0 HIADHN Cc1ccc([C@@H](NC(=O)NCCCCN2CCN(c3ccccc3)CC2)C2CC2)cc1 ZINC000515902449 923421248 /nfs/dbraw/zinc/42/12/48/923421248.db2.gz CSQDYDKCEZVTFB-RUZDIDTESA-N 0 3 420.601 4.348 20 0 HIADHN C[C@@H](CC(=O)NCCCCN1CCN(Cc2ccccc2)CC1)c1ccc(F)cc1 ZINC000516010317 923499556 /nfs/dbraw/zinc/49/95/56/923499556.db2.gz WVXBUUWPCRQMJR-NRFANRHFSA-N 0 3 411.565 4.034 20 0 HIADHN CC1CCN([C@H](CNC(=O)N2CCO[C@@H](c3ccccc3)C2)c2ccccc2)CC1 ZINC000516149213 923576423 /nfs/dbraw/zinc/57/64/23/923576423.db2.gz LJZAPHZXULTIRB-DNQXCXABSA-N 0 3 407.558 4.243 20 0 HIADHN CCOc1ccc([C@H](C)NC(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)cc1OC ZINC000516163750 923582609 /nfs/dbraw/zinc/58/26/09/923582609.db2.gz TWOGSTZPSFASTB-WAOWUJCRSA-N 0 3 411.546 4.290 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)cc1OC ZINC000516164956 923584398 /nfs/dbraw/zinc/58/43/98/923584398.db2.gz IHPLPVNYHGNMLQ-NYVOZVTQSA-N 0 3 423.557 4.386 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)Nc3ccc(-c4ccccn4)cc3)CC2)C[C@H](C)O1 ZINC000516354235 923683896 /nfs/dbraw/zinc/68/38/96/923683896.db2.gz IXIBNNHWUVBARB-PMACEKPBSA-N 0 3 422.573 4.492 20 0 HIADHN CN(C)Cc1ccccc1NC(=O)c1cc(I)ccc1Cl ZINC000516364892 923693750 /nfs/dbraw/zinc/69/37/50/923693750.db2.gz RPLLAINMGFTEBZ-UHFFFAOYSA-N 0 3 414.674 4.259 20 0 HIADHN CN(C)Cc1ccccc1C(=O)Nc1ccc(C(=O)Nc2cccnc2)c(Cl)c1 ZINC000516369993 923697411 /nfs/dbraw/zinc/69/74/11/923697411.db2.gz JIZGLINJPHWMNR-UHFFFAOYSA-N 0 3 408.889 4.301 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CNC(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000516578701 923800118 /nfs/dbraw/zinc/80/01/18/923800118.db2.gz JVZYGRBYUCXBBZ-UGKGYDQZSA-N 0 3 417.557 4.124 20 0 HIADHN COc1ccc(OC2CCN(C(=O)N[C@H]3CCN([C@@H](C)c4ccccc4)C3)CC2)cc1 ZINC000516581459 923801846 /nfs/dbraw/zinc/80/18/46/923801846.db2.gz GMWFPQSXWCOXFB-FPOVZHCZSA-N 0 3 423.557 4.084 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)NCc2ccc(Br)s2)C1 ZINC000516581477 923802378 /nfs/dbraw/zinc/80/23/78/923802378.db2.gz NFKJMJRCILTBLL-HIFRSBDPSA-N 0 3 408.365 4.145 20 0 HIADHN CCOc1cc(CNCc2ccc(NC(=O)C(C)C)cc2)cc(Br)c1O ZINC000516592068 923805859 /nfs/dbraw/zinc/80/58/59/923805859.db2.gz HPTNPDVEASUQQK-UHFFFAOYSA-N 0 3 421.335 4.438 20 0 HIADHN C[C@H](CN1C[C@H](C)C[C@@H](C)C1)NC(=O)N1CCC(C(=O)c2ccc(Cl)cc2)CC1 ZINC000516683805 923844406 /nfs/dbraw/zinc/84/44/06/923844406.db2.gz SNYZKHWEIXKWJG-KZNAEPCWSA-N 0 3 419.997 4.311 20 0 HIADHN CC(C)(C(=O)NC[C@H]1CCCCN1C1CC1)c1csc(-c2cc(F)ccc2F)n1 ZINC000517062299 923982928 /nfs/dbraw/zinc/98/29/28/923982928.db2.gz ONVSGFBWDXMCMT-MRXNPFEDSA-N 0 3 419.541 4.499 20 0 HIADHN CC[C@H](NC(=O)Nc1ccc(N2CCN(CC)CC2)cc1C)c1nc(C)cs1 ZINC000517118794 924008120 /nfs/dbraw/zinc/00/81/20/924008120.db2.gz KNCVEYMBRFDHBH-SFHVURJKSA-N 0 3 401.580 4.175 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)NCc2ccc(Br)cc2)C1 ZINC000517340691 924113039 /nfs/dbraw/zinc/11/30/39/924113039.db2.gz BMZXCELVJFZWPK-HNAYVOBHSA-N 0 3 402.336 4.084 20 0 HIADHN COCCN(C)CCNC(=O)[C@H](Sc1ccc(F)c(Cl)c1)c1ccccc1 ZINC000517371276 924139738 /nfs/dbraw/zinc/13/97/38/924139738.db2.gz XJAVAQVJSAUKLI-LJQANCHMSA-N 0 3 410.942 4.007 20 0 HIADHN C[C@@H](NC(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1)c1nc(C(C)(C)C)cs1 ZINC000517373113 924141484 /nfs/dbraw/zinc/14/14/84/924141484.db2.gz HSZXZFXCKAXSTO-IXDOHACOSA-N 0 3 422.639 4.032 20 0 HIADHN CN1CCN(Cc2ccc(CNC(=O)[C@@H]3C[C@H]3c3cccc4ccccc43)cc2)CC1 ZINC000517406701 924160824 /nfs/dbraw/zinc/16/08/24/924160824.db2.gz FZEXZGHSQAKUKW-IZZNHLLZSA-N 0 3 413.565 4.007 20 0 HIADHN Cc1cc(NC(=O)c2cccc(F)c2)sc1C(=O)N1CC[C@H](N2CCCCC2)C1 ZINC000517411814 924164321 /nfs/dbraw/zinc/16/43/21/924164321.db2.gz YSPHPOLBHTWYNM-SFHVURJKSA-N 0 3 415.534 4.148 20 0 HIADHN C[C@H]1CN([C@@H](CNCc2cc(F)c(F)c(F)c2)c2c(F)cccc2Cl)CCO1 ZINC000517537391 924252591 /nfs/dbraw/zinc/25/25/91/924252591.db2.gz QZKMWQRCSVNQEW-SGTLLEGYSA-N 0 3 416.846 4.448 20 0 HIADHN COc1ccc(Cl)cc1CN(C)C(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000517544482 924256952 /nfs/dbraw/zinc/25/69/52/924256952.db2.gz CTJLPUOGKWQTLS-OXJNMPFZSA-N 0 3 401.938 4.326 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1NC(=O)CCN1Cc2ccccc2OC(C)(C)C1 ZINC000517618889 926727580 /nfs/dbraw/zinc/72/75/80/926727580.db2.gz BVLHHOVAYWXPHF-UHFFFAOYSA-N 0 3 418.541 4.491 20 0 HIADHN Cc1csc(Nc2ccc(NC(=O)[C@@H]3CCCN(Cc4cccnc4)C3)cc2)n1 ZINC000517681153 926786030 /nfs/dbraw/zinc/78/60/30/926786030.db2.gz MJHRAMVRXBPSTH-GOSISDBHSA-N 0 3 407.543 4.441 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N1CCC[C@@H]1Cc1ccc(F)cc1 ZINC000517724090 926814783 /nfs/dbraw/zinc/81/47/83/926814783.db2.gz GMSVGEPRDLENAK-WOJBJXKFSA-N 0 3 401.551 4.441 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N(C)Cc2ccc(Br)s2)C1 ZINC000517790914 926838483 /nfs/dbraw/zinc/83/84/83/926838483.db2.gz HDXCTBDGIKKAPC-GDBMZVCRSA-N 0 3 422.392 4.488 20 0 HIADHN COCCN1CCC[C@H]1CNC(=O)c1ccccc1-c1ncc(-c2ccc(C)cc2)o1 ZINC000517805298 926844149 /nfs/dbraw/zinc/84/41/49/926844149.db2.gz CKTUKIDVJUJQRM-FQEVSTJZSA-N 0 3 419.525 4.158 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)Cc2coc(-c3ccc(Cl)cc3)n2)o1 ZINC000517811670 926847150 /nfs/dbraw/zinc/84/71/50/926847150.db2.gz IFBDDCPRNONCKH-UHFFFAOYSA-N 0 3 401.894 4.029 20 0 HIADHN O=C([C@H]1CCCN(Cc2cccc(F)c2)C1)N1CCC[C@H]1c1ccc2c(c1)OCCO2 ZINC000517889127 926876176 /nfs/dbraw/zinc/87/61/76/926876176.db2.gz SGNKWKUASBYIHQ-UNMCSNQZSA-N 0 3 424.516 4.173 20 0 HIADHN CC(=O)N1CCN(c2ccccc2CN[C@H]2CCCc3c4ccccc4[nH]c32)CC1 ZINC000517999322 926941169 /nfs/dbraw/zinc/94/11/69/926941169.db2.gz PDJQQBLEBJGPTK-QHCPKHFHSA-N 0 3 402.542 4.004 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)NC[C@H]1CCCO[C@@H]1C(C)(C)C ZINC000518002923 926943413 /nfs/dbraw/zinc/94/34/13/926943413.db2.gz QFOFXKFSUDAMRQ-YADHBBJMSA-N 0 3 403.611 4.034 20 0 HIADHN C[C@@H](NC(=O)NCC1(N2CCSCC2)CCCC1)c1nc(C(C)(C)C)cs1 ZINC000518021766 926961602 /nfs/dbraw/zinc/96/16/02/926961602.db2.gz BMHFZRPQXCEZAJ-OAHLLOKOSA-N 0 3 410.653 4.162 20 0 HIADHN Cc1cc(NC(=O)c2cccc(F)c2)sc1C(=O)NC[C@@H](C)N1CCC[C@H](C)C1 ZINC000518054137 926991310 /nfs/dbraw/zinc/99/13/10/926991310.db2.gz OKLFSHODRFKQCL-GOEBONIOSA-N 0 3 417.550 4.298 20 0 HIADHN O=C(CCCc1nc(-c2cccs2)no1)N[C@H](CN1CCCC1)c1ccccc1 ZINC000518125772 927034621 /nfs/dbraw/zinc/03/46/21/927034621.db2.gz JGOFZZAACOSXPR-GOSISDBHSA-N 0 3 410.543 4.074 20 0 HIADHN C[C@H](C1CC1)N(Cc1ccccc1)C(=O)NCC1(N2CCSCC2)CCCC1 ZINC000518224364 927089246 /nfs/dbraw/zinc/08/92/46/927089246.db2.gz VJZMAHLBZSXQER-LJQANCHMSA-N 0 3 401.620 4.358 20 0 HIADHN CCC[C@H](NCc1cccc(OC(F)(F)F)c1)C(=O)N1CCc2sccc2C1 ZINC000518279889 927137459 /nfs/dbraw/zinc/13/74/59/927137459.db2.gz HGBAOACBRGTDEK-KRWDZBQOSA-N 0 3 412.477 4.490 20 0 HIADHN O=C(CCN1CCc2c(cccc2NC(=O)Nc2ccccc2)C1)NC1CCCC1 ZINC000518312119 927174545 /nfs/dbraw/zinc/17/45/45/927174545.db2.gz IJPVJDJMMLBSBM-UHFFFAOYSA-N 0 3 406.530 4.138 20 0 HIADHN CC(C)COc1cccc(NC(=O)N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)c1 ZINC000518316068 927178740 /nfs/dbraw/zinc/17/87/40/927178740.db2.gz PBMSZCWVOVEZHT-KDURUIRLSA-N 0 3 403.567 4.075 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3cccc(Cl)c3Cl)CC2)C[C@H](C)O1 ZINC000518316870 927180371 /nfs/dbraw/zinc/18/03/71/927180371.db2.gz ZJBUVVFJDLYYNF-OKILXGFUSA-N 0 3 400.350 4.347 20 0 HIADHN CN(C)Cc1ccccc1CNC(=O)CCCc1nc(-c2ccc(Cl)cc2)no1 ZINC000518337424 927201838 /nfs/dbraw/zinc/20/18/38/927201838.db2.gz WHAIKDOJYBACEH-UHFFFAOYSA-N 0 3 412.921 4.091 20 0 HIADHN C[C@@H](C(=O)NC[C@@H]1CCN(c2ccc(F)cc2)C1)N1CCC(Cc2ccccc2)CC1 ZINC000518385894 927233737 /nfs/dbraw/zinc/23/37/37/927233737.db2.gz FKIVTSPXOSMWFV-REWPJTCUSA-N 0 3 423.576 4.111 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)N(C)Cc2ccccc2Br)C1 ZINC000518403357 927245435 /nfs/dbraw/zinc/24/54/35/927245435.db2.gz KAWZDYUXOGBMSJ-QFBILLFUSA-N 0 3 416.363 4.426 20 0 HIADHN Cc1sc2ncnc(SCC(=O)N(CCN(C)C)C3CCCCC3)c2c1C ZINC000518425370 927261100 /nfs/dbraw/zinc/26/11/00/927261100.db2.gz OUOJBDDWKUKTKY-UHFFFAOYSA-N 0 3 406.621 4.123 20 0 HIADHN Cc1cccc(C(=O)N2CCCC2)c1NC(=O)N[C@H]1CCN(Cc2ccccc2)[C@@H]1C ZINC000518506697 927315901 /nfs/dbraw/zinc/31/59/01/927315901.db2.gz JPDJNMOCYOXLFH-KNQAVFIVSA-N 0 3 420.557 4.016 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)NC[C@@H]1CCCO[C@H]1c1ccccc1 ZINC000518521960 927323652 /nfs/dbraw/zinc/32/36/52/927323652.db2.gz UKJXHTYSJKTVLJ-REWPJTCUSA-N 0 3 413.537 4.067 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)NC[C@H]1CCCO[C@@H]1c1ccccc1 ZINC000518521957 927324617 /nfs/dbraw/zinc/32/46/17/927324617.db2.gz UKJXHTYSJKTVLJ-NFBKMPQASA-N 0 3 413.537 4.067 20 0 HIADHN C[C@@H](NC(=O)N1CCCN(Cc2ccccc2)CC1)c1nc(C(C)(C)C)cs1 ZINC000518540943 927336871 /nfs/dbraw/zinc/33/68/71/927336871.db2.gz LJVKZLUDKNKULL-QGZVFWFLSA-N 0 3 400.592 4.419 20 0 HIADHN CCCCCOc1ccc(C(=O)CCC(=O)N2CC[C@@H](N3CCCCC3)C2)cc1 ZINC000518619626 927383330 /nfs/dbraw/zinc/38/33/30/927383330.db2.gz CCMQOEHMMBLUDL-OAQYLSRUSA-N 0 3 400.563 4.305 20 0 HIADHN C[C@H](CC(=O)Nc1cccc(N2CCCC2)c1)NCc1cnc(-c2ccccc2)nc1 ZINC000518783419 927490122 /nfs/dbraw/zinc/49/01/22/927490122.db2.gz LWAMKNTXYCWKRT-LJQANCHMSA-N 0 3 415.541 4.251 20 0 HIADHN CN(C)c1ncc(CNCCOc2ccc3cc(Br)ccc3c2)s1 ZINC000518805055 927501805 /nfs/dbraw/zinc/50/18/05/927501805.db2.gz ZPWCLHOVXNWGAC-UHFFFAOYSA-N 0 3 406.349 4.293 20 0 HIADHN COC(=O)c1cc(C)nc(NC[C@H]2CCCN(C)[C@H]2c2ccc(C(F)(F)F)cc2)n1 ZINC000518809211 927506322 /nfs/dbraw/zinc/50/63/22/927506322.db2.gz JKQDEECJCQFOCK-QAPCUYQASA-N 0 3 422.451 4.085 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)c(Cl)c1 ZINC000518812475 927508281 /nfs/dbraw/zinc/50/82/81/927508281.db2.gz PQISZFACFSWQEB-RDTXWAMCSA-N 0 3 400.910 4.255 20 0 HIADHN C[C@@H](CNc1nc(C2CCCCC2)nc2sc3c(c21)CCC3)N1CCN(C)CC1 ZINC000518849258 927552813 /nfs/dbraw/zinc/55/28/13/927552813.db2.gz WYFMZIAOYHEQRA-INIZCTEOSA-N 0 3 413.635 4.276 20 0 HIADHN C[C@@H](CNC(=O)[C@H](C)N(C)CCCc1cc(-c2cccc(F)c2)n[nH]1)c1ccccc1 ZINC000518862455 927569006 /nfs/dbraw/zinc/56/90/06/927569006.db2.gz SGBUXTFZWHJZPZ-OALUTQOASA-N 0 3 422.548 4.389 20 0 HIADHN C[C@H](CNC(=O)N1CCC(Oc2ccc(F)cc2F)CC1)N(C)Cc1ccccc1 ZINC000518968056 927663021 /nfs/dbraw/zinc/66/30/21/927663021.db2.gz AJNYMSSVVFJFPU-QGZVFWFLSA-N 0 3 417.500 4.038 20 0 HIADHN COc1cccc(COC[C@H](O)CN2CCC[C@H]2Cc2c(F)cccc2Cl)c1 ZINC000519000275 927682375 /nfs/dbraw/zinc/68/23/75/927682375.db2.gz CFPABCCJRGNBMJ-ZWKOTPCHSA-N 0 3 407.913 4.072 20 0 HIADHN COc1ccc([C@@H](Cc2ccc(F)cc2)N[C@H](C)C(=O)NCCc2ccccc2)cc1 ZINC000519064328 927743085 /nfs/dbraw/zinc/74/30/85/927743085.db2.gz WCSMVBIRHIQBAI-KBMIEXCESA-N 0 3 420.528 4.455 20 0 HIADHN CCCN(CC)C(=O)c1ccc(C(=O)NC[C@@H](c2ccc(CC)cc2)N(C)C)cc1 ZINC000519085172 927758698 /nfs/dbraw/zinc/75/86/98/927758698.db2.gz OQWKAFTYLDYHSY-QHCPKHFHSA-N 0 3 409.574 4.154 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)Cc2coc(-c3ccc(Cl)cc3)n2)C1 ZINC000519107821 927777346 /nfs/dbraw/zinc/77/73/46/927777346.db2.gz IKDQXFBAEBTTLL-UZLBHIALSA-N 0 3 409.917 4.489 20 0 HIADHN C[C@H](c1cccs1)N(Cc1ccccc1)C[C@@H](O)COc1ccc2c(c1)OCO2 ZINC000519195626 927821621 /nfs/dbraw/zinc/82/16/21/927821621.db2.gz KYIDWZYNODVFIS-IEBWSBKVSA-N 0 3 411.523 4.480 20 0 HIADHN COc1ccc2c(c1F)CC[C@@H]2NCc1cc(Br)c2c(c1)OCCO2 ZINC000519221822 927833894 /nfs/dbraw/zinc/83/38/94/927833894.db2.gz JHEPPHXLZPCZPO-HNNXBMFYSA-N 0 3 408.267 4.145 20 0 HIADHN CCOc1cc2c(cc1NC(=O)NC[C@@H](c1ccccc1)N1CCCC1)O[C@@H](C)C2 ZINC000519241405 927843496 /nfs/dbraw/zinc/84/34/96/927843496.db2.gz HLYJCTAGHDWAME-UWJYYQICSA-N 0 3 409.530 4.367 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N[C@@H](c2ccc(F)cc2)[C@H]2CCCO2)N(C)C)cc1 ZINC000519250877 927846875 /nfs/dbraw/zinc/84/68/75/927846875.db2.gz OALAAJDCAZDPDT-ZRBLBEILSA-N 0 3 413.537 4.210 20 0 HIADHN Cc1c([C@H](C)NC(=O)N2CCN(CCC(C)(C)C)CC2)cnn1-c1ccc(F)cc1 ZINC000519265788 927855463 /nfs/dbraw/zinc/85/54/63/927855463.db2.gz RXJVSBFUERSETI-KRWDZBQOSA-N 0 3 415.557 4.144 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2ccccc2I)N(C)C)cc1 ZINC000519275289 927859818 /nfs/dbraw/zinc/85/98/18/927859818.db2.gz LPTLUCNXGRPYOB-KRWDZBQOSA-N 0 3 423.298 4.024 20 0 HIADHN CC[C@@H](CNC(=O)N(C)[C@@H](C)c1sc(C)nc1C)N1CCc2ccccc2C1 ZINC000519293811 927866974 /nfs/dbraw/zinc/86/69/74/927866974.db2.gz RNGJDQKBSNSSPQ-JXFKEZNVSA-N 0 3 400.592 4.299 20 0 HIADHN O=C(N[C@H](c1ccc(F)cc1)[C@H]1CCCO1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000519421628 927936267 /nfs/dbraw/zinc/93/62/67/927936267.db2.gz OZIYIPSVMXZUQT-UEVCKROQSA-N 0 3 414.496 4.213 20 0 HIADHN C[C@H](NCCCS(=O)(=O)c1ccc(Cl)cc1)c1ccnn1-c1ccccc1 ZINC000519435325 927945712 /nfs/dbraw/zinc/94/57/12/927945712.db2.gz LSETZFRSFOENRC-INIZCTEOSA-N 0 3 403.935 4.040 20 0 HIADHN COc1ccccc1[C@H](NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1)c1ccccc1 ZINC000519440469 927949679 /nfs/dbraw/zinc/94/96/79/927949679.db2.gz IJYVZGNZFPDNRR-RCZVLFRGSA-N 0 3 415.537 4.358 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2nnc(Cc3ccccc3F)s2)N(C)C)cc1 ZINC000519450268 927957688 /nfs/dbraw/zinc/95/76/88/927957688.db2.gz YPUDXAPDEGDPDH-GOSISDBHSA-N 0 3 413.522 4.001 20 0 HIADHN Cc1ccc(Cc2nnc(NC(=O)N[C@H](CN3CCCC3)c3ccccc3)s2)cc1 ZINC000519452311 927960912 /nfs/dbraw/zinc/96/09/12/927960912.db2.gz YJLPOYKGZHOPKL-HXUWFJFHSA-N 0 3 421.570 4.396 20 0 HIADHN CN1CCN(CCCNc2nc(C(F)F)nc3ccccc32)[C@@H](c2ccccc2)C1 ZINC000519477918 927975966 /nfs/dbraw/zinc/97/59/66/927975966.db2.gz FDZXLFOMQYIQPB-HXUWFJFHSA-N 0 3 411.500 4.358 20 0 HIADHN O=C(NC1(c2noc(C3CCN(Cc4ccccc4)CC3)n2)CCC1)c1ccccc1 ZINC000519476242 927976583 /nfs/dbraw/zinc/97/65/83/927976583.db2.gz YYYYUEYQASQJAO-UHFFFAOYSA-N 0 3 416.525 4.258 20 0 HIADHN C[C@H](N[C@H]1c2ccccc2CC12CCOCC2)C(=O)NC12CC3CC(CC(C3)C1)C2 ZINC000519482946 927979208 /nfs/dbraw/zinc/97/92/08/927979208.db2.gz GOKKSPNUQLDELI-AZIODVPDSA-N 0 3 408.586 4.144 20 0 HIADHN COCCN(CCCc1ccccc1)C(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000519488740 927986220 /nfs/dbraw/zinc/98/62/20/927986220.db2.gz LNHSSKJWSAGQSO-URXFXBBRSA-N 0 3 409.574 4.113 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)N[C@@H](c1ccccc1)c1ccccn1 ZINC000519501092 927995464 /nfs/dbraw/zinc/99/54/64/927995464.db2.gz GITJUMPJKIOJFE-QHCPKHFHSA-N 0 3 424.495 4.223 20 0 HIADHN CN1CC[C@@]2(CCN(C(=O)c3ccccc3C(=O)c3ccc(Cl)c(Cl)c3)C2)C1 ZINC000519723403 928057087 /nfs/dbraw/zinc/05/70/87/928057087.db2.gz IUAVGWLKENHHMU-JOCHJYFZSA-N 0 3 417.336 4.392 20 0 HIADHN CCOCC(C)(C)CN[C@@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000519723751 928057732 /nfs/dbraw/zinc/05/77/32/928057732.db2.gz JBUAASOCSHXPPV-FQEVSTJZSA-N 0 3 409.979 4.485 20 0 HIADHN COC(C)(C)c1nc(C)c(C(=O)N(Cc2ccccc2)C2CCN(C)CC2)s1 ZINC000519795098 928080002 /nfs/dbraw/zinc/08/00/02/928080002.db2.gz FKBYZVHLEUTWQI-UHFFFAOYSA-N 0 3 401.576 4.070 20 0 HIADHN COC(=O)c1c(F)ccc(NC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)c1C ZINC000519859821 928099529 /nfs/dbraw/zinc/09/95/29/928099529.db2.gz JOXJHOOBQLRBPJ-INIZCTEOSA-N 0 3 413.493 4.049 20 0 HIADHN COc1ccccc1C[C@H]1CCCN1C(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000519924392 928157069 /nfs/dbraw/zinc/15/70/69/928157069.db2.gz LFPGADICZKIPHM-WOJBJXKFSA-N 0 3 413.587 4.310 20 0 HIADHN CC(C)OCc1ccccc1CNC(=O)N(CCN(C)C)Cc1ccc(F)cc1 ZINC000519970604 928197532 /nfs/dbraw/zinc/19/75/32/928197532.db2.gz ASGBPJHVFZIUJA-UHFFFAOYSA-N 0 3 401.526 4.024 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)c(C)c1 ZINC000519989231 928216202 /nfs/dbraw/zinc/21/62/02/928216202.db2.gz JHDUUHIJKGCQDA-CNNODRBYSA-N 0 3 422.573 4.480 20 0 HIADHN O=C(CN1CCCCC[C@H]1c1ccccc1)NCc1ccccc1CN1CCCC1=O ZINC000520042542 928266530 /nfs/dbraw/zinc/26/65/30/928266530.db2.gz NXKARSVFRRVHEG-DEOSSOPVSA-N 0 3 419.569 4.043 20 0 HIADHN CSc1cc(C(=O)N(CCN(C)C)Cc2cccc(Cl)c2)ccc1NC(C)=O ZINC000520105878 928313756 /nfs/dbraw/zinc/31/37/56/928313756.db2.gz YZULPXWPVVJCLD-UHFFFAOYSA-N 0 3 419.978 4.224 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)NCc1coc(-c2cccs2)n1 ZINC000520114403 928320181 /nfs/dbraw/zinc/32/01/81/928320181.db2.gz JERQSLPNYXAOCB-UHFFFAOYSA-N 0 3 418.950 4.330 20 0 HIADHN CCOc1cccc([C@H](C)NC(=O)NC[C@H](c2ccc(OC)cc2)N2CCCC2)c1 ZINC000520135743 928331786 /nfs/dbraw/zinc/33/17/86/928331786.db2.gz JGXFNOWMAXMAGF-FDDCHVKYSA-N 0 3 411.546 4.291 20 0 HIADHN CC(=O)Nc1ccc(OC[C@H](O)CN(C)[C@H](C)c2ccc(Cl)c(Cl)c2)cc1 ZINC000520173256 928362688 /nfs/dbraw/zinc/36/26/88/928362688.db2.gz ZZZNLKUOQGURRD-CXAGYDPISA-N 0 3 411.329 4.385 20 0 HIADHN CC(C)c1cc(C(=O)NC[C@H](C)N(C)Cc2ccccc2)c2cnn(C(C)C)c2n1 ZINC000520326738 928490840 /nfs/dbraw/zinc/49/08/40/928490840.db2.gz JJKUSVROLSSOER-SFHVURJKSA-N 0 3 407.562 4.386 20 0 HIADHN Cc1c([C@H](C)NC(=O)NC[C@H](C)N(C)Cc2ccccc2)cnn1-c1ccc(F)cc1 ZINC000520377820 928531679 /nfs/dbraw/zinc/53/16/79/928531679.db2.gz QMTSVPKYSSFVHT-ROUUACIJSA-N 0 3 423.536 4.201 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1nnc(C)s1)c1ccc(C(F)(F)F)cc1 ZINC000520460415 928578223 /nfs/dbraw/zinc/57/82/23/928578223.db2.gz RLSMVAXZSYROQH-CQSZACIVSA-N 0 3 401.458 4.070 20 0 HIADHN COc1ccccc1COC[C@@H](O)CN1CCC[C@H]1Cc1c(F)cccc1Cl ZINC000520523815 928617061 /nfs/dbraw/zinc/61/70/61/928617061.db2.gz JEUMWOPADVHHFU-ROUUACIJSA-N 0 3 407.913 4.072 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)Nc3cc(F)c(F)cc3F)CC2)c1 ZINC000520603642 928668544 /nfs/dbraw/zinc/66/85/44/928668544.db2.gz UAQUDPRZBYMOHA-UHFFFAOYSA-N 0 3 420.479 4.136 20 0 HIADHN CN(C)Cc1cccc(NC(=O)C(=O)N[C@H](c2ccc(Cl)cc2)C2CCCC2)c1 ZINC000520668607 928711890 /nfs/dbraw/zinc/71/18/90/928711890.db2.gz BDEIWFZJCQCAFK-NRFANRHFSA-N 0 3 413.949 4.388 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)N[C@H](c1ccc(F)cc1)[C@H]1CCCO1 ZINC000520816044 928830999 /nfs/dbraw/zinc/83/09/99/928830999.db2.gz LBJCATJIYUISQK-DNVJHFABSA-N 0 3 411.521 4.182 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2ccccc2OC[C@@H]2CCCCO2)N(C)C)cc1 ZINC000520831227 928835981 /nfs/dbraw/zinc/83/59/81/928835981.db2.gz XTEHVIYCQKXRTN-RBBKRZOGSA-N 0 3 411.546 4.367 20 0 HIADHN CCOc1cc(CNCc2ccccc2C(F)(F)F)ccc1O[C@@H](C)C(=O)N(C)C ZINC000520965734 928893099 /nfs/dbraw/zinc/89/30/99/928893099.db2.gz XTTYGLNTWCTWEE-HNNXBMFYSA-N 0 3 424.463 4.249 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)N3CC4C[C@@H]5CC3C[C@H](C4)C5)CC2)c1 ZINC000521044473 928956835 /nfs/dbraw/zinc/95/68/35/928956835.db2.gz XZWYLUGTPITGPS-PMLGBOFDSA-N 0 3 424.633 4.117 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)Nc1nc(C(F)(F)F)cs1 ZINC000521065025 928970469 /nfs/dbraw/zinc/97/04/69/928970469.db2.gz ZNVWZIJFJZMYOK-UHFFFAOYSA-N 0 3 408.396 4.036 20 0 HIADHN CN(Cc1csc2ccccc12)C(=O)CCCN1CCN(c2ccccc2)CC1 ZINC000521164979 929038378 /nfs/dbraw/zinc/03/83/78/929038378.db2.gz GUMVQCYOMQGMIS-UHFFFAOYSA-N 0 3 407.583 4.462 20 0 HIADHN CC[C@@H](CNC(=O)N(CCOC)[C@@H](C)c1ccccc1)N1CCc2ccccc2C1 ZINC000521167295 929039142 /nfs/dbraw/zinc/03/91/42/929039142.db2.gz STDNJRBHLAWARS-RDPSFJRHSA-N 0 3 409.574 4.243 20 0 HIADHN Cc1cccc(CN(CC(=O)N2CCC(C(=O)Nc3ccccc3)CC2)CC(C)C)c1 ZINC000521195595 929055227 /nfs/dbraw/zinc/05/52/27/929055227.db2.gz JUCHSZMWVQJMCV-UHFFFAOYSA-N 0 3 421.585 4.330 20 0 HIADHN Cc1ccc(-c2nc(CC(=O)N(C)CCCN(C)Cc3ccncc3)cs2)cc1 ZINC000521286962 929102672 /nfs/dbraw/zinc/10/26/72/929102672.db2.gz IMTGRDVGHQDOAW-UHFFFAOYSA-N 0 3 408.571 4.037 20 0 HIADHN CCN1CCCN(C(=O)CCc2c3ccccc3[nH]c2-c2ccc(OC)cc2)CC1 ZINC000521357414 929178600 /nfs/dbraw/zinc/17/86/00/929178600.db2.gz KUYOWPZJBXVMQW-UHFFFAOYSA-N 0 3 405.542 4.330 20 0 HIADHN CCOc1ccc(OCCN2CCC(Oc3c(OC)cccc3OC)CC2)cc1 ZINC000521425888 929216536 /nfs/dbraw/zinc/21/65/36/929216536.db2.gz PYDUTWXHFPITND-UHFFFAOYSA-N 0 3 401.503 4.025 20 0 HIADHN CN(C)[C@H](CNC(=O)NCc1ccc(Br)cc1Cl)c1ccccc1 ZINC000521436609 929220505 /nfs/dbraw/zinc/22/05/05/929220505.db2.gz IDZWLQVPEHDLLT-QGZVFWFLSA-N 0 3 410.743 4.205 20 0 HIADHN Cc1cc(C(=O)N2CCCC[C@@H]2C)ccc1NC(=O)NCCN(C)Cc1ccccc1 ZINC000521443645 929223320 /nfs/dbraw/zinc/22/33/20/929223320.db2.gz SRVXJHHAFLDQBE-FQEVSTJZSA-N 0 3 422.573 4.263 20 0 HIADHN CN(C(=O)Nc1ccc(OC(F)(F)F)cc1)C1CCN(CCc2ccccn2)CC1 ZINC000521561647 929296923 /nfs/dbraw/zinc/29/69/23/929296923.db2.gz ZLDQADLIOXJKRJ-UHFFFAOYSA-N 0 3 422.451 4.151 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)c1cc2cc(Br)ccc2o1 ZINC000521573347 929305212 /nfs/dbraw/zinc/30/52/12/929305212.db2.gz TVWAYZSLRQXRDU-UHFFFAOYSA-N 0 3 401.304 4.399 20 0 HIADHN COc1cccc(C[C@H]2CCCN2C(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)c1 ZINC000521598783 929320712 /nfs/dbraw/zinc/32/07/12/929320712.db2.gz ZDLJDHPOLUGIJD-FYYLOGMGSA-N 0 3 410.533 4.280 20 0 HIADHN O=C(Cc1sc(-c2ccccc2)nc1-c1cccs1)N[C@@H]1CCN(C2CC2)C1 ZINC000521677717 929360442 /nfs/dbraw/zinc/36/04/42/929360442.db2.gz LNUKUZHHXMSBPR-MRXNPFEDSA-N 0 3 409.580 4.434 20 0 HIADHN Cc1ccc([C@@H](NC(=O)N(CCN(C)C)Cc2ccc(F)cc2F)C2CC2)cc1 ZINC000521687075 929367493 /nfs/dbraw/zinc/36/74/93/929367493.db2.gz ILFMYPQVXJPDLI-JOCHJYFZSA-N 0 3 401.501 4.498 20 0 HIADHN CC(=O)Nc1cccc([C@H](C)NC(=O)N(CCN(C)C)Cc2cccc(Cl)c2)c1 ZINC000521689101 929368016 /nfs/dbraw/zinc/36/80/16/929368016.db2.gz OWEJQVANQFEZBO-INIZCTEOSA-N 0 3 416.953 4.133 20 0 HIADHN COc1ccc(NC(=O)[C@H](NCCc2ccc(OC)cc2OC)c2ccccc2)cc1 ZINC000521766645 929427666 /nfs/dbraw/zinc/42/76/66/929427666.db2.gz BQHBZWXOCLTNTB-XMMPIXPASA-N 0 3 420.509 4.225 20 0 HIADHN COc1ccc(NC(=O)[C@@H](NCCc2ccc(OC)cc2OC)c2ccccc2)cc1 ZINC000521766638 929427734 /nfs/dbraw/zinc/42/77/34/929427734.db2.gz BQHBZWXOCLTNTB-DEOSSOPVSA-N 0 3 420.509 4.225 20 0 HIADHN Cc1cccc(CN(CC(=O)NCC2(c3ccccc3)CCOCC2)CC(C)C)c1 ZINC000521821795 929479278 /nfs/dbraw/zinc/47/92/78/929479278.db2.gz WZPZNANGOXXERR-UHFFFAOYSA-N 0 3 408.586 4.318 20 0 HIADHN Fc1cc(CNC2(c3cccc(Br)c3)CCC2)ccc1-n1cncn1 ZINC000521831934 929483721 /nfs/dbraw/zinc/48/37/21/929483721.db2.gz YMQLYFDVXAYERE-UHFFFAOYSA-N 0 3 401.283 4.338 20 0 HIADHN CC[C@H](C)[C@H](NCc1cnc2n[nH]c(C)c2c1)C(=O)Nc1cccc(N2CCCC2)c1 ZINC000521831624 929484249 /nfs/dbraw/zinc/48/42/49/929484249.db2.gz BLZUYESTHBYQHQ-AOMKIAJQSA-N 0 3 420.561 4.010 20 0 HIADHN CCN(CC)[C@H](CNC(=O)[C@H](c1ccccc1)N1CCSCC1)c1ccsc1 ZINC000521836576 929488985 /nfs/dbraw/zinc/48/89/85/929488985.db2.gz LEKIYQZSFGMCSG-RTWAWAEBSA-N 0 3 417.644 4.037 20 0 HIADHN FC(F)(F)COc1cccc(CN2CCC(n3cc(Br)cn3)CC2)c1 ZINC000521874331 929522591 /nfs/dbraw/zinc/52/25/91/929522591.db2.gz LMYBMCNTWWBYOY-UHFFFAOYSA-N 0 3 418.257 4.424 20 0 HIADHN Cc1ccc(Br)cc1NC(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000521879144 929527078 /nfs/dbraw/zinc/52/70/78/929527078.db2.gz XFBRQGMKYASKNS-IYBDPMFKSA-N 0 3 424.383 4.111 20 0 HIADHN COCCSc1ccc([C@H](C)N[C@@H](C)C(=O)N(C)Cc2cccc(F)c2)cc1 ZINC000521881794 929529624 /nfs/dbraw/zinc/52/96/24/929529624.db2.gz VRQARHSBGDDOFK-IRXDYDNUSA-N 0 3 404.551 4.262 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)NCc1ccccc1C(F)(F)F ZINC000521888378 929536199 /nfs/dbraw/zinc/53/61/99/929536199.db2.gz BSTDERCZMNJGSP-UHFFFAOYSA-N 0 3 415.406 4.257 20 0 HIADHN COCCN(C(=O)NCC(C)(C)N1CCc2ccccc2C1)[C@@H](C)c1ccccc1 ZINC000521887535 929536527 /nfs/dbraw/zinc/53/65/27/929536527.db2.gz STWQDYNHMCDCDB-FQEVSTJZSA-N 0 3 409.574 4.243 20 0 HIADHN C[C@H](C(=O)N1[C@H](C)CCC[C@@H]1C)N(C)CCCc1cc(-c2cccc(F)c2)n[nH]1 ZINC000521902619 929544994 /nfs/dbraw/zinc/54/49/94/929544994.db2.gz GCWPBCCRIDLULA-FGTMMUONSA-N 0 3 400.542 4.258 20 0 HIADHN Cc1nn(Cc2ccccc2Cl)c(C)c1C(=O)NC[C@@H](C)N(C)Cc1ccccc1 ZINC000521957022 929593307 /nfs/dbraw/zinc/59/33/07/929593307.db2.gz MRYSRFHJBWGLMN-QGZVFWFLSA-N 0 3 424.976 4.452 20 0 HIADHN Cc1ccc(NC(=O)C2CC2)cc1NC(=O)NC[C@@H]1CCCN1Cc1ccccc1 ZINC000524481457 929630958 /nfs/dbraw/zinc/63/09/58/929630958.db2.gz XLHVXGGCOYDNJA-NRFANRHFSA-N 0 3 406.530 4.130 20 0 HIADHN CS(=O)(=O)c1cccc(OCCN(CCc2ccccc2F)C2CCCC2)c1 ZINC000524593516 929703543 /nfs/dbraw/zinc/70/35/43/929703543.db2.gz DDNNEQFIZLCHJV-UHFFFAOYSA-N 0 3 405.535 4.095 20 0 HIADHN C[C@@H](CNC(=O)c1ccccc1C(=O)c1ccc(Cl)c(Cl)c1)N(C)C1CC1 ZINC000524596163 929704941 /nfs/dbraw/zinc/70/49/41/929704941.db2.gz MPNSJSIAFBVFSK-ZDUSSCGKSA-N 0 3 405.325 4.437 20 0 HIADHN CCN(Cc1ccc(OC)c(OC)c1)C(=O)CN1C[C@@H](c2ccccc2C)C[C@@H]1C ZINC000524595898 929705452 /nfs/dbraw/zinc/70/54/52/929705452.db2.gz ZBBRAPAIGROLHF-FPOVZHCZSA-N 0 3 410.558 4.239 20 0 HIADHN CCCN(C(=O)NC[C@H](c1ccc(C)cc1)N1CCCC1)[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000524628316 929737393 /nfs/dbraw/zinc/73/73/93/929737393.db2.gz RRXFNUBGWFKDEK-SSGKUCQKSA-N 0 3 413.606 4.367 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)N[C@H](c1ccccc1)c1ccccn1 ZINC000524630527 929739594 /nfs/dbraw/zinc/73/95/94/929739594.db2.gz KKUBSWPMLXHREM-PXDATVDWSA-N 0 3 414.553 4.477 20 0 HIADHN CC[C@H](NC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C)c1ccc2c(c1)OCCO2 ZINC000524630013 929740089 /nfs/dbraw/zinc/74/00/89/929740089.db2.gz SZMPFVAUOBOHSB-KNQAVFIVSA-N 0 3 423.557 4.215 20 0 HIADHN CN(C)Cc1ccccc1CNC(=O)c1ccc(Sc2ccccc2Cl)nn1 ZINC000524653099 929765126 /nfs/dbraw/zinc/76/51/26/929765126.db2.gz NMQVDHFUNUKNFC-UHFFFAOYSA-N 0 3 412.946 4.273 20 0 HIADHN CN(C(=O)[C@@H](Oc1ccc(F)c(Cl)c1)c1ccccc1)[C@@H]1CCN(C2CC2)C1 ZINC000524694263 929802212 /nfs/dbraw/zinc/80/22/12/929802212.db2.gz FYAQTZRROCLTAR-UTKZUKDTSA-N 0 3 402.897 4.294 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)Nc1ccc(O[C@@H]2CCOC2)cc1 ZINC000524799758 929834426 /nfs/dbraw/zinc/83/44/26/929834426.db2.gz PZYUIJGDOXOCIC-OAQYLSRUSA-N 0 3 417.937 4.103 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(F)cc2)CC1)c1ccccc1C(F)(F)F ZINC000524813745 929839866 /nfs/dbraw/zinc/83/98/66/929839866.db2.gz QCXVAJAWQLRJHH-UHFFFAOYSA-N 0 3 410.411 4.118 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)c1ccccc1OCc1cscn1 ZINC000524864958 929864149 /nfs/dbraw/zinc/86/41/49/929864149.db2.gz JSCHWMZGDKMOOH-LJQANCHMSA-N 0 3 421.566 4.459 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)CCCOc1ccc(F)cc1F ZINC000524866564 929864452 /nfs/dbraw/zinc/86/44/52/929864452.db2.gz DDLDCJUWUPOYQI-SFHVURJKSA-N 0 3 402.485 4.247 20 0 HIADHN Cc1cc(C)n(-c2ccc(C(=O)N3CCCN(Cc4ccccc4)C[C@@H]3C)cc2)n1 ZINC000524865498 929864751 /nfs/dbraw/zinc/86/47/51/929864751.db2.gz STJOAXYNOYUDTO-NRFANRHFSA-N 0 3 402.542 4.226 20 0 HIADHN COc1ccc2nc(NC(=O)N3CCCN(Cc4ccccc4)C[C@H]3C)sc2c1 ZINC000524892340 929875619 /nfs/dbraw/zinc/87/56/19/929875619.db2.gz AQEXCNPRFOIZDX-MRXNPFEDSA-N 0 3 410.543 4.433 20 0 HIADHN CCCN(CC(=O)Nc1ccc(OC(F)F)c(Cl)c1)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000524893815 929876833 /nfs/dbraw/zinc/87/68/33/929876833.db2.gz PAOLLPXEWXWJNN-MORSLUCNSA-N 0 3 416.896 4.405 20 0 HIADHN C[C@H](CNC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C)COCc1ccccc1 ZINC000524931525 929896770 /nfs/dbraw/zinc/89/67/70/929896770.db2.gz CQUIKRXKOHHKNA-YADHBBJMSA-N 0 3 409.574 4.145 20 0 HIADHN COc1cc(CCNCc2nc(-c3cccc(Br)c3)c[nH]2)ccc1C ZINC000524944611 929907340 /nfs/dbraw/zinc/90/73/40/929907340.db2.gz LMLSIKQWMGJEQY-UHFFFAOYSA-N 0 3 400.320 4.489 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)[C@@H]1C[C@H]1c1ccccc1OC(F)(F)F ZINC000524958093 929921143 /nfs/dbraw/zinc/92/11/43/929921143.db2.gz ACUGETGSNFTJLB-VQTJNVASSA-N 0 3 418.459 4.253 20 0 HIADHN CN(C)CCN(C(=O)CCSc1ccc2c(c1)OCCCO2)C1CCCCC1 ZINC000524966675 929931575 /nfs/dbraw/zinc/93/15/75/929931575.db2.gz UIOYSSLIMLZPPZ-UHFFFAOYSA-N 0 3 406.592 4.053 20 0 HIADHN COc1ccc2nc(C)cc(C(=O)Nc3ccc(CCN4CCSCC4)cc3)c2c1 ZINC000525026503 929986309 /nfs/dbraw/zinc/98/63/09/929986309.db2.gz BEDDWFVUXMATKG-UHFFFAOYSA-N 0 3 421.566 4.395 20 0 HIADHN CCCc1c(C(=O)N2CCCN(C(C)(C)C)CC2)nnn1-c1cccc(C(C)C)c1 ZINC000525065711 930013067 /nfs/dbraw/zinc/01/30/67/930013067.db2.gz OZWWKZNRCKQPLJ-UHFFFAOYSA-N 0 3 411.594 4.290 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)CCc2ccc(Cl)cc2)cc1)[C@@H]1CCCN(C)C1 ZINC000525066066 930013611 /nfs/dbraw/zinc/01/36/11/930013611.db2.gz FVEKWUMKVHHOGL-OAQYLSRUSA-N 0 3 413.949 4.078 20 0 HIADHN C[C@@H](NC(=O)CCCN1CCN(c2ccccc2)CC1)c1ccccc1C(F)(F)F ZINC000525075695 930020695 /nfs/dbraw/zinc/02/06/95/930020695.db2.gz MUSLMHUQQAYVCQ-GOSISDBHSA-N 0 3 419.491 4.485 20 0 HIADHN O=C(c1ccc(OCc2ccccn2)cc1)N(CCN1CCCC1)c1ccccc1 ZINC000525165297 930073261 /nfs/dbraw/zinc/07/32/61/930073261.db2.gz DUXNQDKLQLQTIJ-UHFFFAOYSA-N 0 3 401.510 4.403 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1C(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1 ZINC000525223678 930092483 /nfs/dbraw/zinc/09/24/83/930092483.db2.gz DVOLPNMMGZGHKP-FQEVSTJZSA-N 0 3 416.569 4.285 20 0 HIADHN COc1cc(-c2nnc(CN3C[C@H](c4ccccc4)C[C@H]3C)o2)cc(OC)c1OC ZINC000525273052 930124952 /nfs/dbraw/zinc/12/49/52/930124952.db2.gz OWKRBPFCGBNYDQ-CRAIPNDOSA-N 0 3 409.486 4.140 20 0 HIADHN CC[C@H](C)[C@H]1CCCCN1CC(=O)N(C)CC(=O)Nc1ccccc1C(F)(F)F ZINC000525327766 930165314 /nfs/dbraw/zinc/16/53/14/930165314.db2.gz HIBKHFMTEOVZIQ-MAUKXSAKSA-N 0 3 413.484 4.003 20 0 HIADHN C[C@@H](CC(=O)NC1CCN(CCOc2ccc(F)cc2)CC1)c1ccc(F)cc1 ZINC000525332087 930167523 /nfs/dbraw/zinc/16/75/23/930167523.db2.gz PQPDYICCJKGVNI-KRWDZBQOSA-N 0 3 402.485 4.118 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)NCCc1ccc(OC(F)F)cc1 ZINC000525399874 930219844 /nfs/dbraw/zinc/21/98/44/930219844.db2.gz DCFLBTVCQZWYIZ-GOSISDBHSA-N 0 3 417.500 4.137 20 0 HIADHN CCCN(Cc1cc(OC)c(OC)cc1Br)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000525410852 930224531 /nfs/dbraw/zinc/22/45/31/930224531.db2.gz MIZXWTAVGIGUEX-GDIGMMSISA-N 0 3 412.368 4.492 20 0 HIADHN CC(C)(C)C[C@H](NC(=O)NC[C@@]1(O)CCN(Cc2ccccc2)C1)c1ccccc1 ZINC000525507339 930291385 /nfs/dbraw/zinc/29/13/85/930291385.db2.gz FVUCWRUDADKCRF-DHLKQENFSA-N 0 3 409.574 4.100 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)c3ccccc3OC3CCCCC3)CC2)C[C@H](C)O1 ZINC000525569800 930335617 /nfs/dbraw/zinc/33/56/17/930335617.db2.gz UXTSQPVBHMYVSU-PMACEKPBSA-N 0 3 414.590 4.360 20 0 HIADHN CN(C(=O)c1ccccc1OCc1ccccc1Br)[C@@H]1CCCN(C)C1 ZINC000525619045 930365455 /nfs/dbraw/zinc/36/54/55/930365455.db2.gz RTFBMLPQCJSKEO-QGZVFWFLSA-N 0 3 417.347 4.194 20 0 HIADHN C[C@@H]1C[C@@H](c2ccccc2)[C@H](C)N1C(=O)CCCN1CCN(c2ccccc2)CC1 ZINC000525645401 930380721 /nfs/dbraw/zinc/38/07/21/930380721.db2.gz LIUJZBNVMJWANI-OTNCWRBYSA-N 0 3 405.586 4.382 20 0 HIADHN Brc1cc(CNC2(c3ccccc3)CCOCC2)cc2c1OCCCO2 ZINC000525697272 930407870 /nfs/dbraw/zinc/40/78/70/930407870.db2.gz YOPKMCKVNVRITN-UHFFFAOYSA-N 0 3 418.331 4.406 20 0 HIADHN Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)N[C@@H]1CCCN(c2cnn(C)c2)C1=O ZINC000525756838 930432365 /nfs/dbraw/zinc/43/23/65/930432365.db2.gz KISDGSKARMITDO-HNAYVOBHSA-N 0 3 409.559 4.007 20 0 HIADHN C[C@@H](NC(=O)C(=O)Nc1ccc2oc3ccccc3c2c1)[C@H](c1ccccc1)N(C)C ZINC000525905197 930480518 /nfs/dbraw/zinc/48/05/18/930480518.db2.gz NXNXZGWKJPTCGE-WAIKUNEKSA-N 0 3 415.493 4.332 20 0 HIADHN Cc1cccc([C@@H]2CCCN2C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)n1 ZINC000525928127 930485722 /nfs/dbraw/zinc/48/57/22/930485722.db2.gz FKLHHNZYXYNHLZ-TVPLGVNVSA-N 0 3 410.484 4.042 20 0 HIADHN O=C(Nc1ccn(Cc2ccccc2)n1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000526063813 930516676 /nfs/dbraw/zinc/51/66/76/930516676.db2.gz YMIDCJPGIVHOKX-UHFFFAOYSA-N 0 3 421.570 4.167 20 0 HIADHN CC(C)c1ccc(CCNC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cc1 ZINC000526792702 930546343 /nfs/dbraw/zinc/54/63/43/930546343.db2.gz SMNBDMNJQGYMKC-UHFFFAOYSA-N 0 3 411.512 4.457 20 0 HIADHN C[C@@H](NCC(=O)NCc1ccc(C(=O)N2CCCC2)cc1)c1cc2ccccc2s1 ZINC000526945088 930554030 /nfs/dbraw/zinc/55/40/30/930554030.db2.gz HUEWUMCJVAPIPK-QGZVFWFLSA-N 0 3 421.566 4.104 20 0 HIADHN C[C@H](NCC(=O)NCCc1cnn(-c2ccccc2)c1)c1cc2ccccc2s1 ZINC000526944638 930554448 /nfs/dbraw/zinc/55/44/48/930554448.db2.gz IFOMPZPRCNCXKU-KRWDZBQOSA-N 0 3 404.539 4.097 20 0 HIADHN Cn1c2ccc(CNCc3ccc(Cn4cnc5ccccc54)cc3)cc2sc1=O ZINC000526979687 930561197 /nfs/dbraw/zinc/56/11/97/930561197.db2.gz WRPIRIGFGGDQIB-UHFFFAOYSA-N 0 3 414.534 4.288 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)N[C@H]2CCCN(Cc3ccc(F)cc3F)C2=O)cc1 ZINC000527039977 930574311 /nfs/dbraw/zinc/57/43/11/930574311.db2.gz RTRMGGOXWCUTEG-HJPURHCSSA-N 0 3 424.495 4.301 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)CCOc3ccccc3)c(OCC)c2)CC1 ZINC000527061161 930578041 /nfs/dbraw/zinc/57/80/41/930578041.db2.gz VINZFUVMFKVMAG-UHFFFAOYSA-N 0 3 411.546 4.025 20 0 HIADHN C[C@@H](NCc1ccc2c(c1)sc(=O)n2C)c1ccc(NC(=O)c2ccncc2)cc1 ZINC000527528798 930674814 /nfs/dbraw/zinc/67/48/14/930674814.db2.gz IGSPHXVDVBTESY-OAHLLOKOSA-N 0 3 418.522 4.098 20 0 HIADHN Cc1cc(NC(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)ccc1NC(=O)c1ccco1 ZINC000530409814 930705257 /nfs/dbraw/zinc/70/52/57/930705257.db2.gz OQSALKOHNMJQIR-IRLDBZIGSA-N 0 3 418.497 4.407 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2ccc(C(=O)NC3CCCCC3)cc2)[C@@H]1c1ccccc1 ZINC000530515311 930733214 /nfs/dbraw/zinc/73/32/14/930733214.db2.gz VZWJLEHPDWVRFR-PKTZIBPZSA-N 0 3 420.557 4.316 20 0 HIADHN CC(C)N1CCN([C@H]2CCN(C(=O)c3ccc(O[C@@H](C)c4ccccc4)cc3)C2)CC1 ZINC000530522845 930737798 /nfs/dbraw/zinc/73/77/98/930737798.db2.gz ICMGWFYJQSDQFP-URXFXBBRSA-N 0 3 421.585 4.067 20 0 HIADHN COc1ccc2nc(CN[C@@H]3CCN(C4CC4)[C@H]3c3cccc(OC)c3)sc2c1 ZINC000530545687 930741839 /nfs/dbraw/zinc/74/18/39/930741839.db2.gz KMMVSAYHDFQHBS-OFNKIYASSA-N 0 3 409.555 4.381 20 0 HIADHN O=C(CC1(N2CCOCC2)CCCC1)Nc1ccccc1COCc1ccccc1 ZINC000530572961 930754829 /nfs/dbraw/zinc/75/48/29/930754829.db2.gz YPZSDPGXUSWYSY-UHFFFAOYSA-N 0 3 408.542 4.377 20 0 HIADHN C[C@H](NC(=O)[C@@H]1CCCN(Cc2cccnc2)C1)c1ccc(-c2ccncc2)cc1 ZINC000530580329 930756846 /nfs/dbraw/zinc/75/68/46/930756846.db2.gz OTDHZMCERXIQKL-YADARESESA-N 0 3 400.526 4.233 20 0 HIADHN Cc1ccc(-n2cnnc2SCc2nc(-c3ccc(CN(C)C)cc3)no2)cc1C ZINC000530632213 930779191 /nfs/dbraw/zinc/77/91/91/930779191.db2.gz BIPMNITZULREJL-UHFFFAOYSA-N 0 3 420.542 4.288 20 0 HIADHN CN(C)Cc1ccc(-c2noc(-c3csc(-c4ccc5c(c4)OCCO5)n3)n2)cc1 ZINC000530633058 930780079 /nfs/dbraw/zinc/78/00/79/930780079.db2.gz VJQJWNFMEJZBOT-UHFFFAOYSA-N 0 3 420.494 4.360 20 0 HIADHN Cc1cccc(-c2nc(-c3ccc(CN(C)C)cc3)no2)c1I ZINC000530632871 930780445 /nfs/dbraw/zinc/78/04/45/930780445.db2.gz RAKMIOZWYUZAKV-UHFFFAOYSA-N 0 3 419.266 4.378 20 0 HIADHN C[C@H](Sc1ccccc1)c1ccc(NC(=O)C(=O)N2CC[C@H](N3CCCC3)C2)cc1 ZINC000530747092 930815781 /nfs/dbraw/zinc/81/57/81/930815781.db2.gz VJZSLSMMKJKFAR-RXVVDRJESA-N 0 3 423.582 4.175 20 0 HIADHN O=C(CC1(N2CCOCC2)CCCC1)Nc1ccccc1OCCc1ccccc1 ZINC000530811486 930829662 /nfs/dbraw/zinc/82/96/62/930829662.db2.gz TVNYNAYIIJZGDR-UHFFFAOYSA-N 0 3 408.542 4.282 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)c2ccc(Oc3ccccc3Cl)nc2)CC1 ZINC000530858914 930842330 /nfs/dbraw/zinc/84/23/30/930842330.db2.gz UTQCWSBBVRUSLZ-UHFFFAOYSA-N 0 3 417.937 4.147 20 0 HIADHN CCOc1ccc(-c2noc(CCc3nc(-c4ccc(CN(C)C)cc4)no3)n2)cc1 ZINC000530871791 930844821 /nfs/dbraw/zinc/84/48/21/930844821.db2.gz VYSKCRLNVIRIEK-UHFFFAOYSA-N 0 3 419.485 4.032 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)NCCc2ccc(OC(F)F)cc2)CC1 ZINC000530922664 930859007 /nfs/dbraw/zinc/85/90/07/930859007.db2.gz SLFLQIFRNUSWSR-UHFFFAOYSA-N 0 3 417.500 4.137 20 0 HIADHN Ic1cccc(OCCCN2CCC[C@@H]2c2ccccn2)c1 ZINC000530963307 930869270 /nfs/dbraw/zinc/86/92/70/930869270.db2.gz NDTXUHZEBXWDKA-GOSISDBHSA-N 0 3 408.283 4.292 20 0 HIADHN CN(C)Cc1ccc(-c2noc(C3CCN(c4nc5ccccc5o4)CC3)n2)cc1 ZINC000531110038 930923480 /nfs/dbraw/zinc/92/34/80/930923480.db2.gz IBHFDHXKMJUPPH-UHFFFAOYSA-N 0 3 403.486 4.323 20 0 HIADHN COC(=O)c1cc2c(o1)c(OC)ccc2CNCc1ccc(OC(F)(F)F)cc1 ZINC000531141969 930941566 /nfs/dbraw/zinc/94/15/66/930941566.db2.gz LYMHGCBTRHWRBI-UHFFFAOYSA-N 0 3 409.360 4.416 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)COc2ccc(C(F)(F)F)cc2)CC1 ZINC000531157811 930948031 /nfs/dbraw/zinc/94/80/31/930948031.db2.gz AGPHJLFGBWYDPU-UHFFFAOYSA-N 0 3 406.448 4.207 20 0 HIADHN COc1ccc(CNCc2n[nH]c(-c3ccc(Br)cc3)n2)cc1Cl ZINC000531256431 930984076 /nfs/dbraw/zinc/98/40/76/930984076.db2.gz BCFPJLYBWSGCRQ-UHFFFAOYSA-N 0 3 407.699 4.186 20 0 HIADHN Cc1ccc(C)c(Oc2ccc(CNC(=O)CC3(N4CCOCC4)CCCC3)cn2)c1 ZINC000531289839 931003032 /nfs/dbraw/zinc/00/30/32/931003032.db2.gz IAURBTJZYSGBCR-UHFFFAOYSA-N 0 3 423.557 4.142 20 0 HIADHN O=C(CCN1CCN(c2ccccc2)CC1)N[C@H](c1cccs1)c1ccc(F)cc1 ZINC000531290902 931004263 /nfs/dbraw/zinc/00/42/63/931004263.db2.gz DRJNZQGBUXTSGC-DEOSSOPVSA-N 0 3 423.557 4.305 20 0 HIADHN CCN1CCN(CCC(=O)N[C@@H](c2ccc(C)cc2)c2ccc(F)cc2Cl)CC1 ZINC000531292777 931005132 /nfs/dbraw/zinc/00/51/32/931005132.db2.gz LLPBWNWEPNEYBY-QHCPKHFHSA-N 0 3 417.956 4.021 20 0 HIADHN CN(C)Cc1ccc(-c2noc(CCNC(=O)c3ccc(C(C)(C)C)cc3)n2)cc1 ZINC000531348475 931026484 /nfs/dbraw/zinc/02/64/84/931026484.db2.gz HFNQHLQVRCPHOZ-UHFFFAOYSA-N 0 3 406.530 4.068 20 0 HIADHN COc1ccc2oc(C(=O)N3CCC(CCN4C[C@@H](C)O[C@H](C)C4)CC3)c(C)c2c1 ZINC000531417978 931049658 /nfs/dbraw/zinc/04/96/58/931049658.db2.gz VTLXLPBZWAXPHM-IAGOWNOFSA-N 0 3 414.546 4.101 20 0 HIADHN C[C@@H](CC(=O)Nc1cccc(N2CCCC2)c1)NCc1c[nH]c(-c2ccccc2)n1 ZINC000531489008 931075996 /nfs/dbraw/zinc/07/59/96/931075996.db2.gz JBGHDMKOHKQFEQ-SFHVURJKSA-N 0 3 403.530 4.184 20 0 HIADHN CC(C)(NCc1ccc(OCCN2CCOCC2)c(Cl)c1)c1ccc(F)c(F)c1 ZINC000531582266 931109166 /nfs/dbraw/zinc/10/91/66/931109166.db2.gz ULJLUVLWBBDWTB-UHFFFAOYSA-N 0 3 424.919 4.354 20 0 HIADHN CCc1cc(Br)ccc1NC(=O)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000531673772 931146183 /nfs/dbraw/zinc/14/61/83/931146183.db2.gz UGWIVJJPTIFXTO-KRWDZBQOSA-N 0 3 402.336 4.257 20 0 HIADHN COc1ccc(OC)c(CN[C@H](C)CC(=O)Nc2ccc(OC(F)(F)F)cc2)c1 ZINC000531687790 931152741 /nfs/dbraw/zinc/15/27/41/931152741.db2.gz MTYLROOMGQXBEP-CYBMUJFWSA-N 0 3 412.408 4.109 20 0 HIADHN COc1cc([C@H](C)N[C@H](C)c2ccc(NS(C)(=O)=O)cc2)ccc1OC(C)C ZINC000531689793 931154919 /nfs/dbraw/zinc/15/49/19/931154919.db2.gz UYDCHVLIKSDFQF-CVEARBPZSA-N 0 3 406.548 4.266 20 0 HIADHN COc1ccc(C[C@@H](NCC(=O)N(C)Cc2ccccc2)c2ccc(OC)cc2)cc1 ZINC000531698881 931163011 /nfs/dbraw/zinc/16/30/11/931163011.db2.gz GZSLBDFRYKBDDO-RUZDIDTESA-N 0 3 418.537 4.236 20 0 HIADHN CC[C@H](N[C@H](C)c1ccc2c(c1)OCCCO2)c1ccccc1OCC(=O)N(C)C ZINC000531701228 931163911 /nfs/dbraw/zinc/16/39/11/931163911.db2.gz ODVWZBSBLJEAKT-XLIONFOSSA-N 0 3 412.530 4.117 20 0 HIADHN CC[C@H](NCc1ccccc1CS(=O)(=O)NC(C)C)c1ccc(Cl)s1 ZINC000531703044 931164679 /nfs/dbraw/zinc/16/46/79/931164679.db2.gz DUEBOEUAFDFLDR-INIZCTEOSA-N 0 3 400.997 4.470 20 0 HIADHN CC(C)c1ccc2c(c1)[C@@H](NCc1ccc(C(=O)N3CCOCC3)cc1)CCCO2 ZINC000531759652 931186300 /nfs/dbraw/zinc/18/63/00/931186300.db2.gz SJYMWIDOLMAUEV-QHCPKHFHSA-N 0 3 408.542 4.286 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3cc(F)c(OC)cc3F)c(C)c2)CC1 ZINC000531827359 931211411 /nfs/dbraw/zinc/21/14/11/931211411.db2.gz VREOPUUXPKOAHQ-UHFFFAOYSA-N 0 3 404.461 4.068 20 0 HIADHN Cc1ccc(-c2ccc(C(=O)N3CC[C@@H](N4CCN(C(C)C)CC4)C3)c(F)c2)cc1 ZINC000531832287 931212268 /nfs/dbraw/zinc/21/22/68/931212268.db2.gz OWKTZPMBLVXNQU-JOCHJYFZSA-N 0 3 409.549 4.042 20 0 HIADHN CCC(CC)(C(=O)N1CC[C@@H](N2CCN(C(C)C)CC2)C1)c1ccc(Cl)cc1 ZINC000531836895 931214890 /nfs/dbraw/zinc/21/48/90/931214890.db2.gz VGSGXUGKJFJJGJ-OAQYLSRUSA-N 0 3 406.014 4.025 20 0 HIADHN CN1CCN(c2ccc(C(F)(F)F)cc2CNCc2cnc(C3CCC3)s2)CC1 ZINC000531866655 931228400 /nfs/dbraw/zinc/22/84/00/931228400.db2.gz XDSFUFQETXPZBI-UHFFFAOYSA-N 0 3 424.536 4.471 20 0 HIADHN CCCO[C@H]1CCCN(CC(=O)N[C@H](C)c2ccc(OC(F)(F)F)cc2)CC1 ZINC000531904941 931242341 /nfs/dbraw/zinc/24/23/41/931242341.db2.gz SAKAUFWLRSXDTF-WBVHZDCISA-N 0 3 402.457 4.044 20 0 HIADHN Cc1nc(C(C)C)sc1[C@@H](C)NCc1ccc(CS(=O)(=O)NC(C)C)cc1 ZINC000531951636 931260737 /nfs/dbraw/zinc/26/07/37/931260737.db2.gz MDXYNRXFJRWJIC-OAHLLOKOSA-N 0 3 409.621 4.254 20 0 HIADHN CNC(=O)c1cccc(CN[C@@H](Cc2ccc(OC)cc2)c2ccc(OC)cc2)c1 ZINC000531956008 931263708 /nfs/dbraw/zinc/26/37/08/931263708.db2.gz XDUQZTPPHYMAEN-DEOSSOPVSA-N 0 3 404.510 4.137 20 0 HIADHN CC(C)NS(=O)(=O)Cc1ccccc1CN[C@H](C)c1cccc(-c2ccncc2)c1 ZINC000531958404 931264263 /nfs/dbraw/zinc/26/42/63/931264263.db2.gz YBFILQDNDIQDPT-LJQANCHMSA-N 0 3 423.582 4.427 20 0 HIADHN CCC[C@H](N[C@H](C)c1ccc2c(c1)OCCCO2)C(=O)N1CCc2sccc2C1 ZINC000531965755 931268541 /nfs/dbraw/zinc/26/85/41/931268541.db2.gz SMYKFVCJJNRTRY-APWZRJJASA-N 0 3 414.571 4.314 20 0 HIADHN O=C(N[C@H](c1ccccc1)c1cccc(F)c1)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000532030648 931290586 /nfs/dbraw/zinc/29/05/86/931290586.db2.gz JINIBAQSUOLEOX-ISKFKSNPSA-N 0 3 403.501 4.339 20 0 HIADHN CN(C)Cc1cccc(NC(=O)NCc2ccc(NC(=O)c3ccc(F)cc3)cc2)c1 ZINC000532073184 931302953 /nfs/dbraw/zinc/30/29/53/931302953.db2.gz NIAQDNLWLUMUSV-UHFFFAOYSA-N 0 3 420.488 4.461 20 0 HIADHN COc1cc(OC)cc(OCCCNCc2nc3cc(C(F)(F)F)ccc3n2C)c1 ZINC000532120522 931320796 /nfs/dbraw/zinc/32/07/96/931320796.db2.gz HVLUGVBDUWZSNT-UHFFFAOYSA-N 0 3 423.435 4.168 20 0 HIADHN C[C@H](NC[C@H](c1ccccc1Cl)N1CCCC1)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000532204376 931349116 /nfs/dbraw/zinc/34/91/16/931349116.db2.gz ZFLOPOVWKKASNA-MGPUTAFESA-N 0 3 424.969 4.370 20 0 HIADHN CC[C@H](N[C@H](C)c1ccc(-n2ccnc2)cc1)c1ccccc1OCC(=O)N(C)C ZINC000532212149 931354801 /nfs/dbraw/zinc/35/48/01/931354801.db2.gz WHPYQXUMVDPYKC-GCJKJVERSA-N 0 3 406.530 4.141 20 0 HIADHN Cn1nnc2cc(CNCc3cn(Cc4ccccc4)nc3-c3ccccc3)ccc21 ZINC000532213159 931355023 /nfs/dbraw/zinc/35/50/23/931355023.db2.gz FRPWOMPPTSGBBU-UHFFFAOYSA-N 0 3 408.509 4.170 20 0 HIADHN Cc1ccc(C[NH+]2CCCC2)cc1[N-]S(=O)(=O)c1ccc(OC(F)(F)F)cc1 ZINC000532271094 931378957 /nfs/dbraw/zinc/37/89/57/931378957.db2.gz VKXFJYUBWHHXTM-UHFFFAOYSA-N 0 3 414.449 4.290 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NCc2nnc3c(Cl)cc(C(F)(F)F)cn23)C1 ZINC000532296301 931389601 /nfs/dbraw/zinc/38/96/01/931389601.db2.gz VBXRIZXPPPVENT-CZUORRHYSA-N 0 3 423.870 4.327 20 0 HIADHN FC(F)(F)c1cnc(N2CC[C@H](NCc3cnn(-c4ccccc4)c3)C2)c(Cl)c1 ZINC000532322151 931396840 /nfs/dbraw/zinc/39/68/40/931396840.db2.gz JQIAVOUBPYLPLJ-INIZCTEOSA-N 0 3 421.854 4.308 20 0 HIADHN Brc1ccc(C2(NCc3ccc(N4CCCC4)nc3)CCOCC2)cc1 ZINC000532328971 931398397 /nfs/dbraw/zinc/39/83/97/931398397.db2.gz BSUFIAQCYIXBDV-UHFFFAOYSA-N 0 3 416.363 4.240 20 0 HIADHN CC(C)Oc1ccc(CNCc2ccc(OCCN3CCOCC3)c(Cl)c2)cc1 ZINC000532348411 931404552 /nfs/dbraw/zinc/40/45/52/931404552.db2.gz UCXAZJOTNCGXOG-UHFFFAOYSA-N 0 3 418.965 4.128 20 0 HIADHN CCC(=O)N1CC[C@H](NCc2cc(Br)ccc2OCc2ccccc2)C1 ZINC000532393862 931420971 /nfs/dbraw/zinc/42/09/71/931420971.db2.gz HJEYYLAHCZBDIX-IBGZPJMESA-N 0 3 417.347 4.129 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@H](C)N[C@@H](C)c2ccc(OC)c(OC)c2)cc1 ZINC000532441193 931435700 /nfs/dbraw/zinc/43/57/00/931435700.db2.gz GYHUJDKZBZNMFT-IRXDYDNUSA-N 0 3 420.575 4.146 20 0 HIADHN COc1ccc(OC)c(NC(=O)C[C@H](C)NCc2ccc(F)cc2C(F)(F)F)c1 ZINC000532446393 931437442 /nfs/dbraw/zinc/43/74/42/931437442.db2.gz UIZZDLJSWNTVBH-LBPRGKRZSA-N 0 3 414.399 4.369 20 0 HIADHN C[C@H](NCc1ccc(OCC(F)(F)F)nc1)c1ccc(OCc2nccn2C)cc1 ZINC000532446288 931437841 /nfs/dbraw/zinc/43/78/41/931437841.db2.gz XVDOFRWTDXHODO-HNNXBMFYSA-N 0 3 420.435 4.186 20 0 HIADHN COc1cc([C@H](C)NCc2ccc3c(c2)nnn3C)ccc1OCc1ccccc1 ZINC000532477046 931453580 /nfs/dbraw/zinc/45/35/80/931453580.db2.gz KRQXZHKBLYJJSO-KRWDZBQOSA-N 0 3 402.498 4.407 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)N[C@H](C)c2ccc(S(C)(=O)=O)c(F)c2)cc1 ZINC000532519175 931472353 /nfs/dbraw/zinc/47/23/53/931472353.db2.gz MXCGBSXAWMZAFY-HUUCEWRRSA-N 0 3 401.507 4.135 20 0 HIADHN COc1ccc([C@@H](N[C@H](C)CCc2ccco2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000532531121 931512807 /nfs/dbraw/zinc/51/28/07/931512807.db2.gz OHUXYQNEKPSYKF-UZUQRXQVSA-N 0 3 413.539 4.392 20 0 HIADHN Cc1ccc2nc(CN[C@H](C)CC(=O)Nc3cccc(Br)c3)[nH]c2c1 ZINC000532531860 931513443 /nfs/dbraw/zinc/51/34/43/931513443.db2.gz WZJMWHKWFXNARL-CYBMUJFWSA-N 0 3 401.308 4.141 20 0 HIADHN COc1ccc(OC)c(NC(=O)C[C@H](C)NCc2cc(C)ccc2OC(F)F)c1 ZINC000532543536 931516787 /nfs/dbraw/zinc/51/67/87/931516787.db2.gz RUSLHIBWMPQNCD-AWEZNQCLSA-N 0 3 408.445 4.121 20 0 HIADHN CCN(CC(=O)NC[C@@H](c1c[nH]c2ccccc21)c1ccc(OC)cc1)C1CCC1 ZINC000532574920 931534913 /nfs/dbraw/zinc/53/49/13/931534913.db2.gz KTHVBGDVNUMVFE-JOCHJYFZSA-N 0 3 405.542 4.299 20 0 HIADHN O=C(CN1CCCCC[C@H]1c1ccco1)Nc1cccc(CN2CCSCC2)c1 ZINC000532586468 931544710 /nfs/dbraw/zinc/54/47/10/931544710.db2.gz WPESJXRUTPJKQB-NRFANRHFSA-N 0 3 413.587 4.384 20 0 HIADHN O[C@@H](COc1cccc(C(F)(F)F)c1)CN1CC=C(c2c[nH]c3ncccc23)CC1 ZINC000532641948 931564654 /nfs/dbraw/zinc/56/46/54/931564654.db2.gz OQXRMXVKFSFWQP-QGZVFWFLSA-N 0 3 417.431 4.111 20 0 HIADHN O=C(CCN1CCC([C@@H](O)C(F)(F)F)CC1)Nc1ccccc1-c1ccccc1 ZINC000532648239 931567418 /nfs/dbraw/zinc/56/74/18/931567418.db2.gz GQTAIUPFTMEGBU-OAQYLSRUSA-N 0 3 406.448 4.317 20 0 HIADHN COc1ccccc1NC(=O)c1ccc(NC(=O)CCN(C)CCC(F)(F)F)cc1 ZINC000532663361 931574929 /nfs/dbraw/zinc/57/49/29/931574929.db2.gz ZOPRXLZHRUINHJ-UHFFFAOYSA-N 0 3 423.435 4.160 20 0 HIADHN CCN(Cc1ccc(OC)c(OC)c1)C(=O)CN[C@H](c1ccc(F)cc1)C1CCC1 ZINC000532688596 931584975 /nfs/dbraw/zinc/58/49/75/931584975.db2.gz SZAINVGZPFDBOW-DEOSSOPVSA-N 0 3 414.521 4.322 20 0 HIADHN C[C@@H](N[C@H](c1ccc(F)cc1)C1CCC1)C(=O)Nc1cccc(N2CCCC2=O)c1 ZINC000532701530 931595494 /nfs/dbraw/zinc/59/54/94/931595494.db2.gz DPRKOTKBVDNWIC-MWTRTKDXSA-N 0 3 409.505 4.411 20 0 HIADHN Cc1ccc2nc(CN(Cc3cccc(Br)c3)C(C)C)cc(=O)n2c1 ZINC000532925707 931696976 /nfs/dbraw/zinc/69/69/76/931696976.db2.gz UEBFDFOTIKKOBU-UHFFFAOYSA-N 0 3 400.320 4.176 20 0 HIADHN CC(C)c1ccccc1OCC(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000532938961 931704558 /nfs/dbraw/zinc/70/45/58/931704558.db2.gz KFDZUZGLELOFRU-OAQYLSRUSA-N 0 3 418.541 4.471 20 0 HIADHN CN(C)C(=O)Nc1ccc(C(=O)N(CCN2CCCC2)c2ccccc2)c(Cl)c1 ZINC000532948972 931708981 /nfs/dbraw/zinc/70/89/81/931708981.db2.gz MLMKCIRABDCBST-UHFFFAOYSA-N 0 3 414.937 4.176 20 0 HIADHN CC(=O)c1ccc(NC(=O)CCN(C)CCc2ccc(Br)cc2)cc1 ZINC000532958718 931712654 /nfs/dbraw/zinc/71/26/54/931712654.db2.gz XISJDJNYTCDVOZ-UHFFFAOYSA-N 0 3 403.320 4.155 20 0 HIADHN COc1ccc(CN[C@@H](C)[C@@H](OC2CCOCC2)c2ccccc2)c(OC)c1OC ZINC000533007344 931733533 /nfs/dbraw/zinc/73/35/33/931733533.db2.gz MQCUJVNMTJSFED-HTAPYJJXSA-N 0 3 415.530 4.127 20 0 HIADHN C[C@@H](NCc1nc(-c2cc(Cl)ccc2Cl)cs1)[C@H](C)N1CCOCC1 ZINC000533149636 931787319 /nfs/dbraw/zinc/78/73/19/931787319.db2.gz FQEWIUOAHQARGJ-OLZOCXBDSA-N 0 3 400.375 4.316 20 0 HIADHN COc1ccc(NC(=O)[C@H](N[C@@H]2[C@@H]3CCO[C@H]3C23CCCC3)c2ccccc2)cc1 ZINC000533177153 931802560 /nfs/dbraw/zinc/80/25/60/931802560.db2.gz WSPMHXAQFCXHSA-WBADGQHESA-N 0 3 406.526 4.312 20 0 HIADHN Oc1ccc(Br)c(CNCCCc2nc(-c3ccncc3)cs2)c1 ZINC000533201256 931807592 /nfs/dbraw/zinc/80/75/92/931807592.db2.gz SVIYGPWDZSOKKR-UHFFFAOYSA-N 0 3 404.333 4.396 20 0 HIADHN O=C(NCCc1cc2ccccc2[nH]1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000533236067 931815767 /nfs/dbraw/zinc/81/57/67/931815767.db2.gz YDKPSVLEQYDION-QFIPXVFZSA-N 0 3 415.459 4.281 20 0 HIADHN C[C@@H](C1CC1)N(CC(=O)N1CCC(OCc2ccccc2)CC1)Cc1ccccc1 ZINC000533243995 931817359 /nfs/dbraw/zinc/81/73/59/931817359.db2.gz UWADPJLIVXNVMZ-NRFANRHFSA-N 0 3 406.570 4.495 20 0 HIADHN CCCN(Cc1nc(=O)c2c(C)c(C(=O)OC)sc2[nH]1)[C@H](CC)c1ccccc1 ZINC000533251242 931819115 /nfs/dbraw/zinc/81/91/15/931819115.db2.gz WSJHLXJILQMFBU-MRXNPFEDSA-N 0 3 413.543 4.443 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1NC(=O)[C@H](C)N1CCN(CC2CCCCC2)CC1 ZINC000533256200 931820932 /nfs/dbraw/zinc/82/09/32/931820932.db2.gz DNMSWPUXHOGTST-NRFANRHFSA-N 0 3 423.605 4.014 20 0 HIADHN CCc1cccc(OCC(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000533261116 931821678 /nfs/dbraw/zinc/82/16/78/931821678.db2.gz HTWUMWBDAWEYRK-JOCHJYFZSA-N 0 3 418.541 4.218 20 0 HIADHN COc1cc(OC)c(OC)cc1CN[C@H](C)[C@H](OC1CCOCC1)c1ccccc1 ZINC000533329423 931839727 /nfs/dbraw/zinc/83/97/27/931839727.db2.gz GYJLVDNSHSTXEP-OSPHWJPCSA-N 0 3 415.530 4.127 20 0 HIADHN O=C(Nc1ccc(F)cc1)C1CCN(C[C@@H](O)COc2ccc3ccccc3c2)CC1 ZINC000533364620 931849216 /nfs/dbraw/zinc/84/92/16/931849216.db2.gz TZICPLZAOPPHHO-HSZRJFAPSA-N 0 3 422.500 4.069 20 0 HIADHN COc1ccc(NC(C)=O)cc1NC(=O)[C@H](C)N[C@H](c1ccc(F)cc1)C1CCC1 ZINC000533368215 931850430 /nfs/dbraw/zinc/85/04/30/931850430.db2.gz WBSBCIHOTJXRGW-FPTDNZKUSA-N 0 3 413.493 4.251 20 0 HIADHN Cc1cc(N2CCCC2)ccc1NC(=O)CN1CCCN(Cc2ccccc2)C[C@@H]1C ZINC000533429656 931865492 /nfs/dbraw/zinc/86/54/92/931865492.db2.gz GEVHPORZIWJDEH-QFIPXVFZSA-N 0 3 420.601 4.130 20 0 HIADHN O[C@H](COc1c(Cl)cccc1Cl)CN1CC=C(c2c[nH]c3ncccc23)CC1 ZINC000533480693 931880014 /nfs/dbraw/zinc/88/00/14/931880014.db2.gz GIPDXKXXRSSZDD-HNNXBMFYSA-N 0 3 418.324 4.399 20 0 HIADHN CC[NH+](CC)CCN(Cc1cccs1)Cc1nc2c3ccccc3oc2c(=O)[n-]1 ZINC000533482490 931880556 /nfs/dbraw/zinc/88/05/56/931880556.db2.gz DYIFCASOSQGPKZ-UHFFFAOYSA-N 0 3 410.543 4.487 20 0 HIADHN COc1ccc([C@H]2CCCCCN2C(=O)CNC2(c3ccccc3)CCOCC2)cc1 ZINC000533517733 931891804 /nfs/dbraw/zinc/89/18/04/931891804.db2.gz FGVZTEYBCJLYIF-XMMPIXPASA-N 0 3 422.569 4.434 20 0 HIADHN COc1ccc2cc(CNCc3ccccc3CS(=O)(=O)N3CCCC3)ccc2c1 ZINC000533638438 931938591 /nfs/dbraw/zinc/93/85/91/931938591.db2.gz YAHCMFXWUCBTQG-UHFFFAOYSA-N 0 3 424.566 4.064 20 0 HIADHN CN1CC[C@H](NC(=O)c2cccc(CN3CCCC3)c2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000533682661 931968109 /nfs/dbraw/zinc/96/81/09/931968109.db2.gz KWDYLXYOKRWHNL-VXKWHMMOSA-N 0 3 415.940 4.250 20 0 HIADHN Cc1cc(Cl)cc(C)c1CNCc1ccccc1CS(=O)(=O)N1CCCC1 ZINC000533800191 932038236 /nfs/dbraw/zinc/03/82/36/932038236.db2.gz FDMZLOKGYVVMOC-UHFFFAOYSA-N 0 3 406.979 4.172 20 0 HIADHN CN(C)Cc1cccc(NC(=O)C(=O)NCC(C)(C)c2ccc(C(C)(C)C)cc2)c1 ZINC000533823226 932045942 /nfs/dbraw/zinc/04/59/42/932045942.db2.gz HPPSQKWPQJLBOW-UHFFFAOYSA-N 0 3 409.574 4.078 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccc(O)cc1)C(=O)c1cnc2onc(C(C)C)c2c1 ZINC000533830577 932049658 /nfs/dbraw/zinc/04/96/58/932049658.db2.gz GXEMBKAIIMVBGK-LJQANCHMSA-N 0 3 422.529 4.179 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)c2c[nH]c3cccc(Br)c23)o1 ZINC000533870943 932072616 /nfs/dbraw/zinc/07/26/16/932072616.db2.gz ONERGECJFKULIM-UHFFFAOYSA-N 0 3 404.308 4.036 20 0 HIADHN CN1CC[C@H](NC(=O)N2CCO[C@@H](c3ccc(F)c(Cl)c3)C2)[C@H]1c1ccccc1 ZINC000533948762 932122380 /nfs/dbraw/zinc/12/23/80/932122380.db2.gz IXEDDUDFPLAVTR-PWRODBHTSA-N 0 3 417.912 4.007 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)CCCCCNC(=O)NC2CCCCC2)c1 ZINC000533968574 932145305 /nfs/dbraw/zinc/14/53/05/932145305.db2.gz BURSSXYXEAJHHS-UHFFFAOYSA-N 0 3 402.583 4.187 20 0 HIADHN Cc1cc(C(=O)NCCN(C)Cc2ccccc2)ccc1NC(=O)c1cccs1 ZINC000534001401 932184176 /nfs/dbraw/zinc/18/41/76/932184176.db2.gz YCEXQEBHJQSYMZ-UHFFFAOYSA-N 0 3 407.539 4.171 20 0 HIADHN CN1CC[C@@H](NC(=O)Cc2c[nH]c3cc(Br)ccc23)[C@H]1c1ccccc1 ZINC000534017743 932199608 /nfs/dbraw/zinc/19/96/08/932199608.db2.gz CORXPLOCXNRZSQ-WIYYLYMNSA-N 0 3 412.331 4.035 20 0 HIADHN Clc1cc(Br)cc2c1CC[C@H]2NCc1cccc(-n2cncn2)c1 ZINC000534058567 932236013 /nfs/dbraw/zinc/23/60/13/932236013.db2.gz DVTYSEQCYBRNTN-GOSISDBHSA-N 0 3 403.711 4.460 20 0 HIADHN CC[C@H](C)n1ncc(C(=O)NCC2(N3CCSCC3)CCCCC2)c1C1CC1 ZINC000534068536 932246803 /nfs/dbraw/zinc/24/68/03/932246803.db2.gz MVSFBFFZVVCZSQ-KRWDZBQOSA-N 0 3 404.624 4.213 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N2CCCC[C@H]2CCc2ccccc2)CC1 ZINC000534073371 932251752 /nfs/dbraw/zinc/25/17/52/932251752.db2.gz WZAYYZQTWVTOOM-QHCPKHFHSA-N 0 3 401.595 4.073 20 0 HIADHN CS[C@H]1CN(C(=O)c2c(C)onc2-c2c(Cl)cccc2Cl)C[C@@H]1N(C)C ZINC000534094878 932275015 /nfs/dbraw/zinc/27/50/15/932275015.db2.gz HORMNLCHXXIQCH-KBPBESRZSA-N 0 3 414.358 4.074 20 0 HIADHN CC[C@H](C)n1ncc(C(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)c1C1CC1 ZINC000534112837 932285425 /nfs/dbraw/zinc/28/54/25/932285425.db2.gz AHLMFRKYYJLFSE-IPMKNSEASA-N 0 3 416.610 4.083 20 0 HIADHN CC[C@H](C)n1ncc(C(=O)Nc2cccc(CN3CCC(CO)CC3)c2)c1C1CC1 ZINC000534148222 932302202 /nfs/dbraw/zinc/30/22/02/932302202.db2.gz ZFJPXOXOJPUKMD-KRWDZBQOSA-N 0 3 410.562 4.188 20 0 HIADHN Cc1cc(-c2ccccc2)ccc1NC(=O)N1CC[C@H](N2CCN(C)CC2)[C@H](C)C1 ZINC000534266144 932372237 /nfs/dbraw/zinc/37/22/37/932372237.db2.gz JZZVMQZMMVDZLH-YKSBVNFPSA-N 0 3 406.574 4.152 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)[C@@H]2CC(=O)N(C)[C@@H]2c2ccc(Cl)c(F)c2)c1 ZINC000534285262 932375336 /nfs/dbraw/zinc/37/53/36/932375336.db2.gz ILVQJZXHBANBBZ-DYESRHJHSA-N 0 3 417.912 4.007 20 0 HIADHN CCOc1c(Br)cc(Br)cc1CN(C)C1CCOCC1 ZINC000534344643 932387349 /nfs/dbraw/zinc/38/73/49/932387349.db2.gz OVFOHCNWWPSNLW-UHFFFAOYSA-N 0 3 407.146 4.221 20 0 HIADHN CC(C)C1CCC(N2CCN(C(=O)N[C@@H](C)c3ccc([S@@](C)=O)cc3)CC2)CC1 ZINC000534442505 932457116 /nfs/dbraw/zinc/45/71/16/932457116.db2.gz OJBQNZRTYAWREM-AUBIAEGNSA-N 0 3 419.635 4.027 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N2CCC[C@H]2Cn2cnc3ccccc32)C1 ZINC000534449885 932464955 /nfs/dbraw/zinc/46/49/55/932464955.db2.gz SSJMGSRFTIPGAU-HJNYFJLDSA-N 0 3 417.557 4.046 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@@H](C)NCc2cnc([C@@H]3CCCO3)s2)CC1 ZINC000534465471 932483704 /nfs/dbraw/zinc/48/37/04/932483704.db2.gz OQVFHOWNBVWWNH-IERDGZPVSA-N 0 3 418.582 4.126 20 0 HIADHN COc1cc([C@H](C)NC(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)ccc1OC(C)C ZINC000534611540 932595283 /nfs/dbraw/zinc/59/52/83/932595283.db2.gz VUEINKYTSQQOIK-XTQVGHSUSA-N 0 3 411.546 4.288 20 0 HIADHN COc1cc([C@H](C)NC(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)ccc1OC(C)C ZINC000534611537 932595325 /nfs/dbraw/zinc/59/53/25/932595325.db2.gz VUEINKYTSQQOIK-KPDCDPCYSA-N 0 3 411.546 4.288 20 0 HIADHN Cc1ccc(CNC(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)c(OCC(F)(F)F)c1 ZINC000534642497 932615451 /nfs/dbraw/zinc/61/54/51/932615451.db2.gz KRDWCVLYSUGBPR-UYAOXDASSA-N 0 3 421.463 4.181 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)COc2ccc(C(=O)c3ccccc3)cc2)c1 ZINC000534706038 932677651 /nfs/dbraw/zinc/67/76/51/932677651.db2.gz QJZQXVBWDILJFM-UHFFFAOYSA-N 0 3 402.494 4.305 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)C2CCN(c3ccc(C(F)(F)F)cn3)CC2)c1 ZINC000534708221 932678916 /nfs/dbraw/zinc/67/89/16/932678916.db2.gz DJXYTSLYVPPWCN-UHFFFAOYSA-N 0 3 420.479 4.326 20 0 HIADHN COc1ccc(CN(C(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)[C@@H](C)C2CC2)cc1 ZINC000534719573 932686900 /nfs/dbraw/zinc/68/69/00/932686900.db2.gz AEQFBVGJXVSWCY-GLYQVZKVSA-N 0 3 407.558 4.451 20 0 HIADHN CN1CC[C@@H](NC(=O)NC2(c3ccc(Br)cc3)CC2)[C@H]1c1ccccc1 ZINC000534719697 932687157 /nfs/dbraw/zinc/68/71/57/932687157.db2.gz CHKLYEILACEXCK-RTBURBONSA-N 0 3 414.347 4.183 20 0 HIADHN CN1CC[C@@H](NC(=O)CCCc2ccccc2Br)[C@@H]1c1ccccc1 ZINC000534756163 932733805 /nfs/dbraw/zinc/73/38/05/932733805.db2.gz PDPRHZBGSPPFKG-CTNGQTDRSA-N 0 3 401.348 4.333 20 0 HIADHN Cc1ccc(OCc2nc(CC(=O)N[C@H]3CCN(C)[C@H]3c3ccccc3)cs2)cc1 ZINC000534756006 932734491 /nfs/dbraw/zinc/73/44/91/932734491.db2.gz GZQLKAUGXUJCBS-URXFXBBRSA-N 0 3 421.566 4.135 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1cc2c(cc1Cl)OCO2 ZINC000534759639 932737872 /nfs/dbraw/zinc/73/78/72/932737872.db2.gz BMZUYGYYBOHMEH-HNNXBMFYSA-N 0 3 401.894 4.197 20 0 HIADHN Fc1ccc(Br)c2c1CC[C@H]2NC1CCN(Cc2ccccn2)CC1 ZINC000534793229 932773747 /nfs/dbraw/zinc/77/37/47/932773747.db2.gz IOBPCDYKOVFAFB-LJQANCHMSA-N 0 3 404.327 4.225 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)C1(c2ccc(F)cc2F)CCCC1 ZINC000534883310 932821654 /nfs/dbraw/zinc/82/16/54/932821654.db2.gz IJODWIRYESOVEZ-UHFFFAOYSA-N 0 3 414.496 4.372 20 0 HIADHN CN(CCC(=O)Nc1ccc(N2CCCC2=O)cc1)Cc1ccc(Cl)c(F)c1 ZINC000534965567 932864792 /nfs/dbraw/zinc/86/47/92/932864792.db2.gz ZHQHPQJKWQTLGT-UHFFFAOYSA-N 0 3 403.885 4.067 20 0 HIADHN CCOc1ccc(C2=CCN(C(=O)[C@@H]3CCCN(Cc4cccnc4)C3)CC2)cc1 ZINC000535072991 932897662 /nfs/dbraw/zinc/89/76/62/932897662.db2.gz KPQZMLWVDCOPTG-HSZRJFAPSA-N 0 3 405.542 4.008 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)c2cc(-c3ccccn3)ccc2Cl)C[C@H](C)O1 ZINC000535096612 932912960 /nfs/dbraw/zinc/91/29/60/932912960.db2.gz VJMYNZLUBDAFJG-CALCHBBNSA-N 0 3 401.938 4.021 20 0 HIADHN COc1ccc(C(=O)NC[C@H]2CCCN2Cc2ccccc2)cc1-c1ccccn1 ZINC000535098746 932915001 /nfs/dbraw/zinc/91/50/01/932915001.db2.gz FULFCWABCZEOQC-OAQYLSRUSA-N 0 3 401.510 4.152 20 0 HIADHN C[C@@H](Cc1cccc(Cl)c1)C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000535135253 932954511 /nfs/dbraw/zinc/95/45/11/932954511.db2.gz UOJPRYALQARLEO-KRWDZBQOSA-N 0 3 418.940 4.317 20 0 HIADHN COc1ccc([C@H](CNCc2cnc([C@@H]3CCCO3)s2)N2CCCCC2)cc1 ZINC000535140863 932959418 /nfs/dbraw/zinc/95/94/18/932959418.db2.gz FHOHWVQTAYIKQU-SFTDATJTSA-N 0 3 401.576 4.320 20 0 HIADHN COc1ccc([C@@H](CNCc2cnc([C@H]3CCCO3)s2)N2CCCCC2)cc1 ZINC000535140861 932959705 /nfs/dbraw/zinc/95/97/05/932959705.db2.gz FHOHWVQTAYIKQU-NHCUHLMSSA-N 0 3 401.576 4.320 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3ccn(-c4ccc(Cl)cc4)n3)c(C)c2)CC1 ZINC000535235410 933032686 /nfs/dbraw/zinc/03/26/86/933032686.db2.gz ZUSJDXPZXIYDCS-UHFFFAOYSA-N 0 3 423.948 4.228 20 0 HIADHN CN(C)[C@H](CNC(=O)N(CCc1ccccc1)Cc1ccncc1)Cc1ccccc1 ZINC000535256460 933039689 /nfs/dbraw/zinc/03/96/89/933039689.db2.gz BHYIBFSFYSOESK-VWLOTQADSA-N 0 3 416.569 4.009 20 0 HIADHN CN(C)[C@H](CNc1cnn(-c2ccc(Cl)cc2)c(=O)c1Cl)Cc1ccccc1 ZINC000535257026 933039922 /nfs/dbraw/zinc/03/99/22/933039922.db2.gz HUKCJHVIYYZBEP-SFHVURJKSA-N 0 3 417.340 4.124 20 0 HIADHN Cc1nn(Cc2ccccc2Cl)c(C)c1C(=O)NC[C@H](Cc1ccccc1)N(C)C ZINC000535258212 933039968 /nfs/dbraw/zinc/03/99/68/933039968.db2.gz XXCHJPGYHAEOMJ-NRFANRHFSA-N 0 3 424.976 4.104 20 0 HIADHN CC(C)Cn1ncc(C(=O)NC[C@H]2CCCN(C)[C@H]2c2cccs2)c1C(F)F ZINC000535388210 933108657 /nfs/dbraw/zinc/10/86/57/933108657.db2.gz LLOKFOKFECLTIH-RHSMWYFYSA-N 0 3 410.534 4.351 20 0 HIADHN CN(CCCc1cc(-c2ccccc2)n[nH]1)C(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000535396941 933114549 /nfs/dbraw/zinc/11/45/49/933114549.db2.gz RQGOSYHWSAHJBI-VWNXMTODSA-N 0 3 417.557 4.096 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)CSc2nnc(-c3ccc(Cl)cc3)o2)c1 ZINC000535421392 933127579 /nfs/dbraw/zinc/12/75/79/933127579.db2.gz IRIFZJCLTYSYCZ-UHFFFAOYSA-N 0 3 416.934 4.491 20 0 HIADHN CN1CC[C@@H](NC(=O)NCc2ccc(Oc3ccccc3)nc2)[C@H]1c1ccccc1 ZINC000535438881 933135823 /nfs/dbraw/zinc/13/58/23/933135823.db2.gz XSVYIOIVBUDBBE-FYYLOGMGSA-N 0 3 402.498 4.119 20 0 HIADHN CN1CC[C@@H](NC(=O)c2cccc(NC(=O)c3ccc(F)cc3)c2)[C@H]1c1ccccc1 ZINC000535467044 933156130 /nfs/dbraw/zinc/15/61/30/933156130.db2.gz APKLOPMXHFUUAK-DHIUTWEWSA-N 0 3 417.484 4.253 20 0 HIADHN CN1CC[C@@H](NC(=O)CCCOc2ccccc2Br)[C@H]1c1ccccc1 ZINC000535466990 933156460 /nfs/dbraw/zinc/15/64/60/933156460.db2.gz AOVGPRIEPBIEKK-WIYYLYMNSA-N 0 3 417.347 4.170 20 0 HIADHN CN1CC[C@@H](NC(=O)CCc2ncc(-c3ccc(F)cc3F)o2)[C@H]1c1ccccc1 ZINC000535468032 933157926 /nfs/dbraw/zinc/15/79/26/933157926.db2.gz GXPROADWYIYFMX-AUSIDOKSSA-N 0 3 411.452 4.114 20 0 HIADHN CCOc1ccc(F)c(NC(=O)NC[C@H](CC)N2CCc3ccccc3C2)c1F ZINC000535494637 933182566 /nfs/dbraw/zinc/18/25/66/933182566.db2.gz VORGKHQULVGRDR-KRWDZBQOSA-N 0 3 403.473 4.322 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)c2cc(N3CCCC3=O)ccc2Cl)C1 ZINC000535527088 933216959 /nfs/dbraw/zinc/21/69/59/933216959.db2.gz ADOABOYEFDMYQZ-WMZOPIPTSA-N 0 3 411.933 4.032 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)[C@H](C)c2cccc(C(=O)c3ccccc3)c2)CC1 ZINC000535598268 933261531 /nfs/dbraw/zinc/26/15/31/933261531.db2.gz LMAYOHCELDJRGI-HXUWFJFHSA-N 0 3 422.569 4.027 20 0 HIADHN CC(C)Cn1cc(NC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)c(C(F)F)n1 ZINC000535663548 933307973 /nfs/dbraw/zinc/30/79/73/933307973.db2.gz FXASYKJXGPDZHJ-INIZCTEOSA-N 0 3 408.468 4.467 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)N1CCC[C@H]1Cn1cnc2ccccc21 ZINC000535936577 933504044 /nfs/dbraw/zinc/50/40/44/933504044.db2.gz NTSWWKMYJUFHRR-GMAHTHKFSA-N 0 3 417.557 4.047 20 0 HIADHN Clc1ccc(-n2cc(CN[C@@H]3CCOC4(CCSCC4)C3)nn2)c(Cl)c1 ZINC000535941986 933508885 /nfs/dbraw/zinc/50/88/85/933508885.db2.gz DLQGGNWRGUMEJA-CQSZACIVSA-N 0 3 413.374 4.109 20 0 HIADHN Cc1nn(C(C)(C)C)c(C)c1CNCCOc1ncc(C(F)(F)F)cc1Cl ZINC000535942718 933510346 /nfs/dbraw/zinc/51/03/46/933510346.db2.gz HVQWAALQUUQXRP-UHFFFAOYSA-N 0 3 404.864 4.491 20 0 HIADHN C[C@H](NCC1=Cc2cc(Br)ccc2OC1)c1ccc([S@@](C)=O)cc1 ZINC000535946633 933512488 /nfs/dbraw/zinc/51/24/88/933512488.db2.gz RFKREYNTLJVUGV-RKNYENMMSA-N 0 3 406.345 4.313 20 0 HIADHN Cc1cccc(CN(Cc2ccco2)C(=O)NC[C@H](Cc2ccccc2)N(C)C)c1 ZINC000536014445 933571667 /nfs/dbraw/zinc/57/16/67/933571667.db2.gz UAMMBQNGEQPDJA-QHCPKHFHSA-N 0 3 405.542 4.473 20 0 HIADHN CN1CCC[C@@H](CNC(=O)c2ccn(-c3ccc(Cl)cc3)n2)[C@H]1c1cccs1 ZINC000536046584 933593315 /nfs/dbraw/zinc/59/33/15/933593315.db2.gz XEPPUWJNQXWXOE-YWZLYKJASA-N 0 3 414.962 4.400 20 0 HIADHN Cc1ccc(-c2nc(C(=O)NC[C@H]3CCCN(Cc4cccs4)C3)cs2)n1C ZINC000536132256 933679663 /nfs/dbraw/zinc/67/96/63/933679663.db2.gz SNIFNMQKSQUXJI-MRXNPFEDSA-N 0 3 414.600 4.161 20 0 HIADHN CCN1CC[C@@H](NCc2c(C)nc3sc(C)nn23)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000537353163 933731956 /nfs/dbraw/zinc/73/19/56/933731956.db2.gz ZXODFMFWNFWNAC-AEFFLSMTSA-N 0 3 407.946 4.125 20 0 HIADHN CCN1CCN(Cc2ccc(N[C@H](C)c3ccc(NC(=O)NC4CC4)cc3)cc2)CC1 ZINC000537393328 933755027 /nfs/dbraw/zinc/75/50/27/933755027.db2.gz BIKHAHFLDHMEPG-LJQANCHMSA-N 0 3 421.589 4.281 20 0 HIADHN O=C1[C@H](NCc2cccc3cc[nH]c32)CCCN1Cc1cccc(C(F)(F)F)c1 ZINC000537435374 933773888 /nfs/dbraw/zinc/77/38/88/933773888.db2.gz VJYBWOWWMHOPHX-LJQANCHMSA-N 0 3 401.432 4.468 20 0 HIADHN CC(C)CN(CC(C)C)C(=O)CNC1(c2cccc(C(F)(F)F)c2)CCOCC1 ZINC000562594011 945105929 /nfs/dbraw/zinc/10/59/29/945105929.db2.gz DLMILQPLCZCIHX-UHFFFAOYSA-N 0 3 414.512 4.441 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)c2ccnc(Oc3ccccc3)c2)c1 ZINC000562920747 945153293 /nfs/dbraw/zinc/15/32/93/945153293.db2.gz HAKAUNJZJOFPDD-UHFFFAOYSA-N 0 3 405.498 4.087 20 0 HIADHN CN1CCN(Cc2ncc(Br)cc2Br)c2ccccc2C1 ZINC000563241198 945159844 /nfs/dbraw/zinc/15/98/44/945159844.db2.gz YHRILKJVOPNIQP-UHFFFAOYSA-N 0 3 411.141 4.059 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3ccc(-c4ncco4)cc3)c(C)c2)CC1 ZINC000537515476 938314531 /nfs/dbraw/zinc/31/45/31/938314531.db2.gz OLRQHIUJKDGXIG-UHFFFAOYSA-N 0 3 405.502 4.436 20 0 HIADHN CCNC(=O)[C@@H](C)N[C@H]1CCCc2nc(-c3ccc(Br)cc3)sc21 ZINC000537520719 938315392 /nfs/dbraw/zinc/31/53/92/938315392.db2.gz CNJWIDUGRNOWLJ-RISCZKNCSA-N 0 3 408.365 4.064 20 0 HIADHN Cc1ccc(C2=NN(C(=O)CN3CCC[C@H]3C3CCOCC3)[C@H](c3ccco3)C2)cc1 ZINC000537524667 938315834 /nfs/dbraw/zinc/31/58/34/938315834.db2.gz WTSWRINEITYQRJ-GOTSBHOMSA-N 0 3 421.541 4.157 20 0 HIADHN Cc1nn(C)c(N2CCOCC2)c1CN1C[C@H](C)C[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000537620862 938335971 /nfs/dbraw/zinc/33/59/71/938335971.db2.gz YWPHFWCQZUCOBN-QRWLVFNGSA-N 0 3 422.495 4.167 20 0 HIADHN COCC1(O)CCN(Cc2cn(-c3ccccc3)nc2-c2cc3ccccc3o2)CC1 ZINC000537624211 938337758 /nfs/dbraw/zinc/33/77/58/938337758.db2.gz SUZGVTUDBSFCKI-UHFFFAOYSA-N 0 3 417.509 4.259 20 0 HIADHN Cc1cccc(-c2n[nH]cc2CN2CCC(n3cc(Br)cn3)CC2)c1 ZINC000537627369 938339427 /nfs/dbraw/zinc/33/94/27/938339427.db2.gz UHVLUUYWMCBSMR-UHFFFAOYSA-N 0 3 400.324 4.181 20 0 HIADHN CC(C)(C)OC(=O)[C@H]1CCN(Cc2cn(-c3ccccc3)nc2-c2cccnc2)C1 ZINC000537650458 938346938 /nfs/dbraw/zinc/34/69/38/938346938.db2.gz GDYAHMSFLUZQMW-IBGZPJMESA-N 0 3 404.514 4.098 20 0 HIADHN COc1cc(CNCc2cn(C)nc2-c2cccs2)cc(Br)c1OC ZINC000537653986 938347704 /nfs/dbraw/zinc/34/77/04/938347704.db2.gz LLGYWMRCZVJIDM-UHFFFAOYSA-N 0 3 422.348 4.218 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)NCc3cc(Cl)sc3Cl)CC2)C[C@H](C)O1 ZINC000537765387 938372531 /nfs/dbraw/zinc/37/25/31/938372531.db2.gz OKGGYWXXKCGCPF-STQMWFEESA-N 0 3 420.406 4.086 20 0 HIADHN CC(C)(C)OC(=O)c1ccc(CN2CCC3(C[C@@H]3C(=O)N3CCCCC3)CC2)cc1 ZINC000537802775 938379930 /nfs/dbraw/zinc/37/99/30/938379930.db2.gz PHCTYQUQSXOLOX-OAQYLSRUSA-N 0 3 412.574 4.257 20 0 HIADHN COc1ccc([C@@H](OC)[C@H](C)[NH2+]Cc2cc(Br)c([O-])c(OC)c2)cc1 ZINC000537864332 938394037 /nfs/dbraw/zinc/39/40/37/938394037.db2.gz WBVIUSPNCMUTRM-BUXKBTBVSA-N 0 3 410.308 4.038 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)N[C@H](c2ccccc2)[C@@H]2CCOC2)CC1 ZINC000537895077 938402958 /nfs/dbraw/zinc/40/29/58/938402958.db2.gz SFNLYDPGMQEXML-ISKFKSNPSA-N 0 3 407.558 4.070 20 0 HIADHN Cc1nn(C)c(C)c1NC(=O)N(CCN(C)Cc1ccccc1)Cc1ccccc1 ZINC000537935370 938421915 /nfs/dbraw/zinc/42/19/15/938421915.db2.gz LRUUOIIIPFCYBM-UHFFFAOYSA-N 0 3 405.546 4.203 20 0 HIADHN C[C@@H](N[C@H]1CCc2cc(F)ccc21)c1ccc(S(=O)(=O)NCc2ccco2)cc1 ZINC000537937426 938422852 /nfs/dbraw/zinc/42/28/52/938422852.db2.gz KMONHKAIQQQCLM-QRQCRPRQSA-N 0 3 414.502 4.235 20 0 HIADHN COc1ccc([C@@H](C)N[C@@H](C)c2ccc(-n3ccnn3)cc2)cc1Br ZINC000537937969 938423261 /nfs/dbraw/zinc/42/32/61/938423261.db2.gz HDVCRWQQKPWVTD-UONOGXRCSA-N 0 3 401.308 4.450 20 0 HIADHN COc1ccc([C@H](C)N[C@H](C)c2ccc(-n3ccnn3)cc2)cc1Br ZINC000537937968 938423640 /nfs/dbraw/zinc/42/36/40/938423640.db2.gz HDVCRWQQKPWVTD-KGLIPLIRSA-N 0 3 401.308 4.450 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)N[C@H](CO)c2ccc(Br)cc2)cc1 ZINC000537941550 938425636 /nfs/dbraw/zinc/42/56/36/938425636.db2.gz VCLSPADKFDDTCK-VBKZILBWSA-N 0 3 400.320 4.327 20 0 HIADHN COc1cc([C@@H](C)NCc2n[nH]c(-c3ccc(Br)cc3)n2)ccc1F ZINC000537946698 938428005 /nfs/dbraw/zinc/42/80/05/938428005.db2.gz QGMHZAACIXQHJL-LLVKDONJSA-N 0 3 405.271 4.233 20 0 HIADHN COc1cc([C@@H](C)NCc2nc(-c3ccc(Br)cc3)n[nH]2)ccc1F ZINC000537946698 938428011 /nfs/dbraw/zinc/42/80/11/938428011.db2.gz QGMHZAACIXQHJL-LLVKDONJSA-N 0 3 405.271 4.233 20 0 HIADHN Cc1c([C@H](C)NC2CCC(C(=O)OC(C)(C)C)CC2)nnn1-c1ccc(F)cc1 ZINC000537950689 938429419 /nfs/dbraw/zinc/42/94/19/938429419.db2.gz IOCOAKVSBBVXAZ-NXVRBGIVSA-N 0 3 402.514 4.266 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(S(C)(=O)=O)cc1)[C@H](OC1CCOCC1)c1ccccc1 ZINC000537949210 938429503 /nfs/dbraw/zinc/42/95/03/938429503.db2.gz WSKAZRARSGOLKM-IXFSTUDKSA-N 0 3 417.571 4.066 20 0 HIADHN COc1ccc([C@@H](C)NC(=O)NC[C@H](c2cccs2)N2CCCC2)c(C)c1OC ZINC000563308163 945174198 /nfs/dbraw/zinc/17/41/98/945174198.db2.gz PWQLORZVUULPDB-SJLPKXTDSA-N 0 3 417.575 4.271 20 0 HIADHN COc1ccc(OC)c(NC(=O)C[C@H](C)N[C@@H]2CC(C)(C)Oc3cc(F)ccc32)c1 ZINC000537961377 938435583 /nfs/dbraw/zinc/43/55/83/938435583.db2.gz IMPDNHBPQQFSGM-IFXJQAMLSA-N 0 3 416.493 4.452 20 0 HIADHN Cc1nc2c(s1)[C@@H](NCc1ccc(Br)cc1N1CCOCC1)CCC2 ZINC000537960798 938435627 /nfs/dbraw/zinc/43/56/27/938435627.db2.gz JVXOMFRNHMAPLS-INIZCTEOSA-N 0 3 422.392 4.218 20 0 HIADHN COc1ccc(OC)c(NC(=O)C[C@H](C)N[C@H]2CC(C)(C)Oc3cc(F)ccc32)c1 ZINC000537961379 938435680 /nfs/dbraw/zinc/43/56/80/938435680.db2.gz IMPDNHBPQQFSGM-LIRRHRJNSA-N 0 3 416.493 4.452 20 0 HIADHN C[C@H](CC(=O)Nc1ccc(Br)cc1)NCc1cccc2c1OCCCO2 ZINC000537964225 938436940 /nfs/dbraw/zinc/43/69/40/938436940.db2.gz JVJRGHJBCZGENQ-CQSZACIVSA-N 0 3 419.319 4.117 20 0 HIADHN Fc1ccc2c(c1)[C@@H](NCc1ccc(Br)cc1N1CCOCC1)CC2 ZINC000537964680 938437325 /nfs/dbraw/zinc/43/73/25/938437325.db2.gz ZNNQFRRSNWIVFK-IBGZPJMESA-N 0 3 405.311 4.202 20 0 HIADHN COc1cc([C@H](C)N[C@H]2CC(=O)N(c3ccccc3Cl)C2)ccc1OC(F)F ZINC000537976484 938444527 /nfs/dbraw/zinc/44/45/27/938444527.db2.gz YTOMQFCHSFHBLL-JSGCOSHPSA-N 0 3 410.848 4.406 20 0 HIADHN COc1cc([C@H](C)N[C@@H]2CC(=O)N(c3ccccc3Cl)C2)ccc1OC(F)F ZINC000537976483 938444585 /nfs/dbraw/zinc/44/45/85/938444585.db2.gz YTOMQFCHSFHBLL-GXTWGEPZSA-N 0 3 410.848 4.406 20 0 HIADHN COc1ccc(OC)c(NC(=O)C[C@H](C)N[C@@H]2CCCOc3ccc(F)cc32)c1 ZINC000537989817 938451509 /nfs/dbraw/zinc/45/15/09/938451509.db2.gz HCKKQFCXHWBWOH-KBXCAEBGSA-N 0 3 402.466 4.064 20 0 HIADHN COc1ccc(C(=O)NCCN[C@H](C)c2sc(Cc3ccccc3)nc2C)cc1 ZINC000537989428 938451744 /nfs/dbraw/zinc/45/17/44/938451744.db2.gz BUOBBXHHECLMKV-MRXNPFEDSA-N 0 3 409.555 4.132 20 0 HIADHN Cn1cc(CN[C@H]2CC(=O)N(c3cccc(C(F)(F)F)c3)C2)c(-c2cccs2)n1 ZINC000538000589 938457361 /nfs/dbraw/zinc/45/73/61/938457361.db2.gz OTWNFMJXQZFSIB-HNNXBMFYSA-N 0 3 420.460 4.063 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(N3CCC(CC[N@@H+](CC)CC(C)C)CC3)nc2)n1 ZINC000538004082 938458664 /nfs/dbraw/zinc/45/86/64/938458664.db2.gz HZTRRTGLSGIZLV-UHFFFAOYSA-N 0 3 411.594 4.391 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(N3CCC(CC[N@H+](CC)CC(C)C)CC3)nc2)n1 ZINC000538004082 938458667 /nfs/dbraw/zinc/45/86/67/938458667.db2.gz HZTRRTGLSGIZLV-UHFFFAOYSA-N 0 3 411.594 4.391 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)N(C)Cc1cccc(F)c1)c1ccc(OCc2cccnc2)cc1 ZINC000538123745 938509963 /nfs/dbraw/zinc/50/99/63/938509963.db2.gz AZAPTSQPFZMBHQ-MOPGFXCFSA-N 0 3 421.516 4.497 20 0 HIADHN CC[C@@H](N[C@H](C)C(=O)N(C)Cc1ccc(OC)c(OC)c1)c1ccc(Cl)cc1 ZINC000538129048 938514221 /nfs/dbraw/zinc/51/42/21/938514221.db2.gz DABKHVXRWDCDSU-DNVCBOLYSA-N 0 3 404.938 4.445 20 0 HIADHN Cc1ccc(OC[C@H](O)CN[C@@H](C)c2cccc(NC(=O)c3ccccc3)c2)cc1 ZINC000538128963 938514371 /nfs/dbraw/zinc/51/43/71/938514371.db2.gz VZSDQGYHWNGGIN-WMZHIEFXSA-N 0 3 404.510 4.338 20 0 HIADHN Cc1nnnn1-c1ccc(F)c(NC(=O)CN[C@H](c2ccc(C(C)C)cc2)C(C)C)c1 ZINC000538139968 938517242 /nfs/dbraw/zinc/51/72/42/938517242.db2.gz IEPPRQGAFRZTGZ-QHCPKHFHSA-N 0 3 424.524 4.159 20 0 HIADHN CCC(CC)[C@H](NCC(=O)NCC(=O)Nc1c(C)cc(C)cc1C)c1cccs1 ZINC000538177632 938539555 /nfs/dbraw/zinc/53/95/55/938539555.db2.gz ZKPGFTIJGWPFCA-QHCPKHFHSA-N 0 3 415.603 4.495 20 0 HIADHN C[C@@H](N[C@H](C)c1cccc(-n2cccn2)c1)C(=O)Nc1nc2ccc(F)cc2s1 ZINC000538187061 938543214 /nfs/dbraw/zinc/54/32/14/938543214.db2.gz FYBPBUCZSZTEDS-ZIAGYGMSSA-N 0 3 409.490 4.299 20 0 HIADHN COc1cc2c(cc1OC)CN(C(=O)CN[C@H](c1cccc(F)c1)C(C)(C)C)CC2 ZINC000538225212 938564154 /nfs/dbraw/zinc/56/41/54/938564154.db2.gz QFJKGXYZHMLXFT-HSZRJFAPSA-N 0 3 414.521 4.105 20 0 HIADHN C[C@@H](NCC(=O)N1CCc2[nH]c3ccccc3c2C1)c1ccc(-c2ccncc2)cc1 ZINC000538237136 938569750 /nfs/dbraw/zinc/56/97/50/938569750.db2.gz JZNJEBNNMVYPKU-GOSISDBHSA-N 0 3 410.521 4.465 20 0 HIADHN CCc1ccc(C(C)(C)NCC(=O)N2CCC[C@@H]2c2ccc(OC)c(OC)c2)cc1 ZINC000538258182 938576620 /nfs/dbraw/zinc/57/66/20/938576620.db2.gz VOPJZNHWKLGTRZ-OAQYLSRUSA-N 0 3 410.558 4.455 20 0 HIADHN C[C@H](NCC(=O)N1CCC(Cc2ccccc2)CC1)c1cccc(N2CCCC2)c1 ZINC000538279342 938582042 /nfs/dbraw/zinc/58/20/42/938582042.db2.gz KWILYLLJKUSUAB-NRFANRHFSA-N 0 3 405.586 4.419 20 0 HIADHN Cc1cc(NC(=O)CN[C@H](C)c2cccc(N3CCCC3)c2)n(-c2ccc(F)cc2)n1 ZINC000538280812 938582417 /nfs/dbraw/zinc/58/24/17/938582417.db2.gz YYKONUCDVYBTGY-GOSISDBHSA-N 0 3 421.520 4.209 20 0 HIADHN COc1ccc(CN(C(=O)CN[C@H](C)c2cccc(N3CCCC3)c2)C2CC2)cc1 ZINC000538280624 938582516 /nfs/dbraw/zinc/58/25/16/938582516.db2.gz VJWLXBGBMKMRED-LJQANCHMSA-N 0 3 407.558 4.137 20 0 HIADHN COc1ccc(CCNC(=O)CN[C@H](c2ccc(Cl)cc2)[C@@H]2C[C@@H]2C)cc1OC ZINC000538324634 938593066 /nfs/dbraw/zinc/59/30/66/938593066.db2.gz BCHWAQNBLHBQCV-FCORRRHLSA-N 0 3 416.949 4.003 20 0 HIADHN CO[C@H](c1ccccc1F)[C@@H](C)NC(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000538372806 938606224 /nfs/dbraw/zinc/60/62/24/938606224.db2.gz KFOBBJSKHHZPRS-ZTNFWEORSA-N 0 3 405.539 4.100 20 0 HIADHN COc1ccc([C@H](N[C@H](C)C(=O)N(C)Cc2nc3ccccc3s2)C2CC2)cc1 ZINC000538389272 938609011 /nfs/dbraw/zinc/60/90/11/938609011.db2.gz CYVDGLHJHLPKSK-IVZQSRNASA-N 0 3 409.555 4.393 20 0 HIADHN CC(C)(C)[C@@H](COc1ccccc1F)NCC(=O)N1CCC[C@@H](C(F)(F)F)C1 ZINC000538390687 938609498 /nfs/dbraw/zinc/60/94/98/938609498.db2.gz UOCNADRNWNCXGZ-RHSMWYFYSA-N 0 3 404.448 4.010 20 0 HIADHN CCOC(=O)C1CCN(C(=O)[C@@H](C)N[C@H](c2ccc(CC(C)C)cc2)C2CC2)CC1 ZINC000538390559 938609606 /nfs/dbraw/zinc/60/96/06/938609606.db2.gz SBEHCVZPILIDAG-WZONZLPQSA-N 0 3 414.590 4.116 20 0 HIADHN Cc1cc(C(=O)NC2CCN(Cc3ccccc3)CC2)nn1-c1cc(C)cc(C)c1 ZINC000538499711 938636084 /nfs/dbraw/zinc/63/60/84/938636084.db2.gz HVAAFJTUWIDTIX-UHFFFAOYSA-N 0 3 402.542 4.192 20 0 HIADHN CCN1CCN(c2ccc(N[C@H](C)c3ccc(NC(C)=O)cc3OC)c(C)c2)CC1 ZINC000538508766 938638336 /nfs/dbraw/zinc/63/83/36/938638336.db2.gz CIDNZQDUWZVMCQ-GOSISDBHSA-N 0 3 410.562 4.277 20 0 HIADHN COc1ccc(C2(C(=O)N[C@@H]3CCN([C@@H](C)c4ccccc4)C3)CCCC2)cc1OC ZINC000538529579 938642204 /nfs/dbraw/zinc/64/22/04/938642204.db2.gz RBECAZRCSNEXMQ-SIKLNZKXSA-N 0 3 422.569 4.467 20 0 HIADHN COc1ccc(C2(C(=O)N[C@H]3CCN([C@@H](C)c4ccccc4)C3)CCCC2)cc1OC ZINC000538529580 938642235 /nfs/dbraw/zinc/64/22/35/938642235.db2.gz RBECAZRCSNEXMQ-UGKGYDQZSA-N 0 3 422.569 4.467 20 0 HIADHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc(C)n(-c2ccc(Cl)c(Cl)c2)n1 ZINC000538561707 938649746 /nfs/dbraw/zinc/64/97/46/938649746.db2.gz LMVAZRIROSAKKG-ZBFHGGJFSA-N 0 3 407.345 4.186 20 0 HIADHN Cc1cc(C(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)nn1[C@@H](C)C1CC1 ZINC000538565721 938650915 /nfs/dbraw/zinc/65/09/15/938650915.db2.gz CSXORDUNNYCUBL-RXVVDRJESA-N 0 3 418.545 4.058 20 0 HIADHN Cc1cc(C(=O)N(Cc2ccco2)C2CCN(C)CC2)nn1-c1ccc(Cl)cc1 ZINC000538672721 938681451 /nfs/dbraw/zinc/68/14/51/938681451.db2.gz XLEQOLWGPUTEOU-UHFFFAOYSA-N 0 3 412.921 4.164 20 0 HIADHN COc1cc(CN(Cc2ccc(C)c(C)c2)C2CC2)ccc1OCC(=O)N1CCCC1 ZINC000538718215 938689587 /nfs/dbraw/zinc/68/95/87/938689587.db2.gz CPZJHVOQBJYEPO-UHFFFAOYSA-N 0 3 422.569 4.478 20 0 HIADHN COc1cc(CN2CC[C@H](OC)C2)ccc1OCc1ccc(Br)cc1 ZINC000538726008 938693448 /nfs/dbraw/zinc/69/34/48/938693448.db2.gz OAQPTRLFKWRMFQ-SFHVURJKSA-N 0 3 406.320 4.257 20 0 HIADHN CC(C)(C)C(=O)NC[C@@H]1CCCN(CC2=Cc3cc(Br)ccc3OC2)C1 ZINC000538733246 938695801 /nfs/dbraw/zinc/69/58/01/938695801.db2.gz BWXMHGMZXCPHIC-HNNXBMFYSA-N 0 3 421.379 4.099 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)cc1CN1CCC[C@@H](CNC(=O)C(C)(C)C)C1 ZINC000538733371 938696526 /nfs/dbraw/zinc/69/65/26/938696526.db2.gz LELUHGYMQKLXFT-KRWDZBQOSA-N 0 3 402.970 4.208 20 0 HIADHN CCOCCCNC(=O)C1CCN([C@H]2CCCc3ccc(Br)cc32)CC1 ZINC000538742786 938699057 /nfs/dbraw/zinc/69/90/57/938699057.db2.gz TVDMQDQQCRKJAO-FQEVSTJZSA-N 0 3 423.395 4.081 20 0 HIADHN CCN(CC(F)(F)F)C(=O)[C@@H]1CCCN(Cc2cnc(-c3ccccc3)s2)C1 ZINC000538751774 938702199 /nfs/dbraw/zinc/70/21/99/938702199.db2.gz MVZXTBNITVCNKZ-MRXNPFEDSA-N 0 3 411.493 4.433 20 0 HIADHN CCCN(CC(F)(F)F)C(=O)[C@H]1CCCN(Cc2c[nH]nc2-c2cccs2)C1 ZINC000538751375 938702308 /nfs/dbraw/zinc/70/23/08/938702308.db2.gz IRQSEGIFJIRDHX-AWEZNQCLSA-N 0 3 414.497 4.151 20 0 HIADHN CCCN(CC(F)(F)F)C(=O)[C@H]1CCCN(Cc2cnc(C)n2-c2ccccc2)C1 ZINC000538752202 938702609 /nfs/dbraw/zinc/70/26/09/938702609.db2.gz PTRYLEDJTKWLMX-SFHVURJKSA-N 0 3 422.495 4.194 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)c2ccccc2Br)cc1 ZINC000538831286 938721728 /nfs/dbraw/zinc/72/17/28/938721728.db2.gz RBKYWYTVHUNRDR-LJQANCHMSA-N 0 3 403.320 4.025 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)c2csc(Br)c2)cc1 ZINC000538830718 938721790 /nfs/dbraw/zinc/72/17/90/938721790.db2.gz MXPRCSMWDQUFJZ-INIZCTEOSA-N 0 3 409.349 4.086 20 0 HIADHN O=C(NC[C@H](c1ccco1)N1CCCCC1)Nc1ccc2nc(C(F)F)[nH]c2c1 ZINC000538983137 938759423 /nfs/dbraw/zinc/75/94/23/938759423.db2.gz IEBWFMFLTRLRQQ-MRXNPFEDSA-N 0 3 403.433 4.442 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N[C@@H](c2ccccc2)[C@H]2CCOC2)N2CCCC2)cc1 ZINC000538999071 938764625 /nfs/dbraw/zinc/76/46/25/938764625.db2.gz RIPDZCNJRAJCQU-HJOGWXRNSA-N 0 3 407.558 4.209 20 0 HIADHN C[C@@H]1Cc2ccc(F)cc2[C@H]1NCc1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000539018483 938770566 /nfs/dbraw/zinc/77/05/66/938770566.db2.gz LZUXFYICPOWDOP-ZHRRBRCNSA-N 0 3 402.535 4.023 20 0 HIADHN CCCCCOc1ccc([C@@H](C)NCc2ccc(S(=O)(=O)N(C)C)cc2)cc1 ZINC000539019088 938770733 /nfs/dbraw/zinc/77/07/33/938770733.db2.gz GOOFQFGQPBFLHQ-GOSISDBHSA-N 0 3 404.576 4.357 20 0 HIADHN CC[C@H](N[C@H](C)c1cc(OC)c(OC)cc1F)[C@@H](c1ccc(C)cc1)n1cncn1 ZINC000539039433 938778123 /nfs/dbraw/zinc/77/81/23/938778123.db2.gz AWMCXZJQTDFKQK-NIJIEXERSA-N 0 3 412.509 4.462 20 0 HIADHN COCCc1nc(C)c([C@@H](C)NCc2ccc(COC3CCOCC3)cc2)s1 ZINC000539051764 938783440 /nfs/dbraw/zinc/78/34/40/938783440.db2.gz DGSGTVQHEGWHSP-MRXNPFEDSA-N 0 3 404.576 4.187 20 0 HIADHN Cc1cccc(NC(=O)C[C@H](C)N[C@@H]2CC(=O)N(C)[C@@H]2c2ccc(Cl)cc2)c1C ZINC000539051827 938784054 /nfs/dbraw/zinc/78/40/54/938784054.db2.gz BXXYTPKYDNDUGG-UYGSHGSRSA-N 0 3 413.949 4.236 20 0 HIADHN C[C@@H](NCc1cccc(Cn2cnc3ccccc32)c1)c1ccc(S(C)(=O)=O)cc1 ZINC000539060670 938787519 /nfs/dbraw/zinc/78/75/19/938787519.db2.gz ILNKPYWVMXEERV-GOSISDBHSA-N 0 3 419.550 4.339 20 0 HIADHN C[C@@H](N[C@H](C)c1cccc(-c2ccncc2)c1)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000539090772 938800820 /nfs/dbraw/zinc/80/08/20/938800820.db2.gz BUPDDAVWHNHTTI-QZTJIDSGSA-N 0 3 409.555 4.411 20 0 HIADHN COc1ccc2c(c1)[C@@H](NCc1ccc(C(=O)N3C[C@@H](C)O[C@@H](C)C3)cc1)CCC2 ZINC000539091079 938801075 /nfs/dbraw/zinc/80/10/75/938801075.db2.gz FWAGTXBUDKCYIH-RHGYRFJNSA-N 0 3 408.542 4.112 20 0 HIADHN C[C@H](NCc1ccc(Cn2ccccc2=O)cc1)c1ccc(NC(=O)NC2CC2)cc1 ZINC000539093119 938801583 /nfs/dbraw/zinc/80/15/83/938801583.db2.gz LBZCMFYOIZGDFI-SFHVURJKSA-N 0 3 416.525 4.031 20 0 HIADHN COc1ccc2cc([C@H](C)NCc3ccc(S(=O)(=O)N4CCCC4)cc3)ccc2c1 ZINC000539094454 938801927 /nfs/dbraw/zinc/80/19/27/938801927.db2.gz WMVYQCRHHSMLDL-SFHVURJKSA-N 0 3 424.566 4.484 20 0 HIADHN C[C@@H](NC[C@@H](c1cccs1)N1CCOCC1)c1nc2ccc(Cl)cc2n1C ZINC000539162129 938814225 /nfs/dbraw/zinc/81/42/25/938814225.db2.gz VNSZYVOACDVUCO-KDOFPFPSSA-N 0 3 404.967 4.012 20 0 HIADHN C[C@@H](NCC(=O)N(Cc1ccco1)c1ccccc1)c1ccccc1-n1cccn1 ZINC000539260087 938828896 /nfs/dbraw/zinc/82/88/96/938828896.db2.gz JPWYICVYRZFJFQ-LJQANCHMSA-N 0 3 400.482 4.349 20 0 HIADHN C[C@H](N[C@@H](C)c1ccccc1-n1cccn1)C(=O)N(C)Cc1nc2ccccc2s1 ZINC000539261454 938829217 /nfs/dbraw/zinc/82/92/17/938829217.db2.gz PCLNSJPZMLBTPU-IRXDYDNUSA-N 0 3 419.554 4.180 20 0 HIADHN C[C@@H](N[C@H](C)c1ccccc1-n1cccn1)C(=O)Nc1ccc(OC(F)F)cc1 ZINC000539261104 938829258 /nfs/dbraw/zinc/82/92/58/938829258.db2.gz YTYKHCGLYUHEDN-HUUCEWRRSA-N 0 3 400.429 4.152 20 0 HIADHN COc1ccc(F)cc1[C@@H](C)NCCc1nc2sc3c(c2c(N)n1)CCCC3 ZINC000539269121 938830745 /nfs/dbraw/zinc/83/07/45/938830745.db2.gz RFCNCSOZQIFDQP-GFCCVEGCSA-N 0 3 400.523 4.193 20 0 HIADHN CC[C@@H](NCC(=O)N(CC)[C@H](C)c1ccc(F)cc1)c1ccc2c(c1)OCCO2 ZINC000539278604 938832198 /nfs/dbraw/zinc/83/21/98/938832198.db2.gz DKUKBYDFRFQDFD-OXQOHEQNSA-N 0 3 400.494 4.247 20 0 HIADHN COC(=O)c1ccc(CN[C@H](C)c2ccc(NC(=O)c3ccncc3)cc2)cc1F ZINC000539286161 938833656 /nfs/dbraw/zinc/83/36/56/938833656.db2.gz DVYNIQDGYQQKJG-OAHLLOKOSA-N 0 3 407.445 4.110 20 0 HIADHN C[C@H](NCC(=O)N(C)[C@@H](C)c1cc2ccccc2o1)c1cccc(-n2cccn2)c1 ZINC000539286550 938833834 /nfs/dbraw/zinc/83/38/34/938833834.db2.gz LZLSVGSYALOEAR-ROUUACIJSA-N 0 3 402.498 4.489 20 0 HIADHN Cc1nn(-c2ccc(C)cc2)c(C)c1NC(=O)CN[C@@H](c1ccccc1)[C@@H]1CCOC1 ZINC000539289387 938834197 /nfs/dbraw/zinc/83/41/97/938834197.db2.gz MPCHOAYPPMSNFS-BWKNWUBXSA-N 0 3 418.541 4.103 20 0 HIADHN C[C@@H](N[C@H](C)c1cccc(-n2cccn2)c1)C(=O)N(C)Cc1nc2ccccc2s1 ZINC000539289640 938834398 /nfs/dbraw/zinc/83/43/98/938834398.db2.gz XIAJKBQNZZGTMO-IAGOWNOFSA-N 0 3 419.554 4.180 20 0 HIADHN Cc1ccccc1NC(=O)[C@H](C)N[C@@H](C)c1ccc(NC(=O)c2ccncc2)cc1 ZINC000539297327 938835836 /nfs/dbraw/zinc/83/58/36/938835836.db2.gz QSJJLBDMHRHBCA-ROUUACIJSA-N 0 3 402.498 4.320 20 0 HIADHN CCOC(=O)c1c2c(sc1NC(=O)[C@@H]1CCC(=O)[C@H](C)C1)C(C)(C)NC(C)(C)C2 ZINC000539298204 938836238 /nfs/dbraw/zinc/83/62/38/938836238.db2.gz PTJMRCBQBQWRCM-CHWSQXEVSA-N 0 3 420.575 4.028 20 0 HIADHN COC(=O)c1ccc(CNC(=O)[C@H](C)N[C@H](C)c2ccc(SC(C)C)cc2)cc1 ZINC000539300417 938836859 /nfs/dbraw/zinc/83/68/59/938836859.db2.gz GICCQRHOLOXXAD-SJORKVTESA-N 0 3 414.571 4.329 20 0 HIADHN CSc1cccc(NC(=O)NCCCN2CCN(C)C[C@H]2c2ccccc2)c1C ZINC000539304875 938837590 /nfs/dbraw/zinc/83/75/90/938837590.db2.gz QRUBCROAALXDAO-NRFANRHFSA-N 0 3 412.603 4.217 20 0 HIADHN COc1cccc(CN(C)C(=O)CN[C@@H](c2cccc(F)c2)C2CCCC2)c1OC ZINC000539323589 938841349 /nfs/dbraw/zinc/84/13/49/938841349.db2.gz JGGDXPVSRSRCRI-HSZRJFAPSA-N 0 3 414.521 4.322 20 0 HIADHN Cc1nn(C)c(C)c1NC(=O)CN[C@@H](c1ccccc1)[C@@H]1CCCc2ccccc21 ZINC000539327583 938842219 /nfs/dbraw/zinc/84/22/19/938842219.db2.gz ZFKKAGKGOHTQBU-RDGATRHJSA-N 0 3 402.542 4.426 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(-n2ccnn2)cc1)C(=O)Nc1ccc(Cl)cc1Cl ZINC000539328951 938842557 /nfs/dbraw/zinc/84/25/57/938842557.db2.gz UDCMJLKIYVSPJJ-QWHCGFSZSA-N 0 3 404.301 4.252 20 0 HIADHN O=C(CN[C@@H](c1cccc(Cl)c1)C1CCCC1)Nc1nnc(-c2ccco2)o1 ZINC000539333406 938843319 /nfs/dbraw/zinc/84/33/19/938843319.db2.gz ZNPSSXALXWIBJT-GOSISDBHSA-N 0 3 400.866 4.443 20 0 HIADHN CCOc1ccc([C@H]2CCCN2C(=O)CN[C@@H](C)c2ccc(-n3cccn3)cc2)cc1 ZINC000539337727 938844297 /nfs/dbraw/zinc/84/42/97/938844297.db2.gz USNMFBHNMZWMDX-YADARESESA-N 0 3 418.541 4.285 20 0 HIADHN COC(=O)c1sc2[nH]c(CN[C@H](c3cccc(C)c3)C(C)(C)C)nc(=O)c2c1C ZINC000539337759 938844335 /nfs/dbraw/zinc/84/43/35/938844335.db2.gz WKCLRRZTIRSWER-GOSISDBHSA-N 0 3 413.543 4.265 20 0 HIADHN C[C@H](NCC(=O)N1CC[C@@H](C)Sc2ccccc21)c1ccc(-n2cccn2)cc1 ZINC000539338063 938844420 /nfs/dbraw/zinc/84/44/20/938844420.db2.gz ZJVXFQSVYBKJTD-MSOLQXFVSA-N 0 3 406.555 4.440 20 0 HIADHN C[C@@H](NCC(=O)Nc1ccc(OC(F)(F)F)cc1)c1ccc(-n2cccn2)cc1 ZINC000539338898 938844733 /nfs/dbraw/zinc/84/47/33/938844733.db2.gz TWBUXISHFNLPRC-CQSZACIVSA-N 0 3 404.392 4.060 20 0 HIADHN O=C(CN[C@@H](c1cccs1)C1CC1)N1c2ccccc2NC(=O)C[C@@H]1C(F)(F)F ZINC000539368997 938849959 /nfs/dbraw/zinc/84/99/59/938849959.db2.gz XMVSYOAAAUZRHT-VQIMIIECSA-N 0 3 423.460 4.095 20 0 HIADHN Cc1cc(NC(=O)CN[C@@H](C)c2cccc(N3CCCC3)c2)n(-c2ccc(C)cc2)n1 ZINC000539379301 938851748 /nfs/dbraw/zinc/85/17/48/938851748.db2.gz PZCTVAAFHLXBTM-FQEVSTJZSA-N 0 3 417.557 4.379 20 0 HIADHN COC(=O)[C@@H](C)Oc1ccc(CNC2(c3ccc(Br)cc3)CC2)cc1 ZINC000539414988 938857433 /nfs/dbraw/zinc/85/74/33/938857433.db2.gz HPBSNXDRYNPMHT-CQSZACIVSA-N 0 3 404.304 4.168 20 0 HIADHN Cc1cc([C@@H](N[C@@H](C)C(=O)Nc2ccc(N3CCCC3=O)cc2)C2CC2)ccc1F ZINC000539425010 938858685 /nfs/dbraw/zinc/85/86/85/938858685.db2.gz QXZISKBCXJJENB-HJPURHCSSA-N 0 3 409.505 4.329 20 0 HIADHN CN(C)CCn1c2cc(NC(=O)c3ccccc3NC3CCCCC3)ccc2oc1=O ZINC000539448653 938862307 /nfs/dbraw/zinc/86/23/07/938862307.db2.gz YUZKEENRJCSITN-UHFFFAOYSA-N 0 3 422.529 4.153 20 0 HIADHN CCOc1ccccc1[C@@H](CC)NC(=O)CN[C@H](c1ccc2c(c1)OCCO2)C1CC1 ZINC000539491676 938867811 /nfs/dbraw/zinc/86/78/11/938867811.db2.gz XGUYGKKYOQJOAV-NLFFAJNJSA-N 0 3 424.541 4.165 20 0 HIADHN COc1cccc2cc([C@H](C)NCCNC(=O)c3ccc(Br)cc3)oc21 ZINC000539498470 938868867 /nfs/dbraw/zinc/86/88/67/938868867.db2.gz HYDHCJKTISCVHV-ZDUSSCGKSA-N 0 3 417.303 4.285 20 0 HIADHN C[C@@H](NC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2)c1cc2cc(Cl)ccc2o1 ZINC000539498928 938869288 /nfs/dbraw/zinc/86/92/88/938869288.db2.gz WUIMUURLNLRPGP-CXAGYDPISA-N 0 3 414.889 4.061 20 0 HIADHN CCN(CC)CCN(C(=O)[C@@H]1CCC(=O)C[C@H]1C)c1cccc(Br)c1 ZINC000539546859 938878108 /nfs/dbraw/zinc/87/81/08/938878108.db2.gz XKOCWKLDHCXXND-DNVCBOLYSA-N 0 3 409.368 4.129 20 0 HIADHN CC(C)[C@@H]1C[C@H](N[C@H](c2ccc(F)cc2)c2cccc(S(C)(=O)=O)c2)CCO1 ZINC000539608535 938887587 /nfs/dbraw/zinc/88/75/87/938887587.db2.gz QTTCSDCJQZSOAB-BAGYTPMASA-N 0 3 405.535 4.112 20 0 HIADHN C[C@H](NCC(=O)Nc1cccc(N2CCCC2=O)c1)c1ccc(F)c2ccccc21 ZINC000563563964 945216319 /nfs/dbraw/zinc/21/63/19/945216319.db2.gz GDNLVKIIEFSBGJ-INIZCTEOSA-N 0 3 405.473 4.395 20 0 HIADHN COc1cc(CN2CCC[C@H](c3nc(-c4ccccc4)n[nH]3)C2)ccc1OC(F)F ZINC000539768136 938931506 /nfs/dbraw/zinc/93/15/06/938931506.db2.gz URXQVRFBEDNCPT-KRWDZBQOSA-N 0 3 414.456 4.461 20 0 HIADHN COc1cc(CN2CCC[C@@H](c3nc(-c4ccccc4)n[nH]3)C2)ccc1OC(F)F ZINC000539768137 938931641 /nfs/dbraw/zinc/93/16/41/938931641.db2.gz URXQVRFBEDNCPT-QGZVFWFLSA-N 0 3 414.456 4.461 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)CN[C@]2(C)CCCc3ccccc32)c(C(F)(F)F)c1 ZINC000539798695 938936956 /nfs/dbraw/zinc/93/69/56/938936956.db2.gz OGHSTIRFBPPXHW-OAQYLSRUSA-N 0 3 419.447 4.444 20 0 HIADHN CCC1(CO)CCN(Cc2c(C)nn(-c3ccc(Br)cc3)c2C)CC1 ZINC000539819781 938943164 /nfs/dbraw/zinc/94/31/64/938943164.db2.gz SCLFQIOXFAQLGN-UHFFFAOYSA-N 0 3 406.368 4.236 20 0 HIADHN CCO[C@H]1C[C@@H](O)C12CCN(Cc1ccc(OC)c(OCc3ccccc3)c1)CC2 ZINC000539838491 938953823 /nfs/dbraw/zinc/95/38/23/938953823.db2.gz SHCSIHVGBQLVRK-RPWUZVMVSA-N 0 3 411.542 4.026 20 0 HIADHN CCCN(CC(F)(F)F)C(=O)[C@@H]1CCCN(Cc2cn(-c3ccccc3)nc2C)C1 ZINC000539850438 938957244 /nfs/dbraw/zinc/95/72/44/938957244.db2.gz LLQXGSYNHPXAGA-GOSISDBHSA-N 0 3 422.495 4.194 20 0 HIADHN CN(Cc1cc(Br)ccc1OCc1ccccn1)C[C@H]1CCC[C@@H]1O ZINC000539912635 938977289 /nfs/dbraw/zinc/97/72/89/938977289.db2.gz DRYQKXYNPKAYAH-BEFAXECRSA-N 0 3 405.336 4.016 20 0 HIADHN O=C(Cc1cccc(OCc2cccnc2)c1)N(CCN1CCCC1)c1ccccc1 ZINC000539959010 938981413 /nfs/dbraw/zinc/98/14/13/938981413.db2.gz MPQRYINHYGTLQY-UHFFFAOYSA-N 0 3 415.537 4.332 20 0 HIADHN CC(C)n1cnnc1[C@H]1CCCN(C[C@@H](O)COc2ccc(-c3ccccc3)cc2)C1 ZINC000540061585 939055002 /nfs/dbraw/zinc/05/50/02/939055002.db2.gz KGGVKNWKRCNPKW-XZOQPEGZSA-N 0 3 420.557 4.145 20 0 HIADHN COc1ccc(COCCNCC2=Cc3cc(Br)ccc3OC2)cc1 ZINC000540065770 939056687 /nfs/dbraw/zinc/05/66/87/939056687.db2.gz GCJNQTDJYAVZDZ-UHFFFAOYSA-N 0 3 404.304 4.040 20 0 HIADHN C[C@H](NC[C@@H](CO)Cc1cccc(OC(F)(F)F)c1)c1nc2c(s1)CCCC2 ZINC000540087053 939065543 /nfs/dbraw/zinc/06/55/43/939065543.db2.gz QLFKJVVUWKQGIH-ZFWWWQNUSA-N 0 3 414.493 4.422 20 0 HIADHN Cc1cc2ncc([C@@H](C)NCc3ccc(-n4ccc(C(F)(F)F)n4)cc3)c(C)n2n1 ZINC000540087078 939065589 /nfs/dbraw/zinc/06/55/89/939065589.db2.gz UWOQROGVRYOODP-CQSZACIVSA-N 0 3 414.435 4.401 20 0 HIADHN CC(C)Cn1cc(NC(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)c(C(F)F)n1 ZINC000540110449 939075622 /nfs/dbraw/zinc/07/56/22/939075622.db2.gz FSUAHNBYXRNWOU-KRWDZBQOSA-N 0 3 405.493 4.215 20 0 HIADHN CC(C)Cn1cc(NC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)c(C(F)F)n1 ZINC000540111280 939075666 /nfs/dbraw/zinc/07/56/66/939075666.db2.gz SCWVOHUYZLYMDV-QGZVFWFLSA-N 0 3 405.493 4.263 20 0 HIADHN Cc1c([C@H](C)N[C@@H]2CCO[C@H](C(C)C)C2)nnn1-c1cccc(Br)c1 ZINC000540137380 939087366 /nfs/dbraw/zinc/08/73/66/939087366.db2.gz BRUYMESWROAOCH-XCRHUMRWSA-N 0 3 407.356 4.192 20 0 HIADHN C[C@@H](NC[C@@H](C)S(C)(=O)=O)c1ccc(-c2ccccc2Br)s1 ZINC000540145803 939090627 /nfs/dbraw/zinc/09/06/27/939090627.db2.gz XSDZYXLDQUZLRS-VXGBXAGGSA-N 0 3 402.379 4.261 20 0 HIADHN Cc1ccc([C@@H](Cn2ccnc2)N[C@H](C)c2cccc(N3CCOCC3)c2)c(C)c1 ZINC000540146202 939090878 /nfs/dbraw/zinc/09/08/78/939090878.db2.gz AZSHOASQYCHMLH-PXDATVDWSA-N 0 3 404.558 4.429 20 0 HIADHN COc1ccc([C@H](NC2CCN(Cc3ccncc3)CC2)c2ccccc2OC)cc1 ZINC000540146501 939091199 /nfs/dbraw/zinc/09/11/99/939091199.db2.gz GJJVYTIRHLWYSV-SANMLTNESA-N 0 3 417.553 4.442 20 0 HIADHN COc1ccc2c(c1)CCC[C@H]2[NH2+]Cc1nnc(-c2ccc(Br)cc2)[n-]1 ZINC000540148418 939092223 /nfs/dbraw/zinc/09/22/23/939092223.db2.gz NIUXHVHMGMWNMG-GOSISDBHSA-N 0 3 413.319 4.410 20 0 HIADHN COc1ccc2c(c1)CCC[C@H]2NCc1nnc(-c2ccc(Br)cc2)[nH]1 ZINC000540148418 939092227 /nfs/dbraw/zinc/09/22/27/939092227.db2.gz NIUXHVHMGMWNMG-GOSISDBHSA-N 0 3 413.319 4.410 20 0 HIADHN CC[C@@H](NCc1ccccc1CS(=O)(=O)N1CCC(C)CC1)c1ccccc1 ZINC000540151232 939092818 /nfs/dbraw/zinc/09/28/18/939092818.db2.gz PPGALEJTRZJTHY-HSZRJFAPSA-N 0 3 400.588 4.489 20 0 HIADHN COc1ccc(OC)c([C@H](C)NC[C@@H](c2cccc(Cl)c2)N2CCOCC2)c1 ZINC000540173437 939103949 /nfs/dbraw/zinc/10/39/49/939103949.db2.gz FBCTXCGODWYBOR-KKSFZXQISA-N 0 3 404.938 4.081 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(OCCN[C@@H](C)c3cnc(C)nc3C)c2)cc1 ZINC000540174807 939104652 /nfs/dbraw/zinc/10/46/52/939104652.db2.gz PCZIKPJUGWWYOD-INIZCTEOSA-N 0 3 420.513 4.084 20 0 HIADHN CC[C@@H](N[C@@H](c1cccc(S(C)(=O)=O)c1)c1cc(F)ccc1F)C1CCOCC1 ZINC000540188407 939112853 /nfs/dbraw/zinc/11/28/53/939112853.db2.gz JIBOBIUBDHEVGP-YADHBBJMSA-N 0 3 423.525 4.253 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)c1cnc(Oc2ccccc2)cn1 ZINC000540207524 939127440 /nfs/dbraw/zinc/12/74/40/939127440.db2.gz FBFHGUVOEALRII-UHFFFAOYSA-N 0 3 420.538 4.113 20 0 HIADHN Cc1nc(-c2ccc(Br)cc2)sc1[C@H](C)N[C@@H]1CC(=O)N(C2CC2)C1 ZINC000540219652 939136031 /nfs/dbraw/zinc/13/60/31/939136031.db2.gz JOCZEYWYJWDFAZ-XHDPSFHLSA-N 0 3 420.376 4.295 20 0 HIADHN Cc1noc(C2CCC(N[C@@H](C)c3nnn(-c4ccc(Cl)cc4)c3C)CC2)n1 ZINC000540222460 939137702 /nfs/dbraw/zinc/13/77/02/939137702.db2.gz QUURMOXOESXFQY-VWDMACCTSA-N 0 3 400.914 4.298 20 0 HIADHN CO[C@H](c1ccc(Br)cc1)[C@H](C)NC(=O)c1cccc(CN(C)C)c1 ZINC000540256487 939174385 /nfs/dbraw/zinc/17/43/85/939174385.db2.gz LQTZKAGANRGHHQ-LIRRHRJNSA-N 0 3 405.336 4.017 20 0 HIADHN CCC[C@H](NCC(=O)N1c2ccccc2NC(=O)C[C@@H]1C(F)(F)F)c1ccccc1 ZINC000540341830 939200032 /nfs/dbraw/zinc/20/00/32/939200032.db2.gz YFPOSKWCUHVMRA-QFBILLFUSA-N 0 3 419.447 4.424 20 0 HIADHN CC(C)[C@H](NCc1cccc(C(=O)NCc2ccco2)c1)c1ccc2c(c1)OCCO2 ZINC000540341818 939200173 /nfs/dbraw/zinc/20/01/73/939200173.db2.gz XMOPZVXBLCZIHP-DEOSSOPVSA-N 0 3 420.509 4.468 20 0 HIADHN COc1ccc(NC(=O)CN[C@@H](c2ccc3c(c2)OCCO3)C(C)C)cc1Cl ZINC000540341023 939200207 /nfs/dbraw/zinc/20/02/07/939200207.db2.gz GJFJTMYOSDEECW-OAQYLSRUSA-N 0 3 404.894 4.045 20 0 HIADHN CC(C)C[C@@H](NCC(=O)N1CCC(C(=O)N2CCCCCC2)CC1)c1ccccc1 ZINC000540342534 939201030 /nfs/dbraw/zinc/20/10/30/939201030.db2.gz GFXIWKMXDTZMCG-HSZRJFAPSA-N 0 3 413.606 4.005 20 0 HIADHN Cc1n[nH]c(C)c1[C@@H]1CCCN1C(=O)NC[C@@H](c1ccccc1)N1CCC(C)CC1 ZINC000540387377 939224757 /nfs/dbraw/zinc/22/47/57/939224757.db2.gz YOVYGLQBLNMVTL-VXKWHMMOSA-N 0 3 409.578 4.346 20 0 HIADHN CCOc1ccc2nc(NC(=O)CN[C@H](c3ccccc3)[C@@H]3CCOC3)sc2c1 ZINC000540388287 939225770 /nfs/dbraw/zinc/22/57/70/939225770.db2.gz PRLGZAAZJGIMNE-IIBYNOLFSA-N 0 3 411.527 4.001 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(NC(=O)c2ccncc2)cc1)C(=O)N(C)C1CCCCC1 ZINC000540388912 939226256 /nfs/dbraw/zinc/22/62/56/939226256.db2.gz ZQLGINAOGRETBW-QZTJIDSGSA-N 0 3 408.546 4.164 20 0 HIADHN Cc1cc(Br)ccc1NC(=O)CN[C@@H](C)c1cccc(-n2cccn2)c1 ZINC000540390131 939227502 /nfs/dbraw/zinc/22/75/02/939227502.db2.gz VNURFPUEGUVBBO-HNNXBMFYSA-N 0 3 413.319 4.233 20 0 HIADHN O=C(CN[C@H](c1ccccc1)[C@@H]1CCOC1)N[C@H](Cc1ccccc1)c1ccccc1 ZINC000540389981 939227677 /nfs/dbraw/zinc/22/76/77/939227677.db2.gz LBASRISBVQEWOY-RGSZASNESA-N 0 3 414.549 4.454 20 0 HIADHN COc1cc(C(C)=O)ccc1OC[C@@H](O)CN[C@@H](c1ccccc1Cl)C(C)C ZINC000540390384 939228801 /nfs/dbraw/zinc/22/88/01/939228801.db2.gz QDPNYZNLWSTFLW-HTAPYJJXSA-N 0 3 405.922 4.278 20 0 HIADHN CN(C(=O)N[C@@H]1CCO[C@H]1c1ccc(Cl)cc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000540393267 939231794 /nfs/dbraw/zinc/23/17/94/939231794.db2.gz ROVVPXGUIXFSTH-VSKRKVRLSA-N 0 3 413.949 4.086 20 0 HIADHN CCNC(=O)c1cccc(NC(=O)CN[C@@H](c2ccc(Cl)cc2)[C@H](C)CC)c1 ZINC000540397784 939233642 /nfs/dbraw/zinc/23/36/42/939233642.db2.gz VWTDPNFHGWBBKI-QVKFZJNVSA-N 0 3 401.938 4.405 20 0 HIADHN CCNC(=O)c1cccc(NC(=O)CN[C@H](c2ccc(Cl)cc2)[C@@H](C)CC)c1 ZINC000540397781 939233947 /nfs/dbraw/zinc/23/39/47/939233947.db2.gz VWTDPNFHGWBBKI-BTYIYWSLSA-N 0 3 401.938 4.405 20 0 HIADHN CSc1cccc(NC(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)c1C ZINC000540407395 939237709 /nfs/dbraw/zinc/23/77/09/939237709.db2.gz JTKGKPPSMQVOCE-CALCHBBNSA-N 0 3 405.608 4.460 20 0 HIADHN C[C@H](NCC(=O)N(Cc1ccccc1)c1ccccc1)c1ccc(-n2ccnn2)cc1 ZINC000540431830 939246039 /nfs/dbraw/zinc/24/60/39/939246039.db2.gz FTRUPLMBEBDOLM-FQEVSTJZSA-N 0 3 411.509 4.151 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(-n2ccnn2)cc1)C(=O)Nc1ccc(Cl)c(Cl)c1 ZINC000540431858 939246380 /nfs/dbraw/zinc/24/63/80/939246380.db2.gz GWIRGWBXGLSQLW-STQMWFEESA-N 0 3 404.301 4.252 20 0 HIADHN COc1ccc([C@H](NC(=O)CN[C@H](C[C@H]2CCOC2)c2ccccc2)C2CC2)cc1 ZINC000540435005 939247988 /nfs/dbraw/zinc/24/79/88/939247988.db2.gz WWRJLPQBJVWVJI-DVKBMCPXSA-N 0 3 408.542 4.020 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(-c2ccncc2)cc1)C(=O)NC(=O)Nc1ccccc1F ZINC000540439727 939250259 /nfs/dbraw/zinc/25/02/59/939250259.db2.gz MXUBCZVHWDCKBC-HZPDHXFCSA-N 0 3 406.461 4.275 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)N1CCN(c2ccccc2)CC1)c1ccc(-c2ccncc2)cc1 ZINC000540439895 939250370 /nfs/dbraw/zinc/25/03/70/939250370.db2.gz OHLDBODIAPJGPV-RTWAWAEBSA-N 0 3 414.553 4.137 20 0 HIADHN CC(=O)Nc1ccc(OC[C@H](O)CN[C@H](Cc2ccccc2)c2ccccc2F)cc1 ZINC000540458354 939259845 /nfs/dbraw/zinc/25/98/45/939259845.db2.gz OBNDMCPRAVRMBN-PXDATVDWSA-N 0 3 422.500 4.097 20 0 HIADHN Cc1cc(C)c(NC(=O)CNC(=O)CN[C@@H](c2ccccc2C)C(C)(C)C)c(C)c1 ZINC000540459061 939260546 /nfs/dbraw/zinc/26/05/46/939260546.db2.gz VLWAVZXMHUFJNS-DEOSSOPVSA-N 0 3 409.574 4.352 20 0 HIADHN Cc1cc(NC(=O)CN[C@@H](c2ccccc2C)C(C)(C)C)n(-c2nc(C)cc(C)n2)n1 ZINC000540459623 939260794 /nfs/dbraw/zinc/26/07/94/939260794.db2.gz NWLOSLXDGMLEPT-QFIPXVFZSA-N 0 3 420.561 4.211 20 0 HIADHN C[C@H](NCC(=O)NCc1ccc(F)cc1C(F)(F)F)c1cccc(N2CCCC2)c1 ZINC000540477559 939268323 /nfs/dbraw/zinc/26/83/23/939268323.db2.gz PEMHJMBUPYZOLR-HNNXBMFYSA-N 0 3 423.454 4.412 20 0 HIADHN C[C@H](NCC(=O)N(C)Cc1c(F)cccc1Cl)c1cccc(N2CCCC2)c1 ZINC000540476785 939268382 /nfs/dbraw/zinc/26/83/82/939268382.db2.gz RGGIAPGEOFLFTH-INIZCTEOSA-N 0 3 403.929 4.389 20 0 HIADHN C[C@@H](NCC(=O)Nc1ccccc1Br)c1cccc(N2CCCC2)c1 ZINC000540478504 939268689 /nfs/dbraw/zinc/26/86/89/939268689.db2.gz JXFFIEISJZPPOY-OAHLLOKOSA-N 0 3 402.336 4.339 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@H](C)N[C@@H](C)c2cccc(N3CCCC3)c2)cc1F ZINC000540478872 939268714 /nfs/dbraw/zinc/26/87/14/939268714.db2.gz QBADKDGTQXTKOV-ROUUACIJSA-N 0 3 413.537 4.132 20 0 HIADHN Cc1cc([C@H](NCC(=O)Nc2cc(Cl)ccc2-n2cncn2)C2CC2)ccc1F ZINC000540523596 939287224 /nfs/dbraw/zinc/28/72/24/939287224.db2.gz WDCIVEBAGVFHKU-OAQYLSRUSA-N 0 3 413.884 4.048 20 0 HIADHN O=C(c1cccc(CN[C@@H](c2ccc3c(c2)OCCO3)C2CC2)c1)N1CCCCC1 ZINC000540589348 939312365 /nfs/dbraw/zinc/31/23/65/939312365.db2.gz SVHXNAXGKATOBD-XMMPIXPASA-N 0 3 406.526 4.325 20 0 HIADHN C[C@@H](NCc1ccc(C(=O)N2CCN(C)CC2)cc1)c1cc2cc(Cl)ccc2o1 ZINC000540597120 939315013 /nfs/dbraw/zinc/31/50/13/939315013.db2.gz JGMXURBGSWSLNY-MRXNPFEDSA-N 0 3 411.933 4.325 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cc(C)n(-c4ccc(C)cc4)n3)c(C)c2)CC1 ZINC000540692259 939340727 /nfs/dbraw/zinc/34/07/27/939340727.db2.gz SBZWNTDSGAGETN-UHFFFAOYSA-N 0 3 417.557 4.192 20 0 HIADHN FC(F)(F)c1cc(Cl)c2nnc(CNC3CCN(c4ccccc4)CC3)n2c1 ZINC000540699826 939343107 /nfs/dbraw/zinc/34/31/07/939343107.db2.gz JUCUZXCUDZCOQJ-UHFFFAOYSA-N 0 3 409.843 4.160 20 0 HIADHN C[C@H](N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1)c1ccc(-n2ccnc2)cc1 ZINC000540754652 939360340 /nfs/dbraw/zinc/36/03/40/939360340.db2.gz WGXMZTVVTAAMFM-LVXARBLLSA-N 0 3 424.548 4.451 20 0 HIADHN COc1cc([C@H](C)Nc2cccc(CN3CCSCC3)c2)cc(OC)c1OC ZINC000540788000 939372504 /nfs/dbraw/zinc/37/25/04/939372504.db2.gz RILFYMQGMUGVLZ-INIZCTEOSA-N 0 3 402.560 4.434 20 0 HIADHN COc1cc(CN[C@@H]2C=C[C@H](CO)C2)ccc1OCc1cccc(C(F)(F)F)c1 ZINC000540806949 939378598 /nfs/dbraw/zinc/37/85/98/939378598.db2.gz CVGLXVINUFZRKS-QFBILLFUSA-N 0 3 407.432 4.320 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)N[C@H]1CCCOc2cc(F)ccc21 ZINC000540863541 939401536 /nfs/dbraw/zinc/40/15/36/939401536.db2.gz NTDBNJJCCFODQH-FQEVSTJZSA-N 0 3 421.463 4.091 20 0 HIADHN COc1cccc([C@@H]2[C@@H](Nc3cc(C)nc(-c4ccccn4)n3)CCN2C2CC2)c1 ZINC000540872466 939405571 /nfs/dbraw/zinc/40/55/71/939405571.db2.gz VMLUFSREDBWZIU-NZQKXSOJSA-N 0 3 401.514 4.246 20 0 HIADHN Cc1nn(-c2ccccc2)cc1NC(=O)N(CCN(C)C)Cc1cccc(Cl)c1 ZINC000540981362 939424315 /nfs/dbraw/zinc/42/43/15/939424315.db2.gz AGEQENGFCYIHFQ-UHFFFAOYSA-N 0 3 411.937 4.430 20 0 HIADHN CSC[C@H](NCc1ccnc(N2CCN(C)CC2)c1)c1ccc(C(F)(F)F)cc1 ZINC000540986268 939425218 /nfs/dbraw/zinc/42/52/18/939425218.db2.gz CYUMSMGWIGFMPL-IBGZPJMESA-N 0 3 424.536 4.046 20 0 HIADHN CSC[C@@H](NCc1cccnc1N1CCN(C)CC1)c1ccc(C(F)(F)F)cc1 ZINC000540987616 939425744 /nfs/dbraw/zinc/42/57/44/939425744.db2.gz UXLAIHLONLPWRF-LJQANCHMSA-N 0 3 424.536 4.046 20 0 HIADHN CC(C)[C@@H](NCc1ccc(S(=O)(=O)N(C)C(C)C)cc1)c1ccc(F)c(F)c1 ZINC000540989628 939426376 /nfs/dbraw/zinc/42/63/76/939426376.db2.gz ZGGYENAHDWNNAQ-OAQYLSRUSA-N 0 3 410.530 4.481 20 0 HIADHN O=C(CCN1CCc2c(cccc2NC(=O)Nc2ccccc2)C1)N1CCCCC1 ZINC000541057672 939444268 /nfs/dbraw/zinc/44/42/68/939444268.db2.gz VYYCHNCLCGKUGH-UHFFFAOYSA-N 0 3 406.530 4.091 20 0 HIADHN CC(C)c1ccccc1OC[C@@H](O)CN1CCC[C@H](n2ccc(C(F)(F)F)n2)C1 ZINC000541127755 939470629 /nfs/dbraw/zinc/47/06/29/939470629.db2.gz OURGMEGMURQWPT-IRXDYDNUSA-N 0 3 411.468 4.102 20 0 HIADHN CN(C)[C@@H](CNC(=O)N1CCO[C@@H](c2ccc(C(F)(F)F)cc2)C1)c1ccccc1 ZINC000541153102 939477769 /nfs/dbraw/zinc/47/77/69/939477769.db2.gz CJABMQVRWSMDBI-VQTJNVASSA-N 0 3 421.463 4.091 20 0 HIADHN CN(C)[C@H](CNC(=O)N1CCO[C@@H](c2ccc(C(F)(F)F)cc2)C1)c1ccccc1 ZINC000541153103 939478037 /nfs/dbraw/zinc/47/80/37/939478037.db2.gz CJABMQVRWSMDBI-WOJBJXKFSA-N 0 3 421.463 4.091 20 0 HIADHN FC(F)(F)c1ccc(CN2CCCN(Cc3nnc(C4CC4)n3C3CC3)CC2)cc1 ZINC000541161842 939481821 /nfs/dbraw/zinc/48/18/21/939481821.db2.gz CRGQAQRKEGZCFO-UHFFFAOYSA-N 0 3 419.495 4.217 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2cc(-c3cnn(C)c3)ccc2F)N2CCCC2)cc1 ZINC000541171125 939484158 /nfs/dbraw/zinc/48/41/58/939484158.db2.gz YSZCURXIBDDSHP-HSZRJFAPSA-N 0 3 406.505 4.102 20 0 HIADHN CC(=O)Nc1ccc(OC[C@H](O)CN2CCCCC[C@H]2/C=C/c2cccs2)cc1 ZINC000541201028 939485280 /nfs/dbraw/zinc/48/52/80/939485280.db2.gz IJFHPMJZIPSEDR-CYYRHQSGSA-N 0 3 414.571 4.404 20 0 HIADHN CC(=O)Nc1ccc(CN[C@H]2CC(=O)N(C(C)C)[C@@H]2c2ccc(Cl)c(F)c2)cc1 ZINC000541203867 939485513 /nfs/dbraw/zinc/48/55/13/939485513.db2.gz JMDJAIXZVGFNOZ-RBBKRZOGSA-N 0 3 417.912 4.278 20 0 HIADHN CCC[C@@H](N[C@@H]1CCCN(Cc2nccn2C)C1=O)c1ccc(Cl)c(Cl)c1 ZINC000541228303 939486559 /nfs/dbraw/zinc/48/65/59/939486559.db2.gz IKENGHWGSVSFQI-QZTJIDSGSA-N 0 3 409.361 4.349 20 0 HIADHN CC[C@@H](N[C@H]1CCCN(Cc2nccn2C)C1=O)c1ccc(Oc2ccccc2)cc1 ZINC000541228903 939486567 /nfs/dbraw/zinc/48/65/67/939486567.db2.gz JFWAIVAANWJUKJ-PKTZIBPZSA-N 0 3 418.541 4.444 20 0 HIADHN CCOc1ccc(C(C)(C)C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1OCC ZINC000541231416 939486741 /nfs/dbraw/zinc/48/67/41/939486741.db2.gz WDOVXNBAAYCQJX-OAQYLSRUSA-N 0 3 410.558 4.152 20 0 HIADHN CC(C)(C)N1CC[C@H](NCc2cc(C(N)=O)cs2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000541247693 939487526 /nfs/dbraw/zinc/48/75/26/939487526.db2.gz NRYNCHCMLXGPJJ-ROUUACIJSA-N 0 3 409.958 4.343 20 0 HIADHN O=C([C@H](NCCCc1nc(-c2ccc(F)cc2)no1)c1ccccc1)N1CCCCC1 ZINC000541283628 939489285 /nfs/dbraw/zinc/48/92/85/939489285.db2.gz XFCIIQDGRXAPLY-JOCHJYFZSA-N 0 3 422.504 4.152 20 0 HIADHN COc1cccc([C@@H]2[C@H](c3ccccc3)CCN2C(=O)N[C@H]2CCN(C3CC3)C2)c1 ZINC000541342964 939493134 /nfs/dbraw/zinc/49/31/34/939493134.db2.gz HEGFTYHAFLKNOC-NKKJXINNSA-N 0 3 405.542 4.172 20 0 HIADHN COCC[C@@H](Cc1ccco1)NCc1nc(-c2ccc(Br)cc2)c[nH]1 ZINC000541381019 939501636 /nfs/dbraw/zinc/50/16/36/939501636.db2.gz RATACCMWWHGCRB-INIZCTEOSA-N 0 3 404.308 4.170 20 0 HIADHN COc1cc(OC)c(CCN[C@H](c2cccnc2)c2ccc(F)c(C)c2)c(OC)c1 ZINC000541546547 939551015 /nfs/dbraw/zinc/55/10/15/939551015.db2.gz WWZZUTYNKIQRAJ-DEOSSOPVSA-N 0 3 410.489 4.477 20 0 HIADHN Cc1cc([C@H](NC[C@@H](c2cccc(F)c2)N2CCOCC2)c2cccnc2)ccc1F ZINC000541547121 939551026 /nfs/dbraw/zinc/55/10/26/939551026.db2.gz AHXPRPDPOWGAPE-DQEYMECFSA-N 0 3 423.507 4.421 20 0 HIADHN Cc1cc([C@H](NC[C@@H]2CC(=O)N(Cc3ccccc3)C2)c2cccnc2)ccc1F ZINC000541565206 939556573 /nfs/dbraw/zinc/55/65/73/939556573.db2.gz COSPKEOECPWBBP-CPJSRVTESA-N 0 3 403.501 4.257 20 0 HIADHN Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)N[C@H]1CCCN(Cc2ccccn2)C1=O ZINC000541568406 939556842 /nfs/dbraw/zinc/55/68/42/939556842.db2.gz QEKMDUWEMCTVPH-QRWLVFNGSA-N 0 3 424.545 4.494 20 0 HIADHN COC(=O)c1cc2cc(CN[C@H](C)c3c(C)nn(CC(F)(F)F)c3C)ccc2o1 ZINC000541600540 939564291 /nfs/dbraw/zinc/56/42/91/939564291.db2.gz KYHVLIMEVWBQNJ-LLVKDONJSA-N 0 3 409.408 4.446 20 0 HIADHN Cc1cccc(C)c1NC(=O)CNC(=O)[C@H](C)N[C@H](CC(C)C)c1cccs1 ZINC000541626166 939574269 /nfs/dbraw/zinc/57/42/69/939574269.db2.gz GTZLCIARSHGLJY-ZWKOTPCHSA-N 0 3 401.576 4.185 20 0 HIADHN C[C@H](NCC(=O)N(Cc1ccc(C(F)(F)F)cc1)C1CC1)[C@H]1COc2ccccc21 ZINC000541699231 939608106 /nfs/dbraw/zinc/60/81/06/939608106.db2.gz BTZZGUZDZAJIIB-MGPUTAFESA-N 0 3 418.459 4.351 20 0 HIADHN CN(CC(=O)NCCCSc1ccccc1)[C@@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000541700822 939608856 /nfs/dbraw/zinc/60/88/56/939608856.db2.gz DJQBZMXRLJMSGS-IRLDBZIGSA-N 0 3 416.562 4.276 20 0 HIADHN C[C@@H](NCC(=O)Nc1ccc2c(c1)OC1(CCCCC1)O2)[C@H]1COc2ccccc21 ZINC000541701362 939609076 /nfs/dbraw/zinc/60/90/76/939609076.db2.gz QVMPNKHVUWFEMC-VQIMIIECSA-N 0 3 408.498 4.211 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@@H]2NCc2ccc(Cn3ccnc3)cc2)cc1 ZINC000541744102 939618989 /nfs/dbraw/zinc/61/89/89/939618989.db2.gz BXEBEJKYGYGINM-BJKOFHAPSA-N 0 3 423.582 4.115 20 0 HIADHN Cc1ccc([C@@H](NCCc2ccc(C)nc2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000541844599 939646424 /nfs/dbraw/zinc/64/64/24/939646424.db2.gz WPTIYLUWDGWPLC-DEOSSOPVSA-N 0 3 408.567 4.332 20 0 HIADHN CC(C)N(CCN(C)C)C(=O)Nc1ccc(OC(F)(F)F)cc1Br ZINC000541961924 939663301 /nfs/dbraw/zinc/66/33/01/939663301.db2.gz IEVOQINCUKHXPH-UHFFFAOYSA-N 0 3 412.250 4.152 20 0 HIADHN CCN1CC[C@H](NCc2cc(OC)c(OC)cc2OC)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000541992108 939672286 /nfs/dbraw/zinc/67/22/86/939672286.db2.gz NFTYHBZUKBMPHY-JTSKRJEESA-N 0 3 424.463 4.055 20 0 HIADHN Cn1cc(-c2ccc(F)c(C(=O)Nc3ccc(CCN4CCSCC4)cc3)c2)cn1 ZINC000542008386 939683454 /nfs/dbraw/zinc/68/34/54/939683454.db2.gz KOLIHYTZJXMBMA-UHFFFAOYSA-N 0 3 424.545 4.070 20 0 HIADHN CN(C)Cc1cccc(NC(=O)N2CCO[C@@H](c3ccc(C(F)(F)F)cc3)C2)c1 ZINC000542008919 939683768 /nfs/dbraw/zinc/68/37/68/939683768.db2.gz XGVIUUGUVYUPER-LJQANCHMSA-N 0 3 407.436 4.372 20 0 HIADHN COC(=O)[C@H](N[C@@H](CN1CCCC1)c1ccccc1)c1ccccc1C(F)(F)F ZINC000542100943 939712776 /nfs/dbraw/zinc/71/27/76/939712776.db2.gz YQTFHWOVEINXII-VQTJNVASSA-N 0 3 406.448 4.346 20 0 HIADHN COC(=O)[C@H](NC1CCN([C@@H](C)c2ccncc2)CC1)c1ccccc1C(F)(F)F ZINC000542100748 939712859 /nfs/dbraw/zinc/71/28/59/939712859.db2.gz KVTIZJTVRZZDTD-MGPUTAFESA-N 0 3 421.463 4.130 20 0 HIADHN CCOC(=O)C1CCN(C(=O)C[C@H](C)NC(c2cccs2)c2cccs2)CC1 ZINC000542137160 939726929 /nfs/dbraw/zinc/72/69/29/939726929.db2.gz YGRFXXDJCDSSHB-HNNXBMFYSA-N 0 3 420.600 4.069 20 0 HIADHN CN(Cc1ccccc1)Cc1cccc(-c2nc(CC(=O)NC3CCCCC3)no2)c1 ZINC000542187323 939749350 /nfs/dbraw/zinc/74/93/50/939749350.db2.gz PBTZWWHTXIIYLV-UHFFFAOYSA-N 0 3 418.541 4.360 20 0 HIADHN CC(C)(C)OC(=O)CCCCN1CCC[C@@H](NC(=O)c2cc3ccccc3o2)C1 ZINC000542209510 939757475 /nfs/dbraw/zinc/75/74/75/939757475.db2.gz MFYPJDVQUCSLKA-GOSISDBHSA-N 0 3 400.519 4.139 20 0 HIADHN COc1ccc(-c2nc(C)c([C@@H](C)N[C@@H](Cc3ccc(F)cc3)C(N)=O)s2)cc1 ZINC000542232499 939767113 /nfs/dbraw/zinc/76/71/13/939767113.db2.gz LFNWECRXHVFKTC-YJYMSZOUSA-N 0 3 413.518 4.013 20 0 HIADHN COc1ccc(-c2nc(C)c([C@@H](C)N[C@H](Cc3ccc(F)cc3)C(N)=O)s2)cc1 ZINC000542232496 939767327 /nfs/dbraw/zinc/76/73/27/939767327.db2.gz LFNWECRXHVFKTC-BFUOFWGJSA-N 0 3 413.518 4.013 20 0 HIADHN Cc1cccc([C@@H]2CCN(C(=O)NCCCCN3CCN(c4ccccc4)CC3)C2)c1 ZINC000542269261 939779054 /nfs/dbraw/zinc/77/90/54/939779054.db2.gz IBLJGRVWDWVWPM-XMMPIXPASA-N 0 3 420.601 4.096 20 0 HIADHN O[C@H](CN[C@@H]1CCOc2c(Cl)cccc21)COc1cccc(C(F)(F)F)c1 ZINC000563738865 945274594 /nfs/dbraw/zinc/27/45/94/945274594.db2.gz KTDFKIULPAMRIM-CXAGYDPISA-N 0 3 401.812 4.212 20 0 HIADHN Cc1ccc([C@@H](CN[C@H](c2ccc(F)cc2)c2cccnc2)N2CCOCC2)cc1 ZINC000542477139 939829769 /nfs/dbraw/zinc/82/97/69/939829769.db2.gz DOTAZKYPLQZGFP-JWQCQUIFSA-N 0 3 405.517 4.282 20 0 HIADHN COc1ccc(C(=O)C[C@H](C)C(=O)NC2[C@H](C)CN(Cc3ccccc3)C[C@H]2C)cc1 ZINC000542489420 939832212 /nfs/dbraw/zinc/83/22/12/939832212.db2.gz IAVXYUWCUJFXIT-XUVXKRRUSA-N 0 3 422.569 4.177 20 0 HIADHN CCOc1ccc([C@@H](CC)N[C@H]2CCCN(Cc3ccccn3)C2=O)cc1OCC ZINC000542498329 939832940 /nfs/dbraw/zinc/83/29/40/939832940.db2.gz JIUBGLDEUZGASA-RTWAWAEBSA-N 0 3 411.546 4.111 20 0 HIADHN Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)NCCC(=O)Nc1cccc(Cl)c1 ZINC000542528660 939837749 /nfs/dbraw/zinc/83/77/49/939837749.db2.gz CSSPAWCOZDJRLH-NSHDSACASA-N 0 3 402.848 4.395 20 0 HIADHN Cc1nccc(NCc2cccc(C(=O)NC[C@@H](c3cccs3)N3CCCC3)c2)n1 ZINC000542569581 939844867 /nfs/dbraw/zinc/84/48/67/939844867.db2.gz PSXIOKUVZDCNDB-FQEVSTJZSA-N 0 3 421.570 4.026 20 0 HIADHN Cc1cnc([C@@H](C)CNC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)s1 ZINC000542572450 939845146 /nfs/dbraw/zinc/84/51/46/939845146.db2.gz GCAQYPIPSDETFJ-LIRRHRJNSA-N 0 3 411.493 4.126 20 0 HIADHN C[C@H](NCC(=O)Nc1cc(C(C)(C)C)nn1-c1ccccc1)[C@@H]1COc2ccccc21 ZINC000542626220 939850136 /nfs/dbraw/zinc/85/01/36/939850136.db2.gz GXHJZUFGAIGAAT-PXNSSMCTSA-N 0 3 418.541 4.263 20 0 HIADHN CCN(CC)[C@H](CNC(=O)C(=O)Nc1cccc(C(F)F)c1Cl)c1ccccc1 ZINC000542631418 939850415 /nfs/dbraw/zinc/85/04/15/939850415.db2.gz DXSGNXMRWQZZHM-QGZVFWFLSA-N 0 3 423.891 4.415 20 0 HIADHN Cc1cnc([C@H](C)CN[C@H](c2ccc(F)cc2)c2cccc(S(C)(=O)=O)c2)s1 ZINC000542698028 939855027 /nfs/dbraw/zinc/85/50/27/939855027.db2.gz ZLHCYGHZBWGDLI-JLTOFOAXSA-N 0 3 418.559 4.477 20 0 HIADHN CC(C)NS(=O)(=O)Cc1ccc(CNC2c3ccccc3-c3ccccc32)cc1 ZINC000542778634 939860513 /nfs/dbraw/zinc/86/05/13/939860513.db2.gz FRRWOIJFVGYJTJ-UHFFFAOYSA-N 0 3 406.551 4.374 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)c1csc(-c2ccc(F)c(F)c2)n1 ZINC000542820320 939861387 /nfs/dbraw/zinc/86/13/87/939861387.db2.gz VHVRVXIFOXXTJY-UHFFFAOYSA-N 0 3 403.454 4.411 20 0 HIADHN COCC[C@@H](Cc1cccc(F)c1)N[C@H](CCO)c1ccccc1Br ZINC000542852201 939863279 /nfs/dbraw/zinc/86/32/79/939863279.db2.gz VPFBFERTOQNVQU-FXAWDEMLSA-N 0 3 410.327 4.249 20 0 HIADHN CN(C)c1cccc(NCc2cc(Br)ccc2OCc2ccccn2)n1 ZINC000542874588 939864660 /nfs/dbraw/zinc/86/46/60/939864660.db2.gz VISQRSXZQJUHBK-UHFFFAOYSA-N 0 3 413.319 4.496 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)NCC(=O)Nc2nc(-c3ccco3)cs2)cc1 ZINC000542883291 939865077 /nfs/dbraw/zinc/86/50/77/939865077.db2.gz PEDRWGTXOPROAG-AWEZNQCLSA-N 0 3 407.499 4.187 20 0 HIADHN Cc1c2cccc(Br)c2oc1C(=O)N(CCN(C)C)Cc1ccccn1 ZINC000543011549 939894825 /nfs/dbraw/zinc/89/48/25/939894825.db2.gz IHBQTHXRLPOWKF-UHFFFAOYSA-N 0 3 416.319 4.103 20 0 HIADHN O[C@@H](CN[C@H](Cc1ccc(Cl)cc1)c1ccccn1)COc1ccccc1F ZINC000543051762 939909940 /nfs/dbraw/zinc/90/99/40/939909940.db2.gz FTDLALQJSYYIRM-GHTZIAJQSA-N 0 3 400.881 4.187 20 0 HIADHN Cc1nc(-c2ccc(C)cc2NC(=O)CN[C@H](c2ccc(Cl)cc2)C2CC2)n[nH]1 ZINC000543063537 939916561 /nfs/dbraw/zinc/91/65/61/939916561.db2.gz QQVVWQFCTLVKOX-NRFANRHFSA-N 0 3 409.921 4.421 20 0 HIADHN CC(C)OC(=O)C1(C(=O)OC(C)C)CC(N[C@H](C)c2ccc(-c3ccncc3)cc2)C1 ZINC000543089301 939937371 /nfs/dbraw/zinc/93/73/71/939937371.db2.gz YFQAOWYUPSNEEV-GOSISDBHSA-N 0 3 424.541 4.451 20 0 HIADHN C[C@H]1[C@H](NC(=O)c2cccc(OCc3cccnc3)c2)CCN1Cc1ccccc1 ZINC000563760449 945287427 /nfs/dbraw/zinc/28/74/27/945287427.db2.gz RPKNAVUBCFRGPW-YADARESESA-N 0 3 401.510 4.053 20 0 HIADHN O[C@@H](COc1ccccc1C(F)(F)F)CN1CCC(OCCc2ccccc2)CC1 ZINC000543207410 939996149 /nfs/dbraw/zinc/99/61/49/939996149.db2.gz PHZBRDKQLRJSPC-LJQANCHMSA-N 0 3 423.475 4.169 20 0 HIADHN C[C@@H](CN(C)CCC(=O)Nc1ccccc1C(=O)c1ccccc1)c1nccs1 ZINC000543238070 940004779 /nfs/dbraw/zinc/00/47/79/940004779.db2.gz IVSNATALFFLQNG-KRWDZBQOSA-N 0 3 407.539 4.438 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)[C@@H](C)c1c(C)n[nH]c1C)c1ccc(C(F)(F)F)cc1 ZINC000543251601 940009024 /nfs/dbraw/zinc/00/90/24/940009024.db2.gz PPCLELYQEYJHCQ-UGSOOPFHSA-N 0 3 410.484 4.348 20 0 HIADHN CCCc1c(C(=O)Nc2cccc(CN3CCC(O)CC3)c2)cnn1-c1ccccc1 ZINC000543280287 940016913 /nfs/dbraw/zinc/01/69/13/940016913.db2.gz LOVSHDLFMZJCNR-UHFFFAOYSA-N 0 3 418.541 4.034 20 0 HIADHN CN(C(=O)[C@@H]1CCn2c(cnc2C2CCCCC2)C1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000543332398 940033695 /nfs/dbraw/zinc/03/36/95/940033695.db2.gz HJGGJBDOZNISLX-PKTZIBPZSA-N 0 3 420.601 4.226 20 0 HIADHN Cc1cc(-c2nc(C3CC3)no2)ccc1NC(=O)N1CCN(C2CCCCC2)CC1 ZINC000543355630 940040252 /nfs/dbraw/zinc/04/02/52/940040252.db2.gz JSIQPFRPEDLJJS-UHFFFAOYSA-N 0 3 409.534 4.405 20 0 HIADHN CCOc1cc(CN(C)Cc2cn(-c3ccncc3)nc2C)ccc1OC(F)F ZINC000543396078 940050896 /nfs/dbraw/zinc/05/08/96/940050896.db2.gz BUKKDJHETMWDHA-UHFFFAOYSA-N 0 3 402.445 4.208 20 0 HIADHN CCN(C[C@H]1CCN(Cc2ccccc2)C1)C(=O)[C@H](C)CC(=O)c1ccc(OC)cc1 ZINC000543431411 940062223 /nfs/dbraw/zinc/06/22/23/940062223.db2.gz HKMGNHHSQPYVHE-IRLDBZIGSA-N 0 3 422.569 4.275 20 0 HIADHN COC(=O)C[C@@H](NCC(=O)Nc1ccc(Cl)cc1C(F)(F)F)C1CCCCC1 ZINC000543460787 940070798 /nfs/dbraw/zinc/07/07/98/940070798.db2.gz RUKMTISVGUYCIP-MRXNPFEDSA-N 0 3 420.859 4.399 20 0 HIADHN CC[C@H](NCC(=O)N1N=C(c2cc3ccccc3o2)C[C@H]1c1ccco1)[C@@H]1CCCO1 ZINC000543494514 940083822 /nfs/dbraw/zinc/08/38/22/940083822.db2.gz KNZDDWLHQSBEKW-CUWPLCDZSA-N 0 3 421.497 4.251 20 0 HIADHN COc1cc(C[NH2+][C@H]2CCO[C@@H](c3ccc(F)cc3)C2)cc(Br)c1[O-] ZINC000543641751 940146484 /nfs/dbraw/zinc/14/64/84/940146484.db2.gz JDKQYSDYYRNMCC-DOTOQJQBSA-N 0 3 410.283 4.312 20 0 HIADHN COc1cc(-c2ccccc2)ccc1CN[C@@H](CN1CCN(C)CC1)c1ccccc1 ZINC000543761530 940178188 /nfs/dbraw/zinc/17/81/88/940178188.db2.gz YWLGILQJNJNHMH-SANMLTNESA-N 0 3 415.581 4.441 20 0 HIADHN OC[C@@H](NCCOc1ccccc1Br)c1ccc(C(F)(F)F)cc1 ZINC000543806661 940192069 /nfs/dbraw/zinc/19/20/69/940192069.db2.gz DDIUOCMYGPONHJ-OAHLLOKOSA-N 0 3 404.226 4.170 20 0 HIADHN CCCCCc1nnc(NC(=O)CN[C@H](C)c2ccc(-n3ccnc3C)cc2)s1 ZINC000543809214 940193271 /nfs/dbraw/zinc/19/32/71/940193271.db2.gz IQFUMUFZZYOHEA-OAHLLOKOSA-N 0 3 412.563 4.054 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@@H](C)N[C@H](C)c2ccc(-n3ccnc3C)cc2)cc1F ZINC000543813598 940195202 /nfs/dbraw/zinc/19/52/02/940195202.db2.gz ZLGGEAFQGPLGKW-IAGOWNOFSA-N 0 3 424.520 4.026 20 0 HIADHN O=C(CN[C@H](CO)C1CCCCC1)N1N=C(c2cccs2)C[C@@H]1c1cccs1 ZINC000543839363 940205240 /nfs/dbraw/zinc/20/52/40/940205240.db2.gz JCTAQRTZULDMHF-QZTJIDSGSA-N 0 3 417.600 4.018 20 0 HIADHN C[C@@H](NCC(=O)N1CCC(Cc2ccccc2)CC1)c1cccc(-n2ccnc2)c1 ZINC000543866089 940216274 /nfs/dbraw/zinc/21/62/74/940216274.db2.gz FDPUAANUFAHCLP-HXUWFJFHSA-N 0 3 402.542 4.004 20 0 HIADHN C[C@@H](C(=O)N1CCC(F)(c2cccnc2)CC1)N1CCC(Cc2ccccc2)CC1 ZINC000563828538 945307520 /nfs/dbraw/zinc/30/75/20/945307520.db2.gz XTDDZDNBTQKNPB-FQEVSTJZSA-N 0 3 409.549 4.212 20 0 HIADHN C[C@H](N[C@H]1CCCN(Cc2nccn2C)C1=O)c1ccc(Oc2ccccc2)cc1 ZINC000544017002 940300647 /nfs/dbraw/zinc/30/06/47/940300647.db2.gz RYQVZBMUMIZZMJ-AVRDEDQJSA-N 0 3 404.514 4.054 20 0 HIADHN COC(=O)[C@H](NC(=O)c1cccc(CN2CCCC2)c1)c1ccc2ccccc2c1 ZINC000544026874 940303793 /nfs/dbraw/zinc/30/37/93/940303793.db2.gz GLDDHLKJWKGJHT-HSZRJFAPSA-N 0 3 402.494 4.080 20 0 HIADHN CN(C)Cc1cccc(NC(=O)NCCc2c[nH]c3ccc(Br)cc23)c1 ZINC000544042859 940308446 /nfs/dbraw/zinc/30/84/46/940308446.db2.gz YFJGHPMIHOVVBP-UHFFFAOYSA-N 0 3 415.335 4.356 20 0 HIADHN C[C@H]1C[C@H](c2ccccc2)CCN1C(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000544110079 940328861 /nfs/dbraw/zinc/32/88/61/940328861.db2.gz KBRSKJSVWXDVAR-RBBKRZOGSA-N 0 3 421.585 4.121 20 0 HIADHN Cc1cccc([C@@H]2CCN(CC(=O)N3CCC[C@H]3c3ccc4c(c3)OCCCO4)C2)c1 ZINC000544183413 940346481 /nfs/dbraw/zinc/34/64/81/940346481.db2.gz GOZLCDSYCYFSJR-PKTZIBPZSA-N 0 3 420.553 4.309 20 0 HIADHN COc1cc(CNCc2cn(-c3ccncc3)nc2C)ccc1OCc1ccccc1 ZINC000544187835 940347904 /nfs/dbraw/zinc/34/79/04/940347904.db2.gz XHBFHBRJGYPAEA-UHFFFAOYSA-N 0 3 414.509 4.453 20 0 HIADHN Cc1ccc(C(=O)N2CC[C@H](N3CCN(C)CC3)[C@H](C)C2)c(Sc2ccccc2)c1 ZINC000544260173 940371053 /nfs/dbraw/zinc/37/10/53/940371053.db2.gz ZZEKOPNVKVEIPT-OFNKIYASSA-N 0 3 423.626 4.244 20 0 HIADHN Cc1cc(NC(=O)NC[C@@H]2CCCCS2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000544266225 940372827 /nfs/dbraw/zinc/37/28/27/940372827.db2.gz QPZFCNTYXAHTKX-UXHICEINSA-N 0 3 413.591 4.046 20 0 HIADHN CC(C)[C@@H](CN[C@@H](c1ccc(F)cc1)c1cnccn1)N1CCc2ccccc2C1 ZINC000544358842 940400538 /nfs/dbraw/zinc/40/05/38/940400538.db2.gz COFBKFNFVUZMDK-RPBOFIJWSA-N 0 3 404.533 4.378 20 0 HIADHN Cc1cc([C@@H](NC[C@@H](c2ccccc2)N2CCOCC2)c2cccnc2)ccc1F ZINC000544359397 940401068 /nfs/dbraw/zinc/40/10/68/940401068.db2.gz ADJYWMLPASXLPK-LOSJGSFVSA-N 0 3 405.517 4.282 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)c(C)c1CN1CCC(OC[C@H]2CCOC2)CC1 ZINC000544370063 940404388 /nfs/dbraw/zinc/40/43/88/940404388.db2.gz ANEHRYRTKXZBMX-SFHVURJKSA-N 0 3 403.954 4.160 20 0 HIADHN CCc1nc(Cc2noc([C@@]3(C(F)(F)F)CCN(Cc4ccccc4)C3)n2)cs1 ZINC000544382464 940406978 /nfs/dbraw/zinc/40/69/78/940406978.db2.gz HTNCXNKQDOLZPY-LJQANCHMSA-N 0 3 422.476 4.385 20 0 HIADHN CN1CCCN(c2ccc(-c3noc([C@@H]4CCC[C@H](C(F)(F)F)C4)n3)cn2)CC1 ZINC000544397175 940411413 /nfs/dbraw/zinc/41/14/13/940411413.db2.gz YAHDWVCINBBBLQ-ZBFHGGJFSA-N 0 3 409.456 4.110 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(/C=C/c4ccc(F)c(Cl)c4)n3)cn2)CC1 ZINC000544396601 940411496 /nfs/dbraw/zinc/41/14/96/940411496.db2.gz LBOZVXLFEHZBRP-XBXARRHUSA-N 0 3 413.884 4.236 20 0 HIADHN COC(=O)c1ccc(CN[C@H](c2ccc(F)c(F)c2)C(C)(C)N2CCCC2)cc1 ZINC000544407353 940415349 /nfs/dbraw/zinc/41/53/49/940415349.db2.gz HHFOMOZYMQDIMT-OAQYLSRUSA-N 0 3 402.485 4.457 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)N(C)Cc1nc2ccccc2s1)[C@H]1Oc2ccccc2[C@H]1C ZINC000544508536 940460880 /nfs/dbraw/zinc/46/08/80/940460880.db2.gz BRGYALHKIBNZKF-HCROLABASA-N 0 3 409.555 4.186 20 0 HIADHN COc1ccc(-c2ocnc2C(=O)Nc2ccc(CCN3CCSCC3)cc2)cc1 ZINC000563911460 945323150 /nfs/dbraw/zinc/32/31/50/945323150.db2.gz IOKYPRVUIHGSFC-UHFFFAOYSA-N 0 3 423.538 4.194 20 0 HIADHN C[C@@H]1N(CC(=O)N[C@@H](c2ccccc2)c2cccc(Cl)c2)CCC12CCOCC2 ZINC000544547195 940476730 /nfs/dbraw/zinc/47/67/30/940476730.db2.gz LUEPXXLKPCVKJR-MBSDFSHPSA-N 0 3 412.961 4.437 20 0 HIADHN c1ccc([C@@H](NCC2(c3ccc4c(c3)OCCO4)CCCC2)c2cncnc2)cc1 ZINC000544568329 940480711 /nfs/dbraw/zinc/48/07/11/940480711.db2.gz FVFJXBJEWFKZKP-XMMPIXPASA-N 0 3 401.510 4.439 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@H]2CCCC[C@@H]2NCc2ccc(Cn3cccn3)cc2)cc1 ZINC000544583130 940484371 /nfs/dbraw/zinc/48/43/71/940484371.db2.gz UXJIPULZGMDSOY-ZEQRLZLVSA-N 0 3 423.582 4.115 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@@H]2NCc2ccc(Cn3cccn3)cc2)cc1 ZINC000544583124 940484421 /nfs/dbraw/zinc/48/44/21/940484421.db2.gz UXJIPULZGMDSOY-BJKOFHAPSA-N 0 3 423.582 4.115 20 0 HIADHN Cc1ncc(CN[C@@H](C)CC(=O)Nc2cccc(N3CCCC3)c2)n1-c1ccccc1 ZINC000544608465 940489776 /nfs/dbraw/zinc/48/97/76/940489776.db2.gz WBLOJMUAPCTCHH-IBGZPJMESA-N 0 3 417.557 4.288 20 0 HIADHN Cc1ccc([C@H](CNC(=O)NCc2nc3ccccc3n2C2CC2)N2CCCC2)cc1 ZINC000544805258 940516157 /nfs/dbraw/zinc/51/61/57/940516157.db2.gz ALVCTAOGIQGLJP-QHCPKHFHSA-N 0 3 417.557 4.316 20 0 HIADHN Fc1cccc(CN2CCC[C@@H](c3nc(-c4ccnc(N5CCCC5)c4)no3)C2)c1 ZINC000545053850 940537563 /nfs/dbraw/zinc/53/75/63/940537563.db2.gz FPDRVIYHKRQWIU-LJQANCHMSA-N 0 3 407.493 4.251 20 0 HIADHN O=C(Nc1ccc(Cl)cc1OC(F)F)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000545151781 940551428 /nfs/dbraw/zinc/55/14/28/940551428.db2.gz AJKUFGIQIKUYTE-UHFFFAOYSA-N 0 3 424.875 4.398 20 0 HIADHN CCN1CC[C@@H](NCc2cncc(Br)c2)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000545218947 940556682 /nfs/dbraw/zinc/55/66/82/940556682.db2.gz STSYYKRRDPTABD-AEFFLSMTSA-N 0 3 414.269 4.187 20 0 HIADHN COC(=O)[C@@H](C)Cc1ccc(NC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)cc1 ZINC000545428546 940569353 /nfs/dbraw/zinc/56/93/53/940569353.db2.gz LOFDLVBALUUORQ-VQTJNVASSA-N 0 3 423.557 4.167 20 0 HIADHN CC[C@H]1CN(C(=O)c2oc3ccccc3c2CN(C)C)CCN1Cc1ccccc1 ZINC000545445705 940570248 /nfs/dbraw/zinc/57/02/48/940570248.db2.gz SSYLRTRDAHYGFQ-FQEVSTJZSA-N 0 3 405.542 4.231 20 0 HIADHN COc1ccc(C(=O)C(=O)N(C)[C@@H]2CCN(Cc3ccccc3)[C@@H](C)C2)cc1Cl ZINC000545475270 940571310 /nfs/dbraw/zinc/57/13/10/940571310.db2.gz FLFOWEZBLBHDFK-QFBILLFUSA-N 0 3 414.933 4.043 20 0 HIADHN CCN(C(=O)c1csc(Nc2ccccn2)n1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000545492910 940571914 /nfs/dbraw/zinc/57/19/14/940571914.db2.gz XPAALRKAEKJZMZ-SFHVURJKSA-N 0 3 407.543 4.018 20 0 HIADHN C[C@@H](NCC(=O)NCC1(c2ccccc2)CCOCC1)c1ccc2c(c1)CCCC2 ZINC000545505557 940572270 /nfs/dbraw/zinc/57/22/70/940572270.db2.gz ZRYSYXNIXKQYTH-HXUWFJFHSA-N 0 3 406.570 4.081 20 0 HIADHN CCO[C@@H]1C[C@H](NCc2cccc(NC(=O)c3ccc(Cl)cc3)c2)[C@]12CCCO2 ZINC000545547903 940574313 /nfs/dbraw/zinc/57/43/13/940574313.db2.gz LCCKUBKOAXVXJJ-QZNHQXDQSA-N 0 3 414.933 4.409 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(-c4cccc(-c5ccoc5)c4)n3)cn2)CC1 ZINC000545657172 940579240 /nfs/dbraw/zinc/57/92/40/940579240.db2.gz UPIJMFDIXBXDAA-UHFFFAOYSA-N 0 3 401.470 4.201 20 0 HIADHN CC(C)c1nc(Cc2noc(-c3ccc(N4CCN(C(C)C)CC4)cc3)n2)cs1 ZINC000545677462 940580233 /nfs/dbraw/zinc/58/02/33/940580233.db2.gz NSQSUPYDJWOGJB-UHFFFAOYSA-N 0 3 411.575 4.438 20 0 HIADHN C(=C/c1ccc(OCc2cccnc2)cc1)\c1nc(CC2=N[C@@H]3CCCC[C@H]3N2)no1 ZINC000545845739 940629868 /nfs/dbraw/zinc/62/98/68/940629868.db2.gz HBVNKOUBSMNKEF-LGQHIAMJSA-N 0 3 415.497 4.069 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)C1(c2ccccc2Br)CC1)c1ccco1 ZINC000563986298 945337079 /nfs/dbraw/zinc/33/70/79/945337079.db2.gz VHIQHAGOUTYTKT-PBHICJAKSA-N 0 3 405.336 4.319 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)C1(c2ccccc2Br)CC1)c1ccco1 ZINC000563986306 945337116 /nfs/dbraw/zinc/33/71/16/945337116.db2.gz VHIQHAGOUTYTKT-WMLDXEAASA-N 0 3 405.336 4.319 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)c2cscc2Br)N(C)C)cc1 ZINC000563991135 945338675 /nfs/dbraw/zinc/33/86/75/945338675.db2.gz AOWBFWXJNRLECJ-QGZVFWFLSA-N 0 3 411.365 4.331 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)NCc2cc(Cl)cc3c2OCC3)CC1 ZINC000546046012 940681152 /nfs/dbraw/zinc/68/11/52/940681152.db2.gz NLTRDXNWCSKIRB-UHFFFAOYSA-N 0 3 413.949 4.081 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)c3nc(C)oc3-c3ccccc3)cc2)CC1 ZINC000546082202 940694067 /nfs/dbraw/zinc/69/40/67/940694067.db2.gz SAJYZRJQGHTNOE-UHFFFAOYSA-N 0 3 404.514 4.040 20 0 HIADHN CS[C@H]1CN(C(=O)Nc2cccc(Cl)c2SCC(F)F)C[C@H]1N(C)C ZINC000546130048 940707937 /nfs/dbraw/zinc/70/79/37/940707937.db2.gz JIDJZLDIBFZXCQ-OLZOCXBDSA-N 0 3 409.955 4.207 20 0 HIADHN NC(=O)[C@H](Cc1ccc(Cl)cc1)NCc1ccccc1COCc1ccccc1 ZINC000546182237 940723684 /nfs/dbraw/zinc/72/36/84/940723684.db2.gz DIVRNJZACZJOQK-QHCPKHFHSA-N 0 3 408.929 4.243 20 0 HIADHN CN(C)C[C@@H](NC(=O)c1cc2sc(N3CCCC3)nc2s1)c1ccc(F)cc1 ZINC000564021684 945352373 /nfs/dbraw/zinc/35/23/73/945352373.db2.gz KKDMFJKIXBKVIG-OAHLLOKOSA-N 0 3 418.563 4.130 20 0 HIADHN Cc1noc(C)c1CO[C@@H]1CCN(Cc2c(-c3ccccc3)nc3ccccn32)C1 ZINC000546588914 940858920 /nfs/dbraw/zinc/85/89/20/940858920.db2.gz LXQNKDGSGKLPMK-HXUWFJFHSA-N 0 3 402.498 4.397 20 0 HIADHN C[C@](O)(C1CCN(CCC(=O)Nc2cccc(C(F)(F)F)c2)CC1)C(F)(F)F ZINC000546638881 940863782 /nfs/dbraw/zinc/86/37/82/940863782.db2.gz JQTKXICGRUIDFW-INIZCTEOSA-N 0 3 412.374 4.059 20 0 HIADHN CN(C)[C@H](CNc1cnn(C(C)(C)C)c(=O)c1Cl)c1cccc(C(F)(F)F)c1 ZINC000546682027 940868907 /nfs/dbraw/zinc/86/89/07/940868907.db2.gz CKTMLZPMKICSMS-OAHLLOKOSA-N 0 3 416.875 4.385 20 0 HIADHN COCCN1CCC(NC(=O)c2cc(F)ccc2Sc2ccc(Cl)cc2)CC1 ZINC000546808937 940886488 /nfs/dbraw/zinc/88/64/88/940886488.db2.gz NYGLTFCUJGYTKW-UHFFFAOYSA-N 0 3 422.953 4.471 20 0 HIADHN Cc1nnc([C@@H](C)NC(=O)N2CCN(Cc3ccccc3)C3(CCCCC3)C2)s1 ZINC000546843182 940893132 /nfs/dbraw/zinc/89/31/32/940893132.db2.gz UMGCVSQBBGUXSF-QGZVFWFLSA-N 0 3 413.591 4.138 20 0 HIADHN CCN1c2ccc(NC(=O)NC[C@H](c3ccc(C)cc3)N3CCCC3)cc2CCC1=O ZINC000546844844 940893550 /nfs/dbraw/zinc/89/35/50/940893550.db2.gz NRJQAVIPEMHLGA-HSZRJFAPSA-N 0 3 420.557 4.253 20 0 HIADHN CC(C)CCN1Cc2cccc(NS(=O)(=O)c3ccccc3Cn3ccnc3)c2C1 ZINC000546856257 940896205 /nfs/dbraw/zinc/89/62/05/940896205.db2.gz IQKPRVYSWVHDAF-UHFFFAOYSA-N 0 3 424.570 4.094 20 0 HIADHN CCN(C(=O)c1ccc(-c2ccccc2)[nH]c1=O)[C@H]1CCN(Cc2ccccc2)C1 ZINC000546913384 940910820 /nfs/dbraw/zinc/91/08/20/940910820.db2.gz CKRXJDAKOQRTSA-NRFANRHFSA-N 0 3 401.510 4.191 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(-c4cc(-c5ccccc5)ns4)n3)cn2)CC1 ZINC000547068110 940982041 /nfs/dbraw/zinc/98/20/41/940982041.db2.gz SDIOZKSQJYLVGF-UHFFFAOYSA-N 0 3 418.526 4.064 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(/C=C/c4ccc(Cl)s4)n3)cn2)CC1 ZINC000547070477 940982847 /nfs/dbraw/zinc/98/28/47/940982847.db2.gz NNSWZGWNIWUYLI-VMPITWQZSA-N 0 3 401.923 4.159 20 0 HIADHN COc1c(-c2noc([C@@H]3CCCN(Cc4cccnc4)C3)n2)cnc2ccccc21 ZINC000547138905 941008950 /nfs/dbraw/zinc/00/89/50/941008950.db2.gz OOXZASBHMFAGPW-QGZVFWFLSA-N 0 3 401.470 4.068 20 0 HIADHN C[C@@H](c1noc([C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)n1)c1ccncc1 ZINC000547220882 941035994 /nfs/dbraw/zinc/03/59/94/941035994.db2.gz GJBIKYDHKOGPFD-FOIQADDNSA-N 0 3 402.420 4.322 20 0 HIADHN Cc1cc(C(=O)N(Cc2ccccc2)C2CCN(C)CC2)c(C)n1Cc1ccncc1 ZINC000547270317 941049275 /nfs/dbraw/zinc/04/92/75/941049275.db2.gz SVEJYNPIOCWURG-UHFFFAOYSA-N 0 3 416.569 4.285 20 0 HIADHN Cc1ccc([C@H](NCCN2CC=C(C)CC2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000547280439 941051037 /nfs/dbraw/zinc/05/10/37/941051037.db2.gz DWQOZIONHWTMEP-XMMPIXPASA-N 0 3 412.599 4.038 20 0 HIADHN CCN(C(=O)NCc1ccccc1COC(C)C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000547465932 941064158 /nfs/dbraw/zinc/06/41/58/941064158.db2.gz ARRRUXRQRQUNGP-DEOSSOPVSA-N 0 3 409.574 4.418 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N[C@H](C(C)(C)C)C(F)(F)F)c(C)c2)CC1 ZINC000547532259 941067698 /nfs/dbraw/zinc/06/76/98/941067698.db2.gz LLYKIUZZMHTEQL-QGZVFWFLSA-N 0 3 400.489 4.235 20 0 HIADHN CC(=O)[C@@H]1C[C@H](CC(=O)Nc2c(C)cnn2[C@@H]2CCN(Cc3ccccc3)C2)C1(C)C ZINC000547535124 941067923 /nfs/dbraw/zinc/06/79/23/941067923.db2.gz JHACQXONQPHNSP-VSKRKVRLSA-N 0 3 422.573 4.218 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@@H]1CCOc2ccc(F)cc21)c1cccc(OC)c1 ZINC000547699806 941072580 /nfs/dbraw/zinc/07/25/80/941072580.db2.gz SVYZTXKSPWFIDK-NHCUHLMSSA-N 0 3 415.509 4.040 20 0 HIADHN Cc1ccnc2c1cccc2S(=O)(=O)N(C)[C@@H]1CCN(Cc2ccccc2)[C@H](C)C1 ZINC000547966471 941081273 /nfs/dbraw/zinc/08/12/73/941081273.db2.gz PMTCHMYPWVGPMX-TZIWHRDSSA-N 0 3 423.582 4.217 20 0 HIADHN CC(C)(C)[C@@H](NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1)C(F)(F)F ZINC000548066599 941085035 /nfs/dbraw/zinc/08/50/35/941085035.db2.gz GGYJORQAXJDGNM-WXRRBKDZSA-N 0 3 403.411 4.068 20 0 HIADHN CC(C)CN(C(=O)[C@@H]1CCCN(Cc2cccnc2)C1)[C@H]1CCCc2cccnc21 ZINC000548147911 941088879 /nfs/dbraw/zinc/08/88/79/941088879.db2.gz LHPUPFQQGBSQLU-PKTZIBPZSA-N 0 3 406.574 4.251 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2coc(C3CCCCC3)n2)cc1)[C@@H]1CCCN(C)C1 ZINC000548274501 941092805 /nfs/dbraw/zinc/09/28/05/941092805.db2.gz IZKDMLGJMFFZMC-HXUWFJFHSA-N 0 3 424.545 4.141 20 0 HIADHN O=C(NCC1(c2ccc(Cl)cc2Cl)CCOCC1)[C@H](C1CC1)N1CCCC1 ZINC000548508399 941111226 /nfs/dbraw/zinc/11/12/26/941111226.db2.gz DUUARGXEVKNGPQ-IBGZPJMESA-N 0 3 411.373 4.032 20 0 HIADHN CC(C)c1noc(CCC(=O)N[C@@H](c2ccc(F)c(F)c2)C(C)(C)N2CCCC2)n1 ZINC000548601483 941114105 /nfs/dbraw/zinc/11/41/05/941114105.db2.gz HSPPVIHBCWFMPT-FQEVSTJZSA-N 0 3 420.504 4.136 20 0 HIADHN CCc1ccc([C@@H](N[C@H]2CCC23CCOCC3)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000548791843 941124006 /nfs/dbraw/zinc/12/40/06/941124006.db2.gz YSRHTKXXWVUURZ-XZOQPEGZSA-N 0 3 413.583 4.291 20 0 HIADHN CCc1ccc([C@@H](N[C@@H]2CCC23CCOCC3)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000548791840 941124053 /nfs/dbraw/zinc/12/40/53/941124053.db2.gz YSRHTKXXWVUURZ-DHIUTWEWSA-N 0 3 413.583 4.291 20 0 HIADHN CCC(=O)Nc1ccc(C)c(NC(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)c1 ZINC000548954624 941133448 /nfs/dbraw/zinc/13/34/48/941133448.db2.gz NCKOARQEHIEKEU-IBGZPJMESA-N 0 3 402.926 4.421 20 0 HIADHN CN(C)C[C@@H](NC(=O)Nc1cccc(C(=O)NC(C)(C)C)c1)c1ccc(Cl)cc1 ZINC000548972080 941136243 /nfs/dbraw/zinc/13/62/43/941136243.db2.gz FBXHGGJXSHFQTF-LJQANCHMSA-N 0 3 416.953 4.293 20 0 HIADHN CC(=O)Nc1ccc(Cl)c(NC(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)c1 ZINC000548973721 941136977 /nfs/dbraw/zinc/13/69/77/941136977.db2.gz GFSGBHCUTBWVFC-GOSISDBHSA-N 0 3 409.317 4.376 20 0 HIADHN Cc1ccc(CNCc2cc(Cl)ccc2N2CCOCC2)c(-c2cnn(C)c2)c1 ZINC000548981264 941138493 /nfs/dbraw/zinc/13/84/93/941138493.db2.gz CYRNLDPBTYFOBM-UHFFFAOYSA-N 0 3 410.949 4.175 20 0 HIADHN CO[C@H](CN[C@H](CN1CCCC1=O)c1cccc(C(F)(F)F)c1)c1ccccc1 ZINC000549066375 941151693 /nfs/dbraw/zinc/15/16/93/941151693.db2.gz VECPUIMSWQCKFD-WOJBJXKFSA-N 0 3 406.448 4.346 20 0 HIADHN CCOc1ccccc1NC(=O)CN[C@H]1CCN(CC)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000549111304 941160713 /nfs/dbraw/zinc/16/07/13/941160713.db2.gz PCIUABXBEQWARJ-SIKLNZKXSA-N 0 3 419.928 4.241 20 0 HIADHN Cc1cccc(NC(=O)CN[C@@H]2CCN(C(C)C)[C@H]2c2ccc(F)c(F)c2)c1C ZINC000549113890 941161216 /nfs/dbraw/zinc/16/12/16/941161216.db2.gz UBUCFWONJHCGMR-GGAORHGYSA-N 0 3 401.501 4.334 20 0 HIADHN CCN1CC[C@@H](NCC(=O)Nc2cccc(C)c2C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000549115385 941161329 /nfs/dbraw/zinc/16/13/29/941161329.db2.gz GWWGQZJGSUYFIQ-IFMALSPDSA-N 0 3 403.929 4.460 20 0 HIADHN CC[C@H](C)C(=O)Nc1cccc(CNC[C@H](O)COc2ccc3ccccc3c2)c1 ZINC000549159486 941167055 /nfs/dbraw/zinc/16/70/55/941167055.db2.gz VDWQSEYFUUQPOX-MBSDFSHPSA-N 0 3 406.526 4.354 20 0 HIADHN CC[C@@H](C)C(=O)Nc1cccc(CNC[C@H](O)COc2ccc3ccccc3c2)c1 ZINC000549159485 941167096 /nfs/dbraw/zinc/16/70/96/941167096.db2.gz VDWQSEYFUUQPOX-JPYJTQIMSA-N 0 3 406.526 4.354 20 0 HIADHN COc1cc2c(cc1F)CC[C@H]2NC(=O)N(CCCc1ccccc1)CCN(C)C ZINC000549236956 941173017 /nfs/dbraw/zinc/17/30/17/941173017.db2.gz RCKZGXXPPVQPPI-JOCHJYFZSA-N 0 3 413.537 4.028 20 0 HIADHN COCCCn1nccc1CNCCOc1ccc2cc(Br)ccc2c1 ZINC000549246321 941173890 /nfs/dbraw/zinc/17/38/90/941173890.db2.gz UOCMCUMBIIYYJQ-UHFFFAOYSA-N 0 3 418.335 4.004 20 0 HIADHN C[C@H]1CCN(C(=O)Nc2ccc3nnc(C4CCC4)n3c2)CCN1Cc1ccccc1 ZINC000549283531 941176793 /nfs/dbraw/zinc/17/67/93/941176793.db2.gz NZKBXVQLEMHDNW-SFHVURJKSA-N 0 3 418.545 4.125 20 0 HIADHN CC(C)c1noc(Cc2ccc(NC(=O)N(CCN(C)C)Cc3ccccc3)cc2)n1 ZINC000549378060 941184182 /nfs/dbraw/zinc/18/41/82/941184182.db2.gz KTBASWCCMKEVKQ-UHFFFAOYSA-N 0 3 421.545 4.380 20 0 HIADHN CCN1CCN(c2ccc(NCc3ccc(C)cc3-c3cnn(C)c3)c(C)c2)CC1 ZINC000549401162 941186215 /nfs/dbraw/zinc/18/62/15/941186215.db2.gz NUZUMJVOUWEALY-UHFFFAOYSA-N 0 3 403.574 4.458 20 0 HIADHN CCc1oc(CNCC2(c3cc(Cl)ccc3OC)CCOCC2)cc1C(=O)OC ZINC000549403278 941186674 /nfs/dbraw/zinc/18/66/74/941186674.db2.gz KHPVWCAEGZSYKH-UHFFFAOYSA-N 0 3 421.921 4.129 20 0 HIADHN CN(C)C[C@H](NC(=O)N[C@H](c1ccc(F)cc1)[C@H]1CCCO1)c1ccc(Cl)cc1 ZINC000549414608 941187470 /nfs/dbraw/zinc/18/74/70/941187470.db2.gz KIBIVTOCFAIPBG-PWRODBHTSA-N 0 3 419.928 4.301 20 0 HIADHN CC(=O)Nc1ccc(OC[C@H](O)CN(Cc2ccc(C(C)C)nc2C)C(C)C)cc1 ZINC000549426440 941188760 /nfs/dbraw/zinc/18/87/60/941188760.db2.gz RWVHUGCZTRWMOW-JOCHJYFZSA-N 0 3 413.562 4.122 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3cccc4[nH]c(C)nc43)c(OCC)c2)CC1 ZINC000549454726 941191679 /nfs/dbraw/zinc/19/16/79/941191679.db2.gz VNQFAAFMNPTOQI-UHFFFAOYSA-N 0 3 421.545 4.054 20 0 HIADHN CCN1CC[C@H](NCc2ccc(C(F)(F)F)cn2)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000549471670 941193460 /nfs/dbraw/zinc/19/34/60/941193460.db2.gz OADSEVGPRQAEIY-WMZOPIPTSA-N 0 3 403.370 4.443 20 0 HIADHN COc1ccc(C)cc1NC(=O)CN[C@@H]1CCN(C(C)C)[C@H]1c1ccc(F)c(F)c1 ZINC000549475052 941194064 /nfs/dbraw/zinc/19/40/64/941194064.db2.gz CBEMRTCSFFRRQH-XXBNENTESA-N 0 3 417.500 4.034 20 0 HIADHN CCc1cccc(CC)c1NC(=O)CN[C@@H]1CCN(C2CC2)[C@@H]1c1cccc(OC)c1 ZINC000549477372 941194566 /nfs/dbraw/zinc/19/45/66/941194566.db2.gz JQBZVLZOPNDZCB-ZEQKJWHPSA-N 0 3 421.585 4.326 20 0 HIADHN CCN1CC[C@H](NCC(=O)Nc2cc(C)cc(C)c2)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000549483173 941195288 /nfs/dbraw/zinc/19/52/88/941195288.db2.gz QQNCUBDSFACRRK-SIKLNZKXSA-N 0 3 405.464 4.084 20 0 HIADHN CN(C)C[C@@H](NC(=O)c1cc(COc2ccccc2F)on1)c1ccc(Cl)cc1 ZINC000549617425 941201559 /nfs/dbraw/zinc/20/15/59/941201559.db2.gz NJNGRYFOFHPGBI-LJQANCHMSA-N 0 3 417.868 4.079 20 0 HIADHN CCOc1c(Cl)cc(CN(Cc2ccc(-n3cncn3)cc2)C2CC2)cc1OC ZINC000549847104 941213921 /nfs/dbraw/zinc/21/39/21/941213921.db2.gz DSIKUBCHADAFGD-UHFFFAOYSA-N 0 3 412.921 4.493 20 0 HIADHN CC(=O)c1ccc2c(c1)CCN(C[C@H](O)CO[C@H](C)c1ccc(Cl)cc1)CC2 ZINC000549970624 941255074 /nfs/dbraw/zinc/25/50/74/941255074.db2.gz JPXURRLWAGICPC-HXOBKFHXSA-N 0 3 401.934 4.082 20 0 HIADHN CC(C)[C@@]1(CO)CCCN(CC(=O)N2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)C1 ZINC000550063364 941277416 /nfs/dbraw/zinc/27/74/16/941277416.db2.gz LQDWZRVBFWDTAY-CTNGQTDRSA-N 0 3 413.389 4.387 20 0 HIADHN CCOc1ccc(-c2nc(CN[C@@H](C)C3CCN(CC(F)(F)F)CC3)co2)cc1 ZINC000550078049 941280744 /nfs/dbraw/zinc/28/07/44/941280744.db2.gz OVHAJIYZUNXEHA-HNNXBMFYSA-N 0 3 411.468 4.493 20 0 HIADHN O=C([C@@H](NC1(Cc2ccc(F)cc2)CCOCC1)c1ccccc1)N1CCCCC1 ZINC000550180757 941294649 /nfs/dbraw/zinc/29/46/49/941294649.db2.gz XENXXUOGRUETRS-QHCPKHFHSA-N 0 3 410.533 4.261 20 0 HIADHN Fc1ccc(CC2(NCc3cn(-c4ccc(F)c(Cl)c4)nn3)CCOCC2)cc1 ZINC000550179678 941294792 /nfs/dbraw/zinc/29/47/92/941294792.db2.gz GXKZBEGOBHWZPZ-UHFFFAOYSA-N 0 3 418.875 4.080 20 0 HIADHN CN(C(=O)N[C@H]1CCc2cc(Cl)ccc21)C1CCN(CCc2ccccn2)CC1 ZINC000550218909 941300524 /nfs/dbraw/zinc/30/05/24/941300524.db2.gz YRXOBBOUIVDQBH-QFIPXVFZSA-N 0 3 412.965 4.071 20 0 HIADHN C/C=C/c1ccc(OC[C@H](O)CNCc2cc(F)cc(Br)c2)c(OC)c1 ZINC000550624280 941346945 /nfs/dbraw/zinc/34/69/45/941346945.db2.gz NDRJBSUVXMCXLC-OAJJDEHYSA-N 0 3 424.310 4.159 20 0 HIADHN CN1CCN(C[C@H](N[C@@H]2CCc3sc(Br)cc32)c2ccccc2)CC1 ZINC000550644655 941348946 /nfs/dbraw/zinc/34/89/46/941348946.db2.gz WPIABXQZWHDJTB-MSOLQXFVSA-N 0 3 420.420 4.076 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1ccc(-c2nncs2)cc1)c1ccsc1 ZINC000550672189 941352887 /nfs/dbraw/zinc/35/28/87/941352887.db2.gz XLYXDRMPBJQZHQ-QGZVFWFLSA-N 0 3 401.561 4.471 20 0 HIADHN Cc1cc(CN[C@@H]2CCCc3cc(S(N)(=O)=O)ccc32)ccc1-c1ccccc1 ZINC000550793965 941367594 /nfs/dbraw/zinc/36/75/94/941367594.db2.gz CWVLZMMROGGZKQ-XMMPIXPASA-N 0 3 406.551 4.477 20 0 HIADHN Fc1ccc([C@@H](NC[C@@H]2CCCCN2Cc2cccc(Cl)c2)c2nnc[nH]2)cc1 ZINC000551050348 941400754 /nfs/dbraw/zinc/40/07/54/941400754.db2.gz FXCMCKWHMHSMBG-LEWJYISDSA-N 0 3 413.928 4.331 20 0 HIADHN NS(=O)(=O)c1ccc2c(c1)CCC[C@H]2N[C@H](c1ccccc1F)C1CCCC1 ZINC000551063522 941403196 /nfs/dbraw/zinc/40/31/96/941403196.db2.gz SLUJDQYRWHBKJE-YADHBBJMSA-N 0 3 402.535 4.372 20 0 HIADHN Cc1cccc(-c2n[nH]cc2CNc2ccc(C(=O)N(C)[C@H]3CCCN(C)C3)cc2)c1 ZINC000551090761 941407961 /nfs/dbraw/zinc/40/79/61/941407961.db2.gz GVBIXEQPVKWDFM-QHCPKHFHSA-N 0 3 417.557 4.163 20 0 HIADHN Cc1ccc(-c2noc([C@H](C)N[C@@H](C)C3CCN(CC(F)(F)F)CC3)n2)cc1F ZINC000551093593 941408800 /nfs/dbraw/zinc/40/88/00/941408800.db2.gz OYMXAYGPJDTVJL-KBPBESRZSA-N 0 3 414.447 4.498 20 0 HIADHN CN(C)Cc1ccc(S(=O)(=O)N2CCCC[C@H]2c2nc(-c3ccccc3)c[nH]2)cc1 ZINC000551204830 941426925 /nfs/dbraw/zinc/42/69/25/941426925.db2.gz CGTLXXWSBXPGSO-QFIPXVFZSA-N 0 3 424.570 4.054 20 0 HIADHN C[C@H](NCc1coc2ccccc12)c1ccc(S(=O)(=O)NCc2ccco2)cc1 ZINC000551208702 941427848 /nfs/dbraw/zinc/42/78/48/941427848.db2.gz RRCMDOIVHVSNIR-INIZCTEOSA-N 0 3 410.495 4.355 20 0 HIADHN O=S1(=O)CC[C@H](NC[C@@H]2C[C@H]2c2ccccc2)c2cc(Br)ccc21 ZINC000551272922 941440765 /nfs/dbraw/zinc/44/07/65/941440765.db2.gz RGMILWCHGWUQID-ZVZYQTTQSA-N 0 3 406.345 4.061 20 0 HIADHN C[C@H](c1ccc(F)cc1)N1CCC[C@@H](N[C@@H](C)c2ccc(-n3cccn3)cc2)C1=O ZINC000551274802 941441557 /nfs/dbraw/zinc/44/15/57/941441557.db2.gz NFTBDBWZAJZLQO-YZZKKUAISA-N 0 3 406.505 4.414 20 0 HIADHN C[C@@H](CS(=O)(=O)c1ccccc1)NCCc1ccc(Br)cc1Cl ZINC000551307594 941448118 /nfs/dbraw/zinc/44/81/18/941448118.db2.gz SRKBXXPJTZNQIT-ZDUSSCGKSA-N 0 3 416.768 4.097 20 0 HIADHN C[C@H](N[C@H]1CCC(=O)N[C@H]1C1CC1)c1nc2cc(Cl)ccc2n1Cc1ccccc1 ZINC000551368806 941463022 /nfs/dbraw/zinc/46/30/22/941463022.db2.gz RBIWTSPXVSBADE-FOMLIJIXSA-N 0 3 422.960 4.446 20 0 HIADHN c1ccc(CN2CCCO[C@@H](CSc3nnc4sc5ccccc5n34)C2)cc1 ZINC000551389481 941467479 /nfs/dbraw/zinc/46/74/79/941467479.db2.gz UEBGPRKSTGMSJC-QGZVFWFLSA-N 0 3 410.568 4.327 20 0 HIADHN Cc1nc2c(cccc2-c2noc(-c3ccc(N4CCN(C(C)C)CC4)cc3)n2)[nH]1 ZINC000551430212 941477650 /nfs/dbraw/zinc/47/76/50/941477650.db2.gz YCQGCWDKZNQYJU-UHFFFAOYSA-N 0 3 402.502 4.119 20 0 HIADHN COc1cc(Cl)c(C)cc1NC(=O)CCN[C@@H](C)c1cnc(OC)c(Cl)c1 ZINC000551533061 941496495 /nfs/dbraw/zinc/49/64/95/941496495.db2.gz JTUIHWDHPUVWRN-LBPRGKRZSA-N 0 3 412.317 4.393 20 0 HIADHN C[C@H](CC(=O)Nc1ccc(OC(F)(F)F)cc1)NCc1ccnc(OC(F)F)c1 ZINC000551570097 941504027 /nfs/dbraw/zinc/50/40/27/941504027.db2.gz BAIFBTOBOXQNRL-LLVKDONJSA-N 0 3 419.350 4.089 20 0 HIADHN COc1cc(OC)cc(Oc2ccc(CNCc3cnc4n[nH]c(C)c4c3)cc2)c1 ZINC000551588526 941507739 /nfs/dbraw/zinc/50/77/39/941507739.db2.gz XTMIKFFELLQUTF-UHFFFAOYSA-N 0 3 404.470 4.366 20 0 HIADHN COCC[C@@H](N[C@@H]1CCCN(CC(F)(F)F)C1=O)c1ccc(Cl)c(Cl)c1 ZINC000551724180 941533734 /nfs/dbraw/zinc/53/37/34/941533734.db2.gz MRGPADGYGLMKPE-HUUCEWRRSA-N 0 3 413.267 4.214 20 0 HIADHN Cc1cc(OC[C@H](O)CNCc2ccc3c(c2)OCCO3)c(C(C)C)cc1Cl ZINC000551972948 941564814 /nfs/dbraw/zinc/56/48/14/941564814.db2.gz WQKKZHOLJBODHO-QGZVFWFLSA-N 0 3 405.922 4.073 20 0 HIADHN O[C@@H](CN[C@H]1CCCOc2ccc(F)cc21)COc1cc(Cl)ccc1Cl ZINC000552029157 941570761 /nfs/dbraw/zinc/57/07/61/941570761.db2.gz LDOQXNXQKPCTJE-YOEHRIQHSA-N 0 3 400.277 4.376 20 0 HIADHN CN(CCCN(C)Cc1nc(-c2cccc(Br)c2)no1)Cc1ccco1 ZINC000552057758 941575666 /nfs/dbraw/zinc/57/56/66/941575666.db2.gz GSMFCBYQRFESOR-UHFFFAOYSA-N 0 3 419.323 4.046 20 0 HIADHN C[C@H](NCC1(S(C)(=O)=O)CCCC1)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000552097483 941584711 /nfs/dbraw/zinc/58/47/11/941584711.db2.gz CZHRJCASLMBOLL-KRWDZBQOSA-N 0 3 405.535 4.413 20 0 HIADHN COc1cccc(NC(=O)C[C@@H](C)N[C@H](CCO)c2ccc(Cl)c(Cl)c2)c1 ZINC000552100722 941585242 /nfs/dbraw/zinc/58/52/42/941585242.db2.gz SLVIKSRNRVMRJY-BFUOFWGJSA-N 0 3 411.329 4.432 20 0 HIADHN COc1ccc(Nc2ccccc2C(=O)N(C)CCCN(C)Cc2ccncc2)cc1 ZINC000552111963 941586695 /nfs/dbraw/zinc/58/66/95/941586695.db2.gz CRYBDRQCRMIOTP-UHFFFAOYSA-N 0 3 418.541 4.428 20 0 HIADHN C[C@@H](CC(=O)Nc1cc(C(F)(F)F)ccc1Cl)NCc1cnc2n1CCCC2 ZINC000552153579 941594873 /nfs/dbraw/zinc/59/48/73/941594873.db2.gz MXRXPOKSCRNBJZ-LBPRGKRZSA-N 0 3 414.859 4.399 20 0 HIADHN Cc1nc([C@H]2CCCN2C(=O)[C@@H]2CN(Cc3ccccc3)CCC2(F)F)cs1 ZINC000552170119 941596647 /nfs/dbraw/zinc/59/66/47/941596647.db2.gz ZTLKOSXMRMCSET-PKOBYXMFSA-N 0 3 405.514 4.272 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)[C@@H]1C[C@H]1c1cc(Cl)cc(Cl)c1 ZINC000552200466 941601357 /nfs/dbraw/zinc/60/13/57/941601357.db2.gz FKMBUWIUNLNJRM-SLFFLAALSA-N 0 3 405.325 4.302 20 0 HIADHN COc1cc(NC(=O)[C@H]2CN(Cc3ccccc3)CCC2(F)F)c(C)c(OC)c1 ZINC000552212837 941604429 /nfs/dbraw/zinc/60/44/29/941604429.db2.gz ULRIKWPVVWRVOI-GOSISDBHSA-N 0 3 404.457 4.108 20 0 HIADHN C[C@@H](NC[C@@H](c1ccc(Cl)cc1)N(C)CCC(F)(F)F)c1ccc(=O)[nH]n1 ZINC000552266702 941617705 /nfs/dbraw/zinc/61/77/05/941617705.db2.gz ZMWPRGDUGHPKCN-WBMJQRKESA-N 0 3 402.848 4.112 20 0 HIADHN CO[C@@H]1C[C@@H](c2ccccc2)CC[C@@H]1NCC(=O)Nc1ccccc1Br ZINC000552268108 941618284 /nfs/dbraw/zinc/61/82/84/941618284.db2.gz ABAGHLIKTBXEFW-FFZOFVMBSA-N 0 3 417.347 4.329 20 0 HIADHN CO[C@@H]1C[C@@H](c2ccccc2)CC[C@H]1NCC(=O)Nc1ccccc1Br ZINC000552268111 941618292 /nfs/dbraw/zinc/61/82/92/941618292.db2.gz ABAGHLIKTBXEFW-PWIZWCRZSA-N 0 3 417.347 4.329 20 0 HIADHN OC[C@@H](CN[C@H](c1ncc[nH]1)C1CCCCC1)Cc1ccccc1OC(F)(F)F ZINC000552270756 941619240 /nfs/dbraw/zinc/61/92/40/941619240.db2.gz BIIUWXXQMMUBNL-BEFAXECRSA-N 0 3 411.468 4.371 20 0 HIADHN C[C@@H](N[C@@H]1CCC(=O)N[C@H]1C(C)(C)C)c1ccc(OC(F)F)cc1OC(F)F ZINC000552296332 941624786 /nfs/dbraw/zinc/62/47/86/941624786.db2.gz HPVZJIMQSAMJQU-CKUKBARFSA-N 0 3 406.420 4.233 20 0 HIADHN CN(C(=O)c1cccc(C(=O)Nc2ccccc2)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000552330537 941633651 /nfs/dbraw/zinc/63/36/51/941633651.db2.gz VSNVZNXMQJFZRQ-XMMPIXPASA-N 0 3 413.521 4.285 20 0 HIADHN COc1ccc(NC(=O)C[C@H](C)N[C@@H](CCO)c2ccc(Cl)c(Cl)c2)cc1 ZINC000552342614 941638711 /nfs/dbraw/zinc/63/87/11/941638711.db2.gz PTWRPPDAUUYKQT-DJJJIMSYSA-N 0 3 411.329 4.432 20 0 HIADHN O=C(Cc1coc2ccccc12)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000552365459 941646518 /nfs/dbraw/zinc/64/65/18/941646518.db2.gz CMTKDHXHKXUBCH-FQEVSTJZSA-N 0 3 400.482 4.258 20 0 HIADHN CN1CC[C@H](NC(=O)C2(c3cc(F)cc(Br)c3)CC2)[C@H]1c1ccccc1 ZINC000552397974 941657106 /nfs/dbraw/zinc/65/71/06/941657106.db2.gz SATDXFMXHVDZLN-RBUKOAKNSA-N 0 3 417.322 4.181 20 0 HIADHN C[C@H](Cc1cccc(C(F)(F)F)c1)C(=O)Nc1cccc(CN2CC[C@H](O)C2)c1 ZINC000552516472 941693472 /nfs/dbraw/zinc/69/34/72/941693472.db2.gz UKPTXJCUJLIGHF-QRWLVFNGSA-N 0 3 406.448 4.089 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)c1ccc(C(=O)NC2CC2)cc1)c1ccc(Cl)cc1 ZINC000552582065 941712610 /nfs/dbraw/zinc/71/26/10/941712610.db2.gz VTOZCFKZLSEDMM-NRFANRHFSA-N 0 3 413.949 4.045 20 0 HIADHN CO[C@@H](c1ccc(F)cc1)[C@H](C)NC(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000552775704 941758917 /nfs/dbraw/zinc/75/89/17/941758917.db2.gz POLRVJVSAGWTPA-FDDCHVKYSA-N 0 3 413.537 4.208 20 0 HIADHN COc1ccc(CN(Cc2cc(=O)c(OC)co2)[C@H]2CCCC[C@H]2C)cc1OC ZINC000552835457 941782225 /nfs/dbraw/zinc/78/22/25/941782225.db2.gz MPPOBVBGDWKWIF-APWZRJJASA-N 0 3 401.503 4.247 20 0 HIADHN Cc1cc(NC(=O)c2cccc(F)c2)sc1C(=O)N1C[C@H](N2CCCC2)C[C@@H]1C ZINC000553102413 941833264 /nfs/dbraw/zinc/83/32/64/941833264.db2.gz PAQWRSUWBJMRGY-MAUKXSAKSA-N 0 3 415.534 4.147 20 0 HIADHN Cc1nn(-c2ccccc2C)c2sc(C(=O)N3C[C@H](N4CCCC4)C[C@@H]3C)cc12 ZINC000553168235 941843787 /nfs/dbraw/zinc/84/37/87/941843787.db2.gz CJBOKELYYPEYKI-FUHWJXTLSA-N 0 3 408.571 4.403 20 0 HIADHN O=C([C@@H]1CCCC[C@H]1C(F)(F)F)N1CCC[C@H](c2n[nH]cc2CN2CCCC2)C1 ZINC000553180830 941845627 /nfs/dbraw/zinc/84/56/27/941845627.db2.gz JYLHIRYLTVKVOB-CGTJXYLNSA-N 0 3 412.500 4.080 20 0 HIADHN O=C(CCc1ccoc1)N(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000553196550 941847913 /nfs/dbraw/zinc/84/79/13/941847913.db2.gz SMYMFVBOLFTJKC-XMMPIXPASA-N 0 3 403.526 4.301 20 0 HIADHN COc1cc(C)c([C@H](C)NC(=O)CN[C@@H](c2ccc(F)c(C)c2)C2CC2)cc1OC ZINC000553283704 941860454 /nfs/dbraw/zinc/86/04/54/941860454.db2.gz FCSLYIWANXOIAW-UPCLLVRISA-N 0 3 414.521 4.378 20 0 HIADHN Cc1cccc([C@H](C)NCC(=O)Nc2nc(CN3CCC(C)CC3)cs2)c1C ZINC000553338084 941869291 /nfs/dbraw/zinc/86/92/91/941869291.db2.gz QICZTLJBGITALR-SFHVURJKSA-N 0 3 400.592 4.281 20 0 HIADHN COc1cc(CNCc2ccc(F)c3cccnc23)cc(Br)c1OC ZINC000553445906 941886208 /nfs/dbraw/zinc/88/62/08/941886208.db2.gz HLALWUNQNFJRQT-UHFFFAOYSA-N 0 3 405.267 4.443 20 0 HIADHN CC[C@H](NC(=O)N[C@H]1CCN([C@H](C)c2ccccc2)C1)c1ccc(OC)c(OC)c1 ZINC000553485005 941893822 /nfs/dbraw/zinc/89/38/22/941893822.db2.gz REXXDQZRQFCRBT-QMMLZNLJSA-N 0 3 411.546 4.290 20 0 HIADHN COc1ccccc1[C@H]1C[C@@H](C)CCN1C(=O)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000553488942 941894755 /nfs/dbraw/zinc/89/47/55/941894755.db2.gz IEQWLLVQPSKKPB-IEIRFRATSA-N 0 3 407.558 4.302 20 0 HIADHN CC(C)Oc1ccc(-c2nn(-c3ccccc3)cc2CNC[C@H](O)C(F)F)cc1 ZINC000553530128 941903934 /nfs/dbraw/zinc/90/39/34/941903934.db2.gz ATXXHIAWDMOEEW-FQEVSTJZSA-N 0 3 401.457 4.042 20 0 HIADHN Cc1cc(C(=O)N(C)CCCN(C)Cc2ccco2)cc(C)c1OCc1cccnc1 ZINC000553740901 941956720 /nfs/dbraw/zinc/95/67/20/941956720.db2.gz KNXKWKCXNRGHPU-UHFFFAOYSA-N 0 3 421.541 4.465 20 0 HIADHN C[C@@H]1C[C@@H]1N1CCN(C(=O)c2cc(Cl)cc(Br)c2F)C[C@@H](C)C1 ZINC000553782959 941967635 /nfs/dbraw/zinc/96/76/35/941967635.db2.gz GAQFORVOSUGXMY-RWSFTLGLSA-N 0 3 403.723 4.044 20 0 HIADHN Cc1cc(C(=O)N2CCN([C@@H]3C[C@H]3C)C[C@@H](C)C2)nn1-c1ccc(Cl)c(Cl)c1 ZINC000553782636 941967788 /nfs/dbraw/zinc/96/77/88/941967788.db2.gz CRFKZRIZZBJEFL-ARGWCVDVSA-N 0 3 421.372 4.290 20 0 HIADHN Cc1ccc(-c2cc(C(=O)N(C)[C@@H]3CN4CCC3CC4)c3cnn(C(C)C)c3n2)s1 ZINC000554017737 942020322 /nfs/dbraw/zinc/02/03/22/942020322.db2.gz STMXATVTOFZUJW-HXUWFJFHSA-N 0 3 423.586 4.215 20 0 HIADHN C[C@@H](NC(=O)Nc1ccccc1C(=O)N1CCCCC1)[C@@H](c1ccccc1)N(C)C ZINC000554111762 942038894 /nfs/dbraw/zinc/03/88/94/942038894.db2.gz BKVOSMVERCKRAI-GCJKJVERSA-N 0 3 408.546 4.126 20 0 HIADHN CC(C)n1c2ccc(C(=O)N3CCN([C@@H]4C[C@H]4C)C[C@H](C)C3)cc2nc1C(F)(F)F ZINC000554113207 942039273 /nfs/dbraw/zinc/03/92/73/942039273.db2.gz KDCXOOOSMWKTOO-QMTMVMCOSA-N 0 3 422.495 4.438 20 0 HIADHN CC(C)n1c2ccc(C(=O)N3CCN([C@H]4C[C@H]4C)C[C@H](C)C3)cc2nc1C(F)(F)F ZINC000554113204 942039434 /nfs/dbraw/zinc/03/94/34/942039434.db2.gz KDCXOOOSMWKTOO-KHYOSLBOSA-N 0 3 422.495 4.438 20 0 HIADHN C[C@H](NCc1ccc2c(c1)OCCO2)c1ccc(OC[C@@H]2CCCCO2)c(F)c1 ZINC000554114830 942040204 /nfs/dbraw/zinc/04/02/04/942040204.db2.gz QMKIWABSVVADOP-LPHOPBHVSA-N 0 3 401.478 4.396 20 0 HIADHN CCCOc1ccc(-c2nc(C(=O)N3CCN([C@@H]4C[C@@H]4C)C[C@@H](C)C3)cs2)cc1 ZINC000554128229 942043490 /nfs/dbraw/zinc/04/34/90/942043490.db2.gz FRSMEMJDLLYLDR-LLGFUMIMSA-N 0 3 413.587 4.401 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)Nc1cccc(C(=O)NC(C)(C)C)c1)c1ccco1 ZINC000554133388 942045512 /nfs/dbraw/zinc/04/55/12/942045512.db2.gz WAXMFVFJHVCYQA-CRAIPNDOSA-N 0 3 400.523 4.059 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)Nc1ccc(C(=O)NC(C)(C)C)cc1)c1ccco1 ZINC000554135412 942046174 /nfs/dbraw/zinc/04/61/74/942046174.db2.gz KKXBXAGQUZUMFJ-QAPCUYQASA-N 0 3 400.523 4.059 20 0 HIADHN C[C@H]1Oc2cc(F)ccc2[C@H]1NC(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000554183504 942061255 /nfs/dbraw/zinc/06/12/55/942061255.db2.gz YBZBLUYUSMHUFD-VFNWGFHPSA-N 0 3 415.534 4.061 20 0 HIADHN CCOc1ccc([C@@H](C)NC(=O)N[C@H](CN(C)C)c2ccc(F)cc2)cc1OCC ZINC000554254019 942080692 /nfs/dbraw/zinc/08/06/92/942080692.db2.gz WIUPYDHUIVCSPG-OXQOHEQNSA-N 0 3 417.525 4.286 20 0 HIADHN COc1ccc(CN2CC[C@@H](N[C@@H](C)c3cc4ccccc4s3)C2=O)c(OC)c1 ZINC000554355855 942111707 /nfs/dbraw/zinc/11/17/07/942111707.db2.gz JQHMIAYISZZLFG-HNAYVOBHSA-N 0 3 410.539 4.370 20 0 HIADHN CSc1ccc([C@H](C)N[C@@H]2CCCN(S(=O)(=O)c3cccs3)C2)cc1F ZINC000554369757 942116898 /nfs/dbraw/zinc/11/68/98/942116898.db2.gz CHYXZEBFYMGYGV-DZGCQCFKSA-N 0 3 414.593 4.113 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1ccc(OC[C@H]2CCCO2)cc1)c1ccco1 ZINC000554397682 942126055 /nfs/dbraw/zinc/12/60/55/942126055.db2.gz AHGGMUCKVKOUEH-PWIZWCRZSA-N 0 3 401.507 4.088 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)Nc1ccc(NC(=O)c2ccco2)cc1)c1ccco1 ZINC000554400835 942127296 /nfs/dbraw/zinc/12/72/96/942127296.db2.gz FJPXYCXZEMPEAW-QAPCUYQASA-N 0 3 410.474 4.376 20 0 HIADHN COc1cc(Br)cc(C)c1NC(=O)N[C@H](CN(C)C)c1ccc(F)cc1 ZINC000554426378 942138487 /nfs/dbraw/zinc/13/84/87/942138487.db2.gz REFXILRJPVOMTA-MRXNPFEDSA-N 0 3 424.314 4.330 20 0 HIADHN COc1cc(Br)cc(C)c1NC(=O)N[C@@H](CN(C)C)c1ccc(F)cc1 ZINC000554426377 942138757 /nfs/dbraw/zinc/13/87/57/942138757.db2.gz REFXILRJPVOMTA-INIZCTEOSA-N 0 3 424.314 4.330 20 0 HIADHN COC[C@H](NC(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1)c1cccc(Cl)c1 ZINC000554692646 942200644 /nfs/dbraw/zinc/20/06/44/942200644.db2.gz ZLCDWHWXMGGXDH-NDXORKPFSA-N 0 3 401.938 4.162 20 0 HIADHN CSc1ccc([C@H](CNC(=O)Cc2nc(-c3ccccc3)oc2C)N(C)C)cc1 ZINC000554707939 942206573 /nfs/dbraw/zinc/20/65/73/942206573.db2.gz VOKIASQTROOWAH-NRFANRHFSA-N 0 3 409.555 4.334 20 0 HIADHN C[C@H](NCC(=O)Nc1cccc(C(=O)NC2CC2)c1)c1ccc(F)c2ccccc21 ZINC000554742241 942216563 /nfs/dbraw/zinc/21/65/63/942216563.db2.gz CCUNCTNGSIWUOC-HNNXBMFYSA-N 0 3 405.473 4.160 20 0 HIADHN CCCN(CCN1CCCCCC1)C(=O)c1cc(COc2ccccc2F)on1 ZINC000554782146 942234211 /nfs/dbraw/zinc/23/42/11/942234211.db2.gz KJCYHXHHZKTJFL-UHFFFAOYSA-N 0 3 403.498 4.121 20 0 HIADHN CCOc1c(Cl)cc(CNC[C@H](O)CO[C@@H]2CCCc3ccccc32)cc1OC ZINC000554831631 942269311 /nfs/dbraw/zinc/26/93/11/942269311.db2.gz WTTNSUGNQZLFRM-GHTZIAJQSA-N 0 3 419.949 4.292 20 0 HIADHN O[C@@H](CNCc1ccc(-c2ccccc2)o1)COc1cccc(Br)c1 ZINC000554831643 942270555 /nfs/dbraw/zinc/27/05/55/942270555.db2.gz XASQWFSDWROSAI-KRWDZBQOSA-N 0 3 402.288 4.239 20 0 HIADHN CN(C[C@H]1CCCN(Cc2ccc(-c3ccccc3Cl)s2)C1)S(C)(=O)=O ZINC000554873136 942302388 /nfs/dbraw/zinc/30/23/88/942302388.db2.gz RXSHOPXJKZQFSE-OAHLLOKOSA-N 0 3 413.008 4.172 20 0 HIADHN Cc1ccc(CNCc2cccc(C(=O)NCc3ccco3)c2)c(-c2ccnn2C)c1 ZINC000554918403 942319027 /nfs/dbraw/zinc/31/90/27/942319027.db2.gz BDZBIQMIKBJFEI-UHFFFAOYSA-N 0 3 414.509 4.208 20 0 HIADHN Cc1ccc(Cl)cc1NC(=O)CN[C@H]1CCN(C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000554948737 942329409 /nfs/dbraw/zinc/32/94/09/942329409.db2.gz CEACFRXKUSBPHG-FXAWDEMLSA-N 0 3 410.320 4.414 20 0 HIADHN CSc1ccc(NC(=O)CN[C@H]2CCN(C)[C@H]2c2ccc(Cl)c(F)c2)cc1 ZINC000554954273 942331829 /nfs/dbraw/zinc/33/18/29/942331829.db2.gz MLVUJESELJDHMC-ICSRJNTNSA-N 0 3 407.942 4.175 20 0 HIADHN Fc1cccc(CN2CCC[C@@H](c3nc(Cc4ccc(-n5cccn5)cc4)no3)C2)c1 ZINC000555086802 942381652 /nfs/dbraw/zinc/38/16/52/942381652.db2.gz GAYYPJJVIPYFSJ-HXUWFJFHSA-N 0 3 417.488 4.365 20 0 HIADHN CCN1CC[C@H](N[C@@H](C)C(=O)Nc2ccc(OC)cc2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000555125030 942392039 /nfs/dbraw/zinc/39/20/39/942392039.db2.gz BFMMRLCPZXFDRF-SZFUDVHCSA-N 0 3 419.928 4.240 20 0 HIADHN Cc1ccccc1CNC(=O)[C@H](C)N[C@H]1CCN(C(C)C)[C@H]1c1ccc(F)c(F)c1 ZINC000555126536 942393546 /nfs/dbraw/zinc/39/35/46/942393546.db2.gz XIYINMZUKQLYSE-RTFZILSDSA-N 0 3 415.528 4.092 20 0 HIADHN CCn1c(CN[C@@H]2CCN(C3CC3)[C@@H]2c2cccc(OC)c2)nc2cc(F)ccc21 ZINC000555128242 942393930 /nfs/dbraw/zinc/39/39/30/942393930.db2.gz FJSUCPZSXDNJBV-HYBUGGRVSA-N 0 3 408.521 4.272 20 0 HIADHN CCOc1ccccc1NC(=O)CN[C@H]1CCN(C(C)C)[C@@H]1c1ccc(F)c(F)c1 ZINC000555132950 942397231 /nfs/dbraw/zinc/39/72/31/942397231.db2.gz LZWWQARZYZJTJP-NZQKXSOJSA-N 0 3 417.500 4.116 20 0 HIADHN C[C@@H](NCC1=Cc2cc(Br)ccc2OC1)c1ccc2c(c1)CCC(=O)N2 ZINC000555196058 942426641 /nfs/dbraw/zinc/42/66/41/942426641.db2.gz RHHZKDGCGGXKBG-CYBMUJFWSA-N 0 3 413.315 4.460 20 0 HIADHN Brc1ccc2c(c1)CCCC[C@@H]2NCc1cccc(N2CCOCC2)n1 ZINC000555225069 942437133 /nfs/dbraw/zinc/43/71/33/942437133.db2.gz GNSAONYMVGAMCD-FQEVSTJZSA-N 0 3 416.363 4.238 20 0 HIADHN Cc1cccc(C)c1CS(=O)(=O)N(C)[C@@H]1CCN(Cc2ccccc2)[C@H](C)C1 ZINC000555317087 942473862 /nfs/dbraw/zinc/47/38/62/942473862.db2.gz MXLQRSWPOFVWSR-IFMALSPDSA-N 0 3 400.588 4.118 20 0 HIADHN COCCOc1cccc(CN2CCC(F)(c3cc(OC)cc(OC)c3)CC2)c1 ZINC000555339527 942483877 /nfs/dbraw/zinc/48/38/77/942483877.db2.gz BBFGNFIAUSTRAA-UHFFFAOYSA-N 0 3 403.494 4.190 20 0 HIADHN CC(C)[C@H](NCC(=O)Nc1nc(CN2CCC(C)CC2)cs1)c1ccccc1 ZINC000555369476 942499179 /nfs/dbraw/zinc/49/91/79/942499179.db2.gz NYBLNBLUUADMPP-NRFANRHFSA-N 0 3 400.592 4.300 20 0 HIADHN CCC[C@H]1CN(c2nnc(C3CCC3)n2C[C@H]2CCCO2)CCN1Cc1ccccc1 ZINC000555394874 942511989 /nfs/dbraw/zinc/51/19/89/942511989.db2.gz LXHCVNBSKOJFJI-XZOQPEGZSA-N 0 3 423.605 4.216 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)NCc1ccc2c(c1)nc(C1CC1)n2C ZINC000555558505 942642363 /nfs/dbraw/zinc/64/23/63/942642363.db2.gz SMJJQPXPZMAXIO-UHFFFAOYSA-N 0 3 402.498 4.189 20 0 HIADHN Cn1c(CNCCc2cnc(SC3CCCC3)nc2)nc2cc(Cl)ccc21 ZINC000555635473 942681800 /nfs/dbraw/zinc/68/18/00/942681800.db2.gz GOPZSBWPFOWUGJ-UHFFFAOYSA-N 0 3 401.967 4.384 20 0 HIADHN O=C(CN1CC[C@H](CC2CC2)C1)N(Cc1nnc(-c2ccccc2Cl)o1)C1CC1 ZINC000555696588 942703071 /nfs/dbraw/zinc/70/30/71/942703071.db2.gz HTGHCGQOLXSXRD-MRXNPFEDSA-N 0 3 414.937 4.003 20 0 HIADHN Cc1cc(C)c(-c2csc(NC(=O)CN[C@@H](C3CC3)C(C)(C)CO)n2)c(C)c1 ZINC000555734561 942716941 /nfs/dbraw/zinc/71/69/41/942716941.db2.gz BYANVVGRDODDDX-FQEVSTJZSA-N 0 3 401.576 4.061 20 0 HIADHN CN(C)Cc1cccc(NC(=O)c2cc(CNC(=O)C(C)(C)C)ccc2Cl)c1 ZINC000555815219 942742256 /nfs/dbraw/zinc/74/22/56/942742256.db2.gz LKJSXHWIUCWDRJ-UHFFFAOYSA-N 0 3 401.938 4.316 20 0 HIADHN CC[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)NCCCCN1C[C@@H](C)O[C@@H](C)C1 ZINC000555852507 942753632 /nfs/dbraw/zinc/75/36/32/942753632.db2.gz APPDYCBSRCBFEF-SCTDSRPQSA-N 0 3 414.512 4.280 20 0 HIADHN O=C(CCc1ccccc1)N1CC[C@@H](N[C@H]2CCc3sc(Br)cc32)C1 ZINC000556104547 942805849 /nfs/dbraw/zinc/80/58/49/942805849.db2.gz YDERSGIHBQPNTE-WBVHZDCISA-N 0 3 419.388 4.321 20 0 HIADHN CN(C)Cc1ccc(S(=O)(=O)N(C)c2ccc(C(F)(F)F)cc2Cl)cc1 ZINC000556304328 942837120 /nfs/dbraw/zinc/83/71/20/942837120.db2.gz WNYXJKFTSHWZLL-UHFFFAOYSA-N 0 3 406.857 4.246 20 0 HIADHN CN(C)Cc1ccc(S(=O)(=O)N[C@H](c2ccc(F)c(Cl)c2)C(F)(F)F)cc1 ZINC000556306002 942837422 /nfs/dbraw/zinc/83/74/22/942837422.db2.gz XSMMRCHCPWOYEG-MRXNPFEDSA-N 0 3 424.847 4.123 20 0 HIADHN CN(C(=O)c1ccc(NCc2nc3ccc(F)cc3s2)cc1)[C@@H]1CCCN(C)C1 ZINC000556338142 942844538 /nfs/dbraw/zinc/84/45/38/942844538.db2.gz VRFHGLPLPJWCIX-GOSISDBHSA-N 0 3 412.534 4.214 20 0 HIADHN Cc1cc(CNCc2cccc(N3C(=O)N[C@@](C)(C4CC4)C3=O)c2)cc2cccnc12 ZINC000556411742 942859399 /nfs/dbraw/zinc/85/93/99/942859399.db2.gz IGJDBJXJUBWBTI-VWLOTQADSA-N 0 3 414.509 4.058 20 0 HIADHN CC(C)[C@@H](CCc1ccccc1)C(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000556431950 942865277 /nfs/dbraw/zinc/86/52/77/942865277.db2.gz GZSUITYRJUJWBT-RUZDIDTESA-N 0 3 408.586 4.165 20 0 HIADHN C[C@@H]1CCCC[C@H]1NC(=O)CN[C@H](c1cccc(C(F)(F)F)c1)C1CCOCC1 ZINC000556515430 942889580 /nfs/dbraw/zinc/88/95/80/942889580.db2.gz VJSPCWRWDURWQU-VMRPVKRXSA-N 0 3 412.496 4.458 20 0 HIADHN CC(C)Oc1ccc([C@H](C)N[C@H]2CCCN(Cc3ccccn3)C2=O)cc1Cl ZINC000556572885 942902457 /nfs/dbraw/zinc/90/24/57/942902457.db2.gz ITCLTFGKGRUBBM-JXFKEZNVSA-N 0 3 401.938 4.364 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2ccc3c(c2)CCC=C3)cc1)[C@@H]1CCCN(C)C1 ZINC000556574031 942902839 /nfs/dbraw/zinc/90/28/39/942902839.db2.gz OGIHENRUQMOGLY-HSZRJFAPSA-N 0 3 403.526 4.065 20 0 HIADHN CC(C)Oc1ccc([C@H](C)NCc2ccc(C(=O)N3CCOCC3)cc2)cc1Cl ZINC000556584137 942905985 /nfs/dbraw/zinc/90/59/85/942905985.db2.gz QKZAKBFAJYLCTQ-KRWDZBQOSA-N 0 3 416.949 4.450 20 0 HIADHN CC(C)(C)N1C[C@@H](C(=O)N2CCC[C@@H]2CC(=O)c2ccccc2)[C@H](C(F)(F)F)C1 ZINC000556593912 942909109 /nfs/dbraw/zinc/90/91/09/942909109.db2.gz VZRQZONGCDEPJJ-KZNAEPCWSA-N 0 3 410.480 4.159 20 0 HIADHN C[C@@H](NCc1cccc(N2C(=O)N[C@@](C)(C3CC3)C2=O)c1)c1ccc2c(c1)CCC2 ZINC000556607257 942913259 /nfs/dbraw/zinc/91/32/59/942913259.db2.gz BUMINLNBZFPQBI-CPJLOUKISA-N 0 3 403.526 4.251 20 0 HIADHN Cc1ccc(Br)c(C)c1C(=O)NC1CCN([C@H](C)c2ccncc2)CC1 ZINC000556678721 942929544 /nfs/dbraw/zinc/92/95/44/942929544.db2.gz BCODAFIJIKSYIM-MRXNPFEDSA-N 0 3 416.363 4.416 20 0 HIADHN COc1cc(CN2CCC(CCO)CC2)ccc1OCCOc1ccccc1Cl ZINC000556793854 942933306 /nfs/dbraw/zinc/93/33/06/942933306.db2.gz BWQVOGNGSRMWLV-UHFFFAOYSA-N 0 3 419.949 4.401 20 0 HIADHN O=C(NCC(F)(F)F)C1CCN(Cc2cccc(OCc3ccccc3F)c2)CC1 ZINC000556812090 942935394 /nfs/dbraw/zinc/93/53/94/942935394.db2.gz VTMOMZJLKCUFKH-UHFFFAOYSA-N 0 3 424.438 4.295 20 0 HIADHN COc1ccc(C)cc1NC(=O)[C@@H](C)N[C@H]1CCC[C@H]1Oc1cc(F)cc(F)c1 ZINC000556881552 942948640 /nfs/dbraw/zinc/94/86/40/942948640.db2.gz WKXIPTNBWWZOPM-YMTYPPQLSA-N 0 3 404.457 4.199 20 0 HIADHN CCOc1ccc(NC(=O)COc2ccc(CN3CCC34CCC4)cc2OC)cc1 ZINC000556887865 942952258 /nfs/dbraw/zinc/95/22/58/942952258.db2.gz MRGPAQNMKCOEJL-UHFFFAOYSA-N 0 3 410.514 4.240 20 0 HIADHN C[C@H](Cn1ccc2ccccc21)C(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000556922404 942967273 /nfs/dbraw/zinc/96/72/73/942967273.db2.gz KLPVEJUJKYICTD-NJDAHSKKSA-N 0 3 411.590 4.015 20 0 HIADHN CC(C)(C)c1nc(CCNC(=O)[C@@H]2CN(Cc3ccccc3)CCC2(F)F)cs1 ZINC000556946164 942976830 /nfs/dbraw/zinc/97/68/30/942976830.db2.gz ODBJFIBZTAVRKH-SFHVURJKSA-N 0 3 421.557 4.257 20 0 HIADHN O=C(N[C@H](c1ccccc1)[C@H]1CCOC1)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000556951461 942978588 /nfs/dbraw/zinc/97/85/88/942978588.db2.gz PCLFIGJTHPLIOS-BHDDXSALSA-N 0 3 414.496 4.038 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@@H](O)C2)c1)c1ccc(Sc2ccccn2)cc1 ZINC000557022602 942996300 /nfs/dbraw/zinc/99/63/00/942996300.db2.gz ATPFFQOOHFOBNW-HXUWFJFHSA-N 0 3 405.523 4.052 20 0 HIADHN CCn1ccnc1[C@@H]1CCCCN1C(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000557061376 943008688 /nfs/dbraw/zinc/00/86/88/943008688.db2.gz JOQRQUWAHLXWNI-PMACEKPBSA-N 0 3 416.516 4.114 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)CCCc2ncc(-c3ccccc3)o2)cc1 ZINC000557202674 943049646 /nfs/dbraw/zinc/04/96/46/943049646.db2.gz AQTJZDOPJUCLEH-OAQYLSRUSA-N 0 3 407.514 4.092 20 0 HIADHN Cc1cc(Br)c(NC(=O)CN(C)[C@H](C)C2CC2)c(Br)c1 ZINC000557218211 943054652 /nfs/dbraw/zinc/05/46/52/943054652.db2.gz YNQVUHJIXIUMLE-SNVBAGLBSA-N 0 3 404.146 4.189 20 0 HIADHN CCCN(C)[C@H](CNC(=O)c1cc2c([nH]c1=O)CCCC2)c1ccc(Cl)cc1 ZINC000557336310 943075909 /nfs/dbraw/zinc/07/59/09/943075909.db2.gz BDNRVPQYNSIVPO-HXUWFJFHSA-N 0 3 401.938 4.132 20 0 HIADHN O=C(N1CCC=C(c2ccco2)C1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000557345431 943080352 /nfs/dbraw/zinc/08/03/52/943080352.db2.gz DPPIWUDYKULSKP-OAQYLSRUSA-N 0 3 404.432 4.350 20 0 HIADHN CN(C)CCN(C[C@H]1CCCO1)C(=O)c1ccc(-c2ccc(Cl)cc2)cc1F ZINC000557359127 943086180 /nfs/dbraw/zinc/08/61/80/943086180.db2.gz YCUHBGNNJYOKTL-LJQANCHMSA-N 0 3 404.913 4.329 20 0 HIADHN C[C@@H]1CC(C(=O)N(Cc2ccncc2)[C@@H]2CCCN(Cc3ccccc3)C2)C[C@@H](C)O1 ZINC000557449433 943133895 /nfs/dbraw/zinc/13/38/95/943133895.db2.gz RXVKGRCPPAQRID-DNRQZRRGSA-N 0 3 421.585 4.278 20 0 HIADHN COC[C@@H](NC[C@@H]1CCN(c2cc(OC)cc(OC)c2)C1)c1cccc(Cl)c1F ZINC000557451453 943135469 /nfs/dbraw/zinc/13/54/69/943135469.db2.gz JEAJCAAAMXMLKG-YCRPNKLZSA-N 0 3 422.928 4.300 20 0 HIADHN COC[C@H](NC[C@H]1CCN(c2cc(OC)cc(OC)c2)C1)c1cccc(Cl)c1F ZINC000557451452 943135651 /nfs/dbraw/zinc/13/56/51/943135651.db2.gz JEAJCAAAMXMLKG-VFNWGFHPSA-N 0 3 422.928 4.300 20 0 HIADHN NS(=O)(=O)c1ccc2c(c1)[C@H](N[C@H](c1ccc(F)cc1)C1CCCC1)CCC2 ZINC000557531391 943193736 /nfs/dbraw/zinc/19/37/36/943193736.db2.gz XKZWSTOOFUTZJV-YADHBBJMSA-N 0 3 402.535 4.372 20 0 HIADHN O=C(NCCc1ccc(F)cc1F)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000557698829 943262030 /nfs/dbraw/zinc/26/20/30/943262030.db2.gz CQVBLKUNFFKETQ-FQEVSTJZSA-N 0 3 412.402 4.078 20 0 HIADHN Cc1cccc(CCCNC(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)n1 ZINC000557749246 943278439 /nfs/dbraw/zinc/27/84/39/943278439.db2.gz UZECTAKATYOMOM-HXUWFJFHSA-N 0 3 400.592 4.157 20 0 HIADHN CC[C@H](NCc1ccc(Cn2cncn2)cc1)c1cc(F)cc(Br)c1 ZINC000557768262 943285961 /nfs/dbraw/zinc/28/59/61/943285961.db2.gz ISQZVUIGHRJZCU-IBGZPJMESA-N 0 3 403.299 4.469 20 0 HIADHN CC(C)C[C@H]1CN(CCCc2ccccc2)CCN1C(=O)c1cc(=O)[nH]c(C2CC2)c1 ZINC000557848335 943311896 /nfs/dbraw/zinc/31/18/96/943311896.db2.gz CKHLLSQJWBKEDF-QHCPKHFHSA-N 0 3 421.585 4.470 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)Nc2cccc(C(=O)N3CCCCC3)c2)CCN1Cc1ccccc1 ZINC000557884319 943320764 /nfs/dbraw/zinc/32/07/64/943320764.db2.gz BMXZMSHRMCGUAJ-XXBNENTESA-N 0 3 420.557 4.097 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)[C@@H]1C[C@@H]1c1cccc(Br)c1)c1ccco1 ZINC000557911315 943326728 /nfs/dbraw/zinc/32/67/28/943326728.db2.gz FHVTZXZMMSFFMZ-OKDNKWQNSA-N 0 3 405.336 4.391 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)C1CCC(NC(=O)CC2CCCC2)CC1)c1ccco1 ZINC000557912636 943327446 /nfs/dbraw/zinc/32/74/46/943327446.db2.gz WCWOHHIJDQCAAU-GHOZHQTGSA-N 0 3 417.594 4.080 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)c1cnn(-c2ccc(Cl)cc2)c1C)c1ccco1 ZINC000557912670 943327553 /nfs/dbraw/zinc/32/75/53/943327553.db2.gz WYHJGRRHYDEQLG-KUHUBIRLSA-N 0 3 400.910 4.286 20 0 HIADHN CN(C)C[C@@H](NC(=O)c1cccc(-n2nccc2C(F)(F)F)c1)c1ccc(F)cc1 ZINC000557955756 943339918 /nfs/dbraw/zinc/33/99/18/943339918.db2.gz QQAHGUGLBKRMJF-GOSISDBHSA-N 0 3 420.410 4.063 20 0 HIADHN CSc1ccc2ncnc(N3CCC(CCN4C[C@@H](C)O[C@H](C)C4)CC3)c2c1 ZINC000558017571 943357019 /nfs/dbraw/zinc/35/70/19/943357019.db2.gz ZQYDUPMVBZVXND-IAGOWNOFSA-N 0 3 400.592 4.067 20 0 HIADHN C[C@@H]1C[C@@H]1N1CCN(C(=O)CCC(=O)c2cc(Cl)sc2Cl)C[C@@H](C)C1 ZINC000558025775 943359494 /nfs/dbraw/zinc/35/94/94/943359494.db2.gz PDMVSNDCDWXCDJ-SCRDCRAPSA-N 0 3 403.375 4.207 20 0 HIADHN CCCN(C)[C@H](CNC(=O)N1CCC[C@@H](c2nc(C)no2)C1)c1ccc(Cl)cc1 ZINC000558107352 943380982 /nfs/dbraw/zinc/38/09/82/943380982.db2.gz LOIILMCRRWHFAQ-IEBWSBKVSA-N 0 3 419.957 4.004 20 0 HIADHN COC(=O)c1ccc(OCCN(Cc2cccs2)[C@@H]2C=C[C@H](CO)C2)c(Cl)c1 ZINC000558133897 943391486 /nfs/dbraw/zinc/39/14/86/943391486.db2.gz ZQTKSZBHSXDHFH-DOTOQJQBSA-N 0 3 421.946 4.006 20 0 HIADHN FC(F)(F)[C@H]1C[C@@H](NCc2ccc(Cl)cc2I)CCO1 ZINC000558254168 943460560 /nfs/dbraw/zinc/46/05/60/943460560.db2.gz AVGJBWABBWIDRF-CMPLNLGQSA-N 0 3 419.612 4.144 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)Nc2cccc(OC(F)F)c2)N(C)C)cc1 ZINC000558277084 943477074 /nfs/dbraw/zinc/47/70/74/943477074.db2.gz PZYAUXSHDSHHOA-LJQANCHMSA-N 0 3 407.461 4.500 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)NC[C@H](N[C@@H](C)CC)c2ccco2)cc1 ZINC000558332715 943511053 /nfs/dbraw/zinc/51/10/53/943511053.db2.gz VCJQFOODMZCJBK-BXWFABGCSA-N 0 3 400.523 4.059 20 0 HIADHN COc1ccc(NC(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)c(Br)c1 ZINC000558352315 943521056 /nfs/dbraw/zinc/52/10/56/943521056.db2.gz FIZDYFFJCODOTK-UGSOOPFHSA-N 0 3 406.324 4.271 20 0 HIADHN CC(=O)NCC[C@H]1CCCN(Cc2cnc(-c3ccc(Br)cc3)s2)C1 ZINC000558426425 943556895 /nfs/dbraw/zinc/55/68/95/943556895.db2.gz JPZVNDIRBYZUFU-OAHLLOKOSA-N 0 3 422.392 4.311 20 0 HIADHN CC(C)(C)N1CCCN(C(=O)CCCC(=O)c2ccc(Br)cc2)CC1 ZINC000558484884 943571961 /nfs/dbraw/zinc/57/19/61/943571961.db2.gz RKEZRDVJKUZNBB-UHFFFAOYSA-N 0 3 409.368 4.135 20 0 HIADHN Cc1ccc(CNCc2cc3c(c(Br)c2)OCO3)c(-c2cnn(C)c2)c1 ZINC000558779692 943660438 /nfs/dbraw/zinc/66/04/38/943660438.db2.gz PDLLIBZIKKXWPG-UHFFFAOYSA-N 0 3 414.303 4.177 20 0 HIADHN CCc1nc2cc(CNCc3c[nH]nc3-c3ccc4c(c3)OCO4)ccc2n1C1CC1 ZINC000558779709 943660619 /nfs/dbraw/zinc/66/06/19/943660619.db2.gz QGLOEZYWXCGTOJ-UHFFFAOYSA-N 0 3 415.497 4.342 20 0 HIADHN CC(C)C(=O)c1ccc([C@H](C)C(=O)N(CCN(C)C)Cc2ccc(F)cc2F)cc1 ZINC000558806091 943671557 /nfs/dbraw/zinc/67/15/57/943671557.db2.gz XDMSUEMWBWRWAN-KRWDZBQOSA-N 0 3 416.512 4.497 20 0 HIADHN CN(Cc1cnn(C)c1)C(=O)CN[C@H](c1cccc(C(F)(F)F)c1)C1CCCCC1 ZINC000558860622 943705415 /nfs/dbraw/zinc/70/54/15/943705415.db2.gz GLDNHBYYJPIRAR-NRFANRHFSA-N 0 3 422.495 4.309 20 0 HIADHN COc1cccc([C@@H]2[C@@H](N[C@@H](C)C(=O)Nc3ccc(C)c(C)c3)CCN2C2CC2)c1 ZINC000558894683 943727127 /nfs/dbraw/zinc/72/71/27/943727127.db2.gz IWFMWDZIWNSXMP-GKVQRAMASA-N 0 3 407.558 4.207 20 0 HIADHN CCN1CC[C@H](NCc2nc3ccccc3nc2C)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000558895829 943728539 /nfs/dbraw/zinc/72/85/39/943728539.db2.gz PHZNMOXCWCPBDE-SIKLNZKXSA-N 0 3 400.448 4.281 20 0 HIADHN CCc1ccccc1NC(=O)CN[C@H]1CCN(CC)[C@H]1c1ccc(Cl)c(F)c1 ZINC000558897143 943732118 /nfs/dbraw/zinc/73/21/18/943732118.db2.gz PFZFXMSDRSUFKJ-UNMCSNQZSA-N 0 3 403.929 4.405 20 0 HIADHN CCN1CC[C@H](N[C@@H](C)C(=O)NCCc2cccs2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000558898741 943732881 /nfs/dbraw/zinc/73/28/81/943732881.db2.gz QMBHPFCHQYDRDF-PNHOKKKMSA-N 0 3 423.985 4.013 20 0 HIADHN CC(C)(C)N1CC[C@H](NCC(=O)Nc2nccs2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000558902136 943736492 /nfs/dbraw/zinc/73/64/92/943736492.db2.gz MVQTYXRRVDMPON-DOTOQJQBSA-N 0 3 410.946 4.078 20 0 HIADHN CCOc1cc(CN(Cc2ccc(-n3cncn3)cc2)C2CC2)cc(Cl)c1OC ZINC000559095829 943836582 /nfs/dbraw/zinc/83/65/82/943836582.db2.gz KSUTXCQRMONXMB-UHFFFAOYSA-N 0 3 412.921 4.493 20 0 HIADHN C[C@H]1CN(Cc2ccc(CNCc3conc3Cc3ccccc3)cc2)C[C@H](C)O1 ZINC000559245202 943885057 /nfs/dbraw/zinc/88/50/57/943885057.db2.gz VDERHVMRGCBMOE-PMACEKPBSA-N 0 3 405.542 4.164 20 0 HIADHN C[C@H](NCc1ccc(I)cc1)c1ccc(-n2cccn2)c(F)c1 ZINC000559339776 943899154 /nfs/dbraw/zinc/89/91/54/943899154.db2.gz RKNUTFZPADHRMZ-ZDUSSCGKSA-N 0 3 421.257 4.467 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CNCCCS(=O)(=O)c1ccc(Cl)cc1 ZINC000559359765 943911203 /nfs/dbraw/zinc/91/12/03/943911203.db2.gz RMUGLUXOBRTKLI-UHFFFAOYSA-N 0 3 417.962 4.096 20 0 HIADHN CCOc1cc(CNCc2cccc(Cn3cccn3)c2)cc(Br)c1O ZINC000559718685 944035631 /nfs/dbraw/zinc/03/56/31/944035631.db2.gz URCJUGCQCAZEFO-UHFFFAOYSA-N 0 3 416.319 4.088 20 0 HIADHN CN1CC[C@H](NCC(=O)N[C@@H](c2cccs2)c2ccc(F)cc2)[C@@H]1c1ccccc1 ZINC000559777714 944048920 /nfs/dbraw/zinc/04/89/20/944048920.db2.gz TXCYHYGOLZIOEH-ZTCOLXNVSA-N 0 3 423.557 4.128 20 0 HIADHN COc1ccc(-c2ccc(CN[C@@H]3CCCc4cc(S(N)(=O)=O)ccc43)cc2)cc1 ZINC000559786659 944049873 /nfs/dbraw/zinc/04/98/73/944049873.db2.gz KADSJPGFARWEKD-XMMPIXPASA-N 0 3 422.550 4.177 20 0 HIADHN NS(=O)(=O)c1ccc2c(c1)CCC[C@@H]2N[C@H](COc1ccccc1)c1ccccc1 ZINC000559788372 944050159 /nfs/dbraw/zinc/05/01/59/944050159.db2.gz GIRJMTFZYFJRKM-BJKOFHAPSA-N 0 3 422.550 4.121 20 0 HIADHN COc1ccc2oc([C@H](C)N[C@@H](C)Cn3cc(Br)ccc3=O)c(C)c2c1 ZINC000559892781 944077296 /nfs/dbraw/zinc/07/72/96/944077296.db2.gz FODBBUFDYUSRAE-JSGCOSHPSA-N 0 3 419.319 4.413 20 0 HIADHN COc1ccc2oc([C@H](C)N[C@H](C)Cn3cc(Br)ccc3=O)c(C)c2c1 ZINC000559892782 944077738 /nfs/dbraw/zinc/07/77/38/944077738.db2.gz FODBBUFDYUSRAE-OCCSQVGLSA-N 0 3 419.319 4.413 20 0 HIADHN C[C@H](N[C@H]1CCCN([C@@H](C)c2ccc(F)cc2)C1=O)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000559897864 944078489 /nfs/dbraw/zinc/07/84/89/944078489.db2.gz SNASPPGDZPWJPX-WCJKSRRJSA-N 0 3 423.532 4.458 20 0 HIADHN COCCOc1ccc([C@H](C)N[C@@H]2CCCN([C@H](C)c3ccc(F)cc3)C2=O)cc1 ZINC000559899157 944079834 /nfs/dbraw/zinc/07/98/34/944079834.db2.gz KSWDFZAZPJNAKL-YZZKKUAISA-N 0 3 414.521 4.254 20 0 HIADHN CN1CC[C@H](CN[C@@H](c2cn[nH]n2)c2ccc(F)cc2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000559920750 944085542 /nfs/dbraw/zinc/08/55/42/944085542.db2.gz HQQXNWTYXMLORF-LPTQZCDUSA-N 0 3 417.891 4.108 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)Nc2ccc(Oc3cccnc3)nc2)C1 ZINC000559966152 944102922 /nfs/dbraw/zinc/10/29/22/944102922.db2.gz NZNZMIWHGFSGHM-FXAWDEMLSA-N 0 3 403.486 4.226 20 0 HIADHN CN(C(=O)c1ccc(NCc2ccc3c(c2)CC(C)(C)O3)cc1)[C@@H]1CCCN(C)C1 ZINC000559997036 944118381 /nfs/dbraw/zinc/11/83/81/944118381.db2.gz PKSXLMQTIIWZJE-JOCHJYFZSA-N 0 3 407.558 4.178 20 0 HIADHN Fc1ccc(Br)cc1-c1noc([C@H]2CCCN(Cc3cccnc3)C2)n1 ZINC000560004825 944125512 /nfs/dbraw/zinc/12/55/12/944125512.db2.gz AOVYWYMZGFFJEB-AWEZNQCLSA-N 0 3 417.282 4.413 20 0 HIADHN CCc1nn(-c2ccccc2)c(CC)c1CNCc1cn(-c2ccncc2)nc1C ZINC000560024343 944132207 /nfs/dbraw/zinc/13/22/07/944132207.db2.gz DUXPRFVZMOIELW-UHFFFAOYSA-N 0 3 400.530 4.176 20 0 HIADHN COC(=O)[C@H](Cc1ccccc1)[C@H](C)N[C@H](C)C(=O)Nc1ccccc1C(F)(F)F ZINC000560177447 944187281 /nfs/dbraw/zinc/18/72/81/944187281.db2.gz ZYZKQPLFIPQEIB-ZMSDIMECSA-N 0 3 422.447 4.042 20 0 HIADHN CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C[C@@H](O)COCc1ccco1 ZINC000560175964 944187307 /nfs/dbraw/zinc/18/73/07/944187307.db2.gz WWKIZIYZCQCUAT-OAHLLOKOSA-N 0 3 411.342 4.327 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1NC(=O)CCN1CCC(F)(c2cccnc2)CC1 ZINC000560204900 944195949 /nfs/dbraw/zinc/19/59/49/944195949.db2.gz CLCCNBNDUQPRQU-UHFFFAOYSA-N 0 3 421.520 4.174 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)CCc2nc3cc(Cl)ccc3s2)cc1 ZINC000560247607 944205506 /nfs/dbraw/zinc/20/55/06/944205506.db2.gz WSPQDYCMNXFJBF-GOSISDBHSA-N 0 3 417.962 4.310 20 0 HIADHN COCc1c(C(=O)N[C@@H](CN(C)C)c2ccc(OC)cc2)sc2cccc(F)c21 ZINC000560252074 944207823 /nfs/dbraw/zinc/20/78/23/944207823.db2.gz UNFSYVHEJJFKEE-SFHVURJKSA-N 0 3 416.518 4.228 20 0 HIADHN O=C(c1cnc(-c2ccccc2F)s1)N1CCN(c2ccnc3ccccc32)CC1 ZINC000560489705 944237607 /nfs/dbraw/zinc/23/76/07/944237607.db2.gz ZHYCQGAZWXXREM-UHFFFAOYSA-N 0 3 418.497 4.460 20 0 HIADHN CCCc1c(C(=O)NC[C@@H](CN(C)C)c2ccc(Cl)cc2)[nH]c(C)c1C(C)=O ZINC000560505976 944238820 /nfs/dbraw/zinc/23/88/20/944238820.db2.gz XNRVTOZWBQWDCJ-KRWDZBQOSA-N 0 3 403.954 4.207 20 0 HIADHN C[C@@H](NCc1cnn(-c2ccc(Br)cc2)c1)c1ccccc1-n1ccnn1 ZINC000560545874 944248988 /nfs/dbraw/zinc/24/89/88/944248988.db2.gz YJNFPPRJAANCSV-OAHLLOKOSA-N 0 3 423.318 4.066 20 0 HIADHN O=S1(=O)CCc2cc(CN[C@H](c3cccc(OC(F)(F)F)c3)C3CC3)ccc21 ZINC000560543692 944249146 /nfs/dbraw/zinc/24/91/46/944249146.db2.gz KUCMECZQYDOFRT-IBGZPJMESA-N 0 3 411.445 4.156 20 0 HIADHN COc1ccc(C[C@@H](C)N[C@@H](CCO)c2ccccc2Br)c(C)c1OC ZINC000560548534 944250132 /nfs/dbraw/zinc/25/01/32/944250132.db2.gz HMUUNVPVAAYHTB-KUHUBIRLSA-N 0 3 422.363 4.419 20 0 HIADHN CN(Cc1nc2c(s1)CCCC2)C(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000560553400 944252032 /nfs/dbraw/zinc/25/20/32/944252032.db2.gz CJMNJBJUMIDHHH-KRWDZBQOSA-N 0 3 419.541 4.138 20 0 HIADHN Cc1c([C@H](C)N[C@@H]2CCCN(C(=O)N3CCCC3)C2)cnn1-c1cccc(Cl)c1 ZINC000560573068 944259199 /nfs/dbraw/zinc/25/91/99/944259199.db2.gz DHWGPCXLOIHLIN-QFBILLFUSA-N 0 3 415.969 4.165 20 0 HIADHN CCCN1CCC[C@H]1CN[C@H](c1cccc(S(C)(=O)=O)c1)c1ccc(C)cc1C ZINC000560583465 944263187 /nfs/dbraw/zinc/26/31/87/944263187.db2.gz YMMLEDDIMSUUPB-XUZZJYLKSA-N 0 3 414.615 4.260 20 0 HIADHN CN(CCCN(C)C(=O)[C@@H]1C[C@@H]1c1cccc(Cl)c1Cl)Cc1ccncc1 ZINC000560596354 944268644 /nfs/dbraw/zinc/26/86/44/944268644.db2.gz YKMQDJJZBFIFSQ-QZTJIDSGSA-N 0 3 406.357 4.472 20 0 HIADHN Cc1cc(N(C)C)cc(C)c1NC(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000560602404 944270943 /nfs/dbraw/zinc/27/09/43/944270943.db2.gz HVEYXPKWWYCTLN-FQEVSTJZSA-N 0 3 401.501 4.465 20 0 HIADHN COc1ccc(C(=O)CCC(=O)N2CCC3(C2)CCN(Cc2ccccc2)CC3)cc1 ZINC000560678688 944291468 /nfs/dbraw/zinc/29/14/68/944291468.db2.gz KRLZCXUIWPEGQW-UHFFFAOYSA-N 0 3 420.553 4.173 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)[C@H]1CC(=O)Nc2cc(F)ccc21)c1ccc(Cl)cc1 ZINC000560710826 944305346 /nfs/dbraw/zinc/30/53/46/944305346.db2.gz WYLJLTAMDUVYSR-ICSRJNTNSA-N 0 3 417.912 4.104 20 0 HIADHN COc1ccccc1NC(=O)c1ccc(NC(=O)[C@@H](C)N2CCC[C@H](C)CC2)cc1 ZINC000560846968 944356576 /nfs/dbraw/zinc/35/65/76/944356576.db2.gz HTHICPLLUMUVTD-ZWKOTPCHSA-N 0 3 409.530 4.397 20 0 HIADHN Cc1c(NC(=O)c2ccc(CN3CCC(CO)CC3)cc2)cccc1-c1ncco1 ZINC000560988544 944387410 /nfs/dbraw/zinc/38/74/10/944387410.db2.gz BMKNOCSECUJDRA-UHFFFAOYSA-N 0 3 405.498 4.107 20 0 HIADHN COc1ccc2nc(NC(=O)[C@@H]3CN(C(C)(C)C)C[C@H]3C(F)(F)F)sc2c1 ZINC000561092556 944445319 /nfs/dbraw/zinc/44/53/19/944445319.db2.gz WLTPRNZVIFYWCC-VXGBXAGGSA-N 0 3 401.454 4.152 20 0 HIADHN Cc1ccc2nc(C)c(C(=O)N3CCC[C@H](c4n[nH]cc4CN4CCCC4)C3)cc2c1 ZINC000561284070 944539327 /nfs/dbraw/zinc/53/93/27/944539327.db2.gz BMIJNKFOAREZGC-IBGZPJMESA-N 0 3 417.557 4.190 20 0 HIADHN CC1(C)Cc2ccc(Br)cc2[C@H]1NCc1ccc2c(c1)NC(=O)CO2 ZINC000561315327 944548016 /nfs/dbraw/zinc/54/80/16/944548016.db2.gz OJVNBDXXISTQCV-LJQANCHMSA-N 0 3 401.304 4.193 20 0 HIADHN CN(C)C[C@H](NC(=O)[C@H]1C[C@@H]1c1cccc(Br)c1)c1ccc(F)cc1 ZINC000561369556 944563263 /nfs/dbraw/zinc/56/32/63/944563263.db2.gz GYNIWMMHVDZABD-QYZOEREBSA-N 0 3 405.311 4.111 20 0 HIADHN COC(=O)c1c(F)ccc(NC(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)c1C ZINC000561403281 944580995 /nfs/dbraw/zinc/58/09/95/944580995.db2.gz OCRHJJVHOKMRLY-MRXNPFEDSA-N 0 3 413.493 4.049 20 0 HIADHN Cc1cccc(-c2cccc(CN[C@@H]3CCCc4ccc(S(N)(=O)=O)cc43)c2)c1 ZINC000561402458 944581163 /nfs/dbraw/zinc/58/11/63/944581163.db2.gz DIFYUVDDUBWVOV-XMMPIXPASA-N 0 3 406.551 4.477 20 0 HIADHN CCCN(C)[C@H](CNC(=O)NC[C@@H](C)c1c(C)noc1C)c1ccc(Cl)cc1 ZINC000561633816 944718858 /nfs/dbraw/zinc/71/88/58/944718858.db2.gz SWRAXAFSVVQJFB-AUUYWEPGSA-N 0 3 406.958 4.431 20 0 HIADHN O=C(NCc1cccc(OCc2ccccc2)c1)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000561639895 944722223 /nfs/dbraw/zinc/72/22/23/944722223.db2.gz GBFLUXJNYSPNEB-XMMPIXPASA-N 0 3 415.537 4.189 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)CCc2cnc3ccccc3c2)N(C)C)cc1 ZINC000561658563 944734054 /nfs/dbraw/zinc/73/40/54/944734054.db2.gz ZOTZKMJRPLBPRM-XMMPIXPASA-N 0 3 405.542 4.374 20 0 HIADHN COCc1c2ccccc2oc1C(=O)NC[C@H](c1ccc(OC(C)C)cc1)N(C)C ZINC000561676095 944742025 /nfs/dbraw/zinc/74/20/25/944742025.db2.gz ITZOWSMWXIOHKU-OAQYLSRUSA-N 0 3 410.514 4.399 20 0 HIADHN C[C@H]1C[C@H]1N1CCN(C(=O)c2ccoc2CN2c3ccccc3C[C@@H]2C)C[C@@H](C)C1 ZINC000561762776 944785333 /nfs/dbraw/zinc/78/53/33/944785333.db2.gz XNISRXBUDIMXEX-KEXUJGGDSA-N 0 3 407.558 4.033 20 0 HIADHN Cc1onc(-c2ccc(C(F)(F)F)cc2)c1C(=O)N1CCN([C@@H]2C[C@H]2C)C[C@@H](C)C1 ZINC000561762527 944785625 /nfs/dbraw/zinc/78/56/25/944785625.db2.gz URXNMRBYUDCRQS-HBUWYVDXSA-N 0 3 421.463 4.471 20 0 HIADHN CCC[C@H]1C[C@H](C(=O)Nc2ccc(N3CCN(CCC)CC3)cc2OCC)CCO1 ZINC000561796550 944800231 /nfs/dbraw/zinc/80/02/31/944800231.db2.gz AHLGOSZQDXJYQZ-CTNGQTDRSA-N 0 3 417.594 4.151 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)NC[C@@H]1CCO[C@H]1c1ccccc1 ZINC000561804871 944803866 /nfs/dbraw/zinc/80/38/66/944803866.db2.gz OCBWQIWKNGDHDW-OYDLWJJNSA-N 0 3 407.558 4.070 20 0 HIADHN C[C@@H](OC[C@@H](O)CN(Cc1cccs1)[C@@H]1C=C[C@H](CO)C1)c1ccc(Cl)cc1 ZINC000561910990 944851182 /nfs/dbraw/zinc/85/11/82/944851182.db2.gz LPEZEYXCYXIUDI-OVQGTLEDSA-N 0 3 421.990 4.279 20 0 HIADHN CN1CCC(N(Cc2ccccc2Br)C(=O)Nc2cncc(F)c2)CC1 ZINC000562029311 944902679 /nfs/dbraw/zinc/90/26/79/944902679.db2.gz HZUHOBLYKMIRFD-UHFFFAOYSA-N 0 3 421.314 4.112 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)Nc2cccc(N3CCCC3=O)c2)N(C)C)cc1 ZINC000562044348 944908433 /nfs/dbraw/zinc/90/84/33/944908433.db2.gz ARGRATQLYVTACG-QFIPXVFZSA-N 0 3 424.545 4.025 20 0 HIADHN CN1CC[C@@H](NCC(=O)N(Cc2ccccc2)C(C)(C)C)[C@H]1c1ccc(F)c(F)c1 ZINC000562045964 944909755 /nfs/dbraw/zinc/90/97/55/944909755.db2.gz FOFCVRGECRCTQM-FYYLOGMGSA-N 0 3 415.528 4.127 20 0 HIADHN CN(C)C[C@H](NC(=O)Nc1ccc(N(C)C)cc1C(F)(F)F)c1ccc(F)cc1 ZINC000562088212 944932687 /nfs/dbraw/zinc/93/26/87/944932687.db2.gz ZVQPPOXFJWAPML-SFHVURJKSA-N 0 3 412.431 4.335 20 0 HIADHN Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C ZINC000562141808 944970283 /nfs/dbraw/zinc/97/02/83/944970283.db2.gz GHPLZHWYGXDFOC-PGRDOPGGSA-N 0 3 408.546 4.044 20 0 HIADHN CN(C)Cc1ccccc1CNC(=O)CCCC(=O)c1ccc(Br)cc1 ZINC000562178841 945004907 /nfs/dbraw/zinc/00/49/07/945004907.db2.gz GYBRJIZIPZXTNU-UHFFFAOYSA-N 0 3 417.347 4.180 20 0 HIADHN CC(C)c1cc(C(=O)N(Cc2ccccc2Br)C2CCN(C)CC2)[nH]n1 ZINC000562249242 945042766 /nfs/dbraw/zinc/04/27/66/945042766.db2.gz QESIXGMOVIOWHA-UHFFFAOYSA-N 0 3 419.367 4.032 20 0 HIADHN CC[C@H](NCc1cc(OC)c(OCC(F)F)c(OC)c1)c1ccc2c(c1)OCCO2 ZINC000564105202 945379936 /nfs/dbraw/zinc/37/99/36/945379936.db2.gz QXRSCUYJPMZTIV-INIZCTEOSA-N 0 3 423.456 4.360 20 0 HIADHN C[C@H](NCC(=O)Nc1nc(CN2CCCC2)cs1)c1ccc(F)c2ccccc21 ZINC000564151423 945401559 /nfs/dbraw/zinc/40/15/59/945401559.db2.gz GLQSHAKWODKIFT-HNNXBMFYSA-N 0 3 412.534 4.321 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3ccc(C)cc3OC)c(OCC)c2)CC1 ZINC000564156203 945404688 /nfs/dbraw/zinc/40/46/88/945404688.db2.gz IBFHRYTVBGWFJA-UHFFFAOYSA-N 0 3 411.546 4.187 20 0 HIADHN C[C@H]1[C@@H](NC(=O)Nc2ccc(OCc3ccncc3)cc2)CCN1Cc1ccccc1 ZINC000564217773 945436772 /nfs/dbraw/zinc/43/67/72/945436772.db2.gz UZQIBLVSUOKTJH-CYFREDJKSA-N 0 3 416.525 4.445 20 0 HIADHN Cc1cc([C@H](NCC2(OCCO)CCOCC2)c2cccc(Cl)c2)c(C)s1 ZINC000564433241 945583045 /nfs/dbraw/zinc/58/30/45/945583045.db2.gz ALBWQHOVWRLLCT-HXUWFJFHSA-N 0 3 409.979 4.255 20 0 HIADHN Cc1cnccc1CC(=O)N(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000564479997 945614025 /nfs/dbraw/zinc/61/40/25/945614025.db2.gz LAMOCRRLQAYPRX-VWLOTQADSA-N 0 3 414.553 4.021 20 0 HIADHN Cc1cccc(Cc2cnc(NC(=O)CN[C@H]3CCN(C)[C@H]3c3ccccc3)s2)c1 ZINC000564688209 945731356 /nfs/dbraw/zinc/73/13/56/945731356.db2.gz BIDSMULVNOKZPC-GMAHTHKFSA-N 0 3 420.582 4.016 20 0 HIADHN O=C1NC2(CCCC2)C(=O)N1c1cccc(CNC/C=C\c2ccc(F)cc2F)c1 ZINC000564688976 945731570 /nfs/dbraw/zinc/73/15/70/945731570.db2.gz FVSHDINHFSUPDD-XQRVVYSFSA-N 0 3 411.452 4.137 20 0 HIADHN Cc1ccc2nc(-c3ccc(NC(=O)[C@H](C)N4CCCN(C)CC4)cc3)sc2c1 ZINC000564741585 945743656 /nfs/dbraw/zinc/74/36/56/945743656.db2.gz MBYHXZVCBXLYEX-KRWDZBQOSA-N 0 3 408.571 4.236 20 0 HIADHN CCCN(CC(=O)Nc1ccccc1OC)Cc1ccc(C)cc1-c1cnn(C)c1 ZINC000565112043 945775957 /nfs/dbraw/zinc/77/59/57/945775957.db2.gz TWHZTBBNVANAFT-UHFFFAOYSA-N 0 3 406.530 4.255 20 0 HIADHN CC[C@@H](c1cccc(OC)c1)N(C)C(=O)Nc1cccc(N2CCN(CC)CC2)c1 ZINC000565143101 945788059 /nfs/dbraw/zinc/78/80/59/945788059.db2.gz IEHOMUPSJLIQBS-QHCPKHFHSA-N 0 3 410.562 4.452 20 0 HIADHN O=C(NCC1(c2ccccn2)CCC1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000565883222 945903615 /nfs/dbraw/zinc/90/36/15/945903615.db2.gz BRFPHYVVAJPZIZ-JOCHJYFZSA-N 0 3 417.475 4.074 20 0 HIADHN COc1ccc(Sc2nsc(NC(=O)N(CCN(C)C)C3CCCC3)n2)cc1 ZINC000565897294 945909555 /nfs/dbraw/zinc/90/95/55/945909555.db2.gz BSMXRNHDTCEZLT-UHFFFAOYSA-N 0 3 421.592 4.036 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)c2cccc(OCc3cscn3)c2)CCN1Cc1ccccc1 ZINC000566390392 946018006 /nfs/dbraw/zinc/01/80/06/946018006.db2.gz RNVOJIJJMMXDDG-VGSWGCGISA-N 0 3 407.539 4.115 20 0 HIADHN COc1cc([C@H](C)NC2CCN(Cc3coc(-c4ccccc4)n3)CC2)c(F)cn1 ZINC000566396922 946021126 /nfs/dbraw/zinc/02/11/26/946021126.db2.gz RMYYPTBIXWPUJK-INIZCTEOSA-N 0 3 410.493 4.200 20 0 HIADHN COc1ccc([C@@H](CNC(=O)Nc2ccc(OC(F)F)cc2F)N2CCCC2)cc1 ZINC000566574090 946043987 /nfs/dbraw/zinc/04/39/87/946043987.db2.gz RZUHHNQCDLPRCT-LJQANCHMSA-N 0 3 423.435 4.394 20 0 HIADHN COc1ccccc1N1CC[C@H](NC/C(C)=C\c2ccccc2OC(F)F)C1=O ZINC000566685538 946071602 /nfs/dbraw/zinc/07/16/02/946071602.db2.gz RVRIFQSULYZQKD-REZBVGGZSA-N 0 3 402.441 4.095 20 0 HIADHN CCc1cccc(C)c1NC(=O)CN[C@H]1CCN(C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000566885169 946155236 /nfs/dbraw/zinc/15/52/36/946155236.db2.gz ZLUDXHAVZXKLDZ-SIKLNZKXSA-N 0 3 403.929 4.323 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)c3cc4cc(Cl)sc4[nH]3)CC2)C[C@H](C)O1 ZINC000566946839 946187328 /nfs/dbraw/zinc/18/73/28/946187328.db2.gz CLLZHJIJXZKXQH-KBPBESRZSA-N 0 3 409.983 4.234 20 0 HIADHN COc1ccc(-c2nn(Cc3ccccc3)cc2CN[C@H]2C[C@@H]2C(F)F)cc1OC ZINC000566997306 946209780 /nfs/dbraw/zinc/20/97/80/946209780.db2.gz YMEJGKKEGPCSOC-OALUTQOASA-N 0 3 413.468 4.359 20 0 HIADHN Cc1ccc(C[C@@H](NC(=O)N2CCN(CCC(C)(C)C)CC2)c2ccccn2)cc1 ZINC000567018700 946218371 /nfs/dbraw/zinc/21/83/71/946218371.db2.gz HOLGDDBOZOBKQX-HSZRJFAPSA-N 0 3 408.590 4.437 20 0 HIADHN C/C(=C/c1ccccc1OC(F)F)CNCc1ccncc1OC[C@@H]1CCOC1 ZINC000567033943 946223681 /nfs/dbraw/zinc/22/36/81/946223681.db2.gz JBJRQZNSAIQIQR-LPPOOGIUSA-N 0 3 404.457 4.291 20 0 HIADHN CN1CCC(N(Cc2ccccc2Br)C(=O)Cc2ccccc2)CC1 ZINC000567291895 946296652 /nfs/dbraw/zinc/29/66/52/946296652.db2.gz WVLITCXEFNIZEK-UHFFFAOYSA-N 0 3 401.348 4.115 20 0 HIADHN CN1CC[C@H](NC(=O)NC2(c3cccc(C(F)(F)F)c3)CC2)[C@H]1c1ccccc1 ZINC000567296615 946298417 /nfs/dbraw/zinc/29/84/17/946298417.db2.gz VYHZINPWWNCHFX-RBUKOAKNSA-N 0 3 403.448 4.439 20 0 HIADHN COc1cc(CNCc2ccccc2-n2ccc(C)n2)cc(OC)c1OCC(F)F ZINC000567512296 946355214 /nfs/dbraw/zinc/35/52/14/946355214.db2.gz NMDZQLHVOLPQET-UHFFFAOYSA-N 0 3 417.456 4.132 20 0 HIADHN COc1ccc2oc([C@H](C)N[C@@H]3CCCc4cc(S(N)(=O)=O)ccc43)c(C)c2c1 ZINC000567574029 946378546 /nfs/dbraw/zinc/37/85/46/946378546.db2.gz YNABQOXXDJKHBF-VBKZILBWSA-N 0 3 414.527 4.125 20 0 HIADHN C[C@@H](NC[C@@H](Cc1ccccc1)C(F)(F)F)c1cccc(S(=O)(=O)N(C)C)c1 ZINC000567576761 946380011 /nfs/dbraw/zinc/38/00/11/946380011.db2.gz STCGDGNXKJLHGS-CRAIPNDOSA-N 0 3 414.493 4.009 20 0 HIADHN O=C(c1ccc(OCC(F)(F)F)cc1)N1CCN(c2ccnc3ccccc32)CC1 ZINC000567930421 946425381 /nfs/dbraw/zinc/42/53/81/946425381.db2.gz LFVKHJSUKKICQA-UHFFFAOYSA-N 0 3 415.415 4.138 20 0 HIADHN O[C@@H](COc1c(Cl)cccc1Cl)CN1CCC(OCCc2ccccc2)CC1 ZINC000568121599 946467743 /nfs/dbraw/zinc/46/77/43/946467743.db2.gz DHQVQYDVBXZCEU-GOSISDBHSA-N 0 3 424.368 4.457 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1ccc(C(=O)N2CCCC2)cc1C)c1ccco1 ZINC000568128608 946472422 /nfs/dbraw/zinc/47/24/22/946472422.db2.gz BXVQGEVEIRCOCF-PXNSSMCTSA-N 0 3 412.534 4.075 20 0 HIADHN O=C(Nc1ccc(OCC(F)(F)F)c(F)c1)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000568486433 946568522 /nfs/dbraw/zinc/56/85/22/946568522.db2.gz PTQLFPJMDDVTNC-OAHLLOKOSA-N 0 3 411.399 4.013 20 0 HIADHN COc1cccc(C(=O)CCCC(=O)N[C@H]2CCN(Cc3ccccc3)C[C@@H]2C)c1 ZINC000568493309 946569448 /nfs/dbraw/zinc/56/94/48/946569448.db2.gz LRPPOHRTFWPLQS-CVDCTZTESA-N 0 3 408.542 4.075 20 0 HIADHN COc1cccc(C(=O)CCCC(=O)N[C@H]2CCN(Cc3ccccc3)C[C@H]2C)c1 ZINC000568493311 946569989 /nfs/dbraw/zinc/56/99/89/946569989.db2.gz LRPPOHRTFWPLQS-XXBNENTESA-N 0 3 408.542 4.075 20 0 HIADHN CN1CC[C@@H](NCC(=O)Nc2cccc(Cl)c2Cl)[C@H]1c1ccc(F)c(F)c1 ZINC000568698315 946665954 /nfs/dbraw/zinc/66/59/54/946665954.db2.gz KJZPHYSYXILIEU-VQIMIIECSA-N 0 3 414.283 4.245 20 0 HIADHN Cc1ccccc1[C@H](OC[C@H](O)CN1CC2(CCC2)[C@H]1[C@@H]1CCCO1)c1ccccc1 ZINC000568697994 946665973 /nfs/dbraw/zinc/66/59/73/946665973.db2.gz FHHGHNFAGPFSML-BIGMCNFVSA-N 0 3 421.581 4.495 20 0 HIADHN CC[C@@H](NC(=O)c1ccccc1)c1noc([C@@H]2CCCN(Cc3cccc(F)c3)C2)n1 ZINC000568799260 946699254 /nfs/dbraw/zinc/69/92/54/946699254.db2.gz HYNBZJLTXWCCSP-TZIWHRDSSA-N 0 3 422.504 4.469 20 0 HIADHN COc1cccc2c1CCC[C@H]2NCc1cc(Br)c2c(c1)OCCO2 ZINC000568833380 946723184 /nfs/dbraw/zinc/72/31/84/946723184.db2.gz GZKCSZBJBUGHTG-QGZVFWFLSA-N 0 3 404.304 4.396 20 0 HIADHN CSc1ccc([C@@H](CNC(=O)c2cc(C)n(-c3nccs3)c2C)N(C)C)cc1 ZINC000568909694 946745617 /nfs/dbraw/zinc/74/56/17/946745617.db2.gz MTZHERRNSBPVNG-LJQANCHMSA-N 0 3 414.600 4.305 20 0 HIADHN C[C@@H](NCc1ccc2c(c1)nnn2C)c1ccc(NC(=O)c2ccc(F)cc2)cc1 ZINC000569133960 946819973 /nfs/dbraw/zinc/81/99/73/946819973.db2.gz VALVZHVUARKOPZ-OAHLLOKOSA-N 0 3 403.461 4.211 20 0 HIADHN Nc1nccc([C@@H]2CCCN(Cc3cccc(NC(=O)c4ccccc4Cl)c3)C2)n1 ZINC000569272465 946846284 /nfs/dbraw/zinc/84/62/84/946846284.db2.gz LCHMHJRNOYHKOF-QGZVFWFLSA-N 0 3 421.932 4.344 20 0 HIADHN CCc1nc2ccccc2n1C1CCN(Cc2cc(OC)c(OC)c(OC)c2)CC1 ZINC000569291878 946852379 /nfs/dbraw/zinc/85/23/79/946852379.db2.gz VQJXBNCRNDODND-UHFFFAOYSA-N 0 3 409.530 4.462 20 0 HIADHN CCCN1CCC[C@H]1CN[C@@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000569443297 946876128 /nfs/dbraw/zinc/87/61/28/946876128.db2.gz ICPMFOWGTVBVQX-UNMCSNQZSA-N 0 3 421.006 4.297 20 0 HIADHN COC(=O)c1ccc(CNCCc2nc(C(F)(F)F)cs2)c(Br)c1 ZINC000569701536 946943301 /nfs/dbraw/zinc/94/33/01/946943301.db2.gz AGTQRFDJSDPNOV-UHFFFAOYSA-N 0 3 423.254 4.043 20 0 HIADHN CCOc1cc(CN(CCO)[C@H]2CCc3ccccc32)cc(Br)c1OC ZINC000569754381 946984381 /nfs/dbraw/zinc/98/43/81/946984381.db2.gz RYUPGTPDRVHCDC-IBGZPJMESA-N 0 3 420.347 4.338 20 0 HIADHN O=C(CCc1ccccn1)N(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000569755535 946986399 /nfs/dbraw/zinc/98/63/99/946986399.db2.gz JFSOZMNZXYBMNA-VWLOTQADSA-N 0 3 414.553 4.103 20 0 HIADHN Cc1cc(C)c(S(N)(=O)=O)cc1[C@@H](C)NC[C@@H](Cc1ccccc1)C(F)(F)F ZINC000569892987 947039039 /nfs/dbraw/zinc/03/90/39/947039039.db2.gz WNCDQBPZALNCLT-NVXWUHKLSA-N 0 3 414.493 4.023 20 0 HIADHN CCO[C@H](C)c1nc(CN(C)C(=O)N[C@@H]2CCN(Cc3ccccc3)[C@H]2C)cs1 ZINC000569956586 947052300 /nfs/dbraw/zinc/05/23/00/947052300.db2.gz UPOUPHGECJRMMF-SQGPQFPESA-N 0 3 416.591 4.045 20 0 HIADHN Cc1ccnc(Oc2ccc(NC(=O)N[C@H]3CCN(Cc4ccccc4)[C@H]3C)cc2)n1 ZINC000570033392 947077402 /nfs/dbraw/zinc/07/74/02/947077402.db2.gz SQUXMFOZVQEJKX-AVRDEDQJSA-N 0 3 417.513 4.362 20 0 HIADHN CCOC(=O)c1c(C)c(C)sc1NC(=O)C[C@H](C)N[C@@H](C)c1cnn(C(C)C)c1 ZINC000570195151 947135153 /nfs/dbraw/zinc/13/51/53/947135153.db2.gz WQPUVENMVKRGND-ZFWWWQNUSA-N 0 3 420.579 4.387 20 0 HIADHN c1ccc(CN2CCCO[C@H](CSc3nnc(-c4cccnc4)n3C3CC3)C2)cc1 ZINC000570230983 947153206 /nfs/dbraw/zinc/15/32/06/947153206.db2.gz VJZOEWKEKZNQRV-NRFANRHFSA-N 0 3 421.570 4.058 20 0 HIADHN C[C@@H]1[C@H](NC(=O)N(C)Cc2ccccc2N2CCCC2)CCN1Cc1ccccc1 ZINC000570238479 947160863 /nfs/dbraw/zinc/16/08/63/947160863.db2.gz ZPPHVTNQMMMRQE-NFBKMPQASA-N 0 3 406.574 4.091 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc2c(c1)OCC(=O)N2)c1ccc(NC(=O)c2ccncc2)cc1 ZINC000570339160 947208528 /nfs/dbraw/zinc/20/85/28/947208528.db2.gz PLGVLYUMYAYIJH-HOTGVXAUSA-N 0 3 416.481 4.077 20 0 HIADHN CN(C)C[C@H](NC(=O)N[C@@H]1CCO[C@H]1c1ccc(F)c(F)c1)c1ccc(Cl)cc1 ZINC000570380181 947228112 /nfs/dbraw/zinc/22/81/12/947228112.db2.gz JLNIHPPPQOCCJQ-AABGKKOBSA-N 0 3 423.891 4.050 20 0 HIADHN O=C(c1csc(-c2ccc(F)cc2)n1)N1CCN(c2ccnc3ccccc32)CC1 ZINC000570426995 947237775 /nfs/dbraw/zinc/23/77/75/947237775.db2.gz FTKUJCDJKLHIGG-UHFFFAOYSA-N 0 3 418.497 4.460 20 0 HIADHN Cc1ccc2[nH]c3c(c2c1)CCC[C@@H]3NCc1ccccc1OCCN1CCOCC1 ZINC000570456952 947253387 /nfs/dbraw/zinc/25/33/87/947253387.db2.gz SLRPWFYYAXDQGT-DEOSSOPVSA-N 0 3 419.569 4.355 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)c1c(F)cc(Br)cc1F)c1ccco1 ZINC000570712946 947332037 /nfs/dbraw/zinc/33/20/37/947332037.db2.gz BMMAMBWWZYFDAR-QMTHXVAHSA-N 0 3 401.251 4.180 20 0 HIADHN Cc1cc(OC(C)C)ccc1NC(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000570755451 947346574 /nfs/dbraw/zinc/34/65/74/947346574.db2.gz VGKDYKMEXISJRT-JOCHJYFZSA-N 0 3 411.546 4.195 20 0 HIADHN CCc1oc(CNC[C@H]2CCN(C)[C@H]2c2ccc(Cl)c(F)c2)cc1C(=O)OC ZINC000570869130 947376090 /nfs/dbraw/zinc/37/60/90/947376090.db2.gz BKBJJYIGCROGDC-VLIAUNLRSA-N 0 3 408.901 4.204 20 0 HIADHN Cn1cncc1CN[C@@H]1CCCc2nc(-c3ccc(Br)cc3)sc21 ZINC000570888794 947385451 /nfs/dbraw/zinc/38/54/51/947385451.db2.gz CHHZNMAMRVCHBD-OAHLLOKOSA-N 0 3 403.349 4.473 20 0 HIADHN C[C@@H]1[C@H](NC(=O)c2cc(F)c(F)cc2Br)CCN1Cc1ccccc1 ZINC000571474413 947664812 /nfs/dbraw/zinc/66/48/12/947664812.db2.gz FBKNZBGXIPIGTO-KZULUSFZSA-N 0 3 409.274 4.120 20 0 HIADHN CN(C)C[C@H](NC(=O)c1cccc(OCc2cscn2)c1)c1ccc(Cl)cc1 ZINC000571823890 947795674 /nfs/dbraw/zinc/79/56/74/947795674.db2.gz YOUSODSHRLDULH-FQEVSTJZSA-N 0 3 415.946 4.408 20 0 HIADHN CN1CC[C@H](NCC(=O)NC2(c3ccccc3)CCC2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000572207747 947864688 /nfs/dbraw/zinc/86/46/88/947864688.db2.gz KJLYMTXRYYRADE-UNMCSNQZSA-N 0 3 415.940 4.010 20 0 HIADHN CN(C)C[C@H](NC(=O)N[C@H]1CCO[C@H](c2ccc(F)cc2)C1)c1ccc(Cl)cc1 ZINC000572224657 947866786 /nfs/dbraw/zinc/86/67/86/947866786.db2.gz DRRCMCBZPZSQJH-ACRUOGEOSA-N 0 3 419.928 4.301 20 0 HIADHN CC1CCN([C@H](CNC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)c2ccccc2)CC1 ZINC000572231216 947868810 /nfs/dbraw/zinc/86/88/10/947868810.db2.gz CMCFXAQPUJUALE-JOCHJYFZSA-N 0 3 409.530 4.462 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)[C@H]1C[C@@H]1c1ccc(Cl)c(Cl)c1 ZINC000572309970 947880144 /nfs/dbraw/zinc/88/01/44/947880144.db2.gz LLJXHQAOWBJXNJ-KSZLIROESA-N 0 3 405.325 4.302 20 0 HIADHN Cc1noc(C)c1CO[C@H]1CCN(Cc2ccc(-n3cnc4ccccc43)cc2)C1 ZINC000572324888 947884975 /nfs/dbraw/zinc/88/49/75/947884975.db2.gz LKPYRQACXNPQGH-NRFANRHFSA-N 0 3 402.498 4.421 20 0 HIADHN COc1ccc([C@H]2CCCCCN2C(=O)CN2CCCC3(CCOCC3)C2)cc1 ZINC000572331270 947886808 /nfs/dbraw/zinc/88/68/08/947886808.db2.gz BRQCDPMJGRIOHO-JOCHJYFZSA-N 0 3 400.563 4.032 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)c1cc2c(cc1F)NC(=O)CC2)c1ccc(Cl)cc1 ZINC000572370316 947889892 /nfs/dbraw/zinc/88/98/92/947889892.db2.gz LZKZKEBCTHEVOR-FQEVSTJZSA-N 0 3 417.912 4.177 20 0 HIADHN COc1ccc([C@@H](Cc2ccccc2)NCC(=O)Nc2cc(OC)cc(OC)c2)cc1 ZINC000572412931 947896573 /nfs/dbraw/zinc/89/65/73/947896573.db2.gz GCUMKNOBAXUYAQ-XMMPIXPASA-N 0 3 420.509 4.225 20 0 HIADHN COc1ccc(-c2nc(CN[C@H]3CCN(C)[C@H]3c3ccccc3)cs2)cc1OC ZINC000572446103 947909275 /nfs/dbraw/zinc/90/92/75/947909275.db2.gz FCMADSJFMCSPCT-UGKGYDQZSA-N 0 3 409.555 4.362 20 0 HIADHN COc1ccc(C(=O)N(Cc2ccccc2Br)C2CCN(C)CC2)cc1 ZINC000572570530 947951458 /nfs/dbraw/zinc/95/14/58/947951458.db2.gz POKPBHUFJOFXQF-UHFFFAOYSA-N 0 3 417.347 4.194 20 0 HIADHN Cc1nn(-c2ccc(Br)cc2)cc1CN1CCC[C@](CO)(C(C)C)C1 ZINC000572669366 947976022 /nfs/dbraw/zinc/97/60/22/947976022.db2.gz VLIAHKPUVRWCAN-FQEVSTJZSA-N 0 3 406.368 4.174 20 0 HIADHN O=C(Nc1ccc(-c2noc(C(F)F)n2)cc1)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000573109525 948079545 /nfs/dbraw/zinc/07/95/45/948079545.db2.gz AXJMINIPVHLRGO-KRWDZBQOSA-N 0 3 413.428 4.070 20 0 HIADHN CCn1cc(C(=O)NC[C@H](c2ccc(CC(C)C)cc2)N(C)C)c(C(F)(F)F)n1 ZINC000573312108 948153926 /nfs/dbraw/zinc/15/39/26/948153926.db2.gz DLWRVXWLBRAKLJ-GOSISDBHSA-N 0 3 410.484 4.153 20 0 HIADHN C[C@@H]1[C@H](NC(=O)N2CCC(C(F)(F)F)(C(F)(F)F)C2)CCN1Cc1ccccc1 ZINC000573474674 948211613 /nfs/dbraw/zinc/21/16/13/948211613.db2.gz CKPAFLBADICKEB-UKRRQHHQSA-N 0 3 423.401 4.176 20 0 HIADHN CC(C)N1CC[C@@H](NCC(=O)Nc2cc(C(C)(C)C)no2)[C@H]1c1ccc(F)c(F)c1 ZINC000573573303 948240071 /nfs/dbraw/zinc/24/00/71/948240071.db2.gz WVNFADRNGXGEQZ-DYESRHJHSA-N 0 3 420.504 4.002 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1cc(Cl)ccc1N1CCOCC1)c1ccco1 ZINC000573751921 948288905 /nfs/dbraw/zinc/28/89/05/948288905.db2.gz OECIVWWYXDGEGB-MAUKXSAKSA-N 0 3 420.941 4.021 20 0 HIADHN C[C@@H](C(=O)N(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1)C(F)(F)F ZINC000573825047 948303634 /nfs/dbraw/zinc/30/36/34/948303634.db2.gz FWYCSVNXBGKWDR-FXAWDEMLSA-N 0 3 405.464 4.273 20 0 HIADHN CN1CCO[C@H]([C@@H](NC[C@H]2CC[C@H](c3ccccc3)O2)c2ccc(Cl)cc2)C1 ZINC000573836752 948307049 /nfs/dbraw/zinc/30/70/49/948307049.db2.gz KCLBMQBYRHMEJH-LUKWVAJMSA-N 0 3 400.950 4.222 20 0 HIADHN COc1ccc([C@H](CNC(=O)NC[C@H]2CC[C@@H](c3ccccc3)O2)N2CCCC2)cc1 ZINC000573852158 948311389 /nfs/dbraw/zinc/31/13/89/948311389.db2.gz BOWNSIHWTKYNKC-SGNDLWITSA-N 0 3 423.557 4.052 20 0 HIADHN Cc1ccc([C@H]2OCCC[C@@H]2NCc2cn3ccc(Br)cc3n2)cc1 ZINC000573965220 948336387 /nfs/dbraw/zinc/33/63/87/948336387.db2.gz JUPCLBOPXMJLCB-AZUAARDMSA-N 0 3 400.320 4.415 20 0 HIADHN OC1(Cc2ccc(F)cc2F)C[C@H]2CC[C@@H](C1)N2Cc1cccc2c1OCCCO2 ZINC000574201543 948385853 /nfs/dbraw/zinc/38/58/53/948385853.db2.gz RIXDLIAWUSZQBN-VXMMSVGHSA-N 0 3 415.480 4.227 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)Nc2cccnc2C(F)(F)F)N(C)C)cc1 ZINC000574313681 948409788 /nfs/dbraw/zinc/40/97/88/948409788.db2.gz PBMBLQSJUHSXFU-KRWDZBQOSA-N 0 3 410.440 4.312 20 0 HIADHN C[C@H](NCc1coc(-c2ccc(F)c(F)c2)n1)C1CCN(CC(F)(F)F)CC1 ZINC000574579447 948480340 /nfs/dbraw/zinc/48/03/40/948480340.db2.gz JMDVDUWAYDORNE-LBPRGKRZSA-N 0 3 403.395 4.372 20 0 HIADHN COc1cccc([C@@H]2[C@@H](NCc3nc4cc(Cl)ccc4n3C)CCN2C2CC2)c1 ZINC000574827387 948536990 /nfs/dbraw/zinc/53/69/90/948536990.db2.gz YJXJFQHYULWPAI-WMZHIEFXSA-N 0 3 410.949 4.303 20 0 HIADHN Cc1c(NC(=O)N[C@@H]2CCN(Cc3ccccc3)[C@H]2C)cccc1C(=O)N1CCCC1 ZINC000574839162 948540619 /nfs/dbraw/zinc/54/06/19/948540619.db2.gz HFIITEYNNWVTGW-WMZHIEFXSA-N 0 3 420.557 4.016 20 0 HIADHN CC(C)N1CC[C@@H](NCC(=O)N[C@@H](C)c2cccs2)[C@H]1c1ccc(F)c(F)c1 ZINC000574929185 948552774 /nfs/dbraw/zinc/55/27/74/948552774.db2.gz TZZZNPXOMNRVCT-FIKMYACPSA-N 0 3 407.530 4.017 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)c1ccc(OCc2ccncc2)cc1 ZINC000575035429 948581101 /nfs/dbraw/zinc/58/11/01/948581101.db2.gz MASAPIPHGPWYNR-NRFANRHFSA-N 0 3 415.537 4.397 20 0 HIADHN CN(C)C[C@H](NC(=O)c1cnc(Cc2ccc(F)cc2)s1)c1ccc(F)cc1 ZINC000575085330 948588354 /nfs/dbraw/zinc/58/83/54/948588354.db2.gz JFXJYCQWKKSNIU-SFHVURJKSA-N 0 3 401.482 4.045 20 0 HIADHN CC[C@H](C)c1nc([C@@H](C)NC(=O)NC[C@H](c2ccccc2Cl)N2CCCC2)n[nH]1 ZINC000575235290 948639467 /nfs/dbraw/zinc/63/94/67/948639467.db2.gz CAEYVXQMAKZRCO-HDMKZQKVSA-N 0 3 418.973 4.169 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)c1cn(C)nc1-c1ccccc1Cl)c1ccco1 ZINC000575351213 948650341 /nfs/dbraw/zinc/65/03/41/948650341.db2.gz JGJIIPMGOIWCEH-KDOFPFPSSA-N 0 3 400.910 4.193 20 0 HIADHN C[C@H](NC(=O)CN[C@@H]1CCN(C)[C@@H]1c1ccccc1)c1ccc(Cl)c(Cl)c1 ZINC000575370019 948659403 /nfs/dbraw/zinc/65/94/03/948659403.db2.gz KUURBOQLTBYGOT-UQIDSAAFSA-N 0 3 406.357 4.206 20 0 HIADHN CN(C)[C@]1(CN[C@@H](c2ccc(Br)o2)c2ccc(F)cc2)CCSC1 ZINC000575783882 948705884 /nfs/dbraw/zinc/70/58/84/948705884.db2.gz LSTTYIOPXJCLJL-MSOLQXFVSA-N 0 3 413.356 4.298 20 0 HIADHN COc1ccc([C@H]2CCCN2C(=O)N[C@H](C)CN(C)Cc2ccccc2)cc1OC ZINC000575810730 948720775 /nfs/dbraw/zinc/72/07/75/948720775.db2.gz VYQCUCWWKAZZCS-WIYYLYMNSA-N 0 3 411.546 4.071 20 0 HIADHN Cc1nc(C(F)(F)N2CCC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)nc(Cl)c1C ZINC001164621075 719085893 /nfs/dbraw/zinc/08/58/93/719085893.db2.gz GXFQOTUOQOODBS-MSOLQXFVSA-N 0 3 406.908 4.393 20 0 HIADHN Cc1nc2sc3c(c2c(N2CC[C@H]4[C@@H]2CCN4Cc2cccnc2)n1)CCCC3 ZINC001164734511 720431382 /nfs/dbraw/zinc/43/13/82/720431382.db2.gz SXJDDYWHPWSZMY-OALUTQOASA-N 0 3 405.571 4.127 20 0 HIADHN Cc1cc(-c2ccccc2F)nnc1N1CCN2C[C@@H](Oc3cccc(F)c3)C[C@H]2C1 ZINC001164904669 721564596 /nfs/dbraw/zinc/56/45/96/721564596.db2.gz FDOJKWHRUGKMKI-ICSRJNTNSA-N 0 3 422.479 4.072 20 0 HIADHN Cc1cnc(N2CCN3C[C@H](Oc4cccc(F)c4)C[C@H]3C2)nc1-c1ccccc1F ZINC001164911886 721565520 /nfs/dbraw/zinc/56/55/20/721565520.db2.gz ZVCRYZBRKQAXDQ-AZUAARDMSA-N 0 3 422.479 4.072 20 0 HIADHN Cc1nc2ccccc2c(N2CCC(F)(F)[C@]3(CCN(Cc4ccccn4)C3)C2)n1 ZINC001164907412 721692885 /nfs/dbraw/zinc/69/28/85/721692885.db2.gz SJSPEETWLVTMEZ-QFIPXVFZSA-N 0 3 409.484 4.071 20 0 HIADHN FC1(F)CCN(c2cc(Cl)nc3c2CCC3)C[C@@]12CCN(Cc1ccccn1)C2 ZINC001164907838 721695514 /nfs/dbraw/zinc/69/55/14/721695514.db2.gz VCOHWTSQUARFGO-NRFANRHFSA-N 0 3 418.919 4.356 20 0 HIADHN CCOc1cc(Cl)nc(N2CCC(F)(F)[C@]3(CCN(Cc4ccccn4)C3)C2)c1 ZINC001164904240 721701678 /nfs/dbraw/zinc/70/16/78/721701678.db2.gz DYNODBIMTDHKKO-FQEVSTJZSA-N 0 3 422.907 4.266 20 0 HIADHN COc1cc(N2CCC(F)(F)[C@]3(CCN(Cc4ccccn4)C3)C2)nc2ccccc21 ZINC001164905737 721716151 /nfs/dbraw/zinc/71/61/51/721716151.db2.gz JDRDWWVMHPEXHZ-QHCPKHFHSA-N 0 3 424.495 4.376 20 0 HIADHN Cc1nnc(N2CCC(F)(F)[C@]3(CCN(Cc4ccccn4)C3)C2)c2ccccc12 ZINC001164906669 721723157 /nfs/dbraw/zinc/72/31/57/721723157.db2.gz NQRYVNFWWONRBZ-QFIPXVFZSA-N 0 3 409.484 4.071 20 0 HIADHN Cc1cc(N2CCC(F)(F)[C@@]3(CCN(Cc4ccccn4)C3)C2)nc(C(C)(C)C)n1 ZINC001164913478 721728751 /nfs/dbraw/zinc/72/87/51/721728751.db2.gz WEHXUVYQWHXWEZ-JOCHJYFZSA-N 0 3 415.532 4.215 20 0 HIADHN Cc1cc2cccnc2c(N2CCC(F)(F)[C@@]3(CCN(Cc4ccccn4)C3)C2)n1 ZINC001164912765 721731049 /nfs/dbraw/zinc/73/10/49/721731049.db2.gz PYVIHMKVVCEKNI-JOCHJYFZSA-N 0 3 409.484 4.071 20 0 HIADHN CSCc1ccnc(N2CCC(F)(F)[C@]3(CCN(Cc4ccccn4)C3)C2)c1 ZINC001164909693 721733001 /nfs/dbraw/zinc/73/30/01/721733001.db2.gz DCKDMAYVPRKUFC-FQEVSTJZSA-N 0 3 404.530 4.077 20 0 HIADHN Cc1ccc2c(c1)nc(Cl)cc2N1CC[C@@H]2CN(Cc3cccnc3)CCO[C@@H]2C1 ZINC001164971450 722125501 /nfs/dbraw/zinc/12/55/01/722125501.db2.gz CLRIQJQOGYGQRD-AUSIDOKSSA-N 0 3 422.960 4.319 20 0 HIADHN Cc1cc(N2CC[C@@H]3CN(Cc4cccnc4)CCO[C@H]3C2)nc2cc(Cl)ccc12 ZINC001164979010 722128995 /nfs/dbraw/zinc/12/89/95/722128995.db2.gz ORSBCEHIFOCWLE-XXBNENTESA-N 0 3 422.960 4.319 20 0 HIADHN COC(=O)c1ccc2ccnc(N3CCC[C@@]4(CCN4Cc4cccc(F)c4)C3)c2c1 ZINC001164995553 722197811 /nfs/dbraw/zinc/19/78/11/722197811.db2.gz VJCKXXLOMLEYOD-RUZDIDTESA-N 0 3 419.500 4.405 20 0 HIADHN COC(=O)c1ccc2c(ccnc2N2CCC[C@@]3(CCN3Cc3cccc(F)c3)C2)c1 ZINC001164993633 722198036 /nfs/dbraw/zinc/19/80/36/722198036.db2.gz GAMSFXJHWKVXBH-RUZDIDTESA-N 0 3 419.500 4.405 20 0 HIADHN Cc1cc(N2CCC[C@]3(CCN3Cc3cccc(F)c3)C2)nc(-c2ccccn2)n1 ZINC001164996698 722207588 /nfs/dbraw/zinc/20/75/88/722207588.db2.gz VTXXRIPJQBOFNW-DEOSSOPVSA-N 0 3 403.505 4.231 20 0 HIADHN Cc1csc(CCC(=O)N[C@@H](c2ccc(F)c(F)c2)C(C)(C)N2CCCC2)n1 ZINC000436037985 861330268 /nfs/dbraw/zinc/33/02/68/861330268.db2.gz KGOASXVMRPDCLF-FQEVSTJZSA-N 0 3 407.530 4.394 20 0 HIADHN CC(C)(NCC(=O)N(Cc1nnc(-c2ccccc2Cl)o1)C1CC1)c1ccccc1 ZINC000436108421 861393482 /nfs/dbraw/zinc/39/34/82/861393482.db2.gz ZOSFEKZBTLDIEV-UHFFFAOYSA-N 0 3 424.932 4.406 20 0 HIADHN COc1ccccc1[C@H](C/N=C/c1cc(Br)ccc1O)N1CCCC1 ZINC000005292803 845099113 /nfs/dbraw/zinc/09/91/13/845099113.db2.gz IHGMHZUABBXNLN-ZFJBLLOBSA-N 0 3 403.320 4.419 20 0 HIADHN COc1ccccc1[C@@H](C/N=C/c1cc(Br)ccc1O)N1CCCC1 ZINC000005292798 845099186 /nfs/dbraw/zinc/09/91/86/845099186.db2.gz IHGMHZUABBXNLN-MNOULKQQSA-N 0 3 403.320 4.419 20 0 HIADHN COc1ccc([C@H](CNC(=O)Cc2cccc(C(F)(F)F)c2)N2CCCC2)cc1 ZINC000007265768 845298920 /nfs/dbraw/zinc/29/89/20/845298920.db2.gz BTCAJTSOGIDEDN-FQEVSTJZSA-N 0 3 406.448 4.210 20 0 HIADHN COc1cc(CNCCNC(=O)c2ccc(Cl)cc2)ccc1OCc1ccccc1 ZINC000008113766 845477491 /nfs/dbraw/zinc/47/74/91/845477491.db2.gz ISNLMGAOUKKVQE-UHFFFAOYSA-N 0 3 424.928 4.447 20 0 HIADHN COc1ccc(CNC(=O)[C@H](C)N[C@@H](c2ccc(Cl)cc2)C(C)C)cc1OC ZINC000011103626 845754000 /nfs/dbraw/zinc/75/40/00/845754000.db2.gz GJXJBXMLBBVALQ-YCRPNKLZSA-N 0 3 404.938 4.349 20 0 HIADHN Fc1cccc2[nH]c(C[NH2+]Cc3nnc(-c4ccc(Br)cc4)[n-]3)cc21 ZINC000436296410 861602624 /nfs/dbraw/zinc/60/26/24/861602624.db2.gz URUHHCXVSXELCA-UHFFFAOYSA-N 0 3 400.255 4.144 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cccc(NC(=O)OC(C)(C)C)c3)cc2)CC1 ZINC000011949963 845842753 /nfs/dbraw/zinc/84/27/53/845842753.db2.gz PJGKAGAAZNSRPD-UHFFFAOYSA-N 0 3 424.545 4.428 20 0 HIADHN Cc1nn(Cc2ccccc2)c2sc(C(=O)NC[C@@H](c3ccccc3)N(C)C)cc12 ZINC000014661230 845967219 /nfs/dbraw/zinc/96/72/19/845967219.db2.gz KCEFRWRCCOUUPO-NRFANRHFSA-N 0 3 418.566 4.487 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)N[C@H](CC(F)(F)F)c2ccc(C(F)(F)F)cc2)CCCN1C ZINC000436326781 861629868 /nfs/dbraw/zinc/62/98/68/861629868.db2.gz FCMCVJFSBJWBBZ-BYCMXARLSA-N 0 3 411.390 4.481 20 0 HIADHN CC(C)[C@@H](NCC(=O)Nc1ccccc1C(=O)NCc1ccco1)c1ccccc1 ZINC000015550309 846062179 /nfs/dbraw/zinc/06/21/79/846062179.db2.gz AYOCFBJBESRADR-HSZRJFAPSA-N 0 3 405.498 4.135 20 0 HIADHN O=C(Nc1ccccc1C(=O)NC1CCN(Cc2ccccc2)CC1)c1ccccc1 ZINC000022961920 846639657 /nfs/dbraw/zinc/63/96/57/846639657.db2.gz FKSGFPLOAAQCRU-UHFFFAOYSA-N 0 3 413.521 4.333 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)[C@@H](C)N1CCCN(Cc2ccc(C)cc2)CC1 ZINC000022995379 846646694 /nfs/dbraw/zinc/64/66/94/846646694.db2.gz LBMNYQJBUXHVQN-GOSISDBHSA-N 0 3 415.965 4.192 20 0 HIADHN O=C(c1ccc(CN2CCCN(Cc3ccc(Cl)cc3)CC2)cc1)N1CCCC1 ZINC000023010201 846647926 /nfs/dbraw/zinc/64/79/26/846647926.db2.gz UAMWAAHZHINMLA-UHFFFAOYSA-N 0 3 411.977 4.284 20 0 HIADHN COc1cc(CN(C)C[C@H](O)COc2cccc3ccccc32)ccc1OC(F)F ZINC000023408736 846696745 /nfs/dbraw/zinc/69/67/45/846696745.db2.gz LBASCUADLNZRNV-SFHVURJKSA-N 0 3 417.452 4.322 20 0 HIADHN FC(F)Sc1nc2ccccc2n1CN1CCC(c2nnc3ccccn32)CC1 ZINC000023851876 846752143 /nfs/dbraw/zinc/75/21/43/846752143.db2.gz HZBLVTBHERGZMC-UHFFFAOYSA-N 0 3 414.485 4.231 20 0 HIADHN O=C(CN[C@@H](Cc1ccccc1)c1ccccc1)Nc1cccc(C(=O)NC2CC2)c1 ZINC000024734729 846859692 /nfs/dbraw/zinc/85/96/92/846859692.db2.gz UJIYEXBABIEEBK-DEOSSOPVSA-N 0 3 413.521 4.091 20 0 HIADHN COc1ccc(CN(C)C[C@H](O)Cn2c3ccccc3c3ccccc32)cc1OC ZINC000024946880 846894802 /nfs/dbraw/zinc/89/48/02/846894802.db2.gz SUEBJTOZKCEVSE-IBGZPJMESA-N 0 3 404.510 4.305 20 0 HIADHN O=C(CN1CCC[C@H]1Cc1ccccc1)N1CCC[C@@H]1c1ccc2c(c1)OCCCO2 ZINC000025359325 846966109 /nfs/dbraw/zinc/96/61/09/846966109.db2.gz RFCUTFPFLPPLSZ-XZOQPEGZSA-N 0 3 420.553 4.219 20 0 HIADHN O[C@@H](CNc1ncnc2scc(-c3ccccc3)c21)CN1CCc2ccccc2C1 ZINC000025499739 846987601 /nfs/dbraw/zinc/98/76/01/846987601.db2.gz PJBLYADGKNQSES-FQEVSTJZSA-N 0 3 416.550 4.189 20 0 HIADHN Cc1oc(-c2ccccc2)nc1CC(=O)NC[C@H](C(C)C)N1CCc2ccccc2C1 ZINC000025540481 846996184 /nfs/dbraw/zinc/99/61/84/846996184.db2.gz YSESBTCTGCJNBH-XMMPIXPASA-N 0 3 417.553 4.392 20 0 HIADHN CC(C)[C@H](CNC(=O)c1ccc(F)cc1Br)N1CCc2ccccc2C1 ZINC000025537632 846996665 /nfs/dbraw/zinc/99/66/65/846996665.db2.gz MTZFAWCULKORTG-FQEVSTJZSA-N 0 3 419.338 4.401 20 0 HIADHN CC(C)(CNC(=O)N[C@H]1CCSc2ccc(F)cc21)N1CCc2ccccc2C1 ZINC000026163796 847097610 /nfs/dbraw/zinc/09/76/10/847097610.db2.gz AJDWXTFTYFZLQX-FQEVSTJZSA-N 0 3 413.562 4.499 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@H](C)NCc2ccc(OC(F)F)cc2)cc1 ZINC000026311104 847122597 /nfs/dbraw/zinc/12/25/97/847122597.db2.gz BPLMMTRGKFSSBT-HNNXBMFYSA-N 0 3 412.502 4.169 20 0 HIADHN COc1cccc(CN(C)C(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)c1 ZINC000026522121 847162738 /nfs/dbraw/zinc/16/27/38/847162738.db2.gz NROSIJFYEGWEMS-FQEVSTJZSA-N 0 3 401.576 4.371 20 0 HIADHN COc1ccc(CCN(Cc2ccco2)Cc2ccc(C(=O)NC3CC3)cc2)cc1 ZINC000026926964 847223501 /nfs/dbraw/zinc/22/35/01/847223501.db2.gz KPGBPDYVGIUEBY-UHFFFAOYSA-N 0 3 404.510 4.425 20 0 HIADHN Cc1noc(C)c1CSc1ncccc1C(=O)NC[C@@H](c1ccccc1)N(C)C ZINC000027456423 847306515 /nfs/dbraw/zinc/30/65/15/847306515.db2.gz KJVOAXWTNDIZSQ-FQEVSTJZSA-N 0 3 410.543 4.011 20 0 HIADHN Cc1noc(C)c1COc1ccccc1C(=O)NC[C@H](c1ccccc1)N1CCCC1 ZINC000027602570 847325517 /nfs/dbraw/zinc/32/55/17/847325517.db2.gz RAQNFYUTSKDFEI-HSZRJFAPSA-N 0 3 419.525 4.437 20 0 HIADHN c1cnn(Cc2ccccc2CNCc2cn(-c3ccccc3)nc2-c2ccncc2)c1 ZINC000028817286 847465106 /nfs/dbraw/zinc/46/51/06/847465106.db2.gz XHJAJKYIGLOCJN-UHFFFAOYSA-N 0 3 420.520 4.469 20 0 HIADHN O=C(CCN1CCN(c2ccccc2)CC1)N[C@@H](c1cccs1)c1ccccc1 ZINC000028843169 847468203 /nfs/dbraw/zinc/46/82/03/847468203.db2.gz IKGHQXAICJBRQO-XMMPIXPASA-N 0 3 405.567 4.166 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3ccc(OCC(F)(F)F)cc3)c(C)c2)CC1 ZINC000028877686 847470495 /nfs/dbraw/zinc/47/04/95/847470495.db2.gz ZPOYJBRLBAPKKM-UHFFFAOYSA-N 0 3 421.463 4.330 20 0 HIADHN CN(CCC(=O)N[C@H](c1cccs1)c1ccccc1)Cc1ccc2c(c1)OCO2 ZINC000028899842 847475862 /nfs/dbraw/zinc/47/58/62/847475862.db2.gz OQMLQGJPLCIIHX-QHCPKHFHSA-N 0 3 408.523 4.205 20 0 HIADHN CC(=O)Nc1cccc([C@@H](C)NC[C@@H](O)COc2ccc(-c3ccccc3)cc2)c1 ZINC000028917875 847477896 /nfs/dbraw/zinc/47/78/96/847477896.db2.gz URGWWAWVOWUCJT-HOYKHHGWSA-N 0 3 404.510 4.403 20 0 HIADHN COc1cc(CN[C@@H](C)c2ccc(C(F)(F)F)cc2)cc(Cl)c1OCC(N)=O ZINC000028926854 847480013 /nfs/dbraw/zinc/48/00/13/847480013.db2.gz DBELPELIRZFUII-NSHDSACASA-N 0 3 416.827 4.082 20 0 HIADHN Cc1noc(CSc2ccc(C(=O)N[C@H](CN3CCCC3)c3ccccc3)cc2)n1 ZINC000029179503 847521966 /nfs/dbraw/zinc/52/19/66/847521966.db2.gz CLPDCJATNPSDHZ-OAQYLSRUSA-N 0 3 422.554 4.237 20 0 HIADHN CC(=O)Nc1ccc(OC[C@H](O)CN[C@H](c2ccccc2)c2ccc(C)cc2)cc1 ZINC000029701008 847603735 /nfs/dbraw/zinc/60/37/35/847603735.db2.gz XHHGIPHQYBTOHL-ILBGXUMGSA-N 0 3 404.510 4.072 20 0 HIADHN O=C(NCc1cccc(NC(=O)C2CCC2)c1)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000029735311 847611036 /nfs/dbraw/zinc/61/10/36/847611036.db2.gz XVWXVLDQOCAJGI-QHCPKHFHSA-N 0 3 420.557 4.062 20 0 HIADHN Cc1ccc(-n2nc(C(=O)NC3CCN(Cc4ccccc4)CC3)c3c2CCC3)cc1 ZINC000029753128 847613550 /nfs/dbraw/zinc/61/35/50/847613550.db2.gz FIIMFUONUWPWPP-UHFFFAOYSA-N 0 3 414.553 4.064 20 0 HIADHN O=C(COC(c1ccccc1)c1ccccc1)NCCCN1CCc2ccccc2C1 ZINC000029839438 847629952 /nfs/dbraw/zinc/62/99/52/847629952.db2.gz VZOWPBHYTQDONM-UHFFFAOYSA-N 0 3 414.549 4.357 20 0 HIADHN COc1ccccc1NC(=O)C1CCN(Cc2cc(=O)oc3c(C)c(C)ccc23)CC1 ZINC000029904678 847645286 /nfs/dbraw/zinc/64/52/86/847645286.db2.gz HIJBSJCDBHCVBE-UHFFFAOYSA-N 0 3 420.509 4.269 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cccc(Nc2ncccn2)c1)c1cccc(OC)c1 ZINC000030622353 847746249 /nfs/dbraw/zinc/74/62/49/847746249.db2.gz SUXIFHMUFRJCFO-QFIPXVFZSA-N 0 3 419.529 4.042 20 0 HIADHN CCOc1cc(CNCc2ccc(C(=O)NC)cc2)ccc1OCc1ccccc1 ZINC000030671844 847756320 /nfs/dbraw/zinc/75/63/20/847756320.db2.gz WVERJIOOMVCKPT-UHFFFAOYSA-N 0 3 404.510 4.314 20 0 HIADHN COc1ccc(CNCc2cccnc2-n2cccn2)cc1OCc1ccccc1 ZINC000030902086 847796262 /nfs/dbraw/zinc/79/62/62/847796262.db2.gz CDNNJCZSIYZGLZ-UHFFFAOYSA-N 0 3 400.482 4.145 20 0 HIADHN COc1cc(CNC[C@H](c2c(F)cccc2Cl)N2CCCC2)cc(OC)c1OC ZINC000030910886 847796915 /nfs/dbraw/zinc/79/69/15/847796915.db2.gz FUDMLRIQKOHCEC-GOSISDBHSA-N 0 3 422.928 4.432 20 0 HIADHN COc1cc(Br)c(CN[C@@H]2CCCN(Cc3ccccc3)C2)cc1OC ZINC000030908967 847797219 /nfs/dbraw/zinc/79/72/19/847797219.db2.gz YWQCWCZSUAYNPG-GOSISDBHSA-N 0 3 419.363 4.221 20 0 HIADHN Cc1ccc(-c2cnc(CCC(=O)N[C@@H]3CCCN(Cc4ccccc4)C3)o2)cc1 ZINC000031544450 847904926 /nfs/dbraw/zinc/90/49/26/847904926.db2.gz RNGSVYIHPXGDML-JOCHJYFZSA-N 0 3 403.526 4.363 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)c2cc(OCc3ccccc3)ccc2O)CC1 ZINC000436545077 861844776 /nfs/dbraw/zinc/84/47/76/861844776.db2.gz GFABKPSKEYXBAE-UHFFFAOYSA-N 0 3 420.509 4.301 20 0 HIADHN CCN(CC)[C@H](CNC(=O)COc1ccccc1C(F)(F)F)c1ccsc1 ZINC000031983449 847975015 /nfs/dbraw/zinc/97/50/15/847975015.db2.gz ZXYPCKYTRAPDNJ-MRXNPFEDSA-N 0 3 400.466 4.345 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)c3csc4c3CCCC4)CC2)c1 ZINC000032068073 847984812 /nfs/dbraw/zinc/98/48/12/847984812.db2.gz MQKWMKQTFIMSCZ-UHFFFAOYSA-N 0 3 411.615 4.268 20 0 HIADHN CC[C@@H](CNC(=O)c1cccc(OCc2cscn2)c1)N1CCc2ccccc2C1 ZINC000032446999 848028481 /nfs/dbraw/zinc/02/84/81/848028481.db2.gz SMJFYYGWUQHUQI-QFIPXVFZSA-N 0 3 421.566 4.289 20 0 HIADHN O=C(CCCc1ncc(-c2ccccc2)o1)NCC1(N2CCSCC2)CCCC1 ZINC000032666758 848061690 /nfs/dbraw/zinc/06/16/90/848061690.db2.gz BOCXAHJAAGXERI-UHFFFAOYSA-N 0 3 413.587 4.142 20 0 HIADHN O=C(Cc1csc(Cc2ccccc2)n1)NC[C@@H](c1cccs1)N1CCCC1 ZINC000032762969 848073528 /nfs/dbraw/zinc/07/35/28/848073528.db2.gz DUPGTOPOSFBMOK-IBGZPJMESA-N 0 3 411.596 4.291 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Cc3csc(-c4ccccc4)n3)c(C)c2)CC1 ZINC000036632467 848150914 /nfs/dbraw/zinc/15/09/14/848150914.db2.gz YDQRBUSWXKUOII-UHFFFAOYSA-N 0 3 420.582 4.442 20 0 HIADHN COc1cccc(CN2CCC(C(=O)Nc3cccc(Br)c3)CC2)c1 ZINC000038833954 848180816 /nfs/dbraw/zinc/18/08/16/848180816.db2.gz ZOYGMBSVHVLCOA-UHFFFAOYSA-N 0 3 403.320 4.308 20 0 HIADHN N#CC(C(=O)C[C@@H](NC(=O)c1ccccc1)c1ccccc1)c1nc2ccccc2[nH]1 ZINC000041497893 848222705 /nfs/dbraw/zinc/22/27/05/848222705.db2.gz LNJCLLIBTMJKMI-SIKLNZKXSA-N 0 3 408.461 4.301 20 0 HIADHN N#CC(C(=O)CC[C@@H]1Cc2ccccc2NC1=O)c1nc2ccccc2n1C(F)F ZINC000041557292 848231550 /nfs/dbraw/zinc/23/15/50/848231550.db2.gz TYBCBFCHPMJPAA-CABCVRRESA-N 0 3 408.408 4.199 20 0 HIADHN COc1cc(-c2nc(CN3CCCC[C@@H]3[C@@H]3CCCC[C@H]3O)cs2)ccc1O ZINC000436659801 861884760 /nfs/dbraw/zinc/88/47/60/861884760.db2.gz AZOPZUPFRBUVAW-IPMKNSEASA-N 0 3 402.560 4.430 20 0 HIADHN c1c(CNCc2ccnc(N3CCCC3)c2)c(-c2ccncc2)nn1-c1ccccc1 ZINC000042207721 848301623 /nfs/dbraw/zinc/30/16/23/848301623.db2.gz LPEGHDDMMAOCKX-UHFFFAOYSA-N 0 3 410.525 4.219 20 0 HIADHN O[C@H](COc1cc(Cl)ccc1Cl)CN1CCC([C@H](O)c2ccccc2)CC1 ZINC000042657704 848340072 /nfs/dbraw/zinc/34/00/72/848340072.db2.gz ILDADSSZZDBLRT-GHTZIAJQSA-N 0 3 410.341 4.179 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)N1CC=C(c2c[nH]c3ncccc23)CC1 ZINC000042813191 848356674 /nfs/dbraw/zinc/35/66/74/848356674.db2.gz KPVNBBOJNGUEQA-HSZRJFAPSA-N 0 3 415.541 4.199 20 0 HIADHN CC(C)[C@@H](NC(=O)NC[C@@H](c1cccs1)N1CCCC1)c1nc2ccccc2[nH]1 ZINC000043107349 848385748 /nfs/dbraw/zinc/38/57/48/848385748.db2.gz GVRALBWLNQYFSI-AZUAARDMSA-N 0 3 411.575 4.458 20 0 HIADHN O=C(NCc1cc(Br)cs1)NC[C@H](c1cccs1)N1CCCC1 ZINC000043231502 848397747 /nfs/dbraw/zinc/39/77/47/848397747.db2.gz QLXJIPXSVPQBGN-CQSZACIVSA-N 0 3 414.394 4.208 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCCc3cccc4cccnc43)c(C)c2)CC1 ZINC000043521305 848434494 /nfs/dbraw/zinc/43/44/94/848434494.db2.gz VVYFROHQMJQVMU-UHFFFAOYSA-N 0 3 417.557 4.049 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N(C)Cc3ccc(Cl)cc3)c(C)c2)CC1 ZINC000043522217 848434954 /nfs/dbraw/zinc/43/49/54/848434954.db2.gz MINUVMWEODZTCO-UHFFFAOYSA-N 0 3 400.954 4.454 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1csc(Br)c1)c1cccc(OC)c1 ZINC000043728063 848454969 /nfs/dbraw/zinc/45/49/69/848454969.db2.gz HEUWEYIRCKNOTM-INIZCTEOSA-N 0 3 411.365 4.332 20 0 HIADHN Cc1ccc(-c2nc(CC(=O)NC[C@@H](c3cccs3)N3CCCC3)cs2)o1 ZINC000043803461 848469742 /nfs/dbraw/zinc/46/97/42/848469742.db2.gz HPMZGCNQCADIQQ-INIZCTEOSA-N 0 3 401.557 4.269 20 0 HIADHN CC(C)C(=O)Nc1cccc(NC(=O)NC[C@H](c2cccs2)N2CCCC2)c1 ZINC000044084343 848512823 /nfs/dbraw/zinc/51/28/23/848512823.db2.gz RYPVGTWWAMJREX-GOSISDBHSA-N 0 3 400.548 4.301 20 0 HIADHN CN(C)C[C@@H]1CCc2ccccc2N1C(=O)c1csc(-c2ccc3c(c2)OCO3)n1 ZINC000436727148 861911838 /nfs/dbraw/zinc/91/18/38/861911838.db2.gz XVKKGMDBYNCYEW-KRWDZBQOSA-N 0 3 421.522 4.062 20 0 HIADHN CN(C)Cc1cccc(NC(=O)N2CCN(c3cccc(C(F)(F)F)c3)CC2)c1 ZINC000044293330 848540427 /nfs/dbraw/zinc/54/04/27/848540427.db2.gz ZGMNQALLKTWPHJ-UHFFFAOYSA-N 0 3 406.452 4.121 20 0 HIADHN Cc1ccc(NC(=O)NC(=O)[C@@H](C)N[C@H](C)c2ccc(OC(F)F)cc2)c(C)c1 ZINC000044803503 848605970 /nfs/dbraw/zinc/60/59/70/848605970.db2.gz BSAOQJAFRCEXJZ-HUUCEWRRSA-N 0 3 405.445 4.292 20 0 HIADHN C=CCOc1ccc(/C=C/C(=O)Nc2ccc(N3CCN(CC)CC3)cc2)cc1OC ZINC000045396492 848673593 /nfs/dbraw/zinc/67/35/93/848673593.db2.gz OWDAOPQOZUYOKH-NTUHNPAUSA-N 0 3 421.541 4.054 20 0 HIADHN Cc1ccccc1CN1CCCN(C(=O)NCCc2cccc3cccnc32)CC1 ZINC000045411022 848676726 /nfs/dbraw/zinc/67/67/26/848676726.db2.gz BUMKQLXXJQLMEQ-UHFFFAOYSA-N 0 3 402.542 4.003 20 0 HIADHN COc1cc([C@H](C)NC(=O)N(CCN(C)C)Cc2ccccc2)ccc1OC(C)C ZINC000046670307 848903496 /nfs/dbraw/zinc/90/34/96/848903496.db2.gz NYYUMFCJUJSNDO-IBGZPJMESA-N 0 3 413.562 4.317 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)c1[nH]c2ccccc2c1Br ZINC000047302235 849021919 /nfs/dbraw/zinc/02/19/19/849021919.db2.gz JUAFTURAHXGWFD-SFHVURJKSA-N 0 3 412.331 4.497 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)c2cnn(C(C)(C)C)c2C(F)(F)F)N(C)C)cc1 ZINC000047330486 849026728 /nfs/dbraw/zinc/02/67/28/849026728.db2.gz HWAXIQMGBRJSMB-QGZVFWFLSA-N 0 3 410.484 4.252 20 0 HIADHN COc1cc(OC)c(NC(=O)N(CCN(C)C)Cc2ccccc2F)cc1Cl ZINC000047352545 849030881 /nfs/dbraw/zinc/03/08/81/849030881.db2.gz MBRKMKAUDZATDH-UHFFFAOYSA-N 0 3 409.889 4.092 20 0 HIADHN CN(C)Cc1cccc(NC(=O)C[C@@H](NC(=O)c2ccccc2)c2ccccc2)c1 ZINC000047452965 849050667 /nfs/dbraw/zinc/05/06/67/849050667.db2.gz HTNDGRBMAQCALV-HSZRJFAPSA-N 0 3 401.510 4.248 20 0 HIADHN CC(C)[C@H](NC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)Nc1cccc(CN(C)C)c1 ZINC000047453366 849050925 /nfs/dbraw/zinc/05/09/25/849050925.db2.gz PDGJOWVEOWGRRH-LFCNWEHWSA-N 0 3 411.590 4.044 20 0 HIADHN Cc1c(C(=O)Nc2cccc(CN(C)C)c2)cnn1-c1ccc(Br)cc1 ZINC000047454053 849050965 /nfs/dbraw/zinc/05/09/65/849050965.db2.gz IDTJJKJSJHXSEN-UHFFFAOYSA-N 0 3 413.319 4.257 20 0 HIADHN O=C(C[C@@H]1C=CCC1)NCCCCN1CCN(c2cccc(C(F)(F)F)c2)CC1 ZINC000047460955 849052169 /nfs/dbraw/zinc/05/21/69/849052169.db2.gz OEMUBXZUPCUZKP-GOSISDBHSA-N 0 3 409.496 4.080 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCCc3ccc(Cl)s3)c(C)c2)CC1 ZINC000047747521 849104223 /nfs/dbraw/zinc/10/42/23/849104223.db2.gz QHMYEXQVZYLKJO-UHFFFAOYSA-N 0 3 406.983 4.216 20 0 HIADHN CCCNC(=O)c1cccc(CNCc2ccc(-n3ccc(C(F)(F)F)n3)cc2)c1 ZINC000047793987 849113169 /nfs/dbraw/zinc/11/31/69/849113169.db2.gz HKCNCJVNCRVHRD-UHFFFAOYSA-N 0 3 416.447 4.321 20 0 HIADHN CCC(CC)(CNC(=O)c1cc(OC)c([O-])c(OC)c1)[NH2+][C@@H](C)c1ccccc1 ZINC000436788972 861981633 /nfs/dbraw/zinc/98/16/33/861981633.db2.gz ALGMBGMOBHWUDC-INIZCTEOSA-N 0 3 400.519 4.049 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)Nc1ccc(Br)cc1F ZINC000048051964 849154462 /nfs/dbraw/zinc/15/44/62/849154462.db2.gz CUDTZAITWZBSEG-UHFFFAOYSA-N 0 3 412.278 4.323 20 0 HIADHN c1cn(-c2ccc(CNCc3ccc(OCCOc4ccccc4)nc3)cc2)cn1 ZINC000048749761 849264725 /nfs/dbraw/zinc/26/47/25/849264725.db2.gz PENYMNLIZIJJLA-UHFFFAOYSA-N 0 3 400.482 4.015 20 0 HIADHN Cc1nn(Cc2c(Cl)cccc2Cl)c(Cl)c1CNCCc1cnn(C)c1 ZINC000048784592 849268312 /nfs/dbraw/zinc/26/83/12/849268312.db2.gz QGJYCFPWZVWKJO-UHFFFAOYSA-N 0 3 412.752 4.266 20 0 HIADHN C[C@@H]([NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1)c1ccccc1Br ZINC000436825913 862007383 /nfs/dbraw/zinc/00/73/83/862007383.db2.gz FTRATIPVPYMUNL-CQSZACIVSA-N 0 3 403.320 4.110 20 0 HIADHN Cc1ccc2[nH]c3c(c2c1)CCC[C@@H]3[NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1 ZINC000436834183 862015407 /nfs/dbraw/zinc/01/54/07/862015407.db2.gz OHNJRXMWELIMKA-QFIPXVFZSA-N 0 3 403.526 4.454 20 0 HIADHN Cc1ccccc1CN1CCCN(C(=O)NCCCCOCc2ccccc2)CC1 ZINC000051312571 849457089 /nfs/dbraw/zinc/45/70/89/849457089.db2.gz PBLHMVVKSLGTBP-UHFFFAOYSA-N 0 3 409.574 4.209 20 0 HIADHN COc1ccc(C(=O)NC[C@H]2CCC[N@H+](C)[C@H]2c2ccc(C(F)(F)F)cc2)c([O-])c1 ZINC000436848525 862025710 /nfs/dbraw/zinc/02/57/10/862025710.db2.gz AJFGZLMIEQQXSA-QRWLVFNGSA-N 0 3 422.447 4.233 20 0 HIADHN COc1ccc(C(=O)NC[C@H]2CCC[N@@H+](C)[C@H]2c2ccc(C(F)(F)F)cc2)c([O-])c1 ZINC000436848525 862025735 /nfs/dbraw/zinc/02/57/35/862025735.db2.gz AJFGZLMIEQQXSA-QRWLVFNGSA-N 0 3 422.447 4.233 20 0 HIADHN COc1cccc(CN2CCC(NC(=O)c3ccccc3Oc3cccnc3)CC2)c1 ZINC000052027037 849543678 /nfs/dbraw/zinc/54/36/78/849543678.db2.gz IUIJFBJSQJYFGV-UHFFFAOYSA-N 0 3 417.509 4.277 20 0 HIADHN Cc1ccccc1C(=O)NC1CCN(CCC(=O)Nc2ccc(Cl)cc2F)CC1 ZINC000052747159 849622550 /nfs/dbraw/zinc/62/25/50/849622550.db2.gz XKKXHPJTLDWHGS-UHFFFAOYSA-N 0 3 417.912 4.011 20 0 HIADHN CC(C)CN(C(=O)CCc1ncc(-c2ccc(F)cc2F)o1)C1CCN(C)CC1 ZINC000053231602 849682854 /nfs/dbraw/zinc/68/28/54/849682854.db2.gz QGEYCQMJUPGBPZ-UHFFFAOYSA-N 0 3 405.489 4.131 20 0 HIADHN Cc1cccc(N2CCN(C(=O)NC[C@@H](c3cccs3)N3CCCC3)CC2)c1C ZINC000053547801 849729972 /nfs/dbraw/zinc/72/99/72/849729972.db2.gz YJAULKXQBJZAEM-NRFANRHFSA-N 0 3 412.603 4.034 20 0 HIADHN CCN(Cc1ccc(N(C)C)cc1)C(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000053548389 849731140 /nfs/dbraw/zinc/73/11/40/849731140.db2.gz IRJFLZYLFLPTNO-FQEVSTJZSA-N 0 3 400.592 4.183 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)c2ccc(OCc3ccncc3)cc2)C1 ZINC000054223713 849828547 /nfs/dbraw/zinc/82/85/47/849828547.db2.gz ZLXAGYVHDVWAPT-XXBNENTESA-N 0 3 401.510 4.226 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)CCCc2nc(-c3cccs3)no2)C1 ZINC000054223095 849828743 /nfs/dbraw/zinc/82/87/43/849828743.db2.gz PHKHSAPYETXXBG-WMZOPIPTSA-N 0 3 410.543 4.073 20 0 HIADHN Cc1noc(C)c1COc1ccccc1C(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000054223953 849828775 /nfs/dbraw/zinc/82/87/75/849828775.db2.gz FDJVNFZUQXHJOL-GHTZIAJQSA-N 0 3 419.525 4.436 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)c2cnn(-c3ccccc3)c2C2CC2)C1 ZINC000054223668 849829064 /nfs/dbraw/zinc/82/90/64/849829064.db2.gz GANKSOIWKQRXGR-NQIIRXRSSA-N 0 3 400.526 4.315 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)c2cccc(NC(=O)c3ccco3)c2)C1 ZINC000054228092 849830517 /nfs/dbraw/zinc/83/05/17/849830517.db2.gz ONUCRRNVWHZPLO-UTKZUKDTSA-N 0 3 403.482 4.097 20 0 HIADHN Cc1ccc(C(=O)NCCN(C)Cc2ccccc2)cc1NC(=O)c1ccccc1 ZINC000054265402 849836245 /nfs/dbraw/zinc/83/62/45/849836245.db2.gz MGJWQTKTOSVFDU-UHFFFAOYSA-N 0 3 401.510 4.109 20 0 HIADHN CCOCCOCc1cccc(NC(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)c1 ZINC000054435452 849867113 /nfs/dbraw/zinc/86/71/13/849867113.db2.gz DNLWYZYHUUBDBO-CVDCTZTESA-N 0 3 411.546 4.197 20 0 HIADHN CC[C@@H](C)NC(=O)c1ccc(NC(=O)NC[C@H](c2ccccc2)N2CCCC2)cc1 ZINC000054478312 849875518 /nfs/dbraw/zinc/87/55/18/849875518.db2.gz PHKVCNXFIKOTET-XMSQKQJNSA-N 0 3 408.546 4.174 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)NC[C@@H](c2ccccc2)N2CCCC2)cc1 ZINC000054478311 849875651 /nfs/dbraw/zinc/87/56/51/849875651.db2.gz PHKVCNXFIKOTET-AVRDEDQJSA-N 0 3 408.546 4.174 20 0 HIADHN CC[C@@H](C)NC(=O)c1ccc(NC(=O)NC[C@H](c2cccs2)N2CCCC2)cc1 ZINC000054478316 849876725 /nfs/dbraw/zinc/87/67/25/849876725.db2.gz QHDTZAVLWYLVBK-VQIMIIECSA-N 0 3 414.575 4.235 20 0 HIADHN Cc1cc(C)cc(C(=O)N2CCC[C@H](C(=O)C(C#N)c3nc4ccccc4o3)C2)c1 ZINC000054735689 849914925 /nfs/dbraw/zinc/91/49/25/849914925.db2.gz RMLTXMHRQSORGX-PKOBYXMFSA-N 0 3 401.466 4.173 20 0 HIADHN C[C@H](c1ccc(-n2cncn2)cc1)N(C)Cc1cccc(C(=O)N2CCCCC2)c1 ZINC000054808087 849926219 /nfs/dbraw/zinc/92/62/19/849926219.db2.gz FCVMSEZNURBPBK-LJQANCHMSA-N 0 3 403.530 4.086 20 0 HIADHN CN1CCN(CCCNC(=O)c2ccc(-c3cc(Cl)cc(Cl)c3)s2)CC1 ZINC000055046074 849963242 /nfs/dbraw/zinc/96/32/42/849963242.db2.gz MZRWGOSPIALJJO-UHFFFAOYSA-N 0 3 412.386 4.089 20 0 HIADHN C/C(=C/c1ccccc1OC(F)F)C[NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1 ZINC000436919848 862100048 /nfs/dbraw/zinc/10/00/48/862100048.db2.gz MVXNCDBGKLKLMQ-PEZBUJJGSA-N 0 3 416.468 4.291 20 0 HIADHN Cc1cccc(-c2nnc(-c3ccc(C(=O)NC[C@H](C)N4CCCCC4)cc3)o2)c1 ZINC000055934842 850210073 /nfs/dbraw/zinc/21/00/73/850210073.db2.gz BURJCJGJTFIQKE-SFHVURJKSA-N 0 3 404.514 4.316 20 0 HIADHN Cc1ccc(CNC(=O)[C@H](C)N[C@@H](C)c2ccc(OCc3cccnc3)cc2)cc1 ZINC000056144235 850253141 /nfs/dbraw/zinc/25/31/41/850253141.db2.gz ORPGDBLRTRYECA-PMACEKPBSA-N 0 3 403.526 4.325 20 0 HIADHN CCN1CCN(c2ccc(N[C@H](C)C(=O)Nc3ccc(Cl)cc3)c(C)c2)CC1 ZINC000056170231 850269067 /nfs/dbraw/zinc/26/90/67/850269067.db2.gz KTPSUWAUJKESKF-QGZVFWFLSA-N 0 3 400.954 4.229 20 0 HIADHN O=C(Nc1ccc(F)cc1)[C@@H](NC1CCN(Cc2ccncc2)CC1)c1ccccc1 ZINC000056195793 850279875 /nfs/dbraw/zinc/27/98/75/850279875.db2.gz GEPDNMDILRXRDN-DEOSSOPVSA-N 0 3 418.516 4.155 20 0 HIADHN CN1CCN(CCC(C)(C)NC(=O)c2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)CC1 ZINC000436934957 862112853 /nfs/dbraw/zinc/11/28/53/862112853.db2.gz UXPJMVHUBMZJQU-UHFFFAOYSA-N 0 3 417.638 4.133 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N(C)Cc1ccn(-c2ccccc2)n1)c1ccsc1 ZINC000056399631 850347549 /nfs/dbraw/zinc/34/75/49/850347549.db2.gz OBMDWVZWKQNGSH-OAQYLSRUSA-N 0 3 411.575 4.158 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N[C@@H]1CCOc2c(Cl)cccc21 ZINC000056804646 850488931 /nfs/dbraw/zinc/48/89/31/850488931.db2.gz WFHYACLGRHBOET-IAGOWNOFSA-N 0 3 405.951 4.361 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)C1(c2cccc(F)c2)CCOCC1)c1ccsc1 ZINC000057211908 850579800 /nfs/dbraw/zinc/57/98/00/850579800.db2.gz YXNLDTRTALMDKB-FQEVSTJZSA-N 0 3 404.551 4.135 20 0 HIADHN COCC[N@H+](C)CCCC1CCN(C(=O)c2cc(Cc3ccccc3)ccc2[O-])CC1 ZINC000436968016 862148755 /nfs/dbraw/zinc/14/87/55/862148755.db2.gz UJOVNTJCAOOMJI-UHFFFAOYSA-N 0 3 424.585 4.194 20 0 HIADHN COCC[N@@H+](C)CCCC1CCN(C(=O)c2cc(Cc3ccccc3)ccc2[O-])CC1 ZINC000436968016 862148765 /nfs/dbraw/zinc/14/87/65/862148765.db2.gz UJOVNTJCAOOMJI-UHFFFAOYSA-N 0 3 424.585 4.194 20 0 HIADHN Cc1ccccc1CN1CCCN(C(=O)C2(c3ccccc3C)CCOCC2)CC1 ZINC000057387742 850625193 /nfs/dbraw/zinc/62/51/93/850625193.db2.gz DBPLZYMKKGJYBX-UHFFFAOYSA-N 0 3 406.570 4.086 20 0 HIADHN CCCN1CCC(NC(=O)c2cccc3c(=O)c(C)c(-c4ccccc4)oc23)CC1 ZINC000057801420 850720869 /nfs/dbraw/zinc/72/08/69/850720869.db2.gz SQEQXLPMZKQWIO-UHFFFAOYSA-N 0 3 404.510 4.373 20 0 HIADHN CCN1CCC[C@H](NC(=O)N2CCC(c3nc4cc(Cl)ccc4s3)CC2)C1 ZINC000057869753 850735971 /nfs/dbraw/zinc/73/59/71/850735971.db2.gz HCNCISLOHXIWDB-INIZCTEOSA-N 0 3 406.983 4.323 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)Nc1ccc2oc(C3CC3)nc2c1 ZINC000058073101 850762823 /nfs/dbraw/zinc/76/28/23/850762823.db2.gz OEYRMDGUFBYWQL-UHFFFAOYSA-N 0 3 400.548 4.188 20 0 HIADHN CN1CCCc2cc(CNCc3cc(Br)c4c(c3)OCCCO4)ccc21 ZINC000058476911 850834480 /nfs/dbraw/zinc/83/44/80/850834480.db2.gz XNZCHBHQOUTYST-UHFFFAOYSA-N 0 3 417.347 4.283 20 0 HIADHN Cn1c2ccccc2c(Cl)c1C(=O)NCCCCN1CCN(c2ccccc2)CC1 ZINC000058490159 850837423 /nfs/dbraw/zinc/83/74/23/850837423.db2.gz LAITVEAACJAZEH-UHFFFAOYSA-N 0 3 424.976 4.164 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCc1ccc2c(c1)CCCN2C)c1ccsc1 ZINC000058559706 850855301 /nfs/dbraw/zinc/85/53/01/850855301.db2.gz YDJZYVPMYACTDR-NRFANRHFSA-N 0 3 400.592 4.013 20 0 HIADHN COc1ccccc1-c1nc(C(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)cs1 ZINC000058697811 850892897 /nfs/dbraw/zinc/89/28/97/850892897.db2.gz HTQWFEQJURKRAX-WMZOPIPTSA-N 0 3 407.539 4.384 20 0 HIADHN CN(C)CCn1c2cc(NC(=O)c3ccc(-c4ccccc4)cc3)ccc2oc1=O ZINC000058737626 850907940 /nfs/dbraw/zinc/90/79/40/850907940.db2.gz YDOHCMFSOCXWJT-UHFFFAOYSA-N 0 3 401.466 4.075 20 0 HIADHN CCN(CC)[C@H](CNC(=O)C[C@@H](NC(C)=O)c1ccc(Cl)cc1)c1ccsc1 ZINC000058954502 850967615 /nfs/dbraw/zinc/96/76/15/850967615.db2.gz UOQIKABTQMYVCY-WOJBJXKFSA-N 0 3 421.994 4.168 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)CCCC[C@@H]2CCSS2)CC1 ZINC000058954443 850967797 /nfs/dbraw/zinc/96/77/97/850967797.db2.gz DYXXOWKIDXCLOQ-OAQYLSRUSA-N 0 3 421.676 4.154 20 0 HIADHN C[C@@](Cc1nc2ccccc2s1)(C(=O)NCCN1CCCCC1)c1ccccc1 ZINC000059280406 850991853 /nfs/dbraw/zinc/99/18/53/850991853.db2.gz ROQFUYSUQNHTLA-DEOSSOPVSA-N 0 3 407.583 4.399 20 0 HIADHN CCN1CCN(C[C@H](C)CNc2nc(C3CC3)nc3sc4c(c32)CCCC4)CC1 ZINC000060380158 851084443 /nfs/dbraw/zinc/08/44/43/851084443.db2.gz UCKFTZXIDGDTHT-MRXNPFEDSA-N 0 3 413.635 4.133 20 0 HIADHN CCn1c2ccccc2nc1SCC(=O)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000060391020 851086501 /nfs/dbraw/zinc/08/65/01/851086501.db2.gz LYDYBUNHLGGERK-NRFANRHFSA-N 0 3 408.571 4.102 20 0 HIADHN CN(C)[C@@H](CNC(=O)N(C)Cc1cc(Br)ccc1F)c1ccccc1 ZINC000060530337 851134898 /nfs/dbraw/zinc/13/48/98/851134898.db2.gz PXBIQAWFCBKMPE-SFHVURJKSA-N 0 3 408.315 4.033 20 0 HIADHN COc1ccccc1C[C@@H]1CCCN1C(=O)NC[C@H](c1ccccc1)N1CCCC1 ZINC000060529344 851135001 /nfs/dbraw/zinc/13/50/01/851135001.db2.gz GBRZDMAIHLMOLI-XZOQPEGZSA-N 0 3 407.558 4.249 20 0 HIADHN COc1ccc(C(C)(C)CNC(=O)N(CCN(C)C)Cc2ccc(F)cc2F)cc1 ZINC000060576256 851153025 /nfs/dbraw/zinc/15/30/25/851153025.db2.gz GKAKPSWMCTVVQA-UHFFFAOYSA-N 0 3 419.516 4.024 20 0 HIADHN Cc1ccc(Oc2ccccc2NC(=O)C(=O)N2CCCN(C(C)(C)C)CC2)cc1 ZINC000060690377 851192086 /nfs/dbraw/zinc/19/20/86/851192086.db2.gz ZKCBBYUAQRFJEA-UHFFFAOYSA-N 0 3 409.530 4.059 20 0 HIADHN CN(C)[C@@H](CNC(=O)NCc1ccc(COc2ccccc2)cc1)c1ccccc1 ZINC000060954835 851257626 /nfs/dbraw/zinc/25/76/26/851257626.db2.gz JVMBPBDMYIMEMD-DEOSSOPVSA-N 0 3 403.526 4.368 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2ccc(-n3cccn3)c(F)c2)N2CCCC2)cc1 ZINC000060971793 851263673 /nfs/dbraw/zinc/26/36/73/851263673.db2.gz WMHVYFXZPIGHAN-QFIPXVFZSA-N 0 3 407.493 4.278 20 0 HIADHN FC(F)Oc1ccc(CCNCc2ccccc2I)cc1 ZINC000061029582 851278424 /nfs/dbraw/zinc/27/84/24/851278424.db2.gz DJWLOQHYJRTWOM-UHFFFAOYSA-N 0 3 403.210 4.225 20 0 HIADHN CCOC(=O)c1cccc(N(CC)C(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)c1 ZINC000061188962 851312304 /nfs/dbraw/zinc/31/23/04/851312304.db2.gz YLPXTHYVNJMIEO-UHFFFAOYSA-N 0 3 423.557 4.060 20 0 HIADHN CC(C)OC(=O)C[C@H](NC(=O)NC[C@H](c1ccccc1)N1CCCC1)c1ccccc1 ZINC000061229862 851322456 /nfs/dbraw/zinc/32/24/56/851322456.db2.gz NSNAGUNCQRHPBM-XZOQPEGZSA-N 0 3 423.557 4.206 20 0 HIADHN O=C(NCc1cc(Br)ccc1F)NC[C@H](c1ccccc1)N1CCCC1 ZINC000061230233 851324211 /nfs/dbraw/zinc/32/42/11/851324211.db2.gz VOVRTGAHISSLGO-LJQANCHMSA-N 0 3 420.326 4.225 20 0 HIADHN CC(C)(CNC(=O)Nc1ccc(N2CCCCC2)nc1)N1CCc2ccccc2C1 ZINC000061398298 851365276 /nfs/dbraw/zinc/36/52/76/851365276.db2.gz RUITYRWUENMXLR-UHFFFAOYSA-N 0 3 407.562 4.030 20 0 HIADHN Cc1ccccc1CN1CCCN(C(=O)Nc2ccc(N3CCCCC3)nc2)CC1 ZINC000061397156 851365448 /nfs/dbraw/zinc/36/54/48/851365448.db2.gz DWELQCKESJFZJQ-UHFFFAOYSA-N 0 3 407.562 4.120 20 0 HIADHN COC(=O)c1cc(NC(=O)NCC(C)(C)N2CCc3ccccc3C2)ccc1Cl ZINC000061424030 851372465 /nfs/dbraw/zinc/37/24/65/851372465.db2.gz KLAHICLTDUGPAK-UHFFFAOYSA-N 0 3 415.921 4.085 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1ccccc1-n1cccn1)c1cccc(OC)c1 ZINC000061450478 851382207 /nfs/dbraw/zinc/38/22/07/851382207.db2.gz RVGNSDSOCLCDLY-QFIPXVFZSA-N 0 3 407.518 4.086 20 0 HIADHN COc1cc(C(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)ccc1OC(F)F ZINC000061503314 851391325 /nfs/dbraw/zinc/39/13/25/851391325.db2.gz CEUGBPQDZZFFHR-GOSISDBHSA-N 0 3 404.457 4.172 20 0 HIADHN COc1ccc2cc(C(=O)Nc3ccc(CCN4CCSCC4)cc3)c(C)nc2c1 ZINC000061572660 851408835 /nfs/dbraw/zinc/40/88/35/851408835.db2.gz PLALVXCUOLENDX-UHFFFAOYSA-N 0 3 421.566 4.395 20 0 HIADHN O=C(NCCc1ccc(Br)s1)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000061646670 851418657 /nfs/dbraw/zinc/41/86/57/851418657.db2.gz OFMNHLRLSBUFGS-MRXNPFEDSA-N 0 3 422.392 4.017 20 0 HIADHN CC(C)(C)c1ccc(OCc2ccc(C(=O)NC[C@H]3CN4CCC[C@H]4CO3)cc2)cc1 ZINC000061650130 851420066 /nfs/dbraw/zinc/42/00/66/851420066.db2.gz MOWDMYFMOIHJAN-UPVQGACJSA-N 0 3 422.569 4.156 20 0 HIADHN CC[C@H](C)N(CC(=O)N1CCC[C@@H]1c1ccc2c(c1)OCCO2)Cc1ccccc1 ZINC000061759917 851442581 /nfs/dbraw/zinc/44/25/81/851442581.db2.gz IFSDIVCLAPEZCI-SIKLNZKXSA-N 0 3 408.542 4.422 20 0 HIADHN Cc1cccc(OCCN(C)C(=O)Nc2ccc(CCN3CCSCC3)cc2)c1 ZINC000061791895 851453818 /nfs/dbraw/zinc/45/38/18/851453818.db2.gz XCWAUHLIYNYJKZ-UHFFFAOYSA-N 0 3 413.587 4.129 20 0 HIADHN C[C@H](CCc1ccc(O)cc1)NC(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000061792730 851454337 /nfs/dbraw/zinc/45/43/37/851454337.db2.gz GMIJTOHIJRKODS-GOSISDBHSA-N 0 3 413.587 4.126 20 0 HIADHN C[C@@H](NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1)c1cccc(OC(F)F)c1 ZINC000061966532 851482076 /nfs/dbraw/zinc/48/20/76/851482076.db2.gz CDMDGBVFQRIQEH-APWZRJJASA-N 0 3 403.473 4.313 20 0 HIADHN C[C@H]1CCCCN1CCNC(=O)C(=O)Nc1cc(Cl)ccc1Oc1ccccc1 ZINC000062121955 851503515 /nfs/dbraw/zinc/50/35/15/851503515.db2.gz RUXAFIYJTBQLOY-INIZCTEOSA-N 0 3 415.921 4.061 20 0 HIADHN CCCCCc1nnc(NC(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)s1 ZINC000062375798 851532734 /nfs/dbraw/zinc/53/27/34/851532734.db2.gz QUMVNDXGMXHKOS-UHFFFAOYSA-N 0 3 411.522 4.145 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)Nc1ccc2c(c1)OC1(CCCC1)O2 ZINC000062377620 851533928 /nfs/dbraw/zinc/53/39/28/851533928.db2.gz KDVNYWHBHYPQNW-UHFFFAOYSA-N 0 3 413.493 4.463 20 0 HIADHN CCCc1nnc(NC(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)s1 ZINC000062377950 851535407 /nfs/dbraw/zinc/53/54/07/851535407.db2.gz RGDDJUWEQSIYBH-UHFFFAOYSA-N 0 3 415.485 4.105 20 0 HIADHN CC(=O)Nc1cc(NC(=O)N(CCN(C)C)Cc2cccc(Cl)c2)ccc1F ZINC000062384245 851536714 /nfs/dbraw/zinc/53/67/14/851536714.db2.gz GSSOQYPOOWUQSV-UHFFFAOYSA-N 0 3 406.889 4.033 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)Nc1cccc(OC(F)(F)F)c1 ZINC000062384512 851538038 /nfs/dbraw/zinc/53/80/38/851538038.db2.gz WZKZKWSGVOIGKI-UHFFFAOYSA-N 0 3 417.378 4.459 20 0 HIADHN CC(C)OCc1cccc(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2F)c1 ZINC000062411489 851546363 /nfs/dbraw/zinc/54/63/63/851546363.db2.gz VWCFIDVONHJYSR-UHFFFAOYSA-N 0 3 405.489 4.486 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)NCc1cc(F)cc(F)c1 ZINC000062478381 851559823 /nfs/dbraw/zinc/55/98/23/851559823.db2.gz NAPMRIULYSQRNC-UHFFFAOYSA-N 0 3 415.406 4.257 20 0 HIADHN CC(C)Oc1ccc(CNC(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)cc1 ZINC000062478714 851560207 /nfs/dbraw/zinc/56/02/07/851560207.db2.gz HIFVJVYMOLZXLY-UHFFFAOYSA-N 0 3 405.489 4.025 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)NCC1(c2ccccc2)CCC1 ZINC000062477112 851560471 /nfs/dbraw/zinc/56/04/71/851560471.db2.gz UMRRZAHSZPKACK-UHFFFAOYSA-N 0 3 401.501 4.160 20 0 HIADHN CC(C)COc1cccc(CNC(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)c1 ZINC000062501175 851566361 /nfs/dbraw/zinc/56/63/61/851566361.db2.gz PFBGAFBVXIHUJB-UHFFFAOYSA-N 0 3 419.516 4.273 20 0 HIADHN CCOc1ccc(NC(=S)NC2CCN(Cc3ccccc3)CC2)cc1OCC ZINC000063143445 851620246 /nfs/dbraw/zinc/62/02/46/851620246.db2.gz UTNGVSLUPOGKHR-UHFFFAOYSA-N 0 3 413.587 4.435 20 0 HIADHN CN(Cc1ccc(OC(F)F)cc1)C(=S)NC1CCN(Cc2ccccc2)CC1 ZINC000063143746 851620278 /nfs/dbraw/zinc/62/02/78/851620278.db2.gz WUYBXZIPERANBZ-UHFFFAOYSA-N 0 3 419.541 4.259 20 0 HIADHN CCOC(=O)/C=C/c1ccc(NC(=S)NC2CCN(Cc3ccccc3)CC2)cc1 ZINC000063145914 851621164 /nfs/dbraw/zinc/62/11/64/851621164.db2.gz OBOBALKSVSOYMC-JLHYYAGUSA-N 0 3 423.582 4.214 20 0 HIADHN CCCN(Cc1ccc(C#N)cc1)C(=S)NC1CCN(Cc2ccccc2)CC1 ZINC000063148970 851621546 /nfs/dbraw/zinc/62/15/46/851621546.db2.gz HWYANTAUYPSVFR-UHFFFAOYSA-N 0 3 406.599 4.309 20 0 HIADHN CC(C)CNC(=O)c1ccc(NC(=S)NC2CCN(Cc3ccccc3)CC2)cc1 ZINC000063149807 851623429 /nfs/dbraw/zinc/62/34/29/851623429.db2.gz JRCPIVFRXHAQOV-UHFFFAOYSA-N 0 3 424.614 4.023 20 0 HIADHN COc1cc(CNCc2ccc(C)cc2C)cc(I)c1OC ZINC000063318957 851658989 /nfs/dbraw/zinc/65/89/89/851658989.db2.gz KKTMIGHNNKCJSW-UHFFFAOYSA-N 0 3 411.283 4.215 20 0 HIADHN COc1cccc(OC)c1OC[C@H](O)CN1Cc2ccccc2[C@H](c2ccccc2)C1 ZINC000063492284 851701722 /nfs/dbraw/zinc/70/17/22/851701722.db2.gz RAUAJPWRICTVFU-GGAORHGYSA-N 0 3 419.521 4.091 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)c(C)c1CNC[C@@H](O)COc1c(C)cccc1C ZINC000063525470 851707499 /nfs/dbraw/zinc/70/74/99/851707499.db2.gz AZYIPTVHDLLQHJ-OAQYLSRUSA-N 0 3 413.949 4.289 20 0 HIADHN Cc1cc(NC(=O)c2ccc(F)cc2Cl)sc1C(=O)NC[C@H](C)N1CCCC1 ZINC000063732756 851750223 /nfs/dbraw/zinc/75/02/23/851750223.db2.gz ABOYZNVAVWVFJW-ZDUSSCGKSA-N 0 3 423.941 4.315 20 0 HIADHN CN1C[C@@H](CN[C@@H](c2ccc(Br)cc2)c2cncnc2)Cc2ccccc21 ZINC000437092375 862284692 /nfs/dbraw/zinc/28/46/92/862284692.db2.gz GWVYCKBTMRATJW-ZHRRBRCNSA-N 0 3 423.358 4.227 20 0 HIADHN Brc1cccc(C2(NCc3ccc4c(c3)OCCO4)CCOCC2)c1 ZINC000063994951 851811848 /nfs/dbraw/zinc/81/18/48/851811848.db2.gz CENZFRIWRFGVGZ-UHFFFAOYSA-N 0 3 404.304 4.016 20 0 HIADHN Cc1ccsc1CN(C)C[C@H](O)COc1ccc(Cl)cc1Br ZINC000064138464 851833570 /nfs/dbraw/zinc/83/35/70/851833570.db2.gz YUPANFRDQFJMKS-ZDUSSCGKSA-N 0 3 404.757 4.344 20 0 HIADHN C[C@@H](NC(=O)CN1CCN(CC2CCCCC2)CC1)c1ccc(Cl)c(Cl)c1 ZINC000064129772 851833700 /nfs/dbraw/zinc/83/37/00/851833700.db2.gz MIQKAABEOHRTAH-MRXNPFEDSA-N 0 3 412.405 4.369 20 0 HIADHN Cc1ccc([C@H](CNC(=O)NCc2ccnc(N3CCCCC3)c2)N2CCCC2)cc1 ZINC000064237397 851855218 /nfs/dbraw/zinc/85/52/18/851855218.db2.gz UUQFSMRDVWITRR-QHCPKHFHSA-N 0 3 421.589 4.017 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)[C@H]1C[C@H]1c1cccc(Br)c1 ZINC000064389991 851885520 /nfs/dbraw/zinc/88/55/20/851885520.db2.gz YJLPWSUYQDYVPK-ROUUACIJSA-N 0 3 423.420 4.030 20 0 HIADHN C[C@H](NC(=O)c1cccs1)C(=O)C(C#N)c1nc(-c2c(F)cccc2F)cs1 ZINC000064714838 851964788 /nfs/dbraw/zinc/96/47/88/851964788.db2.gz QAONBTZGRXWWAK-QWRGUYRKSA-N 0 3 417.462 4.145 20 0 HIADHN Cc1nc(CN(C)[C@H]2CCCN(Cc3ccc(N(C)c4ccccc4)nc3)CC2)no1 ZINC000437117196 862304061 /nfs/dbraw/zinc/30/40/61/862304061.db2.gz NILMJUUQJLZCRP-NRFANRHFSA-N 0 3 420.561 4.027 20 0 HIADHN Cc1csc2nc(CN(Cc3ccc4c(c3)OCO4)C3CCCCC3)cc(=O)n12 ZINC000064805574 851988550 /nfs/dbraw/zinc/98/85/50/851988550.db2.gz YZBFCJQPXURRPQ-UHFFFAOYSA-N 0 3 411.527 4.128 20 0 HIADHN S=C(NCCCCN1CCN(Cc2ccccc2)CC1)Nc1ccc2c(c1)CCC2 ZINC000064893029 852012968 /nfs/dbraw/zinc/01/29/68/852012968.db2.gz OCGTXTYXJIGVAK-UHFFFAOYSA-N 0 3 422.642 4.060 20 0 HIADHN Cc1[nH]c2ccc(CNC(=S)NC3CCN(Cc4ccccc4)CC3)cc2c1C ZINC000064936095 852025429 /nfs/dbraw/zinc/02/54/29/852025429.db2.gz MSSYIWOMEOSHGB-UHFFFAOYSA-N 0 3 406.599 4.413 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCCc1ccccn1)c1ccc(C(F)(F)F)cc1 ZINC000064959849 852030721 /nfs/dbraw/zinc/03/07/21/852030721.db2.gz RNVBKTDOFJZVGT-IBGZPJMESA-N 0 3 408.468 4.025 20 0 HIADHN O=C(NC1CCN(Cc2ccc(C(=O)Nc3ccccc3)cc2)CC1)c1ccsc1 ZINC000064990517 852034634 /nfs/dbraw/zinc/03/46/34/852034634.db2.gz DTWZOUSWPSBXJQ-UHFFFAOYSA-N 0 3 419.550 4.395 20 0 HIADHN CCN(CC)[C@H](CNC(=O)CSC(F)(F)F)c1ccc(C(F)(F)F)cc1 ZINC000065121701 852071070 /nfs/dbraw/zinc/07/10/70/852071070.db2.gz XVAIWCGSNWLNKS-CYBMUJFWSA-N 0 3 402.404 4.458 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)[C@@H]1Cc2ccccc2O1)c1ccc(C(F)(F)F)cc1 ZINC000065121853 852071488 /nfs/dbraw/zinc/07/14/88/852071488.db2.gz JSUHCHCURWXKFW-ICSRJNTNSA-N 0 3 406.448 4.208 20 0 HIADHN COc1ccccc1CN(C[C@@H]1CCCO1)C(=O)c1cccc(CN2CCCC2)c1 ZINC000065132554 852075098 /nfs/dbraw/zinc/07/50/98/852075098.db2.gz UMVTYJUOQUQMQB-QHCPKHFHSA-N 0 3 408.542 4.112 20 0 HIADHN C[C@H](NC(=O)c1ccccc1NC(=O)CN(C)C(C1CC1)C1CC1)c1ccccc1 ZINC000065243512 852092389 /nfs/dbraw/zinc/09/23/89/852092389.db2.gz XXPAFGBAIUCLDM-KRWDZBQOSA-N 0 3 405.542 4.237 20 0 HIADHN CC[NH+](CC)CCn1ccc2cc(NC(=O)c3c[n-]c4ccccc4c3=O)ccc21 ZINC000065316633 852104222 /nfs/dbraw/zinc/10/42/22/852104222.db2.gz AZUUWQFQCDGHOX-UHFFFAOYSA-N 0 3 402.498 4.077 20 0 HIADHN O[C@@H](COCc1ccccc1Cl)CN(Cc1cccc(F)c1)C[C@@H]1CCCO1 ZINC000065353161 852112428 /nfs/dbraw/zinc/11/24/28/852112428.db2.gz KWCIYMGFCJMSPR-RTWAWAEBSA-N 0 3 407.913 4.038 20 0 HIADHN Cc1nn(-c2ccc(C)c(Cl)c2)c(C)c1CC(=O)NCCN(C)Cc1ccccc1 ZINC000065418234 852126060 /nfs/dbraw/zinc/12/60/60/852126060.db2.gz WJMYHBSPDGAROK-UHFFFAOYSA-N 0 3 424.976 4.242 20 0 HIADHN Cc1cccc(NC(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)c1C(=O)N1CCCC1 ZINC000065444696 852135540 /nfs/dbraw/zinc/13/55/40/852135540.db2.gz KMRUPTQERNEAAM-FPOVZHCZSA-N 0 3 420.557 4.188 20 0 HIADHN COCCCOc1ccccc1NC(=O)NCC(C)(C)N1CCc2ccccc2C1 ZINC000065456737 852140901 /nfs/dbraw/zinc/14/09/01/852140901.db2.gz JJTLTHPXEOLODS-UHFFFAOYSA-N 0 3 411.546 4.060 20 0 HIADHN O=C(NCc1ccc(OCc2ccccn2)cc1)N1CCN(CC2CCCCC2)CC1 ZINC000065459304 852142476 /nfs/dbraw/zinc/14/24/76/852142476.db2.gz HRWXIUBKSIVEKI-UHFFFAOYSA-N 0 3 422.573 4.068 20 0 HIADHN COc1ccc(CN(C)C(=O)NC[C@@H](c2ccc(C)cc2)N(C)C)cc1OC(F)F ZINC000065469641 852144752 /nfs/dbraw/zinc/14/47/52/852144752.db2.gz YUZREXGNKJTKPL-SFHVURJKSA-N 0 3 421.488 4.049 20 0 HIADHN CN(CCNC(=O)Nc1ccc(-n2nccc2C(F)(F)F)cc1)Cc1ccccc1 ZINC000065471349 852146194 /nfs/dbraw/zinc/14/61/94/852146194.db2.gz BMTSDEWRZFDIMV-UHFFFAOYSA-N 0 3 417.435 4.145 20 0 HIADHN COc1cccc(CN2CCC(NC(=O)c3c(Cl)c4ccccc4n3C)CC2)c1 ZINC000065506609 852161101 /nfs/dbraw/zinc/16/11/01/852161101.db2.gz PGQKPHKQEKKTCW-UHFFFAOYSA-N 0 3 411.933 4.235 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)NCCc2ccc(Br)s2)C1 ZINC000065522447 852167024 /nfs/dbraw/zinc/16/70/24/852167024.db2.gz JXQQVTVKRFRKTI-HOCLYGCPSA-N 0 3 422.392 4.188 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)NCc2cccnc2OC2CCCC2)C1 ZINC000065522868 852168406 /nfs/dbraw/zinc/16/84/06/852168406.db2.gz VULAPDLWNLCAJL-NQIIRXRSSA-N 0 3 408.546 4.038 20 0 HIADHN Cc1ccc(F)c(NC(=S)NCCCCN2CCN(Cc3ccccc3)CC2)c1 ZINC000065703037 852225290 /nfs/dbraw/zinc/22/52/90/852225290.db2.gz STXBQQGREHCCKS-UHFFFAOYSA-N 0 3 414.594 4.019 20 0 HIADHN CN(C)C(=O)c1cc(NC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)ccc1Cl ZINC000065866754 852290901 /nfs/dbraw/zinc/29/09/01/852290901.db2.gz KJXGEMLPDDICTE-INIZCTEOSA-N 0 3 417.912 4.032 20 0 HIADHN Fc1cc(F)cc(Oc2ccc(CNCc3ccnc(N4CCOCC4)c3)cc2)c1 ZINC000065890410 852304851 /nfs/dbraw/zinc/30/48/51/852304851.db2.gz FDAWJMBKZMIYLD-UHFFFAOYSA-N 0 3 411.452 4.279 20 0 HIADHN COc1ccc(OC)c(CCNCc2c(C)nn(-c3ccc(F)cc3)c2Cl)c1 ZINC000065934103 852324012 /nfs/dbraw/zinc/32/40/12/852324012.db2.gz KNRNPVRVYNFSDF-UHFFFAOYSA-N 0 3 403.885 4.323 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)c1ccc(N(C)C)c(F)c1 ZINC000065936316 852324526 /nfs/dbraw/zinc/32/45/26/852324526.db2.gz FHBBHPVHNRNECW-UHFFFAOYSA-N 0 3 411.443 4.115 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)c1cc(-c2ccccc2Cl)on1 ZINC000065937687 852325953 /nfs/dbraw/zinc/32/59/53/852325953.db2.gz VONZGAKJMJUJGQ-UHFFFAOYSA-N 0 3 419.859 4.477 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)c1ccc(F)c(C(F)(F)F)c1 ZINC000065937531 852326105 /nfs/dbraw/zinc/32/61/05/852326105.db2.gz JYTAWODLCUSAMH-UHFFFAOYSA-N 0 3 404.354 4.327 20 0 HIADHN Cc1ccccc1C(=O)NC1CCN(Cc2ccc(OCc3ccccn3)cc2)CC1 ZINC000065950499 852331008 /nfs/dbraw/zinc/33/10/08/852331008.db2.gz IWMPGGKBUOKKSS-UHFFFAOYSA-N 0 3 415.537 4.363 20 0 HIADHN O=C(NC1CCCCC1)C1CCN(Cc2ccc(OCc3ccccn3)cc2)CC1 ZINC000065964062 852334720 /nfs/dbraw/zinc/33/47/20/852334720.db2.gz RGJGOLSBWTVNMY-UHFFFAOYSA-N 0 3 407.558 4.322 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)NCCc1ccc(F)cc1 ZINC000065984137 852340029 /nfs/dbraw/zinc/34/00/29/852340029.db2.gz MLRDAYBWBBJQOE-UHFFFAOYSA-N 0 3 411.443 4.160 20 0 HIADHN COc1cc(CNCc2cccc(Oc3ccccc3)c2)ccc1OCC(=O)N(C)C ZINC000065981254 852340052 /nfs/dbraw/zinc/34/00/52/852340052.db2.gz KDEYIWGMYIRPGZ-UHFFFAOYSA-N 0 3 420.509 4.244 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)Nc1ccc2c(c1)OCO2 ZINC000065984154 852340231 /nfs/dbraw/zinc/34/02/31/852340231.db2.gz SPPHVBYKKYLXIF-UHFFFAOYSA-N 0 3 409.408 4.030 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)Nc1nc(-c2ccccc2)ns1 ZINC000065984385 852341465 /nfs/dbraw/zinc/34/14/65/852341465.db2.gz DVNYXHISVZWGLL-UHFFFAOYSA-N 0 3 417.485 4.079 20 0 HIADHN COc1cc(CN(C)C[C@H](O)CO[C@@H]2CCCc3ccccc32)ccc1OC(F)F ZINC000068845346 852373856 /nfs/dbraw/zinc/37/38/56/852373856.db2.gz LUNSAEXUYNIACC-AZUAARDMSA-N 0 3 421.484 4.184 20 0 HIADHN COc1cccc([C@@H](CNC(=O)CCOc2ccc(Cl)cc2)N2CCCC2)c1 ZINC000071906578 852428814 /nfs/dbraw/zinc/42/88/14/852428814.db2.gz MAWOPNKSUHYBKY-OAQYLSRUSA-N 0 3 402.922 4.071 20 0 HIADHN O=C(NCc1ccc(OC2CCCC2)nc1)NC[C@H](c1ccccc1)N1CCCC1 ZINC000071919669 852431176 /nfs/dbraw/zinc/43/11/76/852431176.db2.gz VJPNJLDOIOFKRT-JOCHJYFZSA-N 0 3 408.546 4.039 20 0 HIADHN CC(C)n1ncc2c1nc(-c1cccs1)cc2C(=O)NCCN1CCC(C)CC1 ZINC000071941708 852439315 /nfs/dbraw/zinc/43/93/15/852439315.db2.gz QTZCHFNBPNXKPE-UHFFFAOYSA-N 0 3 411.575 4.202 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)c1cc(F)c(Cl)cc1Cl ZINC000071966794 852449849 /nfs/dbraw/zinc/44/98/49/852449849.db2.gz LBYRLWGSPAVIOG-UHFFFAOYSA-N 0 3 424.347 4.465 20 0 HIADHN Cc1cc(NC(=O)c2ccco2)sc1C(=O)N(CCN(C)C)CC1CCCCC1 ZINC000072034647 852477969 /nfs/dbraw/zinc/47/79/69/852477969.db2.gz RKWWADPFEWQGLN-UHFFFAOYSA-N 0 3 417.575 4.486 20 0 HIADHN CCc1ccc2c(CN3CCC[C@H](CNC(=O)OC(C)(C)C)C3)cc(=O)oc2c1 ZINC000072037838 852480458 /nfs/dbraw/zinc/48/04/58/852480458.db2.gz WURCDRUHIJUOLD-QGZVFWFLSA-N 0 3 400.519 4.092 20 0 HIADHN Cc1ccc(Cc2nnc(NC(=O)[C@H]3CCCN(Cc4ccccc4)C3)s2)cc1 ZINC000078671288 852525043 /nfs/dbraw/zinc/52/50/43/852525043.db2.gz QPRLUWVFLJSCAP-FQEVSTJZSA-N 0 3 406.555 4.288 20 0 HIADHN CN(C)C(=O)c1ccc(NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)cc1Cl ZINC000096626654 852552484 /nfs/dbraw/zinc/55/24/84/852552484.db2.gz DQCSYSRIJUAYIV-MRXNPFEDSA-N 0 3 417.912 4.032 20 0 HIADHN Cc1ccc(O[C@H](C)C(=O)NC2CCN(CCOc3ccc(Cl)cc3)CC2)cc1 ZINC000097577243 852637067 /nfs/dbraw/zinc/63/70/67/852637067.db2.gz OZDFIRVMWJZKED-GOSISDBHSA-N 0 3 416.949 4.075 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(Cl)cc2)CC1)c1ccc2ccccc2n1 ZINC000097577229 852637295 /nfs/dbraw/zinc/63/72/95/852637295.db2.gz YLIJKVCTSVMZBD-UHFFFAOYSA-N 0 3 409.917 4.161 20 0 HIADHN CCc1cccc(Oc2ccc(NC(=O)N(CCN(C)C)C[C@@H]3CCCO3)cn2)c1 ZINC000097577467 852638372 /nfs/dbraw/zinc/63/83/72/852638372.db2.gz AGFWGSBXUHRCQW-NRFANRHFSA-N 0 3 412.534 4.011 20 0 HIADHN O=C(CCCc1cccs1)NC1CCN(CCOc2ccc(Cl)cc2)CC1 ZINC000097590250 852639137 /nfs/dbraw/zinc/63/91/37/852639137.db2.gz IYYJCZRMVUAIET-UHFFFAOYSA-N 0 3 406.979 4.384 20 0 HIADHN CCOc1ccc(-c2nc(CC(=O)NC[C@@H](c3ccccc3)N(C)C)cs2)cc1 ZINC000105817223 852730773 /nfs/dbraw/zinc/73/07/73/852730773.db2.gz VULZNKDQRXYESO-NRFANRHFSA-N 0 3 409.555 4.170 20 0 HIADHN COc1cccc(CO[C@@H](C)C(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)c1 ZINC000106287018 852767866 /nfs/dbraw/zinc/76/78/66/852767866.db2.gz ZJGJOORMPFNDQW-GHTZIAJQSA-N 0 3 416.587 4.251 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)[C@H]1C[C@@H]1c1ccccc1Cl ZINC000108470354 852854722 /nfs/dbraw/zinc/85/47/22/852854722.db2.gz ORURXKLFGCWFNJ-YADHBBJMSA-N 0 3 411.977 4.162 20 0 HIADHN CN(CCNC(=O)CCc1nc2ccccc2n1-c1ccccc1)Cc1ccccc1 ZINC000108807371 852881111 /nfs/dbraw/zinc/88/11/11/852881111.db2.gz LXQDDBFQRWTOKK-UHFFFAOYSA-N 0 3 412.537 4.206 20 0 HIADHN COc1ccc2[nH]cc(C3CCN([C@H](C(=O)NC4CC4)c4ccccc4)CC3)c2c1 ZINC000108971164 852901833 /nfs/dbraw/zinc/90/18/33/852901833.db2.gz FAPONAUDHNOFFO-DEOSSOPVSA-N 0 3 403.526 4.376 20 0 HIADHN COc1ccc(Cl)cc1CN(C)C(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000109339788 852955433 /nfs/dbraw/zinc/95/54/33/852955433.db2.gz AHHWYJPKUOVSQI-QGZVFWFLSA-N 0 3 404.913 4.358 20 0 HIADHN O=C(c1cc(C2CC2)n[nH]1)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000109370468 852960077 /nfs/dbraw/zinc/96/00/77/852960077.db2.gz BRZNOJIXKRQGMG-UHFFFAOYSA-N 0 3 407.345 4.332 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)c1ccc(OC(F)(F)F)cc1 ZINC000109498484 852977086 /nfs/dbraw/zinc/97/70/86/852977086.db2.gz NCIMUWBWBPJLLY-UHFFFAOYSA-N 0 3 410.461 4.429 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2cc(Br)ccc2F)N2CCCC2)cc1 ZINC000109504171 852978180 /nfs/dbraw/zinc/97/81/80/852978180.db2.gz DRCKPIGKHDQSGO-LJQANCHMSA-N 0 3 405.311 4.464 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2cc3cnn(C(C)C)c3nc2C)N2CCCC2)cc1 ZINC000109504533 852978758 /nfs/dbraw/zinc/97/87/58/852978758.db2.gz YMMVVWUUDGRFAR-QFIPXVFZSA-N 0 3 405.546 4.196 20 0 HIADHN CCOCc1ccccc1CNC(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000109544416 852981843 /nfs/dbraw/zinc/98/18/43/852981843.db2.gz FIWQRLACLFROBX-JOCHJYFZSA-N 0 3 420.475 4.294 20 0 HIADHN CCC[C@@H](C(=O)N1CCC[C@H](CN2CCN(c3ccccn3)CC2)C1)c1ccccc1 ZINC000109649668 852994765 /nfs/dbraw/zinc/99/47/65/852994765.db2.gz ZXIFTAKHJLOXFW-ISKFKSNPSA-N 0 3 420.601 4.026 20 0 HIADHN C[C@H](Sc1ccc(Cl)cc1)C(=O)N(C)C1CCN(CCc2ccccn2)CC1 ZINC000109796231 853015908 /nfs/dbraw/zinc/01/59/08/853015908.db2.gz ATMFNWYCUIKMDS-KRWDZBQOSA-N 0 3 418.006 4.381 20 0 HIADHN Cc1ccc(-c2nc(C(=O)N(C)C3CCN(CCc4ccccn4)CC3)cs2)cc1 ZINC000109795489 853016382 /nfs/dbraw/zinc/01/63/82/853016382.db2.gz VDXLUCXTSPRRGD-UHFFFAOYSA-N 0 3 420.582 4.293 20 0 HIADHN COc1ccc(N(C)C(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)cc1OC ZINC000110121488 853063211 /nfs/dbraw/zinc/06/32/11/853063211.db2.gz BOFGNAYAJQMCDL-NRFANRHFSA-N 0 3 422.447 4.121 20 0 HIADHN COC(=O)c1ccc(NC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)c(C)c1 ZINC000110121715 853063320 /nfs/dbraw/zinc/06/33/20/853063320.db2.gz DPRIIIYFCZSJAC-NRFANRHFSA-N 0 3 420.431 4.175 20 0 HIADHN O=C(Nc1ccc2oc(=O)ccc2c1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000110126660 853064294 /nfs/dbraw/zinc/06/42/94/853064294.db2.gz QPTJIIKTTFMOMR-OAQYLSRUSA-N 0 3 416.399 4.186 20 0 HIADHN O=C(c1cc(-c2ccccc2F)on1)N1CCCN(CCCc2ccccc2)CC1 ZINC000110202901 853073211 /nfs/dbraw/zinc/07/32/11/853073211.db2.gz MVASLQJLBVBLGD-UHFFFAOYSA-N 0 3 407.489 4.261 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)c3ccccc3COc3ccccc3)CC2)C[C@H](C)O1 ZINC000110410078 853096384 /nfs/dbraw/zinc/09/63/84/853096384.db2.gz HWHMDHBXIDXKAD-OYRHEFFESA-N 0 3 422.569 4.227 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)c3[nH]c4ccc(Cl)cc4c3Cl)CC2)C[C@H](C)O1 ZINC000110405729 853096764 /nfs/dbraw/zinc/09/67/64/853096764.db2.gz ZYJZHMCYNAYNIP-OKILXGFUSA-N 0 3 424.372 4.436 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)CCSc3ccc(Cl)cc3)CC2)C[C@H](C)O1 ZINC000110452884 853101353 /nfs/dbraw/zinc/10/13/53/853101353.db2.gz UZBMUDAFHIKBPI-CALCHBBNSA-N 0 3 411.011 4.170 20 0 HIADHN Cc1nc(-c2ccc(C(F)(F)F)cc2)sc1C(=O)N1CC[C@H](N2CCCC2)C1 ZINC000110521582 853112838 /nfs/dbraw/zinc/11/28/38/853112838.db2.gz KRDBVKLGKSQSNH-INIZCTEOSA-N 0 3 409.477 4.448 20 0 HIADHN COc1ccc([C@@H](CNC(=O)CNc2cccc(C(F)(F)F)c2)N2CCCC2)cc1 ZINC000111071381 853196810 /nfs/dbraw/zinc/19/68/10/853196810.db2.gz PWCPXRQKVAWLGK-HXUWFJFHSA-N 0 3 421.463 4.079 20 0 HIADHN Cc1ccc([C@H](CNC(=O)[C@@H](c2ccccc2)N2CCCCC2=O)N2CCCC2)cc1 ZINC000111199199 853220400 /nfs/dbraw/zinc/22/04/00/853220400.db2.gz APQYQQWLAOTWOG-UKILVPOCSA-N 0 3 419.569 4.002 20 0 HIADHN CC(=O)c1ccc(NC(=O)CCN(CCc2ccccn2)Cc2ccc(F)cc2)cc1 ZINC000112543469 853232609 /nfs/dbraw/zinc/23/26/09/853232609.db2.gz MISRPABYPSQAOK-UHFFFAOYSA-N 0 3 419.500 4.497 20 0 HIADHN CC(C)(C)[S@](=O)Cc1cccc(NC(=O)N[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000112637009 853234725 /nfs/dbraw/zinc/23/47/25/853234725.db2.gz ODAUXAZPGGSXGO-LGGPFLRQSA-N 0 3 413.587 4.130 20 0 HIADHN CN(CCCc1cc(-c2ccccc2)n(C)n1)C(=O)[C@H]1CCCN1Cc1ccccc1 ZINC000115784355 853264957 /nfs/dbraw/zinc/26/49/57/853264957.db2.gz KJNIJOVLPLCBHK-XMMPIXPASA-N 0 3 416.569 4.143 20 0 HIADHN Cc1ccc(NC(=O)c2cccc(CN3CCCC3)c2)cc1I ZINC000115814054 853265948 /nfs/dbraw/zinc/26/59/48/853265948.db2.gz YJCXIPAIOXTGQL-UHFFFAOYSA-N 0 3 420.294 4.448 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)[C@@H]2C[C@@H]2c2ccc(Br)cc2)o1 ZINC000116378156 853299688 /nfs/dbraw/zinc/29/96/88/853299688.db2.gz BZMZSIXWJMGFPR-RTBURBONSA-N 0 3 405.336 4.044 20 0 HIADHN CC[C@@H](CNC(=O)c1cc(C)n(CC(F)(F)F)c1C)N1CCc2ccccc2C1 ZINC000116898067 853337256 /nfs/dbraw/zinc/33/72/56/853337256.db2.gz IRDQJTZNXLAILS-IBGZPJMESA-N 0 3 407.480 4.234 20 0 HIADHN CCN(C(=O)Nc1cc(Cl)c(OC)cc1OC)[C@H]1CCN(Cc2ccccc2)C1 ZINC000138502294 853388374 /nfs/dbraw/zinc/38/83/74/853388374.db2.gz SXGAXMPZKQHGAH-KRWDZBQOSA-N 0 3 417.937 4.486 20 0 HIADHN CCOc1cc(CNCc2ccc(Cn3ccccc3=O)cc2)ccc1OC(F)F ZINC000140421930 853444281 /nfs/dbraw/zinc/44/42/81/853444281.db2.gz KPZAIZDHCSWHGZ-UHFFFAOYSA-N 0 3 414.452 4.187 20 0 HIADHN Cc1sc2nc([C@@H](C)NCC3(c4ccccc4C)CCOCC3)[nH]c(=O)c2c1C ZINC000140441781 853445194 /nfs/dbraw/zinc/44/51/94/853445194.db2.gz QNMWWGQRAMNBSL-MRXNPFEDSA-N 0 3 411.571 4.309 20 0 HIADHN COCCN1CCC(NC(=O)N[C@H](Cc2ccc(Cl)cc2)c2ccccc2)CC1 ZINC000140465181 853445933 /nfs/dbraw/zinc/44/59/33/853445933.db2.gz MLAMBRKCXPDFIX-JOCHJYFZSA-N 0 3 415.965 4.034 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@@H](C)NCc2cccc(OC(F)F)c2)cc1 ZINC000142843321 853502311 /nfs/dbraw/zinc/50/23/11/853502311.db2.gz PRAZKSRPFUQMMX-OAHLLOKOSA-N 0 3 412.502 4.169 20 0 HIADHN CN(CCOc1ccccc1Cl)C(=S)NC1CCN(Cc2ccccc2)CC1 ZINC000145504048 853552454 /nfs/dbraw/zinc/55/24/54/853552454.db2.gz HIFWFLLRAIYTGL-UHFFFAOYSA-N 0 3 418.006 4.190 20 0 HIADHN C[C@H](OC(=O)C1CCN(c2ccc(Cl)cc2)C1=O)c1nnc(-c2cccs2)o1 ZINC000146495407 853570366 /nfs/dbraw/zinc/57/03/66/853570366.db2.gz XKBXTVHIBATJLD-SMDDNHRTSA-N 0 3 417.874 4.109 20 0 HIADHN CNS(=O)(=O)c1ccc([C@H](C)NCc2ccc(-c3ccc(C)cc3)s2)cc1 ZINC000165328571 853651410 /nfs/dbraw/zinc/65/14/10/853651410.db2.gz KSMVGNHJAHDDCN-INIZCTEOSA-N 0 3 400.569 4.482 20 0 HIADHN O=C(NCCCCN1CCN(Cc2ccccc2)CC1)C1(c2ccccc2)CCCC1 ZINC000195586030 853698298 /nfs/dbraw/zinc/69/82/98/853698298.db2.gz OBCJLSPDPGYFED-UHFFFAOYSA-N 0 3 419.613 4.213 20 0 HIADHN CN(CC1CCCCC1)C(=O)CNC1(c2ccc(Br)cc2)CCOCC1 ZINC000195600977 853706452 /nfs/dbraw/zinc/70/64/52/853706452.db2.gz NNSREFWVAPWFFO-UHFFFAOYSA-N 0 3 423.395 4.083 20 0 HIADHN O=C(CNC1(c2ccc(Br)cc2)CCOCC1)NCCC1=CCCCC1 ZINC000195600827 853706849 /nfs/dbraw/zinc/70/68/49/853706849.db2.gz DCPOPYIPXIQJIV-UHFFFAOYSA-N 0 3 421.379 4.051 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(NC(N)=O)cc1)c1ccc(I)cc1 ZINC000195616689 853716446 /nfs/dbraw/zinc/71/64/46/853716446.db2.gz CVTUDELVNAKWNL-VXGBXAGGSA-N 0 3 409.271 4.194 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)N1CCC(COc2ccccc2)CC1 ZINC000195635134 853729073 /nfs/dbraw/zinc/72/90/73/853729073.db2.gz AOXYQDWPALQDLF-XMMPIXPASA-N 0 3 407.558 4.324 20 0 HIADHN CC(C)(CNC(=O)N[C@H]1CCOc2c(Cl)cccc21)N1CCc2ccccc2C1 ZINC000195636515 853730006 /nfs/dbraw/zinc/73/00/06/853730006.db2.gz ZSOFKIAJVKWQHG-FQEVSTJZSA-N 0 3 413.949 4.300 20 0 HIADHN O=C(N[C@H]1CCCN(Cc2ccccc2)C1)N(Cc1cccs1)C[C@@H]1CCCO1 ZINC000195648553 853736821 /nfs/dbraw/zinc/73/68/21/853736821.db2.gz FCUXBCRKTGTHNN-SFTDATJTSA-N 0 3 413.587 4.103 20 0 HIADHN CC(C)(CNC(=O)NC[C@@H]1CCCO[C@H]1c1ccccc1)N1CCc2ccccc2C1 ZINC000195660636 853742089 /nfs/dbraw/zinc/74/20/89/853742089.db2.gz JMXHTYHJVJKYRW-UPVQGACJSA-N 0 3 421.585 4.290 20 0 HIADHN O=C(C1CCN(Cc2cccc(OCC(F)(F)F)c2)CC1)N1CCc2ccccc21 ZINC000195684760 853757107 /nfs/dbraw/zinc/75/71/07/853757107.db2.gz HCEDFPSVBFALOD-UHFFFAOYSA-N 0 3 418.459 4.429 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)[C@H]2C[C@H]2c2cccc(Br)c2)CC1 ZINC000195747721 853791872 /nfs/dbraw/zinc/79/18/72/853791872.db2.gz LGGKLEFDYLZJDV-PMACEKPBSA-N 0 3 417.347 4.269 20 0 HIADHN COc1cccc(-c2nn(-c3ccc(C)cc3)cc2C(=O)N(C)C2CCN(C)CC2)c1 ZINC000215836407 853838805 /nfs/dbraw/zinc/83/88/05/853838805.db2.gz HCVOQIVEJNSNBR-UHFFFAOYSA-N 0 3 418.541 4.023 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)[C@@H]2C[C@@H]2c2ccc(Br)cc2)CC1 ZINC000216497103 853854265 /nfs/dbraw/zinc/85/42/65/853854265.db2.gz RNJGOSRPWVNDFG-WOJBJXKFSA-N 0 3 417.347 4.269 20 0 HIADHN Cc1cc(N2CCN(C)CC2)ccc1NS(=O)(=O)c1ccccc1-c1ccccc1 ZINC000219385539 853868717 /nfs/dbraw/zinc/86/87/17/853868717.db2.gz GLGLVGSEYYFJCA-UHFFFAOYSA-N 0 3 421.566 4.215 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)c2cccc(OCc3cscn3)c2)C1 ZINC000227383344 853886010 /nfs/dbraw/zinc/88/60/10/853886010.db2.gz SRDOVEOYYDZASV-FXAWDEMLSA-N 0 3 407.539 4.287 20 0 HIADHN c1csc(-c2nn(-c3ccccc3)cc2CNCc2ccc(-n3cncn3)cc2)c1 ZINC000236583947 853899768 /nfs/dbraw/zinc/89/97/68/853899768.db2.gz OEZACFOGWQVYIE-UHFFFAOYSA-N 0 3 412.522 4.471 20 0 HIADHN CC(C)(C)[S@@](=O)CCNCc1ccc(OC(F)(F)[C@@H](F)C(F)(F)F)cc1 ZINC000236733334 853917402 /nfs/dbraw/zinc/91/74/02/853917402.db2.gz CWQDDWCEJRNAGZ-NRRJATNASA-N 0 3 405.404 4.195 20 0 HIADHN Cc1nn(Cc2ccccc2Cl)c(Cl)c1CNC1CCN(C(=O)C(C)C)CC1 ZINC000236780677 853922540 /nfs/dbraw/zinc/92/25/40/853922540.db2.gz QUDXVYAKOBNFSW-UHFFFAOYSA-N 0 3 423.388 4.283 20 0 HIADHN CCCN1CCN(c2ccccc2CNCc2c(F)cccc2OC(F)F)CC1 ZINC000236802059 853924402 /nfs/dbraw/zinc/92/44/02/853924402.db2.gz RLXDZQGKAINBSX-UHFFFAOYSA-N 0 3 407.480 4.249 20 0 HIADHN CCN1CCN(Cc2ccc(NCc3ccccc3OCc3cccnc3)cc2)CC1 ZINC000236847303 853928966 /nfs/dbraw/zinc/92/89/66/853928966.db2.gz JYHXVCVYQXVOTP-UHFFFAOYSA-N 0 3 416.569 4.410 20 0 HIADHN CCCOc1c(Cl)cc(CNCc2ccc(-n3cncn3)cc2)cc1OCC ZINC000236910895 853936093 /nfs/dbraw/zinc/93/60/93/853936093.db2.gz OBADWARYRMOAJO-UHFFFAOYSA-N 0 3 400.910 4.398 20 0 HIADHN C=CCOc1c(Br)cc(CNC[C@](C)(O)c2ccco2)cc1OCC ZINC000236957139 853942630 /nfs/dbraw/zinc/94/26/30/853942630.db2.gz HNDKBCSCTUBLHI-IBGZPJMESA-N 0 3 410.308 4.003 20 0 HIADHN CCN(CC)c1ccc(CNCc2cn(-c3ccccc3)nc2-c2cccnc2)cn1 ZINC000237005859 853950038 /nfs/dbraw/zinc/95/00/38/853950038.db2.gz HHNNCPXGTZFSNZ-UHFFFAOYSA-N 0 3 412.541 4.465 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc(CNCc2cccc(OC3CCCC3)c2)cc1 ZINC000237026343 853953342 /nfs/dbraw/zinc/95/33/42/853953342.db2.gz ZOGGFEXDVAIIPG-UHFFFAOYSA-N 0 3 416.587 4.328 20 0 HIADHN CCC[C@H](NCc1ccc(O[C@@H](C)C#N)cc1)C(=O)Nc1cccc(N2CCCC2)c1 ZINC000237033670 853954407 /nfs/dbraw/zinc/95/44/07/853954407.db2.gz DWMOJMABAOAQLZ-CYFREDJKSA-N 0 3 420.557 4.475 20 0 HIADHN CC[C@H]1Oc2cc([C@H](C)NCc3ccc(OC(F)F)c(OC)c3)ccc2NC1=O ZINC000237083075 853962114 /nfs/dbraw/zinc/96/21/14/853962114.db2.gz NUVOHMXIFYWGHR-BLLLJJGKSA-N 0 3 406.429 4.257 20 0 HIADHN COC(=O)CC(C)(C)NCc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1 ZINC000237136368 853970393 /nfs/dbraw/zinc/97/03/93/853970393.db2.gz BEIJMOLTOUWAPS-UHFFFAOYSA-N 0 3 411.252 4.049 20 0 HIADHN CN(Cc1ccccc1Br)C(=O)CCNCc1cc2ccccc2o1 ZINC000237144939 853972486 /nfs/dbraw/zinc/97/24/86/853972486.db2.gz HUPUBZFHZBAIIC-UHFFFAOYSA-N 0 3 401.304 4.334 20 0 HIADHN COC(=O)COc1c(C)cc(CNC2(c3cccc(Br)c3)CC2)cc1C ZINC000237180901 853977632 /nfs/dbraw/zinc/97/76/32/853977632.db2.gz NTAAGVIHILMVQI-UHFFFAOYSA-N 0 3 418.331 4.397 20 0 HIADHN COc1cc(CNCc2ccccc2CN2C[C@@H](C)O[C@H](C)C2)cc(Cl)c1OC ZINC000237215472 853984879 /nfs/dbraw/zinc/98/48/79/853984879.db2.gz UJTRPGZTZIOKIN-IAGOWNOFSA-N 0 3 418.965 4.256 20 0 HIADHN CNC(=O)c1ccc(CN[C@H](Cc2ccccc2C)c2ccc(OC)c(OC)c2)cc1 ZINC000237229241 853986587 /nfs/dbraw/zinc/98/65/87/853986587.db2.gz NSYKMJMWNOSEHC-HSZRJFAPSA-N 0 3 418.537 4.445 20 0 HIADHN CN1CCN(c2cccc(Cl)c2CNCc2ccc(Br)s2)CC1 ZINC000237235744 853987645 /nfs/dbraw/zinc/98/76/45/853987645.db2.gz CXGKOEYPZAYXPG-UHFFFAOYSA-N 0 3 414.800 4.206 20 0 HIADHN COc1cc(Br)cc(C[NH2+]C2(c3cccc(F)c3)CCOCC2)c1[O-] ZINC000237238120 853989065 /nfs/dbraw/zinc/98/90/65/853989065.db2.gz ITJDEJXGWOSHDC-UHFFFAOYSA-N 0 3 410.283 4.098 20 0 HIADHN COc1ccc(NC(=O)C[C@@H](C)NCc2c(C)nn(-c3ccccc3)c2C)c(OC)c1 ZINC000237287097 853998384 /nfs/dbraw/zinc/99/83/84/853998384.db2.gz IJYHUGDCNMXKGN-MRXNPFEDSA-N 0 3 422.529 4.013 20 0 HIADHN COc1cc(CN2CC[C@@H](NCc3ccc(CSC(F)F)o3)C2)cc(OC)c1 ZINC000237305724 854002926 /nfs/dbraw/zinc/00/29/26/854002926.db2.gz TWDBJAAVCBPRDP-OAHLLOKOSA-N 0 3 412.502 4.117 20 0 HIADHN COc1cc(CNC2(c3ccc(Br)cc3)CCC2)cc2c1OCCO2 ZINC000237340119 854009655 /nfs/dbraw/zinc/00/96/55/854009655.db2.gz CYUSIEDYQAKFIJ-UHFFFAOYSA-N 0 3 404.304 4.398 20 0 HIADHN COc1cc([C@@H](C)NCc2cnc3c(c2)c(C)nn3C)ccc1OCc1ccncc1 ZINC000237387708 854020347 /nfs/dbraw/zinc/02/03/47/854020347.db2.gz REBMOEOVINNEJE-MRXNPFEDSA-N 0 3 417.513 4.110 20 0 HIADHN COc1ccc(OCc2ccccn2)c(CNCCOc2ccc(F)cc2F)c1 ZINC000237434729 854032307 /nfs/dbraw/zinc/03/23/07/854032307.db2.gz JAUJPKKYYOEZAG-UHFFFAOYSA-N 0 3 400.425 4.116 20 0 HIADHN C[C@@](O)(CNCc1cc(Cl)ccc1OC[C@H]1CCCO1)c1ccc(F)cc1F ZINC000237466158 854037924 /nfs/dbraw/zinc/03/79/24/854037924.db2.gz NJYSNMGGILQKOO-DYESRHJHSA-N 0 3 411.876 4.173 20 0 HIADHN C[C@@H](NCc1ccc(Br)c([N+](=O)[O-])c1)c1ccc(-n2cccn2)cc1 ZINC000237471378 854039914 /nfs/dbraw/zinc/03/99/14/854039914.db2.gz RDHUXJIGWHJSIM-CYBMUJFWSA-N 0 3 401.264 4.394 20 0 HIADHN C[C@H](CC(=O)Nc1cccc(N2CCCC2)c1)NCc1cnn(-c2ccc(F)cc2)c1 ZINC000237580240 854058791 /nfs/dbraw/zinc/05/87/91/854058791.db2.gz MOAPJNVZSJWPRW-GOSISDBHSA-N 0 3 421.520 4.119 20 0 HIADHN C[C@@H]1CN(CCCNCc2csc(-c3ccc(C(F)(F)F)cc3)n2)C[C@H](C)O1 ZINC000237614799 854062455 /nfs/dbraw/zinc/06/24/55/854062455.db2.gz RNEWZJHGSCFHKB-GASCZTMLSA-N 0 3 413.509 4.418 20 0 HIADHN Cc1cc(F)ccc1CNCc1ccnc(N2CCN(c3ccc(F)cc3)CC2)c1 ZINC000237635202 854065841 /nfs/dbraw/zinc/06/58/41/854065841.db2.gz USPSHWLINDBNEE-UHFFFAOYSA-N 0 3 408.496 4.285 20 0 HIADHN Cc1cccn2cc(COc3ccc(CN[C@H](C)C(=O)N4CCCC[C@H]4C)cc3)nc12 ZINC000237656897 854069721 /nfs/dbraw/zinc/06/97/21/854069721.db2.gz LSJFPOUMVHRZHI-WOJBJXKFSA-N 0 3 420.557 4.101 20 0 HIADHN Cc1nn(Cc2ccccc2Cl)c(C)c1CNCc1ccc(-n2cncn2)cc1 ZINC000237679643 854073997 /nfs/dbraw/zinc/07/39/97/854073997.db2.gz QDVZJLRQRZSJCR-UHFFFAOYSA-N 0 3 406.921 4.072 20 0 HIADHN Cc1nn(-c2cc(C)ccc2C)c(Cl)c1CNCCCOCC1CCOCC1 ZINC000237685345 854075006 /nfs/dbraw/zinc/07/50/06/854075006.db2.gz XPXWMVDLQDYYSW-UHFFFAOYSA-N 0 3 405.970 4.374 20 0 HIADHN Cc1noc(CCNCc2cc(Br)ccc2OCc2ccccc2)n1 ZINC000237687528 854076005 /nfs/dbraw/zinc/07/60/05/854076005.db2.gz YGGUNSOVSCMIMN-UHFFFAOYSA-N 0 3 402.292 4.052 20 0 HIADHN Clc1ccc(OC[C@H]2CCCO2)c(CN[C@H]2CCN(c3ncccc3Cl)C2)c1 ZINC000237716928 854082624 /nfs/dbraw/zinc/08/26/24/854082624.db2.gz QTBSSOGWRBWZBJ-ZWKOTPCHSA-N 0 3 422.356 4.315 20 0 HIADHN Cc1ccc(Br)cc1NC(=O)CCNCc1cc2ccccc2[nH]c1=O ZINC000237790396 854097883 /nfs/dbraw/zinc/09/78/83/854097883.db2.gz JGNGEZOTXHTHPH-UHFFFAOYSA-N 0 3 414.303 4.130 20 0 HIADHN Cc1nn(-c2cccc(C(F)(F)F)c2)c(Cl)c1CN[C@H]1CCc2n[nH]cc2C1 ZINC000237811941 854102270 /nfs/dbraw/zinc/10/22/70/854102270.db2.gz JZCYYSVCBYGKLS-AWEZNQCLSA-N 0 3 409.843 4.223 20 0 HIADHN NC(=O)C1CCN(c2ncccc2CNCc2c3ccccc3cc3ccccc32)CC1 ZINC000237866335 854110749 /nfs/dbraw/zinc/11/07/49/854110749.db2.gz FKVCXGPAERCHCS-UHFFFAOYSA-N 0 3 424.548 4.380 20 0 HIADHN Cc1cccc(-c2nn(Cc3ccccc3)cc2CNCc2ccc(C(N)=O)cc2)c1 ZINC000237880799 854113956 /nfs/dbraw/zinc/11/39/56/854113956.db2.gz MOJMFGLQWWHISC-UHFFFAOYSA-N 0 3 410.521 4.296 20 0 HIADHN O=[N+]([O-])c1ccc(Cl)c(CNC2CCN(c3ccc(C(F)(F)F)cn3)CC2)c1 ZINC000237892888 854115991 /nfs/dbraw/zinc/11/59/91/854115991.db2.gz VSCZHRLZMMSZGN-UHFFFAOYSA-N 0 3 414.815 4.421 20 0 HIADHN CCc1ccc([C@H](CNC(=O)c2cc(C3CC3)nc3c2cnn3C(C)C)N(C)C)cc1 ZINC000247954568 854168251 /nfs/dbraw/zinc/16/82/51/854168251.db2.gz CNWQFWQNBSXVMB-QHCPKHFHSA-N 0 3 419.573 4.485 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)c2cc(C3CC3)nc3c2cnn3C(C)C)N(C)C)cc1 ZINC000247954563 854168570 /nfs/dbraw/zinc/16/85/70/854168570.db2.gz CNWQFWQNBSXVMB-HSZRJFAPSA-N 0 3 419.573 4.485 20 0 HIADHN Cc1cccc(-c2nc(CC(=O)N(Cc3ccco3)C3CCN(C)CC3)cs2)c1 ZINC000248106052 854178325 /nfs/dbraw/zinc/17/83/25/854178325.db2.gz FXIWEHPYLAVFHJ-UHFFFAOYSA-N 0 3 409.555 4.377 20 0 HIADHN CCn1c2ccccc2nc1SCC(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000250348452 854193590 /nfs/dbraw/zinc/19/35/90/854193590.db2.gz RZBHZAMETMAYGC-IEBWSBKVSA-N 0 3 408.571 4.100 20 0 HIADHN O=C(NC[C@@H]1CCCO[C@H]1c1ccccc1)N[C@H](CN1CCCC1)c1ccccc1 ZINC000255959290 854230782 /nfs/dbraw/zinc/23/07/82/854230782.db2.gz MVSXEFGARZTYNS-VXNXHJTFSA-N 0 3 407.558 4.291 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccc(F)c2)C1)N1CCC([C@@H](O)c2ccccc2)CC1 ZINC000261415088 854254555 /nfs/dbraw/zinc/25/45/55/854254555.db2.gz FLUGMDREROURIS-VWNXMTODSA-N 0 3 410.533 4.010 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccc(F)c2)C1)N1CCC([C@H](O)c2ccccc2)CC1 ZINC000261415085 854254629 /nfs/dbraw/zinc/25/46/29/854254629.db2.gz FLUGMDREROURIS-ISKFKSNPSA-N 0 3 410.533 4.010 20 0 HIADHN COc1ccc([C@H](CNc2nc(C(F)(F)F)nc3nc[nH]c32)N2CCCCC2)cc1 ZINC000301100686 854296026 /nfs/dbraw/zinc/29/60/26/854296026.db2.gz PVEDQIJBFKFXST-HNNXBMFYSA-N 0 3 420.439 4.019 20 0 HIADHN CN(C)[C@@H](CNc1ncc(C(=O)N2CCCCC2)cc1Cl)c1ccc(F)cc1 ZINC000301099308 854296061 /nfs/dbraw/zinc/29/60/61/854296061.db2.gz QKVAFFOEXMBHSS-IBGZPJMESA-N 0 3 404.917 4.215 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(NC[C@@H](c3ccc(C)cc3)[NH+]3CCCC3)nc2)n1 ZINC000301157100 854314545 /nfs/dbraw/zinc/31/45/45/854314545.db2.gz BZDFFZMACBHMJN-NRFANRHFSA-N 0 3 403.530 4.364 20 0 HIADHN Cc1c2nnc(C(F)(F)F)n2nc(Nc2cccc(CN3CCSCC3)c2)c1C ZINC000301964554 854505486 /nfs/dbraw/zinc/50/54/86/854505486.db2.gz UAISWOFIPWMBOF-UHFFFAOYSA-N 0 3 422.480 4.052 20 0 HIADHN Cc1ccc2nccc(N3CCC(C(=O)c4ccc5c(c4)NC(=O)[C@@H](C)O5)CC3)c2c1 ZINC000302159504 854539511 /nfs/dbraw/zinc/53/95/11/854539511.db2.gz OLAUEDZNCYWXBS-MRXNPFEDSA-N 0 3 415.493 4.362 20 0 HIADHN CC(=O)N[C@H](C)C1CCN(c2c(C)c(C)nc3ccc(Br)cc32)CC1 ZINC000302370188 854564410 /nfs/dbraw/zinc/56/44/10/854564410.db2.gz GOYMOSVNLCQRAB-CQSZACIVSA-N 0 3 404.352 4.355 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cccnc3SC(F)F)c(C)c2)CC1 ZINC000302539658 854582598 /nfs/dbraw/zinc/58/25/98/854582598.db2.gz QUOMNJXEVDOVIT-UHFFFAOYSA-N 0 3 406.502 4.099 20 0 HIADHN C[C@H]1CN(CCC2CCN(c3nn4cc(C5CCCC5)nc4s3)CC2)C[C@H](C)O1 ZINC000302571299 854587314 /nfs/dbraw/zinc/58/73/14/854587314.db2.gz ZCLXBOZKFDJIKE-IRXDYDNUSA-N 0 3 417.623 4.164 20 0 HIADHN COc1ccc(OC)c([C@H](C)NC(=O)CN[C@H](c2ccc(Cl)cc2)C2CC2)c1 ZINC000302759470 854624209 /nfs/dbraw/zinc/62/42/09/854624209.db2.gz OBTIOASLNLKDDI-FPTDNZKUSA-N 0 3 402.922 4.275 20 0 HIADHN NS(=O)(=O)c1cccc(CNc2ccnc3ccc(Oc4ccccc4)cc32)c1 ZINC000302778623 854631722 /nfs/dbraw/zinc/63/17/22/854631722.db2.gz HEOLHVMFMSWGMJ-UHFFFAOYSA-N 0 3 405.479 4.287 20 0 HIADHN CN1CC[C@@H](Nc2ncc(Cn3cc(Br)cn3)s2)[C@H]1c1ccccc1 ZINC000302839121 854651886 /nfs/dbraw/zinc/65/18/86/854651886.db2.gz YYIBZSRYMBUMSB-IAGOWNOFSA-N 0 3 418.364 4.008 20 0 HIADHN CN(Cc1ccccc1Br)C(=O)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000302896638 854670316 /nfs/dbraw/zinc/67/03/16/854670316.db2.gz LKXSFPOQOCOHKS-FQEVSTJZSA-N 0 3 416.363 4.428 20 0 HIADHN COc1ccc([C@@H](NCC(=O)Nc2cc(OC)c(Cl)cc2OC)C(C)C)cc1 ZINC000302919865 854680476 /nfs/dbraw/zinc/68/04/76/854680476.db2.gz GOOAUUJERJPISD-NRFANRHFSA-N 0 3 406.910 4.291 20 0 HIADHN Cc1cc(C(=O)N(CCN(C)C)Cc2ccc(C#N)cc2)c(C)n1Cc1ccccc1 ZINC000302966072 854699650 /nfs/dbraw/zinc/69/96/50/854699650.db2.gz RDFXSIMWMUINTM-UHFFFAOYSA-N 0 3 414.553 4.229 20 0 HIADHN COc1ccc(CC2CCN([C@@H](C)C(=O)N[C@@H](C)c3ccccc3OC)CC2)cc1 ZINC000303086541 854754154 /nfs/dbraw/zinc/75/41/54/854754154.db2.gz GTXHVHILPCQKJD-OALUTQOASA-N 0 3 410.558 4.224 20 0 HIADHN C=C1c2ccccc2C(=O)N1CC(=O)N(CCC)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000303117126 854768006 /nfs/dbraw/zinc/76/80/06/854768006.db2.gz MFJMFEVUVUHZED-QFIPXVFZSA-N 0 3 417.553 4.016 20 0 HIADHN CCN(CC)c1nc2sc(C(=O)N(CCN(C)C)Cc3ccc(C)o3)cc2s1 ZINC000303121656 854770670 /nfs/dbraw/zinc/77/06/70/854770670.db2.gz PYSPZEYPCGSQLA-UHFFFAOYSA-N 0 3 420.604 4.309 20 0 HIADHN Cc1nn(-c2ccccc2)cc1C(=O)NC[C@@H](c1ccccc1)N1CCC(C)CC1 ZINC000303130945 854775387 /nfs/dbraw/zinc/77/53/87/854775387.db2.gz KHZJLWBEWNDNJY-DEOSSOPVSA-N 0 3 402.542 4.384 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)c2ccc(C)c(NC(=O)c3ccccc3)c2)o1 ZINC000303136083 854778626 /nfs/dbraw/zinc/77/86/26/854778626.db2.gz SSHZAICNPNHMRA-UHFFFAOYSA-N 0 3 419.525 4.353 20 0 HIADHN COc1ccc(CNC[C@H](c2c(F)cccc2Cl)N2CCO[C@H](C)C2)c(OC)c1 ZINC000303228644 854826659 /nfs/dbraw/zinc/82/66/59/854826659.db2.gz XMXZAONGPBEPQQ-FOIQADDNSA-N 0 3 422.928 4.048 20 0 HIADHN O=C(NC[C@@H](O)c1ccc2ccccc2c1)NC[C@@H](c1cccs1)N1CCCC1 ZINC000303354306 854888685 /nfs/dbraw/zinc/88/86/85/854888685.db2.gz GJEAOHROKUWUGD-LEWJYISDSA-N 0 3 409.555 4.071 20 0 HIADHN Cc1ccc(C)c(NC(=O)[C@H](c2ccccc2)N2CCC[C@H](CN3CCOCC3)C2)c1 ZINC000303499058 854988296 /nfs/dbraw/zinc/98/82/96/854988296.db2.gz YBLPVWRSFUKHJH-RDGATRHJSA-N 0 3 421.585 4.027 20 0 HIADHN CCc1nc([C@H](C)NC(=O)Nc2ccc(CCN3CCSCC3)cc2)cs1 ZINC000303507903 854996372 /nfs/dbraw/zinc/99/63/72/854996372.db2.gz WHLQUPKYXAORGS-HNNXBMFYSA-N 0 3 404.605 4.180 20 0 HIADHN C[C@H](CNC(=O)NCc1ccc(Oc2cccnc2)c(F)c1)N(C)Cc1ccccc1 ZINC000303513050 855001737 /nfs/dbraw/zinc/00/17/37/855001737.db2.gz XGVBQQVMBGZTSP-GOSISDBHSA-N 0 3 422.504 4.333 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N(C)Cc3ccc(C(F)(F)F)cc3)cc2)CC1 ZINC000303567398 855044494 /nfs/dbraw/zinc/04/44/94/855044494.db2.gz OIJKIEJPDTXDFS-UHFFFAOYSA-N 0 3 405.464 4.120 20 0 HIADHN Cc1nc2c(s1)[C@H](N(C)C(=O)[C@@H]1CCCN(Cc3cccc(F)c3)C1)CCC2 ZINC000303576856 855053069 /nfs/dbraw/zinc/05/30/69/855053069.db2.gz ZLOJHFKLESHJPV-YLJYHZDGSA-N 0 3 401.551 4.339 20 0 HIADHN CCN(C(=O)Cc1ccc(NC(=O)[C@H](C)N2CCCCCC2)cc1)c1ccccc1 ZINC000303612837 855077617 /nfs/dbraw/zinc/07/76/17/855077617.db2.gz ZECGSOBQSFTPFZ-FQEVSTJZSA-N 0 3 407.558 4.485 20 0 HIADHN Cc1csc(C(C)(C)NC(=O)Nc2ccc(CCN3CCSCC3)cc2)n1 ZINC000303624607 855084886 /nfs/dbraw/zinc/08/48/86/855084886.db2.gz DSNXTXNGGWYQGD-UHFFFAOYSA-N 0 3 404.605 4.100 20 0 HIADHN O=C(NCc1ccco1)c1cccc(CN(CCCO)[C@@H]2CCc3ccccc32)c1 ZINC000303636070 855092436 /nfs/dbraw/zinc/09/24/36/855092436.db2.gz ZSPUBJRJPZUGDY-XMMPIXPASA-N 0 3 404.510 4.082 20 0 HIADHN FC(F)(F)C1(C(F)(F)F)CCN(CCCCCn2nnc(-c3ccccc3)n2)C1 ZINC000303728101 855155169 /nfs/dbraw/zinc/15/51/69/855155169.db2.gz YGUDAVOJBBDOLQ-UHFFFAOYSA-N 0 3 421.389 4.327 20 0 HIADHN C[C@@H]1C[C@H](N(C)S(=O)(=O)c2ccc(F)cc2Cl)CCN1Cc1ccccc1 ZINC000303755865 855176654 /nfs/dbraw/zinc/17/66/54/855176654.db2.gz CYOJJYSDIUIBMF-CRAIPNDOSA-N 0 3 410.942 4.153 20 0 HIADHN CC[C@H](NC(=O)c1ccc(N2CCN(C(C)C)CC2)cc1)c1ccc(F)cc1F ZINC000303769287 855186721 /nfs/dbraw/zinc/18/67/21/855186721.db2.gz QJWBZQDRJYEZSB-QFIPXVFZSA-N 0 3 401.501 4.376 20 0 HIADHN CS(=O)(=O)c1cccc(OCCN(CCc2ccc(Cl)cc2)CC2CC2)c1 ZINC000303775833 855191635 /nfs/dbraw/zinc/19/16/35/855191635.db2.gz RMXHMNPNTRUPPL-UHFFFAOYSA-N 0 3 407.963 4.077 20 0 HIADHN CC[C@@](C)(NC(=O)Nc1ccc(CCN2CCSCC2)cc1)c1nccs1 ZINC000303782007 855194737 /nfs/dbraw/zinc/19/47/37/855194737.db2.gz GUUGIVRKHDVWSZ-HXUWFJFHSA-N 0 3 404.605 4.181 20 0 HIADHN Cc1cnc2c(cccc2S(=O)(=O)N(C)[C@H]2CCN(Cc3ccccc3)[C@H](C)C2)c1 ZINC000303801471 855205408 /nfs/dbraw/zinc/20/54/08/855205408.db2.gz LSNNTWKSLBZNRM-KNQAVFIVSA-N 0 3 423.582 4.217 20 0 HIADHN Cc1ccc([C@H](CNC(=O)[C@H]2C[C@H]2c2ccccc2OC(F)(F)F)N(C)C)cc1 ZINC000303906902 855281663 /nfs/dbraw/zinc/28/16/63/855281663.db2.gz RBYIWETYQHCLSH-FHWLQOOXSA-N 0 3 406.448 4.416 20 0 HIADHN CCCNC(=O)c1cccc(C(=O)N(CCC)[C@@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000303919869 855291101 /nfs/dbraw/zinc/29/11/01/855291101.db2.gz TWYDQPAKRRSCTH-XMMPIXPASA-N 0 3 421.585 4.343 20 0 HIADHN CN(C)Cc1cccc(C(=O)Nc2cccc(CS(=O)(=O)C3CCCCC3)c2)c1 ZINC000303925078 855295136 /nfs/dbraw/zinc/29/51/36/855295136.db2.gz URTZDPFDUNVXGK-UHFFFAOYSA-N 0 3 414.571 4.248 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)NC[C@@H]1CCCO[C@@H]1c1ccccc1 ZINC000303951107 855313942 /nfs/dbraw/zinc/31/39/42/855313942.db2.gz ZWZYJRSJPBKZRS-IEZKXTBUSA-N 0 3 421.585 4.460 20 0 HIADHN CC(C)(C)OC(=O)NC/C=C\CNCc1ccc(Br)c2cccnc12 ZINC000310832452 855367532 /nfs/dbraw/zinc/36/75/32/855367532.db2.gz KLTYAYBTHPUZTA-PLNGDYQASA-N 0 3 406.324 4.168 20 0 HIADHN C[C@H](Cc1ccc(Br)cc1)N[C@@H]1CCS(=O)(=O)c2ccc(F)cc21 ZINC000325113478 855401414 /nfs/dbraw/zinc/40/14/14/855401414.db2.gz JBPQGYNJRQNNIC-SJKOYZFVSA-N 0 3 412.324 4.028 20 0 HIADHN FC(F)(F)Oc1ccc(CNC[C@H]2COc3ccccc3O2)cc1Br ZINC000327840117 855420149 /nfs/dbraw/zinc/42/01/49/855420149.db2.gz QZIFHLFRZIKGMV-LBPRGKRZSA-N 0 3 418.209 4.277 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)c1ccc(F)cc1Br ZINC000383050450 855435812 /nfs/dbraw/zinc/43/58/12/855435812.db2.gz IGJBHQMSZPPTGG-HNNXBMFYSA-N 0 3 405.311 4.325 20 0 HIADHN C[C@H]1CCN(C(=O)c2ccc(F)cc2Br)CCN1Cc1ccccc1 ZINC000383053790 855435983 /nfs/dbraw/zinc/43/59/83/855435983.db2.gz MEZRXDDGEZSYAP-HNNXBMFYSA-N 0 3 405.311 4.325 20 0 HIADHN C[C@@H]1[C@H](NC(=O)c2cccc(Br)c2Cl)CCN1Cc1ccccc1 ZINC000383281654 855436986 /nfs/dbraw/zinc/43/69/86/855436986.db2.gz LDGCDQOYZQJVAV-CXAGYDPISA-N 0 3 407.739 4.495 20 0 HIADHN Cc1c(Br)cccc1C(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000388882542 855448983 /nfs/dbraw/zinc/44/89/83/855448983.db2.gz QXVJAUSRACXUNG-SFHVURJKSA-N 0 3 401.348 4.494 20 0 HIADHN COCC1(CNCc2ccc(F)cc2Cl)CCN(C(=O)OC(C)(C)C)CC1 ZINC000394394977 855469801 /nfs/dbraw/zinc/46/98/01/855469801.db2.gz AQTGJYOLRCSMNG-UHFFFAOYSA-N 0 3 400.922 4.232 20 0 HIADHN C[C@]1(CNC(=O)c2cc(Cl)ncc2Br)CCCN1Cc1ccccc1 ZINC000397976953 855474327 /nfs/dbraw/zinc/47/43/27/855474327.db2.gz KUSZGPLOLQXRCR-LJQANCHMSA-N 0 3 422.754 4.282 20 0 HIADHN C[C@]1(NC(=O)c2c(F)cc(Br)cc2F)CCN(Cc2ccccc2)C1 ZINC000405984295 855482629 /nfs/dbraw/zinc/48/26/29/855482629.db2.gz FVGUWFRTPLGAIN-IBGZPJMESA-N 0 3 409.274 4.122 20 0 HIADHN CN(Cc1c(F)cccc1Cl)C(=O)CCCN1CCN(c2ccccc2)CC1 ZINC000409526647 855523465 /nfs/dbraw/zinc/52/34/65/855523465.db2.gz HHMGSQAMBHWMAZ-UHFFFAOYSA-N 0 3 403.929 4.040 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)N1CCC(Cc2ccccc2)CC1 ZINC000409547222 855536484 /nfs/dbraw/zinc/53/64/84/855536484.db2.gz CBSQLFUKUKKWBS-UHFFFAOYSA-N 0 3 405.586 4.070 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)c1ccc2c(c1)nc(C(F)F)n2C ZINC000409741341 855629646 /nfs/dbraw/zinc/62/96/46/855629646.db2.gz PYOFVDVPNCFXKY-MRXNPFEDSA-N 0 3 412.484 4.248 20 0 HIADHN CCOc1cc2c(cc1[C@@H]1C[C@H]1C(=O)N(CCN(C)C)c1ccccc1)O[C@@H](C)C2 ZINC000409753240 855636479 /nfs/dbraw/zinc/63/64/79/855636479.db2.gz QUTQDGDSAQRJLB-RBDMOPTHSA-N 0 3 408.542 4.107 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)C(Cc2ccccc2)Cc2ccccc2)CC1 ZINC000409772661 855645842 /nfs/dbraw/zinc/64/58/42/855645842.db2.gz WAORZCKEYSBYQO-UHFFFAOYSA-N 0 3 408.586 4.094 20 0 HIADHN CC(C)C(=O)Nc1ccc(C(=O)N[C@@H](CN2CCc3ccccc3C2)C(C)(C)C)cc1 ZINC000410049988 855800298 /nfs/dbraw/zinc/80/02/98/855800298.db2.gz AIFOMPUOZKXQCE-QHCPKHFHSA-N 0 3 421.585 4.484 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)NCc3ccccc3C[N@@H+](C)C(C)C)cc2)cc(=O)[n-]1 ZINC000410375275 855959819 /nfs/dbraw/zinc/95/98/19/855959819.db2.gz PLTWDBJPLWGNHT-UHFFFAOYSA-N 0 3 419.529 4.320 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)NCc3ccccc3C[N@H+](C)C(C)C)cc2)cc(=O)[n-]1 ZINC000410375275 855959823 /nfs/dbraw/zinc/95/98/23/855959823.db2.gz PLTWDBJPLWGNHT-UHFFFAOYSA-N 0 3 419.529 4.320 20 0 HIADHN COCC1(CN[C@@H](c2ccc(OC)c(OC)c2)c2ccccc2Cl)CCOCC1 ZINC000425924554 856001711 /nfs/dbraw/zinc/00/17/11/856001711.db2.gz PQRYXRDPXDSFAK-QFIPXVFZSA-N 0 3 419.949 4.479 20 0 HIADHN CS(=O)(=O)Cc1cccc(CN[C@H](Cc2cccnc2)c2cccc(Cl)c2)c1 ZINC000425932376 856006796 /nfs/dbraw/zinc/00/67/96/856006796.db2.gz PWFOFAWBVJPUTO-JOCHJYFZSA-N 0 3 414.958 4.353 20 0 HIADHN CCNC(=O)COc1cccc(CN[C@H](Cc2cccnc2)c2cccc(Cl)c2)c1 ZINC000425935472 856008131 /nfs/dbraw/zinc/00/81/31/856008131.db2.gz IOSZXHXDTULKPN-HSZRJFAPSA-N 0 3 423.944 4.324 20 0 HIADHN COC[C@H](c1ccc(Cl)cc1)N(C)C(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000425977892 856027169 /nfs/dbraw/zinc/02/71/69/856027169.db2.gz NEQOMHXJFVSUCE-HBMCJLEFSA-N 0 3 401.938 4.114 20 0 HIADHN Cc1ccc(-c2cccc(CNC(=O)N3CCN(C4CCOCC4)C[C@H]3C)c2)cc1 ZINC000426002193 856040607 /nfs/dbraw/zinc/04/06/07/856040607.db2.gz DVXSRZWJODRTDE-HXUWFJFHSA-N 0 3 407.558 4.057 20 0 HIADHN COc1ccc([C@H](CNC(=O)CCc2nc3c(cccc3C)[nH]2)N2CCCCC2)cc1 ZINC000426032316 856059759 /nfs/dbraw/zinc/05/97/59/856059759.db2.gz AEOKPECAPUACOT-QFIPXVFZSA-N 0 3 420.557 4.156 20 0 HIADHN COc1ccc([C@H](CNC(=O)CCc2nc3cccc(C)c3[nH]2)N2CCCCC2)cc1 ZINC000426032316 856059764 /nfs/dbraw/zinc/05/97/64/856059764.db2.gz AEOKPECAPUACOT-QFIPXVFZSA-N 0 3 420.557 4.156 20 0 HIADHN Cc1nc2ccc(CN3CCC(C(=O)Nc4ccc5c(c4)OCO5)CC3)cc2s1 ZINC000426044042 856068514 /nfs/dbraw/zinc/06/85/14/856068514.db2.gz JXEYKUYIPYAFOI-UHFFFAOYSA-N 0 3 409.511 4.184 20 0 HIADHN Cc1cccc2[nH]c(CCC(=O)NC[C@@H](c3cccs3)N3CCC(C)CC3)nc21 ZINC000426053322 856075462 /nfs/dbraw/zinc/07/54/62/856075462.db2.gz BSIIRTUGRKAZJB-IBGZPJMESA-N 0 3 410.587 4.455 20 0 HIADHN Cc1cccc2nc(CCC(=O)NC3CCN(Cc4ccc(Cl)cc4)CC3)[nH]c21 ZINC000426083288 856095241 /nfs/dbraw/zinc/09/52/41/856095241.db2.gz FUAXBNSSBZMMQY-UHFFFAOYSA-N 0 3 410.949 4.238 20 0 HIADHN CC(C)c1nn(C)cc1-c1noc([C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)n1 ZINC000426214997 856180707 /nfs/dbraw/zinc/18/07/07/856180707.db2.gz KIGKCZZFBWBDCY-HXUWFJFHSA-N 0 3 419.451 4.300 20 0 HIADHN C[C@@H](N[C@@H]1c2cc(Br)ccc2CC1(C)C)c1cccc(S(N)(=O)=O)c1 ZINC000426331992 856249451 /nfs/dbraw/zinc/24/94/51/856249451.db2.gz BRJUTPJKDYEKMI-KZULUSFZSA-N 0 3 423.376 4.071 20 0 HIADHN CCOc1cc(CN(C)C/C(C)=C\c2ccccc2)ccc1O[C@@H](C)C(=O)N(C)C ZINC000426376021 856264041 /nfs/dbraw/zinc/26/40/41/856264041.db2.gz HWOUBHUVJJRDQJ-YKRMCXMESA-N 0 3 410.558 4.476 20 0 HIADHN CCOc1cc(CN2CCS[C@H](C)CC2)ccc1OCC(=O)N(C(C)C)C(C)C ZINC000426385664 856269210 /nfs/dbraw/zinc/26/92/10/856269210.db2.gz PVWSVPGLYUHQOX-LJQANCHMSA-N 0 3 422.635 4.437 20 0 HIADHN O=C(N[C@@H]1CCN(C2CC2)C1)N(Cc1ccccc1Br)C1CCCC1 ZINC000426466651 856305945 /nfs/dbraw/zinc/30/59/45/856305945.db2.gz GUADOWQAGIUSKK-MRXNPFEDSA-N 0 3 406.368 4.140 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3nc4c(s3)CCCCC4)CC2)C[C@H](C)O1 ZINC000426635950 856386489 /nfs/dbraw/zinc/38/64/89/856386489.db2.gz YFPUNLLGIVBLQU-CALCHBBNSA-N 0 3 420.623 4.155 20 0 HIADHN C[C@@H](NC(=O)N1CCN(CC2CCCCC2)CC1)c1nc(C(F)(F)F)cs1 ZINC000426663630 856400605 /nfs/dbraw/zinc/40/06/05/856400605.db2.gz MOQJFAJKPDLWPT-CYBMUJFWSA-N 0 3 404.502 4.130 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)c1cc(-c2ccc(Cl)cc2)c[nH]1 ZINC000426670181 856404836 /nfs/dbraw/zinc/40/48/36/856404836.db2.gz DBPPWQQRJSGMOH-UHFFFAOYSA-N 0 3 423.944 4.222 20 0 HIADHN COc1ccccc1[C@@H](NC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1)c1ccco1 ZINC000426773745 856470720 /nfs/dbraw/zinc/47/07/20/856470720.db2.gz LIFCLLONGSTPSM-HYBUGGRVSA-N 0 3 419.525 4.294 20 0 HIADHN CC(C)Oc1nc(C(F)(F)F)ccc1C(=O)NC1CCN(Cc2ccccc2)CC1 ZINC000426872305 856521415 /nfs/dbraw/zinc/52/14/15/856521415.db2.gz VHQMSUSKJULYQR-UHFFFAOYSA-N 0 3 421.463 4.282 20 0 HIADHN C[C@@H](NC(=O)N1CCN(C2CCC(C)CC2)CC1)c1nc(C(F)(F)F)cs1 ZINC000426889855 856528741 /nfs/dbraw/zinc/52/87/41/856528741.db2.gz IBMPWBOIJIWPBF-ROKHWSDSSA-N 0 3 404.502 4.129 20 0 HIADHN CN(C)Cc1ccccc1C(=O)Nc1cccc(-c2cn(Cc3ccccc3)nn2)c1 ZINC000426984037 856579572 /nfs/dbraw/zinc/57/95/72/856579572.db2.gz ZDPJJQSRPGPROA-UHFFFAOYSA-N 0 3 411.509 4.307 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1ccc(NC(C)C)nc1 ZINC000427056476 856613957 /nfs/dbraw/zinc/61/39/57/856613957.db2.gz GGUHVBSLHWNRRN-OAQYLSRUSA-N 0 3 418.545 4.106 20 0 HIADHN CN(C)Cc1cccc(NC(=O)C(=O)N(Cc2ccccc2)Cc2ccccc2F)c1 ZINC000437463655 862826765 /nfs/dbraw/zinc/82/67/65/862826765.db2.gz AFIHWLLPFQDCHW-UHFFFAOYSA-N 0 3 419.500 4.055 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)C(=O)Nc3ccc(C4CCC4)cc3)c2)CC1 ZINC000427238161 856730368 /nfs/dbraw/zinc/73/03/68/856730368.db2.gz HXHYZLYOOVAXQG-UHFFFAOYSA-N 0 3 420.557 4.062 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)CSc3ccccc3Cl)CC2)C[C@@H](C)O1 ZINC000427287144 856752113 /nfs/dbraw/zinc/75/21/13/856752113.db2.gz IXYDGEJOMOJDKM-IAGOWNOFSA-N 0 3 411.011 4.170 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3cc4cc(F)ccc4s3)CC2)C[C@@H](C)O1 ZINC000427297216 856757485 /nfs/dbraw/zinc/75/74/85/856757485.db2.gz SBOCJSSZCBHAAQ-HZPDHXFCSA-N 0 3 404.551 4.392 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)[C@@H]3CCCC[C@@H]3C(F)(F)F)CC2)C[C@H](C)O1 ZINC000427298137 856758762 /nfs/dbraw/zinc/75/87/62/856758762.db2.gz ZUYGPSQZAVTIOG-JFRXWTBNSA-N 0 3 404.517 4.093 20 0 HIADHN Cc1nc(C(C)(C)C)sc1C(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000427298830 856758912 /nfs/dbraw/zinc/75/89/12/856758912.db2.gz GYLGLNQOVJOOIL-IYBDPMFKSA-N 0 3 407.624 4.101 20 0 HIADHN Cc1ccc(SCCC(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)cc1 ZINC000427300201 856759889 /nfs/dbraw/zinc/75/98/89/856759889.db2.gz SDANZFDCWSTYMD-WOJBJXKFSA-N 0 3 404.620 4.215 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3ccc(-c4ccccc4F)o3)CC2)C[C@@H](C)O1 ZINC000427311672 856764200 /nfs/dbraw/zinc/76/42/00/856764200.db2.gz DKKXSZDVBGYZHC-QZTJIDSGSA-N 0 3 414.521 4.437 20 0 HIADHN CC[C@H](Sc1ccccc1)C(=O)N1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000427323288 856771335 /nfs/dbraw/zinc/77/13/35/856771335.db2.gz XBPHCENFGXOUTB-IPJJNNNSSA-N 0 3 404.620 4.295 20 0 HIADHN CSCc1cc(C(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)ccc1F ZINC000427322959 856771372 /nfs/dbraw/zinc/77/13/72/856771372.db2.gz VZMWJOWIARRHHP-IAGOWNOFSA-N 0 3 408.583 4.040 20 0 HIADHN Cc1nc(-c2ccco2)ccc1C(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000427323363 856771916 /nfs/dbraw/zinc/77/19/16/856771916.db2.gz XNKCGGRRPYIXTL-QZTJIDSGSA-N 0 3 411.546 4.002 20 0 HIADHN Cc1ccc(-c2ocnc2C(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)cc1 ZINC000427343359 856783482 /nfs/dbraw/zinc/78/34/82/856783482.db2.gz WINDGOCRIBSZLL-OALUTQOASA-N 0 3 411.546 4.002 20 0 HIADHN C[C@@H](CSc1ccccc1)C(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000427357185 856790670 /nfs/dbraw/zinc/79/06/70/856790670.db2.gz LRXKNEALRYSXQH-SLFFLAALSA-N 0 3 404.620 4.153 20 0 HIADHN Cc1nc(C2CCCC2)sc1C(=O)N1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000427362044 856794174 /nfs/dbraw/zinc/79/41/74/856794174.db2.gz IDSDSKGROZJZLS-IRXDYDNUSA-N 0 3 419.635 4.461 20 0 HIADHN Cc1ccccc1[C@H]([C@H](C)NC(=O)C(=O)Nc1ccc(-c2ccco2)cc1F)N(C)C ZINC000427373650 856800381 /nfs/dbraw/zinc/80/03/81/856800381.db2.gz BOZCIQZVSSFHNU-AOMKIAJQSA-N 0 3 423.488 4.140 20 0 HIADHN COc1ccc([C@@H](CN[C@H](C)c2ncc(Br)cc2F)N2CCCC2)cc1 ZINC000427573544 856872481 /nfs/dbraw/zinc/87/24/81/856872481.db2.gz KEWSCWZAJJIDSC-AUUYWEPGSA-N 0 3 422.342 4.480 20 0 HIADHN O=C1CCCN1Cc1ccc(CN[C@@H]2CCCc3ncc(C(F)(F)F)cc32)cc1 ZINC000427598579 856883165 /nfs/dbraw/zinc/88/31/65/856883165.db2.gz GMKXPZDTBPAFAJ-LJQANCHMSA-N 0 3 403.448 4.390 20 0 HIADHN COc1cccc(N2CC[C@H](CN[C@@H](C)c3ncc(Br)cc3F)C2)c1 ZINC000427694061 856911348 /nfs/dbraw/zinc/91/13/48/856911348.db2.gz IHIOMGNHQLDLCN-UONOGXRCSA-N 0 3 408.315 4.169 20 0 HIADHN COc1ccc(CCN[C@@H](C)c2ncc(Br)cc2F)cc1OC(F)F ZINC000427693788 856911853 /nfs/dbraw/zinc/91/18/53/856911853.db2.gz HALNBOJKPWTNAX-JTQLQIEISA-N 0 3 419.241 4.487 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)C(=O)Nc2ccc3c(c2)oc2ccccc23)o1 ZINC000437502431 862855949 /nfs/dbraw/zinc/85/59/49/862855949.db2.gz QGSVSEXLFBGNAO-UHFFFAOYSA-N 0 3 419.481 4.016 20 0 HIADHN CCSc1cc(CN[C@H](C)CC(=O)Nc2cccc(Br)c2)ccn1 ZINC000427846252 856978642 /nfs/dbraw/zinc/97/86/42/856978642.db2.gz RLULQZUNXRXQEX-CYBMUJFWSA-N 0 3 408.365 4.463 20 0 HIADHN CCSc1cc(CN[C@@H](C)CC(=O)Nc2ccc(Br)cc2)ccn1 ZINC000427871743 856989421 /nfs/dbraw/zinc/98/94/21/856989421.db2.gz BERBFGHEQDCLNM-ZDUSSCGKSA-N 0 3 408.365 4.463 20 0 HIADHN C[C@@H](Cn1cc(Br)ccc1=O)N[C@@H]1CCSc2ccc(Cl)cc21 ZINC000428249879 857126301 /nfs/dbraw/zinc/12/63/01/857126301.db2.gz YRPZXBQAEMAIAJ-XHDPSFHLSA-N 0 3 413.768 4.479 20 0 HIADHN Cc1ccc(-c2cncc(C(=O)NC[C@@H]3CN(Cc4ccccc4)CCCO3)c2)cc1 ZINC000428438436 857203773 /nfs/dbraw/zinc/20/37/73/857203773.db2.gz VVPHHSXJGZDEFH-RUZDIDTESA-N 0 3 415.537 4.078 20 0 HIADHN Cc1cccc(-c2cncc(C(=O)NC[C@H]3CN(Cc4ccccc4)CCCO3)c2)c1 ZINC000428441739 857204809 /nfs/dbraw/zinc/20/48/09/857204809.db2.gz ILPDPHAHONVQRZ-VWLOTQADSA-N 0 3 415.537 4.078 20 0 HIADHN O=C(NC[C@H]1CN(Cc2ccccc2)CCCO1)c1cc(C2CC2)nc2ccccc21 ZINC000428447366 857206170 /nfs/dbraw/zinc/20/61/70/857206170.db2.gz LXJTVMLNVIYCQA-NRFANRHFSA-N 0 3 415.537 4.133 20 0 HIADHN COc1cc(CN2CC[C@@H](O)[C@@H](C)C2)ccc1OCc1cccc(C(F)(F)F)c1 ZINC000428466505 857211504 /nfs/dbraw/zinc/21/15/04/857211504.db2.gz WYNCIVBCBYFNPN-HNAYVOBHSA-N 0 3 409.448 4.496 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)N2CCC(c3ncccc3Cl)CC2)C1 ZINC000428475706 857215726 /nfs/dbraw/zinc/21/57/26/857215726.db2.gz AJBCXBCLTITHCW-FXAWDEMLSA-N 0 3 412.965 4.460 20 0 HIADHN CCCOc1cccnc1C(=O)Nc1cc(C)nn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000428519724 857238850 /nfs/dbraw/zinc/23/88/50/857238850.db2.gz PWSPFZZXHJQQEZ-FQEVSTJZSA-N 0 3 419.529 4.075 20 0 HIADHN Cc1ccccc1COc1ccccc1C(=O)Nc1cccc(CN2CC[C@H](O)C2)c1 ZINC000428529422 857242710 /nfs/dbraw/zinc/24/27/10/857242710.db2.gz HCMQVCJRJKNCNR-QHCPKHFHSA-N 0 3 416.521 4.393 20 0 HIADHN Cc1ccc(C(=O)CC(C)(C)CC(=O)Nc2cccc(CN3CC[C@@H](O)C3)c2)cc1 ZINC000428531241 857243881 /nfs/dbraw/zinc/24/38/81/857243881.db2.gz ANEKHXKPDGAMRH-JOCHJYFZSA-N 0 3 408.542 4.189 20 0 HIADHN CC(C)OCc1c2ccccc2oc1C(=O)Nc1cccc(CN2CC[C@H](O)C2)c1 ZINC000428530849 857244625 /nfs/dbraw/zinc/24/46/25/857244625.db2.gz BYOIIZXBWFOFOB-IBGZPJMESA-N 0 3 408.498 4.177 20 0 HIADHN C[C@H](Oc1ccc(-c2ccccc2)cc1)C(=O)Nc1cccc(CN2CC[C@H](O)C2)c1 ZINC000428537487 857249419 /nfs/dbraw/zinc/24/94/19/857249419.db2.gz LXYZFDDTQFQDKY-CYFREDJKSA-N 0 3 416.521 4.326 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@@H](O)C2)c1)c1c[nH]cc1-c1ccc(Cl)s1 ZINC000428537989 857251304 /nfs/dbraw/zinc/25/13/04/857251304.db2.gz PAMXWLWPDWNHJV-OAHLLOKOSA-N 0 3 401.919 4.216 20 0 HIADHN C[C@@H](Cc1ccc(Cl)cc1Cl)C(=O)Nc1cccc(CN2CC[C@@H](O)C2)c1 ZINC000428547295 857258049 /nfs/dbraw/zinc/25/80/49/857258049.db2.gz YPOUACZIRIAWTB-IFXJQAMLSA-N 0 3 407.341 4.377 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)c1cccc2[nH]c(-c3cccs3)nc21 ZINC000428548652 857258701 /nfs/dbraw/zinc/25/87/01/857258701.db2.gz OGCFLRSAJKCRLX-KRWDZBQOSA-N 0 3 418.522 4.110 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@@H](O)C2)c1)C(Cc1ccccc1)Cc1ccccc1 ZINC000428550732 857260309 /nfs/dbraw/zinc/26/03/09/857260309.db2.gz SBUXFTLIFGZFPA-AREMUKBSSA-N 0 3 414.549 4.293 20 0 HIADHN COCCS(=O)(=O)c1ccc(CNCc2cccc(-c3ccccc3C)c2)cc1 ZINC000428556571 857265546 /nfs/dbraw/zinc/26/55/46/857265546.db2.gz GGEJYTORYKZYOQ-UHFFFAOYSA-N 0 3 409.551 4.372 20 0 HIADHN C[C@H](NC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1)c1nc(C(F)(F)F)cs1 ZINC000428624113 857281520 /nfs/dbraw/zinc/28/15/20/857281520.db2.gz IQYKIUQSFNVGFD-JSGCOSHPSA-N 0 3 415.456 4.390 20 0 HIADHN C[C@@H](NC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1)c1nc(C(F)(F)F)cs1 ZINC000428624115 857281829 /nfs/dbraw/zinc/28/18/29/857281829.db2.gz IQYKIUQSFNVGFD-OCCSQVGLSA-N 0 3 415.456 4.390 20 0 HIADHN CC[C@H](NC(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1)c1ccc(F)cc1F ZINC000428633651 857284240 /nfs/dbraw/zinc/28/42/40/857284240.db2.gz PXOZABSHSIOKBM-UGKGYDQZSA-N 0 3 417.500 4.006 20 0 HIADHN OC[C@H](CC(F)F)NCc1ccc(OCc2ccccc2)c(Br)c1 ZINC000428649473 857288436 /nfs/dbraw/zinc/28/84/36/857288436.db2.gz MQHIWRSGONSMDZ-HNNXBMFYSA-N 0 3 400.263 4.134 20 0 HIADHN CCN1CCCN(C(=O)N[C@H](c2ccccc2)c2ccc(Br)cc2)CC1 ZINC000428691667 857298600 /nfs/dbraw/zinc/29/86/00/857298600.db2.gz NTHWNYRFYOJRIX-HXUWFJFHSA-N 0 3 416.363 4.276 20 0 HIADHN Clc1cccc(-n2cc(CNC[C@@H]3CCO[C@H]3c3ccccc3)nn2)c1Cl ZINC000428703516 857302332 /nfs/dbraw/zinc/30/23/32/857302332.db2.gz WUMDFRHJXMKUHV-YWZLYKJASA-N 0 3 403.313 4.442 20 0 HIADHN CCN1CCCN(C(=O)NCc2csc(-c3ccc(C(F)(F)F)cc3)n2)CC1 ZINC000428704891 857303161 /nfs/dbraw/zinc/30/31/61/857303161.db2.gz CTHBUTYNKFLKES-UHFFFAOYSA-N 0 3 412.481 4.066 20 0 HIADHN CCOC(=O)Cn1nc(C)c(CN2CC=C(c3c[nH]c4cc(C)ccc43)CC2)c1C ZINC000437578324 862896065 /nfs/dbraw/zinc/89/60/65/862896065.db2.gz JKITVQJPFADFQF-UHFFFAOYSA-N 0 3 406.530 4.142 20 0 HIADHN CCN1CCN(CCC(=O)Nc2nc(-c3cccc4ccccc43)c(C)s2)CC1 ZINC000428754724 857319822 /nfs/dbraw/zinc/31/98/22/857319822.db2.gz SVIUNWBNNHVBQZ-UHFFFAOYSA-N 0 3 408.571 4.238 20 0 HIADHN COC(=O)c1coc(CN(Cc2ccncc2)[C@@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000428801034 857348578 /nfs/dbraw/zinc/34/85/78/857348578.db2.gz HKVLEAOVJPYGPJ-HSZRJFAPSA-N 0 3 419.525 4.128 20 0 HIADHN CC(C)(C)c1noc(CN(Cc2ccncc2)[C@H]2CCCN(Cc3ccccc3)C2)n1 ZINC000428802389 857349603 /nfs/dbraw/zinc/34/96/03/857349603.db2.gz JDPRUBUPLZKCRE-QFIPXVFZSA-N 0 3 419.573 4.429 20 0 HIADHN OC[C@H](CNCc1nc2ccc(F)cc2s1)Cc1ccccc1OC(F)(F)F ZINC000428852583 857372857 /nfs/dbraw/zinc/37/28/57/857372857.db2.gz UHLCBZKVTKIJDG-LBPRGKRZSA-N 0 3 414.424 4.275 20 0 HIADHN CCc1nc2cc(NC(=O)N3CCC(CCN4C[C@@H](C)O[C@@H](C)C4)CC3)ccc2o1 ZINC000428889225 857392850 /nfs/dbraw/zinc/39/28/50/857392850.db2.gz VWNMZVFKTDUABZ-CALCHBBNSA-N 0 3 414.550 4.133 20 0 HIADHN CCn1cnnc1-c1ccccc1NC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1 ZINC000428896048 857397364 /nfs/dbraw/zinc/39/73/64/857397364.db2.gz LEBXRNFELBPRJF-IBGZPJMESA-N 0 3 418.545 4.093 20 0 HIADHN CCc1noc(CC)c1CNC(=O)NC[C@H](c1cccs1)N1CCC(C)CC1 ZINC000428970023 857440278 /nfs/dbraw/zinc/44/02/78/857440278.db2.gz AABPWPXYLGXAJU-GOSISDBHSA-N 0 3 404.580 4.133 20 0 HIADHN C[C@H](c1cccc(Cl)c1)N(C)C(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000429008768 857454805 /nfs/dbraw/zinc/45/48/05/857454805.db2.gz MVCDEECCULTZOW-GCJKJVERSA-N 0 3 415.965 4.334 20 0 HIADHN CC(C)(C)Oc1ccc(NC(=O)NC[C@@H]2CN(Cc3ccccc3)CCCO2)cc1 ZINC000429025063 857462978 /nfs/dbraw/zinc/46/29/78/857462978.db2.gz AYTODKTWEHAMRX-JOCHJYFZSA-N 0 3 411.546 4.277 20 0 HIADHN CN(Cc1csc2ccccc12)C(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000429026056 857463043 /nfs/dbraw/zinc/46/30/43/857463043.db2.gz ZFILIVWGLWEMRF-OAQYLSRUSA-N 0 3 423.582 4.334 20 0 HIADHN O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)Nc1ccc2oc(C3CC3)nc2c1 ZINC000429040049 857470662 /nfs/dbraw/zinc/47/06/62/857470662.db2.gz GYCHVVLABBWHBY-HXUWFJFHSA-N 0 3 420.513 4.118 20 0 HIADHN O=C(NC[C@H]1CN(Cc2ccccc2)CCCO1)Nc1cccc(-c2nccs2)c1 ZINC000429053943 857480144 /nfs/dbraw/zinc/48/01/44/857480144.db2.gz OPENFIFIYQNNSN-NRFANRHFSA-N 0 3 422.554 4.223 20 0 HIADHN CC(C)Oc1ccc(NC(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)c(F)c1 ZINC000429062425 857486597 /nfs/dbraw/zinc/48/65/97/857486597.db2.gz GVOKXPXPKIMBQX-ROUUACIJSA-N 0 3 421.557 4.356 20 0 HIADHN CC(C)Oc1ccc(F)cc1NC(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000429064557 857488433 /nfs/dbraw/zinc/48/84/33/857488433.db2.gz NWKBYMRAGHZQNY-QZTJIDSGSA-N 0 3 421.557 4.356 20 0 HIADHN CC1CCN([C@H](CNC(=O)NCc2ccn(C3CCCC3)n2)c2cccs2)CC1 ZINC000429069494 857491947 /nfs/dbraw/zinc/49/19/47/857491947.db2.gz JKPUCHHPDLFTKV-HXUWFJFHSA-N 0 3 415.607 4.332 20 0 HIADHN Cc1ccc2cccc(NC(=O)N3CCC(CCN4C[C@@H](C)O[C@@H](C)C4)CC3)c2n1 ZINC000429077190 857496795 /nfs/dbraw/zinc/49/67/95/857496795.db2.gz USOLLVYWHPXPDU-KDURUIRLSA-N 0 3 410.562 4.286 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N[C@@H](C)c2cccc(N3CCCC3)c2)C1 ZINC000429080712 857499261 /nfs/dbraw/zinc/49/92/61/857499261.db2.gz ONLBZMDUDUNMDA-MIZPHKNDSA-N 0 3 406.574 4.483 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3cccc(OC(F)F)c3)CC2)C[C@@H](C)O1 ZINC000429102578 857509803 /nfs/dbraw/zinc/50/98/03/857509803.db2.gz AJPQMPQKCPNZIN-HZPDHXFCSA-N 0 3 411.493 4.031 20 0 HIADHN CCCn1ccnc1CCCN(C)[C@H](C)C(=O)Nc1ccc(C)cc1Br ZINC000429237170 857567771 /nfs/dbraw/zinc/56/77/71/857567771.db2.gz KGIOEXDDWRLJOY-MRXNPFEDSA-N 0 3 421.383 4.256 20 0 HIADHN CSC[C@@H]1CCCN(CC(=O)N2CCc3sccc3[C@@H]2c2ccccc2)C1 ZINC000429279979 857588710 /nfs/dbraw/zinc/58/87/10/857588710.db2.gz WMMXBVNEVSQSEJ-VGSWGCGISA-N 0 3 400.613 4.297 20 0 HIADHN O[C@@H](COc1cccc2[nH]ccc21)CN(CCc1ccccc1)Cc1cccnc1 ZINC000429283156 857590122 /nfs/dbraw/zinc/59/01/22/857590122.db2.gz IAKQJVACIVIHSK-JOCHJYFZSA-N 0 3 401.510 4.048 20 0 HIADHN Cc1nn(C)c(C)c1NC(=O)[C@H](C)N[C@H]1c2cc(Br)ccc2CC1(C)C ZINC000429296941 857595295 /nfs/dbraw/zinc/59/52/95/857595295.db2.gz TVWHAKPWALLDNM-SGTLLEGYSA-N 0 3 419.367 4.040 20 0 HIADHN CC(C)(C(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1)c1ccccc1Cl ZINC000429331969 857607244 /nfs/dbraw/zinc/60/72/44/857607244.db2.gz WKQJPOLRQLIKRJ-LJQANCHMSA-N 0 3 400.950 4.025 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)NC[C@@H](c1ccccc1)C(C)(C)CO ZINC000437614563 862932174 /nfs/dbraw/zinc/93/21/74/862932174.db2.gz ZVBNEIWZZIHTEL-URXFXBBRSA-N 0 3 423.601 4.095 20 0 HIADHN Cn1ccc([C@@H](NC[C@@H]2CN(Cc3ccccc3)CCCO2)c2ccc(Cl)cc2)n1 ZINC000429413610 857653133 /nfs/dbraw/zinc/65/31/33/857653133.db2.gz VNLQVMLFXVZEKK-VWNXMTODSA-N 0 3 424.976 4.044 20 0 HIADHN COCCS(=O)(=O)c1ccc(CN[C@H](c2ccc(F)cc2)C2CCCC2)cc1 ZINC000429419713 857656208 /nfs/dbraw/zinc/65/62/08/857656208.db2.gz AJXYQWPKMRVBKV-QFIPXVFZSA-N 0 3 405.535 4.267 20 0 HIADHN Fc1ccccc1C[C@H](NCc1cnc(N2CCOCC2)c(F)c1)c1ccccc1 ZINC000429418908 857656252 /nfs/dbraw/zinc/65/62/52/857656252.db2.gz PGVJBFLKMDDCAW-QHCPKHFHSA-N 0 3 409.480 4.270 20 0 HIADHN Cc1noc(C[C@H](NCC[S@](=O)c2cc(Cl)ccc2Cl)c2ccccc2)n1 ZINC000429547459 857737977 /nfs/dbraw/zinc/73/79/77/857737977.db2.gz JMKUXYQANLUJDD-SOKVYYICSA-N 0 3 424.353 4.366 20 0 HIADHN Cc1noc(C[C@H](NCCOc2ccc(Br)cc2)c2ccccc2)n1 ZINC000429547348 857738342 /nfs/dbraw/zinc/73/83/42/857738342.db2.gz LATWESNLRAONJO-SFHVURJKSA-N 0 3 402.292 4.093 20 0 HIADHN CC(C)c1ccc(Cn2nccc2NC(=O)N(CCN(C)C)Cc2ccccn2)cc1 ZINC000429570872 857756507 /nfs/dbraw/zinc/75/65/07/857756507.db2.gz XLDVDABFRMUCEC-UHFFFAOYSA-N 0 3 420.561 4.046 20 0 HIADHN CCN(C(=O)Nc1ccnn1Cc1ccc(F)cc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000429571557 857756789 /nfs/dbraw/zinc/75/67/89/857756789.db2.gz RSMIUWWWCHRVCT-QFIPXVFZSA-N 0 3 421.520 4.199 20 0 HIADHN CN(C(=O)c1ccccc1COC1CCOCC1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000429605310 857787265 /nfs/dbraw/zinc/78/72/65/857787265.db2.gz PVINSSHQLSGQCX-QHCPKHFHSA-N 0 3 422.569 4.119 20 0 HIADHN Cc1ccc([C@H](CNC(=O)NC[C@@H](c2ccccc2)C(C)(C)CO)N2CCCC2)cc1 ZINC000437629706 862954935 /nfs/dbraw/zinc/95/49/35/862954935.db2.gz PJASZCZYQRJGPU-ZEQRLZLVSA-N 0 3 423.601 4.233 20 0 HIADHN c1csc(CN(C[C@@H]2CCCO2)C[C@H]2CN(Cc3ccccc3)CCCO2)c1 ZINC000429732840 857855816 /nfs/dbraw/zinc/85/58/16/857855816.db2.gz YYOJJKFBZNXLHL-FCHUYYIVSA-N 0 3 400.588 4.020 20 0 HIADHN C[C@@H](C(=O)N(CCCc1ccccc1)CCN(C)C)[C@H]1OCCc2sccc21 ZINC000429887916 857928869 /nfs/dbraw/zinc/92/88/69/857928869.db2.gz MJSGCESTJYZADC-XMSQKQJNSA-N 0 3 400.588 4.021 20 0 HIADHN C[C@H](C(=O)N(CCN(C)C)Cc1ccc(C(F)(F)F)cc1)c1ccc2c(c1)OCO2 ZINC000429897559 857933589 /nfs/dbraw/zinc/93/35/89/857933589.db2.gz DFBANWJWXVOBAH-HNNXBMFYSA-N 0 3 422.447 4.128 20 0 HIADHN COc1ccc([C@H](NC(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)C(F)(F)F)cc1 ZINC000429983455 857983097 /nfs/dbraw/zinc/98/30/97/857983097.db2.gz WEJMQRZQTKBWJV-JVPBZIDWSA-N 0 3 409.452 4.289 20 0 HIADHN COc1ccccc1-n1nccc1CNCc1ccccc1CN(C)Cc1ccco1 ZINC000430016436 857998768 /nfs/dbraw/zinc/99/87/68/857998768.db2.gz QHWHGOQDRUVVJN-UHFFFAOYSA-N 0 3 416.525 4.396 20 0 HIADHN Clc1cccc(-n2cnnc2SC[C@H]2CN(Cc3ccccc3)CCCO2)c1 ZINC000430129716 858046007 /nfs/dbraw/zinc/04/60/07/858046007.db2.gz ZTZUJDPRCHXFHQ-HXUWFJFHSA-N 0 3 414.962 4.304 20 0 HIADHN CCc1ccccc1NC(=O)C[C@@H](C)N[C@@H](CO)c1ccc(Br)c(F)c1 ZINC000430147573 858052926 /nfs/dbraw/zinc/05/29/26/858052926.db2.gz LQIDVGCCDASMEH-YJYMSZOUSA-N 0 3 423.326 4.191 20 0 HIADHN COC(=O)c1ccccc1CC1CCN(Cc2c(C)nn(-c3ccccn3)c2C)CC1 ZINC000430174878 858066495 /nfs/dbraw/zinc/06/64/95/858066495.db2.gz AGZGDKSZPIENKG-UHFFFAOYSA-N 0 3 418.541 4.125 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCCC[C@H]1c1nccn1CC)c1ccsc1 ZINC000430185520 858072735 /nfs/dbraw/zinc/07/27/35/858072735.db2.gz DYIBSYISHFPMJU-RBUKOAKNSA-N 0 3 403.596 4.284 20 0 HIADHN COc1ccccc1-c1ncc(CN(CCCO)[C@H]2CCCc3ccccc32)cn1 ZINC000430243086 858094575 /nfs/dbraw/zinc/09/45/75/858094575.db2.gz TUUQFYBEVYEZKG-QHCPKHFHSA-N 0 3 403.526 4.414 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)N[C@H](CC3CC3)c3cc(F)cc(Br)c3)[C@@H]2C1 ZINC000430298933 858113523 /nfs/dbraw/zinc/11/35/23/858113523.db2.gz GXOKUJUOCFVAIN-NIKGAXFTSA-N 0 3 424.358 4.165 20 0 HIADHN CN(C(=O)[C@@H]1CCN(Cc2cccc(C(=O)Nc3ccccc3)c2)C1)c1ccccc1 ZINC000430324515 858122502 /nfs/dbraw/zinc/12/25/02/858122502.db2.gz QUNBTTRNZDMJTL-JOCHJYFZSA-N 0 3 413.521 4.424 20 0 HIADHN C[C@H](N[C@H]1c2ccccc2CC[C@H]1C)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000430694104 858271569 /nfs/dbraw/zinc/27/15/69/858271569.db2.gz IYWIXECIIYCMSX-QHRIQVFBSA-N 0 3 423.376 4.071 20 0 HIADHN O=C1N[C@@H](c2ccc(Cl)cc2Cl)C(=O)N1C1CCN(Cc2ccccc2)CC1 ZINC000430976990 858389103 /nfs/dbraw/zinc/38/91/03/858389103.db2.gz DCNLOLVONWPIMA-IBGZPJMESA-N 0 3 418.324 4.251 20 0 HIADHN O=C1N[C@@H](Cc2cccc3ccccc32)C(=O)N1C[C@@H](c1cccs1)N1CCCC1 ZINC000430979730 858389760 /nfs/dbraw/zinc/38/97/60/858389760.db2.gz QDAVHQCMSSLZBZ-SFTDATJTSA-N 0 3 419.550 4.201 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)CCN1CCC[C@H]1CC(=O)c1cccs1 ZINC000430996876 858398455 /nfs/dbraw/zinc/39/84/55/858398455.db2.gz SDOIKWOUNGGDQB-HNNXBMFYSA-N 0 3 406.935 4.476 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](N2C(=O)N[C@@H](Cc3cccc4ccccc43)C2=O)C1 ZINC000431042454 858415227 /nfs/dbraw/zinc/41/52/27/858415227.db2.gz HSMYFEWCEGRKQR-XANCMCCPSA-N 0 3 413.521 4.138 20 0 HIADHN C[C@@H]1CCN(C(=O)Nc2cccc(NC(=O)C3CC3)c2)CCN1Cc1ccccc1 ZINC000437686431 863026486 /nfs/dbraw/zinc/02/64/86/863026486.db2.gz HNARZILHWSACDU-GOSISDBHSA-N 0 3 406.530 4.163 20 0 HIADHN COC(=O)c1ccc(COc2ccccc2CN2CCC(c3ncc[nH]3)CC2)cc1 ZINC000437691475 863029368 /nfs/dbraw/zinc/02/93/68/863029368.db2.gz JDQXOOOJIKXHDO-UHFFFAOYSA-N 0 3 405.498 4.155 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)N[C@@H]1C[C@H]1c1ccccc1Br ZINC000431187498 858495264 /nfs/dbraw/zinc/49/52/64/858495264.db2.gz PHWZKDGCQKXLBE-FUHWJXTLSA-N 0 3 422.392 4.140 20 0 HIADHN CC(C)c1cccc2c1OCCC[C@@H]2NCc1ccc(C(=O)N2CCN(C)CC2)cc1 ZINC000431323877 858565143 /nfs/dbraw/zinc/56/51/43/858565143.db2.gz QVDQPUDKJDTFEW-DEOSSOPVSA-N 0 3 421.585 4.201 20 0 HIADHN C[C@H]1CN(Cc2cccc(CN[C@@H]3CCCOc4cc5c(cc43)CCC5)c2)CCO1 ZINC000431328769 858567838 /nfs/dbraw/zinc/56/78/38/858567838.db2.gz OSYZCAPCDQSYPX-UQBPGWFLSA-N 0 3 406.570 4.400 20 0 HIADHN C[C@@H]1CCN(C(=O)c2cccc(OCC(F)(F)F)c2)CCN1Cc1ccccc1 ZINC000431501350 858646301 /nfs/dbraw/zinc/64/63/01/858646301.db2.gz XELIDNXZBOCJSV-QGZVFWFLSA-N 0 3 406.448 4.364 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCCC3CC(OC(C)(C)C)C3)c(C)c2)CC1 ZINC000431561629 858670894 /nfs/dbraw/zinc/67/08/94/858670894.db2.gz SFAUEYDGJSDXPJ-UHFFFAOYSA-N 0 3 416.610 4.242 20 0 HIADHN CCN(C)C(=O)CCN[C@@H](c1ccccc1)c1ccc(OC)c(Br)c1 ZINC000431595213 858681089 /nfs/dbraw/zinc/68/10/89/858681089.db2.gz JIDMUOWKKQGGLT-FQEVSTJZSA-N 0 3 405.336 4.005 20 0 HIADHN Cc1cc(C)c(NC(=O)N(CCN(C)C)Cc2ccccn2)c(Br)c1 ZINC000432001254 858915901 /nfs/dbraw/zinc/91/59/01/858915901.db2.gz WOCMBEYMDNAHHP-UHFFFAOYSA-N 0 3 405.340 4.057 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)N1CC[C@H](c2ccc(F)cc2)C1 ZINC000432024075 858935228 /nfs/dbraw/zinc/93/52/28/858935228.db2.gz IYBNGOONGWSBGX-FQEVSTJZSA-N 0 3 413.562 4.438 20 0 HIADHN CCSc1ccc(Cl)cc1NC(=O)N1CCN(c2ccncc2OC)CC1 ZINC000432089728 858981373 /nfs/dbraw/zinc/98/13/73/858981373.db2.gz PNGRXVFRIUESFK-UHFFFAOYSA-N 0 3 406.939 4.210 20 0 HIADHN COCc1ccc([C@H]2CCCN2C(=O)NC[C@@H](c2cccs2)N2CCCC2)o1 ZINC000467564928 881388042 /nfs/dbraw/zinc/38/80/42/881388042.db2.gz SWQSCPICMUEGKT-MSOLQXFVSA-N 0 3 403.548 4.171 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@@H](C)N[C@@H](C)c2cc(C(=O)OC)c(C)o2)CC1 ZINC000432780857 859357432 /nfs/dbraw/zinc/35/74/32/859357432.db2.gz IXUNIAMLWHUISM-CVEARBPZSA-N 0 3 417.525 4.067 20 0 HIADHN Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)N(C)C[C@H](O)COCC(F)(F)F ZINC000432818208 859373353 /nfs/dbraw/zinc/37/33/53/859373353.db2.gz JMILCWKUYYLIIT-ZBFHGGJFSA-N 0 3 402.482 4.360 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1ccc(OC(F)F)c(C(F)(F)F)c1 ZINC000432992864 859468270 /nfs/dbraw/zinc/46/82/70/859468270.db2.gz QDRDCWWNDJIPOS-UHFFFAOYSA-N 0 3 421.366 4.496 20 0 HIADHN C[C@@H](SCCN(C)Cc1ccccc1)C(=O)Nc1ccc2c(c1)OCCCO2 ZINC000433032048 859490570 /nfs/dbraw/zinc/49/05/70/859490570.db2.gz KQSUBBRQRPJTBE-QGZVFWFLSA-N 0 3 400.544 4.040 20 0 HIADHN CCCOc1c(Br)cc(Br)cc1CNCCC[C@H](C)O ZINC000433192422 859561733 /nfs/dbraw/zinc/56/17/33/859561733.db2.gz LEYSUEARTWWIEM-NSHDSACASA-N 0 3 409.162 4.251 20 0 HIADHN COc1cc(NC(=O)CCN2CC=C(c3ccc(O)cc3)CC2)c(OC)cc1Cl ZINC000433289158 859619394 /nfs/dbraw/zinc/61/93/94/859619394.db2.gz PBGCRZVSKBPDFJ-UHFFFAOYSA-N 0 3 416.905 4.181 20 0 HIADHN CN(C)Cc1ccc(S(=O)(=O)N(C)c2ccc(OCc3ccccc3)cc2)cc1 ZINC000433339985 859653425 /nfs/dbraw/zinc/65/34/25/859653425.db2.gz CQWYSFIJBADVMT-UHFFFAOYSA-N 0 3 410.539 4.152 20 0 HIADHN Cc1ccccc1[C@@H](CC(F)(F)F)NS(=O)(=O)c1ccc(CN(C)C)cc1 ZINC000433355783 859658376 /nfs/dbraw/zinc/65/83/76/859658376.db2.gz RMAXWGOKSMCBPB-GOSISDBHSA-N 0 3 400.466 4.029 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)c1cccc(-c2noc(C(F)(F)F)n2)c1 ZINC000433378036 859665955 /nfs/dbraw/zinc/66/59/55/859665955.db2.gz YDJLIYPHQQUCER-UHFFFAOYSA-N 0 3 404.392 4.378 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)Nc2c(C)cccc2Cl)CC1 ZINC000467658164 881452135 /nfs/dbraw/zinc/45/21/35/881452135.db2.gz HINKMTAKSZFNCN-UHFFFAOYSA-N 0 3 400.954 4.108 20 0 HIADHN C[C@H](NC(=O)Nc1ccc(Oc2ncc(Cl)cn2)c(Cl)c1)C1=CCN(C)CC1 ZINC000433658372 859827687 /nfs/dbraw/zinc/82/76/87/859827687.db2.gz BTKQKGZZHLJHAQ-LBPRGKRZSA-N 0 3 422.316 4.348 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)Cc2cc(F)ccc2Br)C1 ZINC000433717872 859852005 /nfs/dbraw/zinc/85/20/05/859852005.db2.gz JYRBGEQOSLPVTA-KBXCAEBGSA-N 0 3 405.311 4.082 20 0 HIADHN CCNC(=O)Nc1cccc(NC(=O)N(CCN(C)C)Cc2cccc(C)c2)c1C ZINC000433735003 859863743 /nfs/dbraw/zinc/86/37/43/859863743.db2.gz HETNQCQANLRHSI-UHFFFAOYSA-N 0 3 411.550 4.041 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)c2cccc(CSc3nccn3C)c2)CN1Cc1ccccc1 ZINC000467684612 881478512 /nfs/dbraw/zinc/47/85/12/881478512.db2.gz CXOMCOQUWKZDKJ-XMSQKQJNSA-N 0 3 420.582 4.105 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)[C@@H]3CCCc4sccc43)CC2)c1 ZINC000433828623 859919023 /nfs/dbraw/zinc/91/90/23/859919023.db2.gz NLHQYXLVVKCEDO-JOCHJYFZSA-N 0 3 411.615 4.195 20 0 HIADHN C[C@@H](NS(=O)(=O)c1ccc(CN(C)C)cc1)[C@@H](C)c1ccccc1C(F)(F)F ZINC000433863561 859941084 /nfs/dbraw/zinc/94/10/84/859941084.db2.gz GEEVMIDZJHKIID-HUUCEWRRSA-N 0 3 414.493 4.238 20 0 HIADHN Cc1ccsc1[C@H](Cc1ccccc1)NS(=O)(=O)c1ccc(CN(C)C)cc1 ZINC000433874079 859946981 /nfs/dbraw/zinc/94/69/81/859946981.db2.gz IGOZCKIMLCKNJR-NRFANRHFSA-N 0 3 414.596 4.380 20 0 HIADHN CC(C)n1nc(-c2ccco2)cc1NC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000433924513 859974825 /nfs/dbraw/zinc/97/48/25/859974825.db2.gz CWAOXYDZGLHIEN-LJQANCHMSA-N 0 3 407.518 4.462 20 0 HIADHN CCN(C(=O)Nc1noc(-c2ccccc2F)c1C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000433927576 859977333 /nfs/dbraw/zinc/97/73/33/859977333.db2.gz SSIUYDXGMZCUSF-LJQANCHMSA-N 0 3 422.504 4.917 20 0 HIADHN O=C(NC[C@@H]1CCCN(c2ccccc2)C1)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000433936109 859984303 /nfs/dbraw/zinc/98/43/03/859984303.db2.gz GWZFJFDDCGHKMW-URXFXBBRSA-N 0 3 406.574 4.039 20 0 HIADHN COc1ccc([C@H](NC(=O)NC[C@@H]2CCCCN2C2CC2)c2ccccc2OC)cc1 ZINC000433942215 859989760 /nfs/dbraw/zinc/98/97/60/859989760.db2.gz PDUQXISEDSOFLN-RDPSFJRHSA-N 0 3 423.557 4.109 20 0 HIADHN Cc1cc(C(=O)N(CCN(C)C)C2CCCC2)c2cc(Br)ccc2n1 ZINC000433975015 860011040 /nfs/dbraw/zinc/01/10/40/860011040.db2.gz RISPLAIIEDVWDA-UHFFFAOYSA-N 0 3 404.352 4.252 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)c2cc(NC(=O)C(C)(C)C)ccc2F)CN1Cc1ccccc1 ZINC000467694735 881488954 /nfs/dbraw/zinc/48/89/54/881488954.db2.gz BTQLTBHVSBJSTN-QFBILLFUSA-N 0 3 411.521 4.203 20 0 HIADHN Cc1ccc(C(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)cc1NC(=O)NC(C)(C)C ZINC000467696675 881490509 /nfs/dbraw/zinc/49/05/09/881490509.db2.gz VYNAYGGJAYAZHJ-GHTZIAJQSA-N 0 3 422.573 4.308 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NC[C@@H](c3cccnc3)C(C)C)c(C)c2)CC1 ZINC000433994947 860026142 /nfs/dbraw/zinc/02/61/42/860026142.db2.gz VZNMUCZXXVHQKE-JOCHJYFZSA-N 0 3 409.578 4.093 20 0 HIADHN Cc1ccn(C2CCN(C(=O)NC[C@H](c3cccs3)N3CCC(C)CC3)CC2)n1 ZINC000434005135 860033680 /nfs/dbraw/zinc/03/36/80/860033680.db2.gz VMFAIYXDRJDDQV-HXUWFJFHSA-N 0 3 415.607 4.073 20 0 HIADHN Cc1cccc(CN(Cc2cccc(C)n2)C(=O)Nc2cccc(CN(C)C)c2)n1 ZINC000434012096 860039036 /nfs/dbraw/zinc/03/90/36/860039036.db2.gz OGDVNENYFLVMLZ-UHFFFAOYSA-N 0 3 403.530 4.389 20 0 HIADHN COc1ccc(C(=O)CCC(=O)NC2C[C@H]3CC[C@@H](C2)N3Cc2ccccc2)cc1F ZINC000434066806 860076776 /nfs/dbraw/zinc/07/67/76/860076776.db2.gz FLLONRHJQWRKPY-SEJPIABJSA-N 0 3 424.516 4.109 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2ccccc2C(C)(C)C)cc1)[C@@H]1CCCN(C)C1 ZINC000434143858 860141783 /nfs/dbraw/zinc/14/17/83/860141783.db2.gz JMCJPSWNAMBQLL-HXUWFJFHSA-N 0 3 407.558 4.403 20 0 HIADHN CN1CCC[C@@H](CNC(=O)c2cc(-c3ccc4c(c3)CCO4)no2)[C@H]1c1cccs1 ZINC000434152912 860149346 /nfs/dbraw/zinc/14/93/46/860149346.db2.gz KUCJVWITJMJNGL-JTSKRJEESA-N 0 3 423.538 4.151 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N3CCC(OCC4CCCC4)CC3)cc2)CC1 ZINC000434156778 860151826 /nfs/dbraw/zinc/15/18/26/860151826.db2.gz GNNCNJYCULRASY-UHFFFAOYSA-N 0 3 413.606 4.028 20 0 HIADHN Cc1nc(-c2ccccc2Br)sc1[C@H](C)NC(=O)CN(C)C(C)C ZINC000467714723 881513629 /nfs/dbraw/zinc/51/36/29/881513629.db2.gz JJFOAUOCCDUKRX-LBPRGKRZSA-N 0 3 410.381 4.398 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N3CCCCC[C@H]3CC(=O)c3ccco3)cc2)CC1 ZINC000434258869 860236198 /nfs/dbraw/zinc/23/61/98/860236198.db2.gz ZLCXDQNGZZKQAH-QFIPXVFZSA-N 0 3 423.557 4.079 20 0 HIADHN CC[C@H](OC1CCCC1)C(=O)Nc1c(C)cnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000434314905 860275863 /nfs/dbraw/zinc/27/58/63/860275863.db2.gz HSPLDQGZDHLGHT-UNMCSNQZSA-N 0 3 410.562 4.315 20 0 HIADHN COc1ccc(C)cc1CC(=O)Nc1c(C)cnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000434315327 860276282 /nfs/dbraw/zinc/27/62/82/860276282.db2.gz BTQOBYCLRSZIOY-JOCHJYFZSA-N 0 3 418.541 4.137 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1cccc2ncccc21 ZINC000434327975 860289427 /nfs/dbraw/zinc/28/94/27/860289427.db2.gz SUEDPUPGLKMARH-HXUWFJFHSA-N 0 3 411.509 4.439 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)[C@H](C)OCc1ccccc1 ZINC000434328713 860290450 /nfs/dbraw/zinc/29/04/50/860290450.db2.gz VXJKNAFQXZCEIY-REWPJTCUSA-N 0 3 418.541 4.182 20 0 HIADHN CCC(=O)c1ccc(C(=O)Nc2c(C)cnn2[C@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000434330178 860292100 /nfs/dbraw/zinc/29/21/00/860292100.db2.gz JVBUKMLDYAQCKY-QFIPXVFZSA-N 0 3 416.525 4.484 20 0 HIADHN COc1cc(C(=O)Nc2c(C)cnn2[C@H]2CCN(Cc3ccccc3)C2)ccc1F ZINC000434330087 860292241 /nfs/dbraw/zinc/29/22/41/860292241.db2.gz IUAKFXVQPMMOBL-IBGZPJMESA-N 0 3 408.477 4.039 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1ccn(C2CCCC2)n1 ZINC000434334159 860296840 /nfs/dbraw/zinc/29/68/40/860296840.db2.gz IMUCXNXLASWYIO-OAQYLSRUSA-N 0 3 418.545 4.202 20 0 HIADHN COC(=O)C[C@H](NC(=O)c1cccc(CN2CCCC2)c1)c1ccc(Cl)c(F)c1 ZINC000434434895 860350603 /nfs/dbraw/zinc/35/06/03/860350603.db2.gz NAMSMZSKYCITGI-FQEVSTJZSA-N 0 3 418.896 4.109 20 0 HIADHN CCCC(O)(CCC)CC(=O)Nc1c(C)cnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000434549188 860396223 /nfs/dbraw/zinc/39/62/23/860396223.db2.gz MUXFVBKVMIWMJW-OAQYLSRUSA-N 0 3 412.578 4.298 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)CCc3cccc(OC(C)(C)C)n3)c(C)c2)CC1 ZINC000467734549 881536847 /nfs/dbraw/zinc/53/68/47/881536847.db2.gz IBVPKPRBXWHVHS-UHFFFAOYSA-N 0 3 424.589 4.281 20 0 HIADHN COc1cccc(OC)c1OC1CCN(CCC(=O)Nc2cccc(F)c2C)CC1 ZINC000434657487 860449345 /nfs/dbraw/zinc/44/93/45/860449345.db2.gz SOPRPPOWLBOMKF-UHFFFAOYSA-N 0 3 416.493 4.023 20 0 HIADHN O=C(NCc1ccco1)c1cccc(CN2CCC(c3ncc4n3CCCC4)CC2)c1 ZINC000434662915 860450166 /nfs/dbraw/zinc/45/01/66/860450166.db2.gz NSGOQZBVHFVOAO-UHFFFAOYSA-N 0 3 418.541 4.122 20 0 HIADHN C[C@H](C(=O)N[C@@H](C)c1cc2ccccc2o1)N1CCC(c2ncc3n2CCCC3)CC1 ZINC000434685072 860459383 /nfs/dbraw/zinc/45/93/83/860459383.db2.gz MGCYMKRDZUKIEF-ZWKOTPCHSA-N 0 3 420.557 4.411 20 0 HIADHN CCc1ccc([C@H](C)NC(=O)[C@@H](C)N2CCC(c3ncc4n3CCCC4)CC2)cc1 ZINC000434685285 860459467 /nfs/dbraw/zinc/45/94/67/860459467.db2.gz NILGVDYQSUKOIH-RBUKOAKNSA-N 0 3 408.590 4.227 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)c2csc(-c3ccc(Cl)s3)n2)C[C@@H](C)O1 ZINC000434757041 860483189 /nfs/dbraw/zinc/48/31/89/860483189.db2.gz FCTDVCDIBPGMFZ-CHWSQXEVSA-N 0 3 413.996 4.144 20 0 HIADHN FC(F)Oc1ccc(Br)cc1CNCCOCC(F)(F)C(F)F ZINC000434795137 860496634 /nfs/dbraw/zinc/49/66/34/860496634.db2.gz OYPCYCUYNUWCQI-UHFFFAOYSA-N 0 3 410.152 4.057 20 0 HIADHN COc1cccc(CN(CCC(=O)Nc2cccc(F)c2C)C[C@@H]2CCCO2)c1 ZINC000434833350 860512635 /nfs/dbraw/zinc/51/26/35/860512635.db2.gz JUVFIXAWZNNFDN-FQEVSTJZSA-N 0 3 400.494 4.153 20 0 HIADHN O=C(CCN1CCC[C@@H](c2nc(C(F)(F)F)cs2)C1)NCC1CCCCC1 ZINC000434883085 860533779 /nfs/dbraw/zinc/53/37/79/860533779.db2.gz LARQTWIXHHIMKG-OAHLLOKOSA-N 0 3 403.514 4.428 20 0 HIADHN CCN1CCN(Cc2ccc(CN[C@@H](C)c3nc(C(F)(F)F)cs3)cc2)CC1 ZINC000467748520 881553760 /nfs/dbraw/zinc/55/37/60/881553760.db2.gz YVQJWRKIXIPHEV-HNNXBMFYSA-N 0 3 412.525 4.150 20 0 HIADHN CC(=O)NC[C@H]1CCCN(Cc2cn(Cc3ccccc3)nc2-c2cccs2)C1 ZINC000434990333 860587909 /nfs/dbraw/zinc/58/79/09/860587909.db2.gz GRRVLGKZJYPVOD-HXUWFJFHSA-N 0 3 408.571 4.008 20 0 HIADHN CSc1nc(-c2ccco2)nc(C)c1C(=O)N[C@@H]1C[C@@H](C)N(Cc2ccccc2)C1 ZINC000467751271 881559933 /nfs/dbraw/zinc/55/99/33/881559933.db2.gz AQMNYZCQIYZIGZ-CRAIPNDOSA-N 0 3 422.554 4.160 20 0 HIADHN COc1cccc([C@H](CNC(=O)CCc2ccc(Cl)c(OC)c2)N2CCCC2)c1 ZINC000435053365 860617137 /nfs/dbraw/zinc/61/71/37/860617137.db2.gz PVJZNPHXSYAGGK-NRFANRHFSA-N 0 3 416.949 4.243 20 0 HIADHN CCc1cc(C)cc(CC)c1NC(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000435173469 860677698 /nfs/dbraw/zinc/67/76/98/860677698.db2.gz LWCBPVBGRBCQSM-UHFFFAOYSA-N 0 3 409.574 4.398 20 0 HIADHN CCOC(=O)[C@H]1CCCN(Cc2cccc(NC(=O)c3ccccc3Cl)c2)C1 ZINC000435246083 860702481 /nfs/dbraw/zinc/70/24/81/860702481.db2.gz PKMWJIJKZYVMTL-KRWDZBQOSA-N 0 3 400.906 4.367 20 0 HIADHN COc1cc(CN2CCC[C@@H](CO)C2)ccc1OCc1ccc(Br)cc1 ZINC000435245221 860702556 /nfs/dbraw/zinc/70/25/56/860702556.db2.gz LDORPBGTPODFCD-GOSISDBHSA-N 0 3 420.347 4.241 20 0 HIADHN Cc1cc(C)n([C@@H](C)CC(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435269411 860709647 /nfs/dbraw/zinc/70/96/47/860709647.db2.gz IHCPFTBHYATNLH-UNMCSNQZSA-N 0 3 420.561 4.042 20 0 HIADHN CCOc1ccc(CC(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000435274341 860712339 /nfs/dbraw/zinc/71/23/39/860712339.db2.gz IIVFQNFPXZMMTK-QFIPXVFZSA-N 0 3 418.541 4.218 20 0 HIADHN Cc1cc(NC(=O)[C@@H](C)Oc2ccc(F)cc2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435276607 860713225 /nfs/dbraw/zinc/71/32/25/860713225.db2.gz ZUCJOEMJPAXHQS-WIYYLYMNSA-N 0 3 422.504 4.184 20 0 HIADHN Cc1cc(NC(=O)[C@@H]2Cc3ccccc3S2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435277316 860714268 /nfs/dbraw/zinc/71/42/68/860714268.db2.gz BGMIEZLVXMFSMI-IRLDBZIGSA-N 0 3 418.566 4.294 20 0 HIADHN CCc1ccc(CC(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000435280223 860716175 /nfs/dbraw/zinc/71/61/75/860716175.db2.gz MXGCOIJIGDKWNZ-QHCPKHFHSA-N 0 3 402.542 4.382 20 0 HIADHN Cc1cc(NC(=O)[C@H](C)Oc2cccc(F)c2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435292779 860722409 /nfs/dbraw/zinc/72/24/09/860722409.db2.gz ZXBYQINKFWWBSA-GHTZIAJQSA-N 0 3 422.504 4.184 20 0 HIADHN Cc1cc(NC(=O)C2(c3ccccc3)CC2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435294032 860723173 /nfs/dbraw/zinc/72/31/73/860723173.db2.gz FPSOQSFUAJKPFD-QFIPXVFZSA-N 0 3 400.526 4.309 20 0 HIADHN CC(C)c1noc(-c2ccccc2C(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)n1 ZINC000467757139 881573167 /nfs/dbraw/zinc/57/31/67/881573167.db2.gz XAUYHMLMPHNUOJ-PKOBYXMFSA-N 0 3 404.514 4.253 20 0 HIADHN Cc1ccc(OCCC(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)c(C)c1 ZINC000435368423 860765818 /nfs/dbraw/zinc/76/58/18/860765818.db2.gz HXPUOHNEMXGZHZ-QFIPXVFZSA-N 0 3 418.541 4.355 20 0 HIADHN CCSc1cc(C(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)ccn1 ZINC000435368547 860765971 /nfs/dbraw/zinc/76/59/71/860765971.db2.gz BCTFUHWZGVJONK-IBGZPJMESA-N 0 3 407.543 4.089 20 0 HIADHN CCCOc1cccc(C(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000435369567 860767044 /nfs/dbraw/zinc/76/70/44/860767044.db2.gz FDISGRMMYNKJLG-NRFANRHFSA-N 0 3 404.514 4.371 20 0 HIADHN COc1ccccc1[C@@H](C)CC(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435369478 860767300 /nfs/dbraw/zinc/76/73/00/860767300.db2.gz FOGJBRQRACFRTO-PZJWPPBQSA-N 0 3 418.541 4.471 20 0 HIADHN COc1ccccc1[C@@H](C)CC(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435369475 860767353 /nfs/dbraw/zinc/76/73/53/860767353.db2.gz FOGJBRQRACFRTO-FPOVZHCZSA-N 0 3 418.541 4.471 20 0 HIADHN O=C(Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)c1csc(-c2ccoc2)n1 ZINC000435370460 860768353 /nfs/dbraw/zinc/76/83/53/860768353.db2.gz PLISVWFMADSBRB-SFHVURJKSA-N 0 3 419.510 4.299 20 0 HIADHN COc1ccc([C@@H](C)CC(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000435371616 860769760 /nfs/dbraw/zinc/76/97/60/860769760.db2.gz NZSLIKDTCFDUSN-UGKGYDQZSA-N 0 3 418.541 4.471 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)c1ccccc1OC(F)F ZINC000435372654 860770751 /nfs/dbraw/zinc/77/07/51/860770751.db2.gz AZHWOELTKZDYRX-QGZVFWFLSA-N 0 3 412.440 4.184 20 0 HIADHN O=C(CCCOc1ccc(F)cc1)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435372093 860770817 /nfs/dbraw/zinc/77/08/17/860770817.db2.gz ZEUUISLUQTUKKI-NRFANRHFSA-N 0 3 422.504 4.267 20 0 HIADHN Cc1cc(C(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)c2ccccc2n1 ZINC000435373327 860771699 /nfs/dbraw/zinc/77/16/99/860771699.db2.gz DOFHVVWWTPAHRK-HXUWFJFHSA-N 0 3 411.509 4.439 20 0 HIADHN CC(C)COc1ncccc1C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435377518 860774989 /nfs/dbraw/zinc/77/49/89/860774989.db2.gz CMAVSZAJNLXJBZ-FQEVSTJZSA-N 0 3 419.529 4.012 20 0 HIADHN O=C(C[C@@H]1CCOc2ccccc21)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435378681 860775610 /nfs/dbraw/zinc/77/56/10/860775610.db2.gz FTEWYCJMWAKHHG-LEWJYISDSA-N 0 3 416.525 4.225 20 0 HIADHN COc1cccc([C@H](C)CC(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000435381604 860777739 /nfs/dbraw/zinc/77/77/39/860777739.db2.gz UXOCIDIAPDJXOA-DENIHFKCSA-N 0 3 418.541 4.471 20 0 HIADHN CC(C)(CNC(=O)N1CCC(OCC2CCCC2)CC1)N1CCc2ccccc2C1 ZINC000435389890 860782064 /nfs/dbraw/zinc/78/20/64/860782064.db2.gz MYVAMTRGACRHDC-UHFFFAOYSA-N 0 3 413.606 4.204 20 0 HIADHN CC[C@H](CNC(=O)N1CCC(OCC2CCCC2)CC1)N1CCc2ccccc2C1 ZINC000435402975 860785976 /nfs/dbraw/zinc/78/59/76/860785976.db2.gz SMSITLVUSLKVSA-HSZRJFAPSA-N 0 3 413.606 4.204 20 0 HIADHN C[C@@H]1CC[C@@H](C)N1[C@@H]1CCCN(S(=O)(=O)c2c(Cl)cc(F)cc2Cl)C1 ZINC000435423284 860795433 /nfs/dbraw/zinc/79/54/33/860795433.db2.gz SJBMWTKMQXQIDL-YRGRVCCFSA-N 0 3 409.354 4.158 20 0 HIADHN C[S@@](=O)c1ccc(CC(=O)N2CCN(Cc3ccccc3)C3(CCCCC3)C2)cc1 ZINC000435453061 860804051 /nfs/dbraw/zinc/80/40/51/860804051.db2.gz RJLYDVVMYKTDKB-SSEXGKCCSA-N 0 3 424.610 4.014 20 0 HIADHN Cc1cc(NC(=O)N(C)[C@H](C)c2cccnc2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435511173 860829376 /nfs/dbraw/zinc/82/93/76/860829376.db2.gz LXKOWHHILFWEPL-KNQAVFIVSA-N 0 3 418.545 4.258 20 0 HIADHN Cc1cc(NC(=O)N2CCC(C(F)F)CC2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435512239 860830281 /nfs/dbraw/zinc/83/02/81/860830281.db2.gz VPFRXSIDSPFOAI-IBGZPJMESA-N 0 3 417.504 4.148 20 0 HIADHN Cc1cc(NC(=O)N[C@@H](C)Cc2cccs2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435518083 860836175 /nfs/dbraw/zinc/83/61/75/860836175.db2.gz SHDMCBCPMXBZPR-PXNSSMCTSA-N 0 3 423.586 4.453 20 0 HIADHN Cc1cc(NC(=O)NCc2cccc(F)c2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435518074 860836236 /nfs/dbraw/zinc/83/62/36/860836236.db2.gz SGKWJBUMMBGDTH-NRFANRHFSA-N 0 3 407.493 4.099 20 0 HIADHN Cc1cc(NC(=O)N2CCC[C@@H]3CCC[C@@H]32)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435518207 860836252 /nfs/dbraw/zinc/83/62/52/860836252.db2.gz ZWGKZXVQBFJIKR-FKBYEOEOSA-N 0 3 407.562 4.435 20 0 HIADHN Cc1cc(NC(=O)N2CCC[C@@H]3CCC[C@H]32)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435518206 860836685 /nfs/dbraw/zinc/83/66/85/860836685.db2.gz ZWGKZXVQBFJIKR-FDFHNCONSA-N 0 3 407.562 4.435 20 0 HIADHN CSCC[C@H](C)N(C)C(=O)Nc1cc(C)nn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435527800 860843468 /nfs/dbraw/zinc/84/34/68/860843468.db2.gz NOBAGJXEPQQBCG-ICSRJNTNSA-N 0 3 415.607 4.244 20 0 HIADHN COc1cc(NC(C)=O)ccc1NC(=O)NC[C@H](c1ccccc1)N1CCC(C)CC1 ZINC000435545650 860860196 /nfs/dbraw/zinc/86/01/96/860860196.db2.gz XIAFGBIBJUCDJJ-JOCHJYFZSA-N 0 3 424.545 4.248 20 0 HIADHN Cc1c(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2F)cnn1-c1ccccc1 ZINC000435548027 860862951 /nfs/dbraw/zinc/86/29/51/860862951.db2.gz AVTGVNYMFBQJAN-UHFFFAOYSA-N 0 3 413.472 4.055 20 0 HIADHN CS[C@H]1CN(C(=O)c2c(C)onc2-c2cccc(Cl)c2Cl)C[C@H]1N(C)C ZINC000435800614 861068879 /nfs/dbraw/zinc/06/88/79/861068879.db2.gz TWWNHVKPSHBPPD-KGLIPLIRSA-N 0 3 414.358 4.074 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3cc(C)cc4c[nH]nc43)c(OCC)c2)CC1 ZINC000435825339 861090363 /nfs/dbraw/zinc/09/03/63/861090363.db2.gz KQYKFFXLQOQGBC-UHFFFAOYSA-N 0 3 421.545 4.054 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(Br)cc1)C(=O)N[C@H]1CCOc2ccccc21 ZINC000435881002 861139024 /nfs/dbraw/zinc/13/90/24/861139024.db2.gz MYTXNSTWHUBTOF-IYOUNJFTSA-N 0 3 403.320 4.128 20 0 HIADHN Cc1c(NC(=O)N(CCN(C)C)Cc2cccs2)cnn1-c1cc(C)ccc1C ZINC000437808379 863132537 /nfs/dbraw/zinc/13/25/37/863132537.db2.gz XMSDRLHBYSXCID-UHFFFAOYSA-N 0 3 411.575 4.455 20 0 HIADHN COc1cc(Oc2ccccc2)ccc1NC(=O)N(CCN(C)C)C[C@H]1CCCO1 ZINC000437875275 863236223 /nfs/dbraw/zinc/23/62/23/863236223.db2.gz VITAQDMAATVDSQ-HXUWFJFHSA-N 0 3 413.518 4.062 20 0 HIADHN CC(=O)Nc1ccc(Cl)c(NC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)c1 ZINC000437882581 863245467 /nfs/dbraw/zinc/24/54/67/863245467.db2.gz QUZVFXJLJXIWGW-INIZCTEOSA-N 0 3 414.937 4.427 20 0 HIADHN Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)NC[C@@H](C)CN1CCN(C)CC1 ZINC000437990799 863352795 /nfs/dbraw/zinc/35/27/95/863352795.db2.gz XKZIMPGXUOFYIV-TZIWHRDSSA-N 0 3 424.589 4.140 20 0 HIADHN C[C@H]1CCCCN1CCNC(=O)c1cc(COc2c(Cl)cccc2Cl)on1 ZINC000467824383 881655550 /nfs/dbraw/zinc/65/55/50/881655550.db2.gz KSIUWYFJHICYDL-ZDUSSCGKSA-N 0 3 412.317 4.165 20 0 HIADHN CCSc1ccc(Cl)cc1C(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000438067864 863448107 /nfs/dbraw/zinc/44/81/07/863448107.db2.gz QPWBIQKNUSBUMQ-HZPDHXFCSA-N 0 3 411.011 4.413 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)N1CC[C@@H](Cc2ccccc2)C1 ZINC000438076926 863465757 /nfs/dbraw/zinc/46/57/57/863465757.db2.gz DTMULYYFKKZWAY-QFIPXVFZSA-N 0 3 409.599 4.374 20 0 HIADHN Cc1ccc(O[C@@H](C)CNC(=O)Nc2ccc(CCN3CCSCC3)cc2)cc1 ZINC000438100475 863508712 /nfs/dbraw/zinc/50/87/12/863508712.db2.gz CTWPMZJTYBYIOE-IBGZPJMESA-N 0 3 413.587 4.175 20 0 HIADHN CCCCOC1CCN(C(=O)Nc2ccc(CCN3CCSCC3)cc2)CC1 ZINC000438105940 863520249 /nfs/dbraw/zinc/52/02/49/863520249.db2.gz RJHSUZKQEQVBJQ-UHFFFAOYSA-N 0 3 405.608 4.091 20 0 HIADHN CC(=O)Nc1cccc(C(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)c1C ZINC000467836642 881671062 /nfs/dbraw/zinc/67/10/62/881671062.db2.gz PKHMJOISUKKYFP-UHFFFAOYSA-N 0 3 421.463 4.176 20 0 HIADHN C[C@H](N[C@H](Cc1ccccc1)C(=O)N1CCCC1)c1cccc(Br)c1 ZINC000467847101 881693861 /nfs/dbraw/zinc/69/38/61/881693861.db2.gz UXCAPAWUUPJGAJ-OXJNMPFZSA-N 0 3 401.348 4.333 20 0 HIADHN Cc1cc(-c2nc3cc(F)ccc3n2C)ccc1NC(=O)N1CC[C@@H](N2CC=CC2)C1 ZINC000438295834 863773125 /nfs/dbraw/zinc/77/31/25/863773125.db2.gz RSMITENSZOLFSZ-LJQANCHMSA-N 0 3 419.504 4.166 20 0 HIADHN CCOC(=O)CCc1ccc(NC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)cc1 ZINC000438303322 863782684 /nfs/dbraw/zinc/78/26/84/863782684.db2.gz XDAQHXLULOUQBN-HXUWFJFHSA-N 0 3 423.557 4.311 20 0 HIADHN CN(C(=O)N[C@H]1C[C@@H]1c1ccccc1OC(F)F)[C@H]1CCN(Cc2ccccc2)C1 ZINC000438406071 863851913 /nfs/dbraw/zinc/85/19/13/863851913.db2.gz YGAYOSXEYSQMLS-SXLOBPIMSA-N 0 3 415.484 4.060 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)N[C@H]1C[C@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000438415090 863855149 /nfs/dbraw/zinc/85/51/49/863855149.db2.gz YATNJEYOZVJSKD-IRJFHVNHSA-N 0 3 420.479 4.120 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)N[C@H]1C[C@H](c2cccc(C(F)(F)F)c2)C1 ZINC000438431091 863862287 /nfs/dbraw/zinc/86/22/87/863862287.db2.gz ZPBNCMLUHLZGBU-IRJFHVNHSA-N 0 3 420.479 4.120 20 0 HIADHN CCc1c(C(=O)CN(C)[C@@H]2CCN(Cc3ccccc3)[C@@H](C)C2)[nH]c(C)c1C(C)=O ZINC000438454295 863878677 /nfs/dbraw/zinc/87/86/77/863878677.db2.gz JNKTZJJGDOVXEP-LAUBAEHRSA-N 0 3 409.574 4.256 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)c1cc2ccc(OC(F)(F)F)cc2[nH]1 ZINC000438465084 863887404 /nfs/dbraw/zinc/88/74/04/863887404.db2.gz ZQSWBSPNYMKUFX-UHFFFAOYSA-N 0 3 411.449 4.332 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)c1cnc(Cc2ccc(F)cc2)s1 ZINC000438471384 863891064 /nfs/dbraw/zinc/89/10/64/863891064.db2.gz SBVLXDXOYAJGOD-UHFFFAOYSA-N 0 3 403.548 4.139 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)Nc2cccc(CSC(C)C)c2C)CC1 ZINC000438472593 863891923 /nfs/dbraw/zinc/89/19/23/863891923.db2.gz ZAEPXLSVDGGINT-GOSISDBHSA-N 0 3 406.640 4.032 20 0 HIADHN Cc1cc(NC(=O)N2CCC(CN3C[C@@H](C)O[C@H](C)C3)CC2)ccc1C(F)(F)F ZINC000438527179 863951836 /nfs/dbraw/zinc/95/18/36/863951836.db2.gz CARVGPLKJNTZQN-HZPDHXFCSA-N 0 3 413.484 4.367 20 0 HIADHN Cc1cc(NC(=O)N2CCC(CN3C[C@H](C)O[C@@H](C)C3)CC2)ccc1C(F)(F)F ZINC000438527178 863952458 /nfs/dbraw/zinc/95/24/58/863952458.db2.gz CARVGPLKJNTZQN-HOTGVXAUSA-N 0 3 413.484 4.367 20 0 HIADHN O=C(NC1CCC2(CCOCC2)CC1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000438529498 863953505 /nfs/dbraw/zinc/95/35/05/863953505.db2.gz SYSREHLJFRVUMC-QFIPXVFZSA-N 0 3 424.507 4.297 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)c1ccn(-c2cccc(C(F)(F)F)c2)n1 ZINC000438531338 863957673 /nfs/dbraw/zinc/95/76/73/863957673.db2.gz NGMFDRRVSBNQCD-UHFFFAOYSA-N 0 3 422.476 4.157 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)c2ccc(CNC(=O)C(C)(C)C)cc2)CC1 ZINC000438554564 863986269 /nfs/dbraw/zinc/98/62/69/863986269.db2.gz AFGRQSIVERRGAC-UHFFFAOYSA-N 0 3 421.585 4.086 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Nc1ccc(C(=O)NC2CCCC2)cc1 ZINC000438620409 864045666 /nfs/dbraw/zinc/04/56/66/864045666.db2.gz NEMLNNRZVVTYBD-UHFFFAOYSA-N 0 3 414.575 4.016 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Nc1cccc(Cl)c1-n1cccn1 ZINC000438627608 864055591 /nfs/dbraw/zinc/05/55/91/864055591.db2.gz RCNJAZDROHHWSD-UHFFFAOYSA-N 0 3 403.939 4.183 20 0 HIADHN CCOc1cc(C)ccc1NC(=O)C(=O)N(CC)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000438665203 864115786 /nfs/dbraw/zinc/11/57/86/864115786.db2.gz CINGLMUYVSDZRC-FPOVZHCZSA-N 0 3 423.557 4.016 20 0 HIADHN CCN(C(=O)C(=O)Nc1cccc(C(F)F)c1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000438665440 864118083 /nfs/dbraw/zinc/11/80/83/864118083.db2.gz QALKOEPFAQDSID-OXQOHEQNSA-N 0 3 415.484 4.247 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)Nc2ccc(-c3csnn3)cc2)CC1 ZINC000438687358 864152713 /nfs/dbraw/zinc/15/27/13/864152713.db2.gz QOQLNPHISVEORQ-UHFFFAOYSA-N 0 3 407.543 4.333 20 0 HIADHN CC(C)(C)C(=O)c1ccc(NC(=O)NCc2ccccc2CN2CCC(O)CC2)cc1 ZINC000438769537 864264554 /nfs/dbraw/zinc/26/45/54/864264554.db2.gz FUQCBEKCFTTYOR-UHFFFAOYSA-N 0 3 423.557 4.194 20 0 HIADHN Cc1ccc2[nH]c3c(c2c1)CCC[C@@H]3NCc1cccc(NC(=O)Cn2cccn2)c1 ZINC000438834312 864327906 /nfs/dbraw/zinc/32/79/06/864327906.db2.gz IAPGILVTBVNOCZ-QHCPKHFHSA-N 0 3 413.525 4.479 20 0 HIADHN COc1cc(NC(C)=O)ccc1[C@@H](C)N[C@@H]1CCN(c2ccccc2OC(F)F)C1 ZINC000438987661 864448758 /nfs/dbraw/zinc/44/87/58/864448758.db2.gz PTPRDGPVBPKIIW-RHSMWYFYSA-N 0 3 419.472 4.185 20 0 HIADHN C[C@@H]1CC[C@H](O)[C@H]([C@@H]2CCCCN2CC(=O)Nc2ccc(Br)cc2)C1 ZINC000438993440 864451892 /nfs/dbraw/zinc/45/18/92/864451892.db2.gz KHLGGZFQBOVTPY-FCLVOEFKSA-N 0 3 409.368 4.039 20 0 HIADHN COc1ccc([C@@H](NC(=O)CN(C)C2CCN(c3ccccc3)CC2)C(C)C)cc1 ZINC000439016630 864467746 /nfs/dbraw/zinc/46/77/46/864467746.db2.gz FBLVEKZEJQZZQW-VWLOTQADSA-N 0 3 409.574 4.109 20 0 HIADHN COC(=O)[C@H](NC1CCN([C@H](C)c2ccncc2)CC1)c1ccc(Cl)cc1Cl ZINC000439064378 864514512 /nfs/dbraw/zinc/51/45/12/864514512.db2.gz OXMHOGBZTAMLKN-JLTOFOAXSA-N 0 3 422.356 4.418 20 0 HIADHN CS(=O)(=O)Nc1ccc(CN[C@@H](c2ccc(Br)s2)C2CC2)cc1 ZINC000439141100 864574323 /nfs/dbraw/zinc/57/43/23/864574323.db2.gz RGTXMFVVRVQVKI-MRXNPFEDSA-N 0 3 415.378 4.123 20 0 HIADHN CN(C)CCN(C(=O)Nc1cc(Cl)ccc1OC[C@@H]1CCCO1)C1CCCC1 ZINC000467912932 881780195 /nfs/dbraw/zinc/78/01/95/881780195.db2.gz XHOBGMPATYAMBF-SFHVURJKSA-N 0 3 409.958 4.236 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)NCc1cc(Cl)ccc1OC(F)F ZINC000439255539 864672381 /nfs/dbraw/zinc/67/23/81/864672381.db2.gz AUIXNZAXVUVHQG-UHFFFAOYSA-N 0 3 417.909 4.276 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)Nc1nc(-c2ccc(O)cc2)cs1 ZINC000439527044 864864096 /nfs/dbraw/zinc/86/40/96/864864096.db2.gz JGZXTTGFHGIPBD-UHFFFAOYSA-N 0 3 422.554 4.057 20 0 HIADHN CC(C)Oc1ccc([C@H](C)N[C@@H](C)C(=O)N2CCN(c3ccc(F)cc3)CC2)cc1 ZINC000439565852 864890259 /nfs/dbraw/zinc/89/02/59/864890259.db2.gz CCMMCGMCWLHVGF-OALUTQOASA-N 0 3 413.537 4.001 20 0 HIADHN Cc1ccc(NC(=O)[C@H](C)NCc2ccccc2CN(C)Cc2ccco2)cc1F ZINC000439592800 864914816 /nfs/dbraw/zinc/91/48/16/864914816.db2.gz HVKHEVJIPCZBEC-SFHVURJKSA-N 0 3 409.505 4.476 20 0 HIADHN Cc1ccc(F)cc1NC(=O)[C@H](C)NCc1ccccc1CN(C)Cc1ccco1 ZINC000439608689 864930738 /nfs/dbraw/zinc/93/07/38/864930738.db2.gz BABPMSYVXKQKFH-SFHVURJKSA-N 0 3 409.505 4.476 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)NC[C@@H]1CCC[C@H](C(F)(F)F)C1 ZINC000439627333 864952468 /nfs/dbraw/zinc/95/24/68/864952468.db2.gz DTKOKQWDTCEBFI-WBVHZDCISA-N 0 3 403.464 4.268 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)NC[C@@H]1CCC[C@H](C(F)(F)F)C1 ZINC000439631113 864957242 /nfs/dbraw/zinc/95/72/42/864957242.db2.gz DGRQSOFPUBNFBA-ZBFHGGJFSA-N 0 3 421.454 4.407 20 0 HIADHN CC(=O)Nc1cccc(NC(=O)[C@H](C)NCC(C)(C)c2c(F)cccc2Cl)c1 ZINC000439650167 864976511 /nfs/dbraw/zinc/97/65/11/864976511.db2.gz RTBCKTYCPUSFDB-ZDUSSCGKSA-N 0 3 405.901 4.332 20 0 HIADHN CCOc1ccccc1NC(=O)[C@H](NCC1(SC)CCOCC1)c1ccccc1 ZINC000439649696 864976791 /nfs/dbraw/zinc/97/67/91/864976791.db2.gz XPAKXPNOLRGTTB-OAQYLSRUSA-N 0 3 414.571 4.267 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)NCc3cccc(-c4ccccn4)c3)cc2)CC1 ZINC000439656505 864982120 /nfs/dbraw/zinc/98/21/20/864982120.db2.gz SEMJIMLTVKCRQU-UHFFFAOYSA-N 0 3 414.553 4.209 20 0 HIADHN Cc1coc(-c2cccc(NC(=O)c3ccc(N4CCN(C(C)C)CC4)cc3)c2)n1 ZINC000467964994 881824150 /nfs/dbraw/zinc/82/41/50/881824150.db2.gz WGFVRMAYGCSQTK-UHFFFAOYSA-N 0 3 404.514 4.433 20 0 HIADHN Cc1cc(Cl)ccc1O[C@@H](C)C(=O)NC1CCN([C@@H](C)c2ccncc2)CC1 ZINC000439732267 865064095 /nfs/dbraw/zinc/06/40/95/865064095.db2.gz LRACXMSXVMHGSM-IRXDYDNUSA-N 0 3 401.938 4.153 20 0 HIADHN C[C@H](Oc1ccccc1C(F)(F)F)C(=O)NC1CCN([C@@H](C)c2ccncc2)CC1 ZINC000439732839 865064628 /nfs/dbraw/zinc/06/46/28/865064628.db2.gz BLLMCRUPVJJQOR-HOTGVXAUSA-N 0 3 421.463 4.210 20 0 HIADHN Cc1cc(Cl)ccc1O[C@@H](C)C(=O)NC1CCN([C@H](C)c2ccncc2)CC1 ZINC000439732268 865064990 /nfs/dbraw/zinc/06/49/90/865064990.db2.gz LRACXMSXVMHGSM-SJORKVTESA-N 0 3 401.938 4.153 20 0 HIADHN COc1cc(CCC(=O)NC2CCN([C@@H](C)c3ccncc3)CC2)ccc1Cl ZINC000439746396 865077476 /nfs/dbraw/zinc/07/74/76/865077476.db2.gz NBBGUTZYVBVFPQ-INIZCTEOSA-N 0 3 401.938 4.018 20 0 HIADHN O=C(CC(Cc1ccccc1)Cc1ccccc1)N1CCN(CC2CCOCC2)CC1 ZINC000439748743 865078916 /nfs/dbraw/zinc/07/89/16/865078916.db2.gz VDEKAEMMVJOPSL-UHFFFAOYSA-N 0 3 420.597 4.049 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)[C@H](OC2CCCC2)c2ccccc2)CC1 ZINC000439748110 865079097 /nfs/dbraw/zinc/07/90/97/865079097.db2.gz SXLCGKLVLBNDKC-YADARESESA-N 0 3 407.558 4.424 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)[C@@H](OC2CCCC2)c2ccccc2)CC1 ZINC000439748104 865079131 /nfs/dbraw/zinc/07/91/31/865079131.db2.gz SXLCGKLVLBNDKC-CYFREDJKSA-N 0 3 407.558 4.424 20 0 HIADHN Cc1cc(CCCC(=O)Nc2ccc(C(=O)NCCN3CCCC3)cc2)c(C)s1 ZINC000439751921 865082457 /nfs/dbraw/zinc/08/24/57/865082457.db2.gz PEYVXAWMMDUOJG-UHFFFAOYSA-N 0 3 413.587 4.152 20 0 HIADHN COc1ccc2c(c1)CCC[C@H]2CC(=O)NC1CCN([C@H](C)c2ccncc2)CC1 ZINC000439767583 865092675 /nfs/dbraw/zinc/09/26/75/865092675.db2.gz KQHUYXDGEMANFE-NQIIRXRSSA-N 0 3 407.558 4.242 20 0 HIADHN COc1ccc2c(c1)CCC[C@H]2CC(=O)NC1CCN([C@@H](C)c2ccncc2)CC1 ZINC000439767584 865092744 /nfs/dbraw/zinc/09/27/44/865092744.db2.gz KQHUYXDGEMANFE-RXVVDRJESA-N 0 3 407.558 4.242 20 0 HIADHN C[C@H](C(=O)Nc1ccc2oc(=O)n(CCN(C)C)c2c1)c1ccc2ccccc2c1 ZINC000439818163 865134033 /nfs/dbraw/zinc/13/40/33/865134033.db2.gz WJXYEWARMOCJGM-INIZCTEOSA-N 0 3 403.482 4.052 20 0 HIADHN CC(C)(C)Nc1ccccc1NC(=O)C(=O)NC[C@]1(C)CCCN1Cc1ccccc1 ZINC000439859115 865165970 /nfs/dbraw/zinc/16/59/70/865165970.db2.gz RCOWSJRWRFOFCC-VWLOTQADSA-N 0 3 422.573 4.006 20 0 HIADHN CCn1ncc(NC(=O)N(CCN(C)C)Cc2cccc(Cl)c2)c1C(F)(F)F ZINC000439874174 865186212 /nfs/dbraw/zinc/18/62/12/865186212.db2.gz BBKHOHFBCYPTST-UHFFFAOYSA-N 0 3 417.863 4.171 20 0 HIADHN CCn1ncc(NC(=O)NC[C@H](C(C)C)N2CCc3ccccc3C2)c1C(F)(F)F ZINC000439882371 865193776 /nfs/dbraw/zinc/19/37/76/865193776.db2.gz IQWKQXQHWGMLDW-GOSISDBHSA-N 0 3 423.483 4.126 20 0 HIADHN Cc1ccc(NC(=O)NC[C@@H]2CCCN([C@@H](C)C(=O)N3[C@H](C)CCC[C@@H]3C)C2)cc1 ZINC000439885182 865197991 /nfs/dbraw/zinc/19/79/91/865197991.db2.gz CCTMAIUIKFLXNX-WOZUAGRISA-N 0 3 414.594 4.007 20 0 HIADHN CC(C)(C)[C@@H](CN1CCc2ccccc2C1)NC(=O)Nc1ccc(N2CCC2=O)cc1 ZINC000439954173 865248045 /nfs/dbraw/zinc/24/80/45/865248045.db2.gz ZMKFQLNJYDUQPU-JOCHJYFZSA-N 0 3 420.557 4.018 20 0 HIADHN O=C(NCc1ccc(F)cc1)c1ccc(NC(=O)[C@@H]2CCCN2C2CCCC2)cc1 ZINC000440122574 865371544 /nfs/dbraw/zinc/37/15/44/865371544.db2.gz PWVWBFVVBDGJAB-QFIPXVFZSA-N 0 3 409.505 4.101 20 0 HIADHN CCCC(=O)Nc1cccc(NC(=O)c2ccc(N3CCN(CC)CC3)cc2)c1C ZINC000468035449 881866572 /nfs/dbraw/zinc/86/65/72/881866572.db2.gz BIGBIFNUKBIWBA-UHFFFAOYSA-N 0 3 408.546 4.128 20 0 HIADHN COc1ccc(NC(=O)C[C@@H](C)N[C@@H](C)c2cn(C(C)(C)C)nc2C)c(OC)c1 ZINC000468040156 881869617 /nfs/dbraw/zinc/86/96/17/881869617.db2.gz DZIYAQLVOZLQMJ-CABCVRRESA-N 0 3 402.539 4.032 20 0 HIADHN CC(C)N(CCN(C)C)C(=O)NCc1cn(Cc2ccccc2)nc1-c1ccccc1 ZINC000440203159 865433073 /nfs/dbraw/zinc/43/30/73/865433073.db2.gz PVWARQGSDJUHKJ-UHFFFAOYSA-N 0 3 419.573 4.080 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)NCc1cccc(-c2ccccn2)c1 ZINC000440233815 865468945 /nfs/dbraw/zinc/46/89/45/865468945.db2.gz AKBMEPANMSDGTI-UHFFFAOYSA-N 0 3 424.495 4.300 20 0 HIADHN C[C@H](NCc1cc2cc(Br)ccc2[nH]1)c1cccc(NS(C)(=O)=O)c1 ZINC000468047697 881874388 /nfs/dbraw/zinc/87/43/88/881874388.db2.gz LMGZENSFIYXCTK-LBPRGKRZSA-N 0 3 422.348 4.153 20 0 HIADHN C[C@@H](NCc1cc2cc(Br)ccc2[nH]1)c1cccc(NS(C)(=O)=O)c1 ZINC000468047696 881874541 /nfs/dbraw/zinc/87/45/41/881874541.db2.gz LMGZENSFIYXCTK-GFCCVEGCSA-N 0 3 422.348 4.153 20 0 HIADHN COc1ccc([C@@H](C)NC(=O)N(CCN(C)C)C2CCCC2)cc1Br ZINC000468054883 881878459 /nfs/dbraw/zinc/87/84/59/881878459.db2.gz LIIYRONGUHECQY-CQSZACIVSA-N 0 3 412.372 4.035 20 0 HIADHN C[C@@H](NC(=O)N(CCN(C)C)C1CCCC1)c1cccc(OCc2ccccn2)c1 ZINC000468055444 881879170 /nfs/dbraw/zinc/87/91/70/881879170.db2.gz SJDPPVCACDXVTJ-LJQANCHMSA-N 0 3 410.562 4.237 20 0 HIADHN Cc1ccc(C(=O)Nc2cccc(CNC(=O)N(CCN(C)C)C3CCCC3)c2)cc1 ZINC000468061129 881881398 /nfs/dbraw/zinc/88/13/98/881881398.db2.gz VAHUMSGVRZZUHO-UHFFFAOYSA-N 0 3 422.573 4.263 20 0 HIADHN Cc1c2ccc3ccccc3c2oc1C(=O)NC[C@@]1(O)CCN(Cc2ccccc2)C1 ZINC000440514455 865801753 /nfs/dbraw/zinc/80/17/53/865801753.db2.gz DTELGZNNZYPMMI-SANMLTNESA-N 0 3 414.505 4.261 20 0 HIADHN Cc1ccc(-c2ccc(C(=O)NC[C@]3(O)CCN(Cc4ccccc4)C3)c(F)c2)cc1 ZINC000440526852 865804960 /nfs/dbraw/zinc/80/49/60/865804960.db2.gz YWMHWRWOGJAFFZ-AREMUKBSSA-N 0 3 418.512 4.168 20 0 HIADHN Cc1ccc(/C=C\CC(=O)Nc2ccc(C(=O)N(C)[C@@H]3CCCN(C)C3)cc2)cc1 ZINC000440566774 865820578 /nfs/dbraw/zinc/82/05/78/865820578.db2.gz SDOIXDMLLYDCGN-GXOSZSFXSA-N 0 3 405.542 4.203 20 0 HIADHN COCc1ccc([C@H]2CCCN2C(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)o1 ZINC000468101664 881910894 /nfs/dbraw/zinc/91/08/94/881910894.db2.gz KQNWGAIRFSWGOL-FGZHOGPDSA-N 0 3 411.546 4.418 20 0 HIADHN COc1cc2c(cc1OC)CN(C(=O)CNC1(c3ccccc3)CCCCC1)CC2 ZINC000440922411 866018407 /nfs/dbraw/zinc/01/84/07/866018407.db2.gz XERFOGNSHFLKAD-UHFFFAOYSA-N 0 3 408.542 4.038 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)c2cn(Cc3ccccc3)nc2-c2cccs2)CN1C1CC1 ZINC000440932725 866030318 /nfs/dbraw/zinc/03/03/18/866030318.db2.gz ZXRPWYGFFJOBOH-AEFFLSMTSA-N 0 3 406.555 4.015 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)c2cn(Cc3ccccc3)nc2-c2cccs2)CN1C1CC1 ZINC000440932727 866030395 /nfs/dbraw/zinc/03/03/95/866030395.db2.gz ZXRPWYGFFJOBOH-FUHWJXTLSA-N 0 3 406.555 4.015 20 0 HIADHN C[C@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)NCCN1CCN(C)C(C)(C)C1 ZINC000440975245 866060054 /nfs/dbraw/zinc/06/00/54/866060054.db2.gz FOSRGKDATAZSFA-HXUWFJFHSA-N 0 3 408.590 4.082 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)CCc2nnc(-c3ccc(Cl)cc3)o2)C1 ZINC000468115643 881941421 /nfs/dbraw/zinc/94/14/21/881941421.db2.gz RSVDZDQGPNNNMJ-UZLBHIALSA-N 0 3 424.932 4.274 20 0 HIADHN CNC(=O)Cc1nc(CN2CCc3ccccc3[C@@H](c3ccccc3)[C@H]2C)cs1 ZINC000441063888 866147307 /nfs/dbraw/zinc/14/73/07/866147307.db2.gz HJGPLGBLAFEVQX-MZNJEOGPSA-N 0 3 405.567 4.010 20 0 HIADHN O=C1c2ccccc2C(=O)N1CCCN1CCC[C@H](c2nc(C(F)(F)F)cs2)C1 ZINC000441067377 866151671 /nfs/dbraw/zinc/15/16/71/866151671.db2.gz UJAZNOYWNIHEAE-ZDUSSCGKSA-N 0 3 423.460 4.028 20 0 HIADHN COc1cc(C)c(CN(C)Cc2ccc(I)cc2)cc1OC ZINC000441259296 866334536 /nfs/dbraw/zinc/33/45/36/866334536.db2.gz VCNYQJZADFIGSW-UHFFFAOYSA-N 0 3 411.283 4.249 20 0 HIADHN COCc1nc(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)c(-c2ccccc2)s1 ZINC000441278179 866353578 /nfs/dbraw/zinc/35/35/78/866353578.db2.gz MQGYMJUCAFTNDH-YLJYHZDGSA-N 0 3 421.566 4.207 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)c3ccncc3Oc3ccccc3)c2)CC1 ZINC000441282578 866358708 /nfs/dbraw/zinc/35/87/08/866358708.db2.gz HHFQBEUXKJZMKQ-UHFFFAOYSA-N 0 3 402.498 4.268 20 0 HIADHN CC[C@@](C)(COc1ncccc1Cl)NCC(=O)Nc1ccccc1OC(F)F ZINC000441304825 866377316 /nfs/dbraw/zinc/37/73/16/866377316.db2.gz HSZFBZRFIUJOOE-IBGZPJMESA-N 0 3 413.852 4.112 20 0 HIADHN CN1CCN(CCNC(=O)Nc2ccccc2-c2nc3ccccc3s2)CC1(C)C ZINC000441316382 866386880 /nfs/dbraw/zinc/38/68/80/866386880.db2.gz SFISUTFQFQLCRQ-UHFFFAOYSA-N 0 3 423.586 4.111 20 0 HIADHN COc1cc(CN(C)C(=O)N[C@H]2C[C@@H](C)N(C3CC3)C2)ccc1OCc1ccccc1 ZINC000441356999 866426849 /nfs/dbraw/zinc/42/68/49/866426849.db2.gz MWFRSVUNKPDOGN-NQIIRXRSSA-N 0 3 423.557 4.041 20 0 HIADHN COc1ccc(CN(C)C(=O)CN(C)[C@@H]2CCC[C@@H]2c2ccc(C)cc2)cc1OC ZINC000441361466 866431213 /nfs/dbraw/zinc/43/12/13/866431213.db2.gz SVFILEOIATZZDE-FGZHOGPDSA-N 0 3 410.558 4.239 20 0 HIADHN C[S@](=O)C1(CNCc2cc(Br)ccc2OCc2ccccc2)CC1 ZINC000441379987 866450359 /nfs/dbraw/zinc/45/03/59/866450359.db2.gz HAVAWGHTPZDDPC-DEOSSOPVSA-N 0 3 408.361 4.029 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)N(C)CCCCCc2cc(-c3ccccc3)no2)CN1C1CC1 ZINC000441394339 866466691 /nfs/dbraw/zinc/46/66/91/866466691.db2.gz OJMYVRPRBQAWQX-QUCCMNQESA-N 0 3 410.562 4.321 20 0 HIADHN Cc1nccn1CCCCNC(=O)N1CCC[C@@H]1c1nc2ccc(Cl)cc2[nH]1 ZINC000441492305 866575363 /nfs/dbraw/zinc/57/53/63/866575363.db2.gz PHBKNMIPLKAKPE-GOSISDBHSA-N 0 3 400.914 4.048 20 0 HIADHN CN1CCC(Oc2ccc(NC(=O)CC(C)(C)CC(=O)c3ccccc3)cn2)CC1 ZINC000441612460 866708945 /nfs/dbraw/zinc/70/89/45/866708945.db2.gz MQDQTIVNQTXFQD-UHFFFAOYSA-N 0 3 409.530 4.182 20 0 HIADHN CC(C)c1ccc([C@@H](NC(=O)CN(C)C2CCN(c3cccnn3)CC2)C(C)C)cc1 ZINC000468147377 882006699 /nfs/dbraw/zinc/00/66/99/882006699.db2.gz XYALHCUGADKVOH-VWLOTQADSA-N 0 3 423.605 4.014 20 0 HIADHN CC(C)c1nc2ccc(NC(=O)C(=O)N[C@H](C)[C@@H](c3ccccc3)N(C)C)cc2s1 ZINC000441694857 866808568 /nfs/dbraw/zinc/80/85/68/866808568.db2.gz QBMWVKNRUBJRTR-QRWLVFNGSA-N 0 3 424.570 4.166 20 0 HIADHN CC(C)Sc1c(Cl)cccc1NC(=O)C(=O)NC[C@H](C)N1CCC[C@@H](C)C1 ZINC000441777039 866851258 /nfs/dbraw/zinc/85/12/58/866851258.db2.gz OZEJOSTWWIUBKR-CABCVRRESA-N 0 3 411.999 4.016 20 0 HIADHN CC(C)Sc1c(Cl)cccc1NC(=O)C(=O)NCCN1[C@@H](C)CCC[C@@H]1C ZINC000441848600 866911557 /nfs/dbraw/zinc/91/15/57/866911557.db2.gz VAFRNPDKDUMTKB-GJZGRUSLSA-N 0 3 411.999 4.158 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CC[C@H](OC)C[C@@H]1C)c1ccc(C(F)(F)F)cc1 ZINC000441897535 866960641 /nfs/dbraw/zinc/96/06/41/866960641.db2.gz NNRULULPHMIJTO-ZYSHUDEJSA-N 0 3 415.500 4.297 20 0 HIADHN C[C@H](NC(=O)C(=O)Nc1ccc([C@H](C)Sc2ccccc2)cc1)C1=CCN(C)CC1 ZINC000442332674 867331034 /nfs/dbraw/zinc/33/10/34/867331034.db2.gz BEHPTNGWDZTVEG-ROUUACIJSA-N 0 3 423.582 4.245 20 0 HIADHN Cc1sc(Br)c(C(=O)Nc2cccc(CN3CCC(O)CC3)c2)c1C ZINC000442682449 867616965 /nfs/dbraw/zinc/61/69/65/867616965.db2.gz JLUQHOIGSMCMQK-UHFFFAOYSA-N 0 3 423.376 4.336 20 0 HIADHN Fc1cccc(CN2CCC[C@@H](c3nc(-c4ccc(OCC(F)F)cn4)no3)C2)c1 ZINC000442688808 867623035 /nfs/dbraw/zinc/62/30/35/867623035.db2.gz MMQBLMHIODCJRW-OAHLLOKOSA-N 0 3 418.419 4.294 20 0 HIADHN COCCC[C@@H](NCc1cccc(NC(=O)[C@H]2CCCO2)c1)c1ccc(F)cc1 ZINC000442789428 867676035 /nfs/dbraw/zinc/67/60/35/867676035.db2.gz GVNDQRFSXGACEM-FGZHOGPDSA-N 0 3 400.494 4.201 20 0 HIADHN CN(CC[C@@H]1CCCCO1)Cc1cccc(Br)c1OC[C@@H]1CCCO1 ZINC000442890728 867724069 /nfs/dbraw/zinc/72/40/69/867724069.db2.gz KXMVOJCZLZDPAU-ROUUACIJSA-N 0 3 412.368 4.398 20 0 HIADHN CCOc1ccccc1CN1CCN(C(=O)c2cccc(CN3CCCC3)c2)[C@H](C)C1 ZINC000442899884 867730327 /nfs/dbraw/zinc/73/03/27/867730327.db2.gz RAIBWEPTUFAXKM-OAQYLSRUSA-N 0 3 421.585 4.028 20 0 HIADHN C[C@H](CC(=O)Nc1ccccc1)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1 ZINC000442993485 867782737 /nfs/dbraw/zinc/78/27/37/867782737.db2.gz OHHPOJUGXRHSAB-AUSIDOKSSA-N 0 3 401.510 4.243 20 0 HIADHN O=C(C/C=C\c1ccc(F)cc1)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000443335967 867909622 /nfs/dbraw/zinc/90/96/22/867909622.db2.gz QKLHSEOFIDJNFW-UPHRSURJSA-N 0 3 400.469 4.028 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(F)cc2)CC1)[C@H]1C[C@@]12CCCc1ccccc12 ZINC000443341787 867913936 /nfs/dbraw/zinc/91/39/36/867913936.db2.gz JHEVLONZWQFHBO-AOYPEHQESA-N 0 3 422.544 4.079 20 0 HIADHN C[C@H](C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1)c1cc2ccccc2o1 ZINC000443343817 867917032 /nfs/dbraw/zinc/91/70/32/867917032.db2.gz GYIBYEIOMPAOAG-KRWDZBQOSA-N 0 3 410.489 4.335 20 0 HIADHN CO[C@H](C)c1noc(CN2CCCN([C@H](C)c3ccc(C(F)(F)F)cc3)CC2)n1 ZINC000468239357 882134097 /nfs/dbraw/zinc/13/40/97/882134097.db2.gz FOIAFAHREHPNJK-HUUCEWRRSA-N 0 3 412.456 4.065 20 0 HIADHN CN(C)[C@H](CNC(=O)Nc1cc(F)cc(F)c1Br)Cc1ccccc1 ZINC000443527907 868085987 /nfs/dbraw/zinc/08/59/87/868085987.db2.gz COFICBVMQNSXET-AWEZNQCLSA-N 0 3 412.278 4.022 20 0 HIADHN O=C(Nc1cc(F)cc(F)c1Br)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000443533318 868092396 /nfs/dbraw/zinc/09/23/96/868092396.db2.gz PPFPQVXBIIOYKR-CQSZACIVSA-N 0 3 410.262 4.123 20 0 HIADHN CCN1CCN(C(=O)CC2CCN([C@H]3CCc4c3cc(Cl)cc4Cl)CC2)CC1 ZINC000443610774 868174517 /nfs/dbraw/zinc/17/45/17/868174517.db2.gz QGVOKJNKPVLNHE-NRFANRHFSA-N 0 3 424.416 4.247 20 0 HIADHN O[C@H](COc1ccccc1Cl)CN1CCC[C@H](c2nc3ccc(F)cc3o2)C1 ZINC000443652197 868248632 /nfs/dbraw/zinc/24/86/32/868248632.db2.gz UACYNKYCRBYXBY-HOCLYGCPSA-N 0 3 404.869 4.240 20 0 HIADHN O=C(CCN1CCC[C@@H](Oc2ccccc2Cl)C1)N1CCc2sccc2C1 ZINC000443652044 868250336 /nfs/dbraw/zinc/25/03/36/868250336.db2.gz KRUZUSLDPSZEIM-QGZVFWFLSA-N 0 3 404.963 4.220 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)C[C@H](Cc2ccccc2)c2ccccc2)C[C@@H](C)O1 ZINC000443664747 868272905 /nfs/dbraw/zinc/27/29/05/868272905.db2.gz FPRQBNPHXQCBJC-RQTOMXEWSA-N 0 3 408.586 4.409 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)CSCc2ccc(Cl)cc2Cl)C[C@@H](C)O1 ZINC000443671714 868278607 /nfs/dbraw/zinc/27/86/07/868278607.db2.gz DCYQQVMHXVLZSJ-HUUCEWRRSA-N 0 3 419.418 4.232 20 0 HIADHN C[C@H]1CN(CCCCNC(=O)C2(c3cccc(C(F)(F)F)c3)CCC2)C[C@H](C)O1 ZINC000443676595 868282344 /nfs/dbraw/zinc/28/23/44/868282344.db2.gz UWWIMFLIRLUDMJ-IRXDYDNUSA-N 0 3 412.496 4.133 20 0 HIADHN CCN(C(=O)C(=O)Nc1ccc2ccoc2c1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000443694897 868294477 /nfs/dbraw/zinc/29/44/77/868294477.db2.gz URSRKJFCSCXTIN-UTKZUKDTSA-N 0 3 405.498 4.055 20 0 HIADHN O=C(Nc1ccc(C(=O)NCCN2CCCC2)cc1)c1occc1-c1ccc(F)cc1 ZINC000443747098 868320639 /nfs/dbraw/zinc/32/06/39/868320639.db2.gz KBBPEIAVFQCUPG-UHFFFAOYSA-N 0 3 421.472 4.164 20 0 HIADHN CSc1ccc(NC(=O)C(=O)N[C@H](C)[C@H](c2ccccc2C)N(C)C)cc1Cl ZINC000443846997 868376766 /nfs/dbraw/zinc/37/67/66/868376766.db2.gz ZAEZVBRSDKNVNC-AUUYWEPGSA-N 0 3 419.978 4.116 20 0 HIADHN OC[C@@H](CNCc1cnc(C(F)(F)F)s1)Cc1ccccc1OC(F)(F)F ZINC000443982369 868507545 /nfs/dbraw/zinc/50/75/45/868507545.db2.gz QEIMYPFORBGGNJ-SNVBAGLBSA-N 0 3 414.371 4.001 20 0 HIADHN COc1ccc(C2(NCc3ccc(OC)c(OC(F)F)c3)CCOCC2)cc1F ZINC000444005874 868527925 /nfs/dbraw/zinc/52/79/25/868527925.db2.gz UFMQHIGTJWEWGU-UHFFFAOYSA-N 0 3 411.420 4.240 20 0 HIADHN CCN(CC)C(=O)[C@H]1CCCN1CCC(=O)Nc1ccc(Oc2ccccc2)cc1 ZINC000444120795 868629605 /nfs/dbraw/zinc/62/96/05/868629605.db2.gz XGGNFWXPAWIUHI-JOCHJYFZSA-N 0 3 409.530 4.140 20 0 HIADHN COc1cc2nc(CN(C)[C@@H]3CCC[C@H]3c3ccc(C)cc3)[nH]c(=O)c2cc1OC ZINC000444239913 868689098 /nfs/dbraw/zinc/68/90/98/868689098.db2.gz MTFJQSUUJLYUDW-FXAWDEMLSA-N 0 3 407.514 4.429 20 0 HIADHN CN(C)CCN(C(=O)NCc1cc(Oc2ccc(F)cc2)ccn1)C1CCCC1 ZINC000468304729 882230824 /nfs/dbraw/zinc/23/08/24/882230824.db2.gz HCLVWZNBAQJPSS-UHFFFAOYSA-N 0 3 400.498 4.029 20 0 HIADHN COc1ccc(-c2ncc(C(=O)Nc3cccc(CN4CCC(O)CC4)c3)s2)cc1 ZINC000444448554 868831953 /nfs/dbraw/zinc/83/19/53/868831953.db2.gz CHGRIPUKKAAMQO-UHFFFAOYSA-N 0 3 423.538 4.028 20 0 HIADHN Cc1ccc(-c2nc(CC(=O)Nc3cccc(CN4CCC(O)CC4)c3)cs2)cc1 ZINC000444453555 868833671 /nfs/dbraw/zinc/83/36/71/868833671.db2.gz JFWDRTJMMXLUPO-UHFFFAOYSA-N 0 3 421.566 4.256 20 0 HIADHN CCCOc1ccc(C(=O)Nc2cccc(CN3CCC(O)CC3)c2)cc1OCC ZINC000444453441 868833740 /nfs/dbraw/zinc/83/37/40/868833740.db2.gz IBLAUBGUEDRLLZ-UHFFFAOYSA-N 0 3 412.530 4.083 20 0 HIADHN CC[C@H](Oc1ccccc1Cl)C(=O)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000444454949 868834983 /nfs/dbraw/zinc/83/49/83/868834983.db2.gz QMTGXVPIZOKOMW-FQEVSTJZSA-N 0 3 402.922 4.093 20 0 HIADHN COc1ccc(C2(C(=O)Nc3cccc(CN4CCC(O)CC4)c3)CCCC2)cc1 ZINC000444463193 868838616 /nfs/dbraw/zinc/83/86/16/868838616.db2.gz XADVCDWPUWERCW-UHFFFAOYSA-N 0 3 408.542 4.102 20 0 HIADHN Cc1cc(C(=O)Nc2cccc(CN3CCC(CO)CC3)c2)cc(C)c1OC(F)F ZINC000444544285 868875722 /nfs/dbraw/zinc/87/57/22/868875722.db2.gz GFKVMRKNNKDXBY-UHFFFAOYSA-N 0 3 418.484 4.361 20 0 HIADHN O=C(COc1cc(Cl)cc(Cl)c1)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000444544707 868876665 /nfs/dbraw/zinc/87/66/65/868876665.db2.gz FWTYZXNDVARFPV-UHFFFAOYSA-N 0 3 423.340 4.215 20 0 HIADHN Cc1ccc(Cl)c(O[C@@H](C)C(=O)Nc2cccc(CN3CCC(CO)CC3)c2)c1 ZINC000444547722 868877396 /nfs/dbraw/zinc/87/73/96/868877396.db2.gz JKBBCAIQWMRYSM-KRWDZBQOSA-N 0 3 416.949 4.259 20 0 HIADHN CC(C)c1ccc(OCCC(=O)Nc2cccc(CN3CCC(CO)CC3)c2)cc1 ZINC000444546953 868877560 /nfs/dbraw/zinc/87/75/60/868877560.db2.gz IZTCDKKAVBOOEY-UHFFFAOYSA-N 0 3 410.558 4.422 20 0 HIADHN CC(C)(C(=O)Nc1cccc(CN2CCC(CO)CC2)c1)c1ccc(Cl)cc1 ZINC000444555060 868880327 /nfs/dbraw/zinc/88/03/27/868880327.db2.gz SJAVWPYRCURQBN-UHFFFAOYSA-N 0 3 400.950 4.461 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1occc1COc1ccccc1 ZINC000444557803 868881507 /nfs/dbraw/zinc/88/15/07/868881507.db2.gz XTAJKKPQVHPSRI-UHFFFAOYSA-N 0 3 420.509 4.315 20 0 HIADHN CC(C)(Oc1ccc(Cl)cc1)C(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000444561575 868883105 /nfs/dbraw/zinc/88/31/05/868883105.db2.gz PVEDUKYYVXFEGS-UHFFFAOYSA-N 0 3 416.949 4.340 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)NC(=O)N2CCCN(Cc3ccccc3)CC2)cc1 ZINC000444589961 868892275 /nfs/dbraw/zinc/89/22/75/868892275.db2.gz AMJVFDQCFKHCAY-FQEVSTJZSA-N 0 3 417.557 4.159 20 0 HIADHN COc1ccc(-c2csc(NC(=O)[C@@H](C)N[C@@H]3CC(C)(C)OC3(C)C)n2)cc1 ZINC000444637948 868925742 /nfs/dbraw/zinc/92/57/42/868925742.db2.gz HKGVRIPVRDVURW-CXAGYDPISA-N 0 3 403.548 4.081 20 0 HIADHN Cc1cc(N2CCCC[C@H]2C)ccc1NC(=O)N(CCN(C)C)Cc1ccccn1 ZINC000468317890 882247427 /nfs/dbraw/zinc/24/74/27/882247427.db2.gz QLODRJMVBIEFCI-HXUWFJFHSA-N 0 3 409.578 4.365 20 0 HIADHN COc1ccccc1S(=O)(=O)CCCN[C@@H](C)c1ccc(Br)s1 ZINC000444754390 868987248 /nfs/dbraw/zinc/98/72/48/868987248.db2.gz AQHLSKJRSZLATL-LBPRGKRZSA-N 0 3 418.378 4.034 20 0 HIADHN COc1ccc(C2(NCc3ccc(C(=O)OC(C)C)cc3)CCOCC2)cc1F ZINC000444816351 869027215 /nfs/dbraw/zinc/02/72/15/869027215.db2.gz XJFPTGYIOUQXAC-UHFFFAOYSA-N 0 3 401.478 4.195 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)Nc2cccc(C(C)(F)F)c2)CC1 ZINC000444938601 869119477 /nfs/dbraw/zinc/11/94/77/869119477.db2.gz XJMQTMHAVDTMGC-UHFFFAOYSA-N 0 3 416.516 4.258 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3c[nH]nc3-c3cccc(Cl)c3)c(C)c2)CC1 ZINC000445645995 869717672 /nfs/dbraw/zinc/71/76/72/869717672.db2.gz BWYIALIDEQPJKB-UHFFFAOYSA-N 0 3 423.948 4.433 20 0 HIADHN CCN(C(=O)Cc1noc(C2CCN(Cc3ccccc3)CC2)n1)c1ccccc1 ZINC000445671961 869741418 /nfs/dbraw/zinc/74/14/18/869741418.db2.gz HSCHUMHHUAEXCM-UHFFFAOYSA-N 0 3 404.514 4.045 20 0 HIADHN COc1ccc(CCC(=O)N2CCN(CC3CCC(C(F)(F)F)CC3)CC2)cc1 ZINC000468391602 882337151 /nfs/dbraw/zinc/33/71/51/882337151.db2.gz FVVBHXZVVVFLTE-UHFFFAOYSA-N 0 3 412.496 4.141 20 0 HIADHN Cc1ccccc1CN1CCC(NC(=O)CCC(=O)c2ccc(F)c(F)c2)CC1 ZINC000445836048 869852551 /nfs/dbraw/zinc/85/25/51/869852551.db2.gz ZHKXJSKDHASTBA-UHFFFAOYSA-N 0 3 400.469 4.017 20 0 HIADHN COc1cccc(Cn2ccc3ccc(N4C(=O)NC(CC(F)(F)F)C4=O)cc32)c1 ZINC000445925280 869891603 /nfs/dbraw/zinc/89/16/03/869891603.db2.gz RSJLMVOTOSIRSD-QGZVFWFLSA-N 0 3 417.387 4.075 20 0 HIADHN CN(C(=O)c1c[nH]nc1-c1cccc(Cl)c1)C1CCN(Cc2ccccc2)CC1 ZINC000446098355 870045730 /nfs/dbraw/zinc/04/57/30/870045730.db2.gz FWGCQYHNHNGQNR-UHFFFAOYSA-N 0 3 408.933 4.467 20 0 HIADHN CCN1CC[C@@H](N(C)C(=O)CCCC(=O)c2ccc(Br)cc2)C[C@H]1C ZINC000446150571 870091207 /nfs/dbraw/zinc/09/12/07/870091207.db2.gz ZGZPCKYONVWAET-CRAIPNDOSA-N 0 3 409.368 4.133 20 0 HIADHN CCN1CC[C@H](N(C)C(=O)CCCC(=O)c2ccc(Br)cc2)C[C@@H]1C ZINC000446150574 870091423 /nfs/dbraw/zinc/09/14/23/870091423.db2.gz ZGZPCKYONVWAET-YJBOKZPZSA-N 0 3 409.368 4.133 20 0 HIADHN CC(C)n1ncc2c1nc(-c1ccco1)cc2C(=O)N(CCN(C)C)Cc1ccco1 ZINC000446425182 870339621 /nfs/dbraw/zinc/33/96/21/870339621.db2.gz QHKNEGMFAGGEOE-UHFFFAOYSA-N 0 3 421.501 4.069 20 0 HIADHN Cc1cc(C(=O)N(CCN(C)C)Cc2ccco2)c2cc(Br)ccc2n1 ZINC000446436143 870354894 /nfs/dbraw/zinc/35/48/94/870354894.db2.gz LSHJBQNAPSWYEN-UHFFFAOYSA-N 0 3 416.319 4.103 20 0 HIADHN COc1ccc(CC(C)(C)NC(=O)NC[C@@H](c2cccs2)N2CCCC2)cc1 ZINC000446564073 870475833 /nfs/dbraw/zinc/47/58/33/870475833.db2.gz JGOWNJFECRTKMX-IBGZPJMESA-N 0 3 401.576 4.214 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)c1cc(NC(=O)NC(C)(C)C)ccc1Cl ZINC000446594097 870503142 /nfs/dbraw/zinc/50/31/42/870503142.db2.gz QWCVECZJCVEYPH-UHFFFAOYSA-N 0 3 420.941 4.057 20 0 HIADHN CSCc1cccc(CNC(=O)N(CCN(C)C)Cc2ccc(F)cc2F)c1 ZINC000446617004 870518504 /nfs/dbraw/zinc/51/85/04/870518504.db2.gz IHMIRGSRNZESOZ-UHFFFAOYSA-N 0 3 407.530 4.101 20 0 HIADHN CCCN(C(=O)N[C@H](C)c1ccncc1OC)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000446634737 870540804 /nfs/dbraw/zinc/54/08/04/870540804.db2.gz NZCJBPLCGPQWJP-CTNGQTDRSA-N 0 3 410.562 4.237 20 0 HIADHN CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)N[C@H]1CC[C@@H](Cc2ccccc2)C1 ZINC000446638733 870547917 /nfs/dbraw/zinc/54/79/17/870547917.db2.gz PFHYKKZUWIQDAJ-BIHRQFPBSA-N 0 3 406.574 4.127 20 0 HIADHN COc1ccc2c(c1)[C@H](N[C@H](C)c1ccc(OCCO)c(OC)c1)CCCS2 ZINC000446742742 870650330 /nfs/dbraw/zinc/65/03/30/870650330.db2.gz BVJPNPQOGDJIMV-DNVCBOLYSA-N 0 3 403.544 4.353 20 0 HIADHN C[C@H](NC[C@H](c1cccs1)N1CCOCC1)c1ccc(Br)cc1F ZINC000446743905 870652258 /nfs/dbraw/zinc/65/22/58/870652258.db2.gz WRXGXKJNPPFUJP-SUMWQHHRSA-N 0 3 413.356 4.374 20 0 HIADHN COc1ccc2c(c1)[C@H](NCc1ccc(N3C[C@H](C)O[C@@H](C)C3)nc1)CCCS2 ZINC000446746192 870654062 /nfs/dbraw/zinc/65/40/62/870654062.db2.gz SOBDRNJDBABYAV-XGHQBKJUSA-N 0 3 413.587 4.421 20 0 HIADHN COc1cc(CN2CCC[C@H](c3n[nH]cc3NC(=O)c3ccccc3)C2)ccc1C ZINC000446751725 870660478 /nfs/dbraw/zinc/66/04/78/870660478.db2.gz FFKWFFJUDGMADD-FQEVSTJZSA-N 0 3 404.514 4.359 20 0 HIADHN CCc1nc(CN2CCC(CN[C@H](c3ncc[nH]3)c3ccc(F)cc3)CC2)cs1 ZINC000446816954 870729661 /nfs/dbraw/zinc/72/96/61/870729661.db2.gz IKTJHSUARAQWNU-NRFANRHFSA-N 0 3 413.566 4.159 20 0 HIADHN CCc1nc(CN2CCC(CN[C@@H](c3ncc[nH]3)c3ccc(F)cc3)CC2)cs1 ZINC000446816955 870733359 /nfs/dbraw/zinc/73/33/59/870733359.db2.gz IKTJHSUARAQWNU-OAQYLSRUSA-N 0 3 413.566 4.159 20 0 HIADHN COc1ccc([C@H](CCn2cncn2)NCc2ccc(Br)c(F)c2)cc1 ZINC000446841898 870759937 /nfs/dbraw/zinc/75/99/37/870759937.db2.gz BQWAWDMFAFXRQX-IBGZPJMESA-N 0 3 419.298 4.110 20 0 HIADHN CCOC(=O)C1CCN(C(=O)C[C@@H](C)N[C@H](C)c2ccc(Cl)cc2Cl)CC1 ZINC000446842407 870762133 /nfs/dbraw/zinc/76/21/33/870762133.db2.gz WJOLGLDEKCSXTI-ZIAGYGMSSA-N 0 3 415.361 4.224 20 0 HIADHN COc1ccc(Br)cc1CN[C@H](CCn1cncn1)c1ccc(C)cc1 ZINC000446919094 870834766 /nfs/dbraw/zinc/83/47/66/870834766.db2.gz DLSMVURBVBAPJK-LJQANCHMSA-N 0 3 415.335 4.279 20 0 HIADHN Cc1ccc([C@H](CCn2cncn2)Nc2cccc(CN3CCSCC3)c2)cc1 ZINC000446938410 870848294 /nfs/dbraw/zinc/84/82/94/870848294.db2.gz IINVLLSTRQMPBE-QHCPKHFHSA-N 0 3 407.587 4.379 20 0 HIADHN CCCOc1cc(C)ccc1CNC(=O)N(C)C1CCN(CCc2ccccn2)CC1 ZINC000446970843 870869137 /nfs/dbraw/zinc/86/91/37/870869137.db2.gz AQUHLDZDHYBLSA-UHFFFAOYSA-N 0 3 424.589 4.027 20 0 HIADHN CC[C@H](C)c1ccccc1NC(=O)[C@H](C)NC[C@@](C)(C(=O)OC)c1ccc(F)cc1 ZINC000447033547 870909123 /nfs/dbraw/zinc/90/91/23/870909123.db2.gz JBHHQFXZENLDTD-WOGXIUBCSA-N 0 3 414.521 4.387 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1ccc(Cl)c(Br)c1 ZINC000447146351 871046946 /nfs/dbraw/zinc/04/69/46/871046946.db2.gz CJSCGDNVVXSMCT-UHFFFAOYSA-N 0 3 400.704 4.291 20 0 HIADHN COc1ccccc1-c1csc([C@H]2CCCN(C[C@@H](O)COc3ccccc3)C2)n1 ZINC000447388176 871299286 /nfs/dbraw/zinc/29/92/86/871299286.db2.gz WAFNPMNDHJLFFW-RBUKOAKNSA-N 0 3 424.566 4.438 20 0 HIADHN CCSCc1ccccc1C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000447506113 871380308 /nfs/dbraw/zinc/38/03/08/871380308.db2.gz HEVSWJJBCLDQFI-UHFFFAOYSA-N 0 3 416.562 4.352 20 0 HIADHN Cc1sc(CC(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)nc1C(C)C ZINC000447539148 871403775 /nfs/dbraw/zinc/40/37/75/871403775.db2.gz FWZXKODZMGHLOC-UHFFFAOYSA-N 0 3 400.592 4.287 20 0 HIADHN CN(C(=O)c1ccnc(Oc2ccc(F)cc2F)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000447567006 871465638 /nfs/dbraw/zinc/46/56/38/871465638.db2.gz YJAWRUCCSJZKOE-HXUWFJFHSA-N 0 3 423.463 4.499 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(Br)cc1)c1cccc(N2CCCS2(=O)=O)c1 ZINC000447566965 871466657 /nfs/dbraw/zinc/46/66/57/871466657.db2.gz YAEIDTSPUFGQQC-LSDHHAIUSA-N 0 3 423.376 4.401 20 0 HIADHN C[C@H](NC[C@H](CO)Cc1cc(F)c(F)c(F)c1)c1nc2ccc(Cl)cc2n1C ZINC000447604367 871514365 /nfs/dbraw/zinc/51/43/65/871514365.db2.gz AFNMWXOBVPQDBM-WCQYABFASA-N 0 3 411.855 4.146 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)Nc1cc(-c2ccc(F)cc2F)nn1C ZINC000447653529 871584665 /nfs/dbraw/zinc/58/46/65/871584665.db2.gz SPAKTARUOSIBRW-UHFFFAOYSA-N 0 3 410.424 4.425 20 0 HIADHN O=C(c1ccc(F)cc1)C1CCN(C(=O)[C@@H]2CCCN(Cc3ccccc3)C2)CC1 ZINC000447710626 871651496 /nfs/dbraw/zinc/65/14/96/871651496.db2.gz QWMQXECRSYSMJP-JOCHJYFZSA-N 0 3 408.517 4.159 20 0 HIADHN CN(C)[C@@H]1CCOc2c(NC(=O)[C@H]3CCCCN3Cc3ccc(F)cc3)cccc21 ZINC000447721153 871664288 /nfs/dbraw/zinc/66/42/88/871664288.db2.gz FFZUWDUXJVVUAY-FGZHOGPDSA-N 0 3 411.521 4.204 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N2CCC(Oc3ccncc3C)CC2)N2CCCC2)cc1 ZINC000447771832 871703779 /nfs/dbraw/zinc/70/37/79/871703779.db2.gz YXGXZASRZZRQSI-QHCPKHFHSA-N 0 3 422.573 4.088 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3cccc4c3OCC[C@@H]4OC)c(C)c2)CC1 ZINC000447893903 871805605 /nfs/dbraw/zinc/80/56/05/871805605.db2.gz AXSSSIBAOCQHAZ-QFIPXVFZSA-N 0 3 424.545 4.251 20 0 HIADHN CO[C@H]1CCOc2c(NC(=O)NCC(C)(C)N3CCc4ccccc4C3)cccc21 ZINC000448039893 871872740 /nfs/dbraw/zinc/87/27/40/871872740.db2.gz UQGWEXXMLYNKBF-NRFANRHFSA-N 0 3 409.530 4.115 20 0 HIADHN CO[C@@H]1CCOc2c(NC(=O)N(CCN(C)C)Cc3cccc(Cl)c3)cccc21 ZINC000448040985 871873734 /nfs/dbraw/zinc/87/37/34/871873734.db2.gz DWEOPXJBYALUEO-HXUWFJFHSA-N 0 3 417.937 4.406 20 0 HIADHN CCN(C(=O)Nc1cccc2c1OCC[C@H]2OC)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000448042043 871875092 /nfs/dbraw/zinc/87/50/92/871875092.db2.gz HQAXEOMIKNDCQV-DENIHFKCSA-N 0 3 409.530 4.285 20 0 HIADHN CO[C@H]1CCOc2c(NC(=O)NC[C@H](c3cccs3)N3CCCC3)cccc21 ZINC000448049934 871880701 /nfs/dbraw/zinc/88/07/01/871880701.db2.gz MKYUOJBVGWKUAV-MSOLQXFVSA-N 0 3 401.532 4.177 20 0 HIADHN CO[C@@H]1CCOc2c(NC(=O)N(C)[C@H]3CCCN(Cc4ccccc4)C3)cccc21 ZINC000448051938 871882068 /nfs/dbraw/zinc/88/20/68/871882068.db2.gz UMEBDWRMPZCHAP-SIKLNZKXSA-N 0 3 409.530 4.285 20 0 HIADHN CCC(C)(C)c1ccc(NC(=O)C(=O)NC2CCN([C@H](C)c3ccncc3)CC2)cc1 ZINC000448294187 872227227 /nfs/dbraw/zinc/22/72/27/872227227.db2.gz NYHBXKGEHSKPDP-GOSISDBHSA-N 0 3 422.573 4.050 20 0 HIADHN Fc1ccc(-c2noc([C@@H]3CCCN(Cc4ccnn4-c4ccccc4)C3)n2)cc1 ZINC000448345782 872292119 /nfs/dbraw/zinc/29/21/19/872292119.db2.gz VBVSTCICAISNJN-GOSISDBHSA-N 0 3 403.461 4.441 20 0 HIADHN COc1ccc(CC[C@H](C)NCc2csc(CNC(=O)c3ccccc3)n2)cc1 ZINC000468561825 882617243 /nfs/dbraw/zinc/61/72/43/882617243.db2.gz WZZXQEAXYKXBJY-KRWDZBQOSA-N 0 3 409.555 4.193 20 0 HIADHN CCN(C(=O)Nc1cccc(OC[C@H]2CCCO2)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000460127233 872604396 /nfs/dbraw/zinc/60/43/96/872604396.db2.gz CHYQLWCWRYLGIZ-LADGPHEKSA-N 0 3 423.557 4.373 20 0 HIADHN CCN(C(=O)Nc1ccccc1OCCCOC)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000460132953 872617705 /nfs/dbraw/zinc/61/77/05/872617705.db2.gz HSUGXKSNTZOFQH-OAQYLSRUSA-N 0 3 411.546 4.230 20 0 HIADHN CCN(C(=O)Nc1cccc(-c2noc(C)n2)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000460132349 872618540 /nfs/dbraw/zinc/61/85/40/872618540.db2.gz GAQMRGJCRNZBGG-NRFANRHFSA-N 0 3 405.502 4.173 20 0 HIADHN O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)N1CCCC[C@@H]1c1nnc(C2CCC2)o1 ZINC000460141766 872644203 /nfs/dbraw/zinc/64/42/03/872644203.db2.gz XEURINGYSINQKG-NHCUHLMSSA-N 0 3 423.561 4.238 20 0 HIADHN CC(C)[C@@H](C(=O)Nc1ccc(Cc2nnc3n2CCCCC3)cc1)N1CCCCC1 ZINC000468574458 882642932 /nfs/dbraw/zinc/64/29/32/882642932.db2.gz ILUBTJFKIGISCJ-QHCPKHFHSA-N 0 3 409.578 4.044 20 0 HIADHN CCn1c(COCc2ccccc2)nnc1N1C[C@@H](C)N(Cc2ccccc2)C[C@@H]1C ZINC000460181955 872743935 /nfs/dbraw/zinc/74/39/35/872743935.db2.gz YIKTWHWHDYRPOQ-RTWAWAEBSA-N 0 3 419.573 4.114 20 0 HIADHN C[C@H](C(=O)Nc1ccc(C(=O)N(C)[C@H]2CCCN(C)C2)cc1)c1cccc(Cl)c1 ZINC000460215270 872801313 /nfs/dbraw/zinc/80/13/13/872801313.db2.gz JMZMZTPRWCXABN-KKSFZXQISA-N 0 3 413.949 4.248 20 0 HIADHN Cc1ccc(-c2nc(CCNC(=O)N[C@H](C)CN(C)Cc3ccccc3)co2)cc1 ZINC000460345399 872962645 /nfs/dbraw/zinc/96/26/45/872962645.db2.gz GCHHZAYENFHKHZ-LJQANCHMSA-N 0 3 406.530 4.012 20 0 HIADHN Cc1ccc(CNCc2ccc(OC[C@@H]3CCCO3)cc2)c(-n2cc(Cl)cn2)n1 ZINC000468590768 882675777 /nfs/dbraw/zinc/67/57/77/882675777.db2.gz NVNBRRRQOFEXDV-NRFANRHFSA-N 0 3 412.921 4.077 20 0 HIADHN CC[C@@H](C)[C@H](NC(=O)c1ccc(N2CCN(CC)CC2)cc1)c1nc2ccccc2[nH]1 ZINC000468593843 882681660 /nfs/dbraw/zinc/68/16/60/882681660.db2.gz CBAQZTWOXFVOHF-JPYJTQIMSA-N 0 3 419.573 4.222 20 0 HIADHN CCCN(CCN1CCN(CC)CC1)C(=O)N[C@@H](c1ccccc1F)C1CCCC1 ZINC000460489084 873175261 /nfs/dbraw/zinc/17/52/61/873175261.db2.gz KEWCVEXVBWXVGO-HSZRJFAPSA-N 0 3 418.601 4.116 20 0 HIADHN C[C@@H]1CN(C(=O)CCCN2CCN(c3ccccc3)CC2)CC[C@H]1c1ccccc1 ZINC000460642177 873383351 /nfs/dbraw/zinc/38/33/51/873383351.db2.gz INIWVXOGPJPTOV-RCZVLFRGSA-N 0 3 405.586 4.241 20 0 HIADHN CCc1nc2ccccc2n1Cc1noc(C2CCN(Cc3ccccc3)CC2)n1 ZINC000460733208 873549777 /nfs/dbraw/zinc/54/97/77/873549777.db2.gz QOPJBSWILHUKDS-UHFFFAOYSA-N 0 3 401.514 4.410 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)c2ccc(NC(=O)CC(C)C)c(F)c2)N(C)C)cc1 ZINC000460791369 873657055 /nfs/dbraw/zinc/65/70/55/873657055.db2.gz OMWNFBLWDUOTDD-JOCHJYFZSA-N 0 3 413.537 4.405 20 0 HIADHN CCOCCCn1c(C2CCC2)nnc1N1C[C@H](C)N(Cc2ccccc2)C[C@H]1C ZINC000460795272 873663508 /nfs/dbraw/zinc/66/35/08/873663508.db2.gz PJWFMDWVRWCLMZ-VQTJNVASSA-N 0 3 411.594 4.071 20 0 HIADHN COc1ccc([C@@H](CNC(=O)c2c[nH]cc2-c2ccc(F)cc2)N2CCCC2)cc1 ZINC000460819070 873700222 /nfs/dbraw/zinc/70/02/22/873700222.db2.gz XDAUXDHNZGZSRI-HSZRJFAPSA-N 0 3 407.489 4.396 20 0 HIADHN O=C(NC[C@H]1CCCCN1Cc1ccccc1)c1ccc(OCc2ccccn2)cc1 ZINC000460928985 873832782 /nfs/dbraw/zinc/83/27/82/873832782.db2.gz VQRXZPNEOMAAAG-XMMPIXPASA-N 0 3 415.537 4.445 20 0 HIADHN CC[C@@H](C(=O)NCCCCN1CCN(Cc2ccccc2)CC1)c1ccc(F)cc1 ZINC000460970993 873867161 /nfs/dbraw/zinc/86/71/61/873867161.db2.gz SLPPDZFURIGHMT-XMMPIXPASA-N 0 3 411.565 4.034 20 0 HIADHN CSC1(CNC(=O)c2ccccc2C(=O)c2ccc(Cl)cc2)CCN(C)CC1 ZINC000460974852 873869148 /nfs/dbraw/zinc/86/91/48/873869148.db2.gz YVZLCTOLTKLHGB-UHFFFAOYSA-N 0 3 416.974 4.128 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N[C@@H]1c2ccccc2CC12CCOCC2)c1ccco1 ZINC000461004531 873880850 /nfs/dbraw/zinc/88/08/50/873880850.db2.gz CNEHGFPFCRNPFS-RBDMOPTHSA-N 0 3 411.546 4.102 20 0 HIADHN O=S1(=O)CCCN1c1ccc(CN[C@@H]2CCSc3c(Cl)cccc32)cc1 ZINC000461093259 874008416 /nfs/dbraw/zinc/00/84/16/874008416.db2.gz RQCNDBVVJYGVTL-GOSISDBHSA-N 0 3 408.976 4.207 20 0 HIADHN C[C@@H](C(=O)N1CC[C@H](COCc2ccccc2)C1)N1CCC(Cc2ccccc2)CC1 ZINC000461372550 874377063 /nfs/dbraw/zinc/37/70/63/874377063.db2.gz CKRJCDPLVIQUBN-NVQXNPDNSA-N 0 3 420.597 4.395 20 0 HIADHN CO[C@@]1(CNCc2c(C)nn(-c3ccccc3)c2Oc2cccc(F)c2)CCOC1 ZINC000461407399 874419052 /nfs/dbraw/zinc/41/90/52/874419052.db2.gz OSKQSGUMINHBPN-HSZRJFAPSA-N 0 3 411.477 4.007 20 0 HIADHN C[C@@H]1CC[C@@H](C)N1CC(=O)Nc1ccc(CN2C(=O)Cc3ccc(Cl)cc32)cc1 ZINC000468719077 882827853 /nfs/dbraw/zinc/82/78/53/882827853.db2.gz GWGAADYCYJYDOM-HZPDHXFCSA-N 0 3 411.933 4.241 20 0 HIADHN CCc1ccc(C(=O)CCC(=O)N2C[C@H]3CCN(Cc4ccccc4)C[C@H]3C2)cc1 ZINC000461424138 874455150 /nfs/dbraw/zinc/45/51/50/874455150.db2.gz HHRJEKCWTFMYOU-RPWUZVMVSA-N 0 3 404.554 4.192 20 0 HIADHN CCOc1ccc(C(=O)CCC(=O)N2C[C@@H]3CCN(Cc4ccccc4)C[C@@H]3C2)cc1 ZINC000461426926 874462169 /nfs/dbraw/zinc/46/21/69/874462169.db2.gz FKWBECBBEODLHG-XZOQPEGZSA-N 0 3 420.553 4.029 20 0 HIADHN O=C(CCC(=O)N1C[C@H]2CN(Cc3ccccc3)CC[C@@H]2C1)c1ccc(Cl)cc1 ZINC000461433323 874482835 /nfs/dbraw/zinc/48/28/35/874482835.db2.gz VUHWDZIURIATOA-NHCUHLMSSA-N 0 3 410.945 4.283 20 0 HIADHN O=C(NCc1nc2c(s1)C[C@@H](c1ccccc1)CC2)[C@H]1CCCN1C1CCCC1 ZINC000468731975 882832746 /nfs/dbraw/zinc/83/27/46/882832746.db2.gz BUKXHODADZLIHK-GHTZIAJQSA-N 0 3 409.599 4.439 20 0 HIADHN Cc1ccc(C)c(C(=O)CCC(=O)N2C[C@@H]3CCN(Cc4ccccc4)C[C@H]3C2)c1 ZINC000461445260 874501278 /nfs/dbraw/zinc/50/12/78/874501278.db2.gz MUFWGMOZEHATCV-GOTSBHOMSA-N 0 3 404.554 4.247 20 0 HIADHN C[C@@H]1[C@H](NC(=O)N2CCCC[C@@H]2c2nnc(C3CCC3)o2)CCN1Cc1ccccc1 ZINC000461539399 874626946 /nfs/dbraw/zinc/62/69/46/874626946.db2.gz XJYWPQJCKXSSEQ-DUXKGJEZSA-N 0 3 423.561 4.237 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)c1cc(-c2cnn(C)c2)ccc1F ZINC000468759834 882846873 /nfs/dbraw/zinc/84/68/73/882846873.db2.gz AHOQUPUGBUDZBR-HSZRJFAPSA-N 0 3 408.521 4.113 20 0 HIADHN CC(=O)Nc1cc(C(=O)N2CCN(Cc3ccccc3)C3(CCCCC3)C2)ccc1F ZINC000461570327 874670511 /nfs/dbraw/zinc/67/05/11/874670511.db2.gz NQPUUDCUOYGTOS-UHFFFAOYSA-N 0 3 423.532 4.445 20 0 HIADHN C[C@H]1CCN(C)CCN1C(=O)N[C@H]1CCCc2c3cc(Br)ccc3[nH]c21 ZINC000461714663 874863829 /nfs/dbraw/zinc/86/38/29/874863829.db2.gz JDSBPQIPCDNBGL-UGSOOPFHSA-N 0 3 419.367 4.043 20 0 HIADHN CCc1nc2c(s1)[C@@H](N[C@@H]1CCCN(Cc3ccc(F)cc3F)C1=O)CCC2 ZINC000468812363 882871820 /nfs/dbraw/zinc/87/18/20/882871820.db2.gz CFYNLJHZJFUWAV-FUHWJXTLSA-N 0 3 405.514 4.142 20 0 HIADHN C[C@H](CC(=O)NCc1ccccc1CN(C)C)c1ccc(F)c(Br)c1 ZINC000461738630 874883307 /nfs/dbraw/zinc/88/33/07/874883307.db2.gz AALXOPVGIHBELC-CQSZACIVSA-N 0 3 407.327 4.460 20 0 HIADHN COC(=O)c1cc(Br)cc(-c2nc(-c3ccc(CN(C)C)cc3)no2)c1 ZINC000461792154 874907525 /nfs/dbraw/zinc/90/75/25/874907525.db2.gz SGHIWDDQSFEACF-UHFFFAOYSA-N 0 3 416.275 4.014 20 0 HIADHN CN(C)Cc1ccc(C(N)=O)cc1NC(Cc1ccccc1F)Cc1ccccc1F ZINC000461832830 874964836 /nfs/dbraw/zinc/96/48/36/874964836.db2.gz JIXXYEUMDKPWTC-UHFFFAOYSA-N 0 3 423.507 4.391 20 0 HIADHN C[C@@H](CNC(=O)N[C@H]1CCCc2cn(C3CCCC3)nc21)N(C)Cc1ccccc1 ZINC000461957787 875085830 /nfs/dbraw/zinc/08/58/30/875085830.db2.gz PSFGJEYXPGOVHH-AVRDEDQJSA-N 0 3 409.578 4.195 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)N(Cc3ccco3)Cc3cccs3)CC2)c1 ZINC000462038766 875151306 /nfs/dbraw/zinc/15/13/06/875151306.db2.gz XCWZTNYNXWXZSC-UHFFFAOYSA-N 0 3 423.582 4.391 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)[C@H]3CCCCN3Cc3ccccc3)c(C)c2)CC1 ZINC000462046056 875158528 /nfs/dbraw/zinc/15/85/28/875158528.db2.gz RBMGHQATSHRIET-RUZDIDTESA-N 0 3 420.601 4.130 20 0 HIADHN Cc1ccccc1-c1cc(NC(=O)NC[C@@H](c2cccs2)N2CCCC2)n(C)n1 ZINC000462085423 875193289 /nfs/dbraw/zinc/19/32/89/875193289.db2.gz RSGFFLHHUXZQBI-IBGZPJMESA-N 0 3 409.559 4.416 20 0 HIADHN Cc1ccccc1-c1cc(NC(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)n(C)n1 ZINC000462088531 875197917 /nfs/dbraw/zinc/19/79/17/875197917.db2.gz NFQSMEPUBFQHQT-UYAOXDASSA-N 0 3 403.530 4.353 20 0 HIADHN C[C@@H](NC(=O)N(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1)c1ccc(C(F)(F)F)cc1 ZINC000462170655 875266663 /nfs/dbraw/zinc/26/66/63/875266663.db2.gz PZUFJMOMKBRQOQ-BPAFIMBUSA-N 0 3 420.479 4.496 20 0 HIADHN CSc1nc(-c2ccco2)nc(C)c1C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C ZINC000462185712 875287590 /nfs/dbraw/zinc/28/75/90/875287590.db2.gz YWYIHEBBBHIUFD-CRAIPNDOSA-N 0 3 422.554 4.017 20 0 HIADHN Cc1nc(COc2ccccc2C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)cs1 ZINC000462195764 875301985 /nfs/dbraw/zinc/30/19/85/875301985.db2.gz MNEZCQBFIDVVOO-VGOFRKELSA-N 0 3 421.566 4.281 20 0 HIADHN COCCOCc1ccc(C(=O)N[C@H](CN2CCc3ccccc3C2)C(C)(C)C)cc1 ZINC000462215629 875324331 /nfs/dbraw/zinc/32/43/31/875324331.db2.gz RERHLUFTSZKPBC-XMMPIXPASA-N 0 3 424.585 4.052 20 0 HIADHN CCCN(C(=O)NCCCc1nccs1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000462222941 875331242 /nfs/dbraw/zinc/33/12/42/875331242.db2.gz ITLBCZDUYCFRBO-HXUWFJFHSA-N 0 3 400.592 4.162 20 0 HIADHN O=C1NC2(CCCC2)C(=O)N1CCN[C@@H](c1ccccc1)c1cccc2ccccc21 ZINC000462237078 875350910 /nfs/dbraw/zinc/35/09/10/875350910.db2.gz JEFKUJRNEDSALV-QHCPKHFHSA-N 0 3 413.521 4.383 20 0 HIADHN Cc1ccc(-c2noc(CCCN3CCC(c4noc(C5CC5)n4)CC3)n2)cc1F ZINC000462239172 875352619 /nfs/dbraw/zinc/35/26/19/875352619.db2.gz RZOFPZOAJCREDV-UHFFFAOYSA-N 0 3 411.481 4.257 20 0 HIADHN CCC(=O)Nc1ccc(Cl)c(NC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)c1 ZINC000462254349 875376673 /nfs/dbraw/zinc/37/66/73/875376673.db2.gz JBVVRDHDIQQWCF-MGPUTAFESA-N 0 3 414.937 4.331 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N[C@H]3CCO[C@@H](c4ccccc4)C3)c(C)c2)CC1 ZINC000462257151 875380730 /nfs/dbraw/zinc/38/07/30/875380730.db2.gz NDLWCEAFYQQQKJ-XUZZJYLKSA-N 0 3 422.573 4.179 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)Nc1ccc(NC(=O)c2ccco2)cc1 ZINC000462267083 875394064 /nfs/dbraw/zinc/39/40/64/875394064.db2.gz HCGFHRQAWWUCFP-UWJYYQICSA-N 0 3 418.497 4.174 20 0 HIADHN COC(=O)Cc1csc(NC(=O)CN[C@@H](CC2CCCCC2)c2ccccc2)n1 ZINC000462334795 875451016 /nfs/dbraw/zinc/45/10/16/875451016.db2.gz VPYSDHQISYHPLJ-IBGZPJMESA-N 0 3 415.559 4.098 20 0 HIADHN C[C@H]1CN(C)CC[C@@H]1N(C)S(=O)(=O)c1ccc(Oc2cccc(Cl)c2)cc1 ZINC000462353364 875466799 /nfs/dbraw/zinc/46/67/99/875466799.db2.gz APPRADSMWNJGEB-YWZLYKJASA-N 0 3 408.951 4.093 20 0 HIADHN C[C@@H]1CN(C)CC[C@@H]1N(C)S(=O)(=O)c1ccc(Oc2cccc(Cl)c2)cc1 ZINC000462353363 875466875 /nfs/dbraw/zinc/46/68/75/875466875.db2.gz APPRADSMWNJGEB-QRWLVFNGSA-N 0 3 408.951 4.093 20 0 HIADHN CCOC(=O)C1CCN(C(=O)[C@H](C)N[C@H](C)c2ccc(Cl)c3ccccc32)CC1 ZINC000462358418 875471418 /nfs/dbraw/zinc/47/14/18/875471418.db2.gz OZBMTCPDRQRIPL-CVEARBPZSA-N 0 3 416.949 4.334 20 0 HIADHN CC[C@H](NCc1cccc(N2CCCS2(=O)=O)c1)c1ccc(Br)cc1 ZINC000462360037 875473628 /nfs/dbraw/zinc/47/36/28/875473628.db2.gz OHMHINDBFCEQKT-IBGZPJMESA-N 0 3 423.376 4.230 20 0 HIADHN Cc1cccc2c1ncc(C)c2N(C)CC(=O)N1c2ccccc2NC(=O)C[C@@H]1C ZINC000462442842 875549828 /nfs/dbraw/zinc/54/98/28/875549828.db2.gz BTFXMYFKYVCGCE-KRWDZBQOSA-N 0 3 402.498 4.052 20 0 HIADHN CC1(C)CN(C2(CNC(=O)CCc3cncc4ccccc43)CCCCC2)CCO1 ZINC000462510113 875627647 /nfs/dbraw/zinc/62/76/47/875627647.db2.gz KOWFZWWRPQJUMN-UHFFFAOYSA-N 0 3 409.574 4.097 20 0 HIADHN COc1ccc([C@H](CNC(=O)N[C@@H]2CCO[C@@H](c3ccccc3)C2)N2CCCC2)cc1 ZINC000462523173 875640289 /nfs/dbraw/zinc/64/02/89/875640289.db2.gz SBNZCFPUYWEACZ-YFNKSVMNSA-N 0 3 423.557 4.052 20 0 HIADHN COc1ccc([C@H](CNC(=O)N[C@H]2CCO[C@H](c3ccccc3)C2)N2CCCC2)cc1 ZINC000462523172 875640636 /nfs/dbraw/zinc/64/06/36/875640636.db2.gz SBNZCFPUYWEACZ-XWGVYQGASA-N 0 3 423.557 4.052 20 0 HIADHN CC(C)[C@H](Oc1ccc(Cl)cc1)C(=O)N1CC[C@@H](CN(C)Cc2cccnc2)C1 ZINC000462536366 875654839 /nfs/dbraw/zinc/65/48/39/875654839.db2.gz DTMSUSQKKRPXCS-UGKGYDQZSA-N 0 3 415.965 4.119 20 0 HIADHN C[C@H]1CN(Cc2ccccc2CNCc2sccc2Br)C[C@H](C)O1 ZINC000462537393 875657774 /nfs/dbraw/zinc/65/77/74/875657774.db2.gz VSNDFYYXVNKYBA-GJZGRUSLSA-N 0 3 409.393 4.410 20 0 HIADHN OC[C@H](CNCc1cc(Br)ccc1F)Cc1c(F)cccc1Cl ZINC000462739215 875810267 /nfs/dbraw/zinc/81/02/67/875810267.db2.gz NNMJFQMCFDUMHE-NSHDSACASA-N 0 3 404.682 4.322 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)CCc2cncc3ccccc32)cc1 ZINC000462776524 875833346 /nfs/dbraw/zinc/83/33/46/875833346.db2.gz SSGOTJCOOKARSB-XMMPIXPASA-N 0 3 403.526 4.129 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@@H](C)N[C@H]2CCCc3c(O)cccc32)cc1 ZINC000462815859 875857320 /nfs/dbraw/zinc/85/73/20/875857320.db2.gz JRXBXCUYJRGQKL-IERDGZPVSA-N 0 3 402.560 4.151 20 0 HIADHN Cc1ccccc1NC(=O)C[C@H](C)NCc1cc(Br)cc2c1OCC2 ZINC000462844260 875879403 /nfs/dbraw/zinc/87/94/03/875879403.db2.gz YMHJUQQWKSNZJX-AWEZNQCLSA-N 0 3 403.320 4.199 20 0 HIADHN Cc1nc2ccc(Br)cc2c(NCc2cccc(-n3cncn3)c2)c1C ZINC000462863918 875895091 /nfs/dbraw/zinc/89/50/91/875895091.db2.gz QTLWNOVSSJRPSN-UHFFFAOYSA-N 0 3 408.303 4.229 20 0 HIADHN COC(=O)c1cc(CN[C@H](c2cc(F)cc(Br)c2)C2CC2)n(C)c1C ZINC000462917029 875944615 /nfs/dbraw/zinc/94/46/15/875944615.db2.gz NDDXTPSVPQFFKM-SFHVURJKSA-N 0 3 409.299 4.263 20 0 HIADHN COc1ccc([C@H](Nc2ccnc3ccccc32)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000462943254 875965587 /nfs/dbraw/zinc/96/55/87/875965587.db2.gz HHTPOQDMFSUSQR-DEOSSOPVSA-N 0 3 418.518 4.270 20 0 HIADHN C[C@@H](NCc1cccc(OCCN2CCOCC2)c1)c1ccc(OC(C)(C)C)cc1 ZINC000463012341 876028135 /nfs/dbraw/zinc/02/81/35/876028135.db2.gz QNTSZWKXDKFGSU-HXUWFJFHSA-N 0 3 412.574 4.426 20 0 HIADHN COCCCCN(Cc1ccccc1)C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C ZINC000463020084 876036668 /nfs/dbraw/zinc/03/66/68/876036668.db2.gz NWRQOZMKKMATBO-ZJSXRUAMSA-N 0 3 409.574 4.145 20 0 HIADHN CC(C)c1nn(-c2ccc(Br)cc2)cc1CN1CC[C@H](n2cccn2)C1 ZINC000463039702 876065291 /nfs/dbraw/zinc/06/52/91/876065291.db2.gz ZARSHCGBJVZVSP-IBGZPJMESA-N 0 3 414.351 4.402 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)c2cc(NC(=O)C(C)(C)C)ccc2F)C1 ZINC000463155845 876207640 /nfs/dbraw/zinc/20/76/40/876207640.db2.gz KJDJJCRUWYMVSX-LPHOPBHVSA-N 0 3 411.521 4.376 20 0 HIADHN Cn1c2cc(Br)ccc2nc1CN1CCCC[C@@H]1[C@H]1CCCC[C@H]1O ZINC000463198212 876259214 /nfs/dbraw/zinc/25/92/14/876259214.db2.gz LISODDAAMPLPAX-SZVBFZGTSA-N 0 3 406.368 4.241 20 0 HIADHN CCOc1ccc(NC(=O)CN2CCCC[C@@H]2[C@@H]2C[C@@H](C)CC[C@H]2O)cc1OCC ZINC000463205886 876266786 /nfs/dbraw/zinc/26/67/86/876266786.db2.gz VSZCCMAHOGGDBS-MJUUVYJYSA-N 0 3 418.578 4.074 20 0 HIADHN COCc1nc(CNC2CCN(CCC(F)(F)F)CC2)c(-c2ccccc2)s1 ZINC000463242884 876300325 /nfs/dbraw/zinc/30/03/25/876300325.db2.gz LTAXEVBZFYGXBT-UHFFFAOYSA-N 0 3 413.509 4.463 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)N[C@@H](C)c2ccc(Cl)c3ccccc32)CC1 ZINC000463263474 876321340 /nfs/dbraw/zinc/32/13/40/876321340.db2.gz SUACKXPOKPGSDT-ROUUACIJSA-N 0 3 416.997 4.127 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)[C@@H](C)CC(=O)c3ccccc3F)c(C)c2)CC1 ZINC000463327950 876384263 /nfs/dbraw/zinc/38/42/63/876384263.db2.gz QVVBOYUTXSPANF-SFHVURJKSA-N 0 3 411.521 4.124 20 0 HIADHN Cc1nn(C)c(Sc2ccccc2)c1C(=O)NC[C@H](c1ccccc1)N1CCCC1 ZINC000463503418 876564911 /nfs/dbraw/zinc/56/49/11/876564911.db2.gz GPOWINDEGCZTIM-OAQYLSRUSA-N 0 3 420.582 4.447 20 0 HIADHN C[C@@H](C(=O)N(CCN(C)C)Cc1ccc(F)cc1)c1ccc(Br)s1 ZINC000463508156 876569212 /nfs/dbraw/zinc/56/92/12/876569212.db2.gz CPQGNELDAVLWQM-CYBMUJFWSA-N 0 3 413.356 4.344 20 0 HIADHN Cc1nn(CC(=O)Nc2ccc(CCN3CCSCC3)cc2)cc1-c1ccccc1 ZINC000468984035 883050835 /nfs/dbraw/zinc/05/08/35/883050835.db2.gz OJSPULQJNWLAAV-UHFFFAOYSA-N 0 3 420.582 4.089 20 0 HIADHN CCN1CCN(c2ccc(NS(=O)(=O)c3ccccc3C(C)C)c(C)c2)CC1 ZINC000469007464 883074556 /nfs/dbraw/zinc/07/45/56/883074556.db2.gz PVSGZKRFGYITGB-UHFFFAOYSA-N 0 3 401.576 4.061 20 0 HIADHN COc1ccc(Cn2nc(C)c(CNCc3ccc(F)c(CN(C)C)c3)c2C)cc1 ZINC000463740851 876862098 /nfs/dbraw/zinc/86/20/98/876862098.db2.gz WGMPULPLAFDORH-UHFFFAOYSA-N 0 3 410.537 4.047 20 0 HIADHN CN(C(=O)CCc1cccc(C(F)(F)F)c1)C1CCN(CCc2ccccn2)CC1 ZINC000463754854 876878747 /nfs/dbraw/zinc/87/87/47/876878747.db2.gz JEENXKGWQOIGPQ-UHFFFAOYSA-N 0 3 419.491 4.199 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)C(=O)Nc3cccc(C4CCC4)c3)c2)CC1 ZINC000463806384 876923782 /nfs/dbraw/zinc/92/37/82/876923782.db2.gz RMJBAMKMFLNLIW-UHFFFAOYSA-N 0 3 420.557 4.062 20 0 HIADHN Cn1ccc(N2CCC[C@H](N[C@@H](Cc3ccc(Cl)cc3)c3ccccc3)C2=O)n1 ZINC000463895873 877017464 /nfs/dbraw/zinc/01/74/64/877017464.db2.gz LCOLRRPYORQQIC-SFTDATJTSA-N 0 3 408.933 4.143 20 0 HIADHN COc1ccc([C@@H](CNC(=O)NC[C@@H](C)Sc2ccccc2)N2CCCC2)cc1 ZINC000463951445 877074339 /nfs/dbraw/zinc/07/43/39/877074339.db2.gz ARLPCMAAAFPXAM-XMSQKQJNSA-N 0 3 413.587 4.312 20 0 HIADHN CCO[C@@H](C)c1nc(CN(C)C(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)cs1 ZINC000463977086 877105203 /nfs/dbraw/zinc/10/52/03/877105203.db2.gz WSVNZLPJPYTXDX-WMZOPIPTSA-N 0 3 419.566 4.250 20 0 HIADHN CCO[C@H](C)c1nc(CN(C)C(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)cs1 ZINC000463977085 877105429 /nfs/dbraw/zinc/10/54/29/877105429.db2.gz WSVNZLPJPYTXDX-SJLPKXTDSA-N 0 3 419.566 4.250 20 0 HIADHN C[C@H]1[C@H](NC(=O)Nc2ccc(NC(=O)c3cccc(Cl)c3)c(F)c2)CCCN1C ZINC000463987667 877120984 /nfs/dbraw/zinc/12/09/84/877120984.db2.gz OVUFKEZCUZXDJW-SCLBCKFNSA-N 0 3 418.900 4.336 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2ccc(OC3CCC3)cc2)cc1)[C@H]1CCCN(C)C1 ZINC000464015295 877150424 /nfs/dbraw/zinc/15/04/24/877150424.db2.gz MLGFXNRJRKEVNX-NRFANRHFSA-N 0 3 421.541 4.036 20 0 HIADHN Clc1ccc(Br)c(CNC[C@H](c2cccs2)N2CCOCC2)c1 ZINC000464048663 877189305 /nfs/dbraw/zinc/18/93/05/877189305.db2.gz NOULCEJUPWCMIV-MRXNPFEDSA-N 0 3 415.784 4.327 20 0 HIADHN Cc1ccc([C@H](Cc2ccccc2Br)NCc2ccc(C(N)=O)nc2)cc1 ZINC000464064004 877209299 /nfs/dbraw/zinc/20/92/99/877209299.db2.gz JPYHKKGFKHJJLC-NRFANRHFSA-N 0 3 424.342 4.325 20 0 HIADHN CSCc1cccnc1C(=O)Nc1c(C)cnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000464190310 877361024 /nfs/dbraw/zinc/36/10/24/877361024.db2.gz UYKDREJPLAUOFF-FQEVSTJZSA-N 0 3 421.570 4.149 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N2Cc3ccc(O)cc3C3(CC3)C2)N2CCCC2)cc1 ZINC000464238103 877414634 /nfs/dbraw/zinc/41/46/34/877414634.db2.gz VTKLJKUXODUBHE-HSZRJFAPSA-N 0 3 405.542 4.095 20 0 HIADHN Cc1nc(C(=O)N2C[C@H]3CCCN3Cc3ccccc32)nn1-c1ccccc1C(C)C ZINC000503285835 912266197 /nfs/dbraw/zinc/26/61/97/912266197.db2.gz SWFWVGOAKKOEJY-HXUWFJFHSA-N 0 3 415.541 4.324 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)N[C@@H]1CCOc2c(F)ccc(F)c21 ZINC000464507893 877732622 /nfs/dbraw/zinc/73/26/22/877732622.db2.gz DBXLLOXVLPVJHT-GOSISDBHSA-N 0 3 423.891 4.215 20 0 HIADHN CC(C)CN(C(=O)c1ccc(Sc2ccccc2Cl)nn1)C1CCN(C)CC1 ZINC000464579250 877802940 /nfs/dbraw/zinc/80/29/40/877802940.db2.gz SBOZXOROCKWBDD-UHFFFAOYSA-N 0 3 418.994 4.474 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)NC[C@H](C)Oc3ccc(Cl)cc3)cc2)CC1 ZINC000464629208 877847872 /nfs/dbraw/zinc/84/78/72/877847872.db2.gz JYMIKLUUJKYDPP-SFHVURJKSA-N 0 3 415.965 4.068 20 0 HIADHN C[C@@H](CNC(=O)c1cccc(CN2CCCC2)c1)Oc1cccc(Br)c1 ZINC000464660830 877881488 /nfs/dbraw/zinc/88/14/88/877881488.db2.gz DDVDTVMZBUBXBP-INIZCTEOSA-N 0 3 417.347 4.242 20 0 HIADHN CCc1cccc(CC)c1NC(=O)CN(CC)CC1CCN(c2ccccn2)CC1 ZINC000464805022 878049637 /nfs/dbraw/zinc/04/96/37/878049637.db2.gz KVCUTYQMJGZGPF-UHFFFAOYSA-N 0 3 408.590 4.383 20 0 HIADHN CCN(CC(=O)Nc1ccc(F)c(Cl)c1)CC1CCN(c2ccccn2)CC1 ZINC000464810016 878060646 /nfs/dbraw/zinc/06/06/46/878060646.db2.gz NNGOFVRZONSBLP-UHFFFAOYSA-N 0 3 404.917 4.051 20 0 HIADHN CN(Cc1nc2c3ccccc3oc2c(=O)[n-]1)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000464840247 878105926 /nfs/dbraw/zinc/10/59/26/878105926.db2.gz TVAHDXSWRSYZOS-GOSISDBHSA-N 0 3 402.498 4.036 20 0 HIADHN CN(Cc1nc2c3ccccc3oc2c(=O)[n-]1)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000464840247 878105936 /nfs/dbraw/zinc/10/59/36/878105936.db2.gz TVAHDXSWRSYZOS-GOSISDBHSA-N 0 3 402.498 4.036 20 0 HIADHN CCc1ccc([C@@H]2C[C@H](C)CCN2C[C@@H](O)COc2ccc(NC(C)=O)cc2)o1 ZINC000464856252 878135988 /nfs/dbraw/zinc/13/59/88/878135988.db2.gz UPWTUFFPBJIHDD-PERKRYKHSA-N 0 3 400.519 4.013 20 0 HIADHN COC(=O)c1c(CN2CC[C@]3(CCOC3)C2)nc2ccccc2c1-c1ccccc1 ZINC000464858672 878138932 /nfs/dbraw/zinc/13/89/32/878138932.db2.gz XOLBZRJBWFXJRM-VWLOTQADSA-N 0 3 402.494 4.301 20 0 HIADHN C[C@@H]1CCN(C(=O)Cc2ccc(Br)cc2)CCN1Cc1ccccc1 ZINC000464902775 878214154 /nfs/dbraw/zinc/21/41/54/878214154.db2.gz BXEQRJLEHYYOEP-QGZVFWFLSA-N 0 3 401.348 4.115 20 0 HIADHN COc1ccc(C(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)cc1OC(F)F ZINC000464902693 878214479 /nfs/dbraw/zinc/21/44/79/878214479.db2.gz SPIIPWSVCPPTIK-MRXNPFEDSA-N 0 3 404.457 4.033 20 0 HIADHN Cc1c(C(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)cnn1-c1ccccc1F ZINC000464902391 878215088 /nfs/dbraw/zinc/21/50/88/878215088.db2.gz ZZWKKQFATRKQQC-GOSISDBHSA-N 0 3 406.505 4.056 20 0 HIADHN C[C@H]1CCN(C(=O)Cc2ccc(Br)cc2)CCN1Cc1ccccc1 ZINC000464902774 878215569 /nfs/dbraw/zinc/21/55/69/878215569.db2.gz BXEQRJLEHYYOEP-KRWDZBQOSA-N 0 3 401.348 4.115 20 0 HIADHN Cc1cc(C)n(Cc2cccc(C(=O)N3CC[C@@H](C)N(Cc4ccccc4)CC3)c2)n1 ZINC000464905562 878219418 /nfs/dbraw/zinc/21/94/18/878219418.db2.gz RGJSNLUCQVRQPV-OAQYLSRUSA-N 0 3 416.569 4.285 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Cc1c[nH]c2ncccc12)c1ccc(C(F)(F)F)cc1 ZINC000464921705 878244221 /nfs/dbraw/zinc/24/42/21/878244221.db2.gz OCPWGEUBYUKWDJ-LJQANCHMSA-N 0 3 418.463 4.324 20 0 HIADHN CCc1ccc(-c2ccc(CNCc3ccc(N4CCN(CC)CC4)nc3)o2)cc1 ZINC000465010183 878369865 /nfs/dbraw/zinc/36/98/65/878369865.db2.gz HBWOLANSJZSQSB-UHFFFAOYSA-N 0 3 404.558 4.336 20 0 HIADHN O=C(CCN1CCN(c2ccccc2)CC1)Nc1ccccc1CCC(F)(F)F ZINC000465146054 878527313 /nfs/dbraw/zinc/52/73/13/878527313.db2.gz MOCBLIDALDRGKY-UHFFFAOYSA-N 0 3 405.464 4.332 20 0 HIADHN C[C@H](NC(=O)NC[C@H](c1cccs1)N1CCCC1)c1nc(C2CCCCC2)no1 ZINC000465419007 878849184 /nfs/dbraw/zinc/84/91/84/878849184.db2.gz AAHNGNKMVAIXGW-DOTOQJQBSA-N 0 3 417.579 4.376 20 0 HIADHN C[C@@H]1CN(C(=O)NC[C@H](c2ccccc2)N2CCCC2)C[C@H](c2ccc(F)cc2)O1 ZINC000465431264 878863725 /nfs/dbraw/zinc/86/37/25/878863725.db2.gz SDSLLADGPHUDFO-SXSPYAJSSA-N 0 3 411.521 4.134 20 0 HIADHN CO[C@@H](CNC(=O)NC[C@H](c1ccccc1)N1CCCC1)c1cccc(Cl)c1 ZINC000465432630 878865325 /nfs/dbraw/zinc/86/53/25/878865325.db2.gz YANFPAFTENMXEF-RTWAWAEBSA-N 0 3 401.938 4.164 20 0 HIADHN O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N[C@H]1COc2c1ccc(Cl)c2Cl ZINC000465434599 878866454 /nfs/dbraw/zinc/86/64/54/878866454.db2.gz RHJQXHVUBIZDRQ-PBHICJAKSA-N 0 3 406.313 4.001 20 0 HIADHN CC[C@H](NC(=O)NC[C@@H](c1ccccc1)N(C)C)c1nc(C(F)(F)F)cs1 ZINC000465454607 878885093 /nfs/dbraw/zinc/88/50/93/878885093.db2.gz ISSXXICLHBPRFZ-KBPBESRZSA-N 0 3 400.470 4.215 20 0 HIADHN CC[C@@H](NC(=O)NC[C@H](c1ccccc1)N(C)C)c1nc(C(F)(F)F)cs1 ZINC000465454613 878885245 /nfs/dbraw/zinc/88/52/45/878885245.db2.gz ISSXXICLHBPRFZ-ZIAGYGMSSA-N 0 3 400.470 4.215 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N[C@H](C)c1c(F)cccc1OC)c1cccc(OC)c1 ZINC000465465941 878899697 /nfs/dbraw/zinc/89/96/97/878899697.db2.gz ASFCWFUTDZERBM-UZLBHIALSA-N 0 3 417.525 4.286 20 0 HIADHN CC[C@H](CNC(=O)N(C)[C@H](C)Cc1ccccc1OC)N1CCc2ccccc2C1 ZINC000465525117 878977298 /nfs/dbraw/zinc/97/72/98/878977298.db2.gz KIZULMPWWFUZLK-AUSIDOKSSA-N 0 3 409.574 4.105 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NC[C@@H](OC)c1ccc(Cl)cc1)c1ccsc1 ZINC000465529709 878984474 /nfs/dbraw/zinc/98/44/74/878984474.db2.gz XKJSUBQGYYWDOH-RTBURBONSA-N 0 3 409.983 4.471 20 0 HIADHN CC[C@@H](CNC(=O)N[C@@H](C)c1ccc(-n2cccn2)cc1)N1CCc2ccccc2C1 ZINC000465538134 878998080 /nfs/dbraw/zinc/99/80/80/878998080.db2.gz GAQDKZFDRVBXIS-CVDCTZTESA-N 0 3 417.557 4.069 20 0 HIADHN CC[C@H](CNC(=O)NCc1ccc(-c2cccnc2)cc1)N1CCc2ccccc2C1 ZINC000465544131 879006100 /nfs/dbraw/zinc/00/61/00/879006100.db2.gz PRKNJSGQBKFDFF-RUZDIDTESA-N 0 3 414.553 4.385 20 0 HIADHN CC[C@@H](CNC(=O)N(Cc1ccc(O)cc1)CC1CC1)N1CCc2ccccc2C1 ZINC000465544631 879006921 /nfs/dbraw/zinc/00/69/21/879006921.db2.gz MZDXRBBJHOLTMK-QHCPKHFHSA-N 0 3 407.558 4.151 20 0 HIADHN Cc1ccc([C@H]2CCCCN2C(=O)NCc2ccc(CN3CCN(C)CC3)cc2)cc1 ZINC000465549193 879011927 /nfs/dbraw/zinc/01/19/27/879011927.db2.gz JPXKVUYNJBQROU-RUZDIDTESA-N 0 3 420.601 4.179 20 0 HIADHN CCO[C@@H](C)c1nc(CN(C)C(=O)N[C@H](CN2CCCC2)c2ccccc2)cs1 ZINC000465598905 879087416 /nfs/dbraw/zinc/08/74/16/879087416.db2.gz MGASHIQVZAQGOV-FXAWDEMLSA-N 0 3 416.591 4.219 20 0 HIADHN COc1ccccc1C[C@H](C)N(C)C(=O)NCC(C)(C)N1CCc2ccccc2C1 ZINC000465687649 879237248 /nfs/dbraw/zinc/23/72/48/879237248.db2.gz HJGVBJDYNHRGKH-IBGZPJMESA-N 0 3 409.574 4.105 20 0 HIADHN CCCCOC1CCN(C(=O)NC[C@@H](c2ccccc2)N2CCC(C)CC2)CC1 ZINC000465724671 879302237 /nfs/dbraw/zinc/30/22/37/879302237.db2.gz NLLQVINVFJWHJR-QHCPKHFHSA-N 0 3 401.595 4.450 20 0 HIADHN CCCCOc1ncccc1CNC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1 ZINC000465731395 879312692 /nfs/dbraw/zinc/31/26/92/879312692.db2.gz ZABJMANUBASVTR-FQEVSTJZSA-N 0 3 410.562 4.067 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N2CC[C@@H](COCc3ccccc3)C2)C1 ZINC000465748769 879335785 /nfs/dbraw/zinc/33/57/85/879335785.db2.gz IOJCAYDFLGDPDP-KIFXHHALSA-N 0 3 407.558 4.070 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N2CC[C@H](COCc3ccccc3)C2)C1 ZINC000465748766 879336283 /nfs/dbraw/zinc/33/62/83/879336283.db2.gz IOJCAYDFLGDPDP-JCTONOIOSA-N 0 3 407.558 4.070 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1)c1cccc(-n2cccn2)c1 ZINC000465758400 879352702 /nfs/dbraw/zinc/35/27/02/879352702.db2.gz PAAQACGYAIQITL-CNNODRBYSA-N 0 3 403.530 4.068 20 0 HIADHN C[C@@H]1CCN(C(=O)NCc2ccccc2Br)CCN1Cc1ccccc1 ZINC000465771668 879372787 /nfs/dbraw/zinc/37/27/87/879372787.db2.gz BGSFELQNBXTYNT-QGZVFWFLSA-N 0 3 416.363 4.255 20 0 HIADHN C[C@@H](NC(=O)N(CCN(C)C)C[C@H]1CCCO1)c1ccccc1Oc1ccccc1 ZINC000465807152 879423253 /nfs/dbraw/zinc/42/32/53/879423253.db2.gz QXMDPLSCDWSUET-TZIWHRDSSA-N 0 3 411.546 4.292 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N[C@@H](C)c2cccc(-n3cccn3)c2)N2CCCC2)cc1 ZINC000465819850 879446287 /nfs/dbraw/zinc/44/62/87/879446287.db2.gz WNWUDDSYTOMZOS-RDPSFJRHSA-N 0 3 417.557 4.378 20 0 HIADHN Cc1ccc([C@H](CNC(=O)NCc2cccc(N3CC=CC3)c2)N2CCCC2)cc1 ZINC000465822859 879452507 /nfs/dbraw/zinc/45/25/07/879452507.db2.gz VTAPAYSWMJYEIA-DEOSSOPVSA-N 0 3 404.558 4.008 20 0 HIADHN Cc1ccccc1Oc1ccccc1CNC(=O)N(CCN(C)C)C[C@@H]1CCCO1 ZINC000465864876 879515196 /nfs/dbraw/zinc/51/51/96/879515196.db2.gz ROMDUNOYVKUADB-NRFANRHFSA-N 0 3 411.546 4.040 20 0 HIADHN C[C@@H]1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CCN1Cc1ccccc1 ZINC000465910409 879572113 /nfs/dbraw/zinc/57/21/13/879572113.db2.gz ZGKUOZHNCMRWQB-HXUWFJFHSA-N 0 3 404.558 4.407 20 0 HIADHN C[C@@H](NC(=O)N1CC[C@H](N2CC=CC2)C1)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000465939464 879606057 /nfs/dbraw/zinc/60/60/57/879606057.db2.gz JARMLPXKEIMJRV-GCJKJVERSA-N 0 3 409.505 4.121 20 0 HIADHN CC[C@@H](NC(=O)N(C)C1CCN(CCc2ccccn2)CC1)C(C)(C)c1ccccc1 ZINC000465970082 879637854 /nfs/dbraw/zinc/63/78/54/879637854.db2.gz CMMRMAYRHSTRHX-XMMPIXPASA-N 0 3 422.617 4.486 20 0 HIADHN Cc1cccc2c(CCNC(=O)N(CCCc3ccccc3)CCN(C)C)c[nH]c21 ZINC000466008301 879688857 /nfs/dbraw/zinc/68/88/57/879688857.db2.gz KNRWGAUKUJIUPN-UHFFFAOYSA-N 0 3 406.574 4.225 20 0 HIADHN COc1cccc([C@@H](Cc2cc(C)cc(C)c2)NC(=O)N[C@@H]2CCN(C3CC3)C2)c1 ZINC000466011100 879690641 /nfs/dbraw/zinc/69/06/41/879690641.db2.gz CBZQWCYUPNCLOA-ZJSXRUAMSA-N 0 3 407.558 4.132 20 0 HIADHN O=C(N[C@@H](c1ccccc1Cl)c1cc(F)ccc1F)N[C@@H]1CCN(C2CC2)C1 ZINC000466015987 879697697 /nfs/dbraw/zinc/69/76/97/879697697.db2.gz KFOTUKKWYRWRPQ-VLIAUNLRSA-N 0 3 405.876 4.244 20 0 HIADHN COc1ccccc1C[C@@H](C)N(Cc1ccccc1)C(=O)N[C@H]1CCN(C2CC2)C1 ZINC000466021113 879707312 /nfs/dbraw/zinc/70/73/12/879707312.db2.gz WWOPGDGKHRTVMA-KNQAVFIVSA-N 0 3 407.558 4.075 20 0 HIADHN COc1ccc([C@H](C)CCNC(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)cc1 ZINC000466030048 879716629 /nfs/dbraw/zinc/71/66/29/879716629.db2.gz AQRVZXIZVUPFNP-NHCUHLMSSA-N 0 3 409.574 4.495 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)NCc2ccc3ncccc3c2)N(C)C)cc1 ZINC000503459297 912489386 /nfs/dbraw/zinc/48/93/86/912489386.db2.gz CZOROKJDVCWOID-QHCPKHFHSA-N 0 3 406.530 4.124 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCC[C@H](C)c3ccc(OC)cc3)c(C)c2)CC1 ZINC000466051557 879742079 /nfs/dbraw/zinc/74/20/79/879742079.db2.gz DENHJSMJDGGTFV-IBGZPJMESA-N 0 3 424.589 4.461 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)NCc1coc(-c2ccccc2)n1 ZINC000466072860 879778668 /nfs/dbraw/zinc/77/86/68/879778668.db2.gz YLUURKXAFWXUNC-LJQANCHMSA-N 0 3 404.514 4.148 20 0 HIADHN C[C@H](NC(=O)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1)[C@H]1CCOC1 ZINC000466118473 879831526 /nfs/dbraw/zinc/83/15/26/879831526.db2.gz SODPCDAWBUZMTA-RDJZCZTQSA-N 0 3 414.377 4.026 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)N[C@@H]2COc3c2ccc(Cl)c3Cl)o1 ZINC000466193672 879886757 /nfs/dbraw/zinc/88/67/57/879886757.db2.gz GUWBRJUMLASDTA-MRXNPFEDSA-N 0 3 412.317 4.102 20 0 HIADHN COc1cc(CNC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)c2ccccc2n1 ZINC000466208767 879898664 /nfs/dbraw/zinc/89/86/64/879898664.db2.gz PFZINIDAIDXNKY-LJQANCHMSA-N 0 3 418.541 4.049 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccc(O)cc1)C(=O)c1oc(-c2ccccc2)nc1C ZINC000503475020 912513217 /nfs/dbraw/zinc/51/32/17/912513217.db2.gz YSOHDKOVHKMZPM-NRFANRHFSA-N 0 3 419.525 4.482 20 0 HIADHN C[C@@H](CNC(=O)Nc1cccc(CN(C)C)c1)Oc1cccc(Br)c1 ZINC000466299823 880047361 /nfs/dbraw/zinc/04/73/61/880047361.db2.gz QLSKSAITRNTJDZ-AWEZNQCLSA-N 0 3 406.324 4.100 20 0 HIADHN CCCN(C(=O)NCc1ncc(CC)s1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000466331332 880084151 /nfs/dbraw/zinc/08/41/51/880084151.db2.gz QBYOFPISRVIWQQ-IBGZPJMESA-N 0 3 400.592 4.292 20 0 HIADHN Cc1cc(CNCc2ccc(OC(F)F)cc2)ccc1I ZINC000466361267 880118845 /nfs/dbraw/zinc/11/88/45/880118845.db2.gz RWXNTJIVNPRYKF-UHFFFAOYSA-N 0 3 403.210 4.491 20 0 HIADHN Cc1cc(CNCc2c[nH]nc2-c2ccccc2)ccc1I ZINC000466363305 880121829 /nfs/dbraw/zinc/12/18/29/880121829.db2.gz BXPOOMDDLDMOLU-UHFFFAOYSA-N 0 3 403.267 4.280 20 0 HIADHN COc1ccc([C@H](CNC(=O)Nc2cccc(Cl)c2N(C)C)N2CCCC2)cc1 ZINC000503490994 912537229 /nfs/dbraw/zinc/53/72/29/912537229.db2.gz FJJUTLBRFZATOT-FQEVSTJZSA-N 0 3 416.953 4.373 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N[C@H](c2ccccc2)c2cccnc2)N(C)C)cc1 ZINC000503500410 912547392 /nfs/dbraw/zinc/54/73/92/912547392.db2.gz YCGRLMABWGWNBH-BJKOFHAPSA-N 0 3 402.542 4.336 20 0 HIADHN C[C@H](CNC(=O)N(CCN(C)C)Cc1ccc(F)c(F)c1)c1ccc(F)cc1F ZINC000466420490 880193441 /nfs/dbraw/zinc/19/34/41/880193441.db2.gz BMJWKQNLUNLNKC-CQSZACIVSA-N 0 3 411.443 4.120 20 0 HIADHN COc1cc(CN[C@H]2CC(=O)N(Cc3ccccc3C(F)(F)F)C2)ccc1SC ZINC000466445320 880222325 /nfs/dbraw/zinc/22/23/25/880222325.db2.gz GGYZAWOBPNWLBR-INIZCTEOSA-N 0 3 424.488 4.327 20 0 HIADHN CCOc1cc(CN[C@@H]2CCCc3sccc32)ccc1O[C@H](C)C(=O)N(C)C ZINC000466461281 880242735 /nfs/dbraw/zinc/24/27/35/880242735.db2.gz GYMVTRXBXAVRLD-CRAIPNDOSA-N 0 3 402.560 4.170 20 0 HIADHN Cc1nc(COc2ccc(CN[C@H]3CC(=O)N(Cc4ccccc4)[C@H]3C)cc2)cs1 ZINC000466476858 880258933 /nfs/dbraw/zinc/25/89/33/880258933.db2.gz BHOPGFGJAPKBSS-SBUREZEXSA-N 0 3 421.566 4.310 20 0 HIADHN CN(CCC1CCOCC1)CC(=O)N[C@H](c1ccccc1)c1cccc(Cl)c1 ZINC000466480339 880262640 /nfs/dbraw/zinc/26/26/40/880262640.db2.gz FABNOPHLSCGPPA-HSZRJFAPSA-N 0 3 400.950 4.294 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)N2CCC(OCCc3ccccc3)CC2)CN1Cc1ccccc1 ZINC000466517891 880292751 /nfs/dbraw/zinc/29/27/51/880292751.db2.gz WZCVEQZNPWGVQL-ZJSXRUAMSA-N 0 3 421.585 4.083 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)Nc2cccc(C(=O)N3CCCCC3)c2)CN1Cc1ccccc1 ZINC000466523215 880299415 /nfs/dbraw/zinc/29/94/15/880299415.db2.gz VAMYGKVVZWFXOD-WMZHIEFXSA-N 0 3 420.557 4.097 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)NCc2ccc(-c3ccncc3)cc2)CN1Cc1ccccc1 ZINC000466534512 880309640 /nfs/dbraw/zinc/30/96/40/880309640.db2.gz QKKPTRMAYWFRPE-DVECYGJZSA-N 0 3 400.526 4.211 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)Nc2cccc(OCc3cccnc3)c2)CN1Cc1ccccc1 ZINC000466540475 880314942 /nfs/dbraw/zinc/31/49/42/880314942.db2.gz OYHNWLRAQPYDSU-XXBNENTESA-N 0 3 416.525 4.445 20 0 HIADHN CN(C)Cc1cccc(NC(=O)N2CCN(c3c(Cl)cccc3Cl)CC2)c1 ZINC000466621589 880393376 /nfs/dbraw/zinc/39/33/76/880393376.db2.gz RSKVZDLQZGAXOR-UHFFFAOYSA-N 0 3 407.345 4.409 20 0 HIADHN CN(Cc1cccc(Br)c1)C(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000503531683 912587006 /nfs/dbraw/zinc/58/70/06/912587006.db2.gz CLGWGMHJZRYXJP-GOSISDBHSA-N 0 3 419.338 4.459 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)NCc1cccc2cc[nH]c21 ZINC000466881507 880649209 /nfs/dbraw/zinc/64/92/09/880649209.db2.gz RPBZULNAFHICCX-UHFFFAOYSA-N 0 3 418.463 4.460 20 0 HIADHN COc1ccc([C@@H](CNC(=O)Nc2cccc(-c3cc[nH]n3)c2)N2CCCC2)cc1 ZINC000466922999 880690988 /nfs/dbraw/zinc/69/09/88/880690988.db2.gz HDRDTSGWKBPQRC-JOCHJYFZSA-N 0 3 405.502 4.044 20 0 HIADHN CCCN(C(=O)NCc1nc(C)c(C)s1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000466963167 880754225 /nfs/dbraw/zinc/75/42/25/880754225.db2.gz IEOLBTMASUNZRL-HXUWFJFHSA-N 0 3 400.592 4.346 20 0 HIADHN O=C(NCCN1CCCCC1)N[C@H]1CCCc2sc(-c3ccc(F)cc3)nc21 ZINC000466981994 880787092 /nfs/dbraw/zinc/78/70/92/880787092.db2.gz YNYNLXMDQGLAFN-KRWDZBQOSA-N 0 3 402.539 4.112 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)Cc2csc(-c3cccc(F)c3)n2)CN1Cc1ccccc1 ZINC000467029656 880828800 /nfs/dbraw/zinc/82/88/00/880828800.db2.gz AFYVLTPXGRAQJM-OXJNMPFZSA-N 0 3 409.530 4.271 20 0 HIADHN C[C@H]1C[C@H](NC(=O)Cc2coc(-c3ccc(Cl)cc3)n2)CN1Cc1ccccc1 ZINC000467049968 880842381 /nfs/dbraw/zinc/84/23/81/880842381.db2.gz YLYGNOIHMCCNRY-JXFKEZNVSA-N 0 3 409.917 4.317 20 0 HIADHN Cc1cc(N2CCSCC2)ccc1NC(=O)N[C@@H]1C[C@H](C)N(Cc2ccccc2)C1 ZINC000467108825 880868324 /nfs/dbraw/zinc/86/83/24/880868324.db2.gz DLGFLDNVGXBNBX-PZJWPPBQSA-N 0 3 424.614 4.333 20 0 HIADHN Cc1cc(Oc2ncccn2)ccc1NC(=O)N[C@H]1C[C@@H](C)N(Cc2ccccc2)C1 ZINC000467109501 880868417 /nfs/dbraw/zinc/86/84/17/880868417.db2.gz GYJYRLPUPFQOOK-QUCCMNQESA-N 0 3 417.513 4.362 20 0 HIADHN Cc1cc(Oc2ncccn2)ccc1NC(=O)N[C@@H]1C[C@H](C)N(Cc2ccccc2)C1 ZINC000467109497 880868598 /nfs/dbraw/zinc/86/85/98/880868598.db2.gz GYJYRLPUPFQOOK-AZUAARDMSA-N 0 3 417.513 4.362 20 0 HIADHN COC(=O)COc1ccc([C@@H](C)N[C@@H](C)C(=O)Nc2ccc(C(C)(C)C)cc2)cc1 ZINC000467189911 880917521 /nfs/dbraw/zinc/91/75/21/880917521.db2.gz CMPPGKWRSAZDLI-SJORKVTESA-N 0 3 412.530 4.214 20 0 HIADHN COc1ccc(C(=O)Nc2ccc(C(=O)NCCN3[C@H](C)CCC[C@@H]3C)s2)cc1 ZINC000467192182 880921886 /nfs/dbraw/zinc/92/18/86/880921886.db2.gz SMCIBNRJGXPAET-IYBDPMFKSA-N 0 3 415.559 4.002 20 0 HIADHN CO[C@H](C)c1nc(CN2CCCN(C[C@@H]3CCC4(CCCCC4)O3)CC2)cs1 ZINC000467200431 880929740 /nfs/dbraw/zinc/92/97/40/880929740.db2.gz HWHKBQNOMLOIHC-QUCCMNQESA-N 0 3 407.624 4.240 20 0 HIADHN CC[C@H](C(=O)Nc1ccc(Oc2ccccc2S(=O)(=O)CC)cc1)N(CC)CC ZINC000467219175 880948647 /nfs/dbraw/zinc/94/86/47/880948647.db2.gz SETZKRUJUVBVNB-LJQANCHMSA-N 0 3 418.559 4.331 20 0 HIADHN COCC[C@H]1CCCCN(CC(=O)N[C@@H](c2cccs2)c2ccc(C)cc2)C1 ZINC000467278452 881022421 /nfs/dbraw/zinc/02/24/21/881022421.db2.gz KSEWNLXNZHEDRD-AUSIDOKSSA-N 0 3 400.588 4.401 20 0 HIADHN C[C@@H](CC(=O)Nc1cccc(Cl)c1)NCc1cc(Cl)ccc1N1CCOCC1 ZINC000467336043 881086732 /nfs/dbraw/zinc/08/67/32/881086732.db2.gz NFUALBPOYCWZGA-HNNXBMFYSA-N 0 3 422.356 4.337 20 0 HIADHN CCc1nn(C)c(CC)c1CN(Cc1cccc(Br)c1)C1CCOCC1 ZINC000467350141 881104399 /nfs/dbraw/zinc/10/43/99/881104399.db2.gz NGIWDYASGAJNBO-UHFFFAOYSA-N 0 3 420.395 4.489 20 0 HIADHN C[C@H](Cc1cccc(C(F)(F)F)c1)N[C@H](c1nc(-c2nc[nH]n2)no1)C(C)(C)C ZINC000467351365 881106899 /nfs/dbraw/zinc/10/68/99/881106899.db2.gz BBCMJDOXPJNGCO-BXUZGUMPSA-N 0 3 408.428 4.182 20 0 HIADHN Brc1cccc(CN(Cc2cccc3nccn32)C2CCOCC2)c1 ZINC000467352366 881110782 /nfs/dbraw/zinc/11/07/82/881110782.db2.gz GNTAXPLGVHURSO-UHFFFAOYSA-N 0 3 400.320 4.278 20 0 HIADHN CSC[C@@H](NCCN1CCc2ccccc2C1=O)c1ccc(C(F)(F)F)cc1 ZINC000467398537 881182097 /nfs/dbraw/zinc/18/20/97/881182097.db2.gz JRJAQVXQVJYEOD-LJQANCHMSA-N 0 3 408.489 4.398 20 0 HIADHN CN(C(=O)CN[C@H](c1cccc(Br)c1)C1CCOCC1)C1CCCCC1 ZINC000467412179 881200096 /nfs/dbraw/zinc/20/00/96/881200096.db2.gz RFLFJSQLXNMHKS-NRFANRHFSA-N 0 3 423.395 4.298 20 0 HIADHN COc1ccc2c(c1)[C@@H](N[C@H](C)c1cc(F)ccc1N1CCN(C)CC1)CCS2 ZINC000467422236 881211014 /nfs/dbraw/zinc/21/10/14/881211014.db2.gz ZJOVUSCPFSVAAN-IERDGZPVSA-N 0 3 415.578 4.474 20 0 HIADHN Cc1ccc(S(=O)(=O)[N-]c2ccc(OCC[NH+](C)C)c(Cl)c2)cc1Cl ZINC000467440973 881241225 /nfs/dbraw/zinc/24/12/25/881241225.db2.gz ZSSPGAZUWLCOTD-UHFFFAOYSA-N 0 3 403.331 4.043 20 0 HIADHN C[C@H]1C[C@H](NC(=O)Nc2ccc(OCc3ccncc3)cc2)CN1Cc1ccccc1 ZINC000467464870 881276076 /nfs/dbraw/zinc/27/60/76/881276076.db2.gz QSPPASWLHLNZNM-CVDCTZTESA-N 0 3 416.525 4.445 20 0 HIADHN Cc1ccnc(-c2cccc(NC(=O)N[C@@H]3C[C@@H](C)N(Cc4ccccc4)C3)c2)n1 ZINC000467469554 881284833 /nfs/dbraw/zinc/28/48/33/881284833.db2.gz OSKPPHUVGYTBNN-XMSQKQJNSA-N 0 3 401.514 4.237 20 0 HIADHN CCc1nnc(-c2ccc(NC(=O)N[C@@H]3C[C@H](C)N(Cc4ccccc4)C3)cc2)o1 ZINC000467470959 881286878 /nfs/dbraw/zinc/28/68/78/881286878.db2.gz BBVADMHKRVWZGG-OXJNMPFZSA-N 0 3 405.502 4.084 20 0 HIADHN COc1ccc(NC(=O)N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)c(Br)c1 ZINC000467471270 881288426 /nfs/dbraw/zinc/28/84/26/881288426.db2.gz GLZIQRIODOTGTR-HOCLYGCPSA-N 0 3 418.335 4.242 20 0 HIADHN C[C@@H](Sc1ccccc1Cl)C(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000467492185 881309927 /nfs/dbraw/zinc/30/99/27/881309927.db2.gz LEQBQXCPPSACGM-MRXNPFEDSA-N 0 3 418.990 4.094 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)c1ccccc1Oc1ccccc1 ZINC000467508364 881321098 /nfs/dbraw/zinc/32/10/98/881321098.db2.gz QXLSUYWMZSDCSG-UHFFFAOYSA-N 0 3 416.521 4.366 20 0 HIADHN CS(=O)(=O)Nc1ccc(OCCNCc2ccc(-c3ccccc3)cc2F)cc1 ZINC000503587648 912672757 /nfs/dbraw/zinc/67/27/57/912672757.db2.gz WZGKJVVPVAOVBI-UHFFFAOYSA-N 0 3 414.502 4.033 20 0 HIADHN COC(=O)[C@](C)(CN[C@@H](C)C(=O)Nc1ccc(Cl)cc1Cl)c1ccccc1 ZINC000469066436 883144227 /nfs/dbraw/zinc/14/42/27/883144227.db2.gz SUBDVDJGPGIJFP-RNODOKPDSA-N 0 3 409.313 4.041 20 0 HIADHN c1ccc(C(OCCN2CCC[C@H](c3nnc4n3CCC4)C2)c2ccccc2)cc1 ZINC000503588462 912674603 /nfs/dbraw/zinc/67/46/03/912674603.db2.gz IKNOVDDJUYRIMM-QFIPXVFZSA-N 0 3 402.542 4.210 20 0 HIADHN C[C@H](CCCOc1ccccc1C(N)=O)N[C@H](c1cccc(F)c1)c1ccccn1 ZINC000469081182 883167325 /nfs/dbraw/zinc/16/73/25/883167325.db2.gz QCCHJFMSWGZYHS-UZUQRXQVSA-N 0 3 407.489 4.246 20 0 HIADHN C[C@H](N[C@@H]1CCCN(Cc2ccc(F)cc2F)C1=O)c1cccc(OC(F)F)c1 ZINC000469104206 883194276 /nfs/dbraw/zinc/19/42/76/883194276.db2.gz WSTDZOMHRIDBNO-ORAYPTAESA-N 0 3 410.411 4.408 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)N1CCN(Cc2ccccc2)C(C)(C)C1 ZINC000469189086 883289088 /nfs/dbraw/zinc/28/90/88/883289088.db2.gz NDLHNAJNYUQMFT-UHFFFAOYSA-N 0 3 405.542 4.231 20 0 HIADHN Cc1c(NC(=O)CCN2CCN(c3ccccc3)CC2)cccc1OCC(F)(F)F ZINC000469199686 883299162 /nfs/dbraw/zinc/29/91/62/883299162.db2.gz XUQIEABBOVEYKA-UHFFFAOYSA-N 0 3 421.463 4.087 20 0 HIADHN Cc1ccc(CN[C@@H](C)c2ccc3c(c2)C(C)(C)C(=O)N3)c(-n2cc(Cl)cn2)n1 ZINC000469208320 883307860 /nfs/dbraw/zinc/30/78/60/883307860.db2.gz LGJRBKHVBZDFQG-AWEZNQCLSA-N 0 3 409.921 4.310 20 0 HIADHN C[C@@H](NCc1ccc(S(C)(=O)=O)s1)[C@@H](C)Oc1ccc(Cl)cc1Cl ZINC000469269513 883368284 /nfs/dbraw/zinc/36/82/84/883368284.db2.gz UWNSSPXRKHSFRR-GHMZBOCLSA-N 0 3 408.372 4.404 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)NCC(C)(C)c1ccc(C(F)(F)F)cc1 ZINC000469275997 883373995 /nfs/dbraw/zinc/37/39/95/883373995.db2.gz FYXXXLOXQUUZEA-UHFFFAOYSA-N 0 3 422.495 4.151 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N[C@H]3C[C@@H]3c3ccccc3C(F)(F)F)cc2)CC1 ZINC000469322790 883427798 /nfs/dbraw/zinc/42/77/98/883427798.db2.gz SBXATQKZEBZOFT-CTNGQTDRSA-N 0 3 417.475 4.133 20 0 HIADHN C[C@@H]1CC[N@H+](CCOc2ccc(NC(=O)CCCc3ccc([O-])c(F)c3)cc2)C1 ZINC000469422050 883599868 /nfs/dbraw/zinc/59/98/68/883599868.db2.gz JWNYSCNLKUXCCQ-QGZVFWFLSA-N 0 3 400.494 4.213 20 0 HIADHN C[C@@H]1CC[N@@H+](CCOc2ccc(NC(=O)CCCc3ccc([O-])c(F)c3)cc2)C1 ZINC000469422050 883599898 /nfs/dbraw/zinc/59/98/98/883599898.db2.gz JWNYSCNLKUXCCQ-QGZVFWFLSA-N 0 3 400.494 4.213 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)NC[C@H]1CCO[C@H]1c1ccccc1 ZINC000469436284 883624921 /nfs/dbraw/zinc/62/49/21/883624921.db2.gz LNMOVEQEHGRKGL-SGNDLWITSA-N 0 3 409.574 4.220 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1ccc(Cl)c(N)c1Cl)c1cccc(OC)c1 ZINC000469443342 883635492 /nfs/dbraw/zinc/63/54/92/883635492.db2.gz VRISSCBMAUUWBG-KRWDZBQOSA-N 0 3 410.345 4.397 20 0 HIADHN CC(=O)c1ccc(SCC(=O)N[C@H](CN(C)Cc2ccccc2)C(C)C)cc1F ZINC000469478411 883710787 /nfs/dbraw/zinc/71/07/87/883710787.db2.gz RPFZBOXBSXXKEN-JOCHJYFZSA-N 0 3 416.562 4.393 20 0 HIADHN CN(C)Cc1ccc(NC(=O)c2cn[nH]c2-c2ccc(F)cc2)cc1Br ZINC000469484755 883719181 /nfs/dbraw/zinc/71/91/81/883719181.db2.gz XYNZIBUKXRABPQ-UHFFFAOYSA-N 0 3 417.282 4.292 20 0 HIADHN CN(C)Cc1ccc(NC(=O)c2cccc(CN3CCCC3)c2)cc1Br ZINC000469490189 883728657 /nfs/dbraw/zinc/72/86/57/883728657.db2.gz PKFZANTVCGTETK-UHFFFAOYSA-N 0 3 416.363 4.359 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)c1ccc(CNC(=O)C(C)(C)C)cc1 ZINC000469506500 883756943 /nfs/dbraw/zinc/75/69/43/883756943.db2.gz IEXNNLBEVRVZCU-HSZRJFAPSA-N 0 3 423.601 4.235 20 0 HIADHN COc1ccc(CN(Cc2cc(-c3cnn(C)c3)no2)C2CCCCC2)cc1OC ZINC000469522740 883793566 /nfs/dbraw/zinc/79/35/66/883793566.db2.gz XVIXVLNBGYRNRA-UHFFFAOYSA-N 0 3 410.518 4.427 20 0 HIADHN NC(=O)c1ccc(NC(=O)CCN2CCCC[C@H]2c2cccc(C(F)(F)F)c2)cc1 ZINC000469533066 883802764 /nfs/dbraw/zinc/80/27/64/883802764.db2.gz KZZYFGZNZDDELS-IBGZPJMESA-N 0 3 419.447 4.360 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(N[C@@H](C[N@H+](C)Cc3ccccc3)C(C)C)nc2)n1 ZINC000469550834 883810700 /nfs/dbraw/zinc/81/07/00/883810700.db2.gz ZLDXCYREOYNFAK-NRFANRHFSA-N 0 3 405.546 4.375 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(N[C@@H](C[N@@H+](C)Cc3ccccc3)C(C)C)nc2)n1 ZINC000469550834 883810701 /nfs/dbraw/zinc/81/07/01/883810701.db2.gz ZLDXCYREOYNFAK-NRFANRHFSA-N 0 3 405.546 4.375 20 0 HIADHN COc1cc(OC)c(OC)cc1CNC[C@H](c1cccc(C(F)(F)F)c1)N(C)C ZINC000469563133 883816067 /nfs/dbraw/zinc/81/60/67/883816067.db2.gz CGVRLTCYTOCGQS-QGZVFWFLSA-N 0 3 412.452 4.124 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)c1ccc(Cl)c(N)c1Cl ZINC000469629370 883841046 /nfs/dbraw/zinc/84/10/46/883841046.db2.gz BLLLAVHUWQAWQT-UHFFFAOYSA-N 0 3 402.272 4.058 20 0 HIADHN Cc1ccn(-c2ccccc2NC(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)n1 ZINC000469646896 883847297 /nfs/dbraw/zinc/84/72/97/883847297.db2.gz ALDUBRIFQZWUGY-HXUWFJFHSA-N 0 3 403.530 4.309 20 0 HIADHN FC(F)C(F)(F)COCCN1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1 ZINC000469715868 883883932 /nfs/dbraw/zinc/88/39/32/883883932.db2.gz BQMRZEVMYCJOJV-ZDUSSCGKSA-N 0 3 421.822 4.486 20 0 HIADHN Cc1ccc(NC(=O)NC[C@@H]2CCCN(CCOCC(F)(F)C(F)(F)F)C2)cc1 ZINC000469722145 883886299 /nfs/dbraw/zinc/88/62/99/883886299.db2.gz WCYFFAFFTDYTIC-HNNXBMFYSA-N 0 3 423.426 4.043 20 0 HIADHN Fc1ccc([C@H](Cn2cnc3ccccc32)NCCOCC(F)(F)C(F)F)cc1 ZINC000469767841 883940727 /nfs/dbraw/zinc/94/07/27/883940727.db2.gz ZSNAFWKLKQVFII-KRWDZBQOSA-N 0 3 413.390 4.423 20 0 HIADHN C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H](C)[C@H]1NCc1nc2c3ccccc3oc2c(=O)[n-]1 ZINC000469775866 883950714 /nfs/dbraw/zinc/95/07/14/883950714.db2.gz MURORKIGDDQYLT-YPGOJHLTSA-N 0 3 416.525 4.328 20 0 HIADHN C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1NCc1nc2c3ccccc3oc2c(=O)[n-]1 ZINC000469775866 883950724 /nfs/dbraw/zinc/95/07/24/883950724.db2.gz MURORKIGDDQYLT-YPGOJHLTSA-N 0 3 416.525 4.328 20 0 HIADHN COc1ccc([C@@H](CCC(C)C)NCc2cccc(C(=O)N3CCOCC3)c2)cc1 ZINC000469807709 883982931 /nfs/dbraw/zinc/98/29/31/883982931.db2.gz IDCLNGVHMAOVPY-XMMPIXPASA-N 0 3 410.558 4.435 20 0 HIADHN C[C@@H](NC(=O)N(CCN(C)C)Cc1ccccc1)c1ccc(OCC2CC2)c(F)c1 ZINC000469825438 884004850 /nfs/dbraw/zinc/00/48/50/884004850.db2.gz TWESXGUAQUZJCW-GOSISDBHSA-N 0 3 413.537 4.449 20 0 HIADHN O=C(CCc1ccc2ccccc2c1)NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000469839962 884020213 /nfs/dbraw/zinc/02/02/13/884020213.db2.gz WIXHQUWSCCLAQQ-VWLOTQADSA-N 0 3 402.538 4.180 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3ccc4c(c3)CC(C)(C)O4)CC2)C[C@@H](C)O1 ZINC000469845375 884027418 /nfs/dbraw/zinc/02/74/18/884027418.db2.gz BRRXLGZINKTTOL-QZTJIDSGSA-N 0 3 415.578 4.143 20 0 HIADHN O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)[C@H]1C[C@H]1c1cccc2ccccc21 ZINC000469848696 884031546 /nfs/dbraw/zinc/03/15/46/884031546.db2.gz MKQYSJZQXVJJQL-RZFJZAQRSA-N 0 3 414.549 4.351 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3ccccc3-n3ccc(C)n3)c(C)c2)CC1 ZINC000469851119 884036218 /nfs/dbraw/zinc/03/62/18/884036218.db2.gz KEJDWHJUCLZYQG-UHFFFAOYSA-N 0 3 418.545 4.275 20 0 HIADHN CO[C@@](C)(C(=O)Nc1cc(C)cc(N2CCN(C(C)C)CC2)c1)c1ccccc1F ZINC000469856205 884041254 /nfs/dbraw/zinc/04/12/54/884041254.db2.gz SAVVAYPBSMSLLN-XMMPIXPASA-N 0 3 413.537 4.165 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)Nc1ccc2c(c1)CC(C)(C)O2 ZINC000469863441 884052130 /nfs/dbraw/zinc/05/21/30/884052130.db2.gz RHXCQENMMMRBFZ-UHFFFAOYSA-N 0 3 403.473 4.274 20 0 HIADHN Cc1c(NC(=O)[C@H](C)N2CCCC3(CCCCC3)CC2)c(=O)n(-c2ccccc2)n1C ZINC000469866404 884056236 /nfs/dbraw/zinc/05/62/36/884056236.db2.gz QBMNDKFXQQJAEQ-FQEVSTJZSA-N 0 3 424.589 4.248 20 0 HIADHN O=C(N[C@H](C1CCCC1)C(F)(F)F)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000469922294 884113199 /nfs/dbraw/zinc/11/31/99/884113199.db2.gz ZMTCAAIRTWZMBU-YMAMQOFZSA-N 0 3 415.422 4.212 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)Nc1cc(Cl)ccc1N1CCCCC1 ZINC000503720570 912809333 /nfs/dbraw/zinc/80/93/33/912809333.db2.gz ZFGINUDLMCVURM-UHFFFAOYSA-N 0 3 415.969 4.321 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@@H]2NC(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)cc1 ZINC000470071101 884326467 /nfs/dbraw/zinc/32/64/67/884326467.db2.gz IATOXEMZAYNHPL-HCUBDLJJSA-N 0 3 407.558 4.350 20 0 HIADHN CCN1CCN(c2ccc(C(=O)NCc3cc(Cl)ccc3OC(F)F)cc2)CC1 ZINC000470107752 884366418 /nfs/dbraw/zinc/36/64/18/884366418.db2.gz NPNITPPJKZTPLL-UHFFFAOYSA-N 0 3 423.891 4.013 20 0 HIADHN CC[C@H](C)[C@@H](NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1)C(F)(F)F ZINC000470122378 884384323 /nfs/dbraw/zinc/38/43/23/884384323.db2.gz NQYLQRXJYHTSHO-KWCMIHLGSA-N 0 3 403.411 4.068 20 0 HIADHN CC(C)[C@H]1CCC[C@@H](NC(=O)NCc2ccccc2CN2CCC(O)CC2)CC1 ZINC000470163881 884440218 /nfs/dbraw/zinc/44/02/18/884440218.db2.gz PCZQKXCRPSCFSN-SIKLNZKXSA-N 0 3 401.595 4.047 20 0 HIADHN CNC(=O)C1CCN(Cc2ccc(Oc3cccc(Br)c3)cc2)CC1 ZINC000470178188 884460510 /nfs/dbraw/zinc/46/05/10/884460510.db2.gz ISDCTXVCPYNROG-UHFFFAOYSA-N 0 3 403.320 4.199 20 0 HIADHN Cc1onc(-c2ccc(C(F)(F)F)cc2)c1C(=O)NC[C@@H]1CCCCN1C1CC1 ZINC000470181177 884468910 /nfs/dbraw/zinc/46/89/10/884468910.db2.gz ZJTXFXZHIFNBSU-KRWDZBQOSA-N 0 3 407.436 4.416 20 0 HIADHN Cc1ccccc1-c1cc(NC(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)n(C)n1 ZINC000470188789 884486238 /nfs/dbraw/zinc/48/62/38/884486238.db2.gz ALUBIGMDQZHRCD-UHFFFAOYSA-N 0 3 417.557 4.178 20 0 HIADHN CCO[C@H](CCNC(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1)C(C)C ZINC000470190519 884489100 /nfs/dbraw/zinc/48/91/00/884489100.db2.gz NCDVXPAOGJVVKE-QUCCMNQESA-N 0 3 400.485 4.008 20 0 HIADHN CCO[C@@H](CCNC(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1)C(C)C ZINC000470190518 884489550 /nfs/dbraw/zinc/48/95/50/884489550.db2.gz NCDVXPAOGJVVKE-ICSRJNTNSA-N 0 3 400.485 4.008 20 0 HIADHN C[C@@H](NC(=O)CCN1CCN(c2ccccc2)CC1)c1ccc(-c2ccncc2)cc1 ZINC000470196134 884503094 /nfs/dbraw/zinc/50/30/94/884503094.db2.gz SFOKGXXNDZHLPW-OAQYLSRUSA-N 0 3 414.553 4.138 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)C1(c2cccc(F)c2)CCOCC1 ZINC000470199783 884512790 /nfs/dbraw/zinc/51/27/90/884512790.db2.gz GPEROCYVDJQSLT-HSZRJFAPSA-N 0 3 412.549 4.147 20 0 HIADHN CC1(C)CCCN(CCNC(=O)c2ccc(Br)cc2Br)C1 ZINC000470287537 884656296 /nfs/dbraw/zinc/65/62/96/884656296.db2.gz HDBAYTJZPCLYJL-UHFFFAOYSA-N 0 3 418.173 4.063 20 0 HIADHN Cc1ccc([C@H](Cc2ccccc2Br)N[C@H](C)C(=O)NCCF)cc1 ZINC000503883246 912849396 /nfs/dbraw/zinc/84/93/96/912849396.db2.gz CRLXDEJZFUEEJA-BEFAXECRSA-N 0 3 407.327 4.105 20 0 HIADHN CC(C)[C@@H]1CCC[C@@H](NC(=O)N(C)C2CCN(CCc3ccccn3)CC2)CC1 ZINC000470292976 884668170 /nfs/dbraw/zinc/66/81/70/884668170.db2.gz MFBDDDJHGFHPQS-IFMALSPDSA-N 0 3 400.611 4.335 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1ccccc1O[C@@H]1CCOC1)c1ccsc1 ZINC000470300267 884674153 /nfs/dbraw/zinc/67/41/53/884674153.db2.gz YSIHAOIUAQLJMD-IEBWSBKVSA-N 0 3 403.548 4.120 20 0 HIADHN CC1(C)[C@@H](C(F)(F)F)CCN1C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000470349864 884743065 /nfs/dbraw/zinc/74/30/65/884743065.db2.gz OSIYZLQMFBSGJT-KRWDZBQOSA-N 0 3 415.525 4.473 20 0 HIADHN CCCN1CCC[C@@H]1C(=O)N1CCC[C@H](c2nc(-c3ccccc3OC)cs2)C1 ZINC000470417759 884821065 /nfs/dbraw/zinc/82/10/65/884821065.db2.gz HUAFZZHTZSJGLE-FXAWDEMLSA-N 0 3 413.587 4.399 20 0 HIADHN Cc1cc(C(=O)Nc2ccc(C(=O)N(C)[C@H]3CCCN(C)C3)cc2)c(Cl)cc1F ZINC000470467728 884859945 /nfs/dbraw/zinc/85/99/45/884859945.db2.gz QNNJDCXXIQZDQQ-KRWDZBQOSA-N 0 3 417.912 4.206 20 0 HIADHN C[C@H]1CN(C2CCOCC2)CCN1C(=O)CCCCc1ccc(Cl)c(Cl)c1 ZINC000470503215 884892205 /nfs/dbraw/zinc/89/22/05/884892205.db2.gz ONJAAQYUPSYWLP-INIZCTEOSA-N 0 3 413.389 4.418 20 0 HIADHN COC[C@H](C)Oc1ccc(Cl)cc1NC(=O)NC[C@H](c1ccccc1)N(C)C ZINC000470535072 884935212 /nfs/dbraw/zinc/93/52/12/884935212.db2.gz XUXKBNVWRXJTHS-HNAYVOBHSA-N 0 3 405.926 4.178 20 0 HIADHN CCOc1c(Cl)cc(C(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)cc1OC ZINC000470660314 885084894 /nfs/dbraw/zinc/08/48/94/885084894.db2.gz ICAXEEHSMCIRRX-IBGZPJMESA-N 0 3 416.949 4.484 20 0 HIADHN CN(C(=O)Cc1ccc(F)c(Br)c1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470661723 885087095 /nfs/dbraw/zinc/08/70/95/885087095.db2.gz GMMYCJRDWGKBHK-GOSISDBHSA-N 0 3 419.338 4.254 20 0 HIADHN Cc1nc2c(cnn2C(C)C)cc1C(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470664753 885092353 /nfs/dbraw/zinc/09/23/53/885092353.db2.gz AXTMIVBIMKBQRE-NRFANRHFSA-N 0 3 405.546 4.057 20 0 HIADHN CN(C(=O)c1ccc(OCc2ccncc2)cc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470675011 885104860 /nfs/dbraw/zinc/10/48/60/885104860.db2.gz OHOFKMYZIZRCOY-XMMPIXPASA-N 0 3 415.537 4.397 20 0 HIADHN CC(=O)CCc1ccc(O[C@H](C)C(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000470678143 885108669 /nfs/dbraw/zinc/10/86/69/885108669.db2.gz JIWYZNPQUVWGHE-QPPBQGQZSA-N 0 3 422.569 4.099 20 0 HIADHN Cc1nn(CC(C)C)c(C)c1CCC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470677144 885108956 /nfs/dbraw/zinc/10/89/56/885108956.db2.gz HFGAGURHXHRGHC-HSZRJFAPSA-N 0 3 410.606 4.212 20 0 HIADHN Cc1noc2nc(C(C)C)cc(C(=O)N(C)[C@@H]3CCCN(Cc4ccccc4)C3)c12 ZINC000470681494 885114405 /nfs/dbraw/zinc/11/44/05/885114405.db2.gz IEGRZHBUYGJJLF-LJQANCHMSA-N 0 3 406.530 4.391 20 0 HIADHN CN(C(=O)N[C@@H]1CCCOc2ccc(F)cc21)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470720283 885164355 /nfs/dbraw/zinc/16/43/55/885164355.db2.gz RWXCCCBVMOFLNT-RBBKRZOGSA-N 0 3 411.521 4.345 20 0 HIADHN O=C(c1cccc(Cl)c1)N1CCCN(C[C@H](O)Cc2ccc3ccccc3c2)CC1 ZINC000470720686 885166563 /nfs/dbraw/zinc/16/65/63/885166563.db2.gz YCQMDZSABNYSRY-XMMPIXPASA-N 0 3 422.956 4.245 20 0 HIADHN CC(C)COC[C@H](NC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1)c1ccco1 ZINC000470728858 885179974 /nfs/dbraw/zinc/17/99/74/885179974.db2.gz CAPRCCHLKZUTKU-YADHBBJMSA-N 0 3 413.562 4.299 20 0 HIADHN CC(C)COC[C@@H](NC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1)c1ccco1 ZINC000470728855 885180134 /nfs/dbraw/zinc/18/01/34/885180134.db2.gz CAPRCCHLKZUTKU-FCHUYYIVSA-N 0 3 413.562 4.299 20 0 HIADHN C[C@H](C(=O)NCCc1nc2ccccc2s1)N1CCC(Cc2ccccc2)CC1 ZINC000470772573 885239244 /nfs/dbraw/zinc/23/92/44/885239244.db2.gz KXQXIMBTSCHQMF-GOSISDBHSA-N 0 3 407.583 4.298 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCC(n2cc(Cl)cn2)CC1)c1ccsc1 ZINC000504010487 912917049 /nfs/dbraw/zinc/91/70/49/912917049.db2.gz NUOHXZHKUVRCKM-GOSISDBHSA-N 0 3 409.987 4.028 20 0 HIADHN CN(C(=O)NC[C@@H]1CCCO[C@@H]1C(C)(C)C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470882247 885373995 /nfs/dbraw/zinc/37/39/95/885373995.db2.gz DCXOBQXHIFUWKA-BDTNDASRSA-N 0 3 401.595 4.134 20 0 HIADHN CO[C@@H](CNC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1)c1ccc(Cl)cc1 ZINC000470894996 885392966 /nfs/dbraw/zinc/39/29/66/885392966.db2.gz PRCLRYZXNIQARG-VXKWHMMOSA-N 0 3 415.965 4.334 20 0 HIADHN CN(Cc1cccc(OC(F)(F)F)c1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000470899174 885399762 /nfs/dbraw/zinc/39/97/62/885399762.db2.gz HGAXXQNFVMYXBX-GOSISDBHSA-N 0 3 407.436 4.001 20 0 HIADHN Cc1nc2ccc(C(=O)N(CCN(C)C)Cc3ccc(Br)cc3)cc2o1 ZINC000470931243 885433839 /nfs/dbraw/zinc/43/38/39/885433839.db2.gz KAVFEMPRJFCPLJ-UHFFFAOYSA-N 0 3 416.319 4.103 20 0 HIADHN O=C1[C@@H](N2CCCCC[C@H]2c2ccc(C(F)(F)F)cc2)CCN1C1CCOCC1 ZINC000471005106 885505329 /nfs/dbraw/zinc/50/53/29/885505329.db2.gz JSXIMUIFCLRQIS-PMACEKPBSA-N 0 3 410.480 4.402 20 0 HIADHN CN1CCN(CC(=O)Nc2cc(C(C)(C)C)nn2-c2ccccc2)C2(CCCCC2)C1 ZINC000471040177 885551066 /nfs/dbraw/zinc/55/10/66/885551066.db2.gz YTMNKDOGRBPCDC-UHFFFAOYSA-N 0 3 423.605 4.059 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)NCCc2ccc3[nH]ccc3c2)N(C)C)cc1 ZINC000504043405 912949648 /nfs/dbraw/zinc/94/96/48/912949648.db2.gz QNLCULCJUAYVLN-QHCPKHFHSA-N 0 3 408.546 4.100 20 0 HIADHN CC(C)(C)OC(=O)CCC(C)(C)NC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000471097493 885628383 /nfs/dbraw/zinc/62/83/83/885628383.db2.gz DZNRYQRZHDUTNC-GOSISDBHSA-N 0 3 406.542 4.054 20 0 HIADHN COc1ccc(NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cc1Cl ZINC000471133627 885673361 /nfs/dbraw/zinc/67/33/61/885673361.db2.gz MSDHSAVISIOUSK-UHFFFAOYSA-N 0 3 405.848 4.275 20 0 HIADHN Cc1cccc(I)c1C(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C ZINC000471139724 885682929 /nfs/dbraw/zinc/68/29/29/885682929.db2.gz KBROLAINIOASLR-KSSFIOAISA-N 0 3 422.310 4.021 20 0 HIADHN COc1ccc(CN(C)CCC(=O)N[C@@H](c2cccs2)c2ccccc2)cc1O ZINC000471182775 885750573 /nfs/dbraw/zinc/75/05/73/885750573.db2.gz UAZQYIIOBHVFOU-HSZRJFAPSA-N 0 3 410.539 4.190 20 0 HIADHN COc1ccc(CN(C)CCC(=O)N[C@H](c2cccs2)c2ccccc2)cc1O ZINC000471182776 885750723 /nfs/dbraw/zinc/75/07/23/885750723.db2.gz UAZQYIIOBHVFOU-QHCPKHFHSA-N 0 3 410.539 4.190 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N3CCCSc4ccc(F)cc43)cc2)CC1 ZINC000471236080 885811057 /nfs/dbraw/zinc/81/10/57/885811057.db2.gz INIZAHFCYAUDNE-UHFFFAOYSA-N 0 3 413.562 4.499 20 0 HIADHN CSc1nc(C(C)(C)C)nc(C)c1C(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000471330445 885928940 /nfs/dbraw/zinc/92/89/40/885928940.db2.gz KKJXOYWSTSNGAG-SJLPKXTDSA-N 0 3 412.603 4.370 20 0 HIADHN Cc1c(NC(=O)NC[C@@H](c2cccs2)N2CCCC2)cccc1NC(=O)N(C)C ZINC000471353947 885972327 /nfs/dbraw/zinc/97/23/27/885972327.db2.gz PRGDTDBWGBZKGW-SFHVURJKSA-N 0 3 415.563 4.109 20 0 HIADHN O=C(Nc1ccc(N2CCCCC2)c2ncccc12)N1CCN(C2CCCC2)CC1 ZINC000471422166 886078065 /nfs/dbraw/zinc/07/80/65/886078065.db2.gz NMXXVLCGVLVZTM-UHFFFAOYSA-N 0 3 407.562 4.317 20 0 HIADHN C[C@H](NC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1)c1ccccc1-n1cccn1 ZINC000471487163 886184477 /nfs/dbraw/zinc/18/44/77/886184477.db2.gz GCWYRVSUPOSOHC-UNMCSNQZSA-N 0 3 417.557 4.239 20 0 HIADHN C[C@H](NC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1)c1ccccc1-n1cccn1 ZINC000471487162 886185363 /nfs/dbraw/zinc/18/53/63/886185363.db2.gz GCWYRVSUPOSOHC-RBBKRZOGSA-N 0 3 417.557 4.239 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N[C@@H]1CC[C@@H]2CCCC[C@H]2C1 ZINC000471506808 886207023 /nfs/dbraw/zinc/20/70/23/886207023.db2.gz JRBKLULEDYMYQN-JASNYYMHSA-N 0 3 401.517 4.450 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N[C@@H]1CC[C@H]2CCCC[C@H]2C1 ZINC000471506809 886207807 /nfs/dbraw/zinc/20/78/07/886207807.db2.gz JRBKLULEDYMYQN-MDSLRYRQSA-N 0 3 401.517 4.450 20 0 HIADHN Cc1ccc(C(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)cc1NC(=O)c1ccco1 ZINC000471527648 886230833 /nfs/dbraw/zinc/23/08/33/886230833.db2.gz CXQFSTJUGPBSQX-HTAPYJJXSA-N 0 3 405.498 4.262 20 0 HIADHN CC(=O)Nc1cc(C(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)cc(C(F)(F)F)c1 ZINC000471528748 886233041 /nfs/dbraw/zinc/23/30/41/886233041.db2.gz GILQRNALZDWGNU-DJJJIMSYSA-N 0 3 407.436 4.085 20 0 HIADHN Cc1cccc(NC(=O)N2CCC[C@H](C(=O)N[C@H](C)[C@H](c3ccccc3)N(C)C)C2)c1 ZINC000471530684 886235474 /nfs/dbraw/zinc/23/54/74/886235474.db2.gz LWLKDLWKYSXLTJ-UNWVZKJWSA-N 0 3 422.573 4.047 20 0 HIADHN C[C@@H](NC(=O)CCc1nc(-c2ccc(Cl)cc2)no1)[C@@H](c1ccccc1)N(C)C ZINC000471535162 886240531 /nfs/dbraw/zinc/24/05/31/886240531.db2.gz DUQXNXORIFWUTK-VFNWGFHPSA-N 0 3 412.921 4.130 20 0 HIADHN C[C@@H](NC(=O)CCc1ncc(-c2ccc(F)cc2F)o1)[C@H](c1ccccc1)N(C)C ZINC000471541791 886247569 /nfs/dbraw/zinc/24/75/69/886247569.db2.gz MJWZKEBKDXOJED-IQMFZBJNSA-N 0 3 413.468 4.360 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CC[C@H](C(F)(F)F)[C@H]1C)c1cccc(OC)c1 ZINC000471546003 886252862 /nfs/dbraw/zinc/25/28/62/886252862.db2.gz HSCIEVWZSMYKOS-FHLIZLRMSA-N 0 3 401.473 4.060 20 0 HIADHN C[C@H](CNC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1ccc(F)cc1 ZINC000471721548 886432020 /nfs/dbraw/zinc/43/20/20/886432020.db2.gz VSRHPBBJMQFWKY-NLNFPOJYSA-N 0 3 401.448 4.034 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)Nc3ccnc(-c4ccccc4)c3)CC2)C[C@H](C)O1 ZINC000504163969 913052627 /nfs/dbraw/zinc/05/26/27/913052627.db2.gz VAOQKDCRQOELLV-OALUTQOASA-N 0 3 408.546 4.102 20 0 HIADHN COC(=O)c1cc(NC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)c(C)cc1C ZINC000471840841 886601645 /nfs/dbraw/zinc/60/16/45/886601645.db2.gz VKYWDOQHEPWUPT-IBGZPJMESA-N 0 3 409.530 4.218 20 0 HIADHN Cc1cn([C@H](C)c2ccccc2)nc1NC(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C ZINC000471864333 886641158 /nfs/dbraw/zinc/64/11/58/886641158.db2.gz ROPWYUAPXCMQKN-KKLQWCBXSA-N 0 3 417.557 4.443 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N[C@H]1CCC[C@@H]1c1ccccc1 ZINC000471871397 886650427 /nfs/dbraw/zinc/65/04/27/886650427.db2.gz LHZXMIAGWFPUIJ-TUNPWDSISA-N 0 3 409.496 4.427 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N[C@@H]1CCC[C@H]1c1ccccc1 ZINC000471871394 886650588 /nfs/dbraw/zinc/65/05/88/886650588.db2.gz LHZXMIAGWFPUIJ-GHBBCFCZSA-N 0 3 409.496 4.427 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N[C@H]1CCC[C@H]1c1ccccc1 ZINC000471871395 886651005 /nfs/dbraw/zinc/65/10/05/886651005.db2.gz LHZXMIAGWFPUIJ-GUMHCPJTSA-N 0 3 409.496 4.427 20 0 HIADHN C[C@H](NC(=O)N(CCN(C)C)Cc1ccccn1)c1cc(F)c(Cl)cc1Cl ZINC000504186521 913068582 /nfs/dbraw/zinc/06/85/82/913068582.db2.gz IVDWRUFAHDMBAZ-ZDUSSCGKSA-N 0 3 413.324 4.362 20 0 HIADHN O=C(N[C@@H](Cc1ccccc1)C1CC1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000471911485 886697496 /nfs/dbraw/zinc/69/74/96/886697496.db2.gz QKPLJJHLMSCFKD-MHJFOBGBSA-N 0 3 409.496 4.112 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2cc(C(C)(C)C)nn2-c2ccccn2)[C@@H]1c1ccccc1 ZINC000471943941 886745095 /nfs/dbraw/zinc/74/50/95/886745095.db2.gz PBKQUCCNMJMPLX-AVRDEDQJSA-N 0 3 418.545 4.132 20 0 HIADHN CC(=O)c1c(C)[nH]c(C(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)c1C(C)C ZINC000504199153 913080725 /nfs/dbraw/zinc/08/07/25/913080725.db2.gz KGNYTIDVAQSRNL-UHFFFAOYSA-N 0 3 410.562 4.432 20 0 HIADHN COC[C@H](C)Oc1ccc(Cl)cc1NC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000471965431 886795039 /nfs/dbraw/zinc/79/50/39/886795039.db2.gz DNYQGCPWLRFSIT-XERREHJYSA-N 0 3 417.937 4.321 20 0 HIADHN COC[C@H](C)Oc1ccc(Cl)cc1NC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000471965428 886795283 /nfs/dbraw/zinc/79/52/83/886795283.db2.gz DNYQGCPWLRFSIT-RRMPHLOHSA-N 0 3 417.937 4.321 20 0 HIADHN COc1cc(NC(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)ccc1Br ZINC000471983305 886811135 /nfs/dbraw/zinc/81/11/35/886811135.db2.gz HXHBVZCSJVEGEN-FUHWJXTLSA-N 0 3 404.308 4.025 20 0 HIADHN CCCCO[C@@H]1C[C@H](NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)C1(C)C ZINC000471991341 886817701 /nfs/dbraw/zinc/81/77/01/886817701.db2.gz HYSLIDCSKVYYED-ZGUYJTEBSA-N 0 3 419.532 4.075 20 0 HIADHN Cc1c(C(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)[nH]c2c1C(=O)CC(C)(C)C2 ZINC000504199694 913083228 /nfs/dbraw/zinc/08/32/28/913083228.db2.gz QWMCUAUESKFREA-UHFFFAOYSA-N 0 3 422.573 4.261 20 0 HIADHN CSc1ccc(F)cc1CNC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472003670 886828604 /nfs/dbraw/zinc/82/86/04/886828604.db2.gz UTDQFHIOPMMQJS-UHFFFAOYSA-N 0 3 419.488 4.152 20 0 HIADHN Cc1cc(C)cc(C[C@H](C)NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)c1 ZINC000472015459 886837954 /nfs/dbraw/zinc/83/79/54/886837954.db2.gz CBTOJHWHRCIISR-DZIBYMRMSA-N 0 3 411.512 4.339 20 0 HIADHN Cc1ccc2[nH]c(CNCc3ccccc3CS(=O)(=O)N3CCCC3)cc2c1C ZINC000472054718 886866048 /nfs/dbraw/zinc/86/60/48/886866048.db2.gz MKYKTUROQJIPPV-UHFFFAOYSA-N 0 3 411.571 4.000 20 0 HIADHN C[C@@H](CCN1CCN(C)CC1)NC(=O)c1ccc(Sc2ccc(Cl)cc2)cc1 ZINC000472086896 886886460 /nfs/dbraw/zinc/88/64/60/886886460.db2.gz ZJDJSUOVDKZFRK-KRWDZBQOSA-N 0 3 418.006 4.247 20 0 HIADHN C[C@H](CCN1CCN(C)CC1)NC(=O)c1cc2c(s1)-c1ccccc1C(C)(C)C2 ZINC000472087091 886886633 /nfs/dbraw/zinc/88/66/33/886886633.db2.gz QIIWKSWBLXCXEH-QGZVFWFLSA-N 0 3 411.615 4.005 20 0 HIADHN C[C@@H](CCN1CCN(C)CC1)NC(=O)c1cc(Cl)ccc1Oc1ccc(F)cc1 ZINC000472087315 886886711 /nfs/dbraw/zinc/88/67/11/886886711.db2.gz RLQZTAZQSTXCOB-INIZCTEOSA-N 0 3 419.928 4.027 20 0 HIADHN COCCC1(CNC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)CCCCC1 ZINC000472183225 886983036 /nfs/dbraw/zinc/98/30/36/886983036.db2.gz YZYBEODFZXWQNS-UHFFFAOYSA-N 0 3 419.532 4.078 20 0 HIADHN Cc1ccccc1Oc1ccccc1CNC(=O)N(CCN(C)C)Cc1ccccn1 ZINC000504248655 913114134 /nfs/dbraw/zinc/11/41/34/913114134.db2.gz YXWXNEQPQSKITA-UHFFFAOYSA-N 0 3 418.541 4.456 20 0 HIADHN COCc1c(Br)cccc1NC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000472314088 887144599 /nfs/dbraw/zinc/14/45/99/887144599.db2.gz LYVDFMMKNHOGFP-RBUKOAKNSA-N 0 3 418.335 4.162 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2ccc(F)cc2OCC(F)(F)F)[C@H]1c1ccccc1 ZINC000472342086 887176611 /nfs/dbraw/zinc/17/66/11/887176611.db2.gz YBBUSHKUGANBHG-FUHWJXTLSA-N 0 3 411.399 4.334 20 0 HIADHN CCN(CC)C(=O)c1cccc(NC(=O)CN2CC[C@@H](Cc3ccccc3)[C@@H]2C)c1 ZINC000472355135 887190767 /nfs/dbraw/zinc/19/07/67/887190767.db2.gz KIDIXWBUTJRIGF-FPOVZHCZSA-N 0 3 407.558 4.060 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N1CC[C@@H](c2cccc(F)c2)C1 ZINC000472444946 887295299 /nfs/dbraw/zinc/29/52/99/887295299.db2.gz UFKUBGGFFSPKLH-VNCLNFNDSA-N 0 3 413.459 4.130 20 0 HIADHN CCOc1ccc(CN(C)C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cc1 ZINC000472445613 887297265 /nfs/dbraw/zinc/29/72/65/887297265.db2.gz XHZASAZTENUUBJ-UHFFFAOYSA-N 0 3 413.484 4.032 20 0 HIADHN COc1ccc([C@H](C)N(C)C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cc1 ZINC000472446409 887298807 /nfs/dbraw/zinc/29/88/07/887298807.db2.gz IXTVWLQFZWDGGY-NNGSBXSVSA-N 0 3 413.484 4.203 20 0 HIADHN Cc1cc(C)c2c(c1)CN(C(=O)NC1CC(N3CCC(C(F)(F)F)CC3)C1)CC2 ZINC000472447541 887300411 /nfs/dbraw/zinc/30/04/11/887300411.db2.gz DVBIIJJTXDAIPT-UHFFFAOYSA-N 0 3 409.496 4.176 20 0 HIADHN COCCC[C@H](Cc1ccccc1)NC(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000472455416 887309527 /nfs/dbraw/zinc/30/95/27/887309527.db2.gz QCLAMLBDYNKUSF-XMMPIXPASA-N 0 3 423.601 4.330 20 0 HIADHN CN(Cc1ccccc1Cl)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472455663 887310976 /nfs/dbraw/zinc/31/09/76/887310976.db2.gz LPMGNBLPLQWDIK-UHFFFAOYSA-N 0 3 403.876 4.287 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N(Cc1ccc(F)cc1)C1CC1 ZINC000472461562 887320063 /nfs/dbraw/zinc/32/00/63/887320063.db2.gz ZYCMWFAJGCSSPZ-UHFFFAOYSA-N 0 3 413.459 4.305 20 0 HIADHN Cc1ccc([C@H](NC(=O)N(CCN(C)C)Cc2cccc(F)c2)c2ccccn2)cc1 ZINC000472484108 887349413 /nfs/dbraw/zinc/34/94/13/887349413.db2.gz IPRJSPPMHVXUFT-DEOSSOPVSA-N 0 3 420.532 4.392 20 0 HIADHN CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)N[C@@H]1CC[C@H](c2ccc(F)cc2)C1 ZINC000472527996 887399322 /nfs/dbraw/zinc/39/93/22/887399322.db2.gz NSIBRFMZMUKSND-MHADKKCISA-N 0 3 410.537 4.191 20 0 HIADHN CCN1CCN(c2cccc(NCc3cc(Br)c(OC)s3)c2)CC1 ZINC000472606160 887476980 /nfs/dbraw/zinc/47/69/80/887476980.db2.gz AIXUHRSYBDJYLU-UHFFFAOYSA-N 0 3 410.381 4.273 20 0 HIADHN CN(C(=O)Nc1ccc(OC[C@@H]2CCCO2)cc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000472676728 887531165 /nfs/dbraw/zinc/53/11/65/887531165.db2.gz IHJIBGJWGUBHOV-VWNXMTODSA-N 0 3 423.557 4.373 20 0 HIADHN CN(C(=O)Nc1ccc(OC[C@H]2CCCO2)cc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000472676725 887531247 /nfs/dbraw/zinc/53/12/47/887531247.db2.gz IHJIBGJWGUBHOV-LADGPHEKSA-N 0 3 423.557 4.373 20 0 HIADHN CC(C)CNC(=O)c1ccc(NC(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000472707971 887559470 /nfs/dbraw/zinc/55/94/70/887559470.db2.gz MBHMWYQVKRQOJL-HSZRJFAPSA-N 0 3 422.573 4.201 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)C[C@H](C)C(=O)c3ccc(Cl)cc3)c2)CC1 ZINC000472753494 887599013 /nfs/dbraw/zinc/59/90/13/887599013.db2.gz OTGFLDXBGMDZFN-KRWDZBQOSA-N 0 3 413.949 4.330 20 0 HIADHN CCN(C(=O)NC[C@H](c1cccs1)N1CCCC1)[C@@H](COC)Cc1ccccc1 ZINC000472916398 887762615 /nfs/dbraw/zinc/76/26/15/887762615.db2.gz DVTQHCZMWLDNPC-NHCUHLMSSA-N 0 3 415.603 4.174 20 0 HIADHN CN(C)[C@@H](CNC(=O)Nc1ccc(F)cc1-c1nc(C2CC2)no1)c1ccccc1 ZINC000472933517 887784086 /nfs/dbraw/zinc/78/40/86/887784086.db2.gz YWRYHFRNKCRPPP-IBGZPJMESA-N 0 3 409.465 4.178 20 0 HIADHN Cc1ncsc1CN(C)C[C@H]1CCN(C(=O)c2cc(F)ccc2-c2ccoc2)C1 ZINC000473018200 887845056 /nfs/dbraw/zinc/84/50/56/887845056.db2.gz YPHLZTMSCLGABB-MRXNPFEDSA-N 0 3 413.518 4.445 20 0 HIADHN COC(=O)C(C)(C)c1ccc(NC(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000473046948 887869435 /nfs/dbraw/zinc/86/94/35/887869435.db2.gz FAFMYHHVSQCEPA-JOCHJYFZSA-N 0 3 423.557 4.266 20 0 HIADHN COc1cc(CN2CCSC3(CCOCC3)C2)ccc1OCc1cccs1 ZINC000473073411 887891953 /nfs/dbraw/zinc/89/19/53/887891953.db2.gz TUIJIHUZBZWIHW-UHFFFAOYSA-N 0 3 405.585 4.434 20 0 HIADHN COc1ccc(CN2CC[C@@]3(C2)OCc2ccccc23)cc1OCc1cccnc1 ZINC000473128486 887919924 /nfs/dbraw/zinc/91/99/24/887919924.db2.gz NZGPLTBNDUMGLI-VWLOTQADSA-N 0 3 402.494 4.301 20 0 HIADHN CCOc1ccc(CNC(=O)N(CCN(C)C)Cc2ccccc2F)cc1Cl ZINC000504361321 913192843 /nfs/dbraw/zinc/19/28/43/913192843.db2.gz CORMQQHFXHRCMG-UHFFFAOYSA-N 0 3 407.917 4.151 20 0 HIADHN Cn1c2ccccc2nc1C(C)(C)NCCc1nc2sc3c(c2c(N)n1)CCCC3 ZINC000473156260 887935778 /nfs/dbraw/zinc/93/57/78/887935778.db2.gz BBPGZELIURPBSW-UHFFFAOYSA-N 0 3 420.586 4.106 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)C3(c4ccc(C(F)(F)F)cc4)CC3)CC2)C[C@H](C)O1 ZINC000473185406 887965415 /nfs/dbraw/zinc/96/54/15/887965415.db2.gz XCKZSXILFZLWKT-IRXDYDNUSA-N 0 3 424.507 4.085 20 0 HIADHN O=C(Nc1cccc2c1CN(CC(F)(F)F)C2)c1cccc(CN2CCCC2)c1 ZINC000473257462 888021200 /nfs/dbraw/zinc/02/12/00/888021200.db2.gz OQINTUXRTXTFIT-UHFFFAOYSA-N 0 3 403.448 4.413 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@H](C)C1NC(=O)CCC(=O)c1ccc(F)c(F)c1 ZINC000473278676 888035286 /nfs/dbraw/zinc/03/52/86/888035286.db2.gz SSYNXDMEZYYCES-IRXDYDNUSA-N 0 3 414.496 4.201 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)C[C@@H](c3cccs3)n3cccc3)cc2)CC1 ZINC000473281333 888036966 /nfs/dbraw/zinc/03/69/66/888036966.db2.gz ZIPWVFOBODETJB-QFIPXVFZSA-N 0 3 422.598 4.305 20 0 HIADHN COc1ccc([C@@H](CNC(=O)C[C@@H](c2cccs2)n2cccc2)N2CCCC2)cc1 ZINC000473291106 888043788 /nfs/dbraw/zinc/04/37/88/888043788.db2.gz JRJZHCFYOXNTQO-FCHUYYIVSA-N 0 3 423.582 4.491 20 0 HIADHN COc1c(CNC(=O)NC[C@@H](c2cccc(OC)c2)N2CCCC2)oc2ccccc21 ZINC000473475157 888199368 /nfs/dbraw/zinc/19/93/68/888199368.db2.gz NDFXYGCTLUDHAV-FQEVSTJZSA-N 0 3 423.513 4.086 20 0 HIADHN Cc1c(C(=O)N2CC[C@]3(C2)CCCN(Cc2ccccc2)C3)oc2c1C(=O)CCC2 ZINC000473494675 888217118 /nfs/dbraw/zinc/21/71/18/888217118.db2.gz BDBPMSVDMHDHGO-RUZDIDTESA-N 0 3 406.526 4.235 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)[C@@H]1CCCC[C@@H]1C(F)(F)F ZINC000473512301 888240445 /nfs/dbraw/zinc/24/04/45/888240445.db2.gz JZKXVTRTQFJSQU-CVSAEHQPSA-N 0 3 400.407 4.277 20 0 HIADHN COc1ccc(C(=O)CCC(=O)N2CC[C@]3(C2)CCCN(Cc2ccccc2)C3)cc1 ZINC000473514924 888245587 /nfs/dbraw/zinc/24/55/87/888245587.db2.gz LWTYIOBQWZMYIQ-AREMUKBSSA-N 0 3 420.553 4.173 20 0 HIADHN Cc1nc(-c2ccco2)ccc1C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473515449 888247547 /nfs/dbraw/zinc/24/75/47/888247547.db2.gz XVQLVMRTAZCIQE-UHFFFAOYSA-N 0 3 407.436 4.185 20 0 HIADHN CC(C)(C)c1ccc(OCC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cc1 ZINC000473516800 888248504 /nfs/dbraw/zinc/24/85/04/888248504.db2.gz DPAVTXAYAANYSD-UHFFFAOYSA-N 0 3 412.496 4.284 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1c[nH]cc1-c1ccc(F)cc1 ZINC000473518515 888250879 /nfs/dbraw/zinc/25/08/79/888250879.db2.gz FDCAGXJSFRVZGF-UHFFFAOYSA-N 0 3 409.427 4.356 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)C1(c2ccc(F)cc2F)CCC1 ZINC000473519410 888252251 /nfs/dbraw/zinc/25/22/51/888252251.db2.gz NLWTUMZHJZUWQC-UHFFFAOYSA-N 0 3 416.434 4.308 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)C1CCC(C(F)(F)F)CC1 ZINC000473520783 888255761 /nfs/dbraw/zinc/25/57/61/888255761.db2.gz DDDRPKBLLYPOSG-UHFFFAOYSA-N 0 3 400.407 4.277 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1ccc(Br)c(F)c1 ZINC000473521690 888257558 /nfs/dbraw/zinc/25/75/58/888257558.db2.gz KCMWKCJEVGABKA-UHFFFAOYSA-N 0 3 423.248 4.123 20 0 HIADHN CC(C)c1cccc(O[C@H](C)C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)c1 ZINC000473525563 888261270 /nfs/dbraw/zinc/26/12/70/888261270.db2.gz QHDDGBXDVFRPML-VNCLNFNDSA-N 0 3 412.496 4.499 20 0 HIADHN O=C(CCc1cnc2ccccc2c1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473525569 888261306 /nfs/dbraw/zinc/26/13/06/888261306.db2.gz QHNUFMKPKGJXOB-UHFFFAOYSA-N 0 3 405.464 4.089 20 0 HIADHN COc1ccc(CCC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cc1Cl ZINC000473525697 888261378 /nfs/dbraw/zinc/26/13/78/888261378.db2.gz ZGVZZKGQRHNVSJ-UHFFFAOYSA-N 0 3 418.887 4.203 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1ncsc1-c1ccccc1 ZINC000473526824 888262991 /nfs/dbraw/zinc/26/29/91/888262991.db2.gz YSURHGUXFAECML-UHFFFAOYSA-N 0 3 409.477 4.345 20 0 HIADHN O=C(Cc1c[nH]c2ccc(Cl)cc12)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473535275 888273062 /nfs/dbraw/zinc/27/30/62/888273062.db2.gz SFTVOIGLEVZXHE-UHFFFAOYSA-N 0 3 413.871 4.285 20 0 HIADHN CN1CCN(CCC(C)(C)NC(=O)Nc2ccc(SC3CCCC3)cc2)CC1 ZINC000473639304 888382691 /nfs/dbraw/zinc/38/26/91/888382691.db2.gz HNTKFFPZVCJZPM-UHFFFAOYSA-N 0 3 404.624 4.259 20 0 HIADHN CC(=O)Nc1ccc(C)c(C(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)c1 ZINC000473645536 888391253 /nfs/dbraw/zinc/39/12/53/888391253.db2.gz UTQULXRLPAAQMQ-UHFFFAOYSA-N 0 3 421.463 4.176 20 0 HIADHN Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)N[C@@H](C)CCN1CCN(C)CC1 ZINC000473668181 888425880 /nfs/dbraw/zinc/42/58/80/888425880.db2.gz ZQOBNFVDALLTKF-LEWJYISDSA-N 0 3 424.589 4.283 20 0 HIADHN CC(C)Sc1ccc(Cl)cc1NC(=O)NC(C)(C)CCN1CCN(C)CC1 ZINC000473671901 888432988 /nfs/dbraw/zinc/43/29/88/888432988.db2.gz YXXRKWJONJISIW-UHFFFAOYSA-N 0 3 413.031 4.378 20 0 HIADHN C[C@@H](N[C@H]1CCN(c2ccc(Cl)cc2Cl)C1=O)c1ccc(-n2ccnn2)cc1 ZINC000473680481 888447169 /nfs/dbraw/zinc/44/71/69/888447169.db2.gz VNUQHDOBPGPHNE-ACJLOTCBSA-N 0 3 416.312 4.030 20 0 HIADHN CN1CCN(CCC(C)(C)NC(=O)Nc2ccc3nc(C(C)(C)C)sc3c2)CC1 ZINC000473696015 888471689 /nfs/dbraw/zinc/47/16/89/888471689.db2.gz JIPMIIPYZVRJAG-UHFFFAOYSA-N 0 3 417.623 4.131 20 0 HIADHN C[C@H](CCN1CCN(C)CC1)NC(=O)Nc1cccc(CSC2CCCC2)c1 ZINC000473707449 888483732 /nfs/dbraw/zinc/48/37/32/888483732.db2.gz VTPPUSABLGDQPI-GOSISDBHSA-N 0 3 404.624 4.010 20 0 HIADHN CC(C)c1cnc(-c2ccc(NC(=O)NC(C)(C)CCN3CCN(C)CC3)cc2)o1 ZINC000473708777 888485876 /nfs/dbraw/zinc/48/58/76/888485876.db2.gz BPPOOPALFQXKLD-UHFFFAOYSA-N 0 3 413.566 4.003 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)c3ccc(Cl)cc3C(F)(F)F)CC2)C[C@H](C)O1 ZINC000473724251 888501350 /nfs/dbraw/zinc/50/13/50/888501350.db2.gz MIOLYGZUFXALDU-OKILXGFUSA-N 0 3 418.887 4.320 20 0 HIADHN Cc1ccc2nc(C3CC3)cc(C(=O)N3CCC(CN4C[C@@H](C)O[C@H](C)C4)CC3)c2c1 ZINC000473726416 888502648 /nfs/dbraw/zinc/50/26/48/888502648.db2.gz UBPDBBRYZFPQDM-RTBURBONSA-N 0 3 421.585 4.382 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)N2CCCC[C@@H]2c2nc(-c3cccc(F)c3)c[nH]2)CN1C1CC1 ZINC000473737044 888516840 /nfs/dbraw/zinc/51/68/40/888516840.db2.gz APDRLGISGMSSAD-FYINFDKHSA-N 0 3 411.525 4.078 20 0 HIADHN CCN(C(=O)Nc1nnc(C(F)(F)F)s1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000473737481 888518064 /nfs/dbraw/zinc/51/80/64/888518064.db2.gz BSYKWMWZMVVOJP-JSGCOSHPSA-N 0 3 413.469 4.246 20 0 HIADHN CCN(C(=O)Nc1nnc(-c2ccco2)s1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000473777929 888580903 /nfs/dbraw/zinc/58/09/03/888580903.db2.gz XLJQBYIXOMLBMY-WBVHZDCISA-N 0 3 411.531 4.487 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)NCc3ccc(C(F)(F)F)cc3)c2)CC1 ZINC000473818746 888647204 /nfs/dbraw/zinc/64/72/04/888647204.db2.gz PTBFRJBCTNZSSP-UHFFFAOYSA-N 0 3 406.452 4.169 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CCc4[nH]c5ccc(F)cc5c4C3)c2)CC1 ZINC000473827553 888660315 /nfs/dbraw/zinc/66/03/15/888660315.db2.gz HORWOLMZPQQKRG-UHFFFAOYSA-N 0 3 421.520 4.039 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CC[C@H](Cc4ccccc4)[C@H]3C)c2)CC1 ZINC000473826566 888660409 /nfs/dbraw/zinc/66/04/09/888660409.db2.gz FOFGWDNJNRZKNX-IFMALSPDSA-N 0 3 406.574 4.314 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)NCc3nc(C(C)C)c(C)s3)c2)CC1 ZINC000473832488 888668386 /nfs/dbraw/zinc/66/83/86/888668386.db2.gz VPFKVJPIUSKTCX-UHFFFAOYSA-N 0 3 401.580 4.039 20 0 HIADHN CCCOc1ccc2c(c1)CCN(C(=O)Nc1cccc(N3CCN(CC)CC3)c1)C2 ZINC000473832818 888668610 /nfs/dbraw/zinc/66/86/10/888668610.db2.gz AXOSRIAOOAJYFF-UHFFFAOYSA-N 0 3 422.573 4.208 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)NCCCO[C@H](C)c3ccccc3)c2)CC1 ZINC000473835441 888671916 /nfs/dbraw/zinc/67/19/16/888671916.db2.gz CYSCNYJJPDFJAC-HXUWFJFHSA-N 0 3 410.562 4.118 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@H](C)c3ccccc3OC(F)F)c2)CC1 ZINC000473836906 888674048 /nfs/dbraw/zinc/67/40/48/888674048.db2.gz OGZYBWWISADJHJ-MRXNPFEDSA-N 0 3 418.488 4.313 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@H](C)c3cccc(OC(F)F)c3)c2)CC1 ZINC000473842337 888685131 /nfs/dbraw/zinc/68/51/31/888685131.db2.gz WWOLDZAOSMTQBH-MRXNPFEDSA-N 0 3 418.488 4.313 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@@H](C)c1noc(-c2ccccc2)n1)c1ccsc1 ZINC000473873276 888735138 /nfs/dbraw/zinc/73/51/38/888735138.db2.gz CQKWMXMZOMALKP-MAUKXSAKSA-N 0 3 413.547 4.241 20 0 HIADHN Cc1c2ccccc2oc1[C@H](NC(=O)NC(C)(C)CCN1CCN(C)CC1)C(C)C ZINC000473911222 888790484 /nfs/dbraw/zinc/79/04/84/888790484.db2.gz JFYJIKLIPLEXIV-OAQYLSRUSA-N 0 3 414.594 4.154 20 0 HIADHN O=C(Nc1ccccc1-c1cccs1)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1CO ZINC000473976838 888842104 /nfs/dbraw/zinc/84/21/04/888842104.db2.gz STIVVTGAYWZANB-CTNGQTDRSA-N 0 3 421.566 4.420 20 0 HIADHN CCOc1cc(CNCCOC(F)(F)F)cc(Br)c1OC(F)F ZINC000473985026 888847524 /nfs/dbraw/zinc/84/75/24/888847524.db2.gz RNXQKBLQGYBPCH-UHFFFAOYSA-N 0 3 408.161 4.075 20 0 HIADHN CCN(C)C(=O)[C@@H](C)N[C@H]1CCCc2nc(-c3ccc(Br)cc3)sc21 ZINC000474108282 888928308 /nfs/dbraw/zinc/92/83/08/888928308.db2.gz WATORKNHTZYNOK-DOMZBBRYSA-N 0 3 422.392 4.406 20 0 HIADHN CC(C)c1nc2c([nH]1)C[C@H](C(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1)CC2 ZINC000474203506 889041382 /nfs/dbraw/zinc/04/13/82/889041382.db2.gz IOWGQRFHDWNZFQ-XLIONFOSSA-N 0 3 414.619 4.289 20 0 HIADHN CC(C)c1nc2c([nH]1)CC[C@@H](C(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1)C2 ZINC000474203506 889041404 /nfs/dbraw/zinc/04/14/04/889041404.db2.gz IOWGQRFHDWNZFQ-XLIONFOSSA-N 0 3 414.619 4.289 20 0 HIADHN O=c1c2ccccc2ncn1CCN1CCC(c2ccccc2C(F)(F)F)CC1 ZINC000474218374 889057304 /nfs/dbraw/zinc/05/73/04/889057304.db2.gz ZOEZIIFRBVVTFC-UHFFFAOYSA-N 0 3 401.432 4.295 20 0 HIADHN C[C@H](Oc1ccc(C(F)(F)F)cc1)C(=O)NC1CCN([C@@H](C)c2ccncc2)CC1 ZINC000474245820 889094773 /nfs/dbraw/zinc/09/47/73/889094773.db2.gz DENLWHHDQFGCCL-HOTGVXAUSA-N 0 3 421.463 4.210 20 0 HIADHN COc1ccc(SCCCC(=O)NC2CCN([C@H](C)c3ccncc3)CC2)cc1 ZINC000474254493 889109118 /nfs/dbraw/zinc/10/91/18/889109118.db2.gz WJGCNQZHCZASLD-GOSISDBHSA-N 0 3 413.587 4.304 20 0 HIADHN COc1ccc2nc(CNC[C@@H](c3ccc(Cl)cc3)N3CCOCC3)sc2c1 ZINC000474347790 889225181 /nfs/dbraw/zinc/22/51/81/889225181.db2.gz LIMRTQKPCIVMBE-IBGZPJMESA-N 0 3 417.962 4.121 20 0 HIADHN Cc1ccc(SC[C@H](C)NC(=O)N(Cc2ccco2)C2CCN(C)CC2)cc1 ZINC000474355016 889233445 /nfs/dbraw/zinc/23/34/45/889233445.db2.gz SAWFSRDAAPKBFV-SFHVURJKSA-N 0 3 401.576 4.375 20 0 HIADHN CN(C(=O)CCc1ccc(Cl)c(Cl)c1)C1CCN(CCc2ccccn2)CC1 ZINC000504557034 913330244 /nfs/dbraw/zinc/33/02/44/913330244.db2.gz YANMCWIHLZUZRE-UHFFFAOYSA-N 0 3 420.384 4.487 20 0 HIADHN C[C@H](N[C@@H]1CCN([C@@H](C(=O)OC(C)(C)C)c2ccccc2)C1=O)c1cccs1 ZINC000474431323 889296519 /nfs/dbraw/zinc/29/65/19/889296519.db2.gz HEVXDXKWGYQDMY-KVSKMBFKSA-N 0 3 400.544 4.083 20 0 HIADHN Cc1nc2ccccc2n1C1CCN(C(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)CC1 ZINC000474537722 889412454 /nfs/dbraw/zinc/41/24/54/889412454.db2.gz HCGZSBISGVDVJJ-VWNXMTODSA-N 0 3 417.557 4.137 20 0 HIADHN CN(C(=O)Nc1ccccc1C(=O)N1CCCCC1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000474554334 889430692 /nfs/dbraw/zinc/43/06/92/889430692.db2.gz FSKVVFNXVWIUGC-OAQYLSRUSA-N 0 3 420.557 4.051 20 0 HIADHN CSc1nc(-c2ccco2)nc(C)c1C(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000474555500 889432678 /nfs/dbraw/zinc/43/26/78/889432678.db2.gz YHVNBFFIVXNDKF-SJLPKXTDSA-N 0 3 422.554 4.332 20 0 HIADHN CN(C(=O)Nc1ccc2c(c1)OC1(CCCC1)O2)[C@H]1CCN(Cc2ccccc2)C1 ZINC000474559093 889435747 /nfs/dbraw/zinc/43/57/47/889435747.db2.gz QSZGYBJHKNOUJC-FQEVSTJZSA-N 0 3 407.514 4.466 20 0 HIADHN CN(C(=O)Nc1ccc(OCc2ccncc2)cc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000474591791 889459795 /nfs/dbraw/zinc/45/97/95/889459795.db2.gz BYCKVWIVHRUJEO-HSZRJFAPSA-N 0 3 416.525 4.399 20 0 HIADHN CN(C(=O)Nc1cccc(-c2noc(C3CC3)n2)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000474617533 889482069 /nfs/dbraw/zinc/48/20/69/889482069.db2.gz GPAFONYNWVNGTA-NRFANRHFSA-N 0 3 417.513 4.352 20 0 HIADHN COc1ccc(NC(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)c(Br)c1 ZINC000474628234 889491171 /nfs/dbraw/zinc/49/11/71/889491171.db2.gz IZLXZZYVKWDFJS-MRXNPFEDSA-N 0 3 418.335 4.196 20 0 HIADHN CN(C(=O)Nc1cccc(OCC(F)(F)F)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000474717663 889575340 /nfs/dbraw/zinc/57/53/40/889575340.db2.gz FXIJADQXGOOTHH-GOSISDBHSA-N 0 3 407.436 4.366 20 0 HIADHN CC[C@@H](C)NC(=O)c1ccc(NC(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)c(C)c1 ZINC000474729373 889585393 /nfs/dbraw/zinc/58/53/93/889585393.db2.gz GJGHJUAXVREISJ-KNQAVFIVSA-N 0 3 422.573 4.262 20 0 HIADHN CN(C(=O)Nc1cccc(OCc2cccnc2)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000474732981 889588140 /nfs/dbraw/zinc/58/81/40/889588140.db2.gz OGOMOYWOMMQFJB-HSZRJFAPSA-N 0 3 416.525 4.399 20 0 HIADHN Cc1ccc(NC(=O)C2CC2)cc1NC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000474740818 889596612 /nfs/dbraw/zinc/59/66/12/889596612.db2.gz USDJRHFZIXLDIM-OAQYLSRUSA-N 0 3 406.530 4.082 20 0 HIADHN FC(F)(F)c1cc(Br)ccc1CNCc1cccc(-n2cncn2)c1 ZINC000474809167 889662127 /nfs/dbraw/zinc/66/21/27/889662127.db2.gz NRDMWKLHKAMBRF-UHFFFAOYSA-N 0 3 411.225 4.338 20 0 HIADHN CCOc1cc(-c2ccccc2)sc1C(=O)NC1CCN(CCOC(C)C)CC1 ZINC000474877978 889732110 /nfs/dbraw/zinc/73/21/10/889732110.db2.gz ODSRYLKOEFWLOV-UHFFFAOYSA-N 0 3 416.587 4.433 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)c2occc2CSc2ccccc2)CC1 ZINC000474889609 889747059 /nfs/dbraw/zinc/74/70/59/889747059.db2.gz XLKZKGXYEFKSLN-UHFFFAOYSA-N 0 3 402.560 4.191 20 0 HIADHN CC(C)COc1ccc(C2(C(=O)NC3CCN(CCOC(C)C)CC3)CCC2)cc1 ZINC000474893151 889750159 /nfs/dbraw/zinc/75/01/59/889750159.db2.gz BNUCCTISTQMGFR-UHFFFAOYSA-N 0 3 416.606 4.149 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)c2ccc(Oc3ccc(F)cc3F)cc2)CC1 ZINC000474893800 889751951 /nfs/dbraw/zinc/75/19/51/889751951.db2.gz ZFHHWSOLVUGFHH-UHFFFAOYSA-N 0 3 418.484 4.376 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)c2cccc(COc3cccc(F)c3)c2)CC1 ZINC000474896512 889755778 /nfs/dbraw/zinc/75/57/78/889755778.db2.gz ZWMPJCSAVHKGCP-UHFFFAOYSA-N 0 3 414.521 4.024 20 0 HIADHN CCN(C(=O)Nc1ccc(C(=O)NC(C)C)cc1C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475001836 889853230 /nfs/dbraw/zinc/85/32/30/889853230.db2.gz LLZBHULNDVUINY-JOCHJYFZSA-N 0 3 422.573 4.262 20 0 HIADHN CCN(C(=O)NCCCn1c(C)nc2ccccc21)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475009353 889862566 /nfs/dbraw/zinc/86/25/66/889862566.db2.gz YBVJPDPDOGFQMR-QFIPXVFZSA-N 0 3 419.573 4.041 20 0 HIADHN CCN(C(=O)Nc1cc(C(=O)NC2CC2)ccc1C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475009836 889864106 /nfs/dbraw/zinc/86/41/06/889864106.db2.gz MCHGSDBANNKLFM-QFIPXVFZSA-N 0 3 420.557 4.016 20 0 HIADHN CCN(C(=O)Nc1cnn(-c2ccccc2F)c1C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475013037 889866867 /nfs/dbraw/zinc/86/68/67/889866867.db2.gz HQCSKRPXCBTRDO-HXUWFJFHSA-N 0 3 421.520 4.448 20 0 HIADHN CCN(C(=O)Nc1ccc(Oc2cccnc2)nc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475014043 889867002 /nfs/dbraw/zinc/86/70/02/889867002.db2.gz GEEICKADGSPPPU-OAQYLSRUSA-N 0 3 417.513 4.397 20 0 HIADHN CCN1CCN(c2cccc(NCc3cn(C)nc3-c3ccccc3Cl)c2)CC1 ZINC000475086246 889933049 /nfs/dbraw/zinc/93/30/49/889933049.db2.gz GMLGWPKEICAPSU-UHFFFAOYSA-N 0 3 409.965 4.495 20 0 HIADHN CN(C(=O)NCc1cc(F)ccc1Br)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475134379 890000667 /nfs/dbraw/zinc/00/06/67/890000667.db2.gz KXLBXNIUOJZUHN-GOSISDBHSA-N 0 3 420.326 4.004 20 0 HIADHN CC[C@H](CNC(=O)N(C)Cc1nc2c(s1)CCCC2)N1CCc2ccccc2C1 ZINC000475141981 890008375 /nfs/dbraw/zinc/00/83/75/890008375.db2.gz WRJFXEQQKKBZJA-LJQANCHMSA-N 0 3 412.603 4.000 20 0 HIADHN CC[C@@H](CNC(=O)N(C)Cc1nc2c(s1)CCCC2)N1CCc2ccccc2C1 ZINC000475141979 890009364 /nfs/dbraw/zinc/00/93/64/890009364.db2.gz WRJFXEQQKKBZJA-IBGZPJMESA-N 0 3 412.603 4.000 20 0 HIADHN CCN(C(=O)NC[C@@H]1CCCO[C@@H]1c1ccccc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475172748 890039051 /nfs/dbraw/zinc/03/90/51/890039051.db2.gz GCTRFJLEDBNHOR-CCDWMCETSA-N 0 3 421.585 4.460 20 0 HIADHN CCC(CC)[C@@H]1C[C@H](NC(=O)N(CC)[C@H]2CCN(Cc3ccccc3)C2)CCO1 ZINC000475173282 890039188 /nfs/dbraw/zinc/03/91/88/890039188.db2.gz IZCUIDBOQLWMGW-VJBWXMMDSA-N 0 3 401.595 4.276 20 0 HIADHN CCN(C(=O)NC[C@H](c1ccccc1)C(C)(C)CO)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475176081 890044088 /nfs/dbraw/zinc/04/40/88/890044088.db2.gz YWQRFJAAIQEUSW-BJKOFHAPSA-N 0 3 423.601 4.095 20 0 HIADHN CC1CCN([C@@H](CNC(=O)Nc2ccc(-c3ncn(C)n3)cc2)c2cccs2)CC1 ZINC000475211718 890080872 /nfs/dbraw/zinc/08/08/72/890080872.db2.gz WHVYOPAMYWPUSX-IBGZPJMESA-N 0 3 424.574 4.138 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)c2cn(C)nc2-c2ccc(Cl)s2)C1 ZINC000475242144 890120314 /nfs/dbraw/zinc/12/03/14/890120314.db2.gz AOJNKTSVQCMPQW-GOEBONIOSA-N 0 3 414.962 4.367 20 0 HIADHN C[C@@H](Oc1cccnc1NC(=O)N(CCN(C)C)Cc1ccco1)c1ccccc1 ZINC000475265066 890158896 /nfs/dbraw/zinc/15/88/96/890158896.db2.gz NSXPGNYGIZMMPZ-GOSISDBHSA-N 0 3 408.502 4.410 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@@H]2CNC(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000475279538 890175532 /nfs/dbraw/zinc/17/55/32/890175532.db2.gz KCSZHKNWOHUWBO-DSITVLBTSA-N 0 3 421.585 4.379 20 0 HIADHN COc1c(Br)cc(Br)cc1CNCCc1cccc(C)n1 ZINC000475282111 890180558 /nfs/dbraw/zinc/18/05/58/890180558.db2.gz UJPBYKVVWTVUFI-UHFFFAOYSA-N 0 3 414.141 4.256 20 0 HIADHN Cc1c(C(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)cnn1-c1cccc(Cl)c1 ZINC000475311800 890225085 /nfs/dbraw/zinc/22/50/85/890225085.db2.gz LCGFKPFOMBQXMB-OAQYLSRUSA-N 0 3 408.933 4.181 20 0 HIADHN CO[C@@H]1CCC[C@H](CC(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)C1 ZINC000475316692 890232565 /nfs/dbraw/zinc/23/25/65/890232565.db2.gz XVNABAKLVDBLOZ-QFBILLFUSA-N 0 3 400.485 4.191 20 0 HIADHN CN(C(=O)Cc1csc(Cc2ccccc2)n1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475319726 890237235 /nfs/dbraw/zinc/23/72/35/890237235.db2.gz UJPSPUHNGZLQJT-QFIPXVFZSA-N 0 3 405.567 4.009 20 0 HIADHN Cc1ccc(-c2cnc(CCC(=O)N(C)[C@@H]3CCN(Cc4ccccc4)C3)o2)cc1 ZINC000475320611 890238476 /nfs/dbraw/zinc/23/84/76/890238476.db2.gz LBLAQVUGUUDYQZ-JOCHJYFZSA-N 0 3 403.526 4.316 20 0 HIADHN CCCN1CCN(c2ccccc2CNc2ccc(F)cc2-c2nnc(C)o2)CC1 ZINC000475351813 890276362 /nfs/dbraw/zinc/27/63/62/890276362.db2.gz MGTFOJQWZJMMSZ-UHFFFAOYSA-N 0 3 409.509 4.328 20 0 HIADHN CCCN1CCN(c2ccccc2CNc2cccc(NC(=O)N(C)C)c2C)CC1 ZINC000475353308 890277596 /nfs/dbraw/zinc/27/75/96/890277596.db2.gz DOCODTIHIBIBIQ-UHFFFAOYSA-N 0 3 409.578 4.233 20 0 HIADHN COCCC[C@H](Cc1ccccc1)NCc1cn(-c2ccc(F)cc2Cl)nn1 ZINC000475355811 890279765 /nfs/dbraw/zinc/27/97/65/890279765.db2.gz WAVLORHQXQAVRL-GOSISDBHSA-N 0 3 402.901 4.187 20 0 HIADHN CN(C(=O)[C@@H]1C[C@@H]1c1ccccc1OC(F)F)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475423558 890345101 /nfs/dbraw/zinc/34/51/01/890345101.db2.gz QWOLOPVQZZXSRZ-MISYRCLQSA-N 0 3 400.469 4.124 20 0 HIADHN CCCN(C(=O)C1CCC(OCCOC)CC1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000475468368 890376964 /nfs/dbraw/zinc/37/69/64/890376964.db2.gz OJPBVAWTAXQAQZ-NSQNTRMNSA-N 0 3 416.606 4.111 20 0 HIADHN C[C@@H](CNC(=O)c1cn(C)nc1-c1ccc(Cl)s1)N(C)Cc1ccccc1 ZINC000475502264 890415095 /nfs/dbraw/zinc/41/50/95/890415095.db2.gz NHTQPTMXEKPDFK-AWEZNQCLSA-N 0 3 402.951 4.052 20 0 HIADHN COc1cccc([C@H](CNC(=O)N[C@H](C)c2cc(F)ccc2OC)N2CCCC2)c1 ZINC000504716641 913452263 /nfs/dbraw/zinc/45/22/63/913452263.db2.gz NSDOYNQUTFWYBD-IERDGZPVSA-N 0 3 415.509 4.040 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)cc1C(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475544163 890468856 /nfs/dbraw/zinc/46/88/56/890468856.db2.gz GQUKNSREVGQDQZ-OAQYLSRUSA-N 0 3 408.933 4.181 20 0 HIADHN OC[C@H](NC1CCN(c2ccc(F)cc2F)CC1)c1ccccc1OC(F)(F)F ZINC000475560688 890489121 /nfs/dbraw/zinc/48/91/21/890489121.db2.gz ORYUVIHWGINKKK-KRWDZBQOSA-N 0 3 416.390 4.155 20 0 HIADHN Cc1nn(-c2ccncc2)cc1CN[C@H](CO)c1ccc(Cl)cc1C(F)(F)F ZINC000475632973 890574223 /nfs/dbraw/zinc/57/42/23/890574223.db2.gz HFQBACZDKYAYGZ-GOSISDBHSA-N 0 3 410.827 4.071 20 0 HIADHN Cc1ccc(-n2cccn2)cc1NC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000475646160 890588160 /nfs/dbraw/zinc/58/81/60/890588160.db2.gz PMXFURGHOAFVJO-JOCHJYFZSA-N 0 3 403.530 4.309 20 0 HIADHN Cc1ccc(Oc2ccc(NC(=O)NC3CCN(CCOC(C)C)CC3)cn2)cc1 ZINC000475645832 890588223 /nfs/dbraw/zinc/58/82/23/890588223.db2.gz AEZJNASLAAHHCA-UHFFFAOYSA-N 0 3 412.534 4.193 20 0 HIADHN OC[C@@]1(Cc2ccccc2)CCCN1Cc1nc(-c2cccc(C(F)(F)F)c2)no1 ZINC000475679240 890622094 /nfs/dbraw/zinc/62/20/94/890622094.db2.gz LPRGQFHNSZKPFC-NRFANRHFSA-N 0 3 417.431 4.325 20 0 HIADHN C[C@H](c1ccc([S@@](C)=O)cc1)N(C)CCC(=O)Nc1ccc(Br)cc1 ZINC000475745515 890688986 /nfs/dbraw/zinc/68/89/86/890688986.db2.gz DMQHGNPYHYHQTQ-DLUDVSRJSA-N 0 3 423.376 4.208 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1cn(C)nc1-c1ccc(Cl)s1 ZINC000475837213 890770116 /nfs/dbraw/zinc/77/01/16/890770116.db2.gz OQDQLVJGZLBDAE-YOEHRIQHSA-N 0 3 414.962 4.052 20 0 HIADHN COc1ccc(C(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)c(OC(F)F)c1 ZINC000475945657 890868136 /nfs/dbraw/zinc/86/81/36/890868136.db2.gz MKYIBNXLVXSNDS-KRWDZBQOSA-N 0 3 404.457 4.033 20 0 HIADHN C[C@H](c1ccc([S@](C)=O)cc1)N(C)C(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000475956686 890877563 /nfs/dbraw/zinc/87/75/63/890877563.db2.gz KOQNRAZVWFQTBG-ODDXKZSGSA-N 0 3 419.616 4.025 20 0 HIADHN CN(C)CCN(C(=O)c1cc(N2CCCC2=O)cc(C(F)(F)F)c1)c1ccccc1 ZINC000476140467 891062218 /nfs/dbraw/zinc/06/22/18/891062218.db2.gz GKUUZQFALXEAPZ-UHFFFAOYSA-N 0 3 419.447 4.041 20 0 HIADHN C[C@@H](NC(=O)N(C)[C@@H]1CCN(C2CC2)C1)c1ccc(NC(=O)c2ccc(F)cc2)cc1 ZINC000476152452 891076138 /nfs/dbraw/zinc/07/61/38/891076138.db2.gz MBEAIEKQAZOAOA-OPAMFIHVSA-N 0 3 424.520 4.017 20 0 HIADHN Clc1ccc(-c2cc3ncnc(N4CCN(C5CCOCC5)CC4)c3s2)cc1 ZINC000476188707 891119810 /nfs/dbraw/zinc/11/98/10/891119810.db2.gz JLKFSBBCAIMFRO-UHFFFAOYSA-N 0 3 414.962 4.313 20 0 HIADHN COc1ccc(-c2nc(C)c(C(=O)N[C@@H](C)CN3CCCCCC3)s2)cc1OC ZINC000476189088 891119896 /nfs/dbraw/zinc/11/98/96/891119896.db2.gz FSUADFOSBUMICZ-HNNXBMFYSA-N 0 3 417.575 4.130 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2c(F)cc(F)cc2Br)N(C)C)cc1 ZINC000476351594 891254931 /nfs/dbraw/zinc/25/49/31/891254931.db2.gz DSFQRLKKBOFOLU-INIZCTEOSA-N 0 3 412.278 4.460 20 0 HIADHN CCCc1ccc([C@H](NC(=O)NC[C@H]2CCCN2CCOC)c2cccs2)cc1 ZINC000476495711 891407196 /nfs/dbraw/zinc/40/71/96/891407196.db2.gz YWTPXCOSWWNGLW-IRLDBZIGSA-N 0 3 415.603 4.200 20 0 HIADHN CSc1cnn(-c2ccccc2)c1NC(=O)N[C@H](CN(C)C)c1ccc(F)cc1 ZINC000476573838 891493893 /nfs/dbraw/zinc/49/38/93/891493893.db2.gz YBBLFHDYDNLQRF-GOSISDBHSA-N 0 3 413.522 4.158 20 0 HIADHN CCC[C@H]1CN(C(=O)[C@H]2CCc3nc(C(C)C)[nH]c3C2)CCN1Cc1ccccc1 ZINC000476589504 891519585 /nfs/dbraw/zinc/51/95/85/891519585.db2.gz SBRQADXZPHIBNZ-SFTDATJTSA-N 0 3 408.590 4.151 20 0 HIADHN CCC[C@H]1CN(C(=O)[C@H]2CCc3[nH]c(C(C)C)nc3C2)CCN1Cc1ccccc1 ZINC000476589504 891519615 /nfs/dbraw/zinc/51/96/15/891519615.db2.gz SBRQADXZPHIBNZ-SFTDATJTSA-N 0 3 408.590 4.151 20 0 HIADHN O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCC(c2c[nH]c3cc(F)ccc32)CC1 ZINC000476653847 891597165 /nfs/dbraw/zinc/59/71/65/891597165.db2.gz MXLJGPOUAAJWDQ-OAQYLSRUSA-N 0 3 420.532 4.471 20 0 HIADHN C[C@@H]1CO[C@H](c2ccccc2Cl)CN1C(=O)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000476657572 891604498 /nfs/dbraw/zinc/60/44/98/891604498.db2.gz PTQSBRQVKUMXSS-JUXOCIIHSA-N 0 3 413.949 4.086 20 0 HIADHN Cc1cc(Br)ccc1CNC(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000476684848 891635752 /nfs/dbraw/zinc/63/57/52/891635752.db2.gz YKMVKOVPVXUTQV-KRWDZBQOSA-N 0 3 422.392 4.455 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)N1CCC[C@]2(C1)OCc1ccccc12 ZINC000476687723 891642643 /nfs/dbraw/zinc/64/26/43/891642643.db2.gz BAGBBVLYPOMJDJ-UKILVPOCSA-N 0 3 405.542 4.055 20 0 HIADHN CN(Cc1ccc(Br)s1)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000504884262 913615805 /nfs/dbraw/zinc/61/58/05/913615805.db2.gz ZUWZBVDJNCXYAB-MRXNPFEDSA-N 0 3 422.392 4.317 20 0 HIADHN COCCN1CCC[C@H]1CNC(=O)N(Cc1ccc(C)cc1)[C@@H]1CCc2ccccc21 ZINC000477112298 892044300 /nfs/dbraw/zinc/04/43/00/892044300.db2.gz UVQJNNIAWUGHDZ-UKILVPOCSA-N 0 3 421.585 4.305 20 0 HIADHN Cc1cc(NC(=O)c2c(F)ccc(F)c2F)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000477119516 892051043 /nfs/dbraw/zinc/05/10/43/892051043.db2.gz JWTQUQNAUGBVOD-INIZCTEOSA-N 0 3 414.431 4.308 20 0 HIADHN C/C=C\c1ccc(OC[C@@H](O)CN2CCC(OCc3ccccc3)CC2)c(OC)c1 ZINC000477157174 892078275 /nfs/dbraw/zinc/07/82/75/892078275.db2.gz BWMOMMVEOKQNRA-CDKWRECCSA-N 0 3 411.542 4.149 20 0 HIADHN COc1ccccc1Oc1ccc(CNC(=O)N2CCN(C3CCCC3)CC2)cc1 ZINC000477219905 892153922 /nfs/dbraw/zinc/15/39/22/892153922.db2.gz IGSQIZDYGQLDAI-UHFFFAOYSA-N 0 3 409.530 4.257 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2ccc(C(C)(C)C)s2)cc1)[C@H]1CCCN(C)C1 ZINC000477278155 892232557 /nfs/dbraw/zinc/23/25/57/892232557.db2.gz KMSWAWKURYYCIA-SFHVURJKSA-N 0 3 413.587 4.464 20 0 HIADHN CCN1CCN([C@@H]2CCN([C@H](C)c3nc(C)c(-c4ccc(Cl)cc4)o3)C2)CC1 ZINC000477287478 892243947 /nfs/dbraw/zinc/24/39/47/892243947.db2.gz PRSCLSZNDFSRAV-YLJYHZDGSA-N 0 3 402.970 4.076 20 0 HIADHN CCN1CCN([C@H]2CCN([C@H](C)c3nc(C)c(-c4ccc(Cl)cc4)o3)C2)CC1 ZINC000477287477 892245570 /nfs/dbraw/zinc/24/55/70/892245570.db2.gz PRSCLSZNDFSRAV-XLIONFOSSA-N 0 3 402.970 4.076 20 0 HIADHN CC1CCN([C@H](CNC(=O)c2ccncc2Br)c2ccccc2)CC1 ZINC000477448396 892400439 /nfs/dbraw/zinc/40/04/39/892400439.db2.gz NRPZWHOPZKVDHT-LJQANCHMSA-N 0 3 402.336 4.047 20 0 HIADHN O[C@@H](COc1cccc(C(F)(F)F)c1)CN1CCC[C@H]1c1ccc2c(c1)OCO2 ZINC000477458619 892422300 /nfs/dbraw/zinc/42/23/00/892422300.db2.gz LKFILFPDMAWICL-AEFFLSMTSA-N 0 3 409.404 4.011 20 0 HIADHN Cc1sc(CNC(=O)NCC2(N3CCOC(C)(C)C3)CCCCC2)nc1C(C)C ZINC000477471056 892449456 /nfs/dbraw/zinc/44/94/56/892449456.db2.gz NDGRMQSSYWDNGB-UHFFFAOYSA-N 0 3 422.639 4.188 20 0 HIADHN CCOc1ccc([C@@H](C)NC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)cc1OC ZINC000504929276 913668328 /nfs/dbraw/zinc/66/83/28/913668328.db2.gz IIRFZWFFVZCYJQ-WIYYLYMNSA-N 0 3 411.546 4.119 20 0 HIADHN O=C(CNC1(c2ccc(OCc3ccccc3)cc2)CCOCC1)Nc1ccccc1 ZINC000477666910 892802217 /nfs/dbraw/zinc/80/22/17/892802217.db2.gz VATUIQBWIMPZKI-UHFFFAOYSA-N 0 3 416.521 4.500 20 0 HIADHN CC(C)n1ncc2c1C[C@H](N[C@H](C)c1ccccc1I)CC2 ZINC000477686660 892809670 /nfs/dbraw/zinc/80/96/70/892809670.db2.gz AQFAJLBUOLXVBB-UKRRQHHQSA-N 0 3 409.315 4.277 20 0 HIADHN O=C(COc1cccc2ccccc21)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000477742947 892838730 /nfs/dbraw/zinc/83/87/30/892838730.db2.gz OWJJGSJUGXIHAD-UHFFFAOYSA-N 0 3 404.510 4.062 20 0 HIADHN CCN(C[C@H]1CCN(Cc2cccc(C(=O)N3CCCCC3)c2)C1)CC(F)(F)F ZINC000477763921 892852686 /nfs/dbraw/zinc/85/26/86/892852686.db2.gz XYIJQGGZJVRMOG-LJQANCHMSA-N 0 3 411.512 4.019 20 0 HIADHN NC(=O)C1CCN(C[C@@H](NCc2ccc(C3CC3)cc2)c2ccc(Cl)cc2)CC1 ZINC000477858054 892918214 /nfs/dbraw/zinc/91/82/14/892918214.db2.gz KHHZAMKJIVXSOW-HSZRJFAPSA-N 0 3 411.977 4.246 20 0 HIADHN C[C@@H](NC(=O)NCc1ccc(NC(=O)c2ccco2)cc1)[C@H](c1ccccc1)N(C)C ZINC000477875771 892939597 /nfs/dbraw/zinc/93/95/97/892939597.db2.gz IHMSTYJGLWESRD-VGOFRKELSA-N 0 3 420.513 4.023 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)Nc1ccc(Br)cc1F ZINC000504976358 913716771 /nfs/dbraw/zinc/71/67/71/913716771.db2.gz DSUCUENVQFBPTQ-UHFFFAOYSA-N 0 3 416.360 4.071 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)N[C@@H](C)CCc2ccc(O)cc2)N(C)C)cc1 ZINC000477903483 892974732 /nfs/dbraw/zinc/97/47/32/892974732.db2.gz CGSXGTFDEIYAOC-MBSDFSHPSA-N 0 3 413.562 4.103 20 0 HIADHN CC(C)[C@H](NCc1ccc(S(=O)(=O)CCO)cc1)c1ccc(Cl)c(Cl)c1 ZINC000477923721 893009465 /nfs/dbraw/zinc/00/94/65/893009465.db2.gz BNNCILFDOJWDSU-IBGZPJMESA-N 0 3 416.370 4.246 20 0 HIADHN CCC[C@H](NCc1ccc(S(=O)(=O)CCO)cc1)c1cccc(C(F)(F)F)c1 ZINC000477924681 893011139 /nfs/dbraw/zinc/01/11/39/893011139.db2.gz GHZVNTCCMMIRNZ-IBGZPJMESA-N 0 3 415.477 4.102 20 0 HIADHN C[C@H](N[C@@H]1CCN(Cc2ccc(F)cc2)C1=O)c1ccc(OCC(F)(F)F)cc1 ZINC000477924260 893011229 /nfs/dbraw/zinc/01/12/29/893011229.db2.gz YPCKPGGEKPAHFN-IFXJQAMLSA-N 0 3 410.411 4.219 20 0 HIADHN CCCN(C(=O)c1ccc2c(c1)CCC(=O)N2)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000505000570 913745169 /nfs/dbraw/zinc/74/51/69/913745169.db2.gz HADZBBMXIWIVHZ-JOCHJYFZSA-N 0 3 405.542 4.088 20 0 HIADHN CC[C@@H](C)n1ncc(C(=O)Nc2c(C)cnn2[C@H]2CCN(Cc3ccccc3)C2)c1C ZINC000478328320 893559804 /nfs/dbraw/zinc/55/98/04/893559804.db2.gz GXYHHGJYMCYXNF-NQIIRXRSSA-N 0 3 420.561 4.367 20 0 HIADHN Cc1ccc(C(=O)N[C@H]2CN(C)C[C@@H]2c2ccccc2)cc1NC(=O)c1ccccc1 ZINC000478372285 893637334 /nfs/dbraw/zinc/63/73/34/893637334.db2.gz PUUPJKAJQJVZLV-VWNXMTODSA-N 0 3 413.521 4.075 20 0 HIADHN CN(Cc1ccc(F)cc1Br)C(=O)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000478459754 893779929 /nfs/dbraw/zinc/77/99/29/893779929.db2.gz NZUDIVDUMKVJKH-SFHVURJKSA-N 0 3 420.326 4.004 20 0 HIADHN CCCN(CCN(C)C)C(=O)c1cc(-c2ccccc2C)nc2c1cnn2C(C)C ZINC000478530029 893833484 /nfs/dbraw/zinc/83/34/84/893833484.db2.gz PNCOADAKUJIRMI-UHFFFAOYSA-N 0 3 407.562 4.401 20 0 HIADHN Cc1c(C(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)nnn1-c1ccccc1Cl ZINC000505099910 913816221 /nfs/dbraw/zinc/81/62/21/913816221.db2.gz XLNFIYBJPMVMKZ-NRFANRHFSA-N 0 3 423.948 4.104 20 0 HIADHN O=C(N[C@H](c1ccccc1)c1ccccn1)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000505105586 913819678 /nfs/dbraw/zinc/81/96/78/913819678.db2.gz QMWHNOLKWAMFBE-FYYLOGMGSA-N 0 3 421.491 4.445 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)N[C@H](C)c2ccccc2OC(F)F)c1 ZINC000478763233 894039129 /nfs/dbraw/zinc/03/91/29/894039129.db2.gz FTMXNDUDSRKTAB-MRXNPFEDSA-N 0 3 421.488 4.131 20 0 HIADHN CCN(CC(=O)N[C@@H](c1ccccc1)c1ccc2nc(C(F)(F)F)[nH]c2c1)C1CC1 ZINC000505129300 913832729 /nfs/dbraw/zinc/83/27/29/913832729.db2.gz HZHWDYXLYXRKOZ-FQEVSTJZSA-N 0 3 416.447 4.272 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)N1CC2(CCC2)c2ccccc21 ZINC000478802620 894076620 /nfs/dbraw/zinc/07/66/20/894076620.db2.gz YHHPPKUFAMNPGM-UHFFFAOYSA-N 0 3 418.585 4.240 20 0 HIADHN Cc1cc(O[C@@H](C)C(=O)NCc2ccccc2CN2CCC(O)CC2)ccc1C(C)C ZINC000478860815 894140373 /nfs/dbraw/zinc/14/03/73/894140373.db2.gz FRZUAFGXXKFFAW-FQEVSTJZSA-N 0 3 424.585 4.159 20 0 HIADHN CC(C)c1ccc(SCC(=O)NCc2ccccc2CN2CCC(O)CC2)cc1 ZINC000478870756 894149035 /nfs/dbraw/zinc/14/90/35/894149035.db2.gz SSNYWLJNRUIZJK-UHFFFAOYSA-N 0 3 412.599 4.175 20 0 HIADHN Cc1ccc(C(C)C)c(O[C@H](C)C(=O)NCc2ccccc2CN2CCC(O)CC2)c1 ZINC000478869814 894149308 /nfs/dbraw/zinc/14/93/08/894149308.db2.gz RROXGSDSIAXJAE-HXUWFJFHSA-N 0 3 424.585 4.159 20 0 HIADHN O=C(CCc1ccccc1)N1CC[C@@H](N[C@@H]2CCCc3nn(-c4ccccc4)cc32)C1 ZINC000479062406 894322608 /nfs/dbraw/zinc/32/26/08/894322608.db2.gz BBFHRJDLFAMIFM-ZJSXRUAMSA-N 0 3 414.553 4.073 20 0 HIADHN C[C@@H](CN[C@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl)Cc1cccs1 ZINC000479064930 894325640 /nfs/dbraw/zinc/32/56/40/894325640.db2.gz HSUVXKHTYYFQLQ-GHMZBOCLSA-N 0 3 407.388 4.232 20 0 HIADHN C[C@@H](NC[C@@H](C)Cc1cccs1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479064936 894326428 /nfs/dbraw/zinc/32/64/28/894326428.db2.gz HSUVXKHTYYFQLQ-WDEREUQCSA-N 0 3 407.388 4.232 20 0 HIADHN CCS[C@@H]1CCCC[C@@H]1N[C@@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479064518 894327249 /nfs/dbraw/zinc/32/72/49/894327249.db2.gz FQHWLULFNPVDEV-NZVBXONLSA-N 0 3 411.420 4.356 20 0 HIADHN CNS(=O)(=O)c1cccc([C@H](C)N[C@@H]2CCCc3cc(Br)ccc32)c1 ZINC000479081587 894347185 /nfs/dbraw/zinc/34/71/85/894347185.db2.gz RGFQPNLQNYYHOP-ORAYPTAESA-N 0 3 423.376 4.085 20 0 HIADHN Cc1cccc([C@@H](C)CN[C@@H](C)c2cc(S(N)(=O)=O)c(Cl)cc2Cl)c1 ZINC000479084024 894350275 /nfs/dbraw/zinc/35/02/75/894350275.db2.gz WTLABRVINFWIRM-STQMWFEESA-N 0 3 401.359 4.404 20 0 HIADHN CC[C@H](C)NC(=O)[C@@H]1C[C@H](C)N(Cc2nc(-c3ccoc3)no2)[C@@H]2CCCC[C@H]12 ZINC000479116404 894386123 /nfs/dbraw/zinc/38/61/23/894386123.db2.gz QZGFTWYBCSBKTF-BHEBFOIGSA-N 0 3 400.523 4.014 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N[C@@H]3CCCc4c(O)cccc43)c(C)c2)CC1 ZINC000479227189 894488876 /nfs/dbraw/zinc/48/88/76/894488876.db2.gz PMBPBUUVVAZFEZ-JOCHJYFZSA-N 0 3 408.546 4.042 20 0 HIADHN CC[C@@H](NC(=O)N(CCN(C)C)Cc1cccc(OC)c1)c1cc(F)ccc1F ZINC000479314231 894601552 /nfs/dbraw/zinc/60/15/52/894601552.db2.gz LHNGEWTVZGXTGY-OAQYLSRUSA-N 0 3 405.489 4.198 20 0 HIADHN COc1cc2c(cc1OC)[C@H](NCc1ccc(OCC(F)(F)F)c(OC)c1)CC2 ZINC000479340395 894634220 /nfs/dbraw/zinc/63/42/20/894634220.db2.gz ZNGCJMWFJUANPC-MRXNPFEDSA-N 0 3 411.420 4.431 20 0 HIADHN C[C@H](Cc1ccccc1F)N[C@@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479354648 894650492 /nfs/dbraw/zinc/65/04/92/894650492.db2.gz CKJBITIOWQHPRJ-MNOVXSKESA-N 0 3 405.322 4.062 20 0 HIADHN CCOC(=O)C(C)(C)C1CCN(C(=O)NC[C@H](c2ccsc2)N(CC)CC)CC1 ZINC000479372933 894673373 /nfs/dbraw/zinc/67/33/73/894673373.db2.gz ADJMYPWHFLHBDW-LJQANCHMSA-N 0 3 423.623 4.142 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N[C@H](CCO)c1ccc(Cl)cc1)c1ccsc1 ZINC000479385367 894686369 /nfs/dbraw/zinc/68/63/69/894686369.db2.gz MBILSSFHSMPJPE-MOPGFXCFSA-N 0 3 409.983 4.207 20 0 HIADHN CCCOC[C@H](Cc1cccc(Br)c1)NCc1cnc(N(C)C)s1 ZINC000479401352 894705551 /nfs/dbraw/zinc/70/55/51/894705551.db2.gz GDCIAGCMJADLIQ-INIZCTEOSA-N 0 3 412.397 4.099 20 0 HIADHN C[C@@H](NC1(Cc2ccccc2)CCC1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479412287 894719826 /nfs/dbraw/zinc/71/98/26/894719826.db2.gz AHKGGJYIQKIVAZ-CYBMUJFWSA-N 0 3 413.370 4.457 20 0 HIADHN CCS(=O)(=O)c1c(Cl)cccc1CN[C@H]1CCN(Cc2ccccc2)[C@@H](C)C1 ZINC000479452099 894771131 /nfs/dbraw/zinc/77/11/31/894771131.db2.gz IGLNNIYDESFBFJ-PXNSSMCTSA-N 0 3 421.006 4.276 20 0 HIADHN CCS(=O)(=O)c1c(Cl)cccc1CN[C@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000479458445 894779507 /nfs/dbraw/zinc/77/95/07/894779507.db2.gz XSBMWPFRJQLVMK-HKUYNNGSSA-N 0 3 411.926 4.283 20 0 HIADHN COC(=O)[C@@H](NC1CCN([C@H](C)c2ccncc2)CC1)c1ccc(Cl)c(Cl)c1 ZINC000479487636 894809210 /nfs/dbraw/zinc/80/92/10/894809210.db2.gz HVQKOYMYCVJRFG-VLIAUNLRSA-N 0 3 422.356 4.418 20 0 HIADHN CC(C)n1ncc2c1C[C@H](N[C@H](C(=O)Nc1ccc(F)cc1)c1ccccc1)CC2 ZINC000479491834 894811904 /nfs/dbraw/zinc/81/19/04/894811904.db2.gz QPLAWSDJFVIGDK-GGAORHGYSA-N 0 3 406.505 4.430 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)NCc1ncoc1-c1ccccc1 ZINC000479728001 895025678 /nfs/dbraw/zinc/02/56/78/895025678.db2.gz DYRSLRWDENVMGO-IBGZPJMESA-N 0 3 404.514 4.148 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3cc(F)c(OC)cc3C)c(C)c2)CC1 ZINC000479754740 895054261 /nfs/dbraw/zinc/05/42/61/895054261.db2.gz NNZZDLDAXAYQCZ-UHFFFAOYSA-N 0 3 400.498 4.237 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)NCCc1ccc(-n2nc(C)cc2C)cc1)c1ccco1 ZINC000479758362 895059101 /nfs/dbraw/zinc/05/91/01/895059101.db2.gz LBLURZKCBOBRGO-HTAPYJJXSA-N 0 3 423.561 4.053 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N[C@H](C)c1cc(OC)c(OC)cc1C)c1ccco1 ZINC000479778485 895080661 /nfs/dbraw/zinc/08/06/61/895080661.db2.gz BFCAWDKIXHTLIT-LZLYRXPVSA-N 0 3 403.523 4.095 20 0 HIADHN C[C@H](NC[C@@H](c1cccs1)N1CCOCC1)c1ccc(F)cc1OC(F)F ZINC000479850347 895182284 /nfs/dbraw/zinc/18/22/84/895182284.db2.gz HIOFBSKZIFOMSA-BBRMVZONSA-N 0 3 400.466 4.213 20 0 HIADHN O=C1NC2(CCCC2)C(=O)N1CCCCNCc1cc(C(F)(F)F)ccc1Cl ZINC000479868111 895208369 /nfs/dbraw/zinc/20/83/69/895208369.db2.gz XPHXCYJVBSXCDT-UHFFFAOYSA-N 0 3 417.859 4.093 20 0 HIADHN COc1cc(OC)c(OC)cc1CN[C@H]1CCN(c2ccccc2C(F)(F)F)C1 ZINC000479869469 895210525 /nfs/dbraw/zinc/21/05/25/895210525.db2.gz YSPVZBRHUWXYRP-HNNXBMFYSA-N 0 3 410.436 4.100 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)[C@H]1C[C@@H]1c1cccc2ccccc21 ZINC000479966501 895319946 /nfs/dbraw/zinc/31/99/46/895319946.db2.gz QPKNZCXYFGXHKS-FTJBHMTQSA-N 0 3 414.549 4.216 20 0 HIADHN COCCN1CCC(NC(=O)N(C)[C@@H](c2ccc(Cl)cc2)C2CCCC2)CC1 ZINC000479992806 895345065 /nfs/dbraw/zinc/34/50/65/895345065.db2.gz VSWSMNKSHWDSKG-OAQYLSRUSA-N 0 3 407.986 4.324 20 0 HIADHN Cc1c(N[C@H](C)C(C)C)cccc1C(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000479991666 895345944 /nfs/dbraw/zinc/34/59/44/895345944.db2.gz OYKDYVOMZLQTEU-HXUWFJFHSA-N 0 3 423.601 4.338 20 0 HIADHN Cc1ccc(C(C)C)cc1O[C@H](C)C(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000479998574 895352639 /nfs/dbraw/zinc/35/26/39/895352639.db2.gz WUXUCYHZRZIWCV-HXUWFJFHSA-N 0 3 424.585 4.159 20 0 HIADHN Cc1cc(-c2noc(CNc3ccccc3CN3CCC(CO)CC3)n2)ccc1F ZINC000480030954 895380042 /nfs/dbraw/zinc/38/00/42/895380042.db2.gz TWULQSGJJPDKJZ-UHFFFAOYSA-N 0 3 410.493 4.001 20 0 HIADHN CN(C)CCN(C)C(=O)c1cccc(NC(=O)Nc2ccc(Cl)c(Cl)c2)c1 ZINC000480081470 895438133 /nfs/dbraw/zinc/43/81/33/895438133.db2.gz FSJPNTPAHLKHLA-UHFFFAOYSA-N 0 3 409.317 4.271 20 0 HIADHN CCCc1c(NC(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)cnn1-c1cc(C)ccn1 ZINC000480118781 895491217 /nfs/dbraw/zinc/49/12/17/895491217.db2.gz DEAUABHHTIHYEV-WZONZLPQSA-N 0 3 420.561 4.341 20 0 HIADHN C[C@H](c1ccccc1)[C@H](C)N[C@H]1CCS(=O)(=O)c2ccc(Br)cc21 ZINC000480167644 895558722 /nfs/dbraw/zinc/55/87/22/895558722.db2.gz JLZBEGJZQDUPCU-DEYYWGMASA-N 0 3 408.361 4.449 20 0 HIADHN Cc1cn2c(n1)[C@@H](CN[C@@H](c1ccc(Br)cc1)c1cncnc1)CCC2 ZINC000480181397 895573228 /nfs/dbraw/zinc/57/32/28/895573228.db2.gz NWUVEQJSNRJDOK-APWZRJJASA-N 0 3 412.335 4.001 20 0 HIADHN Cc1cn2c(n1)[C@H](CN[C@@H](c1ccc(Br)cc1)c1cncnc1)CCC2 ZINC000480181400 895573753 /nfs/dbraw/zinc/57/37/53/895573753.db2.gz NWUVEQJSNRJDOK-LPHOPBHVSA-N 0 3 412.335 4.001 20 0 HIADHN CC[C@H](CN[C@H]1CCS(=O)(=O)c2ccc(Br)cc21)c1ccccc1 ZINC000480195879 895593301 /nfs/dbraw/zinc/59/33/01/895593301.db2.gz ONGZZXUJHIPCCR-KDOFPFPSSA-N 0 3 408.361 4.451 20 0 HIADHN CC[C@H](N[C@H](CN1CCCC1)c1ccccc1)c1ccccc1OCC(=O)N(C)C ZINC000480233238 895638426 /nfs/dbraw/zinc/63/84/26/895638426.db2.gz UQKDSYUDOWLJAZ-XZOQPEGZSA-N 0 3 409.574 4.031 20 0 HIADHN C[C@H](NC[C@H](c1ccc(C(F)(F)F)cc1)N1CCOCC1)c1ccc(Cl)cn1 ZINC000480244655 895654639 /nfs/dbraw/zinc/65/46/39/895654639.db2.gz YFAXWWDWJQQADA-IFXJQAMLSA-N 0 3 413.871 4.478 20 0 HIADHN O=S1(=O)CC[C@H](NC2(Cc3ccccc3)CCC2)c2cc(Br)ccc21 ZINC000480301320 895706119 /nfs/dbraw/zinc/70/61/19/895706119.db2.gz NUVFTISSGKGCRS-SFHVURJKSA-N 0 3 420.372 4.423 20 0 HIADHN Cc1cc(-c2nc(C3CC3)no2)ccc1NC(=O)N[C@@H](CN(C)C)c1ccc(F)cc1 ZINC000480302690 895707882 /nfs/dbraw/zinc/70/78/82/895707882.db2.gz USECRPJGJWIQSZ-FQEVSTJZSA-N 0 3 423.492 4.486 20 0 HIADHN C[C@@H](Cn1ncc2ccccc2c1=O)NCc1cc(Br)c(Cl)s1 ZINC000480304606 895708819 /nfs/dbraw/zinc/70/88/19/895708819.db2.gz JMDBZOHYAPQVNQ-JTQLQIEISA-N 0 3 412.740 4.052 20 0 HIADHN C[C@@H](NCc1ccc(NC(N)=O)cc1)c1cccc(OCc2cn3ccccc3n2)c1 ZINC000480311140 895713271 /nfs/dbraw/zinc/71/32/71/895713271.db2.gz ZDYOHOSVGKVMIK-QGZVFWFLSA-N 0 3 415.497 4.255 20 0 HIADHN Cc1cc(NC(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)nn1[C@H](C)C1CC1 ZINC000480320558 895722567 /nfs/dbraw/zinc/72/25/67/895722567.db2.gz RCTXDXBGENSPCE-DYESRHJHSA-N 0 3 413.566 4.374 20 0 HIADHN CN(C)Cc1cccc(NC(=O)CSc2nc3ccccc3nc2N2CCCC2)c1 ZINC000480332452 895735071 /nfs/dbraw/zinc/73/50/71/895735071.db2.gz VYFIBPRXLFENRQ-UHFFFAOYSA-N 0 3 421.570 4.022 20 0 HIADHN Brc1ccc(CN[C@H]2CCN(c3ccccc3Br)C2)o1 ZINC000480339901 895745056 /nfs/dbraw/zinc/74/50/56/895745056.db2.gz WGKMZFWPXVFUEA-NSHDSACASA-N 0 3 400.114 4.173 20 0 HIADHN COc1cc(Cl)c(C)cc1NC(=O)CCNCc1ccc(N(C)C(C)C)nc1 ZINC000480375692 895782118 /nfs/dbraw/zinc/78/21/18/895782118.db2.gz GUHQJJFMJXOGDY-UHFFFAOYSA-N 0 3 404.942 4.015 20 0 HIADHN CC[C@@H](C)[C@H](NCc1ccc(N(C)CC)nc1)C(=O)Nc1cccc(N2CCCC2)c1 ZINC000480386173 895791615 /nfs/dbraw/zinc/79/16/15/895791615.db2.gz KYFAMXIDVAKEHQ-DVECYGJZSA-N 0 3 423.605 4.281 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@@H](C)NCc2nccn2-c2ccccc2)CC1 ZINC000480385726 895792886 /nfs/dbraw/zinc/79/28/86/895792886.db2.gz RETTXKYAEOGSAS-LJQANCHMSA-N 0 3 407.537 4.004 20 0 HIADHN Cc1cc(Br)cc(Cl)c1C(=O)NC[C@@H](Cc1ccccc1)N(C)C ZINC000480394326 895800941 /nfs/dbraw/zinc/80/09/41/895800941.db2.gz JVFBKHJZQDMBNN-MRXNPFEDSA-N 0 3 409.755 4.314 20 0 HIADHN Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)C(=O)NC[C@H](c1ccccc1)N1CCCC1 ZINC000480407493 895809308 /nfs/dbraw/zinc/80/93/08/895809308.db2.gz VURNOMLQQWKVMQ-HNAYVOBHSA-N 0 3 422.495 4.119 20 0 HIADHN CCOc1c(Cl)cccc1CC(=O)Nc1cccc(N2CCN(CC)CC2)c1 ZINC000480426533 895822128 /nfs/dbraw/zinc/82/21/28/895822128.db2.gz JVSKMWGANWHUQT-UHFFFAOYSA-N 0 3 401.938 4.062 20 0 HIADHN CCN(CC)C(=O)Nc1ccc([C@H](C)N[C@H](CN2CCOCC2)c2ccccc2)cc1 ZINC000480445778 895834374 /nfs/dbraw/zinc/83/43/74/895834374.db2.gz HDDHUDRSVAKRMB-GBXCKJPGSA-N 0 3 424.589 4.284 20 0 HIADHN COc1cc([C@H](C)N[C@H](CN2CCOCC2)c2ccccc2)ccc1OC(F)F ZINC000480447089 895835289 /nfs/dbraw/zinc/83/52/89/895835289.db2.gz USPBNGLPPVTYES-QFBILLFUSA-N 0 3 406.473 4.021 20 0 HIADHN C[C@@H](N[C@@H](CN1CCOCC1)c1ccccc1)c1ccc(F)c(Br)c1 ZINC000480446630 895835347 /nfs/dbraw/zinc/83/53/47/895835347.db2.gz LEYGYVNROJBMTH-QRWLVFNGSA-N 0 3 407.327 4.312 20 0 HIADHN Cc1nc(-c2cccnc2)sc1[C@H](C)N[C@H](CN1CCOCC1)c1ccccc1 ZINC000480457051 895843440 /nfs/dbraw/zinc/84/34/40/895843440.db2.gz WCXFVHZJHILPLJ-LAUBAEHRSA-N 0 3 408.571 4.238 20 0 HIADHN Cc1ccc(Oc2ccc(NC(=O)N3CC[C@H](N4CCN(C)CC4)[C@H](C)C3)cc2)cc1 ZINC000480536257 895899065 /nfs/dbraw/zinc/89/90/65/895899065.db2.gz AMMMLMBCQDUFFL-YKSBVNFPSA-N 0 3 422.573 4.277 20 0 HIADHN Cn1ncc2c1CCC[C@@H]2NCc1ccc(NC(=O)CCCOc2ccccc2)cc1 ZINC000480602079 895966608 /nfs/dbraw/zinc/96/66/08/895966608.db2.gz PNJZZKBVPYLEFN-QHCPKHFHSA-N 0 3 418.541 4.385 20 0 HIADHN C[C@@H](NCc1ccc(N2CCO[C@H](C)C2)nc1)c1ccc(OCC(F)(F)F)cc1 ZINC000480614623 895980285 /nfs/dbraw/zinc/98/02/85/895980285.db2.gz NQXJFADOCXRLIL-HZPDHXFCSA-N 0 3 409.452 4.099 20 0 HIADHN C[C@H](N[C@@H](C)c1cccc(N2CCCS2(=O)=O)c1)c1cccc(OC(F)F)c1 ZINC000480630856 895998905 /nfs/dbraw/zinc/99/89/05/895998905.db2.gz NUIBVFZHPONIAR-GJZGRUSLSA-N 0 3 410.486 4.240 20 0 HIADHN Cn1cc([C@H](NC2CCN(c3ccc(F)cc3F)CC2)c2ccc(F)cc2)cn1 ZINC000480659304 896025627 /nfs/dbraw/zinc/02/56/27/896025627.db2.gz DCOVNUDITUQLKD-JOCHJYFZSA-N 0 3 400.448 4.185 20 0 HIADHN CCCN1C(=O)CCc2cc(NC(=O)NC[C@H](N[C@H](C)CC)c3ccco3)ccc21 ZINC000480684901 896047295 /nfs/dbraw/zinc/04/72/95/896047295.db2.gz PXSQYRZUYUUHHQ-APWZRJJASA-N 0 3 412.534 4.220 20 0 HIADHN CCOc1ccc(Cl)cc1[C@@H](C)NCc1ccc(N2CCN(CC)CC2)nc1 ZINC000480694572 896056391 /nfs/dbraw/zinc/05/63/91/896056391.db2.gz HDXPOZXZKMZPKW-QGZVFWFLSA-N 0 3 402.970 4.126 20 0 HIADHN CCSc1ccc([C@H](C)NCc2ccc(N3CCCS3(=O)=O)c(F)c2)cc1 ZINC000480697533 896059877 /nfs/dbraw/zinc/05/98/77/896059877.db2.gz LMZVZJILTXJNSD-HNNXBMFYSA-N 0 3 408.564 4.328 20 0 HIADHN Cc1ccc2c(c1C)OC[C@H]2NC(=O)N(CCN(C)C)Cc1cccc(Cl)c1 ZINC000480716894 896077454 /nfs/dbraw/zinc/07/74/54/896077454.db2.gz BQAOUHOHYYNIGL-HXUWFJFHSA-N 0 3 401.938 4.164 20 0 HIADHN O=C(Nc1cccc(Oc2cnccn2)c1)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000505374767 914038170 /nfs/dbraw/zinc/03/81/70/914038170.db2.gz IAVWENLEXKZZLW-HXUWFJFHSA-N 0 3 424.451 4.365 20 0 HIADHN C[C@H](NCc1cccc(NC(=O)c2ccccn2)c1)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000480892713 896250938 /nfs/dbraw/zinc/25/09/38/896250938.db2.gz YYFAAAOWPHZLMX-INIZCTEOSA-N 0 3 414.509 4.414 20 0 HIADHN CCCc1ccc([C@@H](C)NCc2cccc(NC(=O)CCN3CCOCC3)c2)cc1 ZINC000480910830 896267419 /nfs/dbraw/zinc/26/74/19/896267419.db2.gz PJPSPZHPCYWUEX-HXUWFJFHSA-N 0 3 409.574 4.151 20 0 HIADHN Cc1onc(-c2cccc(Cl)c2)c1C(=O)N(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1 ZINC000481036251 896363062 /nfs/dbraw/zinc/36/30/62/896363062.db2.gz IQDZHHHVWODAJS-AVRDEDQJSA-N 0 3 424.932 4.463 20 0 HIADHN Fc1cccc(F)c1-c1csc(CN2CCC(CCCN3CCOCC3)CC2)n1 ZINC000481081025 896401201 /nfs/dbraw/zinc/40/12/01/896401201.db2.gz YQFOOBLVRBRMOG-UHFFFAOYSA-N 0 3 421.557 4.413 20 0 HIADHN CCOc1ccc([C@H](C)NC(=O)N[C@@H]2CCN(Cc3ccccc3)[C@H]2C)cc1OC ZINC000481117489 896443130 /nfs/dbraw/zinc/44/31/30/896443130.db2.gz XVJKGNMYGXABGX-BBTUJRGHSA-N 0 3 411.546 4.117 20 0 HIADHN COc1ccc2ccccc2c1-c1cc(CNC2(CO)Cc3ccccc3C2)on1 ZINC000481144675 896472978 /nfs/dbraw/zinc/47/29/78/896472978.db2.gz QURASZTUPPMACK-UHFFFAOYSA-N 0 3 400.478 4.123 20 0 HIADHN COc1cc([C@H](C)N[C@H]2CCc3c2cc(Br)cc3F)ccc1OCCO ZINC000481185876 896533495 /nfs/dbraw/zinc/53/34/95/896533495.db2.gz VEAANCVWVGRXLH-SGTLLEGYSA-N 0 3 424.310 4.306 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)NCc2cc(-c3ccccc3)no2)N(C)C)cc1 ZINC000481224250 896576198 /nfs/dbraw/zinc/57/61/98/896576198.db2.gz GWKIUWNRBUNLQM-HSZRJFAPSA-N 0 3 422.529 4.231 20 0 HIADHN C[C@H](N[C@@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O)c1ccc(-n2cncn2)cc1 ZINC000481235032 896585147 /nfs/dbraw/zinc/58/51/47/896585147.db2.gz JNLYMSRNAFAABZ-ORAYPTAESA-N 0 3 416.312 4.030 20 0 HIADHN COc1cc(OC)c([C@@H](C)NC[C@@H](c2cccc(F)c2)N2CCOCC2)cc1Cl ZINC000481239176 896588655 /nfs/dbraw/zinc/58/86/55/896588655.db2.gz FVHZOVKSIQKMSQ-QRWLVFNGSA-N 0 3 422.928 4.220 20 0 HIADHN CCOc1ccc([C@H](C)NCc2ccc(S(=O)(=O)N3CCC[C@H](C)C3)cc2)cc1 ZINC000481302784 896648860 /nfs/dbraw/zinc/64/88/60/896648860.db2.gz DWQXRAJQYJGACM-OALUTQOASA-N 0 3 416.587 4.357 20 0 HIADHN Cc1cc2n[nH]cc2cc1NC(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000481304544 896650871 /nfs/dbraw/zinc/65/08/71/896650871.db2.gz IDKBKYPTAQDFDR-FQEVSTJZSA-N 0 3 402.420 4.264 20 0 HIADHN CC[C@H](NCc1ccc(S(=O)(=O)N2CCC[C@H](C)C2)cc1)c1cccc(OC)c1 ZINC000481318832 896669981 /nfs/dbraw/zinc/66/99/81/896669981.db2.gz KMYIYZHFIBIRDX-MBSDFSHPSA-N 0 3 416.587 4.357 20 0 HIADHN CC[C@H](N[C@H](C)c1ccccc1-n1cccn1)c1ccccc1OCC(=O)N(C)C ZINC000481324368 896681755 /nfs/dbraw/zinc/68/17/55/896681755.db2.gz YNPZYVAPQWZNBC-NQIIRXRSSA-N 0 3 406.530 4.141 20 0 HIADHN CC[C@H](N[C@@H](C)c1ccc2c(c1)C(C)(C)C(=O)N2)c1ccccc1OCC(=O)N(C)C ZINC000481339727 896705403 /nfs/dbraw/zinc/70/54/03/896705403.db2.gz RFUSDUUWDBWMAR-JXFKEZNVSA-N 0 3 423.557 4.185 20 0 HIADHN CN(C)C[C@H](NC(=O)N[C@@H](c1ccc(F)cc1)C(F)(F)F)c1ccc(F)cc1 ZINC000481391413 896795653 /nfs/dbraw/zinc/79/56/53/896795653.db2.gz LVGPJWYFDJKWCE-IRXDYDNUSA-N 0 3 401.379 4.170 20 0 HIADHN CCS(=O)(=O)Nc1ccc([C@@H](C)NCc2cccc(NC(=O)CC(C)C)c2)cc1 ZINC000481407163 896813798 /nfs/dbraw/zinc/81/37/98/896813798.db2.gz ROALPSWZOAILPD-QGZVFWFLSA-N 0 3 417.575 4.284 20 0 HIADHN COc1ccc([C@@H](CNC(=O)Nc2ccnn2[C@@H](C)CC(C)C)N2CCCC2)cc1 ZINC000481452094 896848292 /nfs/dbraw/zinc/84/82/92/896848292.db2.gz SLMMOQZMIRTRKY-GHTZIAJQSA-N 0 3 413.566 4.457 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)CCc3cc(Cl)cc(Cl)c3)CC2)C[C@H](C)O1 ZINC000481520535 896886419 /nfs/dbraw/zinc/88/64/19/896886419.db2.gz MACFBUVYQPVGIP-IYBDPMFKSA-N 0 3 413.389 4.274 20 0 HIADHN C[C@@H](NC[C@@H](O)COc1ccc(C(F)(F)F)cc1)c1cnn(Cc2ccccc2)c1 ZINC000481533830 896895240 /nfs/dbraw/zinc/89/52/40/896895240.db2.gz LXWOIJADHVRALY-OXQOHEQNSA-N 0 3 419.447 4.041 20 0 HIADHN Cc1c([C@H](C)NC[C@@H](O)COc2ccc(F)cc2)cnn1-c1cccc(Cl)c1 ZINC000481555314 896926396 /nfs/dbraw/zinc/92/63/96/896926396.db2.gz DRKMKAWDAUPNKN-IFXJQAMLSA-N 0 3 403.885 4.064 20 0 HIADHN Cc1cc(NC(=O)Cc2coc(-c3cccs3)n2)cc(N2CCN(C(C)C)CC2)c1 ZINC000481639591 897024782 /nfs/dbraw/zinc/02/47/82/897024782.db2.gz QHDXGBCEIHCGFA-UHFFFAOYSA-N 0 3 424.570 4.423 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)[C@@H](C)Cc3cncc4ccccc43)cc2)CC1 ZINC000481642170 897026243 /nfs/dbraw/zinc/02/62/43/897026243.db2.gz RLFGJHPUHFASHO-FQEVSTJZSA-N 0 3 416.569 4.190 20 0 HIADHN Cc1cc(NC(=O)C[C@H]2CCO[C@H](C(C)C)C2)cc(N2CCN(C(C)C)CC2)c1 ZINC000481663128 897046251 /nfs/dbraw/zinc/04/62/51/897046251.db2.gz NUCJVTFIFJFEOO-REWPJTCUSA-N 0 3 401.595 4.305 20 0 HIADHN CC1(C)CC[C@H](NCc2ccccc2OCC(=O)NC[C@@H]2CCCO2)c2ccccc21 ZINC000481672693 897057064 /nfs/dbraw/zinc/05/70/64/897057064.db2.gz SGRIZMLYBCNTIW-REWPJTCUSA-N 0 3 422.569 4.263 20 0 HIADHN CCOC(=O)C[C@@](C)(NCC(=O)Nc1ccc(Cl)cc1C(F)(F)F)C(C)C ZINC000481685482 897069181 /nfs/dbraw/zinc/06/91/81/897069181.db2.gz IYRUXUBBVQDJAN-QGZVFWFLSA-N 0 3 408.848 4.255 20 0 HIADHN CCOC(=O)C[C@](C)(NCC(=O)Nc1ccc(Cl)cc1C(F)(F)F)C(C)C ZINC000481685481 897069636 /nfs/dbraw/zinc/06/96/36/897069636.db2.gz IYRUXUBBVQDJAN-KRWDZBQOSA-N 0 3 408.848 4.255 20 0 HIADHN CC(C)C[C@@H]1OCCC[C@H]1NCC(=O)N1N=C(c2ccco2)C[C@H]1c1cccs1 ZINC000481725055 897119601 /nfs/dbraw/zinc/11/96/01/897119601.db2.gz NSVSMTMVRNKUAZ-KPFFTGBYSA-N 0 3 415.559 4.202 20 0 HIADHN CC[C@H](CN(CC)[C@H](C)C(=O)NCC(=O)Nc1c(C)cccc1C)c1ccccc1 ZINC000481734888 897129508 /nfs/dbraw/zinc/12/95/08/897129508.db2.gz LUISRQTXCQABHD-NHCUHLMSSA-N 0 3 409.574 4.262 20 0 HIADHN CC[C@@H](CN(CC)CC(=O)N1CCC(C(=O)Nc2ccccc2)CC1)c1ccccc1 ZINC000481765950 897152298 /nfs/dbraw/zinc/15/22/98/897152298.db2.gz HKAFCRQCBYCFSL-NRFANRHFSA-N 0 3 421.585 4.379 20 0 HIADHN C[C@@H](NCc1ccc(S(=O)(=O)N2CCCC2)o1)C1(c2ccccc2)CCCC1 ZINC000481825878 897196886 /nfs/dbraw/zinc/19/68/86/897196886.db2.gz SVMZIZVTTHRVRR-GOSISDBHSA-N 0 3 402.560 4.054 20 0 HIADHN COc1ccc(-c2ccncc2)cc1CN1CCC(C(=O)NCc2ccccc2)CC1 ZINC000481911184 897294520 /nfs/dbraw/zinc/29/45/20/897294520.db2.gz XJHXESSTMSCZPD-UHFFFAOYSA-N 0 3 415.537 4.286 20 0 HIADHN COc1cc(F)c([C@@H](C)N[C@@H]2CCN(c3cc(Cl)ccc3OC)C2)cc1OC ZINC000481933760 897318093 /nfs/dbraw/zinc/31/80/93/897318093.db2.gz IJNUKQRVPCEBBJ-UKRRQHHQSA-N 0 3 408.901 4.434 20 0 HIADHN CC1(C)CC[C@@H](NC[C@H]2CCCCS2(=O)=O)c2cc(Br)ccc21 ZINC000481991041 897386743 /nfs/dbraw/zinc/38/67/43/897386743.db2.gz GYGMOBGLXZEFGT-RHSMWYFYSA-N 0 3 400.382 4.119 20 0 HIADHN CC[C@H](N[C@@H](CC(F)(F)F)C(C)C)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000481992463 897388180 /nfs/dbraw/zinc/38/81/80/897388180.db2.gz OJPCHYDLFANPSW-KBPBESRZSA-N 0 3 400.894 4.266 20 0 HIADHN C[C@H](Cc1ccccc1C(F)(F)F)N[C@H](c1nc(-c2nc[nH]n2)no1)C(C)(C)C ZINC000482001838 897398853 /nfs/dbraw/zinc/39/88/53/897398853.db2.gz YCMRLJMTTMJUFH-BXUZGUMPSA-N 0 3 408.428 4.182 20 0 HIADHN COc1ccc(CCN[C@@H](C)c2nnn(-c3ccc(C)cc3)c2C)cc1OC(F)F ZINC000482029462 897438282 /nfs/dbraw/zinc/43/82/82/897438282.db2.gz FBEKWFKMRQOYMQ-HNNXBMFYSA-N 0 3 416.472 4.387 20 0 HIADHN COC(=O)c1ccc(-c2ccc(CNCCc3nnc(-c4ccccc4)o3)o2)cc1 ZINC000482033663 897446545 /nfs/dbraw/zinc/44/65/45/897446545.db2.gz SYHMFBIBUKPQLP-UHFFFAOYSA-N 0 3 403.438 4.116 20 0 HIADHN CCCOc1c(Br)cc(Br)cc1CNC[C@](C)(O)C1CC1 ZINC000482042806 897462003 /nfs/dbraw/zinc/46/20/03/897462003.db2.gz OOQXDHKAVAADFD-INIZCTEOSA-N 0 3 421.173 4.251 20 0 HIADHN O=C(CCc1ncc(-c2ccc(Cl)cc2)o1)N1CCN(C2CCCCC2)CC1 ZINC000482061509 897493293 /nfs/dbraw/zinc/49/32/93/897493293.db2.gz PDZQZNNCRGQXKU-UHFFFAOYSA-N 0 3 401.938 4.405 20 0 HIADHN COC(=O)c1cccc(CNC2(c3ccc(Br)cc3)CCOCC2)c1 ZINC000505486851 914169467 /nfs/dbraw/zinc/16/94/67/914169467.db2.gz LFOMDYJFOFNPSO-UHFFFAOYSA-N 0 3 404.304 4.031 20 0 HIADHN C[C@@H](NCc1ccc([C@]2(C)NC(=O)NC2=O)cc1)c1ccc(Oc2ccccc2)cc1 ZINC000482104223 897552220 /nfs/dbraw/zinc/55/22/20/897552220.db2.gz FNVTZKFDUTWFPW-NSYGIPOTSA-N 0 3 415.493 4.384 20 0 HIADHN COc1ccccc1N1CC[C@@H](CN[C@@H](C)c2nnn(-c3ccc(C)cc3)c2C)C1 ZINC000482114553 897566640 /nfs/dbraw/zinc/56/66/40/897566640.db2.gz NZSVNISKZHUGLJ-ICSRJNTNSA-N 0 3 405.546 4.070 20 0 HIADHN C[C@H](NCCc1nccs1)c1cccc(S(=O)(=O)NC2CCCCCC2)c1 ZINC000482119357 897572663 /nfs/dbraw/zinc/57/26/63/897572663.db2.gz LLANLFKSUPKJSD-INIZCTEOSA-N 0 3 407.605 4.038 20 0 HIADHN Cc1nc(-c2cccnc2)sc1[C@H](C)N[C@H](Cc1ccccc1)C(=O)N1CCCC1 ZINC000482125095 897580599 /nfs/dbraw/zinc/58/05/99/897580599.db2.gz JCIGPNMWMZCFKA-LAUBAEHRSA-N 0 3 420.582 4.398 20 0 HIADHN O=C(CCc1ccc(Br)cc1)N1CCCN(Cc2ccccc2)CC1 ZINC000482145700 897607477 /nfs/dbraw/zinc/60/74/77/897607477.db2.gz UHUADQHLQCGSAH-UHFFFAOYSA-N 0 3 401.348 4.116 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N[C@H](c2ccc(Cl)cc2)C(F)(F)F)CC1 ZINC000482159545 897622657 /nfs/dbraw/zinc/62/26/57/897622657.db2.gz XNPCMGQMWQHBOW-QGZVFWFLSA-N 0 3 421.891 4.132 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)NC[C@H]1CCCC[C@H]1C(F)(F)F ZINC000482218576 897698057 /nfs/dbraw/zinc/69/80/57/897698057.db2.gz UTMOVGBPAHFMSH-UYAOXDASSA-N 0 3 411.512 4.074 20 0 HIADHN CCC[C@@H](N[C@H](C)c1cc(OC)c(OC)cc1C)C(=O)N1CCc2sccc2C1 ZINC000482237478 897717872 /nfs/dbraw/zinc/71/78/72/897717872.db2.gz DLOWVLACFNEAAZ-VQIMIIECSA-N 0 3 416.587 4.478 20 0 HIADHN CCC[C@@H](N[C@@H](C)c1ccc(OCCOC)cc1)C(=O)N1CCc2sccc2C1 ZINC000482236648 897718228 /nfs/dbraw/zinc/71/82/28/897718228.db2.gz BADGKYVGDRYDFE-LAUBAEHRSA-N 0 3 416.587 4.178 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)N[C@H](C3CCCCC3)C(F)(F)F)CC2)C[C@H](C)O1 ZINC000482265737 897750976 /nfs/dbraw/zinc/75/09/76/897750976.db2.gz HAGQLTPIZZERDE-JTDSTZFVSA-N 0 3 419.532 4.028 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)C[C@@H](c2ccccc2)C(F)(F)F)c1 ZINC000482351128 897864729 /nfs/dbraw/zinc/86/47/29/897864729.db2.gz NWFVEHANZHZPDJ-FQEVSTJZSA-N 0 3 408.464 4.322 20 0 HIADHN COc1ccc([C@@H](NC(=O)N[C@H](CN2CCCC2)c2ccccc2)C(F)(F)F)cc1 ZINC000482364311 897882538 /nfs/dbraw/zinc/88/25/38/897882538.db2.gz VICOTQWJTWBQDH-WOJBJXKFSA-N 0 3 421.463 4.435 20 0 HIADHN COc1ccc([C@@H](NC(=O)NCCCN2CCc3ccccc3C2)C(F)(F)F)cc1 ZINC000482369769 897891455 /nfs/dbraw/zinc/89/14/55/897891455.db2.gz ZNTSBTJJNBBGQU-HXUWFJFHSA-N 0 3 421.463 4.046 20 0 HIADHN CN(C)CCN(C(=O)N[C@@H](c1ccccc1OC(F)F)C(F)(F)F)C1CCCC1 ZINC000482377129 897904899 /nfs/dbraw/zinc/90/48/99/897904899.db2.gz OYVXOXOJAKTELW-INIZCTEOSA-N 0 3 423.426 4.407 20 0 HIADHN CN(C)C[C@@H](NC(=O)Nc1cc(Br)c(F)cc1F)c1ccc(F)cc1 ZINC000482473138 898049518 /nfs/dbraw/zinc/04/95/18/898049518.db2.gz GCLLVDMJCNOYRQ-MRXNPFEDSA-N 0 3 416.241 4.291 20 0 HIADHN COC(=O)COc1ccc(CN(C)Cc2ccc(Oc3cccnc3)c(C)c2)cc1 ZINC000482513057 898099081 /nfs/dbraw/zinc/09/90/81/898099081.db2.gz ZUIYMXJPGSMPJW-UHFFFAOYSA-N 0 3 406.482 4.366 20 0 HIADHN CC(=O)N[C@H](C)C1CCN(Cc2cnc(-c3ccc(Br)cc3)s2)CC1 ZINC000482513674 898100367 /nfs/dbraw/zinc/10/03/67/898100367.db2.gz UWWCHKLCSKLCMY-CYBMUJFWSA-N 0 3 422.392 4.309 20 0 HIADHN CCc1nc2c(s1)[C@@H](N[C@H](C)c1cc(F)ccc1N1CCN(C)CC1)CCC2 ZINC000482529104 898116656 /nfs/dbraw/zinc/11/66/56/898116656.db2.gz APYLSIFSBQFYSS-QAPCUYQASA-N 0 3 402.583 4.325 20 0 HIADHN Cc1nc(Cc2ccccc2)sc1[C@@H](C)NC[C@@H](O)COc1ccc(F)c(F)c1 ZINC000482538194 898125425 /nfs/dbraw/zinc/12/54/25/898125425.db2.gz PTGOEWBICRDOND-RHSMWYFYSA-N 0 3 418.509 4.411 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(F)cc1N(C)C)c1cc(F)ccc1N1CCN(C)CC1 ZINC000482544596 898133401 /nfs/dbraw/zinc/13/34/01/898133401.db2.gz TWIHJUWWCWQNJA-DLBZAZTESA-N 0 3 402.533 4.194 20 0 HIADHN C[C@@H](N[C@@H](C)c1cc(F)ccc1N1CCN(C)CC1)c1ccc(F)cc1N(C)C ZINC000482544601 898133554 /nfs/dbraw/zinc/13/35/54/898133554.db2.gz TWIHJUWWCWQNJA-SJORKVTESA-N 0 3 402.533 4.194 20 0 HIADHN COc1cc(F)c([C@@H](C)N[C@H](C)c2cc(F)ccc2N2CCN(C)CC2)cc1OC ZINC000482558436 898150944 /nfs/dbraw/zinc/15/09/44/898150944.db2.gz SVXAZGXSORINRS-HZPDHXFCSA-N 0 3 419.516 4.146 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@@H](C)N[C@@H](C)c2ccc(OC)cc2OC)CC1 ZINC000482570415 898165417 /nfs/dbraw/zinc/16/54/17/898165417.db2.gz WNNIAMORQMADQT-ZWKOTPCHSA-N 0 3 415.553 4.397 20 0 HIADHN Cn1c(CNC[C@H](CO)Cc2ccccc2C(F)(F)F)nc2ccc(Cl)cc21 ZINC000482581749 898178739 /nfs/dbraw/zinc/17/87/39/898178739.db2.gz QRKHJEURMMVIAP-CYBMUJFWSA-N 0 3 411.855 4.186 20 0 HIADHN CC[C@H](C)C(=O)Nc1cccc(CNC(=O)N[C@@H]2CCN(Cc3ccccc3)[C@@H]2C)c1 ZINC000482583832 898180525 /nfs/dbraw/zinc/18/05/25/898180525.db2.gz UYKKGDOYXMMBIT-YCRNBWNJSA-N 0 3 422.573 4.133 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)[C@@]12CCC(=O)N1c1cc(Cl)ccc1S2 ZINC000482587533 898186286 /nfs/dbraw/zinc/18/62/86/898186286.db2.gz OGSFKBNEKIOSJF-NRFANRHFSA-N 0 3 415.946 4.278 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)c1ccc(=O)n(Cc2ccccc2Cl)c1 ZINC000482591113 898191436 /nfs/dbraw/zinc/19/14/36/898191436.db2.gz ZGUYZBRTRBKVFG-UHFFFAOYSA-N 0 3 409.917 4.172 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)CCSc1ccc2c(c1)OCCCO2 ZINC000482593074 898192855 /nfs/dbraw/zinc/19/28/55/898192855.db2.gz AEKMDUIVWKFWPO-UHFFFAOYSA-N 0 3 400.544 4.339 20 0 HIADHN C[C@H](CNC(=O)Nc1ccc2c(c1)CCC(=O)N2CC1CC1)N(C)Cc1ccccc1 ZINC000482613691 898215770 /nfs/dbraw/zinc/21/57/70/898215770.db2.gz DGADBJDJDRYPHY-GOSISDBHSA-N 0 3 420.557 4.018 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)N1CCC[C@]2(C1)OCc1ccccc12 ZINC000482632362 898234993 /nfs/dbraw/zinc/23/49/93/898234993.db2.gz QGIIZNGKIYOGDA-ILBGXUMGSA-N 0 3 405.542 4.055 20 0 HIADHN C[C@@H](NC(=O)N[C@@H](C)c1ccc(NC(=O)NC2CC2)cc1)[C@@H](c1ccccc1)N(C)C ZINC000482637171 898240036 /nfs/dbraw/zinc/24/00/36/898240036.db2.gz JYXZYVFHNXTEED-JKSBSHDWSA-N 0 3 423.561 4.022 20 0 HIADHN Cc1cc(C(=O)Nc2cc(CN(C)C)ccc2C)c2cnn(Cc3cccs3)c2n1 ZINC000482636172 898240468 /nfs/dbraw/zinc/24/04/68/898240468.db2.gz ZFKWCJBSGQDCQH-UHFFFAOYSA-N 0 3 419.554 4.472 20 0 HIADHN CC(C)CN(C(=O)N[C@H]1CCN(Cc2ccccc2)C1)[C@@H]1CCCc2cccnc21 ZINC000482641942 898245367 /nfs/dbraw/zinc/24/53/67/898245367.db2.gz MKXBRLJBCHUWLI-XZOQPEGZSA-N 0 3 406.574 4.401 20 0 HIADHN CC(C)CN(C(=O)N[C@@H]1CCN(Cc2ccccc2)C1)[C@H]1CCCc2cccnc21 ZINC000482641941 898245784 /nfs/dbraw/zinc/24/57/84/898245784.db2.gz MKXBRLJBCHUWLI-PKTZIBPZSA-N 0 3 406.574 4.401 20 0 HIADHN C[C@@H](Cn1ncc2ccccc2c1=O)NCC1=Cc2cc(Cl)cc(Cl)c2OC1 ZINC000482675278 898277781 /nfs/dbraw/zinc/27/77/81/898277781.db2.gz CRSXMPQFCBOBDV-ZDUSSCGKSA-N 0 3 416.308 4.157 20 0 HIADHN Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)NCc1ccc(Cl)cc1-n1cncn1 ZINC000482814144 898425128 /nfs/dbraw/zinc/42/51/28/898425128.db2.gz WAPLAHSMSNAHBY-LLVKDONJSA-N 0 3 412.847 4.147 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)Nc1cccc(Oc2ccncc2)c1 ZINC000482846100 898456583 /nfs/dbraw/zinc/45/65/83/898456583.db2.gz AJCDSQYZOWSZPJ-UHFFFAOYSA-N 0 3 416.525 4.415 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCCC1)c1ccc(Br)cc1F ZINC000482848235 898458531 /nfs/dbraw/zinc/45/85/31/898458531.db2.gz GAIBVFIDQDFKSC-UHFFFAOYSA-N 0 3 415.372 4.070 20 0 HIADHN CC(C)[C@@H](CC(=O)Nc1cccc(CN2CCC(C(N)=O)CC2)c1)c1ccccc1 ZINC000482849951 898461964 /nfs/dbraw/zinc/46/19/64/898461964.db2.gz RKKOBBKTYSYXSD-HSZRJFAPSA-N 0 3 407.558 4.152 20 0 HIADHN COc1cc([C@H](C)NCc2cccc(COC3CCOCC3)c2)cc(OC)c1OC ZINC000482887137 898503117 /nfs/dbraw/zinc/50/31/17/898503117.db2.gz HKHNEGVZHLHGTB-KRWDZBQOSA-N 0 3 415.530 4.259 20 0 HIADHN Cc1nc2ccccc2n1C1CCN([C@@H](C)C(=O)N(C)Cc2cccc(F)c2)CC1 ZINC000482902421 898520174 /nfs/dbraw/zinc/52/01/74/898520174.db2.gz QWYHDCYMDQHWEZ-KRWDZBQOSA-N 0 3 408.521 4.168 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)N2CCN(C3CCCCC3)CC2)c(C)c1 ZINC000482921104 898538367 /nfs/dbraw/zinc/53/83/67/898538367.db2.gz OFBRDYCQAVSNHI-SFHVURJKSA-N 0 3 400.567 4.006 20 0 HIADHN O=C(Nc1ccccc1OC[C@@H]1CCCCO1)N1CCN(C2CCCCC2)CC1 ZINC000482922111 898540110 /nfs/dbraw/zinc/54/01/10/898540110.db2.gz WDHISFRCRDQATI-FQEVSTJZSA-N 0 3 401.551 4.117 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)c1cccc(C(=O)Nc2ccccc2)c1 ZINC000505559186 914262838 /nfs/dbraw/zinc/26/28/38/914262838.db2.gz IQUNKXQLGQDACF-UHFFFAOYSA-N 0 3 423.582 4.030 20 0 HIADHN O=C1NC2(CCCCC2)C(=O)N1Cc1ccccc1CN[C@H]1CCc2cc(F)ccc21 ZINC000482951111 898578895 /nfs/dbraw/zinc/57/88/95/898578895.db2.gz PSYVKNGBSSTZQO-QFIPXVFZSA-N 0 3 421.516 4.358 20 0 HIADHN COC(=O)c1ccc(OCCN[C@H](C)c2ccc(Br)cn2)c(Cl)c1 ZINC000482961362 898591616 /nfs/dbraw/zinc/59/16/16/898591616.db2.gz MWBNDXSKCIDFBX-LLVKDONJSA-N 0 3 413.699 4.014 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(S(=O)(=O)C2CCCC2)cc1)c1ccc(NC(N)=O)cc1 ZINC000482969023 898602002 /nfs/dbraw/zinc/60/20/02/898602002.db2.gz ZWKVILBGYCESGC-HZPDHXFCSA-N 0 3 415.559 4.305 20 0 HIADHN C[C@H]1CCCCN1C(=O)c1ccc(NC(=O)N2CCN(C3CCCCC3)CC2)cc1 ZINC000482981544 898619511 /nfs/dbraw/zinc/61/95/11/898619511.db2.gz LCVMNDANYUXKKQ-IBGZPJMESA-N 0 3 412.578 4.183 20 0 HIADHN Brc1ccc2c(c1)CC[C@@H]2NCc1ccnc(OC2CCOCC2)c1 ZINC000482982565 898621217 /nfs/dbraw/zinc/62/12/17/898621217.db2.gz MGEBHLMQRNQTIN-IBGZPJMESA-N 0 3 403.320 4.179 20 0 HIADHN CO[C@]1(C)CCCN(CC(=O)N[C@@H](c2ccccc2)c2ccc(Cl)cc2)CC1 ZINC000483028578 898690497 /nfs/dbraw/zinc/69/04/97/898690497.db2.gz QTNGVESRHALOHY-XZOQPEGZSA-N 0 3 400.950 4.437 20 0 HIADHN O=C(Nc1ccc(OC(F)F)cc1OC(F)F)N1CCN(C2CCCCC2)CC1 ZINC000483057896 898731762 /nfs/dbraw/zinc/73/17/62/898731762.db2.gz YNOJZFQGTCUASP-UHFFFAOYSA-N 0 3 419.419 4.372 20 0 HIADHN C[C@H](NC(=O)c1ccc(C(=O)N(C)c2ccccc2)cc1)[C@H](c1ccccc1)N(C)C ZINC000505576376 914282461 /nfs/dbraw/zinc/28/24/61/914282461.db2.gz XOOCKFHHQNZURQ-YADARESESA-N 0 3 415.537 4.384 20 0 HIADHN C[C@H](N[C@H](Cc1ccccc1)[C@@H](O)C(F)F)c1ccc(F)c(Br)c1 ZINC000483133544 898815254 /nfs/dbraw/zinc/81/52/54/898815254.db2.gz ZYWOKVJXMOJCHL-YMRXKLBXSA-N 0 3 402.254 4.476 20 0 HIADHN COCC[C@@](C)(O)CN[C@@H](Cc1ccccc1F)c1ccccc1Br ZINC000483138641 898818156 /nfs/dbraw/zinc/81/81/56/898818156.db2.gz WQBSCMZEFJKYLT-VQTJNVASSA-N 0 3 410.327 4.249 20 0 HIADHN COc1ccc(S(=O)(=O)Nc2cccc(CN[C@H](C)c3ccsc3)c2)cc1 ZINC000483144921 898823928 /nfs/dbraw/zinc/82/39/28/898823928.db2.gz SIYSJFSXEMSHJC-OAHLLOKOSA-N 0 3 402.541 4.408 20 0 HIADHN CN(Cc1c[nH]nc1-c1ccc2c(c1)OCCO2)Cc1ccc(OC(F)F)cc1 ZINC000505582431 914289378 /nfs/dbraw/zinc/28/93/78/914289378.db2.gz RSWVVXTVVQDGSR-UHFFFAOYSA-N 0 3 401.413 4.081 20 0 HIADHN C[C@H](NC(=O)Cc1cccc(OCc2cccnc2)c1)[C@H](c1ccccc1)N(C)C ZINC000505590819 914296875 /nfs/dbraw/zinc/29/68/75/914296875.db2.gz KGSVJFXAMRIYPH-UQBPGWFLSA-N 0 3 403.526 4.011 20 0 HIADHN COCCN(C)c1ccc(CN2CCC[C@@H](c3nc4ccccc4n3C(C)C)C2)cn1 ZINC000483260766 898901969 /nfs/dbraw/zinc/90/19/69/898901969.db2.gz KFIMPJURICPSOE-OAQYLSRUSA-N 0 3 421.589 4.474 20 0 HIADHN COCCN(C)c1ccc(CN2CCC[C@H](c3nc4ccccc4n3C(C)C)C2)cn1 ZINC000483260764 898902539 /nfs/dbraw/zinc/90/25/39/898902539.db2.gz KFIMPJURICPSOE-NRFANRHFSA-N 0 3 421.589 4.474 20 0 HIADHN OC[C@@H](NC[C@H](O)CC1CCCC1)c1ccc(Br)cc1C(F)(F)F ZINC000483271581 898910506 /nfs/dbraw/zinc/91/05/06/898910506.db2.gz PUEQQISWDRAUAD-CZUORRHYSA-N 0 3 410.274 4.032 20 0 HIADHN CC(C)N(C)c1ccc(CN2CCC[C@@H](c3nc(-c4ccc(F)cc4)no3)C2)cn1 ZINC000483287419 898923553 /nfs/dbraw/zinc/92/35/53/898923553.db2.gz CCNZXSVQIHOMSK-LJQANCHMSA-N 0 3 409.509 4.495 20 0 HIADHN C[C@@H]1CN(CCC(=O)Nc2ccc(Oc3ccccc3)cc2)C[C@]2(CCCOC2)O1 ZINC000483367088 899003618 /nfs/dbraw/zinc/00/36/18/899003618.db2.gz LDCDTLRNEYLLTA-DVECYGJZSA-N 0 3 410.514 4.077 20 0 HIADHN CN(C(=O)N[C@@H](Cc1cccc(Br)c1)CC1CC1)[C@@H]1CCN(C2CC2)C1 ZINC000483373367 899008929 /nfs/dbraw/zinc/00/89/29/899008929.db2.gz VVMQZCLKUPNHBW-UYAOXDASSA-N 0 3 420.395 4.038 20 0 HIADHN CS[C@H]1CN(C(=O)c2sc(-c3ccc(C)cc3C)nc2C)C[C@@H]1N1CCCC1 ZINC000483391138 899026409 /nfs/dbraw/zinc/02/64/09/899026409.db2.gz DNTWGYSHLJOBMC-OALUTQOASA-N 0 3 415.628 4.387 20 0 HIADHN CS[C@@H]1CN(C(=O)c2csc(-c3ccc(C)cc3C)n2)C[C@H]1N1CCCC1 ZINC000483392534 899027612 /nfs/dbraw/zinc/02/76/12/899027612.db2.gz IAVXJVHZEKQCRL-RTBURBONSA-N 0 3 401.601 4.079 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)Nc3ccc(C)c(-c4ncco4)c3)CC2)c1 ZINC000483397020 899030566 /nfs/dbraw/zinc/03/05/66/899030566.db2.gz QTFNOYQVTDRZPS-UHFFFAOYSA-N 0 3 404.514 4.109 20 0 HIADHN CS[C@@H]1CN(C(=O)c2sc(-c3cccc(Cl)c3)nc2C)C[C@H]1N1CCCC1 ZINC000483398274 899032597 /nfs/dbraw/zinc/03/25/97/899032597.db2.gz XJHWELYZNLHERU-IAGOWNOFSA-N 0 3 422.019 4.424 20 0 HIADHN Cc1noc(C)c1COc1ccc(CC(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)cc1 ZINC000505603509 914309194 /nfs/dbraw/zinc/30/91/94/914309194.db2.gz ORUZFYPDXYHENI-BVZFJXPGSA-N 0 3 421.541 4.221 20 0 HIADHN COc1ccccc1OCc1ccc(C(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)o1 ZINC000505610887 914313625 /nfs/dbraw/zinc/31/36/25/914313625.db2.gz NBJVRJDRUJGVLG-HXOBKFHXSA-N 0 3 408.498 4.288 20 0 HIADHN CCS(=O)(=O)Nc1ccc([C@@H](C)NCc2ccc(C(=O)OC(C)(C)C)cc2)cc1 ZINC000483456026 899094030 /nfs/dbraw/zinc/09/40/30/899094030.db2.gz QOVKMRVSXHJYIN-MRXNPFEDSA-N 0 3 418.559 4.254 20 0 HIADHN CN(C)C[C@H](NC(=O)Nc1cc(F)cc(Br)c1F)c1ccc(F)cc1 ZINC000483548312 899208183 /nfs/dbraw/zinc/20/81/83/899208183.db2.gz KMJCQCQROAYJEP-HNNXBMFYSA-N 0 3 416.241 4.291 20 0 HIADHN CC(C)C(=O)Nc1ccc(Cl)c(C(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)c1 ZINC000505633733 914332635 /nfs/dbraw/zinc/33/26/35/914332635.db2.gz LONZHJQOVDPHHC-FOIQADDNSA-N 0 3 401.938 4.356 20 0 HIADHN Cc1ccc(NC(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)cc1C(=O)N1CCCCC1 ZINC000483633689 899286826 /nfs/dbraw/zinc/28/68/26/899286826.db2.gz OXCPJRKDNKYAAH-AUSIDOKSSA-N 0 3 422.573 4.434 20 0 HIADHN CC(C)[C@H](CC(=O)Nc1ccccc1CN1CCC[C@H](C(N)=O)C1)c1ccccc1 ZINC000483638398 899292737 /nfs/dbraw/zinc/29/27/37/899292737.db2.gz VZWMKQNDNIMCHJ-VXKWHMMOSA-N 0 3 407.558 4.152 20 0 HIADHN COc1ccc2[nH]c3c(c2c1)C[C@@H](N[C@H](C)c1nc(-c2cccc(OC)c2)no1)CC3 ZINC000483655342 899313973 /nfs/dbraw/zinc/31/39/73/899313973.db2.gz PRPACZLYFXTRNT-ZBFHGGJFSA-N 0 3 418.497 4.443 20 0 HIADHN CCOc1ccc(-c2noc(CCC(=O)Nc3ccc(C)cc3CN(C)C)n2)cc1 ZINC000505639159 914339050 /nfs/dbraw/zinc/33/90/50/914339050.db2.gz WOGLNDOBEOEKPQ-UHFFFAOYSA-N 0 3 408.502 4.077 20 0 HIADHN C[C@H](N[C@H]1CCCN(c2ccccc2Cl)C1=O)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000483717446 899375251 /nfs/dbraw/zinc/37/52/51/899375251.db2.gz ZGJXYXLYYYRBLA-LIRRHRJNSA-N 0 3 411.933 4.416 20 0 HIADHN CC(C)n1cc([C@@H](C)NCc2cc(C(F)(F)F)ccc2N2CCN(C)CC2)cn1 ZINC000483747889 899411801 /nfs/dbraw/zinc/41/18/01/899411801.db2.gz VXKHRUHKQWTEDA-MRXNPFEDSA-N 0 3 409.500 4.085 20 0 HIADHN CNC(=O)[C@H](Cc1c[nH]c2ccccc12)N[C@@H](C)c1sc(-c2cccnc2)nc1C ZINC000483751138 899413411 /nfs/dbraw/zinc/41/34/11/899413411.db2.gz ZQYLBNUNKBFBNB-XOBRGWDASA-N 0 3 419.554 4.003 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCc1cc(-c2ccccc2)no1)c1cccc(OC)c1 ZINC000505651700 914350024 /nfs/dbraw/zinc/35/00/24/914350024.db2.gz LPLCFFQWBCBPDW-HSZRJFAPSA-N 0 3 422.529 4.233 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)c1cnc2c(F)cccc2c1 ZINC000483796898 899469925 /nfs/dbraw/zinc/46/99/25/899469925.db2.gz GXAWCDABZJVRTM-HXUWFJFHSA-N 0 3 415.472 4.270 20 0 HIADHN CN(C(=O)N[C@@H]1CCN(C2CC2)C1)[C@@H](c1ccc(F)cc1)c1ccc(Cl)cc1 ZINC000483812683 899489297 /nfs/dbraw/zinc/48/92/97/899489297.db2.gz ZDYUWWLFGHBCTO-TZIWHRDSSA-N 0 3 401.913 4.447 20 0 HIADHN Cc1ccc(NC(=O)[C@@H](C)Oc2ccc(F)cc2Br)c(CN(C)C)c1 ZINC000505655069 914353893 /nfs/dbraw/zinc/35/38/93/914353893.db2.gz JHWQTUWFPCSNLC-CYBMUJFWSA-N 0 3 409.299 4.364 20 0 HIADHN CC[C@@H]1Oc2cc([C@@H](C)N[C@H](C)c3cccc(N4CCOCC4)c3)ccc2NC1=O ZINC000483858728 899542409 /nfs/dbraw/zinc/54/24/09/899542409.db2.gz MJQSDRMMFBBGKM-YVHKJVDXSA-N 0 3 409.530 4.045 20 0 HIADHN Cc1ccc(F)cc1-c1nnc(NC(=O)N(C)CCCN(C)Cc2ccco2)s1 ZINC000483906267 899575621 /nfs/dbraw/zinc/57/56/21/899575621.db2.gz NNGSUQGPFBMEGJ-UHFFFAOYSA-N 0 3 417.510 4.231 20 0 HIADHN COc1ccccc1NC(=O)C1CCN(CCOc2ccc(Cl)c(F)c2)CC1 ZINC000483962751 899610617 /nfs/dbraw/zinc/61/06/17/899610617.db2.gz MGFWGZXRIZQECK-UHFFFAOYSA-N 0 3 406.885 4.217 20 0 HIADHN COc1cccc(Cn2ccc3ccc(NC(=O)N4CC[C@H](N5CC=CC5)C4)cc32)c1 ZINC000483987515 899629387 /nfs/dbraw/zinc/62/93/87/899629387.db2.gz YPBINYDXYQBGQW-QFIPXVFZSA-N 0 3 416.525 4.176 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)NC[C@H]1CCCC[C@H]1C(F)(F)F ZINC000484047678 899680452 /nfs/dbraw/zinc/68/04/52/899680452.db2.gz XAQQIZTVPRELOA-SJLPKXTDSA-N 0 3 403.464 4.268 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)NC[C@@H]1CCCC[C@H]1C(F)(F)F ZINC000484051417 899684119 /nfs/dbraw/zinc/68/41/19/899684119.db2.gz VLKBTWXWWTZTNS-FUHWJXTLSA-N 0 3 403.464 4.268 20 0 HIADHN C[C@H](NCCNc1ncc(Cl)cc1Cl)c1ccc(-n2cncn2)cc1Cl ZINC000484129052 899750459 /nfs/dbraw/zinc/75/04/59/899750459.db2.gz KLYJHXBHEUSZAM-NSHDSACASA-N 0 3 411.724 4.385 20 0 HIADHN Cc1cc(NC(=O)c2cc(O)ccc2Cl)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000484156338 899776825 /nfs/dbraw/zinc/77/68/25/899776825.db2.gz IOYSUPIRAQYNPL-KRWDZBQOSA-N 0 3 410.905 4.250 20 0 HIADHN CCN(C(=O)c1cnn(-c2ccccc2C)c1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000484165500 899784848 /nfs/dbraw/zinc/78/48/48/899784848.db2.gz TXLRBGAKGURMSM-NZQKXSOJSA-N 0 3 402.542 4.478 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)NCc1ccc(OC2CCCCC2)cc1 ZINC000484169242 899787677 /nfs/dbraw/zinc/78/76/77/899787677.db2.gz CAZRYUZBMYFYOS-UHFFFAOYSA-N 0 3 423.557 4.023 20 0 HIADHN CCN(C(=O)C(=O)Nc1cc(CN(C)C)ccc1C)[C@@H](C)c1cc2ccccc2o1 ZINC000484186277 899801603 /nfs/dbraw/zinc/80/16/03/899801603.db2.gz AZFAVZXMSBEBPP-KRWDZBQOSA-N 0 3 407.514 4.351 20 0 HIADHN Cc1cc(NC(=O)C(=O)Nc2cccc(C(C)C)c2)cc(N2CCN(C(C)C)CC2)c1 ZINC000484204643 899812763 /nfs/dbraw/zinc/81/27/63/899812763.db2.gz ADQUQDIXIVPCNR-UHFFFAOYSA-N 0 3 422.573 4.226 20 0 HIADHN CSc1cccc(N(C(=O)[C@H]2Oc3ccccc3O[C@@H]2C)C2CCN(C)CC2)c1 ZINC000484290811 899855436 /nfs/dbraw/zinc/85/54/36/899855436.db2.gz CZCQGXJHDRBVCG-ZHRRBRCNSA-N 0 3 412.555 4.064 20 0 HIADHN CSc1cccc(N(C(=O)[C@H]2Oc3ccccc3O[C@H]2C)C2CCN(C)CC2)c1 ZINC000484290803 899855611 /nfs/dbraw/zinc/85/56/11/899855611.db2.gz CZCQGXJHDRBVCG-AOMKIAJQSA-N 0 3 412.555 4.064 20 0 HIADHN CSc1cccc(N(C(=O)c2ccc3c(c2)OCCCO3)C2CCN(C)CC2)c1 ZINC000484297050 899860248 /nfs/dbraw/zinc/86/02/48/899860248.db2.gz OQFUTVBSECVZKI-UHFFFAOYSA-N 0 3 412.555 4.311 20 0 HIADHN Cc1cccc2nc(CN[C@@](C)(c3ccc(Br)cc3)C(C)C)cc(=O)n12 ZINC000484340389 899891051 /nfs/dbraw/zinc/89/10/51/899891051.db2.gz MCDJGCNNPICXDC-OAQYLSRUSA-N 0 3 414.347 4.426 20 0 HIADHN CSc1cccc(N(C(=O)c2ccn(-c3ccccc3F)n2)C2CCN(C)CC2)c1 ZINC000484371483 899914634 /nfs/dbraw/zinc/91/46/34/899914634.db2.gz KYSYFTOYCNMRMF-UHFFFAOYSA-N 0 3 424.545 4.474 20 0 HIADHN CSc1cccc(N(C(=O)c2ccc(NC(=O)C3CC3)cc2)C2CCN(C)CC2)c1 ZINC000484406660 899930459 /nfs/dbraw/zinc/93/04/59/899930459.db2.gz QNBNLPQPSCXTCC-UHFFFAOYSA-N 0 3 423.582 4.498 20 0 HIADHN O[C@H](CN[C@H]1CCCc2nc(-c3ccccc3Br)sc21)C(F)F ZINC000484473923 899968128 /nfs/dbraw/zinc/96/81/28/899968128.db2.gz JIBIBCLCYPTKJE-WCQYABFASA-N 0 3 403.292 4.166 20 0 HIADHN COc1cccc2c1CC[C@@H]2N[C@@H](C)c1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000484495818 899986965 /nfs/dbraw/zinc/98/69/65/899986965.db2.gz GOUBUIGCPNGFDH-JTSKRJEESA-N 0 3 414.571 4.208 20 0 HIADHN C[C@H](N[C@H]1CCN(C(=O)CCc2ccccc2)C1)c1ccccc1OC(F)(F)F ZINC000484509091 900000974 /nfs/dbraw/zinc/00/09/74/900000974.db2.gz YTCJZTLFZJRDIF-WMZOPIPTSA-N 0 3 406.448 4.470 20 0 HIADHN OCC[C@@]1(CN[C@@H](Cc2ccccc2F)c2ccccc2Br)CCOC1 ZINC000484510156 900001642 /nfs/dbraw/zinc/00/16/42/900001642.db2.gz VSQWVEPLCAEZTQ-SFTDATJTSA-N 0 3 422.338 4.251 20 0 HIADHN C[C@@H](N[C@@H](C)c1cccc(NS(C)(=O)=O)c1)c1ccc(OCC2CC2)c(F)c1 ZINC000484510299 900001899 /nfs/dbraw/zinc/00/18/99/900001899.db2.gz WOUHRHVWXUAFEA-LSDHHAIUSA-N 0 3 406.523 4.398 20 0 HIADHN OCC[C@]1(CN[C@@H](Cc2ccccc2F)c2ccccc2Br)CCOC1 ZINC000484510153 900002423 /nfs/dbraw/zinc/00/24/23/900002423.db2.gz VSQWVEPLCAEZTQ-LEWJYISDSA-N 0 3 422.338 4.251 20 0 HIADHN O=C(C1CCCCC1)N1CC[C@@H](N[C@H]2CCCOc3cc(Br)ccc32)C1 ZINC000484520755 900009344 /nfs/dbraw/zinc/00/93/44/900009344.db2.gz URUYNNMZJQNATO-MJGOQNOKSA-N 0 3 421.379 4.434 20 0 HIADHN CC(C)n1cc([C@H](C)N[C@H]2CCN(c3ncc(C(F)(F)F)cc3Cl)C2)cn1 ZINC000484523632 900011330 /nfs/dbraw/zinc/01/13/30/900011330.db2.gz VVHYJGZRJPDGDC-WFASDCNBSA-N 0 3 401.864 4.461 20 0 HIADHN CCCOc1ccc(O[C@@H]2CCCC[C@@H]2NCc2cc(=O)n3ccsc3n2)cc1 ZINC000484621540 900074764 /nfs/dbraw/zinc/07/47/64/900074764.db2.gz ACHNQGPORQBQMY-VQTJNVASSA-N 0 3 413.543 4.025 20 0 HIADHN CCCOc1ccc(O[C@H]2CCCC[C@H]2NCc2cc(-c3cnn(C)c3)no2)cc1 ZINC000484623876 900076480 /nfs/dbraw/zinc/07/64/80/900076480.db2.gz VFPCSSCPPQEBJM-GGAORHGYSA-N 0 3 410.518 4.344 20 0 HIADHN Cc1ccc(CN[C@H](C)c2ccc(NS(C)(=O)=O)cc2)c(OCC(F)(F)F)c1 ZINC000484624751 900077422 /nfs/dbraw/zinc/07/74/22/900077422.db2.gz VCKGAQFYFLRCED-CQSZACIVSA-N 0 3 416.465 4.158 20 0 HIADHN CCOc1c(Cl)cc(CNC(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)cc1OC ZINC000484840129 900240174 /nfs/dbraw/zinc/24/01/74/900240174.db2.gz WDDBIOYZWQJOGR-YWZLYKJASA-N 0 3 419.953 4.238 20 0 HIADHN C[C@@H]1Cc2ccccc2N1Cc1ccoc1C(=O)NCc1ccccc1CN(C)C ZINC000484973735 900332844 /nfs/dbraw/zinc/33/28/44/900332844.db2.gz ZLCPSDKEMZXGIQ-GOSISDBHSA-N 0 3 403.526 4.222 20 0 HIADHN CCOc1ccccc1NC(=O)CCN1CCCC[C@@H]1CNC(=O)Nc1ccccc1 ZINC000484990867 900345092 /nfs/dbraw/zinc/34/50/92/900345092.db2.gz ZTRCQTRQUNEQDQ-HXUWFJFHSA-N 0 3 424.545 4.090 20 0 HIADHN CNC(=O)[C@H]1Cc2ccccc2N1C(=O)C(Cc1c(C)cc(C)cc1C)C(F)(F)F ZINC000485134931 900436389 /nfs/dbraw/zinc/43/63/89/900436389.db2.gz PDSGJGRGFMAJAY-UYAOXDASSA-N 0 3 418.459 4.037 20 0 HIADHN CC(C)c1c(NC(=O)N[C@@H](C)C2=CCN(C)CC2)cnn1-c1ccccc1Cl ZINC000485150373 900450328 /nfs/dbraw/zinc/45/03/28/900450328.db2.gz STTZTTIALUWTKD-HNNXBMFYSA-N 0 3 401.942 4.421 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(N[C@H](C)[C@@H]3CC[N@H+](Cc4ccccc4)C3)nc2)n1 ZINC000485191012 900485212 /nfs/dbraw/zinc/48/52/12/900485212.db2.gz VFBXBJQTKDRZSV-YLJYHZDGSA-N 0 3 403.530 4.129 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(N[C@H](C)[C@@H]3CC[N@@H+](Cc4ccccc4)C3)nc2)n1 ZINC000485191012 900485226 /nfs/dbraw/zinc/48/52/26/900485226.db2.gz VFBXBJQTKDRZSV-YLJYHZDGSA-N 0 3 403.530 4.129 20 0 HIADHN CC(C)c1c(NC(=O)N2CC[C@H]3CCN(C)C[C@@H]32)cnn1-c1ccc(Cl)cc1 ZINC000485199452 900491300 /nfs/dbraw/zinc/49/13/00/900491300.db2.gz ZDROOJLFJFZMTN-BEFAXECRSA-N 0 3 401.942 4.207 20 0 HIADHN CS[C@H]1CN(C(=O)Nc2cnn(-c3ccc(Cl)cc3)c2C(C)C)C[C@H]1N(C)C ZINC000485199481 900492742 /nfs/dbraw/zinc/49/27/42/900492742.db2.gz ZJYOKWXMZOBXOO-MSOLQXFVSA-N 0 3 421.998 4.158 20 0 HIADHN CCc1c(NC(=O)N[C@H]2CCN(Cc3ccccc3)C2)cnn1-c1ccccc1C ZINC000485325186 900606938 /nfs/dbraw/zinc/60/69/38/900606938.db2.gz XWRUYZOCGHCCDO-FQEVSTJZSA-N 0 3 403.530 4.139 20 0 HIADHN CCc1c(NC(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)cnn1-c1ccccc1C ZINC000485349186 900641263 /nfs/dbraw/zinc/64/12/63/900641263.db2.gz OOVSOAGTPCQUHE-CVDCTZTESA-N 0 3 403.530 4.310 20 0 HIADHN CCc1c(NC(=O)N(CCN(C)C)Cc2cccc(F)c2)cnn1-c1ccccc1C ZINC000485354803 900649936 /nfs/dbraw/zinc/64/99/36/900649936.db2.gz YJDSIGYNUIFWAB-UHFFFAOYSA-N 0 3 423.536 4.478 20 0 HIADHN CCc1c(NC(=O)N(CCN(C)C)C(C)C)cnn1-c1cccc(C(F)(F)F)c1 ZINC000485356484 900651702 /nfs/dbraw/zinc/65/17/02/900651702.db2.gz KVXGVCYBXWEHBV-UHFFFAOYSA-N 0 3 411.472 4.257 20 0 HIADHN CCc1c(NC(=O)N(CCN(C)C)C2CCCC2)cnn1-c1cccc(Cl)c1 ZINC000485360090 900654703 /nfs/dbraw/zinc/65/47/03/900654703.db2.gz YQBVYAWHYAQTLY-UHFFFAOYSA-N 0 3 403.958 4.426 20 0 HIADHN Cc1nc(-c2ccc(Br)cc2)sc1[C@@H](C)N[C@@H]1CCCN(C)C1=O ZINC000485390280 900685110 /nfs/dbraw/zinc/68/51/10/900685110.db2.gz YEOYWEMEBHADAD-IAQYHMDHSA-N 0 3 408.365 4.152 20 0 HIADHN O=C(N[C@@H](c1ccccc1)c1ccc(Br)cc1)N1CCN2CCC1CC2 ZINC000485437823 900735355 /nfs/dbraw/zinc/73/53/55/900735355.db2.gz OYTPSDBWCCIJQY-FQEVSTJZSA-N 0 3 414.347 4.028 20 0 HIADHN CC(C)(C(=O)Nc1ccc(C(=O)NCCN2CCCC2)cc1)c1ccccc1Cl ZINC000485470966 900764569 /nfs/dbraw/zinc/76/45/69/900764569.db2.gz BJBBHJTUQZVIBW-UHFFFAOYSA-N 0 3 413.949 4.082 20 0 HIADHN O=C(NCCN1CCCC1)c1ccc(NC(=O)c2cc(Cl)ccc2Cl)cc1 ZINC000485477672 900770933 /nfs/dbraw/zinc/77/09/33/900770933.db2.gz RTMDPGRIKDIRGW-UHFFFAOYSA-N 0 3 406.313 4.071 20 0 HIADHN Cc1ccc(C(C)(C)CC(=O)Nc2ccc(C(=O)NCCN3CCCC3)cc2)cc1 ZINC000485529132 900810015 /nfs/dbraw/zinc/81/00/15/900810015.db2.gz QQKZRSQFIGARJY-UHFFFAOYSA-N 0 3 407.558 4.127 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N[C@@H](c3ccccc3)c3cccnc3)cc2)CC1 ZINC000485593758 900856058 /nfs/dbraw/zinc/85/60/58/900856058.db2.gz RXYMHQZBTHWEJV-VWLOTQADSA-N 0 3 414.553 4.131 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)NC[C@H](c3ccccc3)C(F)(F)F)cc2)CC1 ZINC000485606350 900865921 /nfs/dbraw/zinc/86/59/21/900865921.db2.gz FBOHKBCQAGBGBD-OAQYLSRUSA-N 0 3 419.491 4.293 20 0 HIADHN COc1ccc(CN(C)CCC(=O)Nc2ccc(OCc3ccccc3)cc2)cc1O ZINC000485667491 900918552 /nfs/dbraw/zinc/91/85/52/900918552.db2.gz GKNHUCKLGRTAPL-UHFFFAOYSA-N 0 3 420.509 4.440 20 0 HIADHN CCOc1cc(CN2C[C@H](c3ccc(F)cc3)C[C@H]2C)nc2nc(C(F)(F)F)nn21 ZINC000485685239 900935316 /nfs/dbraw/zinc/93/53/16/900935316.db2.gz OVRGGBJEXKKYHO-TZMCWYRMSA-N 0 3 423.414 4.059 20 0 HIADHN CCOc1cc(CN2CC[C@@H](c3ccccc3)[C@@H](C)C2)nc2nc(C(F)(F)F)nn21 ZINC000485691512 900942238 /nfs/dbraw/zinc/94/22/38/900942238.db2.gz XZGWJMHKSAXICT-WMLDXEAASA-N 0 3 419.451 4.167 20 0 HIADHN COCCO[C@@H]1COCC[C@H]1NCc1ccc(-c2cccc(Cl)c2Cl)o1 ZINC000485697531 900947037 /nfs/dbraw/zinc/94/70/37/900947037.db2.gz PSKLFQVMELJFDG-SJLPKXTDSA-N 0 3 400.302 4.164 20 0 HIADHN CN(C(=O)c1cccnc1OCc1ccccc1F)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000485716577 900965790 /nfs/dbraw/zinc/96/57/90/900965790.db2.gz FPEPLFWYFKVVRM-OAQYLSRUSA-N 0 3 419.500 4.146 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)NCc1ccc(COC2CCOCC2)cc1 ZINC000505845927 914494722 /nfs/dbraw/zinc/49/47/22/914494722.db2.gz RVVMXHIDIDPXRN-UHFFFAOYSA-N 0 3 422.525 4.120 20 0 HIADHN C[C@@H]1Cc2ccccc2N1C(=O)[C@@H]1CCCC[C@H]1C(=O)Nc1cccc(CN(C)C)c1 ZINC000485768175 901024899 /nfs/dbraw/zinc/02/48/99/901024899.db2.gz VEELIDJHOOCQOR-SXSPYAJSSA-N 0 3 419.569 4.471 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)c3cnc(-c4ccsc4)s3)cc2)CC1 ZINC000485795578 901047504 /nfs/dbraw/zinc/04/75/04/901047504.db2.gz SWYSSRNEZROXAJ-UHFFFAOYSA-N 0 3 412.584 4.261 20 0 HIADHN C[C@@H](NC(=O)c1ccccc1CN(C)C)c1cccc(NC(=O)c2ccccc2)c1 ZINC000485814680 901062764 /nfs/dbraw/zinc/06/27/64/901062764.db2.gz ACUYBMHFGGPXPO-GOSISDBHSA-N 0 3 401.510 4.492 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@@H](C)N[C@H](C)c2ccc3ncsc3c2)cc1OC ZINC000485838617 901084670 /nfs/dbraw/zinc/08/46/70/901084670.db2.gz BICQRLTYUXXXOU-HUUCEWRRSA-N 0 3 413.543 4.011 20 0 HIADHN CCN(CC)[C@@H](CNc1ncc(Cn2cc(Br)cn2)s1)c1ccco1 ZINC000485845439 901089152 /nfs/dbraw/zinc/08/91/52/901089152.db2.gz QWGQBFCBRMJUIM-HNNXBMFYSA-N 0 3 424.368 4.238 20 0 HIADHN COCCN(C(C)=O)c1nc(CN2C[C@H](c3ccccc3)[C@H]3CCCC[C@@H]32)cs1 ZINC000485903577 901132013 /nfs/dbraw/zinc/13/20/13/901132013.db2.gz DMYKHODSORTGIY-VSKRKVRLSA-N 0 3 413.587 4.301 20 0 HIADHN COCCN(C(C)=O)c1nc(CN2C[C@H](c3ccccc3)[C@@H]3CCCC[C@@H]32)cs1 ZINC000485903575 901132478 /nfs/dbraw/zinc/13/24/78/901132478.db2.gz DMYKHODSORTGIY-BDTNDASRSA-N 0 3 413.587 4.301 20 0 HIADHN CCOc1cn(-c2ccccc2)nc1C(=O)NC[C@@H](c1ccc(C)cc1)N1CCCC1 ZINC000486078943 901270220 /nfs/dbraw/zinc/27/02/20/901270220.db2.gz VYTQKOYXLMESCX-QFIPXVFZSA-N 0 3 418.541 4.146 20 0 HIADHN CN(C(=O)CCOc1ccc2ccccc2c1)C1CCN(CCc2ccccn2)CC1 ZINC000486112635 901297852 /nfs/dbraw/zinc/29/78/52/901297852.db2.gz ALKBAWRRUQUWPH-UHFFFAOYSA-N 0 3 417.553 4.169 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3ccc(O)cc3SC)c(C)c2)CC1 ZINC000486176161 901363104 /nfs/dbraw/zinc/36/31/04/901363104.db2.gz HTEJXTATUPNXPN-UHFFFAOYSA-N 0 3 400.548 4.208 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)NCCc1csc(-c2ccccc2)n1 ZINC000486354315 901525813 /nfs/dbraw/zinc/52/58/13/901525813.db2.gz NWHRPMLXIVVNSZ-UHFFFAOYSA-N 0 3 408.571 4.126 20 0 HIADHN c1oc(-c2ccccc2)nc1CN1C[C@H]2CCC[C@@]2(c2nc(-c3cccnc3)no2)C1 ZINC000486427608 901586824 /nfs/dbraw/zinc/58/68/24/901586824.db2.gz AQFHSCSLIRLGHW-NTKDMRAZSA-N 0 3 413.481 4.340 20 0 HIADHN CN(C)Cc1ccccc1C(=O)N(C)CC1(c2ccc(Br)cc2)CC1 ZINC000486431400 901591588 /nfs/dbraw/zinc/59/15/88/901591588.db2.gz JNLPZTZEKMTZHE-UHFFFAOYSA-N 0 3 401.348 4.315 20 0 HIADHN Fc1cc(CN2C[C@H]3CCC[C@@]3(c3nc(CC4CC4)no3)C2)ccc1OC(F)F ZINC000486438914 901597633 /nfs/dbraw/zinc/59/76/33/901597633.db2.gz ZCXBQGSEXFYFIN-QVKFZJNVSA-N 0 3 407.436 4.316 20 0 HIADHN COc1cc(CN2C[C@H]3CCC[C@@]3(c3nc(CC4CC4)no3)C2)ccc1OC(F)F ZINC000486454006 901613145 /nfs/dbraw/zinc/61/31/45/901613145.db2.gz WYTOVGVKYYXYAL-OPAMFIHVSA-N 0 3 419.472 4.186 20 0 HIADHN CN(CCN(Cc1ccccc1)C(=O)N[C@H]1CCCc2c[nH]nc21)Cc1ccccc1 ZINC000486480738 901639758 /nfs/dbraw/zinc/63/97/58/901639758.db2.gz RDUQOSWAXJAXOW-QHCPKHFHSA-N 0 3 417.557 4.131 20 0 HIADHN Cc1cc(C)n([C@H](C)CC(=O)N[C@@H](c2ccc(F)c(F)c2)C(C)(C)N2CCCC2)n1 ZINC000486562114 901707447 /nfs/dbraw/zinc/70/74/47/901707447.db2.gz QFJOTCARBWRKIL-VGSWGCGISA-N 0 3 418.532 4.461 20 0 HIADHN CC(=O)c1oc2cc(C)ccc2c1CC(=O)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000486568810 901714161 /nfs/dbraw/zinc/71/41/61/901714161.db2.gz WYWCULSZHGYBTH-UHFFFAOYSA-N 0 3 420.509 4.082 20 0 HIADHN CCOc1ncc(C(=O)N(CC)[C@H]2CCN([C@H](C)c3ccccc3)C2)cc1Cl ZINC000486739269 901822937 /nfs/dbraw/zinc/82/29/37/901822937.db2.gz YWZNBMZNULTIQH-APWZRJJASA-N 0 3 401.938 4.431 20 0 HIADHN COc1cc(-c2noc(CN3CC[C@H](Cc4ccccc4)[C@@H]3C)n2)cc(OC)c1OC ZINC000486787360 901853395 /nfs/dbraw/zinc/85/33/95/901853395.db2.gz JZMNGLLJNXRNAN-FUHWJXTLSA-N 0 3 423.513 4.216 20 0 HIADHN C[C@H]1Cc2ccccc2N1Cc1ccoc1C(=O)NCCN(C)Cc1ccccc1 ZINC000486922458 901964109 /nfs/dbraw/zinc/96/41/09/901964109.db2.gz BCOYWZLZBNFQKT-IBGZPJMESA-N 0 3 403.526 4.093 20 0 HIADHN CN(C(=O)NC[C@@H](c1ccccc1)C(F)(F)F)[C@H]1CCN(Cc2ccccc2)C1 ZINC000486987282 902004324 /nfs/dbraw/zinc/00/43/24/902004324.db2.gz LXLXXVRPKSWQNN-PMACEKPBSA-N 0 3 405.464 4.248 20 0 HIADHN CN(Cc1cccnc1)C[C@@H]1CCN(C(=O)Nc2ccc(C(=O)C3CCC3)cc2)C1 ZINC000487041569 902034769 /nfs/dbraw/zinc/03/47/69/902034769.db2.gz OBAFPYBPQNKVJF-IBGZPJMESA-N 0 3 406.530 4.050 20 0 HIADHN CN(C)[C@H](CNC(=O)Nc1c(F)cc(F)cc1Br)Cc1ccccc1 ZINC000487186449 902091171 /nfs/dbraw/zinc/09/11/71/902091171.db2.gz KQYLWUJDADCUEH-AWEZNQCLSA-N 0 3 412.278 4.022 20 0 HIADHN CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)CCSc1cccc(Cl)c1 ZINC000487261721 902124296 /nfs/dbraw/zinc/12/42/96/902124296.db2.gz IULRTCZUBGOFHW-UWJYYQICSA-N 0 3 403.979 4.369 20 0 HIADHN C[C@@H]1CN(C(=O)N[C@H](CC2CCCCC2)C(C)(C)C)CC[C@H]1N1CCN(C)CC1 ZINC000487295357 902139022 /nfs/dbraw/zinc/13/90/22/902139022.db2.gz WFGJAEJTARLYGD-CEMLEFRQSA-N 0 3 406.659 4.039 20 0 HIADHN CCCn1nccc1NC(=O)N(CCN(C)Cc1ccccc1)Cc1ccccc1 ZINC000487529176 902235265 /nfs/dbraw/zinc/23/52/65/902235265.db2.gz WJLYLKXYOOABMN-UHFFFAOYSA-N 0 3 405.546 4.459 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1cccc(OCCc2ccccc2)c1 ZINC000505962496 914620452 /nfs/dbraw/zinc/62/04/52/914620452.db2.gz NPJUWRALIWWDJJ-UHFFFAOYSA-N 0 3 407.514 4.497 20 0 HIADHN COc1cccc(CNC(=O)[C@@H](C)N[C@H](C)c2ccc(Oc3cccnc3)cc2)c1 ZINC000487890547 902432821 /nfs/dbraw/zinc/43/28/21/902432821.db2.gz BMSWWGXOFCPGCD-QZTJIDSGSA-N 0 3 405.498 4.238 20 0 HIADHN COc1ccccc1CNC(=O)[C@H](C)N[C@@H](C)c1ccc(Oc2cccnc2)cc1 ZINC000487937406 902467742 /nfs/dbraw/zinc/46/77/42/902467742.db2.gz XZKISVVQCLRVDX-ROUUACIJSA-N 0 3 405.498 4.238 20 0 HIADHN CC(C)c1nc(C2CCN(C[C@H](O)CO[C@H](C)c3ccc(Cl)cc3)CC2)no1 ZINC000505982263 914645761 /nfs/dbraw/zinc/64/57/61/914645761.db2.gz PEUUSVVHGKIENN-BEFAXECRSA-N 0 3 407.942 4.165 20 0 HIADHN Brc1ccccc1-c1noc(C2CCN(CC3=CCCOC3)CC2)n1 ZINC000488383765 902792458 /nfs/dbraw/zinc/79/24/58/902792458.db2.gz YSONEDUDYKAQKI-UHFFFAOYSA-N 0 3 404.308 4.025 20 0 HIADHN CC(C)(C)[C@H]1C[C@@H](NCc2cccnc2Oc2cccc(S(C)(=O)=O)c2)CS1 ZINC000488405844 902812803 /nfs/dbraw/zinc/81/28/03/902812803.db2.gz BRAODDCBPMBFLM-VQIMIIECSA-N 0 3 420.600 4.287 20 0 HIADHN CC(C)(C)[C@H]1C[C@H](NCc2cccnc2Oc2cccc(S(C)(=O)=O)c2)CS1 ZINC000488405843 902812877 /nfs/dbraw/zinc/81/28/77/902812877.db2.gz BRAODDCBPMBFLM-QFBILLFUSA-N 0 3 420.600 4.287 20 0 HIADHN COc1ccc(S(=O)(=O)[N-]c2cccc(C[NH2+][C@@H]3CS[C@@H](C(C)C)C3)c2)cc1 ZINC000488418274 902818065 /nfs/dbraw/zinc/81/80/65/902818065.db2.gz NFMQKFPHRHCGHF-GHTZIAJQSA-N 0 3 420.600 4.116 20 0 HIADHN COc1ccc(S(=O)(=O)[N-]c2cccc(C[NH2+][C@H]3CS[C@H](C(C)C)C3)c2)cc1 ZINC000488418276 902818190 /nfs/dbraw/zinc/81/81/90/902818190.db2.gz NFMQKFPHRHCGHF-NQIIRXRSSA-N 0 3 420.600 4.116 20 0 HIADHN CCNC(=O)C1(CN[C@@H](C)c2ccc(Br)cc2Br)CCC1 ZINC000488456472 902834296 /nfs/dbraw/zinc/83/42/96/902834296.db2.gz BAUGWGRPDZNRLT-NSHDSACASA-N 0 3 418.173 4.169 20 0 HIADHN CC(C)Sc1ccccc1C(=O)Nc1cccc(CN2CCC(C(N)=O)CC2)c1 ZINC000488541658 902875648 /nfs/dbraw/zinc/87/56/48/902875648.db2.gz SLRNGISNZVSZRB-UHFFFAOYSA-N 0 3 411.571 4.137 20 0 HIADHN C[C@H]1CN(C2CCOCC2)CCN1C(=O)Nc1cccc(-c2ccc3c(c2)CCO3)c1 ZINC000488562299 902885496 /nfs/dbraw/zinc/88/54/96/902885496.db2.gz HTMYLKVPJQIVMH-SFHVURJKSA-N 0 3 421.541 4.006 20 0 HIADHN C[C@H](CNCc1csc(-c2ccc3c(c2)OCO3)n1)N1CCc2ccccc2C1 ZINC000488615666 902900077 /nfs/dbraw/zinc/90/00/77/902900077.db2.gz FJMZKFVMPQZNGR-MRXNPFEDSA-N 0 3 407.539 4.075 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)CCc2ncc(-c3ccccc3)o2)CC1 ZINC000488660543 902924198 /nfs/dbraw/zinc/92/41/98/902924198.db2.gz OVWPOXOYYWIPDJ-UHFFFAOYSA-N 0 3 403.526 4.397 20 0 HIADHN C[C@H]1C[C@H]1C(=O)Nc1cccc(C(=O)N(Cc2ccccc2)C2CCN(C)CC2)c1 ZINC000488672758 902932545 /nfs/dbraw/zinc/93/25/45/902932545.db2.gz FIDKOAITIYSABL-FDDCHVKYSA-N 0 3 405.542 4.018 20 0 HIADHN C[C@@H](Oc1ccccc1C(F)(F)F)C(=O)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000488676932 902940159 /nfs/dbraw/zinc/94/01/59/902940159.db2.gz KYXWLOVBQQNNNS-OAHLLOKOSA-N 0 3 422.447 4.068 20 0 HIADHN C[C@H](c1ccc(S(N)(=O)=O)cc1)N(C)Cc1ccc(F)c(-c2cccs2)c1 ZINC000506000280 914672007 /nfs/dbraw/zinc/67/20/07/914672007.db2.gz ZDMRGDBXBDLXMG-CQSZACIVSA-N 0 3 404.532 4.395 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N3CCCCC[C@@H]3c3ccncc3)cc2)CC1 ZINC000488800871 903006258 /nfs/dbraw/zinc/00/62/58/903006258.db2.gz CQDXVHHLYANCTR-XMMPIXPASA-N 0 3 406.574 4.370 20 0 HIADHN CCCc1nc(C)c(CNC(=O)N[C@H](CN2CCc3ccccc3C2)C(C)(C)C)o1 ZINC000489046781 903152112 /nfs/dbraw/zinc/15/21/12/903152112.db2.gz RNQUOUPWLZXKAV-OAQYLSRUSA-N 0 3 412.578 4.208 20 0 HIADHN Cc1ccc(NC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)cc1C(=O)N(C)C(C)C ZINC000489124835 903215658 /nfs/dbraw/zinc/21/56/58/903215658.db2.gz QHZOCTDACRAZQR-AUSIDOKSSA-N 0 3 422.573 4.117 20 0 HIADHN Cc1ccc(NC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)cc1C(=O)N(C)C(C)C ZINC000489126603 903216423 /nfs/dbraw/zinc/21/64/23/903216423.db2.gz HPBFHKBJMUHFKL-JOCHJYFZSA-N 0 3 422.573 4.262 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)NCc1sccc1Br)c1ccco1 ZINC000489199166 903258087 /nfs/dbraw/zinc/25/80/87/903258087.db2.gz RNBFWFHEHJGHEU-DGCLKSJQSA-N 0 3 400.342 4.032 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)NCc2ccc(Br)s2)CC1 ZINC000489330361 903333547 /nfs/dbraw/zinc/33/35/47/903333547.db2.gz RNUGGBBUVHGTJI-UHFFFAOYSA-N 0 3 422.392 4.317 20 0 HIADHN CC1(C)CC[C@H](NC(=O)NCc2ccccc2CN2CCC(O)CC2)c2ccccc21 ZINC000489407068 903371563 /nfs/dbraw/zinc/37/15/63/903371563.db2.gz LTUXGDXALSVUKC-DEOSSOPVSA-N 0 3 421.585 4.255 20 0 HIADHN Cc1cc(CN(C)[C@@H](C)c2ccc(S(N)(=O)=O)cc2)ccc1Oc1cccnc1 ZINC000506027865 914710793 /nfs/dbraw/zinc/71/07/93/914710793.db2.gz VFBXDTAQOYWBAN-KRWDZBQOSA-N 0 3 411.527 4.023 20 0 HIADHN Cc1cc(Cl)c2c(c1)[C@H](NCc1ccc(CN3CCOCC3)cc1)CCCO2 ZINC000489560106 903464138 /nfs/dbraw/zinc/46/41/38/903464138.db2.gz LUJPASZBZVMEPG-JOCHJYFZSA-N 0 3 400.950 4.484 20 0 HIADHN Cc1ccc(NC(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)cc1C(=O)N(C)C(C)C ZINC000489564015 903468137 /nfs/dbraw/zinc/46/81/37/903468137.db2.gz DVGZKZBTMBVPMZ-VXKWHMMOSA-N 0 3 408.546 4.042 20 0 HIADHN Cc1cc(Cl)c2c(c1)[C@@H](NCc1cccc(CN3CCOCC3)c1)CCCO2 ZINC000489575621 903475035 /nfs/dbraw/zinc/47/50/35/903475035.db2.gz WLMOUIZKLPCZKG-QFIPXVFZSA-N 0 3 400.950 4.484 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)NCc2coc(-c3ccccc3)n2)CC1 ZINC000489598665 903488470 /nfs/dbraw/zinc/48/84/70/903488470.db2.gz MLVOBQDMYDBYCK-UHFFFAOYSA-N 0 3 404.514 4.148 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2cccc(NC(=O)[C@@H]3C[C@@H]3C)c2)N2CCCC2)cc1 ZINC000489600054 903490202 /nfs/dbraw/zinc/49/02/02/903490202.db2.gz UATPXRXRWQVZRD-NMNUPHIUSA-N 0 3 405.542 4.156 20 0 HIADHN COc1ccccc1[C@@]1(C)C[C@H]1NC(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000489634630 903509948 /nfs/dbraw/zinc/50/99/48/903509948.db2.gz UKRASTSYWJYQDS-ILBGXUMGSA-N 0 3 407.558 4.031 20 0 HIADHN Cc1ccc(C[C@@H](C)C(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000489658113 903523772 /nfs/dbraw/zinc/52/37/72/903523772.db2.gz ZIWMZODQEMLKAG-NFBKMPQASA-N 0 3 402.542 4.456 20 0 HIADHN CCN(Cc1ccc(Cl)cc1)C(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000489712872 903553972 /nfs/dbraw/zinc/55/39/72/903553972.db2.gz LGWZSPJOGAPVDZ-UHFFFAOYSA-N 0 3 415.965 4.028 20 0 HIADHN CC[C@@H](C)N(Cc1ccccc1)C(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000489782701 903595000 /nfs/dbraw/zinc/59/50/00/903595000.db2.gz JZSOLAVSSCIYNJ-HXUWFJFHSA-N 0 3 409.574 4.154 20 0 HIADHN CN(C(=O)NCc1ccccc1CN1CCC(O)CC1)C1CCC(C(C)(C)C)CC1 ZINC000489784451 903596909 /nfs/dbraw/zinc/59/69/09/903596909.db2.gz XOGSVGOVCPPFGJ-UHFFFAOYSA-N 0 3 415.622 4.390 20 0 HIADHN COc1ccc(-c2noc([C@@H](C)N3CC[C@H](C)N(Cc4ccccc4)CC3)n2)cc1 ZINC000489884862 903651486 /nfs/dbraw/zinc/65/14/86/903651486.db2.gz KJQKRVMVKLKSCB-RBUKOAKNSA-N 0 3 406.530 4.403 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)NC[C@@H]1SCCc2ccccc21 ZINC000489929037 903683826 /nfs/dbraw/zinc/68/38/26/903683826.db2.gz YFVKEFXCMGNGIM-QUCCMNQESA-N 0 3 401.601 4.215 20 0 HIADHN Cc1ccc(NC(=O)NC[C@@H](c2ccccc2)N(C)C)cc1C(=O)N1CCCCC1 ZINC000490137923 903786272 /nfs/dbraw/zinc/78/62/72/903786272.db2.gz CUFWBJWZARTOOX-QFIPXVFZSA-N 0 3 408.546 4.046 20 0 HIADHN Cc1ccc([C@H](NCCN(C)Cc2ccccc2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000490156432 903798195 /nfs/dbraw/zinc/79/81/95/903798195.db2.gz IJZSGFGYJZYYPC-VWLOTQADSA-N 0 3 422.594 4.210 20 0 HIADHN CCN1CCN(c2ccc(CN[C@@H](c3ccccc3)c3ccc(OC)cc3)cn2)CC1 ZINC000490159784 903801614 /nfs/dbraw/zinc/80/16/14/903801614.db2.gz ZMWUADWSKDLYIZ-SANMLTNESA-N 0 3 416.569 4.111 20 0 HIADHN CCc1ccc([C@H](NCCN2CCCC[C@H]2C)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000490168109 903806429 /nfs/dbraw/zinc/80/64/29/903806429.db2.gz RHQATTVXVZAAFH-DVECYGJZSA-N 0 3 414.615 4.206 20 0 HIADHN CCc1ccc([C@@H](NCC2CCN(S(C)(=O)=O)CC2)c2ccccc2Cl)cc1 ZINC000490168691 903806471 /nfs/dbraw/zinc/80/64/71/903806471.db2.gz YQTVJSHYKYRVLK-JOCHJYFZSA-N 0 3 421.006 4.253 20 0 HIADHN CCN1CCN([C@H](C)CN[C@@H](c2cccc(SC)c2)c2cc(F)ccc2F)CC1 ZINC000490171581 903809050 /nfs/dbraw/zinc/80/90/50/903809050.db2.gz FUYKAGHDSRXHIQ-HXOBKFHXSA-N 0 3 419.585 4.392 20 0 HIADHN CC[C@H](CN[C@H](c1cccc(S(C)(=O)=O)c1)c1ccc(C)cc1C)N1CCCC1 ZINC000490171853 903809264 /nfs/dbraw/zinc/80/92/64/903809264.db2.gz JBINJEFEKYNVOI-ZJSXRUAMSA-N 0 3 414.615 4.260 20 0 HIADHN CCC(CC)[C@@H](CN[C@H](c1ccc(F)cc1)c1cccc(S(C)(=O)=O)c1)N(C)C ZINC000490190399 903817315 /nfs/dbraw/zinc/81/73/15/903817315.db2.gz IRMBOYMQQYXZLH-DHIUTWEWSA-N 0 3 420.594 4.275 20 0 HIADHN Cc1ccc(NC(=O)N2CCN(C3CCCCC3)CC2)cc1C(=O)N1CCCCC1 ZINC000490204474 903826765 /nfs/dbraw/zinc/82/67/65/903826765.db2.gz UHMIZKNHAUOWNZ-UHFFFAOYSA-N 0 3 412.578 4.103 20 0 HIADHN COc1ccc(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2)cc1Br ZINC000490227012 903839035 /nfs/dbraw/zinc/83/90/35/903839035.db2.gz KBYSOVQARKPCPJ-UHFFFAOYSA-N 0 3 424.314 4.193 20 0 HIADHN COCc1cccc(CC(=O)N[C@@H](c2ccc(F)c(F)c2)C(C)(C)N2CCCC2)c1 ZINC000490234003 903842374 /nfs/dbraw/zinc/84/23/74/903842374.db2.gz CKKTZSIDLJGNSQ-QHCPKHFHSA-N 0 3 416.512 4.386 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N[C@@H](c2ccccc2)c2cccnc2)C1 ZINC000490249569 903854299 /nfs/dbraw/zinc/85/42/99/903854299.db2.gz PXELHNOABFLXHX-YGOYIFOWSA-N 0 3 400.526 4.306 20 0 HIADHN O=C(NCCc1nc2ccccc2s1)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000506056656 914758707 /nfs/dbraw/zinc/75/87/07/914758707.db2.gz XAUMVZYRXGGPIK-KRWDZBQOSA-N 0 3 415.509 4.112 20 0 HIADHN CCNC(=O)Nc1ccc(C)c(NC(=O)NC[C@H](c2ccc(CC)cc2)N(C)C)c1 ZINC000490300974 903888887 /nfs/dbraw/zinc/88/88/87/903888887.db2.gz QQOXXRDAXLBYFI-OAQYLSRUSA-N 0 3 411.550 4.123 20 0 HIADHN CCNC(=O)Nc1ccc(C)c(NC(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)c1 ZINC000490352897 903946067 /nfs/dbraw/zinc/94/60/67/903946067.db2.gz KHQBLBKOOWKMIX-IBGZPJMESA-N 0 3 423.561 4.265 20 0 HIADHN Fc1ccc(Br)c2c1CC[C@H]2NCCCn1cc(Br)cn1 ZINC000490375236 903967914 /nfs/dbraw/zinc/96/79/14/903967914.db2.gz VFTGEOSNAIRZPU-CQSZACIVSA-N 0 3 417.120 4.214 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)Nc3ccc(OC(F)F)c(Cc4ccccc4)c3)[C@H]2C1 ZINC000490433716 904007952 /nfs/dbraw/zinc/00/79/52/904007952.db2.gz OHNNMSLEUCRIEW-XLIONFOSSA-N 0 3 415.484 4.437 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)C(=O)Nc1ccc(C(=O)C(C)(C)C)cc1)c1ccccc1 ZINC000490482875 904036991 /nfs/dbraw/zinc/03/69/91/904036991.db2.gz COWFBHQWFLQGME-NRFANRHFSA-N 0 3 423.557 4.053 20 0 HIADHN C[C@]1(CNC(=O)CCC(=O)c2ccc(F)cc2F)CCCN1Cc1ccccc1 ZINC000490515339 904064519 /nfs/dbraw/zinc/06/45/19/904064519.db2.gz VNEAQCRXZFFAMQ-HSZRJFAPSA-N 0 3 400.469 4.099 20 0 HIADHN CN(C)C[C@H](NC(=O)Nc1cccc(-c2noc(C(F)(F)F)n2)c1)c1ccccc1 ZINC000490517037 904066530 /nfs/dbraw/zinc/06/65/30/904066530.db2.gz MUIQFDZWIYKWCD-INIZCTEOSA-N 0 3 419.407 4.180 20 0 HIADHN C[C@@H](CNCc1cnnn1Cc1ccccc1)Sc1ccc(Br)cc1 ZINC000490895559 904306882 /nfs/dbraw/zinc/30/68/82/904306882.db2.gz URDVTZMIZHYJQT-HNNXBMFYSA-N 0 3 417.376 4.359 20 0 HIADHN COc1ccc(F)cc1[C@@H](C)NC(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000490911576 904314082 /nfs/dbraw/zinc/31/40/82/904314082.db2.gz NVVDMGTXALCCRF-MRXNPFEDSA-N 0 3 417.550 4.308 20 0 HIADHN C[C@H](C[C@@H]1CCCO1)N[C@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000491024595 904374587 /nfs/dbraw/zinc/37/45/87/904374587.db2.gz ULTARPVNEHBNTC-MFMILTCTSA-N 0 3 407.963 4.380 20 0 HIADHN C[C@H](C[C@H]1CCCO1)N[C@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000491024596 904374869 /nfs/dbraw/zinc/37/48/69/904374869.db2.gz ULTARPVNEHBNTC-QFIXIFRTSA-N 0 3 407.963 4.380 20 0 HIADHN CCOc1ccc([C@@H](NC[C@@H](C)N2CCN(C)CC2)c2ccccc2Cl)cc1 ZINC000491026864 904377315 /nfs/dbraw/zinc/37/73/15/904377315.db2.gz ZGIUYTLSCAZSDZ-WZONZLPQSA-N 0 3 401.982 4.054 20 0 HIADHN CCc1ccc([C@@H](N[C@@H](C)CN(CC)CC)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000491035346 904386796 /nfs/dbraw/zinc/38/67/96/904386796.db2.gz JJMOXPKKQDEDOF-FDDCHVKYSA-N 0 3 402.604 4.062 20 0 HIADHN CCc1ccc([C@@H](N[C@H](C)CN(CC)CC)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000491035349 904387834 /nfs/dbraw/zinc/38/78/34/904387834.db2.gz JJMOXPKKQDEDOF-WZONZLPQSA-N 0 3 402.604 4.062 20 0 HIADHN CC(=O)N1CCC(CN[C@H](c2ccc3c(c2)OCCO3)c2ccccc2Cl)CC1 ZINC000491054970 904399560 /nfs/dbraw/zinc/39/95/60/904399560.db2.gz RUOSTTYYEPJSLR-HSZRJFAPSA-N 0 3 414.933 4.049 20 0 HIADHN C[C@@H](CN[C@@H](c1ccccc1Cl)c1cc(F)ccc1F)CN1CCN(C)CC1 ZINC000491061567 904405192 /nfs/dbraw/zinc/40/51/92/904405192.db2.gz RQYOBUWMOZTAIS-AOMKIAJQSA-N 0 3 407.936 4.181 20 0 HIADHN NC(=O)c1ccc(CN(Cc2ccc(Br)c3cccnc23)C2CC2)cc1 ZINC000491078839 904414821 /nfs/dbraw/zinc/41/48/21/904414821.db2.gz QRIUWCLZNGKUME-UHFFFAOYSA-N 0 3 410.315 4.261 20 0 HIADHN Cc1ccccc1[C@H](NC(=O)N(CCN(C)C)Cc1ccc(F)cc1F)C1CC1 ZINC000491090081 904422532 /nfs/dbraw/zinc/42/25/32/904422532.db2.gz JYJVBPZPEUMPAH-JOCHJYFZSA-N 0 3 401.501 4.498 20 0 HIADHN CN1CC[C@@H](NC(=O)C2(Cc3ccccc3Br)CC2)[C@H]1c1ccccc1 ZINC000491135530 904448409 /nfs/dbraw/zinc/44/84/09/904448409.db2.gz YBBKRDSRHCOHBV-WOJBJXKFSA-N 0 3 413.359 4.333 20 0 HIADHN CN(Cc1ccc(OCc2ccncc2)cc1)Cc1ccccc1N1CCOCC1 ZINC000506124683 914813636 /nfs/dbraw/zinc/81/36/36/914813636.db2.gz IODIDEWAEIWEGC-UHFFFAOYSA-N 0 3 403.526 4.129 20 0 HIADHN COc1ccccc1-c1ncc(CNC[C@@H](C)c2nc(-c3ccccc3)no2)cn1 ZINC000491226717 904489849 /nfs/dbraw/zinc/48/98/49/904489849.db2.gz XVLLGIKJCSADRZ-MRXNPFEDSA-N 0 3 401.470 4.096 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)Nc3ncc(Cc4ccc(C(F)(F)F)cc4)s3)[C@H]2C1 ZINC000491304912 904525275 /nfs/dbraw/zinc/52/52/75/904525275.db2.gz LAESKIMAKNNYNL-YOEHRIQHSA-N 0 3 424.492 4.311 20 0 HIADHN CC[C@H](C)[C@H](NC(=O)N1CC[C@H](N2CCN(C)CC2)[C@H](C)C1)c1ccc(Cl)cc1 ZINC000491313029 904530892 /nfs/dbraw/zinc/53/08/92/904530892.db2.gz RROISDKEDITUEV-UDKICSLYSA-N 0 3 421.029 4.095 20 0 HIADHN Fc1cc(C(F)(F)F)cc(C2(CNCc3cnnn3Cc3ccccc3)CC2)c1 ZINC000491311086 904531025 /nfs/dbraw/zinc/53/10/25/904531025.db2.gz UTBDUKYTMSSOLQ-UHFFFAOYSA-N 0 3 404.411 4.306 20 0 HIADHN Clc1ccc(Br)c(CCNCc2cnnn2Cc2ccccc2)c1 ZINC000491320809 904535924 /nfs/dbraw/zinc/53/59/24/904535924.db2.gz HQDHBUYXLYEAPG-UHFFFAOYSA-N 0 3 405.727 4.075 20 0 HIADHN CCCN1CCC(N[C@@H](c2ccc(CC)cc2)c2cccc(S(C)(=O)=O)c2)CC1 ZINC000491341619 904546472 /nfs/dbraw/zinc/54/64/72/904546472.db2.gz FIFLCSUMAJXCKD-DEOSSOPVSA-N 0 3 414.615 4.206 20 0 HIADHN Cc1nc(CCN[C@H](c2cccc(S(C)(=O)=O)c2)c2ccc(C)cc2C)cs1 ZINC000491343654 904548394 /nfs/dbraw/zinc/54/83/94/904548394.db2.gz QFPCHANCWNSLMX-JOCHJYFZSA-N 0 3 414.596 4.394 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](N[C@@H]2CCc3ccccc3C2)c2ccc(F)cc2)c1 ZINC000491344119 904548418 /nfs/dbraw/zinc/54/84/18/904548418.db2.gz WQGVNRNDZWZAAH-VWNXMTODSA-N 0 3 409.526 4.466 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)NCc3ccc(C4CC4)cc3F)CC2)C[C@@H](C)O1 ZINC000491350517 904551159 /nfs/dbraw/zinc/55/11/59/904551159.db2.gz WZNXTBCRNQSCFI-QZTJIDSGSA-N 0 3 417.569 4.124 20 0 HIADHN Cc1ccc([C@@H](NCCCOCC(C)C)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000491364765 904560654 /nfs/dbraw/zinc/56/06/54/904560654.db2.gz AYAKAAKUJJXPHB-QHCPKHFHSA-N 0 3 403.588 4.449 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1ccc2c(c1)CCCC(=O)N2)c1ccsc1 ZINC000491411146 904582888 /nfs/dbraw/zinc/58/28/88/904582888.db2.gz XOVVKPORLNQVDY-LJQANCHMSA-N 0 3 400.548 4.228 20 0 HIADHN COc1ccc(CN2CCC[C@@H](c3nnc4ccc(C(F)(F)F)cn43)C2)cc1F ZINC000506149628 914825395 /nfs/dbraw/zinc/82/53/95/914825395.db2.gz ZPWWIBZBYCRMKO-CQSZACIVSA-N 0 3 408.399 4.275 20 0 HIADHN C[C@@H](NC(=O)NC[C@H](c1ccccc1)N1CCCC1)c1nc(C(F)(F)F)cs1 ZINC000491527645 904637785 /nfs/dbraw/zinc/63/77/85/904637785.db2.gz BHEUAFLZXVNADO-UKRRQHHQSA-N 0 3 412.481 4.359 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)Nc2cccc(CN3CCCCC3=O)c2)c1 ZINC000491567864 904653965 /nfs/dbraw/zinc/65/39/65/904653965.db2.gz GXUAFOMOYUPHDJ-UHFFFAOYSA-N 0 3 422.573 4.103 20 0 HIADHN O=C1c2ccccc2C(=O)N1C1CCC(NCc2cc(-c3ccccc3)on2)CC1 ZINC000491590023 904664085 /nfs/dbraw/zinc/66/40/85/904664085.db2.gz WPYMDGUAEBUIBK-UHFFFAOYSA-N 0 3 401.466 4.039 20 0 HIADHN O=S(=O)(c1ccc(CN[C@@H]2CCc3cc(Cl)ccc32)cc1)N1CCCCC1 ZINC000506192759 914839838 /nfs/dbraw/zinc/83/98/38/914839838.db2.gz VBXHZGONKKVZFG-OAQYLSRUSA-N 0 3 404.963 4.292 20 0 HIADHN C[C@@H](NCc1cc(Br)c2c(c1)OCCCO2)[C@H]1OCCc2sccc21 ZINC000492021953 904762175 /nfs/dbraw/zinc/76/21/75/904762175.db2.gz HDNAHICWLRNSDU-KZULUSFZSA-N 0 3 424.360 4.464 20 0 HIADHN CC[C@@H]1CCc2nc(NC(=O)c3ccc(CN4CCC(CO)CC4)cc3)sc2C1 ZINC000492179569 904810905 /nfs/dbraw/zinc/81/09/05/904810905.db2.gz DBPVTELAGWIYSF-MRXNPFEDSA-N 0 3 413.587 4.115 20 0 HIADHN O=C(Nc1cccc(COCC2CC2)c1)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000492179966 904811055 /nfs/dbraw/zinc/81/10/55/904811055.db2.gz FUKTUOLWUFLMIU-UHFFFAOYSA-N 0 3 408.542 4.070 20 0 HIADHN CCN1CCCC[C@H]1CN[C@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000492181566 904811168 /nfs/dbraw/zinc/81/11/68/904811168.db2.gz UGSJXFBQMNHGQS-RBBKRZOGSA-N 0 3 421.006 4.297 20 0 HIADHN CCc1ccc([C@@H](NC[C@@H]2CCCCN2CC)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000492194457 904813063 /nfs/dbraw/zinc/81/30/63/904813063.db2.gz FTCNUHWGASFBSJ-LADGPHEKSA-N 0 3 414.615 4.206 20 0 HIADHN C[C@@H](NCc1cc(Br)c2c(c1)OCCO2)[C@H]1OCCc2sccc21 ZINC000492194052 904813171 /nfs/dbraw/zinc/81/31/71/904813171.db2.gz QCJLPHKPIWPKNV-PIGZYNQJSA-N 0 3 410.333 4.074 20 0 HIADHN CC1(C)Cc2c(cccc2Br)[C@@H]1NCc1cnc(N2CCOCC2)s1 ZINC000492205273 904814044 /nfs/dbraw/zinc/81/40/44/904814044.db2.gz AMAXTPQVIGVQOY-KRWDZBQOSA-N 0 3 422.392 4.155 20 0 HIADHN CC(C)c1ccccc1OC[C@H](O)CN1CCC2(CC1)OCCc1ccsc12 ZINC000492556366 904867044 /nfs/dbraw/zinc/86/70/44/904867044.db2.gz FHTHIMDCWXFIIP-LJQANCHMSA-N 0 3 401.572 4.175 20 0 HIADHN CO[C@H]1C[C@@H](CN(C)C(=O)N[C@H](c2cccc(C(F)(F)F)c2)C(C)(C)C)N(C)C1 ZINC000492627652 904879267 /nfs/dbraw/zinc/87/92/67/904879267.db2.gz KZJVWVVJKTVOBL-OKZBNKHCSA-N 0 3 415.500 4.153 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)NC1CCC(C)(c2ccccc2)CC1 ZINC000492748426 904896705 /nfs/dbraw/zinc/89/67/05/904896705.db2.gz MSABBWHKYRYQHO-UHFFFAOYSA-N 0 3 407.558 4.012 20 0 HIADHN COc1cc(CN2CCC(C(=O)N3CCCC3)CC2)ccc1OCc1cccs1 ZINC000506248668 914862630 /nfs/dbraw/zinc/86/26/30/914862630.db2.gz XWNMBJAXLNHPQC-UHFFFAOYSA-N 0 3 414.571 4.170 20 0 HIADHN OCC[C@]1(CN[C@H](c2cccc(F)c2)c2cccc(Br)c2)CCOC1 ZINC000493009330 904985858 /nfs/dbraw/zinc/98/58/58/904985858.db2.gz MYQFYARUJFCMHH-VQTJNVASSA-N 0 3 408.311 4.056 20 0 HIADHN COc1cc(OC)cc(N2CC[C@H](CN[C@H](c3ccccc3)c3ccccn3)C2)c1 ZINC000493011252 904989597 /nfs/dbraw/zinc/98/95/97/904989597.db2.gz UGVUBCNWULNIES-KBMIEXCESA-N 0 3 403.526 4.304 20 0 HIADHN CCc1ccc([C@H](CNC(=O)c2c(F)ccc(C)c2Br)N(C)C)cc1 ZINC000493048697 905001743 /nfs/dbraw/zinc/00/17/43/905001743.db2.gz HPSIDYDIMIISDC-KRWDZBQOSA-N 0 3 407.327 4.492 20 0 HIADHN CO[C@]1(C)C[C@@H](N[C@H](c2ccc(C)cc2)c2cccc(S(C)(=O)=O)c2)C1(C)C ZINC000493106531 905020357 /nfs/dbraw/zinc/02/03/57/905020357.db2.gz UYTIMCNOWXHBJX-MQSCRBSSSA-N 0 3 401.572 4.281 20 0 HIADHN Cc1ccc([C@H](NC[C@H](CO)c2ccccc2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000493128522 905026050 /nfs/dbraw/zinc/02/60/50/905026050.db2.gz JVFGEJZOXAEACQ-RCZVLFRGSA-N 0 3 423.578 4.162 20 0 HIADHN C[C@]1(CN[C@H](c2ccc(Cl)cc2)c2cccc(S(C)(=O)=O)c2)CCCC[C@H]1O ZINC000493180068 905042307 /nfs/dbraw/zinc/04/23/07/905042307.db2.gz XQJXJPOVGMATMV-YPAWHYETSA-N 0 3 421.990 4.364 20 0 HIADHN CCc1ccc([C@H](NC[C@@]2(C)CCCC[C@H]2O)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000493203598 905049274 /nfs/dbraw/zinc/04/92/74/905049274.db2.gz JHABFPCSFKAIOH-TZRRMPRUSA-N 0 3 415.599 4.273 20 0 HIADHN Cc1nc2sccn2c(=O)c1CCNC(c1ccc(F)cc1)c1ccc(F)cc1 ZINC000506258754 914867866 /nfs/dbraw/zinc/86/78/66/914867866.db2.gz KIULFJDFHPFTCZ-UHFFFAOYSA-N 0 3 411.477 4.264 20 0 HIADHN CC(C)C[C@H](CCO)CN[C@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000493251683 905069045 /nfs/dbraw/zinc/06/90/45/905069045.db2.gz VENHOQSFZVCXAH-HTAPYJJXSA-N 0 3 424.006 4.467 20 0 HIADHN Cc1cccc2sc(N(Cc3ccccc3)C(=O)CN[C@H]3CCC[C@@]3(C)CO)nc21 ZINC000493413427 905114480 /nfs/dbraw/zinc/11/44/80/905114480.db2.gz PADDSKLCMUPZTH-RDPSFJRHSA-N 0 3 423.582 4.279 20 0 HIADHN Cc1cc(NC(=O)C[C@@H](C)c2c(C)n[nH]c2C)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000493463564 905130413 /nfs/dbraw/zinc/13/04/13/905130413.db2.gz VSYAFGCLVMGATQ-IIBYNOLFSA-N 0 3 420.561 4.111 20 0 HIADHN COc1cccc(-c2nn(C(C)(C)C)cc2CN2CCC(C(=O)N3CCCC3)CC2)c1 ZINC000506268942 914874069 /nfs/dbraw/zinc/87/40/69/914874069.db2.gz LOXPEASFNPPAQP-UHFFFAOYSA-N 0 3 424.589 4.148 20 0 HIADHN CC(C)Oc1cc(F)ccc1NC(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000493554890 905160422 /nfs/dbraw/zinc/16/04/22/905160422.db2.gz OLOTVGXZMJIYOD-QZTJIDSGSA-N 0 3 421.557 4.356 20 0 HIADHN CS(=O)(=O)c1ccc(-c2nc(CN[C@@H]3CCC[C@H]3Cc3ccccc3)co2)cc1 ZINC000493576124 905167076 /nfs/dbraw/zinc/16/70/76/905167076.db2.gz VYVXGIXNWDQQAF-SIKLNZKXSA-N 0 3 410.539 4.246 20 0 HIADHN COc1ccc([C@@H](CNC(=O)CCOc2ccc(F)cc2Cl)N2CCCC2)cc1 ZINC000493638317 905180500 /nfs/dbraw/zinc/18/05/00/905180500.db2.gz RNPWDFIHZODXSY-HXUWFJFHSA-N 0 3 420.912 4.210 20 0 HIADHN CC(=O)N1CCN(c2ccccc2CN[C@@H](C)c2cc(Br)cs2)CC1 ZINC000493769389 905216402 /nfs/dbraw/zinc/21/64/02/905216402.db2.gz RFXMAFNRGNOIDK-AWEZNQCLSA-N 0 3 422.392 4.030 20 0 HIADHN CC(C)Cc1noc(-c2cc(Cl)ccc2NC(=O)N2CC[C@H]3CCN(C)C[C@@H]32)n1 ZINC000493835886 905229622 /nfs/dbraw/zinc/22/96/22/905229622.db2.gz NUALEXCUJOZNRE-KDOFPFPSSA-N 0 3 417.941 4.146 20 0 HIADHN Cc1ccc([C@H](N[C@@H]2CCc3ccccc3OC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000493891073 905248451 /nfs/dbraw/zinc/24/84/51/905248451.db2.gz JVOZOAYIZPJABM-RDGATRHJSA-N 0 3 421.562 4.471 20 0 HIADHN CC[C@@H](NC(=O)NC[C@@H](c1ccc(OC(C)C)cc1)N(C)C)c1nc(C)cs1 ZINC000493919128 905269820 /nfs/dbraw/zinc/26/98/20/905269820.db2.gz GWCYUELKZWIJDU-MOPGFXCFSA-N 0 3 404.580 4.292 20 0 HIADHN Cc1nc(COc2cccc(C(=O)N[C@@H]3CCN(Cc4ccccc4)C3)c2)cs1 ZINC000493946584 905296800 /nfs/dbraw/zinc/29/68/00/905296800.db2.gz FVPZNMMCACVFOD-HXUWFJFHSA-N 0 3 407.539 4.035 20 0 HIADHN COC[C@H](N[C@H](C)c1cc(F)ccc1N1CCN(C)CC1)c1ccc(Cl)cc1 ZINC000493961334 905311946 /nfs/dbraw/zinc/31/19/46/905311946.db2.gz PFNULPNVFXTRND-IERDGZPVSA-N 0 3 405.945 4.269 20 0 HIADHN Cc1cc(NC(=O)N2CC[C@H]3CCN(C)C[C@H]32)nn1-c1ccc(Cl)c(Cl)c1 ZINC000493984637 905327267 /nfs/dbraw/zinc/32/72/67/905327267.db2.gz UHZIKNPABFYSQR-CXAGYDPISA-N 0 3 408.333 4.045 20 0 HIADHN CC1(CN[C@@H](c2ccc(Cl)cc2)c2cccc(S(C)(=O)=O)c2)CCOCC1 ZINC000493983407 905328050 /nfs/dbraw/zinc/32/80/50/905328050.db2.gz NMSMEXQJOOSQHS-FQEVSTJZSA-N 0 3 407.963 4.239 20 0 HIADHN Cc1cc(C[C@H](C)N[C@H](c2ccc(Cl)cc2)c2cccc(S(C)(=O)=O)c2)[nH]n1 ZINC000493989318 905331775 /nfs/dbraw/zinc/33/17/75/905331775.db2.gz KPNFMJLNDCLWNN-LHSJRXKWSA-N 0 3 417.962 4.085 20 0 HIADHN Cc1cc(C[C@H](C)N[C@H](c2ccc(Cl)cc2)c2cccc(S(C)(=O)=O)c2)n[nH]1 ZINC000493989318 905331804 /nfs/dbraw/zinc/33/18/04/905331804.db2.gz KPNFMJLNDCLWNN-LHSJRXKWSA-N 0 3 417.962 4.085 20 0 HIADHN C[C@H]1[C@@H](NC(=O)c2ccccc2-c2nc(C(C)(C)C)no2)CCN1Cc1ccccc1 ZINC000493997777 905340541 /nfs/dbraw/zinc/34/05/41/905340541.db2.gz BIAAUNHIWSOPRL-UWJYYQICSA-N 0 3 418.541 4.427 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](N[C@H]2CCOC3(CCC3)C2)c2ccc(F)cc2)c1 ZINC000494003657 905344830 /nfs/dbraw/zinc/34/48/30/905344830.db2.gz KRVXOMFXHMODIY-PZJWPPBQSA-N 0 3 403.519 4.010 20 0 HIADHN C[C@@H]1[C@H](NC(=O)Cc2csc(Cc3ccccc3)n2)CCN1Cc1ccccc1 ZINC000494019974 905359786 /nfs/dbraw/zinc/35/97/86/905359786.db2.gz WQGWVABRKKBHAX-XMSQKQJNSA-N 0 3 405.567 4.056 20 0 HIADHN C[C@@H]1[C@H](NC(=O)c2ccc(OCc3ccncc3)cc2)CCN1Cc1ccccc1 ZINC000494027406 905367845 /nfs/dbraw/zinc/36/78/45/905367845.db2.gz MLECDKPOFNZKNH-NTKDMRAZSA-N 0 3 401.510 4.053 20 0 HIADHN C[C@@H]1C[C@H](N2CCOCC2)CN1Cc1c(-c2ccc(Cl)cc2)nc2sccn12 ZINC000512408217 921140875 /nfs/dbraw/zinc/14/08/75/921140875.db2.gz CJUUIIOSFZEIIN-QAPCUYQASA-N 0 3 416.978 4.011 20 0 HIADHN NC(=O)C1CCC(N[C@H](c2ccccc2)c2cc(Br)ccc2F)CC1 ZINC000494038182 905379126 /nfs/dbraw/zinc/37/91/26/905379126.db2.gz JYENHWYMJCBCHS-GSQSYGFSSA-N 0 3 405.311 4.311 20 0 HIADHN C[C@H]1[C@@H](NC(=O)COc2ccc(Oc3ccccn3)cc2)CCN1Cc1ccccc1 ZINC000494060770 905396523 /nfs/dbraw/zinc/39/65/23/905396523.db2.gz QOMCYOFABIOGSW-CVDCTZTESA-N 0 3 417.509 4.032 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)COc2ccc(Oc3ccccn3)cc2)CCN1Cc1ccccc1 ZINC000494060772 905398293 /nfs/dbraw/zinc/39/82/93/905398293.db2.gz QOMCYOFABIOGSW-XXBNENTESA-N 0 3 417.509 4.032 20 0 HIADHN CC(C)n1ncc2c1nc(C1CC1)cc2C(=O)N[C@H]1CCN(Cc2ccccc2)[C@H]1C ZINC000494070612 905409081 /nfs/dbraw/zinc/40/90/81/905409081.db2.gz XYTNCPQJFNPJCI-JTSKRJEESA-N 0 3 417.557 4.282 20 0 HIADHN C[C@H]1CN(C(=O)c2csc(-c3ccc(Cl)cc3)c2)CC[C@@H]1N1CCN(C)CC1 ZINC000494131084 905476269 /nfs/dbraw/zinc/47/62/69/905476269.db2.gz PENFYEQJBOOHQM-JXFKEZNVSA-N 0 3 418.006 4.167 20 0 HIADHN CCCc1ccc([C@@H](NC(=O)N2CCN(C3CCOCC3)C[C@@H]2C)C(C)C)cc1 ZINC000494194597 905529619 /nfs/dbraw/zinc/52/96/19/905529619.db2.gz IRSNLLWIXGBMFL-CVDCTZTESA-N 0 3 401.595 4.231 20 0 HIADHN Cc1ccc(-c2n[nH]cc2CN2CCC[C@@H](CNC(=O)Nc3ccc(C)cc3)C2)o1 ZINC000512428051 921154982 /nfs/dbraw/zinc/15/49/82/921154982.db2.gz OWEGIMKFVDYGEZ-SFHVURJKSA-N 0 3 407.518 4.320 20 0 HIADHN C[C@H](O)C[C@H]1CCCCCN1CC(=O)N[C@H](c1cccs1)c1ccc(F)cc1 ZINC000512434422 921158223 /nfs/dbraw/zinc/15/82/23/921158223.db2.gz XJEARBHESGVQTR-NBCNXNJRSA-N 0 3 404.551 4.108 20 0 HIADHN CCCC(=O)NC[C@@H]1CCCN(Cc2ccc(OCc3csc(C)n3)cc2)C1 ZINC000512433093 921159098 /nfs/dbraw/zinc/15/90/98/921159098.db2.gz JWVVVVRGKGVDQA-IBGZPJMESA-N 0 3 401.576 4.159 20 0 HIADHN Cc1nc2ccc(CNCc3ccc(C(=O)N4C[C@@H](C)O[C@@H](C)C4)cc3)cc2s1 ZINC000494314618 905629475 /nfs/dbraw/zinc/62/94/75/905629475.db2.gz PZOWUCLOIMQYHF-IYBDPMFKSA-N 0 3 409.555 4.144 20 0 HIADHN Cc1ccc(NC(=O)NC[C@H]2CCCN(Cc3c[nH]nc3-c3cccs3)C2)cc1 ZINC000512445332 921167379 /nfs/dbraw/zinc/16/73/79/921167379.db2.gz ZBFPJHKLKSVXHE-QGZVFWFLSA-N 0 3 409.559 4.480 20 0 HIADHN COc1ccccc1[C@@H](NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1)c1ccco1 ZINC000494424465 905712400 /nfs/dbraw/zinc/71/24/00/905712400.db2.gz ITGFCEIHVFFZCC-HYBUGGRVSA-N 0 3 419.525 4.341 20 0 HIADHN O=C1[C@H](N[C@H]2CCO[C@@H]2c2ccc(Cl)c(F)c2)CCCN1c1ccccc1F ZINC000494492200 905777237 /nfs/dbraw/zinc/77/72/37/905777237.db2.gz HFVRCVGYAKRXBY-NLWGTHIKSA-N 0 3 406.860 4.233 20 0 HIADHN Cc1ccc(S(=O)(=O)CCCN[C@@H]2CCO[C@H]2c2ccc(Cl)c(F)c2)cc1 ZINC000494496785 905783761 /nfs/dbraw/zinc/78/37/61/905783761.db2.gz PRCRBGYOIHRRSP-UXHICEINSA-N 0 3 411.926 4.071 20 0 HIADHN Cc1ccc(NC(=O)NC[C@@H]2CCCN(Cc3cnc(-c4ccccc4)[nH]3)C2)cc1 ZINC000512464369 921179098 /nfs/dbraw/zinc/17/90/98/921179098.db2.gz WXBKRTNZBXBWGH-IBGZPJMESA-N 0 3 403.530 4.419 20 0 HIADHN Cc1nsc(N2CCCN(CCSc3ccnc4cc(Cl)ccc43)CC2)n1 ZINC000512470555 921182737 /nfs/dbraw/zinc/18/27/37/921182737.db2.gz ZFJMQWKRZCRNSG-UHFFFAOYSA-N 0 3 420.007 4.353 20 0 HIADHN Cc1ccc([C@H](NC(=O)CN2CCCCC[C@@H]2C[C@H](C)O)c2cccs2)cc1 ZINC000512473730 921183587 /nfs/dbraw/zinc/18/35/87/921183587.db2.gz FPPAGAHJPQSFKB-NOXFTYBFSA-N 0 3 400.588 4.278 20 0 HIADHN O=C(Nc1ccc(CC(F)(F)F)cc1)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000494582707 905849456 /nfs/dbraw/zinc/84/94/56/905849456.db2.gz DUBMZDSUUMPKAZ-UHFFFAOYSA-N 0 3 406.448 4.248 20 0 HIADHN CCSc1ccc([C@H](C)NC(=O)N[C@H](CN(C)C)c2ccc(OC)cc2)cc1 ZINC000494599677 905856061 /nfs/dbraw/zinc/85/60/61/905856061.db2.gz HRORIEYCWXUAIC-HRAATJIYSA-N 0 3 401.576 4.470 20 0 HIADHN COC(=O)COc1cccc(CN[C@@H]2CCc3cc(Br)cc(C)c32)c1 ZINC000494609869 905861802 /nfs/dbraw/zinc/86/18/02/905861802.db2.gz UXCVYHMMCBAAEQ-GOSISDBHSA-N 0 3 404.304 4.086 20 0 HIADHN CCCCc1cc(NC(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)n[nH]1 ZINC000494649360 905882185 /nfs/dbraw/zinc/88/21/85/905882185.db2.gz MYEZJLDFURFMDX-FQEVSTJZSA-N 0 3 421.549 4.348 20 0 HIADHN O=C(Nc1ccc(Nc2ccccc2)nc1)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000494665633 905890246 /nfs/dbraw/zinc/89/02/46/905890246.db2.gz OOKGQPHRFFADDB-UHFFFAOYSA-N 0 3 416.525 4.282 20 0 HIADHN C[C@@H](NC(=O)N[C@@H](CN1CCCC1)c1ccccc1)c1nc(C(F)(F)F)cs1 ZINC000494717056 905920445 /nfs/dbraw/zinc/92/04/45/905920445.db2.gz AXKSZHYPPSUIID-HIFRSBDPSA-N 0 3 412.481 4.359 20 0 HIADHN CN(C)CCN(Cc1cccc(O)c1)C(=O)c1csc(-c2ccc(Cl)s2)n1 ZINC000494780560 905980716 /nfs/dbraw/zinc/98/07/16/905980716.db2.gz QSIXPRDPDPAQBM-UHFFFAOYSA-N 0 3 421.975 4.435 20 0 HIADHN CCN(CCNCc1nc(-c2cccc(Br)c2)c[nH]1)CCC(F)(F)F ZINC000494841966 906031607 /nfs/dbraw/zinc/03/16/07/906031607.db2.gz JLBJIRKXRNSZEU-UHFFFAOYSA-N 0 3 419.289 4.203 20 0 HIADHN C[C@@H]1CN(C2CCOCC2)CCN1C(=O)N[C@H](c1ccc(Cl)cc1)C1CCCC1 ZINC000494857944 906041348 /nfs/dbraw/zinc/04/13/48/906041348.db2.gz HXULDQWWBJKZMP-VGSWGCGISA-N 0 3 419.997 4.466 20 0 HIADHN CN(CC(=O)N[C@H](c1ccccc1)c1ccc2[nH]c(C(F)(F)F)nc2c1)C1CCC1 ZINC000494874180 906054803 /nfs/dbraw/zinc/05/48/03/906054803.db2.gz OAHKMXLSBOEMHI-HXUWFJFHSA-N 0 3 416.447 4.272 20 0 HIADHN CN(CC(=O)N[C@H](c1ccccc1)c1ccc2nc(C(F)(F)F)[nH]c2c1)C1CCC1 ZINC000494874180 906054816 /nfs/dbraw/zinc/05/48/16/906054816.db2.gz OAHKMXLSBOEMHI-HXUWFJFHSA-N 0 3 416.447 4.272 20 0 HIADHN CN1CCN(CC(=O)N2CCc3sccc3[C@@H]2c2ccccc2)C2(CCCCC2)C1 ZINC000494893780 906068865 /nfs/dbraw/zinc/06/88/65/906068865.db2.gz PYBMGBYYZPASQJ-DEOSSOPVSA-N 0 3 423.626 4.173 20 0 HIADHN C[C@@H](NC(=O)N1CCN(C2CCOCC2)C[C@H]1C)c1ccc(Oc2ccccc2)cc1 ZINC000494912126 906086100 /nfs/dbraw/zinc/08/61/00/906086100.db2.gz SYCGPUJHEOVLJA-WOJBJXKFSA-N 0 3 423.557 4.435 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)c1c[nH]nc1-c1ccc(Cl)s1 ZINC000494925186 906096850 /nfs/dbraw/zinc/09/68/50/906096850.db2.gz QJXZEDLBONITNZ-CYBMUJFWSA-N 0 3 406.964 4.420 20 0 HIADHN Cc1noc(C)c1[C@H](C)CN[C@H](c1ccc(C)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000494990956 906155444 /nfs/dbraw/zinc/15/54/44/906155444.db2.gz YGPQGHHQZOLRAY-WAIKUNEKSA-N 0 3 412.555 4.486 20 0 HIADHN CCOCc1cc(CN2CCC(c3nc(-c4ccccn4)no3)CC2)ccc1OC ZINC000512516797 921210563 /nfs/dbraw/zinc/21/05/63/921210563.db2.gz LXABEXQXROJURF-UHFFFAOYSA-N 0 3 408.502 4.056 20 0 HIADHN Fc1ccc(CN2CCC[C@H](N[C@H](c3nc[nH]n3)C3CCCCC3)C2)c(Cl)c1 ZINC000495036484 906192408 /nfs/dbraw/zinc/19/24/08/906192408.db2.gz MZMQWSMXZBLYRX-ICSRJNTNSA-N 0 3 405.949 4.473 20 0 HIADHN Fc1ccc(CN2CCC[C@@H](N[C@@H](c3nc[nH]n3)C3CCCCC3)C2)c(Cl)c1 ZINC000495036486 906193092 /nfs/dbraw/zinc/19/30/92/906193092.db2.gz MZMQWSMXZBLYRX-UYAOXDASSA-N 0 3 405.949 4.473 20 0 HIADHN Fc1ccc([C@@H](C[C@@H]2CCOC2)NCc2cc(F)ccc2N2CCOCC2)cc1 ZINC000495041731 906198232 /nfs/dbraw/zinc/19/82/32/906198232.db2.gz VDYGRFWNFGPPKQ-HTAPYJJXSA-N 0 3 402.485 4.059 20 0 HIADHN COc1cc(CN[C@@H](C)c2ccc(C(=O)N(C)C)cc2)cc(Br)c1OC ZINC000495063461 906215257 /nfs/dbraw/zinc/21/52/57/906215257.db2.gz BNAHLOIXFPILBH-ZDUSSCGKSA-N 0 3 421.335 4.019 20 0 HIADHN Fc1ccc([C@@H](C[C@H]2CCOC2)NCc2ccnc(OC3CCOCC3)c2)cc1 ZINC000495079310 906225716 /nfs/dbraw/zinc/22/57/16/906225716.db2.gz NLTRKSNHQHKYCA-XMSQKQJNSA-N 0 3 400.494 4.036 20 0 HIADHN CC(C)C[C@@H](NC(=O)N1CCN(C2CCOCC2)C[C@H]1C)c1ccc(Cl)cc1 ZINC000495253970 906341748 /nfs/dbraw/zinc/34/17/48/906341748.db2.gz XELSIIRNSWLAGP-DYESRHJHSA-N 0 3 407.986 4.322 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)c2cccc(F)c2Br)cc1 ZINC000495344885 906390988 /nfs/dbraw/zinc/39/09/88/906390988.db2.gz FIABCKZCOTWINU-SFHVURJKSA-N 0 3 421.310 4.164 20 0 HIADHN CC(=O)NCCc1ccc([C@@H](C)N[C@H](C)c2c(C)nn(CC(F)(F)F)c2C)cc1 ZINC000495421942 906443713 /nfs/dbraw/zinc/44/37/13/906443713.db2.gz WQPQFWYNNQLHOP-ZIAGYGMSSA-N 0 3 410.484 4.153 20 0 HIADHN COc1ccc(OC)c(NC(=O)C[C@H](C)N[C@H]2CCCOc3c(F)cccc32)c1 ZINC000495435514 906450818 /nfs/dbraw/zinc/45/08/18/906450818.db2.gz XOBLGXDFQDNOCS-KSSFIOAISA-N 0 3 402.466 4.064 20 0 HIADHN Cc1cc(OC[C@@H](O)CN2CCC[C@](O)(C(F)(F)F)CC2)c(C(C)C)cc1Cl ZINC000512562587 921237935 /nfs/dbraw/zinc/23/79/35/921237935.db2.gz YSBKBLMNUWZVQZ-HNAYVOBHSA-N 0 3 423.903 4.291 20 0 HIADHN C[C@H](NCc1cccc(NC(=O)Cn2cccn2)c1)c1ccc(C(F)(F)F)cc1 ZINC000495529929 906497416 /nfs/dbraw/zinc/49/74/16/906497416.db2.gz LQEYBTKIDQEEMG-HNNXBMFYSA-N 0 3 402.420 4.391 20 0 HIADHN C[C@@H](NCc1cccc(NC(=O)Cn2cccn2)c1)c1ccc(OC(F)(F)F)cc1 ZINC000495530735 906499499 /nfs/dbraw/zinc/49/94/99/906499499.db2.gz OILDJLSIUMGNRC-OAHLLOKOSA-N 0 3 418.419 4.271 20 0 HIADHN CS[C@H]1CN(C(=O)c2ccc(-c3nc4ccccc4s3)s2)C[C@H]1N(C)C ZINC000495608656 906512617 /nfs/dbraw/zinc/51/26/17/906512617.db2.gz UQQKJMZPCXLGEI-DYVFJYSZSA-N 0 3 403.598 4.142 20 0 HIADHN CS[C@H]1CN(C(=O)c2csc(-c3ccc(Cl)c(Cl)c3)n2)C[C@H]1N(C)C ZINC000495681351 906521955 /nfs/dbraw/zinc/52/19/55/906521955.db2.gz GTVCFWXIBUPXRD-CABCVRRESA-N 0 3 416.399 4.235 20 0 HIADHN CC(C)N(CCN(C)C)C(=O)c1cccc(NC(=O)CCCc2cccs2)c1 ZINC000496027536 906600359 /nfs/dbraw/zinc/60/03/59/906600359.db2.gz HUUZUZGWZZNSGR-UHFFFAOYSA-N 0 3 401.576 4.122 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)c1cc(C(C)C)n(C(C)(C)C)n1 ZINC000496261528 906640461 /nfs/dbraw/zinc/64/04/61/906640461.db2.gz INLIMTJIALDVFE-FQEVSTJZSA-N 0 3 411.594 4.283 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)c1oc2ccccc2c1COC ZINC000496263764 906642464 /nfs/dbraw/zinc/64/24/64/906642464.db2.gz PHBBLPXAJIVIEK-LJQANCHMSA-N 0 3 407.514 4.101 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)c1nc(-c2ccco2)sc1C ZINC000496262980 906642580 /nfs/dbraw/zinc/64/25/80/906642580.db2.gz NDOSOYFWYMKREQ-SFHVURJKSA-N 0 3 410.543 4.233 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)c1oc2ccccc2c1COC ZINC000496263757 906642853 /nfs/dbraw/zinc/64/28/53/906642853.db2.gz PHBBLPXAJIVIEK-IBGZPJMESA-N 0 3 407.514 4.101 20 0 HIADHN O=C(Nc1ccc(O)cc1)C1CCN(Cc2ccccc2OCC(F)(F)F)CC1 ZINC000512605006 921257860 /nfs/dbraw/zinc/25/78/60/921257860.db2.gz UMLDIMGRPHKOQS-UHFFFAOYSA-N 0 3 408.420 4.184 20 0 HIADHN CC[C@H](C)n1ncc(NC(=O)c2ccc(CN3CCC(CO)CC3)cc2)c1C1CC1 ZINC000496615198 906722121 /nfs/dbraw/zinc/72/21/21/906722121.db2.gz MLPAOMWYPJWRTN-KRWDZBQOSA-N 0 3 410.562 4.188 20 0 HIADHN O=C(c1ccncc1Br)N(CCN1CCCC1)Cc1ccc(Cl)cc1 ZINC000496830040 906763866 /nfs/dbraw/zinc/76/38/66/906763866.db2.gz JCRIPOAOZWAULZ-UHFFFAOYSA-N 0 3 422.754 4.236 20 0 HIADHN COc1ccc(-c2n[nH]cc2CN2CCC(n3ccc(C(F)(F)F)n3)CC2)cc1 ZINC000497225644 906822299 /nfs/dbraw/zinc/82/22/99/906822299.db2.gz CKQIAALLJKLUQZ-UHFFFAOYSA-N 0 3 405.424 4.138 20 0 HIADHN FC(F)(F)c1ccn(C2CCN(Cc3ccc(Oc4cnccn4)cc3)CC2)n1 ZINC000497233714 906824441 /nfs/dbraw/zinc/82/44/41/906824441.db2.gz ZEPGICHEWLLIJM-UHFFFAOYSA-N 0 3 403.408 4.321 20 0 HIADHN COc1ccc(-c2nc(C(=O)N(Cc3ccco3)C3CCN(C)CC3)cs2)cc1 ZINC000497364614 906854972 /nfs/dbraw/zinc/85/49/72/906854972.db2.gz PXTZQJZTBOQVLM-UHFFFAOYSA-N 0 3 411.527 4.148 20 0 HIADHN Cc1sc(CNC(=O)N2CC[C@@H]3CCN(C)C[C@H]32)nc1-c1ccc(Cl)cc1 ZINC000497377456 906865706 /nfs/dbraw/zinc/86/57/06/906865706.db2.gz WDVKJVMCUBOWJR-WMLDXEAASA-N 0 3 404.967 4.008 20 0 HIADHN CN(C)[C@H](CNC(=O)C1(c2ccc(Br)cc2)CCC1)c1ccccc1 ZINC000497383947 906869991 /nfs/dbraw/zinc/86/99/91/906869991.db2.gz HTZGMDDGBVGDTQ-LJQANCHMSA-N 0 3 401.348 4.290 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)N[C@H](c3ccc(Br)cc3)C3CCC3)[C@H]2C1 ZINC000497385960 906871885 /nfs/dbraw/zinc/87/18/85/906871885.db2.gz ILZBFPIYZLHKKZ-CCKFTAQKSA-N 0 3 406.368 4.026 20 0 HIADHN COc1cc(C(=O)N(CCN(C)C)Cc2ccc(C)o2)ccc1OC1CCCC1 ZINC000497401919 906881960 /nfs/dbraw/zinc/88/19/60/906881960.db2.gz QSVRGAPYYDNVSZ-UHFFFAOYSA-N 0 3 400.519 4.122 20 0 HIADHN CCCOc1ccc(CC(=O)N[C@H]2CN(C)C[C@H]2c2ccccc2)cc1OCCC ZINC000497415944 906890659 /nfs/dbraw/zinc/89/06/59/906890659.db2.gz JEOJMOJOAVAFGA-VXKWHMMOSA-N 0 3 410.558 4.021 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CNC(=O)CN(C)[C@@H](c1ccccc1)C(C)C ZINC000497422476 906895432 /nfs/dbraw/zinc/89/54/32/906895432.db2.gz OKZGUWSJVXHACG-AREMUKBSSA-N 0 3 418.585 4.494 20 0 HIADHN COc1ccc([C@@H](C)NC(=O)NC[C@H]2CCCN2Cc2ccccc2)c(C)c1OC ZINC000497445285 906918199 /nfs/dbraw/zinc/91/81/99/906918199.db2.gz WNGOZJMKBAVKJY-UYAOXDASSA-N 0 3 411.546 4.037 20 0 HIADHN COc1cc(F)c([C@@H](C)NC(=O)NC[C@H](c2cccs2)N2CCCC2)cc1OC ZINC000512678121 921284814 /nfs/dbraw/zinc/28/48/14/921284814.db2.gz OQNMHGHUIAEZCU-RHSMWYFYSA-N 0 3 421.538 4.102 20 0 HIADHN COc1ccc([C@H](CNC(=O)[C@H]2C[C@H]2c2ccc(F)cc2F)N2CCCC2)cc1 ZINC000497556104 907044340 /nfs/dbraw/zinc/04/43/40/907044340.db2.gz HUVNJSZHQCUXKU-ONTIZHBOSA-N 0 3 400.469 4.030 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)c1cccc(-n2nccc2C(F)(F)F)c1 ZINC000497559715 907047817 /nfs/dbraw/zinc/04/78/17/907047817.db2.gz KSTLYXNHCMVBLW-UHFFFAOYSA-N 0 3 416.447 4.095 20 0 HIADHN O[C@@H](COc1ccc(Cl)cc1Cl)CN(Cc1cccs1)C[C@H]1CCCO1 ZINC000497590203 907069998 /nfs/dbraw/zinc/06/99/98/907069998.db2.gz BVTFDONEPODFGR-HZPDHXFCSA-N 0 3 416.370 4.476 20 0 HIADHN Cc1ccc(CNC(=O)C2CCN(Cc3cccc(OC(F)(F)F)c3)CC2)cc1 ZINC000512702024 921292653 /nfs/dbraw/zinc/29/26/53/921292653.db2.gz ZAFGVVWLDLTKNW-UHFFFAOYSA-N 0 3 406.448 4.422 20 0 HIADHN CC(C)Cn1ncc(NC(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)c1C1CC1 ZINC000497641830 907127355 /nfs/dbraw/zinc/12/73/55/907127355.db2.gz KFRKITZUNYYIEF-UHFFFAOYSA-N 0 3 419.520 4.290 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)N[C@H]3CCCc4nc(-c5ccc(F)cc5)sc43)[C@@H]2C1 ZINC000497645049 907132830 /nfs/dbraw/zinc/13/28/30/907132830.db2.gz YJQAZBFJFQTDSV-MDASCCDHSA-N 0 3 414.550 4.062 20 0 HIADHN CCOc1cc(C[NH2+]CCOc2ccc(Cl)cc2)cc(Br)c1[O-] ZINC000497696756 907202559 /nfs/dbraw/zinc/20/25/59/907202559.db2.gz PURVDSHTBNGNKT-UHFFFAOYSA-N 0 3 400.700 4.375 20 0 HIADHN COc1cccc([C@H](CNC(=O)C[C@@H]2CCCc3cc(OC)ccc32)N2CCCC2)c1 ZINC000497707547 907213072 /nfs/dbraw/zinc/21/30/72/907213072.db2.gz YUOCAQRGGJHAGI-CPJSRVTESA-N 0 3 422.569 4.467 20 0 HIADHN CCN1CCN(Cc2ccc(CNC(=O)Nc3ccc(COC(C)C)cc3)cc2)CC1 ZINC000512763792 921303830 /nfs/dbraw/zinc/30/38/30/921303830.db2.gz VBHXVGQOPKEXFT-UHFFFAOYSA-N 0 3 424.589 4.071 20 0 HIADHN CCN(C(=O)N[C@H](C)c1nccn1-c1ccccc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000512778480 921309773 /nfs/dbraw/zinc/30/97/73/921309773.db2.gz NKJNPIBPSNQKHB-OFNKIYASSA-N 0 3 417.557 4.239 20 0 HIADHN CC(C)c1noc2nc(C3CC3)cc(C(=O)N[C@H]3CN(C)C[C@@H]3c3ccccc3)c21 ZINC000497806025 907292465 /nfs/dbraw/zinc/29/24/65/907292465.db2.gz WMZUKYXDYGNOIP-QUCCMNQESA-N 0 3 404.514 4.051 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)c2cccc(Cn3nc(C)cc3C)c2)N(C)C)cc1 ZINC000497810103 907296022 /nfs/dbraw/zinc/29/60/22/907296022.db2.gz YMEWHHIIIOVBHM-XMMPIXPASA-N 0 3 404.558 4.143 20 0 HIADHN C[C@@H](NC(=O)N[C@@H](CN(C)C)c1ccc(Cl)cc1)c1nccn1-c1ccccc1 ZINC000512798186 921312943 /nfs/dbraw/zinc/31/29/43/921312943.db2.gz RTXYVZPOYACSOC-UZLBHIALSA-N 0 3 411.937 4.189 20 0 HIADHN CCS[C@@H]1CC[C@H](N(C)C(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)C1 ZINC000512807939 921315583 /nfs/dbraw/zinc/31/55/83/921315583.db2.gz LWIJXGQEXWFCNS-CEWLAPEOSA-N 0 3 407.624 4.392 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)c(C)c1CNC[C@@H]1CN(Cc2ccccc2)CCO1 ZINC000512813825 921318495 /nfs/dbraw/zinc/31/84/95/921318495.db2.gz ARJYEIYUZUAWOR-HSZRJFAPSA-N 0 3 424.976 4.133 20 0 HIADHN CN(C)Cc1cccc(NC(=O)[C@@H]2CC(=O)N(c3cc(Cl)cc(Cl)c3)C2)c1 ZINC000497937609 907402884 /nfs/dbraw/zinc/40/28/84/907402884.db2.gz JRVZULOIVFCXGP-CQSZACIVSA-N 0 3 406.313 4.047 20 0 HIADHN CN1CC[C@H](NC(=O)N[C@H](c2cccc(F)c2)c2ccccn2)[C@@H]1c1ccccc1 ZINC000497958300 907429201 /nfs/dbraw/zinc/42/92/01/907429201.db2.gz OFIDFYVOJUSVLI-ZRBLBEILSA-N 0 3 404.489 4.055 20 0 HIADHN COc1ccc(CCC(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)cc1F ZINC000497978619 907453699 /nfs/dbraw/zinc/45/36/99/907453699.db2.gz MIJNNUBDUKQLSQ-IBGZPJMESA-N 0 3 404.551 4.418 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3ccc(Cl)c4ncccc34)CC2)C[C@H](C)O1 ZINC000512822256 921327189 /nfs/dbraw/zinc/32/71/89/921327189.db2.gz QEPJNBMXFMYNTG-CALCHBBNSA-N 0 3 415.965 4.240 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)N(C)Cc2cc(F)cc(F)c2)N(C)C)cc1 ZINC000512827118 921331719 /nfs/dbraw/zinc/33/17/19/921331719.db2.gz LFGSTSSUEZMXFW-NRFANRHFSA-N 0 3 405.489 4.196 20 0 HIADHN C[C@@H](SCC(=O)N(CCN(C)C)Cc1ccccc1F)c1nc2ccccc2[nH]1 ZINC000498111535 907621622 /nfs/dbraw/zinc/62/16/22/907621622.db2.gz JXYWFUVVMVUTCH-MRXNPFEDSA-N 0 3 414.550 4.087 20 0 HIADHN CC(C)(C)C(=O)Nc1ccccc1C(=O)N1CCCN(CCCc2ccccc2)CC1 ZINC000498183237 907716430 /nfs/dbraw/zinc/71/64/30/907716430.db2.gz PATQOPFHKXJABI-UHFFFAOYSA-N 0 3 421.585 4.452 20 0 HIADHN CN(CCCN1CCN(C)CC1)C(=O)N[C@@H](c1cccc(Cl)c1)C1CCCCC1 ZINC000498290285 907821110 /nfs/dbraw/zinc/82/11/10/907821110.db2.gz ZDGNZPATBJTKKI-JOCHJYFZSA-N 0 3 421.029 4.240 20 0 HIADHN CCC(CC)[C@@H]1C[C@H](NC(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)CCO1 ZINC000498377767 907867144 /nfs/dbraw/zinc/86/71/44/907867144.db2.gz VPCOWAMAGRLZPL-NQIIRXRSSA-N 0 3 411.537 4.022 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)[C@H]1C[C@@H]1c1ccccc1C(F)(F)F ZINC000498485506 907956049 /nfs/dbraw/zinc/95/60/49/907956049.db2.gz SAMKYUZJPSUGJP-SJORKVTESA-N 0 3 412.521 4.287 20 0 HIADHN Cc1ccc(-c2cc(C(=O)N3CCN(C)CC[C@@H]3C)c3cnn(C(C)C)c3n2)s1 ZINC000498710117 908136647 /nfs/dbraw/zinc/13/66/47/908136647.db2.gz NRZGDGHYKPEYBP-HNNXBMFYSA-N 0 3 411.575 4.215 20 0 HIADHN Cc1ccc(-c2nc(CNC(=O)N[C@H]3CCN(Cc4ccccc4)[C@H]3C)co2)cc1 ZINC000498720499 908145096 /nfs/dbraw/zinc/14/50/96/908145096.db2.gz IENBCHXHOLGNDC-AVRDEDQJSA-N 0 3 404.514 4.112 20 0 HIADHN Cc1ccc(Cn2cc(C(=O)N3CCN(C)CC[C@@H]3C)c(-c3ccc(C)cc3)n2)cc1 ZINC000498720456 908145220 /nfs/dbraw/zinc/14/52/20/908145220.db2.gz SDOYPKXLMCLXKN-NRFANRHFSA-N 0 3 416.569 4.381 20 0 HIADHN CN(C)C[C@@H](NC(=O)NCc1cc(Cl)ccc1OC(F)F)c1ccc(F)cc1 ZINC000498725904 908152232 /nfs/dbraw/zinc/15/22/32/908152232.db2.gz KMZNQZLTYXWHQO-MRXNPFEDSA-N 0 3 415.843 4.183 20 0 HIADHN C[C@@H]1CCN(C)CCN1C(=O)c1cn(Cc2ccccc2)nc1-c1ccc(Cl)cc1 ZINC000498725921 908152411 /nfs/dbraw/zinc/15/24/11/908152411.db2.gz AUQNPTYXFHBNPT-GOSISDBHSA-N 0 3 422.960 4.418 20 0 HIADHN Cc1cccc(-c2nn(-c3ccc(F)cc3)cc2C(=O)N2CCN(C)CC[C@@H]2C)c1 ZINC000498725685 908152492 /nfs/dbraw/zinc/15/24/92/908152492.db2.gz IUSCPDQDSKOWLF-SFHVURJKSA-N 0 3 406.505 4.153 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N[C@H](C)c1nc(C2CCCCC2)no1)c1ccco1 ZINC000498733495 908162704 /nfs/dbraw/zinc/16/27/04/908162704.db2.gz YDQFNTQWBCZACZ-UXLLHSPISA-N 0 3 403.527 4.200 20 0 HIADHN O=C(CC(F)(F)F)N1CCC(N[C@@H](c2cc3ccccc3o2)c2cccnc2)CC1 ZINC000498774167 908194323 /nfs/dbraw/zinc/19/43/23/908194323.db2.gz OLMIQMORBVMEFQ-OAQYLSRUSA-N 0 3 417.431 4.450 20 0 HIADHN O=C(CN1CCC[C@@H](c2n[nH]c(C3CC3)n2)C1)Nc1ccccc1-c1ccccc1 ZINC000498915305 908323209 /nfs/dbraw/zinc/32/32/09/908323209.db2.gz MKQKMZPCZXMEEA-LJQANCHMSA-N 0 3 401.514 4.167 20 0 HIADHN CCN1C[C@@H](C)N(Cc2csc(N(C(C)=O)c3cccc(C)c3C)n2)C[C@@H]1C ZINC000498914781 908324412 /nfs/dbraw/zinc/32/44/12/908324412.db2.gz KBBFSUAQKXDSMU-DLBZAZTESA-N 0 3 400.592 4.359 20 0 HIADHN CC(=O)CCc1ccc(O[C@@H](C)C(=O)NC[C@H]2CCCCN2Cc2ccccc2)cc1 ZINC000498919954 908330351 /nfs/dbraw/zinc/33/03/51/908330351.db2.gz VHLQRHJDZPSDFZ-XUZZJYLKSA-N 0 3 422.569 4.146 20 0 HIADHN CCN1C[C@@H](C)N(Cc2csc(N(C(C)=O)c3ccc(C)cc3C)n2)C[C@@H]1C ZINC000498928543 908337936 /nfs/dbraw/zinc/33/79/36/908337936.db2.gz YDIQJFMUWRBDCD-ZWKOTPCHSA-N 0 3 400.592 4.359 20 0 HIADHN C[C@H](NC(=O)[C@H](C)N1CCC[C@@H](c2nc(C3CC3)n[nH]2)C1)c1cccc2ccccc21 ZINC000498935716 908342945 /nfs/dbraw/zinc/34/29/45/908342945.db2.gz ADAOXGFDDNAPLL-ABSDTBQOSA-N 0 3 417.557 4.281 20 0 HIADHN C[C@H](NC(=O)[C@H](C)N1CCC[C@@H](c2n[nH]c(C3CC3)n2)C1)c1cccc2ccccc21 ZINC000498935716 908342956 /nfs/dbraw/zinc/34/29/56/908342956.db2.gz ADAOXGFDDNAPLL-ABSDTBQOSA-N 0 3 417.557 4.281 20 0 HIADHN CC[C@@H](C)Sc1ccc(NC(=O)C(=O)NC[C@H](C)N2CCC(C)CC2)c(C)c1 ZINC000499000882 908378828 /nfs/dbraw/zinc/37/88/28/908378828.db2.gz OFASRZRXJRPNMF-ZWKOTPCHSA-N 0 3 405.608 4.061 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(-n2cncn2)cc1)C(=O)Nc1cccc(Cl)c1Cl ZINC000499073460 908438984 /nfs/dbraw/zinc/43/89/84/908438984.db2.gz RKLAIOGFIOFBKS-CHWSQXEVSA-N 0 3 404.301 4.252 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N[C@H](c2cccc(F)c2)c2ccccn2)N(C)C)cc1 ZINC000499086185 908449889 /nfs/dbraw/zinc/44/98/89/908449889.db2.gz YBMOCKDJZBECIR-BJKOFHAPSA-N 0 3 420.532 4.475 20 0 HIADHN COc1ccc([C@H](C)N(C)C(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)cc1 ZINC000512918554 921411808 /nfs/dbraw/zinc/41/18/08/921411808.db2.gz QQXRHYJWGNCWIS-MBSDFSHPSA-N 0 3 413.562 4.488 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)N(C)Cc2ccc(F)c(F)c2)N(C)C)cc1 ZINC000512923843 921419004 /nfs/dbraw/zinc/41/90/04/921419004.db2.gz ZTTOTNCGZIRRFL-OAQYLSRUSA-N 0 3 405.489 4.196 20 0 HIADHN C[C@@H]1Cc2ccc(Br)cc2CN1C(=O)Nc1cccc(CN(C)C)c1 ZINC000499235355 908596022 /nfs/dbraw/zinc/59/60/22/908596022.db2.gz MEILQEGDANYENJ-CQSZACIVSA-N 0 3 402.336 4.489 20 0 HIADHN CN(CC[C@@H]1CCCCN1C)C(=O)CCCC(=O)c1ccc(Br)cc1 ZINC000499246475 908617717 /nfs/dbraw/zinc/61/77/17/908617717.db2.gz CQGOYCJDRBPCFR-SFHVURJKSA-N 0 3 409.368 4.135 20 0 HIADHN Cc1cc(C)n([C@@H](C)C(=O)N(CCN2CCCC2)Cc2ccc(Cl)c(Cl)c2)n1 ZINC000499349480 908723249 /nfs/dbraw/zinc/72/32/49/908723249.db2.gz XXBYCYNHLIZSMW-KRWDZBQOSA-N 0 3 423.388 4.492 20 0 HIADHN COc1ccc(O[C@@H](C)C(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)cc1 ZINC000499374787 908741569 /nfs/dbraw/zinc/74/15/69/908741569.db2.gz JFUPWFDNEGXWME-INIZCTEOSA-N 0 3 424.463 4.072 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)c1cccc([C@H]2CCCOC2)c1 ZINC000499382489 908746642 /nfs/dbraw/zinc/74/66/42/908746642.db2.gz RISCWHDJKJESNX-QFIPXVFZSA-N 0 3 410.583 4.424 20 0 HIADHN COc1cccc2c1CC[C@H]2NC(=O)NC[C@H](c1ccc(OC(C)C)cc1)N(C)C ZINC000499700180 908881307 /nfs/dbraw/zinc/88/13/07/908881307.db2.gz WCARSEIWCHQXJF-FGZHOGPDSA-N 0 3 411.546 4.072 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCc1ccc(N2CCCCC2)nc1)c1ccsc1 ZINC000499709459 908884400 /nfs/dbraw/zinc/88/44/00/908884400.db2.gz SDYILSQQGSRDBT-FQEVSTJZSA-N 0 3 415.607 4.016 20 0 HIADHN C[C@H](CN1CCC[C@@H](C)C1)NC(=O)c1oc2ccccc2c1CSc1ncccn1 ZINC000499725470 908892145 /nfs/dbraw/zinc/89/21/45/908892145.db2.gz AGGPKKKRTDWFDH-IAGOWNOFSA-N 0 3 424.570 4.365 20 0 HIADHN COc1ccccc1-c1csc([C@H]2CCCN(C[C@@](C)(O)C(F)(F)F)C2)n1 ZINC000499732998 908893703 /nfs/dbraw/zinc/89/37/03/908893703.db2.gz JFNAJAYSGPVDKG-SCLBCKFNSA-N 0 3 400.466 4.311 20 0 HIADHN O=C(CCc1cc(Br)cs1)N1CCCN(Cc2ccccc2)CC1 ZINC000499766687 908904975 /nfs/dbraw/zinc/90/49/75/908904975.db2.gz VICNNGUMZAUUGR-UHFFFAOYSA-N 0 3 407.377 4.178 20 0 HIADHN CCN(C(=O)c1cccc(NC(=O)NC2CC2)c1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000499998937 909451117 /nfs/dbraw/zinc/45/11/17/909451117.db2.gz HRNNKILQBOGLGG-JPYJTQIMSA-N 0 3 420.557 4.268 20 0 HIADHN CC[C@H](C)c1ccccc1OCC(=O)N(C)C1CCN(CCc2ccccn2)CC1 ZINC000500013260 909468836 /nfs/dbraw/zinc/46/88/36/909468836.db2.gz GBKNYTMVAGZOMK-FQEVSTJZSA-N 0 3 409.574 4.139 20 0 HIADHN CC(C)c1cccc(O[C@H](C)C(=O)N(C)C2CCN(CCc3ccccn3)CC2)c1 ZINC000500024092 909481174 /nfs/dbraw/zinc/48/11/74/909481174.db2.gz IBFQYKOJELPCFV-HXUWFJFHSA-N 0 3 409.574 4.138 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Cc2coc(-c3ccc(F)cc3)n2)N2CCCC2)cc1 ZINC000500030157 909486717 /nfs/dbraw/zinc/48/67/17/909486717.db2.gz CBPLCZGGEHEFHF-QFIPXVFZSA-N 0 3 407.489 4.285 20 0 HIADHN CN(C(=O)CSCc1ccc(Cl)cc1)C1CCN(CCc2ccccn2)CC1 ZINC000500061741 909527691 /nfs/dbraw/zinc/52/76/91/909527691.db2.gz HUZQEMFGCWBLPJ-UHFFFAOYSA-N 0 3 418.006 4.134 20 0 HIADHN Cc1ccc([C@H](Cn2ccnc2)NC(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)c(C)c1 ZINC000500099597 909579635 /nfs/dbraw/zinc/57/96/35/909579635.db2.gz BNHIZAIWXPHWPV-FGCOXFRFSA-N 0 3 419.573 4.232 20 0 HIADHN COc1ccc(C(=O)CCCC(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@H]2C)cc1 ZINC000500103909 909587839 /nfs/dbraw/zinc/58/78/39/909587839.db2.gz FFJXGSXTWNPKOQ-AUSIDOKSSA-N 0 3 408.542 4.075 20 0 HIADHN C[C@H](NC(C)(C)CNS(=O)(=O)Cc1ccccc1C(F)(F)F)c1ccccc1 ZINC000500111313 909591956 /nfs/dbraw/zinc/59/19/56/909591956.db2.gz ZDSSBTYBQCKEDA-HNNXBMFYSA-N 0 3 414.493 4.254 20 0 HIADHN CN(C)[C@H](CNC(=O)NCc1ccc(Oc2ccc(F)cc2)nc1)c1ccccc1 ZINC000500124983 909607305 /nfs/dbraw/zinc/60/73/05/909607305.db2.gz OZQAREOUXHNSBY-OAQYLSRUSA-N 0 3 408.477 4.115 20 0 HIADHN CN(C)CCN(CC1CCCCC1)C(=O)c1ccc(-c2noc(C(F)(F)F)n2)cc1 ZINC000500125759 909610119 /nfs/dbraw/zinc/61/01/19/909610119.db2.gz QRWMWAUCLPJXHE-UHFFFAOYSA-N 0 3 424.467 4.340 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)N[C@@H]2CC(C)(C)Oc3cc(F)ccc32)cc1 ZINC000500131557 909612336 /nfs/dbraw/zinc/61/23/36/909612336.db2.gz NBHMEARIFBVHEG-UXHICEINSA-N 0 3 415.509 4.039 20 0 HIADHN C[S@@](=O)Cc1ccc(CNCc2ccc(OC(F)F)c(Br)c2)cc1 ZINC000513053568 921510480 /nfs/dbraw/zinc/51/04/80/921510480.db2.gz ZYWQEDLSQBRLSL-XMMPIXPASA-N 0 3 418.303 4.219 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N[C@H]1CC(C)(C)Oc2cc(F)ccc21)c1ccco1 ZINC000500152914 909630981 /nfs/dbraw/zinc/63/09/81/909630981.db2.gz CUJAYFZOJZTOEO-JCGIZDLHSA-N 0 3 403.498 4.450 20 0 HIADHN COCCOc1ccccc1NC(=O)NC[C@@H](c1ccccc1)N1CCC(C)CC1 ZINC000513056176 921512620 /nfs/dbraw/zinc/51/26/20/921512620.db2.gz HSBYAGSNAVIODC-QFIPXVFZSA-N 0 3 411.546 4.307 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N[C@H](c1ccco1)c1ccccc1OC)c1ccco1 ZINC000500181773 909677280 /nfs/dbraw/zinc/67/72/80/909677280.db2.gz KFAGMRNPCXUWHP-ZJBJCVSYSA-N 0 3 411.502 4.399 20 0 HIADHN Fc1cccc(-c2noc([C@@H]3CCCN(Cc4ccc(N5CCCC5)nc4)C3)n2)c1 ZINC000513059683 921515984 /nfs/dbraw/zinc/51/59/84/921515984.db2.gz XCELLWOSEZEJAI-LJQANCHMSA-N 0 3 407.493 4.251 20 0 HIADHN CNC(=O)[C@H]1CCC[C@@H]1NCc1c(C)nn(-c2ccccc2)c1Oc1cccc(F)c1 ZINC000500230271 909719309 /nfs/dbraw/zinc/71/93/09/909719309.db2.gz PDIFGMKYVQZSDI-UNMCSNQZSA-N 0 3 422.504 4.116 20 0 HIADHN CNC(=O)[C@H]1CCC[C@H]1NCc1c(C)nn(-c2ccccc2)c1Oc1cccc(F)c1 ZINC000500230270 909719557 /nfs/dbraw/zinc/71/95/57/909719557.db2.gz PDIFGMKYVQZSDI-RBBKRZOGSA-N 0 3 422.504 4.116 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)c2cc(C)sc2Br)cc1 ZINC000500392960 909831730 /nfs/dbraw/zinc/83/17/30/909831730.db2.gz YAXKUPGCEPFWFE-KRWDZBQOSA-N 0 3 423.376 4.395 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)c2cnc3onc(C(C)(C)C)c3c2)cc1 ZINC000500392639 909831742 /nfs/dbraw/zinc/83/17/42/909831742.db2.gz XFLQRQDUQDNZDF-FQEVSTJZSA-N 0 3 422.529 4.096 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)c2cccc(-c3cscn3)c2)cc1 ZINC000500409626 909841000 /nfs/dbraw/zinc/84/10/00/909841000.db2.gz MVBJTHGWGNEHSF-NRFANRHFSA-N 0 3 407.539 4.386 20 0 HIADHN FC(F)O[C@@H]1CCCC[C@H]1NCc1nc(-c2cccc(Br)c2)c[nH]1 ZINC000500484664 909885711 /nfs/dbraw/zinc/88/57/11/909885711.db2.gz HLDKDSDFCQUSHM-UKRRQHHQSA-N 0 3 400.267 4.479 20 0 HIADHN CC[C@@H]1C[C@]1(NCc1ccc(OCC(=O)N2CCCC2)c(OC)c1)c1cccc(C)c1 ZINC000500496049 909891835 /nfs/dbraw/zinc/89/18/35/909891835.db2.gz JVHVXIBUUOZDTK-QFQXNSOFSA-N 0 3 422.569 4.420 20 0 HIADHN CC(C)Oc1ccc(CNCc2ccc(S(=O)(=O)N3CCC[C@@H](C)C3)cc2)cc1 ZINC000513078382 921532124 /nfs/dbraw/zinc/53/21/24/921532124.db2.gz ZOIIXJIDECVFSL-LJQANCHMSA-N 0 3 416.587 4.184 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)C1CCC(OC[C@@H]2CCCO2)CC1 ZINC000500583235 909944918 /nfs/dbraw/zinc/94/49/18/909944918.db2.gz OUADTLSTFHKQCS-STTLMXHVSA-N 0 3 416.606 4.014 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)N[C@H](c2ccc(C)cc2)C2CC2)CC1 ZINC000500622403 909973152 /nfs/dbraw/zinc/97/31/52/909973152.db2.gz VKPRJCCEABXPDZ-RUZDIDTESA-N 0 3 420.601 4.083 20 0 HIADHN CCOc1cc(CNCc2ccc3[nH]c(C)cc3c2)ccc1O[C@@H](C)C(=O)N(C)C ZINC000513087465 921538838 /nfs/dbraw/zinc/53/88/38/921538838.db2.gz AJQUMVDARUZSIV-KRWDZBQOSA-N 0 3 409.530 4.020 20 0 HIADHN CCc1nnc(NC(=O)[C@H](C)[C@H](C)NCc2ccc(-c3ccccc3F)o2)s1 ZINC000513093401 921542757 /nfs/dbraw/zinc/54/27/57/921542757.db2.gz AFVOQAGKEPNMGK-OLZOCXBDSA-N 0 3 402.495 4.253 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)c1ccc(-c2nc3ccccc3s2)o1 ZINC000500765831 910067416 /nfs/dbraw/zinc/06/74/16/910067416.db2.gz DUYHYHXAGIGBPD-UHFFFAOYSA-N 0 3 406.511 4.155 20 0 HIADHN C[S@@](=O)Cc1ccc(CNCc2ccc(Br)c3cccnc23)cc1 ZINC000513096941 921545151 /nfs/dbraw/zinc/54/51/51/921545151.db2.gz XVTBXWXXGKMKAQ-XMMPIXPASA-N 0 3 403.345 4.166 20 0 HIADHN C[C@H](Oc1ccccc1Cc1ccccc1)C(=O)N(CCN(C)C)Cc1ccccn1 ZINC000500776180 910072714 /nfs/dbraw/zinc/07/27/14/910072714.db2.gz QFBYQBWVLJRHPR-NRFANRHFSA-N 0 3 417.553 4.030 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)c2cc(C3CC3)nn2-c2ccccc2)C1 ZINC000500845671 910120833 /nfs/dbraw/zinc/12/08/33/910120833.db2.gz XDUJSLJZVWGZIA-RXVVDRJESA-N 0 3 400.526 4.315 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)CCOc2ccccc2Br)C1 ZINC000500862488 910135812 /nfs/dbraw/zinc/13/58/12/910135812.db2.gz YSMKDEURXZLJTI-FUHWJXTLSA-N 0 3 417.347 4.170 20 0 HIADHN O=C(NCCNCc1ccc(Cl)c(Cl)c1)c1cccc(Br)c1 ZINC000500871069 910142681 /nfs/dbraw/zinc/14/26/81/910142681.db2.gz QSBRRPAZBISNOW-UHFFFAOYSA-N 0 3 402.119 4.276 20 0 HIADHN CCc1nc(C(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)nn1-c1ccccc1Cl ZINC000500880324 910153977 /nfs/dbraw/zinc/15/39/77/910153977.db2.gz KNQHLDYZRSJLQM-AEFFLSMTSA-N 0 3 423.948 4.048 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(C)c1CN1CCC2(C[C@H]2C(=O)N2CCCCC2)CC1 ZINC000501133276 910313817 /nfs/dbraw/zinc/31/38/17/910313817.db2.gz OBHMCLBPNHQULU-QHCPKHFHSA-N 0 3 424.564 4.243 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)Nc2cccc(NC(=O)c3ccoc3)c2)C1 ZINC000501148263 910322001 /nfs/dbraw/zinc/32/20/01/910322001.db2.gz LSCJMZFSUCFLTK-JTSKRJEESA-N 0 3 418.497 4.489 20 0 HIADHN COc1ccc(CCC(=O)N2CCCN(CCSC3CCCCC3)CC2)cc1 ZINC000501163226 910334356 /nfs/dbraw/zinc/33/43/56/910334356.db2.gz LSGDFHATPBQCIY-UHFFFAOYSA-N 0 3 404.620 4.228 20 0 HIADHN COC(=O)c1cc(CN[C@H](Cc2ccccc2)c2ccccc2)cc(C(=O)OC)c1 ZINC000501216074 910379585 /nfs/dbraw/zinc/37/95/85/910379585.db2.gz FJFVGIFKEMPMPO-HSZRJFAPSA-N 0 3 403.478 4.333 20 0 HIADHN Cc1c(C(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)cnn1-c1ccc(Cl)cc1 ZINC000501228042 910387171 /nfs/dbraw/zinc/38/71/71/910387171.db2.gz OAYHANSAPRATNG-JXFKEZNVSA-N 0 3 408.933 4.399 20 0 HIADHN O=C(NCC1CCC(F)(F)CC1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000501235016 910392922 /nfs/dbraw/zinc/39/29/22/910392922.db2.gz MFHDKFCAQFSKOU-GOSISDBHSA-N 0 3 404.423 4.383 20 0 HIADHN CN(C)c1ncc(CN2CCC[C@H](c3nc(-c4ccc(Cl)cc4)no3)C2)s1 ZINC000513133001 921575555 /nfs/dbraw/zinc/57/55/55/921575555.db2.gz AYOGIUZKHFMHJD-AWEZNQCLSA-N 0 3 403.939 4.292 20 0 HIADHN CN1CCCN(C(=O)Nc2ccc(OCc3ccccc3)c(Br)c2)CC1 ZINC000501313076 910466162 /nfs/dbraw/zinc/46/61/62/910466162.db2.gz APVPLEIJKHWODB-UHFFFAOYSA-N 0 3 418.335 4.198 20 0 HIADHN Cc1cc(C)n(-c2ccc(C(=O)NC[C@@H](c3ccccc3)N3CCC(C)CC3)cn2)n1 ZINC000513137048 921578230 /nfs/dbraw/zinc/57/82/30/921578230.db2.gz GBJNBGXCIXZKEH-QHCPKHFHSA-N 0 3 417.557 4.087 20 0 HIADHN CC[C@@H](C)n1ncc2c1nc(C)cc2C(=O)N(Cc1ccco1)C1CCN(C)CC1 ZINC000501379953 910508989 /nfs/dbraw/zinc/50/89/89/910508989.db2.gz AQTAPAOKOXZGOB-QGZVFWFLSA-N 0 3 409.534 4.040 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N[C@H]1CCO[C@H]1c1ccc(Cl)c(F)c1)c1ccco1 ZINC000501585909 910691291 /nfs/dbraw/zinc/69/12/91/910691291.db2.gz RKIDPOQEJNYULA-NTCOEUGSSA-N 0 3 423.916 4.331 20 0 HIADHN CCc1ccc([C@H](CNC(=O)c2cccc(CSc3nccn3C)c2)N(C)C)cc1 ZINC000501689670 910759128 /nfs/dbraw/zinc/75/91/28/910759128.db2.gz PXUNOJSJPHVFLC-QFIPXVFZSA-N 0 3 422.598 4.308 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)C[C@@H](c1cccs1)n1cccc1 ZINC000501733710 910795720 /nfs/dbraw/zinc/79/57/20/910795720.db2.gz UITVEYPZSQMGTC-FQEVSTJZSA-N 0 3 417.525 4.398 20 0 HIADHN C[C@@H](Cc1cncc2ccccc21)C(=O)N(CCN(C)C)Cc1ccc(F)c(F)c1 ZINC000501740832 910801209 /nfs/dbraw/zinc/80/12/09/910801209.db2.gz GSYDZTOQUUHPII-KRWDZBQOSA-N 0 3 411.496 4.282 20 0 HIADHN CC(C)Cc1ccc(CCC(=O)Nc2ccccc2CN2CCC[C@H](C(N)=O)C2)cc1 ZINC000501758553 910815482 /nfs/dbraw/zinc/81/54/82/910815482.db2.gz ULNYRUGONNKFOS-QHCPKHFHSA-N 0 3 421.585 4.154 20 0 HIADHN CC(=O)c1cccc(O[C@H](C)C(=O)N[C@@H](CN2CCc3ccccc3C2)C(C)(C)C)c1 ZINC000501763548 910818573 /nfs/dbraw/zinc/81/85/73/910818573.db2.gz CDKKRZARCVCIMN-DVECYGJZSA-N 0 3 422.569 4.246 20 0 HIADHN COc1ccc(CN2CCC[C@H](c3n[nH]cc3NC(=O)c3ccccc3)C2)cc1C ZINC000501765201 910820079 /nfs/dbraw/zinc/82/00/79/910820079.db2.gz ANPMZOCZIIIGAR-FQEVSTJZSA-N 0 3 404.514 4.359 20 0 HIADHN CCN1CCN(Cc2ccc(CNC(=O)c3occc3-c3ccc(F)cc3)cc2)CC1 ZINC000501780995 910835964 /nfs/dbraw/zinc/83/59/64/910835964.db2.gz PFGQTNTZWGMZLC-UHFFFAOYSA-N 0 3 421.516 4.153 20 0 HIADHN CN(Cc1ccc(OC(F)F)cc1)C(=O)N[C@H](CN1CCCC1)c1ccccc1 ZINC000501783497 910837575 /nfs/dbraw/zinc/83/75/75/910837575.db2.gz XYLOPRAUFWEQKY-HXUWFJFHSA-N 0 3 403.473 4.267 20 0 HIADHN O=C(CN1CCC[C@@H]1Cc1ccccc1)N1CCC[C@H]1c1ccc2c(c1)OCCCO2 ZINC000501785896 910839529 /nfs/dbraw/zinc/83/95/29/910839529.db2.gz RFCUTFPFLPPLSZ-PKTZIBPZSA-N 0 3 420.553 4.219 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)N1CCC[C@@H]1c1ccc2c(c1)OCCO2 ZINC000501801623 910852016 /nfs/dbraw/zinc/85/20/16/910852016.db2.gz FVNOOBGJVCMZKG-FCHUYYIVSA-N 0 3 421.541 4.141 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)N(Cc1cccs1)C[C@H]1CCCO1 ZINC000501807091 910858390 /nfs/dbraw/zinc/85/83/90/910858390.db2.gz ZWSDGZXFCWTPQQ-IFMALSPDSA-N 0 3 413.587 4.276 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)N1CC=C(c2c[nH]c3ncccc23)CC1 ZINC000501809158 910860134 /nfs/dbraw/zinc/86/01/34/910860134.db2.gz HTRJRKVEBDUFQQ-HSZRJFAPSA-N 0 3 415.541 4.199 20 0 HIADHN CCSc1ccc(CC(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)cc1 ZINC000501874008 910897581 /nfs/dbraw/zinc/89/75/81/910897581.db2.gz PVVMIKMKWVDTLK-RTBURBONSA-N 0 3 404.620 4.079 20 0 HIADHN CCN(C(=O)c1nc(C)n(-c2ccc(F)cc2)n1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000501948598 910934288 /nfs/dbraw/zinc/93/42/88/910934288.db2.gz PZQXUBJJYUANEI-VGOFRKELSA-N 0 3 421.520 4.012 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)C[C@H](c2cccs2)n2cccc2)CC1 ZINC000502013138 910977679 /nfs/dbraw/zinc/97/76/79/910977679.db2.gz YTRKFJWDYSVHNA-GHTZIAJQSA-N 0 3 408.571 4.266 20 0 HIADHN Cc1c2cccc(C)c2oc1C(=O)NCCCCN1CCN(c2ccccc2)CC1 ZINC000502036186 910992437 /nfs/dbraw/zinc/99/24/37/910992437.db2.gz LZZXEQOCNPWEMM-UHFFFAOYSA-N 0 3 405.542 4.382 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Cc1csc(-c2cccnc2)n1)c1ccsc1 ZINC000513225285 921640784 /nfs/dbraw/zinc/64/07/84/921640784.db2.gz CBYGVECKKJGHNI-SFHVURJKSA-N 0 3 400.573 4.008 20 0 HIADHN C[C@H](c1ccccc1)N(C)C(=O)CNC(C)(C)COc1ccc(C(F)(F)F)cn1 ZINC000502267338 911216073 /nfs/dbraw/zinc/21/60/73/911216073.db2.gz IVISRODEUASUFV-OAHLLOKOSA-N 0 3 409.452 4.067 20 0 HIADHN C[C@H](NC(=O)NCC(C)(C)N1CCc2ccccc2C1)c1cccc(OC(F)F)c1 ZINC000502268422 911216574 /nfs/dbraw/zinc/21/65/74/911216574.db2.gz LUGYLRZCAPXAKD-INIZCTEOSA-N 0 3 417.500 4.485 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)c1cnn(-c2ccccc2)c1C1CC1 ZINC000513231167 921643554 /nfs/dbraw/zinc/64/35/54/921643554.db2.gz CCTPTHODOUZGLG-QFIPXVFZSA-N 0 3 400.526 4.144 20 0 HIADHN CCOc1cc(NC(=O)Nc2ccc(N3CCN(CC)CC3)cc2C)ccc1OC ZINC000502293171 911250832 /nfs/dbraw/zinc/25/08/32/911250832.db2.gz RRRVYCCDLUPQSH-UHFFFAOYSA-N 0 3 412.534 4.188 20 0 HIADHN Cn1cc(-c2ncc(CN3CCC(c4ccc(Br)cc4)CC3)cn2)cn1 ZINC000502298042 911255839 /nfs/dbraw/zinc/25/58/39/911255839.db2.gz CTZRDWDCJGVWPU-UHFFFAOYSA-N 0 3 412.335 4.019 20 0 HIADHN COc1ccccc1NC(=O)C[C@@H](C)N[C@H]1CCOc2c(Br)cccc21 ZINC000502301246 911260504 /nfs/dbraw/zinc/26/05/04/911260504.db2.gz ODSZNQVVMCWDNH-CJNGLKHVSA-N 0 3 419.319 4.288 20 0 HIADHN COc1ccccc1NC(=O)C[C@H](C)N[C@H]1CCOc2c(Br)cccc21 ZINC000502301245 911261038 /nfs/dbraw/zinc/26/10/38/911261038.db2.gz ODSZNQVVMCWDNH-BBRMVZONSA-N 0 3 419.319 4.288 20 0 HIADHN Cc1c(C(=O)NC[C@H]2CCCN2Cc2ccccc2)cnn1-c1cccc(Cl)c1 ZINC000513233943 921647220 /nfs/dbraw/zinc/64/72/20/921647220.db2.gz QCTPSBWGCWBWOC-OAQYLSRUSA-N 0 3 408.933 4.229 20 0 HIADHN CCC(=O)Nc1ccc(C)c(NC(=O)Nc2ccc(N3CCN(CC)CC3)cc2C)c1 ZINC000502306132 911269849 /nfs/dbraw/zinc/26/98/49/911269849.db2.gz VEXPLSNLGVCSOF-UHFFFAOYSA-N 0 3 423.561 4.438 20 0 HIADHN COc1cccc(NC(=O)C[C@@H](C)N[C@H]2CCOc3c(Br)cccc32)c1 ZINC000502320717 911294374 /nfs/dbraw/zinc/29/43/74/911294374.db2.gz VKDQAZHPRRRYQR-ACJLOTCBSA-N 0 3 419.319 4.288 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)c1ccc(Br)cc1F ZINC000502352939 911332358 /nfs/dbraw/zinc/33/23/58/911332358.db2.gz MOCSJKGQRWUHOU-UHFFFAOYSA-N 0 3 407.327 4.225 20 0 HIADHN CC(=O)Nc1c[nH]nc1[C@@H]1CCCN([C@H]2CCCc3ccc(Br)cc32)C1 ZINC000502356858 911338308 /nfs/dbraw/zinc/33/83/08/911338308.db2.gz CSWSOCPACQOSJX-BEFAXECRSA-N 0 3 417.351 4.388 20 0 HIADHN Cc1noc2nc(C3CC3)cc(C(=O)N(CCCc3ccccc3)CCN(C)C)c12 ZINC000502358627 911342657 /nfs/dbraw/zinc/34/26/57/911342657.db2.gz BHCNDQHCDOVYST-UHFFFAOYSA-N 0 3 406.530 4.045 20 0 HIADHN C[C@H](SCC(=O)NC[C@H]1CCCN1Cc1ccccc1)c1nc2ccccc2[nH]1 ZINC000513243399 921653915 /nfs/dbraw/zinc/65/39/15/921653915.db2.gz GUBOCXCCEOPDMO-PKOBYXMFSA-N 0 3 408.571 4.138 20 0 HIADHN Cc1c(Cl)cccc1NC(=O)NCCCN1CCN(C)C[C@H]1c1ccccc1 ZINC000502363762 911349238 /nfs/dbraw/zinc/34/92/38/911349238.db2.gz HCOAYNKNOXPIRG-NRFANRHFSA-N 0 3 400.954 4.149 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)c1cc2c(cccc2OC(F)F)[nH]1 ZINC000502376036 911362408 /nfs/dbraw/zinc/36/24/08/911362408.db2.gz SKIFKCMUGNMTDB-UHFFFAOYSA-N 0 3 415.484 4.406 20 0 HIADHN COc1ccc(OC)c(NC(=O)C[C@@H](C)N[C@H](C)c2ccccc2OC(F)F)c1 ZINC000502499164 911504302 /nfs/dbraw/zinc/50/43/02/911504302.db2.gz FOXZKFZAZAESEB-ZIAGYGMSSA-N 0 3 408.445 4.373 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cnc2onc(C)c2c1)c1ccc(C(F)(F)F)cc1 ZINC000502529506 911532589 /nfs/dbraw/zinc/53/25/89/911532589.db2.gz HHJPIKQXUOFMPU-SFHVURJKSA-N 0 3 420.435 4.363 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Cc1ccc(OC)cc1)c1ccc(C(F)(F)F)cc1 ZINC000502548960 911557332 /nfs/dbraw/zinc/55/73/32/911557332.db2.gz REOGYFZXBMNTMV-HXUWFJFHSA-N 0 3 408.464 4.456 20 0 HIADHN C[C@H](c1ccc(F)c(F)c1)N(C)C(=O)CN[C@@]1(Cc2ccc(Cl)cc2)CCOC1 ZINC000502553401 911561343 /nfs/dbraw/zinc/56/13/43/911561343.db2.gz SJNWJNLIODUZTR-IVZQSRNASA-N 0 3 422.903 4.129 20 0 HIADHN CC(C)S(=O)(=O)c1ccc(CN[C@]2(Cc3ccc(Cl)cc3)CCOC2)cc1 ZINC000502600308 911605987 /nfs/dbraw/zinc/60/59/87/911605987.db2.gz MWNUJDKITYWQCN-NRFANRHFSA-N 0 3 407.963 4.014 20 0 HIADHN C[C@H](NC(=O)NC[C@@H](c1ccccc1)N1CCCC1)c1ccc(NC(=O)C2CC2)cc1 ZINC000502650432 911691046 /nfs/dbraw/zinc/69/10/46/911691046.db2.gz OLLLMOWPYUAIGD-MBSDFSHPSA-N 0 3 420.557 4.232 20 0 HIADHN CSc1nc(-c2ccco2)nc(C)c1C(=O)NC[C@@H]1CCCN1Cc1ccccc1 ZINC000513285338 921684909 /nfs/dbraw/zinc/68/49/09/921684909.db2.gz XWZPTUYCJSSFCZ-SFHVURJKSA-N 0 3 422.554 4.161 20 0 HIADHN CCc1sc(C(=O)N(C)C[C@@H]2CCN(C)[C@H]2c2cccnc2)cc1Br ZINC000502716146 911747177 /nfs/dbraw/zinc/74/71/77/911747177.db2.gz MUZCHXVLDMXUHC-KSSFIOAISA-N 0 3 422.392 4.233 20 0 HIADHN Cc1nccn1CCCCN1CCN([C@H](C)c2ccc(Br)cc2)CC1 ZINC000502868770 911874125 /nfs/dbraw/zinc/87/41/25/911874125.db2.gz JVDRCOAWXVQTGK-QGZVFWFLSA-N 0 3 405.384 4.113 20 0 HIADHN Cc1ccc(COc2c(C)cc(CN(C)CC3CCS(=O)(=O)CC3)cc2C)cc1 ZINC000502880782 911881292 /nfs/dbraw/zinc/88/12/92/911881292.db2.gz MHGSARDMNORNIP-UHFFFAOYSA-N 0 3 415.599 4.447 20 0 HIADHN COc1ccc(S[C@H](C)C(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)cc1 ZINC000502882038 911882475 /nfs/dbraw/zinc/88/24/75/911882475.db2.gz TXPPLCZEXBKVTN-GOSISDBHSA-N 0 3 413.587 4.345 20 0 HIADHN Cc1cc(Br)oc1C(=O)Nc1cccc(N2CCN(C(C)C)CC2)c1 ZINC000502889350 911885632 /nfs/dbraw/zinc/88/56/32/911885632.db2.gz BXJAQLUEPBAURD-UHFFFAOYSA-N 0 3 406.324 4.133 20 0 HIADHN CN(C)Cc1ccccc1CNC(=O)COc1ccccc1OCc1ccccc1 ZINC000502930086 911917300 /nfs/dbraw/zinc/91/73/00/911917300.db2.gz HVUVZIPVGLGHQO-UHFFFAOYSA-N 0 3 404.510 4.022 20 0 HIADHN Cc1nc(CCN2CCC(C(=O)Nc3ccccc3Br)CC2)cs1 ZINC000503053943 912019550 /nfs/dbraw/zinc/01/95/50/912019550.db2.gz QQQQRRVFHCZFNX-UHFFFAOYSA-N 0 3 408.365 4.107 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)c1ccc([C@@H]2CCCOC2)cc1 ZINC000503061881 912025407 /nfs/dbraw/zinc/02/54/07/912025407.db2.gz VEEABQCUBIDFMF-HXUWFJFHSA-N 0 3 402.485 4.063 20 0 HIADHN COc1ccc(CN(C)C(=O)NC[C@H](c2ccc(CC(C)C)cc2)N(C)C)cc1O ZINC000513341465 921725810 /nfs/dbraw/zinc/72/58/10/921725810.db2.gz VMFRUTILQJPKOU-OAQYLSRUSA-N 0 3 413.562 4.044 20 0 HIADHN Cc1nc2cc(NC(=O)NCCCCN3CCN(c4cccc(C)c4)CC3)ccc2o1 ZINC000503220510 912202916 /nfs/dbraw/zinc/20/29/16/912202916.db2.gz YGPAVLWYEHXBRK-UHFFFAOYSA-N 0 3 421.545 4.169 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)Nc2cccc(Cl)c2-n2cccn2)C1 ZINC000506295818 914890572 /nfs/dbraw/zinc/89/05/72/914890572.db2.gz UQFGBGVLMQMYIB-WMZOPIPTSA-N 0 3 409.921 4.483 20 0 HIADHN CCN(CC)C(=O)c1cccc(NC(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)c1 ZINC000506295239 914890589 /nfs/dbraw/zinc/89/05/89/914890589.db2.gz PGNJLWPGRMXGQY-XMSQKQJNSA-N 0 3 408.546 4.126 20 0 HIADHN Cc1ccc(-n2cc(CN3CCC(C(=O)N4CCCC4)CC3)c(C(C)(C)C)n2)cc1 ZINC000506313229 914904643 /nfs/dbraw/zinc/90/46/43/914904643.db2.gz UOKVHSRZRSCJLV-UHFFFAOYSA-N 0 3 408.590 4.313 20 0 HIADHN CN(CCOc1ccc(Br)cc1)C(=O)c1cccc(CN2CCCC2)c1 ZINC000513354882 921734248 /nfs/dbraw/zinc/73/42/48/921734248.db2.gz BXMZMWXOWQZLFJ-UHFFFAOYSA-N 0 3 417.347 4.196 20 0 HIADHN CC(C)Cc1ccc([C@@H](CNC(=O)N2CCC[C@H]2C2CCOCC2)N(C)C)cc1 ZINC000513357355 921735248 /nfs/dbraw/zinc/73/52/48/921735248.db2.gz MJUHQFDECBOCEA-XZOQPEGZSA-N 0 3 401.595 4.088 20 0 HIADHN COc1cc(CN2CCC(CO)CC2)ccc1OCc1ccc(Br)cc1 ZINC000506367101 914990133 /nfs/dbraw/zinc/99/01/33/914990133.db2.gz CWDPCIZMVVDTCQ-UHFFFAOYSA-N 0 3 420.347 4.241 20 0 HIADHN CN(C)CCN(CC1CCCCC1)C(=O)C1CCC(NC(=O)CC2CCCC2)CC1 ZINC000513364200 921739608 /nfs/dbraw/zinc/73/96/08/921739608.db2.gz HASRWBPGGPWBJI-UHFFFAOYSA-N 0 3 419.654 4.212 20 0 HIADHN O=C(CCN1CCCN(c2ccccc2F)CC1)Nc1ccccc1Br ZINC000513370102 921743269 /nfs/dbraw/zinc/74/32/69/921743269.db2.gz GSGQRWOMPGRSPK-UHFFFAOYSA-N 0 3 420.326 4.129 20 0 HIADHN CCc1c(C(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)cnn1Cc1ccccc1 ZINC000513375361 921748726 /nfs/dbraw/zinc/74/87/26/921748726.db2.gz BJBPIBSBCJRDMD-SIKLNZKXSA-N 0 3 402.542 4.059 20 0 HIADHN COc1ccc(Br)c(NC(=O)NC[C@H](c2ccc(C)cc2)N(C)C)c1 ZINC000506529093 915171687 /nfs/dbraw/zinc/17/16/87/915171687.db2.gz GGFSRLXUZNOTSV-GOSISDBHSA-N 0 3 406.324 4.191 20 0 HIADHN CCN1CCN([C@H]2CCN([C@H](C)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)C2)CC1 ZINC000506568221 915214766 /nfs/dbraw/zinc/21/47/66/915214766.db2.gz WRFZLMNEXLSYCP-KDOFPFPSSA-N 0 3 423.445 4.497 20 0 HIADHN CCN1CCN([C@H]2CCN([C@@H](C)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)C2)CC1 ZINC000506568222 915215313 /nfs/dbraw/zinc/21/53/13/915215313.db2.gz WRFZLMNEXLSYCP-KSSFIOAISA-N 0 3 423.445 4.497 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)CCN1CCC(c2noc(C(C)C)n2)CC1 ZINC000506591342 915241328 /nfs/dbraw/zinc/24/13/28/915241328.db2.gz AULWQBVGURZCIG-UHFFFAOYSA-N 0 3 406.914 4.063 20 0 HIADHN CC[C@@H](N[C@H](C)C(=O)NC(=O)Nc1ccc(C)cc1C)c1ccc(OC)c(OC)c1 ZINC000506600797 915252111 /nfs/dbraw/zinc/25/21/11/915252111.db2.gz HJZJBCHNZOLPIX-SJLPKXTDSA-N 0 3 413.518 4.098 20 0 HIADHN COc1ccccc1O[C@H]1CCCN(CCc2nc(-c3cccc(Cl)c3)no2)C1 ZINC000513396213 921765138 /nfs/dbraw/zinc/76/51/38/921765138.db2.gz COCCAHCENSBLDY-SFHVURJKSA-N 0 3 413.905 4.485 20 0 HIADHN CC(C)COc1ccc(CN2CCC(C(=O)Nc3ccc4c(c3)OCO4)CC2)cc1 ZINC000506722511 915404782 /nfs/dbraw/zinc/40/47/82/915404782.db2.gz WJOKUPIXRPNDKY-UHFFFAOYSA-N 0 3 410.514 4.301 20 0 HIADHN O=C(CN1CCN(C[C@H]2CC=CCC2)CC1)Nc1ccc(Cl)c(C(F)(F)F)c1 ZINC000506748674 915439061 /nfs/dbraw/zinc/43/90/61/915439061.db2.gz UZJUXONDOACXQU-HNNXBMFYSA-N 0 3 415.887 4.271 20 0 HIADHN C[C@@H](NCC(=O)N1CCc2sccc2[C@H]1c1ccccc1)c1ccc2n[nH]cc2c1 ZINC000513410816 921778745 /nfs/dbraw/zinc/77/87/45/921778745.db2.gz HIOBFPCKAICBAZ-VOIUYBSRSA-N 0 3 416.550 4.449 20 0 HIADHN CCN(Cc1ccc(Cl)cc1)Cc1ccc(OCC(=O)N2CCCC2)c(OC)c1 ZINC000507132719 915882965 /nfs/dbraw/zinc/88/29/65/915882965.db2.gz VJERDWUZKIJOSV-UHFFFAOYSA-N 0 3 416.949 4.372 20 0 HIADHN Cc1ccc(CNC(=O)C2CCN(Cc3c[nH]nc3-c3cccs3)CC2)cc1F ZINC000507136540 915883842 /nfs/dbraw/zinc/88/38/42/915883842.db2.gz YYPHATUPRFVKAN-UHFFFAOYSA-N 0 3 412.534 4.114 20 0 HIADHN COc1ccc2oc(CN3CCC(C(=O)NCc4ccc(C)c(F)c4)CC3)cc2c1 ZINC000507186295 915934845 /nfs/dbraw/zinc/93/48/45/915934845.db2.gz CSWUWZQETRIPNO-UHFFFAOYSA-N 0 3 410.489 4.417 20 0 HIADHN CN(CCCCCc1cc(-c2ccccc2)no1)Cc1cc(=O)n2ccsc2n1 ZINC000507229214 915983964 /nfs/dbraw/zinc/98/39/64/915983964.db2.gz HUIKSGIMGRLIMP-UHFFFAOYSA-N 0 3 408.527 4.256 20 0 HIADHN COc1ccc2cc(CN(C)C(=O)[C@@H](C)N[C@H](C)c3ccc4n[nH]cc4c3)ccc2c1 ZINC000507268315 916032049 /nfs/dbraw/zinc/03/20/49/916032049.db2.gz QGSFWDRTHFXOOI-IAGOWNOFSA-N 0 3 416.525 4.422 20 0 HIADHN COc1ccc(NC(=O)[C@H](NC[C@H]2CCOC[C@@H]2C)c2ccccc2)cc1Cl ZINC000507269285 916032547 /nfs/dbraw/zinc/03/25/47/916032547.db2.gz WXPMNJRCMWPMPQ-LUQKVYGDSA-N 0 3 402.922 4.291 20 0 HIADHN CCOC(=O)CC1CCN(Cc2c(C)nn(Cc3ccccc3Cl)c2C)CC1 ZINC000507310461 916072410 /nfs/dbraw/zinc/07/24/10/916072410.db2.gz UMKFSVMBCJLLPN-UHFFFAOYSA-N 0 3 403.954 4.367 20 0 HIADHN COCCSc1ccc([C@@H](C)N[C@@H](C)C(=O)Nc2cccc(NC(C)=O)c2)cc1 ZINC000507451858 916221390 /nfs/dbraw/zinc/22/13/90/916221390.db2.gz SBGRLLRJQBWTTH-CVEARBPZSA-N 0 3 415.559 4.061 20 0 HIADHN COCCSc1ccc([C@@H](C)N[C@H](C)C(=O)N2CCc3sccc3C2)cc1 ZINC000507458346 916225127 /nfs/dbraw/zinc/22/51/27/916225127.db2.gz FYINJPHIFYRBLZ-HZPDHXFCSA-N 0 3 404.601 4.111 20 0 HIADHN COCCSc1ccc([C@H](C)N[C@@H](C)C(=O)N2CCc3sccc3C2)cc1 ZINC000507458344 916226359 /nfs/dbraw/zinc/22/63/59/916226359.db2.gz FYINJPHIFYRBLZ-HOTGVXAUSA-N 0 3 404.601 4.111 20 0 HIADHN CC(C)(c1ccccc1)c1ccc(OC[C@@H](O)CN2CCC(c3cn[nH]c3)CC2)cc1 ZINC000507461893 916227558 /nfs/dbraw/zinc/22/75/58/916227558.db2.gz NGYMTCDDRLQPKV-DEOSSOPVSA-N 0 3 419.569 4.355 20 0 HIADHN CCc1c(C(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)cnn1-c1ccc(F)cc1 ZINC000507598856 916353002 /nfs/dbraw/zinc/35/30/02/916353002.db2.gz ITUNRCVKEJECGT-XLIONFOSSA-N 0 3 406.505 4.139 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(C)c1CC(=O)N[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000507603010 916357914 /nfs/dbraw/zinc/35/79/14/916357914.db2.gz QUEWCEGWARHZHG-GCJKJVERSA-N 0 3 420.532 4.122 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)C[C@H]3CCO[C@@H](CC)C3)c(OCC)c2)CC1 ZINC000507605554 916363403 /nfs/dbraw/zinc/36/34/03/916363403.db2.gz YKXXDLXHTYGKAS-FPOVZHCZSA-N 0 3 417.594 4.151 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3cc(C(C)(C)C)on3)c(OCC)c2)CC1 ZINC000507611070 916370870 /nfs/dbraw/zinc/37/08/70/916370870.db2.gz NLDWACPMQTUAST-UHFFFAOYSA-N 0 3 414.550 4.155 20 0 HIADHN O=C(Nc1ccc(Cn2cccn2)cc1)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000507652014 916414227 /nfs/dbraw/zinc/41/42/27/916414227.db2.gz VZWHXNBPFXAKPU-NRFANRHFSA-N 0 3 410.468 4.027 20 0 HIADHN C[C@@H](NC(=O)[C@H](C)N(C)CCCc1cc(-c2ccccc2)n[nH]1)c1ccc(F)cc1 ZINC000507669101 916436290 /nfs/dbraw/zinc/43/62/90/916436290.db2.gz NISSTLMLURIJIY-MSOLQXFVSA-N 0 3 408.521 4.346 20 0 HIADHN COc1ccc2nc(C3CC3)cc(C(=O)N3C[C@@H](N(C)C)Cc4ccccc43)c2c1 ZINC000507703213 916487708 /nfs/dbraw/zinc/48/77/08/916487708.db2.gz BJHSYHLUJXLFHU-SFHVURJKSA-N 0 3 401.510 4.254 20 0 HIADHN COc1ccc(-c2n[nH]cc2CN2CC=C(c3ccc4c(c3)OCCO4)CC2)cc1 ZINC000507713974 916506470 /nfs/dbraw/zinc/50/64/70/916506470.db2.gz NAZFMOTXIJEKLV-UHFFFAOYSA-N 0 3 403.482 4.146 20 0 HIADHN CC(C)(C(=O)NC[C@@H]1CCCCN1C1CC1)c1csc(-c2ccccc2F)n1 ZINC000507759855 916547210 /nfs/dbraw/zinc/54/72/10/916547210.db2.gz RJHHRENXFGRLOI-INIZCTEOSA-N 0 3 401.551 4.360 20 0 HIADHN CC(C)c1ccccc1OC[C@H](O)CN1CCC(C(=O)Nc2cccc(F)c2)CC1 ZINC000507773173 916559007 /nfs/dbraw/zinc/55/90/07/916559007.db2.gz RJSMTCDBTIENNB-OAQYLSRUSA-N 0 3 414.521 4.040 20 0 HIADHN CC(C)[C@H](CN[C@H](c1nccn1C)c1cccc(F)c1)N1CCc2ccccc2C1 ZINC000507812983 916606429 /nfs/dbraw/zinc/60/64/29/916606429.db2.gz IXQJOKOSBRDASH-ZEQRLZLVSA-N 0 3 406.549 4.321 20 0 HIADHN COc1cc(CN[C@@H]2CC(=O)N(C)[C@H]2c2ccc(Cl)cc2)ccc1OC(F)F ZINC000507834476 916637762 /nfs/dbraw/zinc/63/77/62/916637762.db2.gz RJCJKTBXUKIADA-BEFAXECRSA-N 0 3 410.848 4.012 20 0 HIADHN Cn1cc(CNCc2ccccc2-c2ccc(Cn3cncn3)cc2)c(C(C)(C)C)n1 ZINC000507844204 916657317 /nfs/dbraw/zinc/65/73/17/916657317.db2.gz HRYFVOLBDKESQN-UHFFFAOYSA-N 0 3 414.557 4.314 20 0 HIADHN COc1ccc(CN[C@@H]2CC(=O)N(C)[C@H]2c2ccc(Cl)cc2)cc1OC(F)F ZINC000507859106 916690973 /nfs/dbraw/zinc/69/09/73/916690973.db2.gz IGYCRURIBFIGHS-BEFAXECRSA-N 0 3 410.848 4.012 20 0 HIADHN COc1ccc(CN[C@@H]2CC(=O)N(C)[C@@H]2c2ccc(Cl)cc2)cc1OC(F)F ZINC000507859108 916691955 /nfs/dbraw/zinc/69/19/55/916691955.db2.gz IGYCRURIBFIGHS-DNVCBOLYSA-N 0 3 410.848 4.012 20 0 HIADHN Cc1cccc(NC(=O)[C@H]2CCCN(Cc3ccccc3OCC(F)(F)F)C2)n1 ZINC000508002088 916842816 /nfs/dbraw/zinc/84/28/16/916842816.db2.gz XWLNDPIVCXUXRV-KRWDZBQOSA-N 0 3 407.436 4.182 20 0 HIADHN Cc1cccc(NC(=O)[C@@H]2CCCN(Cc3ccc(-c4ccncc4)cc3F)C2)n1 ZINC000508038182 916867974 /nfs/dbraw/zinc/86/79/74/916867974.db2.gz BSSBBWXQTPTWIW-OAQYLSRUSA-N 0 3 404.489 4.442 20 0 HIADHN O=C(Cc1c(Cl)cccc1Cl)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000508068071 916890579 /nfs/dbraw/zinc/89/05/79/916890579.db2.gz COSGNMMQAUEBOE-UHFFFAOYSA-N 0 3 407.341 4.379 20 0 HIADHN O=C(Cc1cccc(C(F)(F)F)c1)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000508072599 916893266 /nfs/dbraw/zinc/89/32/66/916893266.db2.gz RYZQJWHCEAYFLZ-UHFFFAOYSA-N 0 3 406.448 4.091 20 0 HIADHN COCc1c(Br)cccc1NC(=O)NC[C@H](c1ccccc1)N(C)C ZINC000508176851 916996292 /nfs/dbraw/zinc/99/62/92/916996292.db2.gz MSDHSQKNEBATAE-GOSISDBHSA-N 0 3 406.324 4.020 20 0 HIADHN COc1cccc(NC(=O)C[C@@H](C)NCc2cc(Cl)c3c(c2)OCCCO3)c1 ZINC000508341480 917143985 /nfs/dbraw/zinc/14/39/85/917143985.db2.gz HGNYXYJANMPTDB-CQSZACIVSA-N 0 3 404.894 4.017 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N2CCO[C@@H](c3ccccc3Cl)C2)N(C)C)cc1 ZINC000508391261 917186533 /nfs/dbraw/zinc/18/65/33/917186533.db2.gz JSCVDABFUTYRDG-NHCUHLMSSA-N 0 3 401.938 4.034 20 0 HIADHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)[C@@H]1CC[C@H](C(F)(F)F)C1 ZINC000508535383 917315506 /nfs/dbraw/zinc/31/55/06/917315506.db2.gz SSJVTLPGYVTYLJ-CABCVRRESA-N 0 3 421.301 4.318 20 0 HIADHN CC(C)n1c2ccccc2nc1[C@@H]1CCCN(Cc2ccc3c(c2)NC(=O)CO3)C1 ZINC000508558654 917333459 /nfs/dbraw/zinc/33/34/59/917333459.db2.gz BPZPPGCXMSWMKQ-GOSISDBHSA-N 0 3 404.514 4.328 20 0 HIADHN O=C(NCCc1ccc2ccccc2n1)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000508563414 917337854 /nfs/dbraw/zinc/33/78/54/917337854.db2.gz KLEPXFBAQQFRHK-OAQYLSRUSA-N 0 3 409.480 4.051 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)NCCCc1c[nH]c2ccc(F)cc12 ZINC000508627250 917393681 /nfs/dbraw/zinc/39/36/81/917393681.db2.gz DPFPWELWYVLUQF-UHFFFAOYSA-N 0 3 414.500 4.152 20 0 HIADHN CC[C@H](C)NC(=O)[C@@H]1C[C@H](C)N(CC(=O)Nc2cc(C)ccc2C)[C@H]2CCCC[C@H]12 ZINC000508651437 917418177 /nfs/dbraw/zinc/41/81/77/917418177.db2.gz AIPRYORVGIQEPS-YDLBFBONSA-N 0 3 413.606 4.426 20 0 HIADHN CCc1ccccc1NC(=O)CN1[C@H](C)C[C@H](C(=O)N[C@H](C)CC)[C@@H]2CCCC[C@@H]21 ZINC000508657489 917423345 /nfs/dbraw/zinc/42/33/45/917423345.db2.gz SHHNAXFQAGOFGE-HIMYBIGCSA-N 0 3 413.606 4.371 20 0 HIADHN COC(=O)[C@@H]1CCN(Cc2cccc(NC(=O)c3ccc(Cl)cc3Cl)c2)C1 ZINC000508664526 917430706 /nfs/dbraw/zinc/43/07/06/917430706.db2.gz JXOHAFLMDKGBFB-CQSZACIVSA-N 0 3 407.297 4.241 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3nn(-c4ccc(Cl)cc4)cc3C)cc2)CC1 ZINC000508681536 917445891 /nfs/dbraw/zinc/44/58/91/917445891.db2.gz SYNACQATGHEEJU-UHFFFAOYSA-N 0 3 423.948 4.228 20 0 HIADHN Brc1ccc2c(c1)[C@@H](NCc1ccccc1Cn1cncn1)CCCO2 ZINC000508722863 917484947 /nfs/dbraw/zinc/48/49/47/917484947.db2.gz GDCXZLHGIUPZHL-IBGZPJMESA-N 0 3 413.319 4.092 20 0 HIADHN CC[C@H](NCc1ccccc1Cn1cncn1)c1cc(F)cc(Br)c1 ZINC000508739392 917498283 /nfs/dbraw/zinc/49/82/83/917498283.db2.gz JZUKYQDAVNWARE-IBGZPJMESA-N 0 3 403.299 4.469 20 0 HIADHN CCC[C@H]1CN(c2nnc(COCc3ccccc3)n2C)CCN1Cc1ccccc1 ZINC000508747980 917506972 /nfs/dbraw/zinc/50/69/72/917506972.db2.gz MBVUUDVSEIYPDG-QHCPKHFHSA-N 0 3 419.573 4.023 20 0 HIADHN C[C@H](NC(=O)Nc1ccccc1OC[C@H]1CCCCO1)[C@H](c1ccccc1)N(C)C ZINC000508853426 917605669 /nfs/dbraw/zinc/60/56/69/917605669.db2.gz RBTATUVYYUEMLH-JXHRLWIKSA-N 0 3 411.546 4.447 20 0 HIADHN CCc1nc2c(s1)[C@H](N(C)C(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C)CCC2 ZINC000508852169 917606403 /nfs/dbraw/zinc/60/64/03/917606403.db2.gz JEPNRFZCMIPRHN-QKYXUNIQSA-N 0 3 400.592 4.416 20 0 HIADHN Cc1nc2ccccc2n1C1CCN(C(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)CC1 ZINC000508891788 917646068 /nfs/dbraw/zinc/64/60/68/917646068.db2.gz CDPIYCHXRVBDHU-HOYKHHGWSA-N 0 3 419.573 4.383 20 0 HIADHN COc1ccccc1NC(=O)C1CCN(Cc2ccc(OC[C@H]3CCCO3)cc2)CC1 ZINC000508892982 917647636 /nfs/dbraw/zinc/64/76/36/917647636.db2.gz HQDUKSHIVGVIQJ-JOCHJYFZSA-N 0 3 424.541 4.104 20 0 HIADHN COc1cc(CN(C)C(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)ccc1SC ZINC000508907778 917665715 /nfs/dbraw/zinc/66/57/15/917665715.db2.gz QZTJXTYHNAZMMO-IIBYNOLFSA-N 0 3 401.576 4.250 20 0 HIADHN COc1ccc(NC(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)cc1N1CCCCC1=O ZINC000508925660 917684384 /nfs/dbraw/zinc/68/43/84/917684384.db2.gz SWBCOUVRDUOBEO-SBUREZEXSA-N 0 3 424.545 4.025 20 0 HIADHN COCCOc1cccc(NC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)c1 ZINC000508942518 917698755 /nfs/dbraw/zinc/69/87/55/917698755.db2.gz RAWDEIQUTNKFNQ-NRFANRHFSA-N 0 3 422.447 4.105 20 0 HIADHN CC(C)COC1CCN(C(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)CC1 ZINC000508982394 917737144 /nfs/dbraw/zinc/73/71/44/917737144.db2.gz RTAUHWDMGKJPQB-OAQYLSRUSA-N 0 3 412.496 4.105 20 0 HIADHN CCOc1ccc(CNC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)cc1 ZINC000509004098 917759347 /nfs/dbraw/zinc/75/93/47/917759347.db2.gz FAIHXUWEKBZVJO-NRFANRHFSA-N 0 3 406.448 4.156 20 0 HIADHN CCCN(C)[C@H](CNC(=O)N1CCCC[C@@H]1c1ccnn1C)c1ccc(Cl)cc1 ZINC000509025004 917778958 /nfs/dbraw/zinc/77/89/58/917778958.db2.gz SOOUAPNCMOKCDJ-NHCUHLMSSA-N 0 3 417.985 4.393 20 0 HIADHN COc1c(C)cnc(CN2CCC(N(C)Cc3nc4cc(F)ccc4o3)CC2)c1C ZINC000509072763 917818097 /nfs/dbraw/zinc/81/80/97/917818097.db2.gz VWWHFUFGADVHPH-UHFFFAOYSA-N 0 3 412.509 4.084 20 0 HIADHN COc1ccc(OC)c(-c2nn(-c3ccccc3)cc2CN2CCC[C@@H](OC)C2)c1 ZINC000509157360 917875435 /nfs/dbraw/zinc/87/54/35/917875435.db2.gz YYTABTSDXKCMJV-OAQYLSRUSA-N 0 3 407.514 4.167 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)Cc1ccc(O)cc1Cl ZINC000509275620 917962434 /nfs/dbraw/zinc/96/24/34/917962434.db2.gz UHZNMMIONDVGEU-LJQANCHMSA-N 0 3 424.932 4.179 20 0 HIADHN CCN(C(=O)c1nn(-c2ccc(F)cc2)cc1C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000509314605 917990928 /nfs/dbraw/zinc/99/09/28/917990928.db2.gz QFPOQEGOMMNEPE-JOCHJYFZSA-N 0 3 406.505 4.056 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)N1CCO[C@H](c2ccccc2Cl)C1 ZINC000509348398 918014672 /nfs/dbraw/zinc/01/46/72/918014672.db2.gz OPEVVDGRIYKVLE-YADHBBJMSA-N 0 3 413.949 4.260 20 0 HIADHN CSc1cccc(F)c1CNC(=O)N(CCN(C)C)Cc1ccc(F)c(F)c1 ZINC000509350901 918016715 /nfs/dbraw/zinc/01/67/15/918016715.db2.gz OCJVAOIXWSQJQG-UHFFFAOYSA-N 0 3 411.493 4.099 20 0 HIADHN CCCOc1cc(CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)ccc1OC ZINC000509356358 918020702 /nfs/dbraw/zinc/02/07/02/918020702.db2.gz GXKNKGABVDBHDC-UHFFFAOYSA-N 0 3 417.937 4.383 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CN1CCC[C@H](C(=O)Nc2ccc(Cl)cn2)C1 ZINC000509369269 918034235 /nfs/dbraw/zinc/03/42/35/918034235.db2.gz CAXWIFRRBYHAGO-SFHVURJKSA-N 0 3 423.948 4.388 20 0 HIADHN O=C(Nc1ccc(Cl)cn1)[C@H]1CCCN(Cc2ccc(Oc3cnccn3)cc2)C1 ZINC000509392680 918058172 /nfs/dbraw/zinc/05/81/72/918058172.db2.gz KTFFCAMGUXZTMQ-KRWDZBQOSA-N 0 3 423.904 4.168 20 0 HIADHN Brc1ccc(-c2ccc(CNCCc3nnnn3-c3ccccc3)o2)cc1 ZINC000509428405 918088283 /nfs/dbraw/zinc/08/82/83/918088283.db2.gz FRLIKBNBIQQHRW-UHFFFAOYSA-N 0 3 424.302 4.017 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N1CCC[C@H]1c1ccc(OC)cc1OC)c1ccco1 ZINC000509551218 918200954 /nfs/dbraw/zinc/20/09/54/918200954.db2.gz ALVTUEAWPBYTGW-DBVUQKKJSA-N 0 3 415.534 4.273 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)N1CCC(n2c(C)nc3ccccc32)CC1)c1ccco1 ZINC000509565936 918215699 /nfs/dbraw/zinc/21/56/99/918215699.db2.gz BZAKKNBSFUEJBJ-UTKZUKDTSA-N 0 3 423.561 4.414 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N1CCC[C@@H]1c1nc2cc(C)ccc2[nH]1)c1ccco1 ZINC000509582953 918231103 /nfs/dbraw/zinc/23/11/03/918231103.db2.gz IYOMDPZQLLCLEN-FFZOFVMBSA-N 0 3 409.534 4.440 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N1CCC[C@@H]1c1nc2ccc(C)cc2[nH]1)c1ccco1 ZINC000509582953 918231122 /nfs/dbraw/zinc/23/11/22/918231122.db2.gz IYOMDPZQLLCLEN-FFZOFVMBSA-N 0 3 409.534 4.440 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N1CCC[C@H]1c1nc2cc(C)ccc2[nH]1)c1ccco1 ZINC000509582951 918232438 /nfs/dbraw/zinc/23/24/38/918232438.db2.gz IYOMDPZQLLCLEN-DBVUQKKJSA-N 0 3 409.534 4.440 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N1CCC[C@H]1c1nc2ccc(C)cc2[nH]1)c1ccco1 ZINC000509582951 918232451 /nfs/dbraw/zinc/23/24/51/918232451.db2.gz IYOMDPZQLLCLEN-DBVUQKKJSA-N 0 3 409.534 4.440 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N(C)Cc1ccc(SC)c(OC)c1)c1ccco1 ZINC000509593224 918242923 /nfs/dbraw/zinc/24/29/23/918242923.db2.gz CRGOERUUMJYHJQ-DOTOQJQBSA-N 0 3 405.564 4.281 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)N1CC=C(c2c(F)cccc2F)CC1)c1ccco1 ZINC000509594827 918244351 /nfs/dbraw/zinc/24/43/51/918244351.db2.gz FXXWEZFYEOCXJP-BEFAXECRSA-N 0 3 403.473 4.486 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N1CCC(OCCc2ccccc2)CC1)c1ccco1 ZINC000509595673 918246552 /nfs/dbraw/zinc/24/65/52/918246552.db2.gz ISIBRLWACDEUOO-SIKLNZKXSA-N 0 3 413.562 4.142 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)N(C)Cc1ccccc1OC(F)(F)F)c1ccco1 ZINC000509597716 918248011 /nfs/dbraw/zinc/24/80/11/918248011.db2.gz ALXDUFDKMFLAIV-GDBMZVCRSA-N 0 3 413.440 4.449 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N1CCO[C@@H](c2cccc(Cl)c2)C1)c1ccco1 ZINC000509603839 918254293 /nfs/dbraw/zinc/25/42/93/918254293.db2.gz RXWRCUVVGIJJEE-ZAAXVRCTSA-N 0 3 405.926 4.145 20 0 HIADHN Fc1ccc([C@@H](CNCc2ccc(Sc3ccccn3)o2)N2CCOCC2)cc1 ZINC000509656878 918291818 /nfs/dbraw/zinc/29/18/18/918291818.db2.gz YUXULSRHCGQSLT-HXUWFJFHSA-N 0 3 413.518 4.128 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CCO[C@]2(CCc3ccccc32)C1)c1ccsc1 ZINC000509791057 918398857 /nfs/dbraw/zinc/39/88/57/918398857.db2.gz RWWTXIFAHJPDHU-JTHBVZDNSA-N 0 3 413.587 4.015 20 0 HIADHN COc1ccc(-c2ccncc2)cc1CN[C@H]1CCCN(C(=O)Cc2ccccc2)C1 ZINC000509950295 918546207 /nfs/dbraw/zinc/54/62/07/918546207.db2.gz WWOLRVIOUCMSMT-DEOSSOPVSA-N 0 3 415.537 4.081 20 0 HIADHN Cc1ccc(-c2ncc(CN[C@@H]3CCCN(C(=O)Cc4ccccc4)C3)s2)cc1 ZINC000509977436 918566664 /nfs/dbraw/zinc/56/66/64/918566664.db2.gz NYNYESRNLLVMLH-OAQYLSRUSA-N 0 3 405.567 4.442 20 0 HIADHN Cc1cccc(C)c1NC(=O)CNC(=O)[C@H](C)N1CCC[C@](C)(c2ccccc2)CC1 ZINC000510077125 918645570 /nfs/dbraw/zinc/64/55/70/918645570.db2.gz AYFHESBYAHOKMM-LVXARBLLSA-N 0 3 421.585 4.190 20 0 HIADHN Cc1ccc(NC(=O)N(CCN(C)C)Cc2ccc(Br)cc2)c(F)c1 ZINC000510354164 918848930 /nfs/dbraw/zinc/84/89/30/918848930.db2.gz ZNAXAWSEYCLRTQ-UHFFFAOYSA-N 0 3 408.315 4.492 20 0 HIADHN c1[nH]nc(-c2ccc3c(c2)OCO3)c1CN1CCC(OCCc2ccccc2)CC1 ZINC000510355055 918849016 /nfs/dbraw/zinc/84/90/16/918849016.db2.gz NFCPTUSNMQSDPP-UHFFFAOYSA-N 0 3 405.498 4.029 20 0 HIADHN C[C@H](c1ncc(-c2ccc(Cl)cc2Cl)o1)N1CCN(C[C@H]2CCOC2)CC1 ZINC000510374502 918860711 /nfs/dbraw/zinc/86/07/11/918860711.db2.gz GUZLPBQJDJCKAQ-HUUCEWRRSA-N 0 3 410.345 4.364 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N3CCC[C@@H]3c3nc4ccccc4s3)cc2)CC1 ZINC000510382672 918864592 /nfs/dbraw/zinc/86/45/92/918864592.db2.gz RAVPWTIRDJQKQW-OAQYLSRUSA-N 0 3 420.582 4.416 20 0 HIADHN Cc1noc(C2(C)CCN(C[C@H](O)COc3cc(C)c(Cl)cc3C(C)C)CC2)n1 ZINC000510425393 918889609 /nfs/dbraw/zinc/88/96/09/918889609.db2.gz NSZZCNDFWNKKIH-KRWDZBQOSA-N 0 3 421.969 4.257 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)Nc1ccc(Cl)c(C(=O)NC2CC2)c1 ZINC000510457125 918912367 /nfs/dbraw/zinc/91/23/67/918912367.db2.gz PWMKEMSJRVJXJP-UHFFFAOYSA-N 0 3 411.889 4.292 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)NCCOc1cccc(C(F)(F)F)c1 ZINC000510469196 918924521 /nfs/dbraw/zinc/92/45/21/918924521.db2.gz CULCNSSNSHLOJM-UHFFFAOYSA-N 0 3 406.404 4.322 20 0 HIADHN Cc1nn(Cc2ccc(C)cc2)c(C)c1CN1CCC(CC(=O)N2CCCC2)CC1 ZINC000510487922 918937933 /nfs/dbraw/zinc/93/79/33/918937933.db2.gz ICLRCCYGSQEISH-UHFFFAOYSA-N 0 3 408.590 4.081 20 0 HIADHN Cc1ccc(NC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)c(OCC(F)(F)F)c1 ZINC000510536692 918981765 /nfs/dbraw/zinc/98/17/65/918981765.db2.gz YUZFOFYDBFNZMC-QGZVFWFLSA-N 0 3 407.436 4.332 20 0 HIADHN CCCOc1ccccc1Oc1ncccc1CNC(=O)N[C@H](C)C1=CCN(C)CC1 ZINC000510541185 918985074 /nfs/dbraw/zinc/98/50/74/918985074.db2.gz RBZZNNZKAIKKSU-GOSISDBHSA-N 0 3 424.545 4.112 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)N[C@@H](c1nccs1)c1ccccc1 ZINC000510561482 919004484 /nfs/dbraw/zinc/00/44/84/919004484.db2.gz WKLBBFVGBNWLJX-HXUWFJFHSA-N 0 3 412.534 4.145 20 0 HIADHN CC[C@@H](CNC(=O)Nc1ccc(C(=O)NCC(C)C)cc1)N1CCc2ccccc2C1 ZINC000510650937 919092866 /nfs/dbraw/zinc/09/28/66/919092866.db2.gz KUTBJCACXXDGMF-QHCPKHFHSA-N 0 3 422.573 4.031 20 0 HIADHN COc1cc(CN2CCC[C@H](c3ccnn3C)C2)cc(OC)c1OCc1ccccc1 ZINC000510656426 919097992 /nfs/dbraw/zinc/09/79/92/919097992.db2.gz FANFWTPYWBAHMR-NRFANRHFSA-N 0 3 421.541 4.396 20 0 HIADHN Cc1nc(C)c([C@H](C)N(C)C(=O)[C@@H]2CN(Cc3ccccc3)CCC2(F)F)s1 ZINC000510705552 919145400 /nfs/dbraw/zinc/14/54/00/919145400.db2.gz WBKCBAHHIBSBRU-YJBOKZPZSA-N 0 3 407.530 4.437 20 0 HIADHN CCCOc1ccc(NC(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)cc1 ZINC000510710777 919149473 /nfs/dbraw/zinc/14/94/73/919149473.db2.gz FSMKWYOHYIHIBG-KDURUIRLSA-N 0 3 403.567 4.219 20 0 HIADHN Cc1ccc(OCc2cccc(C(=O)N(CCN(C)C)Cc3ccc(F)cc3)c2)cn1 ZINC000510712953 919153223 /nfs/dbraw/zinc/15/32/23/919153223.db2.gz HGJGTVXAPLXVAF-UHFFFAOYSA-N 0 3 421.516 4.312 20 0 HIADHN Cc1ccc(NC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)c(OC[C@H]2CCCO2)c1 ZINC000510736397 919181889 /nfs/dbraw/zinc/18/18/89/919181889.db2.gz PWGWATSBDAYEKM-FGZHOGPDSA-N 0 3 423.557 4.339 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)c1cc2c(cccc2Br)[nH]1 ZINC000510789751 919256659 /nfs/dbraw/zinc/25/66/59/919256659.db2.gz IKHNUUZAILBECS-UHFFFAOYSA-N 0 3 422.392 4.022 20 0 HIADHN C[C@@H](NC(=O)[C@@H](Oc1ccc(F)c(Cl)c1)c1ccccc1)C1=CCN(C)CC1 ZINC000510801305 919273216 /nfs/dbraw/zinc/27/32/16/919273216.db2.gz VKWNTTIWGIDVFN-VFNWGFHPSA-N 0 3 402.897 4.366 20 0 HIADHN CCN(CC)C(=O)c1cccc(NC(=O)CN[C@H](C)c2ccc3c(c2)CCCC3)c1 ZINC000510857078 919347070 /nfs/dbraw/zinc/34/70/70/919347070.db2.gz NMANRKPFFSFWML-GOSISDBHSA-N 0 3 407.558 4.337 20 0 HIADHN CCc1noc(-c2ccc(CCNC(=O)c3oc4ccccc4c3CN(C)C)cc2)n1 ZINC000510891854 919388066 /nfs/dbraw/zinc/38/80/66/919388066.db2.gz DYXQRKXVMIWIFT-UHFFFAOYSA-N 0 3 418.497 4.079 20 0 HIADHN CCn1cc(CNC(=O)N(CCN2CCCC2)Cc2ccc(Cl)c(Cl)c2)cn1 ZINC000510924208 919441662 /nfs/dbraw/zinc/44/16/62/919441662.db2.gz BNUUYOSJTMSUTM-UHFFFAOYSA-N 0 3 424.376 4.017 20 0 HIADHN FC(F)Oc1ccc([C@H](NCCc2nnnn2-c2ccccc2)c2ccccc2)cc1 ZINC000510980537 919530203 /nfs/dbraw/zinc/53/02/03/919530203.db2.gz BJMBVOQUNXGJDF-JOCHJYFZSA-N 0 3 421.451 4.185 20 0 HIADHN O=C(COc1ccccc1)N1CC[C@H](N[C@H]2CCSc3c(Cl)cccc32)C1 ZINC000510979666 919531873 /nfs/dbraw/zinc/53/18/73/919531873.db2.gz PFRKSWJBJITYJH-KXBFYZLASA-N 0 3 402.947 4.146 20 0 HIADHN CC[C@H](NCCc1nnnn1-c1ccccc1)c1ccc(Br)cc1Cl ZINC000511001874 919560831 /nfs/dbraw/zinc/56/08/31/919560831.db2.gz RZZBIWOQCDBYLK-KRWDZBQOSA-N 0 3 420.742 4.362 20 0 HIADHN C[C@@H](N[C@H]1CCCN(C(=O)Cc2ccccc2)C1)c1ccc(F)cc1OC(F)F ZINC000511052980 919648206 /nfs/dbraw/zinc/64/82/06/919648206.db2.gz DBILWMCVRAHTHB-QAPCUYQASA-N 0 3 406.448 4.311 20 0 HIADHN C[C@@H](NC(=O)N[C@@H](C)C1=CCN(C)CC1)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000511216493 919827162 /nfs/dbraw/zinc/82/71/62/919827162.db2.gz MFBMHBPYTSOWTN-MSOLQXFVSA-N 0 3 411.521 4.415 20 0 HIADHN C[C@@H](NC(=O)NCc1csc(-c2ccc(C(F)(F)F)cc2)n1)C1=CCN(C)CC1 ZINC000511252039 919854030 /nfs/dbraw/zinc/85/40/30/919854030.db2.gz KIGBAFMGMPESMM-CYBMUJFWSA-N 0 3 424.492 4.279 20 0 HIADHN C[C@@H](NC(=O)N1CCC[C@@H](Oc2ccc(Cl)c(Cl)c2)C1)C1=CCN(C)CC1 ZINC000511273857 919870169 /nfs/dbraw/zinc/87/01/69/919870169.db2.gz PBHDMAYULIZCJF-RHSMWYFYSA-N 0 3 412.361 4.197 20 0 HIADHN COc1ccccc1[C@@H](NC(=O)N[C@H](C)C1=CCN(C)CC1)c1ccccc1Cl ZINC000511309491 919901365 /nfs/dbraw/zinc/90/13/65/919901365.db2.gz RPIFJTLBZARWOQ-ZHRRBRCNSA-N 0 3 413.949 4.388 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)N[C@@H](c3ccc(F)cc3)C3CCC3)CC2)C[C@@H](C)O1 ZINC000511349217 919945047 /nfs/dbraw/zinc/94/50/47/919945047.db2.gz CSCWPLSAIBTENP-PMAPCBKXSA-N 0 3 417.569 4.198 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2Cl)c(C)c1CC(=O)N[C@@H](C)C1=CCN(C)CC1 ZINC000511356742 919952146 /nfs/dbraw/zinc/95/21/46/919952146.db2.gz CPFYPRPFYWFKRP-ZDUSSCGKSA-N 0 3 421.372 4.105 20 0 HIADHN C[C@@H](NC(=O)c1ccccc1SCc1cn2ccccc2n1)C1=CCN(C)CC1 ZINC000511367834 919958260 /nfs/dbraw/zinc/95/82/60/919958260.db2.gz ACASGZVJBWBKRH-QGZVFWFLSA-N 0 3 406.555 4.007 20 0 HIADHN CN(C(=O)N[C@H](C[C@H]1CCOC1)c1ccccc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000511369236 919962169 /nfs/dbraw/zinc/96/21/69/919962169.db2.gz ADGQQKSYFGIEKM-PZUNEJSGSA-N 0 3 421.585 4.460 20 0 HIADHN CC(=O)Nc1ccc(C)cc1NC(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000511444096 920053102 /nfs/dbraw/zinc/05/31/02/920053102.db2.gz JHQQBJWQQWPLNZ-GOSISDBHSA-N 0 3 401.457 4.049 20 0 HIADHN Cc1csc(CCCCNC(=O)[C@H]2CN(Cc3ccccc3)CCC2(F)F)n1 ZINC000511464690 920073651 /nfs/dbraw/zinc/07/36/51/920073651.db2.gz ZDXGFWYYLSEBFF-GOSISDBHSA-N 0 3 407.530 4.048 20 0 HIADHN O=C1COc2ccc(CNCCOc3c(Cl)cc(Cl)cc3Cl)cc2N1 ZINC000511525318 920144547 /nfs/dbraw/zinc/14/45/47/920144547.db2.gz VZGOGFNHCJXVNO-UHFFFAOYSA-N 0 3 401.677 4.146 20 0 HIADHN O=C(CN[C@H](c1cccc(OC(F)(F)F)c1)C1CC1)N1CCc2ccccc2C1 ZINC000511543018 920168242 /nfs/dbraw/zinc/16/82/42/920168242.db2.gz RCSFCVCMQXFURV-NRFANRHFSA-N 0 3 404.432 4.211 20 0 HIADHN COc1ccc(C[C@@H](C)C(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)cc1OC ZINC000511551530 920184400 /nfs/dbraw/zinc/18/44/00/920184400.db2.gz LNPPFTKQQIVRTR-UXHICEINSA-N 0 3 410.558 4.005 20 0 HIADHN CC[C@H](O)[C@H]1CCCCN1CC(=O)NC[C@@H](c1c[nH]c2ccccc21)c1ccccc1 ZINC000511573984 920217247 /nfs/dbraw/zinc/21/72/47/920217247.db2.gz RMURPDOBDQDGHT-SDUSCBPUSA-N 0 3 419.569 4.041 20 0 HIADHN O=C(CN[C@H](c1cccc(OC(F)(F)F)c1)C1CC1)N[C@H]1CCOc2ccccc21 ZINC000511584078 920228950 /nfs/dbraw/zinc/22/89/50/920228950.db2.gz GSQKATPXDQVJEQ-RXVVDRJESA-N 0 3 420.431 4.266 20 0 HIADHN CC(C)n1nccc1NC(=O)[C@@H](C)N[C@@H](c1cccc(OC(F)(F)F)c1)C1CC1 ZINC000511623241 920282340 /nfs/dbraw/zinc/28/23/40/920282340.db2.gz NDLLJNVNMMLZSK-FZKQIMNGSA-N 0 3 410.440 4.431 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)N[C@H](C)c2ccc3n[nH]cc3c2)N(C)C)cc1 ZINC000511642102 920306888 /nfs/dbraw/zinc/30/68/88/920306888.db2.gz VZCVPFUXSAMPHT-ZHRRBRCNSA-N 0 3 409.534 4.013 20 0 HIADHN C[C@H]1CCCN(Cc2csc(NC(=O)[C@H]3CCCN(Cc4ccccc4)C3)n2)C1 ZINC000511646291 920310556 /nfs/dbraw/zinc/31/05/56/920310556.db2.gz JQXBBYZMXGUYDH-ICSRJNTNSA-N 0 3 412.603 4.226 20 0 HIADHN CO[C@@H]1[C@H]2C[C@H]3CN(Cc4csc(-c5cccc(Br)c5)n4)[C@H]1[C@H]3C2 ZINC000511668811 920334051 /nfs/dbraw/zinc/33/40/51/920334051.db2.gz VXUSHWUMFWFVDB-MZDBXJLNSA-N 0 3 405.361 4.428 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N[C@H](C)c1ccc(F)c2ccccc21 ZINC000511736259 920405206 /nfs/dbraw/zinc/40/52/06/920405206.db2.gz BNWLWKNWRBWNTO-MRXNPFEDSA-N 0 3 407.489 4.165 20 0 HIADHN Cc1cc(C(=O)CN2C[C@H](c3ccccc3)[C@H]3COCC[C@H]32)c(C)n1CC(F)(F)F ZINC000511754329 920431913 /nfs/dbraw/zinc/43/19/13/920431913.db2.gz JBTLWIQMKVIRCD-NJDAHSKKSA-N 0 3 420.475 4.354 20 0 HIADHN Brc1ccc2[nH]c(CN3C[C@H](c4ccccc4)[C@H]4COCC[C@@H]43)nc2c1 ZINC000511775954 920464920 /nfs/dbraw/zinc/46/49/20/920464920.db2.gz JCCGHGDZQWQKEM-HLIPFELVSA-N 0 3 412.331 4.330 20 0 HIADHN CCN(C(=O)CN1C[C@H](c2ccccc2)[C@H]2COCC[C@H]21)c1nc2ccccc2s1 ZINC000511795722 920489087 /nfs/dbraw/zinc/48/90/87/920489087.db2.gz XJJPAJOIAIKCLP-SFHLNBCPSA-N 0 3 421.566 4.154 20 0 HIADHN O=C(CSCC(F)(F)F)N[C@@H]1CN(Cc2ccccc2)C[C@H]1c1ccccc1 ZINC000511800515 920494365 /nfs/dbraw/zinc/49/43/65/920494365.db2.gz BXOUNUYDEUFLDR-RBUKOAKNSA-N 0 3 408.489 4.066 20 0 HIADHN CN(C)C(=O)Cc1nc(CN[C@H]2CCC[C@H]2c2cccc(C(F)(F)F)c2)cs1 ZINC000511804567 920500328 /nfs/dbraw/zinc/50/03/28/920500328.db2.gz DFDJIKRKFGCAAW-IRXDYDNUSA-N 0 3 411.493 4.219 20 0 HIADHN Cn1c(CN[C@H]2CCC[C@H]2c2cccc(C(F)(F)F)c2)nc2ccccc2c1=O ZINC000511806850 920503216 /nfs/dbraw/zinc/50/32/16/920503216.db2.gz BCRZZAJUBSKWBF-WMZOPIPTSA-N 0 3 401.432 4.378 20 0 HIADHN O=C(CN1C[C@H](c2ccccc2)[C@@H]2CCC[C@H]21)NCC1(c2ccccc2)CCOCC1 ZINC000511829572 920530601 /nfs/dbraw/zinc/53/06/01/920530601.db2.gz KKGSPYKAZXKYQW-ISJGIBHGSA-N 0 3 418.581 4.119 20 0 HIADHN CCN(C)[C@@H](C(=O)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1 ZINC000511847266 920567517 /nfs/dbraw/zinc/56/75/17/920567517.db2.gz PYUYXLHABJHWDZ-NHCUHLMSSA-N 0 3 419.491 4.089 20 0 HIADHN COc1ccccc1C[C@@H](NCc1ncc(I)s1)C(C)C ZINC000511996577 920764871 /nfs/dbraw/zinc/76/48/71/920764871.db2.gz JLQZZJNWRZFBBY-CYBMUJFWSA-N 0 3 416.328 4.113 20 0 HIADHN COc1cccc(OC)c1CNC1CCN(Cc2ccc(Br)cc2)CC1 ZINC000511996473 920765249 /nfs/dbraw/zinc/76/52/49/920765249.db2.gz HVEPCOVRIXAFOW-UHFFFAOYSA-N 0 3 419.363 4.221 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Cc1ccccc1Br)c1cccc(OC)c1 ZINC000512057075 920827106 /nfs/dbraw/zinc/82/71/06/920827106.db2.gz JGTMTVCUARSGFA-FQEVSTJZSA-N 0 3 419.363 4.200 20 0 HIADHN OC[C@H](CNCc1cscc1Br)Cc1ccccc1C(F)(F)F ZINC000512066157 920833683 /nfs/dbraw/zinc/83/36/83/920833683.db2.gz CRSFADMGSLTORP-NSHDSACASA-N 0 3 408.283 4.470 20 0 HIADHN COc1ccc([C@@H](C)CCNCc2ncc(I)s2)cc1 ZINC000512066326 920833998 /nfs/dbraw/zinc/83/39/98/920833998.db2.gz DZKFWQMNFPILBF-NSHDSACASA-N 0 3 402.301 4.040 20 0 HIADHN O=C(N[C@H]1CCN(Cc2ccccc2)C1)c1cc2ccc(OC(F)(F)F)cc2[nH]1 ZINC000512075328 920841074 /nfs/dbraw/zinc/84/10/74/920841074.db2.gz STHPQOQYRGTHLX-INIZCTEOSA-N 0 3 403.404 4.071 20 0 HIADHN COc1cccc(OC)c1CNC[C@@H]1CCN(c2cccc(Br)c2)C1 ZINC000512098887 920859359 /nfs/dbraw/zinc/85/93/59/920859359.db2.gz JEVRKEFYLYSWMJ-HNNXBMFYSA-N 0 3 405.336 4.082 20 0 HIADHN Cc1ccc(-c2cc(C(=O)N[C@@H](C)C3=CCN(C)CC3)c3cnn(C(C)C)c3n2)s1 ZINC000512106730 920863674 /nfs/dbraw/zinc/86/36/74/920863674.db2.gz ACGSQEKSHGPZHG-INIZCTEOSA-N 0 3 423.586 4.429 20 0 HIADHN Cc1noc(C)c1COc1cc2ccccc2cc1C(=O)N[C@H](C)C1=CCN(C)CC1 ZINC000512121185 920872723 /nfs/dbraw/zinc/87/27/23/920872723.db2.gz DPOPMZVICWECBP-MRXNPFEDSA-N 0 3 419.525 4.404 20 0 HIADHN Cc1cc([C@@H](C)NCc2cccc(OCC(=O)N(C)C)c2)sc1Br ZINC000512119909 920873074 /nfs/dbraw/zinc/87/30/74/920873074.db2.gz DMKOMONVPUIKMI-CYBMUJFWSA-N 0 3 411.365 4.137 20 0 HIADHN CN(C)Cc1cnc(CNCc2ccccc2-c2ccc(Cn3ccnc3)cc2)s1 ZINC000512127271 920876872 /nfs/dbraw/zinc/87/68/72/920876872.db2.gz ADMYUBYOIZJKFS-UHFFFAOYSA-N 0 3 417.582 4.406 20 0 HIADHN C[C@@H](NC(=O)c1ccc(Oc2cccc(Br)c2)nc1)C1=CCN(C)CC1 ZINC000512142321 920886143 /nfs/dbraw/zinc/88/61/43/920886143.db2.gz JFDCETYQEUDCEK-CQSZACIVSA-N 0 3 416.319 4.017 20 0 HIADHN CCN1CCN(CCC(=O)Nc2ccc(N[C@@H](C)c3ccccc3)c(Cl)c2)CC1 ZINC000512157624 920897237 /nfs/dbraw/zinc/89/72/37/920897237.db2.gz FPJWRSDDSSDOCM-SFHVURJKSA-N 0 3 414.981 4.479 20 0 HIADHN CN(CCOc1ccc(Br)cc1)CCc1nc(-c2ccccc2)no1 ZINC000512165459 920901579 /nfs/dbraw/zinc/90/15/79/920901579.db2.gz KXKABBCKXMSYBI-UHFFFAOYSA-N 0 3 402.292 4.052 20 0 HIADHN Cc1cc2cc(CNC(=O)N(CCN(C)C)Cc3ccc(F)c(F)c3)ccc2[nH]1 ZINC000512202061 920946745 /nfs/dbraw/zinc/94/67/45/920946745.db2.gz ZMWFVMMEBZJQRH-UHFFFAOYSA-N 0 3 400.473 4.028 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N[C@H](C[C@@H]3CCOC3)c3ccccc3)cc2)CC1 ZINC000512206679 920953305 /nfs/dbraw/zinc/95/33/05/920953305.db2.gz HZDUUDVYBRQUEJ-SQJMNOBHSA-N 0 3 421.585 4.115 20 0 HIADHN O=C(CN1CCC[C@]2(CC=CCC2)C1)N1CCC[C@H]1c1ccc2c(c1)OCCCO2 ZINC000512208772 920955436 /nfs/dbraw/zinc/95/54/36/920955436.db2.gz HLJVUPJIECKFSC-SQJMNOBHSA-N 0 3 410.558 4.334 20 0 HIADHN COc1cccc(NC(=O)[C@H](NCCc2ccc3c(c2)CCO3)c2ccccc2)c1 ZINC000512247933 921005988 /nfs/dbraw/zinc/00/59/88/921005988.db2.gz BNRXGJLARGYKJH-XMMPIXPASA-N 0 3 402.494 4.142 20 0 HIADHN Cc1cc(CN2CCSCC2)ccc1NC(=O)c1ccc(Cn2ccnc2)cc1 ZINC000512285057 921039172 /nfs/dbraw/zinc/03/91/72/921039172.db2.gz IIXNCZVSSBMDFA-UHFFFAOYSA-N 0 3 406.555 4.041 20 0 HIADHN O=C(N1CCc2cc(F)ccc2C1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000512334278 921081617 /nfs/dbraw/zinc/08/16/17/921081617.db2.gz OVSFCCJGKLJBEU-NRFANRHFSA-N 0 3 406.423 4.165 20 0 HIADHN C[C@@H](C(=O)Nc1ccc(CC(=O)N2CCCc3ccccc32)cc1)N1[C@H](C)CC[C@@H]1C ZINC000512349586 921093902 /nfs/dbraw/zinc/09/39/02/921093902.db2.gz YBCVWHGHHPZNFN-ZCNNSNEGSA-N 0 3 419.569 4.408 20 0 HIADHN CS(=O)(=O)c1cc(CNC/C=C\c2ccc(F)c(F)c2)cc(C(F)(F)F)c1 ZINC000512350505 921096409 /nfs/dbraw/zinc/09/64/09/921096409.db2.gz PSXBAYZLJFOTAN-IHWYPQMZSA-N 0 3 405.388 4.190 20 0 HIADHN O=C(NC1CCN(Cc2cccc(OCc3ccccn3)c2)CC1)C1CCCCC1 ZINC000512354422 921100065 /nfs/dbraw/zinc/10/00/65/921100065.db2.gz CKEWPSAIMJPKMF-UHFFFAOYSA-N 0 3 407.558 4.322 20 0 HIADHN COC(=O)[C@@H](NC1CCN([C@H](C)c2ccncc2)CC1)c1cccc(Cl)c1Cl ZINC000513456991 921822206 /nfs/dbraw/zinc/82/22/06/921822206.db2.gz HAZIVMNMVPIHHV-VLIAUNLRSA-N 0 3 422.356 4.418 20 0 HIADHN COc1ccc(OC)c(NC(=O)C[C@@H](C)NCc2ccc(-c3csc(C)n3)o2)c1 ZINC000513581900 921913790 /nfs/dbraw/zinc/91/37/90/921913790.db2.gz DHFHQYZIJXTMRI-CYBMUJFWSA-N 0 3 415.515 4.236 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2CNCc2ccccc2OC(F)(F)F)C[C@@H](C)O1 ZINC000513588049 921920274 /nfs/dbraw/zinc/92/02/74/921920274.db2.gz GVQCUSBGEKKPRL-IAGOWNOFSA-N 0 3 408.464 4.484 20 0 HIADHN CCOc1ccc(Oc2cc(CNCc3ccc(-n4cncn4)cc3)ccn2)cc1 ZINC000513633530 921960200 /nfs/dbraw/zinc/96/02/00/921960200.db2.gz YRAFDMRRLPLSCG-UHFFFAOYSA-N 0 3 401.470 4.143 20 0 HIADHN C[C@@H](CN1CCCC1=O)NCc1cccc(NC(=O)c2ccc(Cl)cc2Cl)c1 ZINC000513642019 921964888 /nfs/dbraw/zinc/96/48/88/921964888.db2.gz CQFKGKMXPOGZJO-AWEZNQCLSA-N 0 3 420.340 4.346 20 0 HIADHN CC(C)(C)c1nn(Cc2ccccc2)cc1CN1CCC[C@H](c2nnc3n2CCC3)C1 ZINC000513646785 921969307 /nfs/dbraw/zinc/96/93/07/921969307.db2.gz BPGJJSGBOURPKY-FQEVSTJZSA-N 0 3 418.589 4.146 20 0 HIADHN CCN(Cc1ccccc1)C(=O)CN[C@H](Cc1ccncc1)c1ccc(OC)cc1 ZINC000513660058 921983125 /nfs/dbraw/zinc/98/31/25/921983125.db2.gz FLSYVNKTKUYWCU-XMMPIXPASA-N 0 3 403.526 4.012 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)c(C)c1CN1CCC[C@H](c2nnc3n2CCC3)C1 ZINC000513684298 922005962 /nfs/dbraw/zinc/00/59/62/922005962.db2.gz QSYCWSYEQWBOCY-KRWDZBQOSA-N 0 3 410.953 4.060 20 0 HIADHN c1csc(-c2nn(-c3ccccc3)cc2CN2CCCN(c3cccnn3)CC2)c1 ZINC000513707988 922028026 /nfs/dbraw/zinc/02/80/26/922028026.db2.gz LGLARYDNRXIMQC-UHFFFAOYSA-N 0 3 416.554 4.103 20 0 HIADHN CC(C)(C)O[C@@H](C(=O)Nc1ccc(C(=O)NCCN2CCCC2)cc1)c1ccccc1 ZINC000513774970 922095234 /nfs/dbraw/zinc/09/52/34/922095234.db2.gz HWXRGBDUBNGMRJ-JOCHJYFZSA-N 0 3 423.557 4.007 20 0 HIADHN CC(C)(C)O[C@H](C(=O)Nc1ccc(C(=O)NCCN2CCCC2)cc1)c1ccccc1 ZINC000513774971 922095937 /nfs/dbraw/zinc/09/59/37/922095937.db2.gz HWXRGBDUBNGMRJ-QFIPXVFZSA-N 0 3 423.557 4.007 20 0 HIADHN Cc1ccc(NC(=O)Cc2c[nH]c3cccc(Br)c23)c(CN(C)C)c1 ZINC000513781183 922105589 /nfs/dbraw/zinc/10/55/89/922105589.db2.gz JSMAFXYQXWWXNE-UHFFFAOYSA-N 0 3 400.320 4.482 20 0 HIADHN CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)c1ccccc1Oc1ccncc1 ZINC000513828722 922154504 /nfs/dbraw/zinc/15/45/04/922154504.db2.gz ORPXPQNFJJUTOS-CVDCTZTESA-N 0 3 402.498 4.034 20 0 HIADHN CCc1cc(C(=O)Nc2cccc(CN3CCC(O)CC3)c2)c2c(n1)onc2C(C)C ZINC000513835961 922163144 /nfs/dbraw/zinc/16/31/44/922163144.db2.gz XRSBFCQAWDIBSE-UHFFFAOYSA-N 0 3 422.529 4.118 20 0 HIADHN Cc1noc(C)c1[C@H](C)CC(=O)N(CCN(C)C)Cc1ccc(C(F)(F)F)cc1 ZINC000513853819 922178500 /nfs/dbraw/zinc/17/85/00/922178500.db2.gz FBCFXQXSFCZURE-CQSZACIVSA-N 0 3 411.468 4.394 20 0 HIADHN Cc1cc(NC(=O)C[C@@H](C)c2c(C)noc2C)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000513932738 922254133 /nfs/dbraw/zinc/25/41/33/922254133.db2.gz AJFDSDRYYLUHLF-IIBYNOLFSA-N 0 3 421.545 4.376 20 0 HIADHN CSc1cc2c(cc1NC(=O)NC[C@H](c1ccccc1)N1CCCC1)OCCO2 ZINC000513973761 922293243 /nfs/dbraw/zinc/29/32/43/922293243.db2.gz CJQODAREMWXRSQ-GOSISDBHSA-N 0 3 413.543 4.138 20 0 HIADHN C[C@H](Cc1ccccc1Cl)C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000514012752 922337298 /nfs/dbraw/zinc/33/72/98/922337298.db2.gz GIWCVSCXJWALJL-QGZVFWFLSA-N 0 3 418.940 4.317 20 0 HIADHN COc1ccc(OC)c([C@H](C)NC(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)c1 ZINC000514069336 922393794 /nfs/dbraw/zinc/39/37/94/922393794.db2.gz ANAWYSGJDSHGRV-PGRDOPGGSA-N 0 3 411.546 4.210 20 0 HIADHN O=C(Nc1ccccc1)[C@H](NC[C@H]1CCN(C(=O)c2ccccc2)C1)c1ccccc1 ZINC000514076338 922399170 /nfs/dbraw/zinc/39/91/70/922399170.db2.gz WUHTUVMQSFNVKT-HYBUGGRVSA-N 0 3 413.521 4.118 20 0 HIADHN CC[C@H](NCc1ccc(N2CCO[C@@H](C)C2)nc1)c1ccc(OC(F)(F)F)cc1 ZINC000514095259 922419220 /nfs/dbraw/zinc/41/92/20/922419220.db2.gz QCOINBHPTNYYDM-KXBFYZLASA-N 0 3 409.452 4.446 20 0 HIADHN CCCOc1ccc([C@@H](C)NC(=O)NC[C@H](c2ccc(C)cc2)N(C)C)cc1OC ZINC000514126764 922459596 /nfs/dbraw/zinc/45/95/96/922459596.db2.gz LUHYAVYJPISKIA-WIYYLYMNSA-N 0 3 413.562 4.456 20 0 HIADHN CC1CCN([C@H](CNC(=O)NCc2ccccc2-n2ccnc2)c2cccs2)CC1 ZINC000514182697 922521376 /nfs/dbraw/zinc/52/13/76/922521376.db2.gz OFVSLPAYNQJWGI-OAQYLSRUSA-N 0 3 423.586 4.206 20 0 HIADHN O=C(NCc1ccc(Oc2cccnc2)c(F)c1)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000514182708 922522025 /nfs/dbraw/zinc/52/20/25/922522025.db2.gz ONJGVUVRSDAIQW-HXUWFJFHSA-N 0 3 420.488 4.087 20 0 HIADHN CC[C@H]1C[C@@H](CC(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)CCO1 ZINC000514196411 922536152 /nfs/dbraw/zinc/53/61/52/922536152.db2.gz YIGNYCBFIXBCMT-LPHOPBHVSA-N 0 3 400.485 4.191 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N[C@H](C)COc1ccc(F)cc1F)c1ccsc1 ZINC000514221021 922554847 /nfs/dbraw/zinc/55/48/47/922554847.db2.gz FGUXMTFKOAPISU-KDOFPFPSSA-N 0 3 411.518 4.176 20 0 HIADHN C[C@H](Oc1ccc(C(=O)Nc2cccc(CN3CC[C@H](O)C3)c2)cn1)c1ccccc1 ZINC000562377988 945067578 /nfs/dbraw/zinc/06/75/78/945067578.db2.gz WHXAHEMTQKDOFS-MBSDFSHPSA-N 0 3 417.509 4.041 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)Nc2ccc(CC(=O)N(CC)CC)cc2)N(C)C)cc1 ZINC000514513283 922664584 /nfs/dbraw/zinc/66/45/84/922664584.db2.gz NQFRDBJOICPOPE-HSZRJFAPSA-N 0 3 424.589 4.084 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N1CCC(c2nc3ccccc3[nH]2)CC1 ZINC000514564514 922701769 /nfs/dbraw/zinc/70/17/69/922701769.db2.gz HQPQWCMKXYGBDF-HXUWFJFHSA-N 0 3 423.586 4.351 20 0 HIADHN CN(C)C[C@@H](NC(=O)CCCc1ccc(Br)s1)c1ccc(F)cc1 ZINC000514626186 922729169 /nfs/dbraw/zinc/72/91/69/922729169.db2.gz RWRVTNWDWFOFPO-MRXNPFEDSA-N 0 3 413.356 4.392 20 0 HIADHN Clc1ccc(CN2CCC[C@H](c3nc(-c4ccccc4)n[nH]3)C2)c(-n2cncn2)c1 ZINC000514635050 922737630 /nfs/dbraw/zinc/73/76/30/922737630.db2.gz QNNUDDAQYOYQQV-SFHVURJKSA-N 0 3 419.920 4.085 20 0 HIADHN CO[C@H](C)c1nc(C)c(C(=O)NC[C@@H](c2ccc(CC(C)C)cc2)N(C)C)s1 ZINC000514749792 922781134 /nfs/dbraw/zinc/78/11/34/922781134.db2.gz CRVODDLNIQMCRE-APWZRJJASA-N 0 3 403.592 4.390 20 0 HIADHN CO[C@H](C)c1nc(C)c(C(=O)NC[C@H](c2ccc(CC(C)C)cc2)N(C)C)s1 ZINC000514749795 922781187 /nfs/dbraw/zinc/78/11/87/922781187.db2.gz CRVODDLNIQMCRE-VQIMIIECSA-N 0 3 403.592 4.390 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)c1ccc(C(=O)N(C)c2ccccc2)cc1)c1ccco1 ZINC000514750605 922782325 /nfs/dbraw/zinc/78/23/25/922782325.db2.gz XXWUPLTVHPNVEP-PGRDOPGGSA-N 0 3 419.525 4.415 20 0 HIADHN COc1cccc([C@@H](CNC(=O)c2c3c(nc4ccccc42)CCC3)N2CCCC2)c1 ZINC000514775119 922798830 /nfs/dbraw/zinc/79/88/30/922798830.db2.gz QLJQIWQXSAFKOH-XMMPIXPASA-N 0 3 415.537 4.299 20 0 HIADHN CCc1cc(N2CCC(NCc3c(Cl)cc(Cl)cc3N(C)C)CC2)ncn1 ZINC000514820625 922814154 /nfs/dbraw/zinc/81/41/54/922814154.db2.gz UJHHNDHDQJZZTI-UHFFFAOYSA-N 0 3 408.377 4.170 20 0 HIADHN Cc1ccc(-c2cc(C(=O)N(C)C3CCN(C)CC3)c3cnn(C(C)C)c3n2)cc1 ZINC000514912593 922843597 /nfs/dbraw/zinc/84/35/97/922843597.db2.gz ILFKDPBOUTVQMX-UHFFFAOYSA-N 0 3 405.546 4.154 20 0 HIADHN O=C(Cc1coc2ccc3ccccc3c12)Nc1cccc(CN2CC[C@@H](O)C2)c1 ZINC000562377866 945067826 /nfs/dbraw/zinc/06/78/26/945067826.db2.gz BBPGTFRIJKTHNT-OAQYLSRUSA-N 0 3 400.478 4.334 20 0 HIADHN C[C@H](NCc1cccc(COCc2ccco2)c1)C(=O)N1CCc2sccc2C1 ZINC000515210068 922994280 /nfs/dbraw/zinc/99/42/80/922994280.db2.gz CBDZXZCAUMUPTG-KRWDZBQOSA-N 0 3 410.539 4.121 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)Nc1cc(C2CC2)nn1-c1ccccc1 ZINC000515222903 923002899 /nfs/dbraw/zinc/00/28/99/923002899.db2.gz RIDJWZGYFNYFIF-UHFFFAOYSA-N 0 3 403.530 4.345 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N3C[C@H]4CCCCN4c4ccccc43)cc2)CC1 ZINC000515245123 923012593 /nfs/dbraw/zinc/01/25/93/923012593.db2.gz GEXDGJGWKKEOBJ-HSZRJFAPSA-N 0 3 418.585 4.236 20 0 HIADHN COc1cccc(-c2nc(C)c(C(=O)NC[C@H](c3ccc(SC)cc3)N(C)C)[nH]2)c1 ZINC000515409409 923086892 /nfs/dbraw/zinc/08/68/92/923086892.db2.gz SKNWRPCIERMYFL-HXUWFJFHSA-N 0 3 424.570 4.148 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N[C@@H](C)c1c(F)cccc1F)c1cccc(OC)c1 ZINC000515528785 923157291 /nfs/dbraw/zinc/15/72/91/923157291.db2.gz NSVFWPWSJSZZSM-YWZLYKJASA-N 0 3 405.489 4.417 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@@H](C)c1c(F)cccc1F)c1cccc(OC)c1 ZINC000515528783 923157754 /nfs/dbraw/zinc/15/77/54/923157754.db2.gz NSVFWPWSJSZZSM-MGPUTAFESA-N 0 3 405.489 4.417 20 0 HIADHN Cc1ccc([C@@H](C)N[C@@H](C)C(=O)Nc2ccc(I)cc2)cc1 ZINC000515715979 923297215 /nfs/dbraw/zinc/29/72/15/923297215.db2.gz ZGRRHOOXZMFBEL-KGLIPLIRSA-N 0 3 408.283 4.277 20 0 HIADHN CC(C)OCc1cc(NC(=O)[C@@H]2CN(Cc3ccccc3)CCC2(F)F)ccc1O ZINC000515720967 923303486 /nfs/dbraw/zinc/30/34/86/923303486.db2.gz VIRIPKUUPCLDAD-FQEVSTJZSA-N 0 3 418.484 4.413 20 0 HIADHN COc1cccc([C@@H](CNC(=O)CCOc2ccc(F)c(Cl)c2)N2CCCC2)c1 ZINC000515721747 923303910 /nfs/dbraw/zinc/30/39/10/923303910.db2.gz LOXFNEVNLLRCIB-OAQYLSRUSA-N 0 3 420.912 4.210 20 0 HIADHN Cc1cc(-c2noc([C@@H](C)NCC3(N4CCSCC4)CCCC3)n2)ccc1F ZINC000515756823 923329016 /nfs/dbraw/zinc/32/90/16/923329016.db2.gz DRJICGJTIMLRFZ-MRXNPFEDSA-N 0 3 404.555 4.196 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)c1[nH]c2ccccc2c1Br ZINC000515773521 923341202 /nfs/dbraw/zinc/34/12/02/923341202.db2.gz UDBQMVOVEIPVBI-GOSISDBHSA-N 0 3 412.331 4.497 20 0 HIADHN Cc1ccc(-n2ncc(C(=O)N3CCN([C@@H]4C[C@@H]4C)C[C@@H](C)C3)c2C(F)(F)F)cc1 ZINC000515891520 923417483 /nfs/dbraw/zinc/41/74/83/923417483.db2.gz RPYHKWVCQYKJEI-JTDSTZFVSA-N 0 3 420.479 4.002 20 0 HIADHN Cc1cc(=O)[nH]c2cc(C(=O)N3CCCN(CCCc4ccccc4)CC3)ccc12 ZINC000515912428 923430457 /nfs/dbraw/zinc/43/04/57/923430457.db2.gz MUWXKBBPSPOCHT-UHFFFAOYSA-N 0 3 403.526 4.030 20 0 HIADHN COc1ccc(NC(=O)N[C@H](CN(C)C)c2ccc(F)cc2)cc1Br ZINC000516168858 923583828 /nfs/dbraw/zinc/58/38/28/923583828.db2.gz KBJBYQCEJLKEEC-MRXNPFEDSA-N 0 3 410.287 4.021 20 0 HIADHN Cc1cc(NC(=O)N[C@@H]2CCN(Cc3ccccc3)[C@H]2C)ccc1OC1CCOCC1 ZINC000516341444 923677268 /nfs/dbraw/zinc/67/72/68/923677268.db2.gz XYJZBISNCPQJCU-WMZHIEFXSA-N 0 3 423.557 4.337 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)NCc2ccc(OC3CCCC3)nc2)C1 ZINC000516579377 923800317 /nfs/dbraw/zinc/80/03/17/923800317.db2.gz SFOOYVBDHVASTB-WIYYLYMNSA-N 0 3 408.546 4.038 20 0 HIADHN Cc1ccc2c(c1)[nH]cc2C1=CCN(C(=O)NCCN(C)Cc2ccccc2)CC1 ZINC000516610937 923817551 /nfs/dbraw/zinc/81/75/51/923817551.db2.gz HPWFRYXVDUMBDA-UHFFFAOYSA-N 0 3 402.542 4.407 20 0 HIADHN CC(C)CC(=O)Nc1ccc(NC(=O)N[C@H]2CCN(Cc3ccccc3)[C@@H]2C)cc1 ZINC000516657341 923830757 /nfs/dbraw/zinc/83/07/57/923830757.db2.gz XZMCBUSEAZIFKS-GCJKJVERSA-N 0 3 408.546 4.456 20 0 HIADHN Cc1nn(-c2ccccc2C)c(C)c1CN(C)C(=O)NC[C@@H](c1ccccc1)N(C)C ZINC000516657693 923831048 /nfs/dbraw/zinc/83/10/48/923831048.db2.gz JYQZFKXXUVBOFS-DEOSSOPVSA-N 0 3 419.573 4.242 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)NCc1csc([C@@H](C)OC)n1)c1ccc(Cl)cc1 ZINC000516798863 923891403 /nfs/dbraw/zinc/89/14/03/923891403.db2.gz CJMINCAVDSRWCM-KDOFPFPSSA-N 0 3 424.998 4.386 20 0 HIADHN C[C@@H](Nc1cnn(-c2ccc(F)cc2F)c(=O)c1Cl)[C@@H](c1ccccc1)N(C)C ZINC000516899917 923935541 /nfs/dbraw/zinc/93/55/41/923935541.db2.gz OIELEGHRLMJRQW-XCLFUZPHSA-N 0 3 418.875 4.267 20 0 HIADHN Brc1cncc(Br)c1CNC1CCC2(CCOCC2)CC1 ZINC000516941864 923944865 /nfs/dbraw/zinc/94/48/65/923944865.db2.gz VXNNOJKWRHNJTN-UHFFFAOYSA-N 0 3 418.173 4.436 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Nc1nc(Sc2ccccc2)ns1 ZINC000516998038 923961115 /nfs/dbraw/zinc/96/11/15/923961115.db2.gz PJUIKSVKZRODGH-UHFFFAOYSA-N 0 3 419.601 4.347 20 0 HIADHN CN(C(=O)Nc1ccc(F)c(C(F)(F)F)c1)C1CCN(CCc2ccccn2)CC1 ZINC000517288025 924077435 /nfs/dbraw/zinc/07/74/35/924077435.db2.gz HUSIVFYWKWIALL-UHFFFAOYSA-N 0 3 424.442 4.410 20 0 HIADHN COCCOc1ccc(NC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)cc1Cl ZINC000517325502 924103313 /nfs/dbraw/zinc/10/33/13/924103313.db2.gz RGCVMNWVHCETKX-IBGZPJMESA-N 0 3 417.937 4.151 20 0 HIADHN COCCOc1ccc(NC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)cc1Cl ZINC000517325503 924103678 /nfs/dbraw/zinc/10/36/78/924103678.db2.gz RGCVMNWVHCETKX-LJQANCHMSA-N 0 3 417.937 4.151 20 0 HIADHN Cc1nn(Cc2ccc(C)cc2)c(C)c1CCC(=O)N(CCN(C)C)c1ccccc1 ZINC000517338735 924111506 /nfs/dbraw/zinc/11/15/06/924111506.db2.gz GNLQRMSIKNGNSW-UHFFFAOYSA-N 0 3 418.585 4.384 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)NCc2ccc(Br)cc2)C1 ZINC000517340689 924113319 /nfs/dbraw/zinc/11/33/19/924113319.db2.gz BMZXCELVJFZWPK-BEFAXECRSA-N 0 3 402.336 4.084 20 0 HIADHN CN1CCN(Cc2ccc(CNC(=O)[C@@H]3C[C@@H]3c3cccc4ccccc43)cc2)CC1 ZINC000517406697 924161098 /nfs/dbraw/zinc/16/10/98/924161098.db2.gz FZEXZGHSQAKUKW-CLJLJLNGSA-N 0 3 413.565 4.007 20 0 HIADHN CC(C)C[C@H](NC(=O)NCc1ccc(CN2CCN(C)CC2)cc1)c1cccs1 ZINC000517505297 924235708 /nfs/dbraw/zinc/23/57/08/924235708.db2.gz YJCFCSAVXSVIBM-NRFANRHFSA-N 0 3 414.619 4.082 20 0 HIADHN CCN(C(=O)NCCCN1CCc2ccccc2C1)[C@H](C)Cc1ccc(OC)cc1 ZINC000517532536 924250037 /nfs/dbraw/zinc/25/00/37/924250037.db2.gz LQSMKMXCKFDDNO-HXUWFJFHSA-N 0 3 409.574 4.106 20 0 HIADHN O=C([C@@H](Cc1ccccc1)NCc1ccc(-n2cnc3ccccc32)cc1)N1CCCC1 ZINC000517544369 924256715 /nfs/dbraw/zinc/25/67/15/924256715.db2.gz JQXPGQSTKUZQPJ-RUZDIDTESA-N 0 3 424.548 4.349 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)NCc2cc(Br)cs2)C1 ZINC000517544830 924257400 /nfs/dbraw/zinc/25/74/00/924257400.db2.gz TYNCSWQFLLKSID-CJNGLKHVSA-N 0 3 408.365 4.145 20 0 HIADHN C[C@H]1CCCN(C(C)(C)CNC(=O)N2CCC(C(=O)c3cc(F)ccc3F)CC2)C1 ZINC000517594759 926703487 /nfs/dbraw/zinc/70/34/87/926703487.db2.gz FCRORBZNQUKTHF-INIZCTEOSA-N 0 3 421.532 4.080 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1C(=O)N[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000517649824 926758022 /nfs/dbraw/zinc/75/80/22/926758022.db2.gz ZNMBTTHPEQKMFC-XXBNENTESA-N 0 3 402.542 4.114 20 0 HIADHN CC(C)c1ccc(-c2nc(C(=O)Nc3cnccc3N3CCN(C)CC3)cs2)cc1 ZINC000517652734 926760304 /nfs/dbraw/zinc/76/03/04/926760304.db2.gz XCMSKLHGUXIHOO-UHFFFAOYSA-N 0 3 421.570 4.333 20 0 HIADHN CN(C(=O)[C@H](Oc1ccc(F)cc1Cl)c1ccccc1)[C@H]1CCN(C2CC2)C1 ZINC000517697334 926800599 /nfs/dbraw/zinc/80/05/99/926800599.db2.gz ONRSCWKYDUXEMO-GHTZIAJQSA-N 0 3 402.897 4.294 20 0 HIADHN Cc1cc(C)c(NC(=O)CN(C)C(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)c(C)c1 ZINC000517789202 926836747 /nfs/dbraw/zinc/83/67/47/926836747.db2.gz HLEQPEAVKJYJOG-RBBKRZOGSA-N 0 3 422.573 4.027 20 0 HIADHN Cc1cc(C)c(NC(=O)CN(C)C(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)c(C)c1 ZINC000517789199 926837135 /nfs/dbraw/zinc/83/71/35/926837135.db2.gz HLEQPEAVKJYJOG-IRLDBZIGSA-N 0 3 422.573 4.027 20 0 HIADHN CC(=O)Nc1ccc(S[C@H](C)C(=O)N(CCN(C)C)CC2CCCCC2)cc1 ZINC000517823356 926853150 /nfs/dbraw/zinc/85/31/50/926853150.db2.gz CGLYKBZYCXHVDA-QGZVFWFLSA-N 0 3 405.608 4.096 20 0 HIADHN COCc1cccc2sc(NC(=O)c3ccc(N4CCN(C(C)C)CC4)cc3)nc21 ZINC000517851684 926863723 /nfs/dbraw/zinc/86/37/23/926863723.db2.gz AZYKRCLNTOPCPX-UHFFFAOYSA-N 0 3 424.570 4.225 20 0 HIADHN CC(=O)NCC[C@H]1CCCN(c2c(C)c(C)nc3ccc(Br)cc32)C1 ZINC000517995988 926937726 /nfs/dbraw/zinc/93/77/26/926937726.db2.gz GCOJJIUJNSCNQA-MRXNPFEDSA-N 0 3 404.352 4.357 20 0 HIADHN Cc1ccc(-n2ncc(C(=O)NCCN3CCC[C@H](C)C3)c2C2CC2)cc1Cl ZINC000518045012 926983939 /nfs/dbraw/zinc/98/39/39/926983939.db2.gz SXSFOHOBTWOFFD-HNNXBMFYSA-N 0 3 400.954 4.173 20 0 HIADHN CC1CCN([C@H](CNC(=O)NC[C@@H]2CCOc3ccccc32)c2cccs2)CC1 ZINC000518211843 927083050 /nfs/dbraw/zinc/08/30/50/927083050.db2.gz GHRQBSHTPNMUOF-AZUAARDMSA-N 0 3 413.587 4.387 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@H](C)NCc2ccccc2COC(C)C)cc1 ZINC000518231341 927092543 /nfs/dbraw/zinc/09/25/43/927092543.db2.gz DKZMQZFAZOHFOY-IBGZPJMESA-N 0 3 418.603 4.493 20 0 HIADHN C[C@H](Cn1cncn1)NCc1cccc(NC(=O)c2ccc(Cl)cc2Cl)c1 ZINC000518276534 927133254 /nfs/dbraw/zinc/13/32/54/927133254.db2.gz ADBGVFBIOOXMIR-CYBMUJFWSA-N 0 3 404.301 4.016 20 0 HIADHN CCC[C@@H](NCc1cccc(OC(F)(F)F)c1)C(=O)N1CCc2sccc2C1 ZINC000518279890 927137319 /nfs/dbraw/zinc/13/73/19/927137319.db2.gz HGBAOACBRGTDEK-QGZVFWFLSA-N 0 3 412.477 4.490 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)Nc3ccccc3OC3CCCC3)CC2)C[C@H](C)O1 ZINC000518314525 927176773 /nfs/dbraw/zinc/17/67/73/927176773.db2.gz KRDXJDQZBUTPHB-OALUTQOASA-N 0 3 415.578 4.361 20 0 HIADHN CCN(C(=O)c1nc(SC)ncc1Cl)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000518339965 927203925 /nfs/dbraw/zinc/20/39/25/927203925.db2.gz MKLQUTSWGBWXBW-GOEBONIOSA-N 0 3 404.967 4.150 20 0 HIADHN NC(=O)CCN(C(=O)CN1CCC[C@@H]1c1cccc2ccccc21)c1ccc(F)cc1 ZINC000518349379 927213491 /nfs/dbraw/zinc/21/34/91/927213491.db2.gz ONMUIQVALVODKH-HSZRJFAPSA-N 0 3 419.500 4.024 20 0 HIADHN Cc1nc(COc2cccc(C(=O)N[C@@H](CN(C)C)c3ccc(F)cc3)c2)cs1 ZINC000518353903 927216871 /nfs/dbraw/zinc/21/68/71/927216871.db2.gz QEZVXNFJDUXXBM-NRFANRHFSA-N 0 3 413.518 4.202 20 0 HIADHN Cc1nn(-c2ccc(Cl)c(Cl)c2)c(C)c1CC(=O)N(C)[C@H]1CCN(C2CC2)C1 ZINC000518366559 927223566 /nfs/dbraw/zinc/22/35/66/927223566.db2.gz ZNFTXTNOSHDORF-KRWDZBQOSA-N 0 3 421.372 4.034 20 0 HIADHN CC(C)n1ncc2c1nc(-c1cccs1)cc2C(=O)N(C)[C@H]1CCN(C2CC2)C1 ZINC000518364993 927223835 /nfs/dbraw/zinc/22/38/35/927223835.db2.gz OQDBOGJYQDRKOT-INIZCTEOSA-N 0 3 409.559 4.049 20 0 HIADHN CN1CCN(c2ccncc2NC(=O)c2cc(-c3ccccc3)ccc2Cl)CC1 ZINC000518376238 927228882 /nfs/dbraw/zinc/22/88/82/927228882.db2.gz SWCBGBDJUHVTSW-UHFFFAOYSA-N 0 3 406.917 4.406 20 0 HIADHN CC(=O)Nc1cccc([C@H](C)NC(=O)[C@H](C)N2CCC(Cc3ccccc3)CC2)c1 ZINC000518389242 927235434 /nfs/dbraw/zinc/23/54/34/927235434.db2.gz KVVZYHXMUZHPSA-OALUTQOASA-N 0 3 407.558 4.165 20 0 HIADHN CC[C@H](NC(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1)c1ccc2c(c1)OCCO2 ZINC000518406878 927247189 /nfs/dbraw/zinc/24/71/89/927247189.db2.gz JTCIYGHYRXCRJZ-WMQCIHAUSA-N 0 3 409.530 4.044 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N(Cc2ccccc2)C[C@H]2CCCO2)C1 ZINC000518406784 927247336 /nfs/dbraw/zinc/24/73/36/927247336.db2.gz CMFIVKBFOGCWRW-FGCOXFRFSA-N 0 3 407.558 4.213 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N(Cc2cccs2)C[C@H]2CCCO2)C1 ZINC000518410363 927249882 /nfs/dbraw/zinc/24/98/82/927249882.db2.gz OARMBNWXJQZMFL-HMXCVIKNSA-N 0 3 413.587 4.274 20 0 HIADHN CC(C)c1nc(C(=O)N(CCN(C)C)C2CCCCC2)nn1-c1ccccc1Cl ZINC000518428772 927264754 /nfs/dbraw/zinc/26/47/54/927264754.db2.gz XOEVBGUVSKCSEZ-UHFFFAOYSA-N 0 3 417.985 4.381 20 0 HIADHN C[C@@H](C(=O)Nc1cccc(N2CCCC2=O)c1)N1CCC[C@@H](Cc2ccccc2)C1 ZINC000518514981 927320221 /nfs/dbraw/zinc/32/02/21/927320221.db2.gz HHWHMTFHJIBJHL-FPOVZHCZSA-N 0 3 405.542 4.095 20 0 HIADHN Cc1ccc2sc(C(=O)Nc3ccccc3CN3CCC[C@H](C(N)=O)C3)cc2c1 ZINC000518699537 927441565 /nfs/dbraw/zinc/44/15/65/927441565.db2.gz YUIMJYQKLJCXLP-KRWDZBQOSA-N 0 3 407.539 4.159 20 0 HIADHN COc1cc(CNCCNC(=O)c2ccc(C)cc2)ccc1OCc1ccccc1 ZINC000518814111 927509380 /nfs/dbraw/zinc/50/93/80/927509380.db2.gz OMGLWXIPMMLEHS-UHFFFAOYSA-N 0 3 404.510 4.102 20 0 HIADHN COc1ccccc1CC(C)(C)C(=O)NC[C@@H](c1ccc(SC)cc1)N(C)C ZINC000518825892 927522523 /nfs/dbraw/zinc/52/25/23/927522523.db2.gz MGQXQCBBMNJZIZ-FQEVSTJZSA-N 0 3 400.588 4.405 20 0 HIADHN CSc1ccc(Cl)cc1NC(=O)N1CCC(CN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000518838699 927539009 /nfs/dbraw/zinc/53/90/09/927539009.db2.gz LHQMEZBTXYDUPX-GJZGRUSLSA-N 0 3 411.999 4.415 20 0 HIADHN OCCCN(Cc1ccc(Cl)c(Cl)c1)C[C@H](O)COc1ccccc1Cl ZINC000518839863 927540748 /nfs/dbraw/zinc/54/07/48/927540748.db2.gz XRHCAGUJZKFTKZ-HNNXBMFYSA-N 0 3 418.748 4.271 20 0 HIADHN C[C@@H](CNC(=O)c1cccc(C(=O)N(C)c2ccccc2)c1)N(C)Cc1ccccc1 ZINC000518909762 927618571 /nfs/dbraw/zinc/61/85/71/927618571.db2.gz DCFCYJRQZDOSOV-FQEVSTJZSA-N 0 3 415.537 4.214 20 0 HIADHN CC[C@@H](NC(=O)NCC(C)(C)N1CCc2ccccc2C1)c1ccc2c(c1)OCCO2 ZINC000519014489 927693457 /nfs/dbraw/zinc/69/34/57/927693457.db2.gz RLFGJIAAPYPMTE-OAQYLSRUSA-N 0 3 423.557 4.045 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)Nc2cccc([C@@H](C)N3CCOCC3)c2)N(C)C)cc1 ZINC000519199225 927823280 /nfs/dbraw/zinc/82/32/80/927823280.db2.gz SXTYPRAVDIQBTM-NTKDMRAZSA-N 0 3 424.589 4.067 20 0 HIADHN COCCN(CCN(C)C)C(=O)N[C@H](c1cccc(C(F)(F)F)c1)C(C)(C)C ZINC000519206948 927828185 /nfs/dbraw/zinc/82/81/85/927828185.db2.gz GHEOLADPVSLGQB-QGZVFWFLSA-N 0 3 403.489 4.012 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)N1CCC[C@@H]1Cc1cccc(F)c1 ZINC000519250839 927847256 /nfs/dbraw/zinc/84/72/56/927847256.db2.gz LZZGBJCCYVHDIY-UXHICEINSA-N 0 3 401.551 4.441 20 0 HIADHN CCN(CC)[C@H](CNc1nc(C)nc2sc(C(=O)OC)c(C)c21)c1ccco1 ZINC000519289745 927864683 /nfs/dbraw/zinc/86/46/83/927864683.db2.gz UBLURUJJKZGVIH-CQSZACIVSA-N 0 3 402.520 4.183 20 0 HIADHN CC1CCN([C@H](CNC(=O)N2CCCC[C@@H]2c2ncc[nH]2)c2cccs2)CC1 ZINC000519293915 927866820 /nfs/dbraw/zinc/86/68/20/927866820.db2.gz XYDNPUWZRWCEEW-QZTJIDSGSA-N 0 3 401.580 4.181 20 0 HIADHN COc1ccc([C@@H](CNC(=O)Cc2ccc(OCC(C)C)cc2)N2CCCC2)cc1 ZINC000519333825 927886598 /nfs/dbraw/zinc/88/65/98/927886598.db2.gz ICDMPXSBPYVUTJ-XMMPIXPASA-N 0 3 410.558 4.226 20 0 HIADHN CC(C)c1ncc(Cl)c(C(=O)NC[C@H](C(C)C)N2CCc3ccccc3C2)n1 ZINC000519401542 927924315 /nfs/dbraw/zinc/92/43/15/927924315.db2.gz OCSUSRRJTMHXAF-LJQANCHMSA-N 0 3 400.954 4.066 20 0 HIADHN Cc1ccc(Cc2nnc(NC(=O)NC[C@@H](c3ccc(C)cc3)N(C)C)s2)cc1 ZINC000519451205 927959017 /nfs/dbraw/zinc/95/90/17/927959017.db2.gz TYNGNTARPIXQQA-IBGZPJMESA-N 0 3 409.559 4.170 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2ccc(C)c(C(=O)NC(C)C)c2)N2CCCC2)cc1 ZINC000519498268 927992630 /nfs/dbraw/zinc/99/26/30/927992630.db2.gz AADAOAZWDQXLCS-HSZRJFAPSA-N 0 3 422.573 4.400 20 0 HIADHN COc1cccc([C@H](CNC(=O)Nc2cc(-c3nnco3)ccc2C)N2CCCC2)c1 ZINC000519567679 928019268 /nfs/dbraw/zinc/01/92/68/928019268.db2.gz LIEZJTCGESABJT-NRFANRHFSA-N 0 3 421.501 4.012 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@@H](C)c1n[nH]c(C(C)C)n1)c1ccccc1Cl ZINC000519651439 928035260 /nfs/dbraw/zinc/03/52/60/928035260.db2.gz GKVWJIQPEWKPCH-WMLDXEAASA-N 0 3 406.962 4.025 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)NCc1cc(-c2ccccc2)on1 ZINC000519643115 928035751 /nfs/dbraw/zinc/03/57/51/928035751.db2.gz DCUAWVKGJZMCCZ-UHFFFAOYSA-N 0 3 406.530 4.048 20 0 HIADHN CSc1ccc([C@@H](CNC(=O)c2ccc3nc(C(F)(F)F)cn3c2)N(C)C)cc1 ZINC000519778725 928073184 /nfs/dbraw/zinc/07/31/84/928073184.db2.gz BIPDXXIUHSRBKU-MRXNPFEDSA-N 0 3 422.476 4.108 20 0 HIADHN Cc1ccc(-c2ccnn2C)cc1NC(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000519816607 928085369 /nfs/dbraw/zinc/08/53/69/928085369.db2.gz XTKLHJXBXGMAPN-FQEVSTJZSA-N 0 3 424.495 4.491 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)NCc1ccccc1C(F)(F)F ZINC000519922250 928154245 /nfs/dbraw/zinc/15/42/45/928154245.db2.gz ATHOOCDPRDARKZ-UHFFFAOYSA-N 0 3 415.406 4.257 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)CSCc1cc(-c2cccs2)on1 ZINC000519936432 928169266 /nfs/dbraw/zinc/16/92/66/928169266.db2.gz WKDGWBQQKQRVSU-UHFFFAOYSA-N 0 3 417.556 4.345 20 0 HIADHN Cc1cc(C(=O)NC(C)C)ccc1NC(=O)NCC(C)(C)N1CCc2ccccc2C1 ZINC000519972513 928198805 /nfs/dbraw/zinc/19/88/05/928198805.db2.gz FWSNSUJYTGDNCL-UHFFFAOYSA-N 0 3 422.573 4.092 20 0 HIADHN C[C@H](NC(=O)N1CCN(CC2CCCCC2)CC1)c1ccc(NC(=O)C2CC2)cc1 ZINC000520086256 928302861 /nfs/dbraw/zinc/30/28/61/928302861.db2.gz FBHPEBVOPAJODV-SFHVURJKSA-N 0 3 412.578 4.004 20 0 HIADHN Cc1c(C(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)sc2nccc(C)c12 ZINC000520105189 928313487 /nfs/dbraw/zinc/31/34/87/928313487.db2.gz GMLVBJRKZAHZDI-UHFFFAOYSA-N 0 3 403.498 4.395 20 0 HIADHN Cc1cc(C(=O)N(CCN(C)C)c2ccccc2)cc(C)c1OCc1cccnc1 ZINC000520166600 928356980 /nfs/dbraw/zinc/35/69/80/928356980.db2.gz BTJRCMBCAGNWIT-UHFFFAOYSA-N 0 3 403.526 4.486 20 0 HIADHN CCN(C(=O)NCC1(N2CCSCC2)CCCC1)[C@H](C)Cc1ccc(OC)cc1 ZINC000520197803 928383223 /nfs/dbraw/zinc/38/32/23/928383223.db2.gz PPGLJJWMJCVBOX-LJQANCHMSA-N 0 3 419.635 4.019 20 0 HIADHN CC[C@@H](NCc1ccnc2ccccc12)c1ccccc1OCC(=O)N1CCCC1 ZINC000520201883 928386923 /nfs/dbraw/zinc/38/69/23/928386923.db2.gz ZJLXRNVNCXRYQR-JOCHJYFZSA-N 0 3 403.526 4.477 20 0 HIADHN CNC(=O)c1ccc(CN[C@H](Cc2ccc(OC)cc2)c2ccc(OC)cc2)cc1 ZINC000520208302 928389917 /nfs/dbraw/zinc/38/99/17/928389917.db2.gz DSTLTZWRGBTBGB-XMMPIXPASA-N 0 3 404.510 4.137 20 0 HIADHN COc1ccc([C@H](Cc2ccc(F)cc2)NCc2ccc(S(C)(=O)=O)cc2)cc1 ZINC000520218045 928395926 /nfs/dbraw/zinc/39/59/26/928395926.db2.gz YJOYZADORVZWQG-QHCPKHFHSA-N 0 3 413.514 4.311 20 0 HIADHN C[C@@H](C(=O)NC1CCC(C)CC1)N(C)CCCc1cc(-c2cccc(F)c2)n[nH]1 ZINC000520287670 928450244 /nfs/dbraw/zinc/45/02/44/928450244.db2.gz BNJYNUBMTUWUJL-GNZRSQJKSA-N 0 3 400.542 4.164 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N(C)CC(=O)Nc2c(C)cccc2C)N2CCCC2)cc1 ZINC000520296715 928458140 /nfs/dbraw/zinc/45/81/40/928458140.db2.gz FWTHPMYIQGRNBU-JOCHJYFZSA-N 0 3 422.573 4.029 20 0 HIADHN C[C@H](NC(=O)NC[C@H](C)N(C)Cc1ccccc1)c1nc2ccccc2n1C(F)F ZINC000520380582 928533737 /nfs/dbraw/zinc/53/37/37/928533737.db2.gz BIQOVYPZVXBWRU-HOTGVXAUSA-N 0 3 415.488 4.312 20 0 HIADHN COc1cccc(CN(CCC(=O)N[C@H]2CCCc3ccccc32)C[C@@H]2CCCO2)c1 ZINC000520392081 928544582 /nfs/dbraw/zinc/54/45/82/928544582.db2.gz JDSYTZKSWAVVDJ-ZCYQVOJMSA-N 0 3 422.569 4.260 20 0 HIADHN CC[C@H](CNC(=O)Cc1coc(-c2ccc(Cl)cc2)n1)N1CCc2ccccc2C1 ZINC000520511442 928610558 /nfs/dbraw/zinc/61/05/58/928610558.db2.gz ZDNIMKFFSYAKAM-JOCHJYFZSA-N 0 3 423.944 4.491 20 0 HIADHN CCN(CC(=O)N1N=C(c2cccs2)C[C@H]1c1ccco1)[C@@H]1CCOC(C)(C)C1 ZINC000520664800 928708787 /nfs/dbraw/zinc/70/87/87/928708787.db2.gz AFTZVASAOVWSEZ-AEFFLSMTSA-N 0 3 415.559 4.298 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)N[C@H]1C[C@H]1c1cccc(Br)c1 ZINC000520781680 928814784 /nfs/dbraw/zinc/81/47/84/928814784.db2.gz WHOKQVLRPLTDCJ-PMACEKPBSA-N 0 3 416.363 4.078 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2nc(CN3CCC[C@H](C)C3)cs2)N(C)C)cc1 ZINC000520830065 928835871 /nfs/dbraw/zinc/83/58/71/928835871.db2.gz JTKWRIWZLWCXNL-FXAWDEMLSA-N 0 3 415.607 4.108 20 0 HIADHN C[C@@H]1CCN(C(=O)CN2CCN(CC3CCCCC3)CC2)c2ccccc2S1 ZINC000520851286 928843561 /nfs/dbraw/zinc/84/35/61/928843561.db2.gz GHZKYMDNEGWBPX-LJQANCHMSA-N 0 3 401.620 4.102 20 0 HIADHN COc1ccc(CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)[C@@H](C)C2CC2)cc1 ZINC000520905993 928868729 /nfs/dbraw/zinc/86/87/29/928868729.db2.gz NYHKTVRBMQWJPH-CVDCTZTESA-N 0 3 407.558 4.280 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N(CCc2ccccc2)Cc2cccnc2)N(C)C)cc1 ZINC000520937183 928882743 /nfs/dbraw/zinc/88/27/43/928882743.db2.gz ZAZFDPOVSKGDEJ-RUZDIDTESA-N 0 3 416.569 4.447 20 0 HIADHN O[C@H](CNCc1cc(Br)ccc1OCc1ccccn1)C1CCCCC1 ZINC000520963409 928891872 /nfs/dbraw/zinc/89/18/72/928891872.db2.gz ISNXYGAEFDEKAX-HXUWFJFHSA-N 0 3 419.363 4.454 20 0 HIADHN CC(C)c1ncc(Cl)c(C(=O)N[C@H](CN2CCc3ccccc3C2)C(C)(C)C)n1 ZINC000520967518 928894216 /nfs/dbraw/zinc/89/42/16/928894216.db2.gz DOBMKCOIXPBQBH-LJQANCHMSA-N 0 3 414.981 4.456 20 0 HIADHN CCOCCOCc1cccc(NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)c1 ZINC000521008917 928924380 /nfs/dbraw/zinc/92/43/80/928924380.db2.gz ROVVGDNIZVUORA-OAQYLSRUSA-N 0 3 414.521 4.230 20 0 HIADHN O=C(c1ccc(Cn2cccn2)cc1)N(CCN1CCCC1)Cc1ccc(Cl)cc1 ZINC000521054040 928962846 /nfs/dbraw/zinc/96/28/46/928962846.db2.gz CJEPKXXLSIWBBH-UHFFFAOYSA-N 0 3 422.960 4.323 20 0 HIADHN COc1ccc(CNC2(c3cccc(Br)c3)CCOCC2)cc1OC ZINC000521064426 928968981 /nfs/dbraw/zinc/96/89/81/928968981.db2.gz GTAGQYQNDHSYSD-UHFFFAOYSA-N 0 3 406.320 4.262 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)N[C@@H]1CCSc2c(F)cccc21 ZINC000521067195 928970520 /nfs/dbraw/zinc/97/05/20/928970520.db2.gz CDTXUMQIVKLTFD-LJQANCHMSA-N 0 3 423.504 4.414 20 0 HIADHN Cc1cc(C)n(-c2cccc(NC(=O)N(CCN(C)C)Cc3cccc(F)c3)c2)n1 ZINC000521071902 928973320 /nfs/dbraw/zinc/97/33/20/928973320.db2.gz DKIHYPLMHPXCHR-UHFFFAOYSA-N 0 3 409.509 4.224 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)[C@H](C)c2cn(C)c3ccccc23)N(C)C)cc1 ZINC000521099046 928994038 /nfs/dbraw/zinc/99/40/38/928994038.db2.gz RGMJOPONTSVWIX-KOSHJBKYSA-N 0 3 407.558 4.488 20 0 HIADHN CCc1ccc(-c2nc(CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)cs2)cc1 ZINC000521106318 928998182 /nfs/dbraw/zinc/99/81/82/928998182.db2.gz JWZSJCJSOQHPNG-OAQYLSRUSA-N 0 3 405.567 4.306 20 0 HIADHN CN(C(=O)c1ccccc1-c1ncc(-c2ccccc2F)o1)[C@H]1CCN(C2CC2)C1 ZINC000521151819 929026949 /nfs/dbraw/zinc/02/69/49/929026949.db2.gz UXGYLZDVMLAXPR-KRWDZBQOSA-N 0 3 405.473 4.456 20 0 HIADHN C[C@@H](CNC(=O)NCc1cccnc1Oc1cccc(F)c1)N(C)Cc1ccccc1 ZINC000521161894 929033860 /nfs/dbraw/zinc/03/38/60/929033860.db2.gz COGHNKDDHOXYOI-SFHVURJKSA-N 0 3 422.504 4.333 20 0 HIADHN COc1ccc(-c2nc(C(=O)N(CCN(C)C)c3ccccc3)cs2)cc1OC ZINC000521182595 929047769 /nfs/dbraw/zinc/04/77/69/929047769.db2.gz NSIWIOMAIHTPOS-UHFFFAOYSA-N 0 3 411.527 4.036 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)N1CC[C@H](c2ccc(Cl)cc2)C1 ZINC000521181721 929048712 /nfs/dbraw/zinc/04/87/12/929048712.db2.gz SJCFUDHNOBLRPH-NRFANRHFSA-N 0 3 411.977 4.258 20 0 HIADHN COc1cccc([C@@H](CNC(=O)Nc2ccc3c(c2)OC(C)(C)O3)N2CCCC2)c1 ZINC000521267833 929090838 /nfs/dbraw/zinc/09/08/38/929090838.db2.gz AKYYAVNYNUSMJL-LJQANCHMSA-N 0 3 411.502 4.161 20 0 HIADHN CC[C@H](Cc1ccc(Cl)cc1Cl)NC(=O)N(CCN(C)C)Cc1ccccn1 ZINC000521300077 929110308 /nfs/dbraw/zinc/11/03/08/929110308.db2.gz OJFOFEZBOYFAFT-GOSISDBHSA-N 0 3 423.388 4.483 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2ccccc2CN2C[C@@H](C)O[C@H](C)C2)N(C)C)cc1 ZINC000521463267 929233179 /nfs/dbraw/zinc/23/31/79/929233179.db2.gz IKOYODMOWQTFKZ-REHUZNOOSA-N 0 3 424.589 4.029 20 0 HIADHN COc1ccc(Cl)cc1NCCC(=O)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000521532961 929277924 /nfs/dbraw/zinc/27/79/24/929277924.db2.gz GXPGPICJKCCCBA-FQEVSTJZSA-N 0 3 401.938 4.104 20 0 HIADHN Cn1[n-]c(=O)c2c1nc(C1CC1)cc2C(=O)Nc1ccc(C[NH+]2CCCCCC2)cc1 ZINC000521588046 929313366 /nfs/dbraw/zinc/31/33/66/929313366.db2.gz OYAATMHVMKNBNJ-UHFFFAOYSA-N 0 3 419.529 4.180 20 0 HIADHN C[C@@H](CCc1ccc(O)cc1)NC(=O)N(CCN(C)C)Cc1cccc(Cl)c1 ZINC000521687038 929366494 /nfs/dbraw/zinc/36/64/94/929366494.db2.gz FOQFDIYISKULKR-KRWDZBQOSA-N 0 3 403.954 4.140 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)N[C@H]1CCCOc2ccc(F)cc21 ZINC000521687025 929366607 /nfs/dbraw/zinc/36/66/07/929366607.db2.gz CXHBSZAXJFCKSE-FQEVSTJZSA-N 0 3 421.463 4.091 20 0 HIADHN COc1cccc([C@H](CNC(=O)NC(C)(C)c2nc(C)c(C)s2)N2CCCC2)c1 ZINC000521686363 929366801 /nfs/dbraw/zinc/36/68/01/929366801.db2.gz VJGHOAWXHUAIDH-IBGZPJMESA-N 0 3 416.591 4.140 20 0 HIADHN CC(C)(CNC(=O)NCCCc1c[nH]c2ccccc12)N1CCc2ccccc2C1 ZINC000521697952 929372450 /nfs/dbraw/zinc/37/24/50/929372450.db2.gz MNOLVKMBEVLTRI-UHFFFAOYSA-N 0 3 404.558 4.237 20 0 HIADHN C[C@@H](CNC(=O)c1oc2ccccc2c1CSc1ncccn1)N1CCC[C@@H](C)C1 ZINC000521706163 929378656 /nfs/dbraw/zinc/37/86/56/929378656.db2.gz ZLOVNRYJIYSJKW-SJORKVTESA-N 0 3 424.570 4.365 20 0 HIADHN Cc1[nH]c2ccc(Br)cc2c1CC(=O)N(CCN(C)C)c1ccccc1 ZINC000521804450 929464500 /nfs/dbraw/zinc/46/45/00/929464500.db2.gz GGCWKKQWZMXNHR-UHFFFAOYSA-N 0 3 414.347 4.376 20 0 HIADHN CCCN(CC(=O)NCc1ccc(C(=O)N2CCCC2)cc1)[C@@H](CC)c1ccccc1 ZINC000521820109 929477382 /nfs/dbraw/zinc/47/73/82/929477382.db2.gz VIGROGVSPJHPDE-DEOSSOPVSA-N 0 3 421.585 4.402 20 0 HIADHN C[C@H](C(=O)N[C@H]1CCCC[C@H]1C)N(C)CCCc1cc(-c2cccc(F)c2)n[nH]1 ZINC000521902747 929548210 /nfs/dbraw/zinc/54/82/10/929548210.db2.gz NBPQDJUOYBLGJR-LZJOCLMNSA-N 0 3 400.542 4.164 20 0 HIADHN Cc1nc(-c2ccc(F)cc2)sc1C(=O)NCC1(N2CCCCC2)CCOCC1 ZINC000521916135 929559585 /nfs/dbraw/zinc/55/95/85/929559585.db2.gz WMVIJTZMFYOTEG-UHFFFAOYSA-N 0 3 417.550 4.023 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccc(F)c2)C1)N(Cc1ccccc1)CC1CCOCC1 ZINC000521981020 929609297 /nfs/dbraw/zinc/60/92/97/929609297.db2.gz JOVKGTNIBJHDEB-XMMPIXPASA-N 0 3 424.560 4.493 20 0 HIADHN COc1ccc(-c2nc(C(=O)N(CCN(C)C)C3CCCCC3)cs2)cc1OC ZINC000522029369 929623967 /nfs/dbraw/zinc/62/39/67/929623967.db2.gz SBGPVRANEMJWNK-UHFFFAOYSA-N 0 3 417.575 4.164 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)NCc2ccc(Br)s2)c1 ZINC000524517667 929662244 /nfs/dbraw/zinc/66/22/44/929662244.db2.gz PUARJJNEXQRYER-UHFFFAOYSA-N 0 3 410.381 4.092 20 0 HIADHN CC1CCC(N2CCN(C(=O)c3ccc(NC(=O)c4cccs4)cc3)CC2)CC1 ZINC000524544176 929675282 /nfs/dbraw/zinc/67/52/82/929675282.db2.gz IRRZLIZRGQTKAF-UHFFFAOYSA-N 0 3 411.571 4.337 20 0 HIADHN CCOc1ccc(S(=O)(=O)N(C)[C@H]2CCN(Cc3ccccc3)[C@@H](C)C2)c(C)c1 ZINC000524587703 929700760 /nfs/dbraw/zinc/70/07/60/929700760.db2.gz XZXLDGLPLLGLHA-FPOVZHCZSA-N 0 3 416.587 4.067 20 0 HIADHN CC[C@@H](CNC(=O)NCc1nc(C(C)(C)C)cs1)N1CCc2ccccc2C1 ZINC000524590839 929701986 /nfs/dbraw/zinc/70/19/86/929701986.db2.gz RAOFEORORACHJD-SFHVURJKSA-N 0 3 400.592 4.077 20 0 HIADHN CC(C)c1ccc(-c2nc(C(=O)N(CCN(C)C)C[C@H]3CCCO3)cs2)cc1 ZINC000524591222 929702915 /nfs/dbraw/zinc/70/29/15/929702915.db2.gz CVDNZCGUOBFJFE-LJQANCHMSA-N 0 3 401.576 4.116 20 0 HIADHN Cc1ccccc1[C@H]1C[C@H](C)N(CC(=O)N2CCC(C(=O)Nc3ccccc3)CC2)C1 ZINC000524593661 929703830 /nfs/dbraw/zinc/70/38/30/929703830.db2.gz LENUGOBKEUVFSG-UNMCSNQZSA-N 0 3 419.569 4.050 20 0 HIADHN CCN(Cc1ccc(OC)c(OC)c1)C(=O)CN1C[C@@H](c2ccccc2C)C[C@H]1C ZINC000524595897 929704761 /nfs/dbraw/zinc/70/47/61/929704761.db2.gz ZBBRAPAIGROLHF-CTNGQTDRSA-N 0 3 410.558 4.239 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)N[C@H](c1ccccc1)c1ccccn1 ZINC000524630529 929739910 /nfs/dbraw/zinc/73/99/10/929739910.db2.gz KKUBSWPMLXHREM-SQJMNOBHSA-N 0 3 414.553 4.477 20 0 HIADHN CC(C)(C)c1csc(CNC(=O)NCC(C)(C)N2CCc3ccccc3C2)n1 ZINC000524657337 929769475 /nfs/dbraw/zinc/76/94/75/929769475.db2.gz QEXVXEDMDPXZDR-UHFFFAOYSA-N 0 3 400.592 4.077 20 0 HIADHN CCN(CC)C(=O)COc1ccc(NC(=O)[C@@H](C(C)C)N2CCCCC2)cc1Cl ZINC000524705900 929805845 /nfs/dbraw/zinc/80/58/45/929805845.db2.gz XYQVRWHVQHQCDX-OAQYLSRUSA-N 0 3 423.985 4.036 20 0 HIADHN CC[C@@H](CNC(=O)NCc1ccc(-c2ccncc2)cc1)N1CCc2ccccc2C1 ZINC000524724067 929810875 /nfs/dbraw/zinc/81/08/75/929810875.db2.gz SAZFDZLFORXQRH-VWLOTQADSA-N 0 3 414.553 4.385 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)CN2C[C@H](c3ccccc3)C[C@@H]2C)c(OC)c1 ZINC000524755281 929820272 /nfs/dbraw/zinc/82/02/72/929820272.db2.gz MDAORBFWRJKKLA-NOXFTYBFSA-N 0 3 408.542 4.245 20 0 HIADHN CC[C@@H](Cc1ccccc1)N(C)CC(=O)N1CCC[C@@H]1c1ccc(OC)cc1OC ZINC000524758179 929820864 /nfs/dbraw/zinc/82/08/64/929820864.db2.gz DZUJLGCBBBIVAM-NZQKXSOJSA-N 0 3 410.558 4.320 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCc1ncc(C)s1)c1ccc(C(F)(F)F)cc1 ZINC000524781822 929827949 /nfs/dbraw/zinc/82/79/49/929827949.db2.gz JVYJSGGFUPXXAW-MRXNPFEDSA-N 0 3 414.497 4.353 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2ccc(O[C@@H]3CCOC3)cc2)N2CCCC2)cc1 ZINC000524799539 929834247 /nfs/dbraw/zinc/83/42/47/929834247.db2.gz HAHTUJVUWUKABU-PKTZIBPZSA-N 0 3 409.530 4.121 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)c1cnn(-c2ccccc2)c1C1CC1 ZINC000524864353 929863893 /nfs/dbraw/zinc/86/38/93/929863893.db2.gz NQCSXTSUDJUTPR-HXUWFJFHSA-N 0 3 414.553 4.486 20 0 HIADHN CC[C@H](C)n1ncc2c1nc(C)cc2C(=O)N1CCCN(Cc2ccccc2)C[C@H]1C ZINC000524866850 929865125 /nfs/dbraw/zinc/86/51/25/929865125.db2.gz JZCWNYMSBVVKNK-VQTJNVASSA-N 0 3 419.573 4.447 20 0 HIADHN CC(=O)c1cccc(OCCCC(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)c1 ZINC000524876813 929868355 /nfs/dbraw/zinc/86/83/55/929868355.db2.gz KVMMXALKTKSZAU-HXUWFJFHSA-N 0 3 408.542 4.171 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)NCCCCOCc1ccccc1 ZINC000524881305 929870502 /nfs/dbraw/zinc/87/05/02/929870502.db2.gz AWLQYVBGYXQOGB-JOCHJYFZSA-N 0 3 409.574 4.289 20 0 HIADHN Cc1cc(NC(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)n(Cc2ccccc2)n1 ZINC000524928026 929894746 /nfs/dbraw/zinc/89/47/46/929894746.db2.gz FQUFDYPCXHLZGN-OAQYLSRUSA-N 0 3 417.557 4.368 20 0 HIADHN O=C(N[C@H](COCc1ccccc1)c1ccccc1)N1CCN(C2CCCC2)CC1 ZINC000524928193 929894780 /nfs/dbraw/zinc/89/47/80/929894780.db2.gz MDEBZONTNMQGHA-XMMPIXPASA-N 0 3 407.558 4.214 20 0 HIADHN CN(C)[C@@H](CNC(=O)NC1(c2cccc(Br)c2)CC1)c1ccccc1 ZINC000524930904 929896249 /nfs/dbraw/zinc/89/62/49/929896249.db2.gz HNJGOQRETDSMLZ-SFHVURJKSA-N 0 3 402.336 4.040 20 0 HIADHN C[C@@H](CNC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C)COCc1ccccc1 ZINC000524931522 929896743 /nfs/dbraw/zinc/89/67/43/929896743.db2.gz CQUIKRXKOHHKNA-FCHUYYIVSA-N 0 3 409.574 4.145 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)Cc2csc3ccccc23)cc1)[C@@H]1CCCN(C)C1 ZINC000525065536 930012719 /nfs/dbraw/zinc/01/27/19/930012719.db2.gz ILTQHRGIQOHAMT-HXUWFJFHSA-N 0 3 421.566 4.249 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)Cc2ccc(NC(=O)CC(C)(C)C)cc2)o1 ZINC000525065397 930012934 /nfs/dbraw/zinc/01/29/34/930012934.db2.gz VDEOHISPUONJGF-UHFFFAOYSA-N 0 3 413.562 4.096 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)C23CC4CC(CC(C4)C2)C3)cc1)[C@H]1CCCN(C)C1 ZINC000525066500 930013634 /nfs/dbraw/zinc/01/36/34/930013634.db2.gz RGILHLTWVDTRNB-KIZRYQFWSA-N 0 3 409.574 4.008 20 0 HIADHN COc1cc(C(=O)N(C)[C@H]2CCCN(C)C2)ccc1OCc1ccccc1Cl ZINC000525101416 930035877 /nfs/dbraw/zinc/03/58/77/930035877.db2.gz QBCMSEYYWXATKQ-SFHVURJKSA-N 0 3 402.922 4.094 20 0 HIADHN C[C@@H](C(=O)Nc1cccc(N2CCCC2=O)c1)N1CC[C@H](c2ccccc2)[C@H](C)C1 ZINC000525122405 930049052 /nfs/dbraw/zinc/04/90/52/930049052.db2.gz FPUQAGIZWBDXMW-MSYCTHLASA-N 0 3 405.542 4.266 20 0 HIADHN C[C@H](C(=O)Nc1cccc(N2CCCC2=O)c1)N1CC[C@@H](c2ccccc2)[C@H](C)C1 ZINC000525122404 930049218 /nfs/dbraw/zinc/04/92/18/930049218.db2.gz FPUQAGIZWBDXMW-DNVFCKCGSA-N 0 3 405.542 4.266 20 0 HIADHN C[C@H]1CN(CC(=O)N(C)Cc2ccc(OC(F)F)cc2)CC[C@@H]1c1ccccc1 ZINC000525121738 930049330 /nfs/dbraw/zinc/04/93/30/930049330.db2.gz BYKSBNJBSLZHCO-UWJYYQICSA-N 0 3 402.485 4.372 20 0 HIADHN CCN(CC)C(=O)c1cccc(NC(=O)[C@H](C)N2CC[C@H](Cc3ccccc3)C2)c1 ZINC000525125913 930049809 /nfs/dbraw/zinc/04/98/09/930049809.db2.gz LBTZSFNDZXPWRB-PZJWPPBQSA-N 0 3 407.558 4.060 20 0 HIADHN CC(C)CN(CCN(C)C)C(=O)c1ccc(Oc2cccc(Cl)c2Cl)nn1 ZINC000525166972 930074035 /nfs/dbraw/zinc/07/40/35/930074035.db2.gz VIAFDFLEPFRZOP-UHFFFAOYSA-N 0 3 411.333 4.236 20 0 HIADHN Cc1ccc(CCN(Cc2ccco2)C(=O)[C@@H]2CCCN(Cc3cccnc3)C2)cc1 ZINC000525168996 930075056 /nfs/dbraw/zinc/07/50/56/930075056.db2.gz JFWOGMUKKIZBQN-XMMPIXPASA-N 0 3 417.553 4.467 20 0 HIADHN CC(C)(C)OC(=O)c1ccc(CNCc2c[nH]nc2-c2ccc3c(c2)OCO3)cc1 ZINC000525182443 930078800 /nfs/dbraw/zinc/07/88/00/930078800.db2.gz YREFOGQTMVKAJA-UHFFFAOYSA-N 0 3 407.470 4.051 20 0 HIADHN C[C@H](CNCc1ccc(Br)cn1)Oc1cccc(Br)c1 ZINC000525195575 930083069 /nfs/dbraw/zinc/08/30/69/930083069.db2.gz VQTJURTXMVVPPI-LLVKDONJSA-N 0 3 400.114 4.164 20 0 HIADHN COc1ccc([C@@H](CNC(=O)NCCc2cc3ccccc3o2)N2CCCC2)cc1 ZINC000525317817 930156089 /nfs/dbraw/zinc/15/60/89/930156089.db2.gz KMBXJZUAEHJQTA-JOCHJYFZSA-N 0 3 407.514 4.120 20 0 HIADHN Cc1onc(-c2ccccc2)c1C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000525334272 930171387 /nfs/dbraw/zinc/17/13/87/930171387.db2.gz OUWWMDXOSZCXOQ-UHFFFAOYSA-N 0 3 423.488 4.062 20 0 HIADHN CSc1ccc(O[C@@H](C)C(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)cc1 ZINC000525370776 930202003 /nfs/dbraw/zinc/20/20/03/930202003.db2.gz PODHMBMEMHSVDJ-HNNXBMFYSA-N 0 3 408.514 4.044 20 0 HIADHN Cc1ccc(C(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)cc1NC(=O)NC(C)(C)C ZINC000525371797 930202955 /nfs/dbraw/zinc/20/29/55/930202955.db2.gz SEFJAYUQPRKGRQ-WIYYLYMNSA-N 0 3 422.573 4.480 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)Cc1ccc(Br)cc1 ZINC000525385319 930210984 /nfs/dbraw/zinc/21/09/84/930210984.db2.gz TXDJPACRMPPEPP-KRWDZBQOSA-N 0 3 401.348 4.115 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)Cc1csc(-c2ccccc2)n1 ZINC000525384962 930211395 /nfs/dbraw/zinc/21/13/95/930211395.db2.gz NGIQLTXRDNLHFZ-LJQANCHMSA-N 0 3 405.567 4.476 20 0 HIADHN CCCN(Cc1cc(OC)c(OC)cc1Br)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000525410855 930224655 /nfs/dbraw/zinc/22/46/55/930224655.db2.gz MIZXWTAVGIGUEX-ZMYBRWDISA-N 0 3 412.368 4.492 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1ccc(OC[C@H]2CCCO2)cc1 ZINC000525412463 930225852 /nfs/dbraw/zinc/22/58/52/930225852.db2.gz AQJKYHFSJTWIRS-GBXCKJPGSA-N 0 3 423.557 4.373 20 0 HIADHN COc1ccc([C@@H](CNC(=O)Nc2ccc(-c3cc[nH]n3)cc2)N2CCCC2)cc1 ZINC000525414840 930227176 /nfs/dbraw/zinc/22/71/76/930227176.db2.gz MWYYLSGRQNVQFI-JOCHJYFZSA-N 0 3 405.502 4.044 20 0 HIADHN COC(=O)c1cc2cc(NC(=O)N3CCCN(Cc4ccccc4)C[C@H]3C)ccc2o1 ZINC000525418896 930229824 /nfs/dbraw/zinc/22/98/24/930229824.db2.gz MFJAGNDMWTXIJL-QGZVFWFLSA-N 0 3 421.497 4.348 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1ccccc1C(=O)N1CCCC1 ZINC000525453485 930249806 /nfs/dbraw/zinc/24/98/06/930249806.db2.gz DXVDQZZPVUIHPX-HXUWFJFHSA-N 0 3 420.557 4.051 20 0 HIADHN CCOc1cc(CN[C@H](C)[C@H]2CN(Cc3ccccc3)CCO2)cc(Cl)c1OC ZINC000525461661 930254507 /nfs/dbraw/zinc/25/45/07/930254507.db2.gz CUJYXSSSLVJYBI-VGOFRKELSA-N 0 3 418.965 4.126 20 0 HIADHN CN(C)Cc1cccc(C(=O)NCc2cc(Br)ccc2OC(F)F)c1 ZINC000525494051 930280110 /nfs/dbraw/zinc/28/01/10/930280110.db2.gz BKLCWSKAMGQIFQ-UHFFFAOYSA-N 0 3 413.262 4.042 20 0 HIADHN Cc1cccc(NC2CCN(C(=O)N[C@@H]3CCN([C@@H](C)c4ccccc4)C3)CC2)c1 ZINC000525498486 930285158 /nfs/dbraw/zinc/28/51/58/930285158.db2.gz ZBSNTLVWSKGXGR-GBXCKJPGSA-N 0 3 406.574 4.416 20 0 HIADHN CCN(CC)[C@H](CNC(=O)[C@H]1C[C@@H]1c1cccc(F)c1F)c1cccc(OC)c1 ZINC000525578729 930341626 /nfs/dbraw/zinc/34/16/26/930341626.db2.gz DNAAGZVSSDVPMY-SVFBPWRDSA-N 0 3 402.485 4.276 20 0 HIADHN CC[C@@H](CC(=O)Nc1ccc(C(=O)N(C)[C@@H]2CCCN(C)C2)cc1)c1ccccc1 ZINC000525581097 930343332 /nfs/dbraw/zinc/34/33/32/930343332.db2.gz GQEBUWQKLCRMJA-WMZHIEFXSA-N 0 3 407.558 4.375 20 0 HIADHN CC[C@H](CC(=O)Nc1ccc(C(=O)N(C)[C@@H]2CCCN(C)C2)cc1)c1ccccc1 ZINC000525581095 930343418 /nfs/dbraw/zinc/34/34/18/930343418.db2.gz GQEBUWQKLCRMJA-AUSIDOKSSA-N 0 3 407.558 4.375 20 0 HIADHN CC(C)(C)CC(=O)Nc1ccc(CC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000525581495 930343999 /nfs/dbraw/zinc/34/39/99/930343999.db2.gz BVZZJZQJIFSIFI-QHCPKHFHSA-N 0 3 421.585 4.385 20 0 HIADHN CN(C)[C@@H](CNC(=O)c1ccc(Sc2ccccc2Cl)nn1)c1ccccc1 ZINC000525619199 930366930 /nfs/dbraw/zinc/36/69/30/930366930.db2.gz AYKLZZQVNVNAEE-SFHVURJKSA-N 0 3 412.946 4.314 20 0 HIADHN Cc1ccc([C@H](CCn2cncn2)NCc2ccc(N3CCC(C)CC3)nc2)cc1 ZINC000525857882 930469409 /nfs/dbraw/zinc/46/94/09/930469409.db2.gz WPXXWWBNSDDQND-QHCPKHFHSA-N 0 3 404.562 4.139 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCCc3c[nH]c4cc(C)ccc34)c(C)c2)CC1 ZINC000525885144 930476719 /nfs/dbraw/zinc/47/67/19/930476719.db2.gz DEAQELKSIVMVAU-UHFFFAOYSA-N 0 3 419.573 4.291 20 0 HIADHN C[C@@H](NC(=O)C(=O)Nc1ccc2oc3ccccc3c2c1)[C@@H](c1ccccc1)N(C)C ZINC000525905195 930480211 /nfs/dbraw/zinc/48/02/11/930480211.db2.gz NXNXZGWKJPTCGE-MWTRTKDXSA-N 0 3 415.493 4.332 20 0 HIADHN C[C@H]1c2c(F)cccc2CCN1C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000525928411 930485529 /nfs/dbraw/zinc/48/55/29/930485529.db2.gz JBQDZGDXJKWRCB-IGEOTXOUSA-N 0 3 413.459 4.260 20 0 HIADHN CCn1ccnc1[C@H]1OCC[C@@H]1NCc1ccc(Br)cc1C(F)(F)F ZINC000525994896 930503343 /nfs/dbraw/zinc/50/33/43/930503343.db2.gz PSNVTSOHTZMGHH-GJZGRUSLSA-N 0 3 418.257 4.304 20 0 HIADHN O=C(c1ccccc1Cl)N1CCC(NCc2c(F)cccc2OC(F)F)CC1 ZINC000525997889 930504441 /nfs/dbraw/zinc/50/44/41/930504441.db2.gz NVFMCUYEWLYKNV-UHFFFAOYSA-N 0 3 412.839 4.475 20 0 HIADHN C[C@H]([NH2+]C1(CNC(=O)c2cc([O-])c3ccccc3c2)CCOCC1)c1ccccc1 ZINC000526893868 930548496 /nfs/dbraw/zinc/54/84/96/930548496.db2.gz JKVGUKUXWMCPJO-SFHVURJKSA-N 0 3 404.510 4.175 20 0 HIADHN C[C@H](CC(=O)Nc1ccc(Br)cc1)N[C@H]1CCOc2ccc(F)cc21 ZINC000527099696 930588458 /nfs/dbraw/zinc/58/84/58/930588458.db2.gz APKYMQAAKZNELB-PXAZEXFGSA-N 0 3 407.283 4.419 20 0 HIADHN Fc1cccnc1N1CC[C@@H](N[C@H](c2ccc(Br)cc2F)C2CC2)C1 ZINC000527282919 930625764 /nfs/dbraw/zinc/62/57/64/930625764.db2.gz PWUMIYGTRBNXRY-KDOFPFPSSA-N 0 3 408.290 4.442 20 0 HIADHN O=C(Nc1cccc(CN2CCC[C@H](OCCO)C2)c1)c1ccc(Cl)cc1Cl ZINC000527362780 930647367 /nfs/dbraw/zinc/64/73/67/930647367.db2.gz JTAUWUJZMPVFDX-SFHVURJKSA-N 0 3 423.340 4.219 20 0 HIADHN CNC(=O)c1ccc(CN[C@@H](c2ccc(F)c(F)c2)C(C)(C)N2CCCC2)cc1 ZINC000527504420 930670699 /nfs/dbraw/zinc/67/06/99/930670699.db2.gz GLLVWEICMFBHLY-NRFANRHFSA-N 0 3 401.501 4.030 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2ccc(C(=O)N3CCCCCC3)cc2)[C@H]1c1ccccc1 ZINC000530356916 930692345 /nfs/dbraw/zinc/69/23/45/930692345.db2.gz RJSHNVHDESKSLX-DHIUTWEWSA-N 0 3 420.557 4.270 20 0 HIADHN Cc1cc(NC(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)ccc1NC(=O)c1ccco1 ZINC000530409813 930705213 /nfs/dbraw/zinc/70/52/13/930705213.db2.gz OQSALKOHNMJQIR-IFMALSPDSA-N 0 3 418.497 4.407 20 0 HIADHN Fc1ccccc1C[C@@H](NCCc1cnccn1)c1ccccc1Br ZINC000530412671 930706099 /nfs/dbraw/zinc/70/60/99/930706099.db2.gz CZZASSHHAZMNGU-HXUWFJFHSA-N 0 3 400.295 4.494 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2cnn(Cc3ccc(Cl)cc3)c2)[C@@H]1c1ccccc1 ZINC000530512912 930731542 /nfs/dbraw/zinc/73/15/42/930731542.db2.gz OVYFXQSNTGAXAD-RTWAWAEBSA-N 0 3 409.921 4.152 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)c(C(F)(F)F)c1 ZINC000530515303 930734773 /nfs/dbraw/zinc/73/47/73/930734773.db2.gz VLMGWAUDLOZQQM-RTBURBONSA-N 0 3 420.435 4.231 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2cccc(OCc3cccnc3)c2)[C@@H]1c1ccccc1 ZINC000530515369 930735020 /nfs/dbraw/zinc/73/50/20/930735020.db2.gz DTINRNCOYGXBDV-GOTSBHOMSA-N 0 3 402.498 4.228 20 0 HIADHN O=C(CC1(N2CCOCC2)CCCC1)N1Cc2ccccc2[C@@H](c2ccccc2)C1 ZINC000530571722 930753870 /nfs/dbraw/zinc/75/38/70/930753870.db2.gz LVCJVGNTJNRJHY-XMMPIXPASA-N 0 3 404.554 4.196 20 0 HIADHN C[C@@H](NC(=O)[C@H]1CCCN(Cc2cccnc2)C1)c1ccc(-c2ccncc2)cc1 ZINC000530580327 930757242 /nfs/dbraw/zinc/75/72/42/930757242.db2.gz OTDHZMCERXIQKL-DVECYGJZSA-N 0 3 400.526 4.233 20 0 HIADHN O=C(NCCCc1ccc(Cl)cc1Cl)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000530589859 930761154 /nfs/dbraw/zinc/76/11/54/930761154.db2.gz GTCCFSLWPMSUQL-SFHVURJKSA-N 0 3 406.357 4.349 20 0 HIADHN CN(C)Cc1ccc(-c2noc([C@@H]3CC(=O)N(c4cccc5ccccc54)C3)n2)cc1 ZINC000530633277 930780053 /nfs/dbraw/zinc/78/00/53/930780053.db2.gz NAFYMPQPQCVAQO-HXUWFJFHSA-N 0 3 412.493 4.472 20 0 HIADHN C[C@@H](SCC(=O)Nc1ccc(F)cc1)c1nc(-c2ccc(CN(C)C)cc2)no1 ZINC000530633327 930780360 /nfs/dbraw/zinc/78/03/60/930780360.db2.gz UJUNOAJRZWWGFR-CQSZACIVSA-N 0 3 414.506 4.370 20 0 HIADHN CC[C@@H](C)[C@@H](NCc1cnc2cccc(C)n12)C(=O)Nc1cccc(N2CCCC2)c1 ZINC000530665100 930792609 /nfs/dbraw/zinc/79/26/09/930792609.db2.gz WUADWRZEFBXCAP-HOYKHHGWSA-N 0 3 419.573 4.386 20 0 HIADHN Cc1cc(OC(C)C)ccc1NC(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000530741176 930814017 /nfs/dbraw/zinc/81/40/17/930814017.db2.gz IIDDBWQKSCYBOM-UHFFFAOYSA-N 0 3 411.546 4.061 20 0 HIADHN COc1cc(CNCc2ccc(C)cc2N2CCOCC2)ccc1OCC(F)(F)F ZINC000530771874 930820104 /nfs/dbraw/zinc/82/01/04/930820104.db2.gz XTLKXDQARHPQSL-UHFFFAOYSA-N 0 3 424.463 4.071 20 0 HIADHN CN(C(=O)c1cnn(-c2ccccc2Cl)c1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000530825197 930832890 /nfs/dbraw/zinc/83/28/90/930832890.db2.gz FHZVAXANXUZNDG-HXUWFJFHSA-N 0 3 408.933 4.262 20 0 HIADHN Cc1ccc(-c2noc(CCCN3CCc4c(cnn4-c4ccccc4)C3)n2)cc1F ZINC000530975907 930873959 /nfs/dbraw/zinc/87/39/59/930873959.db2.gz GDMKKRVEULCTNF-UHFFFAOYSA-N 0 3 417.488 4.361 20 0 HIADHN COC(=O)CCC1CCN([C@@H](C)C(=O)N[C@H](C)c2ccc(Cl)cc2Cl)CC1 ZINC000531001637 930880935 /nfs/dbraw/zinc/88/09/35/930880935.db2.gz UBPHYPIMOBSRNQ-KGLIPLIRSA-N 0 3 415.361 4.224 20 0 HIADHN CN(C)Cc1ccc(-c2noc(CCCc3nc(-c4ccc(F)cc4)no3)n2)cc1 ZINC000531110293 930922700 /nfs/dbraw/zinc/92/27/00/930922700.db2.gz NGCLVJAZBYAVJR-UHFFFAOYSA-N 0 3 407.449 4.163 20 0 HIADHN Cc1ccc(-c2noc(CCc3nc(-c4ccc(CN(C)C)cc4)no3)n2)cc1F ZINC000531110069 930923204 /nfs/dbraw/zinc/92/32/04/930923204.db2.gz NTGREPBPCJBREX-UHFFFAOYSA-N 0 3 407.449 4.081 20 0 HIADHN O=C(Nc1cc(Cc2ccccc2)ccc1O)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000531113175 930926290 /nfs/dbraw/zinc/92/62/90/930926290.db2.gz XFANENLAMWIILN-QFIPXVFZSA-N 0 3 401.510 4.229 20 0 HIADHN FC(F)(F)[C@@]1(c2nc(COc3ccccc3)no2)CCN(Cc2ccccc2)C1 ZINC000531117877 930930058 /nfs/dbraw/zinc/93/00/58/930930058.db2.gz RUASBCOIMSXKCM-FQEVSTJZSA-N 0 3 403.404 4.355 20 0 HIADHN Cc1cccc2ncc(CNC3(c4cccc(Br)c4)CCOCC3)n21 ZINC000531142300 930943849 /nfs/dbraw/zinc/94/38/49/930943849.db2.gz VOUDFQPABGLDRK-UHFFFAOYSA-N 0 3 400.320 4.201 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)Nc1ccccc1Br)[C@H]1Oc2ccccc2[C@H]1C ZINC000531212524 930967756 /nfs/dbraw/zinc/96/77/56/930967756.db2.gz CIWUTXCSWQGULA-PXWIGAEESA-N 0 3 403.320 4.319 20 0 HIADHN Cc1nn(Cc2ccc(Cl)cc2)c(C)c1CNCc1n[nH]c(-c2ccc(F)cc2)n1 ZINC000531257007 930984516 /nfs/dbraw/zinc/98/45/16/930984516.db2.gz JJNYGXIBTJLXSS-UHFFFAOYSA-N 0 3 424.911 4.416 20 0 HIADHN CCN1CCN(CCC(=O)N[C@H](c2ccc(C)cc2)c2ccc(F)cc2Cl)CC1 ZINC000531292776 931003871 /nfs/dbraw/zinc/00/38/71/931003871.db2.gz LLPBWNWEPNEYBY-HSZRJFAPSA-N 0 3 417.956 4.021 20 0 HIADHN CC[C@H](C(=O)Nc1ccc(Cl)c(-c2nnc3n2CCCCC3)c1)N(CC)CC ZINC000531310574 931011059 /nfs/dbraw/zinc/01/10/59/931011059.db2.gz PVDGIFUAGPAMIT-GOSISDBHSA-N 0 3 403.958 4.384 20 0 HIADHN COC(=O)c1cc2c(o1)c(OC)ccc2CNCc1ccnc(OC2CCCC2)c1 ZINC000531380526 931037762 /nfs/dbraw/zinc/03/77/62/931037762.db2.gz DYAOSWDOLRBUMJ-UHFFFAOYSA-N 0 3 410.470 4.234 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3ccnc(Oc4ccccc4)c3)CC2)C[C@@H](C)O1 ZINC000531417715 931049281 /nfs/dbraw/zinc/04/92/81/931049281.db2.gz IOBSKGZLIATNKQ-WOJBJXKFSA-N 0 3 423.557 4.225 20 0 HIADHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)Nc1nnc(SCc2ccc(F)cc2)s1 ZINC000531438284 931057351 /nfs/dbraw/zinc/05/73/51/931057351.db2.gz AVBFXQBTANWPAB-CVEARBPZSA-N 0 3 421.567 4.060 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)N[C@@H](Cc1ccccc1)c1ccccc1F ZINC000531526264 931093031 /nfs/dbraw/zinc/09/30/31/931093031.db2.gz SEUBSYZFLNMQJX-QHCPKHFHSA-N 0 3 409.505 4.476 20 0 HIADHN CCOc1ccc([C@@H](C)NC(=O)CCCNCc2cn3cc(Cl)ccc3n2)cc1 ZINC000531530204 931094327 /nfs/dbraw/zinc/09/43/27/931094327.db2.gz YDVIPCTVFJDAPR-MRXNPFEDSA-N 0 3 414.937 4.134 20 0 HIADHN CCCn1nc(C)c(CNC[C@H](c2c(F)cccc2Cl)N2CCO[C@H](C)C2)c1C ZINC000531596553 931115501 /nfs/dbraw/zinc/11/55/01/931115501.db2.gz WYCCYZPTOTYBJB-QVKFZJNVSA-N 0 3 422.976 4.254 20 0 HIADHN C[C@@H](NCc1ccc(-n2cccn2)cc1)c1ccc(S(=O)(=O)C2CCCC2)cc1 ZINC000531682417 931150583 /nfs/dbraw/zinc/15/05/83/931150583.db2.gz UZRFHPCMVPUFDL-GOSISDBHSA-N 0 3 409.555 4.439 20 0 HIADHN Cc1ccc(S(=O)(=O)N2CCC(N[C@@H](c3ccco3)c3ccccc3)CC2)cc1 ZINC000531689522 931154190 /nfs/dbraw/zinc/15/41/90/931154190.db2.gz OHCMHPQVYBAENH-HSZRJFAPSA-N 0 3 410.539 4.120 20 0 HIADHN COc1cc(CN[C@@H](C)c2ccc([S@](C)=O)cc2)ccc1OCC(F)(F)F ZINC000531690868 931155496 /nfs/dbraw/zinc/15/54/96/931155496.db2.gz BIPGALCVLVBIIX-CEXHIMGSSA-N 0 3 401.450 4.225 20 0 HIADHN CC[C@H](N[C@@H](C)c1ccc2c(c1)OCCCO2)c1ccccc1OCC(=O)N(C)C ZINC000531701227 931163787 /nfs/dbraw/zinc/16/37/87/931163787.db2.gz ODVWZBSBLJEAKT-PXNSSMCTSA-N 0 3 412.530 4.117 20 0 HIADHN C[C@H](Cn1cc(Br)cn1)NCc1cccc(NC(=O)C2CCCCC2)c1 ZINC000531701055 931164309 /nfs/dbraw/zinc/16/43/09/931164309.db2.gz ZHXCYAKLYVSZAF-OAHLLOKOSA-N 0 3 419.367 4.343 20 0 HIADHN COc1ccc([C@H](Cc2ccccc2C)NCc2ccc3c(c2)nnn3C)cc1OC ZINC000531701393 931164325 /nfs/dbraw/zinc/16/43/25/931164325.db2.gz MHLSWPDNXBAZTI-NRFANRHFSA-N 0 3 416.525 4.368 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)C[C@H](C)NCc1ccc(OCC2CC2)nc1 ZINC000531708482 931167894 /nfs/dbraw/zinc/16/78/94/931167894.db2.gz UUACZPWFMLBQND-AWEZNQCLSA-N 0 3 403.910 4.039 20 0 HIADHN Cc1ccc2nc(CN[C@@H](C)CC(=O)Nc3ccc(OC(F)(F)F)cc3)[nH]c2c1 ZINC000531728922 931175569 /nfs/dbraw/zinc/17/55/69/931175569.db2.gz XVYKAFCUDBDHPY-ZDUSSCGKSA-N 0 3 406.408 4.277 20 0 HIADHN Cc1ccc(Br)cc1NC(=O)CCNCc1cc(-c2ccccc2)n[nH]1 ZINC000531753498 931183386 /nfs/dbraw/zinc/18/33/86/931183386.db2.gz VYGWDGGCHLDTAV-UHFFFAOYSA-N 0 3 413.319 4.266 20 0 HIADHN COc1ccc(Br)c(Cc2nc(-c3ccc(CN(C)C)cc3)no2)c1 ZINC000531759898 931186325 /nfs/dbraw/zinc/18/63/25/931186325.db2.gz GLLIWZXTKALJAJ-UHFFFAOYSA-N 0 3 402.292 4.160 20 0 HIADHN CCOc1ccc(Br)cc1NC(=O)N(CCN(C)C)Cc1ccco1 ZINC000531774833 931191679 /nfs/dbraw/zinc/19/16/79/931191679.db2.gz ZFGIVSAPJLIZJG-UHFFFAOYSA-N 0 3 410.312 4.037 20 0 HIADHN Cc1ccc(-c2ccc(C(=O)N3CC[C@H](N4CCN(C(C)C)CC4)C3)c(F)c2)cc1 ZINC000531832288 931212125 /nfs/dbraw/zinc/21/21/25/931212125.db2.gz OWKTZPMBLVXNQU-QFIPXVFZSA-N 0 3 409.549 4.042 20 0 HIADHN Cc1ccc(SC2(C(=O)N3CC[C@@H](N4CCN(C(C)C)CC4)C3)CCCC2)cc1 ZINC000531832716 931212369 /nfs/dbraw/zinc/21/23/69/931212369.db2.gz UHOCGJHARRWGGV-OAQYLSRUSA-N 0 3 415.647 4.027 20 0 HIADHN CC[C@H](C)[C@H](NC(=O)N1CC[C@@H](N2CCN(C(C)C)CC2)C1)c1ccc(Cl)cc1 ZINC000531839688 931215863 /nfs/dbraw/zinc/21/58/63/931215863.db2.gz MKOARJVCPSKZHX-BWAGFHJFSA-N 0 3 421.029 4.237 20 0 HIADHN O=C(Nc1ccc(F)cc1)c1ccc(CNCc2c[nH]nc2-c2cccnc2)cc1 ZINC000531864102 931226070 /nfs/dbraw/zinc/22/60/70/931226070.db2.gz ZWIVBNWKVXXMET-UHFFFAOYSA-N 0 3 401.445 4.153 20 0 HIADHN CCCO[C@@H]1CCCN(CC(=O)N[C@@H](C)c2ccc(OC(F)(F)F)cc2)CC1 ZINC000531904938 931242293 /nfs/dbraw/zinc/24/22/93/931242293.db2.gz SAKAUFWLRSXDTF-DOTOQJQBSA-N 0 3 402.457 4.044 20 0 HIADHN C[C@@H](NCc1cccc(Cl)c1)c1ccc(S(=O)(=O)NCc2ccco2)cc1 ZINC000531932653 931250557 /nfs/dbraw/zinc/25/05/57/931250557.db2.gz NXCHWWFQUMOAPS-OAHLLOKOSA-N 0 3 404.919 4.262 20 0 HIADHN COc1cc(OC)c([C@@H](C)NC[C@@H](c2cccs2)N2CCN(C)CC2)cc1Cl ZINC000531932582 931250959 /nfs/dbraw/zinc/25/09/59/931250959.db2.gz UEWOQBBVAJPYHR-QAPCUYQASA-N 0 3 424.010 4.058 20 0 HIADHN CC(C)Oc1ccc(CN[C@H](C)CC(=O)Nc2ccc(OC(F)(F)F)cc2)cn1 ZINC000531937029 931252791 /nfs/dbraw/zinc/25/27/91/931252791.db2.gz LGXVFMDMZYYODG-CQSZACIVSA-N 0 3 411.424 4.274 20 0 HIADHN COc1ccc([C@@H](Cc2ccc(F)cc2)NCc2ccc(N3CCOCC3)nc2)cc1 ZINC000531944701 931256843 /nfs/dbraw/zinc/25/68/43/931256843.db2.gz YCSNUXZFCZMYDS-XMMPIXPASA-N 0 3 421.516 4.140 20 0 HIADHN COc1ccc([C@H](C)NCc2ccc(S(=O)(=O)N(C)C(C)C)cc2)cc1Cl ZINC000531951776 931260618 /nfs/dbraw/zinc/26/06/18/931260618.db2.gz YPCBPTLFWFCONV-HNNXBMFYSA-N 0 3 410.967 4.228 20 0 HIADHN COCC1(NCc2ccc(OCc3ccc(Br)cc3)c(OC)c2)CC1 ZINC000531954102 931262457 /nfs/dbraw/zinc/26/24/57/931262457.db2.gz GYKUYFNQEBZHCN-UHFFFAOYSA-N 0 3 406.320 4.305 20 0 HIADHN Cc1c([C@H](C)N[C@@H](C)Cn2cc(Br)cn2)cnn1-c1ccc(F)cc1 ZINC000531962416 931266681 /nfs/dbraw/zinc/26/66/81/931266681.db2.gz KMCUUKFMDISMCC-STQMWFEESA-N 0 3 406.303 4.018 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)cc1 ZINC000531963831 931267795 /nfs/dbraw/zinc/26/77/95/931267795.db2.gz BDLBWHFBFFBUPR-CYFREDJKSA-N 0 3 402.542 4.065 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](NC2CCN(c3ccccc3)CC2)c2ccccc2)c1 ZINC000531988634 931277100 /nfs/dbraw/zinc/27/71/00/931277100.db2.gz SWDKYSCFICUWLM-RUZDIDTESA-N 0 3 420.578 4.438 20 0 HIADHN COCCC[C@@H](NCc1cnn(CC(F)(F)F)c1)c1ccc(Br)cc1 ZINC000531989014 931277146 /nfs/dbraw/zinc/27/71/46/931277146.db2.gz VLQIKKSVJZIAHD-MRXNPFEDSA-N 0 3 420.273 4.465 20 0 HIADHN CC(C)N1CCN([C@H]2CCN(C(=O)Nc3ccc(Oc4ccccc4)cc3)C2)CC1 ZINC000532094338 931309572 /nfs/dbraw/zinc/30/95/72/931309572.db2.gz DMDCQCIYMUSRCQ-NRFANRHFSA-N 0 3 408.546 4.111 20 0 HIADHN CC(C)N1CCN([C@@H]2CCN(C(=O)Nc3ccccc3Oc3ccccc3)C2)CC1 ZINC000532094714 931309921 /nfs/dbraw/zinc/30/99/21/931309921.db2.gz GUHFCDGNODFFMA-HXUWFJFHSA-N 0 3 408.546 4.111 20 0 HIADHN CCC[C@H](NCc1cnc(N2CCN(C)CC2)nc1)c1ccc(Cl)c(Cl)c1 ZINC000532138835 931327132 /nfs/dbraw/zinc/32/71/32/931327132.db2.gz KBGFBMLJDQMGJJ-IBGZPJMESA-N 0 3 408.377 4.166 20 0 HIADHN COc1ccccc1[C@H](C)N(C)C(=O)CN(Cc1ccccc1)CC1CCOCC1 ZINC000532161258 931333062 /nfs/dbraw/zinc/33/30/62/931333062.db2.gz TXBINYRHRQSALY-FQEVSTJZSA-N 0 3 410.558 4.143 20 0 HIADHN COc1cc(CN[C@@H](C)c2ccc(OCc3nccn3C)cc2)ccc1OC(F)F ZINC000532200648 931347484 /nfs/dbraw/zinc/34/74/84/931347484.db2.gz DSROQPBMGXWNMF-HNNXBMFYSA-N 0 3 417.456 4.460 20 0 HIADHN CNC(=O)c1ccc(CN[C@H](C)c2cccc(OCc3cn4ccccc4n3)c2)cc1 ZINC000532202549 931348559 /nfs/dbraw/zinc/34/85/59/931348559.db2.gz LDIDASZPVNOIGT-GOSISDBHSA-N 0 3 414.509 4.124 20 0 HIADHN CC[C@@H](NCc1ccc(C(=O)N2CCOCC2)cc1)c1ccc(OC(F)F)cc1 ZINC000532210323 931353336 /nfs/dbraw/zinc/35/33/36/931353336.db2.gz LZJWVJLGAHWVIZ-HXUWFJFHSA-N 0 3 404.457 4.001 20 0 HIADHN CC[C@@H](N[C@H](CC)c1ccccc1OCC(=O)N(C)C)c1ccc2c(c1)OCCO2 ZINC000532211787 931354305 /nfs/dbraw/zinc/35/43/05/931354305.db2.gz IMMDSVBETBYTMR-WOJBJXKFSA-N 0 3 412.530 4.117 20 0 HIADHN CC[C@H](C(=O)N[C@@H](C)c1sc(-c2ccccc2Br)nc1C)N(C)C ZINC000532226263 931361704 /nfs/dbraw/zinc/36/17/04/931361704.db2.gz RKCPGXQVVXZUJO-XHDPSFHLSA-N 0 3 410.381 4.398 20 0 HIADHN O=C(Nc1cnn(Cc2ccc(Cl)cc2)c1)N1CCN(C2CCCCC2)CC1 ZINC000532224389 931361942 /nfs/dbraw/zinc/36/19/42/931361942.db2.gz QRPKPHXSGDYMDD-UHFFFAOYSA-N 0 3 401.942 4.067 20 0 HIADHN CSc1cccc(N(C(=O)Cc2ccn(-c3ccccc3)n2)C2CCN(C)CC2)c1 ZINC000532313050 931394839 /nfs/dbraw/zinc/39/48/39/931394839.db2.gz QBNDOQYKRHSANE-UHFFFAOYSA-N 0 3 420.582 4.264 20 0 HIADHN CC(C)(C)n1cc(CN[C@@H]2CCN(c3ncc(C(F)(F)F)cc3Cl)C2)cn1 ZINC000532322109 931396989 /nfs/dbraw/zinc/39/69/89/931396989.db2.gz CUQMXTATVVNESP-CQSZACIVSA-N 0 3 401.864 4.074 20 0 HIADHN COc1ccc([C@H](CN[C@H](C)c2ccccc2Cl)N2CCOCC2)cc1OC ZINC000532441784 931435493 /nfs/dbraw/zinc/43/54/93/931435493.db2.gz QJUBRJHJRVXAQS-UZLBHIALSA-N 0 3 404.938 4.081 20 0 HIADHN C[C@@H](NCc1ccc2c(c1)OCO2)c1cccc(OCc2cn3ccccc3n2)c1 ZINC000532442061 931435577 /nfs/dbraw/zinc/43/55/77/931435577.db2.gz XGAAIPANCDLOFJ-QGZVFWFLSA-N 0 3 401.466 4.493 20 0 HIADHN COc1ccc([C@@H](CN[C@@H](C)c2ccccc2Cl)N2CCOCC2)cc1OC ZINC000532441782 931435746 /nfs/dbraw/zinc/43/57/46/931435746.db2.gz QJUBRJHJRVXAQS-OXJNMPFZSA-N 0 3 404.938 4.081 20 0 HIADHN C[C@H](CC(=O)N1CCCCCC1)NCc1cccc(NC(=O)c2ccc(F)cc2)c1 ZINC000532448786 931439631 /nfs/dbraw/zinc/43/96/31/931439631.db2.gz DCJKCBAHMBRKEI-GOSISDBHSA-N 0 3 411.521 4.349 20 0 HIADHN CN(C)Cc1ccc(-c2noc(-c3ccc4c(c3)[nH]c(=O)n4CC(F)(F)F)n2)cc1 ZINC000532453727 931441622 /nfs/dbraw/zinc/44/16/22/931441622.db2.gz LUQSEXACOBAMRZ-UHFFFAOYSA-N 0 3 417.391 4.083 20 0 HIADHN Cc1nc(-c2ccc(CN[C@H](C)c3ccc(S(=O)(=O)N(C)C)cc3)cc2)cs1 ZINC000532471261 931450253 /nfs/dbraw/zinc/45/02/53/931450253.db2.gz VJIFYRBWLJNMKD-OAHLLOKOSA-N 0 3 415.584 4.220 20 0 HIADHN CN(CC(=O)N[C@@H](c1ccccc1)c1ccc2[nH]c(C(F)(F)F)nc2c1)CC1CC1 ZINC000532474095 931452166 /nfs/dbraw/zinc/45/21/66/931452166.db2.gz GMUPRPHCYWKIIO-FQEVSTJZSA-N 0 3 416.447 4.129 20 0 HIADHN CN(CC(=O)N[C@@H](c1ccccc1)c1ccc2nc(C(F)(F)F)[nH]c2c1)CC1CC1 ZINC000532474095 931452171 /nfs/dbraw/zinc/45/21/71/931452171.db2.gz GMUPRPHCYWKIIO-FQEVSTJZSA-N 0 3 416.447 4.129 20 0 HIADHN COc1cccc(CCN[C@@H](C)c2ccccc2I)c1OC ZINC000532475788 931453441 /nfs/dbraw/zinc/45/34/41/931453441.db2.gz MHWXKXCJZLRTSJ-ZDUSSCGKSA-N 0 3 411.283 4.202 20 0 HIADHN CCc1cccc2c(C3CCN(CCn4cnc5ccccc5c4=O)CC3)c[nH]c21 ZINC000532493566 931460498 /nfs/dbraw/zinc/46/04/98/931460498.db2.gz FYUXOHYCHGOIRJ-UHFFFAOYSA-N 0 3 400.526 4.320 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)N[C@@H](C)c2ccc(S(C)(=O)=O)c(F)c2)cc1 ZINC000532519174 931472633 /nfs/dbraw/zinc/47/26/33/931472633.db2.gz MXCGBSXAWMZAFY-GJZGRUSLSA-N 0 3 401.507 4.135 20 0 HIADHN C[C@@H](Cc1ccsc1)NCc1cccnc1Oc1cccc(S(C)(=O)=O)c1 ZINC000532524219 931473837 /nfs/dbraw/zinc/47/38/37/931473837.db2.gz FGWKPTGYOOZMBU-HNNXBMFYSA-N 0 3 402.541 4.060 20 0 HIADHN COc1ccc([C@H](N[C@H](C)Cc2ccsc2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000532531085 931512296 /nfs/dbraw/zinc/51/22/96/931512296.db2.gz KHSIFIDRDNVGII-ZHRRBRCNSA-N 0 3 415.580 4.470 20 0 HIADHN c1nc2cnccn2c1CNC1(c2ccc(OCc3ccccc3)cc2)CCOCC1 ZINC000532616476 931555354 /nfs/dbraw/zinc/55/53/54/931555354.db2.gz JWGTXVMEABWOLV-UHFFFAOYSA-N 0 3 414.509 4.104 20 0 HIADHN CCN(Cc1ccc(OC)c(OC)c1)C(=O)CN[C@@H](c1ccc(F)cc1)C1CCC1 ZINC000532688597 931585190 /nfs/dbraw/zinc/58/51/90/931585190.db2.gz SZAINVGZPFDBOW-XMMPIXPASA-N 0 3 414.521 4.322 20 0 HIADHN O=C(CN[C@H](c1ccccc1)C1CCCC1)NCCc1cnn(-c2ccccc2)c1 ZINC000532714012 931604628 /nfs/dbraw/zinc/60/46/28/931604628.db2.gz IJEPEIWSIGCAOO-RUZDIDTESA-N 0 3 402.542 4.052 20 0 HIADHN c1cc(-c2ccccc2)oc1CNc1ccc2nc(CCN3CCOCC3)[nH]c2c1 ZINC000532729158 931614171 /nfs/dbraw/zinc/61/41/71/931614171.db2.gz UHHIFRXPCFUZRG-UHFFFAOYSA-N 0 3 402.498 4.310 20 0 HIADHN CN(C)Cc1ccc(-c2noc(-c3cccc(F)c3I)n2)cc1 ZINC000532737181 931617660 /nfs/dbraw/zinc/61/76/60/931617660.db2.gz FCAIGUQUMFSTGK-UHFFFAOYSA-N 0 3 423.229 4.209 20 0 HIADHN COc1ccc(NC(=O)CCN2CCC[C@H](c3nc(C(F)(F)F)cs3)C2)cc1 ZINC000532742082 931619242 /nfs/dbraw/zinc/61/92/42/931619242.db2.gz PWUPDCONIHHNEX-ZDUSSCGKSA-N 0 3 413.465 4.379 20 0 HIADHN CCN(CCc1nccs1)Cc1ccnc(-c2ccc(Br)cc2)n1 ZINC000532821971 931640961 /nfs/dbraw/zinc/64/09/61/931640961.db2.gz IHKBLRIMFIJQSW-UHFFFAOYSA-N 0 3 403.349 4.427 20 0 HIADHN Cn1c2ccccc2nc1CCCNCc1cn(-c2cccc(Cl)c2Cl)nn1 ZINC000532848297 931658592 /nfs/dbraw/zinc/65/85/92/931658592.db2.gz ZNVLQIQCPGPIEN-UHFFFAOYSA-N 0 3 415.328 4.183 20 0 HIADHN c1nc(-c2ccccc2)sc1CNc1ccc2nc(CCN3CCOCC3)[nH]c2c1 ZINC000532889720 931681124 /nfs/dbraw/zinc/68/11/24/931681124.db2.gz HXXJAQOSYXPOOU-UHFFFAOYSA-N 0 3 419.554 4.173 20 0 HIADHN COc1ccc2cc(C(=O)Nc3ccnn3[C@@H]3CCN(Cc4ccccc4)C3)[nH]c2c1 ZINC000532943241 931706409 /nfs/dbraw/zinc/70/64/09/931706409.db2.gz ZFRSRKLOTDOYHH-LJQANCHMSA-N 0 3 415.497 4.072 20 0 HIADHN COC1CCC(N(C)CC(=O)N2N=C(c3ccc(C)cc3)C[C@@H]2c2ccco2)CC1 ZINC000532977230 931723064 /nfs/dbraw/zinc/72/30/64/931723064.db2.gz WUWZAMMQVIFUFZ-QETWGEEDSA-N 0 3 409.530 4.155 20 0 HIADHN C[C@H]1C[C@H](c2ccc(F)cc2)CN1CC(=O)N1CCC(OCc2ccccc2)CC1 ZINC000532977022 931723249 /nfs/dbraw/zinc/72/32/49/931723249.db2.gz JLXHOXZFZBJYHV-UGKGYDQZSA-N 0 3 410.533 4.211 20 0 HIADHN COc1cc2c(cc1CN[C@H](C)[C@H](OC1CCOCC1)c1ccccc1)O[C@@H](C)C2 ZINC000533007313 931733904 /nfs/dbraw/zinc/73/39/04/931733904.db2.gz HVZYCCZMWJRMOD-ATLLOTDBSA-N 0 3 411.542 4.434 20 0 HIADHN CN(Cc1ccc(Cl)c(Cl)c1)C(=O)CNC1(c2ccccc2)CCOCC1 ZINC000533059346 931757472 /nfs/dbraw/zinc/75/74/72/931757472.db2.gz AUZIHPZWHQBJJG-UHFFFAOYSA-N 0 3 407.341 4.247 20 0 HIADHN COC(=O)c1sc2ccccc2c1CN1CCC[C@H](c2nnc3ccccn32)C1 ZINC000533079025 931766878 /nfs/dbraw/zinc/76/68/78/931766878.db2.gz RRVGUHAUMYPIOD-HNNXBMFYSA-N 0 3 406.511 4.110 20 0 HIADHN Cn1c(CNC2CCN(c3ccc(C(F)(F)F)cn3)CC2)nc2cc(Cl)ccc21 ZINC000533105934 931772596 /nfs/dbraw/zinc/77/25/96/931772596.db2.gz SRQUJFPQBYATAV-UHFFFAOYSA-N 0 3 423.870 4.399 20 0 HIADHN Brc1cccc(-c2c[nH]c(CN[C@@H]3[C@H]4CCO[C@@H]4C34CCCC4)n2)c1 ZINC000533179461 931803046 /nfs/dbraw/zinc/80/30/46/931803046.db2.gz NPHTVDQGMXNEQC-LZQZEXGQSA-N 0 3 402.336 4.277 20 0 HIADHN COc1cccc(C[C@H]2CCCN2Cc2csc(-c3ccc(C(N)=O)cc3)n2)c1 ZINC000533251825 931819892 /nfs/dbraw/zinc/81/98/92/931819892.db2.gz UEPLQIOLVMEQDM-HXUWFJFHSA-N 0 3 407.539 4.125 20 0 HIADHN Cc1cc(N2CCCC2)ccc1NC(=O)CN(Cc1ccccc1)CC1CCOCC1 ZINC000533286329 931828356 /nfs/dbraw/zinc/82/83/56/931828356.db2.gz MMMVZQIOTHPHIL-UHFFFAOYSA-N 0 3 421.585 4.463 20 0 HIADHN CCc1nc(C)c([C@@H](C)N(C)CCC(=O)Nc2cc(OC)c(OC)c(OC)c2)s1 ZINC000533294003 931831567 /nfs/dbraw/zinc/83/15/67/931831567.db2.gz DNOVVBCXNPDBHL-CQSZACIVSA-N 0 3 421.563 4.061 20 0 HIADHN C[C@H]1C[N@H+](Cc2ccccc2)CCCN1Cc1nc2c3ccccc3oc2c(=O)[n-]1 ZINC000533295139 931831696 /nfs/dbraw/zinc/83/16/96/931831696.db2.gz WEDBTRKKVQMMGW-KRWDZBQOSA-N 0 3 402.498 4.178 20 0 HIADHN C[C@H]1C[N@@H+](Cc2ccccc2)CCCN1Cc1nc2c3ccccc3oc2c(=O)[n-]1 ZINC000533295139 931831699 /nfs/dbraw/zinc/83/16/99/931831699.db2.gz WEDBTRKKVQMMGW-KRWDZBQOSA-N 0 3 402.498 4.178 20 0 HIADHN O[C@H](COc1ccccc1)CN1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1 ZINC000533365676 931849707 /nfs/dbraw/zinc/84/97/07/931849707.db2.gz NGSPHTPDMVQAFQ-HKUYNNGSSA-N 0 3 413.905 4.009 20 0 HIADHN O=C(CN[C@H](c1ccccc1)C1CCCC1)NCC1(c2ccccc2)CCOCC1 ZINC000533386589 931855106 /nfs/dbraw/zinc/85/51/06/931855106.db2.gz XGQVYDHHANCPSY-RUZDIDTESA-N 0 3 406.570 4.372 20 0 HIADHN CC[C@H](Cc1ccccc1)N(C)CC(=O)N1CCC[C@H]1c1ccc(OC)c(OC)c1 ZINC000533431916 931867048 /nfs/dbraw/zinc/86/70/48/931867048.db2.gz RIKYLMWZYGAIOR-YADHBBJMSA-N 0 3 410.558 4.320 20 0 HIADHN Cc1ccccc1[C@@H]1C[C@H](C)N(CC(=O)N2CCC(OCc3ccccc3)CC2)C1 ZINC000533435114 931867707 /nfs/dbraw/zinc/86/77/07/931867707.db2.gz RTYANIYGXPLMHZ-JTHBVZDNSA-N 0 3 406.570 4.381 20 0 HIADHN Fc1cc(CNc2ccc3nc(CCN4CCOCC4)[nH]c3c2)cc(C(F)(F)F)c1 ZINC000533446510 931872013 /nfs/dbraw/zinc/87/20/13/931872013.db2.gz JXHCCKIPXCWJFW-UHFFFAOYSA-N 0 3 422.426 4.208 20 0 HIADHN O=C(CN[C@@H](Cc1ccccc1)c1ccccc1)NCCc1cnn(-c2ccccc2)c1 ZINC000533480316 931880033 /nfs/dbraw/zinc/88/00/33/931880033.db2.gz ROFZUGVCKOOSBY-SANMLTNESA-N 0 3 424.548 4.105 20 0 HIADHN CCNC(=O)c1cccc(NC(=O)CN(CCc2ccc(F)cc2)C2CCCC2)c1 ZINC000533482222 931880369 /nfs/dbraw/zinc/88/03/69/931880369.db2.gz RLOAMKJHNPDBBY-UHFFFAOYSA-N 0 3 411.521 4.001 20 0 HIADHN Cc1cccc([C@@H]2CCCN2CCc2nc3sc4c(c3c(N)n2)CC[C@@H](C)C4)n1 ZINC000533483216 931881320 /nfs/dbraw/zinc/88/13/20/931881320.db2.gz PUCBMZGKJQVQSN-KDOFPFPSSA-N 0 3 407.587 4.481 20 0 HIADHN C[C@@H](NC(=O)[C@H](C)N[C@@H](c1ccc(F)cc1)C1CCC1)c1ccc2c(c1)OCCO2 ZINC000533504092 931886893 /nfs/dbraw/zinc/88/68/93/931886893.db2.gz VHHHOSYLHYVTOD-VBURHUQHSA-N 0 3 412.505 4.294 20 0 HIADHN O=C(CNC1(c2ccc(F)cc2)CCCC1)N1CCC[C@H]1c1ccc2c(c1)OCCO2 ZINC000533510591 931889194 /nfs/dbraw/zinc/88/91/94/931889194.db2.gz ZDQQIUMSABVGBM-NRFANRHFSA-N 0 3 424.516 4.320 20 0 HIADHN C[C@@H](NC(=O)CNC1(c2ccc(Cl)cc2)CCOCC1)c1ccccc1Cl ZINC000533520236 931892313 /nfs/dbraw/zinc/89/23/13/931892313.db2.gz AQMMTZKYBCABFD-OAHLLOKOSA-N 0 3 407.341 4.466 20 0 HIADHN C/C=C/c1ccc(OC[C@@H](O)CN2CCC(Nc3cccc(C)c3)CC2)c(OC)c1 ZINC000533530302 931895414 /nfs/dbraw/zinc/89/54/14/931895414.db2.gz KZRWXPLPUAQDNH-DOHLAZSCSA-N 0 3 410.558 4.353 20 0 HIADHN CCN(CC(=O)Nc1ccc(C)cc1C)C1CCN(c2cc(C)nc(C(C)C)n2)CC1 ZINC000533532912 931896234 /nfs/dbraw/zinc/89/62/34/931896234.db2.gz FKTDDJBNYUNXFQ-UHFFFAOYSA-N 0 3 423.605 4.455 20 0 HIADHN COc1ccc(C(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)cc1-c1ccccn1 ZINC000533650422 931946850 /nfs/dbraw/zinc/94/68/50/931946850.db2.gz WZSCICKKTBEEME-GHTZIAJQSA-N 0 3 401.510 4.150 20 0 HIADHN C[C@H](NC(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1)[C@@H]1COc2ccccc21 ZINC000533657590 931951989 /nfs/dbraw/zinc/95/19/89/931951989.db2.gz ANJLWJICCBKWSL-BPXKWBHBSA-N 0 3 418.459 4.122 20 0 HIADHN Cc1nc2ccccc2n1C[C@@H]1CCCN1C(=O)c1cccc(CN2CCCC2)c1 ZINC000533749813 932007955 /nfs/dbraw/zinc/00/79/55/932007955.db2.gz ROMCWYMISLXIRZ-QFIPXVFZSA-N 0 3 402.542 4.245 20 0 HIADHN CC1CCN(S(=O)(=O)Cc2ccccc2CNCc2cccc3[nH]ccc32)CC1 ZINC000533756486 932012170 /nfs/dbraw/zinc/01/21/70/932012170.db2.gz NHUKCPZJNKRCEE-UHFFFAOYSA-N 0 3 411.571 4.019 20 0 HIADHN COC(=O)CCSc1cccc(NC(=O)NC[C@@H](c2ccc(C)cc2)N(C)C)c1 ZINC000533772260 932025693 /nfs/dbraw/zinc/02/56/93/932025693.db2.gz SAOKHSZQEDCTKO-FQEVSTJZSA-N 0 3 415.559 4.075 20 0 HIADHN CC(=O)N(c1nc(CN2CCN(CC3CC3)CC2)cs1)c1c(C)cc(C)cc1C ZINC000533775676 932027959 /nfs/dbraw/zinc/02/79/59/932027959.db2.gz ROOKDWMOMQORTP-UHFFFAOYSA-N 0 3 412.603 4.281 20 0 HIADHN CN(C)[C@H](CNC(=O)Nc1ccc(OC(F)F)c2ncccc12)Cc1ccccc1 ZINC000533810624 932042164 /nfs/dbraw/zinc/04/21/64/932042164.db2.gz RMNKOMOVRQEOQP-INIZCTEOSA-N 0 3 414.456 4.131 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccc(O)cc1)C(=O)c1cnc2onc(C(C)C)c2c1 ZINC000533830576 932049197 /nfs/dbraw/zinc/04/91/97/932049197.db2.gz GXEMBKAIIMVBGK-IBGZPJMESA-N 0 3 422.529 4.179 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccc(O)cc1)C(=O)CCC(=O)c1ccc(F)cc1 ZINC000533832030 932050319 /nfs/dbraw/zinc/05/03/19/932050319.db2.gz PNHYOTTYTYSDNT-OAQYLSRUSA-N 0 3 412.505 4.007 20 0 HIADHN COc1ccc(-c2cc(C(=O)Nc3cccc4c3CN(c3ccccn3)C4)[nH]n2)cc1 ZINC000533840807 932054901 /nfs/dbraw/zinc/05/49/01/932054901.db2.gz IDKNYTXDRLJALO-UHFFFAOYSA-N 0 3 411.465 4.253 20 0 HIADHN C[C@H](CNC(=O)Nc1cccc2c1CN(c1ccccn1)C2)N(C)Cc1ccccc1 ZINC000533881794 932078503 /nfs/dbraw/zinc/07/85/03/932078503.db2.gz NWGRMRCUJZQSAG-LJQANCHMSA-N 0 3 415.541 4.244 20 0 HIADHN CCCOc1ccc([C@H](C)NC(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)cc1OC ZINC000533929692 932106396 /nfs/dbraw/zinc/10/63/96/932106396.db2.gz LVBPSMJCDVQBIF-WGGBDISSSA-N 0 3 411.546 4.290 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)N[C@@H](c1cccnc1)C1CC1 ZINC000533967463 932143239 /nfs/dbraw/zinc/14/32/39/932143239.db2.gz SAFCKMGTSPHWIM-HXUWFJFHSA-N 0 3 420.479 4.325 20 0 HIADHN CN1CC[C@H](NC(=O)N2CCC(Oc3ccccc3Cl)CC2)[C@@H]1c1ccccc1 ZINC000533983674 932158950 /nfs/dbraw/zinc/15/89/50/932158950.db2.gz HDEKRAZYCFHTFF-UNMCSNQZSA-N 0 3 413.949 4.338 20 0 HIADHN CC(C)N1CCN([C@H]2CCN(C(=O)Nc3ccc4c(c3)C(C)(C)CC4(C)C)C2)CC1 ZINC000534013178 932194145 /nfs/dbraw/zinc/19/41/45/932194145.db2.gz BCQOUZNNTBPYRS-FQEVSTJZSA-N 0 3 412.622 4.278 20 0 HIADHN CN1CC[C@H](NC(=O)Cc2cc(Cl)ccc2Br)[C@@H]1c1ccccc1 ZINC000534019430 932200858 /nfs/dbraw/zinc/20/08/58/932200858.db2.gz QLQHAHZHINJAJI-HKUYNNGSSA-N 0 3 407.739 4.207 20 0 HIADHN CN1CC[C@@H](NC(=O)Cc2ccc(NC(=O)CC(C)(C)C)cc2)[C@@H]1c1ccccc1 ZINC000534021179 932202243 /nfs/dbraw/zinc/20/22/43/932202243.db2.gz WLBYSMVSOZCVEF-QPPBQGQZSA-N 0 3 407.558 4.165 20 0 HIADHN CC(C)n1ncc2c1nc(C1CC1)cc2C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000534020392 932202555 /nfs/dbraw/zinc/20/25/55/932202555.db2.gz VKWVNALKCXXSIB-IFMALSPDSA-N 0 3 403.530 4.065 20 0 HIADHN O=C(c1ccc(CN[C@H]2CCc3c2cc(Cl)cc3Cl)cc1)N1CCOCC1 ZINC000534058539 932236916 /nfs/dbraw/zinc/23/69/16/932236916.db2.gz DKTMOIWSBXPDDK-FQEVSTJZSA-N 0 3 405.325 4.243 20 0 HIADHN CN1CC[C@H](NC(=O)CCc2ncc(-c3ccc(Cl)cc3)o2)[C@H]1c1ccccc1 ZINC000534107887 932281746 /nfs/dbraw/zinc/28/17/46/932281746.db2.gz YFCHQPSEOCSEGJ-WMZHIEFXSA-N 0 3 409.917 4.489 20 0 HIADHN C[C@H]1CN(CCCCNC(=O)c2cc3ccccc3cc2OC(F)F)C[C@H](C)O1 ZINC000534162023 932309377 /nfs/dbraw/zinc/30/93/77/932309377.db2.gz BXGUCJJENSJUDH-HOTGVXAUSA-N 0 3 406.473 4.060 20 0 HIADHN O=C(CCc1ccccc1)N1CCC(NCc2cc(F)ccc2Br)CC1 ZINC000534169680 932313098 /nfs/dbraw/zinc/31/30/98/932313098.db2.gz YUFTUTTYSDXORI-UHFFFAOYSA-N 0 3 419.338 4.302 20 0 HIADHN Cc1c2cccc(Cl)c2oc1C(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1CO ZINC000534181798 932318764 /nfs/dbraw/zinc/31/87/64/932318764.db2.gz MAKJKMMYLZASSX-PXNSSMCTSA-N 0 3 412.917 4.007 20 0 HIADHN Cc1ccc2nc(C3CC3)cc(C(=O)N(CCN(C)C)Cc3cccc(O)c3)c2c1 ZINC000534190182 932322899 /nfs/dbraw/zinc/32/28/99/932322899.db2.gz MAPONZNLWXJRBN-UHFFFAOYSA-N 0 3 403.526 4.330 20 0 HIADHN Cc1ccc2[nH]c([C@@H]3CCCN([C@H](C)C(=O)N4CCc5sccc5C4)C3)nc2c1 ZINC000534216253 932337896 /nfs/dbraw/zinc/33/78/96/932337896.db2.gz JYFRFOJGIRLEMV-SJLPKXTDSA-N 0 3 408.571 4.086 20 0 HIADHN Cc1ccc2nc([C@@H]3CCCN([C@H](C)C(=O)N4CCc5sccc5C4)C3)[nH]c2c1 ZINC000534216253 932337906 /nfs/dbraw/zinc/33/79/06/932337906.db2.gz JYFRFOJGIRLEMV-SJLPKXTDSA-N 0 3 408.571 4.086 20 0 HIADHN CN(C)Cc1ccc(CNCc2cc(Cl)ccc2OC[C@H]2CCCO2)cc1F ZINC000534233225 932353616 /nfs/dbraw/zinc/35/36/16/932353616.db2.gz CEVVAXQJTWETBB-HXUWFJFHSA-N 0 3 406.929 4.388 20 0 HIADHN CCCN1CCN(c2ccccc2CNc2ccc(Cl)c(NC(C)=O)c2)CC1 ZINC000534241953 932359875 /nfs/dbraw/zinc/35/98/75/932359875.db2.gz SNFWIAATMYBDGU-UHFFFAOYSA-N 0 3 400.954 4.443 20 0 HIADHN Cc1cc(-c2ccccc2)ccc1NC(=O)N1CC[C@@H](N2CCN(C)CC2)[C@@H](C)C1 ZINC000534266141 932372649 /nfs/dbraw/zinc/37/26/49/932372649.db2.gz JZZVMQZMMVDZLH-GBXCKJPGSA-N 0 3 406.574 4.152 20 0 HIADHN C[C@H]1CN(C(=O)Nc2ccc3oc4ccccc4c3c2)CC[C@@H]1N1CCN(C)CC1 ZINC000534269703 932373272 /nfs/dbraw/zinc/37/32/72/932373272.db2.gz YRKLVACDVALKPG-UWJYYQICSA-N 0 3 406.530 4.076 20 0 HIADHN O=C(N[C@@H](CC(F)(F)F)c1ccc(F)cc1)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000534341868 932387015 /nfs/dbraw/zinc/38/70/15/932387015.db2.gz IRVCPXSCHPBBFS-MJGOQNOKSA-N 0 3 409.427 4.243 20 0 HIADHN O=C(CN1CC[C@H](C2CCOCC2)C1)N[C@H](c1ccccc1)c1cccc(Cl)c1 ZINC000534381675 932408171 /nfs/dbraw/zinc/40/81/71/932408171.db2.gz APTZJMRVILDEQB-XUZZJYLKSA-N 0 3 412.961 4.294 20 0 HIADHN COc1cccc(-c2nc(C)c(C(=O)N3CCCN(Cc4ccccc4)C[C@H]3C)[nH]2)c1 ZINC000534417014 932435748 /nfs/dbraw/zinc/43/57/48/932435748.db2.gz LPVPXGAMTSKBCG-GOSISDBHSA-N 0 3 418.541 4.130 20 0 HIADHN Cc1cc(C)c(CC(C(=O)N2CCCc3c(C(N)=O)cccc32)C(F)(F)F)c(C)c1 ZINC000534490134 932529097 /nfs/dbraw/zinc/52/90/97/932529097.db2.gz YKHTVPQQCCQVKM-LJQANCHMSA-N 0 3 418.459 4.411 20 0 HIADHN COc1ccc(CN[C@@H]2CCN(C(C)=O)c3ccccc32)cc1OCc1cccnc1 ZINC000534511363 932539364 /nfs/dbraw/zinc/53/93/64/932539364.db2.gz VMXZCOLBUICSOA-JOCHJYFZSA-N 0 3 417.509 4.257 20 0 HIADHN CC[C@@H](NC(=O)NC[C@@H](c1cccc(OC)c1)N(CC)CC)c1c(C)noc1C ZINC000534518428 932542724 /nfs/dbraw/zinc/54/27/24/932542724.db2.gz TUJQIHUBAZPRMZ-UXHICEINSA-N 0 3 402.539 4.133 20 0 HIADHN CN(C)[C@@H](CNC(=O)c1ccn(-c2ccc(Cl)c(Cl)c2)n1)Cc1ccccc1 ZINC000534524036 932544985 /nfs/dbraw/zinc/54/49/85/932544985.db2.gz DQEVFVBNDVBHHR-QGZVFWFLSA-N 0 3 417.340 4.082 20 0 HIADHN COc1cccc(-c2cc(C(=O)Nc3cccc4c3CN(c3ccccn3)C4)[nH]n2)c1 ZINC000534552064 932559037 /nfs/dbraw/zinc/55/90/37/932559037.db2.gz CEBUUHPEKCONTC-UHFFFAOYSA-N 0 3 411.465 4.253 20 0 HIADHN Cc1cc(C(=O)Nc2cccc(CN3CCC(CO)CC3)c2)ccc1Br ZINC000534552931 932559547 /nfs/dbraw/zinc/55/95/47/932559547.db2.gz QWZDMSRAVKWWBL-UHFFFAOYSA-N 0 3 417.347 4.214 20 0 HIADHN COc1cc([C@H](C)NC(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)ccc1OC(C)C ZINC000534611539 932595196 /nfs/dbraw/zinc/59/51/96/932595196.db2.gz VUEINKYTSQQOIK-WGGBDISSSA-N 0 3 411.546 4.288 20 0 HIADHN CN(CCCc1cc(-c2ccccc2)no1)C(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000534683121 932653102 /nfs/dbraw/zinc/65/31/02/932653102.db2.gz AEUDHQCQOPDVSU-VWNXMTODSA-N 0 3 418.541 4.361 20 0 HIADHN CN1CC[C@H](NC(=O)NC2(c3ccc(Br)cc3)CC2)[C@@H]1c1ccccc1 ZINC000534719692 932687460 /nfs/dbraw/zinc/68/74/60/932687460.db2.gz CHKLYEILACEXCK-OALUTQOASA-N 0 3 414.347 4.183 20 0 HIADHN Cc1ccc(OCc2nc(CC(=O)N[C@@H]3CCN(C)[C@@H]3c3ccccc3)cs2)cc1 ZINC000534756012 932734377 /nfs/dbraw/zinc/73/43/77/932734377.db2.gz GZQLKAUGXUJCBS-ZJSXRUAMSA-N 0 3 421.566 4.135 20 0 HIADHN CC(C)Cn1ncc(NC(=O)NC[C@H](c2cccs2)N2CCCC2)c1C(F)F ZINC000534825270 932796077 /nfs/dbraw/zinc/79/60/77/932796077.db2.gz AIGNYIPINQLRPT-OAHLLOKOSA-N 0 3 411.522 4.497 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cnc(-c2cccnc2)s1)c1cccc(OC)c1 ZINC000534870087 932815745 /nfs/dbraw/zinc/81/57/45/932815745.db2.gz OWDUHEIHPZULDG-IBGZPJMESA-N 0 3 410.543 4.027 20 0 HIADHN COc1ccc(C[C@H](C)CN(C)[C@H](C)C(=O)Nc2ccccc2OC(F)F)cc1 ZINC000534913512 932836370 /nfs/dbraw/zinc/83/63/70/932836370.db2.gz ZMLHJSQKBVKEPR-JKSUJKDBSA-N 0 3 406.473 4.434 20 0 HIADHN O=C(NCc1ccccc1)c1cccc(NC(=O)N2CCN(C3CCCCC3)CC2)c1 ZINC000534957661 932858456 /nfs/dbraw/zinc/85/84/56/932858456.db2.gz MXQUMIWXGBFHEW-UHFFFAOYSA-N 0 3 420.557 4.099 20 0 HIADHN CC(C)NS(=O)(=O)Cc1ccccc1CN[C@H]1CCCc2ccc(Cl)cc21 ZINC000534977803 932872969 /nfs/dbraw/zinc/87/29/69/932872969.db2.gz YZWRWCNRRONJJV-NRFANRHFSA-N 0 3 406.979 4.335 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)[C@@H](C)Cc1ccc(Br)cc1 ZINC000535023984 932887735 /nfs/dbraw/zinc/88/77/35/932887735.db2.gz NUCIHKFCSICRDU-AWEZNQCLSA-N 0 3 405.336 4.337 20 0 HIADHN C[C@@H](O)CN(Cc1cn(Cc2ccccc2)nc1-c1cccnc1)Cc1ccccc1 ZINC000535080713 932898929 /nfs/dbraw/zinc/89/89/29/932898929.db2.gz ALSMPTNJASGJJC-OAQYLSRUSA-N 0 3 412.537 4.376 20 0 HIADHN O=C(CN1CC[C@H](C2CCOCC2)C1)N[C@@H](c1ccccc1)c1ccc(Cl)cc1 ZINC000535117685 932934719 /nfs/dbraw/zinc/93/47/19/932934719.db2.gz VIWIXDVTKANXQX-URXFXBBRSA-N 0 3 412.961 4.294 20 0 HIADHN Cc1cc(C)c(C[C@@H](C(=O)N(CCN(C)C)Cc2ccccn2)C(F)(F)F)c(C)c1 ZINC000535153871 932970723 /nfs/dbraw/zinc/97/07/23/932970723.db2.gz ZXHFCPGTZDUWHG-NRFANRHFSA-N 0 3 421.507 4.318 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)N1CCC[C@@H]1Cn1cnc2ccccc21 ZINC000535216642 933021734 /nfs/dbraw/zinc/02/17/34/933021734.db2.gz QKSDOTWYQHEYOB-QPPBQGQZSA-N 0 3 417.557 4.047 20 0 HIADHN CN(C)[C@H](CNC(=O)c1cccnc1SCc1ccc(F)cc1)Cc1ccccc1 ZINC000535257588 933039903 /nfs/dbraw/zinc/03/99/03/933039903.db2.gz OAIBCRQKJUQZHQ-NRFANRHFSA-N 0 3 423.557 4.416 20 0 HIADHN COc1ccc(CN(C(=O)NC[C@H](Cc2ccccc2)N(C)C)[C@H](C)C2CC2)cc1 ZINC000535260743 933040686 /nfs/dbraw/zinc/04/06/86/933040686.db2.gz KEGOLGOGICNGDG-XXBNENTESA-N 0 3 409.574 4.178 20 0 HIADHN CC[C@@H](NC(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1)c1c(C)noc1C ZINC000535278735 933046913 /nfs/dbraw/zinc/04/69/13/933046913.db2.gz XPNYXKRAHLVSRY-XLIONFOSSA-N 0 3 409.452 4.313 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)c2ccn(-c3ccc(Cl)cc3)n2)CC1 ZINC000535291463 933054039 /nfs/dbraw/zinc/05/40/39/933054039.db2.gz BBAMSAXWKRGKRN-UHFFFAOYSA-N 0 3 408.933 4.262 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)CCc2c(C)nc3c4ccccc4nn3c2C)c1 ZINC000535420771 933127903 /nfs/dbraw/zinc/12/79/03/933127903.db2.gz LLZPIPQMPLJCND-UHFFFAOYSA-N 0 3 415.541 4.441 20 0 HIADHN CN(CCc1ccc(Br)cc1)C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000535437369 933135306 /nfs/dbraw/zinc/13/53/06/933135306.db2.gz QEZOIKFGTNLFCE-WOJBJXKFSA-N 0 3 416.363 4.078 20 0 HIADHN Cc1ccc(C(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)cc1NC(=O)c1ccco1 ZINC000535469138 933159842 /nfs/dbraw/zinc/15/98/42/933159842.db2.gz MLFNMBXULKCITB-KNQAVFIVSA-N 0 3 403.482 4.016 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)Nc2cnn(CC(C)C)c2C(F)F)N(C)C)cc1 ZINC000535538130 933231216 /nfs/dbraw/zinc/23/12/16/933231216.db2.gz IYPHXRDFMQMDFQ-GOSISDBHSA-N 0 3 407.509 4.464 20 0 HIADHN CN(C)CCN(Cc1cccc(O)c1)C(=O)[C@@H]1C[C@@H]1c1ccccc1C(F)(F)F ZINC000535640210 933280608 /nfs/dbraw/zinc/28/06/08/933280608.db2.gz SEYVJDPJXJJCSK-RTBURBONSA-N 0 3 406.448 4.105 20 0 HIADHN CC[C@H](c1ccncc1)N(C)C[C@@H](O)COc1ccc(Cl)cc1Br ZINC000535788677 933387452 /nfs/dbraw/zinc/38/74/52/933387452.db2.gz AFUMJHZLBFZLEU-NVXWUHKLSA-N 0 3 413.743 4.320 20 0 HIADHN COc1ccc(-c2ccccc2)cc1CN1CCC(C(=O)NCC(F)(F)F)CC1 ZINC000535796164 933394196 /nfs/dbraw/zinc/39/41/96/933394196.db2.gz YKTDMOPKSLMXFA-UHFFFAOYSA-N 0 3 406.448 4.253 20 0 HIADHN Cc1ccc(C(=O)NC2CCN(Cc3ccc(OC[C@@H]4CCCO4)cc3)CC2)s1 ZINC000535818165 933412111 /nfs/dbraw/zinc/41/21/11/933412111.db2.gz SSILREOPQYWWOY-NRFANRHFSA-N 0 3 414.571 4.009 20 0 HIADHN Cc1ccc(C(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)c(Br)c1 ZINC000535857583 933440411 /nfs/dbraw/zinc/44/04/11/933440411.db2.gz ZZSQNEZRTVJVSV-IAGOWNOFSA-N 0 3 423.395 4.109 20 0 HIADHN C[C@@H](Cc1cccc(Cl)c1)C(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000535909045 933483831 /nfs/dbraw/zinc/48/38/31/933483831.db2.gz BYPZBMAVAZJEEU-GBESFXJTSA-N 0 3 406.998 4.257 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)N1CCC[C@@H]1Cn1cnc2ccccc21 ZINC000535936575 933503771 /nfs/dbraw/zinc/50/37/71/933503771.db2.gz NTSWWKMYJUFHRR-GGAORHGYSA-N 0 3 417.557 4.047 20 0 HIADHN Cc1cccc(CNCc2ccccc2CS(=O)(=O)N2CCC(C)CC2)c1C ZINC000535959463 933524927 /nfs/dbraw/zinc/52/49/27/933524927.db2.gz MINXKTQNXISEQZ-UHFFFAOYSA-N 0 3 400.588 4.155 20 0 HIADHN Brc1ccc(N2CC[C@@H](NCc3cnc([C@H]4CCCO4)s3)C2)cc1 ZINC000535959875 933525144 /nfs/dbraw/zinc/52/51/44/933525144.db2.gz WEXSJYWTIYVBTP-RHSMWYFYSA-N 0 3 408.365 4.126 20 0 HIADHN CCC(CC)n1ncc(C(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)c1C ZINC000536009133 933565960 /nfs/dbraw/zinc/56/59/60/933565960.db2.gz AZSJUOHYDFBXEI-NRFANRHFSA-N 0 3 420.561 4.448 20 0 HIADHN Cc1ccc(OC2CCN(C(=O)NC[C@H](Cc3ccccc3)N(C)C)CC2)cc1C ZINC000536014266 933571560 /nfs/dbraw/zinc/57/15/60/933571560.db2.gz DKXFWRCQIILBGZ-QFIPXVFZSA-N 0 3 409.574 4.029 20 0 HIADHN O=C(CCN1CCC[C@H](c2nncn2C2CC2)C1)Nc1cc(Cl)ccc1Cl ZINC000536029906 933578879 /nfs/dbraw/zinc/57/88/79/933578879.db2.gz SQOGBCJIABOHLJ-ZDUSSCGKSA-N 0 3 408.333 4.128 20 0 HIADHN COCCc1nc(C)c([C@H](C)NCc2ccc(NC(=O)c3cccnc3)cc2)s1 ZINC000536153616 933689681 /nfs/dbraw/zinc/68/96/81/933689681.db2.gz WFQFJFDGELOMHS-HNNXBMFYSA-N 0 3 410.543 4.139 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@@H]2CNC(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)cc1 ZINC000536155151 933690923 /nfs/dbraw/zinc/69/09/23/933690923.db2.gz MUAKBJGQVUUVPF-SBFWRKJZSA-N 0 3 407.558 4.207 20 0 HIADHN CCO[C@@H]1C[C@@H](N[C@@H](c2ccc(C)cc2)c2cccc(S(C)(=O)=O)c2)C1(C)C ZINC000537289938 933699668 /nfs/dbraw/zinc/69/96/68/933699668.db2.gz ZGRZREAQLJPZKO-VSKRKVRLSA-N 0 3 401.572 4.281 20 0 HIADHN COc1ccc([C@@H](C)NCCc2cc(F)cc3c2OCOC3)c(Br)c1 ZINC000537294315 933701088 /nfs/dbraw/zinc/70/10/88/933701088.db2.gz CBKAUWIYYIDJQN-GFCCVEGCSA-N 0 3 410.283 4.357 20 0 HIADHN C[C@@H](NCCOCc1ccc(Cl)cc1Cl)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000537356195 933733690 /nfs/dbraw/zinc/73/36/90/933733690.db2.gz FCXURADTFLZWAM-GFCCVEGCSA-N 0 3 420.333 4.403 20 0 HIADHN O=C1[C@@H](N2CCN(C3CCCCC3)CC2)CCCN1Cc1cccc(C(F)(F)F)c1 ZINC000537361983 933737849 /nfs/dbraw/zinc/73/78/49/933737849.db2.gz CDFFQEGQSHXBIR-NRFANRHFSA-N 0 3 423.523 4.147 20 0 HIADHN C[C@]1(CCCO)CCCN1CC(=O)N[C@H](c1ccccc1)c1ccc(Cl)cc1 ZINC000537409802 933762892 /nfs/dbraw/zinc/76/28/92/933762892.db2.gz AKNJJCKWSVBFTG-DHIUTWEWSA-N 0 3 400.950 4.173 20 0 HIADHN CC1CCN([C@H](CNC(=O)N2CCC[C@@H]2C2CCOCC2)c2cccs2)CC1 ZINC000537413301 933764045 /nfs/dbraw/zinc/76/40/45/933764045.db2.gz JXGSCEOMKUBFIM-WOJBJXKFSA-N 0 3 405.608 4.122 20 0 HIADHN CN(C)c1noc([C@H]2CCCN(Cc3cc4ccccc4nc3N3CCCCC3)C2)n1 ZINC000562488916 945088482 /nfs/dbraw/zinc/08/84/82/945088482.db2.gz FPJXUGWUPRGOTI-IBGZPJMESA-N 0 3 420.561 4.054 20 0 HIADHN COc1ccccc1-c1csc([C@H]2CCCN(CCOC[C@H]3CCCO3)C2)n1 ZINC000562493371 945089505 /nfs/dbraw/zinc/08/95/05/945089505.db2.gz MKKWHXFYCGBKFG-ZWKOTPCHSA-N 0 3 402.560 4.194 20 0 HIADHN Cn1c2ccccc2nc1[C@H](NC1CCN(Cc2ccccn2)CC1)c1ccccc1 ZINC000562920677 945154140 /nfs/dbraw/zinc/15/41/40/945154140.db2.gz IAXINIZVIUAJMM-RUZDIDTESA-N 0 3 411.553 4.312 20 0 HIADHN c1sc(-c2ncccn2)nc1CN1CCC[C@@H](c2n[nH]c(C3CCCCC3)n2)C1 ZINC000537559935 938324003 /nfs/dbraw/zinc/32/40/03/938324003.db2.gz AMEYUVHDYSZQIY-MRXNPFEDSA-N 0 3 409.563 4.146 20 0 HIADHN Cc1nc([C@@H]2CCCN([C@@H](C(=O)Nc3cc(C)ccc3C)c3ccccc3)C2)n[nH]1 ZINC000537564328 938326102 /nfs/dbraw/zinc/32/61/02/938326102.db2.gz SVDLRTFFECSQED-IFMALSPDSA-N 0 3 403.530 4.289 20 0 HIADHN Cc1n[nH]c([C@@H]2CCCN([C@@H](C(=O)Nc3cc(C)ccc3C)c3ccccc3)C2)n1 ZINC000537564328 938326106 /nfs/dbraw/zinc/32/61/06/938326106.db2.gz SVDLRTFFECSQED-IFMALSPDSA-N 0 3 403.530 4.289 20 0 HIADHN Cc1nnc([C@@H]2CCCN([C@@H](C(=O)Nc3cc(C)ccc3C)c3ccccc3)C2)[nH]1 ZINC000537564328 938326110 /nfs/dbraw/zinc/32/61/10/938326110.db2.gz SVDLRTFFECSQED-IFMALSPDSA-N 0 3 403.530 4.289 20 0 HIADHN Cc1cc(NC(=O)NC/C=C/c2ccccc2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000537584951 938328924 /nfs/dbraw/zinc/32/89/24/938328924.db2.gz PIMAEIHTYFRDNQ-IYJBSMEOSA-N 0 3 415.541 4.473 20 0 HIADHN Cc1cc(NC(=O)NC/C=C\c2ccccc2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000537584953 938329098 /nfs/dbraw/zinc/32/90/98/938329098.db2.gz PIMAEIHTYFRDNQ-JQJJQDGNSA-N 0 3 415.541 4.473 20 0 HIADHN CCO[C@@H]1C[C@@H](O)C12CCN(Cc1ccc(-c3ccc(Br)cc3)o1)CC2 ZINC000537617129 938335033 /nfs/dbraw/zinc/33/50/33/938335033.db2.gz QIZSJUHYHYIKIK-WOJBJXKFSA-N 0 3 420.347 4.461 20 0 HIADHN Cn1cc(CN2CCC[C@@H](c3nc(C(F)(F)F)cs3)C2)c(-c2ccncc2)n1 ZINC000537622515 938337100 /nfs/dbraw/zinc/33/71/00/938337100.db2.gz AFJJGLKEHUOTFS-CQSZACIVSA-N 0 3 407.465 4.337 20 0 HIADHN CCO[C@H]1C[C@H](O)C12CCN(Cc1cn(-c3ccc(C)cc3)nc1C(C)(C)C)CC2 ZINC000537635475 938341931 /nfs/dbraw/zinc/34/19/31/938341931.db2.gz WQTFTJUFCSMUCT-VXKWHMMOSA-N 0 3 411.590 4.230 20 0 HIADHN CCN(CC(F)(F)F)C(=O)[C@H]1CCCN(Cc2ccc(OC(F)F)c(F)c2)C1 ZINC000537648572 938345912 /nfs/dbraw/zinc/34/59/12/938345912.db2.gz VEYQGKBEGMVJBZ-ZDUSSCGKSA-N 0 3 412.374 4.050 20 0 HIADHN c1csc(-c2nn(-c3ccccc3)cc2CN2CCC(Cn3ccnn3)CC2)c1 ZINC000537701652 938359221 /nfs/dbraw/zinc/35/92/21/938359221.db2.gz OZWAQDOEYLHAAV-UHFFFAOYSA-N 0 3 404.543 4.105 20 0 HIADHN C[C@H]1CCN(Cc2cn(Cc3ccccc3)nc2-c2cccnc2)C[C@@H]1n1ccnc1 ZINC000537724924 938363091 /nfs/dbraw/zinc/36/30/91/938363091.db2.gz JHFFSXVZGCVBRS-RDPSFJRHSA-N 0 3 412.541 4.273 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)Cc2c[nH]c3cc(Cl)ccc23)cc1 ZINC000537730940 938364860 /nfs/dbraw/zinc/36/48/60/938364860.db2.gz PXBCYKJLZDGIEO-JOCHJYFZSA-N 0 3 411.933 4.326 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)C3(Cc4ccc(Cl)cc4)CC3)CC2)C[C@H](C)O1 ZINC000537762489 938371557 /nfs/dbraw/zinc/37/15/57/938371557.db2.gz JKUCENFBAPWXNW-OALUTQOASA-N 0 3 419.009 4.401 20 0 HIADHN COc1ccc(NC(=O)[C@H](NC[C@@H]2CCO[C@@H](C)C2)c2ccccc2)cc1Cl ZINC000537775785 938374318 /nfs/dbraw/zinc/37/43/18/938374318.db2.gz RAMJADYSSJJGCE-GCKMJXCFSA-N 0 3 402.922 4.433 20 0 HIADHN CC[C@@](C)(NCCc1nc2sc3c(c2c(N)n1)CCCC3)c1nc(C)cs1 ZINC000537860170 938392481 /nfs/dbraw/zinc/39/24/81/938392481.db2.gz CZMHZTQRVWDOCS-HXUWFJFHSA-N 0 3 401.605 4.375 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(I)cc1)c1ccc([S@@](C)=O)cc1 ZINC000537939222 938424217 /nfs/dbraw/zinc/42/42/17/938424217.db2.gz IIHBKOHHHVQNPQ-OSRJUQGESA-N 0 3 413.324 4.440 20 0 HIADHN C[C@@H](NCc1ccccc1CS(=O)(=O)N1CCCC1)c1cc2c(s1)CCC2 ZINC000537941731 938425302 /nfs/dbraw/zinc/42/53/02/938425302.db2.gz BEMHBFIUNKPWFX-MRXNPFEDSA-N 0 3 404.601 4.013 20 0 HIADHN Clc1cccc(N2CCOCC2)c1CNc1cccc(CN2CCSCC2)c1 ZINC000563311793 945174178 /nfs/dbraw/zinc/17/41/78/945174178.db2.gz VVMPWZUWWJTLGW-UHFFFAOYSA-N 0 3 418.006 4.338 20 0 HIADHN C[C@H](NCCOc1ncc(Cl)cc1Cl)c1ccc(-n2cncn2)cc1Cl ZINC000537960783 938435136 /nfs/dbraw/zinc/43/51/36/938435136.db2.gz IYMSFHPSEFYNKB-NSHDSACASA-N 0 3 412.708 4.352 20 0 HIADHN CNS(=O)(=O)c1cccc([C@H](C)N[C@@H](Cc2ccccc2)c2cccs2)c1 ZINC000537970510 938440947 /nfs/dbraw/zinc/44/09/47/938440947.db2.gz XVQMVUKPAAXGTM-JXFKEZNVSA-N 0 3 400.569 4.291 20 0 HIADHN O=C(NCCN[C@@H]1CC2(CCC2)Oc2ccccc21)c1cccc(Br)c1 ZINC000537981304 938446424 /nfs/dbraw/zinc/44/64/24/938446424.db2.gz FVYGWHOFSSKJLX-GOSISDBHSA-N 0 3 415.331 4.215 20 0 HIADHN COc1ccc(CN2CC[C@H](N[C@H](C)c3ccc(OC)c4ccccc43)C2=O)cc1 ZINC000537983182 938448353 /nfs/dbraw/zinc/44/83/53/938448353.db2.gz BCFICYWBEUNRFG-HXOBKFHXSA-N 0 3 404.510 4.309 20 0 HIADHN Cc1cc(C)c2c(c1)[C@H](N[C@@H](C)c1ccc(S(=O)(=O)N(C)C)cc1)CCCO2 ZINC000537990706 938452288 /nfs/dbraw/zinc/45/22/88/938452288.db2.gz KBAXKHAVXQDQFX-LAUBAEHRSA-N 0 3 402.560 4.118 20 0 HIADHN CC[C@H](N[C@H](C)c1ccc(S(=O)(=O)N(C)C)cc1)c1ccc(OC(F)F)cc1 ZINC000537991281 938453315 /nfs/dbraw/zinc/45/33/15/938453315.db2.gz QSBLUVUJDQCJMC-KUHUBIRLSA-N 0 3 412.502 4.340 20 0 HIADHN CN1CCN(CCCCNC(=O)c2ccc(Sc3ccc(Cl)cc3)cc2)CC1 ZINC000538010700 938461333 /nfs/dbraw/zinc/46/13/33/938461333.db2.gz PAJVLXMFXDBSFM-UHFFFAOYSA-N 0 3 418.006 4.249 20 0 HIADHN C[C@H](NCCN1c2cccc3cccc(c23)S1(=O)=O)c1ccc(OC(F)F)cc1 ZINC000538122196 938509246 /nfs/dbraw/zinc/50/92/46/938509246.db2.gz REWRVAORLSXEAH-AWEZNQCLSA-N 0 3 418.465 4.301 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@H](C)N[C@H](C)c2cccc(OC(C)C)c2)cc1F ZINC000538126367 938512534 /nfs/dbraw/zinc/51/25/34/938512534.db2.gz KSBHTLDIIGKMPJ-SJORKVTESA-N 0 3 402.510 4.319 20 0 HIADHN Cc1ccc(S(=O)(=O)CCCN2CCC(CN(C)Cc3ccccc3)CC2)cc1 ZINC000538139112 938517101 /nfs/dbraw/zinc/51/71/01/938517101.db2.gz PVCXOKGJMDLSAV-UHFFFAOYSA-N 0 3 414.615 4.003 20 0 HIADHN CC[C@@H](NCC(=O)N1CCC[C@@H]1c1ccc2c(c1)OCCCO2)c1ccc(OC)cc1 ZINC000538142273 938518645 /nfs/dbraw/zinc/51/86/45/938518645.db2.gz ZYBBFVGMQSVKTK-FGZHOGPDSA-N 0 3 424.541 4.261 20 0 HIADHN CC[C@H](NCCO[C@@H]1CCCC[C@@H]1C)c1ccccc1OCC(=O)N1CCCC1 ZINC000538149786 938522334 /nfs/dbraw/zinc/52/23/34/938522334.db2.gz DMOGMNVVZZNQSU-ILWGZMRPSA-N 0 3 402.579 4.324 20 0 HIADHN CN1CC[C@H](N[C@@H]2CCN(c3ccc(Cl)cc3Cl)C2=O)[C@@H]1c1ccccc1 ZINC000563330031 945182972 /nfs/dbraw/zinc/18/29/72/945182972.db2.gz HLQIELQEIXIFPH-NSHGMRRFSA-N 0 3 404.341 4.134 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(OCC(F)(F)F)cc1)C(=O)NCCc1cccs1 ZINC000538161366 938530164 /nfs/dbraw/zinc/53/01/64/938530164.db2.gz AICLVEDPCVGPTB-ZIAGYGMSSA-N 0 3 400.466 4.087 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)NCCc1cccs1)c1ccc(OCC(F)(F)F)cc1 ZINC000538161364 938530555 /nfs/dbraw/zinc/53/05/55/938530555.db2.gz AICLVEDPCVGPTB-KGLIPLIRSA-N 0 3 400.466 4.087 20 0 HIADHN CC[C@@H](NCC(=O)N(Cc1ccccc1)CC(F)(F)F)c1ccc2c(c1)OCCO2 ZINC000538174742 938536036 /nfs/dbraw/zinc/53/60/36/938536036.db2.gz FTACBRYSRBJQOH-GOSISDBHSA-N 0 3 422.447 4.090 20 0 HIADHN NC(=O)c1ccc(NC(=O)CCN[C@@H](CC(F)(F)F)c2ccccc2)cc1Cl ZINC000538180306 938541147 /nfs/dbraw/zinc/54/11/47/938541147.db2.gz NBRXUHMYPFVDAT-INIZCTEOSA-N 0 3 413.827 4.051 20 0 HIADHN Cc1cccc([C@@H](C)NCC(=O)Nc2cc(C(F)(F)F)ccc2-n2cncn2)c1C ZINC000538186456 938543173 /nfs/dbraw/zinc/54/31/73/938543173.db2.gz ODHDOTNFDCGASQ-OAHLLOKOSA-N 0 3 417.435 4.192 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(NC(=O)c2ccncc2)cc1)C(=O)N(C)Cc1ccccc1 ZINC000538194803 938548911 /nfs/dbraw/zinc/54/89/11/938548911.db2.gz LQCFEEQOUPHANB-OALUTQOASA-N 0 3 416.525 4.032 20 0 HIADHN C[C@@H](NC[C@H](O)COc1cc(Cl)ccc1Cl)c1cccc(N2CCCC2=O)c1 ZINC000538208480 938555942 /nfs/dbraw/zinc/55/59/42/938555942.db2.gz QAZBIPMEYVSONN-KDOFPFPSSA-N 0 3 423.340 4.211 20 0 HIADHN C[C@H](NC[C@@H](O)COc1cc(Cl)ccc1Cl)c1cccc(N2CCCC2=O)c1 ZINC000538208479 938556251 /nfs/dbraw/zinc/55/62/51/938556251.db2.gz QAZBIPMEYVSONN-KBXCAEBGSA-N 0 3 423.340 4.211 20 0 HIADHN CCNC(=O)c1cccc(NC(=O)CN[C@H](c2ccc(C(F)(F)F)cc2)C(C)C)c1 ZINC000538223563 938563180 /nfs/dbraw/zinc/56/31/80/938563180.db2.gz SFVHBQWDURSINL-FQEVSTJZSA-N 0 3 421.463 4.381 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(-n2ccnn2)cc1)C(=O)N[C@@H](C)c1ccc2ccccc2c1 ZINC000538234384 938568142 /nfs/dbraw/zinc/56/81/42/938568142.db2.gz LSSCYGSQGTUEFS-FHWLQOOXSA-N 0 3 413.525 4.337 20 0 HIADHN Cc1cc(NC(=O)CN[C@H](C)c2ccc(-n3cccn3)cc2)ccc1Br ZINC000538236990 938569220 /nfs/dbraw/zinc/56/92/20/938569220.db2.gz GCMACIQIWCAPJW-OAHLLOKOSA-N 0 3 413.319 4.233 20 0 HIADHN C[C@H](NCC(=O)NCc1ccc(OC(F)(F)F)cc1)c1cccc(N2CCCC2)c1 ZINC000538277979 938582146 /nfs/dbraw/zinc/58/21/46/938582146.db2.gz WQUYOMFPJUQKLZ-INIZCTEOSA-N 0 3 421.463 4.152 20 0 HIADHN O=C(CN[C@@H](c1ccc2c(c1)OCCO2)C1CC1)N(Cc1ccco1)c1ccccc1 ZINC000538388801 938609066 /nfs/dbraw/zinc/60/90/66/938609066.db2.gz CPNFWGCPEBORGQ-RUZDIDTESA-N 0 3 418.493 4.325 20 0 HIADHN C[C@H](NC(=O)CN[C@H](c1ccc2c(c1)OCCO2)C1CC1)c1ccc(Cl)cc1 ZINC000538391872 938609537 /nfs/dbraw/zinc/60/95/37/938609537.db2.gz ZXIOERIQPFXSTC-FPTDNZKUSA-N 0 3 400.906 4.029 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)c1coc(-c2ccccc2Cl)n1 ZINC000538431199 938618215 /nfs/dbraw/zinc/61/82/15/938618215.db2.gz MJOWXSOCYJIDHO-UHFFFAOYSA-N 0 3 401.869 4.338 20 0 HIADHN O=C(N[C@H]1CCCOCC1)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000538513019 938638969 /nfs/dbraw/zinc/63/89/69/938638969.db2.gz QGSAORZGSBOEKO-KRWDZBQOSA-N 0 3 414.377 4.170 20 0 HIADHN C[C@]1(CCCO)CCCN1CC(=O)NC[C@H](c1c[nH]c2ccccc21)c1ccccc1 ZINC000538514535 938639049 /nfs/dbraw/zinc/63/90/49/938639049.db2.gz JAUIZYTXJDVFLG-BKMJKUGQSA-N 0 3 419.569 4.043 20 0 HIADHN CN(C)[C@@H](CNC(=O)Nc1ccc2nc(-c3ccccn3)oc2c1)c1ccccc1 ZINC000538625260 938665043 /nfs/dbraw/zinc/66/50/43/938665043.db2.gz ORMJNGPORXZFIG-FQEVSTJZSA-N 0 3 401.470 4.314 20 0 HIADHN O[C@@H](COc1ccccc1Cl)CN1CCC[C@@H](c2nnc(C3CCCCC3)[nH]2)C1 ZINC000538665477 938679724 /nfs/dbraw/zinc/67/97/24/938679724.db2.gz GYPPZLQOHQXGOG-QZTJIDSGSA-N 0 3 418.969 4.125 20 0 HIADHN O=C(CCN1CCC(C(=O)Nc2cc(Cl)ccc2O)CC1)c1ccc(F)cc1 ZINC000538668510 938681013 /nfs/dbraw/zinc/68/10/13/938681013.db2.gz RAKLZFZZMDTRFO-UHFFFAOYSA-N 0 3 404.869 4.108 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cc(C)n(-c4cccc(F)c4)n3)c(C)c2)CC1 ZINC000538690177 938684697 /nfs/dbraw/zinc/68/46/97/938684697.db2.gz QXYPXEBNTLINBH-UHFFFAOYSA-N 0 3 421.520 4.022 20 0 HIADHN CCC1(O)CCN(Cc2cn(-c3ccc(Br)cc3)nc2C(C)C)CC1 ZINC000538716795 938688899 /nfs/dbraw/zinc/68/88/99/938688899.db2.gz AYJGHTFLTXMJEN-UHFFFAOYSA-N 0 3 406.368 4.495 20 0 HIADHN C[C@@]1(C2CCN(Cc3ccc(-c4cccc(Cl)c4Cl)o3)CC2)NC(=O)NC1=O ZINC000538723721 938691781 /nfs/dbraw/zinc/69/17/81/938691781.db2.gz VKANRMNZENBBKU-FQEVSTJZSA-N 0 3 422.312 4.064 20 0 HIADHN COc1cc(N[C@@H]2CCCN(Cc3ccc(Oc4cnccn4)cc3)C2)cc(OC)c1 ZINC000538750921 938701227 /nfs/dbraw/zinc/70/12/27/938701227.db2.gz GQCUGSFSSHRDNS-LJQANCHMSA-N 0 3 420.513 4.363 20 0 HIADHN COC(=O)c1cc2c(o1)c(OC)ccc2CN1CCC(OCC2CCCC2)CC1 ZINC000538764236 938704885 /nfs/dbraw/zinc/70/48/85/938704885.db2.gz VQVZNOJNHPRFJC-UHFFFAOYSA-N 0 3 401.503 4.399 20 0 HIADHN CCOCCO[C@H]1CCN(Cc2cccc(NC(=O)c3ccc(Cl)cc3)c2)C1 ZINC000538795876 938714137 /nfs/dbraw/zinc/71/41/37/938714137.db2.gz BLMKDUPPIPTOHN-NRFANRHFSA-N 0 3 402.922 4.220 20 0 HIADHN COc1ccc(CN(C(=O)N[C@@H]2C[C@@H](C)N(C3CC3)C2)C2CCCCC2)cc1OC ZINC000538811766 938718998 /nfs/dbraw/zinc/71/89/98/938718998.db2.gz FMHJFSFTGOVXKQ-IEBWSBKVSA-N 0 3 415.578 4.173 20 0 HIADHN CN1CCN(Cc2cccc(NCc3ccccc3OCc3ccncc3)c2)CC1 ZINC000538828016 938721156 /nfs/dbraw/zinc/72/11/56/938721156.db2.gz FUSDLJCLVPNIHZ-UHFFFAOYSA-N 0 3 402.542 4.020 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)Cc2nc(-c3ccccc3)oc2C)cc1 ZINC000538831408 938722112 /nfs/dbraw/zinc/72/21/12/938722112.db2.gz YXYXLHCVXVEEQP-QHCPKHFHSA-N 0 3 419.525 4.154 20 0 HIADHN COCCc1nc(C)c([C@H](C)NCc2ccc(CN3C[C@@H](C)O[C@@H](C)C3)cc2)s1 ZINC000538867699 938728176 /nfs/dbraw/zinc/72/81/76/938728176.db2.gz PFXTXNFIXDWDED-KSZLIROESA-N 0 3 417.619 4.100 20 0 HIADHN COc1ccc([C@@H](Cc2ccc(F)cc2)NCc2cccnc2-n2cccn2)cc1 ZINC000538869972 938728685 /nfs/dbraw/zinc/72/86/85/938728685.db2.gz ZCEFOSOOXOHEQV-HSZRJFAPSA-N 0 3 402.473 4.489 20 0 HIADHN C[C@H](CC(=O)Nc1ccc2oc(=O)n(CCN(C)C)c2c1)Cc1ccc(Cl)cc1 ZINC000538955751 938748549 /nfs/dbraw/zinc/74/85/49/938748549.db2.gz LWTDKKIQZWTDIY-HNNXBMFYSA-N 0 3 415.921 4.017 20 0 HIADHN CCc1ccc([C@H](CNC(=O)c2ccc(-c3noc(C(F)F)n3)cc2)N(C)C)cc1 ZINC000538966391 938753782 /nfs/dbraw/zinc/75/37/82/938753782.db2.gz GRDSTDWAANYYAG-SFHVURJKSA-N 0 3 414.456 4.269 20 0 HIADHN CSc1ccc([C@@H](C)NCc2ccc(S(=O)(=O)N3CCCCC3)cc2)cc1 ZINC000539019059 938770607 /nfs/dbraw/zinc/77/06/07/938770607.db2.gz SFUQDVOCRFDOSG-QGZVFWFLSA-N 0 3 404.601 4.434 20 0 HIADHN COCC[C@@H](NCc1cc(Br)c2c(c1)OCCO2)c1ccc(F)cc1 ZINC000539041488 938778694 /nfs/dbraw/zinc/77/86/94/938778694.db2.gz LGSILOYWVKZXTN-QGZVFWFLSA-N 0 3 410.283 4.227 20 0 HIADHN O=S(=O)(Cc1ccccc1CN[C@@H]1CCc2c1cccc2Cl)N1CCCC1 ZINC000539041734 938778793 /nfs/dbraw/zinc/77/87/93/938778793.db2.gz QBMKYGWWHVPYKW-OAQYLSRUSA-N 0 3 404.963 4.043 20 0 HIADHN CC(C)c1ccc([C@H](C)NCc2ccc(S(=O)(=O)NC[C@@H]3CCCO3)cc2)cc1 ZINC000539041333 938779037 /nfs/dbraw/zinc/77/90/37/938779037.db2.gz MAFJJDGZCIBRNQ-AVRDEDQJSA-N 0 3 416.587 4.118 20 0 HIADHN CCc1ccccc1NC(=O)C[C@H](C)N[C@@H]1CC(=O)N(C)[C@@H]1c1ccc(Cl)cc1 ZINC000539049571 938782408 /nfs/dbraw/zinc/78/24/08/938782408.db2.gz UVEYCTGQNOBBMZ-UYGSHGSRSA-N 0 3 413.949 4.181 20 0 HIADHN C[C@H](N[C@H]1CC(=O)N(C)[C@H]1c1ccc(Cl)cc1)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000539049416 938782506 /nfs/dbraw/zinc/78/25/06/938782506.db2.gz QLGZXMVIPCRYAC-LPLGYCIKSA-N 0 3 411.933 4.192 20 0 HIADHN COCCc1nc(C)c([C@H](C)NCc2ccc(COC3CCOCC3)cc2)s1 ZINC000539051760 938783395 /nfs/dbraw/zinc/78/33/95/938783395.db2.gz DGSGTVQHEGWHSP-INIZCTEOSA-N 0 3 404.576 4.187 20 0 HIADHN Cc1cccc(NC(=O)C[C@H](C)N[C@@H]2CC(=O)N(C)[C@H]2c2ccc(Cl)cc2)c1C ZINC000539051817 938783904 /nfs/dbraw/zinc/78/39/04/938783904.db2.gz BXXYTPKYDNDUGG-NQKDMWHGSA-N 0 3 413.949 4.236 20 0 HIADHN Cc1nc(-c2ccccc2F)sc1[C@H](C)N[C@H]1CCCN(CC(F)(F)F)C1=O ZINC000539053524 938784965 /nfs/dbraw/zinc/78/49/65/938784965.db2.gz XSZPOGZSMBIHQH-NHYWBVRUSA-N 0 3 415.456 4.462 20 0 HIADHN C[C@H](N[C@H](COc1ccccc1F)c1ccccc1)c1ccc(-n2cnnn2)cc1 ZINC000539066959 938791189 /nfs/dbraw/zinc/79/11/89/938791189.db2.gz MTFULJYVNMPWQR-HTAPYJJXSA-N 0 3 403.461 4.272 20 0 HIADHN C[C@@H](NC[C@@H](c1cccc(Cl)c1)N1CCOCC1)c1nc2c(s1)CCCC2 ZINC000539081335 938798114 /nfs/dbraw/zinc/79/81/14/938798114.db2.gz ZSBZJHTUOWFMAT-BEFAXECRSA-N 0 3 405.995 4.399 20 0 HIADHN C[C@@H](N[C@H]1CCN(CC(F)(F)F)C1=O)c1ccc(SCC(F)(F)F)cc1 ZINC000539080600 938798393 /nfs/dbraw/zinc/79/83/93/938798393.db2.gz VOWWTLIPRAWOID-MFKMUULPSA-N 0 3 400.388 4.155 20 0 HIADHN COC[C@@H](N[C@@H](C)CC(=O)Nc1ccc(OC(F)(F)F)cc1)c1ccc(F)cc1 ZINC000539090014 938800840 /nfs/dbraw/zinc/80/08/40/938800840.db2.gz GGHWMZZNBXLEIA-SCLBCKFNSA-N 0 3 414.399 4.419 20 0 HIADHN COc1cc(CN[C@@H](Cc2ccc(Cl)cc2)c2ccccc2)ccc1OCC(N)=O ZINC000539091183 938801065 /nfs/dbraw/zinc/80/10/65/938801065.db2.gz PYDMJDYQGYCZDN-NRFANRHFSA-N 0 3 424.928 4.286 20 0 HIADHN C[C@@H](NCc1ccc(S(=O)(=O)N2CCCC2)cc1)c1cc2c(s1)CCCC2 ZINC000539092709 938801768 /nfs/dbraw/zinc/80/17/68/938801768.db2.gz DFZVESQOGZGNOK-MRXNPFEDSA-N 0 3 404.601 4.262 20 0 HIADHN Fc1ccc(-c2nc(CN[C@@H]3CCCOc4ccc(Br)cc43)n[nH]2)cc1 ZINC000539119550 938805401 /nfs/dbraw/zinc/80/54/01/938805401.db2.gz RGXQQAKMZFHXBY-MRXNPFEDSA-N 0 3 417.282 4.377 20 0 HIADHN CCCN1c2ccc(NC(=O)N[C@H]3C[C@@H](C)N(Cc4ccccc4)C3)cc2CCC1=O ZINC000539130783 938808153 /nfs/dbraw/zinc/80/81/53/938808153.db2.gz OKGPDALXNACYPD-GCJKJVERSA-N 0 3 420.557 4.160 20 0 HIADHN COc1cc(CN[C@H](c2ccccc2F)C2CCCC2)ccc1OCC(=O)N(C)C ZINC000539214542 938819827 /nfs/dbraw/zinc/81/98/27/938819827.db2.gz OYCBPZWTUIXPHD-DEOSSOPVSA-N 0 3 414.521 4.322 20 0 HIADHN Cc1ccccc1CCNC(=O)[C@H](C)N[C@@H](C)c1ccc(OCc2cccnc2)cc1 ZINC000539226679 938821705 /nfs/dbraw/zinc/82/17/05/938821705.db2.gz NYZYIALBJIZLRI-SFTDATJTSA-N 0 3 417.553 4.367 20 0 HIADHN Cc1cc(C)c(NC(=O)CNC(=O)CN[C@H](CC(C)C)c2ccccc2C)c(C)c1 ZINC000539261308 938829130 /nfs/dbraw/zinc/82/91/30/938829130.db2.gz NRUGNZKEPOSNNE-JOCHJYFZSA-N 0 3 409.574 4.352 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccccc1-n1cccn1)C(=O)Nc1ccc(OC(F)F)cc1 ZINC000539261105 938829191 /nfs/dbraw/zinc/82/91/91/938829191.db2.gz YTYKHCGLYUHEDN-LSDHHAIUSA-N 0 3 400.429 4.152 20 0 HIADHN CCC[C@H](NCC(=O)Nc1cccc(C(=O)N(C)C)c1)c1cccc(C(F)(F)F)c1 ZINC000539261073 938829303 /nfs/dbraw/zinc/82/93/03/938829303.db2.gz XWXOUZSNYSAVHA-IBGZPJMESA-N 0 3 421.463 4.477 20 0 HIADHN CCOc1ccc([C@@H]2CCCN2C(=O)CN[C@H](CC)c2ccc3c(c2)OCCO3)cc1 ZINC000539279848 938832791 /nfs/dbraw/zinc/83/27/91/938832791.db2.gz LZMDVACRSQFENG-YADHBBJMSA-N 0 3 424.541 4.261 20 0 HIADHN C[C@H](N[C@@H](C)c1cccc(-n2cccn2)c1)C(=O)Nc1cccc(Br)c1 ZINC000539289061 938834097 /nfs/dbraw/zinc/83/40/97/938834097.db2.gz NSMMDUWKARQIQW-GJZGRUSLSA-N 0 3 413.319 4.313 20 0 HIADHN O=C(CN[C@H](c1ccccc1)[C@H]1CCOC1)Nc1ccc2c(c1)OC1(CCCCC1)O2 ZINC000539288772 938834203 /nfs/dbraw/zinc/83/42/03/938834203.db2.gz FDWVDSSQSWOCOO-YADARESESA-N 0 3 422.525 4.424 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)N[C@@H]1CCO[C@H]1c1ccc(Cl)cc1 ZINC000539292545 938835066 /nfs/dbraw/zinc/83/50/66/938835066.db2.gz FHZDBZJECGKUOX-RTWAWAEBSA-N 0 3 419.928 4.083 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(NC(=O)c2ccncc2)cc1)C(=O)NCCC1=CCCCC1 ZINC000539298308 938836094 /nfs/dbraw/zinc/83/60/94/938836094.db2.gz ORVGMPYXQKPQTF-OALUTQOASA-N 0 3 420.557 4.380 20 0 HIADHN COCCOc1ccc(C(F)(F)F)cc1NC(=O)[C@H](C)N[C@@H](C)c1ccccc1 ZINC000539303784 938837375 /nfs/dbraw/zinc/83/73/75/938837375.db2.gz LPZXYYOTKYENOP-GJZGRUSLSA-N 0 3 410.436 4.408 20 0 HIADHN C[C@@H](NC[C@H](O)COc1ccc2ccccc2c1)c1cccc(N2CCCC2=O)c1 ZINC000539308743 938838341 /nfs/dbraw/zinc/83/83/41/938838341.db2.gz KDHQSUWPPFQYHK-JPYJTQIMSA-N 0 3 404.510 4.057 20 0 HIADHN O=C(CN[C@@H](c1ccc(F)cc1)C1CCCC1)Nc1ccccc1N1CCCC1=O ZINC000539313718 938839587 /nfs/dbraw/zinc/83/95/87/938839587.db2.gz IEEKQKQGWFCUQV-XMMPIXPASA-N 0 3 409.505 4.412 20 0 HIADHN CC[C@H](NCCC(=O)Nc1ccc(N2CCCC2=O)cc1)c1ccc(F)cc1F ZINC000539316198 938840024 /nfs/dbraw/zinc/84/00/24/938840024.db2.gz KUNRHYSINRLBLB-FQEVSTJZSA-N 0 3 401.457 4.161 20 0 HIADHN COc1cc(OC)cc(N2CC[C@@H](N[C@@H](C)c3ccc(-c4cccnc4)cc3)C2=O)c1 ZINC000539334724 938843545 /nfs/dbraw/zinc/84/35/45/938843545.db2.gz HKTZHKIXAMMVRM-BXKMTCNYSA-N 0 3 417.509 4.222 20 0 HIADHN O=C(CN[C@H](C[C@H]1CCOC1)c1ccccc1)Nc1ccc(Br)cc1F ZINC000539334709 938843618 /nfs/dbraw/zinc/84/36/18/938843618.db2.gz GQHDGCNNSLMAPP-AUUYWEPGSA-N 0 3 421.310 4.284 20 0 HIADHN COc1ccc(CN(C)C(=O)CN[C@H](c2cccc(F)c2)C(C)(C)C)cc1OC ZINC000539335354 938843819 /nfs/dbraw/zinc/84/38/19/938843819.db2.gz AISFNSJZJFXPPY-JOCHJYFZSA-N 0 3 402.510 4.178 20 0 HIADHN O=C(CN[C@H](C[C@H]1CCOC1)c1ccccc1)N[C@@H](c1nccs1)c1ccccc1 ZINC000539335360 938843915 /nfs/dbraw/zinc/84/39/15/938843915.db2.gz AZRMPEBXZQWWOK-JMUQELJHSA-N 0 3 421.566 4.106 20 0 HIADHN C[C@H](NCC(=O)N(Cc1ccccc1)[C@@H](C)C1CC1)c1ccc(-n2cccn2)cc1 ZINC000539337331 938844316 /nfs/dbraw/zinc/84/43/16/938844316.db2.gz POBNEELEIANEES-PMACEKPBSA-N 0 3 402.542 4.350 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(-n2cccn2)cc1)C(=O)Nc1ccc(OC(F)F)cc1 ZINC000539337605 938844350 /nfs/dbraw/zinc/84/43/50/938844350.db2.gz CXIHWBCUBIMRTP-LSDHHAIUSA-N 0 3 400.429 4.152 20 0 HIADHN CC(=O)c1cccc(OC[C@@H](O)CN[C@H](Cc2ccccc2)c2ccccc2F)c1 ZINC000539360919 938848422 /nfs/dbraw/zinc/84/84/22/938848422.db2.gz XWKJBLDINGZOMD-SQJMNOBHSA-N 0 3 407.485 4.342 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)NCC(=O)N(C)[C@H]2CCCc3ccccc32)cc1 ZINC000539368653 938849897 /nfs/dbraw/zinc/84/98/97/938849897.db2.gz PLFHZVOESAHIDQ-UUOWRZLLSA-N 0 3 402.542 4.367 20 0 HIADHN C[C@H](N[C@@H](C)c1cccc(N2CCCC2)c1)C(=O)NCCc1c[nH]c2ccccc12 ZINC000539379933 938851743 /nfs/dbraw/zinc/85/17/43/938851743.db2.gz JRFPNDUWKIJUAA-OALUTQOASA-N 0 3 404.558 4.166 20 0 HIADHN COc1cc(OC)c(NC(=O)CN[C@H](C)c2cccc(N3CCCC3)c2)cc1Cl ZINC000539378998 938851758 /nfs/dbraw/zinc/85/17/58/938851758.db2.gz NJEFXBMBJRPBLS-OAHLLOKOSA-N 0 3 417.937 4.247 20 0 HIADHN C[C@@H]1C[C@@H]1[C@H](NCC(=O)Nc1ccccc1N1CCCC1=O)c1ccc(Cl)cc1 ZINC000539421131 938857882 /nfs/dbraw/zinc/85/78/82/938857882.db2.gz BGWSFAMAJSVMFU-KFCXZAFISA-N 0 3 411.933 4.392 20 0 HIADHN O=C(Nc1ccc(Cl)cc1C(=O)c1ccc[nH]1)N1CCCN(C2CCCC2)CC1 ZINC000539427294 938859177 /nfs/dbraw/zinc/85/91/77/938859177.db2.gz SGLTYJDWCNDBJQ-UHFFFAOYSA-N 0 3 414.937 4.381 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)N[C@@H]1CCO[C@H]1c1ccc(F)c(F)c1 ZINC000539439697 938860493 /nfs/dbraw/zinc/86/04/93/938860493.db2.gz PAQZQKNMIHVBKE-QUCCMNQESA-N 0 3 400.425 4.033 20 0 HIADHN O=C(c1ccc(CNCc2ccc(F)c(-c3cccs3)c2)cc1)N1CCOCC1 ZINC000539472797 938865690 /nfs/dbraw/zinc/86/56/90/938865690.db2.gz JLLRCUOIRDVYNM-UHFFFAOYSA-N 0 3 410.514 4.316 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)N[C@H]2CCCOc3cc(Cl)ccc32)CC1 ZINC000539475698 938865971 /nfs/dbraw/zinc/86/59/71/938865971.db2.gz WCYBQGASGJINQX-FQEVSTJZSA-N 0 3 417.937 4.453 20 0 HIADHN COC(=O)[C@@H]1CCCC[C@]1(C)NCc1ccnc(-c2ccc(Br)cc2)n1 ZINC000539479088 938866370 /nfs/dbraw/zinc/86/63/70/938866370.db2.gz FBUOSMLWVIOCCQ-PXNSSMCTSA-N 0 3 418.335 4.118 20 0 HIADHN C[C@H](NC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2)c1cc2cc(Cl)ccc2o1 ZINC000539498931 938869305 /nfs/dbraw/zinc/86/93/05/938869305.db2.gz WUIMUURLNLRPGP-SUMWQHHRSA-N 0 3 414.889 4.061 20 0 HIADHN O=C(NCCNCc1cnc(-c2cccs2)s1)c1cccc(Br)c1 ZINC000539502181 938869510 /nfs/dbraw/zinc/86/95/10/938869510.db2.gz RJWHJSJTYACDQC-UHFFFAOYSA-N 0 3 422.373 4.154 20 0 HIADHN CCOC(=O)c1c2c(sc1NC(=O)[C@H]1CCC(=O)C[C@H]1C)C(C)(C)NC(C)(C)C2 ZINC000539550226 938878552 /nfs/dbraw/zinc/87/85/52/938878552.db2.gz CJCITCFANRTUSF-OCCSQVGLSA-N 0 3 420.575 4.028 20 0 HIADHN CC(C)N1CCN([C@@H]2CCN(C(=O)N[C@@H]3C[C@H]4CCC(C)(C)c5cccc3c54)C2)CC1 ZINC000539566725 938880856 /nfs/dbraw/zinc/88/08/56/938880856.db2.gz SOIGJKBHNFRCPX-TXTKFYIRSA-N 0 3 424.633 4.096 20 0 HIADHN Cc1cc(NC(=O)N(CCN(C)C)Cc2cccc(F)c2)nn1-c1cccc(F)c1 ZINC000539580948 938882953 /nfs/dbraw/zinc/88/29/53/938882953.db2.gz AVIUAWBFGRIGJK-UHFFFAOYSA-N 0 3 413.472 4.055 20 0 HIADHN Cc1cc(C(=O)N2CCCN(C(C)(C)C)CC2)nn1-c1ccc(Cl)cc1Cl ZINC000539583597 938883602 /nfs/dbraw/zinc/88/36/02/938883602.db2.gz WLPWNXOQHTYXES-UHFFFAOYSA-N 0 3 409.361 4.434 20 0 HIADHN CC(C)c1nn(-c2ccccc2)cc1CNC[C@@H](Cc1ccccc1Cl)C(N)=O ZINC000539634489 938891288 /nfs/dbraw/zinc/89/12/88/938891288.db2.gz HGZARIFNJOOWJY-GOSISDBHSA-N 0 3 410.949 4.083 20 0 HIADHN COc1ccc([C@H](C)Nc2ccc3c(c2)n(C)c(=O)n3C)cc1CN1CCCCC1 ZINC000539655297 938894791 /nfs/dbraw/zinc/89/47/91/938894791.db2.gz PAFSUBWVZSOTPS-KRWDZBQOSA-N 0 3 408.546 4.045 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](NCCCCC2CCOCC2)c2ccccc2)c1 ZINC000539710298 938908667 /nfs/dbraw/zinc/90/86/67/938908667.db2.gz QRGQKZHGDAEDKK-QHCPKHFHSA-N 0 3 401.572 4.366 20 0 HIADHN O=C(c1ccc(Cn2ccnc2)cc1)N1CCC[C@H](c2n[nH]c(C3CCCCC3)n2)C1 ZINC000539752966 938921360 /nfs/dbraw/zinc/92/13/60/938921360.db2.gz LSSCQKOEFDTHLR-NRFANRHFSA-N 0 3 418.545 4.117 20 0 HIADHN COc1ccc([C@H]2CCCN2C(=O)CN[C@@]2(C)CCCc3ccccc32)c(OC)c1 ZINC000539808182 938938898 /nfs/dbraw/zinc/93/88/98/938938898.db2.gz YRIKIWCIRUUSCM-RDGATRHJSA-N 0 3 408.542 4.209 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)CN[C@]2(C)CCCc3ccccc32)c(OC)c1 ZINC000539808183 938939290 /nfs/dbraw/zinc/93/92/90/938939290.db2.gz YRIKIWCIRUUSCM-WIOPSUGQSA-N 0 3 408.542 4.209 20 0 HIADHN CS(=O)(=O)[C@@H]1CCC[C@@H](N[C@H](c2ccccc2)c2ccc(OC(F)F)cc2)C1 ZINC000539813194 938940149 /nfs/dbraw/zinc/94/01/49/938940149.db2.gz SWJUARCZEPFQEK-MISYRCLQSA-N 0 3 409.498 4.323 20 0 HIADHN CCO[C@@H]1C[C@@H](O)C12CCN(Cc1ccc(OCc3cccs3)c(OC)c1)CC2 ZINC000539819820 938943428 /nfs/dbraw/zinc/94/34/28/938943428.db2.gz VSKYCOFRYMTCNP-FGZHOGPDSA-N 0 3 417.571 4.088 20 0 HIADHN CC(=O)Nc1ccccc1CN1CCC(C(=O)N(Cc2ccccc2)C2CC2)CC1 ZINC000539819995 938943648 /nfs/dbraw/zinc/94/36/48/938943648.db2.gz VRGRUWREKGMNDF-UHFFFAOYSA-N 0 3 405.542 4.048 20 0 HIADHN CCOc1cc(CN(C)[C@H](CCO)c2ccccc2)cc(Br)c1OC ZINC000539827161 938947887 /nfs/dbraw/zinc/94/78/87/938947887.db2.gz DJNCARWHSFPDEP-GOSISDBHSA-N 0 3 408.336 4.412 20 0 HIADHN Cc1nn(CC(=O)OC(C)C)c(C)c1CN1CCC(OC2CCC(C)CC2)CC1 ZINC000539831894 938951660 /nfs/dbraw/zinc/95/16/60/938951660.db2.gz KWIDDNWCBBCKAS-UHFFFAOYSA-N 0 3 405.583 4.011 20 0 HIADHN CCO[C@@H]1C[C@H](O)C12CCN(Cc1ccc(OC)c(OCc3ccccc3)c1)CC2 ZINC000539838489 938953602 /nfs/dbraw/zinc/95/36/02/938953602.db2.gz SHCSIHVGBQLVRK-BJKOFHAPSA-N 0 3 411.542 4.026 20 0 HIADHN OC1CCN(Cc2ccccc2NCc2ccccc2OCc2cccnc2)CC1 ZINC000539921215 938977924 /nfs/dbraw/zinc/97/79/24/938977924.db2.gz VYOKXIWDNWSLPI-UHFFFAOYSA-N 0 3 403.526 4.229 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)Cc2ccccc2C(F)(F)F)cc1 ZINC000539930976 938978607 /nfs/dbraw/zinc/97/86/07/938978607.db2.gz HTQHZNRYXQANOR-HXUWFJFHSA-N 0 3 406.448 4.210 20 0 HIADHN COC(=O)c1cccc(NC2CCN(Cc3c(C)nn(-c4ccccc4)c3C)CC2)c1 ZINC000563572127 945220231 /nfs/dbraw/zinc/22/02/31/945220231.db2.gz UBWSFHOPSIYDDM-UHFFFAOYSA-N 0 3 418.541 4.352 20 0 HIADHN C[C@@H]1CN(c2ccc(CN[C@@H]3CCCc4ccc(Br)cc43)cn2)CCO1 ZINC000539969696 938982555 /nfs/dbraw/zinc/98/25/55/938982555.db2.gz RRASELOAKHKKQC-FOIQADDNSA-N 0 3 416.363 4.236 20 0 HIADHN Cc1cc(C)n(-c2ccccc2CNCc2c(Cl)cccc2N2CCN(C)CC2)n1 ZINC000539978941 939029059 /nfs/dbraw/zinc/02/90/59/939029059.db2.gz HHARBFMRJFKQOJ-UHFFFAOYSA-N 0 3 423.992 4.184 20 0 HIADHN CO[C@H](c1ccc(F)cc1)[C@H](C)NC(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000540015419 939040536 /nfs/dbraw/zinc/04/05/36/939040536.db2.gz DZFTXZJVWZGHEN-QSFXBCCZSA-N 0 3 405.539 4.100 20 0 HIADHN Cc1ncccc1C(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1 ZINC000540032531 939045056 /nfs/dbraw/zinc/04/50/56/939045056.db2.gz CZFCUTMBEZUMJZ-UHFFFAOYSA-N 0 3 400.526 4.007 20 0 HIADHN COc1ccc(COCCNCc2c(C)nn(-c3ccc(F)cc3F)c2C)cc1 ZINC000540065672 939056756 /nfs/dbraw/zinc/05/67/56/939056756.db2.gz BQBBNGCMCZLCOB-UHFFFAOYSA-N 0 3 401.457 4.082 20 0 HIADHN C[C@H](NC[C@@H](c1ccc(Cl)cc1)N1CCOCC1)c1nc2c(s1)CCCC2 ZINC000540085232 939064581 /nfs/dbraw/zinc/06/45/81/939064581.db2.gz NKXFFENQGPXALI-KXBFYZLASA-N 0 3 405.995 4.399 20 0 HIADHN C[C@@H](NC[C@@H](c1ccc(Cl)cc1)N1CCOCC1)c1nc2c(s1)CCCC2 ZINC000540085226 939064647 /nfs/dbraw/zinc/06/46/47/939064647.db2.gz NKXFFENQGPXALI-BEFAXECRSA-N 0 3 405.995 4.399 20 0 HIADHN C[C@H](NC[C@H](C)S(C)(=O)=O)c1ccc(-c2ccc(Br)cc2)s1 ZINC000540141193 939088442 /nfs/dbraw/zinc/08/84/42/939088442.db2.gz YWOKKFMHCSWEBR-RYUDHWBXSA-N 0 3 402.379 4.261 20 0 HIADHN CCOc1cc(Cl)ccc1CN[C@@H](C)CC(=O)Nc1ccc(OC)cc1OC ZINC000540142825 939089426 /nfs/dbraw/zinc/08/94/26/939089426.db2.gz HNWHVEZHRFHYKA-AWEZNQCLSA-N 0 3 406.910 4.263 20 0 HIADHN CC(C)Oc1ccc([C@@H](C)N[C@@H](C)c2cccc(N3CCCS3(=O)=O)c2)cc1 ZINC000540144011 939090205 /nfs/dbraw/zinc/09/02/05/939090205.db2.gz LHSCSKSNVWDMFS-MSOLQXFVSA-N 0 3 402.560 4.426 20 0 HIADHN C[C@@H](COc1ccc2cc(Br)ccc2c1)N[C@@H](CO)CC(F)(F)F ZINC000540154826 939094493 /nfs/dbraw/zinc/09/44/93/939094493.db2.gz ZJLKEDWLJXHISE-XHDPSFHLSA-N 0 3 406.242 4.273 20 0 HIADHN Cc1c([C@H](C)N[C@H]2CCOC3(CCC3)C2)nnn1-c1cccc(Br)c1 ZINC000540158529 939094884 /nfs/dbraw/zinc/09/48/84/939094884.db2.gz ZDJYVGXALMKEMU-BBRMVZONSA-N 0 3 405.340 4.091 20 0 HIADHN CS(=O)(=O)Nc1cccc(CN[C@H](Cc2cccc(F)c2)c2cccc(F)c2)c1 ZINC000540166643 939098656 /nfs/dbraw/zinc/09/86/56/939098656.db2.gz LZXCBHZWYFYBBT-JOCHJYFZSA-N 0 3 416.493 4.410 20 0 HIADHN C[C@H]1C[C@H](NC[C@@H](O)COc2ccccc2Br)c2ccsc2S1 ZINC000540165925 939098693 /nfs/dbraw/zinc/09/86/93/939098693.db2.gz YYGCKKZRPLKHKW-ZOWXZIJZSA-N 0 3 414.390 4.466 20 0 HIADHN O=C(NCCN[C@H]1CCCOc2ccc(Br)cc21)c1ccccc1Cl ZINC000540174411 939104333 /nfs/dbraw/zinc/10/43/33/939104333.db2.gz KVZKDQHVQVKPFP-KRWDZBQOSA-N 0 3 423.738 4.336 20 0 HIADHN Cc1ccc(-c2nc3c(s2)[C@H](N[C@@H]2CCN(CC(F)(F)F)C2=O)CCC3)cc1 ZINC000540174624 939104622 /nfs/dbraw/zinc/10/46/22/939104622.db2.gz MQECGLQQRNASEG-GDBMZVCRSA-N 0 3 409.477 4.249 20 0 HIADHN C[C@H](NCCNC(=O)c1cccc(Br)c1)c1ccccc1OC(F)F ZINC000540181537 939108437 /nfs/dbraw/zinc/10/84/37/939108437.db2.gz LZTFEXPWCYQWNB-LBPRGKRZSA-N 0 3 413.262 4.131 20 0 HIADHN C[C@@H]1CN(C(=O)c2ccc(CN[C@@H]3c4cccc(F)c4CC[C@H]3C)cc2)C[C@@H](C)O1 ZINC000540190279 939114410 /nfs/dbraw/zinc/11/44/10/939114410.db2.gz FQSCUZUEVOHNGC-RTPKDJLFSA-N 0 3 410.533 4.488 20 0 HIADHN CC[C@@H](N[C@H](C)c1ccc(OCCOC)c(OC)c1)c1ccc2c(c1)OCCO2 ZINC000540192015 939117494 /nfs/dbraw/zinc/11/74/94/939117494.db2.gz XDKOWMBYAFKSSN-VQIMIIECSA-N 0 3 401.503 4.294 20 0 HIADHN C[C@H](NCc1ccc(S(=O)(=O)N2CCCCC2)cc1)c1cccc(OC(F)F)c1 ZINC000540192347 939117599 /nfs/dbraw/zinc/11/75/99/939117599.db2.gz HQTQDYNZXAWLFI-INIZCTEOSA-N 0 3 424.513 4.313 20 0 HIADHN O=C(c1cnc(Oc2ccccc2)cn1)N1CCCN(CCCc2ccccc2)CC1 ZINC000540206153 939126898 /nfs/dbraw/zinc/12/68/98/939126898.db2.gz MMLGJGQTDISSHD-UHFFFAOYSA-N 0 3 416.525 4.050 20 0 HIADHN CCN1CCCN(C(=O)Nc2ncc(Cc3ccc(C(F)(F)F)cc3)s2)CC1 ZINC000540282709 939182475 /nfs/dbraw/zinc/18/24/75/939182475.db2.gz BTOBQRIRXBNVME-UHFFFAOYSA-N 0 3 412.481 4.312 20 0 HIADHN O=C(c1ccc(CN[C@H](c2cccc(C(F)(F)F)c2)C2CC2)cc1)N1CCOCC1 ZINC000540301629 939186935 /nfs/dbraw/zinc/18/69/35/939186935.db2.gz MMUYGAWIDNMGBQ-NRFANRHFSA-N 0 3 418.459 4.419 20 0 HIADHN CC(C)[C@H](NCc1cccc(NC(=O)[C@H]2CCCO2)c1)c1ccc2[nH]c(=O)oc2c1 ZINC000540302900 939187710 /nfs/dbraw/zinc/18/77/10/939187710.db2.gz VPOYEOTYWNHRMF-CTNGQTDRSA-N 0 3 409.486 4.138 20 0 HIADHN O=C(N[C@H](c1ccc(Cl)c(C(F)(F)F)c1)C1CC1)N1CC[C@H](N2CC=CC2)C1 ZINC000540309097 939189318 /nfs/dbraw/zinc/18/93/18/939189318.db2.gz QSVOAUQSYOVZFB-YJBOKZPZSA-N 0 3 413.871 4.466 20 0 HIADHN CC[C@H](N[C@@H](C)C(=O)N[C@@H](C)c1cc(OC)ccc1OC)c1ccc(OC)cc1 ZINC000540343368 939200746 /nfs/dbraw/zinc/20/07/46/939200746.db2.gz SGJGVPQBIPGDCP-QYWGDWMGSA-N 0 3 400.519 4.019 20 0 HIADHN C[C@@H](N[C@H](C)c1ccccc1-n1cccn1)C(=O)Nc1ccc(Br)cc1 ZINC000540361959 939210159 /nfs/dbraw/zinc/21/01/59/939210159.db2.gz CGDKWAGZLJRPFH-HUUCEWRRSA-N 0 3 413.319 4.313 20 0 HIADHN CCC(CC)[C@H](NCC(=O)N1CCc2cc(OC)c(OC)cc2C1)c1cccs1 ZINC000540377206 939217525 /nfs/dbraw/zinc/21/75/25/939217525.db2.gz WODCRQPXJWZZAX-QHCPKHFHSA-N 0 3 416.587 4.417 20 0 HIADHN Cc1cc2ncn(C[C@@H](O)CN[C@H](CC(F)(F)F)c3ccc(F)cc3)c2cc1C ZINC000540377778 939218390 /nfs/dbraw/zinc/21/83/90/939218390.db2.gz WBVOTNDQWWAFOU-PKOBYXMFSA-N 0 3 409.427 4.436 20 0 HIADHN Cc1cccc(Cc2cnc(NC(=O)CN[C@@H](c3ccccc3)[C@H]3CCOC3)s2)c1 ZINC000540389263 939225660 /nfs/dbraw/zinc/22/56/60/939225660.db2.gz FZLDJZZWPUBGPW-REWPJTCUSA-N 0 3 421.566 4.348 20 0 HIADHN C[C@H](NCC(=O)Nc1ccc2c(c1)OC1(CCCC1)O2)c1cccc(-n2cccn2)c1 ZINC000540389596 939227021 /nfs/dbraw/zinc/22/70/21/939227021.db2.gz PPEMTTZEMMPAQV-KRWDZBQOSA-N 0 3 418.497 4.203 20 0 HIADHN Cc1ccc(NC(=O)CN[C@@H](c2ccccc2)[C@@H]2CCOC2)c(Br)c1 ZINC000540390350 939228821 /nfs/dbraw/zinc/22/88/21/939228821.db2.gz OMCAUUMOVBPAQW-UZLBHIALSA-N 0 3 403.320 4.063 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)N[C@@H]1CCO[C@H]1c1ccc(Cl)cc1 ZINC000540391001 939230203 /nfs/dbraw/zinc/23/02/03/939230203.db2.gz POZFUQCHZUCJII-RTWAWAEBSA-N 0 3 419.928 4.083 20 0 HIADHN O=C(CN[C@@H](c1ccc(F)cc1)C1CCCC1)NC[C@H]1CCN(c2ccccc2)C1 ZINC000540408310 939238089 /nfs/dbraw/zinc/23/80/89/939238089.db2.gz GMLLKCRDAUMBQW-KBMIEXCESA-N 0 3 409.549 4.289 20 0 HIADHN CC[C@H]1Oc2cc([C@H](C)NCc3ccc(-n4nc(C)cc4C)cc3)ccc2NC1=O ZINC000540457920 939259671 /nfs/dbraw/zinc/25/96/71/939259671.db2.gz KCEWTVBKDJYQKP-HTAPYJJXSA-N 0 3 404.514 4.449 20 0 HIADHN O=C(N[C@@H]1CCO[C@@H]1c1ccc(Cl)cc1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000540462196 939262308 /nfs/dbraw/zinc/26/23/08/939262308.db2.gz OMTSMEUWXSAPDZ-VLCRHTCISA-N 0 3 416.924 4.338 20 0 HIADHN CC[C@H](N[C@@H](C)c1ccc(OC(F)(F)F)cc1)c1cccc(S(N)(=O)=O)c1 ZINC000540464238 939262788 /nfs/dbraw/zinc/26/27/88/939262788.db2.gz ONVGBVIXNJHEEK-SJCJKPOMSA-N 0 3 402.438 4.035 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)N[C@@H](C)C(=O)NCCc2c[nH]c3ccccc23)cc1 ZINC000540468453 939264580 /nfs/dbraw/zinc/26/45/80/939264580.db2.gz PCBCTSXERPPGAT-ROUUACIJSA-N 0 3 415.541 4.060 20 0 HIADHN C[C@@H]1C[C@@H]1[C@H](NCC(=O)Nc1nc(CN2CCCC2)cs1)c1ccc(Cl)cc1 ZINC000540519135 939285366 /nfs/dbraw/zinc/28/53/66/939285366.db2.gz BDWUPODCHQNRFI-HEFCMCLBSA-N 0 3 418.994 4.318 20 0 HIADHN CC[C@H](NCc1cccc(NS(C)(=O)=O)c1)c1cc(F)cc(Br)c1 ZINC000540594526 939314034 /nfs/dbraw/zinc/31/40/34/939314034.db2.gz LCACHCHDBYVPFJ-KRWDZBQOSA-N 0 3 415.328 4.201 20 0 HIADHN COc1cc(CNCc2ccccc2-n2ccc(C)n2)ccc1OCc1ccncc1 ZINC000540620475 939322085 /nfs/dbraw/zinc/32/20/85/939322085.db2.gz YOTIHNFKLMBKBE-UHFFFAOYSA-N 0 3 414.509 4.453 20 0 HIADHN Cc1cc(C(=O)N(CCN(C)C)Cc2ccco2)nn1-c1ccc(Cl)c(Cl)c1 ZINC000540759267 939362633 /nfs/dbraw/zinc/36/26/33/939362633.db2.gz SFHZHZKZUVITRE-UHFFFAOYSA-N 0 3 421.328 4.285 20 0 HIADHN COc1ccc(OC)c(NC(=O)C[C@@H](C)N[C@@H]2CCCOc3cc(F)ccc32)c1 ZINC000540780127 939369973 /nfs/dbraw/zinc/36/99/73/939369973.db2.gz WHUAUHMYIHQFFD-RDTXWAMCSA-N 0 3 402.466 4.064 20 0 HIADHN CC(C)Oc1ccc(-c2nn(-c3ccccc3)cc2CN[C@@H]2C=C[C@H](CO)C2)cc1 ZINC000540807395 939379194 /nfs/dbraw/zinc/37/91/94/939379194.db2.gz NQHCWYPPBPNVHL-SIKLNZKXSA-N 0 3 403.526 4.353 20 0 HIADHN C[C@@H]1CN(Cc2ccccn2)CC[C@@H]1Nc1cnn(-c2ncc(Cl)cc2Cl)c1 ZINC000540825363 939385585 /nfs/dbraw/zinc/38/55/85/939385585.db2.gz XPLDUAGTPLNZNY-KUHUBIRLSA-N 0 3 417.344 4.292 20 0 HIADHN Cc1cc(NC(=O)N(CCN(C)C)Cc2ccco2)nn1-c1cccc(Cl)c1 ZINC000540835001 939388845 /nfs/dbraw/zinc/38/88/45/939388845.db2.gz FYJCILUIKXGTFB-UHFFFAOYSA-N 0 3 401.898 4.023 20 0 HIADHN O=c1cc(CN[C@@H](CC2CCC2)c2ccccc2)nc2ccc(Br)cn12 ZINC000540890081 939411212 /nfs/dbraw/zinc/41/12/12/939411212.db2.gz MDUGVAMJYHLPPU-IBGZPJMESA-N 0 3 412.331 4.478 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc(CN[C@@H](c2ccc(F)c(F)c2)C(C)C)cc1 ZINC000540990331 939426366 /nfs/dbraw/zinc/42/63/66/939426366.db2.gz MVPKBBYYZAMLLO-OAQYLSRUSA-N 0 3 410.530 4.482 20 0 HIADHN CC(C)[C@@H](NC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2)c1ccc(Cl)cc1F ZINC000540990894 939426819 /nfs/dbraw/zinc/42/68/19/939426819.db2.gz XOVYYWQHBVEKPU-OPAMFIHVSA-N 0 3 420.912 4.090 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)NCC(=O)N(C)c2nc3ccccc3s2)cc1 ZINC000541022398 939432766 /nfs/dbraw/zinc/43/27/66/939432766.db2.gz CJQRSXGSKBQEFC-OAHLLOKOSA-N 0 3 405.527 4.104 20 0 HIADHN CCN(CC)C(=O)CCC1CCN(CC(=O)N(CC)[C@H](C)c2ccc(F)cc2)CC1 ZINC000541085199 939454170 /nfs/dbraw/zinc/45/41/70/939454170.db2.gz QTPRSZOVMSLONB-LJQANCHMSA-N 0 3 419.585 4.096 20 0 HIADHN CCN1CC[C@H](N[C@H](C)c2nc3ccccc3n2C)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000541175806 939484336 /nfs/dbraw/zinc/48/43/36/939484336.db2.gz FHTCEYOJCJOESN-MPKWNAGQSA-N 0 3 402.464 4.477 20 0 HIADHN CC(=O)Nc1ccc(CN[C@@H]2CC(=O)N(C(C)C)[C@H]2c2ccc(Cl)c(F)c2)cc1 ZINC000541203866 939485552 /nfs/dbraw/zinc/48/55/52/939485552.db2.gz JMDJAIXZVGFNOZ-IRLDBZIGSA-N 0 3 417.912 4.278 20 0 HIADHN CC[C@@H](N[C@H](CC)c1cccc(S(N)(=O)=O)c1)c1ccc(Br)cc1 ZINC000541204625 939485569 /nfs/dbraw/zinc/48/55/69/939485569.db2.gz AKVGWDZWXQFJPR-QZTJIDSGSA-N 0 3 411.365 4.289 20 0 HIADHN CCOC(=O)C1CCN(C(=O)C[C@@H](C)NCc2ccccc2Oc2ccccc2)CC1 ZINC000541221695 939486346 /nfs/dbraw/zinc/48/63/46/939486346.db2.gz MDHHLOXKDRHGOO-LJQANCHMSA-N 0 3 424.541 4.149 20 0 HIADHN CC[C@@H](N[C@@H]1CCCN(Cc2nccn2C)C1=O)c1ccc(Oc2ccccc2)cc1 ZINC000541228899 939486590 /nfs/dbraw/zinc/48/65/90/939486590.db2.gz JFWAIVAANWJUKJ-DHIUTWEWSA-N 0 3 418.541 4.444 20 0 HIADHN CC(C)(C)N1CC[C@@H](NCc2cc(C(N)=O)cs2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000541247678 939487458 /nfs/dbraw/zinc/48/74/58/939487458.db2.gz NRYNCHCMLXGPJJ-MSOLQXFVSA-N 0 3 409.958 4.343 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3ccc(-c4cccs4)o3)CC2)C[C@@H](C)O1 ZINC000541252996 939487695 /nfs/dbraw/zinc/48/76/95/939487695.db2.gz NEKQFCWJVLIBTP-IAGOWNOFSA-N 0 3 402.560 4.360 20 0 HIADHN O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)N[C@H]1CCCc2cn[nH]c21 ZINC000541312843 939490521 /nfs/dbraw/zinc/49/05/21/939490521.db2.gz XQMUUZQRFPEPSP-SFHVURJKSA-N 0 3 422.360 4.058 20 0 HIADHN COCCOc1ccc(C(F)(F)F)cc1NC(=O)[C@H](C)N(C)C[C@H]1CC=CCC1 ZINC000541320356 939490802 /nfs/dbraw/zinc/49/08/02/939490802.db2.gz VFUAGOHLPKULQJ-HOTGVXAUSA-N 0 3 414.468 4.346 20 0 HIADHN CCOc1cc(CN[C@H](C)C[S@@](C)=O)ccc1OCc1c(F)cccc1Cl ZINC000541371280 939499678 /nfs/dbraw/zinc/49/96/78/939499678.db2.gz VERPWQUOICHRKT-LOKFHWFJSA-N 0 3 413.942 4.313 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)[C@@H]2CCn3c(cnc3C3CCCCC3)C2)C1 ZINC000541395234 939504659 /nfs/dbraw/zinc/50/46/59/939504659.db2.gz AJDMVHMIDWEMCD-PTUXOGIPSA-N 0 3 420.601 4.445 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)[C@H]1CCn2c(cnc2C2CCCCC2)C1 ZINC000541398326 939505317 /nfs/dbraw/zinc/50/53/17/939505317.db2.gz IAWSRXFABSRCMJ-QFIPXVFZSA-N 0 3 420.601 4.058 20 0 HIADHN CN(C)[C@H](CNC(=O)c1ncoc1-c1cccc(C(F)(F)F)c1)c1ccccc1 ZINC000541406857 939507571 /nfs/dbraw/zinc/50/75/71/939507571.db2.gz YSPGRGRXVXWWDD-QGZVFWFLSA-N 0 3 403.404 4.393 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3CC[C@H](c4cccc(C)c4)C3)c(C)c2)CC1 ZINC000541429833 939514100 /nfs/dbraw/zinc/51/41/00/939514100.db2.gz CQBPUOPRSFAXOS-QFIPXVFZSA-N 0 3 406.574 4.467 20 0 HIADHN CCCc1c(NC(=O)N(CCN(C)C)C2CCCC2)cnn1-c1cccc(F)c1 ZINC000541503951 939538531 /nfs/dbraw/zinc/53/85/31/939538531.db2.gz GUWHLATXKQCLFW-UHFFFAOYSA-N 0 3 401.530 4.302 20 0 HIADHN Cc1ccc(NC(=O)c2oc3ccccc3c2CN(C)C)cc1-c1nnnn1C1CC1 ZINC000541517702 939542580 /nfs/dbraw/zinc/54/25/80/939542580.db2.gz BMTDYXLLPSGAJU-UHFFFAOYSA-N 0 3 416.485 4.044 20 0 HIADHN COc1cc(C[C@@H](CO)CN[C@H](c2cccnc2)c2ccc(F)c(C)c2)cc(OC)c1 ZINC000541544527 939549644 /nfs/dbraw/zinc/54/96/44/939549644.db2.gz YWWQRAJHUCGVBK-CLOONOSVSA-N 0 3 424.516 4.077 20 0 HIADHN CC(C)([C@@H](NC(=O)Cc1c[nH]c2ncccc12)c1ccc(F)c(F)c1)N1CCCC1 ZINC000541545728 939549914 /nfs/dbraw/zinc/54/99/14/939549914.db2.gz OVNFJIKWJKPDTR-NRFANRHFSA-N 0 3 412.484 4.116 20 0 HIADHN Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)N[C@@H]1CCCN(Cc2ccccn2)C1=O ZINC000541568404 939557235 /nfs/dbraw/zinc/55/72/35/939557235.db2.gz QEKMDUWEMCTVPH-FOIQADDNSA-N 0 3 424.545 4.494 20 0 HIADHN CCN(CCCN1CCCN(C(=O)Nc2cccc(Cl)c2)CC1)CC(F)(F)F ZINC000541586957 939561120 /nfs/dbraw/zinc/56/11/20/939561120.db2.gz GUASJFCFIGAIDZ-UHFFFAOYSA-N 0 3 420.907 4.154 20 0 HIADHN COC[C@@H](Cc1ccccc1)N[C@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O ZINC000541590490 939561720 /nfs/dbraw/zinc/56/17/20/939561720.db2.gz PJOCQZLHPZGRBK-RTWAWAEBSA-N 0 3 420.475 4.044 20 0 HIADHN COC[C@@H](NCC(=O)Nc1nc(-c2ccc(Cl)cc2Cl)cs1)C1CC1 ZINC000541620440 939573001 /nfs/dbraw/zinc/57/30/01/939573001.db2.gz OZXVUTXNTRLMRB-CQSZACIVSA-N 0 3 400.331 4.070 20 0 HIADHN CC[C@@H](NCC(=O)N(Cc1ccccc1)c1nc2c(s1)CCCC2)[C@@H]1CCCO1 ZINC000541637392 939579362 /nfs/dbraw/zinc/57/93/62/939579362.db2.gz POJOBKIKFGQCFU-QUCCMNQESA-N 0 3 413.587 4.102 20 0 HIADHN C[C@H](N[C@@H](CC(N)=O)C1CCCCC1)C(=O)Nc1ccc(Cl)cc1C(F)(F)F ZINC000541637372 939579446 /nfs/dbraw/zinc/57/94/46/939579446.db2.gz WULAIIICUOXERM-ZBEGNZNMSA-N 0 3 419.875 4.100 20 0 HIADHN C[C@@H](NCC(=O)Nc1ccc2c(c1)OC1(CCCCC1)O2)[C@@H]1COc2ccccc21 ZINC000541701356 939608556 /nfs/dbraw/zinc/60/85/56/939608556.db2.gz QVMPNKHVUWFEMC-APWZRJJASA-N 0 3 408.498 4.211 20 0 HIADHN CC(C)Oc1cccc(CNC(=O)CN(C)[C@H]2CCO[C@H](c3ccc(F)cc3)C2)c1 ZINC000541700109 939608753 /nfs/dbraw/zinc/60/87/53/939608753.db2.gz TWQMMAROFQNEOM-GMAHTHKFSA-N 0 3 414.521 4.081 20 0 HIADHN C[C@H](NCC(=O)N1Cc2ccccc2[C@H](c2ccccc2)C1)[C@@H]1COc2ccccc21 ZINC000541704134 939609921 /nfs/dbraw/zinc/60/99/21/939609921.db2.gz ZJTHJQKBSIHTKM-LQGLAIQGSA-N 0 3 412.533 4.315 20 0 HIADHN C[C@@H](C(=O)Nc1ccc2c(c1)OC1(CCCCC1)O2)N1CCC2(CCOCC2)[C@@H]1C ZINC000541718205 939613132 /nfs/dbraw/zinc/61/31/32/939613132.db2.gz NISHPKMGQFSELJ-ROUUACIJSA-N 0 3 414.546 4.336 20 0 HIADHN CN(CCCN1CCN(C)CC1)C(=O)c1cc(Cl)ccc1SC1CCCC1 ZINC000541726903 939615117 /nfs/dbraw/zinc/61/51/17/939615117.db2.gz UQEDPEDJSXCCNT-UHFFFAOYSA-N 0 3 410.027 4.084 20 0 HIADHN CCCCSc1ccc(Cl)cc1C(=O)NC[C@H](C)CN1CCN(CC)CC1 ZINC000541730930 939615885 /nfs/dbraw/zinc/61/58/85/939615885.db2.gz HSJSCYNDWCOJFW-KRWDZBQOSA-N 0 3 412.043 4.236 20 0 HIADHN C[C@H](CS(=O)(=O)c1ccccc1)N[C@@H]1CCN(c2ccc(Cl)c(Cl)c2)C1 ZINC000541740563 939618481 /nfs/dbraw/zinc/61/84/81/939618481.db2.gz KCTZLNFHFFEQNK-HUUCEWRRSA-N 0 3 413.370 4.024 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@H]2CCCC[C@@H]2NCc2ccc(Cn3ccnc3)cc2)cc1 ZINC000541744105 939618966 /nfs/dbraw/zinc/61/89/66/939618966.db2.gz BXEBEJKYGYGINM-ZEQRLZLVSA-N 0 3 423.582 4.115 20 0 HIADHN O=c1ccccn1Cc1ccc(CNCc2ccc(OCC(F)(F)F)c(F)c2)cc1 ZINC000541773141 939626947 /nfs/dbraw/zinc/62/69/47/939626947.db2.gz SDBUQHZYCPVOQB-UHFFFAOYSA-N 0 3 420.406 4.267 20 0 HIADHN CCC(CC)[C@@H]1C[C@@H](NC(=O)NC[C@H](c2ccc(OC)cc2)N2CCCC2)CCO1 ZINC000541851034 939647140 /nfs/dbraw/zinc/64/71/40/939647140.db2.gz YQSAWIJWEPTQNB-WWNPGLIZSA-N 0 3 417.594 4.115 20 0 HIADHN Cc1nn(-c2ccccc2)cc1NC(=O)NC[C@H](c1ccc(C)cc1)N1CCCC1 ZINC000541907644 939651447 /nfs/dbraw/zinc/65/14/47/939651447.db2.gz YRLCXYCHUKJZDX-HSZRJFAPSA-N 0 3 403.530 4.448 20 0 HIADHN CC[C@@H]1C[C@H](CC(=O)Nc2c(C)cnn2[C@@H]2CCN(Cc3ccccc3)C2)CCO1 ZINC000541964665 939664278 /nfs/dbraw/zinc/66/42/78/939664278.db2.gz OGWPMDQQVITAIK-YPAWHYETSA-N 0 3 410.562 4.172 20 0 HIADHN CCOc1cc(Br)c(NC(=O)N(CCN(C)C)C(C)C)cc1OCC ZINC000541972409 939666744 /nfs/dbraw/zinc/66/67/44/939666744.db2.gz CXLBVJRWXKLLRM-UHFFFAOYSA-N 0 3 416.360 4.050 20 0 HIADHN CCN1CC[C@@H](NCc2c[nH]c(-c3ccccc3)n2)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000541992148 939671903 /nfs/dbraw/zinc/67/19/03/939671903.db2.gz PKEQXYFLNKBMPA-TZIWHRDSSA-N 0 3 400.448 4.419 20 0 HIADHN CCN(CC)C(=O)CCC1CCN([C@H](C)C(=O)N(Cc2ccccc2)C(C)C)CC1 ZINC000542042591 939696924 /nfs/dbraw/zinc/69/69/24/939696924.db2.gz WKEJJRZFLCHRRU-OAQYLSRUSA-N 0 3 415.622 4.173 20 0 HIADHN O[C@@H](COc1ccc2ccccc2c1)CN1CCC[C@@H](n2ccc(C(F)(F)F)n2)C1 ZINC000542055073 939700677 /nfs/dbraw/zinc/70/06/77/939700677.db2.gz LTJZQRBERZJRBU-RTBURBONSA-N 0 3 419.447 4.132 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)N1CCC[C@H](n2ccc(C(F)(F)F)n2)C1 ZINC000542093949 939709279 /nfs/dbraw/zinc/70/92/79/939709279.db2.gz MYWLNNIJTCRNED-AWEZNQCLSA-N 0 3 420.435 4.187 20 0 HIADHN COC(=O)[C@@H](NC1CCN([C@@H](C)c2ccncc2)CC1)c1ccccc1C(F)(F)F ZINC000542100750 939713250 /nfs/dbraw/zinc/71/32/50/939713250.db2.gz KVTIZJTVRZZDTD-YWZLYKJASA-N 0 3 421.463 4.130 20 0 HIADHN O=c1c2ccccc2ncn1CCN[C@H](Cc1ccc(Cl)cc1)c1ccccn1 ZINC000542122874 939720864 /nfs/dbraw/zinc/72/08/64/939720864.db2.gz HVDAVPGCUYBWPI-JOCHJYFZSA-N 0 3 404.901 4.019 20 0 HIADHN CNS(=O)(=O)c1ccc([C@@H](C)N[C@@H]2CCCc3c(Br)cccc32)cc1 ZINC000542152790 939733511 /nfs/dbraw/zinc/73/35/11/939733511.db2.gz RDRJAUVOLQQQIT-BFUOFWGJSA-N 0 3 423.376 4.085 20 0 HIADHN COc1cc(Br)ccc1CCCNCc1nccn1Cc1ccccc1 ZINC000542298743 939789883 /nfs/dbraw/zinc/78/98/83/939789883.db2.gz SQVZQPWOVRCODR-UHFFFAOYSA-N 0 3 414.347 4.425 20 0 HIADHN COc1cc(CN[C@@H](C)C[S@@](C)=O)ccc1OCc1cccc(C(F)(F)F)c1 ZINC000542298910 939789931 /nfs/dbraw/zinc/78/99/31/939789931.db2.gz RHMXFCJHUOBPMR-HJFSHJIFSA-N 0 3 415.477 4.150 20 0 HIADHN COc1c(Br)cc(Br)cc1CN[C@]1(C)CCO[C@H]1C1CC1 ZINC000542312888 939796251 /nfs/dbraw/zinc/79/62/51/939796251.db2.gz JNSKPHBBCYSRMA-JKSUJKDBSA-N 0 3 419.157 4.267 20 0 HIADHN O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)[C@@H]1CCn2c(cnc2C2CCCCC2)C1 ZINC000542328824 939801432 /nfs/dbraw/zinc/80/14/32/939801432.db2.gz MJIGJKPXGFDTGT-DHIUTWEWSA-N 0 3 420.601 4.274 20 0 HIADHN COc1cccc([C@@H](CNC(=O)Nc2ccccc2-n2nccc2C)N2CCCC2)c1 ZINC000542424761 939819720 /nfs/dbraw/zinc/81/97/20/939819720.db2.gz DTEUXHSHWXYJSF-HSZRJFAPSA-N 0 3 419.529 4.148 20 0 HIADHN c1c(CN2CCOCC3(CCOCC3)C2)c(-c2ccccc2)nn1Cc1ccccc1 ZINC000542463780 939827378 /nfs/dbraw/zinc/82/73/78/939827378.db2.gz OQLDYDIPMFPBBM-UHFFFAOYSA-N 0 3 417.553 4.227 20 0 HIADHN Brc1cccc(-c2ccc(CN3CCOCC4(CCOCC4)C3)o2)c1 ZINC000542463880 939827495 /nfs/dbraw/zinc/82/74/95/939827495.db2.gz CZSMRXXIFRDRKQ-UHFFFAOYSA-N 0 3 406.320 4.338 20 0 HIADHN COc1ccc([C@@H](CN[C@@H](c2ccc(F)cc2)c2cccnc2)N(C)C)cc1OC ZINC000542475500 939829297 /nfs/dbraw/zinc/82/92/97/939829297.db2.gz XNNSNEWQIIDWGG-QPPBQGQZSA-N 0 3 409.505 4.220 20 0 HIADHN C[C@H](CN[C@@H](c1ccc(F)cc1)c1cccnc1)N1CCN(c2ccccc2)CC1 ZINC000542480710 939830904 /nfs/dbraw/zinc/83/09/04/939830904.db2.gz JWJMFIAFEBIPIE-NLFFAJNJSA-N 0 3 404.533 4.110 20 0 HIADHN O=C1[C@H](N[C@@H]2CCCc3ccc(Br)cc32)CCCN1Cc1ccccn1 ZINC000542499412 939833074 /nfs/dbraw/zinc/83/30/74/939833074.db2.gz PUFARURUSFSGDH-WOJBJXKFSA-N 0 3 414.347 4.002 20 0 HIADHN C[C@@H](N[C@@H]1CCCN(Cc2ccccn2)C1=O)c1ccc(SCC(F)F)cc1 ZINC000542501247 939833524 /nfs/dbraw/zinc/83/35/24/939833524.db2.gz RPZZKDDFCAWDCA-DNVCBOLYSA-N 0 3 405.514 4.281 20 0 HIADHN CC[C@@H](C)[C@H](C)NCc1nc2c(Br)cc(Br)cc2c(=O)[nH]1 ZINC000542543867 939841402 /nfs/dbraw/zinc/84/14/02/939841402.db2.gz HWYQDNTURYAKHZ-BDAKNGLRSA-N 0 3 417.145 4.385 20 0 HIADHN CC(C)[C@H](Cc1ccc(F)cc1)NCc1coc(-c2ccc(S(C)(=O)=O)cc2)n1 ZINC000542550098 939842322 /nfs/dbraw/zinc/84/23/22/939842322.db2.gz OZCINIIURHXAOB-NRFANRHFSA-N 0 3 416.518 4.241 20 0 HIADHN CC(C)(NCC(=O)NC[C@H](c1ccccc1Cl)N1CCCC1)c1cccs1 ZINC000542567875 939844767 /nfs/dbraw/zinc/84/47/67/939844767.db2.gz BQDQETOJUUVUJR-GOSISDBHSA-N 0 3 405.995 4.180 20 0 HIADHN Cc1c([C@@H](C)NC[C@H](O)COc2ccc(C(C)(C)c3ccccc3)cc2)cnn1C ZINC000542591716 939847106 /nfs/dbraw/zinc/84/71/06/939847106.db2.gz YLWJFLZTJVKPHT-GCJKJVERSA-N 0 3 407.558 4.145 20 0 HIADHN CN(CC(=O)N1CCC(Cc2ccccc2)CC1)[C@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000542627716 939850063 /nfs/dbraw/zinc/85/00/63/939850063.db2.gz LQVWYPAZGHXDOV-LOSJGSFVSA-N 0 3 424.560 4.459 20 0 HIADHN C[C@@H](NCC(=O)Nc1cc(C(C)(C)C)nn1-c1ccccc1)[C@@H]1COc2ccccc21 ZINC000542626223 939850177 /nfs/dbraw/zinc/85/01/77/939850177.db2.gz GXHJZUFGAIGAAT-XLIONFOSSA-N 0 3 418.541 4.263 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@H]2CCCC[C@H]2NCc2cccc(-n3ccnc3)c2)cc1 ZINC000542660119 939852169 /nfs/dbraw/zinc/85/21/69/939852169.db2.gz CZUHIAQXSWHVLY-PKTZIBPZSA-N 0 3 409.555 4.055 20 0 HIADHN Clc1ccccc1N1CCN(CCCN[C@@H](c2ccccc2)c2cncnc2)CC1 ZINC000542667980 939852870 /nfs/dbraw/zinc/85/28/70/939852870.db2.gz BTJMRRBDESSGSS-DEOSSOPVSA-N 0 3 421.976 4.021 20 0 HIADHN CS[C@H]1CN(C(=O)c2csc(-c3ccc(Cl)s3)n2)C[C@H]1N1CCCC1 ZINC000542772627 939860185 /nfs/dbraw/zinc/86/01/85/939860185.db2.gz YCEASFWHYGHFDJ-OCCSQVGLSA-N 0 3 414.021 4.177 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1cn(-c2ccccc2)nc1C)c1cccc(OC)c1 ZINC000542836396 939861993 /nfs/dbraw/zinc/86/19/93/939861993.db2.gz GYOLZTMAQOGHOX-QHCPKHFHSA-N 0 3 421.545 4.394 20 0 HIADHN Cc1cc2c(cc1NC(=O)NC[C@H](c1cccs1)N1CCC(C)CC1)OCO2 ZINC000542837349 939862007 /nfs/dbraw/zinc/86/20/07/939862007.db2.gz IWRVLHPETPHGNP-QGZVFWFLSA-N 0 3 401.532 4.380 20 0 HIADHN COCC[C@@H](Cc1cccc(F)c1)N[C@@H](CCO)c1ccccc1Br ZINC000542852202 939863250 /nfs/dbraw/zinc/86/32/50/939863250.db2.gz VPFBFERTOQNVQU-PXNSSMCTSA-N 0 3 410.327 4.249 20 0 HIADHN COc1cccc(OC)c1OC[C@H](O)CN[C@H](c1ccc(Cl)cc1F)C(C)C ZINC000542919179 939877737 /nfs/dbraw/zinc/87/77/37/939877737.db2.gz KZMKIGJRXJUHRU-QRWLVFNGSA-N 0 3 411.901 4.223 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)Nc2ccc(OC[C@H]3CCCO3)cc2)CCN1Cc1ccccc1 ZINC000563744675 945278778 /nfs/dbraw/zinc/27/87/78/945278778.db2.gz OTCHQNJUCMHEFR-YSZBQJHXSA-N 0 3 409.530 4.029 20 0 HIADHN C[C@H](CCc1n[nH]c2ccccc21)NCc1nnc2c(Cl)cc(C(F)(F)F)cn12 ZINC000543015563 939895406 /nfs/dbraw/zinc/89/54/06/939895406.db2.gz KNFSBFOTIZUGCN-LLVKDONJSA-N 0 3 422.842 4.389 20 0 HIADHN CC(=O)NC1CCC(N(C)CC(=O)N[C@@H](c2ccc(C(C)C)cc2)C(C)C)CC1 ZINC000543171609 939984758 /nfs/dbraw/zinc/98/47/58/939984758.db2.gz DLFQPUGKYLKTDE-UBVWURDFSA-N 0 3 401.595 4.002 20 0 HIADHN O=C1CCCN1C[C@H](NCCc1cccc(F)c1F)c1cccc(C(F)(F)F)c1 ZINC000543182768 939988489 /nfs/dbraw/zinc/98/84/89/939988489.db2.gz XPHYLUMJIUMKST-SFHVURJKSA-N 0 3 412.402 4.479 20 0 HIADHN C[C@H](CN(C)C(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1)c1nccs1 ZINC000543187519 939990060 /nfs/dbraw/zinc/99/00/60/939990060.db2.gz XIDHLIYZCDBXAW-SJORKVTESA-N 0 3 406.621 4.423 20 0 HIADHN COc1ccc([C@H]2CCCN2C(=O)CN2CC[C@H](c3cccc(C)c3)C2)c(OC)c1 ZINC000543253370 940008809 /nfs/dbraw/zinc/00/88/09/940008809.db2.gz PGLIPMAORLTJLB-NZQKXSOJSA-N 0 3 408.542 4.165 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3CC[C@H](c4ccc(C)cc4)C3)c(C)c2)CC1 ZINC000543286479 940018559 /nfs/dbraw/zinc/01/85/59/940018559.db2.gz SPUFWAXAQDTLLP-QFIPXVFZSA-N 0 3 406.574 4.467 20 0 HIADHN Cc1cc(NC(=O)N(C)C[C@@H]2CC=CCC2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000543314546 940026381 /nfs/dbraw/zinc/02/63/81/940026381.db2.gz BQFCIERBTZCCFZ-IFMALSPDSA-N 0 3 407.562 4.459 20 0 HIADHN O=C(N[C@@H]1CCCN(Cc2cc(-n3ccnc3)cs2)C1)c1ccc2ccccc2c1 ZINC000543396667 940050976 /nfs/dbraw/zinc/05/09/76/940050976.db2.gz VPPRKAVRAYLJBL-OAQYLSRUSA-N 0 3 416.550 4.481 20 0 HIADHN CC(C)c1nccn1CCC(=O)N[C@H](c1ccc(F)c(F)c1)C(C)(C)N1CCCC1 ZINC000543402623 940052596 /nfs/dbraw/zinc/05/25/96/940052596.db2.gz DKGNQIBETLLFSM-OAQYLSRUSA-N 0 3 418.532 4.407 20 0 HIADHN COc1cc(OC)cc(N2CC[C@H](CN[C@H](c3ccc(F)cc3)c3cccnc3)C2)c1 ZINC000543404554 940053214 /nfs/dbraw/zinc/05/32/14/940053214.db2.gz IKRLJUSNRYDICA-IQGLISFBSA-N 0 3 421.516 4.443 20 0 HIADHN Cc1cc([C@@H](NC[C@@H](c2cccs2)N2CCOCC2)c2cccnc2)ccc1F ZINC000543404440 940053251 /nfs/dbraw/zinc/05/32/51/940053251.db2.gz KSOWCHPXESEADU-JTHBVZDNSA-N 0 3 411.546 4.343 20 0 HIADHN C[C@@H](C[S@](C)=O)NCc1cn(Cc2ccccc2)nc1-c1cc2ccccc2o1 ZINC000543410485 940056671 /nfs/dbraw/zinc/05/66/71/940056671.db2.gz SFRHGYRJSVUQOX-ADKRDUOOSA-N 0 3 407.539 4.201 20 0 HIADHN COc1cc(CN2CCC(OC[C@H]3CCOC3)CC2)ccc1OCc1cccs1 ZINC000543415323 940057783 /nfs/dbraw/zinc/05/77/83/940057783.db2.gz PRERHCKPFFJOLZ-IBGZPJMESA-N 0 3 417.571 4.353 20 0 HIADHN CC[C@@H](N[C@H]1CCCN(Cc2ccccn2)C1=O)c1cc(F)cc(Br)c1 ZINC000543426814 940060839 /nfs/dbraw/zinc/06/08/39/940060839.db2.gz KQQNEQIJWPPNFC-MOPGFXCFSA-N 0 3 420.326 4.215 20 0 HIADHN O=S1(=O)CCCC[C@@H]1CN[C@@H]1CCCc2nc(-c3ccc(Cl)cc3)sc21 ZINC000543428674 940061731 /nfs/dbraw/zinc/06/17/31/940061731.db2.gz DAIGMMMKLQQCHG-HZPDHXFCSA-N 0 3 410.992 4.398 20 0 HIADHN Cc1ccsc1[C@H](Cc1ccccc1)NCC(=O)Nc1ccc2c(c1)OCCO2 ZINC000543454084 940067716 /nfs/dbraw/zinc/06/77/16/940067716.db2.gz YRFMTQARWIUHFU-IBGZPJMESA-N 0 3 408.523 4.340 20 0 HIADHN Cc1c([C@H](C)NC[C@@H](O)COc2ccccc2Cl)cnn1-c1ccc(F)cc1 ZINC000543470255 940075048 /nfs/dbraw/zinc/07/50/48/940075048.db2.gz OXXLLZVKWDVXFT-KBXCAEBGSA-N 0 3 403.885 4.064 20 0 HIADHN CC(=O)c1cccc(OC[C@@H](O)CN[C@@H](C)c2sc(-c3ccccc3)nc2C)c1 ZINC000543520171 940094692 /nfs/dbraw/zinc/09/46/92/940094692.db2.gz UFSIGJJSLPQNLO-YWZLYKJASA-N 0 3 410.539 4.412 20 0 HIADHN C[C@H](NCC(=O)Nc1nc(-c2ccc(F)c(F)c2)cs1)[C@H]1COc2ccccc21 ZINC000543550518 940105496 /nfs/dbraw/zinc/10/54/96/940105496.db2.gz AFHSCOQQRZSYIL-SWLSCSKDSA-N 0 3 415.465 4.181 20 0 HIADHN CN(Cc1ccc(Cl)s1)C(=O)CN(C)[C@@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000543560969 940109299 /nfs/dbraw/zinc/10/92/99/940109299.db2.gz RNWOTVVIGTULQC-AEFFLSMTSA-N 0 3 410.942 4.351 20 0 HIADHN Cc1cc(NC(=O)N2CCCN(C)CC2)n(-c2cc(C(F)(F)F)ccc2Cl)n1 ZINC000543626234 940140350 /nfs/dbraw/zinc/14/03/50/940140350.db2.gz XYLKMMISHCTUAV-UHFFFAOYSA-N 0 3 415.847 4.022 20 0 HIADHN C[C@H]1CN(CCOC2CCN(Cc3ccccc3OC3CCCC3)CC2)C[C@H](C)O1 ZINC000563778242 945298885 /nfs/dbraw/zinc/29/88/85/945298885.db2.gz RTMVYMLUCBVPNM-SFTDATJTSA-N 0 3 416.606 4.098 20 0 HIADHN C[C@@H]1CCCCN1Cc1ccccc1CNCc1c(Cl)cccc1S(C)(=O)=O ZINC000543650093 940150010 /nfs/dbraw/zinc/15/00/10/940150010.db2.gz AXIGSSYVVCKUCR-QGZVFWFLSA-N 0 3 421.006 4.408 20 0 HIADHN C[C@@H]1CN(CCOC2CCN(Cc3ccccc3OC3CCCC3)CC2)C[C@@H](C)O1 ZINC000563778240 945299392 /nfs/dbraw/zinc/29/93/92/945299392.db2.gz RTMVYMLUCBVPNM-NHCUHLMSSA-N 0 3 416.606 4.098 20 0 HIADHN NC(=O)C1CCN(c2ncccc2CN[C@@H](c2ccccc2)C2CCCCC2)CC1 ZINC000543940953 940257261 /nfs/dbraw/zinc/25/72/61/940257261.db2.gz OOPUUTSDDNULQZ-QHCPKHFHSA-N 0 3 406.574 4.195 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(F)cc2)CC1)c1ccc(-c2cccs2)o1 ZINC000543994578 940288513 /nfs/dbraw/zinc/28/85/13/940288513.db2.gz UCDIRGBFHQVHPH-UHFFFAOYSA-N 0 3 414.502 4.420 20 0 HIADHN COC(=O)c1cccc(NC(=O)C[C@H](C)N[C@@H](CC(F)(F)F)c2ccccc2)c1 ZINC000543996569 940289470 /nfs/dbraw/zinc/28/94/70/940289470.db2.gz JMGICOLJDDSCPC-KSSFIOAISA-N 0 3 408.420 4.474 20 0 HIADHN COC(=O)[C@@H](NC(=O)c1cccc(CN2CCCC2)c1)c1ccc2ccccc2c1 ZINC000544026875 940303572 /nfs/dbraw/zinc/30/35/72/940303572.db2.gz GLDDHLKJWKGJHT-QHCPKHFHSA-N 0 3 402.494 4.080 20 0 HIADHN C[C@@H]1C[C@@H](c2ccccc2)CCN1C(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000544110078 940329185 /nfs/dbraw/zinc/32/91/85/940329185.db2.gz KBRSKJSVWXDVAR-IRLDBZIGSA-N 0 3 421.585 4.121 20 0 HIADHN COCC[C@@H](Cc1ccco1)NC(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1 ZINC000544127082 940332954 /nfs/dbraw/zinc/33/29/54/940332954.db2.gz FSHIEDQNIUXZNW-ICSRJNTNSA-N 0 3 419.591 4.061 20 0 HIADHN COCC[C@H](Cc1ccco1)NC(=O)NC[C@H](c1cccs1)N1CCC(C)CC1 ZINC000544127088 940332985 /nfs/dbraw/zinc/33/29/85/940332985.db2.gz FSHIEDQNIUXZNW-UYAOXDASSA-N 0 3 419.591 4.061 20 0 HIADHN FC(F)(F)Cn1ccnc1CNCCc1c[nH]c2ccc(Br)cc12 ZINC000544185001 940347312 /nfs/dbraw/zinc/34/73/12/940347312.db2.gz SGFUCANQSWASMS-UHFFFAOYSA-N 0 3 401.230 4.022 20 0 HIADHN Cc1cc(Br)cn2c(CNC3(c4cccc(F)c4)CCOCC3)cnc12 ZINC000544192860 940348978 /nfs/dbraw/zinc/34/89/78/940348978.db2.gz XSKKCFMCQUPPRM-UHFFFAOYSA-N 0 3 418.310 4.340 20 0 HIADHN O=C([C@@H]1CCn2c(cnc2C2CCCCC2)C1)N1CCN(CC2CCCCC2)CC1 ZINC000544197807 940351444 /nfs/dbraw/zinc/35/14/44/940351444.db2.gz NWSJZBCLHWGOBE-JOCHJYFZSA-N 0 3 412.622 4.218 20 0 HIADHN C[C@@H](CNC(=O)[C@@H]1CCn2c(cnc2C2CCCCC2)C1)N(C)Cc1ccccc1 ZINC000544224927 940360295 /nfs/dbraw/zinc/36/02/95/940360295.db2.gz NIAGNQBPKXVCMO-SIKLNZKXSA-N 0 3 408.590 4.130 20 0 HIADHN Cc1ccc(C(=O)N2CC[C@@H](N3CCN(C)CC3)[C@H](C)C2)c(Sc2ccccc2)c1 ZINC000544260171 940370771 /nfs/dbraw/zinc/37/07/71/940370771.db2.gz ZZEKOPNVKVEIPT-NFBKMPQASA-N 0 3 423.626 4.244 20 0 HIADHN Cc1ccc2nc(CNC3CCN(Cc4ccccc4Br)CC3)cn2c1 ZINC000563845057 945313483 /nfs/dbraw/zinc/31/34/83/945313483.db2.gz BUHDYJBRPQFFQN-UHFFFAOYSA-N 0 3 413.363 4.159 20 0 HIADHN COc1ccc(C(=O)C[C@H](C)C(=O)N[C@@H]2CCN(Cc3ccccc3)[C@@H](C)C2)cc1 ZINC000544378495 940406468 /nfs/dbraw/zinc/40/64/68/940406468.db2.gz ZRHKTHCZHORHGW-CNNODRBYSA-N 0 3 408.542 4.073 20 0 HIADHN Cc1cc([C@@H](C)NCC(=O)Nc2cccc(CN3CCSCC3)c2)c(C)s1 ZINC000544401006 940412844 /nfs/dbraw/zinc/41/28/44/940412844.db2.gz UERIUCNSAKGAIW-MRXNPFEDSA-N 0 3 403.617 4.203 20 0 HIADHN COc1cccc(NC(=O)CN[C@H](c2ccc(F)c(F)c2)C(C)(C)N2CCCC2)c1 ZINC000544408825 940415569 /nfs/dbraw/zinc/41/55/69/940415569.db2.gz VQAFXHKMCFJRIE-JOCHJYFZSA-N 0 3 417.500 4.117 20 0 HIADHN Cc1ccsc1[C@@H](Cc1ccccc1)NCC(=O)Nc1cccc(C(=O)N(C)C)c1 ZINC000544411662 940416318 /nfs/dbraw/zinc/41/63/18/940416318.db2.gz AZBATGBVCJPRNM-OAQYLSRUSA-N 0 3 421.566 4.270 20 0 HIADHN O=C(CN[C@H](Cc1ccccc1)c1cccs1)N1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000544415149 940417415 /nfs/dbraw/zinc/41/74/15/940417415.db2.gz HRMXFHMAOJDTQY-FGZHOGPDSA-N 0 3 424.541 4.361 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1C[C@H](C)C[C@@H]1c1cccnc1)c1cccc(OC)c1 ZINC000544437591 940430637 /nfs/dbraw/zinc/43/06/37/940430637.db2.gz KCFYLDLLWMZLTO-SXSPYAJSSA-N 0 3 410.562 4.266 20 0 HIADHN CC[C@H](NC[C@H](O)COc1ccc(Cl)cc1Br)c1c(C)noc1C ZINC000544458641 940439880 /nfs/dbraw/zinc/43/98/80/940439880.db2.gz QIHIWPCSCNTXHM-ZFWWWQNUSA-N 0 3 417.731 4.188 20 0 HIADHN COc1ccccc1C[C@H](NCc1nnnn1-c1ccc(C(F)(F)F)cc1)C(C)C ZINC000544458978 940439948 /nfs/dbraw/zinc/43/99/48/940439948.db2.gz JELIKTCGSXJKQA-SFHVURJKSA-N 0 3 419.451 4.047 20 0 HIADHN CCOc1ccc([C@@H]2CCCN2C(=O)CN[C@H](C)[C@@H]2Oc3ccccc3[C@@H]2C)cc1 ZINC000544517901 940469155 /nfs/dbraw/zinc/46/91/55/940469155.db2.gz IKRSHMLIEMVNGG-SNMCCPJMSA-N 0 3 408.542 4.292 20 0 HIADHN C[C@H]1N(CC(=O)N[C@@H](c2ccccc2)c2cccc(Cl)c2)CCC12CCOCC2 ZINC000544547194 940476602 /nfs/dbraw/zinc/47/66/02/940476602.db2.gz LUEPXXLKPCVKJR-JPYJTQIMSA-N 0 3 412.961 4.437 20 0 HIADHN CN(CCc1ccncc1)Cc1cc(Br)ccc1OCc1ccccn1 ZINC000544595841 940486834 /nfs/dbraw/zinc/48/68/34/940486834.db2.gz HAEYZPIAIGQVQW-UHFFFAOYSA-N 0 3 412.331 4.493 20 0 HIADHN CCCCN1CCCC[C@H]1CNC(=O)c1cn(CC)c2ccc(Cl)cc2c1=O ZINC000544596700 940487136 /nfs/dbraw/zinc/48/71/36/940487136.db2.gz SAGLFVRMXJXGSP-KRWDZBQOSA-N 0 3 403.954 4.059 20 0 HIADHN COc1cc(CN[C@@H]2CCO[C@H](c3ccc(F)cc3)C2)c(Br)cc1O ZINC000544618365 940491285 /nfs/dbraw/zinc/49/12/85/940491285.db2.gz NJUSHOWCXUNXLC-QAPCUYQASA-N 0 3 410.283 4.312 20 0 HIADHN CCn1c2ccccc2nc1CNCCc1cn2cc(Br)cc(C)c2n1 ZINC000544708204 940505309 /nfs/dbraw/zinc/50/53/09/940505309.db2.gz KCXWEFFIXZIPFW-UHFFFAOYSA-N 0 3 412.335 4.107 20 0 HIADHN Cc1ccc(C(C)(C)NC[C@@H](O)COc2ccc(Cl)cc2Br)cn1 ZINC000544762012 940511647 /nfs/dbraw/zinc/51/16/47/940511647.db2.gz RXVKNVMGUNVGLD-OAHLLOKOSA-N 0 3 413.743 4.071 20 0 HIADHN CCN(C(=O)c1ccnc(SCC(F)(F)F)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000544847868 940519040 /nfs/dbraw/zinc/51/90/40/940519040.db2.gz LWBGKVSDLXSCOG-GOSISDBHSA-N 0 3 423.504 4.473 20 0 HIADHN CCN(C(=O)c1cncc(-c2ccc(OC)cc2)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000544850482 940519086 /nfs/dbraw/zinc/51/90/86/940519086.db2.gz FCNFUDRUOQSHSY-DEOSSOPVSA-N 0 3 415.537 4.494 20 0 HIADHN CCN(C(=O)c1ccc(NC(C)=O)c(SC)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000544850838 940519144 /nfs/dbraw/zinc/51/91/44/940519144.db2.gz NWEUKFXCHAADJI-HXUWFJFHSA-N 0 3 411.571 4.104 20 0 HIADHN CCN(Cc1coc(-c2ccc(C(=O)OC)cc2)n1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000544897740 940522743 /nfs/dbraw/zinc/52/27/43/940522743.db2.gz PPPAPWUTEDOCTM-QHCPKHFHSA-N 0 3 419.525 4.225 20 0 HIADHN CCCOc1ccc(-c2noc([C@@H]3CCCN(Cc4cccnc4)C3)n2)cc1OC ZINC000544902223 940523384 /nfs/dbraw/zinc/52/33/84/940523384.db2.gz MEOZBMHPKRLPNU-LJQANCHMSA-N 0 3 408.502 4.309 20 0 HIADHN C[C@@H](CNC(=O)c1ccccc1)c1noc([C@H]2CCCN(Cc3cccc(F)c3)C2)n1 ZINC000545046312 940536614 /nfs/dbraw/zinc/53/66/14/940536614.db2.gz AFGKXNWWXOLDCY-PXNSSMCTSA-N 0 3 422.504 4.122 20 0 HIADHN CC(C)(CS(C)(=O)=O)NCc1ccc(-c2cccc(Br)c2)s1 ZINC000545165509 940553224 /nfs/dbraw/zinc/55/32/24/940553224.db2.gz IGZVGZHKLXCDCO-UHFFFAOYSA-N 0 3 402.379 4.090 20 0 HIADHN COc1ccc2[nH]c3c(c2c1)C[C@H](N[C@H](c1nc(-c2cccnc2)no1)C(C)C)CC3 ZINC000545191453 940555343 /nfs/dbraw/zinc/55/53/43/940555343.db2.gz LBOVQVJCTGISLJ-ZHRRBRCNSA-N 0 3 417.513 4.466 20 0 HIADHN COc1cc(C)c(Br)cc1NC(=O)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000545204677 940555778 /nfs/dbraw/zinc/55/57/78/940555778.db2.gz ZVJUVCMPEDHSNO-INIZCTEOSA-N 0 3 418.335 4.012 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N[C@H]1CCOC(C)(C)C1)c1ccc(C(F)(F)F)cc1 ZINC000545236778 940557855 /nfs/dbraw/zinc/55/78/55/940557855.db2.gz OCFMVLPWFVPQAU-ROUUACIJSA-N 0 3 415.500 4.345 20 0 HIADHN CCO[C@@H]1C[C@@H](NCc2c(C)nn(Cc3ccc(Cl)cc3)c2C)[C@]12CCCO2 ZINC000545349786 940563689 /nfs/dbraw/zinc/56/36/89/940563689.db2.gz GTMMWEDMUPOJHI-YPAWHYETSA-N 0 3 403.954 4.018 20 0 HIADHN CN1CCN(CCCCNC(=O)c2cc(Cl)ccc2Sc2ccccc2)CC1 ZINC000545377496 940567032 /nfs/dbraw/zinc/56/70/32/940567032.db2.gz VMKDICLZGFPXLZ-UHFFFAOYSA-N 0 3 418.006 4.249 20 0 HIADHN CS[C@H]1CN(C(=O)Nc2ccc(Br)cc2C(C)C)C[C@H]1N(C)C ZINC000545442849 940570095 /nfs/dbraw/zinc/57/00/95/940570095.db2.gz YYPUKHUTRGYJLS-CVEARBPZSA-N 0 3 400.386 4.082 20 0 HIADHN Cc1cccc(C)c1[C@@H](C)NCC(=O)Nc1ccccc1I ZINC000545518354 940572855 /nfs/dbraw/zinc/57/28/55/940572855.db2.gz IUSJYYAOKBOMJL-CQSZACIVSA-N 0 3 408.283 4.197 20 0 HIADHN CN(Cc1ccccc1)Cc1cccc(-c2nc([C@@H]3CC(=O)N(CC4CC4)C3)no2)c1 ZINC000545797416 940599438 /nfs/dbraw/zinc/59/94/38/940599438.db2.gz BCSTXHJWXDAMGA-JOCHJYFZSA-N 0 3 416.525 4.095 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)CCc1cc(Br)ccc1F)c1ccco1 ZINC000563989527 945338045 /nfs/dbraw/zinc/33/80/45/945338045.db2.gz VZUUUUQYZUYRGN-DYVFJYSZSA-N 0 3 411.315 4.359 20 0 HIADHN COCc1cccc(OCC2(CN3CCC([C@](C)(O)C(F)(F)F)CC3)CCC2)c1 ZINC000545931514 940660519 /nfs/dbraw/zinc/66/05/19/940660519.db2.gz ODNTWARBUVUMRQ-FQEVSTJZSA-N 0 3 415.496 4.407 20 0 HIADHN Brc1ccc(-c2ccc(CN3CCOC4(CCOCC4)CC3)o2)cc1 ZINC000546011537 940674356 /nfs/dbraw/zinc/67/43/56/940674356.db2.gz NASAYLICXZEHBW-UHFFFAOYSA-N 0 3 406.320 4.481 20 0 HIADHN C[C@@H](N[C@H]1COc2ccc(F)cc2C1)c1ccc(S(=O)(=O)C2CCCC2)cc1 ZINC000563998777 945341077 /nfs/dbraw/zinc/34/10/77/945341077.db2.gz NDBMDGNUVUPAAX-DNVCBOLYSA-N 0 3 403.519 4.196 20 0 HIADHN CCO[C@@H]1C[C@H](N[C@H](C)c2ccc(OC(F)F)cc2OC(F)F)[C@]12CCCO2 ZINC000546166881 940720062 /nfs/dbraw/zinc/72/00/62/940720062.db2.gz SLDUWPZCCZMZTR-BGQJUOQUSA-N 0 3 407.404 4.267 20 0 HIADHN Cc1nn(-c2ccccc2)c(Oc2cccc(F)c2)c1CNCCc1ccn(C)n1 ZINC000546176685 940721773 /nfs/dbraw/zinc/72/17/73/940721773.db2.gz QCXNCWHUKJSGSD-UHFFFAOYSA-N 0 3 405.477 4.178 20 0 HIADHN CCN(C(=O)Cc1nc(-c2ccsc2)oc1C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000546182759 940723085 /nfs/dbraw/zinc/72/30/85/940723085.db2.gz IZTZXIWYFZVINA-HXUWFJFHSA-N 0 3 409.555 4.377 20 0 HIADHN CCN(C(=O)[C@@H](C)Cc1ccc(OC)c(OC)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000546182660 940723419 /nfs/dbraw/zinc/72/34/19/940723419.db2.gz IXGUXRMOAHVHCL-UGKGYDQZSA-N 0 3 410.558 4.005 20 0 HIADHN CCN(C(=O)Cc1nc(-c2ccccc2)oc1C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000546184783 940724444 /nfs/dbraw/zinc/72/44/44/940724444.db2.gz QPMCYMZAFUJUAT-QFIPXVFZSA-N 0 3 403.526 4.316 20 0 HIADHN CCN(c1ccc(-c2nc(-c3ccc(N4CCCN(C)CC4)nc3)no2)cc1)C(C)C ZINC000546366070 940802842 /nfs/dbraw/zinc/80/28/42/940802842.db2.gz RFWASGPTZMZKHG-UHFFFAOYSA-N 0 3 420.561 4.175 20 0 HIADHN Fc1cccc(CN2CCC[C@@H](c3nc(-c4ccccc4-n4cccn4)no3)C2)c1 ZINC000546373563 940804390 /nfs/dbraw/zinc/80/43/90/940804390.db2.gz SWIJHACBNURXPN-GOSISDBHSA-N 0 3 403.461 4.441 20 0 HIADHN CC1CCN([C@H](CNC(=O)N2CC3(CCC3)[C@H]2[C@@H]2CCCO2)c2cccs2)CC1 ZINC000564013336 945349915 /nfs/dbraw/zinc/34/99/15/945349915.db2.gz JMRVPKDRLIIBES-SVFBPWRDSA-N 0 3 417.619 4.264 20 0 HIADHN Cc1nc(-c2cccc(-c3noc([C@@H]4CCCN(Cc5cccc(F)c5)C4)n3)c2)n[nH]1 ZINC000546467604 940827683 /nfs/dbraw/zinc/82/76/83/940827683.db2.gz JMBDOSOGIHBFTE-LJQANCHMSA-N 0 3 418.476 4.349 20 0 HIADHN Fc1cccc(CN2CCC[C@H](c3nc(-c4ccncc4N4CCCC4)no3)C2)c1 ZINC000546528613 940844794 /nfs/dbraw/zinc/84/47/94/940844794.db2.gz VDALNMBLHKSVJR-SFHVURJKSA-N 0 3 407.493 4.251 20 0 HIADHN Cc1cc(C(=O)N(CCN(C)C)Cc2cccc(C)c2)c(C)n1Cc1ccncc1 ZINC000546565834 940854812 /nfs/dbraw/zinc/85/48/12/940854812.db2.gz ROAUPRUGRXVPNS-UHFFFAOYSA-N 0 3 404.558 4.061 20 0 HIADHN Cc1noc(C)c1CO[C@H]1CCN(CCC(=O)Nc2c(Cl)cccc2Cl)C1 ZINC000546589470 940858986 /nfs/dbraw/zinc/85/89/86/940858986.db2.gz VPHMINRPVQRPNS-AWEZNQCLSA-N 0 3 412.317 4.218 20 0 HIADHN Cc1ccc([C@@H](Cc2ccccc2Br)NC[C@H](C)S(C)(=O)=O)cc1 ZINC000546626687 940862399 /nfs/dbraw/zinc/86/23/99/940862399.db2.gz HUGYDLHDELNMJD-HNAYVOBHSA-N 0 3 410.377 4.064 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)C1(c2ccc(OC)cc2)CCOCC1)c1ccsc1 ZINC000546702469 940870833 /nfs/dbraw/zinc/87/08/33/940870833.db2.gz RZECGIVDVQNRPP-NRFANRHFSA-N 0 3 416.587 4.004 20 0 HIADHN COc1ccc(C2(C(=O)NC[C@H](c3ccc(C)cc3)N3CCCC3)CCOCC2)cc1 ZINC000546702391 940870875 /nfs/dbraw/zinc/87/08/75/940870875.db2.gz SRGOCYMGOQQWQL-XMMPIXPASA-N 0 3 422.569 4.005 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(F)cc2)CC1)c1scnc1C1CCCC1 ZINC000546807408 940885909 /nfs/dbraw/zinc/88/59/09/940885909.db2.gz SBYTULJRGROJTO-UHFFFAOYSA-N 0 3 417.550 4.213 20 0 HIADHN CCN(C(=O)Cc1ccc(Br)s1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000546889219 940902792 /nfs/dbraw/zinc/90/27/92/940902792.db2.gz IQBGGIZBEPQUIE-INIZCTEOSA-N 0 3 407.377 4.176 20 0 HIADHN CCO[C@@H]1COCC[C@@H]1NCc1cn(-c2ccc(Br)cc2)nc1C(C)C ZINC000546963410 940929500 /nfs/dbraw/zinc/92/95/00/940929500.db2.gz IKVJGQBBLCDHRD-RBUKOAKNSA-N 0 3 422.367 4.042 20 0 HIADHN CN1CCCN(c2ccc(-c3noc([C@@H]4C[C@@]45CCCc4ccccc45)n3)cn2)CC1 ZINC000547067357 940982028 /nfs/dbraw/zinc/98/20/28/940982028.db2.gz CKWODHLAALBHLF-SQJMNOBHSA-N 0 3 415.541 4.035 20 0 HIADHN Cc1ccc(SCCc2nc(-c3ccc(N4CCCN(C)CC4)nc3)no2)cc1C ZINC000547071837 940983459 /nfs/dbraw/zinc/98/34/59/940983459.db2.gz BPLNZUHZDNFMFW-UHFFFAOYSA-N 0 3 423.586 4.225 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(-c4cc(Cl)ccc4Cl)n3)cn2)CC1 ZINC000547072497 940984536 /nfs/dbraw/zinc/98/45/36/940984536.db2.gz QKKISCJTUADYGG-UHFFFAOYSA-N 0 3 404.301 4.247 20 0 HIADHN CC[C@@H](Cc1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1)c1ccc(OC)cc1 ZINC000547073843 940985243 /nfs/dbraw/zinc/98/52/43/940985243.db2.gz AQJFXPVMTGUMPZ-SFHVURJKSA-N 0 3 421.545 4.018 20 0 HIADHN CC(C)NC(=O)Nc1ccc(-c2noc([C@@H]3CCCN(Cc4cccnc4)C3)n2)cc1 ZINC000547108497 940999924 /nfs/dbraw/zinc/99/99/24/940999924.db2.gz DMNPCQSBGAIZIE-LJQANCHMSA-N 0 3 420.517 4.041 20 0 HIADHN COC(=O)c1cn([C@@H]2CCCN(Cc3ccc(-c4ccccc4Cl)s3)C2)nn1 ZINC000547283305 941051874 /nfs/dbraw/zinc/05/18/74/941051874.db2.gz KEUBTUHYRZYZNW-CQSZACIVSA-N 0 3 416.934 4.284 20 0 HIADHN COC[C@H](CC(C)C)N[C@H](c1cccc(S(C)(=O)=O)c1)c1ccc(C)cc1C ZINC000547867655 941079195 /nfs/dbraw/zinc/07/91/95/941079195.db2.gz CNPZKPSCRKZDRR-NZQKXSOJSA-N 0 3 403.588 4.447 20 0 HIADHN Cc1nc(-c2ccc(Br)cc2)c(NC(=O)[C@H](C)N2CCCCCC2)n1C ZINC000547940219 941079798 /nfs/dbraw/zinc/07/97/98/941079798.db2.gz HYKZMWVDJLRBMF-AWEZNQCLSA-N 0 3 419.367 4.361 20 0 HIADHN CCOc1ccc(NC(=O)[C@H]2CCCN(Cc3cccnc3)C2)cc1Br ZINC000547989608 941082319 /nfs/dbraw/zinc/08/23/19/941082319.db2.gz LSVAMLVOYRKDNS-INIZCTEOSA-N 0 3 418.335 4.094 20 0 HIADHN O=C(NCC1(c2ccc(F)cc2F)CCCC1)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000548277477 941093178 /nfs/dbraw/zinc/09/31/78/941093178.db2.gz BTUBKMIOLLVEKI-IBGZPJMESA-N 0 3 413.512 4.200 20 0 HIADHN COc1ccc(-c2ccncc2)cc1CN[C@@H](C)[C@@H]1CN(Cc2ccccc2)CCO1 ZINC000548477334 941107523 /nfs/dbraw/zinc/10/75/23/941107523.db2.gz FHPNFNMWUULLLL-FNZWTVRRSA-N 0 3 417.553 4.136 20 0 HIADHN Cc1ccc(C(=O)C2CCN(CCC(=O)N3CCc4ccccc4C3)CC2)c(C)c1 ZINC000548721514 941121383 /nfs/dbraw/zinc/12/13/83/941121383.db2.gz MTCCOOXSBWUPQL-UHFFFAOYSA-N 0 3 404.554 4.173 20 0 HIADHN CCOc1c(Cl)cc(CNC[C@H](O)COc2cccc3ccccc32)cc1OC ZINC000548926158 941129679 /nfs/dbraw/zinc/12/96/79/941129679.db2.gz NIXYIEKHZUXLCJ-SFHVURJKSA-N 0 3 415.917 4.430 20 0 HIADHN CN(C)C[C@H](NC(=O)Nc1ccc(C(=O)NC(C)(C)C)cc1)c1ccc(Cl)cc1 ZINC000548963772 941135059 /nfs/dbraw/zinc/13/50/59/941135059.db2.gz QWUUAKLBGWGFKG-IBGZPJMESA-N 0 3 416.953 4.293 20 0 HIADHN CCNC(=O)Nc1cccc(NC(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)c1C ZINC000548968383 941135716 /nfs/dbraw/zinc/13/57/16/941135716.db2.gz URDPXAPOYUHQLT-IBGZPJMESA-N 0 3 417.941 4.214 20 0 HIADHN CCc1nc2cc(CNC(=O)NC[C@@H](c3ccccc3)N(C)C)ccc2n1C1CC1 ZINC000548988620 941139225 /nfs/dbraw/zinc/13/92/25/941139225.db2.gz ACFWYVQFVQKYIR-QFIPXVFZSA-N 0 3 405.546 4.036 20 0 HIADHN CO[C@@H](CN[C@H](CO)c1ccc(Br)cc1C(F)(F)F)c1ccccc1 ZINC000549035924 941146858 /nfs/dbraw/zinc/14/68/58/941146858.db2.gz FHGAXSUNMYJCEJ-SJORKVTESA-N 0 3 418.253 4.479 20 0 HIADHN CN(C)[C@@H](CNC(=O)Nc1ccc(NC(=O)CC(F)(F)F)cc1)c1ccccc1 ZINC000549057541 941149978 /nfs/dbraw/zinc/14/99/78/941149978.db2.gz GSYCNMPCRLNSPV-KRWDZBQOSA-N 0 3 408.424 4.002 20 0 HIADHN CNC(=O)c1cccc(NC(=O)[C@H](C)N[C@@H](c2cccc(C(F)(F)F)c2)C2CC2)c1 ZINC000549078310 941153606 /nfs/dbraw/zinc/15/36/06/941153606.db2.gz REJAERZXKWRQPX-ORAYPTAESA-N 0 3 419.447 4.133 20 0 HIADHN CNC(=O)c1cccc(NC(=O)[C@@H](C)N[C@@H](c2cccc(C(F)(F)F)c2)C2CC2)c1 ZINC000549078309 941153648 /nfs/dbraw/zinc/15/36/48/941153648.db2.gz REJAERZXKWRQPX-BFUOFWGJSA-N 0 3 419.447 4.133 20 0 HIADHN COc1cc2c(cc1F)CC[C@H]2NC(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000549100865 941158602 /nfs/dbraw/zinc/15/86/02/941158602.db2.gz LKIPNEFPDAMUKI-QZTJIDSGSA-N 0 3 403.523 4.019 20 0 HIADHN COc1cccc([C@@H]2[C@H](NCC(=O)Nc3ccc(Cl)cc3C)CCN2C2CC2)c1 ZINC000549111514 941160810 /nfs/dbraw/zinc/16/08/10/941160810.db2.gz CNAPBTQITVLGEF-FYYLOGMGSA-N 0 3 413.949 4.163 20 0 HIADHN COc1cccc([C@@H]2[C@@H](N[C@H](C)C(=O)Nc3ccccc3Cl)CCN2C2CC2)c1 ZINC000549112871 941160999 /nfs/dbraw/zinc/16/09/99/941160999.db2.gz MELJHUNWBBDVIB-KBJGYGKASA-N 0 3 413.949 4.243 20 0 HIADHN CCN1CC[C@H](NCC(=O)N(C(C)C)C2CCCC2)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000549115290 941161457 /nfs/dbraw/zinc/16/14/57/941161457.db2.gz BFIMMRJUGZVUGG-SIKLNZKXSA-N 0 3 411.512 4.008 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@@H](NCc2cc(OC)c(OCC)c(OC)c2)c2ccccc21 ZINC000549118373 941161797 /nfs/dbraw/zinc/16/17/97/941161797.db2.gz GHXYCTPAJOHFMD-WOJBJXKFSA-N 0 3 413.514 4.374 20 0 HIADHN CCN1CC[C@H](NCC(=O)Nc2ccc(C)c(C)c2)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000549117869 941161907 /nfs/dbraw/zinc/16/19/07/941161907.db2.gz YLLPIXJMFJSRKI-SIKLNZKXSA-N 0 3 405.464 4.084 20 0 HIADHN CC[C@H](C)Oc1cc(CNC(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)ccn1 ZINC000549122078 941162358 /nfs/dbraw/zinc/16/23/58/941162358.db2.gz FAHBMPMTQVGMTF-KXBFYZLASA-N 0 3 404.942 4.014 20 0 HIADHN CC(=O)NCCN(CCC(=O)Nc1cccc2ccccc21)Cc1ccc(C)s1 ZINC000549151516 941165807 /nfs/dbraw/zinc/16/58/07/941165807.db2.gz RUFHBAZBMJMQDX-UHFFFAOYSA-N 0 3 409.555 4.177 20 0 HIADHN CCCN(C[C@@H]1CCN(C(=O)c2ccccc2)C1)[C@H](C)C(=O)Nc1ccccc1C ZINC000549172481 941168320 /nfs/dbraw/zinc/16/83/20/941168320.db2.gz JIACMXJVHXGGOH-RTWAWAEBSA-N 0 3 407.558 4.196 20 0 HIADHN CN(C)C[C@H](NC(=O)c1csc(-c2ncccc2F)n1)c1ccc(Cl)cc1 ZINC000549245152 941173752 /nfs/dbraw/zinc/17/37/52/941173752.db2.gz MVJAVISRGQDJGO-HNNXBMFYSA-N 0 3 404.898 4.030 20 0 HIADHN CC[C@@H]1CN(c2nnc(COCc3ccccc3)n2CC)CCN1Cc1ccccc1 ZINC000549398849 941186108 /nfs/dbraw/zinc/18/61/08/941186108.db2.gz IWNQIEZMANUXIT-HSZRJFAPSA-N 0 3 419.573 4.116 20 0 HIADHN CN(C)C[C@H](NC(=O)N[C@H](c1ccc(F)cc1)[C@@H]1CCCO1)c1ccc(Cl)cc1 ZINC000549414606 941187489 /nfs/dbraw/zinc/18/74/89/941187489.db2.gz KIBIVTOCFAIPBG-PCCBWWKXSA-N 0 3 419.928 4.301 20 0 HIADHN Cc1cc(NC(=O)[C@H](C)N[C@H]2CCN(C(C)(C)C)[C@H]2c2ccc(Cl)c(F)c2)on1 ZINC000549476046 941194339 /nfs/dbraw/zinc/19/43/39/941194339.db2.gz BWQKSSSDHBLJNE-IXDGSTSKSA-N 0 3 422.932 4.306 20 0 HIADHN Clc1sc(CNCc2cccc(N3CCOCC3)c2)cc1Br ZINC000549832415 941208856 /nfs/dbraw/zinc/20/88/56/941208856.db2.gz BGAWEBGJVPPZNW-UHFFFAOYSA-N 0 3 401.757 4.290 20 0 HIADHN CCN(C(=O)N[C@@H]1CCc2cc(F)c(OC)cc21)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000549625612 941201894 /nfs/dbraw/zinc/20/18/94/941201894.db2.gz QHWYLBQIRPLUBT-DENIHFKCSA-N 0 3 411.521 4.128 20 0 HIADHN CC[C@H]1CN(c2nnc(C3CCCC3)n2C[C@@H]2CCOC2)CCN1Cc1ccccc1 ZINC000549678419 941204189 /nfs/dbraw/zinc/20/41/89/941204189.db2.gz NKFHLNWRJFPSOR-GMAHTHKFSA-N 0 3 423.605 4.073 20 0 HIADHN O=C(NCCN1CCCC1)c1ccc(NCc2cc(F)cc(C(F)(F)F)c2)cc1 ZINC000549680946 941204280 /nfs/dbraw/zinc/20/42/80/941204280.db2.gz MRMHERYIIUJLHU-UHFFFAOYSA-N 0 3 409.427 4.282 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)Nc1ccc(-c2noc(C(F)F)n2)cc1 ZINC000549802815 941207741 /nfs/dbraw/zinc/20/77/41/941207741.db2.gz MUSRZQTZQLDFRQ-UHFFFAOYSA-N 0 3 415.444 4.270 20 0 HIADHN CCOC(=O)c1csc(C2CCN(Cc3ccc(C)cc3-c3cnn(C)c3)CC2)n1 ZINC000549808880 941207983 /nfs/dbraw/zinc/20/79/83/941207983.db2.gz ZDVQOXXTTJLACY-UHFFFAOYSA-N 0 3 424.570 4.408 20 0 HIADHN Cc1nnc(N2CCN(Cc3cccc4ccccc43)CC2)n1Cc1cccs1 ZINC000549866704 941220446 /nfs/dbraw/zinc/22/04/46/941220446.db2.gz IFNSHITZQGMAFU-UHFFFAOYSA-N 0 3 403.555 4.172 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)N[C@@H]2CCN([C@H](C)c3ccc(F)cc3)C2=O)cc1 ZINC000549927536 941240839 /nfs/dbraw/zinc/24/08/39/941240839.db2.gz AHEKOHRITJRZLD-YGKZAACZSA-N 0 3 406.505 4.333 20 0 HIADHN O=S(=O)(CCCNCc1c[nH]nc1-c1cccc(Cl)c1)c1ccc(Cl)cc1 ZINC000549937270 941243145 /nfs/dbraw/zinc/24/31/45/941243145.db2.gz SARIPOGWWANVDR-UHFFFAOYSA-N 0 3 424.353 4.337 20 0 HIADHN C[C@H](CNCc1c(Cl)cccc1N1CCOCC1)c1nc(-c2ccccc2)no1 ZINC000550174207 941293528 /nfs/dbraw/zinc/29/35/28/941293528.db2.gz JGFYCNCZEJHEJP-MRXNPFEDSA-N 0 3 412.921 4.120 20 0 HIADHN Cc1nn(Cc2ccccc2Cl)c(C)c1CNCc1cccc(N2CCOCC2)c1 ZINC000550228456 941301583 /nfs/dbraw/zinc/30/15/83/941301583.db2.gz UIKUDSXUURYIFW-UHFFFAOYSA-N 0 3 424.976 4.328 20 0 HIADHN CN(C)[C@H](CNC(=O)c1cc(CNC(=O)C(C)(C)C)ccc1Cl)c1ccccc1 ZINC000550266625 941306382 /nfs/dbraw/zinc/30/63/82/941306382.db2.gz HHTHFXMOSQVNBV-HXUWFJFHSA-N 0 3 415.965 4.035 20 0 HIADHN COc1cccc(C(=O)CCCC(=O)N2CCC(N3CCc4ccccc4C3)CC2)c1 ZINC000550441408 941327838 /nfs/dbraw/zinc/32/78/38/941327838.db2.gz GUROXTVTVHVGFL-UHFFFAOYSA-N 0 3 420.553 4.098 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)c3cc(Cl)c(F)cc3Cl)CC2)C[C@H](C)O1 ZINC000550471345 941330215 /nfs/dbraw/zinc/33/02/15/941330215.db2.gz IWKRQIRXCJNNRM-STQMWFEESA-N 0 3 403.325 4.094 20 0 HIADHN Brc1cc2c(s1)CC[C@@H]2NCc1ccc(CN2CCOCC2)cc1 ZINC000550609096 941345894 /nfs/dbraw/zinc/34/58/94/941345894.db2.gz OXWFOFBFGDOJGS-KRWDZBQOSA-N 0 3 407.377 4.120 20 0 HIADHN Brc1cc2c(s1)CC[C@H]2NCc1ccc(CN2CCOCC2)cc1 ZINC000550609097 941345996 /nfs/dbraw/zinc/34/59/96/941345996.db2.gz OXWFOFBFGDOJGS-QGZVFWFLSA-N 0 3 407.377 4.120 20 0 HIADHN NS(=O)(=O)c1ccc2c(c1)CCC[C@@H]2NC1(c2cccc(C(F)(F)F)c2)CCC1 ZINC000550754129 941363262 /nfs/dbraw/zinc/36/32/62/941363262.db2.gz UUXYYUWTDYJSIK-IBGZPJMESA-N 0 3 424.488 4.399 20 0 HIADHN COc1ccc(CCN[C@@H](c2cnn(C)c2)c2cccc(F)c2)c(Cl)c1OC ZINC000550858248 941374772 /nfs/dbraw/zinc/37/47/72/941374772.db2.gz ORLKAMUCJPQTKO-HXUWFJFHSA-N 0 3 403.885 4.152 20 0 HIADHN NS(=O)(=O)c1ccc2c(c1)CCC[C@@H]2NCc1ccc(Oc2ccccc2)cc1 ZINC000551029262 941397408 /nfs/dbraw/zinc/39/74/08/941397408.db2.gz BNBJLIHWMVSQJU-QHCPKHFHSA-N 0 3 408.523 4.294 20 0 HIADHN Cc1ccc(-c2noc([C@@H](C)N[C@@H](C)C3CCN(CC(F)(F)F)CC3)n2)cc1F ZINC000551093597 941408895 /nfs/dbraw/zinc/40/88/95/941408895.db2.gz OYMXAYGPJDTVJL-UONOGXRCSA-N 0 3 414.447 4.498 20 0 HIADHN Cc1cccc(-c2ccc(CN[C@H]3CCCc4cc(S(N)(=O)=O)ccc43)cc2)c1 ZINC000551164553 941420621 /nfs/dbraw/zinc/42/06/21/941420621.db2.gz IJIMSAYMQOSVCZ-DEOSSOPVSA-N 0 3 406.551 4.477 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](NC[C@@H](CO)C2CCCCC2)c2ccc(F)cc2)c1 ZINC000551272930 941441057 /nfs/dbraw/zinc/44/10/57/941441057.db2.gz RLVVSFPXPNJPTC-REWPJTCUSA-N 0 3 419.562 4.097 20 0 HIADHN CCO[C@@H]1C[C@H](N[C@@H](c2ccc(Br)cc2F)C2CC2)[C@@H]1n1cccn1 ZINC000551320116 941451542 /nfs/dbraw/zinc/45/15/42/941451542.db2.gz JDMSBYJGBPAENX-MANSERQUSA-N 0 3 408.315 4.244 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)c2cnc(OC3CCCCC3)c(Cl)c2)CC1 ZINC000551363073 941461737 /nfs/dbraw/zinc/46/17/37/941461737.db2.gz TVYXYUILTPNYPK-UHFFFAOYSA-N 0 3 423.985 4.066 20 0 HIADHN C[C@H](N[C@@H]1CCC(=O)N[C@H]1C1CC1)c1nc2cc(Cl)ccc2n1Cc1ccccc1 ZINC000551368808 941463171 /nfs/dbraw/zinc/46/31/71/941463171.db2.gz RBIWTSPXVSBADE-YWBKXGLFSA-N 0 3 422.960 4.446 20 0 HIADHN CCc1ccc(-c2noc([C@@H](C)NC[C@@H]3CN(Cc4ccccc4)CCCO3)n2)cc1 ZINC000551394862 941469047 /nfs/dbraw/zinc/46/90/47/941469047.db2.gz IDGOENUPXZEDCW-AUSIDOKSSA-N 0 3 420.557 4.241 20 0 HIADHN COc1cccc(NC(=O)CN[C@@H](c2cccc(C(F)(F)F)c2)C2CCOCC2)c1 ZINC000551419144 941474729 /nfs/dbraw/zinc/47/47/29/941474729.db2.gz UADZOVSOSLUGLC-OAQYLSRUSA-N 0 3 422.447 4.410 20 0 HIADHN COc1ncc([C@H](C)N[C@H](C)CC(=O)Nc2cccc(N3CCCC3)c2)cc1Cl ZINC000551534794 941497221 /nfs/dbraw/zinc/49/72/21/941497221.db2.gz QXYBUQFNPRTHDX-CVEARBPZSA-N 0 3 416.953 4.412 20 0 HIADHN CC(C)(C)c1nn(-c2ccccc2Cl)cc1CN[C@@H](CO)C[C@H](O)C(C)(C)C ZINC000551571127 941503817 /nfs/dbraw/zinc/50/38/17/941503817.db2.gz KDCIPEGRVYGYEU-APWZRJJASA-N 0 3 407.986 4.071 20 0 HIADHN CCCC(=O)Nc1ccc(CNCc2cccc(I)c2)cc1 ZINC000551571857 941504487 /nfs/dbraw/zinc/50/44/87/941504487.db2.gz KZIYPHMYAVBMIL-UHFFFAOYSA-N 0 3 408.283 4.320 20 0 HIADHN COCC[C@H](N[C@@H](C)c1ccc(-n2cnnn2)cc1)c1ccc(Cl)c(Cl)c1 ZINC000551572306 941504508 /nfs/dbraw/zinc/50/45/08/941504508.db2.gz YNPUOQUJOFPAAP-DJJJIMSYSA-N 0 3 406.317 4.398 20 0 HIADHN Brc1cccc([C@H](NCc2cnc3n2CCCC3)C2CCOCC2)c1 ZINC000551572853 941505016 /nfs/dbraw/zinc/50/50/16/941505016.db2.gz LIHGXYKCPJGQSG-HXUWFJFHSA-N 0 3 404.352 4.239 20 0 HIADHN CC(=O)NCCN(Cc1cnc(-c2ccc(Cl)cc2)s1)C1CCSCC1 ZINC000551602973 941510099 /nfs/dbraw/zinc/51/00/99/941510099.db2.gz XKCWTEBNAGHQGG-UHFFFAOYSA-N 0 3 410.008 4.297 20 0 HIADHN Cc1nc(C(=O)Nc2ccccc2CN(C)C)nn1-c1c(Cl)cccc1Cl ZINC000551654156 941519236 /nfs/dbraw/zinc/51/92/36/941519236.db2.gz PANCYERRLZJDJT-UHFFFAOYSA-N 0 3 404.301 4.196 20 0 HIADHN O=C(CN[C@@H](c1cccc(C(F)(F)F)c1)C1CCOCC1)N1CCc2ccccc21 ZINC000551721811 941533200 /nfs/dbraw/zinc/53/32/00/941533200.db2.gz JBMNWKZEGSMJFC-JOCHJYFZSA-N 0 3 418.459 4.352 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)[C@H]2C[C@@H]2c2cccc(C(F)(F)F)c2)cc1 ZINC000551794279 941546279 /nfs/dbraw/zinc/54/62/79/941546279.db2.gz QGOKZURWZJJKFW-AABGKKOBSA-N 0 3 406.448 4.237 20 0 HIADHN O=C(c1ccc(N2CCCCC2)cc1)N1CCN(c2ccnc3ccccc32)CC1 ZINC000552009018 941568324 /nfs/dbraw/zinc/56/83/24/941568324.db2.gz ORKKAXQMTOMOCQ-UHFFFAOYSA-N 0 3 400.526 4.188 20 0 HIADHN CCC[C@H](N[C@H](C)c1ccc(OC)c(OC)c1C)C(=O)N1CCc2sccc2C1 ZINC000552044946 941573312 /nfs/dbraw/zinc/57/33/12/941573312.db2.gz SSPQMYQPBLIRTA-APWZRJJASA-N 0 3 416.587 4.478 20 0 HIADHN Cc1ccccc1COc1c(C)cc(CN2CCC[C@@H](n3cc(CO)nn3)C2)cc1C ZINC000552110560 941586976 /nfs/dbraw/zinc/58/69/76/941586976.db2.gz UDIQRDHYJOVNIA-XMMPIXPASA-N 0 3 420.557 4.112 20 0 HIADHN C[C@@H](Oc1ccc(Cl)c(Cl)c1)C(=O)N(C)CCCN(C)Cc1ccncc1 ZINC000552112714 941587397 /nfs/dbraw/zinc/58/73/97/941587397.db2.gz QJGMOCQGYGCPNZ-OAHLLOKOSA-N 0 3 410.345 4.136 20 0 HIADHN CN(CCCN(C)C(=O)[C@@H]1C[C@H]1c1cccc(C(F)(F)F)c1)Cc1ccncc1 ZINC000552112637 941587477 /nfs/dbraw/zinc/58/74/77/941587477.db2.gz NJFZCHORQCMQSM-VQTJNVASSA-N 0 3 405.464 4.184 20 0 HIADHN C[C@@H](CC(=O)Nc1cccc(CN2CC[C@@H](O)C2)c1)c1ccc(C(F)(F)F)cc1 ZINC000552198771 941600296 /nfs/dbraw/zinc/60/02/96/941600296.db2.gz FJZBJKJUSYIIRD-MGPUTAFESA-N 0 3 406.448 4.404 20 0 HIADHN COc1cc2c(cc1F)CC[C@H]2NC(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000552211009 941604006 /nfs/dbraw/zinc/60/40/06/941604006.db2.gz FOGWIRNWPMHFAK-UYAOXDASSA-N 0 3 418.459 4.095 20 0 HIADHN O[C@H](CN[C@@H]1CCOc2c(Cl)cccc21)COc1c(Cl)cccc1Cl ZINC000552226744 941608568 /nfs/dbraw/zinc/60/85/68/941608568.db2.gz OLZAUMDKFKOTSG-BDJLRTHQSA-N 0 3 402.705 4.500 20 0 HIADHN CCCN(C)[C@H](CNC(=O)C[C@H](NC(C)=O)c1cccs1)c1ccc(Cl)cc1 ZINC000552241160 941610795 /nfs/dbraw/zinc/61/07/95/941610795.db2.gz CJJZFAGUFQRPQK-RBUKOAKNSA-N 0 3 421.994 4.168 20 0 HIADHN CCCN(C)[C@H](CNC(=O)CSCc1c(C)noc1C)c1ccc(Cl)cc1 ZINC000552243158 941612422 /nfs/dbraw/zinc/61/24/22/941612422.db2.gz RFGKSRDASZHZEQ-LJQANCHMSA-N 0 3 409.983 4.377 20 0 HIADHN CCOc1cc(C[NH2+][C@H](C)COc2ccc(F)cc2F)cc(Br)c1[O-] ZINC000552295464 941625107 /nfs/dbraw/zinc/62/51/07/941625107.db2.gz LEJWXIQFIKXDFU-LLVKDONJSA-N 0 3 416.262 4.389 20 0 HIADHN CNC(=O)COc1cccc(CN[C@@H]2CCCOc3c(C)cc(C(C)(C)C)cc32)c1 ZINC000552296516 941625809 /nfs/dbraw/zinc/62/58/09/941625809.db2.gz KZBILCDJUGAZCA-JOCHJYFZSA-N 0 3 410.558 4.421 20 0 HIADHN CCC(C)(C)C1CCC2(C[C@H]2C(=O)N2CC[C@H](N3CCN(C(C)C)CC3)C2)CC1 ZINC000552354574 941642547 /nfs/dbraw/zinc/64/25/47/941642547.db2.gz JNJNIWLZWTXRKW-NFJKTXFASA-N 0 3 403.655 4.246 20 0 HIADHN CN(CCCN(C)C(=O)CCCn1ccc2cc(Cl)ccc21)Cc1ccncc1 ZINC000552360550 941644035 /nfs/dbraw/zinc/64/40/35/941644035.db2.gz JXXCPLIUCRONFP-UHFFFAOYSA-N 0 3 412.965 4.450 20 0 HIADHN CC(C)Cn1cc(NC(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)c(C(F)F)n1 ZINC000552490397 941687126 /nfs/dbraw/zinc/68/71/26/941687126.db2.gz QNLNSORAXKLMIT-DOTOQJQBSA-N 0 3 405.493 4.261 20 0 HIADHN Cc1ccc(-c2ncc[nH]2)cc1NC(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000552553206 941706137 /nfs/dbraw/zinc/70/61/37/941706137.db2.gz GGDGGYVAYAPRJI-IBGZPJMESA-N 0 3 410.468 4.481 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c2sc(C(=O)N3C[C@H](N4CCCC4)C[C@@H]3C)cc12 ZINC000552680316 941736470 /nfs/dbraw/zinc/73/64/70/941736470.db2.gz OMTBVUZWSLWDNV-KBXCAEBGSA-N 0 3 412.534 4.233 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Cn1cnc2ccccc21)c1ccc(C(F)(F)F)cc1 ZINC000552687144 941738013 /nfs/dbraw/zinc/73/80/13/941738013.db2.gz ZQTGTLQGEZFWIJ-HXUWFJFHSA-N 0 3 418.463 4.254 20 0 HIADHN CO[C@@H](c1ccc(F)cc1)[C@@H](C)NC(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000552775707 941758803 /nfs/dbraw/zinc/75/88/03/941758803.db2.gz POLRVJVSAGWTPA-WZONZLPQSA-N 0 3 413.537 4.208 20 0 HIADHN CCc1ccc(-c2nc(CC(=O)N[C@@H](CN(C)C)c3ccc(OC)cc3)cs2)cc1 ZINC000552814202 941773836 /nfs/dbraw/zinc/77/38/36/941773836.db2.gz XKGQNRFIPMZZOX-QFIPXVFZSA-N 0 3 423.582 4.343 20 0 HIADHN Cc1c(CNC[C@@H](O)COc2cccc(Br)c2)oc2ccc(F)cc12 ZINC000552836727 941782885 /nfs/dbraw/zinc/78/28/85/941782885.db2.gz QZCAGYLYNRGLGU-OAHLLOKOSA-N 0 3 408.267 4.172 20 0 HIADHN Cc1cc2ncc([C@@H](C)N[C@H](C)c3ccc(NC(=O)c4ccncc4)cc3)c(C)n2n1 ZINC000552866355 941793201 /nfs/dbraw/zinc/79/32/01/941793201.db2.gz ZGUUOTULACDHGK-IAGOWNOFSA-N 0 3 414.513 4.405 20 0 HIADHN CC(C)CCOc1ccc([C@@H](C)NCc2ccc(S(=O)(=O)N(C)C)cc2)cc1 ZINC000552880184 941797391 /nfs/dbraw/zinc/79/73/91/941797391.db2.gz VHIREBPHBLBWNL-GOSISDBHSA-N 0 3 404.576 4.213 20 0 HIADHN COc1ccccc1[C@H]1CC[C@H](C)CN1C(=O)CC1(N2CCOCC2)CCCC1 ZINC000552887972 941798458 /nfs/dbraw/zinc/79/84/58/941798458.db2.gz JJLKKJHHGGKIRN-PZJWPPBQSA-N 0 3 400.563 4.030 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(NC(=O)c2ccncc2)cc1)C(=O)N1[C@H](C)CCC[C@@H]1C ZINC000553002805 941814273 /nfs/dbraw/zinc/81/42/73/941814273.db2.gz KDTCOLGURVYNOU-RDGPPVDQSA-N 0 3 408.546 4.163 20 0 HIADHN CCCN(C)[C@H](CNC(=O)[C@@H]1CCCN(C(=O)[C@H](C)CC)C1)c1ccc(Cl)cc1 ZINC000553027454 941819528 /nfs/dbraw/zinc/81/95/28/941819528.db2.gz ZUBYLJWZKHUZSO-YFVAEKQCSA-N 0 3 422.013 4.124 20 0 HIADHN O=C(CC1(O)CCCCC1)N(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000553197472 941847943 /nfs/dbraw/zinc/84/79/43/941847943.db2.gz MHSNIDNEXQWPCQ-DEOSSOPVSA-N 0 3 421.585 4.160 20 0 HIADHN C[C@@H](NC(=O)NC[C@H](c1cccs1)N1CCC(C)CC1)c1ccc2n[nH]cc2c1 ZINC000553363919 941873414 /nfs/dbraw/zinc/87/34/14/941873414.db2.gz WKFNDYQDETVPRX-OXQOHEQNSA-N 0 3 411.575 4.458 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@@H](C)c1nccn1-c1ccccc1)c1ccsc1 ZINC000553412561 941881364 /nfs/dbraw/zinc/88/13/64/941881364.db2.gz SDMNTRMIGLMUPO-FXAWDEMLSA-N 0 3 411.575 4.377 20 0 HIADHN C[C@H](CC(=O)N1CCC[C@@H](c2n[nH]cc2CN2CCCC2)C1)Cc1cccc(F)c1 ZINC000553513921 941899887 /nfs/dbraw/zinc/89/98/87/941899887.db2.gz ZHXLFHBJXOYPBL-AZUAARDMSA-N 0 3 412.553 4.120 20 0 HIADHN Cc1ccc(S[C@@H](C)C(=O)N2CCC[C@H](c3n[nH]cc3CN3CCCC3)C2)cc1 ZINC000553512606 941900046 /nfs/dbraw/zinc/90/00/46/941900046.db2.gz GEFXELHGRFQDAK-OALUTQOASA-N 0 3 412.603 4.201 20 0 HIADHN COc1ccc(C(=O)CC(C)(C)CC(=O)N2CCN(C3CCC3)C[C@H](C)C2)cc1 ZINC000553528506 941903784 /nfs/dbraw/zinc/90/37/84/941903784.db2.gz POTCHVGBQDKYAZ-SFHVURJKSA-N 0 3 400.563 4.017 20 0 HIADHN CC(=O)c1oc2cc(C)ccc2c1CC(=O)NC1CCN(CCc2ccccc2)CC1 ZINC000553612838 941920590 /nfs/dbraw/zinc/92/05/90/941920590.db2.gz KKLINOPUNDUQDK-UHFFFAOYSA-N 0 3 418.537 4.310 20 0 HIADHN COc1ccc([C@@H](CNC(=O)[C@@H](C)Cc2cncc3ccccc32)N2CCCC2)cc1 ZINC000553626275 941924334 /nfs/dbraw/zinc/92/43/34/941924334.db2.gz VNLXHXGJWCEVRZ-UQBPGWFLSA-N 0 3 417.553 4.375 20 0 HIADHN CC[C@H](C)Oc1cccc(NC(=O)N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)c1 ZINC000553654345 941935353 /nfs/dbraw/zinc/93/53/53/941935353.db2.gz KJAFCPJAHCRYRC-GBESFXJTSA-N 0 3 403.567 4.217 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NC[C@@H]1CCO[C@H]1c1ccccc1)c1ccsc1 ZINC000553741443 941956988 /nfs/dbraw/zinc/95/69/88/941956988.db2.gz UNHDZNIVBLREPD-JBACZVJFSA-N 0 3 401.576 4.208 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)c2cc(F)ccc2Br)N(C)C)cc1 ZINC000554015620 942019868 /nfs/dbraw/zinc/01/98/68/942019868.db2.gz SKFWTNVIHPGUPE-LJQANCHMSA-N 0 3 423.326 4.408 20 0 HIADHN Cc1nn(Cc2ccccc2Cl)c(C)c1C(=O)N1CCN([C@@H]2C[C@H]2C)C[C@@H](C)C1 ZINC000554132472 942044943 /nfs/dbraw/zinc/04/49/43/942044943.db2.gz UTSSONJZVAQMBB-WHSLLNHNSA-N 0 3 414.981 4.004 20 0 HIADHN CC(C)CC(=O)Nc1ccc(NC(=O)N[C@@H](CN(C)C)c2ccc(F)cc2)cc1 ZINC000554140194 942047551 /nfs/dbraw/zinc/04/75/51/942047551.db2.gz XBXLGVKYLAJNKO-FQEVSTJZSA-N 0 3 400.498 4.235 20 0 HIADHN CCCN(C)[C@H](CNC(=O)N[C@H]1CCCC12CCOCC2)c1ccc(Cl)cc1 ZINC000554164694 942053625 /nfs/dbraw/zinc/05/36/25/942053625.db2.gz FWMLRFKBQDLJNW-UXHICEINSA-N 0 3 407.986 4.371 20 0 HIADHN CN(C)C[C@H](NC(=O)Nc1ccccc1OC[C@H]1CCCCO1)c1ccc(F)cc1 ZINC000554192161 942063177 /nfs/dbraw/zinc/06/31/77/942063177.db2.gz WRWKQBMIBHENOZ-CTNGQTDRSA-N 0 3 415.509 4.198 20 0 HIADHN Ic1cccc(OCCCN2CCC[C@H]2c2cccnc2)c1 ZINC000554243938 942076103 /nfs/dbraw/zinc/07/61/03/942076103.db2.gz OSFAECGZPZQXJL-SFHVURJKSA-N 0 3 408.283 4.292 20 0 HIADHN CCCN(C)[C@H](CNC(=O)N1CCC([C@H]2CCCO2)CC1)c1ccc(Cl)cc1 ZINC000554248977 942078100 /nfs/dbraw/zinc/07/81/00/942078100.db2.gz AORSBMXBIKZFGT-NHCUHLMSSA-N 0 3 407.986 4.324 20 0 HIADHN COc1cc(OC)c([C@H](C)N[C@@H]2CCCN(C(=O)CCC(F)(F)F)C2)cc1Cl ZINC000554374745 942117789 /nfs/dbraw/zinc/11/77/89/942117789.db2.gz YRFHHQZCCCGUAI-QWHCGFSZSA-N 0 3 422.875 4.341 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1cccc(NC(=O)c2ccoc2)c1)c1ccco1 ZINC000554428683 942140250 /nfs/dbraw/zinc/14/02/50/942140250.db2.gz XRTTVTGXAHYXDY-KXBFYZLASA-N 0 3 410.474 4.376 20 0 HIADHN Cc1ccc2c(c1)CN(C(=O)Nc1ccc(CCN3CCSCC3)cc1)CCO2 ZINC000554428174 942140489 /nfs/dbraw/zinc/14/04/89/942140489.db2.gz IURWBDZOVZYSGN-UHFFFAOYSA-N 0 3 411.571 4.013 20 0 HIADHN Cc1ccc(NC(=O)N[C@@H](CN(C)C)c2ccc(F)cc2)c(OCC(F)(F)F)c1 ZINC000554435953 942142775 /nfs/dbraw/zinc/14/27/75/942142775.db2.gz ZGAKGFWEBYZVKE-KRWDZBQOSA-N 0 3 413.415 4.500 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)Nc1ccc(Oc2ccccc2C(N)=O)cc1 ZINC000554453367 942149085 /nfs/dbraw/zinc/14/90/85/942149085.db2.gz FAPPBPRKGUPFPT-UHFFFAOYSA-N 0 3 424.545 4.308 20 0 HIADHN CN(C)C[C@H](NC(=O)Nc1ccc(-c2noc(C(F)F)n2)cc1)c1ccc(F)cc1 ZINC000554461736 942151495 /nfs/dbraw/zinc/15/14/95/942151495.db2.gz OCEKQWXMHCZTDL-INIZCTEOSA-N 0 3 419.407 4.238 20 0 HIADHN CC(=O)N(Cc1ccc(NC(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)cc1)C(C)C ZINC000554476412 942156180 /nfs/dbraw/zinc/15/61/80/942156180.db2.gz VXIKEMKCECRLNT-MBSDFSHPSA-N 0 3 410.562 4.256 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3ccc(Oc4ccccc4)cn3)CC2)C[C@@H](C)O1 ZINC000554596288 942173847 /nfs/dbraw/zinc/17/38/47/942173847.db2.gz NZXFCKURSDKABP-WOJBJXKFSA-N 0 3 423.557 4.225 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)c2ccc(Oc3ccccc3)cn2)c1 ZINC000554605559 942175197 /nfs/dbraw/zinc/17/51/97/942175197.db2.gz UHSVPJONKMPOQR-UHFFFAOYSA-N 0 3 405.498 4.087 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)c1ccc(OC2CCCC2)c(OC)c1)c1ccco1 ZINC000554634399 942181870 /nfs/dbraw/zinc/18/18/70/942181870.db2.gz YCSNDCATMYLATH-QFBILLFUSA-N 0 3 400.519 4.469 20 0 HIADHN COc1ccc(NC(=O)N[C@H]2CCN(Cc3ccccc3)[C@@H]2C)c(Br)c1 ZINC000554748864 942219371 /nfs/dbraw/zinc/21/93/71/942219371.db2.gz LEENRRPUKAZNPL-KDOFPFPSSA-N 0 3 418.335 4.242 20 0 HIADHN Cc1cccc(C)c1NC(=O)CNC(=O)[C@@H](C)N1[C@@H]2CC[C@H]1C[C@@H](c1ccccc1)C2 ZINC000554837693 942274534 /nfs/dbraw/zinc/27/45/34/942274534.db2.gz SKMFKIQYFODZFH-XBYSBRQOSA-N 0 3 419.569 4.157 20 0 HIADHN CC(C)(CO)[C@@H](NCc1cc(Br)c2c(c1)OCCO2)c1ccccc1 ZINC000554866598 942298945 /nfs/dbraw/zinc/29/89/45/942298945.db2.gz AWSQYBVHOYCSOD-IBGZPJMESA-N 0 3 406.320 4.070 20 0 HIADHN Cc1cc(NC(=O)NCC(C)(C)C(F)(F)F)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000554866098 942299166 /nfs/dbraw/zinc/29/91/66/942299166.db2.gz CNHVSXPXWDKZCZ-KRWDZBQOSA-N 0 3 423.483 4.349 20 0 HIADHN O=C(CN[C@@H]1c2ccccc2CC12CCOCC2)Nc1cccc(C(F)(F)F)c1 ZINC000554971766 942338417 /nfs/dbraw/zinc/33/84/17/942338417.db2.gz AHFITAQPVWHLEB-HXUWFJFHSA-N 0 3 404.432 4.328 20 0 HIADHN CC(C)C(=O)c1ccc([C@H](C)C(=O)NC2CCN([C@@H](C)c3ccncc3)CC2)cc1 ZINC000555010145 942354406 /nfs/dbraw/zinc/35/44/06/942354406.db2.gz CQNLHJCQDKPZIF-OALUTQOASA-N 0 3 407.558 4.366 20 0 HIADHN CC(C)C(=O)c1ccc([C@@H](C)C(=O)NC2CCN([C@@H](C)c3ccncc3)CC2)cc1 ZINC000555010144 942354572 /nfs/dbraw/zinc/35/45/72/942354572.db2.gz CQNLHJCQDKPZIF-MOPGFXCFSA-N 0 3 407.558 4.366 20 0 HIADHN C[C@H](Cc1cnc2ccccc2n1)C(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1 ZINC000555031758 942363231 /nfs/dbraw/zinc/36/32/31/942363231.db2.gz GREMDDIBEQCRRZ-GCJKJVERSA-N 0 3 422.598 4.459 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3ccc(OC(F)F)c(F)c3)c(C)c2)CC1 ZINC000555064589 942374406 /nfs/dbraw/zinc/37/44/06/942374406.db2.gz HQZPIDIOFHSBJJ-UHFFFAOYSA-N 0 3 407.436 4.130 20 0 HIADHN CC(C)N1CC[C@H](N[C@@H](C)C(=O)N(C)Cc2ccccc2)[C@@H]1c1ccc(F)c(F)c1 ZINC000555125675 942392445 /nfs/dbraw/zinc/39/24/45/942392445.db2.gz LKKBZOPHZPZGDA-RTFZILSDSA-N 0 3 415.528 4.125 20 0 HIADHN CC(C)N1CC[C@H](NCC(=O)NCc2cccc(Cl)c2)[C@@H]1c1ccc(F)c(F)c1 ZINC000555125205 942392912 /nfs/dbraw/zinc/39/29/12/942392912.db2.gz IIQQUWQCSLQEQM-UNMCSNQZSA-N 0 3 421.919 4.048 20 0 HIADHN COc1cccc([C@@H]2[C@H](NCc3nc4cc(Cl)ccc4c(=O)[nH]3)CCN2C2CC2)c1 ZINC000555130427 942395472 /nfs/dbraw/zinc/39/54/72/942395472.db2.gz TVDVLGBXTRCNLR-DENIHFKCSA-N 0 3 424.932 4.065 20 0 HIADHN CCN1CC[C@H](NCC(=O)N(CC(F)(F)F)C(C)C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000555133073 942397763 /nfs/dbraw/zinc/39/77/63/942397763.db2.gz YZAKXQFKFDMHIV-FUHWJXTLSA-N 0 3 423.882 4.003 20 0 HIADHN CN(C)C[C@H](NC(=O)c1cc2c(C(F)F)nn(C)c2s1)c1ccc(Cl)cc1 ZINC000555231987 942438853 /nfs/dbraw/zinc/43/88/53/942438853.db2.gz JQFLNUVFOQKZIV-ZDUSSCGKSA-N 0 3 412.893 4.259 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@H](N[C@H](CC(C)C)C(=O)Nc2nccs2)c2ccccc21 ZINC000555236189 942440602 /nfs/dbraw/zinc/44/06/02/942440602.db2.gz RVJRIEWHOMORRP-CEXWTWQISA-N 0 3 415.559 4.268 20 0 HIADHN Cc1nc(-c2ccc(CN[C@@H](C)c3ccc(NS(C)(=O)=O)cc3)cc2)cs1 ZINC000555406648 942518418 /nfs/dbraw/zinc/51/84/18/942518418.db2.gz JLNIDIKQKFBUBF-AWEZNQCLSA-N 0 3 401.557 4.341 20 0 HIADHN CSCc1cnc(CNC[C@@H]2CCN(c3ccc(Br)cc3)C2)s1 ZINC000555529180 942628359 /nfs/dbraw/zinc/62/83/59/942628359.db2.gz DKHXIRJXKADABQ-ZDUSSCGKSA-N 0 3 412.422 4.385 20 0 HIADHN Brc1ccccc1N1CC[C@H](NCc2conc2Cc2ccccc2)C1 ZINC000555547041 942636126 /nfs/dbraw/zinc/63/61/26/942636126.db2.gz FUUOISOYGKXRAO-SFHVURJKSA-N 0 3 412.331 4.396 20 0 HIADHN CCOc1cc(CNCc2cc3ccccc3s2)ccc1O[C@@H](C)C(=O)N(C)C ZINC000555592052 942657572 /nfs/dbraw/zinc/65/75/72/942657572.db2.gz JTEJLOZZOUGSDU-INIZCTEOSA-N 0 3 412.555 4.445 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)N1CCC(OC2CCCCC2)CC1 ZINC000555618091 942671704 /nfs/dbraw/zinc/67/17/04/942671704.db2.gz HWELKBSQEGILBC-FQEVSTJZSA-N 0 3 405.608 4.408 20 0 HIADHN O=S(=O)(CCCNCc1cc(Br)cs1)c1ccc(Cl)cc1 ZINC000555644908 942685591 /nfs/dbraw/zinc/68/55/91/942685591.db2.gz PZDCGEFSYGMVNE-UHFFFAOYSA-N 0 3 408.770 4.118 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)[C@@H]1CCC(=O)c2ccccc21 ZINC000555885711 942766397 /nfs/dbraw/zinc/76/63/97/942766397.db2.gz KHYIINYRGPRVBL-DENIHFKCSA-N 0 3 414.509 4.029 20 0 HIADHN Clc1cccc(-n2cc(-c3noc([C@@H]4CCCN(Cc5cccnc5)C4)n3)cn2)c1 ZINC000556007976 942784951 /nfs/dbraw/zinc/78/49/51/942784951.db2.gz GRGUAZTUKVONHU-QGZVFWFLSA-N 0 3 420.904 4.350 20 0 HIADHN Cc1ccc(Cl)cc1NC(=O)[C@H](C)N[C@@H]1CCN(C)[C@@H]1c1ccc(F)c(F)c1 ZINC000556103328 942805831 /nfs/dbraw/zinc/80/58/31/942805831.db2.gz MREODEGKMNJTRZ-CYFNAFFESA-N 0 3 407.892 4.289 20 0 HIADHN O=C(CCc1ccccc1)N1CC[C@H](N[C@@H]2CCc3sc(Br)cc32)C1 ZINC000556104537 942805885 /nfs/dbraw/zinc/80/58/85/942805885.db2.gz YDERSGIHBQPNTE-DOTOQJQBSA-N 0 3 419.388 4.321 20 0 HIADHN CN1CC[C@H](CN[C@@H](c2nc[nH]n2)c2ccc(F)cc2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000556118774 942807459 /nfs/dbraw/zinc/80/74/59/942807459.db2.gz LAIMHLIIQPAMQA-CDHQVMDDSA-N 0 3 417.891 4.108 20 0 HIADHN CN1CC[C@H](CN[C@H](c2nc[nH]n2)c2ccc(F)cc2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000556118776 942807563 /nfs/dbraw/zinc/80/75/63/942807563.db2.gz LAIMHLIIQPAMQA-XPGWFJOJSA-N 0 3 417.891 4.108 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)c1cc(Br)cc2cccnc21 ZINC000556133871 942809663 /nfs/dbraw/zinc/80/96/63/942809663.db2.gz PMDHROZQCOLBGJ-UHFFFAOYSA-N 0 3 418.360 4.263 20 0 HIADHN C[C@H](N[C@H]1CCCN([C@@H](C)c2ccccc2F)C1=O)c1ccc2c(c1)OCCCO2 ZINC000556223963 942821207 /nfs/dbraw/zinc/82/12/07/942821207.db2.gz LVXLXFPQFFMKJK-FIKGOQFSSA-N 0 3 412.505 4.390 20 0 HIADHN C[C@H](NCCCS(=O)(=O)c1ccc(Cl)cc1)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000556260889 942828048 /nfs/dbraw/zinc/82/80/48/942828048.db2.gz MIPIJWCBSUXEMP-AWEZNQCLSA-N 0 3 420.962 4.084 20 0 HIADHN C[C@H](Cn1cc(Br)ccc1=O)N[C@H]1CCCOc2cc(Cl)ccc21 ZINC000556264881 942828677 /nfs/dbraw/zinc/82/86/77/942828677.db2.gz WURSSSYGTBRLJZ-WBMJQRKESA-N 0 3 411.727 4.156 20 0 HIADHN CN(C(=O)c1ccc(NCc2ccc(OCC(F)F)cc2)cc1)[C@H]1CCCN(C)C1 ZINC000556337499 942844661 /nfs/dbraw/zinc/84/46/61/942844661.db2.gz ROTJOILFBMFIJU-FQEVSTJZSA-N 0 3 417.500 4.109 20 0 HIADHN CN(C(=O)c1ccc(NCc2ccc(OCC(F)F)cc2)cc1)[C@@H]1CCCN(C)C1 ZINC000556337500 942844722 /nfs/dbraw/zinc/84/47/22/942844722.db2.gz ROTJOILFBMFIJU-HXUWFJFHSA-N 0 3 417.500 4.109 20 0 HIADHN CN(C(=O)c1ccc(NCc2cccc3c2OC(C)(C)C3)cc1)[C@@H]1CCCN(C)C1 ZINC000556338220 942845386 /nfs/dbraw/zinc/84/53/86/942845386.db2.gz KKAIWZYSKGYZHX-JOCHJYFZSA-N 0 3 407.558 4.178 20 0 HIADHN Cc1ccc2cc(CNCc3cccc(N4C(=O)N[C@](C)(C5CC5)C4=O)c3)ccc2n1 ZINC000556412406 942860318 /nfs/dbraw/zinc/86/03/18/942860318.db2.gz DBMBTCZBEGDJOO-RUZDIDTESA-N 0 3 414.509 4.058 20 0 HIADHN CCC[C@@H](NCC(=O)NCc1c(C)nn(Cc2ccccc2)c1C)c1ccccc1 ZINC000556498465 942885580 /nfs/dbraw/zinc/88/55/80/942885580.db2.gz BPZWEPPOXKHQFN-XMMPIXPASA-N 0 3 404.558 4.295 20 0 HIADHN Cc1cc(-c2noc([C@H](C)NC[C@@H]3CN(Cc4ccccc4)CCCO3)n2)ccc1F ZINC000556503012 942886497 /nfs/dbraw/zinc/88/64/97/942886497.db2.gz YUTSZASVVJJUKU-GHTZIAJQSA-N 0 3 424.520 4.126 20 0 HIADHN O=C(c1ccc(F)cc1)C1CCN(C[C@H]2CN(Cc3ccccc3)CCCO2)CC1 ZINC000556531497 942892879 /nfs/dbraw/zinc/89/28/79/942892879.db2.gz ZZYLPVLOLLCFDK-DEOSSOPVSA-N 0 3 410.533 4.012 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)c2ccc(Cl)cc2Br)cc1 ZINC000556591107 942908315 /nfs/dbraw/zinc/90/83/15/942908315.db2.gz HEHWAZPHZDISDC-KRWDZBQOSA-N 0 3 411.727 4.144 20 0 HIADHN CSc1ccc([C@@H](C)NCc2cccc(N3C(=O)N[C@@](C)(C4CC4)C3=O)c2)cc1 ZINC000556607925 942912761 /nfs/dbraw/zinc/91/27/61/942912761.db2.gz IPMOGPURRLISQX-CMJOXMDJSA-N 0 3 409.555 4.484 20 0 HIADHN Fc1cccc(Cl)c1CN1CCC(NCc2ccn(Cc3ccccc3)n2)CC1 ZINC000556610397 942914999 /nfs/dbraw/zinc/91/49/99/942914999.db2.gz YISZKAGMKMRZGO-UHFFFAOYSA-N 0 3 412.940 4.478 20 0 HIADHN O=C(c1cc(F)cc(C(F)(F)F)c1)N1CCN(c2ccnc3ccccc32)CC1 ZINC000556833538 942937560 /nfs/dbraw/zinc/93/75/60/942937560.db2.gz WMQYSIVZRGMCAE-UHFFFAOYSA-N 0 3 403.379 4.355 20 0 HIADHN Cc1ccnc([C@@H](C)N[C@@H](Cc2cccc(F)c2)CN2C(=O)c3ccccc3C2=O)c1 ZINC000556873753 942946627 /nfs/dbraw/zinc/94/66/27/942946627.db2.gz UHGXWQCOFDMBNV-XLIONFOSSA-N 0 3 417.484 4.087 20 0 HIADHN OC[C@H](CN[C@H](c1ncc[nH]1)C1CCCCC1)Cc1ccccc1Br ZINC000556880105 942948844 /nfs/dbraw/zinc/94/88/44/942948844.db2.gz JFIIRURULOBPLG-KXBFYZLASA-N 0 3 406.368 4.234 20 0 HIADHN CC(C)Cc1cccc([C@H](C)C(=O)NCc2ccccc2CN2CCC(O)CC2)c1 ZINC000556892801 942954231 /nfs/dbraw/zinc/95/42/31/942954231.db2.gz NNQGPHYHYKDPRN-FQEVSTJZSA-N 0 3 408.586 4.262 20 0 HIADHN O=C(NCc1csc(-c2ccco2)n1)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000556919978 942966384 /nfs/dbraw/zinc/96/63/84/942966384.db2.gz RQTQVJGRKGDHMI-KRWDZBQOSA-N 0 3 417.481 4.177 20 0 HIADHN CC(C)(C)N1C[C@@H](C(=O)Nc2ccc3c(c2)C(=O)CC(C)(C)O3)[C@H](C(F)(F)F)C1 ZINC000556931555 942971700 /nfs/dbraw/zinc/97/17/00/942971700.db2.gz FOTLEPFKIUEXCY-HUUCEWRRSA-N 0 3 412.452 4.278 20 0 HIADHN COc1cc(CNCCC(=O)Nc2cc(Cl)cc(Cl)c2)cc(OC)c1OC ZINC000556949757 942977691 /nfs/dbraw/zinc/97/76/91/942977691.db2.gz CIHUCNAJBVXZSQ-UHFFFAOYSA-N 0 3 413.301 4.138 20 0 HIADHN CCCN(C)[C@H](CNC(=O)CCc1nc(-c2ccoc2)no1)c1ccc(Cl)cc1 ZINC000557059433 943007605 /nfs/dbraw/zinc/00/76/05/943007605.db2.gz RTMZOYSCZJBCFE-GOSISDBHSA-N 0 3 416.909 4.115 20 0 HIADHN COCCCN(C(=O)c1cnc(OC2CCCCC2)c(Cl)c1)C1CCN(C)CC1 ZINC000557218343 943055095 /nfs/dbraw/zinc/05/50/95/943055095.db2.gz CWCQTRMIWIFJTI-UHFFFAOYSA-N 0 3 423.985 4.019 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)c1c(C)nn2c1nc(C)cc2C)c1ccc(Cl)cc1 ZINC000557336825 943076680 /nfs/dbraw/zinc/07/66/80/943076680.db2.gz QXCMOUYXFHGUMW-IBGZPJMESA-N 0 3 413.953 4.121 20 0 HIADHN COCCC[C@H](CNC(=O)CC1(N2CCOCC2)CCCC1)c1ccc(Cl)cc1 ZINC000557341065 943078737 /nfs/dbraw/zinc/07/87/37/943078737.db2.gz AWXASYOPEYSKCS-HXUWFJFHSA-N 0 3 422.997 4.002 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1ccc2[nH]cnc2c1)c1ccc(C(F)(F)F)cc1 ZINC000557342358 943079185 /nfs/dbraw/zinc/07/91/85/943079185.db2.gz CFSCJNVQGWJVTI-LJQANCHMSA-N 0 3 404.436 4.395 20 0 HIADHN CCCN(CCN(C)C)C(=O)c1nn(-c2ccc(Cl)cc2Cl)c2c1CCC2 ZINC000557358502 943085192 /nfs/dbraw/zinc/08/51/92/943085192.db2.gz KDJLVNGVHXVJSY-UHFFFAOYSA-N 0 3 409.361 4.082 20 0 HIADHN CN(C)CCN(C(=O)c1ccc2c(c1)nc(Cc1cccs1)n2C)c1ccccc1 ZINC000557470751 943149745 /nfs/dbraw/zinc/14/97/45/943149745.db2.gz CTRBMKMEWNGUJL-UHFFFAOYSA-N 0 3 418.566 4.434 20 0 HIADHN O=C(CCC(F)(F)F)N1CCC[C@@H](NCc2ccccc2OCc2cccnc2)C1 ZINC000557499204 943169834 /nfs/dbraw/zinc/16/98/34/943169834.db2.gz CMDQWULYEBYPAW-LJQANCHMSA-N 0 3 421.463 4.084 20 0 HIADHN COc1ccc([C@@H](Cc2ccc(F)cc2)N[C@H](C)C(=O)NCc2ccccc2)cc1 ZINC000557513036 943180311 /nfs/dbraw/zinc/18/03/11/943180311.db2.gz XSTFBNKAORMRJE-HOYKHHGWSA-N 0 3 406.501 4.413 20 0 HIADHN O=C(NCCc1ccc(F)cc1F)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000557698847 943261982 /nfs/dbraw/zinc/26/19/82/943261982.db2.gz CQVBLKUNFFKETQ-HXUWFJFHSA-N 0 3 412.402 4.078 20 0 HIADHN Cc1ccccc1[C@@H](OC[C@@H](O)CN1CC[C@@H](Oc2ccncc2)C1)c1ccccc1 ZINC000557700838 943263199 /nfs/dbraw/zinc/26/31/99/943263199.db2.gz IUTDIDXULRYOPB-FBILRYNDSA-N 0 3 418.537 4.010 20 0 HIADHN O=C1NC(=O)C2(CCC(N[C@H](c3ccc(Cl)cc3)c3ccccc3Cl)CC2)N1 ZINC000557831167 943306504 /nfs/dbraw/zinc/30/65/04/943306504.db2.gz PLFLDSMFBVLARQ-BPVAQJAMSA-N 0 3 418.324 4.193 20 0 HIADHN COC1(CNC(=O)[C@@H]2CCCN(Cc3cccnc3)C2)CCC(c2ccccc2)CC1 ZINC000557961518 943340443 /nfs/dbraw/zinc/34/04/43/943340443.db2.gz RMZCDBPWNLQANW-MYIFBMMKSA-N 0 3 421.585 4.153 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c2sc(C(=O)N3CC[C@H](N4CCCC4)[C@H]3C)cc12 ZINC000558017050 943356358 /nfs/dbraw/zinc/35/63/58/943356358.db2.gz XHIPVTOYHXBQGG-BEFAXECRSA-N 0 3 412.534 4.233 20 0 HIADHN CCc1onc(-c2ccccc2Cl)c1C(=O)N1CCN([C@@H]2C[C@@H]2C)C[C@@H](C)C1 ZINC000558027640 943360514 /nfs/dbraw/zinc/36/05/14/943360514.db2.gz RKCAMMYJXJVZED-RVKKMQEKSA-N 0 3 401.938 4.360 20 0 HIADHN CCc1onc(-c2ccccc2Cl)c1C(=O)N1CCN([C@@H]2C[C@H]2C)C[C@H](C)C1 ZINC000558027637 943360530 /nfs/dbraw/zinc/36/05/30/943360530.db2.gz RKCAMMYJXJVZED-HDMKZQKVSA-N 0 3 401.938 4.360 20 0 HIADHN C[C@H]1C[C@@H]1N1CCN(C(=O)C2(Cc3ccc(OC(F)(F)F)cc3)CC2)C[C@@H](C)C1 ZINC000558027726 943361176 /nfs/dbraw/zinc/36/11/76/943361176.db2.gz SUYJRCBCTJUGNG-BXWFABGCSA-N 0 3 410.480 4.097 20 0 HIADHN C[C@H](N[C@@H]1CCCN(C(=O)CCC(F)(F)F)C1)c1ccc(F)cc1OC(F)F ZINC000558255101 943462492 /nfs/dbraw/zinc/46/24/92/943462492.db2.gz MRENFXHXVPMKGR-WCQYABFASA-N 0 3 412.374 4.411 20 0 HIADHN C[C@@H](N[C@@H]1CCCN(S(=O)(=O)c2cccs2)C1)c1ccccc1C(F)(F)F ZINC000558259639 943464060 /nfs/dbraw/zinc/46/40/60/943464060.db2.gz UQBRVYPVFFSAEK-ZIAGYGMSSA-N 0 3 418.506 4.271 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)N[C@@H]1CC[C@H](c2ccccc2)C[C@@H]1OC ZINC000558278362 943478728 /nfs/dbraw/zinc/47/87/28/943478728.db2.gz PEAGLYPIJCLSFA-MZKRTTBSSA-N 0 3 411.546 4.230 20 0 HIADHN CCCN(C)[C@H](CNC(=O)Nc1ccc(C(=O)NCC)cc1)c1ccc(Cl)cc1 ZINC000558291612 943487032 /nfs/dbraw/zinc/48/70/32/943487032.db2.gz KARXOWIUNYWYDX-HXUWFJFHSA-N 0 3 416.953 4.294 20 0 HIADHN COCc1c(Br)cccc1NC(=O)N[C@H](CN(C)C)c1ccc(F)cc1 ZINC000558315386 943501582 /nfs/dbraw/zinc/50/15/82/943501582.db2.gz HSAPYEWKMNNKIA-GOSISDBHSA-N 0 3 424.314 4.159 20 0 HIADHN CCOCCOc1ccc(Cl)cc1NC(=O)N[C@H](CN(C)C)c1ccc(F)cc1 ZINC000558321051 943506483 /nfs/dbraw/zinc/50/64/83/943506483.db2.gz AUMASPFKFVPMAM-LJQANCHMSA-N 0 3 423.916 4.319 20 0 HIADHN CC1CCN([C@H](CNC(=O)N2CCCC[C@@H]2c2cc[nH]n2)c2cccs2)CC1 ZINC000558381233 943537155 /nfs/dbraw/zinc/53/71/55/943537155.db2.gz LSCFHCNBMDJZET-RTBURBONSA-N 0 3 401.580 4.181 20 0 HIADHN O=C(NC[C@H](c1c[nH]c2ccccc21)c1ccccc1Cl)N1CCN2CCC1CC2 ZINC000558383322 943538578 /nfs/dbraw/zinc/53/85/78/943538578.db2.gz ZGBUUMJNOHIAKR-FQEVSTJZSA-N 0 3 422.960 4.443 20 0 HIADHN C[C@H](N[C@@H]1CCN(C)[C@@H]1c1ccc(Cl)cc1)C(=O)Nc1cccc2ncccc21 ZINC000558467558 943567753 /nfs/dbraw/zinc/56/77/53/943567753.db2.gz SGZKOYHQXYJKSR-ITEAAPOESA-N 0 3 408.933 4.250 20 0 HIADHN C[C@H](C(=O)NC[C@@H]1CCO[C@H]1c1ccccc1)N1CCC(Cc2ccccc2)CC1 ZINC000558597221 943613299 /nfs/dbraw/zinc/61/32/99/943613299.db2.gz QQTLCJJYLLREKJ-YNJKOYDBSA-N 0 3 406.570 4.224 20 0 HIADHN C[C@H](C(=O)NC[C@H]1CCO[C@H]1c1ccccc1)N1CCC(Cc2ccccc2)CC1 ZINC000558597223 943613442 /nfs/dbraw/zinc/61/34/42/943613442.db2.gz QQTLCJJYLLREKJ-ZPZUNKDASA-N 0 3 406.570 4.224 20 0 HIADHN CC[C@H](N[C@H](C)c1ccc(Br)cn1)[C@@H]1CN(Cc2ccccc2)CCO1 ZINC000558741182 943636750 /nfs/dbraw/zinc/63/67/50/943636750.db2.gz VWECNBUSAAHTBL-PBEJRMEISA-N 0 3 418.379 4.174 20 0 HIADHN Cc1ccc2c(CN(CCO)Cc3cc(Br)cs3)ccc(O)c2n1 ZINC000558743708 943637968 /nfs/dbraw/zinc/63/79/68/943637968.db2.gz YHPYXOBVLAQKRA-UHFFFAOYSA-N 0 3 407.333 4.067 20 0 HIADHN CN(C)CCN(C[C@@H]1CCCO1)C(=O)Nc1ccc(-c2ccc(Cl)s2)nc1 ZINC000558845174 943694016 /nfs/dbraw/zinc/69/40/16/943694016.db2.gz QJPNMZCRKMJKMJ-HNNXBMFYSA-N 0 3 408.955 4.038 20 0 HIADHN CC(C)c1noc(Cc2ccc(NC(=O)NC[C@@H](C)N(C)Cc3ccccc3)cc2)n1 ZINC000558847055 943696759 /nfs/dbraw/zinc/69/67/59/943696759.db2.gz MIAMTVPMLCYSMI-GOSISDBHSA-N 0 3 421.545 4.426 20 0 HIADHN CC(C)C(=O)c1ccc([C@@H](C)C(=O)Nc2cccc(CN3CCC(CO)CC3)c2)cc1 ZINC000558848765 943698001 /nfs/dbraw/zinc/69/80/01/943698001.db2.gz VBHUPMNVPXLFRW-LJQANCHMSA-N 0 3 422.569 4.472 20 0 HIADHN COc1cccc([C@H]2[C@H](NCC(=O)Nc3cccc4ccccc43)CCN2C2CC2)c1 ZINC000558894288 943727708 /nfs/dbraw/zinc/72/77/08/943727708.db2.gz GLNIHMNURPXOKB-RSXGOPAZSA-N 0 3 415.537 4.355 20 0 HIADHN COc1cccc([C@@H]2[C@@H](N[C@@H](C)C(=O)Nc3cc(F)ccc3C)CCN2C2CC2)c1 ZINC000558897046 943730961 /nfs/dbraw/zinc/73/09/61/943730961.db2.gz NVCJALHCYBOFSZ-JFJYTDJESA-N 0 3 411.521 4.037 20 0 HIADHN CCc1cccc(C)c1NC(=O)CN[C@H]1CCN(C2CC2)[C@@H]1c1cccc(OC)c1 ZINC000558902616 943737555 /nfs/dbraw/zinc/73/75/55/943737555.db2.gz SAWDISOOEJYHJM-WIOPSUGQSA-N 0 3 407.558 4.072 20 0 HIADHN CCN(CC)[C@H](CNC(=O)[C@@H](C)Cc1cnc2ccccc2n1)c1cccc(OC)c1 ZINC000558932142 943753636 /nfs/dbraw/zinc/75/36/36/943753636.db2.gz SYGWNENFTIEGAZ-MHECFPHRSA-N 0 3 420.557 4.016 20 0 HIADHN CN(C)C[C@@H](NC(=O)NC[C@H]1CCCN(c2ccccc2)C1)c1ccc(Cl)cc1 ZINC000558950447 943768675 /nfs/dbraw/zinc/76/86/75/943768675.db2.gz OQQOESXXNFXAOJ-XMSQKQJNSA-N 0 3 414.981 4.159 20 0 HIADHN C[C@H](C(=O)NCCCCN1CCN(c2cccc(C(F)(F)F)c2)CC1)C(C)(F)F ZINC000559021406 943807500 /nfs/dbraw/zinc/80/75/00/943807500.db2.gz AXKITZLOXBYJSB-OAHLLOKOSA-N 0 3 421.454 4.015 20 0 HIADHN CC(=O)NCCN(CC1=Cc2cc(Cl)cc(Cl)c2OC1)C1CCSCC1 ZINC000559096125 943836914 /nfs/dbraw/zinc/83/69/14/943836914.db2.gz PGLOIYIEQCGHBQ-UHFFFAOYSA-N 0 3 415.386 4.103 20 0 HIADHN COCCc1ccc(OC[C@@H](O)CN2CC=C(c3c(C)[nH]c4ccccc43)CC2)cc1 ZINC000559144541 943853418 /nfs/dbraw/zinc/85/34/18/943853418.db2.gz PNWRLDQSZLREAC-QFIPXVFZSA-N 0 3 420.553 4.194 20 0 HIADHN Cc1nc2ccccc2n1C1CCN([C@H]2CCN([C@H](C)c3ccc(F)cc3)C2=O)CC1 ZINC000559185839 943865153 /nfs/dbraw/zinc/86/51/53/943865153.db2.gz HBHZBGACNVIJEZ-OSPHWJPCSA-N 0 3 420.532 4.483 20 0 HIADHN Cc1nc2ccccc2n1C1CCN([C@@H]2CCN([C@H](C)c3ccc(F)cc3)C2=O)CC1 ZINC000559185838 943865280 /nfs/dbraw/zinc/86/52/80/943865280.db2.gz HBHZBGACNVIJEZ-MZNJEOGPSA-N 0 3 420.532 4.483 20 0 HIADHN C[C@@H]1CN(Cc2ccc(CNCc3conc3Cc3ccccc3)cc2)C[C@@H](C)O1 ZINC000559245204 943885274 /nfs/dbraw/zinc/88/52/74/943885274.db2.gz VDERHVMRGCBMOE-WOJBJXKFSA-N 0 3 405.542 4.164 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@@H](O)C2)c1)c1ccc(Oc2ccccc2Cl)nc1 ZINC000559249238 943885879 /nfs/dbraw/zinc/88/58/79/943885879.db2.gz UJEIXRLRPDCFCC-LJQANCHMSA-N 0 3 423.900 4.346 20 0 HIADHN Cc1ccc([C@H](CNCc2c(Cl)cccc2N2CCOCC2)N2CCCC2)o1 ZINC000559260272 943886936 /nfs/dbraw/zinc/88/69/36/943886936.db2.gz WGRQPUWYUKRENQ-NRFANRHFSA-N 0 3 403.954 4.005 20 0 HIADHN Cc1csc(CCCC(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)n1 ZINC000559268280 943888043 /nfs/dbraw/zinc/88/80/43/943888043.db2.gz YUYMZFSXAZRITN-UHFFFAOYSA-N 0 3 413.509 4.383 20 0 HIADHN CCc1nc2ccccc2c(C(=O)N2CCC(CN3C[C@@H](C)O[C@H](C)C3)CC2)c1C ZINC000559279389 943889523 /nfs/dbraw/zinc/88/95/23/943889523.db2.gz WOCGCIYMGLMFIJ-QZTJIDSGSA-N 0 3 409.574 4.067 20 0 HIADHN CCS(=O)(=O)c1ccc([C@@H](C)N[C@H](C)c2ccc(NC(=O)NC(C)C)cc2)cc1 ZINC000559421233 943944359 /nfs/dbraw/zinc/94/43/59/943944359.db2.gz WCAVBSQXZYSVIY-IAGOWNOFSA-N 0 3 417.575 4.422 20 0 HIADHN CCOc1cc(CNCc2ccccc2N2CCO[C@@H](C)C2)ccc1OC(F)F ZINC000559601551 944015364 /nfs/dbraw/zinc/01/53/64/944015364.db2.gz ZCOZEUFYRZNKBQ-INIZCTEOSA-N 0 3 406.473 4.202 20 0 HIADHN CN(C)Cc1ccc(-c2noc([C@@H]3CC(=O)N(C)[C@H]3c3cccc(Cl)c3)n2)cc1 ZINC000559740061 944042447 /nfs/dbraw/zinc/04/24/47/944042447.db2.gz RUTROAAUBIOZLW-QUCCMNQESA-N 0 3 410.905 4.139 20 0 HIADHN NS(=O)(=O)c1ccc2c(c1)CCC[C@@H]2N[C@H]1CC2(CCCC2)Oc2ccccc21 ZINC000559785124 944050215 /nfs/dbraw/zinc/05/02/15/944050215.db2.gz MEIXMVBDKWFBER-SFTDATJTSA-N 0 3 412.555 4.138 20 0 HIADHN CN1CC[C@@H](NCC(=O)Nc2ccc3c(c2)OC2(CCCCC2)O3)[C@@H]1c1ccccc1 ZINC000559791103 944050758 /nfs/dbraw/zinc/05/07/58/944050758.db2.gz NSNZCXLVPCNRNZ-YKSBVNFPSA-N 0 3 421.541 4.092 20 0 HIADHN COc1ccc([C@@H]2CCCCCN2C(=O)CN2CCN(CCC(C)(C)C)CC2)cc1 ZINC000559869277 944071029 /nfs/dbraw/zinc/07/10/29/944071029.db2.gz ZMTZJQAMVRMRRA-QHCPKHFHSA-N 0 3 415.622 4.193 20 0 HIADHN COCCOc1ccc([C@H](C)N[C@@H]2CCCN([C@H](C)c3ccccc3F)C2=O)cc1 ZINC000559878873 944073030 /nfs/dbraw/zinc/07/30/30/944073030.db2.gz OKLXKHIXBOREBR-YZZKKUAISA-N 0 3 414.521 4.254 20 0 HIADHN COCCOc1ccc([C@H](C)N[C@H]2CCCN([C@H](C)c3ccc(F)cc3)C2=O)cc1 ZINC000559899155 944080229 /nfs/dbraw/zinc/08/02/29/944080229.db2.gz KSWDFZAZPJNAKL-IXFSTUDKSA-N 0 3 414.521 4.254 20 0 HIADHN CCc1noc(C)c1-c1noc([C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)n1 ZINC000559915014 944083721 /nfs/dbraw/zinc/08/37/21/944083721.db2.gz IKUKVEKIXKTOOH-LJQANCHMSA-N 0 3 406.408 4.301 20 0 HIADHN COc1cc(C)c([C@H](C)NCCCS(=O)(=O)c2ccc(Cl)cc2)cc1OC ZINC000559917986 944084734 /nfs/dbraw/zinc/08/47/34/944084734.db2.gz CWQHQSIWAPWLBF-HNNXBMFYSA-N 0 3 411.951 4.180 20 0 HIADHN C[C@@H]1CCN(C(=O)C2(Cc3cccc(F)c3)CCOCC2)CCN1Cc1ccccc1 ZINC000560082374 944151928 /nfs/dbraw/zinc/15/19/28/944151928.db2.gz BAOCVJYXHOEOFX-OAQYLSRUSA-N 0 3 424.560 4.288 20 0 HIADHN COCC[C@@H](NC(=O)N[C@H](C)C1=CCN(C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000560103715 944160639 /nfs/dbraw/zinc/16/06/39/944160639.db2.gz UTRRZLVUWRNMPT-FZKQIMNGSA-N 0 3 400.350 4.021 20 0 HIADHN CC(C)N(C(=O)CN[C@H](c1cccc(C(F)(F)F)c1)C1CCOCC1)C(C)C ZINC000560179609 944188320 /nfs/dbraw/zinc/18/83/20/944188320.db2.gz RMTXKGSEHFZLPO-FQEVSTJZSA-N 0 3 400.485 4.408 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)[C@H]2C[C@H]2c2ccccc2C(F)(F)F)cc1 ZINC000560245935 944206069 /nfs/dbraw/zinc/20/60/69/944206069.db2.gz MXDMRYYEQUIKBI-BJLQDIEVSA-N 0 3 406.448 4.237 20 0 HIADHN COc1cccc2c1CCC[C@H]2NCc1cccc(N2C(=O)N[C@](C)(C3CC3)C2=O)c1 ZINC000560265195 944211453 /nfs/dbraw/zinc/21/14/53/944211453.db2.gz GHCJPFWNGXNTGW-PXDATVDWSA-N 0 3 419.525 4.087 20 0 HIADHN C[C@H](N[C@@H](c1cncc(Br)c1)C1CC1)c1ccc(NS(C)(=O)=O)cc1 ZINC000560268040 944213530 /nfs/dbraw/zinc/21/35/30/944213530.db2.gz IMJOPGOGMKEGQP-KPZWWZAWSA-N 0 3 424.364 4.018 20 0 HIADHN C[C@@H]1Cc2ccc(F)cc2[C@@H]1NCc1cccc(N2C(=O)N[C@@](C)(C3CC3)C2=O)c1 ZINC000560269672 944214258 /nfs/dbraw/zinc/21/42/58/944214258.db2.gz WSISLSAGCDYCMN-CGOGNOBXSA-N 0 3 407.489 4.074 20 0 HIADHN CC(C)([C@H](NC(=O)[C@@H]1CCc2cccc(O)c21)c1ccc(F)c(F)c1)N1CCCC1 ZINC000560366998 944228766 /nfs/dbraw/zinc/22/87/66/944228766.db2.gz YRKXYQCBXRFQGG-VGOFRKELSA-N 0 3 414.496 4.432 20 0 HIADHN Cc1ccc(CN2CC[C@@H](CN(C)C(=O)CCC(=O)c3ccc4c(c3)CCC4)C2)s1 ZINC000560482175 944236203 /nfs/dbraw/zinc/23/62/03/944236203.db2.gz LBJVIVQQAXAWEU-IBGZPJMESA-N 0 3 424.610 4.489 20 0 HIADHN CN(CCCN(C)Cc1nnc(-c2cc3c(s2)CCCC3)o1)Cc1ccco1 ZINC000560538460 944247013 /nfs/dbraw/zinc/24/70/13/944247013.db2.gz INKQRMSHLVEPPF-UHFFFAOYSA-N 0 3 400.548 4.224 20 0 HIADHN CO[C@@H]1C[C@H](c2ccccc2)CC[C@H]1N[C@@H](C)CS(=O)(=O)c1ccc(C)cc1 ZINC000560576547 944260339 /nfs/dbraw/zinc/26/03/39/944260339.db2.gz ZZTUECREKKCSLY-CVNLYIMZSA-N 0 3 401.572 4.098 20 0 HIADHN COc1ccc2cc([C@H](C)C(=O)N(C)CCCN(C)Cc3ccncc3)ccc2c1 ZINC000560596324 944268613 /nfs/dbraw/zinc/26/86/13/944268613.db2.gz NNWFUNOCDUGNNK-IBGZPJMESA-N 0 3 405.542 4.327 20 0 HIADHN COc1cccc(CCC(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)c1F ZINC000560598393 944269500 /nfs/dbraw/zinc/26/95/00/944269500.db2.gz PYJQAFFYXYXGRT-HXUWFJFHSA-N 0 3 422.504 4.049 20 0 HIADHN CCc1[nH]ccc1C(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1 ZINC000560620889 944276331 /nfs/dbraw/zinc/27/63/31/944276331.db2.gz MPSSWERTQCNULN-UHFFFAOYSA-N 0 3 402.542 4.194 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)[C@H]1C[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000560676598 944291008 /nfs/dbraw/zinc/29/10/08/944291008.db2.gz PPRGKCQDBFRQDS-ZCNNSNEGSA-N 0 3 404.432 4.014 20 0 HIADHN COC[C@H](C)Nc1ccccc1NC(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000560699248 944299676 /nfs/dbraw/zinc/29/96/76/944299676.db2.gz MKBSCWVOOAYPIP-PKOBYXMFSA-N 0 3 417.500 4.229 20 0 HIADHN COC[C@@H](C)Nc1ccccc1NC(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000560699247 944300309 /nfs/dbraw/zinc/30/03/09/944300309.db2.gz MKBSCWVOOAYPIP-MJGOQNOKSA-N 0 3 417.500 4.229 20 0 HIADHN CCCN(C)[C@H](CNC(=O)c1cc(OC)c(OC)cc1OC)c1ccc(Cl)cc1 ZINC000560708672 944302951 /nfs/dbraw/zinc/30/29/51/944302951.db2.gz MFYGYQHIVGWWMO-GOSISDBHSA-N 0 3 420.937 4.179 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)Cc1ccccc1NC(C)=O)c1ccc(Cl)cc1 ZINC000560709739 944303737 /nfs/dbraw/zinc/30/37/37/944303737.db2.gz PYDIPDWDRDFYTF-NRFANRHFSA-N 0 3 401.938 4.040 20 0 HIADHN CCCN(C)[C@H](CNC(=O)c1cc2ccccc2c(=O)n1C)c1ccc(Cl)cc1 ZINC000560710830 944304603 /nfs/dbraw/zinc/30/46/03/944304603.db2.gz XANAWJPBOYPHEO-OAQYLSRUSA-N 0 3 411.933 4.005 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)c1cccc(C(=O)NC2CC2)c1)c1ccc(Cl)cc1 ZINC000560710848 944305251 /nfs/dbraw/zinc/30/52/51/944305251.db2.gz XQXGNFXSCZGGOW-NRFANRHFSA-N 0 3 413.949 4.045 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)N1CC[C@](F)(c2cc(F)cc(F)c2)C1 ZINC000560826610 944348482 /nfs/dbraw/zinc/34/84/82/944348482.db2.gz FYJDJQWWASONES-JOCHJYFZSA-N 0 3 402.416 4.484 20 0 HIADHN CCc1cnccc1[C@H](C)NC(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1 ZINC000561014513 944396632 /nfs/dbraw/zinc/39/66/32/944396632.db2.gz AYANBNFXJPXVDI-INIZCTEOSA-N 0 3 422.495 4.497 20 0 HIADHN O=C1NC(CC(F)(F)F)C(=O)N1c1ccc(-c2ccc(Cl)cc2Cl)nc1 ZINC000561058692 944421351 /nfs/dbraw/zinc/42/13/51/944421351.db2.gz SIRHHBNNHANWBV-ZDUSSCGKSA-N 0 3 404.175 4.433 20 0 HIADHN O=C(CCc1cccnc1)N(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000561073981 944429077 /nfs/dbraw/zinc/42/90/77/944429077.db2.gz DYUKVDGGWXETIL-RUZDIDTESA-N 0 3 414.553 4.103 20 0 HIADHN Cc1ccc(CC(=O)N(Cc2ccncc2)[C@@H]2CCCN(Cc3ccccc3)C2)o1 ZINC000561075649 944431001 /nfs/dbraw/zinc/43/10/01/944431001.db2.gz TZACGLGIQGKMCH-HSZRJFAPSA-N 0 3 403.526 4.219 20 0 HIADHN CCCN(CCN1CCCC1)C(=O)c1cnn(-c2cccc(C(F)(F)F)c2)c1C ZINC000561200561 944512030 /nfs/dbraw/zinc/51/20/30/944512030.db2.gz IXIDNULGJFNOLX-UHFFFAOYSA-N 0 3 408.468 4.148 20 0 HIADHN CCCN(CCN1CCCC1)C(=O)CSc1nnc(-c2ccc3ccccc3c2)o1 ZINC000561201829 944513154 /nfs/dbraw/zinc/51/31/54/944513154.db2.gz MHDBPSLPAMCCEH-UHFFFAOYSA-N 0 3 424.570 4.316 20 0 HIADHN Cc1noc([C@@H]2CC[C@H](CNc3c(C)c(C)nc4ccc(Br)cc43)O2)n1 ZINC000561304395 944544635 /nfs/dbraw/zinc/54/46/35/944544635.db2.gz ASIHJUUIVZGPMK-PBHICJAKSA-N 0 3 417.307 4.060 20 0 HIADHN CCOc1ccc(CN(CCCn2ccnc2)Cc2cnc3cccc(C)n23)cc1 ZINC000561397690 944579169 /nfs/dbraw/zinc/57/91/69/944579169.db2.gz JNDXVBAXFDSUHU-UHFFFAOYSA-N 0 3 403.530 4.330 20 0 HIADHN CN(CCCN(C)c1cc(C(F)(F)F)nc(-c2cccnc2)n1)Cc1ccco1 ZINC000561434639 944595689 /nfs/dbraw/zinc/59/56/89/944595689.db2.gz AYSVXPIJIXMMEL-UHFFFAOYSA-N 0 3 405.424 4.109 20 0 HIADHN Cc1nn(CC(=O)OC(C)C)c(C)c1CNC(C)(C)c1cccc(C(F)(F)F)c1 ZINC000561476198 944622188 /nfs/dbraw/zinc/62/21/88/944622188.db2.gz PXUYTMLGNVYICS-UHFFFAOYSA-N 0 3 411.468 4.495 20 0 HIADHN CCSc1ccc(-c2nn(-c3ccccc3)cc2CNC[C@H](O)C(F)F)cc1 ZINC000561527624 944656623 /nfs/dbraw/zinc/65/66/23/944656623.db2.gz IWPRENZMAYUJNO-IBGZPJMESA-N 0 3 403.498 4.367 20 0 HIADHN Cc1ccccc1Nc1nc(CN2CCC(CCN3CCOCC3)CC2)cs1 ZINC000561585339 944690416 /nfs/dbraw/zinc/69/04/16/944690416.db2.gz PSVMMPRLMZXJEG-UHFFFAOYSA-N 0 3 400.592 4.129 20 0 HIADHN CCCN(C)[C@H](CNC(=O)NCc1nnc(C(C)(C)C)s1)c1ccc(Cl)cc1 ZINC000561600237 944697801 /nfs/dbraw/zinc/69/78/01/944697801.db2.gz FZLWMNWOJKJODF-MRXNPFEDSA-N 0 3 424.014 4.371 20 0 HIADHN CN(C)C[C@@H](NC(=O)c1cccc(-n2ccc(C(F)(F)F)n2)c1)c1ccc(F)cc1 ZINC000561621236 944712770 /nfs/dbraw/zinc/71/27/70/944712770.db2.gz MWMICGQENIYMKZ-GOSISDBHSA-N 0 3 420.410 4.063 20 0 HIADHN FC(F)(F)c1ccn([C@H]2CCCN(Cc3ccc(OC[C@H]4CCCO4)cc3)C2)n1 ZINC000561625188 944715227 /nfs/dbraw/zinc/71/52/27/944715227.db2.gz CQJFFGOFLQSCQQ-PKOBYXMFSA-N 0 3 409.452 4.297 20 0 HIADHN CSc1ccc([C@@H](CNC(=O)c2c(C)nn(Cc3ccccc3)c2C)N(C)C)cc1 ZINC000561726017 944765720 /nfs/dbraw/zinc/76/57/20/944765720.db2.gz BBNQUOCKESHTQG-JOCHJYFZSA-N 0 3 422.598 4.303 20 0 HIADHN C[C@H]1[C@H](N2CCCC2)CCN1C(=O)c1cc2sc(Nc3ccccc3)nc2s1 ZINC000561753387 944779476 /nfs/dbraw/zinc/77/94/76/944779476.db2.gz KBUFGKLIMFBUMZ-GOEBONIOSA-N 0 3 412.584 4.800 20 0 HIADHN CC(C)CC(=O)Nc1ccc(Cl)c(C(=O)N2CCN([C@@H]3C[C@H]3C)C[C@@H](C)C2)c1 ZINC000561762569 944784889 /nfs/dbraw/zinc/78/48/89/944784889.db2.gz VOJXBPNSYOSEOU-JXXFODFXSA-N 0 3 405.970 4.127 20 0 HIADHN C[C@H]1C[C@@H]1N1CCN(C(=O)c2ccoc2CN2c3ccccc3C[C@@H]2C)C[C@@H](C)C1 ZINC000561762779 944785119 /nfs/dbraw/zinc/78/51/19/944785119.db2.gz XNISRXBUDIMXEX-KGYLXKDPSA-N 0 3 407.558 4.033 20 0 HIADHN C[C@@H]1C[C@H]1N1CCN(C(=O)c2ccoc2CN2c3ccccc3C[C@@H]2C)C[C@@H](C)C1 ZINC000561762782 944785609 /nfs/dbraw/zinc/78/56/09/944785609.db2.gz XNISRXBUDIMXEX-QPXQOZNCSA-N 0 3 407.558 4.033 20 0 HIADHN COc1ccc(Br)c(NC(=O)N[C@@H]2CCN(Cc3ccccc3)[C@@H]2C)c1 ZINC000561799522 944800939 /nfs/dbraw/zinc/80/09/39/944800939.db2.gz NSTNGYFTUZPTKV-RDTXWAMCSA-N 0 3 418.335 4.242 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)Nc1cccc(OCc2cscn2)c1 ZINC000561800803 944802410 /nfs/dbraw/zinc/80/24/10/944802410.db2.gz XYEAKWSGWJDJRT-QGZVFWFLSA-N 0 3 410.543 4.364 20 0 HIADHN COc1ccc2ccccc2c1-c1cc(CN2CCC[C@H](CCNC(C)=O)C2)on1 ZINC000561928753 944861658 /nfs/dbraw/zinc/86/16/58/944861658.db2.gz QDKIOMTUAOURKX-GOSISDBHSA-N 0 3 407.514 4.242 20 0 HIADHN CCOC(=O)COc1c(Br)cc(C)cc1CNCC1(C(F)(F)F)CC1 ZINC000561974022 944881872 /nfs/dbraw/zinc/88/18/72/944881872.db2.gz LODXLBADXXHZJE-UHFFFAOYSA-N 0 3 424.257 4.132 20 0 HIADHN COC(=O)c1cccc(NC2CCN(Cc3ccc4c(c3)COC(C)(C)O4)CC2)c1 ZINC000561975218 944883043 /nfs/dbraw/zinc/88/30/43/944883043.db2.gz APXLXTOIVTXITP-UHFFFAOYSA-N 0 3 410.514 4.195 20 0 HIADHN C[C@@H]1CCc2c(sc3nc(CCN4CCC(OC5CCCC5)CC4)nc(N)c32)C1 ZINC000561998531 944889900 /nfs/dbraw/zinc/88/99/00/944889900.db2.gz KFLFUZWZHGJUFH-OAHLLOKOSA-N 0 3 414.619 4.364 20 0 HIADHN COc1cc([C@@H](C)NC[C@@H]2CCN(c3cccc(Br)c3)C2)c(F)cn1 ZINC000562018923 944897041 /nfs/dbraw/zinc/89/70/41/944897041.db2.gz YSIFQOLUQZOHJW-KGLIPLIRSA-N 0 3 408.315 4.169 20 0 HIADHN CC[C@@H]1CN(C(=O)Nc2ccccc2CN(C)C2CCCCC2)C[C@H](C)[S@]1=O ZINC000562018646 944897083 /nfs/dbraw/zinc/89/70/83/944897083.db2.gz CCSDXSJKFVEMNR-AZVSZNIFSA-N 0 3 405.608 4.214 20 0 HIADHN COc1cc([C@@H](C)NC[C@H]2CCN(c3cccc(Br)c3)C2)c(F)cn1 ZINC000562018927 944897095 /nfs/dbraw/zinc/89/70/95/944897095.db2.gz YSIFQOLUQZOHJW-ZIAGYGMSSA-N 0 3 408.315 4.169 20 0 HIADHN COc1ccc(Oc2cc(CN[C@@H](C)c3cccc(-n4ccnn4)c3)ccn2)cc1 ZINC000562018624 944897337 /nfs/dbraw/zinc/89/73/37/944897337.db2.gz BPMJHGDMDRMPDB-KRWDZBQOSA-N 0 3 401.470 4.314 20 0 HIADHN C[C@H](N[C@@H]1CCCN(S(=O)(=O)c2cccs2)C1)c1cccc(C(F)(F)F)c1 ZINC000562055352 944914541 /nfs/dbraw/zinc/91/45/41/944914541.db2.gz WBLAZPADSPSGDH-XJKSGUPXSA-N 0 3 418.506 4.271 20 0 HIADHN O=C1[C@@H](N[C@@H]2c3ccccc3CC23CCOCC3)CCN1c1ccc(Cl)c(F)c1 ZINC000562071095 944922240 /nfs/dbraw/zinc/92/22/40/944922240.db2.gz UHPJSCLJYIOVPO-LEWJYISDSA-N 0 3 414.908 4.268 20 0 HIADHN C[C@H](NCc1cccc(N2C(=O)NC3(CCCC3)C2=O)c1)c1cc2c(s1)CCC2 ZINC000562103053 944940542 /nfs/dbraw/zinc/94/05/42/944940542.db2.gz NMEAHBAFTHLVHK-HNNXBMFYSA-N 0 3 409.555 4.457 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1cc(OC)ccc1Br)c1ccco1 ZINC000562140122 944966949 /nfs/dbraw/zinc/96/69/49/944966949.db2.gz RUOQBFBFBCBELD-BLLLJJGKSA-N 0 3 410.312 4.302 20 0 HIADHN Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)N[C@H](C)[C@H](c1ccccc1)N(C)C ZINC000562141856 944969823 /nfs/dbraw/zinc/96/98/23/944969823.db2.gz GVXCKXWZGIQVJK-XMSQKQJNSA-N 0 3 410.562 4.194 20 0 HIADHN C[C@H](NC(=O)Nc1ccc(CCN2CCSCC2)cc1)c1ccc2n[nH]cc2c1 ZINC000562141538 944971173 /nfs/dbraw/zinc/97/11/73/944971173.db2.gz ABHJSBQNOIRGJL-INIZCTEOSA-N 0 3 409.559 4.037 20 0 HIADHN CN(C)C[C@H](NC(=O)Nc1ccc(OC(F)F)c2ncccc12)c1ccc(F)cc1 ZINC000562153662 944984025 /nfs/dbraw/zinc/98/40/25/944984025.db2.gz NLWODUWNSJOCBK-KRWDZBQOSA-N 0 3 418.419 4.400 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)Nc2ccc(-c3cc[nH]n3)cc2)N(C)C)cc1 ZINC000562170693 945000133 /nfs/dbraw/zinc/00/01/33/945000133.db2.gz OBSAQCXOEUHCQT-JOCHJYFZSA-N 0 3 407.518 4.288 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1nc2c(cccc2COC)s1)c1ccco1 ZINC000562171059 945000513 /nfs/dbraw/zinc/00/05/13/945000513.db2.gz HGGBSGASBYDEKH-ZFWWWQNUSA-N 0 3 402.520 4.287 20 0 HIADHN C[C@H](NC(=O)NCc1cccc(COCc2ccco2)c1)[C@H](c1ccccc1)N(C)C ZINC000562248031 945042566 /nfs/dbraw/zinc/04/25/66/945042566.db2.gz JKJOKBHBGQATKO-YADARESESA-N 0 3 421.541 4.487 20 0 HIADHN CC(C)CCn1nccc1NC(=O)NC[C@H](c1ccc(OC(C)C)cc1)N(C)C ZINC000562270817 945051150 /nfs/dbraw/zinc/05/11/50/945051150.db2.gz LHRYXUGHHCLHBP-HXUWFJFHSA-N 0 3 401.555 4.141 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)N3CCC(c4ccccc4F)CC3)CC2)c1 ZINC000562300706 945056201 /nfs/dbraw/zinc/05/62/01/945056201.db2.gz CUQRWDXTLBEOQM-UHFFFAOYSA-N 0 3 409.549 4.052 20 0 HIADHN CSc1ccc([C@H](CNC(=O)c2cc(C)n(Cc3ccccn3)c2C)N(C)C)cc1 ZINC000564095821 945377655 /nfs/dbraw/zinc/37/76/55/945377655.db2.gz YVEDBBKEBCUXMI-QHCPKHFHSA-N 0 3 422.598 4.303 20 0 HIADHN Cc1cc(OC[C@H](O)CNCc2cccc(C(=O)N(C)C)c2)c(C(C)C)cc1Cl ZINC000564361873 945528119 /nfs/dbraw/zinc/52/81/19/945528119.db2.gz YBFMOWLTQQKFNL-LJQANCHMSA-N 0 3 418.965 4.003 20 0 HIADHN Cc1cccc2c1[C@H](C)C[C@H]2Cc1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1 ZINC000564372171 945537762 /nfs/dbraw/zinc/53/77/62/945537762.db2.gz UBSZWLKPWCGZLM-QUCCMNQESA-N 0 3 417.557 4.415 20 0 HIADHN CN(Cc1ccc(Cl)s1)C(=O)CN[C@@H]1CCN(C)[C@H]1c1ccc(Cl)cc1 ZINC000564395107 945553034 /nfs/dbraw/zinc/55/30/34/945553034.db2.gz JUZSZCZYXIECQJ-APWZRJJASA-N 0 3 412.386 4.048 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(F)cc2)CC1)C12CC3CC(CC(C3)C1)C2 ZINC000564431608 945580805 /nfs/dbraw/zinc/58/08/05/945580805.db2.gz INWSEFUERLFEAC-UHFFFAOYSA-N 0 3 400.538 4.002 20 0 HIADHN COC(=O)[C@H](C)Cc1ccc(NC(=O)NC[C@H](c2cccs2)N2CCCC2)cc1 ZINC000564455794 945599222 /nfs/dbraw/zinc/59/92/22/945599222.db2.gz WCJLSHQCBHUPQG-VQIMIIECSA-N 0 3 415.559 4.058 20 0 HIADHN O[C@@H](CNCc1cc(F)cc(Br)c1)COc1cccc2ccccc21 ZINC000564484961 945615895 /nfs/dbraw/zinc/61/58/95/945615895.db2.gz GXRFGAHDENVPTK-SFHVURJKSA-N 0 3 404.279 4.271 20 0 HIADHN C[C@H]1C[C@H](Nc2ccc(-n3ncc(Cl)c(Cl)c3=O)cc2Cl)CN1C1CC1 ZINC000564568004 945682051 /nfs/dbraw/zinc/68/20/51/945682051.db2.gz NGRGGPPONPNLHR-QWRGUYRKSA-N 0 3 413.736 4.230 20 0 HIADHN Cc1noc(CSc2ccccc2C(=O)N[C@H]2CCN(Cc3ccccc3)[C@H]2C)n1 ZINC000564680900 945727488 /nfs/dbraw/zinc/72/74/88/945727488.db2.gz ILPRZTWBNCRFOA-JXFKEZNVSA-N 0 3 422.554 4.063 20 0 HIADHN O=C(CCSc1ccc2c(c1)OCCO2)N(CCN1CCCC1)c1ccccc1 ZINC000565273824 945800164 /nfs/dbraw/zinc/80/01/64/945800164.db2.gz MDWXIPKPEIYJAI-UHFFFAOYSA-N 0 3 412.555 4.069 20 0 HIADHN Brc1cncc(Br)c1CNC[C@@H]1[C@@H]2Cc3ccccc3[C@H]12 ZINC000565276230 945801526 /nfs/dbraw/zinc/80/15/26/945801526.db2.gz MLPQNEQTXNJDKX-AHIWAGSCSA-N 0 3 408.137 4.282 20 0 HIADHN CC[C@@H](NC(=O)NC[C@@H](c1cccs1)N1CCCC1)c1ccc(OC)c(OC)c1 ZINC000565321692 945809147 /nfs/dbraw/zinc/80/91/47/945809147.db2.gz HIXHIADNQFCHDH-MSOLQXFVSA-N 0 3 417.575 4.353 20 0 HIADHN Cc1ccccc1C1(C(=O)Nc2cccc(CN3CCC(C(N)=O)CC3)c2)CCCC1 ZINC000565630027 945859066 /nfs/dbraw/zinc/85/90/66/945859066.db2.gz DRIQLGBAPCNTLF-UHFFFAOYSA-N 0 3 419.569 4.143 20 0 HIADHN CC(=O)Nc1ccc(CN2CCC(O)(Cc3ccc(OC(F)(F)F)cc3)CC2)cc1 ZINC000565825184 945890315 /nfs/dbraw/zinc/89/03/15/945890315.db2.gz ACLULCVXRLUBDC-UHFFFAOYSA-N 0 3 422.447 4.113 20 0 HIADHN CCN1CCCC[C@H]1CNC(=O)C(C)(C)c1csc(-c2cc(F)ccc2F)n1 ZINC000565896342 945909424 /nfs/dbraw/zinc/90/94/24/945909424.db2.gz FNNDKYWFLCQIAG-HNNXBMFYSA-N 0 3 407.530 4.357 20 0 HIADHN CC(C)(C(=O)NCCN1CCCCC1)c1csc(-c2c(F)cccc2Cl)n1 ZINC000566532614 946035529 /nfs/dbraw/zinc/03/55/29/946035529.db2.gz VMTMYCBJYXANMP-UHFFFAOYSA-N 0 3 409.958 4.482 20 0 HIADHN C/C(=C/c1cccc(C(F)(F)F)c1)CN(C)[C@H](C)c1cccc(S(N)(=O)=O)c1 ZINC000566587832 946050486 /nfs/dbraw/zinc/05/04/86/946050486.db2.gz KTSGYMSOKSWZAR-BAAYTWLHSA-N 0 3 412.477 4.449 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)N[C@@H](C)c2ccccc2OC(C)C)c1 ZINC000566949069 946188634 /nfs/dbraw/zinc/18/86/34/946188634.db2.gz OKQXYJSGFLRNSV-IBGZPJMESA-N 0 3 413.562 4.317 20 0 HIADHN CN(C(=O)c1ccc(NCc2ccccc2OC(F)F)cc1)[C@H]1CCCN(C)C1 ZINC000566987755 946201297 /nfs/dbraw/zinc/20/12/97/946201297.db2.gz CITKYHKFVSWVDV-IBGZPJMESA-N 0 3 403.473 4.066 20 0 HIADHN COc1cc(Br)ccc1OC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000567002421 946213154 /nfs/dbraw/zinc/21/31/54/946213154.db2.gz PETRLYVODRVPKN-SFHVURJKSA-N 0 3 406.320 4.128 20 0 HIADHN COc1cc2c(cc1CN1CCC[C@@H](c3nc(C(F)(F)F)cn3C)C1)O[C@@H](C)C2 ZINC000567084883 946236578 /nfs/dbraw/zinc/23/65/78/946236578.db2.gz DUZWFUCDYWOIMF-UONOGXRCSA-N 0 3 409.452 4.151 20 0 HIADHN CN1CC[C@@H](NC(=O)NC2(c3cccc(C(F)(F)F)c3)CC2)[C@H]1c1ccccc1 ZINC000567296616 946298839 /nfs/dbraw/zinc/29/88/39/946298839.db2.gz VYHZINPWWNCHFX-RTBURBONSA-N 0 3 403.448 4.439 20 0 HIADHN Brc1cncc(Br)c1CNC[C@@H]1CCOc2ccccc21 ZINC000567435035 946339188 /nfs/dbraw/zinc/33/91/88/946339188.db2.gz VFOBFIRYJKXKAW-NSHDSACASA-N 0 3 412.125 4.263 20 0 HIADHN O=C(Cc1noc(C2CCN(C3CC3)CC2)n1)Nc1ccc(Oc2ccccc2)cc1 ZINC000567649338 946392913 /nfs/dbraw/zinc/39/29/13/946392913.db2.gz OPOSYOMJGAJMCR-UHFFFAOYSA-N 0 3 418.497 4.385 20 0 HIADHN COCC[C@H](NC[C@@H](O)COc1ccccc1F)c1ccc(Cl)c(Cl)c1 ZINC000567904258 946422260 /nfs/dbraw/zinc/42/22/60/946422260.db2.gz VNBCTMMDFJYUMS-KDOFPFPSSA-N 0 3 402.293 4.240 20 0 HIADHN COc1cc(CN2CC[C@@H](c3nccn3C)C2)cc(OC)c1OCc1ccccc1 ZINC000568026020 946447501 /nfs/dbraw/zinc/44/75/01/946447501.db2.gz ZJUFMGJHKZDMBQ-HXUWFJFHSA-N 0 3 407.514 4.006 20 0 HIADHN FC(F)(F)Cc1noc(-c2cccc(CNCc3cnc4ccc(Cl)cn34)c2)n1 ZINC000568143332 946480291 /nfs/dbraw/zinc/48/02/91/946480291.db2.gz MZVWUWNVCSNMOG-UHFFFAOYSA-N 0 3 421.810 4.432 20 0 HIADHN CCSc1cccc(Br)c1NC(=O)N1C[C@@H](SC)[C@@H](N(C)C)C1 ZINC000568333567 946513923 /nfs/dbraw/zinc/51/39/23/946513923.db2.gz DKKQSYZICJLDNF-GXTWGEPZSA-N 0 3 418.426 4.070 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)c1cc2sc(N3CCCC3)nc2s1)c1ccco1 ZINC000568551116 946590613 /nfs/dbraw/zinc/59/06/13/946590613.db2.gz PTCXEXWNVVDTMT-KBPBESRZSA-N 0 3 418.588 4.410 20 0 HIADHN C[C@@H](N[C@@H]1c2ccccc2CC12CCOCC2)C(=O)Nc1ccc(F)cc1Cl ZINC000568568823 946605539 /nfs/dbraw/zinc/60/55/39/946605539.db2.gz NKHRDPKGJUNKGD-JLTOFOAXSA-N 0 3 402.897 4.490 20 0 HIADHN CCOc1ccc(C(C)=O)cc1CN[C@@H]1CCN(C2CC2)[C@H]1c1cccc(OC)c1 ZINC000568657528 946641700 /nfs/dbraw/zinc/64/17/00/946641700.db2.gz WQOLETGSENBFKJ-NOZRDPDXSA-N 0 3 408.542 4.364 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)CCc1nnc(-c2cc3ccccc3o2)o1 ZINC000568678095 946649770 /nfs/dbraw/zinc/64/97/70/946649770.db2.gz JMMAQLCXFPTBLG-QGZVFWFLSA-N 0 3 418.497 4.052 20 0 HIADHN COc1cc(NC(=O)CCN[C@@H]2CCCOc3ccc(F)cc32)c(OC)cc1Cl ZINC000568710276 946670588 /nfs/dbraw/zinc/67/05/88/946670588.db2.gz UVGKWXHEYJAKMV-MRXNPFEDSA-N 0 3 422.884 4.328 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)c1cccc(OCc2csc(C)n2)c1)c1ccco1 ZINC000569025668 946801772 /nfs/dbraw/zinc/80/17/72/946801772.db2.gz WHGPHVCAAKLYPB-QRWLVFNGSA-N 0 3 413.543 4.483 20 0 HIADHN Cc1ccc(NC(=O)NC(=O)[C@H](C)N[C@H](C[C@H]2CCOC2)c2ccccc2)c(C)c1 ZINC000569073154 946815678 /nfs/dbraw/zinc/81/56/78/946815678.db2.gz MKTFCPONALCCSE-NNMXDRDESA-N 0 3 409.530 4.098 20 0 HIADHN OC[C@H]1C=C[C@@H](N(Cc2cccs2)C[C@H](O)Cc2ccc(C(F)(F)F)cc2)C1 ZINC000569371727 946861686 /nfs/dbraw/zinc/86/16/86/946861686.db2.gz GNBHKXGQQKVXBI-QXAKKESOSA-N 0 3 411.489 4.110 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)N(C)CCCc1cc(-c2ccccc2)n[nH]1 ZINC000569405106 946868965 /nfs/dbraw/zinc/86/89/65/946868965.db2.gz SAWIAEFBSXBXHN-HXUWFJFHSA-N 0 3 419.573 4.171 20 0 HIADHN FC(F)(F)c1ccc(-c2nc(CN[C@H]3CCCC[C@@H]3N3CCOCC3)co2)cc1 ZINC000569431559 946874280 /nfs/dbraw/zinc/87/42/80/946874280.db2.gz XOXYPMTWRMZKGQ-OALUTQOASA-N 0 3 409.452 4.093 20 0 HIADHN CN(C)CCn1nccc1NC(=O)CCc1c2ccccc2[nH]c1-c1ccc(F)cc1 ZINC000569582192 946892773 /nfs/dbraw/zinc/89/27/73/946892773.db2.gz QXCWHOFSBWMLMP-UHFFFAOYSA-N 0 3 419.504 4.303 20 0 HIADHN C[C@H]1[C@H](NC(=O)N2CCC(c3nc4ccccc4[nH]3)CC2)CCN1Cc1ccccc1 ZINC000569726632 946958370 /nfs/dbraw/zinc/95/83/70/946958370.db2.gz WWHINQZBUGPZFW-GHTZIAJQSA-N 0 3 417.557 4.115 20 0 HIADHN CCCN(C)[C@H](CNC(=O)Nc1ccc(CNC(C)=O)cc1)c1ccc(Cl)cc1 ZINC000569837585 947015690 /nfs/dbraw/zinc/01/56/90/947015690.db2.gz BFQKKKKNHOWUQS-OAQYLSRUSA-N 0 3 416.953 4.181 20 0 HIADHN COc1ccccc1CNC[C@H](O)COC(c1ccc(F)cc1)c1ccc(F)cc1 ZINC000569871913 947027606 /nfs/dbraw/zinc/02/76/06/947027606.db2.gz VBZIIPVQMLHMOK-QFIPXVFZSA-N 0 3 413.464 4.230 20 0 HIADHN Cc1cc(C)c(S(N)(=O)=O)cc1[C@H](C)NC[C@@H](Cc1ccccc1)C(F)(F)F ZINC000569892985 947039336 /nfs/dbraw/zinc/03/93/36/947039336.db2.gz WNCDQBPZALNCLT-DOTOQJQBSA-N 0 3 414.493 4.023 20 0 HIADHN CCO[C@H](C)c1nc(CN(C)C(=O)N[C@@H]2CCN(Cc3ccccc3)[C@@H]2C)cs1 ZINC000569956584 947051861 /nfs/dbraw/zinc/05/18/61/947051861.db2.gz UPOUPHGECJRMMF-MBOZVWFJSA-N 0 3 416.591 4.045 20 0 HIADHN CCCOc1cc(C)ccc1NC(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000569996750 947065321 /nfs/dbraw/zinc/06/53/21/947065321.db2.gz JCLHURSNJHTSJR-KDURUIRLSA-N 0 3 403.567 4.137 20 0 HIADHN C[C@H]1[C@H](NC(=O)N(C)Cc2ccc(OC(F)F)cc2)CCN1Cc1ccccc1 ZINC000569999347 947065942 /nfs/dbraw/zinc/06/59/42/947065942.db2.gz NYYGCNSGAXFGLP-OXJNMPFZSA-N 0 3 403.473 4.092 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@H](C)[C@H]1NS(=O)(=O)c1ccc(C(F)F)cc1 ZINC000570116067 947098903 /nfs/dbraw/zinc/09/89/03/947098903.db2.gz UFUOYCCKPTUBFL-IGOJGBNBSA-N 0 3 408.514 4.059 20 0 HIADHN COC(=O)c1coc([C@H](C)NC2CCN(Cc3coc(-c4ccccc4)n3)CC2)c1 ZINC000570359974 947218118 /nfs/dbraw/zinc/21/81/18/947218118.db2.gz OBPVPMFLZSAXSI-INIZCTEOSA-N 0 3 409.486 4.036 20 0 HIADHN Brc1ccc(CCNCc2cn3ccc(Br)cc3n2)s1 ZINC000570369738 947223561 /nfs/dbraw/zinc/22/35/61/947223561.db2.gz YACXCOUIZJXBDH-UHFFFAOYSA-N 0 3 415.154 4.253 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)Cc1c[nH]c2cc(Br)ccc12)c1ccco1 ZINC000570424357 947236786 /nfs/dbraw/zinc/23/67/86/947236786.db2.gz JRQIQLALUYCMBK-FZKQIMNGSA-N 0 3 418.335 4.312 20 0 HIADHN CN(C)C(=O)c1cccc(NC(=O)CN[C@@H](c2cccc(C(F)(F)F)c2)C2CC2)c1 ZINC000570465393 947252890 /nfs/dbraw/zinc/25/28/90/947252890.db2.gz FXIXODMQPKKAAJ-HXUWFJFHSA-N 0 3 419.447 4.087 20 0 HIADHN CNC(=O)COc1cccc(CN[C@@H](C)c2sc(Cc3ccccc3)nc2C)c1 ZINC000570648475 947322014 /nfs/dbraw/zinc/32/20/14/947322014.db2.gz NYTYWAVLFLZLBZ-INIZCTEOSA-N 0 3 409.555 4.018 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)Nc2ccccc2N2CCCC2=O)N(C)C)cc1 ZINC000570708465 947332258 /nfs/dbraw/zinc/33/22/58/947332258.db2.gz DHGIABDHOSIUEZ-QFIPXVFZSA-N 0 3 424.545 4.025 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)NCc2sccc2Br)C1 ZINC000570828441 947363083 /nfs/dbraw/zinc/36/30/83/947363083.db2.gz LSIBLPMHOCHYLQ-UKRRQHHQSA-N 0 3 408.365 4.145 20 0 HIADHN CCc1oc(CNC[C@@H]2CCN(C)[C@@H]2c2ccc(Cl)c(F)c2)cc1C(=O)OC ZINC000570869129 947376167 /nfs/dbraw/zinc/37/61/67/947376167.db2.gz BKBJJYIGCROGDC-VBKZILBWSA-N 0 3 408.901 4.204 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)C1(c2cc(F)cc(Br)c2)CC1)c1ccco1 ZINC000570958308 947398598 /nfs/dbraw/zinc/39/85/98/947398598.db2.gz RLEVJRCMUIVXEZ-CXAGYDPISA-N 0 3 423.326 4.458 20 0 HIADHN CN(C)C[C@H](NC(=O)Nc1ccc(Oc2cccnc2)nc1)c1ccc(Cl)cc1 ZINC000571027636 947443535 /nfs/dbraw/zinc/44/35/35/947443535.db2.gz AGIZNKDOYPVUAH-IBGZPJMESA-N 0 3 411.893 4.347 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)c1cccnc1OCc1ccccc1F)c1ccco1 ZINC000571117200 947509326 /nfs/dbraw/zinc/50/93/26/947509326.db2.gz RHMMEVMSYLSPPE-OXQOHEQNSA-N 0 3 411.477 4.252 20 0 HIADHN O[C@H](CO[C@H]1CCCc2ccccc21)CN1CCC(Oc2cncc(Cl)c2)CC1 ZINC000571242389 947563193 /nfs/dbraw/zinc/56/31/93/947563193.db2.gz AGFIWQGFCQVEMF-CVDCTZTESA-N 0 3 416.949 4.033 20 0 HIADHN CN(C)C[C@H](NC(=O)c1c[nH]c2ncc(Br)cc12)c1ccc(Cl)cc1 ZINC000571302905 947582687 /nfs/dbraw/zinc/58/26/87/947582687.db2.gz ZTIKHDOQYCOYCI-INIZCTEOSA-N 0 3 421.726 4.012 20 0 HIADHN CN(C)S(=O)(=O)c1cccc(CN[C@H](Cc2ccc(F)cc2)c2ccccc2)c1 ZINC000571308306 947586194 /nfs/dbraw/zinc/58/61/94/947586194.db2.gz GAYKUKFIKRBEDO-HSZRJFAPSA-N 0 3 412.530 4.150 20 0 HIADHN CC(C)c1cccc(C(C)C)c1NC(=O)CN1CCC(N2CCOC[C@@H]2C)CC1 ZINC000571742473 947773144 /nfs/dbraw/zinc/77/31/44/947773144.db2.gz UTYNTBOWANNKPM-IBGZPJMESA-N 0 3 401.595 4.057 20 0 HIADHN CN1CC[C@H](NCC(=O)Nc2cc(Cl)ccc2F)[C@H]1c1ccc(Cl)c(F)c1 ZINC000571810747 947791994 /nfs/dbraw/zinc/79/19/94/947791994.db2.gz NYOLGZXMTWSBMX-QFBILLFUSA-N 0 3 414.283 4.245 20 0 HIADHN COc1ccc([C@H](Cc2ccccc2)NCC(=O)Nc2ccc(OC)cc2OC)cc1 ZINC000571870566 947806829 /nfs/dbraw/zinc/80/68/29/947806829.db2.gz RUNLBBAHJUQAMF-QHCPKHFHSA-N 0 3 420.509 4.225 20 0 HIADHN C[C@@H](C1CC1)N(Cc1ccccc1)C(=O)CN[C@@H]1c2ccccc2CC12CCOCC2 ZINC000571930952 947814774 /nfs/dbraw/zinc/81/47/74/947814774.db2.gz QSUDDYGXUABUIS-RXFWQSSRSA-N 0 3 418.581 4.498 20 0 HIADHN C[C@H](c1ccc(F)c(F)c1)N(C)C(=O)CN[C@@H]1CCN(C)[C@@H]1c1ccc(Cl)cc1 ZINC000571963123 947823526 /nfs/dbraw/zinc/82/35/26/947823526.db2.gz SOESRDDIKUNZHF-JEWAVWJGSA-N 0 3 421.919 4.173 20 0 HIADHN O=C(C[C@H]1CCCCO1)N(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000572192363 947859862 /nfs/dbraw/zinc/85/98/62/947859862.db2.gz CVVWCYXCEUCDIV-DNQXCXABSA-N 0 3 407.558 4.034 20 0 HIADHN CCN(CC(=O)Nc1c(C#N)c(C)c(C)n1-c1ccccc1)[C@H]1CCOC(C)(C)C1 ZINC000572289810 947877395 /nfs/dbraw/zinc/87/73/95/947877395.db2.gz RYFVXYBAARWUBD-FQEVSTJZSA-N 0 3 408.546 4.184 20 0 HIADHN Cc1ccc(Cl)cc1NC(=O)C[C@H](C)N[C@H](CC(=O)N(C)C)c1ccccc1 ZINC000572387590 947892592 /nfs/dbraw/zinc/89/25/92/947892592.db2.gz IIAVJXYXRZSSFN-OXJNMPFZSA-N 0 3 401.938 4.175 20 0 HIADHN CN(CCCN(C)C(=O)c1cc2c(ccc(Cl)c2Cl)[nH]1)Cc1ccncc1 ZINC000572430234 947901531 /nfs/dbraw/zinc/90/15/31/947901531.db2.gz HEANIYPUQZTIOF-UHFFFAOYSA-N 0 3 405.329 4.464 20 0 HIADHN Cc1csc(Nc2ccc(C(=O)N(CCN(C)C)Cc3cccs3)cc2)n1 ZINC000572534717 947936472 /nfs/dbraw/zinc/93/64/72/947936472.db2.gz QUDWHTZUYGPUFP-UHFFFAOYSA-N 0 3 400.573 4.461 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)Nc1ccc(OCC2CCOCC2)cc1 ZINC000572679362 947980335 /nfs/dbraw/zinc/98/03/35/947980335.db2.gz ZIZUCOUTJAMGAJ-LJQANCHMSA-N 0 3 411.546 4.134 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)c1cnnn1-c1c(Cl)cccc1Cl)c1ccco1 ZINC000572750749 948000953 /nfs/dbraw/zinc/00/09/53/948000953.db2.gz JZZWVWUJGUAZNV-WFASDCNBSA-N 0 3 422.316 4.026 20 0 HIADHN CN(C)C[C@H](NC(=O)Nc1ccc(NC(=O)c2ccco2)cc1)c1ccc(F)cc1 ZINC000572862417 948023698 /nfs/dbraw/zinc/02/36/98/948023698.db2.gz DMSOBPQBRZQZJQ-IBGZPJMESA-N 0 3 410.449 4.095 20 0 HIADHN Cc1ccc([C@H](NC[C@@H]2COc3ccccc32)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000573133340 948083596 /nfs/dbraw/zinc/08/35/96/948083596.db2.gz RJSGVJSDBXMIQU-YKSBVNFPSA-N 0 3 407.535 4.254 20 0 HIADHN Cc1ccc([C@@H](NC[C@@H]2COc3ccccc32)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000573133338 948084356 /nfs/dbraw/zinc/08/43/56/948084356.db2.gz RJSGVJSDBXMIQU-HYBUGGRVSA-N 0 3 407.535 4.254 20 0 HIADHN OC[C@]1(CNCc2cc(Cl)ccc2OC[C@H]2CCCO2)C[C@H]1c1ccccc1 ZINC000573254785 948125779 /nfs/dbraw/zinc/12/57/79/948125779.db2.gz XQTXDBNMQZHEAK-FUPPJEDESA-N 0 3 401.934 4.154 20 0 HIADHN CN1CCC(N(Cc2ccccc2Br)C(=O)Nc2nccs2)CC1 ZINC000573526758 948231539 /nfs/dbraw/zinc/23/15/39/948231539.db2.gz GFSLOTFZPFUPLW-UHFFFAOYSA-N 0 3 409.353 4.034 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)c2cccc3cccc(Br)c32)C[C@@H](C)O1 ZINC000573708091 948278970 /nfs/dbraw/zinc/27/89/70/948278970.db2.gz MZIKJLAYAMVXFO-HZPDHXFCSA-N 0 3 419.363 4.222 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)[C@@H]2C[C@@H]2c2ccccc2OC(F)(F)F)cc1 ZINC000573737020 948285522 /nfs/dbraw/zinc/28/55/22/948285522.db2.gz XXZMAXHQECSWSL-QRVBRYPASA-N 0 3 422.447 4.116 20 0 HIADHN Cc1nn(C(C)(C)C)c(C)c1CNc1ccc(C(=O)N(C)[C@@H]2CCCN(C)C2)cc1 ZINC000573854707 948312785 /nfs/dbraw/zinc/31/27/85/948312785.db2.gz VYUPXGGZVBTURX-OAQYLSRUSA-N 0 3 411.594 4.033 20 0 HIADHN COC(=O)CCn1nc(C)c(CN2CCC([C@H](F)c3ccccc3F)CC2)c1C ZINC000573883918 948320126 /nfs/dbraw/zinc/32/01/26/948320126.db2.gz PYKBZDLAUXVLJK-QFIPXVFZSA-N 0 3 405.489 4.125 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NC[C@H]3CC[C@H](c4ccccc4)O3)c(C)c2)CC1 ZINC000573954957 948332481 /nfs/dbraw/zinc/33/24/81/948332481.db2.gz JWUYITJMNIVGHH-ISKFKSNPSA-N 0 3 422.573 4.179 20 0 HIADHN COc1ccc(Br)c(NC(=O)N[C@H](CN(C)C)c2ccc(F)cc2)c1 ZINC000574048233 948353829 /nfs/dbraw/zinc/35/38/29/948353829.db2.gz FBTZVHAXYHISTA-QGZVFWFLSA-N 0 3 410.287 4.021 20 0 HIADHN CSc1ccc([C@@H](CNC(=O)c2cc(NC(C)=O)ccc2Cl)N(C)C)cc1 ZINC000574192867 948383454 /nfs/dbraw/zinc/38/34/54/948383454.db2.gz GZSXVYWMLDGRNL-LJQANCHMSA-N 0 3 405.951 4.053 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)NCc2ccc(S(C)(=O)=O)c(Cl)c2)cc1 ZINC000574240687 948395445 /nfs/dbraw/zinc/39/54/45/948395445.db2.gz OPHVEJHZLUTECK-AWEZNQCLSA-N 0 3 403.935 4.088 20 0 HIADHN C[C@H]1[C@@H](NC(=O)N2CC=C(c3c[nH]c4ncccc34)CC2)CCN1Cc1ccccc1 ZINC000574306961 948407286 /nfs/dbraw/zinc/40/72/86/948407286.db2.gz NLJKUNNMDBJGLN-MBSDFSHPSA-N 0 3 415.541 4.025 20 0 HIADHN COc1coc(CN[C@@H]2CCN(C(C)(C)C)[C@@H]2c2ccc(Cl)c(F)c2)cc1=O ZINC000574341606 948415986 /nfs/dbraw/zinc/41/59/86/948415986.db2.gz CSOIYIXVMCSCGU-YLJYHZDGSA-N 0 3 408.901 4.145 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)Nc1cnn(Cc2ccc(Cl)cc2)c1)c1ccco1 ZINC000574349724 948419660 /nfs/dbraw/zinc/41/96/60/948419660.db2.gz WDPWXMXYALFURF-BEFAXECRSA-N 0 3 415.925 4.429 20 0 HIADHN CN(C(=O)CN[C@H]1c2ccccc2CC12CCOCC2)[C@@H]1CCCc2ccccc21 ZINC000574560906 948475070 /nfs/dbraw/zinc/47/50/70/948475070.db2.gz VDGSJCADJLXXHH-NOZRDPDXSA-N 0 3 404.554 4.206 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NS(=O)(=O)Cc1ccc2ccccc2c1 ZINC000574606011 948490581 /nfs/dbraw/zinc/49/05/81/948490581.db2.gz AKWRJRCTXCUVOJ-NTKDMRAZSA-N 0 3 408.567 4.170 20 0 HIADHN CN1CC[C@H](NC(=O)NC[C@H](Cc2ccccc2)C(F)(F)F)[C@@H]1c1ccccc1 ZINC000574614039 948492668 /nfs/dbraw/zinc/49/26/68/948492668.db2.gz BULLGHIEZTWMAB-UFYCRDLUSA-N 0 3 405.464 4.152 20 0 HIADHN CN1CCC(N(Cc2ccccc2Br)C(=O)NC(C2CC2)C2CC2)CC1 ZINC000575051739 948583215 /nfs/dbraw/zinc/58/32/15/948583215.db2.gz HBOGXAWYUQYIPJ-UHFFFAOYSA-N 0 3 420.395 4.244 20 0 HIADHN COc1cc(C[NH2+][C@@H]2c3ccccc3CC23CCOCC3)cc(Br)c1[O-] ZINC000575098570 948592737 /nfs/dbraw/zinc/59/27/37/948592737.db2.gz OQIKWSRZXUMXIH-HXUWFJFHSA-N 0 3 418.331 4.347 20 0 HIADHN CC[C@@H](C)n1c(SCCCN2CCN(C(C)C)CC2)nnc1-c1ccccc1 ZINC000575131058 948601719 /nfs/dbraw/zinc/60/17/19/948601719.db2.gz RUDMCWDKFRTGNC-LJQANCHMSA-N 0 3 401.624 4.424 20 0 HIADHN O=c1[n-]c(CN2C[C@@H]3CC[N@H+](Cc4ccccc4)C[C@H]3C2)nc2c3ccccc3oc21 ZINC000575166313 948614721 /nfs/dbraw/zinc/61/47/21/948614721.db2.gz DEDLZNSAJMOKBF-OALUTQOASA-N 0 3 414.509 4.036 20 0 HIADHN O=c1[n-]c(CN2C[C@@H]3CC[N@@H+](Cc4ccccc4)C[C@H]3C2)nc2c3ccccc3oc21 ZINC000575166313 948614732 /nfs/dbraw/zinc/61/47/32/948614732.db2.gz DEDLZNSAJMOKBF-OALUTQOASA-N 0 3 414.509 4.036 20 0 HIADHN OC1(CCN[C@@H](Cc2ccccc2F)c2ccccc2Br)CCOCC1 ZINC000575889772 948752927 /nfs/dbraw/zinc/75/29/27/948752927.db2.gz NAGAOMYKVPKITD-FQEVSTJZSA-N 0 3 422.338 4.393 20 0 HIADHN COc1cc(CN[C@H](c2ccc(Cl)c(Cl)c2)C(C)C)ccc1OCC(N)=O ZINC000575942615 948792470 /nfs/dbraw/zinc/79/24/70/948792470.db2.gz PXQMRHNJYNMUOR-FQEVSTJZSA-N 0 3 411.329 4.353 20 0 HIADHN FC(F)(c1c2c(nnc1Cl)CCC2)N1CCC[C@H]2CN(Cc3ccccc3)C[C@H]21 ZINC001164630103 719099515 /nfs/dbraw/zinc/09/95/15/719099515.db2.gz VGUQRFRBPPCVPK-QFBILLFUSA-N 0 3 418.919 4.264 20 0 HIADHN FC(F)(c1c2c(nnc1Cl)CCC2)N1CCC[C@@H]2CN(Cc3ccccc3)C[C@H]21 ZINC001164630104 719099592 /nfs/dbraw/zinc/09/95/92/719099592.db2.gz VGUQRFRBPPCVPK-VQIMIIECSA-N 0 3 418.919 4.264 20 0 HIADHN Cc1nc2sc3c(c2c(N2CC[C@@H]4[C@H]2CCN4Cc2cccnc2)n1)CCCC3 ZINC001164734516 720431068 /nfs/dbraw/zinc/43/10/68/720431068.db2.gz SXJDDYWHPWSZMY-RTBURBONSA-N 0 3 405.571 4.127 20 0 HIADHN COc1cc2c(cc1F)cc(Cl)nc2N1CC[C@@H]2[C@H]1CCN2Cc1cccnc1 ZINC001164724157 720488609 /nfs/dbraw/zinc/48/86/09/720488609.db2.gz DYRWQFXLIDNLQI-RTBURBONSA-N 0 3 412.896 4.284 20 0 HIADHN FC(F)(c1cnc(Cl)cc1Cl)N1CCCn2cnc(CNC3CCC3)c2C1 ZINC001164838630 720737315 /nfs/dbraw/zinc/73/73/15/720737315.db2.gz UHOXJCJZRJGELC-UHFFFAOYSA-N 0 3 416.303 4.182 20 0 HIADHN O=C(CC1CCC2(CC1)CCN(c1ccc(CN3CCCC3)cn1)CC2)N1CC=CC1 ZINC001164776009 721328939 /nfs/dbraw/zinc/32/89/39/721328939.db2.gz BSXOTSAYRHSJET-UHFFFAOYSA-N 0 3 422.617 4.243 20 0 HIADHN Cc1noc(C)c1CN1CCOC[C@@]2(CCCN(c3nccc4cccc(C)c43)C2)C1 ZINC001164780274 721370356 /nfs/dbraw/zinc/37/03/56/721370356.db2.gz FLSORICIBYADBV-VWLOTQADSA-N 0 3 420.557 4.267 20 0 HIADHN Cc1cncc(COC[C@@]23CCC[C@@H]2CN(c2ccc(CN(C)C4CC4)cn2)C3)c1 ZINC001164797805 721601682 /nfs/dbraw/zinc/60/16/82/721601682.db2.gz CFOLESKVNGDPNL-RDGATRHJSA-N 0 3 406.574 4.203 20 0 HIADHN Cc1cccc2c1ncnc2N1CCC(F)(F)[C@@]2(CCN(Cc3ccccn3)C2)C1 ZINC001164906267 721694140 /nfs/dbraw/zinc/69/41/40/721694140.db2.gz MVQLPHMBAPYZNJ-JOCHJYFZSA-N 0 3 409.484 4.071 20 0 HIADHN COc1ccc2nc(N3CCC(F)(F)[C@@]4(CCN(Cc5ccccn5)C4)C3)ccc2c1 ZINC001164907902 721698567 /nfs/dbraw/zinc/69/85/67/721698567.db2.gz WHXZDZWQLMTMQK-HSZRJFAPSA-N 0 3 424.495 4.376 20 0 HIADHN Clc1ccc2ccnc(N3CCC4(CC3)COCCN(Cc3ccncc3)C4)c2c1 ZINC001164964568 722054896 /nfs/dbraw/zinc/05/48/96/722054896.db2.gz VQWMJIVIAQAGCV-UHFFFAOYSA-N 0 3 422.960 4.402 20 0 HIADHN Clc1ccc2c(ccnc2N2CC[C@H]3CN(Cc4cccnc4)CCO[C@H]3C2)c1 ZINC001164976562 722109605 /nfs/dbraw/zinc/10/96/05/722109605.db2.gz LSSDDMJKTCWOTE-UGKGYDQZSA-N 0 3 408.933 4.011 20 0 HIADHN COC(=O)c1cc2ccccc2c(N2CCC[C@]3(CCN3Cc3cccc(F)c3)C2)n1 ZINC001164994030 722208969 /nfs/dbraw/zinc/20/89/69/722208969.db2.gz DGELIQRTIMVRCZ-VWLOTQADSA-N 0 3 419.500 4.405 20 0 HIADHN Cc1ccc([C@H](CNC(=O)C2(OCc3ccccc3)CCOCC2)N2CCCC2)cc1 ZINC000435947533 861213478 /nfs/dbraw/zinc/21/34/78/861213478.db2.gz BJOIPEKIVDCRPH-DEOSSOPVSA-N 0 3 422.569 4.014 20 0 HIADHN CCOC(=O)c1c(NC(=O)c2ccc(OC)cc2)sc2c1CC(C)(C)NC2(C)C ZINC000004281227 845048617 /nfs/dbraw/zinc/04/86/17/845048617.db2.gz FCLQSYREFUDEIX-UHFFFAOYSA-N 0 3 416.543 4.345 20 0 HIADHN O=C(NCc1ccncc1)Nc1cccc(CNCc2cc3c(cccc3F)[nH]2)c1 ZINC000436244489 861553533 /nfs/dbraw/zinc/55/35/33/861553533.db2.gz RXGNTKMMDMRSJR-UHFFFAOYSA-N 0 3 403.461 4.314 20 0 HIADHN O=C(Nc1ccccc1)c1ccc(CN2CCC(NC(=O)c3ccccc3)CC2)cc1 ZINC000011102827 845754221 /nfs/dbraw/zinc/75/42/21/845754221.db2.gz JUWXCHURGHYSAS-UHFFFAOYSA-N 0 3 413.521 4.333 20 0 HIADHN Cc1cc(NC(=O)C(C)(C)C)sc1C(=O)NC1CCN(Cc2ccccc2)CC1 ZINC000012753901 845888862 /nfs/dbraw/zinc/88/88/62/845888862.db2.gz ZKVKAURXSVYSGU-UHFFFAOYSA-N 0 3 413.587 4.436 20 0 HIADHN CCOC(=O)c1sc2ncnc(NC[C@H](c3ccco3)N3CCCCC3)c2c1C ZINC000015170599 846015309 /nfs/dbraw/zinc/01/53/09/846015309.db2.gz BSCRFEAADRILOB-OAHLLOKOSA-N 0 3 414.531 4.409 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(CNCCOc3ccccc3OC)c2)cc1 ZINC000017312028 846243872 /nfs/dbraw/zinc/24/38/72/846243872.db2.gz WEWSGHRUKRLXMV-UHFFFAOYSA-N 0 3 406.482 4.125 20 0 HIADHN O=S(=O)(c1ccc(CNCc2cccc(C(F)(F)F)c2)cc1)N1CCCCC1 ZINC000017317638 846244689 /nfs/dbraw/zinc/24/46/89/846244689.db2.gz FBYMLVKRILIEEI-UHFFFAOYSA-N 0 3 412.477 4.170 20 0 HIADHN COc1ccc(CNCc2cn(Cc3ccccc3)nc2-c2cccnc2)cc1OC ZINC000017310699 846244778 /nfs/dbraw/zinc/24/47/78/846244778.db2.gz AFXVABZNLCYPFJ-UHFFFAOYSA-N 0 3 414.509 4.300 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3[nH]c4c(c3C)C(=O)CC(C)(C)C4)c(C)c2)CC1 ZINC000022067948 846527849 /nfs/dbraw/zinc/52/78/49/846527849.db2.gz DTCPXZXXUPUCCE-UHFFFAOYSA-N 0 3 422.573 4.181 20 0 HIADHN CCN1CCN(c2ccc(NC(=S)Nc3ccc(OC(F)F)cc3)cc2)CC1 ZINC000023107892 846659304 /nfs/dbraw/zinc/65/93/04/846659304.db2.gz VGCDHMJXDXTXRK-UHFFFAOYSA-N 0 3 406.502 4.239 20 0 HIADHN COc1cc(CN(C)C[C@@H](O)COc2c(C)ccc(C)c2C)ccc1OC(F)F ZINC000023408757 846696168 /nfs/dbraw/zinc/69/61/68/846696168.db2.gz UOOICUJKWBRZCR-GOSISDBHSA-N 0 3 409.473 4.094 20 0 HIADHN CCOc1ccc(OC[C@H](O)CN2CCC(c3nc4ccccc4s3)CC2)cc1 ZINC000023410246 846696587 /nfs/dbraw/zinc/69/65/87/846696587.db2.gz QSARVYJAAZALEJ-GOSISDBHSA-N 0 3 412.555 4.314 20 0 HIADHN COc1cc(CN(C)C[C@H](O)COc2c(C)ccc(C)c2C)ccc1OC(F)F ZINC000023408760 846696669 /nfs/dbraw/zinc/69/66/69/846696669.db2.gz UOOICUJKWBRZCR-SFHVURJKSA-N 0 3 409.473 4.094 20 0 HIADHN Cc1nn(Cc2ccc(F)cc2)c(Cl)c1CN[C@H]1CCN(Cc2ccccc2)C1 ZINC000023480183 846706142 /nfs/dbraw/zinc/70/61/42/846706142.db2.gz DETDJKASDRRIQV-NRFANRHFSA-N 0 3 412.940 4.396 20 0 HIADHN C[NH+](C)Cc1ccc(-c2ccccc2C[N-]S(=O)(=O)c2c(F)cccc2F)cc1 ZINC000024445298 846825280 /nfs/dbraw/zinc/82/52/80/846825280.db2.gz OKLMXQNWHUOFOX-UHFFFAOYSA-N 0 3 416.493 4.172 20 0 HIADHN CCc1c(C(=O)NC2CCN(Cc3ccccc3)CC2)cnn1-c1cccc(Cl)c1 ZINC000024541635 846835266 /nfs/dbraw/zinc/83/52/66/846835266.db2.gz GDSFJSVQYZUXOQ-UHFFFAOYSA-N 0 3 422.960 4.483 20 0 HIADHN COc1ccc(C)cc1NC(=O)[C@H](NCCc1ccc2c(c1)OCO2)c1ccccc1 ZINC000025697775 847021393 /nfs/dbraw/zinc/02/13/93/847021393.db2.gz SQPCMUMBCCPEIK-XMMPIXPASA-N 0 3 418.493 4.244 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1ccc(F)cc1Br)c1cccc(OC)c1 ZINC000025860916 847047148 /nfs/dbraw/zinc/04/71/48/847047148.db2.gz AJPJVXOWAAYQNX-IBGZPJMESA-N 0 3 423.326 4.410 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Cc1nc(-c2ccccc2)oc1C)c1cccc(OC)c1 ZINC000025863276 847048099 /nfs/dbraw/zinc/04/80/99/847048099.db2.gz KWIYQAFEJVQRRX-QHCPKHFHSA-N 0 3 421.541 4.400 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1C(=O)NC[C@@H](C(C)C)N1CCc2ccccc2C1 ZINC000025918149 847057127 /nfs/dbraw/zinc/05/71/27/847057127.db2.gz CPJUQCLPYDPZQW-DEOSSOPVSA-N 0 3 416.569 4.302 20 0 HIADHN CCc1ccc(-c2nn(-c3ccccc3C)cc2CNCCNC(=O)C2CC2)cc1 ZINC000026309009 847122931 /nfs/dbraw/zinc/12/29/31/847122931.db2.gz QZGVVGKZVGBPNC-UHFFFAOYSA-N 0 3 402.542 4.026 20 0 HIADHN COC(=O)c1ccc(CN(C)CCC(=O)NC(c2ccccc2)c2ccccc2)cc1 ZINC000026321463 847125420 /nfs/dbraw/zinc/12/54/20/847125420.db2.gz STHRPCAQMXGBPW-UHFFFAOYSA-N 0 3 416.521 4.201 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)c3cccc(C(F)(F)F)c3)CC2)c1 ZINC000026964620 847227401 /nfs/dbraw/zinc/22/74/01/847227401.db2.gz HSTDIECYYRCUGJ-UHFFFAOYSA-N 0 3 419.491 4.346 20 0 HIADHN COc1cc(CN[C@@H](C)c2cc(C)sc2C)ccc1OCC(=O)N1CCCC1 ZINC000027218243 847268476 /nfs/dbraw/zinc/26/84/76/847268476.db2.gz WRROFPIRMXRPLG-INIZCTEOSA-N 0 3 402.560 4.226 20 0 HIADHN CCOc1cc(CN[C@H](C)c2cc(C)sc2C)ccc1O[C@H](C)C(=O)N(C)C ZINC000027218277 847269033 /nfs/dbraw/zinc/26/90/33/847269033.db2.gz WPWVPVITTCKKNH-HZPDHXFCSA-N 0 3 404.576 4.470 20 0 HIADHN COc1ccc(OC)c([C@H]2CCCN2C[C@@H](O)COc2cccc3ccccc32)c1 ZINC000027279812 847277758 /nfs/dbraw/zinc/27/77/58/847277758.db2.gz NJYICBNSXXBZBE-AUSIDOKSSA-N 0 3 407.510 4.434 20 0 HIADHN Cc1ccccc1CN1CCCN(C(=O)c2ccc(F)cc2Br)CC1 ZINC000027388170 847294192 /nfs/dbraw/zinc/29/41/92/847294192.db2.gz JNDAJQQEDCYPEI-UHFFFAOYSA-N 0 3 405.311 4.245 20 0 HIADHN Cc1ccccc1CN1CCCN(C(=O)c2cc(-c3ccc(Cl)cc3)n[nH]2)CC1 ZINC000027389474 847295601 /nfs/dbraw/zinc/29/56/01/847295601.db2.gz BZAJYHCCLMPUMP-UHFFFAOYSA-N 0 3 408.933 4.387 20 0 HIADHN CN(C)[C@H](CNC(=O)c1ccc(C2SCCCS2)cc1)Cc1ccccc1 ZINC000027584447 847323186 /nfs/dbraw/zinc/32/31/86/847323186.db2.gz HDNVQIYQLHPVIB-FQEVSTJZSA-N 0 3 400.613 4.458 20 0 HIADHN CN(C)[C@@H](CNC(=O)c1ccc(C2SCCCS2)cc1)Cc1ccccc1 ZINC000027584442 847323877 /nfs/dbraw/zinc/32/38/77/847323877.db2.gz HDNVQIYQLHPVIB-HXUWFJFHSA-N 0 3 400.613 4.458 20 0 HIADHN CC(C)c1ccc(-c2noc(CCC(=O)NC[C@H](Cc3ccccc3)N(C)C)n2)cc1 ZINC000027589067 847324770 /nfs/dbraw/zinc/32/47/70/847324770.db2.gz KVNWXRHEESDEQS-QFIPXVFZSA-N 0 3 420.557 4.082 20 0 HIADHN C[C@@H](CN1CCCCC1)NC(=O)c1cnn(-c2cccc(C(F)(F)F)c2)c1C1CC1 ZINC000027767612 847349254 /nfs/dbraw/zinc/34/92/54/847349254.db2.gz NEEWTIPSKNPTGQ-HNNXBMFYSA-N 0 3 420.479 4.373 20 0 HIADHN COC(=O)c1cc(CN2CCCN(Cc3ccc(C(F)(F)F)cc3)CC2)oc1C ZINC000028259844 847399706 /nfs/dbraw/zinc/39/97/06/847399706.db2.gz RUVWOGSTVARRRQ-UHFFFAOYSA-N 0 3 410.436 4.101 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)CN2CCC[C@@H]2Cc2ccccc2)cc1OC ZINC000028279260 847401835 /nfs/dbraw/zinc/40/18/35/847401835.db2.gz ZTCNMNWRUHRYSQ-YADHBBJMSA-N 0 3 408.542 4.074 20 0 HIADHN Cc1ccc(NC(=O)NC(=O)[C@@H](C)N[C@H](C)c2ccc(NC(=O)C3CC3)cc2)c(C)c1 ZINC000028349116 847410606 /nfs/dbraw/zinc/41/06/06/847410606.db2.gz YSPZFXIDVBNZMT-IAGOWNOFSA-N 0 3 422.529 4.039 20 0 HIADHN COc1ccc(CN2CCCN(C(=O)c3cc(-c4ccc(Cl)cc4)[nH]n3)CC2)cc1 ZINC000029092117 847503805 /nfs/dbraw/zinc/50/38/05/847503805.db2.gz LSLKSZHYXAJCEW-UHFFFAOYSA-N 0 3 424.932 4.087 20 0 HIADHN CCOc1c(Cl)cc(C(=O)N[C@H](CN2CCCC2)c2ccccc2)cc1OC ZINC000029177999 847520715 /nfs/dbraw/zinc/52/07/15/847520715.db2.gz ZTSMYZPRNGXQBA-LJQANCHMSA-N 0 3 402.922 4.314 20 0 HIADHN Cc1c(C(=O)N[C@H](CN2CCCC2)c2ccccc2)cnn1-c1ccc(Cl)cc1 ZINC000029179354 847522096 /nfs/dbraw/zinc/52/20/96/847522096.db2.gz BKJZDCFJKSPCPC-JOCHJYFZSA-N 0 3 408.933 4.401 20 0 HIADHN CC(C)[C@H](CNc1ncnc2scc(-c3ccc(F)cc3)c21)N1CCN(C)CC1 ZINC000029839962 847630033 /nfs/dbraw/zinc/63/00/33/847630033.db2.gz ICBSGBVXIGGYIM-IBGZPJMESA-N 0 3 413.566 4.181 20 0 HIADHN COc1ccc(CNCc2ccccc2Cn2cccn2)cc1OCc1cccnc1 ZINC000030629087 847747302 /nfs/dbraw/zinc/74/73/02/847747302.db2.gz CJPLMPKEDNWINS-UHFFFAOYSA-N 0 3 414.509 4.204 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2CNCc2ccc(-n3ccnc3)nc2)o1 ZINC000030655166 847753631 /nfs/dbraw/zinc/75/36/31/847753631.db2.gz JVYRWATXKCXZIY-UHFFFAOYSA-N 0 3 410.481 4.311 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)[C@H](C)Oc3ccc(Cl)cc3C)cc2)CC1 ZINC000030669661 847756292 /nfs/dbraw/zinc/75/62/92/847756292.db2.gz RLKFBJWTPDUSRR-KRWDZBQOSA-N 0 3 401.938 4.196 20 0 HIADHN COc1ccc(CNCCNC(=O)c2ccc(C)c(F)c2)cc1OCc1ccccc1 ZINC000030670216 847756364 /nfs/dbraw/zinc/75/63/64/847756364.db2.gz WQRHWOKOHMPUSX-UHFFFAOYSA-N 0 3 422.500 4.241 20 0 HIADHN COc1cc(CNCCNC(=O)c2ccc(C)c(F)c2)ccc1OCc1ccccc1 ZINC000030670254 847756473 /nfs/dbraw/zinc/75/64/73/847756473.db2.gz XKGGDZVNONQZPD-UHFFFAOYSA-N 0 3 422.500 4.241 20 0 HIADHN COc1cc(CNCc2ccnc(-n3cccn3)c2)ccc1OCc1ccccc1 ZINC000030901029 847794428 /nfs/dbraw/zinc/79/44/28/847794428.db2.gz OKQZLBWYCARZAC-UHFFFAOYSA-N 0 3 400.482 4.145 20 0 HIADHN C[C@@H](NC(=O)NC[C@H](c1cccs1)N1CCC(C)CC1)c1ccc2c(c1)OCO2 ZINC000031101872 847822898 /nfs/dbraw/zinc/82/28/98/847822898.db2.gz DCADKESHFNJXSJ-SJLPKXTDSA-N 0 3 415.559 4.310 20 0 HIADHN Cc1ccc(-c2nc(CC(=O)N[C@H]3CCCN(Cc4ccccc4)C3)cs2)cc1 ZINC000031565523 847908658 /nfs/dbraw/zinc/90/86/58/847908658.db2.gz OPNNDNAGQHKMQU-NRFANRHFSA-N 0 3 405.567 4.442 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cnn(-c2ccccn2)c1C(C)C)c1ccsc1 ZINC000031983071 847974727 /nfs/dbraw/zinc/97/47/27/847974727.db2.gz HDNWAZHEKGLWCB-LJQANCHMSA-N 0 3 411.575 4.265 20 0 HIADHN Cc1ccc(C(=O)NC[C@H](c2cccs2)N2CCCC2)cc1NC(=O)c1ccco1 ZINC000032238945 847993612 /nfs/dbraw/zinc/99/36/12/847993612.db2.gz TYIXCGSHAOZJNP-LJQANCHMSA-N 0 3 423.538 4.469 20 0 HIADHN C[C@H](CN1CCCCC1)NC(=O)c1cccnc1Oc1ccc(Br)cc1 ZINC000032247159 847994748 /nfs/dbraw/zinc/99/47/48/847994748.db2.gz GPOVMHIDDIFRIV-OAHLLOKOSA-N 0 3 418.335 4.241 20 0 HIADHN CC(C)[N@H+](C)Cc1ccccc1C[N-]S(=O)(=O)c1cc(Cl)sc1Cl ZINC000032441325 848026706 /nfs/dbraw/zinc/02/67/06/848026706.db2.gz LTWDBWLBUDYSLD-UHFFFAOYSA-N 0 3 407.388 4.374 20 0 HIADHN CC(C)[N@@H+](C)Cc1ccccc1C[N-]S(=O)(=O)c1cc(Cl)sc1Cl ZINC000032441325 848026711 /nfs/dbraw/zinc/02/67/11/848026711.db2.gz LTWDBWLBUDYSLD-UHFFFAOYSA-N 0 3 407.388 4.374 20 0 HIADHN CC[C@H](CNC(=O)CCc1ncc(-c2ccccc2)o1)N1CCc2ccccc2C1 ZINC000032447182 848028034 /nfs/dbraw/zinc/02/80/34/848028034.db2.gz OFOIEFXLVXAVGJ-JOCHJYFZSA-N 0 3 403.526 4.227 20 0 HIADHN CC[NH+](CC)CCOC1CCN(C(=O)c2cc(Oc3ccccc3)ccc2[O-])CC1 ZINC000436576921 861857844 /nfs/dbraw/zinc/85/78/44/861857844.db2.gz RXFJNVWSNHSQPO-UHFFFAOYSA-N 0 3 412.530 4.148 20 0 HIADHN Cc1cc(C(=O)NC[C@@H](c2ccccc2)N(C)C)cc(C)c1OCc1cccnc1 ZINC000032480542 848037008 /nfs/dbraw/zinc/03/70/08/848037008.db2.gz JKMZDEVYASGZGF-QHCPKHFHSA-N 0 3 403.526 4.310 20 0 HIADHN O=C(CCCc1nnc(-c2ccccc2)o1)NC[C@H](c1cccs1)N1CCCC1 ZINC000032485350 848037924 /nfs/dbraw/zinc/03/79/24/848037924.db2.gz GTSAZPQOCYJTEX-GOSISDBHSA-N 0 3 410.543 4.074 20 0 HIADHN C/C=C/c1ccc(OCC(=O)NC[C@@H](c2cccs2)N2CCCC2)c(OC)c1 ZINC000032761372 848072420 /nfs/dbraw/zinc/07/24/20/848072420.db2.gz DSSXWDZKNFRIEA-JGIVAVPZSA-N 0 3 400.544 4.122 20 0 HIADHN C[C@H](OC[C@H](O)CN1CCC[C@@H]1c1ccc2c(c1)OCCO2)c1ccc(Cl)cc1 ZINC000032769090 848074106 /nfs/dbraw/zinc/07/41/06/848074106.db2.gz DBMRNOUGBYIQNM-ZLGUVYLKSA-N 0 3 417.933 4.387 20 0 HIADHN COc1cccc([C@H](CNC(=O)Cc2ccc(Cl)cc2Cl)N2CCCC2)c1 ZINC000036074961 848146132 /nfs/dbraw/zinc/14/61/32/848146132.db2.gz WYFRSVPDXDYYKY-FQEVSTJZSA-N 0 3 407.341 4.498 20 0 HIADHN CCc1ccc([C@H](CNC(=O)c2c(C)nn(-c3ccccc3)c2Cl)N(C)C)cc1 ZINC000036700619 848155563 /nfs/dbraw/zinc/15/55/63/848155563.db2.gz JYPAWIAYWPYFEX-FQEVSTJZSA-N 0 3 410.949 4.429 20 0 HIADHN C[C@@H](Oc1ccc(Br)cc1)C(=O)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000036883710 848171946 /nfs/dbraw/zinc/17/19/46/848171946.db2.gz OSRAZGJCVKQBAL-UZLBHIALSA-N 0 3 417.347 4.170 20 0 HIADHN CCOc1ccc(-c2noc(CCC(=O)C(C#N)c3nc4ccccc4o3)n2)cc1 ZINC000041540134 848228700 /nfs/dbraw/zinc/22/87/00/848228700.db2.gz CEXIJEGDUOOLBL-MRXNPFEDSA-N 0 3 402.410 4.086 20 0 HIADHN C[C@H](NC(=O)OC(C)(C)C)C(=O)C(C#N)c1nc2cc(C(F)(F)F)ccc2s1 ZINC000041548471 848229352 /nfs/dbraw/zinc/22/93/52/848229352.db2.gz GPLMJYVMCOJYSG-ONGXEEELSA-N 0 3 413.421 4.405 20 0 HIADHN C[C@@H](NC(=O)c1ccccc1)C(=O)C(C#N)c1nc2cc(C(F)(F)F)ccc2s1 ZINC000041549357 848230514 /nfs/dbraw/zinc/23/05/14/848230514.db2.gz VTCKNBXQKYRRPW-BXUZGUMPSA-N 0 3 417.412 4.310 20 0 HIADHN CN(C)c1ccc(CNCc2cn(Cc3ccccc3)nc2-c2cccs2)cn1 ZINC000042227654 848305203 /nfs/dbraw/zinc/30/52/03/848305203.db2.gz AFNWVPILXJDRJZ-UHFFFAOYSA-N 0 3 403.555 4.411 20 0 HIADHN c1csc(-c2nn(-c3ccccc3)cc2CNCc2cccnc2-n2ccnc2)c1 ZINC000042226982 848305952 /nfs/dbraw/zinc/30/59/52/848305952.db2.gz DMGRSUMWLLCGHK-UHFFFAOYSA-N 0 3 412.522 4.471 20 0 HIADHN COc1cc(-c2ccccc2)ccc1C[NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1 ZINC000436676797 861891942 /nfs/dbraw/zinc/89/19/42/861891942.db2.gz TWDQSBYWSCKLRP-UHFFFAOYSA-N 0 3 416.521 4.462 20 0 HIADHN Cn1ccnc1COc1ccc(CN2CCC[C@@H]2c2ccc3c(c2)OCCO3)cc1 ZINC000042743430 848350906 /nfs/dbraw/zinc/35/09/06/848350906.db2.gz ZIQFRNBADFSHMJ-OAQYLSRUSA-N 0 3 405.498 4.107 20 0 HIADHN CCOc1c(Br)cc(Br)cc1CNC[C@H]1CCCCO1 ZINC000042816283 848356209 /nfs/dbraw/zinc/35/62/09/848356209.db2.gz BPIFUXYJDGFUJP-CYBMUJFWSA-N 0 3 407.146 4.269 20 0 HIADHN CN(C)[C@@H](CNC(=O)c1ccccc1SCc1cscn1)Cc1ccccc1 ZINC000043109653 848385782 /nfs/dbraw/zinc/38/57/82/848385782.db2.gz KVQKTGXEXBWYNL-LJQANCHMSA-N 0 3 411.596 4.338 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3ccc(O)c(CC)c3)c(OCC)c2)CC1 ZINC000436709309 861898531 /nfs/dbraw/zinc/89/85/31/861898531.db2.gz VJIQLWQNGVXXNW-UHFFFAOYSA-N 0 3 411.546 4.138 20 0 HIADHN C[C@@H](N[C@@H](C)c1cccc2ccccc21)C(=O)Nc1ccc(N2CCOCC2)cc1 ZINC000043303464 848406678 /nfs/dbraw/zinc/40/66/78/848406678.db2.gz XWUOELHCXASQKJ-RBUKOAKNSA-N 0 3 403.526 4.354 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1cc(OC)c(OC)cc1C)c1cccc(OC)c1 ZINC000043404672 848418194 /nfs/dbraw/zinc/41/81/94/848418194.db2.gz LQEDAHLBHSHWDG-HXUWFJFHSA-N 0 3 415.534 4.225 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NC[C@@H]3CCCc4ccccc43)c(C)c2)CC1 ZINC000043522147 848434216 /nfs/dbraw/zinc/43/42/16/848434216.db2.gz AQLFIQXZCBSCNR-NRFANRHFSA-N 0 3 406.574 4.379 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N[C@H](C)c3ccc(F)cc3F)c(C)c2)CC1 ZINC000043526538 848435601 /nfs/dbraw/zinc/43/56/01/848435601.db2.gz SWWRGICJGDCPPN-MRXNPFEDSA-N 0 3 402.489 4.298 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1cc2c(cc1Cl)OCCO2)c1ccsc1 ZINC000043902707 848488953 /nfs/dbraw/zinc/48/89/53/848488953.db2.gz ATKZTLGAIMRNHY-MRXNPFEDSA-N 0 3 409.939 4.377 20 0 HIADHN Cc1ccc(C(=O)N2c3ccccc3CC[C@H]2CN(C)C)cc1NC(=O)c1ccco1 ZINC000436724741 861910830 /nfs/dbraw/zinc/91/08/30/861910830.db2.gz QIKFMFVKMDXAGB-FQEVSTJZSA-N 0 3 417.509 4.364 20 0 HIADHN CC[C@H](CNC(=O)Nc1cccc(NC(=O)C(C)C)c1)N1CCc2ccccc2C1 ZINC000044083457 848512983 /nfs/dbraw/zinc/51/29/83/848512983.db2.gz NALLJUWEYOKVKU-JOCHJYFZSA-N 0 3 408.546 4.240 20 0 HIADHN CNC(=O)c1cccc(NC(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)c1C ZINC000044177442 848527392 /nfs/dbraw/zinc/52/73/92/848527392.db2.gz DDDQBHMTZQGEKD-IBGZPJMESA-N 0 3 414.575 4.011 20 0 HIADHN Cc1ccc(C)c(NC(=S)NCCCCN2CCN(Cc3ccccc3)CC2)c1 ZINC000044238509 848535809 /nfs/dbraw/zinc/53/58/09/848535809.db2.gz JQUZEGOAIQYEDK-UHFFFAOYSA-N 0 3 410.631 4.188 20 0 HIADHN Cc1ccc(NC(=O)NC(=O)[C@H](C)N[C@@H](C)c2ccc(OC(F)F)cc2)c(C)c1 ZINC000044803500 848606053 /nfs/dbraw/zinc/60/60/53/848606053.db2.gz BSAOQJAFRCEXJZ-GJZGRUSLSA-N 0 3 405.445 4.292 20 0 HIADHN FC(F)(F)c1ccc(-c2noc(CN3CCCN(Cc4ccccc4)CC3)n2)cc1 ZINC000045795011 848730079 /nfs/dbraw/zinc/73/00/79/848730079.db2.gz HGOAYBUYSHJUPQ-UHFFFAOYSA-N 0 3 416.447 4.463 20 0 HIADHN CC(C)(C)[C@@H](CN1CCc2ccccc2C1)NC(=O)c1cccc(Cn2ccnc2)c1 ZINC000045817615 848734941 /nfs/dbraw/zinc/73/49/41/848734941.db2.gz DICDMZWDCJKESW-XMMPIXPASA-N 0 3 416.569 4.134 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Cc1coc2cc(OC)ccc12)c1cccc(OC)c1 ZINC000045827587 848736534 /nfs/dbraw/zinc/73/65/34/848736534.db2.gz JHWLMBWIJVLPAA-QFIPXVFZSA-N 0 3 410.514 4.192 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1ccc2nc(C)c(C)nc2c1)c1cccc(OC)c1 ZINC000046729644 848920510 /nfs/dbraw/zinc/92/05/10/848920510.db2.gz SHEDSHVEHRGGHK-HSZRJFAPSA-N 0 3 406.530 4.068 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)CSCc1cn2cc(C)ccc2n1)c1ccsc1 ZINC000046940538 848963684 /nfs/dbraw/zinc/96/36/84/848963684.db2.gz ADIHPBPHPRGAAA-IBGZPJMESA-N 0 3 416.616 4.137 20 0 HIADHN CC(C)(CNC(=O)N(Cc1ccco1)Cc1ccco1)N1CCc2ccccc2C1 ZINC000046987080 848967947 /nfs/dbraw/zinc/96/79/47/848967947.db2.gz OZFCMDXXKVCAEL-UHFFFAOYSA-N 0 3 407.514 4.421 20 0 HIADHN CCCc1c(C(=O)NC2CCN(Cc3ccccc3)CC2)cnn1Cc1ccccc1 ZINC000047062679 848978338 /nfs/dbraw/zinc/97/83/38/848978338.db2.gz DWLUPIYIJFYSBC-UHFFFAOYSA-N 0 3 416.569 4.278 20 0 HIADHN C[C@H]1CCCCN1CCNC(=O)c1ccc(Cl)c(NC(=O)c2cccs2)c1 ZINC000047142709 848993279 /nfs/dbraw/zinc/99/32/79/848993279.db2.gz OLQKKZCOPAUYGE-AWEZNQCLSA-N 0 3 405.951 4.258 20 0 HIADHN O=C(NCc1ccccc1)C1CCN(Cc2ccc(OCC(F)(F)F)cc2)CC1 ZINC000047265371 849016974 /nfs/dbraw/zinc/01/69/74/849016974.db2.gz IVRXXLSAMJCAPG-UHFFFAOYSA-N 0 3 406.448 4.156 20 0 HIADHN CCOc1cc(C(=O)Nc2cccc(CN(C)C)c2)ccc1OCc1cccnc1 ZINC000047460499 849051469 /nfs/dbraw/zinc/05/14/69/849051469.db2.gz WAUITXOOZJSZLL-UHFFFAOYSA-N 0 3 405.498 4.373 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)Nc1cccc(OC(F)F)c1 ZINC000047521652 849062263 /nfs/dbraw/zinc/06/22/63/849062263.db2.gz DIOBSRAXXMVJGJ-UHFFFAOYSA-N 0 3 418.488 4.012 20 0 HIADHN CCCC(=O)Nc1cccc(NC(=O)NC[C@H](c2cccs2)N2CCCC2)c1 ZINC000047715222 849097381 /nfs/dbraw/zinc/09/73/81/849097381.db2.gz MVDVMZGPYRTKBP-GOSISDBHSA-N 0 3 400.548 4.445 20 0 HIADHN CC(C)CNC(=O)c1ccc(NC(=O)NC[C@@H](c2ccccc2)N2CCCC2)cc1 ZINC000047729786 849100445 /nfs/dbraw/zinc/10/04/45/849100445.db2.gz MRHCXCBQBFGUMN-QFIPXVFZSA-N 0 3 408.546 4.031 20 0 HIADHN CCCC(=O)Nc1cccc(CNC(=O)NC[C@@H](c2ccccc2)N2CCCC2)c1 ZINC000047949414 849142528 /nfs/dbraw/zinc/14/25/28/849142528.db2.gz BATCRJMNNGWWMH-QFIPXVFZSA-N 0 3 408.546 4.062 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)N[C@@H](c1ccccc1)c1ccccn1 ZINC000047948756 849142611 /nfs/dbraw/zinc/14/26/11/849142611.db2.gz VAVBOOHPTBZITI-ZEQRLZLVSA-N 0 3 400.526 4.307 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1ccc(C(=O)NC(C)C)cc1)c1ccsc1 ZINC000048106741 849168212 /nfs/dbraw/zinc/16/82/12/849168212.db2.gz JDRWZIBXHUFITO-LJQANCHMSA-N 0 3 402.564 4.091 20 0 HIADHN CCc1ccc([C@H](CNC(=O)[C@H](C)Sc2ccc(NC(C)=O)cc2)N(C)C)cc1 ZINC000048184801 849186511 /nfs/dbraw/zinc/18/65/11/849186511.db2.gz ZBGDSLRYPWVDDX-AOMKIAJQSA-N 0 3 413.587 4.107 20 0 HIADHN CC(=O)Nc1ccc(S[C@H](C)C(=O)NC[C@H](c2ccccc2)N2CCCC2)cc1 ZINC000048185619 849187533 /nfs/dbraw/zinc/18/75/33/849187533.db2.gz JODSBDFBUHCQKX-VGOFRKELSA-N 0 3 411.571 4.079 20 0 HIADHN O=C(CCC(=O)c1ccc(F)cc1F)NCc1ccccc1CN1CCCCC1 ZINC000048399454 849216429 /nfs/dbraw/zinc/21/64/29/849216429.db2.gz BJVKAFXYLISADG-UHFFFAOYSA-N 0 3 400.469 4.230 20 0 HIADHN CCCCCNC(=O)C(C#N)C(=O)Cc1c(C)nn(-c2ccc(C)c(Cl)c2)c1C ZINC000049252804 849299832 /nfs/dbraw/zinc/29/98/32/849299832.db2.gz SFUDGGPFFAQMBM-LJQANCHMSA-N 0 3 414.937 4.009 20 0 HIADHN C[C@@H]([NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1)c1cccc(OC(F)(F)F)c1 ZINC000436825342 862007712 /nfs/dbraw/zinc/00/77/12/862007712.db2.gz DBGDIUKDUMALBJ-CQSZACIVSA-N 0 3 408.420 4.246 20 0 HIADHN C[C@@H]([NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1)c1ccc(Br)s1 ZINC000436828848 862009464 /nfs/dbraw/zinc/00/94/64/862009464.db2.gz NWBFGBKIHAVCGO-GFCCVEGCSA-N 0 3 409.349 4.172 20 0 HIADHN O=C(c1ccccc1[O-])N1CCC([NH2+][C@@H]2CCSc3c(Cl)cccc32)CC1 ZINC000436828405 862009720 /nfs/dbraw/zinc/00/97/20/862009720.db2.gz MHMKQNYMERJEAJ-GOSISDBHSA-N 0 3 402.947 4.477 20 0 HIADHN O=C(c1ccccc1[O-])N1CCC([NH2+][C@H]2CCCOc3c(Cl)cccc32)CC1 ZINC000436828315 862010466 /nfs/dbraw/zinc/01/04/66/862010466.db2.gz LWVAAHWQTHBVPS-IBGZPJMESA-N 0 3 400.906 4.154 20 0 HIADHN COc1ccc2oc([C@@H](C)[NH2+]C3CCN(C(=O)c4ccccc4[O-])CC3)c(C)c2c1 ZINC000436833744 862015084 /nfs/dbraw/zinc/01/50/84/862015084.db2.gz YYFLZSZNDCQUNV-MRXNPFEDSA-N 0 3 408.498 4.411 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCc3cccc(OC(F)F)c3)c(C)c2)CC1 ZINC000051190536 849441869 /nfs/dbraw/zinc/44/18/69/849441869.db2.gz JLOFUVPTDJBBOC-UHFFFAOYSA-N 0 3 418.488 4.060 20 0 HIADHN Cc1cc(N2CCSCC2)ccc1NC(=O)N(CCN(C)C)Cc1ccccc1 ZINC000051673453 849502318 /nfs/dbraw/zinc/50/23/18/849502318.db2.gz SMRFFSAHDGMIFU-UHFFFAOYSA-N 0 3 412.603 4.144 20 0 HIADHN COc1ccc([C@@H](C)NCc2ccc(N3CCOCC3)cc2)cc1Br ZINC000052918785 849645934 /nfs/dbraw/zinc/64/59/34/849645934.db2.gz BDEXHSKMIZSLQL-OAHLLOKOSA-N 0 3 405.336 4.145 20 0 HIADHN CN(C)Cc1cccc(NC(=O)[C@@H]2CCN(c3ccc(Cl)c(Cl)c3)C2=O)c1 ZINC000053477340 849718268 /nfs/dbraw/zinc/71/82/68/849718268.db2.gz LFPHPJLWGGYKTI-INIZCTEOSA-N 0 3 406.313 4.047 20 0 HIADHN CN(Cc1ccc(OC(F)F)cc1)C(=O)NC[C@H](c1ccccc1)N1CCCC1 ZINC000053547620 849729896 /nfs/dbraw/zinc/72/98/96/849729896.db2.gz HCEZGUJEBKJGHX-HXUWFJFHSA-N 0 3 403.473 4.267 20 0 HIADHN COc1cccc([C@@H](CNC(=O)N[C@H](C)c2ccc(OC)c(F)c2)N2CCCC2)c1 ZINC000053553122 849730951 /nfs/dbraw/zinc/73/09/51/849730951.db2.gz XQPNYFCAHNDDFO-IIBYNOLFSA-N 0 3 415.509 4.040 20 0 HIADHN NC(=O)C1CCN(Cc2cccc(NC(=O)c3cc(Cl)sc3Cl)c2)CC1 ZINC000053996673 849790424 /nfs/dbraw/zinc/79/04/24/849790424.db2.gz YITBIUPCNXYWJR-UHFFFAOYSA-N 0 3 412.342 4.005 20 0 HIADHN Cc1nc(-c2ccc(CNC(=O)NC[C@H](c3cccs3)N3CCCC3)o2)cs1 ZINC000054044463 849804203 /nfs/dbraw/zinc/80/42/03/849804203.db2.gz DBGBBEPNSXOVBJ-QGZVFWFLSA-N 0 3 416.572 4.409 20 0 HIADHN COc1cc(CNCc2cc(-c3ccccc3)cs2)ccc1OCC(=O)N(C)C ZINC000054175230 849820725 /nfs/dbraw/zinc/82/07/25/849820725.db2.gz HOJQLMKAXFUBAF-UHFFFAOYSA-N 0 3 410.539 4.181 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)c2cnn(-c3ccccc3)c2C2CC2)C1 ZINC000054223667 849828911 /nfs/dbraw/zinc/82/89/11/849828911.db2.gz GANKSOIWKQRXGR-RXVVDRJESA-N 0 3 400.526 4.315 20 0 HIADHN C[C@@H](NCc1cccc(OC2CCCC2)c1)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000054808672 849926673 /nfs/dbraw/zinc/92/66/73/849926673.db2.gz RJKRCQZXSUYRCN-QGZVFWFLSA-N 0 3 402.560 4.109 20 0 HIADHN S=C(NCCCCN1CCN(c2ccccc2)CC1)Nc1ccccc1Cl ZINC000054939613 849943425 /nfs/dbraw/zinc/94/34/25/849943425.db2.gz UDEZOOPHKRKSTP-UHFFFAOYSA-N 0 3 402.995 4.229 20 0 HIADHN O=C(NC1CCCCC1)NC1CCN(Cc2ccc(OCC(F)(F)F)cc2)CC1 ZINC000055029576 849957931 /nfs/dbraw/zinc/95/79/31/849957931.db2.gz OMDYRYCJFCTYGJ-UHFFFAOYSA-N 0 3 413.484 4.224 20 0 HIADHN Cc1cc(NC(=O)c2cccc(F)c2)sc1C(=O)NC[C@@H](C)N1CCCC[C@@H]1C ZINC000055362506 850006595 /nfs/dbraw/zinc/00/65/95/850006595.db2.gz XIZNXFAFCYAGAC-JKSUJKDBSA-N 0 3 417.550 4.441 20 0 HIADHN CCOc1ccc(NC(=O)[C@@H](C)N[C@@H](C)c2ccc(NC(=O)NC3CC3)cc2)cc1 ZINC000056159751 850263453 /nfs/dbraw/zinc/26/34/53/850263453.db2.gz IQQJRYMCUZRKFB-JKSUJKDBSA-N 0 3 410.518 4.047 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)c2[nH]c3ccccc3c2Br)C1 ZINC000056168804 850268380 /nfs/dbraw/zinc/26/83/80/850268380.db2.gz KSCLUHLIOVTPDO-ZBFHGGJFSA-N 0 3 412.331 4.496 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(NC(=O)c2ccc(F)cc2)cc1)C(=O)NCc1ccccc1 ZINC000056207210 850283319 /nfs/dbraw/zinc/28/33/19/850283319.db2.gz GFKKRYDRAPSQGV-QZTJIDSGSA-N 0 3 419.500 4.434 20 0 HIADHN CC(=O)Nc1c(C)ccc(NC(=O)NC[C@@H](c2cccs2)N2CCCC2)c1C ZINC000056691471 850440281 /nfs/dbraw/zinc/44/02/81/850440281.db2.gz BTUMMTUORPTBCG-SFHVURJKSA-N 0 3 400.548 4.282 20 0 HIADHN CC[C@H](CNC(=O)Nc1ccc(-c2csnn2)cc1)N1CCc2ccccc2C1 ZINC000056787630 850482178 /nfs/dbraw/zinc/48/21/78/850482178.db2.gz MBERPLZUEHYTNI-HXUWFJFHSA-N 0 3 407.543 4.164 20 0 HIADHN CC(C)[C@@H](NC(=O)N(CCN(C)C)Cc1ccc(F)cc1)c1nc2ccccc2[nH]1 ZINC000056791693 850484366 /nfs/dbraw/zinc/48/43/66/850484366.db2.gz QAIFYRWYGNPFTD-OAQYLSRUSA-N 0 3 411.525 4.173 20 0 HIADHN CC(C)[C@H](NC(=O)N(CCN(C)C)Cc1ccc(F)cc1)c1nc2ccccc2[nH]1 ZINC000056791692 850485011 /nfs/dbraw/zinc/48/50/11/850485011.db2.gz QAIFYRWYGNPFTD-NRFANRHFSA-N 0 3 411.525 4.173 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)[C@@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000057114005 850550111 /nfs/dbraw/zinc/55/01/11/850550111.db2.gz JAKGHBWGDJYQME-RTBURBONSA-N 0 3 411.512 4.074 20 0 HIADHN O=C(c1ccccc1[O-])N1CCC([NH2+]Cc2ccc(-c3cccc(F)c3F)o2)CC1 ZINC000436978330 862156160 /nfs/dbraw/zinc/15/61/60/862156160.db2.gz HFSXJUXKAWZWNM-UHFFFAOYSA-N 0 3 412.436 4.325 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1cccc(-n2cccn2)c1)c1cccc(OC)c1 ZINC000057863136 850734469 /nfs/dbraw/zinc/73/44/69/850734469.db2.gz FMZJMJLYCMOHQN-QFIPXVFZSA-N 0 3 407.518 4.086 20 0 HIADHN Cc1ccc(SCCC(=O)NCCCCN2CCN(c3ccccc3)CC2)cc1 ZINC000058489759 850837283 /nfs/dbraw/zinc/83/72/83/850837283.db2.gz GAPRIDOQQQXUBP-UHFFFAOYSA-N 0 3 411.615 4.196 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cnn(-c2ccc(F)cc2)c1C)c1cccc(OC)c1 ZINC000058678797 850885957 /nfs/dbraw/zinc/88/59/57/850885957.db2.gz SMJYDORJFUEGIC-QHCPKHFHSA-N 0 3 424.520 4.141 20 0 HIADHN Clc1cccc(-c2ccc(C[NH+]3CCN(c4ncnc5[n-]cnc54)CC3)s2)c1 ZINC000058759848 850915347 /nfs/dbraw/zinc/91/53/47/850915347.db2.gz ZGPBLJKSMRUMGR-UHFFFAOYSA-N 0 3 410.934 4.057 20 0 HIADHN CC(=O)CCc1ccc(OCCC(=O)N2CCCN(Cc3ccccc3C)CC2)cc1 ZINC000058804716 850932393 /nfs/dbraw/zinc/93/23/93/850932393.db2.gz INOWATMYWFNKDP-UHFFFAOYSA-N 0 3 422.569 4.020 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)CCCC[C@H]2CCSS2)CC1 ZINC000058954444 850967984 /nfs/dbraw/zinc/96/79/84/850967984.db2.gz DYXXOWKIDXCLOQ-NRFANRHFSA-N 0 3 421.676 4.154 20 0 HIADHN COc1ccccc1C[C@H]1CCCN1Cc1csc(-c2ccc(C(N)=O)cc2)n1 ZINC000058976929 850971594 /nfs/dbraw/zinc/97/15/94/850971594.db2.gz KRPDSEIYPAZLFF-HXUWFJFHSA-N 0 3 407.539 4.125 20 0 HIADHN CC(C)Oc1cc(Br)ccc1C(=O)NC[C@H](c1ccccc1)N(C)C ZINC000060030049 851031783 /nfs/dbraw/zinc/03/17/83/851031783.db2.gz QHMVJNBJVAPEDD-GOSISDBHSA-N 0 3 405.336 4.269 20 0 HIADHN CN(C)CCN(C(=O)Cc1csc2nc(-c3ccccc3)cn12)c1ccccc1 ZINC000060208445 851052316 /nfs/dbraw/zinc/05/23/16/851052316.db2.gz UWAXNSBJBCGTCL-UHFFFAOYSA-N 0 3 404.539 4.200 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)c1ccc(F)cc1Br ZINC000060354248 851074113 /nfs/dbraw/zinc/07/41/13/851074113.db2.gz MGXQTQVTYWBROV-UHFFFAOYSA-N 0 3 415.253 4.070 20 0 HIADHN O=C(c1cccnc1SC(F)(F)F)N1CCCN(CCCc2ccccc2)CC1 ZINC000060355292 851075282 /nfs/dbraw/zinc/07/52/82/851075282.db2.gz ZDLCOKZCTNRZGP-UHFFFAOYSA-N 0 3 423.504 4.474 20 0 HIADHN Cc1ccc(OC[C@@H](O)CN2CCC(c3nc4cc(Cl)ccc4o3)CC2)cc1 ZINC000060477746 851113836 /nfs/dbraw/zinc/11/38/36/851113836.db2.gz SSRPXXOBBNJVBP-SFHVURJKSA-N 0 3 400.906 4.409 20 0 HIADHN COc1ccccc1-c1nc(C(=O)N(CCCc2ccccc2)CCN(C)C)cs1 ZINC000060480375 851114024 /nfs/dbraw/zinc/11/40/24/851114024.db2.gz XDGMKKDDXJEXDT-UHFFFAOYSA-N 0 3 423.582 4.455 20 0 HIADHN COc1ccc([C@H](CNC(=O)CCOc2ccc(Cl)cc2)N2CCCC2)cc1 ZINC000060501645 851123366 /nfs/dbraw/zinc/12/33/66/851123366.db2.gz XKDITMXTWRFEFQ-NRFANRHFSA-N 0 3 402.922 4.071 20 0 HIADHN CN(C)CCN(CCc1ccccc1)C(=O)c1cccc(NC(=O)OC(C)(C)C)c1 ZINC000060536478 851137834 /nfs/dbraw/zinc/13/78/34/851137834.db2.gz GMPVXTLDZOHRQT-UHFFFAOYSA-N 0 3 411.546 4.280 20 0 HIADHN CCOC(=O)c1c2c(sc1NC(=O)c1c(C)onc1CC)C(C)(C)NC(C)(C)C2 ZINC000060748876 851203801 /nfs/dbraw/zinc/20/38/01/851203801.db2.gz NWKFLWBMIGAZIA-UHFFFAOYSA-N 0 3 419.547 4.195 20 0 HIADHN COc1ccc([C@@H](CNCc2cc(OC)c(OC)cc2OC)N2CCCCC2)cc1 ZINC000060828324 851224969 /nfs/dbraw/zinc/22/49/69/851224969.db2.gz CHMKKTXJNSBJJA-OAQYLSRUSA-N 0 3 414.546 4.038 20 0 HIADHN Ic1ccccc1CNC[C@@H](c1ccco1)N1CCCCC1 ZINC000061013465 851273553 /nfs/dbraw/zinc/27/35/53/851273553.db2.gz IDCMMJDLSQHEBV-KRWDZBQOSA-N 0 3 410.299 4.201 20 0 HIADHN COCCOc1ccc([C@@H](C)NCc2ccc(F)c(Br)c2)cc1OC ZINC000061110330 851295224 /nfs/dbraw/zinc/29/52/24/851295224.db2.gz QKNFWCCPUZMHKE-CYBMUJFWSA-N 0 3 412.299 4.473 20 0 HIADHN Cc1ccccc1OCCCN(C)C(=O)c1ccc(N2CCN(C(C)C)CC2)cc1 ZINC000061187344 851312622 /nfs/dbraw/zinc/31/26/22/851312622.db2.gz QKACONZCHUIBIF-UHFFFAOYSA-N 0 3 409.574 4.067 20 0 HIADHN CCc1ccc([C@H](CNC(=O)NCc2csc(Br)c2)N(C)C)cc1 ZINC000061223311 851321316 /nfs/dbraw/zinc/32/13/16/851321316.db2.gz PZRWASMBSMXCSS-INIZCTEOSA-N 0 3 410.381 4.175 20 0 HIADHN CCOc1ccc([C@@H](C)NC(=O)NC[C@H](c2ccccc2)N2CCCC2)cc1OC ZINC000061231323 851323744 /nfs/dbraw/zinc/32/37/44/851323744.db2.gz WAHIHAXQUGVSOC-WIYYLYMNSA-N 0 3 411.546 4.291 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)c1csc(Br)c1 ZINC000061288106 851339243 /nfs/dbraw/zinc/33/92/43/851339243.db2.gz GFYVFWMTXSLTMD-UHFFFAOYSA-N 0 3 411.390 4.354 20 0 HIADHN CC(C)(C)n1nc(C(=O)Nc2ccc(CCN3CCSCC3)cc2)cc1C1CC1 ZINC000061287567 851339818 /nfs/dbraw/zinc/33/98/18/851339818.db2.gz QFSRROWYFCSRLU-UHFFFAOYSA-N 0 3 412.603 4.359 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)C2(c3cccc(F)c3)CCOCC2)N2CCCC2)cc1 ZINC000061502423 851389684 /nfs/dbraw/zinc/38/96/84/851389684.db2.gz XODWTSSBSLGTJL-HSZRJFAPSA-N 0 3 410.533 4.136 20 0 HIADHN CCOc1ccc(/C=C(/C#N)C(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)cc1 ZINC000061502909 851391430 /nfs/dbraw/zinc/39/14/30/851391430.db2.gz RWALOPNHXSRSOO-FOOJEKODSA-N 0 3 403.526 4.254 20 0 HIADHN CCc1ccc(C(=O)CCC(=O)Nc2ccc(CCN3CCSCC3)cc2)cc1 ZINC000061572679 851408757 /nfs/dbraw/zinc/40/87/57/851408757.db2.gz KYMNVWMOQHLZMQ-UHFFFAOYSA-N 0 3 410.583 4.442 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2cccc(N3CCCC3=O)c2)N2CCCC2)cc1 ZINC000061748275 851439078 /nfs/dbraw/zinc/43/90/78/851439078.db2.gz PFKBBKQOQATUBL-QFIPXVFZSA-N 0 3 406.530 4.080 20 0 HIADHN C[C@@H](OC(=O)C1CCN(c2ccccc2Br)C1=O)c1ccc(F)cc1F ZINC000061753346 851441067 /nfs/dbraw/zinc/44/10/67/851441067.db2.gz LLTPPZAHKYXVSS-BXUZGUMPSA-N 0 3 424.241 4.385 20 0 HIADHN C[C@@H](OC(=O)C1CCN(c2ccccc2Br)C1=O)c1cc(F)ccc1F ZINC000061753344 851441484 /nfs/dbraw/zinc/44/14/84/851441484.db2.gz UXTPVZHPRURYKV-DGCLKSJQSA-N 0 3 424.241 4.385 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2ccc(C(=O)NCC(C)C)cc2)N2CCCC2)cc1 ZINC000061772943 851446496 /nfs/dbraw/zinc/44/64/96/851446496.db2.gz AIHDSSAECKYDNN-QHCPKHFHSA-N 0 3 422.573 4.339 20 0 HIADHN CSc1ccc(CNC(=O)Nc2ccc(CCN3CCSCC3)cc2)cc1 ZINC000061790988 851453501 /nfs/dbraw/zinc/45/35/01/851453501.db2.gz PLYJHRJPBGNFCC-UHFFFAOYSA-N 0 3 401.601 4.322 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)C(=O)Nc1ccc(Cl)c(Cl)c1)c1ccccc1 ZINC000061878755 851467739 /nfs/dbraw/zinc/46/77/39/851467739.db2.gz QHWJYHHENOPGEK-SFHVURJKSA-N 0 3 408.329 4.131 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCc1ccc(Br)s1)c1ccsc1 ZINC000061941705 851475625 /nfs/dbraw/zinc/47/56/25/851475625.db2.gz ILLFTNFFDQVRGU-AWEZNQCLSA-N 0 3 416.410 4.454 20 0 HIADHN C[C@H](CNC(=O)[C@@H](C)SCc1ncc(-c2ccc(Cl)cc2)o1)N1CCCC1 ZINC000062244625 851515766 /nfs/dbraw/zinc/51/57/66/851515766.db2.gz VSAFBAVPJCQXRO-HUUCEWRRSA-N 0 3 407.967 4.217 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)Nc1ccc(OC(F)(F)F)cc1 ZINC000062372651 851531934 /nfs/dbraw/zinc/53/19/34/851531934.db2.gz MHKRRCXLUGVFMW-UHFFFAOYSA-N 0 3 417.378 4.459 20 0 HIADHN Cc1cc(NC(=O)N(CCN(C)C)Cc2cccc(F)c2)ccc1Br ZINC000062372895 851532157 /nfs/dbraw/zinc/53/21/57/851532157.db2.gz RRWNEICDCCDJSI-UHFFFAOYSA-N 0 3 408.315 4.492 20 0 HIADHN CC(C)C(=O)Nc1ccc(NC(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)cc1 ZINC000062378519 851534988 /nfs/dbraw/zinc/53/49/88/851534988.db2.gz GFZRNUXABZSYOB-UHFFFAOYSA-N 0 3 418.488 4.155 20 0 HIADHN CCOc1cc(CN[C@@H](C)c2cccc(NS(C)(=O)=O)c2)ccc1OCC(C)C ZINC000062421272 851549245 /nfs/dbraw/zinc/54/92/45/851549245.db2.gz SQIDLSZONLSRRN-KRWDZBQOSA-N 0 3 420.575 4.342 20 0 HIADHN Cc1c([C@H](C)NCC2CCN(CC(F)(F)F)CC2)nnn1-c1ccc(Cl)cc1 ZINC000437058270 862255562 /nfs/dbraw/zinc/25/55/62/862255562.db2.gz NOIDKXUDCBEARH-ZDUSSCGKSA-N 0 3 415.891 4.154 20 0 HIADHN CO[C@@H](CNC(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1)c1ccccc1 ZINC000062478277 851560375 /nfs/dbraw/zinc/56/03/75/851560375.db2.gz YVDKUYKIPMLUNH-FQEVSTJZSA-N 0 3 423.479 4.166 20 0 HIADHN Cc1ccc([C@H](NC(=O)N(CCN(C)C)Cc2ccc(F)cc2F)C2CC2)cc1 ZINC000062477092 851560566 /nfs/dbraw/zinc/56/05/66/851560566.db2.gz ILFMYPQVXJPDLI-QFIPXVFZSA-N 0 3 401.501 4.498 20 0 HIADHN CC(C)OCc1ccccc1CNC(=O)N(CCN(C)C)Cc1ccc(F)c(F)c1 ZINC000062487016 851563490 /nfs/dbraw/zinc/56/34/90/851563490.db2.gz CKDMPQFPBOFVHX-UHFFFAOYSA-N 0 3 419.516 4.163 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)N[C@@H]1CCSc2c(F)cccc21 ZINC000062486961 851563911 /nfs/dbraw/zinc/56/39/11/851563911.db2.gz IVKOPWGBMRCSPB-LJQANCHMSA-N 0 3 423.504 4.414 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)NCc1ncc(-c2ccccc2)o1 ZINC000062487750 851564250 /nfs/dbraw/zinc/56/42/50/851564250.db2.gz DOWBDJKMKBDGMF-UHFFFAOYSA-N 0 3 412.921 4.268 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)NCc1ccccc1N1CCCC1 ZINC000062501119 851566101 /nfs/dbraw/zinc/56/61/01/851566101.db2.gz GTHNOLSLDZAORB-UHFFFAOYSA-N 0 3 414.981 4.214 20 0 HIADHN C[C@@H](OCCCNC(=S)NC1CCN(Cc2ccccc2)CC1)c1ccccc1 ZINC000063145471 851621107 /nfs/dbraw/zinc/62/11/07/851621107.db2.gz NLEVCWXDGSFHFA-HXUWFJFHSA-N 0 3 411.615 4.283 20 0 HIADHN CC(C)Oc1ccc(CCNC(=S)NC2CCN(Cc3ccccc3)CC2)cc1 ZINC000063148325 851621966 /nfs/dbraw/zinc/62/19/66/851621966.db2.gz PGBGWFOSMCXCBJ-UHFFFAOYSA-N 0 3 411.615 4.145 20 0 HIADHN CC(C)[C@H](CNC(=S)NC1CCN(Cc2ccccc2)CC1)Nc1ccccc1 ZINC000063150637 851623904 /nfs/dbraw/zinc/62/39/04/851623904.db2.gz LNDRDSJXPAXZGC-QHCPKHFHSA-N 0 3 410.631 4.252 20 0 HIADHN CC(=O)CCc1ccc(O[C@@H](C)C(=O)NC[C@@H]2CCCCN2Cc2ccccc2)cc1 ZINC000063244992 851639467 /nfs/dbraw/zinc/63/94/67/851639467.db2.gz VHLQRHJDZPSDFZ-URXFXBBRSA-N 0 3 422.569 4.146 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCC(C)(C)c3ccccc3OC)c(C)c2)CC1 ZINC000063321544 851659798 /nfs/dbraw/zinc/65/97/98/851659798.db2.gz WNMLNNUKCRLNFR-UHFFFAOYSA-N 0 3 424.589 4.245 20 0 HIADHN COc1ccccc1C(C)(C)CNC(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000063408605 851681814 /nfs/dbraw/zinc/68/18/14/851681814.db2.gz OCDZDRCHBWGOTD-GOSISDBHSA-N 0 3 401.576 4.171 20 0 HIADHN CC(C)NS(=O)(=O)Cc1ccc(CNCc2cccc(OC3CCCC3)c2)cc1 ZINC000063549766 851712894 /nfs/dbraw/zinc/71/28/94/851712894.db2.gz ZDKBRNQLPOJFQC-UHFFFAOYSA-N 0 3 416.587 4.126 20 0 HIADHN Brc1ccc(CCNCc2ccccc2I)s1 ZINC000063560219 851714207 /nfs/dbraw/zinc/71/42/07/851714207.db2.gz XKOQSMCWNDGGDZ-UHFFFAOYSA-N 0 3 422.129 4.448 20 0 HIADHN CN1CCN(CCCCNC(=O)C2(c3ccc(C(C)(C)C)cc3)CCCCC2)CC1 ZINC000063783543 851761267 /nfs/dbraw/zinc/76/12/67/851761267.db2.gz FIFSIUZQNQHEAG-UHFFFAOYSA-N 0 3 413.650 4.330 20 0 HIADHN CN(C)CCN(Cc1ccc(Br)cc1)C(=S)Nc1ccccc1F ZINC000063790071 851764513 /nfs/dbraw/zinc/76/45/13/851764513.db2.gz FNWKJOGIHHPPPQ-UHFFFAOYSA-N 0 3 410.356 4.349 20 0 HIADHN Cc1noc(CSc2ccc(C(=O)N3CCN(CC4CCCCC4)CC3)cc2)n1 ZINC000064126158 851832092 /nfs/dbraw/zinc/83/20/92/851832092.db2.gz YZUISBSLOGUIMU-UHFFFAOYSA-N 0 3 414.575 4.008 20 0 HIADHN Cc1ccc([C@H](CNC(=O)NCc2ccc(N3CCCC3)cc2)N2CCCC2)cc1 ZINC000064237283 851855282 /nfs/dbraw/zinc/85/52/82/851855282.db2.gz XQYDFFVLGBGCBT-DEOSSOPVSA-N 0 3 406.574 4.232 20 0 HIADHN C[C@H](C(=O)Nc1ccccc1-c1ccccc1)N1CCC(CCN2CCOCC2)CC1 ZINC000064344473 851875308 /nfs/dbraw/zinc/87/53/08/851875308.db2.gz QDICTOLCZNMBRV-OAQYLSRUSA-N 0 3 421.585 4.115 20 0 HIADHN COc1cccc(CN(CCC(=O)Nc2cccc(Cl)c2)C[C@@H]2CCCO2)c1 ZINC000064400243 851889106 /nfs/dbraw/zinc/88/91/06/851889106.db2.gz JXDJOXRZEZHOOA-NRFANRHFSA-N 0 3 402.922 4.358 20 0 HIADHN COc1cccc(CN(C[C@@H](O)COc2ccc3ccccc3c2)C[C@@H]2CCCO2)c1 ZINC000064400313 851889351 /nfs/dbraw/zinc/88/93/51/851889351.db2.gz MBYQWNMBKGTHOK-BVAGGSTKSA-N 0 3 421.537 4.269 20 0 HIADHN CCOc1ccc(C(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)cc1OC ZINC000064470714 851905835 /nfs/dbraw/zinc/90/58/35/851905835.db2.gz DAGALDPADDPIGM-UHFFFAOYSA-N 0 3 424.463 4.317 20 0 HIADHN CC1CCN([C@H](CNC(=O)[C@H](c2ccccc2)n2cccn2)c2cccs2)CC1 ZINC000064895919 852014310 /nfs/dbraw/zinc/01/43/10/852014310.db2.gz DCKGEBQMPAFCMT-IRLDBZIGSA-N 0 3 408.571 4.123 20 0 HIADHN COc1ccc2cc(CNC(=O)N[C@H]3CCN([C@@H](C)c4ccccc4)C3)ccc2c1 ZINC000065029078 852043437 /nfs/dbraw/zinc/04/34/37/852043437.db2.gz CWACKNXHBVZWLX-MBSDFSHPSA-N 0 3 403.526 4.483 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)Nc1ccc(C(F)(F)F)cc1)c1ccc(N2CCOCC2)cc1 ZINC000065278441 852098017 /nfs/dbraw/zinc/09/80/17/852098017.db2.gz UDDMDNHZUIZQMN-CVEARBPZSA-N 0 3 421.463 4.220 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCCc3c[nH]c4cc(F)ccc34)c(C)c2)CC1 ZINC000065276880 852098186 /nfs/dbraw/zinc/09/81/86/852098186.db2.gz FLVLZAQKHADLDD-UHFFFAOYSA-N 0 3 423.536 4.122 20 0 HIADHN O[C@H](CO[C@@H]1CCCc2ccccc21)CN(Cc1cccc(F)c1)C[C@@H]1CCCO1 ZINC000065353142 852111927 /nfs/dbraw/zinc/11/19/27/852111927.db2.gz RPPSPFALYCTUTF-SONWIMMPSA-N 0 3 413.533 4.262 20 0 HIADHN O=C(Nc1cc(N2CCCC2=O)ccc1Cl)N1CCN(CC2CCCCC2)CC1 ZINC000065361370 852113476 /nfs/dbraw/zinc/11/34/76/852113476.db2.gz PMOXUVRBAIPYKO-UHFFFAOYSA-N 0 3 418.969 4.197 20 0 HIADHN Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000065376761 852116808 /nfs/dbraw/zinc/11/68/08/852116808.db2.gz DNQVEOFERWJAOF-QFIPXVFZSA-N 0 3 422.573 4.167 20 0 HIADHN CCC(C)(C)NC(=O)c1ccc(NC(=O)NC[C@@H](c2ccc(C)cc2)N(C)C)cc1 ZINC000065413479 852123689 /nfs/dbraw/zinc/12/36/89/852123689.db2.gz ROAKGSGNIKPENA-NRFANRHFSA-N 0 3 410.562 4.338 20 0 HIADHN Cc1noc(C2CCN(C[C@H](O)CO[C@@H](c3ccccc3)c3ccccc3C)CC2)n1 ZINC000065433629 852130461 /nfs/dbraw/zinc/13/04/61/852130461.db2.gz DRUFICYSTFAONU-UPVQGACJSA-N 0 3 421.541 4.033 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)Nc2cc3c(cc2Cl)OCCCO3)C1 ZINC000065440039 852133784 /nfs/dbraw/zinc/13/37/84/852133784.db2.gz LGMAWZBROYFDEE-RDJZCZTQSA-N 0 3 415.921 4.458 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)Nc2cccc(C(=O)NC(C)(C)C)c2)C1 ZINC000065448026 852136510 /nfs/dbraw/zinc/13/65/10/852136510.db2.gz DSEDQVKRORPUID-LAUBAEHRSA-N 0 3 408.546 4.172 20 0 HIADHN CC[C@@H](C)NC(=O)c1ccc(NC(=O)NCC(C)(C)N2CCc3ccccc3C2)cc1 ZINC000065459123 852143145 /nfs/dbraw/zinc/14/31/45/852143145.db2.gz JEFYVXKIWSGZNY-GOSISDBHSA-N 0 3 422.573 4.173 20 0 HIADHN COc1ccc([C@H]2CCCN2C(=O)NC[C@@H](c2ccc(C)cc2)N(C)C)c(OC)c1 ZINC000065467007 852143585 /nfs/dbraw/zinc/14/35/85/852143585.db2.gz KXFWRVYDMVLMSW-YADHBBJMSA-N 0 3 411.546 4.162 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N2CCC(c3nc4ccccc4[nH]3)CC2)N(C)C)cc1 ZINC000065466524 852143870 /nfs/dbraw/zinc/14/38/70/852143870.db2.gz MDGXEARGRXHORB-QFIPXVFZSA-N 0 3 405.546 4.063 20 0 HIADHN Cc1ccc([C@H](CNC(=O)NCc2ccc(Oc3ccc(F)cc3)nc2)N(C)C)cc1 ZINC000065469841 852145510 /nfs/dbraw/zinc/14/55/10/852145510.db2.gz SOKAQSNIULKCEE-QFIPXVFZSA-N 0 3 422.504 4.424 20 0 HIADHN CCOc1cc(CNC(=O)NC[C@@H](c2ccc(C)cc2)N(C)C)ccc1OC(F)F ZINC000065468649 852145520 /nfs/dbraw/zinc/14/55/20/852145520.db2.gz WJGJEPNPKGCRGL-SFHVURJKSA-N 0 3 421.488 4.097 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N[C@@H](C)c2ccc(OC(F)F)cc2)C1 ZINC000065522722 852166620 /nfs/dbraw/zinc/16/66/20/852166620.db2.gz LRFHIZNYHUFSKR-FCEWJHQRSA-N 0 3 403.473 4.484 20 0 HIADHN CCOC1CCN(C(=O)NC[C@@H](c2ccc(C(F)(F)F)cc2)N(CC)CC)CC1 ZINC000065697627 852223215 /nfs/dbraw/zinc/22/32/15/852223215.db2.gz CWUABSSGOAFWHA-IBGZPJMESA-N 0 3 415.500 4.299 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N[C@H](c3ccco3)c3ccccc3)cc2)CC1 ZINC000065737325 852239812 /nfs/dbraw/zinc/23/98/12/852239812.db2.gz QMNMDVSWTQXQKG-DEOSSOPVSA-N 0 3 403.526 4.329 20 0 HIADHN CCOC(=O)N(C)c1ccc(NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)cc1 ZINC000065882190 852301245 /nfs/dbraw/zinc/30/12/45/852301245.db2.gz UGKWKRSUCFVCNI-GOSISDBHSA-N 0 3 413.493 4.269 20 0 HIADHN Fc1cc(F)cc(Oc2ccc(CNCc3ccc(N4CCOCC4)nc3)cc2)c1 ZINC000065889900 852304458 /nfs/dbraw/zinc/30/44/58/852304458.db2.gz IDMJYUQZAOAWOU-UHFFFAOYSA-N 0 3 411.452 4.279 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)c1cc(-c2ccccc2Cl)on1 ZINC000065931611 852321696 /nfs/dbraw/zinc/32/16/96/852321696.db2.gz JSFKCTWHCLIATI-UHFFFAOYSA-N 0 3 401.869 4.338 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)c1cc(C2CC2)n(C(C)(C)C)n1 ZINC000065936653 852325253 /nfs/dbraw/zinc/32/52/53/852325253.db2.gz HYNKXHJWABIWRA-UHFFFAOYSA-N 0 3 402.970 4.373 20 0 HIADHN CC(C)NC(=O)Nc1ccc(C(=O)N(CCN(C)C)Cc2cccc(Cl)c2)cc1 ZINC000065936427 852325364 /nfs/dbraw/zinc/32/53/64/852325364.db2.gz UCVPAOADNIQUKQ-UHFFFAOYSA-N 0 3 416.953 4.074 20 0 HIADHN Cc1oc(-c2cccs2)nc1CC(=O)N(CCN(C)C)Cc1cccc(Cl)c1 ZINC000065936819 852325441 /nfs/dbraw/zinc/32/54/41/852325441.db2.gz DTDODPZBZIGJCQ-UHFFFAOYSA-N 0 3 417.962 4.498 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)c1cc(F)cc(Br)c1 ZINC000065937618 852326424 /nfs/dbraw/zinc/32/64/24/852326424.db2.gz UDKRRSIKBCRQSX-UHFFFAOYSA-N 0 3 415.253 4.070 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)c1c(Cl)c2ccccc2n1C ZINC000065937662 852326682 /nfs/dbraw/zinc/32/66/82/852326682.db2.gz HTQLZATZWKIBKB-UHFFFAOYSA-N 0 3 405.876 4.314 20 0 HIADHN Cc1nc(Cc2ccccc2)sc1C(=O)N(CCN(C)C)Cc1cccc(F)c1 ZINC000065939610 852327614 /nfs/dbraw/zinc/32/76/14/852327614.db2.gz ABMOKLXFRILCON-UHFFFAOYSA-N 0 3 411.546 4.385 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)c1ccc(NC(=O)OC(C)(C)C)cc1 ZINC000065940098 852329679 /nfs/dbraw/zinc/32/96/79/852329679.db2.gz WGDMCIBSAWFIOL-UHFFFAOYSA-N 0 3 415.509 4.377 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)Nc1ccc(Cl)nc1 ZINC000065984100 852339838 /nfs/dbraw/zinc/33/98/38/852339838.db2.gz VIJNYMSCJAVVKC-UHFFFAOYSA-N 0 3 400.832 4.350 20 0 HIADHN CN(C)[C@H](CNC(=O)c1cc(-c2cccnc2)nc2ccccc21)Cc1ccccc1 ZINC000069231033 852389174 /nfs/dbraw/zinc/38/91/74/852389174.db2.gz MYAGWFNSVCMBAJ-NRFANRHFSA-N 0 3 410.521 4.200 20 0 HIADHN O=C(NCc1ccc(OC2CCCC2)nc1)NC[C@H](c1cccs1)N1CCCC1 ZINC000071923245 852432288 /nfs/dbraw/zinc/43/22/88/852432288.db2.gz UHGHOTHZSCDZAD-LJQANCHMSA-N 0 3 414.575 4.101 20 0 HIADHN Cc1cc(=O)c(C(=O)Nc2ccc(CN3CCC(C)CC3)cc2)nn1-c1ccccc1 ZINC000071961570 852448334 /nfs/dbraw/zinc/44/83/34/852448334.db2.gz SMXSAPHZKAVVFX-UHFFFAOYSA-N 0 3 416.525 4.025 20 0 HIADHN Cc1ccc(Cc2nnc(NC(=O)[C@@H]3CCCN(Cc4ccccc4)C3)s2)cc1 ZINC000078671286 852525122 /nfs/dbraw/zinc/52/51/22/852525122.db2.gz QPRLUWVFLJSCAP-HXUWFJFHSA-N 0 3 406.555 4.288 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N[C@H](C)[C@H]3Oc4ccccc4[C@@H]3C)c(C)c2)CC1 ZINC000437183745 862376396 /nfs/dbraw/zinc/37/63/96/862376396.db2.gz WPWOKAZJINFBLX-GLDPYIMESA-N 0 3 422.573 4.212 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)C(=O)Nc3ccc(C(C)(C)C)cc3)c(C)c2)CC1 ZINC000437187432 862379213 /nfs/dbraw/zinc/37/92/13/862379213.db2.gz FHTYHFQSYUQAJG-UHFFFAOYSA-N 0 3 422.573 4.012 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cc4cnn(C(C)C)c4nc3C)c(C)c2)CC1 ZINC000105288210 852695852 /nfs/dbraw/zinc/69/58/52/852695852.db2.gz UMLGEPPWMYBPLF-UHFFFAOYSA-N 0 3 420.561 4.023 20 0 HIADHN CCCCc1ccc(NC(=O)C(=O)Nc2ccc(N3CCN(CC)CC3)cc2C)cc1 ZINC000437191633 862383808 /nfs/dbraw/zinc/38/38/08/862383808.db2.gz VORNXUICQTZSAM-UHFFFAOYSA-N 0 3 422.573 4.057 20 0 HIADHN CC(=O)Nc1ccc2c(CN3CCC(CCc4ccc(O)cc4)CC3)cc(=O)oc2c1 ZINC000105666357 852721076 /nfs/dbraw/zinc/72/10/76/852721076.db2.gz CGCBURVDCPTZMJ-UHFFFAOYSA-N 0 3 420.509 4.302 20 0 HIADHN CN(C)[C@@H](CNC(=O)CCCc1nc(-c2ccc(Cl)cc2)no1)c1ccccc1 ZINC000106118288 852755756 /nfs/dbraw/zinc/75/57/56/852755756.db2.gz MVHGGDMIOLDUFA-IBGZPJMESA-N 0 3 412.921 4.132 20 0 HIADHN CC(C)OCc1ccccc1CNC(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000107695570 852787166 /nfs/dbraw/zinc/78/71/66/852787166.db2.gz ZSUFCNQCZDGRDJ-FQEVSTJZSA-N 0 3 401.576 4.309 20 0 HIADHN CN1CCN(Cc2ccc(CNC(=O)Nc3ccc(Cl)c(Cl)c3)cc2)CC1 ZINC000107759745 852794050 /nfs/dbraw/zinc/79/40/50/852794050.db2.gz CTOFRMJRLWCJEE-UHFFFAOYSA-N 0 3 407.345 4.063 20 0 HIADHN Cc1nn(C(C)(C)C)c2nc(C3CC3)cc(C(=O)NC[C@@H](c3ccccc3)N(C)C)c12 ZINC000107766183 852794343 /nfs/dbraw/zinc/79/43/43/852794343.db2.gz JLYCZHSIOFEVIZ-NRFANRHFSA-N 0 3 419.573 4.405 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)Nc2ccccc2C(F)(F)F)CC1 ZINC000107964453 852812351 /nfs/dbraw/zinc/81/23/51/852812351.db2.gz YPMLSIPPNNUFEL-UHFFFAOYSA-N 0 3 420.479 4.165 20 0 HIADHN COc1ccccc1[C@@H](CNC(=O)[C@H]1CCCN1Cc1ccccc1)N1CCCCC1 ZINC000108934212 852895378 /nfs/dbraw/zinc/89/53/78/852895378.db2.gz DXTZVTYDYJYJJM-DNQXCXABSA-N 0 3 421.585 4.003 20 0 HIADHN CCN(Cc1ccc(OC)c(OC)c1)C(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000109338680 852955699 /nfs/dbraw/zinc/95/56/99/852955699.db2.gz BSRXIMBQXRPAGB-HXUWFJFHSA-N 0 3 414.521 4.104 20 0 HIADHN COc1ccc(Cl)cc1CN(C)C(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000109339789 852955741 /nfs/dbraw/zinc/95/57/41/852955741.db2.gz AHHWYJPKUOVSQI-KRWDZBQOSA-N 0 3 404.913 4.358 20 0 HIADHN O=C(NCc1ccc(N2CCCCCC2)nc1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000109347394 852956870 /nfs/dbraw/zinc/95/68/70/852956870.db2.gz OCEKPMIMHSGJTC-JOCHJYFZSA-N 0 3 424.564 4.130 20 0 HIADHN COc1ccccc1NC(=O)c1ccc(NC(=O)[C@@H](C)N(C)CC2CCCC2)cc1 ZINC000109423165 852969520 /nfs/dbraw/zinc/96/95/20/852969520.db2.gz HLFCGBHPPDPCSR-QGZVFWFLSA-N 0 3 409.530 4.397 20 0 HIADHN CSc1nc(C)c(CCC(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)c(C)n1 ZINC000109503991 852978232 /nfs/dbraw/zinc/97/82/32/852978232.db2.gz JVPCKAKCROXRQR-OAQYLSRUSA-N 0 3 412.603 4.010 20 0 HIADHN Cc1nc(-c2ccccc2)sc1C(=O)N(C)C1CCN(CCc2ccccn2)CC1 ZINC000109796151 853016032 /nfs/dbraw/zinc/01/60/32/853016032.db2.gz IKJOEPYZZMFHRY-UHFFFAOYSA-N 0 3 420.582 4.293 20 0 HIADHN O=S(=O)(c1cccc2ccccc21)N1CCC(N2CCc3ccccc3C2)CC1 ZINC000437223888 862418660 /nfs/dbraw/zinc/41/86/60/862418660.db2.gz WFWMKRSBTQIFST-UHFFFAOYSA-N 0 3 406.551 4.051 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CC[C@@H](c2ccc(OC)cc2)C1)c1ccsc1 ZINC000110066730 853055511 /nfs/dbraw/zinc/05/55/11/853055511.db2.gz MOXHYZHWBPPNSY-WIYYLYMNSA-N 0 3 401.576 4.339 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)C3(c4cccc(F)c4)CCCCC3)CC2)C[C@@H](C)O1 ZINC000110412635 853096167 /nfs/dbraw/zinc/09/61/67/853096167.db2.gz QYDLPWAENWPNLV-WOJBJXKFSA-N 0 3 416.581 4.375 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)c3cc4c(s3)-c3ccccc3CC4)CC2)C[C@@H](C)O1 ZINC000110414572 853097645 /nfs/dbraw/zinc/09/76/45/853097645.db2.gz QNBXQZQEFYJGIN-QZTJIDSGSA-N 0 3 424.610 4.475 20 0 HIADHN CC(C)Cn1cc(C(=O)N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)c2ccccc21 ZINC000110417423 853097666 /nfs/dbraw/zinc/09/76/66/853097666.db2.gz SBVSAUZTFQZKCL-BGYRXZFFSA-N 0 3 411.590 4.259 20 0 HIADHN CCCCN(CC)c1ccc(C(=O)N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)cc1 ZINC000110415854 853097979 /nfs/dbraw/zinc/09/79/79/853097979.db2.gz UAXLYBOLFYYNRF-OYRHEFFESA-N 0 3 415.622 4.274 20 0 HIADHN Cc1ccc(SCCC(=O)N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)cc1C ZINC000110452072 853101224 /nfs/dbraw/zinc/10/12/24/853101224.db2.gz ASCVLOXBZDLGCT-BGYRXZFFSA-N 0 3 404.620 4.133 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)c3cccc4c5c([nH]c43)CCCC5)CC2)C[C@@H](C)O1 ZINC000110451206 853101265 /nfs/dbraw/zinc/10/12/65/853101265.db2.gz BJLDAPFDSWCRKZ-QZTJIDSGSA-N 0 3 409.574 4.008 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)c3cc4c(s3)CCCCCC4)CC2)C[C@H](C)O1 ZINC000110456899 853102074 /nfs/dbraw/zinc/10/20/74/853102074.db2.gz JXRNYLNHCKNRIP-ROUUACIJSA-N 0 3 404.620 4.369 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1[nH]nc(C(C)C)c1Br)c1ccsc1 ZINC000111144853 853209614 /nfs/dbraw/zinc/20/96/14/853209614.db2.gz RJVPSIZNCCZVRF-CYBMUJFWSA-N 0 3 413.385 4.170 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)Nc3c(F)cccc3N3CCCC3)cc2)CC1 ZINC000111207881 853222554 /nfs/dbraw/zinc/22/25/54/853222554.db2.gz PECBWTJBFVVJMC-UHFFFAOYSA-N 0 3 410.537 4.209 20 0 HIADHN O=C(Nc1cccc(NC(=O)[C@H]2CCCN(Cc3cccnc3)C2)c1)c1cccs1 ZINC000115840335 853268050 /nfs/dbraw/zinc/26/80/50/853268050.db2.gz KUXQGPZLXPKUBQ-SFHVURJKSA-N 0 3 420.538 4.246 20 0 HIADHN O=C(CCN1CCC[C@@H]1c1ccc(Cl)cc1)Nc1ccc(N2CCOCC2)cc1 ZINC000115888847 853270333 /nfs/dbraw/zinc/27/03/33/853270333.db2.gz ILFZGWWGBCXVLS-JOCHJYFZSA-N 0 3 413.949 4.342 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)cc1Cl ZINC000115956187 853274339 /nfs/dbraw/zinc/27/43/39/853274339.db2.gz NJIUCMHVHGJKSU-UHFFFAOYSA-N 0 3 414.937 4.081 20 0 HIADHN CC(C)Oc1ccc(CC[C@H](C)NC(=O)[C@H]2CCCN(Cc3cccnc3)C2)cc1 ZINC000116394683 853300692 /nfs/dbraw/zinc/30/06/92/853300692.db2.gz JAWYTMKNIKHAQV-REWPJTCUSA-N 0 3 409.574 4.218 20 0 HIADHN COc1ccc(CCC2CCN(C(=O)[C@@H]3CCCN(Cc4cccnc4)C3)CC2)cc1 ZINC000116390790 853301023 /nfs/dbraw/zinc/30/10/23/853301023.db2.gz NUWGFGNEXHQYOP-XMMPIXPASA-N 0 3 421.585 4.174 20 0 HIADHN O=C(c1ccc(Br)cc1F)N1CCCN(CCCc2ccccc2)CC1 ZINC000116597554 853317881 /nfs/dbraw/zinc/31/78/81/853317881.db2.gz HHQKPAIVBDKQGK-UHFFFAOYSA-N 0 3 419.338 4.369 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2cccc(NC(=O)C3CC3)c2)N2CCCC2)cc1 ZINC000139339551 853408750 /nfs/dbraw/zinc/40/87/50/853408750.db2.gz HGIBEDGNCDOFDY-JOCHJYFZSA-N 0 3 406.530 4.302 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)c(C)c1CNCc1ccc(N2CCOCC2)cc1 ZINC000139985526 853428913 /nfs/dbraw/zinc/42/89/13/853428913.db2.gz YUWMUFJBXSBQNS-UHFFFAOYSA-N 0 3 410.949 4.269 20 0 HIADHN O=c1ccccn1Cc1ccc(CNCc2c[nH]nc2-c2ccc(Cl)cc2)cc1 ZINC000140417955 853444276 /nfs/dbraw/zinc/44/42/76/853444276.db2.gz ZSNRLOJFSXCMOJ-UHFFFAOYSA-N 0 3 404.901 4.230 20 0 HIADHN COc1cccc(CN2CCC(NC(=O)c3sc(C(C)(C)C)nc3C)CC2)c1 ZINC000140652806 853449667 /nfs/dbraw/zinc/44/96/67/853449667.db2.gz ZNMNNBWHPGCBGK-UHFFFAOYSA-N 0 3 401.576 4.152 20 0 HIADHN CC(=O)Nc1cccc([C@H](C)NC(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)c1 ZINC000141738168 853479454 /nfs/dbraw/zinc/47/94/54/853479454.db2.gz BFYDLKDIGWXRGF-FDDCHVKYSA-N 0 3 408.546 4.151 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)NCc2ncc(-c3ccccc3)o2)N2CCCC2)cc1 ZINC000141728846 853480074 /nfs/dbraw/zinc/48/00/74/853480074.db2.gz HSYLUDNERRSODB-OAQYLSRUSA-N 0 3 404.514 4.286 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)C2(c3ccccc3C)CCOCC2)N2CCCC2)cc1 ZINC000143024012 853505982 /nfs/dbraw/zinc/50/59/82/853505982.db2.gz NRNVITWXTUCWOL-XMMPIXPASA-N 0 3 406.570 4.305 20 0 HIADHN c1[nH]nc(-c2cccnc2)c1CNCc1cn(-c2ccccc2)nc1-c1ccncc1 ZINC000143095976 853507422 /nfs/dbraw/zinc/50/74/22/853507422.db2.gz XMUZYYATYALXDP-UHFFFAOYSA-N 0 3 407.481 4.009 20 0 HIADHN O[C@H](CNCc1ccccc1OCc1ccccn1)c1ccc(OC(F)(F)F)cc1 ZINC000143075512 853507653 /nfs/dbraw/zinc/50/76/53/853507653.db2.gz MFNVPFHINOJKMS-HXUWFJFHSA-N 0 3 418.415 4.382 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Cc2csc(-c3ccccn3)n2)N2CCCC2)cc1 ZINC000143195258 853509569 /nfs/dbraw/zinc/50/95/69/853509569.db2.gz QVCUPBOFLDZPLH-OAQYLSRUSA-N 0 3 406.555 4.009 20 0 HIADHN COCCCCN(Cc1ccccc1)Cc1cc(=O)n2c3ccccc3[nH]c2c1C#N ZINC000144950686 853543185 /nfs/dbraw/zinc/54/31/85/853543185.db2.gz HUJPGXZSDRBJHE-NRFANRHFSA-N 0 3 414.509 4.152 20 0 HIADHN S=C(Nc1cc2c(cc1Cl)OCCO2)NC1CCN(Cc2ccccc2)CC1 ZINC000145508968 853552073 /nfs/dbraw/zinc/55/20/73/853552073.db2.gz DSIUMZYRUPBTOZ-UHFFFAOYSA-N 0 3 417.962 4.062 20 0 HIADHN FC(F)(F)c1ccc(CNC(=S)NC2CCN(Cc3ccccc3)CC2)cc1 ZINC000145505154 853552543 /nfs/dbraw/zinc/55/25/43/853552543.db2.gz VBHDGNSVTINNRG-UHFFFAOYSA-N 0 3 407.505 4.334 20 0 HIADHN N#CC(C(=O)Cc1csc(-c2ccc(Cl)s2)n1)C(=O)Nc1ccccc1 ZINC000150046842 853636828 /nfs/dbraw/zinc/63/68/28/853636828.db2.gz VDRJSJMURVPCKA-ZDUSSCGKSA-N 0 3 401.900 4.415 20 0 HIADHN C[C@@H]1CN(C(=O)c2ccc(CNCc3ccc(C(F)(F)F)cc3)cc2)C[C@H](C)O1 ZINC000165978262 853654155 /nfs/dbraw/zinc/65/41/55/853654155.db2.gz WLECWGPQXSKIIE-IYBDPMFKSA-N 0 3 406.448 4.245 20 0 HIADHN COc1cccc([C@@H](CNC(=O)NCc2ccccc2OC(C)C)N2CCCC2)c1 ZINC000195555475 853681324 /nfs/dbraw/zinc/68/13/24/853681324.db2.gz ZNDYQCKDTLHNMX-JOCHJYFZSA-N 0 3 411.546 4.119 20 0 HIADHN O=C(Nc1ccccc1O)C1CCN(Cc2cccc(OCC(F)(F)F)c2)CC1 ZINC000195561106 853683632 /nfs/dbraw/zinc/68/36/32/853683632.db2.gz CERUFEPVWNPZLU-UHFFFAOYSA-N 0 3 408.420 4.184 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)/C=C/Sc3ccccc3)CC2)c1 ZINC000195562472 853684630 /nfs/dbraw/zinc/68/46/30/853684630.db2.gz WFBNSPJEZKUUAJ-XDHOZWIPSA-N 0 3 409.599 4.319 20 0 HIADHN CCOC(=O)N(C)c1ccc(NC(=O)N[C@H](CN2CCCC2)c2ccccc2)cc1 ZINC000195613259 853713880 /nfs/dbraw/zinc/71/38/80/853713880.db2.gz LLSVMKXTGMPMIG-OAQYLSRUSA-N 0 3 410.518 4.238 20 0 HIADHN C[C@H](CNC(=O)NC[C@@H](c1cccs1)N1CCCC1)COCc1ccccc1 ZINC000195615809 853716026 /nfs/dbraw/zinc/71/60/26/853716026.db2.gz VJTOIIJKGUINIG-QUCCMNQESA-N 0 3 401.576 4.037 20 0 HIADHN Cc1nc(COc2ccc(F)cc2)sc1C(=O)N[C@H](C)CN1C[C@H](C)C[C@@H](C)C1 ZINC000195625544 853723085 /nfs/dbraw/zinc/72/30/85/853723085.db2.gz CYMJHEAAKCXRTN-BZUAXINKSA-N 0 3 419.566 4.266 20 0 HIADHN CC[C@H](NCC(=O)N1CCC(C(=O)N2CCCCCC2)CC1)c1ccc(Cl)cc1 ZINC000195669377 853748468 /nfs/dbraw/zinc/74/84/68/853748468.db2.gz LVIODPLXXHJCFB-NRFANRHFSA-N 0 3 419.997 4.022 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)c1cc(-c2cccs2)n[nH]1 ZINC000195686398 853757763 /nfs/dbraw/zinc/75/77/63/853757763.db2.gz OHXGBUHJUFLPJR-UHFFFAOYSA-N 0 3 422.476 4.361 20 0 HIADHN Cc1noc(C)c1COc1ccc(CC(=O)NC[C@H](c2ccc(C)cc2)N(C)C)cc1 ZINC000195717724 853776206 /nfs/dbraw/zinc/77/62/06/853776206.db2.gz BDQVXNIMDTWWBW-XMMPIXPASA-N 0 3 421.541 4.140 20 0 HIADHN COc1cc(C)c(CN(C)C(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)cc1OC ZINC000195722567 853778419 /nfs/dbraw/zinc/77/84/19/853778419.db2.gz HHTCURWXTVDZLS-IBGZPJMESA-N 0 3 414.521 4.022 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)c1ccc(N(C)c2ccccc2)nc1 ZINC000195723000 853778666 /nfs/dbraw/zinc/77/86/66/853778666.db2.gz RTTPWRMZODZFOP-UHFFFAOYSA-N 0 3 406.505 4.193 20 0 HIADHN O=C(Nc1ccccc1O)C1CCN(Cc2ccc(OCc3ccccn3)cc2)CC1 ZINC000195725043 853779507 /nfs/dbraw/zinc/77/95/07/853779507.db2.gz KKVVDKITIBLNMR-UHFFFAOYSA-N 0 3 417.509 4.217 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(NC(=O)C2CC2)cc1)C(=O)NC12CC3CC(CC(C3)C1)C2 ZINC000220348885 853875029 /nfs/dbraw/zinc/87/50/29/853875029.db2.gz ZZZDBEJCYNIYRC-ASMVTZPNSA-N 0 3 409.574 4.159 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)c2cc(Br)cnc2Cl)C1 ZINC000228716894 853889711 /nfs/dbraw/zinc/88/97/11/853889711.db2.gz QRGUBTJMOWDTRP-IUODEOHRSA-N 0 3 408.727 4.063 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)[C@@H](Oc3ccccc3)c3ccccc3)CC2)C[C@H](C)O1 ZINC000228897426 853890498 /nfs/dbraw/zinc/89/04/98/853890498.db2.gz JPKZLHJMNDQCPX-BKSPAHHJSA-N 0 3 422.569 4.155 20 0 HIADHN c1cnn(-c2ccc(CNCc3cn(-c4ccccc4)nc3-c3cccnc3)cc2)c1 ZINC000236583231 853899569 /nfs/dbraw/zinc/89/95/69/853899569.db2.gz YPTSZWZZOLHCPT-UHFFFAOYSA-N 0 3 406.493 4.410 20 0 HIADHN CC(C)(C)OCc1cccc(CNCc2c[nH]nc2-c2ccc3c(c2)OCCO3)c1 ZINC000236576199 853899626 /nfs/dbraw/zinc/89/96/26/853899626.db2.gz CHANCEIDKNYYKA-UHFFFAOYSA-N 0 3 407.514 4.453 20 0 HIADHN c1ncn(-c2ccc(CNCc3cn(Cc4ccccc4)nc3-c3ccccc3)cc2)n1 ZINC000236580726 853899797 /nfs/dbraw/zinc/89/97/97/853899797.db2.gz WQLXNNGGZKUTPE-UHFFFAOYSA-N 0 3 420.520 4.469 20 0 HIADHN c1cn(Cc2ccc(CNCc3cn(-c4ccccc4)nc3-c3ccncc3)cc2)cn1 ZINC000236584641 853900726 /nfs/dbraw/zinc/90/07/26/853900726.db2.gz NMZSOYYXMLTIBE-UHFFFAOYSA-N 0 3 420.520 4.469 20 0 HIADHN Brc1ccc2c(c1)C=C(CNCc1ccc(C3OCCO3)cc1)CO2 ZINC000236632579 853905174 /nfs/dbraw/zinc/90/51/74/853905174.db2.gz VPLOPMOYHBXAIB-UHFFFAOYSA-N 0 3 402.288 4.060 20 0 HIADHN CC(C)Oc1ccc(CNCc2cccc(NC(=O)NCc3ccncc3)c2)cc1 ZINC000236792471 853923845 /nfs/dbraw/zinc/92/38/45/853923845.db2.gz ZUTJKNBFJNCRAK-UHFFFAOYSA-N 0 3 404.514 4.480 20 0 HIADHN CC(C)c1nn(C)c(Cl)c1CNC[C@@H](c1cccc(Cl)c1)N1CCOCC1 ZINC000236847986 853929102 /nfs/dbraw/zinc/92/91/02/853929102.db2.gz TYJPCGDCLLCZNE-SFHVURJKSA-N 0 3 411.377 4.013 20 0 HIADHN CCOc1cc(CNC[C@H](O)c2c(F)cccc2F)ccc1OCC(F)(F)F ZINC000236952084 853941308 /nfs/dbraw/zinc/94/13/08/853941308.db2.gz LBFAYKYIFLZVRZ-HNNXBMFYSA-N 0 3 405.363 4.128 20 0 HIADHN CC[C@@H](C#N)Oc1cccc(CNCc2cc(Br)c(O)c(OC)c2)c1 ZINC000237019840 853952637 /nfs/dbraw/zinc/95/26/37/853952637.db2.gz CDEXNMTYAPKRIM-HNNXBMFYSA-N 0 3 405.292 4.134 20 0 HIADHN CN(C)[C@H](CNCc1nc(-c2cccc(Br)c2)c[nH]1)c1cccs1 ZINC000237040424 853955753 /nfs/dbraw/zinc/95/57/53/853955753.db2.gz JURCJSYLYXTUTR-MRXNPFEDSA-N 0 3 405.365 4.293 20 0 HIADHN CCOc1ccc(O)c(CNCc2cc(Br)ccc2OC(F)F)c1 ZINC000237049324 853957566 /nfs/dbraw/zinc/95/75/66/853957566.db2.gz BGHNDWGLCLPFDV-UHFFFAOYSA-N 0 3 402.235 4.445 20 0 HIADHN CC[C@H](C(=O)N1CCC(NCc2csc(-c3ccccn3)n2)CC1)c1ccccc1 ZINC000237081072 853962085 /nfs/dbraw/zinc/96/20/85/853962085.db2.gz DZNRVQWZCYICIF-NRFANRHFSA-N 0 3 420.582 4.480 20 0 HIADHN CN(C(=O)c1ccncc1)c1ccc(CNCc2cccc(Br)c2)cc1 ZINC000237094593 853962947 /nfs/dbraw/zinc/96/29/47/853962947.db2.gz GFEHACBMMLKPLZ-UHFFFAOYSA-N 0 3 410.315 4.411 20 0 HIADHN CCc1ccc(-c2nn(-c3ccccc3)cc2CNCc2ccc(C(N)=O)cc2)cc1 ZINC000237104394 853965101 /nfs/dbraw/zinc/96/51/01/853965101.db2.gz AQGLKIGDMXXITJ-UHFFFAOYSA-N 0 3 410.521 4.490 20 0 HIADHN COCCOc1cccc(CNCC2=Cc3cc(Br)ccc3OC2)c1 ZINC000237238524 853988650 /nfs/dbraw/zinc/98/86/50/853988650.db2.gz FYBRILYSMBAUTE-UHFFFAOYSA-N 0 3 404.304 4.040 20 0 HIADHN COc1cc(Br)cc(C[NH2+]CCCOc2cccc3cccnc32)c1[O-] ZINC000237241145 853988957 /nfs/dbraw/zinc/98/89/57/853988957.db2.gz FLTJRNMWDRBMHU-UHFFFAOYSA-N 0 3 417.303 4.270 20 0 HIADHN COc1ccc(OC)c(NC(=O)C[C@H](C)NCc2ccccc2OC(F)(F)F)c1 ZINC000237254986 853991730 /nfs/dbraw/zinc/99/17/30/853991730.db2.gz MKAJMSFBOIGAGR-ZDUSSCGKSA-N 0 3 412.408 4.109 20 0 HIADHN COc1ccc(NC(=O)C[C@H](C)N[C@@H](c2nc3ccccc3[nH]2)C(C)C)c(OC)c1 ZINC000237306471 854002852 /nfs/dbraw/zinc/00/28/52/854002852.db2.gz LWCJPZLIHXKVDJ-OYHNWAKOSA-N 0 3 410.518 4.284 20 0 HIADHN COc1ccccc1/C=C/CNCc1cccc(NC(=O)NCc2ccncc2)c1 ZINC000237312980 854005010 /nfs/dbraw/zinc/00/50/10/854005010.db2.gz ABEPRHGXFGGIDZ-VMPITWQZSA-N 0 3 402.498 4.215 20 0 HIADHN COc1cc(CNC2(c3ccc(Cl)cc3)CCC2)cc(Cl)c1OCC(N)=O ZINC000237340640 854009777 /nfs/dbraw/zinc/00/97/77/854009777.db2.gz BHUNKJKURWVLPL-UHFFFAOYSA-N 0 3 409.313 4.035 20 0 HIADHN COc1cc(CNC2(c3ccc(Cl)cc3)CCCC2)cc(Cl)c1OCC(N)=O ZINC000237341052 854009900 /nfs/dbraw/zinc/00/99/00/854009900.db2.gz FZFURMOJHGWEGM-UHFFFAOYSA-N 0 3 423.340 4.425 20 0 HIADHN COc1ccc(OC(F)F)c(CNCCc2nc(-c3cccc(Cl)c3)no2)c1 ZINC000237367004 854015753 /nfs/dbraw/zinc/01/57/53/854015753.db2.gz QPOZRPGFVFAZIQ-UHFFFAOYSA-N 0 3 409.820 4.332 20 0 HIADHN CNS(=O)(=O)c1ccc([C@@H](C)NCc2ccc(-c3ccccc3OC)cc2)cc1 ZINC000237389299 854020652 /nfs/dbraw/zinc/02/06/52/854020652.db2.gz NKWISQURBKHOFE-QGZVFWFLSA-N 0 3 410.539 4.121 20 0 HIADHN C[C@@H]1CN(CCCNCc2csc(-c3cccc(Br)c3)n2)C[C@@H](C)O1 ZINC000237407703 854025357 /nfs/dbraw/zinc/02/53/57/854025357.db2.gz FKYSTQRZKVIFAJ-HUUCEWRRSA-N 0 3 424.408 4.162 20 0 HIADHN COc1cc2c(c(CN[C@@H](C)CC(=O)Nc3cccc(N4CCCC4)c3)c1)O[C@H](C)C2 ZINC000237421063 854029379 /nfs/dbraw/zinc/02/93/79/854029379.db2.gz HGBWPWXNCUPEON-ZWKOTPCHSA-N 0 3 423.557 4.126 20 0 HIADHN Cc1nn(Cc2ccccc2)c(Cl)c1CNCCc1nc2cc(F)ccc2n1C ZINC000237657767 854070145 /nfs/dbraw/zinc/07/01/45/854070145.db2.gz AQMPEXJSCCLSBT-UHFFFAOYSA-N 0 3 411.912 4.251 20 0 HIADHN Clc1ccc(OC[C@@H]2CCCO2)c(CNCCc2csc(N3CCCC3)n2)c1 ZINC000237712378 854080649 /nfs/dbraw/zinc/08/06/49/854080649.db2.gz KCHSRSJZSMLXPN-IBGZPJMESA-N 0 3 421.994 4.287 20 0 HIADHN Cc1nn(C)c2ncc(CNCc3cn(Cc4ccccc4)nc3-c3ccccc3)cc12 ZINC000237721667 854082818 /nfs/dbraw/zinc/08/28/18/854082818.db2.gz NNEZLVYXBAMRPL-UHFFFAOYSA-N 0 3 422.536 4.478 20 0 HIADHN Cc1nn(C)c(Cl)c1CNC[C@H](c1ccccc1)N1CCc2sccc2C1 ZINC000237738620 854086570 /nfs/dbraw/zinc/08/65/70/854086570.db2.gz QSQXIAWSBRNECB-LJQANCHMSA-N 0 3 400.979 4.333 20 0 HIADHN Cc1nn(-c2ccc(F)cc2F)c(C)c1CN[C@H]1CCN(c2ncccc2Cl)C1 ZINC000237796031 854099347 /nfs/dbraw/zinc/09/93/47/854099347.db2.gz ZTAQNCSAYLIUHH-INIZCTEOSA-N 0 3 417.891 4.184 20 0 HIADHN Cc1nn(Cc2ccc(Cl)cc2)c(Cl)c1CNCCCOC[C@@H]1CCOC1 ZINC000237892089 854115739 /nfs/dbraw/zinc/11/57/39/854115739.db2.gz QKHSAUALNUZPIS-KRWDZBQOSA-N 0 3 412.361 4.079 20 0 HIADHN Cc1cccn2cc(COc3ccc(CN[C@H]4CCCc5c4cnn5C)cc3)nc12 ZINC000237895268 854115933 /nfs/dbraw/zinc/11/59/33/854115933.db2.gz YACYTOSWDONUNK-QFIPXVFZSA-N 0 3 401.514 4.122 20 0 HIADHN Cc1cc(F)ccc1-c1ccc(CN[C@@H](CN2CCN(C)CC2)c2ccccc2)o1 ZINC000261471659 854274112 /nfs/dbraw/zinc/27/41/12/854274112.db2.gz XXTDSCKWYOVVSI-DEOSSOPVSA-N 0 3 407.533 4.472 20 0 HIADHN COc1cccc(C[C@H](C)NC(=O)Nc2ccc(CCN3CCSCC3)cc2)c1 ZINC000261478522 854275972 /nfs/dbraw/zinc/27/59/72/854275972.db2.gz SVUSWMPLKDTGQO-SFHVURJKSA-N 0 3 413.587 4.039 20 0 HIADHN COc1cc([C@H](C)NC(=O)c2oc3ccccc3c2CN(C)C)cc(OC)c1OC ZINC000261487860 854279215 /nfs/dbraw/zinc/27/92/15/854279215.db2.gz VPNVYQHTRFPRKI-AWEZNQCLSA-N 0 3 412.486 4.011 20 0 HIADHN COc1c(Br)cc(Br)cc1CN[C@H]1C[C@H](OC)C1(C)C ZINC000300631740 854281675 /nfs/dbraw/zinc/28/16/75/854281675.db2.gz JLYUWHYBHYWTGH-STQMWFEESA-N 0 3 407.146 4.123 20 0 HIADHN COc1c(Br)cc(Br)cc1CN[C@@H]1C[C@H](OC)C1(C)C ZINC000300631739 854281952 /nfs/dbraw/zinc/28/19/52/854281952.db2.gz JLYUWHYBHYWTGH-OLZOCXBDSA-N 0 3 407.146 4.123 20 0 HIADHN O=C(c1ccc(NC[C@H](c2ccco2)N2CCCC2)nc1)N1CCc2ccccc21 ZINC000301225459 854332831 /nfs/dbraw/zinc/33/28/31/854332831.db2.gz FZCXKFSYXHBNOO-OAQYLSRUSA-N 0 3 402.498 4.127 20 0 HIADHN O=C(c1ccc(NCCCN2CCc3ccccc3C2)nc1)N1CCc2ccccc21 ZINC000301224732 854333035 /nfs/dbraw/zinc/33/30/35/854333035.db2.gz FKNRJCHGGWYJQR-UHFFFAOYSA-N 0 3 412.537 4.145 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(NC3C[C@H]4CC[C@@H](C3)[N@H+]4Cc3ccccc3)nc2)n1 ZINC000301282248 854346806 /nfs/dbraw/zinc/34/68/06/854346806.db2.gz UHWUTDRSWFJHFR-FRIKZZABSA-N 0 3 415.541 4.414 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(NC3C[C@H]4CC[C@@H](C3)[N@@H+]4Cc3ccccc3)nc2)n1 ZINC000301282248 854346810 /nfs/dbraw/zinc/34/68/10/854346810.db2.gz UHWUTDRSWFJHFR-FRIKZZABSA-N 0 3 415.541 4.414 20 0 HIADHN CC(C)(C)OC(=O)NC[C@@](C)(NCc1cc(Br)ccc1F)C1CC1 ZINC000301321484 854358248 /nfs/dbraw/zinc/35/82/48/854358248.db2.gz IBBQTSNMVUCNGY-GOSISDBHSA-N 0 3 401.320 4.371 20 0 HIADHN Cc1noc(-c2cccnc2N[C@@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)n1 ZINC000301392044 854380414 /nfs/dbraw/zinc/38/04/14/854380414.db2.gz HUJWRARKBVEVQK-MRXNPFEDSA-N 0 3 403.408 4.145 20 0 HIADHN C[C@H](NC(C)(C)CNc1nc2c(cnn2-c2ccccc2)c(=O)[nH]1)c1ccccc1 ZINC000301397062 854381762 /nfs/dbraw/zinc/38/17/62/854381762.db2.gz GQXQEMAZXUQIOO-INIZCTEOSA-N 0 3 402.502 4.062 20 0 HIADHN O=S(=O)(c1ccccc1N1CC[C@@H]2[C@H](CCCN2Cc2ccccc2)C1)C(F)F ZINC000301706672 854449067 /nfs/dbraw/zinc/44/90/67/854449067.db2.gz ISBNBOZIAOOSMY-RTBURBONSA-N 0 3 420.525 4.174 20 0 HIADHN COc1cccc([C@@H]2[C@H](Nc3cc(C)nc(-c4cccnc4)n3)CCN2C2CC2)c1 ZINC000302016127 854516344 /nfs/dbraw/zinc/51/63/44/854516344.db2.gz CCBWFAPKFPIRBZ-FYYLOGMGSA-N 0 3 401.514 4.246 20 0 HIADHN COc1ccc(Br)c(CN[C@@H]2CCN(C(=O)OC(C)(C)C)[C@H](C)C2)c1 ZINC000302062874 854524683 /nfs/dbraw/zinc/52/46/83/854524683.db2.gz XDGIIPONRRYPPH-UKRRQHHQSA-N 0 3 413.356 4.335 20 0 HIADHN Cc1ccccc1CN1CCC(Nc2nn3cc(-c4cccnc4)nc3s2)CC1 ZINC000302098582 854530077 /nfs/dbraw/zinc/53/00/77/854530077.db2.gz OZHVUJGGOVVFFL-UHFFFAOYSA-N 0 3 404.543 4.238 20 0 HIADHN C[C@@H]1[C@H](NCc2cc(Br)ccc2F)CCCN1C(=O)OC(C)(C)C ZINC000302101304 854531130 /nfs/dbraw/zinc/53/11/30/854531130.db2.gz JMXFHCSGOAYBKY-MLGOLLRUSA-N 0 3 401.320 4.466 20 0 HIADHN COc1ccccc1[C@H](CNc1ccc2nnc(-c3ccsc3)n2n1)N1CCCC1 ZINC000302302097 854560080 /nfs/dbraw/zinc/56/00/80/854560080.db2.gz NGDCAENKJOBDGC-SFHVURJKSA-N 0 3 420.542 4.110 20 0 HIADHN CN(C)[C@@H](CNc1ncc(Cn2cc(Br)cn2)s1)c1ccc(F)cc1 ZINC000302472535 854574125 /nfs/dbraw/zinc/57/41/25/854574125.db2.gz UOTBITTWRCAEOX-INIZCTEOSA-N 0 3 424.343 4.004 20 0 HIADHN COc1ccc(OC)c([C@@H](C)NC(=O)CN[C@H](c2ccc(Cl)cc2)C2CC2)c1 ZINC000302759474 854624186 /nfs/dbraw/zinc/62/41/86/854624186.db2.gz OBTIOASLNLKDDI-PEBXRYMYSA-N 0 3 402.922 4.275 20 0 HIADHN CCN(CC)C(=O)c1cccc(NC(=O)CN[C@H](c2ccc(OC)cc2)C(C)C)c1 ZINC000302769668 854628721 /nfs/dbraw/zinc/62/87/21/854628721.db2.gz YGUQVDRFPOHXMX-QHCPKHFHSA-N 0 3 411.546 4.103 20 0 HIADHN O=C(c1ccccn1)N1CCN(c2ccnc3ccc(Oc4ccccc4)cc32)CC1 ZINC000302780580 854632677 /nfs/dbraw/zinc/63/26/77/854632677.db2.gz ISCVWSGPSYIMBK-UHFFFAOYSA-N 0 3 410.477 4.385 20 0 HIADHN C[C@H](C1CC1)N(CC(=O)N1CCC[C@@H]1c1ccc2c(c1)OCCO2)Cc1ccccc1 ZINC000302839630 854651727 /nfs/dbraw/zinc/65/17/27/854651727.db2.gz XZCDNNVOCJOFCQ-AUSIDOKSSA-N 0 3 420.553 4.422 20 0 HIADHN CN(C)[C@@H](CNc1nc(C(F)(F)F)nc2nc[nH]c21)c1cccc(C(F)(F)F)c1 ZINC000302877360 854664051 /nfs/dbraw/zinc/66/40/51/854664051.db2.gz GMHOPFCIOIBCKX-NSHDSACASA-N 0 3 418.345 4.105 20 0 HIADHN CN(Cc1ccccc1Br)C(=O)NC[C@H](c1ccccc1)N1CCCC1 ZINC000302896640 854669848 /nfs/dbraw/zinc/66/98/48/854669848.db2.gz LKXSFPOQOCOHKS-HXUWFJFHSA-N 0 3 416.363 4.428 20 0 HIADHN CC1CCN([C@@H](CNC(=O)c2cc(Br)cn2C)c2cccs2)CC1 ZINC000302908926 854675030 /nfs/dbraw/zinc/67/50/30/854675030.db2.gz HWUOPOBLVYESAO-INIZCTEOSA-N 0 3 410.381 4.052 20 0 HIADHN Clc1nc(N2CCC[C@H](CN3CCN(c4ccccn4)CC3)C2)cc2ccccc21 ZINC000302994029 854714023 /nfs/dbraw/zinc/71/40/23/854714023.db2.gz GLXVDLMNMBFWGU-LJQANCHMSA-N 0 3 421.976 4.322 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2cccc(OC[C@H]3CCCO3)c2)N2CCCC2)cc1 ZINC000303035059 854733039 /nfs/dbraw/zinc/73/30/39/854733039.db2.gz OVBBQDOMQTWSTB-DNQXCXABSA-N 0 3 408.542 4.120 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)c(C)c1CC(=O)N(CCN(C)C)Cc1ccccc1 ZINC000303075180 854749429 /nfs/dbraw/zinc/74/94/29/854749429.db2.gz QXGYMFUZYHGYNW-UHFFFAOYSA-N 0 3 424.976 4.275 20 0 HIADHN Cc1c(C(=O)N2CCCN(CCCc3ccccc3)CC2)cnn1Cc1ccccc1 ZINC000303164028 854795441 /nfs/dbraw/zinc/79/54/41/854795441.db2.gz ULENCDOPUIWVJB-UHFFFAOYSA-N 0 3 416.569 4.021 20 0 HIADHN COc1ccc(CCNC(=O)[C@H](C)N2CCC[C@H](c3ccccc3)CC2)cc1OC ZINC000303195749 854812103 /nfs/dbraw/zinc/81/21/03/854812103.db2.gz NKMBSRJIOGVSPJ-UGKGYDQZSA-N 0 3 410.558 4.021 20 0 HIADHN COc1ccc(CCNC(=O)[C@@H](C)N2CCC[C@@H](c3ccccc3)CC2)cc1OC ZINC000303195738 854812224 /nfs/dbraw/zinc/81/22/24/854812224.db2.gz NKMBSRJIOGVSPJ-DENIHFKCSA-N 0 3 410.558 4.021 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)C1(c2ccccc2Cl)CCOCC1 ZINC000303307588 854863995 /nfs/dbraw/zinc/86/39/95/854863995.db2.gz NXOMEYOOYNHURK-IBGZPJMESA-N 0 3 418.990 4.403 20 0 HIADHN O=C(CC1CCCCC1)NC1CCN(CCOc2ccc(Br)cc2)CC1 ZINC000303348467 854885623 /nfs/dbraw/zinc/88/56/23/854885623.db2.gz MZYJLGRPBRYZTR-UHFFFAOYSA-N 0 3 423.395 4.379 20 0 HIADHN Cc1ccc(S(=O)(=O)NC2C[C@H]3CC[C@@H](C2)N3Cc2ccccc2)cc1Cl ZINC000303432339 854932639 /nfs/dbraw/zinc/93/26/39/854932639.db2.gz CLAAFEKYQKEHMG-YQQQUEKLSA-N 0 3 404.963 4.122 20 0 HIADHN CCc1cccc2c(CCNC(=O)NC[C@@H](c3cccs3)N3CCCC3)c[nH]c21 ZINC000303455731 854955696 /nfs/dbraw/zinc/95/56/96/854955696.db2.gz JVFQNPIADYAYJF-FQEVSTJZSA-N 0 3 410.587 4.471 20 0 HIADHN Cc1cccn2c(=O)cc(CN3CCC[C@@H](c4nc5ccccc5n4C(C)C)C3)nc12 ZINC000303506772 854995275 /nfs/dbraw/zinc/99/52/75/854995275.db2.gz BLGZOHONZPONOL-LJQANCHMSA-N 0 3 415.541 4.313 20 0 HIADHN Cc1ccc(C(=O)NC[C@H](C)N(C)Cc2ccccc2)cc1NC(=O)c1ccccc1 ZINC000303514217 855002517 /nfs/dbraw/zinc/00/25/17/855002517.db2.gz UEHHASWGYOEHLF-FQEVSTJZSA-N 0 3 415.537 4.498 20 0 HIADHN CC1CCN(C(=O)C2CCN(Cc3ccc(OCc4ccccn4)cc3)CC2)CC1 ZINC000303536442 855022921 /nfs/dbraw/zinc/02/29/21/855022921.db2.gz FNVUJZMCORFKEH-UHFFFAOYSA-N 0 3 407.558 4.131 20 0 HIADHN CCCN(CC(=O)Nc1ccc(Cl)cc1)C(=O)c1cccc(CN2CCCC2)c1 ZINC000303550406 855034565 /nfs/dbraw/zinc/03/45/65/855034565.db2.gz VMQKQHACDLMADW-UHFFFAOYSA-N 0 3 413.949 4.427 20 0 HIADHN Cc1nc2c(s1)[C@H](N(C)C(=O)[C@H]1CCCN(Cc3cccc(F)c3)C1)CCC2 ZINC000303576853 855052402 /nfs/dbraw/zinc/05/24/02/855052402.db2.gz ZLOJHFKLESHJPV-FXAWDEMLSA-N 0 3 401.551 4.339 20 0 HIADHN CC(C)n1c2ccccc2nc1[C@H]1CCCN(C[C@H](O)COc2ccc(F)cc2)C1 ZINC000303577060 855053038 /nfs/dbraw/zinc/05/30/38/855053038.db2.gz QDLQEVYUVVCJRT-ICSRJNTNSA-N 0 3 411.521 4.376 20 0 HIADHN Cc1ccc(OCc2cccc(C(=O)N(CCN(C)C)Cc3ccccc3)c2)cn1 ZINC000303595808 855067090 /nfs/dbraw/zinc/06/70/90/855067090.db2.gz WHMDFHUWIIMLTO-UHFFFAOYSA-N 0 3 403.526 4.173 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)c1csc(Cc2ccccc2F)n1 ZINC000303683097 855129927 /nfs/dbraw/zinc/12/99/27/855129927.db2.gz NBEUXKVMLMSNAU-UHFFFAOYSA-N 0 3 415.509 4.216 20 0 HIADHN Cc1ccnc(-c2ccc(NC(=O)[C@@H]3CCCN(Cc4cccc(F)c4)C3)cc2)n1 ZINC000303733756 855159550 /nfs/dbraw/zinc/15/95/50/855159550.db2.gz WAPIQCSJJSLTTM-HXUWFJFHSA-N 0 3 404.489 4.442 20 0 HIADHN COc1ccc(C(=O)CCC(=O)N(C)[C@@H]2CCN(Cc3ccccc3)[C@@H](C)C2)cc1 ZINC000303737418 855162409 /nfs/dbraw/zinc/16/24/09/855162409.db2.gz HCXLCFLXNIHMQE-SIKLNZKXSA-N 0 3 408.542 4.170 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)CCN1CCC[C@H](C(=O)c2ccc(F)cc2)C1 ZINC000303745197 855167161 /nfs/dbraw/zinc/16/71/61/855167161.db2.gz JSVHCBCNJVLPCS-INIZCTEOSA-N 0 3 418.896 4.411 20 0 HIADHN Cc1nn(CC(C)C)c(C)c1CCC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C ZINC000303765590 855184377 /nfs/dbraw/zinc/18/43/77/855184377.db2.gz AUHXCGPSOYRLFE-FQEVSTJZSA-N 0 3 410.606 4.212 20 0 HIADHN C[C@@H](c1ccccc1)N(CC(=O)Nc1cccc(C(=O)NC2CC2)c1)CC1CCC1 ZINC000303802047 855206324 /nfs/dbraw/zinc/20/63/24/855206324.db2.gz GZYKLNZXTOTWBW-SFHVURJKSA-N 0 3 405.542 4.381 20 0 HIADHN CCCCS(=O)(=O)Nc1ccc(NC(=O)c2cccc(CN3CCCC3)c2)cc1 ZINC000303816294 855219399 /nfs/dbraw/zinc/21/93/99/855219399.db2.gz JDHDXSWYDUWWDT-UHFFFAOYSA-N 0 3 415.559 4.077 20 0 HIADHN Cc1ccc([C@H](CNC(=O)[C@H]2C[C@@H]2c2ccccc2OC(F)(F)F)N(C)C)cc1 ZINC000303906907 855281236 /nfs/dbraw/zinc/28/12/36/855281236.db2.gz RBYIWETYQHCLSH-QYZOEREBSA-N 0 3 406.448 4.416 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)Cc1ccc(OC(F)(F)F)cc1 ZINC000303919377 855291088 /nfs/dbraw/zinc/29/10/88/855291088.db2.gz VOEMWKKFGDRLSN-QGZVFWFLSA-N 0 3 406.448 4.251 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)Nc1ccc(F)cc1OCC1CC1 ZINC000303941182 855306725 /nfs/dbraw/zinc/30/67/25/855306725.db2.gz XJBIFMHIQOBVEX-UHFFFAOYSA-N 0 3 407.555 4.098 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2C(=O)N(C)[C@@H]2CCCN(C)C2)c(C)c1 ZINC000303963379 855324249 /nfs/dbraw/zinc/32/42/49/855324249.db2.gz XKNDOXLCTZEPCR-OAQYLSRUSA-N 0 3 402.542 4.322 20 0 HIADHN CN(C)Cc1cccc(NC(=O)CCNc2ncc(C(F)(F)F)cc2Cl)c1 ZINC000303973189 855330909 /nfs/dbraw/zinc/33/09/09/855330909.db2.gz UJZCKEAKYYQKJK-UHFFFAOYSA-N 0 3 400.832 4.256 20 0 HIADHN COc1ccc(Br)cc1CN[C@](C)(CNC(=O)OC(C)(C)C)C1CC1 ZINC000304930918 855359179 /nfs/dbraw/zinc/35/91/79/855359179.db2.gz ZCPJHTBVFYQOTE-LJQANCHMSA-N 0 3 413.356 4.241 20 0 HIADHN CN(C(=O)c1cc(Br)ccc1F)C1CCN(Cc2ccccc2)CC1 ZINC000311154672 855369104 /nfs/dbraw/zinc/36/91/04/855369104.db2.gz WWHVIYSWCJNHQC-UHFFFAOYSA-N 0 3 405.311 4.325 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)c1cc(Cl)ncc1Br ZINC000326627252 855411242 /nfs/dbraw/zinc/41/12/42/855411242.db2.gz TUAGIFFQLGTFMD-MRXNPFEDSA-N 0 3 408.727 4.064 20 0 HIADHN CC(C)(C)OC(=O)N1CCC(C)(NCc2cccc(F)c2Br)CC1 ZINC000382519779 855433645 /nfs/dbraw/zinc/43/36/45/855433645.db2.gz ACHLBUPXMIXALT-UHFFFAOYSA-N 0 3 401.320 4.467 20 0 HIADHN CC(C)(C)OC(=O)N1CCC[C@H](CNCc2cccc(F)c2Br)C1 ZINC000382789087 855434901 /nfs/dbraw/zinc/43/49/01/855434901.db2.gz XEPWXSQWEPOIMQ-CYBMUJFWSA-N 0 3 401.320 4.325 20 0 HIADHN C[C@H]1CCN(C(=O)c2ccc(Br)c(F)c2)CCN1Cc1ccccc1 ZINC000383040476 855435418 /nfs/dbraw/zinc/43/54/18/855435418.db2.gz AGSLKUMKYGSVQF-HNNXBMFYSA-N 0 3 405.311 4.325 20 0 HIADHN Cc1c(Br)cccc1C(=O)N1CCCN(Cc2ccccc2)C[C@H]1C ZINC000383044033 855435834 /nfs/dbraw/zinc/43/58/34/855435834.db2.gz DRDZUPCVBGXUHJ-MRXNPFEDSA-N 0 3 401.348 4.494 20 0 HIADHN Cc1ccc(Br)cc1C(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1 ZINC000383064721 855437192 /nfs/dbraw/zinc/43/71/92/855437192.db2.gz WGZVOUNNLMTVHC-KRWDZBQOSA-N 0 3 401.348 4.494 20 0 HIADHN CCOc1c(Br)cc(Br)cc1CN[C@@H]1C[C@H](C)O[C@@H]1C ZINC000384964271 855440437 /nfs/dbraw/zinc/44/04/37/855440437.db2.gz XDKDVYPVWIIMQQ-IMSIIYSGSA-N 0 3 407.146 4.266 20 0 HIADHN CC(C)n1cc(Br)cc1C(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000385199369 855440775 /nfs/dbraw/zinc/44/07/75/855440775.db2.gz SAEXDMALECIGSH-SFHVURJKSA-N 0 3 404.352 4.178 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1cc(Cl)ccc1Br ZINC000389831341 855451370 /nfs/dbraw/zinc/45/13/70/855451370.db2.gz ACCYQPRIWMKSQQ-ACJLOTCBSA-N 0 3 407.739 4.353 20 0 HIADHN COc1cc(Br)c(CNC[C@H](C)COCc2ccccc2)cc1OC ZINC000389918347 855452745 /nfs/dbraw/zinc/45/27/45/855452745.db2.gz OKUDRFJOENCEQI-HNNXBMFYSA-N 0 3 408.336 4.409 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)c1c(F)cc(Br)cc1F ZINC000390803692 855457748 /nfs/dbraw/zinc/45/77/48/855457748.db2.gz UYYRYXWSXBLPAH-HNNXBMFYSA-N 0 3 409.274 4.122 20 0 HIADHN O[C@H](CNCc1cc(Br)cc2c1OCC2)c1ccc(C(F)(F)F)cc1 ZINC000392854741 855467041 /nfs/dbraw/zinc/46/70/41/855467041.db2.gz KDKMHUDWHAYZSQ-MRXNPFEDSA-N 0 3 416.237 4.226 20 0 HIADHN C[C@@H](NCC1([S@](C)=O)CCC1)c1ccc(Br)cc1Br ZINC000393697194 855468843 /nfs/dbraw/zinc/46/88/43/855468843.db2.gz HKUVMUSHWDGHIN-DGIBIBHMSA-N 0 3 409.187 4.163 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)c1cc(Br)cnc1Cl ZINC000398045406 855474971 /nfs/dbraw/zinc/47/49/71/855474971.db2.gz SROCMIXEYNVPIX-QGZVFWFLSA-N 0 3 424.770 4.384 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)c1cc(Cl)ncc1Br ZINC000398038145 855475357 /nfs/dbraw/zinc/47/53/57/855475357.db2.gz OBYRGWHLNDIOHI-KRWDZBQOSA-N 0 3 424.770 4.384 20 0 HIADHN C[C@H]1C[C@H](NC(=O)c2cccc(Br)c2Cl)CN1Cc1ccccc1 ZINC000398140005 855476461 /nfs/dbraw/zinc/47/64/61/855476461.db2.gz NYGBQPYSKFTDGS-ZFWWWQNUSA-N 0 3 407.739 4.495 20 0 HIADHN COc1cc(Br)c(CNCCc2nc3ccccc3s2)cc1OC ZINC000409448080 855484280 /nfs/dbraw/zinc/48/42/80/855484280.db2.gz NLMZMBNPVOYPSB-UHFFFAOYSA-N 0 3 407.333 4.408 20 0 HIADHN CCc1cccc(C)c1NC(=O)NCCCCN1CCN(Cc2ccccc2)CC1 ZINC000409678938 855598156 /nfs/dbraw/zinc/59/81/56/855598156.db2.gz JFFKNUFRSBMSJD-UHFFFAOYSA-N 0 3 408.590 4.277 20 0 HIADHN COc1ccc(CN(CC2CC2)C(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)c(OC)c1 ZINC000409734784 855627016 /nfs/dbraw/zinc/62/70/16/855627016.db2.gz SAUGVHLOQFAQSF-LADGPHEKSA-N 0 3 423.557 4.071 20 0 HIADHN COc1ccc(CN(CC2CC2)C(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)c(OC)c1 ZINC000409734786 855627104 /nfs/dbraw/zinc/62/71/04/855627104.db2.gz SAUGVHLOQFAQSF-UPVQGACJSA-N 0 3 423.557 4.071 20 0 HIADHN CCOc1cc2c(cc1[C@@H]1C[C@@H]1C(=O)N(CCN(C)C)c1ccccc1)O[C@@H](C)C2 ZINC000409753242 855636826 /nfs/dbraw/zinc/63/68/26/855636826.db2.gz QUTQDGDSAQRJLB-XJABCFGWSA-N 0 3 408.542 4.107 20 0 HIADHN C[C@H]1CCN(C(=O)C(C)(C)Cc2nc3ccccc3[nH]2)CCN1Cc1ccccc1 ZINC000409755250 855637502 /nfs/dbraw/zinc/63/75/02/855637502.db2.gz QKGZKUBPEAPMIA-IBGZPJMESA-N 0 3 404.558 4.255 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)CCCC1CCOCC1 ZINC000409844649 855683675 /nfs/dbraw/zinc/68/36/75/855683675.db2.gz NBVPBPUXVDYTBT-UHFFFAOYSA-N 0 3 400.485 4.193 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)C2(c3ccccc3Cl)CCOCC2)C1 ZINC000409849787 855686499 /nfs/dbraw/zinc/68/64/99/855686499.db2.gz QZRFOEDITYZYPQ-UYAOXDASSA-N 0 3 412.961 4.340 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)CCc2cc(Br)cs2)C1 ZINC000409851188 855688251 /nfs/dbraw/zinc/68/82/51/855688251.db2.gz YVKQQMJMWRQNKY-WMLDXEAASA-N 0 3 407.377 4.395 20 0 HIADHN O=C(c1ccc(-c2noc(C(F)(F)F)n2)cc1)N1CCN(CC2CCCCC2)CC1 ZINC000409892768 855710646 /nfs/dbraw/zinc/71/06/46/855710646.db2.gz PKUPTYWVRYUXAT-UHFFFAOYSA-N 0 3 422.451 4.094 20 0 HIADHN CC(C)(C)[C@H](CN1CCc2ccccc2C1)NC(=O)c1cncc(Br)c1 ZINC000410051272 855801585 /nfs/dbraw/zinc/80/15/85/855801585.db2.gz GLXTYXXUJXQKQT-IBGZPJMESA-N 0 3 416.363 4.047 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)N1CCC(N2CCc3ccccc32)CC1 ZINC000410290672 855907791 /nfs/dbraw/zinc/90/77/91/855907791.db2.gz OROPKZYAUFTRBG-UHFFFAOYSA-N 0 3 403.526 4.162 20 0 HIADHN CC[C@H](NC(=O)NCc1ccc(CN2CCN(C)CC2)cc1)c1cccc(Cl)c1 ZINC000410366351 855954141 /nfs/dbraw/zinc/95/41/41/855954141.db2.gz GWUSAMRJZCTXKN-QFIPXVFZSA-N 0 3 414.981 4.038 20 0 HIADHN CN(C)[C@H](CNC(=O)NCc1ccc(OCc2ccccc2)cc1)c1ccccc1 ZINC000410400996 855976046 /nfs/dbraw/zinc/97/60/46/855976046.db2.gz UKJBTZLRMZEKAQ-XMMPIXPASA-N 0 3 403.526 4.368 20 0 HIADHN CS(=O)(=O)Nc1cccc(CN[C@H](Cc2cccnc2)c2cccc(Cl)c2)c1 ZINC000425912399 855994665 /nfs/dbraw/zinc/99/46/65/855994665.db2.gz DOLZMPVKNJZMJD-OAQYLSRUSA-N 0 3 415.946 4.180 20 0 HIADHN C[C@@H]1CN(C2CCOCC2)CCN1C(=O)N[C@H](c1cccc(Cl)c1)C1CCCC1 ZINC000425928292 856004185 /nfs/dbraw/zinc/00/41/85/856004185.db2.gz XTKMAKIJGJFOMM-VGSWGCGISA-N 0 3 419.997 4.466 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)N[C@H]2CCCc3sc(Cl)cc32)cc1 ZINC000426053112 856075091 /nfs/dbraw/zinc/07/50/91/856075091.db2.gz VGCYFKXRSFKBFW-IRXDYDNUSA-N 0 3 407.967 4.390 20 0 HIADHN Cc1cc(Br)c2c(c1)CN(C(=O)Nc1cccc(CN(C)C)c1)CC2 ZINC000426069406 856085187 /nfs/dbraw/zinc/08/51/87/856085187.db2.gz JPDSQAQYSHILTH-UHFFFAOYSA-N 0 3 402.336 4.409 20 0 HIADHN C[C@H](CCCC(F)(F)F)NC(=O)N1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000426093470 856103840 /nfs/dbraw/zinc/10/38/40/856103840.db2.gz XCDMBTRVFPKGTP-IKGGRYGDSA-N 0 3 407.521 4.028 20 0 HIADHN Cn1cc(-c2noc([C@H]3CCCN(Cc4cccc(F)c4)C3)n2)c(C(F)(F)F)n1 ZINC000426225556 856187722 /nfs/dbraw/zinc/18/77/22/856187722.db2.gz JKRROZTYZZXIGM-ZDUSSCGKSA-N 0 3 409.387 4.008 20 0 HIADHN CC1CCN([C@H](CNC(=O)N(CCCO)Cc2ccccc2)c2cccs2)CC1 ZINC000426232373 856191412 /nfs/dbraw/zinc/19/14/12/856191412.db2.gz VOAQGYLULDQMGA-OAQYLSRUSA-N 0 3 415.603 4.115 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N[C@@H]1CCOC2(CCCCC2)C1)c1cccc(OC)c1 ZINC000426231485 856191496 /nfs/dbraw/zinc/19/14/96/856191496.db2.gz ILPHJSAVQOHNMV-IRLDBZIGSA-N 0 3 417.594 4.259 20 0 HIADHN CCN(CC)C(=O)Nc1ccc([C@@H](C)NCc2cc3ccccc3n(C)c2=O)cc1 ZINC000426319696 856243410 /nfs/dbraw/zinc/24/34/10/856243410.db2.gz XKUXBLKFJCFXRZ-QGZVFWFLSA-N 0 3 406.530 4.263 20 0 HIADHN CCN1CCN(CCC(=O)Nc2ccc(Cl)cc2Nc2ccc(F)cc2)CC1 ZINC000426365889 856260471 /nfs/dbraw/zinc/26/04/71/856260471.db2.gz NWWIOCVOXLWAFH-UHFFFAOYSA-N 0 3 404.917 4.189 20 0 HIADHN CCOc1cc(CN(C)C/C(C)=C/c2ccccc2)ccc1O[C@@H](C)C(=O)N(C)C ZINC000426376022 856264450 /nfs/dbraw/zinc/26/44/50/856264450.db2.gz HWOUBHUVJJRDQJ-ZAQQZEBGSA-N 0 3 410.558 4.476 20 0 HIADHN Cc1cccc(-c2cncc(C(=O)N(C)C3CCN(CCc4ccccn4)CC3)c2)c1 ZINC000426425103 856283536 /nfs/dbraw/zinc/28/35/36/856283536.db2.gz OUIPZMWWISZSFD-UHFFFAOYSA-N 0 3 414.553 4.231 20 0 HIADHN CC(C)CN(CCN(C)C)C(=O)Nc1cccc(COc2ccc3c(c2)OCO3)c1 ZINC000426601960 856368485 /nfs/dbraw/zinc/36/84/85/856368485.db2.gz BRJOVRCTBDOGOQ-UHFFFAOYSA-N 0 3 413.518 4.046 20 0 HIADHN CCS[C@H]1CCCC[C@@H]1NC(=O)Nc1ccc(N2CCN(CC)CC2)cc1C ZINC000426630853 856382978 /nfs/dbraw/zinc/38/29/78/856382978.db2.gz VYMOOBKJHXWQIW-SFTDATJTSA-N 0 3 404.624 4.323 20 0 HIADHN CCS[C@H]1CCCC[C@H]1NC(=O)Nc1ccc(N2CCN(CC)CC2)cc1C ZINC000426630852 856383224 /nfs/dbraw/zinc/38/32/24/856383224.db2.gz VYMOOBKJHXWQIW-RTWAWAEBSA-N 0 3 404.624 4.323 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3nc(C(C)(C)C)cs3)CC2)C[C@H](C)O1 ZINC000426633167 856383812 /nfs/dbraw/zinc/38/38/12/856383812.db2.gz CHVLOKKNUDXSPD-IYBDPMFKSA-N 0 3 408.612 4.184 20 0 HIADHN COc1cccc(/C=C(/CC(=O)N2CCNC(C)(C)C2)c2nc3ccccc3s2)c1 ZINC000426691871 856415456 /nfs/dbraw/zinc/41/54/56/856415456.db2.gz MEVMYBSUISETKA-AQTBWJFISA-N 0 3 421.566 4.446 20 0 HIADHN CC(C)Oc1cccc(CN(C)[C@H](C)c2cccc(N3CCCS3(=O)=O)c2)c1 ZINC000426747859 856452338 /nfs/dbraw/zinc/45/23/38/856452338.db2.gz SIRNMVRRAYXZGD-GOSISDBHSA-N 0 3 402.560 4.207 20 0 HIADHN COc1ccccc1C(=O)N(Cc1ccccc1Br)C1CCN(C)CC1 ZINC000426781555 856475569 /nfs/dbraw/zinc/47/55/69/856475569.db2.gz CQIOUAAYJOMLKL-UHFFFAOYSA-N 0 3 417.347 4.194 20 0 HIADHN Cc1ccc(-c2c[nH]cc2C(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)s1 ZINC000427149775 856671242 /nfs/dbraw/zinc/67/12/42/856671242.db2.gz JROJXGDEEFLJSN-IAGOWNOFSA-N 0 3 415.603 4.403 20 0 HIADHN O=C(CCCCC(=O)c1ccc(F)cc1)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000427163658 856682015 /nfs/dbraw/zinc/68/20/15/856682015.db2.gz IRTAKOFWGIEOAI-UHFFFAOYSA-N 0 3 412.505 4.164 20 0 HIADHN C[C@@H]1CCN(C(=O)c2ccc(-c3ccccc3)[nH]c2=O)CCN1Cc1ccccc1 ZINC000437464380 862827061 /nfs/dbraw/zinc/82/70/61/862827061.db2.gz CDSGDMOFFNSAQJ-LJQANCHMSA-N 0 3 401.510 4.191 20 0 HIADHN COc1ccc(C(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)c2ccccc12 ZINC000427286826 856752668 /nfs/dbraw/zinc/75/26/68/856752668.db2.gz HWFGXQHFPVUBQF-KDURUIRLSA-N 0 3 410.558 4.200 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)CCSc3ccccc3F)CC2)C[C@H](C)O1 ZINC000427290306 856753683 /nfs/dbraw/zinc/75/36/83/856753683.db2.gz AGRGSVZYSFYHEA-ROUUACIJSA-N 0 3 408.583 4.046 20 0 HIADHN Cc1nc(CC(C)C)sc1C(=O)N1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000427291381 856755143 /nfs/dbraw/zinc/75/51/43/856755143.db2.gz FTVUISIIGSPJNQ-IRXDYDNUSA-N 0 3 407.624 4.002 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3csc(-c4ccccc4)n3)CC2)C[C@@H](C)O1 ZINC000427292262 856755395 /nfs/dbraw/zinc/75/53/95/856755395.db2.gz OQQYCYJPYAZTLP-QZTJIDSGSA-N 0 3 413.587 4.162 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3ccc(N4CCCCC4)cc3)CC2)C[C@@H](C)O1 ZINC000427295519 856757305 /nfs/dbraw/zinc/75/73/05/856757305.db2.gz JWNQWXHVJAINMY-NHCUHLMSSA-N 0 3 413.606 4.028 20 0 HIADHN C[C@@H]1CCN(C(=O)c2cn(C)nc2-c2ccccc2Cl)CCN1Cc1ccccc1 ZINC000437471184 862832978 /nfs/dbraw/zinc/83/29/78/862832978.db2.gz JDGVTFZTNPPTFG-GOSISDBHSA-N 0 3 422.960 4.477 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)c3ccc(Oc4ccccc4)o3)CC2)C[C@H](C)O1 ZINC000427297894 856758688 /nfs/dbraw/zinc/75/86/88/856758688.db2.gz XPZGQHSRBRWSTB-OALUTQOASA-N 0 3 412.530 4.423 20 0 HIADHN C[C@H](CC(=O)N1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1)Cc1cccc(F)c1 ZINC000427298504 856758956 /nfs/dbraw/zinc/75/89/56/856758956.db2.gz CXYPGVROQPTAGK-UFYCRDLUSA-N 0 3 404.570 4.132 20 0 HIADHN Cc1sc(-c2ccco2)nc1C(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000427299390 856759537 /nfs/dbraw/zinc/75/95/37/856759537.db2.gz MIOJNJMGLMZHBV-HZPDHXFCSA-N 0 3 417.575 4.063 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)[C@@H]3C[C@]34CCCc3ccccc34)CC2)C[C@H](C)O1 ZINC000427308550 856763350 /nfs/dbraw/zinc/76/33/50/856763350.db2.gz OGFUULZWMOAIKP-XDNNPWBZSA-N 0 3 410.602 4.019 20 0 HIADHN Cc1cc(OC(F)F)c(C(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)s1 ZINC000427313877 856765830 /nfs/dbraw/zinc/76/58/30/856765830.db2.gz OIDQNWGDZBVTBW-ZIAGYGMSSA-N 0 3 416.534 4.009 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)c3cc(-c4ccccc4)ns3)CC2)C[C@H](C)O1 ZINC000427319793 856768607 /nfs/dbraw/zinc/76/86/07/856768607.db2.gz JOGAJUAAOIRIDZ-ROUUACIJSA-N 0 3 413.587 4.162 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Cc3c[nH]c4ccc(Cl)cc34)CC2)C[C@H](C)O1 ZINC000427318840 856768685 /nfs/dbraw/zinc/76/86/85/856768685.db2.gz BYRNTRKURNFAPE-CALCHBBNSA-N 0 3 417.981 4.102 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3ccc(-c4ccc(F)cc4)o3)CC2)C[C@H](C)O1 ZINC000427319892 856768757 /nfs/dbraw/zinc/76/87/57/856768757.db2.gz JXKLEKLRKRBMFR-HDICACEKSA-N 0 3 414.521 4.437 20 0 HIADHN Cc1nc(-c2ccco2)ccc1C(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000427323362 856771605 /nfs/dbraw/zinc/77/16/05/856771605.db2.gz XNKCGGRRPYIXTL-HDICACEKSA-N 0 3 411.546 4.002 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)[C@@H]3C[C@@H]3c3ccccc3Cl)CC2)C[C@H](C)O1 ZINC000427362487 856794292 /nfs/dbraw/zinc/79/42/92/856794292.db2.gz MUGDVJOEXZHEKK-HRQSHJORSA-N 0 3 404.982 4.181 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)Cc1cccc(F)c1F ZINC000427381366 856802578 /nfs/dbraw/zinc/80/25/78/856802578.db2.gz GBKRYVCWTBDSQW-UHFFFAOYSA-N 0 3 400.391 4.117 20 0 HIADHN C[C@H]1CCN(C(=O)c2c[nH]nc2-c2ccc(Cl)cc2)CCN1Cc1ccccc1 ZINC000437477024 862837424 /nfs/dbraw/zinc/83/74/24/862837424.db2.gz SPUXXDXGDQDOBJ-KRWDZBQOSA-N 0 3 408.933 4.467 20 0 HIADHN COc1ccccc1-c1csc(C2CCN(C(=O)[C@H]3CCCN3C3CC3)CC2)n1 ZINC000427444696 856822714 /nfs/dbraw/zinc/82/27/14/856822714.db2.gz SSBWFBSUKMGKIX-HXUWFJFHSA-N 0 3 411.571 4.152 20 0 HIADHN FC(F)(F)c1cnc2c(c1)[C@H](NCc1ccc(CN3CCOCC3)cc1)CCC2 ZINC000427571634 856871707 /nfs/dbraw/zinc/87/17/07/856871707.db2.gz CUTQOTMEJOSMFF-HXUWFJFHSA-N 0 3 405.464 4.100 20 0 HIADHN CSc1cc(C(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)ccc1NC(C)=O ZINC000437488172 862845589 /nfs/dbraw/zinc/84/55/89/862845589.db2.gz CSGUBCMLJLGWBO-QGZVFWFLSA-N 0 3 411.571 4.104 20 0 HIADHN COc1ccc(C2(CN[C@@H](C)c3ncc(Br)cc3F)CCOCC2)cc1 ZINC000427605978 856886145 /nfs/dbraw/zinc/88/61/45/856886145.db2.gz FZQZWKCRNCIMBO-AWEZNQCLSA-N 0 3 423.326 4.391 20 0 HIADHN C[C@H]1CCN(C(=O)c2ccccc2NC(=O)C(C)(C)C)CCN1Cc1ccccc1 ZINC000437499191 862854538 /nfs/dbraw/zinc/85/45/38/862854538.db2.gz UWYKMLSLDOJUOM-IBGZPJMESA-N 0 3 407.558 4.408 20 0 HIADHN C[C@@H](NCC(C)(C)c1ccc2c(c1)OCCO2)c1ncc(Br)cc1F ZINC000427704513 856916169 /nfs/dbraw/zinc/91/61/69/856916169.db2.gz DMVDZHZEHMUXSN-GFCCVEGCSA-N 0 3 409.299 4.383 20 0 HIADHN CCN1CCN(c2ccc(C(=O)NC34CCC(C(F)(F)F)(CC3)CC4)cc2)CC1 ZINC000427834010 856975554 /nfs/dbraw/zinc/97/55/54/856975554.db2.gz QNKMJIDBSWQVOK-UHFFFAOYSA-N 0 3 409.496 4.214 20 0 HIADHN COc1ccc(NC(=O)C(Cc2c(C)cc(C)cc2C)C(F)(F)F)cc1NC(N)=O ZINC000427942662 857016935 /nfs/dbraw/zinc/01/69/35/857016935.db2.gz WAKKPIOCBLKTBQ-MRXNPFEDSA-N 0 3 423.435 4.471 20 0 HIADHN C[C@H](C(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1)c1ccc2c(c1)OCO2 ZINC000428006583 857039456 /nfs/dbraw/zinc/03/94/56/857039456.db2.gz PCAADJKLESDHNB-WMZOPIPTSA-N 0 3 400.544 4.170 20 0 HIADHN Cn1ccnc1SCc1ccc(C(=O)NC[C@@]2(C)CCCN2Cc2ccccc2)o1 ZINC000428325280 857154736 /nfs/dbraw/zinc/15/47/36/857154736.db2.gz LLOJXISKPXTYHI-HSZRJFAPSA-N 0 3 424.570 4.090 20 0 HIADHN COc1cc(CN2CC[C@@H](O)[C@H](C)C2)ccc1OCc1cccc(C(F)(F)F)c1 ZINC000428466502 857211670 /nfs/dbraw/zinc/21/16/70/857211670.db2.gz WYNCIVBCBYFNPN-DNVCBOLYSA-N 0 3 409.448 4.496 20 0 HIADHN Cc1nc(-c2ccc(C)cc2)c(CC(=O)Nc2cccc(CN3CC[C@@H](O)C3)c2)s1 ZINC000428531476 857246479 /nfs/dbraw/zinc/24/64/79/857246479.db2.gz KRBFBCDUWIPULK-OAQYLSRUSA-N 0 3 421.566 4.175 20 0 HIADHN Cc1cc(Br)c(C(=O)Nc2cccc(CN3CC[C@H](O)C3)c2)cc1Cl ZINC000428536394 857248885 /nfs/dbraw/zinc/24/88/85/857248885.db2.gz MQCKPBFOOZSFQZ-HNNXBMFYSA-N 0 3 423.738 4.230 20 0 HIADHN O=C(CSc1cccc(C(F)(F)F)c1)Nc1cccc(CN2CC[C@H](O)C2)c1 ZINC000428542324 857254464 /nfs/dbraw/zinc/25/44/64/857254464.db2.gz UWBNYURBQGHFIA-KRWDZBQOSA-N 0 3 410.461 4.003 20 0 HIADHN COc1cccc(CC2(C(=O)Nc3cccc(CN4CC[C@H](O)C4)c3)CCCCC2)c1 ZINC000428543517 857254583 /nfs/dbraw/zinc/25/45/83/857254583.db2.gz GFVQHKOVKSWZGS-QHCPKHFHSA-N 0 3 422.569 4.394 20 0 HIADHN COc1ccc2nc(CNC[C@@]3(Cc4ccc(F)cc4)CCC[C@H]3O)sc2c1 ZINC000428571141 857269297 /nfs/dbraw/zinc/26/92/97/857269297.db2.gz JFLTVWOMADCDLH-IRLDBZIGSA-N 0 3 400.519 4.308 20 0 HIADHN Cc1ccccc1[C@@H](NC(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1)C1CC1 ZINC000428586494 857272732 /nfs/dbraw/zinc/27/27/32/857272732.db2.gz OHFXIVPWTXTQEU-VWNXMTODSA-N 0 3 407.558 4.036 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)N1CCC(c2ncccc2Cl)CC1 ZINC000428590023 857273529 /nfs/dbraw/zinc/27/35/29/857273529.db2.gz YKOZWHYCKJJZGW-FQEVSTJZSA-N 0 3 412.965 4.289 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N(C)[C@@H](C)Cc3ccccc3OC)c(C)c2)CC1 ZINC000437573004 862892847 /nfs/dbraw/zinc/89/28/47/862892847.db2.gz XZDNJBPWQCGAQA-FQEVSTJZSA-N 0 3 424.589 4.240 20 0 HIADHN O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)Nc1ccc(Cl)cc1Cl ZINC000428689627 857298176 /nfs/dbraw/zinc/29/81/76/857298176.db2.gz CKQAACZHTMZTNW-QGZVFWFLSA-N 0 3 408.329 4.406 20 0 HIADHN C[C@@H](NC(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1)c1cc2ccccc2o1 ZINC000428760508 857323340 /nfs/dbraw/zinc/32/33/40/857323340.db2.gz SVCXPSJMIYWUAE-WIYYLYMNSA-N 0 3 407.514 4.084 20 0 HIADHN COC(=O)c1occc1CN(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000428795652 857345002 /nfs/dbraw/zinc/34/50/02/857345002.db2.gz SFKDWSXSYZUXMY-HSZRJFAPSA-N 0 3 419.525 4.128 20 0 HIADHN Fc1ccc2nc(CNC[C@@H](c3ccccc3Cl)N3CCOCC3)sc2c1 ZINC000428853416 857372475 /nfs/dbraw/zinc/37/24/75/857372475.db2.gz ZOLZKMMLMXOFPW-SFHVURJKSA-N 0 3 405.926 4.252 20 0 HIADHN OC[C@@H](CNCc1nc2ccc(F)cc2s1)Cc1ccc(OC(F)(F)F)cc1 ZINC000428866074 857377509 /nfs/dbraw/zinc/37/75/09/857377509.db2.gz YCXREPGOWOZGKH-CYBMUJFWSA-N 0 3 414.424 4.275 20 0 HIADHN CO[C@@H](C)c1nc(CNC(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)cs1 ZINC000428918604 857414631 /nfs/dbraw/zinc/41/46/31/857414631.db2.gz GOUCZJUHZSNRRM-RDJZCZTQSA-N 0 3 422.620 4.184 20 0 HIADHN C[C@@H](c1cccc(Cl)c1)N(C)C(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000429008770 857454478 /nfs/dbraw/zinc/45/44/78/857454478.db2.gz MVCDEECCULTZOW-PGRDOPGGSA-N 0 3 415.965 4.334 20 0 HIADHN CN(Cc1cccc2ccccc21)C(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000429016248 857457944 /nfs/dbraw/zinc/45/79/44/857457944.db2.gz BJWRHMNKTNVVQK-DEOSSOPVSA-N 0 3 417.553 4.272 20 0 HIADHN Cc1ccc([C@@H](C)N(C)C(=O)NC[C@H]2CN(Cc3ccccc3)CCCO2)c(C)c1 ZINC000429017750 857459463 /nfs/dbraw/zinc/45/94/63/857459463.db2.gz GMBHNDMVBUZCFW-GGAORHGYSA-N 0 3 409.574 4.297 20 0 HIADHN CCCN(CCc1cccs1)C(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000429018909 857460135 /nfs/dbraw/zinc/46/01/35/857460135.db2.gz JMYIEQYHCXZHHI-NRFANRHFSA-N 0 3 415.603 4.003 20 0 HIADHN CC(C)OCc1ccc(NC(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)cc1 ZINC000429028555 857463960 /nfs/dbraw/zinc/46/39/60/857463960.db2.gz KPKAKIAVADAHAG-WOJBJXKFSA-N 0 3 417.594 4.355 20 0 HIADHN CC(C)[C@H](c1ccccc1)N(C)C(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000429036689 857468724 /nfs/dbraw/zinc/46/87/24/857468724.db2.gz UEXBOWAMFFJYJO-DNQXCXABSA-N 0 3 409.574 4.316 20 0 HIADHN O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)Nc1ccccc1N1CCCCC1 ZINC000429042369 857472230 /nfs/dbraw/zinc/47/22/30/857472230.db2.gz DSZSDXZHHQIXDB-JOCHJYFZSA-N 0 3 422.573 4.090 20 0 HIADHN CSCc1ccc(NC(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)cc1 ZINC000429059952 857485746 /nfs/dbraw/zinc/48/57/46/857485746.db2.gz BRRVLYHLDOIZJE-HDICACEKSA-N 0 3 405.608 4.293 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)N(C[C@H]1CCCO1)C1CCCC1 ZINC000429066772 857490953 /nfs/dbraw/zinc/49/09/53/857490953.db2.gz WBHQAGRVHGRTLC-JOCHJYFZSA-N 0 3 417.619 4.233 20 0 HIADHN CCOc1cc(C)ccc1NC(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000429109766 857513616 /nfs/dbraw/zinc/51/36/16/857513616.db2.gz NRDVIFBDBZWUJV-KDURUIRLSA-N 0 3 403.567 4.137 20 0 HIADHN CCOc1ccc(NC(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)cc1Cl ZINC000429113705 857515860 /nfs/dbraw/zinc/51/58/60/857515860.db2.gz XUCUOJLVGSWMRN-IRXDYDNUSA-N 0 3 423.985 4.482 20 0 HIADHN C[C@H](NC(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1)c1cc2ccccc2o1 ZINC000429188365 857546693 /nfs/dbraw/zinc/54/66/93/857546693.db2.gz MQGSNZLJQWATGB-QRVBRYPASA-N 0 3 413.562 4.415 20 0 HIADHN C[C@H](NC(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1)c1ccccc1Cl ZINC000429192481 857548128 /nfs/dbraw/zinc/54/81/28/857548128.db2.gz HNYUEXVBMWWVOF-KSZLIROESA-N 0 3 407.986 4.322 20 0 HIADHN Cc1nc2ccc(NC(=O)N3CCC(CCN4C[C@@H](C)O[C@H](C)C4)CC3)cc2s1 ZINC000429219369 857560403 /nfs/dbraw/zinc/56/04/03/857560403.db2.gz HPYBQQATMLNPCL-HZPDHXFCSA-N 0 3 416.591 4.348 20 0 HIADHN CCCn1ccnc1CCCN(C)[C@H](C)C(=O)N(c1nccs1)C1CCCCC1 ZINC000429225137 857563215 /nfs/dbraw/zinc/56/32/15/857563215.db2.gz DEUBIFASZDBYTA-GOSISDBHSA-N 0 3 417.623 4.368 20 0 HIADHN O=C(CN[C@H]1Cc2cccc(O)c2C1)N[C@H](c1ccccc1)c1cccc(Cl)c1 ZINC000429227523 857564316 /nfs/dbraw/zinc/56/43/16/857564316.db2.gz OAYNMYKUYHLSNZ-GBXCKJPGSA-N 0 3 406.913 4.008 20 0 HIADHN Cc1csc2nc(CNC(C)(C)Cc3ccc(Br)c(C)c3)cc(=O)n12 ZINC000429245915 857571427 /nfs/dbraw/zinc/57/14/27/857571427.db2.gz QCKIRTSLULPWGM-UHFFFAOYSA-N 0 3 420.376 4.246 20 0 HIADHN CCC1(CC)[C@H](NCC(=O)Nc2c(F)cc(F)cc2Br)[C@H](C)[C@@H]1OC ZINC000429316800 857600887 /nfs/dbraw/zinc/60/08/87/857600887.db2.gz WYWLUNQURXKFHE-HKJPBSJPSA-N 0 3 419.310 4.095 20 0 HIADHN Cc1cc(C)c(-c2csc(NC(=O)CN[C@H]3Cc4cccc(O)c4C3)n2)cc1C ZINC000429319494 857602287 /nfs/dbraw/zinc/60/22/87/857602287.db2.gz UUNHLYBBAMLPQP-KRWDZBQOSA-N 0 3 407.539 4.136 20 0 HIADHN C[C@@H](NC[C@H](CO)Cc1ccccc1Br)c1nc2c(s1)CCCC2 ZINC000429415958 857654389 /nfs/dbraw/zinc/65/43/89/857654389.db2.gz JLVWTFPGXKXSSL-ZIAGYGMSSA-N 0 3 409.393 4.286 20 0 HIADHN Cn1cc([C@H](NC[C@]2(Cc3ccc(F)cc3)CCC[C@H]2O)c2cccc(F)c2)cn1 ZINC000429453484 857678532 /nfs/dbraw/zinc/67/85/32/857678532.db2.gz OYZWZUXPCIQDNT-WXFUMESZSA-N 0 3 411.496 4.151 20 0 HIADHN Cc1cccc([C@H](C)CNC(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)c1 ZINC000429460493 857682327 /nfs/dbraw/zinc/68/23/27/857682327.db2.gz YYARLBZMZGSWLJ-NJYVYQBISA-N 0 3 401.595 4.019 20 0 HIADHN Cc1noc(C[C@@H](N[C@H](C)c2ccc(NC(=O)NC3CC3)cc2)c2ccccc2)n1 ZINC000429474816 857687997 /nfs/dbraw/zinc/68/79/97/857687997.db2.gz RXALJQARXXZZOS-QVKFZJNVSA-N 0 3 405.502 4.297 20 0 HIADHN Cc1noc(C[C@H](N[C@H](C)c2ccc(OCc3nccn3C)cc2)c2ccccc2)n1 ZINC000429478482 857688978 /nfs/dbraw/zinc/68/89/78/857688978.db2.gz YNZBLEPQIDJVTI-VGSWGCGISA-N 0 3 417.513 4.325 20 0 HIADHN Cc1c(CNC(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)oc2ccccc12 ZINC000429486629 857692503 /nfs/dbraw/zinc/69/25/03/857692503.db2.gz DCVYUNWMZPQIJQ-ROUUACIJSA-N 0 3 413.562 4.162 20 0 HIADHN Cc1ncsc1CN(C)C(=O)N[C@H](CN1CCc2ccccc2C1)C(C)(C)C ZINC000429491926 857694534 /nfs/dbraw/zinc/69/45/34/857694534.db2.gz LVFRWIKUESFMTO-HXUWFJFHSA-N 0 3 400.592 4.066 20 0 HIADHN Cc1cccnc1[C@H](NC(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1)C(C)C ZINC000429499420 857699131 /nfs/dbraw/zinc/69/91/31/857699131.db2.gz UDVXJTGNLROJNA-KCZVDYSFSA-N 0 3 416.610 4.008 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)Nc3cc4c(cc3Cl)CCC4=O)cc2)CC1 ZINC000429500368 857699160 /nfs/dbraw/zinc/69/91/60/857699160.db2.gz XXIQZZOEFFNHGD-UHFFFAOYSA-N 0 3 411.933 4.252 20 0 HIADHN CC(C(=O)N1CC(C)CN(C(=O)[C@@H](C)C(F)(F)F)c2ccccc21)C(F)(F)F ZINC000429526117 857718239 /nfs/dbraw/zinc/71/82/39/857718239.db2.gz GJHFZJGQWTZJBM-VXGBXAGGSA-N 0 3 410.358 4.399 20 0 HIADHN O=C1[C@H](N2CCC(c3ccncc3)CC2)CCCN1Cc1cccc(C(F)(F)F)c1 ZINC000429539465 857731904 /nfs/dbraw/zinc/73/19/04/857731904.db2.gz VMLFXVNRJSHMPK-OAQYLSRUSA-N 0 3 417.475 4.471 20 0 HIADHN Cc1noc(C[C@@H](NCCOc2cc(F)cc(Br)c2)c2ccccc2)n1 ZINC000429540108 857732297 /nfs/dbraw/zinc/73/22/97/857732297.db2.gz LNRHXKQSZZQSKA-GOSISDBHSA-N 0 3 420.282 4.232 20 0 HIADHN CCOC(=O)c1csc(C2CCN(CCC(=O)Nc3cccc(Cl)c3)CC2)n1 ZINC000429580904 857766002 /nfs/dbraw/zinc/76/60/02/857766002.db2.gz WLFCNTHOMHJCTR-UHFFFAOYSA-N 0 3 421.950 4.181 20 0 HIADHN O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)Nc1c(F)cc(Cl)cc1F ZINC000429613689 857794647 /nfs/dbraw/zinc/79/46/47/857794647.db2.gz USXUKHPHELJGCB-MRXNPFEDSA-N 0 3 409.864 4.031 20 0 HIADHN Cc1ccc(NC(=O)NC[C@H]2CN(Cc3ccccc3)CCCO2)cc1-c1ncco1 ZINC000429615458 857798473 /nfs/dbraw/zinc/79/84/73/857798473.db2.gz ZSPZEGQASAIBHF-NRFANRHFSA-N 0 3 420.513 4.063 20 0 HIADHN O=C(NC[C@H]1CN(Cc2ccccc2)CCCO1)Nc1ccc(-c2ccc[nH]2)cc1 ZINC000429622849 857802891 /nfs/dbraw/zinc/80/28/91/857802891.db2.gz GMGKJHDWFCDFJD-QFIPXVFZSA-N 0 3 404.514 4.094 20 0 HIADHN Cc1ccc(-c2noc(CCCN3CCC(Oc4ncccc4C)CC3)n2)cc1F ZINC000429698113 857840603 /nfs/dbraw/zinc/84/06/03/857840603.db2.gz BMSKGVDYMMNPNO-UHFFFAOYSA-N 0 3 410.493 4.364 20 0 HIADHN COc1ccc(NC(=O)[C@H](N[C@H]2CCC[C@H]2CCO)c2ccccc2)cc1Cl ZINC000429765588 857877345 /nfs/dbraw/zinc/87/73/45/857877345.db2.gz AZFUPIJECIZRQB-PAXLWEDBSA-N 0 3 402.922 4.169 20 0 HIADHN CC(C)(C)C(=O)c1ccc(NC(=O)NC[C@H]2CN(Cc3ccccc3)CCCO2)cc1 ZINC000429767734 857878710 /nfs/dbraw/zinc/87/87/10/857878710.db2.gz BKLHDDDYAUWLJI-QFIPXVFZSA-N 0 3 423.557 4.328 20 0 HIADHN CC(C)N1CC[C@H](N[C@@H](C)C(=O)NCc2cccs2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000429777635 857881804 /nfs/dbraw/zinc/88/18/04/857881804.db2.gz WGIMKSWCYSQKRD-PNHOKKKMSA-N 0 3 423.985 4.359 20 0 HIADHN CCN(CC)[C@H](CNC(=O)[C@@H](C)[C@@H]1OCCc2sccc21)c1cccc(OC)c1 ZINC000429857702 857914186 /nfs/dbraw/zinc/91/41/86/857914186.db2.gz KPFAWPOGFSJZBF-AQKFKSFVSA-N 0 3 416.587 4.206 20 0 HIADHN COc1ccc([C@H](NC(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)C(F)(F)F)cc1 ZINC000429983454 857982552 /nfs/dbraw/zinc/98/25/52/857982552.db2.gz WEJMQRZQTKBWJV-CCKFTAQKSA-N 0 3 409.452 4.289 20 0 HIADHN CCCN1c2ccc(NC(=O)N[C@@H](C)[C@@H](c3ccccc3)N(C)C)cc2CCC1=O ZINC000429982837 857983108 /nfs/dbraw/zinc/98/31/08/857983108.db2.gz SVUKDODKNORMRC-SBUREZEXSA-N 0 3 408.546 4.189 20 0 HIADHN COc1ccccc1-c1ncc(CN2CCC[C@H](C(=O)Nc3ccccc3)C2)cn1 ZINC000430012090 857995923 /nfs/dbraw/zinc/99/59/23/857995923.db2.gz FAYHFFYVRRTZKY-IBGZPJMESA-N 0 3 402.498 4.003 20 0 HIADHN Cc1ccc(-c2nnc(SC[C@@H]3CN(Cc4ccccc4)CCCO3)n2C)cc1 ZINC000430107331 858034415 /nfs/dbraw/zinc/03/44/15/858034415.db2.gz WXUWSLTVOOZOJI-NRFANRHFSA-N 0 3 408.571 4.174 20 0 HIADHN COCCn1c2ccccc2nc1SC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000430115546 858037936 /nfs/dbraw/zinc/03/79/36/858037936.db2.gz BKSQXMPMACNNCI-HXUWFJFHSA-N 0 3 411.571 4.066 20 0 HIADHN Cn1cc(CN(Cc2ccc(Cl)cc2)CC2CCN(C(=O)C(C)(C)C)CC2)cn1 ZINC000430280651 858107127 /nfs/dbraw/zinc/10/71/27/858107127.db2.gz WPUQHQPHDHFPFA-UHFFFAOYSA-N 0 3 416.997 4.360 20 0 HIADHN O=C(N[C@@H](CC1CC1)c1cc(F)cc(Br)c1)N1CC[C@@H](N2CC=CC2)C1 ZINC000430291300 858110806 /nfs/dbraw/zinc/11/08/06/858110806.db2.gz GEKVSELDMPESFM-MOPGFXCFSA-N 0 3 422.342 4.085 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)N1CC[C@@H](OCCCc2ccccc2)C1 ZINC000430456802 858174667 /nfs/dbraw/zinc/17/46/67/858174667.db2.gz KGWDDSARIRXANQ-HXUWFJFHSA-N 0 3 406.526 4.358 20 0 HIADHN Cc1ccc([C@H](N[C@@H](C)c2ccc(Br)c(S(N)(=O)=O)c2)C2CC2)cc1 ZINC000430701445 858273392 /nfs/dbraw/zinc/27/33/92/858273392.db2.gz VVBWBLHUWBYVPR-DJJJIMSYSA-N 0 3 423.376 4.207 20 0 HIADHN C[C@H](N[C@H](c1ccccc1)C1CCC1)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000430720340 858278158 /nfs/dbraw/zinc/27/81/58/858278158.db2.gz MOFOALHCTBJVFT-ORAYPTAESA-N 0 3 423.376 4.289 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](NC[C@H]2CCC(F)(F)C2)c2ccc(F)c(F)c2)c1 ZINC000430739840 858283376 /nfs/dbraw/zinc/28/33/76/858283376.db2.gz FLGLLIPBAPTGES-ORAYPTAESA-N 0 3 415.452 4.483 20 0 HIADHN C[C@@H]1CN(Cc2ccc(-n3ccc(C(F)(F)F)n3)cc2)C[C@]2(CCO[C@H](C)C2)O1 ZINC000430766180 858296149 /nfs/dbraw/zinc/29/61/49/858296149.db2.gz KQFBXWHEXORBMZ-JXXFODFXSA-N 0 3 409.452 4.050 20 0 HIADHN COc1ccccc1-n1nccc1CNc1cccc(CN2CCSCC2)c1C ZINC000430765704 858296319 /nfs/dbraw/zinc/29/63/19/858296319.db2.gz VQTZZKBKORKRQL-UHFFFAOYSA-N 0 3 408.571 4.350 20 0 HIADHN CCN(CC)[C@H](CN1C(=O)N[C@@H](c2ccc(Cl)c(F)c2)C1=O)c1ccsc1 ZINC000430867541 858345812 /nfs/dbraw/zinc/34/58/12/858345812.db2.gz KVKAKQSOQMTONQ-SJORKVTESA-N 0 3 409.914 4.217 20 0 HIADHN CC1CCN([C@@H](CN2C(=O)CN(Cc3ccc(F)cc3)C2=O)c2cccs2)CC1 ZINC000430944628 858377337 /nfs/dbraw/zinc/37/73/37/858377337.db2.gz NBYUJTJQGDGAOM-IBGZPJMESA-N 0 3 415.534 4.125 20 0 HIADHN CC1CCN([C@@H](CN2C(=O)[C@H](Cc3ccccc3)N(C)C2=O)c2cccs2)CC1 ZINC000430955313 858381443 /nfs/dbraw/zinc/38/14/43/858381443.db2.gz LXPSLGXORASVJQ-PMACEKPBSA-N 0 3 411.571 4.026 20 0 HIADHN O=C1N[C@H](C[C@@H]2CCCc3ccccc32)C(=O)N1C1CCN(Cc2ccccc2)CC1 ZINC000430980428 858390033 /nfs/dbraw/zinc/39/00/33/858390033.db2.gz DWGFYIXZYIWOBX-XUZZJYLKSA-N 0 3 417.553 4.082 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](N2C(=O)N[C@H](c3ccc(Cl)cc3Cl)C2=O)C1 ZINC000431031841 858409969 /nfs/dbraw/zinc/40/99/69/858409969.db2.gz DUQGZECKOGRLPL-VVFCZOMOSA-N 0 3 418.324 4.422 20 0 HIADHN Cc1c(C(=O)N[C@H]2CCN(Cc3ccccc3)[C@H](C)C2)[nH]c2c1C(=O)CC(C)(C)C2 ZINC000431053393 858420318 /nfs/dbraw/zinc/42/03/18/858420318.db2.gz NEFAWQZZRZWMRQ-APWZRJJASA-N 0 3 407.558 4.261 20 0 HIADHN Cc1ccc([C@H](CN2C(=O)[C@H](Cc3ccccc3)N(C3CC3)C2=O)N2CCCC2)cc1 ZINC000431061230 858427706 /nfs/dbraw/zinc/42/77/06/858427706.db2.gz JEKLDLBATXLDIM-ZEQRLZLVSA-N 0 3 417.553 4.170 20 0 HIADHN CC(C)c1cccc2c1OCCC[C@H]2NCCOc1ccc(S(C)(=O)=O)cc1 ZINC000431335863 858571022 /nfs/dbraw/zinc/57/10/22/858571022.db2.gz FRVCWCAWNAVQIL-OAQYLSRUSA-N 0 3 403.544 4.096 20 0 HIADHN CC(=O)N1CCN(c2ccccc2CN[C@H]2CCCOc3c(C(C)C)cccc32)CC1 ZINC000431354310 858576546 /nfs/dbraw/zinc/57/65/46/858576546.db2.gz WXWLJURMQFPUAU-DEOSSOPVSA-N 0 3 421.585 4.482 20 0 HIADHN COc1cnccc1N1CCN(C(=O)Nc2ccccc2Oc2ccccc2)CC1 ZINC000431440774 858616922 /nfs/dbraw/zinc/61/69/22/858616922.db2.gz LZHPMPOZFYMWNO-UHFFFAOYSA-N 0 3 404.470 4.237 20 0 HIADHN Cc1ccc(NC(=O)NC[C@@H]2CCCN(Cc3c[nH]nc3-c3ccsc3)C2)cc1 ZINC000437715377 863047255 /nfs/dbraw/zinc/04/72/55/863047255.db2.gz FEHMZGXZQZQVAX-KRWDZBQOSA-N 0 3 409.559 4.480 20 0 HIADHN O=C(NC[C@H]1CCCN(Cc2c[nH]nc2-c2ccsc2)C1)Nc1cccc(F)c1 ZINC000437721974 863052446 /nfs/dbraw/zinc/05/24/46/863052446.db2.gz PCXQNTQBDAGNRO-OAHLLOKOSA-N 0 3 413.522 4.311 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CC(C)(C)[C@@H]1c1ccncc1)c1cccc(OC)c1 ZINC000431775110 858806079 /nfs/dbraw/zinc/80/60/79/858806079.db2.gz HQQMVNPCCMSQGW-YADHBBJMSA-N 0 3 410.562 4.266 20 0 HIADHN CCC(CC)n1ccc(C(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)n1 ZINC000431814208 858824472 /nfs/dbraw/zinc/82/44/72/858824472.db2.gz PCRZFKGKGFCUTC-UHFFFAOYSA-N 0 3 410.484 4.467 20 0 HIADHN COc1ccc2c(c1)[C@@H](C(=O)Nc1ccnn1[C@H]1CCN(Cc3ccccc3)C1)CC2 ZINC000431924855 858873096 /nfs/dbraw/zinc/87/30/96/858873096.db2.gz LRUWQNSUTVHLKD-UNMCSNQZSA-N 0 3 416.525 4.007 20 0 HIADHN Cc1ccc(C(=O)C2CCN(C(=O)[C@@H]3CN(C(C)(C)C)C[C@H]3C(F)(F)F)CC2)cc1 ZINC000432031961 858940791 /nfs/dbraw/zinc/94/07/91/858940791.db2.gz LIHGTPCZDUZISO-RTBURBONSA-N 0 3 424.507 4.325 20 0 HIADHN O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)N1CC2(CCC2)[C@H]1c1ccccc1 ZINC000432347374 859113148 /nfs/dbraw/zinc/11/31/48/859113148.db2.gz OWDFLOLLQSEXCJ-DNQXCXABSA-N 0 3 419.569 4.214 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)N1CCO[C@H](c2cccc(Cl)c2)C1 ZINC000467561515 881384019 /nfs/dbraw/zinc/38/40/19/881384019.db2.gz CNMNZEGWZYXSTJ-OALUTQOASA-N 0 3 419.978 4.322 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CC[C@](C)(c4ccc(F)cc4)C3)c2)CC1 ZINC000432415944 859155669 /nfs/dbraw/zinc/15/56/69/859155669.db2.gz XKGIGTPODWKUCA-DEOSSOPVSA-N 0 3 410.537 4.163 20 0 HIADHN FC(F)(F)c1cccc(C2CCC(NCc3nnnn3-c3ccccc3)CC2)c1 ZINC000432422696 859157281 /nfs/dbraw/zinc/15/72/81/859157281.db2.gz VCRMZBNPQTXBJQ-UHFFFAOYSA-N 0 3 401.436 4.497 20 0 HIADHN CC1(C)CN(C(=O)Nc2ccc(CCN3CCSCC3)cc2)[C@H]1c1ccncc1 ZINC000432765868 859345334 /nfs/dbraw/zinc/34/53/34/859345334.db2.gz DXJWZHZSRXOJDV-NRFANRHFSA-N 0 3 410.587 4.288 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@H](C)N[C@H](C)c2cc(C(=O)OC)c(C)o2)CC1 ZINC000432780860 859356700 /nfs/dbraw/zinc/35/67/00/859356700.db2.gz IXUNIAMLWHUISM-JKSUJKDBSA-N 0 3 417.525 4.067 20 0 HIADHN Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)N(C)C[C@@H](O)COCC(F)(F)F ZINC000432818206 859373381 /nfs/dbraw/zinc/37/33/81/859373381.db2.gz JMILCWKUYYLIIT-GOEBONIOSA-N 0 3 402.482 4.360 20 0 HIADHN CC[C@@H](CNC(=O)N1CCC(c2ncc(C)s2)CC1)N1CCc2ccccc2C1 ZINC000432865000 859396397 /nfs/dbraw/zinc/39/63/97/859396397.db2.gz NJZFCFOOLXITIT-NRFANRHFSA-N 0 3 412.603 4.177 20 0 HIADHN COC(=O)c1ccccc1-c1ccc(CNC[C@@]2(CO)C[C@H]2c2ccc(F)cc2)o1 ZINC000433045427 859497050 /nfs/dbraw/zinc/49/70/50/859497050.db2.gz QOJXRRBYXNSIBF-XUZZJYLKSA-N 0 3 409.457 4.128 20 0 HIADHN CCc1ccc([C@H]2CCN(CC(=O)N3CCC(OCc4ccccc4)CC3)C2)cc1 ZINC000433046942 859498454 /nfs/dbraw/zinc/49/84/54/859498454.db2.gz VUNPZEZUVSQEMC-DEOSSOPVSA-N 0 3 406.570 4.246 20 0 HIADHN CN(CCSCC(=O)N[C@H](c1nccs1)c1ccccc1)Cc1ccccc1 ZINC000433054528 859503407 /nfs/dbraw/zinc/50/34/07/859503407.db2.gz UXZJNJNLZIAWEX-NRFANRHFSA-N 0 3 411.596 4.214 20 0 HIADHN COc1ccc([C@H]2CCCN2C(=O)CN2CCC[C@@H](c3ccccc3)C2)cc1OC ZINC000433077178 859512312 /nfs/dbraw/zinc/51/23/12/859512312.db2.gz NFTZLTIZYOJSPL-FGZHOGPDSA-N 0 3 408.542 4.247 20 0 HIADHN COc1ccc([C@H]2CCCN2C(=O)CN2CCC[C@H](c3ccccc3)C2)cc1OC ZINC000433077176 859512344 /nfs/dbraw/zinc/51/23/44/859512344.db2.gz NFTZLTIZYOJSPL-FCHUYYIVSA-N 0 3 408.542 4.247 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)Cc1c[nH]c2cccc(Cl)c12 ZINC000433094854 859519853 /nfs/dbraw/zinc/51/98/53/859519853.db2.gz WDROBKJYIVRYKE-UHFFFAOYSA-N 0 3 405.876 4.232 20 0 HIADHN COc1cc(C[NH2+]C[C@H]2CCCN(c3ccccc3)C2)cc(Br)c1[O-] ZINC000433200074 859564983 /nfs/dbraw/zinc/56/49/83/859564983.db2.gz OCKDEVMLOHTQPB-OAHLLOKOSA-N 0 3 405.336 4.170 20 0 HIADHN FC(F)(F)c1ccccc1[C@H]1CCCCC[C@H]1NCc1nnnn1C1CCOCC1 ZINC000433241943 859586366 /nfs/dbraw/zinc/58/63/66/859586366.db2.gz FMQIYMJDGBPHKR-IEBWSBKVSA-N 0 3 423.483 4.250 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)N2CCC(c3ncc(C)s3)CC2)N(C)C)cc1 ZINC000433279988 859613177 /nfs/dbraw/zinc/61/31/77/859613177.db2.gz XVSIGSTZKLUHBC-HXUWFJFHSA-N 0 3 400.592 4.206 20 0 HIADHN CN(C)Cc1ccccc1C(=O)Nc1cccc(OCc2cn3ccccc3n2)c1 ZINC000433348416 859656716 /nfs/dbraw/zinc/65/67/16/859656716.db2.gz VGUPZPHJBHRFSK-UHFFFAOYSA-N 0 3 400.482 4.227 20 0 HIADHN O=C(N[C@H](c1cc(F)ccc1F)C(F)F)N[C@H](CN1CCCC1)c1ccccc1 ZINC000433617765 859812377 /nfs/dbraw/zinc/81/23/77/859812377.db2.gz OOZVVADGEHJXOR-RTBURBONSA-N 0 3 409.427 4.407 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)N[C@@H](c1cc(F)ccc1F)C(F)F ZINC000433648566 859823823 /nfs/dbraw/zinc/82/38/23/859823823.db2.gz JCQVVZIVXVQXIC-INIZCTEOSA-N 0 3 403.445 4.106 20 0 HIADHN CCNC(=O)Nc1cccc(NC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)c1C ZINC000433726206 859856472 /nfs/dbraw/zinc/85/64/72/859856472.db2.gz HETCGNUTJNJBJS-GOSISDBHSA-N 0 3 423.561 4.265 20 0 HIADHN Cc1c(Br)ccc(NC(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)c1F ZINC000433728189 859858010 /nfs/dbraw/zinc/85/80/10/859858010.db2.gz AFPBHLYYDJGFMT-FUHWJXTLSA-N 0 3 406.299 4.464 20 0 HIADHN CCNC(=O)Nc1cccc(NC(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)c1C ZINC000433744652 859871420 /nfs/dbraw/zinc/87/14/20/859871420.db2.gz LQILZVJEMHSFBL-IEBWSBKVSA-N 0 3 409.534 4.093 20 0 HIADHN CN(C(=O)c1cc(-c2ccc3c(c2)CCO3)no1)C1CCN(Cc2ccccc2)CC1 ZINC000433767583 859883975 /nfs/dbraw/zinc/88/39/75/859883975.db2.gz UPJLJMOUGQQUBW-UHFFFAOYSA-N 0 3 417.509 4.013 20 0 HIADHN Cc1ccsc1[C@@H](Cc1ccccc1)NS(=O)(=O)c1ccc(CN(C)C)cc1 ZINC000433874080 859947294 /nfs/dbraw/zinc/94/72/94/859947294.db2.gz IGOZCKIMLCKNJR-OAQYLSRUSA-N 0 3 414.596 4.380 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)c2ccccc2NCc2cccnc2)CN1Cc1ccccc1 ZINC000467688691 881482132 /nfs/dbraw/zinc/48/21/32/881482132.db2.gz MUFNQCPVOGWFKI-KNQAVFIVSA-N 0 3 400.526 4.087 20 0 HIADHN COc1ccc([C@@H](NC(=O)NC[C@H]2CCCCN2C2CC2)c2ccccc2OC)cc1 ZINC000433942214 859989542 /nfs/dbraw/zinc/98/95/42/859989542.db2.gz PDUQXISEDSOFLN-HYBUGGRVSA-N 0 3 423.557 4.109 20 0 HIADHN Cc1ccc(-c2nc(CC(=O)N[C@@H]3C[C@H](C)N(Cc4ccccc4)C3)cs2)cc1 ZINC000467695367 881489174 /nfs/dbraw/zinc/48/91/74/881489174.db2.gz QXIJLWVIURGKPO-GHTZIAJQSA-N 0 3 405.567 4.440 20 0 HIADHN CCC(=O)c1cccc(NC(=O)NCCCCN2CCN(c3ccccc3)CC2)c1 ZINC000434064648 860074143 /nfs/dbraw/zinc/07/41/43/860074143.db2.gz YDSMVGHMSVRGQL-UHFFFAOYSA-N 0 3 408.546 4.003 20 0 HIADHN O=C(Nc1cccc(-c2noc(C3CC3)n2)c1)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000434066025 860075518 /nfs/dbraw/zinc/07/55/18/860075518.db2.gz AHICIGBXQMRMPE-OAQYLSRUSA-N 0 3 417.513 4.400 20 0 HIADHN O=C(Nc1cccc(-c2noc(C3CC3)n2)c1)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000434069755 860078955 /nfs/dbraw/zinc/07/89/55/860078955.db2.gz DMXDKQJRWOJUBB-HXUWFJFHSA-N 0 3 403.486 4.010 20 0 HIADHN CC(C)(C)c1ccccc1C(=O)N1CCC[C@@H](CN2CCN(c3ccccn3)CC2)C1 ZINC000434084567 860091276 /nfs/dbraw/zinc/09/12/76/860091276.db2.gz XLGBQCWLNBVQAR-NRFANRHFSA-N 0 3 420.601 4.054 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)c1ccc(-c2nc(C3CC3)no2)cc1 ZINC000434133815 860132158 /nfs/dbraw/zinc/13/21/58/860132158.db2.gz VATWWVLXDZQXCF-SFHVURJKSA-N 0 3 416.525 4.351 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)c1ccc(-c2nc(C3CC3)no2)cc1 ZINC000434133814 860132530 /nfs/dbraw/zinc/13/25/30/860132530.db2.gz VATWWVLXDZQXCF-GOSISDBHSA-N 0 3 416.525 4.351 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2ccccc2C(C)(C)C)cc1)[C@H]1CCCN(C)C1 ZINC000434143857 860141358 /nfs/dbraw/zinc/14/13/58/860141358.db2.gz JMCJPSWNAMBQLL-FQEVSTJZSA-N 0 3 407.558 4.403 20 0 HIADHN C[C@H]1CN(C2CC2)C[C@@H]1NC(=O)c1cn(C(C)(C)C)nc1-c1ccccc1Cl ZINC000467713368 881510605 /nfs/dbraw/zinc/51/06/05/881510605.db2.gz MCORDZMZAIXYEE-LIRRHRJNSA-N 0 3 400.954 4.171 20 0 HIADHN O=C(NCCc1cc2ccccc2[nH]1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000434203141 860189176 /nfs/dbraw/zinc/18/91/76/860189176.db2.gz NQTLUMFOTADJGH-UHFFFAOYSA-N 0 3 408.571 4.123 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)Nc1cnn(Cc2ccccc2)c1 ZINC000467711868 881509822 /nfs/dbraw/zinc/50/98/22/881509822.db2.gz FNLFGOLRBAYUGS-UHFFFAOYSA-N 0 3 411.937 4.181 20 0 HIADHN CN(C)[C@@H](CNC(=O)C12C[C@H]3C[C@@H](C1)CC(C(F)(F)F)(C3)C2)Cc1ccccc1 ZINC000434217058 860201706 /nfs/dbraw/zinc/20/17/06/860201706.db2.gz JVDYEBAXTUBJIR-DHIRWMJTSA-N 0 3 408.508 4.424 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)COc1cccc(Cl)c1 ZINC000434313336 860274448 /nfs/dbraw/zinc/27/44/48/860274448.db2.gz VVXJGFHISFOHBN-HXUWFJFHSA-N 0 3 424.932 4.309 20 0 HIADHN CC(=O)c1ccc(C(=O)Nc2c(C)cnn2[C@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000434320559 860280795 /nfs/dbraw/zinc/28/07/95/860280795.db2.gz DDCOTINEESQQCK-QFIPXVFZSA-N 0 3 402.498 4.093 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)[C@H]1CCOc2ccccc21 ZINC000434322054 860282194 /nfs/dbraw/zinc/28/21/94/860282194.db2.gz SWTVTMQNOMOAQW-UNMCSNQZSA-N 0 3 416.525 4.143 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)[C@H]1CCOc2ccccc21 ZINC000434322052 860282618 /nfs/dbraw/zinc/28/26/18/860282618.db2.gz SWTVTMQNOMOAQW-IRLDBZIGSA-N 0 3 416.525 4.143 20 0 HIADHN CCSc1cc(C(=O)Nc2c(C)cnn2[C@@H]2CCN(Cc3ccccc3)C2)ccn1 ZINC000434324008 860284872 /nfs/dbraw/zinc/28/48/72/860284872.db2.gz BFQPTLYAAQLTQT-HXUWFJFHSA-N 0 3 421.570 4.398 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1cc2c(s1)CCC2 ZINC000434326979 860288922 /nfs/dbraw/zinc/28/89/22/860288922.db2.gz UXJJFEUBXGJMPC-LJQANCHMSA-N 0 3 406.555 4.441 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)COc1cc(C)ccc1F ZINC000434336137 860297450 /nfs/dbraw/zinc/29/74/50/860297450.db2.gz YLNAUPMRXXGWIT-FQEVSTJZSA-N 0 3 422.504 4.104 20 0 HIADHN O=C(NC[C@H]1CCCCN1C1CC1)N1CCC[C@@H]1c1nc2cc(Cl)ccc2[nH]1 ZINC000434349225 860305783 /nfs/dbraw/zinc/30/57/83/860305783.db2.gz GTRNGFKCAAEEEH-VQIMIIECSA-N 0 3 401.942 4.080 20 0 HIADHN O=C(CCc1nc2ccccc2n1-c1ccccc1)NC[C@H]1CCCCN1C1CC1 ZINC000434426629 860345125 /nfs/dbraw/zinc/34/51/25/860345125.db2.gz WMDJYRXLSOXYBQ-OAQYLSRUSA-N 0 3 402.542 4.091 20 0 HIADHN C[C@@H]1CN(CCOC2CCN(CCc3cccc(Cl)c3Cl)CC2)C[C@H](C)O1 ZINC000434477457 860366569 /nfs/dbraw/zinc/36/65/69/860366569.db2.gz BLPFCNYCXBZQNE-CALCHBBNSA-N 0 3 415.405 4.126 20 0 HIADHN Cc1ccc(Cl)c(NC(=O)NCc2ccccc2CN2CCC(O)CC2)c1C ZINC000434481298 860367513 /nfs/dbraw/zinc/36/75/13/860367513.db2.gz DDKXROAERSNPSM-UHFFFAOYSA-N 0 3 401.938 4.235 20 0 HIADHN CCOC(=O)CC1(NCC(=O)Nc2ccc(Cl)cc2C(F)(F)F)CCCC1 ZINC000434615480 860430569 /nfs/dbraw/zinc/43/05/69/860430569.db2.gz DTOAVXWAOFDEKZ-UHFFFAOYSA-N 0 3 406.832 4.153 20 0 HIADHN O=C1N[C@@]2(CCN(Cc3ccccc3)C2)C(=O)N1Cc1ccc(-c2cccs2)cc1 ZINC000434651668 860446157 /nfs/dbraw/zinc/44/61/57/860446157.db2.gz XEGHTMNTSDVYBU-XMMPIXPASA-N 0 3 417.534 4.112 20 0 HIADHN CC(C)(C)Oc1cccc(CCC(=O)NC[C@H](c2cccs2)N2CCCC2)n1 ZINC000467738826 881541229 /nfs/dbraw/zinc/54/12/29/881541229.db2.gz ZLLTVALTJKBJPQ-GOSISDBHSA-N 0 3 401.576 4.206 20 0 HIADHN C[C@H](c1cc2ccccc2o1)N(C)C(=O)CN1CCC(c2ncc3n2CCCC3)CC1 ZINC000434687853 860461811 /nfs/dbraw/zinc/46/18/11/860461811.db2.gz ZREKROWQPZSDNI-GOSISDBHSA-N 0 3 420.557 4.365 20 0 HIADHN COc1cc(-c2ccccc2)sc1C(=O)NCCCCN1C[C@@H](C)O[C@H](C)C1 ZINC000434765154 860487095 /nfs/dbraw/zinc/48/70/95/860487095.db2.gz BDDJOAUSXGPYIZ-IAGOWNOFSA-N 0 3 402.560 4.043 20 0 HIADHN C[C@H](CC(=O)NCCCCN1C[C@@H](C)O[C@@H](C)C1)c1cccc(C(F)(F)F)c1 ZINC000434779349 860492666 /nfs/dbraw/zinc/49/26/66/860492666.db2.gz USGSIWHJKGWIQF-ZACQAIPSSA-N 0 3 400.485 4.205 20 0 HIADHN O[C@@H](COCc1ccccc1F)CN1CCC[C@H](c2nc(C(F)(F)F)cs2)C1 ZINC000434885623 860535535 /nfs/dbraw/zinc/53/55/35/860535535.db2.gz IWRYTLLZAOBKOR-DZGCQCFKSA-N 0 3 418.456 4.058 20 0 HIADHN COc1cc(NC(=O)NCCCCN2CCN(c3ccccc3)CC2)c(C)cc1C ZINC000434892308 860539662 /nfs/dbraw/zinc/53/96/62/860539662.db2.gz QBGWCHSNCCCDQR-UHFFFAOYSA-N 0 3 410.562 4.036 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)CN2CC[C@@H](c3ccccc3)[C@H]2C)cc1OC ZINC000434894735 860541080 /nfs/dbraw/zinc/54/10/80/860541080.db2.gz IJFCTVAMCJBJGO-QIJUGHKUSA-N 0 3 408.542 4.245 20 0 HIADHN O=C(Nc1c[nH]nc1[C@H]1CCCN(Cc2ccc(-c3cc[nH]n3)o2)C1)c1ccccc1 ZINC000434983282 860584805 /nfs/dbraw/zinc/58/48/05/860584805.db2.gz QHIQVWBGNVLDLW-KRWDZBQOSA-N 0 3 416.485 4.025 20 0 HIADHN CCOc1c(Br)cc(Br)cc1CN(C)CCCCCO ZINC000435045902 860613334 /nfs/dbraw/zinc/61/33/34/860613334.db2.gz MKHFYHONAZJEAE-UHFFFAOYSA-N 0 3 409.162 4.205 20 0 HIADHN CC(C)n1ccc(NC(=O)N(CCN(C)Cc2ccccc2)Cc2ccccc2)n1 ZINC000435098827 860641093 /nfs/dbraw/zinc/64/10/93/860641093.db2.gz NVIVPFPAYWXRLC-UHFFFAOYSA-N 0 3 405.546 4.630 20 0 HIADHN CCc1cc(C)cc(CC)c1NC(=O)N1CCC(CN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000435180242 860681966 /nfs/dbraw/zinc/68/19/66/860681966.db2.gz CYCGZICUEJTHCU-OALUTQOASA-N 0 3 401.595 4.473 20 0 HIADHN CCS[C@H](C(=O)Nc1cc(C)nn1[C@H]1CCN(Cc2ccccc2)C1)C(C)C ZINC000435267307 860708508 /nfs/dbraw/zinc/70/85/08/860708508.db2.gz LZEKWBKSVVWRGG-FPOVZHCZSA-N 0 3 400.592 4.355 20 0 HIADHN CC[C@@H](OC1CCCC1)C(=O)Nc1cc(C)nn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435268651 860709316 /nfs/dbraw/zinc/70/93/16/860709316.db2.gz PFNMBVASXHWSJL-IFMALSPDSA-N 0 3 410.562 4.315 20 0 HIADHN Cc1cc(NC(=O)c2csc(C(C)C)n2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435268965 860709627 /nfs/dbraw/zinc/70/96/27/860709627.db2.gz QCEVMOBIWDVKRE-GOSISDBHSA-N 0 3 409.559 4.471 20 0 HIADHN CC[C@@H](C)c1cc(C(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)on1 ZINC000435270318 860710332 /nfs/dbraw/zinc/71/03/32/860710332.db2.gz KQIWWQGDNUWOLS-VQIMIIECSA-N 0 3 407.518 4.392 20 0 HIADHN Cc1cc(NC(=O)CO[C@@H]2CCCC[C@@H]2C)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435277532 860714429 /nfs/dbraw/zinc/71/44/29/860714429.db2.gz CXKJEDWRRDUSIG-YUXAGFNASA-N 0 3 410.562 4.172 20 0 HIADHN Cc1cc(NC(=O)c2cncc(OC(C)C)c2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435281395 860716007 /nfs/dbraw/zinc/71/60/07/860716007.db2.gz WIULMRYMFMUTJD-OAQYLSRUSA-N 0 3 419.529 4.073 20 0 HIADHN Cc1cc(NC(=O)CCCc2csc(C)n2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435285850 860718840 /nfs/dbraw/zinc/71/88/40/860718840.db2.gz ASCXRMLCOBZDLP-NRFANRHFSA-N 0 3 423.586 4.365 20 0 HIADHN CCO[C@H](C(=O)Nc1cc(C)nn1[C@H]1CCN(Cc2ccccc2)C1)c1ccccc1 ZINC000435293274 860722812 /nfs/dbraw/zinc/72/28/12/860722812.db2.gz WYNCBZZFNNHZIC-UPVQGACJSA-N 0 3 418.541 4.355 20 0 HIADHN Cc1cc(NC(=O)c2cccc(C(C)C)n2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435293260 860722911 /nfs/dbraw/zinc/72/29/11/860722911.db2.gz WUFORTSKKOUPKZ-FQEVSTJZSA-N 0 3 403.530 4.409 20 0 HIADHN CCO[C@H](C(=O)Nc1cc(C)nn1[C@@H]1CCN(Cc2ccccc2)C1)c1ccccc1 ZINC000435293275 860723385 /nfs/dbraw/zinc/72/33/85/860723385.db2.gz WYNCBZZFNNHZIC-VWNXMTODSA-N 0 3 418.541 4.355 20 0 HIADHN Cc1cc(NC(=O)Cc2c(F)cccc2F)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435299383 860726930 /nfs/dbraw/zinc/72/69/30/860726930.db2.gz OTVIZAGLDZCDLV-GOSISDBHSA-N 0 3 410.468 4.098 20 0 HIADHN CCO[C@@H](CC(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)C1=CCCC1 ZINC000435368393 860765994 /nfs/dbraw/zinc/76/59/94/860765994.db2.gz HUWLRYRSTIBEAG-VXKWHMMOSA-N 0 3 408.546 4.174 20 0 HIADHN Cc1c(C(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)cnc2ccccc12 ZINC000435367909 860766167 /nfs/dbraw/zinc/76/61/67/860766167.db2.gz BRTYTXXMJPUXKT-HXUWFJFHSA-N 0 3 411.509 4.439 20 0 HIADHN O=C(CCSc1ccccc1)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435370494 860768220 /nfs/dbraw/zinc/76/82/20/860768220.db2.gz ISUMWVAPGVIAML-FQEVSTJZSA-N 0 3 406.555 4.451 20 0 HIADHN O=C(CCc1cccc(F)c1F)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435370162 860768533 /nfs/dbraw/zinc/76/85/33/860768533.db2.gz OEZGDPMDRZAUNP-LJQANCHMSA-N 0 3 410.468 4.180 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(-c2cnco2)cc1 ZINC000435371112 860769117 /nfs/dbraw/zinc/76/91/17/860769117.db2.gz SRLFTRBBYLEBMU-OAQYLSRUSA-N 0 3 413.481 4.237 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)c1cc(-c2ccccc2)no1 ZINC000435371279 860769516 /nfs/dbraw/zinc/76/95/16/860769516.db2.gz UBLMRHKXLGTKHQ-HXUWFJFHSA-N 0 3 413.481 4.237 20 0 HIADHN O=C(CCc1c[nH]c2ccccc12)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435372760 860770247 /nfs/dbraw/zinc/77/02/47/860770247.db2.gz SJQFAKHYSAZBLX-NRFANRHFSA-N 0 3 413.525 4.383 20 0 HIADHN C[C@H](Oc1ccccc1Cl)C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435375302 860772455 /nfs/dbraw/zinc/77/24/55/860772455.db2.gz LRGDOFVGCCONLT-PKOBYXMFSA-N 0 3 424.932 4.390 20 0 HIADHN COc1ccc(Cl)cc1CC(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435374638 860772571 /nfs/dbraw/zinc/77/25/71/860772571.db2.gz RMJDIDUSRXOHDM-FQEVSTJZSA-N 0 3 424.932 4.173 20 0 HIADHN C[C@@H](Cc1cccc(F)c1)C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435374659 860773268 /nfs/dbraw/zinc/77/32/68/860773268.db2.gz JLBDLXAFQUCQAT-PGRDOPGGSA-N 0 3 406.505 4.287 20 0 HIADHN CCSc1ccc(C(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)cn1 ZINC000435375620 860773867 /nfs/dbraw/zinc/77/38/67/860773867.db2.gz VVHQCLKQQDENRJ-IBGZPJMESA-N 0 3 407.543 4.089 20 0 HIADHN O=C(C[C@H]1CCOc2ccccc21)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435378685 860775952 /nfs/dbraw/zinc/77/59/52/860775952.db2.gz FTEWYCJMWAKHHG-RTWAWAEBSA-N 0 3 416.525 4.225 20 0 HIADHN COc1cccc([C@@H](C)CC(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000435381607 860777948 /nfs/dbraw/zinc/77/79/48/860777948.db2.gz UXOCIDIAPDJXOA-UGKGYDQZSA-N 0 3 418.541 4.471 20 0 HIADHN Cc1cc(NC(=O)N[C@@H](C)CCc2ccco2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435513662 860831444 /nfs/dbraw/zinc/83/14/44/860831444.db2.gz FDCGXLLQFOSUDT-GHTZIAJQSA-N 0 3 421.545 4.374 20 0 HIADHN Cc1cc(NC(=O)N[C@@H](C)c2csc(C)n2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435514870 860832772 /nfs/dbraw/zinc/83/27/72/860832772.db2.gz DGNCDVHPIVEZOM-LPHOPBHVSA-N 0 3 424.574 4.286 20 0 HIADHN Cc1cc(NC(=O)N(C)Cc2cccs2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435518648 860836394 /nfs/dbraw/zinc/83/63/94/860836394.db2.gz JRCRFMKBGWSNCU-LJQANCHMSA-N 0 3 409.559 4.364 20 0 HIADHN CCSCC[C@@H](C)NC(=O)Nc1cc(C)nn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435521689 860838705 /nfs/dbraw/zinc/83/87/05/860838705.db2.gz IOOWBFBYLIQCKU-XLIONFOSSA-N 0 3 415.607 4.292 20 0 HIADHN Cc1csc([C@H](C)NC(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435532386 860848387 /nfs/dbraw/zinc/84/83/87/860848387.db2.gz DUKPMRHGQXVHNJ-HKUYNNGSSA-N 0 3 424.574 4.286 20 0 HIADHN Cc1ccc([C@H](CN2CCOCC2)NCc2ccc(Br)c(C)c2)cc1 ZINC000467768820 881587351 /nfs/dbraw/zinc/58/73/51/881587351.db2.gz IAOMHAVPDPYFGR-NRFANRHFSA-N 0 3 403.364 4.229 20 0 HIADHN Cc1c(NC(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)cnn1-c1ccccc1 ZINC000435542616 860857231 /nfs/dbraw/zinc/85/72/31/860857231.db2.gz GARLLEXBFVZELC-QHCPKHFHSA-N 0 3 403.530 4.448 20 0 HIADHN Cc1c(NC(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)cnn1-c1ccccc1F ZINC000435547262 860863047 /nfs/dbraw/zinc/86/30/47/860863047.db2.gz CWNCNDFJLSYTMO-VQIMIIECSA-N 0 3 407.493 4.277 20 0 HIADHN Cc1ccc([C@@H](CN2CCOCC2)NCc2ccc(Br)c(C)c2)cc1 ZINC000467768825 881588389 /nfs/dbraw/zinc/58/83/89/881588389.db2.gz IAOMHAVPDPYFGR-OAQYLSRUSA-N 0 3 403.364 4.229 20 0 HIADHN Cc1c(NC(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)cnn1-c1ccccc1F ZINC000435557210 860877345 /nfs/dbraw/zinc/87/73/45/860877345.db2.gz QOEVGYNPQGVWLL-IBGZPJMESA-N 0 3 407.493 4.058 20 0 HIADHN COC(=O)c1ccccc1-c1ccccc1C(=O)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000435653702 860936319 /nfs/dbraw/zinc/93/63/19/860936319.db2.gz HDTHSTXFZAYNQB-FQEVSTJZSA-N 0 3 414.505 4.145 20 0 HIADHN CS[C@@H]1CN(C(=O)c2c(C)onc2-c2cccc(Cl)c2Cl)C[C@H]1N(C)C ZINC000435800617 861069303 /nfs/dbraw/zinc/06/93/03/861069303.db2.gz TWWNHVKPSHBPPD-ZIAGYGMSSA-N 0 3 414.358 4.074 20 0 HIADHN CCc1nc(CN(C(C)=O)[C@@H]2CCN(Cc3cccc(-c4ccccc4C)c3)C2)no1 ZINC000435874696 861134614 /nfs/dbraw/zinc/13/46/14/861134614.db2.gz MTVPZZHXTWMJBC-JOCHJYFZSA-N 0 3 418.541 4.230 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)C3(Cc4ccc(F)cc4)CC3)CC2)c1 ZINC000437753117 863075638 /nfs/dbraw/zinc/07/56/38/863075638.db2.gz XSDMSSYLMWPWCH-UHFFFAOYSA-N 0 3 423.576 4.175 20 0 HIADHN Cc1cc(-c2cc(C(=O)N[C@@H]3CN(C4CC4)C[C@H]3C)c3cnn(C(C)C)c3n2)c(C)o1 ZINC000467804568 881627887 /nfs/dbraw/zinc/62/78/87/881627887.db2.gz XYLTWIYVDSAJDA-JLCFBVMHSA-N 0 3 421.545 4.102 20 0 HIADHN CC(C)CNC(=O)c1ccc(NC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)cc1 ZINC000437821467 863162623 /nfs/dbraw/zinc/16/26/23/863162623.db2.gz LYSRVXKCYFPTKL-FQEVSTJZSA-N 0 3 422.573 4.201 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)cc1 ZINC000437837628 863190769 /nfs/dbraw/zinc/19/07/69/863190769.db2.gz JTBJRRZANIUSKO-PMACEKPBSA-N 0 3 422.573 4.343 20 0 HIADHN C[C@@H]1CCN(C(=O)Nc2cccc(OC[C@@H]3CCCO3)c2)CCN1Cc1ccccc1 ZINC000437911540 863289580 /nfs/dbraw/zinc/28/95/80/863289580.db2.gz OOTFYYADLHSTGV-YKSBVNFPSA-N 0 3 423.557 4.373 20 0 HIADHN Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)NC[C@@H](C)CN1CCN(C)CC1 ZINC000437990796 863353486 /nfs/dbraw/zinc/35/34/86/863353486.db2.gz XKZIMPGXUOFYIV-CTNGQTDRSA-N 0 3 424.589 4.140 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)c1cc(Cl)cc(Br)c1 ZINC000438020000 863380189 /nfs/dbraw/zinc/38/01/89/863380189.db2.gz BXCWFTWXVWLQSB-UHFFFAOYSA-N 0 3 423.738 4.312 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)N[C@H]3C[C@H](c4cccc(Cl)c4)C3)CC2)C[C@H](C)O1 ZINC000438071819 863457215 /nfs/dbraw/zinc/45/72/15/863457215.db2.gz KNNWPZJVOIUUBK-TZLLFPAYSA-N 0 3 419.997 4.117 20 0 HIADHN C[C@@H]1CCC[C@H](OCc2cccc(NC(=O)N(CCN(C)C)C[C@H]3CCCO3)c2)C1 ZINC000438074770 863459660 /nfs/dbraw/zinc/45/96/60/863459660.db2.gz DUEMBPUUVZWLFH-WTIAFYNJSA-N 0 3 417.594 4.356 20 0 HIADHN CCO[C@H]1C[C@H](NC(=O)Nc2ccc(CCN3CCSCC3)cc2)C12CCCC2 ZINC000438078132 863471389 /nfs/dbraw/zinc/47/13/89/863471389.db2.gz HMWONJKYWUAXKL-SFTDATJTSA-N 0 3 417.619 4.137 20 0 HIADHN COC(=O)c1ccc(COc2ccccc2CN2CCC(OCC3CC3)CC2)cc1 ZINC000438117724 863536558 /nfs/dbraw/zinc/53/65/58/863536558.db2.gz GACLYNGPRMWGGK-UHFFFAOYSA-N 0 3 409.526 4.443 20 0 HIADHN CCOc1ccc(NC(=O)CN2CCN([C@@H]3CC[C@](C)(c4ccccc4)C3)CC2)cc1 ZINC000438122874 863542429 /nfs/dbraw/zinc/54/24/29/863542429.db2.gz ROVGACZRLJKHSL-BVAGGSTKSA-N 0 3 421.585 4.152 20 0 HIADHN C[C@@H](NCc1cccc(NC(=O)[C@H]2CCCO2)c1)c1cccc(Br)c1 ZINC000467839674 881676475 /nfs/dbraw/zinc/67/64/75/881676475.db2.gz DYHUQTNEZPRDLF-AUUYWEPGSA-N 0 3 403.320 4.417 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)Nc2ccc(OCC3CCCCC3)cc2)CC1 ZINC000438186455 863611833 /nfs/dbraw/zinc/61/18/33/863611833.db2.gz FJKAOAHFTSXGHL-HXUWFJFHSA-N 0 3 416.610 4.041 20 0 HIADHN C[C@@H](NCc1cccc(OCCN2CCOCC2)c1)c1cccc(Br)c1 ZINC000467843543 881685042 /nfs/dbraw/zinc/68/50/42/881685042.db2.gz IVFSHDGAUMLHHQ-QGZVFWFLSA-N 0 3 419.363 4.011 20 0 HIADHN C[C@H](NC(=O)c1cccc(CN2CCCC2)c1)[C@H](OC1CCOCC1)c1ccccc1 ZINC000438244804 863704817 /nfs/dbraw/zinc/70/48/17/863704817.db2.gz GOGRQXXPGANIFO-CPJSRVTESA-N 0 3 422.569 4.338 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)c1ccc2ccc(Cl)cc2n1 ZINC000438276349 863748127 /nfs/dbraw/zinc/74/81/27/863748127.db2.gz WEIPTZAULTUSSS-HXUWFJFHSA-N 0 3 408.933 4.410 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)N[C@H]1C[C@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000438413215 863854716 /nfs/dbraw/zinc/85/47/16/863854716.db2.gz RTNNIVWBZUUELX-SAABIXHNSA-N 0 3 409.452 4.318 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)N[C@H]2C[C@@H]2c2ccccc2OC(F)F)c1 ZINC000438415893 863855092 /nfs/dbraw/zinc/85/50/92/863855092.db2.gz GZOMJKWYLAXVES-UXHICEINSA-N 0 3 417.500 4.226 20 0 HIADHN COC(=O)C(C)(C)c1ccc(NC(=O)NCC(C)(C)N2CCc3ccccc3C2)cc1 ZINC000438441691 863868598 /nfs/dbraw/zinc/86/85/98/863868598.db2.gz HTHCFHZGEVIZSH-UHFFFAOYSA-N 0 3 423.557 4.096 20 0 HIADHN CC(C)c1cnc(-c2ccc(NC(=O)N(CCN(C)C)C[C@H]3CCCO3)cc2)o1 ZINC000438498184 863918605 /nfs/dbraw/zinc/91/86/05/863918605.db2.gz XWSPNJFIFXOAGB-LJQANCHMSA-N 0 3 400.523 4.040 20 0 HIADHN Cc1cc(NC(=O)N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)ccc1C(F)(F)F ZINC000438527180 863951281 /nfs/dbraw/zinc/95/12/81/863951281.db2.gz CARVGPLKJNTZQN-IYBDPMFKSA-N 0 3 413.484 4.367 20 0 HIADHN CC(C)C1CCC(N2CCN(CC(=O)Nc3ccc(OC(F)F)cc3)CC2)CC1 ZINC000438552656 863981834 /nfs/dbraw/zinc/98/18/34/863981834.db2.gz LTDCDXVCGFDKFT-UHFFFAOYSA-N 0 3 409.521 4.059 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)Cc2cccc(Br)c2)CC1 ZINC000438552813 863983921 /nfs/dbraw/zinc/98/39/21/863983921.db2.gz JHYLAADYBQTBSQ-UHFFFAOYSA-N 0 3 401.348 4.115 20 0 HIADHN CC[C@H](C)n1ncc2c1nc(C)cc2C(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000438557935 863989257 /nfs/dbraw/zinc/98/92/57/863989257.db2.gz GDPXJAKPMLUQMY-IBGZPJMESA-N 0 3 419.573 4.447 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)COc2c(Cl)cccc2Cl)CC1 ZINC000438558832 863991908 /nfs/dbraw/zinc/99/19/08/863991908.db2.gz UIMDGAMFDCNLFT-UHFFFAOYSA-N 0 3 407.341 4.495 20 0 HIADHN CN(C)Cc1cccc(C(=O)N(C)[C@@H]2CCOc3ccc(Br)cc32)c1 ZINC000438629754 864058570 /nfs/dbraw/zinc/05/85/70/864058570.db2.gz VXCJUXPASUFASN-GOSISDBHSA-N 0 3 403.320 4.107 20 0 HIADHN CN(C)[C@H](CNC(=O)Nc1c(F)cc(Br)cc1F)Cc1ccccc1 ZINC000438642652 864078835 /nfs/dbraw/zinc/07/88/35/864078835.db2.gz RCHRQRGLORXNDY-AWEZNQCLSA-N 0 3 412.278 4.022 20 0 HIADHN CCn1cnnc1-c1ccccc1NC(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000438657694 864101748 /nfs/dbraw/zinc/10/17/48/864101748.db2.gz SVXKSBYXTKEHGJ-UHFFFAOYSA-N 0 3 418.545 4.093 20 0 HIADHN CCN(C(=O)C(=O)Nc1ccc2[nH]c(C)cc2c1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000438663571 864113808 /nfs/dbraw/zinc/11/38/08/864113808.db2.gz DOMHVTMXBFUIDM-AVRDEDQJSA-N 0 3 418.541 4.099 20 0 HIADHN CCN(C(=O)C(=O)Nc1cc2[nH]ccc2cc1C)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000438666639 864121294 /nfs/dbraw/zinc/12/12/94/864121294.db2.gz VIFULAGCGPKDHH-RXVVDRJESA-N 0 3 418.541 4.099 20 0 HIADHN Cc1ccnc(Oc2cc(NC(=O)N(CCN(C)C)C[C@H]3CCCO3)ccc2C)c1 ZINC000438669789 864129749 /nfs/dbraw/zinc/12/97/49/864129749.db2.gz BEJVCAWZFADMSQ-HXUWFJFHSA-N 0 3 412.534 4.065 20 0 HIADHN CCN(Cc1ccccc1NC(=O)N(Cc1ccccc1)C1CCN(C)CC1)C(C)=O ZINC000438697595 864168176 /nfs/dbraw/zinc/16/81/76/864168176.db2.gz QCAJBFYUOQXYSQ-UHFFFAOYSA-N 0 3 422.573 4.183 20 0 HIADHN CCC[C@@H](N[C@@H](C)c1ccc(OC)c(OC)c1)C(=O)N1CCc2sccc2C1 ZINC000467876334 881737582 /nfs/dbraw/zinc/73/75/82/881737582.db2.gz GGECUXSAXFOQLC-MAUKXSAKSA-N 0 3 402.560 4.170 20 0 HIADHN C[C@@H]1CCC[C@H](OCc2cccc(NC(=O)C(=O)Nc3cccc(CN(C)C)c3)c2)C1 ZINC000438713199 864193991 /nfs/dbraw/zinc/19/39/91/864193991.db2.gz GCKPXJLUNAQPKE-JPYJTQIMSA-N 0 3 423.557 4.421 20 0 HIADHN Cc1cccc(C(NC(=O)C(=O)Nc2cccc(CN(C)C)c2)c2cccc(C)c2)c1 ZINC000438750590 864240362 /nfs/dbraw/zinc/24/03/62/864240362.db2.gz GZOKVJPELYIQAI-UHFFFAOYSA-N 0 3 415.537 4.209 20 0 HIADHN C[C@@H]1CC[C@H](O)[C@H]([C@@H]2CCCCN2Cc2nnc(-c3ccc(Br)o3)o2)C1 ZINC000438993332 864452109 /nfs/dbraw/zinc/45/21/09/864452109.db2.gz JUNZJXYSZGRSRW-QPSCCSFWSA-N 0 3 424.339 4.244 20 0 HIADHN O[C@@H]1CCCC[C@H]1[C@@H]1CCCCN1Cc1nc(-c2cccc(Br)c2)no1 ZINC000439012299 864463779 /nfs/dbraw/zinc/46/37/79/864463779.db2.gz XJNICRJVWGKWMO-OKZBNKHCSA-N 0 3 420.351 4.405 20 0 HIADHN Cc1cc(Br)ccc1NC(=O)CN1CCCC[C@@H]1[C@@H]1C[C@H](C)CC[C@H]1O ZINC000439014795 864466151 /nfs/dbraw/zinc/46/61/51/864466151.db2.gz KITWZNURCUQHSB-IXMYUCAJSA-N 0 3 423.395 4.348 20 0 HIADHN COC(=O)[C@H](NC1CCN([C@@H](C)c2ccncc2)CC1)c1cc(Cl)cc(Cl)c1 ZINC000439044485 864497791 /nfs/dbraw/zinc/49/77/91/864497791.db2.gz APTMKPUYAOYMNL-VBKZILBWSA-N 0 3 422.356 4.418 20 0 HIADHN COC(=O)[C@H](NC1CCN([C@H](C)c2ccncc2)CC1)c1cc(Cl)cc(Cl)c1 ZINC000439044484 864498609 /nfs/dbraw/zinc/49/86/09/864498609.db2.gz APTMKPUYAOYMNL-JLTOFOAXSA-N 0 3 422.356 4.418 20 0 HIADHN CC[C@H](C)[C@H]1CN(Cc2ccc(C)nc2)CCN1C(=O)Nc1cccc(CN(C)C)c1 ZINC000439074687 864527179 /nfs/dbraw/zinc/52/71/79/864527179.db2.gz YQKHTHQCDRNLRY-YADARESESA-N 0 3 423.605 4.216 20 0 HIADHN COC(=O)COc1cccc(CN[C@@H](c2ccc(Br)s2)C2CC2)c1 ZINC000439139328 864572257 /nfs/dbraw/zinc/57/22/57/864572257.db2.gz YFAQEYAIQASMGO-GOSISDBHSA-N 0 3 410.333 4.303 20 0 HIADHN C[C@@H]1CN(c2ccc(CN[C@H](c3ccc(Br)s3)C3CC3)cn2)CCO1 ZINC000439141574 864573589 /nfs/dbraw/zinc/57/35/89/864573589.db2.gz OEOIOPRQVOJOTO-YJYMSZOUSA-N 0 3 422.392 4.372 20 0 HIADHN CCN(C[C@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)c1cccc(Cl)c1C ZINC000439223844 864640878 /nfs/dbraw/zinc/64/08/78/864640878.db2.gz JDZLAOFQVWOOSS-IBGZPJMESA-N 0 3 406.979 4.181 20 0 HIADHN COc1ccc2cc(CN(C)C(=O)[C@H](C)N3CCC([C@H]4CCCO4)CC3)ccc2c1 ZINC000439302734 864728840 /nfs/dbraw/zinc/72/88/40/864728840.db2.gz VOSOJSOQMBZSCJ-MHECFPHRSA-N 0 3 410.558 4.086 20 0 HIADHN Cc1cccc2nc(CN3CCC(c4cccc(Br)c4)CC3)cc(=O)n12 ZINC000439314567 864749533 /nfs/dbraw/zinc/74/95/33/864749533.db2.gz HXHRHABFSLJIDB-UHFFFAOYSA-N 0 3 412.331 4.145 20 0 HIADHN COc1ccc(CNC(=O)N(CCN(C)C)Cc2cccs2)c(C(F)(F)F)c1 ZINC000439361345 864802165 /nfs/dbraw/zinc/80/21/65/864802165.db2.gz ACRXGPYCXGTNPT-UHFFFAOYSA-N 0 3 415.481 4.049 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)NC[C@@H]2CCC[C@@H](C(F)(F)F)C2)CC1 ZINC000439580984 864902418 /nfs/dbraw/zinc/90/24/18/864902418.db2.gz KVMXKVMPPJCUNS-HZPDHXFCSA-N 0 3 401.473 4.254 20 0 HIADHN CN(Cc1ccco1)Cc1ccccc1CN[C@H]1CCN(c2ccccc2Cl)C1=O ZINC000439592502 864915176 /nfs/dbraw/zinc/91/51/76/864915176.db2.gz DVZCHOQHRRSTQL-QFIPXVFZSA-N 0 3 423.944 4.460 20 0 HIADHN C[C@H](NCC1(N2CCSCC2)CCCCC1)c1nc(Cc2ccccc2)no1 ZINC000439593558 864916326 /nfs/dbraw/zinc/91/63/26/864916326.db2.gz WCHMUUOKRHGNLU-SFHVURJKSA-N 0 3 400.592 4.063 20 0 HIADHN C[C@H](NCc1ccccc1CN(C)Cc1ccco1)C(=O)N1c2ccccc2C[C@@H]1C ZINC000439595408 864918816 /nfs/dbraw/zinc/91/88/16/864918816.db2.gz JXLQMAOBGNPIBC-PMACEKPBSA-N 0 3 417.553 4.368 20 0 HIADHN C[C@H](NCc1ccccc1CN(C)Cc1ccco1)C(=O)N1CCc2sccc2C1 ZINC000439600193 864924448 /nfs/dbraw/zinc/92/44/48/864924448.db2.gz YAMRNSDSAPXXTN-SFHVURJKSA-N 0 3 423.582 4.036 20 0 HIADHN CO[C@@H](C)c1nc(CN2CCCN(CCSc3ccc(F)cc3)CC2)cs1 ZINC000439610648 864933019 /nfs/dbraw/zinc/93/30/19/864933019.db2.gz CEHLVBMFYUTUOC-INIZCTEOSA-N 0 3 409.596 4.290 20 0 HIADHN Cc1nc(NC(=O)[C@H](C)NCc2ccccc2CN(C)Cc2ccco2)sc1C ZINC000439612903 864937270 /nfs/dbraw/zinc/93/72/70/864937270.db2.gz ULPSPLMAFULUEQ-INIZCTEOSA-N 0 3 412.559 4.102 20 0 HIADHN Cc1nn(-c2ccc(Cl)c(Cl)c2)c(C)c1CC(=O)N(CCN(C)C)C(C)C ZINC000439617942 864940860 /nfs/dbraw/zinc/94/08/60/864940860.db2.gz AEKRUSYBJNSWTD-UHFFFAOYSA-N 0 3 411.377 4.137 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)NC[C@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000439633705 864958456 /nfs/dbraw/zinc/95/84/56/864958456.db2.gz MEBHGYNZPHHKJK-DLBZAZTESA-N 0 3 403.464 4.268 20 0 HIADHN CC(C)(C)[C@@H](CN1CCc2ccccc2C1)NC(=O)N1CCC([C@@H]2CCCO2)CC1 ZINC000439641819 864968287 /nfs/dbraw/zinc/96/82/87/864968287.db2.gz GVQKBWICPGANEQ-XZOQPEGZSA-N 0 3 413.606 4.060 20 0 HIADHN CC[C@](C)(O)CN(Cc1ccccc1)C(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000439714936 865051789 /nfs/dbraw/zinc/05/17/89/865051789.db2.gz MIEYHASEDDDGEU-REWPJTCUSA-N 0 3 415.603 4.258 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)COc2ccc(Cl)cc2Cl)CC1 ZINC000439735799 865067447 /nfs/dbraw/zinc/06/74/47/865067447.db2.gz XZEQXNJYVXLBNC-AWEZNQCLSA-N 0 3 408.329 4.109 20 0 HIADHN C[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)NC1CCN([C@@H](C)c2ccncc2)CC1 ZINC000439741090 865072525 /nfs/dbraw/zinc/07/25/25/865072525.db2.gz FGMUUARBWMWTFB-OALUTQOASA-N 0 3 409.574 4.488 20 0 HIADHN Cc1cc(C(=O)NC2CCN([C@@H](C)c3ccncc3)CC2)ccc1NC(=O)CC(C)C ZINC000439749701 865079037 /nfs/dbraw/zinc/07/90/37/865079037.db2.gz ZJEXFDNNGCIKNR-IBGZPJMESA-N 0 3 422.573 4.330 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)CSc2nccc3ccccc32)CC1 ZINC000439760467 865086779 /nfs/dbraw/zinc/08/67/79/865086779.db2.gz NSPQQNDEKMBEDA-QGZVFWFLSA-N 0 3 406.555 4.064 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)CSc2nccc3ccccc32)CC1 ZINC000439760466 865087399 /nfs/dbraw/zinc/08/73/99/865087399.db2.gz NSPQQNDEKMBEDA-KRWDZBQOSA-N 0 3 406.555 4.064 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)c2ccc(Oc3cccnc3)cc2)CC1 ZINC000439763642 865088691 /nfs/dbraw/zinc/08/86/91/865088691.db2.gz DIMJTPAZUFLMPE-SFHVURJKSA-N 0 3 402.498 4.224 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)C(C)(C)Oc2ccc(Cl)cc2)CC1 ZINC000439766458 865092630 /nfs/dbraw/zinc/09/26/30/865092630.db2.gz NBZKBYWPRIYZMY-INIZCTEOSA-N 0 3 401.938 4.234 20 0 HIADHN CCN(CC)[C@H](CNC(=O)C(=O)Nc1ccccc1NC(C)(C)C)c1ccccc1 ZINC000439769258 865093494 /nfs/dbraw/zinc/09/34/94/865093494.db2.gz NSMLYHLBRIATMJ-OAQYLSRUSA-N 0 3 410.562 4.035 20 0 HIADHN C[C@@H](Oc1cccc(C(C)(C)C)c1)C(=O)NC1CCN([C@@H](C)c2ccncc2)CC1 ZINC000439768115 865094300 /nfs/dbraw/zinc/09/43/00/865094300.db2.gz LXCSPIWFFUEHEI-RBUKOAKNSA-N 0 3 409.574 4.488 20 0 HIADHN Cc1cc(CCCC(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)c(C)s1 ZINC000439901346 865212297 /nfs/dbraw/zinc/21/22/97/865212297.db2.gz MADJRUZPCABCPP-ROUUACIJSA-N 0 3 406.636 4.426 20 0 HIADHN Cc1ccc(-c2ccnn2C)cc1NC(=O)N[C@@H]1C[C@@H](C)N(Cc2ccccc2)C1 ZINC000439951044 865243408 /nfs/dbraw/zinc/24/34/08/865243408.db2.gz PUZJJQURBWVOFA-WIYYLYMNSA-N 0 3 403.530 4.180 20 0 HIADHN Cc1ccc(-c2ccnn2C)cc1NC(=O)N[C@@H]1C[C@H](C)N(Cc2ccccc2)C1 ZINC000439951041 865243649 /nfs/dbraw/zinc/24/36/49/865243649.db2.gz PUZJJQURBWVOFA-GHTZIAJQSA-N 0 3 403.530 4.180 20 0 HIADHN CSc1cccc(N(C(=O)c2cccc(NC(C)=O)c2C)C2CCN(C)CC2)c1 ZINC000468017378 881853959 /nfs/dbraw/zinc/85/39/59/881853959.db2.gz QYURLKIBRMYUOS-UHFFFAOYSA-N 0 3 411.571 4.416 20 0 HIADHN Cc1ccc(C(=O)NCC2CC2)cc1NC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000440136739 865375496 /nfs/dbraw/zinc/37/54/96/865375496.db2.gz XJVWRKIZVMEETJ-NRFANRHFSA-N 0 3 423.532 4.125 20 0 HIADHN CC(C)C1CCC(N2CCN(C(=O)Nc3ccc4c(c3)NC(=O)CS4)CC2)CC1 ZINC000440252174 865492511 /nfs/dbraw/zinc/49/25/11/865492511.db2.gz FQMGRUWLDRZACM-UHFFFAOYSA-N 0 3 416.591 4.095 20 0 HIADHN COc1ccc(NC(=O)N2CCN(C3CCC(C(C)C)CC3)CC2)cc1NC(C)=O ZINC000440252544 865495514 /nfs/dbraw/zinc/49/55/14/865495514.db2.gz FBZIWYZIRMJVIH-UHFFFAOYSA-N 0 3 416.566 4.018 20 0 HIADHN CC(C)n1cnnc1-c1ccccc1NC(=O)N1CCN(CC2CCCCC2)CC1 ZINC000440277903 865527327 /nfs/dbraw/zinc/52/73/27/865527327.db2.gz CFMLOPDOYASWPP-UHFFFAOYSA-N 0 3 410.566 4.256 20 0 HIADHN CC(C)n1cnnc1-c1ccccc1NC(=O)NC[C@H]1CCCN1Cc1ccccc1 ZINC000440299388 865558572 /nfs/dbraw/zinc/55/85/72/865558572.db2.gz VLBZUVBFZXYGFQ-HXUWFJFHSA-N 0 3 418.545 4.312 20 0 HIADHN Cc1ccc(-c2noc(CCCN(C)Cc3cc(Br)cn3C)n2)cc1F ZINC000468077254 881889736 /nfs/dbraw/zinc/88/97/36/881889736.db2.gz IWLOSQDDANRAJE-UHFFFAOYSA-N 0 3 421.314 4.350 20 0 HIADHN Cc1ccc(-c2nnco2)cc1NC(=O)N1CCN(C2CCC(C(C)C)CC2)CC1 ZINC000440363486 865642942 /nfs/dbraw/zinc/64/29/42/865642942.db2.gz BFNVXIRPNFVRTH-UHFFFAOYSA-N 0 3 411.550 4.409 20 0 HIADHN O=C(NC[C@]1(O)CCN(Cc2ccccc2)C1)c1cc(-c2ccccc2)ccc1Cl ZINC000440527652 865805210 /nfs/dbraw/zinc/80/52/10/865805210.db2.gz ZQOVCLOSEUITTL-RUZDIDTESA-N 0 3 420.940 4.374 20 0 HIADHN CC(C)(Cc1cccc(Cl)c1)C(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000440557372 865817917 /nfs/dbraw/zinc/81/79/17/865817917.db2.gz NWHNTWUKGXBOTN-UHFFFAOYSA-N 0 3 414.977 4.182 20 0 HIADHN Cn1ccnc1C[C@H]1CCCN(CC(=O)N2c3ccccc3CCc3ccccc32)C1 ZINC000440781889 865907422 /nfs/dbraw/zinc/90/74/22/865907422.db2.gz BGDGSHMJLWTPEZ-HXUWFJFHSA-N 0 3 414.553 4.138 20 0 HIADHN FC(F)(F)c1cc(CNCCSCCOc2cccc(Br)c2)[nH]n1 ZINC000440806562 865925789 /nfs/dbraw/zinc/92/57/89/865925789.db2.gz HZHGJCQIPRSLQD-UHFFFAOYSA-N 0 3 424.286 4.093 20 0 HIADHN CC1(C)CN([C@H](CNCc2cc(C(F)(F)F)n[nH]2)c2ccc(Cl)cc2)CCO1 ZINC000440830613 865944987 /nfs/dbraw/zinc/94/49/87/865944987.db2.gz LIMVZTPVIMIYJW-MRXNPFEDSA-N 0 3 416.875 4.024 20 0 HIADHN COc1ccc(NC(=O)C2(NCCSc3ccccc3F)CCCC2)cc1OC ZINC000440898816 865994207 /nfs/dbraw/zinc/99/42/07/865994207.db2.gz YNJYAIHPTGROIZ-UHFFFAOYSA-N 0 3 418.534 4.476 20 0 HIADHN Cc1cc(C)c(NC(=O)CNC(=O)CNC2(c3ccccc3)CCCCC2)c(C)c1 ZINC000440909571 866006228 /nfs/dbraw/zinc/00/62/28/866006228.db2.gz GPGMPEPQNNEERY-UHFFFAOYSA-N 0 3 407.558 4.116 20 0 HIADHN CN1CCN(CCNC(=O)Nc2ccc(Oc3cccc(Cl)c3)cc2)CC1(C)C ZINC000440928834 866025346 /nfs/dbraw/zinc/02/53/46/866025346.db2.gz KPMWAXBMPAFURU-UHFFFAOYSA-N 0 3 416.953 4.280 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)Cc2csc(-c3cccc(C(F)(F)F)c3)n2)CN1C1CC1 ZINC000440932689 866030257 /nfs/dbraw/zinc/03/02/57/866030257.db2.gz NIFJVZONDQCOMP-SWLSCSKDSA-N 0 3 409.477 4.113 20 0 HIADHN C[C@H]1C[C@H](NC(=O)Cc2csc(-c3cccc(C(F)(F)F)c3)n2)CN1C1CC1 ZINC000440932692 866030530 /nfs/dbraw/zinc/03/05/30/866030530.db2.gz NIFJVZONDQCOMP-WFASDCNBSA-N 0 3 409.477 4.113 20 0 HIADHN CSc1ccccc1[C@H](C)NC(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000441008455 866079109 /nfs/dbraw/zinc/07/91/09/866079109.db2.gz YRLHDDSDQOWAEH-KURKYZTESA-N 0 3 405.608 4.000 20 0 HIADHN C[C@H]1[C@@H](c2ccccc2)c2ccccc2CCN1Cc1csc(CC(=O)N(C)C)n1 ZINC000441071133 866160189 /nfs/dbraw/zinc/16/01/89/866160189.db2.gz QDEOTNJNJSZBDD-BVZFJXPGSA-N 0 3 419.594 4.353 20 0 HIADHN COc1ccc2occ(C(=O)Nc3ccnn3[C@@H]3CCN(Cc4ccccc4)C3)c2c1 ZINC000441071247 866163125 /nfs/dbraw/zinc/16/31/25/866163125.db2.gz HNJXUZRJOADYFJ-GOSISDBHSA-N 0 3 416.481 4.337 20 0 HIADHN Cc1ccnc(Oc2ccc(NC(=O)N(CCN(C)C)Cc3ccccc3)cc2)n1 ZINC000441104986 866202593 /nfs/dbraw/zinc/20/25/93/866202593.db2.gz OCGWYFDGYHWPPB-UHFFFAOYSA-N 0 3 405.502 4.173 20 0 HIADHN O=C(CN1CCC[C@H]([C@H]2CCOC2)C1)NCCC(c1ccccc1)c1ccccc1 ZINC000441216825 866289342 /nfs/dbraw/zinc/28/93/42/866289342.db2.gz KTYACRVYCRJZFB-ZEQRLZLVSA-N 0 3 406.570 4.073 20 0 HIADHN CC[C@@H](Cc1ccc(C)cc1)N(CC)C(=O)C(=O)Nc1cc(CN(C)C)ccc1C ZINC000441231038 866306484 /nfs/dbraw/zinc/30/64/84/866306484.db2.gz MKXJFPBRKLVBDA-QFIPXVFZSA-N 0 3 409.574 4.173 20 0 HIADHN CN(C)[C@H](CNC(=O)N1CCC[C@H]1c1nc2ccc(Cl)cc2[nH]1)c1ccsc1 ZINC000441242699 866317333 /nfs/dbraw/zinc/31/73/33/866317333.db2.gz GCFXKLFIYXCFEY-ZWKOTPCHSA-N 0 3 417.966 4.427 20 0 HIADHN O=C(NCCN1CCc2ccccc2C1)N1CCC[C@H]1c1nc2ccc(Cl)cc2[nH]1 ZINC000441270787 866346043 /nfs/dbraw/zinc/34/60/43/866346043.db2.gz VCIBSKOUPRIRBB-NRFANRHFSA-N 0 3 423.948 4.121 20 0 HIADHN C[C@@H](NC(=O)CN1CC[C@@H](COCc2ccccc2)C1)c1ccc2c(c1)CCCC2 ZINC000441319803 866389462 /nfs/dbraw/zinc/38/94/62/866389462.db2.gz AMMREWXUOFDYSA-IFMALSPDSA-N 0 3 406.570 4.281 20 0 HIADHN CC[C@@H](Cc1ccc(C)cc1)N(CC)CC(=O)N1CCc2cc(OC)c(OC)cc2C1 ZINC000441327954 866399042 /nfs/dbraw/zinc/39/90/42/866399042.db2.gz AFZGBGPASYZGTF-QHCPKHFHSA-N 0 3 424.585 4.240 20 0 HIADHN Cc1ccc([C@@H]2CCC[C@@H]2N(C)CC(=O)NC[C@@H]2CCN(c3ccccc3)C2)cc1 ZINC000441339844 866410946 /nfs/dbraw/zinc/41/09/46/866410946.db2.gz IYMIJKYRORAVKE-TUSQITKMSA-N 0 3 405.586 4.206 20 0 HIADHN Cc1ccc([C@@H]2CCC[C@@H]2N(C)Cc2ccc(S(=O)(=O)N3CCCC3)o2)cc1 ZINC000441360048 866429846 /nfs/dbraw/zinc/42/98/46/866429846.db2.gz XKJBXGYYCMZRDD-SFTDATJTSA-N 0 3 402.560 4.141 20 0 HIADHN C[C@@H](C(=O)N(C)Cc1c(F)cccc1Cl)N1CC[C@@H](COCc2ccccc2)C1 ZINC000441383703 866456264 /nfs/dbraw/zinc/45/62/64/866456264.db2.gz WSKPEUGPETYTQX-PKOBYXMFSA-N 0 3 418.940 4.365 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@H](C)N2CCC[C@@H]2c2cccc(N(C)C)c2)cc1F ZINC000441386834 866459539 /nfs/dbraw/zinc/45/95/39/866459539.db2.gz XDAOUAASUTZTCH-HTAPYJJXSA-N 0 3 413.537 4.084 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N(C)[C@H](C)[C@H](C)c1ccc(Cl)cc1 ZINC000441399989 866474080 /nfs/dbraw/zinc/47/40/80/866474080.db2.gz FVWIDHAVCUYNLQ-DLBZAZTESA-N 0 3 415.965 4.299 20 0 HIADHN COc1ccc(NC(=O)[C@H](c2ccccc2)N2CC[C@@H]([C@@H]3CCOC3)C2)cc1Cl ZINC000441643201 866752110 /nfs/dbraw/zinc/75/21/10/866752110.db2.gz BGFSMAWKVGASHV-HMFYCAOWSA-N 0 3 414.933 4.387 20 0 HIADHN C[C@H](NC(=O)N(CCN(C)C)Cc1cccs1)c1cccc(OC(F)(F)F)c1 ZINC000441677726 866801162 /nfs/dbraw/zinc/80/11/62/866801162.db2.gz GZJRRJNDJFPEBF-AWEZNQCLSA-N 0 3 415.481 4.481 20 0 HIADHN C[C@H](NC(=O)C(=O)Nc1ccccc1-c1ccccc1)[C@@H](c1ccccc1)N(C)C ZINC000441696538 866809484 /nfs/dbraw/zinc/80/94/84/866809484.db2.gz YUBNDMNITGRXDO-MBSDFSHPSA-N 0 3 401.510 4.100 20 0 HIADHN C[C@H](NC(=O)C(=O)Nc1ccccc1-c1ccccc1)[C@H](c1ccccc1)N(C)C ZINC000441696536 866809515 /nfs/dbraw/zinc/80/95/15/866809515.db2.gz YUBNDMNITGRXDO-FDDCHVKYSA-N 0 3 401.510 4.100 20 0 HIADHN C[C@@H](NC(=O)C(=O)Nc1ccccc1-c1ccccc1)[C@H](c1ccccc1)N(C)C ZINC000441696540 866809968 /nfs/dbraw/zinc/80/99/68/866809968.db2.gz YUBNDMNITGRXDO-WZONZLPQSA-N 0 3 401.510 4.100 20 0 HIADHN C[C@H](NC(=O)C(=O)Nc1ccc(OC2CCCCC2)cc1)[C@@H](c1ccccc1)N(C)C ZINC000441698057 866810391 /nfs/dbraw/zinc/81/03/91/866810391.db2.gz GEKVYRRBAAXVKE-MBSDFSHPSA-N 0 3 423.557 4.144 20 0 HIADHN CC1CCN([C@H](CNC(=O)N2CCO[C@H](c3ccsc3)C2)c2cccs2)CC1 ZINC000468161043 882029791 /nfs/dbraw/zinc/02/97/91/882029791.db2.gz USBPQNAPZBPSFT-MOPGFXCFSA-N 0 3 419.616 4.366 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CC[C@@H](OC)C[C@H]1C)c1ccc(C(F)(F)F)cc1 ZINC000441897532 866960373 /nfs/dbraw/zinc/96/03/73/866960373.db2.gz NNRULULPHMIJTO-ATZDWAIDSA-N 0 3 415.500 4.297 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CC[C@H](OC)C[C@H]1C)c1ccc(C(F)(F)F)cc1 ZINC000441897533 866961393 /nfs/dbraw/zinc/96/13/93/866961393.db2.gz NNRULULPHMIJTO-AYOQOUSVSA-N 0 3 415.500 4.297 20 0 HIADHN Cc1nn(C(C)(C)C)cc1[C@@H](C)NC(=O)N(CCCc1ccccc1)CCN(C)C ZINC000468171859 882051320 /nfs/dbraw/zinc/05/13/20/882051320.db2.gz YYQOXOXJLXOIJT-LJQANCHMSA-N 0 3 413.610 4.214 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N[C@H](CC(C)C)c3nc4ccccc4[nH]3)cc2)CC1 ZINC000468178765 882055787 /nfs/dbraw/zinc/05/57/87/882055787.db2.gz PJIOVZLMOHLQPX-HSZRJFAPSA-N 0 3 419.573 4.222 20 0 HIADHN CCN(C(=O)c1cc2cnn(CC)c2nc1C)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000442306758 867317444 /nfs/dbraw/zinc/31/74/44/867317444.db2.gz QNFPJLSGNYAUBC-RXVVDRJESA-N 0 3 405.546 4.057 20 0 HIADHN CN(C)Cc1cccc(NC(=O)C(=O)N2CCCCC[C@H]2/C=C/c2cccs2)c1 ZINC000442490741 867474162 /nfs/dbraw/zinc/47/41/62/867474162.db2.gz ITHRCJNDZGHOEO-SJFMBGHLSA-N 0 3 411.571 4.233 20 0 HIADHN CSc1ccccc1[C@H](C)NC(=O)N(C)C1CCN(CCc2ccccn2)CC1 ZINC000442603174 867555026 /nfs/dbraw/zinc/55/50/26/867555026.db2.gz WVESIYLLLRWJFQ-SFHVURJKSA-N 0 3 412.603 4.213 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)N[C@@H](C)c2ccccc2SC)c1 ZINC000442604082 867555197 /nfs/dbraw/zinc/55/51/97/867555197.db2.gz YMRGEIJCWGPDSG-KRWDZBQOSA-N 0 3 401.576 4.252 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)c3ncccc3Oc3ccccc3)CC2)C[C@H](C)O1 ZINC000442692249 867626196 /nfs/dbraw/zinc/62/61/96/867626196.db2.gz NMRCWROHIMKGPR-PMACEKPBSA-N 0 3 423.557 4.225 20 0 HIADHN COCCC[C@H](NCc1ccc(S(=O)(=O)N(C)C(C)C)cc1)c1ccc(F)cc1 ZINC000442792518 867678055 /nfs/dbraw/zinc/67/80/55/867678055.db2.gz MNJRXZUTEVBZPL-QFIPXVFZSA-N 0 3 422.566 4.112 20 0 HIADHN Cc1c2cc(Cl)ccc2sc1CNC(=O)C(=O)Nc1cccc(CN(C)C)c1 ZINC000443313704 867898855 /nfs/dbraw/zinc/89/88/55/867898855.db2.gz XRDKZZIPBZLEPX-UHFFFAOYSA-N 0 3 415.946 4.180 20 0 HIADHN CCSCc1ccccc1C(=O)NCc1ccccc1CN1CCN(CC)CC1 ZINC000468237277 882132629 /nfs/dbraw/zinc/13/26/29/882132629.db2.gz FRAMMKZONFWUQD-UHFFFAOYSA-N 0 3 411.615 4.007 20 0 HIADHN C[C@@H](CSc1ccccc1)C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000443331019 867907793 /nfs/dbraw/zinc/90/77/93/867907793.db2.gz KUXFAOJYBKBMLL-SFHVURJKSA-N 0 3 416.562 4.214 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(F)cc2)CC1)[C@H]1C[C@]12CCCc1ccccc12 ZINC000443341792 867914944 /nfs/dbraw/zinc/91/49/44/867914944.db2.gz JHEVLONZWQFHBO-RSXGOPAZSA-N 0 3 422.544 4.079 20 0 HIADHN C[C@@H](C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1)c1cc2ccccc2o1 ZINC000443343824 867916130 /nfs/dbraw/zinc/91/61/30/867916130.db2.gz GYIBYEIOMPAOAG-QGZVFWFLSA-N 0 3 410.489 4.335 20 0 HIADHN CC[C@]1(C)Oc2ccc(NC(=O)N(C)C3CCN(CCc4ccccn4)CC3)cc2O1 ZINC000443373088 867935848 /nfs/dbraw/zinc/93/58/48/867935848.db2.gz CDOAUVSVPFCPIH-XMMPIXPASA-N 0 3 424.545 4.150 20 0 HIADHN COc1ccc(CN(C)C[C@H](O)Cc2ccccc2C(F)(F)F)cc1OC(F)F ZINC000443453691 868042121 /nfs/dbraw/zinc/04/21/21/868042121.db2.gz IOGKFFIXPJTJPX-OAHLLOKOSA-N 0 3 419.390 4.351 20 0 HIADHN CN(C(=O)Nc1cc(F)cc(F)c1Br)[C@H]1CCN(Cc2ccccc2)C1 ZINC000443531159 868088736 /nfs/dbraw/zinc/08/87/36/868088736.db2.gz KBQFIKHCSZBWNC-HNNXBMFYSA-N 0 3 424.289 4.466 20 0 HIADHN O=C(Nc1cc(F)cc(F)c1Br)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000443533316 868092886 /nfs/dbraw/zinc/09/28/86/868092886.db2.gz PPFPQVXBIIOYKR-AWEZNQCLSA-N 0 3 410.262 4.123 20 0 HIADHN Cc1cc(NC(=O)Nc2ccc(O)c(C)c2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000443596602 868151091 /nfs/dbraw/zinc/15/10/91/868151091.db2.gz WYYVOTVKUIDERP-FQEVSTJZSA-N 0 3 405.502 4.297 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)CCCOc2cccc(Cl)c2Cl)C[C@H](C)O1 ZINC000443672603 868279574 /nfs/dbraw/zinc/27/95/74/868279574.db2.gz FXYCRUUEYDEZOR-IYBDPMFKSA-N 0 3 417.377 4.158 20 0 HIADHN COc1cc(NC2CCN(C(=O)c3cccc(CN4CCCC4)c3)CC2)cc(OC)c1 ZINC000443800527 868338795 /nfs/dbraw/zinc/33/87/95/868338795.db2.gz SJWFSHVILYAAKN-UHFFFAOYSA-N 0 3 423.557 4.016 20 0 HIADHN CCOC(=O)c1c(NC(=O)CC[C@H]2CC[C@H](C)O2)sc2c1CC(C)(C)NC2(C)C ZINC000443810525 868344948 /nfs/dbraw/zinc/34/49/48/868344948.db2.gz AVTUQJQJXKQZIF-UONOGXRCSA-N 0 3 422.591 4.370 20 0 HIADHN Cc1ccccc1[C@H]([C@@H](C)NC(=O)C(=O)Nc1cccc(OC2CCCC2)c1)N(C)C ZINC000443841227 868370590 /nfs/dbraw/zinc/37/05/90/868370590.db2.gz ZIAGSRGKYUFJQR-JPYJTQIMSA-N 0 3 423.557 4.063 20 0 HIADHN COC(=O)c1c(CN2CCC[C@@H]2C[C@H](C)O)nc2ccccc2c1-c1ccccc1 ZINC000443873213 868404251 /nfs/dbraw/zinc/40/42/51/868404251.db2.gz GBAJGVIXHBLMCW-PKOBYXMFSA-N 0 3 404.510 4.424 20 0 HIADHN COc1ccc(CNC[C@H](c2ccco2)N2CCCC2)c(OCc2cccnc2)c1 ZINC000443976451 868505076 /nfs/dbraw/zinc/50/50/76/868505076.db2.gz ADKWHMDDJCFDEJ-JOCHJYFZSA-N 0 3 407.514 4.189 20 0 HIADHN COc1ccc(C2(NCc3cc(Cl)c4c(c3)OCCO4)CCOCC2)cc1F ZINC000444005222 868527873 /nfs/dbraw/zinc/52/78/73/868527873.db2.gz PPQHMBIRSGPGOC-UHFFFAOYSA-N 0 3 407.869 4.054 20 0 HIADHN Cc1cc(NC(=O)c2noc3c2CCCCC3)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000444237491 868685973 /nfs/dbraw/zinc/68/59/73/868685973.db2.gz KWICQKPDYKHAHU-LJQANCHMSA-N 0 3 419.529 4.148 20 0 HIADHN COc1cc(NC(=O)CN(C)[C@H]2CCC[C@H]2c2ccc(C)cc2)cc(OC)c1OC ZINC000444237730 868687342 /nfs/dbraw/zinc/68/73/42/868687342.db2.gz JCDSFVLOTIOWOM-PMACEKPBSA-N 0 3 412.530 4.227 20 0 HIADHN Cc1ccc([C@H]2CCC[C@@H]2N(C)CC(=O)Nc2cccc(C(=O)NC3CC3)c2)cc1 ZINC000444240908 868689164 /nfs/dbraw/zinc/68/91/64/868689164.db2.gz MRHCDYLJVCYKSZ-PKTZIBPZSA-N 0 3 405.542 4.094 20 0 HIADHN CN(Cc1cccnc1)C[C@H]1CCN(C(=O)C2(c3ccc(C(F)(F)F)cc3)CC2)C1 ZINC000444358241 868785801 /nfs/dbraw/zinc/78/58/01/868785801.db2.gz SHFCENZXEGXPBB-GOSISDBHSA-N 0 3 417.475 4.113 20 0 HIADHN COc1ccc(CN(C)C[C@H](O)CO[C@H](c2ccccc2)c2ccccc2C)cc1O ZINC000444404384 868813695 /nfs/dbraw/zinc/81/36/95/868813695.db2.gz SOHQAGXMQAMHAY-BKMJKUGQSA-N 0 3 421.537 4.308 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)c1cc(Cl)ccc1Br ZINC000444448326 868831775 /nfs/dbraw/zinc/83/17/75/868831775.db2.gz BZWLGQKLANLXRD-UHFFFAOYSA-N 0 3 423.738 4.312 20 0 HIADHN COc1cc(C2(C(=O)Nc3cccc(CN4CCC(O)CC4)c3)CCCC2)ccc1C ZINC000444454058 868833910 /nfs/dbraw/zinc/83/39/10/868833910.db2.gz LXUMWZUXAVJXKK-UHFFFAOYSA-N 0 3 422.569 4.411 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)c1cc(-c2ccc(Cl)cc2)on1 ZINC000444457326 868834579 /nfs/dbraw/zinc/83/45/79/868834579.db2.gz YEVDAXZNDIGECH-UHFFFAOYSA-N 0 3 411.889 4.204 20 0 HIADHN CC[C@@H](Oc1ccccc1Cl)C(=O)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000444454950 868834908 /nfs/dbraw/zinc/83/49/08/868834908.db2.gz QMTGXVPIZOKOMW-HXUWFJFHSA-N 0 3 402.922 4.093 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)[C@H]1C[C@@H]1c1c(F)cccc1Cl ZINC000444462757 868837888 /nfs/dbraw/zinc/83/78/88/868837888.db2.gz VVAXCTUBWRAFTM-ROUUACIJSA-N 0 3 402.897 4.178 20 0 HIADHN Cc1nc(-c2ccco2)ccc1C(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000444539833 868873710 /nfs/dbraw/zinc/87/37/10/868873710.db2.gz ALWJAJXOAUHRKD-UHFFFAOYSA-N 0 3 405.498 4.107 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1ccc(F)cc1Br ZINC000444554570 868880618 /nfs/dbraw/zinc/88/06/18/868880618.db2.gz RUJJPPZFMHMLCM-UHFFFAOYSA-N 0 3 421.310 4.045 20 0 HIADHN O=C(CCSc1ccccc1F)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000444559850 868882030 /nfs/dbraw/zinc/88/20/30/868882030.db2.gz YQPAOOKNHQVBTM-UHFFFAOYSA-N 0 3 402.535 4.151 20 0 HIADHN CCOC(=O)c1c(C)oc2nc(CN[C@@H](CC)C(C)(C)c3ccccc3)nc(N)c21 ZINC000444606631 868902098 /nfs/dbraw/zinc/90/20/98/868902098.db2.gz FKCYIBZUGHADCY-INIZCTEOSA-N 0 3 410.518 4.136 20 0 HIADHN CCO[C@@H](CNC(=O)Nc1ccc(N2CCN(CC)CC2)cc1C)c1ccccc1 ZINC000444841657 869046653 /nfs/dbraw/zinc/04/66/53/869046653.db2.gz WLYIFORMYLMYQL-QHCPKHFHSA-N 0 3 410.562 4.036 20 0 HIADHN CC1CCN([C@H](CNC(=O)Nc2ccc(OC3COC3)cc2)c2cccs2)CC1 ZINC000445024181 869173688 /nfs/dbraw/zinc/17/36/88/869173688.db2.gz VHGAWNZEIZLYID-HXUWFJFHSA-N 0 3 415.559 4.120 20 0 HIADHN Cc1ccc([C@@H](Cn2ccnc2)NC(=O)N(C)Cc2cc(C(C)(C)C)[nH]n2)c(C)c1 ZINC000445219970 869282740 /nfs/dbraw/zinc/28/27/40/869282740.db2.gz GVCBRPZJVGUROU-HXUWFJFHSA-N 0 3 408.550 4.103 20 0 HIADHN CCc1ccc(NC(=O)Cc2noc(C3CCN(Cc4ccccc4)CC3)n2)cc1 ZINC000445321785 869379314 /nfs/dbraw/zinc/37/93/14/869379314.db2.gz OXUGYTDLPDLQBC-UHFFFAOYSA-N 0 3 404.514 4.193 20 0 HIADHN COc1ccc([C@@H](CNC(=O)N[C@@H](CC(F)(F)F)C(C)C)N2CCCC2)cc1 ZINC000445547058 869605302 /nfs/dbraw/zinc/60/53/02/869605302.db2.gz FLVYCERMYBWZNL-ZWKOTPCHSA-N 0 3 401.473 4.108 20 0 HIADHN COc1ccc([C@H](CNC(=O)N[C@@H](CC(F)(F)F)C(C)C)N2CCCC2)cc1 ZINC000445547056 869605412 /nfs/dbraw/zinc/60/54/12/869605412.db2.gz FLVYCERMYBWZNL-ROUUACIJSA-N 0 3 401.473 4.108 20 0 HIADHN FC(F)(F)[C@]1(c2nc(-c3cnc4ccccn34)no2)CCN(Cc2ccccc2)C1 ZINC000445572120 869632002 /nfs/dbraw/zinc/63/20/02/869632002.db2.gz QDWPULIZMJCEMB-HXUWFJFHSA-N 0 3 413.403 4.090 20 0 HIADHN Cc1cccc(CN(Cc2ccco2)C(=O)C(=O)Nc2cc(CN(C)C)ccc2C)c1 ZINC000445634512 869703658 /nfs/dbraw/zinc/70/36/58/869703658.db2.gz JQPJGCGSXBZRQC-UHFFFAOYSA-N 0 3 419.525 4.126 20 0 HIADHN CCN(C(=O)Cc1noc([C@H]2CCCN(Cc3cccc(F)c3)C2)n1)c1ccccc1 ZINC000445673114 869743076 /nfs/dbraw/zinc/74/30/76/869743076.db2.gz DAZICYLHHMELKS-IBGZPJMESA-N 0 3 422.504 4.184 20 0 HIADHN O=C(CCC(=O)N1CCC[C@H]1CN1CCCCC1)c1cc(Cl)sc1Cl ZINC000445789045 869825003 /nfs/dbraw/zinc/82/50/03/869825003.db2.gz DRCHUMHRHFJYRS-ZDUSSCGKSA-N 0 3 403.375 4.495 20 0 HIADHN c1ncn(Cc2ccccc2)c1CN(CCCOc1ccccc1)C1CCOCC1 ZINC000445792694 869827037 /nfs/dbraw/zinc/82/70/37/869827037.db2.gz ZBIXPPXFMUGCHU-UHFFFAOYSA-N 0 3 405.542 4.382 20 0 HIADHN CC(C)n1cnnc1[C@H]1CCCN(CCOc2cc(F)cc(Br)c2)C1 ZINC000445804734 869832199 /nfs/dbraw/zinc/83/21/99/869832199.db2.gz CIDFYMHJOMIPTQ-AWEZNQCLSA-N 0 3 411.319 4.019 20 0 HIADHN O=C(c1c(F)cc(Br)cc1F)N1C[C@@H]2CCCN2Cc2ccccc21 ZINC000445812082 869835605 /nfs/dbraw/zinc/83/56/05/869835605.db2.gz UENOHWFRYWLHJF-AWEZNQCLSA-N 0 3 407.258 4.352 20 0 HIADHN CN(CCC(=O)N(C)c1ccccc1)[C@H]1CCOc2ccc(Br)cc21 ZINC000445885238 869872626 /nfs/dbraw/zinc/87/26/26/869872626.db2.gz MQBJAMSOWUICHL-SFHVURJKSA-N 0 3 403.320 4.258 20 0 HIADHN COc1cc(C)ccc1Oc1ccc(N2C(=O)NC(CC(F)(F)F)C2=O)cc1F ZINC000445950178 869914644 /nfs/dbraw/zinc/91/46/44/869914644.db2.gz UXMKWNJLWQMSQE-ZDUSSCGKSA-N 0 3 412.339 4.312 20 0 HIADHN COc1cc(-c2nnc(CN[C@H]3CCC[C@@H]3c3ccccc3)o2)cc(OC)c1OC ZINC000446002486 869965935 /nfs/dbraw/zinc/96/59/35/869965935.db2.gz FYDGMZWCLDLXHC-MSOLQXFVSA-N 0 3 409.486 4.188 20 0 HIADHN CN(C(=O)c1c[nH]nc1-c1ccccc1Cl)C1CCN(Cc2ccccc2)CC1 ZINC000446101318 870050017 /nfs/dbraw/zinc/05/00/17/870050017.db2.gz TUFKXYCGOKXCBF-UHFFFAOYSA-N 0 3 408.933 4.467 20 0 HIADHN CCC[C@@]1(COC)CCCN1C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000446114729 870060993 /nfs/dbraw/zinc/06/09/93/870060993.db2.gz VNRIKSJSWIPGBU-QFIPXVFZSA-N 0 3 405.608 4.091 20 0 HIADHN O=C(NC[C@H]1CCCN(Cc2cccs2)C1)c1cnc(Cc2ccccc2)s1 ZINC000446141090 870084646 /nfs/dbraw/zinc/08/46/46/870084646.db2.gz XFNHIAGLSYKYFV-GOSISDBHSA-N 0 3 411.596 4.437 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)C2(c3c(Cl)cccc3Cl)CCC2)C[C@@H](C)O1 ZINC000446245798 870188236 /nfs/dbraw/zinc/18/82/36/870188236.db2.gz SSSRBRLVTFVMHH-HZPDHXFCSA-N 0 3 413.389 4.421 20 0 HIADHN CC(=O)c1ccc(C(=O)Nc2cccc(N3CCN(CCc4ccccc4)CC3)c2)o1 ZINC000446296098 870224166 /nfs/dbraw/zinc/22/41/66/870224166.db2.gz FYZGAJGDCSKZKF-UHFFFAOYSA-N 0 3 417.509 4.099 20 0 HIADHN CC(C)Cn1ccc2c1cccc2C(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000446310285 870234545 /nfs/dbraw/zinc/23/45/45/870234545.db2.gz CKUXAVODZPTIDS-UHFFFAOYSA-N 0 3 419.569 4.184 20 0 HIADHN Cc1sc(C(=O)NCCCCN2C[C@@H](C)O[C@@H](C)C2)cc1-c1ccc(F)cc1 ZINC000446384586 870291172 /nfs/dbraw/zinc/29/11/72/870291172.db2.gz APBZZMFVTSHOAH-IYBDPMFKSA-N 0 3 404.551 4.482 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)CCc1nc2ccccc2n1-c1ccccc1 ZINC000446425359 870339795 /nfs/dbraw/zinc/33/97/95/870339795.db2.gz RHZIQNSSZMSACJ-UHFFFAOYSA-N 0 3 416.525 4.142 20 0 HIADHN CN(C)Cc1cccc(C(=O)NC2(c3cccc(C(F)(F)F)c3)CCOCC2)c1 ZINC000446497022 870412599 /nfs/dbraw/zinc/41/25/99/870412599.db2.gz FWWBRSLXPMONIE-UHFFFAOYSA-N 0 3 406.448 4.203 20 0 HIADHN C[C@@H]1CN(c2cccc3cnccc32)CCN1C(=O)c1cccc(CN2CCCC2)c1 ZINC000446603842 870508769 /nfs/dbraw/zinc/50/87/69/870508769.db2.gz GJWYTHAJCKIIBE-HXUWFJFHSA-N 0 3 414.553 4.182 20 0 HIADHN COc1ccc2c(c1)[C@@H](N[C@@H](C)c1ccc(OCCO)c(OC)c1)CCCS2 ZINC000446742744 870649890 /nfs/dbraw/zinc/64/98/90/870649890.db2.gz BVJPNPQOGDJIMV-KXBFYZLASA-N 0 3 403.544 4.353 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)cc1CN[C@@H](CCn1cncn1)c1ccc(C)cc1 ZINC000446753022 870663727 /nfs/dbraw/zinc/66/37/27/870663727.db2.gz JMOXGEQURQVKHY-QHCPKHFHSA-N 0 3 404.493 4.141 20 0 HIADHN CN(C[C@@H](O)COC1CCOCC1)[C@@H](c1ccc(F)cc1)c1ccc(Cl)cc1 ZINC000446777374 870692319 /nfs/dbraw/zinc/69/23/19/870692319.db2.gz OMLNYHRLWVQHSO-IFMALSPDSA-N 0 3 407.913 4.057 20 0 HIADHN Cc1ccc([C@H](CCn2cncn2)NCc2ccc(Br)c(F)c2)cc1 ZINC000446841927 870759919 /nfs/dbraw/zinc/75/99/19/870759919.db2.gz CANUNEJASNLPRS-IBGZPJMESA-N 0 3 403.299 4.409 20 0 HIADHN CC(C)OC(=O)c1ccc(Cl)c(NC(=O)N(CCN(C)C)Cc2ccco2)c1 ZINC000446920800 870836481 /nfs/dbraw/zinc/83/64/81/870836481.db2.gz OOMCKGUKZOGYCN-UHFFFAOYSA-N 0 3 407.898 4.094 20 0 HIADHN COc1ccc([C@H](CCn2cncn2)N[C@H]2CC(C)(C)Oc3cc(F)ccc32)cc1 ZINC000446924196 870837639 /nfs/dbraw/zinc/83/76/39/870837639.db2.gz DJFZNJYAKSJRGH-SFTDATJTSA-N 0 3 410.493 4.449 20 0 HIADHN COC(=O)[C@@](C)(CN[C@H](C)C(=O)Nc1c(C)cc(C)cc1Cl)c1ccc(F)cc1 ZINC000447033039 870908648 /nfs/dbraw/zinc/90/86/48/870908648.db2.gz CVBUEXDMXBZMPW-QRQCRPRQSA-N 0 3 420.912 4.143 20 0 HIADHN COCCO[C@H]1C[C@H](CO)CN(Cc2ccc(-c3ccc(C(C)(C)C)cc3)o2)C1 ZINC000447076012 870958509 /nfs/dbraw/zinc/95/85/09/870958509.db2.gz IITTZBBKXWIXQW-AVRDEDQJSA-N 0 3 401.547 4.090 20 0 HIADHN CS(=O)(=O)c1ccc(CNC/C=C\c2ccc(F)cc2F)cc1C(F)(F)F ZINC000447093628 870988778 /nfs/dbraw/zinc/98/87/78/870988778.db2.gz LHCQVASLUGBQQC-IHWYPQMZSA-N 0 3 405.388 4.190 20 0 HIADHN CS(=O)(=O)c1ccc(OCCCN[C@@H](c2ccccc2)c2cccc(F)c2)cc1 ZINC000447339531 871235250 /nfs/dbraw/zinc/23/52/50/871235250.db2.gz GOGITVPYDCWJLR-QHCPKHFHSA-N 0 3 413.514 4.377 20 0 HIADHN COc1ccccc1-c1csc([C@H]2CCCN(CCn3c(C)csc3=O)C2)n1 ZINC000447385880 871293617 /nfs/dbraw/zinc/29/36/17/871293617.db2.gz PLECZUUBGHGYCY-INIZCTEOSA-N 0 3 415.584 4.230 20 0 HIADHN C[C@@H](C(=O)Nc1ccc(-c2c[nH]cn2)cc1)N1CC[C@H](C)N(Cc2ccccc2)CC1 ZINC000468501613 882495908 /nfs/dbraw/zinc/49/59/08/882495908.db2.gz QZJJUTBVGADCAB-PMACEKPBSA-N 0 3 417.557 4.000 20 0 HIADHN Cc1ccc(C[C@@H](NC(=O)N(CCN(C)C)Cc2ccco2)c2ccccn2)cc1 ZINC000447415258 871320849 /nfs/dbraw/zinc/32/08/49/871320849.db2.gz ZMSYTMQEWWENHC-HSZRJFAPSA-N 0 3 406.530 4.040 20 0 HIADHN CC(C)NS(=O)(=O)Cc1ccccc1CN[C@@H]1C[C@@H](C(C)C)c2ccccc21 ZINC000447538177 871404031 /nfs/dbraw/zinc/40/40/31/871404031.db2.gz AXCHIDBKPDBXAK-XZOQPEGZSA-N 0 3 400.588 4.489 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)Cc2nc(C(C)C)c(C)s2)cc1 ZINC000447549300 871424367 /nfs/dbraw/zinc/42/43/67/871424367.db2.gz JUNAVEMDGIRLDG-LJQANCHMSA-N 0 3 401.576 4.079 20 0 HIADHN Cn1nccc1N1CCC[C@@H](N[C@H](c2ccc(F)cc2)c2cnc3ccccc3c2)C1 ZINC000447578556 871477650 /nfs/dbraw/zinc/47/76/50/871477650.db2.gz LBPJJULAFQOKDJ-RCZVLFRGSA-N 0 3 415.516 4.455 20 0 HIADHN Fc1cccc([C@H](NCC2(N3CCOCC3)CC2)c2cccc(Br)c2)c1 ZINC000447599057 871502749 /nfs/dbraw/zinc/50/27/49/871502749.db2.gz IWZCNMMQZLVOCH-HXUWFJFHSA-N 0 3 419.338 4.132 20 0 HIADHN FC(F)C(F)(F)COCCN[C@H]1CCCOc2cc(Br)ccc21 ZINC000447604918 871512225 /nfs/dbraw/zinc/51/22/25/871512225.db2.gz DYKWHSBGDRZNPD-LBPRGKRZSA-N 0 3 400.210 4.169 20 0 HIADHN CC1(C)CCN(C(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)CCS1 ZINC000447640000 871558816 /nfs/dbraw/zinc/55/88/16/871558816.db2.gz GPUJYUDXRNPUJC-IBGZPJMESA-N 0 3 400.510 4.185 20 0 HIADHN CN(C)[C@H]1CCOc2c(NC(=O)[C@@H]3CCCCN3Cc3ccc(F)cc3)cccc21 ZINC000447721154 871664132 /nfs/dbraw/zinc/66/41/32/871664132.db2.gz FFZUWDUXJVVUAY-VXKWHMMOSA-N 0 3 411.521 4.204 20 0 HIADHN C[C@H](O)C[C@H]1CCCCN1CC(=O)NC[C@@H](c1c[nH]c2ccccc21)c1ccccc1 ZINC000447831081 871758923 /nfs/dbraw/zinc/75/89/23/871758923.db2.gz KGCLCVRPEKVBIE-XKCSPQBFSA-N 0 3 419.569 4.041 20 0 HIADHN C[C@H]1OCC[C@@]12CN(CCC(=O)Nc1ccccc1Oc1ccccc1)C[C@@H](C)O2 ZINC000447844214 871768929 /nfs/dbraw/zinc/76/89/29/871768929.db2.gz LAKQSDXEDUBXJL-KHCICDEESA-N 0 3 410.514 4.076 20 0 HIADHN Brc1cccc(N2CC[C@H](CNCc3nc(-c4ccccc4)c[nH]3)C2)c1 ZINC000447853659 871774059 /nfs/dbraw/zinc/77/40/59/871774059.db2.gz HLYATZQRFRYTLZ-MRXNPFEDSA-N 0 3 411.347 4.455 20 0 HIADHN C[C@@H]1CCC[C@H](C)CN1CC(=O)N(Cc1nnc(-c2ccccc2Cl)o1)C1CC1 ZINC000448023164 871865384 /nfs/dbraw/zinc/86/53/84/871865384.db2.gz RXOMYFOHQIURFB-JKSUJKDBSA-N 0 3 416.953 4.392 20 0 HIADHN CCc1nn(-c2ccccc2)c(CC)c1CN[C@H](C)c1ccc(-n2cncn2)cc1 ZINC000448025661 871866113 /nfs/dbraw/zinc/86/61/13/871866113.db2.gz FBOVMMBGXDYEBS-GOSISDBHSA-N 0 3 400.530 4.429 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1cccc2c1OCC[C@@H]2OC)c1ccsc1 ZINC000448043849 871875575 /nfs/dbraw/zinc/87/55/75/871875575.db2.gz OWRSBZXPEJOBRD-MOPGFXCFSA-N 0 3 403.548 4.423 20 0 HIADHN CO[C@H]1CCOc2c(NC(=O)N(C)[C@@H]3CCCN(Cc4ccccc4)C3)cccc21 ZINC000448051937 871882506 /nfs/dbraw/zinc/88/25/06/871882506.db2.gz UMEBDWRMPZCHAP-KNQAVFIVSA-N 0 3 409.530 4.285 20 0 HIADHN Cc1cc(C[C@H](C)NC(=O)c2oc3ccccc3c2CN(C)C)n(-c2ccccc2)n1 ZINC000448188110 872067507 /nfs/dbraw/zinc/06/75/07/872067507.db2.gz AQUIDTSXWBWZEX-KRWDZBQOSA-N 0 3 416.525 4.350 20 0 HIADHN CN(C)Cc1cccc(C(=O)N2CCC[C@@H](Nc3cccc(Br)c3)C2)c1 ZINC000468557763 882607403 /nfs/dbraw/zinc/60/74/03/882607403.db2.gz ZIICDXGEYJABEQ-HXUWFJFHSA-N 0 3 416.363 4.227 20 0 HIADHN CCN(C(=O)Nc1cccc(C(=O)NC(C)(C)C)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000460132991 872618161 /nfs/dbraw/zinc/61/81/61/872618161.db2.gz IAUNSILKYONLPH-JOCHJYFZSA-N 0 3 422.573 4.343 20 0 HIADHN CN(C(=O)NCC1(N2CCSCC2)CCCC1)[C@H]1CC[C@@H](C(F)(F)F)CC1 ZINC000460134950 872623340 /nfs/dbraw/zinc/62/33/40/872623340.db2.gz STIXYVGGSMRYCB-IYBDPMFKSA-N 0 3 407.546 4.111 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N2CCCC[C@@H]2c2nnc(C3CCC3)o2)N(C)C)cc1 ZINC000460140198 872640462 /nfs/dbraw/zinc/64/04/62/872640462.db2.gz ADUUSYDGXVJJCF-UXHICEINSA-N 0 3 411.550 4.185 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)N1CCCC[C@H]1c1nnc(C2CCC2)o1 ZINC000460165482 872714449 /nfs/dbraw/zinc/71/44/49/872714449.db2.gz CUAVQJODECDYQE-NRFANRHFSA-N 0 3 423.561 4.022 20 0 HIADHN Cc1cc(NC(=O)N2CC[C@H](N3CCN(C)CC3)[C@@H](C)C2)ccc1-c1ccccc1 ZINC000460229584 872816201 /nfs/dbraw/zinc/81/62/01/872816201.db2.gz HSUDGLZFIULYJC-RDPSFJRHSA-N 0 3 406.574 4.152 20 0 HIADHN C[C@@H]1CCC[C@H]1NC(=O)N(Cc1ccccc1Br)C1CCN(C)CC1 ZINC000460270671 872859318 /nfs/dbraw/zinc/85/93/18/872859318.db2.gz OJDSQARRXRNQRA-DNVCBOLYSA-N 0 3 408.384 4.244 20 0 HIADHN CCCN(CCN1CCN(CC)CC1)C(=O)N[C@@H](c1ccc(F)cc1F)C(C)(C)C ZINC000460357855 872982450 /nfs/dbraw/zinc/98/24/50/872982450.db2.gz ABRKTFOPMBXFQJ-NRFANRHFSA-N 0 3 424.580 4.111 20 0 HIADHN CCCN(CCN1CCN(CC)CC1)C(=O)N[C@H](c1ccc(Cl)cc1)[C@H]1C[C@H]1C ZINC000460530591 873223898 /nfs/dbraw/zinc/22/38/98/873223898.db2.gz IGPFDAAIIGMCBC-BVYCBKJFSA-N 0 3 421.029 4.096 20 0 HIADHN CCN1C[C@@H](C)N(c2nnc([C@H]3CCO[C@@H]3c3ccccc3)n2CC(C)C)C[C@H]1C ZINC000460583883 873320508 /nfs/dbraw/zinc/32/05/08/873320508.db2.gz HAJURMLYBVEXGP-KRXUUXHPSA-N 0 3 411.594 4.098 20 0 HIADHN C[C@H]1CN(C(=O)CCCN2CCN(c3ccccc3)CC2)CC[C@H]1c1ccccc1 ZINC000460642179 873383447 /nfs/dbraw/zinc/38/34/47/873383447.db2.gz INIWVXOGPJPTOV-WIOPSUGQSA-N 0 3 405.586 4.241 20 0 HIADHN CCSc1cc(Cl)ccc1C(=O)Nc1ccc2oc(=O)n(CCN(C)C)c2c1 ZINC000460658009 873399980 /nfs/dbraw/zinc/39/99/80/873399980.db2.gz RQGLEFLMKVOZFQ-UHFFFAOYSA-N 0 3 419.934 4.174 20 0 HIADHN C[C@H]1CCCCN1CCNC(=O)c1ccc(Oc2cccc(Cl)c2Cl)nn1 ZINC000460727122 873535435 /nfs/dbraw/zinc/53/54/35/873535435.db2.gz NVIRFGYJDYSFRN-ZDUSSCGKSA-N 0 3 409.317 4.180 20 0 HIADHN C[C@@H](C(=O)NCCCCN1CCN(Cc2ccccc2)CC1)c1cccc(Cl)c1 ZINC000460741453 873567975 /nfs/dbraw/zinc/56/79/75/873567975.db2.gz SGTZZZLIGCILBI-HXUWFJFHSA-N 0 3 413.993 4.158 20 0 HIADHN C[C@@H]1CCC[C@@H]1CNC(=O)N(Cc1ccccc1Br)C1CCN(C)CC1 ZINC000460772356 873622218 /nfs/dbraw/zinc/62/22/18/873622218.db2.gz XWCRFNFBUQAXMT-IAGOWNOFSA-N 0 3 422.411 4.491 20 0 HIADHN CC(C)=CCCNC(=O)N(Cc1ccccc1Br)C1CCN(C)CC1 ZINC000460842068 873731999 /nfs/dbraw/zinc/73/19/99/873731999.db2.gz WPGSEDUPYIRNIZ-UHFFFAOYSA-N 0 3 408.384 4.411 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N1CCCC[C@@H]1c1nnc(C2CCC2)o1 ZINC000460901195 873810055 /nfs/dbraw/zinc/81/00/55/873810055.db2.gz WXUJJILJTGSCHX-DUXKGJEZSA-N 0 3 423.561 4.094 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)c1ccc(OCc2ccccn2)cc1 ZINC000460920071 873825184 /nfs/dbraw/zinc/82/51/84/873825184.db2.gz COWYVBFPPMMGND-UHFFFAOYSA-N 0 3 407.489 4.004 20 0 HIADHN CC(C)c1nc(C(=O)N(CCN(C)C)CC2CCCCC2)nn1-c1ccccc1F ZINC000460962172 873859350 /nfs/dbraw/zinc/85/93/50/873859350.db2.gz JIDWUPYIVKSPFJ-UHFFFAOYSA-N 0 3 415.557 4.114 20 0 HIADHN O=C(c1ccc(Oc2cccc(Cl)c2Cl)nn1)N1CC[C@@H](N2CCCCC2)C1 ZINC000461079117 873984114 /nfs/dbraw/zinc/98/41/14/873984114.db2.gz CSATVBKEIXBCMU-CQSZACIVSA-N 0 3 421.328 4.276 20 0 HIADHN C[C@H](N[C@H]1CCCN(CC(C)(C)C)C1=O)c1ccc(NC(=O)c2ccncc2)cc1 ZINC000461358606 874360759 /nfs/dbraw/zinc/36/07/59/874360759.db2.gz CQAWRPAQKJHEJW-UWJYYQICSA-N 0 3 408.546 4.022 20 0 HIADHN O=C(Nc1ccc2nc([C@@H]3CCCO3)[nH]c2c1)[C@@H]1CCCCN1Cc1ccccc1 ZINC000468706952 882823363 /nfs/dbraw/zinc/82/33/63/882823363.db2.gz NTAXPZCKYUEZSA-VXKWHMMOSA-N 0 3 404.514 4.408 20 0 HIADHN C[C@H](CC(=O)c1ccccc1F)C(=O)N1C[C@H]2CCN(Cc3ccccc3)C[C@H]2C1 ZINC000461438567 874490576 /nfs/dbraw/zinc/49/05/76/874490576.db2.gz MFVDGNJOIFISBH-NRSPTQNISA-N 0 3 408.517 4.015 20 0 HIADHN O=C(CCC(=O)N1C[C@H]2CN(Cc3ccccc3)CC[C@@H]2C1)c1ccc2c(c1)CCC2 ZINC000461439507 874492841 /nfs/dbraw/zinc/49/28/41/874492841.db2.gz RUFCLBAASREBPF-JWQCQUIFSA-N 0 3 416.565 4.119 20 0 HIADHN CCCc1c(C(=O)N2C[C@@H]3CCN(Cc4ccccc4)C[C@@H]3C2)[nH]c(C)c1C(C)=O ZINC000461443855 874498575 /nfs/dbraw/zinc/49/85/75/874498575.db2.gz CAICHQJOYZBBQB-LEWJYISDSA-N 0 3 407.558 4.072 20 0 HIADHN Cc1ccc(C(=O)CCCC(=O)N2C[C@@H]3CCN(Cc4ccccc4)C[C@@H]3C2)cc1 ZINC000461446085 874502825 /nfs/dbraw/zinc/50/28/25/874502825.db2.gz OGMYCVIDDDQVJC-BJKOFHAPSA-N 0 3 404.554 4.329 20 0 HIADHN O=C(C[C@@H]1CCCc2ccccc21)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000461447355 874506049 /nfs/dbraw/zinc/50/60/49/874506049.db2.gz LSOVUHYJGNRDBG-FQEVSTJZSA-N 0 3 410.533 4.295 20 0 HIADHN Cc1nn(C)c(C)c1CCC(=O)N1CCN(Cc2ccccc2)C2(CCCCC2)C1 ZINC000461580766 874687506 /nfs/dbraw/zinc/68/75/06/874687506.db2.gz QMSOKDFOOHKAMX-UHFFFAOYSA-N 0 3 408.590 4.017 20 0 HIADHN CS(=O)(=O)CC1(CNCc2ccc(Oc3cccc(Br)c3)cc2)CC1 ZINC000468775649 882854575 /nfs/dbraw/zinc/85/45/75/882854575.db2.gz BETCBBBMYYGBTN-UHFFFAOYSA-N 0 3 424.360 4.156 20 0 HIADHN CC[C@@H](C(=O)N(CC(=O)Nc1ccccc1C(F)(F)F)C(C)C)N(CC)CC ZINC000461646727 874803417 /nfs/dbraw/zinc/80/34/17/874803417.db2.gz BLFMMQSYQLCQBW-KRWDZBQOSA-N 0 3 401.473 4.001 20 0 HIADHN CCN1CCCN(C(=O)N[C@H]2CCCc3c4cc(Br)ccc4[nH]c32)CC1 ZINC000461719075 874867397 /nfs/dbraw/zinc/86/73/97/874867397.db2.gz ZMXMODQTJBIQLM-SFHVURJKSA-N 0 3 419.367 4.045 20 0 HIADHN CCN1CCCN(C(=O)N[C@@H]2CCCc3c4cc(Br)ccc4[nH]c32)CC1 ZINC000461719074 874867853 /nfs/dbraw/zinc/86/78/53/874867853.db2.gz ZMXMODQTJBIQLM-GOSISDBHSA-N 0 3 419.367 4.045 20 0 HIADHN CN(C)Cc1cccc(C(=O)Nc2cccc(OCC(=O)Nc3ccccc3)c2)c1 ZINC000461892200 875040098 /nfs/dbraw/zinc/04/00/98/875040098.db2.gz ZXZNNYSXCQFPOE-UHFFFAOYSA-N 0 3 403.482 4.018 20 0 HIADHN COCCOCc1ccc(C(=O)NC[C@H](c2ccccc2)N2CCC(C)CC2)cc1 ZINC000461921346 875061780 /nfs/dbraw/zinc/06/17/80/875061780.db2.gz LFJJHFSILTYHKR-XMMPIXPASA-N 0 3 410.558 4.053 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)Nc3ccc(Oc4ccncc4)cc3)CC2)c1 ZINC000461973082 875096496 /nfs/dbraw/zinc/09/64/96/875096496.db2.gz PTNHCPYSFMGMKK-UHFFFAOYSA-N 0 3 416.525 4.333 20 0 HIADHN CCOC(=O)[C@@](C)(CN[C@@H](C)C(=O)Nc1cc(Cl)ccc1C)c1ccccc1 ZINC000468865005 882896347 /nfs/dbraw/zinc/89/63/47/882896347.db2.gz FFAWDPMZICWPJF-AOMKIAJQSA-N 0 3 402.922 4.086 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)NCc3cccc(COC(C)(C)C)c3)CC2)c1 ZINC000462015449 875132552 /nfs/dbraw/zinc/13/25/52/875132552.db2.gz JWXITKVEWUIFQR-UHFFFAOYSA-N 0 3 423.601 4.139 20 0 HIADHN O=C(CCc1nnc(-c2ccc(Cl)cc2)o1)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000462025689 875140933 /nfs/dbraw/zinc/14/09/33/875140933.db2.gz KFJOIIKBUNNDAH-FQEVSTJZSA-N 0 3 424.932 4.276 20 0 HIADHN COc1ccc([C@H](CNC(=O)CN2[C@H](C)CC[C@H]2C)c2c[nH]c3ccccc32)cc1 ZINC000462042501 875155197 /nfs/dbraw/zinc/15/51/97/875155197.db2.gz ZYIBSHHTPBDOFX-HMFYCAOWSA-N 0 3 405.542 4.297 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)Nc3ccc4c(c3)OC3(CCCC3)O4)CC2)c1 ZINC000462050558 875163696 /nfs/dbraw/zinc/16/36/96/875163696.db2.gz RENDCZHKAQLEQR-UHFFFAOYSA-N 0 3 421.541 4.187 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)N[C@@H]1CCc2sc(Cl)cc21 ZINC000462052528 875165718 /nfs/dbraw/zinc/16/57/18/875165718.db2.gz YCIIMAPQODVOPE-MRXNPFEDSA-N 0 3 413.921 4.440 20 0 HIADHN C[C@@H](CC(=O)NCCCCN1CCN(c2ccccc2)CC1)c1c[nH]c2ccccc21 ZINC000468873163 882904892 /nfs/dbraw/zinc/90/48/92/882904892.db2.gz HXJLGTMQTIDKLZ-NRFANRHFSA-N 0 3 418.585 4.380 20 0 HIADHN Cc1nc(C(F)(F)F)sc1C(=O)NC[C@@H]1CCCN(C)[C@H]1c1cccs1 ZINC000462137181 875236341 /nfs/dbraw/zinc/23/63/41/875236341.db2.gz ASHCLLBAFDZIQX-WCQYABFASA-N 0 3 403.495 4.345 20 0 HIADHN Cc1ncsc1CN(C)C[C@@H]1CCN(C(=O)NCc2ccc3sccc3c2)C1 ZINC000462157327 875252796 /nfs/dbraw/zinc/25/27/96/875252796.db2.gz KSOMTKIJGDNTQS-KRWDZBQOSA-N 0 3 414.600 4.330 20 0 HIADHN CC(=O)c1ccc(-c2ccc(C(=O)N[C@@H]3CN(Cc4ccccc4)C[C@@H]3C)o2)cc1 ZINC000462160573 875255464 /nfs/dbraw/zinc/25/54/64/875255464.db2.gz VZUFHHWBXPQDSO-HTAPYJJXSA-N 0 3 402.494 4.400 20 0 HIADHN CC(=O)c1ccc(-c2ccc(C(=O)N[C@@H]3CN(Cc4ccccc4)C[C@H]3C)o2)cc1 ZINC000462160575 875255935 /nfs/dbraw/zinc/25/59/35/875255935.db2.gz VZUFHHWBXPQDSO-VGOFRKELSA-N 0 3 402.494 4.400 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1cccc(C(=O)N(C)CC(C)(C)C)c1 ZINC000462161478 875257385 /nfs/dbraw/zinc/25/73/85/875257385.db2.gz DSFVALFRSUMSTO-XXBNENTESA-N 0 3 421.585 4.055 20 0 HIADHN C[C@H](NC(=O)N1CC[C@@H](CN(C)Cc2cccnc2)C1)c1ccc(C(F)(F)F)cc1 ZINC000462172902 875271088 /nfs/dbraw/zinc/27/10/88/875271088.db2.gz ZIBLNABAVMMRBM-WMZOPIPTSA-N 0 3 420.479 4.325 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)CCc1cc(Br)cs1 ZINC000462180931 875281558 /nfs/dbraw/zinc/28/15/58/875281558.db2.gz WFBOLJJGCNEDSW-KBXCAEBGSA-N 0 3 407.377 4.080 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)NCc1csc(-c2ccccc2)n1 ZINC000462212660 875319662 /nfs/dbraw/zinc/31/96/62/875319662.db2.gz VFIVTNBDPDYLDT-UWJYYQICSA-N 0 3 406.555 4.130 20 0 HIADHN Cc1cc(Oc2ncccn2)ccc1NC(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C ZINC000462250434 875370408 /nfs/dbraw/zinc/37/04/08/875370408.db2.gz ZDWVCLSHVLLVRW-GCJKJVERSA-N 0 3 417.513 4.219 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Nc1cccc(OCc2cscn2)c1 ZINC000462252254 875373068 /nfs/dbraw/zinc/37/30/68/875373068.db2.gz ATJSGUUUKSMMMG-VGOFRKELSA-N 0 3 422.554 4.364 20 0 HIADHN COCCOc1c(Cl)cccc1NC(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C ZINC000462268603 875396114 /nfs/dbraw/zinc/39/61/14/875396114.db2.gz QBQBUGACQSLQPO-OXJNMPFZSA-N 0 3 417.937 4.007 20 0 HIADHN Cc1ccnc(Oc2ccc(NC(=O)N[C@H]3CN(Cc4ccccc4)C[C@@H]3C)cc2)n1 ZINC000462277142 875405173 /nfs/dbraw/zinc/40/51/73/875405173.db2.gz JWAHEWLZBQFHOB-JTSKRJEESA-N 0 3 417.513 4.219 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)NCc1ccc(C(F)F)cc1 ZINC000462301776 875423159 /nfs/dbraw/zinc/42/31/59/875423159.db2.gz LIEAJDDHYICIFV-UHFFFAOYSA-N 0 3 416.516 4.026 20 0 HIADHN Cc1cc(S(=O)(=O)N(C)[C@@H]2CCN(Cc3ccccc3)[C@H](C)C2)cc(C)c1F ZINC000462339479 875453983 /nfs/dbraw/zinc/45/39/83/875453983.db2.gz IAMXRZUQTMZOBX-UYAOXDASSA-N 0 3 404.551 4.116 20 0 HIADHN CCOC(=O)C1CCN(C(=O)[C@@H](C)N[C@@H](C)c2ccc(Cl)c3ccccc32)CC1 ZINC000462358421 875472170 /nfs/dbraw/zinc/47/21/70/875472170.db2.gz OZBMTCPDRQRIPL-JKSUJKDBSA-N 0 3 416.949 4.334 20 0 HIADHN O=S1(=O)CCCN1c1cccc(CN[C@@H](Cc2ccccc2)c2ccccc2)c1 ZINC000462359312 875473601 /nfs/dbraw/zinc/47/36/01/875473601.db2.gz IMUDWXBESNLWSD-DEOSSOPVSA-N 0 3 406.551 4.300 20 0 HIADHN Cc1nc2ccc(Br)cc2c(NC2CCN(C(=O)CC(C)C)CC2)c1C ZINC000462368861 875480733 /nfs/dbraw/zinc/48/07/33/875480733.db2.gz HLMQYIKPDLJINM-UHFFFAOYSA-N 0 3 418.379 4.485 20 0 HIADHN Cc1nc(C(F)(F)F)sc1C(=O)NC[C@H](c1ccc(OC(C)C)cc1)N(C)C ZINC000462466132 875574289 /nfs/dbraw/zinc/57/42/89/875574289.db2.gz NXLXLVQJHGYEBE-OAHLLOKOSA-N 0 3 415.481 4.290 20 0 HIADHN Cc1c(NC(=O)[C@@H](C)N2CC[C@H](C)C3(CCCCC3)C2)c(=O)n(-c2ccccc2)n1C ZINC000462467522 875575196 /nfs/dbraw/zinc/57/51/96/875575196.db2.gz VEYXFNCSBZQJKH-AZUAARDMSA-N 0 3 424.589 4.104 20 0 HIADHN C[C@H](NCC(=O)N(CCC(N)=O)Cc1ccccc1)c1ccc(Cl)c2ccccc21 ZINC000462473398 875580657 /nfs/dbraw/zinc/58/06/57/875580657.db2.gz HPYNNIWMTQHMPL-KRWDZBQOSA-N 0 3 423.944 4.048 20 0 HIADHN OC[C@H](CNCc1sccc1Br)Cc1ccc(C(F)(F)F)cc1 ZINC000462537082 875658465 /nfs/dbraw/zinc/65/84/65/875658465.db2.gz UFTFUSBJOVWJGZ-LBPRGKRZSA-N 0 3 408.283 4.470 20 0 HIADHN CCOC(=O)[C@](C)(CN[C@H](C)C(=O)Nc1cccc(Cl)c1C)c1ccccc1 ZINC000468903506 882956521 /nfs/dbraw/zinc/95/65/21/882956521.db2.gz HRDMVWUBYWYXGT-OPAMFIHVSA-N 0 3 402.922 4.086 20 0 HIADHN CCN1CCN(c2ccc(NCc3cc4c(cc3SC)OCCO4)c(C)c2)CC1 ZINC000462673611 875770471 /nfs/dbraw/zinc/77/04/71/875770471.db2.gz CLURVYVKLJRQMU-UHFFFAOYSA-N 0 3 413.587 4.242 20 0 HIADHN OC[C@H](CNCc1ccccc1Br)Cc1ccccc1OC(F)(F)F ZINC000462736183 875808929 /nfs/dbraw/zinc/80/89/29/875808929.db2.gz DIWVDUXZYXRRNR-ZDUSSCGKSA-N 0 3 418.253 4.289 20 0 HIADHN O=C1C[C@H](NCc2ccc(OC(F)F)c(Cl)c2)CN1[C@@H]1C[C@@H]1c1ccccc1 ZINC000462752253 875818399 /nfs/dbraw/zinc/81/83/99/875818399.db2.gz BGVTUWRYJSKJSJ-LZLYRXPVSA-N 0 3 406.860 4.188 20 0 HIADHN COc1ccc(C[C@@H](NCc2cn(C)nc2C(F)F)c2ccc(OC)cc2)cc1 ZINC000462785694 875838594 /nfs/dbraw/zinc/83/85/94/875838594.db2.gz RDXLSXFBWSAUJV-HXUWFJFHSA-N 0 3 401.457 4.449 20 0 HIADHN Cc1nn(C(C)C)cc1CNC[C@@H](c1c(F)cccc1Cl)N1CCO[C@H](C)C1 ZINC000462787922 875839999 /nfs/dbraw/zinc/83/99/99/875839999.db2.gz MJPNYTISODEIAK-QRWLVFNGSA-N 0 3 408.949 4.117 20 0 HIADHN Cc1nn(C(C)C)cc1CNC[C@H](c1c(F)cccc1Cl)N1CCO[C@H](C)C1 ZINC000462787920 875840375 /nfs/dbraw/zinc/84/03/75/875840375.db2.gz MJPNYTISODEIAK-FOIQADDNSA-N 0 3 408.949 4.117 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)[C@H]1CCn2c(cnc2C2CCCCC2)C1 ZINC000462804748 875851717 /nfs/dbraw/zinc/85/17/17/875851717.db2.gz CKPAMZIWXSWMNL-WNOPAQSVSA-N 0 3 420.601 4.130 20 0 HIADHN C[C@H](NCCCN1C(=O)COc2ccccc21)c1csc(-c2ccccc2F)n1 ZINC000462806938 875852897 /nfs/dbraw/zinc/85/28/97/875852897.db2.gz QSKBDMAYSVPODS-HNNXBMFYSA-N 0 3 411.502 4.416 20 0 HIADHN C[C@H](NCc1ccc(C(=O)N2CCN(C)CC2)cc1)c1ccc(OC(C)(C)C)cc1 ZINC000462810272 875854490 /nfs/dbraw/zinc/85/44/90/875854490.db2.gz ZYHXUDVMHCEXDF-IBGZPJMESA-N 0 3 409.574 4.102 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@H](C)N[C@@H]2CCCc3c(O)cccc32)cc1 ZINC000462815858 875857690 /nfs/dbraw/zinc/85/76/90/875857690.db2.gz JRXBXCUYJRGQKL-HRAATJIYSA-N 0 3 402.560 4.151 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](N[C@H]2CCO[C@@H](C3CC3)C2)c2ccc(Cl)cc2)c1 ZINC000462837209 875870902 /nfs/dbraw/zinc/87/09/02/875870902.db2.gz ZEIDSWGZYYBTAJ-KSEOMHKRSA-N 0 3 419.974 4.380 20 0 HIADHN COc1ccc([C@@H](CCC(C)C)NCc2cnc(N3CCOCC3)c(F)c2)cc1 ZINC000462846243 875882021 /nfs/dbraw/zinc/88/20/21/875882021.db2.gz RSXYIOMWKUKWKQ-JOCHJYFZSA-N 0 3 401.526 4.333 20 0 HIADHN COCCOCc1ccc(CNCC2=Cc3cc(Br)ccc3OC2)cc1 ZINC000462914912 875941567 /nfs/dbraw/zinc/94/15/67/875941567.db2.gz RTLPLARATRHXMN-UHFFFAOYSA-N 0 3 418.331 4.178 20 0 HIADHN C[C@H]1CCc2c(sc3nc(CCN4CCC(OC(C)(C)C)CC4)nc(N)c23)C1 ZINC000468922913 882984556 /nfs/dbraw/zinc/98/45/56/882984556.db2.gz JXMYRKDMFOWBLS-AWEZNQCLSA-N 0 3 402.608 4.220 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)cc1OC ZINC000463012513 876028313 /nfs/dbraw/zinc/02/83/13/876028313.db2.gz QMBNDYAJFAXQFE-BWAGFHJFSA-N 0 3 423.557 4.071 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)[C@]3(C)CCc4ccccc4C3)CC2)c1 ZINC000463100978 876136978 /nfs/dbraw/zinc/13/69/78/876136978.db2.gz ZSKCQZVMMKOLGM-HHHXNRCGSA-N 0 3 419.613 4.209 20 0 HIADHN C[C@H](C(=O)N[C@H]1CCO[C@H](c2ccccc2)C1)N1CCC(Cc2ccccc2)CC1 ZINC000463118621 876162012 /nfs/dbraw/zinc/16/20/12/876162012.db2.gz DHFDIHPXJHBEHC-YNJKOYDBSA-N 0 3 406.570 4.366 20 0 HIADHN CC[C@H](O[C@@H]1CCC[C@@H](C)C1)C(=O)NCCCCN1CCN(c2ccccc2)CC1 ZINC000463123157 876165198 /nfs/dbraw/zinc/16/51/98/876165198.db2.gz ARXKCNLOJUWQDC-JRFVFWCSSA-N 0 3 415.622 4.079 20 0 HIADHN Cc1c(Br)ccc(C(=O)Nc2ccc(OC3CCN(C)CC3)nc2)c1F ZINC000468935876 883000956 /nfs/dbraw/zinc/00/09/56/883000956.db2.gz IBUMPVQKTAAPOA-UHFFFAOYSA-N 0 3 422.298 4.017 20 0 HIADHN CC(C)(COc1ncccc1Br)NCc1cncc(C(F)(F)F)c1 ZINC000463161115 876216480 /nfs/dbraw/zinc/21/64/80/876216480.db2.gz HPRLVFBENGRHAE-UHFFFAOYSA-N 0 3 404.230 4.205 20 0 HIADHN CCN1CC[C@@H](NCc2cncc(C(F)(F)F)c2)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000463197090 876255766 /nfs/dbraw/zinc/25/57/66/876255766.db2.gz OEZJXSDNZBFERN-SJLPKXTDSA-N 0 3 403.370 4.443 20 0 HIADHN C[C@@H]1CC[C@H](O)[C@@H]([C@H]2CCCCN2CC(=O)N(Cc2ccco2)c2ccccc2)C1 ZINC000463203536 876264584 /nfs/dbraw/zinc/26/45/84/876264584.db2.gz KTRRSLZPFCTMIX-CDIGIKMISA-N 0 3 410.558 4.464 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)NCc3ccc(C(F)F)cc3)CC2)C[C@H](C)O1 ZINC000463219796 876278834 /nfs/dbraw/zinc/27/88/34/876278834.db2.gz AFRLRDNFBZMKNN-IRXDYDNUSA-N 0 3 409.521 4.045 20 0 HIADHN CN(CCN(Cc1ccccc1)C(=O)N[C@H]1CCO[C@@H](C2CC2)C1)Cc1ccccc1 ZINC000463258650 876316903 /nfs/dbraw/zinc/31/69/03/876316903.db2.gz RCSVNVRBPJVMBA-LOSJGSFVSA-N 0 3 421.585 4.288 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)c2c(F)cc(C(F)(F)F)cc2F)CC1 ZINC000463258887 876317108 /nfs/dbraw/zinc/31/71/08/876317108.db2.gz NRJJAUQPFXQKMB-UHFFFAOYSA-N 0 3 402.363 4.313 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)NCc1ccc(-c2ccncc2)cc1 ZINC000463275480 876332504 /nfs/dbraw/zinc/33/25/04/876332504.db2.gz LGSCJIVRRUCQCO-DVECYGJZSA-N 0 3 400.526 4.068 20 0 HIADHN CO[C@@H](CNCc1cc(Br)cc(Br)c1N)c1ccccc1 ZINC000463285413 876344921 /nfs/dbraw/zinc/34/49/21/876344921.db2.gz XKRMQWQVTPPTSK-HNNXBMFYSA-N 0 3 414.141 4.271 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1csc2cncn21)c1ccc(C(F)(F)F)cc1 ZINC000468955819 883021430 /nfs/dbraw/zinc/02/14/30/883021430.db2.gz LPMSGHNOYFGWNH-OAHLLOKOSA-N 0 3 410.465 4.228 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)[C@@H]3SCCc4sccc43)c(C)c2)CC1 ZINC000463330341 876386664 /nfs/dbraw/zinc/38/66/64/876386664.db2.gz ZTSMGOVHUXXCNL-HXUWFJFHSA-N 0 3 401.601 4.168 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1Cc2ccc(O)cc2C2(CC2)C1)c1cccc(OC)c1 ZINC000463338132 876394121 /nfs/dbraw/zinc/39/41/21/876394121.db2.gz ANGWOYPHXKYIKV-QHCPKHFHSA-N 0 3 423.557 4.041 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)[C@@H]1[C@@H](c2ccccc2)C1(F)F ZINC000468966274 883032454 /nfs/dbraw/zinc/03/24/54/883032454.db2.gz NFOZRCBISKZNTD-UXHICEINSA-N 0 3 402.510 4.265 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)cc1C(=O)NCCCN1CCc2ccccc2C1 ZINC000463412143 876465166 /nfs/dbraw/zinc/46/51/66/876465166.db2.gz HAGVMFFSKPXVLM-UHFFFAOYSA-N 0 3 408.933 4.012 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)[C@@H]3C[C@H]3c3cc(F)c(F)c(F)c3)c(C)c2)CC1 ZINC000463516188 876581519 /nfs/dbraw/zinc/58/15/19/876581519.db2.gz VIDMLJXXZUXVMK-ZWKOTPCHSA-N 0 3 417.475 4.296 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)c1cc(NC(=O)C(C)(C)C)ccc1F ZINC000463525346 876594876 /nfs/dbraw/zinc/59/48/76/876594876.db2.gz IVFVMMDKKSCFLB-UHFFFAOYSA-N 0 3 417.500 4.153 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)c1ccc(F)c(Br)c1 ZINC000463533404 876611389 /nfs/dbraw/zinc/61/13/89/876611389.db2.gz PZGZARYBCFQSNE-UHFFFAOYSA-N 0 3 415.253 4.070 20 0 HIADHN C[C@H](C(=O)N(CCCn1ccnc1)Cc1c(F)cccc1Cl)N1CCCCCC1 ZINC000468987395 883053361 /nfs/dbraw/zinc/05/33/61/883053361.db2.gz NEGCQPZZRAPZOV-GOSISDBHSA-N 0 3 420.960 4.359 20 0 HIADHN O=C([C@H]1SCCc2sccc21)N1CCCN(CCCc2ccccc2)CC1 ZINC000463618271 876737169 /nfs/dbraw/zinc/73/71/69/876737169.db2.gz MDGCEURMJCLDQV-NRFANRHFSA-N 0 3 400.613 4.246 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)cc1C(=O)NC[C@H]1CCCN1Cc1ccccc1 ZINC000463714253 876833101 /nfs/dbraw/zinc/83/31/01/876833101.db2.gz KCLJLRFVVPQCNZ-OAQYLSRUSA-N 0 3 408.933 4.229 20 0 HIADHN C[C@@H]1CCN(C(=O)[C@@H]2C[C@H]2c2cc(F)c(F)c(F)c2)CCN1Cc1ccccc1 ZINC000463769773 876891577 /nfs/dbraw/zinc/89/15/77/876891577.db2.gz PLMHAORDFMGNJH-AYOQOUSVSA-N 0 3 402.460 4.330 20 0 HIADHN CC(C)c1nn(C)c2sc(C(=O)N(C)C3CCN(Cc4ccccc4)CC3)cc12 ZINC000463808372 876925623 /nfs/dbraw/zinc/92/56/23/876925623.db2.gz JBIOACAQQLXWIH-UHFFFAOYSA-N 0 3 410.587 4.495 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)c2ccc(-c3ccc(C(C)(C)C)cc3)o2)CC1 ZINC000463816795 876931130 /nfs/dbraw/zinc/93/11/30/876931130.db2.gz JRKWPTHCRPYTRW-LJQANCHMSA-N 0 3 411.590 4.248 20 0 HIADHN Cc1cc(N2CC[C@@H](N[C@H](Cc3ccc(Cl)cc3)c3ccccc3)C2=O)n(C)n1 ZINC000463885292 877006568 /nfs/dbraw/zinc/00/65/68/877006568.db2.gz AHOWEZKZFYRYDN-NHCUHLMSSA-N 0 3 408.933 4.061 20 0 HIADHN C[C@H](CNC(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1)Oc1ccccc1F ZINC000463929486 877049919 /nfs/dbraw/zinc/04/99/19/877049919.db2.gz VUKGLXMXADUKSK-IIBYNOLFSA-N 0 3 424.438 4.164 20 0 HIADHN COc1ccc([C@H](CNC(=O)N[C@H](C)c2c(F)cccc2OC)N2CCCC2)cc1 ZINC000463956132 877078344 /nfs/dbraw/zinc/07/83/44/877078344.db2.gz WYYAWEQYOVWJFJ-UZLBHIALSA-N 0 3 415.509 4.040 20 0 HIADHN CC(C)c1ccc(NC(=O)C(=O)Nc2cccc(CN3CC[C@H](O)C3)c2)c(C(C)C)c1 ZINC000463978910 877109405 /nfs/dbraw/zinc/10/94/05/877109405.db2.gz UHZZATDKMZDEPP-NRFANRHFSA-N 0 3 423.557 4.077 20 0 HIADHN CN(C(=O)[C@@H]1C[C@H]1c1ccc(Cl)s1)C1CCN(CCc2ccccn2)CC1 ZINC000469029202 883098603 /nfs/dbraw/zinc/09/86/03/883098603.db2.gz QTNZXZRWARRCOK-QZTJIDSGSA-N 0 3 403.979 4.066 20 0 HIADHN Cc1cc2cc(C(=O)Nc3ccc(C(=O)N(C)[C@@H]4CCCN(C)C4)cc3)oc2cc1C ZINC000464010421 877145105 /nfs/dbraw/zinc/14/51/05/877145105.db2.gz DWXKJDRPZRFODH-OAQYLSRUSA-N 0 3 419.525 4.468 20 0 HIADHN Cc1cc(C(=O)N(C)C2CCN(Cc3ccccc3)CC2)nn1-c1c(F)cccc1F ZINC000469039755 883110043 /nfs/dbraw/zinc/11/00/43/883110043.db2.gz OMYDGXXMVGEMGY-UHFFFAOYSA-N 0 3 424.495 4.196 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)c1cnnc(-c2ccccc2)c1 ZINC000464203667 877373855 /nfs/dbraw/zinc/37/38/55/877373855.db2.gz IEBHRXIDVBVAFD-JOCHJYFZSA-N 0 3 424.508 4.039 20 0 HIADHN Cc1nn(C(C)(C)C)cc1[C@H](C)NC(=O)NCC(C)(C)N1CCc2ccccc2C1 ZINC000464363173 877560564 /nfs/dbraw/zinc/56/05/64/877560564.db2.gz SGLMGSABUQGVKP-KRWDZBQOSA-N 0 3 411.594 4.144 20 0 HIADHN Cc1cc(C(=O)N(CC(C)C)C2CCN(C)CC2)c2cc(Br)ccc2n1 ZINC000464579074 877802704 /nfs/dbraw/zinc/80/27/04/877802704.db2.gz YNEVPWABQIXQBE-UHFFFAOYSA-N 0 3 418.379 4.498 20 0 HIADHN CO[C@H](CNC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1)c1cccc(Cl)c1 ZINC000464592206 877818281 /nfs/dbraw/zinc/81/82/81/877818281.db2.gz HWQXFUBEFYIALC-GHTZIAJQSA-N 0 3 404.913 4.195 20 0 HIADHN C/C=C/c1ccc(OC[C@H](O)CN[C@@H](C)c2cn(C(C)(C)C)nc2C)c(OC)c1 ZINC000464600019 877827526 /nfs/dbraw/zinc/82/75/26/877827526.db2.gz FNHJPIQJPFTCFO-WRKUDEPPSA-N 0 3 401.551 4.079 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cc(COc2ccccc2F)on1)c1ccsc1 ZINC000464658882 877879794 /nfs/dbraw/zinc/87/97/94/877879794.db2.gz WKEIRJVGZRGKKW-LJQANCHMSA-N 0 3 417.506 4.267 20 0 HIADHN COc1cc(C(C)=O)ccc1OC[C@@H](O)CN1CCCC[C@@H]1c1cccc(C)c1C ZINC000464778471 878020749 /nfs/dbraw/zinc/02/07/49/878020749.db2.gz ONIMNPGIJORISW-JTHBVZDNSA-N 0 3 411.542 4.482 20 0 HIADHN COc1cccc(CN(C)C(=O)CN(C)[C@H](Cc2ccc(F)cc2)C(C)C)c1OC ZINC000464786361 878034826 /nfs/dbraw/zinc/03/48/26/878034826.db2.gz XFJAZTGHNDZBNQ-OAQYLSRUSA-N 0 3 416.537 4.000 20 0 HIADHN COC(=O)c1c(CN2CC[C@@]3(CCOC3)C2)nc2ccccc2c1-c1ccccc1 ZINC000464858671 878139151 /nfs/dbraw/zinc/13/91/51/878139151.db2.gz XOLBZRJBWFXJRM-RUZDIDTESA-N 0 3 402.494 4.301 20 0 HIADHN COC(=O)c1cc(CN(Cc2cccc(OC)c2)C2CCC(O)CC2)c(C)s1 ZINC000464868415 878152648 /nfs/dbraw/zinc/15/26/48/878152648.db2.gz MDFWJEVMXUFBLM-UHFFFAOYSA-N 0 3 403.544 4.157 20 0 HIADHN C[C@@H]1CCN(C(=O)c2cnn(-c3ccccc3)c2C2CC2)CCN1Cc1ccccc1 ZINC000464889512 878189947 /nfs/dbraw/zinc/18/99/47/878189947.db2.gz GKHDGUUTBLHINK-HXUWFJFHSA-N 0 3 414.553 4.486 20 0 HIADHN Cc1oc(-c2cccs2)nc1CC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1 ZINC000464909180 878225496 /nfs/dbraw/zinc/22/54/96/878225496.db2.gz XCFQQPHHJNMLRB-KRWDZBQOSA-N 0 3 409.555 4.377 20 0 HIADHN CCOc1ccc(C(=O)CCC(=O)N(C)C[C@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000464972927 878313544 /nfs/dbraw/zinc/31/35/44/878313544.db2.gz OHWPQPPTGBRMFS-OAQYLSRUSA-N 0 3 408.542 4.029 20 0 HIADHN CCC(C)(C)CC(=O)NC1CCN(CCOc2ccc(Br)cc2)CC1 ZINC000465128803 878509342 /nfs/dbraw/zinc/50/93/42/878509342.db2.gz LKWJQCRJCZOLAI-UHFFFAOYSA-N 0 3 411.384 4.235 20 0 HIADHN CC(C)N(Cc1ccccc1)C(=O)[C@H](C)N1CCC[C@@H](c2ncc3n2CCCC3)C1 ZINC000503388450 912372089 /nfs/dbraw/zinc/37/20/89/912372089.db2.gz CNJWJONJRDTMGY-RBBKRZOGSA-N 0 3 408.590 4.225 20 0 HIADHN C[C@@H]1CCN(C(=O)NC[C@H](c2ccco2)N2CCCCC2)CCN1Cc1ccccc1 ZINC000465398072 878834417 /nfs/dbraw/zinc/83/44/17/878834417.db2.gz AZVYXGZTMBZECG-FYYLOGMGSA-N 0 3 424.589 4.113 20 0 HIADHN C[C@H]1CCN(C(=O)NC[C@@H](c2ccco2)N2CCCCC2)CCN1Cc1ccccc1 ZINC000465398074 878834878 /nfs/dbraw/zinc/83/48/78/878834878.db2.gz AZVYXGZTMBZECG-GMAHTHKFSA-N 0 3 424.589 4.113 20 0 HIADHN Cc1ccc2[nH]c(CNC(=O)NC[C@H](c3cccs3)N3CCC(C)CC3)nc2c1 ZINC000465421866 878851292 /nfs/dbraw/zinc/85/12/92/878851292.db2.gz HWKJKPLLELDMHJ-LJQANCHMSA-N 0 3 411.575 4.205 20 0 HIADHN Cc1ccc2nc(CNC(=O)NC[C@H](c3cccs3)N3CCC(C)CC3)[nH]c2c1 ZINC000465421866 878851303 /nfs/dbraw/zinc/85/13/03/878851303.db2.gz HWKJKPLLELDMHJ-LJQANCHMSA-N 0 3 411.575 4.205 20 0 HIADHN CCO[C@H](C)c1nc(CN(C)C(=O)NC[C@H](c2cccs2)N2CCCC2)cs1 ZINC000465430053 878861591 /nfs/dbraw/zinc/86/15/91/878861591.db2.gz XZORXXWWHYGZFA-NVXWUHKLSA-N 0 3 422.620 4.281 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)N[C@H](C)c2cccc(-n3cccn3)c2)N(C)C)cc1 ZINC000465431289 878863450 /nfs/dbraw/zinc/86/34/50/878863450.db2.gz IUFJTWCQTNAFGS-WZONZLPQSA-N 0 3 405.546 4.098 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)N[C@H](C)c2nc(C3CCCCC3)no2)N(C)C)cc1 ZINC000465431221 878863762 /nfs/dbraw/zinc/86/37/62/878863762.db2.gz JYAXTHNUPRGFKC-OXQOHEQNSA-N 0 3 413.566 4.343 20 0 HIADHN CCO[C@@H](C)c1nc(CN(C)C(=O)NC[C@@H](c2ccc(CC)cc2)N(C)C)cs1 ZINC000465434110 878866865 /nfs/dbraw/zinc/86/68/65/878866865.db2.gz PEAKAGZISPFNRW-JXFKEZNVSA-N 0 3 418.607 4.247 20 0 HIADHN COc1cccc([C@H](CNC(=O)NC[C@H](C)c2ccc(F)cc2F)N2CCCC2)c1 ZINC000465482104 878921170 /nfs/dbraw/zinc/92/11/70/878921170.db2.gz WXBFBHPVBJQJEX-AOMKIAJQSA-N 0 3 417.500 4.213 20 0 HIADHN CC[C@@H](CNC(=O)N(C)[C@@H](C)Cc1ccccc1OC)N1CCc2ccccc2C1 ZINC000465525118 878978380 /nfs/dbraw/zinc/97/83/80/878978380.db2.gz KIZULMPWWFUZLK-CVDCTZTESA-N 0 3 409.574 4.105 20 0 HIADHN Cc1cccc([C@H]2CCCN2C(=O)NCc2ccc(CN3CCN(C)CC3)cc2)c1C ZINC000465558375 879029014 /nfs/dbraw/zinc/02/90/14/879029014.db2.gz PBMAZNDTYRHEJZ-RUZDIDTESA-N 0 3 420.601 4.098 20 0 HIADHN CC(C)C(=O)Nc1ccc(CNC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)cc1 ZINC000465575551 879051352 /nfs/dbraw/zinc/05/13/52/879051352.db2.gz QKAOIMBKHWDWPS-HXUWFJFHSA-N 0 3 422.573 4.087 20 0 HIADHN CC[C@H](C)c1ccc([C@H](NC(=O)NC[C@@H](C)CN2CCN(C)CC2)C(C)C)cc1 ZINC000465632526 879144813 /nfs/dbraw/zinc/14/48/13/879144813.db2.gz OSIOOJRMEHFBAE-ZRCGQRJVSA-N 0 3 402.627 4.080 20 0 HIADHN C[C@H]1CCN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)[C@@H](c2ccco2)C1 ZINC000465670248 879206623 /nfs/dbraw/zinc/20/66/23/879206623.db2.gz WWTPVOBVURPINW-JTHBVZDNSA-N 0 3 424.589 4.365 20 0 HIADHN CC(C)(CNC(=O)NCc1ccc(-c2cccnc2)cc1)N1CCc2ccccc2C1 ZINC000465687983 879239111 /nfs/dbraw/zinc/23/91/11/879239111.db2.gz JFRBPWULXXHRCL-UHFFFAOYSA-N 0 3 414.553 4.385 20 0 HIADHN Cc1ccc(-c2nc(CNC(=O)N[C@@H]3CCCN(Cc4ccccc4)C3)co2)cc1 ZINC000465690017 879240981 /nfs/dbraw/zinc/24/09/81/879240981.db2.gz MGXOGRPQACPMIE-OAQYLSRUSA-N 0 3 404.514 4.114 20 0 HIADHN CCCCOc1ncccc1CNC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC000465731396 879312281 /nfs/dbraw/zinc/31/22/81/879312281.db2.gz ZABJMANUBASVTR-HXUWFJFHSA-N 0 3 410.562 4.067 20 0 HIADHN C[C@@H]1CCN(C(=O)N[C@H]2CCOc3c(Cl)cccc32)CCN1Cc1ccccc1 ZINC000465750484 879339017 /nfs/dbraw/zinc/33/90/17/879339017.db2.gz ICUSZOVJFLCWLH-UTKZUKDTSA-N 0 3 413.949 4.470 20 0 HIADHN CN(C)CCN(C[C@H]1CCCO1)C(=O)N[C@H](c1ccsc1)c1ccc(Cl)cc1 ZINC000465763253 879359030 /nfs/dbraw/zinc/35/90/30/879359030.db2.gz WFIIMOCKLOIPLA-UXHICEINSA-N 0 3 421.994 4.243 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)NCc2ccc(-c3cccnc3)cc2)C1 ZINC000465764835 879361752 /nfs/dbraw/zinc/36/17/52/879361752.db2.gz XQZKXDWAIMURJM-YADARESESA-N 0 3 400.526 4.383 20 0 HIADHN COc1ccccc1C1(CNC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)CC1 ZINC000465780681 879383436 /nfs/dbraw/zinc/38/34/36/879383436.db2.gz LKBFILUOMFCXNE-HXUWFJFHSA-N 0 3 407.558 4.033 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)N[C@@H](C)c2ccccc2Oc2ccccc2)CC1 ZINC000465799308 879409973 /nfs/dbraw/zinc/40/99/73/879409973.db2.gz IIZMBLOZZVXDTQ-SFTDATJTSA-N 0 3 424.589 4.113 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N[C@H](C)c2cccc(-n3cccn3)c2)N2CCCC2)cc1 ZINC000465819852 879446787 /nfs/dbraw/zinc/44/67/87/879446787.db2.gz WNWUDDSYTOMZOS-YKSBVNFPSA-N 0 3 417.557 4.378 20 0 HIADHN CN(C)CCN(C[C@H]1CCCO1)C(=O)NCC(C)(C)c1ccc(Cl)c(Cl)c1 ZINC000465826462 879457722 /nfs/dbraw/zinc/45/77/22/879457722.db2.gz OMKDFPHNWMXYDY-MRXNPFEDSA-N 0 3 416.393 4.023 20 0 HIADHN CN(C)CCN(C[C@H]1CCCO1)C(=O)NCc1ccccc1-c1ccc(Cl)cc1 ZINC000465848487 879490042 /nfs/dbraw/zinc/49/00/42/879490042.db2.gz PXVDYCFPUSKVOD-OAQYLSRUSA-N 0 3 415.965 4.259 20 0 HIADHN Cc1ccccc1[C@H](NC(=O)NC[C@H](C)CN1CCN(C)CC1)[C@@H]1CCC[C@@H](C)C1 ZINC000465935180 879600667 /nfs/dbraw/zinc/60/06/67/879600667.db2.gz UPLKTJDAZPVPGW-DAVFGYKESA-N 0 3 414.638 4.045 20 0 HIADHN CCCc1nc(C)c(C(=O)N(Cc2ccc(O)cc2)C[C@@H]2CCCN2CC)s1 ZINC000503454809 912480609 /nfs/dbraw/zinc/48/06/09/912480609.db2.gz SEZAPAPOJJQELI-SFHVURJKSA-N 0 3 401.576 4.236 20 0 HIADHN C[C@@H]1CCN(C)CCN1C(=O)NCc1ccccc1COc1ccccc1Cl ZINC000466031821 879720280 /nfs/dbraw/zinc/72/02/80/879720280.db2.gz DSSHTCRPKUFIIV-QGZVFWFLSA-N 0 3 401.938 4.155 20 0 HIADHN COc1ccccc1[C@]1(C)C[C@H]1NC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1 ZINC000466053050 879743334 /nfs/dbraw/zinc/74/33/34/879743334.db2.gz BQFCNOVJLNDFOH-CYSDGLOUSA-N 0 3 407.558 4.031 20 0 HIADHN COc1ccccc1[C@]1(C)C[C@@H]1NC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1 ZINC000466053052 879743495 /nfs/dbraw/zinc/74/34/95/879743495.db2.gz BQFCNOVJLNDFOH-QXWFJRNPSA-N 0 3 407.558 4.031 20 0 HIADHN COc1ccccc1[C@@H](NC(=O)N1CC[C@H](N2CC=CC2)C1)c1ccccc1Cl ZINC000466079086 879794927 /nfs/dbraw/zinc/79/49/27/879794927.db2.gz OSYRAZKKZXTNDY-JTSKRJEESA-N 0 3 411.933 4.094 20 0 HIADHN CO[C@@H](CNC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C)c1ccc(Cl)cc1 ZINC000466081047 879800364 /nfs/dbraw/zinc/80/03/64/879800364.db2.gz HMWUXHXDAGKUOA-AVRDEDQJSA-N 0 3 415.965 4.334 20 0 HIADHN CO[C@H](CNC(=O)N(CCN(C)C)Cc1cccc(C)c1)c1ccc(Cl)cc1 ZINC000466090795 879809134 /nfs/dbraw/zinc/80/91/34/879809134.db2.gz KXALFLBXHUIPGT-OAQYLSRUSA-N 0 3 403.954 4.109 20 0 HIADHN CCCN(C(=O)N[C@@H]1CCc2c1cccc2O)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000466095356 879814214 /nfs/dbraw/zinc/81/42/14/879814214.db2.gz OFCVGYIBTULJFK-NZQKXSOJSA-N 0 3 407.558 4.466 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)Nc2ccccc2Oc2ccc(C)cc2)CC1 ZINC000466111426 879825894 /nfs/dbraw/zinc/82/58/94/879825894.db2.gz BAXMTWGKTLGUGT-HXUWFJFHSA-N 0 3 410.562 4.182 20 0 HIADHN CCC(CC)c1cc(CNC(=O)N(CCN(C)C)Cc2ccc(F)cc2F)on1 ZINC000466119991 879833115 /nfs/dbraw/zinc/83/31/15/879833115.db2.gz ZCHMUZHNTJKHPV-UHFFFAOYSA-N 0 3 408.493 4.130 20 0 HIADHN CCCN(C(=O)N[C@@H]1[C@@H]2CCCO[C@H]2C1(C)C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000466133263 879845336 /nfs/dbraw/zinc/84/53/36/879845336.db2.gz FCYBYCKZAJUNMS-KAOXLYBCSA-N 0 3 413.606 4.276 20 0 HIADHN CC1CCN([C@@H](CNC(=O)N(C)Cc2cc(Cl)cn2C)c2cccs2)CC1 ZINC000466145642 879854666 /nfs/dbraw/zinc/85/46/66/879854666.db2.gz QBVIRJBRXHTWQB-SFHVURJKSA-N 0 3 408.999 4.355 20 0 HIADHN COc1ccc([C@H](CNC(=O)Nc2cccc(Br)c2)N2CCCC2)cc1 ZINC000503471232 912503864 /nfs/dbraw/zinc/50/38/64/912503864.db2.gz FTNGBRCINCOVQA-IBGZPJMESA-N 0 3 418.335 4.416 20 0 HIADHN COc1ccc([C@@H](CNC(=O)Nc2ccc(OC)c3ncccc23)N2CCCC2)cc1 ZINC000503475260 912514512 /nfs/dbraw/zinc/51/45/12/912514512.db2.gz SRLPJIBXUBHBSZ-OAQYLSRUSA-N 0 3 420.513 4.211 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)N[C@@H](c2ccccc2)c2ccncc2)CN1Cc1ccccc1 ZINC000466262634 879992874 /nfs/dbraw/zinc/99/28/74/879992874.db2.gz YKLBVHAZFQCSFI-YGOYIFOWSA-N 0 3 400.526 4.133 20 0 HIADHN COc1ccc(-c2cncc(C(=O)N[C@H]3CCN([C@@H](C)c4ccccc4)C3)c2)cc1 ZINC000466303863 880053996 /nfs/dbraw/zinc/05/39/96/880053996.db2.gz ZKNXUALARXZCEB-MBSDFSHPSA-N 0 3 401.510 4.323 20 0 HIADHN Cc1cc(CNCc2cnc3ccc(Cl)cn23)ccc1I ZINC000466363026 880120780 /nfs/dbraw/zinc/12/07/80/880120780.db2.gz APOQPMDZEAKDEN-UHFFFAOYSA-N 0 3 411.674 4.191 20 0 HIADHN Cc1oc2ccccc2c1CC(=O)Nc1ccc(C(=O)N(C)[C@H]2CCCN(C)C2)cc1 ZINC000466433817 880208504 /nfs/dbraw/zinc/20/85/04/880208504.db2.gz FTVBGNALKAMJJM-FQEVSTJZSA-N 0 3 419.525 4.089 20 0 HIADHN CO[C@@H](c1ccc(Br)cc1)[C@H](C)NCc1cncc(Br)c1 ZINC000466448710 880225494 /nfs/dbraw/zinc/22/54/94/880225494.db2.gz IKZZKCUWVJGMPD-MEDUHNTESA-N 0 3 414.141 4.472 20 0 HIADHN C[C@H](NC(=O)N(C)C1CCN(CCc2ccccn2)CC1)c1cc2ccccc2o1 ZINC000466488791 880267730 /nfs/dbraw/zinc/26/77/30/880267730.db2.gz NWTFGPXEGWJJAU-SFHVURJKSA-N 0 3 406.530 4.237 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1C[C@H](C)N(Cc2ccccc2)C1)c1nc(C(C)(C)C)cs1 ZINC000466505720 880280986 /nfs/dbraw/zinc/28/09/86/880280986.db2.gz QGZBHFIDFQFTQM-XYJFISCASA-N 0 3 400.592 4.464 20 0 HIADHN COCCCCN(Cc1ccccc1)C(=O)N[C@@H]1C[C@H](C)N(Cc2ccccc2)C1 ZINC000466529590 880305772 /nfs/dbraw/zinc/30/57/72/880305772.db2.gz OSFFRTHWJMJKKB-XUZZJYLKSA-N 0 3 409.574 4.288 20 0 HIADHN CC[C@@H](CNC(=O)N1CCC[C@@H]1c1ccc(COC)o1)N1CCc2ccccc2C1 ZINC000466564010 880339387 /nfs/dbraw/zinc/33/93/87/880339387.db2.gz QEHXTWIKIGBAIX-RBBKRZOGSA-N 0 3 411.546 4.109 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)N1CCO[C@H](c2cccc(Cl)c2)C1 ZINC000466566749 880341981 /nfs/dbraw/zinc/34/19/81/880341981.db2.gz YFWVAVHMLDEBQY-YADHBBJMSA-N 0 3 413.949 4.260 20 0 HIADHN CCOc1cc(F)ccc1NC(=O)NC[C@@H](c1ccc(OC)cc1)N1CCCC1 ZINC000503513061 912558454 /nfs/dbraw/zinc/55/84/54/912558454.db2.gz YHDUOFORHGSHOF-FQEVSTJZSA-N 0 3 401.482 4.192 20 0 HIADHN CC[C@@H](C(=O)Nc1nc(-c2ccc3c(c2)CCC(=O)N3)c(C)s1)N(CC)CC ZINC000466621982 880393223 /nfs/dbraw/zinc/39/32/23/880393223.db2.gz ALKAEHQSXSGMKQ-KRWDZBQOSA-N 0 3 400.548 4.062 20 0 HIADHN CCc1c(NC(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)cnn1-c1ccccc1 ZINC000466664763 880446965 /nfs/dbraw/zinc/44/69/65/880446965.db2.gz LYEFTZWTEZCQDE-GCJKJVERSA-N 0 3 403.530 4.077 20 0 HIADHN C[C@H](NC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1)c1cccc(-n2cccn2)c1 ZINC000466684595 880474926 /nfs/dbraw/zinc/47/49/26/880474926.db2.gz UARZLEPSKYUNRI-SFTDATJTSA-N 0 3 417.557 4.239 20 0 HIADHN CC[C@H](NC(=O)N1CCN(CCC(C)(C)C)CC1)c1nc(C(F)(F)F)cs1 ZINC000466688467 880479013 /nfs/dbraw/zinc/47/90/13/880479013.db2.gz AJCHAQIDDKZUGR-ZDUSSCGKSA-N 0 3 406.518 4.376 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCCc1c[nH]c2ccccc12)c1cccc(OC)c1 ZINC000503522870 912573564 /nfs/dbraw/zinc/57/35/64/912573564.db2.gz CFXWULPGLCYCQW-QHCPKHFHSA-N 0 3 408.546 4.101 20 0 HIADHN O=C(Nc1cc(Br)c(F)cc1F)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000466702751 880494177 /nfs/dbraw/zinc/49/41/77/880494177.db2.gz DRKVGLPXETZILL-ZDUSSCGKSA-N 0 3 410.262 4.123 20 0 HIADHN CC(C)N1CCc2nc(CNc3ccc(CN(C)C)c(Br)c3)sc2C1 ZINC000466723968 880511200 /nfs/dbraw/zinc/51/12/00/880511200.db2.gz BBBCEWZWBGNRCV-UHFFFAOYSA-N 0 3 423.424 4.346 20 0 HIADHN CC1CCN([C@H](CNC(=O)NC[C@@]2(C)CCO[C@@H]2C2CC2)c2cccs2)CC1 ZINC000466789473 880568943 /nfs/dbraw/zinc/56/89/43/880568943.db2.gz LNMTYGBXWJKGMT-SYYKKAFVSA-N 0 3 405.608 4.026 20 0 HIADHN CCN(C(=O)c1ccn(-c2ccc(F)cc2F)n1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000466814157 880589401 /nfs/dbraw/zinc/58/94/01/880589401.db2.gz GPGFGEJGYZUYMN-PXNSSMCTSA-N 0 3 424.495 4.448 20 0 HIADHN COc1cccc([C@H](CNC(=O)Nc2cccc(-c3cc[nH]n3)c2)N2CCCC2)c1 ZINC000466898993 880666349 /nfs/dbraw/zinc/66/63/49/880666349.db2.gz FEKGFQJAWNPKOO-QFIPXVFZSA-N 0 3 405.502 4.044 20 0 HIADHN COCCc1ccccc1NC(=O)N(CCN(C)C)Cc1ccc(C(F)(F)F)cc1 ZINC000466934518 880702333 /nfs/dbraw/zinc/70/23/33/880702333.db2.gz XPUDYJOCBFUVBE-UHFFFAOYSA-N 0 3 423.479 4.490 20 0 HIADHN Cc1ccc([C@H]2OCCC[C@H]2CNC(=O)N2CCN(C3CCC(C)CC3)CC2)cc1 ZINC000466937726 880706202 /nfs/dbraw/zinc/70/62/02/880706202.db2.gz HVFZDQAAZQRJSG-LKCSTTETSA-N 0 3 413.606 4.369 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)N[C@H](C)c2ccc(-n3cccn3)cc2)c1 ZINC000466970751 880771911 /nfs/dbraw/zinc/77/19/11/880771911.db2.gz HXTXLACWTFKUMI-HXUWFJFHSA-N 0 3 405.546 4.015 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)CCc2ncc(-c3ccccc3F)o2)CN1Cc1ccccc1 ZINC000467035733 880833849 /nfs/dbraw/zinc/83/38/49/880833849.db2.gz RUJVNALKJPHSCQ-PKOBYXMFSA-N 0 3 407.489 4.193 20 0 HIADHN C[C@H](NC(=O)N(Cc1ccco1)C1CCN(C)CC1)c1nc(C2CCCCC2)no1 ZINC000467044634 880839534 /nfs/dbraw/zinc/83/95/34/880839534.db2.gz HRQHXXMMQOQWOU-INIZCTEOSA-N 0 3 415.538 4.077 20 0 HIADHN O=C(NCc1ccccc1-c1ccc(Cn2ccnc2)cc1)[C@H]1CCCc2[nH]ncc21 ZINC000467096971 880860868 /nfs/dbraw/zinc/86/08/68/880860868.db2.gz LZJBWXZUEYXYAF-QFIPXVFZSA-N 0 3 411.509 4.058 20 0 HIADHN Cc1nn(C)c(=O)c(-c2nc(CN3CCC[C@@]3(C)Cc3ccccc3)cs2)c1C ZINC000467235127 880961614 /nfs/dbraw/zinc/96/16/14/880961614.db2.gz IOLFSBWMIAAYEA-QHCPKHFHSA-N 0 3 408.571 4.118 20 0 HIADHN FC(F)(F)c1nnc(N2CCCN(CCCc3ccc(Cl)cc3)CC2)s1 ZINC000467278705 881023579 /nfs/dbraw/zinc/02/35/79/881023579.db2.gz OLAHXKAERZYXLF-UHFFFAOYSA-N 0 3 404.889 4.355 20 0 HIADHN C[C@@H](NCc1ccc(CN2C[C@@H](C)O[C@H](C)C2)cc1)c1ccnn1-c1ccccc1 ZINC000467313042 881061121 /nfs/dbraw/zinc/06/11/21/881061121.db2.gz KZSXTRHDMBWGFB-NJDAHSKKSA-N 0 3 404.558 4.332 20 0 HIADHN C[C@@H](Cc1cccc(C(F)(F)F)c1)N[C@@H](c1nc(-c2nc[nH]n2)no1)C(C)(C)C ZINC000467351366 881107414 /nfs/dbraw/zinc/10/74/14/881107414.db2.gz BBCMJDOXPJNGCO-FZMZJTMJSA-N 0 3 408.428 4.182 20 0 HIADHN CC(C)CCOc1ccc(NC(=O)N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)cc1 ZINC000467371339 881145459 /nfs/dbraw/zinc/14/54/59/881145459.db2.gz UKQOAQCSLINOHC-BGYRXZFFSA-N 0 3 417.594 4.465 20 0 HIADHN CCC[C@H](N[C@H]1CCc2cc(F)c(OC)cc21)C(=O)N1CCc2sccc2C1 ZINC000467381621 881159723 /nfs/dbraw/zinc/15/97/23/881159723.db2.gz MGGQRSYPGSMJLE-OALUTQOASA-N 0 3 402.535 4.226 20 0 HIADHN Cc1cc(CN[C@@H]2CCC(=O)Nc3ccc(F)cc32)ccc1I ZINC000467381868 881160305 /nfs/dbraw/zinc/16/03/05/881160305.db2.gz LUQFDFGFDDCDPO-MRXNPFEDSA-N 0 3 424.257 4.302 20 0 HIADHN Cc1cc(CN[C@H]2CCC(=O)Nc3ccc(F)cc32)ccc1I ZINC000467381867 881160934 /nfs/dbraw/zinc/16/09/34/881160934.db2.gz LUQFDFGFDDCDPO-INIZCTEOSA-N 0 3 424.257 4.302 20 0 HIADHN Cc1ccccc1C[C@H](CO)N[C@H](C)c1ccc(OC(F)F)cc1OC(F)F ZINC000467393264 881176136 /nfs/dbraw/zinc/17/61/36/881176136.db2.gz KNKZLSIDPDINPZ-UKRRQHHQSA-N 0 3 401.400 4.452 20 0 HIADHN Cc1c([C@@H](C)NCCN2CCc3ccccc3C2=O)cnn1-c1cccc(Cl)c1 ZINC000467401788 881185287 /nfs/dbraw/zinc/18/52/87/881185287.db2.gz PIWPEQRQEOVMET-MRXNPFEDSA-N 0 3 408.933 4.183 20 0 HIADHN C[C@H](CNC(=O)Nc1ccccc1CC(=O)OC(C)(C)C)N(C)Cc1ccccc1 ZINC000467428286 881220855 /nfs/dbraw/zinc/22/08/55/881220855.db2.gz PHEWLIIBJKKNQI-GOSISDBHSA-N 0 3 411.546 4.213 20 0 HIADHN Cc1nn(C(C)C)cc1CN1CCC[C@@H](c2nnc3ccc(C(F)(F)F)cn32)C1 ZINC000467442338 881243681 /nfs/dbraw/zinc/24/36/81/881243681.db2.gz LIGNJOZLMMMXGZ-OAHLLOKOSA-N 0 3 406.456 4.214 20 0 HIADHN COc1cc([C@H](C)N[C@H]2CC(=O)N(Cc3ccccc3)[C@H]2C)ccc1OC(F)F ZINC000467444984 881247968 /nfs/dbraw/zinc/24/79/68/881247968.db2.gz YBZIHCWTAGPHRR-MPGHIAIKSA-N 0 3 404.457 4.137 20 0 HIADHN CCc1nc2ccccc2n1C1CCN(Cc2cc(-c3cnn(C)c3C)no2)CC1 ZINC000467449198 881251838 /nfs/dbraw/zinc/25/18/38/881251838.db2.gz ILAJJODQLNLUER-UHFFFAOYSA-N 0 3 404.518 4.133 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)Nc2cccc(-c3noc(C4CC4)n3)c2)CN1Cc1ccccc1 ZINC000467455680 881262359 /nfs/dbraw/zinc/26/23/59/881262359.db2.gz DALKRHCMWOFILB-IERDGZPVSA-N 0 3 417.513 4.399 20 0 HIADHN CC(C)(C)c1ccc(CCC(=O)NCc2ccccc2CN2CCC(O)CC2)cc1 ZINC000467491739 881309060 /nfs/dbraw/zinc/30/90/60/881309060.db2.gz AVTQMXPVRUPYEB-UHFFFAOYSA-N 0 3 408.586 4.190 20 0 HIADHN Cc1ccc(SCCC(=O)NCc2ccccc2CN2CCC(O)CC2)cc1C ZINC000467493310 881310563 /nfs/dbraw/zinc/31/05/63/881310563.db2.gz GHGFDKPZHCBBPS-UHFFFAOYSA-N 0 3 412.599 4.059 20 0 HIADHN COc1ccc2c(c1)[C@H](N[C@H]1CCCN(Cc3ccc(F)cc3F)C1=O)CCC2 ZINC000469113353 883204389 /nfs/dbraw/zinc/20/43/89/883204389.db2.gz VOHNTRBFKXSSRL-YADHBBJMSA-N 0 3 400.469 4.132 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)NCC3(c4cc(C(F)(F)F)ccc4Cl)CC3)[C@@H]2C1 ZINC000469181286 883281018 /nfs/dbraw/zinc/28/10/18/883281018.db2.gz GBLDYKFQRAWINQ-SUMWQHHRSA-N 0 3 415.887 4.126 20 0 HIADHN CCCc1noc2nc(CC)cc(C(=O)N(Cc3ccco3)C3CCN(C)CC3)c12 ZINC000503599658 912689891 /nfs/dbraw/zinc/68/98/91/912689891.db2.gz PBKONSBNNTYQHT-UHFFFAOYSA-N 0 3 410.518 4.067 20 0 HIADHN O=C1[C@H](NCc2cccc(-c3cccnc3)c2)CCCN1Cc1ccc(F)cc1F ZINC000469213686 883312458 /nfs/dbraw/zinc/31/24/58/883312458.db2.gz MZLCHEMLDABVCU-HSZRJFAPSA-N 0 3 407.464 4.308 20 0 HIADHN CCOC(=O)[C@@](C)(CN[C@H](C)C(=O)Nc1ccc(C)cc1Cl)c1ccccc1 ZINC000469256040 883353097 /nfs/dbraw/zinc/35/30/97/883353097.db2.gz OGBLGAILLASSGX-ZHRRBRCNSA-N 0 3 402.922 4.086 20 0 HIADHN CCOC(=O)[C@](C)(CN[C@H](C)C(=O)Nc1ccc(C)cc1Cl)c1ccccc1 ZINC000469256039 883353597 /nfs/dbraw/zinc/35/35/97/883353597.db2.gz OGBLGAILLASSGX-OPAMFIHVSA-N 0 3 402.922 4.086 20 0 HIADHN CO[C@H](CCN[C@H](c1ccc(C)cc1)c1cccc(S(C)(=O)=O)c1)C(F)(F)F ZINC000469314164 883414814 /nfs/dbraw/zinc/41/48/14/883414814.db2.gz FDDICKBXUQYYCO-RTBURBONSA-N 0 3 415.477 4.045 20 0 HIADHN CCSCc1ccccc1C(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000469320097 883426214 /nfs/dbraw/zinc/42/62/14/883426214.db2.gz ZUKSIKHATJUQRC-RTBURBONSA-N 0 3 404.620 4.291 20 0 HIADHN C[C@@H](C(=O)N1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1)N1CCCCCC1 ZINC000469394533 883551018 /nfs/dbraw/zinc/55/10/18/883551018.db2.gz AQSFLMWWMODNLC-WMZOPIPTSA-N 0 3 416.953 4.361 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)N[C@H](C)c1ccc2c(c1)CCC(=O)N2 ZINC000469423645 883603063 /nfs/dbraw/zinc/60/30/63/883603063.db2.gz CNFBTANFPLTPDA-JPYJTQIMSA-N 0 3 422.573 4.088 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)NCc1ccccc1-c1cnn(C)c1 ZINC000469434737 883621854 /nfs/dbraw/zinc/62/18/54/883621854.db2.gz SPTWHMVEMNDYQT-DEOSSOPVSA-N 0 3 419.573 4.043 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)N[C@@H]1CCO[C@H](c2ccccc2)C1 ZINC000469439551 883630430 /nfs/dbraw/zinc/63/04/30/883630430.db2.gz XXFULBWNZBBYCC-SGNDLWITSA-N 0 3 409.574 4.363 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)Nc1cccc(NC(=O)C2CC2)c1 ZINC000469448173 883647313 /nfs/dbraw/zinc/64/73/13/883647313.db2.gz LTDRGXULERVADW-QFIPXVFZSA-N 0 3 408.546 4.313 20 0 HIADHN Cc1cc(N2CCOCC2)ccc1NC(=O)N[C@H](CN(C)Cc1ccccc1)C(C)C ZINC000469451489 883653515 /nfs/dbraw/zinc/65/35/15/883653515.db2.gz BVJOQCPQQIZWFO-XMMPIXPASA-N 0 3 424.589 4.110 20 0 HIADHN O=C(NCc1cccc2cc[nH]c21)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000469464241 883678462 /nfs/dbraw/zinc/67/84/62/883678462.db2.gz GQBNOTDFTRWKKL-NRFANRHFSA-N 0 3 401.432 4.239 20 0 HIADHN CC(C)NC(=O)Cc1ccc(NC(=O)N[C@@H](CN(C)Cc2ccccc2)C(C)C)cc1 ZINC000469467908 883690932 /nfs/dbraw/zinc/69/09/32/883690932.db2.gz CEGWWCRBPLNCHS-QHCPKHFHSA-N 0 3 424.589 4.032 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)Cc1csc(-c2ccccn2)n1 ZINC000469501395 883745365 /nfs/dbraw/zinc/74/53/65/883745365.db2.gz JUDKJFZATDFFHD-NRFANRHFSA-N 0 3 408.571 4.020 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)CCc1nnc(-c2ccsc2)o1 ZINC000469505617 883755405 /nfs/dbraw/zinc/75/54/05/883755405.db2.gz VWUSYQPVSMVRAX-IBGZPJMESA-N 0 3 412.559 4.004 20 0 HIADHN COc1ccc(CCN(Cc2cc(-c3cnn(C)c3)no2)Cc2ccccc2)cc1 ZINC000469512793 883771859 /nfs/dbraw/zinc/77/18/59/883771859.db2.gz WQKZQTSFBKQMDU-UHFFFAOYSA-N 0 3 402.498 4.329 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N(Cc3ccccc3)CC(F)F)c(C)c2)CC1 ZINC000469517511 883780040 /nfs/dbraw/zinc/78/00/40/883780040.db2.gz QOVAWGCTAXJTFV-UHFFFAOYSA-N 0 3 416.516 4.436 20 0 HIADHN CN(C)[C@H](CNCc1ccc(Br)cn1)c1cccc(C(F)(F)F)c1 ZINC000469564420 883815717 /nfs/dbraw/zinc/81/57/17/883815717.db2.gz YLIHRKLMABLIRE-MRXNPFEDSA-N 0 3 402.258 4.255 20 0 HIADHN CC(=O)Nc1ccc(C(=O)N2CCN(Cc3ccccc3)C3(CCCCC3)C2)cc1F ZINC000469576457 883819818 /nfs/dbraw/zinc/81/98/18/883819818.db2.gz LRGLVBJBIPZODQ-UHFFFAOYSA-N 0 3 423.532 4.445 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)Nc1ccc(O[C@H]2CCOC2)cc1 ZINC000469648676 883848159 /nfs/dbraw/zinc/84/81/59/883848159.db2.gz CRKFPDQQTQBFHC-GOTSBHOMSA-N 0 3 411.546 4.132 20 0 HIADHN CCCn1c(C(=O)N(C)C[C@@H]2CCCN(CC)[C@H]2c2cnn(C)c2)cc2ccccc21 ZINC000469685195 883869579 /nfs/dbraw/zinc/86/95/79/883869579.db2.gz UFMMBIGPICUADD-GBXCKJPGSA-N 0 3 421.589 4.330 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)N1CCC(c2nc(C(F)(F)F)c[nH]2)CC1 ZINC000469718988 883885366 /nfs/dbraw/zinc/88/53/66/883885366.db2.gz XECUDGGQVOIJNZ-UHFFFAOYSA-N 0 3 420.435 4.256 20 0 HIADHN COc1cc(Br)ccc1[C@@H](C)NC[C@H](O)COc1cccc2[nH]ccc21 ZINC000469751335 883912185 /nfs/dbraw/zinc/91/21/85/883912185.db2.gz INOWYSSTXQOBQN-HIFRSBDPSA-N 0 3 419.319 4.030 20 0 HIADHN CC(C)c1nc([C@@H](C)NCC2CCN(S(=O)(=O)c3ccccc3)CC2)cs1 ZINC000469781628 883957400 /nfs/dbraw/zinc/95/74/00/883957400.db2.gz WGLMSNDQKUPFDH-MRXNPFEDSA-N 0 3 407.605 4.018 20 0 HIADHN Cc1ccc(NC(=O)CCN2CCN(c3ccccc3)CC2)cc1NC(=O)C(C)(C)C ZINC000469960239 884165821 /nfs/dbraw/zinc/16/58/21/884165821.db2.gz WHBPKHGBKJALRU-UHFFFAOYSA-N 0 3 422.573 4.130 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1)c1ccccc1-n1cccn1 ZINC000470034345 884269132 /nfs/dbraw/zinc/26/91/32/884269132.db2.gz PBGYOZFDAHCZLI-IRFCIJBXSA-N 0 3 403.530 4.068 20 0 HIADHN C[C@H](NC(=O)N[C@H](CN1CCCC1)c1ccccc1)c1ccccc1-n1cccn1 ZINC000470063205 884316262 /nfs/dbraw/zinc/31/62/62/884316262.db2.gz VWAWRWHUXOMLLT-SIKLNZKXSA-N 0 3 403.530 4.070 20 0 HIADHN COCCN1CCC(NC(=O)N2CCCC[C@H]2c2cccc(C(F)(F)F)c2)CC1 ZINC000470064479 884317094 /nfs/dbraw/zinc/31/70/94/884317094.db2.gz DWTSQMVCNWXJTA-IBGZPJMESA-N 0 3 413.484 4.053 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)[C@@H]3SCCc4sccc43)c2)CC1 ZINC000503747640 912814875 /nfs/dbraw/zinc/81/48/75/912814875.db2.gz LUGXMSYETYIVKV-HXUWFJFHSA-N 0 3 401.601 4.248 20 0 HIADHN Cc1ccccc1C1(C(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)CCOCC1 ZINC000503754113 912816507 /nfs/dbraw/zinc/81/65/07/912816507.db2.gz YILUMYLVFHWRKS-UHFFFAOYSA-N 0 3 421.585 4.212 20 0 HIADHN CN(C)c1cccc(CNCc2cc(Br)cc(Br)c2N)c1 ZINC000470161122 884436196 /nfs/dbraw/zinc/43/61/96/884436196.db2.gz MIQWHODSRIEFRP-UHFFFAOYSA-N 0 3 413.157 4.150 20 0 HIADHN O=C(CCc1nc2cc(Br)ccc2s1)NC[C@@H]1CCCCN1C1CC1 ZINC000470177535 884458969 /nfs/dbraw/zinc/45/89/69/884458969.db2.gz CWAAMBNQWODIKQ-HNNXBMFYSA-N 0 3 422.392 4.125 20 0 HIADHN C[C@@H](CCNC(=O)CC1(N2CCOCC2)CCCC1)c1cccc(C(F)(F)F)c1 ZINC000470224465 884551442 /nfs/dbraw/zinc/55/14/42/884551442.db2.gz RZMLAXFBFMPEJM-KRWDZBQOSA-N 0 3 412.496 4.350 20 0 HIADHN CC(C)(C)OC(=O)CCCNCc1cc(Br)cc(Br)c1N ZINC000470246503 884578878 /nfs/dbraw/zinc/57/88/78/884578878.db2.gz GHOXIGBNCXTMBX-UHFFFAOYSA-N 0 3 422.161 4.005 20 0 HIADHN O=C(CN[C@@H]1CCCc2cc(Br)ccc21)N[C@@H]1CCOc2ccccc21 ZINC000503852912 912840759 /nfs/dbraw/zinc/84/07/59/912840759.db2.gz BBGXUQPDYSJOHL-RTBURBONSA-N 0 3 415.331 4.056 20 0 HIADHN CC(C)[C@@H](CNC(=O)Nc1ccccc1O[C@H]1CCOC1)N1CCc2ccccc2C1 ZINC000470261409 884605237 /nfs/dbraw/zinc/60/52/37/884605237.db2.gz PTBMSVXOPDIMGL-JTHBVZDNSA-N 0 3 423.557 4.059 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2ccccc2O[C@@H]2CCOC2)N2CCCC2)cc1 ZINC000470261850 884606720 /nfs/dbraw/zinc/60/67/20/884606720.db2.gz WMVMVUKEVZOIBR-IFMALSPDSA-N 0 3 409.530 4.121 20 0 HIADHN CC1(C)CCCN(CCNC(=O)c2ccc(Br)cc2C(F)(F)F)C1 ZINC000470280358 884642846 /nfs/dbraw/zinc/64/28/46/884642846.db2.gz OJFWJXHLGBMDGX-UHFFFAOYSA-N 0 3 407.274 4.320 20 0 HIADHN CCN(C(=O)c1cc(OC)c(OC)cc1F)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000470341317 884728769 /nfs/dbraw/zinc/72/87/69/884728769.db2.gz ZOAHJVNUCRVMFA-SJLPKXTDSA-N 0 3 400.494 4.141 20 0 HIADHN C[C@H](CO)N1CCCN(C(=O)Nc2cccc(CSC3CCCCC3)c2)CC1 ZINC000470366837 884762253 /nfs/dbraw/zinc/76/22/53/884762253.db2.gz HYFBPYXZGVMCJH-GOSISDBHSA-N 0 3 405.608 4.173 20 0 HIADHN O=C(CN[C@H]1CCCc2ccc(Br)cc21)N[C@H]1CCOc2ccccc21 ZINC000503907469 912860470 /nfs/dbraw/zinc/86/04/70/912860470.db2.gz DPDKHEPNNULLHQ-OALUTQOASA-N 0 3 415.331 4.056 20 0 HIADHN O=C(CN[C@@H]1CCCc2ccc(Br)cc21)N[C@H]1CCOc2ccccc21 ZINC000503907466 912860575 /nfs/dbraw/zinc/86/05/75/912860575.db2.gz DPDKHEPNNULLHQ-MOPGFXCFSA-N 0 3 415.331 4.056 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)NCCF)c1ccc(Oc2ccc(Br)cc2)cc1 ZINC000503920823 912865202 /nfs/dbraw/zinc/86/52/02/912865202.db2.gz PLPDCNGQXVZODW-KGLIPLIRSA-N 0 3 409.299 4.366 20 0 HIADHN CCCN1CCC[C@@H]1C(=O)N1CCC[C@@H](c2nc(-c3ccccc3OC)cs2)C1 ZINC000470417762 884820936 /nfs/dbraw/zinc/82/09/36/884820936.db2.gz HUAFZZHTZSJGLE-YLJYHZDGSA-N 0 3 413.587 4.399 20 0 HIADHN CC(C)[C@H](NC(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1)C(F)(F)F ZINC000470453085 884848967 /nfs/dbraw/zinc/84/89/67/884848967.db2.gz UACHPMCTPUOFDJ-HNNXBMFYSA-N 0 3 413.406 4.366 20 0 HIADHN C[C@@H]1CN(C2CCOCC2)CCN1C(=O)C[C@@H](Cc1ccccc1)c1ccccc1 ZINC000470480429 884869040 /nfs/dbraw/zinc/86/90/40/884869040.db2.gz UBLVUFNFCVJAGQ-ZJSXRUAMSA-N 0 3 406.570 4.115 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)N[C@@H](C)c2ccc(-c3ccncc3)cc2)o1 ZINC000470487134 884874760 /nfs/dbraw/zinc/87/47/60/884874760.db2.gz PCBWAEDZCWXQEP-IBGZPJMESA-N 0 3 406.530 4.484 20 0 HIADHN C[C@H](NC(=O)NCC1(N2CCSCC2)CCCC1)c1ccc(-c2ccncc2)cc1 ZINC000470487791 884875254 /nfs/dbraw/zinc/87/52/54/884875254.db2.gz QZECRAPMOSOLSS-IBGZPJMESA-N 0 3 424.614 4.470 20 0 HIADHN CCc1ccccc1NC(=O)C[C@@H](C)N[C@@H](Cn1ccccc1=O)c1ccccc1 ZINC000503937329 912873136 /nfs/dbraw/zinc/87/31/36/912873136.db2.gz MIJDBIWOTQISCG-XXBNENTESA-N 0 3 403.526 4.159 20 0 HIADHN C[C@@H]1C[C@@H]1C(=O)Nc1ccc(C(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000470654551 885076068 /nfs/dbraw/zinc/07/60/68/885076068.db2.gz UIBAOPLMMWIIMP-LEOXJPRUSA-N 0 3 405.542 4.018 20 0 HIADHN CN(C(=O)CCCc1nc(-c2cccs2)no1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470660868 885086241 /nfs/dbraw/zinc/08/62/41/885086241.db2.gz JUKKJEQTEPNDOT-IBGZPJMESA-N 0 3 424.570 4.244 20 0 HIADHN Cc1cc(C(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)c(C)n1Cc1ccccn1 ZINC000470665691 885092292 /nfs/dbraw/zinc/09/22/92/885092292.db2.gz GCQGHJBFKMXVNS-XMMPIXPASA-N 0 3 416.569 4.285 20 0 HIADHN Cc1cc(C)n(-c2ccc(C(=O)N(C)[C@@H]3CCCN(Cc4ccccc4)C3)cc2F)n1 ZINC000470666633 885094893 /nfs/dbraw/zinc/09/48/93/885094893.db2.gz HJEBBMDDHJGOMJ-JOCHJYFZSA-N 0 3 420.532 4.365 20 0 HIADHN CN(C(=O)Cc1cccc(Br)c1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470675825 885107583 /nfs/dbraw/zinc/10/75/83/885107583.db2.gz UTKIPLYWJXSLCG-HXUWFJFHSA-N 0 3 401.348 4.115 20 0 HIADHN CN(C(=O)c1ccc(OCc2ccccn2)cc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470676657 885108586 /nfs/dbraw/zinc/10/85/86/885108586.db2.gz AGRXFBUGHLJWHJ-XMMPIXPASA-N 0 3 415.537 4.397 20 0 HIADHN CC(C)N1CCC[C@@H](NC(=O)c2ccc(Cl)c(NC(=O)c3cccs3)c2)C1 ZINC000470677935 885108743 /nfs/dbraw/zinc/10/87/43/885108743.db2.gz HPSRSWUNJMNTGM-OAHLLOKOSA-N 0 3 405.951 4.256 20 0 HIADHN CN(C(=O)NCCCCOCc1ccccc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470720325 885164305 /nfs/dbraw/zinc/16/43/05/885164305.db2.gz SPEDWKZHHFUUPZ-XMMPIXPASA-N 0 3 409.574 4.289 20 0 HIADHN COc1ccc(CC[C@H](C)NC(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000470725671 885175311 /nfs/dbraw/zinc/17/53/11/885175311.db2.gz IBNRUBKXHLXJQR-REWPJTCUSA-N 0 3 409.574 4.322 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N(C)Cc2nc(C(F)(F)F)cs2)N(C)C)cc1 ZINC000470741001 885203372 /nfs/dbraw/zinc/20/33/72/885203372.db2.gz RYNGHEHUPHUDPU-HNNXBMFYSA-N 0 3 414.497 4.169 20 0 HIADHN CN(Cc1ccccc1OCC(F)(F)F)C[C@@H]1C[C@H](F)CN1Cc1nccs1 ZINC000470802789 885290130 /nfs/dbraw/zinc/29/01/30/885290130.db2.gz BVEFZIZOAUHDET-HOTGVXAUSA-N 0 3 417.472 4.129 20 0 HIADHN CN(C(=O)c1cn(C)nc1-c1ccccc1Cl)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470824483 885312984 /nfs/dbraw/zinc/31/29/84/885312984.db2.gz HEDBKWUVZWGCDL-IBGZPJMESA-N 0 3 422.960 4.477 20 0 HIADHN CN(C)Cc1cnc(CN[C@@H](c2cccc(C(F)(F)F)c2)C2CCOCC2)s1 ZINC000512375154 921114071 /nfs/dbraw/zinc/11/40/71/921114071.db2.gz NAEAXVYQRMCBID-LJQANCHMSA-N 0 3 413.509 4.481 20 0 HIADHN CN(C(=O)NCc1ccccc1OC1CCC1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470882492 885375265 /nfs/dbraw/zinc/37/52/65/885375265.db2.gz DQHVYUYNMGUCHC-QFIPXVFZSA-N 0 3 407.558 4.424 20 0 HIADHN C[C@H](Oc1cnc2ccccc2c1)C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000470897544 885397340 /nfs/dbraw/zinc/39/73/40/885397340.db2.gz NEWUVMRWYIVENR-SFHVURJKSA-N 0 3 421.566 4.232 20 0 HIADHN CSc1ccc(F)cc1CNC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470898813 885399829 /nfs/dbraw/zinc/39/98/29/885399829.db2.gz FJXSFQPDOGXYPC-FQEVSTJZSA-N 0 3 401.551 4.354 20 0 HIADHN Cc1nc2c(cccc2C(=O)N(CCN(C)C)Cc2ccc(Br)cc2)o1 ZINC000470933813 885436165 /nfs/dbraw/zinc/43/61/65/885436165.db2.gz SONRPVIFGGRUQB-UHFFFAOYSA-N 0 3 416.319 4.103 20 0 HIADHN Cn1nc(C(F)F)c2cc(C(=O)NC[C@H]3CCCN(C)[C@H]3c3cccs3)sc21 ZINC000470996064 885496510 /nfs/dbraw/zinc/49/65/10/885496510.db2.gz VCTZJFHUDVSUFW-BDJLRTHQSA-N 0 3 424.542 4.447 20 0 HIADHN CN(C(=O)CN1CCN(C)CC12CCCCC2)[C@@H](c1ccccc1)c1ccc(F)cc1 ZINC000471036527 885545602 /nfs/dbraw/zinc/54/56/02/885545602.db2.gz BMALDHQHTNARGT-VWLOTQADSA-N 0 3 423.576 4.324 20 0 HIADHN Cc1ccc([C@H](NC(=O)CN2CCN(C)CC23CCCCC3)c2cccs2)cc1 ZINC000471037735 885546764 /nfs/dbraw/zinc/54/67/64/885546764.db2.gz GXPCMRHDCAHDTB-QHCPKHFHSA-N 0 3 411.615 4.212 20 0 HIADHN C[C@@H](NC(=O)C1(c2ccccc2Cl)CCOCC1)[C@@H](c1ccccc1)N(C)C ZINC000471127471 885664593 /nfs/dbraw/zinc/66/45/93/885664593.db2.gz NOTBTQXJYKAWRN-UTKZUKDTSA-N 0 3 400.950 4.196 20 0 HIADHN Cc1cc(CSc2ncccc2C(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)no1 ZINC000471139426 885681003 /nfs/dbraw/zinc/68/10/03/885681003.db2.gz HDPZJWLLIBRQBU-OXJNMPFZSA-N 0 3 410.543 4.092 20 0 HIADHN O=C(NC[C@H]1CN(Cc2ccccc2)CCCO1)c1cc(F)ccc1-c1ccoc1 ZINC000471164752 885719821 /nfs/dbraw/zinc/71/98/21/885719821.db2.gz IULNROXOTKZEJV-NRFANRHFSA-N 0 3 408.473 4.107 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)Cc3c[nH]c4ccccc34)c(OCC)c2)CC1 ZINC000471171098 885729648 /nfs/dbraw/zinc/72/96/48/885729648.db2.gz YXJUPYHGDPWKBT-UHFFFAOYSA-N 0 3 420.557 4.280 20 0 HIADHN COc1ccc(Cl)c(NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)c1 ZINC000471242684 885820057 /nfs/dbraw/zinc/82/00/57/885820057.db2.gz HVUNSLFRZROMDE-UHFFFAOYSA-N 0 3 405.848 4.275 20 0 HIADHN O=C(NCc1ccc2ncccc2c1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000471246908 885824999 /nfs/dbraw/zinc/82/49/99/885824999.db2.gz XITIBOPKBSNPGU-UHFFFAOYSA-N 0 3 406.555 4.148 20 0 HIADHN C[C@@H](NC(=O)CCN1CCc2ccccc2C1)c1noc(-c2ccc(Cl)cc2)n1 ZINC000471346616 885957480 /nfs/dbraw/zinc/95/74/80/885957480.db2.gz NZAVFVBQGPXWQV-OAHLLOKOSA-N 0 3 410.905 4.016 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)Nc1ccc(Oc2ccc(F)cc2)nc1 ZINC000504085779 912992584 /nfs/dbraw/zinc/99/25/84/912992584.db2.gz QQSYRKOERAMZFH-UHFFFAOYSA-N 0 3 409.465 4.004 20 0 HIADHN C[C@H]1[C@@H](NC(=O)N[C@H]2C[C@@H]2c2ccccc2OC(F)F)CCN1Cc1ccccc1 ZINC000504103813 913013663 /nfs/dbraw/zinc/01/36/63/913013663.db2.gz MTPOLWAODZDSOX-LDTOTXGLSA-N 0 3 415.484 4.106 20 0 HIADHN O=C(NCc1cccc(C(F)(F)F)c1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000471483224 886180555 /nfs/dbraw/zinc/18/05/55/886180555.db2.gz AKEZAXBCJOLFEH-UHFFFAOYSA-N 0 3 423.401 4.310 20 0 HIADHN CC(=O)Nc1cc(C(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)cc(C(F)(F)F)c1 ZINC000471528747 886232639 /nfs/dbraw/zinc/23/26/39/886232639.db2.gz GILQRNALZDWGNU-BFUOFWGJSA-N 0 3 407.436 4.085 20 0 HIADHN COc1cc(F)c(NC(=O)N2CCCN(CCCc3ccccc3)CC2)cc1OC ZINC000504115220 913022003 /nfs/dbraw/zinc/02/20/03/913022003.db2.gz PHLDGTDCXOGHIU-UHFFFAOYSA-N 0 3 415.509 4.015 20 0 HIADHN C[C@@H](NC(=O)c1cccc(NC(=O)c2ccc(F)cc2)c1)[C@H](c1ccccc1)N(C)C ZINC000471538217 886242733 /nfs/dbraw/zinc/24/27/33/886242733.db2.gz HYRMSORBHIHBLN-UZUQRXQVSA-N 0 3 419.500 4.499 20 0 HIADHN CC[C@H](NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1ccc(OC)cc1 ZINC000471544677 886251330 /nfs/dbraw/zinc/25/13/30/886251330.db2.gz CBBSHWWIDDVDQD-TVPLGVNVSA-N 0 3 413.484 4.251 20 0 HIADHN C[C@@H](NC(=O)c1ccc(CNC(=O)c2cccs2)cc1)[C@@H](c1ccccc1)N(C)C ZINC000471547550 886254974 /nfs/dbraw/zinc/25/49/74/886254974.db2.gz NXHPNUZZHMMUOL-VGSWGCGISA-N 0 3 421.566 4.099 20 0 HIADHN C[C@H](NC(=O)c1ccc(NC(=O)c2ccccc2)cc1)[C@@H](c1ccccc1)N(C)C ZINC000471575168 886285901 /nfs/dbraw/zinc/28/59/01/886285901.db2.gz VYSZUIKHIKHRII-MBSDFSHPSA-N 0 3 401.510 4.360 20 0 HIADHN Cc1noc(CSc2ccc(C(=O)N[C@H](C)[C@H](c3ccccc3)N(C)C)cc2)n1 ZINC000471576927 886289658 /nfs/dbraw/zinc/28/96/58/886289658.db2.gz GFTKCAVLEFVJPY-QVKFZJNVSA-N 0 3 410.543 4.092 20 0 HIADHN C[C@H](CCCCN1C(=O)c2ccccc2C1=O)NCc1nnc(-c2ccccc2)s1 ZINC000471596129 886307935 /nfs/dbraw/zinc/30/79/35/886307935.db2.gz XAOBRCHGBLVIFG-MRXNPFEDSA-N 0 3 420.538 4.150 20 0 HIADHN C[C@H](CCCCN1C(=O)c2ccccc2C1=O)NCc1ncoc1-c1ccccc1 ZINC000471599288 886312133 /nfs/dbraw/zinc/31/21/33/886312133.db2.gz QFEFOTLSAMXSLX-QGZVFWFLSA-N 0 3 403.482 4.286 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)c3cnn(-c4ccccc4)c3C3CC3)c2)CC1 ZINC000471653326 886368461 /nfs/dbraw/zinc/36/84/61/886368461.db2.gz NWKGIYPDQQMAAX-UHFFFAOYSA-N 0 3 415.541 4.144 20 0 HIADHN Cc1cc(C)c(CCNC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)c(C)c1 ZINC000471661539 886375400 /nfs/dbraw/zinc/37/54/00/886375400.db2.gz DUONCBVAFOSFDL-UHFFFAOYSA-N 0 3 411.512 4.259 20 0 HIADHN CC(C)(C)OCc1cc(C(=O)N[C@H](CN2CCc3ccccc3C2)C(C)(C)C)no1 ZINC000471747765 886475207 /nfs/dbraw/zinc/47/52/07/886475207.db2.gz NAOGZJIWNFTVTB-OAQYLSRUSA-N 0 3 413.562 4.193 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cc2c(C(F)F)nn(C)c2s1)c1ccsc1 ZINC000471749269 886476906 /nfs/dbraw/zinc/47/69/06/886476906.db2.gz QXSBXUJYCDWQID-CYBMUJFWSA-N 0 3 412.531 4.447 20 0 HIADHN CC(C)(C)c1csc(CNC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)n1 ZINC000471815067 886557230 /nfs/dbraw/zinc/55/72/30/886557230.db2.gz GVQAQEZIIHHASL-UHFFFAOYSA-N 0 3 418.529 4.045 20 0 HIADHN CC(C)(CNC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1ccc(F)cc1 ZINC000471815980 886557364 /nfs/dbraw/zinc/55/73/64/886557364.db2.gz LTPFQFSBVIFVKO-UHFFFAOYSA-N 0 3 415.475 4.208 20 0 HIADHN Cc1cccc2[nH]cc(CCNC(=O)NC3CC(N4CCC(C(F)(F)F)CC4)C3)c21 ZINC000471824355 886571774 /nfs/dbraw/zinc/57/17/74/886571774.db2.gz RUPKZBCZOKPFTC-UHFFFAOYSA-N 0 3 422.495 4.123 20 0 HIADHN Cc1ccc(C(C)(C)CNC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cc1 ZINC000471825125 886572112 /nfs/dbraw/zinc/57/21/12/886572112.db2.gz SULAJXPMNWXLIQ-UHFFFAOYSA-N 0 3 411.512 4.377 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)c(OC)c1 ZINC000504176148 913059657 /nfs/dbraw/zinc/05/96/57/913059657.db2.gz JREJMJALMITETG-XQFWAAQXSA-N 0 3 423.557 4.386 20 0 HIADHN O=C(NCc1cc(Br)ccc1F)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000504175591 913059764 /nfs/dbraw/zinc/05/97/64/913059764.db2.gz CXMCISOOLYKYQR-SFHVURJKSA-N 0 3 420.326 4.052 20 0 HIADHN CCc1c(C(=O)N(C)C2CCN(Cc3ccccc3)CC2)cnn1-c1ccccc1C ZINC000471840908 886600304 /nfs/dbraw/zinc/60/03/04/886600304.db2.gz VNHCYUZWTKDXIW-UHFFFAOYSA-N 0 3 416.569 4.480 20 0 HIADHN COc1cc(F)c(NC(=O)NC[C@H](C(C)C)N2CCc3ccccc3C2)cc1OC ZINC000504178051 913061274 /nfs/dbraw/zinc/06/12/74/913061274.db2.gz MOXCXRPKOXJGSA-HXUWFJFHSA-N 0 3 415.509 4.047 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2ccc3nc(-c4ccccn4)oc3c2)[C@@H]1c1ccccc1 ZINC000471924194 886714488 /nfs/dbraw/zinc/71/44/88/886714488.db2.gz LZEYVZJEVXPZTQ-KNQAVFIVSA-N 0 3 413.481 4.457 20 0 HIADHN Cc1cc(-c2nc(C3CC3)no2)ccc1NC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000471925378 886716831 /nfs/dbraw/zinc/71/68/31/886716831.db2.gz RVOZBZVTKQDVGB-SFTDATJTSA-N 0 3 417.513 4.489 20 0 HIADHN COc1cc(Br)cc(NC(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)c1 ZINC000471933486 886728358 /nfs/dbraw/zinc/72/83/58/886728358.db2.gz KKEXDRUBSYEBHR-QZTJIDSGSA-N 0 3 404.308 4.025 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2cc(F)c(Br)cc2F)[C@@H]1c1ccccc1 ZINC000471933514 886729022 /nfs/dbraw/zinc/72/90/22/886729022.db2.gz SOPXQEVCYYHMMU-RDJZCZTQSA-N 0 3 410.262 4.294 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2c(F)cc(Br)cc2F)[C@@H]1c1ccccc1 ZINC000471978054 886807769 /nfs/dbraw/zinc/80/77/69/886807769.db2.gz KEUYZUYFLPFKBY-WBVHZDCISA-N 0 3 410.262 4.294 20 0 HIADHN COc1cc(NC(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)ccc1Br ZINC000471983304 886810807 /nfs/dbraw/zinc/81/08/07/886810807.db2.gz HXHBVZCSJVEGEN-AEFFLSMTSA-N 0 3 404.308 4.025 20 0 HIADHN CCO[C@H]1C[C@H](NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)C1(CC)CC ZINC000471989786 886816543 /nfs/dbraw/zinc/81/65/43/886816543.db2.gz BYRPQWNWELFLDH-FOIPXRHGSA-N 0 3 419.532 4.075 20 0 HIADHN C[C@@H]1CCc2ccccc2[C@@H]1NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472132708 886924391 /nfs/dbraw/zinc/92/43/91/886924391.db2.gz OSDITBLNGBLHJP-ASIFFCQLSA-N 0 3 409.496 4.415 20 0 HIADHN C[C@H]1CCc2ccccc2[C@@H]1NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472132710 886925174 /nfs/dbraw/zinc/92/51/74/886925174.db2.gz OSDITBLNGBLHJP-XQFDRNNISA-N 0 3 409.496 4.415 20 0 HIADHN C[C@H](CCCCN1C(=O)c2ccccc2C1=O)NCc1nc(C(F)(F)F)cs1 ZINC000472140214 886935495 /nfs/dbraw/zinc/93/54/95/886935495.db2.gz MNXKEADXYNDKHK-GFCCVEGCSA-N 0 3 411.449 4.107 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)CCSCc3ccccc3)CC2)C[C@@H](C)O1 ZINC000472260915 887072710 /nfs/dbraw/zinc/07/27/10/887072710.db2.gz RPWVMVAMLOTKME-WOJBJXKFSA-N 0 3 404.620 4.048 20 0 HIADHN COc1ccc(NC(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)cc1Br ZINC000472319770 887152079 /nfs/dbraw/zinc/15/20/79/887152079.db2.gz MUPVHRVTRCQSAQ-FUHWJXTLSA-N 0 3 404.308 4.025 20 0 HIADHN Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000472328847 887163068 /nfs/dbraw/zinc/16/30/68/887163068.db2.gz OXDUPPYNDNNDOM-GOTSBHOMSA-N 0 3 420.557 4.234 20 0 HIADHN Cc1cc(Oc2ncccn2)ccc1NC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000472329494 887164831 /nfs/dbraw/zinc/16/48/31/887164831.db2.gz QOTNFRHOYIXVCJ-RTWAWAEBSA-N 0 3 403.486 4.144 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2cccc(C[S@@](=O)C(C)(C)C)c2)[C@@H]1c1ccccc1 ZINC000472345410 887180611 /nfs/dbraw/zinc/18/06/11/887180611.db2.gz XDYWQJXCXODNAD-LRZFZUCMSA-N 0 3 413.587 4.301 20 0 HIADHN Cc1cc2c(cc1C)[C@H](C(=O)Nc1ccnn1[C@H]1CCN(Cc3ccccc3)C1)CO2 ZINC000472353531 887188025 /nfs/dbraw/zinc/18/80/25/887188025.db2.gz RZWNJNOIXQWOFF-RBBKRZOGSA-N 0 3 416.525 4.062 20 0 HIADHN Cc1ccc([C@@]2(C)CCN(C(=O)NC3CC(N4CCC(C(F)(F)F)CC4)C3)C2)cc1 ZINC000472455343 887308761 /nfs/dbraw/zinc/30/87/61/887308761.db2.gz UJLDWLFEAYNYSD-AOMIVXANSA-N 0 3 423.523 4.473 20 0 HIADHN C[C@H]1[C@@H](Cc2ccccc2)CCN1C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472456828 887311456 /nfs/dbraw/zinc/31/14/56/887311456.db2.gz PICBEBWNIAIYII-QVKFIVLNSA-N 0 3 423.523 4.454 20 0 HIADHN CCN(CCc1cccs1)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472457951 887312745 /nfs/dbraw/zinc/31/27/45/887312745.db2.gz UCTURVTVEHFRJY-UHFFFAOYSA-N 0 3 403.514 4.127 20 0 HIADHN C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472457030 887313244 /nfs/dbraw/zinc/31/32/44/887313244.db2.gz UEBYWBSFYSRKMO-GALLPEHLSA-N 0 3 415.422 4.164 20 0 HIADHN CCS[C@@H]1CC[C@@H](N(C)C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)C1 ZINC000472461015 887318360 /nfs/dbraw/zinc/31/83/60/887318360.db2.gz WIMKGIUAFUDINI-MNAZLIDISA-N 0 3 407.546 4.107 20 0 HIADHN CCS[C@@H]1CC[C@H](N(C)C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)C1 ZINC000472461018 887318508 /nfs/dbraw/zinc/31/85/08/887318508.db2.gz WIMKGIUAFUDINI-ODZFXCKXSA-N 0 3 407.546 4.107 20 0 HIADHN COCCC[C@@H](Cc1ccccc1)NC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000472461516 887320313 /nfs/dbraw/zinc/32/03/13/887320313.db2.gz IDHPTWNDVJLWGC-LOSJGSFVSA-N 0 3 423.601 4.330 20 0 HIADHN CC(C)N(Cc1cccs1)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472463699 887322050 /nfs/dbraw/zinc/32/20/50/887322050.db2.gz MGECTDJLYGCGGC-UHFFFAOYSA-N 0 3 403.514 4.473 20 0 HIADHN CN(Cc1csc(-c2ccc(C(N)=O)cc2)n1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000472469127 887329629 /nfs/dbraw/zinc/32/96/29/887329629.db2.gz HMFZRHDBGJDUKT-JOCHJYFZSA-N 0 3 420.582 4.005 20 0 HIADHN C[C@@H](c1c(F)cccc1F)N(C)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472469884 887330972 /nfs/dbraw/zinc/33/09/72/887330972.db2.gz YHRSHRIBXFDWEK-GRTSSRMGSA-N 0 3 419.438 4.473 20 0 HIADHN Cc1ccc([C@@H](NC(=O)N(CCN(C)C)Cc2cccs2)c2ccccn2)cc1 ZINC000472488021 887355280 /nfs/dbraw/zinc/35/52/80/887355280.db2.gz RIXQRRHMJVGXJM-JOCHJYFZSA-N 0 3 408.571 4.314 20 0 HIADHN Cc1ccc(-c2noc([C@H](C)NC(=O)c3oc4ccccc4c3CN(C)C)n2)cc1F ZINC000472550962 887433251 /nfs/dbraw/zinc/43/32/51/887433251.db2.gz XWUBEYUBWAVBFX-AWEZNQCLSA-N 0 3 422.460 4.483 20 0 HIADHN Cc1nn(C)c(=O)c(-c2nc(CN[C@H]3CCC[C@@H]3Cc3ccccc3)cs2)c1C ZINC000472630055 887495294 /nfs/dbraw/zinc/49/52/94/887495294.db2.gz MOXPNMXOIPXSEH-QUCCMNQESA-N 0 3 408.571 4.022 20 0 HIADHN CN(C(=O)Nc1ccc(Cn2cccn2)cc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000472709439 887559583 /nfs/dbraw/zinc/55/95/83/887559583.db2.gz XUOFWYJPIIHGQQ-QHCPKHFHSA-N 0 3 403.530 4.060 20 0 HIADHN CN(C(=O)Nc1ccc(Cn2cccn2)cc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000472709437 887559680 /nfs/dbraw/zinc/55/96/80/887559680.db2.gz XUOFWYJPIIHGQQ-HSZRJFAPSA-N 0 3 403.530 4.060 20 0 HIADHN CCN(CC)C(=O)c1cccc(NC(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000472767480 887613609 /nfs/dbraw/zinc/61/36/09/887613609.db2.gz HRKLWNHHAVDIRF-QHCPKHFHSA-N 0 3 422.573 4.297 20 0 HIADHN COc1cc(NC(=O)N(CCN(C)C)Cc2cccc(C)c2)ccc1Br ZINC000472836423 887686703 /nfs/dbraw/zinc/68/67/03/887686703.db2.gz OTMDKPNMCIUGCE-UHFFFAOYSA-N 0 3 420.351 4.362 20 0 HIADHN Cc1ncsc1CN(C)C[C@@H]1CCN(C(=O)c2cc(F)ccc2-c2ccoc2)C1 ZINC000473018199 887845380 /nfs/dbraw/zinc/84/53/80/887845380.db2.gz YPHLZTMSCLGABB-INIZCTEOSA-N 0 3 413.518 4.445 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)c2ccc(O[C@H](C)c3ccccc3)cc2)CC1 ZINC000473069502 887888720 /nfs/dbraw/zinc/88/87/20/887888720.db2.gz CULXASJUFMGCGF-HXUWFJFHSA-N 0 3 410.558 4.446 20 0 HIADHN COc1ccc([C@H](CNC(=O)C[C@H](c2cccs2)n2cccc2)N2CCCC2)cc1 ZINC000473291109 888044918 /nfs/dbraw/zinc/04/49/18/888044918.db2.gz JRJZHCFYOXNTQO-YADHBBJMSA-N 0 3 423.582 4.491 20 0 HIADHN O=C(CCC(=O)c1ccc2c(c1)CCCC2)NC[C@H]1CCN(Cc2ccccc2)C1 ZINC000473295858 888048180 /nfs/dbraw/zinc/04/81/80/888048180.db2.gz MDAHLDOVUOGKLV-OAQYLSRUSA-N 0 3 404.554 4.167 20 0 HIADHN COc1c(CNC(=O)NC[C@H](c2cccc(OC)c2)N2CCCC2)oc2ccccc21 ZINC000473475160 888198577 /nfs/dbraw/zinc/19/85/77/888198577.db2.gz NDFXYGCTLUDHAV-HXUWFJFHSA-N 0 3 423.513 4.086 20 0 HIADHN C[C@@H](CCN1CCN(C)CC1)NC(=O)Nc1ccc(Oc2ccccc2Cl)cc1 ZINC000473502114 888227212 /nfs/dbraw/zinc/22/72/12/888227212.db2.gz IZXSQLFCNDHSDW-KRWDZBQOSA-N 0 3 416.953 4.280 20 0 HIADHN C[C@H](CSCc1ccccc1)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473513438 888244092 /nfs/dbraw/zinc/24/40/92/888244092.db2.gz NKQCPWCUCRTAOP-VNCLNFNDSA-N 0 3 414.537 4.477 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1cccc([C@H]2CCCOC2)c1 ZINC000473516321 888247515 /nfs/dbraw/zinc/24/75/15/888247515.db2.gz ANRPUQNCYVBKHS-KKXNLOMOSA-N 0 3 410.480 4.116 20 0 HIADHN Cc1ccc(Br)c(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)c1 ZINC000473517595 888248448 /nfs/dbraw/zinc/24/84/48/888248448.db2.gz ITPVNDAZPVFNSJ-UHFFFAOYSA-N 0 3 419.285 4.293 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1ncoc1-c1ccc(F)cc1 ZINC000473519055 888251780 /nfs/dbraw/zinc/25/17/80/888251780.db2.gz LQADOXRKTWZDHF-UHFFFAOYSA-N 0 3 411.399 4.016 20 0 HIADHN Cc1ccc(Cl)c(O[C@@H](C)C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)c1 ZINC000473520280 888253251 /nfs/dbraw/zinc/25/32/51/888253251.db2.gz IQEJBIVWGHCMQJ-JEYLPNPQSA-N 0 3 418.887 4.337 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)C1=Cc2cc(Cl)ccc2OC1 ZINC000473522222 888256480 /nfs/dbraw/zinc/25/64/80/888256480.db2.gz PYUKZGQGTIMMDM-UHFFFAOYSA-N 0 3 414.855 4.037 20 0 HIADHN CC(C)[C@H](C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1ccc(F)cc1 ZINC000473521700 888256906 /nfs/dbraw/zinc/25/69/06/888256906.db2.gz RGXBDCYIIKIPDR-ACBHZAAOSA-N 0 3 400.460 4.487 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1cnc(Cc2ccccc2)s1 ZINC000473527810 888264788 /nfs/dbraw/zinc/26/47/88/888264788.db2.gz SEKROLHYGNJUGH-UHFFFAOYSA-N 0 3 423.504 4.269 20 0 HIADHN C[C@H](CC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1ccc(F)cc1F ZINC000473527765 888264872 /nfs/dbraw/zinc/26/48/72/888264872.db2.gz UFVOCTSQZZGHLQ-UWTIGNOOSA-N 0 3 404.423 4.380 20 0 HIADHN Cc1cc(Cl)ccc1O[C@H](C)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473536859 888275252 /nfs/dbraw/zinc/27/52/52/888275252.db2.gz XSSADUXWNRXUOH-NVPAJSRCSA-N 0 3 418.887 4.337 20 0 HIADHN C[C@H](Oc1ccc(C(F)(F)F)cc1)C(=O)N(Cc1ccco1)C1CCN(C)CC1 ZINC000473620805 888360172 /nfs/dbraw/zinc/36/01/72/888360172.db2.gz UJCQJCLTZVZGBD-HNNXBMFYSA-N 0 3 410.436 4.189 20 0 HIADHN CCOc1cccc2cc([C@H](C)NC(=O)N(CCN(C)C)Cc3ccccn3)oc21 ZINC000504428658 913242195 /nfs/dbraw/zinc/24/21/95/913242195.db2.gz FQVGONYPFABCND-KRWDZBQOSA-N 0 3 410.518 4.061 20 0 HIADHN CN(C)CCN(C[C@H]1CCCO1)C(=O)c1ccc(-c2ccccc2C(F)(F)F)o1 ZINC000473688173 888460510 /nfs/dbraw/zinc/46/05/10/888460510.db2.gz ACFXEUBDGMTJMQ-OAHLLOKOSA-N 0 3 410.436 4.148 20 0 HIADHN Cc1cc(OCc2ccccc2)ccc1NC(=O)NC(C)(C)CCN1CCN(C)CC1 ZINC000473712415 888489157 /nfs/dbraw/zinc/48/91/57/888489157.db2.gz UXUMKCPJYAZUEJ-UHFFFAOYSA-N 0 3 424.589 4.112 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)c3ccc(Cl)cc3C(F)(F)F)CC2)C[C@@H](C)O1 ZINC000473724252 888501583 /nfs/dbraw/zinc/50/15/83/888501583.db2.gz MIOLYGZUFXALDU-ZIAGYGMSSA-N 0 3 418.887 4.320 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CC=C(c4cccc(OC)c4)CC3)c2)CC1 ZINC000473819301 888648875 /nfs/dbraw/zinc/64/88/75/888648875.db2.gz GGMDSBPRJMXYIE-UHFFFAOYSA-N 0 3 420.557 4.158 20 0 HIADHN CCc1nc(C)c([C@H](C)N(C)C(=O)Nc2cccc(N3CCN(CC)CC3)c2)s1 ZINC000473825351 888658397 /nfs/dbraw/zinc/65/83/97/888658397.db2.gz BHHBPJFWDXFKFT-KRWDZBQOSA-N 0 3 415.607 4.381 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@](C)(CC)c3nc(C)cs3)c2)CC1 ZINC000473825920 888658676 /nfs/dbraw/zinc/65/86/76/888658676.db2.gz XGNBDFWYPATLEO-OAQYLSRUSA-N 0 3 401.580 4.040 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CCC[C@@H]3c3cccc(N(C)C)c3)c2)CC1 ZINC000473829716 888663347 /nfs/dbraw/zinc/66/33/47/888663347.db2.gz NLDITSGYWLGTOE-XMMPIXPASA-N 0 3 421.589 4.264 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CCC[C@H]3CCc3ccccc3)c2)CC1 ZINC000473829520 888663380 /nfs/dbraw/zinc/66/33/80/888663380.db2.gz NWLFWXNWIYBBIH-QHCPKHFHSA-N 0 3 406.574 4.458 20 0 HIADHN Cc1nc(CC(C)C)c(NC(=O)N2CCC(CN3C[C@@H](C)O[C@H](C)C3)CC2)s1 ZINC000473845209 888689958 /nfs/dbraw/zinc/68/99/58/888689958.db2.gz UYVAMRIVMWMHIB-HZPDHXFCSA-N 0 3 408.612 4.003 20 0 HIADHN Cc1ccccc1Oc1ccccc1CNC(=O)NC(C)(C)CCN1CCN(C)CC1 ZINC000473949857 888824139 /nfs/dbraw/zinc/82/41/39/888824139.db2.gz OEKDGDGKOFABIF-UHFFFAOYSA-N 0 3 424.589 4.003 20 0 HIADHN CCN1CCN(Cc2ccc(CNC(=O)Nc3c(C)cccc3SC)cc2)CC1 ZINC000473988946 888850081 /nfs/dbraw/zinc/85/00/81/888850081.db2.gz XJQFVPXJVGAPMF-UHFFFAOYSA-N 0 3 412.603 4.176 20 0 HIADHN CSc1cccc(C)c1NC(=O)NCCCN1CCN(C)C[C@H]1c1ccccc1 ZINC000473990661 888852741 /nfs/dbraw/zinc/85/27/41/888852741.db2.gz KGZPILJLUMKCNH-FQEVSTJZSA-N 0 3 412.603 4.217 20 0 HIADHN O=C(Nc1ccccc1-c1ccccc1)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1CO ZINC000473993278 888853462 /nfs/dbraw/zinc/85/34/62/888853462.db2.gz SDELKPYIRSNAMW-VWNXMTODSA-N 0 3 415.537 4.358 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3cc(-c4ccccc4)ns3)CC2)C[C@H](C)O1 ZINC000474004385 888862967 /nfs/dbraw/zinc/86/29/67/888862967.db2.gz FXTOBNSRPSNDGO-CALCHBBNSA-N 0 3 414.575 4.163 20 0 HIADHN C[C@H](NC(=O)N[C@@H](CN1CCCC1)c1ccccc1)c1ccc(Br)cn1 ZINC000474034491 888880452 /nfs/dbraw/zinc/88/04/52/888880452.db2.gz PPKSSNWMRHXPHB-KXBFYZLASA-N 0 3 417.351 4.041 20 0 HIADHN CCN(C)C(=O)[C@H](C)N[C@H]1CCCc2nc(-c3ccc(Br)cc3)sc21 ZINC000474108285 888931097 /nfs/dbraw/zinc/93/10/97/888931097.db2.gz WATORKNHTZYNOK-WFASDCNBSA-N 0 3 422.392 4.406 20 0 HIADHN COc1ccc([C@H]2CCN(CC(=O)N3CC=C(c4c[nH]c5ccccc54)CC3)C2)cc1 ZINC000504532495 913313077 /nfs/dbraw/zinc/31/30/77/913313077.db2.gz IVJXRGPJYWSRNZ-NRFANRHFSA-N 0 3 415.537 4.282 20 0 HIADHN Cc1ccccc1C(=O)NC1CCN(C(=O)CN(Cc2ccccc2)C(C)(C)C)CC1 ZINC000474289156 889155073 /nfs/dbraw/zinc/15/50/73/889155073.db2.gz DXCDLRTWYMPBIL-UHFFFAOYSA-N 0 3 421.585 4.017 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)[C@H]1CCc2nc(C(C)C)[nH]c2C1)c1ccccc1Cl ZINC000474416469 889280519 /nfs/dbraw/zinc/28/05/19/889280519.db2.gz UTZCJWQNUXFIMQ-KKSFZXQISA-N 0 3 416.997 4.491 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)[C@H]1CCc2[nH]c(C(C)C)nc2C1)c1ccccc1Cl ZINC000474416469 889280532 /nfs/dbraw/zinc/28/05/32/889280532.db2.gz UTZCJWQNUXFIMQ-KKSFZXQISA-N 0 3 416.997 4.491 20 0 HIADHN CCc1noc(-c2ccc(C)c(NC(=O)N[C@H](C)[C@H](c3ccccc3)N(C)C)c2)n1 ZINC000474441024 889306914 /nfs/dbraw/zinc/30/69/14/889306914.db2.gz XAOUEQWGFDQAEI-IIBYNOLFSA-N 0 3 407.518 4.420 20 0 HIADHN Cc1cc(Br)cc2c(C(=O)NCCCCN3C[C@H](C)O[C@@H](C)C3)coc21 ZINC000474494440 889354838 /nfs/dbraw/zinc/35/48/38/889354838.db2.gz GPFWYQYESGEFGX-GJZGRUSLSA-N 0 3 423.351 4.123 20 0 HIADHN C[C@@H](NC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1)c1noc(-c2ccccc2)n1 ZINC000474508329 889371478 /nfs/dbraw/zinc/37/14/78/889371478.db2.gz BZFNCIADMIOUNO-RTBURBONSA-N 0 3 419.529 4.104 20 0 HIADHN CN(C)CCN(C(=O)N[C@H](c1cccc(Cl)c1)c1ccccn1)C1CCCC1 ZINC000474514724 889381693 /nfs/dbraw/zinc/38/16/93/889381693.db2.gz NWGFXCCEWCZRQU-OAQYLSRUSA-N 0 3 400.954 4.340 20 0 HIADHN Cc1nc2ccccc2n1C1CCN(C(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)CC1 ZINC000474537719 889412673 /nfs/dbraw/zinc/41/26/73/889412673.db2.gz HCGZSBISGVDVJJ-ISKFKSNPSA-N 0 3 417.557 4.137 20 0 HIADHN Cc1nc2ccccc2n1C1CCN(C(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)CC1 ZINC000474537720 889413074 /nfs/dbraw/zinc/41/30/74/889413074.db2.gz HCGZSBISGVDVJJ-LADGPHEKSA-N 0 3 417.557 4.137 20 0 HIADHN CN(C(=O)Nc1ccccc1C(=O)N1CCCCC1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000474554331 889431132 /nfs/dbraw/zinc/43/11/32/889431132.db2.gz FSKVVFNXVWIUGC-NRFANRHFSA-N 0 3 420.557 4.051 20 0 HIADHN C[C@H](CNC(=O)c1ccc(NC(=O)Nc2ccccc2)s1)N1CCC(C)CC1 ZINC000474571003 889447737 /nfs/dbraw/zinc/44/77/37/889447737.db2.gz WJAIASCCTXVNLT-MRXNPFEDSA-N 0 3 400.548 4.242 20 0 HIADHN Cc1noc(C)c1COc1ccccc1C(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C ZINC000474670373 889534232 /nfs/dbraw/zinc/53/42/32/889534232.db2.gz SRJKKYAOMXKSKC-GAJHUEQPSA-N 0 3 407.514 4.292 20 0 HIADHN Cc1noc(C)c1COc1ccccc1C(=O)N[C@H](C)[C@@H](c1ccccc1)N(C)C ZINC000474670374 889534336 /nfs/dbraw/zinc/53/43/36/889534336.db2.gz SRJKKYAOMXKSKC-HXOBKFHXSA-N 0 3 407.514 4.292 20 0 HIADHN CCC(C)(C)NC(=O)c1ccc(NC(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000474723017 889578651 /nfs/dbraw/zinc/57/86/51/889578651.db2.gz NHFCVHVNPFYCJH-QFIPXVFZSA-N 0 3 422.573 4.343 20 0 HIADHN CN(C)[C@@H](CNC(=O)C1(c2cc(F)cc(Br)c2)CC1)c1ccccc1 ZINC000504606890 913360964 /nfs/dbraw/zinc/36/09/64/913360964.db2.gz ONBLEGJHIXRXLW-SFHVURJKSA-N 0 3 405.311 4.039 20 0 HIADHN CC(C)c1nc2c([nH]1)C[C@@H](C(=O)NC[C@H](c1cccc(Cl)c1)N1CCCC1)CC2 ZINC000474789663 889646926 /nfs/dbraw/zinc/64/69/26/889646926.db2.gz AGNXTTWVYFMMOS-LAUBAEHRSA-N 0 3 414.981 4.245 20 0 HIADHN CC(C)c1nc2c([nH]1)CC[C@H](C(=O)NC[C@H](c1cccc(Cl)c1)N1CCCC1)C2 ZINC000474789663 889646933 /nfs/dbraw/zinc/64/69/33/889646933.db2.gz AGNXTTWVYFMMOS-LAUBAEHRSA-N 0 3 414.981 4.245 20 0 HIADHN CC(C)c1nc2c([nH]1)C[C@H](C(=O)NC[C@@H](c1cccc(Cl)c1)N1CCCC1)CC2 ZINC000474789665 889647128 /nfs/dbraw/zinc/64/71/28/889647128.db2.gz AGNXTTWVYFMMOS-UTKZUKDTSA-N 0 3 414.981 4.245 20 0 HIADHN CC(C)c1nc2c([nH]1)CC[C@@H](C(=O)NC[C@@H](c1cccc(Cl)c1)N1CCCC1)C2 ZINC000474789665 889647133 /nfs/dbraw/zinc/64/71/33/889647133.db2.gz AGNXTTWVYFMMOS-UTKZUKDTSA-N 0 3 414.981 4.245 20 0 HIADHN Cc1cc(C(=O)NC(C)(C)CCN2CCN(C)CC2)sc1-c1ccc(F)cc1 ZINC000474805722 889658449 /nfs/dbraw/zinc/65/84/49/889658449.db2.gz DGMNECYPCUTNJB-UHFFFAOYSA-N 0 3 403.567 4.009 20 0 HIADHN CC(C)[C@H]([NH2+]CCCCc1cccc(C(F)(F)F)c1)c1nc(-c2nc[n-]n2)no1 ZINC000474806836 889660525 /nfs/dbraw/zinc/66/05/25/889660525.db2.gz YUKPCTCJZSHECE-HNNXBMFYSA-N 0 3 408.428 4.183 20 0 HIADHN CC(C)[C@H](NCCCCc1cccc(C(F)(F)F)c1)c1nc(-c2nc[nH]n2)no1 ZINC000474806836 889660531 /nfs/dbraw/zinc/66/05/31/889660531.db2.gz YUKPCTCJZSHECE-HNNXBMFYSA-N 0 3 408.428 4.183 20 0 HIADHN CC(C)N1CCCN(C(=O)c2cc(Oc3cccc(Br)c3)ccn2)CC1 ZINC000474858710 889714182 /nfs/dbraw/zinc/71/41/82/889714182.db2.gz IDGRLFPRLNIKHZ-UHFFFAOYSA-N 0 3 418.335 4.193 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)CSCc2ccc(Cl)cc2Cl)CC1 ZINC000474879140 889733739 /nfs/dbraw/zinc/73/37/39/889733739.db2.gz MGPUZEOYRCAZPW-UHFFFAOYSA-N 0 3 419.418 4.232 20 0 HIADHN C[C@@H]([NH2+][C@H](c1nc(-c2nc[n-]n2)no1)C(C)(C)C)C1CCC(C(F)(F)F)CC1 ZINC000474882099 889737058 /nfs/dbraw/zinc/73/70/58/889737058.db2.gz KEHUCGVOLSGCPZ-IKWCTNDRSA-N 0 3 400.449 4.289 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)c2ccc(-c3nc4ccccc4s3)o2)CC1 ZINC000474890817 889747266 /nfs/dbraw/zinc/74/72/66/889747266.db2.gz XLCMQOSGBJNRQF-UHFFFAOYSA-N 0 3 413.543 4.176 20 0 HIADHN COc1ccc(Nc2ccccc2C(=O)NC2CCN(CCOC(C)C)CC2)cc1 ZINC000474890402 889747325 /nfs/dbraw/zinc/74/73/25/889747325.db2.gz VWRIIRZMCUOOEL-UHFFFAOYSA-N 0 3 411.546 4.058 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)c2ccc(Oc3ccncc3)c(Cl)c2)CC1 ZINC000474896230 889755231 /nfs/dbraw/zinc/75/52/31/889755231.db2.gz YTKDUDKFBJSRJT-UHFFFAOYSA-N 0 3 417.937 4.147 20 0 HIADHN Cc1cc(F)c(Br)cc1NC(=O)N(CCN(C)C)Cc1ccccc1 ZINC000474956981 889812707 /nfs/dbraw/zinc/81/27/07/889812707.db2.gz WGOQTBGVLAEFHG-UHFFFAOYSA-N 0 3 408.315 4.492 20 0 HIADHN CCOC(=O)CCc1ccc(NC(=O)N(CC)[C@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000474998037 889849299 /nfs/dbraw/zinc/84/92/99/889849299.db2.gz BCWXQCJBXGZFFT-QHCPKHFHSA-N 0 3 423.557 4.311 20 0 HIADHN CCN(C(=O)NCCCn1c(C)nc2ccccc21)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475009352 889862244 /nfs/dbraw/zinc/86/22/44/889862244.db2.gz YBVJPDPDOGFQMR-JOCHJYFZSA-N 0 3 419.573 4.041 20 0 HIADHN CCN(CC)C(=O)c1cccc(NC(=O)N(CC)[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000475008570 889862440 /nfs/dbraw/zinc/86/24/40/889862440.db2.gz UYRLYFWJWGOYEY-QHCPKHFHSA-N 0 3 422.573 4.297 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)Nc1ccccc1OCC(F)F ZINC000475025902 889878258 /nfs/dbraw/zinc/87/82/58/889878258.db2.gz VTIFZDZSFUNMPU-UHFFFAOYSA-N 0 3 413.415 4.204 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N(C)[C@@H](C)c1ccc([S@](C)=O)cc1)c1ccsc1 ZINC000475136911 890002492 /nfs/dbraw/zinc/00/24/92/890002492.db2.gz IVVYTRWJHYEJQW-PYFSPHLCSA-N 0 3 421.632 4.271 20 0 HIADHN CN(C(=O)NCc1nc2cc(Cl)ccc2s1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475139901 890006402 /nfs/dbraw/zinc/00/64/02/890006402.db2.gz ZMDZWXAYNKOGKR-QGZVFWFLSA-N 0 3 414.962 4.366 20 0 HIADHN CCN(C(=O)NCc1coc(-c2ccccc2)n1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475156511 890021420 /nfs/dbraw/zinc/02/14/20/890021420.db2.gz OLDIQHSOIJTAPD-JOCHJYFZSA-N 0 3 404.514 4.148 20 0 HIADHN CCN(C(=O)N[C@@H]1CCO[C@@H](c2ccccc2)C1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475164759 890030240 /nfs/dbraw/zinc/03/02/40/890030240.db2.gz PNXCFVZUKBRVIN-WXFUMESZSA-N 0 3 407.558 4.213 20 0 HIADHN CCOCCC1(CNC(=O)N(CC)[C@H]2CCN(Cc3ccccc3)C2)CCCC1 ZINC000475166971 890032847 /nfs/dbraw/zinc/03/28/47/890032847.db2.gz YXZQPYZLWGKMOZ-QFIPXVFZSA-N 0 3 401.595 4.279 20 0 HIADHN CCN(C(=O)Nc1csc(-c2ccccn2)n1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475221636 890090587 /nfs/dbraw/zinc/09/05/87/890090587.db2.gz XBQVSEKHIIWGBK-SFHVURJKSA-N 0 3 407.543 4.333 20 0 HIADHN C[C@H](NC(=O)N(CCN(C)C)CC1CCCCC1)c1ccc(Br)cn1 ZINC000475244668 890125301 /nfs/dbraw/zinc/12/53/01/890125301.db2.gz IYWNRBFZVIYHPG-HNNXBMFYSA-N 0 3 411.388 4.059 20 0 HIADHN CCCN(CCC)C(=O)c1cccc(C(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000475297143 890205302 /nfs/dbraw/zinc/20/53/02/890205302.db2.gz LQZMRDYDFFRVLD-XMMPIXPASA-N 0 3 421.585 4.295 20 0 HIADHN CN(C(=O)c1ccccc1OCc1cscn1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475298539 890205891 /nfs/dbraw/zinc/20/58/91/890205891.db2.gz AUNZGXIKXLSZBH-HXUWFJFHSA-N 0 3 407.539 4.069 20 0 HIADHN CC[C@@H](C)n1ncc2c1nc(C)cc2C(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475303423 890212520 /nfs/dbraw/zinc/21/25/20/890212520.db2.gz ICFJHKUFGOEMDY-QUCCMNQESA-N 0 3 405.546 4.057 20 0 HIADHN CN(C(=O)Cc1ccc(NC(=O)CC(C)(C)C)cc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475315206 890229921 /nfs/dbraw/zinc/22/99/21/890229921.db2.gz JFHDRZLDAXZILI-QHCPKHFHSA-N 0 3 421.585 4.337 20 0 HIADHN CN(C(=O)c1cn(C)nc1-c1ccccc1Cl)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475315368 890231304 /nfs/dbraw/zinc/23/13/04/890231304.db2.gz WUZIZBKJFPSWRN-GOSISDBHSA-N 0 3 408.933 4.087 20 0 HIADHN CCN(C(=O)c1ccn(Cc2ccccc2)n1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000475325686 890246271 /nfs/dbraw/zinc/24/62/71/890246271.db2.gz WWWKLBFLCYACJF-NFBKMPQASA-N 0 3 402.542 4.229 20 0 HIADHN C[C@@H](C(=O)NCCCCN1CCN(c2ccccc2)CC1)c1cn(C)c2ccccc12 ZINC000475340527 890262330 /nfs/dbraw/zinc/26/23/30/890262330.db2.gz WISGQAYFVGVCAS-OAQYLSRUSA-N 0 3 418.585 4.000 20 0 HIADHN CC(C)n1cc2cc(NC(=O)N(CCN(C)C)Cc3ccc(F)cc3F)ccc2n1 ZINC000475377490 890307939 /nfs/dbraw/zinc/30/79/39/890307939.db2.gz PECSIQHQBCXIKD-UHFFFAOYSA-N 0 3 415.488 4.491 20 0 HIADHN CS(=O)(=O)C1(CNCc2ccc(OCc3c(F)cccc3Cl)cc2)CCC1 ZINC000475432000 890350893 /nfs/dbraw/zinc/35/08/93/890350893.db2.gz BOTHTSXCRDWVFS-UHFFFAOYSA-N 0 3 411.926 4.115 20 0 HIADHN Cc1ccc(CN2CCSCC2)cc1NC(=O)[C@@H]1CCc2[nH]c(C(C)C)nc2C1 ZINC000475466983 890375266 /nfs/dbraw/zinc/37/52/66/890375266.db2.gz SJDXXHWKASRKMR-GOSISDBHSA-N 0 3 412.603 4.134 20 0 HIADHN Cc1ccc(CN2CCSCC2)cc1NC(=O)[C@@H]1CCc2nc(C(C)C)[nH]c2C1 ZINC000475466983 890375288 /nfs/dbraw/zinc/37/52/88/890375288.db2.gz SJDXXHWKASRKMR-GOSISDBHSA-N 0 3 412.603 4.134 20 0 HIADHN Cn1cc(C(=O)NC2CCN(Cc3ccccc3)CC2)c(-c2ccc(Cl)s2)n1 ZINC000475484994 890390406 /nfs/dbraw/zinc/39/04/06/890390406.db2.gz IORPJBXWPXPAOX-UHFFFAOYSA-N 0 3 414.962 4.196 20 0 HIADHN CCc1c(C(=O)NCC2(N3CCSCC3)CCCCC2)cnn1C1CCCC1 ZINC000475499865 890410476 /nfs/dbraw/zinc/41/04/76/890410476.db2.gz BFGMGUJDFADJEQ-UHFFFAOYSA-N 0 3 404.624 4.042 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)N[C@@H]2C[C@H]2c2ccc(OC(F)F)cc2)CC1 ZINC000475516399 890436040 /nfs/dbraw/zinc/43/60/40/890436040.db2.gz FHTXNOXRAGOCEH-VQTJNVASSA-N 0 3 419.472 4.043 20 0 HIADHN CN(C(=O)c1cc2ccc(Br)cc2[nH]1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475554042 890479948 /nfs/dbraw/zinc/47/99/48/890479948.db2.gz HQDQEUGWCRVSSG-GOSISDBHSA-N 0 3 412.331 4.277 20 0 HIADHN CCCCOc1cc(CN2CCC[C@H](N(C)Cc3noc(C)n3)CC2)ccc1OC ZINC000475627731 890564772 /nfs/dbraw/zinc/56/47/72/890564772.db2.gz YSCIOICVISILSA-FQEVSTJZSA-N 0 3 416.566 4.052 20 0 HIADHN CCN(C(=O)c1ccnc(N2CC[C@H](C)C2)c1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000475648103 890591260 /nfs/dbraw/zinc/59/12/60/890591260.db2.gz GFIXNDMBAUSLFY-MZKRTTBSSA-N 0 3 406.574 4.225 20 0 HIADHN CC(C)(CNC(=O)N1CC=C(c2ccc(O)cc2)CC1)N1CCc2ccccc2C1 ZINC000504732939 913470763 /nfs/dbraw/zinc/47/07/63/913470763.db2.gz URMSYKLNQJQHJR-UHFFFAOYSA-N 0 3 405.542 4.028 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)CC1 ZINC000475739936 890682654 /nfs/dbraw/zinc/68/26/54/890682654.db2.gz QHLCYTBCJCYQLQ-UHFFFAOYSA-N 0 3 407.864 4.370 20 0 HIADHN CN(C(=O)c1cc(NCc2ccccc2)nc2ccccc21)[C@@H]1CCN(C2CC2)C1 ZINC000475842110 890775214 /nfs/dbraw/zinc/77/52/14/890775214.db2.gz YSKZDADRTDBXMC-HXUWFJFHSA-N 0 3 400.526 4.156 20 0 HIADHN CC1CCN([C@H](CNC(=O)Nc2ccc([S@](C)=O)c(F)c2)c2ccccc2)CC1 ZINC000475856161 890791577 /nfs/dbraw/zinc/79/15/77/890791577.db2.gz VSWQEUGNYCTINF-OLILMLBXSA-N 0 3 417.550 4.158 20 0 HIADHN Cc1cnn(-c2cc[nH+]cc2[N-]C(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)c1 ZINC000504753237 913491624 /nfs/dbraw/zinc/49/16/24/913491624.db2.gz CPXCWESGIFBDBW-UHFFFAOYSA-N 0 3 421.464 4.076 20 0 HIADHN CC(C)C[C@H](NC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1CO)c1cccs1 ZINC000475916826 890844347 /nfs/dbraw/zinc/84/43/47/890844347.db2.gz ONBQESMKYLLBED-NJYVYQBISA-N 0 3 415.603 4.018 20 0 HIADHN CN(C)CCN(C(=O)c1cc2sc(N3CCCC3)nc2s1)C1CCCCC1 ZINC000475919895 890845648 /nfs/dbraw/zinc/84/56/48/890845648.db2.gz OYZNEEHZLZORHD-UHFFFAOYSA-N 0 3 406.621 4.295 20 0 HIADHN CN(C)CCN(C[C@@H]1CCCO1)C(=O)Nc1ccccc1-c1cc(F)c(F)c(F)c1 ZINC000475975129 890892122 /nfs/dbraw/zinc/89/21/22/890892122.db2.gz UPSAWZSYMHIJNJ-INIZCTEOSA-N 0 3 421.463 4.345 20 0 HIADHN Cc1onc(-c2ccccc2C)c1C(=O)N(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1 ZINC000476016611 890947961 /nfs/dbraw/zinc/94/79/61/890947961.db2.gz AWCJMNKDMUARHF-CVDCTZTESA-N 0 3 404.514 4.118 20 0 HIADHN Cc1nc2ccc(Br)cn2c1C(=O)Nc1ccc(C)cc1CN(C)C ZINC000476050100 890980899 /nfs/dbraw/zinc/98/08/99/890980899.db2.gz MHSSWCQFIYQTAZ-UHFFFAOYSA-N 0 3 401.308 4.028 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N[C@H](C)C(c2ccccc2)c2ccccc2)CC1 ZINC000476051773 890982526 /nfs/dbraw/zinc/98/25/26/890982526.db2.gz RWMXUXWGJIGQRG-OAQYLSRUSA-N 0 3 423.601 4.396 20 0 HIADHN COc1cc([C@@H](C)NC(=O)N(C)[C@@H]2CCN(C3CC3)C2)ccc1OCCC(C)C ZINC000476163727 891091735 /nfs/dbraw/zinc/09/17/35/891091735.db2.gz RWGZHSKDJYLNDC-YLJYHZDGSA-N 0 3 403.567 4.059 20 0 HIADHN COCCN1CCC[C@H]1CNC(=O)N[C@H](C)c1ccc(Oc2ccccc2)c(F)c1 ZINC000476178970 891110070 /nfs/dbraw/zinc/11/00/70/891110070.db2.gz XQTNUDMHAOQSQL-MJGOQNOKSA-N 0 3 415.509 4.089 20 0 HIADHN O=C(CN1CC[C@H](c2ccccc2)C1)N1CCC[C@H]1c1ccc2c(c1)OCCCO2 ZINC000476241931 891165880 /nfs/dbraw/zinc/16/58/80/891165880.db2.gz MWHABZCWYOICMG-VXKWHMMOSA-N 0 3 406.526 4.001 20 0 HIADHN CCNc1ccc(Cl)cc1C(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000476301065 891214478 /nfs/dbraw/zinc/21/44/78/891214478.db2.gz DMANDMUVQBJVNK-UHFFFAOYSA-N 0 3 401.938 4.228 20 0 HIADHN COc1ccc([C@@H]2CCCCCN2C(=O)NC2CCN(CCOC(C)C)CC2)cc1 ZINC000476437254 891349072 /nfs/dbraw/zinc/34/90/72/891349072.db2.gz QQWIQSFQNLLUED-QHCPKHFHSA-N 0 3 417.594 4.211 20 0 HIADHN Cc1ccc2c(c1)[nH]cc2C1=CCN(C(=O)NC2CCN(CCOC(C)C)CC2)CC1 ZINC000476451136 891362586 /nfs/dbraw/zinc/36/25/86/891362586.db2.gz HHBJWNXGFXIXJO-UHFFFAOYSA-N 0 3 424.589 4.164 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N(C)Cc2ccccc2-c2ccccc2)CC1 ZINC000476452791 891364142 /nfs/dbraw/zinc/36/41/42/891364142.db2.gz RSFQFEABKZHFSA-UHFFFAOYSA-N 0 3 409.574 4.384 20 0 HIADHN Cc1[nH]c2ccccc2c1C1=CCN(C(=O)NC2CCN(CCOC(C)C)CC2)CC1 ZINC000476456533 891369489 /nfs/dbraw/zinc/36/94/89/891369489.db2.gz YQVHKLBGZLWWME-UHFFFAOYSA-N 0 3 424.589 4.164 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N(CC2CCC2)[C@H](C)c2ccccc2)CC1 ZINC000476466150 891378724 /nfs/dbraw/zinc/37/87/24/891378724.db2.gz YCHYHPZLARPXAM-HXUWFJFHSA-N 0 3 401.595 4.449 20 0 HIADHN CCCc1ccc([C@@H](NC(=O)NC[C@@H]2CCCN2CCOC)c2cccs2)cc1 ZINC000476495712 891406732 /nfs/dbraw/zinc/40/67/32/891406732.db2.gz YWTPXCOSWWNGLW-RBBKRZOGSA-N 0 3 415.603 4.200 20 0 HIADHN C[C@@H]1[C@@H](c2ccccc2)CCN1CC(=O)NCc1cccc(COCc2ccco2)c1 ZINC000476578843 891503780 /nfs/dbraw/zinc/50/37/80/891503780.db2.gz ZTSCFFYGNONVPE-NLFFAJNJSA-N 0 3 418.537 4.491 20 0 HIADHN CN(C(=O)NC[C@H]1CC2c3ccccc3C1c1ccccc12)[C@@H]1CCN(C2CC2)C1 ZINC000476680296 891630099 /nfs/dbraw/zinc/63/00/99/891630099.db2.gz ADBYCCNQJPLWPR-DTAQTMAHSA-N 0 3 401.554 4.162 20 0 HIADHN Cc1nc(-c2ccc(CNC(=O)N[C@H]3CCN(Cc4ccccc4)[C@@H]3C)o2)cs1 ZINC000476736146 891702964 /nfs/dbraw/zinc/70/29/64/891702964.db2.gz KHPFKHFXLXWWOO-BEFAXECRSA-N 0 3 410.543 4.174 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3cc(O)ccc3Cl)c(OCC)c2)CC1 ZINC000504870757 913598643 /nfs/dbraw/zinc/59/86/43/913598643.db2.gz PEFQXCYHBYNPDG-UHFFFAOYSA-N 0 3 417.937 4.229 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N2CCC[C@]3(C2)OCc2ccccc23)C1 ZINC000476892651 891851036 /nfs/dbraw/zinc/85/10/36/891851036.db2.gz ZSMRGXHDRCPNFQ-OPJGWUQDSA-N 0 3 405.542 4.053 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)N[C@@H](c1nccn1C)c1ccc(Cl)cc1 ZINC000476905370 891859401 /nfs/dbraw/zinc/85/94/01/891859401.db2.gz UKZXEUCQSHDJOL-HXUWFJFHSA-N 0 3 417.985 4.070 20 0 HIADHN COc1ccc([C@H](C)NC(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)cc1F ZINC000476905741 891859733 /nfs/dbraw/zinc/85/97/33/891859733.db2.gz VIWCPFWQUVBZFQ-HRAATJIYSA-N 0 3 417.525 4.285 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CNC(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C ZINC000476950970 891887378 /nfs/dbraw/zinc/88/73/78/891887378.db2.gz IVQDCMSEDMEKCI-CYFREDJKSA-N 0 3 419.573 4.039 20 0 HIADHN O=C(Nc1cc2c(cc1Cl)OCCCO2)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000504882296 913612967 /nfs/dbraw/zinc/61/29/67/913612967.db2.gz NHRBQUZFWYHAHM-QGZVFWFLSA-N 0 3 415.921 4.287 20 0 HIADHN COc1cccc(Cl)c1-c1noc(C)c1C(=O)NC[C@H]1CCCCN1C1CC1 ZINC000477097387 892030399 /nfs/dbraw/zinc/03/03/99/892030399.db2.gz FWLJLWUQXONBCR-OAHLLOKOSA-N 0 3 403.910 4.059 20 0 HIADHN COc1ccc([C@H]2CCCN2C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)c(OC)c1 ZINC000504887571 913620261 /nfs/dbraw/zinc/62/02/61/913620261.db2.gz CSOUZSSUQYBOKS-NZQKXSOJSA-N 0 3 423.557 4.215 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)Nc1ccc(Oc2nccc(C)n2)cc1)c1ccco1 ZINC000477110890 892041891 /nfs/dbraw/zinc/04/18/91/892041891.db2.gz FNLTZAOJBJBTTC-BEFAXECRSA-N 0 3 409.490 4.421 20 0 HIADHN CN1CC[C@H](NC(=O)N2CCO[C@@H](c3ccc(F)cc3Cl)C2)[C@H]1c1ccccc1 ZINC000477173483 892094014 /nfs/dbraw/zinc/09/40/14/892094014.db2.gz BWYQZLDSFFUVQW-PWRODBHTSA-N 0 3 417.912 4.007 20 0 HIADHN CC[C@@H](Cc1ccccc1Br)N(C)C(=O)N[C@H](C)C1=CCN(C)CC1 ZINC000477182107 892100500 /nfs/dbraw/zinc/10/05/00/892100500.db2.gz NCFPGIFVFNMRFD-QAPCUYQASA-N 0 3 408.384 4.062 20 0 HIADHN CC[C@H](Cc1ccccc1Br)N(C)C(=O)N[C@H](C)C1=CCN(C)CC1 ZINC000477182105 892100777 /nfs/dbraw/zinc/10/07/77/892100777.db2.gz NCFPGIFVFNMRFD-CRAIPNDOSA-N 0 3 408.384 4.062 20 0 HIADHN CCc1noc(-c2ccc(C)c(NC(=O)N[C@@H](CN(C)C)c3ccc(F)cc3)c2)n1 ZINC000477193653 892118652 /nfs/dbraw/zinc/11/86/52/892118652.db2.gz YWBSEEILRLQMNX-IBGZPJMESA-N 0 3 411.481 4.171 20 0 HIADHN CC[C@@H](c1ccccc1)[C@@H]1CCCN1CC(=O)Nc1cccc(N2CCCC2=O)c1 ZINC000477218321 892150700 /nfs/dbraw/zinc/15/07/00/892150700.db2.gz HQKWDVSMQFVPMX-GOTSBHOMSA-N 0 3 405.542 4.410 20 0 HIADHN Cc1nc([C@@H](C)N2CCC[C@H](CN3CCOCC3)C2)oc1-c1ccc(Cl)cc1 ZINC000477290796 892251275 /nfs/dbraw/zinc/25/12/75/892251275.db2.gz JEQWIIRLGVFYMW-QZTJIDSGSA-N 0 3 403.954 4.409 20 0 HIADHN C[C@H]1C[C@H](NC(=O)Cc2nc(-c3ccc(F)cc3)cs2)CN1Cc1ccccc1 ZINC000477348904 892316571 /nfs/dbraw/zinc/31/65/71/892316571.db2.gz GSNSBWHAHGNPAY-JXFKEZNVSA-N 0 3 409.530 4.271 20 0 HIADHN O[C@@H](COc1cccc(C(F)(F)F)c1)CN1CCC[C@@H]1c1ccc2c(c1)OCO2 ZINC000477458621 892422403 /nfs/dbraw/zinc/42/24/03/892422403.db2.gz LKFILFPDMAWICL-SJLPKXTDSA-N 0 3 409.404 4.011 20 0 HIADHN Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)NC(=O)N(C)[C@H]1CCN(C2CC2)C1 ZINC000477475394 892457761 /nfs/dbraw/zinc/45/77/61/892457761.db2.gz YCHXQHHUISCRNW-KSSFIOAISA-N 0 3 402.539 4.197 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)Nc1cccc(OC(F)(F)F)c1 ZINC000504958983 913695496 /nfs/dbraw/zinc/69/54/96/913695496.db2.gz FLMWMGFJIGUODY-UHFFFAOYSA-N 0 3 403.470 4.068 20 0 HIADHN Cc1cc(N2CCCC2)ccc1NC(=O)NCC1(N2CCSCC2)CCCC1 ZINC000504960557 913697755 /nfs/dbraw/zinc/69/77/55/913697755.db2.gz ZIRWZCGXRVHLHA-UHFFFAOYSA-N 0 3 402.608 4.078 20 0 HIADHN Cc1c(Br)cccc1C(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000477731843 892831135 /nfs/dbraw/zinc/83/11/35/892831135.db2.gz QYUIENIBAWMGSA-UHFFFAOYSA-N 0 3 417.347 4.214 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)[C@@H]1C[C@@H]1c1c(F)cccc1Cl ZINC000477758147 892849287 /nfs/dbraw/zinc/84/92/87/892849287.db2.gz ZHPLDOWUJQHTEM-RBUKOAKNSA-N 0 3 416.924 4.426 20 0 HIADHN CCCN(C)[C@H](CNC(=O)Nc1ccn(CC(F)(F)F)n1)c1ccc(Cl)cc1 ZINC000478027475 893154401 /nfs/dbraw/zinc/15/44/01/893154401.db2.gz QHZJVQNILUGXFU-OAHLLOKOSA-N 0 3 417.863 4.303 20 0 HIADHN CCCN(C(=O)c1ccc(-n2cccn2)cc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000505025273 913766065 /nfs/dbraw/zinc/76/60/65/913766065.db2.gz ZWTMJBQMBPUQQE-DEOSSOPVSA-N 0 3 402.542 4.389 20 0 HIADHN Cc1ccc(-c2nc(NC[C@@H](C)N3CCN(C)CC3)nc3sc4c(c32)CCC4)cc1 ZINC000478256544 893435495 /nfs/dbraw/zinc/43/54/95/893435495.db2.gz JSDLZFRAYWQQMQ-QGZVFWFLSA-N 0 3 421.614 4.203 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2CNCc2nc3ccc(Cl)cc3n2C)C[C@H](C)O1 ZINC000478312974 893538014 /nfs/dbraw/zinc/53/80/14/893538014.db2.gz LEBBBFXLPGOFOC-CALCHBBNSA-N 0 3 412.965 4.126 20 0 HIADHN CC[C@H](C)n1ncc(C(=O)Nc2c(C)cnn2[C@@H]2CCN(Cc3ccccc3)C2)c1C ZINC000478328318 893559748 /nfs/dbraw/zinc/55/97/48/893559748.db2.gz GXYHHGJYMCYXNF-GHTZIAJQSA-N 0 3 420.561 4.367 20 0 HIADHN C[C@@H](NCc1ccc(N2CCCS2(=O)=O)c(F)c1)c1ccc(C(F)(F)F)cc1 ZINC000478416141 893708005 /nfs/dbraw/zinc/70/80/05/893708005.db2.gz OCOYVBMOSFAKLW-CYBMUJFWSA-N 0 3 416.440 4.235 20 0 HIADHN COc1cnccc1N1CCN(C(=O)c2sc(-c3ccc(C)cc3C)nc2C)CC1 ZINC000478436635 893737293 /nfs/dbraw/zinc/73/72/93/893737293.db2.gz FOMJGCAZNNVBKD-UHFFFAOYSA-N 0 3 422.554 4.101 20 0 HIADHN Cc1nc(COc2ccc(F)cc2)sc1C(=O)NC[C@H](C)N1CCC[C@@H](C)C1 ZINC000478487982 893808873 /nfs/dbraw/zinc/80/88/73/893808873.db2.gz PYGTYXFFEHMQAH-CABCVRRESA-N 0 3 405.539 4.020 20 0 HIADHN COc1ccc([C@H](NC(=O)N(CCN(C)C)Cc2cccc(OC)c2)C(C)C)cc1 ZINC000478496403 893813034 /nfs/dbraw/zinc/81/30/34/893813034.db2.gz XJLDWYFSNWDNPQ-HSZRJFAPSA-N 0 3 413.562 4.174 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(CN3CCC(O)CC3)c2)c(OC2CCCC2)c1 ZINC000478507509 893819048 /nfs/dbraw/zinc/81/90/48/893819048.db2.gz QBUUKMXIVIRYHS-UHFFFAOYSA-N 0 3 424.541 4.226 20 0 HIADHN COc1cc(NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)c(OC)c(C)c1OC ZINC000478579474 893857780 /nfs/dbraw/zinc/85/77/80/893857780.db2.gz AAMMKTVIDCYEBN-QGZVFWFLSA-N 0 3 416.493 4.011 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Cc1nc(-c2ccc(F)cc2)cs1 ZINC000478584115 893860576 /nfs/dbraw/zinc/86/05/76/893860576.db2.gz KKDIXKKWIYVELK-OXJNMPFZSA-N 0 3 409.530 4.128 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)N[C@@H](C)Cc2ccc(C(F)(F)F)cc2)o1 ZINC000478661526 893906666 /nfs/dbraw/zinc/90/66/66/893906666.db2.gz PEGJCCSQFYMFHT-HNNXBMFYSA-N 0 3 411.468 4.311 20 0 HIADHN CC(C)C(=O)Nc1ccc(NC(=O)[C@@H]2CN(Cc3ccccc3)CCC2(F)F)cc1 ZINC000505121466 913827706 /nfs/dbraw/zinc/82/77/06/913827706.db2.gz VSNCDMBWLFOGNO-FQEVSTJZSA-N 0 3 415.484 4.377 20 0 HIADHN CCc1ccc([C@H](CNC(=O)c2ccccc2NCc2cccnc2)N(C)C)cc1 ZINC000478800833 894075234 /nfs/dbraw/zinc/07/52/34/894075234.db2.gz RXCCMKIDSAZZQQ-DEOSSOPVSA-N 0 3 402.542 4.289 20 0 HIADHN CC(C)(CNC(=O)N1CC2(CCOCC2)c2ccccc21)N1CCc2ccccc2C1 ZINC000478806324 894080529 /nfs/dbraw/zinc/08/05/29/894080529.db2.gz OMRAWPLNPVZXCD-UHFFFAOYSA-N 0 3 419.569 4.101 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)c1cccc(Oc2ccccc2)c1 ZINC000478869231 894147805 /nfs/dbraw/zinc/14/78/05/894147805.db2.gz PPWOKVOFXQGVBX-UHFFFAOYSA-N 0 3 416.521 4.366 20 0 HIADHN Cc1nc(-c2ccc(F)c(F)c2)sc1C(=O)NCCCCN1C[C@H](C)O[C@@H](C)C1 ZINC000478878314 894155032 /nfs/dbraw/zinc/15/50/32/894155032.db2.gz ZCHPULWSNJLLRO-KBPBESRZSA-N 0 3 423.529 4.016 20 0 HIADHN Cc1nc(-c2ccc(F)c(F)c2)sc1C(=O)NCCCCN1C[C@@H](C)O[C@@H](C)C1 ZINC000478878315 894155308 /nfs/dbraw/zinc/15/53/08/894155308.db2.gz ZCHPULWSNJLLRO-OKILXGFUSA-N 0 3 423.529 4.016 20 0 HIADHN COC(=O)CCSc1cccc(NC(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)c1 ZINC000478965456 894243489 /nfs/dbraw/zinc/24/34/89/894243489.db2.gz QFDRFQOPEJVHBA-HRAATJIYSA-N 0 3 415.559 4.155 20 0 HIADHN COC(=O)CCSc1cccc(NC(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)c1 ZINC000478965461 894245479 /nfs/dbraw/zinc/24/54/79/894245479.db2.gz QFDRFQOPEJVHBA-KKSFZXQISA-N 0 3 415.559 4.155 20 0 HIADHN CCOc1ccc(NC(=O)[C@H]2CN(Cc3ccccc3)CCC2(F)F)cc1OC ZINC000505160124 913850258 /nfs/dbraw/zinc/85/02/58/913850258.db2.gz MMFTZBQWVZLLPR-GOSISDBHSA-N 0 3 404.457 4.190 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)Nc1cccc2c1CN(c1ccccn1)C2)c1ccco1 ZINC000479019444 894285462 /nfs/dbraw/zinc/28/54/62/894285462.db2.gz PYFKWNDXAUAZSF-UTKZUKDTSA-N 0 3 419.529 4.446 20 0 HIADHN C[C@H](NCC(C)(C)c1ccc(F)cc1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479053103 894312578 /nfs/dbraw/zinc/31/25/78/894312578.db2.gz CAWZUUMHPGXUNI-NSHDSACASA-N 0 3 419.349 4.408 20 0 HIADHN Cc1ccccc1C[C@H](C)N[C@@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479064330 894325475 /nfs/dbraw/zinc/32/54/75/894325475.db2.gz QHOPHQDHSIXXBP-STQMWFEESA-N 0 3 401.359 4.231 20 0 HIADHN Cc1ccccc1C[C@H](C)N[C@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479064329 894325576 /nfs/dbraw/zinc/32/55/76/894325576.db2.gz QHOPHQDHSIXXBP-QWHCGFSZSA-N 0 3 401.359 4.231 20 0 HIADHN C[C@@H](CN[C@@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl)c1ccc(F)cc1F ZINC000479066749 894329977 /nfs/dbraw/zinc/32/99/77/894329977.db2.gz VCHGHGAEMOHSAL-UWVGGRQHSA-N 0 3 423.312 4.373 20 0 HIADHN CCO[C@@H](CCN[C@@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl)C1CCCC1 ZINC000479069874 894334282 /nfs/dbraw/zinc/33/42/82/894334282.db2.gz QCXZRZJAJWTWFY-SJCJKPOMSA-N 0 3 423.406 4.277 20 0 HIADHN C[C@H](NCC(C)(C)c1cccc(F)c1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479083118 894348343 /nfs/dbraw/zinc/34/83/43/894348343.db2.gz VIOUMZWGUBDHJS-NSHDSACASA-N 0 3 419.349 4.408 20 0 HIADHN CC[NH+](CC)Cc1cccc([N-]S(=O)(=O)c2ccc(CC(F)(F)F)cc2)c1 ZINC000479132854 894402047 /nfs/dbraw/zinc/40/20/47/894402047.db2.gz OJMUFVFQRIMKFX-UHFFFAOYSA-N 0 3 400.466 4.434 20 0 HIADHN CC(C)c1ccccc1OCCNC(=O)N(CCN(C)C)Cc1cccc(F)c1 ZINC000479186953 894454914 /nfs/dbraw/zinc/45/49/14/894454914.db2.gz FNTSWUBUUDKZJZ-UHFFFAOYSA-N 0 3 401.526 4.101 20 0 HIADHN C[C@H](Cc1ccc(Br)cc1)Nc1ccccc1CN1CCC(O)CC1 ZINC000479282718 894560819 /nfs/dbraw/zinc/56/08/19/894560819.db2.gz GBLJCIMVKRAZLW-MRXNPFEDSA-N 0 3 403.364 4.449 20 0 HIADHN CNS(=O)(=O)c1ccc([C@H](C)N[C@H]2CCCc3cc(Br)ccc32)cc1 ZINC000479344513 894639324 /nfs/dbraw/zinc/63/93/24/894639324.db2.gz KZZWESAIKGSLFJ-DJJJIMSYSA-N 0 3 423.376 4.085 20 0 HIADHN C[C@@H](NC1CCC2(CCOCC2)CC1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479428305 894742044 /nfs/dbraw/zinc/74/20/44/894742044.db2.gz ZJKZAYAFOAYOPJ-GFCCVEGCSA-N 0 3 421.390 4.031 20 0 HIADHN C[C@@H]1CCCN(S(=O)(=O)c2ccc(CN[C@@H]3CCc4ccc(F)cc43)cc2)C1 ZINC000479433050 894748910 /nfs/dbraw/zinc/74/89/10/894748910.db2.gz XOIUUBJOSDUEKM-OPAMFIHVSA-N 0 3 402.535 4.023 20 0 HIADHN Fc1ccc([C@@H](NCCCCn2cc(Br)cn2)c2ccccn2)cc1 ZINC000479448056 894764506 /nfs/dbraw/zinc/76/45/06/894764506.db2.gz REVUXEKLEKWWJD-LJQANCHMSA-N 0 3 403.299 4.339 20 0 HIADHN Fc1ccc([C@@H](NCCCCn2cc(Br)cn2)c2cccnc2)cc1 ZINC000479462565 894785809 /nfs/dbraw/zinc/78/58/09/894785809.db2.gz GMLNGYZRKMIWSP-LJQANCHMSA-N 0 3 403.299 4.339 20 0 HIADHN Fc1ccc([C@@H](NC2CC(N3CCC(C(F)(F)F)CC3)C2)c2cnccn2)cc1 ZINC000479472761 894796919 /nfs/dbraw/zinc/79/69/19/894796919.db2.gz VBRGKARQPLACAY-AFMYVXGZSA-N 0 3 408.443 4.100 20 0 HIADHN CC(=O)N1CCC[C@H](CN[C@H](c2ccccc2)c2ccccc2Br)C1 ZINC000479474480 894798449 /nfs/dbraw/zinc/79/84/49/894798449.db2.gz DFYKXHRKPBQIRA-DYESRHJHSA-N 0 3 401.348 4.387 20 0 HIADHN CCN(Cc1ccc(OCc2cccs2)c(OC)c1)C(=O)[C@H](C(C)C)N(C)C ZINC000479484012 894805819 /nfs/dbraw/zinc/80/58/19/894805819.db2.gz GRWSVUXQZVFYED-NRFANRHFSA-N 0 3 404.576 4.270 20 0 HIADHN COC(=O)[C@H](NC1CCN([C@@H](C)c2ccncc2)CC1)c1ccc(Cl)c(Cl)c1 ZINC000479487635 894809437 /nfs/dbraw/zinc/80/94/37/894809437.db2.gz HVQKOYMYCVJRFG-VBKZILBWSA-N 0 3 422.356 4.418 20 0 HIADHN C[C@H](NCC1(S(C)(=O)=O)CC1)c1ccc(-c2ccc(Br)cc2)s1 ZINC000479490487 894810668 /nfs/dbraw/zinc/81/06/68/894810668.db2.gz PSWAGTQQBPNZDL-LBPRGKRZSA-N 0 3 414.390 4.405 20 0 HIADHN COc1ccc(NC(=O)[C@H](N[C@@H]2CCc3cnn(C(C)C)c3C2)c2ccccc2)cc1 ZINC000479490157 894810747 /nfs/dbraw/zinc/81/07/47/894810747.db2.gz SAHACDKKQNNHHJ-ZJSXRUAMSA-N 0 3 418.541 4.300 20 0 HIADHN C[C@@H](NCc1ccc2ncccc2c1)c1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000479507184 894821718 /nfs/dbraw/zinc/82/17/18/894821718.db2.gz ZFERNPYFLZOBOV-GOSISDBHSA-N 0 3 409.555 4.260 20 0 HIADHN Cc1c([C@@H](C)NCCc2cccc(OCC(F)(F)F)c2)nnn1-c1ccccc1 ZINC000479510358 894824640 /nfs/dbraw/zinc/82/46/40/894824640.db2.gz DBMVHUCKRFZSGK-OAHLLOKOSA-N 0 3 404.436 4.410 20 0 HIADHN C[C@@H]1CN(Cc2ccccn2)CC[C@H]1Nc1ccc(NC(=O)c2ccccc2)cn1 ZINC000479535594 894840215 /nfs/dbraw/zinc/84/02/15/894840215.db2.gz AGKXSRQUSNFTKF-XMSQKQJNSA-N 0 3 401.514 4.051 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)N[C@@H](C)c2c(F)cccc2Cl)c1 ZINC000479683243 894968826 /nfs/dbraw/zinc/96/88/26/894968826.db2.gz FIFFJYWTMQVKRJ-HNNXBMFYSA-N 0 3 407.917 4.322 20 0 HIADHN CN(Cc1ccc(F)cc1Br)C(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000479729343 895027166 /nfs/dbraw/zinc/02/71/66/895027166.db2.gz LJJDLQYGVAMCER-RBUKOAKNSA-N 0 3 420.326 4.175 20 0 HIADHN CN(C(=O)NCc1ncoc1-c1ccccc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000479742376 895041135 /nfs/dbraw/zinc/04/11/35/895041135.db2.gz HVEORUMISBYARC-OAQYLSRUSA-N 0 3 404.514 4.148 20 0 HIADHN CCOC(=O)c1cc(NC[C@H](c2ccccc2OC)N2CCCC2)ncc1Cl ZINC000479867336 895207855 /nfs/dbraw/zinc/20/78/55/895207855.db2.gz UVRJRZCDEYIOOA-GOSISDBHSA-N 0 3 403.910 4.169 20 0 HIADHN C[C@H]1CN(Cc2cccc(CNCc3cccc(C(=O)OC(C)(C)C)c3)c2)CCO1 ZINC000479918161 895266359 /nfs/dbraw/zinc/26/63/59/895266359.db2.gz CFRKWIIABXWQCG-IBGZPJMESA-N 0 3 410.558 4.152 20 0 HIADHN C[C@@H]1CN(Cc2cccc(CNCc3cccc(C(=O)OC(C)(C)C)c3)c2)CCO1 ZINC000479918164 895266634 /nfs/dbraw/zinc/26/66/34/895266634.db2.gz CFRKWIIABXWQCG-LJQANCHMSA-N 0 3 410.558 4.152 20 0 HIADHN CC[C@@H](C)n1ncc(C(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)c1C ZINC000479943505 895296416 /nfs/dbraw/zinc/29/64/16/895296416.db2.gz UAOABPJZMYFKNA-OAHLLOKOSA-N 0 3 410.484 4.385 20 0 HIADHN CC(C)[C@@H](Sc1ccccc1)C(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000479961343 895315582 /nfs/dbraw/zinc/31/55/82/895315582.db2.gz HCXPIEZJOUTLJM-HSZRJFAPSA-N 0 3 412.599 4.076 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3CCC[C@@H](C(F)(F)F)[C@@H]3C)c(C)c2)CC1 ZINC000479966100 895320264 /nfs/dbraw/zinc/32/02/64/895320264.db2.gz QTUSEUHFWXNXJF-FUHWJXTLSA-N 0 3 412.500 4.332 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3CCC[C@H](C(F)(F)F)[C@H]3C)c(C)c2)CC1 ZINC000479966099 895320674 /nfs/dbraw/zinc/32/06/74/895320674.db2.gz QTUSEUHFWXNXJF-AEFFLSMTSA-N 0 3 412.500 4.332 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)NC(C)(C)CC[NH+]3CCCCCC3)cc2)cc(=O)[n-]1 ZINC000480014105 895365528 /nfs/dbraw/zinc/36/55/28/895365528.db2.gz FYEAEJVNJWSDTK-UHFFFAOYSA-N 0 3 411.550 4.324 20 0 HIADHN COc1cc(OC)c([C@H](C)NC[C@@H](c2ccc(F)cc2)N2CCOCC2)cc1Cl ZINC000480068948 895420027 /nfs/dbraw/zinc/42/00/27/895420027.db2.gz KSXHTRRSOGKIPN-YWZLYKJASA-N 0 3 422.928 4.220 20 0 HIADHN CCCc1c(NC(=O)NC[C@@H](N[C@H](C)CC)c2ccco2)cnn1-c1cc(C)ccn1 ZINC000480077480 895431437 /nfs/dbraw/zinc/43/14/37/895431437.db2.gz LETSMJKJZOLUDB-IEBWSBKVSA-N 0 3 424.549 4.372 20 0 HIADHN COc1ccc([C@@H](CN[C@@H](C)c2nnn(-c3ccc(F)cc3)c2C)N2CCCC2)cc1 ZINC000480084465 895443725 /nfs/dbraw/zinc/44/37/25/895443725.db2.gz ROXOZFHQZHNZPX-GAJHUEQPSA-N 0 3 423.536 4.211 20 0 HIADHN COc1cc(C(=O)N(C)CCN(C)C)ccc1OCc1ccc(Cl)cc1Cl ZINC000480088953 895450450 /nfs/dbraw/zinc/45/04/50/895450450.db2.gz DFXHGENDYUQERS-UHFFFAOYSA-N 0 3 411.329 4.215 20 0 HIADHN CCCc1c(NC(=O)N[C@H](CN(C)C)c2ccc(F)cc2)cnn1-c1cc(C)ccn1 ZINC000480098413 895463944 /nfs/dbraw/zinc/46/39/44/895463944.db2.gz OAWDDVBAFYAART-HXUWFJFHSA-N 0 3 424.524 4.092 20 0 HIADHN O=S1(=O)CC[C@@H](N[C@@H](Cc2ccccc2)C2CC2)c2cc(Br)ccc21 ZINC000480159215 895544657 /nfs/dbraw/zinc/54/46/57/895544657.db2.gz KYQBGRLDYQOYNR-MOPGFXCFSA-N 0 3 420.372 4.279 20 0 HIADHN Cc1cc(C)c(CCN[C@H]2CCS(=O)(=O)c3ccc(Br)cc32)c(C)c1 ZINC000480160922 895546659 /nfs/dbraw/zinc/54/66/59/895546659.db2.gz DNRNDFSFEQAKKU-IBGZPJMESA-N 0 3 422.388 4.425 20 0 HIADHN Cc1c(C(F)(F)F)nn(C)c1NC(=O)NC[C@@H](c1ccc(C)cc1)N1CCCC1 ZINC000480162831 895551689 /nfs/dbraw/zinc/55/16/89/895551689.db2.gz RJGNWCGYCZPGOY-INIZCTEOSA-N 0 3 409.456 4.014 20 0 HIADHN CC(C)[C@@H](CN[C@@H]1CCS(=O)(=O)c2ccc(Br)cc21)c1cccnc1 ZINC000480173095 895565417 /nfs/dbraw/zinc/56/54/17/895565417.db2.gz VFRHFIPEMFZUPJ-QZTJIDSGSA-N 0 3 423.376 4.092 20 0 HIADHN O=S1(=O)CC[C@H](NCCC2Cc3ccccc3C2)c2cc(Br)ccc21 ZINC000480185361 895580893 /nfs/dbraw/zinc/58/08/93/895580893.db2.gz UEADAVNFGRIQDC-IBGZPJMESA-N 0 3 420.372 4.062 20 0 HIADHN CC(C)CSCCCN[C@H]1CCS(=O)(=O)c2ccc(Br)cc21 ZINC000480187915 895583308 /nfs/dbraw/zinc/58/33/08/895583308.db2.gz DEAPVLQJHCPSSW-HNNXBMFYSA-N 0 3 406.411 4.037 20 0 HIADHN CCS[C@@H]1CCC[C@H](N[C@H]2CCS(=O)(=O)c3ccc(Br)cc32)C1 ZINC000480194633 895591118 /nfs/dbraw/zinc/59/11/18/895591118.db2.gz AVIQLOVKUJICAD-LZWOXQAQSA-N 0 3 418.422 4.322 20 0 HIADHN COc1cc(CN2CCC(Cc3ccccc3)CC2)ccc1OCC(=O)N1CCCC1 ZINC000505325571 913987415 /nfs/dbraw/zinc/98/74/15/913987415.db2.gz IUNDIEZSYGQRCE-UHFFFAOYSA-N 0 3 422.569 4.151 20 0 HIADHN CC(C)[C@@H]1CCC[C@H](N[C@@H]2CCS(=O)(=O)c3ccc(Br)cc32)C1 ZINC000480256396 895666400 /nfs/dbraw/zinc/66/64/00/895666400.db2.gz AQUXUDOEGRGBBT-UKPHBRMFSA-N 0 3 400.382 4.472 20 0 HIADHN COc1ccc(OC)c([C@@H](C)NC[C@H](c2ccccc2Cl)N2CCOCC2)c1 ZINC000480262496 895670284 /nfs/dbraw/zinc/67/02/84/895670284.db2.gz KNLZUJPVWUMMCV-IIBYNOLFSA-N 0 3 404.938 4.081 20 0 HIADHN C[C@@H](NCc1ccnc(N2CCCC2)c1)c1ccc(I)cc1 ZINC000480292795 895697893 /nfs/dbraw/zinc/69/78/93/895697893.db2.gz OCWQVKJHFBKXOR-CQSZACIVSA-N 0 3 407.299 4.137 20 0 HIADHN C[C@@H](CCc1ccccc1)N[C@H]1CCS(=O)(=O)c2ccc(Br)cc21 ZINC000480327974 895730595 /nfs/dbraw/zinc/73/05/95/895730595.db2.gz MZHXVJVAYIKFFE-KSSFIOAISA-N 0 3 408.361 4.279 20 0 HIADHN O=S1(=O)CC[C@H](NCCc2cccc(Cl)c2)c2cc(Br)ccc21 ZINC000480332390 895735809 /nfs/dbraw/zinc/73/58/09/895735809.db2.gz KOJTXZVHKUGGAH-INIZCTEOSA-N 0 3 414.752 4.153 20 0 HIADHN Cc1ccc(Br)cc1NC(=O)CCNCc1ccc(N(C)C(C)C)nc1 ZINC000480366753 895773552 /nfs/dbraw/zinc/77/35/52/895773552.db2.gz ZUSWAXXYVTUSKN-UHFFFAOYSA-N 0 3 419.367 4.116 20 0 HIADHN Cc1ccc(CN[C@H](C)c2ccc(S(=O)(=O)NCc3ccco3)cc2)cc1F ZINC000480402323 895805694 /nfs/dbraw/zinc/80/56/94/895805694.db2.gz OLIIZEGBDMBWPH-MRXNPFEDSA-N 0 3 402.491 4.056 20 0 HIADHN COc1cc([C@@H](C)N[C@@H](CN2CCOCC2)c2ccc(C)cc2)ccc1SC ZINC000480413315 895812554 /nfs/dbraw/zinc/81/25/54/895812554.db2.gz FTLIEUYQFWIPSK-NQIIRXRSSA-N 0 3 400.588 4.450 20 0 HIADHN C[C@@H](N[C@H](CN1CCOCC1)c1ccccc1)c1ccc(F)c(Br)c1 ZINC000480446626 895835492 /nfs/dbraw/zinc/83/54/92/895835492.db2.gz LEYGYVNROJBMTH-FOIQADDNSA-N 0 3 407.327 4.312 20 0 HIADHN C[C@@H](O)[C@@](C)(CNCc1nc2cc(C(F)(F)F)ccc2n1C)Cc1ccccc1 ZINC000480449349 895837923 /nfs/dbraw/zinc/83/79/23/895837923.db2.gz YHNGHZWFXRNTNB-QVKFZJNVSA-N 0 3 405.464 4.312 20 0 HIADHN C[C@H](N[C@H](CN1CCOCC1)c1ccccc1)c1ccc(OCC(F)(F)F)cc1 ZINC000480465537 895848535 /nfs/dbraw/zinc/84/85/35/895848535.db2.gz FXGRFDBVIKFQEK-LAUBAEHRSA-N 0 3 408.464 4.352 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CN[C@@H](C)c1cccc(N2CCOCC2)c1 ZINC000480474470 895855512 /nfs/dbraw/zinc/85/55/12/895855512.db2.gz VTLOAQKEHIIUDI-IBGZPJMESA-N 0 3 404.558 4.236 20 0 HIADHN COC(=O)c1csc(-c2cccc(CNCc3c[nH]nc3-c3ccc(F)cc3)c2)n1 ZINC000480478373 895857994 /nfs/dbraw/zinc/85/79/94/895857994.db2.gz RTXFCXOJICWVOL-UHFFFAOYSA-N 0 3 422.485 4.416 20 0 HIADHN COc1ccc(Br)cc1CN(C)CC1CCN(C(=O)C(C)(C)C)CC1 ZINC000480525020 895889060 /nfs/dbraw/zinc/88/90/60/895889060.db2.gz GJWIWBODCRCZAF-UHFFFAOYSA-N 0 3 411.384 4.174 20 0 HIADHN COc1ccc(C(=O)N2CC[C@H](CN(C)Cc3cccnc3)C2)c(OC2CCCC2)c1 ZINC000480528405 895892217 /nfs/dbraw/zinc/89/22/17/895892217.db2.gz QPAGGBSUHVDJRW-HXUWFJFHSA-N 0 3 423.557 4.006 20 0 HIADHN CC(C)Oc1ccc(CN[C@@H](C)c2ccc(S(=O)(=O)N3CCCCC3)cc2)cc1 ZINC000480536806 895898838 /nfs/dbraw/zinc/89/88/38/895898838.db2.gz DIOGOVPUYYOWCL-IBGZPJMESA-N 0 3 416.587 4.499 20 0 HIADHN C[C@H](NC1CCN(c2ccccn2)CC1)c1ccccc1I ZINC000480608656 895973987 /nfs/dbraw/zinc/97/39/87/895973987.db2.gz KNQLURBQVBMQIE-AWEZNQCLSA-N 0 3 407.299 4.006 20 0 HIADHN CN1CCN(C(=O)c2ccc(CN[C@H]3CCc4c3ccc(Cl)c4Cl)cc2)CC1 ZINC000480612198 895979410 /nfs/dbraw/zinc/97/94/10/895979410.db2.gz QDEKTXITSMAQBF-FQEVSTJZSA-N 0 3 418.368 4.158 20 0 HIADHN CC(C)Oc1cccc([C@H](C)N[C@@H](C)c2cccc(N3CCCS3(=O)=O)c2)c1 ZINC000480620698 895987678 /nfs/dbraw/zinc/98/76/78/895987678.db2.gz ZAOJUXLGQFVAQZ-ROUUACIJSA-N 0 3 402.560 4.426 20 0 HIADHN CCOc1ccc([C@H](C)NCc2ccc(N3C[C@@H](C)O[C@@H](C)C3)nc2)cc1OCC ZINC000480622732 895990742 /nfs/dbraw/zinc/99/07/42/895990742.db2.gz WCVUSYDEXYDYFH-OTWHNJEPSA-N 0 3 413.562 4.343 20 0 HIADHN COc1cc([C@H](C)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)nc2)ccc1OC(F)F ZINC000480627094 895994123 /nfs/dbraw/zinc/99/41/23/895994123.db2.gz RCQIXQLZEUQYKP-JYJNAYRXSA-N 0 3 421.488 4.156 20 0 HIADHN Clc1sc(CNCc2cccc(CN3CCOCC3)c2)cc1Br ZINC000480632983 896002167 /nfs/dbraw/zinc/00/21/67/896002167.db2.gz DPZDAAZLYWNPNH-UHFFFAOYSA-N 0 3 415.784 4.286 20 0 HIADHN Cn1cc([C@@H](NC2CCN(c3ccc(F)cc3F)CC2)c2ccc(F)cc2)cn1 ZINC000480659305 896026046 /nfs/dbraw/zinc/02/60/46/896026046.db2.gz DCOVNUDITUQLKD-QFIPXVFZSA-N 0 3 400.448 4.185 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)c1cccc(C(=O)Nc2ccccc2)c1 ZINC000505361632 914026597 /nfs/dbraw/zinc/02/65/97/914026597.db2.gz GXDWFFOKFWPKMN-UHFFFAOYSA-N 0 3 413.521 4.117 20 0 HIADHN Clc1sc(CNCc2ccccc2CN2CCOCC2)cc1Br ZINC000480664614 896030734 /nfs/dbraw/zinc/03/07/34/896030734.db2.gz ASXYUKBFHFHNDH-UHFFFAOYSA-N 0 3 415.784 4.286 20 0 HIADHN Cc1onc(-c2ccccn2)c1C(=O)NC[C@H](c1ccccc1)N1CCC(C)CC1 ZINC000480691202 896052846 /nfs/dbraw/zinc/05/28/46/896052846.db2.gz VGOIHMBTWPXJOT-OAQYLSRUSA-N 0 3 404.514 4.248 20 0 HIADHN Cc1nnc(-c2ccccc2C(=O)NC[C@@H](c2ccccc2)N2CCC(C)CC2)o1 ZINC000480691575 896054203 /nfs/dbraw/zinc/05/42/03/896054203.db2.gz WCSXOJHTWACCFZ-QFIPXVFZSA-N 0 3 404.514 4.248 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N1CCC[C@H]1c1ccc2c(c1)OCO2 ZINC000480701614 896063728 /nfs/dbraw/zinc/06/37/28/896063728.db2.gz KPDAAFBIZKHCNS-ZWKOTPCHSA-N 0 3 413.543 4.160 20 0 HIADHN CCNC(=O)COc1ccc(CN[C@@H](C)c2cccc(-c3ccncc3)c2)cc1OC ZINC000480706507 896068924 /nfs/dbraw/zinc/06/89/24/896068924.db2.gz JHGVTUPWNISTEP-SFHVURJKSA-N 0 3 419.525 4.123 20 0 HIADHN C[C@@H](NCc1ccc(N2CCCS2(=O)=O)c(F)c1)c1cc2c(s1)CCCC2 ZINC000480717287 896077505 /nfs/dbraw/zinc/07/75/05/896077505.db2.gz LYXCTUVDGCAKIC-CQSZACIVSA-N 0 3 408.564 4.157 20 0 HIADHN COCCOc1ccc([C@@H](C)N[C@@H](C)c2ccc3c(c2)C(C)(C)C(=O)N3)cc1OC ZINC000480719117 896079241 /nfs/dbraw/zinc/07/92/41/896079241.db2.gz PGURKSXQDGHLJX-JKSUJKDBSA-N 0 3 412.530 4.362 20 0 HIADHN COc1ccc2ccccc2c1-c1cc(CN2CCC[C@@H](C(=O)NCC3CC3)C2)on1 ZINC000480723011 896083464 /nfs/dbraw/zinc/08/34/64/896083464.db2.gz ZPJBGUJMDLMVAV-LJQANCHMSA-N 0 3 419.525 4.242 20 0 HIADHN C[C@@H](NCc1ccc(N2CCCS2(=O)=O)c(F)c1)c1ccc2c(c1)CCCC2 ZINC000480723435 896085125 /nfs/dbraw/zinc/08/51/25/896085125.db2.gz YXUOEIVZYKRVKW-MRXNPFEDSA-N 0 3 402.535 4.095 20 0 HIADHN CCCOc1ccc([C@H](C)N[C@@H](C)c2cccc(NS(C)(=O)=O)c2)cc1OC ZINC000480742675 896104897 /nfs/dbraw/zinc/10/48/97/896104897.db2.gz RVZQMJNZRYLETL-HOTGVXAUSA-N 0 3 406.548 4.267 20 0 HIADHN CNS(=O)(=O)c1ccc([C@@H](C)NCc2ccccc2COCc2ccccc2)cc1 ZINC000480753963 896115040 /nfs/dbraw/zinc/11/50/40/896115040.db2.gz JZRNERICVWAOOL-LJQANCHMSA-N 0 3 424.566 4.162 20 0 HIADHN C[C@@H](NCCCCN1C(=O)NC2(CCCC2)C1=O)c1nc(-c2ccccc2)cs1 ZINC000480752100 896115450 /nfs/dbraw/zinc/11/54/50/896115450.db2.gz XGKXZRIHOHBBFM-MRXNPFEDSA-N 0 3 412.559 4.106 20 0 HIADHN CNS(=O)(=O)c1ccc([C@H](C)NCc2cccc(COCc3ccccc3)c2)cc1 ZINC000480764999 896126921 /nfs/dbraw/zinc/12/69/21/896126921.db2.gz YPDKKELBSBQYBL-IBGZPJMESA-N 0 3 424.566 4.162 20 0 HIADHN C[C@H](NC[C@@H]1CCN(c2ccccc2)C1)c1ccccc1I ZINC000480774770 896137973 /nfs/dbraw/zinc/13/79/73/896137973.db2.gz VVKODHFEWAZNJR-HOTGVXAUSA-N 0 3 406.311 4.468 20 0 HIADHN CCOCc1ccc(CN[C@H](C)c2ccc(S(=O)(=O)N(CC)CC)cc2)cc1 ZINC000480781805 896149000 /nfs/dbraw/zinc/14/90/00/896149000.db2.gz SMZOYPRBUJRADX-GOSISDBHSA-N 0 3 404.576 4.104 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCc3nccc4ccccc43)c(C)c2)CC1 ZINC000505376890 914039439 /nfs/dbraw/zinc/03/94/39/914039439.db2.gz JLGYILLKPGXWFT-UHFFFAOYSA-N 0 3 403.530 4.007 20 0 HIADHN CCN(Cc1ccc(OC)cc1OC)C(=O)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000480862514 896228207 /nfs/dbraw/zinc/22/82/07/896228207.db2.gz HBABAQZGCBYIKX-QFIPXVFZSA-N 0 3 411.546 4.072 20 0 HIADHN CCOc1ccc(Oc2cc(CN[C@@H](C)c3ccc(-n4cnnn4)cc3)ccn2)cc1 ZINC000480893939 896250327 /nfs/dbraw/zinc/25/03/27/896250327.db2.gz CSKYLLUISBRNDW-KRWDZBQOSA-N 0 3 416.485 4.099 20 0 HIADHN C[C@@H](NCCCS(=O)(=O)Cc1ccccc1)c1cccc(OC(F)(F)F)c1 ZINC000480893735 896251047 /nfs/dbraw/zinc/25/10/47/896251047.db2.gz DGXOBSPNAGZAOZ-OAHLLOKOSA-N 0 3 401.450 4.241 20 0 HIADHN O=C1CCCN1Cc1ccc(CN[C@H]2CCc3c2cc(Br)cc3F)cc1 ZINC000480896596 896253329 /nfs/dbraw/zinc/25/33/29/896253329.db2.gz JXQIWHZDVWFGOY-FQEVSTJZSA-N 0 3 417.322 4.488 20 0 HIADHN C[C@H](NCc1ccc(CN2CCN(C)CC2)cc1)c1ccc(F)cc1Br ZINC000480896468 896253642 /nfs/dbraw/zinc/25/36/42/896253642.db2.gz CNNDEQKQOSSMAT-INIZCTEOSA-N 0 3 420.370 4.186 20 0 HIADHN CC(C)NC(=O)Nc1ccc([C@H](C)NCc2ccc(CN3CCCC3=O)cc2)cc1 ZINC000480899897 896254288 /nfs/dbraw/zinc/25/42/88/896254288.db2.gz PYCJGPROWVSKKX-SFHVURJKSA-N 0 3 408.546 4.190 20 0 HIADHN C[C@H](NCc1ccc(CS(C)(=O)=O)cc1)c1ccc(OCC(F)(F)F)cc1 ZINC000480902643 896259110 /nfs/dbraw/zinc/25/91/10/896259110.db2.gz CHNWXTGCOQTQDY-AWEZNQCLSA-N 0 3 401.450 4.023 20 0 HIADHN C[C@H]1C[C@H](NCc2ccc(CS(C)(=O)=O)cc2)c2cccc(Br)c21 ZINC000480910298 896266479 /nfs/dbraw/zinc/26/64/79/896266479.db2.gz ORUSEJSHDKEVAP-UGSOOPFHSA-N 0 3 408.361 4.332 20 0 HIADHN COc1ccc([C@H](Cc2ccccc2C)N[C@H]2CCCN(C(C)C)C2=O)cc1OC ZINC000481064558 896385199 /nfs/dbraw/zinc/38/51/99/896385199.db2.gz VJBVFEPFCDODBU-VXKWHMMOSA-N 0 3 410.558 4.285 20 0 HIADHN COc1ccc2ccccc2c1-c1cc(CN2CCC[C@H](CN3CCOCC3)C2)on1 ZINC000481072559 896392093 /nfs/dbraw/zinc/39/20/93/896392093.db2.gz JROBJPHDHCRANW-LJQANCHMSA-N 0 3 421.541 4.048 20 0 HIADHN CCOc1ccc([C@H](C)NC(=O)N[C@H]2CCN(Cc3ccccc3)[C@H]2C)cc1OC ZINC000481117495 896442374 /nfs/dbraw/zinc/44/23/74/896442374.db2.gz XVJKGNMYGXABGX-WFXMLNOXSA-N 0 3 411.546 4.117 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)C[C@H]3CCc4ccccc4C3)CC2)c1 ZINC000481147253 896474661 /nfs/dbraw/zinc/47/46/61/896474661.db2.gz UKFSOYSNTBHDQW-QHCPKHFHSA-N 0 3 419.613 4.209 20 0 HIADHN CNS(=O)(=O)c1ccc([C@@H](C)N[C@H](C)c2ccc(OCCC(C)C)cc2)cc1 ZINC000481166329 896498717 /nfs/dbraw/zinc/49/87/17/896498717.db2.gz CVCURENLPGIGCN-QZTJIDSGSA-N 0 3 404.576 4.431 20 0 HIADHN COc1cc([C@H](C)N[C@@H](C)c2sc(-c3cccnc3)nc2C)ccc1OCCO ZINC000481175049 896509033 /nfs/dbraw/zinc/50/90/33/896509033.db2.gz JYIKFPDBQYUVAZ-GJZGRUSLSA-N 0 3 413.543 4.305 20 0 HIADHN COc1cc([C@@H](C)N[C@@H]2CCc3c2cc(Br)cc3F)ccc1OCCO ZINC000481185875 896534132 /nfs/dbraw/zinc/53/41/32/896534132.db2.gz VEAANCVWVGRXLH-KZULUSFZSA-N 0 3 424.310 4.306 20 0 HIADHN C[C@@H](NCc1ccccc1OCCN1CCOCC1)c1cc2c(s1)CCCC2 ZINC000481193226 896545235 /nfs/dbraw/zinc/54/52/35/896545235.db2.gz TZKJVUWBCPORMA-GOSISDBHSA-N 0 3 400.588 4.189 20 0 HIADHN COc1cc([C@H](C)N[C@H](C)c2ccc(F)c(Br)c2)ccc1OCCO ZINC000481195911 896547802 /nfs/dbraw/zinc/54/78/02/896547802.db2.gz YJRBSZCXSPJCGU-OLZOCXBDSA-N 0 3 412.299 4.380 20 0 HIADHN COc1ccc2cc([C@H](C)NCc3ccccc3OCCN3CCOCC3)ccc2c1 ZINC000481202617 896557249 /nfs/dbraw/zinc/55/72/49/896557249.db2.gz LUGIOSZBTBAOIU-FQEVSTJZSA-N 0 3 420.553 4.410 20 0 HIADHN C[C@@H](NCc1cccnc1N1CCN(C)CC1)c1ccc(OCc2ccccc2)cc1 ZINC000481236259 896586990 /nfs/dbraw/zinc/58/69/90/896586990.db2.gz ACJWMZBGMKUDQF-OAQYLSRUSA-N 0 3 416.569 4.263 20 0 HIADHN Cc1nc(Cc2ccccc2)sc1[C@@H](C)NCc1cccnc1N1CCN(C)CC1 ZINC000481236303 896587405 /nfs/dbraw/zinc/58/74/05/896587405.db2.gz QHYPQLJUBWKMNZ-GOSISDBHSA-N 0 3 421.614 4.040 20 0 HIADHN O=C(CN[C@H](CC1CCC1)c1ccccc1)NCCc1cnn(-c2ccccc2)c1 ZINC000481279507 896626956 /nfs/dbraw/zinc/62/69/56/896626956.db2.gz DRSZQXXESYGXDP-XMMPIXPASA-N 0 3 402.542 4.052 20 0 HIADHN CC[C@H](NCc1ccc(S(=O)(=O)N2CCC[C@H](C)C2)cc1)c1ccc(OC)cc1 ZINC000481301041 896645059 /nfs/dbraw/zinc/64/50/59/896645059.db2.gz XFBIWULRZXJKPI-MBSDFSHPSA-N 0 3 416.587 4.357 20 0 HIADHN CCC(CC)C(=O)N1CCC(N[C@@H](C)c2nnn(-c3cccc(Cl)c3)c2C)CC1 ZINC000481307085 896655068 /nfs/dbraw/zinc/65/50/68/896655068.db2.gz JBGIVNCMNFPGOD-HNNXBMFYSA-N 0 3 417.985 4.307 20 0 HIADHN Fc1ccc(N2CCN(c3cc(CN[C@H]4CCc5cc(F)ccc54)ccn3)CC2)cc1 ZINC000481313096 896660060 /nfs/dbraw/zinc/66/00/60/896660060.db2.gz IYYLLPDFSMTCJG-DEOSSOPVSA-N 0 3 420.507 4.464 20 0 HIADHN COc1ccc([C@H](C)NCc2ccnc(N3CCN(c4ccc(F)cc4)CC3)c2)cc1 ZINC000481319815 896672094 /nfs/dbraw/zinc/67/20/94/896672094.db2.gz HCDVHUBSIDIBGJ-IBGZPJMESA-N 0 3 420.532 4.407 20 0 HIADHN C[C@@H]1CCCN(S(=O)(=O)c2ccc(CN[C@H]3CCSc4ccccc43)cc2)C1 ZINC000481321688 896676041 /nfs/dbraw/zinc/67/60/41/896676041.db2.gz LHYSGBFZFZJSFK-UTKZUKDTSA-N 0 3 416.612 4.434 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)Nc3cnn(CC(C)C)c3C3CC3)c2)CC1 ZINC000481331107 896690510 /nfs/dbraw/zinc/69/05/10/896690510.db2.gz OJWTYYOGRYWXSQ-UHFFFAOYSA-N 0 3 410.566 4.202 20 0 HIADHN Cc1noc(-c2ccccc2)c1NC(=O)NCC1(N2CCSCC2)CCCC1 ZINC000481447849 896844974 /nfs/dbraw/zinc/84/49/74/896844974.db2.gz MWNRCEFPBVLOJH-UHFFFAOYSA-N 0 3 400.548 4.133 20 0 HIADHN Cc1noc(-c2ccccc2)c1NC(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000481465148 896857661 /nfs/dbraw/zinc/85/76/61/896857661.db2.gz NEJDLSXIYZSOJA-IAGOWNOFSA-N 0 3 412.534 4.003 20 0 HIADHN CCCN(CCc1cccs1)C(=O)Nc1cccc(N2CCN(CC)CC2)c1 ZINC000481491295 896871301 /nfs/dbraw/zinc/87/13/01/896871301.db2.gz KNQRCTVJZQXJMY-UHFFFAOYSA-N 0 3 400.592 4.377 20 0 HIADHN C[C@H](COc1ccccc1C(F)(F)F)N[C@@H](C)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000481542193 896903000 /nfs/dbraw/zinc/90/30/00/896903000.db2.gz JOERMQRWEHKEBQ-OLZOCXBDSA-N 0 3 419.440 4.366 20 0 HIADHN Cc1c([C@H](C)NCC2(c3ccccc3C)CCOCC2)nnn1-c1ccc(F)cc1 ZINC000481548377 896912123 /nfs/dbraw/zinc/91/21/23/896912123.db2.gz UHSMBSOLFLOSGS-SFHVURJKSA-N 0 3 408.521 4.422 20 0 HIADHN COc1cc(OC)c([C@@H](C)NCc2cccc(CN3CCO[C@H](C)C3)c2)cc1Cl ZINC000481560373 896933398 /nfs/dbraw/zinc/93/33/98/896933398.db2.gz UZJYNOXGYKKWGN-IAGOWNOFSA-N 0 3 418.965 4.429 20 0 HIADHN Cc1nccn1-c1ccc(CN[C@@H](C)c2ccc(OCc3nccn3C)cc2)cc1F ZINC000481560035 896933453 /nfs/dbraw/zinc/93/34/53/896933453.db2.gz VERROTOCSAOYJA-KRWDZBQOSA-N 0 3 419.504 4.483 20 0 HIADHN O=C(Nc1cccc(CN[C@H]2CCc3cc(Br)ccc32)c1)[C@H]1CCCO1 ZINC000481569933 896948148 /nfs/dbraw/zinc/94/81/48/896948148.db2.gz KMCGVMAFLUNGEU-VQTJNVASSA-N 0 3 415.331 4.344 20 0 HIADHN Cc1ccc(NC(=O)C[C@@H](C)N[C@@H](CC(=O)N(C)C)c2ccccc2)c(Cl)c1 ZINC000481569326 896948906 /nfs/dbraw/zinc/94/89/06/896948906.db2.gz VVQHCWMKDCTLFK-UZLBHIALSA-N 0 3 401.938 4.175 20 0 HIADHN OC1(Cc2ccc(F)cc2)CCN(Cc2ccc(OCc3cccnc3)cc2)CC1 ZINC000481590913 896970272 /nfs/dbraw/zinc/97/02/72/896970272.db2.gz IIFMRHQLPPTVHR-UHFFFAOYSA-N 0 3 406.501 4.369 20 0 HIADHN CC[C@H](N[C@H](c1ccc(OC)cc1)C1CC1)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000481640501 897024073 /nfs/dbraw/zinc/02/40/73/897024073.db2.gz KOWQNRJDJMZSLU-FPOVZHCZSA-N 0 3 422.978 4.449 20 0 HIADHN COc1cccc(F)c1NC(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1 ZINC000481640945 897024200 /nfs/dbraw/zinc/02/42/00/897024200.db2.gz TXLUQCQBXSSRIU-UHFFFAOYSA-N 0 3 413.415 4.449 20 0 HIADHN Cc1cc(NC(=O)c2ccc(C(F)(F)F)nc2)cc(N2CCN(C(C)C)CC2)c1 ZINC000481654398 897039098 /nfs/dbraw/zinc/03/90/98/897039098.db2.gz IUZMPJNYRRBCLQ-UHFFFAOYSA-N 0 3 406.452 4.192 20 0 HIADHN O=C(NCc1ccncc1)Nc1cccc(CN[C@@H](c2cccnc2)C2CCC2)c1 ZINC000481654911 897039402 /nfs/dbraw/zinc/03/94/02/897039402.db2.gz DIZMCDQYPUHBHQ-HSZRJFAPSA-N 0 3 401.514 4.429 20 0 HIADHN C[C@@H](NCCNc1ccc(-c2ccccc2)nn1)c1ccc(-n2cncn2)cc1Cl ZINC000481671063 897055380 /nfs/dbraw/zinc/05/53/80/897055380.db2.gz PJFPRUIIUPDGIW-MRXNPFEDSA-N 0 3 419.920 4.140 20 0 HIADHN CCOCCOc1ccc(Cl)cc1NC(=O)NC[C@@H](c1ccc(C)cc1)N(C)C ZINC000481685139 897069839 /nfs/dbraw/zinc/06/98/39/897069839.db2.gz OAYNUKPPWOTEFN-FQEVSTJZSA-N 0 3 419.953 4.488 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1cc(F)c(OC)cc1C)c1cccc(OC)c1 ZINC000481724343 897117989 /nfs/dbraw/zinc/11/79/89/897117989.db2.gz HGJMPVREFLNACW-HXUWFJFHSA-N 0 3 403.498 4.356 20 0 HIADHN COc1cc(NC(=O)CCN2Cc3ccccc3C3(CC3)C2)c(OC)cc1Cl ZINC000481724543 897118306 /nfs/dbraw/zinc/11/83/06/897118306.db2.gz MVZXGNJSVXDDPV-UHFFFAOYSA-N 0 3 400.906 4.233 20 0 HIADHN COc1ccc([C@H](C)N[C@@H](C)c2ccc(S(=O)(=O)N3CCCCC3)cc2)cc1 ZINC000481734605 897129608 /nfs/dbraw/zinc/12/96/08/897129608.db2.gz KMHKIKLQHOAAMT-ROUUACIJSA-N 0 3 402.560 4.282 20 0 HIADHN COC(=O)c1ccccc1-c1ccc(CN2CCC(C(=O)N3CCC[C@H](C)C3)CC2)o1 ZINC000481913695 897296058 /nfs/dbraw/zinc/29/60/58/897296058.db2.gz HBDHNYXNENKJIB-SFHVURJKSA-N 0 3 424.541 4.204 20 0 HIADHN COc1ccc(-c2ccncc2)cc1CN1CCC(C(=O)Nc2ccc(C)cn2)CC1 ZINC000481914676 897297383 /nfs/dbraw/zinc/29/73/83/897297383.db2.gz TYKKSUAEBOIBNS-UHFFFAOYSA-N 0 3 416.525 4.311 20 0 HIADHN COc1cccc(N2CC[C@@H](CN[C@@H](C)c3nnn(-c4ccc(C)cc4)c3C)C2)c1 ZINC000481934422 897319247 /nfs/dbraw/zinc/31/92/47/897319247.db2.gz RUICWHOGHREACI-ICSRJNTNSA-N 0 3 405.546 4.070 20 0 HIADHN COC(=O)c1ccccc1-c1ccc(CNCc2ccccc2-c2cnn(C)c2)o1 ZINC000482030856 897439908 /nfs/dbraw/zinc/43/99/08/897439908.db2.gz KULVBPFEDWENJV-UHFFFAOYSA-N 0 3 401.466 4.424 20 0 HIADHN CC(=O)N1CCN(c2ccccc2CN[C@@H](C)c2ccc(Br)s2)CC1 ZINC000482047442 897471199 /nfs/dbraw/zinc/47/11/99/897471199.db2.gz VSHCTIBMTWJSKZ-AWEZNQCLSA-N 0 3 422.392 4.030 20 0 HIADHN O=C(CCc1ncc(-c2ccc(F)cc2F)o1)N1CCN(C2CCCCC2)CC1 ZINC000482059602 897488099 /nfs/dbraw/zinc/48/80/99/897488099.db2.gz IHJPNPMOARSVNT-UHFFFAOYSA-N 0 3 403.473 4.029 20 0 HIADHN C[C@@H](C(=O)NCCCN1CCN(C)C[C@H]1c1ccccc1)c1cc2ccccc2o1 ZINC000482101641 897549918 /nfs/dbraw/zinc/54/99/18/897549918.db2.gz HXSWRBCRQXWFNR-KNQAVFIVSA-N 0 3 405.542 4.031 20 0 HIADHN COCCC[C@H](NCC(=O)Nc1ccc(F)cc1)c1ccc(Br)cc1 ZINC000482108259 897557511 /nfs/dbraw/zinc/55/75/11/897557511.db2.gz HEVVSWVDIXSJAW-SFHVURJKSA-N 0 3 409.299 4.284 20 0 HIADHN COc1cc([C@H](C)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)ccc1OC(F)F ZINC000482124348 897581558 /nfs/dbraw/zinc/58/15/58/897581558.db2.gz ROLVCMSWIWCHFZ-QFBILLFUSA-N 0 3 418.484 4.181 20 0 HIADHN C[C@@H](NCc1ccc(NC(=O)c2cccnc2)cc1)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000482148571 897610765 /nfs/dbraw/zinc/61/07/65/897610765.db2.gz TYXXOGDLZRKPPJ-MRXNPFEDSA-N 0 3 414.509 4.414 20 0 HIADHN C[C@@H]1Cc2ccccc2N1Cc1ccoc1C(=O)NC[C@H](c1ccccc1)N(C)C ZINC000482189895 897661319 /nfs/dbraw/zinc/66/13/19/897661319.db2.gz ADYLLHZYPMHXGM-WZONZLPQSA-N 0 3 403.526 4.264 20 0 HIADHN COC(=O)c1ccc(Cl)c(CNCCCc2nc(-c3ccncc3)cs2)c1 ZINC000482249971 897731281 /nfs/dbraw/zinc/73/12/81/897731281.db2.gz PTHNQOUYZVEDAC-UHFFFAOYSA-N 0 3 401.919 4.368 20 0 HIADHN CN(C)C[C@@H](NC(=O)Nc1c(F)cc(F)cc1Br)c1ccc(F)cc1 ZINC000482331212 897835492 /nfs/dbraw/zinc/83/54/92/897835492.db2.gz FWALHAOTEUUPJC-OAHLLOKOSA-N 0 3 416.241 4.291 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)c2ccc(Oc3ccccc3)nc2)c1 ZINC000482347619 897858697 /nfs/dbraw/zinc/85/86/97/897858697.db2.gz XRVDBJJVIIGVJE-UHFFFAOYSA-N 0 3 405.498 4.087 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)CCc2ccc(-c3ccccc3)[nH]2)c1 ZINC000482359131 897876349 /nfs/dbraw/zinc/87/63/49/897876349.db2.gz PQSVJCZFIWSITE-UHFFFAOYSA-N 0 3 405.542 4.213 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)c2csc(-c3cccs3)n2)c1 ZINC000482387566 897918906 /nfs/dbraw/zinc/91/89/06/897918906.db2.gz CHZHHIJJVQAXLX-UHFFFAOYSA-N 0 3 401.557 4.084 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)c2cc(-c3ccccc3Cl)on2)c1 ZINC000482400259 897939385 /nfs/dbraw/zinc/93/93/85/897939385.db2.gz FUZPFEKBMUNVKR-UHFFFAOYSA-N 0 3 413.905 4.208 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1cc(C(=O)OC)ccc1C(C)C)c1ccco1 ZINC000482425847 897979124 /nfs/dbraw/zinc/97/91/24/897979124.db2.gz YBLYYSNRMWZAFI-HNAYVOBHSA-N 0 3 401.507 4.441 20 0 HIADHN C[C@H](NC(=O)N[C@@H](c1ccccc1C(F)(F)F)C(F)(F)F)C1=CCN(C)CC1 ZINC000482451244 898017837 /nfs/dbraw/zinc/01/78/37/898017837.db2.gz MWSMQVBBYIXHBM-NHYWBVRUSA-N 0 3 409.374 4.258 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccc(F)c2)C1)N1CCC[C@]2(C1)OCc1ccccc12 ZINC000482473114 898047999 /nfs/dbraw/zinc/04/79/99/898047999.db2.gz BFGAQQSUFVULOH-CJFMBICVSA-N 0 3 408.517 4.086 20 0 HIADHN C[C@@H](NC(=O)Nc1cccc2c1CN(CC(F)(F)F)C2)[C@H](c1ccccc1)N(C)C ZINC000482475210 898051037 /nfs/dbraw/zinc/05/10/37/898051037.db2.gz JIPMWBZQAQNUJG-FOIQADDNSA-N 0 3 420.479 4.377 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)Nc1cc(Cl)ccc1OC[C@H]1CCOC1 ZINC000482486883 898066868 /nfs/dbraw/zinc/06/68/68/898066868.db2.gz ZCHJVJSKHQKCOG-SFHVURJKSA-N 0 3 423.985 4.485 20 0 HIADHN CCOc1cc(CN2CCC(c3nnc4n3CCCC4)CC2)ccc1OCC(C)C ZINC000482491262 898069896 /nfs/dbraw/zinc/06/98/96/898069896.db2.gz QRXRSVLALYNTGB-UHFFFAOYSA-N 0 3 412.578 4.428 20 0 HIADHN COCC1=CCN(Cc2cn(Cc3ccccc3)nc2-c2ccc(OC)cc2)CC1 ZINC000482502119 898082687 /nfs/dbraw/zinc/08/26/87/898082687.db2.gz CWKLVHJCQHZPIV-UHFFFAOYSA-N 0 3 403.526 4.386 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)c(C)c1CN1CCC(c2nnc3n2CCCC3)CC1 ZINC000482512812 898099007 /nfs/dbraw/zinc/09/90/07/898099007.db2.gz QLJUOPAAUNWRAI-UHFFFAOYSA-N 0 3 424.980 4.450 20 0 HIADHN COc1ccc(OC)c([C@@H](C)N[C@H](C)c2cc(F)ccc2N2CCN(C)CC2)c1 ZINC000482553193 898143881 /nfs/dbraw/zinc/14/38/81/898143881.db2.gz DJMXHLCCXTVDNV-IAGOWNOFSA-N 0 3 401.526 4.007 20 0 HIADHN CC[C@@H](NCc1nc2ccc(Cl)cc2n1C)[C@H](c1ccc(C)cc1)n1cncn1 ZINC000482582506 898178921 /nfs/dbraw/zinc/17/89/21/898178921.db2.gz RTMBLKFTYONIPR-GCJKJVERSA-N 0 3 408.937 4.284 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)c1nc(C2CC2)n(-c2ccccc2Cl)n1 ZINC000482614105 898214729 /nfs/dbraw/zinc/21/47/29/898214729.db2.gz WEKKLBBEGHLXNP-UHFFFAOYSA-N 0 3 409.921 4.420 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)c1ccccc1SCC(=O)N1CCCC1 ZINC000482618685 898220057 /nfs/dbraw/zinc/22/00/57/898220057.db2.gz RUANSLKROCSENY-UHFFFAOYSA-N 0 3 411.571 4.023 20 0 HIADHN CCOc1c(Br)cc(C(=O)Nc2cc(CN(C)C)ccc2C)cc1OC ZINC000482621635 898225252 /nfs/dbraw/zinc/22/52/52/898225252.db2.gz YJSQKGLGPYKLFT-UHFFFAOYSA-N 0 3 421.335 4.479 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)c1ccccc1 ZINC000482630380 898233808 /nfs/dbraw/zinc/23/38/08/898233808.db2.gz PUBMNOIFRGLNKK-QTJGBDASSA-N 0 3 419.569 4.469 20 0 HIADHN COc1ccc(C(C)(C)CN[C@@H](C)c2nnn(-c3ccc(F)cc3)c2C)cc1OC ZINC000482637596 898242716 /nfs/dbraw/zinc/24/27/16/898242716.db2.gz BRMQLDPPDBTFPH-HNNXBMFYSA-N 0 3 412.509 4.360 20 0 HIADHN COCCOc1ccc(Cl)cc1C(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C ZINC000482672369 898275195 /nfs/dbraw/zinc/27/51/95/898275195.db2.gz MDNACEBUPJQHAV-SFHVURJKSA-N 0 3 416.949 4.102 20 0 HIADHN CN1C(=O)C[C@H](NCc2ccc(OCc3ccccn3)cc2)[C@H]1c1ccc(F)c(F)c1 ZINC000482688312 898288197 /nfs/dbraw/zinc/28/81/97/898288197.db2.gz CPWKYSHBKVJWOY-LADGPHEKSA-N 0 3 423.463 4.000 20 0 HIADHN CC(C)(C)c1noc2ncc(C(=O)NCC3(N4CCSCC4)CCCCC3)cc21 ZINC000482745947 898350800 /nfs/dbraw/zinc/35/08/00/898350800.db2.gz AWCCVSJBHZEJCM-UHFFFAOYSA-N 0 3 416.591 4.002 20 0 HIADHN O=C(Nc1ccc(Br)cn1)C1CCN([C@@H]2CCc3ccc(F)cc32)CC1 ZINC000482829996 898438336 /nfs/dbraw/zinc/43/83/36/898438336.db2.gz XTVHQDKYUZJNKQ-GOSISDBHSA-N 0 3 418.310 4.321 20 0 HIADHN CN(CCN(Cc1ccccc1)C(=O)Cc1csc2nccn12)Cc1ccccc1 ZINC000482832256 898439897 /nfs/dbraw/zinc/43/98/97/898439897.db2.gz XPWGIAFUZZRMAR-UHFFFAOYSA-N 0 3 418.566 4.099 20 0 HIADHN CN1CCN(C)[C@H](CN[C@H](Cc2cccc(F)c2)c2ccc(Cl)c(Cl)c2)C1 ZINC000482886456 898501580 /nfs/dbraw/zinc/50/15/80/898501580.db2.gz NXVLKKSJVABYOR-WIYYLYMNSA-N 0 3 410.364 4.252 20 0 HIADHN COc1ccc(C[C@H](NC[C@H]2CN(C)CCN2C)c2cc(Cl)ccc2Cl)cc1 ZINC000482893190 898511882 /nfs/dbraw/zinc/51/18/82/898511882.db2.gz UNNORORZMQBXKZ-AVRDEDQJSA-N 0 3 422.400 4.121 20 0 HIADHN O=C(NCCc1csc(-c2ccccc2)n1)N1CCCN(Cc2ccccc2)CC1 ZINC000482902593 898520435 /nfs/dbraw/zinc/52/04/35/898520435.db2.gz YGRJRSPIVOLRHU-UHFFFAOYSA-N 0 3 420.582 4.270 20 0 HIADHN O=C(NC1CCCCC1)c1ccc(NC(=O)N2CCN(C3CCCCC3)CC2)cc1 ZINC000482924420 898543342 /nfs/dbraw/zinc/54/33/42/898543342.db2.gz CFXDNKYTBZRKCG-UHFFFAOYSA-N 0 3 412.578 4.231 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(NC(=O)c2ccncc2)cc1)c1ccc([S@](C)=O)cc1 ZINC000482941956 898565128 /nfs/dbraw/zinc/56/51/28/898565128.db2.gz AZJIRIUDCKJTDC-KRQILSMLSA-N 0 3 407.539 4.483 20 0 HIADHN C[C@@H](NC[C@@H](O)Cc1ccc(C(F)(F)F)cc1)c1ccc(Br)cn1 ZINC000482946200 898570956 /nfs/dbraw/zinc/57/09/56/898570956.db2.gz IKYYQXJFHJRUCP-ABAIWWIYSA-N 0 3 403.242 4.117 20 0 HIADHN C[C@@H]1Cc2ccccc2[C@@H]1NCc1ccccc1CN1C(=O)NC2(CCCCC2)C1=O ZINC000482968014 898600749 /nfs/dbraw/zinc/60/07/49/898600749.db2.gz ZGCLXXISYNDFRV-WZONZLPQSA-N 0 3 417.553 4.464 20 0 HIADHN CC[C@H](C)Sc1ccc(NC(=O)N2CC[C@H](N3CCN(C)CC3)[C@H](C)C2)c(C)c1 ZINC000482990578 898633673 /nfs/dbraw/zinc/63/36/73/898633673.db2.gz JHWHKDMQJZQAKX-DXIQSLLYSA-N 0 3 418.651 4.375 20 0 HIADHN CN(C(=O)c1cccc(NC(=O)N2CCN(C3CCCCC3)CC2)c1)c1ccccc1 ZINC000483003574 898652680 /nfs/dbraw/zinc/65/26/80/898652680.db2.gz HTZOCGPGSCBGON-UHFFFAOYSA-N 0 3 420.557 4.445 20 0 HIADHN CCCC[C@](C)(N[C@H]1CCN(C2CCOCC2)C1=O)c1cccc(Br)c1 ZINC000483082947 898767449 /nfs/dbraw/zinc/76/74/49/898767449.db2.gz BIRPZDUAXPNSAY-FPOVZHCZSA-N 0 3 423.395 4.224 20 0 HIADHN CC[C@@H]1CN(CCC(=O)Nc2ccc(Oc3ccccc3)cc2)C[C@]2(CCOC2)O1 ZINC000483147712 898824836 /nfs/dbraw/zinc/82/48/36/898824836.db2.gz BKBJAPOXBBLVGR-YKSBVNFPSA-N 0 3 410.514 4.077 20 0 HIADHN CC[C@H]1CN(CCC(=O)Nc2ccccc2Oc2ccccc2)C[C@]2(CCOC2)O1 ZINC000483163112 898833689 /nfs/dbraw/zinc/83/36/89/898833689.db2.gz XUFILEGHIPOFSQ-CYFREDJKSA-N 0 3 410.514 4.077 20 0 HIADHN C[C@H](NC(=O)c1ccc(C(=O)Nc2ccccc2)cc1)[C@@H](c1ccccc1)N(C)C ZINC000505587802 914292789 /nfs/dbraw/zinc/29/27/89/914292789.db2.gz OYCMSROVTPKTQF-MBSDFSHPSA-N 0 3 401.510 4.360 20 0 HIADHN OC[C@@H](NC[C@@H](O)C1CCCCC1)c1ccc(Br)cc1C(F)(F)F ZINC000483247455 898889689 /nfs/dbraw/zinc/88/96/89/898889689.db2.gz XFQYGEBFLJMLHZ-HZPDHXFCSA-N 0 3 410.274 4.032 20 0 HIADHN Cc1nc(CCN[C@@H](CO)c2ccc(Br)cc2C(F)(F)F)cs1 ZINC000483250648 898892867 /nfs/dbraw/zinc/89/28/67/898892867.db2.gz ARUDEQQDWMJVMQ-AWEZNQCLSA-N 0 3 409.271 4.099 20 0 HIADHN COc1ccc(C[C@H](N[C@@H]2CCC(=O)N(C)C2)c2cc(Cl)ccc2Cl)cc1 ZINC000483293338 898928052 /nfs/dbraw/zinc/92/80/52/898928052.db2.gz GOJBDAANSORJES-UZLBHIALSA-N 0 3 407.341 4.496 20 0 HIADHN COc1ccc(C2=NN(C(=O)CN(CC3CC3)C3CCC3)[C@@H](c3ccco3)C2)cc1 ZINC000483303176 898934233 /nfs/dbraw/zinc/93/42/33/898934233.db2.gz DMPNBNPKHRUXNW-JOCHJYFZSA-N 0 3 407.514 4.230 20 0 HIADHN C[C@H](NC(=O)c1cccc(-c2noc(C(F)(F)F)n2)c1)[C@H](c1ccccc1)N(C)C ZINC000505590134 914298150 /nfs/dbraw/zinc/29/81/50/914298150.db2.gz DXKHAQVNDOKJRM-SUMWQHHRSA-N 0 3 418.419 4.177 20 0 HIADHN Cc1nn(C)c(Sc2ccccc2)c1C(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C ZINC000505592049 914299573 /nfs/dbraw/zinc/29/95/73/914299573.db2.gz QRIPKPFTYZMIFB-UWJYYQICSA-N 0 3 408.571 4.301 20 0 HIADHN C[C@@H](NC(=O)Nc1cc(C(F)(F)F)ccc1Br)C1=CCN(C)CC1 ZINC000483365002 899002398 /nfs/dbraw/zinc/00/23/98/899002398.db2.gz MIDOTCHHUUMNRE-SNVBAGLBSA-N 0 3 406.246 4.240 20 0 HIADHN CS[C@H]1CN(C(=O)c2oc3c(cccc3Br)c2C)C[C@@H]1N1CCCC1 ZINC000483386389 899021086 /nfs/dbraw/zinc/02/10/86/899021086.db2.gz AQQFLSLBPJNURQ-HOTGVXAUSA-N 0 3 423.376 4.156 20 0 HIADHN CS[C@@H]1CN(C(=O)c2cc3cc(C)cc(Br)c3o2)C[C@@H]1N1CCCC1 ZINC000483400071 899032084 /nfs/dbraw/zinc/03/20/84/899032084.db2.gz CNMXWAFWMLGSLF-DOTOQJQBSA-N 0 3 423.376 4.156 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2CN2CC[C@@H](N3CCCC3=O)C2)c(C)c1 ZINC000483428468 899058081 /nfs/dbraw/zinc/05/80/81/899058081.db2.gz ODGBFPRTTIOHAD-HSZRJFAPSA-N 0 3 414.553 4.353 20 0 HIADHN C[C@@H](NC(=O)C1(c2cccc(Br)c2)CC1)[C@@H](c1ccccc1)N(C)C ZINC000505606027 914310106 /nfs/dbraw/zinc/31/01/06/914310106.db2.gz JMIVBPXQHXMTSZ-BEFAXECRSA-N 0 3 401.348 4.288 20 0 HIADHN Cc1noc(C)c1COc1cccc(C(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)c1 ZINC000505606189 914310665 /nfs/dbraw/zinc/31/06/65/914310665.db2.gz GQDOTVYWMMFOIK-GAJHUEQPSA-N 0 3 407.514 4.292 20 0 HIADHN COc1ccc2cc(CN(C)C(=O)[C@H](C)N3CCN(C4CCCCC4)CC3)ccc2c1 ZINC000483491683 899145668 /nfs/dbraw/zinc/14/56/68/899145668.db2.gz PGDXIVFLIZFJLJ-FQEVSTJZSA-N 0 3 423.601 4.146 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)N[C@@H](c1ccc(F)cc1)C(F)(F)F)c1ccco1 ZINC000483501201 899159756 /nfs/dbraw/zinc/15/97/56/899159756.db2.gz IRTYYUAREQGWBX-PVUWLOKVSA-N 0 3 401.404 4.451 20 0 HIADHN C[C@@H](NC(=O)Nc1cc(-c2cc(F)cc(F)c2)nn1C)[C@H](c1ccccc1)N(C)C ZINC000483576944 899230708 /nfs/dbraw/zinc/23/07/08/899230708.db2.gz RYOPHTKVMAUGQM-SPLOXXLWSA-N 0 3 413.472 4.178 20 0 HIADHN CC(C)[C@@H](CC(=O)Nc1ccccc1CN1CCC[C@H](C(N)=O)C1)c1ccccc1 ZINC000483638396 899291972 /nfs/dbraw/zinc/29/19/72/899291972.db2.gz VZWMKQNDNIMCHJ-FCHUYYIVSA-N 0 3 407.558 4.152 20 0 HIADHN CCCN1CCN(c2ccccc2CN[C@H](C)c2nc(Cc3ccccc3)no2)CC1 ZINC000483647568 899303584 /nfs/dbraw/zinc/30/35/84/899303584.db2.gz SYOAJTJHKPRVID-HXUWFJFHSA-N 0 3 419.573 4.043 20 0 HIADHN COc1ccc2[nH]c3c(c2c1)C[C@H](N[C@H](C)c1nc(-c2ccccc2OC)no1)CC3 ZINC000483656483 899316251 /nfs/dbraw/zinc/31/62/51/899316251.db2.gz QVRXHDOZTNJMGR-HUUCEWRRSA-N 0 3 418.497 4.443 20 0 HIADHN CCOc1cc(O)ccc1NC(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000483690180 899348287 /nfs/dbraw/zinc/34/82/87/899348287.db2.gz WSPTWFDGUDLPHZ-UHFFFAOYSA-N 0 3 401.532 4.026 20 0 HIADHN CCN(CC)[C@@H](C(=O)N1CCC(n2cncc2C)CC1)c1cccc(C(F)(F)F)c1 ZINC000505638843 914338966 /nfs/dbraw/zinc/33/89/66/914338966.db2.gz UGHYKGGRDQWQOD-HXUWFJFHSA-N 0 3 422.495 4.457 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2cc(F)ccc2OC(C)C)c1 ZINC000483712698 899369674 /nfs/dbraw/zinc/36/96/74/899369674.db2.gz PZLKWKFTZYNOML-UHFFFAOYSA-N 0 3 403.498 4.217 20 0 HIADHN COCCOc1ccc([C@H](C)N[C@H]2CCCN(c3ccccc3Cl)C2=O)cc1 ZINC000483716584 899374507 /nfs/dbraw/zinc/37/45/07/899374507.db2.gz VOYRUOWFHRMPAQ-JXFKEZNVSA-N 0 3 402.922 4.211 20 0 HIADHN C[C@@H](N[C@@H]1CCCN(c2ccccc2Cl)C1=O)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000483717252 899375976 /nfs/dbraw/zinc/37/59/76/899375976.db2.gz ZGJXYXLYYYRBLA-AUUYWEPGSA-N 0 3 411.933 4.416 20 0 HIADHN CS(=O)(=O)N(CCN[C@@H](Cc1ccccc1)c1cccs1)Cc1ccccc1 ZINC000483727198 899386769 /nfs/dbraw/zinc/38/67/69/899386769.db2.gz MTFRIURNBIUMBR-NRFANRHFSA-N 0 3 414.596 4.083 20 0 HIADHN CS(=O)(=O)N(CCN[C@H](Cc1ccccc1)c1cccs1)Cc1ccccc1 ZINC000483727200 899387730 /nfs/dbraw/zinc/38/77/30/899387730.db2.gz MTFRIURNBIUMBR-OAQYLSRUSA-N 0 3 414.596 4.083 20 0 HIADHN COc1ccc([C@H](CNC(=O)NC2(c3ccc(Cl)cc3)CC2)N2CCCC2)cc1 ZINC000483729819 899390486 /nfs/dbraw/zinc/39/04/86/899390486.db2.gz HOQVZVKFHZRXDT-NRFANRHFSA-N 0 3 413.949 4.474 20 0 HIADHN CNC(=O)[C@H](Cc1c[nH]c2ccccc12)N[C@H](C)c1sc(-c2cccnc2)nc1C ZINC000483751137 899412865 /nfs/dbraw/zinc/41/28/65/899412865.db2.gz ZQYLBNUNKBFBNB-VLIAUNLRSA-N 0 3 419.554 4.003 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCCC1)Nc1nnc(-c2ccsc2)s1 ZINC000483777117 899440077 /nfs/dbraw/zinc/44/00/77/899440077.db2.gz VPYKWORFTHIEDE-UHFFFAOYSA-N 0 3 423.633 4.140 20 0 HIADHN CC(C)(C)Oc1ccc(C(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)nc1 ZINC000483794159 899464344 /nfs/dbraw/zinc/46/43/44/899464344.db2.gz BPIVCQNRPUEUSW-LJQANCHMSA-N 0 3 419.529 4.155 20 0 HIADHN COc1cccc2c1[C@@H](C(=O)Nc1ccnn1[C@@H]1CCN(Cc3ccccc3)C1)CC2 ZINC000483794833 899466113 /nfs/dbraw/zinc/46/61/13/899466113.db2.gz CITDNFBVCSDICG-RTWAWAEBSA-N 0 3 416.525 4.007 20 0 HIADHN CCC(CC)(CCO)CN[C@@H](C)c1nnn(-c2cccc(Br)c2)c1C ZINC000483853571 899535969 /nfs/dbraw/zinc/53/59/69/899535969.db2.gz GDDJEGKFKJAHEJ-AWEZNQCLSA-N 0 3 409.372 4.178 20 0 HIADHN CCC(CC)(CCO)CN[C@H](C)c1nnn(-c2cccc(Br)c2)c1C ZINC000483853589 899536834 /nfs/dbraw/zinc/53/68/34/899536834.db2.gz GDDJEGKFKJAHEJ-CQSZACIVSA-N 0 3 409.372 4.178 20 0 HIADHN CCOc1c(Br)cc(C(=O)Nc2ccc(C)cc2CN(C)C)cc1OC ZINC000505659466 914357394 /nfs/dbraw/zinc/35/73/94/914357394.db2.gz QCWOROBARDJYCP-UHFFFAOYSA-N 0 3 421.335 4.479 20 0 HIADHN CC[C@@H]1Oc2cc([C@@H](C)N[C@@H](C)c3cccc(N4CCCC4=O)c3)ccc2NC1=O ZINC000483868220 899549035 /nfs/dbraw/zinc/54/90/35/899549035.db2.gz GPTRULJKPZXURD-MRUHUIDDSA-N 0 3 407.514 4.335 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1nnc(/C=C/c2ccco2)s1 ZINC000484004494 899642477 /nfs/dbraw/zinc/64/24/77/899642477.db2.gz JFWGQNNDQOSWQH-DVQDXYAYSA-N 0 3 423.542 4.430 20 0 HIADHN C[C@H]1CCN(C(=O)Nc2ccc3oc(N(C)C)nc3c2)CCN1Cc1ccccc1 ZINC000484036136 899668451 /nfs/dbraw/zinc/66/84/51/899668451.db2.gz HHQNTZAIPUDKBS-KRWDZBQOSA-N 0 3 407.518 4.022 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)Nc1ccc2oc(N(C)C)nc2c1 ZINC000484048716 899679975 /nfs/dbraw/zinc/67/99/75/899679975.db2.gz WKAFACXILCEEHS-UHFFFAOYSA-N 0 3 415.925 4.143 20 0 HIADHN Cc1cc(-n2ccnc2)ccc1CN(C)[C@@H](CO)c1cccc(Br)c1 ZINC000484067679 899699581 /nfs/dbraw/zinc/69/95/81/899699581.db2.gz IQTGFKFJJYHDFF-FQEVSTJZSA-N 0 3 400.320 4.109 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)Nc2nnc(/C=C\c3ccco3)s2)C1 ZINC000484092348 899721856 /nfs/dbraw/zinc/72/18/56/899721856.db2.gz BABAPADBGHWOBJ-GUKXCFJFSA-N 0 3 409.515 4.259 20 0 HIADHN Cc1c(C(=O)N(CCN(C)C)Cc2cccc(F)c2)cnn1-c1ccccc1Cl ZINC000484146113 899766793 /nfs/dbraw/zinc/76/67/93/899766793.db2.gz TWANROKOJXJQEE-UHFFFAOYSA-N 0 3 414.912 4.177 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)NCc1ccc(Oc2ccccc2)cc1 ZINC000484146867 899768260 /nfs/dbraw/zinc/76/82/60/899768260.db2.gz OLNDWSQAPXVHJJ-UHFFFAOYSA-N 0 3 417.509 4.104 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)NC[C@H](C)c1c(Cl)cccc1Cl ZINC000484164869 899784065 /nfs/dbraw/zinc/78/40/65/899784065.db2.gz NMSXUEOIVMZSJD-AWEZNQCLSA-N 0 3 422.356 4.222 20 0 HIADHN Cc1c([C@H](C)NC2CCN(c3ccc(C)cn3)CC2)nnn1-c1cccc(Cl)c1 ZINC000484178111 899796572 /nfs/dbraw/zinc/79/65/72/899796572.db2.gz QAWSMGZTPLFTRH-INIZCTEOSA-N 0 3 410.953 4.252 20 0 HIADHN CCOc1ccc(CN(C)Cc2cn(C)nc2-c2ccc3c(c2)OCCCO3)cc1 ZINC000505694801 914383083 /nfs/dbraw/zinc/38/30/83/914383083.db2.gz PSNYWBSVWLPJBX-UHFFFAOYSA-N 0 3 407.514 4.279 20 0 HIADHN Cc1c(CSC(C)C)cccc1NC(=O)N1CC[C@@H](N2CCN(C)CC2)[C@@H](C)C1 ZINC000484280454 899850004 /nfs/dbraw/zinc/85/00/04/899850004.db2.gz MSOFMGUMLYZZHM-PGRDOPGGSA-N 0 3 418.651 4.126 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)N[C@@H](CC(F)(F)F)c2ccccc2)cc1 ZINC000484284474 899850765 /nfs/dbraw/zinc/85/07/65/899850765.db2.gz PDQOXQWFLUNJTF-RBUKOAKNSA-N 0 3 409.452 4.291 20 0 HIADHN C[C@H](N[C@H]1c2cccc(F)c2CC[C@H]1C)c1cccc(N2CCCS2(=O)=O)c1 ZINC000484287131 899853154 /nfs/dbraw/zinc/85/31/54/899853154.db2.gz FPOZMYRNCKPIBA-ZMPRRUGASA-N 0 3 402.535 4.340 20 0 HIADHN COC1CCC(CN[C@@H](C)c2nnn(-c3cccc(Br)c3)c2C)CC1 ZINC000484286260 899853178 /nfs/dbraw/zinc/85/31/78/899853178.db2.gz XLTNXXNYWZMJCO-UQHVZDHRSA-N 0 3 407.356 4.194 20 0 HIADHN CSc1cccc(N(C(=O)CCc2nc(C(C)(C)C)no2)C2CCN(C)CC2)c1 ZINC000484291539 899856733 /nfs/dbraw/zinc/85/67/33/899856733.db2.gz FBUHNLXZGKWMCT-UHFFFAOYSA-N 0 3 416.591 4.149 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2cc(F)c(OC(C)C)c(F)c2)c1 ZINC000484358438 899906353 /nfs/dbraw/zinc/90/63/53/899906353.db2.gz SCTBWEAXKRBTKA-UHFFFAOYSA-N 0 3 421.488 4.356 20 0 HIADHN CSc1cccc(N(C(=O)CSCc2c(C)noc2C)C2CCN(C)CC2)c1 ZINC000484398657 899924899 /nfs/dbraw/zinc/92/48/99/899924899.db2.gz CPDPQNAKHJJEPC-UHFFFAOYSA-N 0 3 419.616 4.374 20 0 HIADHN CCCN(C)[C@H](CNC(=O)Nc1ccc(N2CCC2=O)cc1)c1ccc(Cl)cc1 ZINC000484438525 899945487 /nfs/dbraw/zinc/94/54/87/899945487.db2.gz JVDHXIXYCVZTTD-HXUWFJFHSA-N 0 3 414.937 4.281 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2cc(C)ccc2Br)c1 ZINC000484469647 899964147 /nfs/dbraw/zinc/96/41/47/899964147.db2.gz DLKMZVHFEKAUHQ-UHFFFAOYSA-N 0 3 420.351 4.362 20 0 HIADHN CCc1ccccc1NC(=O)C[C@H](C)NCC(=O)N1CCC(Cc2ccccc2)CC1 ZINC000484482734 899974275 /nfs/dbraw/zinc/97/42/75/899974275.db2.gz KFVKHBIYYRGVDU-FQEVSTJZSA-N 0 3 421.585 4.037 20 0 HIADHN COc1cc(Cl)c(C)cc1NC(=O)CCN[C@H](C)c1cccc(NC(C)=O)c1 ZINC000484481622 899974438 /nfs/dbraw/zinc/97/44/38/899974438.db2.gz WQIYYAYKWZVQTK-CQSZACIVSA-N 0 3 403.910 4.295 20 0 HIADHN CNS(=O)(=O)c1ccc([C@H](C)NCc2ccc(-c3ccc(OC)cc3)s2)cc1 ZINC000484495929 899987129 /nfs/dbraw/zinc/98/71/29/899987129.db2.gz CGYFJSHQFRERRE-HNNXBMFYSA-N 0 3 416.568 4.183 20 0 HIADHN Cc1ccc(CN[C@H](C)c2cccc(N3CCOCC3)c2)c(OC[C@@H]2CCCO2)c1 ZINC000484497989 899988392 /nfs/dbraw/zinc/98/83/92/899988392.db2.gz KCWOOUBQJOAKFP-YKSBVNFPSA-N 0 3 410.558 4.240 20 0 HIADHN CN(C)C(=O)c1cccc(CN[C@@H](c2ccc(F)c(F)c2)C(C)(C)N2CCCC2)c1 ZINC000484540019 900023830 /nfs/dbraw/zinc/02/38/30/900023830.db2.gz VSGFLSSYIZOSST-QFIPXVFZSA-N 0 3 415.528 4.372 20 0 HIADHN C[C@H](CN(C(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1)[C@@H](C)CO)c1ccccc1 ZINC000484692103 900129168 /nfs/dbraw/zinc/12/91/68/900129168.db2.gz WPSWMBHQLSMEQO-XBJMDHIQSA-N 0 3 409.574 4.018 20 0 HIADHN CCc1nnc(C2CCN([C@@H](C)C(=O)Nc3ccccc3Cc3ccccc3)CC2)[nH]1 ZINC000484695767 900132545 /nfs/dbraw/zinc/13/25/45/900132545.db2.gz CWMYXNZTNHKBIH-SFHVURJKSA-N 0 3 417.557 4.165 20 0 HIADHN C[C@@H](NCC(=O)NC1CCOCC1)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 ZINC000484785684 900193498 /nfs/dbraw/zinc/19/34/98/900193498.db2.gz GDGLXHWWVJKKGL-CYBMUJFWSA-N 0 3 412.477 4.380 20 0 HIADHN CC(C)c1nc(C2CCN(CCC(=O)Nc3ccccc3C(F)(F)F)CC2)no1 ZINC000485098315 900408191 /nfs/dbraw/zinc/40/81/91/900408191.db2.gz ZXGXCNIBWNUATK-UHFFFAOYSA-N 0 3 410.440 4.420 20 0 HIADHN CCc1c(NC(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)cnn1-c1ccccc1C ZINC000485349194 900641483 /nfs/dbraw/zinc/64/14/83/900641483.db2.gz OOVSOAGTPCQUHE-XXBNENTESA-N 0 3 403.530 4.310 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)NCc2nc3cc(Cl)ccc3s2)cc1 ZINC000485358693 900653178 /nfs/dbraw/zinc/65/31/78/900653178.db2.gz OEZJVTVLMDMXLY-QGZVFWFLSA-N 0 3 418.950 4.060 20 0 HIADHN CCn1ccnc1[C@@H]1CCCCN1C(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000485376945 900673701 /nfs/dbraw/zinc/67/37/01/900673701.db2.gz CCUIXWYJCGNOII-ZWKOTPCHSA-N 0 3 401.580 4.038 20 0 HIADHN C[C@H](NC(=O)NCc1nc2cc(Cl)ccc2s1)[C@@H](c1ccccc1)N(C)C ZINC000485399542 900697301 /nfs/dbraw/zinc/69/73/01/900697301.db2.gz GQNWFPRWCDHAPT-DJJJIMSYSA-N 0 3 402.951 4.440 20 0 HIADHN CC(C)CC(=O)Nc1cccc(CNC(=O)N[C@H]2CCN(Cc3ccccc3)[C@H]2C)c1 ZINC000485408808 900706797 /nfs/dbraw/zinc/70/67/97/900706797.db2.gz VNHRLZJIUFCEDG-CVDCTZTESA-N 0 3 422.573 4.133 20 0 HIADHN CCOc1cc(CNC2(c3ccccc3)CCCCC2)nc2nc(C(F)(F)F)nn21 ZINC000485419920 900718802 /nfs/dbraw/zinc/71/88/02/900718802.db2.gz ANRGIIFRUMOJAJ-UHFFFAOYSA-N 0 3 419.451 4.491 20 0 HIADHN CC(C)(C)CCN1CCN(C(=O)Nc2ccc(Oc3ccccc3C(N)=O)cc2)CC1 ZINC000485443501 900740566 /nfs/dbraw/zinc/74/05/66/900740566.db2.gz VKQGMJIRTMRQPU-UHFFFAOYSA-N 0 3 424.545 4.164 20 0 HIADHN Cc1cccc(C2(C(=O)Nc3ccc(C(=O)NCCN4CCCC4)cc3)CCCC2)c1 ZINC000485479814 900772070 /nfs/dbraw/zinc/77/20/70/900772070.db2.gz JWJVGBADRNKQTF-UHFFFAOYSA-N 0 3 419.569 4.271 20 0 HIADHN O=C(Cc1ccc(Cl)c(Cl)c1)Nc1ccc(C(=O)NCCN2CCCC2)cc1 ZINC000485496510 900785275 /nfs/dbraw/zinc/78/52/75/900785275.db2.gz LFXGCLLDXKQRIR-UHFFFAOYSA-N 0 3 420.340 4.000 20 0 HIADHN COCCSc1ccc([C@@H](C)NC(=O)N2CCN(C3CCCCC3)CC2)cc1 ZINC000485571602 900840588 /nfs/dbraw/zinc/84/05/88/900840588.db2.gz DHWJVOAUOPSOSV-GOSISDBHSA-N 0 3 405.608 4.146 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@H](C)N[C@H](C)c2ccc3ncsc3c2)cc1OC ZINC000485838612 901084311 /nfs/dbraw/zinc/08/43/11/901084311.db2.gz BICQRLTYUXXXOU-CABCVRRESA-N 0 3 413.543 4.011 20 0 HIADHN CCN(C(=O)C(=O)Nc1ccc(Cl)c(F)c1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000485883412 901117816 /nfs/dbraw/zinc/11/78/16/901117816.db2.gz NISCNGSLFPUPBX-CRAIPNDOSA-N 0 3 417.912 4.102 20 0 HIADHN C[C@H]1CC(=O)CC[C@@H]1C(=O)N1CCC(N(C)Cc2cccc(C(F)(F)F)c2)CC1 ZINC000485945813 901166204 /nfs/dbraw/zinc/16/62/04/901166204.db2.gz QPKUDXTXVYRRBK-YWZLYKJASA-N 0 3 410.480 4.134 20 0 HIADHN O=C(N[C@H](c1cccc(Cl)c1)c1ccccn1)N1CCN(C2CCCCC2)CC1 ZINC000486006085 901219785 /nfs/dbraw/zinc/21/97/85/901219785.db2.gz RMJROZPPKXYVGC-JOCHJYFZSA-N 0 3 412.965 4.484 20 0 HIADHN CCOc1cc(CN2CCC(C(N)=O)CC2)ccc1OCc1c(F)cccc1Cl ZINC000505872866 914519350 /nfs/dbraw/zinc/51/93/50/914519350.db2.gz SHILLVMANCKEAU-UHFFFAOYSA-N 0 3 420.912 4.154 20 0 HIADHN COc1cc([C@H](C)NC[C@H](c2ccccc2)C(F)(F)F)ccc1S(C)(=O)=O ZINC000486062862 901257999 /nfs/dbraw/zinc/25/79/99/901257999.db2.gz RUZFVWZTFQQFLM-XJKSGUPXSA-N 0 3 401.450 4.095 20 0 HIADHN CC[C@H](N[C@@H](C)c1ccc(-n2cnnn2)cc1)c1cc(F)cc(Br)c1 ZINC000486093722 901281215 /nfs/dbraw/zinc/28/12/15/901281215.db2.gz UWUZYWLAXGORKS-SGTLLEGYSA-N 0 3 404.287 4.366 20 0 HIADHN C[C@H]1CN(C(=O)c2cc(-c3ccccc3)ccc2Cl)CC[C@H]1N1CCN(C)CC1 ZINC000486096742 901283940 /nfs/dbraw/zinc/28/39/40/901283940.db2.gz OZIJAJZAJDTIGB-FDDCHVKYSA-N 0 3 411.977 4.105 20 0 HIADHN C[C@@H]1CN(C(=O)c2cc(-c3ccccc3)ccc2Cl)CC[C@@H]1N1CCN(C)CC1 ZINC000486096743 901284745 /nfs/dbraw/zinc/28/47/45/901284745.db2.gz OZIJAJZAJDTIGB-JPYJTQIMSA-N 0 3 411.977 4.105 20 0 HIADHN CN(C)Cc1ccccc1C(=O)Nc1ccc(CC(=O)N2CCc3ccccc32)cc1 ZINC000486118603 901305323 /nfs/dbraw/zinc/30/53/23/901305323.db2.gz UDMZKHJVVKXVRW-UHFFFAOYSA-N 0 3 413.521 4.132 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)c1cc2ccc(Br)cc2[nH]1 ZINC000486176522 901363220 /nfs/dbraw/zinc/36/32/20/901363220.db2.gz VMLSMBYEXLBPJT-HXUWFJFHSA-N 0 3 412.331 4.497 20 0 HIADHN CCC1CCC(N(C(=O)NCc2ccccc2CN2CCC(O)CC2)C2CC2)CC1 ZINC000486217897 901400490 /nfs/dbraw/zinc/40/04/90/901400490.db2.gz CHEYJUBPEVRQEU-UHFFFAOYSA-N 0 3 413.606 4.286 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)c2ccc(-c3noc(C(F)F)n3)cc2)C1 ZINC000486222972 901405012 /nfs/dbraw/zinc/40/50/12/901405012.db2.gz ZLVIDSPAMFIEAA-RDTXWAMCSA-N 0 3 412.440 4.240 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)NC2(c3cccc(Cl)c3)CCCC2)CC1 ZINC000486224296 901407116 /nfs/dbraw/zinc/40/71/16/901407116.db2.gz JONRDIPCARTHOO-UHFFFAOYSA-N 0 3 407.986 4.298 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)C(F)(F)F)N1CCCN(Cc2ccccc2)CC1 ZINC000486456498 901615291 /nfs/dbraw/zinc/61/52/91/901615291.db2.gz NSHFYCVXMFXGCS-FQEVSTJZSA-N 0 3 405.464 4.250 20 0 HIADHN COc1cccc(CN2C[C@H]3CCC[C@@]3(c3nc(CC4CC4)no3)C2)c1OC(C)C ZINC000486474463 901634467 /nfs/dbraw/zinc/63/44/67/901634467.db2.gz XUFDSRUCTZSLRH-NTKDMRAZSA-N 0 3 411.546 4.372 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)N[C@@H]1CC(C)(C)Oc2cc(F)ccc21 ZINC000486482241 901641302 /nfs/dbraw/zinc/64/13/02/901641302.db2.gz LTTWQDXQDPZQRD-GOSISDBHSA-N 0 3 405.539 4.263 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)NC[C@@H](c3ccccc3)C(F)(F)F)c2)CC1 ZINC000486541661 901690637 /nfs/dbraw/zinc/69/06/37/901690637.db2.gz RFVNUJWOMCKJSU-FQEVSTJZSA-N 0 3 420.479 4.296 20 0 HIADHN C[C@@H]([N-]S(=O)(=O)c1c(Cl)cccc1Cl)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000486597777 901735926 /nfs/dbraw/zinc/73/59/26/901735926.db2.gz RNZNFHHQTUQLFB-GDBMZVCRSA-N 0 3 413.370 4.182 20 0 HIADHN C[C@@H]([N-]S(=O)(=O)c1c(Cl)cccc1Cl)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000486597777 901735933 /nfs/dbraw/zinc/73/59/33/901735933.db2.gz RNZNFHHQTUQLFB-GDBMZVCRSA-N 0 3 413.370 4.182 20 0 HIADHN CN(C)Cc1cccc(NC(=O)Nc2cnn(-c3ncc(Cl)cc3Cl)c2)c1 ZINC000486723471 901814354 /nfs/dbraw/zinc/81/43/54/901814354.db2.gz QFZVYSCSIBQBCA-UHFFFAOYSA-N 0 3 405.289 4.280 20 0 HIADHN O=C(NCc1coc(-c2cccs2)n1)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000505921882 914568075 /nfs/dbraw/zinc/56/80/75/914568075.db2.gz CGQDCHZVYQXONS-KRWDZBQOSA-N 0 3 417.481 4.177 20 0 HIADHN COc1cc(-c2noc(CN3CC[C@H](Cc4ccccc4)[C@H]3C)n2)cc(OC)c1OC ZINC000486787362 901853910 /nfs/dbraw/zinc/85/39/10/901853910.db2.gz JZMNGLLJNXRNAN-SJLPKXTDSA-N 0 3 423.513 4.216 20 0 HIADHN COCCSCCCN1CCc2cc(OC)c(OC)cc2[C@H]1c1ccccc1 ZINC000486810894 901868932 /nfs/dbraw/zinc/86/89/32/901868932.db2.gz KECPEYJBJBGQQE-HSZRJFAPSA-N 0 3 401.572 4.421 20 0 HIADHN C[C@H](C(=O)N1[C@H](C)CCC[C@H]1C)N1C[C@H]2CCC[C@@]2(c2nc(-c3ccccc3)no2)C1 ZINC000486829523 901881521 /nfs/dbraw/zinc/88/15/21/901881521.db2.gz XURAUWGKLOYZEP-UYIYHOFSSA-N 0 3 422.573 4.268 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1ccccc1COC1CCOCC1)c1ccsc1 ZINC000486844255 901891079 /nfs/dbraw/zinc/89/10/79/901891079.db2.gz UCLPBFRTHKCFBK-QFIPXVFZSA-N 0 3 416.587 4.257 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cccc(COC2CCOCC2)c1)c1ccsc1 ZINC000486843466 901891340 /nfs/dbraw/zinc/89/13/40/901891340.db2.gz RJZQIDUOHBZNSW-JOCHJYFZSA-N 0 3 416.587 4.257 20 0 HIADHN C[C@@H]1Cc2ccccc2N1Cc1ccoc1C(=O)NCCN(C)Cc1ccccc1 ZINC000486922462 901964150 /nfs/dbraw/zinc/96/41/50/901964150.db2.gz BCOYWZLZBNFQKT-LJQANCHMSA-N 0 3 403.526 4.093 20 0 HIADHN O=C(N[C@@H](c1ccc(F)cc1)C(F)(F)F)N1CCCN(Cc2ccccc2)CC1 ZINC000487116817 902064719 /nfs/dbraw/zinc/06/47/19/902064719.db2.gz KFOCYPIXXNCEMG-IBGZPJMESA-N 0 3 409.427 4.347 20 0 HIADHN FC(F)(F)c1ncc(CN[C@H]2CCN(c3cccc(Br)c3)C2)s1 ZINC000487190253 902093949 /nfs/dbraw/zinc/09/39/49/902093949.db2.gz QXUMBAXTEUXFSJ-NSHDSACASA-N 0 3 406.271 4.293 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)c1ccc(F)cc1C(F)(F)F ZINC000487199612 902097324 /nfs/dbraw/zinc/09/73/24/902097324.db2.gz LVRZVENIRSYQAT-UHFFFAOYSA-N 0 3 423.454 4.177 20 0 HIADHN CN(Cc1ccccc1Br)C(=O)CCNCc1sccc1Cl ZINC000487278942 902135676 /nfs/dbraw/zinc/13/56/76/902135676.db2.gz VBUDQBGZBGSBPM-UHFFFAOYSA-N 0 3 401.757 4.302 20 0 HIADHN Cc1nc(-c2ccc(C)cc2NC(=O)CN2CCC[C@H]2Cc2ccc(C)cc2)n[nH]1 ZINC000487409981 902191196 /nfs/dbraw/zinc/19/11/96/902191196.db2.gz MFNWUNBDMLQQLA-FQEVSTJZSA-N 0 3 403.530 4.043 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)c2cnc(-c3ccc4c(c3)OCO4)s2)c1 ZINC000487651888 902274684 /nfs/dbraw/zinc/27/46/84/902274684.db2.gz AXHUSWKALUORBX-UHFFFAOYSA-N 0 3 423.538 4.051 20 0 HIADHN CN(C(=O)N[C@@H]1CCC[C@H](c2ccccc2)C1)C1CCN(CCc2ccccn2)CC1 ZINC000487731834 902326197 /nfs/dbraw/zinc/32/61/97/902326197.db2.gz AUOSWDFYFVVLKG-LADGPHEKSA-N 0 3 420.601 4.456 20 0 HIADHN C[C@@H](c1cccc(N2CCCS2(=O)=O)c1)N(C)Cc1ccc(OC(F)F)cc1 ZINC000487856844 902408342 /nfs/dbraw/zinc/40/83/42/902408342.db2.gz WPGVHEKARCZPLQ-HNNXBMFYSA-N 0 3 410.486 4.021 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@H](C)[C@@H]1OCCc2sccc21)c1ccsc1 ZINC000487858816 902410144 /nfs/dbraw/zinc/41/01/44/902410144.db2.gz NNTPRYXLINLWCH-BJZITVGISA-N 0 3 407.605 4.194 20 0 HIADHN C[C@@H]1CN(C2CCOCC2)CCN1C(=O)Nc1ccccc1N1CCc2ccccc21 ZINC000487874046 902419735 /nfs/dbraw/zinc/41/97/35/902419735.db2.gz PHDALWCSSTVWGH-LJQANCHMSA-N 0 3 420.557 4.098 20 0 HIADHN CCc1ccccc1N(C(C)=O)c1nc(CN2CCN(C)[C@H](C(C)C)C2)cs1 ZINC000488004844 902525442 /nfs/dbraw/zinc/52/54/42/902525442.db2.gz XSCAXWYSUPBZHW-NRFANRHFSA-N 0 3 400.592 4.162 20 0 HIADHN C[C@@H]1CN(C2CCOCC2)CCN1C(=O)Nc1ccccc1COCc1ccccc1 ZINC000488327182 902767008 /nfs/dbraw/zinc/76/70/08/902767008.db2.gz DZRAKNKUPOORJD-HXUWFJFHSA-N 0 3 423.557 4.120 20 0 HIADHN CCOc1cc(CN(C)[C@@H](C)c2ccc(-n3cncn3)cc2)ccc1OC(F)F ZINC000488397427 902807658 /nfs/dbraw/zinc/80/76/58/902807658.db2.gz NCBNNBYMHFJYAF-HNNXBMFYSA-N 0 3 402.445 4.460 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N[C@H](C)[C@@H]2OCCc3sccc32)N2CCCC2)cc1 ZINC000488508165 902861972 /nfs/dbraw/zinc/86/19/72/902861972.db2.gz ABYISEIHRNFCCV-AGHHOFFYSA-N 0 3 413.587 4.195 20 0 HIADHN Cc1cc(C2CCN(C(=O)N[C@H](C)C3=CCN(C)CC3)CC2)ccc1Br ZINC000488510117 902862779 /nfs/dbraw/zinc/86/27/79/902862779.db2.gz FGYCOCSFIXAXHL-MRXNPFEDSA-N 0 3 420.395 4.297 20 0 HIADHN c1sc(-c2ccc3c(c2)OCO3)nc1CN[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000488511020 902863131 /nfs/dbraw/zinc/86/31/31/902863131.db2.gz CRIXRRPWARKINT-LJQANCHMSA-N 0 3 407.539 4.293 20 0 HIADHN C[C@@H](Oc1cccc(Cl)c1Cl)C(=O)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000488673392 902935705 /nfs/dbraw/zinc/93/57/05/902935705.db2.gz KIPOYHDEOUUCKG-CQSZACIVSA-N 0 3 423.340 4.356 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)Nc1ccc(F)cc1OC1CCOCC1)c1ccco1 ZINC000488711484 902960749 /nfs/dbraw/zinc/96/07/49/902960749.db2.gz WQPDLVPVBTZSRW-DNVCBOLYSA-N 0 3 419.497 4.227 20 0 HIADHN Cc1nc(C(=O)N2CCC(CN3C[C@H](C)O[C@@H](C)C3)CC2)c(-c2ccccc2)s1 ZINC000488890283 903060362 /nfs/dbraw/zinc/06/03/62/903060362.db2.gz LDJIDOBZFIAMCF-IRXDYDNUSA-N 0 3 413.587 4.080 20 0 HIADHN Cc1cc(N2CCCC[C@H]2C)ccc1NC(=O)N1CCN(C2CCOCC2)C[C@@H]1C ZINC000488904415 903068763 /nfs/dbraw/zinc/06/87/63/903068763.db2.gz BSTIYHUNYPQNCS-UXHICEINSA-N 0 3 414.594 4.091 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)Nc2cccc(OC[C@@H]3CCCO3)c2)CC1 ZINC000489007013 903117444 /nfs/dbraw/zinc/11/74/44/903117444.db2.gz FWGQGVGXQHVBGS-DEOSSOPVSA-N 0 3 423.557 4.373 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)Nc2cccc(C(=O)NC(C)(C)C)c2)CC1 ZINC000489034392 903141022 /nfs/dbraw/zinc/14/10/22/903141022.db2.gz CARWIJBGDOWVHZ-UHFFFAOYSA-N 0 3 422.573 4.343 20 0 HIADHN CC(C)CC[C@@H]1CCC[C@@H]1NC(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000489139359 903226365 /nfs/dbraw/zinc/22/63/65/903226365.db2.gz NDVFCSNMJFBLLL-CVDCTZTESA-N 0 3 401.595 4.047 20 0 HIADHN COc1ccc(OC)c(NC(=O)[C@@H](C)N[C@H](COc2ccccc2F)C(C)(C)C)c1 ZINC000489143258 903228170 /nfs/dbraw/zinc/22/81/70/903228170.db2.gz XYSAJVCRBHFPHD-QVKFZJNVSA-N 0 3 418.509 4.253 20 0 HIADHN CN(C)CCN(C(=O)Nc1ccc(Oc2cccc(F)c2F)nc1)C1CCCC1 ZINC000489166868 903240290 /nfs/dbraw/zinc/24/02/90/903240290.db2.gz BPFLSMDDRUXEBB-UHFFFAOYSA-N 0 3 404.461 4.490 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)NCc1ccc(Br)c(F)c1)c1ccco1 ZINC000489177246 903245603 /nfs/dbraw/zinc/24/56/03/903245603.db2.gz QNHFKHTYGZXYQA-LRDDRELGSA-N 0 3 412.303 4.110 20 0 HIADHN CC(C)COC[C@H](NC(=O)N(Cc1ccccc1)C1CCN(C)CC1)c1ccco1 ZINC000489205105 903263509 /nfs/dbraw/zinc/26/35/09/903263509.db2.gz MTKQRKHSROFZJK-QFIPXVFZSA-N 0 3 413.562 4.299 20 0 HIADHN COc1ccccc1-c1ccc(CN(C)[C@@H](C)c2ccc(S(N)(=O)=O)cc2)cc1 ZINC000506022436 914702202 /nfs/dbraw/zinc/70/22/02/914702202.db2.gz TVDKNKGLSCQNTL-KRWDZBQOSA-N 0 3 410.539 4.203 20 0 HIADHN CCN(CC1CCN(c2ccccn2)CC1)[C@@H](C)c1nc(-c2ccc(OC)cc2)no1 ZINC000489331451 903333983 /nfs/dbraw/zinc/33/39/83/903333983.db2.gz PUGWQUJQGAWOAD-SFHVURJKSA-N 0 3 421.545 4.440 20 0 HIADHN Cc1c([C@@H](C)NC(=O)N(CCN(C)Cc2ccccc2)Cc2ccccc2)cnn1C ZINC000489355057 903344039 /nfs/dbraw/zinc/34/40/39/903344039.db2.gz SIVNYARDBIIWJE-HXUWFJFHSA-N 0 3 419.573 4.133 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)NCc2cccc(Br)c2)CC1 ZINC000489365388 903346904 /nfs/dbraw/zinc/34/69/04/903346904.db2.gz NIJYDTYBKDNPFB-UHFFFAOYSA-N 0 3 416.363 4.255 20 0 HIADHN CC[C@H](C)c1ccccc1NC(=O)[C@@H](C)N1CCC(CCCN2CCOCC2)CC1 ZINC000506032016 914714355 /nfs/dbraw/zinc/71/43/55/914714355.db2.gz OISBKLWLUQOZCC-LEWJYISDSA-N 0 3 415.622 4.352 20 0 HIADHN O=C(Nc1ccc(F)cc1)[C@H](N[C@H]1CCO[C@@]2(CCSC2)C1)c1ccccc1 ZINC000489477974 903408328 /nfs/dbraw/zinc/40/83/28/903408328.db2.gz NEMQNBGLQQEAJZ-VWPQPMDRSA-N 0 3 400.519 4.150 20 0 HIADHN CO[C@@H](CNC(=O)N(Cc1ccccc1)C1CCN(C)CC1)c1cccc(Cl)c1 ZINC000489498509 903425613 /nfs/dbraw/zinc/42/56/13/903425613.db2.gz QMGKJMGIKBFXLH-QFIPXVFZSA-N 0 3 415.965 4.334 20 0 HIADHN Cc1ccc(NC(=O)N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)cc1OC(C)C ZINC000489576615 903474437 /nfs/dbraw/zinc/47/44/37/903474437.db2.gz JFKGHZAENFBGHT-KDURUIRLSA-N 0 3 403.567 4.135 20 0 HIADHN C[C@@H](CNC(=O)N(Cc1ccccc1)C1CCN(C)CC1)Oc1cccc(Cl)c1 ZINC000489629077 903506592 /nfs/dbraw/zinc/50/65/92/903506592.db2.gz WRGZDZYNQWPOBQ-SFHVURJKSA-N 0 3 415.965 4.413 20 0 HIADHN Cc1cccc(CC(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)c1Cl ZINC000489712337 903554168 /nfs/dbraw/zinc/55/41/68/903554168.db2.gz WNPKGXGTQHAUCG-FQEVSTJZSA-N 0 3 408.933 4.473 20 0 HIADHN CC(=O)Nc1cccc([C@@H](C)NC(=O)N(Cc2ccccc2)C2CCN(C)CC2)c1 ZINC000489877570 903648017 /nfs/dbraw/zinc/64/80/17/903648017.db2.gz UOEMDLAVUZQKCB-GOSISDBHSA-N 0 3 408.546 4.012 20 0 HIADHN Cc1ccc(C2(C(=O)NC[C@@H](c3ccc(OC(C)C)cc3)N(C)C)CCOCC2)cc1 ZINC000489964354 903699913 /nfs/dbraw/zinc/69/99/13/903699913.db2.gz KZANQSOVVZFXAG-DEOSSOPVSA-N 0 3 424.585 4.250 20 0 HIADHN COc1cc(-c2noc(CN3C[C@H](c4ccc(C)cc4)C[C@@H]3C)n2)cc(OC)c1OC ZINC000490053651 903745736 /nfs/dbraw/zinc/74/57/36/903745736.db2.gz KWRKROATNWZABB-QFBILLFUSA-N 0 3 423.513 4.449 20 0 HIADHN Cn1cc([C@@H](NCCc2ccc(F)c(Br)c2)c2cccc(F)c2)cn1 ZINC000490145484 903791288 /nfs/dbraw/zinc/79/12/88/903791288.db2.gz UFOMTGRTGBHRLP-IBGZPJMESA-N 0 3 406.274 4.383 20 0 HIADHN Cc1ccc([C@@H](NCCCOC2CCCC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000490164544 903805367 /nfs/dbraw/zinc/80/53/67/903805367.db2.gz OMARATMBZZILAS-HSZRJFAPSA-N 0 3 401.572 4.427 20 0 HIADHN Cc1ccc([C@@H](NCCN(C)C2CCCCC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000490172142 903808940 /nfs/dbraw/zinc/80/89/40/903808940.db2.gz LHCDUOWNSXSINM-XMMPIXPASA-N 0 3 414.615 4.342 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](NCCc2cc(F)cc(F)c2)c2ccc(F)cc2)c1 ZINC000490171784 903809347 /nfs/dbraw/zinc/80/93/47/903809347.db2.gz IFONOWSANVGMEQ-QFIPXVFZSA-N 0 3 419.468 4.429 20 0 HIADHN COc1ccc(CCN[C@H](c2cnn(C)c2)c2cccc(F)c2)cc1OC(F)F ZINC000490190662 903817441 /nfs/dbraw/zinc/81/74/41/903817441.db2.gz KXBLXHFFWYUOFV-FQEVSTJZSA-N 0 3 405.420 4.091 20 0 HIADHN COc1cccc(CCN[C@H](c2ccc(F)cc2)c2cccc(S(C)(=O)=O)c2)c1 ZINC000490190430 903817467 /nfs/dbraw/zinc/81/74/67/903817467.db2.gz IXOKFJOYPKFJOF-HSZRJFAPSA-N 0 3 413.514 4.160 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)NCc1ccc(Oc2ccccc2)nc1)c1ccco1 ZINC000490218446 903834025 /nfs/dbraw/zinc/83/40/25/903834025.db2.gz SZYOCEOWZVBYGF-PXNSSMCTSA-N 0 3 408.502 4.396 20 0 HIADHN COc1ccc(NC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)cc1Br ZINC000490315095 903895348 /nfs/dbraw/zinc/89/53/48/903895348.db2.gz RPFHVWGDOWGYGQ-KRWDZBQOSA-N 0 3 418.335 4.244 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)cc1 ZINC000490315530 903896700 /nfs/dbraw/zinc/89/67/00/903896700.db2.gz UVHVQAWAAUYXGO-CVDCTZTESA-N 0 3 422.573 4.482 20 0 HIADHN COc1cc(C)ccc1Oc1ccc(NC(=O)N2CC[C@H]3CCN(C)C[C@@H]32)cc1F ZINC000490326094 903908251 /nfs/dbraw/zinc/90/82/51/903908251.db2.gz FQXZMMVGUPSTAE-APWZRJJASA-N 0 3 413.493 4.493 20 0 HIADHN CCNC(=O)Nc1ccc(C)c(NC(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)c1 ZINC000490355479 903948995 /nfs/dbraw/zinc/94/89/95/903948995.db2.gz SOKLJCPCZWJFQX-XLIONFOSSA-N 0 3 409.534 4.093 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)N1CCC(Cc2ccccc2CO)CC1 ZINC000490380140 903971701 /nfs/dbraw/zinc/97/17/01/903971701.db2.gz UBGIDXIENJNMLY-UHFFFAOYSA-N 0 3 406.526 4.082 20 0 HIADHN CN(C)[C@H](CNC(=O)Nc1cc(-c2ccc(Cl)s2)nn1C)c1ccccc1 ZINC000490566698 904105066 /nfs/dbraw/zinc/10/50/66/904105066.db2.gz HJNUANRLRSWKSO-OAHLLOKOSA-N 0 3 403.939 4.226 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2ccc(C(=O)N3CCCC3)cc2)N2CCCC2)cc1 ZINC000490643393 904152526 /nfs/dbraw/zinc/15/25/26/904152526.db2.gz DBYPNRSFYOITGH-HSZRJFAPSA-N 0 3 420.557 4.190 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)NCCc2csc(C(C)C)n2)N(C)C)cc1 ZINC000490712547 904188305 /nfs/dbraw/zinc/18/83/05/904188305.db2.gz YYACKDDAFMTTNF-FQEVSTJZSA-N 0 3 418.607 4.198 20 0 HIADHN COc1ccccc1-c1ncc(CN[C@@H]2CCN(c3cc(Cl)ccc3OC)C2)cn1 ZINC000490750632 904207302 /nfs/dbraw/zinc/20/73/02/904207302.db2.gz JQTJYDJAMZJPGP-GOSISDBHSA-N 0 3 424.932 4.183 20 0 HIADHN CN(C)[C@H](CNC(=O)N[C@H](c1c[nH]c2ccccc21)C(F)(F)F)c1ccccc1 ZINC000490764430 904216375 /nfs/dbraw/zinc/21/63/75/904216375.db2.gz TWHJKZUSLVPGMV-RTBURBONSA-N 0 3 404.436 4.373 20 0 HIADHN O=C(N[C@@H](c1c[nH]c2ccccc21)C(F)(F)F)N1CCN(C2CCCCC2)CC1 ZINC000490858734 904289692 /nfs/dbraw/zinc/28/96/92/904289692.db2.gz YBXCKLYVDUQKAH-IBGZPJMESA-N 0 3 408.468 4.431 20 0 HIADHN COc1ccc([C@@H](CNC(=O)NCCc2ccc(Cl)s2)N2CCCC2)cc1 ZINC000506111903 914808785 /nfs/dbraw/zinc/80/87/85/914808785.db2.gz GXXIKWXJFYQSDX-GOSISDBHSA-N 0 3 407.967 4.089 20 0 HIADHN CCOc1cc(CN2CCC[C@H]2c2cccs2)ccc1O[C@@H](C)C(=O)N(C)C ZINC000506115785 914809762 /nfs/dbraw/zinc/80/97/62/914809762.db2.gz JQTGYYDDWLCJOH-WMZOPIPTSA-N 0 3 402.560 4.339 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(C)c1CN1CCC(C(=O)Nc2ccccc2O)CC1 ZINC000506128624 914814986 /nfs/dbraw/zinc/81/49/86/914814986.db2.gz IVGZDLYRSIORMP-UHFFFAOYSA-N 0 3 422.504 4.185 20 0 HIADHN COc1ccccc1-c1ncc(CN[C@H]2CCN(c3ccc(Cl)c(F)c3)C2)cn1 ZINC000491213026 904484216 /nfs/dbraw/zinc/48/42/16/904484216.db2.gz KONPOTOGLXKFML-INIZCTEOSA-N 0 3 412.896 4.313 20 0 HIADHN Clc1ccc(N2CC[C@H](NCc3cnnn3Cc3ccccc3)C2)cc1Cl ZINC000491270373 904511678 /nfs/dbraw/zinc/51/16/78/904511678.db2.gz HQXMCZNQHMSAOA-INIZCTEOSA-N 0 3 402.329 4.002 20 0 HIADHN CC(C)Oc1ccc([C@@H](CN2C(=O)CN([C@H](C)c3ccccc3)C2=O)N(C)C)cc1 ZINC000491313681 904532502 /nfs/dbraw/zinc/53/25/02/904532502.db2.gz BBEZBOCSPWWHTK-XMSQKQJNSA-N 0 3 409.530 4.102 20 0 HIADHN Cc1nc(CCN[C@@H](c2cccc(S(C)(=O)=O)c2)c2ccc(C)cc2C)cs1 ZINC000491343655 904547999 /nfs/dbraw/zinc/54/79/99/904547999.db2.gz QFPCHANCWNSLMX-QFIPXVFZSA-N 0 3 414.596 4.394 20 0 HIADHN Cc1ccc([C@H](NCCCOCC(C)C)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000491364764 904560383 /nfs/dbraw/zinc/56/03/83/904560383.db2.gz AYAKAAKUJJXPHB-HSZRJFAPSA-N 0 3 403.588 4.449 20 0 HIADHN COc1ccccc1CCN[C@@H](c1ccc(C)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000491410955 904582737 /nfs/dbraw/zinc/58/27/37/904582737.db2.gz SWRCVKIVBZAANL-DEOSSOPVSA-N 0 3 409.551 4.329 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)Nc2cccc(C(=O)N3CCCC3)c2C)c1 ZINC000491523555 904636231 /nfs/dbraw/zinc/63/62/31/904636231.db2.gz GDDPZJHFUMBSSS-UHFFFAOYSA-N 0 3 422.573 4.135 20 0 HIADHN CSc1cc2c(cc1NC(=O)N(CCN(C)C)Cc1cccc(C)c1)OCCO2 ZINC000491538135 904641883 /nfs/dbraw/zinc/64/18/83/904641883.db2.gz LJPWECQMYMDCPZ-UHFFFAOYSA-N 0 3 415.559 4.084 20 0 HIADHN CN(C)[C@H](CNC(=O)N1CCC[C@H](c2nc3ccc(F)cc3o2)C1)c1ccccc1 ZINC000506170138 914832026 /nfs/dbraw/zinc/83/20/26/914832026.db2.gz IXGRHQSCOZCGSU-FXAWDEMLSA-N 0 3 410.493 4.159 20 0 HIADHN COc1ccc(OC(F)F)c(NC(=O)N(CCN(C)C)Cc2cccc(C)c2)c1 ZINC000491720650 904687754 /nfs/dbraw/zinc/68/77/54/904687754.db2.gz DBTWDVHUWOQNRT-UHFFFAOYSA-N 0 3 407.461 4.201 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)Nc3cc(Br)cc(C(F)(F)F)c3)[C@@H]2C1 ZINC000491998157 904754734 /nfs/dbraw/zinc/75/47/34/904754734.db2.gz KKDMFIMBAZZUSI-QMTHXVAHSA-N 0 3 406.246 4.026 20 0 HIADHN Cn1cc(CN[C@H](Cc2ccc(F)cc2)[C@H]2COc3ccccc3O2)c(C(F)F)n1 ZINC000492004991 904760215 /nfs/dbraw/zinc/76/02/15/904760215.db2.gz XZGHJTZQRCEUEF-YLJYHZDGSA-N 0 3 417.431 4.038 20 0 HIADHN CCC(CC)[C@@H](O)CN[C@@H](c1cccc(S(C)(=O)=O)c1)c1ccc(C)cc1C ZINC000492078360 904791306 /nfs/dbraw/zinc/79/13/06/904791306.db2.gz HHCXVUQTACGCBN-GOTSBHOMSA-N 0 3 403.588 4.183 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)Nc3ccc(Oc4ccc(C(F)(F)F)cc4)nc3)[C@H]2C1 ZINC000492081390 904794107 /nfs/dbraw/zinc/79/41/07/904794107.db2.gz OQMVLIQSFGGTKG-KSSFIOAISA-N 0 3 420.435 4.451 20 0 HIADHN Cc1ccc([C@H](NCCN2[C@@H](C)CCC[C@@H]2C)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000492122439 904801640 /nfs/dbraw/zinc/80/16/40/904801640.db2.gz MXGGHESKVRFPTA-SKPFHBQLSA-N 0 3 414.615 4.340 20 0 HIADHN COc1ccc(CN[C@H]2CCN(c3ccccc3F)C2)c(OCc2cccnc2)c1 ZINC000492205959 904814737 /nfs/dbraw/zinc/81/47/37/904814737.db2.gz CFIJCDGNRHABGS-FQEVSTJZSA-N 0 3 407.489 4.177 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)CCc3ccc4ccccc4n3)c(C)c2)CC1 ZINC000492633726 904879939 /nfs/dbraw/zinc/87/99/39/904879939.db2.gz BAXYEXZGROKGCA-UHFFFAOYSA-N 0 3 402.542 4.256 20 0 HIADHN C[C@@H](CCCC(F)(F)F)N[C@H](C(=O)NCc1ccc2c(c1)OCO2)c1ccccc1 ZINC000492630418 904880524 /nfs/dbraw/zinc/88/05/24/904880524.db2.gz MSAKUKMYJOKALO-YWZLYKJASA-N 0 3 422.447 4.484 20 0 HIADHN Cc1nccn1CCCN(C)c1cccc2c1CCCN2CCCn1ccnc1C ZINC000492727225 904894487 /nfs/dbraw/zinc/89/44/87/904894487.db2.gz HFRGFQKAKBAIHX-UHFFFAOYSA-N 0 3 406.578 4.066 20 0 HIADHN C[C@@H](OC[C@@H](O)CN1CCC2(CC1)OCCc1ccsc12)c1ccc(Cl)cc1 ZINC000492810757 904911108 /nfs/dbraw/zinc/91/11/08/904911108.db2.gz UMKZEYWOQBBUPW-UZLBHIALSA-N 0 3 421.990 4.404 20 0 HIADHN O=C(Nc1ccc2c(c1)OC1(CCCC1)O2)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000492906954 904946051 /nfs/dbraw/zinc/94/60/51/904946051.db2.gz LPCBYFBYIRTRPO-UHFFFAOYSA-N 0 3 422.525 4.185 20 0 HIADHN C[C@@H](Cc1ccncc1)NC(=O)N(CCN(C)Cc1ccccc1)Cc1ccccc1 ZINC000492937920 904956722 /nfs/dbraw/zinc/95/67/22/904956722.db2.gz SMVOEMKBYIODSF-QFIPXVFZSA-N 0 3 416.569 4.356 20 0 HIADHN OCC[C@@]1(CN[C@@H](c2ccc(Cl)cc2)c2ccc(OC(F)F)cc2)CCOC1 ZINC000493008807 904985717 /nfs/dbraw/zinc/98/57/17/904985717.db2.gz LMTULLQQMGYEJX-FPOVZHCZSA-N 0 3 411.876 4.410 20 0 HIADHN Cc1nc(CCN[C@@H](c2ccc(F)cc2)c2cccc(S(C)(=O)=O)c2)sc1C ZINC000493053597 905004263 /nfs/dbraw/zinc/00/42/63/905004263.db2.gz GUKMDEWIQMPCOR-NRFANRHFSA-N 0 3 418.559 4.224 20 0 HIADHN COc1cccc(CCN[C@H](c2cccc(S(C)(=O)=O)c2)c2ccc(C)cc2C)n1 ZINC000493103550 905018722 /nfs/dbraw/zinc/01/87/22/905018722.db2.gz JAYDPLRIZXUJJN-XMMPIXPASA-N 0 3 424.566 4.032 20 0 HIADHN NC(=O)C1(CN[C@H](c2cccc(F)c2)c2cccc(Br)c2)CCCC1 ZINC000493107190 905022625 /nfs/dbraw/zinc/02/26/25/905022625.db2.gz WTBHUCRRIVEEQJ-SFHVURJKSA-N 0 3 405.311 4.313 20 0 HIADHN COc1ccc([C@@H](NC[C@H](C)CN2CCOCC2)c2ccccc2Cl)cc1OC ZINC000493148992 905034247 /nfs/dbraw/zinc/03/42/47/905034247.db2.gz NCCLRBBSYKNPAU-GAJHUEQPSA-N 0 3 418.965 4.005 20 0 HIADHN COc1ccc([C@@H](NC[C@@H](C)CN2CCOCC2)c2ccccc2Cl)cc1OC ZINC000493148995 905034424 /nfs/dbraw/zinc/03/44/24/905034424.db2.gz NCCLRBBSYKNPAU-UZUQRXQVSA-N 0 3 418.965 4.005 20 0 HIADHN COC(=O)c1scc(-c2ccc(C)cc2)c1NC(=O)N1CC[C@@H]2CCN(C)C[C@H]21 ZINC000493157093 905036161 /nfs/dbraw/zinc/03/61/61/905036161.db2.gz XWJWAFQKUKNTJT-FUHWJXTLSA-N 0 3 413.543 4.068 20 0 HIADHN CCCN(CC)CCN[C@@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000493200211 905047254 /nfs/dbraw/zinc/04/72/54/905047254.db2.gz BYWFGZIBSXUKSM-NRFANRHFSA-N 0 3 408.995 4.154 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)Nc1ccc2nc(C(F)F)sc2c1 ZINC000493204049 905048069 /nfs/dbraw/zinc/04/80/69/905048069.db2.gz KBIMJPBUZHUQFJ-UHFFFAOYSA-N 0 3 405.474 4.225 20 0 HIADHN CN(C(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1)[C@@H](c1ncc[nH]1)c1ccccc1 ZINC000493206367 905051048 /nfs/dbraw/zinc/05/10/48/905051048.db2.gz QRLZMFFERYNUMX-RBBKRZOGSA-N 0 3 406.505 4.009 20 0 HIADHN CCC1(CN[C@@H](c2cccc(S(C)(=O)=O)c2)c2ccc(F)c(F)c2)CCOCC1 ZINC000493231976 905058307 /nfs/dbraw/zinc/05/83/07/905058307.db2.gz RXGIQCAOFNUNNL-NRFANRHFSA-N 0 3 423.525 4.254 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)c2ccnc(SCC(F)(F)F)c2)C1 ZINC000493387818 905103224 /nfs/dbraw/zinc/10/32/24/905103224.db2.gz RKJCUPMMTABYKO-WMLDXEAASA-N 0 3 409.477 4.301 20 0 HIADHN CNS(=O)(=O)c1ccc([C@@H](C)N[C@H]2CCc3cc(Br)cc(C)c32)cc1 ZINC000493843946 905231449 /nfs/dbraw/zinc/23/14/49/905231449.db2.gz MOGJASOIEMSLJR-ACJLOTCBSA-N 0 3 423.376 4.004 20 0 HIADHN Cc1ccc([C@@H](N[C@@H]2CCc3ccccc3OC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000493891072 905247937 /nfs/dbraw/zinc/24/79/37/905247937.db2.gz JVOZOAYIZPJABM-RCZVLFRGSA-N 0 3 421.562 4.471 20 0 HIADHN CN1C(=O)C[C@H](NCc2cc(F)cc3cccnc32)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000493909552 905261896 /nfs/dbraw/zinc/26/18/96/905261896.db2.gz WBQKIFOTYKOFAE-RXVVDRJESA-N 0 3 401.844 4.228 20 0 HIADHN COc1ccccc1COc1cccc(NC(=O)N2CC[C@@H]3CCN(C)C[C@@H]32)c1C ZINC000493920070 905271208 /nfs/dbraw/zinc/27/12/08/905271208.db2.gz MXIBVVRCAYDKML-RXVVDRJESA-N 0 3 409.530 4.141 20 0 HIADHN O=C(Nc1ccccn1)N(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000493923826 905275956 /nfs/dbraw/zinc/27/59/56/905275956.db2.gz FKOWGDBLPFJUBC-QFIPXVFZSA-N 0 3 401.514 4.175 20 0 HIADHN Fc1ccc([C@H]2OCC[C@H]2NCc2nc3ccc(Br)cc3[nH]2)cc1F ZINC000493952448 905302835 /nfs/dbraw/zinc/30/28/35/905302835.db2.gz KVOHSPAJQPLKRT-CRAIPNDOSA-N 0 3 408.246 4.223 20 0 HIADHN O=C(c1cccc(CN[C@H]2CCO[C@@H]2c2ccc(F)c(F)c2)c1)N1CCCCC1 ZINC000493960936 905309194 /nfs/dbraw/zinc/30/91/94/905309194.db2.gz NTYZRLKVUHFZBQ-FCHUYYIVSA-N 0 3 400.469 4.211 20 0 HIADHN C[C@H]1[C@@H](NC(=O)c2cn(C)nc2-c2ccc(Cl)s2)CCN1Cc1ccccc1 ZINC000494006414 905349224 /nfs/dbraw/zinc/34/92/24/905349224.db2.gz IRUYGDJFCMOXSD-YOEHRIQHSA-N 0 3 414.962 4.195 20 0 HIADHN COCCC1(CN[C@H](c2ccc(Cl)cc2)c2cccc(S(C)(=O)=O)c2)CC1 ZINC000494026583 905367593 /nfs/dbraw/zinc/36/75/93/905367593.db2.gz CSYLSORHXXAIGQ-HXUWFJFHSA-N 0 3 407.963 4.239 20 0 HIADHN COCc1nc(C(=O)N[C@H]2CCN(Cc3ccccc3)[C@H]2C)c(-c2ccccc2)s1 ZINC000494051310 905390901 /nfs/dbraw/zinc/39/09/01/905390901.db2.gz UNIUVXOHVDHTDE-PXNSSMCTSA-N 0 3 421.566 4.349 20 0 HIADHN C[C@H]1[C@@H](NC(=O)c2ccc(NC(=O)c3ccccc3)cc2)CCN1Cc1ccccc1 ZINC000494061551 905398938 /nfs/dbraw/zinc/39/89/38/905398938.db2.gz XQFRAYJIXBZXPY-CYFREDJKSA-N 0 3 413.521 4.332 20 0 HIADHN CC(C)CC(=O)Nc1ccc(C(=O)N[C@H]2CCN(Cc3ccccc3)[C@@H]2C)cc1F ZINC000494070296 905408100 /nfs/dbraw/zinc/40/81/00/905408100.db2.gz WISGXWMMGUYSHA-UTKZUKDTSA-N 0 3 411.521 4.203 20 0 HIADHN CCCC(=O)NC[C@H]1CCCN(Cc2ccc(OCc3csc(C)n3)cc2)C1 ZINC000512433094 921159044 /nfs/dbraw/zinc/15/90/44/921159044.db2.gz JWVVVVRGKGVDQA-LJQANCHMSA-N 0 3 401.576 4.159 20 0 HIADHN O=C(Nc1cccc(OC2CCCC2)c1)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1CO ZINC000494263118 905588434 /nfs/dbraw/zinc/58/84/34/905588434.db2.gz VLYIASMBEQYUTC-YKSBVNFPSA-N 0 3 423.557 4.013 20 0 HIADHN C[C@H](N[C@]1(C)CCO[C@H]1C)C(=O)N1N=C(c2ccc(Cl)cc2)C[C@@H]1c1ccco1 ZINC000494266633 905590107 /nfs/dbraw/zinc/59/01/07/905590107.db2.gz ZPADVPSDYAQWFL-RMVFTWNNSA-N 0 3 415.921 4.156 20 0 HIADHN CCc1nc(C)c(CNC2CCN(C(=O)c3ccc(Br)cc3C)CC2)o1 ZINC000494307454 905624659 /nfs/dbraw/zinc/62/46/59/905624659.db2.gz FRFACXOHQALBJU-UHFFFAOYSA-N 0 3 420.351 4.011 20 0 HIADHN O=S(=O)(CCCNCc1ccc(Br)c(Cl)c1)Cc1ccccc1 ZINC000494375620 905674373 /nfs/dbraw/zinc/67/43/73/905674373.db2.gz QLWVUULRIDWJDF-UHFFFAOYSA-N 0 3 416.768 4.197 20 0 HIADHN O=C(NC[C@H]1CCCN(Cc2c[nH]nc2-c2cccs2)C1)Nc1cccc(F)c1 ZINC000512444635 921166506 /nfs/dbraw/zinc/16/65/06/921166506.db2.gz QRZHODVEZWZJSY-OAHLLOKOSA-N 0 3 413.522 4.311 20 0 HIADHN Cc1ccnc(-c2n[nH]c([C@H](C)N[C@@H](C)Cc3ccc(Br)cc3)n2)c1 ZINC000494407742 905698467 /nfs/dbraw/zinc/69/84/67/905698467.db2.gz UWBUXYSNSSRVPS-KBPBESRZSA-N 0 3 400.324 4.219 20 0 HIADHN CC(C)C(=O)NC[C@@H]1CCCN(Cc2cc3ccccc3nc2N2CCCCC2)C1 ZINC000512449148 921169074 /nfs/dbraw/zinc/16/90/74/921169074.db2.gz CEELYVHBTOGGRO-FQEVSTJZSA-N 0 3 408.590 4.209 20 0 HIADHN COc1ccccc1[C@H](NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1)c1ccco1 ZINC000494424467 905712858 /nfs/dbraw/zinc/71/28/58/905712858.db2.gz ITGFCEIHVFFZCC-YKSBVNFPSA-N 0 3 419.525 4.341 20 0 HIADHN CC1(C)CN(C(=O)c2ccc(CN3CCC(CO)CC3)cc2)c2cccc(Cl)c21 ZINC000494443966 905728881 /nfs/dbraw/zinc/72/88/81/905728881.db2.gz YPLOSEBZXGGKMS-UHFFFAOYSA-N 0 3 412.961 4.482 20 0 HIADHN Cc1ccc(N[C@H]2CCN(Cc3ccccn3)C[C@@H]2C)cc1C(=O)N1CCCCC1 ZINC000494484317 905767889 /nfs/dbraw/zinc/76/78/89/905767889.db2.gz PURBTVRUGGXLOG-RDPSFJRHSA-N 0 3 406.574 4.339 20 0 HIADHN Cc1ccc(N[C@@H]2CCN(Cc3ccccn3)C[C@H]2C)cc1C(=O)N1CCCCC1 ZINC000494484316 905768878 /nfs/dbraw/zinc/76/88/78/905768878.db2.gz PURBTVRUGGXLOG-HYBUGGRVSA-N 0 3 406.574 4.339 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)N[C@@H](c2nccs2)c2ccccc2)CCN1Cc1ccccc1 ZINC000494652632 905885424 /nfs/dbraw/zinc/88/54/24/905885424.db2.gz XYMZWLUVLSGIBN-JRGCBEDISA-N 0 3 406.555 4.195 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)NC12CCC(C(F)(F)F)(CC1)CC2 ZINC000494688683 905901448 /nfs/dbraw/zinc/90/14/48/905901448.db2.gz UIXLARSVCVBXOQ-UHFFFAOYSA-N 0 3 419.557 4.303 20 0 HIADHN CC(C)n1ncc2ccc(NC(=O)c3ccc(CN4CCC(CO)CC4)cc3)cc21 ZINC000494723121 905924634 /nfs/dbraw/zinc/92/46/34/905924634.db2.gz LDAIAXDNTSLAKE-UHFFFAOYSA-N 0 3 406.530 4.074 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)c2ccnc(SCC(F)(F)F)c2)c1 ZINC000494727019 905927608 /nfs/dbraw/zinc/92/76/08/905927608.db2.gz ACTPULOMZADRPS-UHFFFAOYSA-N 0 3 411.493 4.248 20 0 HIADHN CN(C)CCN(Cc1cccc(O)c1)C(=O)[C@H]1C[C@H]1c1cccc(Cl)c1Cl ZINC000494781761 905982446 /nfs/dbraw/zinc/98/24/46/905982446.db2.gz XNKYUJKVPOENNB-ROUUACIJSA-N 0 3 407.341 4.393 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)c1ccc(Br)c(C(F)(F)F)c1 ZINC000494900192 906074271 /nfs/dbraw/zinc/07/42/71/906074271.db2.gz HVTPYAIWLYGXJM-UHFFFAOYSA-N 0 3 419.241 4.265 20 0 HIADHN C[C@H](NCc1ccc(-n2ccc(C(F)(F)F)n2)cc1)c1ccc(C(=O)N(C)C)cc1 ZINC000494901585 906076447 /nfs/dbraw/zinc/07/64/47/906076447.db2.gz NEUWEIQWFKKDHE-HNNXBMFYSA-N 0 3 416.447 4.444 20 0 HIADHN C[C@@H]1CN(c2ccc(CN[C@H](C[C@H]3CCOC3)c3ccc(F)cc3)cn2)C[C@H](C)O1 ZINC000494917412 906089932 /nfs/dbraw/zinc/08/99/32/906089932.db2.gz AYWHCEHPCYEPKJ-ISJRUSPKSA-N 0 3 413.537 4.092 20 0 HIADHN CC1(C)C[C@@H](N[C@H](c2ccc(Cl)cc2)c2cccc(S(C)(=O)=O)c2)CCO1 ZINC000494945582 906116092 /nfs/dbraw/zinc/11/60/92/906116092.db2.gz AVPJBLBTRMPKSW-AZUAARDMSA-N 0 3 407.963 4.380 20 0 HIADHN C[C@@H](NC(=O)N(CCN(C)C)Cc1cccc(Cl)c1)[C@@H]1OCCc2sccc21 ZINC000494962290 906132179 /nfs/dbraw/zinc/13/21/79/906132179.db2.gz XEANFQPFPIECTP-QRWLVFNGSA-N 0 3 421.994 4.177 20 0 HIADHN COc1ccc([C@H](NC[C@H]2C[C@@H](O)CN2Cc2ccccc2)c2ccccc2)cc1 ZINC000494968879 906137758 /nfs/dbraw/zinc/13/77/58/906137758.db2.gz LMHLKQYBKIULHH-DGWZTRNLSA-N 0 3 402.538 4.010 20 0 HIADHN C[C@@H](NC(=O)N(Cc1ccccc1)C1CCN(C)CC1)[C@H]1OCCc2sccc21 ZINC000494970569 906139507 /nfs/dbraw/zinc/13/95/07/906139507.db2.gz CZOXGWQAWYSIFY-VGOFRKELSA-N 0 3 413.587 4.056 20 0 HIADHN Cc1c2ccccc2oc1[C@H](NC(=O)N1CCN(C2CCOCC2)C[C@@H]1C)C(C)C ZINC000495037622 906192728 /nfs/dbraw/zinc/19/27/28/906192728.db2.gz LPQBCLVJTGETQM-HTAPYJJXSA-N 0 3 413.562 4.333 20 0 HIADHN Cc1ccc(Br)cc1NC(=O)CCN[C@H](c1nnc[nH]1)C1CCCCC1 ZINC000495058144 906210159 /nfs/dbraw/zinc/21/01/59/906210159.db2.gz IEGRKBDBHQKDCK-SFHVURJKSA-N 0 3 420.355 4.115 20 0 HIADHN Cc1ccc(-c2c[nH]cc2C(=O)NCCCCN2CCN(c3ccccc3)CC2)s1 ZINC000495115942 906249687 /nfs/dbraw/zinc/24/96/87/906249687.db2.gz ZSXMXEDEXHGKIU-UHFFFAOYSA-N 0 3 422.598 4.384 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)c1cc2ccccc2n1CC(F)(F)F ZINC000495178753 906287920 /nfs/dbraw/zinc/28/79/20/906287920.db2.gz UNIVIHPQRONROZ-UHFFFAOYSA-N 0 3 403.448 4.408 20 0 HIADHN C[C@H](NC(=O)NC[C@@H]1CCCN1Cc1ccccc1)c1nc(C(F)(F)F)cs1 ZINC000495205597 906306463 /nfs/dbraw/zinc/30/64/63/906306463.db2.gz UKDZPEDHUSXLOZ-ZFWWWQNUSA-N 0 3 412.481 4.187 20 0 HIADHN CCC[C@@H](C)NC(=O)[C@H]1CCCN(Cc2c(C)nn(-c3ccc(F)cc3)c2C)C1 ZINC000512542201 921225237 /nfs/dbraw/zinc/22/52/37/921225237.db2.gz MBFULJGPSUTYSZ-APWZRJJASA-N 0 3 400.542 4.145 20 0 HIADHN Cc1cc(C2CCN(Cc3cc(=O)n4ccccc4n3)CC2)ccc1Br ZINC000495259675 906345625 /nfs/dbraw/zinc/34/56/25/906345625.db2.gz NTEURHZLFWVSIY-UHFFFAOYSA-N 0 3 412.331 4.145 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)N1CC2(CCC2)[C@H]1c1ccccc1 ZINC000495346253 906392423 /nfs/dbraw/zinc/39/24/23/906392423.db2.gz CGZKZWOOXJECSS-RUZDIDTESA-N 0 3 403.570 4.343 20 0 HIADHN O=C(Nc1ccc2nc(C3CC3)oc2c1)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000495404094 906430633 /nfs/dbraw/zinc/43/06/33/906430633.db2.gz JDNROYZRLGKUJF-UHFFFAOYSA-N 0 3 405.498 4.162 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)N[C@H](C)c2nc(C(C)(C)C)cs2)cc1 ZINC000495455620 906461180 /nfs/dbraw/zinc/46/11/80/906461180.db2.gz PRGSJYIBJJZXDV-RHSMWYFYSA-N 0 3 404.580 4.112 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)N[C@H](C)c2nc(C(C)(C)C)cs2)cc1 ZINC000495455619 906461539 /nfs/dbraw/zinc/46/15/39/906461539.db2.gz PRGSJYIBJJZXDV-PBHICJAKSA-N 0 3 404.580 4.112 20 0 HIADHN Cc1cc(OC[C@H](O)CN2CCC[C@@](O)(C(F)(F)F)CC2)c(C(C)C)cc1Cl ZINC000512562585 921238342 /nfs/dbraw/zinc/23/83/42/921238342.db2.gz YSBKBLMNUWZVQZ-BEFAXECRSA-N 0 3 423.903 4.291 20 0 HIADHN CCS(=O)(=O)c1ccc2oc(CN[C@H](Cc3ccc(F)cc3)C(C)C)nc2c1 ZINC000495499918 906488485 /nfs/dbraw/zinc/48/84/85/906488485.db2.gz QDHMFHKZQIPMPO-GOSISDBHSA-N 0 3 404.507 4.117 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N3CCC(OC4CCCCC4)CC3)cc2)CC1 ZINC000495670319 906522508 /nfs/dbraw/zinc/52/25/08/906522508.db2.gz QJGBZPTZOPYJKI-UHFFFAOYSA-N 0 3 413.606 4.171 20 0 HIADHN CCS(=O)(=O)c1ccc(N2CCC(N[C@@H](C)c3cc(F)ccc3F)CC2)cc1 ZINC000495682495 906524353 /nfs/dbraw/zinc/52/43/53/906524353.db2.gz ISHORISVNWDYMR-HNNXBMFYSA-N 0 3 408.514 4.078 20 0 HIADHN CC(C)N(CCN(C)C)C(=O)[C@@H](C)SCc1ncc(-c2ccc(Cl)cc2)o1 ZINC000495954754 906586012 /nfs/dbraw/zinc/58/60/12/906586012.db2.gz SJNRMLLZKISLPN-OAHLLOKOSA-N 0 3 409.983 4.415 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)[C@H]1C[C@@H]1c1cccc(Br)c1 ZINC000495999877 906594893 /nfs/dbraw/zinc/59/48/93/906594893.db2.gz MIGUFUQJQNKFNB-UXHICEINSA-N 0 3 401.348 4.143 20 0 HIADHN CCOc1ccc(SCC(=O)N(Cc2ccncc2)C[C@@H]2CCCN2CC)cc1 ZINC000496224839 906632646 /nfs/dbraw/zinc/63/26/46/906632646.db2.gz INMCEOPRMTTXJH-FQEVSTJZSA-N 0 3 413.587 4.086 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)c2ccnc(-c3ccc(Cl)cc3)n2)CC1 ZINC000512594123 921252859 /nfs/dbraw/zinc/25/28/59/921252859.db2.gz UQFASWUFLLYXSU-UHFFFAOYSA-N 0 3 410.905 4.127 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)CSc1ccc(Cl)cc1 ZINC000496262812 906641951 /nfs/dbraw/zinc/64/19/51/906641951.db2.gz LYUDVPNAZDJCAR-IBGZPJMESA-N 0 3 403.979 4.340 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)CCC(=O)c1ccc(Cl)cc1 ZINC000496264060 906643005 /nfs/dbraw/zinc/64/30/05/906643005.db2.gz QLNGNTUTPDHTIT-OAQYLSRUSA-N 0 3 413.949 4.211 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)c1ccc(Br)cc1F ZINC000496272814 906644444 /nfs/dbraw/zinc/64/44/44/906644444.db2.gz QCHSOUPWEGBKFN-KRWDZBQOSA-N 0 3 420.326 4.110 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)c1cccc(Oc2ccncc2)c1 ZINC000496398128 906673772 /nfs/dbraw/zinc/67/37/72/906673772.db2.gz ZPXSFAGNCNJOAZ-UHFFFAOYSA-N 0 3 411.452 4.356 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)Nc1cnn(C)c1-c1ccccc1 ZINC000496968668 906789682 /nfs/dbraw/zinc/78/96/82/906789682.db2.gz SJWBIVDIPNPLOX-UHFFFAOYSA-N 0 3 411.937 4.336 20 0 HIADHN COc1cc(CN2CCC[C@@H](c3ccc(F)cc3)CC2)cc(Cl)c1OCC(N)=O ZINC000497135710 906811750 /nfs/dbraw/zinc/81/17/50/906811750.db2.gz YKFYSWOEUMWNQW-MRXNPFEDSA-N 0 3 420.912 4.122 20 0 HIADHN CC(C)c1cc(C(=O)N(Cc2ccco2)C2CCN(C)CC2)c2cnn(C(C)C)c2n1 ZINC000497357087 906850396 /nfs/dbraw/zinc/85/03/96/906850396.db2.gz JRRPQSKYTQJXBG-UHFFFAOYSA-N 0 3 423.561 4.465 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)N[C@@H](c3ccc(F)cc3)c3ccccc3Cl)[C@@H]2C1 ZINC000497372079 906861310 /nfs/dbraw/zinc/86/13/10/906861310.db2.gz ZGOPREPFVVEVOD-LPTQZCDUSA-N 0 3 401.913 4.304 20 0 HIADHN COc1cc(CN2CCC(C(=O)N[C@@H](C)C(C)C)CC2)ccc1OCC(F)(F)F ZINC000512647054 921273276 /nfs/dbraw/zinc/27/32/76/921273276.db2.gz AIJWJWSQCMYGDW-HNNXBMFYSA-N 0 3 416.484 4.009 20 0 HIADHN O=C(Nc1cc(C(F)F)ccc1Cl)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1CO ZINC000497448107 906923691 /nfs/dbraw/zinc/92/36/91/906923691.db2.gz XVMDGDFGNQXMHY-AEFFLSMTSA-N 0 3 423.891 4.282 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N[C@H](C)c2cc(OC)c(OC)cc2F)N(C)C)cc1 ZINC000512667478 921281362 /nfs/dbraw/zinc/28/13/62/921281362.db2.gz PTFYKGICHLJJSH-QRWLVFNGSA-N 0 3 417.525 4.068 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)NC[C@H]3CC4c5ccccc5C3c3ccccc34)[C@@H]2C1 ZINC000497483038 906965506 /nfs/dbraw/zinc/96/55/06/906965506.db2.gz LTYYQIAIKNWPBT-HQHFNSQDSA-N 0 3 401.554 4.019 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)N[C@H](c3ccccc3Cl)c3cc(F)ccc3F)[C@@H]2C1 ZINC000497491240 906974868 /nfs/dbraw/zinc/97/48/68/906974868.db2.gz DDRRESJLNOAYRS-XMDBHEJHSA-N 0 3 419.903 4.443 20 0 HIADHN O=C(NCc1ccccc1)[C@H](NCCc1c[nH]c2cc(F)ccc12)c1ccccc1 ZINC000497503808 906992309 /nfs/dbraw/zinc/99/23/09/906992309.db2.gz BGNKMHXCEJGXEO-XMMPIXPASA-N 0 3 401.485 4.497 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)NCc3ccc(OC(C)(C)C)cc3C(F)(F)F)[C@H]2C1 ZINC000497509625 906998673 /nfs/dbraw/zinc/99/86/73/906998673.db2.gz VDAQKJMBXFBYNR-KSSFIOAISA-N 0 3 413.484 4.118 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)NCc3csc(-c4ccc(C(F)(F)F)cc4)n3)[C@@H]2C1 ZINC000497511075 907001552 /nfs/dbraw/zinc/00/15/52/907001552.db2.gz WKLYUOFUIIEYIY-SUMWQHHRSA-N 0 3 424.492 4.065 20 0 HIADHN COc1ccc([C@H](CNC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2F)N2CCCC2)cc1 ZINC000497556107 907043989 /nfs/dbraw/zinc/04/39/89/907043989.db2.gz HUVNJSZHQCUXKU-VWPQPMDRSA-N 0 3 400.469 4.030 20 0 HIADHN CC(C)(C)[C@@H](CN1CCc2ccccc2C1)NC(=O)N1CCC=C(c2ccncc2)C1 ZINC000497616061 907093777 /nfs/dbraw/zinc/09/37/77/907093777.db2.gz BWDQYLCQHXISTC-XMMPIXPASA-N 0 3 418.585 4.353 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)N[C@H](c3cccc(F)c3)c3cccc(Cl)c3)[C@H]2C1 ZINC000497619050 907098359 /nfs/dbraw/zinc/09/83/59/907098359.db2.gz WGWATWJUHJEZCO-NQERJWCQSA-N 0 3 401.913 4.304 20 0 HIADHN COc1cccc([C@@H](CNC(=O)C[C@@H]2CCCc3cc(OC)ccc32)N2CCCC2)c1 ZINC000497707548 907211708 /nfs/dbraw/zinc/21/17/08/907211708.db2.gz YUOCAQRGGJHAGI-NBGIEHNGSA-N 0 3 422.569 4.467 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)N[C@H](C)c2nccn2-c2ccccc2)c1 ZINC000512787401 921311496 /nfs/dbraw/zinc/31/14/96/921311496.db2.gz IGALJBVQDJQHCM-HXUWFJFHSA-N 0 3 405.546 4.015 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)NC[C@H]2CCCO[C@@H]2C(C)(C)C)N(C)C)cc1 ZINC000497823284 907305474 /nfs/dbraw/zinc/30/54/74/907305474.db2.gz PUKXUUJSRNDGHS-HJNYFJLDSA-N 0 3 419.610 4.217 20 0 HIADHN C[C@@H](NC(=O)N[C@H](CN(C)C)c1ccc(Cl)cc1)c1nccn1-c1ccccc1 ZINC000512798185 921313053 /nfs/dbraw/zinc/31/30/53/921313053.db2.gz RTXYVZPOYACSOC-OXQOHEQNSA-N 0 3 411.937 4.189 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)N[C@H](C)[C@@H](OC)c2ccc(Cl)cc2)cc1 ZINC000497847799 907326258 /nfs/dbraw/zinc/32/62/58/907326258.db2.gz QEXMPQXLKVPPEE-GQWLDOHISA-N 0 3 419.953 4.027 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)c1nc(-c2ccccc2)cs1 ZINC000497886317 907359030 /nfs/dbraw/zinc/35/90/30/907359030.db2.gz XRGYZDBBEPSBRO-UHFFFAOYSA-N 0 3 401.482 4.292 20 0 HIADHN Cc1c(NCC(C)(C)C)cccc1C(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1CO ZINC000497888350 907361723 /nfs/dbraw/zinc/36/17/23/907361723.db2.gz IIRLZABNURCJEG-QPPBQGQZSA-N 0 3 423.601 4.066 20 0 HIADHN O=C(CCC(=O)c1ccc2c(c1)CCCC2)NC1CCN(CCc2ccccc2)CC1 ZINC000497893801 907366864 /nfs/dbraw/zinc/36/68/64/907366864.db2.gz VZQICNQILMEZRD-UHFFFAOYSA-N 0 3 418.581 4.352 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)N2CCC(CC(F)(F)F)CC2)N(C)C)cc1 ZINC000512814713 921320217 /nfs/dbraw/zinc/32/02/17/921320217.db2.gz OMFOVNLCBXOCJE-LJQANCHMSA-N 0 3 415.500 4.451 20 0 HIADHN CCCCN1C(=O)C[C@H](C(=O)Nc2cccc(CN(C)C)c2)[C@H]1c1ccc(OC)cc1 ZINC000497972266 907442937 /nfs/dbraw/zinc/44/29/37/907442937.db2.gz XTSCFQCNPYNYFI-LADGPHEKSA-N 0 3 423.557 4.085 20 0 HIADHN COc1ccc([C@H](CNC(=O)CCCOc2ccc(F)cc2F)N2CCCC2)cc1 ZINC000497972765 907445062 /nfs/dbraw/zinc/44/50/62/907445062.db2.gz YGEMYFIAPFIHAL-NRFANRHFSA-N 0 3 418.484 4.086 20 0 HIADHN CCN(C(=O)c1ccc(OCC(F)(F)F)nc1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000498019393 907515250 /nfs/dbraw/zinc/51/52/50/907515250.db2.gz QTABJHXREYCUQF-LPHOPBHVSA-N 0 3 421.463 4.320 20 0 HIADHN CCN(C(=O)c1cnn(-c2ccccc2)c1C)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000498022469 907520721 /nfs/dbraw/zinc/52/07/21/907520721.db2.gz MOPDGIPKXNMDNJ-CVDCTZTESA-N 0 3 402.542 4.478 20 0 HIADHN CC[C@H](CNC(=O)c1cccc(Cn2nc(C)cc2C)c1)N1CCc2ccccc2C1 ZINC000498054085 907564775 /nfs/dbraw/zinc/56/47/75/907564775.db2.gz LDBGBFLFZQXLID-RUZDIDTESA-N 0 3 416.569 4.115 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)[C@H]1C[C@H]1c1ccc(Br)cc1 ZINC000498054123 907564886 /nfs/dbraw/zinc/56/48/86/907564886.db2.gz LTWPIEPJZLGMPF-SFTDATJTSA-N 0 3 413.359 4.117 20 0 HIADHN CN(C)Cc1cccc(C(=O)N[C@@H](Cc2ccc(O)cc2)c2nc3ccccc3[nH]2)c1 ZINC000498102649 907610603 /nfs/dbraw/zinc/61/06/03/907610603.db2.gz FHVOFUXYEYIMMV-QHCPKHFHSA-N 0 3 414.509 4.044 20 0 HIADHN CN1CCN(CCCNC(=O)c2cccc(Cl)c2Cl)[C@H](c2ccccc2)C1 ZINC000498124922 907639789 /nfs/dbraw/zinc/63/97/89/907639789.db2.gz KNPPNMFNYNKRRW-IBGZPJMESA-N 0 3 406.357 4.102 20 0 HIADHN O=C(CC1(C(F)(F)F)CC1)NC1CCN(CCOc2ccc(Cl)cc2)CC1 ZINC000498251698 907788648 /nfs/dbraw/zinc/78/86/48/907788648.db2.gz DMKQXNXERPXKGJ-UHFFFAOYSA-N 0 3 404.860 4.032 20 0 HIADHN COc1ccc(F)cc1[C@H](C)NC(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000498273436 907810120 /nfs/dbraw/zinc/81/01/20/907810120.db2.gz BPEBFVFPAUEFOW-BTYIYWSLSA-N 0 3 424.438 4.466 20 0 HIADHN CC[C@@H](NCc1ccc(Br)c(Br)c1)[C@@H](O)C(F)(F)F ZINC000498352840 907853646 /nfs/dbraw/zinc/85/36/46/907853646.db2.gz IVDQZVVEFXVEJJ-GHMZBOCLSA-N 0 3 405.052 4.003 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)c3sc(C(C)(C)C)nc3C)cc2)CC1 ZINC000498364275 907859014 /nfs/dbraw/zinc/85/90/14/907859014.db2.gz OLVGARYUSVEXCH-UHFFFAOYSA-N 0 3 400.592 4.139 20 0 HIADHN CC(=O)c1ccc(-c2ccc(C(=O)N(Cc3ccco3)C3CCN(C)CC3)o2)cc1 ZINC000498456323 907920339 /nfs/dbraw/zinc/92/03/39/907920339.db2.gz CLLMNMZXEAULRH-UHFFFAOYSA-N 0 3 406.482 4.479 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)c2cc3cc(Br)ccc3[nH]2)CC1 ZINC000498457327 907921703 /nfs/dbraw/zinc/92/17/03/907921703.db2.gz MHHRFAJYWQCXSM-UHFFFAOYSA-N 0 3 416.319 4.260 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)COc2ccc(-c3ccccc3)cc2)CC1 ZINC000498466698 907935263 /nfs/dbraw/zinc/93/52/63/907935263.db2.gz VHVXWXMGNDBUAO-UHFFFAOYSA-N 0 3 404.510 4.448 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)[C@H]1C[C@@H]1c1cccc(Br)c1 ZINC000498492452 907965474 /nfs/dbraw/zinc/96/54/74/907965474.db2.gz YJLPWSUYQDYVPK-MSOLQXFVSA-N 0 3 423.420 4.030 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N[C@H](c3cccc(C)c3)c3ccccn3)cc2)CC1 ZINC000498619165 908065716 /nfs/dbraw/zinc/06/57/16/908065716.db2.gz XTNMQFDQSLCJII-RUZDIDTESA-N 0 3 414.553 4.051 20 0 HIADHN COc1ccc([C@H](NC(=O)N(C)CCN(C)C)c2ccc(C(F)(F)F)cc2)cc1 ZINC000498676803 908106946 /nfs/dbraw/zinc/10/69/46/908106946.db2.gz SNHTXBNYLDQQQQ-LJQANCHMSA-N 0 3 409.452 4.006 20 0 HIADHN Clc1ccc2c(c1)nccc2N1CCC[C@@H](CN2CCN(c3ccccn3)CC2)C1 ZINC000498683149 908113315 /nfs/dbraw/zinc/11/33/15/908113315.db2.gz VGUVWBQIRLIIRA-IBGZPJMESA-N 0 3 421.976 4.322 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)[C@H]1C[C@H]1c1ccc(Br)cc1 ZINC000498709805 908136339 /nfs/dbraw/zinc/13/63/39/908136339.db2.gz BQNKHNYNGNOFND-OALUTQOASA-N 0 3 419.338 4.282 20 0 HIADHN Cc1ccc(-c2cc(C(=O)N3CCN(C)CC[C@H]3C)c3cnn(C(C)C)c3n2)s1 ZINC000498710118 908136835 /nfs/dbraw/zinc/13/68/35/908136835.db2.gz NRZGDGHYKPEYBP-OAHLLOKOSA-N 0 3 411.575 4.215 20 0 HIADHN C[C@H]1CCN(C)CCN1C(=O)c1ccccc1-c1nc(-c2cccc(Cl)c2)no1 ZINC000498716727 908141784 /nfs/dbraw/zinc/14/17/84/908141784.db2.gz LGXDLRQEPQAEFA-HNNXBMFYSA-N 0 3 410.905 4.223 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)NCc2ccc(-c3cccnc3)cc2)CCN1Cc1ccccc1 ZINC000498719305 908144725 /nfs/dbraw/zinc/14/47/25/908144725.db2.gz QEJYWSZWGFIAJP-DVECYGJZSA-N 0 3 400.526 4.211 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)c1csc(Br)c1 ZINC000498724329 908149801 /nfs/dbraw/zinc/14/98/01/908149801.db2.gz GEFXGYJDFJVOGU-INIZCTEOSA-N 0 3 408.365 4.032 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)c1cnn(-c2ccccc2C)c1C ZINC000498723936 908150040 /nfs/dbraw/zinc/15/00/40/908150040.db2.gz BVHBBSTYDXADIP-QFIPXVFZSA-N 0 3 417.557 4.011 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)[C@H]1C[C@@H]1c1cccc(Br)c1 ZINC000498724820 908151759 /nfs/dbraw/zinc/15/17/59/908151759.db2.gz NGIONQGHEWSGAQ-UXHICEINSA-N 0 3 419.338 4.282 20 0 HIADHN C[C@@H]1CCN(C)CCN1C(=O)c1ccc(COc2ccccc2Br)cc1 ZINC000498730723 908158091 /nfs/dbraw/zinc/15/80/91/908158091.db2.gz QQCDPEIXXYEVRD-MRXNPFEDSA-N 0 3 417.347 4.194 20 0 HIADHN Cc1ccc(-c2cc(C(=O)N3CCN(C)CC[C@H]3C)c3cnn(C(C)C)c3n2)cc1 ZINC000498738742 908166295 /nfs/dbraw/zinc/16/62/95/908166295.db2.gz RJORDOQJJATDJG-GOSISDBHSA-N 0 3 405.546 4.154 20 0 HIADHN C[C@@H](NCc1ccc(Oc2cccc(Br)c2)cc1)C1(S(C)(=O)=O)CC1 ZINC000512892043 921386061 /nfs/dbraw/zinc/38/60/61/921386061.db2.gz UEKVRCCFGAOWIU-CQSZACIVSA-N 0 3 424.360 4.297 20 0 HIADHN COCC(=O)N1CCC(N[C@@H](c2sccc2C)c2ccc(Cl)cc2F)CC1 ZINC000498781129 908197108 /nfs/dbraw/zinc/19/71/08/908197108.db2.gz AZOJNMICUNKTNR-LJQANCHMSA-N 0 3 410.942 4.165 20 0 HIADHN CC(C)(C)Oc1cc(F)ccc1NC(=O)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000498825228 908234486 /nfs/dbraw/zinc/23/44/86/908234486.db2.gz MJVXIAYMOBLUPH-UHFFFAOYSA-N 0 3 414.521 4.460 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)N2CCC[C@H](c3nccs3)C2)N(C)C)cc1 ZINC000512902695 921394309 /nfs/dbraw/zinc/39/43/09/921394309.db2.gz QXDGGBWAIYZRLV-ICSRJNTNSA-N 0 3 416.591 4.122 20 0 HIADHN C[C@@H](C(=O)Nc1ccc(Cl)c(Cl)c1)N1CCC[C@@H](c2n[nH]c(C3CC3)n2)C1 ZINC000498904944 908314359 /nfs/dbraw/zinc/31/43/59/908314359.db2.gz LZCKCQUTIMWHMK-WCQYABFASA-N 0 3 408.333 4.196 20 0 HIADHN CCc1ccccc1N(C(C)=O)c1nc(CN2C[C@@H](C)N(CC)C[C@@H]2C)cs1 ZINC000498913317 908320993 /nfs/dbraw/zinc/32/09/93/908320993.db2.gz GIGWOCWSOZHQSO-SJORKVTESA-N 0 3 400.592 4.305 20 0 HIADHN C[C@H](NC(=O)CN1CCC[C@H](c2n[nH]c(C3CC3)n2)C1)c1ccc(Cl)c(Cl)c1 ZINC000498918848 908328318 /nfs/dbraw/zinc/32/83/18/908328318.db2.gz PFWKSLUNAFSGGM-WFASDCNBSA-N 0 3 422.360 4.046 20 0 HIADHN Brc1cc2cccnc2c(CN2CCC[C@H](c3nnc(C4CC4)[nH]3)C2)c1 ZINC000498923043 908331836 /nfs/dbraw/zinc/33/18/36/908331836.db2.gz OIWPJJPFVPUDJF-HNNXBMFYSA-N 0 3 412.335 4.372 20 0 HIADHN Cc1cc(C(=O)[C@@H](C)N2CCC[C@H](c3nc(C4CC4)n[nH]3)C2)c(C)n1Cc1ccco1 ZINC000498928981 908338727 /nfs/dbraw/zinc/33/87/27/908338727.db2.gz LSEWYXOVYDYFGS-MJGOQNOKSA-N 0 3 421.545 4.193 20 0 HIADHN Cc1cc(C(=O)[C@@H](C)N2CCC[C@H](c3n[nH]c(C4CC4)n3)C2)c(C)n1Cc1ccco1 ZINC000498928981 908338733 /nfs/dbraw/zinc/33/87/33/908338733.db2.gz LSEWYXOVYDYFGS-MJGOQNOKSA-N 0 3 421.545 4.193 20 0 HIADHN C[C@@H](c1nc(Cc2ccc(Cl)cc2)no1)N1CCC[C@H](c2n[nH]c(C3CC3)n2)C1 ZINC000498936995 908343518 /nfs/dbraw/zinc/34/35/18/908343518.db2.gz PDUMGNJAUJEKJD-BBRMVZONSA-N 0 3 412.925 4.250 20 0 HIADHN C[C@H](NCC(=O)Nc1cccc(CN2CCSCC2)c1)c1ccccc1Cl ZINC000499050988 908424069 /nfs/dbraw/zinc/42/40/69/908424069.db2.gz FHYZLVAHNDTTEF-INIZCTEOSA-N 0 3 403.979 4.178 20 0 HIADHN C[C@H](c1cccc(C(F)(F)F)c1)N(C)Cc1ccc(S(=O)(=O)N(C)C)cc1 ZINC000499070625 908437397 /nfs/dbraw/zinc/43/73/97/908437397.db2.gz QRWMRPJPWANWAA-CQSZACIVSA-N 0 3 400.466 4.149 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(-n2cncn2)cc1)C(=O)Nc1ccc(Cl)cc1Cl ZINC000499074828 908440031 /nfs/dbraw/zinc/44/00/31/908440031.db2.gz YJVSWFSHZVHKSH-STQMWFEESA-N 0 3 404.301 4.252 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(-n2cncn2)cc1)C(=O)Nc1ccc(Cl)cc1Cl ZINC000499074823 908440512 /nfs/dbraw/zinc/44/05/12/908440512.db2.gz YJVSWFSHZVHKSH-CHWSQXEVSA-N 0 3 404.301 4.252 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)N[C@H](c1cccc(F)c1)c1ccccn1 ZINC000499086476 908449501 /nfs/dbraw/zinc/44/95/01/908449501.db2.gz ZAWKXZRUAIGLJO-DNQXCXABSA-N 0 3 418.516 4.446 20 0 HIADHN CCCOc1c(Cl)cc(C(=O)NC[C@H](c2ccc(C)cc2)N(C)C)cc1OC ZINC000499135420 908491378 /nfs/dbraw/zinc/49/13/78/908491378.db2.gz RIAMBBKVHNSRGQ-LJQANCHMSA-N 0 3 404.938 4.479 20 0 HIADHN Cc1ccc([C@H](CNC(=O)C2(c3ccc(Cl)cc3)CCOCC2)N(C)C)cc1 ZINC000499138178 908494656 /nfs/dbraw/zinc/49/46/56/908494656.db2.gz XTUUUSGMMLVWRM-NRFANRHFSA-N 0 3 400.950 4.116 20 0 HIADHN COc1ccc(CCC(=O)NC[C@H](c2ccc(C)cc2)N(C)C)cc1Br ZINC000499150560 908509564 /nfs/dbraw/zinc/50/95/64/908509564.db2.gz OFQWUJRLHVELOD-LJQANCHMSA-N 0 3 419.363 4.118 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)CCc2ncc(-c3ccc(F)cc3F)o2)N(C)C)cc1 ZINC000499153339 908510410 /nfs/dbraw/zinc/51/04/10/908510410.db2.gz GEAWNVQPTSXFDK-HXUWFJFHSA-N 0 3 413.468 4.280 20 0 HIADHN Cc1ccc([C@H](CNC(=O)[C@@H]2C[C@@H]2c2cccc(Br)c2)N(C)C)cc1 ZINC000499162378 908516506 /nfs/dbraw/zinc/51/65/06/908516506.db2.gz UVTRTRACAHJHCE-AQNXPRMDSA-N 0 3 401.348 4.280 20 0 HIADHN CC(C)(C)[C@H]1CCN(Cc2cn(Cc3ccccc3)nc2-c2cccnc2)C[C@H]1O ZINC000499254397 908629724 /nfs/dbraw/zinc/62/97/24/908629724.db2.gz KRXJXHTVKHEAAA-XZOQPEGZSA-N 0 3 404.558 4.222 20 0 HIADHN Cc1cccnc1[C@@H](NC(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F)C(C)C ZINC000512944573 921430180 /nfs/dbraw/zinc/43/01/80/921430180.db2.gz FHGWWBDGSNOKPT-PMACEKPBSA-N 0 3 401.501 4.361 20 0 HIADHN Cc1cc(C(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)nn1C(C)(C)C ZINC000499357676 908727452 /nfs/dbraw/zinc/72/74/52/908727452.db2.gz OTPKASJHODWUQN-UHFFFAOYSA-N 0 3 410.484 4.169 20 0 HIADHN CC(=O)CCc1ccc(O[C@H](C)C(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)cc1 ZINC000499401033 908763378 /nfs/dbraw/zinc/76/33/78/908763378.db2.gz RYYDEELEQYAUJL-BWKNWUBXSA-N 0 3 422.569 4.237 20 0 HIADHN CCCOc1ccc(CNC(=O)NC[C@H](c2cccc(OC)c2)N2CCCC2)cc1 ZINC000499675128 908872945 /nfs/dbraw/zinc/87/29/45/908872945.db2.gz KLGMMGZHIAAYRT-HSZRJFAPSA-N 0 3 411.546 4.120 20 0 HIADHN Cc1nn(-c2ccccc2)c(Oc2cccc(F)c2)c1CN[C@H](C)CC[S@](C)=O ZINC000499709307 908884523 /nfs/dbraw/zinc/88/45/23/908884523.db2.gz WVVGXHKFFNOLRI-BCOMRZATSA-N 0 3 415.534 4.359 20 0 HIADHN COc1ccc(CNCCn2cc(Br)cn2)cc1OCc1ccccc1 ZINC000512989503 921457260 /nfs/dbraw/zinc/45/72/60/921457260.db2.gz WBJHPMXCUOSLOV-UHFFFAOYSA-N 0 3 416.319 4.023 20 0 HIADHN Cc1c(C(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)cnn1CC(C)C ZINC000499954397 909058145 /nfs/dbraw/zinc/05/81/45/909058145.db2.gz IXUMNYRBPJKIME-UHFFFAOYSA-N 0 3 410.484 4.070 20 0 HIADHN O=C(c1cc(Cl)c[nH]1)N1CCC(NCc2c(F)cccc2OC(F)(F)F)CC1 ZINC000512998650 921465106 /nfs/dbraw/zinc/46/51/06/921465106.db2.gz WKWBNKIQJYFSPH-UHFFFAOYSA-N 0 3 419.806 4.100 20 0 HIADHN CN(C)[C@H](CNC(=O)Cc1csc(-c2ccc(Cl)s2)n1)Cc1ccccc1 ZINC000513001608 921468204 /nfs/dbraw/zinc/46/82/04/921468204.db2.gz KGOYXCKBNUUBNL-INIZCTEOSA-N 0 3 420.003 4.357 20 0 HIADHN CSCc1ccc(CNCc2ccc(OCCN3CCOCC3)c(Cl)c2)cc1 ZINC000513013202 921478004 /nfs/dbraw/zinc/47/80/04/921478004.db2.gz WWAIBYOXIKUUCT-UHFFFAOYSA-N 0 3 421.006 4.204 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)CCc1cc(Br)cs1 ZINC000499977413 909424252 /nfs/dbraw/zinc/42/42/52/909424252.db2.gz GPAGJNAEKPNLHR-UHFFFAOYSA-N 0 3 413.356 4.173 20 0 HIADHN COc1cc(CN2CCC(C(=O)Nc3cccc(F)c3)CC2)ccc1OC(C)C ZINC000513041035 921500141 /nfs/dbraw/zinc/50/01/41/921500141.db2.gz MWBJPQJRISUZEG-UHFFFAOYSA-N 0 3 400.494 4.472 20 0 HIADHN COc1cc(Br)cc(NC(=O)NC[C@H](c2cccs2)N2CCCC2)c1 ZINC000500066366 909535268 /nfs/dbraw/zinc/53/52/68/909535268.db2.gz VTSIUUSAWLPNKE-MRXNPFEDSA-N 0 3 424.364 4.478 20 0 HIADHN Fc1cccc(-c2noc([C@H]3CCCN(Cc4cccc5c4OCCCO5)C3)n2)c1 ZINC000513045538 921504124 /nfs/dbraw/zinc/50/41/24/921504124.db2.gz FSRFWSNSKJTIII-SFHVURJKSA-N 0 3 409.461 4.417 20 0 HIADHN COc1cc(Br)cc(NC(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000500088398 909567731 /nfs/dbraw/zinc/56/77/31/909567731.db2.gz MZOXPAFSJDEZMS-GOSISDBHSA-N 0 3 418.335 4.196 20 0 HIADHN CC(C)N1CCc2nc(CN[C@H]3CCC[C@H]3Oc3cc(F)cc(F)c3)sc2C1 ZINC000513050897 921509234 /nfs/dbraw/zinc/50/92/34/921509234.db2.gz IYBMBGVCHQBVCD-PKOBYXMFSA-N 0 3 407.530 4.278 20 0 HIADHN COc1ccccc1[C@@H](NC(=O)N[C@H](CN(C)C)c1ccc(F)cc1)c1ccco1 ZINC000500164128 909646177 /nfs/dbraw/zinc/64/61/77/909646177.db2.gz PQXXDQUHZWLQFN-DENIHFKCSA-N 0 3 411.477 4.119 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CN1CCC[C@@H](CNC(=O)c2ccccc2)C1 ZINC000513057972 921514027 /nfs/dbraw/zinc/51/40/27/921514027.db2.gz PUBXYFTWRKCOFZ-NRFANRHFSA-N 0 3 402.542 4.131 20 0 HIADHN CSc1ccsc1C(=O)NCCCCN1CCN(c2cccc(C)c2)CC1 ZINC000500215471 909708561 /nfs/dbraw/zinc/70/85/61/909708561.db2.gz LGGKWPZSADIVGO-UHFFFAOYSA-N 0 3 403.617 4.111 20 0 HIADHN CC(=O)Nc1ccc(OC[C@H](O)CN(C)[C@@H](c2ccccc2Cl)C(C)C)cc1 ZINC000500237488 909727526 /nfs/dbraw/zinc/72/75/26/909727526.db2.gz NSXHRQZFXZMTRF-XMSQKQJNSA-N 0 3 404.938 4.367 20 0 HIADHN C[C@@H](NC(=O)N(Cc1ccco1)C1CCN(C)CC1)c1ccccc1OC(F)F ZINC000500386118 909827799 /nfs/dbraw/zinc/82/77/99/909827799.db2.gz SUUAWYOWLAUWTH-OAHLLOKOSA-N 0 3 407.461 4.248 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)c2cc(C)sc2Br)cc1 ZINC000500392962 909831494 /nfs/dbraw/zinc/83/14/94/909831494.db2.gz YAXKUPGCEPFWFE-QGZVFWFLSA-N 0 3 423.376 4.395 20 0 HIADHN C[C@H](NC(=O)NC[C@H](c1ccccc1)N1CCCC1)c1ccccc1OC(F)F ZINC000500426761 909850199 /nfs/dbraw/zinc/85/01/99/909850199.db2.gz GMLLEOJIVGODDG-QFBILLFUSA-N 0 3 403.473 4.485 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)Cc2ccc(Br)s2)cc1 ZINC000500430417 909851697 /nfs/dbraw/zinc/85/16/97/909851697.db2.gz HAGFYVCKDMYTLV-KRWDZBQOSA-N 0 3 423.376 4.015 20 0 HIADHN Clc1cc(CNCc2ccc(-n3ccnc3)cc2)ccc1I ZINC000500439946 909859284 /nfs/dbraw/zinc/85/92/84/909859284.db2.gz LAJJDALQDSEELC-UHFFFAOYSA-N 0 3 423.685 4.420 20 0 HIADHN CC[C@@H](NC(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1)c1ccc(Cl)s1 ZINC000513075009 921528987 /nfs/dbraw/zinc/52/89/87/921528987.db2.gz KBASXTWKJHUPDQ-HLLBOEOZSA-N 0 3 414.015 4.383 20 0 HIADHN COc1ccc([C@H]2C[C@H]([NH2+]Cc3cc(Br)c([O-])c(OC)c3)C2)cc1F ZINC000500500766 909893311 /nfs/dbraw/zinc/89/33/11/909893311.db2.gz HOQNWXYLMXKNJB-HDJSIYSDSA-N 0 3 410.283 4.347 20 0 HIADHN CC(C)Oc1ccc(CNCc2ccc(S(=O)(=O)N3CCC[C@H](C)C3)cc2)cc1 ZINC000513078381 921531965 /nfs/dbraw/zinc/53/19/65/921531965.db2.gz ZOIIXJIDECVFSL-IBGZPJMESA-N 0 3 416.587 4.184 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)[C@@H](C)Cc1cnc2ccccc2n1 ZINC000500588510 909950354 /nfs/dbraw/zinc/95/03/54/909950354.db2.gz XYJXZNVODRGTNL-CYFREDJKSA-N 0 3 404.558 4.081 20 0 HIADHN Cc1ccccc1[C@H]([C@@H](C)NC(=O)C(=O)Nc1cc(C(F)F)ccc1Cl)N(C)C ZINC000500626207 909976663 /nfs/dbraw/zinc/97/66/63/909976663.db2.gz SAROIDBSFVJGNA-ACJLOTCBSA-N 0 3 423.891 4.332 20 0 HIADHN CCOc1cc(CNCc2ccc3[nH]c(C)cc3c2)ccc1O[C@H](C)C(=O)N(C)C ZINC000513087466 921538604 /nfs/dbraw/zinc/53/86/04/921538604.db2.gz AJQUMVDARUZSIV-QGZVFWFLSA-N 0 3 409.530 4.020 20 0 HIADHN CCN1CCN(Cc2ccc(CNC(=O)N[C@H](C)c3cc(C)sc3C)cc2)CC1 ZINC000500645020 909989066 /nfs/dbraw/zinc/98/90/66/909989066.db2.gz DJWIJLXNSMWRQW-GOSISDBHSA-N 0 3 414.619 4.063 20 0 HIADHN COc1ccc(C(=O)CCC(=O)N[C@@H]2CCN(Cc3ccccc3)CC2(C)C)cc1 ZINC000513092244 921542134 /nfs/dbraw/zinc/54/21/34/921542134.db2.gz KENFSMMMLKIPCI-HSZRJFAPSA-N 0 3 408.542 4.075 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(C)c1CN(C)C1CCN(C(=O)c2ccccc2)CC1 ZINC000513095533 921544081 /nfs/dbraw/zinc/54/40/81/921544081.db2.gz OTRBVOSMOSQOFR-UHFFFAOYSA-N 0 3 420.532 4.365 20 0 HIADHN c1ccc(CN2CCC(c3nc([C@@H]4CN(Cc5ccccc5)CCO4)no3)CC2)cc1 ZINC000500835679 910113109 /nfs/dbraw/zinc/11/31/09/910113109.db2.gz KREMEUITNSISIC-QHCPKHFHSA-N 0 3 418.541 4.023 20 0 HIADHN O=C(NCc1ccccc1COCc1ccccc1)N1CCN(C2CCCC2)CC1 ZINC000500839881 910116792 /nfs/dbraw/zinc/11/67/92/910116792.db2.gz IWCPPCNSWGBVEV-UHFFFAOYSA-N 0 3 407.558 4.173 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)Cc2csc(-c3cccc(F)c3)n2)C1 ZINC000500839758 910116883 /nfs/dbraw/zinc/11/68/83/910116883.db2.gz FOBPZHJTJOREHL-OXQOHEQNSA-N 0 3 409.530 4.443 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)Cc2ccc(F)c(Br)c2)C1 ZINC000500870269 910142182 /nfs/dbraw/zinc/14/21/82/910142182.db2.gz VCBYYUKIZXZGKD-YOEHRIQHSA-N 0 3 405.311 4.082 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)c(C)c1CNCCNC(=O)CC1CCCCC1 ZINC000500892860 910163282 /nfs/dbraw/zinc/16/32/82/910163282.db2.gz SBGJXIOFMJXXSQ-UHFFFAOYSA-N 0 3 402.970 4.319 20 0 HIADHN COc1ccc(CN(C)C2CCN(C(=O)c3ccccc3)CC2)c(OC(F)F)c1 ZINC000513107140 921553949 /nfs/dbraw/zinc/55/39/49/921553949.db2.gz UIMMJIRRVVJFME-UHFFFAOYSA-N 0 3 404.457 4.033 20 0 HIADHN COc1cccc(OC)c1Oc1ccc(CN[C@H](C)CC(=O)Nc2ccccc2)cn1 ZINC000513110258 921557804 /nfs/dbraw/zinc/55/78/04/921557804.db2.gz MDVAHPXPVDWNNL-QGZVFWFLSA-N 0 3 421.497 4.398 20 0 HIADHN CN(C)[C@H](CNC(=O)NC[C@H](c1cccc(Cl)c1)N1CCCC1)c1cccs1 ZINC000501012219 910233643 /nfs/dbraw/zinc/23/36/43/910233643.db2.gz VHWHDKJRTAOJKV-RTBURBONSA-N 0 3 421.010 4.141 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)N[C@H](c2cccc(C)c2)c2ccccn2)cc1 ZINC000501089068 910287681 /nfs/dbraw/zinc/28/76/81/910287681.db2.gz POSURSGADQUUKS-BJKOFHAPSA-N 0 3 418.541 4.090 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)N[C@@H](c2cccc(C)c2)c2ccccn2)cc1 ZINC000501089071 910287807 /nfs/dbraw/zinc/28/78/07/910287807.db2.gz POSURSGADQUUKS-RPWUZVMVSA-N 0 3 418.541 4.090 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1cc(C(=O)OC)c(F)cc1F)c1ccsc1 ZINC000501113453 910301558 /nfs/dbraw/zinc/30/15/58/910301558.db2.gz TVQRKGMKMTWVSP-QGZVFWFLSA-N 0 3 411.474 4.018 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCO[C@H](c2ccc(F)cc2)C1)c1ccsc1 ZINC000501132735 910313290 /nfs/dbraw/zinc/31/32/90/910313290.db2.gz IOTZKODRBJKNKO-UXHICEINSA-N 0 3 405.539 4.053 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CN1CCC2(C[C@H]2C(=O)N2CCCCC2)CC1 ZINC000501147625 910322054 /nfs/dbraw/zinc/32/20/54/910322054.db2.gz JTZLJQYPGJBWJO-QHCPKHFHSA-N 0 3 406.574 4.104 20 0 HIADHN CC[C@H](NCc1ccc2ncccc2c1)c1ccccc1OCC(=O)N1CCCC1 ZINC000513126383 921570186 /nfs/dbraw/zinc/57/01/86/921570186.db2.gz RVYRFKCDEPZPJB-QFIPXVFZSA-N 0 3 403.526 4.477 20 0 HIADHN Cc1noc(CSc2ccccc2C(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)n1 ZINC000501228594 910388417 /nfs/dbraw/zinc/38/84/17/910388417.db2.gz OFINCRQTOWQKCR-APWZRJJASA-N 0 3 422.554 4.236 20 0 HIADHN COc1ccc(-c2nc(C(=O)N[C@@H]3CCN([C@H](C)c4ccccc4)C3)cs2)cc1 ZINC000501233282 910390850 /nfs/dbraw/zinc/39/08/50/910390850.db2.gz MLLPRZCUGFYJOB-VQIMIIECSA-N 0 3 407.539 4.384 20 0 HIADHN COc1ccc(-c2nc(C(=O)N[C@@H]3CCN([C@@H](C)c4ccccc4)C3)cs2)cc1 ZINC000501233280 910391730 /nfs/dbraw/zinc/39/17/30/910391730.db2.gz MLLPRZCUGFYJOB-QFBILLFUSA-N 0 3 407.539 4.384 20 0 HIADHN Cc1ccc(C(=O)N(CCN(C)C)CC2CCCCC2)cc1NC(=O)c1ccco1 ZINC000501248333 910405769 /nfs/dbraw/zinc/40/57/69/910405769.db2.gz NDIZVICNBUHZKA-UHFFFAOYSA-N 0 3 411.546 4.424 20 0 HIADHN COc1cccc(CN(Cc2cnn(-c3ccc(F)cc3)c2)C2CCC(O)CC2)c1 ZINC000513137807 921578666 /nfs/dbraw/zinc/57/86/66/921578666.db2.gz BJNPCEMHAXGNAR-UHFFFAOYSA-N 0 3 409.505 4.326 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3ccc(-c4ncco4)cc3)CC2)C[C@@H](C)O1 ZINC000501397697 910526505 /nfs/dbraw/zinc/52/65/05/910526505.db2.gz KEYRGWXLTLXVOA-QZTJIDSGSA-N 0 3 412.534 4.085 20 0 HIADHN O=C(CCCOc1ccc(F)cc1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000501437460 910567316 /nfs/dbraw/zinc/56/73/16/910567316.db2.gz VUSDMKZGSWPRSN-UHFFFAOYSA-N 0 3 402.535 4.215 20 0 HIADHN CNS(=O)(=O)c1cccc([C@@H](C)NC/C(C)=C\c2ccccc2C(F)(F)F)c1 ZINC000501456343 910582367 /nfs/dbraw/zinc/58/23/67/910582367.db2.gz UGJQCCWMCGRURU-QKXCFHHRSA-N 0 3 412.477 4.368 20 0 HIADHN CN(C)C[C@H](NC(=O)N[C@@H]1CCO[C@@H]1c1ccc(Cl)c(F)c1)c1ccc(F)cc1 ZINC000501570361 910676412 /nfs/dbraw/zinc/67/64/12/910676412.db2.gz VANIFLDZORRQRW-HSALFYBXSA-N 0 3 423.891 4.050 20 0 HIADHN COc1ccc(-c2ccccc2)cc1CN1CCC[C@@H](c2n[nH]cc2NC(C)=O)C1 ZINC000501701957 910769977 /nfs/dbraw/zinc/76/99/77/910769977.db2.gz BXBZAZURNBOFEA-HXUWFJFHSA-N 0 3 404.514 4.423 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)Nc1ccccc1OCC(F)(F)F ZINC000501708816 910776821 /nfs/dbraw/zinc/77/68/21/910776821.db2.gz JCALLKJPECDKIP-UHFFFAOYSA-N 0 3 407.436 4.198 20 0 HIADHN CC(=O)Nc1ccc(CN2CCC[C@@H](c3n[nH]cc3NC(=O)c3ccccc3)C2)cc1 ZINC000501713518 910782048 /nfs/dbraw/zinc/78/20/48/910782048.db2.gz LBZRIYSGYZFBDQ-HXUWFJFHSA-N 0 3 417.513 4.000 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)Nc1ccc(Br)cc1F ZINC000501736575 910798225 /nfs/dbraw/zinc/79/82/25/910798225.db2.gz IYGMKGHXVYEAAS-UHFFFAOYSA-N 0 3 406.299 4.158 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)C[C@H](c1cccs1)n1cccc1 ZINC000501740011 910801430 /nfs/dbraw/zinc/80/14/30/910801430.db2.gz DASPLZLVUSKBBJ-HXUWFJFHSA-N 0 3 417.525 4.398 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)c1ccnc(-c2ccc(Cl)cc2)n1 ZINC000501743795 910804308 /nfs/dbraw/zinc/80/43/08/910804308.db2.gz QUFDBYIDRFWGIO-UHFFFAOYSA-N 0 3 412.896 4.140 20 0 HIADHN CCOc1ccc([C@@H]2CCCN2C(=O)NCCCN2CCc3ccccc3C2)cc1 ZINC000501755076 910814206 /nfs/dbraw/zinc/81/42/06/910814206.db2.gz OPHXIMVBSBTRED-DEOSSOPVSA-N 0 3 407.558 4.380 20 0 HIADHN C[C@@H](NCC(=O)N1Cc2ccccc2[C@H](c2ccccc2)C1)c1ccc2n[nH]cc2c1 ZINC000513184812 921608107 /nfs/dbraw/zinc/60/81/07/921608107.db2.gz VHHGOHHOPWEJKK-KOSHJBKYSA-N 0 3 410.521 4.388 20 0 HIADHN COc1ccc(Cl)cc1CN(C)C(=O)N[C@H](CN1CCCC1)c1ccccc1 ZINC000501801198 910851945 /nfs/dbraw/zinc/85/19/45/910851945.db2.gz FMZVOZGJSNDXMK-HXUWFJFHSA-N 0 3 401.938 4.327 20 0 HIADHN CCN(C(=O)c1nc(C)n(-c2ccc(F)cc2)n1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000501948601 910936312 /nfs/dbraw/zinc/93/63/12/910936312.db2.gz PZQXUBJJYUANEI-VGSWGCGISA-N 0 3 421.520 4.012 20 0 HIADHN CCN(C(=O)c1ccc2c(c1)NC(=O)CS2)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000501953995 910941371 /nfs/dbraw/zinc/94/13/71/910941371.db2.gz CUKUVQCTWBOEJW-QFBILLFUSA-N 0 3 409.555 4.028 20 0 HIADHN CCN(C(=O)c1cnc2c(cnn2CC(C)C)c1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000501962427 910949282 /nfs/dbraw/zinc/94/92/82/910949282.db2.gz PQIDTUPUFQCUES-WMZHIEFXSA-N 0 3 419.573 4.385 20 0 HIADHN COc1ccc(NC(=O)[C@H](C)NCC2(c3c(F)cccc3F)CCCC2)cc1OC ZINC000501975844 910957232 /nfs/dbraw/zinc/95/72/32/910957232.db2.gz CMKVGTKQFKWOCV-HNNXBMFYSA-N 0 3 418.484 4.411 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)N[C@@H](C)c2cc(C)cc(C)c2)CC1 ZINC000502139111 911062958 /nfs/dbraw/zinc/06/29/58/911062958.db2.gz FUAYTJMEWNNKOO-NRFANRHFSA-N 0 3 408.590 4.001 20 0 HIADHN COc1ccccc1[C@H](CNC(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C)OC(C)C ZINC000502184503 911115980 /nfs/dbraw/zinc/11/59/80/911115980.db2.gz IDLHWVBEISYWMZ-TZYHBYERSA-N 0 3 413.562 4.152 20 0 HIADHN C[C@H](NC(=O)NC[C@@H](c1ccccc1)N1CCCC1)c1cccc(OC(F)F)c1 ZINC000502225689 911172910 /nfs/dbraw/zinc/17/29/10/911172910.db2.gz KNMFRLJOXNPYBM-JXFKEZNVSA-N 0 3 403.473 4.485 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1)c1cccc(OC(F)F)c1 ZINC000502277276 911225351 /nfs/dbraw/zinc/22/53/51/911225351.db2.gz CDMDGBVFQRIQEH-QFBILLFUSA-N 0 3 403.473 4.313 20 0 HIADHN COc1ccccc1NC(=O)C[C@H](C)N[C@@H]1CCOc2c(Br)cccc21 ZINC000502301248 911261598 /nfs/dbraw/zinc/26/15/98/911261598.db2.gz ODSZNQVVMCWDNH-XJKSGUPXSA-N 0 3 419.319 4.288 20 0 HIADHN C[C@@H](CC(=O)Nc1ccc(F)cc1)N[C@@H]1CCOc2c(Br)cccc21 ZINC000502322045 911299091 /nfs/dbraw/zinc/29/90/91/911299091.db2.gz PHSMQNVMLCVKBK-YVEFUNNKSA-N 0 3 407.283 4.419 20 0 HIADHN O=C(Nc1cccc(C(=O)NC[C@H]2CCCN2Cc2ccccc2)c1)c1cccs1 ZINC000513239383 921650546 /nfs/dbraw/zinc/65/05/46/921650546.db2.gz XSXSKZPNAJSWHV-OAQYLSRUSA-N 0 3 419.550 4.395 20 0 HIADHN C[C@H](CC(=O)Nc1cccc(F)c1)N[C@@H]1CCOc2c(Br)cccc21 ZINC000502346454 911327673 /nfs/dbraw/zinc/32/76/73/911327673.db2.gz PTYBLWLULWABBI-SJKOYZFVSA-N 0 3 407.283 4.419 20 0 HIADHN C[C@@H]1CCCC[C@@H]1OCCN1CCC[C@H](c2n[nH]cc2NC(=O)c2ccccc2)C1 ZINC000502350139 911330467 /nfs/dbraw/zinc/33/04/67/911330467.db2.gz CEIJNDLURSUNLK-CBQOVEMMSA-N 0 3 410.562 4.437 20 0 HIADHN C/C=C/COc1ccc(CC[C@@H](C)NCc2cc(S(C)(=O)=O)ccc2F)cc1 ZINC000502368825 911354737 /nfs/dbraw/zinc/35/47/37/911354737.db2.gz GPHBPDPZGFBPGV-LAQIPUCWSA-N 0 3 405.535 4.295 20 0 HIADHN CC(C)(C)c1ccccc1NC(=O)NCCCN1CCN(Cc2ccccc2)CC1 ZINC000502391343 911375900 /nfs/dbraw/zinc/37/59/00/911375900.db2.gz KXUCQLYRBYTADG-UHFFFAOYSA-N 0 3 408.590 4.314 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CC(=O)N(CCCc1ccccc1)CCN(C)C ZINC000502391453 911377180 /nfs/dbraw/zinc/37/71/80/911377180.db2.gz IQFXODZWEFWXCU-UHFFFAOYSA-N 0 3 418.585 4.055 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)NCc2ccc(C(F)(F)F)cc2C)cc1 ZINC000502420422 911398462 /nfs/dbraw/zinc/39/84/62/911398462.db2.gz ZMEOGFDPKVQCMM-IBGZPJMESA-N 0 3 409.452 4.125 20 0 HIADHN O=C(Cc1csc(Cc2ccc(F)cc2)n1)NC[C@H]1CCCN1Cc1ccccc1 ZINC000513255515 921660881 /nfs/dbraw/zinc/66/08/81/921660881.db2.gz PIDIVSCEZILTCX-JOCHJYFZSA-N 0 3 423.557 4.196 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cnn(C(C)(C)C)c1)c1ccc(C(F)(F)F)cc1 ZINC000502528105 911531929 /nfs/dbraw/zinc/53/19/29/911531929.db2.gz JCOSMSVCTLFGNF-GOSISDBHSA-N 0 3 410.484 4.470 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)CCc1c(C)nn(C)c1C)c1ccc(C(F)(F)F)cc1 ZINC000502529230 911532272 /nfs/dbraw/zinc/53/22/72/911532272.db2.gz FFVITCFRIZQKMY-FQEVSTJZSA-N 0 3 424.511 4.188 20 0 HIADHN COC1CCN(C2(CNC(=O)c3sc(-c4ccc(C)o4)nc3C)CCCC2)CC1 ZINC000502530456 911534447 /nfs/dbraw/zinc/53/44/47/911534447.db2.gz POGDWRQSZBJHCA-UHFFFAOYSA-N 0 3 417.575 4.173 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3ccc([C@@H]4CCCOC4)cc3)c(C)c2)CC1 ZINC000502542210 911548892 /nfs/dbraw/zinc/54/88/92/911548892.db2.gz UKZRNGFLRFKOBG-JOCHJYFZSA-N 0 3 407.558 4.283 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cn(C)nc1C(C)C)c1ccc(C(F)(F)F)cc1 ZINC000502545555 911550974 /nfs/dbraw/zinc/55/09/74/911550974.db2.gz WJEBVDHTQYWMMY-SFHVURJKSA-N 0 3 410.484 4.375 20 0 HIADHN C[C@@H](c1ccc(F)c(F)c1)N(C)C(=O)CN[C@@]1(Cc2ccc(Cl)cc2)CCOC1 ZINC000502553403 911562891 /nfs/dbraw/zinc/56/28/91/911562891.db2.gz SJNWJNLIODUZTR-OYHNWAKOSA-N 0 3 422.903 4.129 20 0 HIADHN O=C(CN[C@@H]1CCCC[C@H]1OC(F)F)Nc1ccc2c(c1)OC1(CCCCC1)O2 ZINC000502561966 911565712 /nfs/dbraw/zinc/56/57/12/911565712.db2.gz XKNYDUOADGTCKA-HZPDHXFCSA-N 0 3 410.461 4.197 20 0 HIADHN CCOc1ccc(C(=O)CCC(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)cc1 ZINC000502855261 911864337 /nfs/dbraw/zinc/86/43/37/911864337.db2.gz IAKOTWQFJIBCRV-UHFFFAOYSA-N 0 3 423.557 4.217 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)CSc3ccc(F)c(F)c3)c2)CC1 ZINC000502891627 911887073 /nfs/dbraw/zinc/88/70/73/911887073.db2.gz CMHCJERWDXJLMM-UHFFFAOYSA-N 0 3 405.514 4.226 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)Cc3ccccc3Br)c2)CC1 ZINC000502903226 911892628 /nfs/dbraw/zinc/89/26/28/911892628.db2.gz GXPLMKFYINDKGU-UHFFFAOYSA-N 0 3 416.363 4.161 20 0 HIADHN Cc1ccc(C(C)(C)CNC(=O)N(C)C2CCN(CCc3ccccn3)CC2)cc1 ZINC000502962293 911943180 /nfs/dbraw/zinc/94/31/80/911943180.db2.gz NPJFVCOPKDVNGR-UHFFFAOYSA-N 0 3 408.590 4.016 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3cnccc3Oc3ccccc3)CC2)C[C@@H](C)O1 ZINC000503010442 911984328 /nfs/dbraw/zinc/98/43/28/911984328.db2.gz CALWMFCKLQZHLH-WOJBJXKFSA-N 0 3 423.557 4.225 20 0 HIADHN O=C(CN1CCN(C2CCCCC2)CC1)Nc1ccc(Cl)c(C(F)(F)F)c1 ZINC000513318614 921709659 /nfs/dbraw/zinc/70/96/59/921709659.db2.gz YDOSTWXREHSKOJ-UHFFFAOYSA-N 0 3 403.876 4.248 20 0 HIADHN CCc1ccc([C@H](NC(=O)CN(C)CCCn2ccnc2C)c2cccs2)cc1 ZINC000503062045 912026713 /nfs/dbraw/zinc/02/67/13/912026713.db2.gz IROPCFXHOOAAFN-QHCPKHFHSA-N 0 3 410.587 4.043 20 0 HIADHN C[C@@H](CCSc1ccccc1)N1CCN(Cc2nc3ccccc3c(=O)[nH]2)CC1 ZINC000513342375 921727144 /nfs/dbraw/zinc/72/71/44/921727144.db2.gz DRXKBSJOYJUSRT-SFHVURJKSA-N 0 3 408.571 4.024 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)N(C)[C@@H]3CCc4ccccc43)CC2)c1 ZINC000503200027 912177650 /nfs/dbraw/zinc/17/76/50/912177650.db2.gz AXFHCIDUYSSLMU-RUZDIDTESA-N 0 3 420.601 4.226 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)N(CCC(C)C)C3CC3)CC2)c1 ZINC000503214517 912197198 /nfs/dbraw/zinc/19/71/98/912197198.db2.gz BGZIGDQSCLOKBV-UHFFFAOYSA-N 0 3 400.611 4.117 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)N(C)CC3CCCCC3)CC2)c1 ZINC000503216559 912199571 /nfs/dbraw/zinc/19/95/71/912199571.db2.gz LKADZRGSFKJGBQ-UHFFFAOYSA-N 0 3 400.611 4.119 20 0 HIADHN Fc1ccc(CN2CCC[C@H](NCc3ccc(Br)cn3)C2)c(Cl)c1 ZINC000506277939 914879759 /nfs/dbraw/zinc/87/97/59/914879759.db2.gz WPIMHOVKNJLTPR-KRWDZBQOSA-N 0 3 412.734 4.391 20 0 HIADHN Cc1ccc(NC(=O)C2CC2)cc1NC(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000506296234 914891496 /nfs/dbraw/zinc/89/14/96/914891496.db2.gz XNRWEGFFCYHMFU-DYESRHJHSA-N 0 3 406.530 4.301 20 0 HIADHN Cn1c2ccccc2nc1CN1CCCN(Cc2ccc(C(F)(F)F)cc2)CC1 ZINC000506297991 914892644 /nfs/dbraw/zinc/89/26/44/914892644.db2.gz NRZCDWBSMZYRMC-UHFFFAOYSA-N 0 3 402.464 4.300 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)cc1 ZINC000506312691 914902065 /nfs/dbraw/zinc/90/20/65/914902065.db2.gz PGNGASNAIHEFII-SVMVAKDDSA-N 0 3 408.546 4.172 20 0 HIADHN CCOc1cc(C[NH2+]C[C@H](C)N2CCc3ccccc32)cc(Br)c1[O-] ZINC000506319935 914918796 /nfs/dbraw/zinc/91/87/96/914918796.db2.gz GXWLKLYGQSMECJ-AWEZNQCLSA-N 0 3 405.336 4.094 20 0 HIADHN CCCNC(=O)C1CCN(Cc2cn(Cc3ccccc3)nc2-c2cccs2)CC1 ZINC000506340383 914957296 /nfs/dbraw/zinc/95/72/96/914957296.db2.gz LGPNDADAXLAEJF-UHFFFAOYSA-N 0 3 422.598 4.398 20 0 HIADHN CC(C)Cc1ccc([C@H](CNC(=O)N2CCC[C@@H]2C2CCOCC2)N(C)C)cc1 ZINC000513357354 921735975 /nfs/dbraw/zinc/73/59/75/921735975.db2.gz MJUHQFDECBOCEA-PKTZIBPZSA-N 0 3 401.595 4.088 20 0 HIADHN CC(C)Cc1ccc([C@@H](CNC(=O)N2CCCC3(CCOCC3)C2)N(C)C)cc1 ZINC000513357551 921736191 /nfs/dbraw/zinc/73/61/91/921736191.db2.gz NBGQMCXGLSCUNW-JOCHJYFZSA-N 0 3 401.595 4.090 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(CN3CCC(C)(c4nc(C)no4)CC3)c2)cc1 ZINC000513358117 921736218 /nfs/dbraw/zinc/73/62/18/921736218.db2.gz PHPGHRYNNNTLDD-UHFFFAOYSA-N 0 3 420.513 4.193 20 0 HIADHN CN(C(=O)c1cc(-c2ccccc2Cl)on1)C1CCN(CCc2ccccn2)CC1 ZINC000513363380 921737258 /nfs/dbraw/zinc/73/72/58/921737258.db2.gz BDXKEMXSZINFRR-UHFFFAOYSA-N 0 3 424.932 4.169 20 0 HIADHN O=C(CCN1CCCN(c2ccccc2F)CC1)Nc1ccccc1C(F)(F)F ZINC000513372985 921745343 /nfs/dbraw/zinc/74/53/43/921745343.db2.gz WRMHIYGRTBPYEV-UHFFFAOYSA-N 0 3 409.427 4.385 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)CCN[C@@H](Cc1ccccn1)c1cccnc1 ZINC000513373799 921747708 /nfs/dbraw/zinc/74/77/08/921747708.db2.gz YFTOQTQYZDOBMH-IBGZPJMESA-N 0 3 410.905 4.041 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)Nc2cc(OC)ccc2Br)N(C)C)cc1 ZINC000506514181 915141925 /nfs/dbraw/zinc/14/19/25/915141925.db2.gz TXTNZRBWTQUNED-LJQANCHMSA-N 0 3 420.351 4.445 20 0 HIADHN NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC[C@H](OCC1CC1)c1ccc(Cl)cc1 ZINC000506617041 915274288 /nfs/dbraw/zinc/27/42/88/915274288.db2.gz NDXNCNGVPVRNCJ-UXHICEINSA-N 0 3 407.341 4.147 20 0 HIADHN COc1cc(CN2CCC[C@@H](c3nnc4n3CCCCC4)C2)c(SC)cc1OC ZINC000506633710 915302623 /nfs/dbraw/zinc/30/26/23/915302623.db2.gz PVVLQKOTELXAHM-MRXNPFEDSA-N 0 3 416.591 4.123 20 0 HIADHN CN(C)[C@@H](CNC(=O)Nc1ccc(C(=O)Nc2ccccc2)cc1)Cc1ccccc1 ZINC000506640708 915311040 /nfs/dbraw/zinc/31/10/40/915311040.db2.gz BAYMQXDGVRQWDJ-HSZRJFAPSA-N 0 3 416.525 4.233 20 0 HIADHN CC[C@@H](N[C@H](C)C(=O)NC12CC3CC(CC(C3)C1)C2)c1ccc(OC)c(OC)c1 ZINC000506662094 915336867 /nfs/dbraw/zinc/33/68/67/915336867.db2.gz KWMTWDUKFJQKSW-IHDYFISCSA-N 0 3 400.563 4.218 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)Nc1cccc(N2CCCC2)c1 ZINC000506683215 915360112 /nfs/dbraw/zinc/36/01/12/915360112.db2.gz STRVPWDJJLKUNI-UHFFFAOYSA-N 0 3 402.489 4.161 20 0 HIADHN Cc1noc([C@@H]2CCCCN2C(=O)NC[C@@H](c2ccc(CC(C)C)cc2)N(C)C)n1 ZINC000513396171 921765686 /nfs/dbraw/zinc/76/56/86/921765686.db2.gz PHZIZFNELUKTAF-SFTDATJTSA-N 0 3 413.566 4.116 20 0 HIADHN Cc1ccc([C@H](CNc2cc(C(=O)NC3CC3)c3ccccc3n2)N2CCCC2)o1 ZINC000506741093 915429493 /nfs/dbraw/zinc/42/94/93/915429493.db2.gz GJDIBQABKKKHDC-NRFANRHFSA-N 0 3 404.514 4.277 20 0 HIADHN CN(C)Cc1cccc(NC(=O)c2cnn(-c3ccccc3F)c2-n2cccc2)c1 ZINC000506782330 915507702 /nfs/dbraw/zinc/50/77/02/915507702.db2.gz QIXOUDOBZIYRRF-UHFFFAOYSA-N 0 3 403.461 4.116 20 0 HIADHN Cc1ccc(-c2nc(C(=O)NC[C@@H]3CCCN(Cc4cccs4)C3)cs2)o1 ZINC000513414530 921783848 /nfs/dbraw/zinc/78/38/48/921783848.db2.gz JBGAJRXFTKTQKG-HNNXBMFYSA-N 0 3 401.557 4.415 20 0 HIADHN CCSc1cccc(NC(=O)NCCCN2CCN(C)C[C@H]2c2ccccc2)c1 ZINC000506878740 915670096 /nfs/dbraw/zinc/67/00/96/915670096.db2.gz VIPQWWGWYWCQNW-QFIPXVFZSA-N 0 3 412.603 4.299 20 0 HIADHN COc1ccc([C@@H]2CCCCCN2C(=O)CN[C@H](C)c2ccc3n[nH]cc3c2)cc1 ZINC000513421056 921789128 /nfs/dbraw/zinc/78/91/28/921789128.db2.gz SRANKAMHFXMPRW-HXOBKFHXSA-N 0 3 406.530 4.366 20 0 HIADHN CCc1c(C(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)cnn1Cc1ccccc1 ZINC000513423754 921793355 /nfs/dbraw/zinc/79/33/55/921793355.db2.gz PPLPSKCRJAEPSN-RUZDIDTESA-N 0 3 416.569 4.369 20 0 HIADHN CCCCNC(=O)C1CCN(Cc2cccc(NC(=O)c3ccc(OC)cc3)c2)CC1 ZINC000507012907 915821156 /nfs/dbraw/zinc/82/11/56/915821156.db2.gz MKTXDVLHXUBLDM-UHFFFAOYSA-N 0 3 423.557 4.076 20 0 HIADHN COc1ccc([C@@H](C)NC(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)c(C)c1OC ZINC000513432192 921801118 /nfs/dbraw/zinc/80/11/18/921801118.db2.gz OWEIGWOKBFDFMI-BEFAXECRSA-N 0 3 419.953 4.329 20 0 HIADHN COc1cc(CN2CCC[C@H](C(=O)NCC3CC3)C2)ccc1OCc1cccs1 ZINC000507069389 915851841 /nfs/dbraw/zinc/85/18/41/915851841.db2.gz FOSDBLDSASLIEY-IBGZPJMESA-N 0 3 414.571 4.074 20 0 HIADHN CCN(Cc1cccc(Cl)c1)Cc1ccc(OCC(=O)N2CCCC2)c(OC)c1 ZINC000507116870 915876443 /nfs/dbraw/zinc/87/64/43/915876443.db2.gz OFDOZPJRZSMQHZ-UHFFFAOYSA-N 0 3 416.949 4.372 20 0 HIADHN CCOCCCNC(=O)C1CCN(Cc2cc(-c3ccccc3)ccc2OC)CC1 ZINC000507133854 915882863 /nfs/dbraw/zinc/88/28/63/915882863.db2.gz GHDGRYTWUOXFGM-UHFFFAOYSA-N 0 3 410.558 4.117 20 0 HIADHN CC(C)C(=O)NC1CCN(Cc2cn(Cc3ccccc3)nc2-c2ccccc2)CC1 ZINC000507141688 915887293 /nfs/dbraw/zinc/88/72/93/915887293.db2.gz HRFMYNDQMOTHPQ-UHFFFAOYSA-N 0 3 416.569 4.335 20 0 HIADHN Cc1ccc(-c2nc(C(=O)N3CCCN(CCCc4ccccc4)CC3)cs2)o1 ZINC000507149259 915891295 /nfs/dbraw/zinc/89/12/95/915891295.db2.gz LYPSULHCCPBKPD-UHFFFAOYSA-N 0 3 409.555 4.492 20 0 HIADHN O=C(c1ccn(-c2cccc(Cl)c2)n1)N1CCCN(CCCc2ccccc2)CC1 ZINC000507150203 915891446 /nfs/dbraw/zinc/89/14/46/915891446.db2.gz PDBXIJAYXFLCBZ-UHFFFAOYSA-N 0 3 422.960 4.306 20 0 HIADHN O=C(c1ccccc1OC[C@H]1CCCO1)N1CCCN(CCCc2ccccc2)CC1 ZINC000507150149 915891793 /nfs/dbraw/zinc/89/17/93/915891793.db2.gz ORAWOHWAIGYYIQ-HSZRJFAPSA-N 0 3 422.569 4.025 20 0 HIADHN CCCN(CC)c1ccc(C(=O)N2CCCN(CCCc3ccccc3)CC2)cn1 ZINC000507164124 915902771 /nfs/dbraw/zinc/90/27/71/915902771.db2.gz WCLBWVXRUPZBJS-UHFFFAOYSA-N 0 3 408.590 4.099 20 0 HIADHN Cc1ccccc1[C@@H]1CCN(CC(=O)N2CCC[C@H]2c2ccc3c(c2)OCCCO3)C1 ZINC000507184822 915933044 /nfs/dbraw/zinc/93/30/44/915933044.db2.gz XCORRBQPAVOSKA-GGAORHGYSA-N 0 3 420.553 4.309 20 0 HIADHN C/C=C/c1ccc(OC[C@@H](O)CN2CCC(Nc3ccc(F)cc3)CC2)c(OC)c1 ZINC000507220391 915974247 /nfs/dbraw/zinc/97/42/47/915974247.db2.gz WHTASVLFJNVGPC-SIAOZKNOSA-N 0 3 414.521 4.184 20 0 HIADHN C[C@H](N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1=O)c1ccc2n[nH]cc2c1 ZINC000507233224 915988459 /nfs/dbraw/zinc/98/84/59/915988459.db2.gz QCPCJAPUBZPPSL-ORAYPTAESA-N 0 3 400.429 4.011 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N[C@H](c2nccs2)c2ccccc2)C1 ZINC000507334672 916090584 /nfs/dbraw/zinc/09/05/84/916090584.db2.gz RGPVMCUYKSNHGF-QMMLZNLJSA-N 0 3 406.555 4.367 20 0 HIADHN CC(C)n1ncc2c1nc(-c1ccco1)cc2C(=O)NCCN(C)Cc1ccccc1 ZINC000507433350 916204020 /nfs/dbraw/zinc/20/40/20/916204020.db2.gz LBRXSNRXNQKNJH-UHFFFAOYSA-N 0 3 417.513 4.134 20 0 HIADHN CCOC(=O)C1CCN(C(=O)[C@H](C)N[C@@H](C)c2ccc(SC(C)C)cc2)CC1 ZINC000507487857 916255836 /nfs/dbraw/zinc/25/58/36/916255836.db2.gz SKXOZMSPAWYMAL-IRXDYDNUSA-N 0 3 406.592 4.028 20 0 HIADHN CC[C@@H]1C[C@]1(NC(=O)NCc1ccccc1CN1CCC(O)CC1)c1cccc(C)c1 ZINC000507581699 916336325 /nfs/dbraw/zinc/33/63/25/916336325.db2.gz CWXZJKCZSKYAQS-ATIYNZHBSA-N 0 3 421.585 4.076 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)C[C@@H]3CCO[C@H](CC)C3)c(OCC)c2)CC1 ZINC000507605556 916362170 /nfs/dbraw/zinc/36/21/70/916362170.db2.gz YKXXDLXHTYGKAS-TZIWHRDSSA-N 0 3 417.594 4.151 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3ccc(C(=O)CC)cc3)c(OCC)c2)CC1 ZINC000507606158 916362842 /nfs/dbraw/zinc/36/28/42/916362842.db2.gz MIEIGWGDRWAWTA-UHFFFAOYSA-N 0 3 423.557 4.462 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](NCC[C@H]2CCCCO2)c2ccc(Cl)cc2)c1 ZINC000507610805 916368104 /nfs/dbraw/zinc/36/81/04/916368104.db2.gz LRDBOHCBXDQBMS-TZIWHRDSSA-N 0 3 407.963 4.382 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)[C@H](C)c3ccsc3)c(OCC)c2)CC1 ZINC000507610379 916368773 /nfs/dbraw/zinc/36/87/73/916368773.db2.gz JGOUHTQWNIILPP-QGZVFWFLSA-N 0 3 401.576 4.421 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)C[C@H]3CCC[C@H](OC)C3)c(OCC)c2)CC1 ZINC000507623646 916382106 /nfs/dbraw/zinc/38/21/06/916382106.db2.gz WFDSGECMONWDMN-FPOVZHCZSA-N 0 3 417.594 4.151 20 0 HIADHN CC[C@@H](C)N(CC(=O)NCc1c(C)nn(Cc2ccccc2)c1C)Cc1ccccc1 ZINC000507680298 916451266 /nfs/dbraw/zinc/45/12/66/916451266.db2.gz YYHZRMWYROHIIG-HXUWFJFHSA-N 0 3 418.585 4.465 20 0 HIADHN CC(C)Sc1cc(Br)ccc1CN1CCN(C[C@H]2CCOC2)CC1 ZINC000507784998 916569413 /nfs/dbraw/zinc/56/94/13/916569413.db2.gz UYHPUJVBHAUUIL-MRXNPFEDSA-N 0 3 413.425 4.104 20 0 HIADHN COc1cccc(NC(=O)[C@H](NCCc2c[nH]c3ncccc23)c2ccccc2)c1 ZINC000507808028 916599122 /nfs/dbraw/zinc/59/91/22/916599122.db2.gz AXBRBLPVYJMLIS-JOCHJYFZSA-N 0 3 400.482 4.084 20 0 HIADHN COc1cc(CN[C@H]2CC(=O)N(C)[C@@H]2c2ccc(Cl)cc2)ccc1OC(F)F ZINC000507834478 916637410 /nfs/dbraw/zinc/63/74/10/916637410.db2.gz RJCJKTBXUKIADA-HNAYVOBHSA-N 0 3 410.848 4.012 20 0 HIADHN CCn1nc(C)c(CNCc2ccccc2-c2ccc(Cn3cncn3)cc2)c1C ZINC000507863391 916693557 /nfs/dbraw/zinc/69/35/57/916693557.db2.gz WLFVCBVLMBQJSK-UHFFFAOYSA-N 0 3 400.530 4.116 20 0 HIADHN Cc1sc(Br)c(C(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)c1C ZINC000507901416 916768659 /nfs/dbraw/zinc/76/86/59/916768659.db2.gz FUJFVCOGBREHOJ-LRDDRELGSA-N 0 3 407.377 4.378 20 0 HIADHN Cc1sc(Br)c(C(=O)Nc2ccc(OC3CCN(C)CC3)nc2)c1C ZINC000507912766 916787895 /nfs/dbraw/zinc/78/78/95/916787895.db2.gz HNAFOSQZYGIHGQ-UHFFFAOYSA-N 0 3 424.364 4.248 20 0 HIADHN COc1ccc(OCc2ccccn2)c(CNCCc2ccn(-c3ccccc3)n2)c1 ZINC000507919263 916800738 /nfs/dbraw/zinc/80/07/38/916800738.db2.gz DJMLTPPCOFIXLD-UHFFFAOYSA-N 0 3 414.509 4.187 20 0 HIADHN Cc1ccc(NC(=O)[C@H]2CCCN(Cc3ccccc3OCC(F)(F)F)C2)nc1 ZINC000507987310 916830090 /nfs/dbraw/zinc/83/00/90/916830090.db2.gz XOGNTIDTERQRLO-KRWDZBQOSA-N 0 3 407.436 4.182 20 0 HIADHN COc1ccc(C(=O)CC(C)(C)CC(=O)N2CCCN(CC3CCC3)CC2)cc1 ZINC000508012299 916850418 /nfs/dbraw/zinc/85/04/18/916850418.db2.gz JVCSQKYAXWHCMR-UHFFFAOYSA-N 0 3 400.563 4.019 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(C)c1CN1CCC[C@@H](C(=O)Nc2cccc(C)n2)C1 ZINC000508029033 916863298 /nfs/dbraw/zinc/86/32/98/916863298.db2.gz RRIACJRHUZZJAQ-LJQANCHMSA-N 0 3 421.520 4.182 20 0 HIADHN O=C(CCCc1nc2ccccc2s1)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000508068076 916890518 /nfs/dbraw/zinc/89/05/18/916890518.db2.gz CREZUFJHLGSKRF-UHFFFAOYSA-N 0 3 423.582 4.462 20 0 HIADHN Cc1oc(-c2ccccc2)nc1CC(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000508072626 916893126 /nfs/dbraw/zinc/89/31/26/916893126.db2.gz SJRJKQNXMZZZNX-UHFFFAOYSA-N 0 3 419.525 4.036 20 0 HIADHN COc1ccc2nc(C3CC3)cc(C(=O)N(C)[C@H]3CCN(Cc4ccccc4)C3)c2c1 ZINC000508078085 916897748 /nfs/dbraw/zinc/89/77/48/916897748.db2.gz FCFLTWQYFAWPTK-FQEVSTJZSA-N 0 3 415.537 4.467 20 0 HIADHN CN(C)C(=O)c1ccc(NC(=O)CNC2(c3ccc(Cl)cc3)CCCCC2)cc1 ZINC000508136594 916955870 /nfs/dbraw/zinc/95/58/70/916955870.db2.gz NBKUDEODHAUNMK-UHFFFAOYSA-N 0 3 413.949 4.430 20 0 HIADHN C[C@H](C(=O)Nc1c(-c2ccc(Br)cc2)ncn1C)N1CCCCCC1 ZINC000508399374 917191107 /nfs/dbraw/zinc/19/11/07/917191107.db2.gz PHKPNVKJENYITF-CQSZACIVSA-N 0 3 405.340 4.053 20 0 HIADHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)[C@@H]1CC[C@@H](C(F)(F)F)C1 ZINC000508535386 917316154 /nfs/dbraw/zinc/31/61/54/917316154.db2.gz SSJVTLPGYVTYLJ-HUUCEWRRSA-N 0 3 421.301 4.318 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)c1cccc(C(=O)Nc2ccccc2)c1 ZINC000508577372 917349736 /nfs/dbraw/zinc/34/97/36/917349736.db2.gz GUGQKTZNPMNBGN-UHFFFAOYSA-N 0 3 419.500 4.282 20 0 HIADHN CCSc1ccc([C@H](C)NC(=O)N2CCC(CN3C[C@H](C)O[C@@H](C)C3)CC2)cc1 ZINC000508580397 917352061 /nfs/dbraw/zinc/35/20/61/917352061.db2.gz FZRLYRSPUYDHCA-FHWLQOOXSA-N 0 3 419.635 4.390 20 0 HIADHN NC(=O)CC1CCN(Cc2cn(Cc3ccccc3Cl)nc2-c2ccccc2)CC1 ZINC000508636056 917402082 /nfs/dbraw/zinc/40/20/82/917402082.db2.gz KDYFRXFRTCJGDH-UHFFFAOYSA-N 0 3 422.960 4.339 20 0 HIADHN CC[C@H](C)NC(=O)[C@@H]1C[C@H](C)N(CC(=O)Nc2c(C)cccc2C)[C@H]2CCCC[C@H]12 ZINC000508673160 917437725 /nfs/dbraw/zinc/43/77/25/917437725.db2.gz XJXCPXMZZYHWJC-ITBHCLRTSA-N 0 3 413.606 4.426 20 0 HIADHN C[C@@H](Oc1ccc2ccccc2c1)c1nnc(N2CCN(C3CCCC3)CC2)n1C ZINC000508690951 917452837 /nfs/dbraw/zinc/45/28/37/917452837.db2.gz ZLPFPICZVJNIRZ-GOSISDBHSA-N 0 3 405.546 4.173 20 0 HIADHN Cc1cc(C)n(-c2ccc(CN3CCC(NC(=O)NC4CCCCC4)CC3)cc2)n1 ZINC000508697525 917458399 /nfs/dbraw/zinc/45/83/99/917458399.db2.gz ZGCOYWQMCIWACI-UHFFFAOYSA-N 0 3 409.578 4.085 20 0 HIADHN FC(F)(F)c1ccc(-c2n[nH]cc2CNCc2ccccc2Cn2cncn2)cc1 ZINC000508733736 917494915 /nfs/dbraw/zinc/49/49/15/917494915.db2.gz NVEZWLKXXLUENP-UHFFFAOYSA-N 0 3 412.419 4.025 20 0 HIADHN C[C@@H](NC(=O)N(Cc1ccc(F)cc1)C1CCOCC1)[C@@H](c1ccccc1)N(C)C ZINC000508852265 917605729 /nfs/dbraw/zinc/60/57/29/917605729.db2.gz JWMUPDYCQHOOFR-JPYJTQIMSA-N 0 3 413.537 4.208 20 0 HIADHN C[C@H](NC(=O)N(Cc1cccs1)C[C@@H]1CCCO1)[C@H](c1ccccc1)N(C)C ZINC000508852893 917606221 /nfs/dbraw/zinc/60/62/21/917606221.db2.gz OLBVUAONZUMBNZ-HFSMHLIXSA-N 0 3 401.576 4.130 20 0 HIADHN Cc1ccc(CNC(=O)C2CCN(Cc3ccc(OC[C@H]4CCCO4)cc3)CC2)cc1 ZINC000508853832 917607842 /nfs/dbraw/zinc/60/78/42/917607842.db2.gz GCOSZLOBRBBPFM-RUZDIDTESA-N 0 3 422.569 4.081 20 0 HIADHN CCO[C@H](C)c1nc(CN(C)C(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)cs1 ZINC000508871857 917625530 /nfs/dbraw/zinc/62/55/30/917625530.db2.gz QPJMAHBMSXVRJS-GPMSIDNRSA-N 0 3 404.580 4.073 20 0 HIADHN C[C@H](NC(=O)N(C)Cc1cccc(Br)c1)[C@H](c1ccccc1)N(C)C ZINC000508905649 917661775 /nfs/dbraw/zinc/66/17/75/917661775.db2.gz MJWXOIWTUPPOMD-HNAYVOBHSA-N 0 3 404.352 4.282 20 0 HIADHN C[C@H](NC(=O)N1CCO[C@H](c2ccc(F)cc2Cl)C1)[C@@H](c1ccccc1)N(C)C ZINC000508907769 917663795 /nfs/dbraw/zinc/66/37/95/917663795.db2.gz QZGYLSWZVFKGCF-JHVJFLLYSA-N 0 3 419.928 4.253 20 0 HIADHN C[C@H](NC(=O)N1CCO[C@@H](c2ccc(F)c(Cl)c2)C1)[C@H](c1ccccc1)N(C)C ZINC000508925979 917685113 /nfs/dbraw/zinc/68/51/13/917685113.db2.gz UPVUOCAKJAFJAI-IWMITWMQSA-N 0 3 419.928 4.253 20 0 HIADHN CC[C@@H](NCCCN1CCN(c2ccccc2)CC1)c1nc(C(F)(F)F)cs1 ZINC000508977000 917730469 /nfs/dbraw/zinc/73/04/69/917730469.db2.gz LPIYOMMUPQUDFR-QGZVFWFLSA-N 0 3 412.525 4.415 20 0 HIADHN COc1cccc([C@H](C)NC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)c1 ZINC000509003356 917757769 /nfs/dbraw/zinc/75/77/69/917757769.db2.gz WWQJGGZYCUCEEG-HRAATJIYSA-N 0 3 406.448 4.327 20 0 HIADHN CCCN(C)[C@H](CNC(=O)N1CCCC[C@@H]1c1ncc[nH]1)c1ccc(Cl)cc1 ZINC000509033313 917788587 /nfs/dbraw/zinc/78/85/87/917788587.db2.gz RAIPXOVTIYJLDZ-RTBURBONSA-N 0 3 403.958 4.383 20 0 HIADHN CCN(C(=O)NCc1c(F)cccc1N1CCCC1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000509047127 917798709 /nfs/dbraw/zinc/79/87/09/917798709.db2.gz APZGJUGMVRTTBN-OAQYLSRUSA-N 0 3 424.564 4.232 20 0 HIADHN CCCN(C)[C@H](CNC(=O)N1CCCC[C@H]1c1cc[nH]n1)c1ccc(Cl)cc1 ZINC000509050884 917801329 /nfs/dbraw/zinc/80/13/29/917801329.db2.gz NHNYFPFOSDCPGX-VQTJNVASSA-N 0 3 403.958 4.383 20 0 HIADHN Cc1cc(NC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)nc(C(C)C)n1 ZINC000509222540 917921654 /nfs/dbraw/zinc/92/16/54/917921654.db2.gz DBGOZCQWCNVSTK-FQEVSTJZSA-N 0 3 406.452 4.302 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N[C@H](CC(F)(F)F)c3ccc(F)cc3)cc2)CC1 ZINC000509294104 917975679 /nfs/dbraw/zinc/97/56/79/917975679.db2.gz NVNQUWRANLQYMB-HXUWFJFHSA-N 0 3 423.454 4.391 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N[C@H](c2nccs2)c2ccccc2)N(C)C)cc1 ZINC000509369780 918036401 /nfs/dbraw/zinc/03/64/01/918036401.db2.gz FQEOMIWLWURTME-SFTDATJTSA-N 0 3 408.571 4.397 20 0 HIADHN O=C(Nc1ccc(Cl)cn1)[C@@H]1CCCN(Cc2c[nH]nc2-c2ccccc2F)C1 ZINC000509374057 918038631 /nfs/dbraw/zinc/03/86/31/918038631.db2.gz QEDDBXGPIYHPLT-CQSZACIVSA-N 0 3 413.884 4.115 20 0 HIADHN COc1ccc(C(=O)CCN2CCC(C(=O)N(Cc3ccccc3)C3CC3)CC2)cc1 ZINC000509377098 918043164 /nfs/dbraw/zinc/04/31/64/918043164.db2.gz BAPZYSMKHDVVOO-UHFFFAOYSA-N 0 3 420.553 4.171 20 0 HIADHN Cc1ccc(C)n1-c1nc(CC(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)cs1 ZINC000509509730 918156553 /nfs/dbraw/zinc/15/65/53/918156553.db2.gz REBDFURLDGJARB-QUCCMNQESA-N 0 3 408.571 4.045 20 0 HIADHN COc1ccccc1NC(=O)C1CCN(Cc2ccc(Oc3cnccn3)cc2)CC1 ZINC000509550058 918200251 /nfs/dbraw/zinc/20/02/51/918200251.db2.gz SJPCCSKHVYMIHD-UHFFFAOYSA-N 0 3 418.497 4.128 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N1CCC(Oc2ccc(F)cc2)CC1)c1ccco1 ZINC000509561743 918210517 /nfs/dbraw/zinc/21/05/17/918210517.db2.gz ZCBCEFFSQQIIOM-JXFKEZNVSA-N 0 3 403.498 4.101 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N(C)Cc1nc(C(F)(F)F)cs1)c1ccco1 ZINC000509569128 918219207 /nfs/dbraw/zinc/21/92/07/918219207.db2.gz NBHPLSLOHYJXKR-RYUDHWBXSA-N 0 3 404.458 4.026 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N[C@H](C)c1ccc(OC)c(OC)c1C)c1ccco1 ZINC000509572282 918221832 /nfs/dbraw/zinc/22/18/32/918221832.db2.gz VBXUMOOBRJLHDY-LESCRADOSA-N 0 3 403.523 4.095 20 0 HIADHN CCOc1cc(CN(CC)[C@@H](C)c2cccc(O)c2)ccc1O[C@H](C)C(=O)N(C)C ZINC000509579837 918228204 /nfs/dbraw/zinc/22/82/04/918228204.db2.gz NSEZVSDRJIPDDB-ZWKOTPCHSA-N 0 3 414.546 4.230 20 0 HIADHN COc1ccc(C[C@@H](NCc2ccc3c(c2)NC(=O)CO3)c2ccc(OC)cc2)cc1 ZINC000509584224 918234222 /nfs/dbraw/zinc/23/42/22/918234222.db2.gz MVIPIYDTPDZTCH-JOCHJYFZSA-N 0 3 418.493 4.108 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)N1CCC(OC2CCC(C)CC2)CC1)c1ccco1 ZINC000509592333 918240255 /nfs/dbraw/zinc/24/02/55/918240255.db2.gz ABTVTCGPAOBGKN-DRDORILISA-N 0 3 405.583 4.478 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N1CCC(OC2CCC(C)CC2)CC1)c1ccco1 ZINC000509592335 918241214 /nfs/dbraw/zinc/24/12/14/918241214.db2.gz ABTVTCGPAOBGKN-GTECDBCCSA-N 0 3 405.583 4.478 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)N(C)Cc1ccccc1OC(F)(F)F)c1ccco1 ZINC000509597725 918248718 /nfs/dbraw/zinc/24/87/18/918248718.db2.gz ALXDUFDKMFLAIV-ZBFHGGJFSA-N 0 3 413.440 4.449 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N(C)Cc1ccc(OC(F)(F)F)cc1)c1ccco1 ZINC000509612408 918260996 /nfs/dbraw/zinc/26/09/96/918260996.db2.gz YGMVPHQNQSVUFN-YOEHRIQHSA-N 0 3 413.440 4.449 20 0 HIADHN CCc1nc2c(s1)[C@H](N(C)C(=O)NC[C@@H](N[C@H](C)CC)c1ccco1)CCC2 ZINC000509615381 918264781 /nfs/dbraw/zinc/26/47/81/918264781.db2.gz UTNIJWTUIWWMGP-DJIMGWMZSA-N 0 3 404.580 4.447 20 0 HIADHN Fc1ccc([C@@H]2CN(CCCN3CCN(c4ccccc4)CC3)CCO2)cc1Cl ZINC000509668646 918301667 /nfs/dbraw/zinc/30/16/67/918301667.db2.gz VBESFLHUEPJYFT-QHCPKHFHSA-N 0 3 417.956 4.065 20 0 HIADHN Cc1cc(Br)cc(C)c1N1CCC[C@@H](N2CCC3(C2)CCOCC3)C1=O ZINC000509699041 918329259 /nfs/dbraw/zinc/32/92/59/918329259.db2.gz PQOLYDBKWBMONB-GOSISDBHSA-N 0 3 421.379 4.064 20 0 HIADHN CC[C@H](CNC(=O)N[C@H](C[C@H]1CCOC1)c1ccccc1)N1CCc2ccccc2C1 ZINC000509752891 918369861 /nfs/dbraw/zinc/36/98/61/918369861.db2.gz WDEPZRYHJPJRJH-NIJXNBFTSA-N 0 3 421.585 4.290 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)NCc3ccccc3C[NH+]3CCCC3)cc2)cc(=O)[n-]1 ZINC000509856028 918458812 /nfs/dbraw/zinc/45/88/12/918458812.db2.gz SHFNOQUYHVCXPX-UHFFFAOYSA-N 0 3 417.513 4.075 20 0 HIADHN O=S(=O)([N-]C1CC[NH+](C2CCCCC2)CC1)c1cc(Cl)ccc1C(F)(F)F ZINC000509881403 918484440 /nfs/dbraw/zinc/48/44/40/918484440.db2.gz BAQGTPPQYAVLHI-UHFFFAOYSA-N 0 3 424.916 4.434 20 0 HIADHN CC(C)CN(C(=O)CSc1nnc(-c2ccc(Cl)cc2)o1)C1CCN(C)CC1 ZINC000509930423 918528958 /nfs/dbraw/zinc/52/89/58/918528958.db2.gz NQZDFMCRXWTVHH-UHFFFAOYSA-N 0 3 422.982 4.061 20 0 HIADHN O=C(Nc1ccccc1)N1CC[C@@H](NCc2ccc(Cl)c(Br)c2)C1 ZINC000509964985 918555137 /nfs/dbraw/zinc/55/51/37/918555137.db2.gz YRKWDBLGVDBCLD-OAHLLOKOSA-N 0 3 408.727 4.499 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)cc1CN[C@@H]1CCN(C(=O)Nc2ccccc2)C1 ZINC000509977428 918566579 /nfs/dbraw/zinc/56/65/79/918566579.db2.gz NWXCDNBKYDTQOK-HXUWFJFHSA-N 0 3 409.921 4.230 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCc3ccc(F)c(Cl)c3)c(C)c2)CC1 ZINC000510025097 918601873 /nfs/dbraw/zinc/60/18/73/918601873.db2.gz YKXNYZCAGMKXMH-UHFFFAOYSA-N 0 3 404.917 4.251 20 0 HIADHN CN(C(=O)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1)C1CCOCC1 ZINC000510053410 918624628 /nfs/dbraw/zinc/62/46/28/918624628.db2.gz DURWXEDKTRBZGA-UHFFFAOYSA-N 0 3 414.377 4.122 20 0 HIADHN Cc1cccc(C)c1NC(=O)CNC(=O)[C@H](C)N1CCC[C@@](C)(c2ccccc2)CC1 ZINC000510077123 918646011 /nfs/dbraw/zinc/64/60/11/918646011.db2.gz AYFHESBYAHOKMM-HFZDXXHNSA-N 0 3 421.585 4.190 20 0 HIADHN O=C(Nc1ccc(C(=O)NC2CCCC2)cc1)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000510165290 918716618 /nfs/dbraw/zinc/71/66/18/918716618.db2.gz CWVWPRRNJHYXCM-QHCPKHFHSA-N 0 3 420.557 4.145 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1nnc(-c2ccco2)s1)c1cccc(OC)c1 ZINC000510226305 918768472 /nfs/dbraw/zinc/76/84/72/918768472.db2.gz DCPLMHRFGZNWJS-MRXNPFEDSA-N 0 3 415.519 4.011 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)NCC1(C(F)(F)F)CC1 ZINC000510313396 918824805 /nfs/dbraw/zinc/82/48/05/918824805.db2.gz NVQGHZSLUWQQPI-UHFFFAOYSA-N 0 3 411.390 4.121 20 0 HIADHN COc1ccc(NC(=O)c2oc3ccccc3c2CN(C)C)cc1N1CCCCC1=O ZINC000510314898 918824821 /nfs/dbraw/zinc/82/48/21/918824821.db2.gz XFOUCWZLSSAZPM-UHFFFAOYSA-N 0 3 421.497 4.272 20 0 HIADHN Cc1cc(F)ccc1NC(=O)N(CCN(C)C)Cc1ccc(Br)cc1 ZINC000510333034 918837490 /nfs/dbraw/zinc/83/74/90/918837490.db2.gz VPIDTSUYDFONPQ-UHFFFAOYSA-N 0 3 408.315 4.492 20 0 HIADHN C[C@H](c1ncc(-c2ccc(Cl)cc2Cl)o1)N1CCN(C[C@@H]2CCOC2)CC1 ZINC000510374498 918860883 /nfs/dbraw/zinc/86/08/83/918860883.db2.gz GUZLPBQJDJCKAQ-CABCVRRESA-N 0 3 410.345 4.364 20 0 HIADHN CCCN(CCC)C(=O)c1ccc(NC(=O)NC[C@@H](c2ccccc2)N(C)C)cc1 ZINC000510408844 918879563 /nfs/dbraw/zinc/87/95/63/918879563.db2.gz SOTFHOBYFUZUQE-QFIPXVFZSA-N 0 3 410.562 4.373 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)NCC1(c2ccc(F)cc2)CCOCC1 ZINC000510420355 918887105 /nfs/dbraw/zinc/88/71/05/918887105.db2.gz PHZXNTMRSWMNJU-UHFFFAOYSA-N 0 3 410.489 4.112 20 0 HIADHN COC[C@@H](C)N(C)Cc1cn(Cc2ccccc2)nc1-c1ccc(OC)c(OC)c1 ZINC000510434424 918895211 /nfs/dbraw/zinc/89/52/11/918895211.db2.gz DHNGQVHKYGGCFV-GOSISDBHSA-N 0 3 409.530 4.082 20 0 HIADHN CCOCCOCc1cccc(NC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000510460921 918915569 /nfs/dbraw/zinc/91/55/69/918915569.db2.gz LTEHDUVOUCQTGX-HSZRJFAPSA-N 0 3 411.546 4.026 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)Nc1cccc(Cl)c1-n1cccn1 ZINC000510459923 918916494 /nfs/dbraw/zinc/91/64/94/918916494.db2.gz PPKDBYYUVNJBKU-HXUWFJFHSA-N 0 3 409.921 4.484 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)N1CCC(Oc2ccc(F)cc2F)CC1 ZINC000510499544 918947408 /nfs/dbraw/zinc/94/74/08/918947408.db2.gz GQUMLAVYRMKXLC-UHFFFAOYSA-N 0 3 414.452 4.456 20 0 HIADHN C[C@H](NC(=O)N[C@H](c1ccc(Br)cc1)C1CCC1)C1=CCN(C)CC1 ZINC000510518757 918964669 /nfs/dbraw/zinc/96/46/69/918964669.db2.gz BIUHDRHOJQDDNW-LIRRHRJNSA-N 0 3 406.368 4.240 20 0 HIADHN COc1cc([C@@H](C)NC(=O)N[C@H](C)C2=CCN(C)CC2)ccc1OCc1ccccc1 ZINC000510541909 918986868 /nfs/dbraw/zinc/98/68/68/918986868.db2.gz VPNPMZNLVMLRDA-RTBURBONSA-N 0 3 423.557 4.285 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2CN2CCC(N3CCO[C@@H](C)C3)CC2)o1 ZINC000510549198 918993957 /nfs/dbraw/zinc/99/39/57/918993957.db2.gz CHFWOYAEBPXGME-FQEVSTJZSA-N 0 3 420.557 4.126 20 0 HIADHN C[C@H](NC(=O)NCC1(c2cccc(Br)c2)CCCC1)C1=CCN(C)CC1 ZINC000510595338 919038225 /nfs/dbraw/zinc/03/82/25/919038225.db2.gz FOKMWYLZBQNLOR-INIZCTEOSA-N 0 3 420.395 4.211 20 0 HIADHN C[C@H](NC(=O)NCc1ccc(-c2ccc3c(c2)C[C@@H](C)O3)cc1)C1=CCN(C)CC1 ZINC000510605166 919046689 /nfs/dbraw/zinc/04/66/89/919046689.db2.gz ATMAGUBSOREMFR-MSOLQXFVSA-N 0 3 405.542 4.127 20 0 HIADHN CCOC(=O)c1cnn(C2CCN(CCSc3ccc(Cl)cc3)CC2)c1C ZINC000510616740 919058525 /nfs/dbraw/zinc/05/85/25/919058525.db2.gz GKQIGYIZDIJDHQ-UHFFFAOYSA-N 0 3 407.967 4.451 20 0 HIADHN CC[C@@H](NCc1nc2cc(C(=O)OC)ccc2c(=O)[nH]1)C12CC3CC(CC(C3)C1)C2 ZINC000510617513 919059409 /nfs/dbraw/zinc/05/94/09/919059409.db2.gz ISCQWDYVQWPONI-KBTRNUBCSA-N 0 3 409.530 4.207 20 0 HIADHN Cc1noc(COc2ccc(NC(=O)c3oc4ccccc4c3CN(C)C)cc2)n1 ZINC000510618103 919060406 /nfs/dbraw/zinc/06/04/06/919060406.db2.gz SULGKWNLFSAXRV-UHFFFAOYSA-N 0 3 406.442 4.017 20 0 HIADHN O=C(Nc1cccc(CN[C@H]2CCc3ccc(Br)cc32)c1)[C@H]1CCCO1 ZINC000510656077 919096755 /nfs/dbraw/zinc/09/67/55/919096755.db2.gz KNFOBDUPXWKNDG-VQTJNVASSA-N 0 3 415.331 4.344 20 0 HIADHN C[C@@H]1CN(c2ccc(CN[C@H]3CCc4ccc(Br)cc43)cn2)C[C@H](C)O1 ZINC000510668468 919109821 /nfs/dbraw/zinc/10/98/21/919109821.db2.gz JNIDFTGAPJCUNH-MDOVXXIYSA-N 0 3 416.363 4.235 20 0 HIADHN Cc1cc(OCCC[C@H](C)[NH2+][C@H](c2nc(-c3nc[n-]n3)no2)C(C)C)ccc1Cl ZINC000510677229 919117012 /nfs/dbraw/zinc/11/70/12/919117012.db2.gz AGADUUDQEMDOMI-YOEHRIQHSA-N 0 3 418.929 4.351 20 0 HIADHN CC(C)[C@@H]([NH2+][C@H](C)CCc1ccc(C(F)(F)F)cc1)c1nc(-c2nc[n-]n2)no1 ZINC000510680845 919119653 /nfs/dbraw/zinc/11/96/53/919119653.db2.gz JFPUCIGHTNDHKS-IUODEOHRSA-N 0 3 408.428 4.182 20 0 HIADHN Cc1cc(N2CCCC2)ccc1NC(=O)CN[C@@H](c1ccc2c(c1)OCCO2)C(C)C ZINC000510687709 919125554 /nfs/dbraw/zinc/12/55/54/919125554.db2.gz ZOLYYWGNVMRSFF-RUZDIDTESA-N 0 3 423.557 4.292 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)Cc1ccc(Br)s1 ZINC000510727335 919172795 /nfs/dbraw/zinc/17/27/95/919172795.db2.gz PEXQOGQGKVSXDL-UHFFFAOYSA-N 0 3 415.784 4.297 20 0 HIADHN COc1cc([C@@H](C)N[C@H]2CCc3ccc(Br)cc32)ccc1OCCO ZINC000510732279 919177794 /nfs/dbraw/zinc/17/77/94/919177794.db2.gz HLEUNBCIZUWVIW-ACJLOTCBSA-N 0 3 406.320 4.167 20 0 HIADHN C[C@@H](NC(=O)Cc1csc(-c2cccc(C(F)(F)F)c2)n1)C1=CCN(C)CC1 ZINC000510788880 919256068 /nfs/dbraw/zinc/25/60/68/919256068.db2.gz VONUGYPWETWYFS-CYBMUJFWSA-N 0 3 409.477 4.138 20 0 HIADHN C[C@@H]1CSc2ccc(Br)cc2[C@@H]1NCc1ccc2c(c1)oc(=O)n2C ZINC000510798771 919270309 /nfs/dbraw/zinc/27/03/09/919270309.db2.gz TUJBGKYZYMUTGT-ADLMAVQZSA-N 0 3 419.344 4.467 20 0 HIADHN CN(CCc1nccs1)C[C@H](O)COC(c1ccc(F)cc1)c1ccc(F)cc1 ZINC000510806733 919282460 /nfs/dbraw/zinc/28/24/60/919282460.db2.gz OLYXRYCSBILSRL-FQEVSTJZSA-N 0 3 418.509 4.063 20 0 HIADHN C[C@@H](c1cccc(NC(=O)c2oc3ccccc3c2CN(C)C)c1)N1CCOCC1 ZINC000510853704 919342610 /nfs/dbraw/zinc/34/26/10/919342610.db2.gz RGBPZWAQFYQUEW-KRWDZBQOSA-N 0 3 407.514 4.140 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc(CNCc2cccc(OCC(C)C)c2)cc1 ZINC000510857499 919347436 /nfs/dbraw/zinc/34/74/36/919347436.db2.gz QZRSKDIHHWOOOL-UHFFFAOYSA-N 0 3 404.576 4.042 20 0 HIADHN COc1ccc(C[C@@H](C)C(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)cc1OC ZINC000510885897 919382528 /nfs/dbraw/zinc/38/25/28/919382528.db2.gz YKUKXUPTVGYTIY-DENIHFKCSA-N 0 3 410.558 4.005 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@@H](C)N[C@H]2CCc3cc(F)c(OC)cc32)cc1 ZINC000510962058 919503333 /nfs/dbraw/zinc/50/33/33/919503333.db2.gz YWJNSCDZQIQAJA-VFNWGFHPSA-N 0 3 420.550 4.203 20 0 HIADHN COc1ccc2oc([C@H](C)N[C@@H]3CCN(C(=O)COc4ccccc4)C3)c(C)c2c1 ZINC000511009393 919569904 /nfs/dbraw/zinc/56/99/04/919569904.db2.gz FNEDUBBCXSBYLT-ZWKOTPCHSA-N 0 3 408.498 4.080 20 0 HIADHN COc1cc(OC)c([C@@H](C)N[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)cc1Cl ZINC000511008283 919570406 /nfs/dbraw/zinc/57/04/06/919570406.db2.gz ANPMAVFWZPWLKL-SJLPKXTDSA-N 0 3 416.949 4.242 20 0 HIADHN COc1cc(C(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)cc(OC)c1C(C)C ZINC000511020322 919587726 /nfs/dbraw/zinc/58/77/26/919587726.db2.gz YCQDCCQSSYNPLN-UHFFFAOYSA-N 0 3 420.500 4.309 20 0 HIADHN CCC(C)(C)NC(=O)c1ccc(NC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000511055304 919652875 /nfs/dbraw/zinc/65/28/75/919652875.db2.gz XTDHTGKYRAXODL-QFIPXVFZSA-N 0 3 422.573 4.391 20 0 HIADHN O=C(CC(F)(F)F)NC[C@@H]1CCCN(Cc2ccccc2Oc2cccnc2)C1 ZINC000511066553 919667658 /nfs/dbraw/zinc/66/76/58/919667658.db2.gz RZPRNYYEQWHTFN-INIZCTEOSA-N 0 3 407.436 4.155 20 0 HIADHN C[C@@H]1CN(c2ccccc2NC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)C[C@H](C)O1 ZINC000511080040 919682249 /nfs/dbraw/zinc/68/22/49/919682249.db2.gz MOTDLXQTLFQYDB-VWPQPMDRSA-N 0 3 422.573 4.086 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)c2cc(C)nc3c2cnn3[C@@H](C)CC)N(C)C)cc1 ZINC000511091470 919695632 /nfs/dbraw/zinc/69/56/32/919695632.db2.gz PWWFVAGWSBPKKW-HTAPYJJXSA-N 0 3 407.562 4.306 20 0 HIADHN Cn1nccc1C1=CCN(CCC(=O)Nc2ccc(OCc3ccccc3)cc2)CC1 ZINC000511093219 919697130 /nfs/dbraw/zinc/69/71/30/919697130.db2.gz QFMFAKGDUBAXNY-UHFFFAOYSA-N 0 3 416.525 4.117 20 0 HIADHN Cc1csc2nc(CN3CCC[C@H](c4cccc(C(F)(F)F)c4)C3)cc(=O)n12 ZINC000511108194 919717362 /nfs/dbraw/zinc/71/73/62/919717362.db2.gz PLQWKCLCQGNIHQ-HNNXBMFYSA-N 0 3 407.461 4.463 20 0 HIADHN CN(Cc1ccccc1)Cc1cccc(C(=O)N2CCN(Cc3cccs3)CC2)c1 ZINC000511113128 919724644 /nfs/dbraw/zinc/72/46/44/919724644.db2.gz ASCXAVBCSAXMAI-UHFFFAOYSA-N 0 3 419.594 4.338 20 0 HIADHN Cc1cc(OC[C@@H](O)CN2CCC[C@@H](c3ccnn3C)C2)c(C(C)C)cc1Cl ZINC000511137881 919755779 /nfs/dbraw/zinc/75/57/79/919755779.db2.gz QQEVVOCWGHTMSH-MSOLQXFVSA-N 0 3 405.970 4.125 20 0 HIADHN CSCc1ccc(CNC(=O)N(CCN(C)C)Cc2ccc(F)cc2F)cc1 ZINC000511139977 919757705 /nfs/dbraw/zinc/75/77/05/919757705.db2.gz DXQCZBSFQIWCRN-UHFFFAOYSA-N 0 3 407.530 4.101 20 0 HIADHN CCOc1cc(CN(C)C(=O)[C@@H]2CCCN2Cc2ccccc2)ccc1OC(F)F ZINC000511156973 919776646 /nfs/dbraw/zinc/77/66/46/919776646.db2.gz YQKQVWLQQZBJLE-IBGZPJMESA-N 0 3 418.484 4.310 20 0 HIADHN C[C@@H](NC(=O)NCc1ccc(OC(C)(C)C)cc1C(F)(F)F)C1=CCN(C)CC1 ZINC000511230925 919834529 /nfs/dbraw/zinc/83/45/29/919834529.db2.gz HGEFYZOEBBDBFJ-CQSZACIVSA-N 0 3 413.484 4.332 20 0 HIADHN CC(C)CN(Cc1ccccc1Br)C(=O)N[C@@H](C)C1=CCN(C)CC1 ZINC000511246854 919847100 /nfs/dbraw/zinc/84/71/00/919847100.db2.gz HUTDEPPBYYSCRQ-INIZCTEOSA-N 0 3 408.384 4.267 20 0 HIADHN C[C@H](NC(=O)NCCc1cccc(OCCCc2ccccc2)c1)C1=CCN(C)CC1 ZINC000511247858 919848255 /nfs/dbraw/zinc/84/82/55/919848255.db2.gz ASGOETPOGPCDPZ-NRFANRHFSA-N 0 3 421.585 4.190 20 0 HIADHN C[C@@H](NC(=O)N1CCC(C)(c2cccc(Br)c2)CC1)C1=CCN(C)CC1 ZINC000511248821 919849727 /nfs/dbraw/zinc/84/97/27/919849727.db2.gz NAMXMTKTDYERBG-MRXNPFEDSA-N 0 3 420.395 4.163 20 0 HIADHN C[C@@H](NC(=O)NCc1cc(Cl)cc(Cl)c1OC(F)F)C1=CCN(C)CC1 ZINC000511251163 919853422 /nfs/dbraw/zinc/85/34/22/919853422.db2.gz SWKGGUDLYNLXGU-SNVBAGLBSA-N 0 3 408.276 4.044 20 0 HIADHN CC(C)N(Cc1cc(Br)ccc1F)C(=O)N[C@@H](C)C1=CCN(C)CC1 ZINC000511286598 919881980 /nfs/dbraw/zinc/88/19/80/919881980.db2.gz MAXGEVHSDREEMR-AWEZNQCLSA-N 0 3 412.347 4.159 20 0 HIADHN C[C@@H](NC(=O)NCc1ccc(-c2ccc3c(c2)CCCO3)cc1)C1=CCN(C)CC1 ZINC000511290264 919887215 /nfs/dbraw/zinc/88/72/15/919887215.db2.gz SPKMBYJEFGCDIG-GOSISDBHSA-N 0 3 405.542 4.128 20 0 HIADHN C[C@H](NC(=O)N[C@H]1c2cc(Br)ccc2SC[C@@H]1C)C1=CCN(C)CC1 ZINC000511292011 919888971 /nfs/dbraw/zinc/88/89/71/919888971.db2.gz WOAWLDAOZAZXKJ-ZJNRKIDTSA-N 0 3 424.408 4.182 20 0 HIADHN C[C@@H](NC(=O)N[C@@H]1CCCc2nc(-c3ccc(F)cc3)sc21)C1=CCN(C)CC1 ZINC000511293332 919889810 /nfs/dbraw/zinc/88/98/10/919889810.db2.gz ZAAYYDXTKAICRD-AUUYWEPGSA-N 0 3 414.550 4.276 20 0 HIADHN COc1ccc([C@H](NC(=O)N[C@@H](C)C2=CCN(C)CC2)c2ccccc2Cl)cc1 ZINC000511304703 919897296 /nfs/dbraw/zinc/89/72/96/919897296.db2.gz FPERBQILRGRVDT-AOMKIAJQSA-N 0 3 413.949 4.388 20 0 HIADHN CCc1cccc2c3c([nH]c21)[C@@](CC)(CC(=O)N[C@H](C)C1=CCN(C)CC1)OCC3 ZINC000511368900 919961713 /nfs/dbraw/zinc/96/17/13/919961713.db2.gz IWHJAROQLIKRFP-CRICUBBOSA-N 0 3 409.574 4.065 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)N[C@@H](C[C@H]1CCOC1)c1ccccc1 ZINC000511372116 919965079 /nfs/dbraw/zinc/96/50/79/919965079.db2.gz GEWFQLWYSRXYFD-XXBNENTESA-N 0 3 413.537 4.067 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)N[C@@H](C[C@H]2CCOC2)c2ccccc2)c1 ZINC000511373081 919970819 /nfs/dbraw/zinc/97/08/19/919970819.db2.gz VOJAAKGHTKZEIB-VWNXMTODSA-N 0 3 409.574 4.236 20 0 HIADHN CC(C)[C@H](NC1CCC(C(=O)OC(C)(C)C)CC1)c1nc(-c2cccnc2)no1 ZINC000511375362 919974083 /nfs/dbraw/zinc/97/40/83/919974083.db2.gz DKKNOARUIHRXGA-VJFUWPCTSA-N 0 3 400.523 4.319 20 0 HIADHN CN1CCO[C@H]([C@@H](NC[C@@H](c2cccs2)N2CCCC2)c2ccc(Cl)cc2)C1 ZINC000511383531 919986036 /nfs/dbraw/zinc/98/60/36/919986036.db2.gz YFEQIJCLAJNZRK-ONTIZHBOSA-N 0 3 420.022 4.200 20 0 HIADHN CN1CCO[C@H]([C@@H](NC[C@H](c2cccs2)N2CCCC2)c2ccc(Cl)cc2)C1 ZINC000511383535 919986369 /nfs/dbraw/zinc/98/63/69/919986369.db2.gz YFEQIJCLAJNZRK-URVUXULASA-N 0 3 420.022 4.200 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)N[C@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000511392412 920000478 /nfs/dbraw/zinc/00/04/78/920000478.db2.gz UQPRMGGEGKWSDG-NMVJMZGASA-N 0 3 421.585 4.460 20 0 HIADHN COc1ccc(OCc2ccccn2)c(CN2CCCN(c3ccccc3)CC2)c1 ZINC000511458519 920068502 /nfs/dbraw/zinc/06/85/02/920068502.db2.gz GTXDRZFMBVWAFK-UHFFFAOYSA-N 0 3 403.526 4.382 20 0 HIADHN Cc1cc(C(=O)NC[C@@H](c2ccccc2)N(C)C)c2cc(Br)ccc2n1 ZINC000511514902 920134134 /nfs/dbraw/zinc/13/41/34/920134134.db2.gz UIVSJWLDZJZDKT-FQEVSTJZSA-N 0 3 412.331 4.338 20 0 HIADHN Cc1ncsc1CN(C)C[C@@H]1CCN(C(=O)N[C@@H]2CCC[C@H]2c2ccccc2)C1 ZINC000511519687 920137974 /nfs/dbraw/zinc/13/79/74/920137974.db2.gz AISYNMFNQRELJG-SESVDKBCSA-N 0 3 412.603 4.251 20 0 HIADHN Cc1ccc2c(CN[C@@](C)(CO)c3ccc(Br)cc3)ccc(O)c2n1 ZINC000511597198 920243711 /nfs/dbraw/zinc/24/37/11/920243711.db2.gz UJZLKFBQVJDAFW-FQEVSTJZSA-N 0 3 401.304 4.009 20 0 HIADHN COC(=O)c1ccc(C)c(NC(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)c1 ZINC000511635597 920297895 /nfs/dbraw/zinc/29/78/95/920297895.db2.gz HJTOWSIUWHCNSN-IBGZPJMESA-N 0 3 415.559 4.438 20 0 HIADHN O=C(CCN1CC[C@@H](C(F)(F)F)[C@H](CO)C1)Nc1ccccc1Oc1ccccc1 ZINC000511640917 920305412 /nfs/dbraw/zinc/30/54/12/920305412.db2.gz PHAMDEDPQPYRCX-FUHWJXTLSA-N 0 3 422.447 4.300 20 0 HIADHN C[C@@H](CNC(=O)c1cccc(C(=O)Nc2ccccc2)c1)N(C)Cc1ccccc1 ZINC000511655170 920320834 /nfs/dbraw/zinc/32/08/34/920320834.db2.gz HCCNBXVQXDYJFP-IBGZPJMESA-N 0 3 401.510 4.189 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)c2ccc(OCc3ccccc3)nc2)C1 ZINC000511678277 920341561 /nfs/dbraw/zinc/34/15/61/920341561.db2.gz XROXSAWAOYFLLC-WMZHIEFXSA-N 0 3 401.510 4.226 20 0 HIADHN C[C@H](CC(=O)Nc1cc(C(F)(F)F)ccc1Cl)N[C@H]1c2ccccc2C[C@@H]1O ZINC000511765308 920448932 /nfs/dbraw/zinc/44/89/32/920448932.db2.gz OZXZGCIWIGPMRB-RDBACFOTSA-N 0 3 412.839 4.324 20 0 HIADHN O=C(Nc1ccc2nc([C@H]3CCCO3)[nH]c2c1)c1ccc(CN2CCSCC2)cc1 ZINC000511782879 920474755 /nfs/dbraw/zinc/47/47/55/920474755.db2.gz ACJSVAFWLWVNSI-OAQYLSRUSA-N 0 3 422.554 4.216 20 0 HIADHN CCN(C(=O)CN1C[C@H](c2ccccc2)[C@H]2COCC[C@@H]21)c1nc2ccccc2s1 ZINC000511795721 920489429 /nfs/dbraw/zinc/48/94/29/920489429.db2.gz XJJPAJOIAIKCLP-SBHAEUEKSA-N 0 3 421.566 4.154 20 0 HIADHN Cc1nn(C)c(=O)c(-c2nc(CN3C[C@H](c4ccccc4)[C@@H]4CCC[C@@H]43)cs2)c1C ZINC000511869714 920598340 /nfs/dbraw/zinc/59/83/40/920598340.db2.gz AGHWWDQLKYXUOQ-HBMCJLEFSA-N 0 3 420.582 4.289 20 0 HIADHN Cc1cc([C@@H](C)NCc2n[nH]c(COc3ccccc3)n2)sc1Br ZINC000511940425 920694471 /nfs/dbraw/zinc/69/44/71/920694471.db2.gz STLAROZGNNIYJO-GFCCVEGCSA-N 0 3 407.337 4.367 20 0 HIADHN O=C(CCN1CCN(c2ccccc2)CC1)N[C@H](CC(F)(F)F)c1ccc(F)cc1 ZINC000511996796 920765771 /nfs/dbraw/zinc/76/57/71/920765771.db2.gz LLJVTSLKNPRXMM-HXUWFJFHSA-N 0 3 423.454 4.148 20 0 HIADHN FC(F)(F)[C@@H]1CCCC[C@@H]1CNCc1ncc(I)s1 ZINC000512051488 920821341 /nfs/dbraw/zinc/82/13/41/920821341.db2.gz IGBHFGBGEOJUHY-RKDXNWHRSA-N 0 3 404.239 4.206 20 0 HIADHN COc1ccc(Cl)cc1C1(CNCc2c(OC)cccc2OC)CCOCC1 ZINC000512089423 920853277 /nfs/dbraw/zinc/85/32/77/920853277.db2.gz RXCWCAJQSFXQBA-UHFFFAOYSA-N 0 3 405.922 4.204 20 0 HIADHN FC(F)(F)c1ccc(-n2cc(CNCc3cccc(Cn4ccnc4)c3)cn2)cc1 ZINC000512097524 920857970 /nfs/dbraw/zinc/85/79/70/920857970.db2.gz FIJMENMLIIZNPJ-UHFFFAOYSA-N 0 3 411.431 4.426 20 0 HIADHN COc1cc(CN[C@@H](C)CC(=O)Nc2cc(C(F)(F)F)ccc2Cl)ccn1 ZINC000512100075 920860533 /nfs/dbraw/zinc/86/05/33/920860533.db2.gz OFWYBIZGKISSSG-NSHDSACASA-N 0 3 401.816 4.269 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)NCc2ccsc2Br)C1 ZINC000512112520 920867291 /nfs/dbraw/zinc/86/72/91/920867291.db2.gz OBPZMJROINVTKR-BBRMVZONSA-N 0 3 408.365 4.145 20 0 HIADHN Cc1nc(COc2ccc(Cl)cc2)sc1C(=O)N[C@@H](C)C1=CCN(C)CC1 ZINC000512130759 920878803 /nfs/dbraw/zinc/87/88/03/920878803.db2.gz BAGWFKPMOQGPKX-ZDUSSCGKSA-N 0 3 405.951 4.064 20 0 HIADHN C[C@@H](NC(=O)c1cn(C(C)(C)C)nc1-c1ccccc1Cl)C1=CCN(C)CC1 ZINC000512139329 920885038 /nfs/dbraw/zinc/88/50/38/920885038.db2.gz QMVUZJUVLLBFNZ-OAHLLOKOSA-N 0 3 400.954 4.339 20 0 HIADHN COc1ccc2c(c1)c(C(=O)N[C@H](C)C1=CCN(C)CC1)c(C)n2Cc1ccccc1 ZINC000512142828 920887238 /nfs/dbraw/zinc/88/72/38/920887238.db2.gz NZGYIIAQYNKPRM-GOSISDBHSA-N 0 3 417.553 4.387 20 0 HIADHN COc1cc2c(cc1OC)CN(C(=O)CN1C[C@@H](C)CC[C@H]1c1ccccc1)CC2 ZINC000512144066 920887529 /nfs/dbraw/zinc/88/75/29/920887529.db2.gz ALMFUCXIBNJEGQ-AVRDEDQJSA-N 0 3 408.542 4.062 20 0 HIADHN C[C@@H]1CSC[C@@H]1NCC(=O)Nc1nc(-c2ccc(Cl)cc2Cl)cs1 ZINC000512180221 920920774 /nfs/dbraw/zinc/92/07/74/920920774.db2.gz NIXMSKMLZQWWLG-RNCFNFMXSA-N 0 3 402.372 4.397 20 0 HIADHN CN(C)Cc1cccc(NC(=O)N[C@H]2CCN(c3cccc(OC(F)(F)F)c3)C2)c1 ZINC000512216087 920965207 /nfs/dbraw/zinc/96/52/07/920965207.db2.gz AJSZDYZCFSCXJZ-KRWDZBQOSA-N 0 3 422.451 4.047 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCC(C)(C)c3cccs3)c(C)c2)CC1 ZINC000512224137 920975933 /nfs/dbraw/zinc/97/59/33/920975933.db2.gz HZJSOKDWMDASEA-UHFFFAOYSA-N 0 3 400.592 4.298 20 0 HIADHN CCCN(CC(=O)c1c[nH]c2ccccc12)C1CCN(c2cc(C)nc(C)n2)CC1 ZINC000512276462 921031959 /nfs/dbraw/zinc/03/19/59/921031959.db2.gz DDMWJUULKVEXPD-UHFFFAOYSA-N 0 3 405.546 4.138 20 0 HIADHN CC(=O)N(C)C1CCN(Cc2cn(-c3ccc(F)cc3)nc2-c2ccc(C)cc2)CC1 ZINC000512294767 921050305 /nfs/dbraw/zinc/05/03/05/921050305.db2.gz YDZHJKPCYPNONO-UHFFFAOYSA-N 0 3 420.532 4.430 20 0 HIADHN CCn1ccnc1[C@H]1OCC[C@@H]1NCc1ccc(OCc2cccs2)c(OC)c1 ZINC000512339122 921084228 /nfs/dbraw/zinc/08/42/28/921084228.db2.gz PUJHRUUGRCXOBB-RXVVDRJESA-N 0 3 413.543 4.172 20 0 HIADHN CS(=O)(=O)c1cc(CNC/C=C/c2ccc(F)c(F)c2)cc(C(F)(F)F)c1 ZINC000512350506 921096007 /nfs/dbraw/zinc/09/60/07/921096007.db2.gz PSXBAYZLJFOTAN-NSCUHMNNSA-N 0 3 405.388 4.190 20 0 HIADHN Cc1ccc(-c2ncc(CN[C@H]3CCO[C@@H]3c3cncc(Br)c3)s2)o1 ZINC000512369714 921109773 /nfs/dbraw/zinc/10/97/73/921109773.db2.gz DXEFZGIJFKCNLB-DOTOQJQBSA-N 0 3 420.332 4.489 20 0 HIADHN COC(=O)[C@H](NC1CCN([C@@H](C)c2ccncc2)CC1)c1cccc(Cl)c1Cl ZINC000513456990 921821866 /nfs/dbraw/zinc/82/18/66/921821866.db2.gz HAZIVMNMVPIHHV-VBKZILBWSA-N 0 3 422.356 4.418 20 0 HIADHN O=C(Cc1ccc(Cl)s1)NC1CCN(CCOc2ccc(Cl)cc2)CC1 ZINC000513470892 921831746 /nfs/dbraw/zinc/83/17/46/921831746.db2.gz IUVTWXKNGGLCFL-UHFFFAOYSA-N 0 3 413.370 4.257 20 0 HIADHN COc1cc(CN2CCC[C@H]2c2ccc(C)s2)ccc1OCC(=O)N1CCCC1 ZINC000513479632 921837115 /nfs/dbraw/zinc/83/71/15/921837115.db2.gz PAGQJOVJKSHNAK-IBGZPJMESA-N 0 3 414.571 4.403 20 0 HIADHN CC(=O)c1cccc(OC[C@H](O)CN(Cc2ccc(Br)cc2)C(C)C)c1 ZINC000513492057 921844098 /nfs/dbraw/zinc/84/40/98/921844098.db2.gz XRISPMZTSPBEJC-HXUWFJFHSA-N 0 3 420.347 4.302 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1ccc(-c2cc(=O)[nH]c(C)n2)cc1)c1ccco1 ZINC000513497498 921846768 /nfs/dbraw/zinc/84/67/68/921846768.db2.gz XPVMKPIYHPRTOR-IFXJQAMLSA-N 0 3 409.490 4.002 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)Nc1ccc(-c2cc(=O)[nH]c(C)n2)cc1)c1ccco1 ZINC000513497499 921847295 /nfs/dbraw/zinc/84/72/95/921847295.db2.gz XPVMKPIYHPRTOR-KUHUBIRLSA-N 0 3 409.490 4.002 20 0 HIADHN CCOc1cc(CN(CCCO)Cc2ccccc2)cc(Br)c1OC ZINC000513509720 921857755 /nfs/dbraw/zinc/85/77/55/921857755.db2.gz VIAQPILWJWSFLY-UHFFFAOYSA-N 0 3 408.336 4.241 20 0 HIADHN COC(=O)c1cccc(-c2nc(CN3CCC[C@@H]3[C@@H]3C[C@H](C)CC[C@@H]3O)cs2)c1 ZINC000513538370 921877768 /nfs/dbraw/zinc/87/77/68/921877768.db2.gz JXXYEVJGEHETGC-QAJUQPOASA-N 0 3 414.571 4.358 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(C)c1C(=O)NC[C@H]1CCCN1Cc1ccccc1 ZINC000513597790 921928530 /nfs/dbraw/zinc/92/85/30/921928530.db2.gz MNJWGDGSZSZBNY-JOCHJYFZSA-N 0 3 406.505 4.023 20 0 HIADHN Cc1nn(Cc2ccccc2Cl)c(C)c1CNCCOc1ccc2c(c1)OCO2 ZINC000513607840 921938794 /nfs/dbraw/zinc/93/87/94/921938794.db2.gz AJHQJFDCVJQYFG-UHFFFAOYSA-N 0 3 413.905 4.099 20 0 HIADHN O=C1COc2ccc(CN[C@H](c3cccc(C(F)(F)F)c3)C3CCOCC3)cc2N1 ZINC000513632630 921958711 /nfs/dbraw/zinc/95/87/11/921958711.db2.gz DSSYKZPYVZHGKJ-NRFANRHFSA-N 0 3 420.431 4.294 20 0 HIADHN Cc1nn(Cc2ccccc2Cl)c(C)c1CN1CCC[C@H](c2nnc3n2CCC3)C1 ZINC000513654787 921975643 /nfs/dbraw/zinc/97/56/43/921975643.db2.gz JUOFVWXAIVMARO-IBGZPJMESA-N 0 3 424.980 4.119 20 0 HIADHN COc1ccc([C@@H](C)N[C@H](C)c2ccc3c(c2)OCC(=O)N3)cc1Br ZINC000513667534 921990119 /nfs/dbraw/zinc/99/01/19/921990119.db2.gz ROIPFSWVXFPHEC-VXGBXAGGSA-N 0 3 405.292 4.200 20 0 HIADHN COc1cc(CN2CCC[C@@H](c3nnc4n3CCC4)C2)ccc1OCc1cccs1 ZINC000513673354 921995483 /nfs/dbraw/zinc/99/54/83/921995483.db2.gz PQKKSGDJDSWUHW-GOSISDBHSA-N 0 3 424.570 4.253 20 0 HIADHN C[C@@H](NCc1ccc(C(=O)Nc2ccc(F)cc2)cc1)c1ccc2c(c1)OCC(=O)N2 ZINC000513678446 922000000 /nfs/dbraw/zinc/00/00/00/922000000.db2.gz NEUCLMSZMUMDKA-OAHLLOKOSA-N 0 3 419.456 4.260 20 0 HIADHN CN(Cc1ccc2c(c1)nnn2C)[C@H]1CCSc2ccc(Br)cc21 ZINC000513725370 922044496 /nfs/dbraw/zinc/04/44/96/922044496.db2.gz OQBJAZWITGYVIH-INIZCTEOSA-N 0 3 403.349 4.400 20 0 HIADHN O=C1CCCN1C1CCN(Cc2cn(-c3ccccc3)nc2-c2ccc(F)cc2)CC1 ZINC000513727899 922047984 /nfs/dbraw/zinc/04/79/84/922047984.db2.gz BVDZKLOXEUKCLW-UHFFFAOYSA-N 0 3 418.516 4.265 20 0 HIADHN O=C1CCCN1C1CCN(Cc2ccc(-c3ccc(Br)cc3)o2)CC1 ZINC000513741056 922062409 /nfs/dbraw/zinc/06/24/09/922062409.db2.gz DTZJPLHSXCFZTE-UHFFFAOYSA-N 0 3 403.320 4.296 20 0 HIADHN C[C@]1(c2ccc(CN[C@H]3CC4(CCCCC4)Oc4ccccc43)cc2)NC(=O)NC1=O ZINC000513789261 922116639 /nfs/dbraw/zinc/11/66/39/922116639.db2.gz FLZAWKXMOLGTGI-GBXCKJPGSA-N 0 3 419.525 4.058 20 0 HIADHN COc1cc(Cl)c(C(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)cc1OC ZINC000513822702 922147614 /nfs/dbraw/zinc/14/76/14/922147614.db2.gz HQOZZLKTEHXQIR-IBGZPJMESA-N 0 3 402.922 4.233 20 0 HIADHN C[C@H]1CCCN(S(=O)(=O)c2ccc(CN[C@H]3CCc4c3cccc4F)cc2)C1 ZINC000513858467 922186404 /nfs/dbraw/zinc/18/64/04/922186404.db2.gz ABURMMGIHYCLMI-AOMKIAJQSA-N 0 3 402.535 4.023 20 0 HIADHN O=C(NCCc1ccc(Br)s1)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000513889144 922217482 /nfs/dbraw/zinc/21/74/82/922217482.db2.gz NJZMDWJSCZPSFN-KRWDZBQOSA-N 0 3 422.392 4.189 20 0 HIADHN O=C(N1CCOc2cccc(F)c2C1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000513916186 922239071 /nfs/dbraw/zinc/23/90/71/922239071.db2.gz DKVVLUSMOUNQLY-NRFANRHFSA-N 0 3 422.422 4.001 20 0 HIADHN COc1cc(Cl)c(C(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)cc1OC ZINC000513930984 922252142 /nfs/dbraw/zinc/25/21/42/922252142.db2.gz BVGKBTJSPJCBMW-QGZVFWFLSA-N 0 3 402.922 4.094 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)C[C@H](C)c1c(C)noc1C ZINC000513949159 922267335 /nfs/dbraw/zinc/26/73/35/922267335.db2.gz WJVFLEMJIWDSSY-KKSFZXQISA-N 0 3 421.545 4.376 20 0 HIADHN COc1ccc(CCCC(=O)N(Cc2ccccc2)C2CCN(C)CC2)c(OC)c1 ZINC000514009516 922333526 /nfs/dbraw/zinc/33/35/26/922333526.db2.gz HJASUDYLQLHPDT-UHFFFAOYSA-N 0 3 410.558 4.150 20 0 HIADHN C[C@H]1CN(c2ccc(CN[C@@H](c3cccc(OC(F)(F)F)c3)C3CC3)cn2)CCO1 ZINC000514096424 922422584 /nfs/dbraw/zinc/42/25/84/922422584.db2.gz VVARJOBIBRLPTR-YCRPNKLZSA-N 0 3 421.463 4.446 20 0 HIADHN COCCN(CCC(=O)Nc1c(C)nn(-c2ccccc2)c1C)Cc1cccs1 ZINC000514112777 922444721 /nfs/dbraw/zinc/44/47/21/922444721.db2.gz JMXXAEMSKGXUHC-UHFFFAOYSA-N 0 3 412.559 4.028 20 0 HIADHN O=C(NCc1ccc(Oc2cccc(F)c2)nc1)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000514158922 922496248 /nfs/dbraw/zinc/49/62/48/922496248.db2.gz YAUSXHQUPKLBNQ-NRFANRHFSA-N 0 3 420.488 4.087 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)NC[C@@H]1CCCO[C@H]1c1ccccc1 ZINC000514176692 922515216 /nfs/dbraw/zinc/51/52/16/922515216.db2.gz UIUPDMWAOHPKPG-VWPQPMDRSA-N 0 3 413.587 4.352 20 0 HIADHN CCCCN(CC(=O)N1CCC(C(=O)N(C)C(C)C)CC1)[C@H](CC)c1ccccc1 ZINC000514182224 922521661 /nfs/dbraw/zinc/52/16/61/922521661.db2.gz GEOBJTVTCPOSFS-HSZRJFAPSA-N 0 3 415.622 4.345 20 0 HIADHN Cc1ccccc1C[C@@H]1CCCN1CC(=O)N1CCC[C@@H]1c1ccc2c(c1)OCCO2 ZINC000514185713 922525810 /nfs/dbraw/zinc/52/58/10/922525810.db2.gz KITPFIDIOLBNKX-XZOQPEGZSA-N 0 3 420.553 4.137 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N3CC[C@@H](C(F)(F)F)C4(CCC4)C3)cc2)CC1 ZINC000514193841 922533572 /nfs/dbraw/zinc/53/35/72/922533572.db2.gz UKHYUEDMUKUCTO-LJQANCHMSA-N 0 3 409.496 4.023 20 0 HIADHN CCc1ccc([C@H](CNC(=O)NC[C@@H]2CCCO[C@H]2c2ccccc2)N(C)C)cc1 ZINC000514197664 922535325 /nfs/dbraw/zinc/53/53/25/922535325.db2.gz RCNJZXPSZKHTDB-HJOGWXRNSA-N 0 3 409.574 4.319 20 0 HIADHN CCc1ccc([C@H](CNC(=O)NC[C@H]2CCCO[C@H]2c2ccccc2)N(C)C)cc1 ZINC000514197666 922535978 /nfs/dbraw/zinc/53/59/78/922535978.db2.gz RCNJZXPSZKHTDB-SGNDLWITSA-N 0 3 409.574 4.319 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)N3CC[C@@H](C(F)(F)F)C4(CCC4)C3)CC2)c1 ZINC000514217450 922551313 /nfs/dbraw/zinc/55/13/13/922551313.db2.gz CLUVBWANTDDSDW-HXUWFJFHSA-N 0 3 423.523 4.088 20 0 HIADHN Cc1ccc(-c2ccc(C(=O)N3CCC(CN4C[C@@H](C)O[C@@H](C)C4)CC3)s2)o1 ZINC000514219786 922554670 /nfs/dbraw/zinc/55/46/70/922554670.db2.gz VNXBJXJYHRBINC-CALCHBBNSA-N 0 3 402.560 4.278 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@H]1CCCOc2ccc(F)cc21)c1ccsc1 ZINC000514242473 922582138 /nfs/dbraw/zinc/58/21/38/922582138.db2.gz SFHHLXQMKXTLNN-RBUKOAKNSA-N 0 3 405.539 4.483 20 0 HIADHN COc1ccc([C@@H]2CCCN2C[C@H](O)COCc2ccccc2Cl)c(OC)c1 ZINC000514317600 922595339 /nfs/dbraw/zinc/59/53/39/922595339.db2.gz OAPRQRDSHVBIHL-UWJYYQICSA-N 0 3 405.922 4.072 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)c1nn(-c2ccccc2F)c2c1CCC2 ZINC000514500078 922652324 /nfs/dbraw/zinc/65/23/24/922652324.db2.gz HKCYIPDAWHYHGG-NRFANRHFSA-N 0 3 418.516 4.067 20 0 HIADHN Cc1nc(-c2ccc(CCNC(=O)NC[C@H](c3ccccc3)N(C)C)s2)cs1 ZINC000514567398 922704692 /nfs/dbraw/zinc/70/46/92/922704692.db2.gz UGBVYDWQDCIHSV-LJQANCHMSA-N 0 3 414.600 4.325 20 0 HIADHN Cc1nc(-c2ccc(CCNC(=O)NC[C@@H](c3ccccc3)N(C)C)s2)cs1 ZINC000514567395 922704857 /nfs/dbraw/zinc/70/48/57/922704857.db2.gz UGBVYDWQDCIHSV-IBGZPJMESA-N 0 3 414.600 4.325 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)N[C@@H]2CCSc3ccc(F)cc32)CC1 ZINC000514579504 922716428 /nfs/dbraw/zinc/71/64/28/922716428.db2.gz BQOLVFVLVFCJQA-LJQANCHMSA-N 0 3 403.523 4.262 20 0 HIADHN Cc1cc(NC(=O)c2ccc3c(C)cc(=O)[nH]c3c2)cc(N2CCN(C(C)C)CC2)c1 ZINC000514632263 922735691 /nfs/dbraw/zinc/73/56/91/922735691.db2.gz UKRAKYMQSCZVKH-UHFFFAOYSA-N 0 3 418.541 4.340 20 0 HIADHN CCn1c2ccccc2nc1[C@H]1CCCN1C[C@@H]1CCN(C(=O)c2ccccc2)C1 ZINC000514680159 922751657 /nfs/dbraw/zinc/75/16/57/922751657.db2.gz QIUGOPDMLFQAFE-WMZHIEFXSA-N 0 3 402.542 4.355 20 0 HIADHN COc1ccc(CN2CCC(CO)(c3ccccc3)CC2)c(OCc2cccnc2)c1 ZINC000514880396 922829595 /nfs/dbraw/zinc/82/95/95/922829595.db2.gz QHXSMLYQKKXZLM-UHFFFAOYSA-N 0 3 418.537 4.195 20 0 HIADHN CSc1ccc([C@H](CNC(=O)[C@@H](C)[C@H]2OCCc3sccc32)N(C)C)cc1 ZINC000514967259 922857291 /nfs/dbraw/zinc/85/72/91/922857291.db2.gz YQICMASJPCGAQL-ADLFWFRXSA-N 0 3 404.601 4.139 20 0 HIADHN CSc1ccc([C@H](CNC(=O)[C@H](C)[C@H]2OCCc3sccc32)N(C)C)cc1 ZINC000514967267 922857713 /nfs/dbraw/zinc/85/77/13/922857713.db2.gz YQICMASJPCGAQL-HEFCMCLBSA-N 0 3 404.601 4.139 20 0 HIADHN O=C(Nc1ncc(Cc2cccc(F)c2)s1)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000515100912 922913280 /nfs/dbraw/zinc/91/32/80/922913280.db2.gz LLZCVHYVSXFJLY-LJQANCHMSA-N 0 3 410.518 4.269 20 0 HIADHN CC[NH+](CC)Cc1cccc(C[N-]S(=O)(=O)c2cc(Cl)sc2Cl)c1 ZINC000515517933 923149172 /nfs/dbraw/zinc/14/91/72/923149172.db2.gz YTBINVVHFLUNBZ-UHFFFAOYSA-N 0 3 407.388 4.375 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CCCN(c2ccccc2)CC1)c1cccc(OC)c1 ZINC000515528508 923156875 /nfs/dbraw/zinc/15/68/75/923156875.db2.gz BAQRYCSUMKVCGK-DEOSSOPVSA-N 0 3 424.589 4.000 20 0 HIADHN COc1ccc(CN(C)C[C@H](O)CO[C@H]2CCCc3ccccc32)cc1OC(F)F ZINC000515548632 923167746 /nfs/dbraw/zinc/16/77/46/923167746.db2.gz OTZRDKMXQTWPHF-ICSRJNTNSA-N 0 3 421.484 4.184 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)c1cc(F)c(F)cc1Br)c1ccco1 ZINC000515696293 923279480 /nfs/dbraw/zinc/27/94/80/923279480.db2.gz IQFQLTQUYZLSTP-MEBBXXQBSA-N 0 3 401.251 4.180 20 0 HIADHN CCOc1ccc(NC(=O)NC[C@@H](c2cccc(OC)c2)N2CCCC2)cc1F ZINC000515807234 923364024 /nfs/dbraw/zinc/36/40/24/923364024.db2.gz YBSQHLCSASWEOD-FQEVSTJZSA-N 0 3 401.482 4.192 20 0 HIADHN O=C(NCCCCN1CCN(Cc2ccccc2)CC1)c1cccc(Cl)c1Cl ZINC000515831414 923380534 /nfs/dbraw/zinc/38/05/34/923380534.db2.gz TXQKFDYEBUSPLG-UHFFFAOYSA-N 0 3 420.384 4.321 20 0 HIADHN COc1ccc2cc(CNC(=O)N(CCN(C)C)Cc3ccccc3F)ccc2c1 ZINC000515857361 923396449 /nfs/dbraw/zinc/39/64/49/923396449.db2.gz GWIVRVBFDQOLLB-UHFFFAOYSA-N 0 3 409.505 4.261 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N2CCC[C@@H]2c2ccc3c(c2)OCCO3)C1 ZINC000516165664 923583761 /nfs/dbraw/zinc/58/37/61/923583761.db2.gz UVZDFEGSDVBJHT-STZQEDGTSA-N 0 3 421.541 4.140 20 0 HIADHN CCS(=O)(=O)c1ccc([C@@H](C)N[C@@H](C)CC(=O)Nc2cccc(Cl)c2)cc1 ZINC000516199497 923595436 /nfs/dbraw/zinc/59/54/36/923595436.db2.gz IVKAWJWNPVPTFL-LSDHHAIUSA-N 0 3 408.951 4.202 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)c1cccc(-n2nccc2C(F)(F)F)c1)c1ccco1 ZINC000516335063 923671883 /nfs/dbraw/zinc/67/18/83/923671883.db2.gz ZGMMPOREUCGOQO-PBHICJAKSA-N 0 3 420.435 4.343 20 0 HIADHN CC(C)[C@H](NC(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1)c1ccc2c(c1)OCCO2 ZINC000516578721 923800750 /nfs/dbraw/zinc/80/07/50/923800750.db2.gz LFOIOFTUUAGXKD-XZOYJPPVSA-N 0 3 423.557 4.290 20 0 HIADHN COCCCCN(Cc1ccccc1)C(=O)N[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000516707831 923856148 /nfs/dbraw/zinc/85/61/48/923856148.db2.gz ALOFRYISLSNQFB-QPPBQGQZSA-N 0 3 409.574 4.460 20 0 HIADHN CC[C@H](CNC(=O)NC[C@@H]1CCCO[C@@H]1c1ccccc1)N1CCc2ccccc2C1 ZINC000516716826 923861057 /nfs/dbraw/zinc/86/10/57/923861057.db2.gz IXHJQIQBLQRUDO-ICDZXHCJSA-N 0 3 421.585 4.290 20 0 HIADHN C[C@H](O)CN(CC(=O)N1N=C(c2cccs2)C[C@@H]1c1ccco1)C1CCCCC1 ZINC000517119199 924008377 /nfs/dbraw/zinc/00/83/77/924008377.db2.gz PBXAWKKSMUPVIX-QFBILLFUSA-N 0 3 415.559 4.034 20 0 HIADHN CN(CCN1CCN(C(=O)Nc2ccc(Cl)cc2Cl)CC1)Cc1ccccc1 ZINC000517120540 924009941 /nfs/dbraw/zinc/00/99/41/924009941.db2.gz HRWWZEQIVHFKMD-UHFFFAOYSA-N 0 3 421.372 4.275 20 0 HIADHN CC(C)OC(=O)C[C@H](NC(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1)c1ccccc1 ZINC000517543757 924255577 /nfs/dbraw/zinc/25/55/77/924255577.db2.gz JZALOQKZKUXION-PTUXOGIPSA-N 0 3 423.557 4.204 20 0 HIADHN COCCN(CCN(C)C)C(=O)N[C@H](c1ccccc1)c1ccc2ccccc2c1 ZINC000517600286 926710373 /nfs/dbraw/zinc/71/03/73/926710373.db2.gz PHYYURZVNKQELK-XMMPIXPASA-N 0 3 405.542 4.149 20 0 HIADHN C[C@@H](C(=O)NCC1CCCCC1)N(C)CCCc1cc(-c2cccc(F)c2)n[nH]1 ZINC000517618166 926727685 /nfs/dbraw/zinc/72/76/85/926727685.db2.gz WHUUDTURPJUKPO-KRWDZBQOSA-N 0 3 400.542 4.165 20 0 HIADHN Cc1ccc(NC(=O)CCCN2CCN(c3ccccc3)CC2)c(Br)c1 ZINC000517641064 926749105 /nfs/dbraw/zinc/74/91/05/926749105.db2.gz HYJVHJSQPIEHSS-UHFFFAOYSA-N 0 3 416.363 4.298 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1NC(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000517643564 926750646 /nfs/dbraw/zinc/75/06/46/926750646.db2.gz YBLNZNAFAWFTNM-RXVVDRJESA-N 0 3 403.530 4.446 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1[nH]nc2ccc(Br)cc21)c1ccsc1 ZINC000517643587 926751037 /nfs/dbraw/zinc/75/10/37/926751037.db2.gz AWEGDZDCNITOEP-MRXNPFEDSA-N 0 3 421.364 4.200 20 0 HIADHN CN(C)CCN(C(=O)c1cccc(C(=O)N(C)c2ccccc2)c1)C1CCCCC1 ZINC000517692044 926796684 /nfs/dbraw/zinc/79/66/84/926796684.db2.gz COWWCHFJIWJCFD-UHFFFAOYSA-N 0 3 407.558 4.300 20 0 HIADHN C[C@@H](NC(=O)N(CCN(C)C)Cc1ccc(F)cc1)c1nc(C(C)(C)C)cs1 ZINC000518030963 926970178 /nfs/dbraw/zinc/97/01/78/926970178.db2.gz ZDNNIJLSMXXNAM-OAHLLOKOSA-N 0 3 406.571 4.414 20 0 HIADHN CN(C)[C@H](CNC(=O)Nc1nnc(C(C)(C)c2ccccc2)s1)c1ccccc1 ZINC000518055067 926992696 /nfs/dbraw/zinc/99/26/96/926992696.db2.gz KDPXAJIDKLKNHJ-GOSISDBHSA-N 0 3 409.559 4.288 20 0 HIADHN O=C(N[C@H](COc1ccccc1)c1ccccc1)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000518070606 927004887 /nfs/dbraw/zinc/00/48/87/927004887.db2.gz IMWRQAPVHKCHMB-UKILVPOCSA-N 0 3 415.537 4.230 20 0 HIADHN O=C(NCCOCC1CC1)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000518159196 927053156 /nfs/dbraw/zinc/05/31/56/927053156.db2.gz KNNGAFWWWZUAHG-UHFFFAOYSA-N 0 3 414.377 4.027 20 0 HIADHN O=C(Nc1ccc(OC(F)F)c2ncccc12)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000518171593 927061572 /nfs/dbraw/zinc/06/15/72/927061572.db2.gz BIVRGKFJCMMUGG-MRXNPFEDSA-N 0 3 412.440 4.232 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@@H](C)NCc2ccccc2COC(C)C)cc1 ZINC000518231342 927092870 /nfs/dbraw/zinc/09/28/70/927092870.db2.gz DKZMQZFAZOHFOY-LJQANCHMSA-N 0 3 418.603 4.493 20 0 HIADHN Cc1nn(Cc2ccccc2Cl)c(C)c1CNCCNC(=O)c1cccc(C)c1 ZINC000518264388 927120106 /nfs/dbraw/zinc/12/01/06/927120106.db2.gz BVKRCZNVZUVJNE-UHFFFAOYSA-N 0 3 410.949 4.030 20 0 HIADHN COc1ccc(C[C@@H]2CCCN([C@H](C)C(=O)N[C@H](C)c3ccccc3OC)C2)cc1 ZINC000518270952 927127938 /nfs/dbraw/zinc/12/79/38/927127938.db2.gz XFASCZPQVUSAEE-SBHAEUEKSA-N 0 3 410.558 4.224 20 0 HIADHN CCc1cc(NCCCCN2CCN(c3ccccc3)CC2)nc(-c2ccccn2)n1 ZINC000518298302 927158325 /nfs/dbraw/zinc/15/83/25/927158325.db2.gz CDBQMTNZUQZFLJ-UHFFFAOYSA-N 0 3 416.573 4.115 20 0 HIADHN CCN(C(=O)c1nc(SC)ncc1Cl)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000518339967 927205009 /nfs/dbraw/zinc/20/50/09/927205009.db2.gz MKLQUTSWGBWXBW-ZBFHGGJFSA-N 0 3 404.967 4.150 20 0 HIADHN CCCC(=O)Nc1ccc(CNC(=O)[C@@H](C)N2CCC(Cc3ccccc3)CC2)cc1 ZINC000518390376 927236115 /nfs/dbraw/zinc/23/61/15/927236115.db2.gz JIGLBAIRARWMFN-HXUWFJFHSA-N 0 3 421.585 4.385 20 0 HIADHN CC(C)[C@@H](CNC(=O)c1ccc2[nH]c(C(F)F)nc2c1)N1CCc2ccccc2C1 ZINC000518392821 927238160 /nfs/dbraw/zinc/23/81/60/927238160.db2.gz YIJYYQCASLFNRR-HXUWFJFHSA-N 0 3 412.484 4.313 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)N(C)CCOc2ccccc2Cl)C1 ZINC000518406992 927247575 /nfs/dbraw/zinc/24/75/75/927247575.db2.gz UFHXOLCPBSSYLF-HKUYNNGSSA-N 0 3 401.938 4.196 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N(C)CCOc2ccccc2Cl)C1 ZINC000518406993 927247923 /nfs/dbraw/zinc/24/79/23/927247923.db2.gz UFHXOLCPBSSYLF-IEBWSBKVSA-N 0 3 401.938 4.196 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)NCc2ccc(OC(F)(F)F)cc2)C1 ZINC000518409645 927250275 /nfs/dbraw/zinc/25/02/75/927250275.db2.gz LGSVUCCWMFKLCK-QAPCUYQASA-N 0 3 407.436 4.220 20 0 HIADHN CCc1cccc2c(CCNC(=O)c3ccc(N4CCN(C(C)C)CC4)cc3)c[nH]c21 ZINC000518412144 927252588 /nfs/dbraw/zinc/25/25/88/927252588.db2.gz ZIVMIBLVKJRQHY-UHFFFAOYSA-N 0 3 418.585 4.233 20 0 HIADHN CCCOc1c(Br)cc(Br)cc1CNC[C@@](C)(O)CC ZINC000518453101 927286326 /nfs/dbraw/zinc/28/63/26/927286326.db2.gz XGVMFEXNWSZTNU-HNNXBMFYSA-N 0 3 409.162 4.251 20 0 HIADHN COc1ccc([C@@H](NC(=O)N(CCN(C)C)CC(C)C)c2ccc(F)cc2)cc1 ZINC000518495729 927308231 /nfs/dbraw/zinc/30/82/31/927308231.db2.gz BCKONJXGBUSVGU-QFIPXVFZSA-N 0 3 401.526 4.153 20 0 HIADHN CN(C)[C@@H](CNC(=O)NCc1ccc(Oc2cccnc2)c(F)c1)c1ccccc1 ZINC000518522783 927326274 /nfs/dbraw/zinc/32/62/74/927326274.db2.gz NFZZOYOIXFAMEE-NRFANRHFSA-N 0 3 408.477 4.115 20 0 HIADHN C[C@H](NC(=O)N(Cc1ccco1)C1CCN(C)CC1)c1nc(C(C)(C)C)cs1 ZINC000518541061 927336921 /nfs/dbraw/zinc/33/69/21/927336921.db2.gz QRJMRELSRKEYFB-HNNXBMFYSA-N 0 3 404.580 4.401 20 0 HIADHN CCCNC(=O)CCNCc1cc(Br)ccc1OCc1ccccc1 ZINC000518760786 927481187 /nfs/dbraw/zinc/48/11/87/927481187.db2.gz ZCXURVNEGZGDOT-UHFFFAOYSA-N 0 3 405.336 4.034 20 0 HIADHN CCn1c(CN[C@@H](C)c2cc(F)ccc2N2CCN(CC)CC2)nc2ccccc21 ZINC000518775977 927488740 /nfs/dbraw/zinc/48/87/40/927488740.db2.gz OLAWWOHMOOTTPX-SFHVURJKSA-N 0 3 409.553 4.188 20 0 HIADHN Cc1cc(-c2cc(C(=O)NC[C@H]3CCCN3C)c3cnn(C(C)C)c3n2)c(C)s1 ZINC000518789741 927495303 /nfs/dbraw/zinc/49/53/03/927495303.db2.gz YYUKRNQTWKVILQ-MRXNPFEDSA-N 0 3 411.575 4.182 20 0 HIADHN COCCN1CCC(NC(=O)Nc2ccccc2Oc2ccccc2Cl)CC1 ZINC000518828058 927526084 /nfs/dbraw/zinc/52/60/84/927526084.db2.gz OKZLQQMFXJOVAX-UHFFFAOYSA-N 0 3 403.910 4.365 20 0 HIADHN C[C@H](CNc1nc(C2CCCCC2)nc2sc3c(c21)CCC3)N1CCN(C)CC1 ZINC000518849259 927554042 /nfs/dbraw/zinc/55/40/42/927554042.db2.gz WYFMZIAOYHEQRA-MRXNPFEDSA-N 0 3 413.635 4.276 20 0 HIADHN CC[C@@H](C)c1ccc(S(=O)(=O)Nc2ccc(N3CCN(CC)CC3)cc2C)cc1 ZINC000518860219 927565634 /nfs/dbraw/zinc/56/56/34/927565634.db2.gz UAJBMZVNJHKEHM-GOSISDBHSA-N 0 3 415.603 4.451 20 0 HIADHN Cc1noc(-c2ccc(C)c(NC(=O)NCC(C)(C)N3CCc4ccccc4C3)c2)n1 ZINC000519012737 927693043 /nfs/dbraw/zinc/69/30/43/927693043.db2.gz KFUNRDCORXYCRE-UHFFFAOYSA-N 0 3 419.529 4.312 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N[C@@H](CO)c1ccccc1)c1ccc(C(F)(F)F)cc1 ZINC000519020984 927698544 /nfs/dbraw/zinc/69/85/44/927698544.db2.gz FMEWKDZDDROKNX-PMACEKPBSA-N 0 3 423.479 4.121 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@H](CO)c1ccccc1)c1ccc(C(F)(F)F)cc1 ZINC000519020987 927698761 /nfs/dbraw/zinc/69/87/61/927698761.db2.gz FMEWKDZDDROKNX-WOJBJXKFSA-N 0 3 423.479 4.121 20 0 HIADHN CN(C)CCN(C[C@@H]1CCCO1)C(=O)c1ccc(COc2ccc3ccccc3c2)o1 ZINC000519148610 927805222 /nfs/dbraw/zinc/80/52/22/927805222.db2.gz PLHYGYVKIXWTJB-QFIPXVFZSA-N 0 3 422.525 4.195 20 0 HIADHN C[C@H](c1cccs1)N(Cc1ccccc1)C[C@H](O)COc1ccc2c(c1)OCO2 ZINC000519195627 927821470 /nfs/dbraw/zinc/82/14/70/927821470.db2.gz KYIDWZYNODVFIS-MJGOQNOKSA-N 0 3 411.523 4.480 20 0 HIADHN C[C@@H](c1cccs1)N(Cc1ccccc1)C[C@H](O)COc1ccc2c(c1)OCO2 ZINC000519195625 927821749 /nfs/dbraw/zinc/82/17/49/927821749.db2.gz KYIDWZYNODVFIS-HKUYNNGSSA-N 0 3 411.523 4.480 20 0 HIADHN CCc1ccc([C@H](CNC(=O)Nc2cccc([C@H](C)N3CCOCC3)c2)N(C)C)cc1 ZINC000519199223 927823570 /nfs/dbraw/zinc/82/35/70/927823570.db2.gz SXTYPRAVDIQBTM-CYFREDJKSA-N 0 3 424.589 4.067 20 0 HIADHN CCc1ccc([C@H](CNC(=O)Nc2cccc([C@@H](C)N3CCOCC3)c2)N(C)C)cc1 ZINC000519199224 927823707 /nfs/dbraw/zinc/82/37/07/927823707.db2.gz SXTYPRAVDIQBTM-DVECYGJZSA-N 0 3 424.589 4.067 20 0 HIADHN CCOc1cc2c(cc1NC(=O)NC[C@H](c1ccccc1)N1CCCC1)O[C@@H](C)C2 ZINC000519241403 927843756 /nfs/dbraw/zinc/84/37/56/927843756.db2.gz HLYJCTAGHDWAME-LAUBAEHRSA-N 0 3 409.530 4.367 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)N1CCC[C@H]1Cc1cccc(F)c1 ZINC000519250833 927847273 /nfs/dbraw/zinc/84/72/73/927847273.db2.gz LZZGBJCCYVHDIY-PMACEKPBSA-N 0 3 401.551 4.441 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2ccc(C(=O)NC3CCCC3)cc2C)N(C)C)cc1 ZINC000519259262 927851479 /nfs/dbraw/zinc/85/14/79/927851479.db2.gz ISXVZBJVAOZZKG-QHCPKHFHSA-N 0 3 422.573 4.400 20 0 HIADHN O=C(Nc1cccc(OCc2cccnc2)c1)N1CCN(CC2CCCCC2)CC1 ZINC000519263140 927854870 /nfs/dbraw/zinc/85/48/70/927854870.db2.gz YBEPDEPKMSIEJL-UHFFFAOYSA-N 0 3 408.546 4.390 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2ccccc2I)N(C)C)cc1 ZINC000519275290 927859854 /nfs/dbraw/zinc/85/98/54/927859854.db2.gz LPTLUCNXGRPYOB-QGZVFWFLSA-N 0 3 423.298 4.024 20 0 HIADHN COc1ccc(C(C)(C)CN[C@H](C(=O)N2CCCCC2)c2ccccc2)cc1OC ZINC000519281857 927862561 /nfs/dbraw/zinc/86/25/61/927862561.db2.gz NVYRHOHMKCVHRK-QHCPKHFHSA-N 0 3 410.558 4.325 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N(C)Cc2ccccc2Br)N(C)C)cc1 ZINC000519295010 927867582 /nfs/dbraw/zinc/86/75/82/927867582.db2.gz AMEFNLMBAVDLGG-IBGZPJMESA-N 0 3 404.352 4.202 20 0 HIADHN CN(Cc1ccc(OC(F)F)cc1)C(=O)NC[C@H]1CCCCN1Cc1ccccc1 ZINC000519296771 927868376 /nfs/dbraw/zinc/86/83/76/927868376.db2.gz HBGJUHFSEWDNDV-HXUWFJFHSA-N 0 3 417.500 4.484 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)NCc2nc3cc(Cl)ccc3s2)N(C)C)cc1 ZINC000519312908 927876307 /nfs/dbraw/zinc/87/63/07/927876307.db2.gz ALVOOKTUBPIXBN-QGZVFWFLSA-N 0 3 402.951 4.360 20 0 HIADHN CN(CCNC(=O)Nc1nnc(C(C)(C)c2ccccc2)s1)Cc1ccccc1 ZINC000519338338 927888414 /nfs/dbraw/zinc/88/84/14/927888414.db2.gz UYDNXAVWARKQJG-UHFFFAOYSA-N 0 3 409.559 4.118 20 0 HIADHN C[C@@H]1CCC[C@H](C)N1CCNC(=O)C(=O)Nc1ccccc1Sc1ccccc1 ZINC000519390112 927914876 /nfs/dbraw/zinc/91/48/76/927914876.db2.gz VQGGGFZPMUJWLM-HDICACEKSA-N 0 3 411.571 4.155 20 0 HIADHN C[C@@H](NCCCS(=O)(=O)c1ccc(Cl)cc1)c1ccnn1-c1ccccc1 ZINC000519435326 927946838 /nfs/dbraw/zinc/94/68/38/927946838.db2.gz LSETZFRSFOENRC-MRXNPFEDSA-N 0 3 403.935 4.040 20 0 HIADHN CC(C)c1noc(-c2ccccc2C(=O)NCC(C)(C)N2CCc3ccccc3C2)n1 ZINC000519455423 927962127 /nfs/dbraw/zinc/96/21/27/927962127.db2.gz KUDLOISUSSBMIY-UHFFFAOYSA-N 0 3 418.541 4.427 20 0 HIADHN CCOCCCNC(=O)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000519499104 927993818 /nfs/dbraw/zinc/99/38/18/927993818.db2.gz VYLCLSRSAFEZNP-UHFFFAOYSA-N 0 3 402.366 4.027 20 0 HIADHN COc1ccc(CN2CC[C@H](NC/C(C)=C\c3ccccc3OC(F)F)C2=O)cc1 ZINC000519673907 928047515 /nfs/dbraw/zinc/04/75/15/928047515.db2.gz QUSZVBBAIIXWQT-JDQHYLEWSA-N 0 3 416.468 4.091 20 0 HIADHN CCc1nn(-c2ccccc2)c(CC)c1CN[C@H](C)c1cccc(-n2ccnn2)c1 ZINC000519809708 928083468 /nfs/dbraw/zinc/08/34/68/928083468.db2.gz DOTFFNBBYNYMAH-GOSISDBHSA-N 0 3 400.530 4.429 20 0 HIADHN CCOc1cccc([C@@H](C)NC(=O)Nc2ccc(N3CCN(CC)CC3)cc2C)c1 ZINC000519871918 928104311 /nfs/dbraw/zinc/10/43/11/928104311.db2.gz XWCLZDZWPJAONV-LJQANCHMSA-N 0 3 410.562 4.418 20 0 HIADHN CC(C)c1cccc(O[C@@H](C(=O)NCCCCN2CCN(C)CC2)c2ccccc2)c1 ZINC000519929611 928162874 /nfs/dbraw/zinc/16/28/74/928162874.db2.gz MMPLODMLCLBHMI-RUZDIDTESA-N 0 3 423.601 4.074 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)c(C)c1 ZINC000519988327 928214478 /nfs/dbraw/zinc/21/44/78/928214478.db2.gz NJMPHHWUOJIJJR-UGKGYDQZSA-N 0 3 422.573 4.309 20 0 HIADHN CCOc1cc2c(cc1NC(=O)NC[C@H](c1cccs1)N1CCCC1)O[C@@H](C)C2 ZINC000520048880 928273205 /nfs/dbraw/zinc/27/32/05/928273205.db2.gz XIMJKQHDZLRYDG-MAUKXSAKSA-N 0 3 415.559 4.429 20 0 HIADHN COc1ccc(F)cc1[C@@H](C)NC(=O)N(CCCc1ccccc1)CCN(C)C ZINC000520052506 928277172 /nfs/dbraw/zinc/27/71/72/928277172.db2.gz CZZRPTIMDNUBCQ-GOSISDBHSA-N 0 3 401.526 4.101 20 0 HIADHN CCCc1c(C(=O)NC[C@@H](c2ccc(C)cc2)N(C)C)cnn1Cc1ccccc1 ZINC000520061334 928285679 /nfs/dbraw/zinc/28/56/79/928285679.db2.gz SXTBURJFRZYQOH-DEOSSOPVSA-N 0 3 404.558 4.225 20 0 HIADHN Cc1nc(COc2ccccc2C(=O)NC[C@H](c2ccc(C)cc2)N(C)C)cs1 ZINC000520061896 928285860 /nfs/dbraw/zinc/28/58/60/928285860.db2.gz JZFBDRLEPAFPPK-OAQYLSRUSA-N 0 3 409.555 4.372 20 0 HIADHN CCOc1ccc(-c2nc(CC(=O)NC[C@H](c3ccc(C)cc3)N(C)C)cs2)cc1 ZINC000520064500 928288844 /nfs/dbraw/zinc/28/88/44/928288844.db2.gz LLIFRYNRWGGAOD-JOCHJYFZSA-N 0 3 423.582 4.479 20 0 HIADHN C[C@H](CNC(=O)c1cccnc1SCc1ccc(F)cc1)N1CCC(C)CC1 ZINC000520065515 928289735 /nfs/dbraw/zinc/28/97/35/928289735.db2.gz HCIYBJNOEMFPIH-QGZVFWFLSA-N 0 3 401.551 4.363 20 0 HIADHN C[C@H](Cc1cccc(Br)c1)NC(=O)N(CCN(C)C)Cc1ccccc1 ZINC000520086305 928302044 /nfs/dbraw/zinc/30/20/44/928302044.db2.gz IEOQFNSXYUMJEG-QGZVFWFLSA-N 0 3 418.379 4.154 20 0 HIADHN O=C(Nc1ccccc1C(=O)N1CCCCC1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000520094001 928306363 /nfs/dbraw/zinc/30/63/63/928306363.db2.gz WBEKEJBVHGRBQM-FQEVSTJZSA-N 0 3 423.532 4.303 20 0 HIADHN O=C(N[C@@H](c1ccccc1)c1ccccn1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000520093690 928306572 /nfs/dbraw/zinc/30/65/72/928306572.db2.gz KYXLTEKXVIVIMU-URXFXBBRSA-N 0 3 403.501 4.339 20 0 HIADHN O=C(N[C@@H](c1ccccc1)c1ccccn1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000520093689 928306656 /nfs/dbraw/zinc/30/66/56/928306656.db2.gz KYXLTEKXVIVIMU-QPPBQGQZSA-N 0 3 403.501 4.339 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)NCc1ccc(F)c(F)c1 ZINC000520114390 928320759 /nfs/dbraw/zinc/32/07/59/928320759.db2.gz IJSZOHROPWWJQK-UHFFFAOYSA-N 0 3 415.406 4.257 20 0 HIADHN COCCCCNC(=O)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000520130796 928328600 /nfs/dbraw/zinc/32/86/00/928328600.db2.gz KKIWOGOBQJBTPO-UHFFFAOYSA-N 0 3 402.366 4.027 20 0 HIADHN COCCN1CCC(NC(=O)Nc2cccc(CO[C@@H]3CCC[C@@H](C)C3)c2)CC1 ZINC000520132692 928330276 /nfs/dbraw/zinc/33/02/76/928330276.db2.gz PZTYJYLMOWETCE-XMSQKQJNSA-N 0 3 403.567 4.014 20 0 HIADHN CN(CCCc1cc(-c2cccc(F)c2)n[nH]1)C(=O)[C@H]1CCCN1Cc1ccccc1 ZINC000520146907 928341059 /nfs/dbraw/zinc/34/10/59/928341059.db2.gz PWVOTPYMRWYDHL-XMMPIXPASA-N 0 3 420.532 4.271 20 0 HIADHN CCN(Cc1ccc(OC)cc1OC)C(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000520153802 928346136 /nfs/dbraw/zinc/34/61/36/928346136.db2.gz XVFNUDCCACLVCB-WIYYLYMNSA-N 0 3 411.546 4.071 20 0 HIADHN CN(C)CCN(C(=O)c1cccc(OCc2cn3ccccc3n2)c1)c1ccccc1 ZINC000520166432 928356473 /nfs/dbraw/zinc/35/64/73/928356473.db2.gz KXCRRMVUBJUVSR-UHFFFAOYSA-N 0 3 414.509 4.122 20 0 HIADHN C/C(=C\c1ccccc1)CNCc1cccc(S(=O)(=O)NCc2cccc(F)c2)c1 ZINC000520200629 928385027 /nfs/dbraw/zinc/38/50/27/928385027.db2.gz IOWWVOYPYSSVKM-CPNJWEJPSA-N 0 3 424.541 4.497 20 0 HIADHN COc1ccc(CCCN(C)C(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)cc1 ZINC000520284159 928446667 /nfs/dbraw/zinc/44/66/67/928446667.db2.gz ZEBOCZOSSLPIEY-XMMPIXPASA-N 0 3 409.574 4.415 20 0 HIADHN CCN1CCCN(C(=O)[C@@](C)(Cc2nc3ccccc3s2)c2ccccc2)CC1 ZINC000520312228 928473916 /nfs/dbraw/zinc/47/39/16/928473916.db2.gz RGQAKSLVTCYAKR-DEOSSOPVSA-N 0 3 407.583 4.351 20 0 HIADHN CCCCC1CCC(C(=O)NCc2ccc(C(=O)NCCN3CCCC3)cc2)CC1 ZINC000520312530 928473940 /nfs/dbraw/zinc/47/39/40/928473940.db2.gz BJVZVPFQUYYBPX-UHFFFAOYSA-N 0 3 413.606 4.125 20 0 HIADHN Fc1ccc(N2CCN(c3cc(CNc4ccnc5ccccc54)ccn3)CC2)cc1 ZINC000520324110 928487827 /nfs/dbraw/zinc/48/78/27/928487827.db2.gz CKDQWMXVNILWOS-UHFFFAOYSA-N 0 3 413.500 4.130 20 0 HIADHN Cc1ccc(OCc2nc(CC(=O)NC[C@H](C)N(C)Cc3ccccc3)cs2)cc1 ZINC000520326967 928491430 /nfs/dbraw/zinc/49/14/30/928491430.db2.gz YMBFJWRKBNYIDB-IBGZPJMESA-N 0 3 423.582 4.210 20 0 HIADHN Cc1cc(NC(=O)c2cccc(F)c2)sc1C(=O)N[C@H](C)CN1CCCCC1 ZINC000520363043 928521446 /nfs/dbraw/zinc/52/14/46/928521446.db2.gz YZAZVXJWPPJXOV-OAHLLOKOSA-N 0 3 403.523 4.052 20 0 HIADHN Cc1cccc(-c2nnc(-c3ccc(C(=O)N(C)[C@H]4CCN(C5CC5)C4)cc3)o2)c1 ZINC000520366438 928523023 /nfs/dbraw/zinc/52/30/23/928523023.db2.gz OUMLDSHSUIJUHX-NRFANRHFSA-N 0 3 402.498 4.021 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N(CC)[C@@H]1CCOC(C)(C)C1)c1cccc(OC)c1 ZINC000520469233 928584228 /nfs/dbraw/zinc/58/42/28/928584228.db2.gz HQQBMSKNTPCGOI-CTNGQTDRSA-N 0 3 405.583 4.067 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N(C)C[C@H]1CCCCO1)c1ccc(C(F)(F)F)cc1 ZINC000520474208 928587293 /nfs/dbraw/zinc/58/72/93/928587293.db2.gz WDUAQBJBQASEKZ-RTBURBONSA-N 0 3 415.500 4.299 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N3CCC[C@H](Cc4ccccc4)C3)cc2)CC1 ZINC000520688327 928735646 /nfs/dbraw/zinc/73/56/46/928735646.db2.gz HSBCSNBTQNXQLH-HSZRJFAPSA-N 0 3 405.586 4.312 20 0 HIADHN COc1cccc(OC)c1OC[C@H](O)CN(C)[C@@H](C)c1ccc(Cl)c(Cl)c1 ZINC000520695051 928742899 /nfs/dbraw/zinc/74/28/99/928742899.db2.gz MENAOKOWQACWPM-DZGCQCFKSA-N 0 3 414.329 4.443 20 0 HIADHN COc1cccc(OC)c1OC[C@@H](O)CN(C)[C@@H](C)c1ccc(Cl)c(Cl)c1 ZINC000520695054 928743404 /nfs/dbraw/zinc/74/34/04/928743404.db2.gz MENAOKOWQACWPM-ZFWWWQNUSA-N 0 3 414.329 4.443 20 0 HIADHN O=C([C@@H](Sc1cc(F)ccc1F)c1ccccc1)N1CC[C@@H](N2CCCC2)C1 ZINC000520734529 928783777 /nfs/dbraw/zinc/78/37/77/928783777.db2.gz FPLLHKXNDNTLIT-NQIIRXRSSA-N 0 3 402.510 4.495 20 0 HIADHN COc1ccc(OC(C)C)c(NC(=O)NCC(C)(C)N2CCc3ccccc3C2)c1 ZINC000520742716 928792065 /nfs/dbraw/zinc/79/20/65/928792065.db2.gz CKYMFHPANMNJHP-UHFFFAOYSA-N 0 3 411.546 4.441 20 0 HIADHN COc1ccc(-c2ccc(C(=O)N3CC[C@H](N4CCCCC4)C3)c(F)c2)c(F)c1 ZINC000520770157 928809130 /nfs/dbraw/zinc/80/91/30/928809130.db2.gz UUANPIMRHIATEM-KRWDZBQOSA-N 0 3 400.469 4.341 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2ccc(C)cc2OC[C@@H]2CCCO2)N(C)C)cc1 ZINC000520826558 928834396 /nfs/dbraw/zinc/83/43/96/928834396.db2.gz DQBKSVRVACCFRZ-RBBKRZOGSA-N 0 3 411.546 4.286 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2cc(C3CC3)nc3c2cnn3C(C)C)N(C)C)cc1 ZINC000520859814 928848192 /nfs/dbraw/zinc/84/81/92/928848192.db2.gz GBAHYAAAJYRWDO-JOCHJYFZSA-N 0 3 405.546 4.231 20 0 HIADHN CC(C)c1ncc(Cl)c(C(=O)N[C@@H](CN2CCc3ccccc3C2)C(C)(C)C)n1 ZINC000520967517 928894125 /nfs/dbraw/zinc/89/41/25/928894125.db2.gz DOBMKCOIXPBQBH-IBGZPJMESA-N 0 3 414.981 4.456 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)c1cc(-c2cccc(F)c2)no1 ZINC000520987476 928905058 /nfs/dbraw/zinc/90/50/58/928905058.db2.gz XQEBCRYVMKGAKT-UHFFFAOYSA-N 0 3 401.869 4.338 20 0 HIADHN O=C(NCc1ccccn1)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000521059612 928965988 /nfs/dbraw/zinc/96/59/88/928965988.db2.gz BEHFGHAYTFXFRO-UHFFFAOYSA-N 0 3 407.345 4.196 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)N[C@H]1CCOc2c(Cl)cccc21 ZINC000521070375 928972077 /nfs/dbraw/zinc/97/20/77/928972077.db2.gz RQPGIASAMJDXJC-IBGZPJMESA-N 0 3 423.891 4.215 20 0 HIADHN C[C@H](CNC(=O)C1(c2cccc(Cl)c2)CCOCC1)N(C)Cc1ccccc1 ZINC000521095525 928989872 /nfs/dbraw/zinc/98/98/72/928989872.db2.gz CLDLLMKKIZSBIN-GOSISDBHSA-N 0 3 400.950 4.025 20 0 HIADHN CCc1ccc([C@H](CNC(=O)Nc2ccc(C(=O)NC3CCCC3)cc2)N(C)C)cc1 ZINC000521185023 929049352 /nfs/dbraw/zinc/04/93/52/929049352.db2.gz YXELXTKQAPNHLM-QHCPKHFHSA-N 0 3 422.573 4.346 20 0 HIADHN CCCN(CC(=O)NCC1(c2ccccc2)CCOCC1)[C@H]1CCc2ccccc21 ZINC000521193722 929054545 /nfs/dbraw/zinc/05/45/45/929054545.db2.gz PNIMQUOSKDCNKT-DEOSSOPVSA-N 0 3 406.570 4.251 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2C(=O)N[C@@H]2CCN(C3CC3)C2)cc1C ZINC000521226495 929068089 /nfs/dbraw/zinc/06/80/89/929068089.db2.gz FHCOSUHXLLBQFO-HXUWFJFHSA-N 0 3 400.526 4.123 20 0 HIADHN CC1(C)CN(C2(CNC(=O)CCc3ccc(OC(F)F)cc3)CCCCC2)CCO1 ZINC000521275027 929094451 /nfs/dbraw/zinc/09/44/51/929094451.db2.gz OLOVIRVTTODTHJ-UHFFFAOYSA-N 0 3 424.532 4.151 20 0 HIADHN Cc1cc(I)ccc1NC(=O)[C@H](C(C)C)N1CCCCC1 ZINC000521442195 929223575 /nfs/dbraw/zinc/22/35/75/929223575.db2.gz ULWWGDLKFMLEAJ-INIZCTEOSA-N 0 3 400.304 4.049 20 0 HIADHN O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N[C@H]1CCSc2ccc(Cl)cc21 ZINC000521450856 929227565 /nfs/dbraw/zinc/22/75/65/929227565.db2.gz OFCIIGMLKJIMCT-MJGOQNOKSA-N 0 3 401.963 4.451 20 0 HIADHN CN(C)[C@H](CNC(=O)NCc1ccc(Oc2cccc(F)c2)nc1)c1ccccc1 ZINC000521453338 929228737 /nfs/dbraw/zinc/22/87/37/929228737.db2.gz SAAWULRBVSRGMH-OAQYLSRUSA-N 0 3 408.477 4.115 20 0 HIADHN O=C(NCc1ccccc1Br)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000521532376 929278122 /nfs/dbraw/zinc/27/81/22/929278122.db2.gz KUHBMRCOUOQTCL-QGZVFWFLSA-N 0 3 405.311 4.117 20 0 HIADHN O=C(Nc1ccc(Br)cc1[O-])[C@@H]1CCC[N@H+](Cc2cccc(F)c2)C1 ZINC000521533571 929279707 /nfs/dbraw/zinc/27/97/07/929279707.db2.gz JEWVBWFJRXSQQF-CQSZACIVSA-N 0 3 407.283 4.145 20 0 HIADHN O=C(Nc1ccc(Br)cc1[O-])[C@@H]1CCC[N@@H+](Cc2cccc(F)c2)C1 ZINC000521533571 929279715 /nfs/dbraw/zinc/27/97/15/929279715.db2.gz JEWVBWFJRXSQQF-CQSZACIVSA-N 0 3 407.283 4.145 20 0 HIADHN CN(C)CCN(C(=O)COc1ccc(Br)cc1Cl)c1ccccc1 ZINC000521803074 929463031 /nfs/dbraw/zinc/46/30/31/929463031.db2.gz CHJZIXDGWXOAKT-UHFFFAOYSA-N 0 3 411.727 4.076 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)N3CC[C@H](c4ccccc4)C3)CC2)c1 ZINC000521834473 929485244 /nfs/dbraw/zinc/48/52/44/929485244.db2.gz UZKZEJBILSNPPF-DEOSSOPVSA-N 0 3 420.601 4.096 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)Nc3ccc(O)c(COC(C)C)c3)c2)CC1 ZINC000521943148 929579020 /nfs/dbraw/zinc/57/90/20/929579020.db2.gz NERGTNQCYIVHSL-UHFFFAOYSA-N 0 3 412.534 4.103 20 0 HIADHN Cc1cc(NC(=O)C(C)(C)C)sc1C(=O)NC[C@@H](C)N(C)Cc1ccccc1 ZINC000521957130 929592606 /nfs/dbraw/zinc/59/26/06/929592606.db2.gz RYEWXXDSLGPKHD-MRXNPFEDSA-N 0 3 401.576 4.291 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N(C)Cc2ccc(Br)o2)N2CCCC2)cc1 ZINC000521993329 929615506 /nfs/dbraw/zinc/61/55/06/929615506.db2.gz KBZJVLZTMHKJMT-GOSISDBHSA-N 0 3 420.351 4.329 20 0 HIADHN CC(C)CC(=O)Nc1ccc(NC(=O)NC[C@H]2CCCN2Cc2ccccc2)cc1 ZINC000524483998 929632559 /nfs/dbraw/zinc/63/25/59/929632559.db2.gz BEPBWBKXWYHWOE-JOCHJYFZSA-N 0 3 408.546 4.457 20 0 HIADHN CC(C)(C)NC(=O)c1cccc(NC(=O)NC[C@@H]2CCCN2Cc2ccccc2)c1 ZINC000524483248 929632869 /nfs/dbraw/zinc/63/28/69/929632869.db2.gz KVWLWONXLNBYSW-NRFANRHFSA-N 0 3 408.546 4.001 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@H](C)N2CCC[C@H](Cc3ccccc3)C2)cc1OC ZINC000524485768 929633610 /nfs/dbraw/zinc/63/36/10/929633610.db2.gz JAMSGIDUEPWXJH-PZJWPPBQSA-N 0 3 410.558 4.005 20 0 HIADHN CCN1CCN(C[C@H](C)CNc2ncnc3scc(-c4ccc(C)cc4)c32)CC1 ZINC000524489960 929637126 /nfs/dbraw/zinc/63/71/26/929637126.db2.gz GIFXAASPGWOTDH-GOSISDBHSA-N 0 3 409.603 4.352 20 0 HIADHN CN(C)Cc1cccc(NC(=O)N(C)CCOc2ccc(Br)cc2)c1 ZINC000524539663 929672065 /nfs/dbraw/zinc/67/20/65/929672065.db2.gz MVKBISRGOFXDNS-UHFFFAOYSA-N 0 3 406.324 4.053 20 0 HIADHN CC[C@H](NC(=O)NC[C@H](c1cccc(OC)c1)N(CC)CC)c1nc(C)cs1 ZINC000524555347 929684443 /nfs/dbraw/zinc/68/44/43/929684443.db2.gz OFJFJJVFHUXTFT-RBUKOAKNSA-N 0 3 404.580 4.294 20 0 HIADHN Cc1cc(NC(=O)c2cccc(F)c2)sc1C(=O)NCCN1[C@H](C)CCC[C@@H]1C ZINC000524673153 929787329 /nfs/dbraw/zinc/78/73/29/929787329.db2.gz CJOQJDLTAAANTF-IYBDPMFKSA-N 0 3 417.550 4.441 20 0 HIADHN CCCC(=O)Nc1cccc(CNC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)c1 ZINC000524740828 929815868 /nfs/dbraw/zinc/81/58/68/929815868.db2.gz QSLNDXZMHLIUHU-HXUWFJFHSA-N 0 3 422.573 4.231 20 0 HIADHN CCN(CC(F)(F)F)C(=O)[C@H]1CCCN(Cc2ccc(SC)c(OC)c2)C1 ZINC000524755846 929819929 /nfs/dbraw/zinc/81/99/29/929819929.db2.gz JOTAHRKIEFHZDQ-HNNXBMFYSA-N 0 3 404.498 4.040 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)N[C@@H](C)c2ncc(-c3ccccc3)o2)c1 ZINC000524802675 929835673 /nfs/dbraw/zinc/83/56/73/929835673.db2.gz GYWBBGRTJKDELO-IBGZPJMESA-N 0 3 406.530 4.484 20 0 HIADHN CCCNC(=O)c1cccc(C(=O)N(CC)[C@@H]2CCN([C@@H](C)c3ccccc3)C2)c1 ZINC000524939926 929900695 /nfs/dbraw/zinc/90/06/95/929900695.db2.gz CQMCJZFMTYGNKV-WMZHIEFXSA-N 0 3 407.558 4.124 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)[C@H]2C[C@@H]2c2ccccc2OC(F)(F)F)o1 ZINC000524959022 929922125 /nfs/dbraw/zinc/92/21/25/929922125.db2.gz IJISZDZREHTLGD-MSOLQXFVSA-N 0 3 410.436 4.181 20 0 HIADHN COc1cccc(Oc2ncccc2CNC(=O)c2cccc(CN3CCCC3)c2)c1 ZINC000524970482 929934596 /nfs/dbraw/zinc/93/45/96/929934596.db2.gz HFIWYKOXIHSFDC-UHFFFAOYSA-N 0 3 417.509 4.408 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)c2cccc(C(=O)N(C)CC(C)(C)C)c2)c1 ZINC000525031743 929990017 /nfs/dbraw/zinc/99/00/17/929990017.db2.gz PRTLAUMKEGJVCQ-UHFFFAOYSA-N 0 3 423.601 4.317 20 0 HIADHN COCCN(CCN(C)C)C(=O)c1cccc(CSc2cc(C)ccc2C)c1 ZINC000525053425 930005599 /nfs/dbraw/zinc/00/55/99/930005599.db2.gz PUKFQNDXAFTTIS-UHFFFAOYSA-N 0 3 400.588 4.246 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2ccc(CNC(=O)C(C)(C)C)cc2)N2CCCC2)cc1 ZINC000525061612 930010618 /nfs/dbraw/zinc/01/06/18/930010618.db2.gz KVBWMEDAWRAERX-HSZRJFAPSA-N 0 3 421.585 4.224 20 0 HIADHN Cc1c2ccccc2oc1C(=O)Nc1ccc(C(=O)N(C)[C@H]2CCCN(C)C2)cc1 ZINC000525065953 930013545 /nfs/dbraw/zinc/01/35/45/930013545.db2.gz DYBAUXMSIHUNJS-IBGZPJMESA-N 0 3 405.498 4.160 20 0 HIADHN Cc1ccc2[nH]c(C(=O)Nc3ccc(C(=O)N(C)[C@H]4CCCN(C)C4)cc3)cc2c1C ZINC000525098974 930033780 /nfs/dbraw/zinc/03/37/80/930033780.db2.gz LERFBVBGPOQWTQ-FQEVSTJZSA-N 0 3 418.541 4.203 20 0 HIADHN C[C@@H](C(=O)Nc1cccc(N2CCCC2=O)c1)N1CC[C@@H](c2ccccc2)[C@H](C)C1 ZINC000525122407 930049069 /nfs/dbraw/zinc/04/90/69/930049069.db2.gz FPUQAGIZWBDXMW-SELNLUPBSA-N 0 3 405.542 4.266 20 0 HIADHN COc1cccc(-c2ccc(CNC(=O)[C@@H]3CCCN(Cc4cccnc4)C3)cc2)c1 ZINC000525164544 930073220 /nfs/dbraw/zinc/07/32/20/930073220.db2.gz QPLRPZBHPBCJQZ-XMMPIXPASA-N 0 3 415.537 4.286 20 0 HIADHN COc1cc(-c2nnc(CN3C[C@H](c4ccccc4C)C[C@@H]3C)o2)cc(OC)c1OC ZINC000525272601 930124398 /nfs/dbraw/zinc/12/43/98/930124398.db2.gz AGYKFKUJNWONRW-FUHWJXTLSA-N 0 3 423.513 4.449 20 0 HIADHN COc1cc(-c2nnc(CN3C[C@H](c4ccccc4C)C[C@H]3C)o2)cc(OC)c1OC ZINC000525272603 930125287 /nfs/dbraw/zinc/12/52/87/930125287.db2.gz AGYKFKUJNWONRW-SJLPKXTDSA-N 0 3 423.513 4.449 20 0 HIADHN CN1CCN(CCCCNC(=O)N(Cc2cccc3ccccc32)C2CCCC2)CC1 ZINC000525303253 930144175 /nfs/dbraw/zinc/14/41/75/930144175.db2.gz AHWHTTGGHCWYRR-UHFFFAOYSA-N 0 3 422.617 4.322 20 0 HIADHN COc1ccc(SCCC(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)cc1OC ZINC000525338912 930175764 /nfs/dbraw/zinc/17/57/64/930175764.db2.gz JTUNQSSODBTIRR-HKUYNNGSSA-N 0 3 414.571 4.138 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(F)cc2)CC1)C1(c2cccc(F)c2)CCC1 ZINC000525352579 930190590 /nfs/dbraw/zinc/19/05/90/930190590.db2.gz UYYSDTYYDDCPDE-UHFFFAOYSA-N 0 3 414.496 4.046 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)c1cccc(Oc2cnccn2)c1 ZINC000525383109 930210079 /nfs/dbraw/zinc/21/00/79/930210079.db2.gz WJPVJZOTZWQDLE-IBGZPJMESA-N 0 3 402.498 4.006 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)NCc1ccccc1OC(F)F ZINC000525399504 930219062 /nfs/dbraw/zinc/21/90/62/930219062.db2.gz RFVYZKKHGKBFPX-KRWDZBQOSA-N 0 3 403.473 4.094 20 0 HIADHN C[C@H](OCCCNC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C)c1ccccc1 ZINC000525399372 930219095 /nfs/dbraw/zinc/21/90/95/930219095.db2.gz LETLCJLYQAISDD-VXKWHMMOSA-N 0 3 409.574 4.460 20 0 HIADHN CCCC(=O)Nc1ccc(CNC(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)cc1 ZINC000525403888 930221892 /nfs/dbraw/zinc/22/18/92/930221892.db2.gz WLKNSORPKYTYRS-HXUWFJFHSA-N 0 3 422.573 4.231 20 0 HIADHN O=C(Nc1cccc(CN2CCSCC2)c1)[C@@H]1CCCCN1Cc1ccccc1 ZINC000525484223 930273336 /nfs/dbraw/zinc/27/33/36/930273336.db2.gz ZPGLWLMVHLUWMJ-QHCPKHFHSA-N 0 3 409.599 4.229 20 0 HIADHN CN(C)Cc1cccc(C(=O)N2CCC[C@H](c3nc(-c4ccc(Cl)cc4)no3)C2)c1 ZINC000525493959 930279970 /nfs/dbraw/zinc/27/99/70/930279970.db2.gz XFMGBLKGJQRPLD-IBGZPJMESA-N 0 3 424.932 4.471 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1ccc(C(=O)NCC(C)(C)C)cc1)c1ccsc1 ZINC000525577464 930340829 /nfs/dbraw/zinc/34/08/29/930340829.db2.gz KDXKQHDEVYCEBZ-FQEVSTJZSA-N 0 3 415.603 4.337 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1ccc(C(=O)NCC(C)(C)C)cc1)c1ccsc1 ZINC000525577465 930341045 /nfs/dbraw/zinc/34/10/45/930341045.db2.gz KDXKQHDEVYCEBZ-HXUWFJFHSA-N 0 3 415.603 4.337 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2ccc3ccccc3c2)cc1)[C@@H]1CCCN(C)C1 ZINC000525581507 930344303 /nfs/dbraw/zinc/34/43/03/930344303.db2.gz CMJQNDMJRUHJJF-HSZRJFAPSA-N 0 3 401.510 4.258 20 0 HIADHN CCCN(CC(=O)Nc1cccc(NC(C)=O)c1)[C@@H]1C[C@H](OCC)C12CCCCC2 ZINC000525640056 930378432 /nfs/dbraw/zinc/37/84/32/930378432.db2.gz NMKUPZLFHLRARD-YADHBBJMSA-N 0 3 415.578 4.423 20 0 HIADHN Cc1cccc(C(C)C)c1NC(=O)[C@H](C)NC[C@H](c1cccs1)N1CCOCC1 ZINC000525757082 930432028 /nfs/dbraw/zinc/43/20/28/930432028.db2.gz BJLYORWEGMTWEZ-AZUAARDMSA-N 0 3 415.603 4.170 20 0 HIADHN O=C(NC[C@H]1CCCN1Cc1ccccc1)N1CCC(OCC2CCCCC2)CC1 ZINC000525765254 930436083 /nfs/dbraw/zinc/43/60/83/930436083.db2.gz OSNAFSOMXKNLHW-HSZRJFAPSA-N 0 3 413.606 4.422 20 0 HIADHN Cc1ccc([C@@H](CCn2cncn2)NCc2ccc(N3CCC(C)CC3)nc2)cc1 ZINC000525857881 930469539 /nfs/dbraw/zinc/46/95/39/930469539.db2.gz WPXXWWBNSDDQND-HSZRJFAPSA-N 0 3 404.562 4.139 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)C(=O)N(Cc1ccccc1)C1CCCCC1 ZINC000525867829 930472050 /nfs/dbraw/zinc/47/20/50/930472050.db2.gz QUABGQPPRYVENG-UHFFFAOYSA-N 0 3 423.557 4.057 20 0 HIADHN C[C@H](CN[C@@H](C(N)=O)c1cccc(Br)c1)c1ccc(C(F)(F)F)cc1 ZINC000525952072 930492920 /nfs/dbraw/zinc/49/29/20/930492920.db2.gz HKEDTVIGDSDZTP-BDJLRTHQSA-N 0 3 415.253 4.388 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)N[C@H](C)c1ccc(Br)s1 ZINC000525961327 930497027 /nfs/dbraw/zinc/49/70/27/930497027.db2.gz AEPMSJPVMGHRQB-LLVKDONJSA-N 0 3 412.353 4.464 20 0 HIADHN C[C@@H](NC(=O)Nc1ccc(C(F)(F)F)c(Br)c1)C1=CCN(C)CC1 ZINC000526065175 930517816 /nfs/dbraw/zinc/51/78/16/930517816.db2.gz ZMASZAWAUSYMDB-SNVBAGLBSA-N 0 3 406.246 4.240 20 0 HIADHN C[C@H](NCC(=O)NCc1ccc(C(=O)N2CCCC2)cc1)c1cc2ccccc2s1 ZINC000526945087 930554961 /nfs/dbraw/zinc/55/49/61/930554961.db2.gz HUEWUMCJVAPIPK-KRWDZBQOSA-N 0 3 421.566 4.104 20 0 HIADHN CC1(C)C[C@@H](NCc2ccc3c(c2)CCS3(=O)=O)c2cc(Br)ccc21 ZINC000527066846 930579102 /nfs/dbraw/zinc/57/91/02/930579102.db2.gz XDXJXPGZSMGCIM-GOSISDBHSA-N 0 3 420.372 4.291 20 0 HIADHN C[C@H](CC(=O)Nc1ccc(NC(=O)C2CC2)cc1)N[C@H]1CCOc2ccc(F)cc21 ZINC000527099721 930589556 /nfs/dbraw/zinc/58/95/56/930589556.db2.gz IDYJEURWNXLZFD-VLIAUNLRSA-N 0 3 411.477 4.005 20 0 HIADHN CS(=O)(=O)[C@@H]1CCC[C@H](N[C@H](c2ccc(Br)cc2Cl)C2CC2)C1 ZINC000527109284 930592285 /nfs/dbraw/zinc/59/22/85/930592285.db2.gz IKSLMHNZSDSKCE-VBQJREDUSA-N 0 3 420.800 4.499 20 0 HIADHN COc1cc2c(cc1OC)CN(C(=O)CN[C@@H](C)c1cc3ccccc3s1)CC2 ZINC000527194371 930609306 /nfs/dbraw/zinc/60/93/06/930609306.db2.gz JQNZWMPAMWCDDM-HNNXBMFYSA-N 0 3 410.539 4.154 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1cc(-c2cccc(F)c2)no1 ZINC000527194581 930609503 /nfs/dbraw/zinc/60/95/03/930609503.db2.gz CMWJGSVXXLRAHL-UHFFFAOYSA-N 0 3 411.399 4.016 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)c1c[nH]c(=O)c2ccccc12 ZINC000527291212 930628541 /nfs/dbraw/zinc/62/85/41/930628541.db2.gz AHZUWKWAOYMHOG-UHFFFAOYSA-N 0 3 417.431 4.163 20 0 HIADHN COc1cc(NC(=O)CN[C@H](C)c2cc3ccccc3s2)cc(OC)c1OC ZINC000527484905 930666460 /nfs/dbraw/zinc/66/64/60/930666460.db2.gz AWPJIJXBTASYLE-CYBMUJFWSA-N 0 3 400.500 4.216 20 0 HIADHN Cc1cc(F)c(Br)cc1NC(=O)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000530456726 930714153 /nfs/dbraw/zinc/71/41/53/930714153.db2.gz MIOFQOJMZQJVDL-OAHLLOKOSA-N 0 3 406.299 4.142 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2cc(N3CCCC3=O)ccc2Cl)[C@@H]1c1ccccc1 ZINC000530515853 930733156 /nfs/dbraw/zinc/73/31/56/930733156.db2.gz CSOCQWYQRCNLMX-RXVVDRJESA-N 0 3 412.921 4.034 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2cccc(OCc3cccnc3)c2)[C@H]1c1ccccc1 ZINC000530515368 930734057 /nfs/dbraw/zinc/73/40/57/930734057.db2.gz DTINRNCOYGXBDV-DHIUTWEWSA-N 0 3 402.498 4.228 20 0 HIADHN C[C@@H](NC(=O)[C@@H]1CCCN(Cc2cccnc2)C1)c1ccc(-c2ccncc2)cc1 ZINC000530580328 930757410 /nfs/dbraw/zinc/75/74/10/930757410.db2.gz OTDHZMCERXIQKL-NTKDMRAZSA-N 0 3 400.526 4.233 20 0 HIADHN COc1ccc(Cc2noc([C@@]3(C(F)(F)F)CCN(Cc4ccccc4)C3)n2)cc1 ZINC000530640362 930784110 /nfs/dbraw/zinc/78/41/10/930784110.db2.gz AEGLPUVOMKUELK-OAQYLSRUSA-N 0 3 417.431 4.375 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)Nc1cccc(Cl)c1Cl ZINC000530740695 930813878 /nfs/dbraw/zinc/81/38/78/930813878.db2.gz YULSSPAIIXYVMP-UHFFFAOYSA-N 0 3 408.329 4.272 20 0 HIADHN O=C(CC1(N2CCOCC2)CCCC1)N[C@@H](Cc1ccccc1)c1ccccc1F ZINC000530820594 930831589 /nfs/dbraw/zinc/83/15/89/930831589.db2.gz ZBWGWWLNXVWABA-QHCPKHFHSA-N 0 3 410.533 4.261 20 0 HIADHN CC(C)n1cc([C@@H](C)NC(=O)N[C@@H](CN2CCc3ccccc3C2)C(C)(C)C)cn1 ZINC000531107869 930921864 /nfs/dbraw/zinc/92/18/64/930921864.db2.gz ABWLLRBRZIHPAE-GCJKJVERSA-N 0 3 411.594 4.297 20 0 HIADHN CN(C)Cc1ccc(-c2noc([C@@H]3CCCN(C(=O)Nc4ccccc4)C3)n2)cc1 ZINC000531110405 930923003 /nfs/dbraw/zinc/92/30/03/930923003.db2.gz RRNGMOOFOOYFNZ-LJQANCHMSA-N 0 3 405.502 4.210 20 0 HIADHN COC(=O)c1cc2c(o1)c(OC)ccc2CNCc1ccc(-n2ccnc2C)c(F)c1 ZINC000531142342 930943646 /nfs/dbraw/zinc/94/36/46/930943646.db2.gz FWFUQBGMTMYTAI-UHFFFAOYSA-N 0 3 423.444 4.151 20 0 HIADHN CCN(CC)[C@@H](C(=O)NC[C@H](C)Cn1ccnc1C)c1cccc(C(F)(F)F)c1 ZINC000531285125 931001195 /nfs/dbraw/zinc/00/11/95/931001195.db2.gz DAWDGTZFCYYMCJ-HNAYVOBHSA-N 0 3 410.484 4.046 20 0 HIADHN Cc1cccc(NC(=O)C(=O)NC[C@H](c2ccccc2)N2CCC(C)CC2)c1Cl ZINC000531286799 931002256 /nfs/dbraw/zinc/00/22/56/931002256.db2.gz SNNRZHIMWXUAIJ-HXUWFJFHSA-N 0 3 413.949 4.176 20 0 HIADHN CCN1CCN(CCC(=O)Nc2ccc(Oc3cccc(C(F)(F)F)c3)cc2)CC1 ZINC000531299158 931006832 /nfs/dbraw/zinc/00/68/32/931006832.db2.gz RMUHIVVBUPEFDS-UHFFFAOYSA-N 0 3 421.463 4.464 20 0 HIADHN CN(C)Cc1ccc(-c2noc(-c3ccc(CNC(=O)c4cccs4)cc3)n2)cc1 ZINC000531348690 931026742 /nfs/dbraw/zinc/02/67/42/931026742.db2.gz YLCMUPNRTSEKCL-UHFFFAOYSA-N 0 3 418.522 4.457 20 0 HIADHN O=C(CN(Cc1ccccc1)Cc1ccccc1)NCc1nc2ccc(F)cc2[nH]1 ZINC000531370195 931033292 /nfs/dbraw/zinc/03/32/92/931033292.db2.gz XOAGWXUYVVYWKN-UHFFFAOYSA-N 0 3 402.473 4.021 20 0 HIADHN CN(Cc1cccc(O)c1)C[C@H](O)COC(c1ccc(F)cc1)c1ccc(F)cc1 ZINC000531378385 931037650 /nfs/dbraw/zinc/03/76/50/931037650.db2.gz IASVWNGFGPZCLZ-QHCPKHFHSA-N 0 3 413.464 4.269 20 0 HIADHN COC(=O)c1cc2c(o1)c(OC)ccc2CNCc1cc(Br)cs1 ZINC000531380542 931037737 /nfs/dbraw/zinc/03/77/37/931037737.db2.gz IAQDMOLRBKNXPC-UHFFFAOYSA-N 0 3 410.289 4.342 20 0 HIADHN CN(Cc1cccc(O)c1)C[C@@H](O)COC(c1ccc(F)cc1)c1ccc(F)cc1 ZINC000531378383 931037943 /nfs/dbraw/zinc/03/79/43/931037943.db2.gz IASVWNGFGPZCLZ-HSZRJFAPSA-N 0 3 413.464 4.269 20 0 HIADHN Cc1ccc(-c2n[nH]cc2C[NH2+]Cc2nnc(-c3ccc(Br)cc3)[n-]2)cc1 ZINC000531495377 931077391 /nfs/dbraw/zinc/07/73/91/931077391.db2.gz UVXPRIYHWNPVKQ-UHFFFAOYSA-N 0 3 423.318 4.223 20 0 HIADHN C[C@H](NC(=O)N(CCN(C)C)Cc1ccco1)c1ccc(OCc2cccnc2)cc1 ZINC000531522789 931091583 /nfs/dbraw/zinc/09/15/83/931091583.db2.gz XWLRGZPCDBPIAG-IBGZPJMESA-N 0 3 422.529 4.088 20 0 HIADHN Cc1ccc(-n2cc(CNCc3cccc(-n4cncn4)c3)c(C(C)(C)C)n2)cc1 ZINC000531581601 931109383 /nfs/dbraw/zinc/10/93/83/931109383.db2.gz AKVHCQUZUZDLEF-UHFFFAOYSA-N 0 3 400.530 4.349 20 0 HIADHN Cc1ccc(Oc2ccc(NC(=O)N3CC[C@H](N4CCN(C(C)C)CC4)C3)cc2)cc1 ZINC000531586736 931110402 /nfs/dbraw/zinc/11/04/02/931110402.db2.gz NRDJNGOBFSPIGX-QFIPXVFZSA-N 0 3 422.573 4.420 20 0 HIADHN CC(C)Sc1ccc([C@H](C)NC(=O)N2CC[C@H](N3CCN(C(C)C)CC3)C2)cc1 ZINC000531584356 931110542 /nfs/dbraw/zinc/11/05/42/931110542.db2.gz RVYCWQCLAOHJPX-FPOVZHCZSA-N 0 3 418.651 4.058 20 0 HIADHN CCc1cc(Br)ccc1NC(=O)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000531673773 931145935 /nfs/dbraw/zinc/14/59/35/931145935.db2.gz UGWIVJJPTIFXTO-QGZVFWFLSA-N 0 3 402.336 4.257 20 0 HIADHN CC[C@@H](C)NC(=O)c1cccc(CN[C@@H](C)c2ccc(OCc3nccn3C)cc2)c1 ZINC000531682132 931149686 /nfs/dbraw/zinc/14/96/86/931149686.db2.gz NLLILKOVBYWYSB-MOPGFXCFSA-N 0 3 420.557 4.378 20 0 HIADHN CC[C@@H](N[C@H](C)c1ccc2c(c1)OCCCO2)c1ccccc1OCC(=O)N(C)C ZINC000531701229 931163583 /nfs/dbraw/zinc/16/35/83/931163583.db2.gz ODVWZBSBLJEAKT-YLJYHZDGSA-N 0 3 412.530 4.117 20 0 HIADHN C[C@@H](N[C@H](CN1CCN(C)CC1)c1ccccc1)c1cc(Br)ccc1F ZINC000531703585 931165693 /nfs/dbraw/zinc/16/56/93/931165693.db2.gz MAVXPXVMJKIETJ-IIBYNOLFSA-N 0 3 420.370 4.228 20 0 HIADHN Cc1nc(-c2cccnc2)sc1[C@H](C)N[C@H](CN1CCN(C)CC1)c1ccccc1 ZINC000531703688 931166013 /nfs/dbraw/zinc/16/60/13/931166013.db2.gz WDPPJVWBMVZDMC-PGRDOPGGSA-N 0 3 421.614 4.153 20 0 HIADHN CC(C)c1nc2ccc(NC(=O)N3CC[C@H](N4CCN(C(C)C)CC4)C3)cc2s1 ZINC000531841088 931217336 /nfs/dbraw/zinc/21/73/36/931217336.db2.gz QVXURULQUMZCBZ-SFHVURJKSA-N 0 3 415.607 4.052 20 0 HIADHN c1cnn(-c2cccc(CNCc3cn(-c4ccccc4)nc3-c3ccncc3)c2)c1 ZINC000531856829 931222848 /nfs/dbraw/zinc/22/28/48/931222848.db2.gz FXUTVQROWCVZAL-UHFFFAOYSA-N 0 3 406.493 4.410 20 0 HIADHN COc1ccc(NC(=O)[C@@H](N[C@H](C)C2CCOCC2)c2ccccc2)cc1Cl ZINC000531883821 931234203 /nfs/dbraw/zinc/23/42/03/931234203.db2.gz KUQBZDZFAYREIP-VFNWGFHPSA-N 0 3 402.922 4.433 20 0 HIADHN O=C(CN(Cc1ccccc1)C1CCCCC1)NCc1cccc(C(=O)NC2CC2)c1 ZINC000531897458 931237389 /nfs/dbraw/zinc/23/73/89/931237389.db2.gz LRUCZPOMJDEPLT-UHFFFAOYSA-N 0 3 419.569 4.030 20 0 HIADHN C[C@@H](NC[C@H](c1cccs1)N1CCOCC1)c1sccc1Br ZINC000531931955 931250880 /nfs/dbraw/zinc/25/08/80/931250880.db2.gz XMSXZRWQPWVMPB-TZMCWYRMSA-N 0 3 401.395 4.296 20 0 HIADHN CCC(=O)Nc1cccc(CN[C@H](C)c2ccc(I)cc2)c1 ZINC000531936265 931252867 /nfs/dbraw/zinc/25/28/67/931252867.db2.gz HIZCFOLZYJZCCW-CYBMUJFWSA-N 0 3 408.283 4.491 20 0 HIADHN CCCOc1ccc([C@H](C)NCc2ccccc2CS(=O)(=O)NC(C)C)cc1 ZINC000531958555 931264296 /nfs/dbraw/zinc/26/42/96/931264296.db2.gz MFZMCAMVQWFCGW-SFHVURJKSA-N 0 3 404.576 4.154 20 0 HIADHN COc1ccc(OC)c(NC(=O)C[C@H](C)N[C@@H](c2ccc(F)cc2)[C@@H]2CCCO2)c1 ZINC000531962329 931266413 /nfs/dbraw/zinc/26/64/13/931266413.db2.gz DRVRLVIQOXTAGY-GNOCETLISA-N 0 3 416.493 4.070 20 0 HIADHN Cc1ccc(NC(=O)C[C@@H](C)NCc2ccnc(OC3CCOCC3)c2)cc1Cl ZINC000531973350 931271935 /nfs/dbraw/zinc/27/19/35/931271935.db2.gz APDYRDVRDSYUAH-MRXNPFEDSA-N 0 3 417.937 4.108 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3CCC[C@@H]3c3cccc(C)n3)c(C)c2)CC1 ZINC000531975562 931272447 /nfs/dbraw/zinc/27/24/47/931272447.db2.gz WBYXNNDOTJCLMF-HSZRJFAPSA-N 0 3 407.562 4.209 20 0 HIADHN COc1ccc([C@H](C)[C@@H](C)NCc2csc(CNC(=O)c3ccccc3)n2)cc1 ZINC000531977200 931273260 /nfs/dbraw/zinc/27/32/60/931273260.db2.gz OUSKPQLCXIWFNY-IAGOWNOFSA-N 0 3 409.555 4.364 20 0 HIADHN CC(=O)Nc1cccc(OCCNCc2cn(-c3ccccc3)nc2C(C)(C)C)c1 ZINC000532075246 931303785 /nfs/dbraw/zinc/30/37/85/931303785.db2.gz YNTMFVYHUBYSTM-UHFFFAOYSA-N 0 3 406.530 4.297 20 0 HIADHN CCOc1cccc([C@H](C)NCc2ccc(OCCN3CCOCC3)c(Cl)c2)c1 ZINC000532093902 931310024 /nfs/dbraw/zinc/31/00/24/931310024.db2.gz OXBRXNVASHWGHL-SFHVURJKSA-N 0 3 418.965 4.301 20 0 HIADHN COc1cccc(-c2nn(C(C)(C)C)cc2CNCc2cccc(-n3cncn3)c2)c1 ZINC000532104528 931313420 /nfs/dbraw/zinc/31/34/20/931313420.db2.gz REVFFPSLXWIGNJ-UHFFFAOYSA-N 0 3 416.529 4.184 20 0 HIADHN CCOc1cc(Br)ccc1NC(=O)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000532181646 931338534 /nfs/dbraw/zinc/33/85/34/931338534.db2.gz FBTNPYHGKSCNLF-MRXNPFEDSA-N 0 3 418.335 4.094 20 0 HIADHN C[C@@H](CCNCc1cc(Br)ccc1OCc1ccccc1)[S@@](C)=O ZINC000532207898 931350966 /nfs/dbraw/zinc/35/09/66/931350966.db2.gz PQXLYRXOGVBRSL-IZHWHUGBSA-N 0 3 410.377 4.275 20 0 HIADHN CC[C@H](N[C@@H](C)c1ccc(-n2ccnc2)cc1)c1ccccc1OCC(=O)N(C)C ZINC000532212148 931355136 /nfs/dbraw/zinc/35/51/36/931355136.db2.gz WHPYQXUMVDPYKC-AVRDEDQJSA-N 0 3 406.530 4.141 20 0 HIADHN CCN(CC)C(=O)Nc1ccc([C@H](C)N[C@H]2CCCN(c3ccccc3)C2=O)cc1 ZINC000532222580 931360942 /nfs/dbraw/zinc/36/09/42/931360942.db2.gz UNEUTXQYLUFJGR-AVRDEDQJSA-N 0 3 408.546 4.407 20 0 HIADHN O=C(NCc1cccc(COCc2ccco2)c1)N1CCN(C2CCCCC2)CC1 ZINC000532253362 931372585 /nfs/dbraw/zinc/37/25/85/931372585.db2.gz AMYBNIWIXGEKHH-UHFFFAOYSA-N 0 3 411.546 4.156 20 0 HIADHN COc1ccc(Br)c2[nH]c(C(=O)N3CCN(C4CCCCC4)CC3)cc21 ZINC000532272191 931378714 /nfs/dbraw/zinc/37/87/14/931378714.db2.gz JNWKCNBRWFMCDN-UHFFFAOYSA-N 0 3 420.351 4.030 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N[C@@H](C)Cc3nc4ccccc4s3)cc2)CC1 ZINC000532314436 931395391 /nfs/dbraw/zinc/39/53/91/931395391.db2.gz HDJRYBQKSKBCSI-SFHVURJKSA-N 0 3 422.598 4.188 20 0 HIADHN FC(F)(F)c1cnc(N2CC[C@@H](NCc3cnn(-c4ccccc4)c3)C2)c(Cl)c1 ZINC000532322152 931396954 /nfs/dbraw/zinc/39/69/54/931396954.db2.gz JQIAVOUBPYLPLJ-MRXNPFEDSA-N 0 3 421.854 4.308 20 0 HIADHN CC(C)N1CCN([C@H]2CCN(C(=O)c3ccc4c(c3)C(C)(C)CCC4(C)C)C2)CC1 ZINC000532342549 931401597 /nfs/dbraw/zinc/40/15/97/931401597.db2.gz QVBMZVONVVAPRD-NRFANRHFSA-N 0 3 411.634 4.276 20 0 HIADHN C[C@@H](O)C[C@@H](CNCc1nc(-c2ccc(Br)cc2)c[nH]1)c1ccccc1 ZINC000532346428 931403316 /nfs/dbraw/zinc/40/33/16/931403316.db2.gz JQRCISPAMOIAIV-QAPCUYQASA-N 0 3 414.347 4.484 20 0 HIADHN O=C(Nc1ccc(F)cc1)c1ccc(CNCc2ccc(-n3cncn3)c(F)c2)cc1 ZINC000532373936 931414285 /nfs/dbraw/zinc/41/42/85/931414285.db2.gz HHEAJKKFWBROTH-UHFFFAOYSA-N 0 3 419.435 4.088 20 0 HIADHN Cn1c(CNCCc2nc(-c3ccncc3)cs2)nc2cc(C(F)(F)F)ccc21 ZINC000532376018 931415165 /nfs/dbraw/zinc/41/51/65/931415165.db2.gz PKRMQSJHMWLROE-UHFFFAOYSA-N 0 3 417.460 4.443 20 0 HIADHN O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)N1CCC(Nc2ccc(F)cc2)CC1 ZINC000532444906 931437643 /nfs/dbraw/zinc/43/76/43/931437643.db2.gz VFFQFJVQOVXVFK-HSZRJFAPSA-N 0 3 410.537 4.076 20 0 HIADHN CN1CCN(c2ccc(CN[C@H](Cc3cccc(F)c3)c3cccc(F)c3)cn2)CC1 ZINC000532452114 931440362 /nfs/dbraw/zinc/44/03/62/931440362.db2.gz SIQVGCVPCMWJHA-XMMPIXPASA-N 0 3 422.523 4.185 20 0 HIADHN Cc1ccc(CNC(=O)c2cccc(CN[C@@H](C)CC(=O)N3CCCCCC3)c2)cc1 ZINC000532459499 931444685 /nfs/dbraw/zinc/44/46/85/931444685.db2.gz XSADPSLFSMUUPR-NRFANRHFSA-N 0 3 421.585 4.196 20 0 HIADHN C[C@@H](NCc1ccc(Cn2cnc3ccccc32)cc1)c1ccc(S(C)(=O)=O)cc1 ZINC000532464548 931446773 /nfs/dbraw/zinc/44/67/73/931446773.db2.gz FMWAUNDXAXZVBM-GOSISDBHSA-N 0 3 419.550 4.339 20 0 HIADHN C[C@H](N[C@H](Cc1ccccc1)C(=O)N1CCCC1)c1ccc(Br)cc1 ZINC000532494869 931461123 /nfs/dbraw/zinc/46/11/23/931461123.db2.gz TXHVBYVFVWETQQ-OXJNMPFZSA-N 0 3 401.348 4.333 20 0 HIADHN C[C@H](N[C@H](CN1CCN(C)CC1)c1ccccc1)c1ccc(F)cc1OC(F)F ZINC000532497426 931462337 /nfs/dbraw/zinc/46/23/37/931462337.db2.gz XEHPVDUJZLNLKY-OXJNMPFZSA-N 0 3 407.480 4.066 20 0 HIADHN C[C@@H](N[C@H](CN1CCN(C)CC1)c1ccccc1)c1ccccc1OC(F)(F)F ZINC000532497773 931462932 /nfs/dbraw/zinc/46/29/32/931462932.db2.gz OHXUJWUQSJOONX-YLJYHZDGSA-N 0 3 407.480 4.225 20 0 HIADHN C[C@H](N[C@@H](CN1CCN(C)CC1)c1ccccc1)c1ccccc1OC(F)(F)F ZINC000532497771 931463143 /nfs/dbraw/zinc/46/31/43/931463143.db2.gz OHXUJWUQSJOONX-PXNSSMCTSA-N 0 3 407.480 4.225 20 0 HIADHN Cc1cc(NC(=O)N[C@@H](C)Cc2ccsc2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000532507758 931467650 /nfs/dbraw/zinc/46/76/50/931467650.db2.gz NKIODVNOFXZTPE-LAUBAEHRSA-N 0 3 423.586 4.453 20 0 HIADHN CCN1CCCN([C@@H](C(=O)Nc2ccc(OC)c(Cl)c2)c2ccccc2)CC1 ZINC000532520707 931472109 /nfs/dbraw/zinc/47/21/09/931472109.db2.gz IADQFYHQLKVDRA-OAQYLSRUSA-N 0 3 401.938 4.056 20 0 HIADHN CO[C@H](C)CN(CC(=O)NC[C@@H](c1c[nH]c2ccccc21)c1ccccc1)C(C)C ZINC000532586881 931544036 /nfs/dbraw/zinc/54/40/36/931544036.db2.gz UBFPJUDYHWAAJW-DENIHFKCSA-N 0 3 407.558 4.161 20 0 HIADHN Cn1ccnc1COc1ccc(CN2CC[C@@H](OCCCc3ccccc3)C2)cc1 ZINC000532651242 931569089 /nfs/dbraw/zinc/56/90/89/931569089.db2.gz JYWCGRHCLKDRGZ-XMMPIXPASA-N 0 3 405.542 4.223 20 0 HIADHN CCc1ccccc1NC(=O)CN(C)C(=O)[C@@H](C)N[C@@H](c1ccccc1)C1CCC1 ZINC000532686187 931583980 /nfs/dbraw/zinc/58/39/80/931583980.db2.gz DCKGFMQOOBQKDK-KOSHJBKYSA-N 0 3 407.558 4.165 20 0 HIADHN CCc1ccccc1NC(=O)CN(C)C(=O)[C@H](C)N[C@H](c1ccccc1)C1CCC1 ZINC000532686189 931584221 /nfs/dbraw/zinc/58/42/21/931584221.db2.gz DCKGFMQOOBQKDK-MHECFPHRSA-N 0 3 407.558 4.165 20 0 HIADHN COc1ccc([C@@H](NCCOC[C@H]2CCCO2)c2ccccc2)cc1Br ZINC000532697657 931592058 /nfs/dbraw/zinc/59/20/58/931592058.db2.gz LIWMOTFQERPJSI-NQIIRXRSSA-N 0 3 420.347 4.332 20 0 HIADHN CCCOc1ccc(CNC(=O)CNC2(c3ccc(Cl)cc3)CCOCC2)cc1 ZINC000532714354 931604605 /nfs/dbraw/zinc/60/46/05/931604605.db2.gz FPLDQORXVZMIMA-UHFFFAOYSA-N 0 3 416.949 4.041 20 0 HIADHN CCCN1CCN(c2ccccc2CNc2ccc(NC(C)=O)c(Cl)c2)CC1 ZINC000532730818 931615024 /nfs/dbraw/zinc/61/50/24/931615024.db2.gz JAKCKHPWJJIEJZ-UHFFFAOYSA-N 0 3 400.954 4.443 20 0 HIADHN CC(C)N(CC(=O)Nc1cc(-c2ccccc2)nn1-c1ccccc1)C1CCOCC1 ZINC000532733407 931616174 /nfs/dbraw/zinc/61/61/74/931616174.db2.gz AOUTXROSDANURF-UHFFFAOYSA-N 0 3 418.541 4.367 20 0 HIADHN O=C1c2ccccc2C(=O)N1[C@@H]1CCCC[C@@H](NCc2coc(-c3cccs3)n2)C1 ZINC000532765446 931626971 /nfs/dbraw/zinc/62/69/71/931626971.db2.gz XOWXUKKOLQYOJQ-NVXWUHKLSA-N 0 3 421.522 4.490 20 0 HIADHN COc1cccc([C@@H](CNC(=O)Nc2cccc(-c3ncco3)c2)N2CCCC2)c1 ZINC000532811747 931636059 /nfs/dbraw/zinc/63/60/59/931636059.db2.gz IPYCGHAADKWZNX-OAQYLSRUSA-N 0 3 406.486 4.309 20 0 HIADHN COc1cc(Br)c(CNCCCc2nc3ccccc3n2C)c(OC)c1 ZINC000532866275 931672336 /nfs/dbraw/zinc/67/23/36/931672336.db2.gz GYJVRBAXCHFCLF-UHFFFAOYSA-N 0 3 418.335 4.075 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc(CNCc2cccc(-c3cccnc3)c2)cc1 ZINC000532870609 931674185 /nfs/dbraw/zinc/67/41/85/931674185.db2.gz MJEISGLXRLAQFR-UHFFFAOYSA-N 0 3 409.555 4.069 20 0 HIADHN OC[C@H](CNCc1cc(O)ccc1Br)Cc1ccccc1C(F)(F)F ZINC000532880004 931677104 /nfs/dbraw/zinc/67/71/04/931677104.db2.gz FZZRLASJRSDWJI-LBPRGKRZSA-N 0 3 418.253 4.114 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1ccc(N(C)C)c(F)c1 ZINC000532910902 931688877 /nfs/dbraw/zinc/68/88/77/931688877.db2.gz ZECMSRHMOXAFAM-HXUWFJFHSA-N 0 3 421.520 4.096 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)c1cnc2ccsc2c1 ZINC000532938574 931704570 /nfs/dbraw/zinc/70/45/70/931704570.db2.gz YRBREVUWABUONA-GOSISDBHSA-N 0 3 403.511 4.192 20 0 HIADHN COc1ccc(NC(=O)[C@H](C)N(C)CCCc2cc(-c3cccc(F)c3)n[nH]2)cc1 ZINC000532959184 931712373 /nfs/dbraw/zinc/71/23/73/931712373.db2.gz OPSOJSJXKAEIQT-INIZCTEOSA-N 0 3 410.493 4.116 20 0 HIADHN CSc1ccccc1NC(=O)CCN1CCC[C@@H](C(=O)c2ccc(F)cc2)C1 ZINC000532970270 931720290 /nfs/dbraw/zinc/72/02/90/931720290.db2.gz FTSSDZIWONSJIC-QGZVFWFLSA-N 0 3 400.519 4.471 20 0 HIADHN C[C@@H]1CN(C(=O)c2ccc(CNCc3cccc(-c4ccccn4)c3)cc2)C[C@H](C)O1 ZINC000533038827 931748392 /nfs/dbraw/zinc/74/83/92/931748392.db2.gz UYPCHAMJZYYCAZ-BGYRXZFFSA-N 0 3 415.537 4.288 20 0 HIADHN COc1ccc(OCc2ccccn2)c(CNCCc2nnc(-c3ccccc3)o2)c1 ZINC000533039360 931748599 /nfs/dbraw/zinc/74/85/99/931748599.db2.gz QDUDWAVGSHNDDB-UHFFFAOYSA-N 0 3 416.481 4.052 20 0 HIADHN CC(C)CNC(=O)c1cccc(CN2CCC(c3nc(-c4ccccc4)n[nH]3)CC2)c1 ZINC000533047805 931752668 /nfs/dbraw/zinc/75/26/68/931752668.db2.gz QPHCZRVYCXQLJW-UHFFFAOYSA-N 0 3 417.557 4.237 20 0 HIADHN O=C(CNC1(c2ccc(F)cc2)CCCC1)N1CCC(OCc2ccccc2)CC1 ZINC000533052394 931754535 /nfs/dbraw/zinc/75/45/35/931754535.db2.gz PCVOJZPEWBBAGO-UHFFFAOYSA-N 0 3 410.533 4.392 20 0 HIADHN C[C@@H](N[C@@H](c1ccc(F)cc1)C1CCC1)C(=O)Nc1ccc(N2CCCC2=O)cc1 ZINC000533054877 931755741 /nfs/dbraw/zinc/75/57/41/931755741.db2.gz YDYUVASEXNJOMX-WAIKUNEKSA-N 0 3 409.505 4.411 20 0 HIADHN Brc1ccc(-c2c[nH]c(CN[C@H]3CCOC4(CCSCC4)C3)n2)cc1 ZINC000533226750 931814625 /nfs/dbraw/zinc/81/46/25/931814625.db2.gz YGLZCZCXMXBFNZ-INIZCTEOSA-N 0 3 422.392 4.374 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)CO[C@H]1CCC[C@H](C)C1 ZINC000533231108 931814905 /nfs/dbraw/zinc/81/49/05/931814905.db2.gz DFKXDNPKXAFCDF-BWAGFHJFSA-N 0 3 410.562 4.172 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)CO[C@@H]1CCC[C@@H](C)C1 ZINC000533231110 931815049 /nfs/dbraw/zinc/81/50/49/931815049.db2.gz DFKXDNPKXAFCDF-STZQEDGTSA-N 0 3 410.562 4.172 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)COc1cc(C)cc(C)c1 ZINC000533232603 931815415 /nfs/dbraw/zinc/81/54/15/931815415.db2.gz DBQWPBQAOLVCSI-QFIPXVFZSA-N 0 3 418.541 4.273 20 0 HIADHN CCN(CC(=O)N[C@@H](c1nccs1)c1ccccc1)[C@@H](C)Cc1ccc(OC)cc1 ZINC000533282439 931827438 /nfs/dbraw/zinc/82/74/38/931827438.db2.gz UMUWLYDTZGBYPN-FDDCHVKYSA-N 0 3 423.582 4.310 20 0 HIADHN CCCN(CC(=O)Nc1ccc(Br)cc1C)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000533293659 931830939 /nfs/dbraw/zinc/83/09/39/931830939.db2.gz YYLJNWROPWKCRI-LZQZEXGQSA-N 0 3 409.368 4.222 20 0 HIADHN CCCN(CC(=O)Nc1ccc(OC(F)(F)F)cc1)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000533292437 931830982 /nfs/dbraw/zinc/83/09/82/931830982.db2.gz KOTDVOUGMGQVQL-CGTJXYLNSA-N 0 3 400.441 4.049 20 0 HIADHN CCCN(CC(=O)Nc1cc(C2CC2)nn1-c1ccccc1)[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC000533294041 931831630 /nfs/dbraw/zinc/83/16/30/931831630.db2.gz GDTNSFXAJUFKDS-IEXUWNMDSA-N 0 3 422.573 4.214 20 0 HIADHN CCCN(CC(=O)Nc1cc(C2CC2)nn1-c1ccccc1)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000533294040 931831800 /nfs/dbraw/zinc/83/18/00/931831800.db2.gz GDTNSFXAJUFKDS-FOVJLYNBSA-N 0 3 422.573 4.214 20 0 HIADHN COc1cc(Cl)c(C)cc1NC(=O)[C@@H](C)N1CCN(C2CCC(C)CC2)CC1 ZINC000533298138 931832093 /nfs/dbraw/zinc/83/20/93/931832093.db2.gz HUPWYWQWVCSLCD-IIIMJFFVSA-N 0 3 407.986 4.180 20 0 HIADHN O[C@@H](COc1cccc2[nH]ccc21)CN1CCC[C@@H](c2nc3ccccc3s2)C1 ZINC000533334971 931840954 /nfs/dbraw/zinc/84/09/54/931840954.db2.gz ZEVAGKMMLDTYFJ-IAGOWNOFSA-N 0 3 407.539 4.397 20 0 HIADHN O=S(=O)(c1ccc(CNCc2cccc(-c3ccccn3)c2)cc1)N1CCCCC1 ZINC000533361408 931848354 /nfs/dbraw/zinc/84/83/54/931848354.db2.gz KBJIJMVQGDNQEE-UHFFFAOYSA-N 0 3 421.566 4.213 20 0 HIADHN O=C(Nc1ccc(F)cc1)C1CCN(C[C@H](O)COc2ccc3ccccc3c2)CC1 ZINC000533364621 931848967 /nfs/dbraw/zinc/84/89/67/931848967.db2.gz TZICPLZAOPPHHO-QHCPKHFHSA-N 0 3 422.500 4.069 20 0 HIADHN O=C(CNC1(c2ccc(F)cc2)CCCC1)Nc1cc(Cl)ccc1-n1cncn1 ZINC000533373966 931852152 /nfs/dbraw/zinc/85/21/52/931852152.db2.gz NKGJILZTUXBJLH-UHFFFAOYSA-N 0 3 413.884 4.057 20 0 HIADHN O=C(CN[C@@H](c1ccccc1)C1CCCC1)NCc1ccc(C(=O)N2CCCC2)cc1 ZINC000533384052 931854477 /nfs/dbraw/zinc/85/44/77/931854477.db2.gz CLMXLSFKAUYYPC-VWLOTQADSA-N 0 3 419.569 4.060 20 0 HIADHN CCCN(CC(=O)Nc1ccc(NC(C)=O)cc1)[C@H]1C[C@H](OCC)C12CCCC2 ZINC000533428850 931865578 /nfs/dbraw/zinc/86/55/78/931865578.db2.gz FGSMCWPLBWSSQS-SFTDATJTSA-N 0 3 401.551 4.033 20 0 HIADHN CN(CCCC(c1ccc(F)cc1)c1ccc(F)cc1)C[C@H]1CCS(=O)(=O)C1 ZINC000533429142 931865804 /nfs/dbraw/zinc/86/58/04/931865804.db2.gz NZSSSNFXIGMKSB-QGZVFWFLSA-N 0 3 407.526 4.243 20 0 HIADHN CCN(CC)C(=O)c1cccc(NC(=O)CNC2(c3ccc(F)cc3)CCCC2)c1 ZINC000533510371 931889482 /nfs/dbraw/zinc/88/94/82/931889482.db2.gz LZQALLIVOOVOAS-UHFFFAOYSA-N 0 3 411.521 4.305 20 0 HIADHN CCCN(Cc1csc(-c2ccccn2)n1)C1CCN(c2cc(C)nc(C)n2)CC1 ZINC000533519600 931892576 /nfs/dbraw/zinc/89/25/76/931892576.db2.gz IXVHJWDRCRKZHB-UHFFFAOYSA-N 0 3 422.602 4.493 20 0 HIADHN CC(C)N1CCN([C@@H]2CCN([C@H](C)c3ncc(-c4ccc(Cl)cc4)o3)C2)CC1 ZINC000533559064 931899808 /nfs/dbraw/zinc/89/98/08/931899808.db2.gz PFZHVLLQFPWKKK-YLJYHZDGSA-N 0 3 402.970 4.156 20 0 HIADHN CN1CCN(c2ccc(CNCc3ccc(Sc4ccccc4)cc3)cn2)CC1 ZINC000533609706 931923361 /nfs/dbraw/zinc/92/33/61/931923361.db2.gz NXBSSADOPAJPFT-UHFFFAOYSA-N 0 3 404.583 4.274 20 0 HIADHN COc1ccc(C(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)cc1-c1ccccn1 ZINC000533651243 931946724 /nfs/dbraw/zinc/94/67/24/931946724.db2.gz TZVXUAFQDXSGKV-NRFANRHFSA-N 0 3 401.510 4.104 20 0 HIADHN CC[C@H](CNC(=O)c1ccc(OC)c(-c2ccccn2)c1)N1CCc2ccccc2C1 ZINC000533653349 931948422 /nfs/dbraw/zinc/94/84/22/931948422.db2.gz YYIXBGPTNAYQOD-JOCHJYFZSA-N 0 3 415.537 4.324 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3ccc(C)cc3Br)c(C)c2)CC1 ZINC000533652824 931948523 /nfs/dbraw/zinc/94/85/23/931948523.db2.gz BKSKWNSPMPWBRB-UHFFFAOYSA-N 0 3 416.363 4.460 20 0 HIADHN C[C@H]1C[C@H](N(C)S(=O)(=O)Cc2ccc(F)c(Cl)c2)CCN1Cc1ccccc1 ZINC000533697617 931975568 /nfs/dbraw/zinc/97/55/68/931975568.db2.gz SCXVTFUDKOBNOE-QFBILLFUSA-N 0 3 424.969 4.294 20 0 HIADHN Cc1cc(C)cc(CNCc2ccccc2CS(=O)(=O)N2CCC(C)CC2)c1 ZINC000533752758 932009698 /nfs/dbraw/zinc/00/96/98/932009698.db2.gz DPPRLSJRUUJGLJ-UHFFFAOYSA-N 0 3 400.588 4.155 20 0 HIADHN COC(=O)CCSc1cccc(NC(=O)N2CCN(C3CCC(C)CC3)CC2)c1 ZINC000533772366 932025242 /nfs/dbraw/zinc/02/52/42/932025242.db2.gz QXWQNKMAVXHNNN-UHFFFAOYSA-N 0 3 419.591 4.070 20 0 HIADHN COc1cccc(COc2cccc(NC(=O)N3CC[C@@H](N4CC=CC4)C3)c2C)c1 ZINC000533773601 932026814 /nfs/dbraw/zinc/02/68/14/932026814.db2.gz MSXGEUBODYGZGV-HXUWFJFHSA-N 0 3 407.514 4.061 20 0 HIADHN CCSc1ccc([C@H](C)NCc2ccccc2OCCN2CCOCC2)cc1 ZINC000533785636 932032654 /nfs/dbraw/zinc/03/26/54/932032654.db2.gz JOYPXJYIPJGBAJ-IBGZPJMESA-N 0 3 400.588 4.360 20 0 HIADHN O=C(Nc1ccccc1O)C1CCN(Cc2ccc(OCc3ccncc3)cc2)CC1 ZINC000533925776 932104338 /nfs/dbraw/zinc/10/43/38/932104338.db2.gz AYHSRUZGWPVOLR-UHFFFAOYSA-N 0 3 417.509 4.217 20 0 HIADHN CN(Cc1ccccc1Br)C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000533947324 932122324 /nfs/dbraw/zinc/12/23/24/932122324.db2.gz UEKMGNDGCKEEOH-RTBURBONSA-N 0 3 402.336 4.036 20 0 HIADHN CCn1c(SCC(=O)Nc2cc(C)cc(CN(C)C)c2)nnc1-c1cccs1 ZINC000533968849 932145645 /nfs/dbraw/zinc/14/56/45/932145645.db2.gz HDYRQPRGFFNPTG-UHFFFAOYSA-N 0 3 415.588 4.127 20 0 HIADHN C[C@@H](C(=O)NCc1ccccc1-c1cnn(C)c1)N1CCC(Cc2ccccc2)CC1 ZINC000534007520 932190411 /nfs/dbraw/zinc/19/04/11/932190411.db2.gz DPVBPCCPNIRXFI-FQEVSTJZSA-N 0 3 416.569 4.047 20 0 HIADHN CN1CC[C@@H](NC(=O)Cc2ccc(NC(=O)CC(C)(C)C)cc2)[C@H]1c1ccccc1 ZINC000534021190 932201942 /nfs/dbraw/zinc/20/19/42/932201942.db2.gz WLBYSMVSOZCVEF-ZJSXRUAMSA-N 0 3 407.558 4.165 20 0 HIADHN CC(C)c1cc(C(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)c2cnn(C(C)C)c2n1 ZINC000534020736 932202668 /nfs/dbraw/zinc/20/26/68/932202668.db2.gz VRPOQVGCODIDGD-IRLDBZIGSA-N 0 3 405.546 4.311 20 0 HIADHN COC(=O)[C@@H]1CCCC[C@]1(C)NCC(=O)Nc1ccc(Cl)cc1C(F)(F)F ZINC000534022484 932203272 /nfs/dbraw/zinc/20/32/72/932203272.db2.gz AASVRONOZMCLAI-SJCJKPOMSA-N 0 3 406.832 4.009 20 0 HIADHN COC(=O)[C@H]1CCCC[C@]1(C)NCC(=O)Nc1ccc(Cl)cc1C(F)(F)F ZINC000534022483 932203328 /nfs/dbraw/zinc/20/33/28/932203328.db2.gz AASVRONOZMCLAI-PXAZEXFGSA-N 0 3 406.832 4.009 20 0 HIADHN CC(C)Cn1ncc(NC(=O)NC[C@@H](c2ccccc2)N2CCCC2)c1C(F)F ZINC000534090715 932271894 /nfs/dbraw/zinc/27/18/94/932271894.db2.gz WXFIWYXWTIAKTB-SFHVURJKSA-N 0 3 405.493 4.435 20 0 HIADHN CN1CC[C@@H](NC(=O)CCc2ncc(-c3ccc(Cl)cc3)o2)[C@@H]1c1ccccc1 ZINC000534107889 932282825 /nfs/dbraw/zinc/28/28/25/932282825.db2.gz YFCHQPSEOCSEGJ-XXBNENTESA-N 0 3 409.917 4.489 20 0 HIADHN Cc1ccc2[nH]c([C@@H]3CCCN([C@@H](C)C(=O)N4CCc5sccc5C4)C3)nc2c1 ZINC000534216252 932337672 /nfs/dbraw/zinc/33/76/72/932337672.db2.gz JYFRFOJGIRLEMV-FUHWJXTLSA-N 0 3 408.571 4.086 20 0 HIADHN Cc1ccc2nc([C@@H]3CCCN([C@@H](C)C(=O)N4CCc5sccc5C4)C3)[nH]c2c1 ZINC000534216252 932337681 /nfs/dbraw/zinc/33/76/81/932337681.db2.gz JYFRFOJGIRLEMV-FUHWJXTLSA-N 0 3 408.571 4.086 20 0 HIADHN CCNC(=O)COc1ccc(CN[C@H]2CCCc3ccc(Cl)cc32)cc1OC ZINC000534237021 932357541 /nfs/dbraw/zinc/35/75/41/932357541.db2.gz HKPBPHWQZZYJGS-IBGZPJMESA-N 0 3 402.922 4.031 20 0 HIADHN COc1ccc(C)cc1NC(=O)[C@@H](c1ccccc1)N1CC[C@@H](C2CCOCC2)C1 ZINC000534381743 932408523 /nfs/dbraw/zinc/40/85/23/932408523.db2.gz CWDJUYLVAKQJAS-ZJSXRUAMSA-N 0 3 408.542 4.432 20 0 HIADHN COc1ccc(C(=O)NC2CCN([C@@H](C)c3ccncc3)CC2)cc1-c1ccccn1 ZINC000534396270 932422095 /nfs/dbraw/zinc/42/20/95/932422095.db2.gz CFQJNZOJLGIYLT-SFHVURJKSA-N 0 3 416.525 4.108 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)c1cc(Br)cc(C(F)(F)F)c1 ZINC000534413512 932434437 /nfs/dbraw/zinc/43/44/37/932434437.db2.gz IROLQEULSOPNIS-UHFFFAOYSA-N 0 3 419.241 4.265 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccc(F)c2)C1)N1CCC[C@H]1Cn1cnc2ccccc21 ZINC000534458591 932475388 /nfs/dbraw/zinc/47/53/88/932475388.db2.gz AQOCWRSRQMBOND-IRLDBZIGSA-N 0 3 420.532 4.079 20 0 HIADHN CN1CC[C@H](NC(=O)NCc2ccc(COCC(F)(F)F)cc2)[C@@H]1c1ccccc1 ZINC000534610358 932594094 /nfs/dbraw/zinc/59/40/94/932594094.db2.gz RHAUKHOAUKZEEW-PMACEKPBSA-N 0 3 421.463 4.010 20 0 HIADHN Cc1ccc(C[C@H](NC(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)c2ccccn2)cc1 ZINC000534684692 932654864 /nfs/dbraw/zinc/65/48/64/932654864.db2.gz GERQXNYJFGRQDV-DSNGMDLFSA-N 0 3 414.553 4.418 20 0 HIADHN CCn1c(SCC(=O)Nc2cc(C)cc(CN(C)C)c2)nnc1-c1cccc(C)c1 ZINC000534705059 932676687 /nfs/dbraw/zinc/67/66/87/932676687.db2.gz HSJZTZOYOJOGKV-UHFFFAOYSA-N 0 3 423.586 4.374 20 0 HIADHN C[C@H](Cc1c(Cl)cccc1Cl)NC(=O)N(CCN(C)C)Cc1ccccn1 ZINC000534707397 932678085 /nfs/dbraw/zinc/67/80/85/932678085.db2.gz XYERLNIYJWPBFT-OAHLLOKOSA-N 0 3 409.361 4.093 20 0 HIADHN CN1CC[C@H](NC(=O)NC2(c3cccc(Br)c3)CC2)[C@H]1c1ccccc1 ZINC000534724184 932692756 /nfs/dbraw/zinc/69/27/56/932692756.db2.gz SIBBIWSVVDYAIK-RBUKOAKNSA-N 0 3 414.347 4.183 20 0 HIADHN COc1ccc(C[C@@H](C)C(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000534729696 932698477 /nfs/dbraw/zinc/69/84/77/932698477.db2.gz YSNSWXAGDZDYMV-DENIHFKCSA-N 0 3 418.541 4.156 20 0 HIADHN CN(C(=O)c1cc(Br)cc2cccnc21)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000534788119 932770123 /nfs/dbraw/zinc/77/01/23/932770123.db2.gz SRTZMQFOAXRYRA-LJQANCHMSA-N 0 3 424.342 4.344 20 0 HIADHN Fc1ccc(Br)c2c1CC[C@H]2NC1CCN(Cc2ccncc2)CC1 ZINC000534794150 932774959 /nfs/dbraw/zinc/77/49/59/932774959.db2.gz WWEXLFZVGGACPI-LJQANCHMSA-N 0 3 404.327 4.225 20 0 HIADHN C[C@@H](CCc1ccc(O)cc1)NC(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000534927949 932842605 /nfs/dbraw/zinc/84/26/05/932842605.db2.gz VQSDHSVADNUSKX-JTSKRJEESA-N 0 3 420.475 4.284 20 0 HIADHN COc1ccc2[nH]cc(Cc3noc(-c4ccc(CN5CCSCC5)cc4)n3)c2c1 ZINC000534971603 932869222 /nfs/dbraw/zinc/86/92/22/932869222.db2.gz PDTBBOVRJYCAGH-UHFFFAOYSA-N 0 3 420.538 4.366 20 0 HIADHN CN(C)Cc1ccc(CNCc2cn(-c3ccccc3)nc2-c2cccnc2)cc1F ZINC000534970514 932869309 /nfs/dbraw/zinc/86/93/09/932869309.db2.gz DUDCHQPRPCPNMD-UHFFFAOYSA-N 0 3 415.516 4.425 20 0 HIADHN CN1CC[C@@H](CNCc2nccn2CC(F)(F)F)[C@H]1c1ccc(Cl)c(F)c1 ZINC000534970660 932869326 /nfs/dbraw/zinc/86/93/26/932869326.db2.gz GSUGWGDBZKXHSQ-SUMWQHHRSA-N 0 3 404.839 4.021 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@@H]1C[C@@H](C)O[C@@H](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000535061886 932895757 /nfs/dbraw/zinc/89/57/57/932895757.db2.gz SYPGNVGLPRUPMJ-WTLGNFPFSA-N 0 3 415.500 4.344 20 0 HIADHN CC(C)Cn1ncc(C(=O)NC[C@@H](C(C)C)N2CCc3ccccc3C2)c1C(F)F ZINC000535329157 933076407 /nfs/dbraw/zinc/07/64/07/933076407.db2.gz GNDNDMCXSVVJPM-FQEVSTJZSA-N 0 3 418.532 4.289 20 0 HIADHN CN1CC[C@H](NC(=O)NCc2ccc(Oc3cccc(F)c3)nc2)[C@H]1c1ccccc1 ZINC000535338655 933081504 /nfs/dbraw/zinc/08/15/04/933081504.db2.gz BEFNNKUGWOXHFA-JTHBVZDNSA-N 0 3 420.488 4.258 20 0 HIADHN Cc1cc(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)ccc1NC(=O)c1cccs1 ZINC000535372239 933098698 /nfs/dbraw/zinc/09/86/98/933098698.db2.gz FTSGMXWSDDHIPI-HXUWFJFHSA-N 0 3 419.550 4.313 20 0 HIADHN CC(C)Cn1ncc(C(=O)NC[C@H]2CCCN(C)[C@@H]2c2cccs2)c1C(F)F ZINC000535388209 933108718 /nfs/dbraw/zinc/10/87/18/933108718.db2.gz LLOKFOKFECLTIH-PBHICJAKSA-N 0 3 410.534 4.351 20 0 HIADHN C[C@@H]1CCN(C(=O)[C@@H](OC2CCOCC2)c2ccccc2)CCN1Cc1ccccc1 ZINC000535405674 933120275 /nfs/dbraw/zinc/12/02/75/933120275.db2.gz DWEKUCPCQTVTFM-BWKNWUBXSA-N 0 3 422.569 4.046 20 0 HIADHN Cc1ccc(I)c(C(=O)Nc2cc(C)cc(CN(C)C)c2)c1 ZINC000535414738 933124300 /nfs/dbraw/zinc/12/43/00/933124300.db2.gz CNVMVRSHMQUJAL-UHFFFAOYSA-N 0 3 408.283 4.222 20 0 HIADHN Cc1ccc(-c2ncco2)cc1NC(=O)c1ccc(N2CCN(C(C)C)CC2)cc1 ZINC000535465104 933155269 /nfs/dbraw/zinc/15/52/69/933155269.db2.gz WTZTXUVRZRMKBN-UHFFFAOYSA-N 0 3 404.514 4.433 20 0 HIADHN COc1cc(CN(C[C@@H](O)COc2c(Cl)cccc2Cl)C2CC2)ccc1O ZINC000535578506 933252208 /nfs/dbraw/zinc/25/22/08/933252208.db2.gz FQQKDXQFTMEKGO-OAHLLOKOSA-N 0 3 412.313 4.112 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3CCc4ccc(Cl)cc4C3)c(C)c2)CC1 ZINC000535612207 933267658 /nfs/dbraw/zinc/26/76/58/933267658.db2.gz QGVOYTIPRMTOKL-UHFFFAOYSA-N 0 3 412.965 4.381 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)c1cccc([C@@H]2CCOC2)c1 ZINC000535619795 933271357 /nfs/dbraw/zinc/27/13/57/933271357.db2.gz GGSGXCVSDDUXEM-HXUWFJFHSA-N 0 3 420.475 4.413 20 0 HIADHN CN(C)CCN(Cc1cccc(O)c1)C(=O)c1ccc(Cl)c(C(F)(F)F)c1 ZINC000535639028 933280249 /nfs/dbraw/zinc/28/02/49/933280249.db2.gz BVUUMPCGAZYTAO-UHFFFAOYSA-N 0 3 400.828 4.268 20 0 HIADHN COc1cc(CN(C)Cc2ccc(OCc3noc(C)n3)cc2)ccc1OC(F)F ZINC000535780287 933385136 /nfs/dbraw/zinc/38/51/36/933385136.db2.gz SYCSGTTVKZWOGT-UHFFFAOYSA-N 0 3 419.428 4.199 20 0 HIADHN CC[C@@H](c1ccncc1)N(C)C[C@@H](O)COc1ccc(Cl)cc1Br ZINC000535788681 933387944 /nfs/dbraw/zinc/38/79/44/933387944.db2.gz AFUMJHZLBFZLEU-WBVHZDCISA-N 0 3 413.743 4.320 20 0 HIADHN COc1ccccc1NC(=O)C1CCN(Cc2cccc(OCC(F)(F)F)c2)CC1 ZINC000535786473 933387981 /nfs/dbraw/zinc/38/79/81/933387981.db2.gz CAWIGVWXSQOAOZ-UHFFFAOYSA-N 0 3 422.447 4.487 20 0 HIADHN COc1cc(CN2CCC[C@H](c3nc4ccc(F)cc4o3)C2)cc(OC)c1OC ZINC000535809340 933404290 /nfs/dbraw/zinc/40/42/90/933404290.db2.gz SACZRALMEQQGHF-HNNXBMFYSA-N 0 3 400.450 4.372 20 0 HIADHN COc1ccc(C(=O)N(CCN(C)C)Cc2cccc(C)c2)cc1-c1ccccn1 ZINC000535856789 933439286 /nfs/dbraw/zinc/43/92/86/933439286.db2.gz SIWMQJLVDUEFTD-UHFFFAOYSA-N 0 3 403.526 4.270 20 0 HIADHN C[C@@H](Cc1cccc(Cl)c1)C(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000535911100 933486699 /nfs/dbraw/zinc/48/66/99/933486699.db2.gz LUUOXMYQNBOJBH-KRWDZBQOSA-N 0 3 400.950 4.362 20 0 HIADHN CC(C)[C@@H](C(=O)Nc1ccc(C(=O)NCCN2CCCC2)cc1)c1ccc(F)cc1 ZINC000535916153 933490187 /nfs/dbraw/zinc/49/01/87/933490187.db2.gz SYOSKUGONXPYOD-JOCHJYFZSA-N 0 3 411.521 4.030 20 0 HIADHN Cc1nc(CN2CCC(CN[C@@H](C)c3ncc(Br)s3)CC2)oc1C ZINC000535989548 933551569 /nfs/dbraw/zinc/55/15/69/933551569.db2.gz VOAZUHITBKJNDF-LBPRGKRZSA-N 0 3 413.385 4.073 20 0 HIADHN Cc1cc(C(=O)NC2CCN([C@H](C)c3ccncc3)CC2)ccc1Br ZINC000536008675 933566626 /nfs/dbraw/zinc/56/66/26/933566626.db2.gz XVPGOASGPIAEOL-OAHLLOKOSA-N 0 3 402.336 4.108 20 0 HIADHN CC(C)OC(=O)c1ccc(Cl)c(NC(=O)NC[C@@H](Cc2ccccc2)N(C)C)c1 ZINC000536015269 933573347 /nfs/dbraw/zinc/57/33/47/933573347.db2.gz GRQNOABAWOTUSX-GOSISDBHSA-N 0 3 417.937 4.200 20 0 HIADHN CN(C)[C@H](CNC(=O)Nc1cccc(C[S@](=O)C(C)(C)C)c1)Cc1ccccc1 ZINC000536016974 933573481 /nfs/dbraw/zinc/57/34/81/933573481.db2.gz GNRPYKHUIKNWDA-LGGPFLRQSA-N 0 3 415.603 4.028 20 0 HIADHN C[C@@H](NC(=O)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1)c1cn[nH]c1 ZINC000536048360 933594579 /nfs/dbraw/zinc/59/45/79/933594579.db2.gz SDDCFFLWEWGHKJ-CQSZACIVSA-N 0 3 410.349 4.085 20 0 HIADHN CC(C)(NC(=O)[C@@H]1CCCN(Cc2cccnc2)C1)c1ccccc1Br ZINC000536062537 933613787 /nfs/dbraw/zinc/61/37/87/933613787.db2.gz LSBNLNVOVJKRPJ-QGZVFWFLSA-N 0 3 416.363 4.108 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@@H]2CNC(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)cc1 ZINC000536155149 933691222 /nfs/dbraw/zinc/69/12/22/933691222.db2.gz MUAKBJGQVUUVPF-QPXUXIHVSA-N 0 3 407.558 4.207 20 0 HIADHN Cc1ccccc1[C@H](NCC(=O)Nc1ccccc1I)C1CC1 ZINC000537288406 933698394 /nfs/dbraw/zinc/69/83/94/933698394.db2.gz YBQGSBDNGXOJBV-LJQANCHMSA-N 0 3 420.294 4.279 20 0 HIADHN C[C@H](N[C@H](c1ccc2c(c1)OCCO2)C1CC1)C(=O)N1CCC[C@H]1c1cccs1 ZINC000537289813 933699842 /nfs/dbraw/zinc/69/98/42/933699842.db2.gz JPVJNMTWSLGOSN-VPKVUBIPSA-N 0 3 412.555 4.312 20 0 HIADHN C[C@H](N[C@@H](c1ccc2c(c1)OCCO2)C1CC1)C(=O)Nc1cccc2ncccc21 ZINC000537289865 933700029 /nfs/dbraw/zinc/70/00/29/933700029.db2.gz FEWNBDDYZBZXNM-NPMXOYFQSA-N 0 3 403.482 4.074 20 0 HIADHN CC[C@@H](NCCCS(=O)(=O)c1ccccc1)c1cc(F)cc(Br)c1 ZINC000537295529 933702238 /nfs/dbraw/zinc/70/22/38/933702238.db2.gz MFIOPPGZJSTPTJ-GOSISDBHSA-N 0 3 414.340 4.493 20 0 HIADHN Cc1cc(C(=O)N(CCN(C)C)Cc2ccc(F)cc2F)nn1C1CCCCC1 ZINC000537338380 933723331 /nfs/dbraw/zinc/72/33/31/933723331.db2.gz HYZCQTVZLDVTPP-UHFFFAOYSA-N 0 3 404.505 4.179 20 0 HIADHN CN1CC[C@H](NCc2nc(-c3ccc(Br)cc3)c[nH]2)[C@H]1c1ccccc1 ZINC000537360743 933736280 /nfs/dbraw/zinc/73/62/80/933736280.db2.gz GWTRUVALKWPYHS-GHTZIAJQSA-N 0 3 411.347 4.374 20 0 HIADHN CCN1CCN(Cc2ccc(N[C@@H](C)c3nnn(-c4ccc(F)cc4)c3C)cc2)CC1 ZINC000537436783 933775665 /nfs/dbraw/zinc/77/56/65/933775665.db2.gz IJRSDSJJPGBBGE-SFHVURJKSA-N 0 3 422.552 4.025 20 0 HIADHN C[C@H](CC(=O)N(C)Cc1cccc(Cl)c1)NC1(c2ccc3c(c2)OCO3)CC1 ZINC000537448870 933778043 /nfs/dbraw/zinc/77/80/43/933778043.db2.gz UQYZWXUAVBTZEC-OAHLLOKOSA-N 0 3 400.906 4.085 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)C[C@H](C)NC1(c2ccc3c(c2)OCO3)CC1 ZINC000537448761 933778077 /nfs/dbraw/zinc/77/80/77/933778077.db2.gz FGRWCSVROUVIPE-ZDUSSCGKSA-N 0 3 402.878 4.073 20 0 HIADHN CCNC(=O)[C@@H](C)N[C@H]1CCCc2nc(-c3ccccc3Br)sc21 ZINC000537519879 933798768 /nfs/dbraw/zinc/79/87/68/933798768.db2.gz KFXGZZVRBOJKBU-RISCZKNCSA-N 0 3 408.365 4.064 20 0 HIADHN CC(C)(C)[C@@H](CN1CCc2ccccc2C1)NC(=O)N1CCC[C@@H]1C1CCOCC1 ZINC000537527776 933800786 /nfs/dbraw/zinc/80/07/86/933800786.db2.gz OQGFHVZEZXDIIN-DHIUTWEWSA-N 0 3 413.606 4.060 20 0 HIADHN Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)C(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000537551897 938321606 /nfs/dbraw/zinc/32/16/06/938321606.db2.gz RRCWPJZOZVETOQ-ZSZQSSIHSA-N 0 3 422.495 4.117 20 0 HIADHN CCO[C@@H]1C[C@@H](O)C12CCN(Cc1cn(-c3ccccc3)nc1-c1cccs1)CC2 ZINC000537615007 938333215 /nfs/dbraw/zinc/33/32/15/938333215.db2.gz IAALKGOPZCVGSF-FGZHOGPDSA-N 0 3 423.582 4.353 20 0 HIADHN Cc1[nH]nc2ncc(CN3CCC(C(=O)Nc4ccc(Cl)c(Cl)c4)CC3)cc12 ZINC000537616682 938333704 /nfs/dbraw/zinc/33/37/04/938333704.db2.gz HFHBFUVXQAOULG-UHFFFAOYSA-N 0 3 418.328 4.424 20 0 HIADHN COCCOc1cccc(CN2CCC(C(=O)N(Cc3ccccc3)C3CC3)CC2)c1 ZINC000537617146 938334663 /nfs/dbraw/zinc/33/46/63/938334663.db2.gz RMJGIYQPQHXICO-UHFFFAOYSA-N 0 3 422.569 4.115 20 0 HIADHN COCCOc1ccccc1CN1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1 ZINC000537623564 938337465 /nfs/dbraw/zinc/33/74/65/938337465.db2.gz IOFCRBWCHBDSNU-UHFFFAOYSA-N 0 3 420.912 4.355 20 0 HIADHN Cc1ccccc1-c1nn(-c2ccccc2)cc1CN1CCC[C@H](N2CCCC2=O)C1 ZINC000537631135 938341438 /nfs/dbraw/zinc/34/14/38/938341438.db2.gz KKQKHGWKHOUKPD-QHCPKHFHSA-N 0 3 414.553 4.435 20 0 HIADHN CCO[C@@H]1C[C@H](O)C12CCN(Cc1cn(-c3ccc(C)cc3)nc1C(C)(C)C)CC2 ZINC000537635473 938341736 /nfs/dbraw/zinc/34/17/36/938341736.db2.gz WQTFTJUFCSMUCT-FCHUYYIVSA-N 0 3 411.590 4.230 20 0 HIADHN CC[C@H](O)CN(Cc1cn(C)nc1-c1ccc2c(c1)OCCCO2)Cc1ccccc1 ZINC000537650286 938347174 /nfs/dbraw/zinc/34/71/74/938347174.db2.gz STHOAEUNGXCJSK-QFIPXVFZSA-N 0 3 421.541 4.022 20 0 HIADHN Cn1cc(CN2CC[C@H](Oc3ccc(Cl)c(Cl)c3)C2)c(-c2cccnc2)n1 ZINC000537658444 938348363 /nfs/dbraw/zinc/34/83/63/938348363.db2.gz GTSVXDYAUCFUSH-KRWDZBQOSA-N 0 3 403.313 4.442 20 0 HIADHN CC(C)(C)OC(=O)C1CCC(NC(=O)NC[C@H](c2ccccc2)N2CCCC2)CC1 ZINC000537676862 938351804 /nfs/dbraw/zinc/35/18/04/938351804.db2.gz NPQBVHXQWCGVGJ-XVAXZDLZSA-N 0 3 415.578 4.023 20 0 HIADHN CC1CCN([C@H](CNC(=O)c2cn(C)nc2-c2ccccc2)c2cccs2)CC1 ZINC000537855954 938391317 /nfs/dbraw/zinc/39/13/17/938391317.db2.gz SDPARHXQXQHALU-HXUWFJFHSA-N 0 3 408.571 4.352 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@H](c1ccccc1)[C@@H]1CCOC1)c1ccsc1 ZINC000537856432 938391480 /nfs/dbraw/zinc/39/14/80/938391480.db2.gz FUFIGZJETUNHNK-HMXCVIKNSA-N 0 3 401.576 4.208 20 0 HIADHN O=S(=O)(c1ccc(CN[C@@H]2CCSc3ccccc32)cc1)N1CCCCC1 ZINC000537918278 938412913 /nfs/dbraw/zinc/41/29/13/938412913.db2.gz IYDLHROAEBCZFK-HXUWFJFHSA-N 0 3 402.585 4.188 20 0 HIADHN CCOc1cc(Cl)ccc1CN[C@@H](C)CC(=O)Nc1cc(OC)ccc1OC ZINC000537938205 938423410 /nfs/dbraw/zinc/42/34/10/938423410.db2.gz QGIRFFUBGSDKKT-AWEZNQCLSA-N 0 3 406.910 4.263 20 0 HIADHN Cc1cccc(NC(=O)C[C@@H](C)N[C@H](CO)c2ccc(Br)cc2)c1C ZINC000537941876 938425158 /nfs/dbraw/zinc/42/51/58/938425158.db2.gz HLVCLVLJJMYZRM-AUUYWEPGSA-N 0 3 405.336 4.106 20 0 HIADHN Cc1nc(-c2ccccc2)sc1[C@H](C)NCCN(C)S(=O)(=O)c1cccs1 ZINC000537948318 938428685 /nfs/dbraw/zinc/42/86/85/938428685.db2.gz HNXVPFLUHOVKKK-AWEZNQCLSA-N 0 3 421.613 4.151 20 0 HIADHN C[C@H](NC[C@@H]1CCCN(c2nccn3cnnc23)C1)c1cc(Cl)sc1Cl ZINC000537959438 938434462 /nfs/dbraw/zinc/43/44/62/938434462.db2.gz GVWIZCOASNIVAV-RYUDHWBXSA-N 0 3 411.362 4.060 20 0 HIADHN C[C@@H](NCCOc1ncc(Cl)cc1Cl)c1ccc(-n2cncn2)cc1Cl ZINC000537960782 938435515 /nfs/dbraw/zinc/43/55/15/938435515.db2.gz IYMSFHPSEFYNKB-LLVKDONJSA-N 0 3 412.708 4.352 20 0 HIADHN CCOC(=O)c1ccn(-c2cccc(CNCc3cnc(-c4ccccc4)s3)c2)n1 ZINC000563313927 945174377 /nfs/dbraw/zinc/17/43/77/945174377.db2.gz HOAJOIJIQSYGGQ-UHFFFAOYSA-N 0 3 418.522 4.462 20 0 HIADHN C[C@@H](NCc1cc(Cl)c2c(c1)OCCCO2)c1cccc(N2CCOCC2)c1 ZINC000537973607 938442829 /nfs/dbraw/zinc/44/28/29/938442829.db2.gz SAMJOAQZTDUDGK-MRXNPFEDSA-N 0 3 402.922 4.189 20 0 HIADHN COc1cccc(C[C@H](NCc2cccc(NS(C)(=O)=O)c2)c2ccccc2)c1 ZINC000537973673 938443000 /nfs/dbraw/zinc/44/30/00/938443000.db2.gz VMJJXKDRPYNLNG-QHCPKHFHSA-N 0 3 410.539 4.140 20 0 HIADHN COc1cc(CN[C@H](C)c2ccc3c(c2)CCC(=O)N3)cc(Br)c1OC ZINC000537974495 938443756 /nfs/dbraw/zinc/44/37/56/938443756.db2.gz DUPKDZWIHUVLFR-GFCCVEGCSA-N 0 3 419.319 4.202 20 0 HIADHN C[C@@H](N[C@@H]1CCc2c1cccc2Br)c1cccc(NS(C)(=O)=O)c1 ZINC000537976006 938443902 /nfs/dbraw/zinc/44/39/02/938443902.db2.gz JDQXYFNKPMGQAS-KZULUSFZSA-N 0 3 409.349 4.159 20 0 HIADHN C[C@H](N[C@@H]1CCc2c1cccc2Br)c1cccc(NS(C)(=O)=O)c1 ZINC000537976005 938444121 /nfs/dbraw/zinc/44/41/21/938444121.db2.gz JDQXYFNKPMGQAS-KPZWWZAWSA-N 0 3 409.349 4.159 20 0 HIADHN C[C@H](NCc1cccc(OCC(F)F)c1)c1ccc(OCc2nccn2C)cc1 ZINC000537974551 938444155 /nfs/dbraw/zinc/44/41/55/938444155.db2.gz GRKPSSUFMIYMAZ-INIZCTEOSA-N 0 3 401.457 4.494 20 0 HIADHN COc1ccc(OC)c(NC(=O)C[C@H](C)N[C@H]2CCCOc3ccc(F)cc32)c1 ZINC000537989823 938451852 /nfs/dbraw/zinc/45/18/52/938451852.db2.gz HCKKQFCXHWBWOH-KSSFIOAISA-N 0 3 402.466 4.064 20 0 HIADHN CCC[C@@H](NCc1ccc(OCC(=O)N(C)C)c(OC)c1)c1ccc(Cl)cc1 ZINC000537990958 938452331 /nfs/dbraw/zinc/45/23/31/938452331.db2.gz NLZNHFPJHNOJLD-LJQANCHMSA-N 0 3 404.938 4.447 20 0 HIADHN COc1cc(CN[C@@H](C)c2cccc(-c3ccncc3)c2)ccc1OCC(=O)N(C)C ZINC000537991967 938452891 /nfs/dbraw/zinc/45/28/91/938452891.db2.gz QWZOKPOGLQHNBM-SFHVURJKSA-N 0 3 419.525 4.075 20 0 HIADHN COc1ccc([C@H](C)NCc2n[nH]c(-c3ccc(Br)cc3)n2)cc1F ZINC000538017274 938463256 /nfs/dbraw/zinc/46/32/56/938463256.db2.gz BIHSJCTYXDONOS-NSHDSACASA-N 0 3 405.271 4.233 20 0 HIADHN COc1ccc([C@H](C)NCc2nc(-c3ccc(Br)cc3)n[nH]2)cc1F ZINC000538017274 938463258 /nfs/dbraw/zinc/46/32/58/938463258.db2.gz BIHSJCTYXDONOS-NSHDSACASA-N 0 3 405.271 4.233 20 0 HIADHN CCNC(=O)COc1cccc(CN[C@H](C)c2sc(Cc3ccccc3)nc2C)c1 ZINC000538019829 938464946 /nfs/dbraw/zinc/46/49/46/938464946.db2.gz MVCBSOQPYQQDNY-QGZVFWFLSA-N 0 3 423.582 4.408 20 0 HIADHN CC(C)NS(=O)(=O)Cc1ccccc1CN[C@H](c1ccc(Cl)cc1)C1CC1 ZINC000538098830 938501545 /nfs/dbraw/zinc/50/15/45/938501545.db2.gz MRLXMTBEZVAAFH-NRFANRHFSA-N 0 3 406.979 4.409 20 0 HIADHN COc1cc([C@@H](C)N[C@H]2CCc3c2cccc3Br)ccc1OCCO ZINC000538099829 938501553 /nfs/dbraw/zinc/50/15/53/938501553.db2.gz CTKSKBJNCDKQRX-ACJLOTCBSA-N 0 3 406.320 4.167 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@@H](C)N[C@@H](C)c2cccc(OC(C)C)c2)cc1F ZINC000538126364 938512692 /nfs/dbraw/zinc/51/26/92/938512692.db2.gz KSBHTLDIIGKMPJ-DLBZAZTESA-N 0 3 402.510 4.319 20 0 HIADHN Cc1ccccc1C(=O)NC1CCN(C(=O)CN[C@@H](CC(C)C)c2ccccc2)CC1 ZINC000538140413 938518060 /nfs/dbraw/zinc/51/80/60/938518060.db2.gz KWYXFWDHXZEXSY-DEOSSOPVSA-N 0 3 421.585 4.093 20 0 HIADHN COc1ccccc1[C@@H](C)NC(=O)[C@@H](C)N[C@H](C)c1ccc(Br)cc1 ZINC000538143019 938518687 /nfs/dbraw/zinc/51/86/87/938518687.db2.gz DECZLVFSEXKFGA-RBSFLKMASA-N 0 3 405.336 4.374 20 0 HIADHN CC[C@@H](NCC(=O)N1c2ccccc2NC(=O)C[C@H]1C(F)(F)F)c1ccc(C)cc1 ZINC000538155050 938526133 /nfs/dbraw/zinc/52/61/33/938526133.db2.gz IVJAYXXNKWGLSZ-APWZRJJASA-N 0 3 419.447 4.342 20 0 HIADHN CN1CC[C@H](N[C@H]2CCN(c3ccc(Cl)cc3Cl)C2=O)[C@H]1c1ccccc1 ZINC000563330029 945183727 /nfs/dbraw/zinc/18/37/27/945183727.db2.gz HLQIELQEIXIFPH-CMKODMSKSA-N 0 3 404.341 4.134 20 0 HIADHN O=C(CN[C@@H](c1ccccc1)[C@H]1CCOC1)Nc1nc(-c2ccc(F)cc2)cs1 ZINC000538187473 938544069 /nfs/dbraw/zinc/54/40/69/938544069.db2.gz HVJIKYNJVYECEJ-UWJYYQICSA-N 0 3 411.502 4.255 20 0 HIADHN O=C(N[C@@H]1CCO[C@@H]1c1ccc(Cl)cc1)N1CCCN(Cc2ccccc2)CC1 ZINC000538191528 938547111 /nfs/dbraw/zinc/54/71/11/938547111.db2.gz PELBIKZKCHOTPW-FGZHOGPDSA-N 0 3 413.949 4.088 20 0 HIADHN COC[C@H](NC[C@@H](CO)Cc1ccc(C(F)(F)F)cc1)c1ccc(F)c(F)c1 ZINC000538194459 938548897 /nfs/dbraw/zinc/54/88/97/938548897.db2.gz KUHZIIQQDMWXDS-LIRRHRJNSA-N 0 3 403.391 4.112 20 0 HIADHN C[C@@H](NC[C@@H](O)COc1c(Cl)cccc1Cl)c1cccc(N2CCCC2=O)c1 ZINC000538211330 938557486 /nfs/dbraw/zinc/55/74/86/938557486.db2.gz TZSIOUBJRUHOGU-RHSMWYFYSA-N 0 3 423.340 4.211 20 0 HIADHN O=C(CN[C@@H](C[C@H]1CCOC1)c1ccccc1)NCC1(c2ccccc2)CCCC1 ZINC000538225878 938564975 /nfs/dbraw/zinc/56/49/75/938564975.db2.gz JMLAHBMRZMQACN-QPPBQGQZSA-N 0 3 406.570 4.372 20 0 HIADHN C[C@@H](NC(=O)[C@H](C)N[C@@H](C)c1ccc(-n2ccnn2)cc1)c1ccc2ccccc2c1 ZINC000538234385 938567819 /nfs/dbraw/zinc/56/78/19/938567819.db2.gz LSSCYGSQGTUEFS-OTWHNJEPSA-N 0 3 413.525 4.337 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(-n2cccn2)cc1)C(=O)Nc1ccc(OC(F)(F)F)cc1 ZINC000538236156 938569112 /nfs/dbraw/zinc/56/91/12/938569112.db2.gz YJXPHJCUGMUCFJ-HUUCEWRRSA-N 0 3 418.419 4.449 20 0 HIADHN CS(=O)(=O)c1cccc(OCCN[C@H](Cc2ccccc2)c2ccccc2F)c1 ZINC000538257064 938576075 /nfs/dbraw/zinc/57/60/75/938576075.db2.gz IRLVQVUPEWYTJA-HSZRJFAPSA-N 0 3 413.514 4.182 20 0 HIADHN CCc1ccc(C(C)(C)NCC(=O)N2CCC[C@H]2c2ccc(OC)c(OC)c2)cc1 ZINC000538258180 938576681 /nfs/dbraw/zinc/57/66/81/938576681.db2.gz VOPJZNHWKLGTRZ-NRFANRHFSA-N 0 3 410.558 4.455 20 0 HIADHN CC(C)OCc1cccc(CNC(=O)CN[C@@H](C)c2cccc(N3CCCC3)c2)c1 ZINC000538278383 938581910 /nfs/dbraw/zinc/58/19/10/938581910.db2.gz VNSHCRJHIJIGHT-FQEVSTJZSA-N 0 3 409.574 4.179 20 0 HIADHN c1ccc(CCCOc2cccc(CNCc3ccc(N4CCOCC4)nc3)c2)cc1 ZINC000538311940 938589998 /nfs/dbraw/zinc/58/99/98/938589998.db2.gz RMYLNJLGJBJBBP-UHFFFAOYSA-N 0 3 417.553 4.220 20 0 HIADHN CO[C@H](c1ccccc1F)[C@H](C)NC(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000538372805 938606298 /nfs/dbraw/zinc/60/62/98/938606298.db2.gz KFOBBJSKHHZPRS-QSFXBCCZSA-N 0 3 405.539 4.100 20 0 HIADHN COc1ccc([C@@H](N[C@H](C)C(=O)N(C)Cc2nc3ccccc3s2)C2CC2)cc1 ZINC000538389276 938609098 /nfs/dbraw/zinc/60/90/98/938609098.db2.gz CYVDGLHJHLPKSK-QRQCRPRQSA-N 0 3 409.555 4.393 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)CN[C@H](c2ccccc2)C2CC2)c(C(F)(F)F)c1 ZINC000538391577 938609343 /nfs/dbraw/zinc/60/93/43/938609343.db2.gz KMBMMIRCTKVAMQ-HXUWFJFHSA-N 0 3 405.420 4.343 20 0 HIADHN CCOc1cccc2cc([C@H](C)NCc3cccc(OCCN4CCOCC4)c3)oc21 ZINC000538398778 938611173 /nfs/dbraw/zinc/61/11/73/938611173.db2.gz TZSWSYCRILEZCG-IBGZPJMESA-N 0 3 424.541 4.393 20 0 HIADHN CCc1ncc(CNCCOc2cccc(NC(=O)c3ccc(OC)cc3)c2)s1 ZINC000538401481 938611681 /nfs/dbraw/zinc/61/16/81/938611681.db2.gz FDNRXLVTMKDLTJ-UHFFFAOYSA-N 0 3 411.527 4.135 20 0 HIADHN COc1cc(CN[C@@H](c2cc3ccccc3o2)C(C)C)ccc1OCC(=O)N(C)C ZINC000538458599 938627106 /nfs/dbraw/zinc/62/71/06/938627106.db2.gz KRQJPRKRKREDIB-XMMPIXPASA-N 0 3 410.514 4.395 20 0 HIADHN C[C@@]1(CCCO)CCCN1CC(=O)NC[C@@H](c1c[nH]c2ccccc21)c1ccccc1 ZINC000538514536 938639074 /nfs/dbraw/zinc/63/90/74/938639074.db2.gz JAUIZYTXJDVFLG-GJZUVCINSA-N 0 3 419.569 4.043 20 0 HIADHN Cc1cc(C(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)nn1[C@@H](C)C1CC1 ZINC000538523385 938641276 /nfs/dbraw/zinc/64/12/76/938641276.db2.gz VMGTZTSAIHDVFW-INIZCTEOSA-N 0 3 422.495 4.385 20 0 HIADHN O=C(Nc1ccc2nc(-c3ccccn3)oc2c1)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000538594966 938658100 /nfs/dbraw/zinc/65/81/00/938658100.db2.gz MFEFEENWAQHGSW-GOSISDBHSA-N 0 3 413.481 4.136 20 0 HIADHN O=C(Nc1ccc2nc(-c3ccccn3)oc2c1)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000538594967 938658151 /nfs/dbraw/zinc/65/81/51/938658151.db2.gz MFEFEENWAQHGSW-SFHVURJKSA-N 0 3 413.481 4.136 20 0 HIADHN Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)C(=O)N(CCN1CCCC1)c1ccccc1 ZINC000538670855 938681078 /nfs/dbraw/zinc/68/10/78/938681078.db2.gz NYVRUSZNDBMGND-INIZCTEOSA-N 0 3 422.495 4.295 20 0 HIADHN C[C@]1(C2CCN(Cc3ccc(-c4cccc(Cl)c4Cl)o3)CC2)NC(=O)NC1=O ZINC000538723722 938691897 /nfs/dbraw/zinc/69/18/97/938691897.db2.gz VKANRMNZENBBKU-HXUWFJFHSA-N 0 3 422.312 4.064 20 0 HIADHN Cc1nc(COc2ccc(CN3CC[C@H](OCCCc4ccccc4)C3)cc2)no1 ZINC000538724282 938692068 /nfs/dbraw/zinc/69/20/68/938692068.db2.gz AYUDKMWUPXXJMZ-QHCPKHFHSA-N 0 3 407.514 4.181 20 0 HIADHN COCC1(O)CCN(Cc2cn(-c3ccccc3)nc2-c2cccc(Cl)c2)CC1 ZINC000538725367 938692799 /nfs/dbraw/zinc/69/27/99/938692799.db2.gz QWBMSZRTSKIOAZ-UHFFFAOYSA-N 0 3 411.933 4.166 20 0 HIADHN CCOCCCNC(=O)C1CCN([C@@H]2CCCc3ccc(Br)cc32)CC1 ZINC000538742787 938699189 /nfs/dbraw/zinc/69/91/89/938699189.db2.gz TVDMQDQQCRKJAO-HXUWFJFHSA-N 0 3 423.395 4.081 20 0 HIADHN CNC(=O)CCOC1CCN(Cc2ccc(-c3ccc(C(F)(F)F)cc3)o2)CC1 ZINC000538790508 938712648 /nfs/dbraw/zinc/71/26/48/938712648.db2.gz GUALDROEDQQRIK-UHFFFAOYSA-N 0 3 410.436 4.083 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)CCCc2c[nH]c3ccccc23)cc1 ZINC000538830843 938721712 /nfs/dbraw/zinc/72/17/12/938721712.db2.gz UGFHNLHNUMLPHC-XMMPIXPASA-N 0 3 405.542 4.453 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)[C@@H]2C[C@@H]2c2ccc(F)cc2F)cc1 ZINC000538830776 938721779 /nfs/dbraw/zinc/72/17/79/938721779.db2.gz PDMIBGNVELRZLG-SJBKTWHCSA-N 0 3 400.469 4.030 20 0 HIADHN CCC[C@@H](N[C@@H](C)c1sc(CCOC)nc1C)C(=O)N1CCc2sccc2C1 ZINC000538869008 938728399 /nfs/dbraw/zinc/72/83/99/938728399.db2.gz UVMIBHPCZYWIQO-WMLDXEAASA-N 0 3 421.632 4.106 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)NCC2(Cc3ccc(F)cc3)CC2)CC1 ZINC000538914471 938737182 /nfs/dbraw/zinc/73/71/82/938737182.db2.gz GIQBLFHGJSJKPI-UHFFFAOYSA-N 0 3 409.549 4.454 20 0 HIADHN CCc1ncsc1C(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1 ZINC000538934526 938740951 /nfs/dbraw/zinc/74/09/51/938740951.db2.gz ZVSNISHQQFQHKN-UHFFFAOYSA-N 0 3 420.582 4.323 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)N[C@H](c1ccccc1)[C@H]1CCOC1 ZINC000538996245 938763439 /nfs/dbraw/zinc/76/34/39/938763439.db2.gz GNLYRUZZIFWUJR-FGCOXFRFSA-N 0 3 407.558 4.070 20 0 HIADHN CCN1C[C@H](C)N(C(=O)Nc2ccc3nc(C(F)(F)C(F)(F)F)[nH]c3c2)C[C@@H]1C ZINC000539010841 938768103 /nfs/dbraw/zinc/76/81/03/938768103.db2.gz MPTCWFRZELTUAF-QWRGUYRKSA-N 0 3 419.398 4.163 20 0 HIADHN COc1ccc(CN(C(=O)N[C@@H]2CCN(C3CC3)C2)[C@@H]2CCCC[C@@H]2C)cc1OC ZINC000539017012 938770026 /nfs/dbraw/zinc/77/00/26/938770026.db2.gz XWRZEBNORXTSBZ-FBBABVLZSA-N 0 3 415.578 4.031 20 0 HIADHN CCOc1ccc([C@H](C)N[C@H](C)c2ccc(S(=O)(=O)N(C)C)cc2)cc1OCC ZINC000539021195 938771463 /nfs/dbraw/zinc/77/14/63/938771463.db2.gz VVUOZTNGCUKYMW-SJORKVTESA-N 0 3 420.575 4.146 20 0 HIADHN CC[C@H](N[C@@H](C)c1cc(OC)c(OC)cc1F)[C@@H](c1ccc(C)cc1)n1cncn1 ZINC000539039432 938778052 /nfs/dbraw/zinc/77/80/52/938778052.db2.gz AWMCXZJQTDFKQK-ITSWEJNFSA-N 0 3 412.509 4.462 20 0 HIADHN CCc1ccc([C@H](CO)N[C@H](C)CC(=O)Nc2ccc(Br)cc2)cc1 ZINC000539041899 938778641 /nfs/dbraw/zinc/77/86/41/938778641.db2.gz UKWMEYSUNNHKCT-KUHUBIRLSA-N 0 3 405.336 4.052 20 0 HIADHN CCOc1ccc([C@H](CC)N[C@@H]2CCCN(CC(F)(F)F)C2=O)cc1OCC ZINC000539052568 938783713 /nfs/dbraw/zinc/78/37/13/938783713.db2.gz MHIZICRIYQQOLZ-JKSUJKDBSA-N 0 3 402.457 4.078 20 0 HIADHN Cc1ccc(C(=O)NCCN[C@@H](C)c2ccc(OC[C@H]3CCCCO3)c(F)c2)cc1 ZINC000539067201 938791058 /nfs/dbraw/zinc/79/10/58/938791058.db2.gz CCBZENQIILNNKG-GHTZIAJQSA-N 0 3 414.521 4.163 20 0 HIADHN Cc1ccc(C(=O)NCCN[C@@H](C)c2ccc(OC[C@@H]3CCCCO3)c(F)c2)cc1 ZINC000539067209 938791502 /nfs/dbraw/zinc/79/15/02/938791502.db2.gz CCBZENQIILNNKG-RXVVDRJESA-N 0 3 414.521 4.163 20 0 HIADHN CCc1cc(N2CCC[C@H](N[C@@H](COC)c3cccc(C(F)(F)F)c3)C2)ncn1 ZINC000539079010 938796835 /nfs/dbraw/zinc/79/68/35/938796835.db2.gz QHEXXKQWMNMBLP-OALUTQOASA-N 0 3 408.468 4.004 20 0 HIADHN C[C@H](N[C@@H]1CC(=O)N(c2ccccc2Cl)C1)c1ccc(OCc2nccn2C)cc1 ZINC000539079768 938797425 /nfs/dbraw/zinc/79/74/25/938797425.db2.gz HXSZASZBDFGPTN-FUHWJXTLSA-N 0 3 424.932 4.109 20 0 HIADHN C[C@H](CC(=O)Nc1ccccc1C(F)(F)F)N[C@@H]1C[C@H](C)N(c2ccccc2)C1=O ZINC000539090442 938800734 /nfs/dbraw/zinc/80/07/34/938800734.db2.gz JHCQLBVLAWAKOG-ZRGWGRIASA-N 0 3 419.447 4.206 20 0 HIADHN C[C@H](CC(=O)Nc1ccccc1C(F)(F)F)N[C@H]1C[C@H](C)N(c2ccccc2)C1=O ZINC000539090441 938800788 /nfs/dbraw/zinc/80/07/88/938800788.db2.gz JHCQLBVLAWAKOG-VCBZYWHSSA-N 0 3 419.447 4.206 20 0 HIADHN CCc1ccccc1NC(=O)C[C@H](C)NCc1cccc(C(=O)NCc2ccco2)c1 ZINC000539090788 938801030 /nfs/dbraw/zinc/80/10/30/938801030.db2.gz QYQYSPNJSXWQJS-SFHVURJKSA-N 0 3 419.525 4.279 20 0 HIADHN COc1ccc2cc([C@@H](C)NCc3ccc(S(=O)(=O)N4CCCC4)cc3)ccc2c1 ZINC000539094452 938802032 /nfs/dbraw/zinc/80/20/32/938802032.db2.gz WMVYQCRHHSMLDL-GOSISDBHSA-N 0 3 424.566 4.484 20 0 HIADHN Cc1cccc(C)c1CNCc1ccccc1CN1C(=O)NC2(CCCCC2)C1=O ZINC000539104600 938803824 /nfs/dbraw/zinc/80/38/24/938803824.db2.gz VZSHULNJDYUJBW-UHFFFAOYSA-N 0 3 405.542 4.348 20 0 HIADHN CCN1CCN([C@H](C)CNC(=O)c2ccc(Sc3ccc(Cl)cc3)cc2)CC1 ZINC000539119613 938805588 /nfs/dbraw/zinc/80/55/88/938805588.db2.gz GFZHMYDERQXKRK-QGZVFWFLSA-N 0 3 418.006 4.247 20 0 HIADHN Cc1noc(C2CCC(N[C@@H](C)c3nnn(-c4cccc(Cl)c4)c3C)CC2)n1 ZINC000539121646 938805940 /nfs/dbraw/zinc/80/59/40/938805940.db2.gz AJLZWTAMNYLDHG-VWDMACCTSA-N 0 3 400.914 4.298 20 0 HIADHN C[C@H](N[C@H]1CCO[C@H]1c1ccc(Cl)c(F)c1)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000539195550 938817889 /nfs/dbraw/zinc/81/78/89/938817889.db2.gz BFBZZNJSRGPWHH-AHYKXKOGSA-N 0 3 415.889 4.203 20 0 HIADHN Clc1ccc([C@@H](NCc2ccccc2OCCN2CCOCC2)C2CC2)cc1 ZINC000539200660 938818542 /nfs/dbraw/zinc/81/85/42/938818542.db2.gz UMSQFRIFXUDAQH-QHCPKHFHSA-N 0 3 400.950 4.292 20 0 HIADHN C[C@H]1CCCN(S(=O)(=O)c2ccc(CN[C@H](c3ccc(F)cc3)C3CC3)cc2)C1 ZINC000539215546 938819779 /nfs/dbraw/zinc/81/97/79/938819779.db2.gz JXROSDVGEHWMNI-SBUREZEXSA-N 0 3 416.562 4.487 20 0 HIADHN CCc1cnccc1[C@H](C)N[C@H](C)c1ccc(S(=O)(=O)NCc2ccco2)cc1 ZINC000539214367 938819852 /nfs/dbraw/zinc/81/98/52/938819852.db2.gz IUEHBKQESUUHJG-SJORKVTESA-N 0 3 413.543 4.127 20 0 HIADHN C[C@H]1CCCN(S(=O)(=O)c2ccc(CN[C@@H](c3ccc(F)cc3)C3CC3)cc2)C1 ZINC000539215543 938819941 /nfs/dbraw/zinc/81/99/41/938819941.db2.gz JXROSDVGEHWMNI-GAJHUEQPSA-N 0 3 416.562 4.487 20 0 HIADHN COCCc1ccc(S(=O)(=O)[N-]c2ccc(C[N@@H+]3CCCC[C@@H]3C)cc2)cc1 ZINC000539231118 938822283 /nfs/dbraw/zinc/82/22/83/938822283.db2.gz PYOQKLYWYPNOOU-SFHVURJKSA-N 0 3 402.560 4.051 20 0 HIADHN COCCc1ccc(S(=O)(=O)[N-]c2ccc(C[N@H+]3CCCC[C@@H]3C)cc2)cc1 ZINC000539231118 938822285 /nfs/dbraw/zinc/82/22/85/938822285.db2.gz PYOQKLYWYPNOOU-SFHVURJKSA-N 0 3 402.560 4.051 20 0 HIADHN CC(C)c1ccc([C@@H](NCC(=O)Nc2ccc(S(C)(=O)=O)cc2)C(C)C)cc1 ZINC000539241111 938824114 /nfs/dbraw/zinc/82/41/14/938824114.db2.gz ACQSMEWJJDKEKT-QFIPXVFZSA-N 0 3 402.560 4.139 20 0 HIADHN C[C@@H](NC[C@@H](O)COc1cccc(Br)c1)c1ccccc1OC(F)F ZINC000539245948 938824873 /nfs/dbraw/zinc/82/48/73/938824873.db2.gz IBLDOPAZBTUFOV-TZMCWYRMSA-N 0 3 416.262 4.141 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)N[C@@H]1CCO[C@H]1c1ccc(Cl)cc1 ZINC000539250505 938825715 /nfs/dbraw/zinc/82/57/15/938825715.db2.gz AOHKTYWXNOWTLY-VSKRKVRLSA-N 0 3 413.949 4.306 20 0 HIADHN C[C@H](NC(=O)CN[C@H](c1ccccc1)[C@H]1CCOC1)c1ccc(OC(F)(F)F)cc1 ZINC000539290369 938834493 /nfs/dbraw/zinc/83/44/93/938834493.db2.gz ZNOGULJRBIXNAQ-UQASEVPWSA-N 0 3 422.447 4.130 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CNC(=O)CNC1(c2ccccc2)CCCC1 ZINC000539296141 938835512 /nfs/dbraw/zinc/83/55/12/938835512.db2.gz ZHWVOIFEAYAXLI-UHFFFAOYSA-N 0 3 402.542 4.164 20 0 HIADHN C[C@H](NC[C@@H](O)COc1ccc2ccccc2c1)c1cccc(N2CCCC2=O)c1 ZINC000539308742 938838259 /nfs/dbraw/zinc/83/82/59/938838259.db2.gz KDHQSUWPPFQYHK-FDDCHVKYSA-N 0 3 404.510 4.057 20 0 HIADHN C[C@H](NC[C@H](O)COc1cccc2ccccc21)c1cccc(N2CCCC2=O)c1 ZINC000539313996 938839515 /nfs/dbraw/zinc/83/95/15/938839515.db2.gz STYJNENOHOIBHS-AVRDEDQJSA-N 0 3 404.510 4.057 20 0 HIADHN CCC[C@H](NCCCS(=O)(=O)c1ccc(NC(C)=O)cc1)c1ccc(F)cc1F ZINC000539324010 938841447 /nfs/dbraw/zinc/84/14/47/938841447.db2.gz DQOIKKPEDSQSMK-NRFANRHFSA-N 0 3 424.513 4.218 20 0 HIADHN COc1cc(C(C)=O)ccc1OC[C@@H](O)CN[C@@H](c1ccccc1F)C1CCCC1 ZINC000539325711 938841993 /nfs/dbraw/zinc/84/19/93/938841993.db2.gz OXVHYWJECNRAJR-YADARESESA-N 0 3 415.505 4.298 20 0 HIADHN CNC(=O)C(C)(C)CN[C@@H](Cc1ccccc1F)c1ccccc1Br ZINC000539369675 938850146 /nfs/dbraw/zinc/85/01/46/938850146.db2.gz YJZVICFYYRTCBR-SFHVURJKSA-N 0 3 407.327 4.234 20 0 HIADHN C[C@@H](NCCN1c2cccc3cccc(c23)S1(=O)=O)c1cccc(N2CCCC2)c1 ZINC000539378348 938851597 /nfs/dbraw/zinc/85/15/97/938851597.db2.gz AAINQAVZFIIMPV-GOSISDBHSA-N 0 3 421.566 4.300 20 0 HIADHN CS(=O)(=O)C[C@@H](NCC/C=C/c1ccc(Br)cc1)c1ccccc1 ZINC000539378988 938851795 /nfs/dbraw/zinc/85/17/95/938851795.db2.gz NFNBUIIPIRABCK-WSSFADSRSA-N 0 3 408.361 4.228 20 0 HIADHN Cc1cc([C@H](NCC(=O)N2CCC[C@@H]2c2ccc3c(c2)OCCO3)C2CC2)ccc1F ZINC000539422758 938858286 /nfs/dbraw/zinc/85/82/86/938858286.db2.gz FJTGNMHHFIUKRY-PXDATVDWSA-N 0 3 424.516 4.310 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)N[C@H]2CCCOc3c(Cl)cccc32)CC1 ZINC000539470232 938865126 /nfs/dbraw/zinc/86/51/26/938865126.db2.gz KFELASXUJFSFPR-FQEVSTJZSA-N 0 3 417.937 4.453 20 0 HIADHN Cc1cc(NC(=O)CN[C@@H](COc2ccccc2F)C(C)(C)C)n(C(C)(C)C)n1 ZINC000539492571 938868280 /nfs/dbraw/zinc/86/82/80/938868280.db2.gz CHKZJGVCOJCYPI-SFHVURJKSA-N 0 3 404.530 4.107 20 0 HIADHN COC(=O)[C@H](C)Oc1ccc(CN[C@H]2CCc3c2cccc3Br)cc1 ZINC000539503549 938869778 /nfs/dbraw/zinc/86/97/78/938869778.db2.gz DIFVFICIBCOOJG-DJJJIMSYSA-N 0 3 404.304 4.167 20 0 HIADHN COC(=O)[C@@H](C)Oc1ccc(CN[C@H]2CCc3c2cccc3Br)cc1 ZINC000539503551 938869920 /nfs/dbraw/zinc/86/99/20/938869920.db2.gz DIFVFICIBCOOJG-YJYMSZOUSA-N 0 3 404.304 4.167 20 0 HIADHN CC(C)(C)C[C@@H](NC[C@H](O)CS(=O)(=O)c1cccs1)c1ccc(Cl)cc1 ZINC000539506849 938870484 /nfs/dbraw/zinc/87/04/84/938870484.db2.gz FONDONQXVAXPNJ-DLBZAZTESA-N 0 3 416.008 4.303 20 0 HIADHN CN(CCCOCc1ccccc1)C(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000539603025 938886717 /nfs/dbraw/zinc/88/67/17/938886717.db2.gz XEIJHUQHTSQCLT-HXUWFJFHSA-N 0 3 401.576 4.133 20 0 HIADHN CC(C)[C@@H]1C[C@@H](N[C@H](c2ccc(F)cc2)c2cccc(S(C)(=O)=O)c2)CCO1 ZINC000539608538 938887606 /nfs/dbraw/zinc/88/76/06/938887606.db2.gz QTTCSDCJQZSOAB-ILWGZMRPSA-N 0 3 405.535 4.112 20 0 HIADHN CC[C@H](C)Oc1cc(C(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)ccn1 ZINC000539665613 938897076 /nfs/dbraw/zinc/89/70/76/938897076.db2.gz DOERZKSSJKDMLM-GHTZIAJQSA-N 0 3 419.529 4.155 20 0 HIADHN COc1cc(OC)c(CNC2CCN(c3nc4ccccc4s3)CC2)c(OC)c1 ZINC000539693406 938903838 /nfs/dbraw/zinc/90/38/38/938903838.db2.gz HXVHZPSAWCQWMF-UHFFFAOYSA-N 0 3 413.543 4.081 20 0 HIADHN C[C@@H](NC(=O)CN1CCC[C@H](c2n[nH]c(C3CCCCC3)n2)C1)c1ccc(F)cc1 ZINC000539763711 938928148 /nfs/dbraw/zinc/92/81/48/938928148.db2.gz XONPUKSWGMOVDO-APWZRJJASA-N 0 3 413.541 4.048 20 0 HIADHN COC(=O)[C@H]1CC12CCN(Cc1cn(-c3ccccc3)nc1-c1ccc(C)o1)CC2 ZINC000539826382 938947929 /nfs/dbraw/zinc/94/79/29/938947929.db2.gz PZAMFWDAGNAJFU-HXUWFJFHSA-N 0 3 405.498 4.216 20 0 HIADHN COc1cc(CN2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)cc(OC)c1 ZINC000539828977 938949346 /nfs/dbraw/zinc/94/93/46/938949346.db2.gz RNXZIHUDQBAQAG-UHFFFAOYSA-N 0 3 406.885 4.347 20 0 HIADHN COCCOc1cccc(CN2CCC([C@@H]3C(=O)Nc4cc(Cl)ccc43)CC2)c1 ZINC000539840336 938954520 /nfs/dbraw/zinc/95/45/20/938954520.db2.gz GSLHJQGDRCNWST-QFIPXVFZSA-N 0 3 414.933 4.313 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@@H](C)N[C@H](C)c2ccccc2N(C)C)cc1 ZINC000539854858 938958967 /nfs/dbraw/zinc/95/89/67/938958967.db2.gz MWBGGNGZUXDFAD-QZTJIDSGSA-N 0 3 403.592 4.195 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)[C@@H]2C[C@@H]2c2cc(F)ccc2F)cc1 ZINC000539931128 938978713 /nfs/dbraw/zinc/97/87/13/938978713.db2.gz VDOSHLNXNRRJCL-UZKOGDIHSA-N 0 3 400.469 4.030 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)c2ccc(Br)cc2F)cc1 ZINC000539931251 938978734 /nfs/dbraw/zinc/97/87/34/938978734.db2.gz HYHVUCPBCNYJNU-LJQANCHMSA-N 0 3 421.310 4.164 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CCC(Cc2cccnc2)CC1)c1ccsc1 ZINC000539949068 938980595 /nfs/dbraw/zinc/98/05/95/938980595.db2.gz QYEWDLYOFSECPF-NRFANRHFSA-N 0 3 400.592 4.190 20 0 HIADHN CC(=O)c1cccc(OCc2cc(-c3nc(-c4ccc(CN(C)C)cc4)no3)no2)c1 ZINC000539958193 938981222 /nfs/dbraw/zinc/98/12/22/938981222.db2.gz JQYGVIOEGILCKZ-UHFFFAOYSA-N 0 3 418.453 4.235 20 0 HIADHN COc1ccc(-c2ccccc2)cc1CN[C@H](CN1CCN(C)CC1)c1ccccc1 ZINC000539963324 938981923 /nfs/dbraw/zinc/98/19/23/938981923.db2.gz SHNJRXUERBXWIC-AREMUKBSSA-N 0 3 415.581 4.441 20 0 HIADHN O=C([C@@H]1CC12CCN(Cc1ccccc1OCC(F)(F)F)CC2)N1CCCCC1 ZINC000540050410 939050983 /nfs/dbraw/zinc/05/09/83/939050983.db2.gz RBOVFHSHAWRUJT-SFHVURJKSA-N 0 3 410.480 4.242 20 0 HIADHN CCc1nc2ccccc2n1C1CCN(C(=O)NC[C@@H](c2ccccc2)N(C)C)CC1 ZINC000540057967 939053200 /nfs/dbraw/zinc/05/32/00/939053200.db2.gz ROTMCSHNPCPDMK-QHCPKHFHSA-N 0 3 419.573 4.248 20 0 HIADHN CC(C)n1cnnc1[C@H]1CCCN(C[C@H](O)COc2ccc(-c3ccccc3)cc2)C1 ZINC000540061583 939055218 /nfs/dbraw/zinc/05/52/18/939055218.db2.gz KGGVKNWKRCNPKW-GOTSBHOMSA-N 0 3 420.557 4.145 20 0 HIADHN CC(C)Cn1cc(NC(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)c(C(F)F)n1 ZINC000540114042 939077420 /nfs/dbraw/zinc/07/74/20/939077420.db2.gz HTWSJGNGORFZMA-RDJZCZTQSA-N 0 3 405.493 4.434 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)Nc2cccc(-c3ccc4c(c3)CCO4)c2)CC1 ZINC000540114986 939077967 /nfs/dbraw/zinc/07/79/67/939077967.db2.gz SKFKUYOKMXNSLK-UHFFFAOYSA-N 0 3 423.557 4.299 20 0 HIADHN CCSc1ccccc1[C@@H](C)NCc1ccc(OCC(=O)N(C)C)c(OC)c1 ZINC000540117821 939079030 /nfs/dbraw/zinc/07/90/30/939079030.db2.gz NVNMEJZPQUIBCC-MRXNPFEDSA-N 0 3 402.560 4.125 20 0 HIADHN CC(C)Oc1ccc([C@H](C)N[C@@H](C)c2cccc(N3CCCS3(=O)=O)c2)cc1 ZINC000540144015 939090140 /nfs/dbraw/zinc/09/01/40/939090140.db2.gz LHSCSKSNVWDMFS-ROUUACIJSA-N 0 3 402.560 4.426 20 0 HIADHN C[C@@H](N[C@@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000540144191 939090299 /nfs/dbraw/zinc/09/02/99/939090299.db2.gz LHTCAMJPAYFNQX-TZMCWYRMSA-N 0 3 415.896 4.165 20 0 HIADHN COC(=O)c1ccc(CN[C@H]2CCCc3ccc(Br)cc32)cc1OC ZINC000540145652 939090746 /nfs/dbraw/zinc/09/07/46/939090746.db2.gz VNUDYSGBRUOSCL-SFHVURJKSA-N 0 3 404.304 4.412 20 0 HIADHN COc1ccc2c(c1)CCC[C@@H]2[NH2+]Cc1nnc(-c2ccc(Br)cc2)[n-]1 ZINC000540148419 939091810 /nfs/dbraw/zinc/09/18/10/939091810.db2.gz NIUXHVHMGMWNMG-SFHVURJKSA-N 0 3 413.319 4.410 20 0 HIADHN COc1ccc2c(c1)CCC[C@@H]2NCc1nnc(-c2ccc(Br)cc2)[nH]1 ZINC000540148419 939091815 /nfs/dbraw/zinc/09/18/15/939091815.db2.gz NIUXHVHMGMWNMG-SFHVURJKSA-N 0 3 413.319 4.410 20 0 HIADHN CCC[C@@H](NC[C@@H](O)CS(=O)(=O)c1cccs1)c1ccc(Cl)c(Cl)c1 ZINC000540149575 939092317 /nfs/dbraw/zinc/09/23/17/939092317.db2.gz VZHABCNYUMAPDW-CZUORRHYSA-N 0 3 422.399 4.321 20 0 HIADHN CN(C(=O)c1ccc(NCc2cc(O)cc(C(F)(F)F)c2)cc1)[C@@H]1CCCN(C)C1 ZINC000563629536 945226832 /nfs/dbraw/zinc/22/68/32/945226832.db2.gz HQXYBLHAAVSIPX-LJQANCHMSA-N 0 3 421.463 4.189 20 0 HIADHN Cc1c([C@H](C)N[C@H]2CCOC3(CCSCC3)C2)nnn1-c1cccc(Cl)c1 ZINC000540160356 939095882 /nfs/dbraw/zinc/09/58/82/939095882.db2.gz ULCHQOLEKWYUPE-YOEHRIQHSA-N 0 3 406.983 4.325 20 0 HIADHN Cc1ccc(NC(=O)C[C@H](C)N[C@H]2CC(=O)N(C)[C@H]2c2ccc(Cl)cc2)c(C)c1 ZINC000540162241 939097356 /nfs/dbraw/zinc/09/73/56/939097356.db2.gz GUPNUVKYGZOXJJ-GRWTVWFQSA-N 0 3 413.949 4.236 20 0 HIADHN CC[C@H](N[C@H]1CCN(Cc2ccc(OC)cc2)C1=O)c1cccc(Br)c1 ZINC000540180789 939107472 /nfs/dbraw/zinc/10/74/72/939107472.db2.gz BSZGRHHAKAJTFE-PMACEKPBSA-N 0 3 417.347 4.300 20 0 HIADHN C[C@H]1C[C@@H](NCCNC(=O)c2cccc(Br)c2)c2ccsc2S1 ZINC000540182042 939108521 /nfs/dbraw/zinc/10/85/21/939108521.db2.gz KLGWJMGYBDHRQU-XHDPSFHLSA-N 0 3 411.390 4.456 20 0 HIADHN O=C(NCCN[C@@H]1CCCOc2c(Br)cccc21)c1ccccc1Cl ZINC000540181541 939108844 /nfs/dbraw/zinc/10/88/44/939108844.db2.gz MEHXJJIYTUBYKZ-QGZVFWFLSA-N 0 3 423.738 4.336 20 0 HIADHN Cc1ccc([C@H](N[C@H]2C[C@@H](C)N(C3CC3)C2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000540185732 939110920 /nfs/dbraw/zinc/11/09/20/939110920.db2.gz ZCESTBSPGAEPGB-LJFZDNNRSA-N 0 3 412.599 4.011 20 0 HIADHN COc1ccc2c(c1)CCC[C@@H]2NCc1ccc(C(=O)N2C[C@H](C)O[C@@H](C)C2)cc1 ZINC000540191442 939116135 /nfs/dbraw/zinc/11/61/35/939116135.db2.gz OAUFKTRRLOXLPV-XFAGBWLFSA-N 0 3 408.542 4.112 20 0 HIADHN CNS(=O)(=O)c1ccc([C@@H](C)N[C@@H](C)c2ccc(OCC(C)C)c(OC)c2)cc1 ZINC000540192475 939116991 /nfs/dbraw/zinc/11/69/91/939116991.db2.gz HTCSZHKGOJMBDP-SJORKVTESA-N 0 3 420.575 4.050 20 0 HIADHN CNS(=O)(=O)c1ccc([C@@H](C)N[C@H](C)c2ccc(OCC(C)C)c(OC)c2)cc1 ZINC000540192473 939117462 /nfs/dbraw/zinc/11/74/62/939117462.db2.gz HTCSZHKGOJMBDP-IAGOWNOFSA-N 0 3 420.575 4.050 20 0 HIADHN C[C@@H](N[C@@H]1CCCc2nc(-c3ccc(Br)cc3)sc21)C(=O)N(C)C ZINC000540223304 939138636 /nfs/dbraw/zinc/13/86/36/939138636.db2.gz CINCMZFRLNBRFO-BXUZGUMPSA-N 0 3 408.365 4.016 20 0 HIADHN O=C(CC1(N2CCOCC2)CCCC1)N1CCC(c2ccc(C(F)(F)F)cc2)CC1 ZINC000540235467 939156798 /nfs/dbraw/zinc/15/67/98/939156798.db2.gz VCZMWJWITICOIS-UHFFFAOYSA-N 0 3 424.507 4.447 20 0 HIADHN COc1ccccc1[C@H](NCc1ccc(C(=O)N2CCN(C)CC2)cc1)C1CCCC1 ZINC000540264031 939177657 /nfs/dbraw/zinc/17/76/57/939177657.db2.gz AIAIPVKKSJQGOY-RUZDIDTESA-N 0 3 421.585 4.104 20 0 HIADHN CC(C)(C)C[C@@H](NCC(=O)NCc1ccc(C(=O)N2CCCC2)cc1)c1ccccc1 ZINC000540355025 939206203 /nfs/dbraw/zinc/20/62/03/939206203.db2.gz XHXIHAJGHPKGDY-HSZRJFAPSA-N 0 3 421.585 4.306 20 0 HIADHN Cc1ccccc1[C@H](CC(C)C)NCC(=O)NCc1ccc(C(=O)N2CCCC2)cc1 ZINC000540359672 939208730 /nfs/dbraw/zinc/20/87/30/939208730.db2.gz UBBRFDUFLXHGJQ-DEOSSOPVSA-N 0 3 421.585 4.224 20 0 HIADHN COc1cccc([C@@H](NC2CCN(C(=O)N(C)C)CC2)c2ccccc2Cl)c1 ZINC000540361300 939210300 /nfs/dbraw/zinc/21/03/00/939210300.db2.gz WTDVOORZNYAHFA-OAQYLSRUSA-N 0 3 401.938 4.174 20 0 HIADHN C[C@H](N[C@@H](C)c1cccc(-n2cccn2)c1)C(=O)Nc1ccc(OC(F)(F)F)cc1 ZINC000540387120 939223510 /nfs/dbraw/zinc/22/35/10/939223510.db2.gz NENACVLMMILLMT-GJZGRUSLSA-N 0 3 418.419 4.449 20 0 HIADHN C[C@@H](NCC(=O)N(C)Cc1ccc(Cl)c(Cl)c1)c1cccc(-n2cccn2)c1 ZINC000540388651 939225798 /nfs/dbraw/zinc/22/57/98/939225798.db2.gz SFXQTOFRAAHQMW-OAHLLOKOSA-N 0 3 417.340 4.488 20 0 HIADHN Cc1cc(Br)ccc1NC(=O)CN[C@H](c1ccccc1)[C@H]1CCOC1 ZINC000540389787 939227732 /nfs/dbraw/zinc/22/77/32/939227732.db2.gz TTWMKIIYDKUTPA-OXJNMPFZSA-N 0 3 403.320 4.063 20 0 HIADHN Cc1ccccc1[C@H](NCC(=O)N1CCN(C(=O)Nc2ccccc2)CC1)C(C)(C)C ZINC000540393511 939231774 /nfs/dbraw/zinc/23/17/74/939231774.db2.gz MIQQPVRKISWSRE-QHCPKHFHSA-N 0 3 422.573 4.048 20 0 HIADHN O=C(CN[C@@H](c1ccccc1)[C@@H]1CCOC1)N1CC=C(c2c[nH]c3ccccc32)CC1 ZINC000540398465 939234207 /nfs/dbraw/zinc/23/42/07/939234207.db2.gz QKWAWOJGDWFYHP-RLWLMLJZSA-N 0 3 415.537 4.151 20 0 HIADHN COc1cccc(CN(C)C(=O)CN[C@H](c2ccc(F)cc2)C2CCCC2)c1OC ZINC000540411065 939239199 /nfs/dbraw/zinc/23/91/99/939239199.db2.gz HIOYDQXULFEREM-QHCPKHFHSA-N 0 3 414.521 4.322 20 0 HIADHN CN(C)C(=O)N1CCC(NCc2csc(-c3ccc(C(F)(F)F)cc3)n2)CC1 ZINC000540417188 939240685 /nfs/dbraw/zinc/24/06/85/939240685.db2.gz TZNKOPRURALASE-UHFFFAOYSA-N 0 3 412.481 4.065 20 0 HIADHN COc1cccc(OC)c1OC[C@H](O)CN[C@H](c1ccc(F)cc1F)C(C)(C)C ZINC000540425987 939244829 /nfs/dbraw/zinc/24/48/29/939244829.db2.gz PXWHBADSONOORZ-QVKFZJNVSA-N 0 3 409.473 4.099 20 0 HIADHN O=C(CN[C@@H](c1cccc(F)c1)C1CCCC1)Nc1cccc(C(=O)NC2CC2)c1 ZINC000540430073 939245352 /nfs/dbraw/zinc/24/53/52/939245352.db2.gz JEKBIYQRYCAHJM-HSZRJFAPSA-N 0 3 409.505 4.178 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)Nc1cccc(Br)c1)c1ccc(-n2cccn2)cc1 ZINC000540433323 939246535 /nfs/dbraw/zinc/24/65/35/939246535.db2.gz CJSPKYGKLCPKPU-CABCVRRESA-N 0 3 413.319 4.313 20 0 HIADHN COc1ccc(CNC(=O)[C@H](C)N[C@@H](C)c2ccc(-c3cccnc3)cc2)cc1OC ZINC000540433474 939246586 /nfs/dbraw/zinc/24/65/86/939246586.db2.gz RTTZSUUKPZLURE-ROUUACIJSA-N 0 3 419.525 4.121 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(-n2cccn2)cc1)C(=O)Nc1cccc(Br)c1 ZINC000540433324 939246694 /nfs/dbraw/zinc/24/66/94/939246694.db2.gz CJSPKYGKLCPKPU-GJZGRUSLSA-N 0 3 413.319 4.313 20 0 HIADHN COc1ccc(CNC(=O)[C@@H](C)N[C@@H](C)c2ccc(-c3cccnc3)cc2)cc1OC ZINC000540433476 939246984 /nfs/dbraw/zinc/24/69/84/939246984.db2.gz RTTZSUUKPZLURE-ZWKOTPCHSA-N 0 3 419.525 4.121 20 0 HIADHN O=C(CN[C@@H](CC1CCCC1)c1ccccc1)Nc1cccc(C(=O)NC2CC2)c1 ZINC000540432338 939247028 /nfs/dbraw/zinc/24/70/28/939247028.db2.gz FUGHPYSIAOZCTF-QHCPKHFHSA-N 0 3 405.542 4.429 20 0 HIADHN COc1cc(Cl)c(C)cc1NC(=O)CN[C@@H](C)c1ccc(-n2ccnc2C)cc1 ZINC000540468044 939264835 /nfs/dbraw/zinc/26/48/35/939264835.db2.gz GQTZLURDIVXWKO-HNNXBMFYSA-N 0 3 412.921 4.440 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)N[C@H](C)C(=O)NCCc2c[nH]c3ccccc23)cc1 ZINC000540468451 939264911 /nfs/dbraw/zinc/26/49/11/939264911.db2.gz PCBCTSXERPPGAT-QZTJIDSGSA-N 0 3 415.541 4.060 20 0 HIADHN C[C@H](NCC(=O)N[C@H](c1nccs1)c1ccccc1)c1cccc(N2CCCC2)c1 ZINC000540477297 939268307 /nfs/dbraw/zinc/26/83/07/939268307.db2.gz LRNOZRVNXPHJEP-MBSDFSHPSA-N 0 3 420.582 4.300 20 0 HIADHN Cc1cc(CN(Cc2ccc3c(c2)ncn3C)CC(C)C)nc(N2CCCCC2)n1 ZINC000540503462 939279840 /nfs/dbraw/zinc/27/98/40/939279840.db2.gz JOLBMCMBAVNRRE-UHFFFAOYSA-N 0 3 406.578 4.320 20 0 HIADHN CCOC(=O)c1ccc(CNC2CCN(Cc3cccc(C(F)(F)F)c3)CC2)o1 ZINC000540523434 939287551 /nfs/dbraw/zinc/28/75/51/939287551.db2.gz OFGLRWWNPFMURP-UHFFFAOYSA-N 0 3 410.436 4.229 20 0 HIADHN CCN(C(=O)CN[C@H](c1ccc2c(c1)OCCO2)C1CC1)[C@@H](C)c1ccc(F)cc1 ZINC000540590232 939312828 /nfs/dbraw/zinc/31/28/28/939312828.db2.gz DFKKPWXGNXNSOU-FYSMJZIKSA-N 0 3 412.505 4.247 20 0 HIADHN CCc1c2cc(C)ccc2oc1[C@@H](C)NCc1ccc([C@]2(C)NC(=O)NC2=O)cc1 ZINC000540593639 939313853 /nfs/dbraw/zinc/31/38/53/939313853.db2.gz IHKHCFWFLPFUIU-MYYSRTQBSA-N 0 3 405.498 4.209 20 0 HIADHN CC[C@H](N[C@H]1CCCN(CC(F)(F)F)C1=O)c1cc(F)cc(Br)c1 ZINC000540605987 939317365 /nfs/dbraw/zinc/31/73/65/939317365.db2.gz JGZRCNWFOVPPSN-KBPBESRZSA-N 0 3 411.237 4.182 20 0 HIADHN CC[C@@H](NCc1c(C(C)C)nc2sc(C)nn12)[C@@H](c1ccc(C)cc1)n1cncn1 ZINC000540627682 939323470 /nfs/dbraw/zinc/32/34/70/939323470.db2.gz CYAYVEHAORTAKY-WIYYLYMNSA-N 0 3 423.590 4.280 20 0 HIADHN CCN1CCN(c2ccc(N[C@H](C)c3sc(CCOC)nc3C)c(C)c2)CC1 ZINC000540707756 939344790 /nfs/dbraw/zinc/34/47/90/939344790.db2.gz NGANAPTWDBYUQB-QGZVFWFLSA-N 0 3 402.608 4.264 20 0 HIADHN CCN1CCN(Cc2ccc(NC3CCC4(CC3)c3ccccc3NC4=O)cc2)CC1 ZINC000540735868 939353203 /nfs/dbraw/zinc/35/32/03/939353203.db2.gz JKXFCWIFWQSEAW-UHFFFAOYSA-N 0 3 418.585 4.069 20 0 HIADHN C[C@H](N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1)c1ccc(-n2ccnc2)cc1 ZINC000540754651 939359826 /nfs/dbraw/zinc/35/98/26/939359826.db2.gz WGXMZTVVTAAMFM-HFZDXXHNSA-N 0 3 424.548 4.451 20 0 HIADHN C[C@H](NC1(c2ccccc2)CCC1)c1ccc(S(=O)(=O)NCc2ccco2)cc1 ZINC000540767405 939364808 /nfs/dbraw/zinc/36/48/08/939364808.db2.gz SJXYLWYPLIJXCA-SFHVURJKSA-N 0 3 410.539 4.488 20 0 HIADHN CCc1ccc([C@@H](NC(=O)CN2CCC[C@@H]2C2CCOCC2)c2cccs2)cc1 ZINC000540826679 939386073 /nfs/dbraw/zinc/38/60/73/939386073.db2.gz BIJCORKBMMPOGJ-ZJSXRUAMSA-N 0 3 412.599 4.407 20 0 HIADHN CC(=O)Nc1cccc(CN2CCC(O)(Cc3ccc(OC(F)(F)F)cc3)CC2)c1 ZINC000540837328 939389991 /nfs/dbraw/zinc/38/99/91/939389991.db2.gz KTTZAPNZGVVVQF-UHFFFAOYSA-N 0 3 422.447 4.113 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](NCC(C2CC2)C2CC2)c2ccc(F)c(F)c2)c1 ZINC000540911888 939416090 /nfs/dbraw/zinc/41/60/90/939416090.db2.gz SCBDSKJSYRNRKA-QFIPXVFZSA-N 0 3 405.510 4.484 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](NCC(C2CC2)C2CC2)c2ccc(F)c(F)c2)c1 ZINC000540911887 939416405 /nfs/dbraw/zinc/41/64/05/939416405.db2.gz SCBDSKJSYRNRKA-JOCHJYFZSA-N 0 3 405.510 4.484 20 0 HIADHN Cc1cc2cc(C(=O)NCCCCN3C[C@H](C)O[C@@H](C)C3)oc2c(Br)c1 ZINC000541092465 939456649 /nfs/dbraw/zinc/45/66/49/939456649.db2.gz KFXPXNQRCJNSMH-GJZGRUSLSA-N 0 3 423.351 4.123 20 0 HIADHN CC(=O)c1ccc(NC(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)cc1Cl ZINC000541184089 939484760 /nfs/dbraw/zinc/48/47/60/939484760.db2.gz QTYJTPWAMJKWPU-UHFFFAOYSA-N 0 3 409.864 4.417 20 0 HIADHN CCN(Cc1ccc(OC)c(OC)c1)C(=O)CN[C@@H](c1ccc(Cl)cc1)C1CC1 ZINC000541203193 939485413 /nfs/dbraw/zinc/48/54/13/939485413.db2.gz VVSBQRNUYDCDHZ-HSZRJFAPSA-N 0 3 416.949 4.447 20 0 HIADHN CC(C)(C)N1CC[C@H](NCc2cc(C(N)=O)cs2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000541247696 939487456 /nfs/dbraw/zinc/48/74/56/939487456.db2.gz NRYNCHCMLXGPJJ-ZWKOTPCHSA-N 0 3 409.958 4.343 20 0 HIADHN CS(=O)(=O)Cc1ccccc1CN[C@H]1CCCc2c(Br)cccc21 ZINC000541257786 939488073 /nfs/dbraw/zinc/48/80/73/939488073.db2.gz KSCKCXGAWMJVTG-IBGZPJMESA-N 0 3 408.361 4.161 20 0 HIADHN O=C(NC1CCN(Cc2ccccc2)CC1)c1nccnc1Sc1ccccc1 ZINC000541264947 939488402 /nfs/dbraw/zinc/48/84/02/939488402.db2.gz OJMWYAVUVQXKLQ-UHFFFAOYSA-N 0 3 404.539 4.022 20 0 HIADHN COc1ccc(C(=O)N(CCN(C)C)Cc2ccc(C)o2)cc1OC1CCCC1 ZINC000541293214 939489747 /nfs/dbraw/zinc/48/97/47/939489747.db2.gz QVRHWAZLINAFAW-UHFFFAOYSA-N 0 3 400.519 4.122 20 0 HIADHN NC(=O)[C@H](Cc1ccc(C(F)(F)F)cc1)N[C@@H]1C[C@H]1c1ccccc1C(F)(F)F ZINC000541307691 939490359 /nfs/dbraw/zinc/49/03/59/939490359.db2.gz PKGAMXSOQSPRMV-UAGQMJEPSA-N 0 3 416.365 4.266 20 0 HIADHN CCOC(=O)c1c(CN2C[C@@H]3CC[C@@H](O)[C@@H]3C2)nc2ccccc2c1-c1ccccc1 ZINC000541315751 939490535 /nfs/dbraw/zinc/49/05/35/939490535.db2.gz KAJMSZROXKOHLW-JXHRLWIKSA-N 0 3 416.521 4.281 20 0 HIADHN CCOC(=O)c1c(CN2C[C@@H]3CC[C@@H](O)[C@H]3C2)nc2ccccc2c1-c1ccccc1 ZINC000541315748 939490544 /nfs/dbraw/zinc/49/05/44/939490544.db2.gz KAJMSZROXKOHLW-GREBRCKQSA-N 0 3 416.521 4.281 20 0 HIADHN CCOC(=O)c1c(CN2C[C@@H]3CC[C@H](O)[C@H]3C2)nc2ccccc2c1-c1ccccc1 ZINC000541315753 939490588 /nfs/dbraw/zinc/49/05/88/939490588.db2.gz KAJMSZROXKOHLW-LEDOBFOHSA-N 0 3 416.521 4.281 20 0 HIADHN C[C@@H](NC[C@H](O)COc1ccccc1C(F)(F)F)c1ccccc1OC(F)F ZINC000541325315 939490963 /nfs/dbraw/zinc/49/09/63/939490963.db2.gz KIIDWRSKXJILGT-OLZOCXBDSA-N 0 3 405.363 4.397 20 0 HIADHN C[C@H](N[C@H](Cc1ccc(C(F)(F)F)cc1)C(N)=O)c1cccc(OC(F)F)c1 ZINC000541328270 939491032 /nfs/dbraw/zinc/49/10/32/939491032.db2.gz SDQNDQUZAQPXNF-MEDUHNTESA-N 0 3 402.363 4.054 20 0 HIADHN CC(C)(C)c1ccc(OC[C@@H](O)CNCc2ccc(C(=O)N3CCCCC3)cc2)cc1 ZINC000563695805 945255259 /nfs/dbraw/zinc/25/52/59/945255259.db2.gz GNZDJWYWMDMBCD-QHCPKHFHSA-N 0 3 424.585 4.140 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)CCc1cc(F)ccc1Br ZINC000541398331 939505355 /nfs/dbraw/zinc/50/53/55/939505355.db2.gz IGCNGDYGOYDIEE-UHFFFAOYSA-N 0 3 409.299 4.230 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)Nc2ccc(-c3ccc[nH]3)cc2)CC1 ZINC000541450332 939519382 /nfs/dbraw/zinc/51/93/82/939519382.db2.gz SVCBEGDTGHJNAF-UHFFFAOYSA-N 0 3 417.557 4.141 20 0 HIADHN CSc1c(F)cc(NC(=O)N(C)C2CCN(CCc3ccccn3)CC2)cc1F ZINC000541467445 939527889 /nfs/dbraw/zinc/52/78/89/939527889.db2.gz UALFMDAWXQQZPP-UHFFFAOYSA-N 0 3 420.529 4.253 20 0 HIADHN C[C@H](NC(=O)N1CCC(F)(c2ccccc2C(F)(F)F)CC1)C1=CCN(C)CC1 ZINC000541551778 939553264 /nfs/dbraw/zinc/55/32/64/939553264.db2.gz HRKOYIWQFCHWSS-HNNXBMFYSA-N 0 3 413.459 4.326 20 0 HIADHN Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)NC[C@@H](O)COc1c(C)ccc(C)c1C ZINC000541600637 939564433 /nfs/dbraw/zinc/56/44/33/939564433.db2.gz OWLLGDKWRGIFCJ-MAUKXSAKSA-N 0 3 413.484 4.078 20 0 HIADHN COc1cc(-c2noc(CN[C@H](C)[C@@H](C)C3CCCCC3)n2)cc(OC)c1OC ZINC000541600314 939564540 /nfs/dbraw/zinc/56/45/40/939564540.db2.gz CTHXUHDLLADASD-HUUCEWRRSA-N 0 3 403.523 4.457 20 0 HIADHN COc1cc(-c2nnc(CN[C@@H]3C[C@@H](C)CC[C@H]3C(C)C)o2)cc(OC)c1OC ZINC000541611059 939569461 /nfs/dbraw/zinc/56/94/61/939569461.db2.gz FNKZWDAJWMGBOP-BHYGNILZSA-N 0 3 403.523 4.313 20 0 HIADHN Cc1ccc(Oc2ccccc2NC(=O)CN[C@@H](CC(N)=O)C2CCCCC2)cc1 ZINC000541628738 939575369 /nfs/dbraw/zinc/57/53/69/939575369.db2.gz SSVWVSMDSYMPGR-NRFANRHFSA-N 0 3 409.530 4.140 20 0 HIADHN COc1ccc2oc([C@H](C)NCCCS(=O)(=O)c3ccc(F)cc3)c(C)c2c1 ZINC000541651121 939587799 /nfs/dbraw/zinc/58/77/99/939587799.db2.gz LXMRPXYBONKWEM-HNNXBMFYSA-N 0 3 405.491 4.404 20 0 HIADHN COc1ccccc1[C@H](C)N(C)C(=O)CN(C)[C@@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000541700084 939608621 /nfs/dbraw/zinc/60/86/21/939608621.db2.gz SHUGBVXUTVHYAZ-WGGBDISSSA-N 0 3 414.521 4.206 20 0 HIADHN C[C@H](NCC(=O)Nc1ccc2c(c1)OC1(CCCCC1)O2)[C@@H]1COc2ccccc21 ZINC000541701360 939608849 /nfs/dbraw/zinc/60/88/49/939608849.db2.gz QVMPNKHVUWFEMC-LPHOPBHVSA-N 0 3 408.498 4.211 20 0 HIADHN C[C@H](NCC(=O)N1Cc2ccccc2[C@H](c2ccccc2)C1)[C@H]1COc2ccccc21 ZINC000541704136 939609632 /nfs/dbraw/zinc/60/96/32/939609632.db2.gz ZJTHJQKBSIHTKM-PNTFMKQHSA-N 0 3 412.533 4.315 20 0 HIADHN c1ccc([C@@H](NC2CCN(c3nc4ccccc4s3)CC2)c2cncnc2)cc1 ZINC000541740775 939618603 /nfs/dbraw/zinc/61/86/03/939618603.db2.gz CXNLPOARIVVFMM-JOCHJYFZSA-N 0 3 401.539 4.434 20 0 HIADHN C[C@@H]1CC(N[C@@H](c2ccc(Cl)cc2)c2cccc(S(C)(=O)=O)c2)C[C@@H](C)O1 ZINC000541847726 939646718 /nfs/dbraw/zinc/64/67/18/939646718.db2.gz BCTCYXUFZCVPSI-PZPWOCDFSA-N 0 3 407.963 4.379 20 0 HIADHN NC(=O)[C@@H](CNCc1ccc(-c2nc3ccccc3s2)o1)Cc1ccc(F)cc1 ZINC000541852629 939647191 /nfs/dbraw/zinc/64/71/91/939647191.db2.gz KWICVMGUCFQJIZ-OAHLLOKOSA-N 0 3 409.486 4.129 20 0 HIADHN Cc1nn(-c2ccccc2)cc1NC(=O)N(CCN(C)C)Cc1ccc(F)c(F)c1 ZINC000541906820 939650962 /nfs/dbraw/zinc/65/09/62/939650962.db2.gz YGGGJIFZHVXVMR-UHFFFAOYSA-N 0 3 413.472 4.055 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)N[C@@H](C)C(=O)Nc2ccc3c(c2)OCCCO3)cc1 ZINC000541956077 939661513 /nfs/dbraw/zinc/66/15/13/939661513.db2.gz NAQFUBQPEURRAF-SJORKVTESA-N 0 3 420.513 4.020 20 0 HIADHN CC(C)N(CCN(C)C)C(=O)Nc1ccnc(Oc2ccccc2Br)c1 ZINC000541970303 939665517 /nfs/dbraw/zinc/66/55/17/939665517.db2.gz PYLAAHLMNGRMHN-UHFFFAOYSA-N 0 3 421.339 4.440 20 0 HIADHN COc1c(C)cnc(CN2CCC(N(C)Cc3nc(C4CC4)cs3)CC2)c1C ZINC000542263957 939776577 /nfs/dbraw/zinc/77/65/77/939776577.db2.gz PTTREKKFRNFWDQ-UHFFFAOYSA-N 0 3 400.592 4.137 20 0 HIADHN COc1cccc(NC2CCN(C[C@H](O)COc3ccccc3C(F)(F)F)CC2)c1 ZINC000542277952 939782408 /nfs/dbraw/zinc/78/24/08/939782408.db2.gz XBADATJQFUAKGU-SFHVURJKSA-N 0 3 424.463 4.030 20 0 HIADHN C[C@H](C[S@](C)=O)NCc1cn(Cc2ccccc2)nc1-c1ccc(Cl)cc1 ZINC000542301843 939791436 /nfs/dbraw/zinc/79/14/36/939791436.db2.gz MQZFMIVPNKSGJF-JWIGPWBQSA-N 0 3 401.963 4.108 20 0 HIADHN c1c(CN2CCOCC3(CCOCC3)C2)c(-c2ccccc2)nn1-c1ccccc1 ZINC000542308704 939793539 /nfs/dbraw/zinc/79/35/39/939793539.db2.gz MGRNOUOOKVDDHS-UHFFFAOYSA-N 0 3 403.526 4.168 20 0 HIADHN C[C@]1(NCC(=O)N2N=C(c3cccs3)C[C@@H]2c2cccs2)CCO[C@@H]1C1CC1 ZINC000542315621 939797989 /nfs/dbraw/zinc/79/79/89/939797989.db2.gz TUBZFQWEPQGVST-HBGVWJBISA-N 0 3 415.584 4.035 20 0 HIADHN C[C@]1(NCC(=O)N2N=C(c3cccs3)C[C@@H]2c2cccs2)CCO[C@H]1C1CC1 ZINC000542315617 939798056 /nfs/dbraw/zinc/79/80/56/939798056.db2.gz TUBZFQWEPQGVST-CZAAIQMYSA-N 0 3 415.584 4.035 20 0 HIADHN O=C(CCc1cc(F)ccc1Br)N1CCCN(Cc2ccccc2)CC1 ZINC000542336925 939803092 /nfs/dbraw/zinc/80/30/92/939803092.db2.gz WMVLBYAZJABTJP-UHFFFAOYSA-N 0 3 419.338 4.255 20 0 HIADHN Cc1cn(C2CCCCC2)nc1NC(=O)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000542426448 939820188 /nfs/dbraw/zinc/82/01/88/939820188.db2.gz CWBCZDXKFBFJOR-UHFFFAOYSA-N 0 3 410.562 4.153 20 0 HIADHN Cn1cc(CN2CCC(C(=O)Nc3ccc4c(c3)OCO4)CC2)c(C2CCCCC2)n1 ZINC000542468647 939828187 /nfs/dbraw/zinc/82/81/87/939828187.db2.gz LJLIMGCMNWTOIG-UHFFFAOYSA-N 0 3 424.545 4.047 20 0 HIADHN O=C(c1ccccc1)N1CCC(CN[C@@H](c2ccccc2)c2ccc(F)cn2)CC1 ZINC000542471601 939828512 /nfs/dbraw/zinc/82/85/12/939828512.db2.gz BMTNKLSAVIZEHB-DEOSSOPVSA-N 0 3 403.501 4.452 20 0 HIADHN Cc1nn(Cc2ccc(Cl)cc2)c(C)c1CN1CCC(OC[C@@H]2CCOC2)CC1 ZINC000542485050 939831665 /nfs/dbraw/zinc/83/16/65/939831665.db2.gz GXQJRRSQXWVCFO-HXUWFJFHSA-N 0 3 417.981 4.219 20 0 HIADHN COC1CCC(N[C@H](c2cccc(S(C)(=O)=O)c2)c2ccc(F)c(F)c2)CC1 ZINC000542485787 939831671 /nfs/dbraw/zinc/83/16/71/939831671.db2.gz UNULWNACVHYHQE-MYKUNDNFSA-N 0 3 409.498 4.005 20 0 HIADHN O[C@@H](CN[C@H](Cn1cnc2ccccc21)c1ccc(F)cc1)COc1ccc(F)cc1 ZINC000542517987 939835861 /nfs/dbraw/zinc/83/58/61/939835861.db2.gz MDLKLZIKHCDQJQ-NZQKXSOJSA-N 0 3 423.463 4.085 20 0 HIADHN COC(=O)c1ccc(CNC(=O)[C@@H](C)N[C@H](Cc2ccccc2)c2cccs2)cc1 ZINC000542521031 939836570 /nfs/dbraw/zinc/83/65/70/939836570.db2.gz JIANSRPTDBDJCN-DYESRHJHSA-N 0 3 422.550 4.113 20 0 HIADHN COC(=O)C[C@H](N[C@@H](C)C(=O)N(c1nccs1)C1CCCCC1)C1CCCCC1 ZINC000542531108 939838580 /nfs/dbraw/zinc/83/85/80/939838580.db2.gz KAJBQFOPVYIDON-LPHOPBHVSA-N 0 3 421.607 4.299 20 0 HIADHN COC(=O)C[C@@H](N[C@H](C)C(=O)Nc1ccccc1C(F)(F)F)C1CCCCC1 ZINC000542534163 939839103 /nfs/dbraw/zinc/83/91/03/939839103.db2.gz YGHLDNWSNSLCLP-CXAGYDPISA-N 0 3 400.441 4.134 20 0 HIADHN C[C@@H]1N(C(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)CCC12CCOCC2 ZINC000542554596 939842771 /nfs/dbraw/zinc/84/27/71/939842771.db2.gz OXUUTWIEGSDWHC-RBUKOAKNSA-N 0 3 405.608 4.122 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1NC(=O)[C@H](C)N[C@H](C)[C@@H]1Oc2ccccc2[C@H]1C ZINC000542610725 939848229 /nfs/dbraw/zinc/84/82/29/939848229.db2.gz LQCLSKALYHNLKG-XWFIKDQWSA-N 0 3 418.541 4.359 20 0 HIADHN C[C@@H](NCC(=O)NCc1ccc(COc2ccccc2)cc1)[C@H]1COc2ccccc21 ZINC000542626308 939850157 /nfs/dbraw/zinc/85/01/57/939850157.db2.gz ICAACSVOPBLRBZ-NTKDMRAZSA-N 0 3 416.521 4.036 20 0 HIADHN Cc1ccc(CN(C(=O)CN(C)[C@H]2CCO[C@@H](c3ccc(F)cc3)C2)C2CC2)o1 ZINC000542630260 939850257 /nfs/dbraw/zinc/85/02/57/939850257.db2.gz ASRIEVMIISEJKD-RBBKRZOGSA-N 0 3 400.494 4.070 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@H]2CCCC[C@@H]2NCc2cccc(-n3ccnc3)c2)cc1 ZINC000542660117 939852208 /nfs/dbraw/zinc/85/22/08/939852208.db2.gz CZUHIAQXSWHVLY-GOTSBHOMSA-N 0 3 409.555 4.055 20 0 HIADHN C[C@@H](CC(=O)Nc1cccc(N2CCCC2)c1)NCc1ccccc1OC(F)F ZINC000542699101 939855120 /nfs/dbraw/zinc/85/51/20/939855120.db2.gz GBAVRLXGJFBBIG-INIZCTEOSA-N 0 3 403.473 4.395 20 0 HIADHN O=C(Nc1cccc(C(F)F)c1Cl)N[C@H]1CCN(Cc2ccccc2)C[C@H]1CO ZINC000542721587 939856778 /nfs/dbraw/zinc/85/67/78/939856778.db2.gz IAQGPTSZURQVLZ-RDJZCZTQSA-N 0 3 423.891 4.282 20 0 HIADHN COc1cc(Br)ccc1CNCCc1nc(-c2ccccn2)cs1 ZINC000542835897 939861876 /nfs/dbraw/zinc/86/18/76/939861876.db2.gz BXSYEMDSWFJNEJ-UHFFFAOYSA-N 0 3 404.333 4.309 20 0 HIADHN Cc1cc2c(cc1NC(=O)N(CCN(C)C)Cc1ccc(C(F)(F)F)cc1)OCO2 ZINC000542838741 939862144 /nfs/dbraw/zinc/86/21/44/939862144.db2.gz HEHMKKSCHWXFFK-UHFFFAOYSA-N 0 3 423.435 4.338 20 0 HIADHN Cc1cc(C)n(-c2ccc(C(F)(F)F)cc2NC(=O)N(CCN(C)C)C(C)C)n1 ZINC000542900100 939874972 /nfs/dbraw/zinc/87/49/72/939874972.db2.gz JKYOKAUULBXDNM-UHFFFAOYSA-N 0 3 411.472 4.312 20 0 HIADHN Cc1cc2cc(C(=O)N(CCN(C)C)Cc3ccco3)oc2c(Br)c1 ZINC000542928051 939879519 /nfs/dbraw/zinc/87/95/19/939879519.db2.gz PBCAXXTURHDKIR-UHFFFAOYSA-N 0 3 405.292 4.301 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)CC3CCC(C(F)(F)F)CC3)CC2)C[C@H](C)O1 ZINC000543073436 939924483 /nfs/dbraw/zinc/92/44/83/939924483.db2.gz WRBUSCCCATZQEE-GIOYIUAESA-N 0 3 404.517 4.093 20 0 HIADHN O=S(=O)(c1ccccc1CNC1CC(c2ccccc2F)C1)N1CCCCC1 ZINC000543074477 939925706 /nfs/dbraw/zinc/92/57/06/939925706.db2.gz RHIFDNOBIAUDKG-UHFFFAOYSA-N 0 3 402.535 4.036 20 0 HIADHN C[C@H](CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)NCC(=O)NC1CCCCC1 ZINC000543090505 939937020 /nfs/dbraw/zinc/93/70/20/939937020.db2.gz PHQYNRPWFFCPQN-GFCCVEGCSA-N 0 3 419.875 4.114 20 0 HIADHN C[C@@H](CC(=O)Nc1ccc(NC(=O)C2CC2)cc1)NCc1ccc(OC(C)(C)C)nc1 ZINC000543112970 939952123 /nfs/dbraw/zinc/95/21/23/939952123.db2.gz LEJOIYLFWCUUQS-INIZCTEOSA-N 0 3 424.545 4.114 20 0 HIADHN CCNC(=O)COc1cccc(CN[C@@H]2CCCc3c(Br)cccc32)c1 ZINC000543113533 939952161 /nfs/dbraw/zinc/95/21/61/939952161.db2.gz BOJHZKMAGDTLEP-HXUWFJFHSA-N 0 3 417.347 4.131 20 0 HIADHN COc1ccc(C(=O)N(CCN(C)C)Cc2cccs2)cc1OC1CCCC1 ZINC000543161655 939981925 /nfs/dbraw/zinc/98/19/25/939981925.db2.gz ONUGCMSKYVPLDM-UHFFFAOYSA-N 0 3 402.560 4.282 20 0 HIADHN CN(CC(=O)N(Cc1nnc(-c2ccccc2Cl)o1)C1CC1)C[C@@H]1CC=CCC1 ZINC000543178861 939987155 /nfs/dbraw/zinc/98/71/55/939987155.db2.gz KHXXDYMYBBXJLM-MRXNPFEDSA-N 0 3 414.937 4.169 20 0 HIADHN C[C@@H](CN(C)C(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1)c1nccs1 ZINC000543187518 939990261 /nfs/dbraw/zinc/99/02/61/939990261.db2.gz XIDHLIYZCDBXAW-IRXDYDNUSA-N 0 3 406.621 4.423 20 0 HIADHN CN(C)c1cccc([C@H]2CCCN2[C@@H](Cc2ccc(C(F)(F)F)cc2)C(N)=O)c1 ZINC000543202698 939994578 /nfs/dbraw/zinc/99/45/78/939994578.db2.gz KQWUGSBFUKYQTJ-UXHICEINSA-N 0 3 405.464 4.005 20 0 HIADHN O[C@H](COc1ccccc1C(F)(F)F)CN1CCC(OCCc2ccccc2)CC1 ZINC000543207409 939996203 /nfs/dbraw/zinc/99/62/03/939996203.db2.gz PHZBRDKQLRJSPC-IBGZPJMESA-N 0 3 423.475 4.169 20 0 HIADHN Cc1cc(Br)cn2c(CN[C@H](c3ccccc3)[C@@H]3CCOC3)cnc12 ZINC000543238826 940004820 /nfs/dbraw/zinc/00/48/20/940004820.db2.gz OYHYJMGYVNTTCN-VQIMIIECSA-N 0 3 400.320 4.273 20 0 HIADHN CCN(CC)[C@H](CNC(=O)[C@H](C)c1c(C)n[nH]c1C)c1ccc(C(F)(F)F)cc1 ZINC000543251597 940008702 /nfs/dbraw/zinc/00/87/02/940008702.db2.gz PPCLELYQEYJHCQ-FZKQIMNGSA-N 0 3 410.484 4.348 20 0 HIADHN Cc1ccnn1-c1ccccc1NC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC000543347404 940037194 /nfs/dbraw/zinc/03/71/94/940037194.db2.gz JHLVTQDXGMPJGJ-LJQANCHMSA-N 0 3 403.530 4.309 20 0 HIADHN Cc1nc(CC(=O)N[C@@H](c2ccc(F)c(F)c2)C(C)(C)N2CCCC2)c(C)s1 ZINC000543389238 940048608 /nfs/dbraw/zinc/04/86/08/940048608.db2.gz DLJARVPRTXREEC-FQEVSTJZSA-N 0 3 407.530 4.313 20 0 HIADHN O=C(CN1CCC(N[C@H](c2ccc(F)cc2)c2cccnc2)CC1)Nc1ccccc1 ZINC000543409116 940056009 /nfs/dbraw/zinc/05/60/09/940056009.db2.gz GPEDIXQCVJOWLP-RUZDIDTESA-N 0 3 418.516 4.003 20 0 HIADHN OC[C@]1(Cc2ccc(F)cc2)CCN(CCc2cc(Cl)c3c(c2)OCCCO3)C1 ZINC000563769999 945293085 /nfs/dbraw/zinc/29/30/85/945293085.db2.gz HQUOPLBKMYDLEY-QHCPKHFHSA-N 0 3 419.924 4.110 20 0 HIADHN O=C(Cc1nc(-c2ccc(F)cc2)cs1)NC[C@H](c1ccccc1)N1CCCC1 ZINC000543416677 940058511 /nfs/dbraw/zinc/05/85/11/940058511.db2.gz ABIIDZWFXFCXMJ-OAQYLSRUSA-N 0 3 409.530 4.445 20 0 HIADHN O=S1(=O)CCCC[C@@H]1CN[C@H]1CCCc2nc(-c3ccc(Cl)cc3)sc21 ZINC000543428672 940061302 /nfs/dbraw/zinc/06/13/02/940061302.db2.gz DAIGMMMKLQQCHG-CVEARBPZSA-N 0 3 410.992 4.398 20 0 HIADHN O=S1(=O)CCCC[C@H]1CN[C@H]1CCCc2nc(-c3ccc(Cl)cc3)sc21 ZINC000543428673 940061781 /nfs/dbraw/zinc/06/17/81/940061781.db2.gz DAIGMMMKLQQCHG-HOTGVXAUSA-N 0 3 410.992 4.398 20 0 HIADHN COc1ccc(NC(C)=O)cc1NC(=O)[C@H](C)N[C@H](CC(C)C)c1cccs1 ZINC000543486167 940080066 /nfs/dbraw/zinc/08/00/66/940080066.db2.gz SQACARAWHXXALS-KBXCAEBGSA-N 0 3 403.548 4.419 20 0 HIADHN COc1ccc(NC(C)=O)cc1NC(=O)[C@@H](C)N[C@@H](CC(C)C)c1cccs1 ZINC000543486169 940080173 /nfs/dbraw/zinc/08/01/73/940080173.db2.gz SQACARAWHXXALS-KDOFPFPSSA-N 0 3 403.548 4.419 20 0 HIADHN CC[C@@H](NCC(=O)Nc1cc(C(F)(F)F)ccc1N1CCCCC1)[C@H]1CCCO1 ZINC000543496734 940084781 /nfs/dbraw/zinc/08/47/81/940084781.db2.gz LRRASVOKPLIGOQ-VQIMIIECSA-N 0 3 413.484 4.181 20 0 HIADHN CC(=O)c1cccc(OC[C@@H](O)CN[C@H](C)c2sc(-c3ccccc3)nc2C)c1 ZINC000543520170 940094977 /nfs/dbraw/zinc/09/49/77/940094977.db2.gz UFSIGJJSLPQNLO-QRWLVFNGSA-N 0 3 410.539 4.412 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Cc1ccc2c(c1)COC2)c1ccc(C(F)(F)F)cc1 ZINC000543537141 940097646 /nfs/dbraw/zinc/09/76/46/940097646.db2.gz NIEBZIRNIKRWNB-OAQYLSRUSA-N 0 3 420.475 4.477 20 0 HIADHN Cc1cc(NC(=O)[C@H](C)N[C@@H](C)[C@H]2COc3ccccc32)ccc1Br ZINC000543552354 940106098 /nfs/dbraw/zinc/10/60/98/940106098.db2.gz UUNBEFHOAQQZQK-GRDNDAEWSA-N 0 3 403.320 4.239 20 0 HIADHN C[C@H](c1ccc(F)cc1)N(C)C(=O)CN(C)[C@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000543558964 940108463 /nfs/dbraw/zinc/10/84/63/940108463.db2.gz OQVYOXJIYNIPFT-XGRCMKMKSA-N 0 3 402.485 4.336 20 0 HIADHN C[C@@H]1N(CC(=O)N[C@@H](c2ccccc2)c2ccc(Cl)cc2)CCC12CCOCC2 ZINC000543574861 940115940 /nfs/dbraw/zinc/11/59/40/940115940.db2.gz RMOYEBJXHPDZEG-MBSDFSHPSA-N 0 3 412.961 4.437 20 0 HIADHN Brc1cccc(N2CC[C@H](CN[C@@H](c3ccccc3)c3cncnc3)C2)c1 ZINC000543601136 940127218 /nfs/dbraw/zinc/12/72/18/940127218.db2.gz VWFYXRWNHTYVME-VGSWGCGISA-N 0 3 423.358 4.445 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@@H]2NC[C@@H](c2ccsc2)N(C)C)cc1 ZINC000543607942 940129477 /nfs/dbraw/zinc/12/94/77/940129477.db2.gz LWYUARQXRPTWSS-PCCBWWKXSA-N 0 3 406.617 4.034 20 0 HIADHN CCCOc1c(Br)cc(CN2CCC[C@H](c3nnc(C)[nH]3)C2)cc1OC ZINC000543621234 940136459 /nfs/dbraw/zinc/13/64/59/940136459.db2.gz JNYIOXQFFMDOOF-HNNXBMFYSA-N 0 3 423.355 4.053 20 0 HIADHN Cc1cc(NC(=O)NC[C@@H](C)c2nccs2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000543631898 940143138 /nfs/dbraw/zinc/14/31/38/940143138.db2.gz UEBXMGICOQHXBT-APWZRJJASA-N 0 3 424.574 4.020 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)NCC(=O)Nc2ccnn2CC2CCCCC2)cc1 ZINC000543813865 940196223 /nfs/dbraw/zinc/19/62/23/940196223.db2.gz XYNOHPUQWJTHFC-SFHVURJKSA-N 0 3 420.561 4.247 20 0 HIADHN CN1CC[C@H](CNCc2ncc(Br)s2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000543848973 940207716 /nfs/dbraw/zinc/20/77/16/940207716.db2.gz DKPWVABTZKBDTH-BZNIZROVSA-N 0 3 418.763 4.481 20 0 HIADHN CN(C)c1ncc(CN[C@H]2CCN(C(C)(C)C)[C@H]2c2ccc(Cl)c(F)c2)cn1 ZINC000543850669 940208318 /nfs/dbraw/zinc/20/83/18/940208318.db2.gz WGKWFWZKTZQPNN-OALUTQOASA-N 0 3 405.949 4.039 20 0 HIADHN C[C@H](NC[C@H](O)COc1ccc(-c2ccccc2)cc1)c1ccc([S@@](C)=O)cc1 ZINC000543898399 940231761 /nfs/dbraw/zinc/23/17/61/940231761.db2.gz ZPCOMGKLUHGZSB-RHJMBEETSA-N 0 3 409.551 4.182 20 0 HIADHN O[C@H](CNCc1cccc(OC(F)(F)F)c1)COc1ccc(C(F)(F)F)cc1 ZINC000563826728 945306234 /nfs/dbraw/zinc/30/62/34/945306234.db2.gz FVBMMOAQWBQHDN-CQSZACIVSA-N 0 3 409.326 4.134 20 0 HIADHN COc1ccc(CN(C)C(=O)CN[C@@H](c2ccc(Cl)cc2)C2CC2)cc1OC ZINC000543989786 940286157 /nfs/dbraw/zinc/28/61/57/940286157.db2.gz AUNCFAKIIGPDPD-JOCHJYFZSA-N 0 3 402.922 4.057 20 0 HIADHN COC(=O)c1cccc(NC(=O)C[C@@H](C)NCc2ccc(Oc3ccccc3)nc2)c1 ZINC000543991792 940287551 /nfs/dbraw/zinc/28/75/51/940287551.db2.gz DWCSLFKESJKQBP-QGZVFWFLSA-N 0 3 419.481 4.167 20 0 HIADHN C[C@H](N[C@@H]1CCCN(Cc2nccn2C)C1=O)c1ccc(-c2ccc(F)cc2)s1 ZINC000544014060 940299531 /nfs/dbraw/zinc/29/95/31/940299531.db2.gz JNAAZCFSGQOMEN-MAUKXSAKSA-N 0 3 412.534 4.130 20 0 HIADHN CC(C)(C)N(Cc1ccccc1)C(=O)CN[C@H]1c2ccccc2CC12CCOCC2 ZINC000563839066 945310845 /nfs/dbraw/zinc/31/08/45/945310845.db2.gz AUUZPTDEHCPTIL-DEOSSOPVSA-N 0 3 406.570 4.498 20 0 HIADHN C[C@@H]1C[C@H](c2ccccc2)CCN1C(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000544110077 940328850 /nfs/dbraw/zinc/32/88/50/940328850.db2.gz KBRSKJSVWXDVAR-IFMALSPDSA-N 0 3 421.585 4.121 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3CC[C@@](F)(c4ccccc4)C3)c(C)c2)CC1 ZINC000563862563 945316095 /nfs/dbraw/zinc/31/60/95/945316095.db2.gz FLWRNPFBNUTCOG-DEOSSOPVSA-N 0 3 410.537 4.240 20 0 HIADHN Cc1cc(NC(=O)NC[C@H]2CCCCS2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000544266229 940373019 /nfs/dbraw/zinc/37/30/19/940373019.db2.gz QPZFCNTYXAHTKX-WOJBJXKFSA-N 0 3 413.591 4.046 20 0 HIADHN Cc1ccnn1-c1ccccc1NC(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000544304678 940385056 /nfs/dbraw/zinc/38/50/56/940385056.db2.gz FXBUAMGGADHZLU-UHFFFAOYSA-N 0 3 403.530 4.309 20 0 HIADHN Cc1ccc(S[C@@H](C)c2nc(-c3ccc(N4CCCN(C)CC4)nc3)no2)cc1 ZINC000544346678 940396340 /nfs/dbraw/zinc/39/63/40/940396340.db2.gz ZURMAOZXIVPQCC-KRWDZBQOSA-N 0 3 409.559 4.435 20 0 HIADHN Cc1cc([C@@H](NC[C@@H](c2cccs2)N2CCN(C)CC2)c2cccnc2)ccc1F ZINC000544360662 940401742 /nfs/dbraw/zinc/40/17/42/940401742.db2.gz PFIUYHOUAPJRJT-LADGPHEKSA-N 0 3 424.589 4.258 20 0 HIADHN Cc1nn(-c2ccccc2)c(Oc2cccc(F)c2)c1CN1C[C@@H]2CC[C@H](O)[C@H]2C1 ZINC000544368154 940403872 /nfs/dbraw/zinc/40/38/72/940403872.db2.gz GSDNKIJESAEVJX-RTFZILSDSA-N 0 3 407.489 4.315 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cc(N(C)C)nc4ccccc43)c(C)c2)CC1 ZINC000544398673 940411766 /nfs/dbraw/zinc/41/17/66/940411766.db2.gz CDSMUUWFDVZCGG-UHFFFAOYSA-N 0 3 417.557 4.003 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)CN[C@@H](c2cccs2)C2CC2)c(C(F)(F)F)c1 ZINC000544400353 940412471 /nfs/dbraw/zinc/41/24/71/940412471.db2.gz UPCOMHXJROPERS-GOSISDBHSA-N 0 3 411.449 4.405 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1cnn(-c2ccccc2)c1C(F)(F)F ZINC000544404868 940414044 /nfs/dbraw/zinc/41/40/44/940414044.db2.gz QVKBVAOMGOSEKK-UHFFFAOYSA-N 0 3 421.423 4.080 20 0 HIADHN CCc1cnccc1[C@H](C)NC[C@H](NS(=O)(=O)c1ccc(C)cc1)c1ccccc1 ZINC000544451708 940436521 /nfs/dbraw/zinc/43/65/21/940436521.db2.gz QDAINYNQPVMNIE-CYFREDJKSA-N 0 3 423.582 4.323 20 0 HIADHN CCOc1ncccc1-c1noc([C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)n1 ZINC000544481175 940450629 /nfs/dbraw/zinc/45/06/29/940450629.db2.gz IOMAVGYAMHWFQK-HXUWFJFHSA-N 0 3 418.419 4.236 20 0 HIADHN C[C@H](NCC(=O)N(C)Cc1cc(Br)cs1)[C@@H]1Oc2ccccc2[C@H]1C ZINC000544514113 940465279 /nfs/dbraw/zinc/46/52/79/940465279.db2.gz HRUUHGOJBPTLGD-QHRIQVFBSA-N 0 3 423.376 4.012 20 0 HIADHN C[C@H](NCC(=O)N[C@H](c1cccs1)c1ccc(F)cc1)[C@H]1COc2ccccc21 ZINC000544527784 940472168 /nfs/dbraw/zinc/47/21/68/940472168.db2.gz CTRHUBAUPIDARP-YWBKXGLFSA-N 0 3 410.514 4.247 20 0 HIADHN Cc1ccc([C@H](NC(=O)CN[C@H](C)[C@H]2COc3ccccc32)c2cccs2)cc1 ZINC000544528185 940472445 /nfs/dbraw/zinc/47/24/45/940472445.db2.gz GXGPIONFTDBKEO-PWAGRJGVSA-N 0 3 406.551 4.416 20 0 HIADHN CCN1CCN(CCNC(=O)c2ccc(C)cc2Sc2ccc(Cl)cc2)CC1 ZINC000544745281 940510032 /nfs/dbraw/zinc/51/00/32/940510032.db2.gz CEZYGQQCZYIKJP-UHFFFAOYSA-N 0 3 418.006 4.167 20 0 HIADHN COC(=O)[C@@H](C)Cc1ccc(NC(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000544802054 940515662 /nfs/dbraw/zinc/51/56/62/940515662.db2.gz XEUICUNSQNEAOX-WMZHIEFXSA-N 0 3 423.557 4.167 20 0 HIADHN CCc1cnc(CNC2CCN(C(=O)c3ccc(Br)cc3C)CC2)s1 ZINC000544826309 940517754 /nfs/dbraw/zinc/51/77/54/940517754.db2.gz CPGNPCKRWCFLQC-UHFFFAOYSA-N 0 3 422.392 4.171 20 0 HIADHN CCN(C(=O)CCCc1nc(-c2cccs2)no1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000544848342 940519015 /nfs/dbraw/zinc/51/90/15/940519015.db2.gz UXGPZOHGOTUSIQ-LJQANCHMSA-N 0 3 424.570 4.244 20 0 HIADHN CCN(C(=O)c1ccc(NC(=O)[C@@H]2C[C@@H]2C)cc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000544871735 940520727 /nfs/dbraw/zinc/52/07/27/940520727.db2.gz LWNVWQICWVSSQS-OFAXGOBFSA-N 0 3 405.542 4.018 20 0 HIADHN COC[C@@H](NCCc1cn2cc(Br)cc(C)c2n1)c1ccc(F)c(F)c1 ZINC000544893448 940522662 /nfs/dbraw/zinc/52/26/62/940522662.db2.gz FRLJKHJATAEAPK-GOSISDBHSA-N 0 3 424.289 4.203 20 0 HIADHN COc1ccc(C(=O)CCc2nc(-c3ccccc3CN3CCCC3)no2)cc1F ZINC000544903445 940523404 /nfs/dbraw/zinc/52/34/04/940523404.db2.gz FLUMSDOZSHUKBL-UHFFFAOYSA-N 0 3 409.461 4.296 20 0 HIADHN CN(C)Cc1ccc(-c2noc(-c3ccc(Oc4ccc(C(N)=O)cc4)cc3)n2)cc1 ZINC000544917988 940525237 /nfs/dbraw/zinc/52/52/37/940525237.db2.gz TYGZACIIFMYNTG-UHFFFAOYSA-N 0 3 414.465 4.356 20 0 HIADHN c1cnn(Cc2ccc(-c3noc(-c4ccc(CN5CCSCC5)cc4)n3)cc2)c1 ZINC000545036863 940535706 /nfs/dbraw/zinc/53/57/06/940535706.db2.gz NTKRBDAZPWQCIE-UHFFFAOYSA-N 0 3 417.538 4.197 20 0 HIADHN COc1cc(CN2CCC(C)(CO)CC2)ccc1OCCOc1ccccc1Cl ZINC000545166372 940553299 /nfs/dbraw/zinc/55/32/99/940553299.db2.gz VNRUFQJJJTUQBJ-UHFFFAOYSA-N 0 3 419.949 4.401 20 0 HIADHN COc1ccc(NC(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)c2ncccc12 ZINC000545314824 940561575 /nfs/dbraw/zinc/56/15/75/940561575.db2.gz HMSNUJPPAQDLED-UHFFFAOYSA-N 0 3 404.514 4.026 20 0 HIADHN CC[C@@H]1CN(C(=O)c2oc3ccccc3c2CN(C)C)CCN1Cc1ccccc1 ZINC000545445706 940570272 /nfs/dbraw/zinc/57/02/72/940570272.db2.gz SSYLRTRDAHYGFQ-HXUWFJFHSA-N 0 3 405.542 4.231 20 0 HIADHN COc1ccc(C(=O)C(=O)N(C)[C@H]2CCN(Cc3ccccc3)[C@H](C)C2)cc1Cl ZINC000545475268 940571253 /nfs/dbraw/zinc/57/12/53/940571253.db2.gz FLFOWEZBLBHDFK-APWZRJJASA-N 0 3 414.933 4.043 20 0 HIADHN CCN(C(=O)c1csc(Cc2ccccc2)n1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000545475964 940571409 /nfs/dbraw/zinc/57/14/09/940571409.db2.gz VXTDUZKIYGPDFM-NRFANRHFSA-N 0 3 405.567 4.471 20 0 HIADHN COc1ccc(NC(=O)N(CCN(C)C)Cc2cccc(F)c2)cc1OC(C)C ZINC000545515216 940572718 /nfs/dbraw/zinc/57/27/18/940572718.db2.gz RXJSKLUQZXIZLR-UHFFFAOYSA-N 0 3 403.498 4.217 20 0 HIADHN C/C(=C/c1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1)c1ccccc1Cl ZINC000545656404 940579187 /nfs/dbraw/zinc/57/91/87/940579187.db2.gz LZBSEDLFGFLOSV-PEZBUJJGSA-N 0 3 409.921 4.487 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(-c4cc(F)c(Cl)cc4Cl)n3)cn2)CC1 ZINC000545659940 940579360 /nfs/dbraw/zinc/57/93/60/940579360.db2.gz OPOGURGVHYQGKS-UHFFFAOYSA-N 0 3 422.291 4.386 20 0 HIADHN c1c(CN2CCOC3(CCOCC3)CC2)c(-c2ccccc2)nn1-c1ccccc1 ZINC000545974705 940668977 /nfs/dbraw/zinc/66/89/77/940668977.db2.gz KADUUERIIZHREM-UHFFFAOYSA-N 0 3 403.526 4.311 20 0 HIADHN C[C@@H](N[C@@H]1COc2ccc(F)cc2C1)c1ccc(S(=O)(=O)C2CCCC2)cc1 ZINC000563998776 945340475 /nfs/dbraw/zinc/34/04/75/945340475.db2.gz NDBMDGNUVUPAAX-BEFAXECRSA-N 0 3 403.519 4.196 20 0 HIADHN CCO[C@@H]1C[C@H](N[C@@H](C)c2ccc(OC(F)F)cc2OC(F)F)[C@]12CCCO2 ZINC000546166884 940719864 /nfs/dbraw/zinc/71/98/64/940719864.db2.gz SLDUWPZCCZMZTR-MYRBDLLGSA-N 0 3 407.404 4.267 20 0 HIADHN COc1ccc(CN[C@@H]2CCO[C@H](c3ccc(F)cc3)C2)c(Br)c1O ZINC000546176340 940721866 /nfs/dbraw/zinc/72/18/66/940721866.db2.gz BGFXSHSQUWSARJ-WBVHZDCISA-N 0 3 410.283 4.312 20 0 HIADHN CCN(C(=O)[C@H](C)Cc1ccc(OC)c(OC)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000546182655 940723327 /nfs/dbraw/zinc/72/33/27/940723327.db2.gz IXGUXRMOAHVHCL-DENIHFKCSA-N 0 3 410.558 4.005 20 0 HIADHN Fc1cc(Br)cc(-c2noc([C@H]3CCCN(Cc4cccnc4)C3)n2)c1 ZINC000546272097 940755662 /nfs/dbraw/zinc/75/56/62/940755662.db2.gz VOMNIWLONOKCHD-AWEZNQCLSA-N 0 3 417.282 4.413 20 0 HIADHN CC(C)c1nn(-c2ccc(Br)cc2)cc1CN1CC[C@H](CO)C[C@@H]1C ZINC000564007202 945346300 /nfs/dbraw/zinc/34/63/00/945346300.db2.gz XUNYLZRAVUJSJA-HOTGVXAUSA-N 0 3 406.368 4.351 20 0 HIADHN c1cnn(Cc2ccccc2-c2noc(-c3ccc(CN4CCSCC4)cc3)n2)c1 ZINC000546288378 940765907 /nfs/dbraw/zinc/76/59/07/940765907.db2.gz PXPDJHCNOMCASX-UHFFFAOYSA-N 0 3 417.538 4.197 20 0 HIADHN FC(F)(F)c1ccc(Cc2noc(C3CCN(Cc4ccccc4)CC3)n2)nc1 ZINC000546300591 940771442 /nfs/dbraw/zinc/77/14/42/940771442.db2.gz OKRVZTRSRYTDPD-UHFFFAOYSA-N 0 3 402.420 4.454 20 0 HIADHN c1cn(-c2cccc(-c3noc(-c4ccc(CN5CCSCC5)cc4)n3)c2)cn1 ZINC000546403942 940812011 /nfs/dbraw/zinc/81/20/11/940812011.db2.gz YOKYSVAOMMNCOB-UHFFFAOYSA-N 0 3 403.511 4.138 20 0 HIADHN Cc1cc(C(=O)N[C@@H](CN2CCCC2)c2ccccc2)c(C)n1Cc1ccncc1 ZINC000546582232 940857479 /nfs/dbraw/zinc/85/74/79/940857479.db2.gz XHWXAHACSXJUIJ-DEOSSOPVSA-N 0 3 402.542 4.115 20 0 HIADHN CC[C@@H](N[C@H](C)CCN1C(=O)c2ccccc2C1=O)c1nc(C(F)(F)F)cs1 ZINC000546660791 940866514 /nfs/dbraw/zinc/86/65/14/940866514.db2.gz KEXIYZHBXNPNQY-BXUZGUMPSA-N 0 3 411.449 4.277 20 0 HIADHN COc1ccc(C2(C(=O)NC[C@@H](c3ccc(C)cc3)N3CCCC3)CCOCC2)cc1 ZINC000546702390 940870782 /nfs/dbraw/zinc/87/07/82/940870782.db2.gz SRGOCYMGOQQWQL-DEOSSOPVSA-N 0 3 422.569 4.005 20 0 HIADHN Cn1cc(C(C)(C)NC[C@@H](O)COc2ccc(C(C)(C)c3ccccc3)cc2)cn1 ZINC000546705160 940871248 /nfs/dbraw/zinc/87/12/48/940871248.db2.gz MXHAJFHVGIKWHY-JOCHJYFZSA-N 0 3 407.558 4.011 20 0 HIADHN CCN1CCN(CCNC(=O)c2cc(C)ccc2Sc2ccc(Cl)cc2)CC1 ZINC000546797995 940885120 /nfs/dbraw/zinc/88/51/20/940885120.db2.gz RSCUTECAOYKPTJ-UHFFFAOYSA-N 0 3 418.006 4.167 20 0 HIADHN CCO[C@@H]1C[C@H](N[C@H](C)c2ccc(OC[C@@H]3CCCCO3)c(F)c2)[C@@]12CCCO2 ZINC000546869638 940898447 /nfs/dbraw/zinc/89/84/47/940898447.db2.gz FILAJKMKACLLNU-JPPXYHIZSA-N 0 3 407.526 4.151 20 0 HIADHN COc1ccc2oc(-c3nc(-c4ccc(N5CCCN(C)CC5)nc4)no3)c(C)c2c1 ZINC000547071221 940983764 /nfs/dbraw/zinc/98/37/64/940983764.db2.gz YELIJMHZTMAHEQ-UHFFFAOYSA-N 0 3 419.485 4.004 20 0 HIADHN c1cncc(CN2CCC[C@@H](c3nc(-c4ccc(OC5CCOCC5)cc4)no3)C2)c1 ZINC000547202833 941031401 /nfs/dbraw/zinc/03/14/01/941031401.db2.gz MTBRTKNNNALIFT-HXUWFJFHSA-N 0 3 420.513 4.069 20 0 HIADHN CC1=CCN(CCNCc2cc(Br)ccc2OCc2ccccn2)CC1 ZINC000547273035 941050113 /nfs/dbraw/zinc/05/01/13/941050113.db2.gz WXEIZLNFAUSJFN-UHFFFAOYSA-N 0 3 416.363 4.165 20 0 HIADHN C[C@@](O)(C1CCN(CCC(=O)Nc2ccccc2C(F)(F)F)CC1)C(F)(F)F ZINC000547345616 941057508 /nfs/dbraw/zinc/05/75/08/941057508.db2.gz KRPMXMDPIACVJV-MRXNPFEDSA-N 0 3 412.374 4.059 20 0 HIADHN CCN(C(=O)Nc1cc(-c2nc(C)no2)ccc1C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000547464865 941064240 /nfs/dbraw/zinc/06/42/40/941064240.db2.gz RJJGDBGYIXDCLP-OAQYLSRUSA-N 0 3 419.529 4.482 20 0 HIADHN CC(=O)[C@@H]1C[C@H](CC(=O)Nc2c(C)cnn2[C@H]2CCN(Cc3ccccc3)C2)C1(C)C ZINC000547535123 941067875 /nfs/dbraw/zinc/06/78/75/941067875.db2.gz JHACQXONQPHNSP-FSSWDIPSSA-N 0 3 422.573 4.218 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)N[C@@H]1CCOc2ccc(F)cc21 ZINC000547713791 941073175 /nfs/dbraw/zinc/07/31/75/941073175.db2.gz HDWVUMWHQYSKTH-LJQANCHMSA-N 0 3 405.901 4.076 20 0 HIADHN CCN(C(=O)Nc1cnc2c(cnn2C(C)C)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000547786327 941075833 /nfs/dbraw/zinc/07/58/33/941075833.db2.gz UMROOHOCPIFIFJ-OAQYLSRUSA-N 0 3 406.534 4.141 20 0 HIADHN CN(C(=O)N[C@H](c1ccccc1)C(F)(F)F)C1CCN(CCc2ccccn2)CC1 ZINC000548170714 941090396 /nfs/dbraw/zinc/09/03/96/941090396.db2.gz FRMLHXIHSWLWKG-HXUWFJFHSA-N 0 3 420.479 4.034 20 0 HIADHN C[C@@H](C(=O)Nc1ccc(Oc2ccc(S(C)(=O)=O)cc2)cc1)N1[C@H](C)CC[C@H]1C ZINC000548372864 941098186 /nfs/dbraw/zinc/09/81/86/941098186.db2.gz DZCDCPMESZBHNE-ZACQAIPSSA-N 0 3 416.543 4.082 20 0 HIADHN CC(=O)[C@@H]1C[C@H](C(=O)N2CCC(N(C)Cc3cccc(C(F)(F)F)c3)CC2)C1(C)C ZINC000548373190 941098189 /nfs/dbraw/zinc/09/81/89/941098189.db2.gz WMIQSSFVCYQJEP-VQTJNVASSA-N 0 3 424.507 4.380 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](N[C@H]2CCC23CCOCC3)c2ccc(Cl)cc2)c1 ZINC000548858640 941126893 /nfs/dbraw/zinc/12/68/93/941126893.db2.gz VUXWNVSAVGOQBQ-LEWJYISDSA-N 0 3 419.974 4.382 20 0 HIADHN COc1ccc2ccccc2c1-c1cc(CN2CCC[C@H](c3ccnc(N)n3)C2)on1 ZINC000548931934 941130524 /nfs/dbraw/zinc/13/05/24/941130524.db2.gz IIMSHMOZOIYATC-KRWDZBQOSA-N 0 3 415.497 4.255 20 0 HIADHN CCc1nc2cc(CNC(=O)N[C@H]3CCN(C)[C@H]3c3ccccc3)ccc2n1C1CC1 ZINC000548969947 941135990 /nfs/dbraw/zinc/13/59/90/941135990.db2.gz LZVAVXFETCKKOD-RDPSFJRHSA-N 0 3 417.557 4.178 20 0 HIADHN CCN1CCN(CCC(=O)Nc2ccc(Sc3ccc(Cl)cc3)cc2)CC1 ZINC000549054188 941149195 /nfs/dbraw/zinc/14/91/95/941149195.db2.gz QLWZBGBYQDOBSF-UHFFFAOYSA-N 0 3 403.979 4.457 20 0 HIADHN COc1ccc(CN(C)C(=O)CN[C@@H](c2cccc(C(F)(F)F)c2)C2CC2)cc1 ZINC000549080176 941154272 /nfs/dbraw/zinc/15/42/72/941154272.db2.gz PTPHBDJIVGORFE-OAQYLSRUSA-N 0 3 406.448 4.413 20 0 HIADHN COc1ccc([C@H](NC(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)C2CC2)cc1 ZINC000549104305 941159407 /nfs/dbraw/zinc/15/94/07/941159407.db2.gz RGZHAEUSJHRUNU-LEWJYISDSA-N 0 3 401.938 4.402 20 0 HIADHN CCN1CC[C@H](NCC(=O)Nc2ccc(Cl)cc2)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000549113794 941161171 /nfs/dbraw/zinc/16/11/71/941161171.db2.gz OEUJSPLJCRYABC-FXAWDEMLSA-N 0 3 411.855 4.121 20 0 HIADHN CCN1CC[C@H](NCC(=O)Nc2cc(C)ccc2OC)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000549113494 941161207 /nfs/dbraw/zinc/16/12/07/941161207.db2.gz PZCLHWJGCDRERN-AVRDEDQJSA-N 0 3 419.928 4.160 20 0 HIADHN COc1cccc([C@H]2[C@H](NCC(=O)Nc3ccc(C)cc3Cl)CCN2C2CC2)c1 ZINC000549118293 941161845 /nfs/dbraw/zinc/16/18/45/941161845.db2.gz RWKQADKITMWFNQ-GGAORHGYSA-N 0 3 413.949 4.163 20 0 HIADHN CCN1CC[C@@H](NCC(=O)Nc2ccc(C)c(C)c2)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000549117867 941161883 /nfs/dbraw/zinc/16/18/83/941161883.db2.gz YLLPIXJMFJSRKI-KNQAVFIVSA-N 0 3 405.464 4.084 20 0 HIADHN O=C1CCCN1C[C@H](NC[C@H]1CCC2(CCCC2)O1)c1cccc(C(F)(F)F)c1 ZINC000549136805 941164509 /nfs/dbraw/zinc/16/45/09/941164509.db2.gz YLBZBPDOTUCOEK-MOPGFXCFSA-N 0 3 410.480 4.450 20 0 HIADHN CN(C)c1noc([C@@H]2CCCN(CCSc3ccnc4cc(Cl)ccc43)C2)n1 ZINC000549147546 941165269 /nfs/dbraw/zinc/16/52/69/941165269.db2.gz LUEUYIPKWFCJQE-CQSZACIVSA-N 0 3 417.966 4.309 20 0 HIADHN CC(=O)Nc1ccc(S[C@@H](C)C(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)cc1 ZINC000549229690 941172302 /nfs/dbraw/zinc/17/23/02/941172302.db2.gz DBEANUPKYQCPBU-XOBRGWDASA-N 0 3 419.978 4.198 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@H](N[C@@H](CO)c2cccc(Br)c2)c2ccccc21 ZINC000549228904 941172424 /nfs/dbraw/zinc/17/24/24/941172424.db2.gz PAJPNJYSFIOIRJ-AABGKKOBSA-N 0 3 418.331 4.254 20 0 HIADHN COc1ccccc1CNC(=O)[C@@H](C)N[C@@H](c1cccc(C(F)(F)F)c1)C1CC1 ZINC000549409982 941187190 /nfs/dbraw/zinc/18/71/90/941187190.db2.gz YDIJSSKMGGKMPL-JLTOFOAXSA-N 0 3 406.448 4.460 20 0 HIADHN CC(C)Cn1c([C@H]2OCC[C@H]2c2ccccc2)nnc1N1CCN(C2CCCC2)CC1 ZINC000549441816 941190250 /nfs/dbraw/zinc/19/02/50/941190250.db2.gz WRRFSHBPVGAKJQ-GOTSBHOMSA-N 0 3 423.605 4.244 20 0 HIADHN CCN1CC[C@H](N[C@H](C)C(=O)Nc2ccccc2OC)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000549475163 941194117 /nfs/dbraw/zinc/19/41/17/941194117.db2.gz CNWFHGZGOJKUDD-RFVSGWPVSA-N 0 3 419.928 4.240 20 0 HIADHN COc1cccc([C@H]2[C@@H](NCC(=O)Nc3ccccc3C(C)(C)C)CCN2C2CC2)c1 ZINC000549476954 941194510 /nfs/dbraw/zinc/19/45/10/941194510.db2.gz HEWGHNWQSHDKAO-ZCYQVOJMSA-N 0 3 421.585 4.499 20 0 HIADHN COCCc1ccc(OC[C@H](O)CN2CCCC[C@H]2c2cc3ccccc3[nH]2)cc1 ZINC000549527821 941198116 /nfs/dbraw/zinc/19/81/16/941198116.db2.gz VXVSHTILOAWHOJ-BWKNWUBXSA-N 0 3 408.542 4.324 20 0 HIADHN C[C@@H](c1ccc(F)cc1)N1CC[C@@H](N2CCC(c3c[nH]c4ncccc34)CC2)C1=O ZINC000549526844 941198153 /nfs/dbraw/zinc/19/81/53/941198153.db2.gz ATIQIZVBMKOZSQ-KSFYIVLOSA-N 0 3 406.505 4.244 20 0 HIADHN Cc1cc(C)n(Cc2ccc(C(=O)N[C@@H](CN(C)C)c3ccc(Cl)cc3)cc2)n1 ZINC000549616472 941201510 /nfs/dbraw/zinc/20/15/10/941201510.db2.gz CMOJJGCGHGCGTF-QFIPXVFZSA-N 0 3 410.949 4.234 20 0 HIADHN CCCN(CC)C(=O)c1ccc(C(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)cc1 ZINC000549616839 941201524 /nfs/dbraw/zinc/20/15/24/941201524.db2.gz DJXUZUFJAMKJQW-NRFANRHFSA-N 0 3 415.965 4.245 20 0 HIADHN C[C@H](c1ccccc1)N1CCC(NS(=O)(=O)Cc2ccc(C(F)F)cc2)CC1 ZINC000549775109 941207033 /nfs/dbraw/zinc/20/70/33/941207033.db2.gz VGULTWOXLBEOMD-MRXNPFEDSA-N 0 3 408.514 4.269 20 0 HIADHN O=C(NCCN1CCCC1)c1ccc(NCc2ccccc2OCC(F)(F)F)cc1 ZINC000550066989 941278595 /nfs/dbraw/zinc/27/85/95/941278595.db2.gz UHKVHNANEFYBFN-UHFFFAOYSA-N 0 3 421.463 4.065 20 0 HIADHN C[C@@H](CNCc1c(Cl)cccc1N1CCOCC1)c1nc(-c2ccccc2)no1 ZINC000550174206 941293606 /nfs/dbraw/zinc/29/36/06/941293606.db2.gz JGFYCNCZEJHEJP-INIZCTEOSA-N 0 3 412.921 4.120 20 0 HIADHN Cc1cc2c(o1)CC(C)(C)C[C@@H]2NC(=O)N(C)C1CCN(CCc2ccccn2)CC1 ZINC000550228711 941301370 /nfs/dbraw/zinc/30/13/70/941301370.db2.gz MDDVDRQTDLZGLW-QFIPXVFZSA-N 0 3 424.589 4.345 20 0 HIADHN COc1cc(CN[C@H]2CCC[C@H]2F)ccc1OCC(=O)Nc1ccc(F)c(Cl)c1 ZINC000550319781 941314135 /nfs/dbraw/zinc/31/41/35/941314135.db2.gz HGWCICAFIKEQAR-MSOLQXFVSA-N 0 3 424.875 4.485 20 0 HIADHN CC(C)Oc1ccc2ccccc2c1CN[C@H]1CCCc2cc(S(N)(=O)=O)ccc21 ZINC000550795578 941367915 /nfs/dbraw/zinc/36/79/15/941367915.db2.gz TXTAMYJPAYJKHL-QHCPKHFHSA-N 0 3 424.566 4.442 20 0 HIADHN CC[C@H](N[C@@H]1CCCN([C@H](C)c2ccccc2F)C1=O)c1ccc2c(c1)OCCO2 ZINC000550860521 941375297 /nfs/dbraw/zinc/37/52/97/941375297.db2.gz KULLQLKOTAIAGZ-TYCQWZJGSA-N 0 3 412.505 4.390 20 0 HIADHN CCO[C@@H]1C[C@H](N[C@H]2CCSc3ccc(Br)cc32)[C@H]1n1cccn1 ZINC000550947140 941384381 /nfs/dbraw/zinc/38/43/81/941384381.db2.gz XECLUZODOLGARR-LISAXSMJSA-N 0 3 408.365 4.191 20 0 HIADHN Cc1cccc(-c2n[nH]cc2CNc2ccc(C(=O)N(C)[C@@H]3CCCN(C)C3)cc2)c1 ZINC000551090760 941408094 /nfs/dbraw/zinc/40/80/94/941408094.db2.gz GVBIXEQPVKWDFM-HSZRJFAPSA-N 0 3 417.557 4.163 20 0 HIADHN O[C@H](CNCc1cc(Cl)c2c(c1)OCCCO2)COc1cccc2ccccc21 ZINC000551236631 941432361 /nfs/dbraw/zinc/43/23/61/941432361.db2.gz VQTMTDNMGQOSHJ-GOSISDBHSA-N 0 3 413.901 4.184 20 0 HIADHN CC(C)(CN[C@@H](c1c[nH]nn1)c1ccc(F)cc1)c1ccc(Br)cc1 ZINC000551264661 941438739 /nfs/dbraw/zinc/43/87/39/941438739.db2.gz CPCCDICIXAXMRV-GOSISDBHSA-N 0 3 403.299 4.363 20 0 HIADHN CN1CCN(CCC(=O)Nc2c(Cl)cccc2Cl)C[C@@H]1Cc1ccccc1 ZINC000551411593 941472121 /nfs/dbraw/zinc/47/21/21/941472121.db2.gz KLWVOFFUDUWRES-KRWDZBQOSA-N 0 3 406.357 4.181 20 0 HIADHN CN(C(=O)c1ccc(NCc2c(C3CC3)nc3sccn23)cc1)[C@@H]1CCCN(C)C1 ZINC000551452190 941482911 /nfs/dbraw/zinc/48/29/11/941482911.db2.gz JFOOFFZNLDGNPF-LJQANCHMSA-N 0 3 423.586 4.052 20 0 HIADHN COc1cccc(C(=O)CCCC(=O)N[C@@H]2CCN(Cc3ccccc3)[C@H](C)C2)c1 ZINC000551468771 941485820 /nfs/dbraw/zinc/48/58/20/941485820.db2.gz KLJZYASWCQYDFC-DENIHFKCSA-N 0 3 408.542 4.218 20 0 HIADHN COc1cccc(C(=O)CCCC(=O)N[C@@H]2CCN(Cc3ccccc3)[C@@H](C)C2)c1 ZINC000551468775 941485869 /nfs/dbraw/zinc/48/58/69/941485869.db2.gz KLJZYASWCQYDFC-SIKLNZKXSA-N 0 3 408.542 4.218 20 0 HIADHN CCCOc1c(Cl)cc(C(=O)N[C@H](CN(C)C)c2ccc(OC)cc2)cc1OC ZINC000551541070 941498262 /nfs/dbraw/zinc/49/82/62/941498262.db2.gz LXNMWEYCTQMOTD-LJQANCHMSA-N 0 3 420.937 4.179 20 0 HIADHN C[C@@H](NCc1ccc(OC2CCCC2)cc1)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000551566698 941503051 /nfs/dbraw/zinc/50/30/51/941503051.db2.gz MTRUSAMHNPGKJM-QGZVFWFLSA-N 0 3 402.560 4.109 20 0 HIADHN O=C1CSc2ccc(NC3CCN(CCC(F)(F)F)CC3)cc2N1CC(F)F ZINC000551572294 941504385 /nfs/dbraw/zinc/50/43/85/941504385.db2.gz YMJLNUTYDVRGMN-UHFFFAOYSA-N 0 3 423.451 4.219 20 0 HIADHN O=C(N[C@H](CCCO)c1ccccc1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000551680696 941525756 /nfs/dbraw/zinc/52/57/56/941525756.db2.gz UITFETXFACKNMJ-IRLDBZIGSA-N 0 3 420.475 4.071 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)c2ccc(C(F)(F)F)cc2Cl)cc1 ZINC000551791472 941546328 /nfs/dbraw/zinc/54/63/28/941546328.db2.gz MLAPOFHHUACDJF-KRWDZBQOSA-N 0 3 400.828 4.400 20 0 HIADHN C[C@@H]1CN([C@@H](CNCc2cnc(C(C)(C)C)nc2)c2c(F)cccc2Cl)CCO1 ZINC000551799244 941546878 /nfs/dbraw/zinc/54/68/78/941546878.db2.gz OZFLHWOOXIDFLQ-BEFAXECRSA-N 0 3 420.960 4.118 20 0 HIADHN CN(C)c1noc([C@@H]2CCCN(Cc3cnc(-c4ccc(Cl)cc4)s3)C2)n1 ZINC000551820953 941552794 /nfs/dbraw/zinc/55/27/94/941552794.db2.gz GBJTXITVGDUYKL-CQSZACIVSA-N 0 3 403.939 4.292 20 0 HIADHN CCc1nc(C(=O)Nc2ccccc2CN(C)C)nn1-c1c(Cl)cccc1Cl ZINC000551828447 941554066 /nfs/dbraw/zinc/55/40/66/941554066.db2.gz NBBRFRPQGLJCSC-UHFFFAOYSA-N 0 3 418.328 4.450 20 0 HIADHN O=C(c1csc(-c2cccs2)n1)N1CCN(c2ccnc3ccccc32)CC1 ZINC000552009088 941568436 /nfs/dbraw/zinc/56/84/36/941568436.db2.gz VTLOSSUPVWKIBU-UHFFFAOYSA-N 0 3 406.536 4.382 20 0 HIADHN COc1ccc(C[C@H](C)N[C@H](c2nc(-c3cccnc3)no2)C(C)C)c(C)c1OC ZINC000552045802 941573488 /nfs/dbraw/zinc/57/34/88/941573488.db2.gz PLPBLDMVKVJJBP-YWZLYKJASA-N 0 3 410.518 4.375 20 0 HIADHN CN(Cc1nc(-c2ccccc2)c[nH]1)C(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000552093940 941584067 /nfs/dbraw/zinc/58/40/67/941584067.db2.gz DLURDOBUFLQIAM-HXUWFJFHSA-N 0 3 424.495 4.193 20 0 HIADHN CN(CCCN(C)C(=O)c1cc(Cl)ccc1Br)Cc1ccncc1 ZINC000552112698 941587581 /nfs/dbraw/zinc/58/75/81/941587581.db2.gz QDBXLXVEHFJGII-UHFFFAOYSA-N 0 3 410.743 4.092 20 0 HIADHN O=C(Cc1csc(-c2cccs2)n1)N1CCN(c2ccnc3ccccc32)CC1 ZINC000552147703 941593736 /nfs/dbraw/zinc/59/37/36/941593736.db2.gz WUVUWRJTAZFLQZ-UHFFFAOYSA-N 0 3 420.563 4.311 20 0 HIADHN O[C@H](CN[C@@H]1CCOc2c(Cl)cccc21)COc1cc(Cl)ccc1Cl ZINC000552226850 941608582 /nfs/dbraw/zinc/60/85/82/941608582.db2.gz QUHIWARAAGBHSC-MLGOLLRUSA-N 0 3 402.705 4.500 20 0 HIADHN Clc1ccc([C@@H](CN[C@@H](c2ncc[nH]2)C2CCCCC2)N2CCOCC2)cc1 ZINC000552248458 941613291 /nfs/dbraw/zinc/61/32/91/941613291.db2.gz HULZMNSFVFKFPJ-NHCUHLMSSA-N 0 3 402.970 4.348 20 0 HIADHN COc1ccc([C@H](Cc2ccncc2)N[C@@H]2CCN(C(C)=O)c3ccccc32)cc1 ZINC000552277003 941621101 /nfs/dbraw/zinc/62/11/01/941621101.db2.gz ODWRRGJOQKCELA-RPWUZVMVSA-N 0 3 401.510 4.462 20 0 HIADHN CCOc1ccc(OC)cc1NC(=O)NC[C@@H](c1ccc(OC)cc1)N1CCCC1 ZINC000552281343 941621605 /nfs/dbraw/zinc/62/16/05/941621605.db2.gz RCBJFJCIENPFIH-NRFANRHFSA-N 0 3 413.518 4.061 20 0 HIADHN c1csc(-c2nn(Cc3ccccc3)cc2CN2CCC(O[C@@H]3CCOC3)CC2)c1 ZINC000552304638 941627938 /nfs/dbraw/zinc/62/79/38/941627938.db2.gz WJGSJXKJLSISDM-JOCHJYFZSA-N 0 3 423.582 4.430 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)N1CC[C@@H](c2cccc(F)c2)C1 ZINC000552310369 941629098 /nfs/dbraw/zinc/62/90/98/941629098.db2.gz UTDXNUNQZPKJNY-HXUWFJFHSA-N 0 3 413.562 4.438 20 0 HIADHN C[S@@](=O)Cc1ccc(CN[C@@H]2CCCOc3cc(Br)ccc32)cc1 ZINC000552317806 941630159 /nfs/dbraw/zinc/63/01/59/941630159.db2.gz IHDAVDMXCWQGEY-HOYKHHGWSA-N 0 3 408.361 4.331 20 0 HIADHN Cc1c([C@H](C)NCCCc2cccc(C)n2)nnn1-c1cccc(Br)c1 ZINC000552323807 941632233 /nfs/dbraw/zinc/63/22/33/941632233.db2.gz SEYNKUZZWLCYBD-HNNXBMFYSA-N 0 3 414.351 4.325 20 0 HIADHN Cc1ccc(C(=O)CCCC(=O)N2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)cc1 ZINC000552336319 941635766 /nfs/dbraw/zinc/63/57/66/941635766.db2.gz YUGZABILQICWBQ-AREMUKBSSA-N 0 3 404.554 4.473 20 0 HIADHN CC(C)[C@@H](CNC(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F)c1cccnc1 ZINC000552341547 941638044 /nfs/dbraw/zinc/63/80/44/941638044.db2.gz MZFXLIZSJQSVCP-RTWAWAEBSA-N 0 3 401.501 4.095 20 0 HIADHN COCCN(CCN(C)C)C(=O)c1cc(F)ccc1-c1cccc(C(F)(F)F)c1 ZINC000552352238 941641573 /nfs/dbraw/zinc/64/15/73/941641573.db2.gz QFBYGZPUUNSYPZ-UHFFFAOYSA-N 0 3 412.427 4.162 20 0 HIADHN CCC(C)(C)C1CCC2(C[C@@H]2C(=O)N2CC[C@@H](N3CCN(C(C)C)CC3)C2)CC1 ZINC000552354576 941642429 /nfs/dbraw/zinc/64/24/29/941642429.db2.gz JNJNIWLZWTXRKW-YCIYHOANSA-N 0 3 403.655 4.246 20 0 HIADHN CC(C)c1c(C(=O)N(C)CCCN(C)Cc2ccncc2)cnn1-c1ccc(F)cc1 ZINC000552360801 941644448 /nfs/dbraw/zinc/64/44/48/941644448.db2.gz SFDJGORUDUQHAR-UHFFFAOYSA-N 0 3 423.536 4.124 20 0 HIADHN CC(C)N(CCc1nccs1)C(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000552367196 941645940 /nfs/dbraw/zinc/64/59/40/941645940.db2.gz DKHWFYZPQGMWKC-GOSISDBHSA-N 0 3 407.530 4.080 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)N1CCC(Oc2cncc(Cl)c2)CC1 ZINC000552467555 941679357 /nfs/dbraw/zinc/67/93/57/941679357.db2.gz DGLVQEZPJYOHNV-UHFFFAOYSA-N 0 3 413.905 4.226 20 0 HIADHN O=C([C@@H]1CN(Cc2ccccc2)CCC1(F)F)N1CCC(F)(c2cccnc2)CC1 ZINC000552544727 941702749 /nfs/dbraw/zinc/70/27/49/941702749.db2.gz BZPKMHFSSRZTOK-FQEVSTJZSA-N 0 3 417.475 4.026 20 0 HIADHN C[C@H](NCc1ccc(OCc2cccc(F)c2)cc1)c1ccc(-n2cnnn2)cc1 ZINC000552575894 941710176 /nfs/dbraw/zinc/71/01/76/941710176.db2.gz KMZLGIXAYGYAMT-KRWDZBQOSA-N 0 3 403.461 4.231 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)CCc1nc(C(C)(C)C)no1)c1ccc(Cl)cc1 ZINC000552672567 941734251 /nfs/dbraw/zinc/73/42/51/941734251.db2.gz SHQYSDKWQRQOLR-KRWDZBQOSA-N 0 3 406.958 4.152 20 0 HIADHN CCCN(C)[C@H](CNC(=O)[C@@H]1CCCN(C(=O)C(C)(C)C)C1)c1ccc(Cl)cc1 ZINC000552681031 941736409 /nfs/dbraw/zinc/73/64/09/941736409.db2.gz NBUKUOUOJDCGOS-UYAOXDASSA-N 0 3 422.013 4.124 20 0 HIADHN C[C@H](c1cc2ccccc2o1)N(C)C(=O)CNC1(c2ccc(F)cc2)CCOCC1 ZINC000552946278 941806412 /nfs/dbraw/zinc/80/64/12/941806412.db2.gz NUIKZQWPTOVCBT-QGZVFWFLSA-N 0 3 410.489 4.387 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)c1nccnc1-c1nc2ccccc2s1 ZINC000553159513 941842187 /nfs/dbraw/zinc/84/21/87/941842187.db2.gz ZCVJCIQWQMCHMI-UHFFFAOYSA-N 0 3 409.559 4.091 20 0 HIADHN Cc1nn(-c2ccccc2C)c2sc(C(=O)N3C[C@@H](N4CCCC4)C[C@H]3C)cc12 ZINC000553168234 941843660 /nfs/dbraw/zinc/84/36/60/941843660.db2.gz CJBOKELYYPEYKI-AEFFLSMTSA-N 0 3 408.571 4.403 20 0 HIADHN O=C(CCc1ccncc1)N(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000553196324 941847435 /nfs/dbraw/zinc/84/74/35/941847435.db2.gz KAJDJUZRYUIHBB-RUZDIDTESA-N 0 3 414.553 4.103 20 0 HIADHN O=C(c1cccc(O)c1)N(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000553197277 941847872 /nfs/dbraw/zinc/84/78/72/941847872.db2.gz CPTWKYHLIAOQBA-HSZRJFAPSA-N 0 3 401.510 4.094 20 0 HIADHN C[C@@H]1CN(C(=O)c2cccc(CN(C)C)c2)C[C@H](c2cccc(C(F)(F)F)c2)O1 ZINC000553382880 941877189 /nfs/dbraw/zinc/87/71/89/941877189.db2.gz XHCCLORRQQRBKP-FOIQADDNSA-N 0 3 406.448 4.369 20 0 HIADHN O=C1c2ccccc2C(=O)N1[C@@H]1CCCC[C@H](NCc2cc(-c3ccccc3)on2)C1 ZINC000553382261 941877260 /nfs/dbraw/zinc/87/72/60/941877260.db2.gz LCFBFAZNPBMIDA-AZUAARDMSA-N 0 3 415.493 4.429 20 0 HIADHN Cc1ccc(-n2nc(C(=O)N3CCN(C4CCC4)C[C@@H](C)C3)c3c2CCCC3)cc1 ZINC000553525380 941902294 /nfs/dbraw/zinc/90/22/94/941902294.db2.gz AXBSONPJIQJOHG-LJQANCHMSA-N 0 3 406.574 4.006 20 0 HIADHN Cc1ccccc1-n1ncc(C(=O)N2CCN(C3CCC3)C[C@H](C)C2)c1C(F)(F)F ZINC000553528316 941903871 /nfs/dbraw/zinc/90/38/71/941903871.db2.gz NKRVRBYUJVIHDA-HNNXBMFYSA-N 0 3 420.479 4.146 20 0 HIADHN C[C@H]1C[C@@H]1N1CCN(C(=O)c2cc(Cl)cc(Br)c2F)C[C@@H](C)C1 ZINC000553782958 941967882 /nfs/dbraw/zinc/96/78/82/941967882.db2.gz GAQFORVOSUGXMY-PGUXBMHVSA-N 0 3 403.723 4.044 20 0 HIADHN Cc1nc2cc(C(=O)N3CCN([C@@H]4C[C@H]4C)C[C@@H](C)C3)ccc2n1Cc1ccsc1 ZINC000553784139 941968559 /nfs/dbraw/zinc/96/85/59/941968559.db2.gz MVSCXXMWAYDZBZ-SEPYTNNBSA-N 0 3 422.598 4.257 20 0 HIADHN CCCN(C)[C@H](CNC(=O)N[C@H](C)c1nc(C(C)(C)C)no1)c1ccc(Cl)cc1 ZINC000553797028 941971499 /nfs/dbraw/zinc/97/14/99/941971499.db2.gz DUIFVFAILRGSHC-RHSMWYFYSA-N 0 3 421.973 4.464 20 0 HIADHN CC(C)c1nn(-c2ccc(Br)cc2)cc1CN[C@H](C)CO[C@@H]1CCOC1 ZINC000553898979 941994228 /nfs/dbraw/zinc/99/42/28/941994228.db2.gz RDDJCQQSQJVYRW-DNVCBOLYSA-N 0 3 422.367 4.042 20 0 HIADHN Cc1ccnn1-c1ccc(C(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)cc1 ZINC000554015040 942019422 /nfs/dbraw/zinc/01/94/22/942019422.db2.gz HXIMKTDPRRATCQ-QHCPKHFHSA-N 0 3 406.530 4.001 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)[C@H]2C[C@@H]2c2cc(F)ccc2F)N(C)C)cc1 ZINC000554015494 942019939 /nfs/dbraw/zinc/01/99/39/942019939.db2.gz XQCUWJPCNYSPBQ-CBQOVEMMSA-N 0 3 402.485 4.275 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)[C@@H]2C[C@@H]2c2cc(F)ccc2F)N(C)C)cc1 ZINC000554015497 942019997 /nfs/dbraw/zinc/01/99/97/942019997.db2.gz XQCUWJPCNYSPBQ-UZKOGDIHSA-N 0 3 402.485 4.275 20 0 HIADHN C[C@@H]1CCc2c(sc3nc(CCN4CC[C@@H](Nc5ccccc5)C4)nc(N)c23)C1 ZINC000554040787 942023776 /nfs/dbraw/zinc/02/37/76/942023776.db2.gz QFBWMQBQYGDTRS-NVXWUHKLSA-N 0 3 407.587 4.127 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)c2ccc([C@H]3CCCOC3)cc2)N(C)C)cc1 ZINC000554040394 942024142 /nfs/dbraw/zinc/02/41/42/942024142.db2.gz NKCDPASYWCXWGF-UPVQGACJSA-N 0 3 410.558 4.401 20 0 HIADHN O=C(CCN1CCC[C@@H](c2nnc3ccc(C(F)(F)F)cn32)C1)c1ccccc1 ZINC000554063060 942027797 /nfs/dbraw/zinc/02/77/97/942027797.db2.gz ZIHXPJMYRVSPKB-MRXNPFEDSA-N 0 3 402.420 4.201 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](NC[C@@H]2CCCSC2)c2ccc(F)c(F)c2)c1 ZINC000554068437 942028906 /nfs/dbraw/zinc/02/89/06/942028906.db2.gz COTUSWMMFVOFAY-XOBRGWDASA-N 0 3 411.539 4.191 20 0 HIADHN Cc1ccccc1-n1ncc(C(=O)N2CCN([C@@H]3C[C@H]3C)C[C@@H](C)C2)c1C(F)(F)F ZINC000554128512 942043887 /nfs/dbraw/zinc/04/38/87/942043887.db2.gz MGTLCURHHZGVAC-IDHHARJASA-N 0 3 420.479 4.002 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1ccc(C(=O)NCC(C)C)cc1C)c1ccco1 ZINC000554182092 942060222 /nfs/dbraw/zinc/06/02/22/942060222.db2.gz OGRASFAPIFTGCS-FXAWDEMLSA-N 0 3 414.550 4.225 20 0 HIADHN Cc1csc2nc(CN(Cc3ccccc3)[C@H]3CC(C)(C)OC3(C)C)cc(=O)n12 ZINC000554198354 942064124 /nfs/dbraw/zinc/06/41/24/942064124.db2.gz LAQFVJFNYXZZLE-IBGZPJMESA-N 0 3 411.571 4.413 20 0 HIADHN Cc1noc([C@H]2CCCCN2C(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)n1 ZINC000554213491 942069798 /nfs/dbraw/zinc/06/97/98/942069798.db2.gz FCNJRQJZWHSOFP-QZTJIDSGSA-N 0 3 417.579 4.149 20 0 HIADHN Cc1noc([C@@H]2CCCCN2C(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)n1 ZINC000554213492 942069897 /nfs/dbraw/zinc/06/98/97/942069897.db2.gz FCNJRQJZWHSOFP-ROUUACIJSA-N 0 3 417.579 4.149 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)N1CCC([C@@H]2CCCO2)CC1)c1ccc(Cl)cc1 ZINC000554248979 942077839 /nfs/dbraw/zinc/07/78/39/942077839.db2.gz AORSBMXBIKZFGT-SFTDATJTSA-N 0 3 407.986 4.324 20 0 HIADHN COc1cc(NC(=O)CCN2CC(C)(C)[C@@H]2c2cccs2)cc(OC)c1OC ZINC000554311930 942099813 /nfs/dbraw/zinc/09/98/13/942099813.db2.gz XUKUEQKOLATZJW-FQEVSTJZSA-N 0 3 404.532 4.186 20 0 HIADHN C[C@H](NC1CCC(N2C(=O)c3ccccc3C2=O)CC1)c1nccn1-c1ccccc1 ZINC000554375056 942117644 /nfs/dbraw/zinc/11/76/44/942117644.db2.gz GTOPBMUNGCENSM-ZJRDLVKKSA-N 0 3 414.509 4.130 20 0 HIADHN Cc1nn(C)c2sc([C@H](C)N[C@H]3CC(=O)N(C)[C@@H]3c3ccc(Cl)c(F)c3)cc12 ZINC000554385130 942121803 /nfs/dbraw/zinc/12/18/03/942121803.db2.gz RNYVRPAFDFUKFQ-WQFAYQGZSA-N 0 3 420.941 4.358 20 0 HIADHN CC(=O)Nc1cc(NC(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)ccc1C ZINC000554413159 942132452 /nfs/dbraw/zinc/13/24/52/942132452.db2.gz PDMKHPMUIIXAMK-QFIPXVFZSA-N 0 3 412.534 4.165 20 0 HIADHN CC(=O)N1CCc2c1cccc2NC(=O)NC[C@H](c1ccc(CC(C)C)cc1)N(C)C ZINC000554500498 942160391 /nfs/dbraw/zinc/16/03/91/942160391.db2.gz XBAKQBDJYZLDPB-XMMPIXPASA-N 0 3 422.573 4.219 20 0 HIADHN COC[C@H](NC(=O)N[C@@H](CN1CCCC1)c1ccccc1)c1cccc(Cl)c1 ZINC000554696325 942202734 /nfs/dbraw/zinc/20/27/34/942202734.db2.gz XGPPWQUMLUFTTC-SFTDATJTSA-N 0 3 401.938 4.164 20 0 HIADHN COc1cc(Cl)c(NC(=O)N2CCC(CN3C[C@H](C)O[C@@H](C)C3)CC2)cc1C ZINC000554763232 942227268 /nfs/dbraw/zinc/22/72/68/942227268.db2.gz OUIXDSJQGXEFOR-HOTGVXAUSA-N 0 3 409.958 4.010 20 0 HIADHN O[C@H](COCc1ccccc1Cl)CN1CCC(Oc2ccc(F)cc2F)CC1 ZINC000554831541 942269468 /nfs/dbraw/zinc/26/94/68/942269468.db2.gz SUDLPMGIPYGVFU-KRWDZBQOSA-N 0 3 411.876 4.039 20 0 HIADHN COC(=O)C(C)(C)c1ccc(NC(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)cc1 ZINC000554888184 942309006 /nfs/dbraw/zinc/30/90/06/942309006.db2.gz KEFNRUUAFJUQPC-LJQANCHMSA-N 0 3 417.937 4.215 20 0 HIADHN Cc1cc(NC(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)n(Cc2ccccc2)n1 ZINC000554895068 942310971 /nfs/dbraw/zinc/31/09/71/942310971.db2.gz JVLQVOPOSYDROF-HXUWFJFHSA-N 0 3 411.937 4.318 20 0 HIADHN Clc1cccc([C@H](Cc2cccnc2)NCc2ccc(Cn3cncn3)cc2)c1 ZINC000555000137 942349696 /nfs/dbraw/zinc/34/96/96/942349696.db2.gz KSXDLOYWKGLTDI-QHCPKHFHSA-N 0 3 403.917 4.448 20 0 HIADHN COc1cc(CN2CC[C@@]3(C2)CCc2ccccc2O3)cc(OC)c1OCC(F)F ZINC000555104962 942387020 /nfs/dbraw/zinc/38/70/20/942387020.db2.gz XHTKTDAELXFIJL-HSZRJFAPSA-N 0 3 419.468 4.317 20 0 HIADHN CCN1CC[C@H](NCC(=O)Nc2ccc(F)cc2F)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000555124754 942391729 /nfs/dbraw/zinc/39/17/29/942391729.db2.gz AWROAQYGDSXGJG-ICSRJNTNSA-N 0 3 411.855 4.121 20 0 HIADHN CCn1c(CN[C@H]2CCN(C3CC3)[C@@H]2c2cccc(OC)c2)nc2cc(F)ccc21 ZINC000555128241 942394229 /nfs/dbraw/zinc/39/42/29/942394229.db2.gz FJSUCPZSXDNJBV-GBXCKJPGSA-N 0 3 408.521 4.272 20 0 HIADHN COC(=O)c1cccc(CN[C@@H]2CCN(C(C)(C)C)[C@@H]2c2ccc(Cl)c(F)c2)n1 ZINC000555127121 942394445 /nfs/dbraw/zinc/39/44/45/942394445.db2.gz AMOVQDYTVNAAGF-UYAOXDASSA-N 0 3 419.928 4.364 20 0 HIADHN CCc1ccc(NC(=O)CN[C@H]2CCN(CC)[C@H]2c2cc(F)c(F)c(F)c2)cc1 ZINC000555132218 942396430 /nfs/dbraw/zinc/39/64/30/942396430.db2.gz TWTLSMYQXLTBGB-UGKGYDQZSA-N 0 3 405.464 4.030 20 0 HIADHN CC(C)N1CC[C@@H](NCC(=O)Nc2ccccc2Cl)[C@@H]1c1ccc(F)c(F)c1 ZINC000555133848 942398149 /nfs/dbraw/zinc/39/81/49/942398149.db2.gz XKRHNNQTDFABGS-CTNGQTDRSA-N 0 3 407.892 4.370 20 0 HIADHN c1ccc(Cn2c(-c3ccc4ccccc4n3)nnc2N2CCN(CC3CC3)CC2)cc1 ZINC000555154109 942407877 /nfs/dbraw/zinc/40/78/77/942407877.db2.gz VCRVFOPSFTWNPG-UHFFFAOYSA-N 0 3 424.552 4.074 20 0 HIADHN Cc1ccccc1CC(=O)N(Cc1ccccc1Br)C1CCN(C)CC1 ZINC000555162092 942411556 /nfs/dbraw/zinc/41/15/56/942411556.db2.gz BBWKRVMDVOJAEX-UHFFFAOYSA-N 0 3 415.375 4.423 20 0 HIADHN C[C@H](SCC(=O)N[C@@H](CN(C)C)c1ccc(Cl)cc1)c1nc2ccccc2[nH]1 ZINC000555229691 942437828 /nfs/dbraw/zinc/43/78/28/942437828.db2.gz DOCLMHLGBMXGAP-LIRRHRJNSA-N 0 3 416.978 4.430 20 0 HIADHN CN(C)C[C@H](NC(=O)Cc1ccc(Br)s1)c1ccc(Cl)cc1 ZINC000555229442 942438048 /nfs/dbraw/zinc/43/80/48/942438048.db2.gz JDHQMACZQVTGEH-AWEZNQCLSA-N 0 3 401.757 4.126 20 0 HIADHN Cc1nn(-c2ccccn2)c(C)c1CN(C)CCCc1cc(-c2ccc(F)cc2)n[nH]1 ZINC000555335462 942481610 /nfs/dbraw/zinc/48/16/10/942481610.db2.gz MCJMOJKETVQAFI-UHFFFAOYSA-N 0 3 418.520 4.478 20 0 HIADHN O=C1NCCN1[C@H]1CCCN(Cc2ccc(-c3ccccc3Br)cc2)C1 ZINC000555337710 942482711 /nfs/dbraw/zinc/48/27/11/942482711.db2.gz JBHBIJQMCCJSIW-SFHVURJKSA-N 0 3 414.347 4.106 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)NCc1cc(-c2ccccc2)on1 ZINC000555338657 942484048 /nfs/dbraw/zinc/48/40/48/942484048.db2.gz DLSICWAACQCSNV-UHFFFAOYSA-N 0 3 412.921 4.268 20 0 HIADHN O=C(NCCN1CCCC1)c1ccc(NCc2cnc(-c3cccs3)s2)cc1 ZINC000555504279 942607318 /nfs/dbraw/zinc/60/73/18/942607318.db2.gz HDCVHJYIWDFKNH-UHFFFAOYSA-N 0 3 412.584 4.309 20 0 HIADHN C[C@H](c1ccccc1F)N1CCC[C@@H](NCc2ccc(Oc3cnccn3)cc2)C1=O ZINC000555607167 942667107 /nfs/dbraw/zinc/66/71/07/942667107.db2.gz WTRSPRYFRHBOOY-VGOFRKELSA-N 0 3 420.488 4.250 20 0 HIADHN O=C(NC1CC1)[C@H](NC1(Cc2ccc(F)cc2Cl)CCOCC1)c1ccccc1 ZINC000555696411 942703088 /nfs/dbraw/zinc/70/30/88/942703088.db2.gz CPTMKNWYIAVXTA-OAQYLSRUSA-N 0 3 416.924 4.180 20 0 HIADHN CN1CCN(C[C@@H](NCc2cc(Cl)ccc2OCC2CC2)c2ccccc2)CC1 ZINC000555702961 942705949 /nfs/dbraw/zinc/70/59/49/942705949.db2.gz SSABGGNZIMTVCT-HSZRJFAPSA-N 0 3 413.993 4.207 20 0 HIADHN COc1cnccc1[C@H](C)NC[C@H](O)CO[C@@H](c1ccccc1)c1ccccc1C ZINC000556018122 942786375 /nfs/dbraw/zinc/78/63/75/942786375.db2.gz GSQWMCLPIWCQPW-OWHZGTRUSA-N 0 3 406.526 4.216 20 0 HIADHN COc1cnccc1[C@H](C)NC[C@H](O)CO[C@H](c1ccccc1)c1ccc(C)cc1 ZINC000556018219 942786420 /nfs/dbraw/zinc/78/64/20/942786420.db2.gz REURDCIUXJXZIF-KIVTUJJHSA-N 0 3 406.526 4.216 20 0 HIADHN CC[C@H](N[C@@H](C)c1cc(F)ccc1N1CCN(C)CC1)c1ccc(C(=O)OC)cc1 ZINC000556076140 942801344 /nfs/dbraw/zinc/80/13/44/942801344.db2.gz KFYQMXLHYUOQJI-JTSKRJEESA-N 0 3 413.537 4.166 20 0 HIADHN CS(=O)(=O)C[C@@H](NCc1ccc(Oc2ccc(C(F)(F)F)cc2)cc1)C1CC1 ZINC000556077274 942801922 /nfs/dbraw/zinc/80/19/22/942801922.db2.gz VCVSYAIMYWJRKV-LJQANCHMSA-N 0 3 413.461 4.411 20 0 HIADHN CN(C)CCN1C[C@@H](C(=O)Nc2ccc(Cl)cc2-c2ccccc2Cl)CC1=O ZINC000556077840 942802261 /nfs/dbraw/zinc/80/22/61/942802261.db2.gz UVNCHJRWCNLTKD-AWEZNQCLSA-N 0 3 420.340 4.009 20 0 HIADHN O=C(NCCN1CCCC1)c1ccc(NC(=O)c2cc(Cl)c(F)cc2Cl)cc1 ZINC000556081672 942802882 /nfs/dbraw/zinc/80/28/82/942802882.db2.gz VBCLYGBLNDIBON-UHFFFAOYSA-N 0 3 424.303 4.210 20 0 HIADHN Brc1ccc(C2(CN[C@H](c3cccs3)c3nnc[nH]3)CCC2)s1 ZINC000556194218 942816990 /nfs/dbraw/zinc/81/69/90/942816990.db2.gz WAGHBEUECRTJNK-CQSZACIVSA-N 0 3 409.378 4.491 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)[C@H](OC1CCOCC1)c1ccccc1 ZINC000556207808 942819133 /nfs/dbraw/zinc/81/91/33/942819133.db2.gz KQOSIHGVDQPNLS-PXDATVDWSA-N 0 3 422.569 4.046 20 0 HIADHN Brc1ccc2c(c1)[C@H](NCc1cccc(N3CCOCC3)c1)CCCO2 ZINC000556223063 942820902 /nfs/dbraw/zinc/82/09/02/942820902.db2.gz UJMSOATZZZLHHS-HXUWFJFHSA-N 0 3 417.347 4.289 20 0 HIADHN C[C@@H](Cn1cc(Br)ccc1=O)N[C@@H]1CCCOc2c(Cl)cccc21 ZINC000556257691 942827425 /nfs/dbraw/zinc/82/74/25/942827425.db2.gz JZXAJMAPMVDNRT-BLLLJJGKSA-N 0 3 411.727 4.156 20 0 HIADHN C[C@@H]1CC[C@H](NCc2cc(Br)ccc2OC(F)F)[C@H](n2cncn2)C1 ZINC000556260583 942828144 /nfs/dbraw/zinc/82/81/44/942828144.db2.gz FQKVZVGHHHUSGB-BYCMXARLSA-N 0 3 415.282 4.162 20 0 HIADHN FC(F)(F)[C@]1(c2nc(-c3nccc4[nH]ccc43)no2)CCN(Cc2ccccc2)C1 ZINC000556328343 942842167 /nfs/dbraw/zinc/84/21/67/942842167.db2.gz RUPQSQQRIRCZDW-HXUWFJFHSA-N 0 3 413.403 4.319 20 0 HIADHN CN(C(=O)c1ccc(NCc2cccc3c2OC(C)(C)C3)cc1)[C@H]1CCCN(C)C1 ZINC000556338221 942845284 /nfs/dbraw/zinc/84/52/84/942845284.db2.gz KKAIWZYSKGYZHX-QFIPXVFZSA-N 0 3 407.558 4.178 20 0 HIADHN CC(C)CN(C(=O)CN[C@@H](c1cccc(C(F)(F)F)c1)C1CCOCC1)C1CC1 ZINC000556523060 942891262 /nfs/dbraw/zinc/89/12/62/942891262.db2.gz SYAGYNTZSKDTED-OAQYLSRUSA-N 0 3 412.496 4.410 20 0 HIADHN Cc1ccc(-n2cc(CN3CCC(C(=O)N(C)C)CC3)c(-c3ccc(F)cc3)n2)cc1 ZINC000556599142 942910869 /nfs/dbraw/zinc/91/08/69/942910869.db2.gz FJHYRJBZFGHQGU-UHFFFAOYSA-N 0 3 420.532 4.287 20 0 HIADHN C[C@@]1(C2CC2)NC(=O)N(c2cccc(CN[C@H]3CCc4cc(Cl)ccc43)c2)C1=O ZINC000556609762 942913674 /nfs/dbraw/zinc/91/36/74/942913674.db2.gz ATLGBQCCFRZTIN-REWPJTCUSA-N 0 3 409.917 4.342 20 0 HIADHN O=C(c1csc(Br)c1)N1CCN(c2ccnc3ccccc32)CC1 ZINC000556833454 942937632 /nfs/dbraw/zinc/93/76/32/942937632.db2.gz NTROEOBWJSJORU-UHFFFAOYSA-N 0 3 402.317 4.021 20 0 HIADHN CC(C)c1ccc([C@@H](NC[C@@H](O)CN2C[C@@H](C)O[C@@H](C)C2)c2cccs2)cc1 ZINC000556853786 942940854 /nfs/dbraw/zinc/94/08/54/942940854.db2.gz NXPUWPIVVHOGSL-NNTZPNAXSA-N 0 3 402.604 4.021 20 0 HIADHN Cc1ccnc([C@H](C)N[C@@H](Cc2cccc(F)c2)CN2C(=O)c3ccccc3C2=O)c1 ZINC000556873750 942946726 /nfs/dbraw/zinc/94/67/26/942946726.db2.gz UHGXWQCOFDMBNV-PXNSSMCTSA-N 0 3 417.484 4.087 20 0 HIADHN OC[C@@H](CN[C@@H](c1ncc[nH]1)C1CCCCC1)Cc1ccc(Br)cc1 ZINC000556881585 942948994 /nfs/dbraw/zinc/94/89/94/942948994.db2.gz XCWBLWKPDGSQSM-VQIMIIECSA-N 0 3 406.368 4.234 20 0 HIADHN CCOc1cc(CN2CC[C@@H](c3ccccc3F)C2)ccc1O[C@H](C)C(=O)N(C)C ZINC000556883741 942949953 /nfs/dbraw/zinc/94/99/53/942949953.db2.gz XEPSFRHENOMXLN-IEBWSBKVSA-N 0 3 414.521 4.069 20 0 HIADHN Cn1cccc1[C@@H]1CCCCN1C(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000556891051 942953394 /nfs/dbraw/zinc/95/33/94/942953394.db2.gz CBFUKVXBHZRZBK-FPOVZHCZSA-N 0 3 401.501 4.236 20 0 HIADHN CCc1nnc(NC(=O)[C@H](C)[C@@H](C)N[C@@H](C)c2ccccc2OC(F)(F)F)s1 ZINC000556914024 942964214 /nfs/dbraw/zinc/96/42/14/942964214.db2.gz XCAJISJTINVGPQ-UTUOFQBUSA-N 0 3 416.469 4.313 20 0 HIADHN CCC[C@@H](CNC(=O)CN1CCCN(CC)CC1)c1ccc(Cl)cc1Cl ZINC000557086544 943016837 /nfs/dbraw/zinc/01/68/37/943016837.db2.gz JLICOFCSHJXEMB-INIZCTEOSA-N 0 3 400.394 4.021 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)c2ccc(NC(=O)CC(C)C)c(C)c2)cc1 ZINC000557205389 943050949 /nfs/dbraw/zinc/05/09/49/943050949.db2.gz JZYVJVRPBDBLFC-JOCHJYFZSA-N 0 3 411.546 4.021 20 0 HIADHN COc1cc([C@H](C)NCCOc2ccccc2C(C)(C)C)ccc1S(C)(=O)=O ZINC000557262882 943062657 /nfs/dbraw/zinc/06/26/57/943062657.db2.gz QASWLLSHEWAWHN-INIZCTEOSA-N 0 3 405.560 4.126 20 0 HIADHN CCNC(=O)COc1cccc(CN[C@@H](C)c2sc(-c3ccccc3)nc2C)c1 ZINC000557277370 943064953 /nfs/dbraw/zinc/06/49/53/943064953.db2.gz LQLQVOMUCICDEW-INIZCTEOSA-N 0 3 409.555 4.484 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)c1cccnc1SCc1c(C)noc1C ZINC000557634466 943241261 /nfs/dbraw/zinc/24/12/61/943241261.db2.gz FOSAUPNZPPMCHO-UHFFFAOYSA-N 0 3 416.591 4.317 20 0 HIADHN C[C@@H](CC(=O)Nc1cccc(N2CCCC2)c1)NCc1cnc(-c2ccncc2)s1 ZINC000557781616 943290094 /nfs/dbraw/zinc/29/00/94/943290094.db2.gz CRIXAONMWAKGPG-KRWDZBQOSA-N 0 3 421.570 4.312 20 0 HIADHN C[C@H]1[C@H](NC(=O)Nc2cccc(C(=O)N3CCCCC3)c2)CCN1Cc1ccccc1 ZINC000557884317 943320635 /nfs/dbraw/zinc/32/06/35/943320635.db2.gz BMXZMSHRMCGUAJ-WMZHIEFXSA-N 0 3 420.557 4.097 20 0 HIADHN Cc1c2ccc(F)cc2sc1C(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000557906631 943325902 /nfs/dbraw/zinc/32/59/02/943325902.db2.gz VOTYWENXCAHPET-LJQANCHMSA-N 0 3 412.530 4.370 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)c1cc2c(cccc2Br)[nH]1)c1ccco1 ZINC000557911026 943326860 /nfs/dbraw/zinc/32/68/60/943326860.db2.gz ZKXZTBMVPYWMIU-PXAZEXFGSA-N 0 3 404.308 4.383 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)Cc2csc(C(C)(C)C)n2)N(C)C)cc1 ZINC000557934640 943333055 /nfs/dbraw/zinc/33/30/55/943333055.db2.gz GVNHEYYHVMFPMV-LJQANCHMSA-N 0 3 403.592 4.189 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)[C@@H]2[C@@H](c3ccccc3)C2(F)F)N(C)C)cc1 ZINC000557936941 943333898 /nfs/dbraw/zinc/33/38/98/943333898.db2.gz SHPQLVOACYJKBJ-NJYVYQBISA-N 0 3 402.485 4.242 20 0 HIADHN CCCN(C)[C@H](CNC(=O)NCCCc1c(C)nn(C)c1C)c1ccc(Cl)cc1 ZINC000557949862 943337280 /nfs/dbraw/zinc/33/72/80/943337280.db2.gz ARQUIONWGRNPOJ-OAQYLSRUSA-N 0 3 420.001 4.005 20 0 HIADHN CN(C)C[C@H](NC(=O)c1cccc(NC(=O)c2ccc(F)cc2)c1)c1ccc(F)cc1 ZINC000557955850 943339818 /nfs/dbraw/zinc/33/98/18/943339818.db2.gz QYIYDZHIZAQREN-QFIPXVFZSA-N 0 3 423.463 4.250 20 0 HIADHN CC(=O)Nc1ccc(CNCc2cc(Br)cc(Br)c2)cc1 ZINC000558099655 943379419 /nfs/dbraw/zinc/37/94/19/943379419.db2.gz AOTDFSVPHIFEBF-UHFFFAOYSA-N 0 3 412.125 4.460 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)N1CC[C@H](C2CCOCC2)C1)c1ccc(Cl)cc1 ZINC000558104679 943379930 /nfs/dbraw/zinc/37/99/30/943379930.db2.gz AEOJSWVRNRTJGF-FPOVZHCZSA-N 0 3 407.986 4.181 20 0 HIADHN Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)N[C@H](Cc1ccc(F)cc1)C(N)=O ZINC000558122683 943386366 /nfs/dbraw/zinc/38/63/66/943386366.db2.gz QTDUVBQWAGYZBD-KPZWWZAWSA-N 0 3 401.482 4.144 20 0 HIADHN CC(=O)c1cccc(OC[C@H](O)CN2CCC(c3c[nH]c4ccc(F)cc43)CC2)c1 ZINC000558177346 943412616 /nfs/dbraw/zinc/41/26/16/943412616.db2.gz UMQYGQJTKUGJML-HXUWFJFHSA-N 0 3 410.489 4.129 20 0 HIADHN COCC(C)(C)CCCN[C@H](C)c1nnn(-c2cccc(Br)c2)c1C ZINC000558259736 943464618 /nfs/dbraw/zinc/46/46/18/943464618.db2.gz WYEFDCRVXDLCIJ-CQSZACIVSA-N 0 3 409.372 4.442 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)NC[C@@H](N[C@@H](C)CC)c2ccco2)c(C)c1 ZINC000558309769 943497329 /nfs/dbraw/zinc/49/73/29/943497329.db2.gz NLOPCQTXHXMKKK-ABSDTBQOSA-N 0 3 414.550 4.367 20 0 HIADHN CC1CCN([C@@H](CNC(=O)N2CCCC[C@@H]2c2cc[nH]n2)c2cccs2)CC1 ZINC000558381230 943536936 /nfs/dbraw/zinc/53/69/36/943536936.db2.gz LSCFHCNBMDJZET-MOPGFXCFSA-N 0 3 401.580 4.181 20 0 HIADHN Nc1nccc([C@@H]2CCCN(Cc3cn(-c4ccccc4)nc3-c3cccs3)C2)n1 ZINC000558407265 943551747 /nfs/dbraw/zinc/55/17/47/943551747.db2.gz KCYUCIDKIYNSOV-QGZVFWFLSA-N 0 3 416.554 4.353 20 0 HIADHN COC(=O)c1ccc(CN[C@@H]2CCCc3c4cc(Br)ccc4[nH]c32)[nH]1 ZINC000558425006 943556775 /nfs/dbraw/zinc/55/67/75/943556775.db2.gz MDUJKMQLZSKPOF-MRXNPFEDSA-N 0 3 402.292 4.212 20 0 HIADHN CN1CC[C@@H](NCC(=O)Nc2ccccc2C(F)(F)F)[C@@H]1c1ccc(Cl)cc1 ZINC000558467130 943567501 /nfs/dbraw/zinc/56/75/01/943567501.db2.gz OFFDPHZGRLSFMT-MJGOQNOKSA-N 0 3 411.855 4.332 20 0 HIADHN C[C@H](N[C@@H]1c2ccccc2CC12CCOCC2)C(=O)N1c2ccccc2CC[C@H]1C ZINC000558483923 943572082 /nfs/dbraw/zinc/57/20/82/943572082.db2.gz MHSGLBAFNAWRBD-YDIMBITNSA-N 0 3 404.554 4.427 20 0 HIADHN COc1ccc(Cn2nc(C)c(CNC[C@]3(C)OCCc4sccc43)c2C)cc1 ZINC000558494104 943575267 /nfs/dbraw/zinc/57/52/67/943575267.db2.gz YNLRUSSIDXSWGN-QHCPKHFHSA-N 0 3 411.571 4.196 20 0 HIADHN O=C(NCc1ccc(-c2ccncc2)cc1)N1CCCN(Cc2ccccc2)CC1 ZINC000558496135 943575556 /nfs/dbraw/zinc/57/55/56/943575556.db2.gz IJHBTTBGXARCHE-UHFFFAOYSA-N 0 3 400.526 4.166 20 0 HIADHN CCSc1cccc(F)c1NC(=O)NCc1ccc(CN2CCN(C)CC2)cc1 ZINC000558514621 943584336 /nfs/dbraw/zinc/58/43/36/943584336.db2.gz STHDSTUSDHYULS-UHFFFAOYSA-N 0 3 416.566 4.007 20 0 HIADHN O=C(CCN[C@H]1CCCOc2ccc(F)cc21)Nc1ccc(Br)cc1 ZINC000558652451 943624531 /nfs/dbraw/zinc/62/45/31/943624531.db2.gz SNUQJUPZTZHZFK-KRWDZBQOSA-N 0 3 407.283 4.420 20 0 HIADHN CC[C@H](N[C@H](C)c1ccc(Br)cn1)[C@H]1CN(Cc2ccccc2)CCO1 ZINC000558741179 943636530 /nfs/dbraw/zinc/63/65/30/943636530.db2.gz VWECNBUSAAHTBL-LKUPVBHCSA-N 0 3 418.379 4.174 20 0 HIADHN CCOC(=O)C1CCC(N(CC)CC(=O)Nc2ccccc2C(F)(F)F)CC1 ZINC000558750430 943641629 /nfs/dbraw/zinc/64/16/29/943641629.db2.gz ZWTLDRRTIBTOGP-UHFFFAOYSA-N 0 3 400.441 4.088 20 0 HIADHN CC(C)N1CC[C@@H](N[C@@H](C)C(=O)Nc2cc(F)ccc2F)[C@@H]1c1ccc(F)c(F)c1 ZINC000558890977 943723688 /nfs/dbraw/zinc/72/36/88/943723688.db2.gz BNVAYLHLZPDUKJ-NQZBTDCJSA-N 0 3 423.454 4.384 20 0 HIADHN COc1cccc([C@@H]2[C@@H](N[C@H](C)C(=O)Nc3ccc(C)cc3F)CCN2C2CC2)c1 ZINC000558896432 943728882 /nfs/dbraw/zinc/72/88/82/943728882.db2.gz SRIFWXCISAGFSS-UZFJHSOTSA-N 0 3 411.521 4.037 20 0 HIADHN c1cc(Cc2nnc(N3CCN(C4CCCC4)CC3)n2Cc2ccccc2)cs1 ZINC000558914356 943744135 /nfs/dbraw/zinc/74/41/35/943744135.db2.gz REAQQMRNGSCVOZ-UHFFFAOYSA-N 0 3 407.587 4.043 20 0 HIADHN C[C@H](NC(=O)N[C@@H](CN(C)C)c1ccc(Cl)cc1)c1ccccc1-n1cccn1 ZINC000558914240 943744226 /nfs/dbraw/zinc/74/42/26/943744226.db2.gz PSRRMZKBUKYTLG-JXFKEZNVSA-N 0 3 411.937 4.189 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@@H](Nc2ccccc2N2CCN(CC)CC2)c2ccccc21 ZINC000558975738 943779516 /nfs/dbraw/zinc/77/95/16/943779516.db2.gz ARHNXESFQKKPFB-FGZHOGPDSA-N 0 3 407.558 4.422 20 0 HIADHN Cc1ccc(CN2CCCC[C@@H]2CNC(=O)c2ccccc2)c(-c2cnn(C)c2)c1 ZINC000559068395 943822955 /nfs/dbraw/zinc/82/29/55/943822955.db2.gz REDFJGFZHKHHTO-HSZRJFAPSA-N 0 3 402.542 4.180 20 0 HIADHN COc1ccccc1SCc1nnc(N2CCN(C)[C@H](C(C)C)C2)n1CC(C)C ZINC000559083303 943830413 /nfs/dbraw/zinc/83/04/13/943830413.db2.gz JCZUYDUVIVAEOP-SFHVURJKSA-N 0 3 417.623 4.011 20 0 HIADHN C[C@@H](N[C@H](CN1CCN(C)CC1)c1ccccc1)c1cc(Br)cs1 ZINC000559087063 943832072 /nfs/dbraw/zinc/83/20/72/943832072.db2.gz OAOGSVBDAPQNIB-CRAIPNDOSA-N 0 3 408.409 4.150 20 0 HIADHN CC[C@H]1CN(c2nnc([C@@H]3OCC[C@@H]3C)n2CC(C)C)CCN1Cc1ccccc1 ZINC000559087458 943833085 /nfs/dbraw/zinc/83/30/85/943833085.db2.gz GKFFKIWTUOBVFU-ILWGZMRPSA-N 0 3 411.594 4.132 20 0 HIADHN Cc1ccsc1-c1nnc(N2CCN(C3CCCC3)CC2)n1Cc1cccs1 ZINC000559160085 943855782 /nfs/dbraw/zinc/85/57/82/943855782.db2.gz FLENMMMKBJKVSS-UHFFFAOYSA-N 0 3 413.616 4.489 20 0 HIADHN Cc1ccc(-c2nc(CCNCc3c(Cl)cccc3N3CCOCC3)co2)cc1 ZINC000559253742 943886389 /nfs/dbraw/zinc/88/63/89/943886389.db2.gz AQNVAAWRZANHKX-UHFFFAOYSA-N 0 3 411.933 4.472 20 0 HIADHN CC[C@H](N[C@@H]1CCc2cccc(Br)c2C1)c1nnc2n1CCCCC2 ZINC000559259919 943886774 /nfs/dbraw/zinc/88/67/74/943886774.db2.gz MISJXYMMIVMUDU-QAPCUYQASA-N 0 3 403.368 4.365 20 0 HIADHN Fc1cc(CNCc2cccc(I)c2)ccc1OC(F)F ZINC000559334635 943898297 /nfs/dbraw/zinc/89/82/97/943898297.db2.gz ALMUOTIOMCFDHW-UHFFFAOYSA-N 0 3 407.173 4.322 20 0 HIADHN CC(C)[C@H](CCc1ccccc1)C(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000559449963 943957870 /nfs/dbraw/zinc/95/78/70/943957870.db2.gz LEJIRHOMPYAXHM-IMSXRSKXSA-N 0 3 400.607 4.239 20 0 HIADHN O=C1CCCN1Cc1ccc(CN[C@@H]2CCc3sc(Br)cc32)cc1 ZINC000559740739 944042870 /nfs/dbraw/zinc/04/28/70/944042870.db2.gz WSLKKFMNHOCZDV-MRXNPFEDSA-N 0 3 405.361 4.410 20 0 HIADHN CN1CC[C@H](NCC(=O)Nc2ccc3c(c2)OC2(CCCCC2)O3)[C@@H]1c1ccccc1 ZINC000559791101 944051701 /nfs/dbraw/zinc/05/17/01/944051701.db2.gz NSNZCXLVPCNRNZ-RDPSFJRHSA-N 0 3 421.541 4.092 20 0 HIADHN C[C@H](c1ccccc1F)N1CCC[C@@H](N[C@@H](C)c2ccc3c(c2)C(C)(C)C(=O)N3)C1=O ZINC000559878658 944072610 /nfs/dbraw/zinc/07/26/10/944072610.db2.gz NAADDFAOPIBJFR-WJONJSRFSA-N 0 3 423.532 4.458 20 0 HIADHN CC(C)(CC(=O)NC1CCN(CCOc2ccc(Br)cc2)CC1)C1CC1 ZINC000559913790 944083488 /nfs/dbraw/zinc/08/34/88/944083488.db2.gz XFJWPORMVVJVDG-UHFFFAOYSA-N 0 3 423.395 4.235 20 0 HIADHN Cc1ccc(OC(F)F)c(CNc2ccc(C(=O)N(C)[C@@H]3CCCN(C)C3)cc2)c1 ZINC000559998732 944121037 /nfs/dbraw/zinc/12/10/37/944121037.db2.gz FHOSWZALOIKZCU-HXUWFJFHSA-N 0 3 417.500 4.375 20 0 HIADHN C[C@@H]1Cc2ccc(F)cc2[C@@H]1NCc1cccc(N2C(=O)N[C@](C)(C3CC3)C2=O)c1 ZINC000560269673 944214087 /nfs/dbraw/zinc/21/40/87/944214087.db2.gz WSISLSAGCDYCMN-FCDRKTINSA-N 0 3 407.489 4.074 20 0 HIADHN C/C=C\c1ccc(OC[C@H](O)CN[C@@H]2CCOc3c(Cl)cccc32)c(OC)c1 ZINC000560515482 944240240 /nfs/dbraw/zinc/24/02/40/944240240.db2.gz USUMLOYBJFHHDL-IPHHBTQASA-N 0 3 403.906 4.235 20 0 HIADHN COc1cccc(Oc2ccc(CN[C@H](C)c3ccccc3-n3ccnn3)cn2)c1 ZINC000560531511 944245203 /nfs/dbraw/zinc/24/52/03/944245203.db2.gz ACIRTPQOWQFROE-QGZVFWFLSA-N 0 3 401.470 4.314 20 0 HIADHN COc1ccc(C[C@@H](C)N[C@H](CCO)c2ccccc2Br)c(C)c1OC ZINC000560548526 944250369 /nfs/dbraw/zinc/25/03/69/944250369.db2.gz HMUUNVPVAAYHTB-AUUYWEPGSA-N 0 3 422.363 4.419 20 0 HIADHN CN(CCCN(C)C(=O)c1cncc(-c2ccc(Cl)cc2)c1)Cc1ccncc1 ZINC000560594849 944267029 /nfs/dbraw/zinc/26/70/29/944267029.db2.gz KROBGJQREQQCDU-UHFFFAOYSA-N 0 3 408.933 4.391 20 0 HIADHN CN(CCCN(C)C(=O)[C@@H]1C[C@H]1c1ccccc1OC(F)(F)F)Cc1ccncc1 ZINC000560596297 944268201 /nfs/dbraw/zinc/26/82/01/944268201.db2.gz MSBXHNWPCGMULD-RBUKOAKNSA-N 0 3 421.463 4.064 20 0 HIADHN O=C(NCC1(c2ccncc2)CCCC1)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000560616782 944275711 /nfs/dbraw/zinc/27/57/11/944275711.db2.gz IPFFGODPRSVGBQ-OAQYLSRUSA-N 0 3 413.512 4.167 20 0 HIADHN Cc1nn(Cc2ccccc2)c2sc(C(=O)N3C[C@H](N4CCCC4)C[C@H]3C)cc12 ZINC000560759302 944322068 /nfs/dbraw/zinc/32/20/68/944322068.db2.gz WHNWNEMYWAPWQH-VQIMIIECSA-N 0 3 408.571 4.153 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)COC(c2ccccc2)c2ccccc2)cc1 ZINC000560845262 944355680 /nfs/dbraw/zinc/35/56/80/944355680.db2.gz DNRPJNUOOCEXSG-XMMPIXPASA-N 0 3 418.537 4.220 20 0 HIADHN COc1ccccc1NC(=O)c1ccc(NC(=O)[C@H](C)N2CCC[C@H](C)CC2)cc1 ZINC000560846965 944356549 /nfs/dbraw/zinc/35/65/49/944356549.db2.gz HTHICPLLUMUVTD-ROUUACIJSA-N 0 3 409.530 4.397 20 0 HIADHN COc1ccc([C@@H](CNC(=O)CCc2ccc3ccccc3n2)N2CCCC2)cc1 ZINC000560863343 944360721 /nfs/dbraw/zinc/36/07/21/944360721.db2.gz HZJGXTUNPKFSFG-XMMPIXPASA-N 0 3 403.526 4.129 20 0 HIADHN CCCN(C)[C@H](CNC(=O)c1ccc(-c2ccccn2)[nH]c1=O)c1ccc(Cl)cc1 ZINC000560967638 944378653 /nfs/dbraw/zinc/37/86/53/944378653.db2.gz XUNCHEKFZXKODH-OAQYLSRUSA-N 0 3 424.932 4.316 20 0 HIADHN C[C@@H](NCC(=O)N(C)Cc1ccc(Cl)c(Cl)c1)c1ccccc1-n1cccn1 ZINC000561112273 944461646 /nfs/dbraw/zinc/46/16/46/944461646.db2.gz WGJHDQIISHGRMM-OAHLLOKOSA-N 0 3 417.340 4.488 20 0 HIADHN CN(C)[C@@H](CNc1cncc(NC[C@@H](c2ccsc2)N(C)C)n1)c1ccsc1 ZINC000561143460 944479708 /nfs/dbraw/zinc/47/97/08/944479708.db2.gz TYBKGFNWHQCTST-ROUUACIJSA-N 0 3 416.620 4.029 20 0 HIADHN CC[C@H](NCC(=O)Nc1cccc(CN2CCSCC2)c1)c1ccc(F)cc1F ZINC000561159538 944489793 /nfs/dbraw/zinc/48/97/93/944489793.db2.gz DCUXIEFEBAHNBN-NRFANRHFSA-N 0 3 419.541 4.193 20 0 HIADHN CCCN(CCN1CCCC1)C(=O)c1nc(CC)n(-c2c(Cl)cccc2Cl)n1 ZINC000561192220 944508815 /nfs/dbraw/zinc/50/88/15/944508815.db2.gz NFVVLAIMTZMMKR-UHFFFAOYSA-N 0 3 424.376 4.085 20 0 HIADHN CCS(=O)(=O)c1ccc([C@H](C)N[C@H](C)CC(=O)Nc2cccc(C)c2C)cc1 ZINC000561297692 944542696 /nfs/dbraw/zinc/54/26/96/944542696.db2.gz IFTRLYQFCJYAKL-AEFFLSMTSA-N 0 3 402.560 4.165 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)COc1ccc(Cl)c2cccnc12)c1ccco1 ZINC000561370260 944563336 /nfs/dbraw/zinc/56/33/36/944563336.db2.gz NGMJTPDQFJXXOT-PBHICJAKSA-N 0 3 401.894 4.106 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)COc1ccc(Cl)c2cccnc12)c1ccco1 ZINC000561370261 944563835 /nfs/dbraw/zinc/56/38/35/944563835.db2.gz NGMJTPDQFJXXOT-RHSMWYFYSA-N 0 3 401.894 4.106 20 0 HIADHN C[C@@H](NC(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1)c1c(F)cncc1F ZINC000561434799 944595956 /nfs/dbraw/zinc/59/59/56/944595956.db2.gz MUNTYRKVHDQRJP-PBHICJAKSA-N 0 3 408.518 4.255 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)c1ccc(OCc2ccncc2)cc1 ZINC000561514840 944648597 /nfs/dbraw/zinc/64/85/97/944648597.db2.gz ACAKPDAHOFOOPS-UHFFFAOYSA-N 0 3 407.489 4.004 20 0 HIADHN C[C@@H]1Cc2ccccc2N1Cc1occc1C(=O)N1CCN(C2CCC2)C[C@@H](C)C1 ZINC000561533384 944658878 /nfs/dbraw/zinc/65/88/78/944658878.db2.gz SMNBPNAPTUYFCQ-RTBURBONSA-N 0 3 407.558 4.177 20 0 HIADHN CC(=O)Nc1ccc(Cl)c(NC(=O)N[C@@H]2CCN(Cc3ccccc3)[C@H]2C)c1 ZINC000561591111 944694256 /nfs/dbraw/zinc/69/42/56/944694256.db2.gz QOLCPJHDZMBYFS-IFXJQAMLSA-N 0 3 400.910 4.083 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)c2cc(-c3cnn(C)c3)ccc2F)N(C)C)cc1 ZINC000561651079 944728861 /nfs/dbraw/zinc/72/88/61/944728861.db2.gz GICYEMCHJMXJQM-QHCPKHFHSA-N 0 3 424.520 4.046 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)c2ccc(NC(=O)[C@H]3C[C@H]3C)cc2)N(C)C)cc1 ZINC000561653938 944730125 /nfs/dbraw/zinc/73/01/25/944730125.db2.gz WPZSZAPFEOHIPS-VSDWSMLSSA-N 0 3 423.557 4.101 20 0 HIADHN COc1cccc(Cl)c1CC(=O)NC[C@H](c1ccc(OC(C)C)cc1)N(C)C ZINC000561653656 944730285 /nfs/dbraw/zinc/73/02/85/944730285.db2.gz RWISUIYEOADBIS-HXUWFJFHSA-N 0 3 404.938 4.097 20 0 HIADHN O=C([C@@H](C1CC1)N1CCCC1)N1CCc2nc(-c3ccccc3Cl)sc2C1 ZINC000561664720 944736643 /nfs/dbraw/zinc/73/66/43/944736643.db2.gz PNMXMCNZKBDTGO-LJQANCHMSA-N 0 3 401.963 4.223 20 0 HIADHN C[C@@H]1C[C@H]1N1CCN(C(=O)c2cc(F)c(Br)c(Cl)c2)C[C@@H](C)C1 ZINC000561761567 944784720 /nfs/dbraw/zinc/78/47/20/944784720.db2.gz MTEODRYMCCGORL-FIXISWKDSA-N 0 3 403.723 4.044 20 0 HIADHN COc1ccc(Br)c(NC(=O)N[C@H]2CCN(Cc3ccccc3)[C@H]2C)c1 ZINC000561799520 944801428 /nfs/dbraw/zinc/80/14/28/944801428.db2.gz NSTNGYFTUZPTKV-KSSFIOAISA-N 0 3 418.335 4.242 20 0 HIADHN Cc1ccc(SC2CCCC2)c(C(=O)NC[C@@]2(O)CCN(Cc3ccccc3)C2)c1 ZINC000561810503 944806090 /nfs/dbraw/zinc/80/60/90/944806090.db2.gz JZUYGIWSQIEHKM-VWLOTQADSA-N 0 3 424.610 4.397 20 0 HIADHN COC[C@H](NCC1(c2ccc3c(c2)OCO3)CCOCC1)c1cccc(Cl)c1F ZINC000562013840 944894341 /nfs/dbraw/zinc/89/43/41/944894341.db2.gz YWIMBNQMGXVROU-SFHVURJKSA-N 0 3 421.896 4.233 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1ccc(C(=O)N(CC)CC)cc1)c1ccco1 ZINC000562013421 944894487 /nfs/dbraw/zinc/89/44/87/944894487.db2.gz OZSUSKCIOCGARL-LPHOPBHVSA-N 0 3 400.523 4.013 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)Nc2cccc(N3CCCC3=O)c2)N(C)C)cc1 ZINC000562044347 944908157 /nfs/dbraw/zinc/90/81/57/944908157.db2.gz ARGRATQLYVTACG-JOCHJYFZSA-N 0 3 424.545 4.025 20 0 HIADHN COc1ccc(CN2CC[C@H](N[C@H](C)c3cccc4ccccc43)C2=O)c(OC)c1 ZINC000562047568 944909925 /nfs/dbraw/zinc/90/99/25/944909925.db2.gz LFPROPZAGMTDSL-HXOBKFHXSA-N 0 3 404.510 4.309 20 0 HIADHN C[C@@H]1C[C@@H]1[C@H](N[C@@H]1CCCc2ccc(S(N)(=O)=O)cc21)c1ccc(Cl)cc1 ZINC000562089722 944932546 /nfs/dbraw/zinc/93/25/46/944932546.db2.gz FFBZIMFBPICROZ-LGWKTVDISA-N 0 3 404.963 4.352 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(F)cc2)CC1)c1[nH]c2ccccc2c1Cl ZINC000562095667 944936050 /nfs/dbraw/zinc/93/60/50/944936050.db2.gz HOOLCDZOHVSZAY-UHFFFAOYSA-N 0 3 415.896 4.234 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1cc(OC)ccc1Br)c1ccco1 ZINC000562140123 944967901 /nfs/dbraw/zinc/96/79/01/944967901.db2.gz RUOQBFBFBCBELD-LRDDRELGSA-N 0 3 410.312 4.302 20 0 HIADHN CCCNC(=O)c1ccc(NC(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)cc1Cl ZINC000562140008 944968105 /nfs/dbraw/zinc/96/81/05/944968105.db2.gz OJBFBUMNOLKYFT-YWZLYKJASA-N 0 3 416.953 4.293 20 0 HIADHN CN(C)C[C@@H](NC(=O)Nc1ccc(OCc2ccncc2)cc1)c1ccc(F)cc1 ZINC000562163394 944992435 /nfs/dbraw/zinc/99/24/35/944992435.db2.gz GNSHQOIZKNCSOC-JOCHJYFZSA-N 0 3 408.477 4.224 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1ccc(OC)c(Br)c1)c1ccco1 ZINC000562169187 944998281 /nfs/dbraw/zinc/99/82/81/944998281.db2.gz QNTJARXHEWBMQG-WFASDCNBSA-N 0 3 410.312 4.302 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1NC(=O)N[C@H]1CCN(Cc2ccccc2)[C@H]1C ZINC000564136731 945396224 /nfs/dbraw/zinc/39/62/24/945396224.db2.gz YYODYENFBFNCCC-AVRDEDQJSA-N 0 3 403.530 4.274 20 0 HIADHN COc1ccc2c(c1F)CC[C@@H]2NC[C@@H](O)COc1cccc(Cl)c1Cl ZINC000564144472 945398658 /nfs/dbraw/zinc/39/86/58/945398658.db2.gz RZZTWGVYGNVZJY-ABAIWWIYSA-N 0 3 400.277 4.158 20 0 HIADHN CCS(=O)(=O)N1CCC([C@@H](C)N(C)Cc2nc(-c3ccc(C)cc3)cs2)CC1 ZINC000564153510 945402905 /nfs/dbraw/zinc/40/29/05/945402905.db2.gz UCIFBQVYXHNRJT-QGZVFWFLSA-N 0 3 421.632 4.001 20 0 HIADHN Cc1nn(Cc2ccc(C)cc2)c(C)c1CN1CC[C@](CO)(Cc2ccc(F)cc2)C1 ZINC000564330979 945518407 /nfs/dbraw/zinc/51/84/07/945518407.db2.gz UYKSHLGLIDWNHC-SANMLTNESA-N 0 3 421.560 4.423 20 0 HIADHN O=C(CCN1CC[C@H](n2cc(Cl)cn2)C1)NC(c1ccccc1)c1ccccc1 ZINC000564400808 945556952 /nfs/dbraw/zinc/55/69/52/945556952.db2.gz SWYIYXIWYXFTKS-NRFANRHFSA-N 0 3 408.933 4.079 20 0 HIADHN COc1ccc([C@@H](C)NCc2cc(C(F)(F)F)ccc2N2CCN(C)CC2)cc1O ZINC000564419384 945571727 /nfs/dbraw/zinc/57/17/27/945571727.db2.gz IIBDXVYZDQGXKZ-OAHLLOKOSA-N 0 3 423.479 4.022 20 0 HIADHN Cc1c(NC(=O)N(CCN(C)C)Cc2ccccc2)cnn1-c1ccc(Cl)cc1 ZINC000564491768 945623278 /nfs/dbraw/zinc/62/32/78/945623278.db2.gz HMDZXAGZSQGZKI-UHFFFAOYSA-N 0 3 411.937 4.430 20 0 HIADHN COC(C)(C)c1nc(C)c(C(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)s1 ZINC000564504102 945632153 /nfs/dbraw/zinc/63/21/53/945632153.db2.gz ISASMLIWQDCXNK-UHFFFAOYSA-N 0 3 416.591 4.116 20 0 HIADHN COc1ccccc1CCNC(=O)CN[C@H](c1cccc(C(F)(F)F)c1)C1CC1 ZINC000564579220 945685139 /nfs/dbraw/zinc/68/51/39/945685139.db2.gz HZKXZPPZCBTZST-NRFANRHFSA-N 0 3 406.448 4.114 20 0 HIADHN Cc1cccc(Cc2cnc(NC(=O)CN[C@@H]3CCN(C)[C@H]3c3ccccc3)s2)c1 ZINC000564688208 945731780 /nfs/dbraw/zinc/73/17/80/945731780.db2.gz BIDSMULVNOKZPC-GGAORHGYSA-N 0 3 420.582 4.016 20 0 HIADHN C[C@H](c1ccc(F)cc1)N(C)C(=O)CN[C@@H]1CCN(C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000565331065 945812520 /nfs/dbraw/zinc/81/25/20/945812520.db2.gz DOPKQLBQCQMNGR-ZFGLAFRWSA-N 0 3 421.919 4.173 20 0 HIADHN CSc1ccc([C@H](CNC(=O)c2c(C)nn(-c3ccccc3)c2C)N(C)C)cc1 ZINC000565356475 945817417 /nfs/dbraw/zinc/81/74/17/945817417.db2.gz MCRROHJUPNIJMH-NRFANRHFSA-N 0 3 408.571 4.244 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@H]2CCCC[C@H]2NCc2ccccc2Cn2ccnc2)cc1 ZINC000565369423 945817574 /nfs/dbraw/zinc/81/75/74/945817574.db2.gz XHQXHFMVHXSWTB-RPWUZVMVSA-N 0 3 423.582 4.115 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)CCCc2ccc(O)c(F)c2)N(C)C)cc1 ZINC000565444876 945831093 /nfs/dbraw/zinc/83/10/93/945831093.db2.gz REWGFTLCNSVXCZ-NRFANRHFSA-N 0 3 402.510 4.060 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)Cc1coc(-c2ccc(Cl)cc2)n1)c1ccco1 ZINC000565826844 945891374 /nfs/dbraw/zinc/89/13/74/945891374.db2.gz TVYGVEKHGQGCEC-RDTXWAMCSA-N 0 3 401.894 4.376 20 0 HIADHN CCCN(C)[C@H](CNC(=O)c1cn(CC)nc1C(F)(F)F)c1ccc(Cl)cc1 ZINC000565849559 945893703 /nfs/dbraw/zinc/89/37/03/945893703.db2.gz GCKCERGJJYPXOL-MRXNPFEDSA-N 0 3 416.875 4.388 20 0 HIADHN COc1ccc([C@@H](Cc2ccccc2)NCC(=O)Nc2cccc(NC(C)=O)c2)cc1 ZINC000565863480 945898971 /nfs/dbraw/zinc/89/89/71/945898971.db2.gz ZZQBRWMELWQHHC-XMMPIXPASA-N 0 3 417.509 4.166 20 0 HIADHN Cc1nn(-c2ccc(Br)cc2)c(C)c1CN1CC[C@H](COC(F)F)C1 ZINC000566389161 946018388 /nfs/dbraw/zinc/01/83/88/946018388.db2.gz OSTKXBWYNXHRFC-AWEZNQCLSA-N 0 3 414.294 4.313 20 0 HIADHN COCCOc1ccc(NC(=O)N[C@@H]2CCN(Cc3ccccc3)[C@@H]2C)cc1Cl ZINC000566522489 946029682 /nfs/dbraw/zinc/02/96/82/946029682.db2.gz PNJFEVCVJPKVKY-OXQOHEQNSA-N 0 3 417.937 4.150 20 0 HIADHN CCSc1cccc(F)c1NC(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000566532104 946034459 /nfs/dbraw/zinc/03/44/59/946034459.db2.gz LDACCISOOGLNPN-IYBDPMFKSA-N 0 3 409.571 4.291 20 0 HIADHN Cc1c2cc(F)ccc2oc1CNCCC(=O)Nc1ccc(N2CCCC2=O)cc1 ZINC000566533408 946036523 /nfs/dbraw/zinc/03/65/23/946036523.db2.gz ICUJMSZTBSALPC-UHFFFAOYSA-N 0 3 409.461 4.126 20 0 HIADHN Clc1ccc([C@H](CNCc2conc2Cc2ccccc2)N2CCOCC2)cc1 ZINC000566574950 946043498 /nfs/dbraw/zinc/04/34/98/946043498.db2.gz SNERHGBKAJCRNP-QHCPKHFHSA-N 0 3 411.933 4.082 20 0 HIADHN Cc1cc(NC(=O)c2ccccc2OC2CC2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000566585453 946047157 /nfs/dbraw/zinc/04/71/57/946047157.db2.gz QYEBHQWTMJFUGA-FQEVSTJZSA-N 0 3 416.525 4.432 20 0 HIADHN C[C@H](CC(=O)Nc1cccc(C(F)(F)F)c1)NCc1cc2ccccc2n(C)c1=O ZINC000566655171 946067649 /nfs/dbraw/zinc/06/76/49/946067649.db2.gz PDNFSZBYQRNESJ-CQSZACIVSA-N 0 3 417.431 4.064 20 0 HIADHN COCCCN(C(=O)c1cc(SC)c(Cl)cc1Cl)C1CCN(C)CC1 ZINC000566711486 946081122 /nfs/dbraw/zinc/08/11/22/946081122.db2.gz GGAQXMYLAZZJGP-UHFFFAOYSA-N 0 3 405.391 4.288 20 0 HIADHN CN(C)C[C@@H](NC(=O)Nc1nc(CN2CCCCC2)cs1)c1ccc(Cl)cc1 ZINC000566750462 946085825 /nfs/dbraw/zinc/08/58/25/946085825.db2.gz RHTHLVYYLGOXEY-GOSISDBHSA-N 0 3 421.998 4.207 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)c1ccc(C)c(NC(=O)c2ccco2)c1)c1ccco1 ZINC000566758017 946089893 /nfs/dbraw/zinc/08/98/93/946089893.db2.gz YXHDBIBBKIEQLK-QFBILLFUSA-N 0 3 409.486 4.293 20 0 HIADHN CCN(CC)CC(=O)Nc1cccc(NC(=O)c2[nH]c(-c3cccc(C)c3)nc2C)c1 ZINC000566759033 946090134 /nfs/dbraw/zinc/09/01/34/946090134.db2.gz YPRWJCMWWGZILU-UHFFFAOYSA-N 0 3 419.529 4.226 20 0 HIADHN Cc1nc(-c2ccc(S(=O)(=O)NCC(C)(C)N[C@H](C)c3ccccc3)cc2)co1 ZINC000566819937 946113314 /nfs/dbraw/zinc/11/33/14/946113314.db2.gz IANPFWQJJKPMEZ-MRXNPFEDSA-N 0 3 413.543 4.058 20 0 HIADHN C[C@@H](NCC(=O)Nc1ccccc1C(=O)c1ccccc1)[C@@H]1COc2ccccc21 ZINC000567147552 946253060 /nfs/dbraw/zinc/25/30/60/946253060.db2.gz QVILZGODXBWQPL-UTKZUKDTSA-N 0 3 400.478 4.010 20 0 HIADHN COCc1ccccc1/C=C(\C)CN(Cc1cncs1)C1CCN(C(C)=O)CC1 ZINC000567152719 946256268 /nfs/dbraw/zinc/25/62/68/946256268.db2.gz MSALDMUXPZGNDB-LDADJPATSA-N 0 3 413.587 4.206 20 0 HIADHN O=C(CCC(F)(F)F)N1CCC[C@@H](NCc2ccccc2OCc2ccncc2)C1 ZINC000567244144 946276571 /nfs/dbraw/zinc/27/65/71/946276571.db2.gz QDJDPAHCTMCYLT-LJQANCHMSA-N 0 3 421.463 4.084 20 0 HIADHN COc1ccc2oc([C@@H](C)N[C@H]3CCCc4cc(S(N)(=O)=O)ccc43)c(C)c2c1 ZINC000567574030 946378523 /nfs/dbraw/zinc/37/85/23/946378523.db2.gz YNABQOXXDJKHBF-VLIAUNLRSA-N 0 3 414.527 4.125 20 0 HIADHN COc1ccccc1C[C@H](C)CC(=O)N1CCN(c2ccnc3ccccc32)CC1 ZINC000568130368 946472475 /nfs/dbraw/zinc/47/24/75/946472475.db2.gz WZSIQKPJSPZROV-IBGZPJMESA-N 0 3 403.526 4.161 20 0 HIADHN Cc1cc(C(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)nn1-c1ccccc1 ZINC000568432464 946542638 /nfs/dbraw/zinc/54/26/38/946542638.db2.gz XRXFGSLZPIDQMN-QHCPKHFHSA-N 0 3 406.530 4.001 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(C4CC(c5cccc(F)c5)C4)n3)cn2)CC1 ZINC000568456768 946560206 /nfs/dbraw/zinc/56/02/06/946560206.db2.gz LIKWYNXSXJSLDE-UHFFFAOYSA-N 0 3 407.493 4.074 20 0 HIADHN COc1cccc(C(=O)CCCC(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@H]2C)c1 ZINC000568493308 946569796 /nfs/dbraw/zinc/56/97/96/946569796.db2.gz LRPPOHRTFWPLQS-AUSIDOKSSA-N 0 3 408.542 4.075 20 0 HIADHN CCc1nc(C(C)C)ccc1C(=O)Nc1ccc(C(=O)N(C)[C@@H]2CCCN(C)C2)cc1 ZINC000568610471 946624065 /nfs/dbraw/zinc/62/40/65/946624065.db2.gz JQHYYBQTQQZHTG-HXUWFJFHSA-N 0 3 422.573 4.186 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)c1ccccc1OCc1csc(C)n1)c1ccco1 ZINC000568642146 946630105 /nfs/dbraw/zinc/63/01/05/946630105.db2.gz XZKJBUXNFGTTTE-DNVCBOLYSA-N 0 3 413.543 4.483 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)N1CCN(c2ccccc2O)CC1)c1ccc(F)c2ccccc21 ZINC000568690207 946658252 /nfs/dbraw/zinc/65/82/52/946658252.db2.gz ISIJZDYRBANPNH-MSOLQXFVSA-N 0 3 421.516 4.072 20 0 HIADHN O=C([C@H]1CCCN(Cc2cccnc2)C1)N(CCC(F)(F)F)Cc1ccccc1 ZINC000568702903 946667930 /nfs/dbraw/zinc/66/79/30/946667930.db2.gz YAURHYPOUHDKMG-FQEVSTJZSA-N 0 3 405.464 4.275 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(CN[C@H](CN(C)C)c3ccc(F)cc3)c2)cc1 ZINC000568807553 946706296 /nfs/dbraw/zinc/70/62/96/946706296.db2.gz GWKOGAQEWINVCX-XMMPIXPASA-N 0 3 421.516 4.479 20 0 HIADHN COc1ccc(-c2ocnc2C(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)cc1 ZINC000568863155 946728560 /nfs/dbraw/zinc/72/85/60/946728560.db2.gz SVRWOVIOSDDVAN-UHFFFAOYSA-N 0 3 420.513 4.133 20 0 HIADHN CS(=O)(=O)C1(CN[C@H]2CCc3c2cc(Cl)cc3Br)CCCC1 ZINC000568895421 946739754 /nfs/dbraw/zinc/73/97/54/946739754.db2.gz DCDRIHVSBIBKDB-HNNXBMFYSA-N 0 3 406.773 4.037 20 0 HIADHN COc1ccc(CN2CCC[C@H](c3nnc(C4CC4)[nH]3)C2)cc1OCc1cccnc1 ZINC000568895852 946740010 /nfs/dbraw/zinc/74/00/10/946740010.db2.gz RWBNSAPSOYDYMK-FQEVSTJZSA-N 0 3 419.529 4.044 20 0 HIADHN COc1ccccc1[C@@H](CC(C)C)N[C@H]1CCCc2cc(S(N)(=O)=O)ccc21 ZINC000568908023 946745326 /nfs/dbraw/zinc/74/53/26/946745326.db2.gz QNWIMHTYOVXLIC-LEWJYISDSA-N 0 3 402.560 4.097 20 0 HIADHN Cc1cnccc1OC1CCN(C[C@H](O)CO[C@@H](C)c2ccc(Cl)cc2)CC1 ZINC000569055019 946812351 /nfs/dbraw/zinc/81/23/51/946812351.db2.gz WNIFSOSYGQJYNJ-PXNSSMCTSA-N 0 3 404.938 4.025 20 0 HIADHN CCCN(CCc1ccccn1)C(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000569253274 946841175 /nfs/dbraw/zinc/84/11/75/946841175.db2.gz RGNWIPYAMYUICX-QFIPXVFZSA-N 0 3 419.491 4.317 20 0 HIADHN COc1ccc([C@H](C)NC[C@H](c2c(F)cccc2Cl)N2CCO[C@@H](C)C2)cc1O ZINC000569512803 946883419 /nfs/dbraw/zinc/88/34/19/946883419.db2.gz HRFBESDVEOWZSQ-YZVOILCLSA-N 0 3 422.928 4.306 20 0 HIADHN CC(C)[C@H]1CCCN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)CC1 ZINC000569640980 946915197 /nfs/dbraw/zinc/91/51/97/946915197.db2.gz PZTLHEIRAWTPRM-QFIPXVFZSA-N 0 3 400.611 4.057 20 0 HIADHN CN(C)C[C@H](NC(=O)c1ccc2c(c1)[nH]c(=O)n2C1CCCC1)c1ccc(F)cc1 ZINC000569643512 946917400 /nfs/dbraw/zinc/91/74/00/946917400.db2.gz UCTDLDHMWLQUKF-FQEVSTJZSA-N 0 3 410.493 4.029 20 0 HIADHN C[C@H]1C[C@@H]1N1CCN(C(=O)c2ccc(-c3noc(CC(C)(C)C)n3)cc2)C[C@@H](C)C1 ZINC000569797339 947009301 /nfs/dbraw/zinc/00/93/01/947009301.db2.gz KNKKYJYOMFMKHD-ZWOKBUDYSA-N 0 3 410.562 4.128 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)Nc1ccccc1CN1C[C@H](C)O[C@@H](C)C1 ZINC000569837924 947016399 /nfs/dbraw/zinc/01/63/99/947016399.db2.gz MBPVAXRVFYYJMK-SFTDATJTSA-N 0 3 416.610 4.026 20 0 HIADHN CN1CC[C@@H](NCc2nc3cc(Br)ccc3[nH]2)[C@@H]1c1ccc(F)c(F)c1 ZINC000569970780 947057910 /nfs/dbraw/zinc/05/79/10/947057910.db2.gz XTOQNSCZCUIIEY-APWZRJJASA-N 0 3 421.289 4.139 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)CCSc2ccc3c(c2)OCCCO3)c1 ZINC000569992188 947063559 /nfs/dbraw/zinc/06/35/59/947063559.db2.gz PKBKDLNZAYBNSJ-UHFFFAOYSA-N 0 3 400.544 4.339 20 0 HIADHN CCCOc1cc(C)ccc1NC(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000569996752 947066915 /nfs/dbraw/zinc/06/69/15/947066915.db2.gz JCLHURSNJHTSJR-RTBURBONSA-N 0 3 403.567 4.137 20 0 HIADHN Cc1nc(COc2ccc(Cl)cc2)sc1C(=O)N1CC[C@H](N2CCCC2)[C@@H]1C ZINC000570116333 947098262 /nfs/dbraw/zinc/09/82/62/947098262.db2.gz SAOOMWXDPOLIFC-YJBOKZPZSA-N 0 3 419.978 4.383 20 0 HIADHN CC(C)[C@H](CNC(=O)CN[C@H]1c2ccccc2CC12CCOCC2)c1ccccc1 ZINC000570369785 947224908 /nfs/dbraw/zinc/22/49/08/947224908.db2.gz ZRNSBEKNSDNWIZ-ZCYQVOJMSA-N 0 3 406.570 4.226 20 0 HIADHN CC(C)[C@@H](CNC(=O)CN[C@@H]1c2ccccc2CC12CCOCC2)c1ccccc1 ZINC000570369782 947225105 /nfs/dbraw/zinc/22/51/05/947225105.db2.gz ZRNSBEKNSDNWIZ-ILBGXUMGSA-N 0 3 406.570 4.226 20 0 HIADHN C[C@H](N[C@@H]1CCN(C)[C@H]1c1ccc(F)c(F)c1)C(=O)Nc1ccc(F)cc1Cl ZINC000570487428 947264257 /nfs/dbraw/zinc/26/42/57/947264257.db2.gz CGWHZCDXBKGMLJ-SYURPWHHSA-N 0 3 411.855 4.119 20 0 HIADHN C/C(=C\c1cccc(C(F)(F)F)c1)CNCc1cccc(C(=O)N2CCOCC2)c1 ZINC000570599734 947308974 /nfs/dbraw/zinc/30/89/74/947308974.db2.gz VZNLSNHZWQWLOP-SFQUDFHCSA-N 0 3 418.459 4.371 20 0 HIADHN O=C1[C@H](N[C@H](C[C@@H]2CCOC2)c2ccccc2)CCN1c1ccc(F)c(Cl)c1 ZINC000570639246 947319396 /nfs/dbraw/zinc/31/93/96/947319396.db2.gz HGADORKXVHDNNC-IWMITWMQSA-N 0 3 402.897 4.342 20 0 HIADHN NC(=O)[C@H](Cc1ccc(C(F)(F)F)cc1)NC[C@H](Cc1ccccc1)C(F)(F)F ZINC000570737916 947341023 /nfs/dbraw/zinc/34/10/23/947341023.db2.gz PBLDDSBXPBRTFP-IRXDYDNUSA-N 0 3 418.381 4.113 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1cc2[nH]ccc2c(C(=O)OC)c1)c1ccsc1 ZINC000570757399 947347993 /nfs/dbraw/zinc/34/79/93/947347993.db2.gz FGVWRJPFVBOWKY-IBGZPJMESA-N 0 3 414.531 4.221 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1nc(C)sc1Br)c1ccsc1 ZINC000570788627 947357586 /nfs/dbraw/zinc/35/75/86/947357586.db2.gz MOQPHKHSJZIPMG-GFCCVEGCSA-N 0 3 402.383 4.088 20 0 HIADHN CSc1ccc([C@@H](CNC(=O)c2cnn(C3CCCCC3)c2C)N(C)C)cc1 ZINC000571337542 947603538 /nfs/dbraw/zinc/60/35/38/947603538.db2.gz WBMUPUGNGMTJJZ-OAQYLSRUSA-N 0 3 400.592 4.451 20 0 HIADHN Cc1cc(Cl)ccc1NC(=O)[C@H](C)N[C@H]1CCN(C)[C@@H]1c1ccc(F)c(F)c1 ZINC000571366725 947623152 /nfs/dbraw/zinc/62/31/52/947623152.db2.gz KPPHUCGUXTXJEG-QTJFZDIUSA-N 0 3 407.892 4.289 20 0 HIADHN Cc1noc(-c2ccc(C)c(NC(=O)N[C@@H]3CCN(Cc4ccccc4)[C@H]3C)c2)n1 ZINC000571474333 947664761 /nfs/dbraw/zinc/66/47/61/947664761.db2.gz MUPFTXHGNSNBIY-OXJNMPFZSA-N 0 3 405.502 4.138 20 0 HIADHN CSc1ccc([C@H](CNC(=O)C2(c3ccccc3C)CCOCC2)N(C)C)cc1 ZINC000571596067 947721636 /nfs/dbraw/zinc/72/16/36/947721636.db2.gz JMGOIWHLKNGQDY-QFIPXVFZSA-N 0 3 412.599 4.184 20 0 HIADHN CSc1ccc([C@H](CNC(=O)c2ccc(F)cc2Br)N(C)C)cc1 ZINC000571664317 947739648 /nfs/dbraw/zinc/73/96/48/947739648.db2.gz OECXUIMJXJQMEK-KRWDZBQOSA-N 0 3 411.340 4.343 20 0 HIADHN NS(=O)(=O)c1ccc2c(c1)[C@H](N[C@@H](Cc1ccccc1)c1ccccc1)CCC2 ZINC000571725236 947765852 /nfs/dbraw/zinc/76/58/52/947765852.db2.gz WEKSIONBWLFICB-RPWUZVMVSA-N 0 3 406.551 4.285 20 0 HIADHN CC(C)c1cccc(C(C)C)c1NC(=O)CN1CCC(N2CCOC[C@H]2C)CC1 ZINC000571742474 947773408 /nfs/dbraw/zinc/77/34/08/947773408.db2.gz UTYNTBOWANNKPM-LJQANCHMSA-N 0 3 401.595 4.057 20 0 HIADHN CN(C)C[C@@H](NC(=O)c1cccc(OCc2cscn2)c1)c1ccc(Cl)cc1 ZINC000571823891 947795418 /nfs/dbraw/zinc/79/54/18/947795418.db2.gz YOUSODSHRLDULH-HXUWFJFHSA-N 0 3 415.946 4.408 20 0 HIADHN CCN1CC[C@@H](NCc2cc(-c3cnn(C)c3C)no2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000571823378 947795443 /nfs/dbraw/zinc/79/54/43/947795443.db2.gz ZLSUWIXONRZJNA-TZIWHRDSSA-N 0 3 417.916 4.101 20 0 HIADHN C/C(=C/c1ccccc1OC(F)F)CN(C)[C@H](C)c1cccc(S(N)(=O)=O)c1 ZINC000571966343 947824241 /nfs/dbraw/zinc/82/42/41/947824241.db2.gz OBQGDWWFGDQYGX-QKXCFHHRSA-N 0 3 410.486 4.032 20 0 HIADHN C[C@H]1Cc2ccccc2N1Cc1ccoc1C(=O)N1CCCN(CC2CCC2)CC1 ZINC000571983307 947826392 /nfs/dbraw/zinc/82/63/92/947826392.db2.gz TVYLODRHCJKLJW-IBGZPJMESA-N 0 3 407.558 4.179 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N[C@@H](C)c2nccn2-c2ccccc2)C1 ZINC000572193032 947860463 /nfs/dbraw/zinc/86/04/63/947860463.db2.gz GFENNTDILQGYFL-ZVDOUQERSA-N 0 3 403.530 4.068 20 0 HIADHN CN(C)C(=O)COc1ccccc1CN1CCC([C@H](F)c2ccccc2F)CC1 ZINC000572324137 947885290 /nfs/dbraw/zinc/88/52/90/947885290.db2.gz KBOUNIWJAQKCEN-QHCPKHFHSA-N 0 3 402.485 4.216 20 0 HIADHN CC(C)N1CC[C@@H](N[C@@H](C)C(=O)Nc2ccc(F)cc2F)[C@@H]1c1ccc(F)c(F)c1 ZINC000572375186 947889957 /nfs/dbraw/zinc/88/99/57/947889957.db2.gz ILSODRQKQICSIL-DYXDTQHNSA-N 0 3 423.454 4.384 20 0 HIADHN Cc1ccc(Cl)cc1NC(=O)C[C@@H](C)N[C@@H](CC(=O)N(C)C)c1ccccc1 ZINC000572387592 947892116 /nfs/dbraw/zinc/89/21/16/947892116.db2.gz IIAVJXYXRZSSFN-UZLBHIALSA-N 0 3 401.938 4.175 20 0 HIADHN COC[C@]1(CNCc2c(Cl)cccc2N2CCCC2)OCCc2ccccc21 ZINC000572531163 947934855 /nfs/dbraw/zinc/93/48/55/947934855.db2.gz GGTNBNAYBJJDDQ-QHCPKHFHSA-N 0 3 400.950 4.144 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)c1cnnn1-c1c(Cl)cccc1Cl)c1ccco1 ZINC000572750746 948000213 /nfs/dbraw/zinc/00/02/13/948000213.db2.gz JZZWVWUJGUAZNV-DOMZBBRYSA-N 0 3 422.316 4.026 20 0 HIADHN Cc1nc(NC(=O)[C@H](C)N[C@@H]2CCN(C(C)C)[C@@H]2c2ccc(F)c(F)c2)sc1C ZINC000573011442 948056953 /nfs/dbraw/zinc/05/69/53/948056953.db2.gz YKULKCQGFCNELJ-MJXNMMHHSA-N 0 3 422.545 4.179 20 0 HIADHN COc1ccc(CNCc2ccc(N3CCc4ccccc4C3)nc2)c(C)c1OC ZINC000573132362 948083964 /nfs/dbraw/zinc/08/39/64/948083964.db2.gz UENWAOVPYSZMDO-UHFFFAOYSA-N 0 3 403.526 4.260 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)NC[C@H](NCc1ccccc1)c1ccco1 ZINC000573228766 948113757 /nfs/dbraw/zinc/11/37/57/948113757.db2.gz JASRZQHEGAIXDG-NRFANRHFSA-N 0 3 417.509 4.348 20 0 HIADHN C/C(=C\c1ccccc1OC(F)F)CN1CCC(C(=O)NCC(F)(F)F)CC1 ZINC000573495572 948219214 /nfs/dbraw/zinc/21/92/14/948219214.db2.gz MTHFUUOKNDQMQH-JLHYYAGUSA-N 0 3 406.395 4.082 20 0 HIADHN Cc1cc(NC(=O)NC[C@H](c2cccs2)N2CCCC2)nn1C1CCCCC1 ZINC000573689916 948272095 /nfs/dbraw/zinc/27/20/95/948272095.db2.gz SVWBUXHYPGGSLC-GOSISDBHSA-N 0 3 401.580 4.717 20 0 HIADHN C[C@H]1CN(CCCCNC(=O)c2cccc3cccc(Br)c32)C[C@H](C)O1 ZINC000573708088 948278858 /nfs/dbraw/zinc/27/88/58/948278858.db2.gz MZIKJLAYAMVXFO-HOTGVXAUSA-N 0 3 419.363 4.222 20 0 HIADHN COC(=O)c1cc(CN[C@@H]2CCCc3c4cc(Br)ccc4[nH]c32)c[nH]1 ZINC000573719877 948281420 /nfs/dbraw/zinc/28/14/20/948281420.db2.gz DBFOBQGSTGQFCC-MRXNPFEDSA-N 0 3 402.292 4.212 20 0 HIADHN COc1ccc(CCC(=O)NC[C@@H](c2ccc(SC)cc2)N(C)C)cc1Cl ZINC000573837960 948307644 /nfs/dbraw/zinc/30/76/44/948307644.db2.gz ZJUNAEQXDUEJGZ-IBGZPJMESA-N 0 3 406.979 4.422 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)c1ccc(Oc2ccc(C(N)=O)cc2)cc1)c1ccco1 ZINC000573950582 948332006 /nfs/dbraw/zinc/33/20/06/948332006.db2.gz UWNVQJJVNVORBE-IIBYNOLFSA-N 0 3 421.497 4.030 20 0 HIADHN Cc1nc(NC(=O)N(CCN(C)C)Cc2cccc(C)c2)sc1C(F)(F)F ZINC000574102971 948363912 /nfs/dbraw/zinc/36/39/12/948363912.db2.gz WNXNODBFUFXWSN-UHFFFAOYSA-N 0 3 400.470 4.374 20 0 HIADHN Cc1cc(C)c(NC(=O)[C@H](C)N[C@@H]2CCN(C)[C@@H]2c2ccc(F)c(F)c2)c(C)c1 ZINC000574122574 948371023 /nfs/dbraw/zinc/37/10/23/948371023.db2.gz YLHWIMNODGXUIV-SAWYMBPVSA-N 0 3 401.501 4.252 20 0 HIADHN Cc1cc(N2CCC(NCc3cc(C(F)(F)F)ccc3Br)CC2)n[nH]1 ZINC000574167330 948377513 /nfs/dbraw/zinc/37/75/13/948377513.db2.gz SIOSOJUPOLZHNY-UHFFFAOYSA-N 0 3 417.273 4.258 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)NCc2ccc(S(C)(=O)=O)c(Cl)c2)cc1 ZINC000574240692 948395692 /nfs/dbraw/zinc/39/56/92/948395692.db2.gz OPHVEJHZLUTECK-CQSZACIVSA-N 0 3 403.935 4.088 20 0 HIADHN Brc1ccc2[nH]cc(CC[NH2+][C@H](c3cccs3)c3nnc[n-]3)c2c1 ZINC000574300140 948405400 /nfs/dbraw/zinc/40/54/00/948405400.db2.gz NVGGCYPKAQBETP-MRXNPFEDSA-N 0 3 402.321 4.032 20 0 HIADHN C[C@@H](NCc1cccc(I)c1)c1ccc(NC(=O)C2CC2)cc1 ZINC000574469206 948449937 /nfs/dbraw/zinc/44/99/37/948449937.db2.gz IABOHTHNMPSZRK-CYBMUJFWSA-N 0 3 420.294 4.491 20 0 HIADHN CCc1c(NC(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)onc1C(F)(F)F ZINC000574475846 948452257 /nfs/dbraw/zinc/45/22/57/948452257.db2.gz SSXRFMPBDMLGJS-UHFFFAOYSA-N 0 3 410.440 4.039 20 0 HIADHN Cc1ccccc1CN1CCC(NS(=O)(=O)Cc2ccc(C(F)F)cc2)CC1 ZINC000574527088 948463401 /nfs/dbraw/zinc/46/34/01/948463401.db2.gz SEALNBQKPQJDLS-UHFFFAOYSA-N 0 3 408.514 4.017 20 0 HIADHN CN1CC[C@H](NC(=O)NC[C@@H](Cc2ccccc2)C(F)(F)F)[C@H]1c1ccccc1 ZINC000574614037 948492848 /nfs/dbraw/zinc/49/28/48/948492848.db2.gz BULLGHIEZTWMAB-HSALFYBXSA-N 0 3 405.464 4.152 20 0 HIADHN CCc1ccc([C@H](NCCC2(OC)CCC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000574657440 948497067 /nfs/dbraw/zinc/49/70/67/948497067.db2.gz NSXKPOKALRNKLN-QFIPXVFZSA-N 0 3 401.572 4.291 20 0 HIADHN Cc1ccc(C(=O)N[C@H](CN(C)C)c2ccc(F)cc2)cc1NC(=O)c1ccco1 ZINC000574784240 948524854 /nfs/dbraw/zinc/52/48/54/948524854.db2.gz AQHSPXQVQIEXTF-HXUWFJFHSA-N 0 3 409.461 4.012 20 0 HIADHN CC(C)C(=O)c1ccc([C@@H](C)C(=O)NC[C@@H]2CN(Cc3ccccc3)CCCO2)cc1 ZINC000574858933 948545592 /nfs/dbraw/zinc/54/55/92/948545592.db2.gz KSXFTZXPESLSLU-HYBUGGRVSA-N 0 3 422.569 4.036 20 0 HIADHN Cc1ccc(C[C@H](NC[C@@H](O)COc2cccc3[nH]ccc32)c2ccccn2)cc1 ZINC000574961759 948565844 /nfs/dbraw/zinc/56/58/44/948565844.db2.gz QQOQLIHXEQVQAN-YKSBVNFPSA-N 0 3 401.510 4.185 20 0 HIADHN CC[C@H](C)c1nc([C@H](C)NC(=O)NC[C@H](c2ccccc2Cl)N2CCCC2)n[nH]1 ZINC000575235292 948639977 /nfs/dbraw/zinc/63/99/77/948639977.db2.gz CAEYVXQMAKZRCO-RLFYNMQTSA-N 0 3 418.973 4.169 20 0 HIADHN CCCN(C)[C@H](CNC(=O)c1cnc(-c2cnn(C)c2)s1)c1ccc(Cl)cc1 ZINC000575416794 948666324 /nfs/dbraw/zinc/66/63/24/948666324.db2.gz YEIPENJEXKCFOY-QGZVFWFLSA-N 0 3 417.966 4.010 20 0 HIADHN CCOc1cc(CN2CCC[C@H](c3nnc(C4CC4)[nH]3)C2)ccc1OCC(F)(F)F ZINC000575855431 948742521 /nfs/dbraw/zinc/74/25/21/948742521.db2.gz AHSPTZHUKRLWJM-INIZCTEOSA-N 0 3 424.467 4.402 20 0 HIADHN C[C@@H](N[C@H]1CCN(c2ccc(Cl)cc2Cl)C1=O)c1ccccc1-n1ccnn1 ZINC000576017188 948810250 /nfs/dbraw/zinc/81/02/50/948810250.db2.gz ZMFHOABWNISAMG-DYVFJYSZSA-N 0 3 416.312 4.030 20 0 HIADHN FC(F)(c1cc(Cl)nc(Cl)n1)N1CCC[C@@H]2CN(Cc3ccccc3)C[C@@H]21 ZINC001164628741 719056389 /nfs/dbraw/zinc/05/63/89/719056389.db2.gz ZRGRIZFNIFPUFR-CABCVRRESA-N 0 3 413.299 4.429 20 0 HIADHN FC(F)(c1cc(Cl)nc(Cl)n1)N1CCC[C@H]2CN(Cc3ccccc3)C[C@@H]21 ZINC001164628742 719056617 /nfs/dbraw/zinc/05/66/17/719056617.db2.gz ZRGRIZFNIFPUFR-GJZGRUSLSA-N 0 3 413.299 4.429 20 0 HIADHN FC1(F)CCN(c2ccc(CN3CCCC3)cn2)C[C@@]12CCN(c1ccccc1)C2 ZINC001164824970 720396049 /nfs/dbraw/zinc/39/60/49/720396049.db2.gz STTZEXVEYUZQQQ-QHCPKHFHSA-N 0 3 412.528 4.420 20 0 HIADHN Clc1ccc2c(Cl)nnc(N3CC[C@H]4[C@H]3CCN4Cc3cccnc3)c2c1 ZINC001164726352 720463714 /nfs/dbraw/zinc/46/37/14/720463714.db2.gz BPVLVKLINWXSQZ-ZWKOTPCHSA-N 0 3 400.313 4.185 20 0 HIADHN FC(F)(c1cc(Cl)nc(Cl)c1)N1CCCn2cnc(CNC3CCC3)c2C1 ZINC001164836160 720736524 /nfs/dbraw/zinc/73/65/24/720736524.db2.gz BPYPTQTYAYGGJA-UHFFFAOYSA-N 0 3 416.303 4.182 20 0 HIADHN Fc1cccc(O[C@H]2C[C@@H]3CN(c4ccc(-c5ccccc5Cl)nn4)CCN3C2)c1 ZINC001164903405 721544201 /nfs/dbraw/zinc/54/42/01/721544201.db2.gz CJXAGEBSSTYDCV-MJGOQNOKSA-N 0 3 424.907 4.278 20 0 HIADHN Cc1cc(-c2cccc(F)c2)nnc1N1CCN2C[C@@H](Oc3cccc(F)c3)C[C@H]2C1 ZINC001164911684 721564712 /nfs/dbraw/zinc/56/47/12/721564712.db2.gz ZKOOGEFEHYKWIK-UNMCSNQZSA-N 0 3 422.479 4.072 20 0 HIADHN Cc1cncc(COC[C@]23CCC[C@H]2CN(c2ccc(CN(C)C4CC4)cn2)C3)c1 ZINC001164797807 721601659 /nfs/dbraw/zinc/60/16/59/721601659.db2.gz CFOLESKVNGDPNL-WIOPSUGQSA-N 0 3 406.574 4.203 20 0 HIADHN Cc1cc2ncnc(N3CCC(F)(F)[C@@]4(CCN(Cc5ccccn5)C4)C3)c2cc1C ZINC001164912163 721733027 /nfs/dbraw/zinc/73/30/27/721733027.db2.gz MEXCJTVPSHUTAD-HSZRJFAPSA-N 0 3 423.511 4.379 20 0 HIADHN Cc1cccc2c1ccnc2N1CCC2(CC1)COCCN(Cc1ccncc1)C2 ZINC001164963217 722056149 /nfs/dbraw/zinc/05/61/49/722056149.db2.gz ISIDUCUJGRNOLF-UHFFFAOYSA-N 0 3 402.542 4.057 20 0 HIADHN Clc1cc(N2CC[C@H]3CN(Cc4cccnc4)CCO[C@H]3C2)c2ccsc2n1 ZINC001164982520 722110081 /nfs/dbraw/zinc/11/00/81/722110081.db2.gz WWCCPSJSZHOQPM-LPHOPBHVSA-N 0 3 414.962 4.072 20 0 HIADHN Cc1ccc2c(c1)cc(Cl)nc2N1CC[C@@H]2CN(Cc3cccnc3)CCO[C@H]2C1 ZINC001164974250 722132587 /nfs/dbraw/zinc/13/25/87/722132587.db2.gz CSEBULPFGCCLCQ-KNQAVFIVSA-N 0 3 422.960 4.319 20 0 HIADHN CCOC(=O)c1cc2ccnc(N3CCC[C@]4(CCN4Cc4cccc(F)c4)C3)c2[nH]1 ZINC001164995193 722197901 /nfs/dbraw/zinc/19/79/01/722197901.db2.gz SKFJIUKFILRBPP-DEOSSOPVSA-N 0 3 422.504 4.124 20 0 HIADHN Fc1cccc(CN2CC[C@]23CCCN(c2cc(-c4nc(C5CC5)no4)ccn2)C3)c1 ZINC001164998473 722212491 /nfs/dbraw/zinc/21/24/91/722212491.db2.gz VSKXFCFJNKEIDI-DEOSSOPVSA-N 0 3 419.504 4.393 20 0 HIADHN CC(C)[C@@H]1CC[C@@H](NCc2nnc3n2CCOC3)[C@@H](Cc2ccc(Cl)cc2)C1 ZINC000436100222 861384169 /nfs/dbraw/zinc/38/41/69/861384169.db2.gz MMHLGZNBQOMWCB-WSTZPKSXSA-N 0 3 402.970 4.235 20 0 HIADHN CS[C@@H]1CN(C(=O)c2c(C)onc2-c2ccc(Cl)cc2Cl)C[C@H]1N(C)C ZINC000436153234 861453838 /nfs/dbraw/zinc/45/38/38/861453838.db2.gz XIKRDOLYSSIXAX-HUUCEWRRSA-N 0 3 414.358 4.074 20 0 HIADHN Cc1nc2c(nccc2C(=O)N(CCN(C)Cc2ccccc2)Cc2ccccc2)[nH]1 ZINC000436199203 861499109 /nfs/dbraw/zinc/49/91/09/861499109.db2.gz BNYPXHBGWKPXED-UHFFFAOYSA-N 0 3 413.525 4.041 20 0 HIADHN COc1cccc([C@H](C/N=C/c2cc(Br)ccc2O)N2CCCC2)c1 ZINC000005291968 845098796 /nfs/dbraw/zinc/09/87/96/845098796.db2.gz BKDRGROBRCUNCV-MEGCXXLRSA-N 0 3 403.320 4.419 20 0 HIADHN COc1ccc(CNCCNC(=O)c2ccccc2Cl)cc1OCc1ccccc1 ZINC000008165817 845483343 /nfs/dbraw/zinc/48/33/43/845483343.db2.gz YUPXKZHPULTJCL-UHFFFAOYSA-N 0 3 424.928 4.447 20 0 HIADHN CC(C)c1cc(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)c2cnn(C(C)C)c2n1 ZINC000008367089 845519607 /nfs/dbraw/zinc/51/96/07/845519607.db2.gz AJIWFMQKGJAHAO-LJQANCHMSA-N 0 3 405.546 4.140 20 0 HIADHN CN(C)Cc1ccccc1CNC(=O)c1cc2ccccc2cc1NC(=O)C1CC1 ZINC000010086095 845618828 /nfs/dbraw/zinc/61/88/28/845618828.db2.gz ARUIKNZJVPFFHH-UHFFFAOYSA-N 0 3 401.510 4.180 20 0 HIADHN COCCS(=O)(=O)c1ccc(CN[C@@H]2CC(C)(C)CCc3ccccc32)cc1 ZINC000436296672 861602460 /nfs/dbraw/zinc/60/24/60/861602460.db2.gz SKAWZDBCGRGVBT-JOCHJYFZSA-N 0 3 401.572 4.300 20 0 HIADHN C/C=C/c1ccc(OCC(=O)N2c3ccc(C)cc3[C@@H]3CN(C)CC[C@@H]32)c(OC)c1 ZINC000011760317 845830947 /nfs/dbraw/zinc/83/09/47/845830947.db2.gz BFWSJNHJRXZJOT-MTADBNSWSA-N 0 3 406.526 4.250 20 0 HIADHN CCc1ccc([C@@H](NCC(=O)Nc2cc(S(C)(=O)=O)ccc2Cl)C(C)C)cc1 ZINC000015522553 846058482 /nfs/dbraw/zinc/05/84/82/846058482.db2.gz UFJVYRYGWMVWLW-NRFANRHFSA-N 0 3 422.978 4.231 20 0 HIADHN Cc1nn(-c2ccccc2)c2sc(C(=O)NC[C@@H](c3ccccc3)N(C)C)cc12 ZINC000016599392 846189307 /nfs/dbraw/zinc/18/93/07/846189307.db2.gz NVTYCPKYGFEVHY-FQEVSTJZSA-N 0 3 404.539 4.428 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Cc3csc(-c4ccccc4)n3)cc2)CC1 ZINC000018891976 846344783 /nfs/dbraw/zinc/34/47/83/846344783.db2.gz DLPGVRPANYBVPE-UHFFFAOYSA-N 0 3 406.555 4.133 20 0 HIADHN CCOc1ccc([C@@H](NCC(=O)N2CCc3sccc3C2)C(C)C)cc1OCC ZINC000022102615 846532023 /nfs/dbraw/zinc/53/20/23/846532023.db2.gz QGALIQHTLQJPGT-QHCPKHFHSA-N 0 3 416.587 4.417 20 0 HIADHN C[C@@H](N[C@@H](CCCc1ccccc1)c1ccccc1)C(=O)Nc1ccc(C(N)=O)cc1 ZINC000022819082 846624814 /nfs/dbraw/zinc/62/48/14/846624814.db2.gz VDFAMVLXSQFLMW-DVECYGJZSA-N 0 3 415.537 4.466 20 0 HIADHN O=S(=O)(NCC1CCN(Cc2cccs2)CC1)c1ccc2ccccc2c1 ZINC000023000363 846646586 /nfs/dbraw/zinc/64/65/86/846646586.db2.gz HGGYFKTVCJTSMB-UHFFFAOYSA-N 0 3 400.569 4.092 20 0 HIADHN COc1ccc([C@@H](CNC(=O)CCCc2c[nH]c3ccccc23)N2CCCC2)cc1 ZINC000023486772 846707354 /nfs/dbraw/zinc/70/73/54/846707354.db2.gz ZFJSXMMHGOYNQU-XMMPIXPASA-N 0 3 405.542 4.453 20 0 HIADHN CCOC(=O)c1sc2ncnc(NC[C@@H](c3ccco3)N3CCCC3)c2c1C ZINC000023745031 846745479 /nfs/dbraw/zinc/74/54/79/846745479.db2.gz HKBLMLDEHOBARQ-AWEZNQCLSA-N 0 3 400.504 4.018 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@H]3C[C@H](c4cc(F)cc(F)c4)C3)c2)CC1 ZINC000436373707 861714741 /nfs/dbraw/zinc/71/47/41/861714741.db2.gz TUWARPKEIQNUFA-CYWCHRQTSA-N 0 3 414.500 4.174 20 0 HIADHN Cc1c(C(=O)NC[C@H](c2ccccc2)N2CCCC2)cnn1-c1cccc(Cl)c1 ZINC000024556117 846837618 /nfs/dbraw/zinc/83/76/18/846837618.db2.gz VLHQEXQWLWCRRW-JOCHJYFZSA-N 0 3 408.933 4.401 20 0 HIADHN C[C@@H](C1CC1)N(CC(=O)Nc1cc(Cl)ccc1-n1cncn1)Cc1ccccc1 ZINC000024674022 846852072 /nfs/dbraw/zinc/85/20/72/846852072.db2.gz ZLGUOAIGYZYRRU-INIZCTEOSA-N 0 3 409.921 4.160 20 0 HIADHN O=C(c1cc(-c2ccccc2Cl)[nH]n1)N1CCCN(Cc2ccc(F)cc2)CC1 ZINC000025093309 846923880 /nfs/dbraw/zinc/92/38/80/846923880.db2.gz PYPUCIMAAOEYEK-UHFFFAOYSA-N 0 3 412.896 4.217 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)CSc3nc4ccccc4o3)c(C)c2)CC1 ZINC000025186824 846938706 /nfs/dbraw/zinc/93/87/06/846938706.db2.gz NMAYUYCEOCYNGD-UHFFFAOYSA-N 0 3 410.543 4.009 20 0 HIADHN Cc1oc(-c2cccs2)nc1CC(=O)NCC(C)(C)N1CCc2ccccc2C1 ZINC000025464370 846981531 /nfs/dbraw/zinc/98/15/31/846981531.db2.gz GEJFYVBPPCYNGF-UHFFFAOYSA-N 0 3 409.555 4.207 20 0 HIADHN CC(C)[C@@H](CNC(=O)c1cccc(OC[C@@H]2CCCO2)c1)N1CCc2ccccc2C1 ZINC000025540590 846996383 /nfs/dbraw/zinc/99/63/83/846996383.db2.gz LWUFOVFVLKNZAH-LOSJGSFVSA-N 0 3 422.569 4.057 20 0 HIADHN COc1cc(C(C)=O)ccc1OC[C@@H](O)CN[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000025664067 847016757 /nfs/dbraw/zinc/01/67/57/847016757.db2.gz YKZZHUBQNXTVNV-UGSOOPFHSA-N 0 3 411.420 4.007 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cc2ccc(OC)cc2nc1C)c1cccc(OC)c1 ZINC000025861977 847046781 /nfs/dbraw/zinc/04/67/81/847046781.db2.gz NNQKOHPBJCOBTN-DEOSSOPVSA-N 0 3 421.541 4.373 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cc2ccc(OC)cc2nc1C)c1cccc(OC)c1 ZINC000025861982 847047342 /nfs/dbraw/zinc/04/73/42/847047342.db2.gz NNQKOHPBJCOBTN-XMMPIXPASA-N 0 3 421.541 4.373 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cc2cc(OC)ccc2nc1C)c1cccc(OC)c1 ZINC000025862618 847048427 /nfs/dbraw/zinc/04/84/27/847048427.db2.gz CFKDMNJBWBWVJI-DEOSSOPVSA-N 0 3 421.541 4.373 20 0 HIADHN COC(=O)c1ccc(CN(C)CCC(=O)N[C@@H](c2cccs2)c2ccccc2)cc1 ZINC000026321418 847124011 /nfs/dbraw/zinc/12/40/11/847124011.db2.gz NLAAFQMNKWSQOS-HSZRJFAPSA-N 0 3 422.550 4.262 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)CCn3ccc4ccccc43)CC2)c1 ZINC000026957093 847226908 /nfs/dbraw/zinc/22/69/08/847226908.db2.gz NMGAKKPUEZNILJ-UHFFFAOYSA-N 0 3 418.585 4.058 20 0 HIADHN Cc1noc(C)c1CSc1ncccc1C(=O)NC[C@H](c1ccccc1)N(C)C ZINC000027456428 847306768 /nfs/dbraw/zinc/30/67/68/847306768.db2.gz KJVOAXWTNDIZSQ-HXUWFJFHSA-N 0 3 410.543 4.011 20 0 HIADHN Cc1nn(CC(C)C)c(C)c1CCC(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000027606650 847326932 /nfs/dbraw/zinc/32/69/32/847326932.db2.gz JSXQULIRGBBJFK-HXUWFJFHSA-N 0 3 402.608 4.103 20 0 HIADHN Cc1cccc(-c2nnc(-c3ccc(C(=O)N[C@H](C)CN4CCCCC4)cc3)o2)c1 ZINC000027762980 847349284 /nfs/dbraw/zinc/34/92/84/847349284.db2.gz QOERFKLMCPYYTP-GOSISDBHSA-N 0 3 404.514 4.316 20 0 HIADHN CCCc1ccc(C(=O)CCC(=O)NC2CCN(CCc3ccccc3)CC2)cc1 ZINC000027926472 847365379 /nfs/dbraw/zinc/36/53/79/847365379.db2.gz YUJMSWYHXMNNPE-UHFFFAOYSA-N 0 3 406.570 4.425 20 0 HIADHN COc1ccc(NC(=O)[C@H](NCCc2ccc(OC)c(OC)c2)c2ccccc2)cc1 ZINC000028621937 847438379 /nfs/dbraw/zinc/43/83/79/847438379.db2.gz KNNPOQPJGIHUII-XMMPIXPASA-N 0 3 420.509 4.225 20 0 HIADHN O=C(CCN1CCN(Cc2ccccc2)CC1)N[C@@H](c1cccs1)c1ccccc1 ZINC000028843080 847468217 /nfs/dbraw/zinc/46/82/17/847468217.db2.gz BTWDEAXXKYLAEK-RUZDIDTESA-N 0 3 419.594 4.162 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3ccc(C(F)(F)F)nc3C)c(C)c2)CC1 ZINC000029008491 847491888 /nfs/dbraw/zinc/49/18/88/847491888.db2.gz RYZBBLKCGQXGLY-UHFFFAOYSA-N 0 3 406.452 4.111 20 0 HIADHN COc1ccc2c(CC(=O)NC[C@H](C(C)C)N3CCc4ccccc4C3)coc2c1 ZINC000029174707 847520613 /nfs/dbraw/zinc/52/06/13/847520613.db2.gz FIUPJPJHTXRCFY-HSZRJFAPSA-N 0 3 406.526 4.183 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)c1cnn(Cc2ccccc2Cl)c1 ZINC000029179026 847521624 /nfs/dbraw/zinc/52/16/24/847521624.db2.gz RIWCPYWQWWPTKG-JOCHJYFZSA-N 0 3 408.933 4.152 20 0 HIADHN CCOc1ccc(SCC(=O)Nc2ccc(N3CCN(CC)CC3)cc2C)cc1 ZINC000029375475 847554347 /nfs/dbraw/zinc/55/43/47/847554347.db2.gz BUBQKHVJMFREFH-UHFFFAOYSA-N 0 3 413.587 4.266 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1)c1ccsc1 ZINC000029414946 847560082 /nfs/dbraw/zinc/56/00/82/847560082.db2.gz PWZHNQMOPHSZOL-HXUWFJFHSA-N 0 3 416.547 4.069 20 0 HIADHN C[C@H](C1CC1)N(CC(=O)N1CCC(C(=O)Nc2ccccc2)CC1)Cc1ccccc1 ZINC000029843916 847632514 /nfs/dbraw/zinc/63/25/14/847632514.db2.gz MALJRBRXOUVXCK-HXUWFJFHSA-N 0 3 419.569 4.164 20 0 HIADHN CC(C)[C@@H]1CCCCN1CC(=O)N(Cc1nnc(-c2ccccc2Cl)o1)C1CC1 ZINC000436468001 861816223 /nfs/dbraw/zinc/81/62/23/861816223.db2.gz HYKHRLLDMRGVFD-IBGZPJMESA-N 0 3 416.953 4.392 20 0 HIADHN CC[C@H](CNC(=O)Cc1c(C)nc2ccccc2c1C)N1CCc2ccccc2C1 ZINC000029908378 847648253 /nfs/dbraw/zinc/64/82/53/847648253.db2.gz BGMQQPRLJFPSTF-JOCHJYFZSA-N 0 3 401.554 4.347 20 0 HIADHN COc1cc(CN[C@@H](C)c2ccc(-n3cncn3)cc2)ccc1OCc1ccncc1 ZINC000030545463 847733967 /nfs/dbraw/zinc/73/39/67/847733967.db2.gz IOBAKIHXBQIWQZ-SFHVURJKSA-N 0 3 415.497 4.101 20 0 HIADHN c1cn(Cc2ccccc2CNCc2cn(-c3ccccc3)nc2-c2ccncc2)cn1 ZINC000030652005 847752262 /nfs/dbraw/zinc/75/22/62/847752262.db2.gz JECWOSVHZCWUJY-UHFFFAOYSA-N 0 3 420.520 4.469 20 0 HIADHN COc1c(Br)cc(Br)cc1CNCCc1csc(C)n1 ZINC000030662546 847755389 /nfs/dbraw/zinc/75/53/89/847755389.db2.gz DEHDUTBBDYHWJE-UHFFFAOYSA-N 0 3 420.170 4.317 20 0 HIADHN COc1ccc(OC)c(CCC(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)c1 ZINC000030700627 847761958 /nfs/dbraw/zinc/76/19/58/847761958.db2.gz JNJHHDBUZDQGIK-FQEVSTJZSA-N 0 3 416.587 4.287 20 0 HIADHN COc1cc(CNCc2ccccc2Cn2cncn2)ccc1OCc1ccccc1 ZINC000030900772 847794002 /nfs/dbraw/zinc/79/40/02/847794002.db2.gz HNAJKXGNQLMDHF-UHFFFAOYSA-N 0 3 414.509 4.204 20 0 HIADHN COCCOc1ccc(CNCc2cn(-c3ccccc3)nc2-c2cccnc2)cc1 ZINC000030916361 847798432 /nfs/dbraw/zinc/79/84/32/847798432.db2.gz CTYVGUVHONMLKR-UHFFFAOYSA-N 0 3 414.509 4.249 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@H](C)c1cc(OC)ccc1OC)c1ccsc1 ZINC000031193937 847840990 /nfs/dbraw/zinc/84/09/90/847840990.db2.gz MFBHIWQZOJMKNG-DNVCBOLYSA-N 0 3 405.564 4.209 20 0 HIADHN CN(C)Cc1ccccc1NC(=O)[C@@H]1CCCN(C(=O)c2cccc3ccccc32)C1 ZINC000031232242 847847710 /nfs/dbraw/zinc/84/77/10/847847710.db2.gz CSXOGAOKKLXURW-OAQYLSRUSA-N 0 3 415.537 4.392 20 0 HIADHN CN(C)Cc1ccccc1NC(=O)[C@H]1CCCN(C(=O)c2cccc3ccccc32)C1 ZINC000031232244 847848139 /nfs/dbraw/zinc/84/81/39/847848139.db2.gz CSXOGAOKKLXURW-NRFANRHFSA-N 0 3 415.537 4.392 20 0 HIADHN Cc1ccccc1CN1CCCN(C(=O)c2ccc(OCc3ccncc3)cc2)CC1 ZINC000031765377 847944966 /nfs/dbraw/zinc/94/49/66/847944966.db2.gz RPCMNPNGBWXBRE-UHFFFAOYSA-N 0 3 415.537 4.317 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cnn(-c2ccc(F)cc2)c1C)c1ccsc1 ZINC000031983931 847975051 /nfs/dbraw/zinc/97/50/51/847975051.db2.gz LPDMJZWVYLTMNB-HXUWFJFHSA-N 0 3 400.523 4.194 20 0 HIADHN Cc1c(C(=O)NCCCN2CCc3ccccc3C2)cnn1-c1ccc(Cl)cc1 ZINC000032400985 848020305 /nfs/dbraw/zinc/02/03/05/848020305.db2.gz YQMYPGSARSVIKU-UHFFFAOYSA-N 0 3 408.933 4.012 20 0 HIADHN CC[C@@H](CNC(=O)Cc1nc(-c2ccccc2)oc1C)N1CCc2ccccc2C1 ZINC000032447327 848028052 /nfs/dbraw/zinc/02/80/52/848028052.db2.gz SLWOEQNVKAJVFC-QFIPXVFZSA-N 0 3 403.526 4.146 20 0 HIADHN CC[C@@H](CNC(=O)CCCc1nnc(-c2ccccc2)o1)N1CCc2ccccc2C1 ZINC000032650064 848059549 /nfs/dbraw/zinc/05/95/49/848059549.db2.gz VRNBVNQERRCEPN-QFIPXVFZSA-N 0 3 418.541 4.012 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)c2cnn(-c3ccc(F)cc3F)c2C)N(C)C)cc1 ZINC000032735007 848069705 /nfs/dbraw/zinc/06/97/05/848069705.db2.gz RIRTYSXZVSBORQ-JOCHJYFZSA-N 0 3 412.484 4.054 20 0 HIADHN CCc1ccc([C@H](CNC(=O)c2cccnc2SCc2cc(C)on2)N(C)C)cc1 ZINC000032733967 848069884 /nfs/dbraw/zinc/06/98/84/848069884.db2.gz RCWJNCXYDDBNBD-NRFANRHFSA-N 0 3 424.570 4.265 20 0 HIADHN Cc1nc(COc2ccc(F)cc2)sc1C(=O)NC[C@H](C)N1CCCC[C@@H]1C ZINC000032737035 848070695 /nfs/dbraw/zinc/07/06/95/848070695.db2.gz KREUNOMWVRHGOE-GJZGRUSLSA-N 0 3 405.539 4.162 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CC(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000032761762 848072991 /nfs/dbraw/zinc/07/29/91/848072991.db2.gz ZHILNNCVIHVJNL-NRFANRHFSA-N 0 3 408.571 4.046 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)C[C@H]1c2ccccc2C=CN1C(C)=O)c1ccsc1 ZINC000041441268 848215662 /nfs/dbraw/zinc/21/56/62/848215662.db2.gz XBHJQPVKDRGIIV-VXKWHMMOSA-N 0 3 411.571 4.211 20 0 HIADHN CSCC[C@@H](NC(=O)c1ccccc1)C(=O)C(C#N)c1nc2ccccc2s1 ZINC000041503770 848222135 /nfs/dbraw/zinc/22/21/35/848222135.db2.gz KDXRCGAVIKNCGS-DOTOQJQBSA-N 0 3 409.536 4.024 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=S)Nc3ccc(C)c(F)c3)CC2)c1 ZINC000041741228 848242185 /nfs/dbraw/zinc/24/21/85/848242185.db2.gz RDSDIVRBPLPQMU-UHFFFAOYSA-N 0 3 414.594 4.331 20 0 HIADHN COc1cc(-c2nc(CN3CCCC[C@@H]3[C@H]3CCCC[C@@H]3O)cs2)ccc1O ZINC000436659803 861884990 /nfs/dbraw/zinc/88/49/90/861884990.db2.gz AZOPZUPFRBUVAW-QRVBRYPASA-N 0 3 402.560 4.430 20 0 HIADHN Cc1ccc(-n2cnnc2SCC(=O)Nc2ccccc2CN(C)C)cc1Cl ZINC000042752706 848351446 /nfs/dbraw/zinc/35/14/46/848351446.db2.gz QMLZICOANHKHEF-UHFFFAOYSA-N 0 3 415.950 4.022 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCC(C(=O)c2ccccc2)CC1)c1ccccc1 ZINC000043230070 848396651 /nfs/dbraw/zinc/39/66/51/848396651.db2.gz MHXIEJJSDIOWJI-HSZRJFAPSA-N 0 3 407.558 4.374 20 0 HIADHN CC(C)C(=O)Nc1cccc(NC(=O)NCC(C)(C)N2CCc3ccccc3C2)c1 ZINC000044083034 848512851 /nfs/dbraw/zinc/51/28/51/848512851.db2.gz WIPKENXSDOQNTJ-UHFFFAOYSA-N 0 3 408.546 4.240 20 0 HIADHN O=C(Cc1csc(-c2cccc(F)c2)n1)NC[C@H](c1ccccc1)N1CCCC1 ZINC000044719537 848594274 /nfs/dbraw/zinc/59/42/74/848594274.db2.gz PODSAHDBPXPJSB-OAQYLSRUSA-N 0 3 409.530 4.445 20 0 HIADHN C[C@@H]([NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1)c1cc(Br)cs1 ZINC000436741190 861926318 /nfs/dbraw/zinc/92/63/18/861926318.db2.gz SCKDEWBIRSLIMP-GFCCVEGCSA-N 0 3 409.349 4.172 20 0 HIADHN COc1cccc([C@H](CNc2cc(C)nc(N)n2)c2c[nH]c3ccccc32)c1OC ZINC000045723953 848718182 /nfs/dbraw/zinc/71/81/82/848718182.db2.gz KLIRGQJQDAFZBV-SFHVURJKSA-N 0 3 403.486 4.110 20 0 HIADHN O=C(CN1CCN(C2CCCC2)CC1)N(Cc1ccc(F)cc1)C1CCCCC1 ZINC000045767890 848724461 /nfs/dbraw/zinc/72/44/61/848724461.db2.gz HRBZRTVXLBBHQN-UHFFFAOYSA-N 0 3 401.570 4.047 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)N1CCC[C@@H](c2nc3ccccc3o2)C1 ZINC000046428128 848846186 /nfs/dbraw/zinc/84/61/86/848846186.db2.gz IGJUBDYMEOQWCT-OAQYLSRUSA-N 0 3 418.541 4.165 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cnn(-c2ccccc2C)c1C)c1cccc(OC)c1 ZINC000046729559 848920423 /nfs/dbraw/zinc/92/04/23/848920423.db2.gz HOFCUEXRZMJXPA-DEOSSOPVSA-N 0 3 420.557 4.311 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cnn(-c2ccccc2)c1C)c1cccc(OC)c1 ZINC000046729503 848920703 /nfs/dbraw/zinc/92/07/03/848920703.db2.gz PYLMIBMMKVCCJY-QHCPKHFHSA-N 0 3 406.530 4.002 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCc3ncc(-c4ccccc4)o3)c(C)c2)CC1 ZINC000047041847 848975685 /nfs/dbraw/zinc/97/56/85/848975685.db2.gz NSBKVCZCTDHJFT-UHFFFAOYSA-N 0 3 419.529 4.114 20 0 HIADHN O=C(NCCCCN1CCN(c2cccc(C(F)(F)F)c2)CC1)c1ccccc1 ZINC000047460943 849051713 /nfs/dbraw/zinc/05/17/13/849051713.db2.gz OAZGJVFWURFMFH-UHFFFAOYSA-N 0 3 405.464 4.038 20 0 HIADHN CN(C)[C@@H](CNC(=O)Nc1cccc(COCc2ccco2)c1)Cc1ccccc1 ZINC000047602788 849082535 /nfs/dbraw/zinc/08/25/35/849082535.db2.gz UWYVRIDPSPAECM-JOCHJYFZSA-N 0 3 407.514 4.291 20 0 HIADHN CCN(CC)C(=O)Nc1ccc([C@@H](C)NCc2cc(OC)c(OC)c(OC)c2)cc1 ZINC000047724725 849099294 /nfs/dbraw/zinc/09/92/94/849099294.db2.gz VSXKGEUXENSEEP-MRXNPFEDSA-N 0 3 415.534 4.437 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)N[C@H](c1ccccc1)c1ccccn1 ZINC000047948758 849142582 /nfs/dbraw/zinc/14/25/82/849142582.db2.gz VAVBOOHPTBZITI-DNQXCXABSA-N 0 3 400.526 4.307 20 0 HIADHN CCCC(=O)Nc1cccc(CNC(=O)NC[C@H](c2ccccc2)N2CCCC2)c1 ZINC000047949416 849143129 /nfs/dbraw/zinc/14/31/29/849143129.db2.gz BATCRJMNNGWWMH-JOCHJYFZSA-N 0 3 408.546 4.062 20 0 HIADHN Cc1cc(C)n(-c2ccccc2NC(=O)N(CCN(C)C)Cc2ccc(F)cc2)n1 ZINC000048075678 849159724 /nfs/dbraw/zinc/15/97/24/849159724.db2.gz MUOMGOCHJSDOLM-UHFFFAOYSA-N 0 3 409.509 4.224 20 0 HIADHN Cc1[nH]c2ccc(Br)cc2c1CC(=O)NCc1ccccc1CN(C)C ZINC000048105391 849168320 /nfs/dbraw/zinc/16/83/20/849168320.db2.gz ZGAMURQAPHSCHK-UHFFFAOYSA-N 0 3 414.347 4.159 20 0 HIADHN CCc1ccc([C@H](CNC(=O)[C@@H](C)Sc2ccc(NC(C)=O)cc2)N(C)C)cc1 ZINC000048184799 849186269 /nfs/dbraw/zinc/18/62/69/849186269.db2.gz ZBGDSLRYPWVDDX-ZHRRBRCNSA-N 0 3 413.587 4.107 20 0 HIADHN CCn1c2ccccc2c2cc(CNCc3cccc(OCC(=O)NC)c3)ccc21 ZINC000048778675 849266978 /nfs/dbraw/zinc/26/69/78/849266978.db2.gz BOMAMZVDSTVQIX-UHFFFAOYSA-N 0 3 401.510 4.229 20 0 HIADHN Cc1cc(CN[C@@H](C)c2ccc(S(=O)(=O)N(C)C)cc2)cc(C)c1OC(F)F ZINC000048780411 849267498 /nfs/dbraw/zinc/26/74/98/849267498.db2.gz XXFLUZRIEFJVPR-HNNXBMFYSA-N 0 3 412.502 4.006 20 0 HIADHN N#CC(C(=O)CCCCc1ccc(Br)cc1)C(=O)NCc1ccccc1 ZINC000049492302 849311055 /nfs/dbraw/zinc/31/10/55/849311055.db2.gz YDCMHBHSIWECNS-IBGZPJMESA-N 0 3 413.315 4.187 20 0 HIADHN O=C(c1ccccc1[O-])N1CCC([NH2+][C@@H]2CCCc3ncc(C(F)(F)F)cc32)CC1 ZINC000436819321 862003313 /nfs/dbraw/zinc/00/33/13/862003313.db2.gz XXYJGCBMCZPWJB-LJQANCHMSA-N 0 3 419.447 4.078 20 0 HIADHN CCOc1ccc([C@H](C)[NH2+]C2CCN(C(=O)c3ccccc3[O-])CC2)cc1OCC ZINC000436825345 862007406 /nfs/dbraw/zinc/00/74/06/862007406.db2.gz DCTOMHUSSMSJKU-KRWDZBQOSA-N 0 3 412.530 4.145 20 0 HIADHN Cc1ccc(C(=O)NC2CCN(Cc3cc(C(C)(C)C)cc(O)c3O)CC2)s1 ZINC000050924207 849420941 /nfs/dbraw/zinc/42/09/41/849420941.db2.gz FGZRYAXGXMJPEH-UHFFFAOYSA-N 0 3 402.560 4.160 20 0 HIADHN COc1ccc2ccc([O-])c(C[NH+]3CCC(NC(=O)c4ccc(C)s4)CC3)c2c1 ZINC000050924224 849421024 /nfs/dbraw/zinc/42/10/24/849421024.db2.gz IUMYLFHOSBOJGY-UHFFFAOYSA-N 0 3 410.539 4.318 20 0 HIADHN Cc1ccc(C(=O)N(Cc2ccncc2)[C@H]2CCCN(Cc3ccccc3)C2)c(O)c1 ZINC000436850560 862028330 /nfs/dbraw/zinc/02/83/30/862028330.db2.gz IKMCZFXAPGUXGF-QHCPKHFHSA-N 0 3 415.537 4.403 20 0 HIADHN FC(F)(F)c1cc(NC[C@@H](c2cccc(Cl)c2)N2CCCC2)n2ncnc2n1 ZINC000052011598 849538025 /nfs/dbraw/zinc/53/80/25/849538025.db2.gz QOIMBFVVUSFMKW-AWEZNQCLSA-N 0 3 410.831 4.046 20 0 HIADHN O=C(CCN1CCC(C(=O)c2ccccc2)CC1)Nc1ccccc1Br ZINC000052412038 849578248 /nfs/dbraw/zinc/57/82/48/849578248.db2.gz UNDVGFMBWMLQAJ-UHFFFAOYSA-N 0 3 415.331 4.373 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@@H](C)NCc2cccc(OC(C)C)c2)cc1 ZINC000052514432 849590443 /nfs/dbraw/zinc/59/04/43/849590443.db2.gz HKGLCOQAEOYIQF-GOSISDBHSA-N 0 3 404.576 4.355 20 0 HIADHN COc1ccc([C@@H](CNC(=O)N[C@@H](C)c2ccc(OC)c(F)c2)N2CCCC2)cc1 ZINC000052710648 849616442 /nfs/dbraw/zinc/61/64/42/849616442.db2.gz SENGZOLJMPSWRE-HRAATJIYSA-N 0 3 415.509 4.040 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)C1(c2cccc(Cl)c2)CCOCC1 ZINC000052960145 849650160 /nfs/dbraw/zinc/65/01/60/849650160.db2.gz MTVTYTNQEZQZJN-QFIPXVFZSA-N 0 3 412.961 4.342 20 0 HIADHN N#Cc1c2[nH]c3ccccc3n2c(=O)cc1CN1CCC[C@@H]1Cc1cccc(F)c1 ZINC000053076576 849662424 /nfs/dbraw/zinc/66/24/24/849662424.db2.gz KVNHOBFNMCDIPO-UXHICEINSA-N 0 3 400.457 4.070 20 0 HIADHN Cc1nc(COc2cccc(C(=O)N(CCN(C)C)Cc3ccccc3)c2)cs1 ZINC000053175893 849675427 /nfs/dbraw/zinc/67/54/27/849675427.db2.gz LQTJQLKHCUZBPD-UHFFFAOYSA-N 0 3 409.555 4.235 20 0 HIADHN CC(C)(C)[C@@H](NCC(=O)N1CCC(C(=O)Nc2ccccc2)CC1)c1ccccc1 ZINC000053617793 849737729 /nfs/dbraw/zinc/73/77/29/849737729.db2.gz ASLBKMWZEJPQFZ-QHCPKHFHSA-N 0 3 407.558 4.241 20 0 HIADHN Cc1c(Br)c2ccccc2n1CC(=O)Nc1ccccc1CN(C)C ZINC000054002359 849792780 /nfs/dbraw/zinc/79/27/80/849792780.db2.gz ILLCKFIZULPFKU-UHFFFAOYSA-N 0 3 400.320 4.413 20 0 HIADHN O=S(=O)(c1ccc(CNCc2cc(-c3ccccc3)cs2)cc1)N1CCCC1 ZINC000054175678 849821368 /nfs/dbraw/zinc/82/13/68/849821368.db2.gz CRDZTAKSVFIHMC-UHFFFAOYSA-N 0 3 412.580 4.489 20 0 HIADHN Cc1ccc(C)n1-c1nc(CC(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)cs1 ZINC000054223055 849829243 /nfs/dbraw/zinc/82/92/43/849829243.db2.gz REBDFURLDGJARB-AZUAARDMSA-N 0 3 408.571 4.045 20 0 HIADHN O=C(NCc1coc(-c2cccs2)n1)NC[C@@H](c1cccs1)N1CCCC1 ZINC000054376763 849854516 /nfs/dbraw/zinc/85/45/16/849854516.db2.gz OPOSHALBMOQLFM-HNNXBMFYSA-N 0 3 402.545 4.101 20 0 HIADHN CCN(CC)C(=O)c1cccc(NC(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)c1 ZINC000054382516 849855456 /nfs/dbraw/zinc/85/54/56/849855456.db2.gz PGNJLWPGRMXGQY-AVRDEDQJSA-N 0 3 408.546 4.126 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)Nc2ccc(NC(=O)c3ccco3)cc2)C1 ZINC000054387514 849856869 /nfs/dbraw/zinc/85/68/69/849856869.db2.gz ADHAPCIJPDROKM-UTKZUKDTSA-N 0 3 418.497 4.489 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)Nc2ccc(OC[C@@H]3CCCO3)cc2)C1 ZINC000054434391 849867244 /nfs/dbraw/zinc/86/72/44/849867244.db2.gz JEJWVQONZLZTAO-JZWVFAODSA-N 0 3 409.530 4.201 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)N(C)Cc2ccc(OC(F)F)cc2)C1 ZINC000054718543 849912550 /nfs/dbraw/zinc/91/25/50/849912550.db2.gz MPJGSQHHZWGNRA-LPHOPBHVSA-N 0 3 403.473 4.265 20 0 HIADHN O=C(NCc1ccco1)c1cccc(CN2CCC[C@H](C(=O)Nc3ccccc3)C2)c1 ZINC000055900417 850200292 /nfs/dbraw/zinc/20/02/92/850200292.db2.gz HNWVNTQLKQUOSV-NRFANRHFSA-N 0 3 417.509 4.060 20 0 HIADHN Cc1ccc(CNC(=O)[C@@H](C)N[C@H](C)c2ccc(OCc3cccnc3)cc2)cc1 ZINC000056144236 850252704 /nfs/dbraw/zinc/25/27/04/850252704.db2.gz ORPGDBLRTRYECA-WOJBJXKFSA-N 0 3 403.526 4.325 20 0 HIADHN CCN(CC)C(=O)[C@H](Nc1ccc(N2CCN(CC)CC2)cc1C)c1ccccc1 ZINC000056170261 850268345 /nfs/dbraw/zinc/26/83/45/850268345.db2.gz DUTGYEHWZXLAKJ-XMMPIXPASA-N 0 3 408.590 4.159 20 0 HIADHN CCN(CC)C(=O)[C@@H](Nc1ccc(N2CCN(CC)CC2)cc1C)c1ccccc1 ZINC000056170260 850268920 /nfs/dbraw/zinc/26/89/20/850268920.db2.gz DUTGYEHWZXLAKJ-DEOSSOPVSA-N 0 3 408.590 4.159 20 0 HIADHN CCN1CCN(c2ccc(N[C@H](C)C(=O)N[C@@H](C)c3ccccc3C)c(C)c2)CC1 ZINC000056170381 850270234 /nfs/dbraw/zinc/27/02/34/850270234.db2.gz FIVYMTMTKGNNSL-LEWJYISDSA-N 0 3 408.590 4.123 20 0 HIADHN O=C(NC1CCN(Cc2cccc(OCC(F)(F)F)c2)CC1)c1ccc(F)cc1 ZINC000056283650 850311564 /nfs/dbraw/zinc/31/15/64/850311564.db2.gz HXJSYECMHRPBQE-UHFFFAOYSA-N 0 3 410.411 4.161 20 0 HIADHN O=C(c1ccccc1[O-])N1CCC([NH2+][C@@H](C[C@@H]2CCCO2)c2ccc(F)cc2)CC1 ZINC000436942059 862119050 /nfs/dbraw/zinc/11/90/50/862119050.db2.gz UBAPXCODZDJFCG-UNMCSNQZSA-N 0 3 412.505 4.036 20 0 HIADHN CCN(CC)C(=O)c1ccccc1NC(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000056554619 850391229 /nfs/dbraw/zinc/39/12/29/850391229.db2.gz OOEADQPVVZPITP-LJQANCHMSA-N 0 3 414.575 4.189 20 0 HIADHN O=C(Nc1ccccc1OC[C@@H]1CCCCO1)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000056554818 850391523 /nfs/dbraw/zinc/39/15/23/850391523.db2.gz DIUKCWVHVVRDKV-RTWAWAEBSA-N 0 3 409.530 4.031 20 0 HIADHN CCN(CC)C(=O)c1ccccc1NC(=O)NC[C@@H](c1ccsc1)N(CC)CC ZINC000056623656 850419260 /nfs/dbraw/zinc/41/92/60/850419260.db2.gz IGGUQCJWVNOMMR-FQEVSTJZSA-N 0 3 416.591 4.435 20 0 HIADHN CC(=O)Nc1c(C)ccc(NC(=O)N2CCCN(Cc3ccccc3C)CC2)c1C ZINC000056691038 850440326 /nfs/dbraw/zinc/44/03/26/850440326.db2.gz COJQILQKEITBIU-UHFFFAOYSA-N 0 3 408.546 4.310 20 0 HIADHN Cc1ccc(NC(=O)C2CC2)cc1NC(=O)NC[C@H](c1ccccc1)N1CCCC1 ZINC000057543456 850665534 /nfs/dbraw/zinc/66/55/34/850665534.db2.gz WEINREOTCFRHCY-JOCHJYFZSA-N 0 3 406.530 4.302 20 0 HIADHN COc1ccc([C@H](CNC(=O)Nc2ccc3c(c2)OC(C)(C)O3)N2CCCC2)cc1 ZINC000057858924 850733221 /nfs/dbraw/zinc/73/32/21/850733221.db2.gz JAQBUQDVPQGZND-IBGZPJMESA-N 0 3 411.502 4.161 20 0 HIADHN COc1ccccc1OCCC(=O)NC[C@H](c1cccs1)N1CCC(C)CC1 ZINC000058118373 850768765 /nfs/dbraw/zinc/76/87/65/850768765.db2.gz AUOBENVYLKSYRU-GOSISDBHSA-N 0 3 402.560 4.115 20 0 HIADHN CN(CCNC(=O)N[C@@H]1CCCc2cc(OC(F)F)ccc21)Cc1ccccc1 ZINC000058572538 850859235 /nfs/dbraw/zinc/85/92/35/850859235.db2.gz VMHVUBGUGRZGRK-HXUWFJFHSA-N 0 3 403.473 4.097 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CNC(=O)CN(CC1CCCCC1)C1CC1 ZINC000059390898 851003502 /nfs/dbraw/zinc/00/35/02/851003502.db2.gz BWSCNDUYCUKHCM-UHFFFAOYSA-N 0 3 408.590 4.209 20 0 HIADHN O=C(CCc1ccccc1Br)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000059403445 851004930 /nfs/dbraw/zinc/00/49/30/851004930.db2.gz UVOSYPRWZVCTRW-LJQANCHMSA-N 0 3 401.348 4.163 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)CC2CCN(C(=O)OC(C)(C)C)CC2)N(C)C)cc1 ZINC000060143378 851045554 /nfs/dbraw/zinc/04/55/54/851045554.db2.gz NIBNUSQXDSLIJR-OAQYLSRUSA-N 0 3 417.594 4.005 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2nn(-c3ccccc3C)c3c2CCC3)N(C)C)cc1 ZINC000060155533 851045602 /nfs/dbraw/zinc/04/56/02/851045602.db2.gz GPVFPOAULFKFTF-HSZRJFAPSA-N 0 3 402.542 4.011 20 0 HIADHN C[C@H]1C[C@@H]1C(=O)Nc1cccc(C(=O)N2CCCN(CCCc3ccccc3)CC2)c1 ZINC000060355325 851076267 /nfs/dbraw/zinc/07/62/67/851076267.db2.gz VFGJVUHXNXKGLI-RDPSFJRHSA-N 0 3 419.569 4.062 20 0 HIADHN CN(C)[C@@H](CNC(=O)CCc1nc2ccccc2n1-c1ccccc1)c1ccccc1 ZINC000060392275 851086479 /nfs/dbraw/zinc/08/64/79/851086479.db2.gz YXRKEBAVSZHIOD-DEOSSOPVSA-N 0 3 412.537 4.377 20 0 HIADHN CN(C)[C@H](CNc1ncc(C(=O)N2CCCCC2)cc1Cl)c1ccc(F)cc1 ZINC000060446884 851102386 /nfs/dbraw/zinc/10/23/86/851102386.db2.gz QKVAFFOEXMBHSS-LJQANCHMSA-N 0 3 404.917 4.215 20 0 HIADHN O=C(Nc1cc(Cl)ccc1[O-])C1CC[NH+](Cc2ccc(OC(F)F)cc2)CC1 ZINC000060477848 851113412 /nfs/dbraw/zinc/11/34/12/851113412.db2.gz PGHQFBALNHLSPE-UHFFFAOYSA-N 0 3 410.848 4.498 20 0 HIADHN CCN(Cc1cc(Br)ccc1F)C(=O)NC[C@@H](c1ccccc1)N(C)C ZINC000060530334 851134669 /nfs/dbraw/zinc/13/46/69/851134669.db2.gz AYNOUTRSFQUOFE-IBGZPJMESA-N 0 3 422.342 4.423 20 0 HIADHN COc1c(C)cnc(CN(C)C(=O)NC[C@H](c2ccccc2)N2CCC(C)CC2)c1C ZINC000060558571 851146558 /nfs/dbraw/zinc/14/65/58/851146558.db2.gz LPJKTJSKBMKFOB-HSZRJFAPSA-N 0 3 424.589 4.322 20 0 HIADHN O=C(Nc1ccc(C(=O)N2CCN(CC3CCCCC3)CC2)cc1)c1ccccc1 ZINC000060579189 851154639 /nfs/dbraw/zinc/15/46/39/851154639.db2.gz HUFQGLQCCKFDCV-UHFFFAOYSA-N 0 3 405.542 4.277 20 0 HIADHN Cc1ccc(Oc2ccc(NC(=O)C(=O)N3CCCN(C(C)(C)C)CC3)cc2)cc1 ZINC000060689073 851191386 /nfs/dbraw/zinc/19/13/86/851191386.db2.gz UKMMYZVNPMKPMV-UHFFFAOYSA-N 0 3 409.530 4.059 20 0 HIADHN CN(C)CCN(CCc1ccccc1)C(=O)c1cccc(NC(=O)c2cccs2)c1 ZINC000060713600 851196596 /nfs/dbraw/zinc/19/65/96/851196596.db2.gz WNOKBJIFRCKHQB-UHFFFAOYSA-N 0 3 421.566 4.247 20 0 HIADHN CCOc1cc(CNCc2cccc(Cl)c2)ccc1OCC(=O)N1CCCCC1 ZINC000060815238 851219686 /nfs/dbraw/zinc/21/96/86/851219686.db2.gz KCGQNIARMXTJCP-UHFFFAOYSA-N 0 3 416.949 4.420 20 0 HIADHN CC[C@H](C)c1ccc(S(=O)(=O)NCC2CCN(Cc3cccs3)CC2)cc1 ZINC000060923558 851250057 /nfs/dbraw/zinc/25/00/57/851250057.db2.gz GVBBFJTYFNRERM-KRWDZBQOSA-N 0 3 406.617 4.452 20 0 HIADHN CCc1cc2c(CNc3ccc(CC[NH+]4CCSCC4)cc3)cc(=O)oc2cc1[O-] ZINC000060926542 851251048 /nfs/dbraw/zinc/25/10/48/851251048.db2.gz GUPHGTYFKARHET-UHFFFAOYSA-N 0 3 424.566 4.264 20 0 HIADHN CCN(CC)CCN(Cc1cccs1)S(=O)(=O)c1ccccc1C(F)(F)F ZINC000060949162 851254891 /nfs/dbraw/zinc/25/48/91/851254891.db2.gz IMZGSOPHMYSGQY-UHFFFAOYSA-N 0 3 420.522 4.300 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc(CNCc2cccc(C(F)(F)F)c2)cc1 ZINC000061029386 851278268 /nfs/dbraw/zinc/27/82/68/851278268.db2.gz ABBLPZCDRACPLM-UHFFFAOYSA-N 0 3 400.466 4.026 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)NCCc3ccccc3C(F)(F)F)cc2)CC1 ZINC000061190700 851313781 /nfs/dbraw/zinc/31/37/81/851313781.db2.gz UPYQBCWMCHXAFC-UHFFFAOYSA-N 0 3 419.491 4.208 20 0 HIADHN CC(C)[C@@H](NC(=O)c1ccc(N2CCN(C(C)C)CC2)cc1)c1nc2ccccc2[nH]1 ZINC000061195816 851314499 /nfs/dbraw/zinc/31/44/99/851314499.db2.gz LJKCPWLUYQDFJF-HSZRJFAPSA-N 0 3 419.573 4.220 20 0 HIADHN CC(=O)Nc1cc(NC(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)ccc1Cl ZINC000061195781 851315095 /nfs/dbraw/zinc/31/50/95/851315095.db2.gz HSIWONHQRWEIFQ-UHFFFAOYSA-N 0 3 414.937 4.081 20 0 HIADHN O=C(NCc1csc(Br)c1)NC[C@H](c1ccccc1)N1CCCC1 ZINC000061230605 851324524 /nfs/dbraw/zinc/32/45/24/851324524.db2.gz XQYLVCKTMABCRC-MRXNPFEDSA-N 0 3 408.365 4.147 20 0 HIADHN O=C(COc1ccc(F)c(Cl)c1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000061288155 851340077 /nfs/dbraw/zinc/34/00/77/851340077.db2.gz XZWLBGRHZLJBIB-UHFFFAOYSA-N 0 3 408.926 4.088 20 0 HIADHN CCCOC(=O)c1ccc(NC(=O)N2CCCN(Cc3ccccc3C)CC2)cc1 ZINC000061331531 851348995 /nfs/dbraw/zinc/34/89/95/851348995.db2.gz IBAKGDZIXVXPSM-UHFFFAOYSA-N 0 3 409.530 4.302 20 0 HIADHN COC(=O)c1ccc(NC(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)c(C)c1 ZINC000061409708 851369534 /nfs/dbraw/zinc/36/95/34/851369534.db2.gz DYTMOIACAFDSDB-LJQANCHMSA-N 0 3 415.559 4.438 20 0 HIADHN Cc1ccccc1CN1CCCN(C(=O)Cc2ccc(OC(F)(F)F)cc2)CC1 ZINC000061451437 851382117 /nfs/dbraw/zinc/38/21/17/851382117.db2.gz QWPWQOOTOUUQQB-UHFFFAOYSA-N 0 3 406.448 4.171 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2ccc(C(=O)NC(C)(C)C)cc2)N2CCCC2)cc1 ZINC000061749219 851438999 /nfs/dbraw/zinc/43/89/99/851438999.db2.gz MBPMYOWIBXCSOI-QFIPXVFZSA-N 0 3 422.573 4.482 20 0 HIADHN CCN(Cc1ccccc1NC(=O)NC[C@@H](c1ccc(C)cc1)N1CCCC1)C(C)=O ZINC000061750824 851439956 /nfs/dbraw/zinc/43/99/56/851439956.db2.gz UDBRJXSYXOAISA-DEOSSOPVSA-N 0 3 422.573 4.322 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2cc(C(=O)NC3CC3)ccc2C)N2CCCC2)cc1 ZINC000061751311 851439981 /nfs/dbraw/zinc/43/99/81/851439981.db2.gz ONWXXNKOYJQAAO-QHCPKHFHSA-N 0 3 420.557 4.154 20 0 HIADHN Cc1c([C@H](C)NCC2CCN(CC(F)(F)F)CC2)nnn1-c1cccc(Cl)c1 ZINC000437050434 862243901 /nfs/dbraw/zinc/24/39/01/862243901.db2.gz IFZBQLDMRTXFKF-ZDUSSCGKSA-N 0 3 415.891 4.154 20 0 HIADHN Cc1nc(-c2cccc(NC(=O)NC[C@@H](c3ccc(C)cc3)N3CCCC3)c2)no1 ZINC000061785782 851451003 /nfs/dbraw/zinc/45/10/03/851451003.db2.gz QMDMWTHMEIJBAQ-NRFANRHFSA-N 0 3 405.502 4.312 20 0 HIADHN COc1cccc([C@@H](CNC(=O)N2CCC[C@@H]2c2nc3cc(C)ccc3[nH]2)N(C)C)c1 ZINC000061795641 851456105 /nfs/dbraw/zinc/45/61/05/851456105.db2.gz ZCFNYZFULKDPEX-FGZHOGPDSA-N 0 3 421.545 4.029 20 0 HIADHN COc1cccc([C@@H](CNC(=O)N2CCC[C@@H]2c2nc3ccc(C)cc3[nH]2)N(C)C)c1 ZINC000061795641 851456118 /nfs/dbraw/zinc/45/61/18/851456118.db2.gz ZCFNYZFULKDPEX-FGZHOGPDSA-N 0 3 421.545 4.029 20 0 HIADHN CCN1CCN(Cc2ccc(CNC(=O)CCCC[C@H]3CCSS3)cc2)CC1 ZINC000061870953 851466055 /nfs/dbraw/zinc/46/60/55/851466055.db2.gz FDCKKZPMAARJFA-NRFANRHFSA-N 0 3 421.676 4.154 20 0 HIADHN C[C@@H](NC(=O)NCC(C)(C)N1CCc2ccccc2C1)c1cccc(OC(F)F)c1 ZINC000061966530 851482328 /nfs/dbraw/zinc/48/23/28/851482328.db2.gz LUGYLRZCAPXAKD-MRXNPFEDSA-N 0 3 417.500 4.485 20 0 HIADHN CCc1ccc(CNC(=O)NCCCCN2CCN(c3cccc(C)c3)CC2)s1 ZINC000061986864 851487121 /nfs/dbraw/zinc/48/71/21/851487121.db2.gz IBLOBUFXCAAKTE-UHFFFAOYSA-N 0 3 414.619 4.021 20 0 HIADHN CC(C)(CNC(=O)NCc1ccc(Br)s1)N1CCc2ccccc2C1 ZINC000062029569 851492806 /nfs/dbraw/zinc/49/28/06/851492806.db2.gz XNAXBPSGOSWTAG-UHFFFAOYSA-N 0 3 422.392 4.147 20 0 HIADHN COc1ccc(C(=O)CCCC(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000062229765 851512006 /nfs/dbraw/zinc/51/20/06/851512006.db2.gz UOLAIZWQVWLFEZ-NRFANRHFSA-N 0 3 408.542 4.077 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)Nc1ccccc1OC(F)(F)F ZINC000062380154 851536262 /nfs/dbraw/zinc/53/62/62/851536262.db2.gz SXBXIGBURPNVIZ-UHFFFAOYSA-N 0 3 417.378 4.459 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)Nc1cccc(Cn2cccn2)c1 ZINC000062388048 851538404 /nfs/dbraw/zinc/53/84/04/851538404.db2.gz IDWHZPKQHCRLDV-UHFFFAOYSA-N 0 3 411.937 4.181 20 0 HIADHN COCc1ccccc1NC(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1 ZINC000062389792 851539788 /nfs/dbraw/zinc/53/97/88/851539788.db2.gz HNKXRUJMKVLFBX-UHFFFAOYSA-N 0 3 409.452 4.448 20 0 HIADHN CCCC(=O)Nc1cccc(NC(=O)N(CCN(C)C)Cc2cccc(F)c2)c1 ZINC000062400764 851541561 /nfs/dbraw/zinc/54/15/61/851541561.db2.gz RYWHMSACVUWCNQ-UHFFFAOYSA-N 0 3 400.498 4.160 20 0 HIADHN CC(=O)N(C)c1ccc(NC(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)cc1 ZINC000062457191 851555778 /nfs/dbraw/zinc/55/57/78/851555778.db2.gz PXGCZPZTAXHIFE-HXUWFJFHSA-N 0 3 414.575 4.326 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)N[C@H]1CCSc2ccc(F)cc21 ZINC000062476652 851560392 /nfs/dbraw/zinc/56/03/92/851560392.db2.gz NCUKUSYZTJAOLN-IBGZPJMESA-N 0 3 405.514 4.275 20 0 HIADHN COc1ccc(CC[C@H](C)NC(=O)N(CCN(C)C)Cc2cccc(Cl)c2)cc1 ZINC000062503228 851565890 /nfs/dbraw/zinc/56/58/90/851565890.db2.gz RILZLWQUOXTIBL-SFHVURJKSA-N 0 3 417.981 4.443 20 0 HIADHN Cc1[nH]c2ccc(CNC(=O)N(CCN(C)C)Cc3ccc(F)c(F)c3)cc2c1C ZINC000062502429 851566028 /nfs/dbraw/zinc/56/60/28/851566028.db2.gz YOFHMQOAWNCVOZ-UHFFFAOYSA-N 0 3 414.500 4.336 20 0 HIADHN CN(CCCCNC(=S)NC1CCN(Cc2ccccc2)CC1)c1ccccc1 ZINC000063150745 851623198 /nfs/dbraw/zinc/62/31/98/851623198.db2.gz CHLJVRDJWOBJLW-UHFFFAOYSA-N 0 3 410.631 4.032 20 0 HIADHN CC(C)COc1cccc(CNC(=S)NC2CCN(Cc3ccccc3)CC2)c1 ZINC000063172976 851626429 /nfs/dbraw/zinc/62/64/29/851626429.db2.gz PUZFAJPYSOQELP-UHFFFAOYSA-N 0 3 411.615 4.350 20 0 HIADHN O=S(=O)(/C=C/c1ccc(Cl)cc1)NCC1CCN(Cc2ccccc2)CC1 ZINC000063182218 851629261 /nfs/dbraw/zinc/62/92/61/851629261.db2.gz PNNPKKJFFILECO-NTCAYCPXSA-N 0 3 404.963 4.142 20 0 HIADHN COc1ccccc1NC(=O)c1ccc(NC(=O)[C@@H](C)N2CCC[C@@H](C)CC2)cc1 ZINC000063309025 851656507 /nfs/dbraw/zinc/65/65/07/851656507.db2.gz HTHICPLLUMUVTD-QZTJIDSGSA-N 0 3 409.530 4.397 20 0 HIADHN CCCOc1ncccc1CNC(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1 ZINC000063607943 851723892 /nfs/dbraw/zinc/72/38/92/851723892.db2.gz JWLVNXQOEHSERB-IBGZPJMESA-N 0 3 416.591 4.204 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N2CCC(Oc3ccccc3)CC2)N2CCCC2)cc1 ZINC000064236917 851854442 /nfs/dbraw/zinc/85/44/42/851854442.db2.gz JNKKWRJZVOVAKR-XMMPIXPASA-N 0 3 407.558 4.385 20 0 HIADHN COc1ccc2c(c1)CN(C(=O)NC[C@H](c1cccs1)N1CCC(C)CC1)CC2 ZINC000064240735 851856181 /nfs/dbraw/zinc/85/61/81/851856181.db2.gz PONKKUVFNXSNKI-OAQYLSRUSA-N 0 3 413.587 4.298 20 0 HIADHN COc1cccc(CN(C[C@H](O)COc2cccc3ccccc32)C[C@@H]2CCCO2)c1 ZINC000064400312 851889126 /nfs/dbraw/zinc/88/91/26/851889126.db2.gz HTNDDFSBYDCWMR-UPVQGACJSA-N 0 3 421.537 4.269 20 0 HIADHN COc1ccc(C)cc1CC(=O)N(CCN(C)C)Cc1ccc(C(F)(F)F)cc1 ZINC000064470567 851905841 /nfs/dbraw/zinc/90/58/41/851905841.db2.gz JFPKCPIVBYELAQ-UHFFFAOYSA-N 0 3 408.464 4.155 20 0 HIADHN CC[C@H](CNC(=O)Nc1cccc(-c2noc(C)n2)c1)N1CCc2ccccc2C1 ZINC000064545525 851926699 /nfs/dbraw/zinc/92/66/99/851926699.db2.gz MGANWHDQONDTPY-OAQYLSRUSA-N 0 3 405.502 4.003 20 0 HIADHN COc1ccc([C@H](CNC(=O)Nc2cc(OC)ccc2Cl)N2CCCC2)cc1 ZINC000064559757 851929493 /nfs/dbraw/zinc/92/94/93/851929493.db2.gz LGLGUTOROQZURI-FQEVSTJZSA-N 0 3 403.910 4.316 20 0 HIADHN Cc1ccc2nc(CN(Cc3ccc4c(c3)OCO4)C3CCCCC3)cc(=O)n2c1 ZINC000064805558 851988498 /nfs/dbraw/zinc/98/84/98/851988498.db2.gz SJMFPWBQNDPQOU-UHFFFAOYSA-N 0 3 405.498 4.067 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Cc1ccc2c(c1)CCO2)c1ccc(C(F)(F)F)cc1 ZINC000065121800 852072184 /nfs/dbraw/zinc/07/21/84/852072184.db2.gz OVOAEBSUTARDRU-HXUWFJFHSA-N 0 3 420.475 4.382 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)Nc1ccccc1C(F)(F)F)c1ccc(N2CCOCC2)cc1 ZINC000065278399 852097734 /nfs/dbraw/zinc/09/77/34/852097734.db2.gz LXGYXTFVQFVVNP-CVEARBPZSA-N 0 3 421.463 4.220 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2ccc(C(=O)N3CCC(C)CC3)cc2)N(C)C)cc1 ZINC000065415766 852124225 /nfs/dbraw/zinc/12/42/25/852124225.db2.gz HUHWGDPQSNVXCF-QHCPKHFHSA-N 0 3 422.573 4.292 20 0 HIADHN CCc1nnc(NC(=O)NC[C@@H](c2ccc(C(F)(F)F)cc2)N(CC)CC)s1 ZINC000065449851 852137684 /nfs/dbraw/zinc/13/76/84/852137684.db2.gz HGVQQVWQXBMAEM-AWEZNQCLSA-N 0 3 415.485 4.324 20 0 HIADHN Cc1ccc([C@H](CNC(=O)NCc2cccc(OCc3ccccn3)c2)N(C)C)cc1 ZINC000065469897 852145493 /nfs/dbraw/zinc/14/54/93/852145493.db2.gz VLMLVLDKEIUNEC-DEOSSOPVSA-N 0 3 418.541 4.071 20 0 HIADHN Cc1ccccc1CN1CCCN(C(=O)NCCCCN(C)c2ccccc2)CC1 ZINC000065510167 852160490 /nfs/dbraw/zinc/16/04/90/852160490.db2.gz IQXFGYYRASKVSL-UHFFFAOYSA-N 0 3 408.590 4.129 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)NCCSCc2ccccc2F)C1 ZINC000065521854 852166397 /nfs/dbraw/zinc/16/63/97/852166397.db2.gz AFUUTGOSBXCHHI-FXAWDEMLSA-N 0 3 401.551 4.194 20 0 HIADHN Cc1ccccc1CN1CCCN(C(=O)N[C@H]2CCCOc3ccc(F)cc32)CC1 ZINC000065547813 852174155 /nfs/dbraw/zinc/17/41/55/852174155.db2.gz SPUXLMQARTVPGR-QFIPXVFZSA-N 0 3 411.521 4.265 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=S)Nc1ccc(OC(F)F)cc1 ZINC000065704660 852226453 /nfs/dbraw/zinc/22/64/53/852226453.db2.gz FFXGEFNFQFQCCY-UHFFFAOYSA-N 0 3 415.456 4.327 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3cc(F)cc4[nH]cnc43)cc2Cl)CC1 ZINC000065723230 852235075 /nfs/dbraw/zinc/23/50/75/852235075.db2.gz UGPFLVZXUCDDAJ-UHFFFAOYSA-N 0 3 415.900 4.140 20 0 HIADHN CCOc1cc2c(cc1NC(=O)[C@@H]1CCCN(Cc3cccc(F)c3)C1)O[C@H](C)C2 ZINC000065858693 852287017 /nfs/dbraw/zinc/28/70/17/852287017.db2.gz RNPMVJUTEPPQOP-SJLPKXTDSA-N 0 3 412.505 4.399 20 0 HIADHN O=C(NCc1nc(-c2ccccc2)cs1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000065872664 852294921 /nfs/dbraw/zinc/29/49/21/852294921.db2.gz DVPKYJQIVOAFDT-IBGZPJMESA-N 0 3 409.530 4.478 20 0 HIADHN CC(C)(C)NC(=O)c1cccc(NC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)c1 ZINC000065872345 852295152 /nfs/dbraw/zinc/29/51/52/852295152.db2.gz PRUOFXKFWCEXMX-IBGZPJMESA-N 0 3 411.521 4.205 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)c1cc2ccc(Br)cc2[nH]1 ZINC000065931404 852322712 /nfs/dbraw/zinc/32/27/12/852322712.db2.gz HAMVRWIDIMNUEU-UHFFFAOYSA-N 0 3 418.310 4.274 20 0 HIADHN Cc1oc(-c2ccccc2)nc1CC(=O)N(CCN(C)C)Cc1cccc(Cl)c1 ZINC000065936876 852324813 /nfs/dbraw/zinc/32/48/13/852324813.db2.gz IDDSBQAKCAJFKA-UHFFFAOYSA-N 0 3 411.933 4.436 20 0 HIADHN Cc1noc2nc(C3CC3)cc(C(=O)N(CCN(C)C)Cc3cccc(Cl)c3)c12 ZINC000065936886 852324925 /nfs/dbraw/zinc/32/49/25/852324925.db2.gz ZLFNVPZKJXMJEZ-UHFFFAOYSA-N 0 3 412.921 4.266 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)c1cc(-c2ccccc2Cl)on1 ZINC000065939628 852327679 /nfs/dbraw/zinc/32/76/79/852327679.db2.gz BJBPSXPSTGQTEI-UHFFFAOYSA-N 0 3 401.869 4.338 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)c1ccc(Br)cc1F ZINC000065938640 852328039 /nfs/dbraw/zinc/32/80/39/852328039.db2.gz NSFLIFKQLJZWOP-UHFFFAOYSA-N 0 3 415.253 4.070 20 0 HIADHN COc1ccc(S[C@H](C)C(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)cc1 ZINC000065938443 852328239 /nfs/dbraw/zinc/32/82/39/852328239.db2.gz RAZCTSXPVNRKOF-OAHLLOKOSA-N 0 3 408.514 4.044 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)Cc1ccc(C(F)(F)F)cc1 ZINC000065938633 852328516 /nfs/dbraw/zinc/32/85/16/852328516.db2.gz UKAPWOZOXFEPFS-UHFFFAOYSA-N 0 3 400.391 4.117 20 0 HIADHN CC(C)(C)OC(=O)NC[C@@H]1CCCN(Cc2ccc(OCc3ccccn3)cc2)C1 ZINC000065953856 852332091 /nfs/dbraw/zinc/33/20/91/852332091.db2.gz ASAMACMIAAFKLN-FQEVSTJZSA-N 0 3 411.546 4.397 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)Nc1cccnc1Cl ZINC000065984106 852340346 /nfs/dbraw/zinc/34/03/46/852340346.db2.gz DPROKMXSPKSYSB-UHFFFAOYSA-N 0 3 400.832 4.350 20 0 HIADHN Cc1ccc(CNC(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)cc1F ZINC000065984112 852340406 /nfs/dbraw/zinc/34/04/06/852340406.db2.gz IKVJDPFEPZSMAD-UHFFFAOYSA-N 0 3 411.443 4.426 20 0 HIADHN Cc1ccccc1C(=O)N[C@H](CC(C)C)C(=O)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000069251079 852389717 /nfs/dbraw/zinc/38/97/17/852389717.db2.gz SHLYXCMITZGMNX-RPWUZVMVSA-N 0 3 421.585 4.093 20 0 HIADHN CN(C)[C@H](CNC(=O)CCCOc1cccc(Br)c1)c1ccccc1 ZINC000069344962 852393273 /nfs/dbraw/zinc/39/32/73/852393273.db2.gz WHSPWOAVIDVXPK-LJQANCHMSA-N 0 3 405.336 4.027 20 0 HIADHN CCN(CC)CCN(Cc1cccs1)S(=O)(=O)c1cccc2cc(C)cnc21 ZINC000071834234 852414425 /nfs/dbraw/zinc/41/44/25/852414425.db2.gz AGCPFXNUWDTGOT-UHFFFAOYSA-N 0 3 417.600 4.137 20 0 HIADHN O=C(c1ccc(Br)c(F)c1)N1CCCN(CCCc2ccccc2)CC1 ZINC000072072784 852497217 /nfs/dbraw/zinc/49/72/17/852497217.db2.gz JYQPAYBXXZDRKQ-UHFFFAOYSA-N 0 3 419.338 4.369 20 0 HIADHN Cc1nccn1-c1ccc(CNC(=O)c2ccc(Nc3ccncc3)cc2)cc1F ZINC000072289316 852512146 /nfs/dbraw/zinc/51/21/46/852512146.db2.gz NRYTVDXLHFEFPY-UHFFFAOYSA-N 0 3 401.445 4.388 20 0 HIADHN CC(C)(C)c1csc(CCNC(=O)NC[C@H](c2cccs2)N2CCCC2)n1 ZINC000078550724 852518727 /nfs/dbraw/zinc/51/87/27/852518727.db2.gz FSLDTDJEPFUEOW-OAHLLOKOSA-N 0 3 406.621 4.181 20 0 HIADHN CCN1CCCC[C@@H]1CNC(=O)c1cccc(NC(=O)CCCc2cccs2)c1 ZINC000078917198 852534638 /nfs/dbraw/zinc/53/46/38/852534638.db2.gz VGJJAVRCQCYTGK-HXUWFJFHSA-N 0 3 413.587 4.314 20 0 HIADHN FC(F)(F)c1ccc(CN2CCCN(c3nccc(C(F)(F)F)n3)CC2)cc1 ZINC000097091597 852582486 /nfs/dbraw/zinc/58/24/86/852582486.db2.gz HUAWLWZCIPFZEN-UHFFFAOYSA-N 0 3 404.358 4.227 20 0 HIADHN CC[C@@H](CNC(=O)c1cc(C)n(-c2nccs2)c1C)N1CCc2ccccc2C1 ZINC000097286223 852597500 /nfs/dbraw/zinc/59/75/00/852597500.db2.gz NZJHJBHUKAQIHK-FQEVSTJZSA-N 0 3 408.571 4.117 20 0 HIADHN Cc1cc(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)c(C)n1Cc1ccccn1 ZINC000097288291 852598696 /nfs/dbraw/zinc/59/86/96/852598696.db2.gz PNTCSKFJXMATRZ-DEOSSOPVSA-N 0 3 402.542 4.115 20 0 HIADHN CC(C)[C@H](NC(=O)N[C@H](CN1CCCC1)c1ccccc1)c1nc2ccccc2[nH]1 ZINC000097394682 852608067 /nfs/dbraw/zinc/60/80/67/852608067.db2.gz FUEUXJYQUNMUDK-YADHBBJMSA-N 0 3 405.546 4.396 20 0 HIADHN O=C(CN1CCN(C2CCCC2)CC1)N[C@@H](c1ccccc1)c1cccc(Cl)c1 ZINC000097477883 852617297 /nfs/dbraw/zinc/61/72/97/852617297.db2.gz LXFVUYJKZOZTAU-DEOSSOPVSA-N 0 3 411.977 4.106 20 0 HIADHN Cc1ccc(O[C@@H](C)C(=O)NC2CCN(CCOc3ccc(Cl)cc3)CC2)cc1 ZINC000097577242 852637395 /nfs/dbraw/zinc/63/73/95/852637395.db2.gz OZDFIRVMWJZKED-SFHVURJKSA-N 0 3 416.949 4.075 20 0 HIADHN Cc1noc2nc(-c3ccccc3)cc(C(=O)NCc3ccccc3CN(C)C)c12 ZINC000105430413 852705441 /nfs/dbraw/zinc/70/54/41/852705441.db2.gz WUOJWKRQCGDLGQ-UHFFFAOYSA-N 0 3 400.482 4.190 20 0 HIADHN CC[NH+]1CCN(c2ccc([N-]S(=O)(=O)c3cccc4ccccc43)c(C)c2)CC1 ZINC000437194079 862386251 /nfs/dbraw/zinc/38/62/51/862386251.db2.gz KVLXSJJJSVTYQC-UHFFFAOYSA-N 0 3 409.555 4.091 20 0 HIADHN Cc1ccccc1CN1CCCN(C(=O)Cc2ccc(Br)cc2)CC1 ZINC000106155130 852758853 /nfs/dbraw/zinc/75/88/53/852758853.db2.gz OTHKAEYAUGEGQT-UHFFFAOYSA-N 0 3 401.348 4.035 20 0 HIADHN CCOc1cccc2cc([C@@H](C)NC(=O)N[C@H]3CCN(Cc4ccccc4)C3)oc21 ZINC000107708928 852788028 /nfs/dbraw/zinc/78/80/28/852788028.db2.gz LXEDRLGZTFFJQL-XLIONFOSSA-N 0 3 407.514 4.466 20 0 HIADHN Cc1ccccc1-n1ccnc1SCC(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000108822401 852883406 /nfs/dbraw/zinc/88/34/06/852883406.db2.gz NMOYINQNAMIOTH-FPOVZHCZSA-N 0 3 420.582 4.225 20 0 HIADHN O=C(c1cccc(CN2CCCC2)c1)N1CCN(Cc2cccc3ccccc32)CC1 ZINC000108966220 852899566 /nfs/dbraw/zinc/89/95/66/852899566.db2.gz JPKPMGQNCFJFAM-UHFFFAOYSA-N 0 3 413.565 4.394 20 0 HIADHN COc1ccc2[nH]cc(C3CCN([C@H](C)C(=O)NCc4ccc(C)cc4)CC3)c2c1 ZINC000108969807 852900626 /nfs/dbraw/zinc/90/06/26/852900626.db2.gz ZORIHHVCZMVNJL-GOSISDBHSA-N 0 3 405.542 4.369 20 0 HIADHN COc1ccc2[nH]cc(C3CCN([C@@H](C)C(=O)N4CCc5sccc5C4)CC3)c2c1 ZINC000108971015 852901349 /nfs/dbraw/zinc/90/13/49/852901349.db2.gz MDUQSJNPNFKIAN-INIZCTEOSA-N 0 3 423.582 4.391 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccc(F)c2)C1)N1CCn2cccc2[C@@H]1c1ccccc1 ZINC000109346093 852956950 /nfs/dbraw/zinc/95/69/50/852956950.db2.gz ITNUAMSUQHNITC-RDGATRHJSA-N 0 3 417.528 4.471 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)NCc3ccc(F)cc3C(F)(F)F)cc2)CC1 ZINC000109487948 852975821 /nfs/dbraw/zinc/97/58/21/852975821.db2.gz GTLCUBZXODPYGW-UHFFFAOYSA-N 0 3 423.454 4.305 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N(C)[C@@H](C)c3ccc(F)c(F)c3)cc2)CC1 ZINC000109489616 852976083 /nfs/dbraw/zinc/97/60/83/852976083.db2.gz XEKFYHAGPSXSNU-KRWDZBQOSA-N 0 3 401.501 4.328 20 0 HIADHN Cc1nc(-c2ccccn2)sc1C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000109499361 852978709 /nfs/dbraw/zinc/97/87/09/852978709.db2.gz KHHHNKRULRUMRP-UHFFFAOYSA-N 0 3 424.595 4.357 20 0 HIADHN O=C(NC[C@H]1CCCN(Cc2cccs2)C1)c1csc(Cc2ccccc2)n1 ZINC000109564906 852986009 /nfs/dbraw/zinc/98/60/09/852986009.db2.gz BOWQRDCOCATIDN-GOSISDBHSA-N 0 3 411.596 4.437 20 0 HIADHN CN(C(=O)CSc1ccc2ccccc2c1)C1CCN(CCc2ccccn2)CC1 ZINC000109795983 853015854 /nfs/dbraw/zinc/01/58/54/853015854.db2.gz JEYJALZGMIKXPS-UHFFFAOYSA-N 0 3 419.594 4.492 20 0 HIADHN CCN(CC(=O)Nc1cccc(CN2CCSCC2)c1)[C@H](C)c1ccc(F)cc1 ZINC000110177345 853068251 /nfs/dbraw/zinc/06/82/51/853068251.db2.gz JNCWBQIFPDVHQX-GOSISDBHSA-N 0 3 415.578 4.396 20 0 HIADHN Cc1c2cc(F)ccc2sc1C(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000110411195 853096033 /nfs/dbraw/zinc/09/60/33/853096033.db2.gz SVLDQQKLBBOQPC-GASCZTMLSA-N 0 3 404.551 4.310 20 0 HIADHN Cc1c2cc(F)ccc2sc1C(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000110411198 853096196 /nfs/dbraw/zinc/09/61/96/853096196.db2.gz SVLDQQKLBBOQPC-HUUCEWRRSA-N 0 3 404.551 4.310 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)CCCOc3cccc4ccccc43)CC2)C[C@@H](C)O1 ZINC000110408979 853096286 /nfs/dbraw/zinc/09/62/86/853096286.db2.gz UVTHHVJVKPMRCS-NHCUHLMSSA-N 0 3 424.585 4.347 20 0 HIADHN Cc1c(C(=O)N2CCC(CN3C[C@H](C)O[C@@H](C)C3)CC2)sc2cccc(F)c12 ZINC000110408489 853096694 /nfs/dbraw/zinc/09/66/94/853096694.db2.gz ICVAUBJMPQWUTH-GJZGRUSLSA-N 0 3 404.551 4.310 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Cc3ccc(-c4ccccc4)cc3)CC2)C[C@H](C)O1 ZINC000110455600 853102540 /nfs/dbraw/zinc/10/25/40/853102540.db2.gz VUBIZQHYEZLZRI-OYRHEFFESA-N 0 3 406.570 4.244 20 0 HIADHN Clc1cc(Cl)c2c(c1)C=C(CNCc1ccc(Cn3cncn3)cc1)CO2 ZINC000110462127 853103248 /nfs/dbraw/zinc/10/32/48/853103248.db2.gz UOAAHUGAIRWDHA-UHFFFAOYSA-N 0 3 401.297 4.199 20 0 HIADHN Fc1ccc(-c2noc([C@@H]3CCCN(CCOCCOc4ccccc4)C3)n2)cc1 ZINC000110472510 853104435 /nfs/dbraw/zinc/10/44/35/853104435.db2.gz AFFWHAHLBIXBTB-LJQANCHMSA-N 0 3 411.477 4.151 20 0 HIADHN Fc1ccc(-c2noc([C@@H]3CCCN(Cn4cnc5cc(F)c(F)cc54)C3)n2)cc1 ZINC000110472854 853104466 /nfs/dbraw/zinc/10/44/66/853104466.db2.gz LLPIXBVDTQNENZ-CQSZACIVSA-N 0 3 413.403 4.341 20 0 HIADHN Cc1cc(NC(=O)c2ccccc2Cl)sc1C(=O)N(C)CCN1CCCC1 ZINC000110917626 853168518 /nfs/dbraw/zinc/16/85/18/853168518.db2.gz RQMKPQQNGHHDFZ-UHFFFAOYSA-N 0 3 405.951 4.130 20 0 HIADHN CN(C)C(=O)Sc1ccccc1NC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000111011792 853187243 /nfs/dbraw/zinc/18/72/43/853187243.db2.gz CXSWFEHVXKQOBM-QGZVFWFLSA-N 0 3 415.534 4.450 20 0 HIADHN CCN(CC)[C@H](C(=O)NC[C@H](c1ccccc1OC)N1CCCC1)c1ccccc1 ZINC000111075252 853198028 /nfs/dbraw/zinc/19/80/28/853198028.db2.gz KKEHNWTXOMPPQS-VWNXMTODSA-N 0 3 409.574 4.031 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)NC[C@H](c2ccccc2)N2CCCC2)c(Cl)c1 ZINC000111217260 853225727 /nfs/dbraw/zinc/22/57/27/853225727.db2.gz VUIAGGIVUSUFEB-HXUWFJFHSA-N 0 3 400.910 4.257 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(NCc3ccccc3C[N@@H+]3CCCC[C@@H]3C)nc2)n1 ZINC000111227856 853228883 /nfs/dbraw/zinc/22/88/83/853228883.db2.gz CGOMFSSDEYIQRH-SFHVURJKSA-N 0 3 417.557 4.381 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(NCc3ccccc3C[N@H+]3CCCC[C@@H]3C)nc2)n1 ZINC000111227856 853228893 /nfs/dbraw/zinc/22/88/93/853228893.db2.gz CGOMFSSDEYIQRH-SFHVURJKSA-N 0 3 417.557 4.381 20 0 HIADHN COc1ccc(NC(=O)[C@H]2CCCN(Cc3cccnc3)C2)cc1OC1CCCC1 ZINC000115841247 853268529 /nfs/dbraw/zinc/26/85/29/853268529.db2.gz VFLZFNVFWSERLR-IBGZPJMESA-N 0 3 409.530 4.262 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)c1cc(-c2ccco2)on1 ZINC000115926602 853273699 /nfs/dbraw/zinc/27/36/99/853273699.db2.gz ANJPSWYMHVEWJT-UHFFFAOYSA-N 0 3 407.392 4.157 20 0 HIADHN Cc1ccc([C@H](CNC(=O)CSCc2cc(-c3cccs3)on2)N(C)C)cc1 ZINC000116183604 853290052 /nfs/dbraw/zinc/29/00/52/853290052.db2.gz ZDYJXIXWFLOJGX-SFHVURJKSA-N 0 3 415.584 4.364 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)c1cc(-c2ccc(F)cc2)[nH]n1 ZINC000116191406 853291278 /nfs/dbraw/zinc/29/12/78/853291278.db2.gz VSLLMKSGMQNGAX-UHFFFAOYSA-N 0 3 410.518 4.059 20 0 HIADHN CC(C)[C@@H](NCC(=O)Nc1ccc(N2C[C@@H](C)O[C@@H](C)C2)cc1)c1ccc(F)cc1 ZINC000116221121 853292479 /nfs/dbraw/zinc/29/24/79/853292479.db2.gz SPHRGXZAJAJTSY-NXMSCROESA-N 0 3 413.537 4.365 20 0 HIADHN Cc1ccccc1CN(Cc1cccnc1)C(=O)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000116395407 853300765 /nfs/dbraw/zinc/30/07/65/853300765.db2.gz IQSAJZGJLZHDLB-VWLOTQADSA-N 0 3 414.553 4.226 20 0 HIADHN CC(C)(NCC(=O)Nc1cc(C(F)(F)F)ccc1N1CCOCC1)c1ccccc1 ZINC000116538446 853312342 /nfs/dbraw/zinc/31/23/42/853312342.db2.gz CYDSCELVLMHGLN-UHFFFAOYSA-N 0 3 421.463 4.005 20 0 HIADHN CN(C)CCN(CCc1ccccc1)C(=O)c1cnc(Cc2ccc(F)cc2)s1 ZINC000116721445 853329372 /nfs/dbraw/zinc/32/93/72/853329372.db2.gz PHWAYOBPDYEHPY-UHFFFAOYSA-N 0 3 411.546 4.120 20 0 HIADHN Cc1ccc(C(=O)CCC(=O)Nc2ccc(CCN3CCSCC3)cc2)s1 ZINC000138699583 853393961 /nfs/dbraw/zinc/39/39/61/853393961.db2.gz NVBFODCODRWDMC-UHFFFAOYSA-N 0 3 402.585 4.249 20 0 HIADHN O=C(CCc1ccc(NC(=O)c2cccc(CN3CCCC3)c2)cc1)N1CCCC1 ZINC000139372024 853408716 /nfs/dbraw/zinc/40/87/16/853408716.db2.gz FVASPSNWLPJBBG-UHFFFAOYSA-N 0 3 405.542 4.090 20 0 HIADHN CN(C)Cc1ccccc1CNC(=O)CSCc1cc(-c2cccs2)on1 ZINC000139642393 853416473 /nfs/dbraw/zinc/41/64/73/853416473.db2.gz XMRWWWIVLOPLTH-UHFFFAOYSA-N 0 3 401.557 4.014 20 0 HIADHN CNS(=O)(=O)c1ccc([C@@H](C)NCc2cccc(OCc3ccccc3)c2)cc1 ZINC000140312671 853440871 /nfs/dbraw/zinc/44/08/71/853440871.db2.gz ZOSPRQVATUFUPD-GOSISDBHSA-N 0 3 410.539 4.025 20 0 HIADHN C[C@@H](SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)NC[C@H](C)N1CCCC1 ZINC000140586573 853447491 /nfs/dbraw/zinc/44/74/91/853447491.db2.gz VSAFBAVPJCQXRO-LSDHHAIUSA-N 0 3 407.967 4.217 20 0 HIADHN Cc1ccc([C@H](CNC(=O)C2(c3cccc(F)c3)CCOCC2)N2CCCC2)cc1 ZINC000143019869 853506325 /nfs/dbraw/zinc/50/63/25/853506325.db2.gz XODWTSSBSLGTJL-QHCPKHFHSA-N 0 3 410.533 4.136 20 0 HIADHN C[C@@H](OC(=O)C1CCN(c2ccc(Cl)cc2)C1=O)c1nnc(-c2cccs2)o1 ZINC000146495801 853570303 /nfs/dbraw/zinc/57/03/03/853570303.db2.gz XKBXTVHIBATJLD-RISCZKNCSA-N 0 3 417.874 4.109 20 0 HIADHN COc1ccc(CN[C@H](C)c2cccc(N3CCOC3=O)c2)cc1OCCCC#N ZINC000147197155 853583861 /nfs/dbraw/zinc/58/38/61/853583861.db2.gz ONWTULOSQGLAGE-QGZVFWFLSA-N 0 3 409.486 4.185 20 0 HIADHN CC1CCN([C@@H](CNC(=O)Nc2nnc(C(F)F)s2)c2cccs2)CC1 ZINC000148311716 853605697 /nfs/dbraw/zinc/60/56/97/853605697.db2.gz ADNPDIAQXCXLPI-NSHDSACASA-N 0 3 401.508 4.132 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3ccc(NC(C)=O)c(C)c3)c(C)c2)CC1 ZINC000148867597 853614952 /nfs/dbraw/zinc/61/49/52/853614952.db2.gz SSSTUECBFRDJAW-UHFFFAOYSA-N 0 3 409.534 4.048 20 0 HIADHN COc1cc(Cl)c(C)cc1NC(=O)C(C#N)C(=O)CCc1cc(F)ccc1F ZINC000150086289 853637838 /nfs/dbraw/zinc/63/78/38/853637838.db2.gz DDOIUVRHYAYKDL-CQSZACIVSA-N 0 3 406.816 4.215 20 0 HIADHN CCc1nc(CC(=O)C(C#N)C(=O)Nc2ccccc2Oc2ccccc2)cs1 ZINC000150133319 853638040 /nfs/dbraw/zinc/63/80/40/853638040.db2.gz QRIRHXVEEKNNOJ-QGZVFWFLSA-N 0 3 405.479 4.388 20 0 HIADHN COc1ccc2ccccc2c1CNCc1ccc(C(=O)N2C[C@H](C)O[C@@H](C)C2)cc1 ZINC000165975878 853653941 /nfs/dbraw/zinc/65/39/41/853653941.db2.gz GGQDPOISJYESIO-OALUTQOASA-N 0 3 418.537 4.388 20 0 HIADHN O=C(NCc1ccccc1OCC(F)(F)F)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000195556439 853681537 /nfs/dbraw/zinc/68/15/37/853681537.db2.gz LGUSHAIGZBXLIB-IBGZPJMESA-N 0 3 421.463 4.264 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1NC(=O)N[C@H](CN1CCCC1)c1ccccc1 ZINC000195582086 853695010 /nfs/dbraw/zinc/69/50/10/853695010.db2.gz VGWCGVPKCNVCJR-JOCHJYFZSA-N 0 3 403.530 4.448 20 0 HIADHN CC[C@@H](C)NC(=O)c1ccc(NC(=O)N[C@H](CN2CCCC2)c2ccccc2)cc1 ZINC000195612957 853713784 /nfs/dbraw/zinc/71/37/84/853713784.db2.gz KFTZNROETGSZMY-XMSQKQJNSA-N 0 3 408.546 4.174 20 0 HIADHN O=C(NC[C@@H]1CCCO[C@H]1c1ccccc1)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000195660651 853743571 /nfs/dbraw/zinc/74/35/71/853743571.db2.gz ICINIYZMJSUSRY-VXNXHJTFSA-N 0 3 407.558 4.118 20 0 HIADHN CN1CCN(Cc2ccc(CNC(=O)C34CC5C[C@@](C)(C3)C[C@](C)(C5)C4)cc2)CC1 ZINC000195675364 853751470 /nfs/dbraw/zinc/75/14/70/853751470.db2.gz NXLNLLOQJJPFFK-GEVPFPAESA-N 0 3 409.618 4.047 20 0 HIADHN O=C(COc1cccc2ccccc21)Nc1ccc(CCN2CCSCC2)cc1 ZINC000195744386 853791174 /nfs/dbraw/zinc/79/11/74/853791174.db2.gz VPRMLCMEAMEQHM-UHFFFAOYSA-N 0 3 406.551 4.449 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)CSCc2cn3cc(C)ccc3n2)N2CCCC2)cc1 ZINC000195746231 853791648 /nfs/dbraw/zinc/79/16/48/853791648.db2.gz XDUOAXCQLRVLKQ-JOCHJYFZSA-N 0 3 422.598 4.138 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)C2(c3ccc(Br)cc3)CC2)C1 ZINC000227381750 853886186 /nfs/dbraw/zinc/88/61/86/853886186.db2.gz ACQXNFPXKDMMIN-OXQOHEQNSA-N 0 3 413.359 4.432 20 0 HIADHN c1cn(-c2cc(CNCc3cn(Cc4ccccc4)nc3-c3ccccc3)ccn2)cn1 ZINC000236580857 853899668 /nfs/dbraw/zinc/89/96/68/853899668.db2.gz UXYSEGZRDOGZTQ-UHFFFAOYSA-N 0 3 420.520 4.469 20 0 HIADHN c1sc(-c2ccc3c(c2)OCO3)nc1CN[C@H](CN1CCCC1)c1ccccc1 ZINC000236613126 853902458 /nfs/dbraw/zinc/90/24/58/853902458.db2.gz HFUVVTQMJDTCJI-HXUWFJFHSA-N 0 3 407.539 4.466 20 0 HIADHN c1c(CNCc2ccc(C3OCCO3)cc2)c(-c2ccncc2)nn1-c1ccccc1 ZINC000236626918 853905191 /nfs/dbraw/zinc/90/51/91/853905191.db2.gz OJWSSIRQPKRVIU-UHFFFAOYSA-N 0 3 412.493 4.270 20 0 HIADHN Brc1cc(CNC[C@@H](c2ccco2)N2CCCC2)cc2c1OCCCO2 ZINC000236650885 853906983 /nfs/dbraw/zinc/90/69/83/853906983.db2.gz GVMHOKKRMGAGDJ-KRWDZBQOSA-N 0 3 421.335 4.130 20 0 HIADHN CC(C)(CNC/C=C/c1ccccc1)S(=O)(=O)c1ccc(Br)cc1 ZINC000236727047 853916091 /nfs/dbraw/zinc/91/60/91/853916091.db2.gz PMQCPHWYBRIPBA-RMKNXTFCSA-N 0 3 408.361 4.304 20 0 HIADHN CC(C)(C)OC(=O)N1CCc2cccc(CNC[C@@H](O)c3ccccc3Cl)c21 ZINC000236733385 853917587 /nfs/dbraw/zinc/91/75/87/853917587.db2.gz KLZUWDGFGURNHX-LJQANCHMSA-N 0 3 402.922 4.461 20 0 HIADHN CCCN1CCN(c2ccccc2CNc2ccc(CC(=O)N(CC)CC)cc2)CC1 ZINC000236804525 853924493 /nfs/dbraw/zinc/92/44/93/853924493.db2.gz GFSIIECTLYKROY-UHFFFAOYSA-N 0 3 422.617 4.242 20 0 HIADHN CCOc1c(OC)cc(CNC[C@@H](O)c2ccc(Cl)cc2Cl)cc1OC ZINC000236863325 853929970 /nfs/dbraw/zinc/92/99/70/853929970.db2.gz LZTIDUAXZSQWPO-MRXNPFEDSA-N 0 3 400.302 4.233 20 0 HIADHN CCN1CCN(c2ccc(CNCc3ccc(-c4c(F)cccc4F)o3)cn2)CC1 ZINC000236866115 853930340 /nfs/dbraw/zinc/93/03/40/853930340.db2.gz FRTUSFZYGZXOLK-UHFFFAOYSA-N 0 3 412.484 4.052 20 0 HIADHN CCCC[C@H](NCc1ccc2c[nH]nc2c1)C(=O)Nc1cccc(N2CCCC2)c1 ZINC000236882411 853931997 /nfs/dbraw/zinc/93/19/97/853931997.db2.gz XFKHPYYSVABRHY-QFIPXVFZSA-N 0 3 405.546 4.450 20 0 HIADHN CC(C)c1nn(C)c(N2CCOCC2)c1CNCCc1c(Cl)cccc1Cl ZINC000236882355 853932022 /nfs/dbraw/zinc/93/20/22/853932022.db2.gz SNHATIDCEPNJNV-UHFFFAOYSA-N 0 3 411.377 4.019 20 0 HIADHN CC[C@H](C#N)Oc1cc(CNCc2ccc(OC)c(Br)c2)ccc1OC ZINC000236894168 853932997 /nfs/dbraw/zinc/93/29/97/853932997.db2.gz ACGPQCRMSJXLKP-MRXNPFEDSA-N 0 3 419.319 4.437 20 0 HIADHN CCOc1cc(CNC(C)(C)c2cccc(F)c2)ccc1O[C@@H](C)C(=O)N(C)C ZINC000236910324 853935905 /nfs/dbraw/zinc/93/59/05/853935905.db2.gz QRIPZYXAUOZEBO-INIZCTEOSA-N 0 3 402.510 4.105 20 0 HIADHN CCCOc1c(Cl)cc(CNC[C@H](c2ccc(C)o2)N2CCOCC2)cc1OC ZINC000236907811 853935928 /nfs/dbraw/zinc/93/59/28/853935928.db2.gz JNYJWTQJALWWIU-LJQANCHMSA-N 0 3 422.953 4.202 20 0 HIADHN CCNC(=O)COc1ccc(CNCc2cccc(-c3cccc(C)c3)c2)cc1OC ZINC000236907792 853936230 /nfs/dbraw/zinc/93/62/30/853936230.db2.gz RTELQOWNVIVUJD-UHFFFAOYSA-N 0 3 418.537 4.475 20 0 HIADHN CCSc1ccc([C@@H](C)NCc2cc(Cl)c(OCC(N)=O)c(OC)c2)cc1 ZINC000236938807 853940336 /nfs/dbraw/zinc/94/03/36/853940336.db2.gz ZASVFKVQXYWSEV-CYBMUJFWSA-N 0 3 408.951 4.176 20 0 HIADHN CCOc1cc(CNCc2ccc(O)c(F)c2)ccc1OCC(=O)Nc1ccccc1 ZINC000236968470 853944394 /nfs/dbraw/zinc/94/43/94/853944394.db2.gz VPDVJRZSOSELCU-UHFFFAOYSA-N 0 3 424.472 4.237 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@@H](C)NCc2ccc3c(c2)CC(C)(C)O3)cc1 ZINC000237031739 853953644 /nfs/dbraw/zinc/95/36/44/853953644.db2.gz WTMOLHFXPPYFHG-QGZVFWFLSA-N 0 3 416.587 4.281 20 0 HIADHN CN(C)[C@H](CNCc1nc(-c2cccc(Br)c2)c[nH]1)c1cccc(F)c1 ZINC000237040331 853955877 /nfs/dbraw/zinc/95/58/77/853955877.db2.gz PVXWNPNCSQUKDJ-LJQANCHMSA-N 0 3 417.326 4.371 20 0 HIADHN CN(C)Cc1cc(CNCc2cc(Cl)ccc2OC[C@H]2CCCO2)ccc1F ZINC000237063223 853958797 /nfs/dbraw/zinc/95/87/97/853958797.db2.gz XDQZBYALDSGIRQ-HXUWFJFHSA-N 0 3 406.929 4.388 20 0 HIADHN Cc1nn(-c2ccc(F)cc2F)c(C)c1CNCc1ccc(F)c(CN(C)C)c1 ZINC000237063892 853958951 /nfs/dbraw/zinc/95/89/51/853958951.db2.gz HDRFCFNYRQOUQG-UHFFFAOYSA-N 0 3 402.464 4.258 20 0 HIADHN COc1ccccc1N1CC[C@H](CNCc2csc(-c3ccc4c(c3)OCO4)n2)C1 ZINC000237125980 853968853 /nfs/dbraw/zinc/96/88/53/853968853.db2.gz CJGLFYUDOOFTRG-MRXNPFEDSA-N 0 3 423.538 4.164 20 0 HIADHN CN(C)[C@@H](CNCc1nc(-c2cccc(Br)c2)c[nH]1)c1ccc(F)cc1 ZINC000237178983 853976158 /nfs/dbraw/zinc/97/61/58/853976158.db2.gz SOGPKYLDIHTBEA-IBGZPJMESA-N 0 3 417.326 4.371 20 0 HIADHN COc1cc(CNCc2ccc(NC(=O)c3ccc(F)cc3)cc2)cc2c1OCCO2 ZINC000237254943 853991833 /nfs/dbraw/zinc/99/18/33/853991833.db2.gz YQNPQXJUUVKVLT-UHFFFAOYSA-N 0 3 422.456 4.148 20 0 HIADHN COc1cccc(N2CC[C@H](CNCc3csc(-c4ccc5c(c4)OCO5)n3)C2)c1 ZINC000237291185 853999583 /nfs/dbraw/zinc/99/95/83/853999583.db2.gz HSUKWUGBKUPCGC-MRXNPFEDSA-N 0 3 423.538 4.164 20 0 HIADHN COc1ccc(NC(=O)C[C@H](C)N[C@H](c2ccccc2)c2ccncc2)c(OC)c1 ZINC000237307229 854003667 /nfs/dbraw/zinc/00/36/67/854003667.db2.gz JJKADRVLRHCYCP-BXKMTCNYSA-N 0 3 405.498 4.195 20 0 HIADHN COc1cc(Br)cc(C[NH2+][C@@H](c2ccc3c(c2)OCCO3)C2CC2)c1[O-] ZINC000237380837 854018583 /nfs/dbraw/zinc/01/85/83/854018583.db2.gz MNMYQBCABYAVPH-LJQANCHMSA-N 0 3 420.303 4.175 20 0 HIADHN COc1ccc(OC)c(NC(=O)C[C@@H](C)N[C@@H]2CCSc3c(F)cccc32)c1 ZINC000237397397 854022432 /nfs/dbraw/zinc/02/24/32/854022432.db2.gz YPZIEFUYAKCYSC-CXAGYDPISA-N 0 3 404.507 4.387 20 0 HIADHN COc1ccc(CNCCc2nc(-c3ccc(Cl)cc3)no2)c(Cl)c1OC ZINC000237396178 854022581 /nfs/dbraw/zinc/02/25/81/854022581.db2.gz KOXMFEKXPSBYOZ-UHFFFAOYSA-N 0 3 408.285 4.393 20 0 HIADHN COc1ccc(OC)c(NC(=O)C[C@H](C)NCc2c(C)nn(-c3ccccc3)c2C)c1 ZINC000237401471 854023525 /nfs/dbraw/zinc/02/35/25/854023525.db2.gz NQZHXYFKYVHUGZ-INIZCTEOSA-N 0 3 422.529 4.013 20 0 HIADHN COc1ccc(OC)c(NC(=O)C[C@H](C)N[C@@H]2CCOc3c(Cl)cccc32)c1 ZINC000237402684 854024654 /nfs/dbraw/zinc/02/46/54/854024654.db2.gz FWOQTBOABKGERA-SUMWQHHRSA-N 0 3 404.894 4.188 20 0 HIADHN C[C@@H]1CN(CCCNCc2csc(-c3ccc(C(F)(F)F)cc3)n2)C[C@@H](C)O1 ZINC000237407660 854025327 /nfs/dbraw/zinc/02/53/27/854025327.db2.gz RNEWZJHGSCFHKB-HUUCEWRRSA-N 0 3 413.509 4.418 20 0 HIADHN COc1ccc(-c2ccc(CNCc3c(C)n(C)n(-c4ccccc4)c3=O)cc2)cc1 ZINC000237418959 854028681 /nfs/dbraw/zinc/02/86/81/854028681.db2.gz AERLPZPZJUFEBE-UHFFFAOYSA-N 0 3 413.521 4.450 20 0 HIADHN C[C@@H](NCc1ccc(-n2ccc(C(F)(F)F)n2)cc1)c1ccc(S(C)(=O)=O)cc1 ZINC000237436298 854033921 /nfs/dbraw/zinc/03/39/21/854033921.db2.gz VTTXQJLXUPFWKV-CQSZACIVSA-N 0 3 423.460 4.145 20 0 HIADHN C[C@H](C[C@H]1CCCCCN1C(=O)OC(C)(C)C)N[C@@H](C)c1nnc2ccccn21 ZINC000237454631 854036008 /nfs/dbraw/zinc/03/60/08/854036008.db2.gz NYYBPZSUUVAYKI-FGTMMUONSA-N 0 3 401.555 4.338 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(CNCCNC(=O)CC3CCCCC3)c2)cc1 ZINC000237463370 854038141 /nfs/dbraw/zinc/03/81/41/854038141.db2.gz YAJSPLBHMTXICN-UHFFFAOYSA-N 0 3 423.557 4.124 20 0 HIADHN COc1ccc(-c2nn(-c3ccccc3)cc2CNCC[S@](=O)C(C)(C)C)cc1 ZINC000237496727 854045574 /nfs/dbraw/zinc/04/55/74/854045574.db2.gz KYHXUPDIISKRTI-LJAQVGFWSA-N 0 3 411.571 4.185 20 0 HIADHN C[C@H]1CN(C(=O)c2ccc(CNCc3cc(Br)cs3)cc2)C[C@H](C)O1 ZINC000237545536 854052627 /nfs/dbraw/zinc/05/26/27/854052627.db2.gz QKIBLKFZTOCBMT-KBPBESRZSA-N 0 3 423.376 4.050 20 0 HIADHN C[C@H](NCc1ccc(OCc2ccccc2)cc1)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000237550160 854053298 /nfs/dbraw/zinc/05/32/98/854053298.db2.gz XRYIDKPRLHRWGN-IBGZPJMESA-N 0 3 424.566 4.367 20 0 HIADHN Cc1nn(Cc2ccccc2Cl)c(Cl)c1CNCCCOC[C@@H]1CCOC1 ZINC000237689860 854076129 /nfs/dbraw/zinc/07/61/29/854076129.db2.gz JEXZGOZFHLHMHF-INIZCTEOSA-N 0 3 412.361 4.079 20 0 HIADHN Cc1nn(C)c(C)c1CCNCc1csc(-c2cccc(Br)c2)n1 ZINC000237701364 854079130 /nfs/dbraw/zinc/07/91/30/854079130.db2.gz PDZYEEWHEVMQPL-UHFFFAOYSA-N 0 3 405.365 4.255 20 0 HIADHN Clc1ccc(OC[C@H]2CCCO2)c(CN[C@@H]2CCN(c3ncccc3Cl)C2)c1 ZINC000237716812 854083093 /nfs/dbraw/zinc/08/30/93/854083093.db2.gz QTBSSOGWRBWZBJ-QZTJIDSGSA-N 0 3 422.356 4.315 20 0 HIADHN Cn1cc(CNCc2cccc(OC(F)F)c2)c(-c2ccc3c(c2)OCCCO3)n1 ZINC000237771224 854093894 /nfs/dbraw/zinc/09/38/94/854093894.db2.gz GYDKMRTTYAHYSC-UHFFFAOYSA-N 0 3 415.440 4.140 20 0 HIADHN Fc1ccc(N2CC[C@H](CNCc3csc(-c4ccc5c(c4)OCO5)n3)C2)cc1 ZINC000237788031 854096832 /nfs/dbraw/zinc/09/68/32/854096832.db2.gz JQAJZPRCPNNTQY-OAHLLOKOSA-N 0 3 411.502 4.294 20 0 HIADHN Cc1ncc(CNCCC(=O)Nc2ccc(Br)cc2)n1-c1ccccc1 ZINC000237786008 854096873 /nfs/dbraw/zinc/09/68/73/854096873.db2.gz LJENOCIIFJHQGV-UHFFFAOYSA-N 0 3 413.319 4.062 20 0 HIADHN O=[N+]([O-])c1ccc(Cl)cc1CNC[C@H](c1ccc(Cl)cc1)N1CCOCC1 ZINC000237784797 854096912 /nfs/dbraw/zinc/09/69/12/854096912.db2.gz ILAGMQHXOKZFHH-LJQANCHMSA-N 0 3 410.301 4.065 20 0 HIADHN Cc1nn(-c2cccc(Cl)c2)c(Cl)c1CNCCc1cn2ccccc2n1 ZINC000237814774 854101947 /nfs/dbraw/zinc/10/19/47/854101947.db2.gz SXUZWYYYVLTFHY-UHFFFAOYSA-N 0 3 400.313 4.468 20 0 HIADHN Clc1cc(Cl)c(OCCNCc2cnc(N3CCOCC3)s2)c(Cl)c1 ZINC000237830027 854105268 /nfs/dbraw/zinc/10/52/68/854105268.db2.gz WDNGHHWKYMEDHD-UHFFFAOYSA-N 0 3 422.765 4.109 20 0 HIADHN O=C(NCCNCc1cccc(NC(=O)c2ccc(Cl)cc2)c1)c1ccccc1 ZINC000237871445 854111700 /nfs/dbraw/zinc/11/17/00/854111700.db2.gz IMNRUUDFMUQQMT-UHFFFAOYSA-N 0 3 407.901 4.112 20 0 HIADHN Fc1cccc([C@H](CNCc2ccc(CSC(F)F)o2)N2CCOCC2)c1 ZINC000237931022 854120917 /nfs/dbraw/zinc/12/09/17/854120917.db2.gz WDJFROSPAXUQBM-SFHVURJKSA-N 0 3 400.466 4.038 20 0 HIADHN C[C@H]1Cc2ccccc2N1Cc1occc1C(=O)NC[C@H](Cc1ccccc1)N(C)C ZINC000248122067 854180980 /nfs/dbraw/zinc/18/09/80/854180980.db2.gz NLFWIAYXSZETAO-UGKGYDQZSA-N 0 3 417.553 4.134 20 0 HIADHN COc1cccc([C@H](CNC(=O)Cc2coc3cc4c(cc23)CCC4)N2CCCC2)c1 ZINC000248265186 854188838 /nfs/dbraw/zinc/18/88/38/854188838.db2.gz YWHZREFYDKOPOP-DEOSSOPVSA-N 0 3 418.537 4.426 20 0 HIADHN Cc1ccccc1-n1ccnc1SCC(=O)N[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000250989060 854196516 /nfs/dbraw/zinc/19/65/16/854196516.db2.gz NMOYINQNAMIOTH-CTNGQTDRSA-N 0 3 420.582 4.225 20 0 HIADHN CCN(CC(=O)NC[C@@H](c1c[nH]c2ccccc21)c1ccc(OC)cc1)CC1CC1 ZINC000261415238 854254310 /nfs/dbraw/zinc/25/43/10/854254310.db2.gz MBNTUSFGDFUVMS-JOCHJYFZSA-N 0 3 405.542 4.157 20 0 HIADHN CC(C)(C)N(Cc1cccc(F)c1)C(=O)CNC1(c2ccc(F)cc2)CCOCC1 ZINC000261426135 854257870 /nfs/dbraw/zinc/25/78/70/854257870.db2.gz GVEUYPBIBWUFMP-UHFFFAOYSA-N 0 3 416.512 4.387 20 0 HIADHN C[C@H](CNC(=O)CSCc1cc(-c2cccs2)on1)N(C)Cc1ccccc1 ZINC000261476177 854275127 /nfs/dbraw/zinc/27/51/27/854275127.db2.gz XEJLCXXAKYGKRW-MRXNPFEDSA-N 0 3 415.584 4.273 20 0 HIADHN CCCc1cc(=O)n2nc(NC[C@@H](c3cccs3)N3CCC(C)CC3)sc2n1 ZINC000301102471 854297149 /nfs/dbraw/zinc/29/71/49/854297149.db2.gz POVCKILIUSLZBH-INIZCTEOSA-N 0 3 417.604 4.050 20 0 HIADHN FC(F)(F)c1cc(NC[C@H](c2ccco2)N2CCCC2)nc(-c2cccnc2)n1 ZINC000301174942 854319556 /nfs/dbraw/zinc/31/95/56/854319556.db2.gz HVIKLQLKOHNUOP-OAHLLOKOSA-N 0 3 403.408 4.399 20 0 HIADHN C[C@@H](NC(C)(C)CNc1nc2c(cnn2-c2ccccc2)c(=O)[nH]1)c1ccccc1 ZINC000301397063 854381526 /nfs/dbraw/zinc/38/15/26/854381526.db2.gz GQXQEMAZXUQIOO-MRXNPFEDSA-N 0 3 402.502 4.062 20 0 HIADHN Cc1ccc([C@H](CNc2ncccc2C(=O)N2CCc3ccccc32)N2CCCC2)o1 ZINC000301412663 854387579 /nfs/dbraw/zinc/38/75/79/854387579.db2.gz PTYIOGLPRGKEOL-QFIPXVFZSA-N 0 3 416.525 4.435 20 0 HIADHN O=S(=O)(c1ccccc1N1CC[C@@H]2[C@@H](CCCN2Cc2ccccc2)C1)C(F)F ZINC000301706670 854448819 /nfs/dbraw/zinc/44/88/19/854448819.db2.gz ISBNBOZIAOOSMY-RBUKOAKNSA-N 0 3 420.525 4.174 20 0 HIADHN Cc1noc(-c2cccnc2N2CCN(C3c4ccccc4-c4ccccc43)CC2)n1 ZINC000301787541 854465749 /nfs/dbraw/zinc/46/57/49/854465749.db2.gz XAVRAJRQNZEQMU-UHFFFAOYSA-N 0 3 409.493 4.332 20 0 HIADHN CN(C)[C@@H](CNc1cc(Br)cc(F)c1C(N)=O)c1ccc(Cl)cc1 ZINC000301941622 854500240 /nfs/dbraw/zinc/50/02/40/854500240.db2.gz VZNZLZQMTRMSBR-HNNXBMFYSA-N 0 3 414.706 4.055 20 0 HIADHN Cc1nc2ccc(Br)cc2c(N2CCC[C@H](c3nncn3C)C2)c1C ZINC000301989161 854510114 /nfs/dbraw/zinc/51/01/14/854510114.db2.gz OHSDBJQRUSDAGW-AWEZNQCLSA-N 0 3 400.324 4.127 20 0 HIADHN c1csc(CN2CCC[C@H](CNc3nn4cc(-c5cccnc5)nc4s3)C2)c1 ZINC000302058193 854523604 /nfs/dbraw/zinc/52/36/04/854523604.db2.gz AUIWRFVQYUUIQM-OAHLLOKOSA-N 0 3 410.572 4.238 20 0 HIADHN CCS(=O)(=O)c1ccc(N2CCC(Nc3ccnc4ccc(C)cc43)CC2)cc1 ZINC000302172457 854542649 /nfs/dbraw/zinc/54/26/49/854542649.db2.gz VJZWRIXROQBIEV-UHFFFAOYSA-N 0 3 409.555 4.418 20 0 HIADHN Cc1cc(C)n(-c2cncc(NC[C@H](c3cccc(C(F)(F)F)c3)N(C)C)n2)n1 ZINC000302216767 854551866 /nfs/dbraw/zinc/55/18/66/854551866.db2.gz IYJSRJLJKGZZBI-QGZVFWFLSA-N 0 3 404.440 4.013 20 0 HIADHN C[C@H](CCN1CCN(C)CC1)Nc1ccc2c(Br)ccc(Cl)c2n1 ZINC000302261010 854557925 /nfs/dbraw/zinc/55/79/25/854557925.db2.gz PLQCFYGVQAWVBK-CYBMUJFWSA-N 0 3 411.775 4.089 20 0 HIADHN CN(C)[C@@H](CNc1ccc2nnc(C(C)(C)C)n2n1)c1cccc(C(F)(F)F)c1 ZINC000302349137 854562353 /nfs/dbraw/zinc/56/23/53/854562353.db2.gz AUWXYCVOXHTSGJ-HNNXBMFYSA-N 0 3 406.456 4.155 20 0 HIADHN CC(C)N1CCN(c2cccc(Nc3ccc4nnc(-c5ccsc5)n4n3)c2)CC1 ZINC000302387118 854566464 /nfs/dbraw/zinc/56/64/64/854566464.db2.gz FIQBGXMWDAPQNS-UHFFFAOYSA-N 0 3 419.558 4.127 20 0 HIADHN C[C@@H]1CN(CCC2CCN(c3nn4cc(C5CCCC5)nc4s3)CC2)C[C@H](C)O1 ZINC000302571297 854587196 /nfs/dbraw/zinc/58/71/96/854587196.db2.gz ZCLXBOZKFDJIKE-CALCHBBNSA-N 0 3 417.623 4.164 20 0 HIADHN COc1ccc(C(NC(=O)CN[C@@H](C)c2ccccc2)c2ccc(OC)cc2)cc1 ZINC000302603604 854591556 /nfs/dbraw/zinc/59/15/56/854591556.db2.gz QUKCKOGCXNLLOD-SFHVURJKSA-N 0 3 404.510 4.260 20 0 HIADHN C[C@H](N[C@@H](Cc1ccccc1)c1ccccc1)C(=O)Nc1ccc2c(c1)OCCO2 ZINC000302804734 854639166 /nfs/dbraw/zinc/63/91/66/854639166.db2.gz KDRLDMPPSVUKTH-AVRDEDQJSA-N 0 3 402.494 4.358 20 0 HIADHN COc1ccc([C@@H](CNC(=O)NCc2cccc(C(F)(F)F)c2)N2CCCC2)cc1 ZINC000302809356 854641573 /nfs/dbraw/zinc/64/15/73/854641573.db2.gz HKGBOPSNSVATGV-HXUWFJFHSA-N 0 3 421.463 4.350 20 0 HIADHN CN(Cc1ccc(Br)cc1)C(=O)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000302898667 854671218 /nfs/dbraw/zinc/67/12/18/854671218.db2.gz NRENPUKWEHTCJX-FQEVSTJZSA-N 0 3 416.363 4.428 20 0 HIADHN CCOc1ccc(OCC)c(NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)c1 ZINC000302944220 854690660 /nfs/dbraw/zinc/69/06/60/854690660.db2.gz AVCWFBFXDDYWNV-GOSISDBHSA-N 0 3 400.494 4.474 20 0 HIADHN O=C(Nc1cccc(OC[C@H]2CCCO2)c1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000302963107 854698558 /nfs/dbraw/zinc/69/85/58/854698558.db2.gz GLTSYYXPJJPGJM-WMZHIEFXSA-N 0 3 412.505 4.234 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1ccc(Br)cc1OC)c1ccsc1 ZINC000302976725 854705750 /nfs/dbraw/zinc/70/57/50/854705750.db2.gz CFWGMWSQXBJUSF-INIZCTEOSA-N 0 3 411.365 4.332 20 0 HIADHN CC1CCN([C@H](CNC(=O)[C@@H]2CCCN2C(=O)CC(C)(C)C)c2cccs2)CC1 ZINC000303006906 854720067 /nfs/dbraw/zinc/72/00/67/854720067.db2.gz IOYPWKVSGYBEIH-RBUKOAKNSA-N 0 3 419.635 4.065 20 0 HIADHN Cc1cc(C)n(Cc2cccc(C(=O)NCC(C)(C)N3CCc4ccccc4C3)c2)n1 ZINC000303045323 854737321 /nfs/dbraw/zinc/73/73/21/854737321.db2.gz UAHNUMIJVGBLMO-UHFFFAOYSA-N 0 3 416.569 4.115 20 0 HIADHN COc1ccc(Cl)cc1N1CC[C@@H](NCc2c(F)cccc2N2CCCC2)C1 ZINC000303101010 854760057 /nfs/dbraw/zinc/76/00/57/854760057.db2.gz CCWKANMTUFQNKV-QGZVFWFLSA-N 0 3 403.929 4.456 20 0 HIADHN C=C1c2ccccc2C(=O)N1CC(=O)N(CCC)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000303117124 854768043 /nfs/dbraw/zinc/76/80/43/854768043.db2.gz MFJMFEVUVUHZED-JOCHJYFZSA-N 0 3 417.553 4.016 20 0 HIADHN COc1ccccc1[C@H](C)NC(=O)CN(Cc1ccc2c(c1)CCO2)C1CCCC1 ZINC000303173687 854800281 /nfs/dbraw/zinc/80/02/81/854800281.db2.gz JQQJLBKDSLASMZ-SFHVURJKSA-N 0 3 408.542 4.252 20 0 HIADHN CC(C)c1nc(C(=O)N2CC[C@H](N3CCCC3)C2)nn1-c1c(Cl)cccc1Cl ZINC000303228303 854826576 /nfs/dbraw/zinc/82/65/76/854826576.db2.gz UQUUDLARMBAACU-AWEZNQCLSA-N 0 3 422.360 4.008 20 0 HIADHN COc1ccc(CNC[C@H](c2c(F)cccc2Cl)N2CCO[C@@H](C)C2)c(OC)c1 ZINC000303228645 854826822 /nfs/dbraw/zinc/82/68/22/854826822.db2.gz XMXZAONGPBEPQQ-MGPUTAFESA-N 0 3 422.928 4.048 20 0 HIADHN CN(C[C@@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)c1cc(Cl)cc(Cl)c1 ZINC000437345675 862621570 /nfs/dbraw/zinc/62/15/70/862621570.db2.gz PNBXYKHEWTUIEU-INIZCTEOSA-N 0 3 413.370 4.136 20 0 HIADHN COc1ccc(CNC(=O)NC[C@@H](C)N(C)Cc2ccccc2)c(C(F)(F)F)c1 ZINC000303432360 854933501 /nfs/dbraw/zinc/93/35/01/854933501.db2.gz CLXWPXODGWXUNN-OAHLLOKOSA-N 0 3 409.452 4.034 20 0 HIADHN COc1ccc(S[C@H](C)C(=O)NCC2(N3CCSCC3)CCCCC2)cc1 ZINC000303435398 854936600 /nfs/dbraw/zinc/93/66/00/854936600.db2.gz GAIOEYABSAZOKP-QGZVFWFLSA-N 0 3 408.633 4.044 20 0 HIADHN N#Cc1ccsc1NC(=O)CCN1CCC([C@H](O)c2ccc(Cl)cc2)CC1 ZINC000303443327 854942779 /nfs/dbraw/zinc/94/27/79/854942779.db2.gz ZCFQYNBNUCJIAF-LJQANCHMSA-N 0 3 403.935 4.047 20 0 HIADHN C[C@H](CNC(=O)N(C)Cc1ccc(Br)s1)N(C)Cc1ccccc1 ZINC000303477342 854973170 /nfs/dbraw/zinc/97/31/70/854973170.db2.gz PDSCKXXYXXVVFK-CQSZACIVSA-N 0 3 410.381 4.173 20 0 HIADHN Cc1cc(NC(=O)c2ccco2)sc1C(=O)NC[C@H](C)N(C)Cc1ccccc1 ZINC000303512536 855000779 /nfs/dbraw/zinc/00/07/79/855000779.db2.gz TVSYUZCDVSVWRZ-INIZCTEOSA-N 0 3 411.527 4.152 20 0 HIADHN C[C@H](CNC(=O)C1(c2ccc(Br)cc2)CC1)N(C)Cc1ccccc1 ZINC000303540542 855025640 /nfs/dbraw/zinc/02/56/40/855025640.db2.gz YKFWPTMTRLXKCH-MRXNPFEDSA-N 0 3 401.348 4.117 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)[C@@H]3C[C@H]3c3cccc(C(F)(F)F)c3)CC2)C[C@H](C)O1 ZINC000303541702 855028108 /nfs/dbraw/zinc/02/81/08/855028108.db2.gz UOSFIYPXGRQHLX-LXDRIQHSSA-N 0 3 424.507 4.157 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3ccc(C)cc3OCC(F)(F)F)cc2)CC1 ZINC000303553029 855035809 /nfs/dbraw/zinc/03/58/09/855035809.db2.gz LYQWOBNTOXXBNS-UHFFFAOYSA-N 0 3 421.463 4.330 20 0 HIADHN CC(C)n1c2ccccc2nc1[C@@H]1CCCN(C[C@H](O)COc2ccc(F)cc2)C1 ZINC000303577063 855052875 /nfs/dbraw/zinc/05/28/75/855052875.db2.gz QDLQEVYUVVCJRT-QUCCMNQESA-N 0 3 411.521 4.376 20 0 HIADHN COc1cc(F)c([C@H](C)NC(=O)N[C@@H](CN2CCCC2)c2ccccc2)cc1OC ZINC000303586066 855060060 /nfs/dbraw/zinc/06/00/60/855060060.db2.gz QNEQMBOWWCCVHB-JXFKEZNVSA-N 0 3 415.509 4.040 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)N1CCC[C@@]2(CC=CCC2)C1 ZINC000303605342 855073513 /nfs/dbraw/zinc/07/35/13/855073513.db2.gz VRLYYPMKZBNNLF-VWLOTQADSA-N 0 3 410.606 4.121 20 0 HIADHN Cc1ccc2cc(C(=O)NC3CCN(CCOc4ccc(Cl)cc4)CC3)[nH]c2c1 ZINC000303731455 855157270 /nfs/dbraw/zinc/15/72/70/855157270.db2.gz VIIDDWSZCOFSHZ-UHFFFAOYSA-N 0 3 411.933 4.403 20 0 HIADHN CO[C@H](c1ccc(Cl)cc1)[C@H](C)NC(=O)N1CCCN(Cc2ccccc2)CC1 ZINC000303745987 855168419 /nfs/dbraw/zinc/16/84/19/855168419.db2.gz FZWAFIXNTOKVNS-AVRDEDQJSA-N 0 3 415.965 4.334 20 0 HIADHN Cc1c(Cl)cccc1S(=O)(=O)N(C)[C@H]1CCN(Cc2ccccc2)[C@H](C)C1 ZINC000303760797 855180038 /nfs/dbraw/zinc/18/00/38/855180038.db2.gz FAWQGLZJHZHWBR-APWZRJJASA-N 0 3 406.979 4.322 20 0 HIADHN O=C(Nc1ccccc1)c1cccc(CN2CCC[C@@H](c3nnc4ccccn43)C2)c1 ZINC000303796812 855202749 /nfs/dbraw/zinc/20/27/49/855202749.db2.gz WAJHVBVDBBCTGY-OAQYLSRUSA-N 0 3 411.509 4.361 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C ZINC000303801128 855205376 /nfs/dbraw/zinc/20/53/76/855205376.db2.gz GVXDRUCQJGLHJI-FQEVSTJZSA-N 0 3 416.569 4.155 20 0 HIADHN Cc1cc(Cl)ccc1S(=O)(=O)N(C)[C@@H]1CCN(Cc2ccccc2)[C@@H](C)C1 ZINC000303803725 855208385 /nfs/dbraw/zinc/20/83/85/855208385.db2.gz MCEKWMVROVOLOL-FXAWDEMLSA-N 0 3 406.979 4.322 20 0 HIADHN Cc1ccc(S(=O)(=O)N(C)[C@H]2CCN(Cc3ccccc3)[C@@H](C)C2)c2cccnc12 ZINC000303817223 855218935 /nfs/dbraw/zinc/21/89/35/855218935.db2.gz OPYBHXAJNVBQDO-FPOVZHCZSA-N 0 3 423.582 4.217 20 0 HIADHN Cc1ccc(S(=O)(=O)N(C)[C@@H]2CCN(Cc3ccccc3)[C@@H](C)C2)c2cccnc12 ZINC000303817226 855219378 /nfs/dbraw/zinc/21/93/78/855219378.db2.gz OPYBHXAJNVBQDO-PZJWPPBQSA-N 0 3 423.582 4.217 20 0 HIADHN CCc1ccc([C@H]2COCCN2C(=O)NC[C@@H](c2ccsc2)N(CC)CC)o1 ZINC000303828269 855228656 /nfs/dbraw/zinc/22/86/56/855228656.db2.gz ZCMVLRQSOQWSKF-RBUKOAKNSA-N 0 3 405.564 4.070 20 0 HIADHN COc1ccc([C@H](CNC(=O)[C@H]2C[C@H]2c2cc(F)ccc2F)N2CCCC2)cc1 ZINC000303838849 855236179 /nfs/dbraw/zinc/23/61/79/855236179.db2.gz HYVDWSUAGQYHOG-VCOUNFBDSA-N 0 3 400.469 4.030 20 0 HIADHN C[C@@H]1C[C@@H](N(C)S(=O)(=O)Cc2cccc3cccnc32)CCN1Cc1ccccc1 ZINC000303868579 855260692 /nfs/dbraw/zinc/26/06/92/855260692.db2.gz XJUOIKUEHHMDGQ-XXBNENTESA-N 0 3 423.582 4.050 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)N[C@H]1C[C@@H]1c1ccccc1OC(F)F ZINC000437370483 862666521 /nfs/dbraw/zinc/66/65/21/862666521.db2.gz QQPNVVJSXGUSQE-WBVHZDCISA-N 0 3 400.425 4.382 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)c1cc(Br)cnc1Cl ZINC000324616762 855399295 /nfs/dbraw/zinc/39/92/95/855399295.db2.gz OQACMJJGOJHIAA-MRXNPFEDSA-N 0 3 408.727 4.064 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)c1cc(Br)cnc1Cl ZINC000324616757 855399449 /nfs/dbraw/zinc/39/94/49/855399449.db2.gz OQACMJJGOJHIAA-INIZCTEOSA-N 0 3 408.727 4.064 20 0 HIADHN CCOc1c(Br)cc(Br)cc1CNC[C@@](C)(O)C(C)C ZINC000380464699 855429246 /nfs/dbraw/zinc/42/92/46/855429246.db2.gz PWQRKGIZVQBGCG-OAHLLOKOSA-N 0 3 409.162 4.107 20 0 HIADHN C[C@@H]1CCN(C(=O)c2ccc(F)cc2Br)CCN1Cc1ccccc1 ZINC000383053791 855437085 /nfs/dbraw/zinc/43/70/85/855437085.db2.gz MEZRXDDGEZSYAP-OAHLLOKOSA-N 0 3 405.311 4.325 20 0 HIADHN COc1c(Br)cc(Br)cc1CNC[C@@](C)(OC)C1CC1 ZINC000384049162 855439440 /nfs/dbraw/zinc/43/94/40/855439440.db2.gz WKLZTLBWHFEWBJ-OAHLLOKOSA-N 0 3 407.146 4.125 20 0 HIADHN CCOc1c(Br)cc(Br)cc1CN[C@H](C)CC(C)(C)O ZINC000384976401 855440967 /nfs/dbraw/zinc/44/09/67/855440967.db2.gz IYSPNJVYANIXKA-SNVBAGLBSA-N 0 3 409.162 4.249 20 0 HIADHN CCn1cc(Br)cc1C(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000388779954 855448120 /nfs/dbraw/zinc/44/81/20/855448120.db2.gz HEQDEBOTQAYKFN-GOSISDBHSA-N 0 3 404.352 4.007 20 0 HIADHN O=C(NC[C@H]1CCCN1Cc1ccccc1)c1ccc(Cl)cc1Br ZINC000390738471 855456082 /nfs/dbraw/zinc/45/60/82/855456082.db2.gz AHNMWGMLEMHCPF-MRXNPFEDSA-N 0 3 407.739 4.497 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)c1ccc(Cl)cc1Br ZINC000390738470 855456471 /nfs/dbraw/zinc/45/64/71/855456471.db2.gz AHNMWGMLEMHCPF-INIZCTEOSA-N 0 3 407.739 4.497 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)c2cc(Cl)ccc2Br)CN1Cc1ccccc1 ZINC000398058948 855475266 /nfs/dbraw/zinc/47/52/66/855475266.db2.gz BFMMTUXGDDRDGN-CJNGLKHVSA-N 0 3 407.739 4.495 20 0 HIADHN C[C@@]1(NC(=O)c2c(F)cc(Br)cc2F)CCN(Cc2ccccc2)C1 ZINC000405984296 855482707 /nfs/dbraw/zinc/48/27/07/855482707.db2.gz FVGUWFRTPLGAIN-LJQANCHMSA-N 0 3 409.274 4.122 20 0 HIADHN CC(C)(Cc1nc2ccccc2[nH]1)C(=O)NCC(C)(C)N1CCc2ccccc2C1 ZINC000409564049 855542727 /nfs/dbraw/zinc/54/27/27/855542727.db2.gz VMJVTNYBEXILGQ-UHFFFAOYSA-N 0 3 404.558 4.085 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N(C)Cc2cc(Br)ccc2F)N(C)C)cc1 ZINC000409596363 855558124 /nfs/dbraw/zinc/55/81/24/855558124.db2.gz IQCJRPFABPIFBD-LJQANCHMSA-N 0 3 422.342 4.341 20 0 HIADHN CN(CCNC(=O)Nc1cc(Cl)ccc1OC[C@@H]1CCCO1)Cc1ccccc1 ZINC000409653978 855585806 /nfs/dbraw/zinc/58/58/06/855585806.db2.gz VAHXTQWGSXBONS-IBGZPJMESA-N 0 3 417.937 4.151 20 0 HIADHN Cc1c(Cl)cccc1NC(=O)NCCCCN1CCN(Cc2ccccc2)CC1 ZINC000409688249 855602796 /nfs/dbraw/zinc/60/27/96/855602796.db2.gz NZLOTPHTIYADBY-UHFFFAOYSA-N 0 3 414.981 4.368 20 0 HIADHN CC(C)n1ncc2c1nc(C1CC1)cc2C(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000409848424 855685476 /nfs/dbraw/zinc/68/54/76/855685476.db2.gz JJVAAFXEABRMGH-YLJYHZDGSA-N 0 3 417.557 4.455 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)CCc2cc(Br)cs2)C1 ZINC000409851187 855687935 /nfs/dbraw/zinc/68/79/35/855687935.db2.gz YVKQQMJMWRQNKY-RHSMWYFYSA-N 0 3 407.377 4.395 20 0 HIADHN O=C(NCc1ccc2c(c1)OCO2)[C@@H](NC[C@H]1CCCC(F)(F)C1)c1ccccc1 ZINC000409865429 855694995 /nfs/dbraw/zinc/69/49/95/855694995.db2.gz FANFONVPKFOTOD-UWJYYQICSA-N 0 3 416.468 4.188 20 0 HIADHN CC(C)n1cnc(C(=O)Nc2cccc(N3CCN(CCc4ccccc4)CC3)c2)c1 ZINC000409893258 855710587 /nfs/dbraw/zinc/71/05/87/855710587.db2.gz UHVFNEKDCQSCMY-UHFFFAOYSA-N 0 3 417.557 4.081 20 0 HIADHN Cc1noc2nc(C)cc(C(=O)N[C@H](CN3CCc4ccccc4C3)C(C)(C)C)c12 ZINC000410055566 855803366 /nfs/dbraw/zinc/80/33/66/855803366.db2.gz WHFVZCRRIQQLES-HXUWFJFHSA-N 0 3 406.530 4.042 20 0 HIADHN Cc1ccccc1C1(C(=O)Nc2ccc(C(=O)N(C)[C@H]3CCCN(C)C3)cc2)CCC1 ZINC000410070178 855807547 /nfs/dbraw/zinc/80/75/47/855807547.db2.gz WMXPLSJCPOJPDM-QFIPXVFZSA-N 0 3 419.569 4.222 20 0 HIADHN CSc1ccccc1[C@@H](C)NC(=O)N1CCC(CN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000410090503 855814645 /nfs/dbraw/zinc/81/46/45/855814645.db2.gz YRLHDDSDQOWAEH-OKZBNKHCSA-N 0 3 405.608 4.000 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)NCc2ccc(F)cc2C(F)(F)F)CC1 ZINC000410197082 855858345 /nfs/dbraw/zinc/85/83/45/855858345.db2.gz CPEIZWQJGSJAAA-UHFFFAOYSA-N 0 3 413.415 4.244 20 0 HIADHN COc1ccc([C@H](CNC(=O)NCc2ccc(OC(C)C)cc2)N2CCCC2)cc1 ZINC000410213859 855865043 /nfs/dbraw/zinc/86/50/43/855865043.db2.gz HYKGJEXNZMYKGH-QHCPKHFHSA-N 0 3 411.546 4.119 20 0 HIADHN COc1cc(NC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)c(C)c(OC)c1 ZINC000410382027 855963319 /nfs/dbraw/zinc/96/33/19/855963319.db2.gz YIZZGIUWXFSZOC-NRFANRHFSA-N 0 3 422.447 4.405 20 0 HIADHN Cc1ccc2cc([C@H](C)NCc3cccc(NC(=O)CCN4CCOCC4)c3)oc2c1 ZINC000425938489 856010252 /nfs/dbraw/zinc/01/02/52/856010252.db2.gz XHHHNHFCKQVJQO-IBGZPJMESA-N 0 3 421.541 4.253 20 0 HIADHN c1coc(-c2ncc(CN3C[C@H]4CCC[C@@]4(c4nc(-c5cccnc5)no4)C3)s2)c1 ZINC000425977499 856026991 /nfs/dbraw/zinc/02/69/91/856026991.db2.gz LHEVIHDXMXAMFH-OPAMFIHVSA-N 0 3 419.510 4.402 20 0 HIADHN CC[C@H](C)[C@H](NC(=O)N1CCN(C2CCOCC2)C[C@@H]1C)c1ccc(Cl)cc1 ZINC000426025258 856054710 /nfs/dbraw/zinc/05/47/10/856054710.db2.gz YSIGQGRLKYPCFO-FIKGOQFSSA-N 0 3 407.986 4.322 20 0 HIADHN CC[C@@H](C)[C@@H](NC(=O)N1CCN(C2CCOCC2)C[C@@H]1C)c1ccc(Cl)cc1 ZINC000426025260 856054755 /nfs/dbraw/zinc/05/47/55/856054755.db2.gz YSIGQGRLKYPCFO-LLGFUMIMSA-N 0 3 407.986 4.322 20 0 HIADHN CC[C@H](C)[C@@H](NC(=O)N1CCN(C2CCOCC2)C[C@H]1C)c1ccc(Cl)cc1 ZINC000426025256 856055013 /nfs/dbraw/zinc/05/50/13/856055013.db2.gz YSIGQGRLKYPCFO-CSODHUTKSA-N 0 3 407.986 4.322 20 0 HIADHN Cc1cc(F)cc2c(O)c(C(=O)NC[C@@H](c3ccccc3)N3CCC(C)CC3)cnc12 ZINC000426215659 856181991 /nfs/dbraw/zinc/18/19/91/856181991.db2.gz KEUYFMNHAONXAM-QFIPXVFZSA-N 0 3 421.516 4.179 20 0 HIADHN CN(C)CCN(C(=O)c1cc(=O)[nH]c2c(Br)cccc12)C1CCCCC1 ZINC000426240864 856196717 /nfs/dbraw/zinc/19/67/17/856196717.db2.gz VAJVMKIZTFFJDI-UHFFFAOYSA-N 0 3 420.351 4.039 20 0 HIADHN Cc1ccc2c(c1)[C@H](N[C@@H](C)c1ccc(Br)c(S(N)(=O)=O)c1)CCC2 ZINC000426294103 856226174 /nfs/dbraw/zinc/22/61/74/856226174.db2.gz SKNMXQFWZYWVSJ-SCLBCKFNSA-N 0 3 423.376 4.133 20 0 HIADHN Cc1ccc(NC(=O)Nc2cccc3c2CCN(C(=O)[C@@H]2CCCN2C2CC2)C3)cc1 ZINC000426313534 856240193 /nfs/dbraw/zinc/24/01/93/856240193.db2.gz NDCHRCKJTAKFTF-QHCPKHFHSA-N 0 3 418.541 4.151 20 0 HIADHN COCC(C)(C)CN(C)Cc1cccc(Br)c1OC[C@@H]1CCCO1 ZINC000426374815 856264827 /nfs/dbraw/zinc/26/48/27/856264827.db2.gz ZBVGVAQCFLPJFW-INIZCTEOSA-N 0 3 400.357 4.111 20 0 HIADHN CC(C)N(CC(=O)N(C)[C@]1(c2ccccc2Cl)CCCCC1=O)C1CCOCC1 ZINC000426452780 856298496 /nfs/dbraw/zinc/29/84/96/856298496.db2.gz ZHJPGWYJAGVPQR-QHCPKHFHSA-N 0 3 420.981 4.026 20 0 HIADHN CCOc1ccc(NC(=O)c2ccc(NC(=O)CN3CC[C@H]4CCC[C@H]43)cc2)cc1 ZINC000426464844 856304422 /nfs/dbraw/zinc/30/44/22/856304422.db2.gz YGLSWHSDKBDYPB-VGOFRKELSA-N 0 3 407.514 4.151 20 0 HIADHN Cc1ccnc(-c2nnc([C@H](C)[NH2+]C[C@H](C)c3cccc(Br)c3)[n-]2)c1 ZINC000426510433 856326048 /nfs/dbraw/zinc/32/60/48/856326048.db2.gz OIJSKHRVFKAHQE-KBPBESRZSA-N 0 3 400.324 4.392 20 0 HIADHN CCS[C@@H]1CCCC[C@H]1NC(=O)Nc1ccc(N2CCN(CC)CC2)cc1C ZINC000426630851 856383029 /nfs/dbraw/zinc/38/30/29/856383029.db2.gz VYMOOBKJHXWQIW-NHCUHLMSSA-N 0 3 404.624 4.323 20 0 HIADHN Cc1cccc(-c2cncc(C(=O)N3CCC(CCN4C[C@H](C)O[C@@H](C)C4)CC3)c2)c1 ZINC000426657608 856397176 /nfs/dbraw/zinc/39/71/76/856397176.db2.gz QDZXHZDKRLMREG-SFTDATJTSA-N 0 3 421.585 4.409 20 0 HIADHN C[C@@H](c1cccc(N2CCCS2(=O)=O)c1)N(C)CCSc1ccccc1F ZINC000426798480 856484470 /nfs/dbraw/zinc/48/44/70/856484470.db2.gz FHZFWKVPVMPJNB-INIZCTEOSA-N 0 3 408.564 4.151 20 0 HIADHN C[C@H](NC(=O)N(CCN(C)C)CC1CCCCC1)c1nc(C(F)(F)F)cs1 ZINC000426899976 856532959 /nfs/dbraw/zinc/53/29/59/856532959.db2.gz ASIDSMDWVVJWDA-ZDUSSCGKSA-N 0 3 406.518 4.376 20 0 HIADHN O=C(NCc1nc(-c2ccccc2F)cs1)N1CCCN(Cc2ccccc2)CC1 ZINC000426901777 856533567 /nfs/dbraw/zinc/53/35/67/856533567.db2.gz XDJKYCZGZRCVLQ-UHFFFAOYSA-N 0 3 424.545 4.367 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)N[C@H](C)c2nc(C(F)(F)F)cs2)c1 ZINC000426906960 856536358 /nfs/dbraw/zinc/53/63/58/856536358.db2.gz KMNDKQFUCKEDEH-CQSZACIVSA-N 0 3 414.497 4.305 20 0 HIADHN CC[C@H](C)Oc1ccc(C(=O)Nc2ccc(C(=O)N(C)[C@@H]3CCCN(C)C3)cc2)cc1 ZINC000426947156 856557063 /nfs/dbraw/zinc/55/70/63/856557063.db2.gz BPFRNVLNWSRPGR-PGRDOPGGSA-N 0 3 423.557 4.282 20 0 HIADHN CC(=O)c1ccc(OCCCC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)cc1 ZINC000437460991 862824579 /nfs/dbraw/zinc/82/45/79/862824579.db2.gz IRFLQXJLKIUVJA-HXUWFJFHSA-N 0 3 408.542 4.171 20 0 HIADHN O=C(N[C@H]1CCOC2(CCCC2)C1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000427274743 856746891 /nfs/dbraw/zinc/74/68/91/856746891.db2.gz NEQHSBICXBGLPJ-RXVVDRJESA-N 0 3 410.480 4.049 20 0 HIADHN CC[C@@H](C)Oc1ccc(C(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)cc1 ZINC000427286054 856751413 /nfs/dbraw/zinc/75/14/13/856751413.db2.gz CCVONROMCAZJBF-AQNXPRMDSA-N 0 3 402.579 4.215 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3cccc(OC4CCCC4)c3)CC2)C[C@@H](C)O1 ZINC000427287749 856752577 /nfs/dbraw/zinc/75/25/77/856752577.db2.gz MGCOYWZXZZVTEW-WOJBJXKFSA-N 0 3 414.590 4.360 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3c(Cl)c4ccccc4n3C)CC2)C[C@@H](C)O1 ZINC000427293946 856756036 /nfs/dbraw/zinc/75/60/36/856756036.db2.gz BPJQHYMFSTWHFD-IAGOWNOFSA-N 0 3 417.981 4.183 20 0 HIADHN C[C@@H]1CCN(C(=O)c2ccc(OCc3ccccn3)cc2)CCN1Cc1ccccc1 ZINC000437471988 862833146 /nfs/dbraw/zinc/83/31/46/862833146.db2.gz LMWMAUJYCCNCQH-OAQYLSRUSA-N 0 3 415.537 4.397 20 0 HIADHN Cc1ccc(Br)cc1C(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000427303432 856761054 /nfs/dbraw/zinc/76/10/54/856761054.db2.gz ACSRAPXVKIQGFZ-CALCHBBNSA-N 0 3 423.395 4.109 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Cc3c[nH]c4ccc(Cl)cc34)CC2)C[C@@H](C)O1 ZINC000427318842 856768055 /nfs/dbraw/zinc/76/80/55/856768055.db2.gz BYRNTRKURNFAPE-IAGOWNOFSA-N 0 3 417.981 4.102 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)CCCOc3ccccc3Cl)CC2)C[C@H](C)O1 ZINC000427331243 856775289 /nfs/dbraw/zinc/77/52/89/856775289.db2.gz OXZLWYGLYUOPLR-KDURUIRLSA-N 0 3 422.997 4.237 20 0 HIADHN C[C@@H](CSc1ccccc1)C(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000427357187 856790058 /nfs/dbraw/zinc/79/00/58/856790058.db2.gz LRXKNEALRYSXQH-XUVXKRRUSA-N 0 3 404.620 4.153 20 0 HIADHN C[C@]1(CNC(=O)C(=O)Nc2cccc3ccsc32)CCCN1Cc1ccccc1 ZINC000427505844 856844668 /nfs/dbraw/zinc/84/46/68/856844668.db2.gz PICFDBCXVYXIEP-HSZRJFAPSA-N 0 3 407.539 4.011 20 0 HIADHN O=S(=O)(Cc1cc(Cl)cc(Cl)c1)NCc1ccccc1CN1CCCC1 ZINC000427515421 856846404 /nfs/dbraw/zinc/84/64/04/856846404.db2.gz SZMHKPSXSWASQF-UHFFFAOYSA-N 0 3 413.370 4.209 20 0 HIADHN COc1cccc([C@@H](CN[C@H](C)c2ncc(Br)cc2F)N2CCCC2)c1 ZINC000427600509 856883832 /nfs/dbraw/zinc/88/38/32/856883832.db2.gz GWXTYGMOHFMJAU-AUUYWEPGSA-N 0 3 422.342 4.480 20 0 HIADHN Cc1cc2c(cc1C)[C@H](NCc1cccc(OCCN3CCOCC3)c1)CCS2 ZINC000427605937 856886138 /nfs/dbraw/zinc/88/61/38/856886138.db2.gz FJVMEIORYLKFRL-HSZRJFAPSA-N 0 3 412.599 4.341 20 0 HIADHN Cc1ccc([C@@H](NCc2ccccc2OCC(=O)NC[C@H]2CCCO2)C2CCC2)cc1 ZINC000427608273 856887217 /nfs/dbraw/zinc/88/72/17/856887217.db2.gz GAKVKWOKQNDVHT-BVAGGSTKSA-N 0 3 422.569 4.300 20 0 HIADHN Cc1ccc(CS(=O)(=O)Nc2ccnc(N3CCc4ccccc4C3)c2)c(F)c1 ZINC000427639356 856894278 /nfs/dbraw/zinc/89/42/78/856894278.db2.gz YRSOHLRGKMUGRL-UHFFFAOYSA-N 0 3 411.502 4.034 20 0 HIADHN Cc1cc2c(cc1C)[C@H](NCc1ccccc1CS(=O)(=O)NC(C)C)CCS2 ZINC000427689937 856909707 /nfs/dbraw/zinc/90/97/07/856909707.db2.gz KLSRWVFVVXNWBI-OAQYLSRUSA-N 0 3 418.628 4.458 20 0 HIADHN Cc1ccc(CN[C@H]2CCCc3ncc(C(F)(F)F)cc32)c(N2CCOCC2)c1 ZINC000427703808 856916186 /nfs/dbraw/zinc/91/61/86/856916186.db2.gz ZORJIGDOQBFBMU-IBGZPJMESA-N 0 3 405.464 4.413 20 0 HIADHN O=C1C[C@H](N[C@@H]2CCCc3ncc(C(F)(F)F)cc32)CN1[C@@H]1C[C@H]1c1ccccc1 ZINC000427711169 856919300 /nfs/dbraw/zinc/91/93/00/856919300.db2.gz RSFLJLJUBAOZJS-ZCLUNYJNSA-N 0 3 415.459 4.224 20 0 HIADHN NC(=O)[C@H](Cc1ccccc1)NC[C@H](OCc1ccccc1)c1ccc(Cl)cc1 ZINC000427816344 856967264 /nfs/dbraw/zinc/96/72/64/856967264.db2.gz ICVXCKAAARSERE-GOTSBHOMSA-N 0 3 408.929 4.284 20 0 HIADHN Fc1cccc([C@@H](N[C@H]2CCn3ccnc3C2)c2cccc(Br)c2)c1 ZINC000427866093 856986636 /nfs/dbraw/zinc/98/66/36/856986636.db2.gz OZCROSYHZBQHAM-ICSRJNTNSA-N 0 3 400.295 4.479 20 0 HIADHN CCN1CCN(c2ccccc2N[C@H](C)c2ncc(Br)cc2F)CC1 ZINC000427875774 856990171 /nfs/dbraw/zinc/99/01/71/856990171.db2.gz UJUZCIVVAIGUMJ-CQSZACIVSA-N 0 3 407.331 4.298 20 0 HIADHN CO[C@H](C)c1nc(CN2CCCN(CCCOc3ccc(C)c(C)c3)CC2)cs1 ZINC000437509835 862859808 /nfs/dbraw/zinc/85/98/08/862859808.db2.gz XJQYMSZSVFKGGD-HXUWFJFHSA-N 0 3 417.619 4.444 20 0 HIADHN CC(C)(C)n1ncc(C(=O)NC[C@@]2(C)CCCN2Cc2ccccc2)c1C(F)(F)F ZINC000427979415 857030962 /nfs/dbraw/zinc/03/09/62/857030962.db2.gz ORYUEYHNNVALKL-OAQYLSRUSA-N 0 3 422.495 4.441 20 0 HIADHN CO[C@@H](C)c1nc(CN2CCCN(CCCOc3cccc(Cl)c3)CC2)cs1 ZINC000437522942 862865658 /nfs/dbraw/zinc/86/56/58/862865658.db2.gz BVVOUHYWZINLMJ-KRWDZBQOSA-N 0 3 424.010 4.481 20 0 HIADHN CO[C@H](C)c1nc(CN2CCCN(CCCOc3ccccc3C)CC2)cs1 ZINC000437523774 862866092 /nfs/dbraw/zinc/86/60/92/862866092.db2.gz ISXUUJDHUYUKEX-LJQANCHMSA-N 0 3 403.592 4.136 20 0 HIADHN CC(C)C[C@@H](NCCCc1c(Cl)cccc1Cl)c1nc(-c2nc[nH]n2)no1 ZINC000428268508 857134169 /nfs/dbraw/zinc/13/41/69/857134169.db2.gz MILQMKPSPYUTPO-OAHLLOKOSA-N 0 3 409.321 4.471 20 0 HIADHN CC1CCN(Cc2csc(NC(=O)CN[C@@H](c3cccs3)C3CC3)n2)CC1 ZINC000428291926 857143580 /nfs/dbraw/zinc/14/35/80/857143580.db2.gz VRKXMYGDOIBQDW-LJQANCHMSA-N 0 3 404.605 4.116 20 0 HIADHN CN(C)Cc1cccc(C(=O)Nc2cc(-c3cccc(C(F)(F)F)c3)nn2C)c1 ZINC000428299975 857145464 /nfs/dbraw/zinc/14/54/64/857145464.db2.gz XZPLEEURSQXFNQ-UHFFFAOYSA-N 0 3 402.420 4.420 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N2CCC(c3ncccc3Cl)CC2)C1 ZINC000428475718 857215632 /nfs/dbraw/zinc/21/56/32/857215632.db2.gz AJBCXBCLTITHCW-YLJYHZDGSA-N 0 3 412.965 4.460 20 0 HIADHN COc1c(C)cc(CN(C)[C@H](C)c2cccc(N3CCCS3(=O)=O)c2)cc1C ZINC000428477505 857218132 /nfs/dbraw/zinc/21/81/32/857218132.db2.gz UMUOPWMOCLTYAP-GOSISDBHSA-N 0 3 402.560 4.045 20 0 HIADHN c1csc(-c2nn(Cc3ccccc3)cc2CN2CCC(Cn3cncn3)CC2)c1 ZINC000428487383 857222755 /nfs/dbraw/zinc/22/27/55/857222755.db2.gz YMVRBULOSOONDP-UHFFFAOYSA-N 0 3 418.570 4.164 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)c1occc1CSc1ccccc1 ZINC000428526569 857241459 /nfs/dbraw/zinc/24/14/59/857241459.db2.gz SXPPVHCTIUDZKY-FQEVSTJZSA-N 0 3 408.523 4.391 20 0 HIADHN CCCn1c2ccccc2nc1CNC[C@@H](CO)Cc1ccc(Br)cc1 ZINC000428540656 857252451 /nfs/dbraw/zinc/25/24/51/857252451.db2.gz UXFPZEHGLGALJJ-KRWDZBQOSA-N 0 3 416.363 4.150 20 0 HIADHN OC[C@@H](CNCc1nc2ccc(F)cc2s1)Cc1cccc(Br)c1 ZINC000428548729 857257999 /nfs/dbraw/zinc/25/79/99/857257999.db2.gz OZLRVSUSEPVJPN-CYBMUJFWSA-N 0 3 409.324 4.139 20 0 HIADHN CC[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)Nc1cccc(CN2CC[C@@H](O)C2)c1 ZINC000428555201 857263872 /nfs/dbraw/zinc/26/38/72/857263872.db2.gz XKQLIBZHLLBFNM-GHTZIAJQSA-N 0 3 420.475 4.479 20 0 HIADHN Cc1ccc(OCCCC(=O)Nc2cccc(CN3CC[C@@H](O)C3)c2)c(Cl)c1 ZINC000428555848 857265463 /nfs/dbraw/zinc/26/54/63/857265463.db2.gz ZZRCODYBKMSUKT-LJQANCHMSA-N 0 3 402.922 4.013 20 0 HIADHN CCN(CC)C(=O)c1ccc(NC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)cc1 ZINC000437581180 862896909 /nfs/dbraw/zinc/89/69/09/862896909.db2.gz VMOFCLROGATGSY-FQEVSTJZSA-N 0 3 422.573 4.297 20 0 HIADHN O=C(CN(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1)Nc1ccccc1 ZINC000428787497 857338808 /nfs/dbraw/zinc/33/88/08/857338808.db2.gz UNJKYYFTEFHYIZ-VWLOTQADSA-N 0 3 414.553 4.187 20 0 HIADHN COC(=O)c1ccc(COc2ccccc2CN2CCC[C@H](c3nc(C)no3)C2)cc1 ZINC000437586092 862899430 /nfs/dbraw/zinc/89/94/30/862899430.db2.gz XDPCJVXTKXDPNV-NRFANRHFSA-N 0 3 421.497 4.123 20 0 HIADHN CC(C)(C)c1nc(CN(Cc2ccncc2)[C@@H]2CCCN(Cc3ccccc3)C2)no1 ZINC000428792364 857341910 /nfs/dbraw/zinc/34/19/10/857341910.db2.gz GXQBZSMMLALQAT-JOCHJYFZSA-N 0 3 419.573 4.429 20 0 HIADHN CC(C)Cc1noc(CN(Cc2ccncc2)[C@@H]2CCCN(Cc3ccccc3)C2)n1 ZINC000428803967 857350673 /nfs/dbraw/zinc/35/06/73/857350673.db2.gz SDQUMYQLIFUGCD-HSZRJFAPSA-N 0 3 419.573 4.330 20 0 HIADHN Cc1cccc(C)c1NC(=O)CN1CCN([C@@H]2CC[C@](C)(c3ccccc3)C2)CC1 ZINC000437590493 862902476 /nfs/dbraw/zinc/90/24/76/862902476.db2.gz MMKOIYOKNSZCRL-BVAGGSTKSA-N 0 3 405.586 4.370 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)NCc3cc4ccccc4s3)CC2)C[C@@H](C)O1 ZINC000428827612 857363326 /nfs/dbraw/zinc/36/33/26/857363326.db2.gz NOFUVJXINBGCDA-QZTJIDSGSA-N 0 3 415.603 4.322 20 0 HIADHN CCN(Cc1ccc(Cl)cc1)C(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000428993562 857447009 /nfs/dbraw/zinc/44/70/09/857447009.db2.gz DGSZAUYYDLYYBE-JOCHJYFZSA-N 0 3 415.965 4.163 20 0 HIADHN Cc1ccc([C@@H]2CCCN2C(=O)NC[C@H]2CN(Cc3ccccc3)CCCO2)s1 ZINC000429020287 857460796 /nfs/dbraw/zinc/46/07/96/857460796.db2.gz LEMNPHHRMVYKPW-SFTDATJTSA-N 0 3 413.587 4.194 20 0 HIADHN CSc1ccc(OCCN[C@@H](CO)c2ccc(Br)c(F)c2)cc1 ZINC000429038003 857468642 /nfs/dbraw/zinc/46/86/42/857468642.db2.gz VQSXLLWCFINMEP-KRWDZBQOSA-N 0 3 400.313 4.012 20 0 HIADHN Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1NC(=O)N(C)CCN(C)C ZINC000429041916 857471424 /nfs/dbraw/zinc/47/14/24/857471424.db2.gz CDMYYRUTMPSHEC-UHFFFAOYSA-N 0 3 422.451 4.291 20 0 HIADHN CCCOc1ccccc1NC(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000429054406 857480291 /nfs/dbraw/zinc/48/02/91/857480291.db2.gz PMKXKXWZPXHOIQ-RTBURBONSA-N 0 3 403.567 4.219 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)N(C[C@@H]1CCCO1)C1CCCC1 ZINC000429066774 857490627 /nfs/dbraw/zinc/49/06/27/857490627.db2.gz WBHQAGRVHGRTLC-QFIPXVFZSA-N 0 3 417.619 4.233 20 0 HIADHN C[C@H](NC(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1)c1ccc(Cl)cc1 ZINC000429218899 857560528 /nfs/dbraw/zinc/56/05/28/857560528.db2.gz ZWWPQRJZRVLXOV-KURKYZTESA-N 0 3 407.986 4.322 20 0 HIADHN CSc1cccc(N(C(=O)COc2cc(C)ccc2F)C2CCN(C)CC2)c1 ZINC000429284007 857590508 /nfs/dbraw/zinc/59/05/08/857590508.db2.gz KZAWEQXSTRTTKH-UHFFFAOYSA-N 0 3 402.535 4.362 20 0 HIADHN CN(C)S(=O)(=O)c1ccc(CN[C@@H](Cc2ccccc2F)c2ccccc2)cc1 ZINC000429416587 857654271 /nfs/dbraw/zinc/65/42/71/857654271.db2.gz IUFYMXVPIRKOFH-QHCPKHFHSA-N 0 3 412.530 4.150 20 0 HIADHN CN(C(=O)NC[C@@H](c1ccccc1)C(C)(C)CO)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000437621053 862937979 /nfs/dbraw/zinc/93/79/79/862937979.db2.gz CLRYFJPCJFXKKE-RPWUZVMVSA-N 0 3 423.601 4.095 20 0 HIADHN CC(C)c1ccc(NC(=O)C[C@H](C)NCc2ccc(S(C)(=O)=O)c(Cl)c2)cc1 ZINC000429459238 857682828 /nfs/dbraw/zinc/68/28/28/857682828.db2.gz VQVPYQOMWPDMJU-HNNXBMFYSA-N 0 3 422.978 4.374 20 0 HIADHN CC(C)(C)[C@H](CN1CCc2ccccc2C1)NC(=O)N1CCC[C@H]1c1ccncc1 ZINC000429492719 857694928 /nfs/dbraw/zinc/69/49/28/857694928.db2.gz QLPWDHQRRNPXNC-GOTSBHOMSA-N 0 3 406.574 4.401 20 0 HIADHN Cc1cc([C@H]2CCCN2C(=O)N[C@@H](CN2CCc3ccccc3C2)C(C)(C)C)on1 ZINC000429502493 857701614 /nfs/dbraw/zinc/70/16/14/857701614.db2.gz JXLGSAOXRLMDEY-IRLDBZIGSA-N 0 3 410.562 4.303 20 0 HIADHN Cc1cnn([C@@H]2CCCN(C(=O)N[C@@H](CN3CCc4ccccc4C3)C(C)(C)C)C2)c1 ZINC000429504863 857702144 /nfs/dbraw/zinc/70/21/44/857702144.db2.gz RNRGWDLZTUNKIR-PKTZIBPZSA-N 0 3 423.605 4.011 20 0 HIADHN Cc1ccc([C@H](C)CNC(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)cc1 ZINC000429504239 857702627 /nfs/dbraw/zinc/70/26/27/857702627.db2.gz PDVNAIXLSQPBAR-HKBOAZHASA-N 0 3 401.595 4.019 20 0 HIADHN CC(C)CN(CCN(C)C)C(=O)Nc1ccnn1Cc1ccc(C(F)(F)F)cc1 ZINC000429512614 857707699 /nfs/dbraw/zinc/70/76/99/857707699.db2.gz SFOPQRCBSGPRCL-UHFFFAOYSA-N 0 3 411.472 4.002 20 0 HIADHN COc1ccc([C@H](N[C@H](C)CC2(OC)CCC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000429517281 857711791 /nfs/dbraw/zinc/71/17/91/857711791.db2.gz NBOWYELVIPSWFF-VGSWGCGISA-N 0 3 417.571 4.125 20 0 HIADHN COc1ccc([C@@H](N[C@@H](C)CC2(OC)CCC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000429517276 857711823 /nfs/dbraw/zinc/71/18/23/857711823.db2.gz NBOWYELVIPSWFF-HTAPYJJXSA-N 0 3 417.571 4.125 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)NC[C@H](c2ccccc2)C(C)(C)CO)CC1 ZINC000437623570 862942285 /nfs/dbraw/zinc/94/22/85/862942285.db2.gz VRVOHSNIYQCUIX-XMMPIXPASA-N 0 3 423.601 4.095 20 0 HIADHN CO[C@@H]1CCCC[C@H]1NCC(=O)N1N=C(c2cccs2)C[C@@H]1c1cccs1 ZINC000429530450 857723555 /nfs/dbraw/zinc/72/35/55/857723555.db2.gz SPKKDDPYYOHUFP-DJIMGWMZSA-N 0 3 403.573 4.035 20 0 HIADHN CN(CCCNC(=O)C1CCC1)Cc1c(-c2ccc(Cl)cc2)nc2sccn12 ZINC000429547812 857739377 /nfs/dbraw/zinc/73/93/77/857739377.db2.gz KZZPBQLXUFVITQ-UHFFFAOYSA-N 0 3 416.978 4.454 20 0 HIADHN CN(C(=O)c1ccccc1COC1CCOCC1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000429605309 857787169 /nfs/dbraw/zinc/78/71/69/857787169.db2.gz PVINSSHQLSGQCX-HSZRJFAPSA-N 0 3 422.569 4.119 20 0 HIADHN Cc1ccc(-c2ncco2)cc1NC(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000429611930 857793176 /nfs/dbraw/zinc/79/31/76/857793176.db2.gz PPKOSNZEXDDAMT-NRFANRHFSA-N 0 3 420.513 4.063 20 0 HIADHN CC(C)n1cc2cc(NC(=O)NC[C@H]3CN(Cc4ccccc4)CCCO3)ccc2n1 ZINC000429747139 857866978 /nfs/dbraw/zinc/86/69/78/857866978.db2.gz JMXXLZGQPLWITD-QFIPXVFZSA-N 0 3 421.545 4.030 20 0 HIADHN Cc1ccc(C(F)(F)F)cc1NC(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000429748243 857868161 /nfs/dbraw/zinc/86/81/61/857868161.db2.gz AIMJZQMOYQWHOH-IBGZPJMESA-N 0 3 421.463 4.426 20 0 HIADHN O=C(NC[C@H]1CN(Cc2ccccc2)CCCO1)Nc1cc(-c2ccccc2)ns1 ZINC000429760026 857875153 /nfs/dbraw/zinc/87/51/53/857875153.db2.gz VYCVXSNOOUEQLW-FQEVSTJZSA-N 0 3 422.554 4.223 20 0 HIADHN CCO[C@@H]1C[C@H](NCC(=O)Nc2cc3c(cc2Cl)OCCCO3)C12CCCCC2 ZINC000429794660 857887436 /nfs/dbraw/zinc/88/74/36/857887436.db2.gz XPEPOIQTCLJEGN-VQTJNVASSA-N 0 3 422.953 4.157 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)c1c[nH]c(C(F)(F)F)c1 ZINC000429810041 857892790 /nfs/dbraw/zinc/89/27/90/857892790.db2.gz KPVSEZNJDWLNAE-UHFFFAOYSA-N 0 3 407.358 4.256 20 0 HIADHN Cc1nn(C(C)C)c(C)c1CC(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1 ZINC000429810529 857892876 /nfs/dbraw/zinc/89/28/76/857892876.db2.gz MCWFGHGNBGDLOF-UHFFFAOYSA-N 0 3 424.511 4.233 20 0 HIADHN CC(F)(F)c1ccc(C(=O)NCCCCN2CCN(c3ccccc3)CC2)cc1 ZINC000429899336 857935317 /nfs/dbraw/zinc/93/53/17/857935317.db2.gz CJBONHNPHCOTFV-UHFFFAOYSA-N 0 3 401.501 4.131 20 0 HIADHN CC(C)Cc1ccc([C@H](C)C(=O)NCc2ccccc2CN2CCC(O)CC2)cc1 ZINC000429912044 857942551 /nfs/dbraw/zinc/94/25/51/857942551.db2.gz VKOWHILNJBFGLX-FQEVSTJZSA-N 0 3 408.586 4.262 20 0 HIADHN O=C(Nc1cccc(-c2ncc3n2CCCC3)c1)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000429965315 857974231 /nfs/dbraw/zinc/97/42/31/857974231.db2.gz SSEOZGSVJPPWSH-JOCHJYFZSA-N 0 3 415.541 4.282 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)Nc1ccc(C(C)(C)C(F)(F)F)cc1 ZINC000429975062 857978020 /nfs/dbraw/zinc/97/80/20/857978020.db2.gz PTDBBLHKKUERSZ-UHFFFAOYSA-N 0 3 421.463 4.474 20 0 HIADHN Cc1ccccc1-c1nnc(SC[C@@H]2CN(Cc3ccccc3)CCCO2)n1C ZINC000430096187 858029285 /nfs/dbraw/zinc/02/92/85/858029285.db2.gz FYUMLMSSTYVGOR-FQEVSTJZSA-N 0 3 408.571 4.174 20 0 HIADHN Cn1c(SC[C@@H]2CN(Cc3ccccc3)CCCO2)nnc1-c1ccccc1F ZINC000430117115 858039133 /nfs/dbraw/zinc/03/91/33/858039133.db2.gz BWLRPDQDQXCAGF-SFHVURJKSA-N 0 3 412.534 4.004 20 0 HIADHN Cn1c(SC[C@H]2CN(Cc3ccccc3)CCCO2)nnc1-c1ccccc1F ZINC000430117111 858039403 /nfs/dbraw/zinc/03/94/03/858039403.db2.gz BWLRPDQDQXCAGF-GOSISDBHSA-N 0 3 412.534 4.004 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N[C@H]2C[C@@H]2c2ccccc2OC(F)F)C1 ZINC000437648573 862981077 /nfs/dbraw/zinc/98/10/77/862981077.db2.gz VPBLOTLDNPAJEN-VUBSUSDNSA-N 0 3 415.484 4.279 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N[C@@H]2C[C@H]2c2cc(F)c(F)c(F)c2)C1 ZINC000437648952 862981535 /nfs/dbraw/zinc/98/15/35/862981535.db2.gz WFHVYAXSJHGCDN-PJKMLTEKSA-N 0 3 403.448 4.095 20 0 HIADHN O=C(N[C@@H](CC1CC1)c1cc(F)cc(Br)c1)N1CC[C@H](N2CC=CC2)C1 ZINC000430291301 858110705 /nfs/dbraw/zinc/11/07/05/858110705.db2.gz GEKVSELDMPESFM-OALUTQOASA-N 0 3 422.342 4.085 20 0 HIADHN O[C@H](Cc1ccc(C(F)(F)F)cc1)CN(CCc1ccccn1)Cc1cccnc1 ZINC000430331840 858124469 /nfs/dbraw/zinc/12/44/69/858124469.db2.gz OLNUNDPGGIUXOP-JOCHJYFZSA-N 0 3 415.459 4.144 20 0 HIADHN Brc1ccc(OCCN(CCc2ccccn2)Cc2cccnc2)cc1 ZINC000430348077 858129171 /nfs/dbraw/zinc/12/91/71/858129171.db2.gz RJCXHRZSPBXKAE-UHFFFAOYSA-N 0 3 412.331 4.363 20 0 HIADHN CN(C)CCN(C(=O)c1cn(-c2ccc(Cl)c(Cl)c2)cn1)c1ccccc1 ZINC000430416272 858151001 /nfs/dbraw/zinc/15/10/01/858151001.db2.gz ROFUJTOWHICBAK-UHFFFAOYSA-N 0 3 403.313 4.388 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)N[C@H]1C[C@@H]1c1ccccc1OC(F)F ZINC000437658089 862997036 /nfs/dbraw/zinc/99/70/36/862997036.db2.gz MXVYKJFWQSNXGT-HSALFYBXSA-N 0 3 415.484 4.280 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)N[C@H]1C[C@@H]1c1ccccc1OC(F)F ZINC000437658086 862998102 /nfs/dbraw/zinc/99/81/02/862998102.db2.gz MXVYKJFWQSNXGT-AABGKKOBSA-N 0 3 415.484 4.280 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)c3ccc(OC(C)(C)C)cc3)CC2)C[C@H](C)O1 ZINC000430692916 858271106 /nfs/dbraw/zinc/27/11/06/858271106.db2.gz XHPFPVWLWAXYPF-OALUTQOASA-N 0 3 402.579 4.215 20 0 HIADHN Cc1cccc(C)c1[C@@H](C)N[C@@H](C)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000430737361 858281515 /nfs/dbraw/zinc/28/15/15/858281515.db2.gz WRTLBJAJMHZXSE-UONOGXRCSA-N 0 3 411.365 4.125 20 0 HIADHN C[C@@H]1C[C@@]2(CCO1)CN(Cc1ccc(-n3ccc(C(F)(F)F)n3)cc1)C[C@H](C)O2 ZINC000430766179 858295772 /nfs/dbraw/zinc/29/57/72/858295772.db2.gz KQFBXWHEXORBMZ-GUXCAODWSA-N 0 3 409.452 4.050 20 0 HIADHN CCN(CC)[C@H](CN1C(=O)[C@H](Cc2ccccc2)N(C2CC2)C1=O)c1ccsc1 ZINC000430874465 858349801 /nfs/dbraw/zinc/34/98/01/858349801.db2.gz DEASDQQIZGJAJF-LEWJYISDSA-N 0 3 411.571 4.169 20 0 HIADHN CN(C)[C@@H](CN1C(=O)[C@H](c2ccc(Cl)c(Cl)c2)N(C)C1=O)c1ccccc1 ZINC000430970612 858386059 /nfs/dbraw/zinc/38/60/59/858386059.db2.gz HVFACJBMMGSJLP-ROUUACIJSA-N 0 3 406.313 4.231 20 0 HIADHN CN(C)[C@@H](CN1C(=O)[C@@H](c2ccc(Cl)c(Cl)c2)N(C)C1=O)c1ccccc1 ZINC000430970614 858386362 /nfs/dbraw/zinc/38/63/62/858386362.db2.gz HVFACJBMMGSJLP-ZWKOTPCHSA-N 0 3 406.313 4.231 20 0 HIADHN O=C1N[C@@H](c2ccc3ccccc3c2)C(=O)N1C[C@H](c1cccs1)N1CCCC1 ZINC000430971897 858386715 /nfs/dbraw/zinc/38/67/15/858386715.db2.gz NFMXAIYLJPQNLN-CTNGQTDRSA-N 0 3 405.523 4.331 20 0 HIADHN O=C1N[C@@H](C[C@H]2CCCc3ccccc32)C(=O)N1C1CCN(Cc2ccccc2)CC1 ZINC000430980424 858390402 /nfs/dbraw/zinc/39/04/02/858390402.db2.gz DWGFYIXZYIWOBX-QPPBQGQZSA-N 0 3 417.553 4.082 20 0 HIADHN O=C1N[C@H](C[C@H]2CCCc3ccccc32)C(=O)N1C1CCN(Cc2ccccc2)CC1 ZINC000430980429 858390416 /nfs/dbraw/zinc/39/04/16/858390416.db2.gz DWGFYIXZYIWOBX-ZJSXRUAMSA-N 0 3 417.553 4.082 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)CCN1CCC[C@@H]1CC(=O)c1cccs1 ZINC000430996877 858398125 /nfs/dbraw/zinc/39/81/25/858398125.db2.gz SDOIKWOUNGGDQB-OAHLLOKOSA-N 0 3 406.935 4.476 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](N2C(=O)N[C@H](Cc3cccc4ccccc43)C2=O)C1 ZINC000431042453 858415121 /nfs/dbraw/zinc/41/51/21/858415121.db2.gz HSMYFEWCEGRKQR-RVSNTGDXSA-N 0 3 413.521 4.138 20 0 HIADHN CC[NH+](CC)C[C@@H]1CCCC[C@@H]1NC(=O)Nc1ccc(-c2cc(=O)[n-]c(C)n2)cc1 ZINC000431078530 858437054 /nfs/dbraw/zinc/43/70/54/858437054.db2.gz UKDMIMYXOSQFHI-ICSRJNTNSA-N 0 3 411.550 4.180 20 0 HIADHN C[C@H]1CCN(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)CCN1Cc1ccccc1 ZINC000437685863 863024343 /nfs/dbraw/zinc/02/43/43/863024343.db2.gz ICLCKOOFYGWKNM-FQEVSTJZSA-N 0 3 420.557 4.051 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)Nc3ccc4nc(C5CC5)oc4c3)CC2)C[C@H](C)O1 ZINC000431154410 858474135 /nfs/dbraw/zinc/47/41/35/858474135.db2.gz VNHWISATLAHCSW-HOTGVXAUSA-N 0 3 412.534 4.058 20 0 HIADHN O=C1N[C@@H](c2ccc(Cl)c(F)c2)C(=O)N1C[C@H]1CCCN(Cc2cccs2)C1 ZINC000431169648 858483945 /nfs/dbraw/zinc/48/39/45/858483945.db2.gz MWAYWTFKTVYOBB-UGSOOPFHSA-N 0 3 421.925 4.046 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)c3c(Cl)cc(F)cc3Cl)CC2)C[C@H](C)O1 ZINC000431621031 858693733 /nfs/dbraw/zinc/69/37/33/858693733.db2.gz BENUBFVUBPEQCC-STQMWFEESA-N 0 3 403.325 4.094 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N[C@H](c3ccccc3)C(F)F)c(C)c2)CC1 ZINC000431702504 858751250 /nfs/dbraw/zinc/75/12/50/858751250.db2.gz NELBTXMWSMZJCK-HXUWFJFHSA-N 0 3 402.489 4.265 20 0 HIADHN O=C(Nc1ccc(OCc2noc(C3CC3)n2)cc1)[C@@H]1CCCCN1C1CCCC1 ZINC000431782478 858809049 /nfs/dbraw/zinc/80/90/49/858809049.db2.gz DULXSAWSNWVEOE-FQEVSTJZSA-N 0 3 410.518 4.262 20 0 HIADHN FC(F)(F)CCN1CCC(Nc2ccc(Cc3nnc4n3CCCCC4)cc2)CC1 ZINC000467529301 881348882 /nfs/dbraw/zinc/34/88/82/881348882.db2.gz MHWWKBKAZBPGDW-UHFFFAOYSA-N 0 3 421.511 4.424 20 0 HIADHN CC(C)(CNC(=O)C1(Cc2ccc(F)cc2)CCOCC1)N1CCc2ccccc2C1 ZINC000431892560 858859458 /nfs/dbraw/zinc/85/94/58/858859458.db2.gz VNWNRPLYCCDVBJ-UHFFFAOYSA-N 0 3 424.560 4.118 20 0 HIADHN O=C(CCN1CCN(c2ccccc2)CC1)N1CCCC[C@@H]1c1cc2ccccc2[nH]1 ZINC000467553145 881374456 /nfs/dbraw/zinc/37/44/56/881374456.db2.gz HMPISRIUAFBZKD-RUZDIDTESA-N 0 3 416.569 4.434 20 0 HIADHN CC1CCN([C@H](CNC(=O)NCCC[C@H]2CCCC[C@@H]2O)c2cccs2)CC1 ZINC000432555676 859225369 /nfs/dbraw/zinc/22/53/69/859225369.db2.gz NFKJEYKPWRVQMC-AQNXPRMDSA-N 0 3 407.624 4.152 20 0 HIADHN C[C@@H]1CN(C(=O)Nc2ccc(CCN3CCSCC3)cc2)Cc2ccccc2O1 ZINC000432765610 859345433 /nfs/dbraw/zinc/34/54/33/859345433.db2.gz CELDDZNPHBZWHI-GOSISDBHSA-N 0 3 411.571 4.093 20 0 HIADHN Brc1ccccc1-c1noc([C@@H]2CCCN2CCC2CCOCC2)n1 ZINC000432790653 859360837 /nfs/dbraw/zinc/36/08/37/859360837.db2.gz DBHYQVQGNMYOMG-KRWDZBQOSA-N 0 3 406.324 4.453 20 0 HIADHN CCN(CCC(=O)Nc1ccc(C(N)=O)c(Cl)c1)Cc1ccc(Cl)s1 ZINC000432965196 859453049 /nfs/dbraw/zinc/45/30/49/859453049.db2.gz FDDWIUMLHCZDBF-UHFFFAOYSA-N 0 3 400.331 4.005 20 0 HIADHN Cc1ccc(-c2ccc(C)c(NC(=O)N3CC[C@H](N4CCN(C)CC4)[C@@H](C)C3)c2)o1 ZINC000432992951 859468241 /nfs/dbraw/zinc/46/82/41/859468241.db2.gz KXDGCBFOAWQTDR-AVRDEDQJSA-N 0 3 410.562 4.053 20 0 HIADHN CC(=O)Nc1cccc(NC(=O)[C@@H](SCCN(C)Cc2ccccc2)C(C)C)c1 ZINC000433021475 859483657 /nfs/dbraw/zinc/48/36/57/859483657.db2.gz XGJPEBXUZUDUOS-QFIPXVFZSA-N 0 3 413.587 4.473 20 0 HIADHN CCOc1cc(CN2CC[C@H](c3ccc(CC)cc3)C2)nc2nc(C(F)(F)F)nn21 ZINC000433077957 859513288 /nfs/dbraw/zinc/51/32/88/859513288.db2.gz UDIKXLRMIJAQPN-INIZCTEOSA-N 0 3 419.451 4.094 20 0 HIADHN Cc1ccc(C(=O)CCCC(=O)Nc2cccc(CN3CCC(CO)CC3)c2)cc1 ZINC000467632727 881430670 /nfs/dbraw/zinc/43/06/70/881430670.db2.gz JFPLNDKBNNGFKT-UHFFFAOYSA-N 0 3 408.542 4.191 20 0 HIADHN CCn1cccc(CN[C@H](C)CC(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)c1=O ZINC000433096500 859519778 /nfs/dbraw/zinc/51/97/78/859519778.db2.gz IJPXEHFCKDKPQL-GFCCVEGCSA-N 0 3 415.843 4.047 20 0 HIADHN Cc1cnc(C2CCN(C[C@@H](O)COc3ccc(Cl)cc3Cl)CC2)s1 ZINC000433174745 859554051 /nfs/dbraw/zinc/55/40/51/859554051.db2.gz KFDBEDZJMQIWAZ-OAHLLOKOSA-N 0 3 401.359 4.378 20 0 HIADHN CC(C)(C)c1nnc(CN(Cc2ccncc2)[C@H]2CCCN(Cc3ccccc3)C2)[nH]1 ZINC000433207072 859566967 /nfs/dbraw/zinc/56/69/67/859566967.db2.gz PQUSBSQIRCFACW-QFIPXVFZSA-N 0 3 418.589 4.164 20 0 HIADHN NC(=O)c1ccc(NC(=O)CCN2CCC[C@@H]2c2ccc(Cl)cc2)cc1Cl ZINC000433297679 859624354 /nfs/dbraw/zinc/62/43/54/859624354.db2.gz WYEVULOQBBSVCI-GOSISDBHSA-N 0 3 406.313 4.258 20 0 HIADHN OCC1([C@@H](NCc2ccc(I)cc2)c2ccccc2)CCC1 ZINC000433301973 859626096 /nfs/dbraw/zinc/62/60/96/859626096.db2.gz WPEHGGAPOYGSBD-SFHVURJKSA-N 0 3 407.295 4.285 20 0 HIADHN CCc1nc(CN2CCC(CNCc3ncc(C(F)(F)F)s3)CC2)cs1 ZINC000433328415 859645331 /nfs/dbraw/zinc/64/53/31/859645331.db2.gz SCYHLHYHDJCQCW-UHFFFAOYSA-N 0 3 404.527 4.183 20 0 HIADHN Cc1cc(C)cc(CN(C)C(=O)NCCCCN2CCN(c3ccccc3)CC2)c1 ZINC000433566195 859782539 /nfs/dbraw/zinc/78/25/39/859782539.db2.gz YTNLZERYNIUZEX-UHFFFAOYSA-N 0 3 408.590 4.047 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N[C@@H](c2cc(F)ccc2F)C(F)F)C1 ZINC000433628208 859816469 /nfs/dbraw/zinc/81/64/69/859816469.db2.gz JIDRDSWPVKHZQU-NRXGSXMXSA-N 0 3 409.427 4.406 20 0 HIADHN COc1cc(NC(=O)NCCCCN2CCN(c3ccccc3)CC2)ccc1Cl ZINC000433633472 859818395 /nfs/dbraw/zinc/81/83/95/859818395.db2.gz MFCPEQLQZKCVQU-UHFFFAOYSA-N 0 3 416.953 4.073 20 0 HIADHN Cc1nc2ccc(NC(=O)NCCCCN3CCN(c4cccc(C)c4)CC3)cc2o1 ZINC000503232157 912212677 /nfs/dbraw/zinc/21/26/77/912212677.db2.gz NTADHZLBBIYPHM-UHFFFAOYSA-N 0 3 421.545 4.169 20 0 HIADHN CCNC(=O)Nc1cccc(NC(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)c1C ZINC000433741303 859869045 /nfs/dbraw/zinc/86/90/45/859869045.db2.gz HGYRRDDTDTZINX-JOCHJYFZSA-N 0 3 423.561 4.403 20 0 HIADHN Cc1c(Br)ccc(NC(=O)N(CCN(C)C)Cc2ccccc2)c1F ZINC000433761962 859881524 /nfs/dbraw/zinc/88/15/24/859881524.db2.gz IOLGIPPWXQCLLV-UHFFFAOYSA-N 0 3 408.315 4.492 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)Nc1ccc(F)cc1-c1cnn(C)c1 ZINC000433814965 859908550 /nfs/dbraw/zinc/90/85/50/859908550.db2.gz YQOJITJVTSQFHM-UHFFFAOYSA-N 0 3 423.536 4.255 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)N[C@@H](c2cccc(Cl)c2)C2CCCC2)CC1 ZINC000433814959 859908782 /nfs/dbraw/zinc/90/87/82/859908782.db2.gz YPNUFWMFVLTVSI-PGRDOPGGSA-N 0 3 421.029 4.144 20 0 HIADHN O=C(Cc1cc(Br)ccc1F)NC[C@@H](c1cccs1)N1CCCC1 ZINC000433869636 859943343 /nfs/dbraw/zinc/94/33/43/859943343.db2.gz SVZNYBRWXBYVKC-INIZCTEOSA-N 0 3 411.340 4.146 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1ccc(-c2nc(C3CC3)no2)cc1)c1ccsc1 ZINC000433950674 859998213 /nfs/dbraw/zinc/99/82/13/859998213.db2.gz PHCLGPOPSKRTRC-LJQANCHMSA-N 0 3 410.543 4.488 20 0 HIADHN C[C@H]1C[C@H](NC(=O)Cc2csc(Cc3ccccc3)n2)CN1Cc1ccccc1 ZINC000467699208 881493819 /nfs/dbraw/zinc/49/38/19/881493819.db2.gz DFYTXHPSQJLSFH-RXVVDRJESA-N 0 3 405.567 4.056 20 0 HIADHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@H](C)Sc1ccnc2cc(Cl)ccc21 ZINC000434035651 860054747 /nfs/dbraw/zinc/05/47/47/860054747.db2.gz IWOCMXWIUYNVAH-UAGQMJEPSA-N 0 3 403.979 4.454 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1cnn(Cc2ccccc2)c1 ZINC000467701821 881497624 /nfs/dbraw/zinc/49/76/24/881497624.db2.gz ZBDWFJWNTGXJIF-FQEVSTJZSA-N 0 3 403.530 4.060 20 0 HIADHN CN(Cc1cc(F)cc(F)c1)C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000434142690 860140242 /nfs/dbraw/zinc/14/02/42/860140242.db2.gz DQOISAUXBQNZMR-UHFFFAOYSA-N 0 3 405.514 4.220 20 0 HIADHN CC(C)[C@@H](CNC(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1)c1cccnc1 ZINC000434169261 860163918 /nfs/dbraw/zinc/16/39/18/860163918.db2.gz HOFAWHOJYJUKQK-IRLDBZIGSA-N 0 3 419.491 4.392 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)Nc1cc(C(F)(F)F)ccn1 ZINC000434206966 860193479 /nfs/dbraw/zinc/19/34/79/860193479.db2.gz RGEAETYAUSHYPE-UHFFFAOYSA-N 0 3 400.832 4.350 20 0 HIADHN C[C@H]1CN(C2CC2)C[C@H]1NC(=O)c1cn(C(C)(C)C)nc1-c1ccccc1Cl ZINC000467713366 881511408 /nfs/dbraw/zinc/51/14/08/881511408.db2.gz MCORDZMZAIXYEE-IFXJQAMLSA-N 0 3 400.954 4.171 20 0 HIADHN COc1ccc(C(=O)CCC(=O)NCc2ccccc2CN2CCCCC2)cc1F ZINC000434222096 860206829 /nfs/dbraw/zinc/20/68/29/860206829.db2.gz FDUTZLJFERJVDS-UHFFFAOYSA-N 0 3 412.505 4.100 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)Nc2cc(Cl)ccc2-c2ccc(C)o2)CC1 ZINC000434221993 860207126 /nfs/dbraw/zinc/20/71/26/860207126.db2.gz DEYJEOJNCAQVSE-INIZCTEOSA-N 0 3 418.969 4.304 20 0 HIADHN Cc1ccccc1-c1nn(-c2ccccc2)cc1C(=O)N[C@H]1CN(C2CC2)C[C@@H]1C ZINC000467718890 881517038 /nfs/dbraw/zinc/51/70/38/881517038.db2.gz VDKCUHFIJAAVKO-MBSDFSHPSA-N 0 3 400.526 4.060 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)C[C@H](C)c1cccnc1 ZINC000434315597 860276098 /nfs/dbraw/zinc/27/60/98/860276098.db2.gz CZWDPKXJNGTMAB-AVRDEDQJSA-N 0 3 403.530 4.166 20 0 HIADHN CC(=O)c1ccc(CC(=O)Nc2c(C)cnn2[C@@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000434317005 860277408 /nfs/dbraw/zinc/27/74/08/860277408.db2.gz JWMXNTLHKYPAGB-HSZRJFAPSA-N 0 3 416.525 4.022 20 0 HIADHN CC(=O)c1c(C)[nH]c(C(=O)Nc2c(C)cnn2[C@H]2CCN(Cc3ccccc3)C2)c1C ZINC000434316971 860277483 /nfs/dbraw/zinc/27/74/83/860277483.db2.gz OIAZVURDTZHDSK-FQEVSTJZSA-N 0 3 419.529 4.038 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)CO[C@H]1CCCC[C@H]1C ZINC000434319565 860279845 /nfs/dbraw/zinc/27/98/45/860279845.db2.gz YLDOSWGLGXMQIC-QIJUGHKUSA-N 0 3 410.562 4.172 20 0 HIADHN CCOc1ccc(CC(=O)Nc2c(C)cnn2[C@@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000434322155 860282581 /nfs/dbraw/zinc/28/25/81/860282581.db2.gz BHLJZJLFPHUMOE-JOCHJYFZSA-N 0 3 418.541 4.218 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)Cc1ccc(F)c(F)c1 ZINC000434323828 860285235 /nfs/dbraw/zinc/28/52/35/860285235.db2.gz BKVYZDQHPNUBSW-IBGZPJMESA-N 0 3 410.468 4.098 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)C1=Cc2ccccc2OC1 ZINC000434324004 860285261 /nfs/dbraw/zinc/28/52/61/860285261.db2.gz CLHFUIZVIAZCAM-JOCHJYFZSA-N 0 3 414.509 4.053 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)COc1cc(C)ccc1F ZINC000434336138 860297754 /nfs/dbraw/zinc/29/77/54/860297754.db2.gz YLNAUPMRXXGWIT-HXUWFJFHSA-N 0 3 422.504 4.104 20 0 HIADHN COc1cc(C(=O)NC[C@@H]2CCCCN2C2CC2)cc(OC)c1OCc1ccccc1 ZINC000434423615 860343808 /nfs/dbraw/zinc/34/38/08/860343808.db2.gz FRVUSGKPDDNQLZ-NRFANRHFSA-N 0 3 424.541 4.030 20 0 HIADHN O=C(Nc1cc(C(=O)NC[C@H]2CCCCN2C2CC2)ccc1Cl)c1cccs1 ZINC000434425550 860343831 /nfs/dbraw/zinc/34/38/31/860343831.db2.gz PIXJTVWJAJQRJS-MRXNPFEDSA-N 0 3 417.962 4.401 20 0 HIADHN O=C(NCc1csc(CCc2ccccc2)n1)c1cccc(CN2CCCC2)c1 ZINC000434563521 860403005 /nfs/dbraw/zinc/40/30/05/860403005.db2.gz CUCHONREAPMLMC-UHFFFAOYSA-N 0 3 405.567 4.454 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)CCN1CCC(C(=O)c2ccc(F)cc2)CC1 ZINC000434676657 860455112 /nfs/dbraw/zinc/45/51/12/860455112.db2.gz SAPBCDZGLMBGBL-UHFFFAOYSA-N 0 3 418.896 4.411 20 0 HIADHN C[C@H](C(=O)N1c2ccccc2CC[C@@H]1C)N1CCC(c2ncc3n2CCCC3)CC1 ZINC000434686908 860460841 /nfs/dbraw/zinc/46/08/41/860460841.db2.gz BKJGUVYQYSOQAB-RBUKOAKNSA-N 0 3 406.574 4.155 20 0 HIADHN Cc1onc(-c2c(F)cccc2Cl)c1C(=O)NCCCCN1C[C@@H](C)O[C@@H](C)C1 ZINC000434789421 860494867 /nfs/dbraw/zinc/49/48/67/860494867.db2.gz MPEKKJXYYLBFPY-OKILXGFUSA-N 0 3 423.916 4.062 20 0 HIADHN O[C@H](COCc1ccccc1F)CN1CCC[C@H](c2nc(C(F)(F)F)cs2)C1 ZINC000434885626 860535978 /nfs/dbraw/zinc/53/59/78/860535978.db2.gz IWRYTLLZAOBKOR-ZFWWWQNUSA-N 0 3 418.456 4.058 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)Nc2cc(OC)c(OC)c(C)c2OC)N(C)C)cc1 ZINC000434892676 860539399 /nfs/dbraw/zinc/53/93/99/860539399.db2.gz ULHAJCZMJBLUEB-LJQANCHMSA-N 0 3 415.534 4.008 20 0 HIADHN COc1cc(NC(=O)NCCCCN2CCN(Cc3ccccc3)CC2)c(C)cc1C ZINC000434903508 860547810 /nfs/dbraw/zinc/54/78/10/860547810.db2.gz LXSUAPOWQYUDGV-UHFFFAOYSA-N 0 3 424.589 4.032 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)CCc2nnc(-c3ccc(Cl)cc3)o2)CN1Cc1ccccc1 ZINC000467750834 881556695 /nfs/dbraw/zinc/55/66/95/881556695.db2.gz CCWRVLBZKKCXSQ-OXJNMPFZSA-N 0 3 424.932 4.102 20 0 HIADHN CC(=O)NC[C@@H]1CCCN(Cc2ccc(OCc3c(F)cccc3Cl)cc2)C1 ZINC000434979480 860583864 /nfs/dbraw/zinc/58/38/64/860583864.db2.gz UACRUJKENZKAJR-SFHVURJKSA-N 0 3 404.913 4.406 20 0 HIADHN CCn1nccc1C1CCN(CC2=Cc3cc(Br)ccc3OC2)CC1 ZINC000435040641 860611159 /nfs/dbraw/zinc/61/11/59/860611159.db2.gz FVTHWJVWUMTOCM-UHFFFAOYSA-N 0 3 402.336 4.321 20 0 HIADHN CN(C)C(=O)Nc1ccc(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)c(Cl)c1 ZINC000435050714 860615992 /nfs/dbraw/zinc/61/59/92/860615992.db2.gz MPFQAZPIUWBAKP-FQEVSTJZSA-N 0 3 414.937 4.000 20 0 HIADHN COc1cc(CCC(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)ccc1Cl ZINC000435085999 860635257 /nfs/dbraw/zinc/63/52/57/860635257.db2.gz SIGAIUROUKMWJF-GOSISDBHSA-N 0 3 400.950 4.404 20 0 HIADHN Cc1nc(CN2CCC(CN[C@@H](C)c3nc(C(F)(F)F)cs3)CC2)oc1C ZINC000467752834 881563733 /nfs/dbraw/zinc/56/37/33/881563733.db2.gz MKBJJGOHQKFXJV-LBPRGKRZSA-N 0 3 402.486 4.330 20 0 HIADHN FC(F)(F)c1ccc2nnc([C@@H]3CCCN(Cc4ccc(-c5cc[nH]n5)o4)C3)n2c1 ZINC000435126702 860653067 /nfs/dbraw/zinc/65/30/67/860653067.db2.gz PWXKSCPUOZKTEX-CYBMUJFWSA-N 0 3 416.407 4.111 20 0 HIADHN CCc1cc(C)cc(CC)c1NC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1CO ZINC000435180130 860681860 /nfs/dbraw/zinc/68/18/60/860681860.db2.gz BWWLCDFUYOPMSY-PKTZIBPZSA-N 0 3 409.574 4.124 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)C2(c3ccccc3Cl)CCOCC2)CN1Cc1ccccc1 ZINC000467754871 881568584 /nfs/dbraw/zinc/56/85/84/881568584.db2.gz XJDSVGIWZONBFG-UYAOXDASSA-N 0 3 412.961 4.167 20 0 HIADHN COc1cc(C(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)ccc1F ZINC000435266460 860708605 /nfs/dbraw/zinc/70/86/05/860708605.db2.gz JTZUOEQFUZFFQL-IBGZPJMESA-N 0 3 408.477 4.039 20 0 HIADHN Cc1cc(NC(=O)c2cc(F)c(F)c(F)c2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435264526 860708787 /nfs/dbraw/zinc/70/87/87/860708787.db2.gz BWHSSDAOKHXGLV-QGZVFWFLSA-N 0 3 414.431 4.308 20 0 HIADHN Cc1cc(NC(=O)c2cccc3cnccc32)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435275759 860713334 /nfs/dbraw/zinc/71/33/34/860713334.db2.gz AYGLYGSIXUSQGN-OAQYLSRUSA-N 0 3 411.509 4.439 20 0 HIADHN Cc1cc(NC(=O)[C@H]2Cc3ccccc3S2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435277315 860714518 /nfs/dbraw/zinc/71/45/18/860714518.db2.gz BGMIEZLVXMFSMI-IFMALSPDSA-N 0 3 418.566 4.294 20 0 HIADHN Cc1cc(NC(=O)c2ccnc(OC(C)C)c2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435279953 860715346 /nfs/dbraw/zinc/71/53/46/860715346.db2.gz QUBDWWXOLLKUJD-OAQYLSRUSA-N 0 3 419.529 4.073 20 0 HIADHN Cc1cc(NC(=O)Cn2ccc3ccccc32)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435282434 860716899 /nfs/dbraw/zinc/71/68/99/860716899.db2.gz VBXPIPGHOZCHHQ-JOCHJYFZSA-N 0 3 413.525 4.232 20 0 HIADHN CC(=O)c1ccc(C(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)s1 ZINC000435282428 860717323 /nfs/dbraw/zinc/71/73/23/860717323.db2.gz VBAUXXRTVMDIEG-SFHVURJKSA-N 0 3 408.527 4.155 20 0 HIADHN CCCCS[C@@H](C)C(=O)Nc1cc(C)nn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435286328 860719078 /nfs/dbraw/zinc/71/90/78/860719078.db2.gz WDYXMMQSTKYKNW-AZUAARDMSA-N 0 3 400.592 4.499 20 0 HIADHN Cc1cc(NC(=O)CCO[C@@H](C)CC(C)C)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435286760 860720145 /nfs/dbraw/zinc/72/01/45/860720145.db2.gz DNWBEWKVFBLECT-RBBKRZOGSA-N 0 3 412.578 4.418 20 0 HIADHN CC(=O)c1ccc(C(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000435286673 860720231 /nfs/dbraw/zinc/72/02/31/860720231.db2.gz XGGNBEFRXFSRSK-QFIPXVFZSA-N 0 3 402.498 4.093 20 0 HIADHN COc1ccc(CCC(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000435290104 860721175 /nfs/dbraw/zinc/72/11/75/860721175.db2.gz PHMRMMSDEOCIJH-QFIPXVFZSA-N 0 3 418.541 4.218 20 0 HIADHN Cc1cc(NC(=O)Cc2ccc(F)cc2F)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435292374 860721910 /nfs/dbraw/zinc/72/19/10/860721910.db2.gz RMVLDHRTAIOMLQ-FQEVSTJZSA-N 0 3 410.468 4.098 20 0 HIADHN Cc1cc(NC(=O)C2=Cc3ccccc3OC2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435291731 860722367 /nfs/dbraw/zinc/72/23/67/860722367.db2.gz VVDBGSFPYHXADQ-QFIPXVFZSA-N 0 3 414.509 4.053 20 0 HIADHN COc1ccc(C(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)c(F)c1 ZINC000435296614 860725116 /nfs/dbraw/zinc/72/51/16/860725116.db2.gz SMWXMUCOXPPSCX-SFHVURJKSA-N 0 3 408.477 4.039 20 0 HIADHN Cc1cc(NC(=O)[C@@H](C)Oc2cccc(C)c2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435303607 860728491 /nfs/dbraw/zinc/72/84/91/860728491.db2.gz ZNSWFQZAESEBCL-IFMALSPDSA-N 0 3 418.541 4.353 20 0 HIADHN CCOc1cccc(C(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000435303401 860728705 /nfs/dbraw/zinc/72/87/05/860728705.db2.gz XNTYZVXVCPOBMB-OAQYLSRUSA-N 0 3 404.514 4.290 20 0 HIADHN Cc1c(C(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)cnc2ccccc12 ZINC000435367908 860765873 /nfs/dbraw/zinc/76/58/73/860765873.db2.gz BRTYTXXMJPUXKT-FQEVSTJZSA-N 0 3 411.509 4.439 20 0 HIADHN Cc1ccc(OCCC(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)cc1C ZINC000435369057 860766915 /nfs/dbraw/zinc/76/69/15/860766915.db2.gz CPSBAMYTJLGBOK-JOCHJYFZSA-N 0 3 418.541 4.355 20 0 HIADHN CC(C)c1cccc(OCC(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000435371355 860769597 /nfs/dbraw/zinc/76/95/97/860769597.db2.gz MHUZISWVOGOHCP-QFIPXVFZSA-N 0 3 418.541 4.471 20 0 HIADHN Cc1c(C(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)oc2c1C(=O)CCC2 ZINC000435371064 860769641 /nfs/dbraw/zinc/76/96/41/860769641.db2.gz SBFPYAHAICBGDY-SFHVURJKSA-N 0 3 418.497 4.003 20 0 HIADHN CCOc1ccccc1CCC(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435374059 860771492 /nfs/dbraw/zinc/77/14/92/860771492.db2.gz WEPNTKWPECJITB-JOCHJYFZSA-N 0 3 418.541 4.300 20 0 HIADHN CC(C)c1ncc(Cl)c(C(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435374044 860771573 /nfs/dbraw/zinc/77/15/73/860771573.db2.gz GULDGMPJERPGSL-QGZVFWFLSA-N 0 3 424.936 4.149 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)[C@H]1C[C@@H]1c1ccc(F)cc1F ZINC000435375807 860773826 /nfs/dbraw/zinc/77/38/26/860773826.db2.gz WTGGGYBXPSMIFN-NRSPTQNISA-N 0 3 422.479 4.351 20 0 HIADHN Cc1cccc(O[C@@H](C)C(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000435375825 860773925 /nfs/dbraw/zinc/77/39/25/860773925.db2.gz WYTKHHJCBSBXQW-FPOVZHCZSA-N 0 3 404.514 4.045 20 0 HIADHN Cc1cc2ccccc2n1CC(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435377299 860774959 /nfs/dbraw/zinc/77/49/59/860774959.db2.gz ZZRBHFMLXIUNAH-JOCHJYFZSA-N 0 3 413.525 4.232 20 0 HIADHN Cc1cc(NC(=O)N(C)Cc2ccc(F)cc2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435513284 860831459 /nfs/dbraw/zinc/83/14/59/860831459.db2.gz CWSWBICNGSVCQP-QFIPXVFZSA-N 0 3 421.520 4.442 20 0 HIADHN Cc1cc(NC(=O)NCc2ccc(C)c(F)c2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435520985 860838519 /nfs/dbraw/zinc/83/85/19/860838519.db2.gz UVKUYXQWDSIILE-OAQYLSRUSA-N 0 3 421.520 4.408 20 0 HIADHN Cc1cc(NC(=O)NCc2nc(C)c(C)s2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435524334 860841167 /nfs/dbraw/zinc/84/11/67/860841167.db2.gz DUCFKRAXCGUXCT-LJQANCHMSA-N 0 3 424.574 4.034 20 0 HIADHN Cc1cc(NC(=O)NCc2cccc(C)c2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435526612 860842121 /nfs/dbraw/zinc/84/21/21/860842121.db2.gz ISWUAVIGKURYRS-JOCHJYFZSA-N 0 3 403.530 4.269 20 0 HIADHN Cc1cc(NC(=O)N[C@@H](C)c2cccc(O)c2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435525557 860842236 /nfs/dbraw/zinc/84/22/36/860842236.db2.gz FDQUNGHGYFWNHX-GHTZIAJQSA-N 0 3 419.529 4.227 20 0 HIADHN O=C(Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)c1cc(-c2cccs2)on1 ZINC000435639558 860930363 /nfs/dbraw/zinc/93/03/63/860930363.db2.gz VEKFVQPIXZAHRZ-KRWDZBQOSA-N 0 3 419.510 4.299 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)c1cc(-c2cccs2)on1 ZINC000435639559 860931169 /nfs/dbraw/zinc/93/11/69/860931169.db2.gz VEKFVQPIXZAHRZ-QGZVFWFLSA-N 0 3 419.510 4.299 20 0 HIADHN CC(C)c1nn(-c2ccc(Br)cc2)cc1CNCC1([S@@](C)=O)CCC1 ZINC000435727025 861010582 /nfs/dbraw/zinc/01/05/82/861010582.db2.gz CKQOGICGPFFGHJ-RUZDIDTESA-N 0 3 424.408 4.149 20 0 HIADHN COc1cc(CN(C)[C@@H](C)c2ccc(-n3cncn3)cc2)ccc1OCC(F)(F)F ZINC000435773140 861048324 /nfs/dbraw/zinc/04/83/24/861048324.db2.gz SPSGTRUMBFDJRX-HNNXBMFYSA-N 0 3 420.435 4.410 20 0 HIADHN CN(C)Cc1cccc(NC(=O)N(C)[C@@H]2c3cc(Cl)cc(Cl)c3C[C@@H]2O)c1 ZINC000435919483 861178852 /nfs/dbraw/zinc/17/88/52/861178852.db2.gz YGFBHOQEEDISHU-RBUKOAKNSA-N 0 3 408.329 4.177 20 0 HIADHN COCCCOc1ccccc1NC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC000437850609 863210931 /nfs/dbraw/zinc/21/09/31/863210931.db2.gz XAZFALKUARICKR-HXUWFJFHSA-N 0 3 411.546 4.230 20 0 HIADHN CCc1ncsc1NC(=O)N(CCN(C)C)Cc1ccc(Br)cc1 ZINC000437884506 863247634 /nfs/dbraw/zinc/24/76/34/863247634.db2.gz VBQIXDGBQSYMQE-UHFFFAOYSA-N 0 3 411.369 4.064 20 0 HIADHN O[C@H](COC(c1ccccc1)c1ccccc1)CN1CCC(Oc2ccccn2)CC1 ZINC000437906179 863279401 /nfs/dbraw/zinc/27/94/01/863279401.db2.gz QSQIXPYYTWTRHT-QHCPKHFHSA-N 0 3 418.537 4.092 20 0 HIADHN C[C@H]1CCN(C(=O)Nc2cccc(N3CCCCC3=O)c2)CCN1Cc1ccccc1 ZINC000437938664 863313907 /nfs/dbraw/zinc/31/39/07/863313907.db2.gz YMJLNZBRUUKZNR-FQEVSTJZSA-N 0 3 420.557 4.332 20 0 HIADHN Cc1csc([C@H](NC(=O)Nc2ccc(CCN3CCSCC3)cc2)C2CC2)n1 ZINC000438095991 863503261 /nfs/dbraw/zinc/50/32/61/863503261.db2.gz IIQLHDNIBNQJDN-LJQANCHMSA-N 0 3 416.616 4.316 20 0 HIADHN CCOc1ccc(NC(=O)CN2CCN([C@H]3CC[C@](C)(c4ccccc4)C3)CC2)cc1 ZINC000438122880 863542096 /nfs/dbraw/zinc/54/20/96/863542096.db2.gz ROVGACZRLJKHSL-OZXSUGGESA-N 0 3 421.585 4.152 20 0 HIADHN C[C@H](NCc1cccc(NC(=O)[C@H]2CCCO2)c1)c1cccc(Br)c1 ZINC000467839675 881676008 /nfs/dbraw/zinc/67/60/08/881676008.db2.gz DYHUQTNEZPRDLF-IFXJQAMLSA-N 0 3 403.320 4.417 20 0 HIADHN C[C@H](NCc1cccc(NC(=O)Cn2cccn2)c1)c1cccc(Br)c1 ZINC000467840639 881678729 /nfs/dbraw/zinc/67/87/29/881678729.db2.gz VUOQGMPBKDTSHJ-HNNXBMFYSA-N 0 3 413.319 4.135 20 0 HIADHN C[C@H](NCc1cccc(NC(=O)[C@@H]2CCCO2)c1)c1cccc(Br)c1 ZINC000467839677 881679075 /nfs/dbraw/zinc/67/90/75/881679075.db2.gz DYHUQTNEZPRDLF-LIRRHRJNSA-N 0 3 403.320 4.417 20 0 HIADHN CCOc1cccc2[nH]cc(CC(=O)N[C@@H](CN3CCCC3)c3ccc(OC)cc3)c21 ZINC000438281579 863751924 /nfs/dbraw/zinc/75/19/24/863751924.db2.gz SRCCGAACOAWMAD-QFIPXVFZSA-N 0 3 421.541 4.071 20 0 HIADHN Cc1cnn(-c2ccc(NC(=O)N3CC[C@H](C)N(Cc4ccccc4)CC3)cc2F)c1 ZINC000438323295 863801215 /nfs/dbraw/zinc/80/12/15/863801215.db2.gz COSJBAQBAJSKRO-IBGZPJMESA-N 0 3 421.520 4.448 20 0 HIADHN Cc1nn(CC(=O)OC(C)C)c(C)c1CN1CCC(c2nc3cccc(C)c3o2)CC1 ZINC000438327326 863804289 /nfs/dbraw/zinc/80/42/89/863804289.db2.gz MAANVLGFVMCHNT-UHFFFAOYSA-N 0 3 424.545 4.281 20 0 HIADHN CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)N[C@@H]1C[C@H]1c1ccc(Cl)c(F)c1 ZINC000438372275 863832218 /nfs/dbraw/zinc/83/22/18/863832218.db2.gz ASQJKZMGRCEFAI-PZBISTMVSA-N 0 3 416.928 4.064 20 0 HIADHN CCc1c(C(=O)CN(C)[C@H]2CCN(Cc3ccccc3)[C@H](C)C2)[nH]c(C)c1C(C)=O ZINC000438454296 863878530 /nfs/dbraw/zinc/87/85/30/863878530.db2.gz JNKTZJJGDOVXEP-UTKZUKDTSA-N 0 3 409.574 4.256 20 0 HIADHN C[C@@H](C(=O)N(CCN(C)C)Cc1cccs1)c1ccc(Br)s1 ZINC000438454873 863878728 /nfs/dbraw/zinc/87/87/28/863878728.db2.gz BIBWLLDKKQSJTO-GFCCVEGCSA-N 0 3 401.395 4.266 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)NC[C@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000438537884 863964452 /nfs/dbraw/zinc/96/44/52/863964452.db2.gz AGSUZNKVIAXRJR-RBUKOAKNSA-N 0 3 411.512 4.074 20 0 HIADHN CC(C)n1ncc2c1nc(C1CC1)cc2C(=O)N(CCN(C)C)Cc1cccs1 ZINC000438541638 863968135 /nfs/dbraw/zinc/96/81/35/863968135.db2.gz QNZQVSWVRPVRKR-UHFFFAOYSA-N 0 3 411.575 4.155 20 0 HIADHN CC(=O)CCc1ccc(O[C@H](C)C(=O)N(Cc2ccccc2)C2CCN(C)CC2)cc1 ZINC000438555024 863986215 /nfs/dbraw/zinc/98/62/15/863986215.db2.gz RLAWLKKTSXSNNP-OAQYLSRUSA-N 0 3 422.569 4.099 20 0 HIADHN O=C(NCCN1CCCCC1)Nc1ncc(Cc2cccc(Br)c2)s1 ZINC000438570787 864003566 /nfs/dbraw/zinc/00/35/66/864003566.db2.gz JWCBEZXXONFMSH-UHFFFAOYSA-N 0 3 423.380 4.104 20 0 HIADHN CC(C)CCO[C@@H]1CCCC[C@H]1NC(=O)N(Cc1ccco1)C1CCN(C)CC1 ZINC000438589001 864019149 /nfs/dbraw/zinc/01/91/49/864019149.db2.gz SKUJSNVQYFVMTO-FGZHOGPDSA-N 0 3 405.583 4.259 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)Nc2ccc(Br)c(F)c2)c1 ZINC000438621183 864046673 /nfs/dbraw/zinc/04/66/73/864046673.db2.gz OORSLSYFJZHKSN-UHFFFAOYSA-N 0 3 408.315 4.492 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)Nc2ccc(OC[C@H]3CCCO3)cc2)CC1 ZINC000438629566 864057780 /nfs/dbraw/zinc/05/77/80/864057780.db2.gz NYRXCUNQTOKIKT-XMMPIXPASA-N 0 3 423.557 4.373 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)Nc1ccc(F)cc1OC(F)F ZINC000438639457 864075021 /nfs/dbraw/zinc/07/50/21/864075021.db2.gz BQKIBXYPDRADAN-UHFFFAOYSA-N 0 3 409.452 4.455 20 0 HIADHN Cc1ccnc(Oc2cc(NC(=O)N(CCN(C)C)C[C@@H]3CCCO3)ccc2C)c1 ZINC000438669785 864130266 /nfs/dbraw/zinc/13/02/66/864130266.db2.gz BEJVCAWZFADMSQ-FQEVSTJZSA-N 0 3 412.534 4.065 20 0 HIADHN CC(=O)c1ccc(OCCCC(=O)N(Cc2ccccc2)C2CCN(C)CC2)cc1 ZINC000438709450 864188182 /nfs/dbraw/zinc/18/81/82/864188182.db2.gz AOPQSJONYFLRHH-UHFFFAOYSA-N 0 3 408.542 4.171 20 0 HIADHN C[C@@H](SCC(=O)N(Cc1ccccc1)C1CCN(C)CC1)c1nc2ccccc2[nH]1 ZINC000438712444 864194738 /nfs/dbraw/zinc/19/47/38/864194738.db2.gz HWDLSVILVMOTDC-GOSISDBHSA-N 0 3 422.598 4.480 20 0 HIADHN CSc1ccc(NC(=O)NCc2ccccc2CN2CCC(O)CC2)cc1Cl ZINC000438760506 864253622 /nfs/dbraw/zinc/25/36/22/864253622.db2.gz WPSWBJJJIAUKJU-UHFFFAOYSA-N 0 3 419.978 4.340 20 0 HIADHN C[C@@H](Sc1ccccc1)c1ccc(NC(=O)C(=O)N2CC[C@H]3CC[C@@H](C2)N3C)cc1 ZINC000438811665 864303510 /nfs/dbraw/zinc/30/35/10/864303510.db2.gz FAXIKNYWCUKSMT-UIFIKXQLSA-N 0 3 423.582 4.174 20 0 HIADHN COC(=O)c1ccc(NC(=O)N(Cc2ccccc2)C2CCN(C)CC2)cc1Cl ZINC000438883702 864370345 /nfs/dbraw/zinc/37/03/45/864370345.db2.gz PTLQBFDEEMJYBS-UHFFFAOYSA-N 0 3 415.921 4.255 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)c1c[nH]c2ccc(Br)cc12 ZINC000439026454 864481366 /nfs/dbraw/zinc/48/13/66/864481366.db2.gz GGBQXKYTPANMGF-UHFFFAOYSA-N 0 3 406.349 4.196 20 0 HIADHN COC(=O)[C@@H](NC1CCN([C@@H](C)c2ccncc2)CC1)c1cc(Cl)cc(Cl)c1 ZINC000439044487 864498244 /nfs/dbraw/zinc/49/82/44/864498244.db2.gz APTMKPUYAOYMNL-XOBRGWDASA-N 0 3 422.356 4.418 20 0 HIADHN COC(=O)[C@H](NC1CCN([C@@H](C)c2ccncc2)CC1)c1ccc(Cl)cc1Cl ZINC000439064379 864514936 /nfs/dbraw/zinc/51/49/36/864514936.db2.gz OXMHOGBZTAMLKN-VBKZILBWSA-N 0 3 422.356 4.418 20 0 HIADHN COc1ccc(Cl)cc1-c1cc(NC(=O)c2oc3ccccc3c2CN(C)C)n[nH]1 ZINC000439158168 864589369 /nfs/dbraw/zinc/58/93/69/864589369.db2.gz HFPLHUODXMSAMR-UHFFFAOYSA-N 0 3 424.888 4.799 20 0 HIADHN Cc1nc(-c2ccc(CNC(=O)N(CCN(C)C)Cc3cccs3)o2)cs1 ZINC000439210713 864633356 /nfs/dbraw/zinc/63/33/56/864633356.db2.gz MTMYIGKPLGQGPY-UHFFFAOYSA-N 0 3 404.561 4.046 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)NCc1ccccc1OC1CCCC1 ZINC000439219770 864636051 /nfs/dbraw/zinc/63/60/51/864636051.db2.gz AVRHJHMKVVRWRN-UHFFFAOYSA-N 0 3 401.576 4.343 20 0 HIADHN CCN(C[C@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)c1ccc2ccccc2c1 ZINC000439233600 864649676 /nfs/dbraw/zinc/64/96/76/864649676.db2.gz ZMKTYTYVTPDDGA-NRFANRHFSA-N 0 3 408.567 4.373 20 0 HIADHN COC(=O)c1c(CN(C)[C@H]2CC[C@H](O)CC2)nc2ccccc2c1-c1ccccc1 ZINC000439285148 864703774 /nfs/dbraw/zinc/70/37/74/864703774.db2.gz NTBKDWRMMMWUFF-WGSAOQKQSA-N 0 3 404.510 4.424 20 0 HIADHN Cc1ccc([C@H]2OCCC[C@H]2CNC(=O)N(CCN(C)C)Cc2cccs2)cc1 ZINC000439330237 864767648 /nfs/dbraw/zinc/76/76/48/864767648.db2.gz YFDBDTKVGOIRPF-RBBKRZOGSA-N 0 3 415.603 4.298 20 0 HIADHN Cc1ccc(-c2nc(CCNC(=O)N(CCN(C)C)Cc3cccs3)co2)cc1 ZINC000439374350 864807747 /nfs/dbraw/zinc/80/77/47/864807747.db2.gz HAIKKDJARDEDRX-UHFFFAOYSA-N 0 3 412.559 4.027 20 0 HIADHN Cc1cccnc1[C@@H](NC[C@@H](O)COc1cc(F)cc(Br)c1)C(C)C ZINC000439458264 864839293 /nfs/dbraw/zinc/83/92/93/864839293.db2.gz SOFCMJHTLHZVAX-AEFFLSMTSA-N 0 3 411.315 4.018 20 0 HIADHN CCCN(C(=O)c1cccc(NC(C)=O)c1C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000467944058 881813189 /nfs/dbraw/zinc/81/31/89/881813189.db2.gz SPVWYAWBHDAXEE-QFIPXVFZSA-N 0 3 407.558 4.470 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)NC[C@@H]1CCC[C@H](C(F)(F)F)C1 ZINC000439580788 864902307 /nfs/dbraw/zinc/90/23/07/864902307.db2.gz KBJFZLDOJOKPSV-ZBFHGGJFSA-N 0 3 421.454 4.407 20 0 HIADHN Cc1ccc(NC(=O)[C@@H](C)NCc2ccccc2CN(C)Cc2ccco2)cc1F ZINC000439592799 864916363 /nfs/dbraw/zinc/91/63/63/864916363.db2.gz HVKHEVJIPCZBEC-GOSISDBHSA-N 0 3 409.505 4.476 20 0 HIADHN CN(Cc1ccco1)Cc1ccccc1CN[C@H]1CCCN(c2ccccc2)C1=O ZINC000439600570 864922956 /nfs/dbraw/zinc/92/29/56/864922956.db2.gz WAGDDHQQVHJAHV-DEOSSOPVSA-N 0 3 403.526 4.197 20 0 HIADHN C[C@@H](NCc1ccccc1CN(C)Cc1ccco1)C(=O)N(C)Cc1cccc(F)c1 ZINC000439599697 864923621 /nfs/dbraw/zinc/92/36/21/864923621.db2.gz WUSVBOMVLVUQAC-LJQANCHMSA-N 0 3 423.532 4.187 20 0 HIADHN COc1ccc(NC(=O)[C@@H](C)NCc2ccccc2CN(C)Cc2ccco2)cc1 ZINC000439610866 864933183 /nfs/dbraw/zinc/93/31/83/864933183.db2.gz MSGTVOQNRHRTIV-GOSISDBHSA-N 0 3 407.514 4.037 20 0 HIADHN CC1CCN([C@@H](CNC(=O)c2ccccc2Cn2cccn2)c2ccccc2)CC1 ZINC000467973299 881828561 /nfs/dbraw/zinc/82/85/61/881828561.db2.gz LUVHQQSAXIBFEY-DEOSSOPVSA-N 0 3 402.542 4.134 20 0 HIADHN CC[C@@](C)(O)CN(Cc1ccccc1)C(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000439714933 865052635 /nfs/dbraw/zinc/05/26/35/865052635.db2.gz MIEYHASEDDDGEU-NFBKMPQASA-N 0 3 415.603 4.258 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)CCOc2ccc(Cl)c(Cl)c2)CC1 ZINC000439742230 865074171 /nfs/dbraw/zinc/07/41/71/865074171.db2.gz GJZDJAXEYJQTQG-OAHLLOKOSA-N 0 3 422.356 4.499 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)[C@@H]2C[C@H]2c2c(F)cccc2Cl)CC1 ZINC000439749397 865078858 /nfs/dbraw/zinc/07/88/58/865078858.db2.gz YKIHRWQQSOKHIW-ZTFGCOKTSA-N 0 3 401.913 4.319 20 0 HIADHN Cc1nnc(-c2ccc(C(=O)NC[C@H](c3ccccc3)N3CCC(C)CC3)cc2)o1 ZINC000467985488 881833782 /nfs/dbraw/zinc/83/37/82/881833782.db2.gz SJHOCXRWGSWUPQ-JOCHJYFZSA-N 0 3 404.514 4.248 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)CCCOc2ccc3c(c2)CCCC3)CC1 ZINC000439762280 865087061 /nfs/dbraw/zinc/08/70/61/865087061.db2.gz RSFZJDFYGOUDCQ-HXUWFJFHSA-N 0 3 421.585 4.461 20 0 HIADHN C[C@@H](Oc1cccc(Cl)c1Cl)C(=O)NC1CCN([C@@H](C)c2ccncc2)CC1 ZINC000439762781 865089337 /nfs/dbraw/zinc/08/93/37/865089337.db2.gz CLNQIJKBSFUQKL-LSDHHAIUSA-N 0 3 422.356 4.498 20 0 HIADHN COc1cc(C(=O)NC2CCN([C@H](C)c3ccncc3)CC2)ccc1OC1CCCC1 ZINC000439765834 865092852 /nfs/dbraw/zinc/09/28/52/865092852.db2.gz GCTMSIWUPXUCQS-GOSISDBHSA-N 0 3 423.557 4.367 20 0 HIADHN C[C@H](Oc1cccc(C(C)(C)C)c1)C(=O)NC1CCN([C@@H](C)c2ccncc2)CC1 ZINC000439768114 865093612 /nfs/dbraw/zinc/09/36/12/865093612.db2.gz LXCSPIWFFUEHEI-OALUTQOASA-N 0 3 409.574 4.488 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)[C@H]2C[C@@H]2c2ccccc2OC(F)F)CC1 ZINC000439770286 865095820 /nfs/dbraw/zinc/09/58/20/865095820.db2.gz QEMAQHVPPYOKLW-YSGRDPCXSA-N 0 3 415.484 4.128 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)[C@H](C)CSc2ccc(F)cc2)CC1 ZINC000439776996 865101038 /nfs/dbraw/zinc/10/10/38/865101038.db2.gz ZAZDUCAJEQFMHP-IAGOWNOFSA-N 0 3 401.551 4.291 20 0 HIADHN CCCN(CC(=O)N(CC)c1ccccc1)C1CCN(C(=O)c2ccccc2)CC1 ZINC000439893266 865205426 /nfs/dbraw/zinc/20/54/26/865205426.db2.gz WMGMLMRDZGWASQ-UHFFFAOYSA-N 0 3 407.558 4.056 20 0 HIADHN C[C@@H](C(=O)NCc1ccc(CN2CCN(C)CC2)cc1)c1ccc2ccccc2c1 ZINC000439914406 865222148 /nfs/dbraw/zinc/22/21/48/865222148.db2.gz NQAYEPCOPRRAOQ-HXUWFJFHSA-N 0 3 401.554 4.007 20 0 HIADHN CCn1ncc(NC(=O)Nc2ccc(N3CCN(CC)CC3)cc2C)c1C(F)(F)F ZINC000439922309 865227441 /nfs/dbraw/zinc/22/74/41/865227441.db2.gz AZEMJADMFVTAGK-UHFFFAOYSA-N 0 3 424.471 4.016 20 0 HIADHN Cc1ccc(-c2ccnn2C)cc1NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000439950846 865243997 /nfs/dbraw/zinc/24/39/97/865243997.db2.gz BKXSEQGPQFJHLB-OAQYLSRUSA-N 0 3 403.530 4.182 20 0 HIADHN CC1CCN([C@H](CNC(=O)Nc2ccc(N3CCC3=O)cc2)c2cccs2)CC1 ZINC000439972369 865264002 /nfs/dbraw/zinc/26/40/02/865264002.db2.gz JJGRLUBXTAQENZ-LJQANCHMSA-N 0 3 412.559 4.080 20 0 HIADHN CC[C@H](C)NC(=O)[C@@H]1C[C@H](C)N(Cc2ccsc2C(=O)OC)[C@H]2CCCC[C@@H]12 ZINC000439982172 865285629 /nfs/dbraw/zinc/28/56/29/865285629.db2.gz IURQXRGKZJBIOS-JAQSECSASA-N 0 3 406.592 4.219 20 0 HIADHN CC(C)N(CCN(C)C)C(=O)NCc1ccccc1-c1ccc(Cn2cccn2)cc1 ZINC000440082786 865345949 /nfs/dbraw/zinc/34/59/49/865345949.db2.gz SBEOSMLCIPZJHI-UHFFFAOYSA-N 0 3 419.573 4.080 20 0 HIADHN COc1ccc2c(c1)[C@@H](N[C@H](C)CC(=O)N(C)Cc1cccc(Cl)c1)CCO2 ZINC000468032874 881864764 /nfs/dbraw/zinc/86/47/64/881864764.db2.gz DEOMOLJJLIPONT-QRWLVFNGSA-N 0 3 402.922 4.199 20 0 HIADHN COc1ccc([C@@H](NC[C@H](O)COCC(C)C)c2ccccc2)cc1Br ZINC000440186955 865414130 /nfs/dbraw/zinc/41/41/30/865414130.db2.gz BSXWKBHEBGFNKY-RXVVDRJESA-N 0 3 422.363 4.170 20 0 HIADHN CC(C)N(CCN(C)C)C(=O)N[C@H]1c2cc(Br)ccc2SC[C@@H]1C ZINC000440223656 865461188 /nfs/dbraw/zinc/46/11/88/865461188.db2.gz CRKUIXXHGIQZAK-SUMWQHHRSA-N 0 3 414.413 4.214 20 0 HIADHN CC(C)N(CCN(C)C)C(=O)NCc1ccc(Oc2ccccc2C(F)(F)F)nc1 ZINC000440255611 865502424 /nfs/dbraw/zinc/50/24/24/865502424.db2.gz YYBPJGINMGDXPG-UHFFFAOYSA-N 0 3 424.467 4.374 20 0 HIADHN O=C(CCN1CCN(c2ccccc2)CC1)N[C@H](CC(F)(F)F)c1ccccc1 ZINC000468079533 881890840 /nfs/dbraw/zinc/89/08/40/881890840.db2.gz NMLBHQPODQQKHY-HXUWFJFHSA-N 0 3 405.464 4.009 20 0 HIADHN COC[C@@H](C)n1c(C)cc(C(=O)CN(C)C2CCN(Cc3ccccc3)CC2)c1C ZINC000440447959 865751741 /nfs/dbraw/zinc/75/17/41/865751741.db2.gz DQFGBQRJNLFFJQ-HXUWFJFHSA-N 0 3 411.590 4.091 20 0 HIADHN CCCN(CC(=O)c1cc(C)n(C2CC2)c1C)C1CCN(c2cc(C)nc(C)n2)CC1 ZINC000440464944 865769560 /nfs/dbraw/zinc/76/95/60/865769560.db2.gz YQHQGXLZKFHSEE-UHFFFAOYSA-N 0 3 423.605 4.410 20 0 HIADHN COc1ccc(COC[C@H](O)CN2CC=C(c3ccc(Cl)cc3)CC2)cc1OC ZINC000440571102 865822403 /nfs/dbraw/zinc/82/24/03/865822403.db2.gz XSJMULSTVNFBRH-OAQYLSRUSA-N 0 3 417.933 4.024 20 0 HIADHN COCc1nc(C(=O)N2CCN(CC3CCCCC3)CC2)c(-c2ccccc2)s1 ZINC000440742037 865883995 /nfs/dbraw/zinc/88/39/95/865883995.db2.gz RQYHRZLSDZQUAD-UHFFFAOYSA-N 0 3 413.587 4.295 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)c1cc(F)c(F)cc1Br ZINC000440879034 865974969 /nfs/dbraw/zinc/97/49/69/865974969.db2.gz OLQFCJSTZHDREX-AWEZNQCLSA-N 0 3 409.274 4.122 20 0 HIADHN COc1ccc(NC(=O)C2(NCCO[C@H]3CCCC[C@@H]3C)CCCC2)cc1OC ZINC000440890035 865984005 /nfs/dbraw/zinc/98/40/05/865984005.db2.gz IOTKURUWEQBCSK-HKUYNNGSSA-N 0 3 404.551 4.140 20 0 HIADHN COc1ccc(NC(=O)C2(NCc3cc(F)cc4cccnc43)CCCC2)cc1OC ZINC000440897477 865992136 /nfs/dbraw/zinc/99/21/36/865992136.db2.gz RLHUIHYUZIPQHA-UHFFFAOYSA-N 0 3 423.488 4.432 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)c2ccc(Cl)c(NC(=O)c3cccs3)c2)CN1C1CC1 ZINC000440920022 866015083 /nfs/dbraw/zinc/01/50/83/866015083.db2.gz GUBIUMLUCQCSFZ-OCCSQVGLSA-N 0 3 403.935 4.009 20 0 HIADHN C[C@H]1C[C@H](NC(=O)c2cn(C(C)(C)C)nc2-c2ccccc2Cl)CN1C1CC1 ZINC000440933927 866032101 /nfs/dbraw/zinc/03/21/01/866032101.db2.gz RNAVMRFWGXYMNQ-GJZGRUSLSA-N 0 3 400.954 4.314 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)c2ccccc2CSc2nc3ccccc3o2)CN1C1CC1 ZINC000440936020 866035096 /nfs/dbraw/zinc/03/50/96/866035096.db2.gz LYEKXQHFYLJDIN-NVXWUHKLSA-N 0 3 407.539 4.475 20 0 HIADHN C[C@@H]1CCCN(C(=O)CNC2(c3ccc(OCc4ccccc4)cc3)CCOCC2)C1 ZINC000441001862 866074769 /nfs/dbraw/zinc/07/47/69/866074769.db2.gz IPRDWOOCCRRVHL-OAQYLSRUSA-N 0 3 422.569 4.119 20 0 HIADHN CSc1ccccc1[C@H](C)NC(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000441021206 866087873 /nfs/dbraw/zinc/08/78/73/866087873.db2.gz KCXXIBSNJYMZFR-AZUAARDMSA-N 0 3 413.587 4.060 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)[C@@H](c2c(F)cccc2Cl)N(C)C)C1 ZINC000468115491 881940055 /nfs/dbraw/zinc/94/00/55/881940055.db2.gz PNTBCSPBDWFEMP-LDBYXDLTSA-N 0 3 403.929 4.034 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N3CCCc4cc(OC(F)F)ccc43)cc2)CC1 ZINC000468115813 881941454 /nfs/dbraw/zinc/94/14/54/881941454.db2.gz SLZBKWBHNJTLSQ-UHFFFAOYSA-N 0 3 415.484 4.023 20 0 HIADHN Cc1ccnc(Oc2ccc(NC(=O)N[C@@H]3CCCN(Cc4ccccc4)C3)cc2)n1 ZINC000441085126 866178951 /nfs/dbraw/zinc/17/89/51/866178951.db2.gz BALRKKAGOZOWOS-OAQYLSRUSA-N 0 3 417.513 4.363 20 0 HIADHN Nc1ccc(F)c(NC(=O)CCN2CCC[C@H](c3nc(C(F)(F)F)cs3)C2)c1 ZINC000441104159 866201447 /nfs/dbraw/zinc/20/14/47/866201447.db2.gz MBSLAVUYQYDFEW-NSHDSACASA-N 0 3 416.444 4.091 20 0 HIADHN C[C@H](C(=O)Nc1ccc(OCc2ccccc2)cc1)N1CCC[C@@H]([C@@H]2CCOC2)C1 ZINC000441284518 866358611 /nfs/dbraw/zinc/35/86/11/866358611.db2.gz XQVXNMRVHKIJTM-CEMLEFRQSA-N 0 3 408.542 4.341 20 0 HIADHN CCCOc1ccc(CN(CCC)C(=O)N[C@H]2C[C@@H](C)N(C3CC3)C2)cc1OC ZINC000441287357 866362466 /nfs/dbraw/zinc/36/24/66/866362466.db2.gz PDZKAVIIBQMGQB-MJGOQNOKSA-N 0 3 403.567 4.031 20 0 HIADHN COc1cccc([C@H](CNC(=O)CCc2c[nH]c3ccc(C)cc23)N2CCCC2)c1 ZINC000468140968 881996044 /nfs/dbraw/zinc/99/60/44/881996044.db2.gz XHOLUIYPYLHZNG-DEOSSOPVSA-N 0 3 405.542 4.371 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)NC[C@]1(C)CCCS1 ZINC000468148470 882007836 /nfs/dbraw/zinc/00/78/36/882007836.db2.gz HWBRHVFLBUCAGM-SFHVURJKSA-N 0 3 403.514 4.064 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)N[C@H](C)c2cccc(OC(F)(F)F)c2)o1 ZINC000441688530 866806213 /nfs/dbraw/zinc/80/62/13/866806213.db2.gz FBJHHVSWKWEGAM-OAHLLOKOSA-N 0 3 413.440 4.321 20 0 HIADHN CC(C)Cn1ccc2cc(NC(=O)C(=O)N[C@H](C)[C@@H](c3ccccc3)N(C)C)ccc21 ZINC000441698056 866810709 /nfs/dbraw/zinc/81/07/09/866810709.db2.gz GMRVQUMSPRBESW-JPYJTQIMSA-N 0 3 420.557 4.043 20 0 HIADHN C[C@@H](NC(=O)C(=O)Nc1ccc2c(c1)Cc1ccccc1-2)[C@H](c1ccccc1)N(C)C ZINC000441705071 866813232 /nfs/dbraw/zinc/81/32/32/866813232.db2.gz RGBHGQVCILXVSR-MZNJEOGPSA-N 0 3 413.521 4.004 20 0 HIADHN CC(C)Sc1c(Cl)cccc1NC(=O)C(=O)NC[C@@H](C)N1CCC[C@H](C)C1 ZINC000441777042 866851574 /nfs/dbraw/zinc/85/15/74/866851574.db2.gz OZEJOSTWWIUBKR-LSDHHAIUSA-N 0 3 411.999 4.016 20 0 HIADHN CCc1ccc([C@H](CNC(=O)c2cc(F)c(F)cc2Br)N(C)C)cc1 ZINC000441836299 866895070 /nfs/dbraw/zinc/89/50/70/866895070.db2.gz DYUWCIXXVCYAHE-SFHVURJKSA-N 0 3 411.290 4.322 20 0 HIADHN Cn1nccc1[C@@H]1CCCN(Cc2ccnc(-c3ccc(Br)cc3)n2)C1 ZINC000441905539 866970526 /nfs/dbraw/zinc/97/05/26/866970526.db2.gz QLVURQYZLNNIFF-MRXNPFEDSA-N 0 3 412.335 4.019 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3nc4c(s3)CCCCCC4)CC2)C[C@@H](C)O1 ZINC000441926973 866991772 /nfs/dbraw/zinc/99/17/72/866991772.db2.gz WMHSLQPEFSZRMQ-IAGOWNOFSA-N 0 3 420.623 4.155 20 0 HIADHN Cc1nn(C(C)(C)C)cc1[C@@H](C)NC(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000468169318 882045815 /nfs/dbraw/zinc/04/58/15/882045815.db2.gz OYEBZGNNEVQBCZ-GOSISDBHSA-N 0 3 411.594 4.314 20 0 HIADHN Cc1cc(SC2CCCCC2)ccc1NC(=O)C(=O)N[C@@H](C)C1=CCN(C)CC1 ZINC000442341461 867336801 /nfs/dbraw/zinc/33/68/01/867336801.db2.gz OQYKYAHIOSARAG-KRWDZBQOSA-N 0 3 415.603 4.125 20 0 HIADHN CN(C)Cc1cccc(NC(=O)C(=O)N2CCCCC[C@@H]2/C=C/c2cccs2)c1 ZINC000442490738 867474095 /nfs/dbraw/zinc/47/40/95/867474095.db2.gz ITHRCJNDZGHOEO-DRUFCSCSSA-N 0 3 411.571 4.233 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)c1ccncc1Oc1ccccc1 ZINC000442678145 867612414 /nfs/dbraw/zinc/61/24/14/867612414.db2.gz CZNXAVXWXBTIOJ-UHFFFAOYSA-N 0 3 403.482 4.083 20 0 HIADHN CC(C)CC1(C(=O)NC2CCN(CCOc3ccc(Br)cc3)CC2)CC1 ZINC000442719653 867646701 /nfs/dbraw/zinc/64/67/01/867646701.db2.gz RUGYEBUJTMJPPO-UHFFFAOYSA-N 0 3 423.395 4.235 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1ncccc1Oc1ccccc1 ZINC000442806662 867681046 /nfs/dbraw/zinc/68/10/46/867681046.db2.gz CEGOTGMDBZGACT-UHFFFAOYSA-N 0 3 419.447 4.409 20 0 HIADHN COC(=O)[C@H](C)Sc1ccccc1C(=O)NCCN1CCC2(CCCCC2)CC1 ZINC000442980579 867775955 /nfs/dbraw/zinc/77/59/55/867775955.db2.gz RQBQMDCYZOHOHB-SFHVURJKSA-N 0 3 418.603 4.116 20 0 HIADHN C[C@H](N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1)c1ccc2c(c1)OCCO2 ZINC000443103782 867820403 /nfs/dbraw/zinc/82/04/03/867820403.db2.gz SLKSHHFABGCSIL-PGRDOPGGSA-N 0 3 402.494 4.358 20 0 HIADHN C[C@H](CSc1ccccc1)C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000443331016 867908718 /nfs/dbraw/zinc/90/87/18/867908718.db2.gz KUXFAOJYBKBMLL-GOSISDBHSA-N 0 3 416.562 4.214 20 0 HIADHN O=C(CCc1cc2ccccc2o1)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000443341890 867914866 /nfs/dbraw/zinc/91/48/66/867914866.db2.gz FYKKBLWFRXKFLT-UHFFFAOYSA-N 0 3 410.489 4.164 20 0 HIADHN Cc1cccc2c(CCC(=O)NC3CCN(CCOc4ccc(F)cc4)CC3)c[nH]c21 ZINC000443349381 867919122 /nfs/dbraw/zinc/91/91/22/867919122.db2.gz UPIOYXADNZJOGN-UHFFFAOYSA-N 0 3 423.532 4.208 20 0 HIADHN O=C(Nc1cc(F)cc(F)c1Br)N1CCN(C2CCCCC2)CC1 ZINC000443518810 868077771 /nfs/dbraw/zinc/07/77/71/868077771.db2.gz GRGNRVNZLCUFLP-UHFFFAOYSA-N 0 3 402.283 4.210 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)C[C@H](Cc2ccccc2)c2ccccc2)C[C@H](C)O1 ZINC000443664745 868270956 /nfs/dbraw/zinc/27/09/56/868270956.db2.gz FPRQBNPHXQCBJC-FBLLAGFSSA-N 0 3 408.586 4.409 20 0 HIADHN CC[C@@H](CC(=O)Nc1cccc(CN2CCC(CO)CC2)c1)c1ccc(OC)cc1 ZINC000443802197 868338972 /nfs/dbraw/zinc/33/89/72/868338972.db2.gz OOOORQAUWPAGFF-NRFANRHFSA-N 0 3 410.558 4.422 20 0 HIADHN Cc1oc2ccc(NC(=O)C(=O)N[C@H](C)[C@@H](c3ccccc3C)N(C)C)cc2c1C ZINC000443846739 868376917 /nfs/dbraw/zinc/37/69/17/868376917.db2.gz WNPWXZGSFWOEGJ-ZHRRBRCNSA-N 0 3 407.514 4.104 20 0 HIADHN Cc1cc(NC(=O)NCC2(C3CC3)CCC2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000443909411 868445709 /nfs/dbraw/zinc/44/57/09/868445709.db2.gz RKCVLXJJCRTQPT-NRFANRHFSA-N 0 3 407.562 4.340 20 0 HIADHN COc1ccc(NC(=O)N(CCN(C)C)CC(C)C)cc1NC(=O)C1CCCCC1 ZINC000443912577 868448544 /nfs/dbraw/zinc/44/85/44/868448544.db2.gz CTLZVWAYEUXDAN-UHFFFAOYSA-N 0 3 418.582 4.266 20 0 HIADHN Cc1nc2ccc(Br)cc2c(N2CCCC[C@H](S(C)(=O)=O)C2)c1C ZINC000443959740 868494025 /nfs/dbraw/zinc/49/40/25/868494025.db2.gz IPZWNCCUTNFOEU-HNNXBMFYSA-N 0 3 411.365 4.018 20 0 HIADHN CCOC1CC(CNc2cc(C)nc3c(C)cc(Cl)cc23)(N2CCOCC2)C1 ZINC000443967296 868498974 /nfs/dbraw/zinc/49/89/74/868498974.db2.gz VDUOPIGCRSPDBH-UHFFFAOYSA-N 0 3 403.954 4.187 20 0 HIADHN FC(F)(F)c1ncc(CN[C@@H]2CCN(c3ccccc3Br)C2)s1 ZINC000443983687 868508599 /nfs/dbraw/zinc/50/85/99/868508599.db2.gz FUFFDCZDQXDWAP-SNVBAGLBSA-N 0 3 406.271 4.293 20 0 HIADHN Cc1ccc(-c2nc(CNC[C@H](CO)Cc3cc(F)c(F)c(F)c3)cs2)cc1 ZINC000443999508 868520135 /nfs/dbraw/zinc/52/01/35/868520135.db2.gz COLXEIAGDSORNX-OAHLLOKOSA-N 0 3 406.473 4.477 20 0 HIADHN COc1ccc(C2(NCc3ccc(OC(C)C)c(OC)c3)CCOCC2)cc1F ZINC000444009753 868532549 /nfs/dbraw/zinc/53/25/49/868532549.db2.gz NYCUHZHNLDXYGY-UHFFFAOYSA-N 0 3 403.494 4.426 20 0 HIADHN COc1ccc(C2(NCc3ccc(OC(F)F)c(OC)c3)CCOCC2)cc1F ZINC000444014655 868539067 /nfs/dbraw/zinc/53/90/67/868539067.db2.gz QJDHFHACJBSIJJ-UHFFFAOYSA-N 0 3 411.420 4.240 20 0 HIADHN CC(C)CN(CCN(C)C)C(=O)Nc1ccc(Br)cc1Br ZINC000444019644 868544527 /nfs/dbraw/zinc/54/45/27/868544527.db2.gz CXCVONBVNRPSRX-UHFFFAOYSA-N 0 3 421.177 4.263 20 0 HIADHN Cc1cc(C(=O)N2CCCC[C@H]2C)ccc1NC(=O)N(CCN(C)C)CC(C)C ZINC000444028816 868561165 /nfs/dbraw/zinc/56/11/65/868561165.db2.gz AIYYECYLYHALMY-LJQANCHMSA-N 0 3 402.583 4.061 20 0 HIADHN O=S(=O)(Nc1cccc(CN2CCCCC2)c1)c1ccc(OCC(F)F)cc1 ZINC000444030302 868563323 /nfs/dbraw/zinc/56/33/23/868563323.db2.gz DXEIAPAJQFFXQW-UHFFFAOYSA-N 0 3 410.486 4.117 20 0 HIADHN CCCN(CC(=O)Nc1c(C)nn(-c2ccc(C)cc2)c1C)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000444232242 868680396 /nfs/dbraw/zinc/68/03/96/868680396.db2.gz OVAIOYOFLZWFJK-HUVFLSCGSA-N 0 3 424.589 4.262 20 0 HIADHN CC[C@H](Cc1ccc(C)cc1)N(CC)Cc1nc2cc(C(=O)OC)ccc2c(=O)[nH]1 ZINC000444233510 868681628 /nfs/dbraw/zinc/68/16/28/868681628.db2.gz BTGHPFCUAHUTCK-LJQANCHMSA-N 0 3 407.514 4.274 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1noc2c1CCCCC2 ZINC000444254563 868700565 /nfs/dbraw/zinc/70/05/65/868700565.db2.gz XTYCBQXIOAQINJ-IBGZPJMESA-N 0 3 419.529 4.148 20 0 HIADHN CCCOc1ccc(C(=O)CNC(=O)C2(C)CCN(Cc3ccccc3)CC2)cc1 ZINC000444297003 868725901 /nfs/dbraw/zinc/72/59/01/868725901.db2.gz WFPAAFRKZAANJJ-UHFFFAOYSA-N 0 3 408.542 4.077 20 0 HIADHN Cc1ccc(NC(=O)N2CCN(Cc3ccccc3)C3(CCCCC3)C2)cc1C(N)=O ZINC000444391580 868805480 /nfs/dbraw/zinc/80/54/80/868805480.db2.gz KWADMKIFNWDKAA-UHFFFAOYSA-N 0 3 420.557 4.147 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)c1cc(C2CC2)nc2ccc(F)cc21 ZINC000444447946 868832220 /nfs/dbraw/zinc/83/22/20/868832220.db2.gz BAKFOFBNKHYUPH-UHFFFAOYSA-N 0 3 419.500 4.460 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)[C@@H]1C[C@@H]1c1ccccc1C(F)(F)F ZINC000444448157 868832266 /nfs/dbraw/zinc/83/22/66/868832266.db2.gz BKUHFASFFSBQOL-WOJBJXKFSA-N 0 3 418.459 4.404 20 0 HIADHN CCN1CCN(CCC(=O)Nc2ccc(-c3nc4ccc(C)cc4s3)cc2)CC1 ZINC000468309572 882236409 /nfs/dbraw/zinc/23/64/09/882236409.db2.gz OYCDYDAHHVCOHB-UHFFFAOYSA-N 0 3 408.571 4.238 20 0 HIADHN Cc1cc(OC(F)F)c(C(=O)Nc2cccc(CN3CCC(CO)CC3)c2)s1 ZINC000444546559 868877838 /nfs/dbraw/zinc/87/78/38/868877838.db2.gz MUFGUQMZTOVZCD-UHFFFAOYSA-N 0 3 410.486 4.115 20 0 HIADHN Fc1ccccc1-c1noc(CN2CCC[C@H](c3n[nH]c(C4CCCCC4)n3)C2)n1 ZINC000444605115 868900054 /nfs/dbraw/zinc/90/00/54/868900054.db2.gz BZSHLNHCSIHBRN-INIZCTEOSA-N 0 3 410.497 4.421 20 0 HIADHN C[C@H](O)CC(C)(C)CNC(=O)N1CCN(Cc2ccccc2)C2(CCCCC2)C1 ZINC000444703426 868965403 /nfs/dbraw/zinc/96/54/03/868965403.db2.gz KQPXNKCXHGEXJV-FQEVSTJZSA-N 0 3 401.595 4.014 20 0 HIADHN Cc1noc(C)c1C[C@H](C)NC(=O)N1CCN(Cc2ccccc2)C2(CCCCC2)C1 ZINC000444705276 868966795 /nfs/dbraw/zinc/96/67/95/868966795.db2.gz MHTCLXURFLPPGM-IBGZPJMESA-N 0 3 424.589 4.453 20 0 HIADHN CC(C)(C)[C@H](CO)NCC(=O)Nc1nc(-c2ccc(Cl)cc2Cl)cs1 ZINC000444709633 868968033 /nfs/dbraw/zinc/96/80/33/868968033.db2.gz SVDXZWZDNHYMJN-AWEZNQCLSA-N 0 3 402.347 4.052 20 0 HIADHN Cc1cc(N2CCCC[C@@H]2C)ccc1NC(=O)N(CCN(C)C)Cc1ccccn1 ZINC000468317889 882247213 /nfs/dbraw/zinc/24/72/13/882247213.db2.gz QLODRJMVBIEFCI-FQEVSTJZSA-N 0 3 409.578 4.365 20 0 HIADHN CC(F)(F)c1cccc(NC(=O)NCc2ccccc2CN2CCC(O)CC2)c1 ZINC000444934592 869117381 /nfs/dbraw/zinc/11/73/81/869117381.db2.gz YYTYUUFJVWCMAB-UHFFFAOYSA-N 0 3 403.473 4.077 20 0 HIADHN Cc1cc2cc[nH]c2cc1NC(=O)C(=O)NC[C@H](c1ccccc1)N1CCC(C)CC1 ZINC000445066118 869201576 /nfs/dbraw/zinc/20/15/76/869201576.db2.gz ONMKOSWGROJUKC-HSZRJFAPSA-N 0 3 418.541 4.004 20 0 HIADHN CC1CCN([C@H](CNC(=O)N(C)Cc2cc(C(C)(C)C)n[nH]2)c2ccccc2)CC1 ZINC000445077774 869203890 /nfs/dbraw/zinc/20/38/90/869203890.db2.gz HORAOEHWTUVWRS-OAQYLSRUSA-N 0 3 411.594 4.322 20 0 HIADHN Cc1ccccc1[C@H](CC(F)(F)F)NC(=O)NC1CCN(CCOC(C)C)CC1 ZINC000445123663 869230198 /nfs/dbraw/zinc/23/01/98/869230198.db2.gz HNIDRQZJBGTTLO-IBGZPJMESA-N 0 3 415.500 4.177 20 0 HIADHN Cc1ccc(NC(=O)Cc2noc(C3CCN(Cc4ccccc4)CC3)n2)c(C)c1 ZINC000445367472 869437336 /nfs/dbraw/zinc/43/73/36/869437336.db2.gz XLNBEKGOPDOOMP-UHFFFAOYSA-N 0 3 404.514 4.247 20 0 HIADHN O=C(N1CCO[C@@H](c2ccsc2)C1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000468361514 882301672 /nfs/dbraw/zinc/30/16/72/882301672.db2.gz ZODBAHXHSVBPQN-QUCCMNQESA-N 0 3 424.488 4.103 20 0 HIADHN CCN1CCN(c2ccc(N[C@H](C)c3nc(Cc4ccc(F)cc4)no3)c(C)c2)CC1 ZINC000445583028 869642716 /nfs/dbraw/zinc/64/27/16/869642716.db2.gz LLWABPNGDGYKBF-GOSISDBHSA-N 0 3 423.536 4.423 20 0 HIADHN Cc1ccc(Oc2ccc(Cl)cc2NC(=O)CN[C@@H]2CCCC[C@H]2C(N)=O)cc1 ZINC000445766786 869810863 /nfs/dbraw/zinc/81/08/63/869810863.db2.gz MECOMKRCCFXHGN-QZTJIDSGSA-N 0 3 415.921 4.013 20 0 HIADHN CCN(CC(=O)Nc1ccc2c(c1)OCCO2)CC1CCC(C(F)(F)F)CC1 ZINC000468404927 882347066 /nfs/dbraw/zinc/34/70/66/882347066.db2.gz GOCIRHYFJKGGDQ-UHFFFAOYSA-N 0 3 400.441 4.087 20 0 HIADHN Cc1nc(CC(C)C)c(C(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)s1 ZINC000445942657 869902856 /nfs/dbraw/zinc/90/28/56/869902856.db2.gz DDJLJPFLNAZGJH-IRXDYDNUSA-N 0 3 407.624 4.002 20 0 HIADHN CC1CCN([C@H](CNC(=O)Nc2cn(C)nc2C(F)(F)F)c2ccccc2)CC1 ZINC000446354133 870264082 /nfs/dbraw/zinc/26/40/82/870264082.db2.gz DDEURHTYXYZPNT-QGZVFWFLSA-N 0 3 409.456 4.034 20 0 HIADHN COc1cc(SC)ccc1NC(=O)N(CCCc1ccccc1)CCN(C)C ZINC000446407685 870311914 /nfs/dbraw/zinc/31/19/14/870311914.db2.gz BCCKGIVTFQIMHY-UHFFFAOYSA-N 0 3 401.576 4.445 20 0 HIADHN Cc1nn(C(C)(C)C)c2nc(C3CC3)cc(C(=O)N(CCN(C)C)Cc3ccco3)c12 ZINC000446434446 870353548 /nfs/dbraw/zinc/35/35/48/870353548.db2.gz ZTRPCBGZWYOFMF-UHFFFAOYSA-N 0 3 423.561 4.169 20 0 HIADHN CC(C)N(C)c1ccccc1CNC(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000446567029 870478918 /nfs/dbraw/zinc/47/89/18/870478918.db2.gz VNRPMRSJWBXSQC-HXUWFJFHSA-N 0 3 400.592 4.229 20 0 HIADHN COc1cccc([C@@H](CNC(=O)N[C@@H](CC(F)(F)F)C(C)C)N2CCCC2)c1 ZINC000446569788 870481724 /nfs/dbraw/zinc/48/17/24/870481724.db2.gz SBFHVSONTGWTQN-ZWKOTPCHSA-N 0 3 401.473 4.108 20 0 HIADHN COc1ccc(CN[C@H](CCn2cncn2)c2ccc(C)cc2)cc1OC(F)F ZINC000446745305 870652159 /nfs/dbraw/zinc/65/21/59/870652159.db2.gz RFZWWSNTDDSSNN-GOSISDBHSA-N 0 3 402.445 4.118 20 0 HIADHN C[C@@H](NC[C@H](c1cccs1)N1CCOCC1)c1ccc(Br)cc1F ZINC000446743902 870652384 /nfs/dbraw/zinc/65/23/84/870652384.db2.gz WRXGXKJNPPFUJP-CXAGYDPISA-N 0 3 413.356 4.374 20 0 HIADHN Cc1cccc(Oc2cc(CNC(=O)N(CCN(C)C)Cc3ccco3)ccn2)c1C ZINC000446776253 870689513 /nfs/dbraw/zinc/68/95/13/870689513.db2.gz KEIXAJBPTFSLJH-UHFFFAOYSA-N 0 3 422.529 4.357 20 0 HIADHN COc1ccc(-c2ccncc2)cc1CN(C[C@H](O)COc1ccccc1)C(C)C ZINC000446832367 870749644 /nfs/dbraw/zinc/74/96/44/870749644.db2.gz BFSQAAHUKJJDLT-QHCPKHFHSA-N 0 3 406.526 4.408 20 0 HIADHN Cc1cc(C(=O)NC2CCN(CCc3cccc(OC(F)(F)F)c3)CC2)c(C)o1 ZINC000446835101 870750958 /nfs/dbraw/zinc/75/09/58/870750958.db2.gz ZYDGDXMFQOJXJL-UHFFFAOYSA-N 0 3 410.436 4.232 20 0 HIADHN COc1ccc([C@H](CCn2cncn2)NCc2ccc(Oc3ccccc3)nc2)cc1 ZINC000446838250 870756010 /nfs/dbraw/zinc/75/60/10/870756010.db2.gz GIRBXPANBDKPFT-QHCPKHFHSA-N 0 3 415.497 4.395 20 0 HIADHN CCOC(=O)C1CCN(C(=O)C[C@@H](C)N[C@@H](C)c2ccc(Cl)cc2Cl)CC1 ZINC000446849171 870768743 /nfs/dbraw/zinc/76/87/43/870768743.db2.gz WJOLGLDEKCSXTI-KGLIPLIRSA-N 0 3 415.361 4.224 20 0 HIADHN C[C@H](CC(=O)Nc1cccc(Br)c1)NCc1ccc2c(n1)CCCC2 ZINC000446896615 870815810 /nfs/dbraw/zinc/81/58/10/870815810.db2.gz PLZVCUDBSIMYRC-CQSZACIVSA-N 0 3 402.336 4.230 20 0 HIADHN COc1ccc([C@@H](CCn2cncn2)Nc2cccc(CN3CCSCC3)c2)cc1 ZINC000446938204 870848598 /nfs/dbraw/zinc/84/85/98/870848598.db2.gz HMMRPKURCBAIHH-HSZRJFAPSA-N 0 3 423.586 4.079 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3CC[C@@](C)(c4ccccc4)C3)c(C)c2)CC1 ZINC000446946620 870854670 /nfs/dbraw/zinc/85/46/70/870854670.db2.gz AEAHTEPLDZFJSD-RUZDIDTESA-N 0 3 406.574 4.332 20 0 HIADHN COC(=O)[C@](C)(CN[C@H](C)C(=O)Nc1cccc2ccccc21)c1ccc(F)cc1 ZINC000447019912 870896368 /nfs/dbraw/zinc/89/63/68/870896368.db2.gz ZEEGTZMYXFABPN-VOIUYBSRSA-N 0 3 408.473 4.026 20 0 HIADHN CC[C@H](C)c1ccccc1NC(=O)[C@@H](C)NC[C@@](C)(C(=O)OC)c1ccc(F)cc1 ZINC000447033544 870909402 /nfs/dbraw/zinc/90/94/02/870909402.db2.gz JBHHQFXZENLDTD-OBWXTZQISA-N 0 3 414.521 4.387 20 0 HIADHN CC[C@H](C)Sc1ccc(NC(=O)C(=O)N(CCN(C)C)Cc2ccco2)c(C)c1 ZINC000447041894 870919118 /nfs/dbraw/zinc/91/91/18/870919118.db2.gz XXECXRUPPJQNQL-KRWDZBQOSA-N 0 3 417.575 4.008 20 0 HIADHN CC[C@@H](C)Sc1ccc(NC(=O)C(=O)N(CCN(C)C)Cc2ccco2)c(C)c1 ZINC000447041895 870919599 /nfs/dbraw/zinc/91/95/99/870919599.db2.gz XXECXRUPPJQNQL-QGZVFWFLSA-N 0 3 417.575 4.008 20 0 HIADHN COC1(CO)CCN(Cc2cn(-c3ccccc3)nc2-c2ccc(C)cc2C)CC1 ZINC000447054785 870934533 /nfs/dbraw/zinc/93/45/33/870934533.db2.gz BPOXTCJPDUDGHQ-UHFFFAOYSA-N 0 3 405.542 4.129 20 0 HIADHN Cc1ccc(NC(=O)C(C)(C)C)cc1NC(=O)N(CCN(C)C)Cc1ccco1 ZINC000447058942 870937975 /nfs/dbraw/zinc/93/79/75/870937975.db2.gz JFOHYNBHDFJERR-UHFFFAOYSA-N 0 3 400.523 4.168 20 0 HIADHN COCCn1cc(CN2CCC[C@@H](c3nc(-c4ccccc4OC)cs3)C2)cn1 ZINC000447068093 870948983 /nfs/dbraw/zinc/94/89/83/870948983.db2.gz QFXYXYUXAJWIRY-GOSISDBHSA-N 0 3 412.559 4.041 20 0 HIADHN Fc1cccnc1OC1CCN(Cc2ccc(-n3ccc(C(F)(F)F)n3)cc2)CC1 ZINC000447095899 870992800 /nfs/dbraw/zinc/99/28/00/870992800.db2.gz FHXPIIQDVWYWFF-UHFFFAOYSA-N 0 3 420.410 4.469 20 0 HIADHN COc1ccccc1-c1csc([C@@H]2CCCN(C(=O)CN3[C@H](C)CC[C@H]3C)C2)n1 ZINC000447149959 871048129 /nfs/dbraw/zinc/04/81/29/871048129.db2.gz COMKMXRSKGTPAG-KZNAEPCWSA-N 0 3 413.587 4.398 20 0 HIADHN Cc1ccc(NC(=O)N(CCN(C)C)Cc2ccc(Br)cc2)c(C)n1 ZINC000447167303 871061919 /nfs/dbraw/zinc/06/19/19/871061919.db2.gz ODXFBJOFANKYNW-UHFFFAOYSA-N 0 3 405.340 4.057 20 0 HIADHN C[C@@H](NC(=O)N(CCN(C)C)Cc1ccc(F)cc1)c1cccc(N2CCCC2)c1 ZINC000447226734 871111826 /nfs/dbraw/zinc/11/18/26/871111826.db2.gz MMRWADBQSUEYTH-LJQANCHMSA-N 0 3 412.553 4.260 20 0 HIADHN COCCO[C@H]1C[C@@H](CO)CN(Cc2ccc(Oc3ccc(Cl)cc3C)cc2)C1 ZINC000447380112 871284861 /nfs/dbraw/zinc/28/48/61/871284861.db2.gz CWEBVDUXXSTUMN-KNQAVFIVSA-N 0 3 419.949 4.287 20 0 HIADHN COc1ccccc1-c1csc([C@@H]2CCCN(C[C@@H](O)CC(F)(F)F)C2)n1 ZINC000447402630 871310925 /nfs/dbraw/zinc/31/09/25/871310925.db2.gz LBFLQXJPKBIXPA-KGLIPLIRSA-N 0 3 400.466 4.311 20 0 HIADHN CN(C)Cc1ccsc1C(=O)NCC1CCN(Cc2ccccc2Cl)CC1 ZINC000447429929 871335453 /nfs/dbraw/zinc/33/54/53/871335453.db2.gz CENVAUUXRGWKTO-UHFFFAOYSA-N 0 3 405.995 4.105 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)c1ccnc(Oc2ccc(F)cc2F)c1 ZINC000468504172 882505031 /nfs/dbraw/zinc/50/50/31/882505031.db2.gz HVCZLKSYKRSQOF-UHFFFAOYSA-N 0 3 411.452 4.356 20 0 HIADHN CC(C)[C@@H]1C[C@@H](NCc2ccccc2OCC(=O)NC[C@@H]2CCCO2)c2ccccc21 ZINC000447539865 871403017 /nfs/dbraw/zinc/40/30/17/871403017.db2.gz HWNGCJZQUAFGLW-NKKJXINNSA-N 0 3 422.569 4.335 20 0 HIADHN Cc1cc(C(=O)Nc2cccc(N3CCN(CCc4ccccc4)CC3)c2)ccn1 ZINC000447544068 871412114 /nfs/dbraw/zinc/41/21/14/871412114.db2.gz TZMGOBFTKKOKBG-UHFFFAOYSA-N 0 3 400.526 4.007 20 0 HIADHN COC(=O)c1coc([C@@H](C)NCCCOc2ncc(C(F)(F)F)cc2Cl)c1 ZINC000447576531 871475660 /nfs/dbraw/zinc/47/56/60/871475660.db2.gz ZCRUYYYWRSQKNV-SNVBAGLBSA-N 0 3 406.788 4.253 20 0 HIADHN O=S1(=O)CCCN1c1cccc(CN[C@@H](Cc2ccc(F)cc2)c2ccccc2)c1 ZINC000447600248 871507825 /nfs/dbraw/zinc/50/78/25/871507825.db2.gz LKXCEOQFYKKDJA-DEOSSOPVSA-N 0 3 424.541 4.439 20 0 HIADHN CCSCc1ccccc1C(=O)N(C)C[C@@H]1CCCN(CC)[C@H]1c1cnn(C)c1 ZINC000447606179 871513628 /nfs/dbraw/zinc/51/36/28/871513628.db2.gz LNLRIPBHZXAOLM-PGRDOPGGSA-N 0 3 414.619 4.218 20 0 HIADHN C[C@H](CC1CCOCC1)N[C@H](c1ccc(F)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000468519562 882530336 /nfs/dbraw/zinc/53/03/36/882530336.db2.gz WCILNQZSIUWOFK-OPAMFIHVSA-N 0 3 405.535 4.113 20 0 HIADHN CC(C)(C)c1cnc(CNC[C@@H](CO)Cc2ccc(OC(F)(F)F)cc2)s1 ZINC000447895011 871806987 /nfs/dbraw/zinc/80/69/87/871806987.db2.gz XBMDJECQOXROKU-AWEZNQCLSA-N 0 3 402.482 4.280 20 0 HIADHN CC(=O)N(c1nc(CNC[C@@H]2N(C)CCCC2(C)C)cs1)c1ccc(C)cc1 ZINC000447905491 871810447 /nfs/dbraw/zinc/81/04/47/871810447.db2.gz UKFKFPBWIWJIGS-FQEVSTJZSA-N 0 3 400.592 4.346 20 0 HIADHN C[C@H]1OCC[C@]1(O)CN(Cc1ccccc1)Cc1ccccc1Oc1cccnc1 ZINC000447926753 871815601 /nfs/dbraw/zinc/81/56/01/871815601.db2.gz NFMNQMJRAVWLHV-NLFFAJNJSA-N 0 3 404.510 4.416 20 0 HIADHN CCOc1ccc(C(=O)N2CCC(NCc3ncc(C(C)(C)C)s3)CC2)cc1 ZINC000447938089 871819174 /nfs/dbraw/zinc/81/91/74/871819174.db2.gz ZFZJHIWFXNNVEI-UHFFFAOYSA-N 0 3 401.576 4.234 20 0 HIADHN Cc1oc2ccccc2c1CNC(=O)N(CCN(C)C)Cc1ccc(F)c(F)c1 ZINC000468531548 882554831 /nfs/dbraw/zinc/55/48/31/882554831.db2.gz WJJWRGVBACESPB-UHFFFAOYSA-N 0 3 401.457 4.293 20 0 HIADHN Clc1ccc(-c2nc3sccn3c2CN2CCC[C@H]2CN2CCOCC2)cc1 ZINC000448033800 871868825 /nfs/dbraw/zinc/86/88/25/871868825.db2.gz DVPMOJFVAOXVHW-SFHVURJKSA-N 0 3 416.978 4.013 20 0 HIADHN CO[C@@H]1CCOc2c(NC(=O)NC[C@@H](c3cccs3)N3CCCC3)cccc21 ZINC000448049937 871880535 /nfs/dbraw/zinc/88/05/35/871880535.db2.gz MKYUOJBVGWKUAV-ZWKOTPCHSA-N 0 3 401.532 4.177 20 0 HIADHN CO[C@H]1CCOc2c(NC(=O)N3CC[C@@H](C)N(Cc4ccccc4)CC3)cccc21 ZINC000448055047 871884653 /nfs/dbraw/zinc/88/46/53/871884653.db2.gz FDFQOANMOGMSDG-GCJKJVERSA-N 0 3 409.530 4.285 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NC[C@@H]1CCSC1)c1ccc(C(F)(F)F)cc1 ZINC000448169159 872043929 /nfs/dbraw/zinc/04/39/29/872043929.db2.gz JSYUKMPNTJPQNR-YOEHRIQHSA-N 0 3 403.514 4.141 20 0 HIADHN Fc1cccc(-c2noc([C@@H]3CCCN(Cc4ccnn4-c4ccccc4)C3)n2)c1 ZINC000448342775 872287673 /nfs/dbraw/zinc/28/76/73/872287673.db2.gz GXZGIGUKGGQIKC-GOSISDBHSA-N 0 3 403.461 4.441 20 0 HIADHN COc1cc(CN2C[C@H](O)C(C)(C)C2)ccc1OCCOc1ccccc1Cl ZINC000448369128 872320307 /nfs/dbraw/zinc/32/03/07/872320307.db2.gz XROIFCAYAIWAFO-NRFANRHFSA-N 0 3 405.922 4.009 20 0 HIADHN Cc1cc(C[C@H](C)NC(=O)c2cccc(CN3CCCC3)c2)n(-c2ccccc2)n1 ZINC000448445784 872388196 /nfs/dbraw/zinc/38/81/96/872388196.db2.gz ITAALPBZWRZMEI-IBGZPJMESA-N 0 3 402.542 4.138 20 0 HIADHN CCN(C(=O)Nc1cc(OC)c(Cl)cc1OC)[C@H]1CCN(Cc2ccccc2)C1 ZINC000460115713 872583385 /nfs/dbraw/zinc/58/33/85/872583385.db2.gz WCHZIUUVZKJCQT-KRWDZBQOSA-N 0 3 417.937 4.486 20 0 HIADHN CCN(C(=O)Nc1cccc(OC[C@@H]2CCCO2)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000460127234 872605015 /nfs/dbraw/zinc/60/50/15/872605015.db2.gz CHYQLWCWRYLGIZ-UPVQGACJSA-N 0 3 423.557 4.373 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N2CCCC[C@@H]2c2nnc(C3CCC3)o2)N(C)C)cc1 ZINC000460140200 872638103 /nfs/dbraw/zinc/63/81/03/872638103.db2.gz ADUUSYDGXVJJCF-WOJBJXKFSA-N 0 3 411.550 4.185 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N2CCCC[C@H]2c2nnc(C3CCC3)o2)N(C)C)cc1 ZINC000460140199 872638694 /nfs/dbraw/zinc/63/86/94/872638694.db2.gz ADUUSYDGXVJJCF-VQTJNVASSA-N 0 3 411.550 4.185 20 0 HIADHN CCCN(CCN1CCN(CC)CC1)C(=O)N[C@H](c1cccc(F)c1)C1CCCC1 ZINC000460504209 873189947 /nfs/dbraw/zinc/18/99/47/873189947.db2.gz NMGZYQCBBZXNPK-QHCPKHFHSA-N 0 3 418.601 4.116 20 0 HIADHN C[C@H]1CN(C(=O)CCCN2CCN(c3ccccc3)CC2)CC[C@@H]1c1ccccc1 ZINC000460642176 873382543 /nfs/dbraw/zinc/38/25/43/873382543.db2.gz INIWVXOGPJPTOV-DHLKQENFSA-N 0 3 405.586 4.241 20 0 HIADHN C[C@@H](CN(C)Cc1ccccc1)NC(=O)N1CCCC[C@@H]1c1nnc(C2CCC2)o1 ZINC000460648647 873389441 /nfs/dbraw/zinc/38/94/41/873389441.db2.gz MBJXPPMDQFGKLH-FXAWDEMLSA-N 0 3 411.550 4.094 20 0 HIADHN O=S1(=O)CCCN1c1ccc(CN[C@@H]2CCc3c2cc(Cl)cc3Cl)cc1 ZINC000460676286 873423913 /nfs/dbraw/zinc/42/39/13/873423913.db2.gz WPLHLJCKHJYIMF-LJQANCHMSA-N 0 3 411.354 4.310 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)[C@H]3CCSc4ccccc43)CC2)c1 ZINC000460717145 873512315 /nfs/dbraw/zinc/51/23/15/873512315.db2.gz PGSBGMPHEGCILV-QHCPKHFHSA-N 0 3 423.626 4.293 20 0 HIADHN O=C(NCc1cccc(-c2cccnc2)c1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000468616963 882732676 /nfs/dbraw/zinc/73/26/76/882732676.db2.gz DERCESMFNNPRBM-HSZRJFAPSA-N 0 3 403.501 4.416 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1ccc(OC2CCOCC2)cc1)c1ccsc1 ZINC000460736469 873558086 /nfs/dbraw/zinc/55/80/86/873558086.db2.gz PBFKJLKTLITKFL-NRFANRHFSA-N 0 3 402.560 4.119 20 0 HIADHN C[C@@H](Oc1cccc(Br)c1)C(=O)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000460804705 873679409 /nfs/dbraw/zinc/67/94/09/873679409.db2.gz JUYLAUDIVZVFQM-UZLBHIALSA-N 0 3 417.347 4.170 20 0 HIADHN COc1cccc([C@@H](CNC(=O)c2c[nH]cc2-c2ccc(F)cc2)N2CCCC2)c1 ZINC000460816844 873697783 /nfs/dbraw/zinc/69/77/83/873697783.db2.gz XJAOMJSKUUUONH-HSZRJFAPSA-N 0 3 407.489 4.396 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N1CCCC[C@H]1c1nnc(C2CCC2)o1 ZINC000460901197 873809697 /nfs/dbraw/zinc/80/96/97/873809697.db2.gz WXUJJILJTGSCHX-QMMLZNLJSA-N 0 3 423.561 4.094 20 0 HIADHN COCCCOc1cccc(C(=O)NC[C@@H](c2ccccc2)N2CCC(C)CC2)c1 ZINC000460962029 873858335 /nfs/dbraw/zinc/85/83/35/873858335.db2.gz IJAMKSYWPDHNIY-DEOSSOPVSA-N 0 3 410.558 4.305 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)c2c[nH]cc2-c2ccc3c(c2)OCCO3)C1 ZINC000460973798 873868467 /nfs/dbraw/zinc/86/84/67/873868467.db2.gz OSSIVCWIKRKKQN-PXNSSMCTSA-N 0 3 417.509 4.018 20 0 HIADHN Cc1cc(C)c(Br)c(C(=O)N2CCC(CN3C[C@H](C)O[C@@H](C)C3)CC2)c1 ZINC000460976117 873869832 /nfs/dbraw/zinc/86/98/32/873869832.db2.gz CEKVYRSYVNFWFS-IRXDYDNUSA-N 0 3 423.395 4.027 20 0 HIADHN O=C(CC1(N2CCOCC2)CCCC1)N(Cc1ccccc1)Cc1ccccc1F ZINC000468637428 882770263 /nfs/dbraw/zinc/77/02/63/882770263.db2.gz GCOUKKZGKWNECO-UHFFFAOYSA-N 0 3 410.533 4.390 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N1CCCC[C@H]1c1nnc(C2CCC2)o1)c1ccco1 ZINC000461025678 873891900 /nfs/dbraw/zinc/89/19/00/873891900.db2.gz MGAPMSTVTTUUFI-JQHSSLGASA-N 0 3 415.538 4.296 20 0 HIADHN COc1ccc2oc([C@H](C)NCc3ccc(N4CCCS4(=O)=O)cc3)c(C)c2c1 ZINC000461095094 874011982 /nfs/dbraw/zinc/01/19/82/874011982.db2.gz WPGUYFXWYFNFJQ-INIZCTEOSA-N 0 3 414.527 4.141 20 0 HIADHN C[C@H](NC(=O)NC[C@H](Cc1ccccc1)C(F)(F)F)[C@@H](c1ccccc1)N(C)C ZINC000461214986 874218075 /nfs/dbraw/zinc/21/80/75/874218075.db2.gz AMULWBYNOTYIDG-VDGAXYAQSA-N 0 3 407.480 4.398 20 0 HIADHN C[C@H](C(=O)N1CC[C@@H](COCc2ccccc2)C1)N1CCC(Cc2ccccc2)CC1 ZINC000461372547 874376609 /nfs/dbraw/zinc/37/66/09/874376609.db2.gz CKRJCDPLVIQUBN-ATIYNZHBSA-N 0 3 420.597 4.395 20 0 HIADHN COc1ccc([C@H](Cc2ccccc2C)NC(=O)CN2[C@H](C)CC[C@@H]2C)cc1OC ZINC000468704485 882822148 /nfs/dbraw/zinc/82/21/48/882822148.db2.gz VIQMLTBEKDSBLB-JQVVWYNYSA-N 0 3 410.558 4.285 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccc(F)c2)C1)N1CC[C@@H](COCc2ccccc2)C1 ZINC000461380186 874386469 /nfs/dbraw/zinc/38/64/69/874386469.db2.gz APSJLVHCTSWFNO-DHIUTWEWSA-N 0 3 410.533 4.103 20 0 HIADHN OCC[C@@H](NCc1nc(-c2cc(Cl)ccc2Cl)cs1)C1CCOCC1 ZINC000461404060 874413616 /nfs/dbraw/zinc/41/36/16/874413616.db2.gz FUIWFGDVJZZCPT-MRXNPFEDSA-N 0 3 401.359 4.384 20 0 HIADHN CC(=O)c1c(C)[nH]c(C(=O)N2C[C@H]3CCN(Cc4ccccc4)C[C@H]3C2)c1C(C)C ZINC000461434447 874484204 /nfs/dbraw/zinc/48/42/04/874484204.db2.gz SJMANPZQSBIOPP-RTWAWAEBSA-N 0 3 407.558 4.243 20 0 HIADHN CCOC(=O)[C@@](C)(CN[C@H](C)C(=O)Nc1c(C)cc(C)cc1Cl)c1ccccc1 ZINC000468826943 882878727 /nfs/dbraw/zinc/87/87/27/882878727.db2.gz CMLYSMGYCSJUHP-HXOBKFHXSA-N 0 3 416.949 4.394 20 0 HIADHN CCOC(=O)[C@@](C)(CN[C@H](C)C(=O)Nc1cccc(Cl)c1Cl)c1ccccc1 ZINC000468827571 882878961 /nfs/dbraw/zinc/87/89/61/882878961.db2.gz DJDMEYYTROJDQF-SZNDQCEHSA-N 0 3 423.340 4.431 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)N[C@@H]2CCCc3cn(C4CCCC4)nc32)c1 ZINC000461958621 875086707 /nfs/dbraw/zinc/08/67/07/875086707.db2.gz NLAAJLYONKRMJG-HSZRJFAPSA-N 0 3 423.605 4.457 20 0 HIADHN CCCN(C(=O)c1ccc(-c2n[nH]c(C)n2)cc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000461991637 875111362 /nfs/dbraw/zinc/11/13/62/875111362.db2.gz YKCRYBHNGCLUDR-QHCPKHFHSA-N 0 3 417.557 4.297 20 0 HIADHN CCOC(=O)[C@](C)(CN[C@@H](C)C(=O)Nc1cc(Cl)ccc1C)c1ccccc1 ZINC000468865184 882896662 /nfs/dbraw/zinc/89/66/62/882896662.db2.gz FFAWDPMZICWPJF-KSFYIVLOSA-N 0 3 402.922 4.086 20 0 HIADHN CN(C(=O)N[C@@H]1CCc2sc(Cl)cc21)C1CCN(CCc2ccccn2)CC1 ZINC000462057567 875170879 /nfs/dbraw/zinc/17/08/79/875170879.db2.gz GRJHWULXEMJFLZ-GOSISDBHSA-N 0 3 418.994 4.132 20 0 HIADHN COc1ccc(CN2CCCN(c3nnc(-c4cccc(F)c4)cc3C)CC2)cc1 ZINC000462088717 875198272 /nfs/dbraw/zinc/19/82/72/875198272.db2.gz FNGLQBJWSUHFLF-UHFFFAOYSA-N 0 3 406.505 4.312 20 0 HIADHN C[C@H](NC(=O)N(CCN(C)C)C1CCCC1)c1ccc(Br)cc1F ZINC000462165351 875261803 /nfs/dbraw/zinc/26/18/03/875261803.db2.gz PPDNDLOGJPDWBS-ZDUSSCGKSA-N 0 3 400.336 4.165 20 0 HIADHN CC(C)C(=O)Nc1ccc(Cl)c(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)c1 ZINC000462181395 875279901 /nfs/dbraw/zinc/27/99/01/875279901.db2.gz KQQJPYAAVSDZRJ-HRAATJIYSA-N 0 3 413.949 4.185 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1ccccc1-c1nc(C(C)(C)C)no1 ZINC000462182543 875283410 /nfs/dbraw/zinc/28/34/10/875283410.db2.gz PPXUJUQJOSTYRW-LAUBAEHRSA-N 0 3 418.541 4.284 20 0 HIADHN Cc1ccc(C(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)cc1NC(=O)c1ccco1 ZINC000462185851 875287895 /nfs/dbraw/zinc/28/78/95/875287895.db2.gz BMJFCTAYVYFKMS-AVRDEDQJSA-N 0 3 417.509 4.091 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)CCc1ncc(-c2ccccc2F)o1 ZINC000462189605 875293667 /nfs/dbraw/zinc/29/36/67/875293667.db2.gz OGEDUJPCUMMVBI-UTKZUKDTSA-N 0 3 407.489 4.050 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)CCc1ncc(-c2ccccc2F)o1 ZINC000462189604 875294441 /nfs/dbraw/zinc/29/44/41/875294441.db2.gz OGEDUJPCUMMVBI-LAUBAEHRSA-N 0 3 407.489 4.050 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)NCc1csc(-c2ccccc2)n1 ZINC000462212659 875320355 /nfs/dbraw/zinc/32/03/55/875320355.db2.gz VFIVTNBDPDYLDT-UTKZUKDTSA-N 0 3 406.555 4.130 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Nc1cc2c(cc1Cl)OCCCO2 ZINC000462247365 875365966 /nfs/dbraw/zinc/36/59/66/875365966.db2.gz NTBMMPSFCNZLDH-DNVCBOLYSA-N 0 3 415.921 4.143 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)Nc1cccc(OCc2cscn2)c1 ZINC000462252255 875374162 /nfs/dbraw/zinc/37/41/62/875374162.db2.gz ATJSGUUUKSMMMG-VGSWGCGISA-N 0 3 422.554 4.364 20 0 HIADHN CC(C)Cn1cc(NC(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)c(C(F)F)n1 ZINC000462281229 875407482 /nfs/dbraw/zinc/40/74/82/875407482.db2.gz YTZCQMWTAXKBGL-WBVHZDCISA-N 0 3 405.493 4.119 20 0 HIADHN Cc1nc(-c2ccc(CNC(=O)N[C@H]3CN(Cc4ccccc4)C[C@H]3C)o2)cs1 ZINC000462308203 875429328 /nfs/dbraw/zinc/42/93/28/875429328.db2.gz IXUYDSHQYOZOQZ-BEFAXECRSA-N 0 3 410.543 4.031 20 0 HIADHN CCN(C(=O)c1ccnc(N2CCC[C@H](C)C2)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000462491420 875602082 /nfs/dbraw/zinc/60/20/82/875602082.db2.gz RALMKBUZAWAZHB-REWPJTCUSA-N 0 3 406.574 4.055 20 0 HIADHN COC(=O)[C@@](C)(CN[C@H](C)C(=O)Nc1cccc(Cl)c1Cl)c1ccccc1 ZINC000468898667 882946489 /nfs/dbraw/zinc/94/64/89/882946489.db2.gz HXXRJIVQYZTUTQ-XCLFUZPHSA-N 0 3 409.313 4.041 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)N[C@H]2c3ccccc3CC23CCOCC3)c1 ZINC000462528903 875646862 /nfs/dbraw/zinc/64/68/62/875646862.db2.gz FNDOYDOLGRUXEU-DEOSSOPVSA-N 0 3 421.585 4.162 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@H]1CCO[C@H](c2ccccc2)C1)c1ccsc1 ZINC000462532311 875650522 /nfs/dbraw/zinc/65/05/22/875650522.db2.gz ZLVNPXUUYRTGAT-HBMCJLEFSA-N 0 3 401.576 4.351 20 0 HIADHN Cc1cc(CNCc2cccc(N3CCCS3(=O)=O)c2)ccc1Oc1cccnc1 ZINC000462545828 875669728 /nfs/dbraw/zinc/66/97/28/875669728.db2.gz DMKRTUXYZWFTPU-UHFFFAOYSA-N 0 3 423.538 4.012 20 0 HIADHN CC(=O)N(Cc1ccc(NC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)cc1)C(C)C ZINC000462561408 875688344 /nfs/dbraw/zinc/68/83/44/875688344.db2.gz USCYYXRPCDSSHQ-NTKDMRAZSA-N 0 3 422.573 4.086 20 0 HIADHN Cc1cc(NC(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)ccc1OC1CCOCC1 ZINC000462671292 875769159 /nfs/dbraw/zinc/76/91/59/875769159.db2.gz BJMFMHKPAUDOSO-CVDCTZTESA-N 0 3 423.557 4.195 20 0 HIADHN Cc1ccc([C@H](CNCc2ccc(Br)cc2Cl)N2CCOCC2)o1 ZINC000462681120 875776754 /nfs/dbraw/zinc/77/67/54/875776754.db2.gz VLOILPPRADKYHS-KRWDZBQOSA-N 0 3 413.743 4.167 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)Nc1c(F)cc(Br)cc1F ZINC000462684744 875778098 /nfs/dbraw/zinc/77/80/98/875778098.db2.gz UOFDFPWYVFGGMN-PXAZEXFGSA-N 0 3 424.289 4.369 20 0 HIADHN Cc1nn(-c2ccccc2)cc1CNCCOc1ncc(C(F)(F)F)cc1Cl ZINC000462730441 875806091 /nfs/dbraw/zinc/80/60/91/875806091.db2.gz WIFAUPFUBYFGHC-UHFFFAOYSA-N 0 3 410.827 4.417 20 0 HIADHN COc1ccc(Br)cc1CNCCc1ccn(-c2ccc(F)cc2)n1 ZINC000462733152 875807187 /nfs/dbraw/zinc/80/71/87/875807187.db2.gz GSHPEBCXLJMOKZ-UHFFFAOYSA-N 0 3 404.283 4.115 20 0 HIADHN OC[C@H](CNCc1ccccc1Br)Cc1cccc(OC(F)(F)F)c1 ZINC000462739629 875811671 /nfs/dbraw/zinc/81/16/71/875811671.db2.gz ORRQGHAEVNBJPQ-AWEZNQCLSA-N 0 3 418.253 4.289 20 0 HIADHN O=C1C[C@H](NCc2ccc(OC(F)F)c(Cl)c2)CN1[C@@H]1C[C@H]1c1ccccc1 ZINC000462752254 875818439 /nfs/dbraw/zinc/81/84/39/875818439.db2.gz BGVTUWRYJSKJSJ-XYJFISCASA-N 0 3 406.860 4.188 20 0 HIADHN COc1cc(CN[C@@H]2CC(=O)N([C@H]3C[C@H]3C)C2)ccc1OCc1ccc(Cl)cc1 ZINC000462755385 875819816 /nfs/dbraw/zinc/81/98/16/875819816.db2.gz KLVHKBNUMCPFGY-YSGRDPCXSA-N 0 3 414.933 4.027 20 0 HIADHN COC(=O)c1cc(CN[C@@H](C)c2sc(-c3ccc(OC)cc3)nc2C)n(C)c1C ZINC000462785542 875838815 /nfs/dbraw/zinc/83/88/15/875838815.db2.gz PBBVVHNJROGESL-ZDUSSCGKSA-N 0 3 413.543 4.411 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)[C@H]1CCn2c(cnc2C2CCCCC2)C1 ZINC000462804746 875851922 /nfs/dbraw/zinc/85/19/22/875851922.db2.gz CKPAMZIWXSWMNL-UCFCWBNQSA-N 0 3 420.601 4.130 20 0 HIADHN C[C@@H](NCc1ccc(N2CCCS2(=O)=O)cc1)c1ccc(OC(C)(C)C)cc1 ZINC000462838725 875873725 /nfs/dbraw/zinc/87/37/25/875873725.db2.gz ZJBSDQINAOKTRR-QGZVFWFLSA-N 0 3 402.560 4.255 20 0 HIADHN COC(=O)[C@@H]1CC12CCN(c1c(C)c(C)nc3ccc(Br)cc31)CC2 ZINC000462839624 875874085 /nfs/dbraw/zinc/87/40/85/875874085.db2.gz NZHJIMJMXMOIFS-INIZCTEOSA-N 0 3 403.320 4.394 20 0 HIADHN CC[C@@H](NCc1cnc(N2CCOCC2)c(F)c1)c1cccc(Br)c1 ZINC000462842195 875877936 /nfs/dbraw/zinc/87/79/36/875877936.db2.gz XBKLMNGZQKZGJT-GOSISDBHSA-N 0 3 408.315 4.061 20 0 HIADHN CC[C@@H](NCc1cnc(N2CCOCC2)c(F)c1)c1ccc(Br)cc1 ZINC000462846991 875881845 /nfs/dbraw/zinc/88/18/45/875881845.db2.gz DMJNPWSEVNYPNW-GOSISDBHSA-N 0 3 408.315 4.061 20 0 HIADHN CCOC(=O)c1csc(CCN[C@@H](C)c2ccc(F)cc2Br)n1 ZINC000468916515 882974817 /nfs/dbraw/zinc/97/48/17/882974817.db2.gz LAFIHHOHXYFYAM-JTQLQIEISA-N 0 3 401.301 4.115 20 0 HIADHN COc1cc(CN2CC[C@@H](O)C2(C)C)ccc1OCCOc1ccccc1Cl ZINC000462873502 875904225 /nfs/dbraw/zinc/90/42/25/875904225.db2.gz XUUUCYYNYQHYMS-OAQYLSRUSA-N 0 3 405.922 4.152 20 0 HIADHN COc1cc(Br)c(CNC[C@H]2CCN(c3ccccc3F)C2)cc1OC ZINC000462908336 875933656 /nfs/dbraw/zinc/93/36/56/875933656.db2.gz JFZMWPOPXJQKBY-CQSZACIVSA-N 0 3 423.326 4.222 20 0 HIADHN C[C@@H](NCc1ccccc1OCCN1CCOCC1)c1ccc(OC(C)(C)C)cc1 ZINC000463006508 876021821 /nfs/dbraw/zinc/02/18/21/876021821.db2.gz DXXMKVGYYDVUEW-HXUWFJFHSA-N 0 3 412.574 4.426 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)cc1OC ZINC000463012514 876028504 /nfs/dbraw/zinc/02/85/04/876028504.db2.gz QMBNDYAJFAXQFE-COPCDDAFSA-N 0 3 423.557 4.071 20 0 HIADHN C[C@H](NCc1ccc(S(=O)(=O)N2CCCC2)cc1)c1ccc(OC(C)(C)C)cc1 ZINC000463028207 876047100 /nfs/dbraw/zinc/04/71/00/876047100.db2.gz LROTVTSZIWKPPH-SFHVURJKSA-N 0 3 416.587 4.499 20 0 HIADHN CC(C)O[C@@H]1C[C@H](N[C@H](c2ccccc2)c2cccc(S(C)(=O)=O)c2)C1(C)C ZINC000463028182 876047929 /nfs/dbraw/zinc/04/79/29/876047929.db2.gz JRIYQQNRGHYELN-BHDDXSALSA-N 0 3 401.572 4.361 20 0 HIADHN CCN(Cc1cn(Cc2ccccc2)nc1-c1ccc(OC)c(OC)c1)[C@H]1CCOC1 ZINC000463039379 876061969 /nfs/dbraw/zinc/06/19/69/876061969.db2.gz SFBKAFCCGVOHIF-QFIPXVFZSA-N 0 3 421.541 4.226 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)[C@H](c3ccccc3)C(C)C)CC2)c1 ZINC000463095683 876129869 /nfs/dbraw/zinc/12/98/69/876129869.db2.gz FLCLQQQUTIPRSN-VWLOTQADSA-N 0 3 407.602 4.453 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)c1cccc(-c2cscn2)c1 ZINC000463123492 876166402 /nfs/dbraw/zinc/16/64/02/876166402.db2.gz JJUZSRWTMHEPNO-UHFFFAOYSA-N 0 3 420.582 4.142 20 0 HIADHN O=C(CCCc1ccc([O-])c(F)c1)N1CC[C@@H]2[C@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000468935791 883001823 /nfs/dbraw/zinc/00/18/23/883001823.db2.gz MFDUMEDESIBZPK-FYYLOGMGSA-N 0 3 410.533 4.367 20 0 HIADHN O=C(CCCc1ccc([O-])c(F)c1)N1CC[C@@H]2[C@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000468935791 883001843 /nfs/dbraw/zinc/00/18/43/883001843.db2.gz MFDUMEDESIBZPK-FYYLOGMGSA-N 0 3 410.533 4.367 20 0 HIADHN C[C@H](Cn1cc(Br)cn1)NCc1ccc(Oc2cccc(F)c2)nc1 ZINC000468946775 883012164 /nfs/dbraw/zinc/01/21/64/883012164.db2.gz LJCNHNZBOIZONS-CYBMUJFWSA-N 0 3 405.271 4.150 20 0 HIADHN C[C@@H]1CC[C@H](O)[C@@H]([C@@H]2CCCCN2Cc2nc3ccc(Br)cc3n2C)C1 ZINC000463214387 876273773 /nfs/dbraw/zinc/27/37/73/876273773.db2.gz PVSOPDGRHLTBNT-BIJSTVTOSA-N 0 3 420.395 4.487 20 0 HIADHN Cc1nc(NC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)nc2c1CCCC2 ZINC000463244856 876301008 /nfs/dbraw/zinc/30/10/08/876301008.db2.gz WRTUIUFXVQGYSC-NRFANRHFSA-N 0 3 418.463 4.057 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)N[C@@H]2CCO[C@H](c3ccccc3)C2)CC1 ZINC000463256826 876313628 /nfs/dbraw/zinc/31/36/28/876313628.db2.gz GDXAAAZEHSGDDR-VWNXMTODSA-N 0 3 407.558 4.213 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)N[C@H]1CCO[C@H](c2ccccc2)C1 ZINC000463255930 876313913 /nfs/dbraw/zinc/31/39/13/876313913.db2.gz CSYKHBWEBOOJPV-ZEQRLZLVSA-N 0 3 409.574 4.113 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N(Cc1ccccc1)CC1CCOCC1 ZINC000463259811 876318456 /nfs/dbraw/zinc/31/84/56/876318456.db2.gz FHHANHCYYTYEOH-OFVILXPXSA-N 0 3 421.585 4.145 20 0 HIADHN CCCN1CCN(c2ccccc2CNc2cc(C[S@@](C)=O)ccc2Cl)CC1 ZINC000463272047 876328962 /nfs/dbraw/zinc/32/89/62/876328962.db2.gz NQJILUBKVTYZKU-MUUNZHRXSA-N 0 3 420.022 4.363 20 0 HIADHN COC(=O)CCCN1CCC(Nc2cc(Br)cc(OC(C)C)c2)CC1 ZINC000463277937 876333951 /nfs/dbraw/zinc/33/39/51/876333951.db2.gz AMJTUYAZRPUTRC-UHFFFAOYSA-N 0 3 413.356 4.066 20 0 HIADHN COc1ccc(NC(=O)[C@H](C)N2[C@H](C)CC[C@H]2C)cc1OCc1cn2ccccc2n1 ZINC000463332608 876389578 /nfs/dbraw/zinc/38/95/78/876389578.db2.gz BTIULTGJPVQSST-KURKYZTESA-N 0 3 422.529 4.122 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)Cc1cc(F)ccc1F ZINC000463514461 876578923 /nfs/dbraw/zinc/57/89/23/876578923.db2.gz KLAFICPLYMHRIA-UHFFFAOYSA-N 0 3 400.391 4.117 20 0 HIADHN CC(C)n1cc(Br)cc1C(=O)N(CCN(C)C)Cc1cccc(F)c1 ZINC000463524245 876592575 /nfs/dbraw/zinc/59/25/75/876592575.db2.gz GQSRUTIGHFFZIO-UHFFFAOYSA-N 0 3 410.331 4.175 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)c1cccc(-c2noc(C3CC3)n2)c1 ZINC000463528734 876603319 /nfs/dbraw/zinc/60/33/19/876603319.db2.gz YEBFHZPQIKVDAO-UHFFFAOYSA-N 0 3 424.932 4.471 20 0 HIADHN O=C(c1ccc(F)c(Br)c1)N1CCCN(CCCc2ccccc2)CC1 ZINC000463623976 876742529 /nfs/dbraw/zinc/74/25/29/876742529.db2.gz YRGNBWIBOUDZRT-UHFFFAOYSA-N 0 3 419.338 4.369 20 0 HIADHN COc1ccc(Cn2nc(C)c(CNCc3ccc(-n4cccn4)cc3)c2C)cc1 ZINC000463751170 876873928 /nfs/dbraw/zinc/87/39/28/876873928.db2.gz PBKXGRYFFYNOQJ-UHFFFAOYSA-N 0 3 401.514 4.032 20 0 HIADHN COc1ccc(Cn2nc(C)c(CNC[C@H](c3ccco3)N3CCCCC3)c2C)cc1 ZINC000463753868 876877746 /nfs/dbraw/zinc/87/77/46/876877746.db2.gz YGXAPSVUKNRNRK-XMMPIXPASA-N 0 3 422.573 4.467 20 0 HIADHN CN(C)CCN(C(=O)c1ccc(-c2noc(-c3ccc(F)cc3)n2)cc1)C1CCCC1 ZINC000463806624 876923424 /nfs/dbraw/zinc/92/34/24/876923424.db2.gz ORBCGPCHPQYMKQ-UHFFFAOYSA-N 0 3 422.504 4.489 20 0 HIADHN C[C@H](CC(=O)c1ccccc1F)C(=O)NC1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1 ZINC000463826711 876942997 /nfs/dbraw/zinc/94/29/97/876942997.db2.gz KDJNRVOGMKHFDP-LBFURVHYSA-N 0 3 408.517 4.346 20 0 HIADHN CCCCCOc1ccc(C(=O)CCC(=O)NC2C[C@H]3CCC[C@@H](C2)N3C)cc1 ZINC000463906494 877028053 /nfs/dbraw/zinc/02/80/53/877028053.db2.gz LHBMIPJYVRXDCL-SEJPIABJSA-N 0 3 400.563 4.350 20 0 HIADHN COc1ccc([C@@H](CNC(=O)N[C@H](c2ncc(C)s2)C2CC2)N2CCCC2)cc1 ZINC000463969831 877096081 /nfs/dbraw/zinc/09/60/81/877096081.db2.gz KDFWZCJADUJHDX-UXHICEINSA-N 0 3 414.575 4.048 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)c1cccc(-c2noc(C3CC3)n2)c1 ZINC000464064043 877210353 /nfs/dbraw/zinc/21/03/53/877210353.db2.gz KAJXQOFLJBNLPI-SFHVURJKSA-N 0 3 416.525 4.351 20 0 HIADHN Cc1nn(C(C)(C)C)cc1[C@H](C)NC(=O)NC[C@@H](c1ccc(C)cc1)N1CCCC1 ZINC000464126210 877281646 /nfs/dbraw/zinc/28/16/46/877281646.db2.gz OLUGWTMBBUPRJH-AVRDEDQJSA-N 0 3 411.594 4.452 20 0 HIADHN Cc1nn(C(C)(C)C)cc1[C@H](C)NC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC000464151979 877320832 /nfs/dbraw/zinc/32/08/32/877320832.db2.gz LMAUXWDYTTVNTQ-MOPGFXCFSA-N 0 3 411.594 4.314 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)NCc1cccc(-c2cccnc2)c1 ZINC000464292278 877478796 /nfs/dbraw/zinc/47/87/96/877478796.db2.gz DBSUGOYCJLNMKT-NTKDMRAZSA-N 0 3 400.526 4.068 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)N1CC[C@@H](CSc2ccccc2)C1 ZINC000464323005 877513108 /nfs/dbraw/zinc/51/31/08/877513108.db2.gz DECYGFYSLCWHLF-JOCHJYFZSA-N 0 3 423.626 4.230 20 0 HIADHN COc1ccccc1S(=O)(=O)CCCNC(C)(c1ccccc1)c1ccccc1 ZINC000464491457 877708890 /nfs/dbraw/zinc/70/88/90/877708890.db2.gz XHESYZULHBYYMX-UHFFFAOYSA-N 0 3 409.551 4.412 20 0 HIADHN CC[C@H](C)c1ccc(S(=O)(=O)[N-]c2ccc(C)c(NC(=O)CC[NH+](C)C)c2)cc1 ZINC000464543130 877758715 /nfs/dbraw/zinc/75/87/15/877758715.db2.gz KVZHUAFJAUNQNH-INIZCTEOSA-N 0 3 417.575 4.200 20 0 HIADHN O=C(CN(CCCOc1ccccc1)C1CCOCC1)N1CCC[C@@H]2CCCC[C@H]21 ZINC000464575295 877796938 /nfs/dbraw/zinc/79/69/38/877796938.db2.gz FVDMNFGSMNUNPQ-XUZZJYLKSA-N 0 3 414.590 4.118 20 0 HIADHN CC(C)CN(C(=O)Cc1csc2nc(-c3ccccc3)cn12)C1CCN(C)CC1 ZINC000464576624 877800095 /nfs/dbraw/zinc/80/00/95/877800095.db2.gz QLFPVMCAONENAA-UHFFFAOYSA-N 0 3 410.587 4.184 20 0 HIADHN CCCN(CCc1cccs1)CC(=O)N1CCC[C@H]1c1ccc(OC)cc1OC ZINC000464588644 877813567 /nfs/dbraw/zinc/81/35/67/877813567.db2.gz WPLFDKBGLLAXFX-NRFANRHFSA-N 0 3 416.587 4.384 20 0 HIADHN C[C@@H](CNC(=O)c1cccc(CN2CCCC2)c1)Oc1ccc(Br)cc1 ZINC000464636699 877853604 /nfs/dbraw/zinc/85/36/04/877853604.db2.gz HHMAMAYVHDLEGW-INIZCTEOSA-N 0 3 417.347 4.242 20 0 HIADHN Cc1ccc(CCN(C[C@@H]2CCCO2)C(=O)c2cccc(CN3CCCC3)c2)cc1 ZINC000464648533 877869036 /nfs/dbraw/zinc/86/90/36/877869036.db2.gz FIOSHIQLQKLHAW-VWLOTQADSA-N 0 3 406.570 4.455 20 0 HIADHN Cc1cccc(S(=O)(=O)CCCN(C)[C@@H]2CCN(Cc3ccccc3)[C@H](C)C2)c1 ZINC000464680400 877896065 /nfs/dbraw/zinc/89/60/65/877896065.db2.gz ZKZDUYMAONFDBC-FYYLOGMGSA-N 0 3 414.615 4.144 20 0 HIADHN CC(=O)Nc1ccc(OC[C@H](O)CN2Cc3ccccc3C[C@@H]2c2ccccc2)cc1 ZINC000464739346 877973704 /nfs/dbraw/zinc/97/37/04/877973704.db2.gz PUPNOHTYVRUAHD-AOYPEHQESA-N 0 3 416.521 4.184 20 0 HIADHN O=C(CN1CCCC2(C1)CCCCCC2)NC1CCN(C(=O)C2CCCCC2)CC1 ZINC000464768215 878009657 /nfs/dbraw/zinc/00/96/57/878009657.db2.gz XWNDXGQCGRAMHX-UHFFFAOYSA-N 0 3 417.638 4.110 20 0 HIADHN C[C@H](C(=O)Nc1cccc(CSc2ccccn2)c1)N1CCC2(C1)CCOCC2 ZINC000464809362 878058252 /nfs/dbraw/zinc/05/82/52/878058252.db2.gz GLXJZHPOTUTEPI-GOSISDBHSA-N 0 3 411.571 4.203 20 0 HIADHN C[C@@H]1CCN(C(=O)Cc2cccc(Br)c2)CCN1Cc1ccccc1 ZINC000464888519 878187508 /nfs/dbraw/zinc/18/75/08/878187508.db2.gz DPIOAEMPMAKPQH-QGZVFWFLSA-N 0 3 401.348 4.115 20 0 HIADHN C[C@H]1CCN(C(=O)c2cccc(NC(=O)c3ccco3)c2)CCN1Cc1ccccc1 ZINC000464893474 878196099 /nfs/dbraw/zinc/19/60/99/878196099.db2.gz MNGYPVKQOAMNEZ-IBGZPJMESA-N 0 3 417.509 4.269 20 0 HIADHN Cc1nc2c(cnn2C(C)C)cc1C(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1 ZINC000464893974 878196832 /nfs/dbraw/zinc/19/68/32/878196832.db2.gz MXMRGFFQKATHBR-SFHVURJKSA-N 0 3 405.546 4.057 20 0 HIADHN CC[C@H](C)n1ncc2c1nc(C)cc2C(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC000464897017 878203386 /nfs/dbraw/zinc/20/33/86/878203386.db2.gz VJBPRZXTTJKLTH-VQTJNVASSA-N 0 3 419.573 4.447 20 0 HIADHN CCN(C[C@H]1CCN(Cc2ccccc2)C1)C(=O)CCC(=O)c1ccc(OC)cc1 ZINC000464936828 878268143 /nfs/dbraw/zinc/26/81/43/878268143.db2.gz JFSBXSRCPLXPDE-NRFANRHFSA-N 0 3 408.542 4.029 20 0 HIADHN COc1ccc([C@H](CNC(=O)CCc2c[nH]c3cc(C)ccc23)N2CCCC2)cc1 ZINC000465053403 878416387 /nfs/dbraw/zinc/41/63/87/878416387.db2.gz LOAFDONLOZSPNV-DEOSSOPVSA-N 0 3 405.542 4.371 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)c1cc(Oc2ccccc2)ccn1 ZINC000465139310 878520122 /nfs/dbraw/zinc/52/01/22/878520122.db2.gz MTCDSCGJARJYLB-NRFANRHFSA-N 0 3 416.525 4.396 20 0 HIADHN CN(C(=O)c1cc(Oc2ccccc2)ccn1)C1CCN(CCc2ccccn2)CC1 ZINC000465170534 878555889 /nfs/dbraw/zinc/55/58/89/878555889.db2.gz NGBVNZCPRMSSHP-UHFFFAOYSA-N 0 3 416.525 4.048 20 0 HIADHN Cc1ccc(OC(F)F)c(CNC(=O)N(CCN(C)C)Cc2cccc(F)c2)c1 ZINC000465223440 878640072 /nfs/dbraw/zinc/64/00/72/878640072.db2.gz GGRDHGAGFLBLRR-UHFFFAOYSA-N 0 3 409.452 4.009 20 0 HIADHN Cc1cc(NC(=O)c2ccccc2Cl)sc1C(=O)N1CC[C@H]2CC[C@@H](C1)N2C ZINC000465239014 878658021 /nfs/dbraw/zinc/65/80/21/878658021.db2.gz LVCPXCJCCIFDBO-CABCVRRESA-N 0 3 417.962 4.271 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N[C@H](c2cccc(F)c2)C2CCCC2)CC1 ZINC000465285478 878722265 /nfs/dbraw/zinc/72/22/65/878722265.db2.gz MAOQUDJQQIHJCR-QFIPXVFZSA-N 0 3 405.558 4.246 20 0 HIADHN C[C@@H](NC(=O)NC[C@H](c1cccs1)N1CCCC1)c1nc(C2CCCCC2)no1 ZINC000465419008 878849442 /nfs/dbraw/zinc/84/94/42/878849442.db2.gz AAHNGNKMVAIXGW-NVXWUHKLSA-N 0 3 417.579 4.376 20 0 HIADHN C[C@@H](NC(=O)NC[C@H](c1cccs1)N1CCCC1)c1ccc(-n2cccn2)cc1 ZINC000465422365 878852519 /nfs/dbraw/zinc/85/25/19/878852519.db2.gz NKZOTZYNPZFEAN-YLJYHZDGSA-N 0 3 409.559 4.131 20 0 HIADHN COc1ccccc1C[C@@H](C)N(C)C(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000465423565 878853011 /nfs/dbraw/zinc/85/30/11/878853011.db2.gz NHQILFASAHAICU-MJGOQNOKSA-N 0 3 401.576 4.166 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)NCc2coc(-c3ccc(C)cc3)n2)N(C)C)cc1 ZINC000465427298 878858113 /nfs/dbraw/zinc/85/81/13/878858113.db2.gz DXIXNLQAKUYZQZ-JOCHJYFZSA-N 0 3 406.530 4.315 20 0 HIADHN CO[C@H](CNC(=O)NC[C@H](c1cccs1)N1CCCC1)c1cccc(Cl)c1 ZINC000465432436 878863065 /nfs/dbraw/zinc/86/30/65/878863065.db2.gz XEDMOPOJNKJAHJ-QZTJIDSGSA-N 0 3 407.967 4.225 20 0 HIADHN O=C(NCc1c(F)cccc1OC(F)F)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000465432588 878865188 /nfs/dbraw/zinc/86/51/88/878865188.db2.gz XORBAUWNGYMHKA-SFHVURJKSA-N 0 3 407.436 4.063 20 0 HIADHN O=C(N[C@H]1CCN(Cc2ccccc2)C1)N[C@@H]1COc2c1ccc(Cl)c2Cl ZINC000465434601 878866577 /nfs/dbraw/zinc/86/65/77/878866577.db2.gz RHJQXHVUBIZDRQ-WMLDXEAASA-N 0 3 406.313 4.001 20 0 HIADHN CO[C@@H](CNC(=O)NC[C@H](c1ccccc1)N1CCCC1)c1ccc(Cl)cc1 ZINC000465439377 878871591 /nfs/dbraw/zinc/87/15/91/878871591.db2.gz FUHZEFZSKKYQAL-RTWAWAEBSA-N 0 3 401.938 4.164 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@@H]2CNC(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000465439727 878871690 /nfs/dbraw/zinc/87/16/90/878871690.db2.gz YRCDCBBARGWMPP-SGNDLWITSA-N 0 3 407.558 4.036 20 0 HIADHN CC[C@H](NC(=O)NC[C@H](c1ccccc1)N(C)C)c1nc(C(F)(F)F)cs1 ZINC000465454610 878885403 /nfs/dbraw/zinc/88/54/03/878885403.db2.gz ISSXXICLHBPRFZ-UONOGXRCSA-N 0 3 400.470 4.215 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@H](C)c1c(F)cccc1OC)c1cccc(OC)c1 ZINC000465465940 878899340 /nfs/dbraw/zinc/89/93/40/878899340.db2.gz ASFCWFUTDZERBM-OXQOHEQNSA-N 0 3 417.525 4.286 20 0 HIADHN COc1cccc([C@@H](CNC(=O)NC[C@H](C)Sc2ccccc2)N2CCCC2)c1 ZINC000465474632 878912671 /nfs/dbraw/zinc/91/26/71/878912671.db2.gz IYQPBVBPXYWVRO-PGRDOPGGSA-N 0 3 413.587 4.312 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCCc1nc(C(F)(F)F)cs1)c1ccsc1 ZINC000465516047 878961078 /nfs/dbraw/zinc/96/10/78/878961078.db2.gz ASFWKESDIWZQLM-CYBMUJFWSA-N 0 3 420.526 4.148 20 0 HIADHN CCN1CCN(Cc2ccc(CNC(=O)N3CC[C@H](C)C[C@H]3c3ccco3)cc2)CC1 ZINC000465518466 878966602 /nfs/dbraw/zinc/96/66/02/878966602.db2.gz DWOKSBMBIFIQGD-REWPJTCUSA-N 0 3 424.589 4.100 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)N1CC[C@@H](COCc2ccccc2)C1 ZINC000465533425 878990576 /nfs/dbraw/zinc/99/05/76/878990576.db2.gz XVTWTADOTDOYGC-VWNXMTODSA-N 0 3 407.558 4.072 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)N3C[C@@H](C)[C@H]3c3ccccc3)CC2)c1 ZINC000465538192 878998021 /nfs/dbraw/zinc/99/80/21/878998021.db2.gz ASSWTERIWUMETG-RDGATRHJSA-N 0 3 420.601 4.300 20 0 HIADHN CC(=O)Nc1cccc([C@H](C)NC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)c1 ZINC000465563377 879034836 /nfs/dbraw/zinc/03/48/36/879034836.db2.gz GQBGVYPEQVRHJD-OALUTQOASA-N 0 3 408.546 4.012 20 0 HIADHN CC[C@H](Cc1ccccc1)N(C)C(=O)NCCCN1CCN(C)C[C@@H]1c1ccccc1 ZINC000465610605 879106176 /nfs/dbraw/zinc/10/61/76/879106176.db2.gz WOEFEYANHSHHTM-JWQCQUIFSA-N 0 3 422.617 4.028 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N2CC[C@@H](COCc3ccccc3)C2)C1 ZINC000465748763 879335714 /nfs/dbraw/zinc/33/57/14/879335714.db2.gz IOJCAYDFLGDPDP-BKULYWANSA-N 0 3 407.558 4.070 20 0 HIADHN C[C@@H]1CCN(C(=O)N[C@@H]2CCOc3c(Cl)cccc32)CCN1Cc1ccccc1 ZINC000465750479 879338888 /nfs/dbraw/zinc/33/88/88/879338888.db2.gz ICUSZOVJFLCWLH-DYESRHJHSA-N 0 3 413.949 4.470 20 0 HIADHN CN(C)CCN(C[C@@H]1CCCO1)C(=O)N[C@@H](c1ccsc1)c1ccc(Cl)cc1 ZINC000465763255 879359732 /nfs/dbraw/zinc/35/97/32/879359732.db2.gz WFIIMOCKLOIPLA-VQTJNVASSA-N 0 3 421.994 4.243 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)NCCc2c[nH]c3ccc(Cl)cc23)C1 ZINC000465765090 879363269 /nfs/dbraw/zinc/36/32/69/879363269.db2.gz VAWQIESTARWBES-JXFKEZNVSA-N 0 3 410.949 4.499 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)N[C@H](C)c2ccccc2Oc2ccccc2)CC1 ZINC000465799306 879409774 /nfs/dbraw/zinc/40/97/74/879409774.db2.gz IIZMBLOZZVXDTQ-NHCUHLMSSA-N 0 3 424.589 4.113 20 0 HIADHN C[C@H](NC(=O)N(CCN(C)C)C[C@H]1CCCO1)c1ccc(Oc2ccccc2)cc1 ZINC000465816868 879440509 /nfs/dbraw/zinc/44/05/09/879440509.db2.gz PHORXHCADCAHOR-WMZHIEFXSA-N 0 3 411.546 4.292 20 0 HIADHN COc1ccc(CC[C@H](C)NC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)cc1 ZINC000465818360 879442865 /nfs/dbraw/zinc/44/28/65/879442865.db2.gz PVBBHNIYWJPBFZ-SFTDATJTSA-N 0 3 409.574 4.322 20 0 HIADHN Cc1[nH]c2ccccc2c1CCNC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1 ZINC000465833504 879469213 /nfs/dbraw/zinc/46/92/13/879469213.db2.gz CRDCJRKZDPDTTA-IBGZPJMESA-N 0 3 404.558 4.325 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)N[C@H](CC2CCCCC2)c2ccccc2)CC1 ZINC000465836392 879472326 /nfs/dbraw/zinc/47/23/26/879472326.db2.gz OTRFDEZBMOORKW-XUZZJYLKSA-N 0 3 414.638 4.271 20 0 HIADHN C[C@H]1CCN(C(=O)NCc2nc(C(C)(C)C)cs2)CCN1Cc1ccccc1 ZINC000465855635 879501366 /nfs/dbraw/zinc/50/13/66/879501366.db2.gz BBZRXXZGMTWATK-KRWDZBQOSA-N 0 3 400.592 4.247 20 0 HIADHN Cc1csc([C@H](NC(=O)NCC2(N3CCOC(C)(C)C3)CCCCC2)C2CC2)n1 ZINC000465868676 879519755 /nfs/dbraw/zinc/51/97/55/879519755.db2.gz HDMJHPYCYMCOFB-GOSISDBHSA-N 0 3 420.623 4.016 20 0 HIADHN CCc1nc(C)c([C@H](C)N(C)C(=O)NC[C@@H]2CCCN2Cc2ccccc2)s1 ZINC000465943058 879612036 /nfs/dbraw/zinc/61/20/36/879612036.db2.gz ZDDDBRXPYDDGCY-HKUYNNGSSA-N 0 3 400.592 4.381 20 0 HIADHN C[C@H](NC(=O)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1)c1cnn(C)c1 ZINC000465956637 879623966 /nfs/dbraw/zinc/62/39/66/879623966.db2.gz ILIWNAFTGQNUQD-HNNXBMFYSA-N 0 3 424.376 4.096 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)N[C@@H](CC(C)C)c2ccc(Cl)cc2)CC1 ZINC000465968830 879638183 /nfs/dbraw/zinc/63/81/83/879638183.db2.gz OEXPIEYKFWQLLD-RXVVDRJESA-N 0 3 409.018 4.000 20 0 HIADHN O=C(N[C@H](c1ccccc1Cl)c1cc(F)ccc1F)N[C@H]1CCN(C2CC2)C1 ZINC000466015986 879696863 /nfs/dbraw/zinc/69/68/63/879696863.db2.gz KFOTUKKWYRWRPQ-VBKZILBWSA-N 0 3 405.876 4.244 20 0 HIADHN COc1ccccc1[C@]1(C)C[C@@H]1NC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C ZINC000466046376 879736073 /nfs/dbraw/zinc/73/60/73/879736073.db2.gz FTPFOJSTOOSEAB-VPHKFGTKSA-N 0 3 407.558 4.031 20 0 HIADHN CCC[C@H](CCc1ccccc1)NC(=O)N1CCC(CN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000466053098 879743206 /nfs/dbraw/zinc/74/32/06/879743206.db2.gz PMFDWGHOQDABSC-AWRGLXIESA-N 0 3 415.622 4.319 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)N(C)[C@@H](C)c2ccc(-c3ccccc3)cc2)CC1 ZINC000466111192 879825705 /nfs/dbraw/zinc/82/57/05/879825705.db2.gz YCUKYBBWXILHQF-VXKWHMMOSA-N 0 3 422.617 4.330 20 0 HIADHN COc1cccc(-c2ccc(CNC(=O)N(CCN(C)C)Cc3ccccn3)cc2)c1 ZINC000466156204 879861723 /nfs/dbraw/zinc/86/17/23/879861723.db2.gz ZJGOUIVCLAZSMY-UHFFFAOYSA-N 0 3 418.541 4.031 20 0 HIADHN Cc1ccccc1C1(CNC(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)CCOCC1 ZINC000466225317 879923977 /nfs/dbraw/zinc/92/39/77/879923977.db2.gz KZZKTEDMCITAGB-JTHBVZDNSA-N 0 3 421.585 4.005 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)N[C@H](c2ccccc2)c2cccnc2)CN1Cc1ccccc1 ZINC000466236589 879941013 /nfs/dbraw/zinc/94/10/13/879941013.db2.gz APATZKUSXQIRQZ-CTUHWIOQSA-N 0 3 400.526 4.133 20 0 HIADHN Cc1ccc(-c2nc(CCNC(=O)N[C@@H]3C[C@H](C)N(Cc4ccccc4)C3)co2)cc1 ZINC000466247065 879962550 /nfs/dbraw/zinc/96/25/50/879962550.db2.gz UTYZYHJNZFSNQC-WMZHIEFXSA-N 0 3 418.541 4.155 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)N[C@H](c2nccs2)c2ccccc2)CN1Cc1ccccc1 ZINC000466267481 880001635 /nfs/dbraw/zinc/00/16/35/880001635.db2.gz HNBRFKZCZMDEAK-UIFIKXQLSA-N 0 3 406.555 4.195 20 0 HIADHN CCCN(C(=O)NCCc1ncc(CC)s1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000466339828 880096468 /nfs/dbraw/zinc/09/64/68/880096468.db2.gz LKILIIUYLRBROU-FQEVSTJZSA-N 0 3 414.619 4.334 20 0 HIADHN Cc1cc(CNCc2ccc(-n3cccn3)cc2)ccc1I ZINC000466363376 880121779 /nfs/dbraw/zinc/12/17/79/880121779.db2.gz DKNIDWNTNXIKIV-UHFFFAOYSA-N 0 3 403.267 4.075 20 0 HIADHN Cc1cc(CNCc2c[nH]nc2-c2ccccc2F)ccc1I ZINC000466364303 880122160 /nfs/dbraw/zinc/12/21/60/880122160.db2.gz NCJBXCHTVRBNRE-UHFFFAOYSA-N 0 3 421.257 4.419 20 0 HIADHN Brc1cccc(-c2nc(CNCCc3cn4c(n3)SCC4)cs2)c1 ZINC000466464621 880245992 /nfs/dbraw/zinc/24/59/92/880245992.db2.gz KYCVBZXEHOFCQN-UHFFFAOYSA-N 0 3 421.389 4.207 20 0 HIADHN O=C1C[C@H](NCc2cc(F)cc3cccnc32)CN1Cc1ccccc1C(F)(F)F ZINC000466476067 880258467 /nfs/dbraw/zinc/25/84/67/880258467.db2.gz VZVCRNYHQMYCGJ-SFHVURJKSA-N 0 3 417.406 4.283 20 0 HIADHN C[C@@H](C(=O)Nc1cccc(CSc2ccccn2)c1)N(C)CCC1CCOCC1 ZINC000466490289 880268616 /nfs/dbraw/zinc/26/86/16/880268616.db2.gz JYEXXPWUATUGEP-SFHVURJKSA-N 0 3 413.587 4.449 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)N2CCC(C(F)(F)F)(C(F)(F)F)C2)CN1Cc1ccccc1 ZINC000466528999 880304930 /nfs/dbraw/zinc/30/49/30/880304930.db2.gz IZPZCMSABJNDGY-UKRRQHHQSA-N 0 3 423.401 4.176 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)Nc2ccccc2N2C[C@@H](C)O[C@H](C)C2)CN1Cc1ccccc1 ZINC000466530052 880305559 /nfs/dbraw/zinc/30/55/59/880305559.db2.gz UMONKAQYRHXBOK-NXLVEIQXSA-N 0 3 422.573 4.085 20 0 HIADHN Cc1ccc(CNC(=O)c2oc3ccccc3c2CN(C)C)c(OC[C@H]2CCCO2)c1 ZINC000466644136 880419411 /nfs/dbraw/zinc/41/94/11/880419411.db2.gz HYFFQPVHNQLMSA-LJQANCHMSA-N 0 3 422.525 4.291 20 0 HIADHN COC(=O)c1ccc(C(C)C)c(NC(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000466714279 880504622 /nfs/dbraw/zinc/50/46/22/880504622.db2.gz WFFCXJNTMZQRSI-HXUWFJFHSA-N 0 3 409.530 4.335 20 0 HIADHN CCN(C(=O)c1ccn(-c2ccc(F)cc2F)n1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000466814158 880589136 /nfs/dbraw/zinc/58/91/36/880589136.db2.gz GPGFGEJGYZUYMN-XLIONFOSSA-N 0 3 424.495 4.448 20 0 HIADHN CSc1ccc(F)cc1CNC(=O)N(CCCc1ccccc1)CCN(C)C ZINC000466821190 880593920 /nfs/dbraw/zinc/59/39/20/880593920.db2.gz GYUPUPVZVXUIKU-UHFFFAOYSA-N 0 3 403.567 4.254 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)NC[C@@H]2CCCO[C@H]2c2ccc(C)cc2)o1 ZINC000466952763 880733107 /nfs/dbraw/zinc/73/31/07/880733107.db2.gz GVDJTBVKFWHSLT-GMAHTHKFSA-N 0 3 413.562 4.138 20 0 HIADHN C[C@H](NC(=O)N[C@H]1CCN(Cc2ccccc2)[C@H]1C)c1nc(C(F)(F)F)cs1 ZINC000503546116 912609915 /nfs/dbraw/zinc/60/99/15/912609915.db2.gz FEFRZAUNXCKDAO-YDHLFZDLSA-N 0 3 412.481 4.185 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)c2cccc(OCc3cccnc3)c2)CN1Cc1ccccc1 ZINC000467030669 880829506 /nfs/dbraw/zinc/82/95/06/880829506.db2.gz CHLMGSJYEAKJCK-AUSIDOKSSA-N 0 3 401.510 4.053 20 0 HIADHN C[C@@H](NC(=O)N1CCCN(Cc2ccccc2)CC1)c1nc(C2CCCCC2)no1 ZINC000467033877 880831646 /nfs/dbraw/zinc/83/16/46/880831646.db2.gz CLFIUTKUDOZMHP-GOSISDBHSA-N 0 3 411.550 4.096 20 0 HIADHN C[C@H](NC(=O)N(CCN(C)C)CC1CCCCC1)c1nc(C2CCCCC2)no1 ZINC000467045701 880839491 /nfs/dbraw/zinc/83/94/91/880839491.db2.gz MWLOSVLCNQIJSN-KRWDZBQOSA-N 0 3 405.587 4.332 20 0 HIADHN Cc1noc(C)c1COc1ccccc1C(=O)N[C@H]1C[C@H](C)N(Cc2ccccc2)C1 ZINC000467060020 880846697 /nfs/dbraw/zinc/84/66/97/880846697.db2.gz QBERDWHJLGOOAJ-UWJYYQICSA-N 0 3 419.525 4.263 20 0 HIADHN Cc1noc(C)c1COc1ccccc1C(=O)N[C@@H]1C[C@H](C)N(Cc2ccccc2)C1 ZINC000467060018 880846737 /nfs/dbraw/zinc/84/67/37/880846737.db2.gz QBERDWHJLGOOAJ-LAUBAEHRSA-N 0 3 419.525 4.263 20 0 HIADHN CC(C)[C@H](Cc1ccc(F)cc1)NC(=O)N(Cc1ccco1)C1CCN(C)CC1 ZINC000467060941 880847133 /nfs/dbraw/zinc/84/71/33/880847133.db2.gz UDRFIIFFLKHCKN-QFIPXVFZSA-N 0 3 401.526 4.292 20 0 HIADHN COc1ccc(C(C)(C)C(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)cc1OC ZINC000467105412 880864947 /nfs/dbraw/zinc/86/49/47/880864947.db2.gz OSCLIZUOLXJNMT-OAQYLSRUSA-N 0 3 410.558 4.243 20 0 HIADHN CCC1(CC)CN(C(=O)Nc2ccc(CCN3CCSCC3)cc2)CCS1 ZINC000467156086 880890515 /nfs/dbraw/zinc/89/05/15/880890515.db2.gz WVRSOIATVFRBGJ-UHFFFAOYSA-N 0 3 407.649 4.417 20 0 HIADHN O=C(CN1CCC(c2ncc[nH]2)CC1)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 ZINC000467155717 880890601 /nfs/dbraw/zinc/89/06/01/880890601.db2.gz RZTFHHNDGLJFGA-GOSISDBHSA-N 0 3 407.345 4.260 20 0 HIADHN COc1ccc(C(=O)Nc2ccc(C(=O)NCCN3[C@H](C)CCC[C@H]3C)s2)cc1 ZINC000467192181 880921597 /nfs/dbraw/zinc/92/15/97/880921597.db2.gz SMCIBNRJGXPAET-HZPDHXFCSA-N 0 3 415.559 4.002 20 0 HIADHN COc1cc(-c2noc(CN3CCC[C@]3(C)Cc3ccccc3)n2)cc(OC)c1OC ZINC000467214759 880944427 /nfs/dbraw/zinc/94/44/27/880944427.db2.gz FJCZCDFASGYZDE-XMMPIXPASA-N 0 3 423.513 4.360 20 0 HIADHN CC[C@H](Cc1cccc(Br)c1)C(=O)N(CCN(C)C)Cc1ccccn1 ZINC000467262908 881000868 /nfs/dbraw/zinc/00/08/68/881000868.db2.gz KYAJZKCOCCXWKL-GOSISDBHSA-N 0 3 418.379 4.003 20 0 HIADHN COCC[C@H]1CCCCN(CC(=O)NCc2ccc(COc3ccccc3)cc2)C1 ZINC000467264280 881001712 /nfs/dbraw/zinc/00/17/12/881001712.db2.gz LBRYLMVANICWMA-JOCHJYFZSA-N 0 3 410.558 4.020 20 0 HIADHN FC(F)(F)c1nnc(N2CCCN(CCc3ccc4ccccc4c3)CC2)s1 ZINC000467269864 881009942 /nfs/dbraw/zinc/00/99/42/881009942.db2.gz WBTWNFSGJSQWHL-UHFFFAOYSA-N 0 3 406.477 4.465 20 0 HIADHN COCC[C@H]1CCCCN(CC(=O)NCc2ccccc2COc2ccccc2)C1 ZINC000467281897 881028497 /nfs/dbraw/zinc/02/84/97/881028497.db2.gz YCLOITAACNNVAA-OAQYLSRUSA-N 0 3 410.558 4.020 20 0 HIADHN COCC[C@@H]1CCCCN(CC(=O)NCc2ccccc2COc2ccccc2)C1 ZINC000467281896 881029183 /nfs/dbraw/zinc/02/91/83/881029183.db2.gz YCLOITAACNNVAA-NRFANRHFSA-N 0 3 410.558 4.020 20 0 HIADHN COc1cc(NC(=O)Nc2ccc(CCN3CCSCC3)cc2)c(C)c(OC)c1 ZINC000503559890 912634497 /nfs/dbraw/zinc/63/44/97/912634497.db2.gz OAQHAKWBQPOTBF-UHFFFAOYSA-N 0 3 415.559 4.248 20 0 HIADHN CC(C)C[C@H](N[C@H](C)Cc1cccc(C(F)(F)F)c1)c1nc(-c2nc[nH]n2)no1 ZINC000467334751 881084226 /nfs/dbraw/zinc/08/42/26/881084226.db2.gz OQQSSKXJLNIURY-DOMZBBRYSA-N 0 3 408.428 4.182 20 0 HIADHN FC(F)(F)c1nnc(N2CCCN(CCCCCOc3ccccc3)CC2)s1 ZINC000467362263 881129192 /nfs/dbraw/zinc/12/91/92/881129192.db2.gz NWKKHWRBQBVAEQ-UHFFFAOYSA-N 0 3 414.497 4.318 20 0 HIADHN C[C@@H](Cc1cccc(C(F)(F)F)c1)N[C@H](C(N)=O)c1cccc(Br)c1 ZINC000467364144 881130647 /nfs/dbraw/zinc/13/06/47/881130647.db2.gz JFONTUGUSHMQKX-ZBEGNZNMSA-N 0 3 415.253 4.215 20 0 HIADHN C[C@H](Cc1cccc(C(F)(F)F)c1)N[C@H](C(N)=O)c1cccc(Br)c1 ZINC000467364142 881131397 /nfs/dbraw/zinc/13/13/97/881131397.db2.gz JFONTUGUSHMQKX-BZNIZROVSA-N 0 3 415.253 4.215 20 0 HIADHN CC(=O)Nc1cccc([C@@H](C)NCc2ccc(I)c(C)c2)c1 ZINC000467382998 881162180 /nfs/dbraw/zinc/16/21/80/881162180.db2.gz COPKSJQOXSHSFQ-CYBMUJFWSA-N 0 3 408.283 4.409 20 0 HIADHN COc1ccc2c(c1)[C@H](N[C@@H]1CC(=O)N(C)[C@@H]1c1ccc(F)c(F)c1)CCS2 ZINC000467394018 881178435 /nfs/dbraw/zinc/17/84/35/881178435.db2.gz BGASBNATLWXEFH-DBXWQHBBSA-N 0 3 404.482 4.072 20 0 HIADHN CC(C)(C)OC(=O)Cc1ccccc1NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000467399330 881181725 /nfs/dbraw/zinc/18/17/25/881181725.db2.gz FIWVXLQACNFTCV-OAQYLSRUSA-N 0 3 423.557 4.357 20 0 HIADHN Clc1ccc(N2CCOCC2)c(CN[C@H](C[C@@H]2CCOC2)c2ccccc2)c1 ZINC000467410748 881197745 /nfs/dbraw/zinc/19/77/45/881197745.db2.gz KFBGQRCJRBZYCC-PGRDOPGGSA-N 0 3 400.950 4.434 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](NC[C@@H](CO)CC2CCCC2)c2ccc(F)cc2)c1 ZINC000467444711 881246157 /nfs/dbraw/zinc/24/61/57/881246157.db2.gz PXNPTPKBBFEJTM-FDDCHVKYSA-N 0 3 419.562 4.097 20 0 HIADHN COc1cc([C@H](C)N[C@@H]2CC(=O)N(Cc3ccccc3)[C@@H]2C)ccc1OC(F)F ZINC000467444983 881247756 /nfs/dbraw/zinc/24/77/56/881247756.db2.gz YBZIHCWTAGPHRR-HDMKZQKVSA-N 0 3 404.457 4.137 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)Nc2ccccc2CC(=O)OC(C)(C)C)CN1Cc1ccccc1 ZINC000467462412 881271521 /nfs/dbraw/zinc/27/15/21/881271521.db2.gz YUMCPDVJJPSCOS-NQIIRXRSSA-N 0 3 423.557 4.355 20 0 HIADHN COc1ccc(NC(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)c(Br)c1 ZINC000467471269 881288586 /nfs/dbraw/zinc/28/85/86/881288586.db2.gz GLZIQRIODOTGTR-GOEBONIOSA-N 0 3 418.335 4.242 20 0 HIADHN Cc1ccnc(-c2ccc(NC(=O)N[C@@H]3C[C@@H](C)N(Cc4ccccc4)C3)cc2)n1 ZINC000467474051 881292850 /nfs/dbraw/zinc/29/28/50/881292850.db2.gz TYWJHIPGQIRSHE-XMSQKQJNSA-N 0 3 401.514 4.237 20 0 HIADHN Cc1ccnc(-c2ccc(NC(=O)N[C@@H]3C[C@H](C)N(Cc4ccccc4)C3)cc2)n1 ZINC000467474048 881293055 /nfs/dbraw/zinc/29/30/55/881293055.db2.gz TYWJHIPGQIRSHE-PGRDOPGGSA-N 0 3 401.514 4.237 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)[C@H]1C[C@H]1c1ccc(F)cc1 ZINC000467476092 881295690 /nfs/dbraw/zinc/29/56/90/881295690.db2.gz NASYOAHUBYKCEC-FSSWDIPSSA-N 0 3 404.489 4.211 20 0 HIADHN Cc1ccnc(Oc2ccc(NC(=O)N[C@@H]3C[C@@H](C)N(Cc4ccccc4)C3)cc2)n1 ZINC000467478965 881300523 /nfs/dbraw/zinc/30/05/23/881300523.db2.gz VXTZCWYZHOMNIB-WIYYLYMNSA-N 0 3 417.513 4.362 20 0 HIADHN C[C@@H](CCCOc1ccccc1C(N)=O)N[C@@H](c1cccc(F)c1)c1ccccn1 ZINC000469081098 883167447 /nfs/dbraw/zinc/16/74/47/883167447.db2.gz QCCHJFMSWGZYHS-SBUREZEXSA-N 0 3 407.489 4.246 20 0 HIADHN COc1ccccc1[C@H](C)NC(=O)[C@H](C)N(C)CCCc1cc(-c2ccccc2)n[nH]1 ZINC000503594278 912684733 /nfs/dbraw/zinc/68/47/33/912684733.db2.gz LTKWBSQQNJTAHZ-OALUTQOASA-N 0 3 420.557 4.216 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)Nc3ccc4cnn(C(C)C)c4c3)CC2)c1 ZINC000469158162 883256196 /nfs/dbraw/zinc/25/61/96/883256196.db2.gz VYABHWJVXSUOBL-UHFFFAOYSA-N 0 3 405.546 4.076 20 0 HIADHN C[C@@H](N[C@@H]1CCCN(Cc2ccc(F)cc2F)C1=O)c1cccc(N2CCCC2)c1 ZINC000469164439 883262737 /nfs/dbraw/zinc/26/27/37/883262737.db2.gz ZXCIWEUYGGBHRR-UZUQRXQVSA-N 0 3 413.512 4.407 20 0 HIADHN C[C@@H](C(=O)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)N1CCCCCC1 ZINC000469249176 883347059 /nfs/dbraw/zinc/34/70/59/883347059.db2.gz RAUSEJVMFGYAJL-INIZCTEOSA-N 0 3 412.405 4.339 20 0 HIADHN C[C@@H]1CN(Cc2cccc(NC(=O)c3ccc(Nc4ccncc4)cc3)c2)C[C@@H](C)O1 ZINC000469253787 883349500 /nfs/dbraw/zinc/34/95/00/883349500.db2.gz RCIGQSYERFCGFM-RTBURBONSA-N 0 3 416.525 4.109 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)N[C@@H](c1ccccc1)[C@@H]1CCOC1 ZINC000469428908 883613734 /nfs/dbraw/zinc/61/37/34/883613734.db2.gz WZNHFIDEVOFEEK-SGNDLWITSA-N 0 3 409.574 4.220 20 0 HIADHN Cc1cc(C)c(NC(=O)CNC(=O)N[C@H](CN(C)Cc2ccccc2)C(C)C)c(C)c1 ZINC000469431934 883615854 /nfs/dbraw/zinc/61/58/54/883615854.db2.gz LZDFALRROFTDSQ-JOCHJYFZSA-N 0 3 424.589 4.006 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)NCc1coc(-c2cccs2)n1 ZINC000469437334 883624232 /nfs/dbraw/zinc/62/42/32/883624232.db2.gz XFSUQWPTBKAFHE-IBGZPJMESA-N 0 3 412.559 4.359 20 0 HIADHN CCC[C@H](NC(=O)N[C@H](CN(C)Cc1ccccc1)C(C)C)c1nnc2ccccn21 ZINC000469437495 883627032 /nfs/dbraw/zinc/62/70/32/883627032.db2.gz YZKBKLHTZZOLCR-LEWJYISDSA-N 0 3 422.577 4.026 20 0 HIADHN CCC[C@@H](NC(=O)N[C@@H](CN(C)Cc1ccccc1)C(C)C)c1nnc2ccccn21 ZINC000469437497 883627369 /nfs/dbraw/zinc/62/73/69/883627369.db2.gz YZKBKLHTZZOLCR-RTWAWAEBSA-N 0 3 422.577 4.026 20 0 HIADHN CCNC(=O)c1ccc(C)c(NC(=O)N[C@@H](CN(C)Cc2ccccc2)C(C)C)c1 ZINC000469453115 883654900 /nfs/dbraw/zinc/65/49/00/883654900.db2.gz VCMPWEPRJYCFFN-QFIPXVFZSA-N 0 3 410.562 4.023 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)Nc1cccc(C(=O)N2CCCC2)c1 ZINC000469459153 883670135 /nfs/dbraw/zinc/67/01/35/883670135.db2.gz OVMVFSBKDDOSOK-HSZRJFAPSA-N 0 3 422.573 4.201 20 0 HIADHN CCN(Cc1cccc(NC(=O)N[C@@H](CN(C)Cc2ccccc2)C(C)C)c1)C(C)=O ZINC000469464738 883677992 /nfs/dbraw/zinc/67/79/92/883677992.db2.gz MPHOSGMEGHXZIS-DEOSSOPVSA-N 0 3 424.589 4.333 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)Nc1ccc(C(=O)N2CCCC2)cc1 ZINC000469470206 883693530 /nfs/dbraw/zinc/69/35/30/883693530.db2.gz HAEIWURHDCIJTR-QHCPKHFHSA-N 0 3 422.573 4.201 20 0 HIADHN Cc1nc2ccc(C(=O)Nc3ccc(C(=O)N(C)[C@@H]4CCCN(C)C4)cc3)cc2s1 ZINC000469469065 883693584 /nfs/dbraw/zinc/69/35/84/883693584.db2.gz QWYYEJJKSUFAAH-LJQANCHMSA-N 0 3 422.554 4.023 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)Nc1ccc(NC(=O)C2CC2)cc1 ZINC000469472264 883698964 /nfs/dbraw/zinc/69/89/64/883698964.db2.gz JOJPLVFBJIXZRT-JOCHJYFZSA-N 0 3 408.546 4.313 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)c1ccc2c(c1)NC(=O)[C@@H](C)S2 ZINC000469479183 883709628 /nfs/dbraw/zinc/70/96/28/883709628.db2.gz CLMGPLJZCLDPRT-UZLBHIALSA-N 0 3 411.571 4.006 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)Cc1coc(-c2ccc(F)cc2)n1 ZINC000469485248 883718627 /nfs/dbraw/zinc/71/86/27/883718627.db2.gz DPBLMEXVFDUGBF-QFIPXVFZSA-N 0 3 409.505 4.296 20 0 HIADHN Cn1cc(-c2cc(CN3CCN(Cc4ccccc4)C4(CCCCC4)C3)on2)cn1 ZINC000469510842 883766582 /nfs/dbraw/zinc/76/65/82/883766582.db2.gz SFRJFLZMQHZEQN-UHFFFAOYSA-N 0 3 405.546 4.096 20 0 HIADHN O=C(CCN1CCN(c2ccccc2)CC1)Nc1ccc(Oc2ccccn2)cc1 ZINC000469520671 883787670 /nfs/dbraw/zinc/78/76/70/883787670.db2.gz OQJAJGHCDWWXEB-UHFFFAOYSA-N 0 3 402.498 4.025 20 0 HIADHN CN(C)[C@@H](CNc1cnn(Cc2ccccc2)c(=O)c1)c1cccc(C(F)(F)F)c1 ZINC000469554592 883812245 /nfs/dbraw/zinc/81/22/45/883812245.db2.gz QIEGVUMBAYOPBS-FQEVSTJZSA-N 0 3 416.447 4.025 20 0 HIADHN Cc1ccc(C)n1C1CCN([C@@H]2CCCN(Cc3ccc(F)cc3F)C2=O)CC1 ZINC000469609413 883833325 /nfs/dbraw/zinc/83/33/25/883833325.db2.gz PRKNGWMIHVIPHN-JOCHJYFZSA-N 0 3 401.501 4.211 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)Nc3ccccc3CC(F)(F)F)CC2)c1 ZINC000469625945 883839581 /nfs/dbraw/zinc/83/95/81/883839581.db2.gz TUAIOUSFWLGWJH-UHFFFAOYSA-N 0 3 405.464 4.251 20 0 HIADHN CCN1c2ccc(NC(=O)N[C@@H](CN(C)Cc3ccccc3)C(C)C)cc2CCC1=O ZINC000469652341 883849984 /nfs/dbraw/zinc/84/99/84/883849984.db2.gz GSPZCPRWXCFVQX-QFIPXVFZSA-N 0 3 422.573 4.264 20 0 HIADHN COc1ccc([C@@H](CNC(=O)Nc2ccccc2-n2ccc(C)n2)N2CCCC2)cc1 ZINC000469661362 883855361 /nfs/dbraw/zinc/85/53/61/883855361.db2.gz HJRYZBJQWJHYHU-HSZRJFAPSA-N 0 3 419.529 4.148 20 0 HIADHN C[C@@H](Oc1cccc2ccccc21)C(=O)NC1CCN([C@H](C)c2ccncc2)CC1 ZINC000469692515 883874079 /nfs/dbraw/zinc/87/40/79/883874079.db2.gz ISURDYMSZCGNHQ-RTBURBONSA-N 0 3 403.526 4.344 20 0 HIADHN O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)c1ccc(CCC(F)(F)F)cc1 ZINC000469847099 884030639 /nfs/dbraw/zinc/03/06/39/884030639.db2.gz SKUHFBJGGRBJSD-OAQYLSRUSA-N 0 3 420.475 4.202 20 0 HIADHN CC(C)(C(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1)c1ccc(Cl)cc1 ZINC000469853872 884037356 /nfs/dbraw/zinc/03/73/56/884037356.db2.gz PYGQJFROMMXPDH-OAQYLSRUSA-N 0 3 400.950 4.025 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N[C@H](c2nc3ccccc3[nH]2)C(C)C)N(C)C)cc1 ZINC000503682238 912789082 /nfs/dbraw/zinc/78/90/82/912789082.db2.gz RIGMCUXZMXBDEW-VXKWHMMOSA-N 0 3 407.562 4.425 20 0 HIADHN C[C@H]1CN(Cc2ccccn2)CC[C@@H]1NCc1csc(CCc2ccccc2)n1 ZINC000469979452 884192637 /nfs/dbraw/zinc/19/26/37/884192637.db2.gz XASYXLQWEHSWNH-CVDCTZTESA-N 0 3 406.599 4.324 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N1CC[C@H](c2c(F)cccc2F)C1 ZINC000470042080 884284234 /nfs/dbraw/zinc/28/42/34/884284234.db2.gz BOOICWTZHPAZFO-MAUKXSAKSA-N 0 3 405.514 4.362 20 0 HIADHN CC1CCN([C@H](CNC(=O)N[C@@H]2CCCC[C@H]2n2cccn2)c2cccs2)CC1 ZINC000470049596 884295102 /nfs/dbraw/zinc/29/51/02/884295102.db2.gz GFBGHZFGBPYJGH-VAMGGRTRSA-N 0 3 415.607 4.201 20 0 HIADHN Nc1c(Br)cc(Br)cc1CNCCOc1ccccc1F ZINC000470113376 884373651 /nfs/dbraw/zinc/37/36/51/884373651.db2.gz SCJPARRBXUTKAK-UHFFFAOYSA-N 0 3 418.104 4.102 20 0 HIADHN C[C@H](NC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C)c1ccccc1-n1cccn1 ZINC000470178247 884461000 /nfs/dbraw/zinc/46/10/00/884461000.db2.gz JFLDJZVKWFXGBS-RTWAWAEBSA-N 0 3 417.557 4.239 20 0 HIADHN Cc1noc(C)c1CSc1ccccc1C(=O)NCCN1CCCC(C)(C)C1 ZINC000470302896 884679833 /nfs/dbraw/zinc/67/98/33/884679833.db2.gz JTNIWBWQFQSZJZ-UHFFFAOYSA-N 0 3 401.576 4.436 20 0 HIADHN Cc1cc(-c2cccc(Cl)c2)ccc1NC(=O)N1CCCN([C@@H](C)CO)CC1 ZINC000470352203 884745363 /nfs/dbraw/zinc/74/53/63/884745363.db2.gz OWDIKDQXCYGRMF-KRWDZBQOSA-N 0 3 401.938 4.236 20 0 HIADHN C[C@@H]1CCC[C@H]1CC(=O)NC1CCN(CCOc2ccc(Br)cc2)CC1 ZINC000470360159 884752725 /nfs/dbraw/zinc/75/27/25/884752725.db2.gz YFGXRYVTBSJDJB-SJORKVTESA-N 0 3 423.395 4.235 20 0 HIADHN C[C@H](CO)N1CCCN(C(=O)Nc2ccc(Sc3ccccc3Cl)cc2)CC1 ZINC000470360818 884753828 /nfs/dbraw/zinc/75/38/28/884753828.db2.gz GMOILBPDUTVOOK-MRXNPFEDSA-N 0 3 419.978 4.412 20 0 HIADHN C[C@@H]1CN(C[C@@H]2CCCN2Cc2cc(Br)cc3cccnc32)C[C@@H](C)O1 ZINC000470369687 884765517 /nfs/dbraw/zinc/76/55/17/884765517.db2.gz PLOCEYMQYKDOGH-QINHECLXSA-N 0 3 418.379 4.071 20 0 HIADHN CC(C)N1CCN(CCCSc2nccn2-c2ccc(Br)cc2)CC1 ZINC000470443631 884841471 /nfs/dbraw/zinc/84/14/71/884841471.db2.gz JYSLUNFSYSBLRL-UHFFFAOYSA-N 0 3 423.424 4.143 20 0 HIADHN CCc1cc(OC)ccc1CN1CCC(C(=O)c2ccc3c(c2)NC(=O)[C@H](C)O3)CC1 ZINC000503937191 912872866 /nfs/dbraw/zinc/87/28/66/912872866.db2.gz LNJZGBOKVCHZCD-INIZCTEOSA-N 0 3 422.525 4.072 20 0 HIADHN C/C(=C/c1ccccc1C(F)(F)F)CN(C)[C@@H](C)c1ccc(S(N)(=O)=O)cc1 ZINC000503951234 912880077 /nfs/dbraw/zinc/88/00/77/912880077.db2.gz FGHJNIZLHRKRET-ZSMUJPCHSA-N 0 3 412.477 4.449 20 0 HIADHN C[C@H](NC(=O)c1oc2ccccc2c1CN(C)C)c1nc(-c2cccc(F)c2)no1 ZINC000470546261 884956704 /nfs/dbraw/zinc/95/67/04/884956704.db2.gz KAULZHOMMBYEOK-ZDUSSCGKSA-N 0 3 408.433 4.175 20 0 HIADHN Cc1cnn(Cc2ccccc2F)c1NC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000470571334 884988428 /nfs/dbraw/zinc/98/84/28/884988428.db2.gz VURDPBLJWJIPIX-HXUWFJFHSA-N 0 3 424.495 4.369 20 0 HIADHN COCCn1cc(C(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)c2ccccc21 ZINC000470675639 885107337 /nfs/dbraw/zinc/10/73/37/885107337.db2.gz SLHHUDKNHBMQSD-NRFANRHFSA-N 0 3 405.542 4.024 20 0 HIADHN CSCc1nc2ccccc2n1CC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470685701 885119721 /nfs/dbraw/zinc/11/97/21/885119721.db2.gz XVSLBLJYTCXKHH-FQEVSTJZSA-N 0 3 422.598 4.022 20 0 HIADHN COc1ccc(C(=O)C2CCN(C[C@H](O)Cc3ccc4ccccc4c3)CC2)cc1 ZINC000470718584 885160098 /nfs/dbraw/zinc/16/00/98/885160098.db2.gz UQKABYDILINACK-XMMPIXPASA-N 0 3 403.522 4.347 20 0 HIADHN CN(C(=O)NCc1ccccc1Br)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470719863 885164052 /nfs/dbraw/zinc/16/40/52/885164052.db2.gz MLHQYTYXFQICHD-IBGZPJMESA-N 0 3 416.363 4.255 20 0 HIADHN CN(C(=O)NCCCCOCc1ccccc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470720324 885165051 /nfs/dbraw/zinc/16/50/51/885165051.db2.gz SPEDWKZHHFUUPZ-DEOSSOPVSA-N 0 3 409.574 4.289 20 0 HIADHN Cc1cccc2[nH]cc(CCNC(=O)N(C)[C@H]3CCCN(Cc4ccccc4)C3)c21 ZINC000470720583 885167161 /nfs/dbraw/zinc/16/71/61/885167161.db2.gz WTOMETYYQZXWJG-QFIPXVFZSA-N 0 3 404.558 4.325 20 0 HIADHN CN(C(=O)N[C@H](c1ccccc1)[C@H]1CCCO1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470726647 885177784 /nfs/dbraw/zinc/17/77/84/885177784.db2.gz NYPNUBSVANMMGS-WXFUMESZSA-N 0 3 407.558 4.213 20 0 HIADHN CN(C(=O)NC[C@@H]1CCCO[C@H]1c1ccccc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470726956 885178077 /nfs/dbraw/zinc/17/80/77/885178077.db2.gz PYBCQYPMYRMOPS-GVAUOCQISA-N 0 3 421.585 4.460 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)CCc1cnc2ccccc2c1)c1cccc(OC)c1 ZINC000470729517 885181770 /nfs/dbraw/zinc/18/17/70/885181770.db2.gz HWOLCUVNGDOSKS-DEOSSOPVSA-N 0 3 405.542 4.375 20 0 HIADHN CN(C(=O)NCC1(c2ccccc2)CCOCC1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470730645 885183512 /nfs/dbraw/zinc/18/35/12/885183512.db2.gz WIMVLYOGRFDWQE-XMMPIXPASA-N 0 3 421.585 4.041 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N(C)Cc1nccs1)c1ccc(C(F)(F)F)cc1 ZINC000470733304 885187949 /nfs/dbraw/zinc/18/79/49/885187949.db2.gz QZIOSXNHDLYHGN-INIZCTEOSA-N 0 3 414.497 4.386 20 0 HIADHN COc1ccc([C@@H](NC(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)C2CC2)cc1 ZINC000470740995 885202781 /nfs/dbraw/zinc/20/27/81/885202781.db2.gz RXFPIZXMBVPEHP-UPVQGACJSA-N 0 3 407.558 4.452 20 0 HIADHN CC(C)Oc1ccc2ccccc2c1CN(C)C[C@@H]1C[C@H](F)CN1Cc1ncccn1 ZINC000470810392 885298829 /nfs/dbraw/zinc/29/88/29/885298829.db2.gz GEQJSZMKBQKYBL-SFTDATJTSA-N 0 3 422.548 4.461 20 0 HIADHN CCc1ccc(Cl)c(CC)c1NC(=O)CCCN1CCO[C@]2(CCO[C@H]2C)C1 ZINC000470934226 885435803 /nfs/dbraw/zinc/43/58/03/885435803.db2.gz AFSDTUJHKYSETG-KSFYIVLOSA-N 0 3 408.970 4.063 20 0 HIADHN Cc1cccc(Oc2ncccc2NC(=O)N(CCN(C)C)Cc2ccccn2)c1C ZINC000504051251 912958299 /nfs/dbraw/zinc/95/82/99/912958299.db2.gz HNSLRBFGCQZXFG-UHFFFAOYSA-N 0 3 419.529 4.481 20 0 HIADHN C[C@H](NC(=O)C1(c2cccc(Cl)c2)CCOCC1)[C@H](c1ccccc1)N(C)C ZINC000471129812 885669042 /nfs/dbraw/zinc/66/90/42/885669042.db2.gz QUIWWNDENPBMSG-LAUBAEHRSA-N 0 3 400.950 4.196 20 0 HIADHN C[C@H](NC(=O)C1(c2ccc(Br)cc2)CC1)[C@H](c1ccccc1)N(C)C ZINC000471137141 885677801 /nfs/dbraw/zinc/67/78/01/885677801.db2.gz NQUBEQHBWBGQCF-HNAYVOBHSA-N 0 3 401.348 4.288 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)c2ccc(Cl)cc2Br)CC1 ZINC000471145755 885690857 /nfs/dbraw/zinc/69/08/57/885690857.db2.gz PIBPOSMQMIORMD-UHFFFAOYSA-N 0 3 411.727 4.432 20 0 HIADHN O=C(CCN1CCC(Oc2ccccn2)CC1)N[C@@H](c1cccs1)c1ccccc1 ZINC000471154777 885704412 /nfs/dbraw/zinc/70/44/12/885704412.db2.gz WLNVOUFHUAMJFK-XMMPIXPASA-N 0 3 421.566 4.282 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)c2cc(NC(C)=O)cc(C(F)(F)F)c2)N(C)C)cc1 ZINC000471174321 885734425 /nfs/dbraw/zinc/73/44/25/885734425.db2.gz ZMWLCUQVNZSVJI-HXUWFJFHSA-N 0 3 421.463 4.259 20 0 HIADHN CN(C)Cc1cccc(NC(=O)N[C@@H]2C[C@H]2c2ccc(Br)c(F)c2)c1 ZINC000471174906 885736544 /nfs/dbraw/zinc/73/65/44/885736544.db2.gz AWVORKXRYYUSNS-MAUKXSAKSA-N 0 3 406.299 4.327 20 0 HIADHN Cn1ccnc1-c1cccc(NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)c1 ZINC000471272885 885851941 /nfs/dbraw/zinc/85/19/41/885851941.db2.gz LKPBWUHRTBCHNB-UHFFFAOYSA-N 0 3 421.467 4.014 20 0 HIADHN CN(C)[C@H]1Cc2ccccc2N(C(=O)c2cccc(-n3ccc(C(F)(F)F)n3)c2)C1 ZINC000471282706 885863570 /nfs/dbraw/zinc/86/35/70/885863570.db2.gz NHPJBXFHSJMZAL-SFHVURJKSA-N 0 3 414.431 4.024 20 0 HIADHN Cc1ccc2cccc(NC(=O)NC3CC(N4CCC(C(F)(F)F)CC4)C3)c2n1 ZINC000471292219 885878712 /nfs/dbraw/zinc/87/87/12/885878712.db2.gz LZXWJYRKNXVENP-UHFFFAOYSA-N 0 3 406.452 4.470 20 0 HIADHN C[C@H](NC(=O)CCN1CCc2ccccc2C1)c1noc(-c2ccc(Cl)cc2)n1 ZINC000471346615 885957782 /nfs/dbraw/zinc/95/77/82/885957782.db2.gz NZAVFVBQGPXWQV-HNNXBMFYSA-N 0 3 410.905 4.016 20 0 HIADHN Cc1c(NC(=O)N(C)C)cccc1NC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1 ZINC000471358978 885982983 /nfs/dbraw/zinc/98/29/83/885982983.db2.gz XXVVVTFCWUWRLB-SFHVURJKSA-N 0 3 423.561 4.217 20 0 HIADHN COc1cccc([C@@H](CNC(=O)N[C@H]2CCSc3ccccc32)N2CCCC2)c1 ZINC000504087513 912995114 /nfs/dbraw/zinc/99/51/14/912995114.db2.gz NZAPDHKGJLXDSE-LEWJYISDSA-N 0 3 411.571 4.368 20 0 HIADHN C[C@@H](CCN1CCN(C)CC1)NC(=O)Nc1cc(-c2ccccc2)ccc1Cl ZINC000471396680 886045831 /nfs/dbraw/zinc/04/58/31/886045831.db2.gz QEBMKQNNYFIEDX-KRWDZBQOSA-N 0 3 400.954 4.155 20 0 HIADHN COc1cc(NC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)cc(-n2cccn2)c1 ZINC000471486214 886183841 /nfs/dbraw/zinc/18/38/41/886183841.db2.gz WXKVSYVIAWYMHN-LJQANCHMSA-N 0 3 419.529 4.009 20 0 HIADHN COc1cc(F)c(NC(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)cc1OC ZINC000504113215 913019930 /nfs/dbraw/zinc/01/99/30/913019930.db2.gz IWWHVQNKCJVOCP-LJQANCHMSA-N 0 3 401.482 4.110 20 0 HIADHN Cc1ccc([C@@H](NC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)c2ccccn2)cc1 ZINC000471530386 886235376 /nfs/dbraw/zinc/23/53/76/886235376.db2.gz QYKIGTPGGMNYBS-ISKFKSNPSA-N 0 3 400.526 4.053 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCc1ccc2ncccc2c1)c1cccc(OC)c1 ZINC000471551463 886260016 /nfs/dbraw/zinc/26/00/16/886260016.db2.gz MQBNSKMRMAEDFL-HSZRJFAPSA-N 0 3 406.530 4.126 20 0 HIADHN Cc1ccc(C)c2c1CCC[C@H]2NCc1ccccc1OCC(=O)NC[C@@H]1CCCO1 ZINC000471576729 886288424 /nfs/dbraw/zinc/28/84/24/886288424.db2.gz DZMIQHVQYGORBB-JTHBVZDNSA-N 0 3 422.569 4.145 20 0 HIADHN C[C@@H](CCCCN1C(=O)c2ccccc2C1=O)NCc1nnc(-c2ccccc2)s1 ZINC000471596127 886308306 /nfs/dbraw/zinc/30/83/06/886308306.db2.gz XAOBRCHGBLVIFG-INIZCTEOSA-N 0 3 420.538 4.150 20 0 HIADHN COc1ccc([C@@H](C)NC[C@H](OC(C)C)c2ccccc2OC)cc1NC(C)=O ZINC000471608879 886324397 /nfs/dbraw/zinc/32/43/97/886324397.db2.gz GOKWTNMFFPRHOF-MWTRTKDXSA-N 0 3 400.519 4.479 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N[C@H]1C[C@@H]1c1ccccc1OC(F)F)c1ccco1 ZINC000504128636 913032703 /nfs/dbraw/zinc/03/27/03/913032703.db2.gz PFCCZPQKERTLSF-ORQFMDKSSA-N 0 3 407.461 4.166 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)Cc3csc(-c4cccc(F)c4)n3)c2)CC1 ZINC000471656010 886369215 /nfs/dbraw/zinc/36/92/15/886369215.db2.gz QEWXTVAXBBVUPT-UHFFFAOYSA-N 0 3 424.545 4.272 20 0 HIADHN CCN(C(=O)c1noc(-c2cccc(OC)c2)n1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000471807016 886545767 /nfs/dbraw/zinc/54/57/67/886545767.db2.gz BCGBFLFQUYDUPI-XLIONFOSSA-N 0 3 420.513 4.043 20 0 HIADHN COC(=O)c1cc(NC(=O)NC[C@@H](c2cccs2)N2CCCC2)c(C)cc1C ZINC000471831639 886584439 /nfs/dbraw/zinc/58/44/39/886584439.db2.gz FXUFUGXAPLFGAF-SFHVURJKSA-N 0 3 401.532 4.110 20 0 HIADHN Cc1cn([C@@H](C)c2ccccc2)nc1NC(=O)NC[C@H](C)N(C)Cc1ccccc1 ZINC000471835477 886591240 /nfs/dbraw/zinc/59/12/40/886591240.db2.gz OPKDHTKDXCSKPP-PMACEKPBSA-N 0 3 405.546 4.443 20 0 HIADHN CSc1cccc(N(C(=O)CCc2cccc3c2OCO3)C2CCN(C)CC2)c1 ZINC000471838050 886597663 /nfs/dbraw/zinc/59/76/63/886597663.db2.gz LDVCBSZCYNGPFP-UHFFFAOYSA-N 0 3 412.555 4.197 20 0 HIADHN COCCC1(CNC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)CCCC1 ZINC000471843327 886603950 /nfs/dbraw/zinc/60/39/50/886603950.db2.gz HLSAIZVMMUZFAA-OAQYLSRUSA-N 0 3 412.496 4.154 20 0 HIADHN Cc1cn([C@H](C)c2ccccc2)nc1NC(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C ZINC000471864337 886641303 /nfs/dbraw/zinc/64/13/03/886641303.db2.gz ROPWYUAPXCMQKN-XQFWAAQXSA-N 0 3 417.557 4.443 20 0 HIADHN Cc1cn([C@H](C)c2ccccc2)nc1NC(=O)N(CCN(C)C)Cc1ccccc1 ZINC000471881719 886662647 /nfs/dbraw/zinc/66/26/47/886662647.db2.gz FCEODBIOELNVNO-HXUWFJFHSA-N 0 3 405.546 4.397 20 0 HIADHN O=C(N[C@H](Cc1ccccc1)C1CC1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000471911486 886697633 /nfs/dbraw/zinc/69/76/33/886697633.db2.gz QKPLJJHLMSCFKD-SOAGJPPSSA-N 0 3 409.496 4.112 20 0 HIADHN COc1ccc([C@H](NC(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)C(F)(F)F)cc1 ZINC000471917091 886705284 /nfs/dbraw/zinc/70/52/84/886705284.db2.gz FHAZLVYLCXNGAM-QYZOEREBSA-N 0 3 407.436 4.043 20 0 HIADHN Cn1nc(C(F)F)c2cc(C(=O)NC[C@@H]3CCCN(Cc4cccs4)C3)sc21 ZINC000471945861 886749202 /nfs/dbraw/zinc/74/92/02/886749202.db2.gz ZOAJKZGQLHKJDN-LBPRGKRZSA-N 0 3 424.542 4.276 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2cc(Br)c(F)cc2F)[C@@H]1c1ccccc1 ZINC000471964428 886790321 /nfs/dbraw/zinc/79/03/21/886790321.db2.gz IYRLVSGFIZBQQR-RDJZCZTQSA-N 0 3 410.262 4.294 20 0 HIADHN Cc1cc(C(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)c(C)n1-c1nccs1 ZINC000504198795 913080194 /nfs/dbraw/zinc/08/01/94/913080194.db2.gz CZPAUKMHFYXXGO-UHFFFAOYSA-N 0 3 423.586 4.333 20 0 HIADHN CSc1cnn(-c2ccccc2)c1NC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000471996277 886821839 /nfs/dbraw/zinc/82/18/39/886821839.db2.gz VXTOCPHPJZMXSK-ICSRJNTNSA-N 0 3 407.543 4.161 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2ccc(OCC3CCOCC3)cc2)[C@@H]1c1ccccc1 ZINC000472017435 886839927 /nfs/dbraw/zinc/83/99/27/886839927.db2.gz PALNNNCUIULFDL-GOTSBHOMSA-N 0 3 409.530 4.059 20 0 HIADHN CCc1noc(-c2ccc(C)c(NC(=O)N[C@@H]3CCN(C)[C@H]3c3ccccc3)c2)n1 ZINC000472019196 886842208 /nfs/dbraw/zinc/84/22/08/886842208.db2.gz YPJKNEWGALHMHG-NQIIRXRSSA-N 0 3 405.502 4.174 20 0 HIADHN CCS[C@@H]1CCCC[C@@H]1NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472045459 886860944 /nfs/dbraw/zinc/86/09/44/886860944.db2.gz SVPDYGBBMHZBCT-SJJHQCBESA-N 0 3 407.546 4.155 20 0 HIADHN CCS[C@@H]1CCCC[C@H]1NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472045456 886861093 /nfs/dbraw/zinc/86/10/93/886861093.db2.gz SVPDYGBBMHZBCT-BHUNQDJPSA-N 0 3 407.546 4.155 20 0 HIADHN Cc1c2cc(F)ccc2oc1S(=O)(=O)NCC1CCN(Cc2cccs2)CC1 ZINC000472105496 886895212 /nfs/dbraw/zinc/89/52/12/886895212.db2.gz FRXADULOQHKKBF-UHFFFAOYSA-N 0 3 422.547 4.132 20 0 HIADHN Cc1ccc([C@H](NC(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)c2ccccn2)cc1 ZINC000472111125 886897905 /nfs/dbraw/zinc/89/79/05/886897905.db2.gz SRFUZVNPEROCCB-KMDXXIMOSA-N 0 3 400.526 4.224 20 0 HIADHN CCN(CC)[C@H](CNC(=O)[C@@H]1C[C@H]1c1cc(OC)ccc1OC)c1ccsc1 ZINC000472120182 886907136 /nfs/dbraw/zinc/90/71/36/886907136.db2.gz NKZCVQDSYGBACO-DFQSSKMNSA-N 0 3 402.560 4.068 20 0 HIADHN CCC(CC)[C@H]1C[C@@H](NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)CCO1 ZINC000472131713 886923418 /nfs/dbraw/zinc/92/34/18/886923418.db2.gz CDZKJZMTJNWCNH-MKCYZYCBSA-N 0 3 419.532 4.075 20 0 HIADHN Cc1nc2c(cccc2C(=O)NC2CCN(CCOc3ccc(Cl)cc3)CC2)o1 ZINC000472153040 886950937 /nfs/dbraw/zinc/95/09/37/886950937.db2.gz IPFNIBAMSSQKDD-UHFFFAOYSA-N 0 3 413.905 4.063 20 0 HIADHN COc1ccsc1[C@@H](C)NCc1cc(C(F)(F)F)ccc1N1CCN(C)CC1 ZINC000472161802 886961115 /nfs/dbraw/zinc/96/11/15/886961115.db2.gz TWKSFJVJAFBQQI-CQSZACIVSA-N 0 3 413.509 4.378 20 0 HIADHN Cc1cc(C)n(-c2ccccc2CNC(=O)N[C@H](CN2CCCC2)c2ccccc2)n1 ZINC000472221865 887024923 /nfs/dbraw/zinc/02/49/23/887024923.db2.gz LNPPLGADNURWLA-HSZRJFAPSA-N 0 3 417.557 4.125 20 0 HIADHN CCc1c(C(=O)NC2CCN(Cc3ccccc3)CC2)cnn1-c1ccc(Cl)cc1 ZINC000472240735 887048553 /nfs/dbraw/zinc/04/85/53/887048553.db2.gz NWGPSBNNSXASCD-UHFFFAOYSA-N 0 3 422.960 4.483 20 0 HIADHN C[C@H](COc1ccccc1)C(=O)NC1CCN(CCOc2ccc(Cl)cc2)CC1 ZINC000472242259 887050902 /nfs/dbraw/zinc/05/09/02/887050902.db2.gz TXQPLAGLZLYBIR-GOSISDBHSA-N 0 3 416.949 4.015 20 0 HIADHN COCCOc1ccc(C(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)c(Cl)c1 ZINC000472290922 887110770 /nfs/dbraw/zinc/11/07/70/887110770.db2.gz ATXFONCGTWIEGS-SFHVURJKSA-N 0 3 416.949 4.102 20 0 HIADHN CC[C@H]1CN(C(C)=O)[C@@H](CC)CN1CCC(=O)Nc1cc(Cl)ccc1Cl ZINC000472317680 887149662 /nfs/dbraw/zinc/14/96/62/887149662.db2.gz QWKNYLGPASXIHR-HOTGVXAUSA-N 0 3 400.350 4.043 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2ccnc(Sc3ccccn3)c2)[C@H]1c1ccccc1 ZINC000472327931 887161155 /nfs/dbraw/zinc/16/11/55/887161155.db2.gz OZXOHBQAYOXAGR-WIYYLYMNSA-N 0 3 405.527 4.195 20 0 HIADHN CC[C@H]1CN(C(C)=O)[C@@H](CC)CN1CCC(=O)Nc1c(Cl)cccc1Cl ZINC000472334923 887170988 /nfs/dbraw/zinc/17/09/88/887170988.db2.gz AWGAEHMBFFANAP-GJZGRUSLSA-N 0 3 400.350 4.043 20 0 HIADHN CO[C@H]1CC[C@@H](NC(=O)N(CCN2CCCC2)Cc2ccc(Cl)c(Cl)c2)C1 ZINC000472346500 887180831 /nfs/dbraw/zinc/18/08/31/887180831.db2.gz JFGFOHXDQRSSNJ-SJORKVTESA-N 0 3 414.377 4.168 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)[C@H](C)Oc3cnc4ccccc4c3)c2)CC1 ZINC000472428911 887275972 /nfs/dbraw/zinc/27/59/72/887275972.db2.gz FTRCQINPALAXDR-IBGZPJMESA-N 0 3 418.541 4.171 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N1CCC[C@H](Nc2ccccc2)C1 ZINC000472451199 887304118 /nfs/dbraw/zinc/30/41/18/887304118.db2.gz ADZRRUSAFHGERE-HDYDNRTBSA-N 0 3 424.511 4.078 20 0 HIADHN CCC1(CC)[C@H](N(C)C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)C[C@@H]1OC ZINC000472454471 887307715 /nfs/dbraw/zinc/30/77/15/887307715.db2.gz HMMIPDKKUHAQQV-HIEASXQVSA-N 0 3 419.532 4.027 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)NC1(Cc2ccccc2)CCC1 ZINC000472458633 887314441 /nfs/dbraw/zinc/31/44/41/887314441.db2.gz XPUGEAQGVZAHOU-UHFFFAOYSA-N 0 3 409.496 4.256 20 0 HIADHN C[C@H](NC(=O)N(CCN(C)C)Cc1ccccn1)C(c1ccccc1)c1ccccc1 ZINC000504284948 913139819 /nfs/dbraw/zinc/13/98/19/913139819.db2.gz WDCNNKCUUPDHNE-NRFANRHFSA-N 0 3 416.569 4.375 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1nn(-c2ccccc2)cc1C)c1cccc(OC)c1 ZINC000472525073 887394639 /nfs/dbraw/zinc/39/46/39/887394639.db2.gz WLYOPQYWHIFERM-JOCHJYFZSA-N 0 3 406.530 4.002 20 0 HIADHN C[C@@H](CNC(=O)N[C@H](c1cccc(Cl)c1)C1CCCCC1)CN1CCN(C)CC1 ZINC000472636290 887500538 /nfs/dbraw/zinc/50/05/38/887500538.db2.gz FFKXGHYORDEWQA-AVRDEDQJSA-N 0 3 421.029 4.144 20 0 HIADHN CN(C)Cc1ccc(S(=O)(=O)N(Cc2cccnc2)c2ccc(Cl)cc2)cc1 ZINC000472676649 887531108 /nfs/dbraw/zinc/53/11/08/887531108.db2.gz IZWDHYNSIZLJFK-UHFFFAOYSA-N 0 3 415.946 4.192 20 0 HIADHN CN(C(=O)Nc1cccc(OC[C@@H]2CCCO2)c1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000472687355 887541594 /nfs/dbraw/zinc/54/15/94/887541594.db2.gz YULVJTJQWKSZFS-UPVQGACJSA-N 0 3 423.557 4.373 20 0 HIADHN Cc1cc(C(=O)NC(C)C)ccc1NC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000472694806 887548560 /nfs/dbraw/zinc/54/85/60/887548560.db2.gz UZBBGOYQELSDOX-JOCHJYFZSA-N 0 3 422.573 4.262 20 0 HIADHN Cc1nc(CC(C)C)c(NC(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)s1 ZINC000472717553 887565580 /nfs/dbraw/zinc/56/55/80/887565580.db2.gz XEWZGRWUUBCBJQ-UHFFFAOYSA-N 0 3 400.592 4.433 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)c(Cl)c1 ZINC000472736416 887583158 /nfs/dbraw/zinc/58/31/58/887583158.db2.gz HFOJGCQBJMIGCR-LJQANCHMSA-N 0 3 414.937 4.427 20 0 HIADHN CN(C(=O)Nc1cccc(N2CCCCC2=O)c1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000472799820 887644681 /nfs/dbraw/zinc/64/46/81/887644681.db2.gz PNGJYBDNZLGWEI-QHCPKHFHSA-N 0 3 420.557 4.332 20 0 HIADHN COC[C@@H](NC(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1)c1ccc(C)o1 ZINC000472819251 887663570 /nfs/dbraw/zinc/66/35/70/887663570.db2.gz ZRIXRVXYHOKNHS-MSOLQXFVSA-N 0 3 405.564 4.109 20 0 HIADHN Cc1ccc(NC(=O)NCCN(C)Cc2ccccc2)c(-c2nc(C3CC3)no2)c1 ZINC000472850907 887705394 /nfs/dbraw/zinc/70/53/94/887705394.db2.gz KTSSWHQDYGUNTK-UHFFFAOYSA-N 0 3 405.502 4.176 20 0 HIADHN C[C@H](CCN1CCN(C)CC1)NC(=O)N[C@H](CCCc1ccccc1)c1ccccc1 ZINC000472905113 887751845 /nfs/dbraw/zinc/75/18/45/887751845.db2.gz ARADNPZZXQUARP-RCZVLFRGSA-N 0 3 422.617 4.076 20 0 HIADHN CC(C)CC[C@@H](NC(=O)N[C@@H](C)CCN1CCN(C)CC1)c1ccc(Cl)cc1 ZINC000472918298 887763253 /nfs/dbraw/zinc/76/32/53/887763253.db2.gz BAZRHIGQZRIQHO-GHTZIAJQSA-N 0 3 409.018 4.143 20 0 HIADHN CCOc1ccc(NC(=O)COc2ccc(CN3CCCC4(CC4)C3)cc2OC)cc1 ZINC000473058608 887880003 /nfs/dbraw/zinc/88/00/03/887880003.db2.gz MVYNACVIRSNXTN-UHFFFAOYSA-N 0 3 424.541 4.487 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)C3(Cc4ccccc4Cl)CC3)CC2)C[C@H](C)O1 ZINC000473185021 887965232 /nfs/dbraw/zinc/96/52/32/887965232.db2.gz VZSYUHBDSBVWNY-HDICACEKSA-N 0 3 404.982 4.011 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)C3(Cc4ccccc4Cl)CC3)CC2)C[C@H](C)O1 ZINC000473185031 887965389 /nfs/dbraw/zinc/96/53/89/887965389.db2.gz VZSYUHBDSBVWNY-ROUUACIJSA-N 0 3 404.982 4.011 20 0 HIADHN Cc1c(F)c(C(F)(F)F)ccc1C(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000473185864 887965462 /nfs/dbraw/zinc/96/54/62/887965462.db2.gz YDBSNQKWHLZKGS-ZIAGYGMSSA-N 0 3 416.459 4.114 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)CCc3cccs3)c(OCC)c2)CC1 ZINC000473233914 888004362 /nfs/dbraw/zinc/00/43/62/888004362.db2.gz YUVOANDHPHFLEP-UHFFFAOYSA-N 0 3 401.576 4.250 20 0 HIADHN COc1ccc(C(=O)CCCC(=O)NC2[C@H](C)CN(Cc3ccccc3)C[C@H]2C)cc1 ZINC000473269747 888028928 /nfs/dbraw/zinc/02/89/28/888028928.db2.gz MZLFSQRFKWRJSJ-WOJBJXKFSA-N 0 3 422.569 4.321 20 0 HIADHN O=C(C[C@@H](c1cccs1)n1cccc1)NCC1(N2CCSCC2)CCCC1 ZINC000473281421 888037062 /nfs/dbraw/zinc/03/70/62/888037062.db2.gz POTVCUSIIRSZCO-SFHVURJKSA-N 0 3 403.617 4.007 20 0 HIADHN C[C@@H](CCN1CCN(C)CC1)NC(=O)Nc1cc(Cl)ccc1Oc1ccccc1 ZINC000473493713 888214373 /nfs/dbraw/zinc/21/43/73/888214373.db2.gz WVUUQWKVYMUDQB-KRWDZBQOSA-N 0 3 416.953 4.280 20 0 HIADHN Cc1ccc(C(=O)CCC(=O)N2CC[C@]3(C2)CCCN(Cc2ccccc2)C3)cc1 ZINC000473495761 888217858 /nfs/dbraw/zinc/21/78/58/888217858.db2.gz CPYSUOBTTPAFCR-AREMUKBSSA-N 0 3 404.554 4.473 20 0 HIADHN Cc1cc(OCC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)ccc1C(C)C ZINC000473512241 888241035 /nfs/dbraw/zinc/24/10/35/888241035.db2.gz JKUGVXMDJCYYLJ-UHFFFAOYSA-N 0 3 412.496 4.419 20 0 HIADHN CCSc1ccc(CC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cc1 ZINC000473514196 888243836 /nfs/dbraw/zinc/24/38/36/888243836.db2.gz QQMSGQNKPPICMF-UHFFFAOYSA-N 0 3 400.510 4.263 20 0 HIADHN O=C(CCSc1ccc(F)cc1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473515066 888245807 /nfs/dbraw/zinc/24/58/07/888245807.db2.gz VAWZWZDXYGDTMG-UHFFFAOYSA-N 0 3 404.473 4.229 20 0 HIADHN COc1cc(C2(C(=O)NC3CC(N4CCC(C(F)(F)F)CC4)C3)CCC2)ccc1C ZINC000473518366 888249529 /nfs/dbraw/zinc/24/95/29/888249529.db2.gz DNHLBYGSKBPGQJ-UHFFFAOYSA-N 0 3 424.507 4.347 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1cncc(-c2ccccc2)c1 ZINC000473518421 888249908 /nfs/dbraw/zinc/24/99/08/888249908.db2.gz KQYMXHKNHMGLLO-UHFFFAOYSA-N 0 3 403.448 4.284 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)[C@@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000473517998 888250849 /nfs/dbraw/zinc/25/08/49/888250849.db2.gz KIXSMRBFQZJABA-QSFCEBDXSA-N 0 3 400.407 4.277 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1ccc2c3c(cccc31)CC2 ZINC000473518750 888251541 /nfs/dbraw/zinc/25/15/41/888251541.db2.gz LCJZEGVDAFACKK-UHFFFAOYSA-N 0 3 402.460 4.474 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)[C@H]1SCCc2sccc21 ZINC000473522348 888256833 /nfs/dbraw/zinc/25/68/33/888256833.db2.gz FPILQZGWVROOCX-ZUEPYMLJSA-N 0 3 404.523 4.000 20 0 HIADHN Cc1ccc(-c2cc(C(=O)NC3CC(N4CCC(C(F)(F)F)CC4)C3)on2)cc1 ZINC000473526275 888263112 /nfs/dbraw/zinc/26/31/12/888263112.db2.gz YGDFEHZCTASQDU-UHFFFAOYSA-N 0 3 407.436 4.185 20 0 HIADHN O=C(COc1cccc2ccccc21)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473537056 888276129 /nfs/dbraw/zinc/27/61/29/888276129.db2.gz YWMKVACHZVQJGE-UHFFFAOYSA-N 0 3 406.448 4.140 20 0 HIADHN CN1CCN(CCC(C)(C)NC(=O)Nc2ccccc2SC2CCCC2)CC1 ZINC000473647745 888394935 /nfs/dbraw/zinc/39/49/35/888394935.db2.gz IFOXEWBCCNWLCA-UHFFFAOYSA-N 0 3 404.624 4.259 20 0 HIADHN CN1CCN(CCC(C)(C)NC(=O)Nc2cccc(CSC3CCCC3)c2)CC1 ZINC000473704809 888482069 /nfs/dbraw/zinc/48/20/69/888482069.db2.gz FWKQHNNQDLHKLT-UHFFFAOYSA-N 0 3 418.651 4.400 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)NC[C@H]3CCC[C@H](C(F)(F)F)C3)c2)CC1 ZINC000473810370 888634215 /nfs/dbraw/zinc/63/42/15/888634215.db2.gz SOJPLMKVPHNCBX-IRXDYDNUSA-N 0 3 412.500 4.319 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@@](C)(CC)c3nc(C)cs3)c2)CC1 ZINC000473825919 888658258 /nfs/dbraw/zinc/65/82/58/888658258.db2.gz XGNBDFWYPATLEO-NRFANRHFSA-N 0 3 401.580 4.040 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)NCc3ccccc3N3CCCCC3)c2)CC1 ZINC000473836543 888674457 /nfs/dbraw/zinc/67/44/57/888674457.db2.gz ONSPFXILWLIPRG-UHFFFAOYSA-N 0 3 421.589 4.141 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@@H]3CCCO[C@@H]3c3ccc(C)cc3)c2)CC1 ZINC000473839137 888678247 /nfs/dbraw/zinc/67/82/47/888678247.db2.gz YQMQHXJKSRFVNC-DNQXCXABSA-N 0 3 422.573 4.179 20 0 HIADHN O=C(N[C@@H](c1cccc(Cl)c1)c1ccccn1)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000473880793 888747409 /nfs/dbraw/zinc/74/74/09/888747409.db2.gz BQRUWGSAFSIBJZ-GMAHTHKFSA-N 0 3 420.944 4.398 20 0 HIADHN CCOc1cccc2[nH]cc(CC(=O)N3CC[C@@H](C)N(Cc4ccccc4)CC3)c21 ZINC000473887687 888757714 /nfs/dbraw/zinc/75/77/14/888757714.db2.gz PTEYVTKIQHGZPM-LJQANCHMSA-N 0 3 405.542 4.232 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCSC[C@H]1c1nccs1)c1ccsc1 ZINC000473890287 888760720 /nfs/dbraw/zinc/76/07/20/888760720.db2.gz CFRCZWOBDWNHFZ-CVEARBPZSA-N 0 3 410.634 4.087 20 0 HIADHN CN1CCN(CCC(C)(C)NC(=O)N[C@H](CCc2ccccc2)c2ccccc2)CC1 ZINC000473908251 888785703 /nfs/dbraw/zinc/78/57/03/888785703.db2.gz VUKBMDZJCKYEOK-XMMPIXPASA-N 0 3 422.617 4.076 20 0 HIADHN O=C(Nc1ccccc1-c1cccs1)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1CO ZINC000473976840 888841913 /nfs/dbraw/zinc/84/19/13/888841913.db2.gz STIVVTGAYWZANB-PZJWPPBQSA-N 0 3 421.566 4.420 20 0 HIADHN C[C@H](NC(=O)N1CCSC[C@H]1c1cccc(C(F)(F)F)c1)C1=CCN(C)CC1 ZINC000473998863 888858068 /nfs/dbraw/zinc/85/80/68/888858068.db2.gz CEHPFIIRQFTOML-KSSFIOAISA-N 0 3 413.509 4.155 20 0 HIADHN Cc1ccccc1C(NC(=O)NC(C)(C)CCN1CCN(C)CC1)c1ccccc1C ZINC000474013974 888869351 /nfs/dbraw/zinc/86/93/51/888869351.db2.gz XLLWECZGEQDTKG-UHFFFAOYSA-N 0 3 422.617 4.108 20 0 HIADHN CC[C@H](C)[C@@H](NC(=O)NC(C)(C)CCN1CCN(C)CC1)c1ccc(Cl)cc1 ZINC000474041364 888884806 /nfs/dbraw/zinc/88/48/06/888884806.db2.gz YTAYILMLCLKHKL-FXAWDEMLSA-N 0 3 409.018 4.143 20 0 HIADHN Cc1cccc2c1OCC[C@H]2N[C@@H](C)CC(=O)Nc1ccc(NC(=O)C2CC2)cc1 ZINC000474095060 888921120 /nfs/dbraw/zinc/92/11/20/888921120.db2.gz KOBGZWZVLAPAHJ-HRAATJIYSA-N 0 3 407.514 4.174 20 0 HIADHN CCCOc1ccc(CN[C@H](C)c2cccc(N3CCCS3(=O)=O)c2)c(C)c1 ZINC000474101970 888923973 /nfs/dbraw/zinc/92/39/73/888923973.db2.gz BEFDYTXUFJRTJY-GOSISDBHSA-N 0 3 402.560 4.175 20 0 HIADHN CCC(CC)[C@H](NC(=O)N1CCN(c2ccncc2OC)CC1)c1cccs1 ZINC000474132266 888953197 /nfs/dbraw/zinc/95/31/97/888953197.db2.gz BZLSPWJEJVPTAE-FQEVSTJZSA-N 0 3 402.564 4.161 20 0 HIADHN COc1ccc(C(=O)CCCCCC(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)cc1 ZINC000474259721 889118549 /nfs/dbraw/zinc/11/85/49/889118549.db2.gz QUHRKZLSSANERO-RDGATRHJSA-N 0 3 408.542 4.390 20 0 HIADHN CN(C)CCN(C(=O)c1ccc(NC(=O)Nc2ccccc2)s1)C1CCCC1 ZINC000474299471 889163153 /nfs/dbraw/zinc/16/31/53/889163153.db2.gz PUWMUNHWACORDE-UHFFFAOYSA-N 0 3 400.548 4.339 20 0 HIADHN CO[C@]1(C)CCCN(C(=O)N[C@@H](CN2CCc3ccccc3C2)C(C)(C)C)CC1 ZINC000474361914 889241049 /nfs/dbraw/zinc/24/10/49/889241049.db2.gz GLQHHOJHZRLDRL-XUZZJYLKSA-N 0 3 401.595 4.060 20 0 HIADHN Brc1cnc(CNC2CCC3(CCOCC3)CC2)c(Br)c1 ZINC000474368029 889246619 /nfs/dbraw/zinc/24/66/19/889246619.db2.gz ITFUCSTVHWBLPY-UHFFFAOYSA-N 0 3 418.173 4.436 20 0 HIADHN CCOC(=O)c1c([N-]C(=O)c2cc(C(C)C)no2)sc2c1CC(C)(C)[NH2+]C2(C)C ZINC000504555694 913330227 /nfs/dbraw/zinc/33/02/27/913330227.db2.gz OJJSJHNVIQCJTM-UHFFFAOYSA-N 0 3 419.547 4.448 20 0 HIADHN C[C@@H](NC(=O)Nc1nnc(Cc2cccc(F)c2)s1)[C@H](c1ccccc1)N(C)C ZINC000474434109 889300186 /nfs/dbraw/zinc/30/01/86/889300186.db2.gz XCIWQBKJGPMLKH-AUUYWEPGSA-N 0 3 413.522 4.081 20 0 HIADHN COc1cc(NC(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)ccc1Br ZINC000474436795 889301171 /nfs/dbraw/zinc/30/11/71/889301171.db2.gz FEYIVUSMEYLFTG-UGSOOPFHSA-N 0 3 406.324 4.271 20 0 HIADHN Clc1ccc(CNCc2cc(Cl)c3c(c2)OCCCO3)c(-n2cncn2)c1 ZINC000474482278 889341656 /nfs/dbraw/zinc/34/16/56/889341656.db2.gz YWYICBFYLJVARH-UHFFFAOYSA-N 0 3 405.285 4.025 20 0 HIADHN C[C@H](NC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1)c1noc(-c2ccccc2)n1 ZINC000474527158 889399250 /nfs/dbraw/zinc/39/92/50/889399250.db2.gz VBAHHWUFXVZJIH-GHTZIAJQSA-N 0 3 419.529 4.104 20 0 HIADHN C[C@@H](CC(=O)Nc1cccc(N2CCCC2)c1)NCc1ccnn1-c1ccc(F)cc1 ZINC000474597018 889464659 /nfs/dbraw/zinc/46/46/59/889464659.db2.gz ISHUDHKWGCRIDZ-SFHVURJKSA-N 0 3 421.520 4.119 20 0 HIADHN CN(C(=O)Nc1cc2c(cc1Cl)OCCCO2)[C@H]1CCN(Cc2ccccc2)C1 ZINC000474706948 889564882 /nfs/dbraw/zinc/56/48/82/889564882.db2.gz JCJGVIXTDIXQOH-KRWDZBQOSA-N 0 3 415.921 4.240 20 0 HIADHN C[C@@H](Sc1cc(Cl)ccc1Cl)C(=O)NC(C)(C)CCN1CCN(C)CC1 ZINC000474825021 889679313 /nfs/dbraw/zinc/67/93/13/889679313.db2.gz YJKTVKGYKDTUQW-CQSZACIVSA-N 0 3 418.434 4.006 20 0 HIADHN C[C@H](Sc1cc(Cl)ccc1Cl)C(=O)NC(C)(C)CCN1CCN(C)CC1 ZINC000474825020 889679700 /nfs/dbraw/zinc/67/97/00/889679700.db2.gz YJKTVKGYKDTUQW-AWEZNQCLSA-N 0 3 418.434 4.006 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)c3cnn(C(C)(C)C)c3C(F)(F)F)c2)CC1 ZINC000474832799 889691990 /nfs/dbraw/zinc/69/19/90/889691990.db2.gz LEZDXXZIKKDODQ-UHFFFAOYSA-N 0 3 423.483 4.051 20 0 HIADHN O=C(c1cc(-c2ccc(F)cc2)on1)N1CCCN(CCCc2ccccc2)CC1 ZINC000474873664 889727945 /nfs/dbraw/zinc/72/79/45/889727945.db2.gz SUNIQBQWQCDNMF-UHFFFAOYSA-N 0 3 407.489 4.261 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)C[C@H](C)c2ccccc2C(F)(F)F)CC1 ZINC000474877677 889732089 /nfs/dbraw/zinc/73/20/89/889732089.db2.gz KZNZNKFXEPFZBH-INIZCTEOSA-N 0 3 400.485 4.205 20 0 HIADHN Cc1c(F)ccc(Cl)c1C(=O)NCCCCN1CCN(Cc2ccccc2)CC1 ZINC000474971013 889826678 /nfs/dbraw/zinc/82/66/78/889826678.db2.gz RNKOSZZTPNFHBW-UHFFFAOYSA-N 0 3 417.956 4.115 20 0 HIADHN CCN(C(=O)Nc1ccc2ccn(CCOC)c2c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475020513 889872912 /nfs/dbraw/zinc/87/29/12/889872912.db2.gz ZTKHOLLLRZSJII-HSZRJFAPSA-N 0 3 420.557 4.416 20 0 HIADHN CN(C)Cc1cccc(NC(=O)N2CCO[C@H](c3cccc(C(F)(F)F)c3)C2)c1 ZINC000475036015 889888002 /nfs/dbraw/zinc/88/80/02/889888002.db2.gz UZHZEHOKEGDKAQ-IBGZPJMESA-N 0 3 407.436 4.372 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1ccccc1OCC(F)F ZINC000475041725 889893693 /nfs/dbraw/zinc/89/36/93/889893693.db2.gz GKKFRVQAMMWJFG-KRWDZBQOSA-N 0 3 403.473 4.459 20 0 HIADHN CCS(=O)(=O)CCCCCN(C)CC1(c2ccc(Br)cc2)CC1 ZINC000475050752 889898253 /nfs/dbraw/zinc/89/82/53/889898253.db2.gz UJBGDVJVOPPBSV-UHFFFAOYSA-N 0 3 402.398 4.018 20 0 HIADHN CCOc1cc(CNc2cccc(N3CCN(CC)CC3)c2)ccc1OC(F)F ZINC000475084275 889930602 /nfs/dbraw/zinc/93/06/02/889930602.db2.gz BYIHNKUTRKWSSW-UHFFFAOYSA-N 0 3 405.489 4.441 20 0 HIADHN CCN(C(=O)Nc1ccc(C[C@@H](C)C(=O)OC)cc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475109590 889959819 /nfs/dbraw/zinc/95/98/19/889959819.db2.gz LAKIIYBSRZPICK-AUSIDOKSSA-N 0 3 423.557 4.167 20 0 HIADHN CN(C(=O)NCc1ccccc1OCC(F)(F)F)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475128039 889990024 /nfs/dbraw/zinc/99/00/24/889990024.db2.gz CTKZLLXQZDZUHZ-LJQANCHMSA-N 0 3 421.463 4.044 20 0 HIADHN CN(C(=O)NCc1cc(Br)ccc1F)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475138474 890003638 /nfs/dbraw/zinc/00/36/38/890003638.db2.gz KYLKOFDBTSLQHA-GOSISDBHSA-N 0 3 420.326 4.004 20 0 HIADHN CCc1cnc(CN(C)C(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)s1 ZINC000475148088 890015474 /nfs/dbraw/zinc/01/54/74/890015474.db2.gz XKFSXUJJLIYQQO-KRWDZBQOSA-N 0 3 406.621 4.382 20 0 HIADHN CCN(C(=O)N[C@@H](C)c1cccc(NC(C)=O)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475162333 890026134 /nfs/dbraw/zinc/02/61/34/890026134.db2.gz KADRROWAIGCGCR-MBSDFSHPSA-N 0 3 408.546 4.012 20 0 HIADHN CCN(C(=O)N[C@@H]1CCO[C@@H](c2ccccc2)C1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475164758 890030973 /nfs/dbraw/zinc/03/09/73/890030973.db2.gz PNXCFVZUKBRVIN-TZRRMPRUSA-N 0 3 407.558 4.213 20 0 HIADHN CCN(C(=O)NC[C@@H]1CCCO[C@H]1C(C)(C)C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475169618 890036337 /nfs/dbraw/zinc/03/63/37/890036337.db2.gz DGGQWQDFPUSMDM-BHDDXSALSA-N 0 3 401.595 4.134 20 0 HIADHN CCN(C(=O)N[C@H](c1ccccc1)[C@@H]1CCOC1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475172775 890040577 /nfs/dbraw/zinc/04/05/77/890040577.db2.gz GFCADHZGTVAJJI-TZRRMPRUSA-N 0 3 407.558 4.070 20 0 HIADHN CCC(CC)[C@@H]1C[C@@H](NC(=O)N(CC)[C@H]2CCN(Cc3ccccc3)C2)CCO1 ZINC000475173280 890040669 /nfs/dbraw/zinc/04/06/69/890040669.db2.gz IZCUIDBOQLWMGW-VABKMULXSA-N 0 3 401.595 4.276 20 0 HIADHN CCN(C(=O)NCc1coc(-c2ccc(C)cc2)n1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475177511 890046752 /nfs/dbraw/zinc/04/67/52/890046752.db2.gz YQEJLPPYINDXMB-HSZRJFAPSA-N 0 3 418.541 4.456 20 0 HIADHN COC(=O)C[C@@H]1CC[C@H](N[C@@H](C)c2nc(-c3ccc(Br)cc3)no2)[C@@H]1C ZINC000475192805 890062270 /nfs/dbraw/zinc/06/22/70/890062270.db2.gz BZZJUOSNDTWFFX-DSPQJCBJSA-N 0 3 422.323 4.128 20 0 HIADHN CCOC1CC(CNCc2c(Cl)cccc2SC(C)C)(N2CCOCC2)C1 ZINC000475217095 890086565 /nfs/dbraw/zinc/08/65/65/890086565.db2.gz VSURLFMBUIFXLO-UHFFFAOYSA-N 0 3 413.027 4.200 20 0 HIADHN Cc1ccc(-c2nc(CNC(=O)N(C)[C@@H]3CCN(Cc4ccccc4)C3)co2)cc1 ZINC000475281902 890181163 /nfs/dbraw/zinc/18/11/63/890181163.db2.gz QLRZTDZYWACQAU-JOCHJYFZSA-N 0 3 404.514 4.066 20 0 HIADHN CCOc1cc(CN2CCC[C@](C)(OC)C2)ccc1OCC(=O)Nc1ccccc1 ZINC000475288448 890187872 /nfs/dbraw/zinc/18/78/72/890187872.db2.gz ZBZDABLCLCNWGZ-DEOSSOPVSA-N 0 3 412.530 4.104 20 0 HIADHN CCOc1cc(CN2CCC[C@](C)(OC)C2)ccc1OCC(=O)N(C(C)C)C(C)C ZINC000475288995 890191105 /nfs/dbraw/zinc/19/11/05/890191105.db2.gz WPNMMTAAIDRYQW-DEOSSOPVSA-N 0 3 420.594 4.110 20 0 HIADHN Cc1nc(COc2cccc(C(=O)N(C)[C@H]3CCN(Cc4ccccc4)C3)c2)cs1 ZINC000475300959 890207536 /nfs/dbraw/zinc/20/75/36/890207536.db2.gz HWOMEANPUWFDNT-QFIPXVFZSA-N 0 3 421.566 4.377 20 0 HIADHN COc1ccc(-c2cncc(C(=O)N(C)[C@@H]3CCN(Cc4ccccc4)C3)c2)cc1 ZINC000475300798 890208324 /nfs/dbraw/zinc/20/83/24/890208324.db2.gz VJQLQQDQSFPCOY-HSZRJFAPSA-N 0 3 401.510 4.104 20 0 HIADHN Cc1cc(CSc2ncccc2C(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)no1 ZINC000475303238 890211639 /nfs/dbraw/zinc/21/16/39/890211639.db2.gz GZBZHBUFXDWNHA-HXUWFJFHSA-N 0 3 422.554 4.017 20 0 HIADHN CN(C(=O)c1cccc(OCc2cscn2)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475302966 890212971 /nfs/dbraw/zinc/21/29/71/890212971.db2.gz GODFIVRJEBQKDV-OAQYLSRUSA-N 0 3 407.539 4.069 20 0 HIADHN Cc1ccc(-c2nc(CC(=O)N(C)[C@H]3CCN(Cc4ccccc4)C3)cs2)cc1 ZINC000475309898 890223007 /nfs/dbraw/zinc/22/30/07/890223007.db2.gz ZKGKZIYSLDJKBP-QFIPXVFZSA-N 0 3 405.567 4.394 20 0 HIADHN CN(C(=O)CCc1cc(Br)cs1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475318778 890236137 /nfs/dbraw/zinc/23/61/37/890236137.db2.gz RCTCMXUFVMXTJK-QGZVFWFLSA-N 0 3 407.377 4.176 20 0 HIADHN C[C@H]1C(=O)CC[C@@H]1CC(=O)N1CCC(N(C)Cc2cccc(C(F)(F)F)c2)CC1 ZINC000475329380 890248300 /nfs/dbraw/zinc/24/83/00/890248300.db2.gz UDALWMNJPUOSQL-NVXWUHKLSA-N 0 3 410.480 4.134 20 0 HIADHN Cn1ccnc1[C@H](NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1cccc(F)c1 ZINC000475334117 890253698 /nfs/dbraw/zinc/25/36/98/890253698.db2.gz NAYGWGNZUDOCMK-CTWPCTMYSA-N 0 3 410.459 4.044 20 0 HIADHN COC(=O)[C@H]1CCN(Cc2cn(-c3ccccc3)nc2-c2ccc(OC)cc2)C[C@@H]1C ZINC000475360873 890287619 /nfs/dbraw/zinc/28/76/19/890287619.db2.gz CRCTXRIWISCCFM-MBSDFSHPSA-N 0 3 419.525 4.179 20 0 HIADHN COC(=O)[C@@H]1CCN(Cc2cccc(NC(=O)c3ccc(Cl)cc3)c2)C[C@@H]1C ZINC000475376145 890305882 /nfs/dbraw/zinc/30/58/82/890305882.db2.gz WBYXZOVLLJCCPW-MGPUTAFESA-N 0 3 400.906 4.223 20 0 HIADHN Cc1c(CN2CCSCC2)cccc1NC(=O)[C@H]1CCc2[nH]c(C(C)C)nc2C1 ZINC000475384443 890312378 /nfs/dbraw/zinc/31/23/78/890312378.db2.gz VOFLGXUELGCXQZ-KRWDZBQOSA-N 0 3 412.603 4.134 20 0 HIADHN Cc1c(CN2CCSCC2)cccc1NC(=O)[C@H]1CCc2nc(C(C)C)[nH]c2C1 ZINC000475384443 890312399 /nfs/dbraw/zinc/31/23/99/890312399.db2.gz VOFLGXUELGCXQZ-KRWDZBQOSA-N 0 3 412.603 4.134 20 0 HIADHN Cc1c(CN2CCSCC2)cccc1NC(=O)[C@@H]1CCc2[nH]c(C(C)C)nc2C1 ZINC000475384444 890312479 /nfs/dbraw/zinc/31/24/79/890312479.db2.gz VOFLGXUELGCXQZ-QGZVFWFLSA-N 0 3 412.603 4.134 20 0 HIADHN Cc1c(CN2CCSCC2)cccc1NC(=O)[C@@H]1CCc2nc(C(C)C)[nH]c2C1 ZINC000475384444 890312499 /nfs/dbraw/zinc/31/24/99/890312499.db2.gz VOFLGXUELGCXQZ-QGZVFWFLSA-N 0 3 412.603 4.134 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2CNCC2(S(C)(=O)=O)CCC2)c(C)c1 ZINC000475432093 890350926 /nfs/dbraw/zinc/35/09/26/890350926.db2.gz PYRRQJXHYQSDIV-UHFFFAOYSA-N 0 3 423.582 4.213 20 0 HIADHN COc1ccc(C(=O)N(Cc2ccco2)C2CCN(C)CC2)c(OCC(C)C)c1 ZINC000475481519 890388051 /nfs/dbraw/zinc/38/80/51/890388051.db2.gz NNHRAOYSLNERRA-UHFFFAOYSA-N 0 3 400.519 4.060 20 0 HIADHN COc1ccc(CN(CCc2ccccn2)Cc2cc(OC)c3c(c2)OCCO3)cc1 ZINC000475545593 890470700 /nfs/dbraw/zinc/47/07/00/890470700.db2.gz FPFTUMXCWZUILO-UHFFFAOYSA-N 0 3 420.509 4.115 20 0 HIADHN CN(C)c1ccc(-c2cncc(C(=O)N(C)[C@H]3CCN(Cc4ccccc4)C3)c2)cc1 ZINC000475562033 890490717 /nfs/dbraw/zinc/49/07/17/890490717.db2.gz SOHQOYPBOBBOFO-VWLOTQADSA-N 0 3 414.553 4.161 20 0 HIADHN Cc1ccc(-n2cccn2)cc1NC(=O)N(CCN(C)C)Cc1ccc(F)c(F)c1 ZINC000475611170 890539936 /nfs/dbraw/zinc/53/99/36/890539936.db2.gz GWHHLKQEXCRTRQ-UHFFFAOYSA-N 0 3 413.472 4.055 20 0 HIADHN Cc1csc(-c2cccc(NC(=O)NC3CCN(CCOC(C)C)CC3)c2)n1 ZINC000475618319 890549830 /nfs/dbraw/zinc/54/98/30/890549830.db2.gz AFNQJFVGAFQHRQ-UHFFFAOYSA-N 0 3 402.564 4.129 20 0 HIADHN Cc1ccc(-n2cccn2)cc1NC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1 ZINC000475637200 890577432 /nfs/dbraw/zinc/57/74/32/890577432.db2.gz XUQPRFLZAACGAF-FQEVSTJZSA-N 0 3 403.530 4.309 20 0 HIADHN Cc1ccc(-n2cccn2)cc1NC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000475646162 890588672 /nfs/dbraw/zinc/58/86/72/890588672.db2.gz PMXFURGHOAFVJO-QFIPXVFZSA-N 0 3 403.530 4.309 20 0 HIADHN CCN(C(=O)c1ccnc(N2CC[C@H](C)C2)c1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000475648102 890591910 /nfs/dbraw/zinc/59/19/10/890591910.db2.gz GFIXNDMBAUSLFY-MIZPHKNDSA-N 0 3 406.574 4.225 20 0 HIADHN CCc1nnc(-c2ccc(NC(=O)NC[C@@H]3CCCN3Cc3ccccc3)cc2)o1 ZINC000475712787 890650028 /nfs/dbraw/zinc/65/00/28/890650028.db2.gz ZPEYCXQHKGZDNC-FQEVSTJZSA-N 0 3 405.502 4.085 20 0 HIADHN COc1ccc(CNC(=O)CN(C)[C@@H](C)[C@H](C)c2ccc(Cl)cc2)cc1OC ZINC000475739847 890682396 /nfs/dbraw/zinc/68/23/96/890682396.db2.gz PNIYBLDSAZFASU-HOTGVXAUSA-N 0 3 404.938 4.097 20 0 HIADHN C[C@@H](NCC1(N2CCSCC2)CCCC1)c1nc(-c2ccc(Cl)cc2)no1 ZINC000475756065 890703224 /nfs/dbraw/zinc/70/32/24/890703224.db2.gz ZIJIOPDYEWUXDL-OAHLLOKOSA-N 0 3 406.983 4.402 20 0 HIADHN CC(C)(C)CCN1CCN(C(=O)Nc2cccc3c2CN(CC(F)(F)F)C3)CC1 ZINC000504755806 913494159 /nfs/dbraw/zinc/49/41/59/913494159.db2.gz SVAGIMHZDHQTCH-UHFFFAOYSA-N 0 3 412.500 4.150 20 0 HIADHN CN(C(=O)c1cn(C)nc1-c1ccc(Cl)s1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475918166 890844316 /nfs/dbraw/zinc/84/43/16/890844316.db2.gz KBHBTNMXQSEPNH-INIZCTEOSA-N 0 3 414.962 4.149 20 0 HIADHN Cc1ccc([C@@H](NC(=O)NC2CCN(CCOC(C)C)CC2)c2ccccc2)cc1 ZINC000475953809 890875849 /nfs/dbraw/zinc/87/58/49/890875849.db2.gz KURUQOSXXNGPHD-DEOSSOPVSA-N 0 3 409.574 4.273 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)NCC2(c3cccs3)CCCCC2)CC1 ZINC000476034992 890967073 /nfs/dbraw/zinc/96/70/73/890967073.db2.gz RIMFVHNHQAQZJT-UHFFFAOYSA-N 0 3 407.624 4.139 20 0 HIADHN COC(=O)c1cc2cc(NC(=O)NCC(C)(C)N3CCc4ccccc4C3)ccc2o1 ZINC000504779923 913508288 /nfs/dbraw/zinc/50/82/88/913508288.db2.gz WFSBBIZDLYSBOB-UHFFFAOYSA-N 0 3 421.497 4.178 20 0 HIADHN Cc1csc([C@@H](C)NC(=O)N[C@H](CN2CCc3ccccc3C2)C(C)(C)C)n1 ZINC000476054688 890983692 /nfs/dbraw/zinc/98/36/92/890983692.db2.gz KHLXBFFTEOIDGQ-VQIMIIECSA-N 0 3 400.592 4.285 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)NC[C@@H](C)c2c(Cl)cccc2Cl)CC1 ZINC000476057181 890987642 /nfs/dbraw/zinc/98/76/42/890987642.db2.gz ZXMSUMQHEXGOGA-OAHLLOKOSA-N 0 3 416.393 4.286 20 0 HIADHN CSc1cnn(-c2ccccc2)c1NC(=O)N[C@H](C)[C@H](c1ccccc1)N(C)C ZINC000476131229 891053166 /nfs/dbraw/zinc/05/31/66/891053166.db2.gz CYTRKRMLKRFINL-OXQOHEQNSA-N 0 3 409.559 4.407 20 0 HIADHN C[C@H]1CCc2ccccc2[C@H]1NC(=O)N(C)C1CCN(CCc2ccccn2)CC1 ZINC000476192605 891124451 /nfs/dbraw/zinc/12/44/51/891124451.db2.gz GTJNFVPBJFJSNX-CYFREDJKSA-N 0 3 406.574 4.054 20 0 HIADHN CCOc1ccc([C@H](NC(=O)N(C)[C@H]2CCN(C3CC3)C2)C(C)C)cc1OCC ZINC000476372708 891285579 /nfs/dbraw/zinc/28/55/79/891285579.db2.gz BGJCYZLYEZKGRB-SIKLNZKXSA-N 0 3 403.567 4.059 20 0 HIADHN CCCSc1nsc(NC(=O)N2CCCN(CCCc3ccccc3)CC2)n1 ZINC000476496304 891406799 /nfs/dbraw/zinc/40/67/99/891406799.db2.gz XNZBJPGHAFLODH-UHFFFAOYSA-N 0 3 419.620 4.213 20 0 HIADHN C[C@@H]1CO[C@H](c2ccccc2Cl)CN1C(=O)NC[C@@H](c1ccccc1)N(C)C ZINC000476596793 891528929 /nfs/dbraw/zinc/52/89/29/891528929.db2.gz MDEKVCJONQMBGJ-CZAAIQMYSA-N 0 3 401.938 4.114 20 0 HIADHN CC(C)([C@@H](NC(=O)Cc1ccc2n[nH]cc2c1)c1ccc(F)c(F)c1)N1CCCC1 ZINC000476620768 891554088 /nfs/dbraw/zinc/55/40/88/891554088.db2.gz VITNFTSVYZTQAT-QFIPXVFZSA-N 0 3 412.484 4.116 20 0 HIADHN CC(C)([C@H](NC(=O)Cc1ccc2n[nH]cc2c1)c1ccc(F)c(F)c1)N1CCCC1 ZINC000476620767 891555334 /nfs/dbraw/zinc/55/53/34/891555334.db2.gz VITNFTSVYZTQAT-JOCHJYFZSA-N 0 3 412.484 4.116 20 0 HIADHN CC(C)([C@@H](NC(=O)Cc1ccc2c[nH]nc2c1)c1ccc(F)c(F)c1)N1CCCC1 ZINC000476621166 891555475 /nfs/dbraw/zinc/55/54/75/891555475.db2.gz ZUBLXMHNBIOPKJ-QFIPXVFZSA-N 0 3 412.484 4.116 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N(C)[C@@H]2CCCc3nc(C)sc32)N(C)C)cc1 ZINC000476622648 891556799 /nfs/dbraw/zinc/55/67/99/891556799.db2.gz FKBXATYMVBRYJI-UXHICEINSA-N 0 3 400.592 4.336 20 0 HIADHN CC(C)(C(=O)NCc1ccccc1CN1CCC(O)CC1)c1cccc(Cl)c1F ZINC000476683736 891634972 /nfs/dbraw/zinc/63/49/72/891634972.db2.gz ASNFZCOAAZEEQH-UHFFFAOYSA-N 0 3 418.940 4.030 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N(CCCO)[C@H]2CCCc3ccccc32)C1 ZINC000476830696 891812151 /nfs/dbraw/zinc/81/21/51/891812151.db2.gz PKBWEQPQJPTQDF-PBXXJUDPSA-N 0 3 421.585 4.294 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCc1nc2cccc(Cl)c2n1C)c1ccsc1 ZINC000476849489 891821538 /nfs/dbraw/zinc/82/15/38/891821538.db2.gz DCJGHNIRGGNYJS-KRWDZBQOSA-N 0 3 419.982 4.171 20 0 HIADHN O=C(Cc1nc(-c2ccc(F)cc2)cs1)NC[C@H]1CCCN1Cc1ccccc1 ZINC000477028944 891955078 /nfs/dbraw/zinc/95/50/78/891955078.db2.gz ZXFQUQDOOZRRJY-HXUWFJFHSA-N 0 3 409.530 4.273 20 0 HIADHN CN(C)C[C@H](NC(=O)Nc1cccc(-c2noc(C3CC3)n2)c1)c1ccc(F)cc1 ZINC000477046196 891975005 /nfs/dbraw/zinc/97/50/05/891975005.db2.gz JMFWWBAIXMYNRB-IBGZPJMESA-N 0 3 409.465 4.178 20 0 HIADHN COc1ccc(OC)c([C@@H]2CCCN2C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000504883841 913614974 /nfs/dbraw/zinc/61/49/74/913614974.db2.gz WUVLWTUQAMPIKN-OFNKIYASSA-N 0 3 423.557 4.215 20 0 HIADHN COc1ccc(Cl)cc1CN(C)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000504887076 913617199 /nfs/dbraw/zinc/61/71/99/913617199.db2.gz AAHXDXJYOVNOHN-HXUWFJFHSA-N 0 3 401.938 4.155 20 0 HIADHN COc1ccc(NC(=O)[C@@H](NCCCn2cnc3ccccc32)c2ccccc2)cc1 ZINC000477100839 892034774 /nfs/dbraw/zinc/03/47/74/892034774.db2.gz OYXRGUUIUKBCPX-DEOSSOPVSA-N 0 3 414.509 4.405 20 0 HIADHN COCCN1CCC[C@H]1CNC(=O)N(Cc1ccccc1)[C@@H](C)c1cccs1 ZINC000477106113 892037453 /nfs/dbraw/zinc/03/74/53/892037453.db2.gz HRCYUMCUOPCKAE-ICSRJNTNSA-N 0 3 401.576 4.132 20 0 HIADHN COCCN1CCC[C@@H]1CNC(=O)Nc1ccc(OCc2ccccc2Cl)cc1 ZINC000477113145 892043351 /nfs/dbraw/zinc/04/33/51/892043351.db2.gz WFLZZJIRPBKSEE-LJQANCHMSA-N 0 3 417.937 4.151 20 0 HIADHN COc1ccc(OC(F)F)c(NC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000504896294 913627432 /nfs/dbraw/zinc/62/74/32/913627432.db2.gz SPZLCDMOALNNNI-INIZCTEOSA-N 0 3 405.445 4.083 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)c2ccc(Br)c(Cl)c2)CC1 ZINC000477237351 892179697 /nfs/dbraw/zinc/17/96/97/892179697.db2.gz BPHGMFNTYOFWJJ-UHFFFAOYSA-N 0 3 411.727 4.432 20 0 HIADHN C[C@@H](CNC(=O)N(Cc1cccc(F)c1)C[C@@H]1CCCO1)N(C)Cc1ccccc1 ZINC000477339547 892306938 /nfs/dbraw/zinc/30/69/38/892306938.db2.gz HHZDNXWNSFBRNR-CVDCTZTESA-N 0 3 413.537 4.037 20 0 HIADHN CC[C@@H](C)n1nc(C(=O)NC2CCN(CCOc3ccc(Cl)cc3)CC2)cc1C ZINC000477448218 892399670 /nfs/dbraw/zinc/39/96/70/892399670.db2.gz WQDUMCDFNLOBBI-MRXNPFEDSA-N 0 3 418.969 4.089 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)CCN1CCC[C@@H]1c1ccc2c(c1)OCO2 ZINC000477464682 892435734 /nfs/dbraw/zinc/43/57/34/892435734.db2.gz NLOPTKXWLWIEDZ-QGZVFWFLSA-N 0 3 402.878 4.243 20 0 HIADHN CC(C)(C)[C@@H](CN1CCc2ccccc2C1)NC(=O)c1ccncc1Br ZINC000477466400 892439142 /nfs/dbraw/zinc/43/91/42/892439142.db2.gz GQECGBYRFQMCOP-LJQANCHMSA-N 0 3 416.363 4.047 20 0 HIADHN O=C(Nc1cccc(OC[C@@H]2CCCO2)c1)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000504925915 913663441 /nfs/dbraw/zinc/66/34/41/913663441.db2.gz SQLNTOZQEVBDMG-GMAHTHKFSA-N 0 3 409.530 4.031 20 0 HIADHN CN(Cc1ccc(Br)cc1)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000504927298 913665395 /nfs/dbraw/zinc/66/53/95/913665395.db2.gz YTCZBIQOXVZBOR-FQEVSTJZSA-N 0 3 416.363 4.255 20 0 HIADHN CN(C)Cc1ccc(S(=O)(=O)N[C@@H]2CCOc3c(-c4ccccc4)cccc32)cc1 ZINC000477512050 892526331 /nfs/dbraw/zinc/52/63/31/892526331.db2.gz BUTXJQNNMTZXOK-HSZRJFAPSA-N 0 3 422.550 4.217 20 0 HIADHN CC(C)[C@@H](C)NC(=O)CNC1(c2ccc(OCc3ccccc3)cc2)CCOCC1 ZINC000477628908 892745718 /nfs/dbraw/zinc/74/57/18/892745718.db2.gz ADAUTXIVJKDJDV-HXUWFJFHSA-N 0 3 410.558 4.022 20 0 HIADHN Cc1ccc2[nH]cc(CCC(=O)Nc3cccc(CN4CCC(CO)CC4)c3)c2c1 ZINC000477727715 892828750 /nfs/dbraw/zinc/82/87/50/892828750.db2.gz UCBWEIVYXZZZBF-UHFFFAOYSA-N 0 3 405.542 4.252 20 0 HIADHN CCc1ccc([C@H](C)NC(=O)[C@H](C)N2CC[C@H](CN(CC)CC(F)(F)F)C2)cc1 ZINC000477729573 892830424 /nfs/dbraw/zinc/83/04/24/892830424.db2.gz YZWPKOZOEMGZRB-JENIJYKNSA-N 0 3 413.528 4.021 20 0 HIADHN CC(C)CN(C)c1ccc(C(=O)Nc2cccc(CN3CCC(CO)CC3)c2)cc1 ZINC000477731702 892831307 /nfs/dbraw/zinc/83/13/07/892831307.db2.gz NJJDCBNNTFFCAQ-UHFFFAOYSA-N 0 3 409.574 4.235 20 0 HIADHN C[C@H](NC(=O)NCC1(N2CCSCC2)CCCC1)c1cccc(C(F)(F)F)c1 ZINC000504965522 913703209 /nfs/dbraw/zinc/70/32/09/913703209.db2.gz NQHFAOCJZRLRPY-HNNXBMFYSA-N 0 3 415.525 4.427 20 0 HIADHN CN(Cc1ccccc1C(F)(F)F)C(=O)NCC1(N2CCSCC2)CCCC1 ZINC000504964985 913703321 /nfs/dbraw/zinc/70/33/21/913703321.db2.gz GFYIHCXCXPXTON-UHFFFAOYSA-N 0 3 415.525 4.208 20 0 HIADHN CCc1cccc2c(CC(=O)Nc3cccc(CN4CCC(CO)CC4)c3)c[nH]c21 ZINC000477741356 892836876 /nfs/dbraw/zinc/83/68/76/892836876.db2.gz KIXJCENSUSNNDP-UHFFFAOYSA-N 0 3 405.542 4.116 20 0 HIADHN COc1ccc(C2(C(=O)Nc3cccc(CN4CCC(CO)CC4)c3)CCCC2)cc1 ZINC000477742670 892837874 /nfs/dbraw/zinc/83/78/74/892837874.db2.gz MOKRIEGWBCOJRR-UHFFFAOYSA-N 0 3 422.569 4.350 20 0 HIADHN CCN(C[C@H]1CCN(CC(=O)N(Cc2ccccc2)C(C)(C)C)C1)CC(F)(F)F ZINC000477759220 892849255 /nfs/dbraw/zinc/84/92/55/892849255.db2.gz FIFUKWMMBLYKAW-LJQANCHMSA-N 0 3 413.528 4.020 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)NCCc1ccc(Br)s1)c1ccco1 ZINC000477844411 892902221 /nfs/dbraw/zinc/90/22/21/892902221.db2.gz MLBSRHBZAJIKQR-OCCSQVGLSA-N 0 3 414.369 4.075 20 0 HIADHN NC(=O)C1CCN(C[C@H](NCc2ccc(C3CC3)cc2)c2ccc(Cl)cc2)CC1 ZINC000477858056 892918963 /nfs/dbraw/zinc/91/89/63/892918963.db2.gz KHHZAMKJIVXSOW-QHCPKHFHSA-N 0 3 411.977 4.246 20 0 HIADHN CCCCCn1cc(CNC(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)c(C)n1 ZINC000504973725 913715341 /nfs/dbraw/zinc/71/53/41/913715341.db2.gz VLTBVQGSAQMLAX-HSZRJFAPSA-N 0 3 411.594 4.188 20 0 HIADHN C[C@@H]1C[C@@H]1c1ccc(CN(C(=O)NCC2(N3CCSCC3)CCCC2)C2CC2)o1 ZINC000504977456 913719344 /nfs/dbraw/zinc/71/93/44/913719344.db2.gz QYAQLIUBDCVYNZ-XLIONFOSSA-N 0 3 417.619 4.439 20 0 HIADHN CC(C)c1ccccc1NC(=O)C[C@H](C)N[C@@H]1CCN(Cc2ccc(F)cc2)C1=O ZINC000477927280 893016236 /nfs/dbraw/zinc/01/62/36/893016236.db2.gz MXPWXDQIBMIKTK-HTAPYJJXSA-N 0 3 411.521 4.057 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(OC(F)(F)F)cc1)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000477928458 893018071 /nfs/dbraw/zinc/01/80/71/893018071.db2.gz SQQUKLMMUGWNMZ-UONOGXRCSA-N 0 3 416.465 4.247 20 0 HIADHN C[C@@H](NCc1ccc(S(=O)(=O)CCO)cc1)c1ccc(C2CCCCC2)cc1 ZINC000477942139 893032351 /nfs/dbraw/zinc/03/23/51/893032351.db2.gz JPUQMCRADHZIEY-GOSISDBHSA-N 0 3 401.572 4.351 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1ccn(-c2ccccc2Cl)n1)c1ccco1 ZINC000478020640 893138869 /nfs/dbraw/zinc/13/88/69/893138869.db2.gz OFSNUPKBQWFVRI-HOCLYGCPSA-N 0 3 401.898 4.370 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)N[C@@H]1CCC[C@@H]1c1ccccc1 ZINC000478021617 893143076 /nfs/dbraw/zinc/14/30/76/893143076.db2.gz OTOXHZKWWHJWIA-IFMALSPDSA-N 0 3 401.501 4.374 20 0 HIADHN CCCN(C(=O)[C@@H]1CC(=O)Nc2cc(F)ccc21)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000504994392 913739203 /nfs/dbraw/zinc/73/92/03/913739203.db2.gz OLGHYAJQUCOGNX-RBBKRZOGSA-N 0 3 423.532 4.155 20 0 HIADHN CC1CCN([C@@H](CNC(=O)Nc2cccc3c2ccn(C)c3=O)c2cccs2)CC1 ZINC000505007188 913751425 /nfs/dbraw/zinc/75/14/25/913751425.db2.gz ZOFISCXFCNUMBW-FQEVSTJZSA-N 0 3 424.570 4.195 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1nnn(-c2ccccc2Cl)c1C)c1ccsc1 ZINC000505026701 913769157 /nfs/dbraw/zinc/76/91/57/913769157.db2.gz JYWOLMGJDAMWMD-GOSISDBHSA-N 0 3 417.966 4.104 20 0 HIADHN CC[C@@H](C)n1ncc(C(=O)Nc2c(C)cnn2[C@@H]2CCN(Cc3ccccc3)C2)c1C ZINC000478328324 893558668 /nfs/dbraw/zinc/55/86/68/893558668.db2.gz GXYHHGJYMCYXNF-WIYYLYMNSA-N 0 3 420.561 4.367 20 0 HIADHN CN1C[C@@H](c2ccccc2)[C@H](NC(=O)CCc2ncc(-c3ccc(Cl)cc3)o2)C1 ZINC000478377314 893643639 /nfs/dbraw/zinc/64/36/39/893643639.db2.gz YRRCGFKCWMSMLX-VQTJNVASSA-N 0 3 409.917 4.142 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)N1CC2(CCOCC2)c2ccccc21 ZINC000478443849 893752292 /nfs/dbraw/zinc/75/22/92/893752292.db2.gz DMFPQOQNLKJCBL-HSZRJFAPSA-N 0 3 405.542 4.102 20 0 HIADHN COc1cnccc1N1CCN(C(=O)c2cc(C3CC3)nc3c(C)cc(C)cc23)CC1 ZINC000478482292 893805079 /nfs/dbraw/zinc/80/50/79/893805079.db2.gz BFRMEWRVXAXABC-UHFFFAOYSA-N 0 3 416.525 4.095 20 0 HIADHN COc1cccc([C@H](CNC(=O)NCC2(c3ccc(F)cc3)CC2)N2CCCC2)c1 ZINC000505079952 913808654 /nfs/dbraw/zinc/80/86/54/913808654.db2.gz MEXCVIDXBMBDLJ-QFIPXVFZSA-N 0 3 411.521 4.002 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)Cc1nc(-c2ccc(F)cc2)cs1 ZINC000478584123 893860333 /nfs/dbraw/zinc/86/03/33/893860333.db2.gz KKDIXKKWIYVELK-UZLBHIALSA-N 0 3 409.530 4.128 20 0 HIADHN CCO[C@H]1C[C@@H](N(C)C(=O)Nc2ccc(CCN3CCSCC3)cc2)C12CCC2 ZINC000478668744 893916977 /nfs/dbraw/zinc/91/69/77/893916977.db2.gz VYCPUIGEAIVYJE-RTWAWAEBSA-N 0 3 417.619 4.089 20 0 HIADHN CC1CCN([C@@H](CNC(=O)c2cccc(Nc3cnn(C)c3)c2)c2cccs2)CC1 ZINC000478790201 894064720 /nfs/dbraw/zinc/06/47/20/894064720.db2.gz VFMGVOVJDZZCBM-NRFANRHFSA-N 0 3 423.586 4.428 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@H]2CN[C@@H](C(N)=O)c2cccc(Br)c2)cc1 ZINC000478799302 894073529 /nfs/dbraw/zinc/07/35/29/894073529.db2.gz ITAGELSDGZEEQR-SXLOBPIMSA-N 0 3 417.347 4.041 20 0 HIADHN C[C@@H](NC(=O)NCc1cccc(OCC(F)(F)F)c1)[C@@H](c1ccccc1)N(C)C ZINC000478803895 894078949 /nfs/dbraw/zinc/07/89/49/894078949.db2.gz WJMDYZZYQZZBQV-BEFAXECRSA-N 0 3 409.452 4.118 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)N[C@H]2CCSc3c(F)cccc32)c1 ZINC000478925990 894205822 /nfs/dbraw/zinc/20/58/22/894205822.db2.gz LJWSXVBWOWWQSJ-FQEVSTJZSA-N 0 3 417.550 4.145 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1nnc(/C=C\c2ccco2)s1)c1ccco1 ZINC000479039725 894299962 /nfs/dbraw/zinc/29/99/62/894299962.db2.gz ASEKHQIJZNBMIH-YPSPLPASSA-N 0 3 401.492 4.145 20 0 HIADHN Cc1cc(C)c(S(N)(=O)=O)cc1[C@H](C)N[C@@H]1CCCc2cc(OC(F)F)ccc21 ZINC000479059544 894318316 /nfs/dbraw/zinc/31/83/16/894318316.db2.gz LEMBEEKUCZTFJN-IFXJQAMLSA-N 0 3 424.513 4.280 20 0 HIADHN CN(C)C(=O)Nc1ccc(CNCc2c[nH]nc2-c2ccc(C(F)(F)F)cc2)cc1 ZINC000479060452 894320754 /nfs/dbraw/zinc/32/07/54/894320754.db2.gz VRYNBEVMBULAPA-UHFFFAOYSA-N 0 3 417.435 4.479 20 0 HIADHN C[C@@H](NCC1(c2cccc(F)c2)CC1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479063129 894323395 /nfs/dbraw/zinc/32/33/95/894323395.db2.gz BWSIMLVNCDONMV-LLVKDONJSA-N 0 3 417.333 4.162 20 0 HIADHN Cc1ccccc1C[C@@H](C)N[C@@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479064328 894326586 /nfs/dbraw/zinc/32/65/86/894326586.db2.gz QHOPHQDHSIXXBP-OLZOCXBDSA-N 0 3 401.359 4.231 20 0 HIADHN CC1CCN([C@H](CNC(=O)[C@H](CO)c2ccc(Cl)cc2)c2cccs2)CC1 ZINC000505170050 913858588 /nfs/dbraw/zinc/85/85/88/913858588.db2.gz ZCYOJLVVCQKCDY-RTBURBONSA-N 0 3 406.979 4.067 20 0 HIADHN Cc1cc(C)c(S(N)(=O)=O)cc1[C@@H](C)N[C@H](C)c1ccc(-c2ccncc2)cc1 ZINC000479079492 894345801 /nfs/dbraw/zinc/34/58/01/894345801.db2.gz QCQIUJUTHVVSOJ-QZTJIDSGSA-N 0 3 409.555 4.425 20 0 HIADHN CNS(=O)(=O)c1cccc([C@H](C)N[C@H]2CCCc3cc(Br)ccc32)c1 ZINC000479081586 894346733 /nfs/dbraw/zinc/34/67/33/894346733.db2.gz RGFQPNLQNYYHOP-DJJJIMSYSA-N 0 3 423.376 4.085 20 0 HIADHN CC[C@H](C)n1nc(C(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)cc1C ZINC000479168930 894436717 /nfs/dbraw/zinc/43/67/17/894436717.db2.gz REQKRJFKNWZHRV-GHTZIAJQSA-N 0 3 420.561 4.367 20 0 HIADHN CC[C@@H](C)n1nc(C(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)cc1C ZINC000479168931 894437074 /nfs/dbraw/zinc/43/70/74/894437074.db2.gz REQKRJFKNWZHRV-NQIIRXRSSA-N 0 3 420.561 4.367 20 0 HIADHN CC[C@@H](C)n1nc(C(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)cc1C ZINC000479184336 894453140 /nfs/dbraw/zinc/45/31/40/894453140.db2.gz IHDHCFDDPBIHJV-YLJYHZDGSA-N 0 3 406.534 4.058 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)Nc1ccc(O[C@@H]2CCCC[C@@H]2O)cc1 ZINC000505204698 913881986 /nfs/dbraw/zinc/88/19/86/913881986.db2.gz PFIRQSBXAMONHS-RBBKRZOGSA-N 0 3 408.498 4.429 20 0 HIADHN C[C@@H]1CN(c2ccc(CN[C@@H]3CCCc4cc(Br)ccc43)cn2)CCO1 ZINC000479329951 894621050 /nfs/dbraw/zinc/62/10/50/894621050.db2.gz HZXUVMQBUAUZKU-FOIQADDNSA-N 0 3 416.363 4.236 20 0 HIADHN CCOC(=O)C(C)(C)C1CCN(C(=O)NC[C@@H](c2ccsc2)N(CC)CC)CC1 ZINC000479372932 894673188 /nfs/dbraw/zinc/67/31/88/894673188.db2.gz ADJMYPWHFLHBDW-IBGZPJMESA-N 0 3 423.623 4.142 20 0 HIADHN C[C@H](N[C@@H]1CCOC2(CCCCC2)C1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479385885 894687398 /nfs/dbraw/zinc/68/73/98/894687398.db2.gz FZWYHPRYZUNHDZ-QWHCGFSZSA-N 0 3 421.390 4.173 20 0 HIADHN COc1ccc(-c2ccc(CN[C@H](C)c3cc(S(N)(=O)=O)c(C)cc3C)cc2)cc1 ZINC000479391740 894693526 /nfs/dbraw/zinc/69/35/26/894693526.db2.gz KULCVPAIHSTJOW-GOSISDBHSA-N 0 3 424.566 4.477 20 0 HIADHN CO[C@H](c1ccc(Cl)cc1)[C@H](C)N[C@@H](C)c1cc(S(N)(=O)=O)c(C)cc1C ZINC000479405177 894710992 /nfs/dbraw/zinc/71/09/92/894710992.db2.gz FPOOSFAKONBGHB-AVYPCKFXSA-N 0 3 410.967 4.031 20 0 HIADHN CCC(CC)[C@@H]1C[C@H](N[C@H](C)c2cc(S(N)(=O)=O)c(Cl)cc2Cl)CCO1 ZINC000479434359 894749201 /nfs/dbraw/zinc/74/92/01/894749201.db2.gz DJHDLGXWINDNCA-NDGTYSDOSA-N 0 3 423.406 4.275 20 0 HIADHN O=C1c2ccccc2CCN1CCN[C@H](c1ccc(Br)cc1F)C1CC1 ZINC000479439474 894755104 /nfs/dbraw/zinc/75/51/04/894755104.db2.gz QMAPXEKXKBLBTC-FQEVSTJZSA-N 0 3 417.322 4.327 20 0 HIADHN CCS(=O)(=O)c1c(Cl)cccc1CN[C@@H]1CCN(Cc2ccccc2)[C@H](C)C1 ZINC000479452101 894771933 /nfs/dbraw/zinc/77/19/33/894771933.db2.gz IGLNNIYDESFBFJ-YLJYHZDGSA-N 0 3 421.006 4.276 20 0 HIADHN C[C@@H](NCC1(S(C)(=O)=O)CC1)c1ccc(-c2ccccc2Br)s1 ZINC000479473710 894796180 /nfs/dbraw/zinc/79/61/80/894796180.db2.gz XHCLTIUMGXPGGK-GFCCVEGCSA-N 0 3 414.390 4.405 20 0 HIADHN COc1ccc(NC(=O)[C@@H](N[C@@H]2CCc3cnn(C(C)C)c3C2)c2ccccc2)cc1 ZINC000479490153 894810603 /nfs/dbraw/zinc/81/06/03/894810603.db2.gz SAHACDKKQNNHHJ-QPPBQGQZSA-N 0 3 418.541 4.300 20 0 HIADHN Cc1ccc([C@H](NC2CC(N3CCCCC3)C2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000479522202 894831702 /nfs/dbraw/zinc/83/17/02/894831702.db2.gz AVQJIGWZWRTLCP-IWAAJCSBSA-N 0 3 412.599 4.094 20 0 HIADHN Cc1nc(COc2ccc(CN[C@H](Cc3ccccn3)c3ccccc3)cc2)no1 ZINC000479614851 894885208 /nfs/dbraw/zinc/88/52/08/894885208.db2.gz LXKLKUWJECIEHY-HSZRJFAPSA-N 0 3 400.482 4.426 20 0 HIADHN Cc1cccc2nc(CN(Cc3ccc4c(c3)OCO4)C3CCC(C)CC3)cc(=O)n12 ZINC000479637358 894904258 /nfs/dbraw/zinc/90/42/58/894904258.db2.gz ICZQFUYHSOHMOZ-UHFFFAOYSA-N 0 3 419.525 4.313 20 0 HIADHN CCOc1cc(Cl)ccc1CNC(=O)N(CCN(C)C)Cc1cccc(OC)c1 ZINC000479729483 895027420 /nfs/dbraw/zinc/02/74/20/895027420.db2.gz LLTDWZGQEDFFLG-UHFFFAOYSA-N 0 3 419.953 4.021 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)N1C[C@H](c2ccccc2)[C@H]2COCC[C@@H]21 ZINC000479742906 895041370 /nfs/dbraw/zinc/04/13/70/895041370.db2.gz FKCMFSQQCOOTBN-VPBXCIAMSA-N 0 3 419.569 4.038 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)NCc2ccc(C(F)(F)F)cc2C)c1 ZINC000479747577 895046406 /nfs/dbraw/zinc/04/64/06/895046406.db2.gz BGIBIBNNYKGXQR-UHFFFAOYSA-N 0 3 423.479 4.296 20 0 HIADHN C[C@H](NC[C@H](c1cccs1)N1CCOCC1)c1cc(Br)ccc1F ZINC000479851203 895183952 /nfs/dbraw/zinc/18/39/52/895183952.db2.gz KMTKOENVLKDITN-SUMWQHHRSA-N 0 3 413.356 4.374 20 0 HIADHN C[C@@H](NCc1ccc(Cl)cc1)c1ccc(S(=O)(=O)NCc2ccco2)cc1 ZINC000479859587 895196274 /nfs/dbraw/zinc/19/62/74/895196274.db2.gz JORVJXKQVMBQTB-OAHLLOKOSA-N 0 3 404.919 4.262 20 0 HIADHN C[C@H](NC[C@@H](c1ccco1)N1CCCC1)c1ccc(S(=O)(=O)C2CCCC2)cc1 ZINC000479864985 895203156 /nfs/dbraw/zinc/20/31/56/895203156.db2.gz XSEQNKPXWYMPRR-AVRDEDQJSA-N 0 3 416.587 4.484 20 0 HIADHN C[C@@H](NC[C@H](c1cccs1)N1CCC(C)CC1)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000479872839 895215023 /nfs/dbraw/zinc/21/50/23/895215023.db2.gz KYVDBVIPUIBLMA-VQIMIIECSA-N 0 3 424.607 4.415 20 0 HIADHN COc1ccccc1[C@H](CN[C@@H](C)c1nnn(-c2ccc(F)cc2)c1C)N1CCCC1 ZINC000479875486 895216979 /nfs/dbraw/zinc/21/69/79/895216979.db2.gz QSZDSZCCCYNMCA-JTSKRJEESA-N 0 3 423.536 4.211 20 0 HIADHN CC[C@H](NC[C@H](c1ccc(OC)c(OC)c1)N1CCOCC1)c1cc(F)ccc1F ZINC000479888720 895235360 /nfs/dbraw/zinc/23/53/60/895235360.db2.gz PJOUDUVBGAWCFC-LEWJYISDSA-N 0 3 420.500 4.096 20 0 HIADHN CCS(=O)(=O)N1CCC(NCc2c(Cl)cccc2Oc2ccccc2)CC1 ZINC000479929182 895277536 /nfs/dbraw/zinc/27/75/36/895277536.db2.gz ULILQDHETDSQDV-UHFFFAOYSA-N 0 3 408.951 4.036 20 0 HIADHN CC[C@H](C)n1ncc(C(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)c1C ZINC000479943504 895295726 /nfs/dbraw/zinc/29/57/26/895295726.db2.gz UAOABPJZMYFKNA-HNNXBMFYSA-N 0 3 410.484 4.385 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)c1cccc(OC2CCCCC2)c1 ZINC000479960851 895313695 /nfs/dbraw/zinc/31/36/95/895313695.db2.gz HLJRYHAACMZUAM-UHFFFAOYSA-N 0 3 422.569 4.285 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3Cc4ccccc4C4(CC4)C3)c(C)c2)CC1 ZINC000479968327 895321512 /nfs/dbraw/zinc/32/15/12/895321512.db2.gz RNJSOIMTPDZOMN-UHFFFAOYSA-N 0 3 404.558 4.216 20 0 HIADHN CC[C@@H](c1ccccc1)[C@@H]1CCCN1Cc1nnc2n1c1ccc(C)cc1c(=O)n2C ZINC000480018196 895368440 /nfs/dbraw/zinc/36/84/40/895368440.db2.gz KXMWEKAGSDXWPI-FPOVZHCZSA-N 0 3 415.541 4.048 20 0 HIADHN CC(C)(CC(=O)NC1CCN(CCOc2ccc(Cl)cc2)CC1)C(F)(F)F ZINC000480082783 895440824 /nfs/dbraw/zinc/44/08/24/895440824.db2.gz RFBRKLAFFVFYAS-UHFFFAOYSA-N 0 3 406.876 4.278 20 0 HIADHN C[C@H](NC[C@H](c1cccs1)N(C)C)c1ccccc1I ZINC000480099361 895465773 /nfs/dbraw/zinc/46/57/73/895465773.db2.gz ZCNXRTNKIPCXGB-SWLSCSKDSA-N 0 3 400.329 4.306 20 0 HIADHN Cc1cccc(C)c1CCN[C@@H]1CCS(=O)(=O)c2ccc(Br)cc21 ZINC000480186675 895582084 /nfs/dbraw/zinc/58/20/84/895582084.db2.gz WQTAPQFTIZPLJJ-GOSISDBHSA-N 0 3 408.361 4.117 20 0 HIADHN COc1ccc(CN[C@@H](C)c2ccc(OCc3nccn3C)cc2)cc1OC(F)F ZINC000480187139 895583627 /nfs/dbraw/zinc/58/36/27/895583627.db2.gz WTPYHXXUFAGQBU-HNNXBMFYSA-N 0 3 417.456 4.460 20 0 HIADHN O=S1(=O)CC[C@@H](NCC2(c3cccc(F)c3)CC2)c2cc(Br)ccc21 ZINC000480189615 895584968 /nfs/dbraw/zinc/58/49/68/895584968.db2.gz BQFVMLFWVBNVBK-QGZVFWFLSA-N 0 3 424.335 4.128 20 0 HIADHN Cc1ccccc1C1(CN[C@@H]2CCS(=O)(=O)c3ccc(Br)cc32)CC1 ZINC000480240927 895651180 /nfs/dbraw/zinc/65/11/80/895651180.db2.gz KTCGDMNMKZOLSY-GOSISDBHSA-N 0 3 420.372 4.297 20 0 HIADHN C[C@@H](NC[C@H](c1ccc(C(F)(F)F)cc1)N1CCOCC1)c1ccc(Cl)cn1 ZINC000480244654 895654114 /nfs/dbraw/zinc/65/41/14/895654114.db2.gz YFAXWWDWJQQADA-AUUYWEPGSA-N 0 3 413.871 4.478 20 0 HIADHN CCS(=O)(=O)Nc1ccc([C@@H](C)NCc2cccc(NC(=O)C3CCC3)c2)cc1 ZINC000480245800 895656843 /nfs/dbraw/zinc/65/68/43/895656843.db2.gz XOFSRBXCDLOQNX-MRXNPFEDSA-N 0 3 415.559 4.038 20 0 HIADHN Cc1ccc(CCN[C@H]2CCS(=O)(=O)c3ccc(Br)cc32)c(C)c1 ZINC000480262263 895670398 /nfs/dbraw/zinc/67/03/98/895670398.db2.gz INHBGVFVKSMEQQ-SFHVURJKSA-N 0 3 408.361 4.117 20 0 HIADHN COc1ccc([C@@H](C)NC[C@H](c2ccccc2Cl)N2CCOCC2)c(OC)c1 ZINC000480276106 895682584 /nfs/dbraw/zinc/68/25/84/895682584.db2.gz RWHFSSNMJABHPS-IIBYNOLFSA-N 0 3 404.938 4.081 20 0 HIADHN C[C@@H](NC(=O)c1oc2ccccc2c1CN(C)C)c1ccc(-n2cccn2)c(F)c1 ZINC000505328523 913993897 /nfs/dbraw/zinc/99/38/97/913993897.db2.gz HCODBYYELKQSSP-OAHLLOKOSA-N 0 3 406.461 4.310 20 0 HIADHN O=S1(=O)CC[C@@H](NC[C@H]2CCCc3ccccc32)c2cc(Br)ccc21 ZINC000480327026 895729612 /nfs/dbraw/zinc/72/96/12/895729612.db2.gz LWJPAFDXVSCGCF-DNVCBOLYSA-N 0 3 420.372 4.377 20 0 HIADHN CC(C)Cc1ccc([C@@H](CNC(=O)Nc2cccc(-c3ncn(C)n3)c2)N(C)C)cc1 ZINC000480349658 895755245 /nfs/dbraw/zinc/75/52/45/895755245.db2.gz RKIJZGIUZDPCRU-JOCHJYFZSA-N 0 3 420.561 4.105 20 0 HIADHN Cc1ccc([C@@H](CN[C@@H](C)c2cc(Br)ccc2F)N2CCOCC2)o1 ZINC000480385221 895790827 /nfs/dbraw/zinc/79/08/27/895790827.db2.gz GJAFKSOJYLIDDK-KBXCAEBGSA-N 0 3 411.315 4.214 20 0 HIADHN CC[C@H](C)[C@@H](NCc1ccc(N(C)CC)nc1)C(=O)Nc1cccc(N2CCCC2)c1 ZINC000480386175 895792308 /nfs/dbraw/zinc/79/23/08/895792308.db2.gz KYFAMXIDVAKEHQ-YADARESESA-N 0 3 423.605 4.281 20 0 HIADHN CN(CCNC(=O)c1ccc(NC(=O)Nc2ccccc2)s1)Cc1ccccc1 ZINC000480510306 895878519 /nfs/dbraw/zinc/87/85/19/895878519.db2.gz KIQZBGMQMBKILR-UHFFFAOYSA-N 0 3 408.527 4.254 20 0 HIADHN COc1cc(CN[C@H](C)c2cccc(N3CCOCC3)c2)ccc1OCC(F)(F)F ZINC000480543259 895905973 /nfs/dbraw/zinc/90/59/73/895905973.db2.gz VJNSBZVFWVVPLF-MRXNPFEDSA-N 0 3 424.463 4.324 20 0 HIADHN CN1CC[C@H](NC(=O)[C@@H]2C[C@H]2c2ccc(OC(F)(F)F)cc2)[C@@H]1c1ccccc1 ZINC000480578084 895939147 /nfs/dbraw/zinc/93/91/47/895939147.db2.gz MWLJRRTZLAWZKL-YRPNKDGESA-N 0 3 404.432 4.250 20 0 HIADHN C[C@@H]1CN(c2ccc(CN[C@H]3CCc4cc(Br)ccc43)cn2)C[C@H](C)O1 ZINC000480609597 895975029 /nfs/dbraw/zinc/97/50/29/895975029.db2.gz HUHPAWFEPSIWFO-MDOVXXIYSA-N 0 3 416.363 4.235 20 0 HIADHN CC(C)n1cc([C@@H](C)NC[C@@H](c2c(F)cccc2Cl)N2CCO[C@H](C)C2)cn1 ZINC000480611012 895977349 /nfs/dbraw/zinc/97/73/49/895977349.db2.gz KAXISKPJJWQCNE-QINHECLXSA-N 0 3 408.949 4.369 20 0 HIADHN CC(C)n1cc([C@H](C)NC[C@@H](c2c(F)cccc2Cl)N2CCO[C@H](C)C2)cn1 ZINC000480611004 895977524 /nfs/dbraw/zinc/97/75/24/895977524.db2.gz KAXISKPJJWQCNE-GUXCAODWSA-N 0 3 408.949 4.369 20 0 HIADHN CN1CCN(C(=O)c2ccc(CN[C@H]3CCSc4ccc(Cl)cc43)cc2)CC1 ZINC000480619020 895986202 /nfs/dbraw/zinc/98/62/02/895986202.db2.gz XAKMHRAMHOSCPZ-FQEVSTJZSA-N 0 3 415.990 4.054 20 0 HIADHN C[C@@H](NCc1ccnc(OCC(F)(F)F)c1)c1ccc(OCc2nccn2C)cc1 ZINC000480631333 896000561 /nfs/dbraw/zinc/00/05/61/896000561.db2.gz OADLKHJNSWMEPF-OAHLLOKOSA-N 0 3 420.435 4.186 20 0 HIADHN Cc1cc([C@@H](NCc2ccc(N3CCCS3(=O)=O)c(F)c2)C2CC2)ccc1F ZINC000480683856 896045998 /nfs/dbraw/zinc/04/59/98/896045998.db2.gz SDRJNRXYUDGFSS-NRFANRHFSA-N 0 3 406.498 4.054 20 0 HIADHN COCCOc1ccc([C@@H](C)NCc2ccc(N3CCCCCC3)nc2)cc1OC ZINC000480697058 896058936 /nfs/dbraw/zinc/05/89/36/896058936.db2.gz KJAVAMVKAZOBSY-LJQANCHMSA-N 0 3 413.562 4.347 20 0 HIADHN COCCOc1ccc([C@@H](C)N[C@@H](C)c2cccc(N3CCCC3=O)c2)cc1OC ZINC000480713557 896074683 /nfs/dbraw/zinc/07/46/83/896074683.db2.gz XQXVFXVDFVKFOX-ZWKOTPCHSA-N 0 3 412.530 4.259 20 0 HIADHN C[C@H](NCc1ccnc(N2CCN(C)CC2)c1)c1cccc(OCc2ccccc2)c1 ZINC000480723472 896085036 /nfs/dbraw/zinc/08/50/36/896085036.db2.gz ZHCWCSSTQCBZSE-NRFANRHFSA-N 0 3 416.569 4.263 20 0 HIADHN COc1cc([C@H](C)N[C@@H](C)c2ccc(-n3cnnn3)cc2)ccc1OC1CCCC1 ZINC000480731708 896091512 /nfs/dbraw/zinc/09/15/12/896091512.db2.gz CQNYTISMZPMSKO-IRXDYDNUSA-N 0 3 407.518 4.404 20 0 HIADHN COc1cc([C@@H](C)N[C@@H](C)c2ccc(-n3cnnn3)cc2)ccc1OC1CCCC1 ZINC000480731699 896091721 /nfs/dbraw/zinc/09/17/21/896091721.db2.gz CQNYTISMZPMSKO-DLBZAZTESA-N 0 3 407.518 4.404 20 0 HIADHN CCN(C)C(=O)CN[C@@H]1CCCc2nc(-c3ccc(Br)cc3)sc21 ZINC000480741152 896102883 /nfs/dbraw/zinc/10/28/83/896102883.db2.gz MVVWYASSBGMZTM-CQSZACIVSA-N 0 3 408.365 4.018 20 0 HIADHN CC[C@@H](C)N(Cc1nc2ccccc2c(=O)[nH]1)CC1CCN(C(=O)C(C)(C)C)CC1 ZINC000480759849 896122356 /nfs/dbraw/zinc/12/23/56/896122356.db2.gz VWUZHWBXQNHLPF-QGZVFWFLSA-N 0 3 412.578 4.221 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N2CCC[C@H]2c2ccc3c(c2)OCO3)N2CCCC2)cc1 ZINC000480797265 896164753 /nfs/dbraw/zinc/16/47/53/896164753.db2.gz ZVQQTNOPKIYJSL-VXKWHMMOSA-N 0 3 421.541 4.407 20 0 HIADHN O=S(=O)(CCCN[C@@H]1CCc2ccc(OC(F)(F)F)cc21)Cc1ccccc1 ZINC000480899819 896254923 /nfs/dbraw/zinc/25/49/23/896254923.db2.gz PNYKEHCEQBNJJY-LJQANCHMSA-N 0 3 413.461 4.167 20 0 HIADHN CC[C@@H](NCc1cccc(NC(=O)c2ccncc2)c1)c1ccc2c(c1)OCCO2 ZINC000480902107 896258232 /nfs/dbraw/zinc/25/82/32/896258232.db2.gz AXIABNVFTUZEHP-OAQYLSRUSA-N 0 3 403.482 4.346 20 0 HIADHN C[C@@H](NCCc1ccc(OCC(=O)NC2CC2)cc1)c1nc(-c2ccccc2)cs1 ZINC000480910380 896265448 /nfs/dbraw/zinc/26/54/48/896265448.db2.gz KCAZLLUADITRJI-QGZVFWFLSA-N 0 3 421.566 4.361 20 0 HIADHN C[C@H]1C[C@@H](NCc2ccc(CS(C)(=O)=O)cc2)c2cccc(Br)c21 ZINC000480910295 896266160 /nfs/dbraw/zinc/26/61/60/896266160.db2.gz ORUSEJSHDKEVAP-SCLBCKFNSA-N 0 3 408.361 4.332 20 0 HIADHN O=C(NCCN[C@H]1CCSc2ccc(F)cc21)c1ccc(Br)cc1 ZINC000480920349 896278539 /nfs/dbraw/zinc/27/85/39/896278539.db2.gz KZAUYXCWWWPUIV-INIZCTEOSA-N 0 3 409.324 4.145 20 0 HIADHN CNS(=O)(=O)c1cccc(CN[C@H](CC(C)C)c2cccc(C(F)(F)F)c2)c1 ZINC000481030212 896358334 /nfs/dbraw/zinc/35/83/34/896358334.db2.gz AQKDMJGEIUEQNE-LJQANCHMSA-N 0 3 414.493 4.491 20 0 HIADHN COc1ccc2ccccc2c1-c1cc(CN2CCC[C@@H](C(=O)N3CCCC3)C2)on1 ZINC000481052890 896376397 /nfs/dbraw/zinc/37/63/97/896376397.db2.gz IRMQLMNYEAQBBB-LJQANCHMSA-N 0 3 419.525 4.338 20 0 HIADHN C[C@@H](NC[C@@H](c1ccccc1)N1CCC(C)CC1)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000481053135 896376599 /nfs/dbraw/zinc/37/65/99/896376599.db2.gz ZPDTZRSSUBGROM-GCJKJVERSA-N 0 3 418.578 4.353 20 0 HIADHN CCO[C@@H]1C[C@H](O)C12CCN(Cc1cc(-c3c(OC)ccc4ccccc43)no1)CC2 ZINC000481094432 896416986 /nfs/dbraw/zinc/41/69/86/896416986.db2.gz QMFVYEXNZJHFBF-XZOQPEGZSA-N 0 3 422.525 4.255 20 0 HIADHN CCO[C@H]1C[C@H](O)C12CCN(Cc1cc(-c3c(OC)ccc4ccccc43)no1)CC2 ZINC000481094429 896417799 /nfs/dbraw/zinc/41/77/99/896417799.db2.gz QMFVYEXNZJHFBF-GOTSBHOMSA-N 0 3 422.525 4.255 20 0 HIADHN CCOc1ccc([C@H](C)NC(=O)N[C@@H]2CCN(Cc3ccccc3)[C@@H]2C)cc1OC ZINC000481117493 896442702 /nfs/dbraw/zinc/44/27/02/896442702.db2.gz XVJKGNMYGXABGX-WAOWUJCRSA-N 0 3 411.546 4.117 20 0 HIADHN COc1ccc([C@H](C)NC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)c(C)c1OC ZINC000481124458 896451157 /nfs/dbraw/zinc/45/11/57/896451157.db2.gz ZGTKCSXHRRJOBZ-ICSRJNTNSA-N 0 3 411.546 4.037 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Cc1csc2nccn12)c1ccc(C(F)(F)F)cc1 ZINC000481145081 896471880 /nfs/dbraw/zinc/47/18/80/896471880.db2.gz PTLXKVQFNHERJM-KRWDZBQOSA-N 0 3 424.492 4.156 20 0 HIADHN COc1cc2nc(CN[C@H]3CCCC[C@@H]3Cc3ccccc3)[nH]c(=O)c2cc1OC ZINC000481168977 896501593 /nfs/dbraw/zinc/50/15/93/896501593.db2.gz FGYVIULLEVCYRV-MJGOQNOKSA-N 0 3 407.514 4.244 20 0 HIADHN COc1cc([C@H](C)N[C@H](C)c2sc(-c3cccnc3)nc2C)ccc1OCCO ZINC000481175053 896508526 /nfs/dbraw/zinc/50/85/26/896508526.db2.gz JYIKFPDBQYUVAZ-LSDHHAIUSA-N 0 3 413.543 4.305 20 0 HIADHN COc1cc([C@H](C)N[C@H]2CCc3ccc(OC(F)(F)F)cc32)ccc1OCCO ZINC000481180774 896520351 /nfs/dbraw/zinc/52/03/51/896520351.db2.gz MFNNQJUZAMZAQX-UGSOOPFHSA-N 0 3 411.420 4.303 20 0 HIADHN CNS(=O)(=O)c1ccc([C@@H](C)N[C@H](C)c2ccc(SCC(F)F)cc2)cc1 ZINC000481182918 896527644 /nfs/dbraw/zinc/52/76/44/896527644.db2.gz QNLBYPKKDCCEPG-ZIAGYGMSSA-N 0 3 414.543 4.364 20 0 HIADHN COc1cc([C@H](C)N[C@H](C)c2ccc(NC(=O)NC(C)C)cc2)ccc1OCCO ZINC000481185424 896530622 /nfs/dbraw/zinc/53/06/22/896530622.db2.gz GRCNEZHDMHXETB-SJORKVTESA-N 0 3 415.534 4.008 20 0 HIADHN Cc1ccc2c(c1)[C@@H](NCc1cccc(S(=O)(=O)NCc3cccc(F)c3)c1)CC2 ZINC000481185892 896533557 /nfs/dbraw/zinc/53/35/57/896533557.db2.gz VGLZQGNTIHBHMN-DEOSSOPVSA-N 0 3 424.541 4.390 20 0 HIADHN Cc1nn(-c2ccccc2C)c2sc(C(=O)N3CCC[C@@H]3CN3CCCC3)cc12 ZINC000481220042 896571526 /nfs/dbraw/zinc/57/15/26/896571526.db2.gz UBUVXENOPRGEGJ-GOSISDBHSA-N 0 3 408.571 4.404 20 0 HIADHN Cc1nc(-c2ccccc2)ncc1C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000481219751 896571898 /nfs/dbraw/zinc/57/18/98/896571898.db2.gz SCUCPCDDAGZLSE-UHFFFAOYSA-N 0 3 418.566 4.296 20 0 HIADHN CC[C@H](NCc1cccnc1N1CCN(C)CC1)c1ccc2cc(OC)ccc2c1 ZINC000481224697 896576116 /nfs/dbraw/zinc/57/61/16/896576116.db2.gz WLFODJVMWBAZTF-DEOSSOPVSA-N 0 3 404.558 4.236 20 0 HIADHN O=S(=O)(CCCN[C@@H]1CCc2c1cc(Br)cc2F)c1ccccc1 ZINC000481243172 896593608 /nfs/dbraw/zinc/59/36/08/896593608.db2.gz SINYQDNKDVQFPE-GOSISDBHSA-N 0 3 412.324 4.029 20 0 HIADHN Cc1nc(-c2cccnc2)sc1[C@H](C)NCCCS(=O)(=O)c1ccccc1 ZINC000481242290 896593976 /nfs/dbraw/zinc/59/39/76/896593976.db2.gz NLVLLGNHLJVMNL-HNNXBMFYSA-N 0 3 401.557 4.028 20 0 HIADHN O=S(=O)(CCCN[C@H]1CCCOc2cc(Br)ccc21)c1ccccc1 ZINC000481246065 896597040 /nfs/dbraw/zinc/59/70/40/896597040.db2.gz KQQZCYOUBSUWRW-SFHVURJKSA-N 0 3 424.360 4.116 20 0 HIADHN COc1ccc(Oc2cc(CN[C@@H](C)c3ccc(-n4cncn4)cc3)ccn2)cc1 ZINC000481298375 896641704 /nfs/dbraw/zinc/64/17/04/896641704.db2.gz HJQJJMSABHBLCO-KRWDZBQOSA-N 0 3 401.470 4.314 20 0 HIADHN C[C@@H](NCc1ccc(N2CCc3ccccc3C2)nc1)c1ccc2c(c1)OCCO2 ZINC000481309316 896656956 /nfs/dbraw/zinc/65/69/56/896656956.db2.gz OPAPDOOSNDXSDX-GOSISDBHSA-N 0 3 401.510 4.266 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N[C@H](c1ccc(OC)cc1)C(F)(F)F)c1ccco1 ZINC000481316809 896667506 /nfs/dbraw/zinc/66/75/06/896667506.db2.gz LBTVZOWFJGMOOM-QANKJYHBSA-N 0 3 413.440 4.320 20 0 HIADHN CC[C@H](N[C@@H](C)c1ccc(-n2cccn2)cc1)c1ccccc1OCC(=O)N(C)C ZINC000481318326 896670022 /nfs/dbraw/zinc/67/00/22/896670022.db2.gz KDUPAXBXYIICFX-AVRDEDQJSA-N 0 3 406.530 4.141 20 0 HIADHN C[C@H]1C[C@H](NCc2cccc(OCC(=O)N(C)C)c2)c2cccc(Br)c21 ZINC000481317686 896670329 /nfs/dbraw/zinc/67/03/29/896670329.db2.gz QMBCPHOYSIUITJ-LIRRHRJNSA-N 0 3 417.347 4.254 20 0 HIADHN Cc1nc(NC(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)ccc1Br ZINC000481364422 896748089 /nfs/dbraw/zinc/74/80/89/896748089.db2.gz BXUBTCNECBPQPO-HNNXBMFYSA-N 0 3 417.351 4.281 20 0 HIADHN Clc1ccc2c(c1Cl)CC[C@H]2NCc1cccc(OCCN2CCOCC2)c1 ZINC000481418572 896821552 /nfs/dbraw/zinc/82/15/52/896821552.db2.gz MBVNGXQOHDYZQA-OAQYLSRUSA-N 0 3 421.368 4.482 20 0 HIADHN COc1cccc([C@@H](CNC(=O)Nc2ccnn2[C@@H](C)CC(C)C)N2CCCC2)c1 ZINC000481479969 896864144 /nfs/dbraw/zinc/86/41/44/896864144.db2.gz KWBRIJRJXMXHBY-GHTZIAJQSA-N 0 3 413.566 4.457 20 0 HIADHN COc1cccc([C@H](CNC(=O)Nc2ccnn2[C@@H](C)CC(C)C)N2CCCC2)c1 ZINC000481479971 896865158 /nfs/dbraw/zinc/86/51/58/896865158.db2.gz KWBRIJRJXMXHBY-RXVVDRJESA-N 0 3 413.566 4.457 20 0 HIADHN CC(C)C[C@@H](C)n1nccc1NC(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000481489523 896870307 /nfs/dbraw/zinc/87/03/07/896870307.db2.gz HTYNDKJGDCRNPE-AQNXPRMDSA-N 0 3 419.614 4.233 20 0 HIADHN COc1cc(C(C)=O)ccc1OC[C@H](O)CN1CCC[C@@H](c2ccc(F)cc2)CC1 ZINC000481496814 896872120 /nfs/dbraw/zinc/87/21/20/896872120.db2.gz PVYLOUWQZJAQSD-XMSQKQJNSA-N 0 3 415.505 4.046 20 0 HIADHN CC1CCN([C@@H](CNC(=O)c2ccc(-c3cncnc3)cc2F)c2ccccc2)CC1 ZINC000481512920 896880825 /nfs/dbraw/zinc/88/08/25/896880825.db2.gz XPGZPWVZNUCHBN-DEOSSOPVSA-N 0 3 418.516 4.486 20 0 HIADHN COc1ccc(C)cc1C1(CN[C@H](C)c2nnn(-c3ccccc3)c2C)CCOCC1 ZINC000481544845 896904961 /nfs/dbraw/zinc/90/49/61/896904961.db2.gz BVUIJQJNIRAORR-LJQANCHMSA-N 0 3 420.557 4.292 20 0 HIADHN Cc1nccn1-c1ccc(CN[C@H](C)c2ccc(NC(=O)NC3CC3)cc2)cc1F ZINC000481554376 896925721 /nfs/dbraw/zinc/92/57/21/896925721.db2.gz BAYRWFMZUWLRLS-OAHLLOKOSA-N 0 3 407.493 4.455 20 0 HIADHN CCOc1ccc(CN[C@H](C)c2ccc(S(=O)(=O)N3CCCCC3)cc2)cc1 ZINC000481561754 896937809 /nfs/dbraw/zinc/93/78/09/896937809.db2.gz YSGYOFVNCAGOBO-GOSISDBHSA-N 0 3 402.560 4.111 20 0 HIADHN COc1cccc(F)c1NC(=O)N(CCN(C)C)Cc1ccc(Br)cc1 ZINC000481635858 897020983 /nfs/dbraw/zinc/02/09/83/897020983.db2.gz UUDMKIYBZWFKDL-UHFFFAOYSA-N 0 3 424.314 4.193 20 0 HIADHN CC[C@@H](N[C@@H](c1ccc(OC)cc1)C1CC1)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000481640505 897024423 /nfs/dbraw/zinc/02/44/23/897024423.db2.gz KOWQNRJDJMZSLU-TZIWHRDSSA-N 0 3 422.978 4.449 20 0 HIADHN Cc1oc2ccc(NC(=O)N[C@@H]3CCN(Cc4ccccc4)C[C@@H]3CO)cc2c1C ZINC000481641956 897026091 /nfs/dbraw/zinc/02/60/91/897026091.db2.gz NQIFJCXFKITHDT-DENIHFKCSA-N 0 3 407.514 4.054 20 0 HIADHN C[C@H](OC[C@@H](O)CN1CCC[C@@]2(C1)OCc1ccccc12)c1ccc(Cl)cc1 ZINC000481699422 897086156 /nfs/dbraw/zinc/08/61/56/897086156.db2.gz BEERZZPKWMAPKJ-HYVJGQCMSA-N 0 3 401.934 4.300 20 0 HIADHN CC[C@H](CN(CC)[C@@H](C)C(=O)NCC(=O)Nc1c(C)cccc1C)c1ccccc1 ZINC000481734881 897129374 /nfs/dbraw/zinc/12/93/74/897129374.db2.gz LUISRQTXCQABHD-LEWJYISDSA-N 0 3 409.574 4.262 20 0 HIADHN COc1ccc([C@H](C)N[C@H](C)c2ccc(S(=O)(=O)N3CCCCC3)cc2)cc1 ZINC000481734606 897129700 /nfs/dbraw/zinc/12/97/00/897129700.db2.gz KMHKIKLQHOAAMT-ZWKOTPCHSA-N 0 3 402.560 4.282 20 0 HIADHN COc1ccc([C@H](C)N[C@@H](C)c2ccc(S(=O)(=O)NCc3ccco3)cc2)cc1 ZINC000481738583 897132968 /nfs/dbraw/zinc/13/29/68/897132968.db2.gz QVIMZPTWZGXKFE-IRXDYDNUSA-N 0 3 414.527 4.179 20 0 HIADHN CC(C)C[C@@H]1OCCC[C@H]1NCC(=O)Nc1ccc(NC(=O)c2cccs2)cc1 ZINC000481738614 897133017 /nfs/dbraw/zinc/13/30/17/897133017.db2.gz FBXDFUCFEAJFEU-MOPGFXCFSA-N 0 3 415.559 4.122 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2ccc(-c3cncnc3)cc2F)N2CCCC2)cc1 ZINC000481885697 897258529 /nfs/dbraw/zinc/25/85/29/897258529.db2.gz DHAOGYQJIVWKGE-QHCPKHFHSA-N 0 3 404.489 4.158 20 0 HIADHN COC(=O)c1ccc(-c2ccc(CN3CCC(C(=O)N4CCC[C@H](C)C4)CC3)o2)cc1 ZINC000481913893 897297425 /nfs/dbraw/zinc/29/74/25/897297425.db2.gz IFDNQENEWNYAKS-SFHVURJKSA-N 0 3 424.541 4.204 20 0 HIADHN Cc1cc(C(=O)Nc2cc(C)cc(N3CCN(C(C)C)CC3)c2)nn1[C@@H](C)C1CC1 ZINC000482013173 897412872 /nfs/dbraw/zinc/41/28/72/897412872.db2.gz FSMQFQKGKMYFSC-IBGZPJMESA-N 0 3 409.578 4.254 20 0 HIADHN CC(=O)c1cccc(O[C@@H](C)C(=O)Nc2cc(C)cc(N3CCN(C(C)C)CC3)c2)c1 ZINC000482026035 897432344 /nfs/dbraw/zinc/43/23/44/897432344.db2.gz MFRWSJQXXYHPCX-FQEVSTJZSA-N 0 3 423.557 4.134 20 0 HIADHN CCN(CC)C(=O)Nc1ccc([C@@H](C)N[C@H]2CC(=O)N(c3cccc(OC)c3)C2)cc1 ZINC000482032005 897443749 /nfs/dbraw/zinc/44/37/49/897443749.db2.gz ZMPMELJYWSDHFN-XLIONFOSSA-N 0 3 424.545 4.025 20 0 HIADHN CC1(C)CN(C(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)CC[C@@H]1C(F)(F)F ZINC000482034626 897449234 /nfs/dbraw/zinc/44/92/34/897449234.db2.gz QZDRIMGZYBZUMZ-AEFFLSMTSA-N 0 3 400.460 4.475 20 0 HIADHN CNS(=O)(=O)c1ccc([C@H](C)NCc2ccc(OC3CCCCC3)cc2)cc1 ZINC000482108682 897558400 /nfs/dbraw/zinc/55/84/00/897558400.db2.gz IBNHGGXCCBRFTF-KRWDZBQOSA-N 0 3 402.560 4.157 20 0 HIADHN COCCOc1ccc([C@H](C)NCc2ccc(NC(=O)c3cccnc3)cc2)cc1 ZINC000482111749 897562890 /nfs/dbraw/zinc/56/28/90/897562890.db2.gz RPVQKRPFHGVBMC-SFHVURJKSA-N 0 3 405.498 4.210 20 0 HIADHN Cc1c([C@H](C)NCCC(=O)N2CCc3sccc3C2)cnn1-c1ccc(F)cc1 ZINC000482115144 897566068 /nfs/dbraw/zinc/56/60/68/897566068.db2.gz QAHBUWPQIQBONW-HNNXBMFYSA-N 0 3 412.534 4.007 20 0 HIADHN C[C@H](CNC(=O)Cc1c[nH]c2cc(Br)ccc12)N(C)Cc1ccccc1 ZINC000482168727 897634943 /nfs/dbraw/zinc/63/49/43/897634943.db2.gz ZTVOIRQBAUMODS-OAHLLOKOSA-N 0 3 414.347 4.110 20 0 HIADHN COC(=O)c1ccc(-c2ccc(CN[C@@H](Cc3ccccc3)[C@@H](O)C(F)F)o2)cc1 ZINC000482206460 897685126 /nfs/dbraw/zinc/68/51/26/897685126.db2.gz FIROKFWETXKZDL-PZJWPPBQSA-N 0 3 415.436 4.060 20 0 HIADHN Cc1cn([C@@H](C)c2ccccc2)nc1NC(=O)N[C@H](CN(C)C)c1ccc(F)cc1 ZINC000482229586 897709556 /nfs/dbraw/zinc/70/95/56/897709556.db2.gz FWWMZCNWAKNVCK-LAUBAEHRSA-N 0 3 409.509 4.364 20 0 HIADHN CCC[C@H](N[C@H](C)c1ccc(OCCOC)cc1)C(=O)N1CCc2sccc2C1 ZINC000482236650 897717927 /nfs/dbraw/zinc/71/79/27/897717927.db2.gz BADGKYVGDRYDFE-UTKZUKDTSA-N 0 3 416.587 4.178 20 0 HIADHN CC[C@H](N[C@@H](C)c1cccc(S(=O)(=O)NC)c1)c1cccc(Br)c1 ZINC000482249769 897731155 /nfs/dbraw/zinc/73/11/55/897731155.db2.gz ZZIPJDSZGLHFIP-UGSOOPFHSA-N 0 3 411.365 4.159 20 0 HIADHN C[C@@H](N[C@@H](C)c1cccc(S(=O)(=O)N(C)C)c1)c1cccc(-c2ccncc2)c1 ZINC000482249019 897731347 /nfs/dbraw/zinc/73/13/47/897731347.db2.gz YEZONIFSGLHSGE-MSOLQXFVSA-N 0 3 409.555 4.411 20 0 HIADHN OC1(Cc2ccc(F)cc2)CCN(Cc2ccccc2OCc2ccncc2)CC1 ZINC000482293694 897790220 /nfs/dbraw/zinc/79/02/20/897790220.db2.gz HVVTZGWDPSCKMV-UHFFFAOYSA-N 0 3 406.501 4.369 20 0 HIADHN COCCOc1ccc(Cl)cc1C(=O)N(C)C1CCN(Cc2ccccc2)CC1 ZINC000482296641 897793557 /nfs/dbraw/zinc/79/35/57/897793557.db2.gz OEZZGSVAUSUGIL-UHFFFAOYSA-N 0 3 416.949 4.102 20 0 HIADHN O=C(N[C@@H](c1cccc(F)c1F)C(F)(F)F)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000482377878 897904504 /nfs/dbraw/zinc/90/45/04/897904504.db2.gz PTKMIZJNERQEEQ-KDOFPFPSSA-N 0 3 413.390 4.142 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Cc2csc(-c3cccc(C)c3)n2)c1 ZINC000482411216 897956123 /nfs/dbraw/zinc/95/61/23/897956123.db2.gz ULPQUOIPVJXUKN-UHFFFAOYSA-N 0 3 423.582 4.260 20 0 HIADHN CN(C)C[C@H](NC(=O)Nc1cccc2c1CN(CC(F)(F)F)C2)c1ccc(F)cc1 ZINC000482425351 897977040 /nfs/dbraw/zinc/97/70/40/897977040.db2.gz UKCMOTQANCOOOB-IBGZPJMESA-N 0 3 424.442 4.128 20 0 HIADHN C[C@@H](NCc1cccnc1N1CCC(C(N)=O)CC1)c1cccc(-c2ccccc2)c1 ZINC000482452497 898019451 /nfs/dbraw/zinc/01/94/51/898019451.db2.gz MEHIXNNYMWDLAE-LJQANCHMSA-N 0 3 414.553 4.301 20 0 HIADHN Cc1c(C(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)cnn1-c1ccccc1Cl ZINC000482486521 898067251 /nfs/dbraw/zinc/06/72/51/898067251.db2.gz VXUPJZGFQOKSAX-VQIMIIECSA-N 0 3 408.933 4.399 20 0 HIADHN Cc1nc(COc2ccc(CN3CCC(c4nnc5n4CCCC5)CC3)cc2)cs1 ZINC000482489126 898068091 /nfs/dbraw/zinc/06/80/91/898068091.db2.gz RYYJIPYGRQCUQL-UHFFFAOYSA-N 0 3 423.586 4.338 20 0 HIADHN CCc1nc2c(s1)[C@@H](N[C@@H](C)c1cc(F)ccc1N1CCN(C)CC1)CCC2 ZINC000482529109 898116606 /nfs/dbraw/zinc/11/66/06/898116606.db2.gz APYLSIFSBQFYSS-YJBOKZPZSA-N 0 3 402.583 4.325 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)c1cnn(-c2ccc(F)cc2)c1-n1cccc1 ZINC000482590178 898189405 /nfs/dbraw/zinc/18/94/05/898189405.db2.gz CHIRUKZIFQZGPB-UHFFFAOYSA-N 0 3 417.488 4.424 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)[C@@H]1CCCN(C(=O)Nc2ccccc2F)C1 ZINC000482602511 898204947 /nfs/dbraw/zinc/20/49/47/898204947.db2.gz AZLXHUIDHQWLPU-GOSISDBHSA-N 0 3 412.509 4.078 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C1CCN(C(=O)c2ccc(Cl)s2)CC1 ZINC000482621610 898225378 /nfs/dbraw/zinc/22/53/78/898225378.db2.gz YCDXPVZAVLTHBI-UHFFFAOYSA-N 0 3 419.978 4.262 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)c2sc(C3CC3)nc2-c2ccccc2)C[C@H](C)O1 ZINC000482835911 898443792 /nfs/dbraw/zinc/44/37/92/898443792.db2.gz LNWOHUULMLYELZ-CALCHBBNSA-N 0 3 413.587 4.307 20 0 HIADHN Cc1ccc(OCCCC(=O)Nc2cccc(CN3CCC(CO)CC3)c2)c(C)c1 ZINC000482839251 898449019 /nfs/dbraw/zinc/44/90/19/898449019.db2.gz VDQWACHAQLYJIT-UHFFFAOYSA-N 0 3 410.558 4.305 20 0 HIADHN COc1cc(Cl)ccc1CN1C[C@H]2CCC[C@@]2(c2nc(-c3cccnc3)no2)C1 ZINC000482854827 898465154 /nfs/dbraw/zinc/46/51/54/898465154.db2.gz JCZIPNWVHUASKD-VGOFRKELSA-N 0 3 410.905 4.347 20 0 HIADHN CCc1nc(CN2CCC(CN[C@@H](C)c3nnn(-c4ccccc4)c3C)CC2)cs1 ZINC000482891482 898509963 /nfs/dbraw/zinc/50/99/63/898509963.db2.gz XAPFLNRKYHYUQT-KRWDZBQOSA-N 0 3 424.618 4.157 20 0 HIADHN C[C@@H]1CN(C(=O)Nc2ccc3c(c2)oc2ccccc23)CC[C@@H]1N1CCN(C)CC1 ZINC000482908412 898527184 /nfs/dbraw/zinc/52/71/84/898527184.db2.gz PNADYJSFYAAPQM-UTKZUKDTSA-N 0 3 406.530 4.076 20 0 HIADHN Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)N1CCN(C2CCCCC2)CC1 ZINC000482913166 898532008 /nfs/dbraw/zinc/53/20/08/898532008.db2.gz BIQHIIZPRMIOFF-UHFFFAOYSA-N 0 3 412.578 4.150 20 0 HIADHN C[C@@H](NCCOc1ccc(OC(F)(F)F)cc1)c1ccc(Br)cn1 ZINC000482976538 898612359 /nfs/dbraw/zinc/61/23/59/898612359.db2.gz INLHRYBBCXMILM-LLVKDONJSA-N 0 3 405.214 4.472 20 0 HIADHN CO[C@@]1(C)CCCN(CC(=O)N[C@H](c2ccccc2)c2cccc(Cl)c2)CC1 ZINC000482996325 898639967 /nfs/dbraw/zinc/63/99/67/898639967.db2.gz FFCXPCUCXLDOQB-PKTZIBPZSA-N 0 3 400.950 4.437 20 0 HIADHN Cc1ccc(NC(=O)c2nnc(CNC(C)(C)CN(C)Cc3ccccc3)s2)cc1 ZINC000505568630 914272950 /nfs/dbraw/zinc/27/29/50/914272950.db2.gz LXIXYCPRTSBRAO-UHFFFAOYSA-N 0 3 423.586 4.099 20 0 HIADHN Cc1nn(C)c(C)c1NC(=O)CN[C@](C)(CC(C)C)c1cccc(Br)c1 ZINC000483045534 898717065 /nfs/dbraw/zinc/71/70/65/898717065.db2.gz IXIJJOCEIPLAKC-HXUWFJFHSA-N 0 3 421.383 4.289 20 0 HIADHN CC(C)C[C@@](C)(NCC(=O)NCc1cccnc1)c1cccc(Br)c1 ZINC000483047535 898718729 /nfs/dbraw/zinc/71/87/29/898718729.db2.gz RTBTYWQXOFQXPD-HXUWFJFHSA-N 0 3 404.352 4.011 20 0 HIADHN COc1cc([C@H](C)N[C@H](Cc2ccccc2)[C@H](O)C(F)F)ccc1OC(F)F ZINC000483137709 898817611 /nfs/dbraw/zinc/81/76/11/898817611.db2.gz VGTOXMRRRPEXCF-PNPHSEOMSA-N 0 3 401.400 4.185 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)N[C@@H](C)c2ccccc2C(F)(F)F)cc1 ZINC000483142635 898821867 /nfs/dbraw/zinc/82/18/67/898821867.db2.gz XILMSDNERQLXIS-IFXJQAMLSA-N 0 3 409.452 4.377 20 0 HIADHN C[C@@H](NC[C@H](c1c(F)cccc1F)N(C)C)c1ccc(-n2cncn2)cc1Cl ZINC000483156694 898829280 /nfs/dbraw/zinc/82/92/80/898829280.db2.gz NSXOGINNWSAAQR-BFUOFWGJSA-N 0 3 405.880 4.152 20 0 HIADHN COc1cc(F)c([C@@H](C)N[C@H]2CCN(c3ccccc3OC(F)F)C2)cc1OC ZINC000483162024 898832330 /nfs/dbraw/zinc/83/23/30/898832330.db2.gz UTZUNUABCTWLBF-KGLIPLIRSA-N 0 3 410.436 4.374 20 0 HIADHN O=C(Nc1ccc(F)cc1OCC(F)(F)F)N1CCN(C2CCCCC2)CC1 ZINC000483183757 898845686 /nfs/dbraw/zinc/84/56/86/898845686.db2.gz NQUXWYLMVUVNTF-UHFFFAOYSA-N 0 3 403.420 4.249 20 0 HIADHN COc1cnccc1N1CCN(Cc2csc(Cc3ccc(Cl)cc3)n2)CC1 ZINC000483212537 898861833 /nfs/dbraw/zinc/86/18/33/898861833.db2.gz RTMLJYZGALNIAP-UHFFFAOYSA-N 0 3 414.962 4.113 20 0 HIADHN OC[C@@H](NC[C@H](O)C1CCCCC1)c1ccc(Br)cc1C(F)(F)F ZINC000483247450 898889855 /nfs/dbraw/zinc/88/98/55/898889855.db2.gz XFQYGEBFLJMLHZ-CVEARBPZSA-N 0 3 410.274 4.032 20 0 HIADHN C[C@H](NC(=O)Cc1ccc(OCc2ccccn2)cc1)[C@H](c1ccccc1)N(C)C ZINC000505588912 914295117 /nfs/dbraw/zinc/29/51/17/914295117.db2.gz WGKXELRDASBBST-UQBPGWFLSA-N 0 3 403.526 4.011 20 0 HIADHN CC1(C(=O)NCc2ccc([O-])c(Br)c2)CC[NH+](Cc2ccccc2)CC1 ZINC000483283904 898920598 /nfs/dbraw/zinc/92/05/98/898920598.db2.gz JMOLHCJXDVOXGJ-UHFFFAOYSA-N 0 3 417.347 4.073 20 0 HIADHN COCCN(C)c1ccc(CN2CCC[C@H](COc3ccccc3Cl)C2)cn1 ZINC000483297594 898931462 /nfs/dbraw/zinc/93/14/62/898931462.db2.gz PKBSOVPVELNHJA-IBGZPJMESA-N 0 3 403.954 4.109 20 0 HIADHN CCCN(C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C)[C@@H]1CCCc2cccnc21 ZINC000483313452 898942174 /nfs/dbraw/zinc/94/21/74/898942174.db2.gz WWLOIWWHXJPSLA-WWPVKYPJSA-N 0 3 406.574 4.401 20 0 HIADHN C[C@H](NC(=O)c1cc(OC(F)F)cc(OC(F)F)c1)[C@H](c1ccccc1)N(C)C ZINC000505592940 914299671 /nfs/dbraw/zinc/29/96/71/914299671.db2.gz WBTFRUBNHUGZSE-YVEFUNNKSA-N 0 3 414.399 4.311 20 0 HIADHN COCc1nc(C(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)c(-c2ccccc2)s1 ZINC000505602530 914306029 /nfs/dbraw/zinc/30/60/29/914306029.db2.gz NCKYSIKLRORINP-KKSFZXQISA-N 0 3 409.555 4.378 20 0 HIADHN COCc1nc(C(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)c(-c2ccccc2)s1 ZINC000505602528 914307228 /nfs/dbraw/zinc/30/72/28/914307228.db2.gz NCKYSIKLRORINP-IERDGZPVSA-N 0 3 409.555 4.378 20 0 HIADHN CO[C@@H](c1ccccc1Cl)[C@H](C)NC(=O)N(Cc1ccco1)C1CCN(C)CC1 ZINC000483418502 899049311 /nfs/dbraw/zinc/04/93/11/899049311.db2.gz NZBMTEJURBCJRF-HRAATJIYSA-N 0 3 419.953 4.315 20 0 HIADHN Cc1cc(NC(=O)c2ccco2)sc1C(=O)N[C@H](C)[C@@H](c1ccccc1)N(C)C ZINC000505605926 914310480 /nfs/dbraw/zinc/31/04/80/914310480.db2.gz JDQCNDRQEKUTJP-BEFAXECRSA-N 0 3 411.527 4.323 20 0 HIADHN Cc1onc(-c2ccccc2)c1-c1nnc(CN2CCN(C3CCCCC3)CC2)o1 ZINC000483486039 899137938 /nfs/dbraw/zinc/13/79/38/899137938.db2.gz DQAULGHDRHOQCJ-UHFFFAOYSA-N 0 3 407.518 4.150 20 0 HIADHN O=C(CN1CCN(C2CCCCC2)CC1)N[C@H](c1cccs1)c1ccc(F)cc1 ZINC000483487082 899138229 /nfs/dbraw/zinc/13/82/29/899138229.db2.gz QPLKYOBIEDRWMB-QHCPKHFHSA-N 0 3 415.578 4.043 20 0 HIADHN COc1ccccc1-c1csc(C2CCN(Cc3ccc(C(N)=O)cc3)CC2)n1 ZINC000483487852 899140646 /nfs/dbraw/zinc/14/06/46/899140646.db2.gz SOAUUDUAGNEUHX-UHFFFAOYSA-N 0 3 407.539 4.297 20 0 HIADHN CCc1cc(=O)c2cc(NC(=O)C3(C)CCN(Cc4ccccc4)CC3)ccc2[nH]1 ZINC000483489095 899142040 /nfs/dbraw/zinc/14/20/40/899142040.db2.gz ZNOFFDAGRZLUPW-UHFFFAOYSA-N 0 3 403.526 4.331 20 0 HIADHN O=C(CN1CCN(C2CCCCC2)CC1)Nc1cc(C(F)(F)F)ccc1Cl ZINC000483492648 899148518 /nfs/dbraw/zinc/14/85/18/899148518.db2.gz PRARXPLOYAIQNV-UHFFFAOYSA-N 0 3 403.876 4.248 20 0 HIADHN C[C@H](NC(=O)c1cccc(CSc2nccn2C)c1)[C@H](c1ccccc1)N(C)C ZINC000505616052 914319036 /nfs/dbraw/zinc/31/90/36/914319036.db2.gz ZWJNATWGLHHBGB-LAUBAEHRSA-N 0 3 408.571 4.134 20 0 HIADHN CCOc1cc2c(cc1[C@@H]1C[C@@H]1C(=O)N[C@H](C)[C@H](c1ccccc1)N(C)C)O[C@H](C)C2 ZINC000505629414 914328402 /nfs/dbraw/zinc/32/84/02/914328402.db2.gz IFMHSUONIRBVEC-WZGCOHSCSA-N 0 3 422.569 4.320 20 0 HIADHN Cc1ccc(NC(=O)N[C@H](CN(C)C)c2ccc(F)cc2)cc1C(=O)N(C)C(C)C ZINC000483598858 899249742 /nfs/dbraw/zinc/24/97/42/899249742.db2.gz CTMMUSOJIZCDPT-OAQYLSRUSA-N 0 3 414.525 4.039 20 0 HIADHN C[C@H](CN1CCCCCC1)NC(=O)N1CCC(C(=O)c2ccc(Cl)cc2)CC1 ZINC000483610519 899261742 /nfs/dbraw/zinc/26/17/42/899261742.db2.gz BUDYYOJGWMREOU-QGZVFWFLSA-N 0 3 405.970 4.209 20 0 HIADHN Cc1cc(-c2noc([C@@H](C)NC3CCN(CCC(F)(F)F)CC3)n2)ccc1F ZINC000483641649 899298506 /nfs/dbraw/zinc/29/85/06/899298506.db2.gz UMCCNSVRVRPCBB-CYBMUJFWSA-N 0 3 400.420 4.252 20 0 HIADHN C[C@H](NC(=O)Cc1ccc(NC(=O)CC(C)(C)C)cc1)[C@H](c1ccccc1)N(C)C ZINC000505634839 914333824 /nfs/dbraw/zinc/33/38/24/914333824.db2.gz RGECJWNBWNAJEA-MHECFPHRSA-N 0 3 409.574 4.411 20 0 HIADHN COc1ccccc1[C@H](CC(C)C)N[C@@H](C)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000483709467 899364005 /nfs/dbraw/zinc/36/40/05/899364005.db2.gz JTAWLJLDKDLMOZ-UWJYYQICSA-N 0 3 404.576 4.384 20 0 HIADHN C[C@H](N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1=O)c1ccc2c(c1)COC2 ZINC000483709571 899364483 /nfs/dbraw/zinc/36/44/83/899364483.db2.gz FSSHANZCTUJAIP-VBKZILBWSA-N 0 3 402.441 4.164 20 0 HIADHN CO[C@@H]1CCCC[C@@H]1NCC(=O)N(Cc1ccccc1)c1nc2c(s1)CCCC2 ZINC000483709618 899364622 /nfs/dbraw/zinc/36/46/22/899364622.db2.gz LDJGAXSMVHEHEW-AZUAARDMSA-N 0 3 413.587 4.102 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2ccc3nn(C(C)C)cc3c2)c1 ZINC000483794060 899463958 /nfs/dbraw/zinc/46/39/58/899463958.db2.gz DBCRFKPIHSKBLE-UHFFFAOYSA-N 0 3 409.534 4.222 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2cccc(CC(F)(F)F)c2)c1 ZINC000483797152 899469455 /nfs/dbraw/zinc/46/94/55/899469455.db2.gz FMYGUGGNRRBVDF-UHFFFAOYSA-N 0 3 409.452 4.396 20 0 HIADHN CC[C@@H]1Oc2cc([C@@H](C)N[C@H](C)c3ccc4c(c3)C(C)(C)C(=O)N4)ccc2NC1=O ZINC000483857131 899540362 /nfs/dbraw/zinc/54/03/62/899540362.db2.gz JZZYGRDMNOTLQQ-JZKQVHKSSA-N 0 3 407.514 4.438 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)Nc1cc([C@H]2CCCO2)nn1C)c1ccc(Cl)cc1 ZINC000483862462 899544592 /nfs/dbraw/zinc/54/45/92/899544592.db2.gz ZXAIYCCLJBTXSB-RBUKOAKNSA-N 0 3 419.957 4.130 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)Nc1cc([C@@H]2CCCO2)nn1C)c1ccc(Cl)cc1 ZINC000483862461 899544729 /nfs/dbraw/zinc/54/47/29/899544729.db2.gz ZXAIYCCLJBTXSB-OALUTQOASA-N 0 3 419.957 4.130 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)NC[C@H]1CCCC[C@@H]1C(F)(F)F ZINC000484051415 899684219 /nfs/dbraw/zinc/68/42/19/899684219.db2.gz VLKBTWXWWTZTNS-AEFFLSMTSA-N 0 3 403.464 4.268 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)Nc1nnc(/C=C/c2ccco2)s1 ZINC000484093502 899723909 /nfs/dbraw/zinc/72/39/09/899723909.db2.gz CVMKARVYIMHDQK-CMDGGOBGSA-N 0 3 415.494 4.036 20 0 HIADHN C[C@H](NCc1ccc(-c2ccncc2)cc1)c1cccc(N2CCCS2(=O)=O)c1 ZINC000484127703 899749093 /nfs/dbraw/zinc/74/90/93/899749093.db2.gz IPOOWNHRIQXYMK-SFHVURJKSA-N 0 3 407.539 4.139 20 0 HIADHN CCN(C(=O)c1cnn(-c2ccccc2C)c1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000484165499 899784991 /nfs/dbraw/zinc/78/49/91/899784991.db2.gz TXLRBGAKGURMSM-NFBKMPQASA-N 0 3 402.542 4.478 20 0 HIADHN Cc1ccc(Oc2ccccc2)c(NC(=O)N2CC[C@@H](N3CCN(C)CC3)[C@H](C)C2)c1 ZINC000484225288 899821861 /nfs/dbraw/zinc/82/18/61/899821861.db2.gz XGLRKXNECGQXMD-NFBKMPQASA-N 0 3 422.573 4.277 20 0 HIADHN CC[C@H](N[C@@H](C)c1sc(-c2ccc(Cl)cc2)nc1C)C(=O)N1CCOCC1 ZINC000484305014 899865017 /nfs/dbraw/zinc/86/50/17/899865017.db2.gz UJKDPRKCPHBURF-GUYCJALGSA-N 0 3 407.967 4.060 20 0 HIADHN CSc1cccc(N(C(=O)Cc2cnn(-c3ccccc3)c2)C2CCN(C)CC2)c1 ZINC000484407930 899930321 /nfs/dbraw/zinc/93/03/21/899930321.db2.gz NXILQLINELWVHD-UHFFFAOYSA-N 0 3 420.582 4.264 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)NCc1cccc(NC(=O)C2CCCC2)c1 ZINC000484414046 899933533 /nfs/dbraw/zinc/93/35/33/899933533.db2.gz ZIMJYNNGERBTOO-UHFFFAOYSA-N 0 3 414.594 4.223 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(S(=O)(=O)N(C)C)cc1)c1ccc(-c2cccnc2)cc1 ZINC000484473154 899966758 /nfs/dbraw/zinc/96/67/58/899966758.db2.gz MCEGFIPDUUHFOM-MSOLQXFVSA-N 0 3 409.555 4.411 20 0 HIADHN COc1ccc2c(c1)[C@H](NCCC(=O)Nc1cc(C)c(Cl)cc1OC)CCCO2 ZINC000484487896 899979932 /nfs/dbraw/zinc/97/99/32/899979932.db2.gz UBAJNOANVLIENJ-GOSISDBHSA-N 0 3 418.921 4.498 20 0 HIADHN Cc1cc(C)c(NC(=O)C(=O)Nc2cc(C)cc(N3CCN(C(C)C)CC3)c2)c(C)c1 ZINC000484490666 899982939 /nfs/dbraw/zinc/98/29/39/899982939.db2.gz KVDUQMGNVSKLSD-UHFFFAOYSA-N 0 3 422.573 4.028 20 0 HIADHN COc1cccc2c1CC[C@H]2N[C@H](C)c1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000484495820 899987013 /nfs/dbraw/zinc/98/70/13/899987013.db2.gz GOUBUIGCPNGFDH-VGOFRKELSA-N 0 3 414.571 4.208 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(OCC2CC2)c(F)c1)c1ccc(NS(C)(=O)=O)cc1 ZINC000484499666 899989980 /nfs/dbraw/zinc/98/99/80/899989980.db2.gz HCANUTGUROAYMA-CABCVRRESA-N 0 3 406.523 4.398 20 0 HIADHN C[C@@H](N[C@H]1CCN(C(=O)CCc2ccccc2)C1)c1ccc(F)cc1OC(F)F ZINC000484501924 899992290 /nfs/dbraw/zinc/99/22/90/899992290.db2.gz MVBLTGHRCKHRRJ-QAPCUYQASA-N 0 3 406.448 4.311 20 0 HIADHN O=C(C1CCCCC1)N1CC[C@@H](N[C@@H]2CCCOc3c(Br)cccc32)C1 ZINC000484507106 899997607 /nfs/dbraw/zinc/99/76/07/899997607.db2.gz YMTPURFIURYRCY-VQIMIIECSA-N 0 3 421.379 4.434 20 0 HIADHN O=C(C1CCCCC1)N1CC[C@H](N[C@H]2CCCOc3ccc(Br)cc32)C1 ZINC000484510238 900001916 /nfs/dbraw/zinc/00/19/16/900001916.db2.gz WMLRSDZBLZDGTP-HKUYNNGSSA-N 0 3 421.379 4.434 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(OCC2CC2)c(F)c1)c1cccc(NS(C)(=O)=O)c1 ZINC000484510298 900002532 /nfs/dbraw/zinc/00/25/32/900002532.db2.gz WOUHRHVWXUAFEA-HUUCEWRRSA-N 0 3 406.523 4.398 20 0 HIADHN O[C@@H](CN[C@@H](Cn1cnc2ccccc21)c1ccc(F)cc1)COc1ccccc1F ZINC000484549444 900029801 /nfs/dbraw/zinc/02/98/01/900029801.db2.gz VHEYWTZOBWCZAG-UGKGYDQZSA-N 0 3 423.463 4.085 20 0 HIADHN Cc1ccc(CN[C@H](C)c2cccc(N3CCOCC3)c2)c(OC[C@@H]2CCOC2)c1 ZINC000484616082 900071710 /nfs/dbraw/zinc/07/17/10/900071710.db2.gz KRUPZKFEVQBTKX-NHCUHLMSSA-N 0 3 410.558 4.098 20 0 HIADHN Cc1ccc(CN[C@@H](C)c2cccc(N3CCOCC3)c2)c(OC[C@H]2CCOC2)c1 ZINC000484616086 900072163 /nfs/dbraw/zinc/07/21/63/900072163.db2.gz KRUPZKFEVQBTKX-SFTDATJTSA-N 0 3 410.558 4.098 20 0 HIADHN Cc1ccc(CN[C@@H](C)c2ccc(NS(C)(=O)=O)cc2)c(OCC(F)(F)F)c1 ZINC000484624750 900077581 /nfs/dbraw/zinc/07/75/81/900077581.db2.gz VCKGAQFYFLRCED-AWEZNQCLSA-N 0 3 416.465 4.158 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)N[C@H](c2cccc(C)c2)C(F)(F)F)c1 ZINC000484795116 900200830 /nfs/dbraw/zinc/20/08/30/900200830.db2.gz JWGVUPQPLZKEKR-HXUWFJFHSA-N 0 3 423.479 4.380 20 0 HIADHN CCc1c(NC(=O)N(CCN(C)C)C(C)C)cnn1-c1ccc(C(F)(F)F)cc1 ZINC000484815222 900217198 /nfs/dbraw/zinc/21/71/98/900217198.db2.gz ZFTVBVDRWNVZJI-UHFFFAOYSA-N 0 3 411.472 4.257 20 0 HIADHN CCc1c(NC(=O)N[C@H]2CCCN(C)[C@H]2C)cnn1-c1ccc(C(F)(F)F)cc1 ZINC000484817452 900219923 /nfs/dbraw/zinc/21/99/23/900219923.db2.gz BCBSVTFBOUVDHR-BBRMVZONSA-N 0 3 409.456 4.058 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCCC1)c1[nH]c2ccc(F)cc2c1Cl ZINC000484854423 900247910 /nfs/dbraw/zinc/24/79/10/900247910.db2.gz IRLNHMWUYQRXQV-UHFFFAOYSA-N 0 3 409.958 4.442 20 0 HIADHN CCOc1ccccc1NC(=O)CCN1CCCC[C@H]1CNC(=O)Nc1ccccc1 ZINC000484990864 900344789 /nfs/dbraw/zinc/34/47/89/900344789.db2.gz ZTRCQTRQUNEQDQ-FQEVSTJZSA-N 0 3 424.545 4.090 20 0 HIADHN CNC(=O)[C@@H]1Cc2ccccc2N1C(=O)C(Cc1c(C)cc(C)cc1C)C(F)(F)F ZINC000485134929 900436717 /nfs/dbraw/zinc/43/67/17/900436717.db2.gz PDSGJGRGFMAJAY-ICSRJNTNSA-N 0 3 418.459 4.037 20 0 HIADHN O=C(NCCN1CCCC1)c1ccc(NC(=O)c2ccc(Cl)cc2Cl)cc1 ZINC000485473036 900766708 /nfs/dbraw/zinc/76/67/08/900766708.db2.gz HLXKBRHCNYZZBJ-UHFFFAOYSA-N 0 3 406.313 4.071 20 0 HIADHN CC(C)(C(=O)Nc1ccc(C(=O)NCCN2CCCC2)cc1)c1ccc(Cl)cc1 ZINC000485481811 900773437 /nfs/dbraw/zinc/77/34/37/900773437.db2.gz OWEAERCPKIKRBM-UHFFFAOYSA-N 0 3 413.949 4.082 20 0 HIADHN O=C(NCCN1CCCC1)c1ccc(NC(=O)c2cc(F)c(Cl)cc2Cl)cc1 ZINC000485482048 900773719 /nfs/dbraw/zinc/77/37/19/900773719.db2.gz PWFRVORTRIJCJQ-UHFFFAOYSA-N 0 3 424.303 4.210 20 0 HIADHN O=C(CCCc1ccc(Cl)cc1)Nc1ccc(C(=O)NCCN2CCCC2)cc1 ZINC000485491643 900781775 /nfs/dbraw/zinc/78/17/75/900781775.db2.gz BXWHQLLHDKEVGA-UHFFFAOYSA-N 0 3 413.949 4.127 20 0 HIADHN CN(C)CCN(C(=O)c1coc(-c2ccc(Br)cc2F)n1)C1CCCC1 ZINC000485602922 900863160 /nfs/dbraw/zinc/86/31/60/900863160.db2.gz GGWIZUKOVXWINF-UHFFFAOYSA-N 0 3 424.314 4.190 20 0 HIADHN CN(C)Cc1ccccc1C(=O)Nc1cccc(COc2ccc3c(c2)OCO3)c1 ZINC000485791761 901044537 /nfs/dbraw/zinc/04/45/37/901044537.db2.gz VEQPNGNKOPOSMH-UHFFFAOYSA-N 0 3 404.466 4.308 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@@H](C)N[C@H](C)c2ccc3ncsc3c2)cc1F ZINC000485820791 901068147 /nfs/dbraw/zinc/06/81/47/901068147.db2.gz UUIQSFCJDHYPDC-ZIAGYGMSSA-N 0 3 401.507 4.142 20 0 HIADHN CC[C@@H](NC[C@@H](O)COc1cccc(C(C)=O)c1)c1cc(F)cc(Br)c1 ZINC000485848246 901091927 /nfs/dbraw/zinc/09/19/27/901091927.db2.gz VGTZGIWHBYAWIK-UYAOXDASSA-N 0 3 424.310 4.271 20 0 HIADHN C[C@H]1CN(C)C[C@@H]1C(=O)Nc1nnc(SCc2c(Cl)cccc2Cl)s1 ZINC000485859315 901100385 /nfs/dbraw/zinc/10/03/85/901100385.db2.gz ZXWUMMDGAQBUPN-UWVGGRQHSA-N 0 3 417.387 4.273 20 0 HIADHN CCN(C(=O)c1cnnc(-c2ccccc2)c1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000485882326 901117745 /nfs/dbraw/zinc/11/77/45/901117745.db2.gz JBDVANASAKCAIG-CVDCTZTESA-N 0 3 400.526 4.441 20 0 HIADHN CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)c1cncc(OCc2cccc(Cl)c2)n1 ZINC000486012281 901221279 /nfs/dbraw/zinc/22/12/79/901221279.db2.gz YXFGDQDVSVUKMY-CVDCTZTESA-N 0 3 423.948 4.233 20 0 HIADHN C[C@@H](NC[C@H](c1ccccc1)C(F)(F)F)c1cccc(N2CCCS2(=O)=O)c1 ZINC000486069831 901261734 /nfs/dbraw/zinc/26/17/34/901261734.db2.gz OCWTUWPYBUNJSS-DNVCBOLYSA-N 0 3 412.477 4.223 20 0 HIADHN CN(C)Cc1ccccc1C(=O)NCc1ccc(NC(=O)c2ccc(F)cc2)cc1 ZINC000486118038 901303648 /nfs/dbraw/zinc/30/36/48/901303648.db2.gz RPXHZSQVZZYIRT-UHFFFAOYSA-N 0 3 405.473 4.070 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)NC[C@H](c2ccccc2)C(F)(F)F)C1 ZINC000486141346 901329237 /nfs/dbraw/zinc/32/92/37/901329237.db2.gz CBGBTBWQWUGAEN-NSISKUIASA-N 0 3 405.464 4.467 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)c2ccc(-c3noc(C(F)F)n3)cc2)C1 ZINC000486222970 901405527 /nfs/dbraw/zinc/40/55/27/901405527.db2.gz ZLVIDSPAMFIEAA-KSSFIOAISA-N 0 3 412.440 4.240 20 0 HIADHN Cc1nc(CNC(=O)N2CCN(C3CCCCC3)CC2)oc1-c1ccc(Cl)cc1 ZINC000486229384 901413421 /nfs/dbraw/zinc/41/34/21/901413421.db2.gz KUMYDAPDLQUGBA-UHFFFAOYSA-N 0 3 416.953 4.463 20 0 HIADHN O=C(CN1CCN(C2CCCCC2)CC1)Nc1ccc(N2CCc3ccccc32)cc1 ZINC000486254332 901437704 /nfs/dbraw/zinc/43/77/04/901437704.db2.gz TZVMZJNIIWSEBR-UHFFFAOYSA-N 0 3 418.585 4.270 20 0 HIADHN C[C@H](CNC(=O)c1ccccc1CN(C)C)Sc1ccc(Br)cc1 ZINC000486255050 901437872 /nfs/dbraw/zinc/43/78/72/901437872.db2.gz JDYAYWCVBZLWMI-CQSZACIVSA-N 0 3 407.377 4.421 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)NCCc2csc(-c3ccccc3)n2)CC1 ZINC000486266127 901448719 /nfs/dbraw/zinc/44/87/19/901448719.db2.gz KPVOHTXMGPPKOZ-UHFFFAOYSA-N 0 3 424.570 4.252 20 0 HIADHN Cc1cc(Br)cc(NC(=O)N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)c1 ZINC000486320747 901498045 /nfs/dbraw/zinc/49/80/45/901498045.db2.gz VLSCQFNVJHONOM-IYBDPMFKSA-N 0 3 424.383 4.111 20 0 HIADHN Cc1cc(Br)cc(NC(=O)N2CCC(CN3C[C@H](C)O[C@@H](C)C3)CC2)c1 ZINC000486320745 901498103 /nfs/dbraw/zinc/49/81/03/901498103.db2.gz VLSCQFNVJHONOM-HOTGVXAUSA-N 0 3 424.383 4.111 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)NCCc1csc(-c2ccccc2)n1 ZINC000486348097 901520335 /nfs/dbraw/zinc/52/03/35/901520335.db2.gz VSZGMMDMBVNYRD-UHFFFAOYSA-N 0 3 414.600 4.188 20 0 HIADHN O=C(NC[C@H](c1ccccc1)C(F)(F)F)N1CCCN(Cc2ccccc2)CC1 ZINC000486456499 901615461 /nfs/dbraw/zinc/61/54/61/901615461.db2.gz NSHFYCVXMFXGCS-HXUWFJFHSA-N 0 3 405.464 4.250 20 0 HIADHN c1c(CN2C[C@H]3CCC[C@@]3(c3nc(-c4cccnc4)no3)C2)[nH]nc1-c1ccccc1 ZINC000486459660 901620365 /nfs/dbraw/zinc/62/03/65/901620365.db2.gz LJGIYMGCDWSIHM-NTKDMRAZSA-N 0 3 412.497 4.075 20 0 HIADHN CCN(Cc1c(F)cccc1F)C(=O)c1ccc(N2CCN(C(C)C)CC2)cc1 ZINC000505910504 914552686 /nfs/dbraw/zinc/55/26/86/914552686.db2.gz YZGDBSDLKMSNGO-UHFFFAOYSA-N 0 3 401.501 4.158 20 0 HIADHN C[C@@H](C(=O)Nc1cccc(CN2CCC(O)CC2)c1)c1cccc(Br)c1 ZINC000486565588 901711530 /nfs/dbraw/zinc/71/15/30/901711530.db2.gz MWAIOLHZTXZZOA-OAHLLOKOSA-N 0 3 417.347 4.148 20 0 HIADHN COC(=O)c1ccc(CN2C[C@H]3CCC[C@@]3(c3nc(-c4ccccc4)no3)C2)s1 ZINC000486852494 901898341 /nfs/dbraw/zinc/89/83/41/901898341.db2.gz KJCRTXYTFYGMKP-OPAMFIHVSA-N 0 3 409.511 4.138 20 0 HIADHN CC1CCC(N2CCN(C(=O)Nc3nnc(/C=C\c4ccco4)s3)CC2)CC1 ZINC000486884595 901931414 /nfs/dbraw/zinc/93/14/14/901931414.db2.gz YGMDBCNIOCTOBG-HJWRWDBZSA-N 0 3 401.536 4.030 20 0 HIADHN CC(C)c1c(NC(=O)NC[C@H](Cc2ccccc2)N(C)C)cnn1-c1ccccc1 ZINC000486889082 901934722 /nfs/dbraw/zinc/93/47/22/901934722.db2.gz UWGJIZUKOICHQZ-NRFANRHFSA-N 0 3 405.546 4.290 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)Nc3cc(C(C)(C)C)nn3-c3cccc(Cl)c3)[C@H]2C1 ZINC000486895656 901939678 /nfs/dbraw/zinc/93/96/78/901939678.db2.gz OLNBKMLNXWEUOT-YJBOKZPZSA-N 0 3 415.969 4.381 20 0 HIADHN C[C@H]1CN([C@H](CNCc2scnc2C2CC2)c2c(F)cccc2Cl)CCO1 ZINC000486925311 901967568 /nfs/dbraw/zinc/96/75/68/901967568.db2.gz FDPGRWKBIPSQNO-SUMWQHHRSA-N 0 3 409.958 4.365 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)Nc2nnc(/C=C/c3ccco3)s2)CN1Cc1ccccc1 ZINC000486942129 901978724 /nfs/dbraw/zinc/97/87/24/901978724.db2.gz LGTKWQHPPCLYHY-AMMZPXFLSA-N 0 3 409.515 4.086 20 0 HIADHN O=C(CCNCc1cnc(-c2ccco2)s1)Nc1ccc(Br)cc1 ZINC000486949519 901984423 /nfs/dbraw/zinc/98/44/23/901984423.db2.gz IAXFBXLOPDCQEL-UHFFFAOYSA-N 0 3 406.305 4.284 20 0 HIADHN CCNC(=O)c1ccc(CNCc2c[nH]nc2-c2ccc(C(F)(F)F)cc2)cc1 ZINC000486981107 902002127 /nfs/dbraw/zinc/00/21/27/902002127.db2.gz QERCXPYPWHRVLA-UHFFFAOYSA-N 0 3 402.420 4.135 20 0 HIADHN Cn1ncc(Br)c1CNCC(C)(C)c1cccc(Br)c1 ZINC000486992641 902006726 /nfs/dbraw/zinc/00/67/26/902006726.db2.gz ZYJFXFMNHPQRJN-UHFFFAOYSA-N 0 3 401.146 4.013 20 0 HIADHN CC(C)([C@H](NC(=O)CCc1cncc(F)c1)c1ccc(F)c(F)c1)N1CCCC1 ZINC000487111450 902061250 /nfs/dbraw/zinc/06/12/50/902061250.db2.gz JDQWXDOVZAWFJE-OAQYLSRUSA-N 0 3 405.464 4.163 20 0 HIADHN CCOc1c(Cl)cccc1CNc1ccc2nc(CCN3CCOCC3)[nH]c2c1 ZINC000487279168 902135221 /nfs/dbraw/zinc/13/52/21/902135221.db2.gz ODVSMGSXTZYTKH-UHFFFAOYSA-N 0 3 414.937 4.102 20 0 HIADHN Cc1nc(-c2ccc(C)cc2NC(=O)CN[C@@H](c2ccc(F)cc2)C2CCC2)n[nH]1 ZINC000487366947 902163664 /nfs/dbraw/zinc/16/36/64/902163664.db2.gz RHTKBJWZLBZUCJ-JOCHJYFZSA-N 0 3 407.493 4.297 20 0 HIADHN Cc1nc(-c2ccc(C)cc2NC(=O)CN(Cc2ccccc2)[C@@H](C)C2CC2)n[nH]1 ZINC000487411924 902193182 /nfs/dbraw/zinc/19/31/82/902193182.db2.gz JBHDWBNXUVHXCB-KRWDZBQOSA-N 0 3 403.530 4.328 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)N[C@@H]1CCC[C@H](c2ccccc2)C1 ZINC000487417844 902200959 /nfs/dbraw/zinc/20/09/59/902200959.db2.gz WHVITRPPGKMLRV-XUZZJYLKSA-N 0 3 421.585 4.169 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2)c1 ZINC000487623443 902255785 /nfs/dbraw/zinc/25/57/85/902255785.db2.gz MWPTVFPKAJIXNL-UHFFFAOYSA-N 0 3 415.537 4.451 20 0 HIADHN FC(F)(F)C1CCN(C2CC(Nc3cc(N4CCc5ccccc54)ncn3)C2)CC1 ZINC000487729946 902324515 /nfs/dbraw/zinc/32/45/15/902324515.db2.gz ZVQHRJFYLSHUNP-UHFFFAOYSA-N 0 3 417.479 4.388 20 0 HIADHN COc1ccc(CNC(=O)[C@H](C)N[C@@H](C)c2ccc(F)c3ccccc32)cc1OC ZINC000487861415 902411721 /nfs/dbraw/zinc/41/17/21/902411721.db2.gz WWHCHPPKOXBJQR-HOTGVXAUSA-N 0 3 410.489 4.352 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(Oc2cccnc2)cc1)C(=O)NC(=O)Nc1ccccc1F ZINC000487931380 902461232 /nfs/dbraw/zinc/46/12/32/902461232.db2.gz FBMLOHDQFAGAPU-HZPDHXFCSA-N 0 3 422.460 4.400 20 0 HIADHN CC[C@@H]1C[C@H](C(=O)NC[C@H](c2ccc(C(F)(F)F)cc2)N(CC)CC)CCO1 ZINC000505969042 914630292 /nfs/dbraw/zinc/63/02/92/914630292.db2.gz AGOOGSMTDGQWLJ-BHIYHBOVSA-N 0 3 400.485 4.410 20 0 HIADHN CCN(C(=O)c1cc2c(cc1F)NC(=O)CC2)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000488099032 902602354 /nfs/dbraw/zinc/60/23/54/902602354.db2.gz PURHCISXNZXXDQ-APWZRJJASA-N 0 3 409.505 4.008 20 0 HIADHN Cc1cccc(NC(=O)[C@H]2CSCN2C(=O)c2cccc(CN3CCCC3)c2)c1C ZINC000488122916 902621366 /nfs/dbraw/zinc/62/13/66/902621366.db2.gz OTPPHWLQRXEGLY-JOCHJYFZSA-N 0 3 423.582 4.053 20 0 HIADHN O=C(CCN1CCC[C@H](c2nc3ccc(F)cc3o2)C1)c1ccc2c(c1)OCCO2 ZINC000488155728 902651290 /nfs/dbraw/zinc/65/12/90/902651290.db2.gz ZKOCDLWLNBJDCE-INIZCTEOSA-N 0 3 410.445 4.191 20 0 HIADHN C[C@H]1CN(C2CCOCC2)CCN1C(=O)Nc1c(F)cccc1Oc1ccccc1 ZINC000488291490 902752453 /nfs/dbraw/zinc/75/24/53/902752453.db2.gz HJJHOOYBALQCCF-KRWDZBQOSA-N 0 3 413.493 4.335 20 0 HIADHN C[C@H]1CN(C2CCOCC2)CCN1C(=O)Nc1ccccc1COCc1ccccc1 ZINC000488327181 902766782 /nfs/dbraw/zinc/76/67/82/902766782.db2.gz DZRAKNKUPOORJD-FQEVSTJZSA-N 0 3 423.557 4.120 20 0 HIADHN Cc1c(CSC(C)C)cccc1NC(=O)N1CCN(C2CCOCC2)C[C@H]1C ZINC000488488030 902850580 /nfs/dbraw/zinc/85/05/80/902850580.db2.gz PQYILRSAAFAENH-QGZVFWFLSA-N 0 3 405.608 4.354 20 0 HIADHN C[C@H](NC(=O)N[C@@H](CC1CC1)c1cc(F)cc(Br)c1)C1=CCN(C)CC1 ZINC000488508986 902861864 /nfs/dbraw/zinc/86/18/64/902861864.db2.gz CCUHXGKZMYYUHR-DJJJIMSYSA-N 0 3 424.358 4.379 20 0 HIADHN Cc1cccc(-c2ccc(CNC(=O)N3CCN(C4CCOCC4)C[C@H]3C)cc2)c1 ZINC000488522619 902868499 /nfs/dbraw/zinc/86/84/99/902868499.db2.gz ZMGCXPGGJRBGEZ-HXUWFJFHSA-N 0 3 407.558 4.057 20 0 HIADHN O=C(Nc1ccc2c(c1)CCCO2)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000505995648 914664908 /nfs/dbraw/zinc/66/49/08/914664908.db2.gz IYSXXAWEMNQCES-OAQYLSRUSA-N 0 3 404.432 4.405 20 0 HIADHN CCOc1cc2c(cc1NC(=O)c1ccc(N3CCN(C(C)C)CC3)cc1)O[C@H](C)C2 ZINC000488582101 902891581 /nfs/dbraw/zinc/89/15/81/902891581.db2.gz MRUWGTPVUSGZAG-GOSISDBHSA-N 0 3 423.557 4.191 20 0 HIADHN C[C@@H](c1ccc(S(N)(=O)=O)cc1)N(C)Cc1ccc(F)c(-c2cccs2)c1 ZINC000506000279 914672204 /nfs/dbraw/zinc/67/22/04/914672204.db2.gz ZDMRGDBXBDLXMG-AWEZNQCLSA-N 0 3 404.532 4.395 20 0 HIADHN Cc1nc(Cc2ccccc2)sc1C(=O)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000488671957 902932595 /nfs/dbraw/zinc/93/25/95/902932595.db2.gz IKFKOZCWTGMWRM-UHFFFAOYSA-N 0 3 421.566 4.251 20 0 HIADHN C[C@@H](NC(=O)Nc1ccc(F)cc1OC1CCOCC1)[C@@H](c1ccccc1)N(C)C ZINC000488701735 902951988 /nfs/dbraw/zinc/95/19/88/902951988.db2.gz YPDMIWQDAATWGX-ZHRRBRCNSA-N 0 3 415.509 4.196 20 0 HIADHN Cc1ccccc1[C@H](C(C)C)N(C)CC(=O)NCC1(c2ccccc2)CCOCC1 ZINC000488720448 902964664 /nfs/dbraw/zinc/96/46/64/902964664.db2.gz BRRKYKNLJWDSIW-VWLOTQADSA-N 0 3 408.586 4.489 20 0 HIADHN Cc1nc(C(=O)N2CCC(CN3C[C@@H](C)O[C@H](C)C3)CC2)c(-c2ccccc2)s1 ZINC000488890282 903059731 /nfs/dbraw/zinc/05/97/31/903059731.db2.gz LDJIDOBZFIAMCF-IAGOWNOFSA-N 0 3 413.587 4.080 20 0 HIADHN CCC(C)(C)OCc1cccc(NC(=O)N2CCN(C3CCOCC3)C[C@H]2C)c1C ZINC000488916909 903075931 /nfs/dbraw/zinc/07/59/31/903075931.db2.gz VGIRITJIAIIJDN-GOSISDBHSA-N 0 3 417.594 4.417 20 0 HIADHN CCOc1ccc(NC(=O)NCc2ccccc2CN2CCC(O)CC2)cc1Cl ZINC000489008904 903118455 /nfs/dbraw/zinc/11/84/55/903118455.db2.gz HVCUJVSZDGOEAQ-UHFFFAOYSA-N 0 3 417.937 4.017 20 0 HIADHN CC(=O)Nc1cccc(NC(=O)[C@H](C)N[C@@H](COc2ccccc2F)C(C)(C)C)c1 ZINC000489026533 903130064 /nfs/dbraw/zinc/13/00/64/903130064.db2.gz IWAVOAQGAQRXMO-BTYIYWSLSA-N 0 3 415.509 4.194 20 0 HIADHN CC(=O)c1cccc(NC(=O)[C@@H](C)N[C@@H](COc2ccccc2F)C(C)(C)C)c1 ZINC000489042738 903147232 /nfs/dbraw/zinc/14/72/32/903147232.db2.gz YCQWTSCPGJBYQK-VFNWGFHPSA-N 0 3 400.494 4.439 20 0 HIADHN CCOc1c(Br)cc(Br)cc1CNC[C@@H](O)[C@H](C)CC ZINC000489064030 903166675 /nfs/dbraw/zinc/16/66/75/903166675.db2.gz JGNZTZRTNIKKRM-QMTHXVAHSA-N 0 3 409.162 4.107 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)NCc2cc(C)cc3c(C)c(C)[nH]c32)cc1 ZINC000489083798 903185162 /nfs/dbraw/zinc/18/51/62/903185162.db2.gz SUKHOFRSRZCILO-JOCHJYFZSA-N 0 3 408.546 4.204 20 0 HIADHN C[C@H](NC(=O)N(CCN(C)Cc1ccccc1)Cc1ccccc1)c1cccnc1 ZINC000489147297 903231937 /nfs/dbraw/zinc/23/19/37/903231937.db2.gz DQGWFUWRFOJYMH-NRFANRHFSA-N 0 3 402.542 4.486 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)N[C@@H](c2ccccc2)[C@H]2CCCO2)CC1 ZINC000489147113 903232209 /nfs/dbraw/zinc/23/22/09/903232209.db2.gz DGJTUPVNTYQRHI-RPWUZVMVSA-N 0 3 407.558 4.213 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)N[C@H]2CCOc3c(Cl)cccc32)CC1 ZINC000489234638 903279285 /nfs/dbraw/zinc/27/92/85/903279285.db2.gz AAFCTCVKZDCZDI-NRFANRHFSA-N 0 3 413.949 4.470 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)NCCOc2cccc(Cl)c2)CC1 ZINC000489271626 903297954 /nfs/dbraw/zinc/29/79/54/903297954.db2.gz UARWJQUBONXOAU-UHFFFAOYSA-N 0 3 401.938 4.025 20 0 HIADHN CC(C)c1ccc(OCCNC(=O)N(Cc2ccccc2)C2CCN(C)CC2)cc1 ZINC000489310442 903323611 /nfs/dbraw/zinc/32/36/11/903323611.db2.gz FRKDRPZQEGOUHM-UHFFFAOYSA-N 0 3 409.574 4.495 20 0 HIADHN CCCOCc1ccccc1CNC(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000489329124 903332825 /nfs/dbraw/zinc/33/28/25/903332825.db2.gz ITTMHYGKHFGZCH-UHFFFAOYSA-N 0 3 409.574 4.419 20 0 HIADHN COc1ccc(Cl)cc1CNC(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000489335040 903337605 /nfs/dbraw/zinc/33/76/05/903337605.db2.gz XPCHJJNADBPUHC-UHFFFAOYSA-N 0 3 401.938 4.155 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@@H](C)NCc2ccc(OC)c(Cl)c2)cc1 ZINC000489453682 903393187 /nfs/dbraw/zinc/39/31/87/903393187.db2.gz AYOAGFTVCLVXBV-OAHLLOKOSA-N 0 3 410.967 4.230 20 0 HIADHN CCSc1cccc(C(=O)NC2CCN(CCOc3ccc(F)cc3)CC2)c1 ZINC000489536456 903446404 /nfs/dbraw/zinc/44/64/04/903446404.db2.gz JBEVAKHHGLIHTA-UHFFFAOYSA-N 0 3 402.535 4.211 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)N[C@H]2CCCN(c3cccc(F)c3)C2)CC1 ZINC000489577224 903476719 /nfs/dbraw/zinc/47/67/19/903476719.db2.gz LAXXXHPLLTZGKN-QFIPXVFZSA-N 0 3 424.564 4.101 20 0 HIADHN C[C@@H](NCCCS(=O)(=O)Cc1ccccc1)c1ccc(Br)c(F)c1 ZINC000489623575 903502627 /nfs/dbraw/zinc/50/26/27/903502627.db2.gz RCKPTUUFFCVZGJ-CQSZACIVSA-N 0 3 414.340 4.244 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)NC[C@@H]2CCCO[C@@H]2C(C)(C)C)CC1 ZINC000489623178 903502933 /nfs/dbraw/zinc/50/29/33/903502933.db2.gz VPMWXYNJSCJHBB-UNMCSNQZSA-N 0 3 401.595 4.134 20 0 HIADHN Cc1cc(C(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)c(C)n1-c1nccs1 ZINC000489630232 903506486 /nfs/dbraw/zinc/50/64/86/903506486.db2.gz ZTYVZQDJFGMTMR-OAQYLSRUSA-N 0 3 408.571 4.426 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1cc(-c2ccsc2)nn1C ZINC000489710773 903552502 /nfs/dbraw/zinc/55/25/02/903552502.db2.gz FQJNUQHPYYVWHS-QGZVFWFLSA-N 0 3 409.559 4.277 20 0 HIADHN CN(Cc1ccc2ccccc2c1)C(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000489782022 903595481 /nfs/dbraw/zinc/59/54/81/903595481.db2.gz IYOKJDOWHZTJTP-UHFFFAOYSA-N 0 3 417.553 4.138 20 0 HIADHN CCN(CCNC(=O)N(Cc1ccccc1)C1CCN(C)CC1)c1cccc(C)c1 ZINC000489869192 903641568 /nfs/dbraw/zinc/64/15/68/903641568.db2.gz GPMOXSOEHOSUJZ-UHFFFAOYSA-N 0 3 408.590 4.127 20 0 HIADHN Cc1ccc([C@H]2C[C@@H](C)N(CC(=O)N3CCC(C(=O)Nc4ccccc4)CC3)C2)cc1 ZINC000490079191 903760665 /nfs/dbraw/zinc/76/06/65/903760665.db2.gz JUEFVEUGORFFEW-OFNKIYASSA-N 0 3 419.569 4.050 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](NCCCOc2ccc(F)cc2)c2ccccc2)c1 ZINC000490128818 903781825 /nfs/dbraw/zinc/78/18/25/903781825.db2.gz AHWOXLWIFHMHOB-HSZRJFAPSA-N 0 3 413.514 4.377 20 0 HIADHN CN(C)C(=O)[C@H]1CCCN1CCCN[C@H](c1ccc(F)cc1)c1ccccc1Cl ZINC000490158058 903800388 /nfs/dbraw/zinc/80/03/88/903800388.db2.gz QAEIIPGQHGVIID-FGZHOGPDSA-N 0 3 417.956 4.101 20 0 HIADHN Cc1ccc(-c2nnc([C@H](C)N3CCC(CCCN4CCOCC4)CC3)o2)cc1C ZINC000506051909 914750852 /nfs/dbraw/zinc/75/08/52/914750852.db2.gz ORTIGSSLTAIDEJ-FQEVSTJZSA-N 0 3 412.578 4.239 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](NCCc2cc(F)cc(F)c2)c2ccc(F)cc2)c1 ZINC000490171783 903809476 /nfs/dbraw/zinc/80/94/76/903809476.db2.gz IFONOWSANVGMEQ-JOCHJYFZSA-N 0 3 419.468 4.429 20 0 HIADHN CCC(CC)[C@@H](CN[C@@H](c1ccc(C)cc1)c1cccc(S(C)(=O)=O)c1)N(C)C ZINC000490191846 903818561 /nfs/dbraw/zinc/81/85/61/903818561.db2.gz XTVYMEUJSSRLLW-RPWUZVMVSA-N 0 3 416.631 4.444 20 0 HIADHN C[C@H](c1ccc(S(N)(=O)=O)cc1)N(C)Cc1ccc(-c2cccc(F)c2)s1 ZINC000506054973 914753597 /nfs/dbraw/zinc/75/35/97/914753597.db2.gz GEXQYVMSOIZCJH-CQSZACIVSA-N 0 3 404.532 4.395 20 0 HIADHN O=C(N[C@H](c1ccccc1)c1ccncc1)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000490238571 903846575 /nfs/dbraw/zinc/84/65/75/903846575.db2.gz FJKFVWNLMFBSEH-DNQXCXABSA-N 0 3 400.526 4.135 20 0 HIADHN C[C@@H]1CCC[C@@H](N(Cc2ccc(C(=O)N(C)C)[nH]2)Cc2ccc3c(c2)OCO3)[C@@H]1C ZINC000506055201 914755497 /nfs/dbraw/zinc/75/54/97/914755497.db2.gz IELLZLPYWILIFZ-CBGDNZLLSA-N 0 3 411.546 4.272 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)CCc3ncc(-c4ccc(Cl)cc4Cl)o3)[C@@H]2C1 ZINC000490273325 903867626 /nfs/dbraw/zinc/86/76/26/903867626.db2.gz MARZDLFWPHEFTC-CXAGYDPISA-N 0 3 408.329 4.134 20 0 HIADHN Cc1ccc2nc([C@@H]3CCCN3C(=O)NC[C@H](C)N3CCc4ccccc4C3)[nH]c2c1 ZINC000490303144 903891089 /nfs/dbraw/zinc/89/10/89/903891089.db2.gz ZYSQHVJXLLXLAE-MBSDFSHPSA-N 0 3 417.557 4.165 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)c3ccc(Oc4cccc(Cl)c4Cl)nc3)[C@@H]2C1 ZINC000490315621 903897079 /nfs/dbraw/zinc/89/70/79/903897079.db2.gz VESSKSHKWJCYRW-XJKSGUPXSA-N 0 3 406.313 4.347 20 0 HIADHN CCNC(=O)Nc1ccc(C)c(NC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)c1 ZINC000490351355 903944687 /nfs/dbraw/zinc/94/46/87/903944687.db2.gz BOOFVINRKCKYBW-IBGZPJMESA-N 0 3 423.561 4.265 20 0 HIADHN CCN(C(=O)c1cc(NC(=O)N(CCN(C)C)CC(C)C)ccc1Cl)C(C)C ZINC000490472154 904027566 /nfs/dbraw/zinc/02/75/66/904027566.db2.gz RGBPNXOTFCDEMR-UHFFFAOYSA-N 0 3 410.990 4.262 20 0 HIADHN O=C(Nc1ccc(-c2ccco2)cc1F)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1CO ZINC000490496209 904048303 /nfs/dbraw/zinc/04/83/03/904048303.db2.gz PHEOCFPJEMEHKY-PZJWPPBQSA-N 0 3 423.488 4.090 20 0 HIADHN O=C(Nc1cc(F)cc(Br)c1F)N1CCN(C2CCCCC2)CC1 ZINC000490521971 904071333 /nfs/dbraw/zinc/07/13/33/904071333.db2.gz WMEFTVOGFHOAQC-UHFFFAOYSA-N 0 3 402.283 4.210 20 0 HIADHN C[C@H](CN1CCCCC1)NC(=O)C(=O)Nc1ccc(Oc2cccc(Cl)c2)cc1 ZINC000490549051 904091933 /nfs/dbraw/zinc/09/19/33/904091933.db2.gz UACLFNHGRNTKFF-MRXNPFEDSA-N 0 3 415.921 4.061 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)Nc3ccc(Br)cc3C(F)(F)F)[C@H]2C1 ZINC000490547384 904092748 /nfs/dbraw/zinc/09/27/48/904092748.db2.gz RHLSCLUZKPTYOO-HZMBPMFUSA-N 0 3 406.246 4.026 20 0 HIADHN COc1ccc([C@H](CO)N(C)Cc2ccc(Br)c3cccnc23)cc1 ZINC000490569174 904106404 /nfs/dbraw/zinc/10/64/04/904106404.db2.gz PYKXYQLTUXIRJH-IBGZPJMESA-N 0 3 401.304 4.171 20 0 HIADHN COc1ccc([C@@H](CO)N(C)Cc2ccc(Br)c3cccnc23)cc1 ZINC000490569175 904107070 /nfs/dbraw/zinc/10/70/70/904107070.db2.gz PYKXYQLTUXIRJH-LJQANCHMSA-N 0 3 401.304 4.171 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)N(CC(F)F)c1ccc(F)cc1 ZINC000490629308 904145701 /nfs/dbraw/zinc/14/57/01/904145701.db2.gz MEPJERFNMQZRJM-UHFFFAOYSA-N 0 3 405.464 4.026 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)NC[C@@H]1CCCCC(F)(F)C1 ZINC000490651279 904156638 /nfs/dbraw/zinc/15/66/38/904156638.db2.gz XTAABZLETIHAMI-OAHLLOKOSA-N 0 3 403.464 4.254 20 0 HIADHN O=C1C[C@H]([C@H]2CCCCN2Cc2nc3cc(Cl)ccc3n2Cc2ccccc2)CN1 ZINC000490674243 904168093 /nfs/dbraw/zinc/16/80/93/904168093.db2.gz OLDZZZDXYCYEIB-GHTZIAJQSA-N 0 3 422.960 4.229 20 0 HIADHN O=C1C[C@H]([C@H]2CCCCN2Cc2csc(-c3ccc(Br)cc3)n2)CN1 ZINC000490674525 904168223 /nfs/dbraw/zinc/16/82/23/904168223.db2.gz NYRLWYJFBSEBRI-WMLDXEAASA-N 0 3 420.376 4.063 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)NC[C@H]3CCCCC(F)(F)C3)CC2)C[C@H](C)O1 ZINC000490716869 904189319 /nfs/dbraw/zinc/18/93/19/904189319.db2.gz CGTFLHQSGOLTTM-NSHGMRRFSA-N 0 3 415.569 4.123 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)NCCc1coc(-c2ccc(F)cc2)n1)c1ccco1 ZINC000490754320 904211256 /nfs/dbraw/zinc/21/12/56/904211256.db2.gz DMEZDOBGZCCRAM-DNVCBOLYSA-N 0 3 414.481 4.045 20 0 HIADHN CN(C)[C@@H](CNC(=O)N[C@@H](c1c[nH]c2ccccc21)C(F)(F)F)Cc1ccccc1 ZINC000490812735 904257510 /nfs/dbraw/zinc/25/75/10/904257510.db2.gz LHRXJHGJFMJMPH-UZLBHIALSA-N 0 3 418.463 4.243 20 0 HIADHN CN(C)[C@H](CNC(=O)N[C@@H](c1c[nH]c2ccccc21)C(F)(F)F)Cc1ccccc1 ZINC000490812729 904258639 /nfs/dbraw/zinc/25/86/39/904258639.db2.gz LHRXJHGJFMJMPH-JXFKEZNVSA-N 0 3 418.463 4.243 20 0 HIADHN CC(C)Cc1ccc([C@H](CNC(=O)NCCc2nnc(C(C)C)s2)N(C)C)cc1 ZINC000491074979 904412996 /nfs/dbraw/zinc/41/29/96/904412996.db2.gz BEBJVCHCTLNVJA-IBGZPJMESA-N 0 3 417.623 4.005 20 0 HIADHN COc1ccccc1-c1ncc(CNc2cccc(CN3CCSCC3)c2)cn1 ZINC000491260240 904508488 /nfs/dbraw/zinc/50/84/88/904508488.db2.gz UKPMMYUVJGJHJE-UHFFFAOYSA-N 0 3 406.555 4.313 20 0 HIADHN Cc1cccc(N2CCN(CCCN[C@H](c3ccccc3)c3ccccn3)CC2)c1 ZINC000491317644 904534529 /nfs/dbraw/zinc/53/45/29/904534529.db2.gz VZASRKPUYVFAPK-AREMUKBSSA-N 0 3 400.570 4.281 20 0 HIADHN CCCN1CCC(N[C@H](c2ccc(CC)cc2)c2cccc(S(C)(=O)=O)c2)CC1 ZINC000491341620 904546037 /nfs/dbraw/zinc/54/60/37/904546037.db2.gz FIFLCSUMAJXCKD-XMMPIXPASA-N 0 3 414.615 4.206 20 0 HIADHN Cc1nc(CCN[C@@H](c2ccc(C)cc2)c2cccc(S(C)(=O)=O)c2)cs1 ZINC000491342859 904546518 /nfs/dbraw/zinc/54/65/18/904546518.db2.gz LEYWWDHVKQNMRD-NRFANRHFSA-N 0 3 400.569 4.085 20 0 HIADHN Clc1ccc(N2CC[C@@H](NCc3cnnn3Cc3ccccc3)C2)c(Cl)c1 ZINC000491358801 904556393 /nfs/dbraw/zinc/55/63/93/904556393.db2.gz HQQVUUNHZUOWJH-QGZVFWFLSA-N 0 3 402.329 4.002 20 0 HIADHN CCCn1nc(C)c(CN2CCC[C@@H](c3nnc4ccc(C(F)(F)F)cn43)C2)c1C ZINC000506147501 914824345 /nfs/dbraw/zinc/82/43/45/914824345.db2.gz JNEGUHXTCLSPHD-MRXNPFEDSA-N 0 3 420.483 4.351 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)Nc1cc(F)c(OC(F)F)cc1F ZINC000491421659 904586299 /nfs/dbraw/zinc/58/62/99/904586299.db2.gz ZBTPQHAUHCQWDB-SJCJKPOMSA-N 0 3 411.399 4.208 20 0 HIADHN Cc1cc(NC(=O)N(CCN(C)C)Cc2ccc(Br)cc2)ccc1F ZINC000491429529 904591797 /nfs/dbraw/zinc/59/17/97/904591797.db2.gz AMKCMJOCVSJJOC-UHFFFAOYSA-N 0 3 408.315 4.492 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)NCCNc1cccc(Br)c1 ZINC000491572209 904655392 /nfs/dbraw/zinc/65/53/92/904655392.db2.gz AFTULQCQEJTBNY-UHFFFAOYSA-N 0 3 416.319 4.099 20 0 HIADHN CCN1CC[C@@H](N(C)S(=O)(=O)c2cc(Cl)ccc2OCCC2CC2)C[C@@H]1C ZINC000491587331 904663650 /nfs/dbraw/zinc/66/36/50/904663650.db2.gz WYSVYPIVESZHCL-MAUKXSAKSA-N 0 3 414.999 4.012 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)Nc2ccc(Br)cc2F)c1 ZINC000491854047 904711106 /nfs/dbraw/zinc/71/11/06/904711106.db2.gz MAUUHPGMQNPRNY-UHFFFAOYSA-N 0 3 408.315 4.492 20 0 HIADHN Cc1nn(-c2ccc(Cl)c(Cl)c2)c(NC(=O)N2CC[C@H]3CCN(C)C[C@H]32)c1C ZINC000492019234 904759008 /nfs/dbraw/zinc/75/90/08/904759008.db2.gz GYHGOSOMKHVXBW-RDTXWAMCSA-N 0 3 422.360 4.354 20 0 HIADHN C[C@H](NCc1cc(Br)c2c(c1)OCCCO2)[C@H]1OCCc2sccc21 ZINC000492021951 904763665 /nfs/dbraw/zinc/76/36/65/904763665.db2.gz HDNAHICWLRNSDU-KPZWWZAWSA-N 0 3 424.360 4.464 20 0 HIADHN Cc1cc(-c2nc3cc(F)ccc3n2C)ccc1NC(=O)N1CC[C@H]2CCN(C)C[C@@H]21 ZINC000492067497 904785291 /nfs/dbraw/zinc/78/52/91/904785291.db2.gz MAJSSDXZPAPFIA-ZHRRBRCNSA-N 0 3 421.520 4.246 20 0 HIADHN Cc1csc(Sc2ccc(NC(=O)N3CC[C@H]4CCN(C)C[C@H]43)c(C)c2)n1 ZINC000492176680 904809711 /nfs/dbraw/zinc/80/97/11/904809711.db2.gz BTZKLUFAAHFPRR-CRAIPNDOSA-N 0 3 402.589 4.469 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)c3cccc(Oc4ccncc4)c3)cc2)CC1 ZINC000492515085 904861936 /nfs/dbraw/zinc/86/19/36/904861936.db2.gz KVOJXWQLHMCGCV-UHFFFAOYSA-N 0 3 416.525 4.264 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)Nc1nc(C2CCOCC2)cs1 ZINC000492515826 904862738 /nfs/dbraw/zinc/86/27/38/904862738.db2.gz QGYXVHCNASRYRB-UHFFFAOYSA-N 0 3 422.982 4.286 20 0 HIADHN CC(C)(CNC(=O)c1cccc(Oc2ccncc2)c1)N1CCc2ccccc2C1 ZINC000492577470 904870560 /nfs/dbraw/zinc/87/05/60/904870560.db2.gz FELHNKQGKCDNLU-UHFFFAOYSA-N 0 3 401.510 4.441 20 0 HIADHN CN(Cc1c[nH]nc1-c1ccc2c(c1)OCO2)Cc1cccc(Br)c1 ZINC000506220776 914850546 /nfs/dbraw/zinc/85/05/46/914850546.db2.gz XSHDPPJMSLPTQC-UHFFFAOYSA-N 0 3 400.276 4.200 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)NCc2sc(-c3ccccc3)nc2C)cc1 ZINC000492605059 904877066 /nfs/dbraw/zinc/87/70/66/904877066.db2.gz ZCOPTKIBUBSYBK-HXUWFJFHSA-N 0 3 424.570 4.229 20 0 HIADHN CCCCCOc1ccc(C(=O)CCC(=O)N2CCC[C@@H]3CN(C)CC[C@@H]32)cc1 ZINC000492788301 904908269 /nfs/dbraw/zinc/90/82/69/904908269.db2.gz HZPLFBQMCFQSKZ-IRLDBZIGSA-N 0 3 400.563 4.161 20 0 HIADHN CCOc1ccc([C@H](NC[C@H]2CCCS(=O)(=O)C2)c2cccc(Cl)c2)cc1 ZINC000506248927 914862478 /nfs/dbraw/zinc/86/24/78/914862478.db2.gz ZEKNNWIAUXWBMY-IERDGZPVSA-N 0 3 407.963 4.243 20 0 HIADHN Cc1ccc([C@@H](NC[C@H](CO)c2ccccc2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000493128523 905026654 /nfs/dbraw/zinc/02/66/54/905026654.db2.gz JVFGEJZOXAEACQ-RDGATRHJSA-N 0 3 423.578 4.162 20 0 HIADHN CCC[C@@H](CCO)CN[C@@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000493177306 905040883 /nfs/dbraw/zinc/04/08/83/905040883.db2.gz PVDKJNLZMQVOGG-KKSFZXQISA-N 0 3 409.979 4.221 20 0 HIADHN CNC(=O)C1CCN(Cc2cn(-c3ccccc3)nc2-c2cccc(Cl)c2)CC1 ZINC000506260611 914869728 /nfs/dbraw/zinc/86/97/28/914869728.db2.gz XPQBTWKLWBZQFO-UHFFFAOYSA-N 0 3 408.933 4.151 20 0 HIADHN COCCC1(CN[C@H](c2ccc(F)cc2)c2cccc(S(C)(=O)=O)c2)CCC1 ZINC000493252781 905070002 /nfs/dbraw/zinc/07/00/02/905070002.db2.gz WMRXGNWOMHSUGT-OAQYLSRUSA-N 0 3 405.535 4.115 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)c3cccc(Oc4ccc(Cl)c(Cl)c4)n3)[C@H]2C1 ZINC000493345453 905093413 /nfs/dbraw/zinc/09/34/13/905093413.db2.gz XVGYSYXDVCYMAB-UGSOOPFHSA-N 0 3 406.313 4.347 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)c3ccc(Oc4ccc(C(F)(F)F)cn4)cc3)[C@H]2C1 ZINC000493558000 905161144 /nfs/dbraw/zinc/16/11/44/905161144.db2.gz SNODRDHFBYBPFH-KSSFIOAISA-N 0 3 405.420 4.059 20 0 HIADHN COc1c(C)cnc(CN2CCC[C@@H](c3nnc4ccc(C(F)(F)F)cn43)C2)c1C ZINC000493637090 905179256 /nfs/dbraw/zinc/17/92/56/905179256.db2.gz VDBKYRAWGYUWGA-OAHLLOKOSA-N 0 3 419.451 4.148 20 0 HIADHN C[C@@H](NCc1ccc(N2C[C@@H](C)O[C@@H](C)C2)nc1)c1cc(Br)cs1 ZINC000493735437 905206131 /nfs/dbraw/zinc/20/61/31/905206131.db2.gz HURZLFFSFAVBOU-HZSPNIEDSA-N 0 3 410.381 4.370 20 0 HIADHN CCN1CCN(CCNC(=O)c2ccc(-c3ccc(Cl)c(Cl)c3)s2)CC1 ZINC000493822648 905227776 /nfs/dbraw/zinc/22/77/76/905227776.db2.gz RMQAKESOURKRAM-UHFFFAOYSA-N 0 3 412.386 4.089 20 0 HIADHN CC(C)Cc1noc(-c2cc(Cl)ccc2NC(=O)N2CC[C@@H]3CCN(C)C[C@H]32)n1 ZINC000493835885 905229242 /nfs/dbraw/zinc/22/92/42/905229242.db2.gz NUALEXCUJOZNRE-KBXCAEBGSA-N 0 3 417.941 4.146 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](N[C@@H]2CCc3ccccc3OC2)c2ccccc2)c1 ZINC000493892638 905250710 /nfs/dbraw/zinc/25/07/10/905250710.db2.gz XUWIGRSQHZMFSS-QPPBQGQZSA-N 0 3 407.535 4.163 20 0 HIADHN O=C(CCCc1ccc(Br)s1)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000493919215 905269252 /nfs/dbraw/zinc/26/92/52/905269252.db2.gz DFCGRXCSFMILAC-MRXNPFEDSA-N 0 3 407.377 4.224 20 0 HIADHN Cc1cc(NC(=O)N2CC[C@H]3CCN(C)C[C@@H]32)nn1-c1ccc(Cl)c(Cl)c1 ZINC000493984638 905327885 /nfs/dbraw/zinc/32/78/85/905327885.db2.gz UHZIKNPABFYSQR-DYVFJYSZSA-N 0 3 408.333 4.045 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](N[C@@H]2CCOC3(CCC3)C2)c2ccc(F)cc2)c1 ZINC000494003658 905343501 /nfs/dbraw/zinc/34/35/01/905343501.db2.gz KRVXOMFXHMODIY-TZIWHRDSSA-N 0 3 403.519 4.010 20 0 HIADHN C[C@@H]1[C@H](NC(=O)Cc2nc(-c3ccc(F)cc3)cs2)CCN1Cc1ccccc1 ZINC000494007221 905347697 /nfs/dbraw/zinc/34/76/97/905347697.db2.gz PBXGGITYCKIBRJ-OXQOHEQNSA-N 0 3 409.530 4.271 20 0 HIADHN C[C@H]1[C@@H](NC(=O)Cc2nc(-c3ccc(F)cc3)cs2)CCN1Cc1ccccc1 ZINC000494007219 905347832 /nfs/dbraw/zinc/34/78/32/905347832.db2.gz PBXGGITYCKIBRJ-JXFKEZNVSA-N 0 3 409.530 4.271 20 0 HIADHN O=S(=O)(C1CC1)N1CCC(N[C@@H](c2ccc(F)cc2)c2ccccc2Cl)CC1 ZINC000494021496 905362967 /nfs/dbraw/zinc/36/29/67/905362967.db2.gz XDSHXKJNSUNNLS-NRFANRHFSA-N 0 3 422.953 4.115 20 0 HIADHN CSc1nc(-c2ccco2)nc(C)c1C(=O)N[C@H]1CCN(Cc2ccccc2)[C@@H]1C ZINC000494025532 905365223 /nfs/dbraw/zinc/36/52/23/905365223.db2.gz CMELWKFVXBLQIQ-AEFFLSMTSA-N 0 3 422.554 4.160 20 0 HIADHN C[C@H]1[C@@H](NC(=O)c2ccc(OCc3ccncc3)cc2)CCN1Cc1ccccc1 ZINC000494027404 905367716 /nfs/dbraw/zinc/36/77/16/905367716.db2.gz MLECDKPOFNZKNH-CYFREDJKSA-N 0 3 401.510 4.053 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)c2cn(C)nc2-c2ccccc2Cl)CCN1Cc1ccccc1 ZINC000494035760 905374509 /nfs/dbraw/zinc/37/45/09/905374509.db2.gz BCVZSOUELUSTTB-IERDGZPVSA-N 0 3 408.933 4.133 20 0 HIADHN C[C@@H]1[C@H](NC(=O)[C@H]2CCn3c(cnc3C3CCCCC3)C2)CCN1Cc1ccccc1 ZINC000494039993 905381588 /nfs/dbraw/zinc/38/15/88/905381588.db2.gz WEZBRWFRHUXUEY-WNOPAQSVSA-N 0 3 420.601 4.272 20 0 HIADHN O[C@H](CN[C@H](c1ccc(Cl)cc1)c1ccc(OC(F)F)cc1)C1CCOCC1 ZINC000494050805 905388381 /nfs/dbraw/zinc/38/83/81/905388381.db2.gz TWFSPTAKDYJCMW-WOJBJXKFSA-N 0 3 411.876 4.408 20 0 HIADHN COCc1nc(C(=O)N[C@@H]2CCN(Cc3ccccc3)[C@H]2C)c(-c2ccccc2)s1 ZINC000494051309 905390714 /nfs/dbraw/zinc/39/07/14/905390714.db2.gz UNIUVXOHVDHTDE-FXAWDEMLSA-N 0 3 421.566 4.349 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)C(C)(C)Cc3ccccc3OC)cc2)CC1 ZINC000494065593 905401243 /nfs/dbraw/zinc/40/12/43/905401243.db2.gz KRMLKHPYNXTXND-UHFFFAOYSA-N 0 3 409.574 4.040 20 0 HIADHN C[C@H](NC(=O)NC[C@H](c1cccs1)N1CCCC1)c1nc(C(F)(F)F)cs1 ZINC000494219163 905549089 /nfs/dbraw/zinc/54/90/89/905549089.db2.gz HVMVUHPSEFXVMQ-NWDGAFQWSA-N 0 3 418.510 4.421 20 0 HIADHN CCN1CCN(Cc2ccc(CNC(=O)C[C@H](C)c3c[nH]c4ccccc43)cc2)CC1 ZINC000494335659 905644834 /nfs/dbraw/zinc/64/48/34/905644834.db2.gz XHNRLNHZTWJTNL-FQEVSTJZSA-N 0 3 418.585 4.115 20 0 HIADHN Cc1nn(-c2ccccc2)c(Oc2cccc(F)c2)c1CN[C@H]1CCn2ccnc2C1 ZINC000494389751 905686262 /nfs/dbraw/zinc/68/62/62/905686262.db2.gz DMMJXMQJVZPXKA-IBGZPJMESA-N 0 3 417.488 4.413 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)N1CCC[C@H]1CCC1CCCC1 ZINC000494417828 905705320 /nfs/dbraw/zinc/70/53/20/905705320.db2.gz NDTIGAPCAINVEN-QHCPKHFHSA-N 0 3 413.606 4.288 20 0 HIADHN O[C@H](CCc1ccccc1)CNCc1cnn(Cc2ccc(C(F)(F)F)cc2)c1 ZINC000494432166 905719139 /nfs/dbraw/zinc/71/91/39/905719139.db2.gz SGGNUWGGQASTRP-OAQYLSRUSA-N 0 3 403.448 4.034 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)c(C)c1CN1CCC[C@@H](CNC(=O)C(C)C)C1 ZINC000512458101 921174176 /nfs/dbraw/zinc/17/41/76/921174176.db2.gz XRMNZTGBRKSZPR-SFHVURJKSA-N 0 3 402.970 4.127 20 0 HIADHN Cc1nc(COc2ccc(CN3CCC[C@@H](CNC(=O)C(C)C)C3)cc2)cs1 ZINC000512458328 921174633 /nfs/dbraw/zinc/17/46/33/921174633.db2.gz ZLBZXBAIHWVVQF-IBGZPJMESA-N 0 3 401.576 4.015 20 0 HIADHN Cc1ccc(NC(=O)NC(=O)[C@H](C)N[C@@H]2CCO[C@@H]2c2ccc(Cl)cc2)c(C)c1 ZINC000494493168 905778971 /nfs/dbraw/zinc/77/89/71/905778971.db2.gz HZVNNNXYJPMCSD-CWFSZBLJSA-N 0 3 415.921 4.113 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N(C)Cc1cccc2[nH]ccc21)c1cccc(OC)c1 ZINC000494561972 905837373 /nfs/dbraw/zinc/83/73/73/905837373.db2.gz KHWIOMGGBRFJFF-HSZRJFAPSA-N 0 3 408.546 4.401 20 0 HIADHN FC(F)(F)c1ccc(Cn2cc(CNCc3ccccc3-n3ccnc3)cn2)cc1 ZINC000494575300 905843464 /nfs/dbraw/zinc/84/34/64/905843464.db2.gz CCGZKQXFBBSULZ-UHFFFAOYSA-N 0 3 411.431 4.426 20 0 HIADHN CC(C)c1ccc(O[C@@H](C)CNC(=O)N(C)C[C@@H]2CCN(C)[C@H]2c2cccnc2)cc1 ZINC000512472292 921183976 /nfs/dbraw/zinc/18/39/76/921183976.db2.gz UABHPRRWXBCGHO-APTRMMRNSA-N 0 3 424.589 4.307 20 0 HIADHN Cc1cc(NC(=O)c2ccc(CN3CCC(CO)CC3)cc2)c2cccnc2c1C ZINC000494628809 905871728 /nfs/dbraw/zinc/87/17/28/905871728.db2.gz ALVZNDJNUXVUIH-UHFFFAOYSA-N 0 3 403.526 4.308 20 0 HIADHN COC[C@@H](NC(=O)N[C@@H](CN1CCCC1)c1ccccc1)c1ccc(Cl)cc1 ZINC000494719176 905922193 /nfs/dbraw/zinc/92/21/93/905922193.db2.gz KQXYOEWVJMGWEA-LEWJYISDSA-N 0 3 401.938 4.164 20 0 HIADHN O=C(Nc1nc2cc(F)c(F)cc2s1)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000494740270 905940305 /nfs/dbraw/zinc/94/03/05/905940305.db2.gz YGJSTOSCSUODCR-UHFFFAOYSA-N 0 3 417.481 4.031 20 0 HIADHN C[C@@H](CC(=O)N(CCN(C)C)Cc1cccc(O)c1)c1ccccc1C(F)(F)F ZINC000494771991 905969685 /nfs/dbraw/zinc/96/96/85/905969685.db2.gz JQGHMDGNWTYDIB-INIZCTEOSA-N 0 3 408.464 4.495 20 0 HIADHN COC(=O)c1cn(C2CCN(Cc3sc4c(cccc4Cl)c3C)CC2)nn1 ZINC000512495364 921200211 /nfs/dbraw/zinc/20/02/11/921200211.db2.gz AVTZMPMYQNPQBI-UHFFFAOYSA-N 0 3 404.923 4.078 20 0 HIADHN Cc1cccn(Cc2c(F)cccc2NC(=O)c2cccc(CN3CCCC3)c2)c1=O ZINC000494790387 905992114 /nfs/dbraw/zinc/99/21/14/905992114.db2.gz KKVBFZQHIDIMKO-UHFFFAOYSA-N 0 3 419.500 4.192 20 0 HIADHN Cc1cccc(-c2cccc(CNC(=O)N3CCN(C4CCOCC4)C[C@H]3C)c2)c1 ZINC000494898397 906072278 /nfs/dbraw/zinc/07/22/78/906072278.db2.gz REEPUNYPGDOMSW-HXUWFJFHSA-N 0 3 407.558 4.057 20 0 HIADHN C[C@H](NC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1)[C@@H]1OCCc2sccc21 ZINC000494938656 906108672 /nfs/dbraw/zinc/10/86/72/906108672.db2.gz PMJZWCZIHJRFKO-FGSXEWAUSA-N 0 3 413.587 4.056 20 0 HIADHN O=C(CN[C@H](C[C@H]1CCOC1)c1ccc(F)cc1)Nc1cccc(Br)c1 ZINC000494956023 906127287 /nfs/dbraw/zinc/12/72/87/906127287.db2.gz IIDJZQGAGVJWLN-AUUYWEPGSA-N 0 3 421.310 4.284 20 0 HIADHN CCC(CC)(CO)CN[C@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000494967030 906135768 /nfs/dbraw/zinc/13/57/68/906135768.db2.gz DMEAUBRNMSYNJS-HXUWFJFHSA-N 0 3 409.979 4.221 20 0 HIADHN O=C1CCCCN1CC1CCN(Cc2c[nH]nc2-c2ccc(C(F)(F)F)cc2)CC1 ZINC000494989948 906153682 /nfs/dbraw/zinc/15/36/82/906153682.db2.gz ACSQAVAQHOMDLB-UHFFFAOYSA-N 0 3 420.479 4.320 20 0 HIADHN CC(C)C(=O)NCCCN[C@@H](c1ccc(Br)cc1)c1ccccc1F ZINC000495025063 906182900 /nfs/dbraw/zinc/18/29/00/906182900.db2.gz GMTUYWAHBBVEEG-IBGZPJMESA-N 0 3 407.327 4.430 20 0 HIADHN CNC(=O)[C@@H]1CCC[C@@H]1N[C@H](c1cccc(F)c1)c1cccc(Br)c1 ZINC000495049122 906203082 /nfs/dbraw/zinc/20/30/82/906203082.db2.gz OGNSCBYEALIHRM-QYZOEREBSA-N 0 3 405.311 4.182 20 0 HIADHN c1nnc([C@@H](NCc2cn(-c3ccccc3)nc2-c2ccncc2)C2CCCCC2)[nH]1 ZINC000495049503 906204375 /nfs/dbraw/zinc/20/43/75/906204375.db2.gz SRDDDIGIYPQRJT-QHCPKHFHSA-N 0 3 413.529 4.464 20 0 HIADHN CNC(=O)[C@@H]1CCC[C@H]1N[C@@H](c1cccc(F)c1)c1cccc(Br)c1 ZINC000495049118 906204419 /nfs/dbraw/zinc/20/44/19/906204419.db2.gz OGNSCBYEALIHRM-GUDVDZBRSA-N 0 3 405.311 4.182 20 0 HIADHN CCN(C(=O)c1ccc2c(c1)C(C)(C)C(=O)N2)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000495060098 906212213 /nfs/dbraw/zinc/21/22/13/906212213.db2.gz PTPIJTLXFWMKQO-YLJYHZDGSA-N 0 3 405.542 4.214 20 0 HIADHN CN(C)Cc1cnc(CNCC2(c3ccc(Br)s3)CCC2)s1 ZINC000512537237 921222379 /nfs/dbraw/zinc/22/23/79/921222379.db2.gz PEZPMRPEWBDAOF-UHFFFAOYSA-N 0 3 400.411 4.240 20 0 HIADHN C[C@@H](NC(=O)NC[C@H]1CCCN1Cc1ccccc1)c1nc(C(F)(F)F)cs1 ZINC000495205596 906306853 /nfs/dbraw/zinc/30/68/53/906306853.db2.gz UKDZPEDHUSXLOZ-UKRRQHHQSA-N 0 3 412.481 4.187 20 0 HIADHN CC(C)C[C@@H](NC(=O)N1CCN(C2CCOCC2)C[C@@H]1C)c1ccc(Cl)cc1 ZINC000495253971 906342564 /nfs/dbraw/zinc/34/25/64/906342564.db2.gz XELSIIRNSWLAGP-LAUBAEHRSA-N 0 3 407.986 4.322 20 0 HIADHN Clc1cccc([C@@H](Cc2cccnc2)NCc2ccc(N3CCOCC3)nc2)c1 ZINC000495258313 906345986 /nfs/dbraw/zinc/34/59/86/906345986.db2.gz ALKOYIXROAHJBA-JOCHJYFZSA-N 0 3 408.933 4.040 20 0 HIADHN Cc1c2ccc(F)cc2sc1C(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000495330838 906381457 /nfs/dbraw/zinc/38/14/57/906381457.db2.gz CTTIWMGHHYQMJH-HUUCEWRRSA-N 0 3 404.551 4.310 20 0 HIADHN CC[C@@H](CNC(=O)c1ccc(OCC(F)(F)F)cc1)N1CCc2ccccc2C1 ZINC000495345210 906390338 /nfs/dbraw/zinc/39/03/38/906390338.db2.gz LPHWFPBWQABDJF-IBGZPJMESA-N 0 3 406.448 4.194 20 0 HIADHN COCC[C@H](N[C@H](C)CC(=O)Nc1cccc(Br)c1)c1ccc(C)o1 ZINC000495400892 906428744 /nfs/dbraw/zinc/42/87/44/906428744.db2.gz GUWFKJQXTRVSJD-DYVFJYSZSA-N 0 3 409.324 4.435 20 0 HIADHN COCC[C@H](N[C@@H](C)CC(=O)Nc1cccc(Br)c1)c1ccc(C)o1 ZINC000495400893 906429011 /nfs/dbraw/zinc/42/90/11/906429011.db2.gz GUWFKJQXTRVSJD-GUYCJALGSA-N 0 3 409.324 4.435 20 0 HIADHN Cc1ccc2nc(-c3ccc(NC(=O)[C@@H](C)N[C@H](C)Cn4cccn4)cc3)sc2c1 ZINC000495470400 906470392 /nfs/dbraw/zinc/47/03/92/906470392.db2.gz NTOAFCPJMYQKNH-IAGOWNOFSA-N 0 3 419.554 4.474 20 0 HIADHN O=C(c1cccc(CN[C@@H](Cc2ccccc2)c2ccccc2)c1)N1CCOCC1 ZINC000495501014 906490373 /nfs/dbraw/zinc/49/03/73/906490373.db2.gz CKFFKDNDZAMOEJ-VWLOTQADSA-N 0 3 400.522 4.233 20 0 HIADHN CC(C)N(CCN(C)C)C(=O)c1ccc(Oc2ccc(Br)cc2)nc1 ZINC000495861904 906565261 /nfs/dbraw/zinc/56/52/61/906565261.db2.gz DHDFPVFJZKAQPX-UHFFFAOYSA-N 0 3 406.324 4.049 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)c1nc(C2CC2)n(-c2ccccc2Cl)n1 ZINC000496000111 906594731 /nfs/dbraw/zinc/59/47/31/906594731.db2.gz PWSHETXPTANUEJ-UHFFFAOYSA-N 0 3 423.948 4.002 20 0 HIADHN CSCC[C@H](N)C(=O)N(C)Cc1cn(-c2ccccc2)nc1-c1ccc(C)c(C)c1 ZINC000496248779 906640532 /nfs/dbraw/zinc/64/05/32/906640532.db2.gz XKYPPEQBXQYDBW-QFIPXVFZSA-N 0 3 422.598 4.195 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)CCC(=O)c1cc(C)ccc1C ZINC000496273198 906644739 /nfs/dbraw/zinc/64/47/39/906644739.db2.gz RHAAUXDNKQLYJR-JOCHJYFZSA-N 0 3 407.558 4.174 20 0 HIADHN CCOc1cc(CN2CCC(C(=O)Nc3ccc(O)cc3)CC2)ccc1OC(F)F ZINC000512600559 921255917 /nfs/dbraw/zinc/25/59/17/921255917.db2.gz XDKHJWITELLTMK-UHFFFAOYSA-N 0 3 420.456 4.243 20 0 HIADHN Cc1ccc(C)n1C1CCN(C(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)CC1 ZINC000512607765 921258547 /nfs/dbraw/zinc/25/85/47/921258547.db2.gz MORHUUYZYZHINC-UHFFFAOYSA-N 0 3 408.590 4.113 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)N[C@@H]2CCOc3ccc(F)cc32)N(C)C)cc1 ZINC000496689556 906735593 /nfs/dbraw/zinc/73/55/93/906735593.db2.gz LZIIJXLAZLLTRT-NHCUHLMSSA-N 0 3 415.509 4.039 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1cnn(C)c1-c1ccccc1 ZINC000496705149 906738162 /nfs/dbraw/zinc/73/81/62/906738162.db2.gz BDSRABLYAHQSAU-LJQANCHMSA-N 0 3 403.530 4.215 20 0 HIADHN O=C(c1cc(-c2ccncc2)on1)N(CCN1CCCC1)Cc1ccc(Cl)cc1 ZINC000496818175 906762164 /nfs/dbraw/zinc/76/21/64/906762164.db2.gz QRXGVOBURJQXFF-UHFFFAOYSA-N 0 3 410.905 4.128 20 0 HIADHN C[C@H]1CCN(C(=O)Nc2cnn(C)c2-c2ccccc2)CCN1Cc1ccccc1 ZINC000496882168 906774481 /nfs/dbraw/zinc/77/44/81/906774481.db2.gz LWLKRRUJIVCCCS-IBGZPJMESA-N 0 3 403.530 4.215 20 0 HIADHN CC(C)c1cc(C(=O)NC[C@H](Cc2ccccc2)N(C)C)c2cnn(C(C)C)c2n1 ZINC000497067848 906800340 /nfs/dbraw/zinc/80/03/40/906800340.db2.gz VYVLLAIGQGOEMF-IBGZPJMESA-N 0 3 407.562 4.038 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)c1ccc(Cl)c(Br)c1 ZINC000512631486 921268444 /nfs/dbraw/zinc/26/84/44/921268444.db2.gz XANZTLFQNDVHGB-UHFFFAOYSA-N 0 3 423.738 4.312 20 0 HIADHN C[C@H](c1ccc2ccccc2c1)N1CCC(N(CC(F)(F)F)S(C)(=O)=O)CC1 ZINC000497359112 906851978 /nfs/dbraw/zinc/85/19/78/906851978.db2.gz AAKSOHOKTQNKKH-OAHLLOKOSA-N 0 3 414.493 4.189 20 0 HIADHN CCCOc1c(Cl)cc(C(=O)N(Cc2ccco2)C2CCN(C)CC2)cc1OC ZINC000497362285 906853838 /nfs/dbraw/zinc/85/38/38/906853838.db2.gz KGNQUTCJYDQYCJ-UHFFFAOYSA-N 0 3 420.937 4.467 20 0 HIADHN CCCN1CCN(c2ccccc2CNc2ccc(C(=O)N(CC)CC)cc2)CC1 ZINC000512647484 921273320 /nfs/dbraw/zinc/27/33/20/921273320.db2.gz DQJDAXPUUPPWMA-UHFFFAOYSA-N 0 3 408.590 4.313 20 0 HIADHN CCCOc1ccc(CC(=O)N[C@@H]2CN(C)C[C@H]2c2ccccc2)cc1OCCC ZINC000497415942 906891046 /nfs/dbraw/zinc/89/10/46/906891046.db2.gz JEOJMOJOAVAFGA-FCHUYYIVSA-N 0 3 410.558 4.021 20 0 HIADHN COc1ccc(CCCN(C)[C@H](C)C(=O)N(C)Cc2nc3ccccc3s2)cc1 ZINC000497457856 906934176 /nfs/dbraw/zinc/93/41/76/906934176.db2.gz CANRTAMWLAKEJY-QGZVFWFLSA-N 0 3 411.571 4.216 20 0 HIADHN O=C([C@H]1CCCN(Cc2cccc(F)c2)C1)N1CCC(OC2CCCCC2)CC1 ZINC000497474535 906955555 /nfs/dbraw/zinc/95/55/55/906955555.db2.gz VXWGSKNHTJDRCV-FQEVSTJZSA-N 0 3 402.554 4.378 20 0 HIADHN Cc1nc2ccccc2n1CCC(=O)NCC1CCN(Cc2ccccc2Cl)CC1 ZINC000497487541 906969504 /nfs/dbraw/zinc/96/95/04/906969504.db2.gz HHYQGEOGTIHNAE-UHFFFAOYSA-N 0 3 424.976 4.417 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)NCc3csc(-c4ccc(C(F)(F)F)cc4)n3)[C@H]2C1 ZINC000497511073 907000762 /nfs/dbraw/zinc/00/07/62/907000762.db2.gz WKLYUOFUIIEYIY-DYVFJYSZSA-N 0 3 424.492 4.065 20 0 HIADHN COc1ccc(C[C@H](NCc2cccc(C(=O)N(C)C)c2)c2ccc(OC)cc2)cc1 ZINC000497587831 907069458 /nfs/dbraw/zinc/06/94/58/907069458.db2.gz WXQARQOPCTTYND-VWLOTQADSA-N 0 3 418.537 4.479 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)c1csc(Cc2ccccc2)n1 ZINC000512703984 921292367 /nfs/dbraw/zinc/29/23/67/921292367.db2.gz JWJJTJFNOFKNAD-NRFANRHFSA-N 0 3 420.582 4.256 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)c2cc3ccc(Br)cc3[nH]2)C1 ZINC000512704254 921292956 /nfs/dbraw/zinc/29/29/56/921292956.db2.gz YFZUJRVENYVCDT-KDOFPFPSSA-N 0 3 412.331 4.496 20 0 HIADHN COc1cccc([C@H]2CCCN2C[C@@H](O)COc2cccc(Br)c2)c1 ZINC000497611694 907088771 /nfs/dbraw/zinc/08/87/71/907088771.db2.gz PHAFTJCOTNMOHE-YLJYHZDGSA-N 0 3 406.320 4.035 20 0 HIADHN Cc1ccc(C[C@@H](NC(=O)N[C@@H](CN(C)C)c2ccc(F)cc2)c2ccccn2)cc1 ZINC000497635201 907117549 /nfs/dbraw/zinc/11/75/49/907117549.db2.gz XYSAHUQKLDXZSO-RPWUZVMVSA-N 0 3 420.532 4.415 20 0 HIADHN Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)NC(=O)N1CC[C@H]2CCN(C)C[C@@H]21 ZINC000497635898 907120639 /nfs/dbraw/zinc/12/06/39/907120639.db2.gz CHTQXQIIAFWMJM-DAYGRLMNSA-N 0 3 402.539 4.054 20 0 HIADHN CC(C)Cn1ncc(NC(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)c1C1CC1 ZINC000497659238 907150313 /nfs/dbraw/zinc/15/03/13/907150313.db2.gz CHMIPJVHLOEWOE-IBGZPJMESA-N 0 3 403.958 4.494 20 0 HIADHN Cc1ccccc1[C@H](NC(=O)N(C)CCCN1CCN(C)CC1)[C@@H]1CCC[C@H](C)C1 ZINC000497666829 907161490 /nfs/dbraw/zinc/16/14/90/907161490.db2.gz ABAWJVBVPIBCEP-BGWNEDDSSA-N 0 3 414.638 4.141 20 0 HIADHN COc1cccc([C@@H](CNC(=O)CCCOc2ccc(F)cc2F)N2CCCC2)c1 ZINC000497694691 907199257 /nfs/dbraw/zinc/19/92/57/907199257.db2.gz YFYJNOCBUZQUSQ-OAQYLSRUSA-N 0 3 418.484 4.086 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)N[C@H](C)c2ncc(-c3ccccc3)o2)cc1 ZINC000497697521 907201914 /nfs/dbraw/zinc/20/19/14/907201914.db2.gz QPNHIFXKJFGSCQ-UZLBHIALSA-N 0 3 408.502 4.013 20 0 HIADHN COc1ccc(-c2cnc(CCC(=O)N[C@@H](CN3CCCC3)c3ccccc3)o2)cc1 ZINC000497724526 907223256 /nfs/dbraw/zinc/22/32/56/907223256.db2.gz WUFBFDPJFJFGBM-QFIPXVFZSA-N 0 3 419.525 4.236 20 0 HIADHN O[C@H](COCc1ccccc1Cl)CN(Cc1cccc(F)c1)C[C@@H]1CCCO1 ZINC000497739167 907233521 /nfs/dbraw/zinc/23/35/21/907233521.db2.gz KWCIYMGFCJMSPR-SFTDATJTSA-N 0 3 407.913 4.038 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)C1(c2ccccc2C)CCOCC1)c1cccc(OC)c1 ZINC000497764680 907255543 /nfs/dbraw/zinc/25/55/43/907255543.db2.gz MOXAMALGFOXBQF-DEOSSOPVSA-N 0 3 424.585 4.251 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)N(C)[C@H](c2ccccc2)C(C)C)CC1 ZINC000497776809 907271209 /nfs/dbraw/zinc/27/12/09/907271209.db2.gz STRJICXAFCKUOK-VWLOTQADSA-N 0 3 422.617 4.363 20 0 HIADHN CCc1ccc([C@H](CNC(=O)C2(c3ccc(Cl)cc3)CCOCC2)N(C)C)cc1 ZINC000497814081 907300053 /nfs/dbraw/zinc/30/00/53/907300053.db2.gz CBXITGNLXKZWRE-QFIPXVFZSA-N 0 3 414.977 4.370 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)C2(c3cccc(Cl)c3)CCOCC2)N(C)C)cc1 ZINC000497815706 907300614 /nfs/dbraw/zinc/30/06/14/907300614.db2.gz VXLPBILWZUYOTH-JOCHJYFZSA-N 0 3 414.977 4.370 20 0 HIADHN CC[C@@H](C)CCC(=O)NC1CCN(CCOc2ccc(Br)cc2)CC1 ZINC000512794180 921312787 /nfs/dbraw/zinc/31/27/87/921312787.db2.gz XSXYOYKUDXYQEK-MRXNPFEDSA-N 0 3 411.384 4.235 20 0 HIADHN COc1cccc(COc2cccc(Cl)c2CNCCCN2CCCC2=O)c1 ZINC000512800313 921314048 /nfs/dbraw/zinc/31/40/48/921314048.db2.gz ZXVUCXPBPCUSLC-UHFFFAOYSA-N 0 3 402.922 4.030 20 0 HIADHN CCN(Cc1ccc(OC)cc1)C(=O)NC[C@H](c1ccc(OC(C)C)cc1)N(C)C ZINC000512806572 921315237 /nfs/dbraw/zinc/31/52/37/921315237.db2.gz AJCSXNZEEFXTLF-HSZRJFAPSA-N 0 3 413.562 4.317 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1ccc(Cl)c2ncccc12 ZINC000512810510 921316732 /nfs/dbraw/zinc/31/67/32/921316732.db2.gz SEFPWDPMUGSTJK-UHFFFAOYSA-N 0 3 411.855 4.423 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)N2CC[C@H](C(F)(F)F)[C@H]2C)N(C)C)cc1 ZINC000512809807 921316956 /nfs/dbraw/zinc/31/69/56/921316956.db2.gz WGFIKCZTWMTPFE-JLSDUUJJSA-N 0 3 401.473 4.059 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)c1ccnc2ccccc21 ZINC000497891882 907364055 /nfs/dbraw/zinc/36/40/55/907364055.db2.gz RUWIBZKCBCESEV-UHFFFAOYSA-N 0 3 401.432 4.458 20 0 HIADHN CCCCN1C(=O)C[C@@H](C(=O)Nc2cccc(CN(C)C)c2)[C@@H]1c1ccc(OC)cc1 ZINC000497972268 907443519 /nfs/dbraw/zinc/44/35/19/907443519.db2.gz XTSCFQCNPYNYFI-VWNXMTODSA-N 0 3 423.557 4.085 20 0 HIADHN C[C@H](NC(=O)CC1CCCCC1)C(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1 ZINC000497993400 907472219 /nfs/dbraw/zinc/47/22/19/907472219.db2.gz NRIDPKUFUJUDAR-ICSRJNTNSA-N 0 3 419.635 4.112 20 0 HIADHN COc1ccc([C@@H](CNC(=O)Cn2ccc3ccc(Cl)cc32)N2CCCC2)cc1 ZINC000497996974 907478890 /nfs/dbraw/zinc/47/88/90/907478890.db2.gz WEULWCPDSUUAEO-JOCHJYFZSA-N 0 3 411.933 4.257 20 0 HIADHN C[C@@H](C(=O)Nc1ccc(OC(F)(F)F)cc1)N1CCN(CC2CCCCC2)CC1 ZINC000497999029 907481467 /nfs/dbraw/zinc/48/14/67/907481467.db2.gz RLWYETHXWUHQPA-INIZCTEOSA-N 0 3 413.484 4.110 20 0 HIADHN CC1CCN([C@H](CNC(=O)Cc2ccc(-n3cccn3)cc2)c2cccs2)CC1 ZINC000498004181 907489435 /nfs/dbraw/zinc/48/94/35/907489435.db2.gz CUYVVEPVWURMRD-OAQYLSRUSA-N 0 3 408.571 4.066 20 0 HIADHN Cc1cc(N2CCSCC2)ccc1NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000498013263 907506612 /nfs/dbraw/zinc/50/66/12/907506612.db2.gz NOHRUGISKXARQG-OAQYLSRUSA-N 0 3 424.614 4.334 20 0 HIADHN CCN(C(=O)c1cnn(-c2ccccc2)c1C)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000498022471 907521231 /nfs/dbraw/zinc/52/12/31/907521231.db2.gz MOPDGIPKXNMDNJ-XXBNENTESA-N 0 3 402.542 4.478 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)NCc1ccnc(N2CCCCCC2)c1 ZINC000498054914 907565500 /nfs/dbraw/zinc/56/55/00/907565500.db2.gz NONSQIFBCRVRAZ-UHFFFAOYSA-N 0 3 406.530 4.200 20 0 HIADHN CC1CCN([C@H](CNC(=O)NCc2ncc(C(C)(C)C)o2)c2cccs2)CC1 ZINC000498125931 907642455 /nfs/dbraw/zinc/64/24/55/907642455.db2.gz IKJPQRVDOHDEDK-MRXNPFEDSA-N 0 3 404.580 4.306 20 0 HIADHN C[C@H](NC(=O)Nc1ccc(OCc2cccc(F)c2)c(F)c1)C1=CCN(C)CC1 ZINC000512838595 921342358 /nfs/dbraw/zinc/34/23/58/921342358.db2.gz ODPUSFJTDIXZQA-HNNXBMFYSA-N 0 3 401.457 4.316 20 0 HIADHN CCOc1ccc([C@@H](C)NC(=O)CCCNCc2nc3c(s2)C[C@H](C)CC3)cc1 ZINC000498349554 907851951 /nfs/dbraw/zinc/85/19/51/907851951.db2.gz FIECEEQLGOEKQE-IAGOWNOFSA-N 0 3 415.603 4.414 20 0 HIADHN CC[C@H](NCc1ccc(Br)c(Br)c1)[C@H](O)C(F)(F)F ZINC000498352847 907853684 /nfs/dbraw/zinc/85/36/84/907853684.db2.gz IVDQZVVEFXVEJJ-QWRGUYRKSA-N 0 3 405.052 4.003 20 0 HIADHN CNC(=O)[C@H]1CCC[C@@H]1NCc1cc(Br)ccc1OCc1ccccc1 ZINC000498376359 907865976 /nfs/dbraw/zinc/86/59/76/907865976.db2.gz SJVCFTYJBGDSTD-OALUTQOASA-N 0 3 417.347 4.032 20 0 HIADHN CC(C)(C)[C@@H](NCc1ccc([C@]2(C)NC(=O)NC2=O)cc1)c1cc2ccccc2o1 ZINC000498433468 907899017 /nfs/dbraw/zinc/89/90/17/907899017.db2.gz DWDUTIARPFOSME-RDPSFJRHSA-N 0 3 405.498 4.364 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)c(C)c1CC(=O)N(CCN(C)C)C1CCCC1 ZINC000498456162 907920387 /nfs/dbraw/zinc/92/03/87/907920387.db2.gz ZYTNQDCXDROEIA-UHFFFAOYSA-N 0 3 402.970 4.018 20 0 HIADHN CN(C(=O)NCc1ccccc1N1CCCCC1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000498468078 907936462 /nfs/dbraw/zinc/93/64/62/907936462.db2.gz SRIAFXMBKUDCRF-HSZRJFAPSA-N 0 3 406.574 4.093 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)NCc1ccccc1N1CCCCC1 ZINC000498472296 907942049 /nfs/dbraw/zinc/94/20/49/907942049.db2.gz SITGTVBUKZENOO-UHFFFAOYSA-N 0 3 412.553 4.089 20 0 HIADHN CN(C(=O)CC1(CCc2ccccc2)CCCC1)C1CCN(CCn2cccn2)CC1 ZINC000498475091 907943114 /nfs/dbraw/zinc/94/31/14/907943114.db2.gz DNFYIKHKXZQOPZ-UHFFFAOYSA-N 0 3 422.617 4.389 20 0 HIADHN COc1ccc(NC(=O)c2cccc(CN(C)C)c2)cc1NC(=O)c1cccc(F)c1 ZINC000498553564 908015119 /nfs/dbraw/zinc/01/51/19/908015119.db2.gz GHTAYZROUGQRGA-UHFFFAOYSA-N 0 3 421.472 4.401 20 0 HIADHN CN(C)Cc1ccccc1CNC(=O)C1(c2ccc(Br)cc2)CCC1 ZINC000498556278 908017872 /nfs/dbraw/zinc/01/78/72/908017872.db2.gz GTFVZUHGGZIFJN-UHFFFAOYSA-N 0 3 401.348 4.249 20 0 HIADHN COc1ccccc1[C@@H]1CC[C@H](C)CN1C(=O)NC1CCN(CCOC(C)C)CC1 ZINC000498595729 908045783 /nfs/dbraw/zinc/04/57/83/908045783.db2.gz YHXAGWFGICNPRC-UGKGYDQZSA-N 0 3 417.594 4.067 20 0 HIADHN O=C(NC1CCN(Cc2ccc(Cl)cc2)CC1)[C@H]1CCCN1Cc1ccccc1 ZINC000498600777 908049604 /nfs/dbraw/zinc/04/96/04/908049604.db2.gz OHPONMZMAZSFPZ-HSZRJFAPSA-N 0 3 411.977 4.085 20 0 HIADHN O=C(Nc1cccc(OC(F)(F)F)c1)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000498620057 908067288 /nfs/dbraw/zinc/06/72/88/908067288.db2.gz PVECWIKFJSUYHQ-UHFFFAOYSA-N 0 3 408.420 4.042 20 0 HIADHN Clc1ccc2c(c1)nccc2N1CCC[C@H](CN2CCN(c3ccccn3)CC2)C1 ZINC000498683150 908113416 /nfs/dbraw/zinc/11/34/16/908113416.db2.gz VGUVWBQIRLIIRA-LJQANCHMSA-N 0 3 421.976 4.322 20 0 HIADHN C[C@@H]1CCN(C)CCN1C(=O)[C@@](C)(Cc1nc2ccccc2s1)c1ccccc1 ZINC000498717190 908141581 /nfs/dbraw/zinc/14/15/81/908141581.db2.gz RFGXAIPMSRFHPQ-KOSHJBKYSA-N 0 3 407.583 4.349 20 0 HIADHN Cc1ccc(-c2nc(CNC(=O)N[C@H]3CCN(Cc4ccccc4)[C@@H]3C)co2)cc1 ZINC000498720500 908145400 /nfs/dbraw/zinc/14/54/00/908145400.db2.gz IENBCHXHOLGNDC-GCJKJVERSA-N 0 3 404.514 4.112 20 0 HIADHN C[C@H]1CCN(C)CCN1C(=O)c1ccc(NC(=O)c2cc(Cl)cc(Cl)c2)cc1 ZINC000498728920 908155868 /nfs/dbraw/zinc/15/58/68/908155868.db2.gz UYEQMCWXJJGWBB-AWEZNQCLSA-N 0 3 420.340 4.412 20 0 HIADHN COc1cc(C(=O)N2CCN(C)CC[C@@H]2C)ccc1OCc1ccccc1Cl ZINC000498732828 908160313 /nfs/dbraw/zinc/16/03/13/908160313.db2.gz BJXDSWJWPZMHTD-INIZCTEOSA-N 0 3 402.922 4.094 20 0 HIADHN C[C@H](NC(=O)C(C)(C)c1csc(-c2c(F)cccc2F)n1)C1=CCN(C)CC1 ZINC000498795172 908207117 /nfs/dbraw/zinc/20/71/17/908207117.db2.gz BXMJRZKRSDWTMV-ZDUSSCGKSA-N 0 3 405.514 4.133 20 0 HIADHN COc1ccc2ccccc2c1-c1cc(CNC(=O)N(CCN(C)C)CC(C)C)on1 ZINC000498833221 908241232 /nfs/dbraw/zinc/24/12/32/908241232.db2.gz LLYRKJSVASWAPC-UHFFFAOYSA-N 0 3 424.545 4.233 20 0 HIADHN Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)N[C@H](CN1CCCC1)c1ccccc1 ZINC000498859262 908262728 /nfs/dbraw/zinc/26/27/28/908262728.db2.gz NCBNRRJXRDJDNX-HSZRJFAPSA-N 0 3 420.557 4.190 20 0 HIADHN Cc1nc(C(C)(C)NC(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)sc1C ZINC000512902329 921394974 /nfs/dbraw/zinc/39/49/74/921394974.db2.gz NRDUQVZPAQCGJB-IBGZPJMESA-N 0 3 418.607 4.384 20 0 HIADHN Cc1cnc(C(C)(C)NC(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)s1 ZINC000512905960 921398050 /nfs/dbraw/zinc/39/80/50/921398050.db2.gz ATOKRWSHJITMTP-GOSISDBHSA-N 0 3 404.580 4.076 20 0 HIADHN CO[C@@H](C)c1nc(CNC(=O)NC[C@H](c2ccc(CC(C)C)cc2)N(C)C)cs1 ZINC000498899328 908305009 /nfs/dbraw/zinc/30/50/09/908305009.db2.gz FNZJGTLIPIRMMJ-OXJNMPFZSA-N 0 3 418.607 4.151 20 0 HIADHN C[C@@H](NC(=O)NCc1csc(CCc2ccccc2)n1)[C@@H](c1ccccc1)N(C)C ZINC000498907976 908317009 /nfs/dbraw/zinc/31/70/09/908317009.db2.gz PUEUYXVRSDTIKO-JPYJTQIMSA-N 0 3 422.598 4.419 20 0 HIADHN CCc1ccccc1N(C(C)=O)c1nc(CN2C[C@H](C)N(CC)C[C@@H]2C)cs1 ZINC000498913316 908321556 /nfs/dbraw/zinc/32/15/56/908321556.db2.gz GIGWOCWSOZHQSO-IRXDYDNUSA-N 0 3 400.592 4.305 20 0 HIADHN CCOC(=O)c1c(C)c2ccccc2nc1CN1CCC[C@H](c2nc(C3CC3)n[nH]2)C1 ZINC000498919353 908327888 /nfs/dbraw/zinc/32/78/88/908327888.db2.gz RXSOWGWTCZHCSK-KRWDZBQOSA-N 0 3 419.529 4.095 20 0 HIADHN O=C(CN1CCC[C@H](c2nc(C3CC3)n[nH]2)C1)N(c1ccccc1)C1CCCCC1 ZINC000498928069 908335558 /nfs/dbraw/zinc/33/55/58/908335558.db2.gz HZBGHLYOAIOHLW-IBGZPJMESA-N 0 3 407.562 4.227 20 0 HIADHN O=C(CN1CCC[C@H](c2n[nH]c(C3CC3)n2)C1)N(c1ccccc1)C1CCCCC1 ZINC000498928069 908335575 /nfs/dbraw/zinc/33/55/75/908335575.db2.gz HZBGHLYOAIOHLW-IBGZPJMESA-N 0 3 407.562 4.227 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)N2CCC(OC(C)(C)C)CC2)N(C)C)cc1 ZINC000512913240 921406040 /nfs/dbraw/zinc/40/60/40/921406040.db2.gz UDCZOFQIEISXHZ-NRFANRHFSA-N 0 3 405.583 4.066 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)N2CCc3c4ccccc4[nH]c3C2)N(C)C)cc1 ZINC000512913233 921406093 /nfs/dbraw/zinc/40/60/93/921406093.db2.gz UCBHZMSKENKLDD-XMMPIXPASA-N 0 3 420.557 4.326 20 0 HIADHN COc1cccc(CN(C)C(=O)CN[C@H](Cc2ccccc2)c2ccccc2)c1OC ZINC000499049192 908421318 /nfs/dbraw/zinc/42/13/18/908421318.db2.gz WZUYBCUXRLNEQG-HSZRJFAPSA-N 0 3 418.537 4.236 20 0 HIADHN COc1ccc(C[C@H](NCC(=O)Nc2ccc(OC)cc2)c2ccc(OC)cc2)cc1 ZINC000499061364 908429071 /nfs/dbraw/zinc/42/90/71/908429071.db2.gz ZSXSPFJTIRXPAP-DEOSSOPVSA-N 0 3 420.509 4.225 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)N2CCC(Cc3cccnc3)CC2)N(C)C)cc1 ZINC000512918891 921413516 /nfs/dbraw/zinc/41/35/16/921413516.db2.gz VBNAMLBPOGPSFH-DEOSSOPVSA-N 0 3 424.589 4.136 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cccc([C@H]2CCCOC2)c1)c1cccc(OC)c1 ZINC000499151506 908511178 /nfs/dbraw/zinc/51/11/78/908511178.db2.gz RMHZQCPUDCVWCP-LADGPHEKSA-N 0 3 410.558 4.402 20 0 HIADHN Cc1cn(-c2ccccc2Cl)nc1C(=O)N[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000499369277 908738300 /nfs/dbraw/zinc/73/83/00/908738300.db2.gz OPTTUQHWPQLFHS-MJGOQNOKSA-N 0 3 408.933 4.399 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2ccc(OC[C@H]3CCCO3)cc2)N2CCCC2)cc1 ZINC000499395712 908756068 /nfs/dbraw/zinc/75/60/68/908756068.db2.gz BPXOAPRNOHNHAL-RPWUZVMVSA-N 0 3 408.542 4.120 20 0 HIADHN CN(C(=O)c1nn(-c2ccccc2)c2c1CCC2)C1CCN(Cc2ccccc2)CC1 ZINC000499513465 908824070 /nfs/dbraw/zinc/82/40/70/908824070.db2.gz VXMDZXDUTUDKAF-UHFFFAOYSA-N 0 3 414.553 4.098 20 0 HIADHN Cc1nn(-c2ccccc2)c(Oc2cccc(F)c2)c1CNC[C@]1(O)CCSC1 ZINC000499676458 908873847 /nfs/dbraw/zinc/87/38/47/908873847.db2.gz DWKVPGHSLBMJJD-JOCHJYFZSA-N 0 3 413.518 4.070 20 0 HIADHN CC(C)c1nn(-c2ccccc2)cc1CNC(=O)N[C@@H](CN(C)C)c1ccc(F)cc1 ZINC000499691145 908878213 /nfs/dbraw/zinc/87/82/13/908878213.db2.gz DOGPITLNEFZPGA-QFIPXVFZSA-N 0 3 423.536 4.237 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCc1ccc(N2CCCCC2)nc1)c1ccsc1 ZINC000499709460 908884716 /nfs/dbraw/zinc/88/47/16/908884716.db2.gz SDYILSQQGSRDBT-HXUWFJFHSA-N 0 3 415.607 4.016 20 0 HIADHN CCN(CC)C(=O)c1ccc(NC(=O)CN[C@H](C)c2ccc3c(c2)CCCC3)cc1 ZINC000499717576 908887681 /nfs/dbraw/zinc/88/76/81/908887681.db2.gz BDGZBOBLVRMLCF-GOSISDBHSA-N 0 3 407.558 4.337 20 0 HIADHN CS(=O)(=O)C1(CNCc2cn(Cc3ccccc3)nc2-c2ccccc2)CCCC1 ZINC000512978168 921451043 /nfs/dbraw/zinc/45/10/43/921451043.db2.gz YLTXAMFLLBBWKW-UHFFFAOYSA-N 0 3 423.582 4.045 20 0 HIADHN CCN1CCCN(C(=O)c2cccc(OCc3ccccc3Br)c2)CC1 ZINC000499858361 908993573 /nfs/dbraw/zinc/99/35/73/908993573.db2.gz HVTZUJNEBQEKGD-UHFFFAOYSA-N 0 3 417.347 4.196 20 0 HIADHN CS(=O)(=O)C1(CNCc2cccc(OCCCc3ccccc3)c2)CCCC1 ZINC000512996063 921463491 /nfs/dbraw/zinc/46/34/91/921463491.db2.gz JRMFKWDRPOKEAC-UHFFFAOYSA-N 0 3 401.572 4.145 20 0 HIADHN CCN(C(=O)c1cccc(NC(=O)NC2CC2)c1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000499998936 909449387 /nfs/dbraw/zinc/44/93/87/909449387.db2.gz HRNNKILQBOGLGG-FDDCHVKYSA-N 0 3 420.557 4.268 20 0 HIADHN CCN(C(=O)c1ccn(-c2ccccc2F)n1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000500004185 909453786 /nfs/dbraw/zinc/45/37/86/909453786.db2.gz KKTNWSYIPCUUOQ-QUCCMNQESA-N 0 3 406.505 4.309 20 0 HIADHN CC[C@@H](C)c1ccccc1OCC(=O)N(C)C1CCN(CCc2ccccn2)CC1 ZINC000500013261 909468226 /nfs/dbraw/zinc/46/82/26/909468226.db2.gz GBKNYTMVAGZOMK-HXUWFJFHSA-N 0 3 409.574 4.139 20 0 HIADHN CCN(C(=O)c1ccn(-c2ccc(OC)cc2)n1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000500013523 909469022 /nfs/dbraw/zinc/46/90/22/909469022.db2.gz YIKLPQMOUCOEIU-DENIHFKCSA-N 0 3 418.541 4.179 20 0 HIADHN COc1cc(Br)cc(NC(=O)N(CCN(C)C)Cc2cccs2)c1 ZINC000500079421 909552783 /nfs/dbraw/zinc/55/27/83/909552783.db2.gz ACOWIGQCBNMMOG-UHFFFAOYSA-N 0 3 412.353 4.115 20 0 HIADHN O[C@@H](COCc1ccco1)CN1CCC(F)(c2ccccc2OC(F)(F)F)CC1 ZINC000500120436 909600483 /nfs/dbraw/zinc/60/04/83/909600483.db2.gz BKNBWZFGXUWQQN-OAHLLOKOSA-N 0 3 417.399 4.017 20 0 HIADHN CN(C)C[C@@H](NC(=O)N[C@@H]1CC(C)(C)Oc2cc(F)ccc21)c1ccc(F)cc1 ZINC000500142447 909621485 /nfs/dbraw/zinc/62/14/85/909621485.db2.gz ORGWSQSRPIXBKF-RTBURBONSA-N 0 3 403.473 4.169 20 0 HIADHN O=C(NCc1ccc(Oc2ccc(F)cc2)nc1)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000500165368 909648902 /nfs/dbraw/zinc/64/89/02/909648902.db2.gz VQGBCIJEEFORON-NRFANRHFSA-N 0 3 420.488 4.087 20 0 HIADHN COc1ccccc1[C@H](NC(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C)c1ccco1 ZINC000500178422 909672944 /nfs/dbraw/zinc/67/29/44/909672944.db2.gz JNSKWAOFQNIUST-PDIWNELESA-N 0 3 407.514 4.368 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)C[C@H](C)Cc3ccccc3OC)cc2)CC1 ZINC000500196672 909688528 /nfs/dbraw/zinc/68/85/28/909688528.db2.gz FKBWPGAIJPZCML-HXUWFJFHSA-N 0 3 409.574 4.040 20 0 HIADHN CC(C)C[C@H](NC(=O)CN(C)C1CCN(C(=O)c2ccccc2)CC1)c1ccccc1 ZINC000500208849 909699177 /nfs/dbraw/zinc/69/91/77/909699177.db2.gz BVDLQVZBJLQLNB-DEOSSOPVSA-N 0 3 421.585 4.127 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)Nc3ccc(NC4CCOCC4)cc3)cc2)CC1 ZINC000513071246 921525821 /nfs/dbraw/zinc/52/58/21/921525821.db2.gz SNDSOQYCVBBMHN-UHFFFAOYSA-N 0 3 422.573 4.060 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)CCc2ccnc3ccccc23)cc1 ZINC000500378957 909825328 /nfs/dbraw/zinc/82/53/28/909825328.db2.gz LYSUWXBVUBRAOF-DEOSSOPVSA-N 0 3 403.526 4.129 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)c2cc(C(C)C)n(C(C)(C)C)n2)cc1 ZINC000500422403 909846883 /nfs/dbraw/zinc/84/68/83/909846883.db2.gz ITHFBVZOOPNPLE-NRFANRHFSA-N 0 3 412.578 4.337 20 0 HIADHN C/C(=C/c1ccccc1C(F)(F)F)CNCC(=O)N[C@@H]1CCOc2ccccc21 ZINC000500527361 909907844 /nfs/dbraw/zinc/90/78/44/909907844.db2.gz KMTIOGKMPQVHJI-LJQBUTKESA-N 0 3 404.432 4.338 20 0 HIADHN COc1ccc(CNCc2ccc(C[S@](C)=O)cc2)cc1OCc1ccccc1 ZINC000513089010 921539913 /nfs/dbraw/zinc/53/99/13/921539913.db2.gz LIBCUOFQPFGCLH-LJAQVGFWSA-N 0 3 409.551 4.443 20 0 HIADHN CC(C)CN(C(=O)c1csc(-c2cnn(-c3ccccc3)c2)n1)C1CCN(C)CC1 ZINC000500690728 910024134 /nfs/dbraw/zinc/02/41/34/910024134.db2.gz VBZWZTWGHLBNOI-UHFFFAOYSA-N 0 3 423.586 4.188 20 0 HIADHN CC1(C)CN(Cc2ccccc2)CC[C@@H]1NC(=O)CCC(=O)c1ccc(F)c(F)c1 ZINC000513093210 921543212 /nfs/dbraw/zinc/54/32/12/921543212.db2.gz XWRANDUVWNCMQG-QFIPXVFZSA-N 0 3 414.496 4.345 20 0 HIADHN Cc1nc(-c2ccc(Cl)s2)sc1C(=O)N(CCN(C)C)Cc1ccccn1 ZINC000500749406 910058042 /nfs/dbraw/zinc/05/80/42/910058042.db2.gz RDUIZZJNPFYRFP-UHFFFAOYSA-N 0 3 420.991 4.432 20 0 HIADHN Cc1ccc(-c2cc(C(=O)Nc3ccc(CCN4CCSCC4)cc3)on2)cc1 ZINC000500818634 910099764 /nfs/dbraw/zinc/09/97/64/910099764.db2.gz QTBJIBMTFROHFP-UHFFFAOYSA-N 0 3 407.539 4.494 20 0 HIADHN Cc1cc(C)n(Cc2cccc(C(=O)N[C@@H]3CCN([C@H](C)c4ccccc4)C3)c2)n1 ZINC000500838112 910114872 /nfs/dbraw/zinc/11/48/72/910114872.db2.gz AIZGEHNJDLZKDF-HYBUGGRVSA-N 0 3 402.542 4.114 20 0 HIADHN COc1cc(Br)ccc1C(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000500880856 910154160 /nfs/dbraw/zinc/15/41/60/910154160.db2.gz QODFVSNXWGPTJW-RHSMWYFYSA-N 0 3 403.320 4.023 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)NCc2cc(Cl)sc2Cl)cc1 ZINC000500882947 910155776 /nfs/dbraw/zinc/15/57/76/910155776.db2.gz BPQRBMVLFVDAQE-AWEZNQCLSA-N 0 3 402.347 4.166 20 0 HIADHN CC(C)(COCc1ccccc1)NCC(=O)N1CC=C(c2c[nH]c3ccccc32)CC1 ZINC000500955939 910206177 /nfs/dbraw/zinc/20/61/77/910206177.db2.gz FBLHWMRRCAZWSQ-UHFFFAOYSA-N 0 3 417.553 4.369 20 0 HIADHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)c1cn(C)c2ccccc12 ZINC000500968005 910211155 /nfs/dbraw/zinc/21/11/55/910211155.db2.gz HWXLRCOKULCIQP-UHFFFAOYSA-N 0 3 414.347 4.145 20 0 HIADHN Cc1cc(CN[C@@H](C)c2cccc(N3CCCS3(=O)=O)c2)ccc1Br ZINC000501010362 910231771 /nfs/dbraw/zinc/23/17/71/910231771.db2.gz KKDHMJHWPOBMSB-HNNXBMFYSA-N 0 3 423.376 4.148 20 0 HIADHN CCn1nc(C)c(CN2CCC(C(=O)Nc3ccccc3Br)CC2)c1C ZINC000513116689 921561416 /nfs/dbraw/zinc/56/14/16/921561416.db2.gz JRETXCRFXUXYDG-UHFFFAOYSA-N 0 3 419.367 4.133 20 0 HIADHN Cc1nn(-c2ccc(Br)cc2)c(C)c1CN1CCC[C@H](n2cccn2)C1 ZINC000513116839 921563726 /nfs/dbraw/zinc/56/37/26/921563726.db2.gz MAVYTMOEPDQQJB-IBGZPJMESA-N 0 3 414.351 4.285 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CCO[C@@H](c2ccc(F)cc2)C1)c1ccsc1 ZINC000501132736 910313614 /nfs/dbraw/zinc/31/36/14/910313614.db2.gz IOTZKODRBJKNKO-VQTJNVASSA-N 0 3 405.539 4.053 20 0 HIADHN O=C([C@@H]1CC12CCN(Cc1ccccc1OCc1cccnc1)CC2)N1CCCCC1 ZINC000501141673 910320408 /nfs/dbraw/zinc/32/04/08/910320408.db2.gz JGDLYCUQVARRJM-QHCPKHFHSA-N 0 3 419.569 4.275 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCc1cc(Cl)c2c(c1)OCCO2)c1ccsc1 ZINC000501155203 910327375 /nfs/dbraw/zinc/32/73/75/910327375.db2.gz TTZCYNMHIPKVIJ-QGZVFWFLSA-N 0 3 423.966 4.055 20 0 HIADHN CCOc1ccc(C(=O)CCC(=O)N[C@@H]2CCN(Cc3ccccc3)CC2(C)C)cc1 ZINC000513125562 921569018 /nfs/dbraw/zinc/56/90/18/921569018.db2.gz HCAONMNDYCXMMG-XMMPIXPASA-N 0 3 422.569 4.465 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)C2(c3cccc(Br)c3)CC2)C1 ZINC000501228372 910388039 /nfs/dbraw/zinc/38/80/39/910388039.db2.gz PRFXPSYMHVQRBZ-OXQOHEQNSA-N 0 3 413.359 4.432 20 0 HIADHN COc1ccc(-c2cnc(CCC(=O)N(CCN(C)C)CC3CCCCC3)o2)cc1 ZINC000501256871 910417736 /nfs/dbraw/zinc/41/77/36/910417736.db2.gz JAVGOTVYMVQCAT-UHFFFAOYSA-N 0 3 413.562 4.253 20 0 HIADHN CN1CCCN(C(=O)Nc2ccc(Oc3nncc4ccccc43)c(Cl)c2)CC1 ZINC000501344182 910479693 /nfs/dbraw/zinc/47/96/93/910479693.db2.gz UWZMIYIYUZEPET-UHFFFAOYSA-N 0 3 411.893 4.245 20 0 HIADHN COc1cccc(C(=O)CCCC(=O)N[C@H]2CCN(Cc3ccccc3)CC2(C)C)c1 ZINC000513152757 921588087 /nfs/dbraw/zinc/58/80/87/921588087.db2.gz GPHNZKRVQCGPAV-DEOSSOPVSA-N 0 3 422.569 4.465 20 0 HIADHN CCCn1nccc1C1CCN(C[C@H](O)COc2c(Cl)cccc2Cl)CC1 ZINC000501560227 910667802 /nfs/dbraw/zinc/66/78/02/910667802.db2.gz DQDCHJRBKPVLOV-INIZCTEOSA-N 0 3 412.361 4.219 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1CCO[C@H]1c1ccc(Cl)c(F)c1)[C@@H](c1ccccc1)N(C)C ZINC000501564192 910672472 /nfs/dbraw/zinc/67/24/72/910672472.db2.gz ACUQNXFQLUCXCY-MGNXDGSBSA-N 0 3 419.928 4.300 20 0 HIADHN CN(C)C[C@H](NC(=O)N[C@H]1CCO[C@@H]1c1ccc(Cl)c(F)c1)c1ccc(F)cc1 ZINC000501570363 910674942 /nfs/dbraw/zinc/67/49/42/910674942.db2.gz VANIFLDZORRQRW-SLFFLAALSA-N 0 3 423.891 4.050 20 0 HIADHN C[C@@H](NC(=O)CN[C@@]1(Cc2ccc(C(F)(F)F)cc2)CCOC1)c1ccc(F)cc1 ZINC000513171960 921599284 /nfs/dbraw/zinc/59/92/84/921599284.db2.gz DIZOFDJREXHOMA-QVKFZJNVSA-N 0 3 424.438 4.013 20 0 HIADHN C[C@@H](NC(=O)CN[C@]1(Cc2ccc(C(F)(F)F)cc2)CCOC1)c1ccc(F)cc1 ZINC000513171962 921599539 /nfs/dbraw/zinc/59/95/39/921599539.db2.gz DIZOFDJREXHOMA-VFNWGFHPSA-N 0 3 424.438 4.013 20 0 HIADHN CC(=O)Nc1c[nH]nc1[C@H]1CCCN(C[C@@H](C)c2cccc(Br)c2)C1 ZINC000501768069 910823703 /nfs/dbraw/zinc/82/37/03/910823703.db2.gz HDDMZIOSMITUDI-CJNGLKHVSA-N 0 3 405.340 4.114 20 0 HIADHN COc1ccc2cc(CNC(=O)NCCCN3CCc4ccccc4C3)ccc2c1 ZINC000501774653 910829112 /nfs/dbraw/zinc/82/91/12/910829112.db2.gz JENAXXYGPBTQHS-UHFFFAOYSA-N 0 3 403.526 4.096 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)c3cc(-c4ccccc4Cl)on3)cc2)CC1 ZINC000513191155 921611143 /nfs/dbraw/zinc/61/11/43/921611143.db2.gz FWUKLRCRSCZTHS-UHFFFAOYSA-N 0 3 424.932 4.385 20 0 HIADHN O=C(Nc1ccccc1C(=O)N1CCCCC1)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000501796803 910849255 /nfs/dbraw/zinc/84/92/55/910849255.db2.gz HKZHPYMBEVBEDL-QHCPKHFHSA-N 0 3 420.557 4.271 20 0 HIADHN CCN(Cc1ccc(OC)c(OC)c1)C(=O)N[C@H](CN1CCCC1)c1ccccc1 ZINC000501802785 910853667 /nfs/dbraw/zinc/85/36/67/910853667.db2.gz OMLHESLQJZNIGR-OAQYLSRUSA-N 0 3 411.546 4.072 20 0 HIADHN CCOc1ccc([C@H](C)NC(=O)N[C@@H](CN2CCCC2)c2ccccc2)cc1OC ZINC000501852191 910884297 /nfs/dbraw/zinc/88/42/97/910884297.db2.gz UPVJQKHHJRQTKP-RXVVDRJESA-N 0 3 411.546 4.291 20 0 HIADHN CCN(CC)C(=O)Cc1ccc(NC(=O)N[C@H](CN2CCCC2)c2ccccc2)cc1 ZINC000501852743 910885997 /nfs/dbraw/zinc/88/59/97/910885997.db2.gz XGEYSPFBWBZYHM-HSZRJFAPSA-N 0 3 422.573 4.056 20 0 HIADHN O=C(CN1CCCN(Cc2ccccc2)CC1)N[C@@H](c1cccs1)c1ccccc1 ZINC000501869287 910896559 /nfs/dbraw/zinc/89/65/59/910896559.db2.gz GHJPLBSIPFDVKX-RUZDIDTESA-N 0 3 419.594 4.162 20 0 HIADHN CCN(C(=O)c1ccc(-n2nc(C)cc2C)nc1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000501955976 910943971 /nfs/dbraw/zinc/94/39/71/910943971.db2.gz IBGPLQUSQZXESN-OFNKIYASSA-N 0 3 417.557 4.182 20 0 HIADHN CN(Cc1ccc(F)cc1Cl)C(=O)NCC(C)(C)N1CCc2ccccc2C1 ZINC000502118019 911048036 /nfs/dbraw/zinc/04/80/36/911048036.db2.gz FTOKMQQMGNDCNL-UHFFFAOYSA-N 0 3 403.929 4.457 20 0 HIADHN COCCN(Cc1ccc(F)cc1Cl)C(=O)NC[C@@H](c1ccc(C)cc1)N(C)C ZINC000502197462 911140946 /nfs/dbraw/zinc/14/09/46/911140946.db2.gz NOIRJJIHLSATRA-NRFANRHFSA-N 0 3 421.944 4.248 20 0 HIADHN CN(C(=O)Nc1cn(C)nc1-c1ccccc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000502209953 911154817 /nfs/dbraw/zinc/15/48/17/911154817.db2.gz UBSYGPKGFSHXNR-OAQYLSRUSA-N 0 3 403.530 4.215 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)[C@@H]1C[C@@H]1c1ccc(Br)cc1 ZINC000513224471 921639196 /nfs/dbraw/zinc/63/91/96/921639196.db2.gz SYEXVXMNCUCYSE-PWRODBHTSA-N 0 3 413.359 4.333 20 0 HIADHN O=C(NC[C@H]1CCCN1Cc1ccccc1)C1(c2cccc(Br)c2)CC1 ZINC000513231786 921643265 /nfs/dbraw/zinc/64/32/65/921643265.db2.gz FQAUJKGQOXUMSE-HXUWFJFHSA-N 0 3 413.359 4.262 20 0 HIADHN CSc1cccc(NC(=O)CNC(C)(C)COc2ccc(C(F)(F)F)cn2)c1 ZINC000502285571 911240520 /nfs/dbraw/zinc/24/05/20/911240520.db2.gz DAVJSNPOURYFMG-UHFFFAOYSA-N 0 3 413.465 4.208 20 0 HIADHN COc1ccc(Br)c(CN2CCC[C@@H](c3ncc4n3CCCC4)C2)c1 ZINC000502330242 911310164 /nfs/dbraw/zinc/31/01/64/911310164.db2.gz CYYYXSWRJLPHQJ-OAHLLOKOSA-N 0 3 404.352 4.370 20 0 HIADHN O=C(Nc1c[nH]nc1[C@H]1CCCN(CCCOc2ccc(F)cc2)C1)c1ccccc1 ZINC000502334904 911315779 /nfs/dbraw/zinc/31/57/79/911315779.db2.gz QFHRTFDIJDTZGG-IBGZPJMESA-N 0 3 422.504 4.450 20 0 HIADHN Cc1cc(C)c(NC(=O)CNC(C)(C)COc2ncccc2C(F)(F)F)c(C)c1 ZINC000502340653 911319553 /nfs/dbraw/zinc/31/95/53/911319553.db2.gz QWAFVCXSRUAWII-UHFFFAOYSA-N 0 3 409.452 4.411 20 0 HIADHN C[C@H](CC(=O)Nc1cccc(F)c1)N[C@H]1CCOc2c(Br)cccc21 ZINC000502346452 911328679 /nfs/dbraw/zinc/32/86/79/911328679.db2.gz PTYBLWLULWABBI-PXAZEXFGSA-N 0 3 407.283 4.419 20 0 HIADHN C[C@@H](SCC(=O)NC[C@@H]1CCCN1Cc1ccccc1)c1nc2ccccc2[nH]1 ZINC000513243398 921653719 /nfs/dbraw/zinc/65/37/19/921653719.db2.gz GUBOCXCCEOPDMO-MJGOQNOKSA-N 0 3 408.571 4.138 20 0 HIADHN Cc1ccccc1NC(=O)CCN1CCC[C@H](c2n[nH]cc2NC(=O)C2CCCC2)C1 ZINC000502363608 911349580 /nfs/dbraw/zinc/34/95/80/911349580.db2.gz WTYVGXGBYZSGTD-IBGZPJMESA-N 0 3 423.561 4.055 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1ccc([C@@H]2CCCOC2)cc1)c1cccc(OC)c1 ZINC000502526667 911530305 /nfs/dbraw/zinc/53/03/05/911530305.db2.gz NOUQSVHEHCAZOU-ISKFKSNPSA-N 0 3 410.558 4.402 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cccc2c1OCCO2)c1ccc(C(F)(F)F)cc1 ZINC000502533327 911536246 /nfs/dbraw/zinc/53/62/46/911536246.db2.gz BQKBIBIQOHATGG-SFHVURJKSA-N 0 3 422.447 4.290 20 0 HIADHN CCc1nc(CC(=O)NC[C@H](c2ccc(C(F)(F)F)cc2)N(CC)CC)cs1 ZINC000502542032 911548554 /nfs/dbraw/zinc/54/85/54/911548554.db2.gz WWRVCLMUPVNGJI-QGZVFWFLSA-N 0 3 413.509 4.466 20 0 HIADHN COc1ccc([C@H]2CCCN2C(=O)CN[C@H](c2ccc(F)cc2)C(C)C)cc1OC ZINC000502563012 911569487 /nfs/dbraw/zinc/56/94/87/911569487.db2.gz JDZFXGUQQZMFOH-YKSBVNFPSA-N 0 3 414.521 4.493 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)c1ccnc(SCC(F)(F)F)c1 ZINC000513269656 921671967 /nfs/dbraw/zinc/67/19/67/921671967.db2.gz WDRPUHZEBOSKIN-KRWDZBQOSA-N 0 3 409.477 4.130 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3ccc(Cn4cccn4)cc3)c(C)c2)CC1 ZINC000502606696 911614803 /nfs/dbraw/zinc/61/48/03/911614803.db2.gz WJWTXIPHWAFKSM-UHFFFAOYSA-N 0 3 418.545 4.026 20 0 HIADHN Cc1nc(COc2ccccc2C(=O)NC[C@H]2CCCN2Cc2ccccc2)cs1 ZINC000513283902 921682744 /nfs/dbraw/zinc/68/27/44/921682744.db2.gz HSHJEKKNZOVORK-OAQYLSRUSA-N 0 3 421.566 4.425 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)CCCOCCc3ccccc3)c2)CC1 ZINC000502855465 911864924 /nfs/dbraw/zinc/86/49/24/911864924.db2.gz JFDIBRBDZAEOOE-UHFFFAOYSA-N 0 3 409.574 4.195 20 0 HIADHN Cc1oc(-c2ccccc2)nc1CC(=O)Nc1cccc(N2CCN(C(C)C)CC2)c1 ZINC000502868835 911873603 /nfs/dbraw/zinc/87/36/03/911873603.db2.gz KTUQLBROQOEGFA-UHFFFAOYSA-N 0 3 418.541 4.362 20 0 HIADHN Cc1oc(-c2ccsc2)nc1CC(=O)Nc1cccc(N2CCN(C(C)C)CC2)c1 ZINC000502869485 911873908 /nfs/dbraw/zinc/87/39/08/911873908.db2.gz WPUPYDCCIVXOPA-UHFFFAOYSA-N 0 3 424.570 4.423 20 0 HIADHN Cc1nccn1CCCCN1CCN([C@@H](C)c2ccc(Br)cc2)CC1 ZINC000502868763 911874159 /nfs/dbraw/zinc/87/41/59/911874159.db2.gz JVDRCOAWXVQTGK-KRWDZBQOSA-N 0 3 405.384 4.113 20 0 HIADHN CC(=O)c1cccc(OCCCC(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)c1 ZINC000502870022 911875746 /nfs/dbraw/zinc/87/57/46/911875746.db2.gz YYVNOANKANEFEX-UHFFFAOYSA-N 0 3 423.557 4.217 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)N3CCC(CCC[NH+]4CCCC4)CC3)cc2)cc(=O)[n-]1 ZINC000502878658 911879911 /nfs/dbraw/zinc/87/99/11/911879911.db2.gz XCYYBAXNHRVLCH-UHFFFAOYSA-N 0 3 423.561 4.278 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)Cc3coc(-c4ccccc4)n3)c2)CC1 ZINC000502880558 911881199 /nfs/dbraw/zinc/88/11/99/911881199.db2.gz PRKHWNNPDDDVPJ-UHFFFAOYSA-N 0 3 404.514 4.053 20 0 HIADHN COc1cccc([C@@H](CNC(=O)NC(C)(C)c2ccccc2OC)N2CCCC2)c1 ZINC000502933144 911918919 /nfs/dbraw/zinc/91/89/19/911918919.db2.gz CBHVMKLYTXXOAM-OAQYLSRUSA-N 0 3 411.546 4.075 20 0 HIADHN COc1ccc([C@@H](CNC(=O)NC(C)(C)c2ccccc2OC)N2CCCC2)cc1 ZINC000502961299 911943275 /nfs/dbraw/zinc/94/32/75/911943275.db2.gz MSDXVGPRKKAJRF-OAQYLSRUSA-N 0 3 411.546 4.075 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NC(C)(C)c1ccccc1OC)c1cccc(OC)c1 ZINC000502976325 911957169 /nfs/dbraw/zinc/95/71/69/911957169.db2.gz OUJLFRDIISWBKQ-NRFANRHFSA-N 0 3 413.562 4.321 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)c1ccc([C@H]2CCCOC2)cc1 ZINC000503059925 912024101 /nfs/dbraw/zinc/02/41/01/912024101.db2.gz PPWFOJYBDFWEIP-FQEVSTJZSA-N 0 3 402.485 4.063 20 0 HIADHN COc1ccc(C)cc1NC(=O)[C@H](c1ccccc1)N(C)CCCn1ccnc1C ZINC000503073360 912040407 /nfs/dbraw/zinc/04/04/07/912040407.db2.gz FWUVOYATLHIMPS-QHCPKHFHSA-N 0 3 406.530 4.210 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)N[C@@H]2CCCc3c(O)cccc32)N(C)C)cc1 ZINC000503136443 912097366 /nfs/dbraw/zinc/09/73/66/912097366.db2.gz GSGJDAGGAUKKQK-FGZHOGPDSA-N 0 3 411.546 4.159 20 0 HIADHN O=c1ccccn1C[C@@H](NCCOc1ccc(Br)cc1)c1ccccc1 ZINC000503212870 912194538 /nfs/dbraw/zinc/19/45/38/912194538.db2.gz WMARCSJNFCQJDG-HXUWFJFHSA-N 0 3 413.315 4.021 20 0 HIADHN OCC1CCN(Cc2ccccc2NCc2nc(-c3ccc(Cl)cc3)no2)CC1 ZINC000503220776 912203828 /nfs/dbraw/zinc/20/38/28/912203828.db2.gz IPWIBTUCIOKDGA-UHFFFAOYSA-N 0 3 412.921 4.206 20 0 HIADHN Cc1nc(COc2ccc(CN3CCC(NC(=O)c4ccccc4)CC3)cc2)cs1 ZINC000506279118 914880234 /nfs/dbraw/zinc/88/02/34/914880234.db2.gz IHHHHTIPMVOVJC-UHFFFAOYSA-N 0 3 421.566 4.425 20 0 HIADHN Cc1cccc(NC(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)c1C(=O)N1CCCC1 ZINC000506281006 914881694 /nfs/dbraw/zinc/88/16/94/914881694.db2.gz KMRUPTQERNEAAM-PZJWPPBQSA-N 0 3 420.557 4.188 20 0 HIADHN CCOCCOCc1cccc(NC(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)c1 ZINC000506293149 914889066 /nfs/dbraw/zinc/88/90/66/914889066.db2.gz DNLWYZYHUUBDBO-XXBNENTESA-N 0 3 411.546 4.197 20 0 HIADHN CCN(CC)C(=O)Cc1ccc(NC(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)cc1 ZINC000506297796 914892179 /nfs/dbraw/zinc/89/21/79/914892179.db2.gz NAMGBQXSSXZIEF-WMZHIEFXSA-N 0 3 422.573 4.055 20 0 HIADHN Cc1cc(C)n(-c2ccccc2NC(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)n1 ZINC000506312958 914902841 /nfs/dbraw/zinc/90/28/41/914902841.db2.gz RTZDDBNPUTXYSU-FPOVZHCZSA-N 0 3 403.530 4.446 20 0 HIADHN CC(C)Cc1ccc([C@H](CNC(=O)N(C)C[C@@H](C)c2nccs2)N(C)C)cc1 ZINC000513356095 921735809 /nfs/dbraw/zinc/73/58/09/921735809.db2.gz BWNHRZAHLBTMDU-XLIONFOSSA-N 0 3 402.608 4.389 20 0 HIADHN COC(=O)c1cccc(CN2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)c1 ZINC000506474629 915073817 /nfs/dbraw/zinc/07/38/17/915073817.db2.gz NXVHYQMPIITEMF-UHFFFAOYSA-N 0 3 404.869 4.116 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1C(=O)NC[C@@H](c1ccc(C)cc1)N1CCCC1 ZINC000513371231 921743846 /nfs/dbraw/zinc/74/38/46/921743846.db2.gz KVSLMBUEWMNDLD-QHCPKHFHSA-N 0 3 402.542 4.364 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)Nc1cccc(CN2CCCCC2=O)c1 ZINC000506502307 915121792 /nfs/dbraw/zinc/12/17/92/915121792.db2.gz LAEGOUKDCQVNEW-HSZRJFAPSA-N 0 3 420.557 4.158 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)Nc1ccnc(Sc2ccccn2)c1 ZINC000506502969 915123623 /nfs/dbraw/zinc/12/36/23/915123623.db2.gz PEMSCOBDIVKLIH-UHFFFAOYSA-N 0 3 419.554 4.198 20 0 HIADHN COc1ccc(Br)c(NC(=O)NC[C@@H](c2cccs2)N2CCCC2)c1 ZINC000506510677 915136128 /nfs/dbraw/zinc/13/61/28/915136128.db2.gz HORPIIFLHPNHPA-INIZCTEOSA-N 0 3 424.364 4.478 20 0 HIADHN O=C(Nc1cccc(CN2CCCCC2=O)c1)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000506514989 915142994 /nfs/dbraw/zinc/14/29/94/915142994.db2.gz WWFZROZVCXQLIH-QHCPKHFHSA-N 0 3 420.557 4.158 20 0 HIADHN CCOc1cc(CN2CCC[C@H](c3nnc4n3CCCCC4)C2)ccc1OC(F)F ZINC000506631416 915300452 /nfs/dbraw/zinc/30/04/52/915300452.db2.gz IJHNPHRWTVTPOJ-KRWDZBQOSA-N 0 3 420.504 4.384 20 0 HIADHN c1ccc(OCc2ccncc2)c(CN2CCC[C@@H](c3nnc4n3CCCCC4)C2)c1 ZINC000506654136 915325818 /nfs/dbraw/zinc/32/58/18/915325818.db2.gz NHXXCELPRAFGNY-JOCHJYFZSA-N 0 3 417.557 4.358 20 0 HIADHN CC[C@H](N[C@@H](C)C(=O)N[C@H](C)c1ccccc1OC)c1ccc(OC)c(OC)c1 ZINC000506663517 915338155 /nfs/dbraw/zinc/33/81/55/915338155.db2.gz SAKOLXXYXXRMQU-GJYPPUQNSA-N 0 3 400.519 4.019 20 0 HIADHN CC[C@H](N[C@@H](C)C(=O)N[C@@H](C)c1ccccc1OC)c1ccc(OC)c(OC)c1 ZINC000506663515 915340118 /nfs/dbraw/zinc/34/01/18/915340118.db2.gz SAKOLXXYXXRMQU-BXWFABGCSA-N 0 3 400.519 4.019 20 0 HIADHN c1ccc(COc2ccccc2CN2CCC[C@H](c3nnc4n3CCCCC4)C2)nc1 ZINC000506667246 915343499 /nfs/dbraw/zinc/34/34/99/915343499.db2.gz AUGCVAPBKHTMFS-NRFANRHFSA-N 0 3 417.557 4.358 20 0 HIADHN CCCNC(=O)C1CCN(Cc2cn(-c3ccccc3)nc2-c2ccc(C)o2)CC1 ZINC000506668673 915345145 /nfs/dbraw/zinc/34/51/45/915345145.db2.gz LJENOCYMSNPZHE-UHFFFAOYSA-N 0 3 406.530 4.179 20 0 HIADHN Cc1ccccc1-c1nn(-c2ccccc2)cc1CN1CCC(NC(=O)C2CC2)CC1 ZINC000506671352 915347181 /nfs/dbraw/zinc/34/71/81/915347181.db2.gz YCABOKBVLCEOMO-UHFFFAOYSA-N 0 3 414.553 4.338 20 0 HIADHN COCCOc1cc2c(cc1CN1CCC(c3c[nH]c4ccccc43)CC1)OCO2 ZINC000506687041 915364021 /nfs/dbraw/zinc/36/40/21/915364021.db2.gz JNTIOLAZUZRZAJ-UHFFFAOYSA-N 0 3 408.498 4.301 20 0 HIADHN Cn1cc(CN2CCN(C3c4ccccc4-c4ccccc43)CC2)c(-c2ccncc2)n1 ZINC000506690433 915369479 /nfs/dbraw/zinc/36/94/79/915369479.db2.gz RDQNDAJPHXJHEH-UHFFFAOYSA-N 0 3 421.548 4.370 20 0 HIADHN CN(C)C(=O)CC1CCN(Cc2cccc(NC(=O)c3ccc(Cl)cc3)c2)CC1 ZINC000513397467 921767058 /nfs/dbraw/zinc/76/70/58/921767058.db2.gz VGAIPTMYYQITQM-UHFFFAOYSA-N 0 3 413.949 4.283 20 0 HIADHN CCOc1ccc([C@@H]2CCCN2Cc2ccccc2OCC(=O)N2CCCC2)cc1 ZINC000506705278 915381316 /nfs/dbraw/zinc/38/13/16/915381316.db2.gz BKVCHXBGVZSFNG-QHCPKHFHSA-N 0 3 408.542 4.424 20 0 HIADHN COc1ccc(CN2CCC(C(=O)NCc3ccccc3)CC2)cc1OCC(C)C ZINC000506722358 915404798 /nfs/dbraw/zinc/40/47/98/915404798.db2.gz SYAKYJFGVUEXPS-UHFFFAOYSA-N 0 3 410.558 4.258 20 0 HIADHN O=C(NCc1ccccc1)C1CCN(Cc2ccccc2OCc2ccncc2)CC1 ZINC000506733734 915418316 /nfs/dbraw/zinc/41/83/16/915418316.db2.gz FZPFSBSGVWBGMN-UHFFFAOYSA-N 0 3 415.537 4.189 20 0 HIADHN CCOC(=O)c1sc2ncnc(NC[C@H](c3ccc(C)o3)N3CCCC3)c2c1C ZINC000506742271 915428441 /nfs/dbraw/zinc/42/84/41/915428441.db2.gz LYLVWHYLHVXAIZ-OAHLLOKOSA-N 0 3 414.531 4.327 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CN1CCC(C(=O)Nc2ccccc2)CC1 ZINC000506742840 915431828 /nfs/dbraw/zinc/43/18/28/915431828.db2.gz JCTWVGSRFYVRSQ-UHFFFAOYSA-N 0 3 402.542 4.399 20 0 HIADHN CN(C)Cc1cccc(NC(=O)[C@H]2CCCN2C(=O)c2ccc(Cl)c(Cl)c2)c1 ZINC000506771875 915482366 /nfs/dbraw/zinc/48/23/66/915482366.db2.gz AKLPPCFTALARKU-LJQANCHMSA-N 0 3 420.340 4.298 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)NCCCO[C@@H]1CCCc2ccccc21 ZINC000506827198 915595257 /nfs/dbraw/zinc/59/52/57/915595257.db2.gz PVMZWTDOJPMGHJ-XMMPIXPASA-N 0 3 409.574 4.244 20 0 HIADHN COc1ccc([C@H](C)NC(=O)N[C@@H]2CCN(Cc3ccccc3)[C@@H]2C)c(C)c1OC ZINC000513418669 921786551 /nfs/dbraw/zinc/78/65/51/921786551.db2.gz CAGOAASCOSWMEX-WAOWUJCRSA-N 0 3 411.546 4.035 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)CSc1nc2ccccc2n1CC)c1ccsc1 ZINC000507051424 915842348 /nfs/dbraw/zinc/84/23/48/915842348.db2.gz JEMQKPPOGYDHJK-IBGZPJMESA-N 0 3 416.616 4.409 20 0 HIADHN COc1cc(CN2CCC[C@H](C(=O)NCC3CC3)C2)ccc1OCc1ccccc1 ZINC000507075884 915855189 /nfs/dbraw/zinc/85/51/89/915855189.db2.gz DOMKSKARZAOUBM-QFIPXVFZSA-N 0 3 408.542 4.012 20 0 HIADHN Cc1nn(-c2ccccc2)cc1CN1CCC(C(=O)NCc2ccc(C)c(F)c2)CC1 ZINC000507132202 915882899 /nfs/dbraw/zinc/88/28/99/915882899.db2.gz JMCUHMWICHZQSP-UHFFFAOYSA-N 0 3 420.532 4.157 20 0 HIADHN CCCn1nccc1C1CCN(C(=O)NCC(C)(C)N2CCc3ccccc3C2)CC1 ZINC000507136833 915884946 /nfs/dbraw/zinc/88/49/46/915884946.db2.gz UOSLCVOMBGKELA-UHFFFAOYSA-N 0 3 423.605 4.019 20 0 HIADHN COc1ccc2c(c1)CCC[C@H]2N(C)Cc1ccccc1OCC(=O)NCC1CC1 ZINC000507158779 915896737 /nfs/dbraw/zinc/89/67/37/915896737.db2.gz FSUXMKYMBALQHD-HSZRJFAPSA-N 0 3 408.542 4.110 20 0 HIADHN O=C(CN1CCC(Cc2ccc(F)cc2)CC1)N1CCC(OCc2ccccc2)CC1 ZINC000507198417 915947814 /nfs/dbraw/zinc/94/78/14/915947814.db2.gz WLNSXIYLXCXLLD-UHFFFAOYSA-N 0 3 424.560 4.288 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc2n[nH]cc2c1)C(=O)N(C)Cc1ccc(Br)cc1 ZINC000507227385 915980867 /nfs/dbraw/zinc/98/08/67/915980867.db2.gz HVXSWJVBBOQXPL-UONOGXRCSA-N 0 3 415.335 4.023 20 0 HIADHN CCCn1nccc1C1CCN(C(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)CC1 ZINC000507236568 915995535 /nfs/dbraw/zinc/99/55/35/915995535.db2.gz SJXOXQIUZTUEDC-DEOSSOPVSA-N 0 3 423.605 4.328 20 0 HIADHN Cc1cc(C(=O)N2CCC(CN3C[C@@H](C)O[C@H](C)C3)CC2)c(C)cc1Br ZINC000507291210 916059503 /nfs/dbraw/zinc/05/95/03/916059503.db2.gz VRTMSVNKSDAWMR-IAGOWNOFSA-N 0 3 423.395 4.027 20 0 HIADHN CCOC(=O)CC1CCN(Cc2cn(Cc3ccccc3)nc2-c2cccnc2)CC1 ZINC000507333644 916090352 /nfs/dbraw/zinc/09/03/52/916090352.db2.gz MQWVHDXSVRVBIO-UHFFFAOYSA-N 0 3 418.541 4.159 20 0 HIADHN CCOC(=O)C1CCN(C(=O)[C@@H](C)N[C@H](C)c2ccc(SC(C)C)cc2)CC1 ZINC000507487854 916255171 /nfs/dbraw/zinc/25/51/71/916255171.db2.gz SKXOZMSPAWYMAL-IAGOWNOFSA-N 0 3 406.592 4.028 20 0 HIADHN CC(=O)Nc1ccc(CCN[C@H](C(=O)Nc2ccc(F)cc2)c2ccccc2)cc1 ZINC000507500176 916265841 /nfs/dbraw/zinc/26/58/41/916265841.db2.gz HGJGMHWGFLHHRH-QHCPKHFHSA-N 0 3 405.473 4.296 20 0 HIADHN CCSc1ccc([C@H](C)N[C@H](C)C(=O)NCc2ccc(OC)c(OC)c2)cc1 ZINC000507537920 916294876 /nfs/dbraw/zinc/29/48/76/916294876.db2.gz SSJIUTWFQHAXKF-JKSUJKDBSA-N 0 3 402.560 4.171 20 0 HIADHN COc1ccc(C)cc1NC(=O)[C@@H](C)N(C)CCCc1cc(-c2ccccc2)n[nH]1 ZINC000507564273 916320427 /nfs/dbraw/zinc/32/04/27/916320427.db2.gz JTRYMVYRDVWNFL-GOSISDBHSA-N 0 3 406.530 4.285 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)COc2ccc(Cl)c3cccnc23)C1 ZINC000507599138 916353348 /nfs/dbraw/zinc/35/33/48/916353348.db2.gz WLLDKLICXADIEG-WMZOPIPTSA-N 0 3 409.917 4.219 20 0 HIADHN C[C@H](N[C@@H]1CCc2nnc(-c3ccc(F)cc3)n2C1)c1nc2ccc(Cl)cc2n1C ZINC000507610001 916368002 /nfs/dbraw/zinc/36/80/02/916368002.db2.gz GULZWSBQABEKEV-SUMWQHHRSA-N 0 3 424.911 4.290 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)c2cc3cc(Br)ccc3[nH]2)C1 ZINC000507614820 916371980 /nfs/dbraw/zinc/37/19/80/916371980.db2.gz WSLQOOCLEOKAAL-KDOFPFPSSA-N 0 3 412.331 4.496 20 0 HIADHN CC[C@H]1C[C@@H](CN2CCN(Cc3csc(-c4ccc(OC)cc4)n3)CC2)CCO1 ZINC000507615849 916374207 /nfs/dbraw/zinc/37/42/07/916374207.db2.gz BNCFMPVXTJUOHR-RXVVDRJESA-N 0 3 415.603 4.142 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)CCCc2nc(-c3ccc(F)cc3)no2)C1 ZINC000507616991 916375281 /nfs/dbraw/zinc/37/52/81/916375281.db2.gz MWUDGBXXIIWNMD-DYESRHJHSA-N 0 3 422.504 4.150 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3csc(C4CC4)n3)c(OCC)c2)CC1 ZINC000507623724 916382956 /nfs/dbraw/zinc/38/29/56/916382956.db2.gz WPCMHCNVSPZMDH-UHFFFAOYSA-N 0 3 414.575 4.204 20 0 HIADHN Cc1cc(C)n(-c2ccc(Cl)c(C(=O)N[C@@H]3CCN([C@H](C)c4ccccc4)C3)n2)n1 ZINC000507627907 916385362 /nfs/dbraw/zinc/38/53/62/916385362.db2.gz BWYZWNJDWGIOPG-IEBWSBKVSA-N 0 3 423.948 4.103 20 0 HIADHN CC(C)Sc1cc(Br)ccc1CN1CC[C@@H](CN2CCOCC2)C1 ZINC000507817400 916612309 /nfs/dbraw/zinc/61/23/09/916612309.db2.gz ZCJAKEXOPPGDJE-INIZCTEOSA-N 0 3 413.425 4.104 20 0 HIADHN COc1cc(CN[C@H]2CC(=O)N(C)[C@H]2c2ccc(Cl)cc2)ccc1OC(F)F ZINC000507834479 916635105 /nfs/dbraw/zinc/63/51/05/916635105.db2.gz RJCJKTBXUKIADA-KXBFYZLASA-N 0 3 410.848 4.012 20 0 HIADHN CC(C)(CN[C@H](C(=O)NC1CC1)c1ccccc1)c1cccc(Br)c1 ZINC000507847444 916662221 /nfs/dbraw/zinc/66/22/21/916662221.db2.gz ZFORCSLQEXHCAR-IBGZPJMESA-N 0 3 401.348 4.336 20 0 HIADHN Fc1ccc(-c2nnc3n2C[C@H](NCc2ccccc2OC(F)(F)F)CC3)cc1 ZINC000507869441 916705771 /nfs/dbraw/zinc/70/57/71/916705771.db2.gz ZAVVHVQFGHUNTI-MRXNPFEDSA-N 0 3 406.383 4.087 20 0 HIADHN Cc1ccc(NC(=O)[C@H]2CCCN(Cc3ccccc3OCc3ccccn3)C2)nc1 ZINC000507995831 916837291 /nfs/dbraw/zinc/83/72/91/916837291.db2.gz ZQNXXNVSANDTSJ-NRFANRHFSA-N 0 3 416.525 4.215 20 0 HIADHN COc1ccc2nc(C3CC3)cc(C(=O)N(CCN(C)C)Cc3cccs3)c2c1 ZINC000507999014 916839629 /nfs/dbraw/zinc/83/96/29/916839629.db2.gz JQLXXZFCMRGSSV-UHFFFAOYSA-N 0 3 409.555 4.386 20 0 HIADHN COc1ccc2nc(C3CC3)cc(C(=O)N(CCN(C)C)Cc3ccc(C)o3)c2c1 ZINC000508008992 916847749 /nfs/dbraw/zinc/84/77/49/916847749.db2.gz QJEGHBHXOHQDDO-UHFFFAOYSA-N 0 3 407.514 4.226 20 0 HIADHN O=C(Cc1ccc(Cl)cc1Cl)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000508073548 916895141 /nfs/dbraw/zinc/89/51/41/916895141.db2.gz XJGPAJZUBDDJNQ-UHFFFAOYSA-N 0 3 407.341 4.379 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)NC[C@H](c1ccc(Cl)cc1)C(C)C ZINC000508162122 916983196 /nfs/dbraw/zinc/98/31/96/916983196.db2.gz LTHSSNFEQABFER-FQEVSTJZSA-N 0 3 415.965 4.205 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)NC[C@@H](c1ccc(Cl)cc1)C(C)C ZINC000508162123 916983459 /nfs/dbraw/zinc/98/34/59/916983459.db2.gz LTHSSNFEQABFER-HXUWFJFHSA-N 0 3 415.965 4.205 20 0 HIADHN CN1CCN(Cc2ccc(CNC(=O)N(Cc3ccccc3)CC(C)(C)C)cc2)CC1 ZINC000508180908 917001613 /nfs/dbraw/zinc/00/16/13/917001613.db2.gz ZUEGIOBKHSKZGX-UHFFFAOYSA-N 0 3 422.617 4.192 20 0 HIADHN CCN(CCCN1CCCC1)C(=O)c1cc(F)c(F)cc1C(=O)c1ccccc1 ZINC000508184861 917006431 /nfs/dbraw/zinc/00/64/31/917006431.db2.gz ZXOREZHXEHXASA-UHFFFAOYSA-N 0 3 400.469 4.144 20 0 HIADHN C[C@@H](C(=O)Nc1c(-c2ccc(Br)cc2)ncn1C)N1CCCCCC1 ZINC000508399372 917191446 /nfs/dbraw/zinc/19/14/46/917191446.db2.gz PHKPNVKJENYITF-AWEZNQCLSA-N 0 3 405.340 4.053 20 0 HIADHN CC(=O)Nc1cc(NC(=O)[C@H]2CN(Cc3ccccc3)CCC2(F)F)ccc1Cl ZINC000508441197 917227275 /nfs/dbraw/zinc/22/72/75/917227275.db2.gz GCUIGFPUIJOHOL-QGZVFWFLSA-N 0 3 421.875 4.394 20 0 HIADHN COCCSc1ccc([C@@H](C)NC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000508562758 917337956 /nfs/dbraw/zinc/33/79/56/917337956.db2.gz WYWOFCJUVFUNIS-WIYYLYMNSA-N 0 3 413.587 4.060 20 0 HIADHN Cn1ccnc1C[C@@H]1CCCN(Cc2cc(Cl)ccc2OC[C@@H]2CCCO2)C1 ZINC000508638978 917403107 /nfs/dbraw/zinc/40/31/07/917403107.db2.gz PRHKQWSAKDMESI-PXNSSMCTSA-N 0 3 403.954 4.086 20 0 HIADHN CCc1ccccc1NC(=O)CN1[C@H](C)C[C@H](C(=O)N[C@H](C)CC)[C@H]2CCCC[C@H]21 ZINC000508657493 917423544 /nfs/dbraw/zinc/42/35/44/917423544.db2.gz SHHNAXFQAGOFGE-XLQGDHTPSA-N 0 3 413.606 4.371 20 0 HIADHN Brc1ccc2c(c1)OCCC[C@@H]2NCc1ccccc1Cn1cncn1 ZINC000508750383 917508662 /nfs/dbraw/zinc/50/86/62/917508662.db2.gz YWQXLOJLLZDIBI-IBGZPJMESA-N 0 3 413.319 4.092 20 0 HIADHN O=C(NCc1nc2ccccc2s1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000508768101 917522625 /nfs/dbraw/zinc/52/26/25/917522625.db2.gz FEYLLRKIXSXBCM-HXUWFJFHSA-N 0 3 419.472 4.367 20 0 HIADHN C[C@H](NC(=O)N1CC=C(c2c[nH]c3ncccc23)CC1)[C@H](c1ccccc1)N(C)C ZINC000508890514 917645437 /nfs/dbraw/zinc/64/54/37/917645437.db2.gz ACTDKTQNQPDJOF-HTAPYJJXSA-N 0 3 403.530 4.053 20 0 HIADHN C[C@@H](NC(=O)N1CC=C(c2c[nH]c3ncccc23)CC1)[C@@H](c1ccccc1)N(C)C ZINC000508890517 917645667 /nfs/dbraw/zinc/64/56/67/917645667.db2.gz ACTDKTQNQPDJOF-VGSWGCGISA-N 0 3 403.530 4.053 20 0 HIADHN COCCOc1ccc(NC(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)cc1Cl ZINC000508893031 917647684 /nfs/dbraw/zinc/64/76/84/917647684.db2.gz DLOZARSFGLWYEJ-MGPUTAFESA-N 0 3 405.926 4.178 20 0 HIADHN COc1ccc(CN(C)C(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)cc1OC(F)F ZINC000508892325 917648032 /nfs/dbraw/zinc/64/80/32/917648032.db2.gz CGKXFQXIHGSMQI-FOIQADDNSA-N 0 3 421.488 4.129 20 0 HIADHN C[C@H](NC(=O)N(CCCO)[C@@H]1CCCc2ccccc21)[C@@H](c1ccccc1)N(C)C ZINC000508894222 917649229 /nfs/dbraw/zinc/64/92/29/917649229.db2.gz FYLDZKTXYWSXBV-IEXUWNMDSA-N 0 3 409.574 4.149 20 0 HIADHN C[C@@H](NC(=O)N(C)Cc1ccccc1Br)[C@@H](c1ccccc1)N(C)C ZINC000508898517 917654814 /nfs/dbraw/zinc/65/48/14/917654814.db2.gz LQVZAZCQWBIKCW-BEFAXECRSA-N 0 3 404.352 4.282 20 0 HIADHN C[C@H](NC(=O)N1CCC(OCCc2ccccc2)CC1)[C@H](c1ccccc1)N(C)C ZINC000508902382 917658269 /nfs/dbraw/zinc/65/82/69/917658269.db2.gz DBNWMXRGAFFKIT-GBXCKJPGSA-N 0 3 409.574 4.111 20 0 HIADHN CCOc1cccc(CNC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)c1 ZINC000508974120 917728519 /nfs/dbraw/zinc/72/85/19/917728519.db2.gz AVLGUBJECSEMMU-NRFANRHFSA-N 0 3 406.448 4.156 20 0 HIADHN CCC(=O)Nc1ccc(NC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)cc1 ZINC000508986213 917740470 /nfs/dbraw/zinc/74/04/70/917740470.db2.gz JEFKXXSXPQWMBQ-OAQYLSRUSA-N 0 3 419.447 4.428 20 0 HIADHN O=C(Cc1csc(Cc2ccccc2)n1)NC[C@H](c1ccccc1)N1CCCC1 ZINC000509087796 917829523 /nfs/dbraw/zinc/82/95/23/917829523.db2.gz UJUWVNMEHWBPHM-JOCHJYFZSA-N 0 3 405.567 4.230 20 0 HIADHN O=C(N1CC[C@H](c2ccccc2)C1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000509142378 917867907 /nfs/dbraw/zinc/86/79/07/917867907.db2.gz VHYAYCNBXXWFOA-UNMCSNQZSA-N 0 3 402.460 4.457 20 0 HIADHN C[C@@H](c1cccc(N2CCCS2(=O)=O)c1)N(C)Cc1ccccc1C(F)(F)F ZINC000509150079 917871848 /nfs/dbraw/zinc/87/18/48/917871848.db2.gz FKWVICCJAKAWEC-HNNXBMFYSA-N 0 3 412.477 4.438 20 0 HIADHN Cc1nn(-c2ccccc2)cc1CN1CCC[C@@H](C(=O)Nc2ccc(Cl)cn2)C1 ZINC000509357522 918022460 /nfs/dbraw/zinc/02/24/60/918022460.db2.gz LTODAZGRHYMRIQ-QGZVFWFLSA-N 0 3 409.921 4.080 20 0 HIADHN O=C(Nc1ccc(Cl)cn1)[C@H]1CCCN(Cc2ccc(OCC(F)F)cc2)C1 ZINC000509367554 918031554 /nfs/dbraw/zinc/03/15/54/918031554.db2.gz UYCOCABWXMGCHP-HNNXBMFYSA-N 0 3 409.864 4.230 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)N1CCO[C@H](c2ccccc2Cl)C1 ZINC000509367886 918032452 /nfs/dbraw/zinc/03/24/52/918032452.db2.gz XGQVKYXAGVLKLS-VXKWHMMOSA-N 0 3 413.949 4.260 20 0 HIADHN CCOc1cccc(CN2CCC(C(=O)Nc3ccc(Br)cn3)CC2)c1 ZINC000509376138 918042512 /nfs/dbraw/zinc/04/25/12/918042512.db2.gz ZEHVXPFDNZDYOZ-UHFFFAOYSA-N 0 3 418.335 4.094 20 0 HIADHN O=C(Nc1ccc(Cl)cn1)[C@H]1CCCN(Cc2cnc(-c3ccncc3)s2)C1 ZINC000509380484 918046691 /nfs/dbraw/zinc/04/66/91/918046691.db2.gz SZYHNDHFBUGCOP-HNNXBMFYSA-N 0 3 413.934 4.104 20 0 HIADHN O=C(N1CCO[C@H](c2ccccc2)C1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000509421800 918082335 /nfs/dbraw/zinc/08/23/35/918082335.db2.gz IMLKHCKWEULBIR-RBBKRZOGSA-N 0 3 418.459 4.041 20 0 HIADHN Cn1cc(-c2ccc(CN[C@@H]3CC(=O)N(C)[C@@H]3c3ccc(Cl)c(F)c3)s2)cn1 ZINC000509479654 918127031 /nfs/dbraw/zinc/12/70/31/918127031.db2.gz ZQSJVFDJZVHXSU-YLJYHZDGSA-N 0 3 418.925 4.003 20 0 HIADHN Cc1nn(-c2ccccc2)cc1CN1CCC(C(=O)Nc2cc(Cl)ccc2O)CC1 ZINC000509521716 918170886 /nfs/dbraw/zinc/17/08/86/918170886.db2.gz AONSCGCKPSVTDY-UHFFFAOYSA-N 0 3 424.932 4.390 20 0 HIADHN C[C@H]1CCCN(C(=O)C2CCN(Cc3c[nH]nc3-c3cccc(Cl)c3)CC2)C1 ZINC000509542882 918190605 /nfs/dbraw/zinc/19/06/05/918190605.db2.gz NUEFTGIOAVVUHH-INIZCTEOSA-N 0 3 400.954 4.201 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N1CCC[C@H]1c1ccc(OC)cc1OC)c1ccco1 ZINC000509551222 918200673 /nfs/dbraw/zinc/20/06/73/918200673.db2.gz ALVTUEAWPBYTGW-VDGAXYAQSA-N 0 3 415.534 4.273 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)N1CCC(F)(c2cccc(OC)c2)CC1)c1ccco1 ZINC000509568133 918217243 /nfs/dbraw/zinc/21/72/43/918217243.db2.gz LGKUUECTZJDYJY-XLIONFOSSA-N 0 3 417.525 4.388 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N1CCC(C(F)(F)F)(C(F)(F)F)C1)c1ccco1 ZINC000509567826 918217575 /nfs/dbraw/zinc/21/75/75/918217575.db2.gz KUZKDLSVMSCNAR-NWDGAFQWSA-N 0 3 415.378 4.235 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N1CCC(F)(c2cccc(OC)c2)CC1)c1ccco1 ZINC000509568131 918218268 /nfs/dbraw/zinc/21/82/68/918218268.db2.gz LGKUUECTZJDYJY-PXNSSMCTSA-N 0 3 417.525 4.388 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N1CCC[C@H]1c1ccc(OC)c(OC)c1)c1ccco1 ZINC000509576273 918224351 /nfs/dbraw/zinc/22/43/51/918224351.db2.gz DUEKSKZVACLMBM-WDSOQIARSA-N 0 3 415.534 4.273 20 0 HIADHN CC[C@@H](NC(=O)N(CCN(C)C)Cc1cccc(C)c1)c1ccc(OC)c(OC)c1 ZINC000509581390 918230285 /nfs/dbraw/zinc/23/02/85/918230285.db2.gz BUKWUQGKTKHZDC-OAQYLSRUSA-N 0 3 413.562 4.237 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)N(C)Cc1csc(Br)c1)c1ccco1 ZINC000509595660 918244277 /nfs/dbraw/zinc/24/42/77/918244277.db2.gz INHXPZQTBDXTJX-TZMCWYRMSA-N 0 3 414.369 4.374 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N1CCC(c2nc3ccccc3[nH]2)CC1)c1ccco1 ZINC000509597833 918248669 /nfs/dbraw/zinc/24/86/69/918248669.db2.gz ATYCMAGAZAUVKJ-OXJNMPFZSA-N 0 3 409.534 4.174 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N1CCO[C@H](c2cccc(Cl)c2)C1)c1ccco1 ZINC000509603838 918253674 /nfs/dbraw/zinc/25/36/74/918253674.db2.gz RXWRCUVVGIJJEE-QSFXBCCZSA-N 0 3 405.926 4.145 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N1CCO[C@H](c2ccc(F)cc2Cl)C1)c1ccco1 ZINC000509613656 918260035 /nfs/dbraw/zinc/26/00/35/918260035.db2.gz NUIFNMFSIYVMBH-QMIHWGKISA-N 0 3 423.916 4.284 20 0 HIADHN CC[C@@H](NC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(OC)c(OC)c1 ZINC000509613391 918260214 /nfs/dbraw/zinc/26/02/14/918260214.db2.gz LJWAYJXOKKQFBJ-NHCUHLMSSA-N 0 3 411.546 4.071 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)Nc1ccc(OCc2nccn2C)cc1 ZINC000509646970 918286140 /nfs/dbraw/zinc/28/61/40/918286140.db2.gz SNJXLIKLDBIGAU-UHFFFAOYSA-N 0 3 404.470 4.059 20 0 HIADHN COCCCOc1cccc(CN2CCC(NC(=O)Nc3ccc(F)cc3)CC2)c1 ZINC000509746377 918366223 /nfs/dbraw/zinc/36/62/23/918366223.db2.gz NEWURSBDEHQVKV-UHFFFAOYSA-N 0 3 415.509 4.027 20 0 HIADHN CCN(CC(=O)Nc1c(Cl)cccc1Cl)C(=O)[C@@H](C)N1CCCCCC1 ZINC000509827253 918429661 /nfs/dbraw/zinc/42/96/61/918429661.db2.gz TZOCMHUGZJLICZ-CQSZACIVSA-N 0 3 400.350 4.045 20 0 HIADHN CCn1ncc2c1nc(-c1ccccc1)cc2C(=O)N(CC(C)C)C1CCN(C)CC1 ZINC000509922069 918521977 /nfs/dbraw/zinc/52/19/77/918521977.db2.gz CDWFZPFSKXZLEN-UHFFFAOYSA-N 0 3 419.573 4.311 20 0 HIADHN Cc1nn(C)c2nc(-c3ccccc3)cc(C(=O)N(CC(C)C)C3CCN(C)CC3)c12 ZINC000509937283 918534681 /nfs/dbraw/zinc/53/46/81/918534681.db2.gz IGRXHPUIXRUXAJ-UHFFFAOYSA-N 0 3 419.573 4.136 20 0 HIADHN COc1cccc(-c2c[nH]cc2C(=O)NC[C@@H]2CCCCN2Cc2ccccc2)c1 ZINC000509942979 918539953 /nfs/dbraw/zinc/53/99/53/918539953.db2.gz MPNHNEZUQQCMOH-NRFANRHFSA-N 0 3 403.526 4.475 20 0 HIADHN O=C(NCCN1CCC2(CCCCC2)CC1)c1ccc(-c2noc(C(F)F)n2)cc1 ZINC000509982243 918570655 /nfs/dbraw/zinc/57/06/55/918570655.db2.gz MXEXMHKBVKLBNN-UHFFFAOYSA-N 0 3 418.488 4.450 20 0 HIADHN CC(C)[C@@H](CNC(=O)Cc1ccc(Br)s1)N1CCc2ccccc2C1 ZINC000510057265 918627480 /nfs/dbraw/zinc/62/74/80/918627480.db2.gz UBIJTCBGHFIPCS-GOSISDBHSA-N 0 3 421.404 4.252 20 0 HIADHN O=C1COc2ccc(CN[C@H](c3ccc(Br)cc3)C3CCC3)cc2N1 ZINC000510065813 918634765 /nfs/dbraw/zinc/63/47/65/918634765.db2.gz MZCQELGRDCYACA-FQEVSTJZSA-N 0 3 401.304 4.411 20 0 HIADHN O=S(=O)([N-]CCCCC[NH+]1CCCCC1)c1c(Cl)cccc1Br ZINC000510129832 918688112 /nfs/dbraw/zinc/68/81/12/918688112.db2.gz GIOJZEAYQKJKSB-UHFFFAOYSA-N 0 3 423.804 4.037 20 0 HIADHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)Nc1ccc2c(c1)COC2 ZINC000510259065 918792720 /nfs/dbraw/zinc/79/27/20/918792720.db2.gz TVVHCQFVVRRFCF-UHFFFAOYSA-N 0 3 418.335 4.075 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3ccc(NC(=O)CC(C)C)cc3)cc2)CC1 ZINC000510355552 918849828 /nfs/dbraw/zinc/84/98/28/918849828.db2.gz SNLGUQHCWDXXFP-UHFFFAOYSA-N 0 3 408.546 4.065 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N[C@H](C)c3ccc(C(F)(F)F)cc3)cc2)CC1 ZINC000510375782 918860861 /nfs/dbraw/zinc/86/08/61/918860861.db2.gz HBHJZBFJDJJBLK-MRXNPFEDSA-N 0 3 405.464 4.338 20 0 HIADHN CC1CCN(C(=O)C2CCN(Cc3ccc(OCc4ccncc4)cc3)CC2)CC1 ZINC000510388020 918866816 /nfs/dbraw/zinc/86/68/16/918866816.db2.gz YZWNZLSAPFMFTF-UHFFFAOYSA-N 0 3 407.558 4.131 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)NCc1ccc(NC(=O)c2ccco2)cc1 ZINC000510399453 918873494 /nfs/dbraw/zinc/87/34/94/918873494.db2.gz AMTCABSXRCTKMA-UHFFFAOYSA-N 0 3 417.465 4.270 20 0 HIADHN CC(C)c1nn(-c2ccccc2)cc1CN1CCC(C(=O)N2CCC(C)CC2)CC1 ZINC000510417127 918885138 /nfs/dbraw/zinc/88/51/38/918885138.db2.gz UVIBIPGBEYEKQU-UHFFFAOYSA-N 0 3 408.590 4.466 20 0 HIADHN CCCCN(C)C(=O)C1CCN(Cc2c(C)nn(-c3ccc(F)cc3F)c2C)CC1 ZINC000510429698 918892615 /nfs/dbraw/zinc/89/26/15/918892615.db2.gz NGYATCJMRDPETA-UHFFFAOYSA-N 0 3 418.532 4.238 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)NCCOc1cccc(Br)c1 ZINC000510471652 918926550 /nfs/dbraw/zinc/92/65/50/918926550.db2.gz MCJVWHSILXCLRD-UHFFFAOYSA-N 0 3 417.303 4.066 20 0 HIADHN Cc1n[nH]c(C)c1[C@@H]1CCCCCN1C(=O)N[C@H](CN1CCCC1)c1ccccc1 ZINC000510502667 918950983 /nfs/dbraw/zinc/95/09/83/918950983.db2.gz PRKTWLXWPUIXLO-YADHBBJMSA-N 0 3 409.578 4.490 20 0 HIADHN C[C@H]1CN(C2CCN(Cc3ccc(-c4ccc(Br)cc4)o3)CC2)CCO1 ZINC000510509597 918956147 /nfs/dbraw/zinc/95/61/47/918956147.db2.gz WIHGUHXJQCFYTB-INIZCTEOSA-N 0 3 419.363 4.394 20 0 HIADHN C[C@@H]1CN(C2CCN(Cc3cn(-c4ccccc4)nc3-c3cccs3)CC2)CCO1 ZINC000510524246 918969864 /nfs/dbraw/zinc/96/98/64/918969864.db2.gz WZYXIQPQODZVEI-LJQANCHMSA-N 0 3 422.598 4.286 20 0 HIADHN COc1ccc([C@H](Cc2ccc(F)cc2)NC(=O)N[C@@H](C)C2=CCN(C)CC2)cc1 ZINC000510526002 918971560 /nfs/dbraw/zinc/97/15/60/918971560.db2.gz OJWCQSUMVRTKRC-SBUREZEXSA-N 0 3 411.521 4.068 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CC[C@@H](n2ncc3ccccc32)C1)c1ccsc1 ZINC000510539927 918985285 /nfs/dbraw/zinc/98/52/85/918985285.db2.gz OECCBGMSGHWMEV-TZIWHRDSSA-N 0 3 411.575 4.137 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CC[C@@H](n2ncc3ccccc32)C1)c1ccsc1 ZINC000510539920 918985456 /nfs/dbraw/zinc/98/54/56/918985456.db2.gz OECCBGMSGHWMEV-CTNGQTDRSA-N 0 3 411.575 4.137 20 0 HIADHN COc1cc([C@@H](C)NC(=O)N[C@@H](C)C2=CCN(C)CC2)ccc1OCc1ccccc1 ZINC000510541908 918986452 /nfs/dbraw/zinc/98/64/52/918986452.db2.gz VPNPMZNLVMLRDA-RBUKOAKNSA-N 0 3 423.557 4.285 20 0 HIADHN Cc1ccccc1C1(CNC(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)CCOCC1 ZINC000510549589 918993848 /nfs/dbraw/zinc/99/38/48/918993848.db2.gz MRSYGRFNDASPCI-FYYLOGMGSA-N 0 3 421.585 4.178 20 0 HIADHN C[C@H]1CN(C2CCN(Cc3ccc(-c4cccc(Br)c4)o3)CC2)CCO1 ZINC000510561165 919004023 /nfs/dbraw/zinc/00/40/23/919004023.db2.gz UTNLTIBGTXQELJ-INIZCTEOSA-N 0 3 419.363 4.394 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCCCOc3ccc(C)cc3)c(C)c2)CC1 ZINC000510616235 919057649 /nfs/dbraw/zinc/05/76/49/919057649.db2.gz QDXQLTDBUQTATO-UHFFFAOYSA-N 0 3 410.562 4.036 20 0 HIADHN FC(F)Cn1cc(CNCc2ccccc2-c2ccc(Cn3cccn3)cc2)cn1 ZINC000510635043 919076229 /nfs/dbraw/zinc/07/62/29/919076229.db2.gz VUZHDLGXQVBCTJ-UHFFFAOYSA-N 0 3 407.468 4.350 20 0 HIADHN COc1c(Cl)cccc1NC(=O)NCCCCN1CCN(c2ccccc2)CC1 ZINC000510674871 919114922 /nfs/dbraw/zinc/11/49/22/919114922.db2.gz MLTRDFCIVJSZGG-UHFFFAOYSA-N 0 3 416.953 4.073 20 0 HIADHN Cc1cc(OCCC[C@@H](C)Nc2cc(C(N)=O)ccc2CN(C)C)ccc1Cl ZINC000510740617 919186497 /nfs/dbraw/zinc/18/64/97/919186497.db2.gz VDCIIBVRCJUJGO-MRXNPFEDSA-N 0 3 403.954 4.469 20 0 HIADHN C[C@@H](CC1CCCCC1)C(=O)N1CCC[C@@H](CN2CCN(c3ccccn3)CC2)C1 ZINC000510783708 919246982 /nfs/dbraw/zinc/24/69/82/919246982.db2.gz STGKSCWNFZNIOV-GMAHTHKFSA-N 0 3 412.622 4.049 20 0 HIADHN C[C@H](NC(=O)c1nn(-c2ccc(Cl)cc2Cl)c2c1CCC2)C1=CCN(C)CC1 ZINC000510799304 919270080 /nfs/dbraw/zinc/27/00/80/919270080.db2.gz NQEPTZFBHDOGDF-ZDUSSCGKSA-N 0 3 419.356 4.048 20 0 HIADHN COc1ccc(C[C@H](NCC(=O)N(C)c2ccccc2)c2ccc(OC)cc2)cc1 ZINC000510856261 919345873 /nfs/dbraw/zinc/34/58/73/919345873.db2.gz GFIIFKDNHVSGMF-DEOSSOPVSA-N 0 3 404.510 4.240 20 0 HIADHN O=C([C@@H]1CN(Cc2ccccc2)CCC1(F)F)N(Cc1cc[nH]n1)Cc1ccccc1 ZINC000510857220 919347296 /nfs/dbraw/zinc/34/72/96/919347296.db2.gz MENAADCADPYTTN-QFIPXVFZSA-N 0 3 424.495 4.096 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N[C@H]1CCc2cc(F)c(OC)cc21)c1ccsc1 ZINC000510860584 919350783 /nfs/dbraw/zinc/35/07/83/919350783.db2.gz LPXUPLWWQNXFOQ-OALUTQOASA-N 0 3 405.539 4.265 20 0 HIADHN CC(C)[C@H](CNC(=O)Nc1ccc(-c2csnn2)cc1)N1CCc2ccccc2C1 ZINC000510875136 919368873 /nfs/dbraw/zinc/36/88/73/919368873.db2.gz VLJPSDGXQHDCAA-QFIPXVFZSA-N 0 3 421.570 4.410 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)Nc1ccc(-c2nnc3n2CCCC3)cc1 ZINC000510896401 919393076 /nfs/dbraw/zinc/39/30/76/919393076.db2.gz SLUNBJMNEPXYGE-UHFFFAOYSA-N 0 3 415.497 4.342 20 0 HIADHN CC(C)CN(C(=O)c1ccn(-c2ccc(Cl)c(Cl)c2)n1)C1CCN(C)CC1 ZINC000511058776 919655351 /nfs/dbraw/zinc/65/53/51/919655351.db2.gz ZUXMCPZKPVYVLT-UHFFFAOYSA-N 0 3 409.361 4.372 20 0 HIADHN Cc1cccn2c(=O)cc(CN(Cc3ccccc3C(F)(F)F)CC3CC3)nc12 ZINC000511097810 919701430 /nfs/dbraw/zinc/70/14/30/919701430.db2.gz XUYNNESSVAHWFW-UHFFFAOYSA-N 0 3 401.432 4.434 20 0 HIADHN Cn1nccc1C1=CCN(CCC(=O)Nc2ccccc2Oc2ccccc2)CC1 ZINC000511119613 919731178 /nfs/dbraw/zinc/73/11/78/919731178.db2.gz AUBCYZFNGHYCRZ-UHFFFAOYSA-N 0 3 402.498 4.330 20 0 HIADHN Cn1nccc1C1=CCN(CCC(=O)Nc2ccc(Oc3ccccc3)cc2)CC1 ZINC000511123669 919735630 /nfs/dbraw/zinc/73/56/30/919735630.db2.gz PXSVYVPJMWWURW-UHFFFAOYSA-N 0 3 402.498 4.330 20 0 HIADHN O=C(Nc1cc(F)c(Br)cc1F)N1CCN(C2CCCCC2)CC1 ZINC000511138913 919757630 /nfs/dbraw/zinc/75/76/30/919757630.db2.gz JYCGKGWAZULCJE-UHFFFAOYSA-N 0 3 402.283 4.210 20 0 HIADHN O=C(CCN1CCC(c2ccccc2C(F)(F)F)CC1)NCC(=O)c1ccccc1 ZINC000511159600 919780425 /nfs/dbraw/zinc/78/04/25/919780425.db2.gz HUWDOJRLNRJZDI-UHFFFAOYSA-N 0 3 418.459 4.274 20 0 HIADHN C[C@@H](NC(=O)Nc1ccc(NC(=O)c2ccc(Cl)cc2)cc1)C1=CCN(C)CC1 ZINC000511263337 919861718 /nfs/dbraw/zinc/86/17/18/919861718.db2.gz AODKWRPNFGCSBW-OAHLLOKOSA-N 0 3 412.921 4.364 20 0 HIADHN COc1cc(CN(C)C(=O)N[C@@H](C)C2=CCN(C)CC2)ccc1OCc1ccccc1 ZINC000511276388 919872966 /nfs/dbraw/zinc/87/29/66/919872966.db2.gz ZIHMQJXRGWOSIU-IBGZPJMESA-N 0 3 423.557 4.066 20 0 HIADHN CC(C)NC(=O)c1ccc(NC(=O)NC[C@@H](C(C)C)N2CCc3ccccc3C2)cc1 ZINC000511280620 919875900 /nfs/dbraw/zinc/87/59/00/919875900.db2.gz ZXWCOEKVLRCRRU-QHCPKHFHSA-N 0 3 422.573 4.029 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1c2cc(Br)ccc2SC[C@H]1C)C1=CCN(C)CC1 ZINC000511292010 919888386 /nfs/dbraw/zinc/88/83/86/919888386.db2.gz WOAWLDAOZAZXKJ-VBHSOAQHSA-N 0 3 424.408 4.182 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1c2cc(Br)ccc2SC[C@@H]1C)C1=CCN(C)CC1 ZINC000511292009 919888459 /nfs/dbraw/zinc/88/84/59/919888459.db2.gz WOAWLDAOZAZXKJ-LXIYXOSZSA-N 0 3 424.408 4.182 20 0 HIADHN C[C@@H](NC(=O)c1cc(-c2ccco2)n(-c2cccc(Cl)c2)n1)C1=CCN(C)CC1 ZINC000511343681 919934867 /nfs/dbraw/zinc/93/48/67/919934867.db2.gz KOESFYZQTVHKRB-OAHLLOKOSA-N 0 3 410.905 4.166 20 0 HIADHN Cc1ccccc1-c1nn(-c2ccccc2)cc1C(=O)N[C@H](C)C1=CCN(C)CC1 ZINC000511356429 919951151 /nfs/dbraw/zinc/95/11/51/919951151.db2.gz CLMRNLSJMYZFKE-LJQANCHMSA-N 0 3 400.526 4.228 20 0 HIADHN C[C@@H](NC(=O)c1ccc(SCc2cn3ccccc3n2)cc1)C1=CCN(C)CC1 ZINC000511370926 919963508 /nfs/dbraw/zinc/96/35/08/919963508.db2.gz VYEZWBNZDXJDPF-QGZVFWFLSA-N 0 3 406.555 4.007 20 0 HIADHN O=C(N[C@@H](C[C@H]1CCOC1)c1ccccc1)N1CCCN(Cc2ccccc2)CC1 ZINC000511390290 919996501 /nfs/dbraw/zinc/99/65/01/919996501.db2.gz HVEPNUHQIFUUPQ-VWNXMTODSA-N 0 3 407.558 4.072 20 0 HIADHN CC[C@@H](NC(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F)c1nc2ccccc2[nH]1 ZINC000511493611 920104057 /nfs/dbraw/zinc/10/40/57/920104057.db2.gz MHSPBPFHWLBZQR-QZTJIDSGSA-N 0 3 412.484 4.288 20 0 HIADHN Cc1cc(C(=O)NC[C@H](c2ccccc2)N(C)C)c2cc(Br)ccc2n1 ZINC000511514904 920133459 /nfs/dbraw/zinc/13/34/59/920133459.db2.gz UIVSJWLDZJZDKT-HXUWFJFHSA-N 0 3 412.331 4.338 20 0 HIADHN Cc1cnc([C@@H](C)NC2CCC(NC(=O)COc3ccc(Cl)cc3)CC2)s1 ZINC000511526339 920146196 /nfs/dbraw/zinc/14/61/96/920146196.db2.gz NYDOLSFCZLBKJP-ODIFPOPNSA-N 0 3 407.967 4.262 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)c1cnn(C2CCCCC2)c1C ZINC000511541835 920166547 /nfs/dbraw/zinc/16/65/47/920166547.db2.gz QMJSXMRBFCNFIJ-QFIPXVFZSA-N 0 3 409.578 4.218 20 0 HIADHN O=C(Nc1ccc(C(=O)N2CCCCCC2)cc1)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000511563922 920205411 /nfs/dbraw/zinc/20/54/11/920205411.db2.gz CVXUTEPEHQTBQJ-QHCPKHFHSA-N 0 3 420.557 4.099 20 0 HIADHN CN(C)[C@@H](CNC(=O)C1CCC(NC(=O)CC2CCCCC2)CC1)c1ccccc1 ZINC000511577981 920222097 /nfs/dbraw/zinc/22/20/97/920222097.db2.gz GJEOWFOBQQJKEI-VNXZQDSDSA-N 0 3 413.606 4.051 20 0 HIADHN CC(C)N(CC(F)(F)F)C(=O)CN[C@@H](c1cccc(OC(F)(F)F)c1)C1CC1 ZINC000511607958 920257780 /nfs/dbraw/zinc/25/77/80/920257780.db2.gz ADWQJJPQYXPELG-MRXNPFEDSA-N 0 3 412.374 4.425 20 0 HIADHN Cc1cc(C)n(-c2ccc(CN[C@](C)(CO)c3ccc(Br)cc3)cc2)n1 ZINC000511621831 920276723 /nfs/dbraw/zinc/27/67/23/920276723.db2.gz HYSRCANTVLCXEK-OAQYLSRUSA-N 0 3 414.347 4.249 20 0 HIADHN O=C(CCN1CC[C@@H](C(F)(F)F)[C@@H](CO)C1)Nc1ccc(Oc2ccccc2)cc1 ZINC000511663075 920327561 /nfs/dbraw/zinc/32/75/61/920327561.db2.gz BVIHNEMWRIUCNR-OXQOHEQNSA-N 0 3 422.447 4.300 20 0 HIADHN COc1cccc([C@@H](CNc2ncc(C(=O)N3CCCCC3)cc2Cl)N(C)C)c1 ZINC000511705450 920369273 /nfs/dbraw/zinc/36/92/73/920369273.db2.gz DUTYPIRENCJJQN-HXUWFJFHSA-N 0 3 416.953 4.085 20 0 HIADHN Fc1ccccc1[C@H]1CC[C@H](NCc2ncc(I)s2)C1 ZINC000511764348 920446955 /nfs/dbraw/zinc/44/69/55/920446955.db2.gz DULUCOTVRZBJDX-QWRGUYRKSA-N 0 3 402.276 4.313 20 0 HIADHN Fc1cccc([C@@H]2CC[C@H](NCc3ncc(I)s3)C2)c1 ZINC000511763797 920447291 /nfs/dbraw/zinc/44/72/91/920447291.db2.gz VDWVTIZWPJWXFE-YPMHNXCESA-N 0 3 402.276 4.313 20 0 HIADHN O=C(CN1C[C@H](c2ccccc2)[C@H]2COCC[C@@H]21)Nc1ccc(OC(F)(F)F)cc1 ZINC000511766916 920452249 /nfs/dbraw/zinc/45/22/49/920452249.db2.gz ASKVGEAOKSACNN-AQNXPRMDSA-N 0 3 420.431 4.028 20 0 HIADHN C[C@H](CC(=O)Nc1cc(C(F)(F)F)ccc1Cl)N[C@H]1CCCc2c[nH]nc21 ZINC000512005287 920776604 /nfs/dbraw/zinc/77/66/04/920776604.db2.gz GOCRYBHNLVDVOX-YGRLFVJLSA-N 0 3 400.832 4.466 20 0 HIADHN FC(F)(F)c1ccc(-n2cc(CN[C@H]3CCN(c4ncccc4Cl)C3)cn2)cc1 ZINC000512006713 920778223 /nfs/dbraw/zinc/77/82/23/920778223.db2.gz HRDDCKBTPOGVPR-INIZCTEOSA-N 0 3 421.854 4.308 20 0 HIADHN C[C@@H](CC(=O)Nc1cc(C(F)(F)F)ccc1Cl)N[C@H](CO)c1ccccc1 ZINC000512007696 920780563 /nfs/dbraw/zinc/78/05/63/920780563.db2.gz OBIYIMUVRZTTHR-YVEFUNNKSA-N 0 3 400.828 4.399 20 0 HIADHN COc1cc(F)c([C@@H](C)NC(=O)NC[C@H](c2ccccc2)N2CCCC2)cc1OC ZINC000512024507 920799782 /nfs/dbraw/zinc/79/97/82/920799782.db2.gz FGUDEZMVYDACKI-OXQOHEQNSA-N 0 3 415.509 4.040 20 0 HIADHN FC(F)(F)[C@H]1CCCC[C@@H]1CNCc1ncc(I)s1 ZINC000512051485 920821480 /nfs/dbraw/zinc/82/14/80/920821480.db2.gz IGBHFGBGEOJUHY-BDAKNGLRSA-N 0 3 404.239 4.206 20 0 HIADHN FC(F)(F)[C@H]1CCCC[C@H]1CNCc1ncc(I)s1 ZINC000512051487 920821807 /nfs/dbraw/zinc/82/18/07/920821807.db2.gz IGBHFGBGEOJUHY-IUCAKERBSA-N 0 3 404.239 4.206 20 0 HIADHN Cc1cc(Cl)c(C(=O)NC2CCN(CCOc3ccc(F)cc3)CC2)cc1C ZINC000512073414 920838351 /nfs/dbraw/zinc/83/83/51/920838351.db2.gz BFKMAYMKWTYYFA-UHFFFAOYSA-N 0 3 404.913 4.369 20 0 HIADHN COc1cccc(CN(Cc2ccc(OCc3nccn3C)cc2)C[C@H]2CCCO2)c1 ZINC000512075490 920840857 /nfs/dbraw/zinc/84/08/57/920840857.db2.gz XHJIVPUAKBMLGW-XMMPIXPASA-N 0 3 421.541 4.189 20 0 HIADHN Cc1nn(C)c(C)c1CN[C@@H](C)CC(=O)Nc1cc(C(F)(F)F)ccc1Cl ZINC000512085678 920849202 /nfs/dbraw/zinc/84/92/02/920849202.db2.gz XPRXWVDUAYGJQM-JTQLQIEISA-N 0 3 402.848 4.216 20 0 HIADHN C[C@@H](NC(=O)CSc1ncnc2scc(-c3ccccc3)c21)C1=CCN(C)CC1 ZINC000512123890 920874098 /nfs/dbraw/zinc/87/40/98/920874098.db2.gz OLWJNYVIWCHSPM-OAHLLOKOSA-N 0 3 424.595 4.217 20 0 HIADHN Cc1cc(-c2cc(C(=O)N[C@@H](C)C3=CCN(C)CC3)c3cnn(C(C)C)c3n2)c(C)o1 ZINC000512126922 920876248 /nfs/dbraw/zinc/87/62/48/920876248.db2.gz ILFLFBAICLCBJP-INIZCTEOSA-N 0 3 421.545 4.269 20 0 HIADHN COc1ccc(CNC2CCN(C(=O)c3ccc(C)cc3)CC2)c(Br)c1 ZINC000512128086 920877397 /nfs/dbraw/zinc/87/73/97/920877397.db2.gz DDIXWSZSZAUZAK-UHFFFAOYSA-N 0 3 417.347 4.161 20 0 HIADHN C[C@@H](NC(=O)c1ccc(CSc2nc3ccccc3[nH]2)cc1)C1=CCN(C)CC1 ZINC000512142933 920887788 /nfs/dbraw/zinc/88/77/88/920887788.db2.gz OTQZWOLOKWFLQV-MRXNPFEDSA-N 0 3 406.555 4.235 20 0 HIADHN CN(C)Cc1ccc(C(=O)Nc2ccc(F)c(NC(=O)Cc3ccccc3)c2)cc1 ZINC000512223651 920975844 /nfs/dbraw/zinc/97/58/44/920975844.db2.gz FJRQQODJCUMPEI-UHFFFAOYSA-N 0 3 405.473 4.321 20 0 HIADHN COc1ccc(CN(C)CCc2nc(-c3ccccc3)no2)cc1Br ZINC000512230001 920982722 /nfs/dbraw/zinc/98/27/22/920982722.db2.gz UKCKIHKLRDGDPH-UHFFFAOYSA-N 0 3 402.292 4.182 20 0 HIADHN CC(=O)N(C)C1CCN(Cc2ccc(OC(F)(F)[C@H](F)C(F)(F)F)cc2)CC1 ZINC000512292654 921048169 /nfs/dbraw/zinc/04/81/69/921048169.db2.gz IOQWUOJWIVULNY-MRXNPFEDSA-N 0 3 412.374 4.001 20 0 HIADHN C[C@@H](NC(=O)CN(C)[C@H]1CCc2ccccc2C1)c1ccc(Br)cc1 ZINC000512317902 921067585 /nfs/dbraw/zinc/06/75/85/921067585.db2.gz HBUWIJMPBWWXMH-QRWLVFNGSA-N 0 3 401.348 4.116 20 0 HIADHN Cc1nn(-c2ccccc2)cc1CN[C@@H](C)CC(=O)N(C)Cc1ccccc1Cl ZINC000512323534 921074493 /nfs/dbraw/zinc/07/44/93/921074493.db2.gz NFTSYQUKSCJMOX-KRWDZBQOSA-N 0 3 410.949 4.361 20 0 HIADHN c1cc(Sc2ccccn2)oc1CN1CCC(CCCN2CCOCC2)CC1 ZINC000512334445 921081927 /nfs/dbraw/zinc/08/19/27/921081927.db2.gz RZNWNNOUFWWFOJ-UHFFFAOYSA-N 0 3 401.576 4.150 20 0 HIADHN O=C(NCc1ccco1)c1cccc(CN(CCO)[C@H]2CCCc3ccccc32)c1 ZINC000512353376 921098392 /nfs/dbraw/zinc/09/83/92/921098392.db2.gz VSMIIYJSQVXOCC-DEOSSOPVSA-N 0 3 404.510 4.082 20 0 HIADHN O=C(NCc1ccco1)c1cccc(CN(CCO)[C@@H]2CCCc3ccccc32)c1 ZINC000512353377 921099013 /nfs/dbraw/zinc/09/90/13/921099013.db2.gz VSMIIYJSQVXOCC-XMMPIXPASA-N 0 3 404.510 4.082 20 0 HIADHN O=C(NC1CCCCC1)C1CCN(Cc2ccccc2OCc2cccnc2)CC1 ZINC000512355338 921100344 /nfs/dbraw/zinc/10/03/44/921100344.db2.gz VKBWOHQUXKTINA-UHFFFAOYSA-N 0 3 407.558 4.322 20 0 HIADHN COc1cc(CN2CCC(c3ncc[nH]3)CC2)cc(OC)c1OCc1ccccc1 ZINC000512364660 921105676 /nfs/dbraw/zinc/10/56/76/921105676.db2.gz KALCACWPPHDBFQ-UHFFFAOYSA-N 0 3 407.514 4.386 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCc3ccc(CSC)cc3)c(C)c2)CC1 ZINC000513454366 921820656 /nfs/dbraw/zinc/82/06/56/921820656.db2.gz FEMWTJXOYCVMPP-UHFFFAOYSA-N 0 3 412.603 4.322 20 0 HIADHN COc1ccc2c(c1)C[C@H](NCc1nnc3c(Cl)cc(C(F)(F)F)cn13)CC2 ZINC000513487855 921841335 /nfs/dbraw/zinc/84/13/35/921841335.db2.gz LCEPYSMXQLWYRS-CQSZACIVSA-N 0 3 410.827 4.057 20 0 HIADHN C[C@H](c1ccc(F)c(F)c1)N(C)C[C@@H](O)COc1ccc(Br)cc1 ZINC000513496858 921846608 /nfs/dbraw/zinc/84/66/08/921846608.db2.gz MHNYDMPBMUTNJG-IUODEOHRSA-N 0 3 400.263 4.160 20 0 HIADHN CCOc1cc(C[NH2+]CCCn2cnc3ccccc32)cc(Br)c1[O-] ZINC000513594235 921924960 /nfs/dbraw/zinc/92/49/60/921924960.db2.gz RZKWNCQXSBETIR-UHFFFAOYSA-N 0 3 404.308 4.083 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)c1csc(Cc2ccccc2)n1 ZINC000513594472 921925155 /nfs/dbraw/zinc/92/51/55/921925155.db2.gz ZIJKUCGOQBMZTL-UHFFFAOYSA-N 0 3 407.583 4.371 20 0 HIADHN COc1ccc(CN2CCC[C@H](c3nnc4n3CCC4)C2)cc1OCc1ccccc1 ZINC000513668368 921992177 /nfs/dbraw/zinc/99/21/77/921992177.db2.gz XMYAGSAYCZVCQY-NRFANRHFSA-N 0 3 418.541 4.192 20 0 HIADHN Cc1cc([C@H]2CCCN2CCCOc2cccc(I)c2)on1 ZINC000513691281 922011772 /nfs/dbraw/zinc/01/17/72/922011772.db2.gz SXBSHKFXYKQDGD-MRXNPFEDSA-N 0 3 412.271 4.194 20 0 HIADHN c1ccc2nc(N3CCCCC3)c(CN3CCC[C@@H](c4nnc5n4CCC5)C3)cc2c1 ZINC000513697780 922019192 /nfs/dbraw/zinc/01/91/92/922019192.db2.gz RHSLZWPRRHSLHX-HXUWFJFHSA-N 0 3 416.573 4.142 20 0 HIADHN CCN(Cc1ccc(C(=O)N(C)C)cc1)Cc1cccc(OCc2ccccn2)c1 ZINC000513750507 922070904 /nfs/dbraw/zinc/07/09/04/922070904.db2.gz JITWYQKCLHPYSQ-UHFFFAOYSA-N 0 3 403.526 4.385 20 0 HIADHN COc1ccc(CCN(Cc2cnc(N3CCOCC3)s2)Cc2ccccc2)cc1 ZINC000513755603 922074482 /nfs/dbraw/zinc/07/44/82/922074482.db2.gz SXRBAQIHWYSYDR-UHFFFAOYSA-N 0 3 423.582 4.233 20 0 HIADHN C[C@@]1(c2ccc(CN[C@H]3CC4(CCCCC4)Oc4ccccc43)cc2)NC(=O)NC1=O ZINC000513789263 922117115 /nfs/dbraw/zinc/11/71/15/922117115.db2.gz FLZAWKXMOLGTGI-RDPSFJRHSA-N 0 3 419.525 4.058 20 0 HIADHN COc1ccc(C(=O)C[C@@H](C)C(=O)N[C@@H]2CCN(Cc3ccccc3)CC2(C)C)cc1 ZINC000513921176 922243404 /nfs/dbraw/zinc/24/34/04/922243404.db2.gz YCFRHBIOHVANDE-NTKDMRAZSA-N 0 3 422.569 4.321 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)Nc2cc3c(cc2SC)OCCO3)N(C)C)cc1 ZINC000513973574 922293697 /nfs/dbraw/zinc/29/36/97/922293697.db2.gz ZCYCCMXYGCQSGY-GOSISDBHSA-N 0 3 415.559 4.167 20 0 HIADHN CC(C)(C)O[C@@H](C(=O)Nc1cccc(CN2CCC(CO)CC2)c1)c1ccccc1 ZINC000514009436 922334261 /nfs/dbraw/zinc/33/42/61/922334261.db2.gz FTOBSLAEVXOAKX-HSZRJFAPSA-N 0 3 410.558 4.386 20 0 HIADHN C[C@@H](Cc1ccccc1Cl)C(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000514012009 922336735 /nfs/dbraw/zinc/33/67/35/922336735.db2.gz WKGZGTGOIXYOIA-GBESFXJTSA-N 0 3 406.998 4.257 20 0 HIADHN CCOc1cc2c(cc1CNC(=O)N[C@@H]1CCN([C@@H](C)c3ccccc3)C1)O[C@H](C)C2 ZINC000514027529 922351092 /nfs/dbraw/zinc/35/10/92/922351092.db2.gz SXYJIZYHNQOJCC-KGVIQGDOSA-N 0 3 423.557 4.043 20 0 HIADHN Clc1ccccc1[C@@H](CN[C@@H](c1ncc[nH]1)C1CCCCC1)N1CCOCC1 ZINC000514081934 922404286 /nfs/dbraw/zinc/40/42/86/922404286.db2.gz DVQAMTWYHCSJMC-NHCUHLMSSA-N 0 3 402.970 4.348 20 0 HIADHN C[C@H](NCc1ccc(N2CCc3ccccc3C2)nc1)c1ccccc1-n1ccnn1 ZINC000514106528 922434198 /nfs/dbraw/zinc/43/41/98/922434198.db2.gz ZEWSPCIURDWQBG-IBGZPJMESA-N 0 3 410.525 4.076 20 0 HIADHN COc1ccccc1CN(CCC(=O)Nc1ccccc1SC)C[C@@H]1CCCO1 ZINC000514113024 922444338 /nfs/dbraw/zinc/44/43/38/922444338.db2.gz MXIHVFRNXUHEHZ-IBGZPJMESA-N 0 3 414.571 4.427 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)NC[C@@H](c2ccccc2Cl)N(C)C)C1 ZINC000514146198 922482186 /nfs/dbraw/zinc/48/21/86/922482186.db2.gz VBVFBVNOGYMDFL-LZNRXBQRSA-N 0 3 414.981 4.077 20 0 HIADHN C[C@H](Cc1cccc(O)c1)NC(=O)NC[C@H](c1cccs1)N1CCC(C)CC1 ZINC000514182285 922521745 /nfs/dbraw/zinc/52/17/45/922521745.db2.gz JYHKFYWHUQQWFM-YLJYHZDGSA-N 0 3 401.576 4.157 20 0 HIADHN CC(C)[C@H]1C[C@@H](CC(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)CCO1 ZINC000514188723 922529178 /nfs/dbraw/zinc/52/91/78/922529178.db2.gz HCOHFNXMNDTQDB-AZUAARDMSA-N 0 3 414.512 4.437 20 0 HIADHN CN(C)[C@H](CNC(=O)CSc1nccn1-c1ccc(Cl)cc1)c1ccccc1 ZINC000514489117 922644331 /nfs/dbraw/zinc/64/43/31/922644331.db2.gz LALWAHGGLXYAEN-LJQANCHMSA-N 0 3 414.962 4.037 20 0 HIADHN COc1cc(C)c(NC(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)cc1OC ZINC000514623441 922728821 /nfs/dbraw/zinc/72/88/21/922728821.db2.gz KMQCRJSDXMDLEG-FQEVSTJZSA-N 0 3 415.534 4.224 20 0 HIADHN OC[C@]1(Cc2ccc(F)cc2)CCN(Cc2ccc(OCC(F)(F)F)c(F)c2)C1 ZINC000514758239 922786927 /nfs/dbraw/zinc/78/69/27/922786927.db2.gz JCQFJRVSSISRLH-FQEVSTJZSA-N 0 3 415.402 4.333 20 0 HIADHN C[C@@H](NC(=O)CNC1(c2ccccc2)CCOCC1)c1ccc(OC(F)(F)F)cc1 ZINC000514852547 922823907 /nfs/dbraw/zinc/82/39/07/922823907.db2.gz DIAIWFJCVRLLSN-MRXNPFEDSA-N 0 3 422.447 4.058 20 0 HIADHN CC(=O)Nc1cccc([C@H](C)N(Cc2ccccc2)C(=O)CN2CCC(C)(C)C2)c1 ZINC000514929638 922847821 /nfs/dbraw/zinc/84/78/21/922847821.db2.gz WMAXJDIVRBPPLZ-IBGZPJMESA-N 0 3 407.558 4.467 20 0 HIADHN CC(C)N(Cc1ccccc1)C(=O)[C@H](C)N[C@@H]1CCN(C)[C@@H]1c1ccc(F)c(F)c1 ZINC000515017677 922879886 /nfs/dbraw/zinc/87/98/86/922879886.db2.gz CUMHYCNFKMPSBK-JJEOQYAHSA-N 0 3 415.528 4.125 20 0 HIADHN O=C(Cc1csc(Cc2ccccc2)n1)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000515079594 922896392 /nfs/dbraw/zinc/89/63/92/922896392.db2.gz ZLIQJFGUDLMNPD-QFIPXVFZSA-N 0 3 405.567 4.230 20 0 HIADHN CN(C)c1ccc(C(F)(F)F)cc1NC(=O)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000515112491 922926651 /nfs/dbraw/zinc/92/66/51/922926651.db2.gz KVISFJLMQREUNT-KRWDZBQOSA-N 0 3 406.452 4.167 20 0 HIADHN CCc1ccc([C@H](CNC(=O)Cc2ccc(-n3nc(C)cc3C)cc2)N(C)C)cc1 ZINC000515125764 922937776 /nfs/dbraw/zinc/93/77/76/922937776.db2.gz QNNRRRJVCJNDBO-DEOSSOPVSA-N 0 3 404.558 4.013 20 0 HIADHN C[C@H](NC(=O)[C@@H]1CCCN(Cc2cccnc2)C1)c1ccc(Br)cc1F ZINC000515160893 922963289 /nfs/dbraw/zinc/96/32/89/922963289.db2.gz YHWCETVJFNKTOP-GOEBONIOSA-N 0 3 420.326 4.073 20 0 HIADHN Cc1nc2sccn2c1-c1noc([C@H]2CN(Cc3ccccc3)CCC2(F)F)n1 ZINC000515183245 922974990 /nfs/dbraw/zinc/97/49/90/922974990.db2.gz SAVJVBRAUQRBDJ-OAHLLOKOSA-N 0 3 415.469 4.379 20 0 HIADHN CC(=O)N1C[C@@H]2CCC[C@H](N[C@H](C)c3nnc(-c4ccc(Cl)c(Cl)c4)o3)[C@H]2C1 ZINC000515249781 923016205 /nfs/dbraw/zinc/01/62/05/923016205.db2.gz NFQPTIKCMCFHNL-IQFXKTMKSA-N 0 3 423.344 4.341 20 0 HIADHN COc1ccccc1CN(CCC(=O)Nc1cccc(Cl)c1)C[C@H]1CCCO1 ZINC000515545883 923167940 /nfs/dbraw/zinc/16/79/40/923167940.db2.gz AWNHALXIZZWCFL-HXUWFJFHSA-N 0 3 402.922 4.358 20 0 HIADHN COc1ccc(CN(C)C[C@@H](O)CO[C@@H]2CCCc3ccccc32)cc1OC(F)F ZINC000515548634 923168237 /nfs/dbraw/zinc/16/82/37/923168237.db2.gz OTZRDKMXQTWPHF-UYAOXDASSA-N 0 3 421.484 4.184 20 0 HIADHN COc1cccc([C@@H](CNc2ncnc3ccc(Br)cc32)N(C)C)c1 ZINC000515578639 923194326 /nfs/dbraw/zinc/19/43/26/923194326.db2.gz BBPDEQCTSPMUIZ-GOSISDBHSA-N 0 3 401.308 4.116 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)c1cc(F)c(F)cc1Br)c1ccco1 ZINC000515696291 923278803 /nfs/dbraw/zinc/27/88/03/923278803.db2.gz IQFQLTQUYZLSTP-BMIGLBTASA-N 0 3 401.251 4.180 20 0 HIADHN CCC(CC)C(=O)N1CCC(N[C@@H](C(=O)NCc2ccccc2)c2ccccc2)CC1 ZINC000515715948 923297611 /nfs/dbraw/zinc/29/76/11/923297611.db2.gz WXUZNDDEBZNUSB-XMMPIXPASA-N 0 3 421.585 4.061 20 0 HIADHN Cc1cc(NC(=O)N2CC(C)(C)[C@@H]2C2CC2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000515716018 923297764 /nfs/dbraw/zinc/29/77/64/923297764.db2.gz BEDZOVGDKXSLFO-IRLDBZIGSA-N 0 3 407.562 4.291 20 0 HIADHN CSc1ccc(NC(=O)[C@@H](C)N[C@@H](C)c2ccc(NC(=O)NC3CC3)cc2)cc1 ZINC000515756244 923328606 /nfs/dbraw/zinc/32/86/06/923328606.db2.gz SNSVAFKDKZFROX-LSDHHAIUSA-N 0 3 412.559 4.370 20 0 HIADHN CC1CCN([C@@H](CNC(=O)N2CCO[C@H](c3ccccc3)C2)c2ccccc2)CC1 ZINC000516149215 923576162 /nfs/dbraw/zinc/57/61/62/923576162.db2.gz LJZAPHZXULTIRB-ZEQRLZLVSA-N 0 3 407.558 4.243 20 0 HIADHN CC(C)COc1ccccc1CNC(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000516154242 923578453 /nfs/dbraw/zinc/57/84/53/923578453.db2.gz PMFLYVLVVXTTSC-IBGZPJMESA-N 0 3 401.576 4.419 20 0 HIADHN COc1ccc(C(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)cc1Br ZINC000516204843 923598428 /nfs/dbraw/zinc/59/84/28/923598428.db2.gz WJYKMZDBKSHKTR-PBHICJAKSA-N 0 3 403.320 4.023 20 0 HIADHN COc1cc(NC(=O)CN[C@@H](C)c2ccc(F)c3ccccc32)cc(OC)c1OC ZINC000516210819 923602345 /nfs/dbraw/zinc/60/23/45/923602345.db2.gz ZIUVDKQUPHVHEV-AWEZNQCLSA-N 0 3 412.461 4.294 20 0 HIADHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)NCCCc1ccccc1 ZINC000516232164 923618749 /nfs/dbraw/zinc/61/87/49/923618749.db2.gz ZFZHJEHKWFZQLY-UHFFFAOYSA-N 0 3 418.379 4.155 20 0 HIADHN C[C@@H](COc1ccccc1C(F)(F)F)NC(=O)c1cccc(CN2CCCC2)c1 ZINC000516270009 923637463 /nfs/dbraw/zinc/63/74/63/923637463.db2.gz JXECGDVZPXBJRD-INIZCTEOSA-N 0 3 406.448 4.499 20 0 HIADHN Brc1ccc2c(c1)[C@@H](NCc1ccc(Cn3cncn3)cc1)CCCO2 ZINC000516517418 923775377 /nfs/dbraw/zinc/77/53/77/923775377.db2.gz VTLDJBQKBMNEHH-IBGZPJMESA-N 0 3 413.319 4.092 20 0 HIADHN COc1cc2nc(NC(=O)[C@@H]3CCCN(Cc4ccccc4)C3)sc2cc1OC ZINC000516555303 923794122 /nfs/dbraw/zinc/79/41/22/923794122.db2.gz QOQQTHZHANFQNR-MRXNPFEDSA-N 0 3 411.527 4.164 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)c1cc(Br)c(C)cc1OC ZINC000516670431 923836303 /nfs/dbraw/zinc/83/63/03/923836303.db2.gz NZIZJPCWQLJDER-UHFFFAOYSA-N 0 3 407.308 4.089 20 0 HIADHN C[C@H](NC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1)c1ccc(NC(=O)C2CC2)cc1 ZINC000516769759 923882126 /nfs/dbraw/zinc/88/21/26/923882126.db2.gz NHSKVSBZISYJED-LAUBAEHRSA-N 0 3 423.532 4.264 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)NCc1csc([C@H](C)OC)n1)c1ccc(Cl)cc1 ZINC000516798864 923891333 /nfs/dbraw/zinc/89/13/33/923891333.db2.gz CJMINCAVDSRWCM-KSSFIOAISA-N 0 3 424.998 4.386 20 0 HIADHN COc1ccc(CN2CCC[C@H](c3nnc(C4CCCCC4)[nH]3)C2)c(OC)c1OC ZINC000516997051 923959275 /nfs/dbraw/zinc/95/92/75/923959275.db2.gz AZTUVIAJYZXQDP-SFHVURJKSA-N 0 3 414.550 4.258 20 0 HIADHN COc1ccc([C@@H](CNC(=O)NCc2nc(C(C)(C)C)cs2)N2CCCC2)cc1 ZINC000517103105 923998502 /nfs/dbraw/zinc/99/85/02/923998502.db2.gz BFKPVZDXHINMLP-GOSISDBHSA-N 0 3 416.591 4.086 20 0 HIADHN Cc1nc(CCC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)oc1-c1ccccc1 ZINC000517352703 924125925 /nfs/dbraw/zinc/12/59/25/924125925.db2.gz CIMLYUWNDITDMK-JOCHJYFZSA-N 0 3 403.526 4.363 20 0 HIADHN COCCN(C)CCNC(=O)[C@@H](Sc1ccc(F)c(Cl)c1)c1ccccc1 ZINC000517371274 924139853 /nfs/dbraw/zinc/13/98/53/924139853.db2.gz XJAVAQVJSAUKLI-IBGZPJMESA-N 0 3 410.942 4.007 20 0 HIADHN Cc1ccc(NC(=O)C(C)C)cc1NC(=O)N[C@H]1CCN(Cc2ccccc2)[C@H]1C ZINC000517420488 924171256 /nfs/dbraw/zinc/17/12/56/924171256.db2.gz FDMCWTSQNRBISU-RXVVDRJESA-N 0 3 408.546 4.374 20 0 HIADHN COc1ccccc1[C@H](NC(=O)NC[C@H](c1ccccc1)N(C)C)c1ccccc1 ZINC000517474741 924216444 /nfs/dbraw/zinc/21/64/44/924216444.db2.gz UWULWDDEORIBSB-ISKFKSNPSA-N 0 3 403.526 4.387 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1ccc(C(=O)NC(C)C)c(C)c1)c1ccsc1 ZINC000517502884 924233203 /nfs/dbraw/zinc/23/32/03/924233203.db2.gz BTQMMRKYSHWYBP-HXUWFJFHSA-N 0 3 416.591 4.399 20 0 HIADHN COC(=O)c1ccc(CN(C)C(=O)NC[C@H](c2ccccc2)N2CCC(C)CC2)cc1 ZINC000517512042 924239218 /nfs/dbraw/zinc/23/92/18/924239218.db2.gz GDTBJXWFBGHNBY-HSZRJFAPSA-N 0 3 423.557 4.088 20 0 HIADHN CCN(C(=O)NC[C@@H](c1ccccc1)N1CCCC1)[C@H](C)Cc1ccc(OC)cc1 ZINC000517532023 924249650 /nfs/dbraw/zinc/24/96/50/924249650.db2.gz IPFWTIRYNHAPMK-YKSBVNFPSA-N 0 3 409.574 4.495 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)NCc2ccccc2OC(F)(F)F)C1 ZINC000517541790 924254930 /nfs/dbraw/zinc/25/49/30/924254930.db2.gz WXVZMSCNIPSZLG-YJBOKZPZSA-N 0 3 407.436 4.220 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N[C@H](c2ccc3c(c2)OCCO3)C2CC2)C1 ZINC000517543440 924255779 /nfs/dbraw/zinc/25/57/79/924255779.db2.gz RTJWECSLHRJQIF-GQOCTPOGSA-N 0 3 421.541 4.044 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)NCc2ccccc2OC(F)(F)F)C1 ZINC000517541788 924255945 /nfs/dbraw/zinc/25/59/45/924255945.db2.gz WXVZMSCNIPSZLG-MAUKXSAKSA-N 0 3 407.436 4.220 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N2CCC(c3nc4ccccc4[nH]3)CC2)C1 ZINC000517544708 924256489 /nfs/dbraw/zinc/25/64/89/924256489.db2.gz MQMWQCQAFUHDQK-WIYYLYMNSA-N 0 3 417.557 4.287 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@@H](C)NCc2ccc(OC)cc2Cl)CC1 ZINC000517547432 924258235 /nfs/dbraw/zinc/25/82/35/924258235.db2.gz UNZBZQJHMKFNSM-MRXNPFEDSA-N 0 3 405.945 4.480 20 0 HIADHN O=S(=O)(CCNCc1ccc(-c2ccccc2Cl)s1)NCc1ccccc1 ZINC000517546992 924258265 /nfs/dbraw/zinc/25/82/65/924258265.db2.gz BNVIIPSMZNBJHI-UHFFFAOYSA-N 0 3 420.987 4.278 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1[nH]nc2ccc(Br)cc21)c1ccsc1 ZINC000517643586 926750120 /nfs/dbraw/zinc/75/01/20/926750120.db2.gz AWEGDZDCNITOEP-INIZCTEOSA-N 0 3 421.364 4.200 20 0 HIADHN Cc1cc(NC(=O)CCCN2CCN(c3ccccc3)CC2)n(-c2ccccc2C)n1 ZINC000517651460 926759472 /nfs/dbraw/zinc/75/94/72/926759472.db2.gz JBAFKCHCFGCNDR-UHFFFAOYSA-N 0 3 417.557 4.030 20 0 HIADHN CCO[C@@H]1C[C@@H](N[C@H](C)C(=O)Nc2c(C)nn(-c3ccccc3)c2C)C12CCCC2 ZINC000517781824 926833561 /nfs/dbraw/zinc/83/35/61/926833561.db2.gz IIMQUIAGEYDHCX-DUXKGJEZSA-N 0 3 410.562 4.144 20 0 HIADHN CCO[C@@H]1C[C@H](N[C@@H](C)C(=O)Nc2c(C)nn(-c3ccccc3)c2C)C12CCCC2 ZINC000517781825 926833909 /nfs/dbraw/zinc/83/39/09/926833909.db2.gz IIMQUIAGEYDHCX-DZFGPLHGSA-N 0 3 410.562 4.144 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3ccc(-n4cccc4)c(F)c3)c(C)c2)CC1 ZINC000517802898 926843267 /nfs/dbraw/zinc/84/32/67/926843267.db2.gz GGRZBIACXCZUNA-UHFFFAOYSA-N 0 3 406.505 4.319 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)NCc1ccc(Oc2cccnc2)c(F)c1 ZINC000517803163 926843341 /nfs/dbraw/zinc/84/33/41/926843341.db2.gz AZYBJIZAXOHSDJ-UHFFFAOYSA-N 0 3 422.504 4.286 20 0 HIADHN CCN(C)C(=O)c1cccc(C(=O)N(CC)[C@@H]2CCN([C@@H](C)c3ccccc3)C2)c1 ZINC000517823906 926852831 /nfs/dbraw/zinc/85/28/31/926852831.db2.gz JAUBHNLCYOCEAF-WMZHIEFXSA-N 0 3 407.558 4.076 20 0 HIADHN Cc1ccc(-c2nnc(-c3ccc(C(=O)N(CCN(C)C)CC(C)C)cc3)o2)cc1 ZINC000517874006 926871314 /nfs/dbraw/zinc/87/13/14/926871314.db2.gz KBRJHKAMBCDBHM-UHFFFAOYSA-N 0 3 406.530 4.372 20 0 HIADHN CC1CCN([C@H](CNC(=O)NC[C@H]2CCOc3ccccc32)c2cccs2)CC1 ZINC000518211851 927082498 /nfs/dbraw/zinc/08/24/98/927082498.db2.gz GHRQBSHTPNMUOF-UYAOXDASSA-N 0 3 413.587 4.387 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CNCCOc1cccc(Br)c1 ZINC000518263283 927121094 /nfs/dbraw/zinc/12/10/94/927121094.db2.gz CLCQHYYKASTGKY-UHFFFAOYSA-N 0 3 414.347 4.479 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3ccc4oc(C5CC5)nc4c3)CC2)C[C@@H](C)O1 ZINC000518313290 927174504 /nfs/dbraw/zinc/17/45/04/927174504.db2.gz GEEVXRADYOPREB-HZPDHXFCSA-N 0 3 412.534 4.058 20 0 HIADHN CCOc1ccc(NC(=O)N2CCC(CN3C[C@@H](C)O[C@H](C)C3)CC2)cc1Cl ZINC000518314400 927177032 /nfs/dbraw/zinc/17/70/32/927177032.db2.gz CCNJFCUELHYPAQ-HZPDHXFCSA-N 0 3 409.958 4.092 20 0 HIADHN CC(C)n1ncc2c1nc(-c1cccs1)cc2C(=O)N(C)[C@@H]1CCN(C2CC2)C1 ZINC000518364995 927223354 /nfs/dbraw/zinc/22/33/54/927223354.db2.gz OQDBOGJYQDRKOT-MRXNPFEDSA-N 0 3 409.559 4.049 20 0 HIADHN CCOc1ccc(-c2nc(CC(=O)NC[C@H](C)N(C)Cc3ccccc3)cs2)cc1 ZINC000518377896 927230124 /nfs/dbraw/zinc/23/01/24/927230124.db2.gz KCLFSAUVANQGBV-SFHVURJKSA-N 0 3 423.582 4.388 20 0 HIADHN COc1ccc2[nH]cc(C3CCN([C@H](C)C(=O)NCCc4ccccc4)CC3)c2c1 ZINC000518576794 927356673 /nfs/dbraw/zinc/35/66/73/927356673.db2.gz YBBPPAIAOCPMMQ-GOSISDBHSA-N 0 3 405.542 4.103 20 0 HIADHN CCN(C)[C@H](C(=O)NCC1CCN(Cc2ccccc2Cl)CC1)c1ccccc1 ZINC000518587754 927365292 /nfs/dbraw/zinc/36/52/92/927365292.db2.gz BMJDMSHVWXFGMZ-QHCPKHFHSA-N 0 3 413.993 4.361 20 0 HIADHN COc1ccccc1[C@H](NC(=O)[C@@H]1CCCN(Cc2cccnc2)C1)c1ccccc1 ZINC000518657513 927411579 /nfs/dbraw/zinc/41/15/79/927411579.db2.gz MJYMLKMZPROLAW-RCZVLFRGSA-N 0 3 415.537 4.208 20 0 HIADHN O=C(N1CCC=C(c2ccncc2)C1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000518810491 927506466 /nfs/dbraw/zinc/50/64/66/927506466.db2.gz JYCUMAVLPPWCFJ-JOCHJYFZSA-N 0 3 415.459 4.152 20 0 HIADHN COCCN1CCC(NC(=O)Nc2ccccc2-c2nc3ccccc3s2)CC1 ZINC000518831493 927528151 /nfs/dbraw/zinc/52/81/51/927528151.db2.gz IIZBXQFCIMTQQO-UHFFFAOYSA-N 0 3 410.543 4.196 20 0 HIADHN C[C@@H](CNC(=O)[C@@H](C)N(C)CCCc1cc(-c2cccc(F)c2)n[nH]1)c1ccccc1 ZINC000518862456 927568428 /nfs/dbraw/zinc/56/84/28/927568428.db2.gz SGBUXTFZWHJZPZ-RBUKOAKNSA-N 0 3 422.548 4.389 20 0 HIADHN Cc1ccc(NC(=O)C(C)C)cc1NC(=O)CCCN1CCN(c2ccccc2)CC1 ZINC000518881499 927595559 /nfs/dbraw/zinc/59/55/59/927595559.db2.gz NAXJEEKDTNCMJH-UHFFFAOYSA-N 0 3 422.573 4.130 20 0 HIADHN Cc1nc(-c2ccc(CNC(=O)NC[C@@H](C)N(C)Cc3ccccc3)s2)cs1 ZINC000518968803 927665020 /nfs/dbraw/zinc/66/50/20/927665020.db2.gz WXEYWGQSOQQNCE-OAHLLOKOSA-N 0 3 414.600 4.500 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)N1CCC(=Cc2cccc(F)c2)CC1 ZINC000518969960 927665061 /nfs/dbraw/zinc/66/50/61/927665061.db2.gz UBGCKRQRJWYMCF-UHFFFAOYSA-N 0 3 421.560 4.434 20 0 HIADHN CN(C)CCN(CC1CCCCC1)C(=O)C1CCN(c2nc3ccccc3o2)CC1 ZINC000519108580 927777385 /nfs/dbraw/zinc/77/73/85/927777385.db2.gz OQTYPMFWQYRUGC-UHFFFAOYSA-N 0 3 412.578 4.015 20 0 HIADHN COCc1cccc2sc(NC(=O)N[C@@H]3CCN([C@H](C)c4ccccc4)C3)nc21 ZINC000519197402 927822245 /nfs/dbraw/zinc/82/22/45/927822245.db2.gz BECMDHJXIHFANC-CRAIPNDOSA-N 0 3 410.543 4.400 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)NCCc1nc(C(C)(C)C)cs1 ZINC000519208570 927828053 /nfs/dbraw/zinc/82/80/53/927828053.db2.gz AOIXNOIUQNXHEQ-UHFFFAOYSA-N 0 3 424.561 4.035 20 0 HIADHN C[C@@H](NCC(C)(C)c1c(Cl)cccc1Cl)C(=O)N1CC(=O)Nc2ccccc21 ZINC000519228234 927836616 /nfs/dbraw/zinc/83/66/16/927836616.db2.gz LOFSKYGJJKLHOA-CYBMUJFWSA-N 0 3 420.340 4.234 20 0 HIADHN Cc1ccc(-c2ncc(CN3CCC[C@H](CNC(=O)CC(F)(F)F)C3)s2)cc1 ZINC000519230578 927837955 /nfs/dbraw/zinc/83/79/55/927837955.db2.gz PFOWIAQBWKFEOV-OAHLLOKOSA-N 0 3 411.493 4.399 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N1CCC[C@@H]1Cc1cccc(F)c1 ZINC000519250843 927847115 /nfs/dbraw/zinc/84/71/15/927847115.db2.gz LZZGBJCCYVHDIY-WOJBJXKFSA-N 0 3 401.551 4.441 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2cccc(C(=O)N3CCCCC3)c2)N(C)C)cc1 ZINC000519259498 927851278 /nfs/dbraw/zinc/85/12/78/927851278.db2.gz QPYOSSVMPVWXBR-JOCHJYFZSA-N 0 3 408.546 4.046 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)c3ccccc3OC(C)C)CC2)c1 ZINC000519273899 927858846 /nfs/dbraw/zinc/85/88/46/927858846.db2.gz KJRSLVBMVPMOHR-UHFFFAOYSA-N 0 3 409.574 4.114 20 0 HIADHN CC(C)(C)[N@@H+]1C[C@@H](C(=O)Nc2ccc(Br)cc2[O-])[C@H](C(F)(F)F)C1 ZINC000519282357 927862642 /nfs/dbraw/zinc/86/26/42/927862642.db2.gz DTDUKODXPOYPKI-GHMZBOCLSA-N 0 3 409.246 4.002 20 0 HIADHN CC(C)(C)[N@H+]1C[C@@H](C(=O)Nc2ccc(Br)cc2[O-])[C@H](C(F)(F)F)C1 ZINC000519282357 927862646 /nfs/dbraw/zinc/86/26/46/927862646.db2.gz DTDUKODXPOYPKI-GHMZBOCLSA-N 0 3 409.246 4.002 20 0 HIADHN CC[C@H](CNC(=O)N(C)[C@@H](C)c1sc(C)nc1C)N1CCc2ccccc2C1 ZINC000519293812 927866834 /nfs/dbraw/zinc/86/68/34/927866834.db2.gz RNGJDQKBSNSSPQ-OXJNMPFZSA-N 0 3 400.592 4.299 20 0 HIADHN Cc1nc(C)c([C@H](C)N(C)C(=O)NCC(C)(C)N2CCc3ccccc3C2)s1 ZINC000519300397 927871322 /nfs/dbraw/zinc/87/13/22/927871322.db2.gz JCHDZUXOFNMEJO-INIZCTEOSA-N 0 3 400.592 4.299 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)CCn1cnc2ccccc21 ZINC000519418714 927934135 /nfs/dbraw/zinc/93/41/35/927934135.db2.gz NACJFIFNPPNPFR-UHFFFAOYSA-N 0 3 418.463 4.036 20 0 HIADHN O=C(N[C@@H]1CCOc2c(Cl)cccc21)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000519432592 927944062 /nfs/dbraw/zinc/94/40/62/927944062.db2.gz XIIYLJPHIUROGG-OXJNMPFZSA-N 0 3 402.897 4.331 20 0 HIADHN Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)N[C@@H]1CCN(Cc2ccccc2)[C@H]1C ZINC000519468520 927969127 /nfs/dbraw/zinc/96/91/27/927969127.db2.gz NZEMIJFDSUGNNG-WMZHIEFXSA-N 0 3 422.573 4.165 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCCc1ccc2ccccc2n1)c1cccc(OC)c1 ZINC000519466860 927969836 /nfs/dbraw/zinc/96/98/36/927969836.db2.gz QDSYSUQMQFCGPB-XMMPIXPASA-N 0 3 420.557 4.168 20 0 HIADHN COc1ccc(C)cc1NC(=O)[C@H](C)N[C@H]1CCN(C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000519481342 927979582 /nfs/dbraw/zinc/97/95/82/927979582.db2.gz IQROQBHCCJIEAU-XQAUZQBESA-N 0 3 419.928 4.158 20 0 HIADHN CC(C)OCCOCc1cccc(NC(=O)N[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000519500196 927994130 /nfs/dbraw/zinc/99/41/30/927994130.db2.gz UNVZGUILSQWUHO-QHCPKHFHSA-N 0 3 411.546 4.024 20 0 HIADHN Cc1ccc([C@@H](NC(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)C2CC2)cc1 ZINC000519507237 927999544 /nfs/dbraw/zinc/99/95/44/927999544.db2.gz SVRAUQZHMMQOFS-JOCHJYFZSA-N 0 3 401.501 4.498 20 0 HIADHN C[C@H](Cc1ccsc1)NC(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1 ZINC000519507862 927999899 /nfs/dbraw/zinc/99/98/99/927999899.db2.gz NZDRKCUOVFANFD-OAHLLOKOSA-N 0 3 413.509 4.471 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)Nc2ccn(Cc3ccccc3)n2)N(C)C)cc1 ZINC000519655968 928036265 /nfs/dbraw/zinc/03/62/65/928036265.db2.gz DVGZRRVXNPXXKR-QFIPXVFZSA-N 0 3 421.545 4.143 20 0 HIADHN COc1cc(CN2CCC[C@H](c3nc4c(s3)CCCC4)C2)cc(OC)c1OC ZINC000519663812 928039732 /nfs/dbraw/zinc/03/97/32/928039732.db2.gz QEONHYHTRRLBRT-INIZCTEOSA-N 0 3 402.560 4.427 20 0 HIADHN C[C@H](N[C@H]1CCN(C)[C@@H]1c1ccc(Cl)cc1)C(=O)Nc1ccc(OC(F)F)cc1 ZINC000519725929 928060127 /nfs/dbraw/zinc/06/01/27/928060127.db2.gz QGZVQLJDDIKWMR-FASAQXTFSA-N 0 3 423.891 4.303 20 0 HIADHN CC(C)Cn1ncc(NC(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)c1C1CC1 ZINC000519776125 928071561 /nfs/dbraw/zinc/07/15/61/928071561.db2.gz YDQNUJTWMLJAFT-UHFFFAOYSA-N 0 3 409.578 4.199 20 0 HIADHN C[C@H](NC(=O)[C@H]1CCCN(Cc2cccnc2)C1)c1ccc(Oc2cccnc2)cc1 ZINC000519792724 928079327 /nfs/dbraw/zinc/07/93/27/928079327.db2.gz QHDKYOJQUKIABX-UGKGYDQZSA-N 0 3 416.525 4.358 20 0 HIADHN CCOCCOc1c(Cl)cccc1NC(=O)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000519879006 928112635 /nfs/dbraw/zinc/11/26/35/928112635.db2.gz UDLCJNMBQKHIMZ-SFHVURJKSA-N 0 3 417.937 4.151 20 0 HIADHN Cc1nc(COc2ccc(F)cc2)sc1C(=O)N(CCN(C)C)c1ccccc1 ZINC000519901306 928136764 /nfs/dbraw/zinc/13/67/64/928136764.db2.gz JEWNXWRYEDFIBG-UHFFFAOYSA-N 0 3 413.518 4.378 20 0 HIADHN O=C(CN(CCc1ccccc1F)C1CCCC1)Nc1ccccc1N1CCCC1=O ZINC000519904825 928139988 /nfs/dbraw/zinc/13/99/88/928139988.db2.gz FPIHGOUUPUVFNK-UHFFFAOYSA-N 0 3 423.532 4.378 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N2CCO[C@H](c3ccc(F)cc3)C2)N2CCCC2)cc1 ZINC000519936007 928169721 /nfs/dbraw/zinc/16/97/21/928169721.db2.gz ZUECQXUIZQQVHQ-PKTZIBPZSA-N 0 3 411.521 4.054 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)NCc2ccc(NC(=O)C(C)C)cc2)N2CCCC2)cc1 ZINC000519935472 928170204 /nfs/dbraw/zinc/17/02/04/928170204.db2.gz UDOFLMRPGLJADC-HSZRJFAPSA-N 0 3 422.573 4.226 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)c1cnn(-c2ccccc2Cl)c1 ZINC000519939402 928174380 /nfs/dbraw/zinc/17/43/80/928174380.db2.gz AAXGZHCWLDMFAB-UHFFFAOYSA-N 0 3 418.875 4.008 20 0 HIADHN O=C(Cc1csc(Cc2ccc(F)cc2)n1)N1CCN(CC2CCCCC2)CC1 ZINC000520039995 928264451 /nfs/dbraw/zinc/26/44/51/928264451.db2.gz YONCFZUTUJXKSI-UHFFFAOYSA-N 0 3 415.578 4.140 20 0 HIADHN Cc1ccc(NC(=O)C2CC2)cc1NC(=O)N(CCCc1ccccc1)CCN(C)C ZINC000520045636 928271162 /nfs/dbraw/zinc/27/11/62/928271162.db2.gz WTRUFIXMNLRXJI-UHFFFAOYSA-N 0 3 422.573 4.372 20 0 HIADHN CCOc1ccc(NC(=O)NC[C@H](c2ccc(OC)cc2)N2CCCC2)cc1OC ZINC000520050602 928276282 /nfs/dbraw/zinc/27/62/82/928276282.db2.gz RDXITMJKHHUBKB-HXUWFJFHSA-N 0 3 413.518 4.061 20 0 HIADHN COc1ccc(F)cc1[C@H](C)NC(=O)N(CCCc1ccccc1)CCN(C)C ZINC000520052507 928277779 /nfs/dbraw/zinc/27/77/79/928277779.db2.gz CZZRPTIMDNUBCQ-SFHVURJKSA-N 0 3 401.526 4.101 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)NC[C@@H]1CCCO[C@@H]1c1ccccc1 ZINC000520058269 928284695 /nfs/dbraw/zinc/28/46/95/928284695.db2.gz XLWWUVCCLZHZDV-LOSJGSFVSA-N 0 3 423.601 4.360 20 0 HIADHN Cc1ccc(C(=O)N(CCN(C)C)Cc2ccccc2)cc1NC(=O)c1ccccc1 ZINC000520105947 928313876 /nfs/dbraw/zinc/31/38/76/928313876.db2.gz GTTJNZBMQKYNRN-UHFFFAOYSA-N 0 3 415.537 4.451 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)NCCc1ccc2ccccc2n1 ZINC000520118106 928321775 /nfs/dbraw/zinc/32/17/75/928321775.db2.gz AHKMSIISCVUFAQ-UHFFFAOYSA-N 0 3 410.949 4.204 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)N[C@H]1CCOc2c(Cl)cccc21 ZINC000520130276 928327962 /nfs/dbraw/zinc/32/79/62/928327962.db2.gz NWURJRDJKMKVNK-IBGZPJMESA-N 0 3 405.901 4.076 20 0 HIADHN COc1ccc(NC(=O)CN(CCc2ccccc2F)C2CCCC2)c(OC)c1 ZINC000520169805 928360434 /nfs/dbraw/zinc/36/04/34/928360434.db2.gz JUSPODFUSRAZLS-UHFFFAOYSA-N 0 3 400.494 4.269 20 0 HIADHN C[C@@H]1CN([C@H](CNCc2c[nH]nc2C(C)(C)C)c2c(F)cccc2Cl)CCO1 ZINC000520205350 928388196 /nfs/dbraw/zinc/38/81/96/928388196.db2.gz NRVJDIBAVSUJQZ-RDTXWAMCSA-N 0 3 408.949 4.051 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3ccc(Cl)c(Cl)c3)CC2)C[C@H](C)O1 ZINC000520265013 928429859 /nfs/dbraw/zinc/42/98/59/928429859.db2.gz HIRLTTSIUORXME-OKILXGFUSA-N 0 3 400.350 4.347 20 0 HIADHN CSCc1cccc(NC(=O)NCCCN2CCN(C)C[C@@H]2c2ccccc2)c1 ZINC000520282950 928445764 /nfs/dbraw/zinc/44/57/64/928445764.db2.gz BPGMWWGYZSTJDK-JOCHJYFZSA-N 0 3 412.603 4.050 20 0 HIADHN C[C@@H]1C[C@@H]1c1ccc(CN(C(=O)CCCN2CCN(c3ccccc3)CC2)C2CC2)o1 ZINC000520306035 928468482 /nfs/dbraw/zinc/46/84/82/928468482.db2.gz LOAQTLFGJUAFMF-YKSBVNFPSA-N 0 3 421.585 4.496 20 0 HIADHN COc1cc(C)c(NC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)cc1OC ZINC000520330847 928494916 /nfs/dbraw/zinc/49/49/16/928494916.db2.gz MLSBQUQCYQBQCS-NRFANRHFSA-N 0 3 422.447 4.405 20 0 HIADHN C[C@H](C(=O)NCCc1cccc2cccnc21)N1CCC(Cc2ccccc2)CC1 ZINC000520332541 928496584 /nfs/dbraw/zinc/49/65/84/928496584.db2.gz JYLXJHQOEPPJSP-HXUWFJFHSA-N 0 3 401.554 4.237 20 0 HIADHN CN(CCNC(=O)N1CCC[C@H](c2nc3ccccc3s2)C1)Cc1ccccc1 ZINC000520424247 928559212 /nfs/dbraw/zinc/55/92/12/928559212.db2.gz YICDSRBAKUTVHP-IBGZPJMESA-N 0 3 408.571 4.317 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)Nc3ccc(Br)cc3)cc2)CC1 ZINC000520462046 928579810 /nfs/dbraw/zinc/57/98/10/928579810.db2.gz NEGRGZNUKBTIJO-UHFFFAOYSA-N 0 3 402.336 4.232 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1ccc(Cn2cccn2)cc1)c1cccc(OC)c1 ZINC000520599021 928662365 /nfs/dbraw/zinc/66/23/65/928662365.db2.gz ADYCKVNWRCGYQR-HSZRJFAPSA-N 0 3 421.545 4.145 20 0 HIADHN O=C([C@@H](Sc1ccc(F)cc1F)c1ccccc1)N1CC[C@H](N2CCCC2)C1 ZINC000520689102 928737358 /nfs/dbraw/zinc/73/73/58/928737358.db2.gz HMTISSMDEXWTMH-RXVVDRJESA-N 0 3 402.510 4.495 20 0 HIADHN COc1cccc([C@@H]2C[C@@H]2C(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)c1 ZINC000520705273 928752481 /nfs/dbraw/zinc/75/24/81/928752481.db2.gz QSAUKFJWUNLLDW-SFTDATJTSA-N 0 3 420.475 4.408 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N[C@@H](c2ccc(F)cc2)[C@@H]2CCCO2)C1 ZINC000520756240 928803120 /nfs/dbraw/zinc/80/31/20/928803120.db2.gz MQAUGJCNQLMOCV-SZOBAZRNSA-N 0 3 411.521 4.181 20 0 HIADHN COC1CCN(C(C)(C)CNC(=O)c2csc(-c3ccccc3Cl)n2)CC1 ZINC000520770647 928810073 /nfs/dbraw/zinc/81/00/73/928810073.db2.gz KWDZTAUKJAUPNM-UHFFFAOYSA-N 0 3 407.967 4.083 20 0 HIADHN Cc1noc(-c2ccc(C)c(NC(=O)N(CCCc3ccccc3)CCN(C)C)c2)n1 ZINC000520817897 928831434 /nfs/dbraw/zinc/83/14/34/928831434.db2.gz PJKHGAPXAGIDCM-UHFFFAOYSA-N 0 3 421.545 4.382 20 0 HIADHN COc1ccc2c(c1)CN(C(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1)CC2 ZINC000520823215 928832988 /nfs/dbraw/zinc/83/29/88/928832988.db2.gz PONKKUVFNXSNKI-NRFANRHFSA-N 0 3 413.587 4.298 20 0 HIADHN C[C@@H]1CN(c2ccccc2NC(=O)N2CCN(CC3CCCCC3)CC2)C[C@H](C)O1 ZINC000520826914 928834510 /nfs/dbraw/zinc/83/45/10/928834510.db2.gz XTXCOZSKDDYVHL-BGYRXZFFSA-N 0 3 414.594 4.030 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2ccc(C)cc2OC[C@@H]2CCCO2)N(C)C)cc1 ZINC000520826559 928834802 /nfs/dbraw/zinc/83/48/02/928834802.db2.gz DQBKSVRVACCFRZ-UNMCSNQZSA-N 0 3 411.546 4.286 20 0 HIADHN CCCO[C@@H]1CCCN(C(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)CC1 ZINC000520825121 928834845 /nfs/dbraw/zinc/83/48/45/928834845.db2.gz XWAQUINOKSXQDO-CTNGQTDRSA-N 0 3 412.496 4.249 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)c2nn(-c3ccc(C)cc3)c3c2CCCC3)o1 ZINC000520837494 928838836 /nfs/dbraw/zinc/83/88/36/928838836.db2.gz XGSIHOWZBQNUDT-UHFFFAOYSA-N 0 3 420.557 4.165 20 0 HIADHN Cc1cc(NC(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)ccc1C(=O)NC(C)C ZINC000520903773 928868124 /nfs/dbraw/zinc/86/81/24/928868124.db2.gz XFBXLYMUVKQYGC-RXVVDRJESA-N 0 3 408.546 4.090 20 0 HIADHN COc1ccc([C@H]2CCCN2C(=O)NC[C@H](c2ccc(C)cc2)N(C)C)cc1OC ZINC000520936468 928881556 /nfs/dbraw/zinc/88/15/56/928881556.db2.gz BKEUWLCPVCZYLN-NHCUHLMSSA-N 0 3 411.546 4.162 20 0 HIADHN Cc1cccc(N2CCN(CCCNCc3csc(-c4ccsc4)n3)CC2)c1 ZINC000520951645 928886385 /nfs/dbraw/zinc/88/63/85/928886385.db2.gz GLFMOPZBEXXZEH-UHFFFAOYSA-N 0 3 412.628 4.482 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)Nc3cc(Cl)cc4cccnc43)CC2)C[C@H](C)O1 ZINC000521006322 928922660 /nfs/dbraw/zinc/92/26/60/928922660.db2.gz JWGXFFAVXFKGOF-HOTGVXAUSA-N 0 3 416.953 4.241 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)Nc1cc(C2CC2)nn1-c1ccccc1 ZINC000521064933 928968902 /nfs/dbraw/zinc/96/89/02/928968902.db2.gz WMMPAKPKPMWCNG-UHFFFAOYSA-N 0 3 421.520 4.485 20 0 HIADHN Cc1noc2nc(-c3ccccc3)cc(C(=O)N(CCN(C)C)c3ccccc3)c12 ZINC000521173391 929043574 /nfs/dbraw/zinc/04/35/74/929043574.db2.gz IHSYMOAMIOAURE-UHFFFAOYSA-N 0 3 400.482 4.407 20 0 HIADHN COc1cc(CN(C)C(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)ccc1SC ZINC000521203329 929058944 /nfs/dbraw/zinc/05/89/44/929058944.db2.gz MPTRQGZKSFNGPH-XLIONFOSSA-N 0 3 413.587 4.394 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2C(=O)N[C@H]2CCN(C3CC3)C2)cc1C ZINC000521226494 929068664 /nfs/dbraw/zinc/06/86/64/929068664.db2.gz FHCOSUHXLLBQFO-FQEVSTJZSA-N 0 3 400.526 4.123 20 0 HIADHN CCN(CC)[C@H](CNC(=O)CCc1c(C)n[nH]c1C)c1ccc(C(F)(F)F)cc1 ZINC000521297058 929107727 /nfs/dbraw/zinc/10/77/27/929107727.db2.gz ANXBZOIFWOTSJD-LJQANCHMSA-N 0 3 410.484 4.177 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2F)c(Cl)c1 ZINC000521344334 929160593 /nfs/dbraw/zinc/16/05/93/929160593.db2.gz AYLBSEZMZNLLEP-UHFFFAOYSA-N 0 3 424.879 4.172 20 0 HIADHN CN(C(=O)CCCN1CCN(c2ccccc2)CC1)[C@@H](c1ccccc1)C(F)(F)F ZINC000521362043 929182189 /nfs/dbraw/zinc/18/21/89/929182189.db2.gz ZXXLBRWGTFIQHS-QFIPXVFZSA-N 0 3 419.491 4.351 20 0 HIADHN CC(C)[C@@H](C(=O)Nc1ccc(C(=O)N2CCc3ccccc32)cc1)N1CCCCC1 ZINC000521462221 929232963 /nfs/dbraw/zinc/23/29/63/929232963.db2.gz CVNYYLFUIKSWFL-QHCPKHFHSA-N 0 3 405.542 4.339 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N(Cc2cccs2)C[C@@H]2CCCO2)N(C)C)cc1 ZINC000521511023 929262760 /nfs/dbraw/zinc/26/27/60/929262760.db2.gz NKDMTRQMIZCRAC-FPOVZHCZSA-N 0 3 401.576 4.050 20 0 HIADHN Cc1cccc(NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)c1C(=O)N1CCCC1 ZINC000521532488 929278548 /nfs/dbraw/zinc/27/85/48/929278548.db2.gz QCIDQKHVTQFZAL-HXUWFJFHSA-N 0 3 423.532 4.221 20 0 HIADHN CN(C(=O)Nc1ccc(-c2nccs2)cc1)C1CCN(CCc2ccccn2)CC1 ZINC000521560588 929295440 /nfs/dbraw/zinc/29/54/40/929295440.db2.gz FUCMWDVNBUWDPY-UHFFFAOYSA-N 0 3 421.570 4.376 20 0 HIADHN O=C(Nc1ccc(OCc2ccccn2)c(Cl)c1)N1CCN(C2CCCC2)CC1 ZINC000521671426 929357896 /nfs/dbraw/zinc/35/78/96/929357896.db2.gz KYMJRGDIPIRLFD-UHFFFAOYSA-N 0 3 414.937 4.406 20 0 HIADHN COCCCn1nccc1CN[C@@H]1CCCc2c3cc(Br)ccc3[nH]c21 ZINC000521674395 929359869 /nfs/dbraw/zinc/35/98/69/929359869.db2.gz GDQMZAKMQQKDMM-LJQANCHMSA-N 0 3 417.351 4.331 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)N[C@@H]1CCCc2occc21 ZINC000521686007 929366345 /nfs/dbraw/zinc/36/63/45/929366345.db2.gz USMCKAKUBQNSLL-GOSISDBHSA-N 0 3 409.452 4.449 20 0 HIADHN CCOc1cccc([C@H](C)NC(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)c1 ZINC000521694424 929369325 /nfs/dbraw/zinc/36/93/25/929369325.db2.gz NZWPIOXQFKXCCO-INIZCTEOSA-N 0 3 405.489 4.198 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N(C)C[C@H]1CCCOC1)c1ccc(C(F)(F)F)cc1 ZINC000521696086 929371100 /nfs/dbraw/zinc/37/11/00/929371100.db2.gz FCTKSXSHXXSTJR-VQIMIIECSA-N 0 3 415.500 4.156 20 0 HIADHN Cc1sc2nc(C)nc(SCC(=O)N3CCCN(C(C)(C)C)CC3)c2c1C ZINC000521755701 929417136 /nfs/dbraw/zinc/41/71/36/929417136.db2.gz FXZHVYQWCVILKT-UHFFFAOYSA-N 0 3 406.621 4.041 20 0 HIADHN Cc1cnc(-c2cccc(NC(=O)NCC3(N4CCSCC4)CCCC3)c2)o1 ZINC000521809372 929468638 /nfs/dbraw/zinc/46/86/38/929468638.db2.gz DGSNQDRNLOIPQK-UHFFFAOYSA-N 0 3 400.548 4.133 20 0 HIADHN CCc1nc(CNCc2ccccc2CN2CCN(c3ccccc3)CC2)cs1 ZINC000521815108 929472775 /nfs/dbraw/zinc/47/27/75/929472775.db2.gz HUMUTCQXWNCQFU-UHFFFAOYSA-N 0 3 406.599 4.318 20 0 HIADHN CCn1c(CNC[C@H]2CCN(c3ccc(Br)cc3)C2)nc2ccccc21 ZINC000521816932 929474302 /nfs/dbraw/zinc/47/43/02/929474302.db2.gz MRXJZQFCWPGXPC-MRXNPFEDSA-N 0 3 413.363 4.435 20 0 HIADHN CC(C)CN(CC(=O)N1CCC[C@H]1c1ccc2c(c1)OCCO2)Cc1ccccc1 ZINC000521816230 929474668 /nfs/dbraw/zinc/47/46/68/929474668.db2.gz LEBIFHSABKZUTI-QFIPXVFZSA-N 0 3 408.542 4.280 20 0 HIADHN CC(=O)Nc1ccc(Cl)cc1NC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000521852287 929501672 /nfs/dbraw/zinc/50/16/72/929501672.db2.gz PLIVTXSHIAPCSU-MRXNPFEDSA-N 0 3 403.885 4.288 20 0 HIADHN COc1ccccc1C[C@@H]1CCCN1C(=O)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000521893240 929540520 /nfs/dbraw/zinc/54/05/20/929540520.db2.gz GBRZDMAIHLMOLI-GOTSBHOMSA-N 0 3 407.558 4.249 20 0 HIADHN Cc1ccc(NC(=O)CCCN2CCN(c3ccccc3)CC2)cc1OCC(F)F ZINC000521929506 929570191 /nfs/dbraw/zinc/57/01/91/929570191.db2.gz ZDBWQHYGYMZRMK-UHFFFAOYSA-N 0 3 417.500 4.180 20 0 HIADHN C[C@@H](CNC(=O)CCc1nnc(-c2cc3ccccc3o2)o1)N(C)Cc1ccccc1 ZINC000521956783 929592347 /nfs/dbraw/zinc/59/23/47/929592347.db2.gz CMEFELGHIHAMKC-KRWDZBQOSA-N 0 3 418.497 4.052 20 0 HIADHN O=C(Nc1ccccc1-c1nc2ccccc2[nH]1)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000521979477 929609631 /nfs/dbraw/zinc/60/96/31/929609631.db2.gz XCGCTHVTPCWRMA-LJQANCHMSA-N 0 3 411.509 4.476 20 0 HIADHN Cc1ccc(OCCNC(=O)Nc2ccc(CCN3CCSCC3)cc2)c(C)c1 ZINC000521987612 929612734 /nfs/dbraw/zinc/61/27/34/929612734.db2.gz XUOOSWSQKLLHNY-UHFFFAOYSA-N 0 3 413.587 4.095 20 0 HIADHN COCCN(Cc1cccs1)C(=O)NC[C@H](c1ccc(C)cc1)N1CCCC1 ZINC000521993497 929615312 /nfs/dbraw/zinc/61/53/12/929615312.db2.gz NYVUTZJVPNSOCX-OAQYLSRUSA-N 0 3 401.576 4.052 20 0 HIADHN COc1cccc(NC(=O)[C@H](NC[C@H](C)N(C)Cc2ccccc2)c2ccccc2)c1 ZINC000522057018 929625083 /nfs/dbraw/zinc/62/50/83/929625083.db2.gz XUVBNUJFHLASIB-NBGIEHNGSA-N 0 3 417.553 4.485 20 0 HIADHN COc1ccc(OC(F)F)c(NC(=O)NC[C@H]2CCCN2Cc2ccccc2)c1 ZINC000524483030 929631838 /nfs/dbraw/zinc/63/18/38/929631838.db2.gz CBUUSZAZYNCHBP-MRXNPFEDSA-N 0 3 405.445 4.083 20 0 HIADHN O=C(NCc1ccc2ccccc2n1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000524496100 929643784 /nfs/dbraw/zinc/64/37/84/929643784.db2.gz FKUIGMXFVIWHKI-UHFFFAOYSA-N 0 3 406.555 4.148 20 0 HIADHN O=C([C@H]1CCCN(Cc2cccc(F)c2)C1)N1CCC(Oc2ccc(F)cc2)CC1 ZINC000524541417 929673489 /nfs/dbraw/zinc/67/34/89/929673489.db2.gz PNJXFCDTLJRHRT-IBGZPJMESA-N 0 3 414.496 4.247 20 0 HIADHN CCN(Cc1ccc(OC)c(OC)c1)C(=O)CN1C[C@H](c2ccccc2C)C[C@@H]1C ZINC000524595899 929705123 /nfs/dbraw/zinc/70/51/23/929705123.db2.gz ZBBRAPAIGROLHF-PZJWPPBQSA-N 0 3 410.558 4.239 20 0 HIADHN Cc1cc(NC(=O)NC[C@@H]2CCCN2Cc2ccccc2)ccc1OC1CCOCC1 ZINC000524599807 929709542 /nfs/dbraw/zinc/70/95/42/929709542.db2.gz XZFSUSIWOUPGMQ-QFIPXVFZSA-N 0 3 423.557 4.339 20 0 HIADHN COCCN1CC[C@H](NC(=O)N[C@H](C)c2ccccc2-c2ccc(Cl)cc2)C1 ZINC000524605416 929715543 /nfs/dbraw/zinc/71/55/43/929715543.db2.gz YJKSMMAZALFOGS-APWZRJJASA-N 0 3 401.938 4.088 20 0 HIADHN COCCOc1ccc(NC(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)c(C)c1 ZINC000524623106 929730266 /nfs/dbraw/zinc/73/02/66/929730266.db2.gz ZPIRFJMIGAKLIR-FQEVSTJZSA-N 0 3 411.546 4.149 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1ccc(Cn2cccn2)cc1 ZINC000524623733 929732248 /nfs/dbraw/zinc/73/22/48/929732248.db2.gz OAZDOTXWYZSZOA-FQEVSTJZSA-N 0 3 403.530 4.060 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)c1cccc(C(=O)N(C)c2ccccc2)c1 ZINC000524651425 929764047 /nfs/dbraw/zinc/76/40/47/929764047.db2.gz PBNCCLQTRHTMSW-UHFFFAOYSA-N 0 3 417.509 4.286 20 0 HIADHN CN(C(=O)c1ccccc1Oc1cccc(Br)c1)[C@@H]1CCCN(C)C1 ZINC000524653415 929765324 /nfs/dbraw/zinc/76/53/24/929765324.db2.gz YGLLHEGEBMQPAR-MRXNPFEDSA-N 0 3 403.320 4.408 20 0 HIADHN Cc1noc(C)c1COc1ccc(CC(=O)NC[C@@H](C)N(C)Cc2ccccc2)cc1 ZINC000524692192 929801578 /nfs/dbraw/zinc/80/15/78/929801578.db2.gz TURXWYOVMDZQAG-GOSISDBHSA-N 0 3 421.541 4.050 20 0 HIADHN C[C@@H]1CCN(C(=O)c2ccccc2OCc2ccncc2)CCN1Cc1ccccc1 ZINC000524711017 929807138 /nfs/dbraw/zinc/80/71/38/929807138.db2.gz LDMHUUCGCRBHJI-OAQYLSRUSA-N 0 3 415.537 4.397 20 0 HIADHN COc1ccc([C@H](NC(=O)CC2(N3CCOCC3)CCCC2)c2ccc(C)cc2)cc1 ZINC000524723549 929810775 /nfs/dbraw/zinc/81/07/75/929810775.db2.gz NFLBPUYMGUIQAB-RUZDIDTESA-N 0 3 422.569 4.244 20 0 HIADHN COc1ccc([C@@H](CNC(=O)NCc2ccccc2OCC2CC2)N2CCCC2)cc1 ZINC000524806160 929836597 /nfs/dbraw/zinc/83/65/97/929836597.db2.gz HTRVDILJIXNMIM-HSZRJFAPSA-N 0 3 423.557 4.120 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)[C@H]1C[C@H]1c1c(F)cccc1Cl ZINC000524833442 929851437 /nfs/dbraw/zinc/85/14/37/929851437.db2.gz CIEIQZFVDGGNIA-CABCVRRESA-N 0 3 410.867 4.451 20 0 HIADHN CC(=O)c1ccc(OCCCC(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)cc1 ZINC000524864922 929864067 /nfs/dbraw/zinc/86/40/67/929864067.db2.gz IDRSKCATIAUCGE-HXUWFJFHSA-N 0 3 408.542 4.171 20 0 HIADHN COc1ccccc1C1(CNC(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)CC1 ZINC000524881535 929870576 /nfs/dbraw/zinc/87/05/76/929870576.db2.gz KURIMIGIGPNIAQ-HXUWFJFHSA-N 0 3 407.558 4.033 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)[C@@H]2C[C@@H]2c2ccccc2OC(F)(F)F)o1 ZINC000524959023 929921850 /nfs/dbraw/zinc/92/18/50/929921850.db2.gz IJISZDZREHTLGD-QZTJIDSGSA-N 0 3 410.436 4.181 20 0 HIADHN CC(C)C(=O)Nc1ccc(Cl)c(C(=O)N(Cc2ccco2)C2CCN(C)CC2)c1 ZINC000525016337 929976528 /nfs/dbraw/zinc/97/65/28/929976528.db2.gz VULDYCVAYHMUBT-UHFFFAOYSA-N 0 3 417.937 4.264 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2cccc(C(F)F)c2)cc1)[C@H]1CCCN(C)C1 ZINC000525065049 930012600 /nfs/dbraw/zinc/01/26/00/930012600.db2.gz IMKVBLGJEFDKKI-IBGZPJMESA-N 0 3 401.457 4.043 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1)[C@@H]1CCCN(C)C1 ZINC000525066249 930013623 /nfs/dbraw/zinc/01/36/23/930013623.db2.gz MDADBBWSDDCAAT-LJQANCHMSA-N 0 3 419.447 4.124 20 0 HIADHN CCc1nc(C)c([C@H](C)N(C)CCC(=O)Nc2ccc(N3CCCC3=O)cc2)s1 ZINC000525121337 930048567 /nfs/dbraw/zinc/04/85/67/930048567.db2.gz IQOWBPURTOLINF-INIZCTEOSA-N 0 3 414.575 4.162 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@H](C)N2CC[C@@H](c3ccccc3)[C@@H](C)C2)cc1OC ZINC000525126128 930049785 /nfs/dbraw/zinc/04/97/85/930049785.db2.gz PXLJYBQCHMJNTB-CNNODRBYSA-N 0 3 410.558 4.176 20 0 HIADHN CC[C@@H](C)[C@H](NCc1cnc2c(C)cccn12)C(=O)Nc1cccc(N2CCCC2)c1 ZINC000525192947 930082163 /nfs/dbraw/zinc/08/21/63/930082163.db2.gz GZGGCFDNJIFWTA-JPYJTQIMSA-N 0 3 419.573 4.386 20 0 HIADHN CCN1CCN(c2ccc(C(=O)NCc3ccc(-c4csc(C)n4)cc3)cc2)CC1 ZINC000525241002 930101482 /nfs/dbraw/zinc/10/14/82/930101482.db2.gz KXEPLJCCZRTWOJ-UHFFFAOYSA-N 0 3 420.582 4.190 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)NCc1ccc(-c2ccncc2)cc1 ZINC000525317370 930155790 /nfs/dbraw/zinc/15/57/90/930155790.db2.gz ARXLQBJMNGVOJG-UHFFFAOYSA-N 0 3 406.505 4.161 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)NCCc1cc2ccccc2o1 ZINC000525318393 930157429 /nfs/dbraw/zinc/15/74/29/930157429.db2.gz HDOCXSZZQQJOFL-UHFFFAOYSA-N 0 3 401.457 4.027 20 0 HIADHN Cc1ccc(C(=O)NC[C@@H]2CCCN2Cc2ccccc2)cc1NC(=O)NC(C)(C)C ZINC000525375609 930204573 /nfs/dbraw/zinc/20/45/73/930204573.db2.gz WRUVLHDBAHLWHK-NRFANRHFSA-N 0 3 422.573 4.309 20 0 HIADHN CCN(CC)[C@H](CNC(=O)[C@@H](c1c(F)cccc1Cl)N(C)C)c1ccsc1 ZINC000525383931 930209849 /nfs/dbraw/zinc/20/98/49/930209849.db2.gz HLFAMSBMCUBHMB-IEBWSBKVSA-N 0 3 411.974 4.343 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)c1cc(F)cc(Br)c1 ZINC000525384484 930211515 /nfs/dbraw/zinc/21/15/15/930211515.db2.gz XFRNPPFRCDEBFK-OAHLLOKOSA-N 0 3 405.311 4.325 20 0 HIADHN CC(C)c1n[nH]c(C(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)c1Br ZINC000525392912 930214956 /nfs/dbraw/zinc/21/49/56/930214956.db2.gz FKEJIJCAMVXTNG-HNNXBMFYSA-N 0 3 419.367 4.032 20 0 HIADHN CCCN(C(=O)NC[C@H](CC)N1CCc2ccccc2C1)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000525418867 930230107 /nfs/dbraw/zinc/23/01/07/930230107.db2.gz BUFJZPZSVPPNJO-AFXVXQJMSA-N 0 3 413.606 4.058 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)N[C@@H]1C[C@H]1c1c(F)cccc1Cl ZINC000525423510 930233201 /nfs/dbraw/zinc/23/32/01/930233201.db2.gz AVTRGSNFOOSCKK-WIYYLYMNSA-N 0 3 415.940 4.054 20 0 HIADHN CC(C)(C)N1CCCN(C(=O)C(=O)Nc2cccc(CSC3CCCC3)c2)CC1 ZINC000525436859 930239454 /nfs/dbraw/zinc/23/94/54/930239454.db2.gz OYOGCEUAJKDVLM-UHFFFAOYSA-N 0 3 417.619 4.134 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1cccc(N2CCCCC2=O)c1 ZINC000525445318 930244370 /nfs/dbraw/zinc/24/43/70/930244370.db2.gz JJGPBCUKXAPJOG-FQEVSTJZSA-N 0 3 420.557 4.332 20 0 HIADHN CCCCOc1ncccc1CNC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C ZINC000525448559 930246429 /nfs/dbraw/zinc/24/64/29/930246429.db2.gz JUGKECHISYOCOO-FQEVSTJZSA-N 0 3 410.562 4.067 20 0 HIADHN CCC(CC)[C@H](NC(=O)NC[C@]1(O)CCN(Cc2ccccc2)C1)c1cccs1 ZINC000525497382 930284645 /nfs/dbraw/zinc/28/46/45/930284645.db2.gz PIMDKOJAEAKQQE-JTHBVZDNSA-N 0 3 415.603 4.162 20 0 HIADHN O=C(NC[C@@]1(O)CCN(Cc2ccccc2)C1)Nc1ccccc1-c1ccccc1 ZINC000525504380 930289274 /nfs/dbraw/zinc/28/92/74/930289274.db2.gz IXOMGCXBRLNOQK-VWLOTQADSA-N 0 3 401.510 4.112 20 0 HIADHN CN(CCNC(=O)Nc1cnn(-c2cccc(C(F)(F)F)c2)c1)Cc1ccccc1 ZINC000525517040 930296129 /nfs/dbraw/zinc/29/61/29/930296129.db2.gz UDDMVAIKRXPIMH-UHFFFAOYSA-N 0 3 417.435 4.145 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)c3ccccc3OC3CCCCC3)CC2)C[C@@H](C)O1 ZINC000525569801 930335804 /nfs/dbraw/zinc/33/58/04/930335804.db2.gz UXTSQPVBHMYVSU-WOJBJXKFSA-N 0 3 414.590 4.360 20 0 HIADHN CC(C)CC(=O)Nc1ccc(C(=O)N(CCN(C)C)Cc2ccc(F)cc2)cc1F ZINC000525648433 930381425 /nfs/dbraw/zinc/38/14/25/930381425.db2.gz GTXRLNNDKOKGEA-UHFFFAOYSA-N 0 3 417.500 4.153 20 0 HIADHN COc1ccc(-c2ccc(CNC(=O)[C@H]3CCCN(Cc4cccnc4)C3)cc2)cc1 ZINC000525678140 930401322 /nfs/dbraw/zinc/40/13/22/930401322.db2.gz CQDKNUYZLXRHBW-DEOSSOPVSA-N 0 3 415.537 4.286 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)cc1CN[C@H](C)[C@H]1CN(Cc2ccccc2)CCO1 ZINC000525697254 930407767 /nfs/dbraw/zinc/40/77/67/930407767.db2.gz TWTCQIKJUNVETJ-NTKDMRAZSA-N 0 3 424.976 4.213 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)cc1CN[C@H](C)[C@@H]1CN(Cc2ccccc2)CCO1 ZINC000525697253 930407972 /nfs/dbraw/zinc/40/79/72/930407972.db2.gz TWTCQIKJUNVETJ-DVECYGJZSA-N 0 3 424.976 4.213 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(NC(=O)C2CC2)cc1)C(=O)N1CCSc2ccccc21 ZINC000525761771 930435344 /nfs/dbraw/zinc/43/53/44/930435344.db2.gz FCRCRRVTWIALAL-HZPDHXFCSA-N 0 3 409.555 4.213 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N2CCO[C@@H](c3ccccc3C)C2)N2CCCC2)cc1 ZINC000525809356 930452141 /nfs/dbraw/zinc/45/21/41/930452141.db2.gz HJBJGABPZIGGOO-BJKOFHAPSA-N 0 3 407.558 4.223 20 0 HIADHN COc1c(Br)cc(CN(C)CCc2ccccn2)cc1Br ZINC000525867041 930472492 /nfs/dbraw/zinc/47/24/92/930472492.db2.gz CFNRMOHCRLYTQN-UHFFFAOYSA-N 0 3 414.141 4.290 20 0 HIADHN CSc1ccc(CNCc2ccc(OCCN3CCOCC3)c(Cl)c2)cc1 ZINC000525878502 930474955 /nfs/dbraw/zinc/47/49/55/930474955.db2.gz OLQPZRNRSGCXRC-UHFFFAOYSA-N 0 3 406.979 4.063 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)c1cc2sc(N3CCCC3)nc2s1 ZINC000525988460 930502506 /nfs/dbraw/zinc/50/25/06/930502506.db2.gz BHPCVANEMZSINM-UHFFFAOYSA-N 0 3 416.572 4.281 20 0 HIADHN COc1ccc([C@@H](C)N[C@@H]2CCCN(Cc3ccc(F)cc3F)C2=O)cc1Cl ZINC000526048016 930514766 /nfs/dbraw/zinc/51/47/66/930514766.db2.gz QGBIJBWKBHSMSA-BFUOFWGJSA-N 0 3 408.876 4.469 20 0 HIADHN CC(C)(CNC(=O)[C@H]1CCCN(Cc2cccnc2)C1)c1ccc(C(F)(F)F)cc1 ZINC000526062848 930516705 /nfs/dbraw/zinc/51/67/05/930516705.db2.gz ONTXOEMTKUWWFY-SFHVURJKSA-N 0 3 419.491 4.406 20 0 HIADHN C[C@H](NCC(=O)Nc1ccc(CN2CCOCC2)cc1)c1cc2ccccc2s1 ZINC000526944948 930554631 /nfs/dbraw/zinc/55/46/31/930554631.db2.gz VLHBRSAQVGEMSO-KRWDZBQOSA-N 0 3 409.555 4.023 20 0 HIADHN Cc1ccccc1[C@H]([C@@H](C)NC(=O)C(=O)Nc1ccc2oc(C(C)C)nc2c1)N(C)C ZINC000526957889 930558136 /nfs/dbraw/zinc/55/81/36/930558136.db2.gz VXJKDDJCEIZZAW-IERDGZPVSA-N 0 3 422.529 4.006 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3cc4ccccn4c3)c(OCC)c2)CC1 ZINC000527061162 930577843 /nfs/dbraw/zinc/57/78/43/930577843.db2.gz VKLPFXMTUZGJMC-UHFFFAOYSA-N 0 3 406.530 4.122 20 0 HIADHN CC1(C)C[C@H](NCc2ccc3c(c2)CCS3(=O)=O)c2cc(Br)ccc21 ZINC000527066847 930578715 /nfs/dbraw/zinc/57/87/15/930578715.db2.gz XDXJXPGZSMGCIM-SFHVURJKSA-N 0 3 420.372 4.291 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2cc(F)ccc2OCC(F)(F)F)[C@H]1c1ccccc1 ZINC000527066999 930579201 /nfs/dbraw/zinc/57/92/01/930579201.db2.gz HHEICPHIWAZHGX-MAUKXSAKSA-N 0 3 411.399 4.334 20 0 HIADHN COc1ccc([C@@H](C)[C@H](C)Nc2ccc3nc(CCN4CCOCC4)[nH]c3c2)cc1 ZINC000527233216 930617621 /nfs/dbraw/zinc/61/76/21/930617621.db2.gz VXMLBFFEAMDELB-ROUUACIJSA-N 0 3 408.546 4.050 20 0 HIADHN COc1cc(NC(=O)CN[C@@H](C)c2cc3ccccc3s2)cc(OC)c1OC ZINC000527484906 930666600 /nfs/dbraw/zinc/66/66/00/930666600.db2.gz AWPJIJXBTASYLE-ZDUSSCGKSA-N 0 3 400.500 4.216 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2cc3c(cc2Cl)OCCCO3)[C@H]1c1ccccc1 ZINC000530409735 930705130 /nfs/dbraw/zinc/70/51/30/930705130.db2.gz IWNMHKVRHRNLNW-OXQOHEQNSA-N 0 3 401.894 4.068 20 0 HIADHN CNC(=O)c1ccc(CN[C@@H](Cc2ccccn2)c2ccc(Br)cc2)cc1 ZINC000530439488 930709021 /nfs/dbraw/zinc/70/90/21/930709021.db2.gz ZDCNECMDLCGTOM-NRFANRHFSA-N 0 3 424.342 4.277 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2ccc(NC(=O)c3ccco3)cc2)[C@@H]1c1ccccc1 ZINC000530462575 930718189 /nfs/dbraw/zinc/71/81/89/930718189.db2.gz LXJRISRHBJTSOQ-FPOVZHCZSA-N 0 3 404.470 4.099 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2ccccc2OC[C@@H]2CCCCO2)[C@@H]1c1ccccc1 ZINC000530462599 930719617 /nfs/dbraw/zinc/71/96/17/930719617.db2.gz PMHISMGMECXBLC-RRPUWOKSSA-N 0 3 409.530 4.201 20 0 HIADHN COC(=O)c1cc2c(o1)c(OC)ccc2CNCc1c(C)nn(-c2ccccc2)c1C ZINC000530664736 930791081 /nfs/dbraw/zinc/79/10/81/930791081.db2.gz VSGPKOOMFLBTPB-UHFFFAOYSA-N 0 3 419.481 4.320 20 0 HIADHN C[C@@H](Sc1ccccc1)c1ccc(NC(=O)C(=O)NC[C@H](C)N2CCCC2)cc1 ZINC000530746914 930815517 /nfs/dbraw/zinc/81/55/17/930815517.db2.gz LYIYRRIIXVIUDX-ZWKOTPCHSA-N 0 3 411.571 4.079 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccnc2)C1)N1CCC[C@@]2(CCCc3ccccc32)C1 ZINC000530759219 930818258 /nfs/dbraw/zinc/81/82/58/930818258.db2.gz GTBFRSWCVQAZCG-BVAGGSTKSA-N 0 3 403.570 4.190 20 0 HIADHN CN(C(=O)NCCc1ccc(OC(F)F)cc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000530827119 930833442 /nfs/dbraw/zinc/83/34/42/930833442.db2.gz OHSSCZKYJQYXQH-HXUWFJFHSA-N 0 3 417.500 4.137 20 0 HIADHN Clc1cc(Cl)c(OCCNCc2cnc(N3CCCC3)nc2)c(Cl)c1 ZINC000530952536 930867073 /nfs/dbraw/zinc/86/70/73/930867073.db2.gz WJYWKVDTDATCDK-UHFFFAOYSA-N 0 3 401.725 4.206 20 0 HIADHN COC(=O)CCC1CCN([C@H](C)C(=O)N[C@@H](C)c2ccc(Cl)cc2Cl)CC1 ZINC000531001638 930880798 /nfs/dbraw/zinc/88/07/98/930880798.db2.gz UBPHYPIMOBSRNQ-UONOGXRCSA-N 0 3 415.361 4.224 20 0 HIADHN FC(F)Oc1ccc(C[NH2+]Cc2nnc(-c3ccc(Br)cc3)[n-]2)cc1 ZINC000531018262 930886046 /nfs/dbraw/zinc/88/60/46/930886046.db2.gz SLUAPLYGGRXKSH-UHFFFAOYSA-N 0 3 409.234 4.125 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N[C@H](c2cccs2)c2ccc(F)cc2)CC1 ZINC000531106476 930921918 /nfs/dbraw/zinc/92/19/18/930921918.db2.gz ZIUZFTBACUYMMI-NRFANRHFSA-N 0 3 419.566 4.165 20 0 HIADHN CN(C)Cc1ccc(-c2noc(COc3ccc(F)cc3Br)n2)cc1 ZINC000531110145 930922963 /nfs/dbraw/zinc/92/29/63/930922963.db2.gz HFNASCIPPZGSNX-UHFFFAOYSA-N 0 3 406.255 4.279 20 0 HIADHN O=C(Nc1cccc(NC(=O)[C@@H]2CCCN(Cc3cccnc3)C2)c1)C1CCCCC1 ZINC000531179537 930955150 /nfs/dbraw/zinc/95/51/50/930955150.db2.gz NWJDMCOZXQZCOP-OAQYLSRUSA-N 0 3 420.557 4.451 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)Nc1ccccc1Br)[C@@H]1Oc2ccccc2[C@H]1C ZINC000531212526 930968475 /nfs/dbraw/zinc/96/84/75/930968475.db2.gz CIWUTXCSWQGULA-VYGYDYRJSA-N 0 3 403.320 4.319 20 0 HIADHN COc1cccc(C2=CCN(C(=O)NC[C@@H](c3cccs3)N3CCCC3)CC2)c1 ZINC000531227999 930975015 /nfs/dbraw/zinc/97/50/15/930975015.db2.gz MKUZZCKHKSIKAO-NRFANRHFSA-N 0 3 411.571 4.393 20 0 HIADHN O=C([C@H]1CCCN(Cc2cccnc2)C1)N1CCC[C@H]1c1nc2cc(Cl)ccc2[nH]1 ZINC000531243710 930979234 /nfs/dbraw/zinc/97/92/34/930979234.db2.gz NGVQQYARMYJRKW-UWJYYQICSA-N 0 3 423.948 4.187 20 0 HIADHN CC(C)Sc1ccc([C@@H](C)NC(=O)N2CC[C@H](N3CCN(C(C)C)CC3)C2)cc1 ZINC000531584352 931110465 /nfs/dbraw/zinc/11/04/65/931110465.db2.gz RVYCWQCLAOHJPX-CTNGQTDRSA-N 0 3 418.651 4.058 20 0 HIADHN O=C(Nc1ccc(F)cc1)c1ccc(CNCc2ccccc2N2CCOCC2)cc1 ZINC000531609804 931122821 /nfs/dbraw/zinc/12/28/21/931122821.db2.gz YBALRIOSMALOAK-UHFFFAOYSA-N 0 3 419.500 4.204 20 0 HIADHN Cn1cc(CNCc2ccc(C(=O)Nc3ccc(F)cc3)cc2)c(-c2ccncc2)n1 ZINC000531609933 931124080 /nfs/dbraw/zinc/12/40/80/931124080.db2.gz SXSDCRHXJLBUFF-UHFFFAOYSA-N 0 3 415.472 4.163 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@H](C)N[C@@H]2CCCc3nc(C)sc32)cc1 ZINC000531677057 931147880 /nfs/dbraw/zinc/14/78/80/931147880.db2.gz WHFMZPGSULSECV-KBXCAEBGSA-N 0 3 407.605 4.210 20 0 HIADHN CC(C)NC(=O)Nc1ccc([C@@H](C)NCc2ccc(OCC(F)(F)F)nc2)cc1 ZINC000531681776 931149708 /nfs/dbraw/zinc/14/97/08/931149708.db2.gz LJCCYCSQTZXXOK-CQSZACIVSA-N 0 3 410.440 4.403 20 0 HIADHN O=C(Nc1ccc2[nH]c([C@H]3CCCO3)nc2c1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000531681215 931149870 /nfs/dbraw/zinc/14/98/70/931149870.db2.gz YKMGDDUKGOZVPW-VGOFRKELSA-N 0 3 422.504 4.404 20 0 HIADHN Cc1nc(-c2cccnc2)sc1[C@H](C)NCc1ccccc1CN1CCCC1=O ZINC000531686269 931151620 /nfs/dbraw/zinc/15/16/20/931151620.db2.gz HFYTZYFKDVZBDB-INIZCTEOSA-N 0 3 406.555 4.487 20 0 HIADHN COc1cc([C@@H](C)NCc2ccccc2CS(=O)(=O)NC(C)C)ccc1SC ZINC000531703238 931165157 /nfs/dbraw/zinc/16/51/57/931165157.db2.gz OKWCSYFYNOPQCX-MRXNPFEDSA-N 0 3 422.616 4.096 20 0 HIADHN C[C@H](NCc1ccc(NC(=O)c2cccnc2)cc1)c1ccc2c(c1)OCCCO2 ZINC000531708539 931168130 /nfs/dbraw/zinc/16/81/30/931168130.db2.gz FGKHAIMAAYFELT-KRWDZBQOSA-N 0 3 403.482 4.346 20 0 HIADHN CC[C@H](N[C@@H](C)c1cccc(S(=O)(=O)N(C)C)c1)c1ccc(OC(F)F)cc1 ZINC000531710179 931168712 /nfs/dbraw/zinc/16/87/12/931168712.db2.gz NHZBDXMORUTZCF-LIRRHRJNSA-N 0 3 412.502 4.340 20 0 HIADHN COc1ccc(S(=O)(=O)[N-]c2cccc(C[NH2+][C@H](C)CCc3ccco3)c2)cc1 ZINC000531711682 931170011 /nfs/dbraw/zinc/17/00/11/931170011.db2.gz ZCAAROLNASGVCP-QGZVFWFLSA-N 0 3 414.527 4.200 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(NC(=O)C2CC2)cc1)C(=O)N1c2ccccc2CC[C@@H]1C ZINC000531752504 931182967 /nfs/dbraw/zinc/18/29/67/931182967.db2.gz JRRQXNDHDGLHHB-BZSNNMDCSA-N 0 3 405.542 4.442 20 0 HIADHN C[C@@H](NC(=O)[C@H]1CCCN(Cc2cccnc2)C1)c1ccc(OCC2CC2)c(F)c1 ZINC000531834828 931213282 /nfs/dbraw/zinc/21/32/82/931213282.db2.gz NCGRGGSQZUURSQ-UTKZUKDTSA-N 0 3 411.521 4.099 20 0 HIADHN CC[C@@H](NCc1cccc(-n2cccn2)c1)c1ccccc1OCC(=O)N1CCCC1 ZINC000531857256 931222646 /nfs/dbraw/zinc/22/26/46/931222646.db2.gz YDCUVKDWXKHSAA-HSZRJFAPSA-N 0 3 418.541 4.114 20 0 HIADHN CCC(=O)Nc1cccc(CN[C@H](C)CC(=O)Nc2ccc(Br)cc2)c1 ZINC000531937992 931253933 /nfs/dbraw/zinc/25/39/33/931253933.db2.gz XQKCZJGUNUFRKK-CQSZACIVSA-N 0 3 418.335 4.305 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)[C@H](C)Cc1ccc(F)c(Br)c1 ZINC000531941733 931255084 /nfs/dbraw/zinc/25/50/84/931255084.db2.gz RZXAIBGVCAROBY-CYBMUJFWSA-N 0 3 423.326 4.476 20 0 HIADHN COc1ccc(Cl)cc1[C@H](CC(C)C)NCc1ccc(N2CCN(C)CC2)nc1 ZINC000531942256 931256059 /nfs/dbraw/zinc/25/60/59/931256059.db2.gz DJHPNYKMLQZKRL-NRFANRHFSA-N 0 3 416.997 4.372 20 0 HIADHN Cc1nc(C(C)(C)C)sc1[C@@H](C)NCc1ccc(C(=O)N2CCOCC2)cc1 ZINC000531954240 931262646 /nfs/dbraw/zinc/26/26/46/931262646.db2.gz KMTSFLQJCFEXBX-OAHLLOKOSA-N 0 3 401.576 4.072 20 0 HIADHN CC[C@H](N[C@@H](C)c1ccc(-n2ccnc2C)cc1)c1ccccc1OCC(=O)N(C)C ZINC000531955573 931264008 /nfs/dbraw/zinc/26/40/08/931264008.db2.gz AJJZZPLAZUMDQF-MBSDFSHPSA-N 0 3 420.557 4.450 20 0 HIADHN COc1ccc(-c2nc3c(s2)[C@H](NCc2ccc4c(c2)nnn4C)CCC3)cc1 ZINC000531957085 931264997 /nfs/dbraw/zinc/26/49/97/931264997.db2.gz DNBFNODERAVFCY-QGZVFWFLSA-N 0 3 405.527 4.268 20 0 HIADHN CC(C)NS(=O)(=O)Cc1ccccc1CN[C@@H](C)c1ccc(C(F)(F)F)cc1 ZINC000531958869 931265831 /nfs/dbraw/zinc/26/58/31/931265831.db2.gz RVGZATBAIGECIZ-HNNXBMFYSA-N 0 3 414.493 4.384 20 0 HIADHN CCS(=O)(=O)Nc1ccc([C@H](C)N[C@H](c2ccc(F)cc2)[C@H]2CCCO2)cc1 ZINC000531962089 931266716 /nfs/dbraw/zinc/26/67/16/931266716.db2.gz NIZQATWCWBCDKG-IWMITWMQSA-N 0 3 406.523 4.158 20 0 HIADHN C[C@@H](N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1)c1ccc2c(c1)CCC(=O)N2 ZINC000531970648 931270383 /nfs/dbraw/zinc/27/03/83/931270383.db2.gz BKTCROWAPQIMCH-KOSHJBKYSA-N 0 3 413.521 4.472 20 0 HIADHN O=C(N[C@@H](c1ccccc1)c1cccc(F)c1)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000532030651 931290528 /nfs/dbraw/zinc/29/05/28/931290528.db2.gz JINIBAQSUOLEOX-VWNXMTODSA-N 0 3 403.501 4.339 20 0 HIADHN Cc1[nH]c(=O)c(C(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)cc1-c1ccccc1 ZINC000532079357 931305136 /nfs/dbraw/zinc/30/51/36/931305136.db2.gz TYQMJRJAGNIKFH-LAUBAEHRSA-N 0 3 401.510 4.155 20 0 HIADHN CC(C)N1CCN([C@H]2CCN(C(=O)c3cc(-c4ccccc4)ccc3Cl)C2)CC1 ZINC000532088722 931307593 /nfs/dbraw/zinc/30/75/93/931307593.db2.gz GUYQGZLPKIDZKJ-NRFANRHFSA-N 0 3 411.977 4.248 20 0 HIADHN CC[C@@H](NCC(=O)Nc1cc(OC)cc(OC)c1)c1ccc(Br)cc1 ZINC000532114950 931318059 /nfs/dbraw/zinc/31/80/59/931318059.db2.gz LODDSLWKPAACBF-GOSISDBHSA-N 0 3 407.308 4.146 20 0 HIADHN CC(C)NS(=O)(=O)Cc1ccccc1CN[C@H](C)c1cc2c(s1)CCCC2 ZINC000532213871 931355047 /nfs/dbraw/zinc/35/50/47/931355047.db2.gz MCPQIYAJTYBZRK-MRXNPFEDSA-N 0 3 406.617 4.306 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(S(C)(=O)=O)cc1)c1ccc(NC(=O)c2ccncc2)cc1 ZINC000532229191 931363347 /nfs/dbraw/zinc/36/33/47/931363347.db2.gz XRDHXCFOYRPUIF-SJORKVTESA-N 0 3 423.538 4.149 20 0 HIADHN Cc1nn(C)c(OCC(F)(F)F)c1CNCCc1nc2cc(Cl)ccc2s1 ZINC000532289481 931385914 /nfs/dbraw/zinc/38/59/14/931385914.db2.gz SZZOXKPZJNRATB-UHFFFAOYSA-N 0 3 418.872 4.265 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NCc2nnc3c(Cl)cc(C(F)(F)F)cn23)C1 ZINC000532296302 931389679 /nfs/dbraw/zinc/38/96/79/931389679.db2.gz VBXRIZXPPPVENT-XJKSGUPXSA-N 0 3 423.870 4.327 20 0 HIADHN CC(C)(C)[C@@H](NC(=O)[C@@H]1CCCN(Cc2cccnc2)C1)c1ccc(F)cc1F ZINC000532339118 931400458 /nfs/dbraw/zinc/40/04/58/931400458.db2.gz JHNSDMJFBJTNKV-UTKZUKDTSA-N 0 3 401.501 4.475 20 0 HIADHN CN(C(=O)Nc1cccc(CC(=O)OC(C)(C)C)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000532391189 931419895 /nfs/dbraw/zinc/41/98/95/931419895.db2.gz MWJWEYIIKPIANQ-JOCHJYFZSA-N 0 3 423.557 4.309 20 0 HIADHN Cc1ccc(C(C)C)cc1OCC(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000532417840 931428414 /nfs/dbraw/zinc/42/84/14/931428414.db2.gz JTAXXWMDFZWIPJ-UHFFFAOYSA-N 0 3 410.558 4.340 20 0 HIADHN Fc1cccc(Cl)c1[C@H](CNCc1cnn(CC(F)(F)F)c1)N1CCCC1 ZINC000532422370 931429814 /nfs/dbraw/zinc/42/98/14/931429814.db2.gz NBQUSHYSGSOLME-INIZCTEOSA-N 0 3 404.839 4.165 20 0 HIADHN COc1ccc([C@@H](CN[C@H](C)c2ccccc2Cl)N2CCOCC2)cc1OC ZINC000532441783 931435609 /nfs/dbraw/zinc/43/56/09/931435609.db2.gz QJUBRJHJRVXAQS-OXQOHEQNSA-N 0 3 404.938 4.081 20 0 HIADHN O=C1CCCN1Cc1ccccc1CN[C@H]1CCc2ccc(OC(F)(F)F)cc21 ZINC000532449940 931439497 /nfs/dbraw/zinc/43/94/97/931439497.db2.gz IKZHNEBEPBGZAU-FQEVSTJZSA-N 0 3 404.432 4.485 20 0 HIADHN CC(C)NS(=O)(=O)Cc1ccc(CN[C@@H](C)c2ccc(C(F)(F)F)cc2)cc1 ZINC000532468084 931448680 /nfs/dbraw/zinc/44/86/80/931448680.db2.gz ZXXDVIJBUXEQTF-HNNXBMFYSA-N 0 3 414.493 4.384 20 0 HIADHN CC(=O)N1CCN(c2ccccc2CN[C@H](C)c2cccc(OC(F)(F)F)c2)CC1 ZINC000532488077 931458399 /nfs/dbraw/zinc/45/83/99/931458399.db2.gz MEEXXHWQKCHBMX-MRXNPFEDSA-N 0 3 421.463 4.105 20 0 HIADHN Cc1cc(NC(=O)c2cnc(C3CC3)s2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000532513988 931469328 /nfs/dbraw/zinc/46/93/28/931469328.db2.gz MANYLGBTYDJIRQ-GOSISDBHSA-N 0 3 407.543 4.225 20 0 HIADHN COCCOc1ccc(C(F)(F)F)cc1NC(=O)[C@H](C)N(C)CC1CCCC1 ZINC000532512542 931469462 /nfs/dbraw/zinc/46/94/62/931469462.db2.gz DJKHMOZDHNFEFR-AWEZNQCLSA-N 0 3 402.457 4.180 20 0 HIADHN CCN1CCCN([C@H](C(=O)Nc2ccc(OC)c(Cl)c2)c2ccccc2)CC1 ZINC000532520706 931472590 /nfs/dbraw/zinc/47/25/90/931472590.db2.gz IADQFYHQLKVDRA-NRFANRHFSA-N 0 3 401.938 4.056 20 0 HIADHN CCN1CCCN(CC(=O)Nc2cc(Cl)ccc2Oc2ccc(C)cc2)CC1 ZINC000532521400 931473287 /nfs/dbraw/zinc/47/32/87/931473287.db2.gz BTKNHHAOYIUCBS-UHFFFAOYSA-N 0 3 401.938 4.407 20 0 HIADHN COc1ccccc1C[C@@H](C)N[C@H](c1ccccc1)c1cccc(S(C)(=O)=O)c1 ZINC000532537622 931515403 /nfs/dbraw/zinc/51/54/03/931515403.db2.gz LBJSHVPVTRBEOO-HOYKHHGWSA-N 0 3 409.551 4.409 20 0 HIADHN O=C(CCN1CCCN(C(=O)CC2CCCC2)CC1)Nc1cccc2ccccc21 ZINC000532555536 931521321 /nfs/dbraw/zinc/52/13/21/931521321.db2.gz ULWNSKUEIOTATI-UHFFFAOYSA-N 0 3 407.558 4.283 20 0 HIADHN C[C@H](O)CN(CC(=O)Nc1ccc(Br)cc1Cl)C1CCCCC1 ZINC000532556831 931522408 /nfs/dbraw/zinc/52/24/08/931522408.db2.gz KJPRHYPEXDHNOR-LBPRGKRZSA-N 0 3 403.748 4.057 20 0 HIADHN COc1ccc(Cl)cc1C[C@@H]1CCCN(CCc2nc3ccccc3c(=O)[nH]2)C1 ZINC000532586778 931544787 /nfs/dbraw/zinc/54/47/87/931544787.db2.gz SSCRSGZLIXEFSJ-INIZCTEOSA-N 0 3 411.933 4.495 20 0 HIADHN C[C@@H]1CC[C@H](C)N1[C@@H]1CCCN(CCS(=O)(=O)c2cc(Cl)ccc2Cl)C1 ZINC000532700254 931593141 /nfs/dbraw/zinc/59/31/41/931593141.db2.gz NKZLUYAOJVJAFH-HLLBOEOZSA-N 0 3 419.418 4.104 20 0 HIADHN O=C(CNC1(c2ccccc2)CCOCC1)N[C@H](Cc1ccccc1)c1ccccc1 ZINC000532708351 931600280 /nfs/dbraw/zinc/60/02/80/931600280.db2.gz HCAJHZKKMMIYAX-RUZDIDTESA-N 0 3 414.549 4.382 20 0 HIADHN O=C(CNC1(c2ccccc2)CCOCC1)Nc1ccc2c(c1)OC1(CCCCC1)O2 ZINC000532709925 931600709 /nfs/dbraw/zinc/60/07/09/931600709.db2.gz GTUSWXDYBIOHNV-UHFFFAOYSA-N 0 3 422.525 4.352 20 0 HIADHN CCc1ccc([C@@H](C)NC(=O)CNC2(c3ccc(Cl)cc3)CCOCC2)cc1 ZINC000532714524 931603573 /nfs/dbraw/zinc/60/35/73/931603573.db2.gz PPVHTGBVKDKANH-QGZVFWFLSA-N 0 3 400.950 4.375 20 0 HIADHN OC[C@@H](CNCc1cc(O)ccc1Br)Cc1ccccc1C(F)(F)F ZINC000532880002 931677319 /nfs/dbraw/zinc/67/73/19/931677319.db2.gz FZZRLASJRSDWJI-GFCCVEGCSA-N 0 3 418.253 4.114 20 0 HIADHN Cc1ccc(COc2ccc(CNc3cc(C(N)=O)ccc3CN(C)C)cc2)cc1 ZINC000532895633 931683114 /nfs/dbraw/zinc/68/31/14/931683114.db2.gz VSHOYBKYNXKIAE-UHFFFAOYSA-N 0 3 403.526 4.347 20 0 HIADHN CN(C)Cc1ccc(C(N)=O)cc1NCc1ccc(-c2nc3ccccc3s2)o1 ZINC000532895842 931683235 /nfs/dbraw/zinc/68/32/35/931683235.db2.gz LCHLNCAICJZDRL-UHFFFAOYSA-N 0 3 406.511 4.329 20 0 HIADHN CCCN1CCN(c2ccccc2CNc2ccc(CN(C(C)=O)C3CC3)cc2)CC1 ZINC000532898428 931684432 /nfs/dbraw/zinc/68/44/32/931684432.db2.gz SJEMGHPBELFKNR-UHFFFAOYSA-N 0 3 420.601 4.342 20 0 HIADHN Cc1cc(NC(=O)c2ccc(N(C)C)c(F)c2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000532939306 931704507 /nfs/dbraw/zinc/70/45/07/931704507.db2.gz PIHCWLKBFZGZAK-FQEVSTJZSA-N 0 3 421.520 4.096 20 0 HIADHN COc1ccc(NC(=O)[C@@H](C)N(C)CCCc2cc(-c3cccc(F)c3)n[nH]2)cc1 ZINC000532959185 931712796 /nfs/dbraw/zinc/71/27/96/931712796.db2.gz OPSOJSJXKAEIQT-MRXNPFEDSA-N 0 3 410.493 4.116 20 0 HIADHN Cc1ccc(CN(Cc2nn3c(nc(C)cc3=O)s2)[C@H]2CCc3ccccc32)cc1 ZINC000533028326 931745644 /nfs/dbraw/zinc/74/56/44/931745644.db2.gz SGRYRCGQQJGUHB-NRFANRHFSA-N 0 3 416.550 4.458 20 0 HIADHN O=c1cc(CN[C@@H](c2ccccc2)C2CCCC2)nc2ccc(Br)cn12 ZINC000533063461 931760187 /nfs/dbraw/zinc/76/01/87/931760187.db2.gz GEXMGFKCDZZVBM-NRFANRHFSA-N 0 3 412.331 4.478 20 0 HIADHN COC(=O)CC1(NCC(=O)Nc2c(Cl)cc(Cl)cc2Cl)CCCCC1 ZINC000533068204 931761863 /nfs/dbraw/zinc/76/18/63/931761863.db2.gz BXBBNQNOYQTDPP-UHFFFAOYSA-N 0 3 407.725 4.441 20 0 HIADHN O=C([C@H]1CCCN(Cc2cccnc2)C1)N1CCC[C@H](Oc2ccccc2Cl)C1 ZINC000533109537 931773058 /nfs/dbraw/zinc/77/30/58/931773058.db2.gz BEBINNPOQUXLPU-PMACEKPBSA-N 0 3 413.949 4.017 20 0 HIADHN CCc1noc(-c2ccc(CCNCc3cc(O)ccc3Br)cc2)n1 ZINC000533201639 931807665 /nfs/dbraw/zinc/80/76/65/931807665.db2.gz YPIUINCZYDLZAZ-UHFFFAOYSA-N 0 3 402.292 4.099 20 0 HIADHN COc1ccc([C@@H](CNC(=O)CN(C(C)C)C2CC2)c2c[nH]c3ccccc32)cc1 ZINC000533251197 931819091 /nfs/dbraw/zinc/81/90/91/931819091.db2.gz PTSPERGPZTYBKN-JOCHJYFZSA-N 0 3 405.542 4.297 20 0 HIADHN O=C(Nc1ccc(Sc2ccncc2)cc1)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000533262377 931822272 /nfs/dbraw/zinc/82/22/72/931822272.db2.gz UARHAXUXLMRILC-LJQANCHMSA-N 0 3 404.539 4.479 20 0 HIADHN CCN(CC(=O)N[C@H](c1nccs1)c1ccccc1)[C@H](C)Cc1ccc(OC)cc1 ZINC000533282440 931827361 /nfs/dbraw/zinc/82/73/61/931827361.db2.gz UMUWLYDTZGBYPN-JPYJTQIMSA-N 0 3 423.582 4.310 20 0 HIADHN CC1CCC(N2CCN(CC(=O)Nc3nc(-c4ccc(F)cc4)cs3)CC2)CC1 ZINC000533298798 931832200 /nfs/dbraw/zinc/83/22/00/931832200.db2.gz IYRPFHFTNHGHRL-UHFFFAOYSA-N 0 3 416.566 4.084 20 0 HIADHN CC1CCC(N2CCN(CC(=O)Nc3ccccc3Cc3ccccc3)CC2)CC1 ZINC000533298122 931832242 /nfs/dbraw/zinc/83/22/42/931832242.db2.gz GETXQBXDXSGACW-UHFFFAOYSA-N 0 3 405.586 4.412 20 0 HIADHN CC(C)(COc1ncccc1Br)NCc1cnc(-c2ccccn2)s1 ZINC000533315492 931837723 /nfs/dbraw/zinc/83/77/23/931837723.db2.gz QMGBMHPKOVATGF-UHFFFAOYSA-N 0 3 419.348 4.310 20 0 HIADHN CC(C)(CO)[C@@H](CNCc1csc(-c2ccc3c(c2)OCO3)n1)c1ccccc1 ZINC000533330587 931840510 /nfs/dbraw/zinc/84/05/10/931840510.db2.gz YIUMAXQVMVHALA-IBGZPJMESA-N 0 3 410.539 4.431 20 0 HIADHN O=C(CNC1(c2ccccc2)CCC1)N1CCC[C@H]1c1ccc2c(c1)OCCCO2 ZINC000533351718 931845818 /nfs/dbraw/zinc/84/58/18/931845818.db2.gz YSCWDBVTFQPPDQ-NRFANRHFSA-N 0 3 406.526 4.180 20 0 HIADHN Cc1cccc(NC(=O)[C@H]2CCCN(Cc3cccc(OCC(F)(F)F)c3)C2)n1 ZINC000533354673 931847337 /nfs/dbraw/zinc/84/73/37/931847337.db2.gz NBHTZFDQTWDLKQ-KRWDZBQOSA-N 0 3 407.436 4.182 20 0 HIADHN O[C@@H](COc1ccccc1)CN1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1 ZINC000533365677 931849504 /nfs/dbraw/zinc/84/95/04/931849504.db2.gz NGSPHTPDMVQAFQ-IEBWSBKVSA-N 0 3 413.905 4.009 20 0 HIADHN O[C@@H](COc1ccccc1)CN1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1 ZINC000533365679 931849625 /nfs/dbraw/zinc/84/96/25/931849625.db2.gz NGSPHTPDMVQAFQ-PKOBYXMFSA-N 0 3 413.905 4.009 20 0 HIADHN O=C(Nc1ccc(F)c(Cl)c1)C1CCN(Cc2ccc3c(c2)OCCO3)CC1 ZINC000533381961 931853920 /nfs/dbraw/zinc/85/39/20/931853920.db2.gz OQQBPKIWTWOANN-UHFFFAOYSA-N 0 3 404.869 4.101 20 0 HIADHN Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)N[C@@H]1CCCN(CC(F)(F)F)C1=O ZINC000533448985 931872418 /nfs/dbraw/zinc/87/24/18/931872418.db2.gz MDRZWUBIVNSODX-XHDPSFHLSA-N 0 3 415.456 4.462 20 0 HIADHN O=C(NC[C@@H]1CCCCN1CCCc1nc(-c2ccccc2)no1)Nc1ccccc1 ZINC000533494847 931884575 /nfs/dbraw/zinc/88/45/75/931884575.db2.gz MGAKTCIIPCSIBI-NRFANRHFSA-N 0 3 419.529 4.345 20 0 HIADHN COC(=O)c1cc(CN2CCC[C@@H](c3nc(-c4ccc(Cl)cc4)no3)C2)oc1C ZINC000533503468 931886191 /nfs/dbraw/zinc/88/61/91/931886191.db2.gz MYJPBOVGMMJYKF-OAHLLOKOSA-N 0 3 415.877 4.458 20 0 HIADHN C[C@@H]1CC[C@@H](C)[NH+]1[C@@H]1CCCN(Cc2nc(=O)c3c(-c4ccco4)csc3[n-]2)C1 ZINC000533511660 931889940 /nfs/dbraw/zinc/88/99/40/931889940.db2.gz SMFZANVZOZGGLR-BZUAXINKSA-N 0 3 412.559 4.494 20 0 HIADHN CCCN(Cc1nc(C)c2ccccc2n1)C1CCN(c2cc(C)nc(C)n2)CC1 ZINC000533518172 931891668 /nfs/dbraw/zinc/89/16/68/931891668.db2.gz WWINJEWHQNJAIO-UHFFFAOYSA-N 0 3 404.562 4.226 20 0 HIADHN CC(C)[C@@H](CNC(=O)CNC1(c2ccc(Cl)cc2)CCOCC1)c1ccccc1 ZINC000533522489 931893182 /nfs/dbraw/zinc/89/31/82/931893182.db2.gz XHORUNDDQIQRDV-JOCHJYFZSA-N 0 3 414.977 4.491 20 0 HIADHN CS(=O)(=O)c1ccc(Cl)c(NC(=O)CN[C@@H](c2ccccc2)C2CCCC2)c1 ZINC000533521366 931893239 /nfs/dbraw/zinc/89/32/39/931893239.db2.gz BYHJEZBRMPRJCX-NRFANRHFSA-N 0 3 420.962 4.203 20 0 HIADHN C/C=C/c1ccc(OC[C@H](O)CN2CCC(Nc3cccc(C)c3)CC2)c(OC)c1 ZINC000533530303 931895588 /nfs/dbraw/zinc/89/55/88/931895588.db2.gz KZRWXPLPUAQDNH-FIYNHDKVSA-N 0 3 410.558 4.353 20 0 HIADHN CSc1ccccc1NC(=O)CN(C)C(=O)CN[C@H](c1ccccc1)C(C)(C)C ZINC000533641637 931940374 /nfs/dbraw/zinc/94/03/74/931940374.db2.gz AYGSRGPWQSDLAU-JOCHJYFZSA-N 0 3 413.587 4.182 20 0 HIADHN COc1ccc(C(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)cc1-c1ccccn1 ZINC000533643010 931941286 /nfs/dbraw/zinc/94/12/86/931941286.db2.gz GXVCYNNZBCXIEO-NQIIRXRSSA-N 0 3 401.510 4.323 20 0 HIADHN COc1ccc(C(=O)N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)cc1-c1ccccn1 ZINC000533650425 931946952 /nfs/dbraw/zinc/94/69/52/931946952.db2.gz WZSCICKKTBEEME-WIYYLYMNSA-N 0 3 401.510 4.150 20 0 HIADHN C[C@H](NC(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1)[C@H]1COc2ccccc21 ZINC000533657595 931951550 /nfs/dbraw/zinc/95/15/50/931951550.db2.gz ANJLWJICCBKWSL-NBCNXNJRSA-N 0 3 418.459 4.122 20 0 HIADHN Cc1cnccc1CCNC(=O)N(CCN(C)Cc1ccccc1)Cc1ccccc1 ZINC000533659688 931953230 /nfs/dbraw/zinc/95/32/30/931953230.db2.gz LBCOANXFAMUAPU-UHFFFAOYSA-N 0 3 416.569 4.276 20 0 HIADHN O=C(CN1CC[C@H](C2CCOCC2)C1)NCCC(c1ccccc1)c1ccccc1 ZINC000533670249 931960865 /nfs/dbraw/zinc/96/08/65/931960865.db2.gz KPKKMGWLWNRSSJ-DEOSSOPVSA-N 0 3 406.570 4.073 20 0 HIADHN Cc1cc(C)c(CC(C(=O)Nc2ccc3c(c2)OCC(=O)N3)C(F)(F)F)c(C)c1 ZINC000533679118 931965957 /nfs/dbraw/zinc/96/59/57/931965957.db2.gz FFCABCYZQFOHOH-INIZCTEOSA-N 0 3 406.404 4.302 20 0 HIADHN C[C@H](CC(=O)Nc1cccc(N2CCCC2)c1)NCc1cnc([C@H]2CCCO2)s1 ZINC000533753828 932010302 /nfs/dbraw/zinc/01/03/02/932010302.db2.gz CPCHRFZNXZZQSN-OXQOHEQNSA-N 0 3 414.575 4.102 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)N1CCC[C@H]1Cn1cnc2ccccc21 ZINC000533767211 932021586 /nfs/dbraw/zinc/02/15/86/932021586.db2.gz OHOIOXWSNOAJAZ-RXVVDRJESA-N 0 3 423.586 4.109 20 0 HIADHN CN1CC[C@H](NC(=O)N2CCC(Oc3ccccc3Cl)CC2)[C@H]1c1ccccc1 ZINC000533983673 932159015 /nfs/dbraw/zinc/15/90/15/932159015.db2.gz HDEKRAZYCFHTFF-RBBKRZOGSA-N 0 3 413.949 4.338 20 0 HIADHN COc1ccccc1COc1cccc(NC(=O)[C@H]2CCCN2C2CCOCC2)c1C ZINC000534011337 932193434 /nfs/dbraw/zinc/19/34/34/932193434.db2.gz PBEAVHSNBALRNT-JOCHJYFZSA-N 0 3 424.541 4.165 20 0 HIADHN Cc1nc(C)n(-c2ccccc2NC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)n1 ZINC000534015632 932197028 /nfs/dbraw/zinc/19/70/28/932197028.db2.gz TYPFGLSWYSVZQM-SFHVURJKSA-N 0 3 418.545 4.012 20 0 HIADHN CN1CC[C@H](NC(=O)CCCc2nc(-c3ccc(Cl)cc3)no2)[C@H]1c1ccccc1 ZINC000534018153 932199339 /nfs/dbraw/zinc/19/93/39/932199339.db2.gz AZHGJKHNISDHMU-SIKLNZKXSA-N 0 3 424.932 4.274 20 0 HIADHN CC[C@@H](C)n1ncc(C(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)c1C1CC1 ZINC000534112838 932285674 /nfs/dbraw/zinc/28/56/74/932285674.db2.gz AHLMFRKYYJLFSE-QRVBRYPASA-N 0 3 416.610 4.083 20 0 HIADHN Cc1ccc(Br)c(NC(=O)CCCN2CCN(c3ccccc3)CC2)c1 ZINC000534159823 932308264 /nfs/dbraw/zinc/30/82/64/932308264.db2.gz ASAYEBNPEFXOSA-UHFFFAOYSA-N 0 3 416.363 4.298 20 0 HIADHN CCN(C(=O)c1ccc(OCC(F)F)nc1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000534175125 932316313 /nfs/dbraw/zinc/31/63/13/932316313.db2.gz DDWGKUXSWZCUBS-VQIMIIECSA-N 0 3 403.473 4.023 20 0 HIADHN CN(C)CCN(Cc1cccc(O)c1)C(=O)[C@H]1C[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000534190410 932322690 /nfs/dbraw/zinc/32/26/90/932322690.db2.gz DPJUCOPCSPTJBY-PMACEKPBSA-N 0 3 406.448 4.105 20 0 HIADHN CC[C@H](C)n1ncc(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2)c1C1CC1 ZINC000534253861 932366800 /nfs/dbraw/zinc/36/68/00/932366800.db2.gz LEPDJKMEESZKLZ-INIZCTEOSA-N 0 3 401.530 4.466 20 0 HIADHN Cc1cc(-c2ccccc2)ccc1NC(=O)N1CC[C@@H](N2CCN(C)CC2)[C@H](C)C1 ZINC000534266142 932372470 /nfs/dbraw/zinc/37/24/70/932372470.db2.gz JZZVMQZMMVDZLH-HYBUGGRVSA-N 0 3 406.574 4.152 20 0 HIADHN Cc1cnc(CCN(C)C[C@@H](O)CO[C@@H](c2ccccc2)c2ccccc2C)s1 ZINC000534379835 932407458 /nfs/dbraw/zinc/40/74/58/932407458.db2.gz YXENZILFTWBECZ-QPPBQGQZSA-N 0 3 410.583 4.401 20 0 HIADHN CC(C)[C@H](C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1)c1ccc(F)cc1 ZINC000534397419 932422670 /nfs/dbraw/zinc/42/26/70/932422670.db2.gz WWBATFVSUOXWKA-QHCPKHFHSA-N 0 3 416.512 4.364 20 0 HIADHN COc1cccc(-c2nc(C)c(C(=O)N3CC[C@@H](C)N(Cc4ccccc4)CC3)[nH]2)c1 ZINC000534424311 932442254 /nfs/dbraw/zinc/44/22/54/932442254.db2.gz SGHUGHRJFPLIIV-GOSISDBHSA-N 0 3 418.541 4.130 20 0 HIADHN Cc1nn(C(C)(C)C)c(C)c1CNCCC(=O)Nc1cc(Br)ccc1C ZINC000534453315 932468920 /nfs/dbraw/zinc/46/89/20/932468920.db2.gz HNABWTBQHVCEMQ-UHFFFAOYSA-N 0 3 421.383 4.444 20 0 HIADHN CC[C@@H](NCc1nc2cc(Cl)ccc2n1C)[C@@H](c1ccc(C)cc1)n1cncn1 ZINC000534453875 932469398 /nfs/dbraw/zinc/46/93/98/932469398.db2.gz UKVUQMBQCSNAOA-XMSQKQJNSA-N 0 3 408.937 4.284 20 0 HIADHN Cc1cc(C)c(CC(C(=O)Nc2ccc(S(C)(=O)=O)cc2)C(F)(F)F)c(C)c1 ZINC000534457270 932474210 /nfs/dbraw/zinc/47/42/10/932474210.db2.gz KERIOODVYDXYQW-SFHVURJKSA-N 0 3 413.461 4.375 20 0 HIADHN Cc1cc(C)c(CC(C(=O)Nc2cc(-c3nccn3C)[nH]n2)C(F)(F)F)c(C)c1 ZINC000534494084 932529415 /nfs/dbraw/zinc/52/94/15/932529415.db2.gz VGYIJWIORBGKQH-HNNXBMFYSA-N 0 3 405.424 4.095 20 0 HIADHN CN(C)[C@H](CNC(=O)Nc1ncc(Cc2cccc(F)c2)s1)Cc1ccccc1 ZINC000534521151 932543318 /nfs/dbraw/zinc/54/33/18/932543318.db2.gz SYTJSPKPGNQFPF-IBGZPJMESA-N 0 3 412.534 4.167 20 0 HIADHN CN(C)[C@H](CNC(=O)Cc1csc(-c2ccc(Cl)cc2)n1)Cc1ccccc1 ZINC000534521976 932544471 /nfs/dbraw/zinc/54/44/71/932544471.db2.gz XAJADKYTYAOLTJ-FQEVSTJZSA-N 0 3 413.974 4.295 20 0 HIADHN Cc1cc(NC(=O)NC[C@@H](Cc2ccccc2)N(C)C)ccc1OCC(F)(F)F ZINC000534526981 932545532 /nfs/dbraw/zinc/54/55/32/932545532.db2.gz RAHPMWDNNWFAOL-GOSISDBHSA-N 0 3 409.452 4.231 20 0 HIADHN CC[C@@H](NC(=O)Nc1ccc(CCN2CCSCC2)cc1)c1c(C)noc1C ZINC000534569819 932572616 /nfs/dbraw/zinc/57/26/16/932572616.db2.gz SXGVDGDFWRGFEC-LJQANCHMSA-N 0 3 402.564 4.156 20 0 HIADHN CN(Cc1ccc(Br)s1)C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000534681645 932651490 /nfs/dbraw/zinc/65/14/90/932651490.db2.gz KBPKANCOFULHGF-NVXWUHKLSA-N 0 3 408.365 4.097 20 0 HIADHN Cc1ccc(C[C@H](NC(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)c2ccccn2)cc1 ZINC000534684691 932655263 /nfs/dbraw/zinc/65/52/63/932655263.db2.gz GERQXNYJFGRQDV-DSITVLBTSA-N 0 3 414.553 4.418 20 0 HIADHN Cc1ccc(C[C@H](NC(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)c2ccccn2)cc1 ZINC000534684690 932655553 /nfs/dbraw/zinc/65/55/53/932655553.db2.gz GERQXNYJFGRQDV-CCDWMCETSA-N 0 3 414.553 4.418 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)c2c(C)cccc2I)c1 ZINC000534703048 932673109 /nfs/dbraw/zinc/67/31/09/932673109.db2.gz VVYKCXKDKFRDMP-UHFFFAOYSA-N 0 3 408.283 4.222 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)c2ccc(S(=O)(=O)C3CCCC3)cc2)c1 ZINC000534702307 932673447 /nfs/dbraw/zinc/67/34/47/932673447.db2.gz PDGFSMUFPZHKHB-UHFFFAOYSA-N 0 3 400.544 4.025 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)c2cccc(F)c2I)c1 ZINC000534704743 932675386 /nfs/dbraw/zinc/67/53/86/932675386.db2.gz IYGALBAEJBLVJV-UHFFFAOYSA-N 0 3 412.246 4.053 20 0 HIADHN CN(C(=O)[C@H](OC1CCOCC1)c1ccccc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000534774597 932754497 /nfs/dbraw/zinc/75/44/97/932754497.db2.gz BCDGSRLCWHTEGP-ILBGXUMGSA-N 0 3 422.569 4.046 20 0 HIADHN CCOc1ccc(F)c(NC(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)c1F ZINC000534781284 932762199 /nfs/dbraw/zinc/76/21/99/932762199.db2.gz UJYBMCLWKDPUJS-QGZVFWFLSA-N 0 3 403.473 4.492 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)c1cnc(-c2cccnc2)s1 ZINC000534906043 932832465 /nfs/dbraw/zinc/83/24/65/932832465.db2.gz JPPASGXZZZOIQX-UHFFFAOYSA-N 0 3 400.935 4.063 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)[C@H](C)Cc1ccc(Br)cc1 ZINC000535023985 932887349 /nfs/dbraw/zinc/88/73/49/932887349.db2.gz NUCIHKFCSICRDU-CQSZACIVSA-N 0 3 405.336 4.337 20 0 HIADHN CCOc1c(Br)cc(CN(Cc2ccccc2)C[C@H](C)O)cc1OC ZINC000535079683 932899042 /nfs/dbraw/zinc/89/90/42/932899042.db2.gz CIDXDVPQJNNADC-HNNXBMFYSA-N 0 3 408.336 4.239 20 0 HIADHN O=C(CN1CC[C@H](C2CCOCC2)C1)Nc1ccc(N2CCc3ccccc32)cc1 ZINC000535115769 932933003 /nfs/dbraw/zinc/93/30/03/932933003.db2.gz GLRZGXSVBMSJDA-NRFANRHFSA-N 0 3 405.542 4.068 20 0 HIADHN CCc1ccccc1N(C(C)=O)c1nc(CN2CCN(C3CCCC3)CC2)cs1 ZINC000535223760 933027757 /nfs/dbraw/zinc/02/77/57/933027757.db2.gz ASDFRJRFPYFEKF-UHFFFAOYSA-N 0 3 412.603 4.450 20 0 HIADHN COc1ccc2oc([C@H](C)NC(=O)NC[C@H](Cc3ccccc3)N(C)C)c(C)c2c1 ZINC000535261607 933040334 /nfs/dbraw/zinc/04/03/34/933040334.db2.gz KECXSYNCDVYZBE-HKUYNNGSSA-N 0 3 409.530 4.283 20 0 HIADHN Cc1nc(C(C)C)sc1[C@H](C)N(C)C(=O)NC[C@H](Cc1ccccc1)N(C)C ZINC000535266574 933042218 /nfs/dbraw/zinc/04/22/18/933042218.db2.gz XACAMUFQBDBCEY-HKUYNNGSSA-N 0 3 402.608 4.450 20 0 HIADHN CN(C)Cc1cccc(C(=O)NCCCOc2ncc(C(F)(F)F)cc2Cl)c1 ZINC000535306096 933062921 /nfs/dbraw/zinc/06/29/21/933062921.db2.gz ACNLFTMQOSVJBH-UHFFFAOYSA-N 0 3 415.843 4.014 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Nc1cccc2c1CN(c1ccccn1)C2 ZINC000535328068 933075463 /nfs/dbraw/zinc/07/54/63/933075463.db2.gz REDURLTUPHHROF-UHFFFAOYSA-N 0 3 421.570 4.259 20 0 HIADHN COCCOc1cc(C(=O)N(CCN2CCCC2)c2ccccc2)nc2ccccc21 ZINC000535395684 933113975 /nfs/dbraw/zinc/11/39/75/933113975.db2.gz GRHUSUNRUZZTNL-UHFFFAOYSA-N 0 3 419.525 4.003 20 0 HIADHN CN1CC[C@@H](NC(=O)N(CCc2ccccc2)Cc2ccncc2)[C@@H]1c1ccccc1 ZINC000535436665 933134332 /nfs/dbraw/zinc/13/43/32/933134332.db2.gz NXGJKZWQNBVUBM-RPBOFIJWSA-N 0 3 414.553 4.281 20 0 HIADHN CC(C)(C)CCN1CCN(C(=O)Nc2cccc3c2CN(c2nccs2)C3)CC1 ZINC000535476723 933168932 /nfs/dbraw/zinc/16/89/32/933168932.db2.gz RQFMJCYABSSNPV-UHFFFAOYSA-N 0 3 413.591 4.249 20 0 HIADHN Cc1cc(NC(=O)C2CCC(F)(F)CC2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000535500145 933187595 /nfs/dbraw/zinc/18/75/95/933187595.db2.gz UIQLYXXWUIBHID-LJQANCHMSA-N 0 3 402.489 4.403 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)c2cc(N3CCCC3=O)ccc2Cl)C1 ZINC000535527086 933216639 /nfs/dbraw/zinc/21/66/39/933216639.db2.gz ADOABOYEFDMYQZ-SJLPKXTDSA-N 0 3 411.933 4.032 20 0 HIADHN COc1cc(CN(C)Cc2ccc(C(C)(C)C)cc2)cc(Cl)c1OCC(N)=O ZINC000535775928 933384054 /nfs/dbraw/zinc/38/40/54/933384054.db2.gz SBJGITVKXXLUEH-UHFFFAOYSA-N 0 3 404.938 4.142 20 0 HIADHN CCNC(=O)COc1ccc(CN(Cc2ccc(Cl)cc2)C2CC2)cc1OC ZINC000535782575 933385354 /nfs/dbraw/zinc/38/53/54/933385354.db2.gz QWCGPIJOMDRTSG-UHFFFAOYSA-N 0 3 402.922 4.028 20 0 HIADHN CO[C@H](C)c1noc(CN2CCCN(Cc3cccc(-c4ccccc4)c3)CC2)n1 ZINC000535802227 933398453 /nfs/dbraw/zinc/39/84/53/933398453.db2.gz RWPHQMLDGLEFCP-LJQANCHMSA-N 0 3 406.530 4.152 20 0 HIADHN COc1ccc(C(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)cc1-c1ccccn1 ZINC000535852635 933435987 /nfs/dbraw/zinc/43/59/87/933435987.db2.gz KLJLJOXWBQAXMC-QFIPXVFZSA-N 0 3 415.537 4.494 20 0 HIADHN C[C@H](NCC1=Cc2cc(Br)ccc2OC1)c1ccc([S@](C)=O)cc1 ZINC000535946634 933512412 /nfs/dbraw/zinc/51/24/12/933512412.db2.gz RFKREYNTLJVUGV-RZFZLAGVSA-N 0 3 406.345 4.313 20 0 HIADHN COc1cc(CN[C@H](C)c2ccc([S@](C)=O)cc2)ccc1OCc1ccncc1 ZINC000535946844 933513534 /nfs/dbraw/zinc/51/35/34/933513534.db2.gz XSGQGBQHNDHVPH-JWRCQZCYSA-N 0 3 410.539 4.257 20 0 HIADHN Cc1nc(-c2ccc(C)cc2)c(CC(=O)NC[C@H](Cc2ccccc2)N(C)C)s1 ZINC000536013639 933570995 /nfs/dbraw/zinc/57/09/95/933570995.db2.gz DIRCDZDBQNRTMV-NRFANRHFSA-N 0 3 407.583 4.259 20 0 HIADHN Cc1cc(Sc2ncccn2)ccc1NC(=O)NC[C@@H](Cc1ccccc1)N(C)C ZINC000536019226 933574661 /nfs/dbraw/zinc/57/46/61/933574661.db2.gz UTKUHEBUOAOANY-LJQANCHMSA-N 0 3 421.570 4.231 20 0 HIADHN C[C@@H](CNC(=O)c1ccc(C(=O)N(C)c2ccccc2)cc1)N(C)Cc1ccccc1 ZINC000536051583 933596927 /nfs/dbraw/zinc/59/69/27/933596927.db2.gz HAEXUEJCOBSWST-FQEVSTJZSA-N 0 3 415.537 4.214 20 0 HIADHN CN1CCN(c2cccc(Cl)c2CNCc2ccc(-c3ccncc3)cc2)CC1 ZINC000536137341 933681841 /nfs/dbraw/zinc/68/18/41/933681841.db2.gz QLSRONPMGIDDHW-UHFFFAOYSA-N 0 3 406.961 4.444 20 0 HIADHN C[C@@H](NCc1ccc([C@@]2(C)NC(=O)NC2=O)cc1)c1cc2c(ccc3ccccc23)o1 ZINC000537293359 933701040 /nfs/dbraw/zinc/70/10/40/933701040.db2.gz ODJSTPXBBPPVQI-SGANQWHYSA-N 0 3 413.477 4.491 20 0 HIADHN CC[C@H](NCc1cccc(OCC(=O)OC)c1)c1cc(F)cc(Br)c1 ZINC000537306463 933708079 /nfs/dbraw/zinc/70/80/79/933708079.db2.gz FSXRKWXRTRPBON-SFHVURJKSA-N 0 3 410.283 4.381 20 0 HIADHN COc1sc(CN[C@@H](C)[C@H](OC)c2ccc(OC)cc2)cc1Br ZINC000537344822 933728013 /nfs/dbraw/zinc/72/80/13/933728013.db2.gz SHMRWUQEXTZGTE-ZBEGNZNMSA-N 0 3 400.338 4.394 20 0 HIADHN C[C@H](N[C@@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O)c1ccc2c(c1)OCO2 ZINC000537346646 933728851 /nfs/dbraw/zinc/72/88/51/933728851.db2.gz BYVDQLDLIQFVQO-KBXCAEBGSA-N 0 3 420.431 4.276 20 0 HIADHN Cc1cc(C(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)nn1[C@@H](C)C1CC1 ZINC000537420257 933768624 /nfs/dbraw/zinc/76/86/24/933768624.db2.gz LLGRUAZBWJZKBP-INIZCTEOSA-N 0 3 422.495 4.385 20 0 HIADHN Clc1cccc([C@@H](CNCc2conc2Cc2ccccc2)N2CCOCC2)c1 ZINC000562768590 945118506 /nfs/dbraw/zinc/11/85/06/945118506.db2.gz YGMVZVAEORYQHK-HSZRJFAPSA-N 0 3 411.933 4.082 20 0 HIADHN COc1cc(CNCc2cccc(N3CCOCC3)c2)ccc1OCc1cccs1 ZINC000562769318 945118758 /nfs/dbraw/zinc/11/87/58/945118758.db2.gz MUBJIXQTEBBQER-UHFFFAOYSA-N 0 3 424.566 4.462 20 0 HIADHN Cn1c2ccccc2nc1[C@@H](NC1CCN(Cc2ccccn2)CC1)c1ccccc1 ZINC000562920678 945153200 /nfs/dbraw/zinc/15/32/00/945153200.db2.gz IAXINIZVIUAJMM-VWLOTQADSA-N 0 3 411.553 4.312 20 0 HIADHN CNC(=O)COc1cccc(CN[C@H]2CCc3c2cc(Cl)cc3Br)c1 ZINC000563269721 945165597 /nfs/dbraw/zinc/16/55/97/945165597.db2.gz UGAPTNPPKRYQTF-SFHVURJKSA-N 0 3 423.738 4.004 20 0 HIADHN CCc1nsc(N2CCCN(Cc3ccc(-c4ccccc4OC)cc3)CC2)n1 ZINC000537622457 938337145 /nfs/dbraw/zinc/33/71/45/938337145.db2.gz XUCMKYPFIAFLSN-UHFFFAOYSA-N 0 3 408.571 4.488 20 0 HIADHN COC(=O)[C@H]1CC12CCN(Cc1cn(-c3ccccc3)nc1-c1cccs1)CC2 ZINC000537625049 938337767 /nfs/dbraw/zinc/33/77/67/938337767.db2.gz HGXKDPJKXYHAQC-LJQANCHMSA-N 0 3 407.539 4.376 20 0 HIADHN COc1ccc(CN2CCC[C@@H](c3nc4ccc(F)cc4o3)C2)c(OC)c1OC ZINC000537698906 938358381 /nfs/dbraw/zinc/35/83/81/938358381.db2.gz YHOLMXRLTHPCHU-OAHLLOKOSA-N 0 3 400.450 4.372 20 0 HIADHN COc1cc(CN2CCCCC[C@H]2/C=C\c2ccccc2)cc(OC)c1OCC(N)=O ZINC000537709824 938361449 /nfs/dbraw/zinc/36/14/49/938361449.db2.gz JQNUNDGCIBCHSI-SQZREULQSA-N 0 3 424.541 4.026 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@@H](C)Oc2ccc(SC)cc2)cc1 ZINC000537728227 938364089 /nfs/dbraw/zinc/36/40/89/938364089.db2.gz JCIDLGVEKQUQHT-VGOFRKELSA-N 0 3 414.571 4.138 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)CCc2nc3ccccc3s2)cc1 ZINC000537728185 938364101 /nfs/dbraw/zinc/36/41/01/938364101.db2.gz COVCKTSTZPARNA-HXUWFJFHSA-N 0 3 409.555 4.191 20 0 HIADHN CN(C)Cc1ccc(-c2noc(Cc3cccc(OCc4cccnc4)c3)n2)cc1 ZINC000537754927 938370145 /nfs/dbraw/zinc/37/01/45/938370145.db2.gz BQNGUTIXBNOUKY-UHFFFAOYSA-N 0 3 400.482 4.363 20 0 HIADHN COCCn1ccc2ccc(NC(=O)NC[C@@H](c3cccs3)N3CCCC3)cc21 ZINC000537799552 938379117 /nfs/dbraw/zinc/37/91/17/938379117.db2.gz ACJSEZMRCYMEAS-FQEVSTJZSA-N 0 3 412.559 4.308 20 0 HIADHN COc1cc(CN[C@H](C)c2ccc(NS(C)(=O)=O)cc2)ccc1OC1CCCC1 ZINC000537918287 938412745 /nfs/dbraw/zinc/41/27/45/938412745.db2.gz JLNOOGIKPHCNCA-MRXNPFEDSA-N 0 3 418.559 4.239 20 0 HIADHN CCC[C@@H](NCc1ccccc1CS(=O)(=O)N1CCCC1)c1ccc(OC)cc1 ZINC000537941862 938425329 /nfs/dbraw/zinc/42/53/29/938425329.db2.gz GQRBEJBWCTVNSS-HSZRJFAPSA-N 0 3 416.587 4.252 20 0 HIADHN C[C@@H](NCc1ccccc1CS(=O)(=O)N1CCCC1)c1cc2c(s1)CCCC2 ZINC000537943876 938427184 /nfs/dbraw/zinc/42/71/84/938427184.db2.gz FSOBQDNUQURULM-QGZVFWFLSA-N 0 3 418.628 4.403 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)N[C@H]2CC(=O)N(C)[C@@H]2c2ccc(F)c(F)c2)cc1 ZINC000537944456 938427271 /nfs/dbraw/zinc/42/72/71/938427271.db2.gz BGMQHFSBMRUXNR-OAJKGFPOSA-N 0 3 410.468 4.082 20 0 HIADHN C[C@H](N[C@@H](C)[C@H](OC1CCOCC1)c1ccccc1)c1ccc(S(C)(=O)=O)cc1 ZINC000537949208 938429099 /nfs/dbraw/zinc/42/90/99/938429099.db2.gz WSKAZRARSGOLKM-BSRJHKFKSA-N 0 3 417.571 4.066 20 0 HIADHN CC(C)C[C@@H](N[C@@H](C)c1ccc(NC(=O)NC(C)C)cc1)C(=O)Nc1nccs1 ZINC000537952595 938430353 /nfs/dbraw/zinc/43/03/53/938430353.db2.gz MBFKIQKYAIAQCK-MAUKXSAKSA-N 0 3 417.579 4.377 20 0 HIADHN Cc1cc([C@@H](N[C@H](C)c2cccc(N3CCCS3(=O)=O)c2)C2CC2)ccc1F ZINC000537952760 938430697 /nfs/dbraw/zinc/43/06/97/938430697.db2.gz RXYZSTOCCCNRIH-ZHRRBRCNSA-N 0 3 402.535 4.476 20 0 HIADHN CC1CCN(S(=O)(=O)Cc2ccccc2CN[C@H]2CCc3cc(F)ccc32)CC1 ZINC000537954000 938431514 /nfs/dbraw/zinc/43/15/14/938431514.db2.gz QCVXGPINAZQOCS-QHCPKHFHSA-N 0 3 416.562 4.165 20 0 HIADHN CCS(=O)(=O)Nc1ccc([C@@H](C)NCc2csc(Br)c2)cc1 ZINC000537966412 938437829 /nfs/dbraw/zinc/43/78/29/938437829.db2.gz KGSFJIKVKCXEIE-LLVKDONJSA-N 0 3 403.367 4.123 20 0 HIADHN COCCNS(=O)(=O)c1ccc(CN[C@H](C)c2ccc(-c3ccccc3)cc2)cc1 ZINC000537967240 938438834 /nfs/dbraw/zinc/43/88/34/938438834.db2.gz ZNXZWLPXZXLPTI-LJQANCHMSA-N 0 3 424.566 4.129 20 0 HIADHN O=C1[C@H](N[C@@H]2CCCc3nc(-c4ccc(F)cc4)sc32)CCN1CC(F)(F)F ZINC000537978015 938445027 /nfs/dbraw/zinc/44/50/27/938445027.db2.gz DIUODQSWBWBMHX-UKRRQHHQSA-N 0 3 413.440 4.079 20 0 HIADHN CCc1noc(-c2ccc(CCN[C@H](C)c3nnn(-c4ccc(C)cc4)c3C)cc2)n1 ZINC000537977549 938445096 /nfs/dbraw/zinc/44/50/96/938445096.db2.gz LZPZFMBQTIZSSP-QGZVFWFLSA-N 0 3 416.529 4.390 20 0 HIADHN O=C(NCCN[C@H]1CC2(CCC2)Oc2ccccc21)c1cccc(Br)c1 ZINC000537981305 938446716 /nfs/dbraw/zinc/44/67/16/938446716.db2.gz FVYGWHOFSSKJLX-SFHVURJKSA-N 0 3 415.331 4.215 20 0 HIADHN COc1ccc(CN2CC[C@@H](N[C@@H](C)c3ccc(OC)c4ccccc43)C2=O)cc1 ZINC000537983181 938448076 /nfs/dbraw/zinc/44/80/76/938448076.db2.gz BCFICYWBEUNRFG-GAJHUEQPSA-N 0 3 404.510 4.309 20 0 HIADHN C[C@@H](NCc1ccccc1OCC(=O)NC[C@@H]1CCCO1)c1ccc2ccccc2c1 ZINC000537987558 938449918 /nfs/dbraw/zinc/44/99/18/938449918.db2.gz QREGYFPYFVRMIP-DVECYGJZSA-N 0 3 418.537 4.365 20 0 HIADHN C[C@H](NCc1ccccc1OCC(=O)NC[C@H]1CCCO1)c1ccc2ccccc2c1 ZINC000537987563 938450118 /nfs/dbraw/zinc/45/01/18/938450118.db2.gz QREGYFPYFVRMIP-YADARESESA-N 0 3 418.537 4.365 20 0 HIADHN CC(C)c1ccc([C@@H](C)NCc2ccccc2OCC(=O)NC[C@@H]2CCCO2)cc1 ZINC000537988013 938450748 /nfs/dbraw/zinc/45/07/48/938450748.db2.gz TZJBYSOVJJJHFK-XXBNENTESA-N 0 3 410.558 4.335 20 0 HIADHN COc1ccc(C(=O)NCCN[C@@H](C)c2sc(Cc3ccccc3)nc2C)cc1 ZINC000537989418 938451227 /nfs/dbraw/zinc/45/12/27/938451227.db2.gz BUOBBXHHECLMKV-INIZCTEOSA-N 0 3 409.555 4.132 20 0 HIADHN C[C@H](Cc1ccccc1)n1cccc1C(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000538020542 938466175 /nfs/dbraw/zinc/46/61/75/938466175.db2.gz GWNMBFQFGZMXEL-YPAWHYETSA-N 0 3 423.601 4.253 20 0 HIADHN CCCN1c2ccc(NC(=O)NC[C@H](C)N(C)Cc3ccccc3)cc2CCC1=O ZINC000538031395 938473282 /nfs/dbraw/zinc/47/32/82/938473282.db2.gz BJLJHYCMCAGDSQ-SFHVURJKSA-N 0 3 408.546 4.018 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@@H](COC)c1ccc(F)c(F)c1)c1ccsc1 ZINC000538036869 938476845 /nfs/dbraw/zinc/47/68/45/938476845.db2.gz CDMSEBPFSPFIJZ-RBUKOAKNSA-N 0 3 411.518 4.096 20 0 HIADHN CN1CC[C@H](NC(=O)N[C@@H]2CCO[C@H]2c2ccc(Cl)c(F)c2)[C@H]1c1ccccc1 ZINC000538043131 938479396 /nfs/dbraw/zinc/47/93/96/938479396.db2.gz BGOZXQGVQMEOCQ-BQJUDKOJSA-N 0 3 417.912 4.054 20 0 HIADHN Cc1cccc([C@H](CN[C@@H](C)c2nc3ccc(Cl)cc3n2C)N2CCOCC2)c1 ZINC000538063435 938492164 /nfs/dbraw/zinc/49/21/64/938492164.db2.gz UBTIXXIDMPWKCL-JTSKRJEESA-N 0 3 412.965 4.259 20 0 HIADHN COc1cc([C@H](C)N[C@@H]2CCc3c2cccc3Br)ccc1OCCO ZINC000538099831 938501896 /nfs/dbraw/zinc/50/18/96/938501896.db2.gz CTKSKBJNCDKQRX-SCLBCKFNSA-N 0 3 406.320 4.167 20 0 HIADHN C[C@@H](NC[C@@H](c1cccc(F)c1)N1CCOCC1)c1nc2ccc(Cl)cc2n1C ZINC000538101625 938502836 /nfs/dbraw/zinc/50/28/36/938502836.db2.gz YUTKXSXNIGNNSH-VFNWGFHPSA-N 0 3 416.928 4.090 20 0 HIADHN C[C@@H](NCCOc1c(Cl)cc(Cl)cc1Cl)c1cccc(S(N)(=O)=O)c1 ZINC000538115856 938506272 /nfs/dbraw/zinc/50/62/72/938506272.db2.gz CMTGBMSRVCBHJO-SNVBAGLBSA-N 0 3 423.749 4.024 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)NCCc1ccc(F)cc1)c1ccc(OCc2cccnc2)cc1 ZINC000538123129 938509888 /nfs/dbraw/zinc/50/98/88/938509888.db2.gz FMNZCPBPURTMSK-MOPGFXCFSA-N 0 3 421.516 4.198 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(OCc2cccnc2)cc1)C(=O)N(C)Cc1ccccc1 ZINC000538124804 938511290 /nfs/dbraw/zinc/51/12/90/938511290.db2.gz NYAXQGQSZVZSII-PMACEKPBSA-N 0 3 403.526 4.358 20 0 HIADHN CC[C@@H](NCC(=O)Nc1cc(C2CC2)nn1-c1ccccc1)c1ccc(OC)cc1 ZINC000538142210 938518601 /nfs/dbraw/zinc/51/86/01/938518601.db2.gz YBOWIXPDQDJPNO-OAQYLSRUSA-N 0 3 404.514 4.438 20 0 HIADHN COc1ccc([C@H](Cc2ccccc2C)NCC(=O)N2CCC[C@@H](C)C2)cc1OC ZINC000538174898 938536242 /nfs/dbraw/zinc/53/62/42/938536242.db2.gz HRHUCNVKAIXUTG-GCJKJVERSA-N 0 3 410.558 4.144 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)N[C@@H]1CCO[C@H]1c1ccc(Cl)cc1 ZINC000538191579 938547101 /nfs/dbraw/zinc/54/71/01/938547101.db2.gz PILRWRWCQGVNJO-MOPGFXCFSA-N 0 3 407.967 4.005 20 0 HIADHN COC[C@@H](NC[C@H](CO)Cc1ccccc1C(F)(F)F)c1ccc(F)c(F)c1 ZINC000538195875 938549137 /nfs/dbraw/zinc/54/91/37/938549137.db2.gz UJOIELPHRALPPH-BFUOFWGJSA-N 0 3 403.391 4.112 20 0 HIADHN COc1cc(F)c([C@H](C)NC[C@@H](O)Cc2ccccc2C(F)(F)F)cc1OC ZINC000538198465 938550938 /nfs/dbraw/zinc/55/09/38/938550938.db2.gz SIDUUFVYGVJPIV-JSGCOSHPSA-N 0 3 401.400 4.116 20 0 HIADHN Cc1cccc(C(C)(C)NCC(=O)N2c3ccccc3NC(=O)C[C@@H]2C(F)(F)F)c1 ZINC000538215955 938559749 /nfs/dbraw/zinc/55/97/49/938559749.db2.gz WHGFIYMXPNVNOB-GOSISDBHSA-N 0 3 419.447 4.126 20 0 HIADHN Cc1cccc(C(C)(C)NCC(=O)N2c3ccccc3NC(=O)C[C@H]2C(F)(F)F)c1 ZINC000538215956 938559989 /nfs/dbraw/zinc/55/99/89/938559989.db2.gz WHGFIYMXPNVNOB-SFHVURJKSA-N 0 3 419.447 4.126 20 0 HIADHN CC(C)(NCC(=O)Nc1cccc(CN2CCSCC2)c1)c1cccc(Cl)c1 ZINC000538215732 938560007 /nfs/dbraw/zinc/56/00/07/938560007.db2.gz ZHXNISVQNDQHJR-UHFFFAOYSA-N 0 3 418.006 4.352 20 0 HIADHN CC1CCN([C@@H](CNC(=O)c2cnn(C)c2-c2ccccc2)c2cccs2)CC1 ZINC000538250903 938574143 /nfs/dbraw/zinc/57/41/43/938574143.db2.gz YIVBKPRDNSXFPT-FQEVSTJZSA-N 0 3 408.571 4.352 20 0 HIADHN CC(C)OCc1cccc(CNC(=O)CN[C@H](C)c2cccc(N3CCCC3)c2)c1 ZINC000538278384 938581967 /nfs/dbraw/zinc/58/19/67/938581967.db2.gz VNSHCRJHIJIGHT-HXUWFJFHSA-N 0 3 409.574 4.179 20 0 HIADHN C[C@@H](NCC(=O)N1CCC(Cc2ccccc2)CC1)c1cccc(N2CCCC2)c1 ZINC000538279347 938582176 /nfs/dbraw/zinc/58/21/76/938582176.db2.gz KWILYLLJKUSUAB-OAQYLSRUSA-N 0 3 405.586 4.419 20 0 HIADHN C[C@H](CCCc1ccccc1)C(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000538287819 938583472 /nfs/dbraw/zinc/58/34/72/938583472.db2.gz ROQVJVBZGNXHIH-VSKRKVRLSA-N 0 3 400.607 4.383 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2cnoc2-c2ccc(F)cc2Cl)N(C)C)cc1 ZINC000538346547 938599557 /nfs/dbraw/zinc/59/95/57/938599557.db2.gz XIACNSJRNYBWAZ-IBGZPJMESA-N 0 3 401.869 4.475 20 0 HIADHN COc1ccc([C@@H](C)N[C@H](CO)Cc2c[nH]c3ccccc23)c(Br)c1 ZINC000538395505 938610822 /nfs/dbraw/zinc/61/08/22/938610822.db2.gz FIQHBDKQGQZIDK-HIFRSBDPSA-N 0 3 403.320 4.193 20 0 HIADHN CCN1CCN(c2ccc(N[C@@H](C)c3cccc(N4CCCC4=O)c3)c(C)c2)CC1 ZINC000538508511 938638355 /nfs/dbraw/zinc/63/83/55/938638355.db2.gz PQNJDWCVGFCMEB-FQEVSTJZSA-N 0 3 406.574 4.437 20 0 HIADHN CC(C)C[C@@H]1C[C@@H](NC(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)CCO1 ZINC000538518122 938639924 /nfs/dbraw/zinc/63/99/24/938639924.db2.gz LDJYJGWRZVUCIZ-ZCNNSNEGSA-N 0 3 407.624 4.414 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)C3(c4ccc(F)cc4F)CCC3)c(C)c2)CC1 ZINC000538548986 938646443 /nfs/dbraw/zinc/64/64/43/938646443.db2.gz RIUXPFQITZCGKU-UHFFFAOYSA-N 0 3 413.512 4.476 20 0 HIADHN NC(=O)[C@@H](N[C@@H]1CC=C(c2ccc(F)cc2)CC1)c1cccc(Br)c1 ZINC000538655166 938674787 /nfs/dbraw/zinc/67/47/87/938674787.db2.gz OMWZQUTUWLWSJB-MOPGFXCFSA-N 0 3 403.295 4.340 20 0 HIADHN C[C@H](c1cn(-c2ccccc2)nn1)N1CCC[C@@H](c2nc(C3CCCCC3)n[nH]2)C1 ZINC000538664622 938678987 /nfs/dbraw/zinc/67/89/87/938678987.db2.gz SIFVJVRCSCFQBW-IEBWSBKVSA-N 0 3 405.550 4.374 20 0 HIADHN C[C@H](c1cn(-c2ccccc2)nn1)N1CCC[C@@H](c2n[nH]c(C3CCCCC3)n2)C1 ZINC000538664622 938678989 /nfs/dbraw/zinc/67/89/89/938678989.db2.gz SIFVJVRCSCFQBW-IEBWSBKVSA-N 0 3 405.550 4.374 20 0 HIADHN COCCOc1cc2c(cc1CN1CC[C@@H](CSc3ccccc3)C1)OCO2 ZINC000538721020 938690947 /nfs/dbraw/zinc/69/09/47/938690947.db2.gz KIWSTBWAWKWNLH-QGZVFWFLSA-N 0 3 401.528 4.055 20 0 HIADHN O=C(NCC(F)(F)F)C1CCN([C@H]2CCCc3ccc(Br)cc32)CC1 ZINC000538743365 938699292 /nfs/dbraw/zinc/69/92/92/938699292.db2.gz YVFRBOBTNOKCCH-INIZCTEOSA-N 0 3 419.285 4.217 20 0 HIADHN CCN(CC(F)(F)F)C(=O)[C@@H]1CCCN(Cc2cnc(-c3cccs3)s2)C1 ZINC000538752054 938702210 /nfs/dbraw/zinc/70/22/10/938702210.db2.gz FSGCDMZYSZWYPV-CYBMUJFWSA-N 0 3 417.522 4.494 20 0 HIADHN CC(C)(C)OC(=O)C1CCC(N[C@H](C(=O)N2CCCCC2)c2ccccc2)CC1 ZINC000538755022 938703115 /nfs/dbraw/zinc/70/31/15/938703115.db2.gz VAJCRAQQWYPDDP-CBNMVNINSA-N 0 3 400.563 4.230 20 0 HIADHN COCCOc1ccc(CN2CCC[C@H](c3nc4c(s3)CCCC4)C2)cc1OC ZINC000538762513 938704013 /nfs/dbraw/zinc/70/40/13/938704013.db2.gz VEBGUNCMJMPJQT-SFHVURJKSA-N 0 3 416.587 4.435 20 0 HIADHN CCOc1c(OC)cc(CN2CCC[C@@H]2Cn2c(C)nc3ccccc32)cc1OC ZINC000538762814 938704891 /nfs/dbraw/zinc/70/48/91/938704891.db2.gz LLYAOOMCYMFVNT-LJQANCHMSA-N 0 3 409.530 4.425 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)c2cccc(C(=O)OC(C)(C)C)c2)CC1 ZINC000538776338 938707584 /nfs/dbraw/zinc/70/75/84/938707584.db2.gz VCXHZGKXAFVQHP-UHFFFAOYSA-N 0 3 408.542 4.379 20 0 HIADHN COC[C@H](NC(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1)c1ccccc1 ZINC000538828498 938721294 /nfs/dbraw/zinc/72/12/94/938721294.db2.gz JDEFEGXTYBYVLU-FQEVSTJZSA-N 0 3 423.479 4.166 20 0 HIADHN Cc1ccc(NC(=O)[C@H](N[C@@H]2CCO[C@]3(CCOC3)C2)c2ccccc2)cc1Cl ZINC000538877075 938729767 /nfs/dbraw/zinc/72/97/67/938729767.db2.gz JRYLRSVTEATFRB-KJXAQDMKSA-N 0 3 414.933 4.256 20 0 HIADHN O=C([C@H]1CC12CCN(Cc1ccccc1Oc1cccnc1)CC2)N1CCCCC1 ZINC000538905582 938735100 /nfs/dbraw/zinc/73/51/00/938735100.db2.gz BGOMSMRFEWRZGQ-JOCHJYFZSA-N 0 3 405.542 4.489 20 0 HIADHN COc1ccc(COCCN[C@@H](C)c2ccc(S(=O)(=O)C3CCCC3)cc2)cc1 ZINC000539037005 938776703 /nfs/dbraw/zinc/77/67/03/938776703.db2.gz OHKMXGKJXWJERX-SFHVURJKSA-N 0 3 417.571 4.279 20 0 HIADHN C[C@H](NCc1ccccc1CS(=O)(=O)N1CCCC1)c1cccc(OC(F)F)c1 ZINC000539044739 938780339 /nfs/dbraw/zinc/78/03/39/938780339.db2.gz WWACOIQQIDVCAD-INIZCTEOSA-N 0 3 424.513 4.064 20 0 HIADHN CC[C@@H](NCc1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1)c1cccc(Cl)c1 ZINC000539044999 938780991 /nfs/dbraw/zinc/78/09/91/938780991.db2.gz XTJCUIHCJVZJKQ-TZIWHRDSSA-N 0 3 422.978 4.038 20 0 HIADHN CC(=O)N1CC[C@@H](N[C@@H](C)c2ccc(I)cc2)c2ccccc21 ZINC000539050834 938783318 /nfs/dbraw/zinc/78/33/18/938783318.db2.gz QRCOWKVGWHTBKH-SCLBCKFNSA-N 0 3 420.294 4.440 20 0 HIADHN C[C@@H](NC[C@@H](CO)Cc1ccc(OC(F)(F)F)cc1)c1nc2c(s1)CCCC2 ZINC000539059637 938787342 /nfs/dbraw/zinc/78/73/42/938787342.db2.gz CWJPYPURLZKYQY-HIFRSBDPSA-N 0 3 414.493 4.422 20 0 HIADHN O=C1c2ccccc2C(=O)N1[C@H]1CCCC[C@@H](NCc2ccn(C3CCCC3)n2)C1 ZINC000539061438 938788390 /nfs/dbraw/zinc/78/83/90/938788390.db2.gz MHIPNBNKTYOGNJ-XLIONFOSSA-N 0 3 406.530 4.085 20 0 HIADHN COc1ccc([C@@H](CN[C@H](C)c2ccc(F)cc2OC(F)F)N(C)C)cc1OC ZINC000539074432 938794665 /nfs/dbraw/zinc/79/46/65/938794665.db2.gz OWDLKRNWWLYCOU-CXAGYDPISA-N 0 3 412.452 4.398 20 0 HIADHN Cc1c([C@H](C)NCCNC(=O)c2c(F)cccc2F)cnn1-c1cc(C)ccc1C ZINC000539078596 938796625 /nfs/dbraw/zinc/79/66/25/938796625.db2.gz HVBMMKODPPJWEC-INIZCTEOSA-N 0 3 412.484 4.156 20 0 HIADHN CCc1nc2c(s1)[C@H](NCc1ccc(C(=O)N3C[C@@H](C)O[C@H](C)C3)cc1)CCC2 ZINC000539091679 938801320 /nfs/dbraw/zinc/80/13/20/938801320.db2.gz JNAYLXLIJVKXAL-GPMSIDNRSA-N 0 3 413.587 4.122 20 0 HIADHN Cc1c([C@@H](C)NCc2ccc(Cn3ccccc3=O)cc2)cnn1-c1ccc(F)cc1 ZINC000539091919 938801393 /nfs/dbraw/zinc/80/13/93/938801393.db2.gz SVIMLBAKSPSOCR-GOSISDBHSA-N 0 3 416.500 4.381 20 0 HIADHN C[C@H](NCc1ccc(S(=O)(=O)N2CCCC2)cc1)c1cc2c(s1)CCCC2 ZINC000539092706 938801579 /nfs/dbraw/zinc/80/15/79/938801579.db2.gz DFZVESQOGZGNOK-INIZCTEOSA-N 0 3 404.601 4.262 20 0 HIADHN CCNC(=O)COc1cccc(CN[C@@H]2C[C@H](C)c3c2cccc3Br)c1 ZINC000539121197 938806021 /nfs/dbraw/zinc/80/60/21/938806021.db2.gz DCDASYOYICOXIH-IFXJQAMLSA-N 0 3 417.347 4.302 20 0 HIADHN CCNC(=O)COc1cccc(CN[C@H]2C[C@H](C)c3c2cccc3Br)c1 ZINC000539121199 938806066 /nfs/dbraw/zinc/80/60/66/938806066.db2.gz DCDASYOYICOXIH-LIRRHRJNSA-N 0 3 417.347 4.302 20 0 HIADHN CCc1nn(C)cc1NC(=O)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000539133857 938808687 /nfs/dbraw/zinc/80/86/87/938808687.db2.gz YSQOHGNGSSCFEK-UHFFFAOYSA-N 0 3 424.376 4.419 20 0 HIADHN CN1CCN(c2ncccc2CN[C@@H](c2cccc(C(F)(F)F)c2)C2CC2)CC1 ZINC000539200207 938818470 /nfs/dbraw/zinc/81/84/70/938818470.db2.gz CDZPBNKVOVFRAD-HXUWFJFHSA-N 0 3 404.480 4.093 20 0 HIADHN CC(C)[C@H](NCc1ccccc1CS(=O)(=O)N1CCC(C)CC1)c1cccnc1 ZINC000539214837 938819789 /nfs/dbraw/zinc/81/97/89/938819789.db2.gz WSSVGQYLGHTCTA-QHCPKHFHSA-N 0 3 415.603 4.130 20 0 HIADHN CC(C)[C@@H](NCc1ccc(S(=O)(=O)N(C)C)cc1)c1ccc(C(F)(F)F)cc1 ZINC000539214399 938819912 /nfs/dbraw/zinc/81/99/12/938819912.db2.gz JUNXEYVFXPFRPK-LJQANCHMSA-N 0 3 414.493 4.443 20 0 HIADHN CCc1cnccc1[C@H](C)N[C@H](C)c1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000539216303 938820060 /nfs/dbraw/zinc/82/00/60/938820060.db2.gz UDNLFYBNLHTHCY-MSOLQXFVSA-N 0 3 401.576 4.230 20 0 HIADHN CC[C@@H](NCC(=O)N(C)Cc1cc(Br)cs1)c1ccc(OC)cc1 ZINC000539242475 938824530 /nfs/dbraw/zinc/82/45/30/938824530.db2.gz AIUUMWURAXEJDG-QGZVFWFLSA-N 0 3 411.365 4.219 20 0 HIADHN CC[C@H](NCCCS(=O)(=O)c1ccc(F)cc1)c1ccccc1OC(F)F ZINC000539254851 938827526 /nfs/dbraw/zinc/82/75/26/938827526.db2.gz UQPRXQDECVOUKW-KRWDZBQOSA-N 0 3 401.450 4.332 20 0 HIADHN C[C@@H](NCC(=O)N(Cc1ccccc1)[C@@H](C)C1CC1)c1ccccc1-n1cccn1 ZINC000539260020 938828817 /nfs/dbraw/zinc/82/88/17/938828817.db2.gz NVEQIQNEQCFNHP-UXHICEINSA-N 0 3 402.542 4.350 20 0 HIADHN CC[C@H](NCCn1cncn1)c1ccccc1OCc1ccccc1Br ZINC000539261195 938829134 /nfs/dbraw/zinc/82/91/34/938829134.db2.gz MHCWOEDSMIHOOY-IBGZPJMESA-N 0 3 415.335 4.361 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(OCC(F)(F)F)cc1)C(=O)N1CCc2ccccc2C1 ZINC000539264412 938829837 /nfs/dbraw/zinc/82/98/37/938829837.db2.gz DDXIZZKJINSQOO-HOTGVXAUSA-N 0 3 406.448 4.252 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)N[C@@H]1CCOc2ccccc21)c1ccc(OCC(F)(F)F)cc1 ZINC000539266163 938830155 /nfs/dbraw/zinc/83/01/55/938830155.db2.gz XMHNLNQWJNERDZ-ZRGWGRIASA-N 0 3 422.447 4.307 20 0 HIADHN CCOc1cccc([C@@H](C)NCC(=O)Nc2ccc3nc(C(F)(F)F)[nH]c3c2)c1 ZINC000539275381 938831547 /nfs/dbraw/zinc/83/15/47/938831547.db2.gz DECDDSHHDLUVEU-GFCCVEGCSA-N 0 3 406.408 4.270 20 0 HIADHN CC[C@H](N[C@@H](C)C(=O)N1CCC[C@H]1c1cccs1)c1ccc2c(c1)OCCO2 ZINC000539276857 938831724 /nfs/dbraw/zinc/83/17/24/938831724.db2.gz QTOZIXWIVMVIBV-SZMVWBNQSA-N 0 3 400.544 4.312 20 0 HIADHN C[C@@H](N[C@@H](C)c1cccc(-n2cccn2)c1)C(=O)Nc1cccc(Br)c1 ZINC000539289063 938834257 /nfs/dbraw/zinc/83/42/57/938834257.db2.gz NSMMDUWKARQIQW-LSDHHAIUSA-N 0 3 413.319 4.313 20 0 HIADHN C[C@@H](N[C@@H](C)c1cccc(-n2cccn2)c1)C(=O)Nc1ccc(OC(F)F)cc1 ZINC000539289798 938834455 /nfs/dbraw/zinc/83/44/55/938834455.db2.gz QKEJLFQNMHTKEO-LSDHHAIUSA-N 0 3 400.429 4.152 20 0 HIADHN C[C@H](NCC(=O)N(Cc1cccc(F)c1)C(C)(C)C)c1cccc(-n2cccn2)c1 ZINC000539289888 938834572 /nfs/dbraw/zinc/83/45/72/938834572.db2.gz SGCFEEGXZLJKLW-SFHVURJKSA-N 0 3 408.521 4.489 20 0 HIADHN COc1ccc(NC(=O)[C@H](C)N[C@H](C)c2ccc(NC(=O)c3ccncc3)cc2)cc1 ZINC000539299948 938836392 /nfs/dbraw/zinc/83/63/92/938836392.db2.gz OJVJYOXLPRZRHI-SJORKVTESA-N 0 3 418.497 4.020 20 0 HIADHN COc1ccc(CN(C)C(=O)CN[C@H](c2ccc(F)cc2)C2CCCC2)cc1OC ZINC000539310263 938838815 /nfs/dbraw/zinc/83/88/15/938838815.db2.gz OJIPUQRCKOHKRR-DEOSSOPVSA-N 0 3 414.521 4.322 20 0 HIADHN Cc1nn(C)c(C)c1NC(=O)CN[C@H](c1ccccc1)[C@@H]1CCCc2ccccc21 ZINC000539327582 938842298 /nfs/dbraw/zinc/84/22/98/938842298.db2.gz ZFKKAGKGOHTQBU-RCZVLFRGSA-N 0 3 402.542 4.426 20 0 HIADHN Cc1nn(C)c(C)c1NC(=O)CN[C@@H](c1ccccc1)[C@H]1CCCc2ccccc21 ZINC000539327581 938842332 /nfs/dbraw/zinc/84/23/32/938842332.db2.gz ZFKKAGKGOHTQBU-DHLKQENFSA-N 0 3 402.542 4.426 20 0 HIADHN O=C(CN[C@H](C[C@@H]1CCOC1)c1ccccc1)N[C@@H](c1nccs1)c1ccccc1 ZINC000539335361 938843797 /nfs/dbraw/zinc/84/37/97/938843797.db2.gz AZRMPEBXZQWWOK-QTGUNEKASA-N 0 3 421.566 4.106 20 0 HIADHN NC(=O)CSc1ccccc1NC(=O)CN[C@H](CC1CCCC1)c1ccccc1 ZINC000539335573 938843839 /nfs/dbraw/zinc/84/38/39/938843839.db2.gz HGWSNTJMOGASPG-HXUWFJFHSA-N 0 3 411.571 4.114 20 0 HIADHN CC[C@H](NCCOC(c1ccccc1)c1ccccc1)c1cccc(S(N)(=O)=O)c1 ZINC000539368178 938849787 /nfs/dbraw/zinc/84/97/87/938849787.db2.gz GOCOXWHWYDKAPQ-QHCPKHFHSA-N 0 3 424.566 4.181 20 0 HIADHN COc1ccc([C@H](NC(=O)CN[C@H](C)c2cccc(N3CCCC3)c2)C(C)C)cc1 ZINC000539379246 938851891 /nfs/dbraw/zinc/85/18/91/938851891.db2.gz SSIJKTZZRXWIBG-KBMIEXCESA-N 0 3 409.574 4.460 20 0 HIADHN CC(C)COc1cccc(CN2CCC(C(=O)Nc3ccc4c(c3)OCO4)CC2)c1 ZINC000539408088 938856249 /nfs/dbraw/zinc/85/62/49/938856249.db2.gz WJIVLUKESWQMNJ-UHFFFAOYSA-N 0 3 410.514 4.301 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)N[C@H]1CCO[C@@H]1c1ccc(F)c(F)c1 ZINC000539439695 938860564 /nfs/dbraw/zinc/86/05/64/938860564.db2.gz PAQZQKNMIHVBKE-AZUAARDMSA-N 0 3 400.425 4.033 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)N[C@@H]2CCCOc3cc(Cl)ccc32)CC1 ZINC000539475699 938865917 /nfs/dbraw/zinc/86/59/17/938865917.db2.gz WCYBQGASGJINQX-HXUWFJFHSA-N 0 3 417.937 4.453 20 0 HIADHN COc1ccc([C@@H](NCC(=O)N[C@H](c2nccs2)c2ccccc2)C2CC2)cc1 ZINC000539491739 938867829 /nfs/dbraw/zinc/86/78/29/938867829.db2.gz ZBFYPLPYGBQBBC-VXKWHMMOSA-N 0 3 407.539 4.098 20 0 HIADHN C[C@@H](c1cc2ccccc2o1)N(C)C(=O)CN[C@H](c1ccc2c(c1)OCCO2)C1CC1 ZINC000539493270 938868288 /nfs/dbraw/zinc/86/82/88/938868288.db2.gz QRBCSXRVXICCAF-LMKMVOKYSA-N 0 3 420.509 4.464 20 0 HIADHN CC[C@H](NCc1ccc(OCCO)c(OC)c1)c1cc(F)cc(Br)c1 ZINC000539498232 938868936 /nfs/dbraw/zinc/86/89/36/938868936.db2.gz AGBFPXZRFJUFRH-KRWDZBQOSA-N 0 3 412.299 4.209 20 0 HIADHN CCCC[C@H](NCc1ccc2c(c1)ncn2C)C(=O)Nc1cccc(N2CCCC2)c1 ZINC000539498434 938868945 /nfs/dbraw/zinc/86/89/45/938868945.db2.gz GBUJSFRECPAILI-QFIPXVFZSA-N 0 3 419.573 4.461 20 0 HIADHN COCCNS(=O)(=O)c1ccc(CN[C@@H](CC(C)(C)C)c2ccc(F)cc2)cc1 ZINC000539499110 938869234 /nfs/dbraw/zinc/86/92/34/938869234.db2.gz BMBUGMVJYUEXJX-NRFANRHFSA-N 0 3 422.566 4.018 20 0 HIADHN COc1cc(CN[C@@H](C)c2ccc(-n3ccnn3)cc2)ccc1OCC(F)(F)F ZINC000539520754 938872941 /nfs/dbraw/zinc/87/29/41/938872941.db2.gz TWNKZPZOBKPLRC-AWEZNQCLSA-N 0 3 406.408 4.068 20 0 HIADHN CCN1CCN(Cc2ccc(N[C@H](C)c3ccc(-n4cncn4)cc3Cl)cc2)CC1 ZINC000539636570 938891646 /nfs/dbraw/zinc/89/16/46/938891646.db2.gz FUVSULMMIUWZAJ-GOSISDBHSA-N 0 3 424.980 4.231 20 0 HIADHN Cc1cc(C(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)nn1-c1ccc(F)cc1 ZINC000539708138 938907662 /nfs/dbraw/zinc/90/76/62/938907662.db2.gz WSQUWNRXMWVCQT-UHFFFAOYSA-N 0 3 421.520 4.103 20 0 HIADHN COc1ccc([C@H]2CCCN2C(=O)CN[C@]2(C)CCCc3ccccc32)c(OC)c1 ZINC000539808181 938938732 /nfs/dbraw/zinc/93/87/32/938938732.db2.gz YRIKIWCIRUUSCM-RCZVLFRGSA-N 0 3 408.542 4.209 20 0 HIADHN COCCOC[C@H]1CCN(Cc2cn(C(C)(C)C)nc2-c2ccccc2Cl)C1 ZINC000539820502 938944167 /nfs/dbraw/zinc/94/41/67/938944167.db2.gz OGNOAYCVBVQODZ-KRWDZBQOSA-N 0 3 405.970 4.443 20 0 HIADHN CCc1ccc(-c2nn(Cc3ccccc3)cc2CN2CCC(OCCO)CC2)cc1 ZINC000539824924 938947034 /nfs/dbraw/zinc/94/70/34/938947034.db2.gz KRILCWIHIUNGBY-UHFFFAOYSA-N 0 3 419.569 4.134 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)c3cc4ccc(C(F)(F)F)cc4[nH]3)CC2)C[C@@H](C)O1 ZINC000539841239 938954964 /nfs/dbraw/zinc/95/49/64/938954964.db2.gz MGWKOPPKDDSFED-HUUCEWRRSA-N 0 3 423.479 4.148 20 0 HIADHN CCCN(CC(F)(F)F)C(=O)[C@@H]1CCCN(Cc2cnc(C3CCC3)s2)C1 ZINC000539850497 938957824 /nfs/dbraw/zinc/95/78/24/938957824.db2.gz OKRXZLNTXJZCCE-OAHLLOKOSA-N 0 3 403.514 4.424 20 0 HIADHN CCCN(CC(F)(F)F)C(=O)[C@H]1CCCN(Cc2cnc(C3CCC3)s2)C1 ZINC000539850490 938957865 /nfs/dbraw/zinc/95/78/65/938957865.db2.gz OKRXZLNTXJZCCE-HNNXBMFYSA-N 0 3 403.514 4.424 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@H](C)N[C@H](C)c2ccccc2N(C)C)cc1 ZINC000539854862 938958681 /nfs/dbraw/zinc/95/86/81/938958681.db2.gz MWBGGNGZUXDFAD-ZWKOTPCHSA-N 0 3 403.592 4.195 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)Nc1ccc(C(N)=O)cc1)c1ccc(-c2ccc(F)cc2)cc1 ZINC000539853715 938958799 /nfs/dbraw/zinc/95/87/99/938958799.db2.gz KUAGFTGUMBAGSZ-CVEARBPZSA-N 0 3 405.473 4.269 20 0 HIADHN CCCC[C@H](NCc1cccc2nccn21)C(=O)Nc1cccc(N2CCCC2)c1 ZINC000539859994 938959790 /nfs/dbraw/zinc/95/97/90/938959790.db2.gz CADDTIJXWZQYPR-QFIPXVFZSA-N 0 3 405.546 4.222 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)Cc2ccccc2C(F)(F)F)cc1 ZINC000539930960 938978549 /nfs/dbraw/zinc/97/85/49/938978549.db2.gz HTQHZNRYXQANOR-FQEVSTJZSA-N 0 3 406.448 4.210 20 0 HIADHN Clc1cc2c(c(Br)c1)CC[C@@H]2NCc1cccnc1-n1cccn1 ZINC000539969894 938982545 /nfs/dbraw/zinc/98/25/45/938982545.db2.gz XDAXNBCNTLADNU-KRWDZBQOSA-N 0 3 403.711 4.460 20 0 HIADHN O=C([C@@H]1CC12CCN(Cc1ccc(OCC(F)(F)F)cc1)CC2)N1CCCCC1 ZINC000540004822 939036100 /nfs/dbraw/zinc/03/61/00/939036100.db2.gz IGSFOOXPYIVYDA-IBGZPJMESA-N 0 3 410.480 4.242 20 0 HIADHN CO[C@H](c1ccc(F)cc1)[C@@H](C)NC(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000540015415 939040350 /nfs/dbraw/zinc/04/03/50/939040350.db2.gz DZFTXZJVWZGHEN-BPAFIMBUSA-N 0 3 405.539 4.100 20 0 HIADHN O=C(CCc1cccnc1)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1 ZINC000540023452 939041550 /nfs/dbraw/zinc/04/15/50/939041550.db2.gz JGNHGJFUZVSREQ-UHFFFAOYSA-N 0 3 414.553 4.018 20 0 HIADHN Cc1c(NC(=O)[C@@H]2CCCN(Cc3cccnc3)C2)cnn1-c1ccc(Cl)cc1 ZINC000563578525 945222649 /nfs/dbraw/zinc/22/26/49/945222649.db2.gz YNDVUPBGVZFUHH-GOSISDBHSA-N 0 3 409.921 4.080 20 0 HIADHN C[C@H](CC(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1)Cc1ccc(Cl)cc1 ZINC000540054475 939051788 /nfs/dbraw/zinc/05/17/88/939051788.db2.gz RVJLSWGAXNQLGO-GBESFXJTSA-N 0 3 406.998 4.257 20 0 HIADHN Brc1cc(CN[C@@H](c2ccccc2)[C@@H]2CCOC2)cc2c1OCCO2 ZINC000540067486 939057286 /nfs/dbraw/zinc/05/72/86/939057286.db2.gz CDTRDSASFIWPLX-APWZRJJASA-N 0 3 404.304 4.088 20 0 HIADHN CCOc1ccccc1-c1cccc(C(=O)NCCCCN2C[C@@H](C)O[C@@H](C)C2)c1 ZINC000540133549 939085387 /nfs/dbraw/zinc/08/53/87/939085387.db2.gz UOWYGIBSGNQHKK-BGYRXZFFSA-N 0 3 410.558 4.372 20 0 HIADHN C[C@H](N[C@H]1CCN(C)[C@H]1c1ccc(F)c(F)c1)c1ccc(-n2cncn2)cc1Cl ZINC000540144517 939090009 /nfs/dbraw/zinc/09/00/09/939090009.db2.gz YZOLBGQQZZYYOZ-ZEWGMFERSA-N 0 3 417.891 4.295 20 0 HIADHN CCCc1ccc([C@@H](C)NCc2ccccc2CS(=O)(=O)N2CCCC2)cc1 ZINC000540144982 939090861 /nfs/dbraw/zinc/09/08/61/939090861.db2.gz VBYSDANPBCYNBR-LJQANCHMSA-N 0 3 400.588 4.416 20 0 HIADHN C[C@@H](NC[C@H](C)S(C)(=O)=O)c1ccc(-c2ccccc2Br)s1 ZINC000540145799 939090903 /nfs/dbraw/zinc/09/09/03/939090903.db2.gz XSDZYXLDQUZLRS-NWDGAFQWSA-N 0 3 402.379 4.261 20 0 HIADHN C[C@H](N[C@H]1CCCN(CC(F)(F)F)C1=O)c1ccc(OCc2ccccc2)cc1 ZINC000540152150 939092856 /nfs/dbraw/zinc/09/28/56/939092856.db2.gz VWEJIYGDRAAIGN-JXFKEZNVSA-N 0 3 406.448 4.470 20 0 HIADHN C[C@@H](NCCNC(=O)c1cccc(Br)c1)c1ccccc1OC(F)F ZINC000540181536 939108829 /nfs/dbraw/zinc/10/88/29/939108829.db2.gz LZTFEXPWCYQWNB-GFCCVEGCSA-N 0 3 413.262 4.131 20 0 HIADHN Cc1ccc(S(=O)(=O)N2CCC(N[C@H](C)c3c(F)cccc3Cl)CC2)cc1 ZINC000540183443 939109904 /nfs/dbraw/zinc/10/99/04/939109904.db2.gz IMMRYYZARHIEEF-OAHLLOKOSA-N 0 3 410.942 4.291 20 0 HIADHN COc1ccc([C@H](C)N[C@H](C)c2ccc(-n3cncn3)cc2)cc1Br ZINC000540191217 939115924 /nfs/dbraw/zinc/11/59/24/939115924.db2.gz MYGJZCIZICMCQB-KGLIPLIRSA-N 0 3 401.308 4.450 20 0 HIADHN CC[C@H](N[C@@H](C)c1ccc(OCCOC)c(OC)c1)c1ccc2c(c1)OCCO2 ZINC000540192013 939117133 /nfs/dbraw/zinc/11/71/33/939117133.db2.gz XDKOWMBYAFKSSN-LPHOPBHVSA-N 0 3 401.503 4.294 20 0 HIADHN Cc1ccc2c(c1)[C@H](NCc1ccc(C(=O)N3C[C@@H](C)O[C@@H](C)C3)cc1)CCCO2 ZINC000540192091 939117385 /nfs/dbraw/zinc/11/73/85/939117385.db2.gz ZXAJHXLKNNLEOH-SELNLUPBSA-N 0 3 408.542 4.248 20 0 HIADHN COc1cc(CN[C@H](C)c2ccc(C(F)(F)F)cc2)ccc1OCC(=O)N(C)C ZINC000540192404 939117448 /nfs/dbraw/zinc/11/74/48/939117448.db2.gz KPGNYLFSAZAXNA-CQSZACIVSA-N 0 3 410.436 4.032 20 0 HIADHN COc1ccc2cc([C@H](C)NCc3ccc(OCC(=O)N(C)C)c(OC)c3)ccc2c1 ZINC000540192835 939118435 /nfs/dbraw/zinc/11/84/35/939118435.db2.gz UPQBTNKLHKVPFJ-KRWDZBQOSA-N 0 3 422.525 4.175 20 0 HIADHN Fc1ccc(-c2nc(CN[C@@H]3CCCOc4c(Br)cccc43)n[nH]2)cc1 ZINC000540218947 939134794 /nfs/dbraw/zinc/13/47/94/939134794.db2.gz WFIVGMJMEVGWMP-MRXNPFEDSA-N 0 3 417.282 4.377 20 0 HIADHN CCN1CCCN(C(=O)Nc2ccc(N(C)C(=O)c3ccc(Cl)cc3)cc2)CC1 ZINC000540225714 939142634 /nfs/dbraw/zinc/14/26/34/939142634.db2.gz QDKDAVGRSQFFOR-UHFFFAOYSA-N 0 3 414.937 4.176 20 0 HIADHN COc1ccc(CCN[C@H](C)c2nc3ccc(Cl)cc3n2C)c(OC)c1OC ZINC000540299617 939186255 /nfs/dbraw/zinc/18/62/55/939186255.db2.gz OAMFPRCRLMEWHF-CYBMUJFWSA-N 0 3 403.910 4.146 20 0 HIADHN CO[C@H](c1ccc(Br)cc1)[C@@H](C)N[C@@H]1CC(=O)N(C)c2ccccc21 ZINC000540315949 939191353 /nfs/dbraw/zinc/19/13/53/939191353.db2.gz KWUBRUKFSWTWKX-DUXSXAKTSA-N 0 3 403.320 4.223 20 0 HIADHN O=C1CCCN1C[C@@H](NCCOc1cccc(F)c1)c1cccc(C(F)(F)F)c1 ZINC000540319230 939192576 /nfs/dbraw/zinc/19/25/76/939192576.db2.gz MVGFCGTZJWDUCH-LJQANCHMSA-N 0 3 410.411 4.177 20 0 HIADHN COc1ccc([C@@H](C)N[C@@H](C)C(=O)N(C)Cc2ccc(Br)cc2)cc1 ZINC000540331248 939197638 /nfs/dbraw/zinc/19/76/38/939197638.db2.gz RRYSAQYBSDURQN-CABCVRRESA-N 0 3 405.336 4.155 20 0 HIADHN C[C@@H](NCCC(=O)Nc1cc(N)ccc1F)c1cccc(NC(=O)c2ccccc2)c1 ZINC000540333155 939198200 /nfs/dbraw/zinc/19/82/00/939198200.db2.gz VXHBLWMXCUKDHJ-MRXNPFEDSA-N 0 3 420.488 4.340 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@@H](C)NCc2cc(F)cc3cccnc32)cc1 ZINC000540343680 939200627 /nfs/dbraw/zinc/20/06/27/939200627.db2.gz DUDXGRHIODGHCS-MRXNPFEDSA-N 0 3 415.534 4.255 20 0 HIADHN CCOC(=O)C1CCN(C(=O)CN[C@H](CC2CCCCC2)c2ccccc2)CC1 ZINC000540355667 939205900 /nfs/dbraw/zinc/20/59/00/939205900.db2.gz NZPNFTIJWBROBT-JOCHJYFZSA-N 0 3 400.563 4.089 20 0 HIADHN CCNC(=O)c1cccc(NC(=O)CN[C@@H](CCc2ccccc2)c2ccccc2)c1 ZINC000540376523 939216752 /nfs/dbraw/zinc/21/67/52/939216752.db2.gz QQVUPOQTQFFKDP-DEOSSOPVSA-N 0 3 415.537 4.339 20 0 HIADHN C[C@H](NCC(=O)NCc1ccccc1OC1CCCC1)c1cccc(-n2cccn2)c1 ZINC000540385746 939223736 /nfs/dbraw/zinc/22/37/36/939223736.db2.gz GXWFYNLMGSMTAT-IBGZPJMESA-N 0 3 418.541 4.161 20 0 HIADHN Cc1cccc(Cc2cnc(NC(=O)CN[C@@H](c3ccccc3)[C@@H]3CCOC3)s2)c1 ZINC000540389262 939226339 /nfs/dbraw/zinc/22/63/39/939226339.db2.gz FZLDJZZWPUBGPW-OFNKIYASSA-N 0 3 421.566 4.348 20 0 HIADHN CC[C@H](C)[C@@H](NCC(=O)N1CCC(C(=O)N(C)C(C)C)CC1)c1ccc(Cl)cc1 ZINC000540411026 939238965 /nfs/dbraw/zinc/23/89/65/939238965.db2.gz JIYBGEMLWBSCCD-HTAPYJJXSA-N 0 3 422.013 4.122 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)Nc1ccc2c(c1)OCCO2)c1ccc(-c2ccncc2)cc1 ZINC000540437960 939249686 /nfs/dbraw/zinc/24/96/86/939249686.db2.gz QEJZQYYKMGHRHL-SJORKVTESA-N 0 3 403.482 4.198 20 0 HIADHN COc1cc2c(cc1OC)CN(C(=O)CN[C@@H](c1cccc(C)c1)C(C)(C)C)CC2 ZINC000540437665 939249739 /nfs/dbraw/zinc/24/97/39/939249739.db2.gz GZQWOOJDQSQZKS-DEOSSOPVSA-N 0 3 410.558 4.274 20 0 HIADHN COc1cc2c(cc1OC)CN(C(=O)CN[C@@H](c1ccccc1C)C(C)(C)C)CC2 ZINC000540457452 939258432 /nfs/dbraw/zinc/25/84/32/939258432.db2.gz ABRZYKUDEIJBNX-DEOSSOPVSA-N 0 3 410.558 4.274 20 0 HIADHN O=C(N[C@@H]1CCO[C@@H]1c1ccc(Cl)cc1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000540462195 939262177 /nfs/dbraw/zinc/26/21/77/939262177.db2.gz OMTSMEUWXSAPDZ-STZQEDGTSA-N 0 3 416.924 4.338 20 0 HIADHN C[C@H](N[C@H](c1ccc(Cl)c(C(F)(F)F)c1)C1CC1)C(=O)NC[C@@H]1CCCO1 ZINC000540523267 939287302 /nfs/dbraw/zinc/28/73/02/939287302.db2.gz KJVIILWFJSWYDV-YLVFBTJISA-N 0 3 404.860 4.083 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)c1ccnc(-c2ccccc2)c1N ZINC000540530005 939291135 /nfs/dbraw/zinc/29/11/35/939291135.db2.gz QUOLGHQIGUNKGA-LJQANCHMSA-N 0 3 400.526 4.067 20 0 HIADHN Cc1cc(C)n2c(CNC[C@H](c3c(F)cccc3Cl)N3CCCC3)cnc2n1 ZINC000540536824 939295196 /nfs/dbraw/zinc/29/51/96/939295196.db2.gz GNSOUJPLKOZDCE-LJQANCHMSA-N 0 3 401.917 4.065 20 0 HIADHN C[C@@H](NC(=O)CN[C@H](c1ccc2c(c1)OCCO2)C1CC1)c1ccccc1Cl ZINC000540589837 939312741 /nfs/dbraw/zinc/31/27/41/939312741.db2.gz BDXZCBJMWAHDOQ-PEBXRYMYSA-N 0 3 400.906 4.029 20 0 HIADHN COc1ccc(C[C@H](NCc2cnc3nc(C)cc(C)n23)c2ccccc2)cc1OC ZINC000540592462 939313674 /nfs/dbraw/zinc/31/36/74/939313674.db2.gz SQEUFRHFYKTFCK-QFIPXVFZSA-N 0 3 416.525 4.437 20 0 HIADHN CCOc1cccc2cc([C@@H](C)NCc3ccc(C(=O)N4CCN(C)CC4)cc3)oc21 ZINC000540597388 939315090 /nfs/dbraw/zinc/31/50/90/939315090.db2.gz OINBXVCYWRQCFJ-GOSISDBHSA-N 0 3 421.541 4.070 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)c2cc(C)ccc2SC2CCCC2)CC1 ZINC000540725995 939350627 /nfs/dbraw/zinc/35/06/27/939350627.db2.gz KMBFNPJSSKAWCP-LJQANCHMSA-N 0 3 403.636 4.033 20 0 HIADHN CNS(=O)(=O)c1ccc([C@@H](C)NC2(c3cccc(C(F)(F)F)c3)CCC2)cc1 ZINC000540753860 939360182 /nfs/dbraw/zinc/36/01/82/939360182.db2.gz UGURAKPRTUEZDH-CQSZACIVSA-N 0 3 412.477 4.344 20 0 HIADHN C[C@H]1CN(Cc2ccccn2)CC[C@@H]1Nc1cccc(I)c1 ZINC000540818211 939383006 /nfs/dbraw/zinc/38/30/06/939383006.db2.gz JFRFEYFVPNEDHO-KSSFIOAISA-N 0 3 407.299 4.009 20 0 HIADHN C[C@H]1CN(Cc2ccccn2)CC[C@H]1Nc1cnn(-c2ncc(Cl)cc2Cl)c1 ZINC000540825360 939385532 /nfs/dbraw/zinc/38/55/32/939385532.db2.gz XPLDUAGTPLNZNY-IFXJQAMLSA-N 0 3 417.344 4.292 20 0 HIADHN Cc1nnc([C@H]2CCCN([C@H](C)c3nc(-c4cccc(C(F)(F)F)c4)no3)C2)[nH]1 ZINC000540862693 939400270 /nfs/dbraw/zinc/40/02/70/939400270.db2.gz HZNDOMJKWZMVNV-RISCZKNCSA-N 0 3 406.412 4.123 20 0 HIADHN Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)C(=O)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000540895969 939413231 /nfs/dbraw/zinc/41/32/31/939413231.db2.gz OMBCNVNUQFFYHA-KXBFYZLASA-N 0 3 422.495 4.119 20 0 HIADHN C[C@H](C[C@H]1CCCO1)N[C@H](c1cccc(S(C)(=O)=O)c1)c1ccc(F)c(F)c1 ZINC000540913932 939416420 /nfs/dbraw/zinc/41/64/20/939416420.db2.gz NKTLVUTTYDYHGZ-SOIKWTOOSA-N 0 3 409.498 4.005 20 0 HIADHN Cc1ncc2c(n1)CC[C@@H](N[C@@H](c1ccc3c(c1)OCCO3)c1ccccc1Cl)C2 ZINC000540916322 939417292 /nfs/dbraw/zinc/41/72/92/939417292.db2.gz STCBQTCTDDDIGJ-KOSHJBKYSA-N 0 3 421.928 4.446 20 0 HIADHN CS(=O)(=O)[C@H]1CCC[C@@H](NCc2ccc(-c3cccc(C(F)(F)F)c3)o2)C1 ZINC000540979877 939424112 /nfs/dbraw/zinc/42/41/12/939424112.db2.gz SBGAJLWEUGPBRF-WBVHZDCISA-N 0 3 401.450 4.411 20 0 HIADHN CC(=O)Nc1ccc([C@@H](C)NCc2ccc(N3CCc4ccccc4C3)nc2)cc1 ZINC000540988909 939426242 /nfs/dbraw/zinc/42/62/42/939426242.db2.gz KUQYLTLICMDDER-GOSISDBHSA-N 0 3 400.526 4.454 20 0 HIADHN CC(C)[C@H](NCc1ccc(S(=O)(=O)C(C)C)cc1)c1ccc2c(c1)OCCO2 ZINC000541058145 939445317 /nfs/dbraw/zinc/44/53/17/939445317.db2.gz UHMOINRXGSRNQS-QFIPXVFZSA-N 0 3 403.544 4.127 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)Nc1cc(F)c(OC(C)(C)C)c(F)c1 ZINC000541104996 939461726 /nfs/dbraw/zinc/46/17/26/939461726.db2.gz TYUOHSBVGQBUBN-UHFFFAOYSA-N 0 3 406.477 4.133 20 0 HIADHN CN(C)[C@H](CNC(=O)N1CCO[C@H](c2ccc(C(F)(F)F)cc2)C1)c1ccccc1 ZINC000541153101 939477946 /nfs/dbraw/zinc/47/79/46/939477946.db2.gz CJABMQVRWSMDBI-UXHICEINSA-N 0 3 421.463 4.091 20 0 HIADHN CCN1CC[C@H](N[C@@H](C)c2nc3ccccc3n2C)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000541175804 939484389 /nfs/dbraw/zinc/48/43/89/939484389.db2.gz FHTCEYOJCJOESN-LTBCBRHQSA-N 0 3 402.464 4.477 20 0 HIADHN COc1cccc(C[C@H](C)N[C@H](c2ccc(C)cc2)c2cccc(S(C)(=O)=O)c2)n1 ZINC000541207573 939485677 /nfs/dbraw/zinc/48/56/77/939485677.db2.gz YROBEBBCYUOAHZ-MHECFPHRSA-N 0 3 424.566 4.112 20 0 HIADHN CC(C)n1ccc(C[C@H](C)N[C@@H](CN2CCCC2=O)c2cccc(C(F)(F)F)c2)n1 ZINC000541212486 939485926 /nfs/dbraw/zinc/48/59/26/939485926.db2.gz JIISKZLXAWCNLR-JXFKEZNVSA-N 0 3 422.495 4.367 20 0 HIADHN Cc1ccc2c(c1C)OC[C@H]2N[C@H](C)CC(=O)Nc1ccc(NC(=O)C2CC2)cc1 ZINC000541213312 939485960 /nfs/dbraw/zinc/48/59/60/939485960.db2.gz KNFVLSBXNZWCAB-QVKFZJNVSA-N 0 3 407.514 4.092 20 0 HIADHN COC(=O)c1cccc(NC(=O)C[C@@H](C)N[C@H](c2nc3ccccc3[nH]2)C(C)C)c1 ZINC000541217964 939486125 /nfs/dbraw/zinc/48/61/25/939486125.db2.gz IMDJVIIIGQUSMH-VFNWGFHPSA-N 0 3 408.502 4.054 20 0 HIADHN CC[C@H](N[C@@H]1CCCN(Cc2nccn2C)C1=O)c1ccc(Oc2ccccc2)cc1 ZINC000541228905 939486604 /nfs/dbraw/zinc/48/66/04/939486604.db2.gz JFWAIVAANWJUKJ-XZOQPEGZSA-N 0 3 418.541 4.444 20 0 HIADHN CN(C)C(=O)[C@H](NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1ccccc1 ZINC000541281974 939489210 /nfs/dbraw/zinc/48/92/10/939489210.db2.gz RUNGPUQXIRSTQX-OAQYLSRUSA-N 0 3 420.384 4.377 20 0 HIADHN CCCN(C(=O)c1cnn(CCC(F)(F)F)c1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000541290924 939489590 /nfs/dbraw/zinc/48/95/90/939489590.db2.gz NVEGGULGNIKXAK-FQEVSTJZSA-N 0 3 422.495 4.352 20 0 HIADHN COCCOc1ccc(C(F)(F)F)cc1NC(=O)[C@@H](C)N(C)C[C@H]1CC=CCC1 ZINC000541320355 939490826 /nfs/dbraw/zinc/49/08/26/939490826.db2.gz VFUAGOHLPKULQJ-CVEARBPZSA-N 0 3 414.468 4.346 20 0 HIADHN O=C(NC[C@@H]1CCCN(Cc2cccs2)C1)c1nccnc1Sc1ccccc1 ZINC000541425122 939513012 /nfs/dbraw/zinc/51/30/12/939513012.db2.gz LCDVGQSIJVTTBK-KRWDZBQOSA-N 0 3 424.595 4.331 20 0 HIADHN C[C@@H](CN(C)C(=O)Nc1ccc(CCN2CCSCC2)cc1)c1nccs1 ZINC000541476902 939531303 /nfs/dbraw/zinc/53/13/03/939531303.db2.gz UWXMIQLUKSFXNN-INIZCTEOSA-N 0 3 404.605 4.002 20 0 HIADHN COc1ccc(Oc2ccc(CNCc3cccc(CS(C)(=O)=O)c3)cc2)cc1 ZINC000541540784 939548017 /nfs/dbraw/zinc/54/80/17/939548017.db2.gz QCRDWLIYWXYDMJ-UHFFFAOYSA-N 0 3 411.523 4.322 20 0 HIADHN CCc1ccc([C@@H](CN2CCOCC2)NCc2ccc(-c3ccncc3)cc2)cc1 ZINC000541541796 939548462 /nfs/dbraw/zinc/54/84/62/939548462.db2.gz IJJLCKJYUWHYGA-AREMUKBSSA-N 0 3 401.554 4.474 20 0 HIADHN O=C1CC[C@@H](NCc2cn(-c3ccccc3)nc2-c2ccncc2)c2ccccc2N1 ZINC000541544374 939549299 /nfs/dbraw/zinc/54/92/99/939549299.db2.gz SFZYEAJTZRNSCL-JOCHJYFZSA-N 0 3 409.493 4.498 20 0 HIADHN Cc1cccc(N2CCN(CCCN[C@@H](c3ccc(F)cc3)c3ccccn3)CC2)c1 ZINC000541547099 939550981 /nfs/dbraw/zinc/55/09/81/939550981.db2.gz PYFPQRSEFLMPRW-SANMLTNESA-N 0 3 418.560 4.420 20 0 HIADHN CCc1noc(CC)c1CC(=O)N[C@H](c1ccc(F)c(F)c1)C(C)(C)N1CCCC1 ZINC000541552060 939553247 /nfs/dbraw/zinc/55/32/47/939553247.db2.gz COUIQYGVXBHOTC-JOCHJYFZSA-N 0 3 419.516 4.352 20 0 HIADHN Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)N[C@@H]1CCCN(Cc2ccccn2)C1=O ZINC000541568405 939556923 /nfs/dbraw/zinc/55/69/23/939556923.db2.gz QEKMDUWEMCTVPH-MGPUTAFESA-N 0 3 424.545 4.494 20 0 HIADHN CC(C)C[C@H](NCC(=O)N1CCC(C(=O)N2CCCCCC2)CC1)c1cccs1 ZINC000541625921 939574470 /nfs/dbraw/zinc/57/44/70/939574470.db2.gz ACPQEDSVNJRIRT-FQEVSTJZSA-N 0 3 419.635 4.066 20 0 HIADHN COc1ccccc1C[C@@H](NCc1nnc(-c2ccc(Br)o2)o1)C(C)C ZINC000541627797 939574967 /nfs/dbraw/zinc/57/49/67/939574967.db2.gz AVPHRDJORYMYRA-CQSZACIVSA-N 0 3 420.307 4.458 20 0 HIADHN CC[C@H](NCC(=O)N(Cc1ccccc1)c1nc2c(s1)CCCC2)[C@H]1CCCO1 ZINC000541637390 939579569 /nfs/dbraw/zinc/57/95/69/939579569.db2.gz POJOBKIKFGQCFU-AZUAARDMSA-N 0 3 413.587 4.102 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)C[C@@H](C)NCc1cc(Cl)cc2c1OCC2 ZINC000541742143 939618447 /nfs/dbraw/zinc/61/84/47/939618447.db2.gz ZWFHAHLKUABFBP-GFCCVEGCSA-N 0 3 409.313 4.444 20 0 HIADHN Cn1ccc([C@H](NCC2(N3CCSCC3)CCCC2)c2ccc(Cl)cc2)n1 ZINC000541746152 939619252 /nfs/dbraw/zinc/61/92/52/939619252.db2.gz FRBWSSGMBLACQM-HXUWFJFHSA-N 0 3 405.011 4.114 20 0 HIADHN O=C(N[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000541749476 939620416 /nfs/dbraw/zinc/62/04/16/939620416.db2.gz MFQGUPNLSJJJIP-WWPVKYPJSA-N 0 3 414.496 4.213 20 0 HIADHN CN(C(=O)Nc1csc(-c2ccccn2)n1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000541763728 939624388 /nfs/dbraw/zinc/62/43/88/939624388.db2.gz VQPVNGXNKKXBOK-GOSISDBHSA-N 0 3 407.543 4.333 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@H]2CCCC[C@H]2NCc2ccccc2-n2cccn2)cc1 ZINC000541768373 939626048 /nfs/dbraw/zinc/62/60/48/939626048.db2.gz UEXMYQKCUCWFEP-GGAORHGYSA-N 0 3 409.555 4.055 20 0 HIADHN CN1CCN(c2ccc(CN[C@H](c3ccccc3)c3ccc(Cl)cc3)cn2)CC1 ZINC000541844438 939646463 /nfs/dbraw/zinc/64/64/63/939646463.db2.gz MZMQZLBAWXKKQW-XMMPIXPASA-N 0 3 406.961 4.366 20 0 HIADHN Cc1nn(-c2ccccc2)cc1NC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000541906631 939650955 /nfs/dbraw/zinc/65/09/55/939650955.db2.gz ZVCUWBLRJNKURT-JOCHJYFZSA-N 0 3 403.530 4.309 20 0 HIADHN COc1ccc(C[C@@H](C)N[C@H](CCO)c2ccccc2Br)cc1OC ZINC000541916520 939653337 /nfs/dbraw/zinc/65/33/37/939653337.db2.gz JDLJERPYQGJYBR-RDTXWAMCSA-N 0 3 408.336 4.111 20 0 HIADHN COc1ccc([C@H](NC(=O)CN[C@H](C)c2ccc(-n3ccnc3C)cc2)C(C)C)cc1 ZINC000541956678 939662852 /nfs/dbraw/zinc/66/28/52/939662852.db2.gz VXHHNRYGKDNOAU-IQGLISFBSA-N 0 3 420.557 4.353 20 0 HIADHN OC[C@H]1CN(Cc2ccccc2)CC[C@@H]1Nc1cnc2cc(Cl)c(Cl)cc2n1 ZINC000542042887 939697275 /nfs/dbraw/zinc/69/72/75/939697275.db2.gz PVBOUJRSUXWRLW-QAPCUYQASA-N 0 3 417.340 4.232 20 0 HIADHN C[C@H](NCC[S@@](=O)c1cc(Cl)ccc1Cl)c1ccc([S@](C)=O)cc1 ZINC000542048449 939699253 /nfs/dbraw/zinc/69/92/53/939699253.db2.gz WZCKACIKAHXTMQ-PHVSPZQESA-N 0 3 404.384 4.189 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N2CCC(Oc3cc(C)ccn3)CC2)N2CCCC2)cc1 ZINC000542089746 939707002 /nfs/dbraw/zinc/70/70/02/939707002.db2.gz TVTDUQRYTQRPEA-QHCPKHFHSA-N 0 3 422.573 4.088 20 0 HIADHN COC(=O)[C@@H](NC1CCN([C@H](C)c2ccncc2)CC1)c1ccccc1C(F)(F)F ZINC000542100749 939713188 /nfs/dbraw/zinc/71/31/88/939713188.db2.gz KVTIZJTVRZZDTD-QRWLVFNGSA-N 0 3 421.463 4.130 20 0 HIADHN CCc1cccc2c1OCC[C@@H]2N[C@H](C)CC(=O)Nc1ccc(NC(=O)C2CC2)cc1 ZINC000542143109 939729276 /nfs/dbraw/zinc/72/92/76/939729276.db2.gz GBOYULXSRVYXAV-ZHRRBRCNSA-N 0 3 421.541 4.428 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2ccc(SC3CC3)cc2)cc1)[C@@H]1CCCN(C)C1 ZINC000542150613 939731881 /nfs/dbraw/zinc/73/18/81/939731881.db2.gz ZFTZEGFEFFEWNU-HXUWFJFHSA-N 0 3 423.582 4.360 20 0 HIADHN COc1ccc(Cl)cc1CN[C@H](C)CC(=O)Nc1ccc(NC(=O)C2CC2)cc1 ZINC000542152168 939732330 /nfs/dbraw/zinc/73/23/30/939732330.db2.gz JLDOTRZGHTUULN-CQSZACIVSA-N 0 3 415.921 4.204 20 0 HIADHN CS(=O)(=O)Cc1cccc(CN[C@H]2CCCc3c(Br)cccc32)c1 ZINC000542153585 939733463 /nfs/dbraw/zinc/73/34/63/939733463.db2.gz IOCHIFPTUCRUBW-IBGZPJMESA-N 0 3 408.361 4.161 20 0 HIADHN O[C@H](COc1ccccc1C(F)(F)F)CN1CCC(OCc2ccccc2)CC1 ZINC000542210137 939758255 /nfs/dbraw/zinc/75/82/55/939758255.db2.gz NXIDSUGYFIAUTH-SFHVURJKSA-N 0 3 409.448 4.126 20 0 HIADHN CN(CCNC(=O)c1ncoc1-c1cccc(C(F)(F)F)c1)Cc1ccccc1 ZINC000542222584 939763409 /nfs/dbraw/zinc/76/34/09/939763409.db2.gz MNLXWGDPLRZGSE-UHFFFAOYSA-N 0 3 403.404 4.222 20 0 HIADHN C[C@H](CN(C)C[C@@H](O)COc1ccc(Cl)cc1Br)c1nccs1 ZINC000542307308 939793784 /nfs/dbraw/zinc/79/37/84/939793784.db2.gz PZJGMRMTEMKGGW-DGCLKSJQSA-N 0 3 419.772 4.034 20 0 HIADHN C[C@@H](CN(C)C(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1)c1nccs1 ZINC000542346108 939804336 /nfs/dbraw/zinc/80/43/36/939804336.db2.gz OVUGNYMYNCNODD-HNAYVOBHSA-N 0 3 411.493 4.160 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)Nc1ccc(-c2ccc[nH]2)cc1 ZINC000542384470 939811866 /nfs/dbraw/zinc/81/18/66/939811866.db2.gz KWAXRFDGMGEKFL-UHFFFAOYSA-N 0 3 417.557 4.406 20 0 HIADHN CC(C)Cc1ccc([C@H](CNC(=O)Nc2ccc3c(c2)CCC(=O)N3)N(C)C)cc1 ZINC000563738542 945274512 /nfs/dbraw/zinc/27/45/12/945274512.db2.gz KVNNPCYNGHXTFA-QFIPXVFZSA-N 0 3 408.546 4.194 20 0 HIADHN O[C@@H](CN[C@H]1CCOc2c(Cl)cccc21)COc1cccc(C(F)(F)F)c1 ZINC000563738875 945274871 /nfs/dbraw/zinc/27/48/71/945274871.db2.gz KTDFKIULPAMRIM-GUYCJALGSA-N 0 3 401.812 4.212 20 0 HIADHN O[C@H](CN[C@H]1CCOc2c(Cl)cccc21)COc1cccc(C(F)(F)F)c1 ZINC000563738870 945275302 /nfs/dbraw/zinc/27/53/02/945275302.db2.gz KTDFKIULPAMRIM-DYVFJYSZSA-N 0 3 401.812 4.212 20 0 HIADHN COc1cc(OC)cc(N2CC[C@H](CN[C@@H](c3ccc(F)cc3)c3ccccn3)C2)c1 ZINC000542475080 939829504 /nfs/dbraw/zinc/82/95/04/939829504.db2.gz PGKGMEOHDGIAFQ-CJAUYULYSA-N 0 3 421.516 4.443 20 0 HIADHN COc1ccc(C(=O)C[C@H](C)C(=O)N[C@H]2[C@H](C)CN(Cc3ccccc3)C[C@@H]2C)cc1 ZINC000542489419 939832147 /nfs/dbraw/zinc/83/21/47/939832147.db2.gz IAVXYUWCUJFXIT-UVPKRVSESA-N 0 3 422.569 4.177 20 0 HIADHN C[C@@H]1C[C@H](N[C@H]2CCCN(Cc3ccccn3)C2=O)c2cccc(Br)c21 ZINC000542499013 939833126 /nfs/dbraw/zinc/83/31/26/939833126.db2.gz MPIYCRFDVUVZSO-CCKFTAQKSA-N 0 3 414.347 4.173 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)N[C@@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000542537871 939840203 /nfs/dbraw/zinc/84/02/03/939840203.db2.gz HQORVNFYMHRQTM-ZLNRFVROSA-N 0 3 411.521 4.182 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@H]1CCO[C@@H](c2ccc(F)cc2)C1)c1ccsc1 ZINC000542538019 939840242 /nfs/dbraw/zinc/84/02/42/939840242.db2.gz NAZPTZVDCIDPED-PWRODBHTSA-N 0 3 419.566 4.490 20 0 HIADHN C[C@@H](NCC(=O)N1CCC(c2ccccc2)=N1)[C@@H](C)c1ccccc1C(F)(F)F ZINC000542564724 939844462 /nfs/dbraw/zinc/84/44/62/939844462.db2.gz XIOYBKYUKPFSAT-HZPDHXFCSA-N 0 3 403.448 4.424 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1NC(=O)[C@H](C)N[C@H](C)[C@H]1Oc2ccccc2[C@@H]1C ZINC000542610721 939848258 /nfs/dbraw/zinc/84/82/58/939848258.db2.gz LQCLSKALYHNLKG-DAKPEJIASA-N 0 3 418.541 4.359 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1NC(=O)[C@H](C)N[C@H](C)[C@@H]1Oc2ccccc2[C@@H]1C ZINC000542610715 939848297 /nfs/dbraw/zinc/84/82/97/939848297.db2.gz LQCLSKALYHNLKG-CABYKGFESA-N 0 3 418.541 4.359 20 0 HIADHN Cc1ccc(CN(C(=O)CN(C)[C@@H]2CCO[C@H](c3ccc(F)cc3)C2)C2CC2)o1 ZINC000542630259 939850313 /nfs/dbraw/zinc/85/03/13/939850313.db2.gz ASRIEVMIISEJKD-IRLDBZIGSA-N 0 3 400.494 4.070 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@@H]2NCc2cccc(-n3ccnc3)c2)cc1 ZINC000542660121 939852173 /nfs/dbraw/zinc/85/21/73/939852173.db2.gz CZUHIAQXSWHVLY-XZOQPEGZSA-N 0 3 409.555 4.055 20 0 HIADHN O=C(NCc1ccncc1)Nc1cccc(CNC/C=C/c2ccc(F)cc2F)c1 ZINC000542688148 939854249 /nfs/dbraw/zinc/85/42/49/939854249.db2.gz RMBRWBNRDTVTCC-DUXPYHPUSA-N 0 3 408.452 4.485 20 0 HIADHN CCOc1ccc([C@@H](NCC2CCS(=O)(=O)CC2)c2ccccc2Cl)cc1 ZINC000542776975 939860327 /nfs/dbraw/zinc/86/03/27/939860327.db2.gz AIECRJXIBCXYIY-OAQYLSRUSA-N 0 3 407.963 4.243 20 0 HIADHN c1csc(C2(NCC3(CNC4(c5nccs5)CCCC4)COC3)CCCC2)n1 ZINC000542929579 939880177 /nfs/dbraw/zinc/88/01/77/939880177.db2.gz CYVPKBIFEJTWRA-UHFFFAOYSA-N 0 3 418.632 4.034 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cc(-c2cnn(C)c2)ccc1F)c1cccc(OC)c1 ZINC000542947236 939883917 /nfs/dbraw/zinc/88/39/17/939883917.db2.gz XMWRLEMJMNWTKV-HSZRJFAPSA-N 0 3 424.520 4.048 20 0 HIADHN CC(C)OC(=O)C1(C(=O)OC(C)C)CC(NCCc2c(Cl)cccc2Cl)C1 ZINC000543070806 939923692 /nfs/dbraw/zinc/92/36/92/939923692.db2.gz HOUHGTMLQCKSKG-UHFFFAOYSA-N 0 3 416.345 4.178 20 0 HIADHN C[C@@H](CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)NCC(=O)NC1CCCCC1 ZINC000543090506 939937306 /nfs/dbraw/zinc/93/73/06/939937306.db2.gz PHQYNRPWFFCPQN-LBPRGKRZSA-N 0 3 419.875 4.114 20 0 HIADHN Cc1cc(Br)cn2c(CN[C@H](c3ccccc3)[C@H]3CCOC3)cnc12 ZINC000543238824 940004520 /nfs/dbraw/zinc/00/45/20/940004520.db2.gz OYHYJMGYVNTTCN-QFBILLFUSA-N 0 3 400.320 4.273 20 0 HIADHN c1c(CNC[C@H]2CC3c4ccccc4C2c2ccccc23)nnn1Cc1cccnc1 ZINC000543246591 940007238 /nfs/dbraw/zinc/00/72/38/940007238.db2.gz VKZNGLLPOLWBPI-ILPVEIHGSA-N 0 3 407.521 4.108 20 0 HIADHN CCN(CC)[C@H](CNC(=O)[C@@H](C)c1c(C)n[nH]c1C)c1ccc(C(F)(F)F)cc1 ZINC000543251599 940008565 /nfs/dbraw/zinc/00/85/65/940008565.db2.gz PPCLELYQEYJHCQ-SCLBCKFNSA-N 0 3 410.484 4.348 20 0 HIADHN CN(C)[C@H](CNC(=O)c1ncoc1-c1cccc(C(F)(F)F)c1)Cc1ccccc1 ZINC000543261649 940011658 /nfs/dbraw/zinc/01/16/58/940011658.db2.gz GVLUUYALOTXZSH-SFHVURJKSA-N 0 3 417.431 4.263 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3CC[C@@H](c4ccc(C)cc4)C3)c(C)c2)CC1 ZINC000543286478 940018459 /nfs/dbraw/zinc/01/84/59/940018459.db2.gz SPUFWAXAQDTLLP-JOCHJYFZSA-N 0 3 406.574 4.467 20 0 HIADHN CN(C(=O)Nc1ccc(-c2ccc[nH]2)cc1)C1CCN(CCc2ccccn2)CC1 ZINC000543309297 940024776 /nfs/dbraw/zinc/02/47/76/940024776.db2.gz SPPWQZYLYOAOFJ-UHFFFAOYSA-N 0 3 403.530 4.248 20 0 HIADHN Cc1cc(NC(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)nn1[C@H](C)C1CC1 ZINC000543319185 940028279 /nfs/dbraw/zinc/02/82/79/940028279.db2.gz YWOPUMXEWCVQBV-OAHLLOKOSA-N 0 3 405.493 4.036 20 0 HIADHN Cc1cc(-c2nc(C3CC3)no2)ccc1NC(=O)N(CCN(C)C)Cc1ccco1 ZINC000543351570 940039128 /nfs/dbraw/zinc/03/91/28/940039128.db2.gz YZJMKVXJOGDIJW-UHFFFAOYSA-N 0 3 409.490 4.111 20 0 HIADHN Cc1nc(CC(=O)N[C@H](c2ccc(F)c(F)c2)C(C)(C)N2CCCC2)c(C)s1 ZINC000543389245 940048596 /nfs/dbraw/zinc/04/85/96/940048596.db2.gz DLJARVPRTXREEC-HXUWFJFHSA-N 0 3 407.530 4.313 20 0 HIADHN CCN(C[C@H]1CCN(Cc2ccccc2)C1)C(=O)[C@@H](C)CC(=O)c1ccc(OC)cc1 ZINC000543431413 940062422 /nfs/dbraw/zinc/06/24/22/940062422.db2.gz HKMGNHHSQPYVHE-UNMCSNQZSA-N 0 3 422.569 4.275 20 0 HIADHN C[C@@H](NCCCN1CCCC1=O)c1nc(-c2ccc(Br)cc2)cs1 ZINC000543498587 940085703 /nfs/dbraw/zinc/08/57/03/940085703.db2.gz HWNQMCXBRLYZLJ-CYBMUJFWSA-N 0 3 408.365 4.236 20 0 HIADHN COc1ccc(Br)cc1-c1nc(CN[C@@H](C)[C@@H]2CCCOC2)cs1 ZINC000543507060 940088979 /nfs/dbraw/zinc/08/89/79/940088979.db2.gz NLGATRBQCLZGKS-QWHCGFSZSA-N 0 3 411.365 4.486 20 0 HIADHN C[C@H](CNC(=O)N[C@@H](CN1CCc2ccccc2C1)C(C)(C)C)c1nccs1 ZINC000543673563 940157408 /nfs/dbraw/zinc/15/74/08/940157408.db2.gz CZHCGTRZLXBWRO-APWZRJJASA-N 0 3 400.592 4.019 20 0 HIADHN COc1ccc(-c2nsc(NC(=O)N[C@H]3CCN([C@@H](C)c4ccccc4)C3)n2)cc1 ZINC000563782578 945300192 /nfs/dbraw/zinc/30/01/92/945300192.db2.gz FMAWFJBUNGUTIS-YJBOKZPZSA-N 0 3 423.542 4.171 20 0 HIADHN CSC[C@@H](N[C@@H](C)Cn1ncc2ccccc2c1=O)c1ccc(C(F)(F)F)cc1 ZINC000543774789 940181608 /nfs/dbraw/zinc/18/16/08/940181608.db2.gz DPJRUSXMDKESCL-IFXJQAMLSA-N 0 3 421.488 4.498 20 0 HIADHN C[C@@H](N[C@H]1CCCN(Cc2nccn2C)C1=O)c1ccc(Oc2ccccc2)cc1 ZINC000544017003 940300546 /nfs/dbraw/zinc/30/05/46/940300546.db2.gz RYQVZBMUMIZZMJ-GCJKJVERSA-N 0 3 404.514 4.054 20 0 HIADHN CCCN1CCN(c2ccccc2CNc2ccc(Cl)c(C[S@@](C)=O)c2)CC1 ZINC000544041949 940308233 /nfs/dbraw/zinc/30/82/33/940308233.db2.gz JJADWZSASIAMRT-MUUNZHRXSA-N 0 3 420.022 4.363 20 0 HIADHN O[C@@H](COc1ccccc1C(F)(F)F)CN1CCC(Nc2ccc(F)cc2)CC1 ZINC000544071639 940317535 /nfs/dbraw/zinc/31/75/35/940317535.db2.gz SNSVSFQDIXWXEP-GOSISDBHSA-N 0 3 412.427 4.161 20 0 HIADHN COCC[C@@H](Cc1ccco1)NC(=O)NC[C@H](c1cccs1)N1CCC(C)CC1 ZINC000544127079 940333197 /nfs/dbraw/zinc/33/31/97/940333197.db2.gz FSHIEDQNIUXZNW-AZUAARDMSA-N 0 3 419.591 4.061 20 0 HIADHN CC(=O)NC1CCC(N(C)c2c(C)c(C)nc3ccc(Br)cc32)CC1 ZINC000544138476 940336028 /nfs/dbraw/zinc/33/60/28/940336028.db2.gz MJJGCPYVJWJWQB-UHFFFAOYSA-N 0 3 404.352 4.498 20 0 HIADHN C[C@@H](C[S@](C)=O)NCc1cn(Cc2ccccc2Cl)nc1-c1ccccc1 ZINC000544168118 940342036 /nfs/dbraw/zinc/34/20/36/940342036.db2.gz BHGUQPMZJBAXSS-OQRWROFFSA-N 0 3 401.963 4.108 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3CC[C@](F)(c4ccccc4)C3)c(C)c2)CC1 ZINC000563862564 945315942 /nfs/dbraw/zinc/31/59/42/945315942.db2.gz FLWRNPFBNUTCOG-XMMPIXPASA-N 0 3 410.537 4.240 20 0 HIADHN COc1ccc(Oc2ccc(CNCc3cccc(OCC(=O)N(C)C)c3)cc2)cc1 ZINC000544185830 940347372 /nfs/dbraw/zinc/34/73/72/940347372.db2.gz IUSFLXYPAYTLNM-UHFFFAOYSA-N 0 3 420.509 4.244 20 0 HIADHN Cc1cc(Br)cn2c(CNC[C@@H](c3ccco3)N3CCCCC3)cnc12 ZINC000544186186 940347797 /nfs/dbraw/zinc/34/77/97/940347797.db2.gz QVJGZXKLJJDAFE-SFHVURJKSA-N 0 3 417.351 4.315 20 0 HIADHN Cc1cc(Br)cn2c(CNC3(c4ccccc4)CCOCC3)cnc12 ZINC000544191716 940348506 /nfs/dbraw/zinc/34/85/06/940348506.db2.gz QULMMRQMPUIBDD-UHFFFAOYSA-N 0 3 400.320 4.201 20 0 HIADHN Cc1nn(C(C)(C)C)cc1C(=O)N(CCN(C)C)Cc1ccc(C(F)(F)F)cc1 ZINC000544195576 940350097 /nfs/dbraw/zinc/35/00/97/940350097.db2.gz QDDUDSBWXGQGRO-UHFFFAOYSA-N 0 3 410.484 4.169 20 0 HIADHN CC1CCN([C@@H](CNC(=O)c2cnn(CCC(F)(F)F)c2)c2ccccc2)CC1 ZINC000544197283 940350729 /nfs/dbraw/zinc/35/07/29/940350729.db2.gz LLUAOLMVBOXXDS-IBGZPJMESA-N 0 3 408.468 4.039 20 0 HIADHN O=C(CC[C@@H]1CCCCO1)N(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000563877633 945318032 /nfs/dbraw/zinc/31/80/32/945318032.db2.gz UDMKETKYUSFAKM-DQEYMECFSA-N 0 3 421.585 4.424 20 0 HIADHN CCN(CC)C(=O)CCCC(=O)N[C@H](c1ccc(F)c(F)c1)C(C)(C)N1CCCC1 ZINC000544355719 940399045 /nfs/dbraw/zinc/39/90/45/940399045.db2.gz KPPCLVMEZBSYGT-JOCHJYFZSA-N 0 3 423.548 4.035 20 0 HIADHN COc1ccc(C(=O)C[C@H](C)C(=O)NCc2ccccc2CN2CCCCC2)cc1 ZINC000544375701 940405501 /nfs/dbraw/zinc/40/55/01/940405501.db2.gz HWYOJMBEGKUIIP-IBGZPJMESA-N 0 3 408.542 4.206 20 0 HIADHN O=C(CC[C@H]1CCCCO1)N(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000563877642 945318441 /nfs/dbraw/zinc/31/84/41/945318441.db2.gz UDMKETKYUSFAKM-LOSJGSFVSA-N 0 3 421.585 4.424 20 0 HIADHN COc1cccc(CN(C)C(=O)CN[C@H](Cc2ccccc2)c2cccs2)c1OC ZINC000544414749 940417179 /nfs/dbraw/zinc/41/71/79/940417179.db2.gz DENSLEYSASXNFC-HXUWFJFHSA-N 0 3 424.566 4.297 20 0 HIADHN CN(C)S(=O)(=O)c1ccc(CN[C@H](Cc2ccccc2)c2cccs2)cc1 ZINC000544415514 940417460 /nfs/dbraw/zinc/41/74/60/940417460.db2.gz LTCNADUHCOXNCU-HXUWFJFHSA-N 0 3 400.569 4.072 20 0 HIADHN COc1ccc(CN(C)C(=O)CN[C@H](Cc2ccccc2)c2cccs2)cc1F ZINC000544415796 940417837 /nfs/dbraw/zinc/41/78/37/940417837.db2.gz TUJQQOJHXWVBJV-HXUWFJFHSA-N 0 3 412.530 4.428 20 0 HIADHN CC(C)N1CC[C@@H](N[C@@H](C)C(=O)N2CCc3ccccc32)[C@H]1c1ccc(F)c(F)c1 ZINC000563901092 945320530 /nfs/dbraw/zinc/32/05/30/945320530.db2.gz QABVMMNXEXAHAK-POCHDABASA-N 0 3 413.512 4.056 20 0 HIADHN CCCOc1cccc(CNC(=O)CN(C)[C@H]2CCO[C@@H](c3ccc(F)cc3)C2)c1 ZINC000544530972 940473130 /nfs/dbraw/zinc/47/31/30/940473130.db2.gz XVVLQHYFKPBGBE-JTHBVZDNSA-N 0 3 414.521 4.083 20 0 HIADHN CC(C)(C)n1cc(CN2CC[C@H](C(=O)N3CCCC3)C2)c(-c2ccccc2Cl)n1 ZINC000563916279 945324554 /nfs/dbraw/zinc/32/45/54/945324554.db2.gz SPNTUKNZYFMLCZ-KRWDZBQOSA-N 0 3 414.981 4.403 20 0 HIADHN OC[C@@H](CN[C@H](c1ccccc1)c1cncnc1)Cc1ccc(C(F)(F)F)cc1 ZINC000544576045 940483230 /nfs/dbraw/zinc/48/32/30/940483230.db2.gz KYFRQYABBDPKHG-DYESRHJHSA-N 0 3 401.432 4.026 20 0 HIADHN CCC[C@H](NCc1ccc(S(=O)(=O)N2CCC[C@@H](C)C2)cc1)c1cccnc1 ZINC000544580334 940484003 /nfs/dbraw/zinc/48/40/03/940484003.db2.gz RBPUONQPHZUZHN-GCJKJVERSA-N 0 3 401.576 4.133 20 0 HIADHN CS[C@@H]1CN(C(=O)c2ccc(COc3ccc(C)cc3C)o2)C[C@H]1N1CCCC1 ZINC000544685223 940502391 /nfs/dbraw/zinc/50/23/91/940502391.db2.gz WMXOEFPIGOWOPR-DENIHFKCSA-N 0 3 414.571 4.127 20 0 HIADHN COC(=O)[C@H](C)Cc1ccc(NC(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000544802055 940515546 /nfs/dbraw/zinc/51/55/46/940515546.db2.gz XEUICUNSQNEAOX-XXBNENTESA-N 0 3 423.557 4.167 20 0 HIADHN COc1ccc(-c2ccc(CN[C@@H](Cc3ccc(Cl)cc3)C(N)=O)s2)cc1 ZINC000544846228 940518779 /nfs/dbraw/zinc/51/87/79/940518779.db2.gz KPZZETHOCGVGDI-IBGZPJMESA-N 0 3 400.931 4.263 20 0 HIADHN CCCc1c(NC(=O)NC[C@@H](c2ccc(C)cc2)N(C)C)cnn1-c1cc(C)ccn1 ZINC000544886708 940521828 /nfs/dbraw/zinc/52/18/28/940521828.db2.gz IDFNWXVMEIPCQS-QFIPXVFZSA-N 0 3 420.561 4.261 20 0 HIADHN CC(=O)Nc1ccc(OC[C@H](O)CNC(c2ccccc2C)c2ccccc2C)cc1 ZINC000544895578 940522541 /nfs/dbraw/zinc/52/25/41/940522541.db2.gz HMXVCAFSVOKJNF-JOCHJYFZSA-N 0 3 418.537 4.381 20 0 HIADHN CN(C)Cc1ccc(-c2noc(COc3ccc(Br)cc3F)n2)cc1 ZINC000544917716 940525198 /nfs/dbraw/zinc/52/51/98/940525198.db2.gz PJIPZQZGWFUVBD-UHFFFAOYSA-N 0 3 406.255 4.279 20 0 HIADHN CCc1ccc([C@@H](NC2Cc3ccccc3C2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000545157270 940552195 /nfs/dbraw/zinc/55/21/95/940552195.db2.gz FBCCGWNWBSBWSX-RUZDIDTESA-N 0 3 405.563 4.499 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cc(C)n(Cc2ccncc2)c1C)c1ccsc1 ZINC000545164434 940553081 /nfs/dbraw/zinc/55/30/81/940553081.db2.gz FHYZORCQFZRWAP-JOCHJYFZSA-N 0 3 410.587 4.423 20 0 HIADHN CCN1CC[C@H](NCc2cncc(Br)c2)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000545218950 940556610 /nfs/dbraw/zinc/55/66/10/940556610.db2.gz STSYYKRRDPTABD-WMZOPIPTSA-N 0 3 414.269 4.187 20 0 HIADHN CC(C)(C)[C@H](CCO)NCC(=O)N1N=C(c2cc3ccccc3o2)C[C@@H]1c1ccco1 ZINC000545517309 940572843 /nfs/dbraw/zinc/57/28/43/940572843.db2.gz KVTFDZLCIYQQAM-GCJKJVERSA-N 0 3 423.513 4.090 20 0 HIADHN c1cnn(-c2ccc(Cc3noc(-c4ccc(CN5CCSCC5)cc4)n3)cc2)c1 ZINC000545626364 940577849 /nfs/dbraw/zinc/57/78/49/940577849.db2.gz CREPPMXGCLCQDD-UHFFFAOYSA-N 0 3 417.538 4.062 20 0 HIADHN CC(C)Oc1ccc(/C=C/c2nc(-c3ccc(N4CCCN(C)CC4)nc3)no2)cc1 ZINC000545652470 940578993 /nfs/dbraw/zinc/57/89/93/940578993.db2.gz DQEJXNZWOUXKQQ-KPKJPENVSA-N 0 3 419.529 4.231 20 0 HIADHN CN(C)c1cc(-c2noc([C@H]3CCCN(Cc4cccnc4)C3)n2)c2ccccc2n1 ZINC000545743843 940583384 /nfs/dbraw/zinc/58/33/84/940583384.db2.gz WEGAIQXKEXITRH-SFHVURJKSA-N 0 3 414.513 4.125 20 0 HIADHN c1cncc(CN2CCC[C@@H](c3nc(-c4ccc(OC5CCCC5)nc4)no3)C2)c1 ZINC000545794682 940598043 /nfs/dbraw/zinc/59/80/43/940598043.db2.gz JANAMJXNMAOBAK-LJQANCHMSA-N 0 3 405.502 4.228 20 0 HIADHN CN(C)c1nc2cc(-c3noc([C@@H]4CCCN(Cc5cccc(F)c5)C4)n3)ccc2o1 ZINC000545824046 940615704 /nfs/dbraw/zinc/61/57/04/940615704.db2.gz WEKYCKPSMJGUQW-QGZVFWFLSA-N 0 3 421.476 4.463 20 0 HIADHN CCN(Cc1ccccc1Br)C(=O)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000545994794 940671341 /nfs/dbraw/zinc/67/13/41/940671341.db2.gz HLEDLHGAJHEIBY-IBGZPJMESA-N 0 3 416.363 4.105 20 0 HIADHN C[C@H]1CN(c2ccc(CN[C@@H](Cc3cccnc3)c3ccc(Cl)cc3)cn2)CCO1 ZINC000546164282 940719205 /nfs/dbraw/zinc/71/92/05/940719205.db2.gz FWKLVXYWJMVNJD-MBSDFSHPSA-N 0 3 422.960 4.429 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](NCCC[C@@H]2CCCCO2)c2ccc(F)cc2)c1 ZINC000546165893 940719468 /nfs/dbraw/zinc/71/94/68/940719468.db2.gz HAXXXJQEULSZRA-RBBKRZOGSA-N 0 3 405.535 4.258 20 0 HIADHN CC[C@@H](C)n1ncc2c1nc(C)cc2C(=O)N(CC)[C@H]1CCN(Cc2ccccc2)C1 ZINC000546183386 940723269 /nfs/dbraw/zinc/72/32/69/940723269.db2.gz FCANNOCYVFFUNU-CTNGQTDRSA-N 0 3 419.573 4.447 20 0 HIADHN CCN(C(=O)c1cc(Br)cn1CC)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000546205837 940729390 /nfs/dbraw/zinc/72/93/90/940729390.db2.gz JWNZSXRGQKUFGW-GOSISDBHSA-N 0 3 404.352 4.007 20 0 HIADHN CC(=O)N1CCC[C@@H](c2noc(-c3cccc(CN(C)Cc4ccccc4)c3)n2)C1 ZINC000546468989 940828421 /nfs/dbraw/zinc/82/84/21/940828421.db2.gz RACBHGFGIDDLTM-JOCHJYFZSA-N 0 3 404.514 4.095 20 0 HIADHN CCN(C(=O)c1cc(C)n(Cc2ccncc2)c1C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000546556566 940851885 /nfs/dbraw/zinc/85/18/85/940851885.db2.gz YAZNKQRPHDIHAR-DEOSSOPVSA-N 0 3 416.569 4.285 20 0 HIADHN Cc1[nH]c(=O)c(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)cc1-c1ccccc1 ZINC000546614240 940861186 /nfs/dbraw/zinc/86/11/86/940861186.db2.gz MKCITSHLYIWAHN-UZUQRXQVSA-N 0 3 401.510 4.013 20 0 HIADHN C[C@](O)(C1CCN(CCC(=O)Nc2c(Cl)cccc2Cl)CC1)C(F)(F)F ZINC000546637544 940863368 /nfs/dbraw/zinc/86/33/68/940863368.db2.gz SBONYMWKBSLZFN-INIZCTEOSA-N 0 3 413.267 4.347 20 0 HIADHN O=C(Nc1cccc(CN2CCOC3(CCOCC3)CC2)c1)c1ccccc1Cl ZINC000546717100 940872182 /nfs/dbraw/zinc/87/21/82/940872182.db2.gz PDBDSIZFUOVHIX-UHFFFAOYSA-N 0 3 414.933 4.364 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)NCc2nc3ccccc3n2C2CC2)C1 ZINC000546763161 940878437 /nfs/dbraw/zinc/87/84/37/940878437.db2.gz ZNPMGZYXGIPCCP-MJGOQNOKSA-N 0 3 403.530 4.006 20 0 HIADHN COC(=O)[C@@H](C)Cc1ccc(NC(=O)N(Cc2ccccc2)C2CCN(C)CC2)cc1 ZINC000546845511 940893933 /nfs/dbraw/zinc/89/39/33/940893933.db2.gz DSCMKIYILFPVOR-IBGZPJMESA-N 0 3 423.557 4.167 20 0 HIADHN COC(=O)COc1cccc(CN[C@H](Cc2cccnc2)c2ccc(Cl)cc2)c1 ZINC000546870625 940898887 /nfs/dbraw/zinc/89/88/87/940898887.db2.gz JVQPVMARAULFRT-JOCHJYFZSA-N 0 3 410.901 4.360 20 0 HIADHN CCN(C(=O)c1ccc(OC)c(-c2ccccn2)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000546889823 940902418 /nfs/dbraw/zinc/90/24/18/940902418.db2.gz SMMWHNBDACDIKF-QFIPXVFZSA-N 0 3 415.537 4.494 20 0 HIADHN CCN(C(=O)c1ccc(-c2nc(C3CC3)no2)cc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000546893099 940903830 /nfs/dbraw/zinc/90/38/30/940903830.db2.gz LOYNIVQHIHGNBX-JOCHJYFZSA-N 0 3 416.525 4.351 20 0 HIADHN CCN(C(=O)c1[nH]c(-c2cccc(OC)c2)nc1C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000546913894 940912031 /nfs/dbraw/zinc/91/20/31/940912031.db2.gz ORZLWVDRHZRYKP-NRFANRHFSA-N 0 3 418.541 4.130 20 0 HIADHN CCCc1c(NC(=O)N2CCN(C3CCCCC3)CC2)cnn1-c1cc(C)ccn1 ZINC000546929259 940916462 /nfs/dbraw/zinc/91/64/62/940916462.db2.gz ODBKNSPGKQNUSA-UHFFFAOYSA-N 0 3 410.566 4.010 20 0 HIADHN Clc1ccccc1-c1cc(-c2nc(-c3ccccc3CN3CCOCC3)no2)[nH]n1 ZINC000547006099 940953146 /nfs/dbraw/zinc/95/31/46/940953146.db2.gz MCSGTEHVRPBZIX-UHFFFAOYSA-N 0 3 421.888 4.279 20 0 HIADHN c1cnc(Oc2ccc(-c3noc([C@H]4CCCN(Cc5cccnc5)C4)n3)cc2)nc1 ZINC000547038285 940970040 /nfs/dbraw/zinc/97/00/40/940970040.db2.gz HHVYQTKFODVZRB-IBGZPJMESA-N 0 3 414.469 4.094 20 0 HIADHN CN(Cc1ccccc1)Cc1cccc(-c2nc(Cc3cccc(C(N)=O)c3)no2)c1 ZINC000547055921 940976896 /nfs/dbraw/zinc/97/68/96/940976896.db2.gz AACYFRHKKLGSMW-UHFFFAOYSA-N 0 3 412.493 4.058 20 0 HIADHN CCN(CC)CCN(Cc1cccs1)C(=O)Nc1ccccc1C[S@@](C)=O ZINC000547287832 941052565 /nfs/dbraw/zinc/05/25/65/941052565.db2.gz WDNQDVCAVNWDSG-HHHXNRCGSA-N 0 3 407.605 4.003 20 0 HIADHN CCN(C(=O)c1cnn(-c2ccccc2C)c1N)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000547388725 941059962 /nfs/dbraw/zinc/05/99/62/941059962.db2.gz BPGLRNPCUCXXQJ-TZIWHRDSSA-N 0 3 417.557 4.061 20 0 HIADHN CCN(C(=O)NCc1ncc(-c2ccccc2)o1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000547465599 941064246 /nfs/dbraw/zinc/06/42/46/941064246.db2.gz WHEMWCPCLLUBNT-OAQYLSRUSA-N 0 3 404.514 4.148 20 0 HIADHN COc1ccccc1OCCNCc1cnn(Cc2ccc(C(F)(F)F)cc2)c1 ZINC000547643848 941070053 /nfs/dbraw/zinc/07/00/53/941070053.db2.gz ZTZKIYHNCZIKPF-UHFFFAOYSA-N 0 3 405.420 4.127 20 0 HIADHN O=S1(=O)CCCN1c1ccc(CN[C@@H]2CCCc3ccc(Cl)cc32)cc1F ZINC000547832201 941077594 /nfs/dbraw/zinc/07/75/94/941077594.db2.gz LGWGBWZOUPKEAD-LJQANCHMSA-N 0 3 408.926 4.186 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1cc(=O)[nH]c(C(C)C)c1 ZINC000547864698 941079299 /nfs/dbraw/zinc/07/92/99/941079299.db2.gz PXVUVIMUPOYUEN-FQEVSTJZSA-N 0 3 419.529 4.115 20 0 HIADHN CCCN(Cc1ccc(C(=O)OC)cc1F)C1CCN(C(=O)c2ccccc2)CC1 ZINC000548095587 941086743 /nfs/dbraw/zinc/08/67/43/941086743.db2.gz IWVIWDGBGLUAFQ-UHFFFAOYSA-N 0 3 412.505 4.129 20 0 HIADHN COc1cccc([C@H](CNC(=O)N[C@@H](C(C)(C)C)C(F)(F)F)N2CCCC2)c1 ZINC000548181043 941091085 /nfs/dbraw/zinc/09/10/85/941091085.db2.gz MUPYJISAJBTCIF-IRXDYDNUSA-N 0 3 401.473 4.108 20 0 HIADHN O=C(Nc1c[nH]nc1[C@@H]1CCCN(C[C@H]2CCC3(CCCC3)O2)C1)c1ccccc1 ZINC000548916771 941128985 /nfs/dbraw/zinc/12/89/85/941128985.db2.gz MRTQRQPEWLBDLM-WOJBJXKFSA-N 0 3 408.546 4.333 20 0 HIADHN COc1cc(NC(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)c(OC)cc1Cl ZINC000548947416 941132269 /nfs/dbraw/zinc/13/22/69/941132269.db2.gz YTCHCDRNSKMPNA-MRXNPFEDSA-N 0 3 412.317 4.435 20 0 HIADHN CCc1nc2cc(CNC(=O)N[C@H]3CCN(C)[C@@H]3c3ccccc3)ccc2n1C1CC1 ZINC000548969941 941135823 /nfs/dbraw/zinc/13/58/23/941135823.db2.gz LZVAVXFETCKKOD-GBXCKJPGSA-N 0 3 417.557 4.178 20 0 HIADHN CCc1nc2cc(CNC(=O)N[C@@H]3CCN(C)[C@@H]3c3ccccc3)ccc2n1C1CC1 ZINC000548969942 941135937 /nfs/dbraw/zinc/13/59/37/941135937.db2.gz LZVAVXFETCKKOD-HYBUGGRVSA-N 0 3 417.557 4.178 20 0 HIADHN Cc1nc2c(cccc2C(=O)N2CCN(C(c3ccccc3)c3ccccc3)CC2)[nH]1 ZINC000549026415 941145268 /nfs/dbraw/zinc/14/52/68/941145268.db2.gz BJRKNDISMBLUIU-UHFFFAOYSA-N 0 3 410.521 4.419 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1cc(F)c(C(=O)OC)c(F)c1)c1ccsc1 ZINC000549046452 941148304 /nfs/dbraw/zinc/14/83/04/941148304.db2.gz FDDZRNCWRFTDDJ-INIZCTEOSA-N 0 3 411.474 4.018 20 0 HIADHN CN(C)C[C@H](NC(=O)NCc1cc(Br)cs1)c1ccc(Cl)cc1 ZINC000549081226 941154140 /nfs/dbraw/zinc/15/41/40/941154140.db2.gz MCPMUKMTQAGLTH-HNNXBMFYSA-N 0 3 416.772 4.266 20 0 HIADHN CN(C)C[C@@H](NC(=O)NCc1cc(Br)cs1)c1ccc(Cl)cc1 ZINC000549081227 941154342 /nfs/dbraw/zinc/15/43/42/941154342.db2.gz MCPMUKMTQAGLTH-OAHLLOKOSA-N 0 3 416.772 4.266 20 0 HIADHN COc1cccc([C@H]2[C@H](NCC(=O)Nc3ccc(Cl)cc3C)CCN2C2CC2)c1 ZINC000549111515 941160747 /nfs/dbraw/zinc/16/07/47/941160747.db2.gz CNAPBTQITVLGEF-GGAORHGYSA-N 0 3 413.949 4.163 20 0 HIADHN Cc1ccc(-c2cncc(F)c2)cc1NC(=O)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000549145526 941165135 /nfs/dbraw/zinc/16/51/35/941165135.db2.gz ZCHLVRFTYYOSFY-FQEVSTJZSA-N 0 3 404.489 4.442 20 0 HIADHN CC[C@H](C)C(=O)Nc1cccc(CNC[C@H](O)CO[C@@H]2CCCc3ccccc32)c1 ZINC000549159588 941167100 /nfs/dbraw/zinc/16/71/00/941167100.db2.gz YWDLRMONGRRXQU-JKFKMHIGSA-N 0 3 410.558 4.216 20 0 HIADHN CN(C)C[C@@H](NC(=O)NCc1sccc1Br)c1ccc(Cl)cc1 ZINC000549175574 941168448 /nfs/dbraw/zinc/16/84/48/941168448.db2.gz HVZLNYMDVVLJPQ-CQSZACIVSA-N 0 3 416.772 4.266 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@H](N[C@@H](Cc2nc(C)no2)c2ccccc2)c2ccccc21 ZINC000549236913 941172919 /nfs/dbraw/zinc/17/29/19/941172919.db2.gz HSYILWCHZSGBAG-FSSWDIPSSA-N 0 3 405.498 4.433 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)Nc1ncc(C(F)(F)F)s1 ZINC000549272153 941175852 /nfs/dbraw/zinc/17/58/52/941175852.db2.gz AMPPDGLFDSIVRZ-UHFFFAOYSA-N 0 3 406.861 4.411 20 0 HIADHN CN(C)C[C@H](NC(=O)Nc1ccc2nnc(C3CCC3)n2c1)c1ccc(Cl)cc1 ZINC000549282119 941176680 /nfs/dbraw/zinc/17/66/80/941176680.db2.gz OCUQSOLBZVTGRH-SFHVURJKSA-N 0 3 412.925 4.075 20 0 HIADHN CN(C(=O)Nc1ccc2nnc(C3CCC3)n2c1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000549287667 941177097 /nfs/dbraw/zinc/17/70/97/941177097.db2.gz LAPHNENCMOABJA-OAQYLSRUSA-N 0 3 418.545 4.125 20 0 HIADHN Cc1ccc(CN2CCCN(C(=O)CCc3ccccc3)CC2)c(-c2cnn(C)c2)c1 ZINC000549403703 941186649 /nfs/dbraw/zinc/18/66/49/941186649.db2.gz NCPIMXUDTFOLNN-UHFFFAOYSA-N 0 3 416.569 4.063 20 0 HIADHN CCN1CC[C@H](NCC(=O)Nc2c(C)cccc2C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000549470499 941193389 /nfs/dbraw/zinc/19/33/89/941193389.db2.gz CURJURQURTWINQ-SIKLNZKXSA-N 0 3 403.929 4.460 20 0 HIADHN CCn1c(CN[C@@H]2CCN(C3CC3)[C@@H]2c2cccc(OC)c2)nc2c1cccc2F ZINC000549475376 941194149 /nfs/dbraw/zinc/19/41/49/941194149.db2.gz DFTKVHVGFBZCON-HYBUGGRVSA-N 0 3 408.521 4.272 20 0 HIADHN Cc1cc(NC(=O)[C@H](C)N[C@@H]2CCN(C(C)(C)C)[C@H]2c2ccc(Cl)c(F)c2)on1 ZINC000549476045 941194370 /nfs/dbraw/zinc/19/43/70/941194370.db2.gz BWQKSSSDHBLJNE-IRWQIABSSA-N 0 3 422.932 4.306 20 0 HIADHN COc1cccc([C@H]2[C@H](NCC(=O)Nc3ccccc3C(C)(C)C)CCN2C2CC2)c1 ZINC000549476952 941194626 /nfs/dbraw/zinc/19/46/26/941194626.db2.gz HEWGHNWQSHDKAO-NOZRDPDXSA-N 0 3 421.585 4.499 20 0 HIADHN CCN1CC[C@@H](NCc2cc(F)cc3c2OCOC3)[C@H]1c1ccc(Cl)c(F)c1 ZINC000549478599 941194854 /nfs/dbraw/zinc/19/48/54/941194854.db2.gz XGKNIAUBPUGTMU-WOJBJXKFSA-N 0 3 408.876 4.410 20 0 HIADHN CN(C)C[C@H](NC(=O)NC[C@H]1CCCO[C@H]1c1ccccc1)c1ccc(Cl)cc1 ZINC000549480507 941195003 /nfs/dbraw/zinc/19/50/03/941195003.db2.gz BEYWTXNYYCTYQC-HJNYFJLDSA-N 0 3 415.965 4.410 20 0 HIADHN COc1cc(OC)cc(C2(F)CCN(CCc3nc(-c4ccccc4)no3)CC2)c1 ZINC000549481596 941195097 /nfs/dbraw/zinc/19/50/97/941195097.db2.gz IIJOXWIOKHJFQN-UHFFFAOYSA-N 0 3 411.477 4.257 20 0 HIADHN CCc1nc2cc(CNC(=O)c3cccc(CN4CCCC4)c3)ccc2n1C1CC1 ZINC000549534574 941198430 /nfs/dbraw/zinc/19/84/30/941198430.db2.gz QLAFQAXLNSQYGW-UHFFFAOYSA-N 0 3 402.542 4.459 20 0 HIADHN COc1c2ccccc2oc1CNC(=O)N[C@@H](CN(C)C)c1ccc(Cl)cc1 ZINC000549575526 941200091 /nfs/dbraw/zinc/20/00/91/941200091.db2.gz ADKZXRSIHBBBPH-KRWDZBQOSA-N 0 3 401.894 4.197 20 0 HIADHN CN(C)C[C@H](NC(=O)Cn1c2ccccc2nc1C(F)(F)F)c1ccc(Cl)cc1 ZINC000549615344 941201407 /nfs/dbraw/zinc/20/14/07/941201407.db2.gz DEQSRLNSRZNOKC-INIZCTEOSA-N 0 3 424.854 4.128 20 0 HIADHN COc1cc2c(cc1F)CC[C@@H]2NC(=O)N[C@H](CN(C)C)c1ccc(Cl)cc1 ZINC000549624070 941201794 /nfs/dbraw/zinc/20/17/94/941201794.db2.gz FDIOULUTMLDAMP-RBUKOAKNSA-N 0 3 405.901 4.077 20 0 HIADHN COc1ccc(F)c(CN[C@H]2CCN(c3ncc(C(F)(F)F)cc3Cl)C2)c1 ZINC000549780893 941207301 /nfs/dbraw/zinc/20/73/01/941207301.db2.gz WLSIZRJHWVBWJH-ZDUSSCGKSA-N 0 3 403.807 4.270 20 0 HIADHN C[C@@H]1C[C@@H](NS(=O)(=O)Cc2ccc(C(F)F)cc2)CCN1Cc1ccccc1 ZINC000549782414 941207330 /nfs/dbraw/zinc/20/73/30/941207330.db2.gz PUQTXQISFXMMQI-UZLBHIALSA-N 0 3 408.514 4.097 20 0 HIADHN CCc1nc2cc(CNCc3ccc(O[C@@H](C)C(=O)OC)cc3)ccc2n1C1CC1 ZINC000549809358 941208008 /nfs/dbraw/zinc/20/80/08/941208008.db2.gz OHJKPLLSBRCTJB-INIZCTEOSA-N 0 3 407.514 4.164 20 0 HIADHN CCOc1cc(CNCc2cccc(N3CCOCC3)c2)ccc1OCC(F)(F)F ZINC000549827544 941208737 /nfs/dbraw/zinc/20/87/37/941208737.db2.gz AQNIYUZAKLZRSF-UHFFFAOYSA-N 0 3 424.463 4.153 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)CNC(C)(C)c2ccccc2C)c(C(F)(F)F)c1 ZINC000549869602 941220887 /nfs/dbraw/zinc/22/08/87/941220887.db2.gz UFMWCBXCZHGYSL-UHFFFAOYSA-N 0 3 407.436 4.436 20 0 HIADHN C[C@@H](c1ccc(F)cc1)N1CCC[C@@H](NCc2ccc(-c3cnn(C)c3)s2)C1=O ZINC000549907509 941235471 /nfs/dbraw/zinc/23/54/71/941235471.db2.gz LXFXLZPUTKMRBT-MGPUTAFESA-N 0 3 412.534 4.130 20 0 HIADHN CCN(C(=O)c1ccc2c(c1)NC(=O)C2(C)C)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000549931227 941241599 /nfs/dbraw/zinc/24/15/99/941241599.db2.gz HYPCJTYAPBFYCY-YLJYHZDGSA-N 0 3 405.542 4.214 20 0 HIADHN COCCc1ccc(OC[C@@H](O)CN2CCC([C@H](F)c3ccccc3F)CC2)cc1 ZINC000550097814 941284066 /nfs/dbraw/zinc/28/40/66/941284066.db2.gz VERXMWOWVQXYFK-RDPSFJRHSA-N 0 3 419.512 4.177 20 0 HIADHN C[C@H](Cc1ccc(Cl)cc1)C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000550121836 941287152 /nfs/dbraw/zinc/28/71/52/941287152.db2.gz DZXGZDQOPMQXNG-QGZVFWFLSA-N 0 3 418.940 4.317 20 0 HIADHN Cc1nn(Cc2ccc(Cl)cc2)c(C)c1CNCc1cccc(N2CCOCC2)c1 ZINC000550227578 941301717 /nfs/dbraw/zinc/30/17/17/941301717.db2.gz UCDMXQAYJNGZIA-UHFFFAOYSA-N 0 3 424.976 4.328 20 0 HIADHN CCc1cnc(CNC2(Cc3ccc(F)cc3Br)CCOCC2)s1 ZINC000550240223 941302822 /nfs/dbraw/zinc/30/28/22/941302822.db2.gz QNBPEWRSQJAOEF-UHFFFAOYSA-N 0 3 413.356 4.489 20 0 HIADHN C[C@H]1CN(c2ccccc2CNCc2ccc(COCC(F)(F)F)cc2)CCO1 ZINC000550751334 941363136 /nfs/dbraw/zinc/36/31/36/941363136.db2.gz WTZJZLBRFHPYGU-KRWDZBQOSA-N 0 3 408.464 4.280 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)N[C@@H]1CCc2ccccc2C1 ZINC000550805594 941369008 /nfs/dbraw/zinc/36/90/08/941369008.db2.gz DOFJRCXSIUFKSY-OAQYLSRUSA-N 0 3 419.491 4.336 20 0 HIADHN CS(=O)(=O)C[C@@H](NC[C@@H](OCc1ccccc1)c1ccc(Cl)cc1)C1CC1 ZINC000550822174 941371380 /nfs/dbraw/zinc/37/13/80/941371380.db2.gz FNZOFPJNWBTYIM-NHCUHLMSSA-N 0 3 407.963 4.011 20 0 HIADHN Fc1cc(Br)cc2c1CC[C@@H]2NCc1cccc(N2CCOCC2)c1 ZINC000550857695 941375110 /nfs/dbraw/zinc/37/51/10/941375110.db2.gz WHSVCJFVRPDUKV-FQEVSTJZSA-N 0 3 405.311 4.202 20 0 HIADHN OC[C@H](N[C@H]1COc2ccccc2C1)c1ccc(Br)cc1C(F)(F)F ZINC000551174481 941422125 /nfs/dbraw/zinc/42/21/25/941422125.db2.gz COACREDBHZETLJ-CJNGLKHVSA-N 0 3 416.237 4.095 20 0 HIADHN OC[C@H](N[C@@H]1COc2ccccc2C1)c1ccc(Br)cc1C(F)(F)F ZINC000551174476 941422142 /nfs/dbraw/zinc/42/21/42/941422142.db2.gz COACREDBHZETLJ-BBRMVZONSA-N 0 3 416.237 4.095 20 0 HIADHN COCC1(CCN[C@@H](c2cccc(S(C)(=O)=O)c2)c2ccc(F)c(F)c2)CCC1 ZINC000551246328 941435198 /nfs/dbraw/zinc/43/51/98/941435198.db2.gz NJPDJSOKUJBTMO-NRFANRHFSA-N 0 3 423.525 4.254 20 0 HIADHN CCCOc1ccccc1Oc1ncccc1CN[C@H]1CCC[C@H](S(C)(=O)=O)C1 ZINC000551266101 941439463 /nfs/dbraw/zinc/43/94/63/941439463.db2.gz VZLRBCAPMIYZBZ-OALUTQOASA-N 0 3 418.559 4.108 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](NC[C@H](CO)C2CCCCC2)c2ccc(F)cc2)c1 ZINC000551272929 941441088 /nfs/dbraw/zinc/44/10/88/941441088.db2.gz RLVVSFPXPNJPTC-OFNKIYASSA-N 0 3 419.562 4.097 20 0 HIADHN C[C@H](c1ccc(F)cc1)N1CCC[C@@H](N[C@@H](C)c2ccc3c(c2)CCC(=O)N3)C1=O ZINC000551274579 941441482 /nfs/dbraw/zinc/44/14/82/941441482.db2.gz SHZANMXUWMJAQF-WJONJSRFSA-N 0 3 409.505 4.113 20 0 HIADHN CNC(=O)COc1cccc(CN[C@@H]2CCc3c2cc(Br)cc3Cl)c1 ZINC000551342626 941457335 /nfs/dbraw/zinc/45/73/35/941457335.db2.gz PPTKIGBLJQUNGF-GOSISDBHSA-N 0 3 423.738 4.004 20 0 HIADHN Fc1ccc([C@@H](NC[C@@H]2CN(Cc3ccccc3)CCCO2)c2ccccn2)cc1 ZINC000551393224 941468531 /nfs/dbraw/zinc/46/85/31/941468531.db2.gz AGJLUXOERZGPBN-ILBGXUMGSA-N 0 3 405.517 4.191 20 0 HIADHN CCc1ccc(-c2noc([C@H](C)NC[C@@H]3CN(Cc4ccccc4)CCCO3)n2)cc1 ZINC000551394864 941468930 /nfs/dbraw/zinc/46/89/30/941468930.db2.gz IDGOENUPXZEDCW-WMZHIEFXSA-N 0 3 420.557 4.241 20 0 HIADHN Cc1ccc([C@@H](NC[C@@H]2CN(Cc3ccccc3)CCCO2)c2ccccn2)cc1 ZINC000551448650 941481175 /nfs/dbraw/zinc/48/11/75/941481175.db2.gz WOIOEVBFXJSMCP-AOYPEHQESA-N 0 3 401.554 4.360 20 0 HIADHN CC[C@H](N[C@H](C)c1cnc(OC)c(Cl)c1)[C@H]1CN(Cc2ccccc2)CCO1 ZINC000551533697 941496465 /nfs/dbraw/zinc/49/64/65/941496465.db2.gz NBALLTAVYLZHRO-TYCQWZJGSA-N 0 3 403.954 4.074 20 0 HIADHN COc1ncc([C@@H](C)N[C@@H](C)CC(=O)Nc2cccc(N3CCCC3)c2)cc1Cl ZINC000551534797 941497123 /nfs/dbraw/zinc/49/71/23/941497123.db2.gz QXYBUQFNPRTHDX-JKSUJKDBSA-N 0 3 416.953 4.412 20 0 HIADHN c1csc(CN(Cc2cnc(N3CCOCC3)s2)C2Cc3ccccc3C2)c1 ZINC000551566238 941503121 /nfs/dbraw/zinc/50/31/21/941503121.db2.gz ZVORCZWOQUHKRP-UHFFFAOYSA-N 0 3 411.596 4.211 20 0 HIADHN CCCCOc1ccc([C@H](C)NCc2cccc(N3CCCS3(=O)=O)c2)cc1 ZINC000551779329 941543890 /nfs/dbraw/zinc/54/38/90/941543890.db2.gz ZEAHTZARYAOAHP-SFHVURJKSA-N 0 3 402.560 4.256 20 0 HIADHN CCOC(=O)c1oc2c(c1C)[C@@H](N[C@H](CN(C)C)c1ccc(OC)cc1)CCC2 ZINC000551804434 941548034 /nfs/dbraw/zinc/54/80/34/941548034.db2.gz ZSGIOOBJEINIEB-RBUKOAKNSA-N 0 3 400.519 4.043 20 0 HIADHN COC(=O)[C@H](C)Oc1ccc(CN[C@@H](c2cncc(Br)c2)C2CC2)cc1 ZINC000551811839 941550090 /nfs/dbraw/zinc/55/00/90/941550090.db2.gz HYVMANMLGRDJCN-ORAYPTAESA-N 0 3 419.319 4.025 20 0 HIADHN COC(=O)[C@H](C)Oc1ccc(CN[C@H](c2cncc(Br)c2)C2CC2)cc1 ZINC000551811838 941550453 /nfs/dbraw/zinc/55/04/53/941550453.db2.gz HYVMANMLGRDJCN-DJJJIMSYSA-N 0 3 419.319 4.025 20 0 HIADHN CC1(C)Cc2c(cccc2Br)[C@@H]1NCc1ccc2c(c1)NC(=O)CO2 ZINC000552051778 941574232 /nfs/dbraw/zinc/57/42/32/941574232.db2.gz GINIISCAIIXTRH-IBGZPJMESA-N 0 3 401.304 4.193 20 0 HIADHN COc1cc(CN2CCC(O[C@@H]3CCOC3)CC2)ccc1OCc1cccs1 ZINC000552080242 941581230 /nfs/dbraw/zinc/58/12/30/941581230.db2.gz XMSSCALUQIIYTF-LJQANCHMSA-N 0 3 403.544 4.106 20 0 HIADHN CNC(=O)COc1cccc(CN[C@H](C)c2ccc(-c3ccccc3OC)cc2)c1 ZINC000552089621 941583171 /nfs/dbraw/zinc/58/31/71/941583171.db2.gz PVWRWXHJVRZPTR-GOSISDBHSA-N 0 3 404.510 4.338 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@@H](C)N[C@H](C)c2ccc3n[nH]cc3c2)cc1 ZINC000552098606 941584694 /nfs/dbraw/zinc/58/46/94/941584694.db2.gz JOLLKKGOWCJXCR-HZPDHXFCSA-N 0 3 400.548 4.005 20 0 HIADHN COc1cccc(NC(=O)C[C@H](C)N[C@H](CCO)c2ccc(Cl)c(Cl)c2)c1 ZINC000552100724 941585123 /nfs/dbraw/zinc/58/51/23/941585123.db2.gz SLVIKSRNRVMRJY-ORAYPTAESA-N 0 3 411.329 4.432 20 0 HIADHN CN(CCCN(C)C(=O)[C@@H]1C[C@@H]1c1cccc(C(F)(F)F)c1)Cc1ccncc1 ZINC000552112638 941587355 /nfs/dbraw/zinc/58/73/55/941587355.db2.gz NJFZCHORQCMQSM-WOJBJXKFSA-N 0 3 405.464 4.184 20 0 HIADHN O=C(c1ccnc(OCc2ccccc2)c1)N1CCN(c2ccnc3ccccc32)CC1 ZINC000552147547 941593847 /nfs/dbraw/zinc/59/38/47/941593847.db2.gz MLIZRYUJKNOZGS-UHFFFAOYSA-N 0 3 424.504 4.171 20 0 HIADHN Cc1ccc(OCc2ccc(C(=O)Nc3cccc(CN4CC[C@H](O)C4)c3)o2)c(C)c1 ZINC000552199645 941600521 /nfs/dbraw/zinc/60/05/21/941600521.db2.gz CBHFYSDEVDYQTD-NRFANRHFSA-N 0 3 420.509 4.294 20 0 HIADHN COCc1c(C(=O)Nc2cccc(CN3CC[C@@H](O)C3)c2)sc2cccc(F)c21 ZINC000552199391 941600604 /nfs/dbraw/zinc/60/06/04/941600604.db2.gz WPXVJDAIHYWXEI-MRXNPFEDSA-N 0 3 414.502 4.006 20 0 HIADHN CS(=O)(=O)Cc1ccccc1CN[C@H](c1cccc(OC(F)(F)F)c1)C1CC1 ZINC000552246424 941613315 /nfs/dbraw/zinc/61/33/15/941613315.db2.gz UINOFURQLBRPQM-IBGZPJMESA-N 0 3 413.461 4.371 20 0 HIADHN C[C@@H](N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1)c1ccccc1-n1ccnn1 ZINC000552249817 941613947 /nfs/dbraw/zinc/61/39/47/941613947.db2.gz LJJRCVSOKHWQSB-XXBNENTESA-N 0 3 411.509 4.168 20 0 HIADHN CCOc1cc(CNCc2ccc(C(=O)N3CCCCC3)cc2)cc(Cl)c1O ZINC000552292088 941623958 /nfs/dbraw/zinc/62/39/58/941623958.db2.gz SJLRSCACPMCRDK-UHFFFAOYSA-N 0 3 402.922 4.360 20 0 HIADHN Cc1c([C@@H](C)NCCCc2cccc(C)n2)nnn1-c1cccc(Br)c1 ZINC000552323808 941632036 /nfs/dbraw/zinc/63/20/36/941632036.db2.gz SEYNKUZZWLCYBD-OAHLLOKOSA-N 0 3 414.351 4.325 20 0 HIADHN Cc1cc(I)cc(N[C@H]2CCN(Cc3ccccn3)C[C@@H]2C)c1 ZINC000552335341 941635040 /nfs/dbraw/zinc/63/50/40/941635040.db2.gz PAIHAQXSLMSNRH-KXBFYZLASA-N 0 3 421.326 4.317 20 0 HIADHN C[C@H](N[C@H]1CCC(C)(C)c2ccc(Br)cc21)C1(S(C)(=O)=O)CC1 ZINC000552341148 941638014 /nfs/dbraw/zinc/63/80/14/941638014.db2.gz GRMPOVYUFKRWIW-LRDDRELGSA-N 0 3 400.382 4.117 20 0 HIADHN CC(C)[C@@H](CNC(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F)c1cccnc1 ZINC000552341546 941638218 /nfs/dbraw/zinc/63/82/18/941638218.db2.gz MZFXLIZSJQSVCP-NHCUHLMSSA-N 0 3 401.501 4.095 20 0 HIADHN C[C@@H]1CSc2ccc(Br)cc2[C@H]1NCC1(S(C)(=O)=O)CCCC1 ZINC000552338647 941638231 /nfs/dbraw/zinc/63/82/31/941638231.db2.gz LAWKOKPWSYDCPC-WBMJQRKESA-N 0 3 418.422 4.179 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3ccccc3N3CCCCC3)CC2)C[C@H](C)O1 ZINC000552342004 941639170 /nfs/dbraw/zinc/63/91/70/941639170.db2.gz BQWDTMNBWCPVNQ-OYRHEFFESA-N 0 3 413.606 4.028 20 0 HIADHN O=C([C@@H]1CN(Cc2ccccc2)CCC1(F)F)N1CCC(Cc2cccnc2)CC1 ZINC000552410179 941661658 /nfs/dbraw/zinc/66/16/58/941661658.db2.gz MPPNPLGEXLHHPQ-QFIPXVFZSA-N 0 3 413.512 4.020 20 0 HIADHN CC(=O)c1ccccc1NC(=O)CCCN1CCC[C@@H]1c1ccc2c(c1)OCCO2 ZINC000552461675 941677221 /nfs/dbraw/zinc/67/72/21/941677221.db2.gz XADRWZWUYOIPCC-OAQYLSRUSA-N 0 3 408.498 4.216 20 0 HIADHN Cc1cccc2c1OCC[C@H]2NC(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000552494555 941688670 /nfs/dbraw/zinc/68/86/70/941688670.db2.gz VMQPWOLPNTXGPV-WOJBJXKFSA-N 0 3 400.469 4.092 20 0 HIADHN c1cn(-c2ccccc2)nc1CNC1CCN(Cc2coc(-c3ccccc3)n2)CC1 ZINC000552604459 941719391 /nfs/dbraw/zinc/71/93/91/941719391.db2.gz IOPBARMTZWACOL-UHFFFAOYSA-N 0 3 413.525 4.282 20 0 HIADHN C[C@@H](CC(=O)c1ccccc1F)C(=O)N1CC[C@@]2(CCN(Cc3ccccc3)C2)C1 ZINC000552678989 941735905 /nfs/dbraw/zinc/73/59/05/941735905.db2.gz LSUGHNZWNNGNRK-UQBPGWFLSA-N 0 3 408.517 4.159 20 0 HIADHN COc1ccc(C(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)c(C)c1OC ZINC000552725824 941746346 /nfs/dbraw/zinc/74/63/46/941746346.db2.gz INETZDRTZHDAIZ-GOSISDBHSA-N 0 3 402.560 4.277 20 0 HIADHN CN(CCCC(=O)c1ccc(Br)cc1)Cc1ccc2c(c1)OCCO2 ZINC000552776821 941759192 /nfs/dbraw/zinc/75/91/92/941759192.db2.gz PSCOOCIVANJXBR-UHFFFAOYSA-N 0 3 404.304 4.315 20 0 HIADHN COc1ccc(C(=O)N(Cc2ccncc2)[C@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000552849947 941787221 /nfs/dbraw/zinc/78/72/21/941787221.db2.gz GLVNDDGSXNQLNA-DEOSSOPVSA-N 0 3 415.537 4.397 20 0 HIADHN Cc1nn(-c2ccccc2)cc1CCCN[C@H](C)c1nnn(-c2ccc(F)cc2)c1C ZINC000552879933 941797426 /nfs/dbraw/zinc/79/74/26/941797426.db2.gz KUHZLUIGUHTHFG-GOSISDBHSA-N 0 3 418.520 4.492 20 0 HIADHN CS(=O)(=O)CCCN[C@H](Cc1cccc(F)c1)c1ccc(Cl)c(Cl)c1 ZINC000552904867 941800670 /nfs/dbraw/zinc/80/06/70/941800670.db2.gz ZQNXUYWUNCQIBJ-GOSISDBHSA-N 0 3 404.334 4.441 20 0 HIADHN CNC(=O)c1ccc(CN[C@@H](CCCOC)c2ccc(Br)cc2)cc1 ZINC000552918383 941802685 /nfs/dbraw/zinc/80/26/85/941802685.db2.gz KKSNWQQNWCPKRH-IBGZPJMESA-N 0 3 405.336 4.066 20 0 HIADHN O=C(Nc1ccnc(N2CCc3ccccc3C2)c1)c1cccc(CN2CCCC2)c1 ZINC000552921126 941803105 /nfs/dbraw/zinc/80/31/05/941803105.db2.gz DWOJNZTXWNIOGU-UHFFFAOYSA-N 0 3 412.537 4.492 20 0 HIADHN CCCN(C)[C@H](CNC(=O)c1ccncc1Br)c1ccc(Cl)cc1 ZINC000553027239 941819733 /nfs/dbraw/zinc/81/97/33/941819733.db2.gz SBJBMQVZDVBKLT-QGZVFWFLSA-N 0 3 410.743 4.310 20 0 HIADHN COc1ccc(C(=O)C[C@@H](C)C(=O)N2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)cc1 ZINC000553176119 941845194 /nfs/dbraw/zinc/84/51/94/941845194.db2.gz RPWFNZXMXPRNBY-FQRUVTKNSA-N 0 3 420.553 4.029 20 0 HIADHN O=C(NC[C@H](NCc1ccccc1)c1ccco1)c1ccc(Nc2ccncc2)cc1 ZINC000553214514 941850397 /nfs/dbraw/zinc/85/03/97/941850397.db2.gz CXAQIRPQBFFJIH-QHCPKHFHSA-N 0 3 412.493 4.101 20 0 HIADHN COc1ccccc1O[C@H]1CCCN(C(=O)c2oc3ccccc3c2CN(C)C)C1 ZINC000553223206 941852233 /nfs/dbraw/zinc/85/22/33/941852233.db2.gz WSNVVJLKQJKROU-KRWDZBQOSA-N 0 3 408.498 4.187 20 0 HIADHN C[C@@H](NCc1ccc(I)cc1)c1ccc2c(c1)CCC(=O)N2 ZINC000553242174 941855652 /nfs/dbraw/zinc/85/56/52/941855652.db2.gz KYPMQJZUJNGGGW-GFCCVEGCSA-N 0 3 406.267 4.027 20 0 HIADHN COc1cc(C)c([C@@H](C)NC(=O)CN[C@@H](c2ccc(F)c(C)c2)C2CC2)cc1OC ZINC000553283705 941860336 /nfs/dbraw/zinc/86/03/36/941860336.db2.gz FCSLYIWANXOIAW-VOIUYBSRSA-N 0 3 414.521 4.378 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)NCC(=O)Nc2ccc(C(F)(F)F)cc2)cc1 ZINC000553427556 941882725 /nfs/dbraw/zinc/88/27/25/941882725.db2.gz DROUOTHZKXKYQX-AWEZNQCLSA-N 0 3 402.420 4.489 20 0 HIADHN C[C@@H]1CN(C(=O)c2ccc(NC(=O)Nc3ccccc3)s2)CCN(C2CCC2)C1 ZINC000553517947 941901333 /nfs/dbraw/zinc/90/13/33/941901333.db2.gz FPGHJSMPVZWBGO-INIZCTEOSA-N 0 3 412.559 4.339 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)c2cnc3onc(C(C)C)c3c2)N(C)C)cc1 ZINC000553673183 941941979 /nfs/dbraw/zinc/94/19/79/941941979.db2.gz JUDOTSHXJWBRGK-FQEVSTJZSA-N 0 3 410.518 4.166 20 0 HIADHN CC[C@H](NC(=O)N[C@H](CN1CCCC1)c1ccccc1)c1ccc(OC)c(OC)c1 ZINC000553734418 941954974 /nfs/dbraw/zinc/95/49/74/941954974.db2.gz YFTHGOXWDLFULO-LEWJYISDSA-N 0 3 411.546 4.291 20 0 HIADHN C[C@@H]1C[C@@H]1N1CCN(C(=O)c2cc(NC(=O)NC(C)(C)C)ccc2Cl)C[C@@H](C)C1 ZINC000553767779 941963084 /nfs/dbraw/zinc/96/30/84/941963084.db2.gz JYARFPZWTDGSRN-KHYOSLBOSA-N 0 3 420.985 4.062 20 0 HIADHN Cc1cccc(C(=O)Nc2ccccc2C(=O)N2CCN([C@@H]3C[C@H]3C)C[C@H](C)C2)c1 ZINC000553783182 941967812 /nfs/dbraw/zinc/96/78/12/941967812.db2.gz NVQYSWPJHNBPNE-YCRNBWNJSA-N 0 3 405.542 4.050 20 0 HIADHN FC(F)(F)c1cnc(OCCNCc2cnc(-c3ccncc3)s2)c(Cl)c1 ZINC000553850465 941983220 /nfs/dbraw/zinc/98/32/20/941983220.db2.gz ILCSYMDCMSKIFP-UHFFFAOYSA-N 0 3 414.840 4.441 20 0 HIADHN Cc1cc(C)c(CN2CCC[C@H](C(=O)NCC3CC3)C2)c(OCc2ccccc2)n1 ZINC000553864383 941986891 /nfs/dbraw/zinc/98/68/91/941986891.db2.gz XFCGPQNAXGJZFI-QFIPXVFZSA-N 0 3 407.558 4.016 20 0 HIADHN CCc1nc(C2CCN(Cc3c(C)cc(C)nc3OCc3ccccc3)CC2)n[nH]1 ZINC000553909245 941996209 /nfs/dbraw/zinc/99/62/09/941996209.db2.gz HNHBVCTWWCIZIY-UHFFFAOYSA-N 0 3 405.546 4.338 20 0 HIADHN CCc1n[nH]c(C2CCN(Cc3c(C)cc(C)nc3OCc3ccccc3)CC2)n1 ZINC000553909245 941996211 /nfs/dbraw/zinc/99/62/11/941996211.db2.gz HNHBVCTWWCIZIY-UHFFFAOYSA-N 0 3 405.546 4.338 20 0 HIADHN CN(Cc1ccc(OCC(F)(F)F)cc1)C(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000553990305 942014503 /nfs/dbraw/zinc/01/45/03/942014503.db2.gz XCQYAWMYJZMITF-UXHICEINSA-N 0 3 421.463 4.215 20 0 HIADHN Cc1nc(-c2c[nH]c(C(=O)NC[C@@H](c3ccc(OC(C)C)cc3)N(C)C)c2)cs1 ZINC000554016675 942019705 /nfs/dbraw/zinc/01/97/05/942019705.db2.gz JNVNYRNFFUVKEH-NRFANRHFSA-N 0 3 412.559 4.267 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)c2ccc(Br)s2)N(C)C)cc1 ZINC000554039495 942023287 /nfs/dbraw/zinc/02/32/87/942023287.db2.gz PTIGKFZZVJSAHD-HNNXBMFYSA-N 0 3 411.365 4.331 20 0 HIADHN C[C@@H]1CCc2c(sc3nc(CCN4CC[C@H](Nc5ccccc5)C4)nc(N)c23)C1 ZINC000554040791 942024121 /nfs/dbraw/zinc/02/41/21/942024121.db2.gz QFBWMQBQYGDTRS-WBVHZDCISA-N 0 3 407.587 4.127 20 0 HIADHN COc1cccc2cc([C@@H](C)N[C@@H]3CCCN(S(=O)(=O)c4cccs4)C3)oc21 ZINC000554085512 942033264 /nfs/dbraw/zinc/03/32/64/942033264.db2.gz KTRDXEKIWLEQRE-GDBMZVCRSA-N 0 3 420.556 4.007 20 0 HIADHN COc1cc(Br)ccc1[C@@H](C)N[C@@H](C)c1cccc(-n2ccnn2)c1 ZINC000554094211 942035100 /nfs/dbraw/zinc/03/51/00/942035100.db2.gz BEWNVJNVKOZYGT-UONOGXRCSA-N 0 3 401.308 4.450 20 0 HIADHN CCOc1ccc(Nc2ncccc2C(=O)N2CCN([C@@H]3C[C@H]3C)C[C@@H](C)C2)cc1 ZINC000554132506 942044819 /nfs/dbraw/zinc/04/48/19/942044819.db2.gz VCHYUDKKYOHMJC-JBYIUTFZSA-N 0 3 408.546 4.026 20 0 HIADHN C[C@H](NC(=O)Nc1cccc(OCc2cccnc2)c1)[C@H](c1ccccc1)N(C)C ZINC000554138128 942046823 /nfs/dbraw/zinc/04/68/23/942046823.db2.gz JNBWCPULSPOHNK-FDDCHVKYSA-N 0 3 404.514 4.474 20 0 HIADHN C[C@@H](NC(=O)Nc1cccc(OCc2cccnc2)c1)[C@@H](c1ccccc1)N(C)C ZINC000554138129 942047104 /nfs/dbraw/zinc/04/71/04/942047104.db2.gz JNBWCPULSPOHNK-JPYJTQIMSA-N 0 3 404.514 4.474 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)Nc1ccc(C(=O)NC2CCCC2)cc1)c1ccco1 ZINC000554147317 942050235 /nfs/dbraw/zinc/05/02/35/942050235.db2.gz VXQAZJRGMNXPBG-OXQOHEQNSA-N 0 3 412.534 4.203 20 0 HIADHN FC(F)(F)COc1ccc(CN2CCC[C@H](c3nc(-c4ccccc4)n[nH]3)C2)cn1 ZINC000554200079 942064534 /nfs/dbraw/zinc/06/45/34/942064534.db2.gz RFOOAHYFFBOAEX-KRWDZBQOSA-N 0 3 417.435 4.187 20 0 HIADHN CN(C)C[C@H](NC(=O)Nc1ccc(F)cc1OCC(F)(F)F)c1ccc(F)cc1 ZINC000554205536 942065930 /nfs/dbraw/zinc/06/59/30/942065930.db2.gz NURFHNDFQKREOQ-INIZCTEOSA-N 0 3 417.378 4.330 20 0 HIADHN CSC[C@@H]1CCCN(C(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)C1 ZINC000554278502 942088736 /nfs/dbraw/zinc/08/87/36/942088736.db2.gz IXMWSOVLIDPYLF-MJGOQNOKSA-N 0 3 400.510 4.043 20 0 HIADHN CC(C)Cc1ccc([C@@H](CNC(=O)Nc2ccc3c(c2)NC(=O)[C@@H](C)O3)N(C)C)cc1 ZINC000554366284 942115927 /nfs/dbraw/zinc/11/59/27/942115927.db2.gz ZNHPOCMEJKCJAN-IIBYNOLFSA-N 0 3 424.545 4.029 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1ccc(-n2nc(C)cc2C)c(F)c1)c1ccco1 ZINC000554409859 942131512 /nfs/dbraw/zinc/13/15/12/942131512.db2.gz UBBRAGYUZVPHQR-IFXJQAMLSA-N 0 3 413.497 4.472 20 0 HIADHN Cc1c(NC(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)cccc1C(=O)N1CCCC1 ZINC000554427970 942140260 /nfs/dbraw/zinc/14/02/60/942140260.db2.gz GEXMQGDKVZTTMB-XMSQKQJNSA-N 0 3 408.546 4.044 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)NCc1c(C)nn(-c2ccccc2)c1C)c1ccco1 ZINC000554476677 942156326 /nfs/dbraw/zinc/15/63/26/942156326.db2.gz YVBZWPNASXZWPG-IIBYNOLFSA-N 0 3 409.534 4.011 20 0 HIADHN O=C(Nc1ccc([C@@H]2CCOC2)cc1)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000554620427 942177765 /nfs/dbraw/zinc/17/77/65/942177765.db2.gz YPZJKLXOPTUZMP-TZIWHRDSSA-N 0 3 400.469 4.286 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)c1ccccc1OCc1c(C)noc1C)c1ccco1 ZINC000554633089 942180621 /nfs/dbraw/zinc/18/06/21/942180621.db2.gz SNLOHPZUNHBZOZ-FOIQADDNSA-N 0 3 411.502 4.323 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)c1ccccc1OCc1c(C)noc1C)c1ccco1 ZINC000554633092 942181132 /nfs/dbraw/zinc/18/11/32/942181132.db2.gz SNLOHPZUNHBZOZ-YWZLYKJASA-N 0 3 411.502 4.323 20 0 HIADHN CN(CCCN(C)C(=O)C(C)(C)c1cccc(C(F)(F)F)c1)Cc1ccncc1 ZINC000554696125 942202600 /nfs/dbraw/zinc/20/26/00/942202600.db2.gz UKFNELJASDVDMF-UHFFFAOYSA-N 0 3 407.480 4.359 20 0 HIADHN Cc1ccnc(Oc2ccc(NC(=O)N[C@H](C)CN(C)Cc3ccccc3)cc2)n1 ZINC000554755237 942223035 /nfs/dbraw/zinc/22/30/35/942223035.db2.gz JUDNEWOMYXXNSJ-GOSISDBHSA-N 0 3 405.502 4.219 20 0 HIADHN O=C(Nc1ccc(Cl)c(F)c1N1CCOCC1)c1cccc(CN2CCCC2)c1 ZINC000554834560 942272990 /nfs/dbraw/zinc/27/29/90/942272990.db2.gz ISIQYGWYYAMVEZ-UHFFFAOYSA-N 0 3 417.912 4.164 20 0 HIADHN COC(=O)c1cc(CN[C@H]2c3cc(Br)ccc3SC[C@H]2C)cn1C ZINC000554855277 942291536 /nfs/dbraw/zinc/29/15/36/942291536.db2.gz OIRAULHRCIFECZ-PIGZYNQJSA-N 0 3 409.349 4.147 20 0 HIADHN CCCOCc1ccccc1CNC(=O)N[C@@H](CN(C)C)c1ccc(Cl)cc1 ZINC000555075194 942377947 /nfs/dbraw/zinc/37/79/47/942377947.db2.gz PXWZENLDAGQRRX-NRFANRHFSA-N 0 3 403.954 4.369 20 0 HIADHN CCN1CC[C@H](NCC(=O)N(C)[C@@H](C)c2ccccc2)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000555129056 942395079 /nfs/dbraw/zinc/39/50/79/942395079.db2.gz JPXYUJDFRZPBOR-RWAHWCJQSA-N 0 3 419.491 4.048 20 0 HIADHN CCN1CC[C@H](NCC(=O)Nc2ccc(C(C)=O)cc2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000555131656 942396262 /nfs/dbraw/zinc/39/62/62/942396262.db2.gz OSNLLCOBFSMTEH-RBBKRZOGSA-N 0 3 417.912 4.045 20 0 HIADHN CCc1cccc(NC(=O)CN[C@H]2CCN(CC)[C@@H]2c2cc(F)c(F)c(F)c2)c1 ZINC000555132177 942396509 /nfs/dbraw/zinc/39/65/09/942396509.db2.gz IDCNMEQYDYZXJY-SIKLNZKXSA-N 0 3 405.464 4.030 20 0 HIADHN CCOc1ccccc1NC(=O)CN[C@@H]1CCN(C(C)C)[C@@H]1c1ccc(F)c(F)c1 ZINC000555132948 942397734 /nfs/dbraw/zinc/39/77/34/942397734.db2.gz LZWWQARZYZJTJP-NFBKMPQASA-N 0 3 417.500 4.116 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@@H](NCc2ccc(OCC(F)(F)F)nc2)c2ccccc21 ZINC000555165281 942412285 /nfs/dbraw/zinc/41/22/85/942412285.db2.gz PRNATXUNRYPAFG-QZTJIDSGSA-N 0 3 408.420 4.294 20 0 HIADHN CCN(C(=O)NCc1ccsc1Br)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000555198201 942428330 /nfs/dbraw/zinc/42/83/30/942428330.db2.gz NFVZMXFHBYSQQX-QGZVFWFLSA-N 0 3 422.392 4.317 20 0 HIADHN Fc1ccc(Cc2nnc(N3CC[C@@]4(CCN(Cc5ccccc5)C4)C3)s2)cc1 ZINC000555206518 942431717 /nfs/dbraw/zinc/43/17/17/942431717.db2.gz HUHFHCJHQCTRFA-HSZRJFAPSA-N 0 3 408.546 4.370 20 0 HIADHN C[C@@H](SCC(=O)N[C@@H](CN(C)C)c1ccc(Cl)cc1)c1nc2ccccc2[nH]1 ZINC000555229687 942437950 /nfs/dbraw/zinc/43/79/50/942437950.db2.gz DOCLMHLGBMXGAP-KUHUBIRLSA-N 0 3 416.978 4.430 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@H](N[C@@H](CC)CS(=O)(=O)c2ccccc2)c2ccccc21 ZINC000555233670 942439589 /nfs/dbraw/zinc/43/95/89/942439589.db2.gz YWAHPWLHSUWOEW-WTOYTKOKSA-N 0 3 415.555 4.010 20 0 HIADHN CCN(CC)[C@H](CNC(=O)C1CCC(OC[C@@H]2CCCO2)CC1)c1ccsc1 ZINC000555297972 942466195 /nfs/dbraw/zinc/46/61/95/942466195.db2.gz CBBWHZQSMUWHRA-NLDTVIPQSA-N 0 3 408.608 4.002 20 0 HIADHN COc1cc(OC)cc(C2(F)CCN(Cc3cn(-c4ccncc4)nc3C)CC2)c1 ZINC000555339512 942483940 /nfs/dbraw/zinc/48/39/40/942483940.db2.gz AMKIQXMHIBTYFW-UHFFFAOYSA-N 0 3 410.493 4.054 20 0 HIADHN COCCc1ccc(OC[C@H](O)CN2CC=C(c3ccc(Cl)cc3)CC2)cc1 ZINC000555417211 942522934 /nfs/dbraw/zinc/52/29/34/942522934.db2.gz AGNSEOXYLIWTQJ-JOCHJYFZSA-N 0 3 401.934 4.058 20 0 HIADHN Fc1ccccc1-c1nnc(N2CCN(C3CCCC3)CC2)n1Cc1cccs1 ZINC000555443160 942546840 /nfs/dbraw/zinc/54/68/40/942546840.db2.gz AJIYTQITZBHGFC-UHFFFAOYSA-N 0 3 411.550 4.259 20 0 HIADHN Cc1ccccc1CN1CCCN(C(=O)COc2ccc(Cl)c3cccnc23)CC1 ZINC000555462265 942563259 /nfs/dbraw/zinc/56/32/59/942563259.db2.gz LMDLQZXAFAZANJ-UHFFFAOYSA-N 0 3 423.944 4.310 20 0 HIADHN COc1ccccc1-c1csc(C2CCN(CCOC[C@H]3CCCO3)CC2)n1 ZINC000555465657 942566978 /nfs/dbraw/zinc/56/69/78/942566978.db2.gz QTHAPNRASIVRBP-GOSISDBHSA-N 0 3 402.560 4.194 20 0 HIADHN OC[C@@H](CNCc1conc1Cc1ccccc1)Cc1ccccc1C(F)(F)F ZINC000555564511 942644785 /nfs/dbraw/zinc/64/47/85/942644785.db2.gz OLKUPDJPXDFKPQ-QGZVFWFLSA-N 0 3 404.432 4.225 20 0 HIADHN O=C(Nc1ccc(-c2noc(C(F)F)n2)cc1)N1CCN(CC2CCCCC2)CC1 ZINC000555575658 942648850 /nfs/dbraw/zinc/64/88/50/942648850.db2.gz DRMRDDCWMWVTGF-UHFFFAOYSA-N 0 3 419.476 4.404 20 0 HIADHN CCOc1cc(CN[C@H](C)c2cc[nH]c(=O)c2)cc(Br)c1OC(F)F ZINC000555608211 942666760 /nfs/dbraw/zinc/66/67/60/942666760.db2.gz ZDJDEVCKZRGFPR-SNVBAGLBSA-N 0 3 417.250 4.401 20 0 HIADHN CCN(C(=O)c1cc(Cc2ccccc2)n[nH]1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000555787891 942733552 /nfs/dbraw/zinc/73/35/52/942733552.db2.gz INNVSMMBHQWKTQ-CVDCTZTESA-N 0 3 402.542 4.298 20 0 HIADHN CC[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)NCCCCN1C[C@@H](C)O[C@@H](C)C1 ZINC000555852511 942754118 /nfs/dbraw/zinc/75/41/18/942754118.db2.gz APPDYCBSRCBFEF-ZIFCJYIRSA-N 0 3 414.512 4.280 20 0 HIADHN CCOc1cccc([C@H](C)NC(=O)N(CCN(C)C)Cc2ccc(F)cc2F)c1 ZINC000555866069 942758592 /nfs/dbraw/zinc/75/85/92/942758592.db2.gz VDYAMMYCFBFTBF-INIZCTEOSA-N 0 3 405.489 4.198 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)c1cnc(OC2CCCCC2)c(Cl)c1 ZINC000555937876 942775830 /nfs/dbraw/zinc/77/58/30/942775830.db2.gz HNSKDZCZJYUDEG-UHFFFAOYSA-N 0 3 416.953 4.046 20 0 HIADHN CC(C)(C(=O)N1CC[C@H](N2CCCCC2)C1)c1csc(-c2ccccc2F)n1 ZINC000555951724 942778018 /nfs/dbraw/zinc/77/80/18/942778018.db2.gz CXXSJVSTARRMGK-INIZCTEOSA-N 0 3 401.551 4.314 20 0 HIADHN NS(=O)(=O)c1ccc2c(c1)CCC[C@@H]2NCc1ccc(OCc2ccccc2)cc1 ZINC000556060831 942799323 /nfs/dbraw/zinc/79/93/23/942799323.db2.gz MNWZIXKFHLKKPI-DEOSSOPVSA-N 0 3 422.550 4.080 20 0 HIADHN C[C@H](N[C@@H](C[C@@H]1CCOC1)c1ccccc1)C(=O)N(C)Cc1nc2ccccc2s1 ZINC000556094035 942804724 /nfs/dbraw/zinc/80/47/24/942804724.db2.gz VJEQXRBOLYFJKR-WFXMLNOXSA-N 0 3 423.582 4.401 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)c2csc(-c3ccc(Cl)cc3)c2)CC1 ZINC000556128246 942808163 /nfs/dbraw/zinc/80/81/63/942808163.db2.gz CJMRXYGIJUADCJ-INIZCTEOSA-N 0 3 405.995 4.072 20 0 HIADHN CCCN(Cc1cccc(C(=O)NCc2ccco2)c1)C[C@@H]1COc2ccccc2O1 ZINC000556207304 942818883 /nfs/dbraw/zinc/81/88/83/942818883.db2.gz RHDGMKSQMGGUQL-JOCHJYFZSA-N 0 3 420.509 4.262 20 0 HIADHN CC(C)NC(=O)Nc1ccc([C@H](C)N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)cc1 ZINC000556247059 942825681 /nfs/dbraw/zinc/82/56/81/942825681.db2.gz YAJCTMPNKHSBHV-BZSNNMDCSA-N 0 3 408.546 4.233 20 0 HIADHN C(=Cc1ccccc1)c1nc(SC[C@H]2CN(Cc3ccccc3)CCCO2)n[nH]1 ZINC000556314619 942839482 /nfs/dbraw/zinc/83/94/82/942839482.db2.gz KZEWCWUIBCEHSD-JNCYCUAHSA-N 0 3 406.555 4.358 20 0 HIADHN C(=Cc1ccccc1)c1nc(SC[C@H]2CN(Cc3ccccc3)CCCO2)n[nH]1 ZINC000556314607 942839514 /nfs/dbraw/zinc/83/95/14/942839514.db2.gz KZEWCWUIBCEHSD-BIGNBACZSA-N 0 3 406.555 4.358 20 0 HIADHN CN(C(=O)c1ccc(NCc2nc3ccc(F)cc3s2)cc1)[C@H]1CCCN(C)C1 ZINC000556338143 942844815 /nfs/dbraw/zinc/84/48/15/942844815.db2.gz VRFHGLPLPJWCIX-SFHVURJKSA-N 0 3 412.534 4.214 20 0 HIADHN CN(C(=O)c1ccc(NCc2ccc(OC(F)F)cc2)cc1)[C@@H]1CCCN(C)C1 ZINC000556338576 942845260 /nfs/dbraw/zinc/84/52/60/942845260.db2.gz ADYOCYOSWCVDIJ-LJQANCHMSA-N 0 3 403.473 4.066 20 0 HIADHN C[C@@H]1CCN(C(=O)C2(Cc3ccc(F)cc3)CCOCC2)CCN1Cc1ccccc1 ZINC000556419769 942861387 /nfs/dbraw/zinc/86/13/87/942861387.db2.gz XFZGSEQEPFDPBG-OAQYLSRUSA-N 0 3 424.560 4.288 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)N(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)CN1C1CC1 ZINC000556454578 942872684 /nfs/dbraw/zinc/87/26/84/942872684.db2.gz QVHRMMWUOJGBOB-ABAIWWIYSA-N 0 3 423.401 4.491 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)N(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)CN1C1CC1 ZINC000556454580 942872816 /nfs/dbraw/zinc/87/28/16/942872816.db2.gz QVHRMMWUOJGBOB-IAQYHMDHSA-N 0 3 423.401 4.491 20 0 HIADHN Fc1ccc([C@@H]2CN(C[C@@H]3CN(Cc4ccccc4)CCCO3)CCO2)cc1Cl ZINC000556498056 942885154 /nfs/dbraw/zinc/88/51/54/942885154.db2.gz UZGVOUNXMJEBKP-REWPJTCUSA-N 0 3 418.940 4.144 20 0 HIADHN Cc1ccc2nc(CN(Cc3cccs3)C3Cc4ccccc4C3)cc(=O)n2c1 ZINC000556518717 942890452 /nfs/dbraw/zinc/89/04/52/942890452.db2.gz KNBXGKYDBQQHKE-UHFFFAOYSA-N 0 3 401.535 4.234 20 0 HIADHN CCOc1cc(NC(=O)C(=O)N(CC)[C@H]2CCN([C@H](C)c3ccccc3)C2)ccc1C ZINC000556548868 942896858 /nfs/dbraw/zinc/89/68/58/942896858.db2.gz RKSBBFCESNJRCC-KNQAVFIVSA-N 0 3 423.557 4.016 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)c2cc(C)cc(C)c2Br)cc1 ZINC000556587299 942907469 /nfs/dbraw/zinc/90/74/69/942907469.db2.gz ALZGMSCBKRWMOS-GOSISDBHSA-N 0 3 405.336 4.107 20 0 HIADHN CCCCOc1ccc([C@H](C)NCc2ccc(C(=O)N3CCN(C)CC3)cc2)cc1 ZINC000556589143 942908344 /nfs/dbraw/zinc/90/83/44/942908344.db2.gz KBQSDODGJOFNNW-FQEVSTJZSA-N 0 3 409.574 4.104 20 0 HIADHN C[C@]1(C2CC2)NC(=O)N(c2cccc(CN[C@H]3CCc4cc(Cl)ccc43)c2)C1=O ZINC000556609758 942914449 /nfs/dbraw/zinc/91/44/49/942914449.db2.gz ATLGBQCCFRZTIN-NZQKXSOJSA-N 0 3 409.917 4.342 20 0 HIADHN CCOc1ccc([C@H](C)NCc2cccc(N3C(=O)N[C@@](C)(C4CC4)C3=O)c2)cc1 ZINC000556611394 942914817 /nfs/dbraw/zinc/91/48/17/942914817.db2.gz OESJSDCEYAKCOB-FYSMJZIKSA-N 0 3 407.514 4.161 20 0 HIADHN COC(=O)[C@@H](Cc1ccccc1)[C@@H](C)NCc1nc2cc(C(F)(F)F)ccc2n1C ZINC000556610182 942915119 /nfs/dbraw/zinc/91/51/19/942915119.db2.gz VAYSRCGDAUJEAY-PBHICJAKSA-N 0 3 419.447 4.102 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)[C@@H]1CC[C@H](C(F)(F)F)C1 ZINC000556937411 942973377 /nfs/dbraw/zinc/97/33/77/942973377.db2.gz NHVPHKNLEYCLRS-FGTMMUONSA-N 0 3 406.452 4.247 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)[C@H](C)[C@H]2OCCc3sccc32)N(C)C)cc1 ZINC000556990279 942988407 /nfs/dbraw/zinc/98/84/07/942988407.db2.gz KXFDFQJJIZFQGD-QGCDCVKKSA-N 0 3 416.587 4.204 20 0 HIADHN O[C@H](CN[C@H]1CCSc2ccc(F)cc21)COc1cccc(Br)c1 ZINC000557013955 942993931 /nfs/dbraw/zinc/99/39/31/942993931.db2.gz LXSQQGDUWFMXHW-PBHICJAKSA-N 0 3 412.324 4.155 20 0 HIADHN C[C@@H](Cn1ccc2ccccc21)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000557041225 943002319 /nfs/dbraw/zinc/00/23/19/943002319.db2.gz AXAYGQAHQGAYPT-MNNVXMFVSA-N 0 3 407.480 4.199 20 0 HIADHN Cc1cccc(COc2ccc(CN[C@H](C)c3ccc(S(N)(=O)=O)cc3)cc2)c1 ZINC000557375417 943092776 /nfs/dbraw/zinc/09/27/76/943092776.db2.gz DMAKIMPNLMHUFI-GOSISDBHSA-N 0 3 410.539 4.072 20 0 HIADHN CS(=O)(=O)Cc1cccc(CN[C@H](c2cccc(OC(F)(F)F)c2)C2CC2)c1 ZINC000557393568 943099769 /nfs/dbraw/zinc/09/97/69/943099769.db2.gz UJAGLZCAWARNJQ-IBGZPJMESA-N 0 3 413.461 4.371 20 0 HIADHN CCN1CCN(c2ccccc2N[C@@H](C)c2ccc(-n3cncn3)cc2Cl)CC1 ZINC000557444611 943129431 /nfs/dbraw/zinc/12/94/31/943129431.db2.gz IAEQQCCOSYUIFD-KRWDZBQOSA-N 0 3 410.953 4.236 20 0 HIADHN COc1cc(NC(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)cc2cccnc21 ZINC000557456649 943138280 /nfs/dbraw/zinc/13/82/80/943138280.db2.gz KAXLXIFBTZOMRS-UHFFFAOYSA-N 0 3 404.514 4.026 20 0 HIADHN C[C@@H](C1CC1)N(Cc1ccccc1)C(=O)CNC1(c2ccc(F)cc2)CCOCC1 ZINC000557499662 943169922 /nfs/dbraw/zinc/16/99/22/943169922.db2.gz RBAHMPFOUPAGOE-IBGZPJMESA-N 0 3 410.533 4.248 20 0 HIADHN CC[C@@H](C)[C@H](NCC(=O)Nc1cccc(C(=O)N(C)C)c1)c1ccc(Cl)cc1 ZINC000557543925 943201280 /nfs/dbraw/zinc/20/12/80/943201280.db2.gz XHHJWOBZWCCAON-VFNWGFHPSA-N 0 3 401.938 4.357 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)N2CCC(c3ncccc3Cl)CC2)CCN1Cc1ccccc1 ZINC000557879952 943318729 /nfs/dbraw/zinc/31/87/29/943318729.db2.gz CRGCHKOCBGUDDM-UTKZUKDTSA-N 0 3 412.965 4.287 20 0 HIADHN Cc1ccc(NC(=O)C2CC2)cc1NC(=O)N[C@@H]1CCN(Cc2ccccc2)[C@@H]1C ZINC000557885823 943320961 /nfs/dbraw/zinc/32/09/61/943320961.db2.gz VQLSARQVHZIUMS-DYESRHJHSA-N 0 3 406.530 4.128 20 0 HIADHN CCOc1cc(CNCc2cccc(Cn3ccnc3)c2)cc(Br)c1O ZINC000557888675 943321645 /nfs/dbraw/zinc/32/16/45/943321645.db2.gz FVIWYDNISHTWAY-UHFFFAOYSA-N 0 3 416.319 4.088 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)Nc3cc(C(F)(F)F)ccc3F)CC2)C[C@H](C)O1 ZINC000557914478 943328166 /nfs/dbraw/zinc/32/81/66/943328166.db2.gz OYUWHOCMFGSPRP-KBPBESRZSA-N 0 3 417.447 4.198 20 0 HIADHN C[C@@H]1C[C@@H]1N1CCN(C(=O)c2ncoc2-c2cccc(C(F)(F)F)c2)C[C@@H](C)C1 ZINC000558021427 943358063 /nfs/dbraw/zinc/35/80/63/943358063.db2.gz CYVUAIVXAORTIF-VBQJREDUSA-N 0 3 407.436 4.163 20 0 HIADHN C[C@@H]1C[C@H]1N1CCN(C(=O)CCC(=O)c2cc(Cl)sc2Cl)C[C@@H](C)C1 ZINC000558025771 943359348 /nfs/dbraw/zinc/35/93/48/943359348.db2.gz PDMVSNDCDWXCDJ-OUCADQQQSA-N 0 3 403.375 4.207 20 0 HIADHN CCc1onc(-c2ccccc2Cl)c1C(=O)N1CCN([C@@H]2C[C@H]2C)C[C@@H](C)C1 ZINC000558027638 943361117 /nfs/dbraw/zinc/36/11/17/943361117.db2.gz RKCAMMYJXJVZED-IIDMSEBBSA-N 0 3 401.938 4.360 20 0 HIADHN COc1cc(CN[C@H](C)c2ccc3c(c2)CCC(=O)N3)cc(OC)c1OCC(F)F ZINC000558104438 943379946 /nfs/dbraw/zinc/37/99/46/943379946.db2.gz PIUYXBILNZJPMT-CYBMUJFWSA-N 0 3 420.456 4.083 20 0 HIADHN CN(CCn1cc(Br)cn1)Cc1ccc(C(=O)Nc2ccccc2)cc1 ZINC000558182905 943416109 /nfs/dbraw/zinc/41/61/09/943416109.db2.gz KBBVHKQVDFPXNL-UHFFFAOYSA-N 0 3 413.319 4.030 20 0 HIADHN CCSc1ccc([C@H](C)N[C@H]2CCN(Cc3ccc(OC)cc3OC)C2=O)cc1 ZINC000558231881 943448462 /nfs/dbraw/zinc/44/84/62/943448462.db2.gz OTRTWLNCTHCTPS-KKSFZXQISA-N 0 3 414.571 4.268 20 0 HIADHN CC[C@@H](N[C@@H]1CCN(Cc2ccc(OC)cc2OC)C1=O)c1cccc(Cl)c1 ZINC000558240095 943453283 /nfs/dbraw/zinc/45/32/83/943453283.db2.gz ABQOMKPFENPFDK-WOJBJXKFSA-N 0 3 402.922 4.199 20 0 HIADHN Cc1cccc(C(=O)N2CCCC2)c1NC(=O)N[C@H](C)[C@H](c1ccccc1)N(C)C ZINC000558268265 943470009 /nfs/dbraw/zinc/47/00/09/943470009.db2.gz ROSXZUBNTYSBTH-XMSQKQJNSA-N 0 3 408.546 4.044 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)N[C@@H]1CC[C@H](c2ccccc2)C[C@H]1OC ZINC000558278361 943478526 /nfs/dbraw/zinc/47/85/26/943478526.db2.gz PEAGLYPIJCLSFA-MIZPHKNDSA-N 0 3 411.546 4.230 20 0 HIADHN COc1cccc([C@@H](CNC(=O)NCc2ccc3[nH]c(C)cc3c2)N2CCCC2)c1 ZINC000558366483 943527793 /nfs/dbraw/zinc/52/77/93/943527793.db2.gz YXZLKLCSDYXDSF-HSZRJFAPSA-N 0 3 406.530 4.121 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)Nc1cnn(CC(F)(F)F)c1)c1ccc(Cl)cc1 ZINC000558377230 943533965 /nfs/dbraw/zinc/53/39/65/943533965.db2.gz LLKACIYYBNVMOS-INIZCTEOSA-N 0 3 417.863 4.303 20 0 HIADHN CC1CCN([C@H](CNC(=O)N2CCCC[C@H]2c2cc[nH]n2)c2cccs2)CC1 ZINC000558381232 943537551 /nfs/dbraw/zinc/53/75/51/943537551.db2.gz LSCFHCNBMDJZET-RBUKOAKNSA-N 0 3 401.580 4.181 20 0 HIADHN CC(=O)N(Cc1ccc(NC(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)cc1)C1CC1 ZINC000558389924 943541680 /nfs/dbraw/zinc/54/16/80/943541680.db2.gz CICSNCKAIQKBJT-HXOBKFHXSA-N 0 3 408.546 4.010 20 0 HIADHN Cc1ccc(-n2cc(CN3CCC[C@H](c4ccnc(N)n4)C3)c(C(C)(C)C)n2)cc1 ZINC000558407602 943551974 /nfs/dbraw/zinc/55/19/74/943551974.db2.gz SXBVOCWOPTUHJS-SFHVURJKSA-N 0 3 404.562 4.230 20 0 HIADHN NS(=O)(=O)c1ccc2c(c1)[C@@H](N[C@H](Cc1ccccc1)c1cccs1)CCC2 ZINC000558498142 943576581 /nfs/dbraw/zinc/57/65/81/943576581.db2.gz PWIRLHHLYKOODW-LEWJYISDSA-N 0 3 412.580 4.347 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)N[C@@H]1c2ccccc2CC12CCOCC2 ZINC000558606393 943616158 /nfs/dbraw/zinc/61/61/58/943616158.db2.gz FHKZMGFZKJNGOA-DNQXCXABSA-N 0 3 419.569 4.217 20 0 HIADHN O=C(c1cc(Br)cc2[nH]cnc21)N(CCN1CCCC1)c1ccccc1 ZINC000558630942 943621147 /nfs/dbraw/zinc/62/11/47/943621147.db2.gz XFSYUMWIWJBDSA-UHFFFAOYSA-N 0 3 413.319 4.068 20 0 HIADHN O=C(c1cc(Br)cc2nc[nH]c21)N(CCN1CCCC1)c1ccccc1 ZINC000558630942 943621148 /nfs/dbraw/zinc/62/11/48/943621148.db2.gz XFSYUMWIWJBDSA-UHFFFAOYSA-N 0 3 413.319 4.068 20 0 HIADHN C[C@@H](N[C@@H]1CN(Cc2ccccc2)C[C@H]1c1ccccc1)C(=O)c1c[nH]c2ncccc12 ZINC000558737690 943635752 /nfs/dbraw/zinc/63/57/52/943635752.db2.gz LPHANFYDMIVFTA-BTZRARBUSA-N 0 3 424.548 4.392 20 0 HIADHN C[C@H](c1cccc(NC(=O)c2ccccc2)c1)N1CCC[C@@H](c2nc(N(C)C)no2)C1 ZINC000558743646 943638126 /nfs/dbraw/zinc/63/81/26/943638126.db2.gz VYFBNXJCULVEMY-YLJYHZDGSA-N 0 3 419.529 4.329 20 0 HIADHN CC(C)C(=O)c1ccc([C@H](C)C(=O)Nc2cccc(CN3CCC(CO)CC3)c2)cc1 ZINC000558848763 943697680 /nfs/dbraw/zinc/69/76/80/943697680.db2.gz VBHUPMNVPXLFRW-IBGZPJMESA-N 0 3 422.569 4.472 20 0 HIADHN CC(C)N1CC[C@@H](NCC(=O)N[C@@H](C)c2ccc(F)cc2)[C@@H]1c1ccc(F)c(F)c1 ZINC000558895660 943729188 /nfs/dbraw/zinc/72/91/88/943729188.db2.gz LBOYSYIRZDDCHQ-XFEAKLGESA-N 0 3 419.491 4.095 20 0 HIADHN CCN1CC[C@H](N[C@H](C)C(=O)Nc2cc(F)ccc2C)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000558898435 943732904 /nfs/dbraw/zinc/73/29/04/943732904.db2.gz SYXIRAJAWNCLIX-LZHZSBQWSA-N 0 3 423.454 4.304 20 0 HIADHN CC(C)(C)N1CC[C@H](NCC(=O)NCc2cccs2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000558901333 943735349 /nfs/dbraw/zinc/73/53/49/943735349.db2.gz JDXKSNUBAKDKFE-ICSRJNTNSA-N 0 3 423.985 4.361 20 0 HIADHN CC(C)(C)N1CC[C@@H](NCC(=O)Nc2nccs2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000558902137 943736769 /nfs/dbraw/zinc/73/67/69/943736769.db2.gz MVQTYXRRVDMPON-NVXWUHKLSA-N 0 3 410.946 4.078 20 0 HIADHN COc1cccc([C@@H]2[C@H](NCC(=O)N[C@H](c3ccccc3)C(C)C)CCN2C2CC2)c1 ZINC000558902664 943737270 /nfs/dbraw/zinc/73/72/70/943737270.db2.gz TXCBECYTSJEHSA-DMTNHVFBSA-N 0 3 421.585 4.076 20 0 HIADHN CN(C)C[C@H](NC(=O)N[C@H](c1ccccc1)[C@H]1CCOC1)c1ccc(Cl)cc1 ZINC000558906296 943739073 /nfs/dbraw/zinc/73/90/73/943739073.db2.gz OCDMLASOBFFWHX-SESVDKBCSA-N 0 3 401.938 4.020 20 0 HIADHN CC(C)c1noc(Cc2ccc(NC(=O)[C@@H]3CCCN(Cc4cccnc4)C3)cc2)n1 ZINC000558907444 943740002 /nfs/dbraw/zinc/74/00/02/943740002.db2.gz QCFBHGQFVGNATL-HXUWFJFHSA-N 0 3 419.529 4.030 20 0 HIADHN CN(C)C[C@@H](NC(=O)NCc1cccc(OC(C)(C)C)n1)c1ccc(Cl)cc1 ZINC000558936540 943758193 /nfs/dbraw/zinc/75/81/93/943758193.db2.gz VHCCOMHMMFYEMV-GOSISDBHSA-N 0 3 404.942 4.014 20 0 HIADHN CSc1cc(C(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)ccc1NC(C)=O ZINC000558971568 943776083 /nfs/dbraw/zinc/77/60/83/943776083.db2.gz KMEOYBIZGFYGFB-GOSISDBHSA-N 0 3 405.951 4.053 20 0 HIADHN Cc1cc(C(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)c(C)n1-c1nccs1 ZINC000558970734 943776123 /nfs/dbraw/zinc/77/61/23/943776123.db2.gz HAMZJDLIVDSKTN-SFHVURJKSA-N 0 3 402.951 4.237 20 0 HIADHN COC(=O)CCN(Cc1ccc(F)c(F)c1)Cc1ccc(C)cc1-c1cnn(C)c1 ZINC000559068876 943823162 /nfs/dbraw/zinc/82/31/62/943823162.db2.gz FSLVAXZBXCCFOX-UHFFFAOYSA-N 0 3 413.468 4.239 20 0 HIADHN COCCc1ccc(OC[C@@H](O)CN2CC[C@H](C)C[C@@H]2c2ccccc2OC)cc1 ZINC000559247664 943885988 /nfs/dbraw/zinc/88/59/88/943885988.db2.gz DMZMXGNEFYATDY-ZCVJKFOLSA-N 0 3 413.558 4.097 20 0 HIADHN CCc1nc2ccccc2c(C(=O)N2CCC(CN3C[C@H](C)O[C@@H](C)C3)CC2)c1C ZINC000559279490 943889656 /nfs/dbraw/zinc/88/96/56/943889656.db2.gz WOCGCIYMGLMFIJ-ROUUACIJSA-N 0 3 409.574 4.067 20 0 HIADHN CSc1cc(Br)ccc1CNCc1cccc(N2CCOCC2)c1 ZINC000559308229 943893726 /nfs/dbraw/zinc/89/37/26/943893726.db2.gz GABNUKFIQKQIRE-UHFFFAOYSA-N 0 3 407.377 4.297 20 0 HIADHN O=S(=O)(CCCNCc1ccc(OC(F)(F)F)cc1)c1ccc(Cl)cc1 ZINC000559359538 943908916 /nfs/dbraw/zinc/90/89/16/943908916.db2.gz KHTXJGJYDLPAQC-UHFFFAOYSA-N 0 3 407.841 4.192 20 0 HIADHN O=C(CC[NH+]1CCCCC1)Nc1cccc(NC(=O)c2cc([O-])ccc2Cl)c1 ZINC000559677265 944028825 /nfs/dbraw/zinc/02/88/25/944028825.db2.gz URGDMXGJNPNMDA-UHFFFAOYSA-N 0 3 401.894 4.112 20 0 HIADHN CN(C)Cc1ccc(-c2noc([C@H]3CC(=O)N(C)[C@@H]3c3cccc(Cl)c3)n2)cc1 ZINC000559740059 944042509 /nfs/dbraw/zinc/04/25/09/944042509.db2.gz RUTROAAUBIOZLW-AZUAARDMSA-N 0 3 410.905 4.139 20 0 HIADHN NS(=O)(=O)c1ccc2c(c1)CCC[C@H]2N[C@@H](COc1ccccc1)c1ccccc1 ZINC000559788374 944051809 /nfs/dbraw/zinc/05/18/09/944051809.db2.gz GIRJMTFZYFJRKM-RPWUZVMVSA-N 0 3 422.550 4.121 20 0 HIADHN C[C@@H](NCCCS(=O)(=O)c1ccc(Cl)cc1)c1cnn(Cc2ccccc2)c1 ZINC000559919837 944084578 /nfs/dbraw/zinc/08/45/78/944084578.db2.gz UAZSARNIWOQRLQ-QGZVFWFLSA-N 0 3 417.962 4.099 20 0 HIADHN CS(=O)(=O)c1ccc(OCCNCc2cnc(-c3ccc(Cl)cc3)s2)cc1 ZINC000560049165 944141103 /nfs/dbraw/zinc/14/11/03/944141103.db2.gz MGIYFTFAYFUAPT-UHFFFAOYSA-N 0 3 422.959 4.036 20 0 HIADHN Cc1c(Br)cc(CN[C@H]2CCCc3c2cnn3C)cc1Br ZINC000560061115 944145025 /nfs/dbraw/zinc/14/50/25/944145025.db2.gz XVCDFIOXSRFEFH-HNNXBMFYSA-N 0 3 413.157 4.421 20 0 HIADHN C[C@@H]1C[C@H](C)CN(C(=O)CN[C@@H](c2cccc(C(F)(F)F)c2)C2CCOCC2)C1 ZINC000560179756 944188217 /nfs/dbraw/zinc/18/82/17/944188217.db2.gz UEEPANDIQXASKW-VWKPWSFCSA-N 0 3 412.496 4.267 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)CSc2cccc(C(F)(F)F)c2)cc1 ZINC000560252101 944207667 /nfs/dbraw/zinc/20/76/67/944207667.db2.gz WQCQNOGXLVQQEY-GOSISDBHSA-N 0 3 412.477 4.225 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)CSc2cccc(C(F)(F)F)c2)cc1 ZINC000560252110 944207782 /nfs/dbraw/zinc/20/77/82/944207782.db2.gz WQCQNOGXLVQQEY-SFHVURJKSA-N 0 3 412.477 4.225 20 0 HIADHN COc1ccc2c(c1)[C@@H](NCc1cccc(N3C(=O)N[C@@](C)(C4CC4)C3=O)c1)CCC2 ZINC000560266029 944212225 /nfs/dbraw/zinc/21/22/25/944212225.db2.gz UVLIPBGMUXMPFZ-DHLKQENFSA-N 0 3 419.525 4.087 20 0 HIADHN C[C@@H](CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)NCc1cnc2n1CCCC2 ZINC000560265936 944212274 /nfs/dbraw/zinc/21/22/74/944212274.db2.gz MKEOAFRCDMSCTL-LBPRGKRZSA-N 0 3 414.859 4.399 20 0 HIADHN Cc1nn(-c2ccc(Br)cc2)cc1C(=O)Nc1ccccc1CN(C)C ZINC000560326442 944225850 /nfs/dbraw/zinc/22/58/50/944225850.db2.gz XZDPSPLVOZSZEP-UHFFFAOYSA-N 0 3 413.319 4.257 20 0 HIADHN O[C@H](CNCc1cc(Cl)c2c(c1)OCCCO2)CO[C@@H]1CCCc2ccccc21 ZINC000560455063 944232459 /nfs/dbraw/zinc/23/24/59/944232459.db2.gz ULFXLGOYWGARNZ-WIYYLYMNSA-N 0 3 417.933 4.046 20 0 HIADHN CCOc1cccc2[nH]cc(CC(=O)N3CCN(c4ccnc5ccccc54)CC3)c21 ZINC000560489639 944237946 /nfs/dbraw/zinc/23/79/46/944237946.db2.gz WTMUSUVOGAUNGX-UHFFFAOYSA-N 0 3 414.509 4.006 20 0 HIADHN CCCc1c(C(=O)NC[C@H](CN(C)C)c2ccc(Cl)cc2)[nH]c(C)c1C(C)=O ZINC000560505983 944239542 /nfs/dbraw/zinc/23/95/42/944239542.db2.gz XNRVTOZWBQWDCJ-QGZVFWFLSA-N 0 3 403.954 4.207 20 0 HIADHN COc1ccc(C[C@H](C)N[C@H](CCO)c2ccccc2Br)c(C)c1OC ZINC000560548533 944249855 /nfs/dbraw/zinc/24/98/55/944249855.db2.gz HMUUNVPVAAYHTB-IFXJQAMLSA-N 0 3 422.363 4.419 20 0 HIADHN CC[C@H](N[C@@H]1CCCN(Cc2ccccn2)C1=O)c1ccc(OC(F)(F)F)cc1 ZINC000560549808 944250330 /nfs/dbraw/zinc/25/03/30/944250330.db2.gz ZECZOVVDFOPAAL-RBUKOAKNSA-N 0 3 407.436 4.212 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@@H](C)NCc2ccc(CSC)cc2)cc1 ZINC000560581001 944262609 /nfs/dbraw/zinc/26/26/09/944262609.db2.gz BQXSKTWEFOQMHD-QGZVFWFLSA-N 0 3 406.617 4.431 20 0 HIADHN Cc1onc(-c2ccccc2Cl)c1C(=O)N(C)CCCN(C)Cc1ccncc1 ZINC000560596566 944268341 /nfs/dbraw/zinc/26/83/41/944268341.db2.gz ODGYBTZCDRGUII-UHFFFAOYSA-N 0 3 412.921 4.293 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)c2cnn(-c3ccccc3C)c2C)cc1 ZINC000560700156 944300277 /nfs/dbraw/zinc/30/02/77/944300277.db2.gz LFBWEEDHMNBSBG-HSZRJFAPSA-N 0 3 418.541 4.065 20 0 HIADHN CCCN(C)[C@H](CNC(=O)c1cnc(-c2ncccn2)s1)c1ccc(Cl)cc1 ZINC000560712514 944306582 /nfs/dbraw/zinc/30/65/82/944306582.db2.gz WAXIVHPUOMVVTP-MRXNPFEDSA-N 0 3 415.950 4.066 20 0 HIADHN CCN1CCN(CCC(=O)NCc2cccc(Oc3cccc4ccccc43)c2)CC1 ZINC000560822482 944345857 /nfs/dbraw/zinc/34/58/57/944345857.db2.gz SHTKGIYLJRHXSB-UHFFFAOYSA-N 0 3 417.553 4.276 20 0 HIADHN O=C(NC[C@H](NCc1ccccc1)c1ccco1)c1cccc(CN2CCCC2)c1 ZINC000561088482 944442372 /nfs/dbraw/zinc/44/23/72/944442372.db2.gz WIRSMWKARYDKIR-QHCPKHFHSA-N 0 3 403.526 4.136 20 0 HIADHN O[C@H](CN[C@@H]1CCCOc2ccc(F)cc21)COc1c(Cl)cccc1Cl ZINC000561257258 944530464 /nfs/dbraw/zinc/53/04/64/944530464.db2.gz NLFNQULQNIARMM-CXAGYDPISA-N 0 3 400.277 4.376 20 0 HIADHN Cc1cc(NC(=O)N[C@H](CN2CCCC2)c2ccccc2)ccc1C(=O)NC(C)C ZINC000561332335 944553498 /nfs/dbraw/zinc/55/34/98/944553498.db2.gz GZOSYGZXBBMGPI-JOCHJYFZSA-N 0 3 408.546 4.092 20 0 HIADHN C[C@@H](N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1)c1cccc(-n2ccnn2)c1 ZINC000561354906 944560875 /nfs/dbraw/zinc/56/08/75/944560875.db2.gz STIOCPBUCMLEOC-DVECYGJZSA-N 0 3 411.509 4.168 20 0 HIADHN CC[C@@H](C)N[C@H](CNc1cc(C(F)(F)F)nc(-c2cccnc2)n1)c1ccco1 ZINC000561357290 944561753 /nfs/dbraw/zinc/56/17/53/944561753.db2.gz ZANZPWIWIFQXAV-UKRRQHHQSA-N 0 3 405.424 4.692 20 0 HIADHN CC(=O)Nc1ccc(Cl)c(NC(=O)N[C@@H]2CCN(Cc3ccccc3)[C@@H]2C)c1 ZINC000561591110 944693658 /nfs/dbraw/zinc/69/36/58/944693658.db2.gz QOLCPJHDZMBYFS-AUUYWEPGSA-N 0 3 400.910 4.083 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)CCc1ccc(Br)cc1OC)c1ccco1 ZINC000561609986 944706318 /nfs/dbraw/zinc/70/63/18/944706318.db2.gz GNQLIZBRNCRUDY-PBHICJAKSA-N 0 3 423.351 4.229 20 0 HIADHN Cc1nc(C(F)(F)F)ccc1C(=O)NC[C@H](c1ccc(OC(C)C)cc1)N(C)C ZINC000561675807 944742007 /nfs/dbraw/zinc/74/20/07/944742007.db2.gz DGVHRYBCJAWWQS-GOSISDBHSA-N 0 3 409.452 4.229 20 0 HIADHN O=C(NC[C@@]1(O)CN2CCC1CC2)c1sc2cc(Cl)cc(Cl)c2c1Cl ZINC000561693270 944748946 /nfs/dbraw/zinc/74/89/46/944748946.db2.gz XBVLXTWLPKWIGK-QGZVFWFLSA-N 0 3 419.761 4.048 20 0 HIADHN C[C@@H]1[C@H](N2CCCC2)CCN1C(=O)c1cc2sc(Nc3ccccc3)nc2s1 ZINC000561753383 944779568 /nfs/dbraw/zinc/77/95/68/944779568.db2.gz KBUFGKLIMFBUMZ-GDBMZVCRSA-N 0 3 412.584 4.800 20 0 HIADHN C[C@@H]1C[C@@H]1N1CCN(C(=O)c2cccnc2SCc2ccc(F)cc2)C[C@@H](C)C1 ZINC000561764416 944786998 /nfs/dbraw/zinc/78/69/98/944786998.db2.gz JYONWIDUBSJYNV-FVJLSDCUSA-N 0 3 413.562 4.315 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)NC[C@@H]1CCO[C@H]1c1ccccc1 ZINC000561804872 944803733 /nfs/dbraw/zinc/80/37/33/944803733.db2.gz OCBWQIWKNGDHDW-QDSKXPNFSA-N 0 3 407.558 4.070 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)Nc3ccc(Oc4cccnc4)cc3)CC2)C[C@H](C)O1 ZINC000561817913 944810915 /nfs/dbraw/zinc/81/09/15/944810915.db2.gz WSYBLSIFBXMAJH-OALUTQOASA-N 0 3 424.545 4.227 20 0 HIADHN Cc1cc(C)n(-c2ccc(Cl)c(-c3nc(-c4ccc(CN(C)C)cc4)no3)n2)n1 ZINC000561858353 944824311 /nfs/dbraw/zinc/82/43/11/944824311.db2.gz SHXHYRVXVIWGEC-UHFFFAOYSA-N 0 3 408.893 4.316 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)c1ccccc1-c1nc(C(C)(C)C)no1 ZINC000561877589 944833144 /nfs/dbraw/zinc/83/31/44/944833144.db2.gz GTJJNORDXNOIFH-QGZVFWFLSA-N 0 3 406.530 4.284 20 0 HIADHN FC1(F)CCN(Cc2ccccc2)C[C@@H]1c1nc(-c2ccc3nccnc3c2)no1 ZINC000561892829 944840420 /nfs/dbraw/zinc/84/04/20/944840420.db2.gz ILMWBWUQUMLQEN-QGZVFWFLSA-N 0 3 407.424 4.305 20 0 HIADHN C[C@H](CC(=O)Nc1cccc(N2CCCC2)c1)NCc1c(C2CC2)nc2sccn12 ZINC000562012255 944893864 /nfs/dbraw/zinc/89/38/64/944893864.db2.gz QQRQWILAXAUJKE-MRXNPFEDSA-N 0 3 423.586 4.380 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)Nc1ccc(C(=O)N(CC)CC)cc1)c1ccco1 ZINC000562013420 944894200 /nfs/dbraw/zinc/89/42/00/944894200.db2.gz OZSUSKCIOCGARL-APWZRJJASA-N 0 3 400.523 4.013 20 0 HIADHN C[C@H](N[C@H]1CCN(C)[C@H]1c1ccc(Cl)cc1)C(=O)Nc1cc(Cl)ccc1F ZINC000562050511 944911732 /nfs/dbraw/zinc/91/17/32/944911732.db2.gz WGKHNDRMCODHPQ-KHDYIWLOSA-N 0 3 410.320 4.495 20 0 HIADHN CC(C)Cc1ccc([C@H](CNC(=O)Nc2ccc(Cl)c(C(N)=O)c2)N(C)C)cc1 ZINC000562089057 944932844 /nfs/dbraw/zinc/93/28/44/944932844.db2.gz NSPDBZZPXJTCHF-FQEVSTJZSA-N 0 3 416.953 4.062 20 0 HIADHN Cc1cc(NC(=O)N[C@@H](CN(C)C)c2ccc(F)cc2)ccc1NC(=O)c1ccco1 ZINC000562125066 944956243 /nfs/dbraw/zinc/95/62/43/944956243.db2.gz RPKMAACAKKHERW-FQEVSTJZSA-N 0 3 424.476 4.404 20 0 HIADHN CC(C)Cc1ccc([C@H](CNC(=O)Nc2cc(C(F)(F)F)c[nH]c2=O)N(C)C)cc1 ZINC000562139101 944967078 /nfs/dbraw/zinc/96/70/78/944967078.db2.gz IHBJPTCKRGUVCZ-SFHVURJKSA-N 0 3 424.467 4.429 20 0 HIADHN Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)N[C@H](C)[C@@H](c1ccccc1)N(C)C ZINC000562141806 944970871 /nfs/dbraw/zinc/97/08/71/944970871.db2.gz GHPLZHWYGXDFOC-GCJKJVERSA-N 0 3 408.546 4.044 20 0 HIADHN Cc1cc(N2CCSCC2)ccc1NC(=O)N[C@H](C)[C@H](c1ccccc1)N(C)C ZINC000562141884 944972128 /nfs/dbraw/zinc/97/21/28/944972128.db2.gz HGHKCVJIRPFRTH-XMSQKQJNSA-N 0 3 412.603 4.361 20 0 HIADHN O=C(NCc1c(F)cccc1N1CCCC1)NC[C@H](c1cccs1)N1CCCC1 ZINC000562180258 945005170 /nfs/dbraw/zinc/00/51/70/945005170.db2.gz MUAKPAKFPRELJR-HXUWFJFHSA-N 0 3 416.566 4.124 20 0 HIADHN CC[C@@H](NCc1cc(OC)c(OCC(F)F)c(OC)c1)c1ccc2c(c1)OCCO2 ZINC000564105206 945380091 /nfs/dbraw/zinc/38/00/91/945380091.db2.gz QXRSCUYJPMZTIV-MRXNPFEDSA-N 0 3 423.456 4.360 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)CCc1ncc(-c2ccc(F)cc2F)o1 ZINC000564125127 945389488 /nfs/dbraw/zinc/38/94/88/945389488.db2.gz VLBIJQQIMULRFF-MRXNPFEDSA-N 0 3 413.468 4.189 20 0 HIADHN CCOc1ccc(-c2noc([C@H]3CN(Cc4ccccc4)CCC3(F)F)n2)cn1 ZINC000564226946 945441380 /nfs/dbraw/zinc/44/13/80/945441380.db2.gz CTBWJYMVRDJJHD-QGZVFWFLSA-N 0 3 400.429 4.155 20 0 HIADHN CCOc1cc(CN(C)Cc2ccc(O)cc2)ccc1OCC(=O)Nc1ccccc1 ZINC000564322349 945514082 /nfs/dbraw/zinc/51/40/82/945514082.db2.gz KTWMQVDRSWLOCR-UHFFFAOYSA-N 0 3 420.509 4.440 20 0 HIADHN OC[C@]1(Cc2ccc(F)cc2)CCN(Cc2ccccc2OCc2ccncc2)C1 ZINC000564329938 945517843 /nfs/dbraw/zinc/51/78/43/945517843.db2.gz GFDCQFWHMUFJHT-VWLOTQADSA-N 0 3 406.501 4.227 20 0 HIADHN CN(Cc1ccc(Cl)s1)C(=O)CN[C@H]1CCN(C)[C@H]1c1ccc(Cl)cc1 ZINC000564395108 945552200 /nfs/dbraw/zinc/55/22/00/945552200.db2.gz JUZSZCZYXIECQJ-LPHOPBHVSA-N 0 3 412.386 4.048 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)Nc1c(-c2cccs2)nc2ccccn21 ZINC000564420806 945572552 /nfs/dbraw/zinc/57/25/52/945572552.db2.gz DJKOXJYDSWXHJR-UHFFFAOYSA-N 0 3 420.542 4.054 20 0 HIADHN C/C(=C/c1cccc(C(F)(F)F)c1)CNCC(=O)N[C@@H]1CCOc2ccccc21 ZINC000564604890 945701939 /nfs/dbraw/zinc/70/19/39/945701939.db2.gz CODONNJQEIYJGW-ILCZHQDMSA-N 0 3 404.432 4.338 20 0 HIADHN COc1cccc(OC)c1OC[C@H](O)CN1CCCCC[C@@H]1/C=C/c1cccs1 ZINC000564605853 945702337 /nfs/dbraw/zinc/70/23/37/945702337.db2.gz SQNNJLTWDQQJJA-WTWCKAPFSA-N 0 3 417.571 4.463 20 0 HIADHN Cc1noc(CSc2ccccc2C(=O)N[C@H]2CCN(Cc3ccccc3)[C@@H]2C)n1 ZINC000564680903 945727703 /nfs/dbraw/zinc/72/77/03/945727703.db2.gz ILPRZTWBNCRFOA-UZLBHIALSA-N 0 3 422.554 4.063 20 0 HIADHN CC(C)(CO)[C@@H](NCc1cc(Br)c2c(c1)OCCCO2)c1ccccc1 ZINC000564757503 945750335 /nfs/dbraw/zinc/75/03/35/945750335.db2.gz OLMBYCYMRVGIDM-FQEVSTJZSA-N 0 3 420.347 4.460 20 0 HIADHN CSc1ccc([C@H](CNc2ccc(-c3nc(C)c(C)c(=O)[n-]3)cn2)[NH+](C)C)cc1 ZINC000565124470 945780128 /nfs/dbraw/zinc/78/01/28/945780128.db2.gz XHHGPHZXUPCGMJ-IBGZPJMESA-N 0 3 409.559 4.298 20 0 HIADHN CC[C@H](c1cccc(OC)c1)N(C)C(=O)Nc1cccc(N2CCN(CC)CC2)c1 ZINC000565143094 945788566 /nfs/dbraw/zinc/78/85/66/945788566.db2.gz IEHOMUPSJLIQBS-HSZRJFAPSA-N 0 3 410.562 4.452 20 0 HIADHN C[C@H](c1ccc(F)cc1)N(C)C(=O)CN[C@H]1CCN(C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000565331064 945812768 /nfs/dbraw/zinc/81/27/68/945812768.db2.gz DOPKQLBQCQMNGR-XDCJIHQESA-N 0 3 421.919 4.173 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)Nc1cccc2c1CN(c1ccccn1)C2 ZINC000565445662 945831951 /nfs/dbraw/zinc/83/19/51/945831951.db2.gz QSNKTBOFVHADTF-LJQANCHMSA-N 0 3 415.541 4.244 20 0 HIADHN Cc1nn(CC(=O)OC(C)C)c(C)c1CN[C@H](C)c1ccc(Oc2cccnc2)cc1 ZINC000565508360 945842076 /nfs/dbraw/zinc/84/20/76/945842076.db2.gz OBPIXUDCSLNPOX-QGZVFWFLSA-N 0 3 422.529 4.490 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)Nc2ccc(-c3ccccc3)c(C)n2)cc1 ZINC000565568774 945851007 /nfs/dbraw/zinc/85/10/07/945851007.db2.gz MLYJCXHQEIWZEN-QFIPXVFZSA-N 0 3 404.514 4.490 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)c1ccc(NC(=O)c2ccccc2)cc1)c1ccco1 ZINC000565679163 945865439 /nfs/dbraw/zinc/86/54/39/945865439.db2.gz QZJRFMUARLQKAT-UTKZUKDTSA-N 0 3 405.498 4.391 20 0 HIADHN Cc1nc(-c2cccc(NC(=O)CN[C@H]3CCN(C)[C@@H]3c3ccccc3)c2)cs1 ZINC000566038298 945988112 /nfs/dbraw/zinc/98/81/12/945988112.db2.gz NIYFPQOCUHPHAY-NZQKXSOJSA-N 0 3 406.555 4.092 20 0 HIADHN COc1cc([C@@H](C)NC2CCN(Cc3coc(-c4ccccc4)n3)CC2)c(F)cn1 ZINC000566396927 946020637 /nfs/dbraw/zinc/02/06/37/946020637.db2.gz RMYYPTBIXWPUJK-MRXNPFEDSA-N 0 3 410.493 4.200 20 0 HIADHN O=C(NC1CCN(Cc2ccccc2)CC1)c1nc2ccccc2cc1Br ZINC000566395805 946020834 /nfs/dbraw/zinc/02/08/34/946020834.db2.gz NOZZQNLPJBVNOZ-UHFFFAOYSA-N 0 3 424.342 4.392 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)c1cccc(COc2ccc(C)nc2)c1)c1ccco1 ZINC000566639242 946059836 /nfs/dbraw/zinc/05/98/36/946059836.db2.gz JZTLSHQPSQTSEC-JTSKRJEESA-N 0 3 407.514 4.421 20 0 HIADHN C[C@@H](C(=O)N(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1)c1cccnc1 ZINC000566847875 946131097 /nfs/dbraw/zinc/13/10/97/946131097.db2.gz YWBNURWRRKHLKH-PXDATVDWSA-N 0 3 414.553 4.274 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)[C@@H]1CCn2c(cnc2C2CCCCC2)C1 ZINC000567037833 946225365 /nfs/dbraw/zinc/22/53/65/946225365.db2.gz COVISHXYKNHEGY-DENIHFKCSA-N 0 3 408.590 4.130 20 0 HIADHN COc1cc2c(cc1CN1CCC[C@H](c3nc(C(F)(F)F)cn3C)C1)O[C@H](C)C2 ZINC000567084882 946237033 /nfs/dbraw/zinc/23/70/33/946237033.db2.gz DUZWFUCDYWOIMF-KGLIPLIRSA-N 0 3 409.452 4.151 20 0 HIADHN Cc1cc(F)ccc1-c1nc(C(C)(C)C(=O)NCCN2CCC[C@@H](C)C2)cs1 ZINC000567244177 946277227 /nfs/dbraw/zinc/27/72/27/946277227.db2.gz RQZAXDTXFGMGGZ-OAHLLOKOSA-N 0 3 403.567 4.383 20 0 HIADHN CCN(CC(F)(F)F)C(=O)[C@H]1CCCN(Cc2cn(C)nc2C2CCCCC2)C1 ZINC000567396529 946323193 /nfs/dbraw/zinc/32/31/93/946323193.db2.gz MHAPERWWQFQARN-KRWDZBQOSA-N 0 3 414.516 4.091 20 0 HIADHN C[C@H](c1ccccc1)N(C)C(=O)CN[C@@H]1CCN(C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000567548923 946373196 /nfs/dbraw/zinc/37/31/96/946373196.db2.gz YXAYGZXLJSWUSI-QPJICYPMSA-N 0 3 403.929 4.034 20 0 HIADHN COc1cc(CN2CCC[C@H](CCNC(C)=O)C2)ccc1OCc1ccc(F)cc1 ZINC000567720512 946399707 /nfs/dbraw/zinc/39/97/07/946399707.db2.gz LDUDFYZLIMZOCF-LJQANCHMSA-N 0 3 414.521 4.152 20 0 HIADHN C[C@@H]1CCCCN1CCNC(=O)C(C)(C)c1csc(-c2cc(F)ccc2F)n1 ZINC000567798351 946413747 /nfs/dbraw/zinc/41/37/47/946413747.db2.gz JHNIBBLJJWHTLL-CQSZACIVSA-N 0 3 407.530 4.357 20 0 HIADHN COC(=O)c1ccc(COc2ccccc2CN2CC[C@@H](n3cc(C)cn3)C2)cc1 ZINC000567974301 946436221 /nfs/dbraw/zinc/43/62/21/946436221.db2.gz NTHUXQIEPCQUMQ-JOCHJYFZSA-N 0 3 405.498 4.004 20 0 HIADHN CCOC(=O)c1cc(COC)cc(NC(=O)c2oc3ccccc3c2CN(C)C)c1 ZINC000568121909 946469391 /nfs/dbraw/zinc/46/93/91/946469391.db2.gz PEECWUIPLHCQIW-UHFFFAOYSA-N 0 3 410.470 4.070 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)CCc1nnc(-c2cc3ccccc3o2)o1)c1ccco1 ZINC000568313554 946501313 /nfs/dbraw/zinc/50/13/13/946501313.db2.gz RFDQDDYXBMFJGQ-WBVHZDCISA-N 0 3 422.485 4.254 20 0 HIADHN COc1ccc(C[C@](C)(O)CN[C@H](c2cccnc2)c2ccc(F)c(C)c2)cc1OC ZINC000568334165 946514290 /nfs/dbraw/zinc/51/42/90/946514290.db2.gz RTSKKMNASMUSRG-DQEYMECFSA-N 0 3 424.516 4.219 20 0 HIADHN CN(C)C[C@@H](CNC(=O)CCC(=O)c1ccc(F)c(F)c1)c1ccc(Cl)cc1 ZINC000568435004 946543647 /nfs/dbraw/zinc/54/36/47/946543647.db2.gz ZUEKFDCHNRMXTG-MRXNPFEDSA-N 0 3 408.876 4.043 20 0 HIADHN COc1cccc(C(=O)CCCC(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@@H]2C)c1 ZINC000568493310 946569279 /nfs/dbraw/zinc/56/92/79/946569279.db2.gz LRPPOHRTFWPLQS-WMZHIEFXSA-N 0 3 408.542 4.075 20 0 HIADHN COCCCN(C(=O)c1csc(-c2ccc(Cl)cc2)n1)C1CCN(C)CC1 ZINC000568577023 946615469 /nfs/dbraw/zinc/61/54/69/946615469.db2.gz WMCKVDBVZSSMBG-UHFFFAOYSA-N 0 3 407.967 4.036 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)Nc3ccnc4ccc(Oc5ccccc5)cc43)[C@H]2C1 ZINC000568803559 946703013 /nfs/dbraw/zinc/70/30/13/946703013.db2.gz RVNQKQUEEZDSDD-SBUREZEXSA-N 0 3 402.498 4.007 20 0 HIADHN COC(C)(C)c1nc(C)c(C(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)s1 ZINC000568820490 946719004 /nfs/dbraw/zinc/71/90/04/946719004.db2.gz VHPRZWMUICVNBR-GOSISDBHSA-N 0 3 419.591 4.153 20 0 HIADHN COc1ccc(Oc2ccc(CNCc3ccnc(N4CCOCC4)c3)cc2)cc1 ZINC000568929116 946763990 /nfs/dbraw/zinc/76/39/90/946763990.db2.gz QGWKUCCVYFKHEE-UHFFFAOYSA-N 0 3 405.498 4.009 20 0 HIADHN Cc1ccsc1CNC(=O)CN[C@H]1CCN(C(C)C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000569005825 946793228 /nfs/dbraw/zinc/79/32/28/946793228.db2.gz BVIHEJUWEQITKP-GHTZIAJQSA-N 0 3 423.985 4.279 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)N1CCC[C@@H]1C1CCOCC1)c1ccc(Cl)cc1 ZINC000569033840 946803342 /nfs/dbraw/zinc/80/33/42/946803342.db2.gz HYHBEGHABDQRCU-RTWAWAEBSA-N 0 3 407.986 4.324 20 0 HIADHN COc1cc(NC(=O)CCN2Cc3ccccc3OC(C)(C)C2)c(OC)cc1Cl ZINC000569047778 946808230 /nfs/dbraw/zinc/80/82/30/946808230.db2.gz SHBSRUPVCXTGMX-UHFFFAOYSA-N 0 3 418.921 4.359 20 0 HIADHN CN1CC[C@@H](NCCS(=O)(=O)c2ccc(C(C)(C)C)cc2)C[C@@H]1c1ccccc1 ZINC000569146923 946822982 /nfs/dbraw/zinc/82/29/82/946822982.db2.gz SKQNOPYAFGHOSL-FYYLOGMGSA-N 0 3 414.615 4.183 20 0 HIADHN CC(C)Cn1ncc(C(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)c1C(F)F ZINC000569261619 946841999 /nfs/dbraw/zinc/84/19/99/946841999.db2.gz BVAXBARNVVBFQJ-IBGZPJMESA-N 0 3 422.520 4.297 20 0 HIADHN CC(C)Cn1ncc(C(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)c1C(F)F ZINC000569261623 946842222 /nfs/dbraw/zinc/84/22/22/946842222.db2.gz BVAXBARNVVBFQJ-LJQANCHMSA-N 0 3 422.520 4.297 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)Nc1cc(N2CCCC2=O)ccc1Cl ZINC000569287379 946850702 /nfs/dbraw/zinc/85/07/02/946850702.db2.gz YQOKFWLRIIZJEW-MRXNPFEDSA-N 0 3 414.937 4.109 20 0 HIADHN COc1ccc([C@@H](NC(=O)CN[C@H]2c3ccccc3CC23CCOCC3)C(C)C)cc1 ZINC000569427877 946874365 /nfs/dbraw/zinc/87/43/65/946874365.db2.gz RJMNJECQUXSXQQ-DQEYMECFSA-N 0 3 422.569 4.192 20 0 HIADHN CNS(=O)(=O)c1ccc([C@@H](C)N[C@H](C)c2ccc(OC(C)C)c(Cl)c2)cc1 ZINC000569700885 946943200 /nfs/dbraw/zinc/94/32/00/946943200.db2.gz LGGXNYKYJYDLER-HUUCEWRRSA-N 0 3 410.967 4.447 20 0 HIADHN Cc1nn(-c2ccccn2)c(C)c1CN1CCC(c2nc(-c3ccccc3)n[nH]2)CC1 ZINC000569750993 946981360 /nfs/dbraw/zinc/98/13/60/946981360.db2.gz VYMQPTJSNMPJCH-UHFFFAOYSA-N 0 3 413.529 4.049 20 0 HIADHN CC(C)(CNC(=O)CC1(N2CCOCC2)CCCC1)c1cccc(C(F)(F)F)c1 ZINC000569765982 946995643 /nfs/dbraw/zinc/99/56/43/946995643.db2.gz NQGBWNPMVNPISM-UHFFFAOYSA-N 0 3 412.496 4.134 20 0 HIADHN C[C@H](N[C@@H]1c2ccccc2CC12CCOCC2)C(=O)Nc1ccc(OC(F)F)cc1 ZINC000569891238 947038099 /nfs/dbraw/zinc/03/80/99/947038099.db2.gz BSYYMXNTNQSEEQ-MGPUTAFESA-N 0 3 416.468 4.299 20 0 HIADHN COC(C)(C)c1nc(C)c(C(=O)NC[C@@H]2CCCN(C)[C@H]2c2cccs2)s1 ZINC000569892880 947039094 /nfs/dbraw/zinc/03/90/94/947039094.db2.gz LVMKUWYBIJHYOE-GOEBONIOSA-N 0 3 407.605 4.207 20 0 HIADHN CC1CCN([C@H](CNC(=O)N2CCC=C(c3ccncc3)C2)c2ccccc2)CC1 ZINC000569996117 947065478 /nfs/dbraw/zinc/06/54/78/947065478.db2.gz HPXMWLXJTPQNOR-XMMPIXPASA-N 0 3 404.558 4.354 20 0 HIADHN CN(C)C[C@@H](NC(=O)c1ccc2nc(C(F)(F)F)cn2c1)c1ccc(Cl)cc1 ZINC000570061524 947080940 /nfs/dbraw/zinc/08/09/40/947080940.db2.gz VLOXVUCFOSFXCA-OAHLLOKOSA-N 0 3 410.827 4.039 20 0 HIADHN COc1ccc(CN(C)C(=O)CN2[C@@H]3CC[C@H]2C[C@@H](c2ccccc2)C3)cc1OC ZINC000570227656 947151226 /nfs/dbraw/zinc/15/12/26/947151226.db2.gz KVLUIASBFKGNNM-KOUNCHBCSA-N 0 3 408.542 4.073 20 0 HIADHN C[C@H]1[C@H](NC(=O)N(C)Cc2ccccc2N2CCCC2)CCN1Cc1ccccc1 ZINC000570238481 947160021 /nfs/dbraw/zinc/16/00/21/947160021.db2.gz ZPPHVTNQMMMRQE-NZQKXSOJSA-N 0 3 406.574 4.091 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)N(C)Cc2ccccc2N2CCCC2)CCN1Cc1ccccc1 ZINC000570238487 947160607 /nfs/dbraw/zinc/16/06/07/947160607.db2.gz ZPPHVTNQMMMRQE-OFNKIYASSA-N 0 3 406.574 4.091 20 0 HIADHN CN1CCC(N(Cc2ccccc2Br)C(=O)[C@@H]2CCCCS2)CC1 ZINC000570374020 947225713 /nfs/dbraw/zinc/22/57/13/947225713.db2.gz JZZVSACZWDIKQZ-SFHVURJKSA-N 0 3 411.409 4.158 20 0 HIADHN O=C(COc1ccc(Cl)c2ccccc12)Nc1cccc(CN2CC[C@@H](O)C2)c1 ZINC000570420115 947234604 /nfs/dbraw/zinc/23/46/04/947234604.db2.gz SETLGPOKJFXBNP-GOSISDBHSA-N 0 3 410.901 4.077 20 0 HIADHN Cn1cc(CN2CCC(F)(c3cccnc3)CC2)c(-c2ccc3c(c2)OCCCO3)n1 ZINC000570468734 947257144 /nfs/dbraw/zinc/25/71/44/947257144.db2.gz ZGJKKTOYTUAGGM-UHFFFAOYSA-N 0 3 422.504 4.104 20 0 HIADHN Cc1cc(F)ccc1-c1nc(C(C)(C)C(=O)N[C@@H]2C[C@H](C)N(C3CC3)C2)cs1 ZINC000570558449 947296027 /nfs/dbraw/zinc/29/60/27/947296027.db2.gz OWOOTIMNEVOBKR-GOEBONIOSA-N 0 3 401.551 4.277 20 0 HIADHN CN1CC[C@@H](NCC(=O)Nc2ccc(OCc3ccccc3)cc2)[C@H]1c1ccccc1 ZINC000570762959 947350205 /nfs/dbraw/zinc/35/02/05/947350205.db2.gz XCSDGSUGRBTDMQ-AOYPEHQESA-N 0 3 415.537 4.239 20 0 HIADHN CCc1oc(CNC[C@H]2CCN(C)[C@@H]2c2ccc(Cl)c(F)c2)cc1C(=O)OC ZINC000570869128 947376698 /nfs/dbraw/zinc/37/66/98/947376698.db2.gz BKBJJYIGCROGDC-JLTOFOAXSA-N 0 3 408.901 4.204 20 0 HIADHN CC(C)(O)CN(Cc1cc(C(F)(F)F)ccc1Br)C1CCOCC1 ZINC000571131501 947524234 /nfs/dbraw/zinc/52/42/34/947524234.db2.gz AMSSZPDTAAXFCM-UHFFFAOYSA-N 0 3 410.274 4.220 20 0 HIADHN CN1CCC(N(Cc2ccccc2Br)C(=O)[C@H]2CCCSC2)CC1 ZINC000571133600 947526712 /nfs/dbraw/zinc/52/67/12/947526712.db2.gz OSBQPVORXGPZLV-INIZCTEOSA-N 0 3 411.409 4.015 20 0 HIADHN O=C(NC[C@@H]1CCCO1)c1cccc(CN[C@H]2CCCc3c4ccccc4[nH]c32)c1 ZINC000571153511 947531050 /nfs/dbraw/zinc/53/10/50/947531050.db2.gz IAKZWSYILKHRJL-CVDCTZTESA-N 0 3 403.526 4.244 20 0 HIADHN O=C(NC[C@@H]1CCCO1)c1cccc(CN[C@@H]2CCCc3c4ccccc4[nH]c32)c1 ZINC000571153512 947531348 /nfs/dbraw/zinc/53/13/48/947531348.db2.gz IAKZWSYILKHRJL-WMZHIEFXSA-N 0 3 403.526 4.244 20 0 HIADHN CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)cc1)[C@@H]1C[C@@H]1C ZINC000571356764 947616715 /nfs/dbraw/zinc/61/67/15/947616715.db2.gz UOAPKYIBDXXDJR-WPSZSDGUSA-N 0 3 423.532 4.438 20 0 HIADHN CN1CCC(N(Cc2ccccc2Br)C(=O)c2cc(C3CC3)no2)CC1 ZINC000571371157 947627038 /nfs/dbraw/zinc/62/70/38/947627038.db2.gz HQWOSZVGJNOUQF-UHFFFAOYSA-N 0 3 418.335 4.051 20 0 HIADHN C[C@H](c1ccccc1)N1CCC(NC(=O)C2(c3cccc(Cl)c3)CC(=O)C2)CC1 ZINC000571574052 947708697 /nfs/dbraw/zinc/70/86/97/947708697.db2.gz GTWGKPGIOHLDBN-QGZVFWFLSA-N 0 3 410.945 4.283 20 0 HIADHN COc1ccc([C@H](C)N[C@@H](C)C(=O)N2CCC[C@H]2c2cccs2)c(C)c1OC ZINC000571590990 947719208 /nfs/dbraw/zinc/71/92/08/947719208.db2.gz GJWXTRYJLDKNKR-BQFCYCMXSA-N 0 3 402.560 4.477 20 0 HIADHN C[C@@H](N[C@H]1c2ccccc2CC12CCOCC2)C(=O)Nc1ccccc1OC(F)F ZINC000571931187 947814834 /nfs/dbraw/zinc/81/48/34/947814834.db2.gz UGPDFIDXELVCEH-QRWLVFNGSA-N 0 3 416.468 4.299 20 0 HIADHN CCOC(=O)c1ccn(-c2cccc(CNCc3cccc(C(F)(F)F)c3)c2)n1 ZINC000572080269 947841997 /nfs/dbraw/zinc/84/19/97/947841997.db2.gz IXTXOMKHLSTQIY-UHFFFAOYSA-N 0 3 403.404 4.358 20 0 HIADHN C/C(=C\c1ccccc1OC(F)F)CN[C@@H]1CCN(Cc2ccc(F)cc2)C1=O ZINC000572084104 947843120 /nfs/dbraw/zinc/84/31/20/947843120.db2.gz YXLWHBHHQPKFME-LBKOFNPBSA-N 0 3 404.432 4.221 20 0 HIADHN CC[C@H](C(=O)Nc1cccc(CN2CC[C@H](O)C2)c1)c1cccc(C(F)(F)F)c1 ZINC000572173022 947856551 /nfs/dbraw/zinc/85/65/51/947856551.db2.gz AVSIITLLKDMVJQ-PMACEKPBSA-N 0 3 406.448 4.404 20 0 HIADHN Cc1nc2cccc(C(=O)Nc3cc(NC(=O)CN4CCCC[C@H]4C)ccc3F)c2[nH]1 ZINC000572260004 947871070 /nfs/dbraw/zinc/87/10/70/947871070.db2.gz HLCQBRVPXVCFGQ-CQSZACIVSA-N 0 3 423.492 4.076 20 0 HIADHN COc1ccc([C@@H](C)NCc2cc3c(c(Br)c2)OCO3)c(C)c1OC ZINC000572588789 947954035 /nfs/dbraw/zinc/95/40/35/947954035.db2.gz RNZAGDZIRIMOCQ-GFCCVEGCSA-N 0 3 408.292 4.354 20 0 HIADHN O=C1NCCc2ccc(CN[C@H]3CCCc4c5cc(Br)ccc5[nH]c43)cc21 ZINC000572756956 948001567 /nfs/dbraw/zinc/00/15/67/948001567.db2.gz IRUCNQXDRWMILL-FQEVSTJZSA-N 0 3 424.342 4.384 20 0 HIADHN C[C@H](Cc1ccc(F)cc1Br)[NH2+]Cc1nnc(COc2ccccc2)[n-]1 ZINC000572915925 948038179 /nfs/dbraw/zinc/03/81/79/948038179.db2.gz JYFAQJCWPQXWKW-CYBMUJFWSA-N 0 3 419.298 4.006 20 0 HIADHN CN(C)C[C@@H](NC(=O)c1cc(Br)cc2cccnc21)c1ccc(F)cc1 ZINC000573158263 948093870 /nfs/dbraw/zinc/09/38/70/948093870.db2.gz RGZVFSCAXBPVND-GOSISDBHSA-N 0 3 416.294 4.169 20 0 HIADHN CN(CCCN(C)C(=O)c1cccc(COc2cccc(F)c2)c1)Cc1ccncc1 ZINC000573401270 948185180 /nfs/dbraw/zinc/18/51/80/948185180.db2.gz LTVPXSWGNFZMBF-UHFFFAOYSA-N 0 3 421.516 4.394 20 0 HIADHN C[C@@H](NCc1cccc(I)c1)c1ccc(-n2cccn2)cc1 ZINC000573449610 948205876 /nfs/dbraw/zinc/20/58/76/948205876.db2.gz SFKBIFHUJXWRQK-CQSZACIVSA-N 0 3 403.267 4.328 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)CCc1nc(-c2ccc(Cl)cc2)no1)c1ccco1 ZINC000573593875 948244747 /nfs/dbraw/zinc/24/47/47/948244747.db2.gz WDBAGXHWCWIHAS-YOEHRIQHSA-N 0 3 416.909 4.161 20 0 HIADHN CCN(CC)C(=O)CCC1CCN(CC(=O)N(C)[C@H](C)c2ccc(Cl)cc2)CC1 ZINC000573714580 948280823 /nfs/dbraw/zinc/28/08/23/948280823.db2.gz HDRGBLOFEGIMGX-GOSISDBHSA-N 0 3 422.013 4.220 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)c1ccc(Oc2ccc(C(N)=O)cc2)cc1)c1ccco1 ZINC000573950581 948331846 /nfs/dbraw/zinc/33/18/46/948331846.db2.gz UWNVQJJVNVORBE-IERDGZPVSA-N 0 3 421.497 4.030 20 0 HIADHN CSc1ccc([C@@H](CNC(=O)c2c(F)cccc2Br)N(C)C)cc1 ZINC000574113873 948368277 /nfs/dbraw/zinc/36/82/77/948368277.db2.gz ADAFTOCATNTXIP-MRXNPFEDSA-N 0 3 411.340 4.343 20 0 HIADHN C[C@@H](NC(=O)c1nc2ccccc2cc1Br)[C@@H](c1ccccc1)N(C)C ZINC000574117929 948369563 /nfs/dbraw/zinc/36/95/63/948369563.db2.gz WRBDCBIJKRDVTK-VLIAUNLRSA-N 0 3 412.331 4.419 20 0 HIADHN Brc1ccc(C2(CN[C@@H](c3nnc[nH]3)c3ccccc3)CCC2)s1 ZINC000574361540 948424034 /nfs/dbraw/zinc/42/40/34/948424034.db2.gz GRHZKBYUWCLAPA-MRXNPFEDSA-N 0 3 403.349 4.430 20 0 HIADHN CN(Cc1c(F)cccc1Cl)C(=O)CN[C@@H]1CCN(C)[C@H]1c1ccc(Cl)cc1 ZINC000574488537 948456883 /nfs/dbraw/zinc/45/68/83/948456883.db2.gz BCNBZBOPBHXYAE-CTNGQTDRSA-N 0 3 424.347 4.126 20 0 HIADHN C[C@H](N[C@H]1CCCN(Cc2nccn2C)C1=O)c1ccc(-c2c(F)cccc2F)cc1 ZINC000574490371 948457673 /nfs/dbraw/zinc/45/76/73/948457673.db2.gz PXAODIFPAJNMFX-KKSFZXQISA-N 0 3 424.495 4.207 20 0 HIADHN O=C(Cc1ccsc1)N(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000574541629 948466651 /nfs/dbraw/zinc/46/66/51/948466651.db2.gz YVPXBOOOMUAUOM-QHCPKHFHSA-N 0 3 405.567 4.379 20 0 HIADHN CC(C)N1CC[C@H](N[C@H]2CCN(c3ccccc3F)C2=O)[C@H]1c1ccc(F)c(F)c1 ZINC000574587755 948483964 /nfs/dbraw/zinc/48/39/64/948483964.db2.gz XZOSDKQZCBUGQU-JAXLGGSGSA-N 0 3 417.475 4.023 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)c1ccnc(Oc2ccc(F)cc2F)c1 ZINC000574633363 948494851 /nfs/dbraw/zinc/49/48/51/948494851.db2.gz PLYGXVOUYFYGKD-UHFFFAOYSA-N 0 3 413.424 4.475 20 0 HIADHN CCCn1c(C)c(C(=O)N(C)CCCN(C)Cc2ccncc2)c2cc(OC)ccc21 ZINC000574668945 948500224 /nfs/dbraw/zinc/50/02/24/948500224.db2.gz HKVJOVKELFFMOA-UHFFFAOYSA-N 0 3 422.573 4.357 20 0 HIADHN COc1ccc(-c2nc(CN3CCN(c4ccnc5ccccc54)CC3)co2)cc1 ZINC000574724261 948512873 /nfs/dbraw/zinc/51/28/73/948512873.db2.gz CUUQPBFWECBEFS-UHFFFAOYSA-N 0 3 400.482 4.221 20 0 HIADHN Cc1cc(NC(=O)N2CC3(C2)CCCCC3)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000574730072 948517350 /nfs/dbraw/zinc/51/73/50/948517350.db2.gz LUBAWYZOQDVNBL-OAQYLSRUSA-N 0 3 407.562 4.437 20 0 HIADHN CC(C)(C)c1n[nH]cc1CN1CCC(O)(Cc2ccc(OC(F)(F)F)cc2)CC1 ZINC000574796747 948528850 /nfs/dbraw/zinc/52/88/50/948528850.db2.gz JYUXSMSTDGPDLQ-UHFFFAOYSA-N 0 3 411.468 4.175 20 0 HIADHN Cc1cccc(C)c1NC(=O)CNC(=O)NC[C@@H](c1ccc(CC(C)C)cc1)N(C)C ZINC000574832853 948538094 /nfs/dbraw/zinc/53/80/94/948538094.db2.gz LRFVUPAZFNQFQC-QFIPXVFZSA-N 0 3 424.589 4.043 20 0 HIADHN CN(C)C[C@@H](NC(=O)Nc1ccc(-n2cccn2)c(F)c1)c1ccc(Cl)cc1 ZINC000574904742 948549946 /nfs/dbraw/zinc/54/99/46/948549946.db2.gz FYARCTJWOJCZLM-GOSISDBHSA-N 0 3 401.873 4.089 20 0 HIADHN COC[C@@]1(CNCc2c(C)nn(Cc3ccc(C)cc3)c2C)OCCc2ccccc21 ZINC000575030752 948579097 /nfs/dbraw/zinc/57/90/97/948579097.db2.gz VASQXQFHFFLKLG-AREMUKBSSA-N 0 3 419.569 4.061 20 0 HIADHN CN(CCC(=O)Nc1cccc(Br)c1)C[C@@H]1OCCc2ccccc21 ZINC000575093284 948590641 /nfs/dbraw/zinc/59/06/41/948590641.db2.gz MVMICUTVNWEFOO-IBGZPJMESA-N 0 3 403.320 4.024 20 0 HIADHN C[C@H]1CCCC[C@H]1N(C)C(=O)CNC1(c2cccc(C(F)(F)F)c2)CCOCC1 ZINC000575207071 948630175 /nfs/dbraw/zinc/63/01/75/948630175.db2.gz BHXCHQZSPLMMLX-QFBILLFUSA-N 0 3 412.496 4.338 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)c1cn(C)nc1-c1ccccc1Cl)c1ccco1 ZINC000575351212 948651083 /nfs/dbraw/zinc/65/10/83/948651083.db2.gz JGJIIPMGOIWCEH-KBXCAEBGSA-N 0 3 400.910 4.193 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)c1cn(-c2ccc(Cl)cc2)nc1C)c1ccco1 ZINC000575351699 948652570 /nfs/dbraw/zinc/65/25/70/948652570.db2.gz WQNHZBIJGMBQIE-AUUYWEPGSA-N 0 3 400.910 4.286 20 0 HIADHN COc1ccc(-c2nc(-c3ccc(CN(C)C)cc3)no2)c(OCCOC(C)C)c1 ZINC000575412377 948664575 /nfs/dbraw/zinc/66/45/75/948664575.db2.gz XVGTWCPIIQMLEW-UHFFFAOYSA-N 0 3 411.502 4.278 20 0 HIADHN C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)C(C)(C)c1csc(-c2c(F)cccc2Cl)n1 ZINC000575631482 948684527 /nfs/dbraw/zinc/68/45/27/948684527.db2.gz PIVFRMPRRDWXAI-MLGOLLRUSA-N 0 3 421.969 4.479 20 0 HIADHN O[C@H](CN[C@@H]1CCCOc2ccc(F)cc21)COc1ccc(Cl)cc1Cl ZINC000575735798 948688118 /nfs/dbraw/zinc/68/81/18/948688118.db2.gz OJSIYURMIJJXIX-RHSMWYFYSA-N 0 3 400.277 4.376 20 0 HIADHN O[C@H](CN[C@H]1CCCOc2ccc(F)cc21)COc1ccc(Cl)cc1Cl ZINC000575735793 948688672 /nfs/dbraw/zinc/68/86/72/948688672.db2.gz OJSIYURMIJJXIX-PBHICJAKSA-N 0 3 400.277 4.376 20 0 HIADHN COCC(C)(C)CCCNC(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000575834274 948729171 /nfs/dbraw/zinc/72/91/71/948729171.db2.gz JNBXCIGEECJQNW-FQEVSTJZSA-N 0 3 400.485 4.010 20 0 HIADHN Cc1cc(C(=O)N(Cc2ccncc2)[C@@H]2CCCN(Cc3ccccc3)C2)ccc1O ZINC000575891121 948755936 /nfs/dbraw/zinc/75/59/36/948755936.db2.gz MGSAYPYBQCWUDP-XMMPIXPASA-N 0 3 415.537 4.403 20 0 HIADHN CCc1nc(C)c([C@H](C)N(C)C(=O)N[C@H]2CCN(Cc3ccccc3)[C@@H]2C)s1 ZINC000575928929 948783592 /nfs/dbraw/zinc/78/35/92/948783592.db2.gz FWUVICOBOYANAH-AOIWGVFYSA-N 0 3 400.592 4.379 20 0 HIADHN CSc1ccc([C@@H](CNC(=O)CCn2c3ccccc3nc2C2CC2)N(C)C)cc1 ZINC000575950042 948797726 /nfs/dbraw/zinc/79/77/26/948797726.db2.gz QMXQMEKBSXJDSI-JOCHJYFZSA-N 0 3 422.598 4.445 20 0 HIADHN FC(F)(F)c1ccc(-n2cc(CN3CCC[C@@H](c4nnc(C5CC5)[nH]4)C3)cn2)cc1 ZINC000576028474 948812859 /nfs/dbraw/zinc/81/28/59/948812859.db2.gz HTCZNRAYAVVKLK-MRXNPFEDSA-N 0 3 416.451 4.266 20 0 HIADHN FC(F)(F)c1ccc(-n2cc(CN3CCC[C@H](c4nnc(C5CC5)[nH]4)C3)cn2)cc1 ZINC000576028473 948812903 /nfs/dbraw/zinc/81/29/03/948812903.db2.gz HTCZNRAYAVVKLK-INIZCTEOSA-N 0 3 416.451 4.266 20 0 HIADHN O=C(CNC1(c2cccc(C(F)(F)F)c2)CCOCC1)N(C1CC1)C1CCCC1 ZINC000576070410 948819615 /nfs/dbraw/zinc/81/96/15/948819615.db2.gz KCKYDKAJSXOBNE-UHFFFAOYSA-N 0 3 410.480 4.234 20 0 HIADHN FC1(F)CCN(c2ncccc2CN2CCCC2)C[C@@]12CCN(c1ccccc1)C2 ZINC001164827703 720396793 /nfs/dbraw/zinc/39/67/93/720396793.db2.gz HEIJHGFUXHOMBI-QHCPKHFHSA-N 0 3 412.528 4.420 20 0 HIADHN Clc1cc2ncnc(N3CC[C@H]4[C@H]3CCN4Cc3cccnc3)c2cc1Cl ZINC001164732421 720414596 /nfs/dbraw/zinc/41/45/96/720414596.db2.gz NGTBPGYIJZLBMK-RBUKOAKNSA-N 0 3 400.313 4.185 20 0 HIADHN COc1cc2c(cc1F)cc(Cl)nc2N1CC[C@H]2[C@H]1CCN2Cc1cccnc1 ZINC001164724155 720489208 /nfs/dbraw/zinc/48/92/08/720489208.db2.gz DYRWQFXLIDNLQI-RBUKOAKNSA-N 0 3 412.896 4.284 20 0 HIADHN FC(F)(c1ccnc(Cl)c1Cl)N1CCCn2cnc(CNC3CCC3)c2C1 ZINC001164836345 720736711 /nfs/dbraw/zinc/73/67/11/720736711.db2.gz DNZBOHWYIDATQC-UHFFFAOYSA-N 0 3 416.303 4.182 20 0 HIADHN c1ccc(-c2cc(N3CCN4C[C@H](Oc5cncnc5)C[C@H]4C3)nc3ccccc32)cc1 ZINC001164737190 720756102 /nfs/dbraw/zinc/75/61/02/720756102.db2.gz AMWKNJRJMAQHJI-LEWJYISDSA-N 0 3 423.520 4.034 20 0 HIADHN Cc1ccc(C)c(-c2ccc(N3CCN4C[C@@H](Oc5cccc(F)c5)C[C@@H]4C3)nn2)c1 ZINC001164905321 721556511 /nfs/dbraw/zinc/55/65/11/721556511.db2.gz GSIKRIFFYXMXIN-IRLDBZIGSA-N 0 3 418.516 4.241 20 0 HIADHN Cc1cnc(N2CCN3C[C@H](Oc4cccc(F)c4)C[C@@H]3C2)nc1-c1ccccc1F ZINC001164911889 721565351 /nfs/dbraw/zinc/56/53/51/721565351.db2.gz ZVCRYZBRKQAXDQ-UYAOXDASSA-N 0 3 422.479 4.072 20 0 HIADHN Cc1nc2sccc2c(N2CCC(F)(F)[C@]3(CCN(Cc4ccccn4)C3)C2)n1 ZINC001164903843 721583343 /nfs/dbraw/zinc/58/33/43/721583343.db2.gz OKJNFBQPGPQQEH-FQEVSTJZSA-N 0 3 415.513 4.132 20 0 HIADHN FC1(F)CCN(c2ccnc(-c3ccccc3)n2)C[C@@]12CCN(Cc1ccccn1)C2 ZINC001164907027 721587547 /nfs/dbraw/zinc/58/75/47/721587547.db2.gz QIYJUOUVMUSZAP-QHCPKHFHSA-N 0 3 421.495 4.276 20 0 HIADHN FC1(F)CCN(c2nccc3c4c([nH]c32)CCC4)C[C@@]12CCN(Cc1ccccn1)C2 ZINC001164909125 721735538 /nfs/dbraw/zinc/73/55/38/721735538.db2.gz BYKSQLMLYHJMME-QHCPKHFHSA-N 0 3 423.511 4.184 20 0 HIADHN COc1cc(N2CCC3(CC2)CN(Cc2ccc(C)cc2)CCO3)nc2ccccc21 ZINC001164940732 721929189 /nfs/dbraw/zinc/92/91/89/721929189.db2.gz ZISMXHOYMZAIQA-UHFFFAOYSA-N 0 3 417.553 4.423 20 0 HIADHN Cc1ccc2ccnc(N3CCC4(CC3)COCCN(Cc3ccncc3)C4)c2c1 ZINC001164964709 722055962 /nfs/dbraw/zinc/05/59/62/722055962.db2.gz XDQRXARDMRMSNC-UHFFFAOYSA-N 0 3 402.542 4.057 20 0 HIADHN Clc1cccc2ccnc(N3CCC4(CC3)COCCN(Cc3ccncc3)C4)c12 ZINC001164963824 722056945 /nfs/dbraw/zinc/05/69/45/722056945.db2.gz MPSFNBKVSYHIQF-UHFFFAOYSA-N 0 3 422.960 4.402 20 0 HIADHN Clc1ccc2ccc(N3CCC4(CC3)COCCN(Cc3ccncc3)C4)nc2c1 ZINC001164962172 722057740 /nfs/dbraw/zinc/05/77/40/722057740.db2.gz AEYPXJRVDHTWSY-UHFFFAOYSA-N 0 3 422.960 4.402 20 0 HIADHN Clc1ccc2nc(N3CC[C@H]4CN(Cc5cccnc5)CCO[C@H]4C3)ccc2c1 ZINC001164986164 722103939 /nfs/dbraw/zinc/10/39/39/722103939.db2.gz YFGUMDFEFGFQCA-UGKGYDQZSA-N 0 3 408.933 4.011 20 0 HIADHN Clc1ccc2ccnc(N3CC[C@@H]4CN(Cc5cccnc5)CCO[C@@H]4C3)c2c1 ZINC001164981102 722110319 /nfs/dbraw/zinc/11/03/19/722110319.db2.gz SOIFAELBPRCCEG-DENIHFKCSA-N 0 3 408.933 4.011 20 0 HIADHN Clc1cccc2c1ccnc2N1CC[C@H]2CN(Cc3cccnc3)CCO[C@H]2C1 ZINC001164974894 722114393 /nfs/dbraw/zinc/11/43/93/722114393.db2.gz IVHDKVDGEPXQRX-AVRDEDQJSA-N 0 3 408.933 4.011 20 0 HIADHN CCCc1c(NC(=O)[C@H](CC)N(CC)CC)cnn1-c1cc(F)c(OC)cc1F ZINC000435950751 861215015 /nfs/dbraw/zinc/21/50/15/861215015.db2.gz XEYVXFGPIYGLCE-KRWDZBQOSA-N 0 3 408.493 4.171 20 0 HIADHN CCCc1c(NC(=O)[C@@H](CC)N(CC)CC)cnn1-c1cc(F)c(OC)cc1F ZINC000435950752 861215432 /nfs/dbraw/zinc/21/54/32/861215432.db2.gz XEYVXFGPIYGLCE-QGZVFWFLSA-N 0 3 408.493 4.171 20 0 HIADHN CC(C)[C@@H]1CC[C@H](NCc2nnc3n2CCOC3)[C@@H](Cc2ccc(Cl)cc2)C1 ZINC000436100217 861384195 /nfs/dbraw/zinc/38/41/95/861384195.db2.gz MMHLGZNBQOMWCB-HBFSDRIKSA-N 0 3 402.970 4.235 20 0 HIADHN CS[C@H]1CN(C(=O)c2c(C)onc2-c2ccc(Cl)c(Cl)c2)C[C@H]1N(C)C ZINC000436152626 861451927 /nfs/dbraw/zinc/45/19/27/861451927.db2.gz WYUSGWVHRLPUAI-CABCVRRESA-N 0 3 414.358 4.074 20 0 HIADHN CS[C@H]1CN(C(=O)c2c(C)onc2-c2ccc(Cl)cc2Cl)C[C@@H]1N(C)C ZINC000436153233 861453661 /nfs/dbraw/zinc/45/36/61/861453661.db2.gz XIKRDOLYSSIXAX-GJZGRUSLSA-N 0 3 414.358 4.074 20 0 HIADHN CCOC(=O)c1c(NC(=O)c2ccccc2OC)sc2c1CC(C)(C)NC2(C)C ZINC000004281235 845048976 /nfs/dbraw/zinc/04/89/76/845048976.db2.gz XFVLFPWAEZATOT-UHFFFAOYSA-N 0 3 416.543 4.345 20 0 HIADHN CC(C)(C)[C@H]1CCCN1CC(=O)N(Cc1nnc(-c2ccccc2Cl)o1)C1CC1 ZINC000436226875 861530171 /nfs/dbraw/zinc/53/01/71/861530171.db2.gz WZKBPQRRHBVNGV-GOSISDBHSA-N 0 3 416.953 4.392 20 0 HIADHN CC(C)(C)[C@@H]1CCCN1CC(=O)N(Cc1nnc(-c2ccccc2Cl)o1)C1CC1 ZINC000436226877 861530565 /nfs/dbraw/zinc/53/05/65/861530565.db2.gz WZKBPQRRHBVNGV-SFHVURJKSA-N 0 3 416.953 4.392 20 0 HIADHN COc1ccc([C@@H](CNC(=O)Cc2cccc(C(F)(F)F)c2)N2CCCC2)cc1 ZINC000007265767 845298638 /nfs/dbraw/zinc/29/86/38/845298638.db2.gz BTCAJTSOGIDEDN-HXUWFJFHSA-N 0 3 406.448 4.210 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@H](C)NCc2cc3c(cccc3F)[nH]2)cc1 ZINC000436267874 861578023 /nfs/dbraw/zinc/57/80/23/861578023.db2.gz FGJRFUYOBMYQCF-HNNXBMFYSA-N 0 3 403.523 4.188 20 0 HIADHN CC(C)[C@H](NCC(=O)Nc1sc2c(c1C(N)=O)CCCC2)c1ccc(Cl)cc1 ZINC000010137521 845622939 /nfs/dbraw/zinc/62/29/39/845622939.db2.gz YELOIQPUYVJQJU-IBGZPJMESA-N 0 3 419.978 4.305 20 0 HIADHN O=S(=O)(CCCNCc1cc(Cl)cc(C(F)(F)F)c1)Cc1ccccc1 ZINC000436284451 861591975 /nfs/dbraw/zinc/59/19/75/861591975.db2.gz ZSSQYBOSPCRXME-UHFFFAOYSA-N 0 3 405.869 4.454 20 0 HIADHN Cc1c([C@H](C)NCC2([S@@](C)=O)CCC2)cnn1-c1ccc(Cl)cc1Cl ZINC000436311596 861616071 /nfs/dbraw/zinc/61/60/71/861616071.db2.gz UDSKMAGUGCTDLJ-UOXLDJKESA-N 0 3 400.375 4.439 20 0 HIADHN COc1cccc([C@H](CNC(=O)Cc2cccc(C(F)(F)F)c2)N2CCCC2)c1 ZINC000014628584 845965043 /nfs/dbraw/zinc/96/50/43/845965043.db2.gz CYKKHQISENSDEC-FQEVSTJZSA-N 0 3 406.448 4.210 20 0 HIADHN COc1ccc([C@H](CNC(=O)/C=C/c2nc3ccccc3s2)N2CCCC2)cc1 ZINC000015387672 846043287 /nfs/dbraw/zinc/04/32/87/846043287.db2.gz ZVVCSCCNCFTHKA-SJFMBGHLSA-N 0 3 407.539 4.271 20 0 HIADHN CCc1ccc([C@@H](NCC(=O)Nc2cc(OC)c(OC)c(OC)c2)C(C)C)cc1 ZINC000015522487 846058152 /nfs/dbraw/zinc/05/81/52/846058152.db2.gz PKGMGDMJYLHVFK-QFIPXVFZSA-N 0 3 400.519 4.200 20 0 HIADHN CC(C)CN1CCO[C@@H](CNCc2cccc(NC(=O)c3ccccc3Cl)c2)C1 ZINC000017317906 846245491 /nfs/dbraw/zinc/24/54/91/846245491.db2.gz FZWIYNKWGJJEJI-FQEVSTJZSA-N 0 3 415.965 4.039 20 0 HIADHN CCC(=O)c1ccc(OCC(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)cc1 ZINC000018011653 846283924 /nfs/dbraw/zinc/28/39/24/846283924.db2.gz OGGCSEWHJVIWSZ-HXUWFJFHSA-N 0 3 414.571 4.309 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)c1cc(-c2ccccn2)nc2ccccc21 ZINC000021934176 846512685 /nfs/dbraw/zinc/51/26/85/846512685.db2.gz XGQSTSLXJHIABF-UHFFFAOYSA-N 0 3 422.532 4.475 20 0 HIADHN CCOc1ccc(C(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)cc1OC ZINC000022680743 846603214 /nfs/dbraw/zinc/60/32/14/846603214.db2.gz AINNSNNFSZFEDO-GOSISDBHSA-N 0 3 402.560 4.358 20 0 HIADHN CCOc1cc(CNCc2cccc(C(F)(F)F)c2)ccc1O[C@@H](C)C(=O)N(C)C ZINC000022774395 846619599 /nfs/dbraw/zinc/61/95/99/846619599.db2.gz HQWSAIHGZWHTAR-HNNXBMFYSA-N 0 3 424.463 4.249 20 0 HIADHN CCOc1cc(CN[C@H](C)c2cccc(Cl)c2)ccc1O[C@H](C)C(=O)N(C)C ZINC000022781861 846620627 /nfs/dbraw/zinc/62/06/27/846620627.db2.gz DIGMOVZICCSIQB-HZPDHXFCSA-N 0 3 404.938 4.445 20 0 HIADHN FC(F)(F)c1cccc(-c2noc(CN3CCCN(Cc4ccccc4)CC3)n2)c1 ZINC000022808693 846623786 /nfs/dbraw/zinc/62/37/86/846623786.db2.gz HMKLXUHBYLJPPV-UHFFFAOYSA-N 0 3 416.447 4.463 20 0 HIADHN Cc1cccc2nc(C3CCN(C(=O)N[C@@H]4CCN(C)[C@@H]4c4ccccc4)CC3)oc21 ZINC000436370736 861709807 /nfs/dbraw/zinc/70/98/07/861709807.db2.gz ZZZXPNKJGSCJOV-IFMALSPDSA-N 0 3 418.541 4.471 20 0 HIADHN COc1cc(CN(C)C[C@@H](O)COc2cccc3ccccc32)ccc1OC(F)F ZINC000023408733 846696224 /nfs/dbraw/zinc/69/62/24/846696224.db2.gz LBASCUADLNZRNV-GOSISDBHSA-N 0 3 417.452 4.322 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)c1cc(Cl)c2c(c1)OCCCO2 ZINC000023739847 846744659 /nfs/dbraw/zinc/74/46/59/846744659.db2.gz LOXAXZUVTDDLFK-IBGZPJMESA-N 0 3 400.906 4.068 20 0 HIADHN CN(CCCCN1C(=O)c2ccccc2C1=O)Cc1ccc(Br)s1 ZINC000024240713 846805637 /nfs/dbraw/zinc/80/56/37/846805637.db2.gz GQMLGPDGQBZFIE-UHFFFAOYSA-N 0 3 407.333 4.019 20 0 HIADHN COc1cc(NC(=O)CCN(C)[C@@H](C)c2sc(C)nc2C)c(OC)cc1Cl ZINC000436379522 861722012 /nfs/dbraw/zinc/72/20/12/861722012.db2.gz QTFAKBYRBICSAL-LBPRGKRZSA-N 0 3 411.955 4.452 20 0 HIADHN CN(Cc1cn(-c2ccccc2)nc1-c1ccccc1)C[C@H](O)COCc1ccco1 ZINC000024591282 846842704 /nfs/dbraw/zinc/84/27/04/846842704.db2.gz IAPKDKHBVVSMIQ-QHCPKHFHSA-N 0 3 417.509 4.142 20 0 HIADHN CN(C)Cc1ccccc1NC(=O)Cn1c(COc2ccccc2)nc2ccccc21 ZINC000024808982 846870652 /nfs/dbraw/zinc/87/06/52/846870652.db2.gz IFNQVLODMOSAED-UHFFFAOYSA-N 0 3 414.509 4.316 20 0 HIADHN CCN(Cc1ccc(OC)c(OC)c1)C[C@H](O)COc1ccc(Cl)cc1Cl ZINC000025234610 846944812 /nfs/dbraw/zinc/94/48/12/846944812.db2.gz NOZXDRWWXHJRBI-INIZCTEOSA-N 0 3 414.329 4.272 20 0 HIADHN O[C@H](COc1ccc(Cl)cc1Cl)CN1CCC[C@@H]1c1ccc2c(c1)OCCO2 ZINC000025227905 846944926 /nfs/dbraw/zinc/94/49/26/846944926.db2.gz WTQNHUXGOXBNPE-FUHWJXTLSA-N 0 3 424.324 4.341 20 0 HIADHN Cc1ccc([C@@H](OC[C@@H](O)CN(C)Cc2ccc3c(c2)OCO3)c2ccccc2)cc1 ZINC000025368610 846968855 /nfs/dbraw/zinc/96/88/55/846968855.db2.gz ZFVGOXGCGIWZGH-OZXSUGGESA-N 0 3 419.521 4.323 20 0 HIADHN CC(C)[C@@H](CNC(=O)c1ccccc1OC[C@H]1CCCO1)N1CCc2ccccc2C1 ZINC000025540855 846995740 /nfs/dbraw/zinc/99/57/40/846995740.db2.gz NRXSSWJJXHKFEY-ISKFKSNPSA-N 0 3 422.569 4.057 20 0 HIADHN CC(C)[C@H](CNC(=O)c1cccc(OC[C@H]2CCCO2)c1)N1CCc2ccccc2C1 ZINC000025540603 846996635 /nfs/dbraw/zinc/99/66/35/846996635.db2.gz LWUFOVFVLKNZAH-RPBOFIJWSA-N 0 3 422.569 4.057 20 0 HIADHN Cc1cc(NC(=O)c2ccco2)sc1C(=O)NC1CCN(Cc2ccccc2)CC1 ZINC000026067772 847080234 /nfs/dbraw/zinc/08/02/34/847080234.db2.gz ZTIITUUZHWCAJU-UHFFFAOYSA-N 0 3 423.538 4.296 20 0 HIADHN COc1ccc(S(=O)(=O)[N-]c2ccccc2C[N@H+](C)C2CCCCC2)cc1OC ZINC000026094097 847082636 /nfs/dbraw/zinc/08/26/36/847082636.db2.gz TYPSRMQXFLGCDW-UHFFFAOYSA-N 0 3 418.559 4.269 20 0 HIADHN COc1ccc(S(=O)(=O)[N-]c2ccccc2C[N@@H+](C)C2CCCCC2)cc1OC ZINC000026094097 847082639 /nfs/dbraw/zinc/08/26/39/847082639.db2.gz TYPSRMQXFLGCDW-UHFFFAOYSA-N 0 3 418.559 4.269 20 0 HIADHN O=C1C[C@@H](NCc2c[nH]nc2-c2ccsc2)CN1Cc1ccccc1C(F)(F)F ZINC000436406684 861754184 /nfs/dbraw/zinc/75/41/84/861754184.db2.gz JHVAMHXZHXBVOZ-MRXNPFEDSA-N 0 3 420.460 4.048 20 0 HIADHN COc1cc(CN[C@H](C)c2ccc3c(c2)CCCC3)ccc1OCC(=O)N1CCCC1 ZINC000026313863 847122718 /nfs/dbraw/zinc/12/27/18/847122718.db2.gz WSOQXGPVMZOTOI-LJQANCHMSA-N 0 3 422.569 4.426 20 0 HIADHN CC(C)Oc1ccc(-c2nn(-c3ccccc3)cc2CNCCNC(=O)C(C)C)cc1 ZINC000026309478 847123002 /nfs/dbraw/zinc/12/30/02/847123002.db2.gz XQJRIQLGOPWWCV-UHFFFAOYSA-N 0 3 420.557 4.188 20 0 HIADHN COc1ccc(CN(C)CCC(=O)Nc2ccccc2SC)cc1OC(F)F ZINC000026453588 847150053 /nfs/dbraw/zinc/15/00/53/847150053.db2.gz VQOUYFGKNXYUNL-UHFFFAOYSA-N 0 3 410.486 4.479 20 0 HIADHN Cn1c2ccc(C(F)(F)F)cc2nc1CNC[C@]1(O)CCC[C@H](C(F)(F)F)C1 ZINC000436408772 861759445 /nfs/dbraw/zinc/75/94/45/861759445.db2.gz WWPPWEUCVVDULJ-LRDDRELGSA-N 0 3 409.374 4.165 20 0 HIADHN COc1ccc(OC)c([C@H](C)NC[C@@H](O)COc2c(Cl)cccc2Cl)c1 ZINC000026714801 847188745 /nfs/dbraw/zinc/18/87/45/847188745.db2.gz MYEMXWSYKQWLHQ-QWHCGFSZSA-N 0 3 400.302 4.101 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)Cc3cccc4ccccc43)CC2)c1 ZINC000026964707 847227821 /nfs/dbraw/zinc/22/78/21/847227821.db2.gz DCVKDPURAQPSSS-UHFFFAOYSA-N 0 3 415.581 4.409 20 0 HIADHN CCn1c2ccccc2c2cc(NC(=O)CN3CCN(C4CCCC4)CC3)ccc21 ZINC000027117954 847250210 /nfs/dbraw/zinc/25/02/10/847250210.db2.gz MKICNZMUYQUVJH-UHFFFAOYSA-N 0 3 404.558 4.313 20 0 HIADHN Cc1cc(-n2c(C)cc(C(=O)N3CCCN(Cc4ccccc4C)CC3)c2C)no1 ZINC000027389403 847295547 /nfs/dbraw/zinc/29/55/47/847295547.db2.gz OLJLLIKGPGBKEL-UHFFFAOYSA-N 0 3 406.530 4.047 20 0 HIADHN Cc1ccccc1CN1CCCN(C(=O)/C=C/c2ccc(Br)o2)CC1 ZINC000027391306 847295772 /nfs/dbraw/zinc/29/57/72/847295772.db2.gz GWEVBMREKXIFFJ-CSKARUKUSA-N 0 3 403.320 4.098 20 0 HIADHN Cc1cc(NC(=O)CN(C)[C@@H](c2ccccc2C)C(C)C)n(-c2nc(C)cc(C)n2)n1 ZINC000436419172 861776484 /nfs/dbraw/zinc/77/64/84/861776484.db2.gz BGLFNKZMOALINS-HSZRJFAPSA-N 0 3 420.561 4.164 20 0 HIADHN COCc1c(C(=O)NC[C@@H](Cc2ccccc2)N(C)C)sc2cccc(F)c21 ZINC000027585001 847323411 /nfs/dbraw/zinc/32/34/11/847323411.db2.gz JHWGDNHEJHHERJ-MRXNPFEDSA-N 0 3 400.519 4.090 20 0 HIADHN CC1CCN([C@@H](CNC(=O)Cc2cnn(-c3ccccc3)c2)c2cccs2)CC1 ZINC000027575403 847323618 /nfs/dbraw/zinc/32/36/18/847323618.db2.gz RSRUXAIHVOAMIO-NRFANRHFSA-N 0 3 408.571 4.066 20 0 HIADHN CN(C)[C@H](CNC(=O)CCc1ncc(-c2ccc(Cl)cc2)o1)Cc1ccccc1 ZINC000027588591 847324838 /nfs/dbraw/zinc/32/48/38/847324838.db2.gz VQYIGPYHLUTJIB-FQEVSTJZSA-N 0 3 411.933 4.217 20 0 HIADHN COc1ccc(NC(C)=O)cc1NC(=O)[C@H](C)N(C)CC12CC3CC(CC(C3)C1)C2 ZINC000027930338 847365042 /nfs/dbraw/zinc/36/50/42/847365042.db2.gz DQYUINPSEUIJGO-AAUBKWPISA-N 0 3 413.562 4.129 20 0 HIADHN Cc1ccc(NC(=O)NC(=O)[C@H](C)N[C@H](C)c2ccc(NC(=O)C3CC3)cc2)c(C)c1 ZINC000028349123 847410659 /nfs/dbraw/zinc/41/06/59/847410659.db2.gz YSPZFXIDVBNZMT-SJORKVTESA-N 0 3 422.529 4.039 20 0 HIADHN CC[C@@H](CNC(=O)N(C)Cc1nc2ccccc2s1)N1CCc2ccccc2C1 ZINC000028391776 847414523 /nfs/dbraw/zinc/41/45/23/847414523.db2.gz PEJBHHBLJBTGBY-IBGZPJMESA-N 0 3 408.571 4.275 20 0 HIADHN CC[C@H](CNC(=O)N(C)Cc1nc2ccccc2s1)N1CCc2ccccc2C1 ZINC000028391782 847414752 /nfs/dbraw/zinc/41/47/52/847414752.db2.gz PEJBHHBLJBTGBY-LJQANCHMSA-N 0 3 408.571 4.275 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1c(C)nn(Cc2ccccc2)c1C)c1ccsc1 ZINC000029414925 847560172 /nfs/dbraw/zinc/56/01/72/847560172.db2.gz ZLTLQDPJDDAXHK-NRFANRHFSA-N 0 3 410.587 4.423 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cc(C)nc4c3cnn4C(C)C)c(C)c2)CC1 ZINC000029579527 847583075 /nfs/dbraw/zinc/58/30/75/847583075.db2.gz VVKWNDQZZOMTAT-UHFFFAOYSA-N 0 3 420.561 4.023 20 0 HIADHN CCc1ccc([C@H](CNC(=O)c2ccc(OCc3ccncc3)cc2)N(C)C)cc1 ZINC000029754591 847613533 /nfs/dbraw/zinc/61/35/33/847613533.db2.gz XRILUFGFLYLUBD-DEOSSOPVSA-N 0 3 403.526 4.256 20 0 HIADHN O=C(CCc1ncc(-c2ccccc2Cl)o1)NCCCN1CCc2ccccc2C1 ZINC000029841560 847630698 /nfs/dbraw/zinc/63/06/98/847630698.db2.gz ATVWKCLQXBNCQD-UHFFFAOYSA-N 0 3 423.944 4.492 20 0 HIADHN CC(C)(C)OC(=O)Nc1ccc(CC(=O)NCCCN2CCc3ccccc3C2)cc1 ZINC000029842159 847630950 /nfs/dbraw/zinc/63/09/50/847630950.db2.gz RCUFOFVQXUAHSI-UHFFFAOYSA-N 0 3 423.557 4.141 20 0 HIADHN CCOc1ccc(-c2nc(CC(=O)NCc3ccccc3CN(C)C)cs2)cc1 ZINC000030564015 847737181 /nfs/dbraw/zinc/73/71/81/847737181.db2.gz VLYMSRKFJNBHJF-UHFFFAOYSA-N 0 3 409.555 4.129 20 0 HIADHN c1ncn(Cc2ccc(CNCc3cn(-c4ccccc4)nc3-c3ccccc3)cc2)n1 ZINC000030634326 847748432 /nfs/dbraw/zinc/74/84/32/847748432.db2.gz UGIBJHGJBAZXRZ-UHFFFAOYSA-N 0 3 420.520 4.469 20 0 HIADHN c1cn(-c2ccc(CNCc3cn(Cc4ccccc4)nc3-c3ccccc3)cn2)cn1 ZINC000030655394 847753337 /nfs/dbraw/zinc/75/33/37/847753337.db2.gz QQAKCZVTAYRTHC-UHFFFAOYSA-N 0 3 420.520 4.469 20 0 HIADHN CNC(=O)c1ccc(CNCc2cn(Cc3ccccc3)nc2-c2ccccc2)cc1 ZINC000030900131 847793987 /nfs/dbraw/zinc/79/39/87/847793987.db2.gz RTMCAFAJJKDGNV-UHFFFAOYSA-N 0 3 410.521 4.248 20 0 HIADHN c1c(CNCc2ccc(N3CCCC3)nc2)c(-c2cccnc2)nn1Cc1ccccc1 ZINC000030900256 847794122 /nfs/dbraw/zinc/79/41/22/847794122.db2.gz OOEPUTFQDLYGBM-UHFFFAOYSA-N 0 3 424.552 4.278 20 0 HIADHN Fc1ccccc1COc1ccc(CNCc2ccccc2Cn2cncn2)cc1 ZINC000030900934 847794350 /nfs/dbraw/zinc/79/43/50/847794350.db2.gz QEZDHPQZOWGPDM-UHFFFAOYSA-N 0 3 402.473 4.334 20 0 HIADHN COc1cc(CNC[C@@H](c2c(F)cccc2Cl)N2CCCC2)cc(OC)c1OC ZINC000030910888 847797239 /nfs/dbraw/zinc/79/72/39/847797239.db2.gz FUDMLRIQKOHCEC-SFHVURJKSA-N 0 3 422.928 4.432 20 0 HIADHN Cc1c(CNCc2cccc(COCc3ccco3)c2)c(=O)n(-c2ccccc2)n1C ZINC000030913264 847797448 /nfs/dbraw/zinc/79/74/48/847797448.db2.gz DFSOMHIRHBCBQZ-UHFFFAOYSA-N 0 3 417.509 4.084 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)c1cc2c(cccc2OC(F)F)[nH]1 ZINC000031210875 847844589 /nfs/dbraw/zinc/84/45/89/847844589.db2.gz VDLUDPIFIQXAKT-INIZCTEOSA-N 0 3 405.470 4.398 20 0 HIADHN O=C(c1ccccc1[O-])N1CCC([NH2+][C@@H]2CCCOc3cc(Cl)ccc32)CC1 ZINC000436556317 861850044 /nfs/dbraw/zinc/85/00/44/861850044.db2.gz RSSAFHPJYJKOPU-LJQANCHMSA-N 0 3 400.906 4.154 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cccc(OC[C@@H]2CCCO2)c1)c1ccsc1 ZINC000031984519 847974777 /nfs/dbraw/zinc/97/47/77/847974777.db2.gz IMQOHKZDSFAFTM-LEWJYISDSA-N 0 3 402.560 4.119 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)COCc1nc2ccccc2s1)c1ccsc1 ZINC000031986518 847975826 /nfs/dbraw/zinc/97/58/26/847975826.db2.gz RGNFBNJDOCBDJO-KRWDZBQOSA-N 0 3 403.573 4.074 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1C(=O)NC[C@H](c1ccccc1)N1CCCC1 ZINC000032217491 847992704 /nfs/dbraw/zinc/99/27/04/847992704.db2.gz FBHYPOLAKJFCDF-HSZRJFAPSA-N 0 3 402.542 4.115 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)C1(c2ccc(Br)cc2)CC1 ZINC000032401165 848020251 /nfs/dbraw/zinc/02/02/51/848020251.db2.gz GURRTCQENPTPSD-UHFFFAOYSA-N 0 3 413.359 4.045 20 0 HIADHN CC[C@@H](CNC(=O)CCc1ncc(-c2ccccc2)o1)N1CCc2ccccc2C1 ZINC000032447181 848028200 /nfs/dbraw/zinc/02/82/00/848028200.db2.gz OFOIEFXLVXAVGJ-QFIPXVFZSA-N 0 3 403.526 4.227 20 0 HIADHN CC[C@H](CNC(=O)CCCc1nc(-c2cccs2)no1)N1CCc2ccccc2C1 ZINC000032650086 848059117 /nfs/dbraw/zinc/05/91/17/848059117.db2.gz GMKCKOMVRJUNLZ-LJQANCHMSA-N 0 3 424.570 4.074 20 0 HIADHN Cc1ccccc1CN1CCCN(C(=O)CCCc2nc(-c3cccs3)no2)CC1 ZINC000032665018 848060486 /nfs/dbraw/zinc/06/04/86/848060486.db2.gz XMMPROKMXUSANK-UHFFFAOYSA-N 0 3 424.570 4.164 20 0 HIADHN CCc1ccc([C@H](CNC(=O)Cc2c(C)nn(-c3ccccc3)c2C)N(C)C)cc1 ZINC000032733551 848069178 /nfs/dbraw/zinc/06/91/78/848069178.db2.gz RAEOAQLHKGKMFP-DEOSSOPVSA-N 0 3 404.558 4.013 20 0 HIADHN Cc1nn(-c2ccc(C(=O)N[C@@H]3CCN(Cc4ccccc4)C3)cc2)c(C)c1Cl ZINC000036664184 848154176 /nfs/dbraw/zinc/15/41/76/848154176.db2.gz WQDMKIDTTZBGQD-HXUWFJFHSA-N 0 3 408.933 4.147 20 0 HIADHN COc1cccc(NC(=O)[C@@H](NCCc2ccc(OC)c(OC)c2)c2ccccc2)c1 ZINC000038431221 848178560 /nfs/dbraw/zinc/17/85/60/848178560.db2.gz VQNQQQANROOSKP-DEOSSOPVSA-N 0 3 420.509 4.225 20 0 HIADHN N#CC(C(=O)CCCc1nc(-c2ccc(Cl)cc2)no1)c1nc2ccccc2[nH]1 ZINC000041494185 848221147 /nfs/dbraw/zinc/22/11/47/848221147.db2.gz OISDKJDUEYZWSN-OAHLLOKOSA-N 0 3 405.845 4.465 20 0 HIADHN C[C@H](Oc1ccc(-c2ccccc2)cc1)C(=O)C(C#N)c1nnc2n1CCCCC2 ZINC000041505716 848223834 /nfs/dbraw/zinc/22/38/34/848223834.db2.gz LJHSFMVJOJTELU-UWJYYQICSA-N 0 3 400.482 4.315 20 0 HIADHN C[C@@H](NC(=O)OCc1ccccc1)C(=O)C(C#N)c1nc(-c2ccccc2)cs1 ZINC000041533255 848227730 /nfs/dbraw/zinc/22/77/30/848227730.db2.gz TUGXHNKBNVSJEW-QAPCUYQASA-N 0 3 405.479 4.301 20 0 HIADHN CCN(CC)[C@H](CNC(=S)Nc1ccc(NC(C)=O)cc1)c1cccc(OC)c1 ZINC000041729294 848241070 /nfs/dbraw/zinc/24/10/70/848241070.db2.gz XESUFEFUAZVMEQ-OAQYLSRUSA-N 0 3 414.575 4.023 20 0 HIADHN COc1cc(-c2nc(CN3CCCC[C@@H]3[C@@H]3CCCC[C@@H]3O)cs2)ccc1O ZINC000436659802 861884487 /nfs/dbraw/zinc/88/44/87/861884487.db2.gz AZOPZUPFRBUVAW-OTWHNJEPSA-N 0 3 402.560 4.430 20 0 HIADHN CCN(CC)Cc1ccc(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)o1 ZINC000042034029 848277053 /nfs/dbraw/zinc/27/70/53/848277053.db2.gz KMZFKYPDCRLRRD-UHFFFAOYSA-N 0 3 403.954 4.169 20 0 HIADHN O[C@@H](c1ccccc1)C1CCN(C[C@H](O)COc2c(Cl)cccc2Cl)CC1 ZINC000042635034 848335128 /nfs/dbraw/zinc/33/51/28/848335128.db2.gz XRFQUUGIZMLDRI-PXNSSMCTSA-N 0 3 410.341 4.179 20 0 HIADHN Cn1ccnc1COc1ccc(CN2CCC[C@H]2c2ccc3c(c2)OCCO3)cc1 ZINC000042743433 848350568 /nfs/dbraw/zinc/35/05/68/848350568.db2.gz ZIQFRNBADFSHMJ-NRFANRHFSA-N 0 3 405.498 4.107 20 0 HIADHN CC(C)CN1CCN(Cn2nc(-c3ccc(C(C)(C)C)cc3)n(C)c2=S)CC1 ZINC000042912394 848364710 /nfs/dbraw/zinc/36/47/10/848364710.db2.gz BVLHSCFBNSVXMR-UHFFFAOYSA-N 0 3 401.624 4.147 20 0 HIADHN CC(C)[C@H](NC(=O)N1CCCN(Cc2ccccc2)CC1)c1nc2ccccc2[nH]1 ZINC000043105834 848384182 /nfs/dbraw/zinc/38/41/82/848384182.db2.gz KMDFAGHDPURIRO-QFIPXVFZSA-N 0 3 405.546 4.178 20 0 HIADHN Cc1ccccc1CN1CCCN(C(=O)N[C@H](c2ccccc2)c2ccccn2)CC1 ZINC000043295210 848405581 /nfs/dbraw/zinc/40/55/81/848405581.db2.gz OORGWSGWNFPTGR-RUZDIDTESA-N 0 3 414.553 4.397 20 0 HIADHN CC1CCN([C@@H](CNC(=O)Nc2ccc(C(=O)N(C)C)cc2)c2cccs2)CC1 ZINC000043487401 848429594 /nfs/dbraw/zinc/42/95/94/848429594.db2.gz JJZZTALYVPXORC-IBGZPJMESA-N 0 3 414.575 4.045 20 0 HIADHN CCNC(=O)c1cccc(NC(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)c1 ZINC000043680207 848449343 /nfs/dbraw/zinc/44/93/43/848449343.db2.gz XTVKHLJWSHBDMQ-IBGZPJMESA-N 0 3 414.575 4.093 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)Nc1cc2c(cc1Cl)OCCO2 ZINC000043903778 848488549 /nfs/dbraw/zinc/48/85/49/848488549.db2.gz NHWIAWPRSSZAAH-SFHVURJKSA-N 0 3 401.894 4.070 20 0 HIADHN Cc1ccccc1CN1CCCN(C(=O)Nc2cc3c(cc2Cl)OCCO3)CC1 ZINC000043902872 848488922 /nfs/dbraw/zinc/48/89/22/848488922.db2.gz UVHQQNXNUGMDQE-UHFFFAOYSA-N 0 3 415.921 4.159 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1cccc(NC(=O)C2CC2)c1)c1ccsc1 ZINC000044101622 848514591 /nfs/dbraw/zinc/51/45/91/848514591.db2.gz UQHPDRUYQBJMRK-IBGZPJMESA-N 0 3 400.548 4.301 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1ccc(CC(=O)NC(C)C)cc1)c1ccsc1 ZINC000044149067 848522468 /nfs/dbraw/zinc/52/24/68/848522468.db2.gz HVVHCCNVGQABSV-FQEVSTJZSA-N 0 3 416.591 4.020 20 0 HIADHN CN(C)C[C@H]1CCc2ccccc2N1C(=O)Cc1csc(-c2cccc(F)c2)n1 ZINC000436727508 861913364 /nfs/dbraw/zinc/91/33/64/861913364.db2.gz ZFYUMNHVNLWNJQ-HXUWFJFHSA-N 0 3 409.530 4.401 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1ccc(N2CCOCC2)cc1C)c1ccsc1 ZINC000044357969 848550395 /nfs/dbraw/zinc/55/03/95/848550395.db2.gz WLVMIQLZLNGVGC-OAQYLSRUSA-N 0 3 416.591 4.098 20 0 HIADHN O=C(Cc1csc(-c2cccc(F)c2)n1)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000044719539 848594481 /nfs/dbraw/zinc/59/44/81/848594481.db2.gz PODSAHDBPXPJSB-NRFANRHFSA-N 0 3 409.530 4.445 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3sc(Cc4ccccc4)nc3C)cc2)CC1 ZINC000046673402 848905301 /nfs/dbraw/zinc/90/53/01/848905301.db2.gz QRKQOAIEILHKPE-UHFFFAOYSA-N 0 3 420.582 4.437 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)N3CC[C@H]3c3ccccc3)CC2)c1 ZINC000046867924 848950492 /nfs/dbraw/zinc/95/04/92/848950492.db2.gz DXLCVRGIAWOGHP-DEOSSOPVSA-N 0 3 406.574 4.054 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)C1(c2ccc(Br)cc2)CC1 ZINC000046917386 848959076 /nfs/dbraw/zinc/95/90/76/848959076.db2.gz XRMVOEOPWWPBIJ-FQEVSTJZSA-N 0 3 413.359 4.434 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCc3cc(Cl)ccc3OC)c(C)c2)CC1 ZINC000047131203 848991087 /nfs/dbraw/zinc/99/10/87/848991087.db2.gz MCDROQVWDKGKAB-UHFFFAOYSA-N 0 3 416.953 4.121 20 0 HIADHN CCc1ccc([C@H](CNC(=O)c2cnn(C(C)(C)C)c2C(F)(F)F)N(C)C)cc1 ZINC000047330487 849027161 /nfs/dbraw/zinc/02/71/61/849027161.db2.gz HWAXIQMGBRJSMB-KRWDZBQOSA-N 0 3 410.484 4.252 20 0 HIADHN N#CC(C(=O)C1CCN(C(=O)/C=C/c2ccccc2)CC1)c1ccc2ccccc2n1 ZINC000047376884 849035193 /nfs/dbraw/zinc/03/51/93/849035193.db2.gz OWHGHLSBMQTTCW-KCQSEKJDSA-N 0 3 409.489 4.363 20 0 HIADHN Clc1ccccc1-c1ccc(C[NH+]2CCN(c3ncnc4[n-]cnc43)CC2)s1 ZINC000047510747 849060091 /nfs/dbraw/zinc/06/00/91/849060091.db2.gz GGCGRMIFWIJXBK-UHFFFAOYSA-N 0 3 410.934 4.057 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)NCc3ccccc3Cl)CC2)c1 ZINC000047616813 849085742 /nfs/dbraw/zinc/08/57/42/849085742.db2.gz WKQGVWKLMUENTH-UHFFFAOYSA-N 0 3 414.981 4.050 20 0 HIADHN COc1ccc(CN[C@@H](C)c2ccc3c(c2)CCC(=O)N3)cc1OCc1cccnc1 ZINC000047826851 849123625 /nfs/dbraw/zinc/12/36/25/849123625.db2.gz OLPLRTXADLEZDK-KRWDZBQOSA-N 0 3 417.509 4.405 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N[C@@H](c2ccccc2)c2ccccn2)N(C)C)cc1 ZINC000047937419 849141125 /nfs/dbraw/zinc/14/11/25/849141125.db2.gz QNAPBNRLTZTHIT-ZEQRLZLVSA-N 0 3 402.542 4.336 20 0 HIADHN CC(C)C(=O)Nc1cccc(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2)c1 ZINC000048074215 849159183 /nfs/dbraw/zinc/15/91/83/849159183.db2.gz WALOYFBKLJMQQQ-UHFFFAOYSA-N 0 3 400.498 4.016 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)Nc1ccc(F)cc1Br ZINC000048082816 849161515 /nfs/dbraw/zinc/16/15/15/849161515.db2.gz AIYZEFJQMRZKMU-UHFFFAOYSA-N 0 3 412.278 4.323 20 0 HIADHN CCC(=O)Nc1ccc(C)c(NC(=O)NC[C@H](c2cccs2)N2CCCC2)c1 ZINC000048257162 849199443 /nfs/dbraw/zinc/19/94/43/849199443.db2.gz JFMIKFUPAKWRRI-GOSISDBHSA-N 0 3 400.548 4.364 20 0 HIADHN CSc1ccc(CNCc2ccc(S(=O)(=O)N3CCC[C@@H](C)C3)cc2)cc1 ZINC000048746512 849263210 /nfs/dbraw/zinc/26/32/10/849263210.db2.gz WDHFDYYUFKPJMV-QGZVFWFLSA-N 0 3 404.601 4.119 20 0 HIADHN CNC(=O)COc1cccc(CNCc2ccc(-c3ccccc3Cl)s2)c1 ZINC000048778948 849266891 /nfs/dbraw/zinc/26/68/91/849266891.db2.gz HTFVTXIQGNNZOZ-UHFFFAOYSA-N 0 3 400.931 4.483 20 0 HIADHN N#CC(C(=O)[C@H]1CCCN(C(=O)Cc2ccc(F)cc2)C1)c1ccc2ccccc2n1 ZINC000048857321 849276266 /nfs/dbraw/zinc/27/62/66/849276266.db2.gz YSGUNVMHBKUEPG-FPOVZHCZSA-N 0 3 415.468 4.031 20 0 HIADHN O=C(NCc1ccc(COCC(F)(F)F)cc1)c1cccc(CN2CCCC2)c1 ZINC000049974909 849336869 /nfs/dbraw/zinc/33/68/69/849336869.db2.gz YTAZAANUGHZOLL-UHFFFAOYSA-N 0 3 406.448 4.291 20 0 HIADHN O=C(NCc1cccc(OCc2ccccn2)c1)c1cccc(CN2CCCC2)c1 ZINC000050032257 849343115 /nfs/dbraw/zinc/34/31/15/849343115.db2.gz URFJBQOQRWSTBC-UHFFFAOYSA-N 0 3 401.510 4.186 20 0 HIADHN S=C(NCCCCOCc1ccccc1)NC1CCN(Cc2ccccc2)CC1 ZINC000050252674 849365276 /nfs/dbraw/zinc/36/52/76/849365276.db2.gz AKCPJJYNCNNREV-UHFFFAOYSA-N 0 3 411.615 4.112 20 0 HIADHN CCOc1ccc(Cl)cc1[C@H](C)[NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1 ZINC000436828827 862010187 /nfs/dbraw/zinc/01/01/87/862010187.db2.gz NRZBZBTUIVGVGN-HNNXBMFYSA-N 0 3 402.922 4.400 20 0 HIADHN O=C(c1ccccc1[O-])N1CCC([NH2+][C@H]2CCCOc3cc4c(cc32)CCCC4)CC1 ZINC000436832818 862011837 /nfs/dbraw/zinc/01/18/37/862011837.db2.gz WIPPRPHAOOCWQD-QHCPKHFHSA-N 0 3 420.553 4.379 20 0 HIADHN C[C@H]([NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1)c1ccccc1OC(F)(F)F ZINC000436831904 862012415 /nfs/dbraw/zinc/01/24/15/862012415.db2.gz UNHURWCTTWRBNV-AWEZNQCLSA-N 0 3 408.420 4.246 20 0 HIADHN CN(CC(=O)N(C)Cc1ccc(Cl)s1)C[C@@H]1CCCO[C@@H]1c1ccccc1 ZINC000051132979 849434186 /nfs/dbraw/zinc/43/41/86/849434186.db2.gz BMTRIXHNBXHHHK-LAUBAEHRSA-N 0 3 406.979 4.460 20 0 HIADHN O=S(=O)(NC1CCN(C2c3ccccc3-c3ccccc32)CC1)c1ccccc1 ZINC000052383271 849575674 /nfs/dbraw/zinc/57/56/74/849575674.db2.gz VAONEAAOVHNGBK-UHFFFAOYSA-N 0 3 404.535 4.199 20 0 HIADHN COc1ccc(Br)cc1NC(=O)N(CCN(C)C)Cc1ccccc1 ZINC000052495011 849587932 /nfs/dbraw/zinc/58/79/32/849587932.db2.gz OBHJWLUCGSEREV-UHFFFAOYSA-N 0 3 406.324 4.053 20 0 HIADHN Cc1ccccc1CN1CCCN(C(=O)c2cc(F)cc3nc(C)c(C)nc32)CC1 ZINC000052777242 849627009 /nfs/dbraw/zinc/62/70/09/849627009.db2.gz TWPHFUZQNWTFQM-UHFFFAOYSA-N 0 3 406.505 4.042 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1ccc(NC(C)=O)c(SC)c1)c1ccsc1 ZINC000052877940 849637413 /nfs/dbraw/zinc/63/74/13/849637413.db2.gz KWOYWGNIRJXOIY-SFHVURJKSA-N 0 3 405.589 4.241 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cccc(NC(=O)c2ccco2)c1)c1ccsc1 ZINC000052877949 849637591 /nfs/dbraw/zinc/63/75/91/849637591.db2.gz CGHPDNUPHRZRHC-IBGZPJMESA-N 0 3 411.527 4.406 20 0 HIADHN CC(C)(C)OC(=O)NC1CCN(Cc2c(-c3ccccc3)nc3ccccn32)CC1 ZINC000052909373 849641022 /nfs/dbraw/zinc/64/10/22/849641022.db2.gz WMBVVOQRCSEDEI-UHFFFAOYSA-N 0 3 406.530 4.490 20 0 HIADHN CC(=O)c1c(C)cc(C)c(CN2CCC(C(=O)NCc3ccc(F)cc3)CC2)c1C ZINC000053049357 849658457 /nfs/dbraw/zinc/65/84/57/849658457.db2.gz SVFLPFIBZQPJCJ-UHFFFAOYSA-N 0 3 410.533 4.482 20 0 HIADHN COc1ccc(C[N@H+](Cc2nc3c4ccccc4oc3c(=O)[n-]2)[C@@H](C)C2CC2)cc1 ZINC000053098272 849666413 /nfs/dbraw/zinc/66/64/13/849666413.db2.gz LBRFKOKKBHLNDX-HNNXBMFYSA-N 0 3 403.482 4.479 20 0 HIADHN COc1ccc(C[N@@H+](Cc2nc3c4ccccc4oc3c(=O)[n-]2)[C@@H](C)C2CC2)cc1 ZINC000053098272 849666414 /nfs/dbraw/zinc/66/64/14/849666414.db2.gz LBRFKOKKBHLNDX-HNNXBMFYSA-N 0 3 403.482 4.479 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1ccc(CN2CCCCC2=O)cc1)c1ccsc1 ZINC000053501832 849722616 /nfs/dbraw/zinc/72/26/16/849722616.db2.gz VXMKWKCZKXYPKM-NRFANRHFSA-N 0 3 413.587 4.074 20 0 HIADHN Cc1ccccc1CN1CCC(NC(=O)CCC(=O)c2ccc(F)cc2F)CC1 ZINC000053968573 849785475 /nfs/dbraw/zinc/78/54/75/849785475.db2.gz RBYVIUIIBFRNKK-UHFFFAOYSA-N 0 3 400.469 4.017 20 0 HIADHN COc1cc(CNCc2cccc(-c3ccccc3)c2)ccc1OCC(=O)N(C)C ZINC000054175232 849821490 /nfs/dbraw/zinc/82/14/90/849821490.db2.gz WOVPHLFTOGZXQY-UHFFFAOYSA-N 0 3 404.510 4.119 20 0 HIADHN Cc1nn(Cc2ccccc2Cl)c(C)c1CNCCC(=O)NC1CCCCC1 ZINC000054203200 849826460 /nfs/dbraw/zinc/82/64/60/849826460.db2.gz LCSUMQJNFNEPGR-UHFFFAOYSA-N 0 3 402.970 4.130 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N(C)Cc2ccccc2N2CCCC2)C1 ZINC000054718921 849912465 /nfs/dbraw/zinc/91/24/65/849912465.db2.gz XUZXBJXUVMCALE-OFNKIYASSA-N 0 3 406.574 4.264 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N2CCC(c3nc4ccccc4[nH]3)CC2)C1 ZINC000054717627 849912877 /nfs/dbraw/zinc/91/28/77/849912877.db2.gz MQMWQCQAFUHDQK-NQIIRXRSSA-N 0 3 417.557 4.287 20 0 HIADHN Cc1ccc([C@H](C)NC(=O)NCCCCN2CCN(c3ccccc3)CC2)s1 ZINC000054734032 849915819 /nfs/dbraw/zinc/91/58/19/849915819.db2.gz UVRPFYQDJBQFIW-IBGZPJMESA-N 0 3 400.592 4.019 20 0 HIADHN C[C@H](NCc1cccc(OC2CCCC2)c1)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000054808671 849926376 /nfs/dbraw/zinc/92/63/76/849926376.db2.gz RJKRCQZXSUYRCN-KRWDZBQOSA-N 0 3 402.560 4.109 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)N1CCC[C@H](c2nc3ccccc3[nH]2)C1 ZINC000054920997 849942483 /nfs/dbraw/zinc/94/24/83/849942483.db2.gz IDYJDIFVHYSFFH-REWPJTCUSA-N 0 3 417.557 4.289 20 0 HIADHN O=C(Nc1ccccc1)NC1CCN(CCOc2ccc(Br)cc2)CC1 ZINC000055030190 849958367 /nfs/dbraw/zinc/95/83/67/849958367.db2.gz UOLOIHNEHOFKET-UHFFFAOYSA-N 0 3 418.335 4.114 20 0 HIADHN CCOc1ccc(NC(=O)[C@@H](C)N[C@H](C)c2ccc(NC(=O)NC3CC3)cc2)cc1 ZINC000056159753 850262489 /nfs/dbraw/zinc/26/24/89/850262489.db2.gz IQQJRYMCUZRKFB-HZPDHXFCSA-N 0 3 410.518 4.047 20 0 HIADHN CCN1CCN(c2ccc(N[C@H](C)C(=O)Nc3ccc(SC)cc3)c(C)c2)CC1 ZINC000056170399 850269620 /nfs/dbraw/zinc/26/96/20/850269620.db2.gz MTZDZHLDWILVDY-GOSISDBHSA-N 0 3 412.603 4.298 20 0 HIADHN Cc1ccc(NC(=O)[C@@H](NC2CCN(Cc3ccncc3)CC2)c2ccccc2)cc1 ZINC000056195791 850279757 /nfs/dbraw/zinc/27/97/57/850279757.db2.gz UPILYFXHPDLMFG-VWLOTQADSA-N 0 3 414.553 4.324 20 0 HIADHN CC[C@H](NC(=O)N(CCN(C)C)Cc1ccc(C)o1)c1ccccc1OC(F)F ZINC000056867430 850506685 /nfs/dbraw/zinc/50/66/85/850506685.db2.gz NTFXDGISCUSOPU-SFHVURJKSA-N 0 3 409.477 4.414 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)C1(c2ccc(F)cc2)CCOCC1)c1ccsc1 ZINC000057211910 850580160 /nfs/dbraw/zinc/58/01/60/850580160.db2.gz MXZRLYDMHHUSPG-FQEVSTJZSA-N 0 3 404.551 4.135 20 0 HIADHN CN(CC1CCN(c2cc[nH+]cc2)CC1)C(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436965372 862146433 /nfs/dbraw/zinc/14/64/33/862146433.db2.gz RQOHTWCSNXNAEV-UHFFFAOYSA-N 0 3 415.537 4.367 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)Nc2cc(NC(=O)C3CC3)ccc2C)N(C)C)cc1 ZINC000057543431 850665092 /nfs/dbraw/zinc/66/50/92/850665092.db2.gz MQTKZHOMLALSSP-JOCHJYFZSA-N 0 3 408.546 4.330 20 0 HIADHN Cc1cc(Br)cc(C)c1NC(=O)NC[C@@H](Cc1ccccc1)N(C)C ZINC000057773458 850712671 /nfs/dbraw/zinc/71/26/71/850712671.db2.gz XIMKSZXSYHIBSO-GOSISDBHSA-N 0 3 404.352 4.360 20 0 HIADHN COc1ccc([C@@H](CNC(=O)Nc2ccc3c(c2)OC(C)(C)O3)N2CCCC2)cc1 ZINC000057858928 850733861 /nfs/dbraw/zinc/73/38/61/850733861.db2.gz JAQBUQDVPQGZND-LJQANCHMSA-N 0 3 411.502 4.161 20 0 HIADHN COc1ccc(NC(=O)NC[C@@H](c2ccccc2)N(C)C)cc1OCc1ccncc1 ZINC000058024125 850752352 /nfs/dbraw/zinc/75/23/52/850752352.db2.gz LSAOWDKUHKOMBT-NRFANRHFSA-N 0 3 420.513 4.094 20 0 HIADHN COc1cc(CN(C)C[C@H](O)CO[C@@H]2CCCc3ccccc32)ccc1SC ZINC000058528020 850846603 /nfs/dbraw/zinc/84/66/03/850846603.db2.gz HUESNTUSKZUYAB-PZJWPPBQSA-N 0 3 401.572 4.304 20 0 HIADHN O=C(c1ccccc1[O-])N1CCC([NH2+]Cc2cc(Cl)cc(C(F)(F)F)c2)CC1 ZINC000437003095 862176901 /nfs/dbraw/zinc/17/69/01/862176901.db2.gz OLXWGOIZZBOJRG-UHFFFAOYSA-N 0 3 412.839 4.459 20 0 HIADHN CC(C)CN(CCN(C)C)C(=O)c1csc(-c2cc(Br)cs2)n1 ZINC000058882636 850950909 /nfs/dbraw/zinc/95/09/09/850950909.db2.gz TUESZEUCEKDNBK-UHFFFAOYSA-N 0 3 416.410 4.294 20 0 HIADHN COc1ccccc1CN(CCCc1nc(-c2cccs2)no1)C[C@@H]1CCCO1 ZINC000058919354 850957329 /nfs/dbraw/zinc/95/73/29/850957329.db2.gz BYNUKZMSNPNHHU-SFHVURJKSA-N 0 3 413.543 4.421 20 0 HIADHN COc1ccccc1C[C@H]1CCCN1C(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000058987957 850973943 /nfs/dbraw/zinc/97/39/43/850973943.db2.gz CCIACOQRBHUOPQ-JTHBVZDNSA-N 0 3 410.533 4.280 20 0 HIADHN CN(C)CCn1c(=O)oc2ccc(NC(=O)c3cc4ccc(C(C)(C)C)cc4[nH]3)cc21 ZINC000059003203 850977988 /nfs/dbraw/zinc/97/79/88/850977988.db2.gz CPUKUBDLDZCVLG-UHFFFAOYSA-N 0 3 420.513 4.187 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2cnn(-c3ccc(F)cc3)c2C(C)C)N(C)C)cc1 ZINC000060155792 851045806 /nfs/dbraw/zinc/04/58/06/851045806.db2.gz LYMMHCXBCWNWMK-JOCHJYFZSA-N 0 3 408.521 4.476 20 0 HIADHN Cc1cc(C)n(-c2ccc(C(=O)NC[C@H](c3ccc(C)cc3)N3CCCC3)cc2)n1 ZINC000060238970 851054796 /nfs/dbraw/zinc/05/47/96/851054796.db2.gz BQSBBPDWIWNHLK-XMMPIXPASA-N 0 3 402.542 4.364 20 0 HIADHN COc1cc(CN(C)C(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)ccc1SC ZINC000060469790 851110785 /nfs/dbraw/zinc/11/07/85/851110785.db2.gz OPPOOZUWBVSSSW-IBGZPJMESA-N 0 3 416.562 4.427 20 0 HIADHN CCN(C(=O)c1ccc(N2CCCC2=O)cc1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000060543832 851139768 /nfs/dbraw/zinc/13/97/68/851139768.db2.gz SAVYVEQXZHRHRC-CVDCTZTESA-N 0 3 405.542 4.111 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)c2cc(Cl)sc2Cl)CC1 ZINC000060551726 851144453 /nfs/dbraw/zinc/14/44/53/851144453.db2.gz HHVINYGCYOCIRF-UHFFFAOYSA-N 0 3 412.386 4.122 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)c3nc(-c4cccs4)oc3C)cc2)CC1 ZINC000060551985 851144519 /nfs/dbraw/zinc/14/45/19/851144519.db2.gz FZNKXSLINYVUGS-UHFFFAOYSA-N 0 3 410.543 4.101 20 0 HIADHN CC(C)(C)OC(=O)Nc1cccc(C(=O)N2CCN(CC3CCCCC3)CC2)c1 ZINC000060579668 851154838 /nfs/dbraw/zinc/15/48/38/851154838.db2.gz FDSFSXKOFGHWQV-UHFFFAOYSA-N 0 3 401.551 4.372 20 0 HIADHN O=C(NCc1sccc1Br)NC[C@H](c1cccs1)N1CCCC1 ZINC000060591852 851159089 /nfs/dbraw/zinc/15/90/89/851159089.db2.gz BPODBNFKFVAYDE-CYBMUJFWSA-N 0 3 414.394 4.208 20 0 HIADHN CN(C)[C@H](CNC(=O)N[C@H]1CCCc2cc(OC(F)F)ccc21)Cc1ccccc1 ZINC000060603703 851164097 /nfs/dbraw/zinc/16/40/97/851164097.db2.gz UTBICHGLNMZLSJ-RXVVDRJESA-N 0 3 417.500 4.138 20 0 HIADHN CC(C)[C@@H](CNc1nc(C2CC2)nc2sc3c(c21)CCCC3)N1CCN(C)CC1 ZINC000060858716 851232977 /nfs/dbraw/zinc/23/29/77/851232977.db2.gz QZWJICVAASEBOF-GOSISDBHSA-N 0 3 413.635 4.131 20 0 HIADHN CC(C)C(=O)NCCNCc1cn(-c2ccccc2)nc1-c1cc2ccccc2o1 ZINC000061014692 851273633 /nfs/dbraw/zinc/27/36/33/851273633.db2.gz SVRSSLPQCQSVCK-UHFFFAOYSA-N 0 3 402.498 4.147 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc(CNCc2ccc(C(F)(F)F)cc2)cc1 ZINC000061029368 851278242 /nfs/dbraw/zinc/27/82/42/851278242.db2.gz MGMQSGFPYYOTSG-UHFFFAOYSA-N 0 3 400.466 4.026 20 0 HIADHN CN(Cc1cc(Br)cs1)C[C@H](O)c1cccc(Br)c1 ZINC000061042563 851282060 /nfs/dbraw/zinc/28/20/60/851282060.db2.gz SQJIBNPRDIDQNO-AWEZNQCLSA-N 0 3 405.155 4.439 20 0 HIADHN CC(=O)Nc1c(C)ccc(NC(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)c1C ZINC000061187728 851312578 /nfs/dbraw/zinc/31/25/78/851312578.db2.gz BJRPHYOYIFMJJL-UHFFFAOYSA-N 0 3 408.546 4.045 20 0 HIADHN Cc1c(C(=O)Nc2ccc(CCN3CCSCC3)cc2)cnn1-c1cccc(C)c1 ZINC000061288172 851339528 /nfs/dbraw/zinc/33/95/28/851339528.db2.gz KDSIVLIBDUIUJX-UHFFFAOYSA-N 0 3 420.582 4.333 20 0 HIADHN Cc1ccc([C@H](CNC(=O)C2(c3ccc(F)cc3)CCOCC2)N2CCCC2)cc1 ZINC000061502425 851390136 /nfs/dbraw/zinc/39/01/36/851390136.db2.gz FJNQHBAUIIITCQ-QHCPKHFHSA-N 0 3 410.533 4.136 20 0 HIADHN O=C(NC[C@H]1CN2CCC[C@H]2CO1)c1ccc(-c2cc(Cl)cc(Cl)c2)s1 ZINC000061649102 851419620 /nfs/dbraw/zinc/41/96/20/851419620.db2.gz ITFUQSRQGWRMPH-HOTGVXAUSA-N 0 3 411.354 4.315 20 0 HIADHN CN(CCCOc1ccccc1)C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000061792944 851455743 /nfs/dbraw/zinc/45/57/43/851455743.db2.gz WUCRMRUOJUWPJA-UHFFFAOYSA-N 0 3 413.587 4.211 20 0 HIADHN C[C@H](CNC(=O)C(=O)Nc1ccc(SC2CCCC2)cc1)N1CCCC[C@@H]1C ZINC000062120548 851503345 /nfs/dbraw/zinc/50/33/45/851503345.db2.gz YUSSCPJRWHKYMX-DLBZAZTESA-N 0 3 403.592 4.039 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)Nc1cccc(Br)c1 ZINC000062368234 851530890 /nfs/dbraw/zinc/53/08/90/851530890.db2.gz VGPGMAIQHOJMMZ-UHFFFAOYSA-N 0 3 412.278 4.323 20 0 HIADHN CCOc1ccc(NC(=O)N(CCN(C)C)Cc2cccc(F)c2)cc1OCC ZINC000062375962 851533330 /nfs/dbraw/zinc/53/33/30/851533330.db2.gz CFRQVMNWOJPYGO-UHFFFAOYSA-N 0 3 403.498 4.219 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)Nc1ccc(F)cc1Br ZINC000062393789 851540008 /nfs/dbraw/zinc/54/00/08/851540008.db2.gz KSRNYAPOXPYGFT-UHFFFAOYSA-N 0 3 412.278 4.323 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)Nc1ccc(OC(F)F)c(F)c1 ZINC000062400699 851541651 /nfs/dbraw/zinc/54/16/51/851541651.db2.gz ZYPSLYHGDGHEBZ-UHFFFAOYSA-N 0 3 417.378 4.301 20 0 HIADHN CCN(CC)[C@H](CNCc1cc(Br)c2c(c1)OCCCO2)c1ccco1 ZINC000062423622 851549068 /nfs/dbraw/zinc/54/90/68/851549068.db2.gz ZZOISPVAUBMDQK-QGZVFWFLSA-N 0 3 423.351 4.376 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)NCCc1cccc(F)c1 ZINC000062476162 851558814 /nfs/dbraw/zinc/55/88/14/851558814.db2.gz CHXZHGZHWBPXRY-UHFFFAOYSA-N 0 3 411.443 4.160 20 0 HIADHN CC(C)Oc1ccc(CCNC(=O)N(CCN(C)C)Cc2ccc(F)cc2F)cc1 ZINC000062484934 851562454 /nfs/dbraw/zinc/56/24/54/851562454.db2.gz KLTHBKRDCWAJKS-UHFFFAOYSA-N 0 3 419.516 4.068 20 0 HIADHN CC(C)Oc1ccc([C@@H](C)NC(=O)N(CCN(C)C)Cc2cccc(F)c2)cc1 ZINC000062485263 851563027 /nfs/dbraw/zinc/56/30/27/851563027.db2.gz DVUZXNPAUMWQBA-GOSISDBHSA-N 0 3 401.526 4.447 20 0 HIADHN CC(C)COc1ccccc1CNC(=O)N(CCN(C)C)Cc1ccc(F)cc1F ZINC000062499280 851566444 /nfs/dbraw/zinc/56/64/44/851566444.db2.gz HHIHKLWEOURORV-UHFFFAOYSA-N 0 3 419.516 4.273 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)C(=O)Nc1cccc2ccccc21 ZINC000062593165 851580184 /nfs/dbraw/zinc/58/01/84/851580184.db2.gz PVJFUWRJEBETSS-UHFFFAOYSA-N 0 3 409.917 4.022 20 0 HIADHN COCCN(Cc1cccs1)C(=O)NC[C@H](c1ccccc1)N1CCC(C)CC1 ZINC000062647642 851584932 /nfs/dbraw/zinc/58/49/32/851584932.db2.gz YLZIANDFPMMNOB-JOCHJYFZSA-N 0 3 415.603 4.379 20 0 HIADHN CN1CCC[C@H](NC(=O)N[C@H](c2ccccc2)c2ccc(Br)cc2F)C1 ZINC000062647268 851585165 /nfs/dbraw/zinc/58/51/65/851585165.db2.gz JIKQDLFSXFYAHP-QFBILLFUSA-N 0 3 420.326 4.071 20 0 HIADHN Fc1ccc(SCCCNC(=S)NC2CCN(Cc3ccccc3)CC2)cc1 ZINC000063144001 851620194 /nfs/dbraw/zinc/62/01/94/851620194.db2.gz XJXAZAADWOKYDA-UHFFFAOYSA-N 0 3 417.619 4.437 20 0 HIADHN C[C@@H](NC(=S)NC1CCN(Cc2ccccc2)CC1)c1ccc(OC(F)F)cc1 ZINC000063147619 851622010 /nfs/dbraw/zinc/62/20/10/851622010.db2.gz AZXNSJPKYKLPQO-MRXNPFEDSA-N 0 3 419.541 4.478 20 0 HIADHN Cc1cccn2cc(COc3ccc(CNCc4cccnc4-n4cccn4)cc3)nc12 ZINC000063313180 851659024 /nfs/dbraw/zinc/65/90/24/851659024.db2.gz PLXBIXQAMPSPAG-UHFFFAOYSA-N 0 3 424.508 4.092 20 0 HIADHN CC(C)N(C)S(=O)(=O)c1ccc(CNCc2cccc(OC3CCCC3)c2)cc1 ZINC000063526055 851707435 /nfs/dbraw/zinc/70/74/35/851707435.db2.gz RWYFFWHRPHPHSI-UHFFFAOYSA-N 0 3 416.587 4.327 20 0 HIADHN CC(C)N(C)S(=O)(=O)c1ccc(CNCc2cccc(C(F)(F)F)c2)cc1 ZINC000063546329 851711759 /nfs/dbraw/zinc/71/17/59/851711759.db2.gz VTHJDGWVINZXDG-UHFFFAOYSA-N 0 3 400.466 4.024 20 0 HIADHN O=C(CN1CCN(CC2CCCCC2)CC1)Nc1ccc(OC(F)F)c(Cl)c1 ZINC000064129729 851832636 /nfs/dbraw/zinc/83/26/36/851832636.db2.gz HLXLBQWAXIHNNZ-UHFFFAOYSA-N 0 3 415.912 4.078 20 0 HIADHN C[C@@H](C(=O)N(c1nccs1)C1CCCCC1)N1CCN(CC2CCCCC2)CC1 ZINC000064129376 851832984 /nfs/dbraw/zinc/83/29/84/851832984.db2.gz NCUUTVKAVVAQCJ-IBGZPJMESA-N 0 3 418.651 4.395 20 0 HIADHN C[C@H]1CCN(C(=O)CN2CCN(CC3CCCCC3)CC2)c2ccccc2S1 ZINC000064129765 851833903 /nfs/dbraw/zinc/83/39/03/851833903.db2.gz GHZKYMDNEGWBPX-IBGZPJMESA-N 0 3 401.620 4.102 20 0 HIADHN CC(C)(C)C[C@H]1CCCN1C(=O)NCCCCN1CCN(c2ccccc2)CC1 ZINC000064224762 851850507 /nfs/dbraw/zinc/85/05/07/851850507.db2.gz NHWGGDKOYSBXJQ-JOCHJYFZSA-N 0 3 400.611 4.199 20 0 HIADHN O=C(NCCc1c[nH]c2ccccc12)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000064334509 851874315 /nfs/dbraw/zinc/87/43/15/851874315.db2.gz QWDUKODDOPFDLK-JOCHJYFZSA-N 0 3 415.459 4.281 20 0 HIADHN CN(CC(=O)C(C#N)c1nc(-c2c(F)cccc2F)cs1)C(=O)c1cccs1 ZINC000064715219 851964748 /nfs/dbraw/zinc/96/47/48/851964748.db2.gz TXPNRBXNEAUVRC-LLVKDONJSA-N 0 3 417.462 4.098 20 0 HIADHN COc1cc(CNCc2ccc(-n3ccc(C(F)(F)F)n3)cc2)cc(OC)c1OC ZINC000065014677 852039820 /nfs/dbraw/zinc/03/98/20/852039820.db2.gz WNHRPMFZGATKII-UHFFFAOYSA-N 0 3 421.419 4.207 20 0 HIADHN c1ccc(Oc2cccc(CNCc3cccc(OCCN4CCOCC4)c3)c2)cc1 ZINC000065014183 852040499 /nfs/dbraw/zinc/04/04/99/852040499.db2.gz UYFBPWMDMHXLDO-UHFFFAOYSA-N 0 3 418.537 4.480 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1csc(COC)n1)c1ccc(C(F)(F)F)cc1 ZINC000065121496 852071090 /nfs/dbraw/zinc/07/10/90/852071090.db2.gz LWTGBDQKJHKJBB-INIZCTEOSA-N 0 3 415.481 4.121 20 0 HIADHN O=C(Nc1cccc(CN2CCCCC2=O)c1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000065166641 852083634 /nfs/dbraw/zinc/08/36/34/852083634.db2.gz NFKYAEBIKXIMKI-NRFANRHFSA-N 0 3 423.532 4.189 20 0 HIADHN Cc1ccc(C(=O)NC2CCN(Cc3ccc(OCc4ccccn4)cc3)CC2)s1 ZINC000065261722 852094562 /nfs/dbraw/zinc/09/45/62/852094562.db2.gz APUCXRKRFUEYJD-UHFFFAOYSA-N 0 3 421.566 4.425 20 0 HIADHN CCCNC(=O)c1ccc(NC(=O)NC[C@H](c2ccc(C)cc2)N(C)C)cc1Cl ZINC000065416218 852124704 /nfs/dbraw/zinc/12/47/04/852124704.db2.gz DMLSOPLUTHCPKW-HXUWFJFHSA-N 0 3 416.953 4.213 20 0 HIADHN COc1cc(OC)cc(Oc2ccc(CNCc3cccnc3-n3ccnc3)cc2)c1 ZINC000065428848 852129441 /nfs/dbraw/zinc/12/94/41/852129441.db2.gz XDTJWNQNMVJLLN-UHFFFAOYSA-N 0 3 416.481 4.367 20 0 HIADHN Cc1cc(Oc2ncccn2)ccc1NC(=O)NCCCN1CCc2ccccc2C1 ZINC000065482569 852153888 /nfs/dbraw/zinc/15/38/88/852153888.db2.gz UXWYNAFGBZPZGN-UHFFFAOYSA-N 0 3 417.513 4.147 20 0 HIADHN CC(=O)Nc1ccc(NC(=S)N(CCN(C)C)Cc2cccc(Cl)c2)cc1 ZINC000065704355 852224840 /nfs/dbraw/zinc/22/48/40/852224840.db2.gz DAEVCFVAQDQEFK-UHFFFAOYSA-N 0 3 404.967 4.059 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N(Cc3ccco3)Cc3ccco3)cc2)CC1 ZINC000065749755 852244705 /nfs/dbraw/zinc/24/47/05/852244705.db2.gz CKJYCSLPRRULHT-UHFFFAOYSA-N 0 3 407.514 4.246 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)Nc1ccc(Cl)nc1 ZINC000065828605 852272162 /nfs/dbraw/zinc/27/21/62/852272162.db2.gz TVNGUJBXAOKBKZ-UHFFFAOYSA-N 0 3 400.832 4.350 20 0 HIADHN CN(c1ccccc1)C1CCN(C(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)CC1 ZINC000065876005 852297258 /nfs/dbraw/zinc/29/72/58/852297258.db2.gz DEBJQZOKERCYAR-NRFANRHFSA-N 0 3 409.549 4.165 20 0 HIADHN O=C(NCc1ccc(N2CCCCC2)cc1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000065901430 852309918 /nfs/dbraw/zinc/30/99/18/852309918.db2.gz CYUWKUKYBXDTCZ-JOCHJYFZSA-N 0 3 409.549 4.344 20 0 HIADHN CC(C)C(=O)Nc1ccc(C(=O)N(CCN(C)C)Cc2cccc(Cl)c2)cc1 ZINC000065936762 852325088 /nfs/dbraw/zinc/32/50/88/852325088.db2.gz ODLWHMFSHPWFJJ-UHFFFAOYSA-N 0 3 401.938 4.139 20 0 HIADHN CC(C)Oc1ccc(C(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)cn1 ZINC000065936342 852325426 /nfs/dbraw/zinc/32/54/26/852325426.db2.gz BGISJEILNICPFP-UHFFFAOYSA-N 0 3 409.452 4.092 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)c1cnn(-c2cccc(Cl)c2)c1 ZINC000065937469 852326332 /nfs/dbraw/zinc/32/63/32/852326332.db2.gz KSBVEVKGZUYXRL-UHFFFAOYSA-N 0 3 418.875 4.008 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)Cc1csc(-c2ccccc2)n1 ZINC000065938192 852326511 /nfs/dbraw/zinc/32/65/11/852326511.db2.gz BEACQOZJWOEILF-UHFFFAOYSA-N 0 3 415.509 4.221 20 0 HIADHN Cc1nc2cc(F)ccc2cc1C(=O)N(CCN(C)C)Cc1ccc(F)cc1F ZINC000065937845 852326782 /nfs/dbraw/zinc/32/67/82/852326782.db2.gz KWLUFASOCOIYEQ-UHFFFAOYSA-N 0 3 401.432 4.165 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)CCCc1ncc(-c2ccccc2)o1 ZINC000065939553 852328305 /nfs/dbraw/zinc/32/83/05/852328305.db2.gz JEOYOGKDOSTHBA-UHFFFAOYSA-N 0 3 409.505 4.394 20 0 HIADHN C=CCSc1nc2ccccc2n1CN1CCC(NC(=O)C2CCCCC2)CC1 ZINC000065943943 852329864 /nfs/dbraw/zinc/32/98/64/852329864.db2.gz ZXCRZJSSFYFNJR-UHFFFAOYSA-N 0 3 412.603 4.433 20 0 HIADHN COc1cccc(CNC[C@H](c2ccc(Cl)cc2)N2CCOCC2)c1OC(C)C ZINC000065981687 852340157 /nfs/dbraw/zinc/34/01/57/852340157.db2.gz BNRLGKZGGYZCEK-OAQYLSRUSA-N 0 3 418.965 4.299 20 0 HIADHN Cc1ccc(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)cc1NC(=O)c1ccco1 ZINC000069251111 852389992 /nfs/dbraw/zinc/38/99/92/852389992.db2.gz DKJUXSKFTJNJMV-QFIPXVFZSA-N 0 3 417.509 4.407 20 0 HIADHN C[C@H](NC(=O)NC[C@@H](c1ccccc1)N1CCCC1)c1ccc(OC(F)F)cc1 ZINC000071913299 852430011 /nfs/dbraw/zinc/43/00/11/852430011.db2.gz GIOLKJKUEKTGSC-JXFKEZNVSA-N 0 3 403.473 4.485 20 0 HIADHN Cc1nn(Cc2ccc(F)cc2)c(Cl)c1CNCCCN(C)CC(F)(F)F ZINC000071947092 852441612 /nfs/dbraw/zinc/44/16/12/852441612.db2.gz HELZLKIIRZBENP-UHFFFAOYSA-N 0 3 406.855 4.006 20 0 HIADHN COc1ccc(CC[C@@H](C)NC(=O)NC[C@H](c2cccs2)N2CCCC2)cc1 ZINC000072044460 852484339 /nfs/dbraw/zinc/48/43/39/852484339.db2.gz WGIFTUKIRQTYPX-YLJYHZDGSA-N 0 3 401.576 4.214 20 0 HIADHN Cc1ccc2c(c1)[nH]cc2C1=CCN(C[C@H](O)COc2cccc3[nH]ccc32)CC1 ZINC000077859753 852511984 /nfs/dbraw/zinc/51/19/84/852511984.db2.gz JIZFSRRYEZFOJK-IBGZPJMESA-N 0 3 401.510 4.487 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)Nc1ccc(Oc2ccncc2)cc1 ZINC000078872172 852531274 /nfs/dbraw/zinc/53/12/74/852531274.db2.gz QQXXWPPIEHGKIQ-UHFFFAOYSA-N 0 3 416.525 4.415 20 0 HIADHN CN(C)C(=O)c1ccc(NC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)cc1Cl ZINC000096626655 852553020 /nfs/dbraw/zinc/55/30/20/852553020.db2.gz DQCSYSRIJUAYIV-INIZCTEOSA-N 0 3 417.912 4.032 20 0 HIADHN C[C@H](SCC(=O)N[C@@H](CN1CCCC1)c1ccccc1)c1nc2ccccc2[nH]1 ZINC000097121355 852584088 /nfs/dbraw/zinc/58/40/88/852584088.db2.gz VXVAKVJDZPVIDD-UWJYYQICSA-N 0 3 408.571 4.310 20 0 HIADHN CCc1c(C(=O)NC[C@H](c2ccccc2)N2CCCC2)cnn1Cc1ccccc1 ZINC000097295251 852598664 /nfs/dbraw/zinc/59/86/64/852598664.db2.gz PSJVUBPTYIIYAO-XMMPIXPASA-N 0 3 402.542 4.061 20 0 HIADHN CCOc1c(Br)cc(CN[C@H](C)c2ccc(NC(N)=O)cc2)cc1OC ZINC000097393849 852607083 /nfs/dbraw/zinc/60/70/83/852607083.db2.gz OUDBDRVVRATCTQ-GFCCVEGCSA-N 0 3 422.323 4.198 20 0 HIADHN CC(C)CN1CCN(CC(=O)Nc2nc(-c3ccccc3)c(C(C)C)s2)CC1 ZINC000097474547 852615820 /nfs/dbraw/zinc/61/58/20/852615820.db2.gz GIIBQTBNIAZCJD-UHFFFAOYSA-N 0 3 400.592 4.146 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)Nc1cccc(C[S@@](=O)C(C)(C)C)c1 ZINC000097573807 852634066 /nfs/dbraw/zinc/63/40/66/852634066.db2.gz CCLPKXOWXXZFQL-LJAQVGFWSA-N 0 3 415.603 4.330 20 0 HIADHN C[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)NCC1(N2CCSCC2)CCCC1 ZINC000097592659 852640604 /nfs/dbraw/zinc/64/06/04/852640604.db2.gz IORONZDWXCGHKF-MRXNPFEDSA-N 0 3 414.537 4.362 20 0 HIADHN C=CCn1c(-c2ccc(Cl)cc2)nn(CN2CCN(CC(C)C)CC2)c1=S ZINC000104751659 852675874 /nfs/dbraw/zinc/67/58/74/852675874.db2.gz DCONDLXUIZMYCW-UHFFFAOYSA-N 0 3 405.999 4.152 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(Br)cc1 ZINC000105292539 852697349 /nfs/dbraw/zinc/69/73/49/852697349.db2.gz QSKKFSSOCIBXPU-HNAYVOBHSA-N 0 3 402.336 4.084 20 0 HIADHN c1ccc2c(c1)nc(-c1ccncc1)nc2NCC1(N2CCOCC2)CCCCC1 ZINC000105567282 852714062 /nfs/dbraw/zinc/71/40/62/852714062.db2.gz ZKHDGYFCPJIATB-UHFFFAOYSA-N 0 3 403.530 4.139 20 0 HIADHN Cc1ccc([C@@H]2CCCN2CC(=O)N2CCC(C(=O)Nc3ccccc3)CC2)cc1 ZINC000105732493 852725007 /nfs/dbraw/zinc/72/50/07/852725007.db2.gz AUFLVDLXCQVHFI-QHCPKHFHSA-N 0 3 405.542 4.009 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cnn(-c4ccc(Cl)cc4)c3)c(C)c2)CC1 ZINC000107851122 852803012 /nfs/dbraw/zinc/80/30/12/852803012.db2.gz ZEPCQHGXGRZSNP-UHFFFAOYSA-N 0 3 423.948 4.228 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1nnn(-c2cccc(Cl)c2)c1C)c1ccsc1 ZINC000108409487 852848019 /nfs/dbraw/zinc/84/80/19/852848019.db2.gz WFOODKDGXIOLFM-SFHVURJKSA-N 0 3 417.966 4.104 20 0 HIADHN Cc1nc(CC(=O)N(CCN2CCCC2)Cc2ccc(Cl)c(Cl)c2)cs1 ZINC000109370925 852960781 /nfs/dbraw/zinc/96/07/81/852960781.db2.gz DVBYTTAIAAACFK-UHFFFAOYSA-N 0 3 412.386 4.425 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)c1ccc(OCC(F)(F)F)cc1 ZINC000109484637 852975830 /nfs/dbraw/zinc/97/58/30/852975830.db2.gz URBRNCJFNMLSFH-UHFFFAOYSA-N 0 3 424.488 4.471 20 0 HIADHN O=C(Nc1ccc(N2CCCC2)nc1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000109547839 852982798 /nfs/dbraw/zinc/98/27/98/852982798.db2.gz HZMNQBSBRDGQOE-OAQYLSRUSA-N 0 3 418.463 4.075 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1 ZINC000109769898 853011651 /nfs/dbraw/zinc/01/16/51/853011651.db2.gz XCEQWJSQABVZDB-VQTJNVASSA-N 0 3 419.338 4.282 20 0 HIADHN Cc1c(NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)cccc1C(=O)N1CCCC1 ZINC000109780133 853013955 /nfs/dbraw/zinc/01/39/55/853013955.db2.gz AEYBGMKRSMGTGP-HXUWFJFHSA-N 0 3 423.532 4.221 20 0 HIADHN CN(C(=O)CCc1ccc(Cl)cc1Cl)C1CCN(CCc2ccccn2)CC1 ZINC000109809410 853017420 /nfs/dbraw/zinc/01/74/20/853017420.db2.gz MQENENSNCANFEQ-UHFFFAOYSA-N 0 3 420.384 4.487 20 0 HIADHN CN(C(=O)CCCOc1ccc(Cl)cc1)C1CCN(CCc2ccccn2)CC1 ZINC000109810584 853018684 /nfs/dbraw/zinc/01/86/84/853018684.db2.gz RCAVSVPROBAZJX-UHFFFAOYSA-N 0 3 415.965 4.060 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)Nc1cccc(OCc2cscn2)c1 ZINC000109996940 853042756 /nfs/dbraw/zinc/04/27/56/853042756.db2.gz ZCVSTWAAUGJFER-UHFFFAOYSA-N 0 3 410.543 4.318 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CC[C@H](c2ccc(OC)cc2)C1)c1ccsc1 ZINC000110066723 853055553 /nfs/dbraw/zinc/05/55/53/853055553.db2.gz MOXHYZHWBPPNSY-RXVVDRJESA-N 0 3 401.576 4.339 20 0 HIADHN COc1ccc(CCCNC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)cc1 ZINC000110120451 853062421 /nfs/dbraw/zinc/06/24/21/853062421.db2.gz IGASVPAPTOAATB-JOCHJYFZSA-N 0 3 420.475 4.199 20 0 HIADHN O=C(NCCc1c(F)cccc1F)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000110123442 853062491 /nfs/dbraw/zinc/06/24/91/853062491.db2.gz BHBVYIDCWDGAHU-FQEVSTJZSA-N 0 3 412.402 4.078 20 0 HIADHN COC(=O)Nc1ccc(NC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)cc1 ZINC000110126107 853063952 /nfs/dbraw/zinc/06/39/52/853063952.db2.gz POYHOSDZHZPXIS-HXUWFJFHSA-N 0 3 421.419 4.258 20 0 HIADHN CCCN(CC(=O)Nc1ccc(C)c(C)c1)C1CCN(C(=O)c2ccccc2)CC1 ZINC000110294361 853083575 /nfs/dbraw/zinc/08/35/75/853083575.db2.gz MWOFRIVXCCUJDD-UHFFFAOYSA-N 0 3 407.558 4.259 20 0 HIADHN Cc1nc(-c2ccccc2)ccc1C(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000110413817 853096521 /nfs/dbraw/zinc/09/65/21/853096521.db2.gz YPKLALQJHXPVQW-KDURUIRLSA-N 0 3 407.558 4.018 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)CCSc3ccc(Cl)cc3)CC2)C[C@H](C)O1 ZINC000110452888 853101047 /nfs/dbraw/zinc/10/10/47/853101047.db2.gz UZBMUDAFHIKBPI-IRXDYDNUSA-N 0 3 411.011 4.170 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Cc3coc4ccc5ccccc5c34)CC2)C[C@H](C)O1 ZINC000110453741 853101281 /nfs/dbraw/zinc/10/12/81/853101281.db2.gz QKWWRZXKSJPPQD-KDURUIRLSA-N 0 3 420.553 4.476 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)c3ccccc3Oc3ccccc3)CC2)C[C@H](C)O1 ZINC000110457570 853102466 /nfs/dbraw/zinc/10/24/66/853102466.db2.gz LLSXILXCUBADMF-BGYRXZFFSA-N 0 3 408.542 4.440 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3cc(Cl)cc(Cl)c3)CC2)C[C@@H](C)O1 ZINC000110715661 853142795 /nfs/dbraw/zinc/14/27/95/853142795.db2.gz ZULDPTTVXAJXHB-ZIAGYGMSSA-N 0 3 400.350 4.347 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3ccc(OC4CCCC4)cc3)CC2)C[C@H](C)O1 ZINC000110727306 853145065 /nfs/dbraw/zinc/14/50/65/853145065.db2.gz MMVWXUDRCRROST-KDURUIRLSA-N 0 3 415.578 4.361 20 0 HIADHN CN1CCN(Cc2cccc(CNC(=O)c3ccc(-c4ccccc4Cl)o3)c2)CC1 ZINC000110814303 853154279 /nfs/dbraw/zinc/15/42/79/853154279.db2.gz VFSTWRIPOSESLQ-UHFFFAOYSA-N 0 3 423.944 4.277 20 0 HIADHN CC(C)c1cc(C(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)nn1C(C)(C)C ZINC000116072746 853281342 /nfs/dbraw/zinc/28/13/42/853281342.db2.gz QCHAUQASENAHCO-UHFFFAOYSA-N 0 3 406.521 4.244 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)c2ccc(NC(=O)c3cccs3)cc2)o1 ZINC000116101637 853283287 /nfs/dbraw/zinc/28/32/87/853283287.db2.gz GVHZFVHMVOABQL-UHFFFAOYSA-N 0 3 411.527 4.106 20 0 HIADHN CCN(C(=O)c1cccc(NC(=O)C2CC2)c1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000116348899 853298544 /nfs/dbraw/zinc/29/85/44/853298544.db2.gz UYHRYBOSESUZRF-MBSDFSHPSA-N 0 3 405.542 4.333 20 0 HIADHN Cc1nc(C(=O)NC2CCN(Cc3ccccc3)CC2)nn1-c1ccccc1C(C)C ZINC000116421404 853302826 /nfs/dbraw/zinc/30/28/26/853302826.db2.gz AECCYHJTWAJZEH-UHFFFAOYSA-N 0 3 417.557 4.094 20 0 HIADHN NC(=O)[C@@H]1CCCN(Cc2ccccc2NC(=O)CCc2ccc3ccccc3c2)C1 ZINC000116438563 853303512 /nfs/dbraw/zinc/30/35/12/853303512.db2.gz RTDDXMBQHMCPPZ-HSZRJFAPSA-N 0 3 415.537 4.108 20 0 HIADHN CC(C)(C)CCN1CCN(Cc2nnc(-c3ccccc3Br)o2)CC1 ZINC000117578673 853360992 /nfs/dbraw/zinc/36/09/92/853360992.db2.gz QINSKHTWHPUMNX-UHFFFAOYSA-N 0 3 407.356 4.053 20 0 HIADHN CCN(C(=O)Nc1cc(Cl)c(OC)cc1OC)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000138502174 853388481 /nfs/dbraw/zinc/38/84/81/853388481.db2.gz SXGAXMPZKQHGAH-QGZVFWFLSA-N 0 3 417.937 4.486 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2cccc(Cn3cccn3)c2)N2CCCC2)cc1 ZINC000139392959 853408915 /nfs/dbraw/zinc/40/89/15/853408915.db2.gz NEEONEDLODUIFN-HSZRJFAPSA-N 0 3 403.530 4.198 20 0 HIADHN CC(=O)Nc1cc(NC(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)c(F)cc1F ZINC000139774258 853421638 /nfs/dbraw/zinc/42/16/38/853421638.db2.gz LMLNEKVUZCMPFC-OAQYLSRUSA-N 0 3 416.472 4.190 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2ccc(Cn3cccn3)cc2)N2CCCC2)cc1 ZINC000139762591 853421725 /nfs/dbraw/zinc/42/17/25/853421725.db2.gz XDHDKAPEYDFXOW-HSZRJFAPSA-N 0 3 403.530 4.198 20 0 HIADHN Cc1cc(Cl)ccc1NC(=O)[C@H](C)N[C@H](C)c1ccc(N2CCOCC2)cc1 ZINC000140188157 853437521 /nfs/dbraw/zinc/43/75/21/853437521.db2.gz LQPUXPFCHUQBNK-SJORKVTESA-N 0 3 401.938 4.163 20 0 HIADHN CCCc1ccc([C@@H](NC(=O)NC2CCN(CCOC)CC2)c2cccs2)cc1 ZINC000140252537 853440153 /nfs/dbraw/zinc/44/01/53/853440153.db2.gz KGQKHJLQXLLGML-JOCHJYFZSA-N 0 3 415.603 4.200 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)Cc1cccc2cccnc21 ZINC000140896267 853455950 /nfs/dbraw/zinc/45/59/50/853455950.db2.gz NFGJNVLQAWYUQW-UHFFFAOYSA-N 0 3 415.459 4.387 20 0 HIADHN O=C(CCN1CCN(CCc2cccs2)CC1)Nc1cc(Cl)ccc1Cl ZINC000141409784 853470939 /nfs/dbraw/zinc/47/09/39/853470939.db2.gz PSJPZHIFCXUWPS-UHFFFAOYSA-N 0 3 412.386 4.244 20 0 HIADHN CC(=O)Nc1cccc([C@H](C)NC(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)c1 ZINC000141738378 853479669 /nfs/dbraw/zinc/47/96/69/853479669.db2.gz BFYDLKDIGWXRGF-MBSDFSHPSA-N 0 3 408.546 4.151 20 0 HIADHN CSc1cc(C(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)ccc1NC(C)=O ZINC000143060171 853507075 /nfs/dbraw/zinc/50/70/75/853507075.db2.gz OXEXITAEEAXDKC-NRFANRHFSA-N 0 3 411.571 4.242 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CNC[C@H](O)c1ccc(OC(F)(F)F)cc1 ZINC000143076235 853507663 /nfs/dbraw/zinc/50/76/63/853507663.db2.gz CFRWOJPBJYPVAZ-NRFANRHFSA-N 0 3 419.447 4.270 20 0 HIADHN Cc1nn(C(F)F)c(C)c1CC(=O)C(C#N)C(=O)Nc1ccc(Cl)cc1Cl ZINC000143147914 853508566 /nfs/dbraw/zinc/50/85/66/853508566.db2.gz CYCMJFXQXSIFKL-GFCCVEGCSA-N 0 3 415.227 4.092 20 0 HIADHN Cc1cccc(NC(=O)[C@H]2CCCN(Cc3ccc(OCc4ccncc4)cc3)C2)n1 ZINC000143403547 853514118 /nfs/dbraw/zinc/51/41/18/853514118.db2.gz DJAILCLXIBAIEH-QFIPXVFZSA-N 0 3 416.525 4.215 20 0 HIADHN COc1cc(CNCc2ccc(S(C)(=O)=O)cc2)c(-c2ccccc2)cc1OC ZINC000145902524 853560466 /nfs/dbraw/zinc/56/04/66/853560466.db2.gz GQNJHEDPXJKAEC-UHFFFAOYSA-N 0 3 411.523 4.064 20 0 HIADHN CCCN(C(=O)C(=O)Nc1cccc(CN(C)C)c1)[C@@H](C)c1cc2ccccc2o1 ZINC000146463298 853570266 /nfs/dbraw/zinc/57/02/66/853570266.db2.gz ZDSYUROBRJDNAY-KRWDZBQOSA-N 0 3 407.514 4.433 20 0 HIADHN COc1cccc(NC(=O)C(C#N)C(=O)c2cnc(-c3ccc(C)cc3C)s2)c1 ZINC000147050523 853581212 /nfs/dbraw/zinc/58/12/12/853581212.db2.gz BEXRZCVAFWJZRL-SFHVURJKSA-N 0 3 405.479 4.397 20 0 HIADHN CCCCCCNC(=O)C(C#N)C(=O)Cc1csc(-c2ccc(Cl)s2)n1 ZINC000148949125 853616101 /nfs/dbraw/zinc/61/61/01/853616101.db2.gz LBLTVIKLXYDWLW-CYBMUJFWSA-N 0 3 409.964 4.473 20 0 HIADHN O=C(OCc1csc([N+](=O)[O-])c1)C1CCN(c2cc(Cl)ccc2Cl)C1=O ZINC000149191979 853620190 /nfs/dbraw/zinc/62/01/90/853620190.db2.gz OGFLSXFPXRXEJT-LLVKDONJSA-N 0 3 415.254 4.059 20 0 HIADHN C[C@H]1CN(C(=O)c2ccc(CNCc3ccc(C(F)(F)F)cc3)cc2)C[C@H](C)O1 ZINC000165978392 853654107 /nfs/dbraw/zinc/65/41/07/853654107.db2.gz WLECWGPQXSKIIE-HOTGVXAUSA-N 0 3 406.448 4.245 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)c1cc(-c2ccc(Cl)cc2)on1 ZINC000195592807 853702677 /nfs/dbraw/zinc/70/26/77/853702677.db2.gz LERDJFRTKXPQEX-UHFFFAOYSA-N 0 3 401.869 4.338 20 0 HIADHN O=C(NC[C@@H]1CCCO[C@@H]1c1ccccc1)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000195660648 853743592 /nfs/dbraw/zinc/74/35/92/853743592.db2.gz ICINIYZMJSUSRY-RBZQAINGSA-N 0 3 407.558 4.118 20 0 HIADHN COc1ccc([C@@H](NCC(=O)NCc2ccc(F)cc2C(F)(F)F)C2CC2)cc1 ZINC000195668016 853747587 /nfs/dbraw/zinc/74/75/87/853747587.db2.gz IOQYCYDKDHNVAW-FQEVSTJZSA-N 0 3 410.411 4.210 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cc(C)nc4onc(C(C)C)c43)c(C)c2)CC1 ZINC000195690758 853759828 /nfs/dbraw/zinc/75/98/28/853759828.db2.gz BNLWGXHAWRYVQI-UHFFFAOYSA-N 0 3 421.545 4.357 20 0 HIADHN COc1cccc([C@H](CNC(=O)NCCc2ccccc2Cl)N2CCCC2)c1 ZINC000195720613 853777593 /nfs/dbraw/zinc/77/75/93/853777593.db2.gz UCMUPPBEIDYBGT-NRFANRHFSA-N 0 3 401.938 4.027 20 0 HIADHN CCOC(=O)/C=C\c1ccc(NC(=O)NC[C@@H](c2cccs2)N2CCCC2)cc1 ZINC000207948613 853805690 /nfs/dbraw/zinc/80/56/90/853805690.db2.gz KZMQEBUSJKDOKK-ADYPVZHUSA-N 0 3 413.543 4.283 20 0 HIADHN COc1c(Br)cc(CNCc2cccc(CO)c2)cc1Br ZINC000222112848 853876834 /nfs/dbraw/zinc/87/68/34/853876834.db2.gz MOJBZCXENMOYBJ-UHFFFAOYSA-N 0 3 415.125 4.002 20 0 HIADHN CCC(CC)[C@H](O)CNCc1cc(Br)cc(Br)c1OC ZINC000225818187 853880125 /nfs/dbraw/zinc/88/01/25/853880125.db2.gz IHNMHUVBFJZUDN-CQSZACIVSA-N 0 3 409.162 4.107 20 0 HIADHN Brc1ccc(-c2c[nH]c(CNC[C@@H]3CCN(c4ccccc4)C3)n2)cc1 ZINC000236622669 853904075 /nfs/dbraw/zinc/90/40/75/853904075.db2.gz PBPLPVDONWEVIH-INIZCTEOSA-N 0 3 411.347 4.455 20 0 HIADHN CC(C)(C)c1nn(-c2ccccc2)cc1CNCCCS(=O)(=O)c1ccccc1 ZINC000236653920 853908248 /nfs/dbraw/zinc/90/82/48/853908248.db2.gz QAHFVBHMHZGGJQ-UHFFFAOYSA-N 0 3 411.571 4.123 20 0 HIADHN CCOc1c(Br)cc(CNC[C@H](c2ccco2)N2CCCC2)cc1OC ZINC000237004769 853950177 /nfs/dbraw/zinc/95/01/77/853950177.db2.gz WOGIRDRXKRUYGG-QGZVFWFLSA-N 0 3 423.351 4.376 20 0 HIADHN CC(=O)N(c1nc(CN[C@H](Cc2ccccc2)CN(C)C)cs1)c1ccc(C)cc1 ZINC000237016286 853951525 /nfs/dbraw/zinc/95/15/25/853951525.db2.gz FKSAOQDPVGDDLA-OAQYLSRUSA-N 0 3 422.598 4.399 20 0 HIADHN COc1ccccc1-c1ccc(CNCc2ccc(N3CCO[C@H](C)C3)nc2)cc1 ZINC000237097550 853964028 /nfs/dbraw/zinc/96/40/28/853964028.db2.gz TVGDJOAWGKUXAV-LJQANCHMSA-N 0 3 403.526 4.272 20 0 HIADHN COc1cc(CNCc2ccc(O[C@@H](C)C#N)cc2)cc(Br)c1OC ZINC000237105163 853965281 /nfs/dbraw/zinc/96/52/81/853965281.db2.gz AFGYAYVLPBPRJJ-ZDUSSCGKSA-N 0 3 405.292 4.047 20 0 HIADHN COc1cc(CN[C@@H]2CCCCNC2=O)ccc1OCc1cccc(C(F)(F)F)c1 ZINC000237184852 853977989 /nfs/dbraw/zinc/97/79/89/853977989.db2.gz HREPGLMICTZKNN-GOSISDBHSA-N 0 3 422.447 4.051 20 0 HIADHN COc1cc(CNc2ccc(N3CCN(C)CC3)cc2C)ccc1OCC(F)(F)F ZINC000237214460 853984434 /nfs/dbraw/zinc/98/44/34/853984434.db2.gz OAAOQQWYKIPECY-UHFFFAOYSA-N 0 3 423.479 4.309 20 0 HIADHN COc1cc(CNCc2ccc(CN3CCCC3=O)cc2)ccc1OCC(F)(F)F ZINC000237241181 853988635 /nfs/dbraw/zinc/98/86/35/853988635.db2.gz ZRDYWKABNAJTJG-UHFFFAOYSA-N 0 3 422.447 4.049 20 0 HIADHN COCCOc1cccc(CNCc2ccc(-n3ccc(C(F)(F)F)n3)cc2)c1 ZINC000237242865 853989830 /nfs/dbraw/zinc/98/98/30/853989830.db2.gz RZSLQXBOWPTAGK-UHFFFAOYSA-N 0 3 405.420 4.206 20 0 HIADHN Cc1ccc(CNC(=O)c2cccc(CN[C@@H](C)CC(=O)Nc3ccccc3)c2)cc1 ZINC000237315030 854004603 /nfs/dbraw/zinc/00/46/03/854004603.db2.gz NMMBNTGDIQPTFE-FQEVSTJZSA-N 0 3 415.537 4.432 20 0 HIADHN COc1cccc([C@H](O)CNCc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)c1 ZINC000237324755 854006761 /nfs/dbraw/zinc/00/67/61/854006761.db2.gz GIEPTWVCEDYVJQ-LJQANCHMSA-N 0 3 402.834 4.340 20 0 HIADHN COc1ccc(CN[C@@H]2CCCN(Cc3ccc(F)cc3Cl)C2)c(OC)c1OC ZINC000237323543 854006806 /nfs/dbraw/zinc/00/68/06/854006806.db2.gz GLEVFPUXXLFJMX-GOSISDBHSA-N 0 3 422.928 4.259 20 0 HIADHN C[C@@H]1C[C@@H]1c1ccc(CNCc2cc(C(F)(F)F)ccc2N2CCN(C)CC2)o1 ZINC000237370489 854016371 /nfs/dbraw/zinc/01/63/71/854016371.db2.gz LWDGTSSMWJGAFL-BEFAXECRSA-N 0 3 407.480 4.463 20 0 HIADHN COc1ccc([C@H](O)CNCc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)cc1 ZINC000237369540 854016410 /nfs/dbraw/zinc/01/64/10/854016410.db2.gz FJURQTDJQHIFIU-LJQANCHMSA-N 0 3 402.834 4.340 20 0 HIADHN C[C@H](NCc1ccc(-n2ccc(C(F)(F)F)n2)cc1)c1ccc2c(c1)NC(=O)CO2 ZINC000237583803 854058224 /nfs/dbraw/zinc/05/82/24/854058224.db2.gz APDBKHPHPLLDHM-ZDUSSCGKSA-N 0 3 416.403 4.073 20 0 HIADHN Cc1cccc(COc2c(C)cc(CNCc3cccc(OCC(N)=O)c3)cc2C)c1 ZINC000237649166 854067902 /nfs/dbraw/zinc/06/79/02/854067902.db2.gz QBASRNBEPQZKNX-UHFFFAOYSA-N 0 3 418.537 4.345 20 0 HIADHN Cc1nc(COc2ccc(CNCc3ccc(CN4CCOCC4)cc3)cc2)cs1 ZINC000237663507 854071103 /nfs/dbraw/zinc/07/11/03/854071103.db2.gz NARFWXKGTUNOSQ-UHFFFAOYSA-N 0 3 423.582 4.153 20 0 HIADHN Cc1nn(Cc2ccccc2Cl)c(C)c1CNC[C@@](C)(O)c1ccc(F)cc1F ZINC000237676987 854074193 /nfs/dbraw/zinc/07/41/93/854074193.db2.gz ONWLHFOOPQRULV-JOCHJYFZSA-N 0 3 419.903 4.477 20 0 HIADHN Cc1nn(Cc2ccccc2Cl)c(Cl)c1CNCCCOC1CCOCC1 ZINC000237689708 854075984 /nfs/dbraw/zinc/07/59/84/854075984.db2.gz IONZGBMXHWOSNC-UHFFFAOYSA-N 0 3 412.361 4.222 20 0 HIADHN Cc1ccc(-c2nn(Cc3ccccc3)cc2CNCc2ccc(C(N)=O)cc2)cc1 ZINC000237696175 854078028 /nfs/dbraw/zinc/07/80/28/854078028.db2.gz RMRHYJWQYOELJI-UHFFFAOYSA-N 0 3 410.521 4.296 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(Cl)c1CNCCCNC(=O)c1ccc(F)cc1 ZINC000237773339 854094109 /nfs/dbraw/zinc/09/41/09/854094109.db2.gz AFKYNCPEYSQKRI-UHFFFAOYSA-N 0 3 418.875 4.022 20 0 HIADHN C[C@H]1CN(Cc2ccccc2CNCc2c(F)cccc2N2CCCC2)C[C@H](C)O1 ZINC000237775820 854094679 /nfs/dbraw/zinc/09/46/79/854094679.db2.gz PJLMJUGGQYWPKU-PMACEKPBSA-N 0 3 411.565 4.325 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2CNCc2c(F)cccc2N2CCCC2)C[C@H](C)O1 ZINC000237775790 854094745 /nfs/dbraw/zinc/09/47/45/854094745.db2.gz PJLMJUGGQYWPKU-BGYRXZFFSA-N 0 3 411.565 4.325 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2CNCc2cnn(-c3ccc(Cl)cc3)c2)C[C@H](C)O1 ZINC000237779069 854096327 /nfs/dbraw/zinc/09/63/27/854096327.db2.gz DQJZBABNLLZWSZ-KDURUIRLSA-N 0 3 424.976 4.425 20 0 HIADHN Fc1ccc(N2CC[C@@H](CNCc3csc(-c4ccc5c(c4)OCO5)n3)C2)cc1 ZINC000237786995 854097015 /nfs/dbraw/zinc/09/70/15/854097015.db2.gz JQAJZPRCPNNTQY-HNNXBMFYSA-N 0 3 411.502 4.294 20 0 HIADHN O=[N+]([O-])c1ccc(Cl)cc1CNC[C@@H](c1ccc(Cl)cc1)N1CCOCC1 ZINC000237794478 854099143 /nfs/dbraw/zinc/09/91/43/854099143.db2.gz ILAGMQHXOKZFHH-IBGZPJMESA-N 0 3 410.301 4.065 20 0 HIADHN Clc1nc2ccccn2c1CNC[C@H]1CCN(c2cccc(Br)c2)C1 ZINC000237805477 854100867 /nfs/dbraw/zinc/10/08/67/854100867.db2.gz SRTRQBVQSUVECR-CQSZACIVSA-N 0 3 419.754 4.366 20 0 HIADHN O=C(Nc1ccc(CNCc2ccccc2N2CCOCC2)cc1)c1ccc(F)cc1 ZINC000237818717 854103129 /nfs/dbraw/zinc/10/31/29/854103129.db2.gz FNLPJKGQPOHIHU-UHFFFAOYSA-N 0 3 419.500 4.204 20 0 HIADHN Fc1cc(CNC2(c3ccc(Cl)cc3)CCOCC2)ccc1N1CCOCC1 ZINC000237843252 854106512 /nfs/dbraw/zinc/10/65/12/854106512.db2.gz KNIFRMNBJCBQEH-UHFFFAOYSA-N 0 3 404.913 4.111 20 0 HIADHN O=[N+]([O-])c1ccc(Cl)c(CNC[C@H](c2cccc(Cl)c2)N2CCOCC2)c1 ZINC000237875986 854112827 /nfs/dbraw/zinc/11/28/27/854112827.db2.gz QXWQWUPXNYZSMW-LJQANCHMSA-N 0 3 410.301 4.065 20 0 HIADHN O[C@H](CNCc1cnc2ccc(Br)cn12)c1c(Cl)cccc1Cl ZINC000237954236 854124598 /nfs/dbraw/zinc/12/45/98/854124598.db2.gz PTUPTRNNBVDWLM-CQSZACIVSA-N 0 3 415.118 4.227 20 0 HIADHN O=[N+]([O-])c1cc(CNC[C@H](O)c2ccc(F)cc2)ccc1Oc1ccc(F)cc1 ZINC000238063645 854139459 /nfs/dbraw/zinc/13/94/59/854139459.db2.gz RGJUHHHNZDUSRX-FQEVSTJZSA-N 0 3 400.381 4.489 20 0 HIADHN Cc1noc(C)c1COc1cccc(C(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)c1 ZINC000250996169 854196270 /nfs/dbraw/zinc/19/62/70/854196270.db2.gz UZKOLJDIACWKKO-GCJKJVERSA-N 0 3 419.525 4.436 20 0 HIADHN Cc1ccc2c(CC(=O)NCCCCN3CCN(c4ccccc4)CC3)coc2c1 ZINC000261376583 854238183 /nfs/dbraw/zinc/23/81/83/854238183.db2.gz UQXYNVCTKKAOHR-UHFFFAOYSA-N 0 3 405.542 4.002 20 0 HIADHN CN(C)CCN(Cc1cccc(C#N)c1)C(=O)c1nc(-c2ccccc2)oc1C1CC1 ZINC000261381754 854241299 /nfs/dbraw/zinc/24/12/99/854241299.db2.gz QLPAHYPXCDKHCX-UHFFFAOYSA-N 0 3 414.509 4.295 20 0 HIADHN C[C@H]1CCN(CC(=O)N[C@@H](c2ccccc2)c2ccc3[nH]c(C(F)(F)F)nc3c2)C1 ZINC000261399847 854248109 /nfs/dbraw/zinc/24/81/09/854248109.db2.gz VSCDIPQZHDVHJO-XOBRGWDASA-N 0 3 416.447 4.129 20 0 HIADHN C[C@H]1CCN(CC(=O)N[C@@H](c2ccccc2)c2ccc3nc(C(F)(F)F)[nH]c3c2)C1 ZINC000261399847 854248115 /nfs/dbraw/zinc/24/81/15/854248115.db2.gz VSCDIPQZHDVHJO-XOBRGWDASA-N 0 3 416.447 4.129 20 0 HIADHN COc1ccccc1[C@@H](CNc1nc(C(F)(F)F)nc2nc[nH]c21)N1CCCCC1 ZINC000301072406 854287791 /nfs/dbraw/zinc/28/77/91/854287791.db2.gz HJBJHSQRLDMICT-CQSZACIVSA-N 0 3 420.439 4.019 20 0 HIADHN FC(F)(F)c1nnc2ccc(NCC3CCN(Cc4ccccc4Cl)CC3)nn21 ZINC000301186404 854323198 /nfs/dbraw/zinc/32/31/98/854323198.db2.gz KEOGRBOUVZRBIX-UHFFFAOYSA-N 0 3 424.858 4.121 20 0 HIADHN CC(C)(C)OC(=O)NC[C@](C)(NCc1cc(Br)ccc1F)C1CC1 ZINC000301321485 854357909 /nfs/dbraw/zinc/35/79/09/854357909.db2.gz IBBQTSNMVUCNGY-SFHVURJKSA-N 0 3 401.320 4.371 20 0 HIADHN Cc1nc2ccc(Br)cc2c(N2CCN(C(=O)c3ccco3)CC2)c1C ZINC000301336884 854363357 /nfs/dbraw/zinc/36/33/57/854363357.db2.gz DHWDVZMYTLNQON-UHFFFAOYSA-N 0 3 414.303 4.170 20 0 HIADHN CN(C)[C@@H](CNc1ncccc1C(=O)N1CCc2ccccc21)c1cccc(F)c1 ZINC000301355434 854369196 /nfs/dbraw/zinc/36/91/96/854369196.db2.gz LXALDYNQLJNZIN-QFIPXVFZSA-N 0 3 404.489 4.138 20 0 HIADHN CC1CCN(C(=O)c2ccc(NC[C@H](c3ccc(Cl)cc3)N(C)C)nc2)CC1 ZINC000301471335 854402496 /nfs/dbraw/zinc/40/24/96/854402496.db2.gz JTKVPKZORKDZAS-HXUWFJFHSA-N 0 3 400.954 4.322 20 0 HIADHN Cc1nc(-c2ccc(N[C@H]3CC[N@H+](Cc4ccccc4)[C@@H](C)C3)nc2)[n-]c(=O)c1C ZINC000301573218 854422713 /nfs/dbraw/zinc/42/27/13/854422713.db2.gz YWICWFKOFCSYOF-KKSFZXQISA-N 0 3 403.530 4.326 20 0 HIADHN Cc1nc(-c2ccc(N[C@H]3CC[N@@H+](Cc4ccccc4)[C@@H](C)C3)nc2)[n-]c(=O)c1C ZINC000301573218 854422719 /nfs/dbraw/zinc/42/27/19/854422719.db2.gz YWICWFKOFCSYOF-KKSFZXQISA-N 0 3 403.530 4.326 20 0 HIADHN COc1ccccc1[C@@H](CNc1ncnc2c1cnn2C(C)(C)C)N1CCCCC1 ZINC000301894907 854487563 /nfs/dbraw/zinc/48/75/63/854487563.db2.gz POECHPGYXCHFGK-LJQANCHMSA-N 0 3 408.550 4.229 20 0 HIADHN CCC[C@@H]1CN(c2ccc(-c3nc(C)c(C)c(=O)[n-]3)cn2)CC[N@@H+]1Cc1ccccc1 ZINC000301996895 854513092 /nfs/dbraw/zinc/51/30/92/854513092.db2.gz HVNCVBRVIZZOLA-JOCHJYFZSA-N 0 3 417.557 4.352 20 0 HIADHN CCC[C@@H]1CN(c2ccc(-c3nc(C)c(C)c(=O)[n-]3)cn2)CC[N@H+]1Cc1ccccc1 ZINC000301996895 854513098 /nfs/dbraw/zinc/51/30/98/854513098.db2.gz HVNCVBRVIZZOLA-JOCHJYFZSA-N 0 3 417.557 4.352 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1Nc1nn2cc(-c3cccnc3)nc2s1 ZINC000302193550 854546983 /nfs/dbraw/zinc/54/69/83/854546983.db2.gz RVGFXLQELTVQOC-APWZRJJASA-N 0 3 404.543 4.175 20 0 HIADHN COc1ccc([C@@H](CNc2ccc3nnc(-c4ccsc4)n3n2)N2CCCC2)cc1 ZINC000302290396 854560638 /nfs/dbraw/zinc/56/06/38/854560638.db2.gz LDXMBPLLWWYTJM-LJQANCHMSA-N 0 3 420.542 4.110 20 0 HIADHN Cc1csc(SCc2c3ccccc3oc2C(=O)NC2CCN(C)CC2)n1 ZINC000302605457 854591277 /nfs/dbraw/zinc/59/12/77/854591277.db2.gz AYHNKCRFEZCUKE-UHFFFAOYSA-N 0 3 401.557 4.314 20 0 HIADHN CN1CC[C@H]2[C@@H](CCCN2c2nnc(-c3cc(Br)ccc3F)s2)C1 ZINC000302759864 854624032 /nfs/dbraw/zinc/62/40/32/854624032.db2.gz WVOBSAVLKCVZGM-NHYWBVRUSA-N 0 3 411.344 4.027 20 0 HIADHN COc1ccc([C@@H](NCC(=O)N2CCC[C@@H]2c2ccc3c(c2)OCCO3)C(C)C)cc1 ZINC000302764069 854626227 /nfs/dbraw/zinc/62/62/27/854626227.db2.gz SDALXKIEBKXESR-BWKNWUBXSA-N 0 3 424.541 4.117 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1ccc(-n2nc(C)cc2C)cc1)c1cccc(OC)c1 ZINC000302878069 854664320 /nfs/dbraw/zinc/66/43/20/854664320.db2.gz JBSKVJSNCBMJLJ-XMMPIXPASA-N 0 3 420.557 4.311 20 0 HIADHN Cc1cc(C(=O)NC[C@H](c2ccccc2)N(C)C)c2ccc(Br)cc2n1 ZINC000302924483 854682504 /nfs/dbraw/zinc/68/25/04/854682504.db2.gz BQBOTTXXKZDLLO-HXUWFJFHSA-N 0 3 412.331 4.338 20 0 HIADHN CC1CCN([C@H](CNC(=O)[C@H]2CCCN2C(=O)CC(C)(C)C)c2cccs2)CC1 ZINC000303006907 854720242 /nfs/dbraw/zinc/72/02/42/854720242.db2.gz IOYPWKVSGYBEIH-RTBURBONSA-N 0 3 419.635 4.065 20 0 HIADHN COCCN1CCC(NC(=O)c2ccc(-c3ccc(Br)cc3)s2)CC1 ZINC000303008386 854721234 /nfs/dbraw/zinc/72/12/34/854721234.db2.gz JDSUCWUITKYDLN-UHFFFAOYSA-N 0 3 423.376 4.018 20 0 HIADHN CCOC(=O)/C=C/c1ccc(NC(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)cc1 ZINC000303023309 854728244 /nfs/dbraw/zinc/72/82/44/854728244.db2.gz MDJVPYULGDNMSK-VGOFMYFVSA-N 0 3 421.541 4.046 20 0 HIADHN COCCN1CCC(NC(=O)CCc2c3ccccc3[nH]c2-c2ccc(F)cc2)CC1 ZINC000303039807 854735156 /nfs/dbraw/zinc/73/51/56/854735156.db2.gz PRDRRFWKJCPWSV-UHFFFAOYSA-N 0 3 423.532 4.134 20 0 HIADHN CCOc1c(Cl)cc(C(=O)N(CCN(C)C)Cc2cccc(C)c2)cc1OC ZINC000303220244 854822619 /nfs/dbraw/zinc/82/26/19/854822619.db2.gz UZMMTJKTXJJCQN-UHFFFAOYSA-N 0 3 404.938 4.260 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N(C)CCc2ccc(Br)cc2)N(C)C)cc1 ZINC000303325055 854872857 /nfs/dbraw/zinc/87/28/57/854872857.db2.gz SCAIMSJNVVLGIA-HXUWFJFHSA-N 0 3 418.379 4.244 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)[C@@H]1C[C@H]1c1cccc(C(F)(F)F)c1 ZINC000303454025 854953758 /nfs/dbraw/zinc/95/37/58/854953758.db2.gz KEBKSASFZVIEEO-LEWJYISDSA-N 0 3 402.460 4.374 20 0 HIADHN Clc1ccc2nccc(N3CCC[C@@H](CN4CCN(c5ccccn5)CC4)C3)c2c1 ZINC000303503063 854991794 /nfs/dbraw/zinc/99/17/94/854991794.db2.gz ABPCGRNRAYYYGB-IBGZPJMESA-N 0 3 421.976 4.322 20 0 HIADHN COc1cc(F)c([C@H](C)NC(=O)c2oc3ccccc3c2CN(C)C)cc1OC ZINC000303546998 855033036 /nfs/dbraw/zinc/03/30/36/855033036.db2.gz LCPCWKJIDMMEHJ-ZDUSSCGKSA-N 0 3 400.450 4.142 20 0 HIADHN CCOc1cc(CN(C)CCc2nc(-c3ccccc3)no2)ccc1OC(F)F ZINC000303560779 855040690 /nfs/dbraw/zinc/04/06/90/855040690.db2.gz NIWTZZVQKGBXAH-UHFFFAOYSA-N 0 3 403.429 4.411 20 0 HIADHN CC(C)n1c2ccccc2nc1[C@@H]1CCCN(C[C@@H](O)COc2ccc(F)cc2)C1 ZINC000303577065 855052365 /nfs/dbraw/zinc/05/23/65/855052365.db2.gz QDLQEVYUVVCJRT-UYAOXDASSA-N 0 3 411.521 4.376 20 0 HIADHN Cc1cc(F)ccc1-c1ccc(C(=O)N(CCN(C)C)C[C@H]2CCCO2)cc1F ZINC000303655393 855109586 /nfs/dbraw/zinc/10/95/86/855109586.db2.gz GAEDAZPZNAFEEI-LJQANCHMSA-N 0 3 402.485 4.123 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N[C@@H](C)c3cccc(C(F)(F)F)c3)cc2)CC1 ZINC000303687021 855133404 /nfs/dbraw/zinc/13/34/04/855133404.db2.gz KRRKLJRYMIDXPO-INIZCTEOSA-N 0 3 405.464 4.338 20 0 HIADHN Cc1ccsc1C(=O)NC1CCN(CCOc2ccc(Br)cc2)CC1 ZINC000303726608 855153965 /nfs/dbraw/zinc/15/39/65/855153965.db2.gz TVWMSOSQVGQEEM-UHFFFAOYSA-N 0 3 423.376 4.092 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)c1cc(Cl)nc(N2CCCC2)c1 ZINC000303831969 855231091 /nfs/dbraw/zinc/23/10/91/855231091.db2.gz LQHYWNFYQCBOLY-GOSISDBHSA-N 0 3 412.965 4.072 20 0 HIADHN Cc1ccc(C[C@@H](C)NC(=O)Nc2ccc(CCN3CCSCC3)cc2)s1 ZINC000303858645 855253447 /nfs/dbraw/zinc/25/34/47/855253447.db2.gz WFAJGMKPEWJCIZ-MRXNPFEDSA-N 0 3 403.617 4.401 20 0 HIADHN Cc1nc(C(C)(C)NC(=O)Nc2ccc(CCN3CCSCC3)cc2)sc1C ZINC000303943435 855307818 /nfs/dbraw/zinc/30/78/18/855307818.db2.gz ZCWFRPKTWGXGMZ-UHFFFAOYSA-N 0 3 418.632 4.408 20 0 HIADHN COc1ccc(Br)cc1C(=O)NC[C@H]1CCCCN1Cc1ccccc1 ZINC000379691464 855426681 /nfs/dbraw/zinc/42/66/81/855426681.db2.gz DQZLPPXPWZHYDR-GOSISDBHSA-N 0 3 417.347 4.242 20 0 HIADHN O=C(NC[C@@H]1CCCCN1Cc1ccccc1)c1cccc(F)c1Br ZINC000379708314 855426715 /nfs/dbraw/zinc/42/67/15/855426715.db2.gz DZBUAYUEPYKHBT-INIZCTEOSA-N 0 3 405.311 4.373 20 0 HIADHN COc1ccc(C(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)cc1Br ZINC000383017159 855434497 /nfs/dbraw/zinc/43/44/97/855434497.db2.gz KGVFRUKGKIBPMI-INIZCTEOSA-N 0 3 417.347 4.194 20 0 HIADHN COc1ccc(Br)cc1C(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1 ZINC000383013297 855434778 /nfs/dbraw/zinc/43/47/78/855434778.db2.gz FDXDOWVLXKJSEY-INIZCTEOSA-N 0 3 417.347 4.194 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(I)cc1)c1ccc2c(c1)OCCO2 ZINC000386057072 855443192 /nfs/dbraw/zinc/44/31/92/855443192.db2.gz GTKGMASSHIDAPZ-QWHCGFSZSA-N 0 3 409.267 4.474 20 0 HIADHN CN(C(=O)c1ccc(Br)cc1F)C1CCN(Cc2ccccc2)CC1 ZINC000386693502 855444260 /nfs/dbraw/zinc/44/42/60/855444260.db2.gz ODDFSJGVWBNEIE-UHFFFAOYSA-N 0 3 405.311 4.325 20 0 HIADHN CN(C(=O)c1cc(F)ccc1Br)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000388806153 855448089 /nfs/dbraw/zinc/44/80/89/855448089.db2.gz KCOUSZSDGYHUOB-KRWDZBQOSA-N 0 3 405.311 4.325 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1cc(Cl)ccc1Br ZINC000389831348 855451239 /nfs/dbraw/zinc/45/12/39/855451239.db2.gz ACCYQPRIWMKSQQ-UGSOOPFHSA-N 0 3 407.739 4.353 20 0 HIADHN Cc1nnc(CCN[C@H](C)c2ccc(Br)cc2Br)s1 ZINC000391834183 855461233 /nfs/dbraw/zinc/46/12/33/855461233.db2.gz RCKGHVHSGCWAFX-MRVPVSSYSA-N 0 3 405.159 4.265 20 0 HIADHN COc1c(Br)cc(Br)cc1CNCC(C)(C)C(C)(C)O ZINC000393668262 855468788 /nfs/dbraw/zinc/46/87/88/855468788.db2.gz NVDJRUWPAWWCGQ-UHFFFAOYSA-N 0 3 409.162 4.107 20 0 HIADHN CC(C)(C)OC(=O)NCC1(CCNCc2ccc(F)cc2Br)CC1 ZINC000404571043 855481878 /nfs/dbraw/zinc/48/18/78/855481878.db2.gz IYFHXDWJJCVQTE-UHFFFAOYSA-N 0 3 401.320 4.373 20 0 HIADHN CCN(Cc1cc(Br)ccc1F)C(=O)NC[C@H](c1ccccc1)N(C)C ZINC000409477576 855501412 /nfs/dbraw/zinc/50/14/12/855501412.db2.gz AYNOUTRSFQUOFE-LJQANCHMSA-N 0 3 422.342 4.423 20 0 HIADHN Cc1nc2cc(C(=O)NCc3ccccc3CN(C)C)ccc2n1Cc1ccsc1 ZINC000409556511 855540059 /nfs/dbraw/zinc/54/00/59/855540059.db2.gz QRFNGUDDDQNFTR-UHFFFAOYSA-N 0 3 418.566 4.446 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)Nc1ccc(OC(F)(F)F)cc1 ZINC000409583822 855552750 /nfs/dbraw/zinc/55/27/50/855552750.db2.gz WHKHRJNQMXVRGG-UHFFFAOYSA-N 0 3 407.436 4.126 20 0 HIADHN C[C@H](C(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1)c1ccc(C(F)(F)F)cc1 ZINC000409646728 855581552 /nfs/dbraw/zinc/58/15/52/855581552.db2.gz FLFALLGRYRJBMV-BBWFWOEESA-N 0 3 412.496 4.157 20 0 HIADHN CN(CCNC(=O)Nc1cc(Cl)ccc1OC[C@H]1CCCO1)Cc1ccccc1 ZINC000409653980 855586050 /nfs/dbraw/zinc/58/60/50/855586050.db2.gz VAHXTQWGSXBONS-LJQANCHMSA-N 0 3 417.937 4.151 20 0 HIADHN O=C(NCCCCN1CCN(Cc2ccccc2)CC1)Nc1cccc(Cl)c1 ZINC000409677418 855597256 /nfs/dbraw/zinc/59/72/56/855597256.db2.gz AYJIYYURRSQAMN-UHFFFAOYSA-N 0 3 400.954 4.060 20 0 HIADHN Cc1c(Cl)cccc1NC(=O)NCCCCN1CCN(c2ccccc2)CC1 ZINC000409684983 855601033 /nfs/dbraw/zinc/60/10/33/855601033.db2.gz KADZPEIEGSEZKU-UHFFFAOYSA-N 0 3 400.954 4.372 20 0 HIADHN Cc1cc(Cl)ccc1NC(=O)NCCCCN1CCN(Cc2ccccc2)CC1 ZINC000409686612 855601690 /nfs/dbraw/zinc/60/16/90/855601690.db2.gz KOGSMGZWRSNQHU-UHFFFAOYSA-N 0 3 414.981 4.368 20 0 HIADHN Cc1ccc(-n2nc(C(=O)N(CCN(C)C)c3ccccc3)c3c2CCC3)c(F)c1 ZINC000409753694 855636465 /nfs/dbraw/zinc/63/64/65/855636465.db2.gz SBOKXYDHTMDDQW-UHFFFAOYSA-N 0 3 406.505 4.017 20 0 HIADHN CC[C@@H](NCC(=O)N[C@@H]1CCOc2ccccc21)c1ccc(Br)cc1 ZINC000409862331 855693354 /nfs/dbraw/zinc/69/33/54/855693354.db2.gz ZJVXHKUZFHVKJO-QZTJIDSGSA-N 0 3 403.320 4.130 20 0 HIADHN O=C(NCc1ccc2c(c1)OCO2)[C@H](NC[C@H]1CCCC(F)(F)C1)c1ccccc1 ZINC000409865427 855695130 /nfs/dbraw/zinc/69/51/30/855695130.db2.gz FANFONVPKFOTOD-LAUBAEHRSA-N 0 3 416.468 4.188 20 0 HIADHN CN1CC[C@@H](NC(=O)C(C)(C)c2ccccc2Br)[C@H]1c1ccccc1 ZINC000409882349 855705080 /nfs/dbraw/zinc/70/50/80/855705080.db2.gz JMQRAWVONKRWFN-RTBURBONSA-N 0 3 401.348 4.288 20 0 HIADHN C[C@@H](NC(=O)Cc1c(F)ccc(Br)c1F)[C@@H](c1ccccc1)N(C)C ZINC000409946368 855738974 /nfs/dbraw/zinc/73/89/74/855738974.db2.gz HMCPZRSFKVEBGT-BLVKFPJESA-N 0 3 411.290 4.077 20 0 HIADHN CC(C)(C)c1csc(NC(=O)NCCCCN2CCN(c3ccccc3)CC2)n1 ZINC000410024172 855784386 /nfs/dbraw/zinc/78/43/86/855784386.db2.gz ZBTAQRXSIFMUBN-UHFFFAOYSA-N 0 3 415.607 4.165 20 0 HIADHN CN(C)Cc1cccc(NC(=O)N[C@H]2CCOc3c(Br)cccc32)c1 ZINC000410054347 855803161 /nfs/dbraw/zinc/80/31/61/855803161.db2.gz JMCFJZNAJVAWJK-KRWDZBQOSA-N 0 3 404.308 4.156 20 0 HIADHN Cc1ccccc1C1(C(=O)Nc2ccc(C(=O)N(C)[C@@H]3CCCN(C)C3)cc2)CCC1 ZINC000410070177 855807624 /nfs/dbraw/zinc/80/76/24/855807624.db2.gz WMXPLSJCPOJPDM-JOCHJYFZSA-N 0 3 419.569 4.222 20 0 HIADHN O=C(NCc1ccc(F)cc1C(F)(F)F)N1CCCN(Cc2ccccc2)CC1 ZINC000410141906 855836744 /nfs/dbraw/zinc/83/67/44/855836744.db2.gz WJUMKXMWMDJVKN-UHFFFAOYSA-N 0 3 409.427 4.262 20 0 HIADHN C[C@@H](NCc1ccc(S(=O)(=O)N2CCCC2)cc1)c1cccc(Br)c1 ZINC000410226201 855869695 /nfs/dbraw/zinc/86/96/95/855869695.db2.gz XWDPJBIVJCAGSR-OAHLLOKOSA-N 0 3 423.376 4.084 20 0 HIADHN CC[C@@H](CSc1ccc(C)c(C)c1)NC(=O)N1CCN(C2CCOCC2)C[C@@H]1C ZINC000425914005 855996253 /nfs/dbraw/zinc/99/62/53/855996253.db2.gz DRCYCOQBHDOIIG-PMACEKPBSA-N 0 3 419.635 4.069 20 0 HIADHN COc1cc(CN2CCC(Oc3cnccn3)CC2)c(-c2ccccc2)cc1OC ZINC000425969507 856023551 /nfs/dbraw/zinc/02/35/51/856023551.db2.gz ATNPJOXIGDMPII-UHFFFAOYSA-N 0 3 405.498 4.204 20 0 HIADHN C[C@H](CCCC(F)(F)F)N[C@@H]1CCS(=O)(=O)c2ccc(Br)cc21 ZINC000426065376 856083055 /nfs/dbraw/zinc/08/30/55/856083055.db2.gz AVFLUXGWXUUPKM-ZWNOBZJWSA-N 0 3 414.287 4.378 20 0 HIADHN C[C@@H](N[C@@H]1c2cc(Br)ccc2CC1(C)C)c1ccc(S(N)(=O)=O)cc1 ZINC000426333533 856250063 /nfs/dbraw/zinc/25/00/63/856250063.db2.gz IEURMXOWKLJQRZ-KZULUSFZSA-N 0 3 423.376 4.071 20 0 HIADHN Cc1nc2ccc(CN(C)[C@@H](C)c3cccc(N4CCCS4(=O)=O)c3)cc2s1 ZINC000426358031 856258449 /nfs/dbraw/zinc/25/84/49/856258449.db2.gz FNLUXADDPHAKCH-HNNXBMFYSA-N 0 3 415.584 4.338 20 0 HIADHN CCOc1cc(CN2CCS[C@H](C)CC2)ccc1OCC(=O)Nc1ccccc1 ZINC000426377866 856265659 /nfs/dbraw/zinc/26/56/59/856265659.db2.gz JQWCFNYFEVATGS-GOSISDBHSA-N 0 3 414.571 4.430 20 0 HIADHN COc1ccc(Cc2noc([C@@H]3CN(C(C)(C)C)C[C@H]3C(F)(F)F)n2)cc1F ZINC000426453184 856298304 /nfs/dbraw/zinc/29/83/04/856298304.db2.gz DCNWXGJJZQFVLE-CHWSQXEVSA-N 0 3 401.404 4.184 20 0 HIADHN COc1ccccc1[C@@H](NC(=O)NC[C@@H]1CCCN1Cc1ccccc1)c1ccco1 ZINC000426466457 856306440 /nfs/dbraw/zinc/30/64/40/856306440.db2.gz CPEHXKOTKFUMMB-GBXCKJPGSA-N 0 3 419.525 4.341 20 0 HIADHN CC[C@H](NC(=O)c1ccccc1)c1noc([C@@H]2CN(C(C)(C)C)C[C@H]2C(F)(F)F)n1 ZINC000426585616 856361114 /nfs/dbraw/zinc/36/11/14/856361114.db2.gz YHRBWWKIUHZISW-OAGGEKHMSA-N 0 3 424.467 4.327 20 0 HIADHN Clc1ccc(-c2nc3sccn3c2CN2CCC(Cn3cncn3)CC2)cc1 ZINC000426747578 856451137 /nfs/dbraw/zinc/45/11/37/856451137.db2.gz QGDGLFJITUMRDN-UHFFFAOYSA-N 0 3 412.950 4.220 20 0 HIADHN O=C(CN1C[C@H]2CCCC[C@@H]2C1)N(Cc1nnc(-c2ccccc2Cl)o1)C1CC1 ZINC000426790026 856480382 /nfs/dbraw/zinc/48/03/82/856480382.db2.gz ZUDGPQSBEZXNOC-HZPDHXFCSA-N 0 3 414.937 4.003 20 0 HIADHN Cc1cc(CN(C)[C@@H](C)c2cccc(N3CCCS3(=O)=O)c2)c2ccccc2n1 ZINC000426800145 856485374 /nfs/dbraw/zinc/48/53/74/856485374.db2.gz MYECAFDSMCZOTH-SFHVURJKSA-N 0 3 409.555 4.276 20 0 HIADHN CN(C)C(=O)c1cccc(NC(=O)CN(Cc2ccccc2)[C@@H]2CCCC2(C)C)c1 ZINC000426815222 856494431 /nfs/dbraw/zinc/49/44/31/856494431.db2.gz DLMMXLAWYBBDNR-JOCHJYFZSA-N 0 3 407.558 4.408 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)CSc3ccccc3Cl)CC2)C[C@H](C)O1 ZINC000427287145 856752539 /nfs/dbraw/zinc/75/25/39/856752539.db2.gz IXYDGEJOMOJDKM-IRXDYDNUSA-N 0 3 411.011 4.170 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3cc4cc(Cl)ccc4o3)CC2)C[C@@H](C)O1 ZINC000427297652 856758145 /nfs/dbraw/zinc/75/81/45/856758145.db2.gz VPHVKZWASJWYMZ-HZPDHXFCSA-N 0 3 404.938 4.438 20 0 HIADHN C[C@H](CCc1ccccc1F)C(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000427304007 856761160 /nfs/dbraw/zinc/76/11/60/856761160.db2.gz GGLXDIJMJJWPGY-VAMGGRTRSA-N 0 3 404.570 4.132 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)CSc3ccc(Cl)cc3)CC2)C[C@@H](C)O1 ZINC000427312010 856764279 /nfs/dbraw/zinc/76/42/79/856764279.db2.gz GUAXYJOTZWSDAN-IAGOWNOFSA-N 0 3 411.011 4.170 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)c3c[nH]cc3-c3ccc(F)cc3)CC2)C[C@H](C)O1 ZINC000427342133 856781995 /nfs/dbraw/zinc/78/19/95/856781995.db2.gz LKQPBAZDAISFHG-ROUUACIJSA-N 0 3 413.537 4.172 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)CCCCC(=O)c3ccccc3)CC2)C[C@@H](C)O1 ZINC000427342120 856782066 /nfs/dbraw/zinc/78/20/66/856782066.db2.gz LHFOKMDMWXCUBU-NHCUHLMSSA-N 0 3 414.590 4.168 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)[C@@H]3C[C@H]3c3ccccc3Cl)CC2)C[C@H](C)O1 ZINC000427362488 856793235 /nfs/dbraw/zinc/79/32/35/856793235.db2.gz MUGDVJOEXZHEKK-KJNZLNQQSA-N 0 3 404.982 4.181 20 0 HIADHN Cc1c2cc(F)ccc2oc1C(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000427361658 856794355 /nfs/dbraw/zinc/79/43/55/856794355.db2.gz GKJXUQRMZGNTIP-IYBDPMFKSA-N 0 3 402.510 4.232 20 0 HIADHN CC1CCN(c2ccc(C(=O)N3CC[C@H](C)N(Cc4ccccc4)CC3)cn2)CC1 ZINC000437476954 862837532 /nfs/dbraw/zinc/83/75/32/862837532.db2.gz SLMQJXJYWLGAOT-NRFANRHFSA-N 0 3 406.574 4.055 20 0 HIADHN CCN1CCC[C@@H](CN(C)C(=O)[C@@H]2C[C@H]2c2ccc(Cl)s2)[C@@H]1c1cnn(C)c1 ZINC000427488288 856839349 /nfs/dbraw/zinc/83/93/49/856839349.db2.gz QEYZLKAZBGXLGT-CNVJLJKISA-N 0 3 421.010 4.170 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1C(=O)C(=O)Nc1cc(CN2CCCC2)ccc1C ZINC000427496293 856841280 /nfs/dbraw/zinc/84/12/80/856841280.db2.gz VUUMIENGVVHWSG-UHFFFAOYSA-N 0 3 416.525 4.215 20 0 HIADHN FC(F)(F)c1cnc2c(c1)[C@@H](NCc1ccc(CN3CCOCC3)cc1)CCC2 ZINC000427571633 856871668 /nfs/dbraw/zinc/87/16/68/856871668.db2.gz CUTQOTMEJOSMFF-FQEVSTJZSA-N 0 3 405.464 4.100 20 0 HIADHN Cc1cc2c(cc1C)[C@H](NCc1ccc(CS(=O)(=O)NC(C)C)cc1)CCS2 ZINC000427572277 856872515 /nfs/dbraw/zinc/87/25/15/856872515.db2.gz MLKRGQLCWICUJR-OAQYLSRUSA-N 0 3 418.628 4.458 20 0 HIADHN C[C@H](NC1CCN(Cc2ccc(F)cc2)CC1)c1ncc(Br)cc1F ZINC000427592648 856881142 /nfs/dbraw/zinc/88/11/42/856881142.db2.gz GQIGRQIOFIICPO-ZDUSSCGKSA-N 0 3 410.306 4.438 20 0 HIADHN Cc1cc2c(cc1C)[C@H](NCc1ccc(S(=O)(=O)N3CCCC3)cc1)CCS2 ZINC000427598200 856882991 /nfs/dbraw/zinc/88/29/91/856882991.db2.gz BSLOHQKKLRCYDU-OAQYLSRUSA-N 0 3 416.612 4.415 20 0 HIADHN Cc1ccc([C@H](NCc2ccccc2OCC(=O)NC[C@H]2CCCO2)C2CCC2)cc1 ZINC000427608276 856887118 /nfs/dbraw/zinc/88/71/18/856887118.db2.gz GAKVKWOKQNDVHT-ZEQKJWHPSA-N 0 3 422.569 4.300 20 0 HIADHN Cc1ccc(CS(=O)(=O)Nc2ccnc(N3CCc4ccccc4C3)c2)cc1F ZINC000427633163 856893310 /nfs/dbraw/zinc/89/33/10/856893310.db2.gz ZSUUSZCXIXNEHH-UHFFFAOYSA-N 0 3 411.502 4.034 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)NC34CCC(C(F)(F)F)(CC3)CC4)CC2)c1 ZINC000427655574 856898468 /nfs/dbraw/zinc/89/84/68/856898468.db2.gz SJRPDZGJPGZCND-UHFFFAOYSA-N 0 3 423.523 4.279 20 0 HIADHN Cc1ccc(CN[C@@H]2CCCc3ncc(C(F)(F)F)cc32)c(N2CCOCC2)c1 ZINC000427703810 856915924 /nfs/dbraw/zinc/91/59/24/856915924.db2.gz ZORJIGDOQBFBMU-LJQANCHMSA-N 0 3 405.464 4.413 20 0 HIADHN Cc1ccc(C(=O)N2CCC(N[C@H](C)c3ncc(Br)cc3F)CC2)cc1 ZINC000427720136 856922250 /nfs/dbraw/zinc/92/22/50/856922250.db2.gz SGNBXULXHUPWRG-CQSZACIVSA-N 0 3 420.326 4.247 20 0 HIADHN CO[C@@H](C)c1nc(CN2CCCN(CCCOc3cc(C)cc(C)c3)CC2)cs1 ZINC000437499425 862854763 /nfs/dbraw/zinc/85/47/63/862854763.db2.gz SBKUDZLUQXZSCK-FQEVSTJZSA-N 0 3 417.619 4.444 20 0 HIADHN COCCCN(C(=O)c1cn(Cc2ccccc2)c2ccccc12)C1CCN(C)CC1 ZINC000427726257 856924037 /nfs/dbraw/zinc/92/40/37/856924037.db2.gz FWPPQZYYBRPFRI-UHFFFAOYSA-N 0 3 419.569 4.263 20 0 HIADHN CCSc1cc(CN[C@H](C)CC(=O)Nc2ccc(NC(=O)C3CC3)cc2)ccn1 ZINC000427869091 856988093 /nfs/dbraw/zinc/98/80/93/856988093.db2.gz FTBWWHAZKSOIQX-OAHLLOKOSA-N 0 3 412.559 4.049 20 0 HIADHN Fc1ccc(Br)cc1[C@H](N[C@H]1CCn2ccnc2C1)c1ccccc1 ZINC000427875399 856990411 /nfs/dbraw/zinc/99/04/11/856990411.db2.gz SZKBVPLKGVEFMX-OXJNMPFZSA-N 0 3 400.295 4.479 20 0 HIADHN CO[C@@H](C)c1nc(CN2CCCN(CCCOc3c(C)cccc3C)CC2)cs1 ZINC000437535154 862870948 /nfs/dbraw/zinc/87/09/48/862870948.db2.gz KRXMSKOYZPQIMU-FQEVSTJZSA-N 0 3 417.619 4.444 20 0 HIADHN O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)N1CCC(c2ncccc2Cl)CC1 ZINC000428489469 857224091 /nfs/dbraw/zinc/22/40/91/857224091.db2.gz XCBZJXJEIBGBJB-HXUWFJFHSA-N 0 3 412.965 4.289 20 0 HIADHN OC[C@H](CNCc1nc2ccc(F)cc2s1)Cc1ccc(Br)cc1 ZINC000428529693 857242836 /nfs/dbraw/zinc/24/28/36/857242836.db2.gz BKYHMHSMZXUDSO-ZDUSSCGKSA-N 0 3 409.324 4.139 20 0 HIADHN Cc1ccc(C(=O)CC(C)(C)CC(=O)Nc2cccc(CN3CC[C@H](O)C3)c2)cc1 ZINC000428531245 857244053 /nfs/dbraw/zinc/24/40/53/857244053.db2.gz ANEKHXKPDGAMRH-QFIPXVFZSA-N 0 3 408.542 4.189 20 0 HIADHN COc1cc(C2(C(=O)Nc3cccc(CN4CC[C@@H](O)C4)c3)CCCC2)ccc1C ZINC000428540372 857250992 /nfs/dbraw/zinc/25/09/92/857250992.db2.gz RKNXSFUUSYNGAI-JOCHJYFZSA-N 0 3 408.542 4.021 20 0 HIADHN OC[C@]1(CNCc2cc(Cl)ccc2OC[C@@H]2CCCO2)C[C@H]1c1ccc(F)cc1 ZINC000428541051 857253389 /nfs/dbraw/zinc/25/33/89/857253389.db2.gz DONDNJSKQWTBFY-QNWVGRARSA-N 0 3 419.924 4.293 20 0 HIADHN C[C@H](Cc1ccc(Cl)cc1Cl)C(=O)Nc1cccc(CN2CC[C@@H](O)C2)c1 ZINC000428547293 857258972 /nfs/dbraw/zinc/25/89/72/857258972.db2.gz YPOUACZIRIAWTB-AUUYWEPGSA-N 0 3 407.341 4.377 20 0 HIADHN C[C@@H](Cc1ccccc1)n1cccc1C(=O)Nc1cccc(CN2CC[C@@H](O)C2)c1 ZINC000428553916 857262366 /nfs/dbraw/zinc/26/23/66/857262366.db2.gz YHNZUGHFKLBPAN-WMZHIEFXSA-N 0 3 403.526 4.111 20 0 HIADHN C[C@H](Oc1ccc(Cl)c2ccccc12)C(=O)Nc1cccc(CN2CC[C@H](O)C2)c1 ZINC000428552166 857262835 /nfs/dbraw/zinc/26/28/35/857262835.db2.gz VAVKVHAWFHSZOT-LPHOPBHVSA-N 0 3 424.928 4.466 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@@H](O)C2)c1)c1cc2ccc(C(F)(F)F)cc2[nH]1 ZINC000428554252 857264224 /nfs/dbraw/zinc/26/42/24/857264224.db2.gz YUZYBYBFWKTFOH-QGZVFWFLSA-N 0 3 403.404 4.006 20 0 HIADHN O=C(NC[C@H]1CN(Cc2ccccc2)CCCO1)Nc1ccc(C(F)(F)F)cc1 ZINC000428700022 857301614 /nfs/dbraw/zinc/30/16/14/857301614.db2.gz MGPNVKGDMSNMIY-IBGZPJMESA-N 0 3 407.436 4.118 20 0 HIADHN C[C@@]1(c2ccccc2)CC[C@H](N2CCN(CC(=O)Nc3ccccc3Cl)CC2)C1 ZINC000437578154 862895924 /nfs/dbraw/zinc/89/59/24/862895924.db2.gz LASBFHOLTKBYCF-GBXCKJPGSA-N 0 3 411.977 4.407 20 0 HIADHN OC[C@H](CNCc1nc2ccc(F)cc2s1)Cc1cccc(OC(F)(F)F)c1 ZINC000428869817 857379614 /nfs/dbraw/zinc/37/96/14/857379614.db2.gz FCIQZKXBORLUFC-ZDUSSCGKSA-N 0 3 414.424 4.275 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)Nc3ccc(C(=O)C(C)(C)C)cc3)CC2)C[C@H](C)O1 ZINC000428878588 857384192 /nfs/dbraw/zinc/38/41/92/857384192.db2.gz AKGYGBUQKWRMJH-ROUUACIJSA-N 0 3 415.578 4.269 20 0 HIADHN CN(C)CCN(C)C(=O)Nc1ccc(Oc2ccc(C(F)(F)F)cn2)c(F)c1 ZINC000428889533 857393296 /nfs/dbraw/zinc/39/32/96/857393296.db2.gz WRDWZJRVNYFBQO-UHFFFAOYSA-N 0 3 400.376 4.057 20 0 HIADHN CCCCn1ncc(C(=O)Nc2ccc(CCN3CCSCC3)cc2)c1CC ZINC000428914151 857410527 /nfs/dbraw/zinc/41/05/27/857410527.db2.gz DCKHQJMYMQATNZ-UHFFFAOYSA-N 0 3 400.592 4.089 20 0 HIADHN CN(C[C@]1(O)CCN(Cc2ccccc2)C1)C(=O)c1ccc(-c2ccc(F)cc2)s1 ZINC000428980261 857442692 /nfs/dbraw/zinc/44/26/92/857442692.db2.gz UWBVGAOLXRYTTI-XMMPIXPASA-N 0 3 424.541 4.263 20 0 HIADHN C[C@@H](c1cc2ccccc2o1)N(C)C(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000429013014 857455864 /nfs/dbraw/zinc/45/58/64/857455864.db2.gz VRZLQDNVCAQKOH-SIKLNZKXSA-N 0 3 421.541 4.426 20 0 HIADHN Cc1ccc(C)c([C@@H](C)N(C)C(=O)NC[C@@H]2CN(Cc3ccccc3)CCCO2)c1 ZINC000429017505 857459256 /nfs/dbraw/zinc/45/92/56/857459256.db2.gz FNNBMMDUJVHTRS-FYYLOGMGSA-N 0 3 409.574 4.297 20 0 HIADHN CCCN(CCc1cccs1)C(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000429018914 857459628 /nfs/dbraw/zinc/45/96/28/857459628.db2.gz JMYIEQYHCXZHHI-OAQYLSRUSA-N 0 3 415.603 4.003 20 0 HIADHN CC(C)OCc1ccc(NC(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)cc1 ZINC000429028552 857463931 /nfs/dbraw/zinc/46/39/31/857463931.db2.gz KPKAKIAVADAHAG-PMACEKPBSA-N 0 3 417.594 4.355 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3cccc(Cl)c3N(C)C)CC2)C[C@H](C)O1 ZINC000429033933 857467581 /nfs/dbraw/zinc/46/75/81/857467581.db2.gz ZFDUQIVRYWDBET-CALCHBBNSA-N 0 3 423.001 4.149 20 0 HIADHN CCN(Cc1cccc(Cl)c1)C(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000429040582 857470058 /nfs/dbraw/zinc/47/00/58/857470058.db2.gz LYLOZUFPSAOZKI-JOCHJYFZSA-N 0 3 415.965 4.163 20 0 HIADHN O=C(NC[C@H]1CN(Cc2ccccc2)CCCO1)Nc1ccccc1N1CCCCC1 ZINC000429042371 857471533 /nfs/dbraw/zinc/47/15/33/857471533.db2.gz DSZSDXZHHQIXDB-QFIPXVFZSA-N 0 3 422.573 4.090 20 0 HIADHN CC[C@@H]1c2ccsc2CCN1C(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000429053341 857480195 /nfs/dbraw/zinc/48/01/95/857480195.db2.gz MROMPOAOCAQEQS-TZIWHRDSSA-N 0 3 413.587 4.058 20 0 HIADHN O=C(NCc1cccc(NC(=O)C2CCCCC2)c1)NC[C@H]1CCCCN1C1CC1 ZINC000429098160 857508495 /nfs/dbraw/zinc/50/84/95/857508495.db2.gz YSYHTKDAKNVSJS-JOCHJYFZSA-N 0 3 412.578 4.022 20 0 HIADHN CC(C)(C)OC1CC(CCNC(=O)NCC(C)(C)N2CCc3ccccc3C2)C1 ZINC000429099606 857508673 /nfs/dbraw/zinc/50/86/73/857508673.db2.gz CNRTVGFAUDEUSM-UHFFFAOYSA-N 0 3 401.595 4.106 20 0 HIADHN CCOc1ccccc1Oc1ccc(CNC(=O)NC[C@H]2CCCCN2C2CC2)cn1 ZINC000429104801 857511207 /nfs/dbraw/zinc/51/12/07/857511207.db2.gz RPKSZOOAZPDZOX-HXUWFJFHSA-N 0 3 424.545 4.089 20 0 HIADHN CC(=O)N1CCC(N(CCCOc2cc(C)cc(C)c2)Cc2cncs2)CC1 ZINC000429176227 857541491 /nfs/dbraw/zinc/54/14/91/857541491.db2.gz MYFSBPMROKMKQU-UHFFFAOYSA-N 0 3 401.576 4.042 20 0 HIADHN CC[C@H](NC(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1)c1ccc(OC)cc1 ZINC000429208149 857555031 /nfs/dbraw/zinc/55/50/31/857555031.db2.gz ZNYBFSDPQKLPBD-PWHSHALESA-N 0 3 417.594 4.067 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3ccccc3OC(F)F)CC2)C[C@H](C)O1 ZINC000429210949 857555885 /nfs/dbraw/zinc/55/58/85/857555885.db2.gz VKTCJVVPQFZBLI-IYBDPMFKSA-N 0 3 411.493 4.031 20 0 HIADHN Cc1nc2ccc(NC(=O)N3CCC(CCN4C[C@H](C)O[C@@H](C)C4)CC3)cc2s1 ZINC000429219368 857560964 /nfs/dbraw/zinc/56/09/64/857560964.db2.gz HPYBQQATMLNPCL-HOTGVXAUSA-N 0 3 416.591 4.348 20 0 HIADHN CCCn1ccnc1CCCN(C)CC(=O)N[C@@H](C)c1ccc(Cl)cc1Cl ZINC000429246938 857573350 /nfs/dbraw/zinc/57/33/50/857573350.db2.gz UXRLXNNJYNDJEQ-HNNXBMFYSA-N 0 3 411.377 4.342 20 0 HIADHN O=C(NC[C@H]1CN(Cc2ccccc2)CCCO1)C1(c2ccccc2F)CCCC1 ZINC000429347000 857613054 /nfs/dbraw/zinc/61/30/54/857613054.db2.gz DNNFNQGKRZIHMJ-NRFANRHFSA-N 0 3 410.533 4.045 20 0 HIADHN Cc1csc(NC(=O)CN2CCN(CCCc3ccccc3)C[C@H]2CC(C)C)n1 ZINC000429397787 857642906 /nfs/dbraw/zinc/64/29/06/857642906.db2.gz SSFSBJBOCBOYRY-OAQYLSRUSA-N 0 3 414.619 4.055 20 0 HIADHN COCCS(=O)(=O)c1ccc(CN[C@H](C)c2ccc3cc(OC)ccc3c2)cc1 ZINC000429419234 857656411 /nfs/dbraw/zinc/65/64/11/857656411.db2.gz SKZJENOVGHFZNN-QGZVFWFLSA-N 0 3 413.539 4.119 20 0 HIADHN COCCS(=O)(=O)c1ccc(CN[C@@H](C)c2ccc(OC)c3ccccc32)cc1 ZINC000429437664 857668042 /nfs/dbraw/zinc/66/80/42/857668042.db2.gz ZCJLVBNAVQBOCZ-KRWDZBQOSA-N 0 3 413.539 4.119 20 0 HIADHN COc1cc(F)c([C@H](C)NC[C@H]2CSCCN2Cc2ccccc2)cc1OC ZINC000429446053 857674483 /nfs/dbraw/zinc/67/44/83/857674483.db2.gz GJKWDJDOJYDCBV-WMZOPIPTSA-N 0 3 404.551 4.111 20 0 HIADHN CC(C)(C)[C@@H](CN1CCc2ccccc2C1)NC(=O)N1CCC(OCC2CC2)CC1 ZINC000429491041 857693586 /nfs/dbraw/zinc/69/35/86/857693586.db2.gz NVOVAEWVEFCRQI-HSZRJFAPSA-N 0 3 413.606 4.060 20 0 HIADHN CC(C)(C)[C@@H](CN1CCc2ccccc2C1)NC(=O)N(Cc1cccnc1)C1CC1 ZINC000429496453 857696863 /nfs/dbraw/zinc/69/68/63/857696863.db2.gz VWVBXWYEJDYBJE-HSZRJFAPSA-N 0 3 406.574 4.229 20 0 HIADHN Cc1noc(C[C@@H](NCCOc2ccc(Br)cc2)c2ccccc2)n1 ZINC000429547347 857738715 /nfs/dbraw/zinc/73/87/15/857738715.db2.gz LATWESNLRAONJO-GOSISDBHSA-N 0 3 402.292 4.093 20 0 HIADHN C[C@@H]1CC[C@@H](N(C)CC(=O)N(Cc2nnc(-c3ccccc3Cl)o2)C2CC2)C1 ZINC000429570260 857756845 /nfs/dbraw/zinc/75/68/45/857756845.db2.gz UPEJVSAKBUEWGQ-GDBMZVCRSA-N 0 3 402.926 4.001 20 0 HIADHN C[C@H]1CC[C@H](N(C)CC(=O)N(Cc2nnc(-c3ccccc3Cl)o2)C2CC2)C1 ZINC000429570267 857756898 /nfs/dbraw/zinc/75/68/98/857756898.db2.gz UPEJVSAKBUEWGQ-HOCLYGCPSA-N 0 3 402.926 4.001 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)Nc2ccnn2Cc2ccc(F)cc2)C1 ZINC000429597352 857779815 /nfs/dbraw/zinc/77/98/15/857779815.db2.gz MUCSFKGNQXLKLM-UTKZUKDTSA-N 0 3 407.493 4.028 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)NC[C@@H](c2ccccc2)C(C)(C)CO)N2CCCC2)cc1 ZINC000437629503 862953186 /nfs/dbraw/zinc/95/31/86/862953186.db2.gz PJASZCZYQRJGPU-BJKOFHAPSA-N 0 3 423.601 4.233 20 0 HIADHN Clc1ccc([C@@H]2CN(C[C@@H]3CN(Cc4ccccc4)CCCO3)CCO2)cc1 ZINC000429720093 857849774 /nfs/dbraw/zinc/84/97/74/857849774.db2.gz DNYNVOKBFINTFW-GOTSBHOMSA-N 0 3 400.950 4.004 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1ccnn1Cc1cccc2ccccc21 ZINC000429732878 857855751 /nfs/dbraw/zinc/85/57/51/857855751.db2.gz SWXMUXZTHZCDIS-UHFFFAOYSA-N 0 3 417.513 4.273 20 0 HIADHN C[C@H](CN1CCCCC1)NC(=O)C(C)(C)c1csc(-c2c(F)cccc2F)n1 ZINC000429830447 857900598 /nfs/dbraw/zinc/90/05/98/857900598.db2.gz NOYUWUIYTRLWBQ-CQSZACIVSA-N 0 3 407.530 4.357 20 0 HIADHN CN(C[C@@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)c1ccc(Cl)cc1Cl ZINC000429845363 857908088 /nfs/dbraw/zinc/90/80/88/857908088.db2.gz ZHKRCVJDQXQMSH-INIZCTEOSA-N 0 3 413.370 4.136 20 0 HIADHN CCN(CC)[C@H](CNC(=O)[C@H](C)[C@@H]1OCCc2sccc21)c1cccc(OC)c1 ZINC000429857704 857913664 /nfs/dbraw/zinc/91/36/64/857913664.db2.gz KPFAWPOGFSJZBF-CNDZOEFASA-N 0 3 416.587 4.206 20 0 HIADHN Cc1ccc(CC(=O)NC[C@H](c2cccs2)N2CCCC2)cc1Br ZINC000437640314 862968490 /nfs/dbraw/zinc/96/84/90/862968490.db2.gz FYZBUOKNCMTFFX-QGZVFWFLSA-N 0 3 407.377 4.315 20 0 HIADHN COc1ccccc1-c1ncc(CN2CCC(Cc3ccccc3CO)CC2)cn1 ZINC000430077486 858022721 /nfs/dbraw/zinc/02/27/21/858022721.db2.gz HFXHACZKWDMQGY-UHFFFAOYSA-N 0 3 403.526 4.099 20 0 HIADHN CC[C@@H]1CN(Cc2cnc(-c3ccccc3OC)nc2)CCN1Cc1ccccc1 ZINC000430087434 858024564 /nfs/dbraw/zinc/02/45/64/858024564.db2.gz UFLPSKPZGGBYKM-JOCHJYFZSA-N 0 3 402.542 4.249 20 0 HIADHN c1coc(Cn2c(SC[C@@H]3CN(Cc4ccccc4)CCCO3)nnc2C2CC2)c1 ZINC000430106994 858034328 /nfs/dbraw/zinc/03/43/28/858034328.db2.gz SCYCCWCBGCCSPH-NRFANRHFSA-N 0 3 424.570 4.180 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CCCC[C@H]1c1nccn1CC)c1ccsc1 ZINC000430185518 858072751 /nfs/dbraw/zinc/07/27/51/858072751.db2.gz DYIBSYISHFPMJU-OALUTQOASA-N 0 3 403.596 4.284 20 0 HIADHN CCOc1cccc2[nH]cc(CC(=O)NC[C@@H](c3ccc(OC)cc3)N3CCCC3)c21 ZINC000437650644 862982963 /nfs/dbraw/zinc/98/29/63/862982963.db2.gz MBAJYIXJLSHEBC-QFIPXVFZSA-N 0 3 421.541 4.071 20 0 HIADHN COc1ccccc1-c1ncc(CN2CCC[C@@H]2Cn2c(C)nc3ccccc32)cn1 ZINC000430232972 858091175 /nfs/dbraw/zinc/09/11/75/858091175.db2.gz IXEWJLAIGMQADJ-HXUWFJFHSA-N 0 3 413.525 4.475 20 0 HIADHN COc1ccccc1-c1ncc(CN2C[C@@H](C)N(Cc3ccccc3)C[C@H]2C)cn1 ZINC000430246631 858095780 /nfs/dbraw/zinc/09/57/80/858095780.db2.gz SDAOACDWTAUJAC-WOJBJXKFSA-N 0 3 402.542 4.247 20 0 HIADHN C[C@@H]1CCN(C)CCN1C(=O)N[C@H](CC1CC1)c1cc(F)cc(Br)c1 ZINC000430289777 858110008 /nfs/dbraw/zinc/11/00/08/858110008.db2.gz LMFILFHHSVLYLH-FZKQIMNGSA-N 0 3 412.347 4.165 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)Nc1ccc2nc(C3CC3)oc2c1 ZINC000430533474 858208998 /nfs/dbraw/zinc/20/89/98/858208998.db2.gz VTNGQJGRRVFJPG-UHFFFAOYSA-N 0 3 404.514 4.246 20 0 HIADHN CCn1ccnc1[C@@H]1CCCCN1C(=O)NC[C@@H](c1ccc(C)cc1)N1CCCC1 ZINC000430543510 858212234 /nfs/dbraw/zinc/21/22/34/858212234.db2.gz YQBSNUYUOXJJIA-VXKWHMMOSA-N 0 3 409.578 4.285 20 0 HIADHN C[C@@H](N[C@@H](c1ccccc1)C1CCC1)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000430720341 858277751 /nfs/dbraw/zinc/27/77/51/858277751.db2.gz MOFOALHCTBJVFT-YJYMSZOUSA-N 0 3 423.376 4.289 20 0 HIADHN O=C1[C@@H]2C[C@H](C3CCCCC3)CN2C(=O)N1C[C@H](c1cccs1)N1CCCC1 ZINC000430976860 858389148 /nfs/dbraw/zinc/38/91/48/858389148.db2.gz UIJFCPMVAYAQMJ-GBESFXJTSA-N 0 3 401.576 4.118 20 0 HIADHN Cc1ccccc1[C@H](OC[C@H](O)CN1CC[C@H](Oc2ccncc2)C1)c1ccccc1 ZINC000431166370 858481830 /nfs/dbraw/zinc/48/18/30/858481830.db2.gz IUTDIDXULRYOPB-KTIWRFAQSA-N 0 3 418.537 4.010 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)c1cc(C(F)(F)F)ccc1Br ZINC000431484750 858639055 /nfs/dbraw/zinc/63/90/55/858639055.db2.gz QQKTVJUEWYZIKP-UHFFFAOYSA-N 0 3 419.241 4.265 20 0 HIADHN O=C(N[C@@H]1CCN(C2CC2)C1)[C@H](Oc1ccc(Cl)c(Cl)c1)c1ccccc1 ZINC000503233459 912212092 /nfs/dbraw/zinc/21/20/92/912212092.db2.gz QSIAYGALRSKCNL-FOIQADDNSA-N 0 3 405.325 4.466 20 0 HIADHN O=C(NC[C@H](c1ccccc1)C1CC1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000431910963 858866972 /nfs/dbraw/zinc/86/69/72/858866972.db2.gz GAGPJNWZYQRSJZ-SOAGJPPSSA-N 0 3 409.496 4.285 20 0 HIADHN Cc1cc(C)c(NC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)c(Br)c1 ZINC000431982668 858902462 /nfs/dbraw/zinc/90/24/62/858902462.db2.gz SPPDAXOIPPBAEQ-QGZVFWFLSA-N 0 3 402.336 4.462 20 0 HIADHN COc1ccc([C@@H](CNC(=O)Cc2cscc2Br)N2CCCC2)cc1 ZINC000432056173 858954422 /nfs/dbraw/zinc/95/44/22/858954422.db2.gz YWNAHZFSTUWBMQ-GOSISDBHSA-N 0 3 423.376 4.015 20 0 HIADHN Cc1cc(NC(=O)N2CC(C3CCCC3)C2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000432284348 859085149 /nfs/dbraw/zinc/08/51/49/859085149.db2.gz HOZKWISDJQMOMK-QFIPXVFZSA-N 0 3 407.562 4.292 20 0 HIADHN CN(C)CCN(C(=O)Nc1cnn(-c2cccc(C(F)(F)F)c2)c1)C1CCCC1 ZINC000467577512 881393988 /nfs/dbraw/zinc/39/39/88/881393988.db2.gz LDZCMJSLUOVGPF-UHFFFAOYSA-N 0 3 409.456 4.229 20 0 HIADHN CC1CCN([C@H](CNC(=O)NCCC[C@@H]2CCCC[C@@H]2O)c2cccs2)CC1 ZINC000432555682 859225190 /nfs/dbraw/zinc/22/51/90/859225190.db2.gz NFKJEYKPWRVQMC-ZCNNSNEGSA-N 0 3 407.624 4.152 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@@H](C)N[C@H](C)c2cc(C(=O)OC)c(C)o2)CC1 ZINC000432780859 859357224 /nfs/dbraw/zinc/35/72/24/859357224.db2.gz IXUNIAMLWHUISM-HZPDHXFCSA-N 0 3 417.525 4.067 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)C2(Cc3cccc(F)c3)CCOCC2)C1 ZINC000432881284 859404896 /nfs/dbraw/zinc/40/48/96/859404896.db2.gz QOOQBXLBOYRHTM-WMZHIEFXSA-N 0 3 410.533 4.117 20 0 HIADHN Cc1cc(NC(=O)CSCCN(C)Cc2ccccc2)n(-c2ccc(F)cc2)n1 ZINC000433019228 859482013 /nfs/dbraw/zinc/48/20/13/859482013.db2.gz MEWYDIROWATZPS-UHFFFAOYSA-N 0 3 412.534 4.124 20 0 HIADHN Cc1cnc(C2CCN(C(=O)N[C@@H](CN(C)Cc3ccccc3)C(C)C)CC2)s1 ZINC000433039790 859494617 /nfs/dbraw/zinc/49/46/17/859494617.db2.gz PNGNATSNBKHXPH-NRFANRHFSA-N 0 3 414.619 4.497 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)NCCC1CC(OC(C)(C)C)C1 ZINC000433045844 859496896 /nfs/dbraw/zinc/49/68/96/859496896.db2.gz NKOMEGPUWWTHNJ-KPQWGBOZSA-N 0 3 401.595 4.276 20 0 HIADHN COC(=O)c1ccccc1-c1ccc(CNC[C@@]2(CO)C[C@@H]2c2ccc(F)cc2)o1 ZINC000433045428 859496910 /nfs/dbraw/zinc/49/69/10/859496910.db2.gz QOJXRRBYXNSIBF-ZJSXRUAMSA-N 0 3 409.457 4.128 20 0 HIADHN O=C(Nc1ccccc1)c1cccc(CN2CCC(CO)(c3ccccc3)CC2)c1 ZINC000433076156 859512069 /nfs/dbraw/zinc/51/20/69/859512069.db2.gz JMSBJBPSNLQOJE-UHFFFAOYSA-N 0 3 400.522 4.465 20 0 HIADHN COc1ccc(C[C@H](NCc2ccc(NC(C)=O)nc2)c2ccc(OC)cc2)cc1 ZINC000433077419 859512230 /nfs/dbraw/zinc/51/22/30/859512230.db2.gz RIPNPHWHTUXXMU-QHCPKHFHSA-N 0 3 405.498 4.131 20 0 HIADHN Cc1ccc([C@H](NCC2(CO)CC3(CCC3)C2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000433084650 859516175 /nfs/dbraw/zinc/51/61/75/859516175.db2.gz RTYWQYBGLQZWKU-QFIPXVFZSA-N 0 3 413.583 4.020 20 0 HIADHN CCn1cccc(CNCc2ccc(OC(F)(F)[C@H](F)C(F)(F)F)cc2)c1=O ZINC000433192838 859562065 /nfs/dbraw/zinc/56/20/65/859562065.db2.gz NDTSPJBRXBUKFB-MRXNPFEDSA-N 0 3 408.342 4.030 20 0 HIADHN O=C(NCc1ccco1)Nc1ccc(NC(=O)[C@@H]2CCCCN2C2CCCC2)cc1 ZINC000433217239 859572694 /nfs/dbraw/zinc/57/26/94/859572694.db2.gz DJWNBJYRZFRFJF-NRFANRHFSA-N 0 3 410.518 4.337 20 0 HIADHN FC(F)(F)c1ccccc1[C@@H]1CCCCC[C@H]1NCc1nnnn1C1CCOCC1 ZINC000433241948 859586734 /nfs/dbraw/zinc/58/67/34/859586734.db2.gz FMQIYMJDGBPHKR-PKOBYXMFSA-N 0 3 423.483 4.250 20 0 HIADHN COc1cccc([C@@H](CNC(=O)NCCC2CC(OC(C)(C)C)C2)N2CCCC2)c1 ZINC000433289515 859619370 /nfs/dbraw/zinc/61/93/70/859619370.db2.gz QBESEZSVBGSSPU-FQUBMZHMSA-N 0 3 417.594 4.115 20 0 HIADHN C[C@@H]1CN([C@H](CNCc2ccc(-c3cc[nH]n3)o2)c2c(F)cccc2Cl)CCO1 ZINC000433328398 859644929 /nfs/dbraw/zinc/64/49/29/859644929.db2.gz RYGRMEMAMMHMLN-AUUYWEPGSA-N 0 3 418.900 4.014 20 0 HIADHN O=C(Nc1ccc2c(c1)CCN2C(=O)c1cccnc1)[C@H]1CCCCN1C1CCCC1 ZINC000433339575 859654101 /nfs/dbraw/zinc/65/41/01/859654101.db2.gz AYGJGNUACUEJOO-HSZRJFAPSA-N 0 3 418.541 4.020 20 0 HIADHN FC(F)(F)c1cnc(N2CC[C@@H](NCc3ccc(-c4cc[nH]n4)o3)C2)c(Cl)c1 ZINC000433345458 859656827 /nfs/dbraw/zinc/65/68/27/859656827.db2.gz XJCIOOVLUKLVJZ-GFCCVEGCSA-N 0 3 411.815 4.105 20 0 HIADHN CN(C)Cc1ccccc1C(=O)Nc1cccc(C[S@](=O)Cc2ccccc2)c1 ZINC000433354585 859658439 /nfs/dbraw/zinc/65/84/39/859658439.db2.gz NVZOCIUQYNTCMX-GDLZYMKVSA-N 0 3 406.551 4.449 20 0 HIADHN C[C@H]1COCC[C@H]1NC(=O)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000433453100 859709664 /nfs/dbraw/zinc/70/96/64/859709664.db2.gz YCARSFPTJMAVCG-HNAYVOBHSA-N 0 3 414.377 4.026 20 0 HIADHN Cc1cc(NC(=O)N2CC3(CCC3)C[C@H]2C)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000433496358 859733666 /nfs/dbraw/zinc/73/36/66/859733666.db2.gz FAGICGPEMHIPFW-CTNGQTDRSA-N 0 3 407.562 4.435 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)Nc1c2c(ccc1Cl)OCC2 ZINC000433508910 859743488 /nfs/dbraw/zinc/74/34/88/859743488.db2.gz AHTCIXMOTUUSJP-UHFFFAOYSA-N 0 3 409.864 4.149 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N[C@H](c1cc(F)ccc1F)C(F)F ZINC000433612572 859810223 /nfs/dbraw/zinc/81/02/23/859810223.db2.gz NELFVLYQACHVQL-NVXWUHKLSA-N 0 3 415.456 4.469 20 0 HIADHN COc1cc(NC(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)ccc1Cl ZINC000433637696 859819843 /nfs/dbraw/zinc/81/98/43/859819843.db2.gz GAHFLUMUMKEUFU-HZPDHXFCSA-N 0 3 409.958 4.092 20 0 HIADHN CN(C(=O)N[C@H](c1cc(F)ccc1F)C(F)F)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000433657119 859826914 /nfs/dbraw/zinc/82/69/14/859826914.db2.gz UDAZOKUNNDDDHM-VQIMIIECSA-N 0 3 409.427 4.187 20 0 HIADHN O=C(N1CC[C@@H](CC(F)(F)F)C1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000433738302 859866357 /nfs/dbraw/zinc/86/63/57/859866357.db2.gz CWPCHXNWNVMVEX-RDJZCZTQSA-N 0 3 408.386 4.242 20 0 HIADHN C[C@H](c1ccccc1C(F)(F)F)[C@H](C)NS(=O)(=O)c1ccc(CN(C)C)cc1 ZINC000433863560 859940897 /nfs/dbraw/zinc/94/08/97/859940897.db2.gz GEEVMIDZJHKIID-GJZGRUSLSA-N 0 3 414.493 4.238 20 0 HIADHN COc1ccc2[nH]cc(C3CCN(C(=O)NC[C@@H]4CCCCN4C4CC4)CC3)c2c1 ZINC000433954723 860000460 /nfs/dbraw/zinc/00/04/60/860000460.db2.gz VSXHYJMWKDXDRD-IBGZPJMESA-N 0 3 410.562 4.082 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)c2cc(NC(=O)C(C)(C)C)ccc2F)CN1Cc1ccccc1 ZINC000467694731 881489037 /nfs/dbraw/zinc/48/90/37/881489037.db2.gz BTQLTBHVSBJSTN-APWZRJJASA-N 0 3 411.521 4.203 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1cccc(OCC(F)(F)F)c1 ZINC000434012910 860040138 /nfs/dbraw/zinc/04/01/38/860040138.db2.gz RIIJWKSXZGCCMZ-UHFFFAOYSA-N 0 3 422.447 4.084 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)c2cccc(NC(=O)c3cccs3)c2)CN1Cc1ccccc1 ZINC000467700856 881495554 /nfs/dbraw/zinc/49/55/54/881495554.db2.gz OFXINIOXJAFAEW-UTKZUKDTSA-N 0 3 419.550 4.393 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)N(CCCO)Cc2cccc(Cl)c2)C1 ZINC000434037720 860055170 /nfs/dbraw/zinc/05/51/70/860055170.db2.gz SEFRZMPKJCRQRN-AVRDEDQJSA-N 0 3 415.965 4.070 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)COc2ccc(Oc3ccccn3)cc2)CN1Cc1ccccc1 ZINC000467698884 881494259 /nfs/dbraw/zinc/49/42/59/881494259.db2.gz CGVXYEGPOVVNFR-PZJWPPBQSA-N 0 3 417.509 4.032 20 0 HIADHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)CSc1nnc(-c2ccc3ccccc3c2)o1 ZINC000434055590 860068957 /nfs/dbraw/zinc/06/89/57/860068957.db2.gz ZWFSEXOOICFMRM-UXHICEINSA-N 0 3 422.554 4.067 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)c2ccc(OCc3ccncc3)cc2)CN1Cc1ccccc1 ZINC000467701062 881497088 /nfs/dbraw/zinc/49/70/88/881497088.db2.gz QKRDRRRIESAKEL-WMZHIEFXSA-N 0 3 401.510 4.053 20 0 HIADHN Cc1cc(NC(=O)NC2CCC3(CC3)CC2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000434212524 860198715 /nfs/dbraw/zinc/19/87/15/860198715.db2.gz VHGOGNNNTDLWFU-NRFANRHFSA-N 0 3 407.562 4.483 20 0 HIADHN CCCNc1ccc(CNC(=O)Nc2ccc(N3CCN(CC)CC3)cc2C)cc1 ZINC000434230775 860215692 /nfs/dbraw/zinc/21/56/92/860215692.db2.gz JBJCXLBQPOYRDZ-UHFFFAOYSA-N 0 3 409.578 4.281 20 0 HIADHN O=C(N[C@H]1CCN(C2CC2)C1)[C@H](Oc1ccc(Cl)c(Cl)c1)c1ccccc1 ZINC000503233460 912212803 /nfs/dbraw/zinc/21/28/03/912212803.db2.gz QSIAYGALRSKCNL-MGPUTAFESA-N 0 3 405.325 4.466 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)NC[C@@H]2CCCN(c3ccccc3)C2)C1 ZINC000434263789 860240143 /nfs/dbraw/zinc/24/01/43/860240143.db2.gz KODZPAXHGKQTHY-GIWBLDEGSA-N 0 3 406.574 4.038 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)NC[C@H]2CCCN(c3ccccc3)C2)C1 ZINC000434263790 860240229 /nfs/dbraw/zinc/24/02/29/860240229.db2.gz KODZPAXHGKQTHY-MQSCRBSSSA-N 0 3 406.574 4.038 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)Cc1c(F)cccc1F ZINC000434318233 860278245 /nfs/dbraw/zinc/27/82/45/860278245.db2.gz SMMCJWJOZNPJGA-GOSISDBHSA-N 0 3 410.468 4.098 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)[C@@H]1CCOc2ccccc21 ZINC000434322053 860282102 /nfs/dbraw/zinc/28/21/02/860282102.db2.gz SWTVTMQNOMOAQW-RBBKRZOGSA-N 0 3 416.525 4.143 20 0 HIADHN CC[C@@H](C)c1cc(C(=O)Nc2c(C)cnn2[C@@H]2CCN(Cc3ccccc3)C2)on1 ZINC000434322715 860283676 /nfs/dbraw/zinc/28/36/76/860283676.db2.gz XJLUKHTXCVZHFA-VQIMIIECSA-N 0 3 407.518 4.392 20 0 HIADHN Cc1cc(C)n([C@H](C)CC(=O)Nc2c(C)cnn2[C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000434324442 860286497 /nfs/dbraw/zinc/28/64/97/860286497.db2.gz DEGHEODPCRIMEX-IFMALSPDSA-N 0 3 420.561 4.042 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)[C@@H]1CSc2ccccc21 ZINC000434324773 860286534 /nfs/dbraw/zinc/28/65/34/860286534.db2.gz FRGCEAATUMESKW-TZIWHRDSSA-N 0 3 418.566 4.467 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)CCOc1ccc(F)cc1 ZINC000434330056 860292215 /nfs/dbraw/zinc/29/22/15/860292215.db2.gz IHKTXVGDZBXSRD-NRFANRHFSA-N 0 3 422.504 4.185 20 0 HIADHN CCOc1ccc(Oc2cc(CNC(=O)NC[C@H]3CCCCN3C3CC3)ccn2)cc1 ZINC000434352854 860306651 /nfs/dbraw/zinc/30/66/51/860306651.db2.gz QFCVGZQYVHBGBK-HXUWFJFHSA-N 0 3 424.545 4.089 20 0 HIADHN C[C@@H]1CCN(C(=O)c2ccc(-c3nc(C4CC4)no3)cc2)CCN1Cc1ccccc1 ZINC000434351060 860307041 /nfs/dbraw/zinc/30/70/41/860307041.db2.gz IWSHZUDJGHEUNA-GOSISDBHSA-N 0 3 416.525 4.351 20 0 HIADHN CCn1c(C)cc(C(=O)Nc2c(C)cnn2[C@@H]2CCN(Cc3ccccc3)C2)c1C ZINC000434413043 860339521 /nfs/dbraw/zinc/33/95/21/860339521.db2.gz SWUATRNTXCOURM-OAQYLSRUSA-N 0 3 405.546 4.329 20 0 HIADHN O=C(Cc1csc(COc2ccc(Cl)cc2)n1)NC[C@H]1CCCCN1C1CC1 ZINC000434425561 860343987 /nfs/dbraw/zinc/34/39/87/860343987.db2.gz PKUPOUPGQLIMIW-GOSISDBHSA-N 0 3 419.978 4.051 20 0 HIADHN Cc1cccc(-c2nnc(-c3ccc(C(=O)NC[C@@H]4CCCCN4C4CC4)cc3)o2)c1 ZINC000434425352 860344306 /nfs/dbraw/zinc/34/43/06/860344306.db2.gz OEZPZJOQMCKBLJ-QFIPXVFZSA-N 0 3 416.525 4.459 20 0 HIADHN O=C(NC[C@H]1CCCCN1C1CC1)c1ccccc1SCc1cn2ccccc2n1 ZINC000434443519 860354990 /nfs/dbraw/zinc/35/49/90/860354990.db2.gz ZQHBYDZZXCEMKW-HXUWFJFHSA-N 0 3 420.582 4.373 20 0 HIADHN Cc1nc(CSc2ccccc2C(=O)NC[C@@H]2CCCCN2C2CC2)cs1 ZINC000434445587 860356054 /nfs/dbraw/zinc/35/60/54/860356054.db2.gz OUNJBFKZPCTVAK-SFHVURJKSA-N 0 3 401.601 4.491 20 0 HIADHN C[C@@H]1CN(CCOC2CCN(CCc3cccc(Cl)c3Cl)CC2)C[C@@H](C)O1 ZINC000434477458 860365936 /nfs/dbraw/zinc/36/59/36/860365936.db2.gz BLPFCNYCXBZQNE-IAGOWNOFSA-N 0 3 415.405 4.126 20 0 HIADHN O=C(NC[C@@H]1CCCCN1C1CC1)c1cnc2ccc(Oc3ccccc3)cc2c1O ZINC000434498861 860374328 /nfs/dbraw/zinc/37/43/28/860374328.db2.gz JUMRWIUTGHLXSN-SFHVURJKSA-N 0 3 417.509 4.067 20 0 HIADHN CCOC(=O)CC1(NCc2ccnc(-c3ccc(Br)cc3)n2)CCCC1 ZINC000434617182 860432477 /nfs/dbraw/zinc/43/24/77/860432477.db2.gz TVJFQDJRMRQMTP-UHFFFAOYSA-N 0 3 418.335 4.262 20 0 HIADHN C[C@@H](C(=O)Nc1cccc(C(F)(F)F)c1)N1CCC(c2ncc3n2CCCC3)CC1 ZINC000434663248 860450550 /nfs/dbraw/zinc/45/05/50/860450550.db2.gz FGGNDOHKTYNNPF-HNNXBMFYSA-N 0 3 420.479 4.445 20 0 HIADHN COc1ccc(CN(C)CCC(=O)Nc2cc(F)cc(F)c2)cc1OC(F)F ZINC000434699527 860465625 /nfs/dbraw/zinc/46/56/25/860465625.db2.gz LOBNUOBHMTUTKN-UHFFFAOYSA-N 0 3 400.372 4.035 20 0 HIADHN CN(Cc1cc(Cl)ccc1OCc1cccnc1)C1CCN(c2cnccn2)CC1 ZINC000434734900 860476291 /nfs/dbraw/zinc/47/62/91/860476291.db2.gz HGNZYUWLIXLMIC-UHFFFAOYSA-N 0 3 423.948 4.205 20 0 HIADHN C[C@H](C(=O)N[C@@H](C)c1ccc(Cl)cc1)N1CCC(c2ncc3n2CCCC3)CC1 ZINC000434751231 860481210 /nfs/dbraw/zinc/48/12/10/860481210.db2.gz CUUHZBQCOCDYFC-DLBZAZTESA-N 0 3 414.981 4.318 20 0 HIADHN C[C@H]1CN(CCCCNC(=O)c2ccc(-c3nc4ccccc4s3)o2)C[C@H](C)O1 ZINC000434761873 860485453 /nfs/dbraw/zinc/48/54/53/860485453.db2.gz CNWUJYCJHMIZDW-HOTGVXAUSA-N 0 3 413.543 4.176 20 0 HIADHN CC(C)[C@@H]1CCCN1CC(=O)N(Cc1nnc(-c2ccccc2Cl)o1)C1CC1 ZINC000434834925 860513296 /nfs/dbraw/zinc/51/32/96/860513296.db2.gz WVCAEDJQQCIWMC-SFHVURJKSA-N 0 3 402.926 4.001 20 0 HIADHN CCN(CC)C(=O)c1cccc(NC(=O)[C@H](C)N2CC[C@@H](c3ccccc3)[C@@H]2C)c1 ZINC000434901907 860545492 /nfs/dbraw/zinc/54/54/92/860545492.db2.gz FYDAMKSTFBPQBH-SFYKDHMMSA-N 0 3 407.558 4.374 20 0 HIADHN COc1ccc([C@H]2CCCN2Cc2ccc(OCC(=O)N3CCCC3)c(OC)c2)cc1 ZINC000434984425 860585739 /nfs/dbraw/zinc/58/57/39/860585739.db2.gz AFFPYUSPCHRVHH-JOCHJYFZSA-N 0 3 424.541 4.042 20 0 HIADHN CSc1nc(-c2ccco2)nc(C)c1C(=O)N[C@H]1C[C@@H](C)N(Cc2ccccc2)C1 ZINC000467751273 881559782 /nfs/dbraw/zinc/55/97/82/881559782.db2.gz AQMNYZCQIYZIGZ-QAPCUYQASA-N 0 3 422.554 4.160 20 0 HIADHN C[C@@H]1CN(CCN(C)Cc2cccc(NC(=O)c3ccccc3Cl)c2)C[C@H](C)O1 ZINC000435052284 860616244 /nfs/dbraw/zinc/61/62/44/860616244.db2.gz GXKBSHJSYQBNJP-HDICACEKSA-N 0 3 415.965 4.133 20 0 HIADHN CN(Cc1cc(Br)c(Cl)s1)C1CCN(c2cnccn2)CC1 ZINC000435054916 860617944 /nfs/dbraw/zinc/61/79/44/860617944.db2.gz GKHFQOAXHNSNMN-UHFFFAOYSA-N 0 3 401.761 4.055 20 0 HIADHN Cc1cccc(-c2cc(Cl)ccc2NC(=O)N2CCCN([C@@H](C)CO)CC2)c1 ZINC000435185843 860685133 /nfs/dbraw/zinc/68/51/33/860685133.db2.gz YTWDZWBNMKCBMP-KRWDZBQOSA-N 0 3 401.938 4.236 20 0 HIADHN Cc1cc(NC(=O)c2cnn(C(C)(C)C)c2C)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435273252 860711726 /nfs/dbraw/zinc/71/17/26/860711726.db2.gz XXPKFASIONOEAB-HXUWFJFHSA-N 0 3 420.561 4.151 20 0 HIADHN Cc1cc(NC(=O)c2cccc3cnccc32)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435275758 860713092 /nfs/dbraw/zinc/71/30/92/860713092.db2.gz AYGLYGSIXUSQGN-NRFANRHFSA-N 0 3 411.509 4.439 20 0 HIADHN Cc1cc(NC(=O)CO[C@@H]2CCCC[C@H]2C)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435277529 860713970 /nfs/dbraw/zinc/71/39/70/860713970.db2.gz CXKJEDWRRDUSIG-BVYCBKJFSA-N 0 3 410.562 4.172 20 0 HIADHN CCc1nc(C)c(C(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)s1 ZINC000435281052 860716216 /nfs/dbraw/zinc/71/62/16/860716216.db2.gz PNJCYPRRPVVJDU-SFHVURJKSA-N 0 3 409.559 4.218 20 0 HIADHN Cc1cc(NC(=O)c2cc(C(C)(C)C)on2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435280775 860716334 /nfs/dbraw/zinc/71/63/34/860716334.db2.gz NJJFTUZNWHKATL-GOSISDBHSA-N 0 3 407.518 4.176 20 0 HIADHN CC(=O)c1ccc(C(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)s1 ZINC000435282427 860716849 /nfs/dbraw/zinc/71/68/49/860716849.db2.gz VBAUXXRTVMDIEG-GOSISDBHSA-N 0 3 408.527 4.155 20 0 HIADHN Cc1cc(NC(=O)C[C@H](C)c2cccnc2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435285130 860718922 /nfs/dbraw/zinc/71/89/22/860718922.db2.gz NWCYIHHRJQEYAJ-AVRDEDQJSA-N 0 3 403.530 4.166 20 0 HIADHN Cc1cc(NC(=O)C2(c3cccc(F)c3)CC2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435288556 860719876 /nfs/dbraw/zinc/71/98/76/860719876.db2.gz DBYVZUWYFAFMMN-QFIPXVFZSA-N 0 3 418.516 4.448 20 0 HIADHN CC(=O)c1cccc(C(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000435287731 860720297 /nfs/dbraw/zinc/72/02/97/860720297.db2.gz AQKDYFOPOBSXGJ-QFIPXVFZSA-N 0 3 402.498 4.093 20 0 HIADHN Cc1cc(NC(=O)[C@@H]2CSc3ccccc32)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435290709 860720887 /nfs/dbraw/zinc/72/08/87/860720887.db2.gz LHJXQXVZJXMDBH-TZIWHRDSSA-N 0 3 418.566 4.467 20 0 HIADHN CCOc1c(F)cccc1C(=O)Nc1cc(C)nn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435289206 860721119 /nfs/dbraw/zinc/72/11/19/860721119.db2.gz GNTRQZHMGWIINS-LJQANCHMSA-N 0 3 422.504 4.429 20 0 HIADHN Cc1cc(NC(=O)CCCOc2ccccc2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435292222 860722008 /nfs/dbraw/zinc/72/20/08/860722008.db2.gz RCILBMCEXHSUBL-QFIPXVFZSA-N 0 3 418.541 4.436 20 0 HIADHN CC(=O)c1csc(C(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000435293397 860722835 /nfs/dbraw/zinc/72/28/35/860722835.db2.gz YIDJBDMIVKFAGB-IBGZPJMESA-N 0 3 408.527 4.155 20 0 HIADHN CCO[C@@H](C(=O)Nc1cc(C)nn1[C@@H]1CCN(Cc2ccccc2)C1)c1ccccc1 ZINC000435293272 860723243 /nfs/dbraw/zinc/72/32/43/860723243.db2.gz WYNCBZZFNNHZIC-ISKFKSNPSA-N 0 3 418.541 4.355 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)Nc1c2c(ccc1Cl)CC(C)(C)O2 ZINC000435328561 860740110 /nfs/dbraw/zinc/74/01/10/860740110.db2.gz RZLUXDBUWNLMAN-UHFFFAOYSA-N 0 3 402.926 4.044 20 0 HIADHN CC(C)c1noc(-c2ccccc2C(=O)N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)n1 ZINC000467757136 881574568 /nfs/dbraw/zinc/57/45/68/881574568.db2.gz XAUYHMLMPHNUOJ-HKUYNNGSSA-N 0 3 404.514 4.253 20 0 HIADHN COc1ccccc1[C@H](C)CC(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435369474 860766982 /nfs/dbraw/zinc/76/69/82/860766982.db2.gz FOGJBRQRACFRTO-CTNGQTDRSA-N 0 3 418.541 4.471 20 0 HIADHN C[C@@H](Cc1ccccc1F)C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435370917 860768125 /nfs/dbraw/zinc/76/81/25/860768125.db2.gz ROXQMZIGRJEVIS-GHTZIAJQSA-N 0 3 406.505 4.287 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)c1csc(-c2ccoc2)n1 ZINC000435370459 860768176 /nfs/dbraw/zinc/76/81/76/860768176.db2.gz PLISVWFMADSBRB-GOSISDBHSA-N 0 3 419.510 4.299 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)c1ccc2ncsc2c1 ZINC000435374301 860772884 /nfs/dbraw/zinc/77/28/84/860772884.db2.gz QBRCIYLLNFUFNO-GOSISDBHSA-N 0 3 403.511 4.192 20 0 HIADHN CCOc1c(F)cccc1C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435377060 860773844 /nfs/dbraw/zinc/77/38/44/860773844.db2.gz XQVJKYKDIJEEHQ-GOSISDBHSA-N 0 3 408.477 4.120 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)[C@H]1CCCc2sccc21 ZINC000435377398 860774694 /nfs/dbraw/zinc/77/46/94/860774694.db2.gz BCVSLUDLJFDVLR-QUCCMNQESA-N 0 3 406.555 4.450 20 0 HIADHN O=C(Cc1ccc2c(c1)CCC2)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435379645 860776195 /nfs/dbraw/zinc/77/61/95/860776195.db2.gz MZVQTKRZDDQCPI-QHCPKHFHSA-N 0 3 400.526 4.000 20 0 HIADHN O=C(Cc1coc2cc(F)ccc12)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435379881 860776322 /nfs/dbraw/zinc/77/63/22/860776322.db2.gz KZDDRONCUAJDCZ-FQEVSTJZSA-N 0 3 418.472 4.397 20 0 HIADHN CC(C)[C@H](C(=O)NC1CCN(CCOc2ccc(Cl)cc2)CC1)c1cccnc1 ZINC000435456826 860805385 /nfs/dbraw/zinc/80/53/85/860805385.db2.gz IGLOYWLYUAOENQ-QFIPXVFZSA-N 0 3 415.965 4.134 20 0 HIADHN Cc1cc(NC(=O)N(C)[C@@H](C)c2cccnc2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435511174 860829542 /nfs/dbraw/zinc/82/95/42/860829542.db2.gz LXKOWHHILFWEPL-SIKLNZKXSA-N 0 3 418.545 4.258 20 0 HIADHN Cc1cc(NC(=O)N(C)Cc2csc(C)n2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435517441 860834878 /nfs/dbraw/zinc/83/48/78/860834878.db2.gz XISVPRJXGRMJQF-FQEVSTJZSA-N 0 3 424.574 4.067 20 0 HIADHN Cc1cc(NC(=O)N(C)Cc2csc(C)n2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435517442 860834960 /nfs/dbraw/zinc/83/49/60/860834960.db2.gz XISVPRJXGRMJQF-HXUWFJFHSA-N 0 3 424.574 4.067 20 0 HIADHN Cc1cc(NC(=O)N2CCC[C@@H]3CCC[C@@H]32)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435518204 860836062 /nfs/dbraw/zinc/83/60/62/860836062.db2.gz ZWGKZXVQBFJIKR-BDTNDASRSA-N 0 3 407.562 4.435 20 0 HIADHN Cc1cc(NC(=O)N(C)[C@@H](C)c2ccco2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435518308 860836412 /nfs/dbraw/zinc/83/64/12/860836412.db2.gz IQVFEUSPLRHVSF-ICSRJNTNSA-N 0 3 407.518 4.456 20 0 HIADHN Cc1cc(NC(=O)N(C)Cc2cccc(F)c2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435518721 860836507 /nfs/dbraw/zinc/83/65/07/860836507.db2.gz KGGQSIAOUZHDRS-QFIPXVFZSA-N 0 3 421.520 4.442 20 0 HIADHN Cc1cc(NC(=O)N[C@@H](C)Cc2cccs2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435518082 860836702 /nfs/dbraw/zinc/83/67/02/860836702.db2.gz SHDMCBCPMXBZPR-FXAWDEMLSA-N 0 3 423.586 4.453 20 0 HIADHN Cc1cc(NC(=O)NCCc2cccc(C)c2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435521522 860838548 /nfs/dbraw/zinc/83/85/48/860838548.db2.gz WVBOALBODYPYBS-QHCPKHFHSA-N 0 3 417.557 4.311 20 0 HIADHN CCSCC[C@H](C)NC(=O)Nc1cc(C)nn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435521687 860838690 /nfs/dbraw/zinc/83/86/90/860838690.db2.gz IOOWBFBYLIQCKU-FXAWDEMLSA-N 0 3 415.607 4.292 20 0 HIADHN CCSCC[C@H](C)NC(=O)Nc1cc(C)nn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435521688 860839190 /nfs/dbraw/zinc/83/91/90/860839190.db2.gz IOOWBFBYLIQCKU-PXNSSMCTSA-N 0 3 415.607 4.292 20 0 HIADHN Cc1cc(NC(=O)N[C@H](C)c2cccc(O)c2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435525558 860842460 /nfs/dbraw/zinc/84/24/60/860842460.db2.gz FDQUNGHGYFWNHX-NQIIRXRSSA-N 0 3 419.529 4.227 20 0 HIADHN Cc1cc(NC(=O)N[C@@H]2CCc3ccccc32)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435526826 860843343 /nfs/dbraw/zinc/84/33/43/860843343.db2.gz JRHYOKBOMFZNQL-FYYLOGMGSA-N 0 3 415.541 4.448 20 0 HIADHN Cc1cc(NC(=O)N2C[C@@H]3CCCC[C@@H]3C2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435533037 860848406 /nfs/dbraw/zinc/84/84/06/860848406.db2.gz HBFPRVLXOKODNW-BDTNDASRSA-N 0 3 407.562 4.292 20 0 HIADHN Cc1c(NC(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)cnn1-c1ccccc1 ZINC000435552736 860868230 /nfs/dbraw/zinc/86/82/30/860868230.db2.gz WAWQXBHRLOSVFG-IBGZPJMESA-N 0 3 403.530 4.309 20 0 HIADHN CC(C)C(=O)Nc1ccc(CNC(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000467776862 881596545 /nfs/dbraw/zinc/59/65/45/881596545.db2.gz UQJRCHRZCOHLAJ-QHCPKHFHSA-N 0 3 422.573 4.087 20 0 HIADHN Cn1cc(C(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)c2cc(F)ccc21 ZINC000435770398 861045560 /nfs/dbraw/zinc/04/55/60/861045560.db2.gz ZZYNUMBAMLOAGQ-LJQANCHMSA-N 0 3 417.488 4.213 20 0 HIADHN O=C(NCCN1CCCCC1)N[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 ZINC000435840873 861103154 /nfs/dbraw/zinc/10/31/54/861103154.db2.gz UJGRASJPHBXWEF-HNNXBMFYSA-N 0 3 411.390 4.484 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)N1CC(Cc2ccc(F)c(F)c2)C1 ZINC000435858717 861117826 /nfs/dbraw/zinc/11/78/26/861117826.db2.gz RMNRJSNSHJLBMO-IBGZPJMESA-N 0 3 405.514 4.047 20 0 HIADHN Cc1cccc2nc(C3CCN(C(=O)N[C@@H]4CCN(Cc5ccccc5)C4)CC3)oc21 ZINC000435861604 861119751 /nfs/dbraw/zinc/11/97/51/861119751.db2.gz JZIZDAYVINEGJH-OAQYLSRUSA-N 0 3 418.541 4.300 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@@H](C)N[C@@H](C)c2ccc(Br)cc2)cc1F ZINC000435904781 861163551 /nfs/dbraw/zinc/16/35/51/861163551.db2.gz ZGXMJFOIFRWDHB-UONOGXRCSA-N 0 3 423.326 4.295 20 0 HIADHN Cc1cc(NC(=O)[C@@H]2CCCc3cccnc32)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435911357 861172895 /nfs/dbraw/zinc/17/28/95/861172895.db2.gz LJBUCXZGTHBZFM-FGZHOGPDSA-N 0 3 415.541 4.092 20 0 HIADHN C[C@H](Oc1ccc(C(F)(F)F)cc1)C(=O)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000437892907 863260030 /nfs/dbraw/zinc/26/00/30/863260030.db2.gz ZGDYDVXSOPTFPA-HNNXBMFYSA-N 0 3 422.447 4.068 20 0 HIADHN Cc1ccc(-c2nnco2)cc1NC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1 ZINC000438083577 863478519 /nfs/dbraw/zinc/47/85/19/863478519.db2.gz YANWGOPSSSTARO-SFHVURJKSA-N 0 3 405.502 4.173 20 0 HIADHN Cc1ccc2cc(CNCc3ccc(S(=O)(=O)N4CCC[C@H](C)C4)cc3)ccc2n1 ZINC000438098969 863505499 /nfs/dbraw/zinc/50/54/99/863505499.db2.gz XLUZADCBXISTKJ-SFHVURJKSA-N 0 3 423.582 4.254 20 0 HIADHN C[C@H]1CCN(C(=O)Nc2ccc(N3CCCC3=O)c(F)c2)CCN1Cc1ccccc1 ZINC000438154698 863575244 /nfs/dbraw/zinc/57/52/44/863575244.db2.gz PWOQCUQDLRRQJI-SFHVURJKSA-N 0 3 424.520 4.081 20 0 HIADHN C[C@H](NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)nc1)c1cccc(Br)c1 ZINC000467837988 881674054 /nfs/dbraw/zinc/67/40/54/881674054.db2.gz DBSZYDKWXAZRLV-OAGGEKHMSA-N 0 3 404.352 4.309 20 0 HIADHN Cc1cc(-c2nc3cc(F)ccc3n2C)ccc1NC(=O)N1CC[C@H](N2CC=CC2)C1 ZINC000438295833 863773631 /nfs/dbraw/zinc/77/36/31/863773631.db2.gz RSMITENSZOLFSZ-IBGZPJMESA-N 0 3 419.504 4.166 20 0 HIADHN COc1cc(CN(C)CC2(CO)CC2)cc(Br)c1OCc1ccccc1 ZINC000438330644 863807026 /nfs/dbraw/zinc/80/70/26/863807026.db2.gz LEAFGRLBGATHLJ-UHFFFAOYSA-N 0 3 420.347 4.241 20 0 HIADHN CN(C)CCN(C[C@@H]1CCCO1)C(=O)Nc1cccc(Cl)c1SCC(F)F ZINC000438332216 863808067 /nfs/dbraw/zinc/80/80/67/863808067.db2.gz CPENUOQLLLFMHZ-ZDUSSCGKSA-N 0 3 421.941 4.272 20 0 HIADHN CCOc1cccc([C@@H]2C[C@H]2NC(=O)N(Cc2ccccc2)C2CCN(C)CC2)c1 ZINC000438338270 863812307 /nfs/dbraw/zinc/81/23/07/863812307.db2.gz DCOJFCDAQQHRMD-BJKOFHAPSA-N 0 3 407.558 4.247 20 0 HIADHN COc1ccc(Oc2ccc(NC(=O)N(CCN(C)C)Cc3ccccc3)cn2)cc1 ZINC000438395686 863844934 /nfs/dbraw/zinc/84/49/34/863844934.db2.gz GJXXJEOFUCWNBA-UHFFFAOYSA-N 0 3 420.513 4.478 20 0 HIADHN CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)N[C@H]1C[C@H](c2cccc(Cl)c2)C1 ZINC000438417763 863856677 /nfs/dbraw/zinc/85/66/77/863856677.db2.gz FWVDIUUWJYEBLB-LGGPRVQUSA-N 0 3 412.965 4.315 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)N[C@H]1C[C@H](c2cc(F)cc(F)c2)C1 ZINC000438422290 863858289 /nfs/dbraw/zinc/85/82/89/863858289.db2.gz PRTSIHPEAQEAHY-IRJFHVNHSA-N 0 3 405.464 4.123 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)N[C@H]1C[C@H](c2cccc(F)c2)C1 ZINC000438452270 863877651 /nfs/dbraw/zinc/87/76/51/863877651.db2.gz VRNVRVDRIMWKTC-IRJFHVNHSA-N 0 3 405.464 4.123 20 0 HIADHN CCCOc1c(Cl)cc(C(=O)N(CCN(C)C)Cc2cccs2)cc1OC ZINC000438465760 863887576 /nfs/dbraw/zinc/88/75/76/863887576.db2.gz LJBGZIBYPBQSDP-UHFFFAOYSA-N 0 3 410.967 4.403 20 0 HIADHN Cc1nn(-c2ccc(Cl)c(Cl)c2)c(NC(=O)N2CC[C@@H](N3CC=CC3)C2)c1C ZINC000438496790 863916953 /nfs/dbraw/zinc/91/69/53/863916953.db2.gz BUELQLSDJFYEEL-MRXNPFEDSA-N 0 3 420.344 4.274 20 0 HIADHN CCc1cnc(NC(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)s1 ZINC000438544054 863971862 /nfs/dbraw/zinc/97/18/62/863971862.db2.gz DGGHWIDNZUCKDO-UHFFFAOYSA-N 0 3 400.470 4.320 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Nc1ccc(OC(F)F)c2ncccc12 ZINC000438618740 864044546 /nfs/dbraw/zinc/04/45/46/864044546.db2.gz IOJYLXZCNHQXMB-UHFFFAOYSA-N 0 3 420.485 4.493 20 0 HIADHN CCN(C(=O)C(=O)Nc1ccc(F)cc1Cl)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000438645052 864082059 /nfs/dbraw/zinc/08/20/59/864082059.db2.gz BYAAWEFIECJLDS-YJBOKZPZSA-N 0 3 417.912 4.102 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)Nc2ccc(N3CCCC3=O)c(F)c2)CC1 ZINC000438645367 864084059 /nfs/dbraw/zinc/08/40/59/864084059.db2.gz JXPXXWSUAPKQEX-UHFFFAOYSA-N 0 3 424.520 4.081 20 0 HIADHN CCCOc1cccc(NC(=O)C(=O)N(CC)[C@H]2CCN([C@H](C)c3ccccc3)C2)c1 ZINC000438646944 864085906 /nfs/dbraw/zinc/08/59/06/864085906.db2.gz FWRXBJAYEXUXTF-KNQAVFIVSA-N 0 3 423.557 4.098 20 0 HIADHN Cn1ccnc1-c1cccc(NC(=O)N(Cc2ccccc2)C2CCN(C)CC2)c1 ZINC000438662103 864111271 /nfs/dbraw/zinc/11/12/71/864111271.db2.gz BUYXNCMJSIUTMW-UHFFFAOYSA-N 0 3 403.530 4.215 20 0 HIADHN CCOc1cc(C)ccc1NC(=O)C(=O)N(CC)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000438665204 864115240 /nfs/dbraw/zinc/11/52/40/864115240.db2.gz CINGLMUYVSDZRC-PZJWPPBQSA-N 0 3 423.557 4.016 20 0 HIADHN CCN(C(=O)C(=O)Nc1ccccc1SC)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000438666550 864120727 /nfs/dbraw/zinc/12/07/27/864120727.db2.gz ICSBYYDJJACVQU-PKOBYXMFSA-N 0 3 411.571 4.031 20 0 HIADHN CCOc1ccc(NC(=O)C(=O)N(CC)[C@@H]2CCN([C@@H](C)c3ccccc3)C2)c(C)c1 ZINC000438666752 864121464 /nfs/dbraw/zinc/12/14/64/864121464.db2.gz RVCIWUIXFGPIJK-PZJWPPBQSA-N 0 3 423.557 4.016 20 0 HIADHN CCN(C(=O)C(=O)Nc1cc2[nH]ccc2cc1C)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000438666638 864121637 /nfs/dbraw/zinc/12/16/37/864121637.db2.gz VIFULAGCGPKDHH-NQIIRXRSSA-N 0 3 418.541 4.099 20 0 HIADHN CCCNC(=O)c1ccc(NC(=O)N(CCN(C)C)Cc2cccs2)cc1Cl ZINC000438670203 864129143 /nfs/dbraw/zinc/12/91/43/864129143.db2.gz BZRZDMMHFNIQSD-UHFFFAOYSA-N 0 3 422.982 4.137 20 0 HIADHN CCC[C@H](N[C@H](C)c1ccc(OC)c(OC)c1)C(=O)N1CCc2sccc2C1 ZINC000467876335 881738462 /nfs/dbraw/zinc/73/84/62/881738462.db2.gz GGECUXSAXFOQLC-QAPCUYQASA-N 0 3 402.560 4.170 20 0 HIADHN COc1cc(CN(C)C[C@H](O)CO[C@@H](c2ccccc2)c2ccccc2C)ccc1O ZINC000438793014 864286787 /nfs/dbraw/zinc/28/67/87/864286787.db2.gz JRMPYRRPCZHISB-NVQXNPDNSA-N 0 3 421.537 4.308 20 0 HIADHN Cc1ccsc1[C@@H]1C[C@@H]1C(=O)NC1CCN(CCOc2ccc(Cl)cc2)CC1 ZINC000438841798 864335425 /nfs/dbraw/zinc/33/54/25/864335425.db2.gz MNVBCFCYCGFQHX-UXHICEINSA-N 0 3 418.990 4.473 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Nc1ccc(F)c(Br)c1 ZINC000438886532 864371635 /nfs/dbraw/zinc/37/16/35/864371635.db2.gz NHRNTSHRYKVRAX-UHFFFAOYSA-N 0 3 400.317 4.245 20 0 HIADHN O=C(C1CCN(CC(F)F)CC1)N1CCN(Cc2ccccc2)C2(CCCCC2)C1 ZINC000438910809 864391105 /nfs/dbraw/zinc/39/11/05/864391105.db2.gz IIISYQCDUCNHLK-UHFFFAOYSA-N 0 3 419.560 4.011 20 0 HIADHN Cc1cc(C)c(CC(C(=O)N2CCNC(=O)c3ccccc32)C(F)(F)F)c(C)c1 ZINC000438951093 864422335 /nfs/dbraw/zinc/42/23/35/864422335.db2.gz IPAOPSIBZVFVOE-SFHVURJKSA-N 0 3 404.432 4.109 20 0 HIADHN C[C@@H]1CC[C@H](O)[C@H]([C@H]2CCCCN2Cc2nnc(-c3ccc(Br)o3)o2)C1 ZINC000438993326 864452039 /nfs/dbraw/zinc/45/20/39/864452039.db2.gz JUNZJXYSZGRSRW-BARDWOONSA-N 0 3 424.339 4.244 20 0 HIADHN CN(CC(=O)N1CCC(Cc2ccccc2)CC1)C1CCN(c2ccccc2)CC1 ZINC000438999674 864455191 /nfs/dbraw/zinc/45/51/91/864455191.db2.gz AXPRTSQOJSVPNA-UHFFFAOYSA-N 0 3 405.586 4.069 20 0 HIADHN O[C@@H]1CCCC[C@@H]1[C@@H]1CCCCN1Cc1csc(-c2ccc3c(c2)OCO3)n1 ZINC000439015692 864466073 /nfs/dbraw/zinc/46/60/73/864466073.db2.gz SZSYRWUPLQOFNP-CEXWTWQISA-N 0 3 400.544 4.444 20 0 HIADHN Cc1cc(Br)ccc1NC(=O)CN1CCCC[C@@H]1[C@@H]1C[C@H](C)CC[C@@H]1O ZINC000439014793 864466464 /nfs/dbraw/zinc/46/64/64/864466464.db2.gz KITWZNURCUQHSB-FPWFTKFVSA-N 0 3 423.395 4.348 20 0 HIADHN Cc1ccsc1[C@@H]1C[C@@H]1C(=O)NCCCCN1CCN(c2cccc(C)c2)CC1 ZINC000439043536 864495485 /nfs/dbraw/zinc/49/54/85/864495485.db2.gz XEJPJIWIRNWIFD-YADHBBJMSA-N 0 3 411.615 4.187 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)NCc1nc2cc(Cl)ccc2s1 ZINC000439162439 864592315 /nfs/dbraw/zinc/59/23/15/864592315.db2.gz CMQROEUJOIDFTG-UHFFFAOYSA-N 0 3 408.980 4.285 20 0 HIADHN CCCOc1ccc(S(=O)(=O)N(CC)C[C@@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000439240607 864657701 /nfs/dbraw/zinc/65/77/01/864657701.db2.gz WWIFJTHLYILEJT-OAQYLSRUSA-N 0 3 416.587 4.008 20 0 HIADHN CC[C@](C)(O)CN(Cc1ccccc1)Cc1cccc(C(=O)NCc2ccco2)c1 ZINC000439270982 864688410 /nfs/dbraw/zinc/68/84/10/864688410.db2.gz GGRRJLJLGIKVPN-VWLOTQADSA-N 0 3 406.526 4.373 20 0 HIADHN CCC[C@H](CNC(=O)CN(C)[C@H]1CC[C@H](O)CC1)c1ccc(Cl)cc1Cl ZINC000439285525 864706797 /nfs/dbraw/zinc/70/67/97/864706797.db2.gz OPPUUNRICAAEOL-DJIMGWMZSA-N 0 3 401.378 4.229 20 0 HIADHN Cc1ccc2nc(CN3CCC(c4cccc(Br)c4)CC3)cc(=O)n2c1 ZINC000439332311 864769927 /nfs/dbraw/zinc/76/99/27/864769927.db2.gz RCEIBWXSILQSLU-UHFFFAOYSA-N 0 3 412.331 4.145 20 0 HIADHN Clc1ccc(OC[C@H]2CCCO2)c(CNCCc2ccn(-c3ccccc3)n2)c1 ZINC000439470049 864843599 /nfs/dbraw/zinc/84/35/99/864843599.db2.gz NWLCIFCNOWPDFI-JOCHJYFZSA-N 0 3 411.933 4.416 20 0 HIADHN COc1cccc([C@H](CNCc2cc(Cl)ccc2OC[C@@H]2CCCO2)N(C)C)c1 ZINC000439480610 864846454 /nfs/dbraw/zinc/84/64/54/864846454.db2.gz VLIRIAPGJPTNPI-VXKWHMMOSA-N 0 3 418.965 4.299 20 0 HIADHN COc1ccccc1C[C@@H](NC(=O)N(CCN(C)C)Cc1cccs1)C(C)C ZINC000439487109 864849300 /nfs/dbraw/zinc/84/93/00/864849300.db2.gz QIRBZWMRBTXUIZ-HXUWFJFHSA-N 0 3 403.592 4.097 20 0 HIADHN CN(Cc1ccco1)Cc1ccccc1CN[C@@H]1CCN(c2ccc(Cl)cc2)C1=O ZINC000439593348 864914849 /nfs/dbraw/zinc/91/48/49/864914849.db2.gz GWNXAVVDBGWXEL-HSZRJFAPSA-N 0 3 423.944 4.460 20 0 HIADHN C[C@@H](NCc1ccccc1CN(C)Cc1ccco1)C(=O)N1c2ccccc2C[C@H]1C ZINC000439595422 864917798 /nfs/dbraw/zinc/91/77/98/864917798.db2.gz JXLQMAOBGNPIBC-WOJBJXKFSA-N 0 3 417.553 4.368 20 0 HIADHN Cc1cc(-c2cc(C(=O)N(CCN(C)C)C(C)C)c3c(C)noc3n2)c(C)s1 ZINC000439611614 864934391 /nfs/dbraw/zinc/93/43/91/864934391.db2.gz IFWLKWDTUDVPIB-UHFFFAOYSA-N 0 3 400.548 4.289 20 0 HIADHN O=C(Nc1ccc2c(c1)C(=O)CCC2)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000467961892 881822358 /nfs/dbraw/zinc/82/23/58/881822358.db2.gz YPZKFCSRATVWLG-UHFFFAOYSA-N 0 3 409.452 4.132 20 0 HIADHN CC[C@H](Oc1ccccc1Cl)C(=O)NC1CCN([C@H](C)c2ccncc2)CC1 ZINC000439737903 865071016 /nfs/dbraw/zinc/07/10/16/865071016.db2.gz ZAXJAUBSMZNTDE-UZLBHIALSA-N 0 3 401.938 4.234 20 0 HIADHN C[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)NC1CCN([C@H](C)c2ccncc2)CC1 ZINC000439741094 865072134 /nfs/dbraw/zinc/07/21/34/865072134.db2.gz FGMUUARBWMWTFB-RTBURBONSA-N 0 3 409.574 4.488 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)Cc2csc(-c3cccc(F)c3)n2)CC1 ZINC000439751469 865080411 /nfs/dbraw/zinc/08/04/11/865080411.db2.gz YAWUJMMQVNDAIO-MRXNPFEDSA-N 0 3 424.545 4.229 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)Cc2csc(-c3cccc(F)c3)n2)CC1 ZINC000439751468 865080820 /nfs/dbraw/zinc/08/08/20/865080820.db2.gz YAWUJMMQVNDAIO-INIZCTEOSA-N 0 3 424.545 4.229 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)COc2cc(Cl)cc(Cl)c2)CC1 ZINC000439751197 865081042 /nfs/dbraw/zinc/08/10/42/865081042.db2.gz LDGAENNTDKZVHY-CQSZACIVSA-N 0 3 408.329 4.109 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)CCc2ccccc2OC(F)(F)F)CC1 ZINC000439757726 865085653 /nfs/dbraw/zinc/08/56/53/865085653.db2.gz HDCYGYGCQTYRRU-INIZCTEOSA-N 0 3 421.463 4.255 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)[C@H](C)Oc2cccc(C(C)(C)C)c2)CC1 ZINC000439768113 865093723 /nfs/dbraw/zinc/09/37/23/865093723.db2.gz LXCSPIWFFUEHEI-MOPGFXCFSA-N 0 3 409.574 4.488 20 0 HIADHN Cc1c(Br)cccc1C(=O)NC1CCN([C@@H](C)c2ccncc2)CC1 ZINC000439770242 865095363 /nfs/dbraw/zinc/09/53/63/865095363.db2.gz QCPGMFWONUQCAZ-HNNXBMFYSA-N 0 3 402.336 4.108 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3ccc(F)c(C4CC4)c3)CC2)C[C@H](C)O1 ZINC000439787127 865108213 /nfs/dbraw/zinc/10/82/13/865108213.db2.gz YVCQBDIZJQEVTB-CALCHBBNSA-N 0 3 403.542 4.446 20 0 HIADHN CCn1ncc(NC(=O)NC[C@@H](C(C)C)N2CCc3ccccc3C2)c1C(F)(F)F ZINC000439882372 865193577 /nfs/dbraw/zinc/19/35/77/865193577.db2.gz IQWKQXQHWGMLDW-SFHVURJKSA-N 0 3 423.483 4.126 20 0 HIADHN CCN(C(=O)Nc1cnn(CC)c1C(F)(F)F)[C@H]1CCN(Cc2ccccc2)C1 ZINC000439899771 865210929 /nfs/dbraw/zinc/21/09/29/865210929.db2.gz KPXFRWIUOOBZIH-INIZCTEOSA-N 0 3 409.456 4.050 20 0 HIADHN CCn1ncc(NC(=O)N(Cc2ccccc2)C2CCN(C)CC2)c1C(F)(F)F ZINC000439914850 865221610 /nfs/dbraw/zinc/22/16/10/865221610.db2.gz NSMLOENNSFMFCV-UHFFFAOYSA-N 0 3 409.456 4.050 20 0 HIADHN COc1ccc(OC)c(-c2csc(NC(=O)CN(C(C)C)C3CCCC3)n2)c1 ZINC000439949670 865244135 /nfs/dbraw/zinc/24/41/35/865244135.db2.gz KGHLMLFOPVVLRG-UHFFFAOYSA-N 0 3 403.548 4.419 20 0 HIADHN Cc1nnc(SCc2c3ccccc3oc2C(=O)N(CCN(C)C)C(C)C)s1 ZINC000439972324 865264042 /nfs/dbraw/zinc/26/40/42/865264042.db2.gz JEMBETSRNNZWKP-UHFFFAOYSA-N 0 3 418.588 4.297 20 0 HIADHN O=C(N[C@@H]1CCN(C2CC2)C1)N(Cc1cccc(C(F)(F)F)c1)Cc1ccccn1 ZINC000468019654 881855805 /nfs/dbraw/zinc/85/58/05/881855805.db2.gz BXPHAXGPMLQHRZ-LJQANCHMSA-N 0 3 418.463 4.049 20 0 HIADHN CC[C@H](C)NC(=O)[C@@H]1C[C@H](C)N(Cc2nc(-c3ccccc3)no2)[C@H]2CCCC[C@H]12 ZINC000439990247 865301003 /nfs/dbraw/zinc/30/10/03/865301003.db2.gz UCBHDJPPRJSCID-VXCLMFOKSA-N 0 3 410.562 4.421 20 0 HIADHN CN(C)CCN(C(=O)NCc1ccc(Oc2cccnc2)c(F)c1)C1CCCC1 ZINC000468039640 881869226 /nfs/dbraw/zinc/86/92/26/881869226.db2.gz UDIBHASKLARSPC-UHFFFAOYSA-N 0 3 400.498 4.029 20 0 HIADHN C[C@]1(CN[C@H](c2ccc(F)cc2)c2cccc(S(C)(=O)=O)c2)CCO[C@H]1C1CC1 ZINC000468050418 881876338 /nfs/dbraw/zinc/87/63/38/881876338.db2.gz YJCBPKFOIIYGJL-XPWALMASSA-N 0 3 417.546 4.113 20 0 HIADHN CCC(=O)Nc1ccc(NC(=O)N2CCN(C3CCC(C(C)C)CC3)CC2)cc1 ZINC000440252380 865493211 /nfs/dbraw/zinc/49/32/11/865493211.db2.gz FAHDYBZZNRXEFZ-UHFFFAOYSA-N 0 3 400.567 4.399 20 0 HIADHN C[C@]1(CN[C@@H](c2ccc(F)cc2)c2cccc(S(C)(=O)=O)c2)CCO[C@H]1C1CC1 ZINC000468050417 881876480 /nfs/dbraw/zinc/87/64/80/881876480.db2.gz YJCBPKFOIIYGJL-RJGXRXQPSA-N 0 3 417.546 4.113 20 0 HIADHN COc1ccc([C@H](C)NC(=O)N(CCN(C)C)C2CCCC2)cc1Br ZINC000468054882 881878094 /nfs/dbraw/zinc/87/80/94/881878094.db2.gz LIIYRONGUHECQY-AWEZNQCLSA-N 0 3 412.372 4.035 20 0 HIADHN CC(C)C1CCC(N2CCN([C@@H](C)C(=O)Nc3ccccc3OC(F)F)CC2)CC1 ZINC000440330957 865608675 /nfs/dbraw/zinc/60/86/75/865608675.db2.gz YMLJKQGWRWFAHP-VIQWUECVSA-N 0 3 423.548 4.447 20 0 HIADHN C[C@@H](C(=O)NC[C@H](c1cccs1)N1CCC(C)CC1)n1ccc2ccccc2c1=O ZINC000468072768 881888152 /nfs/dbraw/zinc/88/81/52/881888152.db2.gz DTYYNIBAKNMHOI-GHTZIAJQSA-N 0 3 423.582 4.213 20 0 HIADHN O=C(CCN1CCN(c2ccccc2)CC1)N[C@@H](CC(F)(F)F)c1ccccc1 ZINC000468079532 881891007 /nfs/dbraw/zinc/89/10/07/881891007.db2.gz NMLBHQPODQQKHY-FQEVSTJZSA-N 0 3 405.464 4.009 20 0 HIADHN COc1ccc([C@H](NC[C@H](O)COCc2ccccc2F)c2ccc(F)cc2)cc1 ZINC000440414335 865710207 /nfs/dbraw/zinc/71/02/07/865710207.db2.gz KIWMQMMJSXSVJW-XUZZJYLKSA-N 0 3 413.464 4.230 20 0 HIADHN CN(C)[C@H](CNC(=O)N1CCC[C@H]1c1nc2ccc(Cl)cc2[nH]1)c1cccs1 ZINC000440499908 865796715 /nfs/dbraw/zinc/79/67/15/865796715.db2.gz ABBDJKABUXDZLW-DLBZAZTESA-N 0 3 417.966 4.427 20 0 HIADHN COC(=O)CC1(CN2CCC(c3nc(-c4ccccc4OC)cs3)CC2)CC1 ZINC000440503061 865798903 /nfs/dbraw/zinc/79/89/03/865798903.db2.gz HTTBUWGUSHXWBL-UHFFFAOYSA-N 0 3 400.544 4.341 20 0 HIADHN Cc1ccc(/C=C/CC(=O)Nc2ccc(C(=O)N(C)[C@@H]3CCCN(C)C3)cc2)cc1 ZINC000440566772 865820838 /nfs/dbraw/zinc/82/08/38/865820838.db2.gz SDOIXDMLLYDCGN-FIYNHDKVSA-N 0 3 405.542 4.203 20 0 HIADHN COCc1ccc([C@@H]2CCCN2C(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)o1 ZINC000468101663 881910631 /nfs/dbraw/zinc/91/06/31/881910631.db2.gz KQNWGAIRFSWGOL-FCHUYYIVSA-N 0 3 411.546 4.418 20 0 HIADHN C[C@@H](CCC(=O)N1CCC[C@H](CN2CCN(c3ccccn3)CC2)C1)c1ccccc1 ZINC000440776105 865903080 /nfs/dbraw/zinc/90/30/80/865903080.db2.gz BEQCAFGLVIRKHJ-XZOQPEGZSA-N 0 3 420.601 4.026 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)c2cc(F)c(F)cc2Br)C1 ZINC000440793507 865916306 /nfs/dbraw/zinc/91/63/06/865916306.db2.gz CQTMAYXLOLOMQF-OCCSQVGLSA-N 0 3 409.274 4.293 20 0 HIADHN CCCCOC1CCN(C(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)CC1 ZINC000440823292 865937979 /nfs/dbraw/zinc/93/79/79/865937979.db2.gz MECBEAXFMXSOKE-NRFANRHFSA-N 0 3 412.496 4.249 20 0 HIADHN Cc1ccccc1[C@H](OC[C@H](O)CN1CCc2ccccc2[C@@H]1CO)c1ccccc1 ZINC000440911053 866006126 /nfs/dbraw/zinc/00/61/26/866006126.db2.gz KRPMBRFJBKNSCC-DURWQBQJSA-N 0 3 417.549 4.054 20 0 HIADHN CN1CCN(CCNC(=O)Nc2ccccc2Oc2ccc(Cl)cc2)CC1(C)C ZINC000440929272 866025726 /nfs/dbraw/zinc/02/57/26/866025726.db2.gz MMLGWTFWIDWDSW-UHFFFAOYSA-N 0 3 416.953 4.280 20 0 HIADHN CCc1nc2c(s1)[C@H](N(C)C[C@@H](O)CO[C@H]1CCCc3ccccc31)CCC2 ZINC000441023366 866089555 /nfs/dbraw/zinc/08/95/55/866089555.db2.gz OHBJLDIXKUYSMC-UIFIKXQLSA-N 0 3 400.588 4.470 20 0 HIADHN CCC(=O)Nc1ccc(Cl)c(NC(=O)c2ccc(N3CCN(CC)CC3)cc2)c1 ZINC000468121799 881956552 /nfs/dbraw/zinc/95/65/52/881956552.db2.gz UCNQCMPUOMMHPS-UHFFFAOYSA-N 0 3 414.937 4.083 20 0 HIADHN Cc1ccc([C@H]2CCC[C@@H]2N(C)C(=O)C(=O)Nc2cc(CN(C)C)ccc2C)cc1 ZINC000441255965 866329367 /nfs/dbraw/zinc/32/93/67/866329367.db2.gz HZUSVRUPXOYNLJ-GGAORHGYSA-N 0 3 407.558 4.098 20 0 HIADHN Cc1cc(CN(C)C(=O)N[C@H]2C[C@@H](C)N(C3CC3)C2)cc(C)c1OCC(F)(F)F ZINC000441280251 866354671 /nfs/dbraw/zinc/35/46/71/866354671.db2.gz CFJNJFLQWWVLGY-WBVHZDCISA-N 0 3 413.484 4.011 20 0 HIADHN COCc1nc(C(=O)N[C@H](C)CN(C)Cc2ccccc2)c(-c2ccccc2)s1 ZINC000441289983 866364652 /nfs/dbraw/zinc/36/46/52/866364652.db2.gz VZNSTFTWSABMTE-QGZVFWFLSA-N 0 3 409.555 4.207 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)Nc1ccc(CCC(F)(F)F)cc1 ZINC000441331101 866401718 /nfs/dbraw/zinc/40/17/18/866401718.db2.gz NIFFQNLVOSPDLO-UHFFFAOYSA-N 0 3 407.436 4.129 20 0 HIADHN COc1cc(CN[C@@H](C)c2ccccc2SC)ccc1OCC(=O)N1CCCC1 ZINC000441330115 866401822 /nfs/dbraw/zinc/40/18/22/866401822.db2.gz LJRXNMXOKMNDEI-KRWDZBQOSA-N 0 3 414.571 4.269 20 0 HIADHN Cc1ccc([C@@H]2CCC[C@H]2N(C)CC(=O)NC[C@@H]2CCN(c3ccccc3)C2)cc1 ZINC000441339842 866410392 /nfs/dbraw/zinc/41/03/92/866410392.db2.gz IYMIJKYRORAVKE-GVXSCFBNSA-N 0 3 405.586 4.206 20 0 HIADHN Cc1ccc([C@@H]2CCC[C@H]2N(C)CC(=O)Nc2ccccc2N2CCCC2=O)cc1 ZINC000441355588 866425111 /nfs/dbraw/zinc/42/51/11/866425111.db2.gz KNONLBQUXVYERK-RBBKRZOGSA-N 0 3 405.542 4.328 20 0 HIADHN C[S@@](=O)C1(CNCc2cc(Br)ccc2OCc2ccccc2)CC1 ZINC000441379988 866450080 /nfs/dbraw/zinc/45/00/80/866450080.db2.gz HAVAWGHTPZDDPC-XMMPIXPASA-N 0 3 408.361 4.029 20 0 HIADHN COCCN(C(=O)N[C@@H]1C[C@@H](C)N(C2CC2)C1)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000441397337 866469661 /nfs/dbraw/zinc/46/96/61/866469661.db2.gz QLKFEEXJEABSBB-RVKKMQEKSA-N 0 3 413.484 4.050 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N(C)[C@@H](C)[C@H](C)c1ccc(Cl)cc1 ZINC000441399991 866473355 /nfs/dbraw/zinc/47/33/55/866473355.db2.gz FVWIDHAVCUYNLQ-IRXDYDNUSA-N 0 3 415.965 4.299 20 0 HIADHN C[C@H](c1ccc(Br)cc1)N1CCN(CCCCCn2cccn2)CC1 ZINC000441476239 866553500 /nfs/dbraw/zinc/55/35/00/866553500.db2.gz JYJVVUYFAZSUQN-GOSISDBHSA-N 0 3 405.384 4.195 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)C[C@H](C)C(=O)c3cccc(F)c3)c(C)c2)CC1 ZINC000468137959 881988379 /nfs/dbraw/zinc/98/83/79/881988379.db2.gz IIQYUWSQMKHMEE-SFHVURJKSA-N 0 3 411.521 4.124 20 0 HIADHN CCOc1ccc(Br)cc1CN(CCC(=O)N1CCC[C@H]1C)C1CC1 ZINC000441501187 866583514 /nfs/dbraw/zinc/58/35/14/866583514.db2.gz KVXOBJCJIOEUED-OAHLLOKOSA-N 0 3 409.368 4.213 20 0 HIADHN CCCn1ccc2ccc(NC(=O)C(=O)NC[C@H](c3ccccc3)N(CC)CC)cc21 ZINC000441593913 866684330 /nfs/dbraw/zinc/68/43/30/866684330.db2.gz CRZQADFLWVPWKH-HSZRJFAPSA-N 0 3 420.557 4.189 20 0 HIADHN C[C@H](C(=O)Nc1cccc(CSc2ccccn2)c1)N1CC[C@@H]([C@@H]2CCOC2)C1 ZINC000441661250 866779172 /nfs/dbraw/zinc/77/91/72/866779172.db2.gz JUQWKTUPFAYDKM-MISYRCLQSA-N 0 3 411.571 4.059 20 0 HIADHN CCC[C@@H](CNC(=O)CN1CCC2(C1)CCOCC2)c1ccc(Cl)cc1Cl ZINC000441691879 866807648 /nfs/dbraw/zinc/80/76/48/866807648.db2.gz UBDFPZVVYAVAON-INIZCTEOSA-N 0 3 413.389 4.496 20 0 HIADHN CC(C)c1nc2ccc(NC(=O)C(=O)N[C@H](C)[C@H](c3ccccc3)N(C)C)cc2s1 ZINC000441694855 866809065 /nfs/dbraw/zinc/80/90/65/866809065.db2.gz QBMWVKNRUBJRTR-FOIQADDNSA-N 0 3 424.570 4.166 20 0 HIADHN C[C@H](NC(=O)C(=O)Nc1ccc2c(c1)Cc1ccccc1-2)[C@H](c1ccccc1)N(C)C ZINC000441705068 866813253 /nfs/dbraw/zinc/81/32/53/866813253.db2.gz RGBHGQVCILXVSR-BXKMTCNYSA-N 0 3 413.521 4.004 20 0 HIADHN Cc1c(Cl)cc(NC(=O)C(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)cc1Cl ZINC000441707522 866814382 /nfs/dbraw/zinc/81/43/82/866814382.db2.gz MFOYTPZYBWFXRP-UGSOOPFHSA-N 0 3 408.329 4.048 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)c1cc(F)c(F)cc1Br ZINC000441825824 866886544 /nfs/dbraw/zinc/88/65/44/866886544.db2.gz WDUKRLJKBCPGBH-SFHVURJKSA-N 0 3 409.274 4.294 20 0 HIADHN Cc1c(COc2ccccc2)cccc1NC(=O)C(=O)Nc1cccc(CN(C)C)c1 ZINC000441836672 866895038 /nfs/dbraw/zinc/89/50/38/866895038.db2.gz FYPHEPTYXXVURU-UHFFFAOYSA-N 0 3 417.509 4.213 20 0 HIADHN Cc1nc(NC(=O)N(CCN(C)C)Cc2ccccn2)sc1Cc1cccc(C)c1 ZINC000441918242 866982283 /nfs/dbraw/zinc/98/22/83/866982283.db2.gz KEFJDWUDOPKMLQ-UHFFFAOYSA-N 0 3 423.586 4.341 20 0 HIADHN CC[C@@H]1CCc2nc(NC(=O)N3CCC(CN4C[C@H](C)O[C@@H](C)C4)CC3)sc2C1 ZINC000441940339 867006285 /nfs/dbraw/zinc/00/62/85/867006285.db2.gz FHFVQODCGHLENK-YESZJQIVSA-N 0 3 420.623 4.011 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)Nc1nc2c(s1)C[C@@H](C(C)(C)C)CC2 ZINC000442074063 867104937 /nfs/dbraw/zinc/10/49/37/867104937.db2.gz BLPADXUXIGQEIM-INIZCTEOSA-N 0 3 415.607 4.285 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3nc(C4CCC4)cs3)CC2)C[C@@H](C)O1 ZINC000442078990 867110137 /nfs/dbraw/zinc/11/01/37/867110137.db2.gz MAEMKSXCCCVZFO-HZPDHXFCSA-N 0 3 406.596 4.154 20 0 HIADHN Cc1ncsc1CN(C)C[C@@H]1CCN(C(=O)Nc2cc(Cl)cc(F)c2F)C1 ZINC000442180827 867204033 /nfs/dbraw/zinc/20/40/33/867204033.db2.gz IVDQHJMTTWGUID-LBPRGKRZSA-N 0 3 414.909 4.369 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)C(=O)Nc3ccc(C(C)(C)C)cc3)c2)CC1 ZINC000442184902 867208305 /nfs/dbraw/zinc/20/83/05/867208305.db2.gz OZKFVCGFENMWTH-UHFFFAOYSA-N 0 3 422.573 4.092 20 0 HIADHN Cc1ccc(C)c(Sc2ccc(NC(=O)C(=O)N[C@H](C)C3=CCN(C)CC3)cc2)c1 ZINC000442340741 867334818 /nfs/dbraw/zinc/33/48/18/867334818.db2.gz LQZWQWZPRJOWFM-GOSISDBHSA-N 0 3 423.582 4.160 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cnn2c1CCCC2)c1ccc(C(F)(F)F)cc1 ZINC000442363479 867350077 /nfs/dbraw/zinc/35/00/77/867350077.db2.gz YKCBLFNANLNIHF-IBGZPJMESA-N 0 3 408.468 4.051 20 0 HIADHN FC(F)(F)c1cc(Cl)c2nnc(CN[C@H]3Cc4[nH]c5ccccc5c4C3)n2c1 ZINC000442722260 867648458 /nfs/dbraw/zinc/64/84/58/867648458.db2.gz WYVLCMOGLZMQDL-LLVKDONJSA-N 0 3 405.811 4.140 20 0 HIADHN COCCC[C@@H](NCC(=O)N1CCC(Cc2ccccc2)CC1)c1ccc(F)cc1 ZINC000442779117 867672313 /nfs/dbraw/zinc/67/23/13/867672313.db2.gz LKZBXKSUZPDZPI-XMMPIXPASA-N 0 3 412.549 4.364 20 0 HIADHN CC(=O)Nc1ccc(S[C@@H](C)C(=O)NCCN2CCC3(CCCCC3)CC2)cc1 ZINC000442980756 867775975 /nfs/dbraw/zinc/77/59/75/867775975.db2.gz SELLVCARLQWTSL-SFHVURJKSA-N 0 3 417.619 4.288 20 0 HIADHN Cc1cc(C(F)(F)F)ccc1CNCc1cccc(NC(=O)Cn2cccn2)c1 ZINC000443003502 867789153 /nfs/dbraw/zinc/78/91/53/867789153.db2.gz WFGQVXHYTYASNG-UHFFFAOYSA-N 0 3 402.420 4.139 20 0 HIADHN C[C@@H](CC(=O)Nc1cccc(F)c1)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1 ZINC000443108965 867823181 /nfs/dbraw/zinc/82/31/81/867823181.db2.gz XDXNPSXVIAUKNM-FDDCHVKYSA-N 0 3 419.500 4.382 20 0 HIADHN Cc1cccc(S(=O)(=O)CCCN[C@H](C)c2ccc(Br)s2)c1 ZINC000443336850 867910947 /nfs/dbraw/zinc/91/09/47/867910947.db2.gz BBBWLAOETLYNPT-CYBMUJFWSA-N 0 3 402.379 4.334 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(F)cc2)CC1)c1ccc(OC2CCC2)cc1 ZINC000443341808 867913957 /nfs/dbraw/zinc/91/39/57/867913957.db2.gz CJQDTKDFMBOASL-UHFFFAOYSA-N 0 3 412.505 4.030 20 0 HIADHN CC[C@@]1(C)Oc2ccc(NC(=O)N(CCN(C)C)Cc3ccc(F)cc3)cc2O1 ZINC000443372169 867933938 /nfs/dbraw/zinc/93/39/38/867933938.db2.gz JJUOZDPIDLSJSR-QFIPXVFZSA-N 0 3 401.482 4.319 20 0 HIADHN COc1ccc([C@H](CNc2nnc(-c3ccccc3Cl)s2)N(C)C)cc1OC ZINC000443434625 868019197 /nfs/dbraw/zinc/01/91/97/868019197.db2.gz HZPSKFXZVHUODW-INIZCTEOSA-N 0 3 418.950 4.591 20 0 HIADHN CC1CCN([C@H](CNC(=O)c2ccc(O[C@H]3CCOC3)cc2)c2cccs2)CC1 ZINC000468246778 882150449 /nfs/dbraw/zinc/15/04/49/882150449.db2.gz KIGBSVXXDCXWLW-LEWJYISDSA-N 0 3 414.571 4.119 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)C23C[C@H]4C[C@@H](C2)CC(C(F)(F)F)(C4)C3)C[C@@H](C)O1 ZINC000443671722 868279505 /nfs/dbraw/zinc/27/95/05/868279505.db2.gz DEOXTBKNADOZPJ-GJKVBTIHSA-N 0 3 416.528 4.141 20 0 HIADHN Cc1ccccc1COc1cccc(CC(=O)NCCCCN2C[C@@H](C)O[C@H](C)C2)c1 ZINC000443675709 868283394 /nfs/dbraw/zinc/28/33/94/868283394.db2.gz QQVGFXWEKVWYGI-FGZHOGPDSA-N 0 3 424.585 4.122 20 0 HIADHN C[C@H]1CN(CCCCNC(=O)c2ccc(Oc3ccc(F)cc3F)cc2)C[C@H](C)O1 ZINC000443677675 868285038 /nfs/dbraw/zinc/28/50/38/868285038.db2.gz TYTPBLAFNUQDNJ-IRXDYDNUSA-N 0 3 418.484 4.376 20 0 HIADHN Cc1ccc(C(C)C)c(OCCC(=O)Nc2cccc(CN3CCC(O)CC3)c2)c1 ZINC000443802801 868339972 /nfs/dbraw/zinc/33/99/72/868339972.db2.gz PSTRMGKJCZNOMJ-UHFFFAOYSA-N 0 3 410.558 4.483 20 0 HIADHN Cc1ccccc1[C@@H]([C@H](C)NC(=O)C(=O)Nc1cc(Cl)ccc1Cl)N(C)C ZINC000443836752 868367440 /nfs/dbraw/zinc/36/74/40/868367440.db2.gz HMZPXANDWUPSLY-SCLBCKFNSA-N 0 3 408.329 4.048 20 0 HIADHN Cc1ccccc1[C@@H]([C@H](C)NC(=O)C(=O)Nc1cccc(OC2CCCC2)c1)N(C)C ZINC000443841223 868370857 /nfs/dbraw/zinc/37/08/57/868370857.db2.gz ZIAGSRGKYUFJQR-FDDCHVKYSA-N 0 3 423.557 4.063 20 0 HIADHN Cc1ccccc1[C@@H]([C@H](C)NC(=O)C(=O)Nc1cc(Cl)cc(Cl)c1)N(C)C ZINC000443840921 868371133 /nfs/dbraw/zinc/37/11/33/868371133.db2.gz JLMOEJJBCMSNKO-SCLBCKFNSA-N 0 3 408.329 4.048 20 0 HIADHN Cc1ccccc1[C@@H]([C@H](C)NC(=O)C(=O)Nc1cccc(C(F)(F)F)c1C)N(C)C ZINC000443843054 868374695 /nfs/dbraw/zinc/37/46/95/868374695.db2.gz RDTAZEIMCRRNSQ-HNAYVOBHSA-N 0 3 421.463 4.068 20 0 HIADHN Cc1oc2ccc(NC(=O)C(=O)N[C@@H](C)[C@@H](c3ccccc3C)N(C)C)cc2c1C ZINC000443846732 868377486 /nfs/dbraw/zinc/37/74/86/868377486.db2.gz WNPWXZGSFWOEGJ-AOMKIAJQSA-N 0 3 407.514 4.104 20 0 HIADHN Cc1cc(NC(=O)NCC2(C3CC3)CCC2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000443909414 868444907 /nfs/dbraw/zinc/44/49/07/868444907.db2.gz RKCVLXJJCRTQPT-OAQYLSRUSA-N 0 3 407.562 4.340 20 0 HIADHN COc1ccc(CNCCOc2ccc(F)cc2F)c(OCc2cccnc2)c1 ZINC000443982912 868507802 /nfs/dbraw/zinc/50/78/02/868507802.db2.gz VPDZPIOIKDVCRV-UHFFFAOYSA-N 0 3 400.425 4.116 20 0 HIADHN CN1CCN(c2cc(CNCc3ccc(Oc4cccc(F)c4)cc3)ccn2)CC1 ZINC000443983992 868508815 /nfs/dbraw/zinc/50/88/15/868508815.db2.gz RYQOXMBFDHJQGL-UHFFFAOYSA-N 0 3 406.505 4.055 20 0 HIADHN CC[C@H](C(=O)N1CCC(NCc2cnc(C(F)(F)F)s2)CC1)c1ccccc1 ZINC000443993186 868514946 /nfs/dbraw/zinc/51/49/46/868514946.db2.gz PGMWBUPLTNHQBJ-KRWDZBQOSA-N 0 3 411.493 4.436 20 0 HIADHN OC[C@@H](CNCc1csc(-c2ccc(F)cc2)n1)Cc1cc(F)c(F)c(F)c1 ZINC000444006056 868528006 /nfs/dbraw/zinc/52/80/06/868528006.db2.gz UWNCOWIXICJWCS-CYBMUJFWSA-N 0 3 410.436 4.307 20 0 HIADHN CC(=O)N(c1nc(CNCCN2CCCC(C)(C)C2)cs1)c1ccc(C)cc1 ZINC000444013679 868535935 /nfs/dbraw/zinc/53/59/35/868535935.db2.gz YAMVOMJTWTZIJZ-UHFFFAOYSA-N 0 3 400.592 4.348 20 0 HIADHN C[C@H](NC(=O)N(CCN(C)C)Cc1cccs1)c1ccc(Br)s1 ZINC000444101018 868617458 /nfs/dbraw/zinc/61/74/58/868617458.db2.gz MHJFSHIKBARTAR-LBPRGKRZSA-N 0 3 416.410 4.407 20 0 HIADHN CCCN(CC(=O)N(CC)c1nc2ccccc2s1)[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC000444231922 868680353 /nfs/dbraw/zinc/68/03/53/868680353.db2.gz LACQKQPJNRBXCV-BEVDRBHNSA-N 0 3 401.576 4.175 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F ZINC000444448155 868831746 /nfs/dbraw/zinc/83/17/46/868831746.db2.gz BKUHFASFFSBQOL-VQTJNVASSA-N 0 3 418.459 4.404 20 0 HIADHN C[C@@H](C(=O)Nc1cccc(CN2CCC(O)CC2)c1)c1ccc(Br)s1 ZINC000444449171 868833116 /nfs/dbraw/zinc/83/31/16/868833116.db2.gz FFJUTAXXVSNCED-CYBMUJFWSA-N 0 3 423.376 4.210 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)[C@@H](OC1CCCC1)c1ccccc1 ZINC000444461206 868836502 /nfs/dbraw/zinc/83/65/02/868836502.db2.gz PYKAAMVNJHGUHI-DEOSSOPVSA-N 0 3 408.542 4.282 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)c1ccc(Sc2ccccn2)cc1 ZINC000444460396 868836748 /nfs/dbraw/zinc/83/67/48/868836748.db2.gz KLYOKSLTVQQSCG-UHFFFAOYSA-N 0 3 419.550 4.442 20 0 HIADHN O=C(N[C@H]1CCOc2c(F)cccc21)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000468307034 882232153 /nfs/dbraw/zinc/23/21/53/882232153.db2.gz OEXDSQNCFDTJSR-GHTZIAJQSA-N 0 3 422.422 4.220 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)NC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000444585225 868891512 /nfs/dbraw/zinc/89/15/12/868891512.db2.gz YBCZIVAYIBLDLS-WMZHIEFXSA-N 0 3 417.557 4.206 20 0 HIADHN C[C@H](N[C@@H]1CC(C)(C)OC1(C)C)C(=O)Nc1ccc(NC(=O)c2cccs2)cc1 ZINC000444644630 868928789 /nfs/dbraw/zinc/92/87/89/868928789.db2.gz WMHDXYAYDUVZGI-KBXCAEBGSA-N 0 3 415.559 4.263 20 0 HIADHN O[C@@H](COc1ccc(Cl)cc1Br)CN1CC[C@H](CC(F)(F)F)C1 ZINC000444689432 868959795 /nfs/dbraw/zinc/95/97/95/868959795.db2.gz FVBIKBZJBMVYGV-ZYHUDNBSSA-N 0 3 416.665 4.117 20 0 HIADHN C[C@H](c1nc(Cc2ccc(F)cc2)no1)N1CCC[C@H](c2ncc(C(F)(F)F)[nH]2)C1 ZINC000444801369 869015341 /nfs/dbraw/zinc/01/53/41/869015341.db2.gz BQTXIOZUWVQLKA-OCCSQVGLSA-N 0 3 423.414 4.482 20 0 HIADHN COC(=O)c1cc2cc(CNC3(c4ccc(OC)c(F)c4)CCOCC3)ccc2o1 ZINC000444809293 869021082 /nfs/dbraw/zinc/02/10/82/869021082.db2.gz AYRPHSKZDJXJDT-UHFFFAOYSA-N 0 3 413.445 4.163 20 0 HIADHN CC(C)Oc1ccc(NC(=O)N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)c(Cl)c1 ZINC000445024035 869173522 /nfs/dbraw/zinc/17/35/22/869173522.db2.gz NDJIJMZEZBDBGU-CALCHBBNSA-N 0 3 423.985 4.480 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)[C@@H]2C[C@@H]2c2cc(F)c(F)c(F)c2)cc1 ZINC000468341527 882276384 /nfs/dbraw/zinc/27/63/84/882276384.db2.gz VEGRYRNZXLSKDD-OPYAIIAOSA-N 0 3 418.459 4.169 20 0 HIADHN C[C@H]1c2cc(F)cc(F)c2CCN1C(=O)CCCN1CCN(c2ccccc2)CC1 ZINC000468352839 882290420 /nfs/dbraw/zinc/29/04/20/882290420.db2.gz YSQOGCUXSDJUOM-SFHVURJKSA-N 0 3 413.512 4.013 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)c2c(F)cc(Br)cc2F)CC1 ZINC000445527621 869585333 /nfs/dbraw/zinc/58/53/33/869585333.db2.gz HRLBDTBQUBAZCR-UHFFFAOYSA-N 0 3 413.262 4.057 20 0 HIADHN CC(C)[C@@H](CC(F)(F)F)NCC(=O)N(C)Cc1cc(Br)cs1 ZINC000445895238 869876255 /nfs/dbraw/zinc/87/62/55/869876255.db2.gz SYHDHCKZNCWRKJ-GFCCVEGCSA-N 0 3 401.292 4.036 20 0 HIADHN CC(C)[C@H](CC(F)(F)F)NCC(=O)N(C)Cc1cc(Br)cs1 ZINC000445895240 869876377 /nfs/dbraw/zinc/87/63/77/869876377.db2.gz SYHDHCKZNCWRKJ-LBPRGKRZSA-N 0 3 401.292 4.036 20 0 HIADHN COc1cc(-c2nnc(CN[C@H]3CCC[C@H]3c3ccccc3)o2)cc(OC)c1OC ZINC000446002490 869965701 /nfs/dbraw/zinc/96/57/01/869965701.db2.gz FYDGMZWCLDLXHC-ROUUACIJSA-N 0 3 409.486 4.188 20 0 HIADHN O=C(c1cc(N2CCCC2)ccn1)N(CCN1CCCC1)Cc1ccc(Cl)cc1 ZINC000446044018 870005844 /nfs/dbraw/zinc/00/58/44/870005844.db2.gz TWFIDJOKCAAXEO-UHFFFAOYSA-N 0 3 412.965 4.073 20 0 HIADHN COc1cc(C)c(NC(=O)NCCCCN2CCN(c3ccccc3)CC2)cc1C ZINC000446352981 870262558 /nfs/dbraw/zinc/26/25/58/870262558.db2.gz LLYSHZBAJZFXAO-UHFFFAOYSA-N 0 3 410.562 4.036 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)c1cc(C2CC2)nc2onc(CC(C)(C)C)c21 ZINC000446432290 870351440 /nfs/dbraw/zinc/35/14/40/870351440.db2.gz HHWRTWVVJTWBKS-UHFFFAOYSA-N 0 3 424.545 4.486 20 0 HIADHN CN(C(=O)N[C@@H]1CC[C@@H](Cc2ccccc2)C1)C1CCN(CCc2ccccn2)CC1 ZINC000446634990 870541851 /nfs/dbraw/zinc/54/18/51/870541851.db2.gz QTJGEYIWELXQIC-LADGPHEKSA-N 0 3 420.601 4.141 20 0 HIADHN CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)N[C@@H]1CC[C@@H](Cc2ccccc2)C1 ZINC000446638736 870546957 /nfs/dbraw/zinc/54/69/57/870546957.db2.gz PFHYKKZUWIQDAJ-XGAJZPNHSA-N 0 3 406.574 4.127 20 0 HIADHN CN(C)Cc1cccc(C(=O)Nc2nccn2Cc2ccc(Br)cc2)c1 ZINC000446671586 870584457 /nfs/dbraw/zinc/58/44/57/870584457.db2.gz QTXPXTJZBNLOKP-UHFFFAOYSA-N 0 3 413.319 4.008 20 0 HIADHN C[C@@H](NCc1cccc(NC(=O)CCN2CCOCC2)c1)c1cc2ccccc2s1 ZINC000446742287 870649614 /nfs/dbraw/zinc/64/96/14/870649614.db2.gz FNZMIRTZFILLIE-GOSISDBHSA-N 0 3 423.582 4.413 20 0 HIADHN COc1ccc2c(c1)[C@H](NCc1ccc(N3C[C@@H](C)O[C@@H](C)C3)nc1)CCCS2 ZINC000446746191 870654729 /nfs/dbraw/zinc/65/47/29/870654729.db2.gz SOBDRNJDBABYAV-LLGFUMIMSA-N 0 3 413.587 4.421 20 0 HIADHN COc1cc(CN2CCC[C@@H](c3nccn3C)C2)cc(OC)c1OCc1ccccc1 ZINC000446828852 870744080 /nfs/dbraw/zinc/74/40/80/870744080.db2.gz ABCDRYMMNHSYPX-OAQYLSRUSA-N 0 3 421.541 4.396 20 0 HIADHN Cc1cccn2c(CNC3(c4cccc(OC(F)(F)F)c4)CCOCC3)cnc12 ZINC000446839143 870756278 /nfs/dbraw/zinc/75/62/78/870756278.db2.gz PSNMXQWEYXPLHS-UHFFFAOYSA-N 0 3 405.420 4.337 20 0 HIADHN Cc1cccc2ncc(CNC3(c4cccc(OC(F)(F)F)c4)CCOCC3)n21 ZINC000446851935 870772531 /nfs/dbraw/zinc/77/25/31/870772531.db2.gz LLRGOMZDQLYBIP-UHFFFAOYSA-N 0 3 405.420 4.337 20 0 HIADHN Cc1cc(CN2CCC[C@H]([C@@H](O)C(F)(F)F)C2)cc(C)c1OCc1ccccn1 ZINC000446974529 870872003 /nfs/dbraw/zinc/87/20/03/870872003.db2.gz JFWCDEQVCARULT-GHTZIAJQSA-N 0 3 408.464 4.413 20 0 HIADHN COC(=O)[C@](C)(CN[C@@H](C)C(=O)Nc1cccc2ccccc21)c1ccc(F)cc1 ZINC000447019911 870896196 /nfs/dbraw/zinc/89/61/96/870896196.db2.gz ZEEGTZMYXFABPN-UPCLLVRISA-N 0 3 408.473 4.026 20 0 HIADHN Cc1nc(-c2ccc(C)c(NC(=O)N[C@@H](CN3CCCC3)c3ccccc3)c2)n[nH]1 ZINC000447060464 870940024 /nfs/dbraw/zinc/94/00/24/870940024.db2.gz PCSQWENTOXVPII-NRFANRHFSA-N 0 3 404.518 4.047 20 0 HIADHN Cc1nc(-c2ccc(C)c(NC(=O)N[C@@H]3CCN([C@H](C)c4ccccc4)C3)c2)n[nH]1 ZINC000447076289 870959920 /nfs/dbraw/zinc/95/99/20/870959920.db2.gz JMCQWEZNUFXVIK-OXQOHEQNSA-N 0 3 404.518 4.046 20 0 HIADHN CN1CCC2(CCN(Cc3cn(C(C)(C)C)nc3-c3ccccc3Cl)CC2)C1=O ZINC000447075963 870960796 /nfs/dbraw/zinc/96/07/96/870960796.db2.gz HXTJQXIOLDCDPK-UHFFFAOYSA-N 0 3 414.981 4.403 20 0 HIADHN COC(=O)[C@@](C)(CNCc1ccccc1OCc1cccnc1)c1ccc(F)cc1 ZINC000447083976 870975483 /nfs/dbraw/zinc/97/54/83/870975483.db2.gz CJRZCQSRXOFOFT-DEOSSOPVSA-N 0 3 408.473 4.020 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1cnn(-c2ccccc2F)c1 ZINC000447191171 871083757 /nfs/dbraw/zinc/08/37/57/871083757.db2.gz INVCGWYJLJLBDL-SFHVURJKSA-N 0 3 407.493 4.140 20 0 HIADHN COc1cccc(C2(NCCC(=O)Nc3cccc(Cl)c3)CCOCC2)c1F ZINC000447362734 871269700 /nfs/dbraw/zinc/26/97/00/871269700.db2.gz GMLPCOJNFOOVRR-UHFFFAOYSA-N 0 3 406.885 4.112 20 0 HIADHN O=C(CCN1CCC(Oc2ncccc2F)CC1)Nc1cc(Cl)ccc1Cl ZINC000447362800 871270007 /nfs/dbraw/zinc/27/00/07/871270007.db2.gz HJJXRNSIXGWKQF-UHFFFAOYSA-N 0 3 412.292 4.400 20 0 HIADHN CC(C)[C@@H](NC(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1)c1ccc(F)cc1F ZINC000468500077 882494760 /nfs/dbraw/zinc/49/47/60/882494760.db2.gz CKPKTKCNWUARHR-HYFFOGBASA-N 0 3 423.548 4.193 20 0 HIADHN COC(=O)c1coc([C@H](C)NCC2(c3cc(Cl)ccc3OC)CCOCC2)c1 ZINC000447533151 871398715 /nfs/dbraw/zinc/39/87/15/871398715.db2.gz WUJQOLUSUVTBOE-AWEZNQCLSA-N 0 3 407.894 4.127 20 0 HIADHN CC(C)NS(=O)(=O)Cc1ccccc1CN[C@H]1C[C@H](C(C)C)c2ccccc21 ZINC000447538176 871402461 /nfs/dbraw/zinc/40/24/61/871402461.db2.gz AXCHIDBKPDBXAK-PKTZIBPZSA-N 0 3 400.588 4.489 20 0 HIADHN COC(=O)c1coc([C@H](C)NC[C@H]2CCN(c3cccc(Br)c3)C2)c1 ZINC000447545262 871411957 /nfs/dbraw/zinc/41/19/57/871411957.db2.gz WZTFLNPSTXZSNE-UONOGXRCSA-N 0 3 407.308 4.006 20 0 HIADHN CC1(C)COc2c1cccc2C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000447560601 871449274 /nfs/dbraw/zinc/44/92/74/871449274.db2.gz WTRCJXFVMCJJRC-IBGZPJMESA-N 0 3 416.525 4.252 20 0 HIADHN CCOC1CC(CN[C@H](C)c2cc(F)c(Cl)cc2Cl)(N2CCOCC2)C1 ZINC000447580434 871483529 /nfs/dbraw/zinc/48/35/29/871483529.db2.gz QKLRYIMNOUJRSX-VFPJAPOESA-N 0 3 405.341 4.053 20 0 HIADHN C[C@@H](N[C@@H](C)c1cccc(OCc2ccccc2)c1)c1ccc(S(N)(=O)=O)cc1 ZINC000447593495 871501047 /nfs/dbraw/zinc/50/10/47/871501047.db2.gz SHLWVYMFDIJWGX-MSOLQXFVSA-N 0 3 410.539 4.325 20 0 HIADHN COc1cccc(-c2nc(C(=O)Nc3cccc4c3OCC[C@H]4N(C)C)c(C)[nH]2)c1 ZINC000447728919 871677260 /nfs/dbraw/zinc/67/72/60/871677260.db2.gz MQYPGDIUFCJJRN-LJQANCHMSA-N 0 3 406.486 4.031 20 0 HIADHN COc1cccc(-c2nc(C)c(C(=O)Nc3cccc4c3OCC[C@H]4N(C)C)[nH]2)c1 ZINC000447728919 871677269 /nfs/dbraw/zinc/67/72/69/871677269.db2.gz MQYPGDIUFCJJRN-LJQANCHMSA-N 0 3 406.486 4.031 20 0 HIADHN O=C1[C@H](N[C@@H](C[C@@H]2CCOC2)c2ccccc2)CCN1c1ccc(Cl)c(F)c1 ZINC000447887864 871801823 /nfs/dbraw/zinc/80/18/23/871801823.db2.gz GXUKWWDWEQECNY-RVHYNSKXSA-N 0 3 402.897 4.342 20 0 HIADHN CCc1nn(-c2ccccc2)c(CC)c1CNC(=O)Nc1cccc(CN(C)C)c1 ZINC000447899886 871809764 /nfs/dbraw/zinc/80/97/64/871809764.db2.gz XSGCMKFUWBMLPL-UHFFFAOYSA-N 0 3 405.546 4.380 20 0 HIADHN CCOc1cc(CN[C@@H](CO)[C@@H]2CCCO2)ccc1OCc1c(F)cccc1Cl ZINC000447981999 871833655 /nfs/dbraw/zinc/83/36/55/871833655.db2.gz HUUQBMPIZXOBDC-PMACEKPBSA-N 0 3 423.912 4.086 20 0 HIADHN CO[C@@H]1CCOc2c(NC(=O)N3CCCN(Cc4ccccc4)C[C@@H]3C)cccc21 ZINC000448040943 871873572 /nfs/dbraw/zinc/87/35/72/871873572.db2.gz ZEZLIOMTEACODO-PGRDOPGGSA-N 0 3 409.530 4.285 20 0 HIADHN CO[C@@H]1CCOc2c(NC(=O)N[C@@H](CN(C)Cc3ccccc3)C(C)C)cccc21 ZINC000448052631 871883025 /nfs/dbraw/zinc/88/30/25/871883025.db2.gz DJPJWTDEQLAWQI-FCHUYYIVSA-N 0 3 411.546 4.435 20 0 HIADHN CCOC(=O)c1c2c(sc1NC(=O)c1ccnc(C)c1)C(C)(C)NC(C)(C)C2 ZINC000448095816 871934396 /nfs/dbraw/zinc/93/43/96/871934396.db2.gz CNPVBKILMFYWFP-UHFFFAOYSA-N 0 3 401.532 4.040 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NC[C@H]1CCSC1)c1ccc(C(F)(F)F)cc1 ZINC000448169157 872043984 /nfs/dbraw/zinc/04/39/84/872043984.db2.gz JSYUKMPNTJPQNR-RHSMWYFYSA-N 0 3 403.514 4.141 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)c2ccc3cc(Br)ccc3c2)C[C@@H](C)O1 ZINC000448239425 872153098 /nfs/dbraw/zinc/15/30/98/872153098.db2.gz LDNXGPLYMGDEHE-HZPDHXFCSA-N 0 3 419.363 4.222 20 0 HIADHN Cc1ccc2cc(C(=O)Nc3ccnn3[C@H]3CCN(Cc4ccccc4)C3)ccc2n1 ZINC000448256566 872178319 /nfs/dbraw/zinc/17/83/19/872178319.db2.gz NLWYHJDVJXIGSO-QFIPXVFZSA-N 0 3 411.509 4.439 20 0 HIADHN COc1ccc([C@H](CNC(=O)CCCc2ccc(O)c(F)c2)N2CCCCC2)cc1 ZINC000468552784 882598681 /nfs/dbraw/zinc/59/86/81/882598681.db2.gz IKSGNVNOAJGDAE-QFIPXVFZSA-N 0 3 414.521 4.206 20 0 HIADHN CCN(C(=O)Nc1cccc(OC[C@@H]2CCCO2)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000460127235 872605646 /nfs/dbraw/zinc/60/56/46/872605646.db2.gz CHYQLWCWRYLGIZ-VWNXMTODSA-N 0 3 423.557 4.373 20 0 HIADHN CC(C)c1ccc(Cn2nccc2NC(=O)N(CCN(C)C)Cc2ccco2)cc1 ZINC000460134563 872623077 /nfs/dbraw/zinc/62/30/77/872623077.db2.gz OIFOXNLQPSKZPO-UHFFFAOYSA-N 0 3 409.534 4.244 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)N(CC)[C@@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000460136145 872627958 /nfs/dbraw/zinc/62/79/58/872627958.db2.gz UGOMOWIQHSFNOV-WMZHIEFXSA-N 0 3 422.573 4.343 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)N1CCCC[C@@H]1c1nnc(C2CCC2)o1 ZINC000460163057 872708305 /nfs/dbraw/zinc/70/83/05/872708305.db2.gz BEKDXBRYWNFDRH-LEWJYISDSA-N 0 3 423.561 4.411 20 0 HIADHN CCC1(CNC(=O)N(Cc2ccccc2Br)C2CCN(C)CC2)CC1 ZINC000460496978 873181987 /nfs/dbraw/zinc/18/19/87/873181987.db2.gz ZQDVAVWAKQUAJW-UHFFFAOYSA-N 0 3 408.384 4.245 20 0 HIADHN CCCN(CCN1CCN(CC)CC1)C(=O)N[C@H](c1ccc(Cl)cc1)[C@H]1C[C@@H]1C ZINC000460530594 873225009 /nfs/dbraw/zinc/22/50/09/873225009.db2.gz IGPFDAAIIGMCBC-YUXAGFNASA-N 0 3 421.029 4.096 20 0 HIADHN CCN1C[C@@H](C)N(c2nnc(CSc3ccccc3OC)n2CC(C)C)C[C@@H]1C ZINC000460596172 873336224 /nfs/dbraw/zinc/33/62/24/873336224.db2.gz HOOXLOUFMYDWRT-ZWKOTPCHSA-N 0 3 417.623 4.154 20 0 HIADHN C[C@@H]1CN(C(=O)CCCN2CCN(c3ccccc3)CC2)CC[C@@H]1c1ccccc1 ZINC000460642178 873383123 /nfs/dbraw/zinc/38/31/23/873383123.db2.gz INIWVXOGPJPTOV-RDGATRHJSA-N 0 3 405.586 4.241 20 0 HIADHN CCOC(=O)c1csc(CCNCc2c(C)nn(-c3ccc(Cl)cc3)c2C)n1 ZINC000468617346 882733647 /nfs/dbraw/zinc/73/36/47/882733647.db2.gz HGQHWTVXSXJASE-UHFFFAOYSA-N 0 3 418.950 4.108 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)c1c[nH]cc1-c1ccc(F)cc1 ZINC000460735337 873553848 /nfs/dbraw/zinc/55/38/48/873553848.db2.gz VRDFHNVJWMMCTL-UHFFFAOYSA-N 0 3 420.532 4.153 20 0 HIADHN CCc1ccc([C@H](CNC(=O)c2ccc(NC(=O)CC(C)C)c(F)c2)N(C)C)cc1 ZINC000460791370 873657091 /nfs/dbraw/zinc/65/70/91/873657091.db2.gz OMWNFBLWDUOTDD-QFIPXVFZSA-N 0 3 413.537 4.405 20 0 HIADHN CCCN(C(=O)c1ccc(-n2cncn2)c(C)c1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000460878109 873787003 /nfs/dbraw/zinc/78/70/03/873787003.db2.gz DIWSOXMBQLQHMR-HSZRJFAPSA-N 0 3 417.557 4.093 20 0 HIADHN Cc1cc(C)c(Br)c(C(=O)N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)c1 ZINC000460976115 873870085 /nfs/dbraw/zinc/87/00/85/873870085.db2.gz CEKVYRSYVNFWFS-CALCHBBNSA-N 0 3 423.395 4.027 20 0 HIADHN O=S1(=O)CCCN1c1ccc(CN[C@@H](c2ccccc2F)C2CCCC2)cc1 ZINC000461084417 873994991 /nfs/dbraw/zinc/99/49/91/873994991.db2.gz GDWMHBVJQIZNHB-JOCHJYFZSA-N 0 3 402.535 4.387 20 0 HIADHN O=C(NCc1nc2c(s1)C[C@@H](c1ccccc1)CC2)[C@@H]1CCCN1C1CCCC1 ZINC000468731977 882832691 /nfs/dbraw/zinc/83/26/91/882832691.db2.gz BUKXHODADZLIHK-RXVVDRJESA-N 0 3 409.599 4.439 20 0 HIADHN O=S1(=O)CCCN1c1ccc(CNCc2ccc(F)c(-c3cccs3)c2)cc1 ZINC000461437635 874489049 /nfs/dbraw/zinc/48/90/49/874489049.db2.gz IEOVVAXYJSKTMA-UHFFFAOYSA-N 0 3 416.543 4.384 20 0 HIADHN C[C@H](CC(=O)N1C[C@H]2CN(Cc3ccccc3)CC[C@@H]2C1)C(=O)c1cccc(F)c1 ZINC000461446989 874504130 /nfs/dbraw/zinc/50/41/30/874504130.db2.gz FXBCKXVCEUVYEM-STZQEDGTSA-N 0 3 408.517 4.015 20 0 HIADHN CCCN(C(=O)NCC[C@@H](OC)C(F)(F)F)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000468768635 882851600 /nfs/dbraw/zinc/85/16/00/882851600.db2.gz APZXKUJGPLKQEQ-RTBURBONSA-N 0 3 415.500 4.040 20 0 HIADHN Cc1nn(C)c(C)c1[C@@H](C)C(=O)N1CCN(Cc2ccccc2)C2(CCCCC2)C1 ZINC000461578382 874682877 /nfs/dbraw/zinc/68/28/77/874682877.db2.gz LNKHLRLXWLSOES-LJQANCHMSA-N 0 3 408.590 4.188 20 0 HIADHN O=C(Cc1noc2ccccc21)N1CCN(Cc2ccccc2)C2(CCCCC2)C1 ZINC000461597364 874722296 /nfs/dbraw/zinc/72/22/96/874722296.db2.gz DXVGUMBVIUBDDY-UHFFFAOYSA-N 0 3 403.526 4.418 20 0 HIADHN CC[C@@H](C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1)c1ccc(F)cc1 ZINC000461660646 874814014 /nfs/dbraw/zinc/81/40/14/874814014.db2.gz YFHVNUUQUJPUAP-JOCHJYFZSA-N 0 3 402.485 4.118 20 0 HIADHN COC[C@H](NC(=O)N(Cc1ccccc1)C1CCN(C)CC1)c1cccc(Cl)c1 ZINC000461717178 874866745 /nfs/dbraw/zinc/86/67/45/874866745.db2.gz IBNBUQYBULLZAV-QFIPXVFZSA-N 0 3 415.965 4.334 20 0 HIADHN CCCN(CCN(CC)CC)C(=O)c1cn(Cc2ccccc2)c2ccccc2c1=O ZINC000461721232 874869498 /nfs/dbraw/zinc/86/94/98/874869498.db2.gz DLWFSVFMMIKLJO-UHFFFAOYSA-N 0 3 419.569 4.244 20 0 HIADHN CNC(=O)CCOC1CCN(Cc2ccccc2Oc2ccc(F)cc2Cl)CC1 ZINC000461841677 874979528 /nfs/dbraw/zinc/97/95/28/874979528.db2.gz QOOUHVJVTQKFSM-UHFFFAOYSA-N 0 3 420.912 4.389 20 0 HIADHN C[C@@H](CN(C)Cc1ccccc1)NC(=O)N[C@@H]1CCCc2cn(C3CCCC3)nc21 ZINC000461959880 875087498 /nfs/dbraw/zinc/08/74/98/875087498.db2.gz RVRTZLUELURXCZ-PGRDOPGGSA-N 0 3 409.578 4.195 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)NCc2ncc(-c3ccccc3)cn2)N2CCCC2)cc1 ZINC000462000326 875121936 /nfs/dbraw/zinc/12/19/36/875121936.db2.gz AHDXKFDMRLYRNC-HSZRJFAPSA-N 0 3 415.541 4.088 20 0 HIADHN Cc1ccccc1-c1cc(NC(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)n(C)n1 ZINC000462087943 875196442 /nfs/dbraw/zinc/19/64/42/875196442.db2.gz ZSQODXRHHGTDKU-FQEVSTJZSA-N 0 3 403.530 4.134 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)Nc2cc(-c3ccccc3C)nn2C)c1 ZINC000462093319 875203027 /nfs/dbraw/zinc/20/30/27/875203027.db2.gz OXDGYQYOZBEDHS-UHFFFAOYSA-N 0 3 405.546 4.300 20 0 HIADHN CN1CCN(CCCNC(=O)c2cc(Cl)ccc2Oc2cccc(Cl)c2)CC1 ZINC000468873470 882905582 /nfs/dbraw/zinc/90/55/82/882905582.db2.gz GKJIAUDGAJXGQY-UHFFFAOYSA-N 0 3 422.356 4.153 20 0 HIADHN C[C@H]1CCCN(c2cc(C(=O)N3CCCN(Cc4ccccc4)C[C@@H]3C)ccn2)C1 ZINC000462153902 875249815 /nfs/dbraw/zinc/24/98/15/875249815.db2.gz YKYHXFAQQIOAHR-SFTDATJTSA-N 0 3 406.574 4.055 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)[C@H]1C[C@H]1c1ccccc1OC(F)F ZINC000462156379 875253197 /nfs/dbraw/zinc/25/31/97/875253197.db2.gz CPLCKQKQHUPHKT-TTYHFUOFSA-N 0 3 400.469 4.028 20 0 HIADHN CSc1nc(C(C)(C)C)nc(C)c1C(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C ZINC000462178553 875279222 /nfs/dbraw/zinc/27/92/22/875279222.db2.gz IMMQKEFFPDPWFO-QAPCUYQASA-N 0 3 412.603 4.055 20 0 HIADHN CSc1nc(-c2ccco2)nc(C)c1C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C ZINC000462185713 875286388 /nfs/dbraw/zinc/28/63/88/875286388.db2.gz YWYIHEBBBHIUFD-MAUKXSAKSA-N 0 3 422.554 4.017 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1cccc(NC(=O)c2cccs2)c1 ZINC000462187431 875292206 /nfs/dbraw/zinc/29/22/06/875292206.db2.gz IHPNUXKBEDYDPA-UWJYYQICSA-N 0 3 419.550 4.251 20 0 HIADHN CN(C(=O)NC[C@@H](Cc1ccccc1)C(F)(F)F)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000462223615 875331042 /nfs/dbraw/zinc/33/10/42/875331042.db2.gz IULCTKFOOWWVAR-NHCUHLMSSA-N 0 3 419.491 4.324 20 0 HIADHN C[C@H](NC(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C)c1ncc(-c2ccccc2)o1 ZINC000462226232 875334949 /nfs/dbraw/zinc/33/49/49/875334949.db2.gz QNISYNZDDXLVMH-LQWHRVPQSA-N 0 3 404.514 4.222 20 0 HIADHN O=C(CCN1CCC(c2noc(C3CC3)n2)CC1)Nc1c(Cl)cccc1Cl ZINC000462234627 875346886 /nfs/dbraw/zinc/34/68/86/875346886.db2.gz RLRSTJXXRXTLOR-UHFFFAOYSA-N 0 3 409.317 4.462 20 0 HIADHN CN(C)C[C@H](NC(=O)NC[C@H](Cc1ccccc1)C(F)(F)F)c1ccc(F)cc1 ZINC000462236951 875348872 /nfs/dbraw/zinc/34/88/72/875348872.db2.gz RTCHZZVBJBDNOL-HKUYNNGSSA-N 0 3 411.443 4.149 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)NC[C@H](Cc2ccccc2)C(F)(F)F)cc1 ZINC000462240340 875355804 /nfs/dbraw/zinc/35/58/04/875355804.db2.gz VECBIHQFTWBAHQ-AZUAARDMSA-N 0 3 423.479 4.018 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)[C@@H](C)c2cccc(Br)c2)CC1 ZINC000462247280 875364528 /nfs/dbraw/zinc/36/45/28/875364528.db2.gz OMIJNKUVPROOHP-JKSUJKDBSA-N 0 3 416.363 4.289 20 0 HIADHN COCCOc1ccc(NC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)cc1Cl ZINC000462248265 875366524 /nfs/dbraw/zinc/36/65/24/875366524.db2.gz SPFACGOWQOYSJP-OXJNMPFZSA-N 0 3 417.937 4.007 20 0 HIADHN CC(C)n1cnnc1-c1ccccc1NC(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C ZINC000462266580 875392999 /nfs/dbraw/zinc/39/29/99/875392999.db2.gz FWURUVDWGDMFNQ-PGRDOPGGSA-N 0 3 418.545 4.168 20 0 HIADHN CCCC(=O)Nc1cccc(NC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)c1C ZINC000462272142 875399628 /nfs/dbraw/zinc/39/96/28/875399628.db2.gz QMOQXXJDZWHLDU-HTAPYJJXSA-N 0 3 408.546 4.376 20 0 HIADHN C[C@H](CC(=O)N[C@@H]1CN(C)C[C@@H]1c1ccccc1)c1ccc(F)c(Br)c1 ZINC000462282879 875409332 /nfs/dbraw/zinc/40/93/32/875409332.db2.gz XVDZBPHARYODOS-WIBUTAKZSA-N 0 3 419.338 4.296 20 0 HIADHN CCN1CC[C@H](N(C)S(=O)(=O)c2ccc3nc(C(C)(C)C)sc3c2)C[C@@H]1C ZINC000462334378 875451385 /nfs/dbraw/zinc/45/13/85/875451385.db2.gz JMCOTVCNDRWMPN-GJZGRUSLSA-N 0 3 409.621 4.087 20 0 HIADHN CCN(CC)[C@@H](CNc1cc(C(F)(F)F)nc(-c2ccncc2)n1)c1ccco1 ZINC000462376427 875487497 /nfs/dbraw/zinc/48/74/97/875487497.db2.gz JKPMIQFEHWYILZ-HNNXBMFYSA-N 0 3 405.424 4.067 20 0 HIADHN COc1ccc([C@@H](CNC(=O)CCc2cncc3ccccc32)N2CCCC2)cc1 ZINC000462399537 875507352 /nfs/dbraw/zinc/50/73/52/875507352.db2.gz BMHYXYPJTYUSMF-XMMPIXPASA-N 0 3 403.526 4.129 20 0 HIADHN C[C@H](Cn1cc(Br)cn1)NCc1ccc(Oc2cccnc2)c(F)c1 ZINC000468894522 882941168 /nfs/dbraw/zinc/94/11/68/882941168.db2.gz HFYFEONUPPIBRY-CYBMUJFWSA-N 0 3 405.271 4.150 20 0 HIADHN COc1ccc(CNC(=O)C2CCN(c3c(C)cnc4c(C)cccc43)CC2)cc1 ZINC000462494304 875606724 /nfs/dbraw/zinc/60/67/24/875606724.db2.gz YCJFKBAGHYKFAI-UHFFFAOYSA-N 0 3 403.526 4.393 20 0 HIADHN CCOC(=O)c1csc(CCN[C@H](C)c2cnn(-c3cc(C)ccc3C)c2C)n1 ZINC000468897864 882946564 /nfs/dbraw/zinc/94/65/64/882946564.db2.gz JTCJYWPXMRSDLE-MRXNPFEDSA-N 0 3 412.559 4.324 20 0 HIADHN CC[C@H](CNC(=O)N[C@@H]1CCO[C@H](c2ccccc2)C1)N1CCc2ccccc2C1 ZINC000462529913 875649550 /nfs/dbraw/zinc/64/95/50/875649550.db2.gz RWSLNCVKRXCAPD-SMIHKQSGSA-N 0 3 407.558 4.043 20 0 HIADHN CC[C@H](CNC(=O)N[C@@H]1CCO[C@@H](c2ccccc2)C1)N1CCc2ccccc2C1 ZINC000462530212 875649687 /nfs/dbraw/zinc/64/96/87/875649687.db2.gz RWSLNCVKRXCAPD-WXFUMESZSA-N 0 3 407.558 4.043 20 0 HIADHN CC(C)[C@@H](Oc1ccc(Cl)cc1)C(=O)N1CC[C@@H](CN(C)Cc2cccnc2)C1 ZINC000462536066 875655083 /nfs/dbraw/zinc/65/50/83/875655083.db2.gz DTMSUSQKKRPXCS-SIKLNZKXSA-N 0 3 415.965 4.119 20 0 HIADHN CCc1noc(-c2ccc(C)c(NC(=O)N[C@@H]3CN(Cc4ccccc4)C[C@@H]3C)c2)n1 ZINC000462686076 875778544 /nfs/dbraw/zinc/77/85/44/875778544.db2.gz SYKZPHDKLSULGI-LAUBAEHRSA-N 0 3 419.529 4.249 20 0 HIADHN COc1ccc(C)nc1NC(=O)N(CCN(C)C)Cc1ccc(C(F)(F)F)cc1 ZINC000462722952 875800458 /nfs/dbraw/zinc/80/04/58/875800458.db2.gz CPNPFRDVJFCNLV-UHFFFAOYSA-N 0 3 410.440 4.013 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](NCCc2ccc(F)c(F)c2)c2ccccc2)c1 ZINC000468908823 882964315 /nfs/dbraw/zinc/96/43/15/882964315.db2.gz JFKADQQDKWRKAG-QFIPXVFZSA-N 0 3 401.478 4.290 20 0 HIADHN COc1ccccc1/C=C/CN[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1=O ZINC000462739767 875811398 /nfs/dbraw/zinc/81/13/98/875811398.db2.gz WWWWDAQPUQJCMD-QTWIXLPOSA-N 0 3 402.441 4.095 20 0 HIADHN CN(C)CCN(C[C@@H]1CCCO1)C(=O)c1ccc(Oc2ccc(Cl)cc2)c(F)c1 ZINC000468908964 882964797 /nfs/dbraw/zinc/96/47/97/882964797.db2.gz KQKDXHJCZRPBPI-IBGZPJMESA-N 0 3 420.912 4.454 20 0 HIADHN COc1cccc(N2C[C@@H](NCc3ccc(-c4ccccc4OC)cc3)CC2=O)c1 ZINC000462769058 875828863 /nfs/dbraw/zinc/82/88/63/875828863.db2.gz QREIXCFMRRFOGR-FQEVSTJZSA-N 0 3 402.494 4.266 20 0 HIADHN O=C(CCN1CCOCC1)Nc1cccc(CNCc2ccc(C3CCCC3)cc2)c1 ZINC000462794676 875844786 /nfs/dbraw/zinc/84/47/86/875844786.db2.gz HZOCIJQUHDPBIB-UHFFFAOYSA-N 0 3 421.585 4.295 20 0 HIADHN C[C@@H]1CN(Cc2cccc(CNCc3ccc(C(=O)OC(C)(C)C)cc3)c2)CCO1 ZINC000462796204 875846057 /nfs/dbraw/zinc/84/60/57/875846057.db2.gz KTSSNNBMOLGNGJ-LJQANCHMSA-N 0 3 410.558 4.152 20 0 HIADHN Fc1cc(CN[C@H]2CCCc3nc(-c4ccccc4)sc32)cnc1N1CCOCC1 ZINC000462833930 875868674 /nfs/dbraw/zinc/86/86/74/875868674.db2.gz NQSIVHHUNPHOJH-IBGZPJMESA-N 0 3 424.545 4.348 20 0 HIADHN C[C@H](NCc1cccc(N2CCCS2(=O)=O)c1)c1ccc(OC(C)(C)C)cc1 ZINC000462837417 875871195 /nfs/dbraw/zinc/87/11/95/875871195.db2.gz WMHHWEUQMSGKFE-KRWDZBQOSA-N 0 3 402.560 4.255 20 0 HIADHN CCc1ccc([C@H](N[C@@H]2CCO[C@@H](C3CC3)C2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000462838710 875873535 /nfs/dbraw/zinc/87/35/35/875873535.db2.gz ZHISVQJYFZFNNA-JRFVFWCSSA-N 0 3 413.583 4.289 20 0 HIADHN CC[C@@H](NCc1cnc(N2CCOCC2)c(F)c1)c1ccc2cc(OC)ccc2c1 ZINC000462843557 875879271 /nfs/dbraw/zinc/87/92/71/875879271.db2.gz JTLAFYLOSAXIFG-HSZRJFAPSA-N 0 3 409.505 4.460 20 0 HIADHN CCCOC[C@@H](Cc1cccc(Br)c1)NCc1cn(C)nc1C(F)F ZINC000462900685 875926868 /nfs/dbraw/zinc/92/68/68/875926868.db2.gz OULSNDXXZRZNHQ-MRXNPFEDSA-N 0 3 416.310 4.248 20 0 HIADHN COc1cc(Br)c(CNC[C@@H]2CCN(c3ccccc3F)C2)cc1OC ZINC000462908334 875934435 /nfs/dbraw/zinc/93/44/35/875934435.db2.gz JFZMWPOPXJQKBY-AWEZNQCLSA-N 0 3 423.326 4.222 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N[C@H](CC(F)(F)F)c1ccccc1 ZINC000463004012 876019666 /nfs/dbraw/zinc/01/96/66/876019666.db2.gz WDPSZOFHTPGLCR-NSISKUIASA-N 0 3 405.464 4.500 20 0 HIADHN COCCCCN(Cc1ccccc1)C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C ZINC000463020083 876036991 /nfs/dbraw/zinc/03/69/91/876036991.db2.gz NWRQOZMKKMATBO-XUZZJYLKSA-N 0 3 409.574 4.145 20 0 HIADHN CC(=O)N1CCN(c2ccccc2CN[C@H](C)c2ccc(OC(C)(C)C)cc2)CC1 ZINC000463025155 876043919 /nfs/dbraw/zinc/04/39/19/876043919.db2.gz SEMHOMTVUWOWHQ-LJQANCHMSA-N 0 3 409.574 4.383 20 0 HIADHN COc1cc(CN2CCC[C@](CO)(Cc3ccccc3)C2)ccc1OCC(F)(F)F ZINC000463028873 876048849 /nfs/dbraw/zinc/04/88/49/876048849.db2.gz CFDHOGJHCKGTKO-QFIPXVFZSA-N 0 3 423.475 4.454 20 0 HIADHN C[C@@H](CCc1cccc(F)c1)C(=O)NCCCCN1CCN(c2ccccc2)CC1 ZINC000463123695 876166232 /nfs/dbraw/zinc/16/62/32/876166232.db2.gz CORWJVFKWCIBIG-NRFANRHFSA-N 0 3 411.565 4.113 20 0 HIADHN CC(C)n1cc(Br)cc1C(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000463152174 876205244 /nfs/dbraw/zinc/20/52/44/876205244.db2.gz REZWLWSVLUEVAV-MAUKXSAKSA-N 0 3 404.352 4.397 20 0 HIADHN Cc1nc(-c2cccc(NC(=O)CN3CCCC[C@@H]3[C@@H]3CCCC[C@H]3O)c2)cs1 ZINC000463195483 876254525 /nfs/dbraw/zinc/25/45/25/876254525.db2.gz XUMCFCUWMQAUMB-KSEOMHKRSA-N 0 3 413.587 4.463 20 0 HIADHN Cc1cc(N2CCCC2)ccc1NC(=O)CN1CCCC[C@@H]1[C@@H]1C[C@@H](C)CC[C@H]1O ZINC000463217883 876275809 /nfs/dbraw/zinc/27/58/09/876275809.db2.gz GUZPJQIZVRFSGC-KXHCOYLBSA-N 0 3 413.606 4.185 20 0 HIADHN Cc1cc(N2CCCC2)ccc1NC(=O)CN1CCCC[C@@H]1[C@@H]1C[C@@H](C)CC[C@@H]1O ZINC000463217882 876277014 /nfs/dbraw/zinc/27/70/14/876277014.db2.gz GUZPJQIZVRFSGC-CJOZULMCSA-N 0 3 413.606 4.185 20 0 HIADHN CN(C(=O)N[C@@H]1CCO[C@@H](c2ccccc2)C1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000463225315 876283387 /nfs/dbraw/zinc/28/33/87/876283387.db2.gz HHHUSJLFHJXMMD-TZRRMPRUSA-N 0 3 407.558 4.213 20 0 HIADHN COc1ccccc1[C@H](NC(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C)c1ccco1 ZINC000463272975 876331171 /nfs/dbraw/zinc/33/11/71/876331171.db2.gz WGLQXUICONEZMP-XZOYJPPVSA-N 0 3 419.525 4.197 20 0 HIADHN COC(=O)CCCN1CCC(Nc2cc(Cl)ccc2OCC(F)(F)F)CC1 ZINC000463280848 876338121 /nfs/dbraw/zinc/33/81/21/876338121.db2.gz NUPVSIDHTOXUTN-UHFFFAOYSA-N 0 3 408.848 4.111 20 0 HIADHN O=C(CCc1nc2cc(Br)ccc2s1)N1CCN(C2CCCC2)CC1 ZINC000463314148 876373216 /nfs/dbraw/zinc/37/32/16/876373216.db2.gz AHFWQOYMRWWWRZ-UHFFFAOYSA-N 0 3 422.392 4.078 20 0 HIADHN CC(C)N(Cc1ccccc1)C(=O)[C@H](C)N1CCC[C@@](CO)(Cc2ccccc2)C1 ZINC000463433541 876489749 /nfs/dbraw/zinc/48/97/49/876489749.db2.gz DSPDNGPFENDFGZ-BKMJKUGQSA-N 0 3 408.586 4.129 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)c2cccc(-c3noc(C4CC4)n3)c2)N(C)C)cc1 ZINC000463436662 876493113 /nfs/dbraw/zinc/49/31/13/876493113.db2.gz YVCMLTQRNZUYSW-OAQYLSRUSA-N 0 3 404.514 4.209 20 0 HIADHN C[C@@H]1CCc2onc(C(=O)N(CCN(C)C)Cc3ccc(C(F)(F)F)cc3)c2C1 ZINC000468973513 883039919 /nfs/dbraw/zinc/03/99/19/883039919.db2.gz LSUINCBANREORG-CQSZACIVSA-N 0 3 409.452 4.022 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)c2cc(NC(=O)C(C)(C)C)ccc2F)c1 ZINC000463498141 876557756 /nfs/dbraw/zinc/55/77/56/876557756.db2.gz WEPLHVGBXKSZAA-UHFFFAOYSA-N 0 3 413.537 4.323 20 0 HIADHN O=C(NC[C@@H]1CCCCN1Cc1ccccc1)c1cccc(-c2noc(C3CC3)n2)c1 ZINC000463509968 876573166 /nfs/dbraw/zinc/57/31/66/876573166.db2.gz UYFVYDSHZOCXSZ-QFIPXVFZSA-N 0 3 416.525 4.399 20 0 HIADHN CC(C)c1nn(C)c2sc(C(=O)N(CCCc3ccccc3)CCN(C)C)cc12 ZINC000463511098 876574625 /nfs/dbraw/zinc/57/46/25/876574625.db2.gz FECKNIMUNHAXQC-UHFFFAOYSA-N 0 3 412.603 4.395 20 0 HIADHN CCc1ccc(-c2ccc(C(=O)Nc3ccc4oc(=O)n(CCN(C)C)c4c3)o2)cc1 ZINC000463568643 876661663 /nfs/dbraw/zinc/66/16/63/876661663.db2.gz JTZUMKAJQSQKSZ-UHFFFAOYSA-N 0 3 419.481 4.231 20 0 HIADHN Cc1nc(-c2cccc(C(=O)N(C)C3CCN(CCc4ccccn4)CC3)c2)cs1 ZINC000463627181 876745136 /nfs/dbraw/zinc/74/51/36/876745136.db2.gz VMUWTPBEPQDNCJ-UHFFFAOYSA-N 0 3 420.582 4.293 20 0 HIADHN Cc1nn(C)c(Sc2ccccc2)c1C(=O)NC[C@H](C)N(C)Cc1ccccc1 ZINC000463762542 876885128 /nfs/dbraw/zinc/88/51/28/876885128.db2.gz HOIIQFIMEFDDPD-KRWDZBQOSA-N 0 3 408.571 4.130 20 0 HIADHN COc1ccc([C@H](CNC(=O)N[C@H](c2ncc(C)s2)C2CC2)N2CCCC2)cc1 ZINC000463969830 877096701 /nfs/dbraw/zinc/09/67/01/877096701.db2.gz KDFWZCJADUJHDX-PMACEKPBSA-N 0 3 414.575 4.048 20 0 HIADHN COc1ccc2[nH]c(C(=O)Nc3ccnn3[C@@H]3CCN(Cc4ccccc4)C3)cc2c1 ZINC000469030345 883098419 /nfs/dbraw/zinc/09/84/19/883098419.db2.gz QWOKFYMCZJNVSO-LJQANCHMSA-N 0 3 415.497 4.072 20 0 HIADHN Cc1c2ccc(NC(=O)NC[C@@H](c3ccc(OC(C)C)cc3)N(C)C)cc2nn1C ZINC000464086590 877240079 /nfs/dbraw/zinc/24/00/79/877240079.db2.gz IWLJRBZMIMXKSJ-QFIPXVFZSA-N 0 3 409.534 4.093 20 0 HIADHN CC[C@H](CNC(=O)N[C@@H](C)c1cn(C(C)(C)C)nc1C)N1CCc2ccccc2C1 ZINC000464139458 877304712 /nfs/dbraw/zinc/30/47/12/877304712.db2.gz IITBNRDYGYMKFD-LAUBAEHRSA-N 0 3 411.594 4.144 20 0 HIADHN C[C@H]1C[C@H](NC(=O)NCc2cccc(-c3cccnc3)c2)CN1Cc1ccccc1 ZINC000464303761 877492325 /nfs/dbraw/zinc/49/23/25/877492325.db2.gz DAHVEFHXTQMJDX-CYFREDJKSA-N 0 3 400.526 4.211 20 0 HIADHN Cc1cccc(S(=O)(=O)CCCN[C@@H](C)c2cccc(OCc3ccccn3)c2)c1 ZINC000464480894 877701389 /nfs/dbraw/zinc/70/13/89/877701389.db2.gz MVDNVSVVHFXPHD-FQEVSTJZSA-N 0 3 424.566 4.484 20 0 HIADHN CCOc1cccc2cc([C@H](C)NCCCS(=O)(=O)c3ccccc3OC)oc21 ZINC000464490271 877708520 /nfs/dbraw/zinc/70/85/20/877708520.db2.gz LKVAFSSHPLGWIB-INIZCTEOSA-N 0 3 417.527 4.355 20 0 HIADHN Cc1cccc(S(=O)(=O)CCCNC2(c3ccc(Br)cc3)CC2)c1 ZINC000464494676 877712973 /nfs/dbraw/zinc/71/29/73/877712973.db2.gz IEXMJUDVNLOVJN-UHFFFAOYSA-N 0 3 408.361 4.200 20 0 HIADHN CC(C)CN(C(=O)[C@@H]1C[C@]12CCc1cc(Br)ccc12)C1CCN(C)CC1 ZINC000464572670 877792795 /nfs/dbraw/zinc/79/27/95/877792795.db2.gz HOXZKWWYRZJZNT-UNMCSNQZSA-N 0 3 419.407 4.232 20 0 HIADHN Cc1nn(C(C)(C)C)cc1[C@H](C)NC[C@@H](O)COc1ccc(Cl)cc1Cl ZINC000464609765 877837795 /nfs/dbraw/zinc/83/77/95/877837795.db2.gz QFYRCMXMCBCJPV-SWLSCSKDSA-N 0 3 400.350 4.344 20 0 HIADHN Cc1cccc(S(=O)(=O)CCCN(Cc2ccccc2)CC2CCOCC2)c1 ZINC000464689781 877904700 /nfs/dbraw/zinc/90/47/00/877904700.db2.gz KBLBGLYFCYMSMS-UHFFFAOYSA-N 0 3 401.572 4.088 20 0 HIADHN COc1cccc([C@@H](CNC(=O)[C@H](C(C)C)N(C)C)c2c[nH]c3ccccc32)c1OC ZINC000464789982 878035715 /nfs/dbraw/zinc/03/57/15/878035715.db2.gz HXYPGGQGZZHCCK-OFNKIYASSA-N 0 3 423.557 4.019 20 0 HIADHN CCN(CC(=O)Nc1cc(Cl)ccc1F)CC1CCN(c2ccccn2)CC1 ZINC000464804780 878050899 /nfs/dbraw/zinc/05/08/99/878050899.db2.gz IMZAZBYPIWGEAP-UHFFFAOYSA-N 0 3 404.917 4.051 20 0 HIADHN CCc1ccc([C@@H]2C[C@@H](C)CCN2C[C@@H](O)COc2c(OC)cccc2OC)o1 ZINC000464846646 878120461 /nfs/dbraw/zinc/12/04/61/878120461.db2.gz SENMVCFEIAZPEK-SCTDSRPQSA-N 0 3 403.519 4.072 20 0 HIADHN CCc1nsc(N2CCCN(CC/C=C\c3ccc(Br)cc3)CC2)n1 ZINC000464848513 878122810 /nfs/dbraw/zinc/12/28/10/878122810.db2.gz BZUVDQCKEDKDPJ-UTCJRWHESA-N 0 3 421.408 4.479 20 0 HIADHN CCCCOC1CCN(C[C@H](O)COc2ccc(Cl)cc2Br)CC1 ZINC000464859175 878139225 /nfs/dbraw/zinc/13/92/25/878139225.db2.gz QGACQDGUMQMFBI-HNNXBMFYSA-N 0 3 420.775 4.123 20 0 HIADHN COC(=O)c1ccc2c(c1)nc(CN(CCc1cccc(F)c1)C1CCCC1)[nH]c2=O ZINC000464875569 878163389 /nfs/dbraw/zinc/16/33/89/878163389.db2.gz DMHMVKQMGGJSTD-UHFFFAOYSA-N 0 3 423.488 4.248 20 0 HIADHN CSCc1nc2ccccc2n1CC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1 ZINC000464894117 878199003 /nfs/dbraw/zinc/19/90/03/878199003.db2.gz NPPFMHBYGKHRDP-IBGZPJMESA-N 0 3 422.598 4.022 20 0 HIADHN Cc1oc(-c2ccccc2)nc1CC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1 ZINC000464894557 878199186 /nfs/dbraw/zinc/19/91/86/878199186.db2.gz OEJFJWVJRKVDJZ-IBGZPJMESA-N 0 3 403.526 4.316 20 0 HIADHN C[C@H]1CCN(C(=O)CCc2ccc(OC(F)F)cc2)CCN1Cc1ccccc1 ZINC000464896029 878201204 /nfs/dbraw/zinc/20/12/04/878201204.db2.gz RFLHXASSDCNFAF-SFHVURJKSA-N 0 3 402.485 4.344 20 0 HIADHN Cc1ccccc1C1(C(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)CCOCC1 ZINC000464897474 878204020 /nfs/dbraw/zinc/20/40/20/878204020.db2.gz WBHZRPHYGJQYEL-JOCHJYFZSA-N 0 3 406.570 4.166 20 0 HIADHN COc1ccc(-c2nc(C)c(C(=O)N3CCC[C@H]3CN3CCCCC3)s2)c(F)c1 ZINC000503356221 912330311 /nfs/dbraw/zinc/33/03/11/912330311.db2.gz QRPODBADYJUQDL-INIZCTEOSA-N 0 3 417.550 4.357 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)c1cc(Oc2ccccc2)ccn1 ZINC000465139311 878520683 /nfs/dbraw/zinc/52/06/83/878520683.db2.gz MTCDSCGJARJYLB-OAQYLSRUSA-N 0 3 416.525 4.396 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)N[C@@H](c2ccc(C)cc2)c2ccccn2)cc1 ZINC000503374921 912355098 /nfs/dbraw/zinc/35/50/98/912355098.db2.gz VQDBWRQVMKNGOS-ZEQRLZLVSA-N 0 3 418.541 4.090 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)N[C@H](c2ccc(C)cc2)c2ccccn2)cc1 ZINC000503374918 912356051 /nfs/dbraw/zinc/35/60/51/912356051.db2.gz VQDBWRQVMKNGOS-BJKOFHAPSA-N 0 3 418.541 4.090 20 0 HIADHN C[C@H](NC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1)c1cccc(-n2cccn2)c1 ZINC000465206231 878613993 /nfs/dbraw/zinc/61/39/93/878613993.db2.gz NGHNPKUQIBEWLA-GHTZIAJQSA-N 0 3 406.505 4.101 20 0 HIADHN Cc1nn(-c2cccc(Cl)c2)c2sc(C(=O)N3CC[C@H]4CC[C@@H](C3)N4C)cc12 ZINC000465227423 878643392 /nfs/dbraw/zinc/64/33/92/878643392.db2.gz SSOUEKYZEQSDAQ-WBVHZDCISA-N 0 3 414.962 4.358 20 0 HIADHN CC(C)N(Cc1ccccc1)C(=O)[C@H](C)N1CCC[C@H](c2ncc3n2CCCC3)C1 ZINC000503388451 912371078 /nfs/dbraw/zinc/37/10/78/912371078.db2.gz CNJWJONJRDTMGY-UNMCSNQZSA-N 0 3 408.590 4.225 20 0 HIADHN CC(=O)N(C)c1cccc(NC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)c1 ZINC000465286565 878722190 /nfs/dbraw/zinc/72/21/90/878722190.db2.gz QIRWPIJCUGBIIM-NRFANRHFSA-N 0 3 419.447 4.062 20 0 HIADHN O=c1c2ccccc2ncn1CCN1CCC(c2ccc(Br)cc2)CC1 ZINC000503404645 912385499 /nfs/dbraw/zinc/38/54/99/912385499.db2.gz HFOWYDCYBIDOLK-UHFFFAOYSA-N 0 3 412.331 4.039 20 0 HIADHN C[C@@H](CNC(=O)NC[C@@H](c1cccs1)N1CCCC1)Oc1ccccc1Cl ZINC000465424668 878854423 /nfs/dbraw/zinc/85/44/23/878854423.db2.gz PJUKRRFKGJWTKR-RDJZCZTQSA-N 0 3 407.967 4.305 20 0 HIADHN CC1CCN([C@H](CNC(=O)N[C@@H]2[C@H]3CCCO[C@H]3C2(C)C)c2cccs2)CC1 ZINC000465424363 878854855 /nfs/dbraw/zinc/85/48/55/878854855.db2.gz OYDQQBZDBGSDEP-HNBVOPMISA-N 0 3 405.608 4.024 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N2CC[C@@H](COCc3ccccc3)C2)N(C)C)cc1 ZINC000465429600 878859536 /nfs/dbraw/zinc/85/95/36/878859536.db2.gz HVBSUKRJDGUJJT-VWNXMTODSA-N 0 3 409.574 4.100 20 0 HIADHN C[C@@H]1CN(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)C[C@H](c2ccc(F)cc2)O1 ZINC000465431265 878863217 /nfs/dbraw/zinc/86/32/17/878863217.db2.gz SDSLLADGPHUDFO-YFXJRYMSSA-N 0 3 411.521 4.134 20 0 HIADHN CO[C@@H](CNC(=O)NC[C@H](c1cccs1)N1CCCC1)c1cccc(Cl)c1 ZINC000465432434 878863650 /nfs/dbraw/zinc/86/36/50/878863650.db2.gz XEDMOPOJNKJAHJ-MSOLQXFVSA-N 0 3 407.967 4.225 20 0 HIADHN C[C@H](NC(=O)NC[C@@H](c1ccccc1)N1CCCC1)c1ccc(-n2cccn2)cc1 ZINC000465433028 878865479 /nfs/dbraw/zinc/86/54/79/878865479.db2.gz ZWHXYAFTTQRBRC-CVDCTZTESA-N 0 3 403.530 4.070 20 0 HIADHN CC[C@@H](NC(=O)NC[C@H](Cc1ccccc1)N(C)C)c1nc(C(F)(F)F)cs1 ZINC000465440350 878871669 /nfs/dbraw/zinc/87/16/69/878871669.db2.gz ZWVVBBPSIIOMPY-LSDHHAIUSA-N 0 3 414.497 4.085 20 0 HIADHN CC[C@@H](NC(=O)NC[C@@H](c1ccccc1)N(C)C)c1nc(C(F)(F)F)cs1 ZINC000465454609 878885345 /nfs/dbraw/zinc/88/53/45/878885345.db2.gz ISSXXICLHBPRFZ-KGLIPLIRSA-N 0 3 400.470 4.215 20 0 HIADHN COc1cccc([C@H](CNC(=O)N[C@@H](C)c2c(F)cccc2OC)N2CCCC2)c1 ZINC000465467143 878902491 /nfs/dbraw/zinc/90/24/91/878902491.db2.gz OBEVYXXZIAZYNA-JXFKEZNVSA-N 0 3 415.509 4.040 20 0 HIADHN CN(C)CCN(C[C@H]1CCCO1)C(=O)N[C@H](c1cc2ccccc2o1)c1ccccc1 ZINC000465497419 878937135 /nfs/dbraw/zinc/93/71/35/878937135.db2.gz FLCHKCBZTNTWBC-QPPBQGQZSA-N 0 3 421.541 4.274 20 0 HIADHN CC[C@H](CNC(=O)N(C)[C@@H](C)Cc1ccccc1OC)N1CCc2ccccc2C1 ZINC000465525119 878977773 /nfs/dbraw/zinc/97/77/73/878977773.db2.gz KIZULMPWWFUZLK-WMZHIEFXSA-N 0 3 409.574 4.105 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CC[C@H](COCc2ccccc2)C1)c1ccsc1 ZINC000465532877 878989540 /nfs/dbraw/zinc/98/95/40/878989540.db2.gz WBGROGDDXSCCIQ-RBBKRZOGSA-N 0 3 415.603 4.379 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NC[C@H](OC)c1cccc(Cl)c1)c1ccsc1 ZINC000465532506 878989649 /nfs/dbraw/zinc/98/96/49/878989649.db2.gz FWGZSARFNVIDBF-OALUTQOASA-N 0 3 409.983 4.471 20 0 HIADHN CC(C)CC[C@@H](NC(=O)NC[C@H](C)CN1CCN(C)CC1)c1ccc(Cl)cc1 ZINC000465664139 879196624 /nfs/dbraw/zinc/19/66/24/879196624.db2.gz PTCKYSDTCVOMFV-GHTZIAJQSA-N 0 3 409.018 4.000 20 0 HIADHN C[C@H]1CCN(C(=O)NCc2cc(-c3ccccc3)no2)CCN1Cc1ccccc1 ZINC000465678072 879220985 /nfs/dbraw/zinc/22/09/85/879220985.db2.gz ZWZYWCJJNCJWLI-IBGZPJMESA-N 0 3 404.514 4.148 20 0 HIADHN CCc1nc(C)c([C@H](C)N(C)C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)s1 ZINC000465695918 879252455 /nfs/dbraw/zinc/25/24/55/879252455.db2.gz SKMGGJOGAVSIEC-HKUYNNGSSA-N 0 3 400.592 4.381 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)N2C[C@@H](C)O[C@H](c3ccc(F)cc3)C2)C1 ZINC000465741931 879328786 /nfs/dbraw/zinc/32/87/86/879328786.db2.gz ADCCJUMNJJCFCW-FKKSXTGDSA-N 0 3 411.521 4.133 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1)c1nc(C2CCCCC2)no1 ZINC000465753992 879343982 /nfs/dbraw/zinc/34/39/82/879343982.db2.gz LEISNVDMDMDCQZ-ABSDTBQOSA-N 0 3 411.550 4.313 20 0 HIADHN CO[C@H](CNC(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1)c1cccc(Cl)c1 ZINC000465761303 879358111 /nfs/dbraw/zinc/35/81/11/879358111.db2.gz QNBMBHIDEQJQQG-ZLGUVYLKSA-N 0 3 401.938 4.162 20 0 HIADHN CN(C)CCN(C[C@H]1CCCO1)C(=O)N[C@@H](c1ccsc1)c1ccc(Cl)cc1 ZINC000465763257 879358708 /nfs/dbraw/zinc/35/87/08/879358708.db2.gz WFIIMOCKLOIPLA-WOJBJXKFSA-N 0 3 421.994 4.243 20 0 HIADHN CO[C@H](CNC(=O)N[C@H]1CCN([C@H](C)c2ccccc2)C1)c1ccc(Cl)cc1 ZINC000465766044 879363518 /nfs/dbraw/zinc/36/35/18/879363518.db2.gz XIMNEVGKAUERHT-TYCQWZJGSA-N 0 3 401.938 4.162 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N[C@@H](C)c2ccc(-n3cccn3)cc2)C1 ZINC000465767188 879366045 /nfs/dbraw/zinc/36/60/45/879366045.db2.gz YWDIVGJZDZAFLQ-JQVVWYNYSA-N 0 3 403.530 4.068 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N[C@@H](C)c2ccc(-n3cccn3)cc2)N2CCCC2)cc1 ZINC000465825103 879455703 /nfs/dbraw/zinc/45/57/03/879455703.db2.gz BHWOYTQOYBGCFG-GBXCKJPGSA-N 0 3 417.557 4.378 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)N[C@@H](CC2CCCCC2)c2ccccc2)CC1 ZINC000465836389 879472398 /nfs/dbraw/zinc/47/23/98/879472398.db2.gz OTRFDEZBMOORKW-URXFXBBRSA-N 0 3 414.638 4.271 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccc(O)cc1)C(=O)c1cc(-c2cccs2)on1 ZINC000503445527 912464587 /nfs/dbraw/zinc/46/45/87/912464587.db2.gz FBUIBHXQXCZMOW-KRWDZBQOSA-N 0 3 411.527 4.235 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@H]2CNC(=O)NC[C@@H](C)N(C)Cc2ccccc2)cc1 ZINC000465894183 879551489 /nfs/dbraw/zinc/55/14/89/879551489.db2.gz UIHFGHMUBKRKTR-QDSKXPNFSA-N 0 3 409.574 4.282 20 0 HIADHN CC(C)[C@H](CNC(=O)N1CC[C@H](N2CC=CC2)C1)Cc1ccc(Cl)cc1Cl ZINC000465925117 879588399 /nfs/dbraw/zinc/58/83/99/879588399.db2.gz NZJAYNXUTJDSNV-HKUYNNGSSA-N 0 3 410.389 4.464 20 0 HIADHN O=C(NCc1ccc(-c2cccnc2)cc1)NC[C@H]1CCCN1Cc1ccccc1 ZINC000465926468 879589461 /nfs/dbraw/zinc/58/94/61/879589461.db2.gz IRKSCGQKYNDKPA-XMMPIXPASA-N 0 3 400.526 4.212 20 0 HIADHN Cc1cccc(COc2ccc([C@H](C)NC(=O)N3CC[C@H](N4CC=CC4)C3)cc2)c1 ZINC000465953525 879620596 /nfs/dbraw/zinc/62/05/96/879620596.db2.gz QBKJJEYYXSACRV-REWPJTCUSA-N 0 3 405.542 4.291 20 0 HIADHN CC[C@H](NC(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1)C(C)(C)c1ccccc1 ZINC000465965873 879634054 /nfs/dbraw/zinc/63/40/54/879634054.db2.gz FURKBVAZHFGHQA-VIZSFHNOSA-N 0 3 415.622 4.274 20 0 HIADHN Cc1cc([C@H](NC(=O)N[C@H]2CCN(C3CC3)C2)c2ccccc2Cl)ccc1F ZINC000466014774 879697069 /nfs/dbraw/zinc/69/70/69/879697069.db2.gz JKENNBWTJJXEKG-KKSFZXQISA-N 0 3 401.913 4.413 20 0 HIADHN Cc1nc(C)c(CNC(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)s1 ZINC000466110180 879824666 /nfs/dbraw/zinc/82/46/66/879824666.db2.gz PSKPLPSWYUTUIM-UHFFFAOYSA-N 0 3 414.497 4.052 20 0 HIADHN Cc1cnc([C@H](NC(=O)N(CCN(C)C)Cc2cccc(Cl)c2)C2CC2)s1 ZINC000466114084 879828177 /nfs/dbraw/zinc/82/81/77/879828177.db2.gz HGCXYIKLPUNKQV-GOSISDBHSA-N 0 3 406.983 4.329 20 0 HIADHN Cc1cc(Sc2ccccc2)ccc1NC(=O)NC[C@H](C)CN1CCN(C)CC1 ZINC000466133998 879845607 /nfs/dbraw/zinc/84/56/07/879845607.db2.gz GKMTXQJWZVEMSH-SFHVURJKSA-N 0 3 412.603 4.151 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)N[C@H](c2ccccc2)c2ccccn2)CN1Cc1ccccc1 ZINC000466140085 879849913 /nfs/dbraw/zinc/84/99/13/879849913.db2.gz FRKRSWDEVBBBTF-ZFJSRUIDSA-N 0 3 400.526 4.133 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)N[C@@H](c2ccccc2)c2cccnc2)CN1Cc1ccccc1 ZINC000466236592 879941757 /nfs/dbraw/zinc/94/17/57/879941757.db2.gz APATZKUSXQIRQZ-YGOYIFOWSA-N 0 3 400.526 4.133 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccc(O)cc1)C(=O)c1coc(-c2ccccc2)n1 ZINC000503478945 912521479 /nfs/dbraw/zinc/52/14/79/912521479.db2.gz KAUBDZHQOZXUCH-HXUWFJFHSA-N 0 3 405.498 4.174 20 0 HIADHN COc1cccc([C@@H](CNC(=O)NCCc2c[nH]c3cccc(C)c23)N2CCCC2)c1 ZINC000503480708 912522443 /nfs/dbraw/zinc/52/24/43/912522443.db2.gz WOLFCQSKNLSCSB-HSZRJFAPSA-N 0 3 420.557 4.164 20 0 HIADHN COc1cccc([C@H](CNC(=O)NCCc2c[nH]c3cccc(C)c23)N2CCCC2)c1 ZINC000503480709 912524163 /nfs/dbraw/zinc/52/41/63/912524163.db2.gz WOLFCQSKNLSCSB-QHCPKHFHSA-N 0 3 420.557 4.164 20 0 HIADHN CCOc1ccc(CNCc2ccc(I)c(C)c2)cc1OC ZINC000466363967 880122288 /nfs/dbraw/zinc/12/22/88/880122288.db2.gz IBBCEXFCLXGXQO-UHFFFAOYSA-N 0 3 411.283 4.297 20 0 HIADHN Cc1cc(CNCc2cc3ccccc3[nH]c2=O)ccc1I ZINC000466364740 880123618 /nfs/dbraw/zinc/12/36/18/880123618.db2.gz QUOOBOJJWCMTDZ-UHFFFAOYSA-N 0 3 404.251 4.143 20 0 HIADHN C[C@@H](CNC(=O)Nc1cccc(CN(C)C)c1)Oc1ccc(Br)cc1 ZINC000466375337 880134717 /nfs/dbraw/zinc/13/47/17/880134717.db2.gz ZLXWXJSCYDWGBO-AWEZNQCLSA-N 0 3 406.324 4.100 20 0 HIADHN FC(F)(F)c1cnc(OCCNCc2cncc(Br)c2)c(Cl)c1 ZINC000466377389 880137753 /nfs/dbraw/zinc/13/77/53/880137753.db2.gz DINNINIOGMDJLQ-UHFFFAOYSA-N 0 3 410.621 4.080 20 0 HIADHN CO[C@H](C)[C@H](C)N[C@H](C)C(=O)N1N=C(c2ccc(Cl)cc2)C[C@@H]1c1ccco1 ZINC000466429027 880204014 /nfs/dbraw/zinc/20/40/14/880204014.db2.gz UQKNZWADXORXEN-NRTGNBEESA-N 0 3 403.910 4.012 20 0 HIADHN CCOc1cc(CN[C@@H]2CCCc3sccc32)ccc1O[C@@H](C)C(=O)N(C)C ZINC000466461282 880242490 /nfs/dbraw/zinc/24/24/90/880242490.db2.gz GYMVTRXBXAVRLD-MAUKXSAKSA-N 0 3 402.560 4.170 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N[C@@H](c1ccccc1)c1cccnc1 ZINC000503503105 912550324 /nfs/dbraw/zinc/55/03/24/912550324.db2.gz MMGFWNRYVRDXBO-IRLDBZIGSA-N 0 3 406.555 4.369 20 0 HIADHN C[C@H](NC(=O)N[C@H]1C[C@@H](C)N(Cc2ccccc2)C1)c1nc(C(C)(C)C)cs1 ZINC000466505718 880281057 /nfs/dbraw/zinc/28/10/57/880281057.db2.gz QGZBHFIDFQFTQM-RYRKJORJSA-N 0 3 400.592 4.464 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)NCc2ccc(-c3cccnc3)cc2)CN1Cc1ccccc1 ZINC000466511361 880285942 /nfs/dbraw/zinc/28/59/42/880285942.db2.gz AJBBJCIOHLETNX-YADARESESA-N 0 3 400.526 4.211 20 0 HIADHN CC(=O)Nc1ccc(Cl)c(NC(=O)N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)c1 ZINC000466516006 880289474 /nfs/dbraw/zinc/28/94/74/880289474.db2.gz DRHZQHNGWBSGAK-KDOFPFPSSA-N 0 3 400.910 4.083 20 0 HIADHN C[C@H]1C[C@H](NC(=O)Nc2cc3c(cc2Cl)OCCCO3)CN1Cc1ccccc1 ZINC000466514364 880289687 /nfs/dbraw/zinc/28/96/87/880289687.db2.gz LHPREAHBQVJFGB-RDJZCZTQSA-N 0 3 415.921 4.286 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)N(Cc2ccccc2)CC2CCOCC2)CN1Cc1ccccc1 ZINC000466514554 880290062 /nfs/dbraw/zinc/29/00/62/880290062.db2.gz LDRZUGBMGDRXBG-PXDATVDWSA-N 0 3 421.585 4.288 20 0 HIADHN CCO[C@H](C)c1nc(CN(C)C(=O)N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)cs1 ZINC000466537159 880310756 /nfs/dbraw/zinc/31/07/56/880310756.db2.gz VOGWPVCOLWNVGG-ZHALLVOQSA-N 0 3 416.591 4.045 20 0 HIADHN C[C@H]1C[C@H](NC(=O)Nc2ccccc2C(=O)N2CCCCC2)CN1Cc1ccccc1 ZINC000466541933 880315995 /nfs/dbraw/zinc/31/59/95/880315995.db2.gz PNDRFZGEYFYUSD-FPOVZHCZSA-N 0 3 420.557 4.097 20 0 HIADHN CC[C@H](CNC(=O)N1CCC[C@@H]1c1ccc(COC)o1)N1CCc2ccccc2C1 ZINC000466564006 880338726 /nfs/dbraw/zinc/33/87/26/880338726.db2.gz QEHXTWIKIGBAIX-IFMALSPDSA-N 0 3 411.546 4.109 20 0 HIADHN O=C(NCc1cc(Cl)ccc1OC(F)F)N1CCCN(Cc2ccccc2)CC1 ZINC000466781222 880559473 /nfs/dbraw/zinc/55/94/73/880559473.db2.gz YVUJFUGTCRCULB-UHFFFAOYSA-N 0 3 423.891 4.359 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N(C)CC[C@H]1CCCO1)c1ccc(C(F)(F)F)cc1 ZINC000466973173 880775598 /nfs/dbraw/zinc/77/55/98/880775598.db2.gz CATPVSBXJFKUSK-RTBURBONSA-N 0 3 415.500 4.299 20 0 HIADHN CCS[C@H]1CC[C@H](N(C)C(=O)Nc2ccc(N3CCN(CC)CC3)cc2C)C1 ZINC000466978505 880781395 /nfs/dbraw/zinc/78/13/95/880781395.db2.gz ZELCRWSLJOMANE-ICSRJNTNSA-N 0 3 404.624 4.275 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)Cc2ccc(NC(=O)CC(C)(C)C)cc2)CN1Cc1ccccc1 ZINC000467040823 880837161 /nfs/dbraw/zinc/83/71/61/880837161.db2.gz NRRYFKUBQLSRCB-WMZHIEFXSA-N 0 3 421.585 4.383 20 0 HIADHN C[C@H]1C[C@H](NC(=O)c2cccc(C(=O)N(C)CC(C)(C)C)c2)CN1Cc1ccccc1 ZINC000467040186 880837282 /nfs/dbraw/zinc/83/72/82/880837282.db2.gz HLOVUCHJSXMJFC-CVDCTZTESA-N 0 3 421.585 4.198 20 0 HIADHN C[C@H](SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)N[C@H]1CN(C2CC2)C[C@@H]1C ZINC000467049221 880841410 /nfs/dbraw/zinc/84/14/10/880841410.db2.gz XEOJZZKCBUPSLN-DEYYWGMASA-N 0 3 419.978 4.216 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)c2cnn(C(C)(C)C)c2C(F)(F)F)CN1Cc1ccccc1 ZINC000467051731 880843465 /nfs/dbraw/zinc/84/34/65/880843465.db2.gz RHYLXJIJFOADEU-ZBFHGGJFSA-N 0 3 408.468 4.050 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)CCc2nc(-c3ccc(Cl)cc3)no2)CN1Cc1ccccc1 ZINC000467053932 880844086 /nfs/dbraw/zinc/84/40/86/880844086.db2.gz NZTAOSOZLMXXSW-OXQOHEQNSA-N 0 3 424.932 4.102 20 0 HIADHN C[C@@H]1CCN(C)CCN1C(=O)NCc1csc(-c2ccc(C(F)(F)F)cc2)n1 ZINC000467060685 880847066 /nfs/dbraw/zinc/84/70/66/880847066.db2.gz ZDTAOZZIRJPGGS-CYBMUJFWSA-N 0 3 412.481 4.065 20 0 HIADHN CCS[C@@H]1CC[C@@H](N(C)C(=O)Nc2ccc(CCN3CCSCC3)cc2)C1 ZINC000467105702 880866099 /nfs/dbraw/zinc/86/60/99/880866099.db2.gz GJAUZWWNRKWZOE-WOJBJXKFSA-N 0 3 407.649 4.416 20 0 HIADHN Cc1cc(Oc2ncccn2)ccc1NC(=O)N[C@@H]1C[C@@H](C)N(Cc2ccccc2)C1 ZINC000467109503 880868582 /nfs/dbraw/zinc/86/85/82/880868582.db2.gz GYJYRLPUPFQOOK-UYAOXDASSA-N 0 3 417.513 4.362 20 0 HIADHN C[C@H]1C[C@H](NC(=O)Nc2cccc(NC(=O)c3ccoc3)c2)CN1Cc1ccccc1 ZINC000467114006 880872582 /nfs/dbraw/zinc/87/25/82/880872582.db2.gz KBTNSVXPRLOCCT-JTSKRJEESA-N 0 3 418.497 4.316 20 0 HIADHN Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)N[C@@H]1C[C@H](C)N(Cc2ccccc2)C1 ZINC000467116700 880874047 /nfs/dbraw/zinc/87/40/47/880874047.db2.gz MHYJHPRYRSNPJS-SIKLNZKXSA-N 0 3 420.557 4.016 20 0 HIADHN COC[C@H]1CCCCN([C@@H](C)C(=O)Nc2cccc(CSc3ccccn3)c2)C1 ZINC000467121819 880877421 /nfs/dbraw/zinc/87/74/21/880877421.db2.gz GXYXQDXMPQPQRS-ICSRJNTNSA-N 0 3 413.587 4.449 20 0 HIADHN COC[C@@H]1CCCCN([C@@H](C)C(=O)Nc2cccc(CSc3ccccn3)c2)C1 ZINC000467121818 880877660 /nfs/dbraw/zinc/87/76/60/880877660.db2.gz GXYXQDXMPQPQRS-AZUAARDMSA-N 0 3 413.587 4.449 20 0 HIADHN COC1CCN(C(C)(C)CNC(=O)c2cncc(-c3ccc(Cl)cc3)c2)CC1 ZINC000467190032 880917409 /nfs/dbraw/zinc/91/74/09/880917409.db2.gz DKQYTSMGMOUOPT-UHFFFAOYSA-N 0 3 401.938 4.021 20 0 HIADHN Cc1ccccc1C(=O)NC1CCN(CCOc2ccc(OC(F)(F)F)cc2)CC1 ZINC000467191759 880919883 /nfs/dbraw/zinc/91/98/83/880919883.db2.gz QWWAFJDULOLEKA-UHFFFAOYSA-N 0 3 422.447 4.167 20 0 HIADHN O=C(NC1CCCCC1)C1CCN(CCOc2ccc(OC(F)(F)F)cc2)CC1 ZINC000467197722 880926887 /nfs/dbraw/zinc/92/68/87/880926887.db2.gz URZHZERQZMARGD-UHFFFAOYSA-N 0 3 414.468 4.125 20 0 HIADHN C[C@H](NC(=O)N1CCC[C@@H]1c1cc(F)cc(Br)c1)C1=CCN(C)CC1 ZINC000467214952 880944231 /nfs/dbraw/zinc/94/42/31/880944231.db2.gz DWOUNSYVMMSVQM-SCLBCKFNSA-N 0 3 410.331 4.085 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)N2CCC[C@H]2c2cc(F)cc(Br)c2)CN1C1CC1 ZINC000467228487 880957442 /nfs/dbraw/zinc/95/74/42/880957442.db2.gz IPWXLEUONCDCGT-NJAPINKUSA-N 0 3 410.331 4.060 20 0 HIADHN COCC[C@H]1CCCCN(CC(=O)N[C@@H](c2cccs2)c2ccc(F)cc2)C1 ZINC000467272707 881015534 /nfs/dbraw/zinc/01/55/34/881015534.db2.gz HAOIZWBURXZBFP-VGOFRKELSA-N 0 3 404.551 4.231 20 0 HIADHN C[S@@](=O)c1ccc(CN(Cc2cccc(Br)c2)C2CCOCC2)cc1 ZINC000467351090 881108410 /nfs/dbraw/zinc/10/84/10/881108410.db2.gz XUTSEXISMUVBAL-RUZDIDTESA-N 0 3 422.388 4.368 20 0 HIADHN C[C@H](Cc1cccc(C(F)(F)F)c1)N[C@@H](c1nc(-c2nc[nH]n2)no1)C(C)(C)C ZINC000467351367 881108895 /nfs/dbraw/zinc/10/88/95/881108895.db2.gz BBCMJDOXPJNGCO-RISCZKNCSA-N 0 3 408.428 4.182 20 0 HIADHN C[C@@H](N[C@@H]1CCCC12CCOCC2)c1nc(-c2ccc(Br)cc2)no1 ZINC000503571114 912650379 /nfs/dbraw/zinc/65/03/79/912650379.db2.gz MLVWFYQYWIIUAX-CZUORRHYSA-N 0 3 406.324 4.499 20 0 HIADHN CCS(=O)(=O)c1cccc(CN[C@@H]2CCCc3cc(Br)ccc32)c1 ZINC000467401156 881185020 /nfs/dbraw/zinc/18/50/20/881185020.db2.gz BINJZHMCQMJXAH-LJQANCHMSA-N 0 3 408.361 4.410 20 0 HIADHN Cc1c([C@H](C)NCCN2CCc3ccccc3C2=O)cnn1-c1cccc(Cl)c1 ZINC000467401787 881185628 /nfs/dbraw/zinc/18/56/28/881185628.db2.gz PIWPEQRQEOVMET-INIZCTEOSA-N 0 3 408.933 4.183 20 0 HIADHN Cc1ccc(-c2nnc([C@H](C)NCC3(N4CCSCC4)CCCC3)o2)cc1C ZINC000467401268 881186154 /nfs/dbraw/zinc/18/61/54/881186154.db2.gz CEYMELZFYUJDQI-SFHVURJKSA-N 0 3 400.592 4.366 20 0 HIADHN C[C@H](NCc1cc(Cl)ccc1N1CCOCC1)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000467420354 881208725 /nfs/dbraw/zinc/20/87/25/881208725.db2.gz UNOZQQRUBHVTPW-HNNXBMFYSA-N 0 3 413.949 4.257 20 0 HIADHN COc1ccc2c(c1)[C@H](NC[C@H](O)COc1ccc(C(F)(F)F)cc1)CCS2 ZINC000467420117 881209778 /nfs/dbraw/zinc/20/97/78/881209778.db2.gz QOSWNKHXQWTRDH-KBXCAEBGSA-N 0 3 413.461 4.280 20 0 HIADHN O=C(c1cccc(CN2CCCC2)c1)N1CC(OCc2cccc3ccccc32)C1 ZINC000467463352 881274150 /nfs/dbraw/zinc/27/41/50/881274150.db2.gz JBEDHAPUBXFOEL-UHFFFAOYSA-N 0 3 400.522 4.477 20 0 HIADHN COc1ccccc1CC(=O)N1CCC(NCc2ccc(Oc3ccccc3)o2)CC1 ZINC000503581954 912669137 /nfs/dbraw/zinc/66/91/37/912669137.db2.gz UBLBMRUWKHPEEY-UHFFFAOYSA-N 0 3 420.509 4.404 20 0 HIADHN CCN(C(=O)CCN1CCN(c2cccc(C)c2)CC1)[C@@H](C)c1cccc(OC)c1 ZINC000467522221 881338543 /nfs/dbraw/zinc/33/85/43/881338543.db2.gz OFPBTYXQHCAXMV-NRFANRHFSA-N 0 3 409.574 4.125 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)c2cc(Br)c(F)cc2F)C1 ZINC000469051792 883125241 /nfs/dbraw/zinc/12/52/41/883125241.db2.gz SACDHTIEWSFLLU-OCCSQVGLSA-N 0 3 409.274 4.293 20 0 HIADHN CC[C@@H](Cc1ccccc1)N(CC)CC(=O)NCC(=O)Nc1c(C)cc(C)cc1C ZINC000469059484 883133460 /nfs/dbraw/zinc/13/34/60/883133460.db2.gz STVVCARLTXWDRP-QFIPXVFZSA-N 0 3 409.574 4.010 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N3CC[C@H](CSc4ccccc4)C3)cc2)CC1 ZINC000469067945 883146641 /nfs/dbraw/zinc/14/66/41/883146641.db2.gz WWFICLLJFYNIIR-FQEVSTJZSA-N 0 3 409.599 4.083 20 0 HIADHN COCCc1nc(C)c([C@H](C)NCc2ccc(C)nc2-n2cc(Cl)cn2)s1 ZINC000469069169 883148126 /nfs/dbraw/zinc/14/81/26/883148126.db2.gz WREUNQKUUVNIFT-ZDUSSCGKSA-N 0 3 405.955 4.034 20 0 HIADHN C[C@H](O)C[C@H](CNC(=O)[C@H](C)N1CCC(Cc2ccccc2)CC1)c1ccccc1 ZINC000469075763 883161665 /nfs/dbraw/zinc/16/16/65/883161665.db2.gz VUOAKVLNOZNONP-STWLZBDKSA-N 0 3 408.586 4.001 20 0 HIADHN COc1cc(CN[C@@H](CC2CC2)c2ccc(Cl)cc2)ccc1OCC(=O)N(C)C ZINC000469078812 883164469 /nfs/dbraw/zinc/16/44/69/883164469.db2.gz XQOFRQBQEZECQA-FQEVSTJZSA-N 0 3 416.949 4.447 20 0 HIADHN COc1cc(Br)ccc1[C@H](C)NCc1cn(-c2ccncc2)nc1C ZINC000469100437 883191388 /nfs/dbraw/zinc/19/13/88/883191388.db2.gz XFCOKNIHQPQDAS-AWEZNQCLSA-N 0 3 401.308 4.198 20 0 HIADHN Cc1cn(-c2c(F)cccc2F)nc1C(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000469108598 883201247 /nfs/dbraw/zinc/20/12/47/883201247.db2.gz VPFVRLDWCAZUBX-UHFFFAOYSA-N 0 3 424.495 4.196 20 0 HIADHN COc1ccc2c(c1)[C@@H](N[C@@H]1CCCN(Cc3ccc(F)cc3F)C1=O)CCC2 ZINC000469113090 883204038 /nfs/dbraw/zinc/20/40/38/883204038.db2.gz VOHNTRBFKXSSRL-FCHUYYIVSA-N 0 3 400.469 4.132 20 0 HIADHN CN(C)CCN(C(=O)c1ccc(Sc2ccccc2Cl)nn1)c1ccccc1 ZINC000469202033 883300862 /nfs/dbraw/zinc/30/08/62/883300862.db2.gz FLMMWNQZCQMZCT-UHFFFAOYSA-N 0 3 412.946 4.490 20 0 HIADHN COc1cc(Br)ccc1[C@H](C)N[C@@H](C)Cn1cc(Br)cn1 ZINC000469226365 883326162 /nfs/dbraw/zinc/32/61/62/883326162.db2.gz STTPGGMZULHGCM-QWRGUYRKSA-N 0 3 417.145 4.156 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@@H](C)N[C@H](C)c2cnn(C(C)C)c2C)CC1 ZINC000469240327 883338657 /nfs/dbraw/zinc/33/86/57/883338657.db2.gz PTQIYXKLGWMHOT-QZTJIDSGSA-N 0 3 401.574 4.465 20 0 HIADHN COc1ccc([C@H](NCCc2ccccc2F)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000469267645 883364115 /nfs/dbraw/zinc/36/41/15/883364115.db2.gz NSZPNOQNZPLDRS-QHCPKHFHSA-N 0 3 413.514 4.160 20 0 HIADHN CCN(C(=O)c1ccc(OCC(F)(F)F)cn1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000469294501 883391208 /nfs/dbraw/zinc/39/12/08/883391208.db2.gz RFBJYIMAGUUYFS-FUHWJXTLSA-N 0 3 421.463 4.320 20 0 HIADHN CCSCc1ccccc1C(=O)N1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000469320092 883425274 /nfs/dbraw/zinc/42/52/74/883425274.db2.gz ZUKSIKHATJUQRC-OALUTQOASA-N 0 3 404.620 4.291 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N[C@@H]3C[C@@H]3c3ccccc3C(F)(F)F)cc2)CC1 ZINC000469322866 883427611 /nfs/dbraw/zinc/42/76/11/883427611.db2.gz SBXATQKZEBZOFT-TZIWHRDSSA-N 0 3 417.475 4.133 20 0 HIADHN COCc1ccc([C@@H]2CCCN2C(=O)N[C@H](CN(C)Cc2ccccc2)C(C)C)o1 ZINC000469432572 883618898 /nfs/dbraw/zinc/61/88/98/883618898.db2.gz SVNDWNGXZMWXFA-YADHBBJMSA-N 0 3 413.562 4.429 20 0 HIADHN Cc1cnc([C@H](NC(=O)N[C@H](CN(C)Cc2ccccc2)C(C)C)C2CC2)s1 ZINC000469438759 883627675 /nfs/dbraw/zinc/62/76/75/883627675.db2.gz OHDBVKJYATXOQN-WOJBJXKFSA-N 0 3 400.592 4.358 20 0 HIADHN COc1ccc(COC[C@@H](O)CN2CCC(=Cc3ccc(F)c(F)c3)CC2)cc1 ZINC000469445866 883640701 /nfs/dbraw/zinc/64/07/01/883640701.db2.gz HTRQQEBXPKIMNU-FQEVSTJZSA-N 0 3 403.469 4.030 20 0 HIADHN C[C@@H](N(CC(=O)Nc1ccccc1SCC(N)=O)Cc1ccccc1)C(C)(C)C ZINC000469446584 883640783 /nfs/dbraw/zinc/64/07/83/883640783.db2.gz PWLHNCMBEDYZOE-QGZVFWFLSA-N 0 3 413.587 4.139 20 0 HIADHN CC(=O)Nc1cc(NC(=O)N[C@H](CN(C)Cc2ccccc2)C(C)C)ccc1F ZINC000469473995 883701255 /nfs/dbraw/zinc/70/12/55/883701255.db2.gz HAIMHSLMPKNJMB-OAQYLSRUSA-N 0 3 400.498 4.062 20 0 HIADHN CC(C)C(=O)N(C)Cc1ccc(C(=O)N[C@H](CN(C)Cc2ccccc2)C(C)C)cc1 ZINC000469477746 883707920 /nfs/dbraw/zinc/70/79/20/883707920.db2.gz JSJFOOGJOHLQBP-XMMPIXPASA-N 0 3 423.601 4.187 20 0 HIADHN C[C@@H](c1ccccc1Br)N(C)C(=O)CC1(N2CCOCC2)CCCC1 ZINC000503639881 912742505 /nfs/dbraw/zinc/74/25/05/912742505.db2.gz QEYBRQVKQFBTEN-INIZCTEOSA-N 0 3 409.368 4.004 20 0 HIADHN C[C@@H](CC(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1)c1c[nH]c2ccccc21 ZINC000469531357 883802054 /nfs/dbraw/zinc/80/20/54/883802054.db2.gz PUJONBFEHLLGML-SLFFLAALSA-N 0 3 411.590 4.399 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N[C@@H](C)c3nc4ccccc4n3C(C)C)cc2)CC1 ZINC000469551222 883810330 /nfs/dbraw/zinc/81/03/30/883810330.db2.gz DMHPORKPUZVJTL-IBGZPJMESA-N 0 3 419.573 4.250 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(N[C@H](C[N@H+](C)Cc3ccccc3)C(C)C)nc2)n1 ZINC000469550835 883810402 /nfs/dbraw/zinc/81/04/02/883810402.db2.gz ZLDXCYREOYNFAK-OAQYLSRUSA-N 0 3 405.546 4.375 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(N[C@H](C[N@@H+](C)Cc3ccccc3)C(C)C)nc2)n1 ZINC000469550835 883810406 /nfs/dbraw/zinc/81/04/06/883810406.db2.gz ZLDXCYREOYNFAK-OAQYLSRUSA-N 0 3 405.546 4.375 20 0 HIADHN CCN(C(=O)c1nn(-c2c(F)cccc2F)cc1C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000469564755 883816528 /nfs/dbraw/zinc/81/65/28/883816528.db2.gz DIUAGMKHTDKSSI-IBGZPJMESA-N 0 3 424.495 4.196 20 0 HIADHN CCN(C(=O)c1cc(C)n(-c2c(F)cccc2F)n1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000469564723 883816831 /nfs/dbraw/zinc/81/68/31/883816831.db2.gz DANUDSKNRIUKAC-IBGZPJMESA-N 0 3 424.495 4.196 20 0 HIADHN CCOc1cc(Cl)ccc1NC(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000469617371 883836236 /nfs/dbraw/zinc/83/62/36/883836236.db2.gz KVPFYMYMNWOOHW-UHFFFAOYSA-N 0 3 417.937 4.017 20 0 HIADHN CCN(CCOc1ccc(Br)cc1)C(=O)c1cccc(CN(C)C)c1 ZINC000469626220 883839388 /nfs/dbraw/zinc/83/93/88/883839388.db2.gz WQEIHUSWTFSOSJ-UHFFFAOYSA-N 0 3 405.336 4.052 20 0 HIADHN COc1cc(F)c(NC(=O)N[C@H](CN(C)Cc2ccccc2)C(C)C)cc1OC ZINC000469675793 883864455 /nfs/dbraw/zinc/86/44/55/883864455.db2.gz UPGVMDLYTGKTFY-LJQANCHMSA-N 0 3 403.498 4.121 20 0 HIADHN COc1cc(F)c(NC(=O)N[C@@H](CN(C)Cc2ccccc2)C(C)C)cc1OC ZINC000469675792 883864601 /nfs/dbraw/zinc/86/46/01/883864601.db2.gz UPGVMDLYTGKTFY-IBGZPJMESA-N 0 3 403.498 4.121 20 0 HIADHN Cc1csc2nc(CN(C)C[C@@H](C)Oc3ccc(Cl)c(Cl)c3)cc(=O)n12 ZINC000469734686 883892912 /nfs/dbraw/zinc/89/29/12/883892912.db2.gz QDIBITIRXHTVJT-GFCCVEGCSA-N 0 3 412.342 4.271 20 0 HIADHN CCC1(CC)CCCN([C@H](C)C(=O)Nc2c(C)n(C)n(-c3ccccc3)c2=O)CC1 ZINC000469736786 883893848 /nfs/dbraw/zinc/89/38/48/883893848.db2.gz KTCOYYMBMVCMBD-LJQANCHMSA-N 0 3 412.578 4.104 20 0 HIADHN COc1ccc(C(=O)N2CCC(N[C@@H](C)c3csc(C(C)C)n3)CC2)c(OC)c1 ZINC000469776684 883951114 /nfs/dbraw/zinc/95/11/14/883951114.db2.gz RZMSUXWDQOTBBW-HNNXBMFYSA-N 0 3 417.575 4.239 20 0 HIADHN Cc1cc(NC(=O)c2ccoc2Br)cc(N2CCN(C(C)C)CC2)c1 ZINC000469851964 884036386 /nfs/dbraw/zinc/03/63/86/884036386.db2.gz DJHNTBQKSISZGM-UHFFFAOYSA-N 0 3 406.324 4.133 20 0 HIADHN CCC[C@@H]1C[C@@H](C(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)CCO1 ZINC000503678463 912785015 /nfs/dbraw/zinc/78/50/15/912785015.db2.gz GEALXJNUWYQBFE-FDFHNCONSA-N 0 3 410.562 4.172 20 0 HIADHN CCOc1ccc(F)c(NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)c1F ZINC000469934761 884129714 /nfs/dbraw/zinc/12/97/14/884129714.db2.gz KOEBQIGULFYQEB-UHFFFAOYSA-N 0 3 421.410 4.290 20 0 HIADHN C[C@@H](CC(=O)NC1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1)C(=O)c1cccc(F)c1 ZINC000469961605 884168403 /nfs/dbraw/zinc/16/84/03/884168403.db2.gz HFFFJXYBZYXOAA-BOSCWZPRSA-N 0 3 408.517 4.346 20 0 HIADHN CC(C)[C@H](NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1)c1nc2ccccc2[nH]1 ZINC000503698147 912802222 /nfs/dbraw/zinc/80/22/22/912802222.db2.gz IESFMRZWRNZLQW-KNQAVFIVSA-N 0 3 405.546 4.224 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@H]2NC(=O)N(CCN(C)C)Cc2ccc(F)cc2)cc1 ZINC000470048518 884292739 /nfs/dbraw/zinc/29/27/39/884292739.db2.gz WYOWMZRLPRKTEM-PKTZIBPZSA-N 0 3 413.537 4.128 20 0 HIADHN C[C@@H](CO)N1CCCN(C(=O)c2cc(F)ccc2-c2cccc(C(F)(F)F)c2)CC1 ZINC000470050070 884294172 /nfs/dbraw/zinc/29/41/72/884294172.db2.gz ZLXNUJMRGAARSG-HNNXBMFYSA-N 0 3 424.438 4.040 20 0 HIADHN Cc1cccc(NC(=O)CCCN2CCN(c3ccccc3)CC2)c1Br ZINC000470114686 884375513 /nfs/dbraw/zinc/37/55/13/884375513.db2.gz VFIQSRXEOWWSCJ-UHFFFAOYSA-N 0 3 416.363 4.298 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)C1(OCc2ccccc2)CCOCC1 ZINC000470168360 884446395 /nfs/dbraw/zinc/44/63/95/884446395.db2.gz ZOQIVONIOYUPLQ-DEOSSOPVSA-N 0 3 424.585 4.025 20 0 HIADHN O=C(NC[C@H]1CCCCN1C1CC1)c1ccc(Br)cc1C(F)(F)F ZINC000470170080 884448032 /nfs/dbraw/zinc/44/80/32/884448032.db2.gz OFQTYSOOKWVVPP-CYBMUJFWSA-N 0 3 405.258 4.215 20 0 HIADHN CC[C@@H]1CN(C(=O)c2ccc(N3CCN(CC)CC3)cc2)CC[C@H]1c1ccccc1 ZINC000470192864 884497086 /nfs/dbraw/zinc/49/70/86/884497086.db2.gz CWWSXDIUYHECBX-PXDATVDWSA-N 0 3 405.586 4.484 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@H]2NC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)cc1 ZINC000470268593 884620872 /nfs/dbraw/zinc/62/08/72/884620872.db2.gz NHFSLNRPCWBQMZ-QTJGBDASSA-N 0 3 410.533 4.383 20 0 HIADHN C[C@H](NCCc1cccc2[nH]ccc21)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000503885553 912850690 /nfs/dbraw/zinc/85/06/90/912850690.db2.gz LLCQNCVYJSIWKQ-NSHDSACASA-N 0 3 412.342 4.015 20 0 HIADHN C[C@@H](CO)N1CCCN(C(=O)Nc2ccc(F)cc2-c2ccc(Cl)cc2)CC1 ZINC000470343567 884732953 /nfs/dbraw/zinc/73/29/53/884732953.db2.gz QMZBQFMATNOIKX-HNNXBMFYSA-N 0 3 405.901 4.067 20 0 HIADHN O=C(CC1CCCC1)NCCCCN1CCN(c2cccc(C(F)(F)F)c2)CC1 ZINC000503915768 912862562 /nfs/dbraw/zinc/86/25/62/912862562.db2.gz HAJRHJKNZFESQX-UHFFFAOYSA-N 0 3 411.512 4.304 20 0 HIADHN C[C@H]1CN(CCCCNC(=O)Nc2ccc(Br)cc2Cl)C[C@H](C)O1 ZINC000470438798 884836429 /nfs/dbraw/zinc/83/64/29/884836429.db2.gz PROUFYNHCQIYLM-STQMWFEESA-N 0 3 418.763 4.113 20 0 HIADHN O=C(NC1CCCCC1)C1CCN(Cc2c[nH]nc2-c2ccc(Cl)cc2)CC1 ZINC000512374116 921113855 /nfs/dbraw/zinc/11/38/55/921113855.db2.gz DMMZHHDNGMPRGR-UHFFFAOYSA-N 0 3 400.954 4.391 20 0 HIADHN CCc1ccccc1NC(=O)C[C@H](C)N[C@@H](Cn1ccccc1=O)c1ccccc1 ZINC000503937327 912872854 /nfs/dbraw/zinc/87/28/54/912872854.db2.gz MIJDBIWOTQISCG-CVDCTZTESA-N 0 3 403.526 4.159 20 0 HIADHN COc1cccc2c1CC[C@H]2NC(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000470594421 885015899 /nfs/dbraw/zinc/01/58/99/885015899.db2.gz KVJDHRNQQUMXFT-OAQYLSRUSA-N 0 3 411.571 4.096 20 0 HIADHN C[C@@H](CO)N1CCCN(C(=O)Nc2ccccc2Oc2ccccc2Cl)CC1 ZINC000470604497 885034004 /nfs/dbraw/zinc/03/40/04/885034004.db2.gz DAAUXSCUAFPQML-INIZCTEOSA-N 0 3 403.910 4.053 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)N[C@H]2CCSc3c(F)cccc32)CC1 ZINC000503985316 912897015 /nfs/dbraw/zinc/89/70/15/912897015.db2.gz ICWCJOPVNGGSQS-IBGZPJMESA-N 0 3 403.523 4.262 20 0 HIADHN CCOC(=O)c1cc2cc(C(=O)N(C)[C@H]3CCCN(Cc4ccccc4)C3)ccc2[nH]1 ZINC000470678819 885110489 /nfs/dbraw/zinc/11/04/89/885110489.db2.gz MJAQOAFSTVWFFE-NRFANRHFSA-N 0 3 419.525 4.081 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)Nc1cccc(COc2cccc(F)c2)c1 ZINC000503991270 912900881 /nfs/dbraw/zinc/90/08/81/912900881.db2.gz DPHKLWAKEMYONM-UHFFFAOYSA-N 0 3 422.504 4.395 20 0 HIADHN O=C(c1ccc(Cl)cc1)N1CCCN(C[C@H](O)Cc2ccc3ccccc3c2)CC1 ZINC000470720559 885164428 /nfs/dbraw/zinc/16/44/28/885164428.db2.gz WNEDCJDONCIBLA-XMMPIXPASA-N 0 3 422.956 4.245 20 0 HIADHN C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470723144 885171094 /nfs/dbraw/zinc/17/10/94/885171094.db2.gz NWJJXIIHCUTYRA-KNQAVFIVSA-N 0 3 423.557 4.042 20 0 HIADHN COc1ccc(OC)c([C@H](C)NC(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000470745385 885209085 /nfs/dbraw/zinc/20/90/85/885209085.db2.gz PCZIMASQXUNWOT-AZUAARDMSA-N 0 3 411.546 4.071 20 0 HIADHN CN(C(=O)NCc1ccnc(OC2CCCC2)c1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470751732 885216822 /nfs/dbraw/zinc/21/68/22/885216822.db2.gz PJCSMDIQRUOLQG-JOCHJYFZSA-N 0 3 422.573 4.209 20 0 HIADHN CN(Cc1cccc(OCC(F)(F)F)c1)C[C@@H]1C[C@H](F)CN1Cc1nccs1 ZINC000470810414 885298506 /nfs/dbraw/zinc/29/85/06/885298506.db2.gz GLAYWYMFAAOLNG-HOTGVXAUSA-N 0 3 417.472 4.129 20 0 HIADHN CCOC(=O)c1c2c(sc1NC(=O)[C@H](C)c1cccnc1)C(C)(C)NC(C)(C)C2 ZINC000470829911 885320227 /nfs/dbraw/zinc/32/02/27/885320227.db2.gz GBLFUARAUXNKSO-CYBMUJFWSA-N 0 3 415.559 4.221 20 0 HIADHN CN(C(=O)NC[C@@H]1CCCO[C@H]1C(C)(C)C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470882249 885376209 /nfs/dbraw/zinc/37/62/09/885376209.db2.gz DCXOBQXHIFUWKA-FDFHNCONSA-N 0 3 401.595 4.134 20 0 HIADHN C[C@@H]1CN(C(=O)NC[C@@H](c2cccs2)N2CCCC2)C[C@@H](c2ccsc2)O1 ZINC000470897081 885395755 /nfs/dbraw/zinc/39/57/55/885395755.db2.gz KCJFGQHGVMHJSP-NJAFHUGGSA-N 0 3 405.589 4.118 20 0 HIADHN CN(C(=O)NCCCc1c[nH]c2ccccc12)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470897691 885397454 /nfs/dbraw/zinc/39/74/54/885397454.db2.gz OKZDYKOIZVZXBJ-QFIPXVFZSA-N 0 3 404.558 4.407 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)N(CCO)Cc1ccc(Cl)c(Cl)c1 ZINC000504029422 912931797 /nfs/dbraw/zinc/93/17/97/912931797.db2.gz BJVBFSXHINAOFW-UHFFFAOYSA-N 0 3 421.324 4.436 20 0 HIADHN CCCN(Cc1csc(-c2c(C)c(C)nn(C)c2=O)n1)[C@@H]1CCc2ccccc2C1 ZINC000470959382 885457858 /nfs/dbraw/zinc/45/78/58/885457858.db2.gz LKSHOLMNLXCHGO-OAQYLSRUSA-N 0 3 422.598 4.290 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)N1CC[C@H](c2ccccc2F)C1 ZINC000504034221 912937160 /nfs/dbraw/zinc/93/71/60/912937160.db2.gz HKFAANCEXUJHID-IBGZPJMESA-N 0 3 413.562 4.438 20 0 HIADHN O=C1[C@H](N2CCCCC[C@@H]2c2ccc(C(F)(F)F)cc2)CCN1C1CCOCC1 ZINC000471005110 885505156 /nfs/dbraw/zinc/50/51/56/885505156.db2.gz JSXIMUIFCLRQIS-WOJBJXKFSA-N 0 3 410.480 4.402 20 0 HIADHN CN1CCN(CC(=O)N[C@H](c2cccs2)c2ccc(F)cc2)C2(CCCCC2)C1 ZINC000471036090 885542935 /nfs/dbraw/zinc/54/29/35/885542935.db2.gz VQORBNJNSLEMJL-QFIPXVFZSA-N 0 3 415.578 4.043 20 0 HIADHN CCOc1cc(F)ccc1NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000471216447 885789594 /nfs/dbraw/zinc/78/95/94/885789594.db2.gz PWNWDYDMHZEWEF-UHFFFAOYSA-N 0 3 403.420 4.151 20 0 HIADHN CC(C)N(C)c1cccc(NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)c1 ZINC000471294446 885879751 /nfs/dbraw/zinc/87/97/51/885879751.db2.gz YPLXEKZLUNAKPW-UHFFFAOYSA-N 0 3 412.500 4.458 20 0 HIADHN CSc1nc(C(C)(C)C)nc(C)c1C(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000471330447 885929056 /nfs/dbraw/zinc/92/90/56/885929056.db2.gz KKJXOYWSTSNGAG-WMZOPIPTSA-N 0 3 412.603 4.370 20 0 HIADHN C[C@@H](NC(=O)N(Cc1ccccc1)C1CCN(C)CC1)c1ccccc1-n1cccn1 ZINC000471489547 886188643 /nfs/dbraw/zinc/18/86/43/886188643.db2.gz VOVMOFCZZCNLRI-HXUWFJFHSA-N 0 3 417.557 4.239 20 0 HIADHN CCN1CCC[C@@H](CN(C)C(=O)Nc2cc(Cl)ccc2C)[C@@H]1c1cnn(C)c1 ZINC000471493949 886194277 /nfs/dbraw/zinc/19/42/77/886194277.db2.gz VREMEVTVNKDCNA-OXJNMPFZSA-N 0 3 403.958 4.319 20 0 HIADHN CCN1CCC[C@@H](CN(C)C(=O)Nc2ccccc2C(F)(F)F)[C@@H]1c1cnn(C)c1 ZINC000471497809 886198753 /nfs/dbraw/zinc/19/87/53/886198753.db2.gz ZACUVSUQEWDPBE-HNAYVOBHSA-N 0 3 423.483 4.376 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)NCC1CCN(c2ccccc2)CC1 ZINC000471507414 886209633 /nfs/dbraw/zinc/20/96/33/886209633.db2.gz MSRJCVRQUYXQSU-NRFANRHFSA-N 0 3 412.603 4.101 20 0 HIADHN CCCCCn1nc(C(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)c2ccccc2c1=O ZINC000471528010 886230386 /nfs/dbraw/zinc/23/03/86/886230386.db2.gz DRCSDAUAPNBPIW-JPYJTQIMSA-N 0 3 420.557 4.008 20 0 HIADHN O=C(N[C@H](c1cccs1)C1CC1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000471542216 886248649 /nfs/dbraw/zinc/24/86/49/886248649.db2.gz SMWYSKPBKAOUEP-DQPZFDDXSA-N 0 3 401.498 4.304 20 0 HIADHN COc1ccc(CCC(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)cc1Br ZINC000471543119 886250190 /nfs/dbraw/zinc/25/01/90/886250190.db2.gz XDDLFEPJGPNDEB-BTYIYWSLSA-N 0 3 419.363 4.198 20 0 HIADHN CC[C@@H](NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1ccc(OC)cc1 ZINC000471544676 886250903 /nfs/dbraw/zinc/25/09/03/886250903.db2.gz CBBSHWWIDDVDQD-FAFZWHIHSA-N 0 3 413.484 4.251 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CC[C@@H](C(F)(F)F)[C@H]1C)c1cccc(OC)c1 ZINC000471546006 886253273 /nfs/dbraw/zinc/25/32/73/886253273.db2.gz HSCIEVWZSMYKOS-ZTFGCOKTSA-N 0 3 401.473 4.060 20 0 HIADHN CCOCCC1(CNC(=O)Nc2ccc(N3CCN(CC)CC3)cc2C)CCCC1 ZINC000471604551 886318170 /nfs/dbraw/zinc/31/81/70/886318170.db2.gz XQHIIKKVIKIJCZ-UHFFFAOYSA-N 0 3 416.610 4.245 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)N[C@H]1C[C@@H]1c1ccccc1OC(F)F)c1ccco1 ZINC000504128638 913032800 /nfs/dbraw/zinc/03/28/00/913032800.db2.gz PFCCZPQKERTLSF-SIXLDLHFSA-N 0 3 407.461 4.166 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)Cc3csc(-c4cccs4)n3)c2)CC1 ZINC000471644234 886360309 /nfs/dbraw/zinc/36/03/09/886360309.db2.gz UKYRLWGTRGUQML-UHFFFAOYSA-N 0 3 412.584 4.195 20 0 HIADHN CSc1nc(C(C)(C)C)nc(C)c1C(=O)NC[C@@H](c1ccc(C)cc1)N(C)C ZINC000471756741 886488302 /nfs/dbraw/zinc/48/83/02/886488302.db2.gz PMCGCPCBYGJBNJ-KRWDZBQOSA-N 0 3 400.592 4.146 20 0 HIADHN O=C(NCc1ccccc1C(F)(F)F)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000471770108 886503070 /nfs/dbraw/zinc/50/30/70/886503070.db2.gz LIAMIZBYMIZIDP-UHFFFAOYSA-N 0 3 423.401 4.310 20 0 HIADHN Cc1cn(-c2ccccc2)nc1C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000471775124 886508300 /nfs/dbraw/zinc/50/83/00/886508300.db2.gz YTDGTBKTIXQROG-UHFFFAOYSA-N 0 3 406.555 4.024 20 0 HIADHN O=C(NCCc1ccccc1OC(F)F)NC[C@@H](c1cccs1)N1CCCC1 ZINC000471832550 886585099 /nfs/dbraw/zinc/58/50/99/886585099.db2.gz AOVWFKKFXIAVOP-INIZCTEOSA-N 0 3 409.502 4.028 20 0 HIADHN Cc1ccc(NC(=O)c2ccc(=O)n(Cc3csc(C(C)C)n3)c2)c(CN(C)C)c1 ZINC000471831754 886585590 /nfs/dbraw/zinc/58/55/90/886585590.db2.gz MPJLOEWEBKAXDS-UHFFFAOYSA-N 0 3 424.570 4.099 20 0 HIADHN COc1ccc(OC)c(NC(=O)[C@H](C)N[C@H]2C[C@H](OCc3ccccc3)C2(C)C)c1 ZINC000471860751 886635613 /nfs/dbraw/zinc/63/56/13/886635613.db2.gz YIWUIQZVBRMOLR-SSKFGXFMSA-N 0 3 412.530 4.004 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)c1c(F)cccc1I ZINC000471907717 886691429 /nfs/dbraw/zinc/69/14/29/886691429.db2.gz PQZQXJNHNZULHG-UHFFFAOYSA-N 0 3 412.246 4.053 20 0 HIADHN Cc1cc(-c2nc(C3CC3)no2)ccc1NC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000471925375 886716709 /nfs/dbraw/zinc/71/67/09/886716709.db2.gz RVOZBZVTKQDVGB-LEWJYISDSA-N 0 3 417.513 4.489 20 0 HIADHN CCN(CCCN1CCCC1)C(=O)Nc1ccc(Cl)cc1C(=O)c1ccc[nH]1 ZINC000471940102 886738965 /nfs/dbraw/zinc/73/89/65/886738965.db2.gz ACRSVOKBPUZXFK-UHFFFAOYSA-N 0 3 402.926 4.239 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2cccc3c2CN(c2nccs2)C3)[C@@H]1c1ccccc1 ZINC000471964251 886791694 /nfs/dbraw/zinc/79/16/94/886791694.db2.gz ILQOVKMPWAIMSV-SFTDATJTSA-N 0 3 419.554 4.230 20 0 HIADHN CC(=O)c1ccc(OCCCC(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)cc1 ZINC000504199070 913080338 /nfs/dbraw/zinc/08/03/38/913080338.db2.gz IUIYDFLRGYTWJH-UHFFFAOYSA-N 0 3 423.557 4.217 20 0 HIADHN COC[C@H](C)Oc1ccc(Cl)cc1NC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000471965429 886794197 /nfs/dbraw/zinc/79/41/97/886794197.db2.gz DNYQGCPWLRFSIT-UQASEVPWSA-N 0 3 417.937 4.321 20 0 HIADHN CCCc1c(C(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)[nH]c(C)c1C(C)=O ZINC000504199830 913083148 /nfs/dbraw/zinc/08/31/48/913083148.db2.gz TYRRVPYVJHQLEB-UHFFFAOYSA-N 0 3 410.562 4.261 20 0 HIADHN C[C@@H](CNC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1ccc(F)cc1F ZINC000472004081 886829508 /nfs/dbraw/zinc/82/95/08/886829508.db2.gz XDDRULOKTKGJTG-JQRITLKVSA-N 0 3 419.438 4.173 20 0 HIADHN Cc1noc(-c2ccccc2)c1NC(=O)CCCN1CCN(c2ccccc2)CC1 ZINC000472015769 886837696 /nfs/dbraw/zinc/83/76/96/886837696.db2.gz AJDMYWDMUAXELF-UHFFFAOYSA-N 0 3 404.514 4.191 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2ccc(OCC3CCOCC3)cc2)[C@H]1c1ccccc1 ZINC000472017434 886840138 /nfs/dbraw/zinc/84/01/38/886840138.db2.gz PALNNNCUIULFDL-DHIUTWEWSA-N 0 3 409.530 4.059 20 0 HIADHN Cc1nn(C)c(OCC(F)(F)F)c1CN[C@@H]1C[C@@H](OCc2ccccc2)C1(C)C ZINC000472041878 886858995 /nfs/dbraw/zinc/85/89/95/886858995.db2.gz OQHBYNJPPCCBIV-QZTJIDSGSA-N 0 3 411.468 4.143 20 0 HIADHN Clc1cnc(CNCC2(c3cccc(Br)c3)CCOCC2)s1 ZINC000472055889 886867567 /nfs/dbraw/zinc/86/75/67/886867567.db2.gz QSGSIIPJBIWVPE-UHFFFAOYSA-N 0 3 401.757 4.397 20 0 HIADHN C[C@H]1CCc2ccccc2[C@H]1NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472132709 886925259 /nfs/dbraw/zinc/92/52/59/886925259.db2.gz OSDITBLNGBLHJP-VLNXYBQZSA-N 0 3 409.496 4.415 20 0 HIADHN COc1ccc(OC)c([C@@H]2C[C@@H]2C(=O)N[C@H](CN(C)Cc2ccccc2)C(C)C)c1 ZINC000472253488 887063277 /nfs/dbraw/zinc/06/32/77/887063277.db2.gz DEJROKXTZAIAKG-ACIOBRDBSA-N 0 3 410.558 4.080 20 0 HIADHN COCc1c(Br)cccc1NC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000472314085 887144380 /nfs/dbraw/zinc/14/43/80/887144380.db2.gz LYVDFMMKNHOGFP-MOPGFXCFSA-N 0 3 418.335 4.162 20 0 HIADHN COc1ccc(NC(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)cc1Br ZINC000472319768 887151567 /nfs/dbraw/zinc/15/15/67/887151567.db2.gz MUPVHRVTRCQSAQ-AEFFLSMTSA-N 0 3 404.308 4.025 20 0 HIADHN COc1ccc(NC(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)c(Br)c1 ZINC000472319758 887152284 /nfs/dbraw/zinc/15/22/84/887152284.db2.gz VLAYPEOLHZRTEE-QZTJIDSGSA-N 0 3 404.308 4.025 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2cccc(C[S@](=O)C(C)(C)C)c2)[C@@H]1c1ccccc1 ZINC000472345412 887180441 /nfs/dbraw/zinc/18/04/41/887180441.db2.gz XDYWQJXCXODNAD-WURXVLGASA-N 0 3 413.587 4.301 20 0 HIADHN CCCOC1(CNC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)CCCCC1 ZINC000472443092 887293484 /nfs/dbraw/zinc/29/34/84/887293484.db2.gz GPIRKRXKMWVIJR-UHFFFAOYSA-N 0 3 419.532 4.220 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N1CC[C@H](c2cccc(F)c2)C1 ZINC000472444945 887295088 /nfs/dbraw/zinc/29/50/88/887295088.db2.gz UFKUBGGFFSPKLH-MNNVXMFVSA-N 0 3 413.459 4.130 20 0 HIADHN CN(CC1(c2ccccc2)CC1)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472447208 887298623 /nfs/dbraw/zinc/29/86/23/887298623.db2.gz AAFURLRBEOYGCW-UHFFFAOYSA-N 0 3 409.496 4.165 20 0 HIADHN C[C@H](c1ccccc1F)N(C)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472447544 887299627 /nfs/dbraw/zinc/29/96/27/887299627.db2.gz MVRBUDKGBHUFGP-IUDNXUCKSA-N 0 3 401.448 4.333 20 0 HIADHN C[C@]1(c2ccccc2)CCN(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)C1 ZINC000472447933 887300188 /nfs/dbraw/zinc/30/01/88/887300188.db2.gz GAVUSSGIZYXTPW-GRERDSQWSA-N 0 3 409.496 4.165 20 0 HIADHN COCCCC[C@@H](NC(=O)N(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1)c1ccccc1 ZINC000472464568 887324225 /nfs/dbraw/zinc/32/42/25/887324225.db2.gz PNSNQCFODKEQEU-VXNXHJTFSA-N 0 3 424.589 4.274 20 0 HIADHN Cc1cccc([C@@H]2CCN(C(=O)NC3CC(N4CCC(C(F)(F)F)CC4)C3)C2)c1 ZINC000472470175 887331476 /nfs/dbraw/zinc/33/14/76/887331476.db2.gz ZIYKVUFHIXKUAA-QHGAOEGBSA-N 0 3 409.496 4.299 20 0 HIADHN CN(C(=O)Nc1ccc(OC[C@@H]2CCCO2)cc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000472676727 887531021 /nfs/dbraw/zinc/53/10/21/887531021.db2.gz IHJIBGJWGUBHOV-UPVQGACJSA-N 0 3 423.557 4.373 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1ccc2nc(C(F)(F)F)cn2c1)c1ccsc1 ZINC000472730968 887577250 /nfs/dbraw/zinc/57/72/50/887577250.db2.gz LKQIJPLRWXRSCW-OAHLLOKOSA-N 0 3 410.465 4.228 20 0 HIADHN Cc1ccc(NC(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)cc1C(=O)NC(C)C ZINC000472732856 887578937 /nfs/dbraw/zinc/57/89/37/887578937.db2.gz GXKFGAMLGQUQGU-JOCHJYFZSA-N 0 3 422.573 4.262 20 0 HIADHN CN(C(=O)Nc1cccc(NC(=O)C2CC2)c1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000472750686 887595766 /nfs/dbraw/zinc/59/57/66/887595766.db2.gz NHIVSRLWUKXPHM-QFIPXVFZSA-N 0 3 406.530 4.163 20 0 HIADHN CN(C(=O)Nc1cccc(NC(=O)C2CC2)c1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000472750685 887595995 /nfs/dbraw/zinc/59/59/95/887595995.db2.gz NHIVSRLWUKXPHM-JOCHJYFZSA-N 0 3 406.530 4.163 20 0 HIADHN Cc1ccc(NC(=O)NC[C@@H](c2ccccc2)N(C)C)c(-c2nc(C3CC3)no2)c1 ZINC000472841365 887694972 /nfs/dbraw/zinc/69/49/72/887694972.db2.gz SCWJISUGAFZNHL-FQEVSTJZSA-N 0 3 405.502 4.347 20 0 HIADHN CC1CCN(CCNC(=O)Nc2cc(Cl)ccc2-c2nc(C3CC3)no2)CC1 ZINC000472880282 887730820 /nfs/dbraw/zinc/73/08/20/887730820.db2.gz JMDUCKNOVRYEPL-UHFFFAOYSA-N 0 3 403.914 4.121 20 0 HIADHN C[C@H](CNC(=O)Nc1ccc(F)cc1-c1nc(C2CC2)no1)N(C)Cc1ccccc1 ZINC000472904143 887750144 /nfs/dbraw/zinc/75/01/44/887750144.db2.gz LSIIRWQJZSJQOM-OAHLLOKOSA-N 0 3 423.492 4.395 20 0 HIADHN C[C@H](N[C@H]1CCN(c2ccccc2C(F)(F)F)C1=O)c1ccc(-n2ccnc2)cc1 ZINC000473045407 887868019 /nfs/dbraw/zinc/86/80/19/887868019.db2.gz WZJQXSGCCYYRFM-KXBFYZLASA-N 0 3 414.431 4.347 20 0 HIADHN COc1ccc([C@H](CNC(=O)C[C@@H](c2cccs2)n2cccc2)N2CCCC2)cc1 ZINC000473291108 888045284 /nfs/dbraw/zinc/04/52/84/888045284.db2.gz JRJZHCFYOXNTQO-VXKWHMMOSA-N 0 3 423.582 4.491 20 0 HIADHN CC(C)N1CCC[C@H](N[C@@H](Cc2ccccn2)c2ccc(Br)cc2)C1=O ZINC000473444639 888166715 /nfs/dbraw/zinc/16/67/15/888166715.db2.gz ZMJOBIHIFONALP-PMACEKPBSA-N 0 3 416.363 4.117 20 0 HIADHN C[C@H](CCN1CCN(C)CC1)NC(=O)Nc1ccccc1-c1nc2ccccc2s1 ZINC000473490151 888211586 /nfs/dbraw/zinc/21/15/86/888211586.db2.gz DUUPNOCGVWNOJV-QGZVFWFLSA-N 0 3 423.586 4.111 20 0 HIADHN Cc1c(C(=O)N2CC[C@@]3(C2)CCCN(Cc2ccccc2)C3)oc2c1C(=O)CCC2 ZINC000473494676 888217439 /nfs/dbraw/zinc/21/74/39/888217439.db2.gz BDBPMSVDMHDHGO-VWLOTQADSA-N 0 3 406.526 4.235 20 0 HIADHN C[C@@H](Oc1ccc(F)cc1Cl)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473512280 888241164 /nfs/dbraw/zinc/24/11/64/888241164.db2.gz JTSANPXUHXJNOG-VCANKDNSSA-N 0 3 422.850 4.168 20 0 HIADHN COc1ccc(SCCC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cc1 ZINC000473512601 888241857 /nfs/dbraw/zinc/24/18/57/888241857.db2.gz KKUNVMIQMDPMSG-UHFFFAOYSA-N 0 3 416.509 4.099 20 0 HIADHN CCN(c1ccc(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cc1)C(C)C ZINC000473516853 888248920 /nfs/dbraw/zinc/24/89/20/888248920.db2.gz FDDHKKMJXZTLLH-UHFFFAOYSA-N 0 3 411.512 4.456 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1cnc(-c2ccccc2)s1 ZINC000473518207 888250730 /nfs/dbraw/zinc/25/07/30/888250730.db2.gz CQDQPRZVANJZTO-UHFFFAOYSA-N 0 3 409.477 4.345 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)[C@@H]1C[C@H]1c1ccccc1Cl ZINC000473519187 888251256 /nfs/dbraw/zinc/25/12/56/888251256.db2.gz BCSYOGHHEKLVNN-YQEWQEHLSA-N 0 3 400.872 4.365 20 0 HIADHN CSCc1cc(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)ccc1F ZINC000473518890 888251459 /nfs/dbraw/zinc/25/14/59/888251459.db2.gz FUKUYRSAVKLURX-UHFFFAOYSA-N 0 3 404.473 4.224 20 0 HIADHN COc1ccc(S[C@H](C)C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cc1 ZINC000473518620 888251511 /nfs/dbraw/zinc/25/15/11/888251511.db2.gz AKNPSKNFIICTHL-IUDNXUCKSA-N 0 3 416.509 4.097 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)[C@H]1C[C@]12CCCc1ccccc12 ZINC000473520145 888252974 /nfs/dbraw/zinc/25/29/74/888252974.db2.gz IHTGQLLVOHPPEZ-WJTCQHJGSA-N 0 3 406.492 4.202 20 0 HIADHN C[C@H](Cc1cccc(Cl)c1)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473522090 888256675 /nfs/dbraw/zinc/25/66/75/888256675.db2.gz SEAIREROCOLTDX-NLNFPOJYSA-N 0 3 402.888 4.440 20 0 HIADHN CCSCc1ccccc1C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473522171 888257119 /nfs/dbraw/zinc/25/71/19/888257119.db2.gz PSZHFMYKWQVWKV-UHFFFAOYSA-N 0 3 400.510 4.475 20 0 HIADHN CC[C@H](Oc1ccccc1Cl)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473524669 888259555 /nfs/dbraw/zinc/25/95/55/888259555.db2.gz PIIFPHQVEJXWRI-DQPZFDDXSA-N 0 3 418.887 4.419 20 0 HIADHN Cc1ccc2[nH]cc(CCC(=O)NC3CC(N4CCC(C(F)(F)F)CC4)C3)c2c1 ZINC000473526350 888263613 /nfs/dbraw/zinc/26/36/13/888263613.db2.gz MBTSFCQYNYDNCK-UHFFFAOYSA-N 0 3 407.480 4.330 20 0 HIADHN Cn1cc(CCC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)c2ccccc21 ZINC000473530546 888269065 /nfs/dbraw/zinc/26/90/65/888269065.db2.gz ZNNKSOBHZSRNMI-UHFFFAOYSA-N 0 3 407.480 4.032 20 0 HIADHN COCCC[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000473537065 888276759 /nfs/dbraw/zinc/27/67/59/888276759.db2.gz YZENITPSZQOFES-VWNXMTODSA-N 0 3 412.549 4.192 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)N[C@@H](CC(C)(C)C)c1ccc(F)cc1 ZINC000504423237 913239023 /nfs/dbraw/zinc/23/90/23/913239023.db2.gz XLWCWNLBOJDRKQ-NRFANRHFSA-N 0 3 400.542 4.471 20 0 HIADHN CC(=O)Nc1ccc(C)c(C(=O)N[C@@H](CN2CCc3ccccc3C2)C(C)(C)C)c1 ZINC000473647099 888394565 /nfs/dbraw/zinc/39/45/65/888394565.db2.gz XMPKHJRVBJHYOW-QHCPKHFHSA-N 0 3 407.558 4.156 20 0 HIADHN CC[C@@H](C)Sc1ccc(NC(=O)NC(C)(C)CCN2CCN(C)CC2)c(C)c1 ZINC000473654364 888403799 /nfs/dbraw/zinc/40/37/99/888403799.db2.gz OASDQXDMCXHZJN-GOSISDBHSA-N 0 3 406.640 4.423 20 0 HIADHN C[C@H](CCN1CCN(C)CC1)NC(=O)Nc1cccc(CSC2CCCCC2)c1 ZINC000473689795 888462323 /nfs/dbraw/zinc/46/23/23/888462323.db2.gz IRCKWFUGZMWKJW-LJQANCHMSA-N 0 3 418.651 4.400 20 0 HIADHN CC(C)c1cccc2c1CCN(C(=O)NCc1ccccc1CN1CCC(O)CC1)C2 ZINC000473743265 888525143 /nfs/dbraw/zinc/52/51/43/888525143.db2.gz KBNLLSSRVCQBCV-UHFFFAOYSA-N 0 3 421.585 4.035 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)NCc3ccccc3OC3CCC3)c2)CC1 ZINC000473809866 888634398 /nfs/dbraw/zinc/63/43/98/888634398.db2.gz RMLONEDQJLVYSY-UHFFFAOYSA-N 0 3 408.546 4.082 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)NC[C@H]3CCC[C@@H](C(F)(F)F)C3)c2)CC1 ZINC000473810366 888634842 /nfs/dbraw/zinc/63/48/42/888634842.db2.gz SOJPLMKVPHNCBX-DLBZAZTESA-N 0 3 412.500 4.319 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)NCc1ccsc1Br)c1ccco1 ZINC000504459548 913264260 /nfs/dbraw/zinc/26/42/60/913264260.db2.gz ZZRRFPJYRZAVLP-WCQYABFASA-N 0 3 400.342 4.032 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@H](C[C@H]3CCOC3)c3ccccc3)c2)CC1 ZINC000473819969 888649775 /nfs/dbraw/zinc/64/97/75/888649775.db2.gz PBCBRJOUNFPVQJ-HYBUGGRVSA-N 0 3 422.573 4.118 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)Nc3cc(-c4ncco4)ccc3C)c2)CC1 ZINC000473819863 888650174 /nfs/dbraw/zinc/65/01/74/888650174.db2.gz TVJGYRHXSRXNSM-UHFFFAOYSA-N 0 3 405.502 4.436 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@@H]3CCOc4c(Cl)cccc43)c2)CC1 ZINC000473820659 888650207 /nfs/dbraw/zinc/65/02/07/888650207.db2.gz WJERVHUIQQDRJM-HXUWFJFHSA-N 0 3 414.937 4.127 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)Nc3ccc(OCC(F)F)cc3)c2)CC1 ZINC000473820601 888650277 /nfs/dbraw/zinc/65/02/77/888650277.db2.gz VVFAQTJXWMFYKQ-UHFFFAOYSA-N 0 3 404.461 4.116 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CCSC[C@@H]3c3ccccc3)c2)CC1 ZINC000473835484 888671815 /nfs/dbraw/zinc/67/18/15/888671815.db2.gz DLCWUDJMBJHLDO-JOCHJYFZSA-N 0 3 410.587 4.151 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)NC[C@H]3CCCC[C@@H]3C(F)(F)F)c2)CC1 ZINC000473835061 888672068 /nfs/dbraw/zinc/67/20/68/888672068.db2.gz HFEHKVNYHRPJHK-APWZRJJASA-N 0 3 412.500 4.319 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@@H](C)c3cccc(OC(F)F)c3)c2)CC1 ZINC000473842336 888685929 /nfs/dbraw/zinc/68/59/29/888685929.db2.gz WWOLDZAOSMTQBH-INIZCTEOSA-N 0 3 418.488 4.313 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)NCC3(Sc4ccccc4)CC3)c2)CC1 ZINC000473843380 888687466 /nfs/dbraw/zinc/68/74/66/888687466.db2.gz ZQQFQKGWNODTIR-UHFFFAOYSA-N 0 3 410.587 4.275 20 0 HIADHN Cc1nc(CC(C)C)c(NC(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)s1 ZINC000473848233 888696705 /nfs/dbraw/zinc/69/67/05/888696705.db2.gz QKRMTNBVCDKOKX-IRXDYDNUSA-N 0 3 422.639 4.393 20 0 HIADHN O=C(N[C@H](c1cccc(Cl)c1)c1ccccn1)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000473880794 888747587 /nfs/dbraw/zinc/74/75/87/888747587.db2.gz BQRUWGSAFSIBJZ-JTHBVZDNSA-N 0 3 420.944 4.398 20 0 HIADHN CN1CCN(CCC(C)(C)NC(=O)N[C@@H](CC(C)(C)C)c2ccc(F)cc2)CC1 ZINC000473897188 888770309 /nfs/dbraw/zinc/77/03/09/888770309.db2.gz TVSAVJOIVHAOFN-FQEVSTJZSA-N 0 3 406.590 4.018 20 0 HIADHN CSc1cccc(C)c1NC(=O)NCCCCN1CCN(c2ccccc2)CC1 ZINC000473989311 888850365 /nfs/dbraw/zinc/85/03/65/888850365.db2.gz LKPFFPJIGSRXLN-UHFFFAOYSA-N 0 3 412.603 4.441 20 0 HIADHN C[C@H](NC(=O)N1CCSC[C@@H]1c1cccc(C(F)(F)F)c1)C1=CCN(C)CC1 ZINC000473998861 888857962 /nfs/dbraw/zinc/85/79/62/888857962.db2.gz CEHPFIIRQFTOML-KBXCAEBGSA-N 0 3 413.509 4.155 20 0 HIADHN C[C@H](NC(=O)NC(C)(C)CCN1CCN(C)CC1)c1ccc(Cl)c2ccccc21 ZINC000474000224 888859301 /nfs/dbraw/zinc/85/93/01/888859301.db2.gz IKIRKSZGWVODLS-KRWDZBQOSA-N 0 3 416.997 4.270 20 0 HIADHN CC(C)C[C@H](NC(=O)NC(C)(C)CCN1CCN(C)CC1)c1ccc(Cl)cc1 ZINC000474030769 888879436 /nfs/dbraw/zinc/87/94/36/888879436.db2.gz FUXYSJYFOPUKCN-FQEVSTJZSA-N 0 3 409.018 4.143 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc(CN[C@H]2CC(C)(C)c3cc(OC)ccc32)cc1 ZINC000474033812 888880827 /nfs/dbraw/zinc/88/08/27/888880827.db2.gz MABICJUVNZFTTL-QFIPXVFZSA-N 0 3 416.587 4.238 20 0 HIADHN COc1ccc2c(c1)C(C)(C)C[C@H]2N[C@@H](C)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000474070457 888898865 /nfs/dbraw/zinc/89/88/65/888898865.db2.gz BJQTZTZLDUCZIZ-YCRPNKLZSA-N 0 3 402.560 4.019 20 0 HIADHN CCCOc1ccc(CN[C@@H](C)c2cccc(N3CCCS3(=O)=O)c2)c(C)c1 ZINC000474101972 888925461 /nfs/dbraw/zinc/92/54/61/888925461.db2.gz BEFDYTXUFJRTJY-SFHVURJKSA-N 0 3 402.560 4.175 20 0 HIADHN CCCS(=O)(=O)NC1CCN(CCCCc2ccc(Cl)c(Cl)c2)CC1 ZINC000474105805 888929483 /nfs/dbraw/zinc/92/94/83/888929483.db2.gz RRRNQGJQVSHKOX-UHFFFAOYSA-N 0 3 407.407 4.110 20 0 HIADHN COc1ccc2nc(CN[C@H]3CCN(c4ccccc4OC(F)F)C3)sc2c1 ZINC000474350182 889226074 /nfs/dbraw/zinc/22/60/74/889226074.db2.gz BEUIEELBUJWCAA-ZDUSSCGKSA-N 0 3 405.470 4.275 20 0 HIADHN Cc1nnc([C@@H]2CCCN(Cc3ccc(OC(F)(F)F)c(Br)c3)C2)[nH]1 ZINC000474387528 889261233 /nfs/dbraw/zinc/26/12/33/889261233.db2.gz BVDSMUTUKDUHAC-GFCCVEGCSA-N 0 3 419.245 4.154 20 0 HIADHN C[C@@H](NC(=O)Nc1cccc(CN2CCCCC2=O)c1)[C@H](c1ccccc1)N(C)C ZINC000474425967 889291470 /nfs/dbraw/zinc/29/14/70/889291470.db2.gz IRDOAECXHSUPOS-WZONZLPQSA-N 0 3 408.546 4.012 20 0 HIADHN C[C@H](N[C@@H]1CCN([C@H](C(=O)OC(C)(C)C)c2ccccc2)C1=O)c1cccs1 ZINC000474431326 889295538 /nfs/dbraw/zinc/29/55/38/889295538.db2.gz HEVXDXKWGYQDMY-WDYCEAGBSA-N 0 3 400.544 4.083 20 0 HIADHN C[C@H](NC(=O)Nc1ccc(OCC2CCOCC2)cc1)[C@@H](c1ccccc1)N(C)C ZINC000474434680 889298932 /nfs/dbraw/zinc/29/89/32/889298932.db2.gz AMHLGPYHWIMBQZ-MBSDFSHPSA-N 0 3 411.546 4.305 20 0 HIADHN CC(C)n1cnnc1-c1ccccc1NC(=O)N[C@H](C)[C@@H](c1ccccc1)N(C)C ZINC000474440374 889305912 /nfs/dbraw/zinc/30/59/12/889305912.db2.gz SBEDNHPRTNUWJY-UTKZUKDTSA-N 0 3 406.534 4.339 20 0 HIADHN FC(F)(F)COCc1ccc(CNCc2ccc(Cl)cc2-n2cncn2)cc1 ZINC000474467502 889330805 /nfs/dbraw/zinc/33/08/05/889330805.db2.gz HQAOVXCGMGPYMQ-UHFFFAOYSA-N 0 3 410.827 4.289 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)c2ccc3nc(C(F)(F)F)cn3c2)CC1 ZINC000474489462 889350054 /nfs/dbraw/zinc/35/00/54/889350054.db2.gz BHZLNXSDVABNHZ-UHFFFAOYSA-N 0 3 416.447 4.090 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)CCCc2cccc(C(F)(F)F)c2)C[C@@H](C)O1 ZINC000474495573 889356486 /nfs/dbraw/zinc/35/64/86/889356486.db2.gz MYGGGBXJDCCVDX-IAGOWNOFSA-N 0 3 400.485 4.034 20 0 HIADHN C[C@H](CNC(=O)c1ccc(NC(=O)Nc2ccccc2)s1)N1CCC[C@H](C)C1 ZINC000474514405 889379833 /nfs/dbraw/zinc/37/98/33/889379833.db2.gz PZUGZIUMXGZHCO-JKSUJKDBSA-N 0 3 400.548 4.242 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N2CC=C(c3cccc(Cl)c3)CC2)CC1 ZINC000474518282 889386684 /nfs/dbraw/zinc/38/66/84/889386684.db2.gz UDXANWAXDTXIBM-UHFFFAOYSA-N 0 3 405.970 4.028 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N2CCC(c3cccc(Cl)c3)CC2)CC1 ZINC000474519208 889388203 /nfs/dbraw/zinc/38/82/03/889388203.db2.gz MNHAIJIXDVHJFQ-UHFFFAOYSA-N 0 3 407.986 4.118 20 0 HIADHN CN1CC[C@@H](NC(=O)N[C@@H]2C[C@H]2c2ccc(Br)s2)[C@H]1c1ccccc1 ZINC000474540411 889416396 /nfs/dbraw/zinc/41/63/96/889416396.db2.gz NVXGZMCHOVJYIZ-ATNYBXOESA-N 0 3 420.376 4.111 20 0 HIADHN Cc1cc(NC(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)ccc1OC1CCOCC1 ZINC000474590659 889459754 /nfs/dbraw/zinc/45/97/54/889459754.db2.gz XXRYXALOAVAOHQ-QFIPXVFZSA-N 0 3 423.557 4.291 20 0 HIADHN C[C@H](CC(=O)Nc1cccc(N2CCCC2)c1)NCc1ccnn1-c1ccc(F)cc1 ZINC000474597017 889465258 /nfs/dbraw/zinc/46/52/58/889465258.db2.gz ISHUDHKWGCRIDZ-GOSISDBHSA-N 0 3 421.520 4.119 20 0 HIADHN Cc1ccccc1-n1nccc1CNC[C@H](O)COc1cccc(Cl)c1Cl ZINC000474631138 889492638 /nfs/dbraw/zinc/49/26/38/889492638.db2.gz MOCUVHZOVFYRCI-INIZCTEOSA-N 0 3 406.313 4.017 20 0 HIADHN Cc1nc2ccccc2n1C1CCN(C(=O)N[C@H](C)CN(C)Cc2ccccc2)CC1 ZINC000474655984 889519990 /nfs/dbraw/zinc/51/99/90/889519990.db2.gz KRDYSZSZRJDGFS-LJQANCHMSA-N 0 3 419.573 4.212 20 0 HIADHN CC(C)c1nc2c([nH]1)C[C@@H](C(=O)NC[C@@H](c1cccc(Cl)c1)N1CCCC1)CC2 ZINC000474789667 889647106 /nfs/dbraw/zinc/64/71/06/889647106.db2.gz AGNXTTWVYFMMOS-UWJYYQICSA-N 0 3 414.981 4.245 20 0 HIADHN CC(C)c1nc2c([nH]1)CC[C@H](C(=O)NC[C@@H](c1cccc(Cl)c1)N1CCCC1)C2 ZINC000474789667 889647110 /nfs/dbraw/zinc/64/71/10/889647110.db2.gz AGNXTTWVYFMMOS-UWJYYQICSA-N 0 3 414.981 4.245 20 0 HIADHN CC(C)c1ccc(-c2nc(C(=O)NC(C)(C)CCN3CCN(C)CC3)cs2)cc1 ZINC000474811405 889664104 /nfs/dbraw/zinc/66/41/04/889664104.db2.gz RIHARJVNVZKHSO-UHFFFAOYSA-N 0 3 414.619 4.079 20 0 HIADHN CN1CCN(CCC(C)(C)NC(=O)CCCCc2ccc(C(C)(C)C)cc2)CC1 ZINC000474814182 889665480 /nfs/dbraw/zinc/66/54/80/889665480.db2.gz BPNIDDRGSGJWER-UHFFFAOYSA-N 0 3 401.639 4.229 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)CCCc2ccc(Cl)c(Cl)c2)CC1 ZINC000474883184 889739142 /nfs/dbraw/zinc/73/91/42/889739142.db2.gz NXLBTSKRSHYTED-UHFFFAOYSA-N 0 3 401.378 4.322 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)[C@H](C)Sc2cc(Cl)ccc2Cl)CC1 ZINC000474891539 889748789 /nfs/dbraw/zinc/74/87/89/889748789.db2.gz OCXODCWZKWWNBO-AWEZNQCLSA-N 0 3 419.418 4.480 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N[C@@H]3CCCc4ccc(F)cc43)c(C)c2)CC1 ZINC000475000908 889852160 /nfs/dbraw/zinc/85/21/60/889852160.db2.gz KGYDCNHLHWAWEX-HSZRJFAPSA-N 0 3 410.537 4.475 20 0 HIADHN CCN(C(=O)Nc1nnc(-c2ccsc2)s1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475007801 889860566 /nfs/dbraw/zinc/86/05/66/889860566.db2.gz RQYHXSKCDBTKRE-QGZVFWFLSA-N 0 3 413.572 4.395 20 0 HIADHN CCN(C(=O)Nc1ccc(N2CCCC2=O)c(F)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475007565 889860934 /nfs/dbraw/zinc/86/09/34/889860934.db2.gz ICOVXJKZSKCYAA-HXUWFJFHSA-N 0 3 424.520 4.081 20 0 HIADHN CCOc1ccc(F)c(NC(=O)N(CC)[C@@H]2CCN(Cc3ccccc3)C2)c1F ZINC000475016271 889870163 /nfs/dbraw/zinc/87/01/63/889870163.db2.gz UMNNDMZTMVATIX-QGZVFWFLSA-N 0 3 403.473 4.492 20 0 HIADHN CN(Cc1ccc(-c2cccc(F)c2F)o1)C[C@@H]1C[C@H](F)CN1Cc1ncccn1 ZINC000475092029 889939446 /nfs/dbraw/zinc/93/94/46/889939446.db2.gz LDSIQAKCSANDLT-HOTGVXAUSA-N 0 3 416.447 4.059 20 0 HIADHN CCN(C(=O)Nc1ccccc1-n1nccc1C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475102150 889950956 /nfs/dbraw/zinc/95/09/56/889950956.db2.gz RGUQMCGINOFUCX-NRFANRHFSA-N 0 3 403.530 4.309 20 0 HIADHN CCN(C(=O)Nc1ccc(C[C@@H](C)C(=O)OC)cc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475109595 889958629 /nfs/dbraw/zinc/95/86/29/889958629.db2.gz LAKIIYBSRZPICK-XXBNENTESA-N 0 3 423.557 4.167 20 0 HIADHN CCc1cnc(CN(C)C(=O)NC[C@H](c2ccccc2)N2CCC(C)CC2)s1 ZINC000475112359 889962826 /nfs/dbraw/zinc/96/28/26/889962826.db2.gz SKIKEANEYACARF-HXUWFJFHSA-N 0 3 400.592 4.320 20 0 HIADHN C[C@@H](NC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1)c1nc(C(C)(C)C)cs1 ZINC000475121950 889979784 /nfs/dbraw/zinc/97/97/84/889979784.db2.gz UOSSPHSJUWIGNI-SJLPKXTDSA-N 0 3 400.592 4.418 20 0 HIADHN CN(C(=O)NCc1ccc(F)cc1C(F)(F)F)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475131672 889995974 /nfs/dbraw/zinc/99/59/74/889995974.db2.gz VIJIDIIBGFFUPC-GOSISDBHSA-N 0 3 409.427 4.260 20 0 HIADHN C[C@H](NC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1)c1ccc(OC(F)F)cc1 ZINC000475145428 890012932 /nfs/dbraw/zinc/01/29/32/890012932.db2.gz XIPCDQUECHIXBE-LPHOPBHVSA-N 0 3 403.473 4.265 20 0 HIADHN CCN(C(=O)N[C@H](c1ccccc1)[C@@H]1CCCO1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475161582 890027987 /nfs/dbraw/zinc/02/79/87/890027987.db2.gz JVUDZCZQKCSRTN-KMDXXIMOSA-N 0 3 407.558 4.213 20 0 HIADHN CCN(C(=O)NCc1ncoc1-c1ccccc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475165598 890030182 /nfs/dbraw/zinc/03/01/82/890030182.db2.gz SIAPXHILORKOKF-NRFANRHFSA-N 0 3 404.514 4.148 20 0 HIADHN CCN(C(=O)N[C@H](C)c1cccc(-n2cccn2)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475172763 890038971 /nfs/dbraw/zinc/03/89/71/890038971.db2.gz IOOJNGKGLFYCRK-HYBUGGRVSA-N 0 3 417.557 4.239 20 0 HIADHN CCC(CC)[C@@H]1C[C@@H](NC(=O)N(CC)[C@@H]2CCN(Cc3ccccc3)C2)CCO1 ZINC000475173285 890039256 /nfs/dbraw/zinc/03/92/56/890039256.db2.gz IZCUIDBOQLWMGW-ZRBLBEILSA-N 0 3 401.595 4.276 20 0 HIADHN CCN(C(=O)NC[C@@H](c1ccccc1)C(C)(C)CO)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475176086 890044339 /nfs/dbraw/zinc/04/43/39/890044339.db2.gz YWQRFJAAIQEUSW-ZEQRLZLVSA-N 0 3 423.601 4.095 20 0 HIADHN C[C@H](CC(=O)N1CCC[C@H](CN2CCN(c3ccccn3)CC2)C1)C1CCCCC1 ZINC000504676117 913414695 /nfs/dbraw/zinc/41/46/95/913414695.db2.gz FYGBEWBABDXNMT-FGZHOGPDSA-N 0 3 412.622 4.049 20 0 HIADHN C[C@H](Oc1cccnc1NC(=O)N(CCN(C)C)Cc1ccco1)c1ccccc1 ZINC000475265068 890158713 /nfs/dbraw/zinc/15/87/13/890158713.db2.gz NSXPGNYGIZMMPZ-SFHVURJKSA-N 0 3 408.502 4.410 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)NC(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000475278512 890173957 /nfs/dbraw/zinc/17/39/57/890173957.db2.gz HNHJSIPGVWYPMW-CYFREDJKSA-N 0 3 417.557 4.158 20 0 HIADHN CN(C(=O)c1cccc(NC(=O)c2cccs2)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475295607 890201546 /nfs/dbraw/zinc/20/15/46/890201546.db2.gz FYQRRDNPUGENHA-OAQYLSRUSA-N 0 3 419.550 4.347 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)[C@@H](C)c3cn(C)c4ccccc34)c(C)c2)CC1 ZINC000475302385 890210241 /nfs/dbraw/zinc/21/02/41/890210241.db2.gz LVQRZCIVMNFDRZ-IBGZPJMESA-N 0 3 404.558 4.371 20 0 HIADHN CN(C(=O)[C@@H]1C[C@H]1c1ccccc1OC(F)(F)F)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475306832 890217876 /nfs/dbraw/zinc/21/78/76/890217876.db2.gz VDHPWTKJQLUWCE-YZGWKJHDSA-N 0 3 418.459 4.422 20 0 HIADHN CN(C(=O)c1cc(C2CC2)nn1-c1ccccc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475307564 890219029 /nfs/dbraw/zinc/21/90/29/890219029.db2.gz DLDJBPHNNYLFPC-JOCHJYFZSA-N 0 3 400.526 4.096 20 0 HIADHN CN(C(=O)CCc1nnc(-c2ccc(Cl)cc2)o1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475308422 890220896 /nfs/dbraw/zinc/22/08/96/890220896.db2.gz PIXCENADKZMGBH-HXUWFJFHSA-N 0 3 424.932 4.056 20 0 HIADHN CN(C(=O)c1ccc(OCc2ccccc2)nc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475314013 890228842 /nfs/dbraw/zinc/22/88/42/890228842.db2.gz GQONQMQMNQPQID-QHCPKHFHSA-N 0 3 401.510 4.007 20 0 HIADHN COC(=O)[C@H]1CCN(Cc2cccc(NC(=O)c3ccc(Cl)cc3)c2)C[C@H]1C ZINC000475376146 890305465 /nfs/dbraw/zinc/30/54/65/890305465.db2.gz WBYXZOVLLJCCPW-QRWLVFNGSA-N 0 3 400.906 4.223 20 0 HIADHN CN(c1ccccc1)c1ccc(C(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)cn1 ZINC000475425861 890346064 /nfs/dbraw/zinc/34/60/64/890346064.db2.gz XQUNVALFOOFEMO-HSZRJFAPSA-N 0 3 400.526 4.196 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)N[C@@H]1C[C@H]1c1ccc(OC(F)F)cc1 ZINC000475519163 890440766 /nfs/dbraw/zinc/44/07/66/890440766.db2.gz BTKLQFXYQQEBIE-VQTJNVASSA-N 0 3 421.463 4.056 20 0 HIADHN COc1cccc([C@@H](CNC(=O)N[C@H](C)c2cc(F)ccc2OC)N2CCCC2)c1 ZINC000504716642 913452179 /nfs/dbraw/zinc/45/21/79/913452179.db2.gz NSDOYNQUTFWYBD-IIBYNOLFSA-N 0 3 415.509 4.040 20 0 HIADHN C[C@@H](NC(=O)Nc1ccc(Br)cc1OC(F)(F)F)C1=CCN(C)CC1 ZINC000475553846 890479560 /nfs/dbraw/zinc/47/95/60/890479560.db2.gz WCAJJJSPORUEAD-SNVBAGLBSA-N 0 3 422.245 4.120 20 0 HIADHN CCc1onc(-c2ccc(Br)cc2)c1C(=O)N1CCCN(C(C)C)CC1 ZINC000475604942 890531305 /nfs/dbraw/zinc/53/13/05/890531305.db2.gz SGKMUAYMODRRTO-UHFFFAOYSA-N 0 3 420.351 4.223 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)Cc2nc(-c3ccc(F)cc3)cs2)C1 ZINC000475614310 890542962 /nfs/dbraw/zinc/54/29/62/890542962.db2.gz VGUZYORVCKCWQE-UZLBHIALSA-N 0 3 409.530 4.443 20 0 HIADHN Cc1nc(CN(C)[C@@H]2CCCN(Cc3cnc(-c4cccs4)s3)CC2)no1 ZINC000475614733 890545259 /nfs/dbraw/zinc/54/52/59/890545259.db2.gz HEYSAEJXYNHSBC-OAHLLOKOSA-N 0 3 403.577 4.050 20 0 HIADHN CC(C)n1ccc(C[C@H](C)NCc2ccc(I)cc2Cl)n1 ZINC000475627675 890565189 /nfs/dbraw/zinc/56/51/89/890565189.db2.gz UGRDUJWNWWVRQF-LBPRGKRZSA-N 0 3 417.722 4.443 20 0 HIADHN OC[C@@H](NCc1cc(-n2ccnc2)cs1)c1ccc(Cl)cc1C(F)(F)F ZINC000475640533 890582679 /nfs/dbraw/zinc/58/26/79/890582679.db2.gz SDWALJCXCYVTEO-MRXNPFEDSA-N 0 3 401.841 4.429 20 0 HIADHN CCN(C(=O)c1ccnc(N2CC[C@H](C)C2)c1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000475648104 890591547 /nfs/dbraw/zinc/59/15/47/890591547.db2.gz GFIXNDMBAUSLFY-SXWKCWPCSA-N 0 3 406.574 4.225 20 0 HIADHN CC(=O)Nc1ccc(S(=O)(=O)CCCN[C@@H](C)c2cc3cccc(F)c3o2)cc1 ZINC000475689085 890630566 /nfs/dbraw/zinc/63/05/66/890630566.db2.gz BYIRUOICYZUEBZ-AWEZNQCLSA-N 0 3 418.490 4.045 20 0 HIADHN CCc1nnc(-c2ccc(NC(=O)NC[C@H](c3ccc(CC)cc3)N(C)C)cc2)o1 ZINC000475695633 890635373 /nfs/dbraw/zinc/63/53/73/890635373.db2.gz KIJGWXWDQRDIOS-HXUWFJFHSA-N 0 3 407.518 4.286 20 0 HIADHN O=C(c1cc2sc(N3CCCC3)nc2s1)N1CCCC[C@H](N2CCCC2)C1 ZINC000475771380 890715167 /nfs/dbraw/zinc/71/51/67/890715167.db2.gz IEUIBEGBEMWEPT-HNNXBMFYSA-N 0 3 404.605 4.049 20 0 HIADHN O=C(c1cc2sc(N3CCCC3)nc2s1)N1CCCC[C@@H](N2CCCC2)C1 ZINC000475771382 890715437 /nfs/dbraw/zinc/71/54/37/890715437.db2.gz IEUIBEGBEMWEPT-OAHLLOKOSA-N 0 3 404.605 4.049 20 0 HIADHN O=C(N[C@@H](c1ccccc1)C1CCCC1)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1CO ZINC000475894150 890826958 /nfs/dbraw/zinc/82/69/58/890826958.db2.gz ZTRZZGKOBYJQOM-GVAUOCQISA-N 0 3 421.585 4.100 20 0 HIADHN O=C(Cc1cnc2ccccc2c1)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000475912328 890840083 /nfs/dbraw/zinc/84/00/83/890840083.db2.gz RQOUBCFZMAXQNR-QFIPXVFZSA-N 0 3 411.509 4.060 20 0 HIADHN Cn1cc(C(=O)NC[C@H]2CCCN2Cc2ccccc2)c(-c2ccc(Cl)s2)n1 ZINC000475941271 890865270 /nfs/dbraw/zinc/86/52/70/890865270.db2.gz UEYRHSOSBMHKAP-MRXNPFEDSA-N 0 3 414.962 4.196 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2cn(C)nc2-c2ccc(Cl)s2)N(C)C)cc1 ZINC000475987825 890904915 /nfs/dbraw/zinc/90/49/15/890904915.db2.gz OECGTDKBAPAYMI-MRXNPFEDSA-N 0 3 402.951 4.143 20 0 HIADHN CCc1onc(-c2ccccc2)c1C(=O)N(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1 ZINC000476027405 890959852 /nfs/dbraw/zinc/95/98/52/890959852.db2.gz VNWPBMMBVLKZFR-CVDCTZTESA-N 0 3 404.514 4.064 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(Cl)cc2)CC1)c1cc2[nH]ccc2s1 ZINC000476090092 891012714 /nfs/dbraw/zinc/01/27/14/891012714.db2.gz LNVYJNXYCGLOMN-UHFFFAOYSA-N 0 3 403.935 4.156 20 0 HIADHN Cc1c(F)ccc(Cl)c1C(=O)Nc1ccc(C(=O)N(C)[C@H]2CCCN(C)C2)cc1 ZINC000476143646 891066663 /nfs/dbraw/zinc/06/66/63/891066663.db2.gz JHNLYOQDHOXGPJ-KRWDZBQOSA-N 0 3 417.912 4.206 20 0 HIADHN Cc1nc2ccc(Br)cn2c1C(=O)Nc1cc(CN(C)C)ccc1C ZINC000476248800 891171931 /nfs/dbraw/zinc/17/19/31/891171931.db2.gz MDSNGHRWEKSITD-UHFFFAOYSA-N 0 3 401.308 4.028 20 0 HIADHN O=C(Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)[C@H]1CCCc2c(O)cccc21 ZINC000476334494 891238241 /nfs/dbraw/zinc/23/82/41/891238241.db2.gz PYCHDWWPYJUKGD-UGKGYDQZSA-N 0 3 416.525 4.094 20 0 HIADHN O=C(Nc1c(F)cc(F)cc1Br)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000476365172 891272989 /nfs/dbraw/zinc/27/29/89/891272989.db2.gz NOPWVVDLHCQRBT-AWEZNQCLSA-N 0 3 410.262 4.123 20 0 HIADHN CO[C@@H]1CCC[C@H](CC(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)C1 ZINC000476415724 891329411 /nfs/dbraw/zinc/32/94/11/891329411.db2.gz OCCGAPYHJKNAQN-BHDDXSALSA-N 0 3 410.562 4.172 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N2Cc3ccccc3[C@H](c3ccccc3)C2)CC1 ZINC000476437730 891350136 /nfs/dbraw/zinc/35/01/36/891350136.db2.gz SLQIDTJJGALUIZ-VWLOTQADSA-N 0 3 421.585 4.233 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N2CCC[C@@H]2c2nc3ccccc3s2)CC1 ZINC000476451549 891362671 /nfs/dbraw/zinc/36/26/71/891362671.db2.gz JBWFWQMTFNFFJK-LJQANCHMSA-N 0 3 416.591 4.032 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N(Cc2cccs2)Cc2cccs2)CC1 ZINC000476450446 891363034 /nfs/dbraw/zinc/36/30/34/891363034.db2.gz DVMOVZMJLZWPQR-UHFFFAOYSA-N 0 3 421.632 4.411 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)N(Cc1ccccc1)CC1CCOCC1 ZINC000476532094 891445783 /nfs/dbraw/zinc/44/57/83/891445783.db2.gz GTVKWFNZGPWKKN-RUZDIDTESA-N 0 3 421.585 4.462 20 0 HIADHN CCN1CC[C@@H](N(C)C(=O)c2cn(C3CC3)c3cc(Cl)c(F)cc3c2=O)C[C@@H]1C ZINC000476546373 891462519 /nfs/dbraw/zinc/46/25/19/891462519.db2.gz NZRZOUWNNLMHTG-DZGCQCFKSA-N 0 3 419.928 4.074 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)C3(Cc4cccc(F)c4)CCC3)CC2)C[C@H](C)O1 ZINC000476649995 891592083 /nfs/dbraw/zinc/59/20/83/891592083.db2.gz VMZIZYVJALDXEG-PMACEKPBSA-N 0 3 416.581 4.276 20 0 HIADHN C[C@H](CNC(=O)c1cn(C2CC2)c2cc(Cl)c(F)cc2c1=O)N1CCCC[C@@H]1C ZINC000476763681 891737724 /nfs/dbraw/zinc/73/77/24/891737724.db2.gz NKAYUAMFNCUIPE-UONOGXRCSA-N 0 3 419.928 4.122 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N(CCCO)[C@H]2CCCc3ccccc32)C1 ZINC000476830698 891812035 /nfs/dbraw/zinc/81/20/35/891812035.db2.gz PKBWEQPQJPTQDF-XRODADMRSA-N 0 3 421.585 4.294 20 0 HIADHN O=C(Nc1cccc(OCc2cccnc2)c1)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000504881866 913613035 /nfs/dbraw/zinc/61/30/35/913613035.db2.gz KNYZMDYCRJSZJG-QHCPKHFHSA-N 0 3 416.525 4.447 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)cc1OC ZINC000504895721 913628709 /nfs/dbraw/zinc/62/87/09/913628709.db2.gz QBQIBHYKMKMLRO-VXKWHMMOSA-N 0 3 423.557 4.215 20 0 HIADHN COc1ccc(Cl)cc1N1CC[C@H](NCc2cnn(-c3ccc(F)cc3)c2)C1 ZINC000477212238 892144576 /nfs/dbraw/zinc/14/45/76/892144576.db2.gz ATNCBRHQXRGLPJ-SFHVURJKSA-N 0 3 400.885 4.042 20 0 HIADHN CC[C@H](C)n1ncc(NC(=O)CCCN2CCN(c3ccccc3)CC2)c1C1CC1 ZINC000477245304 892195192 /nfs/dbraw/zinc/19/51/92/892195192.db2.gz UCHKJSLCGPXYIA-IBGZPJMESA-N 0 3 409.578 4.272 20 0 HIADHN CC(C)(C)N1C[C@@H](C(=O)Nc2nc(-c3ccc(O)cc3)cs2)[C@H](C(F)(F)F)C1 ZINC000477260807 892214045 /nfs/dbraw/zinc/21/40/45/892214045.db2.gz DWPARANSVKAHEX-ZIAGYGMSSA-N 0 3 413.465 4.363 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)c3cc(C)ccc3Br)cc2)CC1 ZINC000477319137 892283254 /nfs/dbraw/zinc/28/32/54/892283254.db2.gz BWLUQNUDGAYYCY-UHFFFAOYSA-N 0 3 416.363 4.147 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)Cc2nc(-c3ccc(F)cc3)cs2)CN1Cc1ccccc1 ZINC000477348907 892316106 /nfs/dbraw/zinc/31/61/06/892316106.db2.gz GSNSBWHAHGNPAY-OXQOHEQNSA-N 0 3 409.530 4.271 20 0 HIADHN CN(Cc1cc(Br)cs1)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000504917307 913652270 /nfs/dbraw/zinc/65/22/70/913652270.db2.gz CVPMIZXFSKMEKG-QGZVFWFLSA-N 0 3 422.392 4.317 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(Cl)cc2)CC1)c1cc2sccc2[nH]1 ZINC000477377570 892338067 /nfs/dbraw/zinc/33/80/67/892338067.db2.gz WPWTWQVSOOEYAK-UHFFFAOYSA-N 0 3 403.935 4.156 20 0 HIADHN O=C(Nc1ccc(OCC(F)(F)F)c(F)c1)N1CCN(C2CCCCC2)CC1 ZINC000504923986 913661037 /nfs/dbraw/zinc/66/10/37/913661037.db2.gz JQAZPWFHRWDIHU-UHFFFAOYSA-N 0 3 403.420 4.249 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@H](C)N[C@H](C)c2ccc(F)c(OC)c2)cc1 ZINC000504926834 913665542 /nfs/dbraw/zinc/66/55/42/913665542.db2.gz KRYNWKAQMOEQCU-JKSUJKDBSA-N 0 3 408.539 4.277 20 0 HIADHN CCOc1ccc([C@H](C)NC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)cc1OC ZINC000504929275 913668092 /nfs/dbraw/zinc/66/80/92/913668092.db2.gz IIRFZWFFVZCYJQ-RXVVDRJESA-N 0 3 411.546 4.119 20 0 HIADHN CCOc1ccc([C@H](NS(=O)(=O)c2ccc(CN(C)C)cc2)c2ccccc2)cc1 ZINC000477522006 892542900 /nfs/dbraw/zinc/54/29/00/892542900.db2.gz HSJLZXCLQHKZCW-XMMPIXPASA-N 0 3 424.566 4.215 20 0 HIADHN CN(C)Cc1ccc(S(=O)(=O)N2CCC[C@H]2c2ccc(Br)cc2)cc1 ZINC000477572833 892635575 /nfs/dbraw/zinc/63/55/75/892635575.db2.gz BEPBBRTWBKZZIA-IBGZPJMESA-N 0 3 423.376 4.037 20 0 HIADHN CN(C)C[C@H](NC(=O)NCc1ccc(F)cc1C(F)(F)F)c1ccc(F)cc1 ZINC000477585913 892655843 /nfs/dbraw/zinc/65/58/43/892655843.db2.gz IKFWYVYADLZOJY-KRWDZBQOSA-N 0 3 401.379 4.086 20 0 HIADHN CCc1cccc2c(CCNC(=O)N(CCN(C)C)Cc3ccccc3F)c[nH]c21 ZINC000477620828 892723521 /nfs/dbraw/zinc/72/35/21/892723521.db2.gz FQPQEQQUNKQHGB-UHFFFAOYSA-N 0 3 410.537 4.185 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)N[C@@H](C)c2ccc(C(F)(F)F)cc2)cc1 ZINC000477623193 892731773 /nfs/dbraw/zinc/73/17/73/892731773.db2.gz QPWNGUBDXMDPBI-LIRRHRJNSA-N 0 3 409.452 4.377 20 0 HIADHN CCc1cccc2c(CCNC(=O)N3CCCN(Cc4ccccc4)CC3)c[nH]c21 ZINC000477647833 892775287 /nfs/dbraw/zinc/77/52/87/892775287.db2.gz XRTWDBVWMNGIQC-UHFFFAOYSA-N 0 3 404.558 4.190 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)Nc3ccc(F)cc3-c3cnn(C)c3)cc2)CC1 ZINC000477661970 892800314 /nfs/dbraw/zinc/80/03/14/892800314.db2.gz JUXXUBLFJZGQMH-UHFFFAOYSA-N 0 3 421.520 4.009 20 0 HIADHN O=C(CNC1(c2ccc(OCc3ccccc3)cc2)CCOCC1)N1CCCCCC1 ZINC000477666739 892802206 /nfs/dbraw/zinc/80/22/06/892802206.db2.gz MMOYWJSULSMTLN-UHFFFAOYSA-N 0 3 422.569 4.264 20 0 HIADHN CCOc1ccc(SCC(=O)Nc2cccc(CN3CCC(CO)CC3)c2)cc1 ZINC000477714904 892823471 /nfs/dbraw/zinc/82/34/71/892823471.db2.gz HKYLXSKUCYBTME-UHFFFAOYSA-N 0 3 414.571 4.020 20 0 HIADHN O=C(CCc1ccc(-c2ccccc2)[nH]1)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000477729382 892830468 /nfs/dbraw/zinc/83/04/68/892830468.db2.gz BNFPHNBPTVPDBN-UHFFFAOYSA-N 0 3 417.553 4.457 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N2CCC[C@@H]2c2ccc3c(c2)OCO3)C1 ZINC000477746107 892840486 /nfs/dbraw/zinc/84/04/86/892840486.db2.gz FMAJCEVQVRIBTH-JRGCBEDISA-N 0 3 407.514 4.097 20 0 HIADHN CN(C(=O)NCc1ccc(-c2ccc3c(c2)CCCO3)cc1)[C@@H]1CCN(C2CC2)C1 ZINC000477769541 892855364 /nfs/dbraw/zinc/85/53/64/892855364.db2.gz ZRWMNDDSMJTBQR-HSZRJFAPSA-N 0 3 405.542 4.057 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N[C@H]3COc4c3ccc(C)c4C)c(C)c2)CC1 ZINC000477791890 892869387 /nfs/dbraw/zinc/86/93/87/892869387.db2.gz DXJOINLHGSKEPV-QFIPXVFZSA-N 0 3 408.546 4.009 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)N(C)Cc2nc(-c3ccccc3)c[nH]2)C1 ZINC000477817698 892885744 /nfs/dbraw/zinc/88/57/44/892885744.db2.gz GQNQZRULKFMLBB-GHTZIAJQSA-N 0 3 403.530 4.054 20 0 HIADHN CC[C@H](CNC(=O)NCc1csc(-c2ccco2)n1)N1CCc2ccccc2C1 ZINC000477819159 892886397 /nfs/dbraw/zinc/88/63/97/892886397.db2.gz IOCGBLYVKWDVPI-LJQANCHMSA-N 0 3 410.543 4.039 20 0 HIADHN Cc1ccc([C@@H](NC[C@](C)(O)C2CCCCC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000477844250 892902596 /nfs/dbraw/zinc/90/25/96/892902596.db2.gz CJLPTCJEWMMLGR-RPWUZVMVSA-N 0 3 415.599 4.409 20 0 HIADHN C[C@@H](NC(=O)NCc1ccc(NC(=O)c2ccco2)cc1)[C@@H](c1ccccc1)N(C)C ZINC000477875774 892938008 /nfs/dbraw/zinc/93/80/08/892938008.db2.gz IHMSTYJGLWESRD-VGSWGCGISA-N 0 3 420.513 4.023 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)N[C@@H](C)CCc2ccc(O)cc2)N(C)C)cc1 ZINC000477903481 892974398 /nfs/dbraw/zinc/97/43/98/892974398.db2.gz CGSXGTFDEIYAOC-FDDCHVKYSA-N 0 3 413.562 4.103 20 0 HIADHN Cc1ccc(CN2CC[C@@H](N[C@@H](C)CC(=O)Nc3ccc(C(C)C)cc3)C2=O)cc1 ZINC000477917629 893002286 /nfs/dbraw/zinc/00/22/86/893002286.db2.gz NVOGZRNGVNYKLR-WMZHIEFXSA-N 0 3 407.558 4.226 20 0 HIADHN CCOc1ccc([C@H](CC)N[C@@H]2CCN(Cc3ccc(F)cc3)C2=O)cc1OCC ZINC000477925445 893012366 /nfs/dbraw/zinc/01/23/66/893012366.db2.gz IQVIWLVBEGWHRW-LEWJYISDSA-N 0 3 414.521 4.465 20 0 HIADHN CC(C)c1ccccc1NC(=O)C[C@H](C)N[C@H]1CCN(Cc2ccc(F)cc2)C1=O ZINC000477927282 893015565 /nfs/dbraw/zinc/01/55/65/893015565.db2.gz MXPWXDQIBMIKTK-JTSKRJEESA-N 0 3 411.521 4.057 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(S(=O)(=O)N(C)C)cc1)c1ccc(OC(F)(F)F)cc1 ZINC000477928457 893017631 /nfs/dbraw/zinc/01/76/31/893017631.db2.gz SQQUKLMMUGWNMZ-KBPBESRZSA-N 0 3 416.465 4.247 20 0 HIADHN Cc1cc(NC(=O)NCC2(C(F)(F)F)CC2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000477936419 893026261 /nfs/dbraw/zinc/02/62/61/893026261.db2.gz HWILULROYGMYJP-KRWDZBQOSA-N 0 3 421.467 4.103 20 0 HIADHN O=C(N[C@@H]1C[C@H]1c1ccc(Br)s1)c1cccc(CN2CCCC2)c1 ZINC000477980057 893078581 /nfs/dbraw/zinc/07/85/81/893078581.db2.gz NMTXPCLOSWSNPA-HZPDHXFCSA-N 0 3 405.361 4.392 20 0 HIADHN CN(Cc1ccccc1)[C@@H](CNC(=O)N1CCC(C(=O)c2ccccc2)CC1)C1CC1 ZINC000478009251 893117241 /nfs/dbraw/zinc/11/72/41/893117241.db2.gz KGNMKUJNYKKBRM-DEOSSOPVSA-N 0 3 419.569 4.202 20 0 HIADHN CC1CCN([C@@H](CNC(=O)Nc2cccc3c2ccn(C)c3=O)c2ccccc2)CC1 ZINC000505006363 913747768 /nfs/dbraw/zinc/74/77/68/913747768.db2.gz SMELUWVAUWQHSA-QHCPKHFHSA-N 0 3 418.541 4.133 20 0 HIADHN CCOc1c(Cl)cccc1CC(=O)NC[C@H](c1cccc(OC)c1)N1CCCC1 ZINC000478287256 893495933 /nfs/dbraw/zinc/49/59/33/893495933.db2.gz FOKTVFBPAIAAQV-OAQYLSRUSA-N 0 3 416.949 4.243 20 0 HIADHN Cn1cc([C@H](NCCc2cc(Cl)c3c(c2)OCCCO3)c2ccc(F)cc2)cn1 ZINC000478330624 893564666 /nfs/dbraw/zinc/56/46/66/893564666.db2.gz OAHYHYRIELJGBW-OAQYLSRUSA-N 0 3 415.896 4.296 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N[C@H](c3nccs3)c3ccccc3)cc2)CC1 ZINC000505042418 913782090 /nfs/dbraw/zinc/78/20/90/913782090.db2.gz SOUBVAFNICPCRD-QFIPXVFZSA-N 0 3 420.582 4.193 20 0 HIADHN CN1C[C@@H](NC(=O)c2cccc(NC(=O)C3CCCCC3)c2)[C@@H](c2ccccc2)C1 ZINC000478373893 893638066 /nfs/dbraw/zinc/63/80/66/893638066.db2.gz VPWOUXFRYZFVIX-DHIUTWEWSA-N 0 3 405.542 4.033 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)N2CC3(CCOCC3)c3ccccc32)N(C)C)cc1 ZINC000478448614 893764279 /nfs/dbraw/zinc/76/42/79/893764279.db2.gz PHMFXIUHTMUGCD-HSZRJFAPSA-N 0 3 407.558 4.130 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)N[C@H](C)c2nc(C(C)(C)C)cs2)c1 ZINC000478605607 893870920 /nfs/dbraw/zinc/87/09/20/893870920.db2.gz FKYXCUGPGLKWTO-MRXNPFEDSA-N 0 3 418.607 4.284 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)N[C@@H](c2nccs2)c2ccccc2)c1 ZINC000478619403 893879085 /nfs/dbraw/zinc/87/90/85/893879085.db2.gz KKBYNGBOFQKRCN-OAQYLSRUSA-N 0 3 424.570 4.015 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)NCc2oc3ccc(F)cc3c2C)c1 ZINC000478819235 894092848 /nfs/dbraw/zinc/09/28/48/894092848.db2.gz HHEVNTXXMLXRIA-UHFFFAOYSA-N 0 3 413.493 4.162 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)Nc1cc(Br)cc(OC)c1)c1ccco1 ZINC000478927183 894208095 /nfs/dbraw/zinc/20/80/95/894208095.db2.gz GBTRMXVRNASPHV-MLGOLLRUSA-N 0 3 410.312 4.302 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)N[C@@H](CC(F)(F)F)c2ccccc2)c1 ZINC000478940369 894221108 /nfs/dbraw/zinc/22/11/08/894221108.db2.gz UICRGPVCKUMNIS-FQEVSTJZSA-N 0 3 423.479 4.462 20 0 HIADHN CCOc1cc(CN(Cc2ccccc2)[C@H](C)C2CC2)nc2nc(C(F)(F)F)nn21 ZINC000478980236 894257418 /nfs/dbraw/zinc/25/74/18/894257418.db2.gz KNBCQPJUPKKYDA-CQSZACIVSA-N 0 3 419.451 4.343 20 0 HIADHN CS(=O)(=O)Cc1cccc(CN[C@H]2CCCc3cc(Br)ccc32)c1 ZINC000479068149 894332270 /nfs/dbraw/zinc/33/22/70/894332270.db2.gz MCIRZIOOBGYZGE-IBGZPJMESA-N 0 3 408.361 4.161 20 0 HIADHN COc1cc2c(cc1OC)[C@@H](N[C@H]1CCCN(c3ccccc3Cl)C1=O)CC2 ZINC000479079445 894344868 /nfs/dbraw/zinc/34/48/68/894344868.db2.gz PQALOLIZBQJLJP-ROUUACIJSA-N 0 3 400.906 4.130 20 0 HIADHN Cc1cc(C)c(S(N)(=O)=O)cc1[C@@H](C)N[C@@H](C)c1ccc(-c2ccncc2)cc1 ZINC000479079494 894345147 /nfs/dbraw/zinc/34/51/47/894345147.db2.gz QCQIUJUTHVVSOJ-ZWKOTPCHSA-N 0 3 409.555 4.425 20 0 HIADHN C[C@H](NC[C@@H]1CCCO[C@@H]1C(C)(C)C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479080969 894346526 /nfs/dbraw/zinc/34/65/26/894346526.db2.gz OTOBLFKCBRLYSP-PRXAMGSTSA-N 0 3 423.406 4.133 20 0 HIADHN CC[C@H](C)NC(=O)[C@@H]1C[C@H](C)N(CC(=O)N[C@H](C)c2cccs2)[C@@H]2CCCC[C@H]12 ZINC000479111039 894379580 /nfs/dbraw/zinc/37/95/80/894379580.db2.gz VLPYRQJLEDTQRE-VTYCOLDWSA-N 0 3 419.635 4.109 20 0 HIADHN CC[C@H](C)NC(=O)[C@@H]1C[C@H](C)N(Cc2nc(-c3ccoc3)no2)[C@H]2CCCC[C@@H]12 ZINC000479116405 894385286 /nfs/dbraw/zinc/38/52/86/894385286.db2.gz QZGFTWYBCSBKTF-JAQSECSASA-N 0 3 400.523 4.014 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N[C@H]3CCCc4c(O)cccc43)c(C)c2)CC1 ZINC000479227191 894488379 /nfs/dbraw/zinc/48/83/79/894488379.db2.gz PMBPBUUVVAZFEZ-QFIPXVFZSA-N 0 3 408.546 4.042 20 0 HIADHN C[C@@H](NCCNC(=O)c1ccco1)c1ccc(Br)cc1C(F)(F)F ZINC000479253721 894519312 /nfs/dbraw/zinc/51/93/12/894519312.db2.gz MBCUKRODGPOMKH-SNVBAGLBSA-N 0 3 405.214 4.142 20 0 HIADHN O=C(c1cccc(CN2CCCC2)c1)N1CCO[C@@H](c2ccc(F)cc2Cl)C1 ZINC000479270388 894545365 /nfs/dbraw/zinc/54/53/65/894545365.db2.gz NGPFEWPRPJUYNQ-OAQYLSRUSA-N 0 3 402.897 4.289 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)N[C@@H]2C[C@@H]2c2c(F)cccc2Cl)c1 ZINC000479316961 894604573 /nfs/dbraw/zinc/60/45/73/894604573.db2.gz LXSCHYFBAUHMJR-FXAWDEMLSA-N 0 3 419.928 4.117 20 0 HIADHN CCOc1ccc([C@H](C)NC(=O)N(Cc2ccco2)C2CCN(C)CC2)cc1OC ZINC000505210357 913885325 /nfs/dbraw/zinc/88/53/25/913885325.db2.gz LVDNYDHATLYPNI-KRWDZBQOSA-N 0 3 415.534 4.054 20 0 HIADHN COc1cc2c(cc1OC)[C@@H](NCc1ccc(OCC(F)(F)F)c(OC)c1)CC2 ZINC000479340391 894633759 /nfs/dbraw/zinc/63/37/59/894633759.db2.gz ZNGCJMWFJUANPC-INIZCTEOSA-N 0 3 411.420 4.431 20 0 HIADHN C[C@H](NCCc1c[nH]c2ccccc12)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479356807 894655126 /nfs/dbraw/zinc/65/51/26/894655126.db2.gz GGFZJSHMKMQUIR-NSHDSACASA-N 0 3 412.342 4.015 20 0 HIADHN Cc1c2ccccc2oc1[C@H](C)NC(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000479363842 894664091 /nfs/dbraw/zinc/66/40/91/894664091.db2.gz VKNNGDNNOPXUCF-SCTDSRPQSA-N 0 3 413.562 4.333 20 0 HIADHN C[C@H](N[C@H]1CCOC2(CCCCC2)C1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479385889 894687976 /nfs/dbraw/zinc/68/79/76/894687976.db2.gz FZWYHPRYZUNHDZ-STQMWFEESA-N 0 3 421.390 4.173 20 0 HIADHN C[C@@H](NCC1(Cc2ccccc2)CC1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479387494 894689447 /nfs/dbraw/zinc/68/94/47/894689447.db2.gz HGDQCZNGUAESPW-CYBMUJFWSA-N 0 3 413.370 4.314 20 0 HIADHN C[C@@H](N[C@@H](C)CCCC(F)(F)F)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479459509 894782105 /nfs/dbraw/zinc/78/21/05/894782105.db2.gz WQEWVJOYLBMMMX-DTWKUNHWSA-N 0 3 407.285 4.413 20 0 HIADHN COc1ccc([C@H](NC[C@H]2CCCN(C(C)=O)C2)c2ccccc2Cl)cc1OC ZINC000479468705 894791376 /nfs/dbraw/zinc/79/13/76/894791376.db2.gz CNZNOOACEYAPGN-HXOBKFHXSA-N 0 3 416.949 4.295 20 0 HIADHN C[C@@H](NCCCCn1cc(Br)cn1)c1ncc(Br)cc1F ZINC000479468592 894791395 /nfs/dbraw/zinc/79/13/95/894791395.db2.gz YNWMAZWUERBNCL-SNVBAGLBSA-N 0 3 420.124 4.073 20 0 HIADHN CCN(CC)[C@H](C)CN[C@@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000479469947 894792615 /nfs/dbraw/zinc/79/26/15/894792615.db2.gz JPUNSIGGLAETQA-IERDGZPVSA-N 0 3 408.995 4.153 20 0 HIADHN CCS(=O)(=O)c1c(Cl)cccc1CNC[C@@H]1CCCc2cc(OC)ccc21 ZINC000479473568 894796705 /nfs/dbraw/zinc/79/67/05/894796705.db2.gz AZRSWLPRXMEEPN-INIZCTEOSA-N 0 3 407.963 4.352 20 0 HIADHN CCN(CC)[C@H](C)CN[C@@H](c1cccc(S(C)(=O)=O)c1)c1ccc(C)cc1C ZINC000479482629 894805411 /nfs/dbraw/zinc/80/54/11/894805411.db2.gz ZBVOLAANUJOTPP-XXBNENTESA-N 0 3 402.604 4.116 20 0 HIADHN Cn1ccc([C@@H](NC2CC(N3CCC(C(F)(F)F)CC3)C2)c2ccc(F)cc2)n1 ZINC000479482495 894805506 /nfs/dbraw/zinc/80/55/06/894805506.db2.gz TZYYFARJDFNBQA-QLOJAFMTSA-N 0 3 410.459 4.044 20 0 HIADHN COc1ccc([C@@H](CCO)N[C@H](C)c2ccc(I)cc2)cc1 ZINC000479484405 894806788 /nfs/dbraw/zinc/80/67/88/894806788.db2.gz HZCCLZCAKJRPGW-FZKQIMNGSA-N 0 3 411.283 4.074 20 0 HIADHN CCOC(=O)[C@H](NC1CCN([C@@H](C)c2ccncc2)CC1)c1cccc(Cl)c1 ZINC000479492457 894811607 /nfs/dbraw/zinc/81/16/07/894811607.db2.gz VMVQFXAJTYNSCZ-HRAATJIYSA-N 0 3 401.938 4.154 20 0 HIADHN C[C@@H](CNC(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1)Oc1ccccc1 ZINC000505251602 913905557 /nfs/dbraw/zinc/90/55/57/913905557.db2.gz PIMKVUPSKXJPJN-UWJYYQICSA-N 0 3 406.448 4.025 20 0 HIADHN CCc1nc2c(s1)[C@@H](N(C)C(=O)NC[C@@H](c1ccc(C)cc1)N(C)C)CCC2 ZINC000479510393 894824378 /nfs/dbraw/zinc/82/43/78/894824378.db2.gz DTVLYNFSDJAVMU-OALUTQOASA-N 0 3 400.592 4.336 20 0 HIADHN O=S1(=O)CC[C@H](NCCCc2ccccc2F)c2cc(Br)ccc21 ZINC000479546982 894847407 /nfs/dbraw/zinc/84/74/07/894847407.db2.gz UFJASXSIOJWMMI-KRWDZBQOSA-N 0 3 412.324 4.029 20 0 HIADHN COc1ccc(-c2ccncc2)cc1CNCc1cccc(CN2CCO[C@@H](C)C2)c1 ZINC000479550337 894849530 /nfs/dbraw/zinc/84/95/30/894849530.db2.gz BESYYWHCCBTABL-FQEVSTJZSA-N 0 3 417.553 4.268 20 0 HIADHN Cn1cc([C@H](NCCc2cccc(OCC(F)(F)F)c2)c2cccc(F)c2)cn1 ZINC000479552454 894850780 /nfs/dbraw/zinc/85/07/80/894850780.db2.gz HKMMBZWIBRIKDY-HXUWFJFHSA-N 0 3 407.411 4.422 20 0 HIADHN CCOc1ccc([C@@H](C)NC(=O)NC[C@H](c2ccc(CC)cc2)N(C)C)cc1OC ZINC000505268581 913924637 /nfs/dbraw/zinc/92/46/37/913924637.db2.gz MGGSMGSFGHIUNA-DYESRHJHSA-N 0 3 413.562 4.319 20 0 HIADHN C[C@H](NC(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C)c1ccc(NC(=O)C2CC2)cc1 ZINC000479760448 895062215 /nfs/dbraw/zinc/06/22/15/895062215.db2.gz SHSQWXZVHFRUNK-HOIFWPIMSA-N 0 3 408.546 4.087 20 0 HIADHN COc1ccc(C(=O)Nc2ccc(C(=O)N[C@H](C)CN3CCCCCC3)s2)cc1 ZINC000479797504 895102510 /nfs/dbraw/zinc/10/25/10/895102510.db2.gz OSTFFWBRZBYZQL-MRXNPFEDSA-N 0 3 415.559 4.003 20 0 HIADHN CCCOc1ccc([C@H](C)NC(=O)N[C@@H](CN(C)C)c2ccc(F)cc2)cc1OC ZINC000479809879 895116671 /nfs/dbraw/zinc/11/66/71/895116671.db2.gz DJVSPUDVYAZVMG-JXFKEZNVSA-N 0 3 417.525 4.286 20 0 HIADHN COc1cc(C)c([C@H](C)NC(=O)N[C@@H]2CCN(Cc3ccccc3)[C@H]2C)cc1OC ZINC000479817143 895129529 /nfs/dbraw/zinc/12/95/29/895129529.db2.gz OYWLWHDOLIQTBH-BBTUJRGHSA-N 0 3 411.546 4.035 20 0 HIADHN COC[C@H](NC[C@@H](c1cccs1)N1CCOCC1)c1cccc(C(F)(F)F)c1 ZINC000479856243 895192132 /nfs/dbraw/zinc/19/21/32/895192132.db2.gz WDCKUCNZNUXBNJ-ROUUACIJSA-N 0 3 414.493 4.118 20 0 HIADHN C[C@H](NC[C@@H](c1cccs1)N1CCC(C)CC1)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000479872834 895215081 /nfs/dbraw/zinc/21/50/81/895215081.db2.gz KYVDBVIPUIBLMA-LPHOPBHVSA-N 0 3 424.607 4.415 20 0 HIADHN Cc1c([C@H](C)NCc2ccccc2CN2CCOCC2)cnn1-c1ccc(F)cc1 ZINC000479897970 895244687 /nfs/dbraw/zinc/24/46/87/895244687.db2.gz NHEOKKIEPFFBBH-SFHVURJKSA-N 0 3 408.521 4.003 20 0 HIADHN CC(C)(C)n1cc(C(=O)N(CCN2CCCC2)Cc2ccc(Cl)c(Cl)c2)nn1 ZINC000479943788 895297738 /nfs/dbraw/zinc/29/77/38/895297738.db2.gz XFUBLLXZKCKPGL-UHFFFAOYSA-N 0 3 424.376 4.078 20 0 HIADHN O=C(CCCCCc1cccs1)NCc1ccccc1CN1CCC(O)CC1 ZINC000479961221 895315137 /nfs/dbraw/zinc/31/51/37/895315137.db2.gz IRHANEAMPKXNJL-UHFFFAOYSA-N 0 3 400.588 4.124 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)[C@@H]1C[C@H]1c1ccc2ccccc2c1 ZINC000479965790 895319447 /nfs/dbraw/zinc/31/94/47/895319447.db2.gz POLJGRSTMXSRHU-IZZNHLLZSA-N 0 3 414.549 4.216 20 0 HIADHN Cc1c(N[C@@H](C)C(C)C)cccc1C(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000479991645 895344865 /nfs/dbraw/zinc/34/48/65/895344865.db2.gz OYKDYVOMZLQTEU-FQEVSTJZSA-N 0 3 423.601 4.338 20 0 HIADHN Cc1ccc(C)n1-c1sccc1C(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000479998066 895351897 /nfs/dbraw/zinc/35/18/97/895351897.db2.gz WOOPBMDNJRXCTE-UHFFFAOYSA-N 0 3 423.582 4.042 20 0 HIADHN CS(=O)(=O)CCCCN[C@@H](c1cccc(F)c1)c1cccc(Br)c1 ZINC000480024468 895374507 /nfs/dbraw/zinc/37/45/07/895374507.db2.gz UIKJKXUQYGZEOF-GOSISDBHSA-N 0 3 414.340 4.092 20 0 HIADHN COc1cc(OC2CC2)ccc1C(=O)N1CCCN(CCCc2ccccc2)CC1 ZINC000480038484 895386971 /nfs/dbraw/zinc/38/69/71/895386971.db2.gz LIIASKDSXVHDNI-UHFFFAOYSA-N 0 3 408.542 4.017 20 0 HIADHN COc1ccc([C@@H](CN[C@@H](C)c2nnn(-c3ccccc3)c2C)N2CCCC2)cc1 ZINC000480079858 895435068 /nfs/dbraw/zinc/43/50/68/895435068.db2.gz DTJDHKPWMGSTGH-FDDCHVKYSA-N 0 3 405.546 4.072 20 0 HIADHN COc1cccc([C@@H](CN[C@H](C)c2nnn(-c3ccc(F)cc3)c2C)N2CCCC2)c1 ZINC000480081455 895437732 /nfs/dbraw/zinc/43/77/32/895437732.db2.gz FOFHEOUPKLZTLB-UZUQRXQVSA-N 0 3 423.536 4.211 20 0 HIADHN COc1cccc([C@H](CN[C@H](C)c2nnn(-c3ccccc3)c2C)N2CCCC2)c1 ZINC000480082832 895441712 /nfs/dbraw/zinc/44/17/12/895441712.db2.gz GQRZCRHSIOGUOB-JPYJTQIMSA-N 0 3 405.546 4.072 20 0 HIADHN CCCc1c(NC(=O)N[C@@H](CN(C)C)c2ccc(F)cc2)cnn1-c1cc(C)ccn1 ZINC000480098410 895463323 /nfs/dbraw/zinc/46/33/23/895463323.db2.gz OAWDDVBAFYAART-FQEVSTJZSA-N 0 3 424.524 4.092 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2ccc(F)c3ccccc23)cc1)[C@H]1CCCN(C)C1 ZINC000480114691 895486679 /nfs/dbraw/zinc/48/66/79/895486679.db2.gz HJORYNHBPJINTK-IBGZPJMESA-N 0 3 419.500 4.397 20 0 HIADHN CC[C@H](c1ccccc1)[C@H]1CCCN1CC(=O)Nc1cccc(C(=O)NC2CC2)c1 ZINC000480118883 895490977 /nfs/dbraw/zinc/49/09/77/895490977.db2.gz DWEDSZOKOKMUJT-DHIUTWEWSA-N 0 3 405.542 4.176 20 0 HIADHN C[C@H](N[C@@H]1CCS(=O)(=O)c2ccc(Br)cc21)[C@@H](C)c1ccccc1 ZINC000480167646 895557636 /nfs/dbraw/zinc/55/76/36/895557636.db2.gz JLZBEGJZQDUPCU-QWQRMKEZSA-N 0 3 408.361 4.449 20 0 HIADHN CC(C)(CN[C@@H]1CCS(=O)(=O)c2ccc(Br)cc21)C1CCCC1 ZINC000480175209 895567530 /nfs/dbraw/zinc/56/75/30/895567530.db2.gz AZRJRSDIWNDFRQ-MRXNPFEDSA-N 0 3 400.382 4.474 20 0 HIADHN Cc1ccc(CC[C@H](C)N[C@@H]2CCS(=O)(=O)c3ccc(Br)cc32)o1 ZINC000480186391 895580860 /nfs/dbraw/zinc/58/08/60/895580860.db2.gz XTIWRKJSWPRMIS-YVEFUNNKSA-N 0 3 412.349 4.180 20 0 HIADHN CNS(=O)(=O)c1ccc([C@@H](C)N[C@H](C)c2ccc(-c3csc(C)n3)cc2)cc1 ZINC000480235235 895640691 /nfs/dbraw/zinc/64/06/91/895640691.db2.gz YEFYRVOULOEFMK-HUUCEWRRSA-N 0 3 415.584 4.438 20 0 HIADHN COC[C@@H](NC[C@H](c1ccccc1)N1CCOCC1)c1cccc(C(F)(F)F)c1 ZINC000480249888 895660425 /nfs/dbraw/zinc/66/04/25/895660425.db2.gz QNXNFWWQDNOQRQ-NHCUHLMSSA-N 0 3 408.464 4.056 20 0 HIADHN CC(C)Cc1ccc([C@@H](CNC(=O)Nc2ccc(-c3ncn(C)n3)cc2)N(C)C)cc1 ZINC000480271864 895679221 /nfs/dbraw/zinc/67/92/21/895679221.db2.gz UWQSPKLUJVUVFM-JOCHJYFZSA-N 0 3 420.561 4.105 20 0 HIADHN CCN1CC[C@H](NCc2ccc(Br)o2)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000480304357 895709036 /nfs/dbraw/zinc/70/90/36/895709036.db2.gz ACKNIXODJAZQMV-WMLDXEAASA-N 0 3 403.242 4.385 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N(CC)Cc2ccc(OC)cc2OC)N(C)C)cc1 ZINC000480320817 895723447 /nfs/dbraw/zinc/72/34/47/895723447.db2.gz SQJFNEKGORGAHX-QFIPXVFZSA-N 0 3 413.562 4.101 20 0 HIADHN CCOc1ccc([C@H](C)NC(=O)CCCNCc2ccc(Br)o2)cc1 ZINC000480392659 895798497 /nfs/dbraw/zinc/79/84/97/895798497.db2.gz ZXHNFAYJMBUGKZ-AWEZNQCLSA-N 0 3 409.324 4.188 20 0 HIADHN CC[C@@H](C(=O)N1CCC(NCc2nccn2-c2ccccc2)CC1)c1ccccc1 ZINC000480396185 895801190 /nfs/dbraw/zinc/80/11/90/895801190.db2.gz PBUHYXCABRVQSE-HSZRJFAPSA-N 0 3 402.542 4.147 20 0 HIADHN Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)C(=O)NC[C@H](c1ccccc1)N1CCCC1 ZINC000480407492 895809453 /nfs/dbraw/zinc/80/94/53/895809453.db2.gz VURNOMLQQWKVMQ-DNVCBOLYSA-N 0 3 422.495 4.119 20 0 HIADHN FC(F)(F)Oc1ccc2c(c1)[C@H](N[C@H](CN1CCOCC1)c1ccccc1)CC2 ZINC000480415085 895813751 /nfs/dbraw/zinc/81/37/51/895813751.db2.gz JVCLGNIEQPSTFG-NHCUHLMSSA-N 0 3 406.448 4.236 20 0 HIADHN Brc1ccc2c(c1)CC[C@@H]2N[C@H](CN1CCOCC1)c1ccccc1 ZINC000480441011 895830723 /nfs/dbraw/zinc/83/07/23/895830723.db2.gz BLDKHUIRSIFYJY-LEWJYISDSA-N 0 3 401.348 4.100 20 0 HIADHN C[C@H](O)[C@@](C)(CNCc1nc2cc(C(F)(F)F)ccc2n1C)Cc1ccccc1 ZINC000480449353 895838046 /nfs/dbraw/zinc/83/80/46/895838046.db2.gz YHNGHZWFXRNTNB-YCRPNKLZSA-N 0 3 405.464 4.312 20 0 HIADHN Cc1cc(-c2cc(C(=O)NCCN(C)Cc3ccccc3)c3c(C)noc3n2)c(C)o1 ZINC000480476792 895856877 /nfs/dbraw/zinc/85/68/77/895856877.db2.gz DSIBISUINQBUOR-UHFFFAOYSA-N 0 3 418.497 4.270 20 0 HIADHN CC(C)Oc1ccc(CN[C@H](C)c2ccc(S(=O)(=O)N3CCCCC3)cc2)cc1 ZINC000480536809 895899455 /nfs/dbraw/zinc/89/94/55/895899455.db2.gz DIOGOVPUYYOWCL-LJQANCHMSA-N 0 3 416.587 4.499 20 0 HIADHN CC[C@@H](c1ccc(F)cc1F)N1CCN(CC2CCN(C(=O)C(C)(C)C)CC2)CC1 ZINC000480538138 895900512 /nfs/dbraw/zinc/90/05/12/895900512.db2.gz QFZVZBFSTDYEMU-QFIPXVFZSA-N 0 3 421.576 4.318 20 0 HIADHN CC[C@H](c1ccc(F)cc1F)N1CCN(CC2CCN(C(=O)C(C)(C)C)CC2)CC1 ZINC000480538136 895900839 /nfs/dbraw/zinc/90/08/39/895900839.db2.gz QFZVZBFSTDYEMU-JOCHJYFZSA-N 0 3 421.576 4.318 20 0 HIADHN Cc1cccc(Oc2ccc(NC(=O)N3CC[C@H](N4CCN(C)CC4)[C@H](C)C3)cc2)c1 ZINC000480542157 895904359 /nfs/dbraw/zinc/90/43/59/895904359.db2.gz RCGBCYZHVMUXBO-YKSBVNFPSA-N 0 3 422.573 4.277 20 0 HIADHN CCCOc1ccc(C(=O)N[C@@H](C)C2=CCN(C)CC2)c(OCc2ccccc2)c1 ZINC000480551062 895912295 /nfs/dbraw/zinc/91/22/95/895912295.db2.gz GTRGKMMLYDCLEC-IBGZPJMESA-N 0 3 408.542 4.435 20 0 HIADHN CCCN(C(=O)c1cccs1)C1CCN(CCc2ccccc2C(=O)OC)CC1 ZINC000480586987 895949477 /nfs/dbraw/zinc/94/94/77/895949477.db2.gz WTYTWMDFXCWYIY-UHFFFAOYSA-N 0 3 414.571 4.094 20 0 HIADHN CCS(=O)(=O)Nc1ccc([C@H](C)NCc2ccc(F)cc2C(F)(F)F)cc1 ZINC000480602566 895967669 /nfs/dbraw/zinc/96/76/69/895967669.db2.gz UICHTQABIIEIRT-LBPRGKRZSA-N 0 3 404.429 4.457 20 0 HIADHN C[C@H]1C[C@H](NCc2ccc(N3CCO[C@H](C)C3)nc2)c2cccc(Br)c21 ZINC000480620594 895987870 /nfs/dbraw/zinc/98/78/70/895987870.db2.gz VNGNUKOJCSWDDC-KHYOSLBOSA-N 0 3 416.363 4.407 20 0 HIADHN O=S(=O)(CCCNCc1cc(Br)c(Cl)s1)Cc1ccccc1 ZINC000480642934 896012195 /nfs/dbraw/zinc/01/21/95/896012195.db2.gz ZNJLXXOOUVEWBJ-UHFFFAOYSA-N 0 3 422.797 4.259 20 0 HIADHN Cc1ccc([C@H](CNCc2cc(Br)c(Cl)s2)N2CCOCC2)o1 ZINC000480658258 896025396 /nfs/dbraw/zinc/02/53/96/896025396.db2.gz AMEXAUXRVRGJJA-AWEZNQCLSA-N 0 3 419.772 4.229 20 0 HIADHN Brc1cccc(N2CC[C@@H](CNCc3nccn3-c3ccccc3)C2)c1 ZINC000480674077 896038896 /nfs/dbraw/zinc/03/88/96/896038896.db2.gz SSVOVAIRRUSRDA-KRWDZBQOSA-N 0 3 411.347 4.251 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)N1CCC[C@H]1c1ccc2c(c1)OCO2 ZINC000480690139 896052809 /nfs/dbraw/zinc/05/28/09/896052809.db2.gz ZXGJMAYBGCUFHN-RTWAWAEBSA-N 0 3 407.514 4.099 20 0 HIADHN C[C@H](NCCc1ccc(OCC(F)(F)F)nc1)c1nc2ccc(Cl)cc2n1C ZINC000480692868 896055212 /nfs/dbraw/zinc/05/52/12/896055212.db2.gz AVZBONTXNFZOAM-LBPRGKRZSA-N 0 3 412.843 4.456 20 0 HIADHN CCSc1ccc([C@@H](C)NCc2ccc(N3CCCS3(=O)=O)c(F)c2)cc1 ZINC000480697534 896059719 /nfs/dbraw/zinc/05/97/19/896059719.db2.gz LMZVZJILTXJNSD-OAHLLOKOSA-N 0 3 408.564 4.328 20 0 HIADHN CCCCOc1cccc(CN[C@@H](C)c2cccc(N3CCCS3(=O)=O)c2)c1 ZINC000480711030 896072671 /nfs/dbraw/zinc/07/26/71/896072671.db2.gz GEGAJPWAFQMMDE-SFHVURJKSA-N 0 3 402.560 4.256 20 0 HIADHN CN1CCN(c2cc(CN[C@@H](Cc3cccc(F)c3)c3cccc(F)c3)ccn2)CC1 ZINC000480711649 896072724 /nfs/dbraw/zinc/07/27/24/896072724.db2.gz QSSTZLKPUQLKEC-DEOSSOPVSA-N 0 3 422.523 4.185 20 0 HIADHN CN1CCN(c2cc(CN[C@H]3CCCOc4c(Cl)c(Cl)ccc43)ccn2)CC1 ZINC000480720375 896081274 /nfs/dbraw/zinc/08/12/74/896081274.db2.gz JFRFDUGAVYFWGX-SFHVURJKSA-N 0 3 421.372 4.144 20 0 HIADHN CCNC(=O)COc1ccc(CN[C@@H](C)c2cc3c(s2)CCCC3)cc1OC ZINC000480732454 896093905 /nfs/dbraw/zinc/09/39/05/896093905.db2.gz YSXUNMGGCPSHRB-HNNXBMFYSA-N 0 3 402.560 4.001 20 0 HIADHN C[C@H](NC[C@H](c1cccc(Cl)c1)N1CCCC1)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000480774194 896138611 /nfs/dbraw/zinc/13/86/11/896138611.db2.gz VIVXZUWFYVBDIQ-MGPUTAFESA-N 0 3 424.969 4.370 20 0 HIADHN C[C@H]1Cc2ccc(Br)cc2CN1CC1CCN(C(=O)C(C)(C)C)CC1 ZINC000480858195 896225330 /nfs/dbraw/zinc/22/53/30/896225330.db2.gz QKBGTYSUIPUMKU-HNNXBMFYSA-N 0 3 407.396 4.480 20 0 HIADHN Fc1cccc(F)c1-c1csc(CN2CCC[C@@H](c3nc(C4CC4)n[nH]3)C2)n1 ZINC000480862869 896228801 /nfs/dbraw/zinc/22/88/01/896228801.db2.gz JOYHNHLNPOBDRP-CYBMUJFWSA-N 0 3 401.486 4.463 20 0 HIADHN Fc1cccc(F)c1-c1csc(CN2CCC[C@@H](c3n[nH]c(C4CC4)n3)C2)n1 ZINC000480862869 896228819 /nfs/dbraw/zinc/22/88/19/896228819.db2.gz JOYHNHLNPOBDRP-CYBMUJFWSA-N 0 3 401.486 4.463 20 0 HIADHN Cc1cc(C)c([C@H](C)NCc2cccc(NC(=O)CCN3CCOCC3)c2)cc1C ZINC000480887329 896244590 /nfs/dbraw/zinc/24/45/90/896244590.db2.gz ULGGAEFCSPGLSZ-NRFANRHFSA-N 0 3 409.574 4.123 20 0 HIADHN C[C@H](NCc1cccc(NC(=O)c2ccncc2)c1)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000480894667 896251127 /nfs/dbraw/zinc/25/11/27/896251127.db2.gz GINMTLHRUASNLA-INIZCTEOSA-N 0 3 414.509 4.414 20 0 HIADHN Fc1ccccc1COc1ccc(CN(C[C@@H]2CCCO2)[C@H]2CCSC2)cn1 ZINC000480902978 896260225 /nfs/dbraw/zinc/26/02/25/896260225.db2.gz VUEQEANCWXSSGM-PMACEKPBSA-N 0 3 402.535 4.286 20 0 HIADHN C[C@H](NCCCS(=O)(=O)Cc1ccccc1)c1ccc(Br)s1 ZINC000480903816 896260290 /nfs/dbraw/zinc/26/02/90/896260290.db2.gz DMSORZGPHWNFNU-ZDUSSCGKSA-N 0 3 402.379 4.166 20 0 HIADHN C[C@H]1C[C@@H](NCCNC(=O)c2ccc(Br)cc2)c2ccsc2S1 ZINC000480908038 896263534 /nfs/dbraw/zinc/26/35/34/896263534.db2.gz JYEMQJLRCYXNMU-XHDPSFHLSA-N 0 3 411.390 4.456 20 0 HIADHN CCCc1ccc([C@H](C)NCc2cccc(NC(=O)CCN3CCOCC3)c2)cc1 ZINC000480910827 896267640 /nfs/dbraw/zinc/26/76/40/896267640.db2.gz PJPSPZHPCYWUEX-FQEVSTJZSA-N 0 3 409.574 4.151 20 0 HIADHN Cc1c2ccccc2oc1[C@H](C)NCc1cccc(NC(=O)CCN2CCOCC2)c1 ZINC000480913539 896272134 /nfs/dbraw/zinc/27/21/34/896272134.db2.gz UDKQDEOGGUGADU-IBGZPJMESA-N 0 3 421.541 4.253 20 0 HIADHN COC(=O)COc1ccc(CN(C)Cc2ccc(C(=O)Nc3ccccc3)cc2)cc1 ZINC000481117350 896442842 /nfs/dbraw/zinc/44/28/42/896442842.db2.gz SHLUFUDNKUREHA-UHFFFAOYSA-N 0 3 418.493 4.123 20 0 HIADHN COc1ccc([C@H](C)NC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)c(C)c1OC ZINC000481124457 896452194 /nfs/dbraw/zinc/45/21/94/896452194.db2.gz ZGTKCSXHRRJOBZ-AZUAARDMSA-N 0 3 411.546 4.037 20 0 HIADHN Cc1c([C@@H](C)NC[C@H](O)COCC(C)C)cnn1-c1ccc(Cl)cc1Cl ZINC000481165188 896499062 /nfs/dbraw/zinc/49/90/62/896499062.db2.gz CWMYRWVZPKUOOB-CJNGLKHVSA-N 0 3 400.350 4.172 20 0 HIADHN COc1cc([C@@H](C)N[C@H](C)c2sc(-c3cccnc3)nc2C)ccc1OCCO ZINC000481175051 896510015 /nfs/dbraw/zinc/51/00/15/896510015.db2.gz JYIKFPDBQYUVAZ-HUUCEWRRSA-N 0 3 413.543 4.305 20 0 HIADHN CNS(=O)(=O)c1ccc([C@H](C)N[C@@H](C)c2ccc(SCC(F)F)cc2)cc1 ZINC000481182912 896527722 /nfs/dbraw/zinc/52/77/22/896527722.db2.gz QNLBYPKKDCCEPG-KBPBESRZSA-N 0 3 414.543 4.364 20 0 HIADHN COCCC[C@@H](NCC(=O)N(C)Cc1ccccc1)c1ccc(Br)cc1 ZINC000481184676 896530599 /nfs/dbraw/zinc/53/05/99/896530599.db2.gz VKBPWBUQFLCNLQ-HXUWFJFHSA-N 0 3 419.363 4.165 20 0 HIADHN C[C@H](NC[C@@H](c1cccc(F)c1)N1CCOCC1)c1ccc(F)cc1OC(F)F ZINC000481231816 896583014 /nfs/dbraw/zinc/58/30/14/896583014.db2.gz IJYPKJXRAFWZAX-LIRRHRJNSA-N 0 3 412.427 4.290 20 0 HIADHN O=C(NCc1cnc(-c2ccc(Cl)cc2)s1)N1CCN(C2CCCC2)CC1 ZINC000505416145 914080119 /nfs/dbraw/zinc/08/01/19/914080119.db2.gz SAHRNNDSYZWABZ-UHFFFAOYSA-N 0 3 404.967 4.233 20 0 HIADHN CN1CCN(c2ncccc2CN[C@H]2CCCSc3ccc(Cl)cc32)CC1 ZINC000481241229 896591935 /nfs/dbraw/zinc/59/19/35/896591935.db2.gz JXHHMAAPXWVGFF-IBGZPJMESA-N 0 3 402.995 4.204 20 0 HIADHN C[C@H]1CCCN(S(=O)(=O)c2ccc(CN[C@@H]3CCc4cc(F)ccc43)cc2)C1 ZINC000481308230 896654455 /nfs/dbraw/zinc/65/44/55/896654455.db2.gz GBEKUWHHDJKYGK-KSFYIVLOSA-N 0 3 402.535 4.023 20 0 HIADHN C[C@@H](NCc1ccnc(N2CCCCC2)c1)c1ccc(OCc2nccn2C)cc1 ZINC000481313241 896662132 /nfs/dbraw/zinc/66/21/32/896662132.db2.gz KCNXYORFQRWUQX-LJQANCHMSA-N 0 3 405.546 4.235 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N[C@@H](c1ccc(OC)cc1)C(F)(F)F)c1ccco1 ZINC000481316811 896668088 /nfs/dbraw/zinc/66/80/88/896668088.db2.gz LBTVZOWFJGMOOM-XCRHUMRWSA-N 0 3 413.440 4.320 20 0 HIADHN COc1cc(C)c([C@H](C)N[C@H](C)c2ccc(OCC(=O)NC3CC3)cc2)cc1OC ZINC000481327749 896685466 /nfs/dbraw/zinc/68/54/66/896685466.db2.gz MBHRCYRYIXZIOX-SJORKVTESA-N 0 3 412.530 4.081 20 0 HIADHN Cc1nc(NC(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)ccc1Br ZINC000481343271 896712279 /nfs/dbraw/zinc/71/22/79/896712279.db2.gz QHVXKOGXTOUGQY-GDBMZVCRSA-N 0 3 403.324 4.110 20 0 HIADHN CN(C)C[C@@H](NC(=O)N[C@H](c1c(F)cccc1F)C(F)(F)F)c1ccc(F)cc1 ZINC000481357776 896734835 /nfs/dbraw/zinc/73/48/35/896734835.db2.gz GFXHXVLSCQVIOO-NVXWUHKLSA-N 0 3 419.369 4.309 20 0 HIADHN COC(=O)[C@@H]1CCCCCC[C@@H]1NCC(=O)Nc1c(Cl)cccc1C(F)(F)F ZINC000481430372 896831127 /nfs/dbraw/zinc/83/11/27/896831127.db2.gz GJRRJCZKJDKXDE-DOMZBBRYSA-N 0 3 420.859 4.399 20 0 HIADHN CC(C)NC(=O)Nc1ccc([C@@H](C)NCc2cccc(NC(=O)[C@H]3CCCO3)c2)cc1 ZINC000481535041 896895660 /nfs/dbraw/zinc/89/56/60/896895660.db2.gz PGVRMEKSFYWMOY-VGOFRKELSA-N 0 3 424.545 4.185 20 0 HIADHN CC(C)N(C)S(=O)(=O)c1ccc(CN[C@H](C)c2ccc(OC(F)F)cc2)cc1 ZINC000481539602 896899259 /nfs/dbraw/zinc/89/92/59/896899259.db2.gz DRKWYDQOCZYEHZ-OAHLLOKOSA-N 0 3 412.502 4.168 20 0 HIADHN CCCOc1ccc(CN(Cc2ccccc2)CC2CCS(=O)(=O)CC2)cc1 ZINC000481558772 896930094 /nfs/dbraw/zinc/93/00/94/896930094.db2.gz ZLYXMTSRSRHQGU-UHFFFAOYSA-N 0 3 401.572 4.302 20 0 HIADHN Cc1ccc(NC(=O)C[C@@H](C)N[C@H](CC(=O)N(C)C)c2ccccc2)c(Cl)c1 ZINC000481569323 896947911 /nfs/dbraw/zinc/94/79/11/896947911.db2.gz VVQHCWMKDCTLFK-OXQOHEQNSA-N 0 3 401.938 4.175 20 0 HIADHN Cc1cc2cc([C@H](C)NC[C@H](O)COc3ccc4c(c3)CCC(=O)N4)oc2cc1C ZINC000481571154 896950540 /nfs/dbraw/zinc/95/05/40/896950540.db2.gz LWOLKARBNRIWSS-LPHOPBHVSA-N 0 3 408.498 4.025 20 0 HIADHN C[C@H](NCc1ccc(-n2ccnc2)c(F)c1)c1ccc(OCc2nccn2C)cc1 ZINC000481572566 896952177 /nfs/dbraw/zinc/95/21/77/896952177.db2.gz YSNCIGLZURHUKY-KRWDZBQOSA-N 0 3 405.477 4.175 20 0 HIADHN COCCOc1ccc([C@H](C)NCc2cc3c(c(Br)c2)OCO3)cc1 ZINC000481578731 896957251 /nfs/dbraw/zinc/95/72/51/896957251.db2.gz GWMNFDAPQYQIAF-ZDUSSCGKSA-N 0 3 408.292 4.054 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)[C@H](C)Cc3cncc4ccccc43)cc2)CC1 ZINC000481642171 897027055 /nfs/dbraw/zinc/02/70/55/897027055.db2.gz RLFGJHPUHFASHO-HXUWFJFHSA-N 0 3 416.569 4.190 20 0 HIADHN COc1cccc([C@H]2C[C@@H]2C(=O)Nc2cc(C)cc(N3CCN(C(C)C)CC3)c2)c1 ZINC000481644618 897029734 /nfs/dbraw/zinc/02/97/34/897029734.db2.gz MEQGGPCEHUVUOH-RPWUZVMVSA-N 0 3 407.558 4.276 20 0 HIADHN COc1cccc([C@@H]2C[C@@H]2C(=O)Nc2cc(C)cc(N3CCN(C(C)C)CC3)c2)c1 ZINC000481644619 897030416 /nfs/dbraw/zinc/03/04/16/897030416.db2.gz MEQGGPCEHUVUOH-ZEQRLZLVSA-N 0 3 407.558 4.276 20 0 HIADHN COc1ccc(C(=O)CCC(=O)Nc2cc(C)cc(N3CCN(C(C)C)CC3)c2)cc1 ZINC000481656822 897041216 /nfs/dbraw/zinc/04/12/16/897041216.db2.gz MBYLCGCILXCCSA-UHFFFAOYSA-N 0 3 423.557 4.136 20 0 HIADHN Cc1cc(NC(=O)CCC(=O)c2ccc(F)cc2)cc(N2CCN(C(C)C)CC2)c1 ZINC000481663768 897048325 /nfs/dbraw/zinc/04/83/25/897048325.db2.gz FKKPWODNRFCQLQ-UHFFFAOYSA-N 0 3 411.521 4.266 20 0 HIADHN Cc1cc(NC(=O)c2csc([C@H]3CCCO3)n2)cc(N2CCN(C(C)C)CC2)c1 ZINC000481675887 897059146 /nfs/dbraw/zinc/05/91/46/897059146.db2.gz WVRYWGVYTKWRPI-HXUWFJFHSA-N 0 3 414.575 4.086 20 0 HIADHN C[C@H](OC[C@H](O)CN1CCC[C@@]2(C1)OCc1ccccc12)c1ccc(Cl)cc1 ZINC000481699424 897086582 /nfs/dbraw/zinc/08/65/82/897086582.db2.gz BEERZZPKWMAPKJ-LXBDKUERSA-N 0 3 401.934 4.300 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)c2ccc(-c3cncnc3)cc2F)CC1 ZINC000481776916 897160530 /nfs/dbraw/zinc/16/05/30/897160530.db2.gz ITVZXNILZNBZHS-UHFFFAOYSA-N 0 3 404.489 4.019 20 0 HIADHN C[C@@H]([C@H](C)NC(=O)N(C)C1CCN(CCc2ccccn2)CC1)C1CCCCC1 ZINC000481783494 897165416 /nfs/dbraw/zinc/16/54/16/897165416.db2.gz GEZSHFJLJRWJAF-PMACEKPBSA-N 0 3 400.611 4.335 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)c1ccc(-c2cncnc2)cc1F ZINC000481784773 897167246 /nfs/dbraw/zinc/16/72/46/897167246.db2.gz IAFPTAAXURRLAO-GOSISDBHSA-N 0 3 404.489 4.019 20 0 HIADHN COc1cc2nc(CN[C@@H](C)C3(c4ccccc4)CCCC3)[nH]c(=O)c2cc1OC ZINC000481841490 897207521 /nfs/dbraw/zinc/20/75/21/897207521.db2.gz WXEUHUPZKAJRDY-INIZCTEOSA-N 0 3 407.514 4.343 20 0 HIADHN O=C(c1ccc(-c2cncnc2)cc1F)N1CCCN(CCCc2ccccc2)CC1 ZINC000481889315 897265808 /nfs/dbraw/zinc/26/58/08/897265808.db2.gz GQKFCPOSEMMKCA-UHFFFAOYSA-N 0 3 418.516 4.063 20 0 HIADHN CC[C@@H](N[C@H](CC)c1ccc(Cl)c(S(=O)(=O)NC)c1)c1ccc(OC)cc1 ZINC000481912021 897294670 /nfs/dbraw/zinc/29/46/70/897294670.db2.gz IAOKLHOEHWHJKY-RTBURBONSA-N 0 3 410.967 4.449 20 0 HIADHN COc1ccc(-c2ccncc2)cc1CN1CCC[C@@H](C(=O)Nc2ccc(C)cn2)C1 ZINC000481913517 897295698 /nfs/dbraw/zinc/29/56/98/897295698.db2.gz NSEZRBQLXMZUDG-OAQYLSRUSA-N 0 3 416.525 4.311 20 0 HIADHN CN(C)CCN(C(=O)Nc1nnc(-c2c(F)cccc2Cl)s1)C1CCCC1 ZINC000481920080 897304237 /nfs/dbraw/zinc/30/42/37/897304237.db2.gz LCGGBHADFYWUAM-UHFFFAOYSA-N 0 3 411.934 4.336 20 0 HIADHN COc1ccc(-c2ccncc2)cc1CN1CCC(NC(=O)c2ccccc2)CC1 ZINC000481921685 897306270 /nfs/dbraw/zinc/30/62/70/897306270.db2.gz XIMIVQIORUDYFA-UHFFFAOYSA-N 0 3 401.510 4.152 20 0 HIADHN COc1ccc(-c2ccncc2)cc1CN1CCC(NC(=O)c2ccccc2C)CC1 ZINC000481930840 897314088 /nfs/dbraw/zinc/31/40/88/897314088.db2.gz XUSOUROVYIMGCU-UHFFFAOYSA-N 0 3 415.537 4.460 20 0 HIADHN CN(C)C[C@@H](NC(=O)Nc1cccc(-n2cc(C(F)(F)F)cn2)c1)c1ccccc1 ZINC000481942169 897328855 /nfs/dbraw/zinc/32/88/55/897328855.db2.gz GMHPMSDQFGBGKS-LJQANCHMSA-N 0 3 417.435 4.316 20 0 HIADHN COc1cc(F)c([C@@H](C)NC[C@H](c2ccc(Cl)cc2)N2CCOCC2)cc1OC ZINC000481957337 897347349 /nfs/dbraw/zinc/34/73/49/897347349.db2.gz FZZVIBVORMHHPH-FOIQADDNSA-N 0 3 422.928 4.220 20 0 HIADHN COc1ccc(-c2ccncc2)cc1CN1CCC(C(=O)NC2CCCCC2)CC1 ZINC000481989715 897383963 /nfs/dbraw/zinc/38/39/63/897383963.db2.gz HFUFFUDHDXVUQH-UHFFFAOYSA-N 0 3 407.558 4.418 20 0 HIADHN COC(=O)c1ccc(-c2ccc(CN3CCC(C(=O)NC4CCCCC4)CC3)o2)cc1 ZINC000481988484 897384364 /nfs/dbraw/zinc/38/43/64/897384364.db2.gz CEUSLHYZUBDWMS-UHFFFAOYSA-N 0 3 424.541 4.394 20 0 HIADHN Cc1cc(NC(=O)c2ccnc(N3CC[C@H](C)C3)c2)cc(N2CCN(C(C)C)CC2)c1 ZINC000482038705 897454592 /nfs/dbraw/zinc/45/45/92/897454592.db2.gz ZLIQYOOHZBHTQO-IBGZPJMESA-N 0 3 421.589 4.019 20 0 HIADHN COc1ccc(OC)c([C@@H](C)N[C@@H](C)CC(=O)Nc2cccc(N3CCCC3)c2)c1 ZINC000482087675 897529461 /nfs/dbraw/zinc/52/94/61/897529461.db2.gz GKIGVVBEQTWGAP-ZWKOTPCHSA-N 0 3 411.546 4.372 20 0 HIADHN CCOc1ccc([C@H](C)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)cc1OCC ZINC000482106369 897555501 /nfs/dbraw/zinc/55/55/01/897555501.db2.gz AXHHAHGHTHNEMS-SIKLNZKXSA-N 0 3 410.558 4.368 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)Nc1nc(-c2ccccc2F)co1 ZINC000482123754 897579372 /nfs/dbraw/zinc/57/93/72/897579372.db2.gz IANQTZIJAHFNOA-UHFFFAOYSA-N 0 3 408.477 4.022 20 0 HIADHN CCO[C@H]1C[C@H](NCC(=O)Nc2cc3c(cc2Cl)OCCCO3)C1(CC)CC ZINC000482144717 897605346 /nfs/dbraw/zinc/60/53/46/897605346.db2.gz BKURJUYEQHRLCP-OALUTQOASA-N 0 3 410.942 4.013 20 0 HIADHN CC1(C)C[C@@H](NCC(=O)N2N=C(c3cccs3)C[C@@H]2c2cccs2)C(C)(C)O1 ZINC000482165391 897630170 /nfs/dbraw/zinc/63/01/70/897630170.db2.gz RHJZNNSBOIJBQJ-CRAIPNDOSA-N 0 3 417.600 4.423 20 0 HIADHN COC(=O)c1ccc(Cl)c(CNCc2ccccc2CN2C[C@H](C)O[C@@H](C)C2)c1 ZINC000482247861 897729698 /nfs/dbraw/zinc/72/96/98/897729698.db2.gz VQBZWFKCFVZMLV-IRXDYDNUSA-N 0 3 416.949 4.026 20 0 HIADHN COC(=O)c1ccc(Cl)c(CNCc2ccccc2CN2C[C@@H](C)O[C@H](C)C2)c1 ZINC000482247860 897729953 /nfs/dbraw/zinc/72/99/53/897729953.db2.gz VQBZWFKCFVZMLV-IAGOWNOFSA-N 0 3 416.949 4.026 20 0 HIADHN CCC[C@H](N[C@@H](C)c1ccc(-n2ccnc2)cc1)C(=O)N1CCc2sccc2C1 ZINC000482253635 897735010 /nfs/dbraw/zinc/73/50/10/897735010.db2.gz RFFUYMAYLFFBGD-UWJYYQICSA-N 0 3 408.571 4.338 20 0 HIADHN O=C(N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1)c1cccc(CN2CCCC2)c1 ZINC000482259406 897742150 /nfs/dbraw/zinc/74/21/50/897742150.db2.gz DVCAJVNCROQYSL-LJQANCHMSA-N 0 3 417.475 4.310 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)c2ccc(Oc3cccnc3)cc2)c1 ZINC000482344019 897852690 /nfs/dbraw/zinc/85/26/90/897852690.db2.gz MLVUSVVCHNMCHF-UHFFFAOYSA-N 0 3 405.498 4.087 20 0 HIADHN Cc1c(C(=O)N[C@H](CN2CCCC2)c2ccccc2)cnn1-c1ccccc1Cl ZINC000482359348 897876409 /nfs/dbraw/zinc/87/64/09/897876409.db2.gz FZNPZWVQBOHBDN-OAQYLSRUSA-N 0 3 408.933 4.401 20 0 HIADHN CN(C)[C@@H](CNC(=O)N[C@H](c1c(F)cccc1F)C(F)(F)F)c1ccccc1 ZINC000482404291 897944506 /nfs/dbraw/zinc/94/45/06/897944506.db2.gz MLBLCCDSKXXSNG-DOTOQJQBSA-N 0 3 401.379 4.170 20 0 HIADHN CC(C)CN(CCN(C)C)C(=O)N[C@H](c1ccc(OC(F)F)cc1)C(F)(F)F ZINC000482427745 897982227 /nfs/dbraw/zinc/98/22/27/897982227.db2.gz XXSCRMFAMDDHEW-OAHLLOKOSA-N 0 3 411.415 4.121 20 0 HIADHN CC(C)CCC[C@H](NCc1cccnc1N1CCC(C(N)=O)CC1)c1ccccc1 ZINC000482455748 898024986 /nfs/dbraw/zinc/02/49/86/898024986.db2.gz QVUJRDCLJODQDA-QHCPKHFHSA-N 0 3 408.590 4.441 20 0 HIADHN COc1ccc([C@@H](CCC(C)C)NCc2cccnc2N2CCC(C(N)=O)CC2)cc1 ZINC000482458564 898031158 /nfs/dbraw/zinc/03/11/58/898031158.db2.gz SYTKYPQFZXXCNE-HSZRJFAPSA-N 0 3 424.589 4.059 20 0 HIADHN CC(=O)c1cccc(C(=O)N(C[C@H]2CCN(Cc3ccccc3)C2)CC(F)(F)F)c1 ZINC000482492206 898072194 /nfs/dbraw/zinc/07/21/94/898072194.db2.gz TVSBSLRIHBDPFT-IBGZPJMESA-N 0 3 418.459 4.416 20 0 HIADHN Cc1c([C@@H](C)N[C@@H](C)Cc2ccc(O)cc2)nnn1-c1cccc(Br)c1 ZINC000482502461 898085279 /nfs/dbraw/zinc/08/52/79/898085279.db2.gz COLPWRPWELMXRO-UONOGXRCSA-N 0 3 415.335 4.326 20 0 HIADHN CC(=O)N[C@H](C)C1CCN(Cc2cccc(NC(=O)c3ccccc3Cl)c2)CC1 ZINC000482511601 898097374 /nfs/dbraw/zinc/09/73/74/898097374.db2.gz NPERSEUKXWWONA-MRXNPFEDSA-N 0 3 413.949 4.329 20 0 HIADHN C[C@H](N[C@@H](C)c1cc(F)ccc1N1CCN(C)CC1)c1ccc(F)cc1N(C)C ZINC000482544600 898133000 /nfs/dbraw/zinc/13/30/00/898133000.db2.gz TWIHJUWWCWQNJA-IRXDYDNUSA-N 0 3 402.533 4.194 20 0 HIADHN COc1ccc(OC)c([C@H](C)N[C@@H](C)c2cc(F)ccc2N2CCN(C)CC2)c1 ZINC000482553196 898143184 /nfs/dbraw/zinc/14/31/84/898143184.db2.gz DJMXHLCCXTVDNV-IRXDYDNUSA-N 0 3 401.526 4.007 20 0 HIADHN C[C@@H](N[C@@H](C)c1cc(F)ccc1N1CCN(C)CC1)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000482564078 898156275 /nfs/dbraw/zinc/15/62/75/898156275.db2.gz HEGKYDCGCZZZIR-SJORKVTESA-N 0 3 424.564 4.219 20 0 HIADHN COCCOc1ccc([C@H](C)N[C@@H](C)c2cc(F)ccc2N2CCN(C)CC2)cc1 ZINC000482564868 898156402 /nfs/dbraw/zinc/15/64/02/898156402.db2.gz LXHJNKWRSACURB-OALUTQOASA-N 0 3 415.553 4.015 20 0 HIADHN C[C@H](N[C@@H](C)c1cc(F)ccc1N1CCN(C)CC1)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000482564075 898156433 /nfs/dbraw/zinc/15/64/33/898156433.db2.gz HEGKYDCGCZZZIR-IRXDYDNUSA-N 0 3 424.564 4.219 20 0 HIADHN Cc1cccc(NC(=O)N2CCC[C@H](C(=O)Nc3cc(CN(C)C)ccc3C)C2)c1 ZINC000482619281 898221298 /nfs/dbraw/zinc/22/12/98/898221298.db2.gz UUONCSPFTPILRX-FQEVSTJZSA-N 0 3 408.546 4.248 20 0 HIADHN COc1ccc(C(C)(C)CN[C@H](C)c2nnn(-c3ccc(F)cc3)c2C)cc1OC ZINC000482637597 898242070 /nfs/dbraw/zinc/24/20/70/898242070.db2.gz BRMQLDPPDBTFPH-OAHLLOKOSA-N 0 3 412.509 4.360 20 0 HIADHN COc1ccccc1OC[C@@H](C)CNCc1csc(-c2ccc3c(c2)OCO3)n1 ZINC000482662222 898265347 /nfs/dbraw/zinc/26/53/47/898265347.db2.gz KKRDTOXBENCLEM-HNNXBMFYSA-N 0 3 412.511 4.352 20 0 HIADHN CC(C)(C)c1nn(Cc2ccccc2)cc1CN[C@@H]1CCN(C(=O)C2CCCCC2)C1 ZINC000482788097 898397497 /nfs/dbraw/zinc/39/74/97/898397497.db2.gz LLHJDFBGUNBBOI-HSZRJFAPSA-N 0 3 422.617 4.500 20 0 HIADHN C[C@@H](CC(=O)NC1CCN(CCOc2ccc(F)cc2)CC1)c1ccc(F)cc1F ZINC000505551179 914253592 /nfs/dbraw/zinc/25/35/92/914253592.db2.gz QZGUNLRKBFGRLE-INIZCTEOSA-N 0 3 420.475 4.257 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CC=C(COC)CC1)c1ccc(C(F)(F)F)cc1 ZINC000482877695 898490386 /nfs/dbraw/zinc/49/03/86/898490386.db2.gz RTVZRAXXVHFPRM-LJQANCHMSA-N 0 3 413.484 4.076 20 0 HIADHN CCN(Cc1ccccc1)C(=O)[C@H](C)N1CCC(n2c(C)nc3ccccc32)CC1 ZINC000482885155 898499224 /nfs/dbraw/zinc/49/92/24/898499224.db2.gz GTICURQLDSFNCN-IBGZPJMESA-N 0 3 404.558 4.419 20 0 HIADHN Cc1nc2ccccc2n1C1CCN([C@H](C)C(=O)N2CCc3sccc3C2)CC1 ZINC000482887712 898502464 /nfs/dbraw/zinc/50/24/64/898502464.db2.gz IXNYLGADRUWZIM-MRXNPFEDSA-N 0 3 408.571 4.017 20 0 HIADHN Cc1nc2ccccc2n1C1CCN([C@H](C)C(=O)N(C)Cc2cccc(F)c2)CC1 ZINC000482902426 898520329 /nfs/dbraw/zinc/52/03/29/898520329.db2.gz QWYHDCYMDQHWEZ-QGZVFWFLSA-N 0 3 408.521 4.168 20 0 HIADHN CC(C)NC(=O)Nc1ccc([C@H](C)NCc2ccnc(OC3CCOCC3)c2)cc1 ZINC000482944265 898568497 /nfs/dbraw/zinc/56/84/97/898568497.db2.gz KQHZIMMQSOJLNB-KRWDZBQOSA-N 0 3 412.534 4.020 20 0 HIADHN O=C1NC2(CCCCC2)C(=O)N1Cc1ccccc1CN[C@@H]1CCc2c1cccc2F ZINC000482951491 898579901 /nfs/dbraw/zinc/57/99/01/898579901.db2.gz BDUCDBSXTREQFL-JOCHJYFZSA-N 0 3 421.516 4.358 20 0 HIADHN C[C@H](NCc1ccnc(OC2CCC(C)CC2)c1)c1ccc(NS(C)(=O)=O)cc1 ZINC000482957849 898586665 /nfs/dbraw/zinc/58/66/65/898586665.db2.gz JDTQZKKSHMQECW-BATSVXPKSA-N 0 3 417.575 4.261 20 0 HIADHN CO[C@]1(C)CCCN(CC(=O)N[C@H](c2ccccc2)c2ccc(Cl)cc2)CC1 ZINC000483028575 898690314 /nfs/dbraw/zinc/69/03/14/898690314.db2.gz QTNGVESRHALOHY-DHIUTWEWSA-N 0 3 400.950 4.437 20 0 HIADHN C[C@@H]1CN(C(=O)Nc2ccccc2SC2CCCC2)CC[C@@H]1N1CCN(C)CC1 ZINC000483056623 898729719 /nfs/dbraw/zinc/72/97/19/898729719.db2.gz HCHHJVBAFHEYDY-NQIIRXRSSA-N 0 3 416.635 4.211 20 0 HIADHN COc1c(Br)c(C)sc1C(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C ZINC000505573824 914279838 /nfs/dbraw/zinc/27/98/38/914279838.db2.gz FDIORYQSMDAXDX-NHYWBVRUSA-N 0 3 411.365 4.249 20 0 HIADHN COc1cc([C@H](C)N[C@@H](Cc2ccccc2)[C@@H](O)C(F)F)ccc1OC(F)F ZINC000483137712 898817032 /nfs/dbraw/zinc/81/70/32/898817032.db2.gz VGTOXMRRRPEXCF-XLWVJDPXSA-N 0 3 401.400 4.185 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)N[C@@H](C)c2ccccc2C(F)(F)F)cc1 ZINC000483142637 898821512 /nfs/dbraw/zinc/82/15/12/898821512.db2.gz XILMSDNERQLXIS-LIRRHRJNSA-N 0 3 409.452 4.377 20 0 HIADHN COc1cc(F)c([C@@H](C)N[C@@H]2CCN(c3ccccc3OC(F)F)C2)cc1OC ZINC000483162026 898832591 /nfs/dbraw/zinc/83/25/91/898832591.db2.gz UTZUNUABCTWLBF-ZIAGYGMSSA-N 0 3 410.436 4.374 20 0 HIADHN COc1ccc(C[C@@H](N[C@H]2CCC(=O)N(C)C2)c2cc(Cl)ccc2Cl)cc1 ZINC000483293334 898927833 /nfs/dbraw/zinc/92/78/33/898927833.db2.gz GOJBDAANSORJES-OXJNMPFZSA-N 0 3 407.341 4.496 20 0 HIADHN CCCN(C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C)[C@H]1CCCc2cccnc21 ZINC000483313434 898939808 /nfs/dbraw/zinc/93/98/08/898939808.db2.gz WWLOIWWHXJPSLA-PMOQBDJRSA-N 0 3 406.574 4.401 20 0 HIADHN CCN(C)c1ccc(CNCc2ccccc2-c2ccc(Cn3cncn3)cc2)cn1 ZINC000483316647 898943687 /nfs/dbraw/zinc/94/36/87/898943687.db2.gz QTYDDDZJIMTZLZ-UHFFFAOYSA-N 0 3 412.541 4.134 20 0 HIADHN CC1(C)CN(CCC(=O)Nc2ccccc2Oc2ccccc2)C[C@]2(CCCOC2)O1 ZINC000483336626 898967291 /nfs/dbraw/zinc/96/72/91/898967291.db2.gz FRQSGUWHXFWZMJ-VWLOTQADSA-N 0 3 424.541 4.468 20 0 HIADHN CS[C@H]1CN(C(=O)c2sc(-c3ccc(F)c(F)c3)nc2C)C[C@H]1N1CCCC1 ZINC000483393970 899028958 /nfs/dbraw/zinc/02/89/58/899028958.db2.gz IPBIBSVDSBDPMG-SJORKVTESA-N 0 3 423.554 4.049 20 0 HIADHN C[C@H](NC(=O)C1CCC(NC(=O)CC2CCCC2)CC1)[C@H](c1ccccc1)N(C)C ZINC000505610004 914313890 /nfs/dbraw/zinc/31/38/90/914313890.db2.gz LSRDSGCLUBDOBL-HNRNTVDCSA-N 0 3 413.606 4.049 20 0 HIADHN Cc1ccc(OCc2nc(CC(=O)N[C@@H](C)[C@@H](c3ccccc3)N(C)C)cs2)cc1 ZINC000505613638 914317667 /nfs/dbraw/zinc/31/76/67/914317667.db2.gz ZTBDHVPOWIYDMY-UUOWRZLLSA-N 0 3 423.582 4.381 20 0 HIADHN Cc1ccc([C@H](NC(=O)CN2CCN(C3CCCCC3)CC2)c2cccs2)cc1 ZINC000483487659 899140404 /nfs/dbraw/zinc/14/04/04/899140404.db2.gz RNYAFEGUYDNGMN-DEOSSOPVSA-N 0 3 411.615 4.212 20 0 HIADHN CCCCCn1nc(C)cc1NC(=O)N(CCN(C)C)Cc1ccc(F)c(F)c1 ZINC000483489254 899142143 /nfs/dbraw/zinc/14/21/43/899142143.db2.gz KYVALBRTSLXZAV-UHFFFAOYSA-N 0 3 407.509 4.256 20 0 HIADHN CCn1c(CNC2CCN(c3nccs3)CC2)nc2cc(Br)ccc21 ZINC000483508184 899169562 /nfs/dbraw/zinc/16/95/62/899169562.db2.gz KGHJYMYRMXCEBY-UHFFFAOYSA-N 0 3 420.380 4.034 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)Nc1ccc(OC2CCC2)c(F)c1 ZINC000483517997 899180072 /nfs/dbraw/zinc/18/00/72/899180072.db2.gz HCJMVTANIVGGEO-UHFFFAOYSA-N 0 3 403.473 4.492 20 0 HIADHN COc1ccccc1-c1noc([C@H](C)N[C@H]2C[C@@H](C)CN(Cc3ccccc3)C2)n1 ZINC000483645571 899300891 /nfs/dbraw/zinc/30/08/91/899300891.db2.gz ASQRQWCWNSJGMG-HBFSDRIKSA-N 0 3 406.530 4.306 20 0 HIADHN C[C@](CO)(CNCc1nc(-c2ccc(Br)cc2)c[nH]1)Cc1ccccc1 ZINC000483650938 899308045 /nfs/dbraw/zinc/30/80/45/899308045.db2.gz YUHHMZJMSJCOCC-OAQYLSRUSA-N 0 3 414.347 4.170 20 0 HIADHN COc1ccc2[nH]c3c(c2c1)C[C@@H](N[C@H](C)c1nc(-c2ccccc2OC)no1)CC3 ZINC000483656477 899315774 /nfs/dbraw/zinc/31/57/74/899315774.db2.gz QVRXHDOZTNJMGR-CABCVRRESA-N 0 3 418.497 4.443 20 0 HIADHN CCOc1ccccc1[C@H](CC(C)C)N[C@H](C)c1ccc(S(=O)(=O)NC)cc1 ZINC000483706630 899361523 /nfs/dbraw/zinc/36/15/23/899361523.db2.gz CUPGXASGZWMDDV-UTKZUKDTSA-N 0 3 404.576 4.431 20 0 HIADHN Cc1ccc(NC(=O)c2n[nH]c(-c3ccccc3)c2Br)c(CN(C)C)c1 ZINC000505641378 914341710 /nfs/dbraw/zinc/34/17/10/914341710.db2.gz YXVLZLWAYUZINF-UHFFFAOYSA-N 0 3 413.319 4.462 20 0 HIADHN Cc1nc(C)c([C@@H](C)NCc2cc(C(F)(F)F)ccc2N2CCN(C)CC2)s1 ZINC000483732322 899393459 /nfs/dbraw/zinc/39/34/59/899393459.db2.gz MHNDHNSQSSEYKV-CYBMUJFWSA-N 0 3 412.525 4.381 20 0 HIADHN Cc1ccc2nc(C(=O)Nc3ccnn3[C@H]3CCN(Cc4ccccc4)C3)ccc2c1 ZINC000483795934 899468435 /nfs/dbraw/zinc/46/84/35/899468435.db2.gz FNBNAYUCPXDVOO-NRFANRHFSA-N 0 3 411.509 4.439 20 0 HIADHN C[C@@H](NC(=O)Nc1cc(-c2ccc(F)cc2F)nn1C)[C@H](c1ccccc1)N(C)C ZINC000483800148 899473715 /nfs/dbraw/zinc/47/37/15/899473715.db2.gz FYLUMIOIDVVBPX-SPLOXXLWSA-N 0 3 413.472 4.178 20 0 HIADHN Cc1ccc(-c2cc(C(=O)N(CCN(C)C)C3CC3)c3cnn(C(C)C)c3n2)s1 ZINC000505653636 914351478 /nfs/dbraw/zinc/35/14/78/914351478.db2.gz FSXJCADOLMFBCS-UHFFFAOYSA-N 0 3 411.575 4.215 20 0 HIADHN Cn1ccc(C(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)c1C1CCC1 ZINC000483806467 899482043 /nfs/dbraw/zinc/48/20/43/899482043.db2.gz SVRJLSFNYLPPHY-HXUWFJFHSA-N 0 3 403.530 4.188 20 0 HIADHN Cc1ccc(NC(=O)c2cccc(CS(=O)(=O)c3ccccc3)c2)c(CN(C)C)c1 ZINC000505656691 914355946 /nfs/dbraw/zinc/35/59/46/914355946.db2.gz LNJYGDQWZXQNLJ-UHFFFAOYSA-N 0 3 422.550 4.283 20 0 HIADHN CC[C@@H]1Oc2cc([C@H](C)N[C@@H](C)c3cc(OC)c(OC)c(OC)c3)ccc2NC1=O ZINC000483850035 899530733 /nfs/dbraw/zinc/53/07/33/899530733.db2.gz OEMACUCIKCUYEW-DEYYWGMASA-N 0 3 414.502 4.234 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N[C@@H](c1ccccc1Cl)C(C)C ZINC000483971596 899616830 /nfs/dbraw/zinc/61/68/30/899616830.db2.gz IUXAJNLFOXBHRD-HXUWFJFHSA-N 0 3 401.938 4.162 20 0 HIADHN Cc1ccc([C@H](NC(=O)C(=O)Nc2cc(CN(C)C)ccc2C)c2ccccc2)cc1 ZINC000483994341 899633632 /nfs/dbraw/zinc/63/36/32/899633632.db2.gz PTHRMLADCOOYMN-XMMPIXPASA-N 0 3 415.537 4.209 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)NC[C@H]1CCCC[C@@H]1C(F)(F)F ZINC000484024539 899657574 /nfs/dbraw/zinc/65/75/74/899657574.db2.gz BLDKLUXNFHKFAA-PBHICJAKSA-N 0 3 421.454 4.407 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)NC[C@H]1CCCC[C@@H]1C(F)(F)F ZINC000484048927 899680553 /nfs/dbraw/zinc/68/05/53/899680553.db2.gz VZVMJLUVDRJEMN-CVEARBPZSA-N 0 3 421.454 4.407 20 0 HIADHN O=C(c1cnc(Cc2ccccc2F)s1)N1C[C@@H]2CCCN2Cc2ccccc21 ZINC000484060344 899694112 /nfs/dbraw/zinc/69/41/12/899694112.db2.gz VRXZMYAIEFVUQL-SFHVURJKSA-N 0 3 407.514 4.498 20 0 HIADHN O=C(c1cn(-c2ccccc2)nc1-c1cccnc1)N1CCN(C2CCCCC2)CC1 ZINC000484102118 899729024 /nfs/dbraw/zinc/72/90/24/899729024.db2.gz AKTILZLDTCEOBQ-UHFFFAOYSA-N 0 3 415.541 4.025 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)Nc1nnc(/C=C/c2ccco2)s1 ZINC000484126566 899748456 /nfs/dbraw/zinc/74/84/56/899748456.db2.gz FRABEFAEXNLNRS-DOJUMQAQSA-N 0 3 409.515 4.260 20 0 HIADHN CCCc1nc(C)c(C(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)o1 ZINC000484156346 899776460 /nfs/dbraw/zinc/77/64/60/899776460.db2.gz IPYLXKSEWXPCMG-LJQANCHMSA-N 0 3 407.518 4.140 20 0 HIADHN Cc1cc(NC(=O)c2cc(O)ccc2Cl)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000484156340 899777078 /nfs/dbraw/zinc/77/70/78/899777078.db2.gz IOYSUPIRAQYNPL-QGZVFWFLSA-N 0 3 410.905 4.250 20 0 HIADHN CCN(C(=O)c1cnn(-c2ccccc2C)c1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000484165502 899785505 /nfs/dbraw/zinc/78/55/05/899785505.db2.gz TXLRBGAKGURMSM-OFNKIYASSA-N 0 3 402.542 4.478 20 0 HIADHN CCN(C(=O)C(=O)Nc1cc(CN(C)C)ccc1C)[C@H](C)c1cc2ccccc2o1 ZINC000484186278 899801300 /nfs/dbraw/zinc/80/13/00/899801300.db2.gz AZFAVZXMSBEBPP-QGZVFWFLSA-N 0 3 407.514 4.351 20 0 HIADHN COc1cc([C@H](C)N[C@@H](C)c2ccc(-n3ccnc3C)cc2)ccc1S(C)(=O)=O ZINC000484306539 899866250 /nfs/dbraw/zinc/86/62/50/899866250.db2.gz XBKAJWCQGRQCKL-HOTGVXAUSA-N 0 3 413.543 4.005 20 0 HIADHN COc1ccccc1-c1nc(C2CCN(CCC(=O)Nc3ccccc3F)CC2)no1 ZINC000484317871 899876054 /nfs/dbraw/zinc/87/60/54/899876054.db2.gz YDQRCZJUFJAHBY-UHFFFAOYSA-N 0 3 424.476 4.093 20 0 HIADHN Cc1csc2nc(CN[C@@](C)(c3ccc(Br)cc3)C(C)C)cc(=O)n12 ZINC000484325272 899880527 /nfs/dbraw/zinc/88/05/27/899880527.db2.gz BQUDAMXZZAMVKZ-LJQANCHMSA-N 0 3 420.376 4.488 20 0 HIADHN COc1cc(C(=O)NCc2ccccc2C[N@H+](C)C2CCCCC2)cc(OC)c1[O-] ZINC000484387737 899921042 /nfs/dbraw/zinc/92/10/42/899921042.db2.gz SDTZYTOFFSAJKZ-UHFFFAOYSA-N 0 3 412.530 4.104 20 0 HIADHN COc1cc(C(=O)NCc2ccccc2C[N@@H+](C)C2CCCCC2)cc(OC)c1[O-] ZINC000484387737 899921052 /nfs/dbraw/zinc/92/10/52/899921052.db2.gz SDTZYTOFFSAJKZ-UHFFFAOYSA-N 0 3 412.530 4.104 20 0 HIADHN CSc1cccc(N(C(=O)COc2cccc(C(C)=O)c2)C2CCN(C)CC2)c1 ZINC000484398626 899924630 /nfs/dbraw/zinc/92/46/30/899924630.db2.gz CBQIYSDKRMGSJM-UHFFFAOYSA-N 0 3 412.555 4.117 20 0 HIADHN Cc1c([C@H](C)NCCC2CCN(CC(F)(F)F)CC2)nnn1-c1ccc(F)cc1 ZINC000484468988 899962211 /nfs/dbraw/zinc/96/22/11/899962211.db2.gz CLIJLXZKTZTDAN-AWEZNQCLSA-N 0 3 413.463 4.030 20 0 HIADHN O[C@@H](CN[C@H]1CCCc2nc(-c3ccc(Br)cc3)sc21)C(F)F ZINC000484469010 899962617 /nfs/dbraw/zinc/96/26/17/899962617.db2.gz CSWICZODKJGFKS-AAEUAGOBSA-N 0 3 403.292 4.166 20 0 HIADHN CN1CCC[C@@H](N[C@@H]2CCCc3nc(-c4ccc(Br)cc4)sc32)C1=O ZINC000484479812 899971805 /nfs/dbraw/zinc/97/18/05/899971805.db2.gz ZMYBZNLNFGCGFK-GDBMZVCRSA-N 0 3 420.376 4.160 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2cc(F)ccc2OC(F)F)c1 ZINC000484498024 899988266 /nfs/dbraw/zinc/98/82/66/899988266.db2.gz KKNSNPPFFPTYTO-UHFFFAOYSA-N 0 3 411.424 4.031 20 0 HIADHN Cc1ccc(OC(F)F)c([C@@H](C)N[C@H]2CCN(C(=O)CCc3ccccc3)C2)c1 ZINC000484502101 899992155 /nfs/dbraw/zinc/99/21/55/899992155.db2.gz JXCHHPXZTZGFFA-MJGOQNOKSA-N 0 3 402.485 4.481 20 0 HIADHN O=C(C1CCCCC1)N1CC[C@@H](N[C@H]2CCCOc3c(Br)cccc32)C1 ZINC000484507098 899997585 /nfs/dbraw/zinc/99/75/85/899997585.db2.gz YMTPURFIURYRCY-APWZRJJASA-N 0 3 421.379 4.434 20 0 HIADHN O[C@H](CN[C@@H](Cn1cnc2ccccc21)c1ccc(F)cc1)COc1ccccc1F ZINC000484549442 900029370 /nfs/dbraw/zinc/02/93/70/900029370.db2.gz VHEYWTZOBWCZAG-KNQAVFIVSA-N 0 3 423.463 4.085 20 0 HIADHN Brc1ccc(-c2nccc(CN[C@H]3CCCC[C@H]3n3cccn3)n2)cc1 ZINC000484626362 900078998 /nfs/dbraw/zinc/07/89/98/900078998.db2.gz IRZOOIRZGMGNGK-RBUKOAKNSA-N 0 3 412.335 4.376 20 0 HIADHN Cc1nccc(NC(=O)N(CCN2CCCC2)Cc2ccc(Cl)c(Cl)c2)n1 ZINC000484667059 900110070 /nfs/dbraw/zinc/11/00/70/900110070.db2.gz WKGQSBNHYLUMEC-UHFFFAOYSA-N 0 3 408.333 4.222 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)NCC1(c2ccccc2C)CCOCC1)c1ccco1 ZINC000484948933 900316566 /nfs/dbraw/zinc/31/65/66/900316566.db2.gz UQDSRPSFCPMZEG-CTNGQTDRSA-N 0 3 413.562 4.065 20 0 HIADHN COc1cccc(NC(=O)CCN2CCC(C(=O)c3ccc(Cl)cc3)CC2)c1 ZINC000485054086 900383810 /nfs/dbraw/zinc/38/38/10/900383810.db2.gz LWTXZRUTNGJAPU-UHFFFAOYSA-N 0 3 400.906 4.272 20 0 HIADHN CC(C)(C)OC(=O)C1CCN(CCC(=O)Nc2cccc(C(F)(F)F)c2)CC1 ZINC000485122693 900427154 /nfs/dbraw/zinc/42/71/54/900427154.db2.gz KVZMELOBTAYLAD-UHFFFAOYSA-N 0 3 400.441 4.088 20 0 HIADHN CC(C)c1c(NC(=O)N2CC[C@H]3CCN(C)C[C@@H]32)cnn1-c1ccccc1Cl ZINC000485143747 900444446 /nfs/dbraw/zinc/44/44/46/900444446.db2.gz IWLHCQFMPIXONJ-BEFAXECRSA-N 0 3 401.942 4.207 20 0 HIADHN CCCCn1ncc(NC(=O)N2CCC(CN3C[C@H](C)O[C@@H](C)C3)CC2)c1C(C)C ZINC000485163493 900461680 /nfs/dbraw/zinc/46/16/80/900461680.db2.gz XYRGHUQIVFHOIO-OALUTQOASA-N 0 3 419.614 4.160 20 0 HIADHN CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)N[C@H](c1ccc(F)cc1)C(F)(F)F ZINC000485214915 900502745 /nfs/dbraw/zinc/50/27/45/900502745.db2.gz ZRMAWLRCZWNHNM-YTQUADARSA-N 0 3 424.442 4.159 20 0 HIADHN Cc1ccccc1CCCN1CCN(CCCc2nc(-c3cccs3)no2)CC1 ZINC000485218666 900505266 /nfs/dbraw/zinc/50/52/66/900505266.db2.gz YUAGUOQBXRRIMF-UHFFFAOYSA-N 0 3 410.587 4.290 20 0 HIADHN CCCCNc1ccccc1C(=O)Nc1ccc(C(=O)N(C)[C@@H]2CCCN(C)C2)cc1 ZINC000485279655 900557524 /nfs/dbraw/zinc/55/75/24/900557524.db2.gz APGVFCBYKWRRQZ-OAQYLSRUSA-N 0 3 422.573 4.317 20 0 HIADHN CCc1c(NC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cnn1-c1ccccc1C ZINC000485325187 900608244 /nfs/dbraw/zinc/60/82/44/900608244.db2.gz XWRUYZOCGHCCDO-HXUWFJFHSA-N 0 3 403.530 4.139 20 0 HIADHN CCc1c(NC(=O)N[C@H](C)C2=CCN(C)CC2)cnn1-c1cccc(C(F)(F)F)c1 ZINC000485327638 900610903 /nfs/dbraw/zinc/61/09/03/900610903.db2.gz ZHMQKKKJPIHMBP-CQSZACIVSA-N 0 3 421.467 4.225 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NC[C@@H]1CCOC[C@H]1C)c1ccc(C(F)(F)F)cc1 ZINC000485335269 900621890 /nfs/dbraw/zinc/62/18/90/900621890.db2.gz ZXAMLAOOVNNBSA-HHXXYDBFSA-N 0 3 415.500 4.060 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NC[C@H]1CCOC[C@H]1C)c1ccc(C(F)(F)F)cc1 ZINC000485335272 900622147 /nfs/dbraw/zinc/62/21/47/900622147.db2.gz ZXAMLAOOVNNBSA-SZVBFZGTSA-N 0 3 415.500 4.060 20 0 HIADHN COc1ccc(NC(=O)CCN(C)[C@H](C)c2ccc([S@](C)=O)cc2)cc1Cl ZINC000485404807 900703321 /nfs/dbraw/zinc/70/33/21/900703321.db2.gz LMSWERZNKKNQRU-ASHKIFAZSA-N 0 3 408.951 4.108 20 0 HIADHN CC(C)CC(=O)Nc1cccc(CNC(=O)N[C@@H]2CCN(Cc3ccccc3)[C@H]2C)c1 ZINC000485408810 900706443 /nfs/dbraw/zinc/70/64/43/900706443.db2.gz VNHRLZJIUFCEDG-WMZHIEFXSA-N 0 3 422.573 4.133 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1ccc(N2CCCC2=O)c(F)c1)c1ccsc1 ZINC000485415551 900714246 /nfs/dbraw/zinc/71/42/46/900714246.db2.gz RAINQRNXAOMOFP-LJQANCHMSA-N 0 3 418.538 4.219 20 0 HIADHN Cc1c2ccc(NC(=O)[C@]3(C(F)(F)F)CCN(Cc4ccccc4)C3)cc2nn1C ZINC000485443948 900740461 /nfs/dbraw/zinc/74/04/61/900740461.db2.gz FUCCCRVYWTZBKQ-NRFANRHFSA-N 0 3 416.447 4.275 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)Cc2ccc(F)cc2Br)C1 ZINC000485456319 900750355 /nfs/dbraw/zinc/75/03/55/900750355.db2.gz RPOMLHHFFOQIGN-KDOFPFPSSA-N 0 3 405.311 4.082 20 0 HIADHN CCOc1cc(Cl)ccc1C(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000485548340 900823250 /nfs/dbraw/zinc/82/32/50/900823250.db2.gz HWURYHWBESGHNU-IAGOWNOFSA-N 0 3 408.970 4.090 20 0 HIADHN O=C(N[C@@H](c1ccccc1)c1cccnc1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000485604067 900863223 /nfs/dbraw/zinc/86/32/23/900863223.db2.gz UZNDENJUTZPOEA-VWNXMTODSA-N 0 3 403.501 4.339 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N[C@H]1CCCc2c[nH]nc21)c1ccc(C(F)(F)F)cc1 ZINC000485613326 900871415 /nfs/dbraw/zinc/87/14/15/900871415.db2.gz LSONQVLRLMUVQH-ROUUACIJSA-N 0 3 423.483 4.188 20 0 HIADHN COCCO[C@H]1COCC[C@H]1NCc1ccc(-c2cccc(Cl)c2Cl)o1 ZINC000485697524 900947589 /nfs/dbraw/zinc/94/75/89/900947589.db2.gz PSKLFQVMELJFDG-AEFFLSMTSA-N 0 3 400.302 4.164 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)[C@H]1COc2ccc(Cl)cc21 ZINC000485779993 901034751 /nfs/dbraw/zinc/03/47/51/901034751.db2.gz DZQJSFYESVZBFD-IBGZPJMESA-N 0 3 402.947 4.046 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@H](C)N[C@@H](C)c2ccc3ncsc3c2)cc1OC ZINC000485838615 901084446 /nfs/dbraw/zinc/08/44/46/901084446.db2.gz BICQRLTYUXXXOU-GJZGRUSLSA-N 0 3 413.543 4.011 20 0 HIADHN Cc1ccc(S(=O)(=O)NCc2ccccc2CN2CCCCC2)c2cccnc12 ZINC000486056951 901253148 /nfs/dbraw/zinc/25/31/48/901253148.db2.gz WWCSESUZWFAAGT-UHFFFAOYSA-N 0 3 409.555 4.008 20 0 HIADHN CN(C)Cc1ccccc1C(=O)NCc1cccc(NC(=O)Nc2ccccc2)c1 ZINC000486070270 901263753 /nfs/dbraw/zinc/26/37/53/901263753.db2.gz XVABYBPXPHPIKG-UHFFFAOYSA-N 0 3 402.498 4.322 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(NC[C@H](Cc3ccccc3)[NH+](CC)CC)nc2)n1 ZINC000486123948 901311033 /nfs/dbraw/zinc/31/10/33/901311033.db2.gz SMCPNBZBEZMAHY-NRFANRHFSA-N 0 3 405.546 4.172 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)[C@@H]1[C@@H](c2ccccc2)C1(F)F ZINC000486302813 901482557 /nfs/dbraw/zinc/48/25/57/901482557.db2.gz GCAYEKRFFHKWGH-FCEUIQTBSA-N 0 3 422.479 4.318 20 0 HIADHN CCn1nc(CN2C[C@H]3CCC[C@@]3(c3nc(-c4cccnc4)no3)C2)c2ccccc21 ZINC000486430303 901590318 /nfs/dbraw/zinc/59/03/18/901590318.db2.gz HFWGYIIXOODIDW-HOYKHHGWSA-N 0 3 414.513 4.055 20 0 HIADHN CC(C)(C)c1ncc(CN2C[C@H]3CCC[C@@]3(c3nc(-c4cccnc4)no3)C2)s1 ZINC000486437518 901595742 /nfs/dbraw/zinc/59/57/42/901595742.db2.gz WXIVQHHZRURVHW-OPAMFIHVSA-N 0 3 409.559 4.439 20 0 HIADHN Clc1cc2c(c(CN3C[C@H]4CCC[C@@]4(c4nc(-c5cccnc5)no4)C3)c1)OCC2 ZINC000486446461 901605513 /nfs/dbraw/zinc/60/55/13/901605513.db2.gz CVACJIRRXVKPMP-WZONZLPQSA-N 0 3 422.916 4.274 20 0 HIADHN CC(=O)c1ccc(CC(=O)N[C@H](c2ccc(F)c(F)c2)C(C)(C)N2CCCC2)cc1 ZINC000486556899 901703124 /nfs/dbraw/zinc/70/31/24/901703124.db2.gz HIQHAMUHGLZDSR-HSZRJFAPSA-N 0 3 414.496 4.442 20 0 HIADHN Cc1nc(-c2ccc(C)cc2NC(=O)CN2CCC[C@@H]2c2cc(C)ccc2C)n[nH]1 ZINC000486779089 901848429 /nfs/dbraw/zinc/84/84/29/901848429.db2.gz YSECLJNFYVCOHW-JOCHJYFZSA-N 0 3 403.530 4.481 20 0 HIADHN CNC(=O)[C@@H](NCc1ccc(OCc2cccc(C(F)(F)F)c2)c(OC)c1)C(C)C ZINC000486790771 901856084 /nfs/dbraw/zinc/85/60/84/901856084.db2.gz YWFOATINDGKBAV-FQEVSTJZSA-N 0 3 424.463 4.153 20 0 HIADHN Cc1csc(Nc2ccc(C(=O)Nc3ccc(OC4CCN(C)CC4)nc3)cc2)n1 ZINC000486827518 901878743 /nfs/dbraw/zinc/87/87/43/901878743.db2.gz RIHDXNSVZFSPQD-UHFFFAOYSA-N 0 3 423.542 4.315 20 0 HIADHN C[C@H](C(=O)N1[C@@H](C)CCC[C@@H]1C)N1C[C@H]2CCC[C@@]2(c2nc(-c3ccccc3)no2)C1 ZINC000486829526 901881737 /nfs/dbraw/zinc/88/17/37/901881737.db2.gz XURAUWGKLOYZEP-YTOCAZORSA-N 0 3 422.573 4.268 20 0 HIADHN CO[C@@H](c1ccc(Br)cc1)[C@H](C)NC(=O)c1ccccc1CN(C)C ZINC000486847150 901892487 /nfs/dbraw/zinc/89/24/87/901892487.db2.gz PXOBVYCPNHQHLO-IFXJQAMLSA-N 0 3 405.336 4.017 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)Nc3ncc(Cc4cccc(C(F)(F)F)c4)s3)[C@H]2C1 ZINC000486858634 901903693 /nfs/dbraw/zinc/90/36/93/901903693.db2.gz BOPWLHDYAUWLEU-YOEHRIQHSA-N 0 3 424.492 4.311 20 0 HIADHN C[C@H](Cc1ccc(Br)cc1)NC(=O)N(CCN(C)C)Cc1ccccc1 ZINC000505926126 914575522 /nfs/dbraw/zinc/57/55/22/914575522.db2.gz BLDRSEUKLDRMPI-QGZVFWFLSA-N 0 3 418.379 4.154 20 0 HIADHN CCCC(=O)Nc1ccc(Cl)c(NC(=O)N(CCN(C)C)Cc2ccco2)c1 ZINC000486868496 901914309 /nfs/dbraw/zinc/91/43/09/901914309.db2.gz KMXLTXOIOXRRTP-UHFFFAOYSA-N 0 3 406.914 4.267 20 0 HIADHN O=C(NC[C@@H]1CCCN(Cc2cccs2)C1)c1c(F)cccc1Br ZINC000486895701 901939171 /nfs/dbraw/zinc/93/91/71/901939171.db2.gz FPCRYEAPERFJQX-ZDUSSCGKSA-N 0 3 411.340 4.292 20 0 HIADHN CC(C)([C@@H](NC(=O)CCc1cncc(F)c1)c1ccc(F)c(F)c1)N1CCCC1 ZINC000487111445 902061064 /nfs/dbraw/zinc/06/10/64/902061064.db2.gz JDQWXDOVZAWFJE-NRFANRHFSA-N 0 3 405.464 4.163 20 0 HIADHN CN(CCN1CCCC1)C(=O)[C@@H](Oc1ccccc1Br)c1ccccc1 ZINC000487533783 902238194 /nfs/dbraw/zinc/23/81/94/902238194.db2.gz HYGHOSSWQMDGEZ-FQEVSTJZSA-N 0 3 417.347 4.123 20 0 HIADHN Cn1ncc(Br)c1CNCC(C)(C)c1ccccc1Br ZINC000487537946 902240646 /nfs/dbraw/zinc/24/06/46/902240646.db2.gz LNXBLAHNMWWLMJ-UHFFFAOYSA-N 0 3 401.146 4.013 20 0 HIADHN CCCOc1ccc(Cl)cc1C(=O)N1CCC(CN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000487739534 902332502 /nfs/dbraw/zinc/33/25/02/902332502.db2.gz MWHVZUTWIXUVPE-IRXDYDNUSA-N 0 3 408.970 4.090 20 0 HIADHN Brc1ccccc1-c1noc(C2CCN(C[C@H]3CCCCO3)CC2)n1 ZINC000488169949 902660937 /nfs/dbraw/zinc/66/09/37/902660937.db2.gz OEGWNTCZMCTMOZ-OAHLLOKOSA-N 0 3 406.324 4.248 20 0 HIADHN O=C(NCc1nc2ccccc2s1)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000505986207 914653536 /nfs/dbraw/zinc/65/35/36/914653536.db2.gz GQHVTNFKJXKGQS-MRXNPFEDSA-N 0 3 401.482 4.070 20 0 HIADHN Cn1ccc(CN2CCC(c3nc(-c4ccccc4Br)no3)CC2)c1 ZINC000488386325 902796432 /nfs/dbraw/zinc/79/64/32/902796432.db2.gz MINRMSFHYSRQEJ-UHFFFAOYSA-N 0 3 401.308 4.217 20 0 HIADHN CC(C)[C@@H]1C[C@@H](N[C@H](CN2CCCC2=O)c2cccc(C(F)(F)F)c2)CS1 ZINC000488426117 902821574 /nfs/dbraw/zinc/82/15/74/902821574.db2.gz VKHNMPBZQHOLHI-KURKYZTESA-N 0 3 400.510 4.489 20 0 HIADHN Cc1c(CSC(C)C)cccc1NC(=O)N1CCN(C2CCOCC2)C[C@@H]1C ZINC000488488027 902850520 /nfs/dbraw/zinc/85/05/20/902850520.db2.gz PQYILRSAAFAENH-KRWDZBQOSA-N 0 3 405.608 4.354 20 0 HIADHN Cc1c(C(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@@H]2C)[nH]c2c1C(=O)CC(C)(C)C2 ZINC000488516555 902866128 /nfs/dbraw/zinc/86/61/28/902866128.db2.gz NLRACEUOCQHOQF-QFBILLFUSA-N 0 3 407.558 4.119 20 0 HIADHN COc1ccc(NC(=O)C2(NCc3cc4ccc(F)cc4[nH]3)CCCC2)cc1OC ZINC000488521700 902868508 /nfs/dbraw/zinc/86/85/08/902868508.db2.gz JTLBCOQYKJGMAD-UHFFFAOYSA-N 0 3 411.477 4.365 20 0 HIADHN Cc1ccc(C)c(NC(=O)[C@H](c2ccccc2)N2CCN(C3CCOCC3)C[C@H]2C)c1 ZINC000488692701 902945594 /nfs/dbraw/zinc/94/55/94/902945594.db2.gz UFUBJLNUROWLHM-BWKNWUBXSA-N 0 3 421.585 4.168 20 0 HIADHN O=C(CCN1CCC(Oc2cnccn2)CC1)Nc1ccccc1Oc1ccccc1 ZINC000488773663 902989380 /nfs/dbraw/zinc/98/93/80/902989380.db2.gz ZUTQMJWXVZRITL-UHFFFAOYSA-N 0 3 418.497 4.141 20 0 HIADHN CN(C)[C@H](CNC(=O)CSc1nnc(CCC2CCCCC2)o1)c1ccccc1 ZINC000488803637 903009160 /nfs/dbraw/zinc/00/91/60/903009160.db2.gz AREYXNLIHXDPKL-LJQANCHMSA-N 0 3 416.591 4.094 20 0 HIADHN Cc1nc(C(=O)N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)c(-c2ccccc2)s1 ZINC000488890281 903059441 /nfs/dbraw/zinc/05/94/41/903059441.db2.gz LDJIDOBZFIAMCF-CALCHBBNSA-N 0 3 413.587 4.080 20 0 HIADHN C[C@H](N[C@@H](COc1ccccc1F)C(C)(C)C)C(=O)N[C@H]1CCOc2ccccc21 ZINC000489025278 903128351 /nfs/dbraw/zinc/12/83/51/903128351.db2.gz DATSINFKAAXSMI-BPXKWBHBSA-N 0 3 414.521 4.237 20 0 HIADHN COc1cccc(N2C[C@@H](NCc3ccc(Oc4cccnc4)c(C)c3)CC2=O)c1 ZINC000489055527 903161218 /nfs/dbraw/zinc/16/12/18/903161218.db2.gz UEVUKNJTZPMDBY-IBGZPJMESA-N 0 3 403.482 4.086 20 0 HIADHN O[C@H](COc1cccc2[nH]ccc21)CN1CCC[C@H](c2nc3c(s2)CCCC3)C1 ZINC000489108096 903202181 /nfs/dbraw/zinc/20/21/81/903202181.db2.gz ZBWXDZBRWHWCFT-IRXDYDNUSA-N 0 3 411.571 4.123 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2ccc(C)c(C(=O)N(C)C(C)C)c2)N(C)C)cc1 ZINC000489130245 903218829 /nfs/dbraw/zinc/21/88/29/903218829.db2.gz NXIIYIIFHSTUKJ-QFIPXVFZSA-N 0 3 410.562 4.208 20 0 HIADHN Cc1ccc(CNC(=O)N(CCN(C)Cc2ccccc2)Cc2ccccc2)cn1 ZINC000489251852 903288253 /nfs/dbraw/zinc/28/82/53/903288253.db2.gz LEBCACYDQGQRRK-UHFFFAOYSA-N 0 3 402.542 4.234 20 0 HIADHN O=C(Nc1ccccc1F)Nc1cccc2c1CCN(C[C@@H](O)Cc1ccccc1)C2 ZINC000489290758 903311483 /nfs/dbraw/zinc/31/14/83/903311483.db2.gz JZWKEYCDRDTJER-FQEVSTJZSA-N 0 3 419.500 4.431 20 0 HIADHN Cc1c(C(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)nnn1-c1cccc(Cl)c1 ZINC000489619136 903501082 /nfs/dbraw/zinc/50/10/82/903501082.db2.gz GTMXSEQCULIBII-NRFANRHFSA-N 0 3 423.948 4.104 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2ccc(-c3ccccc3)[nH]c2=O)N2CCCC2)cc1 ZINC000489656737 903522132 /nfs/dbraw/zinc/52/21/32/903522132.db2.gz VSRCVWGTKCYGMV-QHCPKHFHSA-N 0 3 401.510 4.330 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)NC1CCC(c2ccccc2)CC1 ZINC000489790038 903600188 /nfs/dbraw/zinc/60/01/88/903600188.db2.gz LOIXMBQVOLFLTN-UHFFFAOYSA-N 0 3 421.585 4.169 20 0 HIADHN CSCC[C@H](N[C@@H](C)c1ccc(OCc2ccccc2C)cc1)C(=O)N(C)C ZINC000489884327 903651365 /nfs/dbraw/zinc/65/13/65/903651365.db2.gz OAIXJHSFMDBPQI-AVRDEDQJSA-N 0 3 400.588 4.435 20 0 HIADHN Cc1ccc([C@H]2C[C@@H](C)N(CC(=O)NCC3(c4ccccc4)CCOCC3)C2)cc1 ZINC000490060838 903749099 /nfs/dbraw/zinc/74/90/99/903749099.db2.gz JHTYRWDTZKWTML-GGAORHGYSA-N 0 3 406.570 4.037 20 0 HIADHN CNC(=O)CN1CCC(N[C@@H](c2ccccc2Cl)c2cccc3ccccc32)CC1 ZINC000490129196 903781578 /nfs/dbraw/zinc/78/15/78/903781578.db2.gz CSINCLBQMYNXEX-RUZDIDTESA-N 0 3 421.972 4.383 20 0 HIADHN Cn1cc([C@H](NCCc2ccc(F)c(Br)c2)c2cccc(F)c2)cn1 ZINC000490145485 903790817 /nfs/dbraw/zinc/79/08/17/903790817.db2.gz UFOMTGRTGBHRLP-LJQANCHMSA-N 0 3 406.274 4.383 20 0 HIADHN CCN1CCN(c2ccc(CN[C@H](c3ccccc3)c3ccc(OC)cc3)cn2)CC1 ZINC000490159783 903801574 /nfs/dbraw/zinc/80/15/74/903801574.db2.gz ZMWUADWSKDLYIZ-AREMUKBSSA-N 0 3 416.569 4.111 20 0 HIADHN Cc1ccc([C@@H](NC[C@H](C(C)C)N2CCCC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000490172560 903810421 /nfs/dbraw/zinc/81/04/21/903810421.db2.gz ONVFAWQZAXVAOE-DNQXCXABSA-N 0 3 414.615 4.198 20 0 HIADHN C[C@@H]1CCC[C@H](N(Cc2ccc(C(=O)N(C)C)[nH]2)Cc2ccc3c(c2)OCO3)[C@@H]1C ZINC000506055203 914753354 /nfs/dbraw/zinc/75/33/54/914753354.db2.gz IELLZLPYWILIFZ-LZJOCLMNSA-N 0 3 411.546 4.272 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)NCc1ccc(Oc2ccccc2)nc1)c1ccco1 ZINC000490218448 903833985 /nfs/dbraw/zinc/83/39/85/903833985.db2.gz SZYOCEOWZVBYGF-XLIONFOSSA-N 0 3 408.502 4.396 20 0 HIADHN COc1cccc(CO[C@H](C)C(=O)NC[C@@H](c2ccccc2)N2CCC(C)CC2)c1 ZINC000490218677 903834125 /nfs/dbraw/zinc/83/41/25/903834125.db2.gz UEVQQOLYCDLSHY-YKSBVNFPSA-N 0 3 410.558 4.190 20 0 HIADHN CCNC(=O)Nc1ccc(C)c(NC(=O)N(CC)[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000490321487 903901497 /nfs/dbraw/zinc/90/14/97/903901497.db2.gz JNLLXFLKFBEAEK-NRFANRHFSA-N 0 3 423.561 4.265 20 0 HIADHN CCSc1cccc(CNC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)c1 ZINC000490356959 903950673 /nfs/dbraw/zinc/95/06/73/903950673.db2.gz WIBORFYKVNHQMJ-UHFFFAOYSA-N 0 3 415.525 4.403 20 0 HIADHN Cc1cc([C@@H](NCCCn2cc(Br)cn2)c2cccnc2)ccc1F ZINC000490439668 904012434 /nfs/dbraw/zinc/01/24/34/904012434.db2.gz YHSBHVIJRDKBEA-LJQANCHMSA-N 0 3 403.299 4.257 20 0 HIADHN Cn1nc(-c2ccc(Cl)s2)cc1NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000490497119 904049961 /nfs/dbraw/zinc/04/99/61/904049961.db2.gz ZIDXIZRFCLBZQR-OAHLLOKOSA-N 0 3 415.950 4.198 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)Nc1ccc(-c2ccco2)cc1F ZINC000490506546 904057007 /nfs/dbraw/zinc/05/70/07/904057007.db2.gz XGDBLPWCCNMQOK-UHFFFAOYSA-N 0 3 423.488 4.364 20 0 HIADHN CC(=O)c1ccc(SCC(=O)NC[C@]2(C)CCCN2Cc2ccccc2)cc1F ZINC000490525710 904073750 /nfs/dbraw/zinc/07/37/50/904073750.db2.gz DLFGIJUCCSGKMP-QHCPKHFHSA-N 0 3 414.546 4.291 20 0 HIADHN COc1ccccc1-c1ncc(CNC[C@H](c2ccccc2OC)N2CCCC2)cn1 ZINC000490531891 904079963 /nfs/dbraw/zinc/07/99/63/904079963.db2.gz SFMVQARSBQNBNN-JOCHJYFZSA-N 0 3 418.541 4.088 20 0 HIADHN O=C1C[C@H]([C@@H]2CCCCN2Cc2csc(-c3ccc(C(F)(F)F)cc3)n2)CN1 ZINC000490676223 904168271 /nfs/dbraw/zinc/16/82/71/904168271.db2.gz SFNXLRWXNCUQDP-YOEHRIQHSA-N 0 3 409.477 4.320 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)NC[C@@H]3CCCCC(F)(F)C3)CC2)C[C@@H](C)O1 ZINC000490716870 904189173 /nfs/dbraw/zinc/18/91/73/904189173.db2.gz CGTFLHQSGOLTTM-QWFCFKBJSA-N 0 3 415.569 4.123 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)NC[C@@H]3CCCCC(F)(F)C3)CC2)C[C@H](C)O1 ZINC000490716872 904189725 /nfs/dbraw/zinc/18/97/25/904189725.db2.gz CGTFLHQSGOLTTM-WSTZPKSXSA-N 0 3 415.569 4.123 20 0 HIADHN OC1CCN(Cc2cn(-c3ccccc3)nc2-c2ccc(Br)cc2)CC1 ZINC000506084885 914789057 /nfs/dbraw/zinc/78/90/57/914789057.db2.gz DHDIFCLVDSLUBA-UHFFFAOYSA-N 0 3 412.331 4.259 20 0 HIADHN Cc1ccc(-c2nn(-c3ccc(F)cc3)cc2CN2CCC(C(=O)N(C)C)CC2)cc1 ZINC000506084880 914790828 /nfs/dbraw/zinc/79/08/28/914790828.db2.gz GKZHPBDWWBVOPH-UHFFFAOYSA-N 0 3 420.532 4.287 20 0 HIADHN CC(C)(C)[C@@H]1C[C@H](NC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)CCO1 ZINC000490821169 904266322 /nfs/dbraw/zinc/26/63/22/904266322.db2.gz AUAYQSSZBPCSMP-LQWHRVPQSA-N 0 3 412.496 4.151 20 0 HIADHN COc1cc(CN(C)Cc2ccc3ccccc3c2)ccc1OCC(=O)N1CCCC1 ZINC000506111293 914807798 /nfs/dbraw/zinc/80/77/98/914807798.db2.gz AMMVNRUGABZLIV-UHFFFAOYSA-N 0 3 418.537 4.482 20 0 HIADHN Cc1ccc([C@@H](NC[C@H](O)C2CCCCC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000491008954 904368680 /nfs/dbraw/zinc/36/86/80/904368680.db2.gz QDAMKENMAPMDPQ-XZOQPEGZSA-N 0 3 401.572 4.019 20 0 HIADHN CCCCOc1ccc(CN2CCC(C(=O)N3CCCCC3)CC2)cc1OCC ZINC000506101909 914803818 /nfs/dbraw/zinc/80/38/18/914803818.db2.gz UWYJLHHLIRVHKS-UHFFFAOYSA-N 0 3 402.579 4.489 20 0 HIADHN C[C@H](C1CC1)n1cc(NC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)cn1 ZINC000491068617 904408616 /nfs/dbraw/zinc/40/86/16/904408616.db2.gz NHTQTKPYXMSBAV-QRWLVFNGSA-N 0 3 406.452 4.247 20 0 HIADHN COc1cccc([C@H](CNC(=O)NCCc2ccc(Cl)s2)N2CCCC2)c1 ZINC000506109083 914807168 /nfs/dbraw/zinc/80/71/68/914807168.db2.gz XSAICKRKRXWHDC-SFHVURJKSA-N 0 3 407.967 4.089 20 0 HIADHN CN(C)C(=O)COc1ccccc1CN1CCC(c2nc3ccccc3s2)CC1 ZINC000506115901 914809426 /nfs/dbraw/zinc/80/94/26/914809426.db2.gz LWKVYNSMXFYILA-UHFFFAOYSA-N 0 3 409.555 4.143 20 0 HIADHN C[C@@H]1CN(C[C@@H]2CCCN2Cc2ccc(Br)c3cccnc23)C[C@H](C)O1 ZINC000491194935 904476748 /nfs/dbraw/zinc/47/67/48/904476748.db2.gz RDPWBSZLFJYSTO-JZXOWHBKSA-N 0 3 418.379 4.071 20 0 HIADHN O=C([C@H]1CN(Cc2ccccc2)CCC1(F)F)N1CCC(c2ccc(O)cc2)CC1 ZINC000506127391 914814637 /nfs/dbraw/zinc/81/46/37/914814637.db2.gz YVJZWBRSLHEBOE-JOCHJYFZSA-N 0 3 414.496 4.256 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)NCc1cc(Br)ccc1F ZINC000506145299 914822617 /nfs/dbraw/zinc/82/26/17/914822617.db2.gz YIEKWZGXOVPTAN-UHFFFAOYSA-N 0 3 405.267 4.326 20 0 HIADHN COc1ccccc1-c1ncc(CN[C@H]2CCN(C)[C@@H]2c2ccc(Cl)cc2)cn1 ZINC000491309001 904529415 /nfs/dbraw/zinc/52/94/15/904529415.db2.gz IUZJOLMRRUCFCY-RBBKRZOGSA-N 0 3 408.933 4.341 20 0 HIADHN CCOc1cc(CN2CCC[C@@H](c3nnc4ccccn43)C2)ccc1OC(F)F ZINC000506141112 914820795 /nfs/dbraw/zinc/82/07/95/914820795.db2.gz PIKWXEPTZZAGJY-MRXNPFEDSA-N 0 3 402.445 4.109 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)NCc3ccc(C4CC4)cc3F)CC2)C[C@H](C)O1 ZINC000491350513 904551468 /nfs/dbraw/zinc/55/14/68/904551468.db2.gz WZNXTBCRNQSCFI-HDICACEKSA-N 0 3 417.569 4.124 20 0 HIADHN COc1ccccc1-c1ncc(CNCCCOc2ccc(C(F)(F)F)cn2)cn1 ZINC000491374125 904565667 /nfs/dbraw/zinc/56/56/67/904565667.db2.gz KOLVKFIGSHGDNQ-UHFFFAOYSA-N 0 3 418.419 4.125 20 0 HIADHN COc1ccccc1-c1ncc(CN[C@@]2(Cc3ccc(Cl)cc3)CCOC2)cn1 ZINC000491388044 904572246 /nfs/dbraw/zinc/57/22/46/904572246.db2.gz JUSKDFAQAJFDFV-HSZRJFAPSA-N 0 3 409.917 4.297 20 0 HIADHN COc1ccc([C@H](NC[C@@H](c2ccc(C)o2)N2CCOCC2)c2ccc(F)cc2)cc1 ZINC000491410828 904582324 /nfs/dbraw/zinc/58/23/24/904582324.db2.gz RZZJDXYNMHAONC-UKILVPOCSA-N 0 3 424.516 4.488 20 0 HIADHN COc1ccc([C@@H](NC[C@@H](c2ccc(C)o2)N2CCOCC2)c2ccc(F)cc2)cc1 ZINC000491410829 904583199 /nfs/dbraw/zinc/58/31/99/904583199.db2.gz RZZJDXYNMHAONC-ZCYQVOJMSA-N 0 3 424.516 4.488 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)N2CCCC[C@@H]2c2ccc(C(C)C)cc2)CC1 ZINC000491425105 904589638 /nfs/dbraw/zinc/58/96/38/904589638.db2.gz VWEVRVUONWJGFD-ZJSXRUAMSA-N 0 3 414.638 4.320 20 0 HIADHN C[C@H]1C[C@H]1C(=O)Nc1cccc(C(=O)NC[C@H](c2ccccc2)N2CCC(C)CC2)c1 ZINC000491423953 904589761 /nfs/dbraw/zinc/58/97/61/904589761.db2.gz OOLGKKFVCATHGL-WUMKDDEVSA-N 0 3 419.569 4.484 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)Nc2cc(F)c(OC(F)F)cc2F)CN1Cc1ccccc1 ZINC000491472754 904615800 /nfs/dbraw/zinc/61/58/00/904615800.db2.gz XQTYAWXDLGPEIW-OCCSQVGLSA-N 0 3 411.399 4.351 20 0 HIADHN O=C(Nc1ccc(F)c(F)c1F)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000491522120 904633052 /nfs/dbraw/zinc/63/30/52/904633052.db2.gz QORWGOKNAPTODN-GOSISDBHSA-N 0 3 402.338 4.497 20 0 HIADHN CC(=O)Nc1cc(NC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)ccc1F ZINC000491520623 904633908 /nfs/dbraw/zinc/63/39/08/904633908.db2.gz GUVCTMAJHCYVHS-FQEVSTJZSA-N 0 3 423.410 4.177 20 0 HIADHN C[C@H](NC(=O)NC[C@@H](c1ccccc1)N1CCCC1)c1nc(C(F)(F)F)cs1 ZINC000491527646 904637452 /nfs/dbraw/zinc/63/74/52/904637452.db2.gz BHEUAFLZXVNADO-ZFWWWQNUSA-N 0 3 412.481 4.359 20 0 HIADHN C[C@H](NC(=O)NC[C@H](c1ccccc1)N1CCCC1)c1nc(C(F)(F)F)cs1 ZINC000491527643 904638471 /nfs/dbraw/zinc/63/84/71/904638471.db2.gz BHEUAFLZXVNADO-DZGCQCFKSA-N 0 3 412.481 4.359 20 0 HIADHN COc1cccc(CN(C)C(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)c1 ZINC000491542021 904644183 /nfs/dbraw/zinc/64/41/83/904644183.db2.gz ZUTKLEIGNZQPOU-OAQYLSRUSA-N 0 3 406.448 4.108 20 0 HIADHN CC[C@@H](Cc1ccc(Cl)cc1Cl)NC(=O)C(=O)Nc1cccc(CN(C)C)c1 ZINC000491608190 904674540 /nfs/dbraw/zinc/67/45/40/904674540.db2.gz VLZLPOXUKUZFRP-KRWDZBQOSA-N 0 3 422.356 4.131 20 0 HIADHN CCN(CC)C(=O)c1cccc(NC(=O)N(CCN(C)C)Cc2cccc(C)c2)c1 ZINC000491852996 904711171 /nfs/dbraw/zinc/71/11/71/904711171.db2.gz HDXCCLMAFZFITN-UHFFFAOYSA-N 0 3 410.562 4.073 20 0 HIADHN COC[C@H](NCc1ccccc1CN1C[C@@H](C)O[C@@H](C)C1)c1ccc(Cl)cc1 ZINC000491906977 904726283 /nfs/dbraw/zinc/72/62/83/904726283.db2.gz CBUUMSMWWMKATH-IXFSTUDKSA-N 0 3 402.966 4.427 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)Nc2ccc(C(=O)NC(C)(C)C)cc2)c1 ZINC000491941702 904739488 /nfs/dbraw/zinc/73/94/88/904739488.db2.gz XISIWZWOUJRPQR-UHFFFAOYSA-N 0 3 410.562 4.119 20 0 HIADHN CCCC(=O)Nc1cccc(NC(=O)c2ccc(CN3CCC(CO)CC3)cc2)c1C ZINC000492108691 904801021 /nfs/dbraw/zinc/80/10/21/904801021.db2.gz KDFRRDDVDVIOMO-UHFFFAOYSA-N 0 3 423.557 4.190 20 0 HIADHN C[C@H](NCc1cnn(-c2ccc(Br)cc2)c1)[C@H]1OCCc2sccc21 ZINC000492192546 904812033 /nfs/dbraw/zinc/81/20/33/904812033.db2.gz HLRQKZOHNLXRBQ-ORAYPTAESA-N 0 3 418.360 4.488 20 0 HIADHN CC1(C)Cc2c(cccc2Br)[C@@H]1NCc1ccc(S(C)(=O)=O)cc1 ZINC000492211532 904816227 /nfs/dbraw/zinc/81/62/27/904816227.db2.gz SZLQJWWEEHZMIX-SFHVURJKSA-N 0 3 408.361 4.266 20 0 HIADHN CCNC(=O)COc1ccc(CN[C@@H]2CCCc3sc(Cl)cc32)cc1OC ZINC000492336709 904836453 /nfs/dbraw/zinc/83/64/53/904836453.db2.gz WVSHDPQQFUMAMH-OAHLLOKOSA-N 0 3 408.951 4.092 20 0 HIADHN CC(C)c1nnc(CCNCc2cccc(Br)c2OC(F)F)s1 ZINC000492397755 904842971 /nfs/dbraw/zinc/84/29/71/904842971.db2.gz KZAATJJINSEJKR-UHFFFAOYSA-N 0 3 406.296 4.358 20 0 HIADHN Brc1ccc(OCCN2CCC3(CC2)OCCc2ccsc23)cc1 ZINC000492602905 904875531 /nfs/dbraw/zinc/87/55/31/904875531.db2.gz RHPDVAGAFTXCHH-UHFFFAOYSA-N 0 3 408.361 4.453 20 0 HIADHN CCCN(C)[C@H](CNC(=O)C(=O)Nc1cccc(C(F)F)c1)c1ccc(Cl)cc1 ZINC000506224373 914851191 /nfs/dbraw/zinc/85/11/91/914851191.db2.gz DMHFEKOKKKDWHJ-GOSISDBHSA-N 0 3 423.891 4.415 20 0 HIADHN CN(C)CCN(C(=O)Nc1cc(-c2cccc(C(F)(F)F)c2)nn1C)C1CCCC1 ZINC000492648602 904882135 /nfs/dbraw/zinc/88/21/35/904882135.db2.gz FYGUBZQNCJVGBY-UHFFFAOYSA-N 0 3 423.483 4.444 20 0 HIADHN CCc1ccc([C@@H](NCC2(CCO)CCCC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000493062513 905006122 /nfs/dbraw/zinc/00/61/22/905006122.db2.gz TVHNRTUCIGWNTM-HSZRJFAPSA-N 0 3 415.599 4.274 20 0 HIADHN CC[C@H](NCc1cc(C(F)(F)F)ccc1N1CCN(C)CC1)c1ccc(F)cn1 ZINC000493106855 905022867 /nfs/dbraw/zinc/02/28/67/905022867.db2.gz WLERIFFJTJZSJQ-SFHVURJKSA-N 0 3 410.459 4.232 20 0 HIADHN Cc1nc(CCN[C@H](c2cccc(S(C)(=O)=O)c2)c2ccc(C)cc2C)c(C)o1 ZINC000493222909 905053680 /nfs/dbraw/zinc/05/36/80/905053680.db2.gz BFZHEYBWDFHKCG-HSZRJFAPSA-N 0 3 412.555 4.233 20 0 HIADHN Fc1ccccc1[C@H](NCCCO[C@H]1CCOC1)c1ccc(Br)cc1 ZINC000493250895 905067111 /nfs/dbraw/zinc/06/71/11/905067111.db2.gz SSJJYZGNWQBEDD-FXAWDEMLSA-N 0 3 408.311 4.463 20 0 HIADHN CC(C)(CO)CCCN[C@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000493275747 905072419 /nfs/dbraw/zinc/07/24/19/905072419.db2.gz BQDAJWSKZKHDML-HXUWFJFHSA-N 0 3 409.979 4.221 20 0 HIADHN COc1ccc(-c2[nH]c3ccccc3c2CCC(=O)N2CC[C@H]3CCN(C)C[C@H]32)cc1 ZINC000493441644 905122885 /nfs/dbraw/zinc/12/28/85/905122885.db2.gz YIWVXJZVHFTMMI-HOYKHHGWSA-N 0 3 417.553 4.329 20 0 HIADHN Cc1cc(-c2cc(C(=O)N3CC[C@@H]4CCN(C)C[C@H]43)c3c(C)noc3n2)c(C)s1 ZINC000493467116 905129981 /nfs/dbraw/zinc/12/99/81/905129981.db2.gz RVIKMKVHOUXUJR-HNAYVOBHSA-N 0 3 410.543 4.043 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)c3ccc(Oc4cccc(Br)c4)cc3)[C@@H]2C1 ZINC000493537674 905152330 /nfs/dbraw/zinc/15/23/30/905152330.db2.gz XYPIKMCMMKJYHX-FOIQADDNSA-N 0 3 415.331 4.408 20 0 HIADHN CC(C)Oc1cc(F)ccc1NC(=O)N1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000493554893 905160668 /nfs/dbraw/zinc/16/06/68/905160668.db2.gz OLOTVGXZMJIYOD-ROUUACIJSA-N 0 3 421.557 4.356 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)c3cc(-c4ccc(F)cc4)nc4onc(C5CC5)c43)[C@@H]2C1 ZINC000493559362 905160904 /nfs/dbraw/zinc/16/09/04/905160904.db2.gz VWKKUUYJALJHLI-FOIQADDNSA-N 0 3 420.488 4.073 20 0 HIADHN CC(C)Oc1cc(F)ccc1NC(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000493554882 905161100 /nfs/dbraw/zinc/16/11/00/905161100.db2.gz OLOTVGXZMJIYOD-HDICACEKSA-N 0 3 421.557 4.356 20 0 HIADHN COc1c(C)cnc(CN2CCC[C@H](c3nnc4ccc(C(F)(F)F)cn43)C2)c1C ZINC000493637089 905179477 /nfs/dbraw/zinc/17/94/77/905179477.db2.gz VDBKYRAWGYUWGA-HNNXBMFYSA-N 0 3 419.451 4.148 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](N[C@@H]2CCc3ccccc3OC2)c2ccccc2)c1 ZINC000493892641 905251358 /nfs/dbraw/zinc/25/13/58/905251358.db2.gz XUWIGRSQHZMFSS-ZJSXRUAMSA-N 0 3 407.535 4.163 20 0 HIADHN CC(C)c1ccc(-c2noc(CCC(=O)N[C@H]3CCN(Cc4ccccc4)C3)n2)cc1 ZINC000493910889 905261787 /nfs/dbraw/zinc/26/17/87/905261787.db2.gz KAGGMGNCHVJHPX-QFIPXVFZSA-N 0 3 418.541 4.183 20 0 HIADHN Cc1cc(Br)cc2c1[C@@H](NCc1ccccc1CS(C)(=O)=O)CC2 ZINC000493928340 905282174 /nfs/dbraw/zinc/28/21/74/905282174.db2.gz UDJPHDZLZYACGS-SFHVURJKSA-N 0 3 408.361 4.079 20 0 HIADHN Cc1cc(Br)cc2c1[C@H](NCc1ccccc1CS(C)(=O)=O)CC2 ZINC000493928339 905282742 /nfs/dbraw/zinc/28/27/42/905282742.db2.gz UDJPHDZLZYACGS-GOSISDBHSA-N 0 3 408.361 4.079 20 0 HIADHN Cc1cc(NC(=O)N2CC[C@@H]3CCN(C)C[C@@H]32)nn1-c1ccc(Cl)cc1Cl ZINC000493982251 905326157 /nfs/dbraw/zinc/32/61/57/905326157.db2.gz IVWYISRGFNNYBG-GUYCJALGSA-N 0 3 408.333 4.045 20 0 HIADHN CSc1nc(-c2ccco2)nc(C)c1C(=O)N[C@@H]1CCN(Cc2ccccc2)[C@H]1C ZINC000494025533 905365868 /nfs/dbraw/zinc/36/58/68/905365868.db2.gz CMELWKFVXBLQIQ-FUHWJXTLSA-N 0 3 422.554 4.160 20 0 HIADHN CC(C)(C)N1C[C@@H](C(=O)Nc2nnc(/C=C\c3ccco3)s2)[C@H](C(F)(F)F)C1 ZINC000494121729 905466129 /nfs/dbraw/zinc/46/61/29/905466129.db2.gz KZAICXBBHKKQMD-ZSBJFDRYSA-N 0 3 414.453 4.149 20 0 HIADHN CSc1cnn(-c2ccccc2)c1NC(=O)N(CCN(C)C)Cc1cccs1 ZINC000494173178 905509915 /nfs/dbraw/zinc/50/99/15/905509915.db2.gz PBARBLFIJMSHRK-UHFFFAOYSA-N 0 3 415.588 4.251 20 0 HIADHN O=C(NCc1ccnc(Oc2ccccc2F)c1)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000494181282 905517699 /nfs/dbraw/zinc/51/76/99/905517699.db2.gz ARAZBWJLDQCGOY-FQEVSTJZSA-N 0 3 420.488 4.087 20 0 HIADHN CSc1ccc(NC(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@@H]2CO)cc1Cl ZINC000494188662 905523546 /nfs/dbraw/zinc/52/35/46/905523546.db2.gz LKEHCJGEUDZDNZ-VQIMIIECSA-N 0 3 419.978 4.066 20 0 HIADHN CC(=O)c1c(C)cc(C)c(CN[C@@H]2CC(=O)N(C)[C@@H]2c2ccc(F)c(F)c2)c1C ZINC000494208923 905540233 /nfs/dbraw/zinc/54/02/33/905540233.db2.gz OIBPRTFHLYHHRA-NFBKMPQASA-N 0 3 400.469 4.154 20 0 HIADHN CCOc1ccccc1NC(=O)CCN(C)Cc1ccc(Br)c(F)c1 ZINC000494293430 905613913 /nfs/dbraw/zinc/61/39/13/905613913.db2.gz PHBDQSVMQTYMTJ-UHFFFAOYSA-N 0 3 409.299 4.448 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1nc(C2CCOCC2)cs1)c1ccsc1 ZINC000494301602 905620837 /nfs/dbraw/zinc/62/08/37/905620837.db2.gz QCBJTPZDJFEWFE-QGZVFWFLSA-N 0 3 408.593 4.303 20 0 HIADHN CC1(C)Cc2ccc(Br)cc2[C@H]1NCc1cnc(N2CCOCC2)s1 ZINC000494310550 905624970 /nfs/dbraw/zinc/62/49/70/905624970.db2.gz KKMOHNJYZNIMPZ-QGZVFWFLSA-N 0 3 422.392 4.155 20 0 HIADHN CN(C)Cc1cccc(NC(=O)NC2(Cc3ccccc3Br)CC2)c1 ZINC000494365390 905664070 /nfs/dbraw/zinc/66/40/70/905664070.db2.gz GFIPFRBWRXXOGG-UHFFFAOYSA-N 0 3 402.336 4.408 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2CN2CCC[C@@H](CNC(=O)C(C)C)C2)o1 ZINC000512455242 921172767 /nfs/dbraw/zinc/17/27/67/921172767.db2.gz BQWXLICSZWICHY-FQEVSTJZSA-N 0 3 420.557 4.425 20 0 HIADHN C[C@H]1CCN(C(=O)Nc2nc(C3CCOCC3)cs2)CCN1Cc1ccccc1 ZINC000494485281 905768599 /nfs/dbraw/zinc/76/85/99/905768599.db2.gz KLZBCNVXZHFDKN-KRWDZBQOSA-N 0 3 414.575 4.165 20 0 HIADHN CC(C)CNC(=O)c1cccc(CN[C@H]2CCO[C@@H]2c2ccc(Cl)c(F)c2)c1 ZINC000494490125 905775063 /nfs/dbraw/zinc/77/50/63/905775063.db2.gz XQZYLZFRADKQQD-LEWJYISDSA-N 0 3 404.913 4.485 20 0 HIADHN Cc1ccc(S(=O)(=O)CCCN[C@H]2CCO[C@H]2c2ccc(Cl)c(F)c2)cc1 ZINC000494496783 905784224 /nfs/dbraw/zinc/78/42/24/905784224.db2.gz PRCRBGYOIHRRSP-PMACEKPBSA-N 0 3 411.926 4.071 20 0 HIADHN O=C(NCc1ccco1)c1cccc(CN[C@H]2CCO[C@H]2c2ccc(Cl)cc2)c1 ZINC000494499166 905787447 /nfs/dbraw/zinc/78/74/47/905787447.db2.gz XXCVXHGZPHYIRC-VXKWHMMOSA-N 0 3 410.901 4.483 20 0 HIADHN CC[C@H](N[C@@H]1CCO[C@H]1c1ccc(Cl)c(F)c1)C(=O)Nc1ccc(OC)cc1 ZINC000494499336 905788829 /nfs/dbraw/zinc/78/88/29/905788829.db2.gz ZFFIWGBQHMSPRL-ZCNNSNEGSA-N 0 3 406.885 4.325 20 0 HIADHN CN(CC(=O)N(Cc1ccc(F)cc1)C12CC3CC(CC(C3)C1)C2)C[C@@H]1CCOC1 ZINC000494564960 905838314 /nfs/dbraw/zinc/83/83/14/905838314.db2.gz MTZJXUGRYPEKCJ-HMNVQUIHSA-N 0 3 414.565 4.091 20 0 HIADHN CC(=O)N1CC[C@H](NCc2cccc(COCC(F)(F)F)c2)c2ccccc2C1 ZINC000494572023 905842637 /nfs/dbraw/zinc/84/26/37/905842637.db2.gz VMQZPKYSFNSVGD-NRFANRHFSA-N 0 3 406.448 4.349 20 0 HIADHN Cc1cc(NC(=O)N2CC[C@@H](C)C(F)(F)C2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000494653781 905885100 /nfs/dbraw/zinc/88/51/00/905885100.db2.gz VRIAEOKOSYKYCP-APWZRJJASA-N 0 3 417.504 4.148 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)NCc1nc(-c2ccccc2F)cs1 ZINC000494661680 905888172 /nfs/dbraw/zinc/88/81/72/905888172.db2.gz PFMZAZCLBBANRZ-UHFFFAOYSA-N 0 3 424.545 4.197 20 0 HIADHN C[C@@H](NC(=O)N1CCN(C2CCOCC2)C[C@@H]1C)C(c1ccccc1)c1ccccc1 ZINC000494683360 905898375 /nfs/dbraw/zinc/89/83/75/905898375.db2.gz VTROLJWJVPSIDO-LEWJYISDSA-N 0 3 421.585 4.102 20 0 HIADHN CC(C)[C@@H](NCCC=Cc1ccc(Br)cc1)c1nc(-c2nc[nH]n2)no1 ZINC000494690122 905901493 /nfs/dbraw/zinc/90/14/93/905901493.db2.gz ZIRFSPYYGKJBCJ-UYWPIULCSA-N 0 3 417.311 4.007 20 0 HIADHN Cc1ccc([C@H](NCC(C)(C)[C@H](O)C(C)C)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000494714503 905916264 /nfs/dbraw/zinc/91/62/64/905916264.db2.gz IZUZRWYFIKJIHS-FCHUYYIVSA-N 0 3 403.588 4.121 20 0 HIADHN COc1c(O)cccc1CNCCSCCOc1cccc(Br)c1 ZINC000494715878 905918775 /nfs/dbraw/zinc/91/87/75/905918775.db2.gz SZXTZRQOTFFQHP-UHFFFAOYSA-N 0 3 412.349 4.065 20 0 HIADHN COC[C@@H](N[C@H]1CCc2nnc(-c3ccc(F)cc3)n2C1)c1ccc(Cl)cc1 ZINC000494759634 905957034 /nfs/dbraw/zinc/95/70/34/905957034.db2.gz WMMJRRYWHBQINX-RBUKOAKNSA-N 0 3 400.885 4.030 20 0 HIADHN CN(C)CCN(Cc1cccc(O)c1)C(=O)c1cc(C2CC2)nc2ccc(F)cc21 ZINC000494771667 905969263 /nfs/dbraw/zinc/96/92/63/905969263.db2.gz VJZFKEAJYLJVCS-UHFFFAOYSA-N 0 3 407.489 4.161 20 0 HIADHN C[C@H](NCc1ccc(N2CCc3ccccc3C2)nc1)c1ccc(C(=O)N(C)C)cc1 ZINC000494886053 906063790 /nfs/dbraw/zinc/06/37/90/906063790.db2.gz LXHMDYHJEWOCKL-IBGZPJMESA-N 0 3 414.553 4.197 20 0 HIADHN CCCN(CC(F)(F)F)C(=O)[C@@H]1CCCN(Cc2cnc(-c3ccco3)s2)C1 ZINC000494955383 906127457 /nfs/dbraw/zinc/12/74/57/906127457.db2.gz BZYSGMACCBRKRI-CQSZACIVSA-N 0 3 415.481 4.416 20 0 HIADHN Cc1noc(C)c1[C@@H](C)CN[C@H](c1ccc(C)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000494990955 906155301 /nfs/dbraw/zinc/15/53/01/906155301.db2.gz YGPQGHHQZOLRAY-QMHKHESXSA-N 0 3 412.555 4.486 20 0 HIADHN COc1ccc(CN2CCC(C(=O)Nc3ccc(Br)cc3)CC2)cc1 ZINC000512516752 921210598 /nfs/dbraw/zinc/21/05/98/921210598.db2.gz LGRDDPBFQSFZRP-UHFFFAOYSA-N 0 3 403.320 4.308 20 0 HIADHN CCc1ccc(C(C)(C)C(=O)Nc2ccc(C(=O)N(C)[C@H]3CCCN(C)C3)cc2)cc1 ZINC000495005312 906166204 /nfs/dbraw/zinc/16/62/04/906166204.db2.gz IXGWBBVGWPRFKV-QHCPKHFHSA-N 0 3 421.585 4.332 20 0 HIADHN Fc1ccc(CN2CCC[C@@H](N[C@H](c3nc[nH]n3)C3CCCCC3)C2)c(Cl)c1 ZINC000495036485 906192937 /nfs/dbraw/zinc/19/29/37/906192937.db2.gz MZMQWSMXZBLYRX-QUCCMNQESA-N 0 3 405.949 4.473 20 0 HIADHN Brc1ccccc1N1CC[C@@H](N[C@H](c2nc[nH]n2)C2CCCCC2)C1 ZINC000495074208 906222908 /nfs/dbraw/zinc/22/29/08/906222908.db2.gz ZWXGCEBUYDKOPP-QAPCUYQASA-N 0 3 404.356 4.057 20 0 HIADHN Cc1cccc2[nH]c(CCC(=O)Nc3ccc(CCN4CCSCC4)cc3)nc21 ZINC000495096583 906235955 /nfs/dbraw/zinc/23/59/55/906235955.db2.gz BTBDXJDKFOMURM-UHFFFAOYSA-N 0 3 408.571 4.034 20 0 HIADHN Cc1cccc2nc(CCC(=O)Nc3cccc(CN4CCSCC4)c3C)[nH]c21 ZINC000495097273 906236603 /nfs/dbraw/zinc/23/66/03/906236603.db2.gz FWMVAYMKSCLHHJ-UHFFFAOYSA-N 0 3 408.571 4.300 20 0 HIADHN CN(Cc1c[nH]nc1-c1ccc(C(F)(F)F)cc1)C[C@@H](O)COCc1ccccc1 ZINC000495172454 906286821 /nfs/dbraw/zinc/28/68/21/906286821.db2.gz HYFBFBOIMARIQO-HXUWFJFHSA-N 0 3 419.447 4.105 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)[C@@H](C)[C@@H]3OCCc4sccc43)c2)CC1 ZINC000495365608 906407127 /nfs/dbraw/zinc/40/71/27/906407127.db2.gz JGUPRNIKJBWGQH-JTSKRJEESA-N 0 3 413.587 4.167 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)NCC(=O)Nc2cccc(Br)c2)cc1 ZINC000495397131 906427267 /nfs/dbraw/zinc/42/72/67/906427267.db2.gz UDPWZMMCIMTDBC-CQSZACIVSA-N 0 3 413.319 4.233 20 0 HIADHN CCS(=O)(=O)Nc1ccc([C@@H](C)NCc2ccccc2N2CCCCC2)cc1 ZINC000495402431 906428666 /nfs/dbraw/zinc/42/86/66/906428666.db2.gz QUYJDWDLUNTFQB-GOSISDBHSA-N 0 3 401.576 4.289 20 0 HIADHN COc1ccccc1CN1CCC(C(=O)Nc2cccc(Br)c2)CC1 ZINC000512562913 921239128 /nfs/dbraw/zinc/23/91/28/921239128.db2.gz AVFMXNHUDCDXIS-UHFFFAOYSA-N 0 3 403.320 4.308 20 0 HIADHN COCC[C@H](N[C@@H](C)CC(=O)Nc1ccc(Br)cc1)c1ccc(C)o1 ZINC000495434538 906450587 /nfs/dbraw/zinc/45/05/87/906450587.db2.gz SNDVHDIIIAUVBA-GUYCJALGSA-N 0 3 409.324 4.435 20 0 HIADHN O=C(Nc1cc(C2CCCCCC2)[nH]n1)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000495483680 906478084 /nfs/dbraw/zinc/47/80/84/906478084.db2.gz URIMRXJPIJZLIV-UHFFFAOYSA-N 0 3 410.562 4.304 20 0 HIADHN COc1ccsc1CN1CCC(C(=O)Nc2ccc(Br)cc2)CC1 ZINC000512563390 921239001 /nfs/dbraw/zinc/23/90/01/921239001.db2.gz DZCABCHVUGYDRY-UHFFFAOYSA-N 0 3 409.349 4.370 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)c2sc3cc(Cl)ccc3c2Cl)CC1 ZINC000495653974 906519536 /nfs/dbraw/zinc/51/95/36/906519536.db2.gz JUNYVFHWTHTGKH-ZDUSSCGKSA-N 0 3 414.402 4.212 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(C)c1CN1CCC(C(=O)Nc2ccc(O)cc2)CC1 ZINC000512591748 921252178 /nfs/dbraw/zinc/25/21/78/921252178.db2.gz ZJBOJEGTIZAWDQ-UHFFFAOYSA-N 0 3 422.504 4.185 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)c1cc(-c2ccc(Cl)cc2)n[nH]1 ZINC000496223726 906632704 /nfs/dbraw/zinc/63/27/04/906632704.db2.gz DAFSASBGYCTBCO-FQEVSTJZSA-N 0 3 423.948 4.252 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)c1csc(-c2cccs2)n1 ZINC000496247484 906637858 /nfs/dbraw/zinc/63/78/58/906637858.db2.gz WONIPDASCYISSW-KRWDZBQOSA-N 0 3 412.584 4.393 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)c1sccc1Br ZINC000496266215 906642392 /nfs/dbraw/zinc/64/23/92/906642392.db2.gz YCRWYVGQTJROJT-OAHLLOKOSA-N 0 3 408.365 4.032 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)c1csc(-c2ccc(F)cc2)n1 ZINC000496262433 906642526 /nfs/dbraw/zinc/64/25/26/906642526.db2.gz LBUZHDJHUKAHMZ-HXUWFJFHSA-N 0 3 424.545 4.471 20 0 HIADHN Cc1ccc(-c2ncco2)cc1NC(=O)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000496549899 906709158 /nfs/dbraw/zinc/70/91/58/906709158.db2.gz CHXHSDKESRZFAM-UHFFFAOYSA-N 0 3 405.498 4.107 20 0 HIADHN COc1ccc(C2(NC(=O)NC[C@H](c3ccc(OC(C)C)cc3)N(C)C)CC2)cc1 ZINC000496594056 906716099 /nfs/dbraw/zinc/71/60/99/906716099.db2.gz RHXHOVOGNIBTGJ-JOCHJYFZSA-N 0 3 411.546 4.074 20 0 HIADHN O=C(NCc1ccsc1Br)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000512611780 921260201 /nfs/dbraw/zinc/26/02/01/921260201.db2.gz CHGWVZAHZBBMPA-INIZCTEOSA-N 0 3 408.365 4.147 20 0 HIADHN CO[C@H]1C[C@@H](CN(C)C(=O)N[C@H](c2ccccc2)c2ccc3ccccc3c2)N(C)C1 ZINC000496610751 906720050 /nfs/dbraw/zinc/72/00/50/906720050.db2.gz IPWIDTRAMMQQFZ-CCDWMCETSA-N 0 3 417.553 4.290 20 0 HIADHN CC[C@@H](C)n1ncc(NC(=O)c2ccc(CN3CCC(CO)CC3)cc2)c1C1CC1 ZINC000496615199 906721529 /nfs/dbraw/zinc/72/15/29/906721529.db2.gz MLPAOMWYPJWRTN-QGZVFWFLSA-N 0 3 410.562 4.188 20 0 HIADHN CCc1noc(CC)c1CC(=O)N(CCN1CCCC1)Cc1ccc(Cl)cc1 ZINC000496862782 906769228 /nfs/dbraw/zinc/76/92/28/906769228.db2.gz DHMQBKKCZCHOFS-UHFFFAOYSA-N 0 3 403.954 4.120 20 0 HIADHN O=C(c1ccc(Cn2ccnc2)cc1)N(CCN1CCCC1)Cc1ccc(Cl)cc1 ZINC000496916463 906780628 /nfs/dbraw/zinc/78/06/28/906780628.db2.gz ZXZWLZCLJSKSJP-UHFFFAOYSA-N 0 3 422.960 4.323 20 0 HIADHN CCN(C)C(=O)c1cccc(NC(=O)NC[C@H](c2ccsc2)N(CC)CC)c1 ZINC000496934282 906784579 /nfs/dbraw/zinc/78/45/79/906784579.db2.gz NJMZFNKAABSSOO-LJQANCHMSA-N 0 3 402.564 4.045 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)N[C@H](c3ccc(F)cc3)c3ccccc3Cl)[C@H]2C1 ZINC000497372072 906861543 /nfs/dbraw/zinc/86/15/43/906861543.db2.gz ZGOPREPFVVEVOD-GQWLDOHISA-N 0 3 401.913 4.304 20 0 HIADHN Cc1sc(CNC(=O)N2CC[C@H]3CCN(C)C[C@H]32)nc1-c1ccc(Cl)cc1 ZINC000497377455 906865534 /nfs/dbraw/zinc/86/55/34/906865534.db2.gz WDVKJVMCUBOWJR-RHSMWYFYSA-N 0 3 404.967 4.008 20 0 HIADHN COCc1c(C(=O)N(CCN(C)C)Cc2ccc(C)o2)sc2cccc(F)c21 ZINC000497384535 906871697 /nfs/dbraw/zinc/87/16/97/906871697.db2.gz IFTBKHWOAJIEGM-UHFFFAOYSA-N 0 3 404.507 4.292 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)N[C@H](c3ccc(Br)cc3)C3CCC3)[C@@H]2C1 ZINC000497385976 906871726 /nfs/dbraw/zinc/87/17/26/906871726.db2.gz ILZBFPIYZLHKKZ-ZMYBRWDISA-N 0 3 406.368 4.026 20 0 HIADHN COc1cc(C(=O)N(CCN(C)C)Cc2ccc(C)o2)cc(Cl)c1OCC(C)C ZINC000497385075 906871750 /nfs/dbraw/zinc/87/17/50/906871750.db2.gz LYFBHWLVOAQEBL-UHFFFAOYSA-N 0 3 422.953 4.489 20 0 HIADHN O[C@H](COc1ccc(Br)cc1)CN1CCC(OC2CCCCC2)CC1 ZINC000497386256 906872115 /nfs/dbraw/zinc/87/21/15/906872115.db2.gz KDXURYSFPNQYCH-KRWDZBQOSA-N 0 3 412.368 4.003 20 0 HIADHN CN1C[C@@H](NC(=O)Cc2csc(-c3ccc(Cl)s3)n2)[C@@H](c2ccccc2)C1 ZINC000497413278 906889526 /nfs/dbraw/zinc/88/95/26/906889526.db2.gz AQJIGMNNJGECKN-HZPDHXFCSA-N 0 3 417.987 4.282 20 0 HIADHN CN1C[C@H](NC(=O)c2ccc(Oc3ccncc3)c(Cl)c2)[C@H](c2ccccc2)C1 ZINC000497415982 906890557 /nfs/dbraw/zinc/89/05/57/906890557.db2.gz IQTQGMYMFYALMI-FPOVZHCZSA-N 0 3 407.901 4.355 20 0 HIADHN CN1C[C@H](NC(=O)CCCc2ccc(Br)s2)[C@H](c2ccccc2)C1 ZINC000497415658 906890682 /nfs/dbraw/zinc/89/06/82/906890682.db2.gz HWXYRSOIHDTASZ-IRXDYDNUSA-N 0 3 407.377 4.047 20 0 HIADHN CCCNC(=O)[C@@H]1CCCN(Cc2c(-c3ccc(Cl)cc3)nc3sccn23)C1 ZINC000497421263 906894186 /nfs/dbraw/zinc/89/41/86/906894186.db2.gz VLUFSSMNDMYLPU-MRXNPFEDSA-N 0 3 416.978 4.454 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)Nc2cc(C)c(Br)cc2F)cc1 ZINC000497451435 906927781 /nfs/dbraw/zinc/92/77/81/906927781.db2.gz OZRUXZAYJJTTOW-GOSISDBHSA-N 0 3 424.314 4.330 20 0 HIADHN C[C@@H]1CN(C(=O)c2cc3sc4ccccc4c3s2)CC[C@@H]1N1CCN(C)CC1 ZINC000497479218 906961206 /nfs/dbraw/zinc/96/12/06/906961206.db2.gz YUKZUXMMASIUPI-WBVHZDCISA-N 0 3 413.612 4.214 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)N[C@H](c3ccccc3Cl)c3cc(F)ccc3F)[C@H]2C1 ZINC000497491237 906974828 /nfs/dbraw/zinc/97/48/28/906974828.db2.gz DDRRESJLNOAYRS-PUCZYUMASA-N 0 3 419.903 4.443 20 0 HIADHN Cn1c(=O)oc2cc(CN[C@@H](c3cc(F)cc(Br)c3)C3CC3)ccc21 ZINC000512678861 921285344 /nfs/dbraw/zinc/28/53/44/921285344.db2.gz SWCMXOACBBLDRG-GOSISDBHSA-N 0 3 405.267 4.274 20 0 HIADHN Cc1nc2c(s1)[C@H](N(C)C(=O)[C@H]1CN(Cc3ccccc3)CCC1(F)F)CCC2 ZINC000512689995 921288247 /nfs/dbraw/zinc/28/82/47/921288247.db2.gz KKAOQBDTDSAYAE-IEBWSBKVSA-N 0 3 419.541 4.445 20 0 HIADHN Cc1ccc(CNC(=O)C2CCN(Cc3cnc(-c4ccncc4)s3)CC2)cc1 ZINC000512689772 921288482 /nfs/dbraw/zinc/28/84/82/921288482.db2.gz JJMQBUPYGPNCAC-UHFFFAOYSA-N 0 3 406.555 4.042 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)c1csc(-c2ccc(C)o2)n1 ZINC000512704608 921292915 /nfs/dbraw/zinc/29/29/15/921292915.db2.gz RNGGVHOXXSVQRL-SFHVURJKSA-N 0 3 410.543 4.233 20 0 HIADHN CC(C)(C)[C@H](CN1CCc2ccccc2C1)NC(=O)N1CCCC[C@H]1c1cc[nH]n1 ZINC000497610027 907088380 /nfs/dbraw/zinc/08/83/80/907088380.db2.gz LXVVVENPXHQTPQ-VXKWHMMOSA-N 0 3 409.578 4.119 20 0 HIADHN C[C@@H]1[C@H](NC(=O)NCc2csc(-c3ccccc3)n2)CCN1Cc1ccccc1 ZINC000497615981 907093688 /nfs/dbraw/zinc/09/36/88/907093688.db2.gz AZWDOAMBAPWSBR-DYESRHJHSA-N 0 3 406.555 4.272 20 0 HIADHN O=C(Nc1ccc(-c2cncnc2)cc1)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000512722233 921296518 /nfs/dbraw/zinc/29/65/18/921296518.db2.gz CKKJQUOBDNHZAS-NRFANRHFSA-N 0 3 408.452 4.240 20 0 HIADHN CCc1nc(C(=O)NC[C@H]2CCCN(C)[C@H]2c2ccc(C(F)(F)F)cc2)c(C)o1 ZINC000512734105 921299174 /nfs/dbraw/zinc/29/91/74/921299174.db2.gz IVDLZNNLVVEQLF-BEFAXECRSA-N 0 3 409.452 4.377 20 0 HIADHN COc1cccc([C@H](CNC(=O)CCCOc2ccc(F)cc2F)N2CCCC2)c1 ZINC000497694688 907199051 /nfs/dbraw/zinc/19/90/51/907199051.db2.gz YFYJNOCBUZQUSQ-NRFANRHFSA-N 0 3 418.484 4.086 20 0 HIADHN CCc1nc(C(=O)NC[C@H](c2ccccc2)N2CCCC2)nn1-c1ccccc1Cl ZINC000497696071 907202416 /nfs/dbraw/zinc/20/24/16/907202416.db2.gz JXOULNVBHCXGCC-HXUWFJFHSA-N 0 3 423.948 4.050 20 0 HIADHN O=C(CCOc1cccc(Br)c1)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000497722392 907220637 /nfs/dbraw/zinc/22/06/37/907220637.db2.gz BTBNFODLCDKSLL-FQEVSTJZSA-N 0 3 417.347 4.171 20 0 HIADHN Cc1noc(C)c1C[C@@H](C)NC(=O)NC[C@H](c1ccc(CC(C)C)cc1)N(C)C ZINC000497732163 907230349 /nfs/dbraw/zinc/23/03/49/907230349.db2.gz WIHNRTACCINYCA-OPAMFIHVSA-N 0 3 400.567 4.023 20 0 HIADHN O=C(COc1ccc(Oc2ccccn2)cc1)NC[C@@H](c1cccs1)N1CCCC1 ZINC000497756503 907247266 /nfs/dbraw/zinc/24/72/66/907247266.db2.gz WVDPHIOWJNQGFC-FQEVSTJZSA-N 0 3 423.538 4.268 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(Cl)cc2)CC1)[C@@H]1CC[C@@H](C(F)(F)F)C1 ZINC000512779866 921310015 /nfs/dbraw/zinc/31/00/15/921310015.db2.gz UVJRGDRZYMVNDC-HUUCEWRRSA-N 0 3 418.887 4.278 20 0 HIADHN O=C(C[C@@H]1C[C@H]1c1ccccc1)NC1CCN(CCOc2ccc(Cl)cc2)CC1 ZINC000512779467 921310046 /nfs/dbraw/zinc/31/00/46/921310046.db2.gz QPIPIDOHCJBOET-CVDCTZTESA-N 0 3 412.961 4.493 20 0 HIADHN C[C@@H](NC(=O)N(CCCc1ccccc1)CCN(C)C)c1nccn1-c1ccccc1 ZINC000512794042 921312781 /nfs/dbraw/zinc/31/27/81/921312781.db2.gz YPKHIKHPIJNWKZ-OAQYLSRUSA-N 0 3 419.573 4.139 20 0 HIADHN C[C@@H](NC(=O)N(Cc1ccccc1)C1CCN(C)CC1)c1nccn1-c1ccccc1 ZINC000512797755 921313366 /nfs/dbraw/zinc/31/33/66/921313366.db2.gz NYXBMIGJXJRXMW-HXUWFJFHSA-N 0 3 417.557 4.239 20 0 HIADHN O=C(c1ccoc1)N1CCC(N[C@H](c2cc3ccccc3o2)c2cccnc2)CC1 ZINC000497842547 907321191 /nfs/dbraw/zinc/32/11/91/907321191.db2.gz JODYRHMZUQHBSW-QHCPKHFHSA-N 0 3 401.466 4.405 20 0 HIADHN CCc1ccc([C@H](N[C@H](C)CCn2cccn2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000497850954 907330788 /nfs/dbraw/zinc/33/07/88/907330788.db2.gz DKPXFALHIBRVGA-JPYJTQIMSA-N 0 3 411.571 4.007 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)c1ccc(F)cc1Br ZINC000497880723 907355823 /nfs/dbraw/zinc/35/58/23/907355823.db2.gz NHEMOZUAJAOBEG-UHFFFAOYSA-N 0 3 415.253 4.070 20 0 HIADHN C[C@@H]1CCC[C@H](C)N1C(=O)COc1ccc(C(=O)Nc2cccc(CN(C)C)c2)cc1 ZINC000497936202 907400366 /nfs/dbraw/zinc/40/03/66/907400366.db2.gz RPFSJAMKCSJKBI-KDURUIRLSA-N 0 3 423.557 4.169 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)[C@@H]3CCCc4ccccc43)CC2)c1 ZINC000497937273 907402255 /nfs/dbraw/zinc/40/22/55/907402255.db2.gz LEEYNSKDWGJKHP-RUZDIDTESA-N 0 3 405.586 4.134 20 0 HIADHN CCOC1CC2(C1)CCN([C@H]1CCCN(Cc3cccc(C(F)(F)F)c3)C1=O)C2 ZINC000512818540 921322542 /nfs/dbraw/zinc/32/25/42/921322542.db2.gz VETCOJXNGIVTMF-SCCNAQOGSA-N 0 3 410.480 4.087 20 0 HIADHN CC(C)(C)c1nc(CCNC(=O)N[C@@H](CN2CCCC2)c2ccccc2)cs1 ZINC000497951388 907421665 /nfs/dbraw/zinc/42/16/65/907421665.db2.gz PYPSHVQEKUAEJK-IBGZPJMESA-N 0 3 400.592 4.119 20 0 HIADHN CN1CC[C@H](NC(=O)N[C@@H](c2cccc(F)c2)c2ccccn2)[C@@H]1c1ccccc1 ZINC000497958296 907430405 /nfs/dbraw/zinc/43/04/05/907430405.db2.gz OFIDFYVOJUSVLI-VABKMULXSA-N 0 3 404.489 4.055 20 0 HIADHN COc1cc(CCC(=O)Nc2cccc(CN(C)C)c2)ccc1OCC(F)(F)F ZINC000497965317 907435208 /nfs/dbraw/zinc/43/52/08/907435208.db2.gz MYWIMLUXHWKMEX-UHFFFAOYSA-N 0 3 410.436 4.269 20 0 HIADHN COc1ccc([C@@H](CNC(=O)CCCOc2ccc(F)cc2F)N2CCCC2)cc1 ZINC000497972766 907444640 /nfs/dbraw/zinc/44/46/40/907444640.db2.gz YGEMYFIAPFIHAL-OAQYLSRUSA-N 0 3 418.484 4.086 20 0 HIADHN COc1cc(CN[C@@H](C)c2ccc3c(c2)OCCCO3)cc(Br)c1OC ZINC000512821065 921325732 /nfs/dbraw/zinc/32/57/32/921325732.db2.gz LSUJPEGMGYPGPH-ZDUSSCGKSA-N 0 3 422.319 4.478 20 0 HIADHN CC1CCN([C@@H](CNC(=O)Cc2ccc(-n3cccn3)cc2)c2cccs2)CC1 ZINC000498004180 907490554 /nfs/dbraw/zinc/49/05/54/907490554.db2.gz CUYVVEPVWURMRD-NRFANRHFSA-N 0 3 408.571 4.066 20 0 HIADHN COc1cccc(C2=CCN(C(=O)NC[C@H](c3ccc(OC(C)C)cc3)N(C)C)C2)c1 ZINC000512825282 921329467 /nfs/dbraw/zinc/32/94/67/921329467.db2.gz DEALNJFHZKTIMN-XMMPIXPASA-N 0 3 423.557 4.194 20 0 HIADHN CCN(C(=O)c1ccc(OCC(F)(F)F)nc1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000498019395 907516087 /nfs/dbraw/zinc/51/60/87/907516087.db2.gz QTABJHXREYCUQF-VQIMIIECSA-N 0 3 421.463 4.320 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)N(C)Cc2cc(F)cc(F)c2)N(C)C)cc1 ZINC000512827119 921330619 /nfs/dbraw/zinc/33/06/19/921330619.db2.gz LFGSTSSUEZMXFW-OAQYLSRUSA-N 0 3 405.489 4.196 20 0 HIADHN CC[C@H](CNC(=O)CCCOc1cccc(C(C)=O)c1)N1CCc2ccccc2C1 ZINC000498050705 907562496 /nfs/dbraw/zinc/56/24/96/907562496.db2.gz XQNQXYRGPAGASK-HSZRJFAPSA-N 0 3 408.542 4.001 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)c3cc(NCc4ccccc4)nc4ccccc43)[C@H]2C1 ZINC000498105420 907613603 /nfs/dbraw/zinc/61/36/03/907613603.db2.gz KLIUAGIIKXEYLK-CVDCTZTESA-N 0 3 400.526 4.013 20 0 HIADHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)c1ccnc2ccccc21 ZINC000498120314 907632567 /nfs/dbraw/zinc/63/25/67/907632567.db2.gz BUHZUBSNAGLMBX-UHFFFAOYSA-N 0 3 412.331 4.201 20 0 HIADHN CCOc1ccccc1C(=O)N(CCN(C)C)Cc1ccc(Br)cc1 ZINC000498120988 907633617 /nfs/dbraw/zinc/63/36/17/907633617.db2.gz LDSGCTCJRPRUNE-UHFFFAOYSA-N 0 3 405.336 4.052 20 0 HIADHN Cc1cccc([C@H](NC(=O)NC[C@H](C)N(C)Cc2ccccc2)c2ccccn2)c1 ZINC000498237959 907771160 /nfs/dbraw/zinc/77/11/60/907771160.db2.gz HHLPZPNKPVAJBD-RDPSFJRHSA-N 0 3 402.542 4.299 20 0 HIADHN C[C@H](CNC(=O)N[C@H](c1cccc(F)c1)c1ccccn1)N(C)Cc1ccccc1 ZINC000498238330 907771894 /nfs/dbraw/zinc/77/18/94/907771894.db2.gz JZFREGSQOHKSFT-WZONZLPQSA-N 0 3 406.505 4.130 20 0 HIADHN COc1ccc(F)cc1[C@@H](C)NC(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000498273438 907810045 /nfs/dbraw/zinc/81/00/45/907810045.db2.gz BPEBFVFPAUEFOW-VFNWGFHPSA-N 0 3 424.438 4.466 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@@H](C)NCc2nc3c(s2)C[C@H](C)CC3)CC1 ZINC000498350425 907851984 /nfs/dbraw/zinc/85/19/84/907851984.db2.gz XHISDJVWXAJZOU-IAGOWNOFSA-N 0 3 416.610 4.400 20 0 HIADHN CCOc1ccc([C@H](C)NC(=O)CCCNCc2nc3c(s2)C[C@@H](C)CC3)cc1 ZINC000498349555 907852215 /nfs/dbraw/zinc/85/22/15/907852215.db2.gz FIECEEQLGOEKQE-IRXDYDNUSA-N 0 3 415.603 4.414 20 0 HIADHN C[C@H]1CCc2nc(CNC3CCN(c4ccc(C(F)(F)F)cn4)CC3)sc2C1 ZINC000498360303 907857405 /nfs/dbraw/zinc/85/74/05/907857405.db2.gz ZVLZQHYTODHUIU-ZDUSSCGKSA-N 0 3 410.509 4.440 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cccc(Cn2nc(C)cc2C)c1)c1ccsc1 ZINC000498369102 907861543 /nfs/dbraw/zinc/86/15/43/907861543.db2.gz JNCPYNIBIQZTAV-JOCHJYFZSA-N 0 3 410.587 4.423 20 0 HIADHN CCC(CC)[C@H]1C[C@@H](NC(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)CCO1 ZINC000498377763 907867113 /nfs/dbraw/zinc/86/71/13/907867113.db2.gz VPCOWAMAGRLZPL-GHTZIAJQSA-N 0 3 411.537 4.022 20 0 HIADHN CC[C@@H](NCc1cc(Br)c2c(c1)OCCO2)c1ccc(OC)c(OC)c1 ZINC000512863721 921364543 /nfs/dbraw/zinc/36/45/43/921364543.db2.gz FZKXIGSIGNKSMJ-MRXNPFEDSA-N 0 3 422.319 4.478 20 0 HIADHN Cc1nn(C(C)(C)C)c2nc(C3CC3)cc(C(=O)N(CCN(C)C)C3CCCC3)c12 ZINC000498465499 907932893 /nfs/dbraw/zinc/93/28/93/907932893.db2.gz RQPMYAFZSGKUKO-UHFFFAOYSA-N 0 3 411.594 4.319 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)NCc1ccccc1N1CCCCC1 ZINC000498471843 907941663 /nfs/dbraw/zinc/94/16/63/907941663.db2.gz QWDBNEMKWOBRKQ-UHFFFAOYSA-N 0 3 412.553 4.089 20 0 HIADHN CCN1CCN(CCNC(=O)c2sc3cc(Cl)cc(Cl)c3c2Cl)CC1 ZINC000498509826 907982488 /nfs/dbraw/zinc/98/24/88/907982488.db2.gz JYKALJACFGNEIB-UHFFFAOYSA-N 0 3 420.793 4.229 20 0 HIADHN O=C(c1cccc(CN2CCCC2)c1)N1CCN(Cc2ccc(F)cc2Cl)CC1 ZINC000498556671 908017400 /nfs/dbraw/zinc/01/74/00/908017400.db2.gz IZNDOITWAHNLNB-UHFFFAOYSA-N 0 3 415.940 4.033 20 0 HIADHN CC(C)(C)c1nc(CCNC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)cs1 ZINC000498599600 908048249 /nfs/dbraw/zinc/04/82/49/908048249.db2.gz JMWQACXCVIPRER-KRWDZBQOSA-N 0 3 403.567 4.151 20 0 HIADHN C[C@@H]1CCN(C)CCN1C(=O)c1ccc(Oc2cccc(Br)c2)cc1 ZINC000498710575 908135880 /nfs/dbraw/zinc/13/58/80/908135880.db2.gz PRJVURMMXNTAHK-OAHLLOKOSA-N 0 3 403.320 4.408 20 0 HIADHN Cc1ccc(-c2nn(-c3ccc(F)cc3)cc2C(=O)N2CCN(C)CC[C@H]2C)cc1 ZINC000498730003 908157962 /nfs/dbraw/zinc/15/79/62/908157962.db2.gz XJSQYURMORBZHK-GOSISDBHSA-N 0 3 406.505 4.153 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N[C@@H](C)c1nc(C2CCCCC2)no1)c1ccco1 ZINC000498733501 908162732 /nfs/dbraw/zinc/16/27/32/908162732.db2.gz YDQFNTQWBCZACZ-ZOBUZTSGSA-N 0 3 403.527 4.200 20 0 HIADHN O=C(Nc1ccc(F)cc1)[C@H](c1ccccc1)N1CCC[C@@H](c2nc(C3CC3)n[nH]2)C1 ZINC000498904727 908311802 /nfs/dbraw/zinc/31/18/02/908311802.db2.gz KDYQOAZGEQOHCB-NQIIRXRSSA-N 0 3 419.504 4.381 20 0 HIADHN O=C(Nc1ccc(F)cc1)[C@H](c1ccccc1)N1CCC[C@@H](c2n[nH]c(C3CC3)n2)C1 ZINC000498904727 908311819 /nfs/dbraw/zinc/31/18/19/908311819.db2.gz KDYQOAZGEQOHCB-NQIIRXRSSA-N 0 3 419.504 4.381 20 0 HIADHN O=C(Nc1ccc(F)cc1)[C@@H](c1ccccc1)N1CCC[C@@H](c2nc(C3CC3)n[nH]2)C1 ZINC000498904729 908312615 /nfs/dbraw/zinc/31/26/15/908312615.db2.gz KDYQOAZGEQOHCB-WIYYLYMNSA-N 0 3 419.504 4.381 20 0 HIADHN O=C(Nc1ccc(F)cc1)[C@@H](c1ccccc1)N1CCC[C@@H](c2n[nH]c(C3CC3)n2)C1 ZINC000498904729 908312636 /nfs/dbraw/zinc/31/26/36/908312636.db2.gz KDYQOAZGEQOHCB-WIYYLYMNSA-N 0 3 419.504 4.381 20 0 HIADHN CCN1C[C@H](C)N(Cc2csc(N(C(C)=O)c3cccc(C)c3C)n2)C[C@H]1C ZINC000498914792 908324249 /nfs/dbraw/zinc/32/42/49/908324249.db2.gz KBBFSUAQKXDSMU-SJORKVTESA-N 0 3 400.592 4.359 20 0 HIADHN CCN(Cc1ccc(OCc2ccccc2)cc1)C(=O)CN1C[C@@H](C)N(CC)C[C@H]1C ZINC000498927049 908335834 /nfs/dbraw/zinc/33/58/34/908335834.db2.gz TYZBKZLXYVTIIJ-FGZHOGPDSA-N 0 3 423.601 4.029 20 0 HIADHN CCN1C[C@@H](C)N(CC(=O)Nc2nc(-c3cc(C)c(C)cc3C)cs2)C[C@@H]1C ZINC000498944131 908349212 /nfs/dbraw/zinc/34/92/12/908349212.db2.gz ZMQACYRMPKIZIM-ZWKOTPCHSA-N 0 3 400.592 4.088 20 0 HIADHN CN(C)S(=O)(=O)c1ccc(CNC(C)(C)c2ccc(Cl)c(Cl)c2)cc1 ZINC000499049416 908421686 /nfs/dbraw/zinc/42/16/86/908421686.db2.gz YZSVZOZBHQOJLJ-UHFFFAOYSA-N 0 3 401.359 4.269 20 0 HIADHN C[C@@H](c1ccc(C(F)(F)F)cc1)N(C)Cc1ccc(S(=O)(=O)N(C)C)cc1 ZINC000499064678 908431429 /nfs/dbraw/zinc/43/14/29/908431429.db2.gz LPZTWBBHZIDAQS-AWEZNQCLSA-N 0 3 400.466 4.149 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)N2CC[C@H](C(F)(F)F)C2(C)C)N(C)C)cc1 ZINC000512918663 921412227 /nfs/dbraw/zinc/41/22/27/921412227.db2.gz ROJKXJJVRXHPIW-ROUUACIJSA-N 0 3 415.500 4.449 20 0 HIADHN C[C@H]1CN(C2CC2)C[C@H]1NC(=O)N1CCc2nc(-c3ccccc3Cl)sc2C1 ZINC000499194198 908548794 /nfs/dbraw/zinc/54/87/94/908548794.db2.gz SAFMRMPPMGDYPL-SCLBCKFNSA-N 0 3 416.978 4.014 20 0 HIADHN Cc1cc(C(=O)N(CCN(C)C)Cc2cccc(Cl)c2)c2cnn(C(C)C)c2n1 ZINC000499252183 908627304 /nfs/dbraw/zinc/62/73/04/908627304.db2.gz XQWKAKCIUIRPAN-UHFFFAOYSA-N 0 3 413.953 4.178 20 0 HIADHN Cc1cn(-c2ccccc2Cl)nc1C(=O)N(Cc1ccco1)C1CCN(C)CC1 ZINC000499292476 908664576 /nfs/dbraw/zinc/66/45/76/908664576.db2.gz TUXUOOPDHSNUNL-UHFFFAOYSA-N 0 3 412.921 4.164 20 0 HIADHN C[C@H](NC(=O)NCCc1csc(-c2ccccc2)n1)[C@H](c1ccccc1)N(C)C ZINC000499333216 908709412 /nfs/dbraw/zinc/70/94/12/908709412.db2.gz CRPNIFBQYMNUER-LAUBAEHRSA-N 0 3 408.571 4.343 20 0 HIADHN CC[C@H](C)n1ncc2c1nc(C)cc2C(=O)N(CCN(C)C)Cc1cccc(F)c1 ZINC000499360316 908728913 /nfs/dbraw/zinc/72/89/13/908728913.db2.gz VOJQCVSJMWPJMK-KRWDZBQOSA-N 0 3 411.525 4.054 20 0 HIADHN COc1ccc(CCC(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)cc1Cl ZINC000499365493 908733448 /nfs/dbraw/zinc/73/34/48/908733448.db2.gz UJVGVAGCOOILEC-UHFFFAOYSA-N 0 3 410.892 4.150 20 0 HIADHN CSc1cc(C(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)ccc1F ZINC000499446429 908803209 /nfs/dbraw/zinc/80/32/09/908803209.db2.gz ZWZKQTGHLAZCIE-GOSISDBHSA-N 0 3 410.518 4.443 20 0 HIADHN COc1ccc([C@@H](CNC(=O)N[C@H](C)c2cccc(F)c2F)N2CCCC2)cc1 ZINC000499477556 908811256 /nfs/dbraw/zinc/81/12/56/908811256.db2.gz BYSHRTHXGNGLMU-FOIQADDNSA-N 0 3 403.473 4.171 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)NCc2nc(C(C)C)cs2)N(C)C)cc1 ZINC000499566913 908843057 /nfs/dbraw/zinc/84/30/57/908843057.db2.gz PGEAMOOVBLHGQY-IBGZPJMESA-N 0 3 404.580 4.156 20 0 HIADHN CN(C(=O)c1ccc(CSc2nccn2C)o1)C1CCN(Cc2ccccc2)CC1 ZINC000499626051 908859661 /nfs/dbraw/zinc/85/96/61/908859661.db2.gz MGIOHNVRPMXZTR-UHFFFAOYSA-N 0 3 424.570 4.042 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1C(=O)N(C)C1CCN(Cc2ccccc2)CC1 ZINC000499661063 908868000 /nfs/dbraw/zinc/86/80/00/908868000.db2.gz NGXTWYBQJIBJCV-UHFFFAOYSA-N 0 3 402.542 4.226 20 0 HIADHN Cc1nn(-c2ccccc2)c(Oc2cccc(F)c2)c1CNCCc1cnn(C)c1 ZINC000499663033 908868821 /nfs/dbraw/zinc/86/88/21/908868821.db2.gz IZRPOFJUTRJKCL-UHFFFAOYSA-N 0 3 405.477 4.178 20 0 HIADHN O=C(c1cc(Cl)c[nH]1)N1CCC(NCc2csc(-c3ccsc3)n2)CC1 ZINC000512989494 921457391 /nfs/dbraw/zinc/45/73/91/921457391.db2.gz VWAAYMCKSYOZGS-UHFFFAOYSA-N 0 3 406.964 4.248 20 0 HIADHN COc1ccc(-c2n[nH]cc2CN2CCC(C(=O)Nc3cccc(F)c3)CC2)cc1 ZINC000513021982 921484095 /nfs/dbraw/zinc/48/40/95/921484095.db2.gz MYKKRVFBHROKKV-UHFFFAOYSA-N 0 3 408.477 4.075 20 0 HIADHN Cc1cc(C[C@H](C)NC(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)n(-c2ccccc2)n1 ZINC000499957685 909398116 /nfs/dbraw/zinc/39/81/16/909398116.db2.gz NFOLNICGFPEUIW-MFSJNOQSSA-N 0 3 419.573 4.102 20 0 HIADHN CCN(C(=O)c1cc(C)n(-c2ccccc2)n1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000499998901 909451468 /nfs/dbraw/zinc/45/14/68/909451468.db2.gz HIHOXHSZUUYQGO-NZQKXSOJSA-N 0 3 402.542 4.478 20 0 HIADHN CC(C)Cn1ncc(NC(=O)N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)c1C(C)C ZINC000500006876 909456934 /nfs/dbraw/zinc/45/69/34/909456934.db2.gz UKTWLBOVFUUMAF-KDURUIRLSA-N 0 3 419.614 4.016 20 0 HIADHN Cc1nc(COc2ccc(CNCc3ccc(C[S@@](C)=O)cc3)cc2)cs1 ZINC000513039583 921498684 /nfs/dbraw/zinc/49/86/84/921498684.db2.gz BPWIYUHFDMCZME-HHHXNRCGSA-N 0 3 400.569 4.199 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)Nc1nc2c(ccc(F)c2F)s1 ZINC000500039540 909498116 /nfs/dbraw/zinc/49/81/16/909498116.db2.gz SANYAZZRONCLRG-UHFFFAOYSA-N 0 3 408.449 4.309 20 0 HIADHN Cc1cc2occ(CC(=O)N(C)C3CCN(CCc4ccccn4)CC3)c2cc1C ZINC000500063398 909529858 /nfs/dbraw/zinc/52/98/58/909529858.db2.gz LNNHDDAOBYEVFV-UHFFFAOYSA-N 0 3 405.542 4.153 20 0 HIADHN Fc1cccc(-c2noc([C@@H]3CCCN(Cc4cnn(CC(F)(F)F)c4)C3)n2)c1 ZINC000513047235 921506276 /nfs/dbraw/zinc/50/62/76/921506276.db2.gz QEQNJYIMMCPNFL-OAHLLOKOSA-N 0 3 409.387 4.014 20 0 HIADHN COc1ccc(C(=O)CCCC(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@@H]2C)cc1 ZINC000500103913 909587387 /nfs/dbraw/zinc/58/73/87/909587387.db2.gz FFJXGSXTWNPKOQ-WMZHIEFXSA-N 0 3 408.542 4.075 20 0 HIADHN COc1ccc(C(=O)CCCC(=O)N[C@H]2CCN(Cc3ccccc3)C[C@H]2C)cc1 ZINC000500103914 909587459 /nfs/dbraw/zinc/58/74/59/909587459.db2.gz FFJXGSXTWNPKOQ-XXBNENTESA-N 0 3 408.542 4.075 20 0 HIADHN C[C@@H](NC(C)(C)CNS(=O)(=O)Cc1ccccc1C(F)(F)F)c1ccccc1 ZINC000500111319 909592017 /nfs/dbraw/zinc/59/20/17/909592017.db2.gz ZDSSBTYBQCKEDA-OAHLLOKOSA-N 0 3 414.493 4.254 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1nn(-c2ccc(F)cc2)cc1C)c1ccsc1 ZINC000513049202 921508115 /nfs/dbraw/zinc/50/81/15/921508115.db2.gz PXIJOQLOGFINSF-LJQANCHMSA-N 0 3 400.523 4.194 20 0 HIADHN O[C@H](COCc1ccco1)CN1CCC(F)(c2ccccc2OC(F)(F)F)CC1 ZINC000500120434 909600828 /nfs/dbraw/zinc/60/08/28/909600828.db2.gz BKNBWZFGXUWQQN-HNNXBMFYSA-N 0 3 417.399 4.017 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CN1CCC(C(=O)Nc2cccc(F)c2)CC1 ZINC000513056129 921512836 /nfs/dbraw/zinc/51/28/36/921512836.db2.gz HLMQIGRRTNOLRK-UHFFFAOYSA-N 0 3 406.505 4.479 20 0 HIADHN COc1ccccc1[C@H](NC(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C)c1ccco1 ZINC000500178424 909672406 /nfs/dbraw/zinc/67/24/06/909672406.db2.gz JNSKWAOFQNIUST-RTFZILSDSA-N 0 3 407.514 4.368 20 0 HIADHN O=C(CN1CCC[C@@H](Cc2ccccc2)C1)N1CCC(OCc2ccccc2)CC1 ZINC000500214705 909704514 /nfs/dbraw/zinc/70/45/14/909704514.db2.gz KEVZCWWZWVWIKW-DEOSSOPVSA-N 0 3 406.570 4.149 20 0 HIADHN CCN(C(=O)C(=O)Nc1cccc(F)c1Cl)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000500225587 909717003 /nfs/dbraw/zinc/71/70/03/909717003.db2.gz CNQCNADWMNHWNC-WBVHZDCISA-N 0 3 417.912 4.102 20 0 HIADHN CNC(=O)[C@@H]1CCC[C@H]1NCc1c(C)nn(-c2ccccc2)c1Oc1cccc(F)c1 ZINC000500230268 909719380 /nfs/dbraw/zinc/71/93/80/909719380.db2.gz PDIFGMKYVQZSDI-IFMALSPDSA-N 0 3 422.504 4.116 20 0 HIADHN C[C@@H](Cn1ncc2ccccc2c1=O)NCc1cccc(OCc2ccc(F)cc2)c1 ZINC000500248012 909736219 /nfs/dbraw/zinc/73/62/19/909736219.db2.gz DGJPWFZPAZSPHU-SFHVURJKSA-N 0 3 417.484 4.293 20 0 HIADHN CCc1nnc(NC(=O)[C@@H](C)[C@H](C)NCc2c(Cl)cccc2N2CCCC2)s1 ZINC000513064568 921521657 /nfs/dbraw/zinc/52/16/57/921521657.db2.gz QJFCSPZNCGCNOF-KBPBESRZSA-N 0 3 421.998 4.107 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)c2cccc([C@@H]3CCCOC3)c2)cc1 ZINC000500387396 909828508 /nfs/dbraw/zinc/82/85/08/909828508.db2.gz GWPPPQIXGPRPPL-ISKFKSNPSA-N 0 3 408.542 4.156 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)c2cccc([C@H]3CCCOC3)c2)cc1 ZINC000500387397 909829130 /nfs/dbraw/zinc/82/91/30/909829130.db2.gz GWPPPQIXGPRPPL-LADGPHEKSA-N 0 3 408.542 4.156 20 0 HIADHN COc1cc(CN[C@H](C)c2ccc(OCc3ccncc3)c(OC)c2)cc(OC)c1O ZINC000513075705 921528849 /nfs/dbraw/zinc/52/88/49/921528849.db2.gz OFOHSRATRJNFMC-MRXNPFEDSA-N 0 3 424.497 4.243 20 0 HIADHN CC(C)CN(C(=O)C[C@@H](NC(=O)c1ccccc1)c1ccccc1)C1CCN(C)CC1 ZINC000500677731 910014996 /nfs/dbraw/zinc/01/49/96/910014996.db2.gz JIIHFIRISYXARS-XMMPIXPASA-N 0 3 421.585 4.127 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCCc3ccc(F)cc3Cl)c(C)c2)CC1 ZINC000500752547 910060191 /nfs/dbraw/zinc/06/01/91/910060191.db2.gz FXLIWKAXCIVXIX-UHFFFAOYSA-N 0 3 418.944 4.294 20 0 HIADHN Cc1ccc(NC(=O)CNC(C)(C)COCc2ccccc2)c(Br)c1 ZINC000500820657 910101526 /nfs/dbraw/zinc/10/15/26/910101526.db2.gz GYPHKPOPDZTGSY-UHFFFAOYSA-N 0 3 405.336 4.281 20 0 HIADHN C[C@H](CC(=O)N[C@@H]1CCN(Cc2ccccc2)CC1(C)C)C(=O)c1cccc(F)c1 ZINC000513110543 921557435 /nfs/dbraw/zinc/55/74/35/921557435.db2.gz QEYQQHXTKZQQDO-XMSQKQJNSA-N 0 3 410.533 4.452 20 0 HIADHN CCSc1cc(C(=O)N(CCN(C)C)Cc2ccc(Br)cc2)ccn1 ZINC000500990084 910219743 /nfs/dbraw/zinc/21/97/43/910219743.db2.gz VGJWJJRFNKOJOV-UHFFFAOYSA-N 0 3 422.392 4.160 20 0 HIADHN CN(C)[C@@H](CNC(=O)NC[C@H](c1cccc(Cl)c1)N1CCCC1)c1cccs1 ZINC000501012217 910233570 /nfs/dbraw/zinc/23/35/70/910233570.db2.gz VHWHDKJRTAOJKV-MOPGFXCFSA-N 0 3 421.010 4.141 20 0 HIADHN CCCCOc1cc(CN2CCC3(C[C@@H]3C(=O)N3CCCCC3)CC2)ccc1OC ZINC000501098110 910293907 /nfs/dbraw/zinc/29/39/07/910293907.db2.gz COJVPYSIRZEMNC-OAQYLSRUSA-N 0 3 414.590 4.489 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)Nc2cccc(NC(=O)c3ccoc3)c2)C1 ZINC000501148265 910322655 /nfs/dbraw/zinc/32/26/55/910322655.db2.gz LSCJMZFSUCFLTK-VGOFRKELSA-N 0 3 418.497 4.489 20 0 HIADHN COc1cccc([C@@H](CNC(=O)Nc2c(C)cc(N(C)C)cc2C)N2CCCC2)c1 ZINC000501191066 910353696 /nfs/dbraw/zinc/35/36/96/910353696.db2.gz YOLUAUUFJPFSIV-JOCHJYFZSA-N 0 3 410.562 4.337 20 0 HIADHN COc1ccc([C@@H](CNC(=O)Nc2c(C)cc(N(C)C)cc2C)N2CCCC2)cc1 ZINC000501193435 910355359 /nfs/dbraw/zinc/35/53/59/910355359.db2.gz GCVJERSIKQKZQV-JOCHJYFZSA-N 0 3 410.562 4.337 20 0 HIADHN C[C@H](CC(=O)c1ccccc1F)C(=O)N[C@@H]1CCN(Cc2ccccc2)CC1(C)C ZINC000513126317 921570128 /nfs/dbraw/zinc/57/01/28/921570128.db2.gz RCRJIETZLFDGBX-WZONZLPQSA-N 0 3 410.533 4.452 20 0 HIADHN Cc1noc(CSc2ccc(C(=O)N(CCN(C)C)CC3CCCCC3)cc2)n1 ZINC000501227917 910388080 /nfs/dbraw/zinc/38/80/80/910388080.db2.gz MLUVXBVSBSMFMW-UHFFFAOYSA-N 0 3 416.591 4.254 20 0 HIADHN COc1ccc(-c2nc(C(=O)N(CCN(C)C)CC3CCCCC3)cs2)cc1 ZINC000501238517 910395752 /nfs/dbraw/zinc/39/57/52/910395752.db2.gz INLXDDHCUPWIFW-UHFFFAOYSA-N 0 3 401.576 4.403 20 0 HIADHN Cc1ccc2nc(-c3ccc(NC(=O)CN[C@H](C)Cn4cccn4)cc3)sc2c1 ZINC000501262432 910422329 /nfs/dbraw/zinc/42/23/29/910422329.db2.gz LJDBJFSLCQVPQF-MRXNPFEDSA-N 0 3 405.527 4.085 20 0 HIADHN CCN(C(=O)c1cnc(C2CCCC2)nc1N)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000501281217 910443090 /nfs/dbraw/zinc/44/30/90/910443090.db2.gz JPKAMFQDZGZSJL-PXNSSMCTSA-N 0 3 407.562 4.014 20 0 HIADHN CC1CCN([C@H](CNC(=O)[C@@H](c2ccccc2)n2cccn2)c2ccccc2)CC1 ZINC000513137296 921577698 /nfs/dbraw/zinc/57/76/98/921577698.db2.gz JIJOYLWJWIPLMP-DNQXCXABSA-N 0 3 402.542 4.062 20 0 HIADHN CC[C@H](CNC(=O)N(C)Cc1ccc(OC(F)F)cc1)N1CCc2ccccc2C1 ZINC000501389887 910522036 /nfs/dbraw/zinc/52/20/36/910522036.db2.gz QLOATCGPUHDHSN-HXUWFJFHSA-N 0 3 417.500 4.266 20 0 HIADHN Cc1ccc(S(=O)(=O)NC[C@H]2CCCN(Cc3cc(C)nc4ccccc34)C2)cc1 ZINC000513145299 921583324 /nfs/dbraw/zinc/58/33/24/921583324.db2.gz QQSDYTQTNQQTPQ-HXUWFJFHSA-N 0 3 423.582 4.042 20 0 HIADHN O=C(CN[C@@]1(Cc2ccc(C(F)(F)F)cc2)CCOC1)Nc1ccccc1Cl ZINC000513174665 921601128 /nfs/dbraw/zinc/60/11/28/921601128.db2.gz XIHPKEPFRFBDOC-LJQANCHMSA-N 0 3 412.839 4.289 20 0 HIADHN Cc1nc(-c2ccc(CNC(=O)N(Cc3ccco3)C3CCN(C)CC3)o2)cs1 ZINC000501735901 910797651 /nfs/dbraw/zinc/79/76/51/910797651.db2.gz FNMMCWDGSQZACN-UHFFFAOYSA-N 0 3 414.531 4.111 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)Nc1ccc2c(c1)OC1(CCCC1)O2 ZINC000501758809 910815559 /nfs/dbraw/zinc/81/55/59/910815559.db2.gz JUIHNACBBBZPII-UHFFFAOYSA-N 0 3 407.514 4.298 20 0 HIADHN CC(C)(C)c1n[nH]cc1CN1CCC[C@H](c2n[nH]cc2NC(=O)c2ccccc2)C1 ZINC000501770598 910825233 /nfs/dbraw/zinc/82/52/33/910825233.db2.gz NWZRDTKINPCACB-KRWDZBQOSA-N 0 3 406.534 4.062 20 0 HIADHN C[C@H](NC(=O)N[C@H](CN1CCCC1)c1ccccc1)c1cccc(OC(F)F)c1 ZINC000501799049 910850517 /nfs/dbraw/zinc/85/05/17/910850517.db2.gz FPLBGHBXBDOXNN-OXJNMPFZSA-N 0 3 403.473 4.485 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cc(NC(=O)N(C)C)ccc1Cl)c1ccsc1 ZINC000501807588 910857849 /nfs/dbraw/zinc/85/78/49/910857849.db2.gz BGLFZPDIINKMLM-GOSISDBHSA-N 0 3 422.982 4.308 20 0 HIADHN COc1cccc(C(=O)NC[C@H](C(C)C)N2CCc3ccccc3C2)c1OC(F)F ZINC000501819587 910867175 /nfs/dbraw/zinc/86/71/75/910867175.db2.gz IJQRLJGBWSSRON-LJQANCHMSA-N 0 3 418.484 4.109 20 0 HIADHN C[C@@H](NC(=O)N[C@@H](CN1CCCC1)c1ccccc1)c1ccc(NC(=O)C2CC2)cc1 ZINC000501834879 910876267 /nfs/dbraw/zinc/87/62/67/910876267.db2.gz ZTDXPSUOXJQLTH-JPYJTQIMSA-N 0 3 420.557 4.232 20 0 HIADHN C[C@H](CC(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1)c1ccc(F)cc1F ZINC000501876377 910899196 /nfs/dbraw/zinc/89/91/96/910899196.db2.gz ZGTRMQMYWZWFNX-KZNAEPCWSA-N 0 3 408.533 4.196 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)N[C@@H]2CCCc3cn(C4CCCC4)nc32)CCN1Cc1ccccc1 ZINC000501921290 910918511 /nfs/dbraw/zinc/91/85/11/910918511.db2.gz ZCBXXWQZKQRTDL-YFXJRYMSSA-N 0 3 421.589 4.338 20 0 HIADHN COc1ccc(NC(=O)[C@H](C)NCC2(c3c(F)cccc3F)CCCC2)c(OC)c1 ZINC000501987244 910965085 /nfs/dbraw/zinc/96/50/85/910965085.db2.gz VGNCCRNPABAWNF-HNNXBMFYSA-N 0 3 418.484 4.411 20 0 HIADHN CC(C)(COc1ccc(C(F)(F)F)cn1)NCC(=O)Nc1ccc(F)cc1Cl ZINC000502220138 911163180 /nfs/dbraw/zinc/16/31/80/911163180.db2.gz TZWGSTZGGDAQMV-UHFFFAOYSA-N 0 3 419.806 4.279 20 0 HIADHN CCc1c(C(=O)NC[C@H](c2ccsc2)N(CC)CC)cnn1Cc1ccccc1 ZINC000513223262 921638793 /nfs/dbraw/zinc/63/87/93/921638793.db2.gz SKXAFKAZVGZAHD-JOCHJYFZSA-N 0 3 410.587 4.368 20 0 HIADHN O=C(Cc1csc(-c2cccc(F)c2)n1)NC[C@@H]1CCCN1Cc1ccccc1 ZINC000513231751 921643609 /nfs/dbraw/zinc/64/36/09/921643609.db2.gz FFZVPNKIOIHQHU-NRFANRHFSA-N 0 3 409.530 4.273 20 0 HIADHN COc1ccc(NC(=O)C[C@@H](C)N[C@H]2CCOc3c(Br)cccc32)cc1 ZINC000502335222 911315951 /nfs/dbraw/zinc/31/59/51/911315951.db2.gz BDPOLRZDABBIMK-ACJLOTCBSA-N 0 3 419.319 4.288 20 0 HIADHN COc1cc(CN2CCC[C@H](c3ncc4n3CCCC4)C2)c(SC)cc1OC ZINC000502345070 911326280 /nfs/dbraw/zinc/32/62/80/911326280.db2.gz XKFQPHKQABAVOT-INIZCTEOSA-N 0 3 401.576 4.338 20 0 HIADHN Cc1ccc([C@H](C)N(C)C(=O)NCCCN2CCN(C)C[C@@H]2c2ccccc2)cc1 ZINC000502347034 911328805 /nfs/dbraw/zinc/32/88/05/911328805.db2.gz STVOXOIAFMDASN-XUZZJYLKSA-N 0 3 408.590 4.076 20 0 HIADHN COc1cc(CCNC(=O)CN2C[C@H](C)C[C@H]2c2ccccc2)ccc1OC(F)F ZINC000513259363 921664623 /nfs/dbraw/zinc/66/46/23/921664623.db2.gz AZDMTDLMGDZINQ-APWZRJJASA-N 0 3 418.484 4.038 20 0 HIADHN COc1ccc([C@H]2CCCN2C(=O)CN[C@@H](c2ccc(F)cc2)C(C)C)c(OC)c1 ZINC000502508407 911514484 /nfs/dbraw/zinc/51/44/84/911514484.db2.gz IGUOOGJLFJPGLO-ZJSXRUAMSA-N 0 3 414.521 4.493 20 0 HIADHN O=C(NCc1ccco1)c1cccc(CN[C@]2(Cc3ccc(Cl)cc3)CCOC2)c1 ZINC000502533561 911539749 /nfs/dbraw/zinc/53/97/49/911539749.db2.gz ZNADCBIXYKCWJT-DEOSSOPVSA-N 0 3 424.928 4.354 20 0 HIADHN COc1ccc(NC(=O)[C@H](c2ccccc2)N(C)CC2CCOCC2)cc1Cl ZINC000502554018 911562474 /nfs/dbraw/zinc/56/24/74/911562474.db2.gz NKZWVUIPCJZEEJ-NRFANRHFSA-N 0 3 402.922 4.387 20 0 HIADHN O=S1(=O)CC[C@H](NC[C@H]2CCCC(F)(F)C2)c2cc(Br)ccc21 ZINC000502573047 911578886 /nfs/dbraw/zinc/57/88/86/911578886.db2.gz CTJRKJZKEPMCLD-FZMZJTMJSA-N 0 3 408.308 4.083 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3cccc(-c4noc(C)n4)c3)c(C)c2)CC1 ZINC000502623249 911650687 /nfs/dbraw/zinc/65/06/87/911650687.db2.gz PXKVBEQZFVTKME-UHFFFAOYSA-N 0 3 420.517 4.139 20 0 HIADHN C[C@H](NC(=O)N1CCCN(Cc2ccccc2)CC1)c1ccc(NC(=O)C2CC2)cc1 ZINC000502666511 911706876 /nfs/dbraw/zinc/70/68/76/911706876.db2.gz KTDVVJZWKVLQCU-IBGZPJMESA-N 0 3 420.557 4.014 20 0 HIADHN CCSc1cc(CNC(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)ccn1 ZINC000502683478 911723654 /nfs/dbraw/zinc/72/36/54/911723654.db2.gz WICGILXPVWHMHN-HXUWFJFHSA-N 0 3 416.591 4.083 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CCC[C@@H](COC)C1)c1ccc(C(F)(F)F)cc1 ZINC000502844454 911854622 /nfs/dbraw/zinc/85/46/22/911854622.db2.gz ACQAOZGDIXCQJH-APWZRJJASA-N 0 3 415.500 4.156 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)NCCCC[NH+]3C[C@H](C)C[C@@H](C)C3)cc2)cc(=O)[n-]1 ZINC000502862490 911869071 /nfs/dbraw/zinc/86/90/71/911869071.db2.gz OGTCGGMZRQNZME-IAGOWNOFSA-N 0 3 411.550 4.037 20 0 HIADHN COc1ccc2cc(C(=O)Nc3cccc(N4CCN(C(C)C)CC4)c3)c(C)nc2c1 ZINC000502881108 911880726 /nfs/dbraw/zinc/88/07/26/911880726.db2.gz PIUJQUVESSSIAF-UHFFFAOYSA-N 0 3 418.541 4.335 20 0 HIADHN CCCc1noc2nc(CC)cc(C(=O)N(Cc3ccccc3)C3CCN(C)CC3)c12 ZINC000503004510 911979292 /nfs/dbraw/zinc/97/92/92/911979292.db2.gz VFAORTOLHOXUGB-UHFFFAOYSA-N 0 3 420.557 4.474 20 0 HIADHN Cc1nccn1CCCN(C)CC(=O)N[C@@H](c1ccccc1)c1cccc(Cl)c1 ZINC000503056155 912020076 /nfs/dbraw/zinc/02/00/76/912020076.db2.gz ZNZHJSVBKFYIEV-QHCPKHFHSA-N 0 3 410.949 4.073 20 0 HIADHN CN(C)S(=O)(=O)c1ccc(CN(Cc2cccc(-c3cccnc3)c2)C2CC2)cc1 ZINC000503062053 912025517 /nfs/dbraw/zinc/02/55/17/912025517.db2.gz IVNLSFWXFOAYIR-UHFFFAOYSA-N 0 3 421.566 4.164 20 0 HIADHN COc1cccc([C@@H](CNC(=O)Nc2ccc(OCC3CC3)cc2)N2CCCC2)c1 ZINC000503093014 912063410 /nfs/dbraw/zinc/06/34/10/912063410.db2.gz LIGHVCMVMNVUDX-HSZRJFAPSA-N 0 3 409.530 4.443 20 0 HIADHN COc1cccc([C@H](CNC(=O)Nc2ccc(OCC3CC3)cc2)N2CCCC2)c1 ZINC000503093015 912064289 /nfs/dbraw/zinc/06/42/89/912064289.db2.gz LIGHVCMVMNVUDX-QHCPKHFHSA-N 0 3 409.530 4.443 20 0 HIADHN CC1CCN([C@@H](CNC(=O)Nc2nnc(C(F)(F)F)s2)c2cccs2)CC1 ZINC000503160972 912129818 /nfs/dbraw/zinc/12/98/18/912129818.db2.gz RGNLOHXGUUJOOT-NSHDSACASA-N 0 3 419.498 4.213 20 0 HIADHN Cc1ccn(C2CCN(C(=O)NC[C@H](c3ccc(CC(C)C)cc3)N(C)C)CC2)n1 ZINC000513340716 921725724 /nfs/dbraw/zinc/72/57/24/921725724.db2.gz MYJRNVSREKKHJU-HSZRJFAPSA-N 0 3 411.594 4.039 20 0 HIADHN OCC1CCN(Cc2ccccc2NCc2nc(-c3cccc(Cl)c3)no2)CC1 ZINC000503224958 912206515 /nfs/dbraw/zinc/20/65/15/912206515.db2.gz VYDHSYFNSDZUOO-UHFFFAOYSA-N 0 3 412.921 4.206 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CN1CCC[C@H](C(=O)Nc2ccccc2)C1 ZINC000506280211 914880938 /nfs/dbraw/zinc/88/09/38/914880938.db2.gz NIPQVKADEHMHOY-QFIPXVFZSA-N 0 3 402.542 4.399 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)Nc2cc3c(cc2Cl)OCCCO3)C1 ZINC000506294817 914889622 /nfs/dbraw/zinc/88/96/22/914889622.db2.gz LGMAWZBROYFDEE-NVXWUHKLSA-N 0 3 415.921 4.458 20 0 HIADHN CC(=O)Nc1ccc(Cl)c(NC(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)c1 ZINC000506296302 914891342 /nfs/dbraw/zinc/89/13/42/914891342.db2.gz XZNVYPPWPOBNQA-RDTXWAMCSA-N 0 3 400.910 4.255 20 0 HIADHN FC(F)(F)c1ccc(CN2CCCN(Cc3ccc(N4CCCC4)nc3)CC2)cc1 ZINC000506297051 914891691 /nfs/dbraw/zinc/89/16/91/914891691.db2.gz GOYPXZAUEKBFJN-UHFFFAOYSA-N 0 3 418.507 4.409 20 0 HIADHN Cc1cc(C)n(-c2cccc(NC(=O)N[C@H]3CCN([C@@H](C)c4ccccc4)C3)c2)n1 ZINC000506296606 914891706 /nfs/dbraw/zinc/89/17/06/914891706.db2.gz BCONPMPWZCPMSI-UGKGYDQZSA-N 0 3 403.530 4.446 20 0 HIADHN C[C@H](c1ccccc1Cl)N1CCN(C(=O)c2cccc(CN3CCCC3)c2)CC1 ZINC000513355524 921733855 /nfs/dbraw/zinc/73/38/55/921733855.db2.gz RZHCARHKDYOYCI-LJQANCHMSA-N 0 3 411.977 4.455 20 0 HIADHN CC(C)Cc1ccc([C@H](CNC(=O)N2CCCC3(CCOCC3)C2)N(C)C)cc1 ZINC000513357552 921735905 /nfs/dbraw/zinc/73/59/05/921735905.db2.gz NBGQMCXGLSCUNW-QFIPXVFZSA-N 0 3 401.595 4.090 20 0 HIADHN COc1cc(CN2CCC(CO)CC2)ccc1OCc1cccc(C(F)(F)F)c1 ZINC000506367507 914992074 /nfs/dbraw/zinc/99/20/74/914992074.db2.gz FBEJQNSHWGPEAA-UHFFFAOYSA-N 0 3 409.448 4.497 20 0 HIADHN COc1cc(OC)cc(Oc2ccc(CN3CCC(CC(=O)N(C)C)CC3)cc2)c1 ZINC000513368949 921741934 /nfs/dbraw/zinc/74/19/34/921741934.db2.gz BSIQAUCCGWEVHX-UHFFFAOYSA-N 0 3 412.530 4.186 20 0 HIADHN CC(C)Cc1ccc([C@H](CNC(=O)N(C)Cc2cnc(C(C)C)nc2)N(C)C)cc1 ZINC000513370304 921743951 /nfs/dbraw/zinc/74/39/51/921743951.db2.gz HDCXQEZWQBEHEF-QFIPXVFZSA-N 0 3 411.594 4.243 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)CCN[C@H](Cc1ccccn1)c1cccnc1 ZINC000513373800 921747357 /nfs/dbraw/zinc/74/73/57/921747357.db2.gz YFTOQTQYZDOBMH-LJQANCHMSA-N 0 3 410.905 4.041 20 0 HIADHN CCc1c(C(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)cnn1Cc1ccccc1 ZINC000513375358 921749742 /nfs/dbraw/zinc/74/97/42/921749742.db2.gz BJBPIBSBCJRDMD-DENIHFKCSA-N 0 3 402.542 4.059 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)NCCOc2ccccc2Cl)CC1 ZINC000506582278 915234517 /nfs/dbraw/zinc/23/45/17/915234517.db2.gz WAXXNSJJBMORHE-UHFFFAOYSA-N 0 3 401.938 4.025 20 0 HIADHN Cc1cnc(CCN(C)C(=O)NC[C@H](c2ccc(CC(C)C)cc2)N(C)C)s1 ZINC000513385021 921757241 /nfs/dbraw/zinc/75/72/41/921757241.db2.gz SGSSYDFPTZTNRE-HXUWFJFHSA-N 0 3 402.608 4.137 20 0 HIADHN COc1ccc([C@@H]2CCCN2Cc2ccc(OCc3noc(C)n3)cc2)cc1OC ZINC000506631463 915298693 /nfs/dbraw/zinc/29/86/93/915298693.db2.gz JJJUDQITWMTVIE-FQEVSTJZSA-N 0 3 409.486 4.311 20 0 HIADHN CCCNC(=O)C1CCN(Cc2cn(C(C)(C)C)nc2-c2cccc(OC)c2)CC1 ZINC000506649209 915319209 /nfs/dbraw/zinc/31/92/09/915319209.db2.gz RLDAGHGJGBZINY-UHFFFAOYSA-N 0 3 412.578 4.052 20 0 HIADHN COc1cc(CN2CCC(c3nnc4ccccn43)CC2)ccc1OCC(F)(F)F ZINC000506712023 915389849 /nfs/dbraw/zinc/38/98/49/915389849.db2.gz XASIAJUESIXEGH-UHFFFAOYSA-N 0 3 420.435 4.059 20 0 HIADHN CN(C)Cc1cccc(NC(=O)c2ccccc2OCC(=O)Nc2ccccc2F)c1 ZINC000506773080 915486100 /nfs/dbraw/zinc/48/61/00/915486100.db2.gz DHRMWUCRRATUMS-UHFFFAOYSA-N 0 3 421.472 4.157 20 0 HIADHN COc1ccc([C@H](C)NC(=O)N[C@H]2CCN(Cc3ccccc3)[C@@H]2C)c(C)c1OC ZINC000513418667 921786921 /nfs/dbraw/zinc/78/69/21/921786921.db2.gz CAGOAASCOSWMEX-UEXGIBASSA-N 0 3 411.546 4.035 20 0 HIADHN CC(C)OCCCNC(=O)C1CCN(Cc2ccc(-c3ccncc3)cc2F)CC1 ZINC000506872534 915661785 /nfs/dbraw/zinc/66/17/85/915661785.db2.gz CGANDTISGRFXEE-UHFFFAOYSA-N 0 3 413.537 4.031 20 0 HIADHN O=C1C[C@H](c2ccccc2)N(CCOC(c2ccccc2)c2ccccc2)CCN1 ZINC000506916457 915716942 /nfs/dbraw/zinc/71/69/42/915716942.db2.gz JALSIFBIZNYPNG-XMMPIXPASA-N 0 3 400.522 4.356 20 0 HIADHN CC(C)(C)[C@H](NCC(=O)Nc1ccnn1Cc1cccs1)c1ccc(F)cc1 ZINC000507007126 915817798 /nfs/dbraw/zinc/81/77/98/915817798.db2.gz MADUMAKPRPNZOL-HXUWFJFHSA-N 0 3 400.523 4.448 20 0 HIADHN CCCn1nccc1C1CCN(C(=O)NC[C@H](c2cccs2)N2CCCC2)CC1 ZINC000507075282 915854896 /nfs/dbraw/zinc/85/48/96/915854896.db2.gz VVELVRVCYRGPBW-HXUWFJFHSA-N 0 3 415.607 4.081 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)N1CCC(N2CCc3ccccc32)CC1 ZINC000507074408 915855233 /nfs/dbraw/zinc/85/52/33/915855233.db2.gz ZWRRYLXJTMYSBK-RUZDIDTESA-N 0 3 418.585 4.060 20 0 HIADHN COc1ccc([C@@H](C)NC(=O)N(CCN(C)C)Cc2cccc(C)c2)c(C)c1OC ZINC000513433336 921802388 /nfs/dbraw/zinc/80/23/88/921802388.db2.gz XPQWIYZHNCEAEC-LJQANCHMSA-N 0 3 413.562 4.155 20 0 HIADHN CCCn1nccc1C1CCN(C(=O)NC[C@@H](c2ccsc2)N(CC)CC)CC1 ZINC000507098522 915868461 /nfs/dbraw/zinc/86/84/61/915868461.db2.gz WYSXQLDYIUZMRE-NRFANRHFSA-N 0 3 417.623 4.327 20 0 HIADHN Cc1c(C(=O)N2CCCN(CCCc3ccccc3)CC2)cnn1-c1cccc(C)c1 ZINC000507129973 915881995 /nfs/dbraw/zinc/88/19/95/915881995.db2.gz ZUTGBUOEEABKKZ-UHFFFAOYSA-N 0 3 416.569 4.270 20 0 HIADHN Cc1ccccc1[C@H]1CCN(CC(=O)N2CCC[C@H]2c2ccc3c(c2)OCCCO3)C1 ZINC000507184823 915932612 /nfs/dbraw/zinc/93/26/12/915932612.db2.gz XCORRBQPAVOSKA-GMAHTHKFSA-N 0 3 420.553 4.309 20 0 HIADHN CCc1nnc(NC(=O)[C@H](C)[C@@H](C)N[C@H](C)c2ccccc2Br)s1 ZINC000507206810 915956017 /nfs/dbraw/zinc/95/60/17/915956017.db2.gz ANPYSEQQVIRRRK-IJLUTSLNSA-N 0 3 411.369 4.177 20 0 HIADHN O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)c1cc(Cl)c(F)cc1Cl ZINC000507221091 915974567 /nfs/dbraw/zinc/97/45/67/915974567.db2.gz FDTDIJFIZQTQGO-OAHLLOKOSA-N 0 3 411.304 4.153 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1NC(=O)CCN(C)C[C@@H]1OCCc2ccccc21 ZINC000507260169 916021353 /nfs/dbraw/zinc/02/13/53/916021353.db2.gz RUNRYCILNFVNNT-QHCPKHFHSA-N 0 3 418.541 4.064 20 0 HIADHN Cc1cc(C(=O)N2CCC(CN3C[C@H](C)O[C@@H](C)C3)CC2)c(C)cc1Br ZINC000507291211 916058744 /nfs/dbraw/zinc/05/87/44/916058744.db2.gz VRTMSVNKSDAWMR-IRXDYDNUSA-N 0 3 423.395 4.027 20 0 HIADHN CCCCS(=O)(=O)Nc1ccc(NC2CCN(CCC(F)(F)F)CC2)cc1 ZINC000507398832 916162848 /nfs/dbraw/zinc/16/28/48/916162848.db2.gz IFEKQLPXUGOLOJ-UHFFFAOYSA-N 0 3 407.502 4.057 20 0 HIADHN O=C(Nc1ccccc1)[C@@H](NC1CCN(CCC(F)(F)F)CC1)c1ccccc1 ZINC000507487617 916255505 /nfs/dbraw/zinc/25/55/05/916255505.db2.gz RPHJEMUBNINFTJ-FQEVSTJZSA-N 0 3 405.464 4.373 20 0 HIADHN O=C(c1cn2c(n1)CCCC2)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000507546987 916304532 /nfs/dbraw/zinc/30/45/32/916304532.db2.gz DJNUSFXFOFAWCM-UHFFFAOYSA-N 0 3 421.372 4.264 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)COc2ccc(Oc3ccccn3)cc2)C1 ZINC000507613877 916372031 /nfs/dbraw/zinc/37/20/31/916372031.db2.gz ACKMOYHAFQWKFC-PZJWPPBQSA-N 0 3 417.509 4.204 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)COC3CCC(C)CC3)c(OCC)c2)CC1 ZINC000507615274 916373120 /nfs/dbraw/zinc/37/31/20/916373120.db2.gz ACBNIYYQIYMRKB-UHFFFAOYSA-N 0 3 417.594 4.151 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3cc4[nH]ccc4s3)c(OCC)c2)CC1 ZINC000507624100 916382926 /nfs/dbraw/zinc/38/29/26/916382926.db2.gz YJNBUEIEJYFXQJ-UHFFFAOYSA-N 0 3 412.559 4.412 20 0 HIADHN CC[C@H]1C[C@@H](C[N@H+](C)Cc2cccc([N-]S(=O)(=O)c3ccccc3)c2)CCO1 ZINC000507776618 916560842 /nfs/dbraw/zinc/56/08/42/916560842.db2.gz OCWCWTXLDXUVPG-FPOVZHCZSA-N 0 3 402.560 4.124 20 0 HIADHN CC[C@H]1C[C@@H](C[N@@H+](C)Cc2cccc([N-]S(=O)(=O)c3ccccc3)c2)CCO1 ZINC000507776618 916560856 /nfs/dbraw/zinc/56/08/56/916560856.db2.gz OCWCWTXLDXUVPG-FPOVZHCZSA-N 0 3 402.560 4.124 20 0 HIADHN CN1C(=O)C[C@H](NCc2ccc(OCc3ccccn3)cc2)[C@@H]1c1ccc(Cl)cc1 ZINC000507834907 916642035 /nfs/dbraw/zinc/64/20/35/916642035.db2.gz VEAVPNCGETYILX-UPVQGACJSA-N 0 3 421.928 4.376 20 0 HIADHN c1ncn(Cc2ccc(-c3ccccc3CNCc3ccc(N4CCCC4)nc3)cc2)n1 ZINC000507846581 916660076 /nfs/dbraw/zinc/66/00/76/916660076.db2.gz UQQYSJCACDVAGW-UHFFFAOYSA-N 0 3 424.552 4.278 20 0 HIADHN COc1cc(CN[C@@H]2CC(=O)N(C)[C@@H]2c2ccc(Cl)cc2)cc(Cl)c1OC ZINC000507848151 916668702 /nfs/dbraw/zinc/66/87/02/916668702.db2.gz SANMRTMRCUFYDL-VQIMIIECSA-N 0 3 409.313 4.072 20 0 HIADHN CCN1CCN(c2ccccc2CN[C@@H]2CCCc3cn(C4CCCC4)nc32)CC1 ZINC000507913903 916791914 /nfs/dbraw/zinc/79/19/14/916791914.db2.gz VBJHKCRVJQFUKG-HSZRJFAPSA-N 0 3 407.606 4.307 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CN1CCC[C@H](C(=O)Nc2cccc(C)n2)C1 ZINC000507987043 916829721 /nfs/dbraw/zinc/82/97/21/916829721.db2.gz ROPOCDFVKJNQGU-FQEVSTJZSA-N 0 3 403.530 4.043 20 0 HIADHN Cc1cccc(NC(=O)[C@@H]2CCCN(Cc3ccccc3OCC(F)(F)F)C2)n1 ZINC000508002091 916842759 /nfs/dbraw/zinc/84/27/59/916842759.db2.gz XWLNDPIVCXUXRV-QGZVFWFLSA-N 0 3 407.436 4.182 20 0 HIADHN Cc1cccc(NC(=O)[C@@H]2CCCN(Cc3c[nH]nc3-c3ccc(Cl)cc3)C2)n1 ZINC000508001309 916842947 /nfs/dbraw/zinc/84/29/47/916842947.db2.gz WFQQBWMBTCPLGF-QGZVFWFLSA-N 0 3 409.921 4.284 20 0 HIADHN Cc1ccc(NC(=O)[C@H]2CCCN(Cc3ccc(OCC(F)(F)F)cc3)C2)nc1 ZINC000508014733 916851738 /nfs/dbraw/zinc/85/17/38/916851738.db2.gz KXARAXPTANQTGA-KRWDZBQOSA-N 0 3 407.436 4.182 20 0 HIADHN Cc1cccc(NC(=O)[C@@H]2CCCN(Cc3ccccc3OCc3cccnc3)C2)n1 ZINC000508021075 916857644 /nfs/dbraw/zinc/85/76/44/916857644.db2.gz KXZPDSNKEXHLJC-JOCHJYFZSA-N 0 3 416.525 4.215 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1cc(F)cc(Br)c1 ZINC000508073500 916895232 /nfs/dbraw/zinc/89/52/32/916895232.db2.gz WXBMPNODVIFVJV-UHFFFAOYSA-N 0 3 421.310 4.045 20 0 HIADHN COCc1c(Br)cccc1NC(=O)N1CCN(CC2CCCCC2)CC1 ZINC000508179445 916999794 /nfs/dbraw/zinc/99/97/94/916999794.db2.gz HFGNYRGSHMVRIK-UHFFFAOYSA-N 0 3 424.383 4.325 20 0 HIADHN COCc1c(Br)cccc1NC(=O)NC[C@@H](c1ccc(C)cc1)N(C)C ZINC000508183259 917004001 /nfs/dbraw/zinc/00/40/01/917004001.db2.gz OZZOSADAPDISTC-IBGZPJMESA-N 0 3 420.351 4.328 20 0 HIADHN Cc1ccc2[nH]c([C@H]3CCCN(C(=O)[C@@H]4CCCN4Cc4ccccc4)C3)nc2c1 ZINC000508245660 917062658 /nfs/dbraw/zinc/06/26/58/917062658.db2.gz DNCSQWCTWBXCBX-REWPJTCUSA-N 0 3 402.542 4.242 20 0 HIADHN Cc1ccc2nc([C@H]3CCCN(C(=O)[C@@H]4CCCN4Cc4ccccc4)C3)[nH]c2c1 ZINC000508245660 917062670 /nfs/dbraw/zinc/06/26/70/917062670.db2.gz DNCSQWCTWBXCBX-REWPJTCUSA-N 0 3 402.542 4.242 20 0 HIADHN CCC(CC)(C(=O)NCCN1CCN(C)C(C)(C)C1)c1ccc(Cl)c(Cl)c1 ZINC000508314861 917121124 /nfs/dbraw/zinc/12/11/24/917121124.db2.gz HBQKHSSUVCYOGH-UHFFFAOYSA-N 0 3 414.421 4.193 20 0 HIADHN C[C@H](Oc1cccc(Cl)c1)c1nnc(N2CCN(C3CCCCC3)CC2)n1C ZINC000508429466 917217455 /nfs/dbraw/zinc/21/74/55/917217455.db2.gz URHRIKGTEQPUSY-INIZCTEOSA-N 0 3 403.958 4.063 20 0 HIADHN COCCSc1ccc([C@@H](C)NC(=O)NC[C@@H](c2ccccc2)N(C)C)cc1 ZINC000508547081 917325452 /nfs/dbraw/zinc/32/54/52/917325452.db2.gz AFROPYRXGNBXLT-UTKZUKDTSA-N 0 3 401.576 4.088 20 0 HIADHN Cc1nc(COc2ccc(CN(Cc3ccc(C(N)=O)cc3)C3CC3)cc2)cs1 ZINC000508625427 917390668 /nfs/dbraw/zinc/39/06/68/917390668.db2.gz MAFRWOJNZWRLJD-UHFFFAOYSA-N 0 3 407.539 4.294 20 0 HIADHN Clc1cccc([C@H](Cc2cccnc2)NCc2ccccc2Cn2cncn2)c1 ZINC000508735657 917495273 /nfs/dbraw/zinc/49/52/73/917495273.db2.gz XATJRNLCZVXCBC-QHCPKHFHSA-N 0 3 403.917 4.448 20 0 HIADHN Cc1c([C@H](C)NCc2ccccc2Cn2cncn2)cnn1-c1cc(C)ccc1C ZINC000508748361 917506851 /nfs/dbraw/zinc/50/68/51/917506851.db2.gz RECCBTDMIFWYFN-IBGZPJMESA-N 0 3 400.530 4.288 20 0 HIADHN O=C(Nc1ccc(-c2nnco2)cc1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000508814871 917568969 /nfs/dbraw/zinc/56/89/69/917568969.db2.gz YFHRAZKEPHLCBM-HXUWFJFHSA-N 0 3 416.403 4.130 20 0 HIADHN COc1cccc(C2(F)CCN(C(=O)N[C@@H](C)[C@@H](c3ccccc3)N(C)C)CC2)c1 ZINC000508842550 917594721 /nfs/dbraw/zinc/59/47/21/917594721.db2.gz BZBGKFQFTNOSJM-AVRDEDQJSA-N 0 3 413.537 4.357 20 0 HIADHN C[C@H](NC(=O)N(Cc1ccc(F)cc1)C1CCOCC1)[C@H](c1ccccc1)N(C)C ZINC000508852264 917606235 /nfs/dbraw/zinc/60/62/35/917606235.db2.gz JWMUPDYCQHOOFR-FDDCHVKYSA-N 0 3 413.537 4.208 20 0 HIADHN C[C@@H](NC(=O)N1CCC(Oc2ccc(F)cc2F)CC1)[C@@H](c1ccccc1)N(C)C ZINC000508860116 917613688 /nfs/dbraw/zinc/61/36/88/917613688.db2.gz ZXEYEBXUEMWWKF-ZHRRBRCNSA-N 0 3 417.500 4.209 20 0 HIADHN C[C@@H](NC(=O)N(C)Cc1cc(Br)cs1)[C@@H](c1ccccc1)N(C)C ZINC000508875258 917628369 /nfs/dbraw/zinc/62/83/69/917628369.db2.gz BUVNMISVPXDXIL-DYVFJYSZSA-N 0 3 410.381 4.343 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1c2ccccc2CC[C@@H]1n1ccnc1)[C@H](c1ccccc1)N(C)C ZINC000508888159 917641527 /nfs/dbraw/zinc/64/15/27/917641527.db2.gz CAQSSTHBQQEUMC-PVERMEFCSA-N 0 3 417.557 4.102 20 0 HIADHN CCN1CCN(Cc2ccc(CNC(=O)c3ccccc3SC(C)C)cc2)CC1 ZINC000508894445 917649675 /nfs/dbraw/zinc/64/96/75/917649675.db2.gz USWWOLTUPLAMAZ-UHFFFAOYSA-N 0 3 411.615 4.255 20 0 HIADHN C[C@H](NC(=O)Nc1ccccc1I)[C@@H](c1ccccc1)N(C)C ZINC000508898206 917654479 /nfs/dbraw/zinc/65/44/79/917654479.db2.gz KZOIUAJOAFIKGM-GUYCJALGSA-N 0 3 423.298 4.104 20 0 HIADHN C[C@H](NC(=O)N1CCO[C@@H](c2ccccc2Cl)C1)[C@@H](c1ccccc1)N(C)C ZINC000508907749 917663568 /nfs/dbraw/zinc/66/35/68/917663568.db2.gz QWXBSPNDDBMGFX-DQLDELGASA-N 0 3 401.938 4.114 20 0 HIADHN Cc1nc2sccn2c(=O)c1CCN(Cc1csc(Br)c1)C1CC1 ZINC000508976860 917730514 /nfs/dbraw/zinc/73/05/14/917730514.db2.gz KIAVIIXZQVYZDF-UHFFFAOYSA-N 0 3 424.389 4.096 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1nn(-c2ccc(F)cc2)cc1C)c1cccc(OC)c1 ZINC000509122637 917856681 /nfs/dbraw/zinc/85/66/81/917856681.db2.gz KIKWHPKFBMMBNE-QFIPXVFZSA-N 0 3 424.520 4.141 20 0 HIADHN CCN1CCN(CCNC(=O)c2ccc(Oc3ccc(Cl)cc3Cl)cc2)CC1 ZINC000509138722 917865317 /nfs/dbraw/zinc/86/53/17/917865317.db2.gz NSWHOWNZPNQMDV-UHFFFAOYSA-N 0 3 422.356 4.153 20 0 HIADHN CC(C)(C)c1cnc(CCC(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)o1 ZINC000509185734 917895052 /nfs/dbraw/zinc/89/50/52/917895052.db2.gz LCQWEVUBOXYYTJ-LJQANCHMSA-N 0 3 421.545 4.187 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)c1coc(C2CCCC2)n1 ZINC000509187752 917895207 /nfs/dbraw/zinc/89/52/07/917895207.db2.gz PZLJBRKHQNNQSE-LJQANCHMSA-N 0 3 405.502 4.228 20 0 HIADHN Cc1nc2sccn2c(=O)c1CCN1CCC[C@H]1c1cccc(Br)c1 ZINC000509277390 917962528 /nfs/dbraw/zinc/96/25/28/917962528.db2.gz BGRFSSOBPTWGGC-KRWDZBQOSA-N 0 3 418.360 4.207 20 0 HIADHN O=C(NCc1cnc2ccccc2c1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000509353463 918017644 /nfs/dbraw/zinc/01/76/44/918017644.db2.gz KDINKHKONHZQQA-JOCHJYFZSA-N 0 3 413.443 4.306 20 0 HIADHN CCOCc1cc(CN2CCC[C@H](C(=O)Nc3ccc(Cl)cn3)C2)ccc1OC ZINC000509358666 918025166 /nfs/dbraw/zinc/02/51/66/918025166.db2.gz PCDICCQDIKIVRQ-KRWDZBQOSA-N 0 3 417.937 4.131 20 0 HIADHN COc1ccccc1SC[C@@H](C)CNC(=O)NC[C@H](c1ccccc1)N(C)C ZINC000509360376 918027164 /nfs/dbraw/zinc/02/71/64/918027164.db2.gz VZWCHUVDPSNGTI-PKOBYXMFSA-N 0 3 401.576 4.026 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CN1CCC[C@@H](C(=O)Nc2ccc(Cl)cn2)C1 ZINC000509369268 918033263 /nfs/dbraw/zinc/03/32/63/918033263.db2.gz CAXWIFRRBYHAGO-GOSISDBHSA-N 0 3 423.948 4.388 20 0 HIADHN CC(C)(C)n1cc(CN[C@H]2CC(=O)N3CCCC[C@H]23)c(-c2ccccc2Cl)n1 ZINC000509422226 918082423 /nfs/dbraw/zinc/08/24/23/918082423.db2.gz BIGHWSZPGZHHFC-RBUKOAKNSA-N 0 3 400.954 4.202 20 0 HIADHN Cn1cc(-c2ccc(CN[C@H](Cc3ccccc3)C(=O)Nc3ccccc3)s2)cn1 ZINC000509464772 918114918 /nfs/dbraw/zinc/11/49/18/918114918.db2.gz PERAPAPPVLCJCM-JOCHJYFZSA-N 0 3 416.550 4.488 20 0 HIADHN O=C(NCc1ccccc1)[C@H](NC[C@H]1CCO[C@@H]1c1ccccc1)c1ccccc1 ZINC000509509761 918156680 /nfs/dbraw/zinc/15/66/80/918156680.db2.gz HZSWBTWACOBCTJ-UBFVSLLYSA-N 0 3 400.522 4.412 20 0 HIADHN COc1cc(CNCc2ccc(-c3cnn(C)c3)s2)ccc1OCC(F)(F)F ZINC000509529857 918177508 /nfs/dbraw/zinc/17/75/08/918177508.db2.gz VVVORJNOCZFKOA-UHFFFAOYSA-N 0 3 411.449 4.388 20 0 HIADHN COc1ccc(CN2CCC(C(=O)N3CCC[C@H](C)C3)CC2)cc1OCC(C)C ZINC000509533017 918181095 /nfs/dbraw/zinc/18/10/95/918181095.db2.gz OLJOCABNIOSZRA-IBGZPJMESA-N 0 3 402.579 4.201 20 0 HIADHN CC(C)c1nn(-c2ccccc2)cc1CN1CCC(C(=O)N2CCC[C@@H](C)C2)CC1 ZINC000509532976 918181464 /nfs/dbraw/zinc/18/14/64/918181464.db2.gz NUFHOYQKWIAJMW-HXUWFJFHSA-N 0 3 408.590 4.466 20 0 HIADHN CC(C)Cc1cccc([C@H](C)C(=O)Nc2ccccc2CN2CCC[C@@H](C(N)=O)C2)c1 ZINC000509563441 918213301 /nfs/dbraw/zinc/21/33/01/918213301.db2.gz GQPIULACWCSWBN-WMZHIEFXSA-N 0 3 421.585 4.325 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)N1CCCc2c([nH]c3c2cccc3F)C1)c1ccco1 ZINC000509567283 918217357 /nfs/dbraw/zinc/21/73/57/918217357.db2.gz IOGBNQZCHOTVKA-BEFAXECRSA-N 0 3 412.509 4.487 20 0 HIADHN COc1ccccc1NC(=O)C1CCN(Cc2ccc(OCC(F)F)cc2)CC1 ZINC000509574919 918224742 /nfs/dbraw/zinc/22/47/42/918224742.db2.gz KXPPGGCFBBQGIB-UHFFFAOYSA-N 0 3 404.457 4.190 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N1CCC(Nc2cccc(OC)c2)CC1)c1ccco1 ZINC000509575075 918225344 /nfs/dbraw/zinc/22/53/44/918225344.db2.gz VDHRMKYTZAUGMM-UWJYYQICSA-N 0 3 414.550 4.004 20 0 HIADHN COc1ccc(CN2CCC(C(=O)N(C)C(C)C)CC2)cc1OCc1ccccc1 ZINC000509578307 918228641 /nfs/dbraw/zinc/22/86/41/918228641.db2.gz HEZDSVBCGWSTIQ-UHFFFAOYSA-N 0 3 410.558 4.353 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N(Cc1cccc(F)c1)C[C@@H]1CCCO1)c1ccco1 ZINC000509589139 918239297 /nfs/dbraw/zinc/23/92/97/918239297.db2.gz YNEXYZGQDBEYJZ-DZFGPLHGSA-N 0 3 417.525 4.239 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N1C[C@@H](c2ccc(F)cc2)O[C@@H](C)C1)c1ccco1 ZINC000509594016 918242611 /nfs/dbraw/zinc/24/26/11/918242611.db2.gz YZCSRIOTRXZVOL-DGCVBNHASA-N 0 3 403.498 4.020 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N1CC[C@@H](Oc2ccccc2Cl)C1)c1ccco1 ZINC000509611981 918258346 /nfs/dbraw/zinc/25/83/46/918258346.db2.gz VZWPDGBIPAQVGH-LZLYRXPVSA-N 0 3 405.926 4.225 20 0 HIADHN Cn1c2ccc(CNCc3cn(-c4ccccc4)nc3-c3ccccc3)cc2oc1=O ZINC000509663783 918296422 /nfs/dbraw/zinc/29/64/22/918296422.db2.gz DSIGUCMHINLSLX-UHFFFAOYSA-N 0 3 410.477 4.274 20 0 HIADHN C[C@H](NC(=O)c1oc2ccccc2c1CN(C)C)c1ccc(NC(=O)C2CC2)cc1 ZINC000509675607 918306512 /nfs/dbraw/zinc/30/65/12/918306512.db2.gz NUURYKBJUCHLBZ-HNNXBMFYSA-N 0 3 405.498 4.334 20 0 HIADHN O=C(N[C@H](C[C@@H]1CCOC1)c1ccccc1)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000509782697 918392176 /nfs/dbraw/zinc/39/21/76/918392176.db2.gz UTHFOPIAZVXGMC-QPTUXGOLSA-N 0 3 407.558 4.118 20 0 HIADHN O=S(=O)([N-]C1CC[NH+](C2CCCC2)CC1)c1cc(Cl)ccc1C(F)(F)F ZINC000509869636 918470878 /nfs/dbraw/zinc/47/08/78/918470878.db2.gz ZCENSWRPINYKEV-UHFFFAOYSA-N 0 3 410.889 4.044 20 0 HIADHN CCOc1cccc(CN[C@H]2CCCN(C(=O)Cc3ccccc3)C2)c1OC(F)F ZINC000509945129 918541486 /nfs/dbraw/zinc/54/14/86/918541486.db2.gz RRSLSCKYSUHSAP-IBGZPJMESA-N 0 3 418.484 4.010 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)c1ccc(-c2ccccc2)[nH]c1=O ZINC000509980812 918569056 /nfs/dbraw/zinc/56/90/56/918569056.db2.gz CLKLSFOEQOTYDM-UHFFFAOYSA-N 0 3 403.526 4.091 20 0 HIADHN O=C(Nc1ccccc1)N1CC[C@@H](NCc2ccccc2OCc2ccncc2)C1 ZINC000510004935 918587489 /nfs/dbraw/zinc/58/74/89/918587489.db2.gz LCJKEUNEVLCPLI-JOCHJYFZSA-N 0 3 402.498 4.057 20 0 HIADHN CN(c1ccccc1)c1ccc(CN[C@@H]2CCN(C(=O)Nc3ccccc3)C2)cn1 ZINC000510022995 918599376 /nfs/dbraw/zinc/59/93/76/918599376.db2.gz IDBHXMIBVZVAAX-OAQYLSRUSA-N 0 3 401.514 4.246 20 0 HIADHN O=C(Nc1nnc(-c2ccccc2)s1)N1CCCN(CCCc2ccccc2)CC1 ZINC000510042716 918613398 /nfs/dbraw/zinc/61/33/98/918613398.db2.gz RIFDSRQDDQFAOR-UHFFFAOYSA-N 0 3 421.570 4.378 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cnn(C4CCCCC4)c3C)c(C)c2)CC1 ZINC000510153091 918706851 /nfs/dbraw/zinc/70/68/51/918706851.db2.gz SBVPWPYOHJDCNM-UHFFFAOYSA-N 0 3 409.578 4.399 20 0 HIADHN O=C(Nc1ccc(C(=O)NC2CCCC2)cc1)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000510165289 918716488 /nfs/dbraw/zinc/71/64/88/918716488.db2.gz CWVWPRRNJHYXCM-HSZRJFAPSA-N 0 3 420.557 4.145 20 0 HIADHN COc1cc(CN(C)C[C@@H](O)COc2ccc(C(F)(F)F)cc2)ccc1SC ZINC000510194833 918745076 /nfs/dbraw/zinc/74/50/76/918745076.db2.gz WFHVPQPVZPFHIB-MRXNPFEDSA-N 0 3 415.477 4.308 20 0 HIADHN CN(Cc1c[nH]nc1-c1ccc(F)cc1)C[C@@H](O)COc1ccc(C(F)(F)F)cc1 ZINC000510206218 918755590 /nfs/dbraw/zinc/75/55/90/918755590.db2.gz AHNLPBPWWRMLQI-GOSISDBHSA-N 0 3 423.410 4.106 20 0 HIADHN CCCN(Cc1nnc(-c2ccccc2)o1)C1CCN(c2cc(C)nc(C)n2)CC1 ZINC000510244710 918782091 /nfs/dbraw/zinc/78/20/91/918782091.db2.gz QMRNXJWWPACUHD-UHFFFAOYSA-N 0 3 406.534 4.024 20 0 HIADHN CCCN(CC(=O)Nc1ccccc1Cl)C1CCN(c2cc(C)nc(C)n2)CC1 ZINC000510247774 918784492 /nfs/dbraw/zinc/78/44/92/918784492.db2.gz AIVSDSLZIRLXSO-UHFFFAOYSA-N 0 3 415.969 4.066 20 0 HIADHN COC(=O)c1cc2c(o1)c(OC)ccc2CN1CCC(OCCc2ccccc2)CC1 ZINC000510354481 918848953 /nfs/dbraw/zinc/84/89/53/918848953.db2.gz LEHQOCSDHVJITF-UHFFFAOYSA-N 0 3 423.509 4.452 20 0 HIADHN O[C@@H](COc1cc(Cl)ccc1Cl)CN1CC[C@@H](n2ncc3ccccc32)C1 ZINC000510403959 918877428 /nfs/dbraw/zinc/87/74/28/918877428.db2.gz XXBVFEMTUJPLMA-IAGOWNOFSA-N 0 3 406.313 4.030 20 0 HIADHN C[C@@H](NC(=O)NC[C@H](c1c[nH]c2ccccc21)c1ccccc1)C1=CCN(C)CC1 ZINC000510499163 918947012 /nfs/dbraw/zinc/94/70/12/918947012.db2.gz FIZSMRFKEXVGNK-GCJKJVERSA-N 0 3 402.542 4.249 20 0 HIADHN Cc1ccc(NC(=O)N[C@H]2CCN(Cc3ccccc3)C2)c(OCC(F)(F)F)c1 ZINC000510536691 918982060 /nfs/dbraw/zinc/98/20/60/918982060.db2.gz YUZFOFYDBFNZMC-KRWDZBQOSA-N 0 3 407.436 4.332 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)N[C@H](c2nccs2)c2ccccc2)CC1 ZINC000510577358 919019529 /nfs/dbraw/zinc/01/95/29/919019529.db2.gz HEQWHTBWSUVSBH-FQEVSTJZSA-N 0 3 410.543 4.132 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)N[C@H](c1nccs1)c1ccccc1 ZINC000510604240 919046253 /nfs/dbraw/zinc/04/62/53/919046253.db2.gz WDJSVXLSPNXYFJ-FQEVSTJZSA-N 0 3 412.534 4.145 20 0 HIADHN Cc1csc([C@H](C)NC2CCC(NC(=O)COc3ccc(Cl)cc3)CC2)n1 ZINC000510631494 919073499 /nfs/dbraw/zinc/07/34/99/919073499.db2.gz FWWZPJHUPCTCNY-OOHWJJMZSA-N 0 3 407.967 4.262 20 0 HIADHN CSc1ccccc1NC(=O)CN(C)C(=O)CN[C@H](C)c1cccc2ccccc21 ZINC000510633169 919074560 /nfs/dbraw/zinc/07/45/60/919074560.db2.gz JRKKLEAQCGFUJE-QGZVFWFLSA-N 0 3 421.566 4.309 20 0 HIADHN CN(C)Cc1cccc(NC(=O)N2CCC[C@H](c3nc(-c4ccc(F)cc4)no3)C2)c1 ZINC000510639590 919080584 /nfs/dbraw/zinc/08/05/84/919080584.db2.gz WVTIOMDTGOILTH-SFHVURJKSA-N 0 3 423.492 4.349 20 0 HIADHN CCOC(=O)c1cnn(C2CCN([C@H](C)c3ccc(OC(F)F)cc3)CC2)c1C ZINC000510642019 919082886 /nfs/dbraw/zinc/08/28/86/919082886.db2.gz XPNYDYDSLPJIRC-CQSZACIVSA-N 0 3 407.461 4.368 20 0 HIADHN CC(C)CNC(=O)c1ccc(NC(=O)N[C@@H](CN2CCCC2)c2ccccc2)cc1 ZINC000510652919 919093378 /nfs/dbraw/zinc/09/33/78/919093378.db2.gz QGYGYKYRJQWLKI-QFIPXVFZSA-N 0 3 408.546 4.031 20 0 HIADHN COc1cc(CN2CCC[C@@H](c3ccnn3C)C2)cc(OC)c1OCc1ccccc1 ZINC000510656427 919097266 /nfs/dbraw/zinc/09/72/66/919097266.db2.gz FANFWTPYWBAHMR-OAQYLSRUSA-N 0 3 421.541 4.396 20 0 HIADHN CCCC(=O)Nc1cccc(NC(=O)NC[C@H](c2ccc(OC)cc2)N2CCCC2)c1 ZINC000510673405 919114066 /nfs/dbraw/zinc/11/40/66/919114066.db2.gz BKIGPSFVCNNXJP-JOCHJYFZSA-N 0 3 424.545 4.392 20 0 HIADHN CCCC(=O)Nc1cccc(NC(=O)NC[C@H](CC)N2CCc3ccccc3C2)c1 ZINC000510693802 919131554 /nfs/dbraw/zinc/13/15/54/919131554.db2.gz DMEZNARSPSULSS-QFIPXVFZSA-N 0 3 408.546 4.384 20 0 HIADHN Cc1ccc(OCc2cccc(C(=O)NC[C@@H](C)N(C)Cc3ccccc3)c2)cn1 ZINC000510711381 919151183 /nfs/dbraw/zinc/15/11/83/919151183.db2.gz AAOZSKIEFXNUEO-HXUWFJFHSA-N 0 3 403.526 4.219 20 0 HIADHN COc1ccc(-c2nc3c(s2)[C@H](NCc2cnn(CC(F)F)c2)CCC3)cc1 ZINC000510714045 919155534 /nfs/dbraw/zinc/15/55/34/919155534.db2.gz DUCOEPXAROWOAU-MRXNPFEDSA-N 0 3 404.486 4.448 20 0 HIADHN Cc1ccc(CN[C@@H]2CCc3ccc(Br)cc32)c(N2CCOCC2)c1 ZINC000510715890 919156850 /nfs/dbraw/zinc/15/68/50/919156850.db2.gz DNJSTRJXPGJHMM-HXUWFJFHSA-N 0 3 401.348 4.371 20 0 HIADHN Cc1ccc(CN[C@H]2CCc3ccc(Br)cc32)c(N2CCOCC2)c1 ZINC000510715887 919157096 /nfs/dbraw/zinc/15/70/96/919157096.db2.gz DNJSTRJXPGJHMM-FQEVSTJZSA-N 0 3 401.348 4.371 20 0 HIADHN CC(=O)CCc1ccc(OCc2cccc(C(=O)N[C@H](C)C3=CCN(C)CC3)c2)cc1 ZINC000510741720 919189047 /nfs/dbraw/zinc/18/90/47/919189047.db2.gz OZTKZMVYDQZPEW-HXUWFJFHSA-N 0 3 420.553 4.167 20 0 HIADHN CC(C)[C@H](NCc1ccc(C2CCCCC2)cc1)C(=O)N(C)Cc1nnc2n1CCC2 ZINC000510761861 919214062 /nfs/dbraw/zinc/21/40/62/919214062.db2.gz IQCVVFJSUXZGIR-DEOSSOPVSA-N 0 3 423.605 4.045 20 0 HIADHN CCOc1cc2c(cc1OCC)CN(C(=O)c1oc3ccccc3c1CN(C)C)CC2 ZINC000510781686 919243587 /nfs/dbraw/zinc/24/35/87/919243587.db2.gz OLAXLHBLLFLMII-UHFFFAOYSA-N 0 3 422.525 4.490 20 0 HIADHN C[C@@H](CC1CCCCC1)C(=O)N1CCC[C@H](CN2CCN(c3ccccn3)CC2)C1 ZINC000510783710 919245687 /nfs/dbraw/zinc/24/56/87/919245687.db2.gz STGKSCWNFZNIOV-JTHBVZDNSA-N 0 3 412.622 4.049 20 0 HIADHN C[C@H](NC(=O)Cc1csc(-c2ccc(Cl)cc2Cl)n1)C1=CCN(C)CC1 ZINC000510786793 919252248 /nfs/dbraw/zinc/25/22/48/919252248.db2.gz GSNWKBJCLFCZQH-LBPRGKRZSA-N 0 3 410.370 4.426 20 0 HIADHN C[C@H](C(=O)Nc1ccc(CC(=O)N2CCc3ccccc32)cc1)N1CCCCCC1 ZINC000510799302 919269127 /nfs/dbraw/zinc/26/91/27/919269127.db2.gz NQCFMPNPCDJQCV-LJQANCHMSA-N 0 3 405.542 4.021 20 0 HIADHN C[C@H](NC(=O)c1ccc(COc2ccc(Br)cc2)o1)C1=CCN(C)CC1 ZINC000510805681 919280349 /nfs/dbraw/zinc/28/03/49/919280349.db2.gz ZDZQJNTVNKLTCC-AWEZNQCLSA-N 0 3 419.319 4.001 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1ccc(-n2cccn2)c(F)c1)c1ccsc1 ZINC000510834972 919315717 /nfs/dbraw/zinc/31/57/17/919315717.db2.gz DBYUZPCTSBIBKT-IBGZPJMESA-N 0 3 401.511 4.278 20 0 HIADHN COc1ccc(C[C@H](NC(=O)[C@@H](C)N2CCCCCC2)c2ccccc2)cc1OC ZINC000510860704 919350984 /nfs/dbraw/zinc/35/09/84/919350984.db2.gz CCCKQHNJTQSXGH-KNQAVFIVSA-N 0 3 410.558 4.368 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@@H]1CCc2cc(F)c(OC)cc21)c1ccsc1 ZINC000510860587 919351272 /nfs/dbraw/zinc/35/12/72/919351272.db2.gz LPXUPLWWQNXFOQ-RTBURBONSA-N 0 3 405.539 4.265 20 0 HIADHN COc1ccc(C[C@H](C)C(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)cc1OC ZINC000510885899 919383062 /nfs/dbraw/zinc/38/30/62/919383062.db2.gz YKUKXUPTVGYTIY-SIKLNZKXSA-N 0 3 410.558 4.005 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)NCCc1nc(-c2ccc(Cl)cc2)no1 ZINC000510899385 919398255 /nfs/dbraw/zinc/39/82/55/919398255.db2.gz DVKHUSLTHSCJMP-UHFFFAOYSA-N 0 3 424.888 4.170 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)NCC(F)(F)c2ccc(Cl)cc2)CC1 ZINC000510917482 919431350 /nfs/dbraw/zinc/43/13/50/919431350.db2.gz ZCELSFLISLOJLD-UHFFFAOYSA-N 0 3 411.880 4.331 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)Nc1ccc(C(=O)NCC(F)(F)F)cc1 ZINC000510926654 919446758 /nfs/dbraw/zinc/44/67/58/919446758.db2.gz FEBSJSKJGCSRJE-UHFFFAOYSA-N 0 3 419.403 4.039 20 0 HIADHN CC[C@@H](N[C@@H]1CCc2cc(F)c(OC)cc21)c1ccccc1OCC(=O)N(C)C ZINC000510976817 919524862 /nfs/dbraw/zinc/52/48/62/919524862.db2.gz HGRGXHAUDBKZIO-WOJBJXKFSA-N 0 3 400.494 4.030 20 0 HIADHN COc1ccc(C[C@H](C)C(=O)N(CCN(C)C)Cc2cccc(Cl)c2)cc1OC ZINC000511018168 919585582 /nfs/dbraw/zinc/58/55/82/919585582.db2.gz SHDSDNOQCNKZJI-KRWDZBQOSA-N 0 3 418.965 4.126 20 0 HIADHN Cc1ccc(NC(=O)N2CCN(CCC(C)(C)C)CC2)c(OC[C@H]2CCCO2)c1 ZINC000511030099 919607416 /nfs/dbraw/zinc/60/74/16/919607416.db2.gz LUWWYIAGDSWNQD-LJQANCHMSA-N 0 3 403.567 4.139 20 0 HIADHN C[C@H](NCCOc1ccc(I)cc1)c1ccc(Cl)cn1 ZINC000511038816 919623320 /nfs/dbraw/zinc/62/33/20/919623320.db2.gz VVTUATABAPNNAH-NSHDSACASA-N 0 3 402.663 4.069 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)Nc2ccccc2N2C[C@@H](C)O[C@@H](C)C2)N(C)C)cc1 ZINC000511085103 919686772 /nfs/dbraw/zinc/68/67/72/919686772.db2.gz IWOBMHFRBVQNML-YDIMBITNSA-N 0 3 424.589 4.287 20 0 HIADHN O=c1c2ccccc2ncn1CCN1CCC[C@@H](c2cccc(C(F)(F)F)c2)C1 ZINC000511087689 919691095 /nfs/dbraw/zinc/69/10/95/919691095.db2.gz ADVXUIIHQACRNL-QGZVFWFLSA-N 0 3 401.432 4.295 20 0 HIADHN CC[C@@H](C)c1ccc([C@H](NC(=O)CCN2CCN(CC)CC2)c2cccs2)cc1 ZINC000511107858 919715536 /nfs/dbraw/zinc/71/55/36/919715536.db2.gz SROHKPWMRBKBNA-DVECYGJZSA-N 0 3 413.631 4.495 20 0 HIADHN CCOc1cc2c(cc1NC(=O)N(CCN(C)C)Cc1ccc(F)cc1)O[C@@H](C)C2 ZINC000511179204 919801773 /nfs/dbraw/zinc/80/17/73/919801773.db2.gz ZHTKEIVGPRWYQO-INIZCTEOSA-N 0 3 415.509 4.144 20 0 HIADHN CC(C)Sc1ccc(CN2CCC(OCCN3C[C@@H](C)O[C@H](C)C3)CC2)cc1 ZINC000511206053 919818035 /nfs/dbraw/zinc/81/80/35/919818035.db2.gz YCDGRAMHZNZNHO-WOJBJXKFSA-N 0 3 406.636 4.277 20 0 HIADHN C[C@@H](NC(=O)N[C@@H](C)c1ccc(OCc2ccc(F)cc2)cc1)C1=CCN(C)CC1 ZINC000511216496 919827818 /nfs/dbraw/zinc/82/78/18/919827818.db2.gz MFBMHBPYTSOWTN-ZWKOTPCHSA-N 0 3 411.521 4.415 20 0 HIADHN COc1ccc(CN(C(=O)N[C@H](C)C2=CCN(C)CC2)C2CCCCC2)cc1OC ZINC000511246738 919846979 /nfs/dbraw/zinc/84/69/79/919846979.db2.gz DVUBPASGJMXNHW-GOSISDBHSA-N 0 3 415.578 4.199 20 0 HIADHN C[C@@H](NC(=O)Nc1ccc(Cl)c(C(=O)NC2CCCCC2)c1)C1=CCN(C)CC1 ZINC000511254362 919857334 /nfs/dbraw/zinc/85/73/34/919857334.db2.gz QSBQTRQVHMOGQL-OAHLLOKOSA-N 0 3 418.969 4.174 20 0 HIADHN COc1ccccc1C[C@@H](C)N(Cc1ccccc1)C(=O)N[C@H](C)C1=CCN(C)CC1 ZINC000511287679 919883678 /nfs/dbraw/zinc/88/36/78/919883678.db2.gz OINQXXVPTWIVDC-NHCUHLMSSA-N 0 3 421.585 4.488 20 0 HIADHN COc1ccc([C@@H](NC(=O)N[C@H](C)C2=CCN(C)CC2)c2ccccc2Cl)cc1 ZINC000511304705 919897653 /nfs/dbraw/zinc/89/76/53/919897653.db2.gz FPERBQILRGRVDT-OPAMFIHVSA-N 0 3 413.949 4.388 20 0 HIADHN COc1ccccc1[C@@H](NC(=O)N[C@@H](C)C1=CCN(C)CC1)c1ccccc1Cl ZINC000511309485 919901715 /nfs/dbraw/zinc/90/17/15/919901715.db2.gz RPIFJTLBZARWOQ-AOMKIAJQSA-N 0 3 413.949 4.388 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2Cl)c(C)c1CC(=O)N[C@H](C)C1=CCN(C)CC1 ZINC000511356738 919951942 /nfs/dbraw/zinc/95/19/42/919951942.db2.gz CPFYPRPFYWFKRP-CYBMUJFWSA-N 0 3 421.372 4.105 20 0 HIADHN C[C@H](NC(=O)c1ccccc1SCc1cn2ccccc2n1)C1=CCN(C)CC1 ZINC000511367833 919958639 /nfs/dbraw/zinc/95/86/39/919958639.db2.gz ACASGZVJBWBKRH-KRWDZBQOSA-N 0 3 406.555 4.007 20 0 HIADHN CN1CCO[C@H]([C@@H](NCCc2nc(C(F)(F)F)cs2)c2ccc(Cl)cc2)C1 ZINC000511383484 919985857 /nfs/dbraw/zinc/98/58/57/919985857.db2.gz YCDYIQBRIMNFQI-YOEHRIQHSA-N 0 3 419.900 4.019 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)N[C@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000511384811 919987842 /nfs/dbraw/zinc/98/78/42/919987842.db2.gz RPDSUZWCKPRBBI-NZQKXSOJSA-N 0 3 413.537 4.067 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)N[C@H](C[C@H]1CCOC1)c1ccccc1 ZINC000511389328 919994158 /nfs/dbraw/zinc/99/41/58/919994158.db2.gz BVAUJEAUOVREMF-NFBKMPQASA-N 0 3 413.537 4.067 20 0 HIADHN COc1ccc(CN(C)C(=O)CN[C@@H](c2cccc(OC(F)(F)F)c2)C2CC2)cc1 ZINC000511545128 920172374 /nfs/dbraw/zinc/17/23/74/920172374.db2.gz IYWAVSZZJGWHJT-OAQYLSRUSA-N 0 3 422.447 4.293 20 0 HIADHN O=C(CN[C@@H](c1cccc(OC(F)(F)F)c1)C1CC1)N[C@@H]1CCOc2ccccc21 ZINC000511584079 920230005 /nfs/dbraw/zinc/23/00/05/920230005.db2.gz GSQKATPXDQVJEQ-WIYYLYMNSA-N 0 3 420.431 4.266 20 0 HIADHN C[C@@H](O)CN(Cc1nc(-c2ccc(Br)s2)no1)C1CCCCC1 ZINC000511593203 920238449 /nfs/dbraw/zinc/23/84/49/920238449.db2.gz NPHVEPYEBZIYAB-LLVKDONJSA-N 0 3 400.342 4.076 20 0 HIADHN O=C(CN1C[C@H](c2ccccc2)[C@H]2COCC[C@@H]21)Nc1ccc(C(F)(F)F)cc1 ZINC000511668345 920334498 /nfs/dbraw/zinc/33/44/98/920334498.db2.gz SZYLAABWJOPRAD-AQNXPRMDSA-N 0 3 404.432 4.148 20 0 HIADHN OC[C@H]1CN(CCSc2ccnc3cc(Cl)ccc32)CC[C@H]1C(F)(F)F ZINC000511667441 920334835 /nfs/dbraw/zinc/33/48/35/920334835.db2.gz ONCKULKYSCISTF-IUODEOHRSA-N 0 3 404.885 4.473 20 0 HIADHN O=C(Nc1nc(CN2CCCCCC2)cs1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000511667409 920335228 /nfs/dbraw/zinc/33/52/28/920335228.db2.gz YVEGTCYJZFECQH-HXUWFJFHSA-N 0 3 412.603 4.370 20 0 HIADHN COc1cccc(OC)c1CNC1CCN(Cc2coc(-c3ccccc3)n2)CC1 ZINC000511764684 920447738 /nfs/dbraw/zinc/44/77/38/920447738.db2.gz IARWBPMTVXYBNC-UHFFFAOYSA-N 0 3 407.514 4.113 20 0 HIADHN C[C@H](CC(=O)Nc1cc(C(F)(F)F)ccc1Cl)N[C@@H]1c2ccccc2C[C@@H]1O ZINC000511765309 920449308 /nfs/dbraw/zinc/44/93/08/920449308.db2.gz OZXZGCIWIGPMRB-XTDINYQCSA-N 0 3 412.839 4.324 20 0 HIADHN Brc1cc(CN2C[C@H](c3ccccc3)[C@H]3COCC[C@@H]32)cc2c1OCO2 ZINC000511765225 920449452 /nfs/dbraw/zinc/44/94/52/920449452.db2.gz NYPIRMDNBJNEIL-LMMKCTJWSA-N 0 3 416.315 4.182 20 0 HIADHN O=C(CCc1ccccc1Br)NC[C@@H](c1cccs1)N1CCCC1 ZINC000511767097 920453497 /nfs/dbraw/zinc/45/34/97/920453497.db2.gz JNGGCPMMMJYDMB-KRWDZBQOSA-N 0 3 407.377 4.397 20 0 HIADHN Cn1c(CN2C[C@H](c3ccccc3)[C@@H]3COCC[C@H]32)nnc1-c1ccc(Cl)cc1 ZINC000511775769 920465103 /nfs/dbraw/zinc/46/51/03/920465103.db2.gz SQKHBXNXZWYXAQ-QHAWAJNXSA-N 0 3 408.933 4.140 20 0 HIADHN C[C@H](c1cc2ccccc2o1)N(C)C(=O)CN1C[C@H](c2ccccc2)[C@@H]2COCC[C@@H]21 ZINC000511781865 920473458 /nfs/dbraw/zinc/47/34/58/920473458.db2.gz UCRASNBDRBIWSK-QQUTXWOLSA-N 0 3 418.537 4.457 20 0 HIADHN Cc1cc(N2CCCC2)ccc1NC(=O)CN1C[C@H](c2ccccc2)[C@H]2COCC[C@H]21 ZINC000511793251 920486332 /nfs/dbraw/zinc/48/63/32/920486332.db2.gz PSCGWWVKXVXDBP-VDKIKQQVSA-N 0 3 419.569 4.038 20 0 HIADHN CCN(CC)C(=O)c1ccc(NC(=O)CN2C[C@H](c3ccccc3)[C@@H]3CCC[C@@H]32)cc1 ZINC000511842615 920558875 /nfs/dbraw/zinc/55/88/75/920558875.db2.gz KLMBITYKAMHENQ-VXNXHJTFSA-N 0 3 419.569 4.375 20 0 HIADHN CCN(CC)C(=O)c1cccc(NC(=O)CN2C[C@H](c3ccccc3)[C@@H]3CCC[C@H]32)c1 ZINC000511897290 920633645 /nfs/dbraw/zinc/63/36/45/920633645.db2.gz RYOGNWMTBJQXIL-RBZQAINGSA-N 0 3 419.569 4.375 20 0 HIADHN CC(C)[C@H](NC(=O)N[C@@H](C)CCN1CCN(C)CC1)c1ccc(C(C)(C)C)cc1 ZINC000511899275 920637527 /nfs/dbraw/zinc/63/75/27/920637527.db2.gz RHDJRHDTINKTKO-UGKGYDQZSA-N 0 3 402.627 4.006 20 0 HIADHN CC(C)N1CC[C@@H](NCc2ncc(CN(C)C)s2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000511925354 920672528 /nfs/dbraw/zinc/67/25/28/920672528.db2.gz YBGXKVDRYLDDNY-QUCCMNQESA-N 0 3 410.990 4.311 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2cc3c(cccc3Br)[nH]2)N(C)C)cc1 ZINC000511959816 920722068 /nfs/dbraw/zinc/72/20/68/920722068.db2.gz HRRPBMLBZALQOU-LJQANCHMSA-N 0 3 400.320 4.272 20 0 HIADHN Cc1cc([C@H](C)NCc2ccccc2CS(C)(=O)=O)sc1Br ZINC000512010110 920781242 /nfs/dbraw/zinc/78/12/42/920781242.db2.gz RPBONHLPUMDGPQ-LBPRGKRZSA-N 0 3 402.379 4.214 20 0 HIADHN CO[C@@H]1C[C@H](c2ccccc2)CC[C@@H]1NC(=O)N(CCN(C)C)Cc1ccc(C)o1 ZINC000512065299 920832268 /nfs/dbraw/zinc/83/22/68/920832268.db2.gz XFLSVLQHJJUBSI-AKIFATBCSA-N 0 3 413.562 4.013 20 0 HIADHN Cc1nn(C)cc1[C@@H](C)N[C@H](C)CC(=O)Nc1cc(C(F)(F)F)ccc1Cl ZINC000512087346 920851608 /nfs/dbraw/zinc/85/16/08/920851608.db2.gz IRTZVDXFJWEKCQ-GHMZBOCLSA-N 0 3 402.848 4.469 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Cc2cccc(Br)c2)N2CCCC2)cc1 ZINC000512092126 920855631 /nfs/dbraw/zinc/85/56/31/920855631.db2.gz PNIGXTFCWFKCRY-HXUWFJFHSA-N 0 3 401.348 4.253 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)c2sc(C(=O)N[C@@H](C)C3=CCN(C)CC3)cc12 ZINC000512137696 920883951 /nfs/dbraw/zinc/88/39/51/920883951.db2.gz JQXOGSWWMACBNY-ZDUSSCGKSA-N 0 3 414.962 4.429 20 0 HIADHN O=C(CCN[C@@H](CCO)c1ccc(Cl)c(Cl)c1)N1CCCc2ccccc21 ZINC000512153610 920894585 /nfs/dbraw/zinc/89/45/85/920894585.db2.gz UHLYFWYDBDOIGY-IBGZPJMESA-N 0 3 407.341 4.376 20 0 HIADHN CC[C@H](NC(=O)NCc1ccc(CN2CCN(C)CC2)cc1)c1ccc(Cl)s1 ZINC000512196033 920942191 /nfs/dbraw/zinc/94/21/91/920942191.db2.gz LNDPIEQZLHFQHK-SFHVURJKSA-N 0 3 421.010 4.099 20 0 HIADHN OCC[C@H](NC[C@@H](O)COc1ccccc1Cl)c1ccc(Cl)c(Cl)c1 ZINC000512202459 920948279 /nfs/dbraw/zinc/94/82/79/920948279.db2.gz KMZLXRXMLWRVIZ-DYVFJYSZSA-N 0 3 404.721 4.100 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N(C)[C@@H]3CCc4ccccc4C3)c(C)c2)CC1 ZINC000512220074 920969220 /nfs/dbraw/zinc/96/92/20/920969220.db2.gz UTFYOSHBZQOEOB-JOCHJYFZSA-N 0 3 406.574 4.158 20 0 HIADHN CCN(CC)C(=O)C1CCN(Cc2cc3ccccc3nc2N2CCCCC2)CC1 ZINC000512219544 920969491 /nfs/dbraw/zinc/96/94/91/920969491.db2.gz OTLWDGQWFFUZCG-UHFFFAOYSA-N 0 3 408.590 4.306 20 0 HIADHN CCC[C@@]1(NCC(=O)N2N=C(c3cccs3)C[C@@H]2c2cccs2)CCOC1 ZINC000512237671 920992631 /nfs/dbraw/zinc/99/26/31/920992631.db2.gz UWMBQRDDHIEXPQ-OXQOHEQNSA-N 0 3 403.573 4.036 20 0 HIADHN FC(F)(F)Oc1cccc(N2CC[C@@H](NCc3cccc4c3OCCCO4)C2)c1 ZINC000512244127 921001066 /nfs/dbraw/zinc/00/10/66/921001066.db2.gz QUDCTMSRNZACHQ-MRXNPFEDSA-N 0 3 408.420 4.115 20 0 HIADHN CCCN(CC(=O)Nc1cccc(C)c1C)C1CCN(c2cc(C)nc(C)n2)CC1 ZINC000512282653 921037227 /nfs/dbraw/zinc/03/72/27/921037227.db2.gz MXXIKJRWFJZREM-UHFFFAOYSA-N 0 3 409.578 4.030 20 0 HIADHN CCc1nc2ccccc2n1CC(=O)Nc1ccc(CN2CCSCC2)cc1C ZINC000512290663 921045102 /nfs/dbraw/zinc/04/51/02/921045102.db2.gz XQKYDOCBGZLEPX-UHFFFAOYSA-N 0 3 408.571 4.095 20 0 HIADHN CC(=O)N(C)C1CCN(Cc2cn(Cc3ccccc3)nc2-c2ccccc2)CC1 ZINC000512292099 921046357 /nfs/dbraw/zinc/04/63/57/921046357.db2.gz GCHSSJRCLJYGJE-UHFFFAOYSA-N 0 3 402.542 4.041 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)c2cccc(C(=O)Nc3ccccc3)c2)CC1 ZINC000512316854 921066868 /nfs/dbraw/zinc/06/68/68/921066868.db2.gz ZEIQVPZTYMZYMP-UHFFFAOYSA-N 0 3 417.509 4.269 20 0 HIADHN FC(F)(F)Oc1ccc(CN[C@H]2CCO[C@@H]2c2cccnc2)cc1Br ZINC000512351119 921097677 /nfs/dbraw/zinc/09/76/77/921097677.db2.gz ZAGUAYFAGZFVQW-GOEBONIOSA-N 0 3 417.225 4.363 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(C)c1CN1CCC(C(=O)NC2CCCCC2)CC1 ZINC000512360172 921103291 /nfs/dbraw/zinc/10/32/91/921103291.db2.gz TUARTGWETITDKY-UHFFFAOYSA-N 0 3 412.553 4.289 20 0 HIADHN O=C(NC[C@@H]1CCO[C@@H]1c1ccccc1)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000513449112 921815285 /nfs/dbraw/zinc/81/52/85/921815285.db2.gz XQMOBTSZZZUIQD-BHDDXSALSA-N 0 3 414.496 4.038 20 0 HIADHN CCOc1c(Br)cc(Br)cc1CN(C)C[C@H]1CCCOC1 ZINC000513466497 921828931 /nfs/dbraw/zinc/82/89/31/921828931.db2.gz GPOAYZMHKWZXHS-GFCCVEGCSA-N 0 3 421.173 4.469 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2CN[C@H](Cc2ccccn2)c2cccnc2)C[C@@H](C)O1 ZINC000513498529 921848245 /nfs/dbraw/zinc/84/82/45/921848245.db2.gz AMTIQPGAEIPMCR-IPVFLDMMSA-N 0 3 416.569 4.159 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)[C@H]1CCO[C@@H]1c1cnn(-c2ccccc2F)c1 ZINC000513522889 921866760 /nfs/dbraw/zinc/86/67/60/921866760.db2.gz VDNPDDHNJCOMSL-WMZHIEFXSA-N 0 3 422.504 4.098 20 0 HIADHN CC(C)OCc1ccc(NC(=O)NCCCN2CCN(C)C[C@H]2c2ccccc2)cc1 ZINC000513558322 921893454 /nfs/dbraw/zinc/89/34/54/921893454.db2.gz MLECJFAQORVJOC-DEOSSOPVSA-N 0 3 424.589 4.112 20 0 HIADHN CCCN(CC(=O)Nc1ccccc1N1CCCC1=O)[C@@H]1CCc2ccccc2C1 ZINC000513632207 921958455 /nfs/dbraw/zinc/95/84/55/921958455.db2.gz AJZMYKUFJZPAEC-OAQYLSRUSA-N 0 3 405.542 4.021 20 0 HIADHN Cc1ccc([C@@H](CNCc2ccc(Br)cc2F)N2CCOCC2)cc1 ZINC000513631819 921958540 /nfs/dbraw/zinc/95/85/40/921958540.db2.gz IADFWGCCXKOYAT-HXUWFJFHSA-N 0 3 407.327 4.060 20 0 HIADHN COc1ccc([C@@H](C)N[C@H](C)c2ccccc2-n2ccnn2)cc1Br ZINC000513673704 921994915 /nfs/dbraw/zinc/99/49/15/921994915.db2.gz WEGSLFZSBKPKGI-ZIAGYGMSSA-N 0 3 401.308 4.450 20 0 HIADHN COc1ccc([C@H](Cc2ccncc2)N[C@H]2CC(=O)N(c3c(F)cccc3F)C2)cc1 ZINC000513685005 922006105 /nfs/dbraw/zinc/00/61/05/922006105.db2.gz WCNDPUQVPPSQSF-AVRDEDQJSA-N 0 3 423.463 4.047 20 0 HIADHN COc1cc(CN(C)[C@@H]2CCOC2)ccc1OCc1ccc(Br)cc1 ZINC000513746209 922068039 /nfs/dbraw/zinc/06/80/39/922068039.db2.gz QEJZUZTYWVZFMP-GOSISDBHSA-N 0 3 406.320 4.257 20 0 HIADHN O=C(c1cnc(NC[C@@H]2CCCN2Cc2ccccc2)c(Cl)c1)N1CCCCC1 ZINC000513762187 922079642 /nfs/dbraw/zinc/07/96/42/922079642.db2.gz YEYWLDKECVQWRM-FQEVSTJZSA-N 0 3 412.965 4.438 20 0 HIADHN COc1ccc(C(=O)CCCC(=O)N[C@H]2CCN(Cc3ccccc3)CC2(C)C)cc1 ZINC000513798400 922124910 /nfs/dbraw/zinc/12/49/10/922124910.db2.gz ZDHRXRXOIVDJQP-DEOSSOPVSA-N 0 3 422.569 4.465 20 0 HIADHN COc1ccc(CCCC(=O)NC[C@H](c2cccs2)N2CCCC2)c(OC)c1 ZINC000513807118 922131655 /nfs/dbraw/zinc/13/16/55/922131655.db2.gz VRWCOFDUOHWCBL-LJQANCHMSA-N 0 3 402.560 4.041 20 0 HIADHN Cc1ccc(CN[C@@H]2CCc3c2cccc3Br)c(N2CCOCC2)c1 ZINC000513859656 922186357 /nfs/dbraw/zinc/18/63/57/922186357.db2.gz OECHEAUFXHIHAI-HXUWFJFHSA-N 0 3 401.348 4.371 20 0 HIADHN Cc1noc(C)c1[C@H](C)CC(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000513929533 922250100 /nfs/dbraw/zinc/25/01/00/922250100.db2.gz IPDVIMOKRBQYKH-UZLBHIALSA-N 0 3 407.518 4.067 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CNc1ccc(OC2CCN(C)CC2)nc1 ZINC000514073516 922396252 /nfs/dbraw/zinc/39/62/52/922396252.db2.gz YKALLQHHIQZQCJ-UHFFFAOYSA-N 0 3 405.546 4.028 20 0 HIADHN CCC[C@@H](Cc1ccccc1)N(CCC)Cc1cnn([C@@]2(C)CCS(=O)(=O)C2)c1 ZINC000514087032 922410505 /nfs/dbraw/zinc/41/05/05/922410505.db2.gz FLQSUMWXYDHBHR-GOTSBHOMSA-N 0 3 417.619 4.040 20 0 HIADHN COc1ccc(C[C@H](C)N[C@@H](CCSC)c2nnc3ccccn32)c(C)c1OC ZINC000514096200 922422058 /nfs/dbraw/zinc/42/20/58/922422058.db2.gz VCNFHGZBXZLBMI-YJBOKZPZSA-N 0 3 414.575 4.070 20 0 HIADHN COc1cc([C@H](C)NC(=O)NC[C@@H](c2ccc(C)cc2)N(C)C)ccc1OC(C)C ZINC000514102239 922428823 /nfs/dbraw/zinc/42/88/23/922428823.db2.gz MQEAWLUQUGPLFF-RXVVDRJESA-N 0 3 413.562 4.454 20 0 HIADHN CCCC(=O)Nc1ccc(CNC(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)cc1 ZINC000514123311 922455892 /nfs/dbraw/zinc/45/58/92/922455892.db2.gz UCBFVEIGTYKHHG-GCJKJVERSA-N 0 3 408.546 4.060 20 0 HIADHN CCCC(=O)Nc1ccc(CNC(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)cc1 ZINC000514123312 922456130 /nfs/dbraw/zinc/45/61/30/922456130.db2.gz UCBFVEIGTYKHHG-XMSQKQJNSA-N 0 3 408.546 4.060 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)N[C@H]3CCc4c3cccc4F)CC2)c1 ZINC000514133801 922469451 /nfs/dbraw/zinc/46/94/51/922469451.db2.gz CNLWLVOJONACPS-DEOSSOPVSA-N 0 3 424.564 4.023 20 0 HIADHN CC[C@@H](NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1)c1nc(-c2ccccc2)c[nH]1 ZINC000514148633 922483453 /nfs/dbraw/zinc/48/34/53/922483453.db2.gz GQEYEHOJDDXEFJ-NHCUHLMSSA-N 0 3 403.530 4.102 20 0 HIADHN O=C(NCc1ccnc(Oc2ccc(F)cc2)c1)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000514157304 922494630 /nfs/dbraw/zinc/49/46/30/922494630.db2.gz DBEKSSSECYGMGV-OAQYLSRUSA-N 0 3 420.488 4.087 20 0 HIADHN CCOc1ccc(CNC(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)cc1 ZINC000514182457 922521876 /nfs/dbraw/zinc/52/18/76/922521876.db2.gz LICAFLRMGSNTQP-FQEVSTJZSA-N 0 3 401.576 4.419 20 0 HIADHN COc1cccc([C@@H](CNC(=O)NCc2ccc3[nH]c(C)c(C)c3c2)N2CCCC2)c1 ZINC000514187122 922527115 /nfs/dbraw/zinc/52/71/15/922527115.db2.gz OQPWHXVBESCGDW-XMMPIXPASA-N 0 3 420.557 4.430 20 0 HIADHN CCc1ccc([C@H](CNC(=O)NC[C@@H]2CCCO[C@@H]2c2ccccc2)N(C)C)cc1 ZINC000514197665 922536315 /nfs/dbraw/zinc/53/63/15/922536315.db2.gz RCNJZXPSZKHTDB-KMDXXIMOSA-N 0 3 409.574 4.319 20 0 HIADHN C[C@@H](NC(=O)NC[C@H](Cc1ccccc1)N(C)C)c1ccc(OCC(F)(F)F)cc1 ZINC000514202026 922539030 /nfs/dbraw/zinc/53/90/30/922539030.db2.gz QKWYSTGDBRMYSP-APWZRJJASA-N 0 3 423.479 4.161 20 0 HIADHN Cc1ccccc1C1(CNC(=O)N[C@@H](CN2CCCC2)c2ccccc2)CCOCC1 ZINC000514217566 922550799 /nfs/dbraw/zinc/55/07/99/922550799.db2.gz DBRYEJBQYHSACT-DEOSSOPVSA-N 0 3 421.585 4.180 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NC[C@@H]1CCN(c2ccc(F)cc2)C1)c1ccsc1 ZINC000514221616 922554512 /nfs/dbraw/zinc/55/45/12/922554512.db2.gz ISRDHXCULJECPQ-LAUBAEHRSA-N 0 3 418.582 4.096 20 0 HIADHN CC(=O)Nc1ccc(S(=O)(=O)CCCN2CCC[C@@H]2CC2CCCCC2)cc1 ZINC000514223706 922558925 /nfs/dbraw/zinc/55/89/25/922558925.db2.gz SIJYKJRTTSKHBW-OAQYLSRUSA-N 0 3 406.592 4.244 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N[C@H]1CCCOc2ccc(F)cc21)c1ccsc1 ZINC000514242472 922582615 /nfs/dbraw/zinc/58/26/15/922582615.db2.gz SFHHLXQMKXTLNN-OALUTQOASA-N 0 3 405.539 4.483 20 0 HIADHN CN(C)[C@H](CNC(=O)NC[C@H](c1ccccc1Cl)N1CCCC1)c1ccsc1 ZINC000514458364 922635485 /nfs/dbraw/zinc/63/54/85/922635485.db2.gz NQUNHZPMYNVVAS-WOJBJXKFSA-N 0 3 421.010 4.141 20 0 HIADHN CN(Cc1cc(Br)cs1)C(=O)NC[C@H](c1ccccc1)N1CCCC1 ZINC000514566533 922703833 /nfs/dbraw/zinc/70/38/33/922703833.db2.gz GSAMMVFHTWFPQJ-GOSISDBHSA-N 0 3 422.392 4.489 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)c1ccc(C(=O)N(C)c2ccccc2)cc1)c1ccco1 ZINC000514750604 922781315 /nfs/dbraw/zinc/78/13/15/922781315.db2.gz XXWUPLTVHPNVEP-GCJKJVERSA-N 0 3 419.525 4.415 20 0 HIADHN CCOC(=O)C(C)(C)c1csc(NC(=O)c2oc3ccccc3c2CN(C)C)n1 ZINC000514963115 922856068 /nfs/dbraw/zinc/85/60/68/922856068.db2.gz FZSMBBOTVHFKQG-UHFFFAOYSA-N 0 3 415.515 4.044 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)[C@@H](C)Oc3ccc4c(c3)CCC4)c(C)c2)CC1 ZINC000515086189 922899664 /nfs/dbraw/zinc/89/96/64/922899664.db2.gz OHQQTOOEUBCGIE-LJQANCHMSA-N 0 3 407.558 4.032 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N(Cc3ccc(F)cc3)C3CC3)c(C)c2)CC1 ZINC000515113240 922925448 /nfs/dbraw/zinc/92/54/48/922925448.db2.gz LORFXJZHJPXYBB-UHFFFAOYSA-N 0 3 410.537 4.473 20 0 HIADHN Cc1cc(NC(=O)NC[C@H](c2ccccc2)N2CCCC2)n(Cc2ccccc2)n1 ZINC000515117765 922931091 /nfs/dbraw/zinc/93/10/91/922931091.db2.gz ABKSHXMJFMBVIE-JOCHJYFZSA-N 0 3 403.530 4.198 20 0 HIADHN O=C(Nc1cccc(NC(=O)c2cccs2)c1)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000515119552 922932756 /nfs/dbraw/zinc/93/27/56/922932756.db2.gz AFEUILJXHZIESS-FQEVSTJZSA-N 0 3 420.538 4.396 20 0 HIADHN CCCc1c(NC(=O)N[C@H](C)CN(C)Cc2ccccc2)cnn1-c1cc(C)ccn1 ZINC000515249504 923017412 /nfs/dbraw/zinc/01/74/12/923017412.db2.gz FIKIEHUXVOXKAD-LJQANCHMSA-N 0 3 420.561 4.170 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cnn2c1nccc2-c1ccccc1)c1ccsc1 ZINC000515503876 923139429 /nfs/dbraw/zinc/13/94/29/923139429.db2.gz VEZKGZBZSOLFFV-OAQYLSRUSA-N 0 3 419.554 4.271 20 0 HIADHN Cc1ccccc1CN1CCC(NS(=O)(=O)c2cccc(Cl)c2Cl)CC1 ZINC000515517023 923147572 /nfs/dbraw/zinc/14/75/72/923147572.db2.gz NEIPNOWVZYJXBH-UHFFFAOYSA-N 0 3 413.370 4.245 20 0 HIADHN O=C(NCc1cc(F)ccc1Br)N[C@H](CN1CCCC1)c1ccccc1 ZINC000515778463 923346070 /nfs/dbraw/zinc/34/60/70/923346070.db2.gz NPTNLYZNWYVTHQ-LJQANCHMSA-N 0 3 420.326 4.225 20 0 HIADHN C[C@@H](NC(=O)NC[C@H](c1ccccc1)N(C)C)c1cccc(OCc2ccccn2)c1 ZINC000515854702 923394922 /nfs/dbraw/zinc/39/49/22/923394922.db2.gz CDAPSBVLVDAABU-NTKDMRAZSA-N 0 3 418.541 4.324 20 0 HIADHN COc1cc([C@H](C)NC(=O)NCCN2CCCCC2)ccc1OCc1ccccc1 ZINC000515910864 923428809 /nfs/dbraw/zinc/42/88/09/923428809.db2.gz ITNLNENBVAONAK-IBGZPJMESA-N 0 3 411.546 4.120 20 0 HIADHN CC1CCN([C@@H](CNC(=O)c2cncc(Br)c2)c2ccccc2)CC1 ZINC000515978974 923475267 /nfs/dbraw/zinc/47/52/67/923475267.db2.gz XIEUILJWQWNKDH-IBGZPJMESA-N 0 3 402.336 4.047 20 0 HIADHN CCOC(=O)c1[nH]c(C)c(C(=O)NC[C@@H](c2ccccc2)N2CCC(C)CC2)c1C ZINC000516138743 923569302 /nfs/dbraw/zinc/56/93/02/923569302.db2.gz LBRXHJMGAVWQPY-FQEVSTJZSA-N 0 3 411.546 4.011 20 0 HIADHN Cc1noc(C)c1CSCC(=O)NC[C@@H](c1ccccc1)N1CCC(C)CC1 ZINC000516138741 923569409 /nfs/dbraw/zinc/56/94/09/923569409.db2.gz LBCUMOUMFXTOMD-NRFANRHFSA-N 0 3 401.576 4.114 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N(C)Cc2ccc(OC(F)F)cc2)C1 ZINC000516163626 923581976 /nfs/dbraw/zinc/58/19/76/923581976.db2.gz MPJGSQHHZWGNRA-VQIMIIECSA-N 0 3 403.473 4.265 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)NCCc2ccccc2C(F)(F)F)CC1 ZINC000516168630 923583398 /nfs/dbraw/zinc/58/33/98/923583398.db2.gz UYLSCHZAOOJMAP-UHFFFAOYSA-N 0 3 409.452 4.147 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N2CCC[C@H]2c2ccc3c(c2)OCCO3)C1 ZINC000516165662 923584643 /nfs/dbraw/zinc/58/46/43/923584643.db2.gz UVZDFEGSDVBJHT-COPCDDAFSA-N 0 3 421.541 4.140 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cnn(-c2ccc(F)cc2F)c1C)c1ccsc1 ZINC000516179717 923589164 /nfs/dbraw/zinc/58/91/64/923589164.db2.gz SQSKBUIEJBSNOI-FQEVSTJZSA-N 0 3 418.513 4.333 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N2CCC(COc3ccccc3)CC2)C1 ZINC000516223608 923610721 /nfs/dbraw/zinc/61/07/21/923610721.db2.gz ROHPVAOOUZRBPD-NFBKMPQASA-N 0 3 407.558 4.323 20 0 HIADHN Cc1ccc(-c2noc(CCC(=O)N[C@@H](CN3CCCC3)c3ccccc3)n2)cc1F ZINC000516436354 923731997 /nfs/dbraw/zinc/73/19/97/923731997.db2.gz WAVBMPISOKKMEU-NRFANRHFSA-N 0 3 422.504 4.070 20 0 HIADHN CC1CCN([C@H](CNC(=O)Nc2cc3c(cc2F)CCC(=O)N3)c2ccccc2)CC1 ZINC000516466627 923746225 /nfs/dbraw/zinc/74/62/25/923746225.db2.gz UIYOOAKRLUQVOU-JOCHJYFZSA-N 0 3 424.520 4.305 20 0 HIADHN C[C@H](CNC(=O)CSc1nnc(-c2ccc3ccccc3c2)o1)N1CCCC[C@H]1C ZINC000516491429 923756946 /nfs/dbraw/zinc/75/69/46/923756946.db2.gz GVIKOUKJMVDDAY-IAGOWNOFSA-N 0 3 424.570 4.361 20 0 HIADHN CCO[C@@H]1C[C@H](N[C@@H](C)c2cc3cc(Br)ccc3o2)[C@H]1n1cccn1 ZINC000516496789 923760130 /nfs/dbraw/zinc/76/01/30/923760130.db2.gz AJHSMTFAFNSGLE-LAKGBWAGSA-N 0 3 404.308 4.461 20 0 HIADHN CC(C)[C@H](NC(=O)N[C@H]1CCN([C@H](C)c2ccccc2)C1)c1ccc2c(c1)OCCO2 ZINC000516578722 923800955 /nfs/dbraw/zinc/80/09/55/923800955.db2.gz LFOIOFTUUAGXKD-ZHRMCQFGSA-N 0 3 423.557 4.290 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)NCc2ccc(Br)s2)C1 ZINC000516581476 923802022 /nfs/dbraw/zinc/80/20/22/923802022.db2.gz NFKJMJRCILTBLL-DZGCQCFKSA-N 0 3 408.365 4.145 20 0 HIADHN C[C@@H](CCc1ccc(Br)cc1)NC(=O)N1CCN(C2CCCC2)CC1 ZINC000516587631 923803598 /nfs/dbraw/zinc/80/35/98/923803598.db2.gz JOROAVTUBFEVEH-INIZCTEOSA-N 0 3 408.384 4.040 20 0 HIADHN O=C(N1CCC=C(c2cccnc2)C1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000516602888 923811670 /nfs/dbraw/zinc/81/16/70/923811670.db2.gz CXTRFRYXZRDLHK-QFIPXVFZSA-N 0 3 415.459 4.152 20 0 HIADHN COc1ccc2[nH]cc(C3CCN(C(=O)NC[C@H](c4ccccc4)N(C)C)CC3)c2c1 ZINC000516656070 923830701 /nfs/dbraw/zinc/83/07/01/923830701.db2.gz WDLLTACPTGVGMV-XMMPIXPASA-N 0 3 420.557 4.368 20 0 HIADHN CN(C)[C@@H](CNC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1)c1ccccc1Cl ZINC000516767648 923882391 /nfs/dbraw/zinc/88/23/91/923882391.db2.gz XZSNSNPNKCFFLR-GCJKJVERSA-N 0 3 417.956 4.110 20 0 HIADHN Cc1cc(NC(=O)c2cccnc2OC(C)C)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000516985757 923953148 /nfs/dbraw/zinc/95/31/48/923953148.db2.gz UMVCEYAFASXYMK-FQEVSTJZSA-N 0 3 419.529 4.073 20 0 HIADHN CC(C)[C@H](NC[C@@H](O)CS(=O)(=O)c1cccs1)c1ccc(C(C)(C)C)cc1 ZINC000517045622 923971652 /nfs/dbraw/zinc/97/16/52/923971652.db2.gz FFRJKFGWNJLJGW-QUCCMNQESA-N 0 3 409.617 4.167 20 0 HIADHN C[C@@H](NCC(=O)NC[C@@H]1CCN(c2ccccc2)C1)c1ccc(F)c2ccccc21 ZINC000517053293 923975966 /nfs/dbraw/zinc/97/59/66/923975966.db2.gz AKFPNIJJDQYNBB-MOPGFXCFSA-N 0 3 405.517 4.272 20 0 HIADHN C[C@@H](CNC(=O)CSc1nnc(-c2ccc3ccccc3c2)o1)N1CCC[C@H](C)C1 ZINC000517090329 923991475 /nfs/dbraw/zinc/99/14/75/923991475.db2.gz LUNUKTACYPPYCR-IRXDYDNUSA-N 0 3 424.570 4.219 20 0 HIADHN CCC[C@H]1CN(c2nnc(C(C)C)n2C[C@@H]2CCCO2)CCN1Cc1ccccc1 ZINC000517248747 924060032 /nfs/dbraw/zinc/06/00/32/924060032.db2.gz AQAXYTVDXGSRDP-VXKWHMMOSA-N 0 3 411.594 4.071 20 0 HIADHN O=C(CCC(=O)N1CC[C@]2(CCN(Cc3ccccc3)C2)C1)c1ccc(Cl)cc1 ZINC000517252355 924060894 /nfs/dbraw/zinc/06/08/94/924060894.db2.gz PYSBILATEBJTRJ-DEOSSOPVSA-N 0 3 410.945 4.428 20 0 HIADHN CCc1ccc([C@H](CNC(=O)Nc2ccc(C(=O)NC(C)C)cc2C)N(C)C)cc1 ZINC000517303816 924089830 /nfs/dbraw/zinc/08/98/30/924089830.db2.gz UDOGVJFEPYWLOH-QFIPXVFZSA-N 0 3 410.562 4.120 20 0 HIADHN O=C(CN1CCC[C@H](Cc2ccccc2)C1)N1CCC[C@@H]1c1ccc2c(c1)OCCO2 ZINC000517324699 924103624 /nfs/dbraw/zinc/10/36/24/924103624.db2.gz ZGCLHUNDAORIMH-FYYLOGMGSA-N 0 3 420.553 4.076 20 0 HIADHN Cc1noc(C[C@H](NC[C@@H](O)CO[C@H](C)c2ccc(Cl)cc2)c2ccccc2)n1 ZINC000517476551 924217417 /nfs/dbraw/zinc/21/74/17/924217417.db2.gz DQNPCIHXQSBDNX-LPTQZCDUSA-N 0 3 415.921 4.044 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc(CNCc2ccc(OCC(C)C)cc2)cc1 ZINC000517539799 924254017 /nfs/dbraw/zinc/25/40/17/924254017.db2.gz GPEXRWDGYCPVMT-UHFFFAOYSA-N 0 3 404.576 4.042 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)NCc2cc(Br)cs2)C1 ZINC000517544832 924256620 /nfs/dbraw/zinc/25/66/20/924256620.db2.gz TYNCSWQFLLKSID-XJKSGUPXSA-N 0 3 408.365 4.145 20 0 HIADHN FC(F)(F)CN1CC[C@@H](NCc2ccc(-c3ccc(Br)cc3)o2)C1 ZINC000517552595 924261122 /nfs/dbraw/zinc/26/11/22/924261122.db2.gz OOOHHAQDSKNUDA-CQSZACIVSA-N 0 3 403.242 4.435 20 0 HIADHN COc1cc(Cl)c(C)cc1NC(=O)N1CCC(CN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000517600349 926710252 /nfs/dbraw/zinc/71/02/52/926710252.db2.gz RSAVQSGKCKRFNJ-HOTGVXAUSA-N 0 3 409.958 4.010 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)N(Cc1ccco1)Cc1ccccc1 ZINC000517643612 926750562 /nfs/dbraw/zinc/75/05/62/926750562.db2.gz CCIQERQQKKEYQR-UHFFFAOYSA-N 0 3 417.553 4.411 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)C3(c4ccc(C)cc4)CCOCC3)c(C)c2)CC1 ZINC000517653385 926760687 /nfs/dbraw/zinc/76/06/87/926760687.db2.gz PMYOSWUJJLPGPT-UHFFFAOYSA-N 0 3 421.585 4.132 20 0 HIADHN COCCCN(C(=O)C[C@H](C)c1cccc(C(F)(F)F)c1)C1CCN(C)CC1 ZINC000517792485 926839146 /nfs/dbraw/zinc/83/91/46/926839146.db2.gz VBQYGZTVACUQPA-INIZCTEOSA-N 0 3 400.485 4.158 20 0 HIADHN O=C(NC[C@@H]1CCCO[C@H]1c1ccccc1)N1CCCN(Cc2ccccc2)CC1 ZINC000517804988 926844231 /nfs/dbraw/zinc/84/42/31/926844231.db2.gz USJYEPAJVOQGOX-ZEQRLZLVSA-N 0 3 407.558 4.072 20 0 HIADHN CCN(C)C(=O)c1cccc(C(=O)N(CC)[C@H]2CCN([C@H](C)c3ccccc3)C2)c1 ZINC000517823908 926852753 /nfs/dbraw/zinc/85/27/53/926852753.db2.gz JAUBHNLCYOCEAF-XXBNENTESA-N 0 3 407.558 4.076 20 0 HIADHN CCN(CC)[C@@H](C(=O)NC1CCN(Cc2ccc(F)c(F)c2)CC1)c1ccccc1 ZINC000517882628 926873362 /nfs/dbraw/zinc/87/33/62/926873362.db2.gz PFZZIICYWWWHLS-HSZRJFAPSA-N 0 3 415.528 4.129 20 0 HIADHN C[C@@H](NC(=O)N(CCN(C)C)Cc1ccccc1F)c1nc(C(C)(C)C)cs1 ZINC000518030626 926967328 /nfs/dbraw/zinc/96/73/28/926967328.db2.gz QPLPMQAAOKAWFU-OAHLLOKOSA-N 0 3 406.571 4.414 20 0 HIADHN CN(C)Cc1cccc(NC(=O)c2nc(-c3cccs3)n(-c3ccc(F)cc3)n2)c1 ZINC000518171273 927062572 /nfs/dbraw/zinc/06/25/72/927062572.db2.gz PKLYOCNCNMMAMZ-UHFFFAOYSA-N 0 3 421.501 4.449 20 0 HIADHN CC1CCN([C@@H](CNC(=O)NC[C@@H]2CCOc3ccccc32)c2cccs2)CC1 ZINC000518211846 927082732 /nfs/dbraw/zinc/08/27/32/927082732.db2.gz GHRQBSHTPNMUOF-ICSRJNTNSA-N 0 3 413.587 4.387 20 0 HIADHN COc1ccc(-c2nn(Cc3ccccc3)cc2CNCc2cccc(CO)c2)cc1 ZINC000518275880 927133520 /nfs/dbraw/zinc/13/35/20/927133520.db2.gz WXMIPJCWHZAPIS-UHFFFAOYSA-N 0 3 413.521 4.389 20 0 HIADHN CC(C)Oc1ccc([C@H](C)NC(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)cc1 ZINC000518307611 927170064 /nfs/dbraw/zinc/17/00/64/927170064.db2.gz YDKZBUGMQKYANZ-FQEVSTJZSA-N 0 3 409.574 4.495 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3ccccc3OC3CCCC3)CC2)C[C@@H](C)O1 ZINC000518314526 927177133 /nfs/dbraw/zinc/17/71/33/927177133.db2.gz KRDXJDQZBUTPHB-RTBURBONSA-N 0 3 415.578 4.361 20 0 HIADHN Cc1cc(OC(C)C)ccc1NC(=O)N1CCC(CN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000518315934 927179122 /nfs/dbraw/zinc/17/91/22/927179122.db2.gz KQCQAISVJLLVAH-OALUTQOASA-N 0 3 403.567 4.135 20 0 HIADHN CC(C)n1ncc2c1nc(C1CC1)cc2C(=O)NC[C@H](C)N(C)Cc1ccccc1 ZINC000518378182 927229437 /nfs/dbraw/zinc/22/94/37/927229437.db2.gz OBGOEOCWJCXHFC-KRWDZBQOSA-N 0 3 405.546 4.140 20 0 HIADHN COc1cccc(C[C@@H]2CCCN2C(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)c1 ZINC000518403125 927244605 /nfs/dbraw/zinc/24/46/05/927244605.db2.gz HYYJJFLFGFEUHD-OIBXWCBGSA-N 0 3 407.558 4.247 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N(C)Cc2ccc(Br)o2)C1 ZINC000518409654 927250808 /nfs/dbraw/zinc/25/08/08/927250808.db2.gz MCLGNTGGJIGZQD-GDBMZVCRSA-N 0 3 406.324 4.019 20 0 HIADHN CC(C)(C)CCN1CCN(C(=O)NCc2ccc(Oc3cccnc3)c(F)c2)CC1 ZINC000518521707 927324520 /nfs/dbraw/zinc/32/45/20/927324520.db2.gz FLLKUSKCQVGNJF-UHFFFAOYSA-N 0 3 414.525 4.276 20 0 HIADHN Cc1ccc(-n2ncc(C(=O)N3CC[C@@H](N4CCCCC4)C3)c2C2CC2)cc1Cl ZINC000518616024 927380773 /nfs/dbraw/zinc/38/07/73/927380773.db2.gz GWMSEZWLBJFCBO-LJQANCHMSA-N 0 3 412.965 4.412 20 0 HIADHN COc1ccccc1[C@@H](NC(=O)[C@@H]1CCCN(Cc2cccnc2)C1)c1ccccc1 ZINC000518657514 927411527 /nfs/dbraw/zinc/41/15/27/927411527.db2.gz MJYMLKMZPROLAW-RDGATRHJSA-N 0 3 415.537 4.208 20 0 HIADHN Cc1[nH]c2ccccc2c1C1=CCN(C(=O)NCCN(C)Cc2ccccc2)CC1 ZINC000518720619 927453812 /nfs/dbraw/zinc/45/38/12/927453812.db2.gz YNVQNFLWFLLVMQ-UHFFFAOYSA-N 0 3 402.542 4.407 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@H](C)NCc2cnn(Cc3ccccc3)c2)CC1 ZINC000518774644 927486684 /nfs/dbraw/zinc/48/66/84/927486684.db2.gz YHOVFCFFCSXKTC-FQEVSTJZSA-N 0 3 421.564 4.063 20 0 HIADHN O=C(Nc1cccc(CNCc2ccc(OCCO)cc2)c1)c1ccccc1Cl ZINC000518776019 927489022 /nfs/dbraw/zinc/48/90/22/927489022.db2.gz RHKXOTXHWQYJKS-UHFFFAOYSA-N 0 3 410.901 4.253 20 0 HIADHN CC[C@@H](C)Oc1ccc(NC(=O)N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)cc1 ZINC000518838334 927538480 /nfs/dbraw/zinc/53/84/80/927538480.db2.gz CUAGMTYFCKNKOK-QRVBRYPASA-N 0 3 403.567 4.217 20 0 HIADHN Cc1c(CN2CCSCC2)cccc1NC(=O)[C@H](c1cccc(Cl)c1)N(C)C ZINC000518891076 927603081 /nfs/dbraw/zinc/60/30/81/927603081.db2.gz IVECCMAVJSYDHF-NRFANRHFSA-N 0 3 418.006 4.439 20 0 HIADHN Cc1cc(N2CCCC2)ccc1NC(=O)CCCN1CCN(c2ccccc2)CC1 ZINC000518905406 927615859 /nfs/dbraw/zinc/61/58/59/927615859.db2.gz XBSDBXAZHJRSHM-UHFFFAOYSA-N 0 3 406.574 4.136 20 0 HIADHN COCc1c(C(=O)NC[C@@H](C)N(C)Cc2ccccc2)sc2cccc(F)c21 ZINC000518907747 927617074 /nfs/dbraw/zinc/61/70/74/927617074.db2.gz BPRTXPHQCUWFLM-OAHLLOKOSA-N 0 3 400.519 4.437 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N(C)Cc3ccc(OC(F)F)cc3)cc2)CC1 ZINC000518926321 927632766 /nfs/dbraw/zinc/63/27/66/927632766.db2.gz FPXOJOTYIOGAMO-UHFFFAOYSA-N 0 3 417.500 4.091 20 0 HIADHN CC[C@H](NC(=O)NCC(C)(C)N1CCc2ccccc2C1)c1ccc2c(c1)OCCO2 ZINC000519014488 927693178 /nfs/dbraw/zinc/69/31/78/927693178.db2.gz RLFGJIAAPYPMTE-NRFANRHFSA-N 0 3 423.557 4.045 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@@H](CO)c1ccccc1)c1ccc(C(F)(F)F)cc1 ZINC000519020986 927698339 /nfs/dbraw/zinc/69/83/39/927698339.db2.gz FMEWKDZDDROKNX-VQTJNVASSA-N 0 3 423.479 4.121 20 0 HIADHN CCN(CC)C(=O)c1ccc(C(=O)N(CCN(C)C)Cc2cccc(Cl)c2)cc1 ZINC000519098459 927769384 /nfs/dbraw/zinc/76/93/84/927769384.db2.gz JXDLDIDEOFNGRD-UHFFFAOYSA-N 0 3 415.965 4.026 20 0 HIADHN COC(=O)c1cc2cc(NC(=O)N(CCCc3ccccc3)CCN(C)C)ccc2o1 ZINC000519229882 927837867 /nfs/dbraw/zinc/83/78/67/927837867.db2.gz VZBVOZKYYMIRAK-UHFFFAOYSA-N 0 3 423.513 4.248 20 0 HIADHN C[C@@H]1CCC[C@@H](C)N1CCNC(=O)C(=O)Nc1ccccc1Sc1ccccc1 ZINC000519390113 927917198 /nfs/dbraw/zinc/91/71/98/927917198.db2.gz VQGGGFZPMUJWLM-QZTJIDSGSA-N 0 3 411.571 4.155 20 0 HIADHN CC(C)c1ncc(Cl)c(C(=O)NC[C@@H](C(C)C)N2CCc3ccccc3C2)n1 ZINC000519401541 927924095 /nfs/dbraw/zinc/92/40/95/927924095.db2.gz OCSUSRRJTMHXAF-IBGZPJMESA-N 0 3 400.954 4.066 20 0 HIADHN Cc1cc(C(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)c(C)n1-c1nccs1 ZINC000519414340 927932852 /nfs/dbraw/zinc/93/28/52/927932852.db2.gz ATZKLBWWZFJHJO-UHFFFAOYSA-N 0 3 418.513 4.033 20 0 HIADHN CC[C@@H](NC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1)c1ccc2c(c1)OCCO2 ZINC000519440120 927948656 /nfs/dbraw/zinc/94/86/56/927948656.db2.gz JKEIPABPRKHTKS-TZIWHRDSSA-N 0 3 412.505 4.076 20 0 HIADHN O=C(NCc1ccccc1OCC(F)(F)F)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000519442045 927949844 /nfs/dbraw/zinc/94/98/44/927949844.db2.gz RDYPLTWAPNDJLX-SFHVURJKSA-N 0 3 424.438 4.295 20 0 HIADHN Cn1cc(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)c(-c2ccccc2Cl)n1 ZINC000519459668 927964793 /nfs/dbraw/zinc/96/47/93/927964793.db2.gz VLZXDDPUPGOGRD-SFHVURJKSA-N 0 3 408.933 4.135 20 0 HIADHN O=S(=O)(Cc1ccc(C(F)F)cc1)NCC1CCN(Cc2cccs2)CC1 ZINC000519587880 928024491 /nfs/dbraw/zinc/02/44/91/928024491.db2.gz HSPFUXKHMVKLAT-UHFFFAOYSA-N 0 3 414.543 4.017 20 0 HIADHN CCOCC(C)(C)CN[C@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000519723768 928058715 /nfs/dbraw/zinc/05/87/15/928058715.db2.gz JBUAASOCSHXPPV-HXUWFJFHSA-N 0 3 409.979 4.485 20 0 HIADHN CCOc1cc(C(=O)N(CCN(C)C)c2ccccc2)ccc1OCc1cccnc1 ZINC000519898083 928133507 /nfs/dbraw/zinc/13/35/07/928133507.db2.gz KPYMZVKGVGQFLJ-UHFFFAOYSA-N 0 3 419.525 4.268 20 0 HIADHN CC(=O)Nc1ccc(OC[C@H](O)CN(C)[C@H](C)c2cccc(C(F)(F)F)c2)cc1 ZINC000519903514 928138686 /nfs/dbraw/zinc/13/86/86/928138686.db2.gz JPBKBLCEYDJSBT-AUUYWEPGSA-N 0 3 410.436 4.097 20 0 HIADHN CCN(CCc1cccs1)C(=O)Nc1ccc(N2CCN(CC)CC2)cc1C ZINC000519909393 928144646 /nfs/dbraw/zinc/14/46/46/928144646.db2.gz VPIJOBZAFAEIHG-UHFFFAOYSA-N 0 3 400.592 4.295 20 0 HIADHN CC(C)c1cccc(O[C@H](C(=O)NCCCCN2CCN(C)CC2)c2ccccc2)c1 ZINC000519929612 928162336 /nfs/dbraw/zinc/16/23/36/928162336.db2.gz MMPLODMLCLBHMI-VWLOTQADSA-N 0 3 423.601 4.074 20 0 HIADHN Cc1c(C(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)cnn1-c1ccc(C)cc1 ZINC000519936682 928171540 /nfs/dbraw/zinc/17/15/40/928171540.db2.gz OIBIDFHNZSJUQH-DEOSSOPVSA-N 0 3 402.542 4.364 20 0 HIADHN COc1ccc(COC[C@@H](O)CN2CCC[C@H]2Cc2c(F)cccc2Cl)cc1 ZINC000519968418 928197643 /nfs/dbraw/zinc/19/76/43/928197643.db2.gz DIQUZODESCLWPY-ROUUACIJSA-N 0 3 407.913 4.072 20 0 HIADHN O=C(NCc1cc(F)ccc1Br)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000520112137 928318339 /nfs/dbraw/zinc/31/83/39/928318339.db2.gz GEUDKIJJDPVHPM-OAHLLOKOSA-N 0 3 423.301 4.256 20 0 HIADHN Cc1nc(NC(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)sc1C ZINC000520128721 928326561 /nfs/dbraw/zinc/32/65/61/928326561.db2.gz HBMBQJLHBAHMPW-UHFFFAOYSA-N 0 3 400.470 4.374 20 0 HIADHN CC[C@@H](c1ccccc1)N(CC)CC(=O)NCc1ccc(C(=O)N2CCCC2)cc1 ZINC000520174563 928365899 /nfs/dbraw/zinc/36/58/99/928365899.db2.gz PCHIQHXCNQNWTJ-QHCPKHFHSA-N 0 3 407.558 4.012 20 0 HIADHN COc1ccc(C[C@@](C)(O)CN[C@@H](C)c2nc(-c3ccccc3)cs2)cc1OC ZINC000520212395 928390596 /nfs/dbraw/zinc/39/05/96/928390596.db2.gz HGYBQHOZFIIKSJ-QMHKHESXSA-N 0 3 412.555 4.472 20 0 HIADHN COc1ccc(C[C@H](N[C@@H]2CCN(c3ccccc3)C2=O)c2ccccc2)cc1OC ZINC000520249346 928416834 /nfs/dbraw/zinc/41/68/34/928416834.db2.gz ZKTDDFICQPHEIW-PKTZIBPZSA-N 0 3 416.521 4.383 20 0 HIADHN CCCOc1ccc(NC(=O)N2CCC(CN3C[C@@H](C)O[C@H](C)C3)CC2)cc1Cl ZINC000520266504 928431601 /nfs/dbraw/zinc/43/16/01/928431601.db2.gz RUTINHYAPHXOCN-IAGOWNOFSA-N 0 3 423.985 4.482 20 0 HIADHN Cc1cc(CN(CCCN2CCOCC2)Cc2ccncc2)cc(C)c1OC(F)F ZINC000520289279 928451743 /nfs/dbraw/zinc/45/17/43/928451743.db2.gz CCTUNRDNJXFDOK-UHFFFAOYSA-N 0 3 419.516 4.024 20 0 HIADHN C[C@H](CNC(=O)[C@H]1C[C@H]1c1cccc(Br)c1)N(C)Cc1ccccc1 ZINC000520327478 928491259 /nfs/dbraw/zinc/49/12/59/928491259.db2.gz FNEJAJWUPZDUMO-XPGWFJOJSA-N 0 3 401.348 4.189 20 0 HIADHN Cc1ccc(C2(C(=O)Nc3ccc(CCN4CCSCC4)cc3)CCOCC2)cc1 ZINC000520339570 928503587 /nfs/dbraw/zinc/50/35/87/928503587.db2.gz AKMPKLFGRSDWQX-UHFFFAOYSA-N 0 3 424.610 4.273 20 0 HIADHN COCCN(Cc1ccccc1)C(=O)NC[C@H](c1cccs1)N1CCC(C)CC1 ZINC000520424766 928559501 /nfs/dbraw/zinc/55/95/01/928559501.db2.gz WOCCBOUEPUDUEY-OAQYLSRUSA-N 0 3 415.603 4.379 20 0 HIADHN C[C@H](N[C@H]1CCN(C(C)(C)C)[C@@H]1c1ccc(Cl)c(F)c1)C(=O)Nc1nccs1 ZINC000520433246 928562627 /nfs/dbraw/zinc/56/26/27/928562627.db2.gz NCLUHGTVGZBXDV-AFAVFJNCSA-N 0 3 424.973 4.466 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N(C)Cc3c(F)cccc3Cl)cc2)CC1 ZINC000520462012 928579884 /nfs/dbraw/zinc/57/98/84/928579884.db2.gz HFYKNAQIHFCAIE-UHFFFAOYSA-N 0 3 403.929 4.282 20 0 HIADHN CCN1CCCC[C@@H]1C(=O)NCc1ccccc1-c1ccc(Cn2ccnc2)cc1 ZINC000520567086 928644970 /nfs/dbraw/zinc/64/49/70/928644970.db2.gz JXCVYXWEMQIGQZ-XMMPIXPASA-N 0 3 402.542 4.089 20 0 HIADHN COc1ccc2c(c1F)CC[C@@H]2N[C@@H]1CCCN([C@H](C)c2ccc(F)cc2)C1=O ZINC000520601745 928666764 /nfs/dbraw/zinc/66/67/64/928666764.db2.gz NWCSSBUIZDQIRW-VOBQZIQPSA-N 0 3 400.469 4.303 20 0 HIADHN C[C@H](NC(=O)NC[C@@H]1CCCCN1C1CC1)c1ccc(OCc2cccnc2)cc1 ZINC000520706552 928754193 /nfs/dbraw/zinc/75/41/93/928754193.db2.gz WMQADKQUXPXHHR-AVRDEDQJSA-N 0 3 408.546 4.038 20 0 HIADHN Cc1nc(COc2ccc(Cl)cc2)sc1C(=O)N[C@H]1CCN(C2CCCC2)C1 ZINC000520733831 928782714 /nfs/dbraw/zinc/78/27/14/928782714.db2.gz RGRWMJOPCUKEMD-INIZCTEOSA-N 0 3 419.978 4.431 20 0 HIADHN O=C([C@H](Sc1cc(F)ccc1F)c1ccccc1)N1CC[C@H](N2CCCC2)C1 ZINC000520734528 928784347 /nfs/dbraw/zinc/78/43/47/928784347.db2.gz FPLLHKXNDNTLIT-GHTZIAJQSA-N 0 3 402.510 4.495 20 0 HIADHN COC1CCN(C(C)(C)CNC(=O)CCC(=O)c2ccc(-c3ccccc3)cc2)CC1 ZINC000520770654 928810122 /nfs/dbraw/zinc/81/01/22/928810122.db2.gz LAWAEZWYGRRQTH-UHFFFAOYSA-N 0 3 422.569 4.322 20 0 HIADHN CCC(=O)Nc1ccc(C)c(NC(=O)N(CCCc2ccccc2)CCN(C)C)c1 ZINC000520796330 928822964 /nfs/dbraw/zinc/82/29/64/928822964.db2.gz FVAMIBFVHQJBRA-UHFFFAOYSA-N 0 3 410.562 4.372 20 0 HIADHN Cc1ccc(Cc2nnc(NC(=O)N[C@@H]3CCN([C@@H](C)c4ccccc4)C3)s2)cc1 ZINC000520856388 928846679 /nfs/dbraw/zinc/84/66/79/928846679.db2.gz CKXZGYPMULRYAR-FXAWDEMLSA-N 0 3 421.570 4.394 20 0 HIADHN O=C(NCc1ccc(Br)s1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000520954061 928887761 /nfs/dbraw/zinc/88/77/61/928887761.db2.gz RENPZOJKLRHTIU-CQSZACIVSA-N 0 3 411.340 4.178 20 0 HIADHN Cc1ccc(COc2ccc(CNCc3cccnc3N3CCN(C)CC3)cc2)cc1 ZINC000520962440 928892199 /nfs/dbraw/zinc/89/21/99/928892199.db2.gz CRNWPXUSIIUZNW-UHFFFAOYSA-N 0 3 416.569 4.011 20 0 HIADHN CN(C)c1ncc(CNCc2ccccc2-c2ccc(Cn3cccn3)cc2)s1 ZINC000520965043 928892886 /nfs/dbraw/zinc/89/28/86/928892886.db2.gz RVXVZMFXSLPLSW-UHFFFAOYSA-N 0 3 403.555 4.411 20 0 HIADHN CCOc1cc(CNC2(c3ccccc3)CC2)ccc1OCC(=O)N1CCCCC1 ZINC000520992562 928910166 /nfs/dbraw/zinc/91/01/66/928910166.db2.gz CVSKIWDBRIBEJZ-UHFFFAOYSA-N 0 3 408.542 4.256 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)NCc1nc2cc(Cl)ccc2s1 ZINC000521015858 928932628 /nfs/dbraw/zinc/93/26/28/928932628.db2.gz MEDZWSQIIMEJAV-UHFFFAOYSA-N 0 3 420.941 4.362 20 0 HIADHN CC(C)Oc1ccccc1[C@H](C)NC(=O)N(CCN(C)C)Cc1cccc(F)c1 ZINC000521070455 928971961 /nfs/dbraw/zinc/97/19/61/928971961.db2.gz VWERNCLSACIDHW-SFHVURJKSA-N 0 3 401.526 4.447 20 0 HIADHN C[C@H](C(=O)N1CC=C(c2ccc(O)cc2)CC1)N1CCC(Cc2ccccc2)CC1 ZINC000521105601 928998333 /nfs/dbraw/zinc/99/83/33/928998333.db2.gz USDXFPPDFYJGJA-HXUWFJFHSA-N 0 3 404.554 4.351 20 0 HIADHN CN(CCNC(=O)N[C@H]1CCCc2cc(OC(F)F)ccc21)Cc1ccccc1 ZINC000521202207 929059321 /nfs/dbraw/zinc/05/93/21/929059321.db2.gz VMHVUBGUGRZGRK-FQEVSTJZSA-N 0 3 403.473 4.097 20 0 HIADHN COc1cc2c(cc1OC)CN(C(=O)CN1CCCCC[C@@H]1c1ccccc1)CC2 ZINC000521425920 929216040 /nfs/dbraw/zinc/21/60/40/929216040.db2.gz RQKWFBBCKBMITF-JOCHJYFZSA-N 0 3 408.542 4.206 20 0 HIADHN Cc1ccc([C@H](CNC(=O)COc2ccc(C(=O)c3ccccc3)cc2)N(C)C)cc1 ZINC000521488880 929248670 /nfs/dbraw/zinc/24/86/70/929248670.db2.gz BRWNSEHEEAINRM-DEOSSOPVSA-N 0 3 416.521 4.024 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Cc2csc(Cc3ccc(F)cc3)n2)N(C)C)cc1 ZINC000521488977 929248810 /nfs/dbraw/zinc/24/88/10/929248810.db2.gz JQIUMUNAAUXLOJ-NRFANRHFSA-N 0 3 411.546 4.143 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)N1CCn2cccc2[C@H]1c1ccccc1 ZINC000521524189 929274506 /nfs/dbraw/zinc/27/45/06/929274506.db2.gz JODNYCKYLSBHCM-ILBGXUMGSA-N 0 3 414.553 4.440 20 0 HIADHN O=C(NCc1cccnc1OC1CCCC1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000521533942 929279857 /nfs/dbraw/zinc/27/98/57/929279857.db2.gz SKDYOQJESNIXOR-FQEVSTJZSA-N 0 3 411.521 4.071 20 0 HIADHN O=C(NC1CCCC1)c1ccc(NC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)cc1 ZINC000521593073 929315351 /nfs/dbraw/zinc/31/53/51/929315351.db2.gz HUCRAYKJFAXGMQ-FQEVSTJZSA-N 0 3 423.532 4.349 20 0 HIADHN NS(=O)(=O)c1ccc2c(c1)CCC[C@@H]2N[C@@H]1CCc2c1ccc(Cl)c2Cl ZINC000521595082 929316929 /nfs/dbraw/zinc/31/69/29/929316929.db2.gz QWTGHVZJJBJWOF-ZWKOTPCHSA-N 0 3 411.354 4.295 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)N[C@H]1CCSc2c(F)cccc21 ZINC000521685714 929365038 /nfs/dbraw/zinc/36/50/38/929365038.db2.gz IVKOPWGBMRCSPB-IBGZPJMESA-N 0 3 423.504 4.414 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N(C)C[C@@H]1CCCOC1)c1ccc(C(F)(F)F)cc1 ZINC000521696085 929370918 /nfs/dbraw/zinc/37/09/18/929370918.db2.gz FCTKSXSHXXSTJR-QFBILLFUSA-N 0 3 415.500 4.156 20 0 HIADHN CN(C)[C@@H](CNC(=O)CCCCOc1ccc(Br)cc1)c1ccccc1 ZINC000521751193 929413339 /nfs/dbraw/zinc/41/33/39/929413339.db2.gz VFXLUOJHPXXBPU-FQEVSTJZSA-N 0 3 419.363 4.417 20 0 HIADHN CC[C@@H](NC(=O)NCC1(N2CCOC(C)(C)C2)CCCCC1)c1nc(C)cs1 ZINC000521781405 929441849 /nfs/dbraw/zinc/44/18/49/929441849.db2.gz YHALGZYIKMYTHX-QGZVFWFLSA-N 0 3 408.612 4.016 20 0 HIADHN O=C1CCCN1c1cccc(CNCC2=Cc3cc(Br)ccc3OC2)c1 ZINC000521815031 929471794 /nfs/dbraw/zinc/47/17/94/929471794.db2.gz AGHYWRYNNICEDD-UHFFFAOYSA-N 0 3 413.315 4.142 20 0 HIADHN COc1cc(CNCc2cccc(-c3ccccc3C)c2)ccc1OCC(=O)N(C)C ZINC000521817703 929475780 /nfs/dbraw/zinc/47/57/80/929475780.db2.gz LYJQOEKPZUXJFN-UHFFFAOYSA-N 0 3 418.537 4.427 20 0 HIADHN Cc1ccc([C@@H](CNCc2ccccc2OCc2ccccc2)N2CCOCC2)o1 ZINC000521822665 929479439 /nfs/dbraw/zinc/47/94/39/929479439.db2.gz CGYXTXOLKKKEFO-HSZRJFAPSA-N 0 3 406.526 4.330 20 0 HIADHN CC(C)N(C)c1cccc(NC(=O)N(C)C2CCN(CCc3ccccn3)CC2)c1 ZINC000521898574 929543663 /nfs/dbraw/zinc/54/36/63/929543663.db2.gz NONJKZFUPVMRCE-UHFFFAOYSA-N 0 3 409.578 4.097 20 0 HIADHN O=C(CCc1nc2cc(Cl)ccc2s1)NCCCN1CCc2ccccc2C1 ZINC000521903017 929548354 /nfs/dbraw/zinc/54/83/54/929548354.db2.gz JPOLNJTYQOFDIB-UHFFFAOYSA-N 0 3 413.974 4.447 20 0 HIADHN CCOC(=O)c1c2c(sc1NC(=O)CC[C@@H]1CCCCO1)C(C)(C)NC(C)(C)C2 ZINC000521955619 929590446 /nfs/dbraw/zinc/59/04/46/929590446.db2.gz QPOYCYOAKZMAFZ-AWEZNQCLSA-N 0 3 422.591 4.372 20 0 HIADHN COCCN1CC[C@@H](NC(=O)N[C@H](C)c2ccccc2-c2ccc(Cl)cc2)C1 ZINC000524605419 929715860 /nfs/dbraw/zinc/71/58/60/929715860.db2.gz YJKSMMAZALFOGS-VQIMIIECSA-N 0 3 401.938 4.088 20 0 HIADHN CC1CCC(OC2CCN(C(=O)N[C@H]3CCCN(Cc4ccccc4)C3)CC2)CC1 ZINC000524614777 929724247 /nfs/dbraw/zinc/72/42/47/929724247.db2.gz ZMXFWMXFUCMYRG-APKLWFBNSA-N 0 3 413.606 4.420 20 0 HIADHN CC[C@H](NC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C)c1ccc2c(c1)OCCO2 ZINC000524630015 929739278 /nfs/dbraw/zinc/73/92/78/929739278.db2.gz SZMPFVAUOBOHSB-UGKGYDQZSA-N 0 3 423.557 4.215 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)c3cccc(C(F)F)c3)CC2)c1 ZINC000524652861 929765595 /nfs/dbraw/zinc/76/55/95/929765595.db2.gz FXWWZYGFMFVTPC-UHFFFAOYSA-N 0 3 401.501 4.265 20 0 HIADHN CCN(CC)C(=O)COc1ccc(NC(=O)[C@H](C(C)C)N2CCCCC2)cc1Cl ZINC000524705899 929805769 /nfs/dbraw/zinc/80/57/69/929805769.db2.gz XYQVRWHVQHQCDX-NRFANRHFSA-N 0 3 423.985 4.036 20 0 HIADHN CN(C)CCN(CC1CCCCC1)C(=O)c1ccc(Oc2ccc(C(N)=O)cc2)cc1 ZINC000524709085 929806370 /nfs/dbraw/zinc/80/63/70/929806370.db2.gz MGOFRLXCILOKJC-UHFFFAOYSA-N 0 3 423.557 4.162 20 0 HIADHN CC[C@@H](Cc1ccccc1)N(C)CC(=O)N1CCC[C@H]1c1ccc(OC)cc1OC ZINC000524758181 929820747 /nfs/dbraw/zinc/82/07/47/929820747.db2.gz DZUJLGCBBBIVAM-REWPJTCUSA-N 0 3 410.558 4.320 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2ccc(O[C@@H]3CCOC3)cc2)N2CCCC2)cc1 ZINC000524799537 929833667 /nfs/dbraw/zinc/83/36/67/929833667.db2.gz HAHTUJVUWUKABU-DHIUTWEWSA-N 0 3 409.530 4.121 20 0 HIADHN Cc1c2cc(F)ccc2oc1C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000524836218 929852572 /nfs/dbraw/zinc/85/25/72/929852572.db2.gz MQOQTYFCVFLZIT-UHFFFAOYSA-N 0 3 414.452 4.293 20 0 HIADHN COc1ccc(SCCC(=O)NC[C@@H](c2cccs2)N2CCCC2)cc1OC ZINC000524855998 929860559 /nfs/dbraw/zinc/86/05/59/929860559.db2.gz GNZLGJJTUSCQJW-KRWDZBQOSA-N 0 3 420.600 4.201 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)c1cnn(Cc2ccccc2Cl)c1 ZINC000524864214 929863994 /nfs/dbraw/zinc/86/39/94/929863994.db2.gz FLWKVPSVUJGMDV-IBGZPJMESA-N 0 3 422.960 4.321 20 0 HIADHN CC[C@H](C)n1ncc2c1nc(C)cc2C(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C ZINC000524866847 929865266 /nfs/dbraw/zinc/86/52/66/929865266.db2.gz JZCWNYMSBVVKNK-PMACEKPBSA-N 0 3 419.573 4.447 20 0 HIADHN Cc1cc(C(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)c(C)n1Cc1ccccn1 ZINC000524875750 929868282 /nfs/dbraw/zinc/86/82/82/929868282.db2.gz RRTIHQCYXZMOEP-NRFANRHFSA-N 0 3 416.569 4.285 20 0 HIADHN CCCN(CC(=O)Nc1ccc(OC(F)F)c(Cl)c1)[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000524893814 929876548 /nfs/dbraw/zinc/87/65/48/929876548.db2.gz PAOLLPXEWXWJNN-FSPWUOQZSA-N 0 3 416.896 4.405 20 0 HIADHN CC1CCN([C@H](CNC(=O)c2ccccc2Cn2cccn2)c2cccs2)CC1 ZINC000524967570 929932118 /nfs/dbraw/zinc/93/21/18/929932118.db2.gz HPOADVPLFWZQMG-OAQYLSRUSA-N 0 3 408.571 4.196 20 0 HIADHN CN(C)Cc1cccc(C(=O)Nc2ccc(CC(=O)Nc3ccccc3F)cc2)c1 ZINC000524973471 929938420 /nfs/dbraw/zinc/93/84/20/929938420.db2.gz XCPPSANJLPIOJV-UHFFFAOYSA-N 0 3 405.473 4.321 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)c3cccc4ccc(C)nc43)CC2)c1 ZINC000524973790 929938942 /nfs/dbraw/zinc/93/89/42/929938942.db2.gz KGIPIWZSHJMEOB-UHFFFAOYSA-N 0 3 416.569 4.184 20 0 HIADHN CN(C)Cc1cccc(C(=O)N2CCO[C@@H](c3cc(F)c(Cl)cc3Cl)C2)c1 ZINC000524978074 929943179 /nfs/dbraw/zinc/94/31/79/929943179.db2.gz ZJGLNOVSKLBYPH-LJQANCHMSA-N 0 3 411.304 4.408 20 0 HIADHN CCCc1c(C(=O)N2CC[C@H](N3CCCCC3)C2)nnn1-c1cccc(C(C)C)c1 ZINC000525059663 930009920 /nfs/dbraw/zinc/00/99/20/930009920.db2.gz KMNNHLVZMWEZQZ-NRFANRHFSA-N 0 3 409.578 4.044 20 0 HIADHN CCN1CCN(CCNC(=O)c2ccc(F)cc2-c2ccc(Cl)c(Cl)c2)CC1 ZINC000525062780 930011355 /nfs/dbraw/zinc/01/13/55/930011355.db2.gz YATQPBSOVHJHKH-UHFFFAOYSA-N 0 3 424.347 4.167 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1ccc(CNC(=O)C(C)(C)C)cc1)c1ccsc1 ZINC000525062729 930011410 /nfs/dbraw/zinc/01/14/10/930011410.db2.gz YJCIUOJULKKFCY-FQEVSTJZSA-N 0 3 415.603 4.223 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2cccc3ccccc32)cc1)[C@@H]1CCCN(C)C1 ZINC000525066576 930013439 /nfs/dbraw/zinc/01/34/39/930013439.db2.gz TZPVJEJJYDTWRF-OAQYLSRUSA-N 0 3 401.510 4.258 20 0 HIADHN Cc1cccc([C@H]2CCCN2CC(=O)N2CCC(C(=O)Nc3ccccc3)CC2)c1C ZINC000525125896 930050040 /nfs/dbraw/zinc/05/00/40/930050040.db2.gz KQVKYYONTWOHEA-XMMPIXPASA-N 0 3 419.569 4.318 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)NCCc1ccc2c(c1)OCCO2)c1cccc2ccccc21 ZINC000525248804 930105835 /nfs/dbraw/zinc/10/58/35/930105835.db2.gz AVQOJTNXUGGZKA-MSOLQXFVSA-N 0 3 404.510 4.009 20 0 HIADHN COc1ccc(SCCC(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)cc1OC ZINC000525338919 930176166 /nfs/dbraw/zinc/17/61/66/930176166.db2.gz JTUNQSSODBTIRR-IEBWSBKVSA-N 0 3 414.571 4.138 20 0 HIADHN Cc1ccc(S[C@H](C)C(=O)NC2CCN(CCOc3ccc(F)cc3)CC2)cc1 ZINC000525351857 930190819 /nfs/dbraw/zinc/19/08/19/930190819.db2.gz NMXDHDNWWCJAJF-GOSISDBHSA-N 0 3 416.562 4.274 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)Cc1csc(-c2ccccc2)n1 ZINC000525384961 930211617 /nfs/dbraw/zinc/21/16/17/930211617.db2.gz NGIQLTXRDNLHFZ-IBGZPJMESA-N 0 3 405.567 4.476 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)NC[C@H]1CCCO[C@@H]1C(C)(C)C ZINC000525394450 930215922 /nfs/dbraw/zinc/21/59/22/930215922.db2.gz QYPQOAATDXHJOB-FCEUIQTBSA-N 0 3 401.595 4.134 20 0 HIADHN CC(=O)Nc1ccc(Cl)c(NC(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)c1 ZINC000525416658 930228808 /nfs/dbraw/zinc/22/88/08/930228808.db2.gz SNOSJBLDSWLTJI-INIZCTEOSA-N 0 3 414.937 4.427 20 0 HIADHN Cc1ccc(OCCCCNC(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)cc1 ZINC000525421214 930231488 /nfs/dbraw/zinc/23/14/88/930231488.db2.gz JXFZBRFNTSXLHS-QFIPXVFZSA-N 0 3 409.574 4.460 20 0 HIADHN Cc1ccccc1-c1cc(C(=O)N(C)[C@H]2CCCN(C)C2)c2cnn(C(C)C)c2n1 ZINC000525525633 930302275 /nfs/dbraw/zinc/30/22/75/930302275.db2.gz VIHFUNLYXCLPIK-SFHVURJKSA-N 0 3 405.546 4.154 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)CC(C)(C)c2ccccc2)cc1)[C@@H]1CCCN(C)C1 ZINC000525579123 930341911 /nfs/dbraw/zinc/34/19/11/930341911.db2.gz AVBJUIFISDWQHF-JOCHJYFZSA-N 0 3 407.558 4.159 20 0 HIADHN CC(C)OCc1ccc(C(=O)Nc2ccc(C(=O)N(C)[C@@H]3CCCN(C)C3)cc2)cc1 ZINC000525580456 930343691 /nfs/dbraw/zinc/34/36/91/930343691.db2.gz VTTJECWANGLMCT-HSZRJFAPSA-N 0 3 423.557 4.030 20 0 HIADHN CCn1cc(C(=O)Nc2ccc(C(=O)N(C)[C@H]3CCCN(C)C3)cc2)c2ccccc21 ZINC000525615111 930363103 /nfs/dbraw/zinc/36/31/03/930363103.db2.gz ZGCSTLFMXQJMED-FQEVSTJZSA-N 0 3 418.541 4.080 20 0 HIADHN Cc1c(N[C@@H](C)C(C)C)cccc1C(=O)NCc1ccc(CN2CCN(C)CC2)cc1 ZINC000525620565 930367890 /nfs/dbraw/zinc/36/78/90/930367890.db2.gz ZIOAPIBDQBYQJX-NRFANRHFSA-N 0 3 422.617 4.129 20 0 HIADHN Cc1cccc([C@@H]2CCCN2CC(=O)NCC2(c3ccccc3)CCOCC2)c1C ZINC000525639579 930378059 /nfs/dbraw/zinc/37/80/59/930378059.db2.gz PLUIQNDEVAUFTH-DEOSSOPVSA-N 0 3 406.570 4.305 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(OC(F)F)cc1)c1ccc(OCC(=O)NC2CC2)cc1 ZINC000525760704 930434443 /nfs/dbraw/zinc/43/44/43/930434443.db2.gz BJBHCGOLVSFUAO-GJZGRUSLSA-N 0 3 404.457 4.357 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)N1CCC(OCC2CCCCC2)CC1 ZINC000525765255 930436270 /nfs/dbraw/zinc/43/62/70/930436270.db2.gz OSNAFSOMXKNLHW-QHCPKHFHSA-N 0 3 413.606 4.422 20 0 HIADHN C[C@H]1CCN(C(=O)NCc2ncc(-c3ccccc3)o2)CCN1Cc1ccccc1 ZINC000525767295 930436797 /nfs/dbraw/zinc/43/67/97/930436797.db2.gz PUGBSWIYVKRVOZ-IBGZPJMESA-N 0 3 404.514 4.148 20 0 HIADHN C[C@H](NC(=O)CC1(N2CCOCC2)CCCC1)C(c1ccccc1)c1ccccc1 ZINC000525823968 930458135 /nfs/dbraw/zinc/45/81/35/930458135.db2.gz UMBYJOGBUWPSEV-NRFANRHFSA-N 0 3 406.570 4.358 20 0 HIADHN CC(C)(C)OC(=O)CCc1cccc(NC(=O)[C@@H]2CCCN(Cc3cccnc3)C2)c1 ZINC000525942812 930491633 /nfs/dbraw/zinc/49/16/33/930491633.db2.gz DZXRHEUVAAJHLT-OAQYLSRUSA-N 0 3 423.557 4.207 20 0 HIADHN COc1ccc([C@@H](CNc2nnc(Cc3ccc(F)cc3)s2)N(C)C)cc1OC ZINC000525960529 930496026 /nfs/dbraw/zinc/49/60/26/930496026.db2.gz PBNAVEDBRVVYOE-QGZVFWFLSA-N 0 3 416.522 4.000 20 0 HIADHN COc1ccc2c(c1)CCC[C@@H]2N[C@H]1CCCN(Cc2ccc(F)cc2F)C1=O ZINC000526047974 930514807 /nfs/dbraw/zinc/51/48/07/930514807.db2.gz DRGWIMKKULWLPX-VXKWHMMOSA-N 0 3 400.469 4.132 20 0 HIADHN CC(C)(CNC(=O)[C@@H]1CCCN(Cc2cccnc2)C1)c1ccc(C(F)(F)F)cc1 ZINC000526062847 930516922 /nfs/dbraw/zinc/51/69/22/930516922.db2.gz ONTXOEMTKUWWFY-GOSISDBHSA-N 0 3 419.491 4.406 20 0 HIADHN CC[C@H](N[C@H]1CCC[C@@H](S(C)(=O)=O)C1)c1ccc(Br)cc1Cl ZINC000526117034 930538548 /nfs/dbraw/zinc/53/85/48/930538548.db2.gz PQQBJLXWOJPRJM-ZENOOKHLSA-N 0 3 408.789 4.499 20 0 HIADHN C[C@H](CC(=O)Nc1ccc(Br)cc1)N[C@@H]1CCOc2ccc(F)cc21 ZINC000527099698 930588803 /nfs/dbraw/zinc/58/88/03/930588803.db2.gz APKYMQAAKZNELB-SJKOYZFVSA-N 0 3 407.283 4.419 20 0 HIADHN C[C@H](CC(=O)Nc1ccc(NC(=O)C2CC2)cc1)N[C@@H]1CCOc2ccc(F)cc21 ZINC000527099719 930589666 /nfs/dbraw/zinc/58/96/66/930589666.db2.gz IDYJEURWNXLZFD-JLTOFOAXSA-N 0 3 411.477 4.005 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CN[C@H](CCn1cncn1)c1ccc(C)cc1 ZINC000527348617 930643538 /nfs/dbraw/zinc/64/35/38/930643538.db2.gz CPFVTUSNFKZTLI-XMMPIXPASA-N 0 3 400.530 4.310 20 0 HIADHN Cc1nn(-c2ccccc2)c(Oc2ccc(F)cc2)c1CNCCc1cnccn1 ZINC000530280930 930675165 /nfs/dbraw/zinc/67/51/65/930675165.db2.gz JCTDGOBZRLKIMA-UHFFFAOYSA-N 0 3 403.461 4.234 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)CO[C@H]3CCC[C@@H](C)C3)c(OCC)c2)CC1 ZINC000530348026 930688809 /nfs/dbraw/zinc/68/88/09/930688809.db2.gz CFTWTPDKVBHEPY-CTNGQTDRSA-N 0 3 417.594 4.151 20 0 HIADHN Cc1ccc(NC(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)c(OC[C@@H]2CCCO2)c1 ZINC000530357008 930692852 /nfs/dbraw/zinc/69/28/52/930692852.db2.gz AQQUGBRVOSPPOT-XKCSPQBFSA-N 0 3 409.530 4.120 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2cnn(Cc3ccc(Cl)cc3)c2)[C@H]1c1ccccc1 ZINC000530512911 930731071 /nfs/dbraw/zinc/73/10/71/930731071.db2.gz OVYFXQSNTGAXAD-NHCUHLMSSA-N 0 3 409.921 4.152 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2cc(N3CCCC3=O)ccc2Cl)[C@H]1c1ccccc1 ZINC000530515851 930735151 /nfs/dbraw/zinc/73/51/51/930735151.db2.gz CSOCQWYQRCNLMX-GHTZIAJQSA-N 0 3 412.921 4.034 20 0 HIADHN COc1ccc2nc(CN[C@H]3CCN(C4CC4)[C@@H]3c3cccc(OC)c3)sc2c1 ZINC000530545686 930742354 /nfs/dbraw/zinc/74/23/54/930742354.db2.gz KMMVSAYHDFQHBS-NZQKXSOJSA-N 0 3 409.555 4.381 20 0 HIADHN COc1cc(-c2nc(-c3ccc(CN(C)C)cc3)no2)cc(OC)c1Br ZINC000530632922 930779646 /nfs/dbraw/zinc/77/96/46/930779646.db2.gz CLAVPCOHSUUAAG-UHFFFAOYSA-N 0 3 418.291 4.245 20 0 HIADHN CN(C)Cc1ccc(-c2noc([C@H]3CCCN(C(=O)c4ccc(Cl)cc4)C3)n2)cc1 ZINC000530632707 930780231 /nfs/dbraw/zinc/78/02/31/930780231.db2.gz FBFFOHZFKCMUJW-IBGZPJMESA-N 0 3 424.932 4.471 20 0 HIADHN COc1ccc(-c2nc(C(=O)Nc3cc(CN(C)C)ccc3C)cs2)cc1OC ZINC000530658924 930788736 /nfs/dbraw/zinc/78/87/36/930788736.db2.gz MMFWKTQOAYGLPD-UHFFFAOYSA-N 0 3 411.527 4.450 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)c2cc(F)cc(Br)c2)CC1 ZINC000530679994 930796576 /nfs/dbraw/zinc/79/65/76/930796576.db2.gz MZUHRDLFJLYYMU-UHFFFAOYSA-N 0 3 405.311 4.325 20 0 HIADHN CN(C[C@H](O)COC[C@H]1CCCO1)[C@H](c1ccc(F)cc1)c1ccc(Cl)cc1 ZINC000530901571 930854405 /nfs/dbraw/zinc/85/44/05/930854405.db2.gz QOEKLQRUMGTWBD-BDTNDASRSA-N 0 3 407.913 4.057 20 0 HIADHN CCC[C@H](N[C@@H](C)CC(=O)Nc1ccccc1)C(=O)Nc1cccc(N2CCCC2)c1 ZINC000530907396 930855034 /nfs/dbraw/zinc/85/50/34/930855034.db2.gz JYIVOIYWEYATOV-CVDCTZTESA-N 0 3 422.573 4.401 20 0 HIADHN CCN(CC)[C@H](C(=O)N1CCC(c2cnc[nH]2)CC1)c1cccc(C(F)(F)F)c1 ZINC000530958202 930868609 /nfs/dbraw/zinc/86/86/09/930868609.db2.gz GGXHVWQSBIPIBV-IBGZPJMESA-N 0 3 408.468 4.218 20 0 HIADHN O=C(Nc1cc(F)ccc1OCC(F)(F)F)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000530988087 930877840 /nfs/dbraw/zinc/87/78/40/930877840.db2.gz OERQLXJNPLUOHM-HNNXBMFYSA-N 0 3 411.399 4.013 20 0 HIADHN O=C(CC1(N2CCOCC2)CCCC1)N[C@@H](c1cccs1)c1ccc(F)cc1 ZINC000531051444 930898175 /nfs/dbraw/zinc/89/81/75/930898175.db2.gz DJPTUIIOVBLUBF-OAQYLSRUSA-N 0 3 402.535 4.128 20 0 HIADHN Cc1ccc(C(=O)CCC(=O)CCc2nc(-c3ccc(CN(C)C)cc3)no2)s1 ZINC000531109872 930923454 /nfs/dbraw/zinc/92/34/54/930923454.db2.gz DTHKBKMCCSQANC-UHFFFAOYSA-N 0 3 411.527 4.333 20 0 HIADHN CS(=O)(=O)c1ccc(OCCCN[C@@H](c2ccccc2)c2ccc(F)cc2)cc1 ZINC000531142069 930941179 /nfs/dbraw/zinc/94/11/79/930941179.db2.gz JORZYFVCQJTCDS-QHCPKHFHSA-N 0 3 413.514 4.377 20 0 HIADHN CC[C@@H](C)NC(=O)c1cccc(CNCc2ccc(OC)c3oc(C(=O)OC)cc32)c1 ZINC000531142549 930943887 /nfs/dbraw/zinc/94/38/87/930943887.db2.gz ODWWWOSTXKESBB-OAHLLOKOSA-N 0 3 424.497 4.046 20 0 HIADHN Cc1cc([C@H](C)NC(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)c(C)s1 ZINC000531183495 930955718 /nfs/dbraw/zinc/95/57/18/930955718.db2.gz FAGJWWZQYATDBZ-NUJGCVRESA-N 0 3 407.624 4.347 20 0 HIADHN CN1CCN(c2ccncc2NC(=O)c2cc(C3CC3)nc3ccc(Cl)cc32)CC1 ZINC000531192031 930959441 /nfs/dbraw/zinc/95/94/41/930959441.db2.gz SQILDGHRJYQQSO-UHFFFAOYSA-N 0 3 421.932 4.165 20 0 HIADHN CCNC(=O)COc1cccc(CNCC2=Cc3cc(Cl)cc(Cl)c3OC2)c1 ZINC000531206950 930966437 /nfs/dbraw/zinc/96/64/37/930966437.db2.gz MYTVYLNPGLMSHW-UHFFFAOYSA-N 0 3 421.324 4.074 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)c1ccc(Oc2ccccc2Cl)nc1 ZINC000531313757 931012182 /nfs/dbraw/zinc/01/21/82/931012182.db2.gz MUBPQKXVLOUQGW-UHFFFAOYSA-N 0 3 410.905 4.126 20 0 HIADHN O=C(NC[C@H](Cc1ccccc1)c1ccccc1)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000531389271 931040627 /nfs/dbraw/zinc/04/06/27/931040627.db2.gz KQHJTTNDPGTSJK-FTJBHMTQSA-N 0 3 413.565 4.436 20 0 HIADHN CCCC(=O)Nc1cccc(CNC(=O)N(Cc2ccccc2)C2CCN(C)CC2)c1 ZINC000531399603 931044112 /nfs/dbraw/zinc/04/41/12/931044112.db2.gz DJEIWMIRPTUUFF-UHFFFAOYSA-N 0 3 422.573 4.231 20 0 HIADHN C[C@@H](NC(=O)N1CCCN(Cc2ccccc2)CC1)c1cccc(N2CCCC2)c1 ZINC000531504458 931081539 /nfs/dbraw/zinc/08/15/39/931081539.db2.gz AJLTUSORCRYXLR-OAQYLSRUSA-N 0 3 406.574 4.265 20 0 HIADHN C[C@@H](O)C[C@@H](CNCc1nc(-c2cccc(Br)c2)c[nH]1)c1ccccc1 ZINC000531582090 931109246 /nfs/dbraw/zinc/10/92/46/931109246.db2.gz WIMZRZGLSPIIBP-QAPCUYQASA-N 0 3 414.347 4.484 20 0 HIADHN O=C(N[C@@H](c1cccc(Cl)c1)c1ccccn1)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000531618421 931129553 /nfs/dbraw/zinc/12/95/53/931129553.db2.gz IBXXOBAMHCOHRL-REWPJTCUSA-N 0 3 420.944 4.248 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@H](C)N[C@H]2CCCc3nc(C)sc32)cc1 ZINC000531677059 931148032 /nfs/dbraw/zinc/14/80/32/931148032.db2.gz WHFMZPGSULSECV-KSSFIOAISA-N 0 3 407.605 4.210 20 0 HIADHN O=C(Nc1ccc2[nH]c([C@@H]3CCCO3)nc2c1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000531681216 931149977 /nfs/dbraw/zinc/14/99/77/931149977.db2.gz YKMGDDUKGOZVPW-VGSWGCGISA-N 0 3 422.504 4.404 20 0 HIADHN COc1ccccc1-c1ccc([C@H](C)NCc2ccc(N3CCN(C)CC3)nc2)cc1 ZINC000531687510 931152789 /nfs/dbraw/zinc/15/27/89/931152789.db2.gz DDJKDYKYRGKUSF-FQEVSTJZSA-N 0 3 416.569 4.360 20 0 HIADHN CC(C)CCOc1ccc([C@@H](C)NCc2ccc(C(=O)N3CCOCC3)cc2)cc1 ZINC000531697821 931161353 /nfs/dbraw/zinc/16/13/53/931161353.db2.gz JZSVOJIXFKUCHD-HXUWFJFHSA-N 0 3 410.558 4.435 20 0 HIADHN Cc1ccc(OC(F)F)c([C@@H](C)N[C@H](CN2CCN(C)CC2)c2ccccc2)c1 ZINC000531710732 931169864 /nfs/dbraw/zinc/16/98/64/931169864.db2.gz VNIOGUXPMOJEOW-WIYYLYMNSA-N 0 3 403.517 4.236 20 0 HIADHN CC(C)(C)c1nn(-c2ccccc2)cc1CN[C@@H]1CCN(C(=O)C2CCCCC2)C1 ZINC000531863892 931225763 /nfs/dbraw/zinc/22/57/63/931225763.db2.gz SICMUTUPEFIVJL-OAQYLSRUSA-N 0 3 408.590 4.441 20 0 HIADHN Cc1cc(CNCc2ccc(C(=O)Nc3ccc(F)cc3)cc2)ccc1-n1cncn1 ZINC000531863284 931226710 /nfs/dbraw/zinc/22/67/10/931226710.db2.gz BLOODVPWIWWUED-UHFFFAOYSA-N 0 3 415.472 4.257 20 0 HIADHN CCOc1ccc([C@@H](CNC(=O)[C@H](CC)N(C)C)c2c[nH]c3ccccc32)cc1OC ZINC000531932795 931250856 /nfs/dbraw/zinc/25/08/56/931250856.db2.gz MJOCMZPURAJJOR-KNQAVFIVSA-N 0 3 423.557 4.164 20 0 HIADHN COc1cc([C@@H](C)NCc2ccccc2CN2CCCC2=O)ccc1OC(F)F ZINC000531939667 931255057 /nfs/dbraw/zinc/25/50/57/931255057.db2.gz WFFQAGIQQXWEOW-OAHLLOKOSA-N 0 3 404.457 4.270 20 0 HIADHN COc1cc([C@@H](C)N[C@H](C)c2ccc(S(=O)(=O)N(C)C)cc2)ccc1OC(C)C ZINC000531944784 931256985 /nfs/dbraw/zinc/25/69/85/931256985.db2.gz KSVPPHSJJMRBPK-IAGOWNOFSA-N 0 3 420.575 4.145 20 0 HIADHN C[C@@H](NCc1ccc(-n2ccc(C(F)(F)F)n2)cc1)c1ccc([S@](C)=O)cc1 ZINC000531948707 931259909 /nfs/dbraw/zinc/25/99/09/931259909.db2.gz FYIJDGMXKRNBQQ-SUMNFNSASA-N 0 3 407.461 4.479 20 0 HIADHN CC[C@@H](N[C@@H](C)c1ccc(-n2ccnc2C)cc1)c1ccccc1OCC(=O)N(C)C ZINC000531955571 931263232 /nfs/dbraw/zinc/26/32/32/931263232.db2.gz AJJZZPLAZUMDQF-FDDCHVKYSA-N 0 3 420.557 4.450 20 0 HIADHN COc1ccc([C@@H](C)NCc2ccccc2CS(=O)(=O)NC(C)C)cc1Cl ZINC000531958227 931264605 /nfs/dbraw/zinc/26/46/05/931264605.db2.gz UHRBDRWMROIFKO-OAHLLOKOSA-N 0 3 410.967 4.027 20 0 HIADHN CSc1ccc([C@@H](C)NCc2ccccc2N2CCN(C(C)=O)CC2)cc1F ZINC000531961382 931266353 /nfs/dbraw/zinc/26/63/53/931266353.db2.gz FURLUPZQPYNSOI-MRXNPFEDSA-N 0 3 401.551 4.067 20 0 HIADHN CSc1ccc([C@H](C)NCc2ccccc2N2CCN(C(C)=O)CC2)cc1F ZINC000531961381 931266557 /nfs/dbraw/zinc/26/65/57/931266557.db2.gz FURLUPZQPYNSOI-INIZCTEOSA-N 0 3 401.551 4.067 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)cc1 ZINC000531963834 931267282 /nfs/dbraw/zinc/26/72/82/931267282.db2.gz BDLBWHFBFFBUPR-YADARESESA-N 0 3 402.542 4.065 20 0 HIADHN C[C@@H](N[C@H](CN1CCN(C)CC1)c1ccccc1)c1ccc(F)cc1Br ZINC000531965885 931268682 /nfs/dbraw/zinc/26/86/82/931268682.db2.gz RCDCTZZCKAZMST-IIBYNOLFSA-N 0 3 420.370 4.228 20 0 HIADHN CCC[C@H](N[C@@H](C)c1ccc2c(c1)OCCCO2)C(=O)N1CCc2sccc2C1 ZINC000531965756 931268705 /nfs/dbraw/zinc/26/87/05/931268705.db2.gz SMYKFVCJJNRTRY-LPHOPBHVSA-N 0 3 414.571 4.314 20 0 HIADHN COc1cc(C[C@H](CO)CN[C@@H](C)c2sccc2Br)cc(OC)c1 ZINC000531994811 931279133 /nfs/dbraw/zinc/27/91/33/931279133.db2.gz QJZGZPVNZZWDTB-JSGCOSHPSA-N 0 3 414.365 4.030 20 0 HIADHN CSCc1cc(F)ccc1CNC(=O)N(CCN(C)C)Cc1cccc(F)c1 ZINC000532038416 931293937 /nfs/dbraw/zinc/29/39/37/931293937.db2.gz ZWJLZPRFIQRNOR-UHFFFAOYSA-N 0 3 407.530 4.101 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)c1cccc(-n2ccc(C(F)(F)F)n2)c1 ZINC000532109308 931315983 /nfs/dbraw/zinc/31/59/83/931315983.db2.gz PPCDFIQGSVNNNK-UHFFFAOYSA-N 0 3 418.419 4.214 20 0 HIADHN O=C(C1CCCCC1)N1CC[C@H](NCc2cc3ccccc3nc2N2CCCCC2)C1 ZINC000532119780 931319951 /nfs/dbraw/zinc/31/99/51/931319951.db2.gz AJCJRFPRBWHPOM-QHCPKHFHSA-N 0 3 420.601 4.496 20 0 HIADHN O=C([C@H]1CCCN(Cc2cccnc2)C1)N1CCCC[C@H]1c1nc2ccccc2o1 ZINC000532153916 931329602 /nfs/dbraw/zinc/32/96/02/931329602.db2.gz WZLZGQZGMMNMGS-FPOVZHCZSA-N 0 3 404.514 4.189 20 0 HIADHN COc1ccccc1[C@@H](C)N(C)C(=O)CN(Cc1ccccc1)CC1CCOCC1 ZINC000532161260 931333109 /nfs/dbraw/zinc/33/31/09/931333109.db2.gz TXBINYRHRQSALY-HXUWFJFHSA-N 0 3 410.558 4.143 20 0 HIADHN COc1cc(CN[C@H](C)c2ccc(OCc3nccn3C)cc2)ccc1OC(F)F ZINC000532200649 931347032 /nfs/dbraw/zinc/34/70/32/931347032.db2.gz DSROQPBMGXWNMF-OAHLLOKOSA-N 0 3 417.456 4.460 20 0 HIADHN C[C@@H](NC[C@H](c1ccccc1Cl)N1CCCC1)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000532204375 931349351 /nfs/dbraw/zinc/34/93/51/931349351.db2.gz ZFLOPOVWKKASNA-FOIQADDNSA-N 0 3 424.969 4.370 20 0 HIADHN Cc1cc(C)c2c(c1)[C@H](NCc1ccc(CS(=O)(=O)NC(C)C)cc1)CCCO2 ZINC000532207321 931351403 /nfs/dbraw/zinc/35/14/03/931351403.db2.gz RHABQGIKJNEKFR-JOCHJYFZSA-N 0 3 416.587 4.135 20 0 HIADHN C[C@H](NCc1ccc(C(=O)N2CCOCC2)cc1)c1ccc(SCC(F)F)cc1 ZINC000532209455 931351953 /nfs/dbraw/zinc/35/19/53/931351953.db2.gz IJSAHDQTSCADGW-INIZCTEOSA-N 0 3 420.525 4.367 20 0 HIADHN C[C@@H](NCc1ccc(NC(=O)c2ccncc2)cc1)c1ccc2c(c1)CCC(=O)N2 ZINC000532219665 931357950 /nfs/dbraw/zinc/35/79/50/931357950.db2.gz DKTYOFDTVZEMST-MRXNPFEDSA-N 0 3 400.482 4.069 20 0 HIADHN COc1ccccc1C[C@H](NCc1csc(CNC(=O)c2ccccc2)n1)C(C)C ZINC000532232366 931364206 /nfs/dbraw/zinc/36/42/06/931364206.db2.gz BWPLYLRDNDCJAP-NRFANRHFSA-N 0 3 423.582 4.439 20 0 HIADHN COc1cc(-c2noc(CN3CC[C@H](C)[C@@H]4CCCC[C@H]43)n2)cc(OC)c1OC ZINC000532266926 931376645 /nfs/dbraw/zinc/37/66/45/931376645.db2.gz QAPYPVRWQDUGPK-BHYGNILZSA-N 0 3 401.507 4.163 20 0 HIADHN C[C@H](O)C[C@H](CNCc1nc(-c2ccc(Br)cc2)c[nH]1)c1ccccc1 ZINC000532346427 931403472 /nfs/dbraw/zinc/40/34/72/931403472.db2.gz JQRCISPAMOIAIV-MAUKXSAKSA-N 0 3 414.347 4.484 20 0 HIADHN CC(C)c1ccc(C2(C(=O)N3CC[C@@H](N4CCN(C(C)C)CC4)C3)CCCC2)cc1 ZINC000532347733 931403788 /nfs/dbraw/zinc/40/37/88/931403788.db2.gz JPTIBSFKLLOUFN-XMMPIXPASA-N 0 3 411.634 4.249 20 0 HIADHN CC(C)N1CCN([C@@H]2CCN(C(=O)Nc3ccc4c(c3)oc3ccccc34)C2)CC1 ZINC000532350563 931404710 /nfs/dbraw/zinc/40/47/10/931404710.db2.gz GOUSMVDWVYIOFK-LJQANCHMSA-N 0 3 406.530 4.218 20 0 HIADHN FC(F)(F)Cn1cc(CNC2(c3cccc(Br)c3)CCOCC2)cn1 ZINC000532420638 931429416 /nfs/dbraw/zinc/42/94/16/931429416.db2.gz CHSZGUPZEDGTJT-UHFFFAOYSA-N 0 3 418.257 4.003 20 0 HIADHN C[C@H](NCCc1csc(-c2ccccc2)n1)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000532454300 931441791 /nfs/dbraw/zinc/44/17/91/931441791.db2.gz HVHJTJBLDJBKTF-AWEZNQCLSA-N 0 3 404.532 4.246 20 0 HIADHN C[C@@H](NCc1cccc(OCCN2CCOCC2)c1)c1ccccc1C(F)(F)F ZINC000532461654 931445691 /nfs/dbraw/zinc/44/56/91/931445691.db2.gz LHHOQHJIKXOFHF-QGZVFWFLSA-N 0 3 408.464 4.267 20 0 HIADHN CCCCOc1ccc([C@@H](C)N[C@H](C)c2ccc(S(=O)(=O)NC)cc2)cc1OC ZINC000532471939 931450516 /nfs/dbraw/zinc/45/05/16/931450516.db2.gz PIIFVLPCUUUYLM-IAGOWNOFSA-N 0 3 420.575 4.194 20 0 HIADHN CCCCOc1ccc([C@H](C)N[C@H](C)c2ccc(S(=O)(=O)NC)cc2)cc1OC ZINC000532471941 931450611 /nfs/dbraw/zinc/45/06/11/931450611.db2.gz PIIFVLPCUUUYLM-SJORKVTESA-N 0 3 420.575 4.194 20 0 HIADHN Cn1cc(CC(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)c2ccccc21 ZINC000532512532 931469407 /nfs/dbraw/zinc/46/94/07/931469407.db2.gz BBKUTZHJCXWQHD-NRFANRHFSA-N 0 3 413.525 4.003 20 0 HIADHN CCCN(CC(F)(F)F)C(=O)[C@@H]1CCCN(Cc2cnc(-c3ccccc3)nc2)C1 ZINC000532581113 931538457 /nfs/dbraw/zinc/53/84/57/931538457.db2.gz ILUQSICSACPPRH-LJQANCHMSA-N 0 3 420.479 4.157 20 0 HIADHN COc1ccc([C@H](Cc2ccc(F)cc2)N[C@H]2CCCN(CC(F)(F)F)C2=O)cc1 ZINC000532588286 931544832 /nfs/dbraw/zinc/54/48/32/931544832.db2.gz RLTPNRQBUCHHSK-PMACEKPBSA-N 0 3 424.438 4.261 20 0 HIADHN O=C(CN[C@H](c1ccc(F)cc1)C1CCC1)N1CCC[C@H]1c1ccc2c(c1)OCCO2 ZINC000532687632 931584855 /nfs/dbraw/zinc/58/48/55/931584855.db2.gz GVOPAZBYIOVOMG-OFVILXPXSA-N 0 3 424.516 4.391 20 0 HIADHN CCc1ccc(CCN2CCC(C(=O)c3ccc4c(c3)NC(=O)[C@@H](C)O4)CC2)cc1 ZINC000532690663 931587019 /nfs/dbraw/zinc/58/70/19/931587019.db2.gz NRIKBPKAAOETGM-QGZVFWFLSA-N 0 3 406.526 4.106 20 0 HIADHN O=C(CNC1(c2ccc(Cl)cc2)CCOCC1)NC12CC3CC(CC(C3)C1)C2 ZINC000532715095 931606201 /nfs/dbraw/zinc/60/62/01/931606201.db2.gz UGQKAPZSLVGAOZ-UHFFFAOYSA-N 0 3 402.966 4.020 20 0 HIADHN COc1ccc(CCNC(=O)CN[C@H](c2ccc(Cl)cc2)C(C)C)cc1OC ZINC000532770105 931627408 /nfs/dbraw/zinc/62/74/08/931627408.db2.gz FAPNCXWXBXWEGU-QFIPXVFZSA-N 0 3 404.938 4.003 20 0 HIADHN C[C@@H](NCc1cccc(NC(=O)CCN2CCOCC2)c1)c1ccccc1C(C)(C)C ZINC000532849887 931660461 /nfs/dbraw/zinc/66/04/61/931660461.db2.gz DXIXBUQHXKNZNG-HXUWFJFHSA-N 0 3 423.601 4.496 20 0 HIADHN CN1CCN(Cc2ccc(NCc3ccccc3OCc3ccncc3)cc2)CC1 ZINC000532890608 931681657 /nfs/dbraw/zinc/68/16/57/931681657.db2.gz AAQZNDQSOLLYDM-UHFFFAOYSA-N 0 3 402.542 4.020 20 0 HIADHN CCc1cccc(OCC(=O)Nc2c(C)cnn2[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000532910489 931688847 /nfs/dbraw/zinc/68/88/47/931688847.db2.gz FIZUWEHZPVBVTG-JOCHJYFZSA-N 0 3 418.541 4.218 20 0 HIADHN C[C@H]1CN(CC(=O)N2CCC(OCc3ccccc3)CC2)CC[C@H]1c1ccccc1 ZINC000532972483 931721386 /nfs/dbraw/zinc/72/13/86/931721386.db2.gz KTWGGZGDGGKZGW-SQJMNOBHSA-N 0 3 406.570 4.320 20 0 HIADHN C[C@H]1CN(CC(=O)N2CCC(OCc3ccccc3)CC2)CC[C@@H]1c1ccccc1 ZINC000532972480 931721680 /nfs/dbraw/zinc/72/16/80/931721680.db2.gz KTWGGZGDGGKZGW-OFVILXPXSA-N 0 3 406.570 4.320 20 0 HIADHN CC(C)N1CCN([C@@H]2CCN(Cc3csc(-c4ccc(Cl)cc4)n3)C2)CC1 ZINC000532986600 931727039 /nfs/dbraw/zinc/72/70/39/931727039.db2.gz HAGNRHQHGJDMKD-HXUWFJFHSA-N 0 3 405.011 4.064 20 0 HIADHN CC(C)n1c2ccccc2nc1[C@@H]1CCCN(CCn2cnc3ccccc3c2=O)C1 ZINC000533070354 931762524 /nfs/dbraw/zinc/76/25/24/931762524.db2.gz CHIBQQVDVGHYPD-LJQANCHMSA-N 0 3 415.541 4.207 20 0 HIADHN Cn1c(CNC[C@H](CO)Cc2ccc(C(F)(F)F)cc2)nc2cc(Cl)ccc21 ZINC000533106131 931772364 /nfs/dbraw/zinc/77/23/64/931772364.db2.gz JIFQIHAIZFAECA-CQSZACIVSA-N 0 3 411.855 4.186 20 0 HIADHN Cc1cnc(CCN(C)C(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)s1 ZINC000533179840 931803203 /nfs/dbraw/zinc/80/32/03/931803203.db2.gz INBZRCDGSAUNBP-KRWDZBQOSA-N 0 3 406.621 4.170 20 0 HIADHN O=C(NCCc1cc2ccccc2[nH]1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000533236065 931815896 /nfs/dbraw/zinc/81/58/96/931815896.db2.gz YDKPSVLEQYDION-JOCHJYFZSA-N 0 3 415.459 4.281 20 0 HIADHN CCCCN(CC(=O)N1CCC(NC(=O)c2ccccc2)CC1)[C@H](C)c1ccccc1 ZINC000533290022 931829857 /nfs/dbraw/zinc/82/98/57/931829857.db2.gz LPAXZIZXELVFGA-OAQYLSRUSA-N 0 3 421.585 4.271 20 0 HIADHN C[C@@H](NCc1ccc(Br)cn1)[C@@H](OC1CCOCC1)c1ccccc1 ZINC000533329129 931839805 /nfs/dbraw/zinc/83/98/05/931839805.db2.gz XBAUDINPSIGQJB-FOIQADDNSA-N 0 3 405.336 4.259 20 0 HIADHN CCC(CC)(NCC(=O)N1CCC(C(=O)OC)CC1)c1ccc(Cl)c(Cl)c1 ZINC000533383661 931854529 /nfs/dbraw/zinc/85/45/29/931854529.db2.gz DRJDHHCCHZFVDJ-UHFFFAOYSA-N 0 3 415.361 4.010 20 0 HIADHN Cc1nc(C(C)C)sc1C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000533397052 931857522 /nfs/dbraw/zinc/85/75/22/931857522.db2.gz DEVBGQSDJYITIN-GOSISDBHSA-N 0 3 409.559 4.471 20 0 HIADHN CC(C)[N@H+](C)CC1CCN(Cc2nc(=O)c3c(-c4ccco4)csc3[n-]2)CC1 ZINC000533408899 931860938 /nfs/dbraw/zinc/86/09/38/931860938.db2.gz LAXBLZOUTWNIKE-UHFFFAOYSA-N 0 3 400.548 4.209 20 0 HIADHN CC(C)[N@@H+](C)CC1CCN(Cc2nc(=O)c3c(-c4ccco4)csc3[n-]2)CC1 ZINC000533408899 931860941 /nfs/dbraw/zinc/86/09/41/931860941.db2.gz LAXBLZOUTWNIKE-UHFFFAOYSA-N 0 3 400.548 4.209 20 0 HIADHN CCN(CC(=O)Nc1ccc(N2CCCC2)cc1C)[C@@H](C)Cc1ccc(OC)cc1 ZINC000533418892 931862704 /nfs/dbraw/zinc/86/27/04/931862704.db2.gz QMZRTLIFCDMEEL-FQEVSTJZSA-N 0 3 409.574 4.495 20 0 HIADHN Cc1ccccc1[C@H]1C[C@H](C)N(CC(=O)N2CCC(OCc3ccccc3)CC2)C1 ZINC000533435113 931867727 /nfs/dbraw/zinc/86/77/27/931867727.db2.gz RTYANIYGXPLMHZ-GMAHTHKFSA-N 0 3 406.570 4.381 20 0 HIADHN Cc1ccccc1[C@H]1C[C@@H](C)N(CC(=O)N2CCC(OCc3ccccc3)CC2)C1 ZINC000533435112 931867906 /nfs/dbraw/zinc/86/79/06/931867906.db2.gz RTYANIYGXPLMHZ-GGAORHGYSA-N 0 3 406.570 4.381 20 0 HIADHN CCCCOc1ccc([C@H](C)N[C@H]2CCCN(CC(F)(F)F)C2=O)cc1OC ZINC000533449118 931872451 /nfs/dbraw/zinc/87/24/51/931872451.db2.gz MKDJZMGHSNWLSW-HOCLYGCPSA-N 0 3 402.457 4.078 20 0 HIADHN C[C@@H]1CC[C@H](C)[N@H+]1[C@@H]1CCCN(Cc2nc(=O)c3c(-c4ccco4)csc3[n-]2)C1 ZINC000533511662 931890060 /nfs/dbraw/zinc/89/00/60/931890060.db2.gz SMFZANVZOZGGLR-OWCLPIDISA-N 0 3 412.559 4.494 20 0 HIADHN C[C@@H]1CC[C@H](C)[N@@H+]1[C@@H]1CCCN(Cc2nc(=O)c3c(-c4ccco4)csc3[n-]2)C1 ZINC000533511662 931890065 /nfs/dbraw/zinc/89/00/65/931890065.db2.gz SMFZANVZOZGGLR-OWCLPIDISA-N 0 3 412.559 4.494 20 0 HIADHN CC[C@H](NCc1cc2c(cc1OC)C[C@H](C)O2)[C@H](c1ccc(C)cc1)n1cncn1 ZINC000533741797 932003313 /nfs/dbraw/zinc/00/33/13/932003313.db2.gz KNSMCSSXOKGJFW-JBUDQFAYSA-N 0 3 406.530 4.076 20 0 HIADHN Cc1cc(C)c(CC(C(=O)Nc2ccnc(C(=O)N(C)C)c2)C(F)(F)F)c(C)c1 ZINC000533763903 932018466 /nfs/dbraw/zinc/01/84/66/932018466.db2.gz PDDHSKRZIYQITD-QGZVFWFLSA-N 0 3 407.436 4.068 20 0 HIADHN C[C@H](NCCC1CCN(CC(F)(F)F)CC1)c1ncc(Br)s1 ZINC000533786383 932032812 /nfs/dbraw/zinc/03/28/12/932032812.db2.gz NRYFJXNKNNUZIA-JTQLQIEISA-N 0 3 400.308 4.221 20 0 HIADHN O=C([C@H]1CCCN(Cc2cccc(F)c2)C1)N(Cc1ccco1)Cc1cccnc1 ZINC000533805030 932039782 /nfs/dbraw/zinc/03/97/82/932039782.db2.gz MRJHEBXESZRCEV-NRFANRHFSA-N 0 3 407.489 4.255 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccc(O)cc1)C(=O)c1nc(C(C)C)ncc1Cl ZINC000533829964 932049563 /nfs/dbraw/zinc/04/95/63/932049563.db2.gz MVXIXZYYWCGHIR-KRWDZBQOSA-N 0 3 416.953 4.086 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccc(O)cc1)C(=O)c1cc(-c2ccccc2)no1 ZINC000533833774 932051513 /nfs/dbraw/zinc/05/15/13/932051513.db2.gz ZWHQQTCYBRVMOX-FQEVSTJZSA-N 0 3 405.498 4.174 20 0 HIADHN Cc1cccc(C(=O)N(Cc2ccccc2)C2CCN(C)CC2)c1Br ZINC000533844839 932057553 /nfs/dbraw/zinc/05/75/53/932057553.db2.gz KIFYNDBWOPDNGK-UHFFFAOYSA-N 0 3 401.348 4.494 20 0 HIADHN Cc1n[nH]c(C)c1[C@H](C)CC(=O)N(CCN(C)C)Cc1ccc(C(F)(F)F)cc1 ZINC000533872555 932073560 /nfs/dbraw/zinc/07/35/60/932073560.db2.gz OXZQSAJJNFDARH-CQSZACIVSA-N 0 3 410.484 4.129 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2cccc3c2CN(c2ccccn2)C3)N(C)C)cc1 ZINC000533882377 932078839 /nfs/dbraw/zinc/07/88/39/932078839.db2.gz ZUWVWFWKOXVIOM-HSZRJFAPSA-N 0 3 415.541 4.335 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1)c1ccc(OCC(F)(F)F)cc1 ZINC000533891451 932084797 /nfs/dbraw/zinc/08/47/97/932084797.db2.gz QKYRZTNPSXBVOY-BEVDRBHNSA-N 0 3 421.463 4.433 20 0 HIADHN C[C@H](NC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1)c1ccc(OCC(F)(F)F)cc1 ZINC000533891457 932085127 /nfs/dbraw/zinc/08/51/27/932085127.db2.gz QKYRZTNPSXBVOY-YSSFQJQWSA-N 0 3 421.463 4.433 20 0 HIADHN CN1CC[C@H](NC(=O)NCc2cccnc2Oc2cccc(F)c2)[C@H]1c1ccccc1 ZINC000533929568 932106509 /nfs/dbraw/zinc/10/65/09/932106509.db2.gz ZPHROISRCQGAEJ-FCHUYYIVSA-N 0 3 420.488 4.258 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)c2ccn(-c3cccc(Br)c3)n2)c1 ZINC000533966747 932142369 /nfs/dbraw/zinc/14/23/69/932142369.db2.gz GPZZKWOYKLHZJK-UHFFFAOYSA-N 0 3 413.319 4.257 20 0 HIADHN Cc1sc2ncnc(SCC(=O)Nc3cc(C)cc(CN(C)C)c3)c2c1C ZINC000533970917 932149380 /nfs/dbraw/zinc/14/93/80/932149380.db2.gz RAVWHTFIEBQGMA-UHFFFAOYSA-N 0 3 400.573 4.409 20 0 HIADHN CN1CC[C@H](NC(=O)Cc2c[nH]c3cc(Br)ccc23)[C@@H]1c1ccccc1 ZINC000534017742 932200277 /nfs/dbraw/zinc/20/02/77/932200277.db2.gz CORXPLOCXNRZSQ-RXVVDRJESA-N 0 3 412.331 4.035 20 0 HIADHN CNC(=O)[C@H](Cc1c[nH]c2ccccc12)N[C@H]1CCc2c1cc(Cl)cc2Cl ZINC000534059192 932237980 /nfs/dbraw/zinc/23/79/80/932237980.db2.gz KCKNWXDPIHYFKQ-PMACEKPBSA-N 0 3 402.325 4.409 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2cccc(-c3ccoc3)c2)cc1)[C@@H]1CCCN(C)C1 ZINC000534079150 932258103 /nfs/dbraw/zinc/25/81/03/932258103.db2.gz HZBXNKFPLIIQDB-HSZRJFAPSA-N 0 3 417.509 4.365 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2cccc(-c3ccoc3)c2)cc1)[C@H]1CCCN(C)C1 ZINC000534079151 932258480 /nfs/dbraw/zinc/25/84/80/932258480.db2.gz HZBXNKFPLIIQDB-QHCPKHFHSA-N 0 3 417.509 4.365 20 0 HIADHN CS[C@@H]1CN(C(=O)c2c(C)onc2-c2c(Cl)cccc2Cl)C[C@@H]1N(C)C ZINC000534094880 932274078 /nfs/dbraw/zinc/27/40/78/932274078.db2.gz HORMNLCHXXIQCH-UONOGXRCSA-N 0 3 414.358 4.074 20 0 HIADHN CS[C@H]1CN(C(=O)c2c(C)onc2-c2c(Cl)cccc2Cl)C[C@H]1N(C)C ZINC000534094879 932274507 /nfs/dbraw/zinc/27/45/07/932274507.db2.gz HORMNLCHXXIQCH-KGLIPLIRSA-N 0 3 414.358 4.074 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)N[C@H]1CCN(C)[C@H]1c1ccc(Cl)cc1 ZINC000534125762 932292352 /nfs/dbraw/zinc/29/23/52/932292352.db2.gz XCDUTMBOAMYVDT-FPOVZHCZSA-N 0 3 411.933 4.323 20 0 HIADHN O=C(CCCc1cc(F)ccc1F)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000534157526 932306602 /nfs/dbraw/zinc/30/66/02/932306602.db2.gz WZMXIVINVMHCGD-UHFFFAOYSA-N 0 3 420.475 4.086 20 0 HIADHN Cc1ccc(-n2nc(C(C)(C)C)cc2NC(=O)N2CC[C@@H](N3CC=CC3)C2)c(C)c1 ZINC000534161151 932308748 /nfs/dbraw/zinc/30/87/48/932308748.db2.gz BXLLJQJJGSRLLS-LJQANCHMSA-N 0 3 407.562 4.265 20 0 HIADHN COc1ccc(-c2n[nH]cc2CN(Cc2ccc(C(=O)NC3CC3)cc2)C2CC2)cc1 ZINC000534335984 932385253 /nfs/dbraw/zinc/38/52/53/932385253.db2.gz OQSKKEWPQXZDHF-UHFFFAOYSA-N 0 3 416.525 4.142 20 0 HIADHN O=C(N[C@H](CC(F)(F)F)c1ccc(F)cc1)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000534341869 932387200 /nfs/dbraw/zinc/38/72/00/932387200.db2.gz IRVCPXSCHPBBFS-PKOBYXMFSA-N 0 3 409.427 4.243 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cn(C)nc1C(F)F)c1ccc(C(F)(F)F)cc1 ZINC000534360025 932394209 /nfs/dbraw/zinc/39/42/09/932394209.db2.gz OBLRSEHSVZCJIA-OAHLLOKOSA-N 0 3 418.410 4.189 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3cccnc3-c3ccccc3)CC2)C[C@H](C)O1 ZINC000534376376 932404411 /nfs/dbraw/zinc/40/44/11/932404411.db2.gz DNGCFMXSIRHKKT-KDURUIRLSA-N 0 3 408.546 4.102 20 0 HIADHN O=C([C@@H]1CC[C@@H]2CCCC[C@H]2C1)N1CCC[C@@H](CN2CCN(c3ccccn3)CC2)C1 ZINC000534426469 932443439 /nfs/dbraw/zinc/44/34/39/932443439.db2.gz MJAUGLKBEWLNRB-NEWJYFPISA-N 0 3 424.633 4.049 20 0 HIADHN CC[C@H](NCc1nc2cc(Cl)ccc2n1C)[C@H](c1ccc(C)cc1)n1cncn1 ZINC000534453871 932468681 /nfs/dbraw/zinc/46/86/81/932468681.db2.gz UKVUQMBQCSNAOA-AVRDEDQJSA-N 0 3 408.937 4.284 20 0 HIADHN CC1CCN(S(=O)(=O)Cc2ccccc2CNCc2cccc3cc[nH]c32)CC1 ZINC000534467778 932489117 /nfs/dbraw/zinc/48/91/17/932489117.db2.gz ZYKKYWGZVJFDBE-UHFFFAOYSA-N 0 3 411.571 4.019 20 0 HIADHN Cc1cc(C)c(CC(C(=O)Nc2nc3c(s2)CN(C)CC3)C(F)(F)F)c(C)c1 ZINC000534469726 932492595 /nfs/dbraw/zinc/49/25/95/932492595.db2.gz OBNVGIXVLUOASZ-HNNXBMFYSA-N 0 3 411.493 4.416 20 0 HIADHN CN(C)[C@@H](CNC(=O)Nc1ncc(Cc2cccc(F)c2)s1)Cc1ccccc1 ZINC000534521152 932543125 /nfs/dbraw/zinc/54/31/25/932543125.db2.gz SYTJSPKPGNQFPF-LJQANCHMSA-N 0 3 412.534 4.167 20 0 HIADHN Cc1nc(-c2ccc(CNC(=O)NC[C@@H](Cc3ccccc3)N(C)C)s2)cs1 ZINC000534522245 932544769 /nfs/dbraw/zinc/54/47/69/932544769.db2.gz GGOABXGIKNNRMK-QGZVFWFLSA-N 0 3 414.600 4.152 20 0 HIADHN CC(C)CN(C(=O)c1ccc(C(=O)N(C)c2ccccc2)cc1)C1CCN(C)CC1 ZINC000534562277 932566227 /nfs/dbraw/zinc/56/62/27/932566227.db2.gz QFGNRSLAQFVBJD-UHFFFAOYSA-N 0 3 407.558 4.156 20 0 HIADHN CC[C@H](NC(=O)Nc1ccc(CCN2CCSCC2)cc1)c1c(C)noc1C ZINC000534569818 932572201 /nfs/dbraw/zinc/57/22/01/932572201.db2.gz SXGVDGDFWRGFEC-IBGZPJMESA-N 0 3 402.564 4.156 20 0 HIADHN CN(C)[C@@H](CNC(=O)Nc1cccc2c1CN(c1nccs1)C2)c1ccccc1 ZINC000534760993 932741167 /nfs/dbraw/zinc/74/11/67/932741167.db2.gz IQFNOUCWHQSXKV-FQEVSTJZSA-N 0 3 407.543 4.088 20 0 HIADHN CC(=O)c1ccc(Oc2ccc(C(=O)N(CCN(C)C)Cc3ccco3)cc2)cc1 ZINC000534803171 932779198 /nfs/dbraw/zinc/77/91/98/932779198.db2.gz UOKKMYWBTIVCQZ-UHFFFAOYSA-N 0 3 406.482 4.479 20 0 HIADHN C[C@H](C(=O)N1CCCN(C2CCCC2)CC1)c1cccc(C(=O)c2ccccc2)c1 ZINC000534887867 932824169 /nfs/dbraw/zinc/82/41/69/932824169.db2.gz NPPFAHWATNIUTH-FQEVSTJZSA-N 0 3 404.554 4.498 20 0 HIADHN C[C@H](CCc1ccc(O)cc1)NC(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000534927950 932842574 /nfs/dbraw/zinc/84/25/74/932842574.db2.gz VQSDHSVADNUSKX-VGOFRKELSA-N 0 3 420.475 4.284 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)c1ccc(C(=O)N(C)c2ccccc2)cc1 ZINC000535244274 933034690 /nfs/dbraw/zinc/03/46/90/933034690.db2.gz YEAUKYKHRLSVCN-UHFFFAOYSA-N 0 3 417.509 4.286 20 0 HIADHN CN1CC[C@@H](NC(=O)NCc2ccc(Oc3cccc(F)c3)nc2)[C@@H]1c1ccccc1 ZINC000535338653 933081209 /nfs/dbraw/zinc/08/12/09/933081209.db2.gz BEFNNKUGWOXHFA-GGAORHGYSA-N 0 3 420.488 4.258 20 0 HIADHN CN1CC[C@H](NC(=O)NCc2cc(Cl)ccc2OC(F)F)[C@@H]1c1ccccc1 ZINC000535358933 933090912 /nfs/dbraw/zinc/09/09/12/933090912.db2.gz WMRIPQUNUDWAQU-WMZOPIPTSA-N 0 3 409.864 4.186 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)c1ccccc1CCC(F)(F)F ZINC000535373040 933098632 /nfs/dbraw/zinc/09/86/32/933098632.db2.gz CFMNHSOCYPVIDS-UHFFFAOYSA-N 0 3 400.510 4.273 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)[C@@H]1CC(=O)N(C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000535374231 933099534 /nfs/dbraw/zinc/09/95/34/933099534.db2.gz VOOYVZFRGANGKM-IIBYNOLFSA-N 0 3 417.912 4.007 20 0 HIADHN CN1CC[C@H](NC(=O)CCc2ncc(-c3ccc(F)cc3F)o2)[C@H]1c1ccccc1 ZINC000535468041 933158002 /nfs/dbraw/zinc/15/80/02/933158002.db2.gz GXPROADWYIYFMX-WMZHIEFXSA-N 0 3 411.452 4.114 20 0 HIADHN Cc1cc(C(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)ccc1NC(=O)c1cccs1 ZINC000535470450 933160939 /nfs/dbraw/zinc/16/09/39/933160939.db2.gz WEBOZTFHNZDTHO-IFMALSPDSA-N 0 3 419.550 4.484 20 0 HIADHN CCOc1ccc(F)c(NC(=O)NC[C@@H](CC)N2CCc3ccccc3C2)c1F ZINC000535494641 933183132 /nfs/dbraw/zinc/18/31/32/933183132.db2.gz VORGKHQULVGRDR-QGZVFWFLSA-N 0 3 403.473 4.322 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cc(N2CCCC2=O)ccc1Cl)c1ccsc1 ZINC000535504389 933195629 /nfs/dbraw/zinc/19/56/29/933195629.db2.gz RLNPZRZINLLOQK-LJQANCHMSA-N 0 3 419.978 4.341 20 0 HIADHN C[C@@H](Oc1ccc(C(=O)N(CCN(C)C)Cc2cccc(O)c2)cn1)c1ccccc1 ZINC000535638414 933279404 /nfs/dbraw/zinc/27/94/04/933279404.db2.gz POIARSKPNVBATP-LJQANCHMSA-N 0 3 419.525 4.131 20 0 HIADHN CN(C)CCN(Cc1cccc(O)c1)C(=O)c1cc(-c2ccccn2)ccc1Cl ZINC000535639162 933281035 /nfs/dbraw/zinc/28/10/35/933281035.db2.gz DIKWBHGNLUTPGH-UHFFFAOYSA-N 0 3 409.917 4.312 20 0 HIADHN Cc1nn(-c2ccc(F)cc2F)c(C)c1CNCc1ccc(CN(C)C)c(F)c1 ZINC000535687661 933341526 /nfs/dbraw/zinc/34/15/26/933341526.db2.gz CJGUXTHJEGKXJB-UHFFFAOYSA-N 0 3 402.464 4.258 20 0 HIADHN CC[C@H](C)n1ncc(NC(=O)N(C)C2CCN(CCc3ccccn3)CC2)c1C1CC1 ZINC000535698175 933352056 /nfs/dbraw/zinc/35/20/56/933352056.db2.gz DHFJMXOHRLQLBI-SFHVURJKSA-N 0 3 424.593 4.297 20 0 HIADHN Cc1cnc(CCN(C)C[C@@H](O)CO[C@H](c2ccccc2)c2ccc(C)cc2)s1 ZINC000535869127 933451188 /nfs/dbraw/zinc/45/11/88/933451188.db2.gz DIQQZBAVUHXAHJ-ISKFKSNPSA-N 0 3 410.583 4.401 20 0 HIADHN Cc1cc(C)c(CC(C(=O)Nc2ccnn2C[C@H]2CCOC2)C(F)(F)F)c(C)c1 ZINC000535879857 933460689 /nfs/dbraw/zinc/46/06/89/933460689.db2.gz NNVVUXUZNPWHKH-SJLPKXTDSA-N 0 3 409.452 4.205 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)[C@@H](C)C1CCOCC1)c1ccc(C(F)(F)F)cc1 ZINC000535882841 933463341 /nfs/dbraw/zinc/46/33/41/933463341.db2.gz LRNIKBBBIKXCGX-KXBFYZLASA-N 0 3 400.485 4.267 20 0 HIADHN Cc1nc(-c2ccc(CNC(=O)NC[C@@H](Cc3ccccc3)N(C)C)cc2)cs1 ZINC000536015018 933572666 /nfs/dbraw/zinc/57/26/66/933572666.db2.gz NZALPFDREOCCSG-OAQYLSRUSA-N 0 3 408.571 4.091 20 0 HIADHN CN1CCC[C@@H](CNC(=O)c2ccn(-c3ccc(Cl)cc3)n2)[C@@H]1c1cccs1 ZINC000536046582 933592634 /nfs/dbraw/zinc/59/26/34/933592634.db2.gz XEPPUWJNQXWXOE-MGPUTAFESA-N 0 3 414.962 4.400 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)c2ccc(OC(C)C)c(OC)c2)cc1 ZINC000536095770 933646257 /nfs/dbraw/zinc/64/62/57/933646257.db2.gz OVFULNZNHWNLSK-NRFANRHFSA-N 0 3 412.530 4.058 20 0 HIADHN COc1ccc([C@H](C)NC2CCN(C(=O)c3ccco3)CC2)c(Br)c1 ZINC000537295683 933702310 /nfs/dbraw/zinc/70/23/10/933702310.db2.gz KWKDUEYRZRRECE-ZDUSSCGKSA-N 0 3 407.308 4.006 20 0 HIADHN CC[C@H](N[C@@H]1CCO[C@H]1c1ccc(F)c(F)c1)c1ccccc1OCC(=O)N(C)C ZINC000537303163 933705690 /nfs/dbraw/zinc/70/56/90/933705690.db2.gz CVKMKRBSGNJHLE-MZKRTTBSSA-N 0 3 418.484 4.003 20 0 HIADHN Cc1nn(Cc2ccccc2Cl)c(C)c1CN[C@H]1CCN(c2ncccc2F)C1 ZINC000537396848 933757236 /nfs/dbraw/zinc/75/72/36/933757236.db2.gz QABNOQHGJZVKQV-SFHVURJKSA-N 0 3 413.928 4.104 20 0 HIADHN Cc1ccc(N[C@@H]2CCN(Cc3ccccn3)C[C@@H]2C)cc1I ZINC000537406516 933761872 /nfs/dbraw/zinc/76/18/72/933761872.db2.gz KEMIHDWWEVXCFF-HNAYVOBHSA-N 0 3 421.326 4.317 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)c2csc(Nc3ccccn3)n2)CC1 ZINC000562491817 945089950 /nfs/dbraw/zinc/08/99/50/945089950.db2.gz YFITXDJRBWMYKY-UHFFFAOYSA-N 0 3 407.543 4.018 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)c1c2c(sc1-n1cccc1)CCC2 ZINC000562509710 945095597 /nfs/dbraw/zinc/09/55/97/945095597.db2.gz LMEHXLPHZKWHSK-UHFFFAOYSA-N 0 3 421.566 4.237 20 0 HIADHN CCS(=O)(=O)c1ccc(CN[C@H]2CCCc3ccc(Br)cc32)cc1 ZINC000562877509 945136595 /nfs/dbraw/zinc/13/65/95/945136595.db2.gz WQIGIXVUMRGFDD-IBGZPJMESA-N 0 3 408.361 4.410 20 0 HIADHN Cc1ccc(C2=NN(C(=O)CN3CCC[C@H]3C3CCOCC3)[C@@H](c3ccco3)C2)cc1 ZINC000537524674 938315812 /nfs/dbraw/zinc/31/58/12/938315812.db2.gz WTSWRINEITYQRJ-XZOQPEGZSA-N 0 3 421.541 4.157 20 0 HIADHN COc1ccc(NC(=O)[C@@H](C)N2CCC[C@@H](c3n[nH]c(C4CCCCC4)n3)C2)cc1 ZINC000537561598 938324712 /nfs/dbraw/zinc/32/47/12/938324712.db2.gz HFDIGUFZGKVVNJ-SJLPKXTDSA-N 0 3 411.550 4.068 20 0 HIADHN COc1ccc(NC(=O)[C@@H](C)N2CCC[C@H](c3n[nH]c(C4CCCCC4)n3)C2)cc1 ZINC000537561596 938324862 /nfs/dbraw/zinc/32/48/62/938324862.db2.gz HFDIGUFZGKVVNJ-AEFFLSMTSA-N 0 3 411.550 4.068 20 0 HIADHN Cc1nc(-c2ccc(F)c(F)c2)sc1C(=O)NC[C@@H](c1ccccc1)N(C)C ZINC000537593260 938330792 /nfs/dbraw/zinc/33/07/92/938330792.db2.gz XTYRFAWBSXBOSI-SFHVURJKSA-N 0 3 401.482 4.429 20 0 HIADHN CCO[C@H]1C[C@H](O)C12CCN(Cc1cn(-c3ccccc3)nc1-c1cccs1)CC2 ZINC000537615008 938333394 /nfs/dbraw/zinc/33/33/94/938333394.db2.gz IAALKGOPZCVGSF-VXKWHMMOSA-N 0 3 423.582 4.353 20 0 HIADHN Cc1nn(C)c(N2CCOCC2)c1CN1C[C@@H](C)C[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000537620863 938336282 /nfs/dbraw/zinc/33/62/82/938336282.db2.gz YWPHFWCQZUCOBN-YWZLYKJASA-N 0 3 422.495 4.167 20 0 HIADHN Cn1cc(CN2CCC[C@@H](c3nc(C(F)(F)F)cs3)C2)c(-c2cccnc2)n1 ZINC000537622396 938337535 /nfs/dbraw/zinc/33/75/35/938337535.db2.gz XNLIPZYVCXXARN-CQSZACIVSA-N 0 3 407.465 4.337 20 0 HIADHN COC(=O)[C@H]1CC12CCN(Cc1cnc(-c3ccc(Br)cc3)s1)CC2 ZINC000537625185 938337802 /nfs/dbraw/zinc/33/78/02/938337802.db2.gz QPSNJNNCAVXRCE-MRXNPFEDSA-N 0 3 421.360 4.348 20 0 HIADHN CCOc1c(Br)cc(CN(C)[C@@H](CCO)c2ccccc2)cc1OC ZINC000537624338 938338166 /nfs/dbraw/zinc/33/81/66/938338166.db2.gz IPWHHIZTTPCESV-SFHVURJKSA-N 0 3 408.336 4.412 20 0 HIADHN COc1cc(CN2CCCC[C@H]2CN2CCOCC2)ccc1OCc1cccs1 ZINC000537636786 938342614 /nfs/dbraw/zinc/34/26/14/938342614.db2.gz VTFNHWWAQDBFGE-FQEVSTJZSA-N 0 3 416.587 4.022 20 0 HIADHN Cc1nn(-c2ccc(Br)cc2)cc1CN1CCC(OCC2CC2)CC1 ZINC000537648447 938345926 /nfs/dbraw/zinc/34/59/26/938345926.db2.gz IUHCAWPRYYGNGZ-UHFFFAOYSA-N 0 3 404.352 4.334 20 0 HIADHN CN1CCN(c2cccc(Cl)c2CNCc2ccnc(OC3CCCC3)c2)CC1 ZINC000537747840 938368564 /nfs/dbraw/zinc/36/85/64/938368564.db2.gz FGYFRNNOWZJLLU-UHFFFAOYSA-N 0 3 414.981 4.098 20 0 HIADHN O=C([C@H]1CC12CCN(CCOc1ccc(C(F)(F)F)cc1)CC2)N1CCCCC1 ZINC000537806455 938381140 /nfs/dbraw/zinc/38/11/40/938381140.db2.gz JEYCDXAXMXMTKA-LJQANCHMSA-N 0 3 410.480 4.199 20 0 HIADHN C[C@@H](NC(=O)N1CCO[C@H](CN(C)C)C1)c1ccc(-c2ccc(Cl)cc2)s1 ZINC000537814602 938383246 /nfs/dbraw/zinc/38/32/46/938383246.db2.gz FGCUPTNCEFKVQO-RHSMWYFYSA-N 0 3 407.967 4.102 20 0 HIADHN CC(=O)CCC(C)(C)C(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1 ZINC000537829276 938385348 /nfs/dbraw/zinc/38/53/48/938385348.db2.gz COYGHZSJOHYFGH-UHFFFAOYSA-N 0 3 421.585 4.385 20 0 HIADHN C[C@@H](C(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1)C1CCOCC1 ZINC000537832358 938386060 /nfs/dbraw/zinc/38/60/60/938386060.db2.gz TUGIKVZZPZLQCO-OAQYLSRUSA-N 0 3 421.585 4.053 20 0 HIADHN C[C@H](C(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1)C1CCOCC1 ZINC000537832354 938386213 /nfs/dbraw/zinc/38/62/13/938386213.db2.gz TUGIKVZZPZLQCO-NRFANRHFSA-N 0 3 421.585 4.053 20 0 HIADHN Cc1nn(C)c(C)c1NC(=O)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000537888392 938400226 /nfs/dbraw/zinc/40/02/26/938400226.db2.gz WEWRWTHKYFPJSG-UHFFFAOYSA-N 0 3 424.376 4.474 20 0 HIADHN CC(C)Cn1cc(NC(=O)NCCCN2CCc3ccccc3C2)c(C(F)F)n1 ZINC000537913104 938410820 /nfs/dbraw/zinc/41/08/20/938410820.db2.gz LUMWVHZGSKDDBA-UHFFFAOYSA-N 0 3 405.493 4.047 20 0 HIADHN CC[C@H](NCc1ccc(S(=O)(=O)N2CCCCC2)cc1)c1ccc(OC)cc1 ZINC000537918741 938413366 /nfs/dbraw/zinc/41/33/66/938413366.db2.gz IORCILTVWCTPLZ-QFIPXVFZSA-N 0 3 402.560 4.111 20 0 HIADHN C[C@@H](NCCOc1cccc(C(F)(F)F)n1)c1ccc(-n2cncn2)cc1Cl ZINC000537950698 938429929 /nfs/dbraw/zinc/42/99/29/938429929.db2.gz IYNHAXIYBWZIHH-GFCCVEGCSA-N 0 3 411.815 4.064 20 0 HIADHN COc1ccc([C@@H](C)NCc2ccccc2CS(=O)(=O)N2CCC(C)CC2)cc1 ZINC000537954240 938431794 /nfs/dbraw/zinc/43/17/94/938431794.db2.gz YXOXEWMLXZCBGK-LJQANCHMSA-N 0 3 416.587 4.108 20 0 HIADHN COc1ccc(C[C@@H](C)CN[C@@H](C)c2nnn(-c3ccc(F)cc3)c2C)cc1OC ZINC000537962149 938435248 /nfs/dbraw/zinc/43/52/48/938435248.db2.gz MROOHCMONYOORR-CVEARBPZSA-N 0 3 412.509 4.261 20 0 HIADHN COc1ccc([C@H](OC)[C@H](C)N[C@@H](C)c2ccc(-n3cncn3)cc2Cl)cc1 ZINC000537964591 938437045 /nfs/dbraw/zinc/43/70/45/938437045.db2.gz WLBVWQOCKPSMMC-VFCRVFHLSA-N 0 3 400.910 4.356 20 0 HIADHN CCc1cc(N2CCC[C@H](N[C@@H](C)c3cc(Cl)c(OC)cc3OC)C2)ncn1 ZINC000537979935 938446464 /nfs/dbraw/zinc/44/64/64/938446464.db2.gz BROAIWLDUJIBNS-HOCLYGCPSA-N 0 3 404.942 4.029 20 0 HIADHN C[C@H](N[C@@H]1CCN(c2ccc(Cl)cc2)C1=O)c1ccc(OCc2nccn2C)cc1 ZINC000537983012 938447419 /nfs/dbraw/zinc/44/74/19/938447419.db2.gz TWXYQEBCYGWVBU-HRAATJIYSA-N 0 3 424.932 4.109 20 0 HIADHN COc1ccc([C@H](C)NCc2ccc(S(=O)(=O)N3CCCCC3)cc2)cc1Cl ZINC000537992623 938454002 /nfs/dbraw/zinc/45/40/02/938454002.db2.gz ZCAZDIZXPCJKLM-INIZCTEOSA-N 0 3 422.978 4.374 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)c3cnc(Oc4ccccc4)cn3)c2)CC1 ZINC000537999899 938457276 /nfs/dbraw/zinc/45/72/76/938457276.db2.gz JDIPHVRLBPTSFH-UHFFFAOYSA-N 0 3 417.513 4.052 20 0 HIADHN COc1cc(OC)c(OC)cc1CN[C@@H](C)[C@H](OC)c1ccc(Br)cc1 ZINC000538018233 938463956 /nfs/dbraw/zinc/46/39/56/938463956.db2.gz MZNSCYNYLHUQIG-RBZFPXEDSA-N 0 3 424.335 4.341 20 0 HIADHN COc1ccc2c(c1)[C@H](NCc1nnc(-c3ccc(Br)cc3)[nH]1)CCC2 ZINC000538018328 938464495 /nfs/dbraw/zinc/46/44/95/938464495.db2.gz OPVQVIKJUGAHQM-GOSISDBHSA-N 0 3 413.319 4.410 20 0 HIADHN COc1ccc2c(c1)[C@H]([NH2+]Cc1nnc(-c3ccc(Br)cc3)[n-]1)CCC2 ZINC000538018328 938464507 /nfs/dbraw/zinc/46/45/07/938464507.db2.gz OPVQVIKJUGAHQM-GOSISDBHSA-N 0 3 413.319 4.410 20 0 HIADHN Fc1ccc(-c2nc(CN[C@@H]3CCCOc4cc(Br)ccc43)n[nH]2)cc1 ZINC000538020192 938464916 /nfs/dbraw/zinc/46/49/16/938464916.db2.gz BDUCRDFOAINPRT-MRXNPFEDSA-N 0 3 417.282 4.377 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@H](COC)c1ccc(F)c(F)c1)c1ccsc1 ZINC000538036870 938476880 /nfs/dbraw/zinc/47/68/80/938476880.db2.gz CDMSEBPFSPFIJZ-RTBURBONSA-N 0 3 411.518 4.096 20 0 HIADHN Cc1cccc([C@@H](CN[C@H](C)c2nc3ccc(Cl)cc3n2C)N2CCOCC2)c1 ZINC000538063438 938492351 /nfs/dbraw/zinc/49/23/51/938492351.db2.gz UBTIXXIDMPWKCL-VGOFRKELSA-N 0 3 412.965 4.259 20 0 HIADHN C[C@@H](NCC(=O)NCCc1cccc(Cl)c1Cl)c1ccccc1-n1cccn1 ZINC000538160477 938529341 /nfs/dbraw/zinc/52/93/41/938529341.db2.gz ABKIBKRMVNMEFB-OAHLLOKOSA-N 0 3 417.340 4.189 20 0 HIADHN COc1ccc([C@@H](Cc2ccccc2C)NCC(=O)N2CCC[C@H](C)C2)cc1OC ZINC000538174899 938535657 /nfs/dbraw/zinc/53/56/57/938535657.db2.gz HRHUCNVKAIXUTG-PGRDOPGGSA-N 0 3 410.558 4.144 20 0 HIADHN COC[C@H](NC[C@H](CO)Cc1ccc(C(F)(F)F)cc1)c1ccc(F)c(F)c1 ZINC000538194454 938548776 /nfs/dbraw/zinc/54/87/76/938548776.db2.gz KUHZIIQQDMWXDS-KUHUBIRLSA-N 0 3 403.391 4.112 20 0 HIADHN CC(C)(C)c1ccc(C(C)(C)NCC(=O)NCc2cccc(C(=O)NC3CC3)c2)cc1 ZINC000538204512 938553765 /nfs/dbraw/zinc/55/37/65/938553765.db2.gz HELVMZJEDYJODH-UHFFFAOYSA-N 0 3 421.585 4.017 20 0 HIADHN COc1ccc(CN(C)C(=O)CN[C@@H](c2ccc(Cl)cc2)C2CCC2)cc1OC ZINC000538206559 938554137 /nfs/dbraw/zinc/55/41/37/938554137.db2.gz QYNZIYPLZGLSQS-HSZRJFAPSA-N 0 3 416.949 4.447 20 0 HIADHN CS(=O)(=O)CCCN[C@H](Cc1ccc(Cl)cc1Cl)c1ccc(F)cc1 ZINC000538216763 938559999 /nfs/dbraw/zinc/55/99/99/938559999.db2.gz ASVYEENFMKQCBV-GOSISDBHSA-N 0 3 404.334 4.441 20 0 HIADHN O=C1CCCN1CCN[C@H](COc1cccc(F)c1)c1cccc(C(F)(F)F)c1 ZINC000538219142 938561653 /nfs/dbraw/zinc/56/16/53/938561653.db2.gz AIDNZZQNIKUMTD-LJQANCHMSA-N 0 3 410.411 4.177 20 0 HIADHN O=C(CN[C@H](C[C@H]1CCOC1)c1ccccc1)NCc1ccccc1OC1CCCC1 ZINC000538233327 938567127 /nfs/dbraw/zinc/56/71/27/938567127.db2.gz QJVBDCNNYAZUKX-HYBUGGRVSA-N 0 3 422.569 4.382 20 0 HIADHN CCN(CC)CCN(C(=O)[C@H]1CCC(=O)[C@@H](C)C1)c1cccc(Br)c1 ZINC000538256818 938576133 /nfs/dbraw/zinc/57/61/33/938576133.db2.gz QGIRKKWNDRGHIK-HOTGVXAUSA-N 0 3 409.368 4.129 20 0 HIADHN CCNC(=O)COc1cccc(CN[C@@H](CC)c2cc(F)cc(Br)c2)c1 ZINC000538409636 938613329 /nfs/dbraw/zinc/61/33/29/938613329.db2.gz SYVGBEBXFZONAO-IBGZPJMESA-N 0 3 423.326 4.344 20 0 HIADHN O=C1[C@H](N2CCC(OCC3CC3)CC2)CCCN1Cc1cccc(C(F)(F)F)c1 ZINC000538468878 938629389 /nfs/dbraw/zinc/62/93/89/938629389.db2.gz SRXQPIWHADNDLS-HXUWFJFHSA-N 0 3 410.480 4.087 20 0 HIADHN C[C@]1(CCCO)CCCN1CC(=O)NC[C@@H](c1c[nH]c2ccccc21)c1ccccc1 ZINC000538514534 938638960 /nfs/dbraw/zinc/63/89/60/938638960.db2.gz JAUIZYTXJDVFLG-ATIYNZHBSA-N 0 3 419.569 4.043 20 0 HIADHN C[C@@]1(CCCO)CCCN1CC(=O)NC[C@H](c1c[nH]c2ccccc21)c1ccccc1 ZINC000538514537 938639023 /nfs/dbraw/zinc/63/90/23/938639023.db2.gz JAUIZYTXJDVFLG-NVQXNPDNSA-N 0 3 419.569 4.043 20 0 HIADHN O=C(N[C@@H]1CCCOCC1)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000538513020 938639046 /nfs/dbraw/zinc/63/90/46/938639046.db2.gz QGSAORZGSBOEKO-QGZVFWFLSA-N 0 3 414.377 4.170 20 0 HIADHN Cc1cc(C(=O)N(C)C2CCN(Cc3ccccc3)CC2)nn1-c1ccc(F)cc1 ZINC000538523171 938641323 /nfs/dbraw/zinc/64/13/23/938641323.db2.gz KIEKODAFOPFYLN-UHFFFAOYSA-N 0 3 406.505 4.056 20 0 HIADHN COc1cc(C)nc(CNCc2ccccc2CN2CCN(c3ccccc3)CC2)c1 ZINC000538611341 938661098 /nfs/dbraw/zinc/66/10/98/938661098.db2.gz IVMKFEJEIBYXQF-UHFFFAOYSA-N 0 3 416.569 4.011 20 0 HIADHN COc1cc(CNC/C=C\c2ccccc2)cc(I)c1OC ZINC000538671626 938681147 /nfs/dbraw/zinc/68/11/47/938681147.db2.gz LWEXLNZRFJLOLH-TWGQIWQCSA-N 0 3 409.267 4.111 20 0 HIADHN NC(=O)CCC1CCN(Cc2cnc(-c3ccc(Br)cc3)s2)CC1 ZINC000538718449 938689455 /nfs/dbraw/zinc/68/94/55/938689455.db2.gz SJFQWIAMFVFDFA-UHFFFAOYSA-N 0 3 408.365 4.050 20 0 HIADHN COc1cc(CN2CCC[C@@H](CC(N)=O)C2)ccc1OCc1ccc(Cl)cc1 ZINC000538722988 938691348 /nfs/dbraw/zinc/69/13/48/938691348.db2.gz DXLRHSHELZGKCZ-KRWDZBQOSA-N 0 3 402.922 4.015 20 0 HIADHN CCN(C1CCN(Cc2ccc3c(c2)c2ccccc2n3CC)CC1)S(C)(=O)=O ZINC000538730695 938695091 /nfs/dbraw/zinc/69/50/91/938695091.db2.gz GSVSNNKLLCJDEM-UHFFFAOYSA-N 0 3 413.587 4.060 20 0 HIADHN COc1cc(CN2CCC3(CNC(=O)C3)CC2)ccc1OCc1ccc(Cl)cc1 ZINC000538735516 938696921 /nfs/dbraw/zinc/69/69/21/938696921.db2.gz FLMVVVQOIWZKQL-UHFFFAOYSA-N 0 3 414.933 4.030 20 0 HIADHN COc1c(C)cc(CN2CCCN(Cc3csc([C@H](C)OC)n3)CC2)cc1C ZINC000538811953 938718962 /nfs/dbraw/zinc/71/89/62/938718962.db2.gz PMGUQNJSYCNREE-SFHVURJKSA-N 0 3 403.592 4.184 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)c2cc3ccc(F)cc3nc2C)cc1 ZINC000538830520 938721145 /nfs/dbraw/zinc/72/11/45/938721145.db2.gz AAOWLKVZAHAIEF-QHCPKHFHSA-N 0 3 407.489 4.258 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)c2cc3ccc(F)cc3nc2C)cc1 ZINC000538830519 938721383 /nfs/dbraw/zinc/72/13/83/938721383.db2.gz AAOWLKVZAHAIEF-HSZRJFAPSA-N 0 3 407.489 4.258 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2F)cc1 ZINC000538830778 938721797 /nfs/dbraw/zinc/72/17/97/938721797.db2.gz PDMIBGNVELRZLG-VWPQPMDRSA-N 0 3 400.469 4.030 20 0 HIADHN Cc1ccc(NC(=O)[C@H](N[C@@H]2CCO[C@@]3(CCOC3)C2)c2ccccc2)cc1Cl ZINC000538877076 938729723 /nfs/dbraw/zinc/72/97/23/938729723.db2.gz JRYLRSVTEATFRB-LSWJPFSZSA-N 0 3 414.933 4.256 20 0 HIADHN Cc1nn(C)c(C)c1CNc1cccc(N2CCN(CCc3ccccc3)CC2)c1 ZINC000538878120 938729952 /nfs/dbraw/zinc/72/99/52/938729952.db2.gz HLYQTAZVNPTUHQ-UHFFFAOYSA-N 0 3 403.574 4.014 20 0 HIADHN O=S(=O)(c1ccc(CN[C@@H]2CCc3c2cccc3Cl)cc1)N1CCCCC1 ZINC000539020259 938770807 /nfs/dbraw/zinc/77/08/07/938770807.db2.gz WEPOCHJXZBBMMQ-OAQYLSRUSA-N 0 3 404.963 4.292 20 0 HIADHN COc1cc(CN[C@H](C)c2ccc(-c3ccc(F)cc3)s2)ccc1OCC(N)=O ZINC000539040883 938777789 /nfs/dbraw/zinc/77/77/89/938777789.db2.gz VSLRXJOTYQFKBH-CQSZACIVSA-N 0 3 414.502 4.278 20 0 HIADHN C[C@H](NCc1cccc(NC(=O)c2ccccc2)c1)c1ccc(NS(C)(=O)=O)cc1 ZINC000539039849 938777924 /nfs/dbraw/zinc/77/79/24/938777924.db2.gz FQHPZNKSNNULRA-KRWDZBQOSA-N 0 3 423.538 4.161 20 0 HIADHN COc1ccc([C@@H](NC2CCN(c3ccccn3)CC2)c2ccccc2OC)cc1 ZINC000539043956 938780474 /nfs/dbraw/zinc/78/04/74/938780474.db2.gz ZJRGZRVSKQEGHG-RUZDIDTESA-N 0 3 403.526 4.447 20 0 HIADHN CC(C)NC(=O)Nc1ccc([C@H](C)N[C@@H]2CCN(CCCc3ccccc3)C2=O)cc1 ZINC000539045641 938781241 /nfs/dbraw/zinc/78/12/41/938781241.db2.gz DLBSQIJGACOVMJ-WMZHIEFXSA-N 0 3 422.573 4.101 20 0 HIADHN CCC[C@H](NC[C@H](O)CS(=O)(=O)c1cccs1)c1cccc(C(F)(F)F)c1 ZINC000539049066 938782581 /nfs/dbraw/zinc/78/25/81/938782581.db2.gz ACTLIEVKVUYORE-HOTGVXAUSA-N 0 3 421.506 4.033 20 0 HIADHN C[C@@H](NCCN(C)S(=O)(=O)c1cccs1)c1ccc(SCC(F)F)cc1 ZINC000539051229 938783452 /nfs/dbraw/zinc/78/34/52/938783452.db2.gz BJROZYDAJFFIJS-CYBMUJFWSA-N 0 3 420.572 4.077 20 0 HIADHN Cc1nc(-c2ccccc2F)sc1[C@@H](C)N[C@H]1CCCN(CC(F)(F)F)C1=O ZINC000539053518 938784985 /nfs/dbraw/zinc/78/49/85/938784985.db2.gz XSZPOGZSMBIHQH-ABAIWWIYSA-N 0 3 415.456 4.462 20 0 HIADHN C[C@H](CC(=O)Nc1ccccc1C(F)(F)F)NCc1nc(-c2ccc(F)cc2)n[nH]1 ZINC000539056259 938785588 /nfs/dbraw/zinc/78/55/88/938785588.db2.gz CYKBXLFUOSNABJ-GFCCVEGCSA-N 0 3 421.398 4.137 20 0 HIADHN C[C@H](NCCOc1ncccc1Cl)c1ccc(S(=O)(=O)C2CCCC2)cc1 ZINC000539058227 938786419 /nfs/dbraw/zinc/78/64/19/938786419.db2.gz PLVGJDITRGTWJB-HNNXBMFYSA-N 0 3 408.951 4.181 20 0 HIADHN C[C@@H](N[C@@H]1CC(=O)N(c2ccccc2Cl)C1)c1ccc(OCc2nccn2C)cc1 ZINC000539079769 938797341 /nfs/dbraw/zinc/79/73/41/938797341.db2.gz HXSZASZBDFGPTN-SJLPKXTDSA-N 0 3 424.932 4.109 20 0 HIADHN Cc1ccccc1COc1ccc([C@@H](C)N[C@H]2CCCN(c3ccn(C)n3)C2=O)cc1 ZINC000539089071 938800479 /nfs/dbraw/zinc/80/04/79/938800479.db2.gz JELRVGOWIGPZDT-XXBNENTESA-N 0 3 418.541 4.154 20 0 HIADHN COC[C@@H](N[C@H](C)CC(=O)Nc1ccc(OC(F)(F)F)cc1)c1ccc(F)cc1 ZINC000539090012 938800776 /nfs/dbraw/zinc/80/07/76/938800776.db2.gz GGHWMZZNBXLEIA-FZKQIMNGSA-N 0 3 414.399 4.419 20 0 HIADHN CCc1ccccc1NC(=O)C[C@@H](C)NCc1cccc(C(=O)NCc2ccco2)c1 ZINC000539090785 938801078 /nfs/dbraw/zinc/80/10/78/938801078.db2.gz QYQYSPNJSXWQJS-GOSISDBHSA-N 0 3 419.525 4.279 20 0 HIADHN CC[C@@H](NCc1ccccc1OCC(=O)NC[C@H]1CCCO1)c1ccc(Cl)cc1 ZINC000539091165 938801092 /nfs/dbraw/zinc/80/10/92/938801092.db2.gz GYBKPEDFARRXFC-NHCUHLMSSA-N 0 3 416.949 4.255 20 0 HIADHN COc1ccc([C@H](C)NCc2ccc(C(=O)N3C[C@@H](C)O[C@@H](C)C3)cc2)cc1Cl ZINC000539093452 938801748 /nfs/dbraw/zinc/80/17/48/938801748.db2.gz LQIIWYNMQRHLRT-BBWFWOEESA-N 0 3 416.949 4.449 20 0 HIADHN C[C@@H](NCc1ccc(C(=O)N2CCCCC2)cc1)c1ccc(NC(=O)NC2CC2)cc1 ZINC000539092470 938801810 /nfs/dbraw/zinc/80/18/10/938801810.db2.gz BELGUXVDBQIBRL-GOSISDBHSA-N 0 3 420.557 4.447 20 0 HIADHN O=C1C[C@@H](NCc2c[nH]nc2-c2cccs2)CN1c1cccc(C(F)(F)F)c1 ZINC000539104060 938803698 /nfs/dbraw/zinc/80/36/98/938803698.db2.gz VMAXWECYAVYVOB-CQSZACIVSA-N 0 3 406.433 4.052 20 0 HIADHN Brc1ccc(-c2nnc(C[NH2+][C@H]3CSCCc4ccccc43)[n-]2)cc1 ZINC000539121755 938805963 /nfs/dbraw/zinc/80/59/63/938805963.db2.gz PSUSYDIRCMBGRP-KRWDZBQOSA-N 0 3 415.360 4.354 20 0 HIADHN CC(C)(C)OCc1ccccc1C(=O)NCC1(N2CCSCC2)CCCCC1 ZINC000539121479 938805990 /nfs/dbraw/zinc/80/59/90/938805990.db2.gz HHKMFPQWMLOEMD-UHFFFAOYSA-N 0 3 404.620 4.483 20 0 HIADHN CCN1CCCN(C(=O)Nc2ccc(Cl)c(C(=O)Nc3ccccc3)c2)CC1 ZINC000539145286 938811001 /nfs/dbraw/zinc/81/10/01/938811001.db2.gz FJRVFJLKGVTXRO-UHFFFAOYSA-N 0 3 400.910 4.152 20 0 HIADHN C[C@H]1CN(c2ccc(CN[C@H](c3ccc(Br)cc3)C3CC3)cn2)CCO1 ZINC000539159389 938814035 /nfs/dbraw/zinc/81/40/35/938814035.db2.gz PGBOCWSJLHDKCA-BTYIYWSLSA-N 0 3 416.363 4.310 20 0 HIADHN CCc1cnccc1[C@@H](C)N[C@H](C)c1ccc(S(=O)(=O)NCc2ccco2)cc1 ZINC000539214365 938819541 /nfs/dbraw/zinc/81/95/41/938819541.db2.gz IUEHBKQESUUHJG-IAGOWNOFSA-N 0 3 413.543 4.127 20 0 HIADHN COc1cc(OC)cc(N2CC[C@@H](N[C@H](C)c3nc4ccc(Cl)cc4n3C)C2)c1 ZINC000539214098 938819586 /nfs/dbraw/zinc/81/95/86/938819586.db2.gz YHKPFPLHJYCOHP-GDBMZVCRSA-N 0 3 414.937 4.173 20 0 HIADHN COc1ccccc1CNC(=O)[C@H](C)N[C@@H](C)c1ccc(OCc2cccnc2)cc1 ZINC000539225232 938821494 /nfs/dbraw/zinc/82/14/94/938821494.db2.gz GUZSETJUVUNYSG-OALUTQOASA-N 0 3 419.525 4.025 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@@H](C)N[C@H](C)c2cccc(OC(C)C)c2)cc1OC ZINC000539226128 938821842 /nfs/dbraw/zinc/82/18/42/938821842.db2.gz LFTUCWDVGSWSQQ-QZTJIDSGSA-N 0 3 414.546 4.189 20 0 HIADHN COc1ccc([C@H](CCO)NCc2cc(Br)cc3cccnc32)cc1 ZINC000539234397 938822897 /nfs/dbraw/zinc/82/28/97/938822897.db2.gz QNGVZCLYJCNIJQ-IBGZPJMESA-N 0 3 401.304 4.219 20 0 HIADHN COc1ccc([C@@H](NCC(=O)N[C@H](c2nccs2)c2ccccc2)C(C)C)cc1 ZINC000539242332 938824555 /nfs/dbraw/zinc/82/45/55/938824555.db2.gz GSJJOBOHACHUNO-VXKWHMMOSA-N 0 3 409.555 4.344 20 0 HIADHN C[C@H](NC[C@@H](O)COc1cccc(Br)c1)c1ccccc1OC(F)F ZINC000539245941 938824934 /nfs/dbraw/zinc/82/49/34/938824934.db2.gz IBLDOPAZBTUFOV-GXTWGEPZSA-N 0 3 416.262 4.141 20 0 HIADHN COCc1ccccc1CNC(=O)CN[C@@H](c1cccc(C(F)(F)F)c1)C(C)C ZINC000539257304 938828284 /nfs/dbraw/zinc/82/82/84/938828284.db2.gz RGZQKGJBRCTEHZ-OAQYLSRUSA-N 0 3 408.464 4.455 20 0 HIADHN CCOc1cc(CN[C@H](c2ccccc2C)C(C)C)nc2nc(C(F)(F)F)nn21 ZINC000539260996 938828841 /nfs/dbraw/zinc/82/88/41/938828841.db2.gz KITSAJKGFFDVBP-KRWDZBQOSA-N 0 3 407.440 4.337 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(OCC(F)(F)F)cc1)C(=O)N[C@H]1CCOc2ccccc21 ZINC000539265989 938830191 /nfs/dbraw/zinc/83/01/91/938830191.db2.gz XMHNLNQWJNERDZ-DOXZYTNZSA-N 0 3 422.447 4.307 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)N[C@H]1CCOc2ccccc21)c1ccc(OCC(F)(F)F)cc1 ZINC000539265990 938830208 /nfs/dbraw/zinc/83/02/08/938830208.db2.gz XMHNLNQWJNERDZ-VCBZYWHSSA-N 0 3 422.447 4.307 20 0 HIADHN COc1cc(F)c([C@H](C)NC[C@@H](O)CO[C@H](C)c2ccc(Cl)cc2)cc1OC ZINC000539286841 938833784 /nfs/dbraw/zinc/83/37/84/938833784.db2.gz OMYZZFVOQGIUGS-JJRVBVJISA-N 0 3 411.901 4.286 20 0 HIADHN CC(=O)Nc1ccc(S(=O)(=O)CCCN[C@@H](c2ccccc2Cl)C(C)C)cc1 ZINC000539287577 938833950 /nfs/dbraw/zinc/83/39/50/938833950.db2.gz RQBAUYBMGVLIIQ-OAQYLSRUSA-N 0 3 422.978 4.449 20 0 HIADHN CN(Cc1cc(Cl)cc(Cl)c1)C(=O)CN[C@H](c1ccccc1)[C@@H]1CCOC1 ZINC000539290056 938834512 /nfs/dbraw/zinc/83/45/12/938834512.db2.gz UNQIYTAOVAPCCC-DYESRHJHSA-N 0 3 407.341 4.319 20 0 HIADHN CC(C)(C)[C@@H](NCC(=O)NCc1ccccc1Cn1cccn1)c1cccc(F)c1 ZINC000539333665 938843261 /nfs/dbraw/zinc/84/32/61/938843261.db2.gz BRZUIZUXBXEXMK-QHCPKHFHSA-N 0 3 408.521 4.064 20 0 HIADHN O=C(CN[C@H](c1cccc(F)c1)C1CCCC1)Nc1ccccc1N1CCCC1=O ZINC000539334829 938843584 /nfs/dbraw/zinc/84/35/84/938843584.db2.gz LZLKITQPNGMSAT-DEOSSOPVSA-N 0 3 409.505 4.412 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)c2c(OC)ccc(SC)c2OC)N(C)C)cc1 ZINC000539365770 938849330 /nfs/dbraw/zinc/84/93/30/938849330.db2.gz PUDJALICNZNLGJ-QGZVFWFLSA-N 0 3 402.560 4.021 20 0 HIADHN C[C@@H](NCC(=O)N1CCC(OCc2ccccc2)CC1)c1cccc(N2CCCC2)c1 ZINC000539377004 938851199 /nfs/dbraw/zinc/85/11/99/938851199.db2.gz MZLHXYBAFASOSV-OAQYLSRUSA-N 0 3 421.585 4.145 20 0 HIADHN Cc1ccc(NC(=O)NC(=O)[C@@H](C)N[C@@H](C)c2cccc(N3CCCC3)c2)c(C)c1 ZINC000539379318 938851726 /nfs/dbraw/zinc/85/17/26/938851726.db2.gz QBIXOHMIFRWFLO-RBUKOAKNSA-N 0 3 408.546 4.291 20 0 HIADHN Cc1cc([C@@H](NCC(=O)N2CCC[C@H]2c2ccc3c(c2)OCCO3)C2CC2)ccc1F ZINC000539422757 938858140 /nfs/dbraw/zinc/85/81/40/938858140.db2.gz FJTGNMHHFIUKRY-OFVILXPXSA-N 0 3 424.516 4.310 20 0 HIADHN Cc1cc([C@H](N[C@@H](C)C(=O)N[C@H](C)c2ccc3c(c2)OCCO3)C2CC2)ccc1F ZINC000539421494 938858255 /nfs/dbraw/zinc/85/82/55/938858255.db2.gz CYAQALMCNBGYMG-VBURHUQHSA-N 0 3 412.505 4.212 20 0 HIADHN CC(C)c1nn(-c2ccc(Br)cc2)cc1CN[C@@H](C)Cn1ccnc1 ZINC000539446586 938861886 /nfs/dbraw/zinc/86/18/86/938861886.db2.gz IKSRWHLMQHCSLS-HNNXBMFYSA-N 0 3 402.340 4.133 20 0 HIADHN Cc1ccccc1[C@H](NCC(=O)Nc1cc2c(cc1Cl)OCCCO2)C1CC1 ZINC000539490262 938867585 /nfs/dbraw/zinc/86/75/85/938867585.db2.gz BKRXUNAFWFSEPQ-JOCHJYFZSA-N 0 3 400.906 4.489 20 0 HIADHN CCOc1ccccc1[C@H](CC)NC(=O)CN[C@H](c1ccc2c(c1)OCCO2)C1CC1 ZINC000539491670 938867941 /nfs/dbraw/zinc/86/79/41/938867941.db2.gz XGUYGKKYOQJOAV-CPJSRVTESA-N 0 3 424.541 4.165 20 0 HIADHN COCCNS(=O)(=O)c1cccc(CN[C@@H](CC(C)(C)C)c2ccc(F)cc2)c1 ZINC000539497188 938868931 /nfs/dbraw/zinc/86/89/31/938868931.db2.gz RDELMUYLHOWWPD-NRFANRHFSA-N 0 3 422.566 4.018 20 0 HIADHN COc1cccc2cc([C@@H](C)NCCNC(=O)c3cccc(Br)c3)oc21 ZINC000539510091 938871150 /nfs/dbraw/zinc/87/11/50/938871150.db2.gz YHWLADNNOUWSIK-CYBMUJFWSA-N 0 3 417.303 4.285 20 0 HIADHN COc1sc(CNCCOc2ncccc2C(F)(F)F)cc1Br ZINC000539524066 938873223 /nfs/dbraw/zinc/87/32/23/938873223.db2.gz SZGNOEAYDFJVFT-UHFFFAOYSA-N 0 3 411.243 4.102 20 0 HIADHN Clc1cc2cccnc2c(CNc2ccc3nc(CCN4CCOCC4)[nH]c3c2)c1 ZINC000539708993 938908139 /nfs/dbraw/zinc/90/81/39/938908139.db2.gz UFODRRGDRSZAGL-UHFFFAOYSA-N 0 3 421.932 4.251 20 0 HIADHN CC1(C)CC(NC(=O)NCc2ccccc2CN2CCC(O)CC2)CC(C)(C)C1 ZINC000539737971 938917165 /nfs/dbraw/zinc/91/71/65/938917165.db2.gz FUAOESAWTAWCMQ-UHFFFAOYSA-N 0 3 401.595 4.047 20 0 HIADHN Cc1cc(C(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)nn1-c1ccc(Cl)cc1 ZINC000539759389 938925989 /nfs/dbraw/zinc/92/59/89/938925989.db2.gz HZSBBHQBCMZLIC-NRFANRHFSA-N 0 3 408.933 4.181 20 0 HIADHN O=C(c1cc(OCC(F)F)ccn1)N(CCN1CCCC1)Cc1ccc(Cl)cc1 ZINC000539765670 938930004 /nfs/dbraw/zinc/93/00/04/938930004.db2.gz MRNCKFFSMYLVRS-UHFFFAOYSA-N 0 3 423.891 4.117 20 0 HIADHN CC(=O)c1ccc(NC(=O)CCN2CCC[C@@H](c3nnc(C4CCCCC4)[nH]3)C2)cc1 ZINC000539767379 938931041 /nfs/dbraw/zinc/93/10/41/938931041.db2.gz VUVHQQQSBTWGKV-HXUWFJFHSA-N 0 3 423.561 4.263 20 0 HIADHN COCCOC1CCN(Cc2cccc(NC(=O)c3ccc(Cl)cc3)c2)CC1 ZINC000539831000 938950966 /nfs/dbraw/zinc/95/09/66/938950966.db2.gz DUCSGFITGZVBKM-UHFFFAOYSA-N 0 3 402.922 4.220 20 0 HIADHN Cc1nn(-c2ccc(F)cc2F)c(C)c1CN1CCC[C@H](CNC(=O)C(C)(C)C)C1 ZINC000539833224 938952476 /nfs/dbraw/zinc/95/24/76/938952476.db2.gz QASPXEKVRWINGB-QGZVFWFLSA-N 0 3 418.532 4.142 20 0 HIADHN O=C1Nc2cc(Cl)ccc2[C@@H]1C1CCN(Cc2c[nH]nc2-c2cccnc2)CC1 ZINC000539839463 938953741 /nfs/dbraw/zinc/95/37/41/938953741.db2.gz WGRXTUNGXKFRBL-FQEVSTJZSA-N 0 3 407.905 4.073 20 0 HIADHN CCOc1cc(CN2CCC(CN3CCCCC3=O)CC2)ccc1OCC(C)C ZINC000539838399 938953929 /nfs/dbraw/zinc/95/39/29/938953929.db2.gz PCAMHSRYFHJTHD-UHFFFAOYSA-N 0 3 402.579 4.345 20 0 HIADHN CCCN(CC(F)(F)F)C(=O)[C@H]1CCCN(Cc2cn(-c3ccccc3)nc2C)C1 ZINC000539850442 938957228 /nfs/dbraw/zinc/95/72/28/938957228.db2.gz LLQXGSYNHPXAGA-SFHVURJKSA-N 0 3 422.495 4.194 20 0 HIADHN CC(C)(C)OC(=O)[C@H]1CCN(Cc2cn(Cc3ccccc3)nc2-c2cccnc2)C1 ZINC000539850851 938957404 /nfs/dbraw/zinc/95/74/04/938957404.db2.gz QEERZBDOLURASZ-NRFANRHFSA-N 0 3 418.541 4.157 20 0 HIADHN COc1cc(CN(C)C2c3ccccc3-c3ccccc32)cc(Cl)c1OCC(N)=O ZINC000539852529 938958289 /nfs/dbraw/zinc/95/82/89/938958289.db2.gz VAIUPJPPWUOOKS-UHFFFAOYSA-N 0 3 422.912 4.415 20 0 HIADHN Brc1ccc(-c2ncc(CN3CCC[C@H](Cn4ccnn4)C3)s2)cc1 ZINC000539895727 938970845 /nfs/dbraw/zinc/97/08/45/938970845.db2.gz FTJIGFSKKACQBG-AWEZNQCLSA-N 0 3 418.364 4.076 20 0 HIADHN CCOCCO[C@H]1CCN(Cc2cn(-c3ccccc3)nc2-c2ccc(OC)cc2)C1 ZINC000539897063 938971151 /nfs/dbraw/zinc/97/11/51/938971151.db2.gz WKQROXVOZPQOHF-DEOSSOPVSA-N 0 3 421.541 4.175 20 0 HIADHN CN(Cc1cc(Br)ccc1OCc1ccccn1)C[C@@H]1CCC[C@@H]1O ZINC000539912638 938977295 /nfs/dbraw/zinc/97/72/95/938977295.db2.gz DRYQKXYNPKAYAH-KXBFYZLASA-N 0 3 405.336 4.016 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)Cc2cccc(OCc3cccnc3)c2)N(C)C)cc1 ZINC000539961040 938981612 /nfs/dbraw/zinc/98/16/12/938981612.db2.gz WSFVNMLFPZBOOO-RUZDIDTESA-N 0 3 417.553 4.185 20 0 HIADHN Cc1nc2ccccn2c(=O)c1CCN1CCC(Oc2ccc(C(C)C)cc2)CC1 ZINC000563572872 945220294 /nfs/dbraw/zinc/22/02/94/945220294.db2.gz LWNQMXHASCWBRO-UHFFFAOYSA-N 0 3 405.542 4.212 20 0 HIADHN CCc1nc2ccccc2n1C1CCN(CCc2nc3ccccc3c(=O)[nH]2)CC1 ZINC000540059537 939053811 /nfs/dbraw/zinc/05/38/11/939053811.db2.gz KKCNSPGSYULSQB-UHFFFAOYSA-N 0 3 401.514 4.127 20 0 HIADHN CC(C)n1cnnc1[C@@H]1CCCN(C[C@@H](O)COc2ccc(-c3ccccc3)cc2)C1 ZINC000540061582 939055114 /nfs/dbraw/zinc/05/51/14/939055114.db2.gz KGGVKNWKRCNPKW-DHIUTWEWSA-N 0 3 420.557 4.145 20 0 HIADHN CCOC(=O)c1sc2nc(CNC(C)(C)CCc3ccccc3)nc(N)c2c1C ZINC000540066060 939056771 /nfs/dbraw/zinc/05/67/71/939056771.db2.gz BQTHKNBNOMTRND-UHFFFAOYSA-N 0 3 412.559 4.260 20 0 HIADHN CCN(CC)C(=O)Nc1ccc([C@@H](C)N[C@@H]2CCN(Cc3ccccc3)C2=O)cc1 ZINC000540145914 939090511 /nfs/dbraw/zinc/09/05/11/939090511.db2.gz ZJBYUHFZMZTRLK-XMSQKQJNSA-N 0 3 408.546 4.012 20 0 HIADHN Cc1cc(S(=O)(=O)NCCN[C@@H](C)c2ccc(-c3ccncc3)cc2)c(C)s1 ZINC000540147688 939091217 /nfs/dbraw/zinc/09/12/17/939091217.db2.gz OXMMCXGYECOVEI-INIZCTEOSA-N 0 3 415.584 4.056 20 0 HIADHN C[C@H](N[C@@H]1CC(=O)N(C)[C@@H]1c1ccc(Cl)cc1)c1cccc(N2CCCC2=O)c1 ZINC000540155830 939093996 /nfs/dbraw/zinc/09/39/96/939093996.db2.gz MOFXFGZXPXJKDA-UYGSHGSRSA-N 0 3 411.933 4.089 20 0 HIADHN Cc1ccc2c(c1)[C@H](NCc1ccc(Br)cc1N1CCOCC1)CC2 ZINC000540162603 939097544 /nfs/dbraw/zinc/09/75/44/939097544.db2.gz LCTCGTBBCBKYGY-HXUWFJFHSA-N 0 3 401.348 4.371 20 0 HIADHN CC(C)C[C@@H](N[C@@H](C)c1ccc2c(c1)C(C)(C)C(=O)N2)C(=O)Nc1nccs1 ZINC000540165868 939099038 /nfs/dbraw/zinc/09/90/38/939099038.db2.gz ZHALOFHWFAKEED-SUMWQHHRSA-N 0 3 400.548 4.077 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(OCCN[C@H](C)c3cnc(C)nc3C)c2)cc1 ZINC000540174808 939104715 /nfs/dbraw/zinc/10/47/15/939104715.db2.gz PCZIKPJUGWWYOD-MRXNPFEDSA-N 0 3 420.513 4.084 20 0 HIADHN C[C@H]1C[C@H](NCCC(=O)N2CCN(c3ccc(F)cc3)CC2)c2ccsc2S1 ZINC000540190813 939115552 /nfs/dbraw/zinc/11/55/52/939115552.db2.gz IMANCTOEWQJHFP-KXBFYZLASA-N 0 3 419.591 4.141 20 0 HIADHN CC[C@H](NCc1ccccc1OCC(=O)NC[C@H]1CCCO1)c1cccc(Cl)c1 ZINC000540191544 939115685 /nfs/dbraw/zinc/11/56/85/939115685.db2.gz PXNZBQSXHSSGKY-RTWAWAEBSA-N 0 3 416.949 4.255 20 0 HIADHN CC(C)c1nn(-c2ccc(Br)cc2)cc1CN[C@@H](C)Cn1cccn1 ZINC000540216415 939133131 /nfs/dbraw/zinc/13/31/31/939133131.db2.gz MRRLMUMXADJQON-HNNXBMFYSA-N 0 3 402.340 4.133 20 0 HIADHN CC[C@H](N[C@H](C)C(=O)N[C@@H](C)c1cc(OC)ccc1OC)c1ccc(OC)cc1 ZINC000540343366 939200653 /nfs/dbraw/zinc/20/06/53/939200653.db2.gz SGJGVPQBIPGDCP-MRUHUIDDSA-N 0 3 400.519 4.019 20 0 HIADHN Cc1ccccc1C(=O)NC1CCN(C(=O)CN[C@H](c2ccccc2C)C(C)C)CC1 ZINC000540360975 939209580 /nfs/dbraw/zinc/20/95/80/939209580.db2.gz LTPLJHNSQHUDFI-VWLOTQADSA-N 0 3 421.585 4.011 20 0 HIADHN CCNC(=O)c1cccc(NC(=O)CN[C@H](CCc2ccccc2)c2ccccc2)c1 ZINC000540376525 939217181 /nfs/dbraw/zinc/21/71/81/939217181.db2.gz QQVUPOQTQFFKDP-XMMPIXPASA-N 0 3 415.537 4.339 20 0 HIADHN Cc1n[nH]c(C)c1[C@@H]1CCCN1C(=O)NC[C@H](c1ccccc1)N1CCC(C)CC1 ZINC000540387375 939224365 /nfs/dbraw/zinc/22/43/65/939224365.db2.gz YOVYGLQBLNMVTL-FCHUYYIVSA-N 0 3 409.578 4.346 20 0 HIADHN O=C(CNC1(c2ccccc2)CCCC1)N1CCC[C@@H]1c1ccc2c(c1)OCCO2 ZINC000540389141 939225752 /nfs/dbraw/zinc/22/57/52/939225752.db2.gz AWDBFZPPOOOQMS-OAQYLSRUSA-N 0 3 406.526 4.180 20 0 HIADHN COc1cc(CCNC(=O)CNC2(c3ccccc3)CCCC2)ccc1OC(F)F ZINC000540389736 939227389 /nfs/dbraw/zinc/22/73/89/939227389.db2.gz RHQAZKDILNUMOZ-UHFFFAOYSA-N 0 3 418.484 4.014 20 0 HIADHN CCNC(=O)c1cccc(NC(=O)CN[C@@H](c2ccc(Cl)cc2)[C@@H](C)CC)c1 ZINC000540397787 939233750 /nfs/dbraw/zinc/23/37/50/939233750.db2.gz VWTDPNFHGWBBKI-YCRPNKLZSA-N 0 3 401.938 4.405 20 0 HIADHN CC(NCCC(=O)Nc1ccc(C(N)=O)c(Cl)c1)(c1ccccc1)c1ccccc1 ZINC000540406934 939237114 /nfs/dbraw/zinc/23/71/14/939237114.db2.gz YIJVMMTZTQJMHM-UHFFFAOYSA-N 0 3 421.928 4.321 20 0 HIADHN CSc1cccc(NC(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)c1C ZINC000540407398 939237790 /nfs/dbraw/zinc/23/77/90/939237790.db2.gz JTKGKPPSMQVOCE-IRXDYDNUSA-N 0 3 405.608 4.460 20 0 HIADHN C[C@H](NC[C@@H](O)COc1ccc(Cl)cc1Cl)c1cccc(N2CCCC2=O)c1 ZINC000540408451 939238309 /nfs/dbraw/zinc/23/83/09/939238309.db2.gz BYFSLRJDSVUBOR-KBXCAEBGSA-N 0 3 423.340 4.211 20 0 HIADHN CC[C@H](C)[C@H](NCC(=O)N1CCC(C(=O)N(C)C(C)C)CC1)c1ccc(Cl)cc1 ZINC000540411027 939239256 /nfs/dbraw/zinc/23/92/56/939239256.db2.gz JIYBGEMLWBSCCD-JTSKRJEESA-N 0 3 422.013 4.122 20 0 HIADHN COc1ccc([C@H](NC2CCN(C(=O)N(C)C)CC2)c2ccccc2Cl)c(C)c1 ZINC000540416415 939240967 /nfs/dbraw/zinc/24/09/67/939240967.db2.gz DSWNEJHDCVDNDP-QFIPXVFZSA-N 0 3 415.965 4.482 20 0 HIADHN O=C(CN[C@H](C[C@@H]1CCOC1)c1ccccc1)NCCc1cccc(Cl)c1Cl ZINC000540433899 939247537 /nfs/dbraw/zinc/24/75/37/939247537.db2.gz AXNSHOABSHEKJR-OXJNMPFZSA-N 0 3 421.368 4.410 20 0 HIADHN O=C(CN[C@H](C[C@@H]1CCOC1)c1ccccc1)N(Cc1ccccc1)CC(F)(F)F ZINC000540434788 939247610 /nfs/dbraw/zinc/24/76/10/939247610.db2.gz ULPSVNUQPHKWAL-PZJWPPBQSA-N 0 3 420.475 4.335 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)NCC(=O)Nc2cccc(C(F)(F)F)c2)cc1 ZINC000540467557 939264892 /nfs/dbraw/zinc/26/48/92/939264892.db2.gz BEGJODUTTPFEGR-CQSZACIVSA-N 0 3 402.420 4.489 20 0 HIADHN C[C@@H](NCC(=O)NCc1ccc(F)cc1C(F)(F)F)c1cccc(N2CCCC2)c1 ZINC000540477560 939267875 /nfs/dbraw/zinc/26/78/75/939267875.db2.gz PEMHJMBUPYZOLR-OAHLLOKOSA-N 0 3 423.454 4.412 20 0 HIADHN C[C@@H](CCCc1ccccc1)C(=O)Nc1ccc(C(=O)N(C)[C@H]2CCCN(C)C2)cc1 ZINC000540499409 939278089 /nfs/dbraw/zinc/27/80/89/939278089.db2.gz HDXYDAPCFDZJIP-RDPSFJRHSA-N 0 3 421.585 4.450 20 0 HIADHN Cn1cc(CN2CCC(C(=O)N(Cc3ccccc3)C3CC3)CC2)c(C(C)(C)C)n1 ZINC000540506021 939280532 /nfs/dbraw/zinc/28/05/32/939280532.db2.gz RCAINADBJATNBN-UHFFFAOYSA-N 0 3 408.590 4.121 20 0 HIADHN COc1ccc(CNC(=O)[C@H](C)N[C@H](c2ccc(Cl)cc2)[C@H]2C[C@H]2C)cc1OC ZINC000540523170 939287191 /nfs/dbraw/zinc/28/71/91/939287191.db2.gz LWSIBLGFRFGBLI-SXGZUBKSSA-N 0 3 416.949 4.349 20 0 HIADHN CC(C)(C)N1CCCN(C(=O)Nc2ccc(Cl)cc2C(=O)c2ccc[nH]2)CC1 ZINC000540526650 939289726 /nfs/dbraw/zinc/28/97/26/939289726.db2.gz OATJWZXBCVHQOT-UHFFFAOYSA-N 0 3 402.926 4.237 20 0 HIADHN CCOc1cccc2cc([C@H](C)NCc3ccc(C(=O)N4CCN(C)CC4)cc3)oc21 ZINC000540597389 939315409 /nfs/dbraw/zinc/31/54/09/939315409.db2.gz OINBXVCYWRQCFJ-SFHVURJKSA-N 0 3 421.541 4.070 20 0 HIADHN CCN(CC)c1ncc(CN[C@H](C)[C@H](OC2CCOCC2)c2ccccc2)s1 ZINC000540622005 939322460 /nfs/dbraw/zinc/32/24/60/939322460.db2.gz NERMMSSVPXTJCF-UTKZUKDTSA-N 0 3 403.592 4.404 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)c1coc(-c2ccccc2Cl)n1 ZINC000540639838 939327179 /nfs/dbraw/zinc/32/71/79/939327179.db2.gz SRQAZBXIPZTXAQ-UHFFFAOYSA-N 0 3 401.869 4.338 20 0 HIADHN COc1ccc(-c2nc3c(s2)[C@H](N[C@H](C)C(=O)NCc2ccccc2)CCC3)cc1 ZINC000540727926 939350360 /nfs/dbraw/zinc/35/03/60/939350360.db2.gz SXXXJJWIXIHFAH-OXQOHEQNSA-N 0 3 421.566 4.491 20 0 HIADHN COCCNC(=O)[C@H](Cc1ccccc1)N[C@H](C)c1sc(-c2ccccc2)nc1C ZINC000540746289 939356800 /nfs/dbraw/zinc/35/68/00/939356800.db2.gz VWPMBCUYKSYMMN-UTKZUKDTSA-N 0 3 423.582 4.143 20 0 HIADHN CCOc1cc(CNC2(CC(=O)OC)CCC2)cc(Br)c1OC(F)F ZINC000540769471 939365943 /nfs/dbraw/zinc/36/59/43/939365943.db2.gz NYHQPBQDVNUDCL-UHFFFAOYSA-N 0 3 422.266 4.025 20 0 HIADHN CCc1ccc([C@@H](NC(=O)CN2CCC[C@H]2C2CCOCC2)c2cccs2)cc1 ZINC000540826677 939385962 /nfs/dbraw/zinc/38/59/62/939385962.db2.gz BIJCORKBMMPOGJ-XUZZJYLKSA-N 0 3 412.599 4.407 20 0 HIADHN Cc1nc([C@@H]2CCCN([C@H](C)c3nnc(-c4ccc(Cl)c(Cl)c4)o3)C2)n[nH]1 ZINC000540862522 939400167 /nfs/dbraw/zinc/40/01/67/939400167.db2.gz QXBJSAZHLPVBJO-ZWNOBZJWSA-N 0 3 407.305 4.411 20 0 HIADHN Cc1n[nH]c([C@@H]2CCCN([C@H](C)c3nnc(-c4ccc(Cl)c(Cl)c4)o3)C2)n1 ZINC000540862522 939400176 /nfs/dbraw/zinc/40/01/76/939400176.db2.gz QXBJSAZHLPVBJO-ZWNOBZJWSA-N 0 3 407.305 4.411 20 0 HIADHN Cc1nnc([C@@H]2CCCN([C@H](C)c3nnc(-c4ccc(Cl)c(Cl)c4)o3)C2)[nH]1 ZINC000540862522 939400182 /nfs/dbraw/zinc/40/01/82/939400182.db2.gz QXBJSAZHLPVBJO-ZWNOBZJWSA-N 0 3 407.305 4.411 20 0 HIADHN Cc1cc(C(=O)Nc2ccc(CCN3CCSCC3)cc2)nn1-c1cccc(F)c1 ZINC000540867053 939404598 /nfs/dbraw/zinc/40/45/98/939404598.db2.gz VEYBAKIDWOTSIB-UHFFFAOYSA-N 0 3 424.545 4.163 20 0 HIADHN C[C@H](C[C@H]1CCCO1)N[C@@H](c1cccc(S(C)(=O)=O)c1)c1ccc(F)c(F)c1 ZINC000540913933 939416208 /nfs/dbraw/zinc/41/62/08/939416208.db2.gz NKTLVUTTYDYHGZ-ZVGUJKQYSA-N 0 3 409.498 4.005 20 0 HIADHN O=c1cc(CN2CCC[C@H]2/C=C\c2ccccc2)nc2ccc(Br)cn12 ZINC000540944606 939419368 /nfs/dbraw/zinc/41/93/68/939419368.db2.gz PZWVGHLQGLLHJM-QIBOZCLASA-N 0 3 410.315 4.135 20 0 HIADHN CSC[C@H](NCc1ccc(N2CCN(C)CC2)nc1)c1ccc(C(F)(F)F)cc1 ZINC000540988630 939425909 /nfs/dbraw/zinc/42/59/09/939425909.db2.gz HWCJNEMCFOHHKD-IBGZPJMESA-N 0 3 424.536 4.046 20 0 HIADHN CC(C)[C@H](NC[C@H](O)COc1ccc2c(c1)CCC(=O)N2)c1ccc(Cl)cc1F ZINC000540990892 939426680 /nfs/dbraw/zinc/42/66/80/939426680.db2.gz XOVYYWQHBVEKPU-AOMKIAJQSA-N 0 3 420.912 4.090 20 0 HIADHN Cc1ccnc(OC2CCN(C[C@@H](O)CO[C@@H](C)c3ccc(Cl)cc3)CC2)c1 ZINC000541117521 939466039 /nfs/dbraw/zinc/46/60/39/939466039.db2.gz DGQIOVLFCIWUJJ-FXAWDEMLSA-N 0 3 404.938 4.025 20 0 HIADHN CCN(CC)C(=O)CCC1CCN([C@H](C)C(=O)N[C@H](C)c2ccc(Cl)cc2)CC1 ZINC000541119047 939466910 /nfs/dbraw/zinc/46/69/10/939466910.db2.gz AYVAZCZASDQQOX-QZTJIDSGSA-N 0 3 422.013 4.266 20 0 HIADHN O[C@H](CN[C@H](Cc1ccc(Cl)cc1)c1ccccn1)COCc1ccccc1F ZINC000541194779 939485123 /nfs/dbraw/zinc/48/51/23/939485123.db2.gz VMPNDQHNKFJOKN-NFBKMPQASA-N 0 3 414.908 4.325 20 0 HIADHN COc1ccc(F)cc1[C@@H](C)N[C@@H](C)CC(=O)Nc1ccc(NC(=O)C2CC2)cc1 ZINC000541212652 939485893 /nfs/dbraw/zinc/48/58/93/939485893.db2.gz VDACXGJELRAWRY-LSDHHAIUSA-N 0 3 413.493 4.251 20 0 HIADHN CC(C)(C)N1CC[C@@H](NCc2cc(C(N)=O)cs2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000541247691 939487460 /nfs/dbraw/zinc/48/74/60/939487460.db2.gz NRYNCHCMLXGPJJ-QZTJIDSGSA-N 0 3 409.958 4.343 20 0 HIADHN C[C@@H](N[C@H](Cc1ccc(C(F)(F)F)cc1)C(N)=O)c1cccc(OC(F)F)c1 ZINC000541328266 939491057 /nfs/dbraw/zinc/49/10/57/939491057.db2.gz SDQNDQUZAQPXNF-BDJLRTHQSA-N 0 3 402.363 4.054 20 0 HIADHN Cc1cc(CNCc2ccc(C(=O)N3C[C@H](C)O[C@@H](C)C3)cc2)cc2cccnc12 ZINC000541389000 939503280 /nfs/dbraw/zinc/50/32/80/939503280.db2.gz LSPQCKHQXQXTRN-OALUTQOASA-N 0 3 403.526 4.082 20 0 HIADHN CCN(C(=O)c1cnn(CCC(F)(F)F)c1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000541393704 939504550 /nfs/dbraw/zinc/50/45/50/939504550.db2.gz MCIPXIHWJWOFQT-LPHOPBHVSA-N 0 3 408.468 4.133 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3CC[C@@H](c4cccc(C)c4)C3)c(C)c2)CC1 ZINC000541429832 939514260 /nfs/dbraw/zinc/51/42/60/939514260.db2.gz CQBPUOPRSFAXOS-JOCHJYFZSA-N 0 3 406.574 4.467 20 0 HIADHN CN1CC[C@H](NC(=O)[C@H]2CCn3c(cnc3C3CCCCC3)C2)[C@@H]1c1ccccc1 ZINC000541454467 939520757 /nfs/dbraw/zinc/52/07/57/939520757.db2.gz NBBOZEODVXITAT-PMVMPFDFSA-N 0 3 406.574 4.055 20 0 HIADHN Cc1cc(-c2nc(C3CC3)no2)ccc1NC(=O)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000541505656 939539043 /nfs/dbraw/zinc/53/90/43/939539043.db2.gz FUWBMMDGXCDBHQ-FQEVSTJZSA-N 0 3 417.513 4.318 20 0 HIADHN O=C(c1ccccc1)N1CCC(CN[C@@H](c2ccc(F)cc2)c2ccccn2)CC1 ZINC000541544065 939549234 /nfs/dbraw/zinc/54/92/34/939549234.db2.gz OYZHNYOWXBWLPN-DEOSSOPVSA-N 0 3 403.501 4.452 20 0 HIADHN CCN1CCN(Cc2ccc(CN[C@H](c3ccc(F)cc3)c3ccccn3)cc2)CC1 ZINC000541545716 939550304 /nfs/dbraw/zinc/55/03/04/939550304.db2.gz JSFBPVKSDWMJAY-AREMUKBSSA-N 0 3 418.560 4.237 20 0 HIADHN C[C@@H](NCC(=O)Nc1nnc(-c2ccco2)o1)[C@@H](C)c1ccccc1C(F)(F)F ZINC000541637254 939579478 /nfs/dbraw/zinc/57/94/78/939579478.db2.gz QTXBIZUGPWOYKZ-VXGBXAGGSA-N 0 3 408.380 4.069 20 0 HIADHN NC(=O)C[C@@H](NCC(=O)Nc1ccccc1Sc1ccccc1)C1CCCCC1 ZINC000541636692 939579727 /nfs/dbraw/zinc/57/97/27/939579727.db2.gz GJIFADBUIZSKRJ-HXUWFJFHSA-N 0 3 411.571 4.190 20 0 HIADHN COc1ccc(-c2nc(NC(=O)CN[C@@H](C)[C@H]3COc4ccccc43)sc2C)cc1 ZINC000541697919 939608039 /nfs/dbraw/zinc/60/80/39/939608039.db2.gz QJJPFTWQWVXPTJ-IFXJQAMLSA-N 0 3 423.538 4.220 20 0 HIADHN CCc1ccc([C@@H](NC(=O)CN2CCC3(CCOCC3)[C@H]2C)c2cccs2)cc1 ZINC000541718321 939613982 /nfs/dbraw/zinc/61/39/82/939613982.db2.gz OCIBLMDMQCQOLV-WZONZLPQSA-N 0 3 412.599 4.407 20 0 HIADHN COc1cc(C)c(CN2CCC(C(=O)N(Cc3ccccc3)C3CC3)CC2)c(C)n1 ZINC000541927856 939656137 /nfs/dbraw/zinc/65/61/37/939656137.db2.gz OPSLBPKXQWWDAN-UHFFFAOYSA-N 0 3 407.558 4.110 20 0 HIADHN Cc1ccccc1[C@H](CO)NC[C@@H](O)CO[C@H](c1ccccc1)c1ccccc1C ZINC000541982238 939669674 /nfs/dbraw/zinc/66/96/74/939669674.db2.gz IAJBMGJBLGFRIE-ZSQFBXSQSA-N 0 3 405.538 4.094 20 0 HIADHN CCN1CC[C@@H](NCc2cnn(Cc3ccccc3)c2)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000541993904 939672481 /nfs/dbraw/zinc/67/24/81/939672481.db2.gz GECVVDCVZHPOEB-GGAORHGYSA-N 0 3 414.475 4.274 20 0 HIADHN COc1c(NC(=O)C(Cc2c(C)cc(C)cc2C)C(F)(F)F)cccc1C(N)=O ZINC000542018893 939688353 /nfs/dbraw/zinc/68/83/53/939688353.db2.gz GUCFTZNKJLNMNO-INIZCTEOSA-N 0 3 408.420 4.079 20 0 HIADHN COC(=O)[C@H](NC1CCN([C@H](C)c2ccncc2)CC1)c1ccccc1C(F)(F)F ZINC000542100747 939713012 /nfs/dbraw/zinc/71/30/12/939713012.db2.gz KVTIZJTVRZZDTD-FOIQADDNSA-N 0 3 421.463 4.130 20 0 HIADHN O=C(CC1CC(c2ccccc2)C1)Nc1ccc(C(=O)NCCN2CCCC2)cc1 ZINC000542144090 939729046 /nfs/dbraw/zinc/72/90/46/939729046.db2.gz UJHACUJXSOVNFR-UHFFFAOYSA-N 0 3 405.542 4.035 20 0 HIADHN CS(=O)(=O)Cc1cccc(CN[C@@H]2CCCc3c(Br)cccc32)c1 ZINC000542153587 939733559 /nfs/dbraw/zinc/73/35/59/939733559.db2.gz IOCHIFPTUCRUBW-LJQANCHMSA-N 0 3 408.361 4.161 20 0 HIADHN COC(=O)CN1CCC(N[C@@H](c2ccc(Cl)cc2)c2ccccc2Cl)CC1 ZINC000542169490 939742229 /nfs/dbraw/zinc/74/22/29/939742229.db2.gz PRJXZHDYPANHKX-NRFANRHFSA-N 0 3 407.341 4.310 20 0 HIADHN CC(C)(C)OC(=O)CCCCN1CCC[C@H](NC(=O)c2cc3ccccc3o2)C1 ZINC000542209512 939757308 /nfs/dbraw/zinc/75/73/08/939757308.db2.gz MFYPJDVQUCSLKA-SFHVURJKSA-N 0 3 400.519 4.139 20 0 HIADHN C[C@@H](N[C@H](Cc1ccc(C(F)(F)F)cc1)C(N)=O)c1cccc(N2CCCC2)c1 ZINC000542231887 939766702 /nfs/dbraw/zinc/76/67/02/939766702.db2.gz AYPTWAYIPSULQS-FOIQADDNSA-N 0 3 405.464 4.053 20 0 HIADHN Fc1cccc(CCN2CCC[C@@H](c3nnc4ccc(C(F)(F)F)cn43)C2)c1F ZINC000542281171 939784462 /nfs/dbraw/zinc/78/44/62/939784462.db2.gz YOGYEQFQXCVJHF-CQSZACIVSA-N 0 3 410.390 4.448 20 0 HIADHN C[C@@H](CN(C)C[C@H](O)COc1ccc(Cl)cc1Br)c1nccs1 ZINC000542307301 939793867 /nfs/dbraw/zinc/79/38/67/939793867.db2.gz PZJGMRMTEMKGGW-AAEUAGOBSA-N 0 3 419.772 4.034 20 0 HIADHN C[C@@]1(NCC(=O)Nc2cc(C(F)(F)F)cc(C(F)(F)F)c2)CCO[C@H]1C1CC1 ZINC000542309037 939794371 /nfs/dbraw/zinc/79/43/71/939794371.db2.gz DNXLOMTWLJQVLW-JKSUJKDBSA-N 0 3 410.358 4.210 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)CN2CC[C@H](c3cccc(C)c3)C2)cc1OC ZINC000542318940 939798747 /nfs/dbraw/zinc/79/87/47/939798747.db2.gz BRAJJHDWFNAWPZ-VXKWHMMOSA-N 0 3 408.542 4.165 20 0 HIADHN Cc1cc(CNCc2ccc(S(=O)(=O)N3CCC[C@H](C)C3)cc2)cc2cccnc12 ZINC000542321943 939800008 /nfs/dbraw/zinc/80/00/08/939800008.db2.gz ONPQAGQFSGEBLB-SFHVURJKSA-N 0 3 423.582 4.254 20 0 HIADHN COc1cc(OC)cc(N2CC[C@H](CN[C@H](c3ccc(F)cc3)c3ccccn3)C2)c1 ZINC000542475081 939829390 /nfs/dbraw/zinc/82/93/90/939829390.db2.gz PGKGMEOHDGIAFQ-IQGLISFBSA-N 0 3 421.516 4.443 20 0 HIADHN O=C1CC[C@H](NCc2ccc(-n3ccc(C(F)(F)F)n3)cc2)c2ccccc2N1 ZINC000542479620 939830443 /nfs/dbraw/zinc/83/04/43/939830443.db2.gz VRKRHPNBNXLUGS-KRWDZBQOSA-N 0 3 400.404 4.454 20 0 HIADHN COC(=O)c1cc(CNC2CCN(Cc3cc(Cl)cc(Cl)c3)CC2)oc1C ZINC000542484650 939831574 /nfs/dbraw/zinc/83/15/74/939831574.db2.gz NOSLAAVMNQDMFD-UHFFFAOYSA-N 0 3 411.329 4.436 20 0 HIADHN COC(=O)c1ccc(CNC(=O)[C@H](C)N[C@@H](Cc2ccccc2)c2cccs2)cc1 ZINC000542521037 939836680 /nfs/dbraw/zinc/83/66/80/939836680.db2.gz JIANSRPTDBDJCN-UWJYYQICSA-N 0 3 422.550 4.113 20 0 HIADHN COC(=O)C[C@@H](N[C@@H](C)C(=O)N(c1nccs1)C1CCCCC1)C1CCCCC1 ZINC000542531111 939838567 /nfs/dbraw/zinc/83/85/67/939838567.db2.gz KAJBQFOPVYIDON-QFBILLFUSA-N 0 3 421.607 4.299 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)N[C@@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000542545353 939841651 /nfs/dbraw/zinc/84/16/51/939841651.db2.gz UFUKJOPGKOJONV-VJBWXMMDSA-N 0 3 411.521 4.182 20 0 HIADHN CCN1CCN(CCCNC(=O)c2cc(Cl)ccc2SC2CCCC2)CC1 ZINC000542609087 939847936 /nfs/dbraw/zinc/84/79/36/939847936.db2.gz SCTNYBFEGFFCLE-UHFFFAOYSA-N 0 3 410.027 4.132 20 0 HIADHN C[C@H](NCC(=O)Nc1cc(C(C)(C)C)nn1-c1ccccc1)[C@H]1COc2ccccc21 ZINC000542626214 939850077 /nfs/dbraw/zinc/85/00/77/939850077.db2.gz GXHJZUFGAIGAAT-FXAWDEMLSA-N 0 3 418.541 4.263 20 0 HIADHN C[C@H](NCC(=O)N[C@H](Cc1ccccc1)c1ccccc1)[C@@H]1COc2ccccc21 ZINC000542628144 939850234 /nfs/dbraw/zinc/85/02/34/939850234.db2.gz GMCBKSPQHFEQAC-WDJPJFJCSA-N 0 3 400.522 4.241 20 0 HIADHN C[C@@H]1C[C@@H](c2cccnc2)N(C(=O)Nc2ccc(CCN3CCSCC3)cc2)C1 ZINC000542669488 939852936 /nfs/dbraw/zinc/85/29/36/939852936.db2.gz JIMBOAKBAQCQEW-GCJKJVERSA-N 0 3 410.587 4.288 20 0 HIADHN CC[C@H](CNC(=O)Nc1csc(-c2ccccn2)n1)N1CCc2ccccc2C1 ZINC000542686151 939854080 /nfs/dbraw/zinc/85/40/80/939854080.db2.gz HCWTVCLSCDQRBR-GOSISDBHSA-N 0 3 407.543 4.164 20 0 HIADHN CCOC(=O)c1nn(-c2ccccc2)cc1CN[C@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000542689884 939854485 /nfs/dbraw/zinc/85/44/85/939854485.db2.gz YUMSVCAHAOXNLW-RBBKRZOGSA-N 0 3 423.488 4.198 20 0 HIADHN CCc1ccc([C@H](NCCc2ccc(C)nc2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000542774179 939860198 /nfs/dbraw/zinc/86/01/98/939860198.db2.gz FKFDUDKPXLYMMA-DEOSSOPVSA-N 0 3 408.567 4.278 20 0 HIADHN CS[C@@H]1CN(C(=O)c2oc3ccc(Br)cc3c2C)C[C@@H]1N1CCCC1 ZINC000542772935 939860239 /nfs/dbraw/zinc/86/02/39/939860239.db2.gz JRCVGFPGYXSKDA-DOTOQJQBSA-N 0 3 423.376 4.156 20 0 HIADHN CN1CCN(CCCSc2nc3cc(Cl)ccc3n2Cc2ccccc2)CC1 ZINC000542815644 939861242 /nfs/dbraw/zinc/86/12/42/939861242.db2.gz PTTHNHKIBPOAOF-UHFFFAOYSA-N 0 3 415.006 4.468 20 0 HIADHN COc1cc(C)c(CN2CCC[C@@H](c3n[nH]cc3NC(=O)c3ccccc3)C2)c(C)n1 ZINC000542849557 939863052 /nfs/dbraw/zinc/86/30/52/939863052.db2.gz CYGMVUUMXVUNSO-LJQANCHMSA-N 0 3 419.529 4.062 20 0 HIADHN COc1ccccc1[C@H](C)N(C)C(=O)CN[C@@H](C)c1ccc(-n2ccnc2C)cc1 ZINC000542883743 939865246 /nfs/dbraw/zinc/86/52/46/939865246.db2.gz WQJHTXLCLCHNSZ-ROUUACIJSA-N 0 3 406.530 4.060 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)NCC(=O)NCc2ccc(COC(C)C)cc2)cc1 ZINC000542887149 939865482 /nfs/dbraw/zinc/86/54/82/939865482.db2.gz VQOMTJBFKIVRGK-IBGZPJMESA-N 0 3 420.557 4.073 20 0 HIADHN Cc1cc(NC(=O)C[C@@H]2CCO[C@@H](C(C)C)C2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000542886658 939865528 /nfs/dbraw/zinc/86/55/28/939865528.db2.gz JQMJQESAETVNES-XPWALMASSA-N 0 3 424.589 4.418 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)C[C@@H]1CCO[C@H](C(C)C)C1 ZINC000542892674 939865858 /nfs/dbraw/zinc/86/58/58/939865858.db2.gz CXFLFUUNUNYXEX-ZLNRFVROSA-N 0 3 424.589 4.418 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)C[C@H]1CCO[C@H](C(C)C)C1 ZINC000542892676 939874591 /nfs/dbraw/zinc/87/45/91/939874591.db2.gz CXFLFUUNUNYXEX-ZRBLBEILSA-N 0 3 424.589 4.418 20 0 HIADHN CC(=O)c1ccc(NC(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)cc1Cl ZINC000543037539 939899901 /nfs/dbraw/zinc/89/99/01/939899901.db2.gz SEJFUXILDMVJQA-HZPDHXFCSA-N 0 3 421.969 4.286 20 0 HIADHN COC(=O)c1cccc(NC(=O)C[C@@H](C)N[C@H]2CCSc3ccc(F)cc32)c1 ZINC000543068136 939921268 /nfs/dbraw/zinc/92/12/68/939921268.db2.gz UEWBGAXZVVWBFF-ACJLOTCBSA-N 0 3 402.491 4.156 20 0 HIADHN CC(C)Oc1ccccc1CN[C@@H](C)CC(=O)Nc1ccc(NC(=O)C2CC2)cc1 ZINC000543070932 939923273 /nfs/dbraw/zinc/92/32/73/939923273.db2.gz MBWKBLMRRNXVBO-KRWDZBQOSA-N 0 3 409.530 4.329 20 0 HIADHN C[C@H](CC(=O)Nc1ccc(NC(=O)C2CC2)cc1)N[C@H](C)c1ccc(F)cc1F ZINC000543072289 939925213 /nfs/dbraw/zinc/92/52/13/939925213.db2.gz KTVOKEJGWURNME-ZIAGYGMSSA-N 0 3 401.457 4.381 20 0 HIADHN O=C(NCCN1CCCC1)c1ccc(NC(=O)c2ccc(SC3CC3)cc2)cc1 ZINC000543078864 939930135 /nfs/dbraw/zinc/93/01/35/939930135.db2.gz UIWFQJZTEZREPW-UHFFFAOYSA-N 0 3 409.555 4.019 20 0 HIADHN CCOc1ccc(C(C)(C)C(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)cc1OCC ZINC000543095296 939941832 /nfs/dbraw/zinc/94/18/32/939941832.db2.gz LRGUTRNRLURFHC-REWPJTCUSA-N 0 3 410.558 4.323 20 0 HIADHN O=C(Cc1ccccc1)N1CCc2ccc(NC(=O)[C@@H]3CCCN3C3CCCC3)cc21 ZINC000563758299 945287580 /nfs/dbraw/zinc/28/75/80/945287580.db2.gz CXCSPEUUVMQXBA-QHCPKHFHSA-N 0 3 417.553 4.164 20 0 HIADHN Cc1cc(Br)cn2c(CN[C@@H](c3ccccc3)[C@@H]3CCOC3)cnc12 ZINC000543238819 940004881 /nfs/dbraw/zinc/00/48/81/940004881.db2.gz OYHYJMGYVNTTCN-APWZRJJASA-N 0 3 400.320 4.273 20 0 HIADHN COc1ccc(Oc2ccc(CNCc3ccc(N4CCO[C@@H](C)C4)nc3)cc2)cc1 ZINC000543245506 940006878 /nfs/dbraw/zinc/00/68/78/940006878.db2.gz SPZHZDHNDQOFJI-IBGZPJMESA-N 0 3 419.525 4.397 20 0 HIADHN CN1CC[C@H](NC(=O)CCc2cc(F)ccc2Br)[C@@H]1c1ccccc1 ZINC000543313158 940026153 /nfs/dbraw/zinc/02/61/53/940026153.db2.gz YZGWEGYBLUBLHK-ICSRJNTNSA-N 0 3 405.311 4.082 20 0 HIADHN CC(C)Oc1c(F)cc(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2)cc1F ZINC000543325404 940031876 /nfs/dbraw/zinc/03/18/76/940031876.db2.gz WFSATPOXPZQITA-UHFFFAOYSA-N 0 3 409.452 4.487 20 0 HIADHN Cc1cn(C2CCCCC2)nc1NC(=O)N(CCN(C)C)Cc1ccc(F)cc1 ZINC000543328797 940032667 /nfs/dbraw/zinc/03/26/67/940032667.db2.gz IYKOOBDZZHYATF-UHFFFAOYSA-N 0 3 401.530 4.432 20 0 HIADHN FC(F)(F)c1cc(Cl)c2nnc(CN[C@@H]3CCCN(Cc4ccccc4)C3)n2c1 ZINC000543399612 940051702 /nfs/dbraw/zinc/05/17/02/940051702.db2.gz RSFNPLGSOCIUCG-MRXNPFEDSA-N 0 3 423.870 4.156 20 0 HIADHN CCc1ccc([C@H](CN2CCOCC2)NCc2cc(Br)cs2)cc1 ZINC000543403933 940053526 /nfs/dbraw/zinc/05/35/26/940053526.db2.gz HLFVBYUYRJXGJI-IBGZPJMESA-N 0 3 409.393 4.236 20 0 HIADHN COc1cc(CN2CCC(OC[C@H]3CCOC3)CC2)ccc1OCc1ccccc1 ZINC000543415295 940057868 /nfs/dbraw/zinc/05/78/68/940057868.db2.gz OPVAGFPPBZSYMH-QFIPXVFZSA-N 0 3 411.542 4.292 20 0 HIADHN C[C@@H](Cc1ccccc1)CN1CCN(CC(=O)Nc2ccccc2C(F)(F)F)CC1 ZINC000543447379 940065958 /nfs/dbraw/zinc/06/59/58/940065958.db2.gz GXBKUHLKSQSKAW-SFHVURJKSA-N 0 3 419.491 4.140 20 0 HIADHN Cc1csc([C@@H](C)CNC(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)n1 ZINC000543483867 940079156 /nfs/dbraw/zinc/07/91/56/940079156.db2.gz AJHVIXZIBNEXJR-DOTOQJQBSA-N 0 3 406.621 4.389 20 0 HIADHN C[C@H](NCC(=O)Nc1ccc(Br)cc1F)[C@H]1Oc2ccccc2[C@@H]1C ZINC000543545270 940102540 /nfs/dbraw/zinc/10/25/40/940102540.db2.gz SAKPFONVWCEGRH-ZKTNFTSUSA-N 0 3 407.283 4.070 20 0 HIADHN CN(CC(=O)NC12CC3CC(CC(C3)C1)C2)[C@@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000543560583 940108682 /nfs/dbraw/zinc/10/86/82/940108682.db2.gz IYMKWKDSJXSDDF-DMPBKHRZSA-N 0 3 400.538 4.063 20 0 HIADHN C[C@H](c1ccc(F)cc1)N(C)C(=O)CN(C)[C@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000543558962 940108784 /nfs/dbraw/zinc/10/87/84/940108784.db2.gz OQVYOXJIYNIPFT-URZJWIJPSA-N 0 3 402.485 4.336 20 0 HIADHN C[C@H]1N(CC(=O)N[C@H](c2ccccc2)c2ccc(Cl)cc2)CCC12CCOCC2 ZINC000543574863 940116389 /nfs/dbraw/zinc/11/63/89/940116389.db2.gz RMOYEBJXHPDZEG-WZONZLPQSA-N 0 3 412.961 4.437 20 0 HIADHN Brc1cccc(N2CC[C@@H](CN[C@H](c3ccccc3)c3cncnc3)C2)c1 ZINC000543601122 940127104 /nfs/dbraw/zinc/12/71/04/940127104.db2.gz VWFYXRWNHTYVME-HTAPYJJXSA-N 0 3 423.358 4.445 20 0 HIADHN COc1ccc([C@H](CN[C@@H](c2ccccc2)c2cncnc2)N2CCCCC2)cc1 ZINC000543604676 940128751 /nfs/dbraw/zinc/12/87/51/940128751.db2.gz CQCYUSSSKHXPPS-DQEYMECFSA-N 0 3 402.542 4.391 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@H]2NC[C@H](c2ccsc2)N(C)C)cc1 ZINC000543607941 940129411 /nfs/dbraw/zinc/12/94/11/940129411.db2.gz LWYUARQXRPTWSS-NJDAHSKKSA-N 0 3 406.617 4.034 20 0 HIADHN COc1c(Br)cc(Br)cc1CN(C)CCc1ccncc1 ZINC000543621610 940137099 /nfs/dbraw/zinc/13/70/99/940137099.db2.gz WRQKMCHGVISZIW-UHFFFAOYSA-N 0 3 414.141 4.290 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CCC[C@@H]1C(C)(C)O)c1ccc(C(F)(F)F)cc1 ZINC000543691671 940161185 /nfs/dbraw/zinc/16/11/85/940161185.db2.gz WVEWTTLQQJLYNV-ZWKOTPCHSA-N 0 3 415.500 4.033 20 0 HIADHN CC[C@@H](N[C@@H](C)c1ccc(NC(C)=O)cc1)c1ccccc1OCC(=O)N1CCCC1 ZINC000543773897 940181792 /nfs/dbraw/zinc/18/17/92/940181792.db2.gz IDLLDSKSLMWWJD-FDDCHVKYSA-N 0 3 423.557 4.448 20 0 HIADHN CC(C)[C@H](NCc1ccccc1CS(=O)(=O)N1CCCC1)c1ccc(F)c(F)c1 ZINC000543773701 940181858 /nfs/dbraw/zinc/18/18/58/940181858.db2.gz MGFGGMZBPSLQPT-QFIPXVFZSA-N 0 3 422.541 4.377 20 0 HIADHN CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H](c2ccc(Cl)cc2F)C(C)C)cc1 ZINC000543846948 940207093 /nfs/dbraw/zinc/20/70/93/940207093.db2.gz YLFVFMQISPGETB-LAUBAEHRSA-N 0 3 408.901 4.164 20 0 HIADHN Cc1ccnc(OC2CCN(CCCc3nc(-c4ccc(C)c(F)c4)no3)CC2)c1 ZINC000543904488 940235255 /nfs/dbraw/zinc/23/52/55/940235255.db2.gz ULVHVYDCDTUVDX-UHFFFAOYSA-N 0 3 410.493 4.364 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CCC(Oc2cc(C)ccn2)CC1)c1ccsc1 ZINC000543913355 940241527 /nfs/dbraw/zinc/24/15/27/940241527.db2.gz MRMQMFVLPJFXIM-FQEVSTJZSA-N 0 3 416.591 4.087 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CCC(c2ccc(C)nc2)CC1)c1ccsc1 ZINC000543965448 940274772 /nfs/dbraw/zinc/27/47/72/940274772.db2.gz TVHZMBVGXJBTSS-NRFANRHFSA-N 0 3 400.592 4.424 20 0 HIADHN C[C@@H](CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)N[C@H]1c2ccccc2C[C@H]1O ZINC000543994400 940288075 /nfs/dbraw/zinc/28/80/75/940288075.db2.gz KMQLZKWFWPUQIG-JVMOKEISSA-N 0 3 412.839 4.324 20 0 HIADHN CCCN1CCN(c2ccccc2CNc2ccc(Cl)c(C[S@](C)=O)c2)CC1 ZINC000544041950 940308216 /nfs/dbraw/zinc/30/82/16/940308216.db2.gz JJADWZSASIAMRT-NDEPHWFRSA-N 0 3 420.022 4.363 20 0 HIADHN COc1cc(Br)c(CNCCc2ccc(F)c(F)c2F)cc1OC ZINC000544174523 940343873 /nfs/dbraw/zinc/34/38/73/940343873.db2.gz JWJAAXPTNYCIHO-UHFFFAOYSA-N 0 3 404.226 4.216 20 0 HIADHN CCCN(C(=O)NCC[C@@H]1CCO[C@H](C)C1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000544330094 940392217 /nfs/dbraw/zinc/39/22/17/940392217.db2.gz RCQIHCVLNQTPIL-XPNTWCBSSA-N 0 3 401.595 4.278 20 0 HIADHN O=C(Nc1cccc(Cl)c1)N1CCCN(Cc2cc(-n3ccnc3)cs2)CC1 ZINC000544349477 940396729 /nfs/dbraw/zinc/39/67/29/940396729.db2.gz ZOMKHTONFYFZAV-UHFFFAOYSA-N 0 3 415.950 4.327 20 0 HIADHN COc1ccc(CN[C@H](CN2CCOCC2)c2ccccc2C)c(C(F)(F)F)c1 ZINC000544356645 940399056 /nfs/dbraw/zinc/39/90/56/940399056.db2.gz HVIVCSUITTXZBA-OAQYLSRUSA-N 0 3 408.464 4.186 20 0 HIADHN Fc1ccc([C@@H](NC[C@H](c2ccc(F)cc2)N2CCOCC2)c2cccnc2)cc1 ZINC000544363213 940402153 /nfs/dbraw/zinc/40/21/53/940402153.db2.gz UHULCCFIXUJGQR-DNQXCXABSA-N 0 3 409.480 4.112 20 0 HIADHN Cc1nn(-c2ccccc2)c(Oc2cccc(F)c2)c1CN1C[C@@H]2CC[C@H](O)[C@@H]2C1 ZINC000544368151 940403622 /nfs/dbraw/zinc/40/36/22/940403622.db2.gz GSDNKIJESAEVJX-IMRHEYAYSA-N 0 3 407.489 4.315 20 0 HIADHN Cc1nc(-c2ccccc2F)sc1[C@H](C)N[C@H]1CCCN(Cc2ccccn2)C1=O ZINC000544386033 940408197 /nfs/dbraw/zinc/40/81/97/940408197.db2.gz RKERHIPPCOQCND-YWZLYKJASA-N 0 3 424.545 4.494 20 0 HIADHN Cc1ccsc1[C@H](Cc1ccccc1)NCC(=O)Nc1ccc(C(=O)N(C)C)cc1 ZINC000544415397 940417150 /nfs/dbraw/zinc/41/71/50/940417150.db2.gz PTULXSOAIIWFFQ-NRFANRHFSA-N 0 3 421.566 4.270 20 0 HIADHN CN(C)S(=O)(=O)c1ccc(CN[C@@H](Cc2ccccc2)c2cccs2)cc1 ZINC000544415507 940417447 /nfs/dbraw/zinc/41/74/47/940417447.db2.gz LTCNADUHCOXNCU-FQEVSTJZSA-N 0 3 400.569 4.072 20 0 HIADHN CC[C@@H](NC[C@@H](O)COc1ccc(Oc2ccccc2)cc1)c1c(C)nn(C)c1C ZINC000544417271 940417633 /nfs/dbraw/zinc/41/76/33/940417633.db2.gz SARSVQKURAKYRO-AUSIDOKSSA-N 0 3 409.530 4.310 20 0 HIADHN CC[C@@H](NC[C@H](O)COc1ccc(Oc2ccccc2)cc1)c1c(C)nn(C)c1C ZINC000544417273 940417920 /nfs/dbraw/zinc/41/79/20/940417920.db2.gz SARSVQKURAKYRO-WMZHIEFXSA-N 0 3 409.530 4.310 20 0 HIADHN CC[C@@H](NC[C@H](O)COc1ccc(Cl)cc1Br)c1c(C)noc1C ZINC000544458635 940440038 /nfs/dbraw/zinc/44/00/38/940440038.db2.gz QIHIWPCSCNTXHM-DZGCQCFKSA-N 0 3 417.731 4.188 20 0 HIADHN C[C@H](NCC(=O)NC(=O)NCC(F)(F)F)c1ccc(-c2ccc(Cl)cc2)s1 ZINC000544523729 940471114 /nfs/dbraw/zinc/47/11/14/940471114.db2.gz AFPFERPWVUEEPU-JTQLQIEISA-N 0 3 419.856 4.107 20 0 HIADHN CCCOc1cccc(CNC(=O)CN(C)[C@@H]2CCO[C@H](c3ccc(F)cc3)C2)c1 ZINC000544530970 940473523 /nfs/dbraw/zinc/47/35/23/940473523.db2.gz XVVLQHYFKPBGBE-GGAORHGYSA-N 0 3 414.521 4.083 20 0 HIADHN CCC[C@@H](NCc1ccccc1CN1C(=O)NC2(CCCCC2)C1=O)c1cccnc1 ZINC000544567464 940481066 /nfs/dbraw/zinc/48/10/66/940481066.db2.gz SRRFVTNCXZTMSQ-JOCHJYFZSA-N 0 3 420.557 4.467 20 0 HIADHN CS[C@@H]1CN(C(=O)c2c(C)onc2-c2c(F)cccc2Cl)C[C@@H]1N1CCCC1 ZINC000544684970 940502131 /nfs/dbraw/zinc/50/21/31/940502131.db2.gz RDMSQLMXEOMCPY-JKSUJKDBSA-N 0 3 423.941 4.094 20 0 HIADHN CCO[C@@H]1C[C@@H](NCc2cccc(NC(=O)c3ccccc3Cl)c2)[C@@]12CCCO2 ZINC000544709978 940505530 /nfs/dbraw/zinc/50/55/30/940505530.db2.gz NGSLDDOOSXFKAH-XPNTWCBSSA-N 0 3 414.933 4.409 20 0 HIADHN CCNC(=O)COc1cccc(CN[C@H](Cc2cccnc2)c2ccc(Cl)cc2)c1 ZINC000544827814 940517812 /nfs/dbraw/zinc/51/78/12/940517812.db2.gz ORPQWGQXBBBXCY-HSZRJFAPSA-N 0 3 423.944 4.324 20 0 HIADHN CO[C@H](c1ccccc1Cl)[C@@H](C)N[C@@H](C)c1cccc(S(=O)(=O)N(C)C)c1 ZINC000544828130 940518040 /nfs/dbraw/zinc/51/80/40/940518040.db2.gz OIZFYMGXPYAJCA-MDOVXXIYSA-N 0 3 410.967 4.017 20 0 HIADHN CC[C@@H](CC(F)(F)F)NCc1cc(I)c(OC)c(OC)c1 ZINC000544838542 940518427 /nfs/dbraw/zinc/51/84/27/940518427.db2.gz ZXBJVVZMJSVYSF-JTQLQIEISA-N 0 3 417.209 4.129 20 0 HIADHN CCN(C(=O)CCCc1nnc(-c2ccccc2)o1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000544850941 940519106 /nfs/dbraw/zinc/51/91/06/940519106.db2.gz HIJWEXQSTPEATE-JOCHJYFZSA-N 0 3 418.541 4.182 20 0 HIADHN Fc1cccc(CN2CCC[C@@H](c3nc(-c4ccc(N5CCOCC5)cc4)no3)C2)c1 ZINC000544910018 940524260 /nfs/dbraw/zinc/52/42/60/940524260.db2.gz OIANUBWJTIQYIG-HXUWFJFHSA-N 0 3 422.504 4.092 20 0 HIADHN CN1CCN(c2ncccc2CN[C@@H](Cc2ccc(F)cc2)c2ccccc2)CC1 ZINC000563933984 945328740 /nfs/dbraw/zinc/32/87/40/945328740.db2.gz AUPAVUUKHQXCTR-DEOSSOPVSA-N 0 3 404.533 4.046 20 0 HIADHN C[C@@H](CCN1C(=O)c2ccccc2C1=O)N[C@H](CC(F)(F)F)c1ccc(F)cc1 ZINC000545302462 940560845 /nfs/dbraw/zinc/56/08/45/940560845.db2.gz PMFGWNGCIRAZIQ-SCLBCKFNSA-N 0 3 408.395 4.484 20 0 HIADHN CN(C)CCN(CC1CCCCC1)C(=O)N[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000545340292 940562868 /nfs/dbraw/zinc/56/28/68/940562868.db2.gz DTHGDCFTOWHFFR-FGZHOGPDSA-N 0 3 405.558 4.199 20 0 HIADHN CCN1CCN(Cc2ccc(CNC(=O)Nc3ccccc3CSC)cc2)CC1 ZINC000545428025 940569323 /nfs/dbraw/zinc/56/93/23/940569323.db2.gz YSIFXWQPYCXSGO-UHFFFAOYSA-N 0 3 412.603 4.009 20 0 HIADHN CS(=O)(=O)Nc1ccc(CN[C@@H](Cc2cccnc2)c2ccc(Cl)cc2)cc1 ZINC000545458580 940570818 /nfs/dbraw/zinc/57/08/18/940570818.db2.gz ZIAYDCCTNKYCBW-NRFANRHFSA-N 0 3 415.946 4.180 20 0 HIADHN CCN(C(=O)c1cccc(NC(=O)[C@@H]2C[C@@H]2C)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000545476606 940571461 /nfs/dbraw/zinc/57/14/61/940571461.db2.gz DXFZOSFOYKESFX-OFAXGOBFSA-N 0 3 405.542 4.018 20 0 HIADHN O=C(c1ccccc1Cl)N1CCC(NCc2nc3ccccc3n2C2CC2)CC1 ZINC000545560127 940574677 /nfs/dbraw/zinc/57/46/77/940574677.db2.gz VSZGSIKFHDNBFK-UHFFFAOYSA-N 0 3 408.933 4.419 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(-c4ccc(OC(C)(C)C)cc4)n3)cn2)CC1 ZINC000545650181 940578894 /nfs/dbraw/zinc/57/88/94/940578894.db2.gz VNHIJDNEZNDTEC-UHFFFAOYSA-N 0 3 407.518 4.118 20 0 HIADHN Cc1cccn2cc(Cc3noc([C@H]4CCCN(Cc5cccc(F)c5)C4)n3)nc12 ZINC000545677746 940580188 /nfs/dbraw/zinc/58/01/88/940580188.db2.gz DGQMNCLISHUVNF-SFHVURJKSA-N 0 3 405.477 4.135 20 0 HIADHN Cc1cc(C(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)c(C)n1Cc1ccncc1 ZINC000545862700 940642209 /nfs/dbraw/zinc/64/22/09/940642209.db2.gz TWBWDYOWGSLMOY-XXBNENTESA-N 0 3 402.542 4.114 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)[C@H](C)c1c(C)nn(CC(F)(F)F)c1C)c1ccco1 ZINC000563986614 945337007 /nfs/dbraw/zinc/33/70/07/945337007.db2.gz AYYJEKXZECIHPY-WOSRLPQWSA-N 0 3 414.472 4.004 20 0 HIADHN CC(=O)NC1CCC(N[C@H](c2ccc3c(c2)OCCO3)c2ccccc2Cl)CC1 ZINC000545916966 940657848 /nfs/dbraw/zinc/65/78/48/940657848.db2.gz KWPSPIHGQBGLME-QPFKGPCDSA-N 0 3 414.933 4.238 20 0 HIADHN Cc1cn(-c2ccccc2)nc1C(=O)NC[C@@H](c1ccc(OC(C)C)cc1)N(C)C ZINC000563991260 945338643 /nfs/dbraw/zinc/33/86/43/945338643.db2.gz IZHGMEOFGHTHOA-QFIPXVFZSA-N 0 3 406.530 4.001 20 0 HIADHN C[C@@H]1CCCC[N@@H+]1Cc1ccc([N-]S(=O)(=O)c2ccccc2Cn2ccnc2)cc1 ZINC000546087449 940695643 /nfs/dbraw/zinc/69/56/43/940695643.db2.gz GGZNNLOWJPMZJG-LJQANCHMSA-N 0 3 424.570 4.107 20 0 HIADHN C[C@@H]1CCCC[N@H+]1Cc1ccc([N-]S(=O)(=O)c2ccccc2Cn2ccnc2)cc1 ZINC000546087449 940695650 /nfs/dbraw/zinc/69/56/50/940695650.db2.gz GGZNNLOWJPMZJG-LJQANCHMSA-N 0 3 424.570 4.107 20 0 HIADHN CS[C@@H]1CN(C(=O)Nc2cccc(Cl)c2SCC(F)F)C[C@H]1N(C)C ZINC000546130044 940707818 /nfs/dbraw/zinc/70/78/18/940707818.db2.gz JIDJZLDIBFZXCQ-CHWSQXEVSA-N 0 3 409.955 4.207 20 0 HIADHN CCN(C(=O)c1nn(-c2ccccc2)c2c1CCC2)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000546184841 940723948 /nfs/dbraw/zinc/72/39/48/940723948.db2.gz VGBGBGSIUUSMDY-JOCHJYFZSA-N 0 3 414.553 4.098 20 0 HIADHN CCCN(C(=O)NCCC[C@H]1CCCCO1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000546203689 940728819 /nfs/dbraw/zinc/72/88/19/940728819.db2.gz NLYBYHDISIEBKI-DHIUTWEWSA-N 0 3 401.595 4.422 20 0 HIADHN Cc1ccc(Cc2noc([C@@]3(C(F)(F)F)CCN(Cc4ccccc4)C3)n2)cn1 ZINC000546344767 940796119 /nfs/dbraw/zinc/79/61/19/940796119.db2.gz CWCSQZDYEKKHPY-HXUWFJFHSA-N 0 3 402.420 4.070 20 0 HIADHN C[C@H](CCc1ccccc1F)c1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1 ZINC000546362870 940802329 /nfs/dbraw/zinc/80/23/29/940802329.db2.gz KCAOHIPNGGYTSB-QGZVFWFLSA-N 0 3 409.509 4.149 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(-c4cc(Cl)sc4Cl)n3)cn2)CC1 ZINC000546365091 940802489 /nfs/dbraw/zinc/80/24/89/940802489.db2.gz HSYAEUGTGSLHKA-UHFFFAOYSA-N 0 3 410.330 4.309 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](NC2Cc3ccccc3C2)c2ccc(F)c(F)c2)c1 ZINC000546573464 940855910 /nfs/dbraw/zinc/85/59/10/940855910.db2.gz MCZPQBZDUPSROI-HSZRJFAPSA-N 0 3 413.489 4.215 20 0 HIADHN Cc1[nH]c(=O)c(C(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)cc1-c1ccccc1 ZINC000546614239 940861167 /nfs/dbraw/zinc/86/11/67/940861167.db2.gz MKCITSHLYIWAHN-SBUREZEXSA-N 0 3 401.510 4.013 20 0 HIADHN CC(C)c1c(C(=O)N[C@@H](CN(C)Cc2ccccc2)C(C)C)cnn1-c1ccccn1 ZINC000546719783 940872559 /nfs/dbraw/zinc/87/25/59/940872559.db2.gz ABKIGFOOLCTDCK-QFIPXVFZSA-N 0 3 419.573 4.277 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)N[C@H](CCc1ccccc1)C(F)(F)F ZINC000546821139 940888258 /nfs/dbraw/zinc/88/82/58/940888258.db2.gz WZVFDEKBWXSKHI-GOSISDBHSA-N 0 3 413.509 4.385 20 0 HIADHN O=C(NCc1nc2ccccc2n1C1CC1)NC[C@@H](c1cccs1)N1CCCC1 ZINC000546824921 940889129 /nfs/dbraw/zinc/88/91/29/940889129.db2.gz JEQFSLAFBGIJPI-IBGZPJMESA-N 0 3 409.559 4.069 20 0 HIADHN CC(C)Cc1ccc([C@H](CNC(=O)[C@H]2CCc3nc(C(C)C)[nH]c3C2)N(C)C)cc1 ZINC000564030241 945357600 /nfs/dbraw/zinc/35/76/00/945357600.db2.gz VJCNIHBGHNAWDJ-REWPJTCUSA-N 0 3 410.606 4.256 20 0 HIADHN Cc1c([C@@H](C)NCCC[C@@H]2CCCCO2)nnn1-c1cccc(Br)c1 ZINC000546872016 940898894 /nfs/dbraw/zinc/89/88/94/940898894.db2.gz WLGSXJTUPCIPHJ-KDOFPFPSSA-N 0 3 407.356 4.338 20 0 HIADHN CCN(C(=O)c1cc(C2CC2)nc2onc(C)c21)[C@H]1CCN(Cc2ccccc2)C1 ZINC000546893182 940903403 /nfs/dbraw/zinc/90/34/03/940903403.db2.gz IGPFHHKKKFMQLJ-IBGZPJMESA-N 0 3 404.514 4.145 20 0 HIADHN CCN(C(=O)c1ccc(-c2n[nH]c(C3CC3)n2)cc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000546906656 940908858 /nfs/dbraw/zinc/90/88/58/940908858.db2.gz FNDAQQSRPLTWHQ-JOCHJYFZSA-N 0 3 415.541 4.086 20 0 HIADHN O=C1CCCN1c1cccc(-c2noc([C@H]3CCCN(Cc4cccc(F)c4)C3)n2)c1 ZINC000546983753 940938556 /nfs/dbraw/zinc/93/85/56/940938556.db2.gz JEPULFDMJGYSBB-IBGZPJMESA-N 0 3 420.488 4.382 20 0 HIADHN CCOc1ccc(-c2noc([C@@]3(C(F)(F)F)CCN(Cc4ccccc4)C3)n2)cn1 ZINC000547082155 940987698 /nfs/dbraw/zinc/98/76/98/940987698.db2.gz MTPVUVNQYRMWFQ-HXUWFJFHSA-N 0 3 418.419 4.236 20 0 HIADHN O=C1C[C@H](c2noc([C@H]3CCCN(Cc4cccc(F)c4)C3)n2)CN1c1ccccc1 ZINC000547133671 941007297 /nfs/dbraw/zinc/00/72/97/941007297.db2.gz GGZXJMAAPBURQQ-OALUTQOASA-N 0 3 420.488 4.109 20 0 HIADHN Cc1cc(-c2noc(-c3ccc(CN4C[C@@H](C)O[C@H](C)C4)cc3)n2)cc2nc[nH]c21 ZINC000547150973 941012399 /nfs/dbraw/zinc/01/23/99/941012399.db2.gz LJTXNJZHYYVCMW-HZPDHXFCSA-N 0 3 403.486 4.198 20 0 HIADHN Cc1cc(C(=O)NCC(C)(C)N2CCc3ccccc3C2)c(C)n1Cc1ccncc1 ZINC000547273516 941050126 /nfs/dbraw/zinc/05/01/26/941050126.db2.gz CNRDODVEFZFBNO-UHFFFAOYSA-N 0 3 416.569 4.115 20 0 HIADHN O[C@@H](COCc1cccs1)CN1CC=C(c2cccc(Br)c2)CC1 ZINC000547292601 941054084 /nfs/dbraw/zinc/05/40/84/941054084.db2.gz RWALHRHQIWQRFT-GOSISDBHSA-N 0 3 408.361 4.177 20 0 HIADHN Fc1ccc(-c2nc3c(s2)CCC[C@H]3NC2CCN(c3cnccn3)CC2)cc1 ZINC000547356726 941058162 /nfs/dbraw/zinc/05/81/62/941058162.db2.gz SCTNFFWLQOLGRM-GOSISDBHSA-N 0 3 409.534 4.375 20 0 HIADHN CCN(C(=O)c1cnn(-c2ccccc2C)c1N)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000547388722 941059922 /nfs/dbraw/zinc/05/99/22/941059922.db2.gz BPGLRNPCUCXXQJ-CTNGQTDRSA-N 0 3 417.557 4.061 20 0 HIADHN CC(C)([C@H](NC(=O)Cc1ccc2c(c1)COC2)c1ccc(F)c(F)c1)N1CCCC1 ZINC000547622137 941068998 /nfs/dbraw/zinc/06/89/98/941068998.db2.gz MYGQWEJOHJYQAH-HSZRJFAPSA-N 0 3 414.496 4.269 20 0 HIADHN Cc1nc(-c2ccc(Br)cc2)c(NC(=O)[C@@H](C)N2CCCCCC2)n1C ZINC000547940220 941079873 /nfs/dbraw/zinc/07/98/73/941079873.db2.gz HYKZMWVDJLRBMF-CQSZACIVSA-N 0 3 419.367 4.361 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)N1CCC(c2c(F)cccc2F)CC1 ZINC000547942607 941079918 /nfs/dbraw/zinc/07/99/18/941079918.db2.gz IPOKTJXOCPAISR-UHFFFAOYSA-N 0 3 403.473 4.447 20 0 HIADHN COc1ccc(NC(=O)C2(NCc3ccnc4ccccc34)CCCC2)cc1OC ZINC000548317565 941095846 /nfs/dbraw/zinc/09/58/46/941095846.db2.gz NUPTWTOFSUDTTJ-UHFFFAOYSA-N 0 3 405.498 4.293 20 0 HIADHN C[C@@H](C(=O)Nc1ccc(Oc2ccc(S(C)(=O)=O)cc2)cc1)N1[C@H](C)CC[C@@H]1C ZINC000548372861 941098371 /nfs/dbraw/zinc/09/83/71/941098371.db2.gz DZCDCPMESZBHNE-BBWFWOEESA-N 0 3 416.543 4.082 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](N[C@@H]2CCC23CCOCC3)c2ccc(Cl)cc2)c1 ZINC000548858641 941126962 /nfs/dbraw/zinc/12/69/62/941126962.db2.gz VUXWNVSAVGOQBQ-NHCUHLMSSA-N 0 3 419.974 4.382 20 0 HIADHN CCOc1c(Cl)cc(CNC[C@@H](O)COc2cccc3ccccc32)cc1OC ZINC000548926157 941129872 /nfs/dbraw/zinc/12/98/72/941129872.db2.gz NIXYIEKHZUXLCJ-GOSISDBHSA-N 0 3 415.917 4.430 20 0 HIADHN CN(C)C[C@@H](NC(=O)Nc1ccnn1Cc1ccc(F)cc1)c1ccc(Cl)cc1 ZINC000548976387 941137350 /nfs/dbraw/zinc/13/73/50/941137350.db2.gz XUBITRRAZQQHLM-LJQANCHMSA-N 0 3 415.900 4.148 20 0 HIADHN COc1cccc([C@@H]2[C@@H](N[C@H](C)C(=O)Nc3cc(C)ccc3C)CCN2C2CC2)c1 ZINC000549112196 941161006 /nfs/dbraw/zinc/16/10/06/941161006.db2.gz GOGPLBCMSBJCJW-RVSNTGDXSA-N 0 3 407.558 4.207 20 0 HIADHN CCN1CC[C@H](NCC(=O)N(C(C)C)C2CCCC2)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000549115291 941161337 /nfs/dbraw/zinc/16/13/37/941161337.db2.gz BFIMMRJUGZVUGG-UGKGYDQZSA-N 0 3 411.512 4.008 20 0 HIADHN CCc1ccccc1NC(=O)[C@H](C)N[C@@H]1CCN(C2CC2)[C@H]1c1cccc(OC)c1 ZINC000549118402 941161826 /nfs/dbraw/zinc/16/18/26/941161826.db2.gz HTYBGQGXIJUNRO-VWMXVWASSA-N 0 3 407.558 4.152 20 0 HIADHN CCN1CC[C@@H](NCC(=O)Nc2ccc(C)c(C)c2)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000549117865 941161841 /nfs/dbraw/zinc/16/18/41/941161841.db2.gz YLLPIXJMFJSRKI-DENIHFKCSA-N 0 3 405.464 4.084 20 0 HIADHN COc1ccc(OC(F)F)c(NC(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)c1 ZINC000549197114 941170391 /nfs/dbraw/zinc/17/03/91/941170391.db2.gz NYMWWUIHMMXUQV-MRXNPFEDSA-N 0 3 413.852 4.374 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@@H](N[C@@H](CO)c2cccc(Br)c2)c2ccccc21 ZINC000549228905 941172335 /nfs/dbraw/zinc/17/23/35/941172335.db2.gz PAJPNJYSFIOIRJ-AQNXPRMDSA-N 0 3 418.331 4.254 20 0 HIADHN CC(=O)Nc1ccc(S[C@@H](C)C(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)cc1 ZINC000549229688 941172385 /nfs/dbraw/zinc/17/23/85/941172385.db2.gz DBEANUPKYQCPBU-VBKZILBWSA-N 0 3 419.978 4.198 20 0 HIADHN Cc1cc(C(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)c(C)n1Cc1ccccn1 ZINC000549239710 941173246 /nfs/dbraw/zinc/17/32/46/941173246.db2.gz IWUTYVVHTJAGPU-QFIPXVFZSA-N 0 3 410.949 4.234 20 0 HIADHN CN(C)C[C@H](NC(=O)Nc1ccc(-c2csnn2)cc1)c1ccc(Cl)cc1 ZINC000549243594 941173564 /nfs/dbraw/zinc/17/35/64/941173564.db2.gz AQRAYBUBTGXONO-KRWDZBQOSA-N 0 3 401.923 4.283 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)NCc2cc(-c3ccccc3)on2)N2CCCC2)cc1 ZINC000549403140 941186467 /nfs/dbraw/zinc/18/64/67/941186467.db2.gz OPQBFPKZCXXQLC-JOCHJYFZSA-N 0 3 404.514 4.286 20 0 HIADHN CC(C)N1CC[C@@H](N[C@@H](C)C(=O)Nc2ccc(Cl)cn2)[C@H]1c1ccc(F)c(F)c1 ZINC000549468437 941192873 /nfs/dbraw/zinc/19/28/73/941192873.db2.gz KSADBWQZIKCSPG-CYFNAFFESA-N 0 3 422.907 4.154 20 0 HIADHN COc1cccc([C@H]2[C@H](NCc3nccn3Cc3ccccc3)CCN2C2CC2)c1 ZINC000549477029 941194608 /nfs/dbraw/zinc/19/46/08/941194608.db2.gz IFYNVSFPVHOAOE-NOZRDPDXSA-N 0 3 402.542 4.008 20 0 HIADHN CCN1CC[C@H](N[C@H](C)C(=O)Nc2ccc(C)cc2F)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000549482092 941195183 /nfs/dbraw/zinc/19/51/83/941195183.db2.gz KXURWKZQUQYFSK-YIILKADPSA-N 0 3 423.454 4.304 20 0 HIADHN CCN1CC[C@H](N[C@H](C)C(=O)Nc2ccc(C)cc2F)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000549482091 941195197 /nfs/dbraw/zinc/19/51/97/941195197.db2.gz KXURWKZQUQYFSK-XFPJRNFQSA-N 0 3 423.454 4.304 20 0 HIADHN CCN1CC[C@@H](NCC(=O)Nc2cc(C)cc(C)c2)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000549483171 941195338 /nfs/dbraw/zinc/19/53/38/941195338.db2.gz QQNCUBDSFACRRK-DENIHFKCSA-N 0 3 405.464 4.084 20 0 HIADHN COCCc1ccc(OC[C@H](O)CN2CC=C(c3c[nH]c4cc(C)ccc43)CC2)cc1 ZINC000549509510 941197615 /nfs/dbraw/zinc/19/76/15/941197615.db2.gz SYWGDGZLZIEHDK-JOCHJYFZSA-N 0 3 420.553 4.194 20 0 HIADHN C[C@@H](c1ccc(F)cc1)N1CC[C@H](N2CCC(c3c[nH]c4ncccc34)CC2)C1=O ZINC000549526842 941198107 /nfs/dbraw/zinc/19/81/07/941198107.db2.gz ATIQIZVBMKOZSQ-AOMKIAJQSA-N 0 3 406.505 4.244 20 0 HIADHN CCC[C@@H]1CN(c2nnc(C3CCC3)n2C[C@H]2CCOC2)CCN1Cc1ccccc1 ZINC000549594390 941200656 /nfs/dbraw/zinc/20/06/56/941200656.db2.gz GNKTVQJFOWRRKD-FYYLOGMGSA-N 0 3 423.605 4.073 20 0 HIADHN CC[C@@H]1CN(c2nnc(C3CCCC3)n2C[C@H]2CCOC2)CCN1Cc1ccccc1 ZINC000549678417 941204193 /nfs/dbraw/zinc/20/41/93/941204193.db2.gz NKFHLNWRJFPSOR-FYYLOGMGSA-N 0 3 423.605 4.073 20 0 HIADHN C[C@@H](c1ccccc1)N1CCC(NS(=O)(=O)Cc2ccc(C(F)F)cc2)CC1 ZINC000549775099 941207040 /nfs/dbraw/zinc/20/70/40/941207040.db2.gz VGULTWOXLBEOMD-INIZCTEOSA-N 0 3 408.514 4.269 20 0 HIADHN CCN(C(=O)c1ccc2c(c1)NC(=O)C2(C)C)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000549931218 941241449 /nfs/dbraw/zinc/24/14/49/941241449.db2.gz HYPCJTYAPBFYCY-FXAWDEMLSA-N 0 3 405.542 4.214 20 0 HIADHN O=S(=O)(CCCNCc1ccc(F)c(C(F)(F)F)c1)c1ccc(Cl)cc1 ZINC000549935740 941243155 /nfs/dbraw/zinc/24/31/55/941243155.db2.gz MJAIYPSNQYEMRS-UHFFFAOYSA-N 0 3 409.832 4.452 20 0 HIADHN COc1cccc(OC)c1OC[C@H](O)CN1CCc2ccccc2[C@H]1c1ccccc1 ZINC000549961023 941250593 /nfs/dbraw/zinc/25/05/93/941250593.db2.gz SAELONCMRSEHPN-PXDATVDWSA-N 0 3 419.521 4.091 20 0 HIADHN CC(C)[C@@]1(CO)CCCN(CC(=O)N2CCC[C@H]2c2ccc(Cl)c(Cl)c2)C1 ZINC000550063365 941277318 /nfs/dbraw/zinc/27/73/18/941277318.db2.gz LQDWZRVBFWDTAY-FPOVZHCZSA-N 0 3 413.389 4.387 20 0 HIADHN C[C@@H](c1ccccc1)N1CCC(NS(=O)(=O)Cc2ccc(F)c(Cl)c2)CC1 ZINC000550208965 941298605 /nfs/dbraw/zinc/29/86/05/941298605.db2.gz DFSIUYHQSWYOJJ-HNNXBMFYSA-N 0 3 410.942 4.124 20 0 HIADHN O=c1ccccn1Cc1ccc(CN[C@H]2CCc3sc(Br)cc32)cc1 ZINC000550628137 941347572 /nfs/dbraw/zinc/34/75/72/941347572.db2.gz DUYXEOUCMNSRSY-KRWDZBQOSA-N 0 3 415.356 4.498 20 0 HIADHN CN1CCN(C[C@H](N[C@H]2CCc3sc(Br)cc32)c2ccccc2)CC1 ZINC000550644662 941349155 /nfs/dbraw/zinc/34/91/55/941349155.db2.gz WPIABXQZWHDJTB-ROUUACIJSA-N 0 3 420.420 4.076 20 0 HIADHN CS(=O)(=O)C[C@@H](NC[C@H](OCc1ccccc1)c1ccc(Cl)cc1)C1CC1 ZINC000550822175 941371233 /nfs/dbraw/zinc/37/12/33/941371233.db2.gz FNZOFPJNWBTYIM-RTWAWAEBSA-N 0 3 407.963 4.011 20 0 HIADHN O=C(Nc1cccc(OC[C@H]2CN(Cc3ccccc3)CCCO2)c1)c1ccco1 ZINC000550823620 941371263 /nfs/dbraw/zinc/37/12/63/941371263.db2.gz YASVMOISDUBTEX-JOCHJYFZSA-N 0 3 406.482 4.202 20 0 HIADHN C[C@@H](NC[C@@H](c1ccc(C(F)(F)F)cc1)N1CCOCC1)c1cn2ccccc2n1 ZINC000550885534 941379267 /nfs/dbraw/zinc/37/92/67/941379267.db2.gz GJBIGSLGBBHGBY-UZLBHIALSA-N 0 3 418.463 4.077 20 0 HIADHN CC[C@H](N[C@H]1CCCN([C@H](C)c2ccc(F)cc2)C1=O)c1ccc2c(c1)OCCO2 ZINC000550894642 941380476 /nfs/dbraw/zinc/38/04/76/941380476.db2.gz ISEPTJYIFMRJSD-CZAAIQMYSA-N 0 3 412.505 4.390 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)Nc2ccc(Oc3cccnc3)nc2)CN1Cc1ccccc1 ZINC000551026846 941396992 /nfs/dbraw/zinc/39/69/92/941396992.db2.gz CMCWIGZNGYQNTE-XLIONFOSSA-N 0 3 403.486 4.053 20 0 HIADHN CN(C(=O)c1ccc(NCc2cc(F)cc3cccnc32)cc1)[C@@H]1CCCN(C)C1 ZINC000551085890 941406776 /nfs/dbraw/zinc/40/67/76/941406776.db2.gz CXCULFNWRAGFOG-JOCHJYFZSA-N 0 3 406.505 4.152 20 0 HIADHN CN1CC[C@@H](NCC(=O)Nc2cc(Cl)ccc2Cl)[C@@H]1c1ccc(F)c(F)c1 ZINC000551097702 941409449 /nfs/dbraw/zinc/40/94/49/941409449.db2.gz QRKZWVLJWXNALG-APWZRJJASA-N 0 3 414.283 4.245 20 0 HIADHN Cc1cccc(-c2ccc(CN[C@@H]3CCCc4cc(S(N)(=O)=O)ccc43)cc2)c1 ZINC000551164554 941420590 /nfs/dbraw/zinc/42/05/90/941420590.db2.gz IJIMSAYMQOSVCZ-XMMPIXPASA-N 0 3 406.551 4.477 20 0 HIADHN O=C(NC[C@@H]1CCCCN1Cc1ccccc1)N1CCC(F)(c2cccnc2)CC1 ZINC000551215791 941429238 /nfs/dbraw/zinc/42/92/38/941429238.db2.gz PVLJJYSYQREZAT-QFIPXVFZSA-N 0 3 410.537 4.107 20 0 HIADHN CC[C@@H](Cn1cncn1)N[C@@H](c1ccc(OC)cc1)c1ccc(C(F)(F)F)cc1 ZINC000551293207 941444965 /nfs/dbraw/zinc/44/49/65/941444965.db2.gz AXLSLZSUFXVEDE-AZUAARDMSA-N 0 3 404.436 4.463 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)N1CCCN(c2ccc(F)c(F)c2)CC1 ZINC000551337484 941455437 /nfs/dbraw/zinc/45/54/37/941455437.db2.gz CMKNFAOFMYSGTQ-UHFFFAOYSA-N 0 3 413.468 4.125 20 0 HIADHN Clc1cccc([C@@H]2CN(C[C@H]3CN(Cc4ccccc4)CCCO3)CCO2)c1 ZINC000551394909 941468913 /nfs/dbraw/zinc/46/89/13/941468913.db2.gz IHOOGVZQGRUASE-PKTZIBPZSA-N 0 3 400.950 4.004 20 0 HIADHN Clc1cccc([C@H]2CN(C[C@H]3CN(Cc4ccccc4)CCCO3)CCO2)c1 ZINC000551394907 941468919 /nfs/dbraw/zinc/46/89/19/941468919.db2.gz IHOOGVZQGRUASE-DHIUTWEWSA-N 0 3 400.950 4.004 20 0 HIADHN Cn1c2ccccc2nc1[C@@H]1CCCN1C[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000551395789 941469055 /nfs/dbraw/zinc/46/90/55/941469055.db2.gz PMUMTUNRLGVNNE-QPPBQGQZSA-N 0 3 404.558 4.001 20 0 HIADHN COC(=O)[C@H](Cc1ccccc1)[C@@H](C)N[C@@H](C)C(=O)Nc1c(C)cccc1C(C)C ZINC000551420399 941475161 /nfs/dbraw/zinc/47/51/61/941475161.db2.gz ZDVUCKTZOPYDFC-XQBPLPMBSA-N 0 3 410.558 4.455 20 0 HIADHN CN(C(=O)c1ccc(NCc2cc(Br)cs2)cc1)[C@H]1CCCN(C)C1 ZINC000551452721 941482512 /nfs/dbraw/zinc/48/25/12/941482512.db2.gz VWSNVPFKNBACOL-KRWDZBQOSA-N 0 3 422.392 4.289 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)[C@@H](C)c2ccc(Br)s2)cc1 ZINC000551540206 941498076 /nfs/dbraw/zinc/49/80/76/941498076.db2.gz CUQNEFLHGQNDHO-WFASDCNBSA-N 0 3 411.365 4.042 20 0 HIADHN CC(C)(C)c1ncc(CN[C@H]2CCN(c3ncc(C(F)(F)F)cc3Cl)C2)cn1 ZINC000551556139 941500444 /nfs/dbraw/zinc/50/04/44/941500444.db2.gz FYFQGIJKNAMDTO-AWEZNQCLSA-N 0 3 413.875 4.210 20 0 HIADHN CC(C)(C)c1ncc(CN[C@@H]2CCN(c3ncc(C(F)(F)F)cc3Cl)C2)cn1 ZINC000551556140 941500476 /nfs/dbraw/zinc/50/04/76/941500476.db2.gz FYFQGIJKNAMDTO-CQSZACIVSA-N 0 3 413.875 4.210 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)[C@@H]1CCc2cccc(O)c21 ZINC000551704901 941529816 /nfs/dbraw/zinc/52/98/16/941529816.db2.gz FZDNPRZKURWHMS-LEWJYISDSA-N 0 3 416.525 4.013 20 0 HIADHN Cc1ccc(C)c(OC[C@H](O)CN[C@H](c2cncc(Br)c2)C2CC2)c1C ZINC000551718558 941532774 /nfs/dbraw/zinc/53/27/74/941532774.db2.gz IDJIKMBPPQAVPH-UXHICEINSA-N 0 3 419.363 4.250 20 0 HIADHN CCCN(CCC)C(=O)CN[C@H](c1cccc(C(F)(F)F)c1)C1CCOCC1 ZINC000551721450 941533154 /nfs/dbraw/zinc/53/31/54/941533154.db2.gz VDFAIOQBRXGBEC-FQEVSTJZSA-N 0 3 400.485 4.411 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)COc2ccccc2-c2ccccc2)cc1 ZINC000551794095 941546010 /nfs/dbraw/zinc/54/60/10/941546010.db2.gz WSNCGFHQDHNQPP-HSZRJFAPSA-N 0 3 404.510 4.160 20 0 HIADHN CCCN(CC(=O)Nc1c(F)cccc1F)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000551797365 941546667 /nfs/dbraw/zinc/54/66/67/941546667.db2.gz HXDACRMTWLSSPT-IBGZPJMESA-N 0 3 401.501 4.280 20 0 HIADHN COCC[C@@H](N[C@@H](C)c1ccc(S(N)(=O)=O)cc1)c1ccc(Cl)c(Cl)c1 ZINC000551812490 941549962 /nfs/dbraw/zinc/54/99/62/941549962.db2.gz FKYBENMRGPZZFR-KPZWWZAWSA-N 0 3 417.358 4.069 20 0 HIADHN C[C@@H](NCc1cccc(N2C(=O)N[C@](C)(C3CC3)C2=O)c1)c1cc2c(s1)CCC2 ZINC000551818525 941552289 /nfs/dbraw/zinc/55/22/89/941552289.db2.gz VNCIMALCTWXZNV-QKFKETGDSA-N 0 3 409.555 4.313 20 0 HIADHN CCC[C@H](N[C@@H](C)c1ccc(OC)c(OC)c1C)C(=O)N1CCc2sccc2C1 ZINC000552044947 941573441 /nfs/dbraw/zinc/57/34/41/941573441.db2.gz SSPQMYQPBLIRTA-LPHOPBHVSA-N 0 3 416.587 4.478 20 0 HIADHN C[C@H](CC(=O)Nc1cccc(C(F)(F)F)c1)N[C@H](CC(=O)N(C)C)c1ccccc1 ZINC000552073627 941579454 /nfs/dbraw/zinc/57/94/54/941579454.db2.gz LJZQTADXXIJELX-DNVCBOLYSA-N 0 3 421.463 4.232 20 0 HIADHN COc1ccc(OCc2ccccn2)c(CN2CCC(CO)(c3ccccc3)CC2)c1 ZINC000552072101 941579680 /nfs/dbraw/zinc/57/96/80/941579680.db2.gz VLLCRPPOLRAEHR-UHFFFAOYSA-N 0 3 418.537 4.195 20 0 HIADHN OC1(CCN[C@H](c2cccc(F)c2)c2cccc(Br)c2)CCOCC1 ZINC000552085693 941581533 /nfs/dbraw/zinc/58/15/33/941581533.db2.gz JAJLEZWLVVOUPZ-IBGZPJMESA-N 0 3 408.311 4.199 20 0 HIADHN OCC1([C@@H](NCc2cnc3ccc(Br)cn23)c2ccccc2)CCC1 ZINC000552084852 941581790 /nfs/dbraw/zinc/58/17/90/941581790.db2.gz BRELEWOJUYYXOR-IBGZPJMESA-N 0 3 400.320 4.090 20 0 HIADHN C[C@H](Cn1ccc2ccccc21)C(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000552093038 941583732 /nfs/dbraw/zinc/58/37/32/941583732.db2.gz SUWBBLONIHTOAP-LJQANCHMSA-N 0 3 405.542 4.120 20 0 HIADHN C[C@@H](Cc1ccc(Br)cc1)C(=O)N(C)CCCN(C)Cc1ccncc1 ZINC000552112873 941587627 /nfs/dbraw/zinc/58/76/27/941587627.db2.gz YILCDVMZZRKVRL-KRWDZBQOSA-N 0 3 418.379 4.003 20 0 HIADHN CC(C)(C)n1nc(C(=O)N2CCN(c3ccnc4ccccc43)CC2)cc1C1CC1 ZINC000552148566 941593702 /nfs/dbraw/zinc/59/37/02/941593702.db2.gz RYKNARSWTOMKCI-UHFFFAOYSA-N 0 3 403.530 4.026 20 0 HIADHN O=C(c1csc(-c2ccccc2F)n1)N1CCN(c2ccnc3ccccc32)CC1 ZINC000552149264 941593755 /nfs/dbraw/zinc/59/37/55/941593755.db2.gz ARKLSFXODLUHAD-UHFFFAOYSA-N 0 3 418.497 4.460 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@@H](O)C2)c1)c1cccc(NC(=O)C2CCCCC2)c1 ZINC000552198953 941600459 /nfs/dbraw/zinc/60/04/59/941600459.db2.gz KBCPPESAJQXFKU-HSZRJFAPSA-N 0 3 421.541 4.024 20 0 HIADHN CS(=O)(=O)Cc1ccccc1CN[C@@H](c1cccc(OC(F)(F)F)c1)C1CC1 ZINC000552246425 941613434 /nfs/dbraw/zinc/61/34/34/941613434.db2.gz UINOFURQLBRPQM-LJQANCHMSA-N 0 3 413.461 4.371 20 0 HIADHN NS(=O)(=O)C[C@H]1CCCN(Cc2ccc(-c3ccc(Cl)c(Cl)c3)s2)C1 ZINC000552256528 941615392 /nfs/dbraw/zinc/61/53/92/941615392.db2.gz PARBUMRATZBVSK-LBPRGKRZSA-N 0 3 419.399 4.222 20 0 HIADHN CO[C@@H]1C[C@H](c2ccccc2)CC[C@@H]1NCC(=O)Nc1ccc(OC(F)F)cc1 ZINC000552268235 941618125 /nfs/dbraw/zinc/61/81/25/941618125.db2.gz BJLVYVMTGSXGEB-LSTHTHJFSA-N 0 3 404.457 4.167 20 0 HIADHN C[S@](=O)Cc1ccc(CN[C@@H]2CCCOc3cc(Br)ccc32)cc1 ZINC000552317807 941629983 /nfs/dbraw/zinc/62/99/83/941629983.db2.gz IHDAVDMXCWQGEY-KOSHJBKYSA-N 0 3 408.361 4.331 20 0 HIADHN Cc1nc(-c2cc([C@H](C)NC[C@@H](N3CCOCC3)C(F)(F)F)cs2)cs1 ZINC000552338973 941638105 /nfs/dbraw/zinc/63/81/05/941638105.db2.gz UXYYGNCDKOJNJC-MEDUHNTESA-N 0 3 405.511 4.094 20 0 HIADHN COc1ccc(NC(=O)C[C@@H](C)N[C@@H](CCO)c2ccc(Cl)c(Cl)c2)cc1 ZINC000552342616 941639031 /nfs/dbraw/zinc/63/90/31/941639031.db2.gz PTWRPPDAUUYKQT-YJYMSZOUSA-N 0 3 411.329 4.432 20 0 HIADHN C[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)N(C)CCCN(C)Cc1ccncc1 ZINC000552360680 941644608 /nfs/dbraw/zinc/64/46/08/941644608.db2.gz MXCAQFNUUUGCHM-KRWDZBQOSA-N 0 3 407.480 4.260 20 0 HIADHN COCc1ccc([C@H]2CCCN2C(=O)[C@H]2CN(Cc3ccccc3)CCC2(F)F)o1 ZINC000552449067 941674813 /nfs/dbraw/zinc/67/48/13/941674813.db2.gz OMPCBDJLMZJURA-WOJBJXKFSA-N 0 3 418.484 4.247 20 0 HIADHN Cc1ccc(C(=O)Nc2cccc(CNC[C@H](O)COc3c(C)cccc3C)c2)cc1 ZINC000552487295 941686132 /nfs/dbraw/zinc/68/61/32/941686132.db2.gz KMZNLIITLJBWOL-DEOSSOPVSA-N 0 3 418.537 4.394 20 0 HIADHN O=C(CC(c1ccccc1)c1ccccc1)Nc1cccc(CN2CC[C@H](O)C2)c1 ZINC000552514389 941691188 /nfs/dbraw/zinc/69/11/88/941691188.db2.gz BGVLSFLTDHICRC-DEOSSOPVSA-N 0 3 400.522 4.414 20 0 HIADHN O=C(CC(c1ccccc1)c1ccccc1)Nc1cccc(CN2CC[C@@H](O)C2)c1 ZINC000552514390 941691271 /nfs/dbraw/zinc/69/12/71/941691271.db2.gz BGVLSFLTDHICRC-XMMPIXPASA-N 0 3 400.522 4.414 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)[C@@H]1C[C@@H]1c1cccc(Cl)c1Cl ZINC000552515908 941691785 /nfs/dbraw/zinc/69/17/85/941691785.db2.gz CTJJUGCPVQGGQF-CGTJXYLNSA-N 0 3 405.325 4.302 20 0 HIADHN C[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)Nc1cccc(CN2CC[C@@H](O)C2)c1 ZINC000552516076 941691882 /nfs/dbraw/zinc/69/18/82/941691882.db2.gz IMMMGXYIVYHMDE-MGPUTAFESA-N 0 3 406.448 4.089 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)c1ccc(-c2nc3ccccc3s2)o1 ZINC000552514725 941692246 /nfs/dbraw/zinc/69/22/46/941692246.db2.gz LSMYCUDXGIROLY-KRWDZBQOSA-N 0 3 419.506 4.375 20 0 HIADHN COc1cc(-c2ccccc2)sc1C(=O)Nc1cccc(CN2CC[C@H](O)C2)c1 ZINC000552515160 941692679 /nfs/dbraw/zinc/69/26/79/941692679.db2.gz ZTDKHFCOJCWVQI-IBGZPJMESA-N 0 3 408.523 4.243 20 0 HIADHN Cc1ccc(-c2ncc[nH]2)cc1NC(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000552553207 941706400 /nfs/dbraw/zinc/70/64/00/941706400.db2.gz GGDGGYVAYAPRJI-LJQANCHMSA-N 0 3 410.468 4.481 20 0 HIADHN CC(=O)CCc1ccc(OC[C@H](O)CN[C@H]2CCSc3ccc(Cl)cc32)cc1 ZINC000553020959 941818635 /nfs/dbraw/zinc/81/86/35/941818635.db2.gz ONSOPYBUPVXUMH-NQIIRXRSSA-N 0 3 419.974 4.428 20 0 HIADHN CCCN(C)[C@H](CNC(=O)c1csc(-c2cnccn2)n1)c1ccc(Cl)cc1 ZINC000553028702 941820040 /nfs/dbraw/zinc/82/00/40/941820040.db2.gz QRLVMGOJNOMCRR-GOSISDBHSA-N 0 3 415.950 4.066 20 0 HIADHN CCN1CCN(CCC(=O)NCc2cccc(Oc3ccc4ccccc4c3)c2)CC1 ZINC000553061966 941826459 /nfs/dbraw/zinc/82/64/59/941826459.db2.gz WSVVAROGJPUNBU-UHFFFAOYSA-N 0 3 417.553 4.276 20 0 HIADHN COc1ccc(C(=O)C[C@@H](C)C(=O)N2CC[C@]3(CCN(Cc4ccccc4)C3)C2)cc1 ZINC000553176120 941845135 /nfs/dbraw/zinc/84/51/35/941845135.db2.gz RPWFNZXMXPRNBY-IBVKSMDESA-N 0 3 420.553 4.029 20 0 HIADHN C/C=C/c1ccc(OC[C@@H](O)CNCc2ccc(Br)s2)c(OC)c1 ZINC000553199874 941848153 /nfs/dbraw/zinc/84/81/53/941848153.db2.gz VRMGUTBYVMRJSL-XGACYXMMSA-N 0 3 412.349 4.082 20 0 HIADHN OC1(Cc2ccc(F)cc2F)C[C@H]2CC[C@@H](C1)N2Cc1cnn(Cc2ccccc2)c1 ZINC000553203853 941848688 /nfs/dbraw/zinc/84/86/88/941848688.db2.gz SVRSVERJEHOAJV-HCGNOCCLSA-N 0 3 423.507 4.310 20 0 HIADHN Cc1cccc(C)c1NC(=O)CNC(=O)[C@H](C)N[C@H](c1ccc(Cl)cc1)C(C)C ZINC000553368182 941873872 /nfs/dbraw/zinc/87/38/72/941873872.db2.gz USLCTNMTQXQVLY-UWJYYQICSA-N 0 3 415.965 4.387 20 0 HIADHN CCOc1cc(CN[C@H]2CCCc3[nH]c(=O)ccc32)cc(Br)c1OC ZINC000553398011 941878958 /nfs/dbraw/zinc/87/89/58/941878958.db2.gz GSZYRRFJPHUHGJ-HNNXBMFYSA-N 0 3 407.308 4.124 20 0 HIADHN O=C(NC[C@H]1CCCCN1Cc1ccccc1)c1ccc(OCc2ccncc2)cc1 ZINC000553630839 941927123 /nfs/dbraw/zinc/92/71/23/941927123.db2.gz SKAWMRREGKJYGC-XMMPIXPASA-N 0 3 415.537 4.445 20 0 HIADHN CC(C)Oc1cc(Br)cc(C(=O)N2CCN([C@@H]3C[C@H]3C)C[C@H](C)C2)c1 ZINC000553781628 941967138 /nfs/dbraw/zinc/96/71/38/941967138.db2.gz CZDCBJPAGHUQJR-QMTMVMCOSA-N 0 3 409.368 4.039 20 0 HIADHN CC(C)Oc1cc(Br)ccc1C(=O)N1CCN([C@@H]2C[C@H]2C)C[C@H](C)C1 ZINC000553782683 941967833 /nfs/dbraw/zinc/96/78/33/941967833.db2.gz DOMDYUPDDKQSOD-HDMKZQKVSA-N 0 3 409.368 4.039 20 0 HIADHN C[C@H]1CCN(C(=O)NC[C@@H]2CCO[C@H]2c2ccccc2)CCN1Cc1ccccc1 ZINC000553825734 941978456 /nfs/dbraw/zinc/97/84/56/941978456.db2.gz OLNHDEUYOZDCMT-OYDLWJJNSA-N 0 3 407.558 4.070 20 0 HIADHN C[C@H]1CN(C(=O)c2ccn(-c3ccc(Cl)cc3Cl)n2)CCN(C2CCC2)C1 ZINC000553862509 941985952 /nfs/dbraw/zinc/98/59/52/941985952.db2.gz CQNSNZISUPYBHA-CQSZACIVSA-N 0 3 407.345 4.126 20 0 HIADHN C[C@@H]1CN(C(=O)c2ccc(-c3ccc4c(c3)OCCO4)s2)CCN(C2CCC2)C1 ZINC000553862234 941986182 /nfs/dbraw/zinc/98/61/82/941986182.db2.gz OHITYTCKUJPNTA-INIZCTEOSA-N 0 3 412.555 4.133 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)N[C@H](CO)c1sccc1C)c1ccc(Cl)cc1 ZINC000553894575 941992896 /nfs/dbraw/zinc/99/28/96/941992896.db2.gz PGUWBXQYHWYPHG-MSOLQXFVSA-N 0 3 409.983 4.126 20 0 HIADHN Cc1nn(Cc2ccc(Cl)cc2)c(C)c1CN1CC[C@H](OCc2ccncc2)C1 ZINC000553897219 941993446 /nfs/dbraw/zinc/99/34/46/941993446.db2.gz CGFBUIGVBKMZBV-QFIPXVFZSA-N 0 3 410.949 4.388 20 0 HIADHN COC(=O)c1ccc(-c2nc(CN(C[C@@H](C)c3ccccc3)[C@@H](C)CO)co2)cc1 ZINC000553936273 942002459 /nfs/dbraw/zinc/00/24/59/942002459.db2.gz SAGCDJQNUGWTQR-MSOLQXFVSA-N 0 3 408.498 4.115 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)[C@H]2C[C@@H]2c2ccc(F)cc2F)N(C)C)cc1 ZINC000554015326 942019107 /nfs/dbraw/zinc/01/91/07/942019107.db2.gz MSDCLYJGMVPGCJ-URVUXULASA-N 0 3 402.485 4.275 20 0 HIADHN CC(C)Cc1ccc([C@@H](CNC(=O)Cc2csc(-c3cccnc3)n2)N(C)C)cc1 ZINC000554083781 942032989 /nfs/dbraw/zinc/03/29/89/942032989.db2.gz FMNYWEFMWOVRMJ-JOCHJYFZSA-N 0 3 422.598 4.365 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1cccc(C(=O)N(CC)CC)c1)c1ccco1 ZINC000554112010 942038931 /nfs/dbraw/zinc/03/89/31/942038931.db2.gz FTWIIDNYNGYRPI-LPHOPBHVSA-N 0 3 400.523 4.013 20 0 HIADHN C[C@@H]1C[C@@H]1N1CCN(C(=O)c2ccc(Sc3ccccc3Cl)nn2)C[C@@H](C)C1 ZINC000554132521 942045213 /nfs/dbraw/zinc/04/52/13/942045213.db2.gz VEZABZXBPQDBMA-DAYGRLMNSA-N 0 3 416.978 4.084 20 0 HIADHN Cc1nn(Cc2ccccc2Cl)c(C)c1C(=O)N1CCN([C@@H]2C[C@@H]2C)C[C@H](C)C1 ZINC000554132469 942045251 /nfs/dbraw/zinc/04/52/51/942045251.db2.gz UTSSONJZVAQMBB-CKJXQJPGSA-N 0 3 414.981 4.004 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1ccccc1N1C[C@H](C)O[C@@H](C)C1)c1ccco1 ZINC000554150046 942050792 /nfs/dbraw/zinc/05/07/92/942050792.db2.gz HFXGCRBVKBYPFW-CGBFIWBNSA-N 0 3 414.550 4.144 20 0 HIADHN COc1ccc(NC(=O)CCCN2CCN(c3ccccc3)CC2)c(C(F)(F)F)c1 ZINC000554210438 942068805 /nfs/dbraw/zinc/06/88/05/942068805.db2.gz GOEOWXUOCPIQHW-UHFFFAOYSA-N 0 3 421.463 4.255 20 0 HIADHN C[C@@H](NC(=O)NC[C@@H](c1cccs1)N1CCCC1)c1nccn1-c1ccccc1 ZINC000554219615 942071298 /nfs/dbraw/zinc/07/12/98/942071298.db2.gz ZBXNNQAFBMXVAC-MJGOQNOKSA-N 0 3 409.559 4.131 20 0 HIADHN COC[C@@H](NCC1CCN(C(=O)c2ccccc2)CC1)c1cccc(Cl)c1F ZINC000554361658 942113688 /nfs/dbraw/zinc/11/36/88/942113688.db2.gz FIBFECKTPBENCK-HXUWFJFHSA-N 0 3 404.913 4.309 20 0 HIADHN O=C(CCC(F)(F)F)N1CCC[C@@H](N[C@@H]2CCCc3nn(-c4ccccc4)cc32)C1 ZINC000554376808 942118625 /nfs/dbraw/zinc/11/86/25/942118625.db2.gz WPVXQFZDFUENCJ-VQIMIIECSA-N 0 3 420.479 4.173 20 0 HIADHN C[C@@H](N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1)c1cccc(-n2ccnn2)c1 ZINC000554376576 942118761 /nfs/dbraw/zinc/11/87/61/942118761.db2.gz STIOCPBUCMLEOC-NTKDMRAZSA-N 0 3 411.509 4.168 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1ccc(OC[C@@H]2CCCO2)cc1)c1ccco1 ZINC000554397683 942125873 /nfs/dbraw/zinc/12/58/73/942125873.db2.gz AHGGMUCKVKOUEH-VDGAXYAQSA-N 0 3 401.507 4.088 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1ccc(Oc2ncccn2)cc1C)c1ccco1 ZINC000554413830 942132875 /nfs/dbraw/zinc/13/28/75/942132875.db2.gz AXANFJBUWOVZMD-LPHOPBHVSA-N 0 3 409.490 4.421 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)Nc1ccc(N2CCSCC2)cc1C)c1ccco1 ZINC000554428746 942140201 /nfs/dbraw/zinc/14/02/01/942140201.db2.gz ZWVNWRMSFYYUKL-XLIONFOSSA-N 0 3 416.591 4.392 20 0 HIADHN Cc1cc(NC(=O)N[C@@H](CN(C)C)c2ccc(F)cc2)ccc1OC1CCOCC1 ZINC000554466702 942153074 /nfs/dbraw/zinc/15/30/74/942153074.db2.gz KFQAPBXYNWSZFL-NRFANRHFSA-N 0 3 415.509 4.116 20 0 HIADHN CC(=O)N(Cc1ccc(NC(=O)N[C@@H](CN(C)C)c2ccc(F)cc2)cc1)C(C)C ZINC000554474517 942155283 /nfs/dbraw/zinc/15/52/83/942155283.db2.gz DLDBFODXLKQNFM-QFIPXVFZSA-N 0 3 414.525 4.007 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)c1ccc(OC2CCCC2)c(OC)c1)c1ccco1 ZINC000554634400 942182019 /nfs/dbraw/zinc/18/20/19/942182019.db2.gz YCSNDCATMYLATH-VQIMIIECSA-N 0 3 400.519 4.469 20 0 HIADHN COc1ccc([C@H](C)NCc2cccc(I)c2)c(C)c1OC ZINC000554720197 942210694 /nfs/dbraw/zinc/21/06/94/942210694.db2.gz XLPYFJHOILIJGL-ZDUSSCGKSA-N 0 3 411.283 4.468 20 0 HIADHN C[C@@H](NCC(=O)NCC1(c2ccccc2)CCOCC1)c1ccc(F)c2ccccc21 ZINC000554743615 942218629 /nfs/dbraw/zinc/21/86/29/942218629.db2.gz ODWSCTVWDMTHDI-LJQANCHMSA-N 0 3 420.528 4.494 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)Nc1cc(F)ccc1OC[C@H]1CCCO1 ZINC000554751125 942221231 /nfs/dbraw/zinc/22/12/31/942221231.db2.gz QFOAWCHEGQZRDY-YLJYHZDGSA-N 0 3 415.509 4.026 20 0 HIADHN Cc1cc2ncn(C[C@H](O)CNCc3ccccc3OCc3ccccc3)c2cc1C ZINC000554831421 942269126 /nfs/dbraw/zinc/26/91/26/942269126.db2.gz NEXVTEBBHVPZMH-HSZRJFAPSA-N 0 3 415.537 4.383 20 0 HIADHN O=C(CN1[C@@H]2CC[C@H]1C[C@@H](c1ccccc1)C2)Nc1cccc(N2CCCC2=O)c1 ZINC000554833926 942272222 /nfs/dbraw/zinc/27/22/22/942272222.db2.gz POUREFWAAAOLQT-QYEXWFEISA-N 0 3 403.526 4.163 20 0 HIADHN CC1(C)C[N@H+](Cc2ccccc2)CC[C@H]1NCc1nc2c3ccccc3oc2c(=O)[n-]1 ZINC000554840109 942278590 /nfs/dbraw/zinc/27/85/90/942278590.db2.gz PELHFHLCTVUMMW-HXUWFJFHSA-N 0 3 416.525 4.472 20 0 HIADHN CC1(C)C[N@@H+](Cc2ccccc2)CC[C@H]1NCc1nc2c3ccccc3oc2c(=O)[n-]1 ZINC000554840109 942278605 /nfs/dbraw/zinc/27/86/05/942278605.db2.gz PELHFHLCTVUMMW-HXUWFJFHSA-N 0 3 416.525 4.472 20 0 HIADHN c1nc(CN[C@@H]2CN(Cc3ccccc3)C[C@H]2c2ccccc2)n(-c2ccccc2)n1 ZINC000554842553 942280888 /nfs/dbraw/zinc/28/08/88/942280888.db2.gz HDYDKYWOQXVJMY-LOSJGSFVSA-N 0 3 409.537 4.025 20 0 HIADHN C/C=C/c1ccc(OC[C@H](O)CNCc2ccc(F)cc2C(F)(F)F)c(OC)c1 ZINC000554863375 942298044 /nfs/dbraw/zinc/29/80/44/942298044.db2.gz RCXCRNYPPBTOMG-REMYHPOOSA-N 0 3 413.411 4.416 20 0 HIADHN CN(C)C[C@H](NC(=O)Nc1ccc(OC[C@H]2CCCO2)cc1)c1ccc(Cl)cc1 ZINC000554909506 942316332 /nfs/dbraw/zinc/31/63/32/942316332.db2.gz FHXJUPDDPQDINK-RTWAWAEBSA-N 0 3 417.937 4.322 20 0 HIADHN CCc1nc2cc(CNC(=O)N[C@H]3CCN(Cc4ccccc4)C3)ccc2n1C1CC1 ZINC000554937020 942324986 /nfs/dbraw/zinc/32/49/86/942324986.db2.gz AFMRJUPIAYKWQH-FQEVSTJZSA-N 0 3 417.557 4.007 20 0 HIADHN CC(=O)Nc1cccc(NC(=O)CNC(C)(C)c2ccc(Br)c(C)c2)c1 ZINC000554958898 942333987 /nfs/dbraw/zinc/33/39/87/942333987.db2.gz ZDGXKFCSUGABAI-UHFFFAOYSA-N 0 3 418.335 4.179 20 0 HIADHN O=C(CCN1CC[C@H](n2cc(Cl)cn2)C1)N[C@H](c1cccs1)c1ccccc1 ZINC000554959113 942334240 /nfs/dbraw/zinc/33/42/40/942334240.db2.gz BIVZDISUYQRZAO-RXVVDRJESA-N 0 3 414.962 4.141 20 0 HIADHN CC(C)C(=O)c1ccc([C@H](C)C(=O)NC2CCN([C@H](C)c3ccncc3)CC2)cc1 ZINC000555010146 942354528 /nfs/dbraw/zinc/35/45/28/942354528.db2.gz CQNLHJCQDKPZIF-RBUKOAKNSA-N 0 3 407.558 4.366 20 0 HIADHN CCOc1cc(CN2CC3(CCC3)[C@@H]2C2CC2)ccc1OCC(=O)N1CCCCC1 ZINC000555098271 942385468 /nfs/dbraw/zinc/38/54/68/942385468.db2.gz FBXKJLOVGNGGCT-DEOSSOPVSA-N 0 3 412.574 4.241 20 0 HIADHN CCc1ccccc1NC(=O)CN[C@@H]1CCN(CC)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000555124916 942392075 /nfs/dbraw/zinc/39/20/75/942392075.db2.gz CQWPZKQFYCVMMJ-DENIHFKCSA-N 0 3 405.464 4.030 20 0 HIADHN COc1cccc([C@@H]2[C@H](N[C@H](C)C(=O)Nc3ccc(C)c(F)c3)CCN2C2CC2)c1 ZINC000555126512 942393351 /nfs/dbraw/zinc/39/33/51/942393351.db2.gz WZYLKWKZPQFZNH-ZGNKEGEESA-N 0 3 411.521 4.037 20 0 HIADHN CCOc1ccccc1NC(=O)CN[C@H]1CCN(C(C)C)[C@H]1c1ccc(F)c(F)c1 ZINC000555132954 942397192 /nfs/dbraw/zinc/39/71/92/942397192.db2.gz LZWWQARZYZJTJP-REWPJTCUSA-N 0 3 417.500 4.116 20 0 HIADHN CCN1CC[C@@H](NCC(=O)N(CC(F)(F)F)C(C)C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000555133075 942397395 /nfs/dbraw/zinc/39/73/95/942397395.db2.gz YZAKXQFKFDMHIV-SJLPKXTDSA-N 0 3 423.882 4.003 20 0 HIADHN COc1cccc([C@H]2[C@H](NCC(=O)Nc3cc(Cl)ccc3C)CCN2C2CC2)c1 ZINC000555133534 942397693 /nfs/dbraw/zinc/39/76/93/942397693.db2.gz UJMIIZZRPYSOSV-OFNKIYASSA-N 0 3 413.949 4.163 20 0 HIADHN C[C@H]1CC(C(=O)N(Cc2ccccc2Br)C2CCN(C)CC2)C[C@H](C)O1 ZINC000555162367 942411388 /nfs/dbraw/zinc/41/13/88/942411388.db2.gz JGWRXRZAKJQPSH-HOTGVXAUSA-N 0 3 423.395 4.076 20 0 HIADHN COCCCN(C(=O)C[C@H](Cc1ccccc1)c1ccccc1)C1CCN(C)CC1 ZINC000555166190 942413060 /nfs/dbraw/zinc/41/30/60/942413060.db2.gz CAVXFUGYJJEVDM-DEOSSOPVSA-N 0 3 408.586 4.362 20 0 HIADHN C[C@@H](SCC(=O)N[C@H](CN(C)C)c1ccc(Cl)cc1)c1nc2ccccc2[nH]1 ZINC000555229682 942437861 /nfs/dbraw/zinc/43/78/61/942437861.db2.gz DOCLMHLGBMXGAP-AUUYWEPGSA-N 0 3 416.978 4.430 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@H](N[C@@H]2CCN(c3ccccc3Cl)C2=O)c2ccccc21 ZINC000555232848 942438870 /nfs/dbraw/zinc/43/88/70/942438870.db2.gz NOFPDWGSGOHJRW-YZGWKJHDSA-N 0 3 412.917 4.217 20 0 HIADHN CC[C@H](N[C@@H](C)c1ccc(Br)cn1)[C@@H](c1ccc(C)cc1)n1cncn1 ZINC000555378196 942503453 /nfs/dbraw/zinc/50/34/53/942503453.db2.gz VEFJHMLWDAGWBX-ZAAXVRCTSA-N 0 3 414.351 4.463 20 0 HIADHN CC(C)[C@H](NC1CCC2(CC1)c1ccccc1NC2=O)c1nc(-c2cccnc2)no1 ZINC000555419793 942524222 /nfs/dbraw/zinc/52/42/22/942524222.db2.gz AWVZGQJLDVXXEQ-QOALBKQRSA-N 0 3 417.513 4.251 20 0 HIADHN COc1ccccc1-c1csc(C2CCN(CCOC[C@@H]3CCCO3)CC2)n1 ZINC000555465659 942567455 /nfs/dbraw/zinc/56/74/55/942567455.db2.gz QTHAPNRASIVRBP-SFHVURJKSA-N 0 3 402.560 4.194 20 0 HIADHN Cc1cc(CNc2ccc(C(=O)NCCN3CCCC3)cc2)sc1Br ZINC000555505754 942609649 /nfs/dbraw/zinc/60/96/49/942609649.db2.gz DLBMRKPFWUWDPR-UHFFFAOYSA-N 0 3 422.392 4.257 20 0 HIADHN CSCc1cnc(CNC[C@@H]2CCN(c3cccc(Br)c3)C2)s1 ZINC000555529567 942629155 /nfs/dbraw/zinc/62/91/55/942629155.db2.gz DKFMHRUMEPWTQE-ZDUSSCGKSA-N 0 3 412.422 4.385 20 0 HIADHN COc1cc(Br)ccc1CCCNCc1ncc(CSC)s1 ZINC000555578021 942650278 /nfs/dbraw/zinc/65/02/78/942650278.db2.gz XPLIHBFIMAUGSA-UHFFFAOYSA-N 0 3 401.395 4.500 20 0 HIADHN Brc1cccc(N2CC[C@H](NCc3conc3Cc3ccccc3)C2)c1 ZINC000555584581 942655848 /nfs/dbraw/zinc/65/58/48/942655848.db2.gz YPWVEETXOMOIHZ-IBGZPJMESA-N 0 3 412.331 4.396 20 0 HIADHN COc1c(Br)cc(CN[C@@H](C)c2cc[nH]c(=O)c2)cc1Br ZINC000555606452 942665839 /nfs/dbraw/zinc/66/58/39/942665839.db2.gz KNQJKXRPNKDQLT-VIFPVBQESA-N 0 3 416.113 4.172 20 0 HIADHN CN1CCN(C[C@H](NCc2cc(Cl)ccc2OCC2CC2)c2ccccc2)CC1 ZINC000555702964 942705791 /nfs/dbraw/zinc/70/57/91/942705791.db2.gz SSABGGNZIMTVCT-QHCPKHFHSA-N 0 3 413.993 4.207 20 0 HIADHN O=C(CCc1ccccc1)N1CC[C@H](N[C@H]2CCc3sc(Br)cc32)C1 ZINC000556104545 942805975 /nfs/dbraw/zinc/80/59/75/942805975.db2.gz YDERSGIHBQPNTE-RDJZCZTQSA-N 0 3 419.388 4.321 20 0 HIADHN Cc1nc([C@@H]2CCCOC2)sc1C(=O)N(C)C1CCN(Cc2ccccc2)CC1 ZINC000556154034 942811634 /nfs/dbraw/zinc/81/16/34/942811634.db2.gz WQTUFJPYPDBGMT-LJQANCHMSA-N 0 3 413.587 4.082 20 0 HIADHN Cc1nc([C@H]2CCCOC2)sc1C(=O)N(C)C1CCN(Cc2ccccc2)CC1 ZINC000556154033 942811680 /nfs/dbraw/zinc/81/16/80/942811680.db2.gz WQTUFJPYPDBGMT-IBGZPJMESA-N 0 3 413.587 4.082 20 0 HIADHN O=C(Nc1ccccc1)N1CC[C@@H](N[C@@H]2CCc3sc(Br)cc32)C1 ZINC000556177628 942814516 /nfs/dbraw/zinc/81/45/16/942814516.db2.gz FHJUVZRPJYZZOO-UKRRQHHQSA-N 0 3 406.349 4.394 20 0 HIADHN NC(=O)[C@@H](Cc1ccc(C(F)(F)F)cc1)NCc1ccc(OC2CCCC2)cc1 ZINC000556291791 942834260 /nfs/dbraw/zinc/83/42/60/942834260.db2.gz BELHPJKBXCAKEJ-HXUWFJFHSA-N 0 3 406.448 4.213 20 0 HIADHN C[C@@]1(C2CC2)NC(=O)N(c2cccc(CN[C@H]3CCCCc4ccccc43)c2)C1=O ZINC000556292079 942834283 /nfs/dbraw/zinc/83/42/83/942834283.db2.gz NVZJWERZGOZCBC-DHLKQENFSA-N 0 3 403.526 4.469 20 0 HIADHN COc1ccccc1[C@H](NC(=O)N1CCN(C2CCC(C)CC2)CC1)c1ccccn1 ZINC000556332208 942843629 /nfs/dbraw/zinc/84/36/29/942843629.db2.gz OWGDLFHTHJFXEB-IMQCZEGASA-N 0 3 422.573 4.086 20 0 HIADHN CC1CCN(c2ccc(CNCc3cccc(I)c3)cn2)CC1 ZINC000556407462 942858393 /nfs/dbraw/zinc/85/83/93/942858393.db2.gz SHURCSMNEJBRNL-UHFFFAOYSA-N 0 3 421.326 4.212 20 0 HIADHN CCCCOc1ccc([C@@H](C)NCc2ccccc2N2CCN(C(C)=O)CC2)cc1 ZINC000556585249 942907252 /nfs/dbraw/zinc/90/72/52/942907252.db2.gz BJBNEJHJICDWQF-HXUWFJFHSA-N 0 3 409.574 4.385 20 0 HIADHN COC(=O)c1ccc(CN[C@@H]2CCO[C@H](c3ccccc3)C2)c(Br)c1 ZINC000556603365 942912145 /nfs/dbraw/zinc/91/21/45/942912145.db2.gz IWYXOIFCXKBKMZ-MJGOQNOKSA-N 0 3 404.304 4.246 20 0 HIADHN COc1c(N[C@@H]2CCCN(Cc3ccccc3)C2)cc(Cl)cc1C(=O)N(C)C ZINC000556607158 942913008 /nfs/dbraw/zinc/91/30/08/942913008.db2.gz AFLLPXZGWSOJIX-GOSISDBHSA-N 0 3 401.938 4.127 20 0 HIADHN CC[C@@H](NCc1ccc(CS(C)(=O)=O)cc1)c1ccc(OC(F)(F)F)cc1 ZINC000556858380 942942073 /nfs/dbraw/zinc/94/20/73/942942073.db2.gz PWXPHXHXTCWDAT-GOSISDBHSA-N 0 3 401.450 4.371 20 0 HIADHN C[C@@H](NCc1ccc(Cn2cnc3ccccc32)cc1)c1ccc2c(c1)OCC(=O)N2 ZINC000556870889 942945885 /nfs/dbraw/zinc/94/58/85/942945885.db2.gz JVUUIXUSALAUAF-QGZVFWFLSA-N 0 3 412.493 4.266 20 0 HIADHN CCc1nnc(NC(=O)[C@H](C)[C@@H](C)N[C@H](C)c2ccccc2OC(F)(F)F)s1 ZINC000556914023 942964162 /nfs/dbraw/zinc/96/41/62/942964162.db2.gz XCAJISJTINVGPQ-IJLUTSLNSA-N 0 3 416.469 4.313 20 0 HIADHN Cc1cc(NC(=O)c2nc(C(C)C)oc2C)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000556940423 942974229 /nfs/dbraw/zinc/97/42/29/942974229.db2.gz ZKQBMRNLPYRKFK-LJQANCHMSA-N 0 3 407.518 4.311 20 0 HIADHN O=C([C@H]1CN(Cc2ccccc2)CCC1(F)F)N1CC[C@H](COc2ccccc2)C1 ZINC000556967258 942982137 /nfs/dbraw/zinc/98/21/37/942982137.db2.gz YZHTWXNZNFFESH-RBBKRZOGSA-N 0 3 414.496 4.071 20 0 HIADHN Cn1nccc1C1C[C@H]2CC[C@@H](C1)N2CC(=O)N(c1ccccc1)C1CCCCC1 ZINC000556972109 942985222 /nfs/dbraw/zinc/98/52/22/942985222.db2.gz UNPZWTQCFXHYKL-VKGMXUHCSA-N 0 3 406.574 4.496 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)[C@@H](C)[C@H]2OCCc3sccc32)N(C)C)cc1 ZINC000556990280 942988603 /nfs/dbraw/zinc/98/86/03/942988603.db2.gz KXFDFQJJIZFQGD-XUEUYAKLSA-N 0 3 416.587 4.204 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)c1ccc(Sc2ccccn2)cc1 ZINC000557022601 942996160 /nfs/dbraw/zinc/99/61/60/942996160.db2.gz ATPFFQOOHFOBNW-FQEVSTJZSA-N 0 3 405.523 4.052 20 0 HIADHN Cn1c(C(=O)Nc2cccc(CN3CC[C@H](O)C3)c2)cc2cc(C(F)(F)F)ccc21 ZINC000557023122 942996290 /nfs/dbraw/zinc/99/62/90/942996290.db2.gz MWNYUTMZCATRBK-SFHVURJKSA-N 0 3 417.431 4.016 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)c1ncccc1Br)c1ccc(Cl)cc1 ZINC000557058642 943008143 /nfs/dbraw/zinc/00/81/43/943008143.db2.gz GNIXTNDPPABAAK-INIZCTEOSA-N 0 3 410.743 4.310 20 0 HIADHN CCC[C@H](CNC(=O)CN1CCCN(CC)CC1)c1ccc(Cl)cc1Cl ZINC000557086545 943016630 /nfs/dbraw/zinc/01/66/30/943016630.db2.gz JLICOFCSHJXEMB-MRXNPFEDSA-N 0 3 400.394 4.021 20 0 HIADHN Cc1c(CNC[C@H](O)COc2ccc(Br)cc2)oc2ccc(F)cc12 ZINC000557218326 943054413 /nfs/dbraw/zinc/05/44/13/943054413.db2.gz CTWBGIMJHCVHAG-HNNXBMFYSA-N 0 3 408.267 4.172 20 0 HIADHN O[C@H](CNCc1ccc(Oc2cccnc2)c(F)c1)COc1ccccc1Cl ZINC000557218160 943054494 /nfs/dbraw/zinc/05/44/94/943054494.db2.gz YBZBBQNHOULTRV-MRXNPFEDSA-N 0 3 402.853 4.196 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)N[C@@H](c1ccccc1)[C@@H]1CCOC1 ZINC000557228332 943056488 /nfs/dbraw/zinc/05/64/88/943056488.db2.gz RHRQFHXTCOCICR-IRLDBZIGSA-N 0 3 415.965 4.191 20 0 HIADHN O[C@@H](CN[C@H]1CCSc2c(F)cccc21)COc1ccc(Br)cc1 ZINC000557340010 943078130 /nfs/dbraw/zinc/07/81/30/943078130.db2.gz BADFHMBONINTHL-GUYCJALGSA-N 0 3 412.324 4.155 20 0 HIADHN O[C@@H](CN[C@@H]1CCSc2c(F)cccc21)COc1ccc(Br)cc1 ZINC000557340011 943078513 /nfs/dbraw/zinc/07/85/13/943078513.db2.gz BADFHMBONINTHL-SUMWQHHRSA-N 0 3 412.324 4.155 20 0 HIADHN Cc1ccc(CN2CC[C@H](CN(C)C(=O)CCC(=O)c3ccc(F)cc3)C2)s1 ZINC000557497198 943168210 /nfs/dbraw/zinc/16/82/10/943168210.db2.gz ZNGBQQHNLBEDSU-QGZVFWFLSA-N 0 3 402.535 4.139 20 0 HIADHN O=C(CNC1(c2ccc(Cl)cc2)CC1)Nc1cccc(CN2CCSCC2)c1 ZINC000557540866 943200167 /nfs/dbraw/zinc/20/01/67/943200167.db2.gz JHMMBMMZVWUMHK-UHFFFAOYSA-N 0 3 415.990 4.106 20 0 HIADHN O=C(c1ccc(-c2cccs2)o1)N1CCC[C@@H](c2n[nH]cc2CN2CCCC2)C1 ZINC000557646763 943246563 /nfs/dbraw/zinc/24/65/63/943246563.db2.gz LEEIGNZAYIRWGM-MRXNPFEDSA-N 0 3 410.543 4.347 20 0 HIADHN C[C@H](C(=O)N1CCC[C@H](c2n[nH]cc2CN2CCCC2)C1)c1cc2ccccc2o1 ZINC000557645881 943246608 /nfs/dbraw/zinc/24/66/08/943246608.db2.gz MGOSEXHLANJQBI-HKUYNNGSSA-N 0 3 406.530 4.261 20 0 HIADHN O=C(c1occc1-c1ccc(F)cc1)N1CCC[C@H](c2n[nH]cc2CN2CCCC2)C1 ZINC000557645943 943246668 /nfs/dbraw/zinc/24/66/68/943246668.db2.gz CONBYLXPPCGMPL-SFHVURJKSA-N 0 3 422.504 4.424 20 0 HIADHN CC1CCN([C@@H](CNC(=O)NCC2(c3ccccn3)CCC2)c2cccs2)CC1 ZINC000557748302 943278273 /nfs/dbraw/zinc/27/82/73/943278273.db2.gz NQQKMPQJLGBWNT-IBGZPJMESA-N 0 3 412.603 4.337 20 0 HIADHN CCCN1CCN(c2ccccc2CNCc2sccc2Br)CC1 ZINC000557791678 943292368 /nfs/dbraw/zinc/29/23/68/943292368.db2.gz IRVVEIYXHKEYJN-UHFFFAOYSA-N 0 3 408.409 4.332 20 0 HIADHN COCCCCN(Cc1ccccc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)[C@H]1C ZINC000557885529 943320683 /nfs/dbraw/zinc/32/06/83/943320683.db2.gz UFSOLRNIKDKKGM-XUZZJYLKSA-N 0 3 409.574 4.288 20 0 HIADHN C[C@@H]1[C@H](NC(=O)Nc2cccc(C(=O)N3CCCCC3)c2)CCN1Cc1ccccc1 ZINC000557884314 943320827 /nfs/dbraw/zinc/32/08/27/943320827.db2.gz BMXZMSHRMCGUAJ-AUSIDOKSSA-N 0 3 420.557 4.097 20 0 HIADHN C/C=C\c1ccc(OC[C@@H](O)CNCc2csc(Br)c2)c(OC)c1 ZINC000557888742 943321408 /nfs/dbraw/zinc/32/14/08/943321408.db2.gz HTDBNJRLSXGTSS-JZIMQPMSSA-N 0 3 412.349 4.082 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)[C@@H]1C[C@H]1c1cccc(Br)c1)c1ccco1 ZINC000557911316 943326600 /nfs/dbraw/zinc/32/66/00/943326600.db2.gz FHVTZXZMMSFFMZ-VIBAHUMZSA-N 0 3 405.336 4.391 20 0 HIADHN CCCN(C)[C@H](CNC(=O)NC[C@@H]1CCCn2cc(C)nc21)c1ccc(Cl)cc1 ZINC000557921702 943329599 /nfs/dbraw/zinc/32/95/99/943329599.db2.gz QZYWCDXWPMUNOQ-AZUAARDMSA-N 0 3 417.985 4.105 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)c2cccc(Oc3cnccn3)c2)N(C)C)cc1 ZINC000557937200 943334059 /nfs/dbraw/zinc/33/40/59/943334059.db2.gz WVJFTLMQPWYGIK-QFIPXVFZSA-N 0 3 420.513 4.089 20 0 HIADHN CCO[C@@H](C)c1ncc(C(=O)NC[C@@H](c2ccc(CC(C)C)cc2)N(C)C)s1 ZINC000557985747 943347566 /nfs/dbraw/zinc/34/75/66/943347566.db2.gz PJZBVSDPUYGMNB-LPHOPBHVSA-N 0 3 403.592 4.472 20 0 HIADHN C[C@H]1C[C@@H]1N1CCN(C(=O)c2cc(Cl)cc(F)c2Br)C[C@@H](C)C1 ZINC000558027621 943361159 /nfs/dbraw/zinc/36/11/59/943361159.db2.gz QZHNGBNQHYNTFD-PGUXBMHVSA-N 0 3 403.723 4.044 20 0 HIADHN CCCN(C)[C@H](CNC(=O)N1CC[C@@H](C2CCOCC2)C1)c1ccc(Cl)cc1 ZINC000558104683 943380070 /nfs/dbraw/zinc/38/00/70/943380070.db2.gz AEOJSWVRNRTJGF-TZIWHRDSSA-N 0 3 407.986 4.181 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)Nc1cc(N2CCCC2=O)ccc1Cl)c1ccco1 ZINC000558268755 943470180 /nfs/dbraw/zinc/47/01/80/943470180.db2.gz UDLSQTWNJHIAFF-KDOFPFPSSA-N 0 3 418.925 4.311 20 0 HIADHN Fc1ccc(-n2cc(CN3C[C@H](c4ccccc4)[C@H]4COCC[C@H]43)nn2)c(Cl)c1 ZINC000558412318 943552675 /nfs/dbraw/zinc/55/26/75/943552675.db2.gz VYJXHYSOJWIPFE-SFHLNBCPSA-N 0 3 412.896 4.064 20 0 HIADHN C[C@H](N[C@H]1CCN(C)[C@H]1c1ccc(Cl)cc1)C(=O)Nc1ccc(F)cc1Cl ZINC000558467065 943567746 /nfs/dbraw/zinc/56/77/46/943567746.db2.gz NCJFQNFGLMNZSP-NXXSPTCGSA-N 0 3 410.320 4.495 20 0 HIADHN NS(=O)(=O)c1ccc2c(c1)[C@H](N[C@H](Cc1ccccc1)c1cccs1)CCC2 ZINC000558498143 943576421 /nfs/dbraw/zinc/57/64/21/943576421.db2.gz PWIRLHHLYKOODW-NHCUHLMSSA-N 0 3 412.580 4.347 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCC(C)(C)c1ncccc1C)c1cccc(OC)c1 ZINC000558608592 943616737 /nfs/dbraw/zinc/61/67/37/943616737.db2.gz STFJAEDOFYMBPS-NRFANRHFSA-N 0 3 412.578 4.059 20 0 HIADHN c1coc(-c2nnc(CN[C@@H]3CN(Cc4ccccc4)C[C@H]3c3ccccc3)o2)c1 ZINC000558737351 943636041 /nfs/dbraw/zinc/63/60/41/943636041.db2.gz AKSSMIBHXABYNF-LEWJYISDSA-N 0 3 400.482 4.087 20 0 HIADHN Cc1ccc(CNCc2ccc(C)cc2-c2cnn(C)c2)c(OC[C@@H]2CCOC2)c1 ZINC000558783110 943662220 /nfs/dbraw/zinc/66/22/20/943662220.db2.gz WMWSOUOJKUINKA-HXUWFJFHSA-N 0 3 405.542 4.409 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)Nc1ccc2nnc(C3CCC3)n2c1 ZINC000558795498 943666216 /nfs/dbraw/zinc/66/62/16/943666216.db2.gz BSTASTPOTLIUHB-QGZVFWFLSA-N 0 3 410.547 4.017 20 0 HIADHN CC(=O)NCCN(Cc1ccc(Oc2ccccc2)c(F)c1)C1CCSCC1 ZINC000558864056 943707040 /nfs/dbraw/zinc/70/70/40/943707040.db2.gz LJLBUHKRUYECSH-UHFFFAOYSA-N 0 3 402.535 4.452 20 0 HIADHN CCN1CC[C@@H](NCc2nc3ccccc3nc2C)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000558895826 943729845 /nfs/dbraw/zinc/72/98/45/943729845.db2.gz PHZNMOXCWCPBDE-KNQAVFIVSA-N 0 3 400.448 4.281 20 0 HIADHN COc1cccc([C@@H]2[C@@H](N[C@H](C)C(=O)Nc3cc(F)ccc3C)CCN2C2CC2)c1 ZINC000558897051 943730426 /nfs/dbraw/zinc/73/04/26/943730426.db2.gz NVCJALHCYBOFSZ-XORNHQRDSA-N 0 3 411.521 4.037 20 0 HIADHN COc1cccc([C@@H]2[C@@H](NCC(=O)N[C@@H](c3ccccc3)C(C)C)CCN2C2CC2)c1 ZINC000558902666 943737571 /nfs/dbraw/zinc/73/75/71/943737571.db2.gz TXCBECYTSJEHSA-SKBVVQJISA-N 0 3 421.585 4.076 20 0 HIADHN CN(C)C[C@@H](NC(=O)NCc1cccc(OCC(F)F)c1)c1ccc(Cl)cc1 ZINC000558941177 943762031 /nfs/dbraw/zinc/76/20/31/943762031.db2.gz SGDRRBUFVZWBSI-GOSISDBHSA-N 0 3 411.880 4.086 20 0 HIADHN COc1ccc(C(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)cc1-c1ccccn1 ZINC000558972975 943777623 /nfs/dbraw/zinc/77/76/23/943777623.db2.gz PRINCWNGODIQSR-OAQYLSRUSA-N 0 3 409.917 4.443 20 0 HIADHN COc1ccc(CCCC(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)c(OC)c1 ZINC000558972567 943777875 /nfs/dbraw/zinc/77/78/75/943777875.db2.gz BSSDHFMABAYSSQ-HXUWFJFHSA-N 0 3 404.938 4.099 20 0 HIADHN CCOCCCn1c(C2CCC2)nnc1N1CCN(Cc2ccccc2)C(C)(C)C1 ZINC000559048370 943815501 /nfs/dbraw/zinc/81/55/01/943815501.db2.gz YEMJECRFBUGVDC-UHFFFAOYSA-N 0 3 411.594 4.073 20 0 HIADHN Cc1nc(COc2ccc(CN3CCC(N4CCc5cc(F)ccc54)CC3)cc2)no1 ZINC000559074188 943826589 /nfs/dbraw/zinc/82/65/89/943826589.db2.gz XHAFERLIBRYMEZ-UHFFFAOYSA-N 0 3 422.504 4.123 20 0 HIADHN C[C@H](Oc1ccccc1NC(=O)[C@@H]1CCCN(Cc2cccnc2)C1)C(F)(F)F ZINC000559099063 943838197 /nfs/dbraw/zinc/83/81/97/943838197.db2.gz BZTLTRWPRLADLM-DOTOQJQBSA-N 0 3 407.436 4.262 20 0 HIADHN C[C@@H](Cc1cnc2ccccc2n1)C(=O)NC[C@@H](c1ccccc1)N1CCC(C)CC1 ZINC000559149910 943854526 /nfs/dbraw/zinc/85/45/26/943854526.db2.gz PXGBBUMDFVFKLK-CPJSRVTESA-N 0 3 416.569 4.398 20 0 HIADHN COc1cc(CNCc2cc3ccccc3s2)ccc1OCC(=O)N1CCCC1 ZINC000559308761 943893781 /nfs/dbraw/zinc/89/37/81/943893781.db2.gz XTMFXUDUGIMYJM-UHFFFAOYSA-N 0 3 410.539 4.201 20 0 HIADHN CC(C)[C@H](CCc1ccccc1)C(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000559449970 943960240 /nfs/dbraw/zinc/96/02/40/943960240.db2.gz LEJIRHOMPYAXHM-LGVFNWMJSA-N 0 3 400.607 4.239 20 0 HIADHN COC(=O)c1c(CN2CCC[C@@H](CO)CC2)nc2ccccc2c1-c1ccccc1 ZINC000559458326 943963556 /nfs/dbraw/zinc/96/35/56/943963556.db2.gz BPRLFGSYUQKTLZ-GOSISDBHSA-N 0 3 404.510 4.283 20 0 HIADHN O[C@@H](CNCc1cc(F)cc(Br)c1)CO[C@@H]1CCCc2ccccc21 ZINC000559739294 944041968 /nfs/dbraw/zinc/04/19/68/944041968.db2.gz DOVGRWANXANCIL-AZUAARDMSA-N 0 3 408.311 4.133 20 0 HIADHN Brc1cccc2[nH]cc(CC[NH2+][C@H](c3cccs3)c3nnc[n-]3)c21 ZINC000559853707 944068140 /nfs/dbraw/zinc/06/81/40/944068140.db2.gz BOZXQUVXTODXJC-MRXNPFEDSA-N 0 3 402.321 4.032 20 0 HIADHN CCOC1(CN[C@H](c2ccc(C)cc2)c2cccc(S(C)(=O)=O)c2)CCCC1 ZINC000559891414 944076646 /nfs/dbraw/zinc/07/66/46/944076646.db2.gz XWGYXWOIWDJKDQ-JOCHJYFZSA-N 0 3 401.572 4.427 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)C(=O)Nc2cccc(C(F)F)c2)N(CC)CC)cc1 ZINC000560254244 944208411 /nfs/dbraw/zinc/20/84/11/944208411.db2.gz YDLAGNUYXMSWRK-HXUWFJFHSA-N 0 3 417.500 4.324 20 0 HIADHN C[C@@H](N[C@@H](c1cncc(Br)c1)C1CC1)c1ccc(NS(C)(=O)=O)cc1 ZINC000560268041 944213236 /nfs/dbraw/zinc/21/32/36/944213236.db2.gz IMJOPGOGMKEGQP-KZULUSFZSA-N 0 3 424.364 4.018 20 0 HIADHN CN(Cc1cnn(CC(F)(F)F)c1)CC1(c2ccc(Br)cc2)CC1 ZINC000560553806 944251896 /nfs/dbraw/zinc/25/18/96/944251896.db2.gz KGEKZHRIAIBPBJ-UHFFFAOYSA-N 0 3 402.258 4.372 20 0 HIADHN CCc1nnc(NC(=O)[C@H](C)[C@@H](C)N[C@H](c2ccccc2)c2ccc(OC)cc2)s1 ZINC000560571947 944258157 /nfs/dbraw/zinc/25/81/57/944258157.db2.gz OUEOFCSNMFBXLY-WHSLLNHNSA-N 0 3 424.570 4.451 20 0 HIADHN Brc1ccc2c(c1)C=C(CN1CCC[C@H](c3nnc(C4CC4)[nH]3)C1)CO2 ZINC000560680884 944292992 /nfs/dbraw/zinc/29/29/92/944292992.db2.gz ZEJQBAGOTUMECQ-HNNXBMFYSA-N 0 3 415.335 4.100 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)c1cc(OC)c(OC)cc1OC)c1ccc(Cl)cc1 ZINC000560708673 944302540 /nfs/dbraw/zinc/30/25/40/944302540.db2.gz MFYGYQHIVGWWMO-SFHVURJKSA-N 0 3 420.937 4.179 20 0 HIADHN C[C@@H](N[C@@H](C)c1cccc(OC(F)(F)F)c1)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000560885484 944364309 /nfs/dbraw/zinc/36/43/09/944364309.db2.gz XBMYIXJELGUKCO-KGLIPLIRSA-N 0 3 416.465 4.247 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3ccc(-c4ccncc4)c(C)c3)cc2)CC1 ZINC000561091790 944444230 /nfs/dbraw/zinc/44/42/30/944444230.db2.gz OANXHQRFYNREME-UHFFFAOYSA-N 0 3 400.526 4.451 20 0 HIADHN CC(=O)c1c(C)[nH]c(C(=O)N2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)c1C(C)C ZINC000561282762 944539077 /nfs/dbraw/zinc/53/90/77/944539077.db2.gz YWBYQFQVRAWJNZ-RUZDIDTESA-N 0 3 407.558 4.387 20 0 HIADHN C[C@H]1CN(C(=O)CCC(=O)c2cc(Cl)sc2Cl)CCN(C2CCC2)C1 ZINC000561527852 944657059 /nfs/dbraw/zinc/65/70/59/944657059.db2.gz VRYQLXQPFBLREA-GFCCVEGCSA-N 0 3 403.375 4.351 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)c1ccc(NC(=O)CC(C)C)c(F)c1)c1ccco1 ZINC000561610575 944706004 /nfs/dbraw/zinc/70/60/04/944706004.db2.gz NOCJZYGTJKHTHY-HNAYVOBHSA-N 0 3 403.498 4.263 20 0 HIADHN CCO[C@H](C)c1ncc(C(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)s1 ZINC000561651577 944729244 /nfs/dbraw/zinc/72/92/44/944729244.db2.gz KTPDCBRRQQNDFF-CRAIPNDOSA-N 0 3 405.564 4.061 20 0 HIADHN CCOc1cccc2[nH]cc(CC(=O)NC[C@@H](c3ccc(OC(C)C)cc3)N(C)C)c21 ZINC000561676907 944741943 /nfs/dbraw/zinc/74/19/43/944741943.db2.gz FZHAWCFSAHTZMT-QFIPXVFZSA-N 0 3 423.557 4.315 20 0 HIADHN Cc1onc(-c2ccc(C(F)(F)F)cc2)c1C(=O)N1CCN([C@@H]2C[C@@H]2C)C[C@@H](C)C1 ZINC000561762529 944785224 /nfs/dbraw/zinc/78/52/24/944785224.db2.gz URXNMRBYUDCRQS-QWQRMKEZSA-N 0 3 421.463 4.471 20 0 HIADHN C[C@@H]1C[C@H]1N1CCN(C(=O)c2cccc(-c3noc(CC(C)(C)C)n3)c2)C[C@@H](C)C1 ZINC000561761970 944785511 /nfs/dbraw/zinc/78/55/11/944785511.db2.gz PBALVGDGKZEISJ-SQGPQFPESA-N 0 3 410.562 4.128 20 0 HIADHN COc1ccccc1-c1nc(C2CCN(Cc3ccc(OC)c(OC)c3C)CC2)no1 ZINC000561959471 944875585 /nfs/dbraw/zinc/87/55/85/944875585.db2.gz CETLVXJPSHUVMG-UHFFFAOYSA-N 0 3 423.513 4.450 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)Nc1ccc(C(=O)N(CC)CC)cc1)c1ccco1 ZINC000562013424 944893903 /nfs/dbraw/zinc/89/39/03/944893903.db2.gz OZSUSKCIOCGARL-VQIMIIECSA-N 0 3 400.523 4.013 20 0 HIADHN CC[C@@H]1CN(C(=O)Nc2ccccc2CN(C)C2CCCCC2)C[C@@H](C)[S@@]1=O ZINC000562018647 944897390 /nfs/dbraw/zinc/89/73/90/944897390.db2.gz CCSDXSJKFVEMNR-KJFKMWBDSA-N 0 3 405.608 4.214 20 0 HIADHN C[C@@H](NCc1cccc(N2C(=O)NC3(CCCC3)C2=O)c1)c1cc2c(s1)CCC2 ZINC000562103055 944940254 /nfs/dbraw/zinc/94/02/54/944940254.db2.gz NMEAHBAFTHLVHK-OAHLLOKOSA-N 0 3 409.555 4.457 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)Nc2cnc3c(cnn3C(C)C)c2)N(C)C)cc1 ZINC000562112665 944946635 /nfs/dbraw/zinc/94/66/35/944946635.db2.gz PCUIXEARZXJFHB-NRFANRHFSA-N 0 3 424.549 4.224 20 0 HIADHN CC(C)Cc1ccc([C@@H](CNC(=O)Nc2cc(C(F)(F)F)c[nH]c2=O)N(C)C)cc1 ZINC000562139100 944967771 /nfs/dbraw/zinc/96/77/71/944967771.db2.gz IHBJPTCKRGUVCZ-GOSISDBHSA-N 0 3 424.467 4.429 20 0 HIADHN Cc1cc(N2CCSCC2)ccc1NC(=O)N[C@H](C)[C@@H](c1ccccc1)N(C)C ZINC000562141880 944969742 /nfs/dbraw/zinc/96/97/42/944969742.db2.gz HGHKCVJIRPFRTH-GCJKJVERSA-N 0 3 412.603 4.361 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)Nc2cccc(C)c2Cl)CC1 ZINC000562296892 945055228 /nfs/dbraw/zinc/05/52/28/945055228.db2.gz UFPSJSKNYUXAHQ-UHFFFAOYSA-N 0 3 400.954 4.108 20 0 HIADHN CSc1ccc([C@H](CNC(=O)c2ccc(-c3nc(C4CC4)no3)cc2)N(C)C)cc1 ZINC000564094964 945377337 /nfs/dbraw/zinc/37/73/37/945377337.db2.gz PNZYDEZCVLJUQT-FQEVSTJZSA-N 0 3 422.554 4.369 20 0 HIADHN Brc1cc(Br)cc(CNCc2ccc(-n3cncn3)cc2)c1 ZINC000564115138 945384476 /nfs/dbraw/zinc/38/44/76/945384476.db2.gz UIRNXHQVFHOPBL-UHFFFAOYSA-N 0 3 422.124 4.082 20 0 HIADHN CC(C)c1ccc(-c2noc(CCC(=O)N[C@H](C)CN(C)Cc3ccccc3)n2)cc1 ZINC000564121117 945387778 /nfs/dbraw/zinc/38/77/78/945387778.db2.gz WKPRBQMZBUPCEG-LJQANCHMSA-N 0 3 420.557 4.429 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1NC(=O)N[C@@H]1CCN(Cc2ccccc2)[C@@H]1C ZINC000564136735 945396174 /nfs/dbraw/zinc/39/61/74/945396174.db2.gz YYODYENFBFNCCC-XMSQKQJNSA-N 0 3 403.530 4.274 20 0 HIADHN COc1ccc2c(c1F)CC[C@H]2[NH2+]Cc1nnc(-c2ccc(Br)cc2)[n-]1 ZINC000564149552 945401583 /nfs/dbraw/zinc/40/15/83/945401583.db2.gz YBSPCHCNTVNCEV-OAHLLOKOSA-N 0 3 417.282 4.159 20 0 HIADHN COc1ccc2c(c1F)CC[C@@H]2[NH2+]Cc1nnc(-c2ccc(Br)cc2)[n-]1 ZINC000564149551 945401869 /nfs/dbraw/zinc/40/18/69/945401869.db2.gz YBSPCHCNTVNCEV-HNNXBMFYSA-N 0 3 417.282 4.159 20 0 HIADHN C[C@@H](c1ccccc1F)N1CCC[C@H](NCc2ccc(-c3cnn(C)c3)s2)C1=O ZINC000564229627 945444052 /nfs/dbraw/zinc/44/40/52/945444052.db2.gz FAHAUENFNDXQQS-YWZLYKJASA-N 0 3 412.534 4.130 20 0 HIADHN COc1cc(Br)c(CN[C@@H]2CCN(C)[C@H]2c2ccccc2)cc1OC ZINC000564256047 945473807 /nfs/dbraw/zinc/47/38/07/945473807.db2.gz MHJYVVUVCSDZPZ-XLIONFOSSA-N 0 3 405.336 4.001 20 0 HIADHN Brc1cccc2[nH]cc(Cc3noc(C4CCN(C5CC5)CC4)n3)c21 ZINC000564265142 945480989 /nfs/dbraw/zinc/48/09/89/945480989.db2.gz XVZYHXCCNNRDPQ-UHFFFAOYSA-N 0 3 401.308 4.246 20 0 HIADHN FC1(F)CCN(Cc2ccccc2)C[C@@H]1c1nc(-c2ccc(-c3nnco3)cc2)no1 ZINC000564273871 945487567 /nfs/dbraw/zinc/48/75/67/945487567.db2.gz XSJSHSKMIKEUAQ-GOSISDBHSA-N 0 3 423.423 4.411 20 0 HIADHN C[C@H](c1cccc(N2CCCS2(=O)=O)c1)N(C)C/C=C/c1ccc(F)c(F)c1 ZINC000564302879 945505813 /nfs/dbraw/zinc/50/58/13/945505813.db2.gz VUVQKUIDKVXCNZ-MQDFFIGUSA-N 0 3 406.498 4.211 20 0 HIADHN CCN(CCOC)c1cccc(CN2CCC[C@H](c3nc4ccc(F)cc4o3)C2)n1 ZINC000564316034 945512998 /nfs/dbraw/zinc/51/29/98/945512998.db2.gz UJJKOMFCACKDOY-KRWDZBQOSA-N 0 3 412.509 4.214 20 0 HIADHN COc1ccc(C[C@@H](CO)CNCc2csc(-c3ccc(Cl)cc3)n2)cc1O ZINC000564322151 945515170 /nfs/dbraw/zinc/51/51/70/945515170.db2.gz CRJVZQSSBJEPMN-OAHLLOKOSA-N 0 3 418.946 4.119 20 0 HIADHN O=C(NC[C@H]1CCCN1Cc1ccccc1)Nc1ccc(C(=O)NC2CCCC2)cc1 ZINC000564363111 945529900 /nfs/dbraw/zinc/52/99/00/945529900.db2.gz RQWSKKISABRWLH-HSZRJFAPSA-N 0 3 420.557 4.145 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)NC1(c2cccc(Cl)c2)CCCC1 ZINC000564383254 945546771 /nfs/dbraw/zinc/54/67/71/945546771.db2.gz XXZBGWKCMRHRJG-UHFFFAOYSA-N 0 3 413.949 4.234 20 0 HIADHN CN(Cc1ccc(Cl)s1)C(=O)CN[C@H]1CCN(C)[C@@H]1c1ccc(Cl)cc1 ZINC000564395109 945553023 /nfs/dbraw/zinc/55/30/23/945553023.db2.gz JUZSZCZYXIECQJ-QFBILLFUSA-N 0 3 412.386 4.048 20 0 HIADHN C[C@H](N[C@H]1CCN(C)[C@@H]1c1ccc(Cl)c(F)c1)C(=O)Nc1ccc(F)cc1F ZINC000564400084 945556372 /nfs/dbraw/zinc/55/63/72/945556372.db2.gz XHQFJVCDRHPXOI-KQPNJSLMSA-N 0 3 411.855 4.119 20 0 HIADHN O[C@@H]1[C@@H](CNCc2cc(C(F)(F)F)ccc2Br)CCC12CCOCC2 ZINC000564413240 945565164 /nfs/dbraw/zinc/56/51/64/945565164.db2.gz CACKQFMEZCPFEO-MLGOLLRUSA-N 0 3 422.285 4.125 20 0 HIADHN COc1ccc(CN(C)C(=O)CN[C@@H](Cc2ccccc2)c2ccc(OC)cc2)cc1 ZINC000564415464 945566895 /nfs/dbraw/zinc/56/68/95/945566895.db2.gz RRXXUKXZAHXHLO-VWLOTQADSA-N 0 3 418.537 4.236 20 0 HIADHN COc1ccc([C@@H](Cc2ccccc2)NCc2ccccc2CS(C)(=O)=O)cc1 ZINC000564423393 945573328 /nfs/dbraw/zinc/57/33/28/945573328.db2.gz IVHAIKQJGCTNBO-XMMPIXPASA-N 0 3 409.551 4.313 20 0 HIADHN CC[C@@H](NCc1cccc(N2C(=O)NC3(CCCC3)C2=O)c1)c1ccc(OC)cc1 ZINC000564434481 945583103 /nfs/dbraw/zinc/58/31/03/945583103.db2.gz XRCXZIAIBMDYMZ-OAQYLSRUSA-N 0 3 407.514 4.305 20 0 HIADHN O=C(Nc1ccc(Cl)c(Cl)c1)C1CCN(Cc2c[nH]c3nccnc23)CC1 ZINC000564527846 945654283 /nfs/dbraw/zinc/65/42/83/945654283.db2.gz DHNYMDYNVQGHKE-UHFFFAOYSA-N 0 3 404.301 4.067 20 0 HIADHN Cc1noc(CSc2ccccc2C(=O)N[C@@H]2CCN(Cc3ccccc3)[C@@H]2C)n1 ZINC000564680902 945727160 /nfs/dbraw/zinc/72/71/60/945727160.db2.gz ILPRZTWBNCRFOA-OXQOHEQNSA-N 0 3 422.554 4.063 20 0 HIADHN C[C@@H](NC[C@@H](CO)Cc1c(F)cccc1Cl)c1ccc(Br)cn1 ZINC000564766875 945754521 /nfs/dbraw/zinc/75/45/21/945754521.db2.gz RIWPGPUGZYNZKP-NEPJUHHUSA-N 0 3 401.707 4.138 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1cc2c(cc1Br)CCC2 ZINC000564773452 945755869 /nfs/dbraw/zinc/75/58/69/945755869.db2.gz AVMAJMKXFMHVDD-UHFFFAOYSA-N 0 3 406.324 4.127 20 0 HIADHN C[C@@H](NCCCOc1ccc(C(F)(F)F)cn1)c1ccc(Br)cn1 ZINC000564783202 945757581 /nfs/dbraw/zinc/75/75/81/945757581.db2.gz CLEVEFAINJWPDJ-LLVKDONJSA-N 0 3 404.230 4.378 20 0 HIADHN CN(C(=O)N[C@H](c1ccccc1)[C@H]1CCOC1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000565093829 945773071 /nfs/dbraw/zinc/77/30/71/945773071.db2.gz RNWZTRFQFAPARH-RBZQAINGSA-N 0 3 407.558 4.070 20 0 HIADHN C[C@@H](CCN1CCCN(S(=O)(=O)c2cccc3cnccc32)CC1)c1ccccc1 ZINC000565389338 945822831 /nfs/dbraw/zinc/82/28/31/945822831.db2.gz CNAKHSJHZPPBQO-FQEVSTJZSA-N 0 3 423.582 4.125 20 0 HIADHN C[C@H](c1ccc(Cl)cc1)N1CCN(C[C@@H]2CCN(C(=O)c3ccccc3)C2)CC1 ZINC000565490303 945837313 /nfs/dbraw/zinc/83/73/13/945837313.db2.gz DKRNFAIHBBHNHD-UXHICEINSA-N 0 3 411.977 4.181 20 0 HIADHN CN1CCC(N(Cc2ccccc2Br)C(=O)CCC(F)(F)F)CC1 ZINC000565514536 945843699 /nfs/dbraw/zinc/84/36/99/945843699.db2.gz TZISLUDEKSKYTK-UHFFFAOYSA-N 0 3 407.274 4.214 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)NCCc1cccc2cccnc21 ZINC000565570080 945851152 /nfs/dbraw/zinc/85/11/52/945851152.db2.gz SGYLACDONOZLIZ-FQEVSTJZSA-N 0 3 402.542 4.083 20 0 HIADHN Cc1ccc(C(=O)N[C@@H]2CCN(Cc3ccccc3)[C@@H]2C)cc1NC(=O)c1ccco1 ZINC000565971076 945948700 /nfs/dbraw/zinc/94/87/00/945948700.db2.gz FQIUEQZTKUSPFI-WIYYLYMNSA-N 0 3 417.509 4.233 20 0 HIADHN Cc1ccc(C(=O)N[C@@H]2CCN(Cc3ccccc3)[C@H]2C)cc1NC(=O)c1ccco1 ZINC000565971072 945948948 /nfs/dbraw/zinc/94/89/48/945948948.db2.gz FQIUEQZTKUSPFI-GHTZIAJQSA-N 0 3 417.509 4.233 20 0 HIADHN CCN1CC[C@H](N[C@H](C)C(=O)Nc2ccccc2C)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000566347719 946006680 /nfs/dbraw/zinc/00/66/80/946006680.db2.gz WGWIPQYQMUNFMY-XWRIVVANSA-N 0 3 405.464 4.164 20 0 HIADHN O=C([C@H]1CN(Cc2ccccc2)CCC1(F)F)N1CCC(CC(F)(F)F)CC1 ZINC000566381392 946015728 /nfs/dbraw/zinc/01/57/28/946015728.db2.gz OXLSHPRJMKDLLA-QGZVFWFLSA-N 0 3 404.423 4.335 20 0 HIADHN Cc1nn(-c2ccc(Br)cc2)c(C)c1CN1CC[C@@H](COC(F)F)C1 ZINC000566389162 946018763 /nfs/dbraw/zinc/01/87/63/946018763.db2.gz OSTKXBWYNXHRFC-CQSZACIVSA-N 0 3 414.294 4.313 20 0 HIADHN COCCOc1ccc(NC(=O)N[C@H]2CCN(Cc3ccccc3)[C@@H]2C)cc1Cl ZINC000566522490 946029506 /nfs/dbraw/zinc/02/95/06/946029506.db2.gz PNJFEVCVJPKVKY-UZLBHIALSA-N 0 3 417.937 4.150 20 0 HIADHN CSc1ccc([C@@H](CNC(=O)c2csc(Nc3ccccn3)n2)N(C)C)cc1 ZINC000566640792 946061129 /nfs/dbraw/zinc/06/11/29/946061129.db2.gz FUZIMTYWBDHJIP-QGZVFWFLSA-N 0 3 413.572 4.036 20 0 HIADHN COc1ccccc1N1CC[C@@H](NC/C(C)=C/c2ccccc2OC(F)F)C1=O ZINC000566685537 946072421 /nfs/dbraw/zinc/07/24/21/946072421.db2.gz RVRIFQSULYZQKD-LCJXNMAOSA-N 0 3 402.441 4.095 20 0 HIADHN C/C(=C/c1ccccc1OC(F)F)CNCc1ccncc1OC[C@H]1CCOC1 ZINC000567033944 946223552 /nfs/dbraw/zinc/22/35/52/946223552.db2.gz JBJRQZNSAIQIQR-RNIVLKNTSA-N 0 3 404.457 4.291 20 0 HIADHN O=C(CCC(F)(F)F)N1CCC[C@@H](NCc2ccccc2OCc2ccccn2)C1 ZINC000567196402 946266893 /nfs/dbraw/zinc/26/68/93/946266893.db2.gz IDQWFTJVEQCGLR-GOSISDBHSA-N 0 3 421.463 4.084 20 0 HIADHN CCOC(=O)c1nnc(-c2cccc(C[NH2+][C@@H](C)C3CCC(C(F)(F)F)CC3)c2)[n-]1 ZINC000567312378 946308753 /nfs/dbraw/zinc/30/87/53/946308753.db2.gz PHWYECWRHMKLFT-KTAKPFMOSA-N 0 3 424.467 4.495 20 0 HIADHN CCOC(=O)c1nc(-c2cccc(C[NH2+][C@@H](C)C3CCC(C(F)(F)F)CC3)c2)n[n-]1 ZINC000567312378 946308766 /nfs/dbraw/zinc/30/87/66/946308766.db2.gz PHWYECWRHMKLFT-KTAKPFMOSA-N 0 3 424.467 4.495 20 0 HIADHN CC(C)C[C@@H](NC(=O)N1CC[C@H](N2CCN(C(C)C)CC2)C1)c1ccc(Cl)cc1 ZINC000567438537 946341804 /nfs/dbraw/zinc/34/18/04/946341804.db2.gz FHSUWOPAPOYNOX-FCHUYYIVSA-N 0 3 421.029 4.237 20 0 HIADHN COC(=O)c1cc(NC(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)cc2[nH]ccc21 ZINC000567646777 946391084 /nfs/dbraw/zinc/39/10/84/946391084.db2.gz CIDMIWDLRALSEE-IBGZPJMESA-N 0 3 414.893 4.032 20 0 HIADHN CC(=O)NCCN(CCCC(=O)Nc1c(C)cccc1C)Cc1ccc(C)s1 ZINC000567756627 946401815 /nfs/dbraw/zinc/40/18/15/946401815.db2.gz IAGBSTYNUZSPSN-UHFFFAOYSA-N 0 3 401.576 4.030 20 0 HIADHN COc1ccc(C(=O)N[C@H](CN(C)C)c2ccc(F)cc2)cc1OC1CCCC1 ZINC000567780642 946405720 /nfs/dbraw/zinc/40/57/20/946405720.db2.gz DHEPBNGBJMUXPG-HXUWFJFHSA-N 0 3 400.494 4.188 20 0 HIADHN C[C@@H](NC[C@@H]1CSCCN1Cc1ccccc1)c1ccc(Br)cn1 ZINC000567986325 946439181 /nfs/dbraw/zinc/43/91/81/946439181.db2.gz RSYKNSNDZLJMMY-CRAIPNDOSA-N 0 3 406.393 4.112 20 0 HIADHN C[C@H](NC[C@H]1CSCCN1Cc1ccccc1)c1ccc(Br)cn1 ZINC000567986328 946439309 /nfs/dbraw/zinc/43/93/09/946439309.db2.gz RSYKNSNDZLJMMY-YJBOKZPZSA-N 0 3 406.393 4.112 20 0 HIADHN C[C@@H](NC[C@H]1CSCCN1Cc1ccccc1)c1ccc(Br)cn1 ZINC000567986327 946439917 /nfs/dbraw/zinc/43/99/17/946439917.db2.gz RSYKNSNDZLJMMY-QAPCUYQASA-N 0 3 406.393 4.112 20 0 HIADHN CN(C)CCn1nccc1NC(=O)c1cnc(Nc2ccc(Cl)cc2)c(Cl)c1 ZINC000568080750 946457275 /nfs/dbraw/zinc/45/72/75/946457275.db2.gz FXCRJIGLWUJHMI-UHFFFAOYSA-N 0 3 419.316 4.142 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccc(O)cc1)C(=O)c1cscc1Br ZINC000568119167 946467256 /nfs/dbraw/zinc/46/72/56/946467256.db2.gz JCFBAUOJDQGUPL-OAHLLOKOSA-N 0 3 423.376 4.343 20 0 HIADHN C/C(=C/c1ccccc1OC(F)F)CNCc1cc(F)ccc1N1CCOCC1 ZINC000568332551 946512616 /nfs/dbraw/zinc/51/26/16/946512616.db2.gz DIJJISZJPZPSFG-VBKFSLOCSA-N 0 3 406.448 4.457 20 0 HIADHN Cc1ccccc1NC(=O)[C@H](C)N[C@@H]1CCN(C(C)C)[C@@H]1c1ccc(F)c(F)c1 ZINC000568416828 946532921 /nfs/dbraw/zinc/53/29/21/946532921.db2.gz JOGLMNVUOPWTLB-KNXBSLHKSA-N 0 3 401.501 4.414 20 0 HIADHN CC(C)Cc1ccc([C@H](CNC(=O)c2ncsc2Br)N(C)C)cc1 ZINC000568431573 946541471 /nfs/dbraw/zinc/54/14/71/946541471.db2.gz ROSBTTLBKCQDDV-HNNXBMFYSA-N 0 3 410.381 4.137 20 0 HIADHN O[C@H](CNCc1ccccc1OCc1ccccc1)COc1cccc2[nH]ccc21 ZINC000568461411 946562894 /nfs/dbraw/zinc/56/28/94/946562894.db2.gz MEWQHUPZYREOFI-OAQYLSRUSA-N 0 3 402.494 4.276 20 0 HIADHN O=C(Nc1ccc(OCC(F)(F)F)c(F)c1)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000568486431 946570436 /nfs/dbraw/zinc/57/04/36/946570436.db2.gz PTQLFPJMDDVTNC-HNNXBMFYSA-N 0 3 411.399 4.013 20 0 HIADHN CS(=O)(=O)c1ccc(NC2CCN(CC3CCCC3)CC2)c(C(F)(F)F)c1 ZINC000568545517 946586103 /nfs/dbraw/zinc/58/61/03/946586103.db2.gz SFZBHDDVNDWDKZ-UHFFFAOYSA-N 0 3 404.498 4.175 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(F)c2ccccc21)C(=O)N1CCN(c2ccccc2O)CC1 ZINC000568690210 946658040 /nfs/dbraw/zinc/65/80/40/946658040.db2.gz ISIJZDYRBANPNH-ZWKOTPCHSA-N 0 3 421.516 4.072 20 0 HIADHN CN(C)CCN(C[C@@H]1CCCO1)C(=O)Nc1cccc(CCCc2ccccc2)c1 ZINC000568913893 946750687 /nfs/dbraw/zinc/75/06/87/946750687.db2.gz SAUNYXUAXMCPHY-DEOSSOPVSA-N 0 3 409.574 4.436 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)N[C@@H]2c3ccccc3CC23CCOCC3)CN1Cc1ccccc1 ZINC000569048684 946809040 /nfs/dbraw/zinc/80/90/40/946809040.db2.gz PRKIARVEKWTJKB-ZFJSRUIDSA-N 0 3 419.569 4.043 20 0 HIADHN Cc1cc(Br)cn2c(CN[C@H](c3ccccc3)C3(CO)CCC3)cnc12 ZINC000569131837 946820181 /nfs/dbraw/zinc/82/01/81/946820181.db2.gz DCNHQXLHUTZVPE-LJQANCHMSA-N 0 3 414.347 4.399 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)Nc2cccc(OCc3cccnc3)c2)CCN1Cc1ccccc1 ZINC000569261042 946842135 /nfs/dbraw/zinc/84/21/35/946842135.db2.gz OXVGXEQNLLGIPX-DVECYGJZSA-N 0 3 416.525 4.445 20 0 HIADHN CN(C)C[C@H](NC(=O)CCc1ncc(-c2ccc(F)cc2F)o1)c1ccc(F)cc1 ZINC000569282355 946848866 /nfs/dbraw/zinc/84/88/66/946848866.db2.gz VDXBHDIKWATEKE-IBGZPJMESA-N 0 3 417.431 4.111 20 0 HIADHN CSc1ccc([C@@H](CNC(=O)c2cnn(-c3ccccn3)c2C(C)C)N(C)C)cc1 ZINC000569285662 946849992 /nfs/dbraw/zinc/84/99/92/946849992.db2.gz WHSBUZXYOQTUHF-HXUWFJFHSA-N 0 3 423.586 4.145 20 0 HIADHN C[C@H](NC[C@]1(CO)C[C@H]1c1ccccc1)c1ccccc1I ZINC000569397066 946866752 /nfs/dbraw/zinc/86/67/52/946866752.db2.gz ZRVJPTVZUNAXNC-FNHZYXHNSA-N 0 3 407.295 4.108 20 0 HIADHN Brc1ccccc1-n1cc(CNCCCCOCc2ccccc2)nn1 ZINC000569746447 946973779 /nfs/dbraw/zinc/97/37/79/946973779.db2.gz OVAZNEVVGXRYMI-UHFFFAOYSA-N 0 3 415.335 4.116 20 0 HIADHN C[C@H](N[C@H]1c2ccccc2CC12CCOCC2)C(=O)Nc1ccc(OC(F)F)cc1 ZINC000569891240 947037126 /nfs/dbraw/zinc/03/71/26/947037126.db2.gz BSYYMXNTNQSEEQ-YWZLYKJASA-N 0 3 416.468 4.299 20 0 HIADHN C[C@H]1[C@@H](NC(=O)N(C)Cc2ccc(OC(F)F)cc2)CCN1Cc1ccccc1 ZINC000569999346 947066760 /nfs/dbraw/zinc/06/67/60/947066760.db2.gz NYYGCNSGAXFGLP-JXFKEZNVSA-N 0 3 403.473 4.092 20 0 HIADHN CCC(CC)(CN[C@H](c1nnc[nH]1)c1ccc(F)cc1)c1ccc(OC)c(OC)c1 ZINC000570053813 947079705 /nfs/dbraw/zinc/07/97/05/947079705.db2.gz FFDHDMMUGRBNMF-NRFANRHFSA-N 0 3 412.509 4.398 20 0 HIADHN O=C1NC2(CCCC2)C(=O)N1c1cccc(CN[C@@H](c2cccnc2)C2CCC2)c1 ZINC000570090118 947092176 /nfs/dbraw/zinc/09/21/76/947092176.db2.gz FEXXLRKBDGCUSF-OAQYLSRUSA-N 0 3 404.514 4.082 20 0 HIADHN Cc1nc(COc2ccc(Cl)cc2)sc1C(=O)N1CC[C@@H](N2CCCC2)[C@H]1C ZINC000570116330 947098487 /nfs/dbraw/zinc/09/84/87/947098487.db2.gz SAOOMWXDPOLIFC-CRAIPNDOSA-N 0 3 419.978 4.383 20 0 HIADHN CC(C)(C)C[C@@H](O)CC(=O)N(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000570234497 947156394 /nfs/dbraw/zinc/15/63/94/947156394.db2.gz XLTJPQJSPJUJNA-ZEQRLZLVSA-N 0 3 423.601 4.262 20 0 HIADHN CC(C)[C@@H](CNC(=O)CN[C@H]1c2ccccc2CC12CCOCC2)c1ccccc1 ZINC000570369783 947223874 /nfs/dbraw/zinc/22/38/74/947223874.db2.gz ZRNSBEKNSDNWIZ-NOZRDPDXSA-N 0 3 406.570 4.226 20 0 HIADHN Cc1ccc2[nH]c3c(c2c1)CCC[C@H]3NCc1ccccc1OCCN1CCOCC1 ZINC000570456953 947252846 /nfs/dbraw/zinc/25/28/46/947252846.db2.gz SLRPWFYYAXDQGT-XMMPIXPASA-N 0 3 419.569 4.355 20 0 HIADHN C[C@H](CNC(=O)c1nc2ccccc2cc1Br)N(C)Cc1ccccc1 ZINC000570480431 947261069 /nfs/dbraw/zinc/26/10/69/947261069.db2.gz QFCSRLRZRLAYHW-OAHLLOKOSA-N 0 3 412.331 4.248 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1nc(C)sc1Br)c1ccsc1 ZINC000570788628 947358017 /nfs/dbraw/zinc/35/80/17/947358017.db2.gz MOQPHKHSJZIPMG-LBPRGKRZSA-N 0 3 402.383 4.088 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)NCc2sccc2Br)C1 ZINC000570828439 947363422 /nfs/dbraw/zinc/36/34/22/947363422.db2.gz LSIBLPMHOCHYLQ-DZGCQCFKSA-N 0 3 408.365 4.145 20 0 HIADHN CC1(C)CN(c2nnc(C3CCCC3)n2C[C@H]2CCOC2)CCN1Cc1ccccc1 ZINC000571180625 947533267 /nfs/dbraw/zinc/53/32/67/947533267.db2.gz KNFNZHDGDQNYGB-OAQYLSRUSA-N 0 3 423.605 4.073 20 0 HIADHN CCOc1ccc(/C=C/c2nc(-c3ccc(N4CCCN(C)CC4)nc3)no2)cc1C ZINC000571205567 947545570 /nfs/dbraw/zinc/54/55/70/947545570.db2.gz WEWVTSHYHXYHMZ-YRNVUSSQSA-N 0 3 419.529 4.151 20 0 HIADHN Cc1ccc(C[C@H]2CCCN(CCCOc3ccc(S(C)(=O)=O)cc3)C2)cc1 ZINC000571312107 947590499 /nfs/dbraw/zinc/59/04/99/947590499.db2.gz MYTOBGROXVIOJV-OAQYLSRUSA-N 0 3 401.572 4.122 20 0 HIADHN C[C@H]1[C@@H](NC(=O)CCc2ncc(-c3ccccc3F)o2)CCN1Cc1ccccc1 ZINC000571314434 947590934 /nfs/dbraw/zinc/59/09/34/947590934.db2.gz JMYGZCFFVCELAW-UWJYYQICSA-N 0 3 407.489 4.193 20 0 HIADHN CN(C)C[C@H](NC(=O)Nc1cccc(C[S@@](=O)C(C)(C)C)c1)c1ccc(F)cc1 ZINC000571311542 947592168 /nfs/dbraw/zinc/59/21/68/947592168.db2.gz MVLQVIMMDPVRFP-AFJIDDCJSA-N 0 3 419.566 4.297 20 0 HIADHN CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)cc1)[C@@H]1C[C@H]1C ZINC000571356765 947617339 /nfs/dbraw/zinc/61/73/39/947617339.db2.gz UOAPKYIBDXXDJR-WSCWJOSJSA-N 0 3 423.532 4.438 20 0 HIADHN CN(CCCN(C)C(=O)c1cccc(Br)c1Cl)Cc1ccncc1 ZINC000571476739 947664396 /nfs/dbraw/zinc/66/43/96/947664396.db2.gz NGGORGBZGFPKDH-UHFFFAOYSA-N 0 3 410.743 4.092 20 0 HIADHN COc1ccc([C@H](C)N[C@@H](C)C(=O)N2CCC[C@@H]2c2cccs2)c(C)c1OC ZINC000571590993 947719655 /nfs/dbraw/zinc/71/96/55/947719655.db2.gz GJWXTRYJLDKNKR-XYJFISCASA-N 0 3 402.560 4.477 20 0 HIADHN O=C(N[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000571843436 947802505 /nfs/dbraw/zinc/80/25/05/947802505.db2.gz ZMBMXEIFKZHJED-FUHIMQAGSA-N 0 3 404.341 4.273 20 0 HIADHN CCOC(=O)c1ccn(-c2cccc(CNCc3cscc3C(F)(F)F)c2)n1 ZINC000571847009 947804513 /nfs/dbraw/zinc/80/45/13/947804513.db2.gz KVTCPMMDYFUSAJ-UHFFFAOYSA-N 0 3 409.433 4.419 20 0 HIADHN COc1cc(-c2ccccc2)sc1C(=O)N(C)CCCN(C)Cc1ccncc1 ZINC000572019784 947829459 /nfs/dbraw/zinc/82/94/59/947829459.db2.gz QKLKHIBOOLKCSN-UHFFFAOYSA-N 0 3 409.555 4.413 20 0 HIADHN Brc1cc(Br)cc(CN[C@H]2CCO[C@@H]2c2cccnc2)c1 ZINC000572157898 947852585 /nfs/dbraw/zinc/85/25/85/947852585.db2.gz PIBFZZPJXPGGCZ-JKSUJKDBSA-N 0 3 412.125 4.226 20 0 HIADHN CC1CCN([C@@H](CNC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)c2ccccc2)CC1 ZINC000572231217 947869251 /nfs/dbraw/zinc/86/92/51/947869251.db2.gz CMCFXAQPUJUALE-QFIPXVFZSA-N 0 3 409.530 4.462 20 0 HIADHN CN(C)C[C@@H](NC(=O)NCc1c(F)cccc1OC(F)F)c1ccc(Cl)cc1 ZINC000572305579 947879529 /nfs/dbraw/zinc/87/95/29/947879529.db2.gz SIMZPDBLTDNSKW-MRXNPFEDSA-N 0 3 415.843 4.183 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)CCc1cc(F)ccc1Br)c1ccco1 ZINC000572394096 947894146 /nfs/dbraw/zinc/89/41/46/947894146.db2.gz MHDAXVCNGMHTEH-SUMWQHHRSA-N 0 3 411.315 4.359 20 0 HIADHN C[C@H]1C[C@@H](NS(=O)(=O)Cc2ccc3ccccc3c2)CCN1Cc1ccccc1 ZINC000572528377 947931340 /nfs/dbraw/zinc/93/13/40/947931340.db2.gz OKMUWEYWVBGRHM-CYFREDJKSA-N 0 3 408.567 4.312 20 0 HIADHN CSc1ccc(CN(C)C(=O)CN[C@H]2c3ccccc3CC23CCOCC3)cc1 ZINC000572611589 947956624 /nfs/dbraw/zinc/95/66/24/947956624.db2.gz JAOFZABFEQYRIN-QHCPKHFHSA-N 0 3 410.583 4.051 20 0 HIADHN CCc1oc(CNC[C@H]2CCN(c3cccc(Br)c3)C2)cc1C(=O)OC ZINC000572620522 947957794 /nfs/dbraw/zinc/95/77/94/947957794.db2.gz LHPHGWYWIIXXSD-CQSZACIVSA-N 0 3 421.335 4.007 20 0 HIADHN Cn1nc(C(F)F)c2cc(C(=O)N(CCN3CCCCCC3)C3CCC3)sc21 ZINC000572873600 948026651 /nfs/dbraw/zinc/02/66/51/948026651.db2.gz XZNRBAGGTVKUGJ-UHFFFAOYSA-N 0 3 410.534 4.443 20 0 HIADHN CSc1ccc([C@H](CNC(=O)c2ccc(N3CCCC3)c(F)c2)N(C)C)cc1 ZINC000572876953 948026828 /nfs/dbraw/zinc/02/68/28/948026828.db2.gz FSIJWZGOSMTIQU-NRFANRHFSA-N 0 3 401.551 4.181 20 0 HIADHN CC(C)Cn1ncc(NC(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)c1C(F)F ZINC000572905177 948034641 /nfs/dbraw/zinc/03/46/41/948034641.db2.gz CIRYLFMRRQRYOV-WBVHZDCISA-N 0 3 405.493 4.434 20 0 HIADHN Cc1nc(NC(=O)[C@H](C)N[C@@H]2CCN(C(C)C)[C@H]2c2ccc(F)c(F)c2)sc1C ZINC000573011440 948057724 /nfs/dbraw/zinc/05/77/24/948057724.db2.gz YKULKCQGFCNELJ-BKTGTZMESA-N 0 3 422.545 4.179 20 0 HIADHN COc1sc(CNC2(c3ccc(F)cc3)CCOCC2)cc1Br ZINC000573033874 948065386 /nfs/dbraw/zinc/06/53/86/948065386.db2.gz ZVIVDCMSBAPSGI-UHFFFAOYSA-N 0 3 400.313 4.454 20 0 HIADHN CCOC(=O)c1cccc(OC[C@@H](O)CN[C@@H]2CCSc3ccc(Cl)cc32)c1 ZINC000573231220 948116001 /nfs/dbraw/zinc/11/60/01/948116001.db2.gz YVRUWSNXDOKIRU-QFBILLFUSA-N 0 3 421.946 4.083 20 0 HIADHN OC[C@]1(CNCc2cc(Cl)ccc2OC[C@@H]2CCCO2)C[C@@H]1c1ccccc1 ZINC000573254788 948125468 /nfs/dbraw/zinc/12/54/68/948125468.db2.gz XQTXDBNMQZHEAK-QZNHQXDQSA-N 0 3 401.934 4.154 20 0 HIADHN CCCN(CC)C[C@@H](C)N[C@H](c1ccc(C)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000573254726 948125895 /nfs/dbraw/zinc/12/58/95/948125895.db2.gz VEFFMWLDSNOLPN-AUSIDOKSSA-N 0 3 402.604 4.198 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@@H]2NC[C@@H](c2ccco2)N2CCCC2)cc1 ZINC000573289168 948146216 /nfs/dbraw/zinc/14/62/16/948146216.db2.gz SDQWDTLOOMKNHZ-QNWVGRARSA-N 0 3 416.587 4.100 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@@H](O)C2)c1)c1csc(-c2cccc(Cl)c2)n1 ZINC000573332218 948157615 /nfs/dbraw/zinc/15/76/15/948157615.db2.gz RWTDTOKDGZOAJO-GOSISDBHSA-N 0 3 413.930 4.282 20 0 HIADHN CSc1ccc([C@@H](CNC(=O)CCc2cccc(OC(C)(C)C)n2)N(C)C)cc1 ZINC000573358586 948165766 /nfs/dbraw/zinc/16/57/66/948165766.db2.gz LJCUMQYCZVMEON-HXUWFJFHSA-N 0 3 415.603 4.333 20 0 HIADHN COc1cc(CNCc2ccc(Cn3cnc4ccccc43)cc2)cc(OC)c1O ZINC000573366697 948168874 /nfs/dbraw/zinc/16/88/74/948168874.db2.gz SLBDREXQOLAWBP-UHFFFAOYSA-N 0 3 403.482 4.097 20 0 HIADHN Cn1cc(CNCCOc2ccc3cc(Br)ccc3c2)c(C(F)F)n1 ZINC000573381305 948174407 /nfs/dbraw/zinc/17/44/07/948174407.db2.gz IAMXMVSDVPHVFJ-UHFFFAOYSA-N 0 3 410.262 4.442 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)N(Cc2ccccc2)CC2CCOCC2)CCN1Cc1ccccc1 ZINC000573398846 948185428 /nfs/dbraw/zinc/18/54/28/948185428.db2.gz VJIDDSQLJQZDDG-BWKNWUBXSA-N 0 3 421.585 4.288 20 0 HIADHN C[C@H](NCc1cccc(I)c1)c1ccc(-n2cccn2)cc1 ZINC000573449602 948205175 /nfs/dbraw/zinc/20/51/75/948205175.db2.gz SFKBIFHUJXWRQK-AWEZNQCLSA-N 0 3 403.267 4.328 20 0 HIADHN Cc1cc(Br)c(C(=O)NCCCCN2C[C@H](C)O[C@@H](C)C2)cc1Cl ZINC000573705678 948276999 /nfs/dbraw/zinc/27/69/99/948276999.db2.gz GQBCSEQMDHQKKM-KBPBESRZSA-N 0 3 417.775 4.030 20 0 HIADHN Cc1nc(COc2cccc(C(=O)N[C@H]3CCN(Cc4ccccc4)[C@H]3C)c2)cs1 ZINC000573716076 948280516 /nfs/dbraw/zinc/28/05/16/948280516.db2.gz VDEULHUWXQEFOY-SBUREZEXSA-N 0 3 421.566 4.423 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)[C@@H]2C[C@H]2c2ccccc2OC(F)(F)F)cc1 ZINC000573737019 948285273 /nfs/dbraw/zinc/28/52/73/948285273.db2.gz XXZMAXHQECSWSL-OTWHNJEPSA-N 0 3 422.447 4.116 20 0 HIADHN C[C@@H](C(=O)N(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1)C(F)(F)F ZINC000573825051 948303035 /nfs/dbraw/zinc/30/30/35/948303035.db2.gz FWYCSVNXBGKWDR-PXNSSMCTSA-N 0 3 405.464 4.273 20 0 HIADHN C[C@H](C(=O)N(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1)C(F)(F)F ZINC000573825054 948303755 /nfs/dbraw/zinc/30/37/55/948303755.db2.gz FWYCSVNXBGKWDR-YLJYHZDGSA-N 0 3 405.464 4.273 20 0 HIADHN Cc1ccc(NC(=O)Cc2noc(C3(C)CCN(Cc4ccccc4)CC3)n2)cc1 ZINC000573956876 948334225 /nfs/dbraw/zinc/33/42/25/948334225.db2.gz JTPVHLZPEVSXBK-UHFFFAOYSA-N 0 3 404.514 4.113 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@H]2NCc2cn3ccc(Br)cc3n2)cc1 ZINC000573965222 948336157 /nfs/dbraw/zinc/33/61/57/948336157.db2.gz JUPCLBOPXMJLCB-QUCCMNQESA-N 0 3 400.320 4.415 20 0 HIADHN COc1cc(Cl)c(C)cc1NC(=O)[C@H](C)N(C)CCCN(C)Cc1ccco1 ZINC000574062138 948355281 /nfs/dbraw/zinc/35/52/81/948355281.db2.gz JMZFENBBCXZIAD-INIZCTEOSA-N 0 3 407.942 4.031 20 0 HIADHN COc1cc(Cl)c(C)cc1NC(=O)[C@@H](C)N(C)CCCN(C)Cc1ccco1 ZINC000574062139 948355615 /nfs/dbraw/zinc/35/56/15/948355615.db2.gz JMZFENBBCXZIAD-MRXNPFEDSA-N 0 3 407.942 4.031 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)N[C@H]1c2ccccc2CC12CCOCC2 ZINC000574093963 948363665 /nfs/dbraw/zinc/36/36/65/948363665.db2.gz UNBGLJZZMGYTCC-RPWUZVMVSA-N 0 3 419.569 4.217 20 0 HIADHN CN(C)C[C@H](NC(=O)c1ccc(C(=O)N(C)c2ccccc2)cc1)c1ccc(F)cc1 ZINC000574190465 948382912 /nfs/dbraw/zinc/38/29/12/948382912.db2.gz ZOIMFNVLFUBYQS-QHCPKHFHSA-N 0 3 419.500 4.135 20 0 HIADHN O=C(Nc1cc(F)c(F)cc1N1CCCCC1)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000574585666 948481711 /nfs/dbraw/zinc/48/17/11/948481711.db2.gz SIQYCTIHEXMKSB-GOSISDBHSA-N 0 3 414.500 4.201 20 0 HIADHN CC(C)Cc1ccc([C@@H](CNC(=O)Cc2ccc(NC(=O)C3CC3)cc2)N(C)C)cc1 ZINC000574711861 948508586 /nfs/dbraw/zinc/50/85/86/948508586.db2.gz CQMUKLPCUDZOIC-XMMPIXPASA-N 0 3 421.585 4.195 20 0 HIADHN CC(C)N1CC[C@H](NCC(=O)N[C@@H](C)c2cccs2)[C@@H]1c1ccc(F)c(F)c1 ZINC000574929187 948553661 /nfs/dbraw/zinc/55/36/61/948553661.db2.gz TZZZNPXOMNRVCT-XQAUZQBESA-N 0 3 407.530 4.017 20 0 HIADHN COC[C@]1(CNCc2c(C)nn(Cc3ccc(C)cc3)c2C)OCCc2ccccc21 ZINC000575030753 948578379 /nfs/dbraw/zinc/57/83/79/948578379.db2.gz VASQXQFHFFLKLG-SANMLTNESA-N 0 3 419.569 4.061 20 0 HIADHN COCC[C@H](Cc1cccc(Br)c1)C(=O)Nc1ccccc1CN(C)C ZINC000575223646 948636767 /nfs/dbraw/zinc/63/67/67/948636767.db2.gz BJENRZPRUJCUOP-QGZVFWFLSA-N 0 3 419.363 4.345 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)c1cn(C)nc1-c1ccccc1Cl)c1ccco1 ZINC000575351214 948650281 /nfs/dbraw/zinc/65/02/81/948650281.db2.gz JGJIIPMGOIWCEH-KSSFIOAISA-N 0 3 400.910 4.193 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)c1cn(C)nc1-c1ccccc1Cl)c1ccco1 ZINC000575351215 948651204 /nfs/dbraw/zinc/65/12/04/948651204.db2.gz JGJIIPMGOIWCEH-RDTXWAMCSA-N 0 3 400.910 4.193 20 0 HIADHN CC[C@H](N[C@@H]1CCCc2cc(S(N)(=O)=O)ccc21)c1ccccc1OC(F)F ZINC000575360087 948654431 /nfs/dbraw/zinc/65/44/31/948654431.db2.gz PTGVBIIUZAAYAL-ZWKOTPCHSA-N 0 3 410.486 4.054 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)Nc1c(F)cc(Br)cc1F ZINC000575515586 948674489 /nfs/dbraw/zinc/67/44/89/948674489.db2.gz HELQSIDOBYIHOR-GFCCVEGCSA-N 0 3 412.278 4.369 20 0 HIADHN CSc1ccc([C@H](CNC(=O)c2cc(C)nc3c2cnn3C(C)C)N(C)C)cc1 ZINC000575831630 948728092 /nfs/dbraw/zinc/72/80/92/948728092.db2.gz VCHPAGPSVGFJQD-FQEVSTJZSA-N 0 3 411.575 4.075 20 0 HIADHN CN(C(=O)C(C)(C)C)c1ccc(OC[C@H]2CN(Cc3ccccc3)CCCO2)cc1 ZINC000576031773 948813299 /nfs/dbraw/zinc/81/32/99/948813299.db2.gz NZKALQMLHZPXHK-HSZRJFAPSA-N 0 3 410.558 4.365 20 0 HIADHN CC(C)N(C)Cc1nn(C(F)(F)c2cc3ccccc3nc2Cl)c2c1CCNC2 ZINC001164681609 719628978 /nfs/dbraw/zinc/62/89/78/719628978.db2.gz IXWGUINPAGQNIO-UHFFFAOYSA-N 0 3 419.907 4.168 20 0 HIADHN Clc1ccc2c(Cl)nnc(N3CC[C@H]4[C@@H]3CCN4Cc3cccnc3)c2c1 ZINC001164726351 720464239 /nfs/dbraw/zinc/46/42/39/720464239.db2.gz BPVLVKLINWXSQZ-ROUUACIJSA-N 0 3 400.313 4.185 20 0 HIADHN c1cc2c(nc(-c3ccccn3)nc2N2CC[C@H]3[C@@H]2CCN3Cc2cccnc2)s1 ZINC001164730590 720467645 /nfs/dbraw/zinc/46/76/45/720467645.db2.gz UOZXMRXHPBMXME-PMACEKPBSA-N 0 3 414.538 4.002 20 0 HIADHN FC1(F)CCN(c2nc(Cl)nc3ccoc32)C[C@@]12CCN(Cc1ccccn1)C2 ZINC001164905505 721586960 /nfs/dbraw/zinc/58/69/60/721586960.db2.gz JPHSFOBLAGHINH-IBGZPJMESA-N 0 3 419.863 4.009 20 0 HIADHN FC1(F)CCN(c2nccc3ccsc32)C[C@@]12CCN(Cc1ccccn1)C2 ZINC001164904758 721696800 /nfs/dbraw/zinc/69/68/00/721696800.db2.gz GEARVOBTFXISOL-FQEVSTJZSA-N 0 3 400.498 4.429 20 0 HIADHN COc1cccc2c1ccnc2N1CCC(F)(F)[C@@]2(CCN(Cc3ccccn3)C2)C1 ZINC001164909872 721728583 /nfs/dbraw/zinc/72/85/83/721728583.db2.gz FARXVUVFXBJZED-HSZRJFAPSA-N 0 3 424.495 4.376 20 0 HIADHN c1ccc(-c2ccnc(N3CCC4(CC3)COCCN(Cc3ccncc3)C4)c2)cc1 ZINC001164959524 722054580 /nfs/dbraw/zinc/05/45/80/722054580.db2.gz MHXSNBGKCQCMPV-UHFFFAOYSA-N 0 3 414.553 4.263 20 0 HIADHN Cc1cc2ccccc2c(N2CCC3(CC2)COCCN(Cc2ccncc2)C3)n1 ZINC001164963389 722057897 /nfs/dbraw/zinc/05/78/97/722057897.db2.gz YDQZOXUDPGERPJ-UHFFFAOYSA-N 0 3 402.542 4.057 20 0 HIADHN Clc1ccc2ccc(N3CC[C@@H]4CN(Cc5cccnc5)CCO[C@H]4C3)nc2c1 ZINC001164976714 722129307 /nfs/dbraw/zinc/12/93/07/722129307.db2.gz MHVGSHAYOPMPOU-KNQAVFIVSA-N 0 3 408.933 4.011 20 0 HIADHN Cc1c(Cl)ccc2ccc(N3CC[C@H]4CN(Cc5cccnc5)CCO[C@H]4C3)nc21 ZINC001164984226 722134658 /nfs/dbraw/zinc/13/46/58/722134658.db2.gz WOPVHVZZFVZCDQ-UNMCSNQZSA-N 0 3 422.960 4.319 20 0 HIADHN CCOC(=O)/C=C\c1ccc(N2CCC[C@@]3(CCN3Cc3cccc(F)c3)C2)nc1 ZINC001164995368 722204246 /nfs/dbraw/zinc/20/42/46/722204246.db2.gz MQJSIIQPJHKBMM-NECUJFQYSA-N 0 3 409.505 4.042 20 0 HIADHN Cc1cc(N2CCC[C@@]3(CCN3Cc3cccc(F)c3)C2)nc(-c2ccncc2)n1 ZINC001164996240 722207100 /nfs/dbraw/zinc/20/71/00/722207100.db2.gz RZBIFFMYXOEZCV-XMMPIXPASA-N 0 3 403.505 4.231 20 0 HIADHN Fc1cccc(CN2CC[C@@]23CCCN(c2cc(-c4nc(C5CC5)no4)ccn2)C3)c1 ZINC001164998474 722212420 /nfs/dbraw/zinc/21/24/20/722212420.db2.gz VSKXFCFJNKEIDI-XMMPIXPASA-N 0 3 419.504 4.393 20 0 HIADHN CCCN(CCC)C(=O)c1ccc(NC(=O)N(CCN(C)C)C2CCCC2)cc1 ZINC000435996417 861278938 /nfs/dbraw/zinc/27/89/38/861278938.db2.gz PUYFXLUUGAIJRL-UHFFFAOYSA-N 0 3 402.583 4.287 20 0 HIADHN CCN1CCC[C@@H](NC(=O)N[C@H](CC(F)(F)F)c2ccc(C(F)(F)F)cc2)C1 ZINC000436034749 861327179 /nfs/dbraw/zinc/32/71/79/861327179.db2.gz OWZKFVNUALLRFF-HUUCEWRRSA-N 0 3 411.390 4.482 20 0 HIADHN CS[C@@H]1CN(C(=O)c2c(C)onc2-c2ccc(Cl)cc2Cl)C[C@@H]1N(C)C ZINC000436153235 861453363 /nfs/dbraw/zinc/45/33/63/861453363.db2.gz XIKRDOLYSSIXAX-LSDHHAIUSA-N 0 3 414.358 4.074 20 0 HIADHN CSc1c(F)cccc1C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000436161192 861461708 /nfs/dbraw/zinc/46/17/08/861461708.db2.gz BEKKIFQQVDKLHH-QGZVFWFLSA-N 0 3 410.518 4.443 20 0 HIADHN COc1cc(CNC(=O)CN[C@H](C)c2ccccc2)ccc1OCc1ccccc1 ZINC000007336294 845313242 /nfs/dbraw/zinc/31/32/42/845313242.db2.gz DNHFPZKWMLIPDU-LJQANCHMSA-N 0 3 404.510 4.241 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)CCc1nc2ccccc2s1)c1cccc(OC)c1 ZINC000010917456 845726595 /nfs/dbraw/zinc/72/65/95/845726595.db2.gz JVERXQSCDXOZND-FQEVSTJZSA-N 0 3 411.571 4.437 20 0 HIADHN CCOC(=O)c1sc2ncnc(NC[C@@H](c3ccco3)N3CCCCC3)c2c1C ZINC000015170600 846015466 /nfs/dbraw/zinc/01/54/66/846015466.db2.gz BSCRFEAADRILOB-HNNXBMFYSA-N 0 3 414.531 4.409 20 0 HIADHN CCc1ccc([C@@H](NCC(=O)NCC(=O)Nc2c(C)cc(C)cc2C)C(C)C)cc1 ZINC000015522601 846058604 /nfs/dbraw/zinc/05/86/04/846058604.db2.gz PAASZKPEQFBYBO-DEOSSOPVSA-N 0 3 409.574 4.216 20 0 HIADHN CCOc1ccccc1OCCCC(=O)Nc1ccc(N2CCN(CC)CC2)cc1 ZINC000018892151 846345457 /nfs/dbraw/zinc/34/54/57/846345457.db2.gz MUURXIQZASPHBE-UHFFFAOYSA-N 0 3 411.546 4.025 20 0 HIADHN COc1cc(NC(=O)CN[C@@H](Cc2ccccc2)c2ccccc2)cc(OC)c1OC ZINC000019538793 846367727 /nfs/dbraw/zinc/36/77/27/846367727.db2.gz ZXSAXFGGUUTYOH-NRFANRHFSA-N 0 3 420.509 4.225 20 0 HIADHN CCn1c(SCC(=O)C(C#N)c2nc(C)cs2)nnc1-c1cccc(Cl)c1 ZINC000020077374 846379935 /nfs/dbraw/zinc/37/99/35/846379935.db2.gz LVVCMPAUWYWMQH-AWEZNQCLSA-N 0 3 417.947 4.352 20 0 HIADHN COc1ccc([C@H](CNC(=O)CCc2ncc(-c3ccccc3)o2)N2CCCC2)cc1 ZINC000021298240 846427017 /nfs/dbraw/zinc/42/70/17/846427017.db2.gz JXNJDTLBVSCRGX-QFIPXVFZSA-N 0 3 419.525 4.236 20 0 HIADHN CCN(CC)[C@H](CNC(=O)COc1ccc(F)cc1Cl)c1cccc(OC)c1 ZINC000022700604 846606481 /nfs/dbraw/zinc/60/64/81/846606481.db2.gz YLJMMQUGSMYQRB-LJQANCHMSA-N 0 3 408.901 4.066 20 0 HIADHN Cc1ccc(NC(=O)[C@H](NCC(C)(C)N2C[C@@H](C)O[C@H](C)C2)c2ccccc2)cc1 ZINC000022735116 846611470 /nfs/dbraw/zinc/61/14/70/846611470.db2.gz OWCUSYNQGNAIGH-TXTKFYIRSA-N 0 3 409.574 4.152 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)c1ccc(OCc2cccnc2)cc1 ZINC000023114206 846660317 /nfs/dbraw/zinc/66/03/17/846660317.db2.gz ZKZODDWATUZOFY-DEOSSOPVSA-N 0 3 401.510 4.228 20 0 HIADHN O=c1[nH]c(CN2CCN(Cc3cccc4ccccc43)CC2)nc2ccc(Cl)cc21 ZINC000023301808 846683304 /nfs/dbraw/zinc/68/33/04/846683304.db2.gz MHPVYQXHCQLCOC-UHFFFAOYSA-N 0 3 418.928 4.048 20 0 HIADHN S=c1oc(-c2ccncc2)nn1CN1CCN(Cc2cccc3ccccc32)CC1 ZINC000023475246 846705200 /nfs/dbraw/zinc/70/52/00/846705200.db2.gz WQJVJLZOGNXINM-UHFFFAOYSA-N 0 3 417.538 4.196 20 0 HIADHN COc1ccc([C@@H](CNC(=O)Cc2ccc(C(F)(F)F)cc2)N2CCCC2)cc1 ZINC000023487761 846707275 /nfs/dbraw/zinc/70/72/75/846707275.db2.gz WGEQTQLPQAMOJK-HXUWFJFHSA-N 0 3 406.448 4.210 20 0 HIADHN COc1cc(C)ccc1OCC(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1 ZINC000023721821 846742878 /nfs/dbraw/zinc/74/28/78/846742878.db2.gz DFWUXICZVWTGHD-SFHVURJKSA-N 0 3 402.560 4.033 20 0 HIADHN C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000023737697 846744567 /nfs/dbraw/zinc/74/45/67/846744567.db2.gz LZKGZECADWEWJQ-CVDCTZTESA-N 0 3 421.585 4.056 20 0 HIADHN CCO[C@H]1C[C@](CO)(NCc2cccc(NC(=O)c3ccccc3Cl)c2)C1(C)C ZINC000436377593 861719289 /nfs/dbraw/zinc/71/92/89/861719289.db2.gz IGDDAYRNOOXRKS-NZQKXSOJSA-N 0 3 416.949 4.248 20 0 HIADHN CN(C)Cc1ccccc1NC(=O)c1nc(-c2cccs2)n(-c2cccc(F)c2)n1 ZINC000024809223 846870495 /nfs/dbraw/zinc/87/04/95/846870495.db2.gz UQHMCRZTFGBWIZ-UHFFFAOYSA-N 0 3 421.501 4.449 20 0 HIADHN Cc1cc(NC(=O)CCN2CCC(c3nc4cc(Cl)ccc4s3)CC2)no1 ZINC000025037266 846910303 /nfs/dbraw/zinc/91/03/03/846910303.db2.gz GFLFPUPVLINUSD-UHFFFAOYSA-N 0 3 404.923 4.454 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2CNCCNC(=O)c2ccco2)c(C)c1 ZINC000025053744 846912715 /nfs/dbraw/zinc/91/27/15/846912715.db2.gz BSLXLTUWWSXCIK-UHFFFAOYSA-N 0 3 414.509 4.269 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)[C@@H](C)Oc3cccc(Cl)c3)c(C)c2)CC1 ZINC000025187373 846939079 /nfs/dbraw/zinc/93/90/79/846939079.db2.gz MPFDHSBZYHOAPR-QGZVFWFLSA-N 0 3 401.938 4.196 20 0 HIADHN COc1cc(CNC[C@@H]2COc3ccccc3O2)ccc1OCc1ccc(F)cc1 ZINC000025261683 846949406 /nfs/dbraw/zinc/94/94/06/846949406.db2.gz HWTWCNFFIAWOFU-HXUWFJFHSA-N 0 3 409.457 4.343 20 0 HIADHN O=C(CCN1CCC[C@@H]1[C@H](O)C(F)(F)F)Nc1ccc(Oc2ccccc2)cc1 ZINC000436393711 861736954 /nfs/dbraw/zinc/73/69/54/861736954.db2.gz UZVCNQPTMGLJGG-QUCCMNQESA-N 0 3 408.420 4.195 20 0 HIADHN COc1ccc([C@@H]2CCCN2C[C@@H](O)COCc2ccccc2Cl)c(OC)c1 ZINC000025301241 846956878 /nfs/dbraw/zinc/95/68/78/846956878.db2.gz OAPRQRDSHVBIHL-UTKZUKDTSA-N 0 3 405.922 4.072 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@@H](C)N2CCC(Cc3ccccc3)CC2)cc1OC ZINC000025507734 846989139 /nfs/dbraw/zinc/98/91/39/846989139.db2.gz CLJWFMNDHZPOGV-LJQANCHMSA-N 0 3 410.558 4.005 20 0 HIADHN CC(C)[C@@H](CNC(=O)c1ccccc1Br)N1CCc2ccccc2C1 ZINC000025535830 846994606 /nfs/dbraw/zinc/99/46/06/846994606.db2.gz YZDFTRREYQQYHO-HXUWFJFHSA-N 0 3 401.348 4.262 20 0 HIADHN COc1ccc(C)cc1NC(=O)[C@@H](NCCc1ccc2c(c1)OCO2)c1ccccc1 ZINC000025697773 847021786 /nfs/dbraw/zinc/02/17/86/847021786.db2.gz SQPCMUMBCCPEIK-DEOSSOPVSA-N 0 3 418.493 4.244 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1oc2ccccc2c1COC)c1cccc(OC)c1 ZINC000025857556 847046926 /nfs/dbraw/zinc/04/69/26/847046926.db2.gz REQDTXMIBLESHL-OAQYLSRUSA-N 0 3 410.514 4.401 20 0 HIADHN CC(C)NC(=O)c1ccccc1NC(=O)CN[C@@H](Cc1ccccc1)c1ccccc1 ZINC000025945901 847061596 /nfs/dbraw/zinc/06/15/96/847061596.db2.gz BEOPYPOHJLAXIP-DEOSSOPVSA-N 0 3 415.537 4.337 20 0 HIADHN Cc1cc(C(=O)NCCCCN2CCN(c3cccc(C)c3)CC2)c(C)n1C1CC1 ZINC000026958771 847226523 /nfs/dbraw/zinc/22/65/23/847226523.db2.gz WLTXNJSMVGGCOA-UHFFFAOYSA-N 0 3 408.590 4.080 20 0 HIADHN C[C@@H](C(=O)Nc1ccc(OCc2ccccc2)cc1)N1CCN(C2CCCC2)CC1 ZINC000027118790 847250442 /nfs/dbraw/zinc/25/04/42/847250442.db2.gz MLQAYHOKDQFAIV-FQEVSTJZSA-N 0 3 407.558 4.153 20 0 HIADHN CCN(CC(=O)Nc1cc(C(F)(F)F)ccc1OCCOC)C1CCCCC1 ZINC000027286181 847279213 /nfs/dbraw/zinc/27/92/13/847279213.db2.gz BAHXLQTUAJRARU-UHFFFAOYSA-N 0 3 402.457 4.324 20 0 HIADHN CC1CCN([C@@H](CNC(=O)CCc2ccc3c(c2)OCCO3)c2cccs2)CC1 ZINC000027574840 847321387 /nfs/dbraw/zinc/32/13/87/847321387.db2.gz DQVKAOKYCBLNIF-IBGZPJMESA-N 0 3 414.571 4.041 20 0 HIADHN COc1cc(C(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)cc(OC)c1C ZINC000027573174 847321981 /nfs/dbraw/zinc/32/19/81/847321981.db2.gz USQMFSNBFJUBRS-GOSISDBHSA-N 0 3 402.560 4.277 20 0 HIADHN CC1CCN([C@H](CNC(=O)Cc2ccc(OC(F)F)cc2)c2cccs2)CC1 ZINC000027574114 847322078 /nfs/dbraw/zinc/32/20/78/847322078.db2.gz XUTHXOVZKPFLCJ-GOSISDBHSA-N 0 3 408.514 4.481 20 0 HIADHN CN(C)[C@@H](CNC(=O)Cc1csc(-c2ccccc2Cl)n1)Cc1ccccc1 ZINC000027584861 847323387 /nfs/dbraw/zinc/32/33/87/847323387.db2.gz SUTUPSZICNJLCI-GOSISDBHSA-N 0 3 413.974 4.295 20 0 HIADHN CN(C)[C@@H](CNC(=O)CCc1ncc(-c2ccc(Cl)cc2)o1)Cc1ccccc1 ZINC000027588585 847324983 /nfs/dbraw/zinc/32/49/83/847324983.db2.gz VQYIGPYHLUTJIB-HXUWFJFHSA-N 0 3 411.933 4.217 20 0 HIADHN Cc1ccc(NC(=O)NC(=O)[C@H](C)N[C@@H](C)c2ccc(NC(=O)C3CC3)cc2)c(C)c1 ZINC000028349110 847410414 /nfs/dbraw/zinc/41/04/14/847410414.db2.gz YSPZFXIDVBNZMT-IRXDYDNUSA-N 0 3 422.529 4.039 20 0 HIADHN O=C(NCCCCN1CCN(c2cccc(C(F)(F)F)c2)CC1)c1cccc(F)c1 ZINC000029166266 847518491 /nfs/dbraw/zinc/51/84/91/847518491.db2.gz IIRVECWRFXLXLS-UHFFFAOYSA-N 0 3 423.454 4.177 20 0 HIADHN CN(C)Cc1cccc(NC(=O)c2cn(Cc3ccccc3)nc2-c2cccnc2)c1 ZINC000029173725 847518863 /nfs/dbraw/zinc/51/88/63/847518863.db2.gz CMLNHZFKUJYEHN-UHFFFAOYSA-N 0 3 411.509 4.307 20 0 HIADHN C[C@H](Oc1ccc(Br)cc1)C(=O)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000029177981 847520274 /nfs/dbraw/zinc/52/02/74/847520274.db2.gz HDASUWDYWRVBGD-JXFKEZNVSA-N 0 3 417.347 4.170 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)c1cc2c([nH]c(=O)cc2C(F)(F)F)o1 ZINC000029179587 847522264 /nfs/dbraw/zinc/52/22/64/847522264.db2.gz KGRLGYQDBVGRPG-MRXNPFEDSA-N 0 3 419.403 4.119 20 0 HIADHN CC(C)[C@H](CNC(=O)c1ccc(NC(=O)[C@H]2C[C@@H]2C)cc1)N1CCc2ccccc2C1 ZINC000030637576 847749825 /nfs/dbraw/zinc/74/98/25/847749825.db2.gz PKGLEKJPUXYWIC-NWVWQQAFSA-N 0 3 419.569 4.094 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1ccc(NC(=O)[C@H]2C[C@@H]2C)cc1)c1cccc(OC)c1 ZINC000030680603 847758753 /nfs/dbraw/zinc/75/87/53/847758753.db2.gz GQICPRGVVDVYFQ-PDIWNELESA-N 0 3 423.557 4.103 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)c2c(C)nn(Cc3ccccc3)c2C)N(C)C)cc1 ZINC000030936940 847800614 /nfs/dbraw/zinc/80/06/14/847800614.db2.gz ZWBZEQIQMZARNX-HSZRJFAPSA-N 0 3 404.558 4.143 20 0 HIADHN Cc1cc(C)n(-c2ccc(C(=O)N3CCCN(Cc4ccccc4C)CC3)cc2)n1 ZINC000031766570 847946078 /nfs/dbraw/zinc/94/60/78/847946078.db2.gz UNJDWUBKXWOZTO-UHFFFAOYSA-N 0 3 402.542 4.146 20 0 HIADHN CC(C)(CNC(=O)CCCc1nnc(-c2ccccc2)o1)N1CCc2ccccc2C1 ZINC000032638308 848058739 /nfs/dbraw/zinc/05/87/39/848058739.db2.gz OEIRXVDMKKFYGG-UHFFFAOYSA-N 0 3 418.541 4.012 20 0 HIADHN C/C=C/c1ccc(OCC(=O)NC[C@H](c2cccs2)N2CCCC2)c(OC)c1 ZINC000032761371 848072273 /nfs/dbraw/zinc/07/22/73/848072273.db2.gz DSSXWDZKNFRIEA-NTSMAEHXSA-N 0 3 400.544 4.122 20 0 HIADHN O=C(Nc1ccc([O-])c(-c2nc3ccccc3s2)c1)[C@H]1CCC[N@@H+]1C1CCOCC1 ZINC000436605638 861866931 /nfs/dbraw/zinc/86/69/31/861866931.db2.gz PLXGTDYUEHFOMO-LJQANCHMSA-N 0 3 423.538 4.251 20 0 HIADHN O=C(Nc1ccc([O-])c(-c2nc3ccccc3s2)c1)[C@H]1CCC[N@H+]1C1CCOCC1 ZINC000436605638 861866934 /nfs/dbraw/zinc/86/69/34/861866934.db2.gz PLXGTDYUEHFOMO-LJQANCHMSA-N 0 3 423.538 4.251 20 0 HIADHN CN1CCN(CCCNC(=O)c2cc(F)c(Cl)cc2Cl)[C@@H](c2ccccc2)C1 ZINC000033135779 848112363 /nfs/dbraw/zinc/11/23/63/848112363.db2.gz DQIFQFHNMCHOHT-HXUWFJFHSA-N 0 3 424.347 4.241 20 0 HIADHN Cc1nn(-c2ccc(C(=O)N[C@H]3CCN(Cc4ccccc4)C3)cc2)c(C)c1Cl ZINC000036664186 848154129 /nfs/dbraw/zinc/15/41/29/848154129.db2.gz WQDMKIDTTZBGQD-FQEVSTJZSA-N 0 3 408.933 4.147 20 0 HIADHN C[C@H](Oc1ccc(-c2ccccc2)cc1)C(=O)C(C#N)c1nnc2n1CCCCC2 ZINC000041505708 848223753 /nfs/dbraw/zinc/22/37/53/848223753.db2.gz LJHSFMVJOJTELU-LAUBAEHRSA-N 0 3 400.482 4.315 20 0 HIADHN C[C@@H](NC(=O)c1ccccc1)C(=O)C(C#N)c1nc(-c2ccc(Cl)cc2)cs1 ZINC000041515044 848224938 /nfs/dbraw/zinc/22/49/38/848224938.db2.gz JEPPWZYELFRTHW-CXAGYDPISA-N 0 3 409.898 4.458 20 0 HIADHN CCOC(=O)N[C@@H](C(=O)C(C#N)c1nc(-c2ccc(Cl)cc2)cs1)C(C)C ZINC000041514018 848224990 /nfs/dbraw/zinc/22/49/90/848224990.db2.gz VRURLLFUSCAQOA-GOEBONIOSA-N 0 3 405.907 4.410 20 0 HIADHN C[C@@H](NC(=O)c1ccccc1)C(=O)C(C#N)c1nc(-c2ccc(Cl)cc2)cs1 ZINC000041515050 848225017 /nfs/dbraw/zinc/22/50/17/848225017.db2.gz JEPPWZYELFRTHW-DYVFJYSZSA-N 0 3 409.898 4.458 20 0 HIADHN Cc1noc(C)c1COc1ccc(CC(=O)C(C#N)c2nc3ccccc3o2)cc1 ZINC000041546700 848229670 /nfs/dbraw/zinc/22/96/70/848229670.db2.gz NSINPHHKOVZVON-GOSISDBHSA-N 0 3 401.422 4.431 20 0 HIADHN COc1cc(CN[C@H](C)c2ccc3c(c2)OCCO3)ccc1OCc1ccncc1 ZINC000042186456 848298498 /nfs/dbraw/zinc/29/84/98/848298498.db2.gz NHOGIGWTBYFORN-QGZVFWFLSA-N 0 3 406.482 4.291 20 0 HIADHN CNC(=O)c1ccc(CNCc2cn(-c3ccccc3)nc2-c2cccs2)cc1 ZINC000042225866 848304516 /nfs/dbraw/zinc/30/45/16/848304516.db2.gz LSNNCEJMIDXFFZ-UHFFFAOYSA-N 0 3 402.523 4.250 20 0 HIADHN COc1ccc(NC(C)=O)cc1NC(=O)[C@@H](C)N[C@@H](C)c1cccc2ccccc21 ZINC000042636679 848336033 /nfs/dbraw/zinc/33/60/33/848336033.db2.gz LKZUIUYDNBSIAC-JKSUJKDBSA-N 0 3 405.498 4.485 20 0 HIADHN O=C(c1ccccc1[O-])N1CCC([NH2+]CC(c2ccccc2)c2ccccc2)CC1 ZINC000436705312 861897898 /nfs/dbraw/zinc/89/78/98/861897898.db2.gz MMNZIHNIJRWEGH-UHFFFAOYSA-N 0 3 400.522 4.419 20 0 HIADHN CCN(Cc1ccc(OC)c(OC)c1)C(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000043231137 848396452 /nfs/dbraw/zinc/39/64/52/848396452.db2.gz RLIRGDMWHWHJBA-GOSISDBHSA-N 0 3 417.575 4.134 20 0 HIADHN CCN(CC)C(=O)c1cccc(NC(=O)NC[C@@H](c2ccccc2)N2CCCC2)c1 ZINC000043499217 848432221 /nfs/dbraw/zinc/43/22/21/848432221.db2.gz GAZSHLGIXRJWRO-QFIPXVFZSA-N 0 3 408.546 4.127 20 0 HIADHN CCNC(=O)c1cccc(NC(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)c1 ZINC000043680208 848449046 /nfs/dbraw/zinc/44/90/46/848449046.db2.gz XTVKHLJWSHBDMQ-LJQANCHMSA-N 0 3 414.575 4.093 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)Nc1ccc(NC(=O)c2ccco2)cc1 ZINC000043976653 848496448 /nfs/dbraw/zinc/49/64/48/848496448.db2.gz KDDVYGMRFRRTSD-UHFFFAOYSA-N 0 3 406.486 4.128 20 0 HIADHN CCN(CC)c1ccc(/C=[NH+]/C2CCN(C(=O)CCc3ccccc3)CC2)c([O-])c1 ZINC000044010733 848499425 /nfs/dbraw/zinc/49/94/25/848499425.db2.gz NSJKEIWOIXGFOF-LGUFXXKBSA-N 0 3 407.558 4.281 20 0 HIADHN NC(=O)C1CCN(Cc2cccc(NC(=S)Nc3ccc4ccccc4c3)c2)CC1 ZINC000044226280 848534336 /nfs/dbraw/zinc/53/43/36/848534336.db2.gz FZFSVBYTHVZWFA-UHFFFAOYSA-N 0 3 418.566 4.346 20 0 HIADHN CCc1ccc([C@H](CNC(=O)Nc2cccc(CN(CC)C(C)=O)c2)N(C)C)cc1 ZINC000044381053 848554324 /nfs/dbraw/zinc/55/43/24/848554324.db2.gz KAEFHVOYYARYQF-QHCPKHFHSA-N 0 3 410.562 4.042 20 0 HIADHN CCN(Cc1ccccc1NC(=O)NC[C@H](c1cccs1)N1CCCC1)C(C)=O ZINC000045686161 848713780 /nfs/dbraw/zinc/71/37/80/848713780.db2.gz QBJHYHRYBTXTDM-HXUWFJFHSA-N 0 3 414.575 4.075 20 0 HIADHN CC(C)(C)[C@H](CN1CCc2ccccc2C1)NC(=O)c1cccc(Cn2ccnc2)c1 ZINC000045817617 848734896 /nfs/dbraw/zinc/73/48/96/848734896.db2.gz DICDMZWDCJKESW-DEOSSOPVSA-N 0 3 416.569 4.134 20 0 HIADHN CC(C)c1ccc(CCC(=O)Nc2cccc(CN3CCC(C(N)=O)CC3)c2)cc1 ZINC000046345790 848829617 /nfs/dbraw/zinc/82/96/17/848829617.db2.gz XJEUBWSBVJKTFG-UHFFFAOYSA-N 0 3 407.558 4.079 20 0 HIADHN Cc1ccc(-c2csc3ncnc(NC[C@H](C(C)C)N4CCN(C)CC4)c23)cc1 ZINC000046551948 848872623 /nfs/dbraw/zinc/87/26/23/848872623.db2.gz OYAXJTLEUSNVQP-HXUWFJFHSA-N 0 3 409.603 4.351 20 0 HIADHN CC1CCN(CCNC(=O)c2ccc(Cl)c(NC(=O)c3cccs3)c2)CC1 ZINC000047119630 848987116 /nfs/dbraw/zinc/98/71/16/848987116.db2.gz KLAYEUDUUOFBRJ-UHFFFAOYSA-N 0 3 405.951 4.116 20 0 HIADHN C[C@@H](c1ccc(F)cc1)N1CCC(C(=O)Nc2ccc(Br)cn2)CC1 ZINC000047261941 849016629 /nfs/dbraw/zinc/01/66/29/849016629.db2.gz IFMIITZQTDATNT-ZDUSSCGKSA-N 0 3 406.299 4.395 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)c1[nH]c2ccccc2c1Br ZINC000047302234 849021616 /nfs/dbraw/zinc/02/16/16/849021616.db2.gz JUAFTURAHXGWFD-GOSISDBHSA-N 0 3 412.331 4.497 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)c(C)c1CC(=O)NCc1ccccc1CN(C)C ZINC000047572435 849075931 /nfs/dbraw/zinc/07/59/31/849075931.db2.gz IFGPGEXIWTTYAT-UHFFFAOYSA-N 0 3 410.949 4.063 20 0 HIADHN CCNC(=O)COc1ccc(CNCc2ccc(-c3ccccc3)s2)cc1OC ZINC000047726368 849099395 /nfs/dbraw/zinc/09/93/95/849099395.db2.gz HCYXMIOJFVJMSR-UHFFFAOYSA-N 0 3 410.539 4.228 20 0 HIADHN COc1cccc([C@@H](CNC(=O)Nc2cccc(OC(F)F)c2)N2CCCC2)c1 ZINC000047906760 849135095 /nfs/dbraw/zinc/13/50/95/849135095.db2.gz HIQNINANGGZQMN-LJQANCHMSA-N 0 3 405.445 4.255 20 0 HIADHN COc1ccc(OC(F)F)c(NC(=O)NC[C@H](c2cccs2)N2CCCC2)c1 ZINC000047921074 849138527 /nfs/dbraw/zinc/13/85/27/849138527.db2.gz DLQAAOLTZSFHMJ-OAHLLOKOSA-N 0 3 411.474 4.317 20 0 HIADHN COc1cc(C)c([C@@H](C)NC(=O)NC[C@@H](c2cccs2)N2CCCC2)cc1OC ZINC000047951691 849143824 /nfs/dbraw/zinc/14/38/24/849143824.db2.gz WUXKNNQSIWUOJI-AEFFLSMTSA-N 0 3 417.575 4.271 20 0 HIADHN O=C(NCc1cccc(COCc2ccco2)c1)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000047964824 849144830 /nfs/dbraw/zinc/14/48/30/849144830.db2.gz VAYZSGASPQXBOE-HSZRJFAPSA-N 0 3 419.525 4.070 20 0 HIADHN CCOC(=O)c1ccc(NC(=S)NC[C@H](c2cccs2)N2CCCC2)cc1 ZINC000048037457 849152163 /nfs/dbraw/zinc/15/21/63/849152163.db2.gz AJHUXEZXRCPVAP-QGZVFWFLSA-N 0 3 403.573 4.048 20 0 HIADHN Cc1ccccc1CN1CCCN(C(=O)Nc2ccc(N3CCCC3)c(F)c2)CC1 ZINC000048138916 849175593 /nfs/dbraw/zinc/17/55/93/849175593.db2.gz LKMAQVRJLDVYBZ-UHFFFAOYSA-N 0 3 410.537 4.474 20 0 HIADHN CN(C)Cc1ccccc1NC(=O)c1cccc(OCc2cn3ccccc3n2)c1 ZINC000048174057 849185736 /nfs/dbraw/zinc/18/57/36/849185736.db2.gz WYJLUNRANXSOGL-UHFFFAOYSA-N 0 3 400.482 4.227 20 0 HIADHN O=C(NC1CCN(Cc2ccccc2)CC1)c1ccc(Br)cc1Cl ZINC000048299148 849205019 /nfs/dbraw/zinc/20/50/19/849205019.db2.gz HGXCNQLXHUEMAA-UHFFFAOYSA-N 0 3 407.739 4.497 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)[C@H](C)Sc3ccc(OC)cc3)c(C)c2)CC1 ZINC000048359739 849210516 /nfs/dbraw/zinc/21/05/16/849210516.db2.gz ZITKBTSWHBTULY-SFHVURJKSA-N 0 3 413.587 4.265 20 0 HIADHN CCOc1ccc2cc(C(=O)Nc3ccc(N4CCN(CC)CC4)cc3C)[nH]c2c1 ZINC000048359731 849210846 /nfs/dbraw/zinc/21/08/46/849210846.db2.gz XVQYDFQNNQXMNJ-UHFFFAOYSA-N 0 3 406.530 4.269 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)CCC(=O)c3ccc(F)cc3F)c(C)c2)CC1 ZINC000048678168 849253977 /nfs/dbraw/zinc/25/39/77/849253977.db2.gz QJISQESOZQUKKM-UHFFFAOYSA-N 0 3 415.484 4.017 20 0 HIADHN Cc1nn(-c2ccc(F)cc2F)c(C)c1CNCc1ccc(Cn2ccnc2)cc1 ZINC000048711536 849257866 /nfs/dbraw/zinc/25/78/66/849257866.db2.gz MXOHVVZGJMNGTM-UHFFFAOYSA-N 0 3 407.468 4.302 20 0 HIADHN Brc1cccc(CNCc2cc(Br)c3c(c2)OCCO3)c1 ZINC000048817952 849271571 /nfs/dbraw/zinc/27/15/71/849271571.db2.gz GVHZELGNZBLLNQ-UHFFFAOYSA-N 0 3 413.109 4.273 20 0 HIADHN C[C@@H](SCC(=O)Nc1ccc(F)cc1)C(=O)C(C#N)c1nc2ccccc2s1 ZINC000048823182 849271830 /nfs/dbraw/zinc/27/18/30/849271830.db2.gz GSWYRTALEXPYOU-DOMZBBRYSA-N 0 3 413.499 4.372 20 0 HIADHN N#CC(C(=O)[C@@H]1CCCN(C(=O)Cc2ccc(F)cc2)C1)c1ccc2ccccc2n1 ZINC000048857312 849275702 /nfs/dbraw/zinc/27/57/02/849275702.db2.gz YSGUNVMHBKUEPG-TZIWHRDSSA-N 0 3 415.468 4.031 20 0 HIADHN C[C@H]([NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1)c1ccc(OC(F)(F)F)cc1 ZINC000436825309 862005071 /nfs/dbraw/zinc/00/50/71/862005071.db2.gz CVHQTBDGIBIUKI-AWEZNQCLSA-N 0 3 408.420 4.246 20 0 HIADHN O=C(c1ccccc1[O-])N1CCC([NH2+][C@H]2CCCc3ncc(C(F)(F)F)cc32)CC1 ZINC000436819319 862003440 /nfs/dbraw/zinc/00/34/40/862003440.db2.gz XXYJGCBMCZPWJB-IBGZPJMESA-N 0 3 419.447 4.078 20 0 HIADHN CC(C)(C)c1ccc(/C=C\C(=O)Nc2cccc(CN3CCC(C(N)=O)CC3)c2)cc1 ZINC000049770844 849328139 /nfs/dbraw/zinc/32/81/39/849328139.db2.gz ARTVNDLMIVJTJO-XFXZXTDPSA-N 0 3 419.569 4.333 20 0 HIADHN C#CCN1CCC(C(=O)NC[C@H](c2c[nH]c3ccccc32)c2ccccc2Cl)CC1 ZINC000050027428 849342880 /nfs/dbraw/zinc/34/28/80/849342880.db2.gz PUZLYALJLCURJQ-NRFANRHFSA-N 0 3 419.956 4.415 20 0 HIADHN COc1cc([C@H](C)[NH2+]C2CCN(C(=O)c3ccccc3[O-])CC2)ccc1SC ZINC000436833359 862011544 /nfs/dbraw/zinc/01/15/44/862011544.db2.gz YAUVKEZAGKKQDP-HNNXBMFYSA-N 0 3 400.544 4.078 20 0 HIADHN Cc1ccc2[nH]c3c(c2c1)CCC[C@H]3[NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1 ZINC000436834182 862013992 /nfs/dbraw/zinc/01/39/92/862013992.db2.gz OHNJRXMWELIMKA-JOCHJYFZSA-N 0 3 403.526 4.454 20 0 HIADHN CC(=O)N[C@H](C(=O)C(C#N)c1nc(-c2ccc(Cl)cc2)cs1)C1CCCC1 ZINC000051156262 849438060 /nfs/dbraw/zinc/43/80/60/849438060.db2.gz JNRWEYIRXLEHBH-AEFFLSMTSA-N 0 3 401.919 4.335 20 0 HIADHN N#CC(C(=O)CCN1c2ccccc2Sc2ccccc21)C(=O)NC1CCCC1 ZINC000051652332 849499273 /nfs/dbraw/zinc/49/92/73/849499273.db2.gz NIQQRUWLEYAKFL-KRWDZBQOSA-N 0 3 405.523 4.447 20 0 HIADHN COc1ccc([C@@H](CNC(=O)N[C@H](C)c2ccc(OC)c(F)c2)N2CCCC2)cc1 ZINC000052710649 849615664 /nfs/dbraw/zinc/61/56/64/849615664.db2.gz SENGZOLJMPSWRE-IIBYNOLFSA-N 0 3 415.509 4.040 20 0 HIADHN CCOC(=O)Nc1ccc2c(CN(CC)Cc3ccc(OC)cc3)cc(=O)oc2c1 ZINC000053087153 849663885 /nfs/dbraw/zinc/66/38/85/849663885.db2.gz UVOQLEJKRONKOU-UHFFFAOYSA-N 0 3 410.470 4.392 20 0 HIADHN CCOc1cc(C(=O)N(CCN(C)C)C2CCCC2)ccc1OCc1cccnc1 ZINC000053152978 849674032 /nfs/dbraw/zinc/67/40/32/849674032.db2.gz XXGJUDZBONNCMW-UHFFFAOYSA-N 0 3 411.546 4.006 20 0 HIADHN Cc1sc2ncnc(SCCC(=O)Nc3cccc(CN(C)C)c3)c2c1C ZINC000053477301 849718253 /nfs/dbraw/zinc/71/82/53/849718253.db2.gz ZVCVNMWZYGPZOP-UHFFFAOYSA-N 0 3 400.573 4.491 20 0 HIADHN Cc1ccc(C)n1-c1nc(CC(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)cs1 ZINC000054223056 849829077 /nfs/dbraw/zinc/82/90/77/849829077.db2.gz REBDFURLDGJARB-ICSRJNTNSA-N 0 3 408.571 4.045 20 0 HIADHN Cc1noc(C)c1COc1ccccc1C(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000054223956 849829300 /nfs/dbraw/zinc/82/93/00/849829300.db2.gz FDJVNFZUQXHJOL-RXVVDRJESA-N 0 3 419.525 4.436 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)Nc2nc(CN3CCCCC3)cs2)C1 ZINC000054382555 849855836 /nfs/dbraw/zinc/85/58/36/849855836.db2.gz LRZADKCORQDZEV-HKUYNNGSSA-N 0 3 413.591 4.086 20 0 HIADHN CCc1ccc(NC(=O)CNC2(c3ccc(Br)cc3)CCOCC2)cc1 ZINC000054394238 849859589 /nfs/dbraw/zinc/85/95/89/849859589.db2.gz URBCNFCMZPILJS-UHFFFAOYSA-N 0 3 417.347 4.246 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)CCc1ncc(-c2ccc(F)cc2F)o1 ZINC000054686292 849907953 /nfs/dbraw/zinc/90/79/53/849907953.db2.gz GFOVXMOMWCDRFP-UHFFFAOYSA-N 0 3 413.468 4.143 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NC1CCN(c2ccccc2)CC1)c1ccsc1 ZINC000054682671 849908672 /nfs/dbraw/zinc/90/86/72/849908672.db2.gz KPAIRLJNMFNADU-OAQYLSRUSA-N 0 3 400.592 4.099 20 0 HIADHN COc1cc(C)c([C@H](C)NC(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)cc1OC ZINC000054719484 849913020 /nfs/dbraw/zinc/91/30/20/849913020.db2.gz MFJCPZONALRBJZ-BJLQDIEVSA-N 0 3 411.546 4.208 20 0 HIADHN C[C@@H](N[C@H](CCc1ccccc1)c1ccccc1)C(=O)Nc1ccc(C(N)=O)cc1 ZINC000055153001 849978290 /nfs/dbraw/zinc/97/82/90/849978290.db2.gz GYTSNKYZESSZPT-WZONZLPQSA-N 0 3 401.510 4.076 20 0 HIADHN COc1ccc(CN2CCCN(Cc3ccc(OC(F)F)c(OC)c3)CC2)cc1 ZINC000055504544 850043749 /nfs/dbraw/zinc/04/37/49/850043749.db2.gz JLYWWNFKOYQBHR-UHFFFAOYSA-N 0 3 406.473 4.013 20 0 HIADHN Cc1nc(-c2cccc(NC(=O)CN3CCN(CCC(C)(C)C)CC3)c2)cs1 ZINC000055935524 850210493 /nfs/dbraw/zinc/21/04/93/850210493.db2.gz UGXXJIVBYWWMBV-UHFFFAOYSA-N 0 3 400.592 4.111 20 0 HIADHN CC(C)(C)CCN1CCN(CC(=O)N[C@H](c2cccs2)c2ccc(F)cc2)CC1 ZINC000055934944 850210620 /nfs/dbraw/zinc/21/06/20/850210620.db2.gz XINVZRGGOICZIN-QFIPXVFZSA-N 0 3 417.594 4.147 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)c2cnn(C(C)(C)C)c2C(F)(F)F)C1 ZINC000056168670 850268861 /nfs/dbraw/zinc/26/88/61/850268861.db2.gz BKPIMLAOHFIWOD-ZBFHGGJFSA-N 0 3 408.468 4.222 20 0 HIADHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)Nc1c(F)cccc1F ZINC000056525490 850384429 /nfs/dbraw/zinc/38/44/29/850384429.db2.gz PUGIKXJKUDNLOC-UHFFFAOYSA-N 0 3 412.278 4.323 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)Nc2ccccc2C(=O)N(CC)CC)N(C)C)cc1 ZINC000056554313 850392111 /nfs/dbraw/zinc/39/21/11/850392111.db2.gz CNFJCDKJMNFSSL-JOCHJYFZSA-N 0 3 410.562 4.155 20 0 HIADHN C#Cc1cccc(NC(=O)N(CCN(C)C)Cc2ccc(Br)cc2)c1 ZINC000056599034 850409047 /nfs/dbraw/zinc/40/90/47/850409047.db2.gz YPCPXDULUNJNFH-UHFFFAOYSA-N 0 3 400.320 4.026 20 0 HIADHN O=C(NCCN1CCCCC1)Nc1ccc(Cl)c(C(=O)NC2CCCCC2)c1 ZINC000056749245 850465592 /nfs/dbraw/zinc/46/55/92/850465592.db2.gz ZMQKUSOCMJKALT-UHFFFAOYSA-N 0 3 406.958 4.010 20 0 HIADHN Fc1ccccc1-c1nnc2ccc(NC3CCN(Cc4ccccc4)CC3)nn21 ZINC000057126685 850555677 /nfs/dbraw/zinc/55/56/77/850555677.db2.gz FMYKRLNZXYEXHF-UHFFFAOYSA-N 0 3 402.477 4.007 20 0 HIADHN COc1ccccc1OCc1ccc(C(=O)N2C[C@@H]3CCCN3Cc3ccccc32)o1 ZINC000057349155 850612192 /nfs/dbraw/zinc/61/21/92/850612192.db2.gz RPTWSWGVYYJELU-IBGZPJMESA-N 0 3 418.493 4.492 20 0 HIADHN CCCCOc1ccc(C(=O)N(C)CCC2CCN(c3cc[nH+]cc3)CC2)c([O-])c1 ZINC000436988418 862165278 /nfs/dbraw/zinc/16/52/78/862165278.db2.gz PDXANBFTQNIFKI-UHFFFAOYSA-N 0 3 411.546 4.345 20 0 HIADHN CCN1CCN(Cc2ccc(CNC(=O)CCCc3ccc(Cl)cc3)cc2)CC1 ZINC000058081881 850763459 /nfs/dbraw/zinc/76/34/59/850763459.db2.gz RIHABMHAKUSNGR-UHFFFAOYSA-N 0 3 413.993 4.117 20 0 HIADHN COc1ccc(OCCC(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)cc1 ZINC000058118311 850769241 /nfs/dbraw/zinc/76/92/41/850769241.db2.gz ULWYOXAXAHICMJ-HXUWFJFHSA-N 0 3 402.560 4.115 20 0 HIADHN CCN(Cc1ccccc1NC(=O)NCC(C)(C)N1CCc2ccccc2C1)C(C)=O ZINC000058154643 850775262 /nfs/dbraw/zinc/77/52/62/850775262.db2.gz TZKUIZIZUVXANK-UHFFFAOYSA-N 0 3 422.573 4.013 20 0 HIADHN Cc1cc(C)c(NC(=S)Nc2ccc3oc(=O)n(CCN(C)C)c3c2)c(Cl)c1 ZINC000058467828 850832615 /nfs/dbraw/zinc/83/26/15/850832615.db2.gz HRCWWISHVOLXKR-UHFFFAOYSA-N 0 3 418.950 4.235 20 0 HIADHN O=C(CCSc1ccc(F)cc1)NCCCCN1CCN(c2ccccc2)CC1 ZINC000058489968 850837739 /nfs/dbraw/zinc/83/77/39/850837739.db2.gz AUJCTHKOSXOZDZ-UHFFFAOYSA-N 0 3 415.578 4.027 20 0 HIADHN CC[C@@H](CNC(=O)CCCOc1cccc(C(C)=O)c1)N1CCc2ccccc2C1 ZINC000058677390 850886079 /nfs/dbraw/zinc/88/60/79/850886079.db2.gz XQNQXYRGPAGASK-QHCPKHFHSA-N 0 3 408.542 4.001 20 0 HIADHN CN(C)CCn1c2cc(NC(=O)c3cccc(Oc4ccccc4)c3)ccc2oc1=O ZINC000058739993 850908714 /nfs/dbraw/zinc/90/87/14/850908714.db2.gz QLGBPUPRWMSQPJ-UHFFFAOYSA-N 0 3 417.465 4.201 20 0 HIADHN CCN(CC)C(=O)c1ccc(NC(=O)NC[C@H](c2ccccc2)N2CCCC2)cc1 ZINC000058864116 850946754 /nfs/dbraw/zinc/94/67/54/850946754.db2.gz IHANDICYECMBJP-JOCHJYFZSA-N 0 3 408.546 4.127 20 0 HIADHN COc1ccccc1CN(CCCc1nc(-c2cccs2)no1)C[C@H]1CCCO1 ZINC000058919358 850957695 /nfs/dbraw/zinc/95/76/95/850957695.db2.gz BYNUKZMSNPNHHU-GOSISDBHSA-N 0 3 413.543 4.421 20 0 HIADHN CCOc1c(Cl)cc(C(=O)N(CCN(C)C)Cc2ccc(F)cc2)cc1OC ZINC000059001040 850977004 /nfs/dbraw/zinc/97/70/04/850977004.db2.gz MKCRZCCIWOPTEU-UHFFFAOYSA-N 0 3 408.901 4.090 20 0 HIADHN CN(C)CCn1c(=O)oc2ccc(NC(=O)c3cc4c(ccc5ccccc45)[nH]3)cc21 ZINC000059003563 850977724 /nfs/dbraw/zinc/97/77/24/850977724.db2.gz DDIPBDOXFADAER-UHFFFAOYSA-N 0 3 414.465 4.043 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)Nc1ccc(OCC(F)(F)F)nc1 ZINC000059037892 850982153 /nfs/dbraw/zinc/98/21/53/850982153.db2.gz ZJKJLTIMFGLHAB-AWEZNQCLSA-N 0 3 414.453 4.043 20 0 HIADHN O=C(Nc1ccccc1-n1ccnc1)c1cc(-c2ccc(Br)cc2)n[nH]1 ZINC000059404279 851004350 /nfs/dbraw/zinc/00/43/50/851004350.db2.gz NQMBPMYIBMJGDZ-UHFFFAOYSA-N 0 3 408.259 4.277 20 0 HIADHN Cc1cc(C)n(-c2ccc(C(=O)Nc3ccc(CCN4CCSCC4)cc3)cc2)n1 ZINC000060221214 851053433 /nfs/dbraw/zinc/05/34/33/851053433.db2.gz OXPNRQUGNJXLCM-UHFFFAOYSA-N 0 3 420.582 4.333 20 0 HIADHN COc1cc([C@H](C)NCC2=Cc3cc(Cl)cc(Cl)c3OC2)ccc1OCCO ZINC000060332797 851065755 /nfs/dbraw/zinc/06/57/55/851065755.db2.gz KYVHVEGBYFOZGR-ZDUSSCGKSA-N 0 3 424.324 4.500 20 0 HIADHN COc1cc(CCC(=O)N(CCN(C)C)c2ccccc2)ccc1OCC(F)(F)F ZINC000060338427 851068472 /nfs/dbraw/zinc/06/84/72/851068472.db2.gz RQFGFFTXSNIJPP-UHFFFAOYSA-N 0 3 424.463 4.164 20 0 HIADHN Cc1cc(NC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)ccc1N(C)C ZINC000060350680 851073075 /nfs/dbraw/zinc/07/30/75/851073075.db2.gz OFMFLTHLDLCQOS-OAQYLSRUSA-N 0 3 405.464 4.454 20 0 HIADHN COc1ccccc1C[C@@H]1CCCN1C(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000060532069 851135927 /nfs/dbraw/zinc/13/59/27/851135927.db2.gz LFPGADICZKIPHM-PMACEKPBSA-N 0 3 413.587 4.310 20 0 HIADHN COc1ccc(C(C)(C)CNC(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)cc1 ZINC000060576255 851153205 /nfs/dbraw/zinc/15/32/05/851153205.db2.gz KPGKGWXEEWSIEI-UHFFFAOYSA-N 0 3 419.516 4.024 20 0 HIADHN CN(C)[C@H](CNC(=O)N[C@@H]1CCCc2cc(OC(F)F)ccc21)c1ccccc1 ZINC000060602767 851164034 /nfs/dbraw/zinc/16/40/34/851164034.db2.gz OKUXCKFCLNWJQI-WOJBJXKFSA-N 0 3 403.473 4.268 20 0 HIADHN Cc1ccc(-n2ncc(C(=O)NCCN3CCCC[C@@H]3C)c2C2CC2)cc1Cl ZINC000060669566 851184080 /nfs/dbraw/zinc/18/40/80/851184080.db2.gz BEPMZOULTXVYFZ-INIZCTEOSA-N 0 3 400.954 4.316 20 0 HIADHN Cc1cccc(Oc2ccc(NC(=O)C(=O)N3CCCN(C(C)(C)C)CC3)cc2)c1 ZINC000060689896 851192181 /nfs/dbraw/zinc/19/21/81/851192181.db2.gz RUPYFGBQJQAERQ-UHFFFAOYSA-N 0 3 409.530 4.059 20 0 HIADHN CN(C[C@H]1CCN(Cc2ccccc2)C1)C(=O)CCC(=O)c1ccc2c(c1)CCC2 ZINC000437035498 862223272 /nfs/dbraw/zinc/22/32/72/862223272.db2.gz HJHUJISDJDZWQF-OAQYLSRUSA-N 0 3 404.554 4.119 20 0 HIADHN COc1ccc(CNCc2cn(-c3ccccc3)nc2-c2ccncc2)cc1OC ZINC000061003634 851269726 /nfs/dbraw/zinc/26/97/26/851269726.db2.gz NCBAZWAQCMGEAZ-UHFFFAOYSA-N 0 3 400.482 4.241 20 0 HIADHN Cc1nn(Cc2ccc(F)cc2)c(Cl)c1CNC[C@@H](c1cccs1)N(C)C ZINC000061013631 851273941 /nfs/dbraw/zinc/27/39/41/851273941.db2.gz IRDSIMLVWOLULS-SFHVURJKSA-N 0 3 406.958 4.486 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc(CNCc2ccc3cc(OC)ccc3c2)cc1 ZINC000061029504 851277799 /nfs/dbraw/zinc/27/77/99/851277799.db2.gz FGWGBCLGVITMMR-UHFFFAOYSA-N 0 3 412.555 4.169 20 0 HIADHN O=C(CC1CCN(Cc2ccc(C(=O)Nc3ccccc3)cc2)CC1)N1CCCC1 ZINC000061048962 851283146 /nfs/dbraw/zinc/28/31/46/851283146.db2.gz KTGJQJZXJPYIAD-UHFFFAOYSA-N 0 3 405.542 4.163 20 0 HIADHN COc1cc(CNCc2ccc(C#N)cc2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000061079196 851290611 /nfs/dbraw/zinc/29/06/11/851290611.db2.gz ZLTUWRGIMZUMPH-UHFFFAOYSA-N 0 3 403.438 4.344 20 0 HIADHN O=S(=O)(c1ccc(CNCc2ccc(-c3ccccc3)s2)cc1)N1CCCC1 ZINC000061108556 851294525 /nfs/dbraw/zinc/29/45/25/851294525.db2.gz QCJGBMUIFVBNKK-UHFFFAOYSA-N 0 3 412.580 4.489 20 0 HIADHN CCN(C(=O)c1ccc(N2CCN(C(C)C)CC2)cc1)[C@H](C)c1cccc(OC)c1 ZINC000061140155 851302651 /nfs/dbraw/zinc/30/26/51/851302651.db2.gz FPQWSTUUFDXHLH-HXUWFJFHSA-N 0 3 409.574 4.449 20 0 HIADHN CC(C)OCc1ccccc1CNC(=O)c1ccc(N2CCN(C(C)C)CC2)cc1 ZINC000061138456 851303043 /nfs/dbraw/zinc/30/30/43/851303043.db2.gz ZDWCEFGEMYDYBE-UHFFFAOYSA-N 0 3 409.574 4.072 20 0 HIADHN CCOC(=O)Nc1ccc(NC(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)cc1 ZINC000061161162 851307828 /nfs/dbraw/zinc/30/78/28/851307828.db2.gz FNEACSSDOZSWBX-UHFFFAOYSA-N 0 3 410.518 4.038 20 0 HIADHN O=C(NCc1ccc(N2CCCCCC2)nc1)NC[C@H](c1ccccc1)N1CCCC1 ZINC000061229838 851322911 /nfs/dbraw/zinc/32/29/11/851322911.db2.gz LKPSRVDAWDQMPI-HSZRJFAPSA-N 0 3 421.589 4.098 20 0 HIADHN CCN(CC1CCN(c2ccccn2)CC1)C(=O)c1cccc(CN2CCCC2)c1 ZINC000437040143 862231841 /nfs/dbraw/zinc/23/18/41/862231841.db2.gz CLJFFVMXGISZLN-UHFFFAOYSA-N 0 3 406.574 4.056 20 0 HIADHN Cc1c(C(=O)Nc2ccc(CCN3CCSCC3)cc2)cnn1-c1ccccc1C ZINC000061288027 851339388 /nfs/dbraw/zinc/33/93/88/851339388.db2.gz SSYWCVXVVOZLFV-UHFFFAOYSA-N 0 3 420.582 4.333 20 0 HIADHN Cc1ccc([C@H](CNC(=O)CSc2ccc(C(F)(F)F)cn2)N2CCCC2)cc1 ZINC000061503205 851391222 /nfs/dbraw/zinc/39/12/22/851391222.db2.gz ZHNYXELJCLULOE-SFHVURJKSA-N 0 3 423.504 4.454 20 0 HIADHN Cc1c(C(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)cnn1-c1ccc(F)cc1 ZINC000061502872 851391247 /nfs/dbraw/zinc/39/12/47/851391247.db2.gz LPKLENCNPWWPSN-HSZRJFAPSA-N 0 3 406.505 4.195 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2ccccc2NC(=O)NC(C)C)N2CCCC2)cc1 ZINC000061503074 851391258 /nfs/dbraw/zinc/39/12/58/851391258.db2.gz AOBZKGVWWCTWMF-JOCHJYFZSA-N 0 3 408.546 4.092 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)N2CCCC2)cc1 ZINC000061503131 851391362 /nfs/dbraw/zinc/39/13/62/851391362.db2.gz LXVTZLGHXDFVMA-HSZRJFAPSA-N 0 3 422.529 4.070 20 0 HIADHN CCc1oc2ccccc2c1CNCc1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000061743463 851436099 /nfs/dbraw/zinc/43/60/99/851436099.db2.gz JEDBPGFJRXZGPX-UHFFFAOYSA-N 0 3 412.555 4.460 20 0 HIADHN CN(C)Cc1cccc(NC(=O)C(=O)N[C@@H](c2ccccc2)c2ccc(Cl)cc2)c1 ZINC000061912786 851472367 /nfs/dbraw/zinc/47/23/67/851472367.db2.gz UFKMIXPNZLUFFG-QFIPXVFZSA-N 0 3 421.928 4.246 20 0 HIADHN COc1cc(CN[C@@H]2CCc3cc(Cl)ccc32)ccc1OCC(=O)N1CCCC1 ZINC000062257600 851518901 /nfs/dbraw/zinc/51/89/01/851518901.db2.gz XCRMGRVZYPZFIY-HXUWFJFHSA-N 0 3 414.933 4.127 20 0 HIADHN CC(C)OCCOCc1cccc(NC(=O)N2CCN(CC3CCCCC3)CC2)c1 ZINC000062416071 851547348 /nfs/dbraw/zinc/54/73/48/851547348.db2.gz BOOYACGYOHCZJO-UHFFFAOYSA-N 0 3 417.594 4.358 20 0 HIADHN CC[C@@H](NC(=O)N(CCN(C)C)Cc1ccc(F)c(F)c1)c1ccccc1OC ZINC000062486228 851563166 /nfs/dbraw/zinc/56/31/66/851563166.db2.gz HDCYKOUZGHBZLM-HXUWFJFHSA-N 0 3 405.489 4.198 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)N[C@@H]1CCCOc2ccc(F)cc21 ZINC000062500177 851566199 /nfs/dbraw/zinc/56/61/99/851566199.db2.gz YBRWLTIKESCMLH-HXUWFJFHSA-N 0 3 421.463 4.091 20 0 HIADHN CC(C)COc1ccccc1CNC(=O)N(CCN(C)C)Cc1ccc(F)cc1 ZINC000062647463 851585194 /nfs/dbraw/zinc/58/51/94/851585194.db2.gz OOAMUURKQDYUJF-UHFFFAOYSA-N 0 3 401.526 4.134 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N[C@H](C)c2ccc(Br)cc2)N(C)C)cc1 ZINC000063069905 851609831 /nfs/dbraw/zinc/60/98/31/851609831.db2.gz ZUUAZXZYSHANMD-BEFAXECRSA-N 0 3 404.352 4.421 20 0 HIADHN FC(F)(F)c1ccccc1NNC(=S)NC1CCN(Cc2ccccc2)CC1 ZINC000063142520 851619637 /nfs/dbraw/zinc/61/96/37/851619637.db2.gz LZNMVXIRMNYKLA-UHFFFAOYSA-N 0 3 408.493 4.161 20 0 HIADHN S=C(NNc1ccc(Cl)cc1Cl)NC1CCN(Cc2ccccc2)CC1 ZINC000063143683 851620343 /nfs/dbraw/zinc/62/03/43/851620343.db2.gz KJFKURTUERENOC-UHFFFAOYSA-N 0 3 409.386 4.449 20 0 HIADHN CCCOc1ccc(CN(CCC)C(=S)NC2CCN(C)CC2)cc1OCC ZINC000063144129 851620469 /nfs/dbraw/zinc/62/04/69/851620469.db2.gz BNOCHNJBWLQVMZ-UHFFFAOYSA-N 0 3 407.624 4.055 20 0 HIADHN S=C(NCCCn1ccc2ccccc21)NC1CCN(Cc2ccccc2)CC1 ZINC000063144407 851620545 /nfs/dbraw/zinc/62/05/45/851620545.db2.gz SSYFTBJZTNSEKH-UHFFFAOYSA-N 0 3 406.599 4.160 20 0 HIADHN CC(C)(C)NC(=O)c1ccc(NC(=S)NC2CCN(Cc3ccccc3)CC2)cc1 ZINC000063147060 851621328 /nfs/dbraw/zinc/62/13/28/851621328.db2.gz XKDBGJQGUJVMKB-UHFFFAOYSA-N 0 3 424.614 4.166 20 0 HIADHN S=C(NCc1ccnc(OC2CCCC2)c1)NC1CCN(Cc2ccccc2)CC1 ZINC000063148498 851621915 /nfs/dbraw/zinc/62/19/15/851621915.db2.gz CXCYZJSAUWJTGG-UHFFFAOYSA-N 0 3 424.614 4.032 20 0 HIADHN CN1CCC(NC(=S)N(Cc2ccsc2)c2ccc(Br)cc2)CC1 ZINC000063149931 851623210 /nfs/dbraw/zinc/62/32/10/851623210.db2.gz AFGQLXNHXMWMEL-UHFFFAOYSA-N 0 3 424.433 4.486 20 0 HIADHN N#CCCCOc1cccc(NC(=S)NC2CCN(Cc3ccccc3)CC2)c1 ZINC000063149821 851623514 /nfs/dbraw/zinc/62/35/14/851623514.db2.gz KJRQLHGVAJDRRL-UHFFFAOYSA-N 0 3 408.571 4.320 20 0 HIADHN Cc1cccc(C)c1OC[C@H](C)NC(=S)NC1CCN(Cc2ccccc2)CC1 ZINC000063172985 851626350 /nfs/dbraw/zinc/62/63/50/851626350.db2.gz MGHWLXOZIQPSQI-FQEVSTJZSA-N 0 3 411.615 4.199 20 0 HIADHN CCOC(=O)c1c(C)c(C)sc1NC(=O)C[C@H](C)N[C@@H](C)c1ccncc1OC ZINC000437082898 862276335 /nfs/dbraw/zinc/27/63/35/862276335.db2.gz MSKNXGBRBPZUEV-JSGCOSHPSA-N 0 3 419.547 4.013 20 0 HIADHN Cc1ccc([C@@H]2CCCN2C(=O)NCc2ccc(CN3CCN(C)CC3)cc2)cc1C ZINC000063615754 851725197 /nfs/dbraw/zinc/72/51/97/851725197.db2.gz JWXBATPAMHNTGM-VWLOTQADSA-N 0 3 420.601 4.098 20 0 HIADHN O=C1COc2ccc(-c3csc(NC4CCN(Cc5ccccc5)CC4)n3)cc2N1 ZINC000063630553 851729761 /nfs/dbraw/zinc/72/97/61/851729761.db2.gz CLCAUQHZMMKIBX-UHFFFAOYSA-N 0 3 420.538 4.218 20 0 HIADHN CCOC(=O)c1c(C)c(C)sc1NC(=O)C[C@@H](C)N[C@H](C)c1ccncc1OC ZINC000437082900 862277407 /nfs/dbraw/zinc/27/74/07/862277407.db2.gz MSKNXGBRBPZUEV-TZMCWYRMSA-N 0 3 419.547 4.013 20 0 HIADHN O=C([C@@H]1CCCN1Cc1ccccc1)N1CCCN(Cc2ccc(Cl)cc2)CC1 ZINC000063686207 851741031 /nfs/dbraw/zinc/74/10/31/851741031.db2.gz GKLYMKVQYUDWMP-QHCPKHFHSA-N 0 3 411.977 4.039 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)c1csc(-c2ccccc2F)n1 ZINC000063826953 851773371 /nfs/dbraw/zinc/77/33/71/851773371.db2.gz OREAQLNBKCBSES-UHFFFAOYSA-N 0 3 401.482 4.292 20 0 HIADHN Cc1nn(C)c2nc(-c3ccccc3)cc(C(=O)N(CCN(C)C)c3ccccc3)c12 ZINC000063853406 851778260 /nfs/dbraw/zinc/77/82/60/851778260.db2.gz WEVLXTTUTXPHJR-UHFFFAOYSA-N 0 3 413.525 4.152 20 0 HIADHN CCOc1cc2c(cc1OCC)CN(C(=O)c1cccc(CN3CCCC3)c1)CC2 ZINC000063913883 851792345 /nfs/dbraw/zinc/79/23/45/851792345.db2.gz NFPBLNODWFOYQB-UHFFFAOYSA-N 0 3 408.542 4.278 20 0 HIADHN O=C(CN1CCN(CC2CCCCC2)CC1)N[C@H](c1cccs1)c1ccccc1 ZINC000064129624 851832649 /nfs/dbraw/zinc/83/26/49/851832649.db2.gz FNYDKSXPKHYORK-DEOSSOPVSA-N 0 3 411.615 4.152 20 0 HIADHN CC(C)N(Cc1ccccn1)C[C@@H](O)COc1ccc(Cl)cc1Br ZINC000064142612 851834355 /nfs/dbraw/zinc/83/43/55/851834355.db2.gz LGNITVRZLWZTSN-MRXNPFEDSA-N 0 3 413.743 4.148 20 0 HIADHN CC[N@H+](C)Cc1cccc(CNC(=O)NN=c2[n-]c(Cl)c(Cl)cc2Cl)c1 ZINC000064229815 851852924 /nfs/dbraw/zinc/85/29/24/851852924.db2.gz LEZPYRUNTMMVCR-UHFFFAOYSA-N 0 3 416.740 4.320 20 0 HIADHN CC[N@@H+](C)Cc1cccc(CNC(=O)NN=c2[n-]c(Cl)c(Cl)cc2Cl)c1 ZINC000064229815 851852925 /nfs/dbraw/zinc/85/29/25/851852925.db2.gz LEZPYRUNTMMVCR-UHFFFAOYSA-N 0 3 416.740 4.320 20 0 HIADHN COc1ccc(CCCN(C)C(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)cc1 ZINC000064237011 851855413 /nfs/dbraw/zinc/85/54/13/851855413.db2.gz ZEBOCZOSSLPIEY-DEOSSOPVSA-N 0 3 409.574 4.415 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)NCc1ccc(N(C)C)cc1 ZINC000064412273 851891438 /nfs/dbraw/zinc/89/14/38/851891438.db2.gz ACQRQBWBVPFMQO-UHFFFAOYSA-N 0 3 422.495 4.045 20 0 HIADHN COc1ccc(-c2cncc(C(=O)NC3CCN(Cc4ccccc4)CC3)c2)cc1 ZINC000064568291 851933069 /nfs/dbraw/zinc/93/30/69/851933069.db2.gz CJNMITFCDRUWSL-UHFFFAOYSA-N 0 3 401.510 4.152 20 0 HIADHN CCOc1ccccc1CNC(=O)N(CCN(C)C)Cc1ccc(C(F)(F)F)cc1 ZINC000064758949 851978772 /nfs/dbraw/zinc/97/87/72/851978772.db2.gz NOZVYBMQRSBECX-UHFFFAOYSA-N 0 3 423.479 4.378 20 0 HIADHN O=C(CN(C1CC1)C1CCCC1)N(Cc1cccs1)c1ccc2c(c1)OCCO2 ZINC000064808584 851989655 /nfs/dbraw/zinc/98/96/55/851989655.db2.gz FZPJJYZOHSJLBO-UHFFFAOYSA-N 0 3 412.555 4.460 20 0 HIADHN CC(C)Sc1ccccc1C(=O)NCCCN1CCN(C)C[C@@H]1c1ccccc1 ZINC000064861211 852007916 /nfs/dbraw/zinc/00/79/16/852007916.db2.gz AVORWIRQOYGLIP-JOCHJYFZSA-N 0 3 411.615 4.296 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=S)Nc3ccc4c(c3)CCC4)CC2)c1 ZINC000064892631 852012875 /nfs/dbraw/zinc/01/28/75/852012875.db2.gz ASUWSWDBHPQREG-UHFFFAOYSA-N 0 3 422.642 4.373 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)c2ccc(F)cc2NC(=O)c2ccoc2)C1 ZINC000065141108 852076217 /nfs/dbraw/zinc/07/62/17/852076217.db2.gz IIXPXSFONNHNTE-OXQOHEQNSA-N 0 3 421.472 4.236 20 0 HIADHN COc1cc(OC)cc(Oc2ccc(CNCc3cccnc3-n3cccn3)cc2)c1 ZINC000065428842 852129447 /nfs/dbraw/zinc/12/94/47/852129447.db2.gz BJRHORRZLJOGIB-UHFFFAOYSA-N 0 3 416.481 4.367 20 0 HIADHN CN(CCNC(=O)Nc1cccc(C(=O)Nc2cccc(F)c2)c1)Cc1ccccc1 ZINC000065450459 852138620 /nfs/dbraw/zinc/13/86/20/852138620.db2.gz YDFQEKUMVGIHLC-UHFFFAOYSA-N 0 3 420.488 4.332 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N(C)Cc2csc(Br)c2)N(C)C)cc1 ZINC000065467955 852144952 /nfs/dbraw/zinc/14/49/52/852144952.db2.gz WWTHLWINQQUQDM-INIZCTEOSA-N 0 3 410.381 4.263 20 0 HIADHN Cc1nn(-c2ccccc2)cc1CCCNC(=O)NC[C@@H](c1ccc(C)cc1)N(C)C ZINC000065467656 852145373 /nfs/dbraw/zinc/14/53/73/852145373.db2.gz FIMBWHSGWMTZIJ-DEOSSOPVSA-N 0 3 419.573 4.024 20 0 HIADHN CCOC(=O)N(C)c1ccc(NC(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)cc1 ZINC000065472671 852147384 /nfs/dbraw/zinc/14/73/84/852147384.db2.gz FILDVGMLTWFWNY-YLJYHZDGSA-N 0 3 410.518 4.236 20 0 HIADHN COc1cccc(CN2CCC(NC(=O)CCOc3ccc(F)cc3Cl)CC2)c1 ZINC000065506652 852161048 /nfs/dbraw/zinc/16/10/48/852161048.db2.gz CKOGWERCHNVBMO-UHFFFAOYSA-N 0 3 420.912 4.037 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)N(C)Cc2ccc(Br)s2)C1 ZINC000065521458 852166342 /nfs/dbraw/zinc/16/63/42/852166342.db2.gz HDXCTBDGIKKAPC-HOCLYGCPSA-N 0 3 422.392 4.488 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)NCc2csc(Br)c2)C1 ZINC000065522762 852166955 /nfs/dbraw/zinc/16/69/55/852166955.db2.gz SMUAPZTWXOQJHR-BBRMVZONSA-N 0 3 408.365 4.145 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)c(OC)c1 ZINC000065521762 852167051 /nfs/dbraw/zinc/16/70/51/852167051.db2.gz JREJMJALMITETG-LEDOBFOHSA-N 0 3 423.557 4.386 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)N(C)Cc2ccc(Br)cc2)C1 ZINC000065522160 852167286 /nfs/dbraw/zinc/16/72/86/852167286.db2.gz NUCSCSQIVWTNCU-JXFKEZNVSA-N 0 3 416.363 4.426 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)NCc2ccc(Br)s2)C1 ZINC000065522949 852168455 /nfs/dbraw/zinc/16/84/55/852168455.db2.gz NFKJMJRCILTBLL-ZFWWWQNUSA-N 0 3 408.365 4.145 20 0 HIADHN CN1CCN(CCCNC(=O)c2ccccc2Oc2ccc(Cl)cc2Cl)CC1 ZINC000065538247 852170574 /nfs/dbraw/zinc/17/05/74/852170574.db2.gz GQYDNZQKVVAVIW-UHFFFAOYSA-N 0 3 422.356 4.153 20 0 HIADHN CC(C)CC(=O)Nc1ccc(NC(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)cc1 ZINC000065737537 852239876 /nfs/dbraw/zinc/23/98/76/852239876.db2.gz HAHQTJRPRAQHAZ-UHFFFAOYSA-N 0 3 422.573 4.454 20 0 HIADHN CCN(Cc1cccc(NC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)c1)C(C)=O ZINC000065866573 852291661 /nfs/dbraw/zinc/29/16/61/852291661.db2.gz RCRHAUBMXVDTFE-NRFANRHFSA-N 0 3 411.521 4.045 20 0 HIADHN Cc1nc(C2(NC(=O)[C@H]3CCCN(Cc4cccc(F)c4)C3)CCCCCC2)no1 ZINC000065876527 852298167 /nfs/dbraw/zinc/29/81/67/852298167.db2.gz FAWWRYGMQNHKFT-IBGZPJMESA-N 0 3 414.525 4.095 20 0 HIADHN O=C(N[C@@H]1CCCOc2ccc(F)cc21)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000065882147 852300779 /nfs/dbraw/zinc/30/07/79/852300779.db2.gz IBOHKXMEODBYEY-DYESRHJHSA-N 0 3 400.469 4.207 20 0 HIADHN Cc1ccc(-c2nc(CC(=O)N(CCN(C)C)Cc3cccc(Cl)c3)cs2)o1 ZINC000065936764 852324601 /nfs/dbraw/zinc/32/46/01/852324601.db2.gz QJCQLCGRTVDHLS-UHFFFAOYSA-N 0 3 417.962 4.498 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)/C=C/c1ccc([N+](=O)[O-])cc1 ZINC000065936367 852325041 /nfs/dbraw/zinc/32/50/41/852325041.db2.gz CVOKXHAJROUKHL-KPKJPENVSA-N 0 3 421.419 4.217 20 0 HIADHN Cc1cc(C(=O)N(CCN(C)C)Cc2ccc(F)cc2F)c(C)n1CC(F)(F)F ZINC000065937871 852326172 /nfs/dbraw/zinc/32/61/72/852326172.db2.gz RDHQDLBVSHLLGH-UHFFFAOYSA-N 0 3 417.422 4.149 20 0 HIADHN C[C@@H](NC(=O)NC[C@H](c1ccccc1)N1CCCC1)c1cccc(N2CCCC2=O)c1 ZINC000065994881 852349019 /nfs/dbraw/zinc/34/90/19/852349019.db2.gz PLLONRXODLATPX-AUSIDOKSSA-N 0 3 420.557 4.011 20 0 HIADHN Cc1cc(Br)ccc1SCC(=O)NC[C@H](c1ccccc1)N(C)C ZINC000068988167 852379517 /nfs/dbraw/zinc/37/95/17/852379517.db2.gz IZRUFFWOALORGO-QGZVFWFLSA-N 0 3 407.377 4.269 20 0 HIADHN COc1ccc(CC[C@H](C)NC(=O)NC[C@@H](c2cccs2)N2CCCC2)cc1 ZINC000072044458 852484385 /nfs/dbraw/zinc/48/43/85/852484385.db2.gz WGIFTUKIRQTYPX-PXNSSMCTSA-N 0 3 401.576 4.214 20 0 HIADHN COc1ccc(CC[C@@H](C)NC(=O)NC[C@@H](c2cccs2)N2CCCC2)cc1 ZINC000072044459 852484692 /nfs/dbraw/zinc/48/46/92/852484692.db2.gz WGIFTUKIRQTYPX-XLIONFOSSA-N 0 3 401.576 4.214 20 0 HIADHN O=C(Nc1nnc(Cc2cccc(F)c2)s1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000078654046 852522849 /nfs/dbraw/zinc/52/28/49/852522849.db2.gz SDSUGIWQDXMSPJ-SFHVURJKSA-N 0 3 410.518 4.119 20 0 HIADHN C[C@H](CN1CCCCC1)NC(=O)c1ccc(Oc2cccc(Br)c2)nc1 ZINC000078956906 852536409 /nfs/dbraw/zinc/53/64/09/852536409.db2.gz QHSQPTGLUFEIOU-OAHLLOKOSA-N 0 3 418.335 4.241 20 0 HIADHN COc1ccc(-c2nnc(SCC(=O)C(C#N)c3nc4ccccc4s3)o2)cc1 ZINC000096299408 852547697 /nfs/dbraw/zinc/54/76/97/852547697.db2.gz ZWHLFUXUUVMUEW-AWEZNQCLSA-N 0 3 422.491 4.323 20 0 HIADHN Cc1cc(C(=O)NC[C@H](c2cccs2)N2CCCC2)c(C)n1Cc1ccccn1 ZINC000097285728 852596681 /nfs/dbraw/zinc/59/66/81/852596681.db2.gz UNXKJIPXKHRWIE-OAQYLSRUSA-N 0 3 408.571 4.177 20 0 HIADHN CCc1c(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)cnn1Cc1ccccc1 ZINC000097295248 852598601 /nfs/dbraw/zinc/59/86/01/852598601.db2.gz PSJVUBPTYIIYAO-DEOSSOPVSA-N 0 3 402.542 4.061 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1ccsc1 ZINC000097327266 852601773 /nfs/dbraw/zinc/60/17/73/852601773.db2.gz LSVWLCGVIUDCSZ-ROUUACIJSA-N 0 3 419.616 4.004 20 0 HIADHN O=C(C[C@H](c1ccccc1)C(F)(F)F)NCC1(N2CCSCC2)CCCC1 ZINC000097547165 852626391 /nfs/dbraw/zinc/62/63/91/852626391.db2.gz XECDHQCEHMREDH-QGZVFWFLSA-N 0 3 400.510 4.200 20 0 HIADHN C[C@H](SCC(=O)NC[C@H](c1ccccc1)N1CCCC1)c1nc2ccccc2[nH]1 ZINC000097656485 852645560 /nfs/dbraw/zinc/64/55/60/852645560.db2.gz CNONAFOFURRISD-LAUBAEHRSA-N 0 3 408.571 4.310 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CC(=O)N1CCCN(Cc2ccccc2C)CC1 ZINC000106223993 852763766 /nfs/dbraw/zinc/76/37/66/852763766.db2.gz LVDOCNXKWKHAEJ-UHFFFAOYSA-N 0 3 416.569 4.075 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)[C@H](C)Oc3cc(C)ccc3Cl)cc2)CC1 ZINC000108144253 852825955 /nfs/dbraw/zinc/82/59/55/852825955.db2.gz YPDVJJYNJBMFGJ-SFHVURJKSA-N 0 3 415.965 4.192 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cccn1Cc1cccs1)c1cccc(OC)c1 ZINC000108467466 852853863 /nfs/dbraw/zinc/85/38/63/852853863.db2.gz CGZVDOXACYSHQS-JOCHJYFZSA-N 0 3 411.571 4.419 20 0 HIADHN Cc1cc(NC(=O)C(C)(C)C)sc1C(=O)N(CCN(C)C)Cc1ccccc1F ZINC000108688985 852872453 /nfs/dbraw/zinc/87/24/53/852872453.db2.gz WKWWKSNJPAEYFA-UHFFFAOYSA-N 0 3 419.566 4.384 20 0 HIADHN CN(CC(=O)Nc1c(Cl)cccc1Cl)C(=O)c1cccc(CN2CCCC2)c1 ZINC000108706925 852874333 /nfs/dbraw/zinc/87/43/33/852874333.db2.gz ZTXPNOOVMQPYLD-UHFFFAOYSA-N 0 3 420.340 4.300 20 0 HIADHN Cc1noc(CSc2ccccc2C(=O)NC[C@@H](c2ccc(C)cc2)N(C)C)n1 ZINC000109290084 852947272 /nfs/dbraw/zinc/94/72/72/852947272.db2.gz KGNNBBPDINFTDE-IBGZPJMESA-N 0 3 410.543 4.011 20 0 HIADHN CSCc1nc2ccccc2n1CC(=O)NC[C@@H]1CCCCN1Cc1ccccc1 ZINC000109303876 852949915 /nfs/dbraw/zinc/94/99/15/852949915.db2.gz CWLMYZZGOLHSRJ-FQEVSTJZSA-N 0 3 422.598 4.070 20 0 HIADHN O=C(CCc1ccc(Br)cc1F)N1CCCN(Cc2ccccc2)CC1 ZINC000109376722 852962301 /nfs/dbraw/zinc/96/23/01/852962301.db2.gz PQWBDBCWESNBKG-UHFFFAOYSA-N 0 3 419.338 4.255 20 0 HIADHN O=C(N[C@H]1CCN(Cc2ccccc2)C1)c1ccc(N2CCc3ccccc3C2)cc1 ZINC000109416050 852967477 /nfs/dbraw/zinc/96/74/77/852967477.db2.gz NFBWNHQSDSJYDA-VWLOTQADSA-N 0 3 411.549 4.254 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)[C@H]1C[C@H]1c1cccc(Br)c1 ZINC000109566228 852986229 /nfs/dbraw/zinc/98/62/29/852986229.db2.gz WKJXVZRHVSTFOY-OALUTQOASA-N 0 3 419.338 4.282 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)[C@H]1C[C@@H]1c1ccc(Br)cc1 ZINC000109770646 853011873 /nfs/dbraw/zinc/01/18/73/853011873.db2.gz IGVKFHUJLPXETN-UXHICEINSA-N 0 3 419.338 4.282 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)[C@H]1C[C@@H]1c1ccc(Br)cc1 ZINC000109769894 853011930 /nfs/dbraw/zinc/01/19/30/853011930.db2.gz XCEQWJSQABVZDB-UXHICEINSA-N 0 3 419.338 4.282 20 0 HIADHN C[C@@H](Sc1ccc(Cl)cc1)C(=O)N(C)C1CCN(CCc2ccccn2)CC1 ZINC000109796234 853016175 /nfs/dbraw/zinc/01/61/75/853016175.db2.gz ATMFNWYCUIKMDS-QGZVFWFLSA-N 0 3 418.006 4.381 20 0 HIADHN C[C@@H](Sc1ccccc1Cl)C(=O)N(C)C1CCN(CCc2ccccn2)CC1 ZINC000109809060 853017107 /nfs/dbraw/zinc/01/71/07/853017107.db2.gz UNJNEHRHJLTHMS-QGZVFWFLSA-N 0 3 418.006 4.381 20 0 HIADHN CCOc1ccc(CN(C)C(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)cc1 ZINC000110172301 853069253 /nfs/dbraw/zinc/06/92/53/853069253.db2.gz QIMZLTJGXRWDBW-QFIPXVFZSA-N 0 3 420.475 4.498 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)[C@H](Oc3ccccc3)c3ccccc3)CC2)C[C@@H](C)O1 ZINC000110408128 853096452 /nfs/dbraw/zinc/09/64/52/853096452.db2.gz JPKZLHJMNDQCPX-DNRQZRRGSA-N 0 3 422.569 4.155 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)c3cc4c(s3)-c3ccccc3CC4)CC2)C[C@H](C)O1 ZINC000110414569 853097900 /nfs/dbraw/zinc/09/79/00/853097900.db2.gz QNBXQZQEFYJGIN-ROUUACIJSA-N 0 3 424.610 4.475 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)Cc3ccc(-c4ccccc4)cc3)CC2)C[C@H](C)O1 ZINC000110455602 853102107 /nfs/dbraw/zinc/10/21/07/853102107.db2.gz VUBIZQHYEZLZRI-SFTDATJTSA-N 0 3 406.570 4.244 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)c3cccc(Oc4ccccc4)c3)CC2)C[C@@H](C)O1 ZINC000110454279 853102317 /nfs/dbraw/zinc/10/23/17/853102317.db2.gz XNYMPPFYMCNZIR-WOJBJXKFSA-N 0 3 408.542 4.440 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3ccc(-c4nccs4)cc3)CC2)C[C@H](C)O1 ZINC000110723264 853145260 /nfs/dbraw/zinc/14/52/60/853145260.db2.gz DVIACHVDMWMXSV-CALCHBBNSA-N 0 3 414.575 4.163 20 0 HIADHN CSc1ccccc1NC(=O)CCN1CCC(c2nc(-c3ccccn3)no2)CC1 ZINC000110991735 853182398 /nfs/dbraw/zinc/18/23/98/853182398.db2.gz GGGFYZQCEQNRKU-UHFFFAOYSA-N 0 3 423.542 4.062 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)[C@H](c2ccccc2)N2CCCCC2=O)N2CCCC2)cc1 ZINC000111199201 853220588 /nfs/dbraw/zinc/22/05/88/853220588.db2.gz APQYQQWLAOTWOG-NOZRDPDXSA-N 0 3 419.569 4.002 20 0 HIADHN CCOc1c(Br)cc(Br)cc1CNCCc1cscn1 ZINC000111627330 853228752 /nfs/dbraw/zinc/22/87/52/853228752.db2.gz QORAQUDUJBPBRB-UHFFFAOYSA-N 0 3 420.170 4.399 20 0 HIADHN COc1ccc([C@H]2CCCN2C[C@H](O)COc2cccc3ccccc32)c(OC)c1 ZINC000115336935 853249669 /nfs/dbraw/zinc/24/96/69/853249669.db2.gz IVLIBZBRVCYRBP-WMZHIEFXSA-N 0 3 407.510 4.434 20 0 HIADHN COc1ccc(SCCC(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)cc1 ZINC000116073105 853281376 /nfs/dbraw/zinc/28/13/76/853281376.db2.gz QFTADIJUFFQNAH-UHFFFAOYSA-N 0 3 408.514 4.046 20 0 HIADHN CCCN(C(=O)c1ccc(Cn2ccnc2)cc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000116590668 853318306 /nfs/dbraw/zinc/31/83/06/853318306.db2.gz PLKGNFCEVLCDQG-VWLOTQADSA-N 0 3 416.569 4.448 20 0 HIADHN CC[C@H](CNC(=O)N(Cc1ccco1)Cc1ccco1)N1CCc2ccccc2C1 ZINC000117307789 853353009 /nfs/dbraw/zinc/35/30/09/853353009.db2.gz XNEJBBQTFTXJGU-OAQYLSRUSA-N 0 3 407.514 4.421 20 0 HIADHN COCCN1CCC(NC(=O)c2ccc(CSc3ccc(Cl)cc3)cc2)CC1 ZINC000138553789 853391169 /nfs/dbraw/zinc/39/11/69/853391169.db2.gz OKIQHDYMJQATHJ-UHFFFAOYSA-N 0 3 418.990 4.473 20 0 HIADHN O=C(c1cc(F)ccc1F)C1CCN(C(=O)c2cccc(CN3CCCC3)c2)CC1 ZINC000139277800 853407273 /nfs/dbraw/zinc/40/72/73/853407273.db2.gz YFKNUZCBLDNUAY-UHFFFAOYSA-N 0 3 412.480 4.296 20 0 HIADHN Cc1cc(C)n(Cc2ccc(C(=O)NC[C@@H](c3ccccc3)N3CCCC3)cc2)n1 ZINC000139678624 853418283 /nfs/dbraw/zinc/41/82/83/853418283.db2.gz PVAUTXYOIDQHMO-DEOSSOPVSA-N 0 3 402.542 4.115 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCc1csc(C)n1)c1ccc(C(F)(F)F)cc1 ZINC000139691228 853419388 /nfs/dbraw/zinc/41/93/88/853419388.db2.gz OMCWZUVWYWQLTC-QGZVFWFLSA-N 0 3 414.497 4.353 20 0 HIADHN O=C(CCN1CCN(CCc2cccs2)CC1)Nc1c(Cl)cccc1Cl ZINC000141409336 853471377 /nfs/dbraw/zinc/47/13/77/853471377.db2.gz UAJOUZJOIVQQTG-UHFFFAOYSA-N 0 3 412.386 4.244 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2cccc(NC(=O)c3ccco3)c2)N2CCCC2)cc1 ZINC000143052014 853507339 /nfs/dbraw/zinc/50/73/39/853507339.db2.gz ORXPVBDBVZLKCW-QFIPXVFZSA-N 0 3 417.509 4.407 20 0 HIADHN Cc1nn(CC(C)C)c(C)c1CCC(=O)NC[C@H](c1ccc(C)cc1)N1CCCC1 ZINC000143200445 853509469 /nfs/dbraw/zinc/50/94/69/853509469.db2.gz QKKHQJGPTFQPDN-XMMPIXPASA-N 0 3 410.606 4.350 20 0 HIADHN Cc1nn(C(F)F)c(C)c1CC(=O)C(C#N)C(=O)Nc1cc(Cl)cc(Cl)c1 ZINC000143164300 853509514 /nfs/dbraw/zinc/50/95/14/853509514.db2.gz JGXKPISZXXUIOC-AWEZNQCLSA-N 0 3 415.227 4.092 20 0 HIADHN COc1ccc([C@H](NC(=S)NC2CCN(Cc3ccccc3)CC2)C2CC2)cc1 ZINC000145509170 853552654 /nfs/dbraw/zinc/55/26/54/853552654.db2.gz IPFHUUBARXDQFU-HSZRJFAPSA-N 0 3 409.599 4.275 20 0 HIADHN CCCOc1ccccc1CN1CCC2(CC1)CCN(C(=O)c1cccnc1)CC2 ZINC000147490781 853588619 /nfs/dbraw/zinc/58/86/19/853588619.db2.gz PYOMKBWWKXYUSO-UHFFFAOYSA-N 0 3 407.558 4.389 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1NC(=O)c1ccc(N2CCN(C(C)C)CC2)cc1 ZINC000148753231 853612941 /nfs/dbraw/zinc/61/29/41/853612941.db2.gz JRGFWEJLZXJZSP-UHFFFAOYSA-N 0 3 417.557 4.272 20 0 HIADHN C[C@@H]1CN(C(=O)c2ccc(CNCc3cccc(C(F)(F)F)c3)cc2)C[C@H](C)O1 ZINC000165973037 853654034 /nfs/dbraw/zinc/65/40/34/853654034.db2.gz PZDNODFQCDQHBC-IYBDPMFKSA-N 0 3 406.448 4.245 20 0 HIADHN CN(C(=O)c1ccccc1Oc1cccc(Br)c1)C1CCN(C)CC1 ZINC000195536773 853671149 /nfs/dbraw/zinc/67/11/49/853671149.db2.gz JLYHNKDZCSOMPV-UHFFFAOYSA-N 0 3 403.320 4.408 20 0 HIADHN O=C(NCc1ccccc1OCC(F)(F)F)N1CCCN(Cc2ccccc2)CC1 ZINC000195556255 853681308 /nfs/dbraw/zinc/68/13/08/853681308.db2.gz FEGZKNGCVLWUPC-UHFFFAOYSA-N 0 3 421.463 4.045 20 0 HIADHN CC(C)CN(CCN(C)C)C(=O)NC1CCN(c2ccc(C(C)(C)C)cc2)CC1 ZINC000195614899 853714988 /nfs/dbraw/zinc/71/49/88/853714988.db2.gz LRYHNCDHXGZEJH-UHFFFAOYSA-N 0 3 402.627 4.182 20 0 HIADHN COc1cccc([C@@H](CNC(=O)N[C@@H]2CCc3c2cccc3Cl)N2CCCC2)c1 ZINC000195637237 853729671 /nfs/dbraw/zinc/72/96/71/853729671.db2.gz HCAINUJFNSCEEI-FGZHOGPDSA-N 0 3 413.949 4.472 20 0 HIADHN CC(C)(CNC(=O)N[C@@H]1CCOc2c(Cl)cccc21)N1CCc2ccccc2C1 ZINC000195636514 853729871 /nfs/dbraw/zinc/72/98/71/853729871.db2.gz ZSOFKIAJVKWQHG-HXUWFJFHSA-N 0 3 413.949 4.300 20 0 HIADHN COc1cccc([C@H](CNC(=O)N[C@H]2CCc3c2cccc3Cl)N2CCCC2)c1 ZINC000195637242 853730021 /nfs/dbraw/zinc/73/00/21/853730021.db2.gz HCAINUJFNSCEEI-VXKWHMMOSA-N 0 3 413.949 4.472 20 0 HIADHN COc1ccc([C@H](NCC(=O)N2CCC[C@@H]2c2ccc(OC)cc2OC)C2CC2)cc1 ZINC000195667937 853747394 /nfs/dbraw/zinc/74/73/94/853747394.db2.gz IZDMFKNADNVTGZ-RCZVLFRGSA-N 0 3 424.541 4.117 20 0 HIADHN C[C@]12CC3CC(C(=O)Nc4cccc(CN5CCC(C(N)=O)CC5)c4)(C1)C[C@@](C)(C3)C2 ZINC000195682462 853755710 /nfs/dbraw/zinc/75/57/10/853755710.db2.gz ICQXVTRRPWQLAP-JZHSQQRGSA-N 0 3 423.601 4.319 20 0 HIADHN C[C@H](Cc1cccc(Br)c1)NC(=O)c1cccc(CN2CCCC2)c1 ZINC000195683344 853755982 /nfs/dbraw/zinc/75/59/82/853755982.db2.gz OKJNCHZSQNTSEU-MRXNPFEDSA-N 0 3 401.348 4.406 20 0 HIADHN CCN(C(=O)CNC1(c2ccc(Br)cc2)CCOCC1)C1CCCCC1 ZINC000195687510 853758945 /nfs/dbraw/zinc/75/89/45/853758945.db2.gz OXRUUZHAHGBZEQ-UHFFFAOYSA-N 0 3 423.395 4.226 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cc(Br)cs1)c1cccc(OC)c1 ZINC000195714580 853774477 /nfs/dbraw/zinc/77/44/77/853774477.db2.gz IACZXBGRXDXUDF-MRXNPFEDSA-N 0 3 411.365 4.332 20 0 HIADHN COCCOc1c(Cl)cccc1NC(=O)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000195713603 853774661 /nfs/dbraw/zinc/77/46/61/853774661.db2.gz BUZMCXCJDBKDPA-FQEVSTJZSA-N 0 3 417.937 4.324 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2cnn(-c3ccccc3)c2C(F)(F)F)N(C)C)cc1 ZINC000195717693 853776736 /nfs/dbraw/zinc/77/67/36/853776736.db2.gz GRVJBBDXSYKDEX-IBGZPJMESA-N 0 3 416.447 4.232 20 0 HIADHN O=C(NCc1ccc(Br)c(F)c1)N1CCCN(Cc2ccccc2)CC1 ZINC000195736151 853786086 /nfs/dbraw/zinc/78/60/86/853786086.db2.gz LCQCJKTYRTZPCM-UHFFFAOYSA-N 0 3 420.326 4.006 20 0 HIADHN Cc1ccc(NC(=O)C2CCN(CCOc3ccccc3C(F)(F)F)CC2)nc1 ZINC000215892380 853839139 /nfs/dbraw/zinc/83/91/39/853839139.db2.gz HVTISVAEUZXYNB-UHFFFAOYSA-N 0 3 407.436 4.138 20 0 HIADHN c1ccc(COc2cccc(CN[C@H](CN3CCOCC3)c3ccccc3)c2)cc1 ZINC000216503676 853853996 /nfs/dbraw/zinc/85/39/96/853853996.db2.gz WWMVHEDGGKAFST-AREMUKBSSA-N 0 3 402.538 4.429 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)c2cccc(NC(=O)c3ccco3)c2)C1 ZINC000227388804 853886091 /nfs/dbraw/zinc/88/60/91/853886091.db2.gz ONUCRRNVWHZPLO-LAUBAEHRSA-N 0 3 403.482 4.097 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)C2(c3ccc(Br)cc3)CC2)C1 ZINC000227381743 853886147 /nfs/dbraw/zinc/88/61/47/853886147.db2.gz ACQXNFPXKDMMIN-OXJNMPFZSA-N 0 3 413.359 4.432 20 0 HIADHN Brc1cccc(-c2nc(CNCCCOC3CCOCC3)cs2)c1 ZINC000236581366 853899932 /nfs/dbraw/zinc/89/99/32/853899932.db2.gz VTHOGOMUIYSTCR-UHFFFAOYSA-N 0 3 411.365 4.248 20 0 HIADHN CC(=O)Nc1cccc(OCCNCc2c(C)nn(-c3ccc(Cl)cc3)c2C)c1 ZINC000236627970 853904791 /nfs/dbraw/zinc/90/47/91/853904791.db2.gz HZSTYXZRLDLGJN-UHFFFAOYSA-N 0 3 412.921 4.270 20 0 HIADHN CC(C)N(C)S(=O)(=O)c1ccc(CNCc2cccc(-c3ccncc3)c2)cc1 ZINC000236688166 853912287 /nfs/dbraw/zinc/91/22/87/853912287.db2.gz MHWWBCLNJLGFFF-UHFFFAOYSA-N 0 3 409.555 4.067 20 0 HIADHN CC(C)NS(=O)(=O)Cc1ccccc1CNCc1ccc(-c2ccccc2)cc1 ZINC000236721918 853915137 /nfs/dbraw/zinc/91/51/37/853915137.db2.gz FQVFCAPKUAFMLU-UHFFFAOYSA-N 0 3 408.567 4.471 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@@H](C)NCc2cc3ccccc3[nH]c2=O)CC1 ZINC000236850940 853929204 /nfs/dbraw/zinc/92/92/04/853929204.db2.gz DOVNOHRDVBTMJK-QGZVFWFLSA-N 0 3 408.521 4.072 20 0 HIADHN CCCOc1c(Cl)cc(CNCc2ccnc(-n3ccnc3)c2)cc1OCC ZINC000236911905 853935948 /nfs/dbraw/zinc/93/59/48/853935948.db2.gz RIVRDEBRGRLXKQ-UHFFFAOYSA-N 0 3 400.910 4.398 20 0 HIADHN CCOc1cc(CNCc2ccc(C)cc2C)ccc1OCC(=O)N1CCCCC1 ZINC000236964200 853943518 /nfs/dbraw/zinc/94/35/18/853943518.db2.gz SJHHBFNRRNXTAM-UHFFFAOYSA-N 0 3 410.558 4.383 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@@H](C)NCc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000236981189 853946379 /nfs/dbraw/zinc/94/63/79/853946379.db2.gz VROGLOPDAXKFHX-OAHLLOKOSA-N 0 3 420.916 4.380 20 0 HIADHN CCCOc1c(Br)cc(CNC[C@@H](c2ccco2)N(C)C)cc1OC ZINC000236992928 853948188 /nfs/dbraw/zinc/94/81/88/853948188.db2.gz KOJKRMWWPWGJMF-INIZCTEOSA-N 0 3 411.340 4.232 20 0 HIADHN CCn1c2ccccc2c2cc(CNCc3ccc(S(=O)(=O)N(C)C)cc3)ccc21 ZINC000237007748 853950098 /nfs/dbraw/zinc/95/00/98/853950098.db2.gz JGYQJPBPEOZQGA-UHFFFAOYSA-N 0 3 421.566 4.355 20 0 HIADHN CCOc1c(Br)cc(CNCc2ccccc2-n2cccn2)cc1OC ZINC000237006247 853950112 /nfs/dbraw/zinc/95/01/12/853950112.db2.gz PNENKZMMUOXPLT-UHFFFAOYSA-N 0 3 416.319 4.332 20 0 HIADHN CNC(=O)c1cccc(CCNCc2c(C)nn(-c3cc(C)ccc3C)c2Cl)c1 ZINC000237047857 853956864 /nfs/dbraw/zinc/95/68/64/853956864.db2.gz OQLUXBVWQYJPCG-UHFFFAOYSA-N 0 3 410.949 4.143 20 0 HIADHN CN1CCN(c2ccc(C(F)(F)F)cc2CNCc2cc3ccccc3o2)CC1 ZINC000237100418 853964121 /nfs/dbraw/zinc/96/41/21/853964121.db2.gz ZYBDWZSGTWLTKW-UHFFFAOYSA-N 0 3 403.448 4.493 20 0 HIADHN COc1ccccc1-c1ccc(CNCc2ccccc2CN2CCOCC2)cc1 ZINC000237096530 853964516 /nfs/dbraw/zinc/96/45/16/853964516.db2.gz BBDTWVCPNFIENE-UHFFFAOYSA-N 0 3 402.538 4.484 20 0 HIADHN Cc1cc(N2CCN(C)CC2)ccc1NCc1csc(-c2ccc3c(c2)OCO3)n1 ZINC000237122358 853967339 /nfs/dbraw/zinc/96/73/39/853967339.db2.gz RLWLYUWOLRHXIB-UHFFFAOYSA-N 0 3 422.554 4.211 20 0 HIADHN COCCOc1cccc(CNCc2ccc(NC(=O)c3ccc(F)cc3)cc2)c1 ZINC000237242107 853990206 /nfs/dbraw/zinc/99/02/06/853990206.db2.gz USHIPZBPDPKXBH-UHFFFAOYSA-N 0 3 408.473 4.393 20 0 HIADHN COc1ccc(NC(=O)C[C@@H](C)N[C@H]2CCSc3c(F)cccc32)c(OC)c1 ZINC000237293026 853999151 /nfs/dbraw/zinc/99/91/51/853999151.db2.gz ZEBPDDGLVSINEQ-DYVFJYSZSA-N 0 3 404.507 4.387 20 0 HIADHN COc1ccc(OCc2ccccn2)c(CNCCc2nc3cc(F)ccc3n2C)c1 ZINC000237291646 853999370 /nfs/dbraw/zinc/99/93/70/853999370.db2.gz ZCHWHVBJVVWGPR-UHFFFAOYSA-N 0 3 420.488 4.027 20 0 HIADHN COc1cc(CNCc2ccnc(-n3ccnc3)c2)ccc1OCc1cccs1 ZINC000237291227 853999548 /nfs/dbraw/zinc/99/95/48/853999548.db2.gz UWISSGLGFAZRNC-UHFFFAOYSA-N 0 3 406.511 4.206 20 0 HIADHN CSC[C@@](C)(O)CNCc1c(C)nn(Cc2c(Cl)cccc2Cl)c1Cl ZINC000237362316 854014737 /nfs/dbraw/zinc/01/47/37/854014737.db2.gz FODQQSNFUYOFEF-KRWDZBQOSA-N 0 3 422.809 4.404 20 0 HIADHN COc1cccc(CNCCc2nc(-c3ccc(Cl)cc3)no2)c1OC(F)F ZINC000237376414 854017763 /nfs/dbraw/zinc/01/77/63/854017763.db2.gz PRIJIFCQWTZLOU-UHFFFAOYSA-N 0 3 409.820 4.332 20 0 HIADHN COc1ccc(OC)c(NC(=O)C[C@@H](C)N[C@H]2CCSc3ccc(F)cc32)c1 ZINC000237398147 854022258 /nfs/dbraw/zinc/02/22/58/854022258.db2.gz DWOHQMPIBLSNAP-DYVFJYSZSA-N 0 3 404.507 4.387 20 0 HIADHN COc1ccc(OC)c(NC(=O)C[C@@H](C)N[C@H](c2ccccc2)c2ccncc2)c1 ZINC000237397939 854022551 /nfs/dbraw/zinc/02/25/51/854022551.db2.gz IWTJYUAKQXBCOJ-MZNJEOGPSA-N 0 3 405.498 4.195 20 0 HIADHN COc1cc([C@H](C)NCc2cnc3c(c2)c(C)nn3C)ccc1OCc1ccncc1 ZINC000237398582 854023421 /nfs/dbraw/zinc/02/34/21/854023421.db2.gz REBMOEOVINNEJE-INIZCTEOSA-N 0 3 417.513 4.110 20 0 HIADHN COc1cc(CN[C@H](Cc2ccccc2)c2ccccc2)cc(Cl)c1OCC(N)=O ZINC000237407805 854025530 /nfs/dbraw/zinc/02/55/30/854025530.db2.gz SRMUTLBOMBHCGE-OAQYLSRUSA-N 0 3 424.928 4.286 20 0 HIADHN COc1ccc(Br)c(C(=O)NCCCNCc2ccc([C@@H]3C[C@@H]3C)o2)c1 ZINC000237419093 854029016 /nfs/dbraw/zinc/02/90/16/854029016.db2.gz NOJZVSCQSODOIZ-XJKSGUPXSA-N 0 3 421.335 4.084 20 0 HIADHN COc1ccc(OCc2ccccn2)c(CNCc2ccc(F)c(CN(C)C)c2)c1 ZINC000237438060 854033946 /nfs/dbraw/zinc/03/39/46/854033946.db2.gz DORQHIDSWWJQRU-UHFFFAOYSA-N 0 3 409.505 4.160 20 0 HIADHN COc1cc(CNc2ccccc2CN2CCC(O)CC2)ccc1OCC(F)(F)F ZINC000237448079 854034976 /nfs/dbraw/zinc/03/49/76/854034976.db2.gz BFDORQXHDVOMBX-UHFFFAOYSA-N 0 3 424.463 4.205 20 0 HIADHN Cc1nn(Cc2ccc(Cl)cc2Cl)c(Cl)c1CNC[C@]1(O)CCSC1 ZINC000237601834 854060725 /nfs/dbraw/zinc/06/07/25/854060725.db2.gz QPCNQRVBRBPAQH-QGZVFWFLSA-N 0 3 420.793 4.158 20 0 HIADHN Cc1nccn1-c1ccc(CNCc2cn(-c3ccccc3)nc2-c2ccncc2)cn1 ZINC000237655592 854068671 /nfs/dbraw/zinc/06/86/71/854068671.db2.gz BICFAKZHJKUIBL-UHFFFAOYSA-N 0 3 421.508 4.113 20 0 HIADHN O=C(Nc1cccc(CNCc2ccc(-n3cncn3)cc2)c1)c1ccc(Cl)cc1 ZINC000237667996 854071673 /nfs/dbraw/zinc/07/16/73/854071673.db2.gz LROCOFQPAVSFCF-UHFFFAOYSA-N 0 3 417.900 4.463 20 0 HIADHN Cc1nn(-c2cccc(C(F)(F)F)c2)c(Cl)c1CN[C@@H]1CCc2n[nH]cc2C1 ZINC000237811598 854102359 /nfs/dbraw/zinc/10/23/59/854102359.db2.gz JZCYYSVCBYGKLS-CQSZACIVSA-N 0 3 409.843 4.223 20 0 HIADHN Cc1nn(C)c(N2CCOCC2)c1CN[C@H](CCc1ccccc1)c1ccccc1 ZINC000237832207 854105722 /nfs/dbraw/zinc/10/57/22/854105722.db2.gz DYZAILAEXDVGBP-XMMPIXPASA-N 0 3 404.558 4.029 20 0 HIADHN Cn1c(CCNCc2cc(Cl)ccc2OC[C@@H]2CCCO2)nc2c1cccc2F ZINC000237852412 854107626 /nfs/dbraw/zinc/10/76/26/854107626.db2.gz PYDHSTHFVLVTPP-KRWDZBQOSA-N 0 3 417.912 4.256 20 0 HIADHN O=C(CCNCc1cccc(NC(=O)c2ccc(Cl)cc2)c1)N1CCCCCC1 ZINC000237870607 854111579 /nfs/dbraw/zinc/11/15/79/854111579.db2.gz WEXKWUFNKHJABR-UHFFFAOYSA-N 0 3 413.949 4.475 20 0 HIADHN Cc1cccc(OC[C@H](O)CNCc2cc3ccccc3nc2N2CCCCC2)c1 ZINC000237867553 854111769 /nfs/dbraw/zinc/11/17/69/854111769.db2.gz LVPUJWAGBZGMRY-JOCHJYFZSA-N 0 3 405.542 4.063 20 0 HIADHN O[C@H](CNCc1cnc(-c2ccccc2)s1)COc1cccc(C(F)(F)F)c1 ZINC000237978503 854128377 /nfs/dbraw/zinc/12/83/77/854128377.db2.gz KBPMRSNBVUMUSX-MRXNPFEDSA-N 0 3 408.445 4.358 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)Cc2csc(-c3cccs3)n2)CC1 ZINC000248126631 854180497 /nfs/dbraw/zinc/18/04/97/854180497.db2.gz LXMJBMKNUDPNNG-UHFFFAOYSA-N 0 3 401.557 4.130 20 0 HIADHN Cc1cccc([C@@H]2CCCN2CC(=O)N2CCC[C@H]2c2ccc3c(c2)OCCO3)c1 ZINC000251196474 854197342 /nfs/dbraw/zinc/19/73/42/854197342.db2.gz QOJSHELBWRHOTF-VXKWHMMOSA-N 0 3 406.526 4.267 20 0 HIADHN Cc1ccc(C[C@@H]2CCCN2CC(=O)N2CCC[C@H]2c2ccc3c(c2)OCCO3)cc1 ZINC000251496622 854198475 /nfs/dbraw/zinc/19/84/75/854198475.db2.gz VCINOUOQNNORTH-GOTSBHOMSA-N 0 3 420.553 4.137 20 0 HIADHN COc1cccc([C@@H](CNC(=O)/C=C/c2nc3ccccc3s2)N2CCCC2)c1 ZINC000255949732 854228004 /nfs/dbraw/zinc/22/80/04/854228004.db2.gz FPRHPIBEKNXGBM-YVNCXZRQSA-N 0 3 407.539 4.271 20 0 HIADHN O=C(Cc1cccc2cccnc21)NC1CCN(CCOc2ccc(Cl)cc2)CC1 ZINC000261427583 854258600 /nfs/dbraw/zinc/25/86/00/854258600.db2.gz OAJFRDQEIWFYQT-UHFFFAOYSA-N 0 3 423.944 4.090 20 0 HIADHN Cc1onc(-c2ccccc2)c1-c1nnc(CN2CCN(C3CCC(C)CC3)CC2)o1 ZINC000261465537 854271534 /nfs/dbraw/zinc/27/15/34/854271534.db2.gz VJWGAUGLXNFMEC-UHFFFAOYSA-N 0 3 421.545 4.396 20 0 HIADHN C[C@@H](CNC(=O)CSCc1cc(-c2cccs2)on1)N(C)Cc1ccccc1 ZINC000261476176 854274755 /nfs/dbraw/zinc/27/47/55/854274755.db2.gz XEJLCXXAKYGKRW-INIZCTEOSA-N 0 3 415.584 4.273 20 0 HIADHN COc1ccc([C@@H](CNc2ccc3nnc(-c4ccccc4)n3n2)N2CCCC2)cc1 ZINC000301061893 854284224 /nfs/dbraw/zinc/28/42/24/854284224.db2.gz CLDGZYGISPTNKH-OAQYLSRUSA-N 0 3 414.513 4.049 20 0 HIADHN COc1ccc([C@@H](CNC(=O)CCSc2ccc(F)cc2)N2CCCC2)cc1 ZINC000301315645 854355945 /nfs/dbraw/zinc/35/59/45/854355945.db2.gz QSENGJLIJVOMAC-OAQYLSRUSA-N 0 3 402.535 4.270 20 0 HIADHN COc1ccc([C@H](CNC(=O)CCSc2ccc(F)cc2)N2CCCC2)cc1 ZINC000301315644 854356559 /nfs/dbraw/zinc/35/65/59/854356559.db2.gz QSENGJLIJVOMAC-NRFANRHFSA-N 0 3 402.535 4.270 20 0 HIADHN COc1ccc([C@@H](CNc2ccc(-c3nc(C)c(C)c(=O)[n-]3)cn2)[NH+]2CCCC2)cc1 ZINC000301348069 854367160 /nfs/dbraw/zinc/36/71/60/854367160.db2.gz ISXMYFDIWACSMM-OAQYLSRUSA-N 0 3 419.529 4.119 20 0 HIADHN O=c1c(Cl)c(N[C@@H](CN2CCCC2)c2ccccc2)cnn1Cc1ccccc1 ZINC000301371800 854373853 /nfs/dbraw/zinc/37/38/53/854373853.db2.gz VMZQHSFLGWUIJC-NRFANRHFSA-N 0 3 408.933 4.194 20 0 HIADHN Cc1ccc([C@H](CNc2ccc(-c3nc(C)c(C)c(=O)[n-]3)cn2)[NH+]2CCCC2)cc1 ZINC000301428571 854392464 /nfs/dbraw/zinc/39/24/64/854392464.db2.gz UVGXRIPTWFNEFV-NRFANRHFSA-N 0 3 403.530 4.418 20 0 HIADHN COc1ccccc1[C@@H](CNc1nc(-c2cccnc2)nc(C)c1C)N1CCCC1 ZINC000301495879 854407962 /nfs/dbraw/zinc/40/79/62/854407962.db2.gz AWZOIGWWNVUASI-OAQYLSRUSA-N 0 3 403.530 4.413 20 0 HIADHN O=S(=O)(c1ccc(N2CC[C@H]3[C@@H](CCCN3Cc3ccccc3)C2)cc1)C(F)F ZINC000301660365 854439347 /nfs/dbraw/zinc/43/93/47/854439347.db2.gz CLSBFJRUIUYFOQ-RXVVDRJESA-N 0 3 420.525 4.174 20 0 HIADHN C[C@@H]1C[C@H](NCc2ccc(F)cc2Br)CCN1C(=O)OC(C)(C)C ZINC000302152137 854538123 /nfs/dbraw/zinc/53/81/23/854538123.db2.gz AWRBVLNDKZTGLV-IUODEOHRSA-N 0 3 401.320 4.466 20 0 HIADHN C[C@H]1C[C@H](NCc2ccc(F)cc2Br)CCN1C(=O)OC(C)(C)C ZINC000302152138 854538235 /nfs/dbraw/zinc/53/82/35/854538235.db2.gz AWRBVLNDKZTGLV-SWLSCSKDSA-N 0 3 401.320 4.466 20 0 HIADHN COc1ccccc1[C@@H](CNc1ccc2nnc(-c3ccsc3)n2n1)N1CCCC1 ZINC000302302095 854560763 /nfs/dbraw/zinc/56/07/63/854560763.db2.gz NGDCAENKJOBDGC-GOSISDBHSA-N 0 3 420.542 4.110 20 0 HIADHN O=C(CN[C@H](c1ccc(Cl)cc1)C1CC1)Nc1cc(Cl)ccc1-n1cncn1 ZINC000302759534 854623842 /nfs/dbraw/zinc/62/38/42/854623842.db2.gz OLJMHLIZFJZBCP-FQEVSTJZSA-N 0 3 416.312 4.254 20 0 HIADHN COc1ccc([C@@H](NCC(=O)Nc2c(C)nn(-c3ccccc3)c2C)C(C)C)cc1 ZINC000302769655 854629231 /nfs/dbraw/zinc/62/92/31/854629231.db2.gz YAGFDIXFGNJRRW-QHCPKHFHSA-N 0 3 406.530 4.423 20 0 HIADHN O=C(NC1CCN(Cc2ccccc2)CC1)c1cc(Cl)ccc1Br ZINC000302832986 854648299 /nfs/dbraw/zinc/64/82/99/854648299.db2.gz YLAFTCFOWJLMMR-UHFFFAOYSA-N 0 3 407.739 4.497 20 0 HIADHN C[C@@H](C1CC1)N(CC(=O)N1CCC[C@H]1c1ccc2c(c1)OCCO2)Cc1ccccc1 ZINC000302839631 854651347 /nfs/dbraw/zinc/65/13/47/854651347.db2.gz XZCDNNVOCJOFCQ-CVDCTZTESA-N 0 3 420.553 4.422 20 0 HIADHN CN1CC[C@H](Nc2ncc(Cn3cc(Br)cn3)s2)[C@H]1c1ccccc1 ZINC000302839120 854651465 /nfs/dbraw/zinc/65/14/65/854651465.db2.gz YYIBZSRYMBUMSB-DLBZAZTESA-N 0 3 418.364 4.008 20 0 HIADHN O=C1NCCCN1C1CCN(c2ccnc3ccc(Oc4ccccc4)cc32)CC1 ZINC000302863500 854660746 /nfs/dbraw/zinc/66/07/46/854660746.db2.gz WWEBQWLIYMPYCK-UHFFFAOYSA-N 0 3 402.498 4.411 20 0 HIADHN CN(C)[C@H](CNC(=O)N1CCC(c2nc3ccccc3s2)CC1)c1ccccc1 ZINC000302889059 854667077 /nfs/dbraw/zinc/66/70/77/854667077.db2.gz BQUMXMZXIBHYOO-HXUWFJFHSA-N 0 3 408.571 4.488 20 0 HIADHN CN(Cc1ccc(Br)s1)C(=O)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000302895340 854670285 /nfs/dbraw/zinc/67/02/85/854670285.db2.gz JWRMZWRUCVSJMU-KRWDZBQOSA-N 0 3 422.392 4.489 20 0 HIADHN COCCN1CCC(NC(=O)c2cccc(Oc3cccc(C(F)(F)F)c3)c2)CC1 ZINC000303063344 854744202 /nfs/dbraw/zinc/74/42/02/854744202.db2.gz VCBWXWINSZVSTM-UHFFFAOYSA-N 0 3 422.447 4.338 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1ccccc1CN1CCSCC1)c1ccco1 ZINC000303076027 854749699 /nfs/dbraw/zinc/74/96/99/854749699.db2.gz ZERZDLUKHQYQKF-HXUWFJFHSA-N 0 3 416.591 4.033 20 0 HIADHN CC(C)(C)NC(=O)c1ccccc1NC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000303087368 854755409 /nfs/dbraw/zinc/75/54/09/854755409.db2.gz YDOUTXJUXMKUSO-SFHVURJKSA-N 0 3 411.521 4.205 20 0 HIADHN CC(C)CN(CCN(C)C)C(=O)CSc1nnc(-c2ccc3ccccc3c2)o1 ZINC000303260255 854840385 /nfs/dbraw/zinc/84/03/85/854840385.db2.gz PDNVILDSBKTLQM-UHFFFAOYSA-N 0 3 412.559 4.028 20 0 HIADHN CCN1CCN(c2ccc(NS(=O)(=O)c3ccccc3C(C)(C)C)c(C)c2)CC1 ZINC000437337326 862611730 /nfs/dbraw/zinc/61/17/30/862611730.db2.gz LMFIPWIFTNFVHK-UHFFFAOYSA-N 0 3 415.603 4.235 20 0 HIADHN CCN(CC)[C@H](C(=O)NC[C@H](c1cccc(OC)c1)N1CCCC1)c1ccccc1 ZINC000303306581 854863187 /nfs/dbraw/zinc/86/31/87/854863187.db2.gz ZVNQNCDUNPJWOL-RPWUZVMVSA-N 0 3 409.574 4.031 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)NC[C@@H](O)c1ccc2ccccc2c1 ZINC000303354308 854888701 /nfs/dbraw/zinc/88/87/01/854888701.db2.gz GJEAOHROKUWUGD-NHCUHLMSSA-N 0 3 409.555 4.071 20 0 HIADHN CC(C)C(=O)Nc1ccc(CNC(=O)[C@H](C)N2CCC(Cc3ccccc3)CC2)cc1 ZINC000303450096 854949348 /nfs/dbraw/zinc/94/93/48/854949348.db2.gz DURFTIVMVSVCMN-FQEVSTJZSA-N 0 3 421.585 4.241 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)[C@H]1C[C@@H]1c1cccc(C(F)(F)F)c1 ZINC000303454027 854953281 /nfs/dbraw/zinc/95/32/81/854953281.db2.gz KEBKSASFZVIEEO-RTWAWAEBSA-N 0 3 402.460 4.374 20 0 HIADHN Cc1ccc(C)c(NC(=O)[C@@H](c2ccccc2)N2CCC[C@@H](CN3CCOCC3)C2)c1 ZINC000303499061 854987893 /nfs/dbraw/zinc/98/78/93/854987893.db2.gz YBLPVWRSFUKHJH-WIOPSUGQSA-N 0 3 421.585 4.027 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)c1cc(F)c(Cl)nc1Cl ZINC000303540954 855026660 /nfs/dbraw/zinc/02/66/60/855026660.db2.gz TZNVAWYZIPJUOY-UHFFFAOYSA-N 0 3 404.700 4.385 20 0 HIADHN COc1cc(CN(C)C[C@@H](O)COc2ccccc2C(F)(F)F)ccc1SC ZINC000303636165 855092699 /nfs/dbraw/zinc/09/26/99/855092699.db2.gz GUBBBEGLVVTOIQ-OAHLLOKOSA-N 0 3 415.477 4.308 20 0 HIADHN CC(C)(C)OC(=O)N1CCC(CN2CCC(C(F)(F)F)(C(F)(F)F)C2)CC1 ZINC000303641369 855098036 /nfs/dbraw/zinc/09/80/36/855098036.db2.gz BHUSATVCVJCJAI-UHFFFAOYSA-N 0 3 404.395 4.450 20 0 HIADHN Cc1cnn(-c2ccc(NC(=O)c3ccc(N4CCN(C(C)C)CC4)cc3)cc2F)c1 ZINC000303666804 855118921 /nfs/dbraw/zinc/11/89/21/855118921.db2.gz CJNMKGVKMUJFIK-UHFFFAOYSA-N 0 3 421.520 4.103 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)/C=C/c3ccnc4ccccc34)c(C)c2)CC1 ZINC000303732333 855157369 /nfs/dbraw/zinc/15/73/69/855157369.db2.gz ZREKSVPBNAWMOO-DHZHZOJOSA-N 0 3 400.526 4.337 20 0 HIADHN CCc1ccc([C@H]2COCCN2C(=O)NC[C@H](c2ccsc2)N(CC)CC)o1 ZINC000303828270 855228633 /nfs/dbraw/zinc/22/86/33/855228633.db2.gz ZCMVLRQSOQWSKF-RTBURBONSA-N 0 3 405.564 4.070 20 0 HIADHN COc1ccc([C@H](CNC(=O)[C@@H]2C[C@H]2c2cc(F)ccc2F)N2CCCC2)cc1 ZINC000303838841 855236539 /nfs/dbraw/zinc/23/65/39/855236539.db2.gz HYVDWSUAGQYHOG-DWLFOUALSA-N 0 3 400.469 4.030 20 0 HIADHN CN(C(=O)[C@H]1C[C@@H]1c1c(F)cccc1Cl)C1CCN(CCc2ccccn2)CC1 ZINC000303902359 855278146 /nfs/dbraw/zinc/27/81/46/855278146.db2.gz STVKWKIKUDVJGI-OALUTQOASA-N 0 3 415.940 4.143 20 0 HIADHN CN(C(=O)c1cc(Br)cnc1Cl)C1CCN(Cc2ccccc2)CC1 ZINC000311053180 855369252 /nfs/dbraw/zinc/36/92/52/855369252.db2.gz XPHOPKGRTTXJJU-UHFFFAOYSA-N 0 3 422.754 4.234 20 0 HIADHN CC(C)(C)OC(=O)N[C@H](CNCc1cnn(Cc2ccccc2)c1)c1ccccc1 ZINC000378925681 855424101 /nfs/dbraw/zinc/42/41/01/855424101.db2.gz SQCZMPJRRNLVQF-JOCHJYFZSA-N 0 3 406.530 4.287 20 0 HIADHN C[C@@H]1CCN(C(=O)c2ccc(F)c(Br)c2)CCN1Cc1ccccc1 ZINC000383049973 855435875 /nfs/dbraw/zinc/43/58/75/855435875.db2.gz IFBYGKHIQYFULY-OAHLLOKOSA-N 0 3 405.311 4.325 20 0 HIADHN C[C@H]1[C@H](NC(=O)c2cc(Cl)ccc2Br)CCN1Cc1ccccc1 ZINC000383542408 855438733 /nfs/dbraw/zinc/43/87/33/855438733.db2.gz URLDEZQFNWFRKR-SCLBCKFNSA-N 0 3 407.739 4.495 20 0 HIADHN COc1ccc(C(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)cc1Br ZINC000388623079 855447514 /nfs/dbraw/zinc/44/75/14/855447514.db2.gz ZXUIKCGSBCUJPP-GOSISDBHSA-N 0 3 417.347 4.194 20 0 HIADHN C[C@H]1C[C@@H](NCc2cccc(F)c2Br)CCN1C(=O)OC(C)(C)C ZINC000394620403 855470850 /nfs/dbraw/zinc/47/08/50/855470850.db2.gz XIMHTQQEQLHKSV-JSGCOSHPSA-N 0 3 401.320 4.466 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)c1c(F)cccc1Br ZINC000398067065 855474854 /nfs/dbraw/zinc/47/48/54/855474854.db2.gz ICIDFRYIKNIEPA-SFHVURJKSA-N 0 3 407.327 4.475 20 0 HIADHN CC[C@@H](C(=O)N1CCC(NC(=O)Nc2cccc(CN(C)C)c2)CC1)c1ccccc1 ZINC000409547375 855536778 /nfs/dbraw/zinc/53/67/78/855536778.db2.gz IOMSDXDYWZAECC-HSZRJFAPSA-N 0 3 422.573 4.055 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)[C@H]1CCCc2nn(C)cc21)c1ccc(C(F)(F)F)cc1 ZINC000409572085 855545939 /nfs/dbraw/zinc/54/59/39/855545939.db2.gz AVQKHEFSZZVZLB-PXNSSMCTSA-N 0 3 422.495 4.058 20 0 HIADHN O=C(NCCCCN1CCN(Cc2ccccc2)CC1)Nc1ccc(Cl)cc1F ZINC000409714181 855616811 /nfs/dbraw/zinc/61/68/11/855616811.db2.gz JFKMYFOPNYEJDO-UHFFFAOYSA-N 0 3 418.944 4.199 20 0 HIADHN CN(C(=O)c1ccc2c(c1)nc(C(F)F)n2C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000409791134 855656030 /nfs/dbraw/zinc/65/60/30/855656030.db2.gz PDYRHCMZFKXATJ-GOSISDBHSA-N 0 3 412.484 4.248 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)c2ccc3c(c2)nc(C(F)F)n3C)c1 ZINC000409846963 855685461 /nfs/dbraw/zinc/68/54/61/855685461.db2.gz VWCPZGDCHLFUCL-UHFFFAOYSA-N 0 3 400.473 4.023 20 0 HIADHN CCCN(C(=O)c1ccc(-c2ncon2)cc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000409909803 855718661 /nfs/dbraw/zinc/71/86/61/855718661.db2.gz VJNMTJQPCMTIET-JOCHJYFZSA-N 0 3 404.514 4.253 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)[C@H](C)c2ccc(C(F)(F)F)cc2)c1 ZINC000409983909 855762004 /nfs/dbraw/zinc/76/20/04/855762004.db2.gz ZDBKLSJXMFROMV-MRXNPFEDSA-N 0 3 408.464 4.408 20 0 HIADHN CCc1cc(C(=O)N(CCN(C)C)Cc2ccco2)c2c(CC(C)(C)C)noc2n1 ZINC000410007375 855776165 /nfs/dbraw/zinc/77/61/65/855776165.db2.gz RMCBZJMBFDGWLR-UHFFFAOYSA-N 0 3 412.534 4.171 20 0 HIADHN CC1CCN([C@@H](CNC(=O)Nc2ccc(Cl)c(C(N)=O)c2)c2cccs2)CC1 ZINC000410339895 855937381 /nfs/dbraw/zinc/93/73/81/855937381.db2.gz LUCKCPXTPMQUIW-KRWDZBQOSA-N 0 3 420.966 4.095 20 0 HIADHN C[C@H]1CN(c2ccc(CN[C@@H](Cc3cccnc3)c3cccc(Cl)c3)cn2)CCO1 ZINC000425949230 856014345 /nfs/dbraw/zinc/01/43/45/856014345.db2.gz GXHYIYGJXFQHQY-MBSDFSHPSA-N 0 3 422.960 4.429 20 0 HIADHN COC(=O)COc1cccc(CN[C@H](Cc2cccnc2)c2cccc(Cl)c2)c1 ZINC000426048454 856071715 /nfs/dbraw/zinc/07/17/15/856071715.db2.gz HISSHIVZCAYHPF-JOCHJYFZSA-N 0 3 410.901 4.360 20 0 HIADHN C[C@@H](CCCC(F)(F)F)N[C@@H]1CCS(=O)(=O)c2ccc(Br)cc21 ZINC000426065374 856082871 /nfs/dbraw/zinc/08/28/71/856082871.db2.gz AVFLUXGWXUUPKM-GXFFZTMASA-N 0 3 414.287 4.378 20 0 HIADHN COc1ccc(NC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)c2cccnc12 ZINC000426108872 856112648 /nfs/dbraw/zinc/11/26/48/856112648.db2.gz JTYGFSJLCWOBAM-SFHVURJKSA-N 0 3 404.514 4.372 20 0 HIADHN Cc1c(NC(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@H]2CO)cccc1C(F)(F)F ZINC000426143024 856137057 /nfs/dbraw/zinc/13/70/57/856137057.db2.gz KXJWNPFNBJXCQL-FXAWDEMLSA-N 0 3 421.463 4.018 20 0 HIADHN Cc1cc(CNC(=O)N2CCN(C3CCOCC3)C[C@H]2C)ccc1-c1ccccc1 ZINC000426210753 856178516 /nfs/dbraw/zinc/17/85/16/856178516.db2.gz NSRLQLXLUXTNDG-HXUWFJFHSA-N 0 3 407.558 4.057 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N[C@H]1CCOC2(CCCCC2)C1)c1cccc(OC)c1 ZINC000426231487 856190836 /nfs/dbraw/zinc/19/08/36/856190836.db2.gz ILPHJSAVQOHNMV-UNMCSNQZSA-N 0 3 417.594 4.259 20 0 HIADHN C[C@@H](N[C@H]1c2cc(Br)ccc2CC1(C)C)c1cccc(S(N)(=O)=O)c1 ZINC000426331994 856249907 /nfs/dbraw/zinc/24/99/07/856249907.db2.gz BRJUTPJKDYEKMI-XIKOKIGWSA-N 0 3 423.376 4.071 20 0 HIADHN COc1cc(CN(C)C/C(C)=C/c2ccccc2)ccc1OCC(=O)N1CCCC1 ZINC000426379425 856266032 /nfs/dbraw/zinc/26/60/32/856266032.db2.gz JDDBCZMKJSWOAU-HMMYKYKNSA-N 0 3 408.542 4.232 20 0 HIADHN CCOc1ccc(NC(=O)c2ccc(NC(=O)CN3CC[C@@H]4CCC[C@@H]43)cc2)cc1 ZINC000426464843 856304711 /nfs/dbraw/zinc/30/47/11/856304711.db2.gz YGLSWHSDKBDYPB-JTSKRJEESA-N 0 3 407.514 4.151 20 0 HIADHN O=C(N[C@H]1CCN(C2CC2)C1)N(Cc1ccccc1Br)C1CCCC1 ZINC000426466650 856306596 /nfs/dbraw/zinc/30/65/96/856306596.db2.gz GUADOWQAGIUSKK-INIZCTEOSA-N 0 3 406.368 4.140 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)N[C@H]1CCOC2(CCCCC2)C1 ZINC000426501966 856321867 /nfs/dbraw/zinc/32/18/67/856321867.db2.gz WDGOLIMXHJXEEW-QFIPXVFZSA-N 0 3 401.595 4.074 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3nc4ccccc4s3)CC2)C[C@H](C)O1 ZINC000426633815 856384938 /nfs/dbraw/zinc/38/49/38/856384938.db2.gz JIWJMUVOXFRJHS-IYBDPMFKSA-N 0 3 402.564 4.040 20 0 HIADHN COc1ccccc1[C@@H](NC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1)c1ccco1 ZINC000426773744 856470198 /nfs/dbraw/zinc/47/01/98/856470198.db2.gz LIFCLLONGSTPSM-GBXCKJPGSA-N 0 3 419.525 4.294 20 0 HIADHN COc1ccccc1[C@H](NC(=O)N(CCN(C)C)Cc1ccc(C)o1)c1ccco1 ZINC000426777454 856473038 /nfs/dbraw/zinc/47/30/38/856473038.db2.gz NMCLKTIIAQDUKL-QFIPXVFZSA-N 0 3 411.502 4.052 20 0 HIADHN COc1ccccc1[C@@H](NC(=O)N(CCN(C)C)Cc1cccc(C)c1)c1ccco1 ZINC000426800147 856485930 /nfs/dbraw/zinc/48/59/30/856485930.db2.gz MYMLDYODPKWEFL-XMMPIXPASA-N 0 3 421.541 4.459 20 0 HIADHN CCc1c(C(=O)Nc2ccc(CCN3CCSCC3)cc2)cnn1CCC(C)C ZINC000426917658 856540793 /nfs/dbraw/zinc/54/07/93/856540793.db2.gz VRFUOFYOAJUXLS-UHFFFAOYSA-N 0 3 414.619 4.335 20 0 HIADHN COc1cccc(-c2c[nH]cc2C(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)c1 ZINC000437468121 862830186 /nfs/dbraw/zinc/83/01/86/862830186.db2.gz BHIBDJYJFRHEAR-LJQANCHMSA-N 0 3 403.526 4.427 20 0 HIADHN O=C(CCCCCc1ccc(F)cc1)NCc1ccccc1CN1CCC(O)CC1 ZINC000427254130 856737939 /nfs/dbraw/zinc/73/79/39/856737939.db2.gz WSVQLLAGAGORRE-UHFFFAOYSA-N 0 3 412.549 4.202 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3cccc(Oc4ccncc4)c3)CC2)C[C@H](C)O1 ZINC000427286734 856752622 /nfs/dbraw/zinc/75/26/22/856752622.db2.gz GZPFXYOPCMETSI-BGYRXZFFSA-N 0 3 423.557 4.225 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3ccc(Oc4ccccc4)nc3)CC2)C[C@@H](C)O1 ZINC000427289614 856753549 /nfs/dbraw/zinc/75/35/49/856753549.db2.gz VWBCWTUJZPQNGZ-WOJBJXKFSA-N 0 3 423.557 4.225 20 0 HIADHN Cc1ccc(CCCCC(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)cc1 ZINC000427292483 856755052 /nfs/dbraw/zinc/75/50/52/856755052.db2.gz QSBXNZOFRDROQA-SZPZYZBQSA-N 0 3 400.607 4.446 20 0 HIADHN Cc1nc(CC(C)C)sc1C(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000427291379 856755504 /nfs/dbraw/zinc/75/55/04/856755504.db2.gz FTVUISIIGSPJNQ-CALCHBBNSA-N 0 3 407.624 4.002 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3c(Cl)c4ccccc4n3C)CC2)C[C@H](C)O1 ZINC000427293945 856756271 /nfs/dbraw/zinc/75/62/71/856756271.db2.gz BPJQHYMFSTWHFD-CALCHBBNSA-N 0 3 417.981 4.183 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)[C@@H]3CCC[C@H](C(F)(F)F)C3)CC2)C[C@@H](C)O1 ZINC000427297432 856758071 /nfs/dbraw/zinc/75/80/71/856758071.db2.gz STPGAAYSAJAXTN-RWQQGDIJSA-N 0 3 404.517 4.093 20 0 HIADHN C[C@@H]1C[C@H]1C(=O)Nc1ccc(C(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)cc1 ZINC000437471770 862833115 /nfs/dbraw/zinc/83/31/15/862833115.db2.gz XDEBKWZMQFQROO-DNVFCKCGSA-N 0 3 405.542 4.018 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3ccc(Cl)c4cccnc34)CC2)C[C@H](C)O1 ZINC000427299574 856760008 /nfs/dbraw/zinc/76/00/08/856760008.db2.gz OHYHJXURYXKTHG-CALCHBBNSA-N 0 3 415.965 4.240 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)[C@@H]3C[C@@]34CCCc3ccccc34)CC2)C[C@H](C)O1 ZINC000427308546 856763218 /nfs/dbraw/zinc/76/32/18/856763218.db2.gz OGFUULZWMOAIKP-PEJASQCSSA-N 0 3 410.602 4.019 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3ccc(Oc4cccnc4)cc3)CC2)C[C@H](C)O1 ZINC000427321954 856769883 /nfs/dbraw/zinc/76/98/83/856769883.db2.gz RUBSMIUZVKUPCT-BGYRXZFFSA-N 0 3 423.557 4.225 20 0 HIADHN CC[C@@H](Sc1ccccc1)C(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000427323295 856771508 /nfs/dbraw/zinc/77/15/08/856771508.db2.gz XBPHCENFGXOUTB-XQBPLPMBSA-N 0 3 404.620 4.295 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)CCCOc3ccccc3Cl)CC2)C[C@@H](C)O1 ZINC000427331245 856774599 /nfs/dbraw/zinc/77/45/99/856774599.db2.gz OXZLWYGLYUOPLR-RTBURBONSA-N 0 3 422.997 4.237 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)c3cc(F)c(Cl)cc3Cl)CC2)C[C@H](C)O1 ZINC000427333073 856776430 /nfs/dbraw/zinc/77/64/30/856776430.db2.gz XAWAEJMDNTZARS-KBPBESRZSA-N 0 3 417.352 4.484 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)c2ccc(-c3nc(C4CC4)no3)cc2)c1 ZINC000427351149 856786105 /nfs/dbraw/zinc/78/61/05/856786105.db2.gz XYTYZXGXSUKBDR-UHFFFAOYSA-N 0 3 404.514 4.126 20 0 HIADHN CC(C)CC(=O)N[C@H](C(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1)c1ccccc1 ZINC000437477070 862837209 /nfs/dbraw/zinc/83/72/09/862837209.db2.gz RYMDZZHMBUKJCG-OFVILXPXSA-N 0 3 421.585 4.013 20 0 HIADHN COc1ccccc1-c1csc(C2CCN(C(=O)[C@@H]3CCCN3C3CC3)CC2)n1 ZINC000427444695 856822831 /nfs/dbraw/zinc/82/28/31/856822831.db2.gz SSBWFBSUKMGKIX-FQEVSTJZSA-N 0 3 411.571 4.152 20 0 HIADHN CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)c1cc(-c2ccc(Cl)cc2)c[nH]1 ZINC000427502897 856843582 /nfs/dbraw/zinc/84/35/82/856843582.db2.gz WFMQMCLWYSUJRT-AVRDEDQJSA-N 0 3 408.933 4.495 20 0 HIADHN C[C@@H](NC1CCN(C(=O)c2ccccc2F)CC1)c1ncc(Br)cc1F ZINC000427601024 856883957 /nfs/dbraw/zinc/88/39/57/856883957.db2.gz JMALVWWHUJJRSS-GFCCVEGCSA-N 0 3 424.289 4.078 20 0 HIADHN O=S(=O)(Nc1ccnc(N2CCc3ccccc3C2)c1)c1ccc(C(F)F)cc1 ZINC000427636111 856893376 /nfs/dbraw/zinc/89/33/76/856893376.db2.gz APRMDYZAIYYWAF-UHFFFAOYSA-N 0 3 415.465 4.383 20 0 HIADHN Fc1ccc(Br)cc1[C@H](N[C@@H]1CCn2ccnc2C1)c1ccccc1 ZINC000427875400 856990193 /nfs/dbraw/zinc/99/01/93/856990193.db2.gz SZKBVPLKGVEFMX-OXQOHEQNSA-N 0 3 400.295 4.479 20 0 HIADHN COc1ccc(NC(=O)C(Cc2c(C)cc(C)cc2C)C(F)(F)F)cc1NC(N)=O ZINC000427942661 857017135 /nfs/dbraw/zinc/01/71/35/857017135.db2.gz WAKKPIOCBLKTBQ-INIZCTEOSA-N 0 3 423.435 4.471 20 0 HIADHN Cc1ncc(C(=O)N2CCCN(CCCc3ccccc3)CC2)c(Cl)c1Cl ZINC000428033239 857050147 /nfs/dbraw/zinc/05/01/47/857050147.db2.gz QMFBVLXCJOFJSX-UHFFFAOYSA-N 0 3 406.357 4.478 20 0 HIADHN CCCNC(=O)C1(NCc2cccc(NC(=O)c3ccc(OC)cc3)c2)CCCCC1 ZINC000428090292 857068711 /nfs/dbraw/zinc/06/87/11/857068711.db2.gz WMSRPPANFWUPOU-UHFFFAOYSA-N 0 3 423.557 4.266 20 0 HIADHN Cc1nc([C@@H]2CCCOC2)sc1C(=O)NC[C@H]1CCCN(Cc2cccs2)C1 ZINC000428200845 857109245 /nfs/dbraw/zinc/10/92/45/857109245.db2.gz QIVOXSHFNOINOF-IAGOWNOFSA-N 0 3 419.616 4.049 20 0 HIADHN CC[NH+](CC)CCN(CCC(F)(F)F)Cc1nc2c3ccccc3oc2c(=O)[n-]1 ZINC000437541193 862874947 /nfs/dbraw/zinc/87/49/47/862874947.db2.gz VGELGPWHQCSLLQ-UHFFFAOYSA-N 0 3 410.440 4.178 20 0 HIADHN OC[C@@H](CNCc1nc2ccc(F)cc2s1)Cc1ccccc1Br ZINC000428530451 857244731 /nfs/dbraw/zinc/24/47/31/857244731.db2.gz BFWFSIORWDNOHQ-GFCCVEGCSA-N 0 3 409.324 4.139 20 0 HIADHN Cc1ccc(C(=O)Nc2cccc(CN3CC[C@@H](O)C3)c2)c(Sc2ccccc2)n1 ZINC000428533302 857247773 /nfs/dbraw/zinc/24/77/73/857247773.db2.gz DERKIEOAIZSONU-HXUWFJFHSA-N 0 3 419.550 4.360 20 0 HIADHN COCCS(=O)(=O)c1ccc(CNCc2ccc(-c3cccc(F)c3)s2)cc1 ZINC000428537262 857249462 /nfs/dbraw/zinc/24/94/62/857249462.db2.gz LHAONCBVCLKFAV-UHFFFAOYSA-N 0 3 419.543 4.264 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)c1c[nH]cc1-c1ccc(Cl)s1 ZINC000428537988 857250780 /nfs/dbraw/zinc/25/07/80/857250780.db2.gz PAMXWLWPDWNHJV-HNNXBMFYSA-N 0 3 401.919 4.216 20 0 HIADHN O=C(CCOc1ccccc1-c1ccccc1)Nc1cccc(CN2CC[C@@H](O)C2)c1 ZINC000428538242 857251253 /nfs/dbraw/zinc/25/12/53/857251253.db2.gz WXXTUMJDLNOJSZ-HSZRJFAPSA-N 0 3 416.521 4.328 20 0 HIADHN OC[C@@H](CNCc1sccc1Br)Cc1ccccc1Br ZINC000428540829 857252626 /nfs/dbraw/zinc/25/26/26/857252626.db2.gz CYQBEWXWKYACRK-LLVKDONJSA-N 0 3 419.182 4.214 20 0 HIADHN CCCn1c2ccccc2nc1CNC[C@H](CO)Cc1ccc(Br)cc1 ZINC000428540657 857253425 /nfs/dbraw/zinc/25/34/25/857253425.db2.gz UXFPZEHGLGALJJ-QGZVFWFLSA-N 0 3 416.363 4.150 20 0 HIADHN Fc1ccc(-c2nc(CNC[C@H]3CN(Cc4ccccc4)CCCO3)cs2)cc1 ZINC000428543134 857254524 /nfs/dbraw/zinc/25/45/24/857254524.db2.gz GYZMHQWPVJJEQK-QFIPXVFZSA-N 0 3 411.546 4.330 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)C1(c2c(Cl)cccc2Cl)CC1 ZINC000428542448 857254613 /nfs/dbraw/zinc/25/46/13/857254613.db2.gz RETYUWYXOAIOAU-INIZCTEOSA-N 0 3 405.325 4.230 20 0 HIADHN Cc1ccc(C(=O)Nc2cccc(CN3CC[C@H](O)C3)c2)cc1Oc1ccncc1 ZINC000428553552 857262195 /nfs/dbraw/zinc/26/21/95/857262195.db2.gz XJHQXFCOVVGZPT-NRFANRHFSA-N 0 3 403.482 4.001 20 0 HIADHN O=C(CCCc1cccc(C(F)(F)F)c1)Nc1cccc(CN2CC[C@@H](O)C2)c1 ZINC000428555561 857264260 /nfs/dbraw/zinc/26/42/60/857264260.db2.gz YORVEDWBJPFCNS-HXUWFJFHSA-N 0 3 406.448 4.233 20 0 HIADHN COc1ccc(OCc2ccccn2)c(CNC[C@@]2(CO)C[C@@H]2c2ccc(F)cc2)c1 ZINC000428557888 857265017 /nfs/dbraw/zinc/26/50/17/857265017.db2.gz JYOWAYWMMDRXMS-ILBGXUMGSA-N 0 3 422.500 4.064 20 0 HIADHN CCCn1ccnc1CCCN(C)C(=O)NC[C@@H](c1ccc(C)cc1)N1CCCC1 ZINC000428559972 857266271 /nfs/dbraw/zinc/26/62/71/857266271.db2.gz QWJOZGBMZWZRHM-QFIPXVFZSA-N 0 3 411.594 4.013 20 0 HIADHN CC[C@H](NC(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1)c1cc(F)ccc1F ZINC000428584406 857272154 /nfs/dbraw/zinc/27/21/54/857272154.db2.gz VKSQOVKABYIYDH-KNQAVFIVSA-N 0 3 417.500 4.006 20 0 HIADHN CC[C@H](NC(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1)c1ccc(F)cc1F ZINC000428633648 857284204 /nfs/dbraw/zinc/28/42/04/857284204.db2.gz PXOZABSHSIOKBM-KNQAVFIVSA-N 0 3 417.500 4.006 20 0 HIADHN C[C@@H](CN1CCN(CCCc2nc(-c3cccs3)no2)CC1)c1ccc(F)cc1 ZINC000437575467 862894081 /nfs/dbraw/zinc/89/40/81/862894081.db2.gz FWUNXESBMNARES-KRWDZBQOSA-N 0 3 414.550 4.291 20 0 HIADHN CCN1CCCN(C(=O)NCc2ccc(Oc3ccccc3C(F)(F)F)nc2)CC1 ZINC000428701341 857301453 /nfs/dbraw/zinc/30/14/53/857301453.db2.gz RBKLPNVUMAIYAG-UHFFFAOYSA-N 0 3 422.451 4.130 20 0 HIADHN CCC(C)(C)OCc1cccc(NC(=O)N(CCN(C)C)C[C@@H]2CCCO2)c1C ZINC000428758505 857321386 /nfs/dbraw/zinc/32/13/86/857321386.db2.gz MJPCPXJJMVPXBY-FQEVSTJZSA-N 0 3 405.583 4.275 20 0 HIADHN CC(C)c1nnc(CN(Cc2ccncc2)[C@@H]2CCCN(Cc3ccccc3)C2)o1 ZINC000428800913 857349090 /nfs/dbraw/zinc/34/90/90/857349090.db2.gz DNMBIPOYSDVQDX-JOCHJYFZSA-N 0 3 405.546 4.255 20 0 HIADHN c1nc2ccccn2c1CN(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000428808261 857354072 /nfs/dbraw/zinc/35/40/72/857354072.db2.gz SMRLPYCQDCANHH-DEOSSOPVSA-N 0 3 411.553 4.396 20 0 HIADHN Cc1cccc(C)c1NC(=O)CN1CCN([C@H]2CC[C@@](C)(c3ccccc3)C2)CC1 ZINC000437590494 862902192 /nfs/dbraw/zinc/90/21/92/862902192.db2.gz MMKOIYOKNSZCRL-JYFHCDHNSA-N 0 3 405.586 4.370 20 0 HIADHN OC[C@H](CNCc1nc2ccc(F)cc2s1)Cc1ccc(OC(F)(F)F)cc1 ZINC000428866075 857377193 /nfs/dbraw/zinc/37/71/93/857377193.db2.gz YCXREPGOWOZGKH-ZDUSSCGKSA-N 0 3 414.424 4.275 20 0 HIADHN C[C@@H](c1ccccc1)[C@@H](NCc1c(-c2ccc(Cl)cc2)nc2sccn21)C(N)=O ZINC000428866334 857378776 /nfs/dbraw/zinc/37/87/76/857378776.db2.gz YLVIDKZOTISZAO-IFXJQAMLSA-N 0 3 424.957 4.463 20 0 HIADHN C[C@@H](NC(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1)c1ccc(Cl)s1 ZINC000428912706 857410095 /nfs/dbraw/zinc/41/00/95/857410095.db2.gz KJJYVZBDYXDPKM-OWCLPIDISA-N 0 3 414.015 4.383 20 0 HIADHN CO[C@H](C)c1nc(CNC(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)cs1 ZINC000428918603 857414593 /nfs/dbraw/zinc/41/45/93/857414593.db2.gz GOUCZJUHZSNRRM-NVXWUHKLSA-N 0 3 422.620 4.184 20 0 HIADHN C[C@@H](c1ccccc1Cl)N(C)C(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000429007419 857454722 /nfs/dbraw/zinc/45/47/22/857454722.db2.gz KAWUTAWXDWHBFE-AZUAARDMSA-N 0 3 415.965 4.334 20 0 HIADHN Cc1ccc([C@H]2CCCN2C(=O)NC[C@@H]2CN(Cc3ccccc3)CCCO2)s1 ZINC000429020283 857461241 /nfs/dbraw/zinc/46/12/41/857461241.db2.gz LEMNPHHRMVYKPW-NHCUHLMSSA-N 0 3 413.587 4.194 20 0 HIADHN CN(Cc1csc2ccccc12)C(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000429026052 857463121 /nfs/dbraw/zinc/46/31/21/857463121.db2.gz ZFILIVWGLWEMRF-NRFANRHFSA-N 0 3 423.582 4.334 20 0 HIADHN O=C(NC[C@H]1CN(Cc2ccccc2)CCCO1)N(Cc1ccco1)C1CCCC1 ZINC000429035677 857467741 /nfs/dbraw/zinc/46/77/41/857467741.db2.gz OQPHJCGXJDXLJL-QHCPKHFHSA-N 0 3 411.546 4.025 20 0 HIADHN O=C(NC[C@H]1CN(Cc2ccccc2)CCCO1)N1CCCCC[C@H]1c1ccco1 ZINC000429049217 857477364 /nfs/dbraw/zinc/47/73/64/857477364.db2.gz BGJWPMHIUVGUQV-VXKWHMMOSA-N 0 3 411.546 4.197 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)N[C@@H](c3cccs3)C3CC3)CC2)C[C@H](C)O1 ZINC000429210403 857556013 /nfs/dbraw/zinc/55/60/13/857556013.db2.gz YCIPOYIQWRAZFK-LLGFUMIMSA-N 0 3 405.608 4.120 20 0 HIADHN COc1ccc2cc(CN(C)C(=O)[C@H](C)N3CCC[C@@H](CSC)C3)ccc2c1 ZINC000429272891 857585267 /nfs/dbraw/zinc/58/52/67/857585267.db2.gz LMRBRUUTTOXARZ-PKOBYXMFSA-N 0 3 400.588 4.270 20 0 HIADHN CSC[C@H]1CCCN(CC(=O)N2CCc3sccc3[C@H]2c2ccccc2)C1 ZINC000429279972 857589093 /nfs/dbraw/zinc/58/90/93/857589093.db2.gz WMMXBVNEVSQSEJ-HTAPYJJXSA-N 0 3 400.613 4.297 20 0 HIADHN CSc1cccc(N(C(=O)c2ccc3c(c2)C(C)(C)C(=O)N3)C2CCN(C)CC2)c1 ZINC000429289607 857593520 /nfs/dbraw/zinc/59/35/20/857593520.db2.gz YBMLZFKXCWGCTK-UHFFFAOYSA-N 0 3 423.582 4.379 20 0 HIADHN O=C(CN[C@@H]1Cc2cccc(O)c2C1)N[C@H](c1ccccc1)c1ccc(Cl)cc1 ZINC000429302258 857595832 /nfs/dbraw/zinc/59/58/32/857595832.db2.gz RNMJSBQHAXGPJH-HYBUGGRVSA-N 0 3 406.913 4.008 20 0 HIADHN CCC1(CC)[C@H](NCC(=O)Nc2ccc(NC(=O)c3cccs3)cc2)C[C@H]1OC ZINC000429303463 857597806 /nfs/dbraw/zinc/59/78/06/857597806.db2.gz WIBNXFBVSWJLTH-RTBURBONSA-N 0 3 415.559 4.122 20 0 HIADHN CCO[C@@H]1C[C@H](NCC(=O)Nc2c(F)cc(F)cc2Br)C1(CC)CC ZINC000429329642 857604650 /nfs/dbraw/zinc/60/46/50/857604650.db2.gz AYYZGRDWIWKDEQ-LSDHHAIUSA-N 0 3 419.310 4.239 20 0 HIADHN OC[C@H](CN[C@@H](c1ccccc1)c1ccccn1)Cc1ccc(Br)cc1 ZINC000429417529 857655449 /nfs/dbraw/zinc/65/54/49/857655449.db2.gz GVCNJTIYJXPYDS-AVRDEDQJSA-N 0 3 411.343 4.374 20 0 HIADHN COCCS(=O)(=O)c1ccc(CN[C@@H](c2ccc(F)cc2)C2CCCC2)cc1 ZINC000429419712 857656636 /nfs/dbraw/zinc/65/66/36/857656636.db2.gz AJXYQWPKMRVBKV-JOCHJYFZSA-N 0 3 405.535 4.267 20 0 HIADHN Fc1ccc([C@@H](NC[C@H]2CN(Cc3ccccc3)CCCO2)c2cccnc2)cc1 ZINC000429445264 857673537 /nfs/dbraw/zinc/67/35/37/857673537.db2.gz FSBBLZKZQLRXJE-LOSJGSFVSA-N 0 3 405.517 4.191 20 0 HIADHN CC[C@H](NC(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1)c1cc(F)ccc1F ZINC000429449117 857676151 /nfs/dbraw/zinc/67/61/51/857676151.db2.gz RMIUQFDUMFCWGT-JKSBSHDWSA-N 0 3 423.548 4.337 20 0 HIADHN C[C@@H](NC[C@H](CO)Cc1cccc(Br)c1)c1nc2c(s1)CCCC2 ZINC000429456814 857679704 /nfs/dbraw/zinc/67/97/04/857679704.db2.gz RHSGZGHPAJNDJE-UKRRQHHQSA-N 0 3 409.393 4.286 20 0 HIADHN Cc1cccc([C@H](C)CNC(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)c1 ZINC000429460488 857683049 /nfs/dbraw/zinc/68/30/49/857683049.db2.gz YYARLBZMZGSWLJ-HKBOAZHASA-N 0 3 401.595 4.019 20 0 HIADHN Cc1c(CNC(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)oc2ccccc12 ZINC000429486624 857692490 /nfs/dbraw/zinc/69/24/90/857692490.db2.gz DCVYUNWMZPQIJQ-HDICACEKSA-N 0 3 413.562 4.162 20 0 HIADHN CC(C(=O)N1CC(C)CN(C(=O)[C@H](C)C(F)(F)F)c2ccccc21)C(F)(F)F ZINC000429526116 857718396 /nfs/dbraw/zinc/71/83/96/857718396.db2.gz GJHFZJGQWTZJBM-RYUDHWBXSA-N 0 3 410.358 4.399 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1ccnn1Cc1ccc(F)cc1 ZINC000429567900 857753784 /nfs/dbraw/zinc/75/37/84/857753784.db2.gz HOAQGQRLEYMXEX-IBGZPJMESA-N 0 3 421.520 4.199 20 0 HIADHN O=C(c1ccc(F)cc1)[C@@H]1CCCN(C[C@@H]2CN(Cc3ccccc3)CCCO2)C1 ZINC000429683750 857833416 /nfs/dbraw/zinc/83/34/16/857833416.db2.gz RFYKEWCMFPYOJA-VWNXMTODSA-N 0 3 410.533 4.012 20 0 HIADHN c1cc2n(c1)CCN(C[C@H]1CN(Cc3ccccc3)CCCO1)[C@@H]2c1ccccc1 ZINC000429684451 857833563 /nfs/dbraw/zinc/83/35/63/857833563.db2.gz MQHFAYPFRKDIPP-AOYPEHQESA-N 0 3 401.554 4.184 20 0 HIADHN c1cc2n(c1)CCN(C[C@@H]1CN(Cc3ccccc3)CCCO1)[C@@H]2c1ccccc1 ZINC000429684455 857833698 /nfs/dbraw/zinc/83/36/98/857833698.db2.gz MQHFAYPFRKDIPP-AZGAKELHSA-N 0 3 401.554 4.184 20 0 HIADHN C[C@H](c1cc(Cl)ccc1Cl)n1nccc1NC(=O)N1CC[C@H]2CCN(C)C[C@@H]21 ZINC000429718217 857848907 /nfs/dbraw/zinc/84/89/07/857848907.db2.gz JFPAMNJUIFZMLD-LBTNJELSSA-N 0 3 422.360 4.357 20 0 HIADHN COC(=O)c1c(CN[C@@H]2CCC[C@H]2CCO)nc2ccccc2c1-c1ccccc1 ZINC000429775466 857880292 /nfs/dbraw/zinc/88/02/92/857880292.db2.gz PHWUSQDMASQAOB-FXAWDEMLSA-N 0 3 404.510 4.329 20 0 HIADHN O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)Nc1ccccc1CC(F)(F)F ZINC000429776350 857882065 /nfs/dbraw/zinc/88/20/65/857882065.db2.gz RICFGHXBRUHWCW-LJQANCHMSA-N 0 3 421.463 4.204 20 0 HIADHN O=C(NC1CC1)[C@H](N[C@H]1C[C@H](c2ccc(F)c(Br)c2)C1)c1ccccc1 ZINC000429806207 857890604 /nfs/dbraw/zinc/89/06/04/857890604.db2.gz HDSWPZLHDASANK-WRWLIDTKSA-N 0 3 417.322 4.444 20 0 HIADHN C[C@@H](C(=O)N(CCN(C)C)Cc1cccc(Cl)c1)[C@H]1OCCc2sccc21 ZINC000429804517 857890863 /nfs/dbraw/zinc/89/08/63/857890863.db2.gz CZJSGNKRWLLUQW-FOIQADDNSA-N 0 3 406.979 4.242 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)[C@H](C)[C@H]3OCCc4sccc43)c(C)c2)CC1 ZINC000429845860 857908344 /nfs/dbraw/zinc/90/83/44/857908344.db2.gz KWOKVRDLRUTGNW-VGOFRKELSA-N 0 3 413.587 4.087 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)[C@@H](C)[C@@H]3OCCc4sccc43)c(C)c2)CC1 ZINC000429845857 857908549 /nfs/dbraw/zinc/90/85/49/857908549.db2.gz KWOKVRDLRUTGNW-JTSKRJEESA-N 0 3 413.587 4.087 20 0 HIADHN Cc1cc(Br)cc(Cl)c1NS(=O)(=O)c1ccc(CN(C)C)cc1 ZINC000430069780 858019436 /nfs/dbraw/zinc/01/94/36/858019436.db2.gz ZTXLPBNUCHGSJL-UHFFFAOYSA-N 0 3 417.756 4.273 20 0 HIADHN Cc1ccc(NC(=O)C[C@@H](C)N[C@@H](CO)c2ccc(Br)c(F)c2)c(C)c1 ZINC000430125248 858043404 /nfs/dbraw/zinc/04/34/04/858043404.db2.gz MGOCZPDZAAIGRQ-KUHUBIRLSA-N 0 3 423.326 4.245 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)NCCCCCc2ccc(F)cc2)CC1 ZINC000430190914 858074167 /nfs/dbraw/zinc/07/41/67/858074167.db2.gz IAZARTOXWKOTHV-UHFFFAOYSA-N 0 3 401.526 4.438 20 0 HIADHN COC(=O)CCn1nc(C)c(CN2CC[C@H](Sc3cccc(Cl)c3)C2)c1C ZINC000430198312 858077830 /nfs/dbraw/zinc/07/78/30/858077830.db2.gz RBLRNPNDTYOYSO-SFHVURJKSA-N 0 3 407.967 4.083 20 0 HIADHN COc1ccccc1-c1ncc(CN(CCCO)[C@@H]2CCCc3ccccc32)cn1 ZINC000430243084 858094657 /nfs/dbraw/zinc/09/46/57/858094657.db2.gz TUUQFYBEVYEZKG-HSZRJFAPSA-N 0 3 403.526 4.414 20 0 HIADHN C[C@@H]1C[C@@]2(CCO1)CN(CCC(=O)Nc1ccc(Oc3ccccc3)cc1)C[C@H](C)O2 ZINC000430259863 858099322 /nfs/dbraw/zinc/09/93/22/858099322.db2.gz FXVLARLGOIONRO-RNHFSVANSA-N 0 3 424.541 4.466 20 0 HIADHN C[C@H]1CCN(C)CCN1C(=O)N[C@@H](CC1CC1)c1cc(F)cc(Br)c1 ZINC000430289779 858109951 /nfs/dbraw/zinc/10/99/51/858109951.db2.gz LMFILFHHSVLYLH-UGSOOPFHSA-N 0 3 412.347 4.165 20 0 HIADHN CCn1ccnc1[C@H]1CCCCN1C(=O)Nc1ccc(N2CCN(CC)CC2)cc1C ZINC000430351490 858130756 /nfs/dbraw/zinc/13/07/56/858130756.db2.gz JEHVYMKMWOASFG-JOCHJYFZSA-N 0 3 424.593 4.112 20 0 HIADHN O=C(CO[C@@H]1CCCc2ccccc21)Nc1ccc(CCN2CCSCC2)cc1 ZINC000430414563 858150227 /nfs/dbraw/zinc/15/02/27/858150227.db2.gz COQULLYJFVXWTC-HSZRJFAPSA-N 0 3 410.583 4.311 20 0 HIADHN C[C@@H]1CN(Cc2ccc(-n3ccc(C(F)(F)F)n3)cc2)C[C@@]2(CCO[C@H](C)C2)O1 ZINC000430766183 858295905 /nfs/dbraw/zinc/29/59/05/858295905.db2.gz KQFBXWHEXORBMZ-QINHECLXSA-N 0 3 409.452 4.050 20 0 HIADHN CC[C@@H](c1ccccc1)N1CC(=O)N(CC(C)(C)N2CCc3ccccc3C2)C1=O ZINC000430847669 858331270 /nfs/dbraw/zinc/33/12/70/858331270.db2.gz ZJOAZGCASBDOPC-QFIPXVFZSA-N 0 3 405.542 4.239 20 0 HIADHN COc1cccc([C@H](CNC(=O)Cc2c[nH]c3cccc(Cl)c23)N2CCCC2)c1 ZINC000430892591 858357695 /nfs/dbraw/zinc/35/76/95/858357695.db2.gz AKSNSNPSBKBPJC-NRFANRHFSA-N 0 3 411.933 4.326 20 0 HIADHN C[C@@H](NC(=O)N1CCC[C@H]1c1ccc(Br)c(F)c1)C1=CCN(C)CC1 ZINC000430892267 858357862 /nfs/dbraw/zinc/35/78/62/858357862.db2.gz CLTBPBUDDFCSDU-ACJLOTCBSA-N 0 3 410.331 4.085 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](N2C(=O)N[C@@H](c3ccc(Cl)cc3Cl)C2=O)C1 ZINC000431031840 858410402 /nfs/dbraw/zinc/41/04/02/858410402.db2.gz DUQGZECKOGRLPL-NRXGSXMXSA-N 0 3 418.324 4.422 20 0 HIADHN CN(Cc1cccnc1)C[C@@H]1CCN(C(=O)N[C@@H]2CC[C@H](c3ccccc3F)C2)C1 ZINC000431056774 858423379 /nfs/dbraw/zinc/42/33/79/858423379.db2.gz LQXWYEGWVXNIHW-PCCBWWKXSA-N 0 3 410.537 4.020 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)N[C@@H]3C[C@H]3c3cccc4ccccc43)CC2)C[C@@H](C)O1 ZINC000431057830 858425051 /nfs/dbraw/zinc/42/50/51/858425051.db2.gz PLISXXOGTHBEMH-ZSVMJGIMSA-N 0 3 421.585 4.227 20 0 HIADHN CC[NH+](CC)C[C@H]1CCCC[C@H]1NC(=O)Nc1ccc(-c2cc(=O)[n-]c(C)n2)cc1 ZINC000431078532 858437158 /nfs/dbraw/zinc/43/71/58/858437158.db2.gz UKDMIMYXOSQFHI-UYAOXDASSA-N 0 3 411.550 4.180 20 0 HIADHN CN(C[C@@H](O)COCC(F)(F)F)[C@@H](c1ccc(F)cc1)c1ccc(Cl)cc1 ZINC000431125956 858457679 /nfs/dbraw/zinc/45/76/79/858457679.db2.gz DRSNCQVBKBXFJB-QZTJIDSGSA-N 0 3 405.819 4.440 20 0 HIADHN CCc1noc(-c2ccc(C)c(NC(=O)N[C@@H]3CCCN(Cc4ccccc4)C3)c2)n1 ZINC000431132149 858461203 /nfs/dbraw/zinc/46/12/03/858461203.db2.gz IUXSBTXOZHLGRH-HXUWFJFHSA-N 0 3 419.529 4.394 20 0 HIADHN CC[C@@H](c1ccccc1)N1CC(=O)N(C[C@H]2CCCN(Cc3cccs3)C2)C1=O ZINC000431172477 858486341 /nfs/dbraw/zinc/48/63/41/858486341.db2.gz XKIZQJKLUKEHFH-RXVVDRJESA-N 0 3 411.571 4.376 20 0 HIADHN COc1ccc2nc(NC(=O)N3CC[C@H](C)N(Cc4ccccc4)CC3)sc2c1 ZINC000437705559 863037582 /nfs/dbraw/zinc/03/75/82/863037582.db2.gz AXEOBLIYBMWRAX-INIZCTEOSA-N 0 3 410.543 4.433 20 0 HIADHN C[C@@H]1CN(Cc2cccc(CN[C@@H]3CCCOc4cc5c(cc43)CCC5)c2)CCO1 ZINC000431328768 858567790 /nfs/dbraw/zinc/56/77/90/858567790.db2.gz OSYZCAPCDQSYPX-KBMIEXCESA-N 0 3 406.570 4.400 20 0 HIADHN COc1cnccc1N1CCN(C(=O)Nc2cc(C(F)(F)F)ccc2Cl)CC1 ZINC000431441041 858616540 /nfs/dbraw/zinc/61/65/40/858616540.db2.gz OLZRKMYWRAJJDM-UHFFFAOYSA-N 0 3 414.815 4.117 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)Cc2cccc(OCC(F)(F)F)c2)C1 ZINC000431468011 858631261 /nfs/dbraw/zinc/63/12/61/858631261.db2.gz BGUKPVJKIWGFKZ-QFBILLFUSA-N 0 3 406.448 4.122 20 0 HIADHN O=C(NCCCN(Cc1ccccc1)Cc1ccccc1)C1C[C@H]2CC[C@@H](C1)C2=O ZINC000431475852 858635030 /nfs/dbraw/zinc/63/50/30/858635030.db2.gz HDKDOULUKRUIBM-VSGJHWFKSA-N 0 3 404.554 4.200 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)Cc2cccc(OCC(F)(F)F)c2)CC1 ZINC000431489715 858641835 /nfs/dbraw/zinc/64/18/35/858641835.db2.gz ZQSUGMAQLNWXFW-UHFFFAOYSA-N 0 3 420.475 4.293 20 0 HIADHN CCc1noc(-c2ccc(C)c(NC(=O)c3ccc(N4CCN(CC)CC4)cc3)c2)n1 ZINC000431500525 858645272 /nfs/dbraw/zinc/64/52/72/858645272.db2.gz AHJLFSWNRQMFHG-UHFFFAOYSA-N 0 3 419.529 4.002 20 0 HIADHN C[C@H]1CN(CCCCNC(=O)c2ccc3c(ccn3Cc3ccccc3)c2)C[C@H](C)O1 ZINC000431837981 858834712 /nfs/dbraw/zinc/83/47/12/858834712.db2.gz OLAOMPROJHTAFS-SFTDATJTSA-N 0 3 419.569 4.309 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)C1CC1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000431910962 858866811 /nfs/dbraw/zinc/86/68/11/858866811.db2.gz GAGPJNWZYQRSJZ-MHJFOBGBSA-N 0 3 409.496 4.285 20 0 HIADHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc(COc2c(Cl)cccc2Cl)on1 ZINC000467542120 881363985 /nfs/dbraw/zinc/36/39/85/881363985.db2.gz XVNYLBALWHOTJG-KGLIPLIRSA-N 0 3 424.328 4.259 20 0 HIADHN COc1cnccc1N1CCN(C(=O)Nc2cccc(CSC(C)C)c2C)CC1 ZINC000432127434 859004854 /nfs/dbraw/zinc/00/48/54/859004854.db2.gz SYBZOSIIAWZEPB-UHFFFAOYSA-N 0 3 414.575 4.394 20 0 HIADHN Cc1cc(NC(=O)N[C@@H]2C[C@@H]2c2ccccc2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000432276914 859080777 /nfs/dbraw/zinc/08/07/77/859080777.db2.gz KRJFNYFDVWNDGU-DNVJHFABSA-N 0 3 415.541 4.316 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)NC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)cc1 ZINC000432329357 859105892 /nfs/dbraw/zinc/10/58/92/859105892.db2.gz OSWSOABNXOQXSU-GCJKJVERSA-N 0 3 420.532 4.409 20 0 HIADHN COCC[C@H]1CCCCN(C(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)C1 ZINC000467559356 881383409 /nfs/dbraw/zinc/38/34/09/881383409.db2.gz GDVYKZXTXCDOCM-WOJBJXKFSA-N 0 3 407.624 4.369 20 0 HIADHN O=C(NCc1cccc(-c2cccnc2)c1)NC[C@H](c1cccs1)N1CCCC1 ZINC000467565660 881387459 /nfs/dbraw/zinc/38/74/59/881387459.db2.gz VANHXRWJTIDGFF-OAQYLSRUSA-N 0 3 406.555 4.446 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)C2(Cc3ccc(F)cc3)CCOCC2)C1 ZINC000432420150 859156252 /nfs/dbraw/zinc/15/62/52/859156252.db2.gz JEEOWQIMZHXYQJ-CVDCTZTESA-N 0 3 410.533 4.117 20 0 HIADHN COc1ccc(-c2cncc(C(=O)N3CC[C@@H](C)N(Cc4ccccc4)CC3)c2)cc1 ZINC000467580448 881395805 /nfs/dbraw/zinc/39/58/05/881395805.db2.gz VMVNRBJYHRWRQC-HXUWFJFHSA-N 0 3 415.537 4.494 20 0 HIADHN O=C(CO[C@H]1CCCc2ccccc21)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000432719312 859317452 /nfs/dbraw/zinc/31/74/52/859317452.db2.gz NERVJNKFUHKMGA-QLOJAFMTSA-N 0 3 410.480 4.002 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@H](C)N[C@@H](C)c2cc(C(=O)OC)c(C)o2)CC1 ZINC000432780858 859356828 /nfs/dbraw/zinc/35/68/28/859356828.db2.gz IXUNIAMLWHUISM-HOTGVXAUSA-N 0 3 417.525 4.067 20 0 HIADHN Cc1noc(C)c1NC(=O)N(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000432818037 859373459 /nfs/dbraw/zinc/37/34/59/859373459.db2.gz DAIOHGAQZXAKOS-QFIPXVFZSA-N 0 3 419.529 4.385 20 0 HIADHN Cc1ccc(CNC(=O)c2cccc(CN3CCCC3)c2)c(OC[C@H]2CCCO2)c1 ZINC000467626299 881427345 /nfs/dbraw/zinc/42/73/45/881427345.db2.gz XCTCBCQMSAOHHT-HSZRJFAPSA-N 0 3 408.542 4.079 20 0 HIADHN CC(=O)Nc1ccc(CN[C@H](c2cccc(Br)c2)C2CCOCC2)cn1 ZINC000433064144 859505804 /nfs/dbraw/zinc/50/58/04/859505804.db2.gz WBNXXENOCSKRJW-FQEVSTJZSA-N 0 3 418.335 4.060 20 0 HIADHN COc1ccc(-c2nc3c(s2)[C@@H](NCc2ccc(NC(C)=O)nc2)CCC3)cc1 ZINC000433097532 859520637 /nfs/dbraw/zinc/52/06/37/859520637.db2.gz NKYYYZPWKPENTI-SFHVURJKSA-N 0 3 408.527 4.339 20 0 HIADHN O=C(Nc1cccc(CNC[C@@H]2CCCC(=O)N2)c1)c1ccc(Cl)cc1Cl ZINC000433196665 859563357 /nfs/dbraw/zinc/56/33/57/859563357.db2.gz LSNMVIQQFXTFGR-INIZCTEOSA-N 0 3 406.313 4.004 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CC[C@@H](CC(F)(F)F)C1)c1cccc(OC)c1 ZINC000433566532 859782237 /nfs/dbraw/zinc/78/22/37/859782237.db2.gz UFYPMLPYFOKXSM-MAUKXSAKSA-N 0 3 401.473 4.062 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)Nc3ccc(Oc4ncc(Cl)cn4)c(Cl)c3)[C@H]2C1 ZINC000433670868 859832676 /nfs/dbraw/zinc/83/26/76/859832676.db2.gz SZQCHENCLWTCFX-WBMJQRKESA-N 0 3 422.316 4.134 20 0 HIADHN CCNC(=O)Nc1cccc(NC(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)c1C ZINC000433722677 859854084 /nfs/dbraw/zinc/85/40/84/859854084.db2.gz DKKLWMUGQRJAQA-FQEVSTJZSA-N 0 3 423.561 4.265 20 0 HIADHN CCNC(=O)Nc1cccc(NC(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)c1C ZINC000433744651 859871370 /nfs/dbraw/zinc/87/13/70/859871370.db2.gz LQILZVJEMHSFBL-HKUYNNGSSA-N 0 3 409.534 4.093 20 0 HIADHN CCNC(=O)Nc1cccc(NC(=O)NC[C@H](CC)N2CCc3ccccc3C2)c1C ZINC000433747199 859873062 /nfs/dbraw/zinc/87/30/62/859873062.db2.gz DOULTUMJJWESRQ-FQEVSTJZSA-N 0 3 423.561 4.095 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CCC(F)(c4ccccc4)CC3)c2)CC1 ZINC000433822683 859914201 /nfs/dbraw/zinc/91/42/01/859914201.db2.gz SWWBRHMLJCLXJI-UHFFFAOYSA-N 0 3 410.537 4.321 20 0 HIADHN O=C(Cc1cc(F)ccc1Br)NC[C@H](c1ccccc1)N1CCCC1 ZINC000433868583 859943447 /nfs/dbraw/zinc/94/34/47/859943447.db2.gz OEMUEFFZIMSYLL-LJQANCHMSA-N 0 3 405.311 4.084 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)c2ccccc2NCc2cccnc2)CN1Cc1ccccc1 ZINC000467688692 881481886 /nfs/dbraw/zinc/48/18/86/881481886.db2.gz MUFNQCPVOGWFKI-SIKLNZKXSA-N 0 3 400.526 4.087 20 0 HIADHN Cc1cc(C(=O)N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)ccc1NC(=O)CC(C)C ZINC000467689543 881482311 /nfs/dbraw/zinc/48/23/11/881482311.db2.gz VSKMMVQKQHLWJV-DENIHFKCSA-N 0 3 407.558 4.372 20 0 HIADHN Cc1c(NC(=O)NC[C@@H](c2ccccc2)N2CCCC2)noc1-c1ccccc1F ZINC000433908586 859963085 /nfs/dbraw/zinc/96/30/85/859963085.db2.gz OSHSDPXXTBRYNL-FQEVSTJZSA-N 0 3 408.477 4.748 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)NC[C@H]1CCCN(c2ccccc2)C1 ZINC000433914859 859967025 /nfs/dbraw/zinc/96/70/25/859967025.db2.gz KQUXZXJWZLSIEU-ZJSXRUAMSA-N 0 3 406.574 4.039 20 0 HIADHN Cc1c(NC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)noc1-c1ccccc1F ZINC000433915554 859968175 /nfs/dbraw/zinc/96/81/75/859968175.db2.gz QQTWAORMFHTEEG-QGZVFWFLSA-N 0 3 422.504 4.917 20 0 HIADHN C[C@@H](NC(=O)NC[C@@H]1CCCCN1C1CC1)c1cccc(NC(=O)c2ccccc2)c1 ZINC000433940179 859988734 /nfs/dbraw/zinc/98/87/34/859988734.db2.gz KDTYMPDCINCUFM-JPYJTQIMSA-N 0 3 420.557 4.316 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)c2ccc(NC(=O)c3cccs3)cc2)CN1Cc1ccccc1 ZINC000467693416 881487708 /nfs/dbraw/zinc/48/77/08/881487708.db2.gz BCNOGTVKWKBSSJ-DYESRHJHSA-N 0 3 419.550 4.393 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)c2ccc(NC(=O)c3ccccc3)cc2)CN1Cc1ccccc1 ZINC000467698548 881493575 /nfs/dbraw/zinc/49/35/75/881493575.db2.gz QNYXNVVBIQZOPC-YADARESESA-N 0 3 413.521 4.332 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N(CCCO)Cc2cccc(Cl)c2)C1 ZINC000434037723 860055479 /nfs/dbraw/zinc/05/54/79/860055479.db2.gz SEFRZMPKJCRQRN-XMSQKQJNSA-N 0 3 415.965 4.070 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)Cc2csc(Cc3ccccc3)n2)CN1Cc1ccccc1 ZINC000467699209 881494357 /nfs/dbraw/zinc/49/43/57/881494357.db2.gz DFYTXHPSQJLSFH-WIYYLYMNSA-N 0 3 405.567 4.056 20 0 HIADHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(Cl)c(NC(=O)c2cccs2)c1 ZINC000434042666 860058191 /nfs/dbraw/zinc/05/81/91/860058191.db2.gz PNPIJNPPVWOVRK-CVEARBPZSA-N 0 3 417.962 4.353 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCCC1)c1ccccc1NCc1cccnc1 ZINC000434076810 860084951 /nfs/dbraw/zinc/08/49/51/860084951.db2.gz KTBABJOVZBFZBU-UHFFFAOYSA-N 0 3 424.614 4.175 20 0 HIADHN CC(C)(C)c1ccccc1C(=O)N1CCC[C@H](CN2CCN(c3ccccn3)CC2)C1 ZINC000434084570 860091632 /nfs/dbraw/zinc/09/16/32/860091632.db2.gz XLGBQCWLNBVQAR-OAQYLSRUSA-N 0 3 420.601 4.054 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)c2ccccc2NCc2cccnc2)C1 ZINC000434086825 860093916 /nfs/dbraw/zinc/09/39/16/860093916.db2.gz ICYYARPPQWAVSP-DENIHFKCSA-N 0 3 400.526 4.259 20 0 HIADHN O=C(NC[C@H]1CCCN1Cc1ccccc1)c1ccc(-c2nc(C3CC3)no2)cc1 ZINC000434118209 860120114 /nfs/dbraw/zinc/12/01/14/860120114.db2.gz AAQVBWVHUIIJSS-OAQYLSRUSA-N 0 3 402.498 4.008 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)N1CC[C@H](CC(F)(F)F)C1 ZINC000434143855 860141981 /nfs/dbraw/zinc/14/19/81/860141981.db2.gz JLZZBJDURLQGHP-MRXNPFEDSA-N 0 3 401.498 4.084 20 0 HIADHN O=C(Nc1cnn(Cc2ccccc2)c1)N1CCCN(CCCc2ccccc2)CC1 ZINC000467708782 881506186 /nfs/dbraw/zinc/50/61/86/881506186.db2.gz LEFVXHDKJWTRIT-UHFFFAOYSA-N 0 3 417.557 4.104 20 0 HIADHN CC(C)[C@H](CNC(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1)c1cccnc1 ZINC000434169265 860163789 /nfs/dbraw/zinc/16/37/89/860163789.db2.gz HOFAWHOJYJUKQK-UNMCSNQZSA-N 0 3 419.491 4.392 20 0 HIADHN CCCN(C)CC(=O)N[C@@H](C)c1sc(-c2ccccc2Br)nc1C ZINC000467713714 881511188 /nfs/dbraw/zinc/51/11/88/881511188.db2.gz JIYBPLBRBREFJH-LBPRGKRZSA-N 0 3 410.381 4.400 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N(C)Cc3cc(Cl)ccc3F)c2)CC1 ZINC000434226160 860212329 /nfs/dbraw/zinc/21/23/29/860212329.db2.gz PQDALPBKIMZSEC-UHFFFAOYSA-N 0 3 404.917 4.285 20 0 HIADHN COc1ccc(C(=O)CCC(=O)NC2CCN([C@@H](C)c3ccccc3)CC2)cc1F ZINC000434264957 860241133 /nfs/dbraw/zinc/24/11/33/860241133.db2.gz SCAVSNRUWQSSPF-KRWDZBQOSA-N 0 3 412.505 4.139 20 0 HIADHN Cc1ccn(C2CCN(C(=O)NC[C@H](c3ccccc3)N3CCC(C)CC3)CC2)n1 ZINC000434269238 860243779 /nfs/dbraw/zinc/24/37/79/860243779.db2.gz LULQRFGJOVMPIV-HSZRJFAPSA-N 0 3 409.578 4.011 20 0 HIADHN Cc1ccccc1-c1nn(-c2ccccc2)cc1C(=O)N[C@H]1CN(C2CC2)C[C@H]1C ZINC000467718889 881517236 /nfs/dbraw/zinc/51/72/36/881517236.db2.gz VDKCUHFIJAAVKO-JPYJTQIMSA-N 0 3 400.526 4.060 20 0 HIADHN COc1ccccc1CCC(=O)Nc1c(C)cnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000434313126 860274324 /nfs/dbraw/zinc/27/43/24/860274324.db2.gz STVPOMZWANGDOS-QFIPXVFZSA-N 0 3 418.541 4.218 20 0 HIADHN CC[C@@H](OC1CCCC1)C(=O)Nc1c(C)cnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000434314904 860275577 /nfs/dbraw/zinc/27/55/77/860275577.db2.gz HSPLDQGZDHLGHT-RBBKRZOGSA-N 0 3 410.562 4.315 20 0 HIADHN CC(=O)c1c(C)[nH]c(C(=O)Nc2c(C)cnn2[C@@H]2CCN(Cc3ccccc3)C2)c1C ZINC000434316973 860277203 /nfs/dbraw/zinc/27/72/03/860277203.db2.gz OIAZVURDTZHDSK-HXUWFJFHSA-N 0 3 419.529 4.038 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1ccnn1C1CCCC1 ZINC000434316949 860277442 /nfs/dbraw/zinc/27/74/42/860277442.db2.gz ODCKXADFOANOLP-NRFANRHFSA-N 0 3 418.545 4.202 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1ccc2ncccc2c1 ZINC000434319007 860280039 /nfs/dbraw/zinc/28/00/39/860280039.db2.gz RMGDAVRFOBAUQH-JOCHJYFZSA-N 0 3 411.509 4.439 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)[C@@H]1CCOc2ccccc21 ZINC000434322051 860282323 /nfs/dbraw/zinc/28/23/23/860282323.db2.gz SWTVTMQNOMOAQW-IFMALSPDSA-N 0 3 416.525 4.143 20 0 HIADHN CCOc1cccc(C(=O)Nc2c(C)cnn2[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000434322275 860283168 /nfs/dbraw/zinc/28/31/68/860283168.db2.gz UPRPVLDVUFRMKY-OAQYLSRUSA-N 0 3 404.514 4.290 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1ccnc(OC(C)C)c1 ZINC000434323598 860285036 /nfs/dbraw/zinc/28/50/36/860285036.db2.gz KORHDBPIVVMJKF-NRFANRHFSA-N 0 3 419.529 4.073 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1ccc(OC(C)C)nc1 ZINC000434325179 860285981 /nfs/dbraw/zinc/28/59/81/860285981.db2.gz OWQBTRYNVVPRSG-OAQYLSRUSA-N 0 3 419.529 4.073 20 0 HIADHN CC(=O)c1csc(C(=O)Nc2c(C)cnn2[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000434326770 860288487 /nfs/dbraw/zinc/28/84/87/860288487.db2.gz NRRMTFXFELQJMZ-LJQANCHMSA-N 0 3 408.527 4.155 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)COc1ccccc1Cl ZINC000434334706 860296104 /nfs/dbraw/zinc/29/61/04/860296104.db2.gz RTOFLQSZFYIONS-LJQANCHMSA-N 0 3 424.932 4.309 20 0 HIADHN O=C(NC[C@H]1CCCCN1C1CC1)c1ccc(SCc2cn3ccccc3n2)cc1 ZINC000434418994 860341848 /nfs/dbraw/zinc/34/18/48/860341848.db2.gz HSYRKCSVNIALPT-OAQYLSRUSA-N 0 3 420.582 4.373 20 0 HIADHN Cc1ccc(-c2nnc(-c3ccc(C(=O)NC[C@@H]4CCCCN4C4CC4)cc3)o2)cc1 ZINC000434418085 860342253 /nfs/dbraw/zinc/34/22/53/860342253.db2.gz YLMWXHFWLVEETJ-QFIPXVFZSA-N 0 3 416.525 4.459 20 0 HIADHN O=C(Cc1csc(COc2ccc(Cl)cc2)n1)NC[C@@H]1CCCCN1C1CC1 ZINC000434425562 860343776 /nfs/dbraw/zinc/34/37/76/860343776.db2.gz PKUPOUPGQLIMIW-SFHVURJKSA-N 0 3 419.978 4.051 20 0 HIADHN CCCNc1ccc(CNC(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)cc1 ZINC000434464070 860361409 /nfs/dbraw/zinc/36/14/09/860361409.db2.gz XWSJJRCZNHHSTP-UHFFFAOYSA-N 0 3 404.505 4.060 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)Nc2c(Cl)ccc(C)c2C)CC1 ZINC000434478359 860366381 /nfs/dbraw/zinc/36/63/81/860366381.db2.gz GCRVIUNZVFFUJL-UHFFFAOYSA-N 0 3 414.981 4.416 20 0 HIADHN Cc1ccn(C2CCN([C@H]3CCCN(Cc4cccc(C(F)(F)F)c4)C3=O)CC2)n1 ZINC000434506570 860379231 /nfs/dbraw/zinc/37/92/31/860379231.db2.gz DBOSAXPLHMHMHY-FQEVSTJZSA-N 0 3 420.479 4.038 20 0 HIADHN C[C@@H](NCC1(c2ccc3c(c2)OCO3)CCOCC1)c1nc(C(F)(F)F)cs1 ZINC000467732005 881532281 /nfs/dbraw/zinc/53/22/81/881532281.db2.gz DWAVAKFCTTVPDL-GFCCVEGCSA-N 0 3 414.449 4.290 20 0 HIADHN CCCCN(CC(=O)N(Cc1nnc(-c2ccccc2Cl)o1)C1CC1)C1CC1 ZINC000434578441 860411336 /nfs/dbraw/zinc/41/13/36/860411336.db2.gz XTQUFWQOTLIVHP-UHFFFAOYSA-N 0 3 402.926 4.146 20 0 HIADHN Brc1ccccc1OCCN1CCC(c2ncc3n2CCCC3)CC1 ZINC000434690268 860462883 /nfs/dbraw/zinc/46/28/83/860462883.db2.gz FUIXAKGCCYZCKP-UHFFFAOYSA-N 0 3 404.352 4.240 20 0 HIADHN CC(C)CN(CC(=O)N(Cc1nnc(-c2ccccc2Cl)o1)C1CC1)C1CC1 ZINC000434698296 860466422 /nfs/dbraw/zinc/46/64/22/860466422.db2.gz UWQJVNVHLPMIRH-UHFFFAOYSA-N 0 3 402.926 4.001 20 0 HIADHN Cc1ccc([C@]2(C)CCN(CC(=O)N3CCC(OCc4ccccc4)CC3)C2)cc1 ZINC000434738900 860477544 /nfs/dbraw/zinc/47/75/44/860477544.db2.gz SRESVIAENJPXIT-AREMUKBSSA-N 0 3 406.570 4.166 20 0 HIADHN CC[C@@H](NC(=O)CN1CCC(c2ncc3n2CCCC3)CC1)c1ccc(Cl)cc1 ZINC000434755857 860483477 /nfs/dbraw/zinc/48/34/77/860483477.db2.gz XYXPOBYXAVEZPK-OAQYLSRUSA-N 0 3 414.981 4.320 20 0 HIADHN C[C@H]1CN(CCCCNC(=O)c2ccccc2OCc2ccc(F)cc2)C[C@H](C)O1 ZINC000434789059 860494886 /nfs/dbraw/zinc/49/48/86/860494886.db2.gz LTBMUULVLPVCCD-OALUTQOASA-N 0 3 414.521 4.024 20 0 HIADHN CCn1nccc1C1CCN(C[C@@H](O)COc2ccc(Oc3ccccc3)cc2)CC1 ZINC000434790026 860495024 /nfs/dbraw/zinc/49/50/24/860495024.db2.gz PXXOBBLLUPRLQM-OAQYLSRUSA-N 0 3 421.541 4.315 20 0 HIADHN COc1cc(NC(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)c(C)cc1C ZINC000434897181 860542176 /nfs/dbraw/zinc/54/21/76/860542176.db2.gz SDTUXVKTHIAGMS-OALUTQOASA-N 0 3 403.567 4.055 20 0 HIADHN C[C@@H]1[C@@H](c2ccccc2)CCN1CC(=O)Nc1cccc(CN2CCSCC2)c1 ZINC000434897599 860542268 /nfs/dbraw/zinc/54/22/68/860542268.db2.gz XAFHRNJJXBRJNR-XXBNENTESA-N 0 3 409.599 4.052 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1ccc(NC(=O)N(C)C)cc1Cl)c1ccsc1 ZINC000435051492 860616284 /nfs/dbraw/zinc/61/62/84/860616284.db2.gz ZNNCWXGQJKKUIX-SFHVURJKSA-N 0 3 422.982 4.308 20 0 HIADHN Cc1cc(NC(=O)NCCc2cccs2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435099095 860641229 /nfs/dbraw/zinc/64/12/29/860641229.db2.gz QNLKIOQFGLSAMP-LJQANCHMSA-N 0 3 409.559 4.064 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCC3(Cc4ccccc4)CC3)c(C)c2)CC1 ZINC000435144775 860663630 /nfs/dbraw/zinc/66/36/30/860663630.db2.gz LBRYGDKPFOARLX-UHFFFAOYSA-N 0 3 406.574 4.281 20 0 HIADHN CC(C)c1nn(C)cc1NC(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1 ZINC000435186250 860685956 /nfs/dbraw/zinc/68/59/56/860685956.db2.gz CFGHSVDDYFILQJ-UHFFFAOYSA-N 0 3 411.472 4.158 20 0 HIADHN COCc1ccccc1C(=O)Nc1cc(C)nn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435269670 860709378 /nfs/dbraw/zinc/70/93/78/860709378.db2.gz IWWAYLXOJVAYMK-NRFANRHFSA-N 0 3 404.514 4.037 20 0 HIADHN CCCCn1ncc(C(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)c1C ZINC000435270608 860710705 /nfs/dbraw/zinc/71/07/05/860710705.db2.gz VNRPJLBKQMFSGB-NRFANRHFSA-N 0 3 420.561 4.196 20 0 HIADHN CCn1nc(C(C)C)cc1C(=O)Nc1cc(C)nn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435272541 860711522 /nfs/dbraw/zinc/71/15/22/860711522.db2.gz RVBMQIKAWHRYOP-FQEVSTJZSA-N 0 3 420.561 4.231 20 0 HIADHN COCCC1(C(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)CCCC1 ZINC000435276089 860713315 /nfs/dbraw/zinc/71/33/15/860713315.db2.gz CAOMDQUJUAPRSU-NRFANRHFSA-N 0 3 410.562 4.174 20 0 HIADHN Cc1cc(NC(=O)[C@H]2CCOc3ccccc32)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435277375 860714391 /nfs/dbraw/zinc/71/43/91/860714391.db2.gz IZDFEVDZLHHJQX-IRLDBZIGSA-N 0 3 416.525 4.143 20 0 HIADHN CO[C@@](C)(C(=O)Nc1cc(C)nn1[C@H]1CCN(Cc2ccccc2)C1)c1ccccc1 ZINC000435277371 860714463 /nfs/dbraw/zinc/71/44/63/860714463.db2.gz BPLSAOJSKQPYBR-WIOPSUGQSA-N 0 3 418.541 4.139 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)c2ccccc2-c2nc(C(C)(C)C)no2)CN1Cc1ccccc1 ZINC000467756509 881571275 /nfs/dbraw/zinc/57/12/75/881571275.db2.gz VGNKTISRMDGRIG-IEBWSBKVSA-N 0 3 418.541 4.427 20 0 HIADHN CCCCS[C@@H](C)C(=O)Nc1cc(C)nn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435286330 860718710 /nfs/dbraw/zinc/71/87/10/860718710.db2.gz WDYXMMQSTKYKNW-ICSRJNTNSA-N 0 3 400.592 4.499 20 0 HIADHN CCCCS[C@H](C)C(=O)Nc1cc(C)nn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435286334 860718750 /nfs/dbraw/zinc/71/87/50/860718750.db2.gz WDYXMMQSTKYKNW-UYAOXDASSA-N 0 3 400.592 4.499 20 0 HIADHN CCSc1cc(C(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)ccn1 ZINC000435287788 860719841 /nfs/dbraw/zinc/71/98/41/860719841.db2.gz IRLJZLVUJYPHDM-HXUWFJFHSA-N 0 3 421.570 4.398 20 0 HIADHN CCO[C@H](CC(=O)Nc1cc(C)nn1[C@H]1CCN(Cc2ccccc2)C1)C1=CCCC1 ZINC000435292817 860722941 /nfs/dbraw/zinc/72/29/41/860722941.db2.gz ZELKRBKIEMYXPC-XZOQPEGZSA-N 0 3 422.573 4.483 20 0 HIADHN COc1ccc(F)cc1C(=O)Nc1cc(C)nn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435296573 860725173 /nfs/dbraw/zinc/72/51/73/860725173.db2.gz FTEDEKOKNKIRBB-LJQANCHMSA-N 0 3 408.477 4.039 20 0 HIADHN Cc1cc(NC(=O)c2cc3nc(C)ccc3o2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435300007 860726783 /nfs/dbraw/zinc/72/67/83/860726783.db2.gz SUOQNEBOBLWRMH-LJQANCHMSA-N 0 3 415.497 4.340 20 0 HIADHN O=C(Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)c1coc(-c2ccccc2)n1 ZINC000435368744 860765774 /nfs/dbraw/zinc/76/57/74/860765774.db2.gz BXFSNCOZSTXZMI-FQEVSTJZSA-N 0 3 413.481 4.237 20 0 HIADHN COc1cccc([C@@H](C)C(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000435369002 860766770 /nfs/dbraw/zinc/76/67/70/860766770.db2.gz CMBMDJPHNRQXNB-NQIIRXRSSA-N 0 3 404.514 4.081 20 0 HIADHN C[C@@H](Cc1ccccc1F)C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435370919 860767932 /nfs/dbraw/zinc/76/79/32/860767932.db2.gz ROXQMZIGRJEVIS-RXVVDRJESA-N 0 3 406.505 4.287 20 0 HIADHN O=C(Cc1ccc(F)cc1Cl)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435371045 860768059 /nfs/dbraw/zinc/76/80/59/860768059.db2.gz RUIRZFKRZOLJOX-LJQANCHMSA-N 0 3 412.896 4.304 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)c1cc(-c2ccccc2)on1 ZINC000435371896 860769188 /nfs/dbraw/zinc/76/91/88/860769188.db2.gz XXRSOTYHUAJVGO-HXUWFJFHSA-N 0 3 413.481 4.237 20 0 HIADHN O=C(CCCOc1ccc(F)cc1)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435372094 860770893 /nfs/dbraw/zinc/77/08/93/860770893.db2.gz ZEUUISLUQTUKKI-OAQYLSRUSA-N 0 3 422.504 4.267 20 0 HIADHN Cc1ccc(CC(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)c(Cl)c1 ZINC000435374076 860771641 /nfs/dbraw/zinc/77/16/41/860771641.db2.gz HDIHIORXRHCXBN-HXUWFJFHSA-N 0 3 408.933 4.473 20 0 HIADHN Cc1ccc(O[C@H](C)C(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000435373519 860771755 /nfs/dbraw/zinc/77/17/55/860771755.db2.gz DVXUAKUMJRXGFC-CTNGQTDRSA-N 0 3 404.514 4.045 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)[C@@H]1C[C@]12CCc1ccccc12 ZINC000435377971 860774815 /nfs/dbraw/zinc/77/48/15/860774815.db2.gz BQGHLKUCRLAOFE-JJTGBXKASA-N 0 3 412.537 4.173 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)[C@H]1C[C@@H]1c1cc(F)ccc1F ZINC000435378134 860775358 /nfs/dbraw/zinc/77/53/58/860775358.db2.gz CDDKUFVRSCSMCF-SBHAEUEKSA-N 0 3 422.479 4.351 20 0 HIADHN O=C(C[C@@H]1CCOc2ccccc21)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435378687 860776082 /nfs/dbraw/zinc/77/60/82/860776082.db2.gz FTEWYCJMWAKHHG-SFTDATJTSA-N 0 3 416.525 4.225 20 0 HIADHN Cc1cc(NC(=O)N(C)[C@H](C)c2cccnc2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435511172 860829193 /nfs/dbraw/zinc/82/91/93/860829193.db2.gz LXKOWHHILFWEPL-DENIHFKCSA-N 0 3 418.545 4.258 20 0 HIADHN Cc1cc(NC(=O)N(C)Cc2ccccc2F)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435512818 860831683 /nfs/dbraw/zinc/83/16/83/860831683.db2.gz AYECRGDYMTYJKN-OAQYLSRUSA-N 0 3 421.520 4.442 20 0 HIADHN Cc1cc(NC(=O)N[C@H](C)CCc2ccco2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435513665 860832667 /nfs/dbraw/zinc/83/26/67/860832667.db2.gz FDCGXLLQFOSUDT-WIYYLYMNSA-N 0 3 421.545 4.374 20 0 HIADHN Cc1cc(NC(=O)N2CCC[C@@H]2C2CCC2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435517148 860835132 /nfs/dbraw/zinc/83/51/32/860835132.db2.gz OVNBBZUOWDAMPN-FCHUYYIVSA-N 0 3 407.562 4.435 20 0 HIADHN CC[C@@H](NC(=O)Nc1cc(C)nn1[C@@H]1CCN(Cc2ccccc2)C1)c1nccs1 ZINC000435520899 860839129 /nfs/dbraw/zinc/83/91/29/860839129.db2.gz FFDHICDQZBUWTP-RTBURBONSA-N 0 3 424.574 4.368 20 0 HIADHN Cc1cc(NC(=O)NCCc2ccccc2F)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435525748 860842563 /nfs/dbraw/zinc/84/25/63/860842563.db2.gz FVIXZWAQCJNAHA-NRFANRHFSA-N 0 3 421.520 4.142 20 0 HIADHN CSCC[C@@H](C)N(C)C(=O)Nc1cc(C)nn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435527802 860843944 /nfs/dbraw/zinc/84/39/44/860843944.db2.gz NOBAGJXEPQQBCG-UYAOXDASSA-N 0 3 415.607 4.244 20 0 HIADHN Cc1cc(NC(=O)NCCCC(F)(F)F)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435528318 860844664 /nfs/dbraw/zinc/84/46/64/860844664.db2.gz VLFFSZAFZYZYCX-QGZVFWFLSA-N 0 3 409.456 4.103 20 0 HIADHN Cc1cc(NC(=O)N2CCc3ccccc3C2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435529958 860845470 /nfs/dbraw/zinc/84/54/70/860845470.db2.gz SSLNMZPYRAEEHT-HSZRJFAPSA-N 0 3 415.541 4.229 20 0 HIADHN Cc1csc([C@@H](C)NC(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435532388 860847990 /nfs/dbraw/zinc/84/79/90/860847990.db2.gz DUKPMRHGQXVHNJ-MJGOQNOKSA-N 0 3 424.574 4.286 20 0 HIADHN Cc1c(NC(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)cnn1-c1ccccc1F ZINC000435555791 860874286 /nfs/dbraw/zinc/87/42/86/860874286.db2.gz ZKUVFIMYWDEOKI-GOSISDBHSA-N 0 3 421.520 4.448 20 0 HIADHN CC(C)C(=O)Nc1ccc(CNC(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000467776861 881596785 /nfs/dbraw/zinc/59/67/85/881596785.db2.gz UQJRCHRZCOHLAJ-HSZRJFAPSA-N 0 3 422.573 4.087 20 0 HIADHN Cc1cc(NC(=O)c2nccc3ccccc32)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435692949 860974465 /nfs/dbraw/zinc/97/44/65/860974465.db2.gz RWCSACNEXYUZQB-OAQYLSRUSA-N 0 3 411.509 4.439 20 0 HIADHN O=C(NC1CCN(Cc2ccccc2)CC1)c1c[nH]nc1-c1cc2ccccc2o1 ZINC000435831069 861095121 /nfs/dbraw/zinc/09/51/21/861095121.db2.gz MKGJXDLIUYDQHT-UHFFFAOYSA-N 0 3 400.482 4.217 20 0 HIADHN COc1ccc([C@H](CNC(=O)N[C@H]2C[C@H](c3ccccc3F)C2)N2CCCC2)cc1 ZINC000435868522 861129093 /nfs/dbraw/zinc/12/90/93/861129093.db2.gz FMEHVBLLTQBWLA-YDHSSHFGSA-N 0 3 411.521 4.217 20 0 HIADHN CCc1nc(CN(C(C)=O)[C@H]2CCN(Cc3ccc(-c4ccc(C)cc4)s3)C2)no1 ZINC000435885144 861142716 /nfs/dbraw/zinc/14/27/16/861142716.db2.gz GBHSBUTVAYQIQB-IBGZPJMESA-N 0 3 424.570 4.292 20 0 HIADHN Cc1cc(NC(=O)[C@H]2CCCc3cccnc32)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435911358 861172666 /nfs/dbraw/zinc/17/26/66/861172666.db2.gz LJBUCXZGTHBZFM-VXKWHMMOSA-N 0 3 415.541 4.092 20 0 HIADHN O=C1c2ccccc2C(=O)N1C1CCC(N[C@H](c2ccccc2)c2ccccn2)CC1 ZINC000437779546 863098290 /nfs/dbraw/zinc/09/82/90/863098290.db2.gz BOOSRLKEVGARGQ-ZSHKSDETSA-N 0 3 411.505 4.368 20 0 HIADHN CCC(=O)Nc1ccc(C)c(NC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)c1 ZINC000437803052 863123586 /nfs/dbraw/zinc/12/35/86/863123586.db2.gz TWCBJMNNBBZSHN-LJQANCHMSA-N 0 3 408.546 4.472 20 0 HIADHN O=C(Nc1ccc(NC(=O)N2CC[C@H](N3CC=CC3)C2)cc1)c1ccc(Cl)cc1 ZINC000437828003 863175287 /nfs/dbraw/zinc/17/52/87/863175287.db2.gz JOYINVBMHBVYHV-FQEVSTJZSA-N 0 3 410.905 4.070 20 0 HIADHN CN(CC/C=C\c1ccc(Br)cc1)[C@@H]1CCCC[C@H]1S(C)(=O)=O ZINC000437879311 863240624 /nfs/dbraw/zinc/24/06/24/863240624.db2.gz BBJALIHZYDSLSG-DIWYCERUSA-N 0 3 400.382 4.140 20 0 HIADHN CC[C@H](c1ccc(F)cc1F)N1CCN(C(=O)Nc2cccc(CN(C)C)c2)CC1 ZINC000437930291 863307746 /nfs/dbraw/zinc/30/77/46/863307746.db2.gz DCAFKURXJQDZJX-JOCHJYFZSA-N 0 3 416.516 4.327 20 0 HIADHN C[C@H](CNC(=O)Nc1ccc(F)cc1-c1ccc(Cl)cc1)CN1CCN(C)CC1 ZINC000437993165 863355688 /nfs/dbraw/zinc/35/56/88/863355688.db2.gz MFJKUCDLQJYCDD-MRXNPFEDSA-N 0 3 418.944 4.151 20 0 HIADHN C[C@@H](CNC(=O)Nc1ccc(CCN2CCSCC2)cc1)c1ccc(F)cc1F ZINC000438084795 863483039 /nfs/dbraw/zinc/48/30/39/863483039.db2.gz ZTYXUQZIRTWMRV-INIZCTEOSA-N 0 3 419.541 4.481 20 0 HIADHN C[C@H](CNC(=O)Nc1ccc(CCN2CCSCC2)cc1)c1ccc(F)cc1F ZINC000438084797 863483427 /nfs/dbraw/zinc/48/34/27/863483427.db2.gz ZTYXUQZIRTWMRV-MRXNPFEDSA-N 0 3 419.541 4.481 20 0 HIADHN CCOC(=O)Cn1nc(C)c(CN2CCC(Sc3ccc(Cl)cc3)CC2)c1C ZINC000438095655 863502551 /nfs/dbraw/zinc/50/25/51/863502551.db2.gz JEUYNKDCGZJWQM-UHFFFAOYSA-N 0 3 421.994 4.473 20 0 HIADHN C[C@@H](CNC(=O)Nc1ccc(Oc2cccc(Cl)c2)cc1)CN1CCN(C)CC1 ZINC000438100940 863512570 /nfs/dbraw/zinc/51/25/70/863512570.db2.gz DXRZRTCSQNUCJS-KRWDZBQOSA-N 0 3 416.953 4.137 20 0 HIADHN CN(C)CCN(C[C@H]1CCCO1)C(=O)Nc1ccc(OCC2CCCCC2)cc1 ZINC000438206543 863638966 /nfs/dbraw/zinc/63/89/66/863638966.db2.gz NYYVYYCGDSNEDM-JOCHJYFZSA-N 0 3 403.567 4.220 20 0 HIADHN C[C@@H](CNC(=O)Nc1ccccc1Oc1ccc(Cl)cc1)CN1CCN(C)CC1 ZINC000438225593 863661310 /nfs/dbraw/zinc/66/13/10/863661310.db2.gz NRCGEZLBPJHHPN-KRWDZBQOSA-N 0 3 416.953 4.137 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)c1ccc2ccc(Cl)cc2n1 ZINC000438276344 863747696 /nfs/dbraw/zinc/74/76/96/863747696.db2.gz WEIPTZAULTUSSS-FQEVSTJZSA-N 0 3 408.933 4.410 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Nc1ccc(NC(=O)c2ccco2)cc1 ZINC000438317988 863797698 /nfs/dbraw/zinc/79/76/98/863797698.db2.gz FHGAXDHSIQZZSF-UHFFFAOYSA-N 0 3 412.515 4.189 20 0 HIADHN Cc1cc(NC(=O)N2CCN(CCN(C)Cc3ccccc3)CC2)ccc1OC(C)C ZINC000438404582 863850950 /nfs/dbraw/zinc/85/09/50/863850950.db2.gz TXXVHLMIFLBBON-UHFFFAOYSA-N 0 3 424.589 4.064 20 0 HIADHN COc1ccc(Oc2ccc(NC(=O)NC[C@@H](Cc3ccccc3)N(C)C)cn2)cc1 ZINC000438441226 863868525 /nfs/dbraw/zinc/86/85/25/863868525.db2.gz HCEVERMGCHFRQK-HXUWFJFHSA-N 0 3 420.513 4.177 20 0 HIADHN COC(=O)C(C)(C)c1ccc(NC(=O)NC[C@@H](c2cccs2)N2CCCC2)cc1 ZINC000438448797 863874224 /nfs/dbraw/zinc/87/42/24/863874224.db2.gz BBYJBODBEPWMCM-SFHVURJKSA-N 0 3 415.559 4.157 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1ccc(C(C)(C)C(=O)OC)cc1)c1ccsc1 ZINC000438465931 863887183 /nfs/dbraw/zinc/88/71/83/863887183.db2.gz CSEWOEQFBFFWCQ-IBGZPJMESA-N 0 3 417.575 4.403 20 0 HIADHN CCn1cc(Br)cc1C(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000438562314 863995708 /nfs/dbraw/zinc/99/57/08/863995708.db2.gz OSZKDJRMHGRZRC-UHFFFAOYSA-N 0 3 404.352 4.007 20 0 HIADHN CCCOc1ccccc1NC(=O)C(=O)N(CC)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000438656528 864099440 /nfs/dbraw/zinc/09/94/40/864099440.db2.gz OMHIBVSUOOOOPZ-PZJWPPBQSA-N 0 3 423.557 4.098 20 0 HIADHN CCCOc1ccc(NC(=O)C(=O)N(CC)[C@@H]2CCN([C@H](C)c3ccccc3)C2)cc1 ZINC000438658103 864104683 /nfs/dbraw/zinc/10/46/83/864104683.db2.gz YVLBLYDEPORHBZ-DENIHFKCSA-N 0 3 423.557 4.098 20 0 HIADHN CCN(C(=O)C(=O)Nc1ccc2[nH]c(C)cc2c1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000438663572 864114067 /nfs/dbraw/zinc/11/40/67/864114067.db2.gz DOMHVTMXBFUIDM-GCJKJVERSA-N 0 3 418.541 4.099 20 0 HIADHN CCN(C(=O)C(=O)Nc1ccc(F)c(Cl)c1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000438664926 864116018 /nfs/dbraw/zinc/11/60/18/864116018.db2.gz BIMXKVWDSOYADM-CRAIPNDOSA-N 0 3 417.912 4.102 20 0 HIADHN CCN(C(=O)C(=O)Nc1cccc(C(F)F)c1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000438665441 864119159 /nfs/dbraw/zinc/11/91/59/864119159.db2.gz QALKOEPFAQDSID-UZLBHIALSA-N 0 3 415.484 4.247 20 0 HIADHN COc1ccc(OC(F)F)c(NC(=O)N(Cc2ccccc2)C2CCN(C)CC2)c1 ZINC000438690877 864156610 /nfs/dbraw/zinc/15/66/10/864156610.db2.gz CPYCMUZUOISPQC-UHFFFAOYSA-N 0 3 419.472 4.425 20 0 HIADHN Cc1ccnc(Oc2cc(NC(=O)N3CCN(CC4CCOCC4)CC3)ccc2C)c1 ZINC000438696168 864162750 /nfs/dbraw/zinc/16/27/50/864162750.db2.gz ULRMADQBRFRZIJ-UHFFFAOYSA-N 0 3 424.545 4.067 20 0 HIADHN COc1cc(CN(C)C[C@H](O)CO[C@H](c2ccccc2)c2ccccc2C)ccc1O ZINC000438793008 864285949 /nfs/dbraw/zinc/28/59/49/864285949.db2.gz JRMPYRRPCZHISB-BKMJKUGQSA-N 0 3 421.537 4.308 20 0 HIADHN CCN1CCC[C@H]1CNC(=O)C(=O)Nc1ccc([C@@H](C)Sc2ccccc2)cc1 ZINC000438808571 864299470 /nfs/dbraw/zinc/29/94/70/864299470.db2.gz BSIVYKKYKMDOLR-XLIONFOSSA-N 0 3 411.571 4.079 20 0 HIADHN Cc1ccc(Br)cc1CNCc1c[nH]nc1-c1ccc2c(c1)OCO2 ZINC000438911334 864390311 /nfs/dbraw/zinc/39/03/11/864390311.db2.gz PKQNAPRVSXCXGC-UHFFFAOYSA-N 0 3 400.276 4.166 20 0 HIADHN COc1ccc(Cl)cc1N1CC[C@H](N[C@@H](C)c2ccc(NC(C)=O)cc2OC)C1 ZINC000438978348 864441849 /nfs/dbraw/zinc/44/18/49/864441849.db2.gz MIFLQFMPVHBDKQ-KSSFIOAISA-N 0 3 417.937 4.245 20 0 HIADHN O[C@@H]1CCCC[C@@H]1[C@@H]1CCCCN1Cc1cc2c(cc1Br)OCCO2 ZINC000439003131 864457163 /nfs/dbraw/zinc/45/71/63/864457163.db2.gz PWSFCXBLLBADNY-BPQIPLTHSA-N 0 3 410.352 4.126 20 0 HIADHN Cc1ccsc1[C@H]1C[C@@H]1C(=O)NCCCCN1CCN(c2cccc(C)c2)CC1 ZINC000439043534 864495333 /nfs/dbraw/zinc/49/53/33/864495333.db2.gz XEJPJIWIRNWIFD-VXKWHMMOSA-N 0 3 411.615 4.187 20 0 HIADHN CC[C@H](C)[C@@H]1CN(Cc2ccc(C)nc2)CCN1C(=O)Nc1cccc(CN(C)C)c1 ZINC000439074679 864527376 /nfs/dbraw/zinc/52/73/76/864527376.db2.gz YQKHTHQCDRNLRY-CYFREDJKSA-N 0 3 423.605 4.216 20 0 HIADHN C[C@@H]1CN(c2ccc(CN[C@@H](c3ccc(Br)s3)C3CC3)cn2)CCO1 ZINC000439141571 864573711 /nfs/dbraw/zinc/57/37/11/864573711.db2.gz OEOIOPRQVOJOTO-BFUOFWGJSA-N 0 3 422.392 4.372 20 0 HIADHN CCN(C[C@@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)c1cccc(Cl)c1F ZINC000439226788 864643600 /nfs/dbraw/zinc/64/36/00/864643600.db2.gz WPJWTNXJRSMMNY-QGZVFWFLSA-N 0 3 410.942 4.012 20 0 HIADHN CCN(C[C@@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)c1ccc(C)c(Cl)c1 ZINC000439228225 864645172 /nfs/dbraw/zinc/64/51/72/864645172.db2.gz FNCPNHPBMLFBDT-LJQANCHMSA-N 0 3 406.979 4.181 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Nc1cc(F)ccc1Br ZINC000467926696 881801166 /nfs/dbraw/zinc/80/11/66/881801166.db2.gz LFFLGEWCYBVPLQ-UHFFFAOYSA-N 0 3 400.317 4.245 20 0 HIADHN CN(C)[C@H](CNCc1cc(Cl)ccc1OC[C@@H]1CCCO1)c1cccc(F)c1 ZINC000439480271 864846348 /nfs/dbraw/zinc/84/63/48/864846348.db2.gz UFTCSCALKYOCNB-LEWJYISDSA-N 0 3 406.929 4.429 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1ccc(C(F)(F)F)c(F)c1 ZINC000439510934 864858470 /nfs/dbraw/zinc/85/84/70/864858470.db2.gz IAVWDIDDODDAHZ-UHFFFAOYSA-N 0 3 410.411 4.301 20 0 HIADHN C[C@H](NCc1ccccc1CN(C)Cc1ccco1)C(=O)Nc1ccc(F)cc1F ZINC000439608725 864930680 /nfs/dbraw/zinc/93/06/80/864930680.db2.gz BMEASFVYLNZTRP-INIZCTEOSA-N 0 3 413.468 4.307 20 0 HIADHN CO[C@H](C)c1nc(CN2CCCN(CCOc3c(C)cccc3C)CC2)cs1 ZINC000439623520 864947235 /nfs/dbraw/zinc/94/72/35/864947235.db2.gz RRFBJFJVTWQKSI-LJQANCHMSA-N 0 3 403.592 4.054 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)NC[C@@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000439623763 864947570 /nfs/dbraw/zinc/94/75/70/864947570.db2.gz KPGRHWAABDVSKP-NVXWUHKLSA-N 0 3 403.464 4.268 20 0 HIADHN CC(C)N(CCN(C)C)C(=O)c1ccc(COc2cccc(Br)c2)o1 ZINC000439631337 864956601 /nfs/dbraw/zinc/95/66/01/864956601.db2.gz DWPMGZTXPYXERK-UHFFFAOYSA-N 0 3 409.324 4.033 20 0 HIADHN COc1ccc(OC)c(NC(=O)[C@H](C)NCC(C)(C)c2c(F)cccc2Cl)c1 ZINC000439647808 864973637 /nfs/dbraw/zinc/97/36/37/864973637.db2.gz OERBYJDXRMXKCL-ZDUSSCGKSA-N 0 3 408.901 4.391 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)Nc2cc(C(=O)NCC3CC3)ccc2C)N(C)C)cc1 ZINC000439689487 865026847 /nfs/dbraw/zinc/02/68/47/865026847.db2.gz CMXDKJIVRPTNDA-HSZRJFAPSA-N 0 3 422.573 4.122 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)COc2ccccc2-c2ccccc2)CC1 ZINC000439728362 865059331 /nfs/dbraw/zinc/05/93/31/865059331.db2.gz CVVYYIRGKNWXJZ-FQEVSTJZSA-N 0 3 415.537 4.469 20 0 HIADHN Cc1ccc(Cl)c(O[C@@H](C)C(=O)NC2CCN([C@@H](C)c3ccncc3)CC2)c1 ZINC000439733090 865066405 /nfs/dbraw/zinc/06/64/05/865066405.db2.gz MVENCHCCWHYOIP-IRXDYDNUSA-N 0 3 401.938 4.153 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)CSCc2cccc(Cl)c2)CC1 ZINC000439734405 865068026 /nfs/dbraw/zinc/06/80/26/865068026.db2.gz QCEUCEAKPLDAJV-MRXNPFEDSA-N 0 3 403.979 4.310 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)c2cc(-c3ccc(Cl)cc3)n[nH]2)CC1 ZINC000439756863 865083712 /nfs/dbraw/zinc/08/37/12/865083712.db2.gz DLILHVJBNCEBKV-HNNXBMFYSA-N 0 3 409.921 4.081 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)CCc2ccccc2OC(F)(F)F)CC1 ZINC000439757727 865085189 /nfs/dbraw/zinc/08/51/89/865085189.db2.gz HDCYGYGCQTYRRU-MRXNPFEDSA-N 0 3 421.463 4.255 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)[C@@H]2C[C@H]2c2ccccc2OC(F)F)CC1 ZINC000439770282 865096191 /nfs/dbraw/zinc/09/61/91/865096191.db2.gz QEMAQHVPPYOKLW-UIAACRFSSA-N 0 3 415.484 4.128 20 0 HIADHN Cc1cc(Br)ccc1C(=O)NC1CCN([C@H](C)c2ccncc2)CC1 ZINC000439772431 865097216 /nfs/dbraw/zinc/09/72/16/865097216.db2.gz VXLHQTWYMOSBCZ-OAHLLOKOSA-N 0 3 402.336 4.108 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)CCc2ncc(-c3ccccc3F)o2)CC1 ZINC000439777144 865100999 /nfs/dbraw/zinc/10/09/99/865100999.db2.gz ZKOYPCMIFIRAID-QGZVFWFLSA-N 0 3 422.504 4.150 20 0 HIADHN C[C@@H](C(=O)Nc1ccc2oc(=O)n(CCN(C)C)c2c1)c1ccc2ccccc2c1 ZINC000439818164 865134324 /nfs/dbraw/zinc/13/43/24/865134324.db2.gz WJXYEWARMOCJGM-MRXNPFEDSA-N 0 3 403.482 4.052 20 0 HIADHN COc1cccc([C@H](C)CC(=O)NCCCCN2CCN(c3cccc(C)c3)CC2)c1 ZINC000439888645 865200916 /nfs/dbraw/zinc/20/09/16/865200916.db2.gz MCNZXDLSQHXKIX-JOCHJYFZSA-N 0 3 423.601 4.216 20 0 HIADHN Cc1ccc(Br)cc1CNC(=O)N(CCN(C)C)Cc1cccs1 ZINC000439934816 865234166 /nfs/dbraw/zinc/23/41/66/865234166.db2.gz RBTFJMHRAQCSEH-UHFFFAOYSA-N 0 3 410.381 4.092 20 0 HIADHN Cc1ccc(-c2ccnn2C)cc1NC(=O)N(CCN(C)C)Cc1cccc(F)c1 ZINC000439957033 865250175 /nfs/dbraw/zinc/25/01/75/865250175.db2.gz HZYCLOMALICTCO-UHFFFAOYSA-N 0 3 409.509 4.130 20 0 HIADHN Cc1ccc(-c2ccnn2C)cc1NC(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000439968836 865260637 /nfs/dbraw/zinc/26/06/37/865260637.db2.gz PTUWSXRQUDADQX-WIYYLYMNSA-N 0 3 403.530 4.353 20 0 HIADHN CC(C)C1CCC(N2CCN(C(=O)CCc3nnc(-c4ccccc4)o3)CC2)CC1 ZINC000439985037 865291069 /nfs/dbraw/zinc/29/10/69/865291069.db2.gz UELVLEIUEABMGM-UHFFFAOYSA-N 0 3 410.562 4.028 20 0 HIADHN O=C(Nc1cccc(COCC(F)(F)C(F)F)c1)[C@@H]1CCCN1C1CCCC1 ZINC000440115955 865368718 /nfs/dbraw/zinc/36/87/18/865368718.db2.gz DEURKNMYMYJWRG-KRWDZBQOSA-N 0 3 402.432 4.449 20 0 HIADHN CC[C@H](NC(=O)N1CCN(C2CCC(C(C)C)CC2)CC1)c1c(C)nn(C)c1C ZINC000440194751 865422789 /nfs/dbraw/zinc/42/27/89/865422789.db2.gz ZXQUFQIQYSKECQ-CBNMVNINSA-N 0 3 403.615 4.030 20 0 HIADHN COc1ccc(-c2nc(C)c([C@H](C)NC(=O)N(CCN(C)C)C(C)C)s2)cc1 ZINC000440226309 865462935 /nfs/dbraw/zinc/46/29/35/865462935.db2.gz IHAVQFYYKONCGE-INIZCTEOSA-N 0 3 404.580 4.170 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)NCc1cccc(-c2ccccn2)c1 ZINC000440259997 865511653 /nfs/dbraw/zinc/51/16/53/865511653.db2.gz XQFMFLCEYRKPAN-UHFFFAOYSA-N 0 3 424.495 4.300 20 0 HIADHN C[C@H](CSCc1ccccc1)C(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000440278407 865527673 /nfs/dbraw/zinc/52/76/73/865527673.db2.gz DMVMGQKPLGOEBG-NJYVYQBISA-N 0 3 418.647 4.294 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2ccccc2-c2nncn2C(C)C)N(C)C)cc1 ZINC000440311592 865579926 /nfs/dbraw/zinc/57/99/26/865579926.db2.gz MSLZDPNWYVTOCO-NRFANRHFSA-N 0 3 406.534 4.259 20 0 HIADHN C[C@H](NC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1)c1ccc(-n2cccn2)cc1 ZINC000440596655 865829769 /nfs/dbraw/zinc/82/97/69/865829769.db2.gz ABXRBANDDNVAMY-RXVVDRJESA-N 0 3 406.505 4.101 20 0 HIADHN FC(F)(F)c1cc(CNC[C@H](c2ccccc2)N2CCc3sccc3C2)[nH]n1 ZINC000440832407 865947671 /nfs/dbraw/zinc/94/76/71/865947671.db2.gz PJSCXFXDSJQYCD-QGZVFWFLSA-N 0 3 406.477 4.379 20 0 HIADHN Cc1ccccc1[C@H](OC[C@@H](O)CN1CCc2ccccc2[C@H]1CO)c1ccccc1 ZINC000440911054 866006185 /nfs/dbraw/zinc/00/61/85/866006185.db2.gz KRPMBRFJBKNSCC-HUROMRQRSA-N 0 3 417.549 4.054 20 0 HIADHN Cc1ccccc1-c1cc(C(=O)N[C@@H]2C[C@H](C)N(C3CC3)C2)c2cnn(C(C)C)c2n1 ZINC000440913903 866010027 /nfs/dbraw/zinc/01/00/27/866010027.db2.gz MHOXIOKDWKXJMI-ZWKOTPCHSA-N 0 3 417.557 4.343 20 0 HIADHN Cc1noc(C)c1COc1cc2ccccc2cc1C(=O)N[C@H]1C[C@@H](C)N(C2CC2)C1 ZINC000440916300 866012091 /nfs/dbraw/zinc/01/20/91/866012091.db2.gz RSZLNUNADYQWQA-QRWLVFNGSA-N 0 3 419.525 4.379 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)c2ccc(Oc3ccc(C(F)(F)F)cn3)cc2)CN1C1CC1 ZINC000440919021 866015286 /nfs/dbraw/zinc/01/52/86/866015286.db2.gz PFCFPTOIKMBZBB-CZUORRHYSA-N 0 3 405.420 4.248 20 0 HIADHN Cc1cc(-c2cc(C(=O)N[C@@H]3C[C@@H](C)N(C4CC4)C3)c3cnn(C(C)C)c3n2)c(C)o1 ZINC000440924699 866019327 /nfs/dbraw/zinc/01/93/27/866019327.db2.gz JLBWTLMIENYGGM-RHSMWYFYSA-N 0 3 421.545 4.244 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)c2ccccc2CSc2nc3ccccc3[nH]2)CN1C1CC1 ZINC000440924158 866020267 /nfs/dbraw/zinc/02/02/67/866020267.db2.gz MJAHDVHQWWHSGM-NVXWUHKLSA-N 0 3 406.555 4.210 20 0 HIADHN CC(C)n1ncc2c1nc(-c1cccs1)cc2C(=O)N[C@@H]1C[C@H](C)N(C2CC2)C1 ZINC000440931023 866028590 /nfs/dbraw/zinc/02/85/90/866028590.db2.gz IDLBJIQVSUONJU-LSDHHAIUSA-N 0 3 409.559 4.096 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)c2cn(Cc3ccccc3)nc2-c2cccs2)CN1C1CC1 ZINC000440932730 866031091 /nfs/dbraw/zinc/03/10/91/866031091.db2.gz ZXRPWYGFFJOBOH-SJLPKXTDSA-N 0 3 406.555 4.015 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)c2ccccc2CSc2nc3ccccc3o2)CN1C1CC1 ZINC000440936016 866034960 /nfs/dbraw/zinc/03/49/60/866034960.db2.gz LYEKXQHFYLJDIN-DOTOQJQBSA-N 0 3 407.539 4.475 20 0 HIADHN Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)NCCN1CCN(C)C(C)(C)C1 ZINC000440979213 866062440 /nfs/dbraw/zinc/06/24/40/866062440.db2.gz ZRAMBGUITKVTNL-HXUWFJFHSA-N 0 3 424.589 4.283 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)[C@@H](c2c(F)cccc2Cl)N(C)C)C1 ZINC000468115492 881939172 /nfs/dbraw/zinc/93/91/72/881939172.db2.gz PNTBCSPBDWFEMP-QLVMHMETSA-N 0 3 403.929 4.034 20 0 HIADHN O=c1[nH]c(CCN2CCC[C@H](c3nc(C(F)(F)F)cs3)C2)nc2ccccc12 ZINC000441057997 866138737 /nfs/dbraw/zinc/13/87/37/866138737.db2.gz FHMIUHKVMDPWFR-LBPRGKRZSA-N 0 3 408.449 4.233 20 0 HIADHN Cc1ccnc(Oc2ccc(NC(=O)NC[C@H]3CCCN3Cc3ccccc3)cc2)n1 ZINC000441096663 866192281 /nfs/dbraw/zinc/19/22/81/866192281.db2.gz WICQGVXNAPCWMQ-OAQYLSRUSA-N 0 3 417.513 4.363 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)Nc1ccc(C)c(OCCC(C)C)c1 ZINC000441173204 866252451 /nfs/dbraw/zinc/25/24/51/866252451.db2.gz QWTJWUICRRHISO-UHFFFAOYSA-N 0 3 411.546 4.367 20 0 HIADHN CCOc1ccc(-c2nc(CN3CCC[C@@H]([C@H]4CCOC4)C3)cs2)cc1OC ZINC000441219202 866297101 /nfs/dbraw/zinc/29/71/01/866297101.db2.gz WGKZWLBLOUVEEK-MSOLQXFVSA-N 0 3 402.560 4.466 20 0 HIADHN CC[C@H](Cc1ccc(C)cc1)N(CC)C(=O)C(=O)Nc1cc(CN(C)C)ccc1C ZINC000441231034 866305811 /nfs/dbraw/zinc/30/58/11/866305811.db2.gz MKXJFPBRKLVBDA-JOCHJYFZSA-N 0 3 409.574 4.173 20 0 HIADHN COc1ccc([C@@H](CNC(=O)CN2CCC3(CCC3)C2)c2c[nH]c3ccccc32)cc1 ZINC000468125532 881963778 /nfs/dbraw/zinc/96/37/78/881963778.db2.gz GHFLBJXYGMGRDM-JOCHJYFZSA-N 0 3 417.553 4.301 20 0 HIADHN O=C(CN1CCC[C@H]([C@H]2CCOC2)C1)N[C@@H](c1ccccc1)c1ccc(Cl)cc1 ZINC000441279597 866355049 /nfs/dbraw/zinc/35/50/49/866355049.db2.gz CISBWSHZKGRRBJ-HFMPRLQTSA-N 0 3 412.961 4.294 20 0 HIADHN Cc1ccc([C@H]2CCC[C@H]2N(C)CC(=O)Nc2ccc(CN3CCOCC3)cc2)cc1 ZINC000441322423 866392631 /nfs/dbraw/zinc/39/26/31/866392631.db2.gz KBTDJLBTMHTIMH-JWQCQUIFSA-N 0 3 421.585 4.034 20 0 HIADHN Cc1ccc([C@@H]2CCC[C@H]2N(C)CC(=O)Nc2ccc(CN3CCOCC3)cc2)cc1 ZINC000441322424 866392800 /nfs/dbraw/zinc/39/28/00/866392800.db2.gz KBTDJLBTMHTIMH-LOSJGSFVSA-N 0 3 421.585 4.034 20 0 HIADHN Cc1ccc([C@@H]2CCC[C@@H]2N(C)CC(=O)Nc2cccc(N3CCCC3=O)c2)cc1 ZINC000441338358 866408902 /nfs/dbraw/zinc/40/89/02/866408902.db2.gz CYIZNQATANWZGW-GOTSBHOMSA-N 0 3 405.542 4.328 20 0 HIADHN COc1cc(CN(C)C(=O)N[C@@H]2C[C@@H](C)N(C3CC3)C2)ccc1OCc1ccccc1 ZINC000441357003 866426906 /nfs/dbraw/zinc/42/69/06/866426906.db2.gz MWFRSVUNKPDOGN-WIYYLYMNSA-N 0 3 423.557 4.041 20 0 HIADHN CN(C)[C@@H](CNC(=O)N1CCC[C@@H]1c1nc2cc(Cl)ccc2[nH]1)c1ccccc1 ZINC000441417891 866494150 /nfs/dbraw/zinc/49/41/50/866494150.db2.gz HATFWQXSIRHVJN-UXHICEINSA-N 0 3 411.937 4.366 20 0 HIADHN CN(C)[C@@H](CNC(=O)N1CCC[C@H]1c1nc2cc(Cl)ccc2[nH]1)c1ccccc1 ZINC000441417889 866494511 /nfs/dbraw/zinc/49/45/11/866494511.db2.gz HATFWQXSIRHVJN-PMACEKPBSA-N 0 3 411.937 4.366 20 0 HIADHN CC1CCC(N(CC(=O)N(Cc2ccco2)CC(F)(F)F)C[C@@H]2CCCO2)CC1 ZINC000441443526 866520572 /nfs/dbraw/zinc/52/05/72/866520572.db2.gz BEYXSAQPMSVVMY-ABHNRTSZSA-N 0 3 416.484 4.230 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)c2cc(F)c(F)cc2Br)CN1Cc1ccccc1 ZINC000441451204 866526812 /nfs/dbraw/zinc/52/68/12/866526812.db2.gz TWJXKNPRTVSMHF-TZMCWYRMSA-N 0 3 409.274 4.120 20 0 HIADHN COc1ccc(Br)cc1-c1nc(CN2CC[C@H]([C@H]3CCOC3)C2)cs1 ZINC000441658707 866774611 /nfs/dbraw/zinc/77/46/11/866774611.db2.gz WOZDIWMIZMMIJF-KBPBESRZSA-N 0 3 423.376 4.440 20 0 HIADHN C[C@H](NC(=O)C(=O)Nc1cccc(C(F)F)c1Cl)[C@H](c1ccccc1)N(C)C ZINC000441707788 866815531 /nfs/dbraw/zinc/81/55/31/866815531.db2.gz ZPHDCIUYJNPCDW-YVEFUNNKSA-N 0 3 409.864 4.024 20 0 HIADHN C[C@H](NC(=O)C(=O)Nc1cccc(C(F)F)c1Cl)[C@@H](c1ccccc1)N(C)C ZINC000441707784 866815692 /nfs/dbraw/zinc/81/56/92/866815692.db2.gz ZPHDCIUYJNPCDW-SJCJKPOMSA-N 0 3 409.864 4.024 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)Nc3nc4c(s3)CCCCCC4)CC2)C[C@H](C)O1 ZINC000441926974 866991900 /nfs/dbraw/zinc/99/19/00/866991900.db2.gz WMHSLQPEFSZRMQ-IRXDYDNUSA-N 0 3 420.623 4.155 20 0 HIADHN CC(C)Sc1c(Cl)cccc1NC(=O)C(=O)N1CCCN(C2CCCC2)CC1 ZINC000441979620 867040535 /nfs/dbraw/zinc/04/05/35/867040535.db2.gz QGMWFJRSZSBMBN-UHFFFAOYSA-N 0 3 424.010 4.256 20 0 HIADHN CN(C(=O)N[C@@H]1CCCc2sc(-c3ccc(F)cc3)nc21)[C@@H]1CCN(C2CC2)C1 ZINC000468167388 882044367 /nfs/dbraw/zinc/04/43/67/882044367.db2.gz AELPUAAQSIJALG-QZTJIDSGSA-N 0 3 414.550 4.205 20 0 HIADHN C[C@H]1CCN(C)CCN1C(=O)N[C@@H]1CCCc2sc(-c3ccc(F)cc3)nc21 ZINC000468172043 882051073 /nfs/dbraw/zinc/05/10/73/882051073.db2.gz ZQXVWLFGRATLRN-WMLDXEAASA-N 0 3 402.539 4.062 20 0 HIADHN COCc1nc(CNC(=O)N[C@H](CN(C)C)c2ccccc2)c(-c2ccccc2)s1 ZINC000442471909 867454831 /nfs/dbraw/zinc/45/48/31/867454831.db2.gz JGQDUUDWGZKSIA-HXUWFJFHSA-N 0 3 424.570 4.059 20 0 HIADHN CN(C)Cc1cccc(NC(=O)C(=O)N2CCCCC[C@H]2/C=C\c2cccs2)c1 ZINC000442490736 867474147 /nfs/dbraw/zinc/47/41/47/867474147.db2.gz ITHRCJNDZGHOEO-CBUFDYBVSA-N 0 3 411.571 4.233 20 0 HIADHN CSc1ccccc1[C@H](C)NC(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000442592684 867550169 /nfs/dbraw/zinc/55/01/69/867550169.db2.gz HCSKAZZEVIUJFC-QRVBRYPASA-N 0 3 419.635 4.390 20 0 HIADHN Cc1ncsc1CN(C)C[C@@H]1CCN(C(=O)c2ccncc2Oc2ccccc2)C1 ZINC000442768058 867669121 /nfs/dbraw/zinc/66/91/21/867669121.db2.gz JVRHGSHXGKWWJF-SFHVURJKSA-N 0 3 422.554 4.233 20 0 HIADHN COc1ccc(S(=O)(=O)[N-]c2cccc(C[NH2+]C3CCC(C(F)F)CC3)c2)cc1 ZINC000442776740 867671009 /nfs/dbraw/zinc/67/10/09/867671009.db2.gz HWASDLGNZPLUJL-UHFFFAOYSA-N 0 3 424.513 4.410 20 0 HIADHN CN(CC[C@H]1CCCCO1)Cc1cccc(Br)c1OC[C@@H]1CCCO1 ZINC000442890724 867723081 /nfs/dbraw/zinc/72/30/81/867723081.db2.gz KXMVOJCZLZDPAU-MSOLQXFVSA-N 0 3 412.368 4.398 20 0 HIADHN Cc1c(F)c(C(F)(F)F)ccc1C(=O)N(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1 ZINC000442977611 867774738 /nfs/dbraw/zinc/77/47/38/867774738.db2.gz LWOHAVXBIKNAJD-KXBFYZLASA-N 0 3 409.427 4.313 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N[C@H]1CCOc2c(F)cccc21)c1cccc(OC)c1 ZINC000443015027 867792921 /nfs/dbraw/zinc/79/29/21/867792921.db2.gz RFYXYDYDHGDBOH-SFTDATJTSA-N 0 3 415.509 4.040 20 0 HIADHN C[C@H](CC(=O)Nc1cccc(Br)c1)N[C@H]1CCOc2c(F)cccc21 ZINC000443207775 867875021 /nfs/dbraw/zinc/87/50/21/867875021.db2.gz KKQLJBARTOGPMC-PXAZEXFGSA-N 0 3 407.283 4.419 20 0 HIADHN COc1cc(NC(=O)CCN2CC3(CCCC3)OC(C)(C)C2)c(OC)cc1Cl ZINC000443337560 867912754 /nfs/dbraw/zinc/91/27/54/867912754.db2.gz XPWYZLJXZXJITL-UHFFFAOYSA-N 0 3 410.942 4.109 20 0 HIADHN CC[C@]1(C)Oc2ccc(NC(=O)N(C)C[C@@H]3CCN(C)[C@H]3c3cccnc3)cc2O1 ZINC000443389980 867949023 /nfs/dbraw/zinc/94/90/23/867949023.db2.gz SRCWHTYCKLHZGW-JWNTYJGQSA-N 0 3 410.518 4.136 20 0 HIADHN C[C@@H](NC(=O)NC[C@@H](Cc1ccccc1)N(C)C)c1ccc(Br)s1 ZINC000443539612 868097485 /nfs/dbraw/zinc/09/74/85/868097485.db2.gz GZQISMABRQRERW-UKRRQHHQSA-N 0 3 410.381 4.044 20 0 HIADHN CC[C@]1(C)Oc2ccc(NC(=O)c3ccc(CN4CCC(CO)CC4)cc3)cc2O1 ZINC000443564843 868120056 /nfs/dbraw/zinc/12/00/56/868120056.db2.gz CRJCBAMFJMAWJJ-XMMPIXPASA-N 0 3 410.514 4.041 20 0 HIADHN CCSCc1ccccc1C(=O)NCCCN1CCN(C)C[C@H]1c1ccccc1 ZINC000468249017 882156452 /nfs/dbraw/zinc/15/64/52/882156452.db2.gz GRJIQJFSXXRRHR-QHCPKHFHSA-N 0 3 411.615 4.048 20 0 HIADHN C[C@@H](c1ncc(-c2ccc(Cl)cc2)o1)N1CCC(CCN2CCOCC2)CC1 ZINC000443634155 868213011 /nfs/dbraw/zinc/21/30/11/868213011.db2.gz UTQIAUAJSYCECP-KRWDZBQOSA-N 0 3 403.954 4.490 20 0 HIADHN Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)NCCCCN1C[C@H](C)O[C@@H](C)C1 ZINC000443669256 868276576 /nfs/dbraw/zinc/27/65/76/868276576.db2.gz XTWOOQXNYZTVNF-GJZGRUSLSA-N 0 3 421.994 4.391 20 0 HIADHN Cc1ccccc1[C@H]([C@H](C)NC(=O)C(=O)Nc1cc(Cl)ccc1Cl)N(C)C ZINC000443836753 868368096 /nfs/dbraw/zinc/36/80/96/868368096.db2.gz HMZPXANDWUPSLY-UGSOOPFHSA-N 0 3 408.329 4.048 20 0 HIADHN Cc1ccccc1[C@@H]([C@H](C)NC(=O)C(=O)Nc1ccc(OC2CCCC2)cc1)N(C)C ZINC000443845069 868376105 /nfs/dbraw/zinc/37/61/05/868376105.db2.gz SVBGIPGTWPLMBA-FDDCHVKYSA-N 0 3 423.557 4.063 20 0 HIADHN CSc1cccc(N(C(=O)[C@H]2Cc3cc(C)c(C)cc3O2)C2CCN(C)CC2)c1 ZINC000443876869 868407421 /nfs/dbraw/zinc/40/74/21/868407421.db2.gz AMUOIKKVVPQFLU-HSZRJFAPSA-N 0 3 410.583 4.456 20 0 HIADHN COc1ccc(CNC[C@@H](c2cccc(F)c2)N(C)C)c(OCc2cccnc2)c1 ZINC000443982639 868507310 /nfs/dbraw/zinc/50/73/10/868507310.db2.gz GVJCFGMZUPBCGB-QHCPKHFHSA-N 0 3 409.505 4.201 20 0 HIADHN OC[C@H](CNCc1cnc(C(F)(F)F)s1)Cc1ccccc1OC(F)(F)F ZINC000443982368 868507735 /nfs/dbraw/zinc/50/77/35/868507735.db2.gz QEIMYPFORBGGNJ-JTQLQIEISA-N 0 3 414.371 4.001 20 0 HIADHN CCCOc1cc(CNC2(c3ccc(OC)c(F)c3)CCOCC2)ccc1OC ZINC000444013010 868536847 /nfs/dbraw/zinc/53/68/47/868536847.db2.gz WIRYDBLMGFNWGY-UHFFFAOYSA-N 0 3 403.494 4.427 20 0 HIADHN COc1ccc(C2(NCc3cc(Br)cs3)CCOCC2)cc1F ZINC000444018178 868542086 /nfs/dbraw/zinc/54/20/86/868542086.db2.gz UEXIZPGCHRPCAU-UHFFFAOYSA-N 0 3 400.313 4.454 20 0 HIADHN C[C@@H]1CCN(C)CCN1C(=O)N[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 ZINC000444021210 868546713 /nfs/dbraw/zinc/54/67/13/868546713.db2.gz LMMPFEKBYVITST-DOMZBBRYSA-N 0 3 411.390 4.435 20 0 HIADHN CC(C)CN(CCN(C)C)C(=O)Nc1ccc(Cl)c(C(=O)NC2CCCCC2)c1 ZINC000444034861 868569971 /nfs/dbraw/zinc/56/99/71/868569971.db2.gz IUAOBMBXEBMYPJ-UHFFFAOYSA-N 0 3 423.001 4.454 20 0 HIADHN CCc1nc(-c2ccc(Cl)cc2)[nH]c1C(=O)N(CC(C)C)C1CCN(C)CC1 ZINC000444273223 868710417 /nfs/dbraw/zinc/71/04/17/868710417.db2.gz ZXORNHIAWCAKOT-UHFFFAOYSA-N 0 3 402.970 4.485 20 0 HIADHN Cc1cc(O[C@H](C)C(=O)Nc2cccc(CN3CCC(O)CC3)c2)ccc1C(C)C ZINC000444457235 868834663 /nfs/dbraw/zinc/83/46/63/868834663.db2.gz XNBNVSUYDOHZBC-LJQANCHMSA-N 0 3 410.558 4.481 20 0 HIADHN CC(C)[C@H]1CC[C@@H](C)C[C@@H]1OCC(=O)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000444461106 868836646 /nfs/dbraw/zinc/83/66/46/868836646.db2.gz ONECUYXFJGOGCJ-YSZBQJHXSA-N 0 3 402.579 4.059 20 0 HIADHN CC(C)n1cc(Br)cc1C(=O)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000444461252 868837070 /nfs/dbraw/zinc/83/70/70/868837070.db2.gz QPWKGNSAJCDKTO-UHFFFAOYSA-N 0 3 420.351 4.041 20 0 HIADHN COc1ccccc1C[C@H](C)CC(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000444551832 868879259 /nfs/dbraw/zinc/87/92/59/868879259.db2.gz SJYOFBAKOHZTOR-IBGZPJMESA-N 0 3 410.558 4.107 20 0 HIADHN CCCCN(C)c1ccc(C(=O)Nc2cccc(CN3CCC(CO)CC3)c2)cc1 ZINC000444555771 868880144 /nfs/dbraw/zinc/88/01/44/868880144.db2.gz YLWQNZCYWVMSNB-UHFFFAOYSA-N 0 3 409.574 4.380 20 0 HIADHN O=C(CCN1CCC(C(=O)c2ccc(Cl)cc2)CC1)N1CCc2ccccc2C1 ZINC000444595144 868896011 /nfs/dbraw/zinc/89/60/11/868896011.db2.gz UNDVIEGOHFOUIY-UHFFFAOYSA-N 0 3 410.945 4.210 20 0 HIADHN Fc1ccccc1-c1noc(CN2CCC[C@@H](c3n[nH]c(C4CCCCC4)n3)C2)n1 ZINC000444605117 868899647 /nfs/dbraw/zinc/89/96/47/868899647.db2.gz BZSHLNHCSIHBRN-MRXNPFEDSA-N 0 3 410.497 4.421 20 0 HIADHN CCOC(=O)c1c(C)oc2nc(CN[C@H](CC)C(C)(C)c3ccccc3)nc(N)c21 ZINC000444606633 868901031 /nfs/dbraw/zinc/90/10/31/868901031.db2.gz FKCYIBZUGHADCY-MRXNPFEDSA-N 0 3 410.518 4.136 20 0 HIADHN COc1ccc(-c2csc(NC(=O)[C@H](C)N[C@H]3CC(C)(C)OC3(C)C)n2)cc1 ZINC000444637952 868925468 /nfs/dbraw/zinc/92/54/68/868925468.db2.gz HKGVRIPVRDVURW-GUYCJALGSA-N 0 3 403.548 4.081 20 0 HIADHN Cc1cc(N2CCCC[C@H]2C)ccc1NC(=O)NC1CCN(CCOC(C)C)CC1 ZINC000468314828 882242902 /nfs/dbraw/zinc/24/29/02/882242902.db2.gz DTFOEYHMFNBYTO-HXUWFJFHSA-N 0 3 416.610 4.385 20 0 HIADHN O=C(CCN1CCC[C@H]([C@H](O)C(F)(F)F)C1)Nc1ccc(Oc2ccccc2)cc1 ZINC000444724742 868976456 /nfs/dbraw/zinc/97/64/56/868976456.db2.gz LCSPPWPBKVFHOV-KKSFZXQISA-N 0 3 422.447 4.443 20 0 HIADHN O=C(CCN1CCC[C@H]([C@@H](O)C(F)(F)F)C1)Nc1ccc(Oc2ccccc2)cc1 ZINC000444724739 868977042 /nfs/dbraw/zinc/97/70/42/868977042.db2.gz LCSPPWPBKVFHOV-HRAATJIYSA-N 0 3 422.447 4.443 20 0 HIADHN O=C(CCN1CCC[C@@H]([C@H](O)C(F)(F)F)C1)Nc1ccccc1Oc1ccccc1 ZINC000444723058 868977182 /nfs/dbraw/zinc/97/71/82/868977182.db2.gz UCEDRVKGNYUECF-IERDGZPVSA-N 0 3 422.447 4.443 20 0 HIADHN Cc1ccccc1[C@H](CC(F)(F)F)NCCCOc1ccc(S(C)(=O)=O)cc1 ZINC000444778826 868999435 /nfs/dbraw/zinc/99/94/35/868999435.db2.gz AEBWXLMCFXRJMG-IBGZPJMESA-N 0 3 415.477 4.451 20 0 HIADHN Cc1coc(-c2cccc(NC(=O)N3CCC(CN4C[C@@H](C)O[C@@H](C)C4)CC3)c2)n1 ZINC000468334432 882267397 /nfs/dbraw/zinc/26/73/97/882267397.db2.gz RGMXAKSNKDJZHA-HDICACEKSA-N 0 3 412.534 4.003 20 0 HIADHN C[C@@H](c1nc(-c2csc(I)c2)no1)N1[C@H](C)CC[C@@H]1C ZINC000445301820 869354974 /nfs/dbraw/zinc/35/49/74/869354974.db2.gz VKLODUYLLCSZDG-AEJSXWLSSA-N 0 3 403.289 4.337 20 0 HIADHN CCc1ccc(NC(=O)Cc2noc([C@H]3CCCN(Cc4cccc(F)c4)C3)n2)cc1 ZINC000445326176 869385941 /nfs/dbraw/zinc/38/59/41/869385941.db2.gz YQRZNZMCLMIOKU-IBGZPJMESA-N 0 3 422.504 4.332 20 0 HIADHN c1cncc(COc2ccc(-c3noc([C@H]4CCCN4C4CCOCC4)n3)cc2)c1 ZINC000445560423 869617596 /nfs/dbraw/zinc/61/75/96/869617596.db2.gz HOWPQJUDMFOCPB-OAQYLSRUSA-N 0 3 406.486 4.027 20 0 HIADHN Fc1cccc(CN2CCC[C@@H](c3nc(COCC(F)(F)C(F)F)no3)C2)c1 ZINC000445738945 869793268 /nfs/dbraw/zinc/79/32/68/869793268.db2.gz ATLNBGDXIAKGDI-CYBMUJFWSA-N 0 3 405.367 4.005 20 0 HIADHN CCN1CCN(CCC(=O)Nc2ccc(Oc3ncc(Cl)cc3Cl)cc2)CC1 ZINC000468399970 882341492 /nfs/dbraw/zinc/34/14/92/882341492.db2.gz RTUOLGGAZNSXEJ-UHFFFAOYSA-N 0 3 423.344 4.147 20 0 HIADHN O=C1NC(CC(F)(F)F)C(=O)N1c1ccc(OC(F)F)c(Cc2ccccc2)c1 ZINC000445878037 869868714 /nfs/dbraw/zinc/86/87/14/869868714.db2.gz QSJWIZJUEOHOEN-AWEZNQCLSA-N 0 3 414.330 4.256 20 0 HIADHN CC(C)[C@@H](CC(F)(F)F)NCC(=O)Nc1ccnn1Cc1ccccc1Cl ZINC000445893407 869875671 /nfs/dbraw/zinc/87/56/71/869875671.db2.gz JYCBXLMGEURMQX-OAHLLOKOSA-N 0 3 402.848 4.090 20 0 HIADHN COCCCOc1cc(C)ccc1CNC(=O)c1oc2ccccc2c1CN(C)C ZINC000445943953 869904635 /nfs/dbraw/zinc/90/46/35/869904635.db2.gz LIRWUEXZDBVBPS-UHFFFAOYSA-N 0 3 410.514 4.148 20 0 HIADHN Cc1ccc2c(c1)[nH]cc2C1=CCN(C(=O)CC2(N3CCOCC3)CCCC2)CC1 ZINC000468412783 882357173 /nfs/dbraw/zinc/35/71/73/882357173.db2.gz QFKXPHPWOCCIFU-UHFFFAOYSA-N 0 3 407.558 4.127 20 0 HIADHN CN1CCN(c2cc(C(=O)Nc3ccc4nc(C5CCCCC5)[nH]c4c3)ccn2)CC1 ZINC000446245109 870185143 /nfs/dbraw/zinc/18/51/43/870185143.db2.gz QRIRHJJYTFMOTA-UHFFFAOYSA-N 0 3 418.545 4.010 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)c1ccc(NC(=O)Nc2ccccc2)s1 ZINC000446442819 870363497 /nfs/dbraw/zinc/36/34/97/870363497.db2.gz WBARRWFFHBZMRH-UHFFFAOYSA-N 0 3 412.515 4.189 20 0 HIADHN CC(C)N(C)c1ccccc1CNC(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000446621527 870523283 /nfs/dbraw/zinc/52/32/83/870523283.db2.gz WYGJLPWUPAVUTM-UHFFFAOYSA-N 0 3 408.590 4.337 20 0 HIADHN C[C@H](NCc1ccccc1OCC(=O)NC[C@H]1CCCO1)c1cc2ccccc2s1 ZINC000446757269 870667973 /nfs/dbraw/zinc/66/79/73/870667973.db2.gz SPBHGEJHFRLSLV-FXAWDEMLSA-N 0 3 424.566 4.426 20 0 HIADHN Cc1cc(C)n2c(CNC3(c4cccc(C(F)(F)F)c4)CCOCC3)cnc2n1 ZINC000446836736 870754786 /nfs/dbraw/zinc/75/47/86/870754786.db2.gz WDPGNFBFEXPHJP-UHFFFAOYSA-N 0 3 404.436 4.160 20 0 HIADHN OCC1(Cc2ccccc2)CCN(Cc2ccccc2OCc2ccccn2)CC1 ZINC000446840482 870758191 /nfs/dbraw/zinc/75/81/91/870758191.db2.gz ZKHDCRPXFKNJMS-UHFFFAOYSA-N 0 3 402.538 4.478 20 0 HIADHN COc1ccc(CN[C@@H](CCn2cncn2)c2ccc(C)cc2)cc1Br ZINC000446841850 870759875 /nfs/dbraw/zinc/75/98/75/870759875.db2.gz BFKYLBUMDNMOIO-IBGZPJMESA-N 0 3 415.335 4.279 20 0 HIADHN Cc1ccccc1[C@H](CC(F)(F)F)NC(=O)N(CCN(C)C)Cc1ccccn1 ZINC000446866276 870786818 /nfs/dbraw/zinc/78/68/18/870786818.db2.gz FPGSMDWLZZWDMP-IBGZPJMESA-N 0 3 408.468 4.157 20 0 HIADHN CCN1CCN(c2ccccc2CNc2ccc(C(=O)NC3CCCC3)cc2)CC1 ZINC000446887055 870806314 /nfs/dbraw/zinc/80/63/14/870806314.db2.gz NNHPJQJRFSNEKZ-UHFFFAOYSA-N 0 3 406.574 4.113 20 0 HIADHN Cc1ccc(CN[C@H](C)CC(=O)Nc2ccc(C(C)C)cc2)cc1S(C)(=O)=O ZINC000446894066 870812941 /nfs/dbraw/zinc/81/29/41/870812941.db2.gz KEQDCZBTIAPPJM-QGZVFWFLSA-N 0 3 402.560 4.029 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1ccc(C(=O)Nc2ccccc2)cc1 ZINC000446909277 870825800 /nfs/dbraw/zinc/82/58/00/870825800.db2.gz XASZVPXGWNRJEI-UHFFFAOYSA-N 0 3 406.486 4.128 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1ccc(Br)cc1Cl ZINC000446932417 870843954 /nfs/dbraw/zinc/84/39/54/870843954.db2.gz IEZHIWCTAVDBGE-UHFFFAOYSA-N 0 3 400.704 4.291 20 0 HIADHN O[C@@H]([C@H]1CCCN(Cc2ccc(-n3ccc(C(F)(F)F)n3)cc2)C1)C(F)(F)F ZINC000446976217 870873885 /nfs/dbraw/zinc/87/38/85/870873885.db2.gz VUKIZPVBDPMFHS-BBRMVZONSA-N 0 3 407.358 4.026 20 0 HIADHN COc1ccccc1-c1csc([C@@H]2CCCN(Cc3cnc4cnccn34)C2)n1 ZINC000447059527 870939507 /nfs/dbraw/zinc/93/95/07/870939507.db2.gz LGWXYJKTTCOZIU-MRXNPFEDSA-N 0 3 405.527 4.241 20 0 HIADHN Cc1nc(-c2ccc(C)c(NC(=O)N[C@@H]3CCN([C@@H](C)c4ccccc4)C3)c2)n[nH]1 ZINC000447076288 870959056 /nfs/dbraw/zinc/95/90/56/870959056.db2.gz JMCQWEZNUFXVIK-OXJNMPFZSA-N 0 3 404.518 4.046 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1cccc(CSC2CCOCC2)c1 ZINC000447076058 870960384 /nfs/dbraw/zinc/96/03/84/870960384.db2.gz LYLWAWFVBNSXST-UHFFFAOYSA-N 0 3 417.575 4.288 20 0 HIADHN COCCO[C@@H]1C[C@@H](CO)CN(Cc2ccc(-c3ccc(C(C)(C)C)cc3)o2)C1 ZINC000447076017 870960516 /nfs/dbraw/zinc/96/05/16/870960516.db2.gz IITTZBBKXWIXQW-XMSQKQJNSA-N 0 3 401.547 4.090 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1cccn(Cc2ccccc2)c1=O)c1ccsc1 ZINC000447197021 871090397 /nfs/dbraw/zinc/09/03/97/871090397.db2.gz ZMTAKPOCTHPRIX-OAQYLSRUSA-N 0 3 424.570 4.163 20 0 HIADHN Cc1noc(C)c1CSc1ccccc1C(=O)NC[C@@H]1N(C)CCCC1(C)C ZINC000468494263 882479838 /nfs/dbraw/zinc/47/98/38/882479838.db2.gz ASMYWTMXCYGZJA-FQEVSTJZSA-N 0 3 401.576 4.434 20 0 HIADHN C[C@H](CCc1ccc(Br)cc1)NC(=O)N(CCN(C)C)Cc1ccco1 ZINC000447319485 871211019 /nfs/dbraw/zinc/21/10/19/871211019.db2.gz YBSLGDWINRFFDH-MRXNPFEDSA-N 0 3 422.367 4.137 20 0 HIADHN COc1ccccc1-c1csc([C@@H]2CCCN([C@H]3CCCN(C(C)C)C3=O)C2)n1 ZINC000447401398 871311879 /nfs/dbraw/zinc/31/18/79/871311879.db2.gz YCFJJJFJWISIIM-XLIONFOSSA-N 0 3 413.587 4.398 20 0 HIADHN COC(=O)c1coc([C@H](C)NCCCOc2ncc(C(F)(F)F)cc2Cl)c1 ZINC000447576530 871476331 /nfs/dbraw/zinc/47/63/31/871476331.db2.gz ZCRUYYYWRSQKNV-JTQLQIEISA-N 0 3 406.788 4.253 20 0 HIADHN FC(F)C(F)(F)COCCN[C@@H]1CCCOc2c(Br)cccc21 ZINC000447595245 871500551 /nfs/dbraw/zinc/50/05/51/871500551.db2.gz MDSOEDFLASMMMF-GFCCVEGCSA-N 0 3 400.210 4.169 20 0 HIADHN OC[C@H](CN[C@H](c1ccc(F)cc1)c1cccnc1)Cc1cc(F)c(F)c(F)c1 ZINC000447607257 871517374 /nfs/dbraw/zinc/51/73/74/871517374.db2.gz QWRQDHRKJQEDRD-OYHNWAKOSA-N 0 3 404.407 4.168 20 0 HIADHN CC(C)[C@@H]1C[C@H](NCc2ccc(N3CCCS3(=O)=O)c(F)c2)c2ccccc21 ZINC000447608825 871518360 /nfs/dbraw/zinc/51/83/60/871518360.db2.gz WKKCUIQPOKIMFU-FPOVZHCZSA-N 0 3 402.535 4.340 20 0 HIADHN CCOc1ccc([C@H](N[C@H]2CCCN(CC(F)(F)F)C2=O)C(C)C)cc1OCC ZINC000447886677 871800850 /nfs/dbraw/zinc/80/08/50/871800850.db2.gz ULVIGGQKWBVOEI-QFBILLFUSA-N 0 3 416.484 4.324 20 0 HIADHN COc1cccc2sc(NC(=O)CN[C@H](C[C@H]3CCOC3)c3ccccc3)nc21 ZINC000447889249 871803217 /nfs/dbraw/zinc/80/32/17/871803217.db2.gz GYKDGNBVSGPYFU-NVXWUHKLSA-N 0 3 411.527 4.001 20 0 HIADHN CCC(CC)(CN[C@H](C)C(=O)Nc1ccc(Cl)cc1C(F)(F)F)C(=O)OC ZINC000447890526 871803419 /nfs/dbraw/zinc/80/34/19/871803419.db2.gz LTENUEADSWLJPV-LLVKDONJSA-N 0 3 408.848 4.255 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3cccc4c3OCC[C@H]4OC)c(C)c2)CC1 ZINC000447893902 871805803 /nfs/dbraw/zinc/80/58/03/871805803.db2.gz AXSSSIBAOCQHAZ-JOCHJYFZSA-N 0 3 424.545 4.251 20 0 HIADHN Cc1oc2ccccc2c1CNC(=O)N1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000468530727 882553150 /nfs/dbraw/zinc/55/31/50/882553150.db2.gz ROFBFZLGZLKLHV-ROUUACIJSA-N 0 3 413.562 4.162 20 0 HIADHN CO[C@@H]1CCOc2c(NC(=O)N(CCCc3ccccc3)CCN(C)C)cccc21 ZINC000448050423 871881292 /nfs/dbraw/zinc/88/12/92/871881292.db2.gz OGHIWAFUOMHWIK-JOCHJYFZSA-N 0 3 411.546 4.185 20 0 HIADHN CCCN(C(=O)NC[C@]1(C)CCO[C@H]1C1CC1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000468536207 882569634 /nfs/dbraw/zinc/56/96/34/882569634.db2.gz LSSSQBHBYAQPRS-LSQMVHIFSA-N 0 3 413.606 4.278 20 0 HIADHN Cc1nn(C(C)(C)C)cc1[C@@H](C)NC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000468566547 882626399 /nfs/dbraw/zinc/62/63/99/882626399.db2.gz OZWWRYQWEYXKTQ-APWZRJJASA-N 0 3 400.542 4.175 20 0 HIADHN CN1CCC(N(Cc2ccccc2Br)C(=O)NCCC(F)(F)F)CC1 ZINC000460373794 873010145 /nfs/dbraw/zinc/01/01/45/873010145.db2.gz UIVNQOYXMRKHQT-UHFFFAOYSA-N 0 3 422.289 4.007 20 0 HIADHN CCC[C@H]1C[C@H]1NC(=O)N(Cc1ccccc1Br)C1CCN(C)CC1 ZINC000460396322 873046362 /nfs/dbraw/zinc/04/63/62/873046362.db2.gz ZYWSUPGQRNFPFS-HNAYVOBHSA-N 0 3 408.384 4.244 20 0 HIADHN O=C(CC1(N2CCOCC2)CCCC1)N1CCC[C@@H]1Cc1c(F)cccc1Cl ZINC000468594110 882683203 /nfs/dbraw/zinc/68/32/03/882683203.db2.gz DLCPAJDXDCIHHZ-QGZVFWFLSA-N 0 3 408.945 4.048 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N(C)Cc3cccc(C(F)(F)F)c3)cc2)CC1 ZINC000468600298 882696909 /nfs/dbraw/zinc/69/69/09/882696909.db2.gz TVGVCEKCIKXTBY-UHFFFAOYSA-N 0 3 405.464 4.120 20 0 HIADHN CN1CCC(N(Cc2ccccc2Br)C(=O)N[C@@H]2C=CCCC2)CC1 ZINC000460510490 873198030 /nfs/dbraw/zinc/19/80/30/873198030.db2.gz JUNHKRCXJBBDKZ-QGZVFWFLSA-N 0 3 406.368 4.164 20 0 HIADHN CCOCCCn1c([C@H](CC)c2ccccc2)nnc1N1C[C@@H](C)N(CC)C[C@H]1C ZINC000460765525 873608940 /nfs/dbraw/zinc/60/89/40/873608940.db2.gz ALOHMGVCNDLUCR-KCZVDYSFSA-N 0 3 413.610 4.166 20 0 HIADHN CCN1C[C@@H](C)N(c2nnc([C@H]3OCC[C@H]3c3ccccc3)n2CC(C)C)C[C@H]1C ZINC000460919465 873824392 /nfs/dbraw/zinc/82/43/92/873824392.db2.gz XFFWRMXXCRIMRT-WKDRNLAYSA-N 0 3 411.594 4.098 20 0 HIADHN CC(C)CN(C(=O)CCNc1ncc(C(F)(F)F)cc1Cl)C1CCN(C)CC1 ZINC000460988184 873875270 /nfs/dbraw/zinc/87/52/70/873875270.db2.gz NTHLDEUQFDQOBM-UHFFFAOYSA-N 0 3 420.907 4.135 20 0 HIADHN Cc1cc(C)c(Br)c(C(=O)Nc2ccc(OC3CCN(C)CC3)nc2)c1 ZINC000461025437 873891747 /nfs/dbraw/zinc/89/17/47/873891747.db2.gz QSTJATVUMUOTHF-UHFFFAOYSA-N 0 3 418.335 4.186 20 0 HIADHN C[C@H](C(=O)NC1CCN(CCOc2ccc(Cl)cc2)CC1)c1cccc(F)c1 ZINC000461052889 873926742 /nfs/dbraw/zinc/92/67/42/873926742.db2.gz GXTSCKIGOZXKJE-INIZCTEOSA-N 0 3 404.913 4.242 20 0 HIADHN CC[C@H](C)c1nnc(N2C[C@H](C)N(Cc3ccccc3)C[C@@H]2C)n1C[C@@H]1CCCO1 ZINC000461073387 873969674 /nfs/dbraw/zinc/96/96/74/873969674.db2.gz ZQUFEGWWIAIIKF-XWUOBKMESA-N 0 3 411.594 4.070 20 0 HIADHN COc1ccc([C@H](Cc2ccccc2C)NC(=O)CN2[C@H](C)CC[C@H]2C)cc1OC ZINC000468704486 882822301 /nfs/dbraw/zinc/82/23/01/882822301.db2.gz VIQMLTBEKDSBLB-KNKQGSTJSA-N 0 3 410.558 4.285 20 0 HIADHN CO[C@]1(CNCc2c(C)nn(-c3ccccc3)c2Oc2ccc(F)cc2)CCOC1 ZINC000461404564 874417320 /nfs/dbraw/zinc/41/73/20/874417320.db2.gz GICQLUXZTIYWRR-QHCPKHFHSA-N 0 3 411.477 4.007 20 0 HIADHN Cc1ccc(C)c(C(=O)CCC(=O)N2C[C@@H]3CCN(Cc4ccccc4)C[C@@H]3C2)c1 ZINC000461445262 874502933 /nfs/dbraw/zinc/50/29/33/874502933.db2.gz MUFWGMOZEHATCV-XZOQPEGZSA-N 0 3 404.554 4.247 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(F)cc2)CC1)c1cc2c(s1)CCCC2 ZINC000461449297 874507555 /nfs/dbraw/zinc/50/75/55/874507555.db2.gz SBJUWJZXKOHCNW-UHFFFAOYSA-N 0 3 402.535 4.039 20 0 HIADHN CC[C@H](CN(C)C(=O)N[C@H](C)C1=CCN(C)CC1)Oc1ccc(Cl)c(Cl)c1 ZINC000468745763 882839864 /nfs/dbraw/zinc/83/98/64/882839864.db2.gz WEIHURNFXBBTLN-GDBMZVCRSA-N 0 3 414.377 4.443 20 0 HIADHN O=C1[C@@H](NCc2cccc(-c3ccncc3)c2)CCCN1Cc1ccc(F)cc1F ZINC000468760272 882846667 /nfs/dbraw/zinc/84/66/67/882846667.db2.gz AHEFMBOOYRBNMK-QHCPKHFHSA-N 0 3 407.464 4.308 20 0 HIADHN O=C(Nc1cccc(Oc2cccnn2)c1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000461563585 874659186 /nfs/dbraw/zinc/65/91/86/874659186.db2.gz FHNQYBYMXYIIOV-GOSISDBHSA-N 0 3 406.461 4.259 20 0 HIADHN COc1ccc(C(=O)N2CCN(Cc3ccccc3)C3(CCCCC3)C2)cc1OC ZINC000461571430 874671887 /nfs/dbraw/zinc/67/18/87/874671887.db2.gz GWWJVLAVFZHAAF-UHFFFAOYSA-N 0 3 408.542 4.365 20 0 HIADHN CCCN(C(=O)NCC[C@H](OC)C(F)(F)F)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000468768481 882851512 /nfs/dbraw/zinc/85/15/12/882851512.db2.gz APZXKUJGPLKQEQ-MOPGFXCFSA-N 0 3 415.500 4.040 20 0 HIADHN O=C([C@@H]1CC(=O)Nc2ccccc21)N1CCN(Cc2ccccc2)C2(CCCCC2)C1 ZINC000461598027 874723452 /nfs/dbraw/zinc/72/34/52/874723452.db2.gz FXZLFZXUFCZWMP-JOCHJYFZSA-N 0 3 417.553 4.160 20 0 HIADHN COCCOCc1ccc(C(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)cc1 ZINC000461738133 874882856 /nfs/dbraw/zinc/88/28/56/874882856.db2.gz ROGCUTKPNXSFCA-NRFANRHFSA-N 0 3 416.587 4.114 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1sc(C(F)(F)F)nc1C)c1cccc(OC)c1 ZINC000461795860 874910690 /nfs/dbraw/zinc/91/06/90/874910690.db2.gz KZBVDAGLOPAYKS-OAHLLOKOSA-N 0 3 415.481 4.292 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3ccnc(N4CCC[C@@H](C)C4)c3)c(C)c2)CC1 ZINC000461798750 874911831 /nfs/dbraw/zinc/91/18/31/874911831.db2.gz WSVGILVVQDOPHX-LJQANCHMSA-N 0 3 421.589 4.021 20 0 HIADHN CC[C@@H](c1nnc(N(C)[C@@H]2CCN(C3CC3)C2)n1C[C@@H]1CCCCO1)c1ccccc1 ZINC000461817701 874938336 /nfs/dbraw/zinc/93/83/36/874938336.db2.gz AWDZBHKOKPYQCX-XPWALMASSA-N 0 3 423.605 4.062 20 0 HIADHN CCOC(=O)[C@](C)(CN[C@H](C)C(=O)Nc1cccc(Cl)c1Cl)c1ccccc1 ZINC000468827451 882878758 /nfs/dbraw/zinc/87/87/58/882878758.db2.gz DJDMEYYTROJDQF-SPLOXXLWSA-N 0 3 423.340 4.431 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)N[C@H]2CCCc3cn(C4CCCC4)nc32)c1 ZINC000461958622 875086952 /nfs/dbraw/zinc/08/69/52/875086952.db2.gz NLAAJLYONKRMJG-QHCPKHFHSA-N 0 3 423.605 4.457 20 0 HIADHN C[C@@H](CC(=O)Nc1ccc(CCN2CCSCC2)cc1)C(=O)c1cccc(F)c1 ZINC000468867842 882898102 /nfs/dbraw/zinc/89/81/02/882898102.db2.gz GTPKIBGSIWQUIK-KRWDZBQOSA-N 0 3 414.546 4.265 20 0 HIADHN O=C(CCN1CCN(c2ccccc2)CC1)Nc1ccccc1N1CCCCCC1 ZINC000462033383 875148865 /nfs/dbraw/zinc/14/88/65/875148865.db2.gz SUTUFPCYLQZLTR-UHFFFAOYSA-N 0 3 406.574 4.218 20 0 HIADHN CN(C(=O)N[C@H]1CCc2sc(Cl)cc21)C1CCN(CCc2ccccn2)CC1 ZINC000462057569 875170930 /nfs/dbraw/zinc/17/09/30/875170930.db2.gz GRJHWULXEMJFLZ-SFHVURJKSA-N 0 3 418.994 4.132 20 0 HIADHN Cc1nc(C(F)(F)F)sc1C(=O)NC[C@H]1CCCN(C)[C@H]1c1cccs1 ZINC000462137180 875237171 /nfs/dbraw/zinc/23/71/71/875237171.db2.gz ASHCLLBAFDZIQX-DGCLKSJQSA-N 0 3 403.495 4.345 20 0 HIADHN Cc1ccc(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)cc1NC(=O)c1ccco1 ZINC000462185854 875288913 /nfs/dbraw/zinc/28/89/13/875288913.db2.gz BMJFCTAYVYFKMS-XMSQKQJNSA-N 0 3 417.509 4.091 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1cccc(NC(=O)c2cccs2)c1 ZINC000462187428 875292325 /nfs/dbraw/zinc/29/23/25/875292325.db2.gz IHPNUXKBEDYDPA-DYESRHJHSA-N 0 3 419.550 4.251 20 0 HIADHN COc1ccc(C(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)cc1-c1ccccn1 ZINC000462190837 875296392 /nfs/dbraw/zinc/29/63/92/875296392.db2.gz OXHOIGRTZRJSOE-MBSDFSHPSA-N 0 3 401.510 4.008 20 0 HIADHN C[C@H](C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C)c1ccc(Br)s1 ZINC000462194544 875302844 /nfs/dbraw/zinc/30/28/44/875302844.db2.gz IPEZIEANLRYTOP-IJEWVQPXSA-N 0 3 407.377 4.251 20 0 HIADHN C[C@@H]1CCCN(c2cc(C(=O)N(C)[C@H]3CCCN(Cc4ccccc4)C3)ccn2)C1 ZINC000462196792 875303923 /nfs/dbraw/zinc/30/39/23/875303923.db2.gz BGTPZNZABHHBJI-OFNKIYASSA-N 0 3 406.574 4.055 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)CCCc1ncc(-c2ccccc2)o1 ZINC000462197941 875307180 /nfs/dbraw/zinc/30/71/80/875307180.db2.gz WUNYHNRKSRGBOT-SIKLNZKXSA-N 0 3 403.526 4.301 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)NC[C@@H](Cc2ccccc2)C(F)(F)F)CC1 ZINC000462223719 875332186 /nfs/dbraw/zinc/33/21/86/875332186.db2.gz KYHAYCSOGVCQPH-GOSISDBHSA-N 0 3 423.479 4.307 20 0 HIADHN Cc1ccc(NC(=O)C(C)C)cc1NC(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C ZINC000462239442 875353352 /nfs/dbraw/zinc/35/33/52/875353352.db2.gz FYRRFVQUEAPSED-XMSQKQJNSA-N 0 3 408.546 4.232 20 0 HIADHN CC(C)CC(=O)Nc1ccc(NC(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)cc1 ZINC000462241415 875356586 /nfs/dbraw/zinc/35/65/86/875356586.db2.gz ODOAAKPLKLRKAJ-AVRDEDQJSA-N 0 3 408.546 4.313 20 0 HIADHN COc1ccc(Br)c(NC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)c1 ZINC000462253586 875375384 /nfs/dbraw/zinc/37/53/84/875375384.db2.gz IEHBOGPSKOFJHJ-IFXJQAMLSA-N 0 3 418.335 4.100 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)c(C)c1 ZINC000462258469 875382563 /nfs/dbraw/zinc/38/25/63/875382563.db2.gz LMSATGLMCQKPIW-SFYKDHMMSA-N 0 3 422.573 4.165 20 0 HIADHN COCCOc1c(Cl)cccc1NC(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C ZINC000462268602 875396568 /nfs/dbraw/zinc/39/65/68/875396568.db2.gz QBQBUGACQSLQPO-JXFKEZNVSA-N 0 3 417.937 4.007 20 0 HIADHN COc1ccc(NC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)c(C(F)(F)F)c1 ZINC000462275234 875403258 /nfs/dbraw/zinc/40/32/58/875403258.db2.gz RWTHQIUVUKXGRY-IFXJQAMLSA-N 0 3 407.436 4.356 20 0 HIADHN Cc1cc(S(=O)(=O)N(C)[C@@H]2CCN(Cc3ccccc3)[C@@H](C)C2)cc(C)c1F ZINC000462339476 875454512 /nfs/dbraw/zinc/45/45/12/875454512.db2.gz IAMXRZUQTMZOBX-AZUAARDMSA-N 0 3 404.551 4.116 20 0 HIADHN Cc1cccc2c1ncc(C)c2N1CCC(C(=O)Nc2ccc3c(c2)OCO3)CC1 ZINC000462436805 875542723 /nfs/dbraw/zinc/54/27/23/875542723.db2.gz PBPHBWWVZKRDCH-UHFFFAOYSA-N 0 3 403.482 4.435 20 0 HIADHN Fc1cccc(-c2ccc(CNCc3cnc(N4CCOCC4)c(F)c3)s2)c1 ZINC000462542911 875664388 /nfs/dbraw/zinc/66/43/88/875664388.db2.gz HDJMEVXGABCILL-UHFFFAOYSA-N 0 3 401.482 4.215 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Nc1ccccc1CC(=O)OC(C)(C)C ZINC000462665222 875765248 /nfs/dbraw/zinc/76/52/48/875765248.db2.gz VZEMCAGMPVHDQA-PGRDOPGGSA-N 0 3 423.557 4.213 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)Nc1ccc(OCC2CCOCC2)cc1 ZINC000462685849 875778594 /nfs/dbraw/zinc/77/85/94/875778594.db2.gz VZHBMAUZGMGOSC-CYFREDJKSA-N 0 3 423.557 4.134 20 0 HIADHN CCc1noc(-c2ccc(C)c(NC(=O)N[C@H]3CN(Cc4ccccc4)C[C@H]3C)c2)n1 ZINC000462686078 875778600 /nfs/dbraw/zinc/77/86/00/875778600.db2.gz SYKZPHDKLSULGI-UTKZUKDTSA-N 0 3 419.529 4.249 20 0 HIADHN C[C@@H](CNCc1cnn(-c2ccc(Br)cc2)c1)Oc1ccccc1F ZINC000462733412 875807192 /nfs/dbraw/zinc/80/71/92/875807192.db2.gz IOWGLWJGRRGFBQ-AWEZNQCLSA-N 0 3 404.283 4.331 20 0 HIADHN C[C@@H]1C[C@H]1N1C[C@H](NCc2cn(C(C)(C)C)nc2-c2ccccc2Cl)CC1=O ZINC000462747398 875815484 /nfs/dbraw/zinc/81/54/84/875815484.db2.gz VCQFFEYUQLPKCQ-IDHHARJASA-N 0 3 400.954 4.057 20 0 HIADHN FC(F)(F)c1cc(Cl)c2nnc(CN[C@@H]3CCC[C@H]([C@H]4CCOC4)C3)n2c1 ZINC000462791868 875843053 /nfs/dbraw/zinc/84/30/53/875843053.db2.gz SSTCJWXJCGQBLP-SGMGOOAPSA-N 0 3 402.848 4.086 20 0 HIADHN COc1ccc(C[C@@H](NCc2cn(C)nc2C(F)F)c2ccccc2)cc1OC ZINC000462797147 875845415 /nfs/dbraw/zinc/84/54/15/875845415.db2.gz CANLVFVGBVVGIO-GOSISDBHSA-N 0 3 401.457 4.449 20 0 HIADHN C[C@@H](NCc1ccc(C(=O)N2CCN(C)CC2)cc1)c1ccc(OC(C)(C)C)cc1 ZINC000462810273 875854921 /nfs/dbraw/zinc/85/49/21/875854921.db2.gz ZYHXUDVMHCEXDF-LJQANCHMSA-N 0 3 409.574 4.102 20 0 HIADHN CNc1cc(N2CCC[C@@H]2CN[C@@H](C)c2csc(-c3ccccc3F)n2)ncn1 ZINC000462817196 875858867 /nfs/dbraw/zinc/85/88/67/875858867.db2.gz NBICUBOAFPLIGE-LSDHHAIUSA-N 0 3 412.538 4.101 20 0 HIADHN COc1cccc(C[C@H](NCc2cnc(N3CCOCC3)c(F)c2)c2ccccc2)c1 ZINC000462835953 875869919 /nfs/dbraw/zinc/86/99/19/875869919.db2.gz UHDKNDWZSOKUEA-DEOSSOPVSA-N 0 3 421.516 4.140 20 0 HIADHN C[C@H]1C[C@@H](NCc2cnc(N3CCOCC3)c(F)c2)c2cccc(Br)c21 ZINC000462837469 875872462 /nfs/dbraw/zinc/87/24/62/875872462.db2.gz XNKPLKVVHXGKAX-SCLBCKFNSA-N 0 3 420.326 4.158 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](N[C@@H]2CCO[C@H](C3CC3)C2)c2ccc(F)c(F)c2)c1 ZINC000462840247 875874963 /nfs/dbraw/zinc/87/49/63/875874963.db2.gz QLHSNYYHBJKSQX-WTNAPCKOSA-N 0 3 421.509 4.005 20 0 HIADHN CC[C@H](NCc1cnc(N2CCOCC2)c(F)c1)c1ccc2cc(OC)ccc2c1 ZINC000462843558 875879086 /nfs/dbraw/zinc/87/90/86/875879086.db2.gz JTLAFYLOSAXIFG-QHCPKHFHSA-N 0 3 409.505 4.460 20 0 HIADHN CN(CCc1cccc(Br)c1)C(=O)c1cccc(CN2CCCC2)c1 ZINC000462847123 875882094 /nfs/dbraw/zinc/88/20/94/875882094.db2.gz VVCVCDJZMVHEST-UHFFFAOYSA-N 0 3 401.348 4.360 20 0 HIADHN COC(=O)CCCN1CCC(Nc2cnn(-c3ccc(Cl)cc3Cl)c2)CC1 ZINC000462902381 875927855 /nfs/dbraw/zinc/92/78/55/875927855.db2.gz IZQPDMMWBKAQDA-UHFFFAOYSA-N 0 3 411.333 4.009 20 0 HIADHN COC(=O)CCCN1CCC(Nc2cccc(COc3ccc(F)cc3)c2)CC1 ZINC000462903873 875929431 /nfs/dbraw/zinc/92/94/31/875929431.db2.gz SPLYDSKONSNMSE-UHFFFAOYSA-N 0 3 400.494 4.234 20 0 HIADHN COC(=O)CCCN1CCC(Nc2cc(Cl)ccc2OC[C@H]2CCCCO2)CC1 ZINC000462903773 875929949 /nfs/dbraw/zinc/92/99/49/875929949.db2.gz BUADTECTSVQLMW-LJQANCHMSA-N 0 3 424.969 4.117 20 0 HIADHN CCN(CC)C(=O)Nc1ccc([C@@H](C)N[C@H]2CC(=O)N(c3ccccc3F)C2)cc1 ZINC000462944615 875966571 /nfs/dbraw/zinc/96/65/71/875966571.db2.gz FVVNGNHKRMLDMZ-APWZRJJASA-N 0 3 412.509 4.156 20 0 HIADHN COc1cc(CN(C)C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)ccc1SC ZINC000463023247 876042157 /nfs/dbraw/zinc/04/21/57/876042157.db2.gz UQNPYNRKGMENCL-FXAWDEMLSA-N 0 3 413.587 4.079 20 0 HIADHN OC[C@@]1(Cc2ccccc2)CCCN(Cc2ccccc2OCc2cccnc2)C1 ZINC000463029625 876049337 /nfs/dbraw/zinc/04/93/37/876049337.db2.gz AOXROKJHECFWIC-AREMUKBSSA-N 0 3 402.538 4.478 20 0 HIADHN CCOc1c(Br)cc(CN(CC)[C@@H]2CCOC2)cc1Br ZINC000463042168 876069490 /nfs/dbraw/zinc/06/94/90/876069490.db2.gz IMKIUWXPYONHPO-GFCCVEGCSA-N 0 3 407.146 4.221 20 0 HIADHN Cc1nc2ccccc2n1CCCCCN1CCCN(C(=O)c2ccsc2)CC1 ZINC000463069748 876100536 /nfs/dbraw/zinc/10/05/36/876100536.db2.gz AYULORDEEMYWHU-UHFFFAOYSA-N 0 3 410.587 4.425 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)c3cccc(F)c3Cl)CC2)c1 ZINC000463090003 876122844 /nfs/dbraw/zinc/12/28/44/876122844.db2.gz BINHOQVSZKNFFR-UHFFFAOYSA-N 0 3 403.929 4.120 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cccc(-c2noc(C3CC3)n2)c1)c1ccsc1 ZINC000463108328 876146319 /nfs/dbraw/zinc/14/63/19/876146319.db2.gz SRYAQCLUAZTLNN-IBGZPJMESA-N 0 3 410.543 4.488 20 0 HIADHN COc1ccc(-n2ccc(CNC3CCN(Cc4ccccc4Cl)CC3)n2)cc1 ZINC000463114831 876155210 /nfs/dbraw/zinc/15/52/10/876155210.db2.gz JKAZOBGCQRHTBK-UHFFFAOYSA-N 0 3 410.949 4.289 20 0 HIADHN C[C@H](C(=O)N[C@@H]1CCO[C@@H](c2ccccc2)C1)N1CCC(Cc2ccccc2)CC1 ZINC000463118619 876162037 /nfs/dbraw/zinc/16/20/37/876162037.db2.gz DHFDIHPXJHBEHC-NIJXNBFTSA-N 0 3 406.570 4.366 20 0 HIADHN COc1cc(OC)c(CNC2CCN(Cc3ccccc3Cl)CC2)c(OC)c1 ZINC000463147432 876202085 /nfs/dbraw/zinc/20/20/85/876202085.db2.gz VPAQXHYPALZIGT-UHFFFAOYSA-N 0 3 404.938 4.120 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)c2cccc(-c3noc(C4CC4)n3)c2)C1 ZINC000463155167 876207567 /nfs/dbraw/zinc/20/75/67/876207567.db2.gz HFJHGHAGXBFGLE-KKSFZXQISA-N 0 3 402.498 4.179 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)c2cccc(-c3noc(C4CC4)n3)c2)C1 ZINC000463155164 876207981 /nfs/dbraw/zinc/20/79/81/876207981.db2.gz HFJHGHAGXBFGLE-HRAATJIYSA-N 0 3 402.498 4.179 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)cc1C(=O)N(CCN(C)C)Cc1ccccc1F ZINC000463159994 876213506 /nfs/dbraw/zinc/21/35/06/876213506.db2.gz IHFCVSKMTSPWBA-UHFFFAOYSA-N 0 3 414.912 4.177 20 0 HIADHN Cc1nc(-c2cccc(NC(=O)CN3CCCC[C@@H]3[C@H]3CCCC[C@@H]3O)c2)cs1 ZINC000463195482 876254061 /nfs/dbraw/zinc/25/40/61/876254061.db2.gz XUMCFCUWMQAUMB-FCEUIQTBSA-N 0 3 413.587 4.463 20 0 HIADHN O=C(CN1CCCC[C@@H]1[C@@H]1CCCC[C@H]1O)NCc1ccccc1OC1CCCC1 ZINC000463201619 876262753 /nfs/dbraw/zinc/26/27/53/876262753.db2.gz MGKQOLYYBRIDEG-YTFSRNRJSA-N 0 3 414.590 4.030 20 0 HIADHN CN(C(=O)N[C@@H]1CCO[C@H](c2ccccc2)C1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000463225313 876282976 /nfs/dbraw/zinc/28/29/76/876282976.db2.gz HHHUSJLFHJXMMD-SGNDLWITSA-N 0 3 407.558 4.213 20 0 HIADHN CN(C(=O)N[C@@H]1CCO[C@@H](c2ccccc2)C1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000463225316 876283699 /nfs/dbraw/zinc/28/36/99/876283699.db2.gz HHHUSJLFHJXMMD-WXFUMESZSA-N 0 3 407.558 4.213 20 0 HIADHN O=C(c1ccccc1Cl)N1CCC(N[C@H](CO)c2cccc(Cl)c2F)CC1 ZINC000463248308 876305869 /nfs/dbraw/zinc/30/58/69/876305869.db2.gz SWNZXPKFFCBXFM-GOSISDBHSA-N 0 3 411.304 4.060 20 0 HIADHN C[N@H+](CCCC1CCOCC1)Cc1cccc([N-]S(=O)(=O)c2ccccc2)c1 ZINC000463300279 876361694 /nfs/dbraw/zinc/36/16/94/876361694.db2.gz LTWIHXOIFVUPFT-UHFFFAOYSA-N 0 3 402.560 4.126 20 0 HIADHN C[N@@H+](CCCC1CCOCC1)Cc1cccc([N-]S(=O)(=O)c2ccccc2)c1 ZINC000463300279 876361702 /nfs/dbraw/zinc/36/17/02/876361702.db2.gz LTWIHXOIFVUPFT-UHFFFAOYSA-N 0 3 402.560 4.126 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1csc2cncn21)c1ccc(C(F)(F)F)cc1 ZINC000468955570 883022442 /nfs/dbraw/zinc/02/24/42/883022442.db2.gz LPMSGHNOYFGWNH-HNNXBMFYSA-N 0 3 410.465 4.228 20 0 HIADHN CN(CCc1cccc(Br)c1)C(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000463401314 876456086 /nfs/dbraw/zinc/45/60/86/876456086.db2.gz CESRLUUZLQHXEY-PMACEKPBSA-N 0 3 416.363 4.078 20 0 HIADHN Oc1ccc2c(c1)C1(CC1)CN(C/C=C\CN1Cc3ccc(O)cc3C3(CC3)C1)C2 ZINC000463422993 876478070 /nfs/dbraw/zinc/47/80/70/876478070.db2.gz BDHTYTBVYBHPAW-UPHRSURJSA-N 0 3 402.538 4.049 20 0 HIADHN Cc1cc(C)c(CN2CC[C@](CO)(c3ccccc3)C2)c(OCc2ccccc2)n1 ZINC000463432271 876487835 /nfs/dbraw/zinc/48/78/35/876487835.db2.gz UHCXYZXPOZTVLY-SANMLTNESA-N 0 3 402.538 4.413 20 0 HIADHN C[C@H]1CCc2onc(C(=O)N(CCN(C)C)Cc3ccc(C(F)(F)F)cc3)c2C1 ZINC000468973351 883040737 /nfs/dbraw/zinc/04/07/37/883040737.db2.gz LSUINCBANREORG-AWEZNQCLSA-N 0 3 409.452 4.022 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)[C@H]1C[C@H]1c1cc(F)c(F)c(F)c1 ZINC000463526034 876596227 /nfs/dbraw/zinc/59/62/27/876596227.db2.gz DGIAWMQFESUOCT-GJZGRUSLSA-N 0 3 412.402 4.076 20 0 HIADHN Cc1cc(Br)cc(C(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)c1 ZINC000463568940 876661175 /nfs/dbraw/zinc/66/11/75/876661175.db2.gz KYFIUMVOIRFXOW-CALCHBBNSA-N 0 3 423.395 4.109 20 0 HIADHN Cc1nn(C)c(Sc2ccccc2)c1C(=O)N[C@H](C)CN(C)Cc1ccccc1 ZINC000463689957 876810498 /nfs/dbraw/zinc/81/04/98/876810498.db2.gz ZVHSEVBOULPYAH-QGZVFWFLSA-N 0 3 408.571 4.130 20 0 HIADHN CN(C)[C@H](CNC(=O)Nc1cccc(-c2ncc3n2CCCC3)c1)c1ccccc1 ZINC000463696694 876816992 /nfs/dbraw/zinc/81/69/92/876816992.db2.gz JKLGUNXOVIBZCW-JOCHJYFZSA-N 0 3 403.530 4.311 20 0 HIADHN CCCN(C(=O)CCCn1c(C)cc(=O)cc1C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000463718959 876838364 /nfs/dbraw/zinc/83/83/64/876838364.db2.gz WQSHZBYFNPSLBK-XMMPIXPASA-N 0 3 423.601 4.149 20 0 HIADHN CC(C)(C)C(=O)Nc1ccc(F)c(C(=O)NC[C@@H]2CCCN2Cc2ccccc2)c1 ZINC000463740726 876860653 /nfs/dbraw/zinc/86/06/53/876860653.db2.gz FGGJCIBIRUOQNI-IBGZPJMESA-N 0 3 411.521 4.205 20 0 HIADHN C[C@@H](C(=O)NC[C@@H]1CCCN1Cc1ccccc1)c1ccc(Br)s1 ZINC000463742205 876863618 /nfs/dbraw/zinc/86/36/18/876863618.db2.gz VFGRXJCEXOPETL-ZBFHGGJFSA-N 0 3 407.377 4.395 20 0 HIADHN COc1ccc(Cn2nc(C)c(CNCc3cc(OC)nc4ccccc34)c2C)cc1 ZINC000463747572 876869712 /nfs/dbraw/zinc/86/97/12/876869712.db2.gz SLPVNOZQPGMNGZ-UHFFFAOYSA-N 0 3 416.525 4.403 20 0 HIADHN Cn1cc(N2CCC[C@H](N[C@H](CCCc3ccccc3)c3ccccc3)C2=O)cn1 ZINC000463900039 877021940 /nfs/dbraw/zinc/02/19/40/877021940.db2.gz ZAEFIWVHKDNYKR-RPWUZVMVSA-N 0 3 402.542 4.269 20 0 HIADHN Cc1cc(N2CC[C@@H](N[C@@H](Cc3ccccc3Cl)c3ccccc3)C2=O)n(C)n1 ZINC000463906919 877029369 /nfs/dbraw/zinc/02/93/69/877029369.db2.gz VENHZXGPZYRYEI-RTWAWAEBSA-N 0 3 408.933 4.061 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N[C@H](C)c1cn(C(C)(C)C)nc1C)c1ccsc1 ZINC000464136535 877298581 /nfs/dbraw/zinc/29/85/81/877298581.db2.gz BNMLDSLDFONCRL-BEFAXECRSA-N 0 3 405.612 4.451 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)N(C)CCc1cccc(Br)c1)c1ccco1 ZINC000464392258 877593787 /nfs/dbraw/zinc/59/37/87/877593787.db2.gz HIIYYZSZLOISOV-QAPCUYQASA-N 0 3 422.367 4.355 20 0 HIADHN Cc1cccc(S(=O)(=O)CCCN[C@H](C)c2cccc(OCc3ccccn3)c2)c1 ZINC000464480907 877701504 /nfs/dbraw/zinc/70/15/04/877701504.db2.gz MVDNVSVVHFXPHD-HXUWFJFHSA-N 0 3 424.566 4.484 20 0 HIADHN COc1cc([C@@H](C)NCCCS(=O)(=O)c2cccc(C)c2)ccc1OC(C)C ZINC000464481025 877701620 /nfs/dbraw/zinc/70/16/20/877701620.db2.gz NSQBIQUCZDNIJI-GOSISDBHSA-N 0 3 405.560 4.305 20 0 HIADHN CC[C@@H]1CCCCN1CCNC(=O)C(=O)Nc1cc(Cl)ccc1SC(C)C ZINC000503317226 912296445 /nfs/dbraw/zinc/29/64/45/912296445.db2.gz SNIUSMLNWIUFNH-MRXNPFEDSA-N 0 3 411.999 4.160 20 0 HIADHN Cc1nn(C)c(C)c1NC(=O)[C@H](C)N[C@H](COc1c(C)cccc1C)C(C)(C)C ZINC000464785828 878032616 /nfs/dbraw/zinc/03/26/16/878032616.db2.gz GWRUSARDCFITHA-PKOBYXMFSA-N 0 3 400.567 4.064 20 0 HIADHN CCN(CC(=O)Nc1sc(C)c(C)c1C)CC1CCN(c2ccccn2)CC1 ZINC000464812822 878063993 /nfs/dbraw/zinc/06/39/93/878063993.db2.gz WSUDOPQZBZMHCV-UHFFFAOYSA-N 0 3 400.592 4.245 20 0 HIADHN C[C@@H](C(=O)N1CCC[C@@H]1c1cccs1)N1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC000464839508 878106986 /nfs/dbraw/zinc/10/69/86/878106986.db2.gz PWILBTDEGAWYKK-RZUBCFFCSA-N 0 3 411.615 4.397 20 0 HIADHN CCN(Cc1ccc(OCc2ccccc2)cc1)C(=O)CN1CCC[C@H]2COCC[C@@H]21 ZINC000464851554 878131014 /nfs/dbraw/zinc/13/10/14/878131014.db2.gz PRMDJVRPJNLDLQ-ZCYQVOJMSA-N 0 3 422.569 4.115 20 0 HIADHN COC(=O)c1ccc(CN(C)CCCc2cc(-c3ccc(F)cc3)n(C)n2)cc1F ZINC000464865639 878148311 /nfs/dbraw/zinc/14/83/11/878148311.db2.gz IZVJWBBVWQQKST-UHFFFAOYSA-N 0 3 413.468 4.217 20 0 HIADHN CCOc1c(Cl)cc(C(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)cc1OC ZINC000464888379 878186775 /nfs/dbraw/zinc/18/67/75/878186775.db2.gz DTVMJKYWYXYVKO-KRWDZBQOSA-N 0 3 416.949 4.484 20 0 HIADHN C[C@H]1CCN(C(=O)c2ccnc(SCC(F)(F)F)c2)CCN1Cc1ccccc1 ZINC000464891897 878193774 /nfs/dbraw/zinc/19/37/74/878193774.db2.gz INGYQSBNNJRSFA-INIZCTEOSA-N 0 3 423.504 4.473 20 0 HIADHN COCCn1cc(C(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)c2ccccc21 ZINC000464895410 878198878 /nfs/dbraw/zinc/19/88/78/878198878.db2.gz RJIWYTHXBFIFPR-HXUWFJFHSA-N 0 3 405.542 4.024 20 0 HIADHN COc1ccc(CCC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)cc1Cl ZINC000464895563 878200719 /nfs/dbraw/zinc/20/07/19/878200719.db2.gz MOSOVKNGZCRGES-GOSISDBHSA-N 0 3 400.950 4.404 20 0 HIADHN Cc1ccccc1C1(C(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)CCOCC1 ZINC000464897475 878202532 /nfs/dbraw/zinc/20/25/32/878202532.db2.gz WBHZRPHYGJQYEL-QFIPXVFZSA-N 0 3 406.570 4.166 20 0 HIADHN CCOc1cccc(CNC(=O)c2cccc(CN3CCCC3)c2)c1OC(F)F ZINC000465045674 878408284 /nfs/dbraw/zinc/40/82/84/878408284.db2.gz FNQKWJGTXYDZSB-UHFFFAOYSA-N 0 3 404.457 4.213 20 0 HIADHN C[C@@H](NC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1)c1cccc(-n2cccn2)c1 ZINC000465206232 878614138 /nfs/dbraw/zinc/61/41/38/878614138.db2.gz NGHNPKUQIBEWLA-NQIIRXRSSA-N 0 3 406.505 4.101 20 0 HIADHN CC1CCN([C@H](CNC(=O)N2CCC(OCC3CC3)CC2)c2cccs2)CC1 ZINC000465422012 878851358 /nfs/dbraw/zinc/85/13/58/878851358.db2.gz MOABUSRZIUTIKU-HXUWFJFHSA-N 0 3 405.608 4.122 20 0 HIADHN C[C@@H](NC(=O)NC[C@H](c1cccs1)N1CCCC1)c1cccc(-n2cccn2)c1 ZINC000465426141 878856199 /nfs/dbraw/zinc/85/61/99/878856199.db2.gz RLVPELTUZLOIIG-YLJYHZDGSA-N 0 3 409.559 4.131 20 0 HIADHN C[C@@H]1CN(C(=O)NC[C@H](c2cccs2)N2CCCC2)C[C@@H](c2ccc(F)cc2)O1 ZINC000465427659 878857574 /nfs/dbraw/zinc/85/75/74/878857574.db2.gz JRMICCJPQIYWID-AHRSYUTCSA-N 0 3 417.550 4.196 20 0 HIADHN CC[C@H](NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1)c1nc(C(F)(F)F)cs1 ZINC000465430409 878861653 /nfs/dbraw/zinc/86/16/53/878861653.db2.gz HPARWALFBQZFPW-CABCVRRESA-N 0 3 412.481 4.187 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N[C@H](C)c2cccc(-n3cccn3)c2)N(C)C)cc1 ZINC000465431287 878863708 /nfs/dbraw/zinc/86/37/08/878863708.db2.gz IUFJTWCQTNAFGS-JPYJTQIMSA-N 0 3 405.546 4.098 20 0 HIADHN Cc1ccccc1[C@@H]1CN(C(=O)NC[C@@H](c2cccs2)N2CCCC2)[C@@H](C)CO1 ZINC000465433451 878864868 /nfs/dbraw/zinc/86/48/68/878864868.db2.gz MYFASATZEHTUMR-JBACZVJFSA-N 0 3 413.587 4.365 20 0 HIADHN Cc1ccccc1[C@@H]1CN(C(=O)NC[C@@H](c2cccs2)N2CCCC2)[C@H](C)CO1 ZINC000465433450 878865292 /nfs/dbraw/zinc/86/52/92/878865292.db2.gz MYFASATZEHTUMR-GIVPXCGWSA-N 0 3 413.587 4.365 20 0 HIADHN CO[C@@H](CNC(=O)NC[C@@H](c1ccccc1)N1CCCC1)c1ccc(Cl)cc1 ZINC000465439378 878871506 /nfs/dbraw/zinc/87/15/06/878871506.db2.gz FUHZEFZSKKYQAL-SFTDATJTSA-N 0 3 401.938 4.164 20 0 HIADHN Cc1nc2ccccc2n1CCCNC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1 ZINC000465464434 878897279 /nfs/dbraw/zinc/89/72/79/878897279.db2.gz CTOJWTYJJNCGHX-FQEVSTJZSA-N 0 3 419.573 4.041 20 0 HIADHN COc1cccc([C@@H](CNC(=O)NC[C@@H](C)Sc2ccccc2)N2CCCC2)c1 ZINC000465474633 878912088 /nfs/dbraw/zinc/91/20/88/878912088.db2.gz IYQPBVBPXYWVRO-XMSQKQJNSA-N 0 3 413.587 4.312 20 0 HIADHN COc1cccc([C@@H](CNC(=O)NCCc2c[nH]c3c2cccc3C)N2CCCC2)c1 ZINC000465476194 878914288 /nfs/dbraw/zinc/91/42/88/878914288.db2.gz OYYZLNYDVGYPQI-HSZRJFAPSA-N 0 3 420.557 4.164 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@@H]1C[C@@]1(C)c1ccccc1OC)c1ccsc1 ZINC000465526569 878980463 /nfs/dbraw/zinc/98/04/63/878980463.db2.gz OVORBMRELNRPAL-UZKOGDIHSA-N 0 3 401.576 4.169 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NC[C@H](OC)c1ccc(Cl)cc1)c1ccsc1 ZINC000465529707 878984671 /nfs/dbraw/zinc/98/46/71/878984671.db2.gz XKJSUBQGYYWDOH-OALUTQOASA-N 0 3 409.983 4.471 20 0 HIADHN CC[C@H](C)c1ccc([C@H](NC(=O)NC[C@H](C)CN2CCN(C)CC2)C(C)C)cc1 ZINC000465632523 879144700 /nfs/dbraw/zinc/14/47/00/879144700.db2.gz OSIOOJRMEHFBAE-SXWKCWPCSA-N 0 3 402.627 4.080 20 0 HIADHN CCO[C@@H](C)c1nc(CN(C)C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)cs1 ZINC000465688685 879238932 /nfs/dbraw/zinc/23/89/32/879238932.db2.gz JKHPWMMICOOEDD-PKOBYXMFSA-N 0 3 416.591 4.047 20 0 HIADHN Cc1ccccc1[C@@H]1CN(C(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)[C@@H](C)CO1 ZINC000465752713 879341655 /nfs/dbraw/zinc/34/16/55/879341655.db2.gz JWNDBHUJTVEDPM-QRVLJTFESA-N 0 3 407.558 4.302 20 0 HIADHN C[C@@H]1CCN(C(=O)N[C@H]2CCCOc3ccc(F)cc32)CCN1Cc1ccccc1 ZINC000465760021 879354023 /nfs/dbraw/zinc/35/40/23/879354023.db2.gz QLOJRHFFLRMCHD-GCJKJVERSA-N 0 3 411.521 4.345 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)NCc2ccc(C(=O)OC(C)(C)C)cc2)C1 ZINC000465759696 879354835 /nfs/dbraw/zinc/35/48/35/879354835.db2.gz POSRGKJTKJHYBP-XMSQKQJNSA-N 0 3 423.557 4.277 20 0 HIADHN CO[C@H](CNC(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1)c1ccc(Cl)cc1 ZINC000465766045 879362941 /nfs/dbraw/zinc/36/29/41/879362941.db2.gz XIMNEVGKAUERHT-ZLGUVYLKSA-N 0 3 401.938 4.162 20 0 HIADHN O=C(NC[C@@H]1CCO[C@H]1c1ccccc1)NC[C@@H]1CCCCN1Cc1ccccc1 ZINC000465795125 879403923 /nfs/dbraw/zinc/40/39/23/879403923.db2.gz YYNXTVHCMOSBNS-HJOGWXRNSA-N 0 3 407.558 4.118 20 0 HIADHN O=C(NC[C@@H]1CCO[C@@H]1c1ccccc1)NC[C@@H]1CCCCN1Cc1ccccc1 ZINC000465795127 879404338 /nfs/dbraw/zinc/40/43/38/879404338.db2.gz YYNXTVHCMOSBNS-KMDXXIMOSA-N 0 3 407.558 4.118 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N2CC[C@@H](COCc3ccccc3)C2)N2CCCC2)cc1 ZINC000465816201 879438987 /nfs/dbraw/zinc/43/89/87/879438987.db2.gz SBVVBAFLJNWQKU-NOZRDPDXSA-N 0 3 421.585 4.380 20 0 HIADHN C[C@@H]1CCN(C(=O)N[C@H](c2ccccc2)[C@H]2CCCO2)CCN1Cc1ccccc1 ZINC000465839950 879477652 /nfs/dbraw/zinc/47/76/52/879477652.db2.gz JMQYNIJZTDWAPW-AGILITTLSA-N 0 3 407.558 4.213 20 0 HIADHN C[C@H]1CCN(C(=O)NCCc2nc(C(C)(C)C)cs2)CCN1Cc1ccccc1 ZINC000465870146 879522146 /nfs/dbraw/zinc/52/21/46/879522146.db2.gz QTSZCCBDHVVVTA-SFHVURJKSA-N 0 3 414.619 4.289 20 0 HIADHN COc1cc(Cl)ccc1CNC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1 ZINC000465907161 879568089 /nfs/dbraw/zinc/56/80/89/879568089.db2.gz JUPVQQYHABLPEM-KRWDZBQOSA-N 0 3 401.938 4.155 20 0 HIADHN O=C(N[C@@H](c1ccccc1Cl)c1cc(F)ccc1F)N[C@H]1CCN(C2CC2)C1 ZINC000466015988 879697485 /nfs/dbraw/zinc/69/74/85/879697485.db2.gz KFOTUKKWYRWRPQ-XOBRGWDASA-N 0 3 405.876 4.244 20 0 HIADHN Cc1cc([C@@H](NC(=O)N[C@@H]2CCN(C3CC3)C2)c2ccccc2Cl)ccc1F ZINC000466014772 879697625 /nfs/dbraw/zinc/69/76/25/879697625.db2.gz JKENNBWTJJXEKG-IIBYNOLFSA-N 0 3 401.913 4.413 20 0 HIADHN O=C(N[C@@H]1CCN(C2CC2)C1)N1CCC(COc2cc(Cl)cc(Cl)c2)CC1 ZINC000466020985 879706392 /nfs/dbraw/zinc/70/63/92/879706392.db2.gz JVSOBYZGXWHESC-QGZVFWFLSA-N 0 3 412.361 4.031 20 0 HIADHN COc1ccc([C@H](C)CCNC(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)cc1 ZINC000466030050 879716935 /nfs/dbraw/zinc/71/69/35/879716935.db2.gz AQRVZXIZVUPFNP-RTWAWAEBSA-N 0 3 409.574 4.495 20 0 HIADHN O=C(NCc1ccccc1COc1ccccc1Cl)N1CC[C@H](N2CC=CC2)C1 ZINC000466037408 879727167 /nfs/dbraw/zinc/72/71/67/879727167.db2.gz MEZFGSQWMRWJME-FQEVSTJZSA-N 0 3 411.933 4.075 20 0 HIADHN COc1ccc([C@H](C)CCNC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)cc1 ZINC000466055976 879748378 /nfs/dbraw/zinc/74/83/78/879748378.db2.gz ODAYVOHMYVEHJU-RTWAWAEBSA-N 0 3 409.574 4.495 20 0 HIADHN CCCN(C(=O)NC[C@@H](C)CN1CCN(CC)CC1)[C@@H](C)c1cc2ccccc2o1 ZINC000466108140 879823143 /nfs/dbraw/zinc/82/31/43/879823143.db2.gz GGXDMUUIRGZOIU-UXHICEINSA-N 0 3 414.594 4.189 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)Nc2ccccc2Oc2cccc(C)c2)CC1 ZINC000466112541 879826923 /nfs/dbraw/zinc/82/69/23/879826923.db2.gz ADBXZOHHNBMQAV-FQEVSTJZSA-N 0 3 410.562 4.182 20 0 HIADHN CCCN(C(=O)N[C@@H]1[C@@H]2CCCO[C@H]2C1(C)C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000466133266 879845799 /nfs/dbraw/zinc/84/57/99/879845799.db2.gz FCYBYCKZAJUNMS-MYDTUXCISA-N 0 3 413.606 4.276 20 0 HIADHN C[C@H]1CCN(C)CCN1C(=O)NCc1ccc(Oc2ccccc2C(F)(F)F)nc1 ZINC000466149596 879856031 /nfs/dbraw/zinc/85/60/31/879856031.db2.gz KUOLKBXDVHIFMJ-HNNXBMFYSA-N 0 3 422.451 4.128 20 0 HIADHN C[C@H](CNC(=O)N(Cc1ccco1)C1CCN(C)CC1)Oc1cccc(Cl)c1 ZINC000466211468 879901822 /nfs/dbraw/zinc/90/18/22/879901822.db2.gz VEXMNADQNDJMHG-MRXNPFEDSA-N 0 3 405.926 4.006 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)C2(Cc3ccccc3)CCC2)cc1)[C@H]1CCCN(C)C1 ZINC000466245964 879959955 /nfs/dbraw/zinc/95/99/55/879959955.db2.gz KZSOFEBBLHXDOG-QHCPKHFHSA-N 0 3 419.569 4.204 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)N[C@@H](c2ccccc2)c2ccncc2)CN1Cc1ccccc1 ZINC000466262627 879992806 /nfs/dbraw/zinc/99/28/06/879992806.db2.gz YKLBVHAZFQCSFI-FOVJLYNBSA-N 0 3 400.526 4.133 20 0 HIADHN CSc1cccc([C@H](NC(=O)N2CCCN(C)CC2)c2cc(F)ccc2F)c1 ZINC000466278141 880017538 /nfs/dbraw/zinc/01/75/38/880017538.db2.gz OPUOGUSMRWPRES-FQEVSTJZSA-N 0 3 405.514 4.123 20 0 HIADHN Cc1nn(C(C)C)cc1CN[C@@H]1CCN(c2ncc(C(F)(F)F)cc2Cl)C1 ZINC000466347205 880105162 /nfs/dbraw/zinc/10/51/62/880105162.db2.gz OMNDIVXKOKDNJF-OAHLLOKOSA-N 0 3 401.864 4.208 20 0 HIADHN Cc1cc(CNCc2ccc(N(C)C(C)C)nc2)ccc1I ZINC000466360254 880117129 /nfs/dbraw/zinc/11/71/29/880117129.db2.gz AFVFLPFFHGPMPY-UHFFFAOYSA-N 0 3 409.315 4.129 20 0 HIADHN Cc1cc(CNCc2cnc(-c3ccncc3)s2)ccc1I ZINC000466363635 880121973 /nfs/dbraw/zinc/12/19/73/880121973.db2.gz FPBSQOLMOPWDLI-UHFFFAOYSA-N 0 3 421.307 4.408 20 0 HIADHN C[C@@H](CCNC(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1)c1ccccc1 ZINC000466389851 880150551 /nfs/dbraw/zinc/15/05/51/880150551.db2.gz RSLDMWXLWOLBJV-PCCBWWKXSA-N 0 3 401.595 4.101 20 0 HIADHN COc1ccc([C@H](CNC(=O)NCCc2c[nH]c3cccc(C)c23)N2CCCC2)cc1 ZINC000503492737 912540682 /nfs/dbraw/zinc/54/06/82/912540682.db2.gz IXGIEYDGXUQQFP-QHCPKHFHSA-N 0 3 420.557 4.164 20 0 HIADHN COc1ccc(C(=O)Nc2ccc(C(=O)NC[C@@H](c3ccccc3)N(C)C)s2)cc1 ZINC000466426572 880201189 /nfs/dbraw/zinc/20/11/89/880201189.db2.gz RTEFATXELPENMG-IBGZPJMESA-N 0 3 423.538 4.042 20 0 HIADHN CCOc1ccc(CN[C@H]2CC(=O)N(Cc3ccccc3C(F)(F)F)C2)cc1OC ZINC000466446054 880223697 /nfs/dbraw/zinc/22/36/97/880223697.db2.gz MVJHKABLWGUORA-KRWDZBQOSA-N 0 3 422.447 4.003 20 0 HIADHN CO[C@H](c1ccc(Br)cc1)[C@H](C)NCc1cncc(Br)c1 ZINC000466448711 880226239 /nfs/dbraw/zinc/22/62/39/880226239.db2.gz IKZZKCUWVJGMPD-ZBEGNZNMSA-N 0 3 414.141 4.472 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)N[C@@H](C)c2ccc(SC)cc2)c1 ZINC000466483824 880264531 /nfs/dbraw/zinc/26/45/31/880264531.db2.gz XZKUPGSTJKLGHR-KRWDZBQOSA-N 0 3 401.576 4.252 20 0 HIADHN CSc1ccc([C@H](C)NC(=O)N(C)C2CCN(CCc3ccccn3)CC2)cc1 ZINC000466486083 880266236 /nfs/dbraw/zinc/26/62/36/880266236.db2.gz GLKKXNXIACNITB-SFHVURJKSA-N 0 3 412.603 4.213 20 0 HIADHN CSc1ccc([C@H](C)NC(=O)N2CCC(CN3C[C@@H](C)O[C@H](C)C3)CC2)cc1 ZINC000466496496 880272599 /nfs/dbraw/zinc/27/25/99/880272599.db2.gz TWXKRSJRCFXVRJ-KURKYZTESA-N 0 3 405.608 4.000 20 0 HIADHN Cc1ccc(-c2nc(CNC(=O)N[C@H]3C[C@H](C)N(Cc4ccccc4)C3)co2)cc1 ZINC000466516135 880291479 /nfs/dbraw/zinc/29/14/79/880291479.db2.gz QJAYRYATTJKHHO-RXVVDRJESA-N 0 3 404.514 4.112 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)N2CC=C(c3c[nH]c4ncccc34)CC2)CN1Cc1ccccc1 ZINC000466519264 880295630 /nfs/dbraw/zinc/29/56/30/880295630.db2.gz PJFJJLUXCBFUSU-NQIIRXRSSA-N 0 3 415.541 4.025 20 0 HIADHN C[C@H]1C[C@H](NC(=O)N2CCC(Nc3ccc(F)cc3)CC2)CN1Cc1ccccc1 ZINC000466534034 880308511 /nfs/dbraw/zinc/30/85/11/880308511.db2.gz MDQQJHIKRQALEG-MBSDFSHPSA-N 0 3 410.537 4.075 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)Nc2ccccc2C(=O)N2CCCCC2)CN1Cc1ccccc1 ZINC000466542114 880315149 /nfs/dbraw/zinc/31/51/49/880315149.db2.gz PNDRFZGEYFYUSD-PZJWPPBQSA-N 0 3 420.557 4.097 20 0 HIADHN CC[C@@H](NC(=O)N(CCN(C)C)Cc1ccccc1)c1nc(C(F)(F)F)cs1 ZINC000466680024 880468515 /nfs/dbraw/zinc/46/85/15/880468515.db2.gz BHTUNODLQQXZKO-OAHLLOKOSA-N 0 3 414.497 4.386 20 0 HIADHN C[C@@H](NC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1)c1cccc(-n2cccn2)c1 ZINC000466684593 880474342 /nfs/dbraw/zinc/47/43/42/880474342.db2.gz UARZLEPSKYUNRI-NHCUHLMSSA-N 0 3 417.557 4.239 20 0 HIADHN CCc1c(NC(=O)NC[C@H](c2ccccc2)N2CCCC2)cnn1-c1ccccc1 ZINC000466690722 880480252 /nfs/dbraw/zinc/48/02/52/880480252.db2.gz RJIXNEYWBGGYLZ-HSZRJFAPSA-N 0 3 403.530 4.393 20 0 HIADHN CCc1c(NC(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)cnn1-c1ccccc1 ZINC000466698638 880489965 /nfs/dbraw/zinc/48/99/65/880489965.db2.gz ZFBXJGTXKGOLKT-NRFANRHFSA-N 0 3 403.530 4.173 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Nc1cc(Br)c(F)cc1F ZINC000466711715 880501754 /nfs/dbraw/zinc/50/17/54/880501754.db2.gz DKOBGAHFTQGXBB-UHFFFAOYSA-N 0 3 418.307 4.385 20 0 HIADHN C[C@H]1CN(C2CC2)C[C@@H]1NC(=O)N1CCC(c2nc3cc(Cl)ccc3s2)CC1 ZINC000466750336 880531037 /nfs/dbraw/zinc/53/10/37/880531037.db2.gz CNPCWGAYNQZFFF-UGSOOPFHSA-N 0 3 418.994 4.321 20 0 HIADHN CCCN(C(=O)NCc1nc2cc(C)ccc2[nH]1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000466754660 880535396 /nfs/dbraw/zinc/53/53/96/880535396.db2.gz VCNQFQOSNSVULT-NRFANRHFSA-N 0 3 419.573 4.458 20 0 HIADHN CCCN(C(=O)NCc1nc2ccc(C)cc2[nH]1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000466754660 880535406 /nfs/dbraw/zinc/53/54/06/880535406.db2.gz VCNQFQOSNSVULT-NRFANRHFSA-N 0 3 419.573 4.458 20 0 HIADHN CCCN1CCC[C@@H]1C(=O)NC[C@H](c1c[nH]c2ccccc21)c1ccc(OC)cc1 ZINC000503526995 912580474 /nfs/dbraw/zinc/58/04/74/912580474.db2.gz IPIRRPFYVDYGHY-XUZZJYLKSA-N 0 3 405.542 4.299 20 0 HIADHN CC1CCN([C@H](CNC(=O)NC[C@@]2(C)CCO[C@H]2C2CC2)c2cccs2)CC1 ZINC000466789472 880569250 /nfs/dbraw/zinc/56/92/50/880569250.db2.gz LNMTYGBXWJKGMT-KAGYGMCKSA-N 0 3 405.608 4.026 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)NCc2c(F)cccc2OC(F)F)c1 ZINC000466792161 880570188 /nfs/dbraw/zinc/57/01/88/880570188.db2.gz XDOZUMYZIPKCAQ-UHFFFAOYSA-N 0 3 409.452 4.009 20 0 HIADHN CSc1ccc(F)cc1CNC(=O)N(CCN(C)C)Cc1ccc(F)c(F)c1 ZINC000466811233 880587848 /nfs/dbraw/zinc/58/78/48/880587848.db2.gz FMJKUNOHSZWREX-UHFFFAOYSA-N 0 3 411.493 4.099 20 0 HIADHN Cc1c(-c2cc(CN(Cc3ccc4c(c3)OCO4)C3CCCCC3)on2)cnn1C ZINC000466815133 880590385 /nfs/dbraw/zinc/59/03/85/880590385.db2.gz KWSFIECXEXFQNY-UHFFFAOYSA-N 0 3 408.502 4.447 20 0 HIADHN Cc1ccc([C@H]2OCCC[C@@H]2CNC(=O)N2CCCN(Cc3ccccc3)CC2)cc1 ZINC000466955011 880738102 /nfs/dbraw/zinc/73/81/02/880738102.db2.gz PKHONRDYJLRUCM-JWQCQUIFSA-N 0 3 421.585 4.380 20 0 HIADHN Cc1nc(CNC(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)sc1C ZINC000466960583 880749040 /nfs/dbraw/zinc/74/90/40/880749040.db2.gz WXYYBUKLNTUEMA-UHFFFAOYSA-N 0 3 414.497 4.052 20 0 HIADHN CCCN(C(=O)NCc1nc(C)c(C)s1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000466963166 880754511 /nfs/dbraw/zinc/75/45/11/880754511.db2.gz IEOLBTMASUNZRL-FQEVSTJZSA-N 0 3 400.592 4.346 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N(C)CC[C@@H]1CCCO1)c1ccc(C(F)(F)F)cc1 ZINC000466973172 880776427 /nfs/dbraw/zinc/77/64/27/880776427.db2.gz CATPVSBXJFKUSK-RBUKOAKNSA-N 0 3 415.500 4.299 20 0 HIADHN CCS[C@H]1CC[C@@H](N(C)C(=O)Nc2ccc(N3CCN(CC)CC3)cc2C)C1 ZINC000466978506 880781870 /nfs/dbraw/zinc/78/18/70/880781870.db2.gz ZELCRWSLJOMANE-QUCCMNQESA-N 0 3 404.624 4.275 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1NC(=O)N[C@@H]1C[C@H](C)N(Cc2ccccc2)C1 ZINC000466976486 880783215 /nfs/dbraw/zinc/78/32/15/880783215.db2.gz JSJNEHJULVVSOD-LAUBAEHRSA-N 0 3 403.530 4.274 20 0 HIADHN C[C@H]1C[C@H](NC(=O)c2cccc(-c3noc(C4CC4)n3)c2)CN1Cc1ccccc1 ZINC000467021324 880822985 /nfs/dbraw/zinc/82/29/85/880822985.db2.gz GDTXNHVYHWXBMC-KKSFZXQISA-N 0 3 402.498 4.007 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)c2cnn(-c3ccccc3)c2C2CC2)CN1Cc1ccccc1 ZINC000467028159 880827466 /nfs/dbraw/zinc/82/74/66/880827466.db2.gz GMASABGNJADHPC-WIYYLYMNSA-N 0 3 400.526 4.143 20 0 HIADHN C[C@H]1C[C@H](NC(=O)Cc2csc(-c3cccc(F)c3)n2)CN1Cc1ccccc1 ZINC000467029654 880828586 /nfs/dbraw/zinc/82/85/86/880828586.db2.gz AFYVLTPXGRAQJM-JXFKEZNVSA-N 0 3 409.530 4.271 20 0 HIADHN C[C@H](NC(=O)N(CCN(C)C)Cc1ccc(F)cc1)c1nc(C2CCCCC2)no1 ZINC000467029931 880829512 /nfs/dbraw/zinc/82/95/12/880829512.db2.gz XJOXIMGQQQMPAQ-INIZCTEOSA-N 0 3 417.529 4.091 20 0 HIADHN C[C@@H](NC(=O)N1CCN(CC2CCCCC2)CC1)c1nc(C2CCCCC2)no1 ZINC000467029794 880829723 /nfs/dbraw/zinc/82/97/23/880829723.db2.gz XBKHDMUVPBBILD-QGZVFWFLSA-N 0 3 403.571 4.086 20 0 HIADHN Cc1noc(CSc2ccc(C(=O)N[C@@H]3C[C@@H](C)N(Cc4ccccc4)C3)cc2)n1 ZINC000467033729 880831830 /nfs/dbraw/zinc/83/18/30/880831830.db2.gz NIJKKTLEWYHXNP-OXQOHEQNSA-N 0 3 422.554 4.063 20 0 HIADHN C[C@H](SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)N[C@@H]1CN(C2CC2)C[C@H]1C ZINC000467049223 880841380 /nfs/dbraw/zinc/84/13/80/880841380.db2.gz XEOJZZKCBUPSLN-QWQRMKEZSA-N 0 3 419.978 4.216 20 0 HIADHN Cc1cc(CSc2ncccc2C(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)no1 ZINC000467048959 880841398 /nfs/dbraw/zinc/84/13/98/880841398.db2.gz UXCDLPKYVWCRRL-QFBILLFUSA-N 0 3 422.554 4.063 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)Nc2cccc(NC(=O)c3ccoc3)c2)CN1Cc1ccccc1 ZINC000467114008 880872844 /nfs/dbraw/zinc/87/28/44/880872844.db2.gz KBTNSVXPRLOCCT-VGSWGCGISA-N 0 3 418.497 4.316 20 0 HIADHN COC(=O)COc1ccc([C@H](C)N[C@@H](C)C(=O)Nc2c(C)cccc2C(C)C)cc1 ZINC000467179757 880907395 /nfs/dbraw/zinc/90/73/95/880907395.db2.gz IXJDICZMBJNSKZ-ROUUACIJSA-N 0 3 412.530 4.348 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)N2CCC[C@@H]2c2cc(F)cc(Br)c2)CN1C1CC1 ZINC000467228494 880957663 /nfs/dbraw/zinc/95/76/63/880957663.db2.gz IPWXLEUONCDCGT-PZPSRYQVSA-N 0 3 410.331 4.060 20 0 HIADHN CN(C)C[C@@H](NC(=O)NCc1nc(-c2ccccc2F)cs1)c1ccc(F)cc1 ZINC000503556372 912628544 /nfs/dbraw/zinc/62/85/44/912628544.db2.gz CLAZWHHIPQZQKU-GOSISDBHSA-N 0 3 416.497 4.190 20 0 HIADHN COCC[C@@H]1CCCCN(CC(=O)Nc2cccc(CSc3ccccn3)c2)C1 ZINC000467274360 881016558 /nfs/dbraw/zinc/01/65/58/881016558.db2.gz WOWPPNQCENFOJD-IBGZPJMESA-N 0 3 413.587 4.451 20 0 HIADHN CN(CCN(Cc1nnc(-c2ccco2)o1)Cc1ccccc1)Cc1ccccc1 ZINC000467281769 881029363 /nfs/dbraw/zinc/02/93/63/881029363.db2.gz LRDYVLGPUUAPDE-UHFFFAOYSA-N 0 3 402.498 4.464 20 0 HIADHN CN1CCN(c2ccc(C(F)(F)F)cc2CN[C@H](c2cncc(F)c2)C2CC2)CC1 ZINC000467337866 881089788 /nfs/dbraw/zinc/08/97/88/881089788.db2.gz GFLPNELUBAPEKX-NRFANRHFSA-N 0 3 422.470 4.232 20 0 HIADHN C[C@@H](Cc1cccc(C(F)(F)F)c1)N[C@@H](C(N)=O)c1cccc(Br)c1 ZINC000467364143 881131036 /nfs/dbraw/zinc/13/10/36/881131036.db2.gz JFONTUGUSHMQKX-MEDUHNTESA-N 0 3 415.253 4.215 20 0 HIADHN Cc1cc(CN[C@H](C)c2ccc([S@](C)=O)cc2)ccc1I ZINC000467380170 881156790 /nfs/dbraw/zinc/15/67/90/881156790.db2.gz CQCJPXZQOGYJAS-ASSNKEHSSA-N 0 3 413.324 4.188 20 0 HIADHN CCC[C@H](N[C@@H]1CCc2cc(F)c(OC)cc21)C(=O)N1CCc2sccc2C1 ZINC000467381620 881160580 /nfs/dbraw/zinc/16/05/80/881160580.db2.gz MGGQRSYPGSMJLE-MOPGFXCFSA-N 0 3 402.535 4.226 20 0 HIADHN C[C@@H](NC[C@H](O)COc1cccc(Cl)c1Cl)c1ccnn1-c1ccccc1 ZINC000467382991 881162743 /nfs/dbraw/zinc/16/27/43/881162743.db2.gz CMCIXBUOTJPFPL-ZBFHGGJFSA-N 0 3 406.313 4.270 20 0 HIADHN COc1c(Br)cc(Br)cc1CN(C)CC[C@@H]1CCCO1 ZINC000467387079 881170256 /nfs/dbraw/zinc/17/02/56/881170256.db2.gz DNWIVZPHITVECR-ZDUSSCGKSA-N 0 3 407.146 4.221 20 0 HIADHN Cc1ccccc1C[C@@H](CO)N[C@H](C)c1ccc(OC(F)F)cc1OC(F)F ZINC000467393263 881176361 /nfs/dbraw/zinc/17/63/61/881176361.db2.gz KNKZLSIDPDINPZ-HIFRSBDPSA-N 0 3 401.400 4.452 20 0 HIADHN Cc1ccccc1C[C@H](CO)N[C@@H](C)c1ccc(OC(F)F)cc1OC(F)F ZINC000467393254 881176756 /nfs/dbraw/zinc/17/67/56/881176756.db2.gz KNKZLSIDPDINPZ-DZGCQCFKSA-N 0 3 401.400 4.452 20 0 HIADHN Clc1ccc(N2CCOCC2)c(CN[C@@H](C[C@H]2CCOC2)c2ccccc2)c1 ZINC000467410747 881196727 /nfs/dbraw/zinc/19/67/27/881196727.db2.gz KFBGQRCJRBZYCC-GCJKJVERSA-N 0 3 400.950 4.434 20 0 HIADHN COc1ccc2c(c1)[C@H](NCCNC(=O)c1cccc(Br)c1)CCS2 ZINC000467417260 881204445 /nfs/dbraw/zinc/20/44/45/881204445.db2.gz FXMYQGFDZVGLHN-QGZVFWFLSA-N 0 3 421.360 4.014 20 0 HIADHN COc1ccc2c(c1)[C@@H](N[C@H](C)c1ccc(OCC(=O)NC3CC3)cc1)CCS2 ZINC000467425326 881214321 /nfs/dbraw/zinc/21/43/21/881214321.db2.gz YTPQCGXHZNGOAY-VFNWGFHPSA-N 0 3 412.555 4.240 20 0 HIADHN COc1ccc2c(c1)[C@H](N[C@@H](C)c1ccc(OCC(=O)NC3CC3)cc1)CCS2 ZINC000467425328 881214535 /nfs/dbraw/zinc/21/45/35/881214535.db2.gz YTPQCGXHZNGOAY-YCRPNKLZSA-N 0 3 412.555 4.240 20 0 HIADHN COc1ccc(NC(=O)N(CCN(C)C)C2CCCC2)cc1OCc1ccncc1 ZINC000467438545 881236649 /nfs/dbraw/zinc/23/66/49/881236649.db2.gz OQQJYHJRCPQAIO-UHFFFAOYSA-N 0 3 412.534 4.007 20 0 HIADHN COc1ccccc1NC(=O)c1ccc(NC(=O)N(CCN(C)C)C2CCCC2)cc1 ZINC000467443520 881245883 /nfs/dbraw/zinc/24/58/83/881245883.db2.gz RMUCTFATZYAMHM-UHFFFAOYSA-N 0 3 424.545 4.286 20 0 HIADHN COc1ccc(NC(=O)N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)c(Br)c1 ZINC000467471268 881287509 /nfs/dbraw/zinc/28/75/09/881287509.db2.gz GLZIQRIODOTGTR-GDBMZVCRSA-N 0 3 418.335 4.242 20 0 HIADHN CC(=O)N(Cc1ccc(NC(=O)N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)cc1)C(C)C ZINC000467476111 881294994 /nfs/dbraw/zinc/29/49/94/881294994.db2.gz NGGHDIYRBANGIY-CYFREDJKSA-N 0 3 422.573 4.228 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)c1ccc(-c2ccc(F)cc2)s1 ZINC000467506485 881322439 /nfs/dbraw/zinc/32/24/39/881322439.db2.gz ZWBIKBUATCHKHJ-UHFFFAOYSA-N 0 3 424.541 4.441 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)C1(c2cccc(F)c2)CCCCC1 ZINC000467507553 881322702 /nfs/dbraw/zinc/32/27/02/881322702.db2.gz GDVZGSSBVNECJH-UHFFFAOYSA-N 0 3 424.560 4.301 20 0 HIADHN CC[C@H](Cc1ccccc1)N(CC)CC(=O)NCC(=O)Nc1c(C)cc(C)cc1C ZINC000469059218 883133069 /nfs/dbraw/zinc/13/30/69/883133069.db2.gz STVVCARLTXWDRP-JOCHJYFZSA-N 0 3 409.574 4.010 20 0 HIADHN CSc1ccc([C@@H](C)N[C@@H](C)C(=O)N[C@@H](C)c2ccc3c(c2)OCCO3)cc1 ZINC000503587395 912672005 /nfs/dbraw/zinc/67/20/05/912672005.db2.gz TVOBQHVIOCSPQU-PMPSAXMXSA-N 0 3 400.544 4.096 20 0 HIADHN CCN(CC)[C@H](CNC(=O)CC1(O)CCCCC1)c1ccc(C(F)(F)F)cc1 ZINC000469065025 883141628 /nfs/dbraw/zinc/14/16/28/883141628.db2.gz QRVWWZAFZOVXGD-GOSISDBHSA-N 0 3 400.485 4.290 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N3CC[C@@H](CSc4ccccc4)C3)cc2)CC1 ZINC000469068082 883146706 /nfs/dbraw/zinc/14/67/06/883146706.db2.gz WWFICLLJFYNIIR-HXUWFJFHSA-N 0 3 409.599 4.083 20 0 HIADHN C[C@@H]1CC[C@H](C)N1CC(=O)N[C@@H](c1ccc2c(c1)OCCO2)c1ccccc1Cl ZINC000469102039 883192977 /nfs/dbraw/zinc/19/29/77/883192977.db2.gz ZULSMZNBAGIHFN-PXAQALGRSA-N 0 3 414.933 4.190 20 0 HIADHN Cc1nc2c(s1)CCC[C@H]2C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000469103641 883194549 /nfs/dbraw/zinc/19/45/49/883194549.db2.gz WUUIZCIXJWOHBD-GOSISDBHSA-N 0 3 401.601 4.101 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)Nc3cccc(COCC4CC4)c3)CC2)c1 ZINC000469146739 883243721 /nfs/dbraw/zinc/24/37/21/883243721.db2.gz XLQDBBDNOFPJCZ-UHFFFAOYSA-N 0 3 407.558 4.072 20 0 HIADHN COc1cccc([C@@H](C)CCCC(=O)NCc2ccc(CN3CCN(C)CC3)cc2)c1 ZINC000469155335 883251414 /nfs/dbraw/zinc/25/14/14/883251414.db2.gz YJHXMBCOTUZQQA-NRFANRHFSA-N 0 3 423.601 4.033 20 0 HIADHN CCN(C(=O)c1nnn(CC2CCCC2)c1C)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000469187668 883287050 /nfs/dbraw/zinc/28/70/50/883287050.db2.gz CSMYVRWVFHNPSM-GCJKJVERSA-N 0 3 409.578 4.074 20 0 HIADHN COc1cc(N[C@H]2CCCN(Cc3ccc4c(c3)COC(C)(C)O4)C2)cc(OC)c1 ZINC000469220849 883321582 /nfs/dbraw/zinc/32/15/82/883321582.db2.gz DEQJRCMAAFGHTB-IBGZPJMESA-N 0 3 412.530 4.425 20 0 HIADHN COc1ccc(NC(=O)[C@H](NC2CCN(c3nccs3)CC2)c2ccccc2)cc1 ZINC000503602426 912694131 /nfs/dbraw/zinc/69/41/31/912694131.db2.gz MDAIEFUNKUVJOT-OAQYLSRUSA-N 0 3 422.554 4.090 20 0 HIADHN Cc1cc(C(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)nn1-c1c(F)cccc1F ZINC000469388329 883536945 /nfs/dbraw/zinc/53/69/45/883536945.db2.gz JYKUDEIMHVUVFC-GOSISDBHSA-N 0 3 424.495 4.196 20 0 HIADHN Cc1c2cc(C)c(C)cc2sc1C(=O)N(C)C1CCN(CCn2cccn2)CC1 ZINC000469392360 883546207 /nfs/dbraw/zinc/54/62/07/883546207.db2.gz BLFFLYCBONUIAE-UHFFFAOYSA-N 0 3 410.587 4.260 20 0 HIADHN CC(C)c1ccc(C(=O)NCc2ccccc2CN2CCC(O)CC2)cc1Cl ZINC000469405119 883574304 /nfs/dbraw/zinc/57/43/04/883574304.db2.gz CJFWSTXDXCTYEJ-UHFFFAOYSA-N 0 3 400.950 4.350 20 0 HIADHN Cc1cnc([C@@H](NC(=O)N[C@H](CN(C)Cc2ccccc2)C(C)C)C2CC2)s1 ZINC000469438757 883627534 /nfs/dbraw/zinc/62/75/34/883627534.db2.gz OHDBVKJYATXOQN-UXHICEINSA-N 0 3 400.592 4.358 20 0 HIADHN Cc1csc([C@H](NC(=O)N[C@H](CN(C)Cc2ccccc2)C(C)C)C2CC2)n1 ZINC000469439958 883629834 /nfs/dbraw/zinc/62/98/34/883629834.db2.gz CSLGHORKVONIJM-WOJBJXKFSA-N 0 3 400.592 4.358 20 0 HIADHN COc1ccc2c(c1)CN(CCc1nnnn1-c1ccccc1)[C@@H](c1ccccc1)C2 ZINC000469447382 883644832 /nfs/dbraw/zinc/64/48/32/883644832.db2.gz BINNUOAOGTZQND-XMMPIXPASA-N 0 3 411.509 4.013 20 0 HIADHN CCNC(=O)c1ccc(C)c(NC(=O)N[C@H](CN(C)Cc2ccccc2)C(C)C)c1 ZINC000469453114 883655655 /nfs/dbraw/zinc/65/56/55/883655655.db2.gz VCMPWEPRJYCFFN-JOCHJYFZSA-N 0 3 410.562 4.023 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)CCc1nc(-c2cccs2)no1 ZINC000469477548 883707869 /nfs/dbraw/zinc/70/78/69/883707869.db2.gz HEJOWKKVDBOGAQ-SFHVURJKSA-N 0 3 412.559 4.004 20 0 HIADHN CC(C)C(=O)N(C)Cc1ccc(C(=O)N[C@@H](CN(C)Cc2ccccc2)C(C)C)cc1 ZINC000469477745 883708570 /nfs/dbraw/zinc/70/85/70/883708570.db2.gz JSJFOOGJOHLQBP-DEOSSOPVSA-N 0 3 423.601 4.187 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)c1cccc(Oc2cnccn2)c1 ZINC000469505579 883755831 /nfs/dbraw/zinc/75/58/31/883755831.db2.gz VNMLCPDQLKBLNL-JOCHJYFZSA-N 0 3 404.514 4.155 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)c2ccc3c(ccn3Cc3ccccc3)c2)CC1 ZINC000469535449 883804571 /nfs/dbraw/zinc/80/45/71/883804571.db2.gz MFXNXTULBARFSM-UHFFFAOYSA-N 0 3 419.569 4.309 20 0 HIADHN COc1ccc(-c2ncc(C(=O)Nc3cc(CN(C)C)ccc3C)s2)cc1OC ZINC000469537250 883805272 /nfs/dbraw/zinc/80/52/72/883805272.db2.gz HTXHIFVHPMWWHU-UHFFFAOYSA-N 0 3 411.527 4.450 20 0 HIADHN Cc1nc(-c2ccc(N[C@@H](C[N@H+](C)Cc3ccccc3)C(C)C)nc2)[n-]c(=O)c1C ZINC000469548357 883809485 /nfs/dbraw/zinc/80/94/85/883809485.db2.gz ZCFSONXMDWOJIW-NRFANRHFSA-N 0 3 405.546 4.430 20 0 HIADHN Cc1nc(-c2ccc(N[C@@H](C[N@@H+](C)Cc3ccccc3)C(C)C)nc2)[n-]c(=O)c1C ZINC000469548357 883809486 /nfs/dbraw/zinc/80/94/86/883809486.db2.gz ZCFSONXMDWOJIW-NRFANRHFSA-N 0 3 405.546 4.430 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)N3C[C@@H](C)C[C@@H]3c3cccc(F)c3)CC2)c1 ZINC000469568284 883817653 /nfs/dbraw/zinc/81/76/53/883817653.db2.gz FGJUQYSDAKTJJL-GBXCKJPGSA-N 0 3 409.549 4.256 20 0 HIADHN Cc1ccc(F)c(C(=O)N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)c1Br ZINC000469584442 883823737 /nfs/dbraw/zinc/82/37/37/883823737.db2.gz GQUDRPMISOHYBT-ZBFHGGJFSA-N 0 3 405.311 4.289 20 0 HIADHN COc1ccnc(CC(=O)N(CCN2CCCC2)Cc2ccc(Cl)c(Cl)c2)c1 ZINC000469630032 883841173 /nfs/dbraw/zinc/84/11/73/883841173.db2.gz IUXVCPWZSBIFRC-UHFFFAOYSA-N 0 3 422.356 4.064 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N3C[C@@H](c4cc(C)ccc4C)OC[C@H]3C)cc2)CC1 ZINC000469636512 883843506 /nfs/dbraw/zinc/84/35/06/883843506.db2.gz ZTIFMDBPLFSAAK-BWKNWUBXSA-N 0 3 421.585 4.048 20 0 HIADHN COC(=O)c1cccc(NC(=O)CN[C@@H](C)c2ccccc2-c2ccc(Cl)cc2)n1 ZINC000469757613 883922170 /nfs/dbraw/zinc/92/21/70/883922170.db2.gz SPPFOFSJQCSLJS-HNNXBMFYSA-N 0 3 423.900 4.478 20 0 HIADHN COc1cc(Br)ccc1[C@H](C)NCCC(=O)N1CCc2ccccc2C1 ZINC000469758834 883924029 /nfs/dbraw/zinc/92/40/29/883924029.db2.gz ZRTGJUYCEHADEO-HNNXBMFYSA-N 0 3 417.347 4.083 20 0 HIADHN CCS[C@@H]1CCCC[C@@H]1NCC(=O)Nc1c(F)cc(F)cc1Br ZINC000469773678 883949518 /nfs/dbraw/zinc/94/95/18/883949518.db2.gz AFDJNEIUPPFUDL-UONOGXRCSA-N 0 3 407.324 4.320 20 0 HIADHN C[C@@H](NC(=O)CCCc1nnc(-c2ccc(Cl)cc2Cl)o1)C1=CCN(C)CC1 ZINC000469801139 883975774 /nfs/dbraw/zinc/97/57/74/883975774.db2.gz QAJQTILFGYJULG-CYBMUJFWSA-N 0 3 423.344 4.133 20 0 HIADHN C[C@H](CC(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1)c1c[nH]c2ccccc21 ZINC000469849804 884032002 /nfs/dbraw/zinc/03/20/02/884032002.db2.gz AMSVEXVQGJTKIG-TZIWHRDSSA-N 0 3 405.542 4.069 20 0 HIADHN O=C(NC[C@H]1CN(Cc2ccccc2)CCCO1)c1sccc1-c1ccccc1 ZINC000469856167 884041606 /nfs/dbraw/zinc/04/16/06/884041606.db2.gz MBCNDDWDHCSQMM-NRFANRHFSA-N 0 3 406.551 4.436 20 0 HIADHN O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)[C@H]1C[C@@H]1c1ccc2ccccc2c1 ZINC000469862472 884049705 /nfs/dbraw/zinc/04/97/05/884049705.db2.gz MTAORYBFNGSDCH-CYXNTTPDSA-N 0 3 414.549 4.351 20 0 HIADHN O=C(NC[C@H]1CN(Cc2ccccc2)CCCO1)C1(Cc2ccc(Cl)cc2)CC1 ZINC000469864711 884054188 /nfs/dbraw/zinc/05/41/88/884054188.db2.gz LMVZZFTYGCDUSE-QFIPXVFZSA-N 0 3 412.961 4.070 20 0 HIADHN O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)C1(c2cccc(F)c2)CCCC1 ZINC000469865573 884056188 /nfs/dbraw/zinc/05/61/88/884056188.db2.gz VYTJDXDXWHPBHK-HSZRJFAPSA-N 0 3 410.533 4.045 20 0 HIADHN CC(C)(C)c1csc(C2CCN(C(=O)CC3(N4CCOCC4)CCCC3)CC2)n1 ZINC000469965872 884172405 /nfs/dbraw/zinc/17/24/05/884172405.db2.gz QCNVYNGMGPTZPP-UHFFFAOYSA-N 0 3 419.635 4.182 20 0 HIADHN C[C@H]1CN(Cc2ccccn2)CC[C@H]1NCc1csc(CCc2ccccc2)n1 ZINC000469979453 884192270 /nfs/dbraw/zinc/19/22/70/884192270.db2.gz XASYXLQWEHSWNH-WMZHIEFXSA-N 0 3 406.599 4.324 20 0 HIADHN Cc1ccc([C@H]2OCCC[C@H]2NC(=O)N(CCN(C)C)Cc2ccccc2F)cc1 ZINC000470029879 884259953 /nfs/dbraw/zinc/25/99/53/884259953.db2.gz NUYUVSNHGFUKPT-DHIUTWEWSA-N 0 3 413.537 4.128 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@@H]2NC(=O)NC[C@H](c2ccccc2)N2CCCC2)cc1 ZINC000470062896 884316308 /nfs/dbraw/zinc/31/63/08/884316308.db2.gz SQGBJYXZVRDKBX-VXNXHJTFSA-N 0 3 407.558 4.351 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@@H]2NC(=O)N[C@H](CN2CCCC2)c2ccccc2)cc1 ZINC000470077554 884335028 /nfs/dbraw/zinc/33/50/28/884335028.db2.gz YLAPNZYKPBKSHV-VXNXHJTFSA-N 0 3 407.558 4.351 20 0 HIADHN CCOc1cc(CN2CC[C@H](C(F)(F)F)C2(C)C)ccc1O[C@H](C)C(=O)N(C)C ZINC000470130690 884395198 /nfs/dbraw/zinc/39/51/98/884395198.db2.gz DHOAEVPFLRSJAY-KDOFPFPSSA-N 0 3 416.484 4.104 20 0 HIADHN Cc1nc2c(cnn2C(C)C)cc1C(=O)N[C@@H](CN(C)Cc1ccccc1)C(C)C ZINC000470161074 884436334 /nfs/dbraw/zinc/43/63/34/884436334.db2.gz LPHNUXODKZUOQY-QFIPXVFZSA-N 0 3 407.562 4.207 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)c1ccccc1COC1CCOCC1 ZINC000470165862 884442393 /nfs/dbraw/zinc/44/23/93/884442393.db2.gz PLNIXZDJAYXPOX-RUZDIDTESA-N 0 3 424.585 4.269 20 0 HIADHN Cc1ccc([C@H]2OCCC[C@H]2NC(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)cc1 ZINC000470262595 884609010 /nfs/dbraw/zinc/60/90/10/884609010.db2.gz BNJSFKCXGAGBMH-JWQCQUIFSA-N 0 3 421.585 4.176 20 0 HIADHN COc1cccc(C[C@H](NCC(=O)N[C@@H]2CCOc3ccccc32)c2ccccc2)c1 ZINC000503858810 912844416 /nfs/dbraw/zinc/84/44/16/912844416.db2.gz LQJFZZJRKWSAPJ-RPWUZVMVSA-N 0 3 416.521 4.209 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)N(Cc1cc[nH]n1)Cc1ccccc1 ZINC000470283567 884649934 /nfs/dbraw/zinc/64/99/34/884649934.db2.gz BYYGRCLYJCSVAN-DEOSSOPVSA-N 0 3 419.573 4.278 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3cccc(OCCF)c3)c(C)c2)CC1 ZINC000470296644 884672944 /nfs/dbraw/zinc/67/29/44/884672944.db2.gz MHRVNTNEUDDIJY-UHFFFAOYSA-N 0 3 400.498 4.129 20 0 HIADHN Cc1cccc([C@H](N[C@@H](C)CCCOc2ccccc2C(N)=O)c2ccccn2)c1 ZINC000470306747 884681174 /nfs/dbraw/zinc/68/11/74/884681174.db2.gz HCKCDQWBDHNANU-CYFREDJKSA-N 0 3 403.526 4.416 20 0 HIADHN Cc1cccc([C@@H](N[C@@H](C)CCCOc2ccccc2C(N)=O)c2ccccn2)c1 ZINC000470306750 884683714 /nfs/dbraw/zinc/68/37/14/884683714.db2.gz HCKCDQWBDHNANU-YADARESESA-N 0 3 403.526 4.416 20 0 HIADHN O=S1(=O)CC[C@@H](NCC2CCC(F)(F)CC2)c2cc(Br)ccc21 ZINC000503884305 912851016 /nfs/dbraw/zinc/85/10/16/912851016.db2.gz HIEUGDXRAPGZNE-CQSZACIVSA-N 0 3 408.308 4.083 20 0 HIADHN Cc1ccc(NC(=O)C[C@H](C)N[C@H](Cn2ccccc2=O)c2ccccc2)c(C)c1 ZINC000503927412 912868119 /nfs/dbraw/zinc/86/81/19/912868119.db2.gz PQUDFDJTWNRUSF-NZQKXSOJSA-N 0 3 403.526 4.213 20 0 HIADHN C[C@H](NC(=O)NC[C@@H](Cc1ccccc1)N(C)C)c1ccc(-c2ccncc2)cc1 ZINC000470471261 884862718 /nfs/dbraw/zinc/86/27/18/884862718.db2.gz VWGOFTUKLWXIFJ-YADARESESA-N 0 3 402.542 4.282 20 0 HIADHN COC[C@@H](C)Oc1ccc(Cl)cc1NC(=O)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000470519378 884910505 /nfs/dbraw/zinc/91/05/05/884910505.db2.gz LTFXLJAMEAZYHG-APWZRJJASA-N 0 3 417.937 4.150 20 0 HIADHN COc1cccc(-c2noc([C@H](C)NC(=O)c3oc4ccccc4c3CN(C)C)n2)c1 ZINC000470520575 884911436 /nfs/dbraw/zinc/91/14/36/884911436.db2.gz SVAKKYZJTZKYPD-AWEZNQCLSA-N 0 3 420.469 4.044 20 0 HIADHN C[C@H](CC(=O)Nc1cccc(Cl)c1)N[C@@H](Cn1ccccc1=O)c1ccccc1 ZINC000503944022 912876059 /nfs/dbraw/zinc/87/60/59/912876059.db2.gz YFHOMUXYUNMRCS-UTKZUKDTSA-N 0 3 409.917 4.250 20 0 HIADHN O[C@H](COCc1cccs1)CN1CC[C@@H](Oc2ccc(Cl)c(Cl)c2)C1 ZINC000470568154 884984577 /nfs/dbraw/zinc/98/45/77/884984577.db2.gz FAMPIYUYJXEHGL-DZGCQCFKSA-N 0 3 402.343 4.086 20 0 HIADHN C[C@H](CO)N1CCCN(C(=O)Nc2ccc(Oc3ccccc3Cl)cc2)CC1 ZINC000470608547 885035150 /nfs/dbraw/zinc/03/51/50/885035150.db2.gz VHYINUISWJBATA-MRXNPFEDSA-N 0 3 403.910 4.053 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)Nc1cccc(OCc2ccc(F)cc2)c1 ZINC000503974323 912891577 /nfs/dbraw/zinc/89/15/77/912891577.db2.gz MHCKYEGYOOMIHY-UHFFFAOYSA-N 0 3 422.504 4.395 20 0 HIADHN CN(C(=O)c1cccc(OCc2cscn2)c1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470655130 885076466 /nfs/dbraw/zinc/07/64/66/885076466.db2.gz CEVMXNUKZQJKCE-QFIPXVFZSA-N 0 3 421.566 4.459 20 0 HIADHN CN(C(=O)Cc1ccc(F)c(Br)c1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470661727 885086512 /nfs/dbraw/zinc/08/65/12/885086512.db2.gz GMMYCJRDWGKBHK-SFHVURJKSA-N 0 3 419.338 4.254 20 0 HIADHN CN(C(=O)c1ccnc(OCc2ccccc2)c1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470667899 885096659 /nfs/dbraw/zinc/09/66/59/885096659.db2.gz MDNACAZYEFRDCC-DEOSSOPVSA-N 0 3 415.537 4.397 20 0 HIADHN CN(C(=O)Cc1csc(Cc2ccccc2)n1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470675723 885107028 /nfs/dbraw/zinc/10/70/28/885107028.db2.gz UBJLIMMGIOAWDF-HSZRJFAPSA-N 0 3 419.594 4.399 20 0 HIADHN CSc1nccn1-c1ccc(C(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000470675983 885107482 /nfs/dbraw/zinc/10/74/82/885107482.db2.gz WJPWDEUDJVDWPN-QFIPXVFZSA-N 0 3 420.582 4.331 20 0 HIADHN Cc1cc(C(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)c2c(n1)onc2C(C)C ZINC000470676905 885108916 /nfs/dbraw/zinc/10/89/16/885108916.db2.gz BXUHAQQYCJXTTN-IBGZPJMESA-N 0 3 406.530 4.391 20 0 HIADHN CC(C)N1CCC[C@@H](NC(=O)c2ccccc2CSc2nc3ccccc3[nH]2)C1 ZINC000470695826 885132677 /nfs/dbraw/zinc/13/26/77/885132677.db2.gz ZFOJWLPMCWXJIY-GOSISDBHSA-N 0 3 408.571 4.458 20 0 HIADHN COc1ccc([C@H](NC(=O)NC[C@@H](c2cccc(OC)c2)N2CCCC2)C2CC2)cc1 ZINC000503992958 912902312 /nfs/dbraw/zinc/90/23/12/912902312.db2.gz MQULMQXZQGZVRS-BJKOFHAPSA-N 0 3 423.557 4.291 20 0 HIADHN CC[C@H](NC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1)c1ccc2c(c1)OCCO2 ZINC000470722258 885169160 /nfs/dbraw/zinc/16/91/60/885169160.db2.gz HRZRNENMTZPXRY-YADHBBJMSA-N 0 3 423.557 4.215 20 0 HIADHN COc1ccc(CC[C@@H](C)NC(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000470725670 885176011 /nfs/dbraw/zinc/17/60/11/885176011.db2.gz IBNRUBKXHLXJQR-OFNKIYASSA-N 0 3 409.574 4.322 20 0 HIADHN CN(C(=O)N[C@H](c1ccccc1)[C@H]1CCCO1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470726645 885178273 /nfs/dbraw/zinc/17/82/73/885178273.db2.gz NYPNUBSVANMMGS-RBZQAINGSA-N 0 3 407.558 4.213 20 0 HIADHN CCCOCc1ccccc1CNC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470728713 885179529 /nfs/dbraw/zinc/17/95/29/885179529.db2.gz XJQHIJQEZDDCQU-DEOSSOPVSA-N 0 3 409.574 4.419 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N(C)Cc1nc(C(F)(F)F)cs1)c1ccsc1 ZINC000470739591 885201087 /nfs/dbraw/zinc/20/10/87/885201087.db2.gz CHUYOARGEBPMNW-CYBMUJFWSA-N 0 3 420.526 4.448 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)[C@H](C)Oc3cnc4ccccc4c3)c(C)c2)CC1 ZINC000470742699 885204439 /nfs/dbraw/zinc/20/44/39/885204439.db2.gz JAXAGSMVCZRUJJ-IBGZPJMESA-N 0 3 418.541 4.091 20 0 HIADHN CN(C(=O)NCc1ccc(OC(F)F)cc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470744915 885207880 /nfs/dbraw/zinc/20/78/80/885207880.db2.gz NGNKDMITIYYITG-IBGZPJMESA-N 0 3 403.473 4.094 20 0 HIADHN C[C@H](NC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1)c1ccccc1-n1cccn1 ZINC000470771982 885237700 /nfs/dbraw/zinc/23/77/00/885237700.db2.gz IGNMVFZWXOJFDJ-AZUAARDMSA-N 0 3 406.505 4.101 20 0 HIADHN CN(C(=O)c1cnn(-c2ccccc2)c1C1CC1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470812356 885300245 /nfs/dbraw/zinc/30/02/45/885300245.db2.gz QPNGCARUPMIKRY-HSZRJFAPSA-N 0 3 414.553 4.486 20 0 HIADHN COc1cc(F)c(C(=O)N(c2cccc(SC)c2)C2CCN(C)CC2)cc1OC ZINC000470856101 885351330 /nfs/dbraw/zinc/35/13/30/885351330.db2.gz OUYAIUFBGJLBRO-UHFFFAOYSA-N 0 3 418.534 4.306 20 0 HIADHN COc1cc(Cl)ccc1CNC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470890480 885385485 /nfs/dbraw/zinc/38/54/85/885385485.db2.gz WPSQLXLJPQPMBD-FQEVSTJZSA-N 0 3 401.938 4.155 20 0 HIADHN CCC(CC)[C@@H](c1ccc(Cl)cc1)N(C)CC(=O)N1CCC(C(=O)OC)CC1 ZINC000470929444 885433922 /nfs/dbraw/zinc/43/39/22/885433922.db2.gz DPSPGEVEORIWHF-NRFANRHFSA-N 0 3 408.970 4.161 20 0 HIADHN Cc1cc(Br)cc(C)c1NC(=O)CCCN1C[C@H](C)O[C@@H](C2CC2)C1 ZINC000470928743 885434037 /nfs/dbraw/zinc/43/40/37/885434037.db2.gz GXBQYJMWYOOVEP-MAUKXSAKSA-N 0 3 409.368 4.284 20 0 HIADHN CN(C(=O)c1cc2c(C(F)F)nn(C)c2s1)C1CCN(Cc2ccccc2)CC1 ZINC000470942838 885442453 /nfs/dbraw/zinc/44/24/53/885442453.db2.gz DFLIOEZQLPPVNV-UHFFFAOYSA-N 0 3 418.513 4.309 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)Nc1ccc(OCc2ccccc2F)cc1 ZINC000504033637 912936231 /nfs/dbraw/zinc/93/62/31/912936231.db2.gz BRTYCUNHCNRSFX-UHFFFAOYSA-N 0 3 422.504 4.395 20 0 HIADHN COc1cc(-c2noc(CN3CC[C@H](c4ccc(C)cc4C)C3)n2)cc(OC)c1OC ZINC000471000877 885501274 /nfs/dbraw/zinc/50/12/74/885501274.db2.gz KFNXTXJRZHWWRO-KRWDZBQOSA-N 0 3 423.513 4.369 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)c1cc2c(C(F)F)nn(C)c2s1 ZINC000471122623 885658878 /nfs/dbraw/zinc/65/88/78/885658878.db2.gz BSRKFGPATXSSFO-MRXNPFEDSA-N 0 3 420.529 4.459 20 0 HIADHN O=C(Nc1ccccc1OC(F)F)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000471123751 885661531 /nfs/dbraw/zinc/66/15/31/885661531.db2.gz HWZSPXPUZFFTHQ-UHFFFAOYSA-N 0 3 407.383 4.215 20 0 HIADHN COc1ccc(NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)c2cccnc12 ZINC000471253088 885830918 /nfs/dbraw/zinc/83/09/18/885830918.db2.gz MENWUGYTNNCFQL-UHFFFAOYSA-N 0 3 422.451 4.170 20 0 HIADHN Cc1ccc(NC(=O)Nc2cccc3c2CCN(C(=O)[C@@H](C(C)C)N(C)C)C3)cc1 ZINC000471277831 885858292 /nfs/dbraw/zinc/85/82/92/885858292.db2.gz KQXWIMICUGFOKM-JOCHJYFZSA-N 0 3 408.546 4.110 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1nnc(-c2ccc(Cl)cc2F)s1 ZINC000471307418 885896494 /nfs/dbraw/zinc/89/64/94/885896494.db2.gz XBGBGQNMFNRWGU-UHFFFAOYSA-N 0 3 423.901 4.186 20 0 HIADHN CC(=O)Nc1cc(C(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)cc(C(F)(F)F)c1 ZINC000471333792 885934935 /nfs/dbraw/zinc/93/49/35/885934935.db2.gz ZLVJCEVHQAMRPY-IFXJQAMLSA-N 0 3 419.447 4.229 20 0 HIADHN O=C(CCN1CCc2ccccc2C1)Nc1ccccc1NC(=O)C[C@H]1C=CCC1 ZINC000471381539 886027886 /nfs/dbraw/zinc/02/78/86/886027886.db2.gz MBDSYHZSZMYUHR-IBGZPJMESA-N 0 3 403.526 4.368 20 0 HIADHN COc1cc(NC(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)cc(-n2cccn2)c1 ZINC000471474244 886168802 /nfs/dbraw/zinc/16/88/02/886168802.db2.gz ARISBMMNPGKRQY-LJQANCHMSA-N 0 3 419.529 4.009 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)N[C@H]2C[C@H](c3ccc(Cl)cc3)C2)cc1 ZINC000504104293 913015411 /nfs/dbraw/zinc/01/54/11/913015411.db2.gz PZSKKTLFAZCZRT-YFVAEKQCSA-N 0 3 401.938 4.197 20 0 HIADHN C[C@H](NC(=O)COc1ccc(Oc2ccccn2)cc1)[C@@H](c1ccccc1)N(C)C ZINC000471538070 886242946 /nfs/dbraw/zinc/24/29/46/886242946.db2.gz OEIBGTWFLLXKDV-UUOWRZLLSA-N 0 3 405.498 4.060 20 0 HIADHN C[C@H](NC(=O)c1cccc(NC(=O)c2ccc(F)cc2)c1)[C@@H](c1ccccc1)N(C)C ZINC000471538216 886243861 /nfs/dbraw/zinc/24/38/61/886243861.db2.gz HYRMSORBHIHBLN-SBUREZEXSA-N 0 3 419.500 4.499 20 0 HIADHN Cc1c(I)cccc1C(=O)N[C@H](C)[C@H](c1ccccc1)N(C)C ZINC000471545507 886253708 /nfs/dbraw/zinc/25/37/08/886253708.db2.gz GHUPCTFETANHJW-RDTXWAMCSA-N 0 3 422.310 4.021 20 0 HIADHN COc1ccccc1[C@@H](CNC(=O)c1oc2ccccc2c1CN(C)C)OC(C)C ZINC000471551852 886259032 /nfs/dbraw/zinc/25/90/32/886259032.db2.gz OYFUZELIZIEPSR-JOCHJYFZSA-N 0 3 410.514 4.399 20 0 HIADHN Cc1cccc(C(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)c1I ZINC000471558951 886267244 /nfs/dbraw/zinc/26/72/44/886267244.db2.gz HUYKPSUVPAPABG-KBXCAEBGSA-N 0 3 422.310 4.021 20 0 HIADHN C[C@H](NC(=O)CCSc1ccc2c(c1)OCCCO2)[C@@H](c1ccccc1)N(C)C ZINC000471564609 886274166 /nfs/dbraw/zinc/27/41/66/886274166.db2.gz UFIKUQXUISCQNL-SBUREZEXSA-N 0 3 414.571 4.138 20 0 HIADHN C[C@@H](CCCCN1C(=O)c2ccccc2C1=O)NCc1coc(-c2ccccc2)n1 ZINC000471598594 886312182 /nfs/dbraw/zinc/31/21/82/886312182.db2.gz XRPVWUPHQPGGCS-KRWDZBQOSA-N 0 3 403.482 4.286 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)c3cc(C)sc3Br)c2)CC1 ZINC000471638708 886354551 /nfs/dbraw/zinc/35/45/51/886354551.db2.gz LCMFHLSHYVHJDE-UHFFFAOYSA-N 0 3 408.365 4.213 20 0 HIADHN Cc1ccc([C@H](NC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)c2ccccn2)cc1 ZINC000471677967 886388002 /nfs/dbraw/zinc/38/80/02/886388002.db2.gz JKNQASRXSDKBPA-ZCYQVOJMSA-N 0 3 414.553 4.443 20 0 HIADHN Cc1ccc2c(CCNC(=O)NC3CC(N4CCC(C(F)(F)F)CC4)C3)c[nH]c2c1 ZINC000471755901 886484955 /nfs/dbraw/zinc/48/49/55/886484955.db2.gz HAKCQLAEFRBZAS-UHFFFAOYSA-N 0 3 422.495 4.123 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)CS[C@@H](C)c2nc3ccccc3[nH]2)C1 ZINC000471800481 886537355 /nfs/dbraw/zinc/53/73/55/886537355.db2.gz RPCREMGFRFLFED-AOIWGVFYSA-N 0 3 408.571 4.309 20 0 HIADHN CCSCc1cc(C(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)no1 ZINC000471834924 886589479 /nfs/dbraw/zinc/58/94/79/886589479.db2.gz NGMBQDJUMKZKIB-UHFFFAOYSA-N 0 3 415.481 4.151 20 0 HIADHN CSc1cc(C(=O)NCCCCN2C[C@H](C)O[C@@H](C)C2)c(Cl)cc1Cl ZINC000471908997 886693380 /nfs/dbraw/zinc/69/33/80/886693380.db2.gz HFFFHEANFSGWMX-STQMWFEESA-N 0 3 405.391 4.335 20 0 HIADHN Cc1ccc([C@@H](NC(=O)NC[C@H]2CCCN2Cc2ccccc2)c2ccccn2)cc1 ZINC000471924240 886714216 /nfs/dbraw/zinc/71/42/16/886714216.db2.gz SCVLAVWWJBKABP-ILBGXUMGSA-N 0 3 414.553 4.443 20 0 HIADHN Cc1ccc([C@@H](NC(=O)NC[C@@H]2CCCN2Cc2ccccc2)c2ccccn2)cc1 ZINC000471924242 886714785 /nfs/dbraw/zinc/71/47/85/886714785.db2.gz SCVLAVWWJBKABP-UKILVPOCSA-N 0 3 414.553 4.443 20 0 HIADHN C[C@H](NC(=O)NC[C@@H](Cc1ccccc1)N(C)C)c1nc(-c2ccccc2)cs1 ZINC000504191613 913075074 /nfs/dbraw/zinc/07/50/74/913075074.db2.gz VYZFIUZYJGZNTE-FXAWDEMLSA-N 0 3 408.571 4.343 20 0 HIADHN CCCCO[C@@H]1C[C@@H](NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)C1(C)C ZINC000471991340 886817206 /nfs/dbraw/zinc/81/72/06/886817206.db2.gz HYSLIDCSKVYYED-OPQOLIRYSA-N 0 3 419.532 4.075 20 0 HIADHN CCCCO[C@H]1C[C@@H](NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)C1(C)C ZINC000471991339 886817530 /nfs/dbraw/zinc/81/75/30/886817530.db2.gz HYSLIDCSKVYYED-HIEASXQVSA-N 0 3 419.532 4.075 20 0 HIADHN Cc1ccc(NC(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)cc1OCC1CCOCC1 ZINC000472004707 886829602 /nfs/dbraw/zinc/82/96/02/886829602.db2.gz BIYUAPKHMKPSQV-VWNXMTODSA-N 0 3 423.557 4.367 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N2CCC(C)(c3ccc(Cl)cc3)CC2)CC1 ZINC000472017609 886839939 /nfs/dbraw/zinc/83/99/39/886839939.db2.gz KNLKERDKSLDRRI-UHFFFAOYSA-N 0 3 422.013 4.293 20 0 HIADHN Cc1nn(C)c(OCC(F)(F)F)c1CN[C@H]1C[C@H](OCc2ccccc2)C1(C)C ZINC000472041879 886859376 /nfs/dbraw/zinc/85/93/76/886859376.db2.gz OQHBYNJPPCCBIV-ROUUACIJSA-N 0 3 411.468 4.143 20 0 HIADHN COc1ccccc1[C@@H](CNCc1cnc2ccc(Br)cn12)OC(C)C ZINC000472044432 886861059 /nfs/dbraw/zinc/86/10/59/886861059.db2.gz NIVALTAIYVUNHR-LJQANCHMSA-N 0 3 418.335 4.361 20 0 HIADHN Cc1ccc([C@H](NC(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)c2ccccn2)cc1 ZINC000472069623 886875314 /nfs/dbraw/zinc/87/53/14/886875314.db2.gz KRXUFAZYNMNHAH-ZWSUVBHBSA-N 0 3 414.553 4.442 20 0 HIADHN CC(C)c1cccc(O[C@@H](C(=O)N[C@H](C)CCN2CCN(C)CC2)c2ccccc2)c1 ZINC000472084362 886884926 /nfs/dbraw/zinc/88/49/26/886884926.db2.gz APHUWDPIQLXGKK-PXDATVDWSA-N 0 3 423.601 4.072 20 0 HIADHN CCC(CC)[C@@H]1C[C@@H](NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)CCO1 ZINC000472131714 886923374 /nfs/dbraw/zinc/92/33/74/886923374.db2.gz CDZKJZMTJNWCNH-RGVPCPSESA-N 0 3 419.532 4.075 20 0 HIADHN COc1ccsc1[C@H](C)NCc1cc(C(F)(F)F)ccc1N1CCN(C)CC1 ZINC000472161799 886961052 /nfs/dbraw/zinc/96/10/52/886961052.db2.gz TWKSFJVJAFBQQI-AWEZNQCLSA-N 0 3 413.509 4.378 20 0 HIADHN CCc1c(C(=O)NC2CCN(Cc3ccccc3)CC2)cnn1-c1ccccc1C ZINC000472239855 887047156 /nfs/dbraw/zinc/04/71/56/887047156.db2.gz MBJUXRUWHACZFV-UHFFFAOYSA-N 0 3 402.542 4.138 20 0 HIADHN C[C@@H]1CC[C@@H](C)N1[C@H]1CCCN(CCS(=O)(=O)c2ccc(C(C)(C)C)cc2)C1 ZINC000472263137 887076329 /nfs/dbraw/zinc/07/63/29/887076329.db2.gz YUKVKKZWBGVNAJ-SBHAEUEKSA-N 0 3 406.636 4.095 20 0 HIADHN C[C@@H]1CC[C@H](C)N1[C@@H]1CCCN(CCS(=O)(=O)c2ccc(C(C)(C)C)cc2)C1 ZINC000472263144 887076723 /nfs/dbraw/zinc/07/67/23/887076723.db2.gz YUKVKKZWBGVNAJ-SVFBPWRDSA-N 0 3 406.636 4.095 20 0 HIADHN O=C(NC[C@@H]1CCCCN1CCc1nc(-c2cccc(Cl)c2)no1)c1ccccc1 ZINC000472273843 887088514 /nfs/dbraw/zinc/08/85/14/887088514.db2.gz CQEDWFGNRXDBIB-FQEVSTJZSA-N 0 3 424.932 4.217 20 0 HIADHN Cc1cc(C(=O)Nc2ccc(C(=O)N(C)[C@H]3CCCN(C)C3)cc2)c(C(F)(F)F)o1 ZINC000472307074 887133084 /nfs/dbraw/zinc/13/30/84/887133084.db2.gz VKAZBWYPWHOCAX-INIZCTEOSA-N 0 3 423.435 4.025 20 0 HIADHN CC[C@@H]1CN(C(C)=O)[C@@H](CC)CN1CCC(=O)Nc1ccccc1-c1ccccc1 ZINC000472344456 887178660 /nfs/dbraw/zinc/17/86/60/887178660.db2.gz TUXQIOIMQDAYHF-YADHBBJMSA-N 0 3 407.558 4.404 20 0 HIADHN CCN(CC)C(=O)c1ccc(NC(=O)CN2CC[C@@H](Cc3ccccc3)[C@H]2C)cc1 ZINC000472343433 887179030 /nfs/dbraw/zinc/17/90/30/887179030.db2.gz AHFFMPXYTAORKL-KNQAVFIVSA-N 0 3 407.558 4.060 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)NC(c1ccc(F)cc1)c1ccc(F)cc1 ZINC000504254844 913120257 /nfs/dbraw/zinc/12/02/57/913120257.db2.gz PIJYJOYGGXALPW-UHFFFAOYSA-N 0 3 424.495 4.223 20 0 HIADHN C[C@H](Oc1ccc2ccccc2c1)C(=O)NC1CCN([C@@H](C)c2ccncc2)CC1 ZINC000472398681 887245105 /nfs/dbraw/zinc/24/51/05/887245105.db2.gz RZBVGNUZZXWKEV-OALUTQOASA-N 0 3 403.526 4.344 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)[C@H](C)Oc2ccc3ccccc3c2)CC1 ZINC000472398674 887245498 /nfs/dbraw/zinc/24/54/98/887245498.db2.gz RZBVGNUZZXWKEV-MOPGFXCFSA-N 0 3 403.526 4.344 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N1CCc2c(Cl)cccc2C1 ZINC000472442903 887294225 /nfs/dbraw/zinc/29/42/25/887294225.db2.gz FDCYKCZFBDGWLY-UHFFFAOYSA-N 0 3 415.887 4.213 20 0 HIADHN CC[C@H](Cc1ccccc1)N(C)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472447449 887298306 /nfs/dbraw/zinc/29/83/06/887298306.db2.gz MIHGRMALDVBECL-IOJLRTSASA-N 0 3 411.512 4.454 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N1CC[C@H](c2ccc(F)cc2)C1 ZINC000472450813 887304370 /nfs/dbraw/zinc/30/43/70/887304370.db2.gz ISUMBSLQOVABDH-MNNVXMFVSA-N 0 3 413.459 4.130 20 0 HIADHN CC(C)(NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1ccc(F)c(F)c1 ZINC000472452603 887305985 /nfs/dbraw/zinc/30/59/85/887305985.db2.gz YNOJYPZJTRMRDE-UHFFFAOYSA-N 0 3 419.438 4.304 20 0 HIADHN CCC1(CC)[C@H](OC)C[C@H]1N(C)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472454472 887307416 /nfs/dbraw/zinc/30/74/16/887307416.db2.gz HMMIPDKKUHAQQV-OPQOLIRYSA-N 0 3 419.532 4.027 20 0 HIADHN COCCC[C@H](Cc1ccccc1)NC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C ZINC000472458681 887314370 /nfs/dbraw/zinc/31/43/70/887314370.db2.gz YQCGJQXFNPZCQX-RCZVLFRGSA-N 0 3 423.601 4.330 20 0 HIADHN COCCC[C@H](Cc1ccccc1)NC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC000472465029 887323595 /nfs/dbraw/zinc/32/35/95/887323595.db2.gz UCSXSDMJNSLRKW-RCZVLFRGSA-N 0 3 423.601 4.330 20 0 HIADHN C[C@@H]1C[C@@H](c2ccccc2)CN1C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472467611 887328203 /nfs/dbraw/zinc/32/82/03/887328203.db2.gz ZWHKDILIJATQEC-ZRFLGMCQSA-N 0 3 409.496 4.379 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N1CCSC2(CCCCC2)C1 ZINC000472468398 887328377 /nfs/dbraw/zinc/32/83/77/887328377.db2.gz TUCBMCWKNNRWOI-UHFFFAOYSA-N 0 3 419.557 4.253 20 0 HIADHN C[C@H](Oc1ccc2ccccc2c1)C(=O)N(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1 ZINC000472585560 887465454 /nfs/dbraw/zinc/46/54/54/887465454.db2.gz GJKGXEZFSJWEQC-OEOAZWSVSA-N 0 3 403.526 4.154 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000472700565 887553566 /nfs/dbraw/zinc/55/35/66/887553566.db2.gz DJKYCZJCUWOUEO-WMZHIEFXSA-N 0 3 422.573 4.343 20 0 HIADHN Cc1nc(-c2cccc(NC(=O)N(C)[C@H]3CCCN(Cc4ccccc4)C3)c2)no1 ZINC000472711883 887560926 /nfs/dbraw/zinc/56/09/26/887560926.db2.gz YNFHPMRTLUNPGG-NRFANRHFSA-N 0 3 405.502 4.173 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1ccc2nc(C(F)(F)F)cn2c1)c1ccsc1 ZINC000472730967 887577920 /nfs/dbraw/zinc/57/79/20/887577920.db2.gz LKQIJPLRWXRSCW-HNNXBMFYSA-N 0 3 410.465 4.228 20 0 HIADHN Cc1ccc(-c2nnco2)cc1NC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000472739901 887586025 /nfs/dbraw/zinc/58/60/25/887586025.db2.gz PMNLZZBBFFASNU-FQEVSTJZSA-N 0 3 405.502 4.173 20 0 HIADHN CN(C(=O)Nc1ccc(N2CCCC2=O)c(F)c1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000472744890 887590558 /nfs/dbraw/zinc/59/05/58/887590558.db2.gz CVGKKVQWNJFUOA-HXUWFJFHSA-N 0 3 424.520 4.081 20 0 HIADHN CCCOc1ccc(C(=O)CCC(=O)Nc2cccc(N3CCN(CC)CC3)c2)cc1 ZINC000472757522 887602609 /nfs/dbraw/zinc/60/26/09/887602609.db2.gz VRZKEXIHCGOXOE-UHFFFAOYSA-N 0 3 423.557 4.219 20 0 HIADHN CN1CC[C@@H](NC(=O)NCC2(CCOCc3ccccc3)CC2)[C@@H]1c1ccccc1 ZINC000472775776 887621911 /nfs/dbraw/zinc/62/19/11/887621911.db2.gz IQNIXXKPBSBAMJ-PKTZIBPZSA-N 0 3 407.558 4.118 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N[C@@H](CC1CCCC1)c1ccccc1 ZINC000504317873 913163509 /nfs/dbraw/zinc/16/35/09/913163509.db2.gz VRDGNEKEQWVBAH-QHCPKHFHSA-N 0 3 407.558 4.433 20 0 HIADHN O=C(Nc1ccc(F)cc1-c1nc(C2CC2)no1)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000472922286 887768993 /nfs/dbraw/zinc/76/89/93/887768993.db2.gz HFPZEPJKBFIFIT-GOSISDBHSA-N 0 3 421.476 4.149 20 0 HIADHN O=C(Nc1ccc(OCc2ccccn2)c(F)c1)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000472922537 887769096 /nfs/dbraw/zinc/76/90/96/887769096.db2.gz NZKXOMKXTBJZLZ-FQEVSTJZSA-N 0 3 420.488 4.196 20 0 HIADHN O=C(CCN1CC[C@]2(C1)OCc1ccccc12)Nc1ccc(Br)cc1F ZINC000473151910 887930985 /nfs/dbraw/zinc/93/09/85/887930985.db2.gz MJFWPUOGVPGXRO-HXUWFJFHSA-N 0 3 419.294 4.048 20 0 HIADHN O=C(CCC(=O)c1ccc2ccccc2c1)NC[C@@H]1CCN(Cc2ccccc2)C1 ZINC000473298086 888049631 /nfs/dbraw/zinc/04/96/31/888049631.db2.gz HESKPCWTEHTFNJ-NRFANRHFSA-N 0 3 400.522 4.441 20 0 HIADHN O=C(c1cc(O)ccc1C(F)(F)F)N1CCCN(CCCc2ccccc2)CC1 ZINC000473308586 888055237 /nfs/dbraw/zinc/05/52/37/888055237.db2.gz YZUCWPLAGFLQDB-UHFFFAOYSA-N 0 3 406.448 4.192 20 0 HIADHN CC(C)N1CCC[C@H](N[C@H](Cc2ccccn2)c2ccc(Br)cc2)C1=O ZINC000473444641 888167138 /nfs/dbraw/zinc/16/71/38/888167138.db2.gz ZMJOBIHIFONALP-VQTJNVASSA-N 0 3 416.363 4.117 20 0 HIADHN C[C@@H](CCN1CCN(C)CC1)NC(=O)Nc1ccccc1-c1nc2ccccc2s1 ZINC000473490149 888212094 /nfs/dbraw/zinc/21/20/94/888212094.db2.gz DUUPNOCGVWNOJV-KRWDZBQOSA-N 0 3 423.586 4.111 20 0 HIADHN CC(C)(Oc1cccc(Cl)c1)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473511228 888240956 /nfs/dbraw/zinc/24/09/56/888240956.db2.gz HUSZLZYCGLGPLZ-UHFFFAOYSA-N 0 3 418.887 4.419 20 0 HIADHN CC(C)[C@@H]1CC[C@@H](C)C[C@@H]1OCC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473513512 888243592 /nfs/dbraw/zinc/24/35/92/888243592.db2.gz NYQIIADATVUGKL-OUDVLWQGSA-N 0 3 418.544 4.385 20 0 HIADHN C[C@H](Cc1ccc(Cl)cc1)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473516305 888246661 /nfs/dbraw/zinc/24/66/61/888246661.db2.gz AGHXCHZTTNYZGZ-NLNFPOJYSA-N 0 3 402.888 4.440 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1cnc(-c2ccsc2)s1 ZINC000473516190 888247332 /nfs/dbraw/zinc/24/73/32/888247332.db2.gz AAEBUXSZBAICBU-UHFFFAOYSA-N 0 3 415.506 4.407 20 0 HIADHN O=C(CSc1ccc(Cl)cc1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473520374 888253042 /nfs/dbraw/zinc/25/30/42/888253042.db2.gz CTUDQKZPLTZJGE-UHFFFAOYSA-N 0 3 406.901 4.354 20 0 HIADHN C[C@H](Cc1ccccc1Cl)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473523360 888258305 /nfs/dbraw/zinc/25/83/05/888258305.db2.gz VLPIPMRPGUXHLS-NVPAJSRCSA-N 0 3 402.888 4.440 20 0 HIADHN O=C(Cc1ccc(C(F)(F)F)cc1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473523195 888258706 /nfs/dbraw/zinc/25/87/06/888258706.db2.gz HBHPAWGYEYUHDO-UHFFFAOYSA-N 0 3 408.386 4.169 20 0 HIADHN Cc1ccc(CSCC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cc1 ZINC000473525504 888261672 /nfs/dbraw/zinc/26/16/72/888261672.db2.gz WXURTEQRBWTFTO-UHFFFAOYSA-N 0 3 400.510 4.150 20 0 HIADHN CC[C@H](O[C@H]1CCC[C@@H](C)C1)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473534067 888271096 /nfs/dbraw/zinc/27/10/96/888271096.db2.gz UMBKGSAOFSPFGP-JVDIXKJGSA-N 0 3 404.517 4.282 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1cccc(Br)c1F ZINC000473534041 888271266 /nfs/dbraw/zinc/27/12/66/888271266.db2.gz PHLONUNLOCXCCL-UHFFFAOYSA-N 0 3 423.248 4.123 20 0 HIADHN Cc1cc(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)nn1-c1ccc(C)cc1 ZINC000473533609 888271881 /nfs/dbraw/zinc/27/18/81/888271881.db2.gz TYZZVYVRIBNEFW-UHFFFAOYSA-N 0 3 420.479 4.024 20 0 HIADHN Cc1cc(Sc2ccccc2)ccc1NC(=O)N[C@@H](C)CCN1CCN(C)CC1 ZINC000473653325 888401501 /nfs/dbraw/zinc/40/15/01/888401501.db2.gz GITUYDMDLKPBQD-IBGZPJMESA-N 0 3 412.603 4.294 20 0 HIADHN C[C@@H](CCN1CCN(C)CC1)NC(=O)Nc1ccccc1Oc1ccc(Cl)cc1 ZINC000473664739 888419053 /nfs/dbraw/zinc/41/90/53/888419053.db2.gz UTKBJACBIRAFKO-KRWDZBQOSA-N 0 3 416.953 4.280 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N[C@H]1C[C@H](c2ccc(OC)c(F)c2)C1)c1ccco1 ZINC000504433447 913244774 /nfs/dbraw/zinc/24/47/74/913244774.db2.gz IIQYNOXYHVSTMY-XPYUAMARSA-N 0 3 403.498 4.102 20 0 HIADHN CCN(C(=O)c1nn(-c2ccccc2)cc1C)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000473758590 888550682 /nfs/dbraw/zinc/55/06/82/888550682.db2.gz PYSHAAFHNBLDSI-NZQKXSOJSA-N 0 3 402.542 4.478 20 0 HIADHN CN(C)Cc1cccc(NC(=O)N[C@H]2CCN(c3ccc(Cl)cc3Cl)C2)c1 ZINC000473760417 888553845 /nfs/dbraw/zinc/55/38/45/888553845.db2.gz HERVNDLLNQLTSB-KRWDZBQOSA-N 0 3 407.345 4.455 20 0 HIADHN C[C@H](NC(=O)N(CCN(C)C)Cc1ccccn1)c1nc(-c2ccccc2)cs1 ZINC000504449229 913258071 /nfs/dbraw/zinc/25/80/71/913258071.db2.gz QLOXCFZFCLXWEQ-KRWDZBQOSA-N 0 3 409.559 4.040 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@@H]3CCCOc4c(F)cccc43)c2)CC1 ZINC000473808025 888630815 /nfs/dbraw/zinc/63/08/15/888630815.db2.gz NUVBHORIGZVEAL-OAQYLSRUSA-N 0 3 412.509 4.003 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)NC[C@@H]3CCC[C@@H](C(F)(F)F)C3)c2)CC1 ZINC000473810368 888634783 /nfs/dbraw/zinc/63/47/83/888634783.db2.gz SOJPLMKVPHNCBX-IAGOWNOFSA-N 0 3 412.500 4.319 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)NC[C@@H]3CCC[C@H](C(F)(F)F)C3)c2)CC1 ZINC000473810375 888634927 /nfs/dbraw/zinc/63/49/27/888634927.db2.gz SOJPLMKVPHNCBX-SJORKVTESA-N 0 3 412.500 4.319 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N(CCc3ccc(F)cc3)C3CC3)c2)CC1 ZINC000473815613 888641346 /nfs/dbraw/zinc/64/13/46/888641346.db2.gz FNEOTKXPCKJLFI-UHFFFAOYSA-N 0 3 410.537 4.207 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N(C)CCc3ccc(Cl)cc3)c2)CC1 ZINC000473814944 888641629 /nfs/dbraw/zinc/64/16/29/888641629.db2.gz DLXBAMVMOQCWOR-UHFFFAOYSA-N 0 3 400.954 4.188 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CCC[C@H]3c3ccc(OC)cc3)c2)CC1 ZINC000473835180 888672542 /nfs/dbraw/zinc/67/25/42/888672542.db2.gz IFZMLNGPLJGMTM-QHCPKHFHSA-N 0 3 408.546 4.206 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@@H](C)c3ccccc3OC(F)F)c2)CC1 ZINC000473836905 888673885 /nfs/dbraw/zinc/67/38/85/888673885.db2.gz OGZYBWWISADJHJ-INIZCTEOSA-N 0 3 418.488 4.313 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N(C)[C@H]3CCCc4cc(OC)ccc43)c2)CC1 ZINC000473837073 888674649 /nfs/dbraw/zinc/67/46/49/888674649.db2.gz QFQQCXXNLMCZLC-DEOSSOPVSA-N 0 3 422.573 4.378 20 0 HIADHN CCOc1cccc2[nH]cc(CC(=O)N3CCCN(Cc4ccccc4)C[C@@H]3C)c21 ZINC000473841162 888683327 /nfs/dbraw/zinc/68/33/27/888683327.db2.gz QZRCGRXBHLAGEO-IBGZPJMESA-N 0 3 405.542 4.232 20 0 HIADHN CC(C)Cc1ccc([C@@H](NC(=O)NC(C)(C)CCN2CCN(C)CC2)C2CC2)cc1 ZINC000473932596 888811923 /nfs/dbraw/zinc/81/19/23/888811923.db2.gz MEEXWSQIRMYIJS-HSZRJFAPSA-N 0 3 414.638 4.052 20 0 HIADHN Cc1cccc(Oc2ccccc2CNC(=O)NC(C)(C)CCN2CCN(C)CC2)c1 ZINC000473938012 888815298 /nfs/dbraw/zinc/81/52/98/888815298.db2.gz OFKIUKDCOLBIJP-UHFFFAOYSA-N 0 3 424.589 4.003 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)Nc2c(C)cccc2SC)CC1 ZINC000473995956 888856044 /nfs/dbraw/zinc/85/60/44/888856044.db2.gz VIVMZXOFBLCHAD-UHFFFAOYSA-N 0 3 412.603 4.176 20 0 HIADHN CN1CCN(CCC(C)(C)NC(=O)N[C@@H]2C[C@H]3CCC(C)(C)c4cccc2c43)CC1 ZINC000474004028 888862404 /nfs/dbraw/zinc/86/24/04/888862404.db2.gz ATHQFKIUPUKJLN-WIYYLYMNSA-N 0 3 412.622 4.002 20 0 HIADHN CN1CCN(CCC(C)(C)NC(=O)N[C@H]2C[C@@H]3CCC(C)(C)c4cccc2c43)CC1 ZINC000474004027 888862913 /nfs/dbraw/zinc/86/29/13/888862913.db2.gz ATHQFKIUPUKJLN-RXVVDRJESA-N 0 3 412.622 4.002 20 0 HIADHN CCOC1CC(CCN[C@@H](C)c2nnn(-c3cccc(Br)c3)c2C)C1 ZINC000474028969 888878596 /nfs/dbraw/zinc/87/85/96/888878596.db2.gz GYYQXNSBONICNR-UQHVZDHRSA-N 0 3 407.356 4.194 20 0 HIADHN O=C(N[C@@H](CO)c1c(Cl)cccc1Cl)N[C@H](CN1CCCC1)c1ccccc1 ZINC000474037407 888882881 /nfs/dbraw/zinc/88/28/81/888882881.db2.gz VLTLNLLEYJURGR-MOPGFXCFSA-N 0 3 422.356 4.163 20 0 HIADHN CCN(C)C(=O)[C@@H](C)N[C@@H]1CCCc2nc(-c3ccc(Br)cc3)sc21 ZINC000474108283 888929518 /nfs/dbraw/zinc/92/95/18/888929518.db2.gz WATORKNHTZYNOK-IUODEOHRSA-N 0 3 422.392 4.406 20 0 HIADHN C[C@@H]1CN(C2CCN(Cc3ccc(Br)cc3C(F)(F)F)CC2)CCO1 ZINC000474144874 888972238 /nfs/dbraw/zinc/97/22/38/888972238.db2.gz DMPKCALAZSBUPK-CYBMUJFWSA-N 0 3 421.301 4.153 20 0 HIADHN COc1ccc2[nH]cc(C3CCN(Cc4ccc5c(c4)sc(=O)n5C)CC3)c2c1 ZINC000474152413 888983014 /nfs/dbraw/zinc/98/30/14/888983014.db2.gz JGTYCMGGDJFPQF-UHFFFAOYSA-N 0 3 407.539 4.470 20 0 HIADHN C[C@@H](NC(=O)c1[nH]c2ccccc2c1Br)[C@H](c1ccccc1)N(C)C ZINC000474172212 889012230 /nfs/dbraw/zinc/01/22/30/889012230.db2.gz RNTCAFZUAGURFE-BFUOFWGJSA-N 0 3 400.320 4.352 20 0 HIADHN Cc1ccc(C)c([C@H]2CCCN2CC(=O)N2CCC(C(=O)Nc3ccccc3)CC2)c1 ZINC000474208158 889046257 /nfs/dbraw/zinc/04/62/57/889046257.db2.gz BTRUYZNJMAQLEC-XMMPIXPASA-N 0 3 419.569 4.318 20 0 HIADHN CCO[C@H](C)c1noc(CN2CCN(C[C@@H](CC(C)C)c3ccccc3)CC2)n1 ZINC000474267683 889130231 /nfs/dbraw/zinc/13/02/31/889130231.db2.gz NODZCXGLXSUVJC-TZIWHRDSSA-N 0 3 400.567 4.115 20 0 HIADHN CC(C)c1nc2c([nH]1)C[C@@H](C(=O)N1CCN(Cc3cccc4ccccc43)CC1)CC2 ZINC000474285923 889151964 /nfs/dbraw/zinc/15/19/64/889151964.db2.gz SXXNQUIWKGEDAL-FQEVSTJZSA-N 0 3 416.569 4.136 20 0 HIADHN CC(C)c1nc2c([nH]1)CC[C@H](C(=O)N1CCN(Cc3cccc4ccccc43)CC1)C2 ZINC000474285923 889151979 /nfs/dbraw/zinc/15/19/79/889151979.db2.gz SXXNQUIWKGEDAL-FQEVSTJZSA-N 0 3 416.569 4.136 20 0 HIADHN C[C@H](NC(=O)Nc1ccc(OCC2CCOCC2)cc1)[C@H](c1ccccc1)N(C)C ZINC000474434678 889300057 /nfs/dbraw/zinc/30/00/57/889300057.db2.gz AMHLGPYHWIMBQZ-FDDCHVKYSA-N 0 3 411.546 4.305 20 0 HIADHN COc1cc(NC(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)ccc1Br ZINC000474436792 889301092 /nfs/dbraw/zinc/30/10/92/889301092.db2.gz FEYIVUSMEYLFTG-SCLBCKFNSA-N 0 3 406.324 4.271 20 0 HIADHN COc1cc(NC(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)ccc1Br ZINC000474436786 889301289 /nfs/dbraw/zinc/30/12/89/889301289.db2.gz FEYIVUSMEYLFTG-ACJLOTCBSA-N 0 3 406.324 4.271 20 0 HIADHN CCc1ccc(-c2noc([C@H](C)NC(=O)N(CCN(C)C)Cc3ccccc3)n2)cc1 ZINC000474475405 889336622 /nfs/dbraw/zinc/33/66/22/889336622.db2.gz YGLRYTQOUHJVCM-SFHVURJKSA-N 0 3 421.545 4.133 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)N[C@H](c1cccc(Cl)c1)c1ccccn1 ZINC000474515707 889383332 /nfs/dbraw/zinc/38/33/32/889383332.db2.gz PGOGGUVLDYIQHP-OAQYLSRUSA-N 0 3 412.921 4.191 20 0 HIADHN C[C@@H](NC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C)c1noc(-c2ccccc2)n1 ZINC000474517345 889384769 /nfs/dbraw/zinc/38/47/69/889384769.db2.gz IYTKDAPFEXNZPQ-RBUKOAKNSA-N 0 3 419.529 4.104 20 0 HIADHN CCCCn1cc(C(=O)Nc2c(C)cnn2[C@@H]2CCN(Cc3ccccc3)C2)c(C)n1 ZINC000474519241 889387695 /nfs/dbraw/zinc/38/76/95/889387695.db2.gz KHNHPOHJDXLPPC-OAQYLSRUSA-N 0 3 420.561 4.196 20 0 HIADHN COc1ccc(Br)c(NC(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000474606666 889473240 /nfs/dbraw/zinc/47/32/40/889473240.db2.gz VCYGYMDHYAMEIK-MRXNPFEDSA-N 0 3 418.335 4.196 20 0 HIADHN CN(C(=O)Nc1ccccc1OC[C@@H]1CCCCO1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000474722221 889578525 /nfs/dbraw/zinc/57/85/25/889578525.db2.gz YUCKSXUNQGDDGN-VXKWHMMOSA-N 0 3 423.557 4.373 20 0 HIADHN CCC(C)(C)NC(=O)c1ccc(NC(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000474723016 889579087 /nfs/dbraw/zinc/57/90/87/889579087.db2.gz NHFCVHVNPFYCJH-JOCHJYFZSA-N 0 3 422.573 4.343 20 0 HIADHN COCCOc1c(Cl)cccc1NC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000474742761 889599211 /nfs/dbraw/zinc/59/92/11/889599211.db2.gz LQRSOECXKVJSSY-SFHVURJKSA-N 0 3 417.937 4.103 20 0 HIADHN C[C@@H](CN1CCC[C@@H](C)C1)NC(=O)c1ccc(NC(=O)Nc2ccccc2)s1 ZINC000474826925 889681323 /nfs/dbraw/zinc/68/13/23/889681323.db2.gz YPTBEZNGMALWDB-CVEARBPZSA-N 0 3 400.548 4.242 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)c3c(C)nn(-c4ccc(F)cc4)c3C)c2)CC1 ZINC000474838090 889697116 /nfs/dbraw/zinc/69/71/16/889697116.db2.gz UVBDZIOHVBOUDQ-UHFFFAOYSA-N 0 3 421.520 4.022 20 0 HIADHN C[C@@H](N[C@H](c1nc(-c2nc[nH]n2)no1)C(C)(C)C)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000474885825 889742493 /nfs/dbraw/zinc/74/24/93/889742493.db2.gz WXKCUDLYNMFTRD-FBKDDSFISA-N 0 3 406.943 4.439 20 0 HIADHN C[C@@H]([NH2+][C@H](c1nc(-c2nc[n-]n2)no1)C(C)(C)C)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000474885825 889742498 /nfs/dbraw/zinc/74/24/98/889742498.db2.gz WXKCUDLYNMFTRD-FBKDDSFISA-N 0 3 406.943 4.439 20 0 HIADHN Cc1cccc(COc2cccc(CC(=O)NC3CCN(CCOC(C)C)CC3)c2)c1 ZINC000474895503 889753714 /nfs/dbraw/zinc/75/37/14/889753714.db2.gz WZHKFDDWZOKJJG-UHFFFAOYSA-N 0 3 424.585 4.122 20 0 HIADHN Cc1cnc([C@H](C)CNCc2c(F)ccc(I)c2F)s1 ZINC000474949652 889805123 /nfs/dbraw/zinc/80/51/23/889805123.db2.gz UNYHOIPEVWNVKL-MRVPVSSYSA-N 0 3 408.255 4.228 20 0 HIADHN CCN(C(=O)Nc1ccc2oc(N(C)C)nc2c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000474997714 889849081 /nfs/dbraw/zinc/84/90/81/889849081.db2.gz HFQHPNNSAMEJDA-IBGZPJMESA-N 0 3 407.518 4.022 20 0 HIADHN CC(C)[C@@H](NC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1)c1nc2ccccc2[nH]1 ZINC000475012267 889865650 /nfs/dbraw/zinc/86/56/50/889865650.db2.gz GMIUTQFYCFUARZ-DENIHFKCSA-N 0 3 405.546 4.176 20 0 HIADHN CN(Cc1ccc(Cl)c(C(F)(F)F)c1)C[C@@H]1C[C@H](F)CN1Cc1ccnn1C ZINC000475086405 889933096 /nfs/dbraw/zinc/93/30/96/889933096.db2.gz HAKZLPDTDHPKMO-HOCLYGCPSA-N 0 3 418.866 4.137 20 0 HIADHN CC1CCN([C@@H](CNC(=O)c2ncccc2Br)c2ccccc2)CC1 ZINC000475122049 889979638 /nfs/dbraw/zinc/97/96/38/889979638.db2.gz SQPLFNBXYIMOBO-SFHVURJKSA-N 0 3 402.336 4.047 20 0 HIADHN C[C@H](NC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1)c1nc(C(C)(C)C)cs1 ZINC000475121949 889979829 /nfs/dbraw/zinc/97/98/29/889979829.db2.gz UOSSPHSJUWIGNI-FUHWJXTLSA-N 0 3 400.592 4.418 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@@H](C)C1CCOCC1)c1ccc(C(F)(F)F)cc1 ZINC000475133795 889997979 /nfs/dbraw/zinc/99/79/79/889997979.db2.gz BELAKRRLIQFSKS-HNAYVOBHSA-N 0 3 415.500 4.203 20 0 HIADHN CCN(C(=O)NCc1nc(C(C)(C)C)cs1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475161153 890024846 /nfs/dbraw/zinc/02/48/46/890024846.db2.gz GWUVKQWEOCQUIN-SFHVURJKSA-N 0 3 400.592 4.247 20 0 HIADHN CCN(C(=O)NCCc1csc(C(C)C)n1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475160621 890025498 /nfs/dbraw/zinc/02/54/98/890025498.db2.gz DIHIAYATBUUUBD-HXUWFJFHSA-N 0 3 400.592 4.115 20 0 HIADHN CCN(C(=O)NCc1cc(-c2ccccc2)on1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475168738 890034564 /nfs/dbraw/zinc/03/45/64/890034564.db2.gz WOVHEGBBIIKLRU-QFIPXVFZSA-N 0 3 404.514 4.148 20 0 HIADHN CCN(C(=O)NCc1csc(Br)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475179670 890049577 /nfs/dbraw/zinc/04/95/77/890049577.db2.gz WRXUPYPJDWXKOG-QGZVFWFLSA-N 0 3 422.392 4.317 20 0 HIADHN CCS(=O)(=O)c1ccc(CN[C@@H](C)Cc2ccc(Br)cc2F)s1 ZINC000475204086 890074818 /nfs/dbraw/zinc/07/48/18/890074818.db2.gz RIFJUNBPXFLRBR-NSHDSACASA-N 0 3 420.369 4.164 20 0 HIADHN Fc1cccc(Br)c1CNCCCCn1cc(Br)cn1 ZINC000475221810 890090041 /nfs/dbraw/zinc/09/00/41/890090041.db2.gz XHAFYAFVHSFNSB-UHFFFAOYSA-N 0 3 405.109 4.117 20 0 HIADHN CN(C(=O)NCc1ccc(-c2cccnc2)cc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475274151 890169542 /nfs/dbraw/zinc/16/95/42/890169542.db2.gz HXOXEFBHKWAADR-XMMPIXPASA-N 0 3 400.526 4.165 20 0 HIADHN CN(C(=O)c1ccccc1-c1nc(C(C)(C)C)no1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475303687 890212917 /nfs/dbraw/zinc/21/29/17/890212917.db2.gz JAUPFVCMJLMLPT-IBGZPJMESA-N 0 3 418.541 4.381 20 0 HIADHN Cc1c(C(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)cnn1-c1ccccc1Cl ZINC000475307018 890219268 /nfs/dbraw/zinc/21/92/68/890219268.db2.gz XJXBFWMSVKGTRX-IBGZPJMESA-N 0 3 408.933 4.181 20 0 HIADHN CN(C(=O)[C@@H]1C[C@@H]1c1ccccc1OC(F)(F)F)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475306830 890219593 /nfs/dbraw/zinc/21/95/93/890219593.db2.gz VDHPWTKJQLUWCE-MISYRCLQSA-N 0 3 418.459 4.422 20 0 HIADHN CN(C(=O)C1(c2cccc(Cl)c2)CCOCC1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475316833 890230929 /nfs/dbraw/zinc/23/09/29/890230929.db2.gz MKYVVSNEAUUAMK-JOCHJYFZSA-N 0 3 412.961 4.121 20 0 HIADHN CCCOc1c(Cl)cc(C(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)cc1OC ZINC000475317020 890234548 /nfs/dbraw/zinc/23/45/48/890234548.db2.gz NFNJTBUHFDAUGU-LJQANCHMSA-N 0 3 416.949 4.484 20 0 HIADHN COCCC[C@H](Cc1ccccc1)NCc1cc(O)c(OC)cc1Br ZINC000475329857 890250278 /nfs/dbraw/zinc/25/02/78/890250278.db2.gz CCLAKASOVLCKTB-QGZVFWFLSA-N 0 3 408.336 4.291 20 0 HIADHN Cn1ccnc1[C@@H](NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1cccc(F)c1 ZINC000475334116 890254435 /nfs/dbraw/zinc/25/44/35/890254435.db2.gz NAYGWGNZUDOCMK-ACBHZAAOSA-N 0 3 410.459 4.044 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)N[C@@H]1C[C@H]1c1ccc(Br)s1 ZINC000475360958 890287468 /nfs/dbraw/zinc/28/74/68/890287468.db2.gz LNVBEGRJFHFQTO-HZPDHXFCSA-N 0 3 422.392 4.140 20 0 HIADHN COC(=O)[C@@H]1CCN(Cc2cccc(NC(=O)c3ccccc3Cl)c2)C[C@@H]1C ZINC000475364677 890293279 /nfs/dbraw/zinc/29/32/79/890293279.db2.gz AGKYSGJBOGECBA-MAUKXSAKSA-N 0 3 400.906 4.223 20 0 HIADHN CCc1ccc(-c2nn(-c3ccccc3)cc2CNCC2(S(C)(=O)=O)CCC2)cc1 ZINC000475432105 890351924 /nfs/dbraw/zinc/35/19/24/890351924.db2.gz QEFHBCTXZNGDOI-UHFFFAOYSA-N 0 3 423.582 4.159 20 0 HIADHN C[C@H](CCc1ccc(Cl)s1)N[C@H](C(N)=O)c1cccc(Br)c1 ZINC000475438669 890357107 /nfs/dbraw/zinc/35/71/07/890357107.db2.gz HZGXCKFXQCLJLK-BMIGLBTASA-N 0 3 401.757 4.301 20 0 HIADHN CCOc1cc(CN[C@H]2CCCc3ccc(F)cc32)ccc1O[C@H](C)C(=O)N(C)C ZINC000475503753 890417132 /nfs/dbraw/zinc/41/71/32/890417132.db2.gz SYCCVJAQPGFINC-IERDGZPVSA-N 0 3 414.521 4.247 20 0 HIADHN CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)N[C@H]1CC[C@@H](c2cccc(F)c2)C1 ZINC000475517745 890435109 /nfs/dbraw/zinc/43/51/09/890435109.db2.gz KBNFPPSUIVFCPV-VLSUOOLDSA-N 0 3 410.537 4.191 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)Nc2ccc3nc(C4CC4)sc3c2)CC1 ZINC000475609371 890538172 /nfs/dbraw/zinc/53/81/72/890538172.db2.gz RKXHGWCQLJAMRL-UHFFFAOYSA-N 0 3 402.564 4.185 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)Nc2ccc(OC3CCCCC3)cc2)CC1 ZINC000475625864 890563260 /nfs/dbraw/zinc/56/32/60/890563260.db2.gz PFANKYSMAMFERC-UHFFFAOYSA-N 0 3 403.567 4.409 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)Nc2cc(-c3ccccc3)nn2C(C)C)CC1 ZINC000475629810 890571206 /nfs/dbraw/zinc/57/12/06/890571206.db2.gz WHLVHFLONIDOLQ-UHFFFAOYSA-N 0 3 413.566 4.142 20 0 HIADHN FC(F)(F)CCN(Cc1ccc(Br)cc1N1CCOCC1)CC1CC1 ZINC000475711805 890649990 /nfs/dbraw/zinc/64/99/90/890649990.db2.gz XBMNSQNUHJEXJV-UHFFFAOYSA-N 0 3 421.301 4.450 20 0 HIADHN COc1ccccc1CN(C)C(=O)CNC(C)(C)c1ccc(OC(F)(F)F)cc1 ZINC000475720474 890658707 /nfs/dbraw/zinc/65/87/07/890658707.db2.gz DCGBSIPPBZTVLW-UHFFFAOYSA-N 0 3 410.436 4.077 20 0 HIADHN CC(C)N(CC(F)(F)F)C(=O)CNC(C)(C)c1ccc(OC(F)(F)F)cc1 ZINC000475722503 890661616 /nfs/dbraw/zinc/66/16/16/890661616.db2.gz RUHIVIZKJHVOJT-UHFFFAOYSA-N 0 3 400.363 4.209 20 0 HIADHN C[C@H](c1ccc(Cl)cc1)[C@H](C)N(C)Cc1ccc(S(=O)(=O)N2CCCC2)o1 ZINC000475729226 890667177 /nfs/dbraw/zinc/66/71/77/890667177.db2.gz DXBWVWRNXCNEIJ-HOTGVXAUSA-N 0 3 410.967 4.342 20 0 HIADHN C[C@@H]1C[C@@H](C)[C@H](C)N(CC(=O)N(Cc2nnc(-c3ccccc3Cl)o2)C2CC2)C1 ZINC000475732792 890672931 /nfs/dbraw/zinc/67/29/31/890672931.db2.gz RNNXOBWUCHGMIZ-OAGGEKHMSA-N 0 3 416.953 4.247 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1oc(CC(C)C)nc1C ZINC000475913265 890841308 /nfs/dbraw/zinc/84/13/08/890841308.db2.gz VYWWTFVPGGQKAQ-HXUWFJFHSA-N 0 3 421.545 4.386 20 0 HIADHN C[C@H](c1ccc([S@@](C)=O)cc1)N(C)C(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000475956682 890877618 /nfs/dbraw/zinc/87/76/18/890877618.db2.gz KOQNRAZVWFQTBG-KJZPAOQPSA-N 0 3 419.616 4.025 20 0 HIADHN CN(Cc1nc2c(s1)CCCC2)C(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000475960688 890880920 /nfs/dbraw/zinc/88/09/20/890880920.db2.gz SOFDEBCSKFRFLU-INIZCTEOSA-N 0 3 404.605 4.062 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)N(C)Cc2nc3c(s2)CCCC3)N(C)C)cc1 ZINC000475985229 890901675 /nfs/dbraw/zinc/90/16/75/890901675.db2.gz MENQGHXLKSSJEQ-LJQANCHMSA-N 0 3 400.592 4.029 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2cccc3c2CN(CC(F)(F)F)C3)[C@@H]1c1ccccc1 ZINC000504768768 913500479 /nfs/dbraw/zinc/50/04/79/913500479.db2.gz AXMSIQBDURCPBX-UXHICEINSA-N 0 3 418.463 4.131 20 0 HIADHN Cn1cc(C(=O)NC[C@H](c2cccs2)N2CCCC2)c(-c2ccc(Cl)s2)n1 ZINC000476020546 890953028 /nfs/dbraw/zinc/95/30/28/890953028.db2.gz IJVOFTGIUWXCKN-CQSZACIVSA-N 0 3 420.991 4.430 20 0 HIADHN Cn1cc(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)c(-c2ccc(Cl)s2)n1 ZINC000476022434 890954658 /nfs/dbraw/zinc/95/46/58/890954658.db2.gz MECHLBKIEIPYFQ-KRWDZBQOSA-N 0 3 414.962 4.369 20 0 HIADHN CC(C)Cc1ccc([C@@H](CNC(=O)Nc2cnn(CC(F)(F)F)c2)N(C)C)cc1 ZINC000476149831 891074757 /nfs/dbraw/zinc/07/47/57/891074757.db2.gz KUZBDQSVFQNZBL-GOSISDBHSA-N 0 3 411.472 4.068 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1ccc(OCC2CCOCC2)cc1)c1ccco1 ZINC000476162260 891088404 /nfs/dbraw/zinc/08/84/04/891088404.db2.gz QABVSCUJTQBJFB-UWJYYQICSA-N 0 3 415.534 4.336 20 0 HIADHN COc1ccc(Br)c(NC(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)c1 ZINC000476232137 891155193 /nfs/dbraw/zinc/15/51/93/891155193.db2.gz XJHFVYNPBOJKTF-SCLBCKFNSA-N 0 3 406.324 4.271 20 0 HIADHN O=C(CN1CC[C@H](c2ccccc2)C1)N1CCC[C@@H]1c1ccc2c(c1)OCCCO2 ZINC000476241929 891165426 /nfs/dbraw/zinc/16/54/26/891165426.db2.gz MWHABZCWYOICMG-FCHUYYIVSA-N 0 3 406.526 4.001 20 0 HIADHN CCc1onc(-c2ccccc2Cl)c1C(=O)NC1CCN(CCOC(C)C)CC1 ZINC000476256878 891179685 /nfs/dbraw/zinc/17/96/85/891179685.db2.gz MVMDVELPBUISSP-UHFFFAOYSA-N 0 3 419.953 4.177 20 0 HIADHN Cc1cc(NC(=O)c2cc3[nH]ccc3s2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000476418071 891331755 /nfs/dbraw/zinc/33/17/55/891331755.db2.gz XIXSHRNPEAGEOB-QGZVFWFLSA-N 0 3 405.527 4.434 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)c1coc2cc(F)ccc12 ZINC000476424995 891338035 /nfs/dbraw/zinc/33/80/35/891338035.db2.gz AQXCVBCHNHHHSM-GOSISDBHSA-N 0 3 404.445 4.468 20 0 HIADHN CC(C)c1ccccc1OCCNC(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000476686389 891638015 /nfs/dbraw/zinc/63/80/15/891638015.db2.gz SRHOAAMGZVELPA-IBGZPJMESA-N 0 3 401.576 4.387 20 0 HIADHN CN(C(=O)NCC1(c2cccc(C(F)(F)F)c2)CCCC1)[C@@H]1CCN(C2CC2)C1 ZINC000476709043 891670091 /nfs/dbraw/zinc/67/00/91/891670091.db2.gz MTCSBHNARNQRJV-LJQANCHMSA-N 0 3 409.496 4.395 20 0 HIADHN CCN(Cc1ccc(OC)cc1OC)C(=O)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000476820428 891805474 /nfs/dbraw/zinc/80/54/74/891805474.db2.gz HCLGAEIXLRNVDS-QFIPXVFZSA-N 0 3 411.546 4.072 20 0 HIADHN CCN(C)Cc1cccc(CNC(=O)c2cn(CC)c3ccc(Cl)cc3c2=O)c1 ZINC000476870558 891832740 /nfs/dbraw/zinc/83/27/40/891832740.db2.gz APIFFEDDENWZSP-UHFFFAOYSA-N 0 3 411.933 4.057 20 0 HIADHN Cc1c(Br)scc1C(=O)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000476910001 891861993 /nfs/dbraw/zinc/86/19/93/891861993.db2.gz ADQQUWCMXJLILY-UHFFFAOYSA-N 0 3 409.349 4.028 20 0 HIADHN COc1ccc(OC)c([C@H]2CCCN2C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000504883838 913614535 /nfs/dbraw/zinc/61/45/35/913614535.db2.gz WUVLWTUQAMPIKN-NFBKMPQASA-N 0 3 423.557 4.215 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)Nc1cccc(-c2noc(C3CC3)n2)c1)c1ccco1 ZINC000477031477 891957192 /nfs/dbraw/zinc/95/71/92/891957192.db2.gz GAJSFQLZEWDJDC-KDOFPFPSSA-N 0 3 409.490 4.458 20 0 HIADHN CC(=O)c1c(C)[nH]c(C(=O)[C@@H](C)N2CC[C@]3(C2)CCCN(Cc2ccccc2)C3)c1C ZINC000477059687 891990626 /nfs/dbraw/zinc/99/06/26/891990626.db2.gz CFJYKENQEIWUAR-FQRUVTKNSA-N 0 3 421.585 4.393 20 0 HIADHN COc1ccc(OC)c([C@H]2CCCN2C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000504883840 913615712 /nfs/dbraw/zinc/61/57/12/913615712.db2.gz WUVLWTUQAMPIKN-NZQKXSOJSA-N 0 3 423.557 4.215 20 0 HIADHN C[C@@H](NC(=O)Nc1cccc(-c2noc(C3CC3)n2)c1)[C@H](c1ccccc1)N(C)C ZINC000477071060 892004649 /nfs/dbraw/zinc/00/46/49/892004649.db2.gz RMZNXPWJIUSFAP-FOIQADDNSA-N 0 3 405.502 4.427 20 0 HIADHN O=C(Nc1ccc(NC(=O)c2ccco2)cc1)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000504897160 913627352 /nfs/dbraw/zinc/62/73/52/913627352.db2.gz XECSIMCWDHBHRC-NRFANRHFSA-N 0 3 418.497 4.318 20 0 HIADHN C[C@@H](NC(=O)N[C@H](Cc1cccc(Br)c1)CC1CC1)C1=CCN(C)CC1 ZINC000477179607 892098515 /nfs/dbraw/zinc/09/85/15/892098515.db2.gz GTEFHLZIRQRBSZ-QRWLVFNGSA-N 0 3 420.395 4.110 20 0 HIADHN C[C@H](NC(=O)N[C@@H](Cc1cccc(Br)c1)CC1CC1)C1=CCN(C)CC1 ZINC000477179606 892099245 /nfs/dbraw/zinc/09/92/45/892099245.db2.gz GTEFHLZIRQRBSZ-MGPUTAFESA-N 0 3 420.395 4.110 20 0 HIADHN CC[C@H](C)C(=O)Nc1cccc(CNC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000504904250 913636457 /nfs/dbraw/zinc/63/64/57/913636457.db2.gz VKZCACYRBUPLRY-WMZHIEFXSA-N 0 3 422.573 4.135 20 0 HIADHN C[C@@H](CNC(=O)N1CCn2cccc2[C@@H]1c1ccccc1)N(C)Cc1ccccc1 ZINC000477397720 892352553 /nfs/dbraw/zinc/35/25/53/892352553.db2.gz XYTMHAGZCDSPGE-RDPSFJRHSA-N 0 3 402.542 4.123 20 0 HIADHN O[C@@H](COc1ccc(Cl)cc1Cl)CN1CCC[C@H]1c1ccc2c(c1)OCO2 ZINC000477462771 892429727 /nfs/dbraw/zinc/42/97/27/892429727.db2.gz GCPZFHOAIOKRBE-WBVHZDCISA-N 0 3 410.297 4.299 20 0 HIADHN CCN(C(=O)c1ccncc1Br)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000477467925 892441643 /nfs/dbraw/zinc/44/16/43/892441643.db2.gz ANTNNJSJODLZCK-DOTOQJQBSA-N 0 3 402.336 4.142 20 0 HIADHN CCN(C(=O)c1ccncc1Br)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000477467927 892444005 /nfs/dbraw/zinc/44/40/05/892444005.db2.gz ANTNNJSJODLZCK-NVXWUHKLSA-N 0 3 402.336 4.142 20 0 HIADHN CCOc1ccc([C@@H](C)NC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)cc1OC ZINC000504929272 913668288 /nfs/dbraw/zinc/66/82/88/913668288.db2.gz IIRFZWFFVZCYJQ-NQIIRXRSSA-N 0 3 411.546 4.119 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)c2csc(Br)c2C)cc1 ZINC000477619511 892720543 /nfs/dbraw/zinc/72/05/43/892720543.db2.gz CQVFABWHMSWLKX-QGZVFWFLSA-N 0 3 423.376 4.395 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)c2cccc(Oc3ccc(Cl)cc3)c2)CC1 ZINC000477634749 892757099 /nfs/dbraw/zinc/75/70/99/892757099.db2.gz GHOANUCMLJFPAN-GOSISDBHSA-N 0 3 415.965 4.136 20 0 HIADHN CCC(=O)Nc1ccc(Cl)c(NC(=O)NCC2(N3CCSCC3)CCCC2)c1 ZINC000504959478 913698193 /nfs/dbraw/zinc/69/81/93/913698193.db2.gz LXFQQSWDJXUQRX-UHFFFAOYSA-N 0 3 424.998 4.172 20 0 HIADHN CN(C)CCn1cc(NC(=O)c2ccc(Sc3ccc(Cl)cc3)o2)ccc1=O ZINC000477724866 892827988 /nfs/dbraw/zinc/82/79/88/892827988.db2.gz MFYKEWCJAGANSG-UHFFFAOYSA-N 0 3 417.918 4.060 20 0 HIADHN O=C(Nc1ccc(OCC(F)(F)F)c(Cl)c1)N1CCN(C2CCCC2)CC1 ZINC000504965039 913703044 /nfs/dbraw/zinc/70/30/44/913703044.db2.gz GZBPAZUNCDAJAB-UHFFFAOYSA-N 0 3 405.848 4.373 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1ccc(Oc2ccccc2)nc1 ZINC000477735663 892833232 /nfs/dbraw/zinc/83/32/32/892833232.db2.gz BMHBSHHAVIMOTF-UHFFFAOYSA-N 0 3 417.509 4.331 20 0 HIADHN C[C@@H]1C[C@@H]1c1ccc([C@H]2C[C@H]2C(=O)Nc2cccc(CN3CCC(CO)CC3)c2)o1 ZINC000477735809 892833506 /nfs/dbraw/zinc/83/35/06/892833506.db2.gz BIMAAEKRKXHHPO-YPVJZLTNSA-N 0 3 408.542 4.350 20 0 HIADHN COc1ccc([C@H](NC(=O)NCC2(N3CCSCC3)CCCC2)C(C)C)cc1 ZINC000504969346 913707383 /nfs/dbraw/zinc/70/73/83/913707383.db2.gz AZWGCWRJLUXAEG-HXUWFJFHSA-N 0 3 405.608 4.053 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N(C)Cc2nc(-c3ccccc3)c[nH]2)C1 ZINC000477817700 892885516 /nfs/dbraw/zinc/88/55/16/892885516.db2.gz GQNQZRULKFMLBB-NQIIRXRSSA-N 0 3 403.530 4.054 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N(C)Cc1nc(-c2ccccc2)c[nH]1)c1ccsc1 ZINC000477831163 892893691 /nfs/dbraw/zinc/89/36/91/892893691.db2.gz ZIFVKVBUYMPXJH-FQEVSTJZSA-N 0 3 411.575 4.363 20 0 HIADHN O=C(N[C@H](Cc1ccc(Cl)cc1)c1ccccn1)N1CCN(C2CCCC2)CC1 ZINC000504973323 913714549 /nfs/dbraw/zinc/71/45/49/913714549.db2.gz RLEKTWUYPDDNHV-JOCHJYFZSA-N 0 3 412.965 4.289 20 0 HIADHN C[C@@H](NCc1ccc(S(=O)(=O)CCO)cc1)c1ccc(-c2ccccc2F)s1 ZINC000477918804 893004319 /nfs/dbraw/zinc/00/43/19/893004319.db2.gz PNXVDTCTQVKODP-OAHLLOKOSA-N 0 3 419.543 4.171 20 0 HIADHN CN(C(=O)N[C@H]1CCC[C@@H]1c1ccccc1)C1CCN(CCc2ccccn2)CC1 ZINC000477947080 893036690 /nfs/dbraw/zinc/03/66/90/893036690.db2.gz ZFBHWYTWJNWSAA-RPWUZVMVSA-N 0 3 406.574 4.066 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3cccc(-n4cccc4)c3)CC2)C[C@H](C)O1 ZINC000478081483 893243669 /nfs/dbraw/zinc/24/36/69/893243669.db2.gz VHILGIFTLLPKFR-BGYRXZFFSA-N 0 3 410.562 4.221 20 0 HIADHN CC1CCN([C@H](CNC(=O)N[C@H]2CCO[C@@H](C(C)(C)C)C2)c2cccs2)CC1 ZINC000478219857 893379208 /nfs/dbraw/zinc/37/92/08/893379208.db2.gz LKDJZZHQWRHHTE-NLWGTHIKSA-N 0 3 407.624 4.414 20 0 HIADHN C[C@H](CNC(=O)C(=O)Nc1ccc(Oc2ccccc2)cc1)N(C)Cc1ccccc1 ZINC000478255742 893434735 /nfs/dbraw/zinc/43/47/35/893434735.db2.gz PIYWDWQOFAOQCI-LJQANCHMSA-N 0 3 417.509 4.054 20 0 HIADHN C[C@H]1CN(Cc2ccccc2CNCc2nc3ccc(Cl)cc3n2C)C[C@H](C)O1 ZINC000478312978 893536785 /nfs/dbraw/zinc/53/67/85/893536785.db2.gz LEBBBFXLPGOFOC-IRXDYDNUSA-N 0 3 412.965 4.126 20 0 HIADHN C[C@@H](NC(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1)c1c(F)cccc1Cl ZINC000478378717 893646362 /nfs/dbraw/zinc/64/63/62/893646362.db2.gz HTFXQFUENMTUIN-BZUAXINKSA-N 0 3 411.949 4.071 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)Cc3nc(-c4ccc(F)cc4)cs3)c2)CC1 ZINC000478588430 893862207 /nfs/dbraw/zinc/86/22/07/893862207.db2.gz CHCPDJUROMTUQS-UHFFFAOYSA-N 0 3 424.545 4.272 20 0 HIADHN O=C(N[C@@H](c1ccccc1)c1ccccn1)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000505105587 913819968 /nfs/dbraw/zinc/81/99/68/913819968.db2.gz QMWHNOLKWAMFBE-GGAORHGYSA-N 0 3 421.491 4.445 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2c(C)nn(-c3ccccc3)c2C)c1 ZINC000478785631 894062326 /nfs/dbraw/zinc/06/23/26/894062326.db2.gz GBHMAIPMLMTURS-UHFFFAOYSA-N 0 3 421.545 4.093 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2ccc(Br)cc2F)c1 ZINC000478787727 894063428 /nfs/dbraw/zinc/06/34/28/894063428.db2.gz KGZNDBXYKPULME-UHFFFAOYSA-N 0 3 424.314 4.193 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)NCc2csc(-c3ccccc3)n2)c1 ZINC000478836956 894115216 /nfs/dbraw/zinc/11/52/16/894115216.db2.gz CVYWOFBRONXDMU-UHFFFAOYSA-N 0 3 424.570 4.092 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)N[C@@H]2CCSc3c(F)cccc32)c1 ZINC000478925991 894206225 /nfs/dbraw/zinc/20/62/25/894206225.db2.gz LJWSXVBWOWWQSJ-HXUWFJFHSA-N 0 3 417.550 4.145 20 0 HIADHN COc1cc(Br)cc(NC(=O)N[C@@H](CN(C)C)c2ccc(F)cc2)c1 ZINC000478949052 894232098 /nfs/dbraw/zinc/23/20/98/894232098.db2.gz HFMILSJAQIRWLG-KRWDZBQOSA-N 0 3 410.287 4.021 20 0 HIADHN Cc1c(NC(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)cnn1CC(C)C ZINC000479045992 894307321 /nfs/dbraw/zinc/30/73/21/894307321.db2.gz MSRHEPIKKYMYAE-NRFANRHFSA-N 0 3 401.555 4.059 20 0 HIADHN COc1cc(CNCc2ccc(NC(=O)N(C)C)cc2)ccc1OCC(F)(F)F ZINC000479049432 894308420 /nfs/dbraw/zinc/30/84/20/894308420.db2.gz GDGJRROOVZZWSW-UHFFFAOYSA-N 0 3 411.424 4.020 20 0 HIADHN Cc1cc(C)c(S(N)(=O)=O)cc1[C@H](C)NCCOc1ccccc1-c1ccccc1 ZINC000479058564 894317585 /nfs/dbraw/zinc/31/75/85/894317585.db2.gz KAYQWRIPTQUSGF-IBGZPJMESA-N 0 3 424.566 4.347 20 0 HIADHN COCCSc1ccc([C@@H](C)N[C@H](C)c2cc(S(N)(=O)=O)c(C)cc2C)cc1 ZINC000479060489 894320805 /nfs/dbraw/zinc/32/08/05/894320805.db2.gz AHPYSAJNMCLCRG-IAGOWNOFSA-N 0 3 422.616 4.101 20 0 HIADHN Cc1cc(C)c(S(N)(=O)=O)cc1[C@H](C)N[C@@H](C)c1ccc(-c2cccnc2)cc1 ZINC000479062423 894322434 /nfs/dbraw/zinc/32/24/34/894322434.db2.gz BDIWAFYJRDHBQE-ROUUACIJSA-N 0 3 409.555 4.425 20 0 HIADHN C[C@@H](NCC(C)(C)c1ccccc1F)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479065825 894328484 /nfs/dbraw/zinc/32/84/84/894328484.db2.gz SNUWPGCZTUIXLV-LLVKDONJSA-N 0 3 419.349 4.408 20 0 HIADHN CS(=O)(=O)Cc1cccc(CN[C@@H]2CCCc3cc(Br)ccc32)c1 ZINC000479068150 894332188 /nfs/dbraw/zinc/33/21/88/894332188.db2.gz MCIRZIOOBGYZGE-LJQANCHMSA-N 0 3 408.361 4.161 20 0 HIADHN Cc1ccc([C@H](C)CN[C@@H](C)c2cc(S(N)(=O)=O)c(Cl)cc2Cl)cc1 ZINC000479077500 894342264 /nfs/dbraw/zinc/34/22/64/894342264.db2.gz MDUIHZDVBSVZJX-OLZOCXBDSA-N 0 3 401.359 4.404 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)Nc2cncc(Br)c2)N(C)C)cc1 ZINC000479076735 894342611 /nfs/dbraw/zinc/34/26/11/894342611.db2.gz DPVCLCOCMROEAF-SFHVURJKSA-N 0 3 421.339 4.056 20 0 HIADHN CC[C@H](C)n1nc(C(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)cc1C ZINC000479184329 894451405 /nfs/dbraw/zinc/45/14/05/894451405.db2.gz IHDHCFDDPBIHJV-FXAWDEMLSA-N 0 3 406.534 4.058 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)Nc1ccc(O[C@H]2CCCC[C@H]2O)cc1 ZINC000505204697 913882104 /nfs/dbraw/zinc/88/21/04/913882104.db2.gz PFIRQSBXAMONHS-IRLDBZIGSA-N 0 3 408.498 4.429 20 0 HIADHN C[C@@H](CCc1ccccc1)N[C@@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479333297 894625785 /nfs/dbraw/zinc/62/57/85/894625785.db2.gz WMGRTRZEAHZNQO-STQMWFEESA-N 0 3 401.359 4.313 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)N[C@H](C)c2ncc(-c3ccccc3)o2)c1 ZINC000479333665 894627931 /nfs/dbraw/zinc/62/79/31/894627931.db2.gz WYYZQZVTBHHHOR-GOSISDBHSA-N 0 3 422.529 4.185 20 0 HIADHN CC1(C)C[C@H](NCc2ccc(N3CCOCC3)nc2)c2cc(Br)ccc21 ZINC000479365400 894664524 /nfs/dbraw/zinc/66/45/24/894664524.db2.gz VUBXTKTUJJVJDM-IBGZPJMESA-N 0 3 416.363 4.193 20 0 HIADHN C[C@H](NCC1(Cc2ccccc2)CC1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479387495 894690247 /nfs/dbraw/zinc/69/02/47/894690247.db2.gz HGDQCZNGUAESPW-ZDUSSCGKSA-N 0 3 413.370 4.314 20 0 HIADHN C[C@@H](NCCc1nc(-c2ccc(Cl)cc2)no1)c1ccc(Br)cn1 ZINC000479391579 894694328 /nfs/dbraw/zinc/69/43/28/894694328.db2.gz KHLVKFOMJJONGI-LLVKDONJSA-N 0 3 407.699 4.441 20 0 HIADHN CN(Cc1nc(-c2ccccc2)c[nH]1)C(=O)NC[C@H](c1ccccc1)N1CCCC1 ZINC000479412615 894721911 /nfs/dbraw/zinc/72/19/11/894721911.db2.gz JGOUFUFSPVXMKK-JOCHJYFZSA-N 0 3 403.530 4.055 20 0 HIADHN COc1ccc(CN2CCCN(Cc3cccc(OC)c3OC(F)F)CC2)cc1 ZINC000505232225 913895979 /nfs/dbraw/zinc/89/59/79/913895979.db2.gz VSYONECOLNXIJX-UHFFFAOYSA-N 0 3 406.473 4.013 20 0 HIADHN CCC(CC)[C@@H]1C[C@H](N[C@@H](C)c2cc(S(N)(=O)=O)c(Cl)cc2Cl)CCO1 ZINC000479434362 894748875 /nfs/dbraw/zinc/74/88/75/894748875.db2.gz DJHDLGXWINDNCA-PPHDSNJXSA-N 0 3 423.406 4.275 20 0 HIADHN COC(=O)c1csc(-c2cccc(CN[C@H]3CCc4cc(OC)c(OC)cc43)c2)n1 ZINC000479439571 894754481 /nfs/dbraw/zinc/75/44/81/894754481.db2.gz SPUHHOJBEIDNOW-SFHVURJKSA-N 0 3 424.522 4.391 20 0 HIADHN CO[C@H](c1ccccc1Cl)[C@H](C)N[C@@H](C)c1cc(S(N)(=O)=O)c(C)cc1C ZINC000479448494 894767700 /nfs/dbraw/zinc/76/77/00/894767700.db2.gz DIPANBXFBOHSTA-AVYPCKFXSA-N 0 3 410.967 4.031 20 0 HIADHN Cc1ccc([C@@H](NCCc2cccc(C)n2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000479466016 894787332 /nfs/dbraw/zinc/78/73/32/894787332.db2.gz UCTDNDUCDVJMQI-DEOSSOPVSA-N 0 3 408.567 4.332 20 0 HIADHN CCS(=O)(=O)c1c(Cl)cccc1CNC[C@H]1CCCc2cc(OC)ccc21 ZINC000479473571 894796643 /nfs/dbraw/zinc/79/66/43/894796643.db2.gz AZRSWLPRXMEEPN-MRXNPFEDSA-N 0 3 407.963 4.352 20 0 HIADHN COCCCC[C@@H](N[C@H](C)c1cccc(S(=O)(=O)N(C)C)c1)c1ccccc1 ZINC000479487738 894809455 /nfs/dbraw/zinc/80/94/55/894809455.db2.gz GQSTXAWTDJHVFY-XMSQKQJNSA-N 0 3 404.576 4.146 20 0 HIADHN COCCCC[C@@H](N[C@@H](C)c1cc(S(N)(=O)=O)c(C)cc1C)c1ccccc1 ZINC000479500088 894818142 /nfs/dbraw/zinc/81/81/42/894818142.db2.gz PJPLOOXKWQWSIC-GHTZIAJQSA-N 0 3 404.576 4.159 20 0 HIADHN COc1ccc(CNCCc2ccc(OCC(F)(F)F)nc2)c(Cl)c1OC ZINC000479574431 894867020 /nfs/dbraw/zinc/86/70/20/894867020.db2.gz ACETXOJYDMMGIL-UHFFFAOYSA-N 0 3 404.816 4.026 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NC[C@H]3CCC4(CCCCC4)O3)c(C)c2)CC1 ZINC000479575001 894867956 /nfs/dbraw/zinc/86/79/56/894867956.db2.gz BRZILFSUJBXTAA-OAQYLSRUSA-N 0 3 414.594 4.140 20 0 HIADHN Cc1nn(C)c2ncc(CN[C@H](c3cc(F)cc(Br)c3)C3CC3)cc12 ZINC000479607133 894882225 /nfs/dbraw/zinc/88/22/25/894882225.db2.gz SEPXQSQBULLJTJ-SFHVURJKSA-N 0 3 403.299 4.419 20 0 HIADHN COCC[C@@H](NC(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1)c1ccc(C)o1 ZINC000479680422 894964131 /nfs/dbraw/zinc/96/41/31/894964131.db2.gz XKPQQZUDWHUZHR-NQIIRXRSSA-N 0 3 424.463 4.236 20 0 HIADHN CCc1nc2c(s1)[C@H](N(C)C(=O)N[C@@H]1C[C@H](C)N(Cc3ccccc3)C1)CCC2 ZINC000479734009 895033469 /nfs/dbraw/zinc/03/34/69/895033469.db2.gz HLEKRPXYHDNIFU-ILZDJORESA-N 0 3 412.603 4.387 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)NCc2cccc(-c3cccnc3)c2)c1 ZINC000479755853 895055713 /nfs/dbraw/zinc/05/57/13/895055713.db2.gz PPEXOMIYYIKHRY-UHFFFAOYSA-N 0 3 418.541 4.031 20 0 HIADHN COc1cc([C@@H](C)NC(=O)N[C@@H](CN(C)C)c2ccc(F)cc2)ccc1OC(C)C ZINC000479790016 895094421 /nfs/dbraw/zinc/09/44/21/895094421.db2.gz QIGNYEKCNADVFV-UZLBHIALSA-N 0 3 417.525 4.285 20 0 HIADHN COc1ccc([C@H](C)NC(=O)N[C@@H](CN2CCCC2)c2ccccc2)c(C)c1OC ZINC000479791679 895095928 /nfs/dbraw/zinc/09/59/28/895095928.db2.gz WOLJVVQLNZSZGO-RXVVDRJESA-N 0 3 411.546 4.210 20 0 HIADHN C[C@H](CN1CCCCCC1)NC(=O)c1cn(C2CC2)c2cc(Cl)c(F)cc2c1=O ZINC000479794543 895098663 /nfs/dbraw/zinc/09/86/63/895098663.db2.gz GWFSTMDVCMKTEB-CQSZACIVSA-N 0 3 419.928 4.123 20 0 HIADHN C[C@H](NC(=O)N[C@H]1CCN(Cc2ccccc2)[C@H]1C)c1ccc(NC(=O)C2CC2)cc1 ZINC000479819189 895133213 /nfs/dbraw/zinc/13/32/13/895133213.db2.gz SGORATXMNXFJMN-BSRJHKFKSA-N 0 3 420.557 4.058 20 0 HIADHN Cc1noc(C)c1COc1cc2ccccc2cc1C(=O)NCCN1CCC[C@@H](C)C1 ZINC000479860818 895196171 /nfs/dbraw/zinc/19/61/71/895196171.db2.gz WXTIEUSLAMPNPP-QGZVFWFLSA-N 0 3 421.541 4.485 20 0 HIADHN Cc1noc(C)c1COc1cc2ccccc2cc1C(=O)NCCN1CCC[C@H](C)C1 ZINC000479860782 895196822 /nfs/dbraw/zinc/19/68/22/895196822.db2.gz WXTIEUSLAMPNPP-KRWDZBQOSA-N 0 3 421.541 4.485 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)C1CCC(c2ccccc2)CC1 ZINC000479969932 895323434 /nfs/dbraw/zinc/32/34/34/895323434.db2.gz YLLAKENFYWFNJA-UHFFFAOYSA-N 0 3 406.570 4.234 20 0 HIADHN C[C@H](NC[C@@H](c1ccc(F)cc1)N1CCOCC1)c1ccc(F)cc1OC(F)F ZINC000480082191 895440468 /nfs/dbraw/zinc/44/04/68/895440468.db2.gz PQHHAEUBAMNLNV-LIRRHRJNSA-N 0 3 412.427 4.290 20 0 HIADHN COc1cccc([C@H](CN[C@@H](C)c2nnn(-c3ccccc3)c2C)N2CCCC2)c1 ZINC000480082836 895441130 /nfs/dbraw/zinc/44/11/30/895441130.db2.gz GQRZCRHSIOGUOB-MBSDFSHPSA-N 0 3 405.546 4.072 20 0 HIADHN COc1ccc([C@H](CN[C@@H](C)c2cc(OC)c(OC)cc2F)N2CCCC2)cc1 ZINC000480087507 895449093 /nfs/dbraw/zinc/44/90/93/895449093.db2.gz XEZOSUDUUHJXDB-KKSFZXQISA-N 0 3 402.510 4.339 20 0 HIADHN C[C@H](N[C@H]1CCS(=O)(=O)c2ccc(Br)cc21)[C@@H](C)c1ccccc1 ZINC000480167645 895558039 /nfs/dbraw/zinc/55/80/39/895558039.db2.gz JLZBEGJZQDUPCU-GLJUWKHASA-N 0 3 408.361 4.449 20 0 HIADHN CC1(CN[C@H]2CCS(=O)(=O)c3ccc(Br)cc32)Cc2ccccc2C1 ZINC000480170614 895560043 /nfs/dbraw/zinc/56/00/43/895560043.db2.gz ZASDXUDLVXDDGZ-SFHVURJKSA-N 0 3 420.372 4.062 20 0 HIADHN Cc1cccc([C@@H](C)CN[C@@H]2CCS(=O)(=O)c3ccc(Br)cc32)c1 ZINC000480202983 895601837 /nfs/dbraw/zinc/60/18/37/895601837.db2.gz ZOBKRQAKILXTQN-KBXCAEBGSA-N 0 3 408.361 4.369 20 0 HIADHN C[C@H](NCC1(C(N)=O)CCOCC1)c1ccc(Oc2ccc(F)cc2)cc1Cl ZINC000480221838 895627920 /nfs/dbraw/zinc/62/79/20/895627920.db2.gz IWSADPLTBRKSDR-AWEZNQCLSA-N 0 3 406.885 4.204 20 0 HIADHN CCN(CC)C(=O)c1ccc(CN[C@@H](C)c2ccc(NC(=O)NC3CC3)cc2)cc1 ZINC000480231032 895636642 /nfs/dbraw/zinc/63/66/42/895636642.db2.gz RDUVOHWCQBFTJF-KRWDZBQOSA-N 0 3 408.546 4.303 20 0 HIADHN CC[C@H](N[C@@H](CN1CCCC1)c1ccccc1)c1ccccc1OCC(=O)N(C)C ZINC000480233230 895638642 /nfs/dbraw/zinc/63/86/42/895638642.db2.gz UQKDSYUDOWLJAZ-GOTSBHOMSA-N 0 3 409.574 4.031 20 0 HIADHN C[C@H](NCc1ccc(CN2C[C@@H](C)O[C@@H](C)C2)cc1)c1cnn(Cc2ccccc2)c1 ZINC000480236639 895645696 /nfs/dbraw/zinc/64/56/96/895645696.db2.gz VQCRYCWIAPSFIP-BDTNDASRSA-N 0 3 418.585 4.391 20 0 HIADHN CC[C@H](N[C@@H](C)c1ccc(S(=O)(=O)N2CCOCC2)cc1)c1ccc(Cl)cc1 ZINC000480283618 895688641 /nfs/dbraw/zinc/68/86/41/895688641.db2.gz OOPDTAAVOVZCSQ-KKSFZXQISA-N 0 3 422.978 4.163 20 0 HIADHN Cc1cc(I)cc(C(=O)Nc2cccc(CN(C)C)c2)c1C ZINC000480335496 895739136 /nfs/dbraw/zinc/73/91/36/895739136.db2.gz XSAWMWRCLODUKM-UHFFFAOYSA-N 0 3 408.283 4.222 20 0 HIADHN CCN(Cc1cccc(Br)c1)C(=O)NC[C@@H](Cc1ccccc1)N(C)C ZINC000480337411 895741477 /nfs/dbraw/zinc/74/14/77/895741477.db2.gz RTIZOKNXVUETAA-HXUWFJFHSA-N 0 3 418.379 4.154 20 0 HIADHN COc1cc([C@H](C)N[C@@H](CN2CCOCC2)c2ccc(C)cc2)ccc1SC ZINC000480413317 895812833 /nfs/dbraw/zinc/81/28/33/895812833.db2.gz FTLIEUYQFWIPSK-RXVVDRJESA-N 0 3 400.588 4.450 20 0 HIADHN Brc1ccc2c(c1)CC[C@@H]2N[C@@H](CN1CCOCC1)c1ccccc1 ZINC000480441018 895832092 /nfs/dbraw/zinc/83/20/92/895832092.db2.gz BLDKHUIRSIFYJY-SFTDATJTSA-N 0 3 401.348 4.100 20 0 HIADHN CNS(=O)(=O)c1ccc([C@@H](C)NCc2ccc(Oc3ccc(F)cc3)cc2)cc1 ZINC000480452469 895840022 /nfs/dbraw/zinc/84/00/22/895840022.db2.gz HLFIVVHBHJIKBO-MRXNPFEDSA-N 0 3 414.502 4.377 20 0 HIADHN CNS(=O)(=O)c1ccc([C@H](C)NCc2ccc(Oc3ccc(F)cc3)cc2)cc1 ZINC000480452467 895840064 /nfs/dbraw/zinc/84/00/64/895840064.db2.gz HLFIVVHBHJIKBO-INIZCTEOSA-N 0 3 414.502 4.377 20 0 HIADHN Cc1ccc([C@H](CN2CCOCC2)N[C@H](C)c2ccc(NC(=O)NC3CC3)cc2)cc1 ZINC000480453960 895840937 /nfs/dbraw/zinc/84/09/37/895840937.db2.gz GAEAJHMVDCEPOT-DVECYGJZSA-N 0 3 422.573 4.003 20 0 HIADHN CC(C)n1ncc2c1C[C@@H](NCc1nc(-c3ccc(Br)cc3)c[nH]1)CC2 ZINC000480486844 895862830 /nfs/dbraw/zinc/86/28/30/895862830.db2.gz KIXHVMOLUGUXDF-KRWDZBQOSA-N 0 3 414.351 4.264 20 0 HIADHN COc1ccc(C(=O)N(C)C[C@@H]2CCN(C)[C@H]2c2cccnc2)c(OC2CCCC2)c1 ZINC000480501730 895871430 /nfs/dbraw/zinc/87/14/30/895871430.db2.gz OGTLTRLBKCLMDU-CYFREDJKSA-N 0 3 423.557 4.177 20 0 HIADHN Cc1cccc(Oc2ccc(NC(=O)N3CC[C@@H](N4CCN(C)CC4)[C@@H](C)C3)cc2)c1 ZINC000480542154 895904118 /nfs/dbraw/zinc/90/41/18/895904118.db2.gz RCGBCYZHVMUXBO-GBXCKJPGSA-N 0 3 422.573 4.277 20 0 HIADHN CC1CCN(C(=O)c2ccc(NC3CC(N4CCC(C(F)(F)F)CC4)C3)nc2)CC1 ZINC000480551298 895912021 /nfs/dbraw/zinc/91/20/21/895912021.db2.gz KBRGLDGUMUKYMR-UHFFFAOYSA-N 0 3 424.511 4.171 20 0 HIADHN CC(C)(C)C(=O)N1CCC(CN[C@H](C(=O)Nc2ccccc2)c2ccccc2)CC1 ZINC000480564103 895923969 /nfs/dbraw/zinc/92/39/69/895923969.db2.gz PPKDRRMQBHAFLE-QFIPXVFZSA-N 0 3 407.558 4.241 20 0 HIADHN CCc1cc(C(=O)NC[C@@H](c2ccc(C(F)(F)F)cc2)N(CC)CC)cc(=O)[nH]1 ZINC000480567591 895928639 /nfs/dbraw/zinc/92/86/39/895928639.db2.gz HMAUSATVYZSHLF-SFHVURJKSA-N 0 3 409.452 4.181 20 0 HIADHN CN1CC[C@@H](NC(=O)[C@@H]2C[C@H]2c2ccc(OC(F)(F)F)cc2)[C@@H]1c1ccccc1 ZINC000480578082 895937683 /nfs/dbraw/zinc/93/76/83/895937683.db2.gz MWLJRRTZLAWZKL-NMLBUPMWSA-N 0 3 404.432 4.250 20 0 HIADHN C[C@H](NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)nc1)c1ccc(OCC(F)(F)F)cc1 ZINC000480600279 895962414 /nfs/dbraw/zinc/96/24/14/895962414.db2.gz GVGHCJGJOIHLMD-ZACQAIPSSA-N 0 3 423.479 4.487 20 0 HIADHN C[C@@H](NCc1ccnc(OCc2ccccc2)c1)c1cccc(N2CCOCC2)c1 ZINC000480607942 895973612 /nfs/dbraw/zinc/97/36/12/895973612.db2.gz JUYVELCOKAXMPB-HXUWFJFHSA-N 0 3 403.526 4.348 20 0 HIADHN CCCCOc1ccc([C@@H](C)NCc2ccc(N3CCO[C@H](C)C3)nc2)cc1OC ZINC000480622273 895989592 /nfs/dbraw/zinc/98/95/92/895989592.db2.gz GDLVVKUIFUHSGF-RTBURBONSA-N 0 3 413.562 4.345 20 0 HIADHN COCCN(C)c1ccc(CNCc2ccc(CN3CCc4ccccc43)cc2)cn1 ZINC000480668576 896033569 /nfs/dbraw/zinc/03/35/69/896033569.db2.gz NGIBADIBTCSNLX-UHFFFAOYSA-N 0 3 416.569 4.017 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N2CCC[C@H]2c2ccc3c(c2)OCO3)N(C)C)cc1 ZINC000480679523 896043479 /nfs/dbraw/zinc/04/34/79/896043479.db2.gz BFBFVOHMSUDTIW-SFTDATJTSA-N 0 3 409.530 4.127 20 0 HIADHN CCS(=O)(=O)Nc1ccc([C@H](C)NCc2ccc(N3CCCCCC3)nc2)cc1 ZINC000480693345 896056494 /nfs/dbraw/zinc/05/64/94/896056494.db2.gz BQLXHWFKECSWJE-SFHVURJKSA-N 0 3 416.591 4.074 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)N1CCC[C@H]1c1ccc2c(c1)OCO2 ZINC000480701611 896063231 /nfs/dbraw/zinc/06/32/31/896063231.db2.gz KPDAAFBIZKHCNS-ROUUACIJSA-N 0 3 413.543 4.160 20 0 HIADHN O=S1(=O)CCCN1c1ccc(CN[C@@H](c2ccc(Cl)cc2)C2CC2)cc1F ZINC000480705482 896067720 /nfs/dbraw/zinc/06/77/20/896067720.db2.gz DLBUXWRUVNWKSM-HXUWFJFHSA-N 0 3 408.926 4.260 20 0 HIADHN COCCOc1ccc([C@H](C)N[C@H](C)c2ccc3c(c2)C(C)(C)C(=O)N3)cc1OC ZINC000480719103 896079099 /nfs/dbraw/zinc/07/90/99/896079099.db2.gz PGURKSXQDGHLJX-CVEARBPZSA-N 0 3 412.530 4.362 20 0 HIADHN CCNC(=O)COc1ccc(CN[C@H]2CCCCc3ccc(Cl)cc32)cc1OC ZINC000480727385 896088579 /nfs/dbraw/zinc/08/85/79/896088579.db2.gz JIJKGNYAQOWHCG-FQEVSTJZSA-N 0 3 416.949 4.421 20 0 HIADHN CCCOc1ccc([C@@H](C)N[C@H](C)c2ccc(NS(C)(=O)=O)cc2)cc1OC ZINC000480737435 896096989 /nfs/dbraw/zinc/09/69/89/896096989.db2.gz ILFGBNFTFSREJX-HZPDHXFCSA-N 0 3 406.548 4.267 20 0 HIADHN C[C@@H](N[C@H](c1cc(F)cc(Br)c1)C1CC1)c1ccc(-n2cnnn2)cc1 ZINC000480758374 896120655 /nfs/dbraw/zinc/12/06/55/896120655.db2.gz NMRQMZIORGWIEL-BLVKFPJESA-N 0 3 416.298 4.366 20 0 HIADHN C[C@H](NCc1ccc(N(C)C)nc1)c1cccc(OCc2cn3ccccc3n2)c1 ZINC000480791740 896160947 /nfs/dbraw/zinc/16/09/47/896160947.db2.gz APVFZJJAVFISCN-SFHVURJKSA-N 0 3 401.514 4.225 20 0 HIADHN Cc1nc(C(C)C)sc1[C@H](C)NCCNC(=O)c1ccc(Br)cc1 ZINC000480876390 896234760 /nfs/dbraw/zinc/23/47/60/896234760.db2.gz IXUKZRIUZPSPTH-LBPRGKRZSA-N 0 3 410.381 4.418 20 0 HIADHN Brc1ccc2nc(CN[C@H](c3ccc4c(c3)OCCO4)C3CC3)[nH]c2c1 ZINC000480887985 896244342 /nfs/dbraw/zinc/24/43/42/896244342.db2.gz GQKSKNDLCKIICL-FQEVSTJZSA-N 0 3 414.303 4.338 20 0 HIADHN COc1cc(CN[C@@H]2C[C@@H](C)c3c2cccc3Br)ccc1OCCO ZINC000480887191 896245005 /nfs/dbraw/zinc/24/50/05/896245005.db2.gz DGGJLEJFUOLXNT-CXAGYDPISA-N 0 3 406.320 4.167 20 0 HIADHN Cc1c([C@@H](C)NCc2ccc(CN3CCCC3=O)cc2)cnn1-c1ccc(F)cc1 ZINC000480905255 896261455 /nfs/dbraw/zinc/26/14/55/896261455.db2.gz YXBYXCNQEKHMHY-QGZVFWFLSA-N 0 3 406.505 4.293 20 0 HIADHN COc1cccc([C@@H](C)N[C@H](C)c2ccc(S(=O)(=O)N3CCCCC3)cc2)c1 ZINC000480909020 896265196 /nfs/dbraw/zinc/26/51/96/896265196.db2.gz GVHIGWIXGLAGIN-QZTJIDSGSA-N 0 3 402.560 4.282 20 0 HIADHN C[C@H](NCc1ccc(CN2CCN(C)CC2)cc1)c1nc(-c2ccccc2)cs1 ZINC000480920812 896278653 /nfs/dbraw/zinc/27/86/53/896278653.db2.gz NJQIOXMHRJGZGV-IBGZPJMESA-N 0 3 406.599 4.408 20 0 HIADHN CCS[C@H]1CCCCN(C(=O)Nc2ccc(N3CCN(CC)CC3)cc2C)C1 ZINC000480921888 896279910 /nfs/dbraw/zinc/27/99/10/896279910.db2.gz QTFLLROEOYCWFQ-FQEVSTJZSA-N 0 3 404.624 4.276 20 0 HIADHN COC(=O)c1cc(NC(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)cc(Cl)c1F ZINC000480971392 896309403 /nfs/dbraw/zinc/30/94/03/896309403.db2.gz NNPULICFYOHAKT-KZULUSFZSA-N 0 3 407.873 4.079 20 0 HIADHN CCO[C@H]1C[C@@H](O)C12CCN(Cc1cc(-c3c(OC)ccc4ccccc43)no1)CC2 ZINC000481094431 896416305 /nfs/dbraw/zinc/41/63/05/896416305.db2.gz QMFVYEXNZJHFBF-PKTZIBPZSA-N 0 3 422.525 4.255 20 0 HIADHN CC[C@H](N[C@H](C)c1ccc(S(=O)(=O)NC)cc1)c1cccc(Br)c1 ZINC000481181320 896520167 /nfs/dbraw/zinc/52/01/67/896520167.db2.gz ZBXVTZZSJUPSKD-ACJLOTCBSA-N 0 3 411.365 4.159 20 0 HIADHN COc1cc([C@H](C)N[C@@H](C)c2ccc(NC(=O)NC(C)C)cc2)ccc1OCCO ZINC000481185422 896529314 /nfs/dbraw/zinc/52/93/14/896529314.db2.gz GRCNEZHDMHXETB-IRXDYDNUSA-N 0 3 415.534 4.008 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)NCc2nccc3ccccc32)N(C)C)cc1 ZINC000481232011 896583115 /nfs/dbraw/zinc/58/31/15/896583115.db2.gz FZZPBWBCQAFERV-HSZRJFAPSA-N 0 3 406.530 4.124 20 0 HIADHN C[C@@H](N[C@@H](C)c1cccc(OC(F)F)c1)c1ccc(OCC(=O)NC2CC2)cc1 ZINC000481293658 896638067 /nfs/dbraw/zinc/63/80/67/896638067.db2.gz HYHMYRVIHGPUDM-CABCVRRESA-N 0 3 404.457 4.357 20 0 HIADHN CCC(CC)C(=O)N1CCC(N[C@H](C)c2nnn(-c3ccc(Cl)cc3)c2C)CC1 ZINC000481302583 896649086 /nfs/dbraw/zinc/64/90/86/896649086.db2.gz CVQUKGPVYWHXIM-OAHLLOKOSA-N 0 3 417.985 4.307 20 0 HIADHN Cc1c([C@@H](C)NC2CCN(Cc3ccc(F)cc3)CC2)nnn1-c1ccc(F)cc1 ZINC000481309034 896656910 /nfs/dbraw/zinc/65/69/10/896656910.db2.gz HCGSIBOJHLRICJ-MRXNPFEDSA-N 0 3 411.500 4.169 20 0 HIADHN CCc1nc2c(s1)[C@@H](N[C@@H](CC)c1ccccc1OCC(=O)N(C)C)CCC2 ZINC000481317713 896669829 /nfs/dbraw/zinc/66/98/29/896669829.db2.gz UNZPDOPZGOIHON-IRXDYDNUSA-N 0 3 401.576 4.291 20 0 HIADHN CCc1nc2c(s1)[C@@H](N[C@H](CC)c1ccccc1OCC(=O)N(C)C)CCC2 ZINC000481317717 896669900 /nfs/dbraw/zinc/66/99/00/896669900.db2.gz UNZPDOPZGOIHON-SJORKVTESA-N 0 3 401.576 4.291 20 0 HIADHN CC[C@H](NCc1ccc(S(=O)(=O)N2CCC[C@@H](C)C2)cc1)c1cccc(OC)c1 ZINC000481318830 896670558 /nfs/dbraw/zinc/67/05/58/896670558.db2.gz KMYIYZHFIBIRDX-JPYJTQIMSA-N 0 3 416.587 4.357 20 0 HIADHN CC[C@H](N[C@@H](C)c1ccc2c(c1)OCCO2)c1ccccc1OCC(=O)N1CCCC1 ZINC000481319982 896672570 /nfs/dbraw/zinc/67/25/70/896672570.db2.gz USZAFMYMQZKVRL-RXVVDRJESA-N 0 3 424.541 4.261 20 0 HIADHN C[C@H](NCc1ccc(N2CCc3ccccc3C2)nc1)c1ccc([S@](C)=O)cc1 ZINC000481323650 896677798 /nfs/dbraw/zinc/67/77/98/896677798.db2.gz OUSVATZYVUYGKR-YRVHBCJASA-N 0 3 405.567 4.233 20 0 HIADHN FC(F)(F)Oc1ccc2c(c1)[C@@H](NCc1cccc(CN3CCOCC3)c1)CC2 ZINC000481326265 896683621 /nfs/dbraw/zinc/68/36/21/896683621.db2.gz XBEBSDWKVZDMIP-NRFANRHFSA-N 0 3 406.448 4.195 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)NCc3c(F)cccc3SC)c2)CC1 ZINC000481331725 896691542 /nfs/dbraw/zinc/69/15/42/896691542.db2.gz QVVJIFZLYLFCHG-UHFFFAOYSA-N 0 3 402.539 4.011 20 0 HIADHN COc1ccc([C@H](NC(=O)N[C@H](CN(C)C)c2ccc(F)cc2)C(F)(F)F)cc1 ZINC000481331102 896691652 /nfs/dbraw/zinc/69/16/52/896691652.db2.gz OJQYIXBZOBZFIC-MSOLQXFVSA-N 0 3 413.415 4.040 20 0 HIADHN COc1ccc([C@H](C)NCc2ccc(OCc3ccccn3)cc2)cc1NC(C)=O ZINC000481332316 896693123 /nfs/dbraw/zinc/69/31/23/896693123.db2.gz MXCULMQMIYLETJ-KRWDZBQOSA-N 0 3 405.498 4.478 20 0 HIADHN C[C@H](NC1CCN(Cc2ccccn2)CC1)c1ccccc1I ZINC000481335572 896698629 /nfs/dbraw/zinc/69/86/29/896698629.db2.gz YSSAOJSGNFUBRV-HNNXBMFYSA-N 0 3 421.326 4.001 20 0 HIADHN Cc1nc(NC(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)ccc1Br ZINC000481343276 896712447 /nfs/dbraw/zinc/71/24/47/896712447.db2.gz QHVXKOGXTOUGQY-ZBFHGGJFSA-N 0 3 403.324 4.110 20 0 HIADHN CC[C@@H]1[C@H](C)CCN1CC(=O)N(Cc1nnc(-c2ccccc2Cl)o1)C1CC1 ZINC000481374776 896767974 /nfs/dbraw/zinc/76/79/74/896767974.db2.gz OKMKPONLITVNRV-RDTXWAMCSA-N 0 3 402.926 4.001 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N[C@H](c1ccc(F)cc1)C(F)(F)F)c1ccco1 ZINC000481390154 896793012 /nfs/dbraw/zinc/79/30/12/896793012.db2.gz IRTYYUAREQGWBX-XGWLTEMNSA-N 0 3 401.404 4.451 20 0 HIADHN C[C@@H](NCc1cccc(OCCN2CCOCC2)c1)c1ccc(-c2ccncc2)cc1 ZINC000481401315 896808272 /nfs/dbraw/zinc/80/82/72/896808272.db2.gz INVLEMMYPMTPQH-OAQYLSRUSA-N 0 3 417.553 4.310 20 0 HIADHN Clc1ccc2c(c1)[C@H](NCc1cccc(OCCN3CCOCC3)c1)CCS2 ZINC000481407666 896813851 /nfs/dbraw/zinc/81/38/51/896813851.db2.gz SGEBWNZNQCYYNX-OAQYLSRUSA-N 0 3 418.990 4.378 20 0 HIADHN COc1cc(C(C)=O)ccc1OC[C@H](O)CN1CCC[C@H](c2ccc(F)cc2)CC1 ZINC000481496812 896872472 /nfs/dbraw/zinc/87/24/72/896872472.db2.gz PVYLOUWQZJAQSD-PGRDOPGGSA-N 0 3 415.505 4.046 20 0 HIADHN COc1ccc(OC)c([C@H](C)NC[C@H](O)COc2cccc(Cl)c2Cl)c1 ZINC000481539865 896898957 /nfs/dbraw/zinc/89/89/57/896898957.db2.gz ZBPDIJOPWLVYDW-STQMWFEESA-N 0 3 400.302 4.101 20 0 HIADHN C[C@@H](NCc1cccc(CN2CCO[C@H](C)C2)c1)c1cnn(Cc2ccccc2)c1 ZINC000481550041 896915027 /nfs/dbraw/zinc/91/50/27/896915027.db2.gz ULCJVTSOSUUJOI-NHCUHLMSSA-N 0 3 404.558 4.003 20 0 HIADHN C[C@@H](NC[C@H](O)COc1cccc(Cl)c1Cl)c1cccc(N2CCCC2=O)c1 ZINC000481551312 896918574 /nfs/dbraw/zinc/91/85/74/896918574.db2.gz GHCVGFAPLAOLNN-PBHICJAKSA-N 0 3 423.340 4.211 20 0 HIADHN C[C@H](NCc1ccc(Oc2cccnc2)c(F)c1)c1ccc(NS(C)(=O)=O)cc1 ZINC000481559302 896932565 /nfs/dbraw/zinc/93/25/65/896932565.db2.gz SSMZCHUCTZTHQY-HNNXBMFYSA-N 0 3 415.490 4.235 20 0 HIADHN Cc1nn(C)c2sc(C(=O)Nc3cc(C)cc(N4CCN(C(C)C)CC4)c3)cc12 ZINC000481631177 897015967 /nfs/dbraw/zinc/01/59/67/897015967.db2.gz SSQUCUWBOXEAFH-UHFFFAOYSA-N 0 3 411.575 4.034 20 0 HIADHN Cc1cc(NC(=O)c2cnc(-c3ccncc3)s2)cc(N2CCN(C(C)C)CC2)c1 ZINC000481635726 897021534 /nfs/dbraw/zinc/02/15/34/897021534.db2.gz JGQZWOQUYOQZKC-UHFFFAOYSA-N 0 3 421.570 4.296 20 0 HIADHN CC[C@@H](N[C@H](c1ccc(OC)cc1)C1CC1)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000481640497 897024994 /nfs/dbraw/zinc/02/49/94/897024994.db2.gz KOWQNRJDJMZSLU-CTNGQTDRSA-N 0 3 422.978 4.449 20 0 HIADHN Cc1oc2ccc(NC(=O)N[C@H]3CCN(Cc4ccccc4)C[C@@H]3CO)cc2c1C ZINC000481641957 897026706 /nfs/dbraw/zinc/02/67/06/897026706.db2.gz NQIFJCXFKITHDT-KNQAVFIVSA-N 0 3 407.514 4.054 20 0 HIADHN Cc1cc(NC(=O)c2ccc(Cn3cccn3)cc2)cc(N2CCN(C(C)C)CC2)c1 ZINC000481652761 897037640 /nfs/dbraw/zinc/03/76/40/897037640.db2.gz GKZSCSUISIZMGW-UHFFFAOYSA-N 0 3 417.557 4.023 20 0 HIADHN CC(C)c1nc(C(=O)N2CCCN(C(C)C)CC2)nn1-c1c(Cl)cccc1Cl ZINC000505460469 914132397 /nfs/dbraw/zinc/13/23/97/914132397.db2.gz COIHSADTEGEZEB-UHFFFAOYSA-N 0 3 424.376 4.254 20 0 HIADHN CC1(C)CC[C@H](NC[C@H]2CCCCS2(=O)=O)c2cc(Br)ccc21 ZINC000481991039 897385815 /nfs/dbraw/zinc/38/58/15/897385815.db2.gz GYGMOBGLXZEFGT-PBHICJAKSA-N 0 3 400.382 4.119 20 0 HIADHN Cc1cc(NC(=O)c2cnn(C(C)C)c2C2CC2)cc(N2CCN(C(C)C)CC2)c1 ZINC000482014334 897414617 /nfs/dbraw/zinc/41/46/17/897414617.db2.gz JRNXFPLIZDSHAD-UHFFFAOYSA-N 0 3 409.578 4.433 20 0 HIADHN CC(=O)N1CCN(c2ccccc2CN[C@@H](C)c2ccc(OCC(C)C)cc2)CC1 ZINC000482015688 897416605 /nfs/dbraw/zinc/41/66/05/897416605.db2.gz JPOBECPYZDMSKI-FQEVSTJZSA-N 0 3 409.574 4.241 20 0 HIADHN CC(=O)N1CCN(c2ccccc2CN[C@H](C)c2cccc(-c3ccncc3)c2)CC1 ZINC000482032200 897443147 /nfs/dbraw/zinc/44/31/47/897443147.db2.gz KQCRZTXREGRQRW-HXUWFJFHSA-N 0 3 414.553 4.268 20 0 HIADHN CCN(CC)C(=O)Nc1ccc([C@@H](C)N[C@@H]2CC(=O)N(c3cccc(OC)c3)C2)cc1 ZINC000482032006 897443576 /nfs/dbraw/zinc/44/35/76/897443576.db2.gz ZMPMELJYWSDHFN-YLJYHZDGSA-N 0 3 424.545 4.025 20 0 HIADHN CC1(C)CN(C(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)CC[C@@H]1C(F)(F)F ZINC000482034632 897449392 /nfs/dbraw/zinc/44/93/92/897449392.db2.gz QZDRIMGZYBZUMZ-WMZOPIPTSA-N 0 3 400.460 4.475 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)Nc1ccc(Cl)cc1-n1cccn1)c1ccco1 ZINC000482044864 897465291 /nfs/dbraw/zinc/46/52/91/897465291.db2.gz GDCPWMAKXZSTBQ-RHSMWYFYSA-N 0 3 401.898 4.370 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1ccc(Cl)cc1-n1cccn1)c1ccco1 ZINC000482044870 897465361 /nfs/dbraw/zinc/46/53/61/897465361.db2.gz GDCPWMAKXZSTBQ-YOEHRIQHSA-N 0 3 401.898 4.370 20 0 HIADHN Cc1cc(NC(=O)c2cccnc2C(F)(F)F)cc(N2CCN(C(C)C)CC2)c1 ZINC000482048720 897472801 /nfs/dbraw/zinc/47/28/01/897472801.db2.gz YEOPYYOVSKEBIM-UHFFFAOYSA-N 0 3 406.452 4.192 20 0 HIADHN COC(=O)c1ccccc1-c1ccc(CN[C@@H]2CCN(c3ncccc3Cl)C2)o1 ZINC000482057063 897484900 /nfs/dbraw/zinc/48/49/00/897484900.db2.gz SRVJVPYTNZVQQS-OAHLLOKOSA-N 0 3 411.889 4.150 20 0 HIADHN Cc1nn(Cc2ccc(Cl)cc2)c(C)c1C(=O)NCCN(C)Cc1ccccc1 ZINC000482071069 897507489 /nfs/dbraw/zinc/50/74/89/897507489.db2.gz YLLKRTICEZCPKM-UHFFFAOYSA-N 0 3 410.949 4.063 20 0 HIADHN O=C(Nc1cc(Cl)ccc1[O-])C1CC[NH+](CCCc2ccc3c(c2)CCO3)CC1 ZINC000482073245 897509060 /nfs/dbraw/zinc/50/90/60/897509060.db2.gz JZBXITRIUVKZFW-UHFFFAOYSA-N 0 3 414.933 4.264 20 0 HIADHN C[C@@H](NCc1cccc(COC(C)(C)C)c1)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000482087626 897529749 /nfs/dbraw/zinc/52/97/49/897529749.db2.gz FRSCHTAHGZTSRO-QGZVFWFLSA-N 0 3 404.576 4.103 20 0 HIADHN COc1ccccc1N1CC[C@H](CN[C@@H](C)c2nnn(-c3ccc(C)cc3)c2C)C1 ZINC000482114552 897566149 /nfs/dbraw/zinc/56/61/49/897566149.db2.gz NZSVNISKZHUGLJ-AZUAARDMSA-N 0 3 405.546 4.070 20 0 HIADHN CC(C)NC(=O)Nc1ccc([C@H](C)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)cc1 ZINC000482118431 897571547 /nfs/dbraw/zinc/57/15/47/897571547.db2.gz DLKSYTWHJPJZBM-WMZHIEFXSA-N 0 3 422.573 4.101 20 0 HIADHN CCO[C@@H]1C[C@H](N[C@H](C)C(=O)Nc2c(C)nn(-c3ccccc3)c2C)C1(CC)CC ZINC000482142249 897602405 /nfs/dbraw/zinc/60/24/05/897602405.db2.gz WFFBNFDQLFRDNQ-JRGCBEDISA-N 0 3 412.578 4.390 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)CCCOc2ccc3c(c2)CCCC3)CC1 ZINC000482146781 897608814 /nfs/dbraw/zinc/60/88/14/897608814.db2.gz BLZDRTCZMBFPLR-UHFFFAOYSA-N 0 3 410.558 4.440 20 0 HIADHN CCO[C@H]1C[C@H](NCC(=O)Nc2c(C)nn(-c3ccc(C)cc3)c2C)C1(CC)CC ZINC000482148407 897610365 /nfs/dbraw/zinc/61/03/65/897610365.db2.gz LAHMHHZJERRENS-SFTDATJTSA-N 0 3 412.578 4.309 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)CSc1nccc2ccccc21 ZINC000482176219 897643452 /nfs/dbraw/zinc/64/34/52/897643452.db2.gz KUJSPWVIFTYSHI-OAQYLSRUSA-N 0 3 420.582 4.235 20 0 HIADHN CN(C)[C@H](CNC(=O)CSc1nccn1-c1cccc(Cl)c1)c1ccccc1 ZINC000482192881 897665760 /nfs/dbraw/zinc/66/57/60/897665760.db2.gz LWQWAJUPYKTDCF-LJQANCHMSA-N 0 3 414.962 4.037 20 0 HIADHN Cc1nc2n(n1)C[C@H](N[C@@H](C)c1cnn(-c3ccc(Cl)cc3Cl)c1C)CC2 ZINC000482244654 897726337 /nfs/dbraw/zinc/72/63/37/897726337.db2.gz QDEWLQXWFFOPQU-XHDPSFHLSA-N 0 3 405.333 4.053 20 0 HIADHN CCC[C@@H](N[C@@H](C)c1ccc(-n2cccn2)cc1)C(=O)N1CCc2sccc2C1 ZINC000482251613 897732901 /nfs/dbraw/zinc/73/29/01/897732901.db2.gz ZCAMSGZNUWVWHA-LAUBAEHRSA-N 0 3 408.571 4.338 20 0 HIADHN CCC[C@H](N[C@H](C)c1ccc(-n2cccn2)cc1)C(=O)N1CCc2sccc2C1 ZINC000482251614 897732927 /nfs/dbraw/zinc/73/29/27/897732927.db2.gz ZCAMSGZNUWVWHA-UTKZUKDTSA-N 0 3 408.571 4.338 20 0 HIADHN COc1ccc([C@H](NC(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)C(F)(F)F)cc1 ZINC000482329603 897832622 /nfs/dbraw/zinc/83/26/22/897832622.db2.gz UGBARVDDXHNGPM-ICSRJNTNSA-N 0 3 421.463 4.215 20 0 HIADHN Cc1cc(C)n(-c2ccc(C(=O)N[C@@H](CN3CCCC3)c3ccccc3)cc2F)n1 ZINC000482358829 897874911 /nfs/dbraw/zinc/87/49/11/897874911.db2.gz DXPUJPZJNPZBAP-QFIPXVFZSA-N 0 3 406.505 4.195 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)c2cccc(-c3nc(C)cs3)c2)c1 ZINC000482369422 897890035 /nfs/dbraw/zinc/89/00/35/897890035.db2.gz RRQWPTJGPZNVSX-UHFFFAOYSA-N 0 3 409.555 4.331 20 0 HIADHN O=C(N[C@H](c1cccc(F)c1F)C(F)(F)F)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000482377880 897906841 /nfs/dbraw/zinc/90/68/41/897906841.db2.gz PTKMIZJNERQEEQ-RDTXWAMCSA-N 0 3 413.390 4.142 20 0 HIADHN CN(C)[C@@H](CNC(=O)N[C@@H](c1c(F)cccc1F)C(F)(F)F)c1ccccc1 ZINC000482404293 897945326 /nfs/dbraw/zinc/94/53/26/897945326.db2.gz MLBLCCDSKXXSNG-RDJZCZTQSA-N 0 3 401.379 4.170 20 0 HIADHN CN(C)[C@H](CNC(=O)N[C@H](c1cccc(F)c1F)C(F)(F)F)c1ccccc1 ZINC000482439819 897999733 /nfs/dbraw/zinc/99/97/33/897999733.db2.gz MVDMWEDNGAGSKI-NVXWUHKLSA-N 0 3 401.379 4.170 20 0 HIADHN COc1ccc(CN[C@@H](C)c2ccc(NS(C)(=O)=O)cc2)cc1OC1CCCC1 ZINC000482456236 898024028 /nfs/dbraw/zinc/02/40/28/898024028.db2.gz ZDKWTNMPBMNFMZ-INIZCTEOSA-N 0 3 418.559 4.239 20 0 HIADHN C[C@H](NC(=O)Nc1cccc2c1CN(CC(F)(F)F)C2)[C@H](c1ccccc1)N(C)C ZINC000482475211 898050759 /nfs/dbraw/zinc/05/07/59/898050759.db2.gz JIPMWBZQAQNUJG-MGPUTAFESA-N 0 3 420.479 4.377 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)Nc1cc(Cl)ccc1OC[C@@H]1CCOC1 ZINC000482486882 898067086 /nfs/dbraw/zinc/06/70/86/898067086.db2.gz ZCHJVJSKHQKCOG-GOSISDBHSA-N 0 3 423.985 4.485 20 0 HIADHN CC(=O)N[C@@H](C)C1CCN(Cc2cccc(NC(=O)c3ccc(Cl)cc3)c2)CC1 ZINC000482524960 898113477 /nfs/dbraw/zinc/11/34/77/898113477.db2.gz QIYCBVRZAYCCIX-INIZCTEOSA-N 0 3 413.949 4.329 20 0 HIADHN COc1ccc(Cc2nc(C)c([C@H](C)NCc3cccc(CO)c3)s2)cc1OC ZINC000482542256 898130037 /nfs/dbraw/zinc/13/00/37/898130037.db2.gz XPKLKOIRMASSLS-HNNXBMFYSA-N 0 3 412.555 4.403 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)[C@@H]1CCN(c2cc(Cl)ccc2Cl)C1=O ZINC000482581824 898179106 /nfs/dbraw/zinc/17/91/06/898179106.db2.gz DLTULSUCXZKUQO-INIZCTEOSA-N 0 3 420.340 4.355 20 0 HIADHN COc1cc(C(=O)Nc2cc(CN(C)C)ccc2C)cc(OC)c1Br ZINC000482620031 898221985 /nfs/dbraw/zinc/22/19/85/898221985.db2.gz YNGBIMRIPSLELM-UHFFFAOYSA-N 0 3 407.308 4.089 20 0 HIADHN CC[C@@H](C)[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)Nc1cc(CN(C)C)ccc1C ZINC000482627290 898229267 /nfs/dbraw/zinc/22/92/67/898229267.db2.gz GFFVAMAJAWVQCN-VFNWGFHPSA-N 0 3 415.965 4.493 20 0 HIADHN CN1C(=O)C[C@@H](NCc2ccc(OCc3ccncc3)cc2)[C@@H]1c1ccc(F)c(F)c1 ZINC000482727554 898328678 /nfs/dbraw/zinc/32/86/78/898328678.db2.gz XJURCXNLTOXCLF-VWNXMTODSA-N 0 3 423.463 4.000 20 0 HIADHN Clc1ccc(CNC2(c3ccc(Br)cc3)CC2)c(-n2cncn2)c1 ZINC000482787205 898396100 /nfs/dbraw/zinc/39/61/00/898396100.db2.gz LXWJODYOGQEFKN-UHFFFAOYSA-N 0 3 403.711 4.462 20 0 HIADHN Cn1c(CNC[C@@H](c2cccc(Cl)c2)N2CCOCC2)nc2ccc(Cl)cc21 ZINC000482809986 898419834 /nfs/dbraw/zinc/41/98/34/898419834.db2.gz DHIYGOGZTLZQGC-FQEVSTJZSA-N 0 3 419.356 4.043 20 0 HIADHN O=C(Nc1ccc(Br)cn1)C1CCN([C@H]2CCc3ccc(F)cc32)CC1 ZINC000482829998 898438388 /nfs/dbraw/zinc/43/83/88/898438388.db2.gz XTVHQDKYUZJNKQ-SFHVURJKSA-N 0 3 418.310 4.321 20 0 HIADHN Cc1nc(-c2ccccc2)ncc1C(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000482858805 898470863 /nfs/dbraw/zinc/47/08/63/898470863.db2.gz LPKWLGPQOWMJIA-UHFFFAOYSA-N 0 3 400.526 4.189 20 0 HIADHN C[C@@H](NCc1cccc(COC2CCOCC2)c1)c1cccc(N2CCCC2=O)c1 ZINC000482887771 898504126 /nfs/dbraw/zinc/50/41/26/898504126.db2.gz JDUDFKVDECXKMG-LJQANCHMSA-N 0 3 408.542 4.360 20 0 HIADHN NC(=O)c1ccc(NC(=O)CCN2CCCC[C@@H]2c2ccc(F)cc2)cc1Cl ZINC000482907777 898525876 /nfs/dbraw/zinc/52/58/76/898525876.db2.gz YWELXEXNVJDOOC-LJQANCHMSA-N 0 3 403.885 4.134 20 0 HIADHN C[C@H](NCCOc1cc(F)cc(Br)c1)c1ccc(Br)cn1 ZINC000482959546 898589458 /nfs/dbraw/zinc/58/94/58/898589458.db2.gz JVPJZZNSVHUPDI-JTQLQIEISA-N 0 3 418.104 4.475 20 0 HIADHN C[C@H](NC[C@@H](O)CO[C@@H](C)c1ccc(Cl)cc1)c1ccc(Br)cn1 ZINC000482961253 898591798 /nfs/dbraw/zinc/59/17/98/898591798.db2.gz OEPBHHTWKRBAEC-GDZNZVCISA-N 0 3 413.743 4.287 20 0 HIADHN COc1cccc([C@@H](C)NCc2ccccc2CN2C(=O)NC3(CCCCC3)C2=O)c1 ZINC000482964054 898594071 /nfs/dbraw/zinc/59/40/71/898594071.db2.gz RKHLQSDMWKWXLS-GOSISDBHSA-N 0 3 421.541 4.301 20 0 HIADHN C[C@H](NC[C@@H](O)Cc1ccccc1C(F)(F)F)c1ccc(Br)cn1 ZINC000482964580 898595578 /nfs/dbraw/zinc/59/55/78/898595578.db2.gz RZYAUSJCRCGNIW-FZMZJTMJSA-N 0 3 403.242 4.117 20 0 HIADHN C[C@H](NC[C@H](O)Cc1ccccc1C(F)(F)F)c1ccc(Br)cn1 ZINC000482964582 898595653 /nfs/dbraw/zinc/59/56/53/898595653.db2.gz RZYAUSJCRCGNIW-SMDDNHRTSA-N 0 3 403.242 4.117 20 0 HIADHN CCOc1ccc([C@@H](NC(=O)N2CCN(C3CCCC3)CC2)c2ccccc2)cc1 ZINC000505565201 914269210 /nfs/dbraw/zinc/26/92/10/914269210.db2.gz ICVHINMXFOBKBW-DEOSSOPVSA-N 0 3 407.558 4.445 20 0 HIADHN CO[C@@]1(C)CCCN(CC(=O)NC[C@H](c2c[nH]c3ccccc32)c2ccccc2)CC1 ZINC000483038491 898705518 /nfs/dbraw/zinc/70/55/18/898705518.db2.gz UQSWUXNDKTZCFE-NVQXNPDNSA-N 0 3 419.569 4.307 20 0 HIADHN Cc1n[nH]c(C)c1NC(=O)CN[C@@](C)(CC(C)C)c1cccc(Br)c1 ZINC000483055312 898730473 /nfs/dbraw/zinc/73/04/73/898730473.db2.gz SCWBTTXFMPTHDY-IBGZPJMESA-N 0 3 407.356 4.279 20 0 HIADHN COc1c(Br)c(C)sc1C(=O)N[C@H](C)[C@@H](c1ccccc1)N(C)C ZINC000505573822 914280748 /nfs/dbraw/zinc/28/07/48/914280748.db2.gz FDIORYQSMDAXDX-ABAIWWIYSA-N 0 3 411.365 4.249 20 0 HIADHN C[C@H](NC(=O)c1ccc(-c2noc(C(F)(F)F)n2)cc1)[C@H](c1ccccc1)N(C)C ZINC000505575035 914281140 /nfs/dbraw/zinc/28/11/40/914281140.db2.gz NVOSOVYXJKSFBT-SUMWQHHRSA-N 0 3 418.419 4.177 20 0 HIADHN CCCC[C@](C)(NCC(=O)Nc1c(C)nn(C)c1C)c1cccc(Br)c1 ZINC000483092106 898780776 /nfs/dbraw/zinc/78/07/76/898780776.db2.gz SSBQFINHPMNGKG-FQEVSTJZSA-N 0 3 421.383 4.433 20 0 HIADHN CCCC[C@@](C)(NCC(=O)Nc1cc(C)nn1C)c1cccc(Br)c1 ZINC000483094279 898783702 /nfs/dbraw/zinc/78/37/02/898783702.db2.gz XVFDRXVYWOQQII-LJQANCHMSA-N 0 3 407.356 4.125 20 0 HIADHN C[C@H](N[C@@H](Cc1ccccc1)[C@H](O)C(F)F)c1ccc(F)c(Br)c1 ZINC000483133541 898815081 /nfs/dbraw/zinc/81/50/81/898815081.db2.gz ZYWOKVJXMOJCHL-GOPGUHFVSA-N 0 3 402.254 4.476 20 0 HIADHN COc1cc([C@H](C)N[C@@H](Cc2ccccc2)[C@H](O)C(F)F)ccc1OC(F)F ZINC000483137710 898817632 /nfs/dbraw/zinc/81/76/32/898817632.db2.gz VGTOXMRRRPEXCF-QITLCBANSA-N 0 3 401.400 4.185 20 0 HIADHN C[C@@H](NCc1ccc(F)c(CN(C)C)c1)c1ccccc1I ZINC000483145612 898823884 /nfs/dbraw/zinc/82/38/84/898823884.db2.gz QFOCPCHFWJOTTD-CYBMUJFWSA-N 0 3 412.290 4.343 20 0 HIADHN C[C@H](NCc1ccc(F)c(CN(C)C)c1)c1ccc(S(=O)(=O)C2CCCC2)cc1 ZINC000483151973 898826827 /nfs/dbraw/zinc/82/68/27/898826827.db2.gz QZHPKYZOTOJIQW-KRWDZBQOSA-N 0 3 418.578 4.454 20 0 HIADHN C[C@@H](NCc1ccc(F)c(CN(C)C)c1)c1ccc(S(=O)(=O)C2CCCC2)cc1 ZINC000483151976 898827267 /nfs/dbraw/zinc/82/72/67/898827267.db2.gz QZHPKYZOTOJIQW-QGZVFWFLSA-N 0 3 418.578 4.454 20 0 HIADHN C[C@H]1CCN(C(=O)c2ccc(-c3n[nH]c(C4CC4)n3)cc2)CCN1Cc1ccccc1 ZINC000483154023 898827756 /nfs/dbraw/zinc/82/77/56/898827756.db2.gz KCUJORIQGXVJCL-SFHVURJKSA-N 0 3 415.541 4.086 20 0 HIADHN CC1(C)CN(CCC(=O)Nc2ccc(Oc3ccccc3)cc2)C[C@@]2(CCOC2)O1 ZINC000483182702 898845882 /nfs/dbraw/zinc/84/58/82/898845882.db2.gz ITFCCQBEMABZRK-XMMPIXPASA-N 0 3 410.514 4.077 20 0 HIADHN Cc1c([C@@H](C)NCCNc2nccc(C(F)(F)F)n2)cnn1-c1cccc(Cl)c1 ZINC000483227993 898872132 /nfs/dbraw/zinc/87/21/32/898872132.db2.gz CXPKDBCOCRNRPO-GFCCVEGCSA-N 0 3 424.858 4.406 20 0 HIADHN C[C@@H](NC(=O)c1cn(C)nc1-c1ccc(Cl)s1)[C@@H](c1ccccc1)N(C)C ZINC000505585646 914293349 /nfs/dbraw/zinc/29/33/49/914293349.db2.gz GBGMGRPQMZZVEZ-YJYMSZOUSA-N 0 3 402.951 4.223 20 0 HIADHN CC(C)N(C)c1ccc(CN2CCC[C@H](c3nc(-c4cccc(F)c4)no3)C2)cn1 ZINC000483295518 898929191 /nfs/dbraw/zinc/92/91/91/898929191.db2.gz YUYNREFJAWEIGP-IBGZPJMESA-N 0 3 409.509 4.495 20 0 HIADHN O=C(Nc1cccc(OCc2cscn2)c1)N1CCN(C2CCCCC2)CC1 ZINC000483322328 898949791 /nfs/dbraw/zinc/94/97/91/898949791.db2.gz KNRQOPFFGHLARR-UHFFFAOYSA-N 0 3 400.548 4.204 20 0 HIADHN CC(C)OCCOCc1cccc(NC(=O)N2CCN(C3CCCCC3)CC2)c1 ZINC000483326677 898955025 /nfs/dbraw/zinc/95/50/25/898955025.db2.gz QKWVGNMUSXRDRY-UHFFFAOYSA-N 0 3 403.567 4.110 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)Nc2c3c(ccc2Cl)OCC3)N(C)C)cc1 ZINC000483360219 898996529 /nfs/dbraw/zinc/99/65/29/898996529.db2.gz ZBRJWQZFIUALEG-IBGZPJMESA-N 0 3 417.937 4.487 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)Nc2c3c(ccc2Cl)OCC3)N(C)C)cc1 ZINC000483360220 898997358 /nfs/dbraw/zinc/99/73/58/898997358.db2.gz ZBRJWQZFIUALEG-LJQANCHMSA-N 0 3 417.937 4.487 20 0 HIADHN CN(C(=O)N[C@H](Cc1cccc(Br)c1)CC1CC1)[C@@H]1CCN(C2CC2)C1 ZINC000483373361 899009642 /nfs/dbraw/zinc/00/96/42/899009642.db2.gz VVMQZCLKUPNHBW-AZUAARDMSA-N 0 3 420.395 4.038 20 0 HIADHN CS[C@@H]1CN(C(=O)c2sc(-c3ccc(Cl)cc3)nc2C)C[C@H]1N1CCCC1 ZINC000483390975 899025742 /nfs/dbraw/zinc/02/57/42/899025742.db2.gz FCYLDJVJJPGOGR-IAGOWNOFSA-N 0 3 422.019 4.424 20 0 HIADHN Cc1ccc(NC(=O)CCCN2CCN(c3ccccc3)CC2)cc1-c1ncco1 ZINC000483397483 899030603 /nfs/dbraw/zinc/03/06/03/899030603.db2.gz VKBCDHNJIOROAJ-UHFFFAOYSA-N 0 3 404.514 4.191 20 0 HIADHN CS[C@@H]1CN(C(=O)c2sc(C3CC3)nc2-c2ccccc2)C[C@@H]1N1CCCC1 ZINC000483399544 899032918 /nfs/dbraw/zinc/03/29/18/899032918.db2.gz CHYZMWGJVHYLBT-ZWKOTPCHSA-N 0 3 413.612 4.339 20 0 HIADHN CCOc1cc(CN2CCSCC[C@@H]2C)ccc1OCC(=O)Nc1ccccc1 ZINC000483423995 899054145 /nfs/dbraw/zinc/05/41/45/899054145.db2.gz BXCRHAYBQLIHMG-SFHVURJKSA-N 0 3 414.571 4.430 20 0 HIADHN Cc1cccc(-c2nn(-c3ccc(F)cc3)cc2CN2CC[C@H](N3CCCC3=O)C2)c1 ZINC000483431740 899063902 /nfs/dbraw/zinc/06/39/02/899063902.db2.gz DHVNWEREKLEXQP-QHCPKHFHSA-N 0 3 418.516 4.184 20 0 HIADHN C[C@H](NC(=O)CCCc1nc(-c2ccc(F)cc2)no1)[C@@H](c1ccccc1)N(C)C ZINC000505606411 914310745 /nfs/dbraw/zinc/31/07/45/914310745.db2.gz HIHRXNVGMOORLH-AOMKIAJQSA-N 0 3 410.493 4.006 20 0 HIADHN O=C1CCCN1[C@H]1CCN(Cc2ccc(-c3ccccc3Br)s2)C1 ZINC000483436878 899070559 /nfs/dbraw/zinc/07/05/59/899070559.db2.gz UJJMNLLQQCFHHK-AWEZNQCLSA-N 0 3 405.361 4.374 20 0 HIADHN CCc1ccc([C@H](N[C@H](COC)CC(C)C)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000483453346 899090353 /nfs/dbraw/zinc/09/03/53/899090353.db2.gz GYRBLBCWWKWFBG-GMAHTHKFSA-N 0 3 403.588 4.393 20 0 HIADHN C[C@@H](NC(=O)C1CCC(NC(=O)CC2CCCC2)CC1)[C@@H](c1ccccc1)N(C)C ZINC000505610003 914313648 /nfs/dbraw/zinc/31/36/48/914313648.db2.gz LSRDSGCLUBDOBL-GGOOSFECSA-N 0 3 413.606 4.049 20 0 HIADHN Cc1nc(COc2ccccc2C(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)cs1 ZINC000505614198 914317378 /nfs/dbraw/zinc/31/73/78/914317378.db2.gz TZDWGAFWLAYROO-KSFYIVLOSA-N 0 3 409.555 4.452 20 0 HIADHN C[C@H](NC(=O)Nc1cc(-c2cc(F)cc(F)c2)nn1C)[C@@H](c1ccccc1)N(C)C ZINC000483576943 899230869 /nfs/dbraw/zinc/23/08/69/899230869.db2.gz RYOPHTKVMAUGQM-QKKBWIMNSA-N 0 3 413.472 4.178 20 0 HIADHN CN(C(=O)Nc1ccc(OCC(F)F)cc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000483590563 899241828 /nfs/dbraw/zinc/24/18/28/899241828.db2.gz JXACDLRUEMLULT-IBGZPJMESA-N 0 3 403.473 4.459 20 0 HIADHN Cc1ccc(NC(=O)N[C@@H](CN(C)C)c2ccc(F)cc2)cc1C(=O)N(C)C(C)C ZINC000483598856 899250011 /nfs/dbraw/zinc/25/00/11/899250011.db2.gz CTMMUSOJIZCDPT-NRFANRHFSA-N 0 3 414.525 4.039 20 0 HIADHN Cc1ccc(NC(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)cc1C(=O)N1CCCCC1 ZINC000483633691 899287603 /nfs/dbraw/zinc/28/76/03/899287603.db2.gz OXCPJRKDNKYAAH-CVDCTZTESA-N 0 3 422.573 4.434 20 0 HIADHN Cc1ccc(OCc2cccc(C(=O)N[C@H](C)[C@@H](c3ccccc3)N(C)C)c2)cn1 ZINC000505634795 914334609 /nfs/dbraw/zinc/33/46/09/914334609.db2.gz MNGHGLMLWVDQED-DVECYGJZSA-N 0 3 403.526 4.390 20 0 HIADHN CN(C)CCN(C[C@@H]1CCCO1)C(=O)Nc1c(F)cc(F)cc1-c1ccccc1 ZINC000483654729 899312448 /nfs/dbraw/zinc/31/24/48/899312448.db2.gz OPYJEUZHRLPUMK-SFHVURJKSA-N 0 3 403.473 4.206 20 0 HIADHN CCOc1ccccc1[C@@H](CC(C)C)N[C@H](C)c1ccc(S(=O)(=O)NC)cc1 ZINC000483706627 899361385 /nfs/dbraw/zinc/36/13/85/899361385.db2.gz CUPGXASGZWMDDV-DYESRHJHSA-N 0 3 404.576 4.431 20 0 HIADHN CN1CCN(c2ccc(C(F)(F)F)cc2CN[C@@H]2CCCOc3ccccc32)CC1 ZINC000483724976 899384411 /nfs/dbraw/zinc/38/44/11/899384411.db2.gz CZDSQXQRTYNTSE-HXUWFJFHSA-N 0 3 419.491 4.461 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2ccc(Br)c(F)c2)c1 ZINC000483785139 899453035 /nfs/dbraw/zinc/45/30/35/899453035.db2.gz IRNZKMAWWJJIQW-UHFFFAOYSA-N 0 3 424.314 4.193 20 0 HIADHN COc1cccc2c1[C@H](C(=O)Nc1ccnn1[C@@H]1CCN(Cc3ccccc3)C1)CC2 ZINC000483794831 899466014 /nfs/dbraw/zinc/46/60/14/899466014.db2.gz CITDNFBVCSDICG-NHCUHLMSSA-N 0 3 416.525 4.007 20 0 HIADHN C[C@H](SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)N(CCN(C)C)C1CC1 ZINC000505656947 914355444 /nfs/dbraw/zinc/35/54/44/914355444.db2.gz GNTMEHKRFMKLLA-AWEZNQCLSA-N 0 3 407.967 4.169 20 0 HIADHN Cc1cccc(-c2ccc(CNC(=O)C(=O)Nc3cc(CN(C)C)ccc3C)cc2)c1 ZINC000483966378 899613036 /nfs/dbraw/zinc/61/30/36/899613036.db2.gz UOAUASZAPZODHI-UHFFFAOYSA-N 0 3 415.537 4.287 20 0 HIADHN Cc1ccc([C@@H](NC(=O)C(=O)Nc2cc(CN(C)C)ccc2C)c2ccccc2)cc1 ZINC000483994340 899633972 /nfs/dbraw/zinc/63/39/72/899633972.db2.gz PTHRMLADCOOYMN-DEOSSOPVSA-N 0 3 415.537 4.209 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)NC[C@@H]1CCCC[C@H]1C(F)(F)F ZINC000484024541 899657820 /nfs/dbraw/zinc/65/78/20/899657820.db2.gz BLDKLUXNFHKFAA-WMLDXEAASA-N 0 3 421.454 4.407 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)NC[C@H]2CCCC[C@H]2C(F)(F)F)CC1 ZINC000484049098 899681460 /nfs/dbraw/zinc/68/14/60/899681460.db2.gz SDMVTJAVTUTHEP-CRAIPNDOSA-N 0 3 401.473 4.254 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2cc(Br)ccc2F)c1 ZINC000484112790 899736925 /nfs/dbraw/zinc/73/69/25/899736925.db2.gz JSYROFFWIGJCKT-UHFFFAOYSA-N 0 3 424.314 4.193 20 0 HIADHN Cc1ccc(N2CCC(N[C@H](C)c3ccccc3I)CC2)nc1 ZINC000484125833 899747357 /nfs/dbraw/zinc/74/73/57/899747357.db2.gz CHGFIUAXEYHWTK-OAHLLOKOSA-N 0 3 421.326 4.314 20 0 HIADHN C[C@@H](NCCNc1ncc(Cl)cc1Cl)c1ccc(-n2cncn2)cc1Cl ZINC000484129049 899749958 /nfs/dbraw/zinc/74/99/58/899749958.db2.gz KLYJHXBHEUSZAM-LLVKDONJSA-N 0 3 411.724 4.385 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2cccc(Oc3ccncc3)c2)c1 ZINC000484151685 899772593 /nfs/dbraw/zinc/77/25/93/899772593.db2.gz IQOULDJCMJZUOA-UHFFFAOYSA-N 0 3 420.513 4.478 20 0 HIADHN Cc1cc(NC(=O)c2c[nH]c(C(F)(F)F)c2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000484153678 899773958 /nfs/dbraw/zinc/77/39/58/899773958.db2.gz CCUHHUDYMLNQJG-QGZVFWFLSA-N 0 3 417.435 4.238 20 0 HIADHN CC(=O)c1cc(C(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)cs1 ZINC000484164676 899783977 /nfs/dbraw/zinc/78/39/77/899783977.db2.gz WLMCOMILWHVSMZ-IBGZPJMESA-N 0 3 408.527 4.155 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2cc(OC)ccc2OC(C)C)c1 ZINC000484168316 899788309 /nfs/dbraw/zinc/78/83/09/899788309.db2.gz ZCEQZEYCEKRFOU-UHFFFAOYSA-N 0 3 415.534 4.087 20 0 HIADHN Cc1c([C@H](C)NCC2(CCO)CCCCC2)nnn1-c1cccc(Br)c1 ZINC000484278463 899847275 /nfs/dbraw/zinc/84/72/75/899847275.db2.gz OUZCMCJXGKTKBL-HNNXBMFYSA-N 0 3 421.383 4.322 20 0 HIADHN CSc1cccc(N(C(=O)Cn2c(C)nc3ccccc32)C2CCN(C)CC2)c1 ZINC000484279866 899848614 /nfs/dbraw/zinc/84/86/14/899848614.db2.gz HCKXQUAMVWHXEJ-UHFFFAOYSA-N 0 3 408.571 4.194 20 0 HIADHN COc1cccc([C@H](CN2C(=O)[C@@H]3CC[C@@H](c4ccccc4)N3C2=O)N2CCCC2)c1 ZINC000484437643 899945566 /nfs/dbraw/zinc/94/55/66/899945566.db2.gz GZPRRCUEKAOENM-VABKMULXSA-N 0 3 419.525 4.000 20 0 HIADHN O[C@H](CN[C@H]1CCCc2nc(-c3ccc(Br)cc3)sc21)C(F)F ZINC000484469012 899962176 /nfs/dbraw/zinc/96/21/76/899962176.db2.gz CSWICZODKJGFKS-WCQYABFASA-N 0 3 403.292 4.166 20 0 HIADHN COC[C@@H](N[C@@H]1CCN(c2cc(OC)cc(OC)c2)C1)c1cccc(C(F)(F)F)c1 ZINC000484485105 899976714 /nfs/dbraw/zinc/97/67/14/899976714.db2.gz IVVJTZHEHPSOTR-DYESRHJHSA-N 0 3 424.463 4.279 20 0 HIADHN COc1cccc2c1CC[C@@H]2N[C@H](C)c1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000484495821 899987290 /nfs/dbraw/zinc/98/72/90/899987290.db2.gz GOUBUIGCPNGFDH-VGSWGCGISA-N 0 3 414.571 4.208 20 0 HIADHN C[C@@H](N[C@H]1CCN(c2c(F)cccc2F)C1)c1ccc(-n2cncn2)cc1Cl ZINC000484623031 900076048 /nfs/dbraw/zinc/07/60/48/900076048.db2.gz QQNWSQRGGCBIHF-KGLIPLIRSA-N 0 3 403.864 4.128 20 0 HIADHN Brc1ccccc1-n1nnnc1CN[C@H]1CCCC[C@H]1c1ccccc1 ZINC000484633623 900083370 /nfs/dbraw/zinc/08/33/70/900083370.db2.gz AHQQMYPXXSMWBR-WMZOPIPTSA-N 0 3 412.335 4.241 20 0 HIADHN COc1ccc2c(c1NC(=O)N(CCN(C)C)Cc1ccc(F)c(F)c1)CCC2 ZINC000484823827 900226686 /nfs/dbraw/zinc/22/66/86/900226686.db2.gz QDSZFFRLODTACJ-UHFFFAOYSA-N 0 3 403.473 4.058 20 0 HIADHN Cc1ccccc1C1(CNC(=O)N[C@@H]2CCN(Cc3ccccc3)[C@H]2C)CCOCC1 ZINC000484893727 900277036 /nfs/dbraw/zinc/27/70/36/900277036.db2.gz WOCBUQVRZBJIME-XUZZJYLKSA-N 0 3 421.585 4.005 20 0 HIADHN COc1ccc2cc(C(=O)NCC3(N4CCSCC4)CCCCC3)c(C)nc2c1 ZINC000484920981 900295680 /nfs/dbraw/zinc/29/56/80/900295680.db2.gz XVNKGGDLPQFCBA-UHFFFAOYSA-N 0 3 413.587 4.033 20 0 HIADHN CCOc1cc(CN(Cc2ccccc2)[C@@H](C)CC)nc2nc(C(F)(F)F)nn21 ZINC000485033199 900373395 /nfs/dbraw/zinc/37/33/95/900373395.db2.gz LRTMKDSTWVUTLI-AWEZNQCLSA-N 0 3 407.440 4.343 20 0 HIADHN CC(C)c1c(NC(=O)N2CC[C@@H]3CCN(C)C[C@@H]32)cnn1-c1ccc(Cl)cc1 ZINC000485199458 900492490 /nfs/dbraw/zinc/49/24/90/900492490.db2.gz ZDROOJLFJFZMTN-KXBFYZLASA-N 0 3 401.942 4.207 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCC[C@@]12CCOC2)c1ccc(C(F)(F)F)cc1 ZINC000485333079 900618804 /nfs/dbraw/zinc/61/88/04/900618804.db2.gz TTYZTJQOHVCFGC-QUCCMNQESA-N 0 3 413.484 4.053 20 0 HIADHN CC(C)CC(=O)Nc1cccc(CNC(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)c1 ZINC000485342127 900632410 /nfs/dbraw/zinc/63/24/10/900632410.db2.gz CZFOZNHGKDSQFA-WZONZLPQSA-N 0 3 410.562 4.162 20 0 HIADHN C[C@H](c1ccc([S@](C)=O)cc1)N(C)CCC(=O)Nc1ccccc1C(F)(F)F ZINC000485413502 900712330 /nfs/dbraw/zinc/71/23/30/900712330.db2.gz YQFMXTGDKZJFTO-SUMNFNSASA-N 0 3 412.477 4.464 20 0 HIADHN COCCSc1ccc([C@H](C)NC(=O)N2CCN(C3CCCCC3)CC2)cc1 ZINC000485571604 900840341 /nfs/dbraw/zinc/84/03/41/900840341.db2.gz DHWJVOAUOPSOSV-SFHVURJKSA-N 0 3 405.608 4.146 20 0 HIADHN CCN(CC)[C@H](CNC(=O)C1(CC)CCOCC1)c1ccc(C(F)(F)F)cc1 ZINC000485602193 900862113 /nfs/dbraw/zinc/86/21/13/900862113.db2.gz DIGJITIHKRWIFQ-GOSISDBHSA-N 0 3 400.485 4.411 20 0 HIADHN CC[C@@H](NCc1ccc(OCC(=O)OC)cc1)c1cc(F)cc(Br)c1 ZINC000485710811 900960420 /nfs/dbraw/zinc/96/04/20/900960420.db2.gz NNPHQMNAYLAPSY-GOSISDBHSA-N 0 3 410.283 4.381 20 0 HIADHN C[C@@H]1Cc2ccccc2N1C(=O)[C@H]1CCCC[C@@H]1C(=O)Nc1cccc(CN(C)C)c1 ZINC000485768174 901024592 /nfs/dbraw/zinc/02/45/92/901024592.db2.gz VEELIDJHOOCQOR-LEOXJPRUSA-N 0 3 419.569 4.471 20 0 HIADHN C[C@@H]([NH2+]C(C)(C)CNC(=O)NCc1ccc([O-])c(Br)c1)c1ccccc1 ZINC000485773853 901030754 /nfs/dbraw/zinc/03/07/54/901030754.db2.gz IFCIKQDGSPRVOF-CQSZACIVSA-N 0 3 420.351 4.083 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@H](C)N[C@@H](C)c2ccc3ncsc3c2)cc1F ZINC000485820784 901067791 /nfs/dbraw/zinc/06/77/91/901067791.db2.gz UUIQSFCJDHYPDC-KBPBESRZSA-N 0 3 401.507 4.142 20 0 HIADHN C[C@H](CNC(=O)c1ccc(NC(=O)Nc2ccccc2)s1)N1CCCC[C@H]1C ZINC000485914603 901140912 /nfs/dbraw/zinc/14/09/12/901140912.db2.gz CAGBRKMMVQLJCQ-HZPDHXFCSA-N 0 3 400.548 4.385 20 0 HIADHN CC[C@H](N[C@@H](C)c1ccc(S(N)(=O)=O)cc1)c1cc(F)cc(Br)c1 ZINC000486095474 901282407 /nfs/dbraw/zinc/28/24/07/901282407.db2.gz NHNJTRYJHFAYEB-GTNSWQLSSA-N 0 3 415.328 4.038 20 0 HIADHN C[C@@H]1CN(C(=O)c2cc(-c3ccccc3)ccc2Cl)CC[C@H]1N1CCN(C)CC1 ZINC000486096745 901284144 /nfs/dbraw/zinc/28/41/44/901284144.db2.gz OZIJAJZAJDTIGB-WZONZLPQSA-N 0 3 411.977 4.105 20 0 HIADHN Cc1ccc(C(=O)c2c(NC(=O)C3CCN(C4CC4)CC3)sc3c2CCOC3)cc1 ZINC000486121319 901308087 /nfs/dbraw/zinc/30/80/87/901308087.db2.gz AJJYIONNPWYXGA-UHFFFAOYSA-N 0 3 424.566 4.173 20 0 HIADHN C[C@@H]1CN(C(=O)c2ccc(-c3ccc(C(C)(C)C)cc3)o2)CC[C@@H]1N1CCN(C)CC1 ZINC000486154704 901342592 /nfs/dbraw/zinc/34/25/92/901342592.db2.gz SOKONRICHYUGDX-KNQAVFIVSA-N 0 3 423.601 4.342 20 0 HIADHN O=C(CN1CCN(C2CCCCC2)CC1)N1CCc2sccc2[C@@H]1c1ccccc1 ZINC000486229365 901413115 /nfs/dbraw/zinc/41/31/15/901413115.db2.gz JBBXGTXLNDZPFW-VWLOTQADSA-N 0 3 423.626 4.173 20 0 HIADHN O=C(CN1CCN(C2CCCCC2)CC1)Nc1ccc(Cl)cc1C(F)(F)F ZINC000486242449 901425214 /nfs/dbraw/zinc/42/52/14/901425214.db2.gz WCFBCVWMBLNPBB-UHFFFAOYSA-N 0 3 403.876 4.248 20 0 HIADHN CN(C)Cc1ccccc1C(=O)N1CCC(c2nc(-c3ccncc3)cs2)CC1 ZINC000486254499 901438076 /nfs/dbraw/zinc/43/80/76/901438076.db2.gz DABKJCIDYGMKQT-UHFFFAOYSA-N 0 3 406.555 4.287 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccc(F)c2)C1)N1CCC(Nc2ccc(F)cc2)CC1 ZINC000486274260 901458227 /nfs/dbraw/zinc/45/82/27/901458227.db2.gz XMMPDTGIBVWLTD-LJQANCHMSA-N 0 3 413.512 4.280 20 0 HIADHN C[C@H]1CN(C2CCOCC2)CCN1C(=O)Nc1cccc(OCCc2ccccc2)c1 ZINC000505897539 914539233 /nfs/dbraw/zinc/53/92/33/914539233.db2.gz BLIGBWVILYYUDA-FQEVSTJZSA-N 0 3 423.557 4.025 20 0 HIADHN Cc1nc2c(s1)CCC[C@@H]2C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000486302667 901482678 /nfs/dbraw/zinc/48/26/78/901482678.db2.gz FJLOQFJSQRKCKL-MOPGFXCFSA-N 0 3 421.570 4.154 20 0 HIADHN COc1ccc(CN2C[C@H]3CCC[C@@]3(c3nc(-c4cccnc4)no3)C2)c(Cl)c1 ZINC000486462304 901621972 /nfs/dbraw/zinc/62/19/72/901621972.db2.gz QGUJTDBYENHJKI-VGOFRKELSA-N 0 3 410.905 4.347 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)N[C@H]2CC(C)(C)Oc3cc(F)ccc32)CC1 ZINC000486473523 901634737 /nfs/dbraw/zinc/63/47/37/901634737.db2.gz VYMCJXHNLHNSLT-FQEVSTJZSA-N 0 3 415.509 4.327 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@@H](C)c3ccc4ncsc4c3)c2)CC1 ZINC000486517059 901668316 /nfs/dbraw/zinc/66/83/16/901668316.db2.gz IERRKSVACFFHSK-INIZCTEOSA-N 0 3 409.559 4.321 20 0 HIADHN Cc1ccc(NC(=O)C2(CNC(=O)c3ccccc3CN(C)C)CCCC2)cc1C ZINC000486567699 901712482 /nfs/dbraw/zinc/71/24/82/901712482.db2.gz RMYOPNJEWGLZGK-UHFFFAOYSA-N 0 3 407.558 4.294 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)c1c(F)cc(C(F)(F)F)cc1F ZINC000486568654 901713923 /nfs/dbraw/zinc/71/39/23/901713923.db2.gz TZEJJIQICIESQT-UHFFFAOYSA-N 0 3 414.374 4.193 20 0 HIADHN C[C@H]([N-]S(=O)(=O)c1c(Cl)cccc1Cl)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000486597778 901735231 /nfs/dbraw/zinc/73/52/31/901735231.db2.gz RNZNFHHQTUQLFB-GOEBONIOSA-N 0 3 413.370 4.182 20 0 HIADHN C[C@H]([N-]S(=O)(=O)c1c(Cl)cccc1Cl)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000486597778 901735236 /nfs/dbraw/zinc/73/52/36/901735236.db2.gz RNZNFHHQTUQLFB-GOEBONIOSA-N 0 3 413.370 4.182 20 0 HIADHN O=C(N[C@H](c1ccccc1)c1ccncc1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000486828766 901880358 /nfs/dbraw/zinc/88/03/58/901880358.db2.gz RCQYZQIUAYTUOO-LADGPHEKSA-N 0 3 403.501 4.339 20 0 HIADHN C[C@H](c1cccc(Cl)c1F)N1C[C@H]2CCC[C@@]2(c2nc(-c3cnccn3)no2)C1 ZINC000486845714 901892502 /nfs/dbraw/zinc/89/25/02/901892502.db2.gz NFJDNMUENAFGAB-ZMOMAAQPSA-N 0 3 413.884 4.434 20 0 HIADHN CN(C(=O)Nc1nnc(/C=C/c2ccco2)s1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000486851252 901896860 /nfs/dbraw/zinc/89/68/60/901896860.db2.gz KGGRKAMOGGJOIN-IENJSVCTSA-N 0 3 423.542 4.430 20 0 HIADHN COc1cc(CN2CCC(c3ccsc3)CC2)ccc1OCC(=O)N1CCCC1 ZINC000486900802 901944090 /nfs/dbraw/zinc/94/40/90/901944090.db2.gz HQCMUOTWHIORQN-UHFFFAOYSA-N 0 3 414.571 4.138 20 0 HIADHN CN(C)Cc1ccccc1C(=O)N1CCN(C2c3ccccc3-c3ccccc32)CC1 ZINC000486926523 901968447 /nfs/dbraw/zinc/96/84/47/901968447.db2.gz OUSNWHJXHHGEKF-UHFFFAOYSA-N 0 3 411.549 4.276 20 0 HIADHN Cc1ccc(CNCc2ccc(-c3cccc(Br)c3)s2)c(=O)n1C ZINC000487168408 902082810 /nfs/dbraw/zinc/08/28/10/902082810.db2.gz SKJXZNAUHXLGBU-UHFFFAOYSA-N 0 3 403.345 4.475 20 0 HIADHN FC(F)(F)c1cnc(N2CC[C@@H](NCc3scnc3C3CC3)C2)c(Cl)c1 ZINC000487313749 902148069 /nfs/dbraw/zinc/14/80/69/902148069.db2.gz BKYSTGBVFSMOME-GFCCVEGCSA-N 0 3 402.873 4.456 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3cc[nH]c3C3CCC3)c(OCC)c2)CC1 ZINC000487367602 902163033 /nfs/dbraw/zinc/16/30/33/902163033.db2.gz YOUOLAIWISRDLW-UHFFFAOYSA-N 0 3 410.562 4.465 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2ccccc2COC2CCOCC2)N2CCCC2)cc1 ZINC000487435022 902209317 /nfs/dbraw/zinc/20/93/17/902209317.db2.gz DKSLNAQOZPUTNO-VWLOTQADSA-N 0 3 422.569 4.258 20 0 HIADHN CC(C)CCn1ncc(NC(=O)N(CCN(C)C)Cc2ccccn2)c1C(C)C ZINC000487632648 902261875 /nfs/dbraw/zinc/26/18/75/902261875.db2.gz SHLNRGJFZQULCH-UHFFFAOYSA-N 0 3 400.571 4.043 20 0 HIADHN COc1cc(CNC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)ccc1OC1CCCC1 ZINC000505957608 914614040 /nfs/dbraw/zinc/61/40/40/914614040.db2.gz VXBGBEBAIZWHSY-OAQYLSRUSA-N 0 3 423.557 4.090 20 0 HIADHN CN(C)Cc1ccccc1C(=O)NCC1(c2ccc(Br)s2)CCC1 ZINC000487945078 902476343 /nfs/dbraw/zinc/47/63/43/902476343.db2.gz ISEYJYALETTXGY-UHFFFAOYSA-N 0 3 407.377 4.424 20 0 HIADHN CC(=O)N(c1nc(CN2CCN(C)[C@H](C(C)C)C2)cs1)c1cccc(C)c1C ZINC000487977533 902501741 /nfs/dbraw/zinc/50/17/41/902501741.db2.gz GGQMZWHSNZNYEX-NRFANRHFSA-N 0 3 400.592 4.217 20 0 HIADHN CC(=O)N(c1nc(CN2CCN(C)[C@H](C(C)C)C2)cs1)c1ccc(C)cc1C ZINC000488172305 902663156 /nfs/dbraw/zinc/66/31/56/902663156.db2.gz RKRJCMRZPYVQMO-NRFANRHFSA-N 0 3 400.592 4.217 20 0 HIADHN CC(C)n1ncc(C(=O)NCCCN2CCc3ccccc3C2)c1-c1ccccc1 ZINC000488392249 902802635 /nfs/dbraw/zinc/80/26/35/902802635.db2.gz ZSOVIPPTIYNBNH-UHFFFAOYSA-N 0 3 402.542 4.309 20 0 HIADHN COCc1cnc(NC(=O)N(CCN(C)Cc2ccccc2)Cc2ccccc2)s1 ZINC000488409791 902813700 /nfs/dbraw/zinc/81/37/00/902813700.db2.gz HYDAGGGLEVZGLO-UHFFFAOYSA-N 0 3 424.570 4.456 20 0 HIADHN Cc1cc(C2CCN(C(=O)N[C@@H](C)C3=CCN(C)CC3)CC2)ccc1Br ZINC000488510116 902862994 /nfs/dbraw/zinc/86/29/94/902862994.db2.gz FGYCOCSFIXAXHL-INIZCTEOSA-N 0 3 420.395 4.297 20 0 HIADHN CCCOc1ccc(C(=O)CCC(=O)N[C@H]2CCN(Cc3ccccc3)C[C@@H]2C)cc1 ZINC000488519882 902867275 /nfs/dbraw/zinc/86/72/75/902867275.db2.gz VCRBKDSPHZULDQ-RDPSFJRHSA-N 0 3 422.569 4.465 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)NC[C@@H]3CCCO[C@H]3c3ccccc3)cc2)CC1 ZINC000488627546 902907190 /nfs/dbraw/zinc/90/71/90/902907190.db2.gz MPAMDUWSEPSYOO-ZCYQVOJMSA-N 0 3 421.585 4.115 20 0 HIADHN Cc1c(C(=O)N(Cc2ccccc2)C2CCN(C)CC2)cnn1-c1ccccc1F ZINC000488694295 902948583 /nfs/dbraw/zinc/94/85/83/902948583.db2.gz XLZULQVZZBUJJK-UHFFFAOYSA-N 0 3 406.505 4.056 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)[C@@H](Oc1ccccc1)c1ccccc1 ZINC000488699135 902950722 /nfs/dbraw/zinc/95/07/22/902950722.db2.gz GKGKMGLGXVMGKB-VWLOTQADSA-N 0 3 416.521 4.402 20 0 HIADHN O=C(CCc1ccc(OC(F)(F)F)cc1)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000488700271 902950967 /nfs/dbraw/zinc/95/09/67/902950967.db2.gz JFGYBHWUPDOLNP-UHFFFAOYSA-N 0 3 422.447 4.113 20 0 HIADHN C[C@H](c1ccc(S(N)(=O)=O)cc1)N(C)Cc1cccc(OCc2ccccc2)c1 ZINC000506005300 914676917 /nfs/dbraw/zinc/67/69/17/914676917.db2.gz UAPFMHJBLUDEMW-GOSISDBHSA-N 0 3 410.539 4.106 20 0 HIADHN Cc1cc(N2CCCC[C@H]2C)ccc1NC(=O)N1CCN(C2CCOCC2)C[C@H]1C ZINC000488904419 903068136 /nfs/dbraw/zinc/06/81/36/903068136.db2.gz BSTIYHUNYPQNCS-WOJBJXKFSA-N 0 3 414.594 4.091 20 0 HIADHN CCCOc1cc(C)ccc1NC(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000489019491 903124145 /nfs/dbraw/zinc/12/41/45/903124145.db2.gz RCVUDDIZMWIWBY-UHFFFAOYSA-N 0 3 411.546 4.062 20 0 HIADHN Cc1ccc(NC(=O)N2CCN(CC3CCCCC3)CC2)cc1C(=O)N(C)C(C)C ZINC000489129983 903218482 /nfs/dbraw/zinc/21/84/82/903218482.db2.gz JJHTVLBHHUMMJM-UHFFFAOYSA-N 0 3 414.594 4.205 20 0 HIADHN COc1ccc(-c2nc(CN3CCC(CCCN4CCOCC4)CC3)cs2)cc1 ZINC000506022522 914702038 /nfs/dbraw/zinc/70/20/38/914702038.db2.gz NFQNXSYCRGQTGY-UHFFFAOYSA-N 0 3 415.603 4.143 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N2CCC(N(C)c3ccccc3)CC2)C1 ZINC000489292209 903313204 /nfs/dbraw/zinc/31/32/04/903313204.db2.gz MDBMAEKHRSJEHH-IRLDBZIGSA-N 0 3 406.574 4.132 20 0 HIADHN CCN(CC(=O)Nc1nc2ccc(C)cc2s1)CC1CCN(c2ccccn2)CC1 ZINC000489291732 903313730 /nfs/dbraw/zinc/31/37/30/903313730.db2.gz NRKDYFMYMUJWTE-UHFFFAOYSA-N 0 3 423.586 4.177 20 0 HIADHN CN(CCN(Cc1ccccc1)C(=O)NCc1cccc(O)c1)Cc1ccccc1 ZINC000489327719 903332621 /nfs/dbraw/zinc/33/26/21/903332621.db2.gz HRPALVSCZXIXCZ-UHFFFAOYSA-N 0 3 403.526 4.236 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)NC[C@H]2CCCO[C@H]2c2ccccc2)CC1 ZINC000489368585 903348660 /nfs/dbraw/zinc/34/86/60/903348660.db2.gz NAGQCNIBBQHRNS-NOZRDPDXSA-N 0 3 421.585 4.460 20 0 HIADHN COc1ccc(CC[C@@H](C)NC(=O)N(Cc2ccccc2)C2CCN(C)CC2)cc1 ZINC000489368221 903348969 /nfs/dbraw/zinc/34/89/69/903348969.db2.gz ZCHPHCRPOQKZJX-HXUWFJFHSA-N 0 3 409.574 4.322 20 0 HIADHN Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)N1CCC(CCCN2CCOCC2)CC1 ZINC000506028528 914709764 /nfs/dbraw/zinc/70/97/64/914709764.db2.gz VETMOBLGSQPGKG-OAQYLSRUSA-N 0 3 415.622 4.270 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1NC(=O)N(CCN(C)C)Cc1cccc(C)c1 ZINC000489396068 903363842 /nfs/dbraw/zinc/36/38/42/903363842.db2.gz YQLNXEYKDXRIOX-UHFFFAOYSA-N 0 3 405.546 4.393 20 0 HIADHN CC[C@H](CNC(=O)N(Cc1ccccc1)C1CCN(C)CC1)Oc1ccccc1F ZINC000489440727 903385064 /nfs/dbraw/zinc/38/50/64/903385064.db2.gz CGZPHAGVFGOAJD-OAQYLSRUSA-N 0 3 413.537 4.289 20 0 HIADHN C[C@@H](NC(=O)NCc1ccccc1CN1CCC(O)CC1)[C@H](C)C1CCCCC1 ZINC000489492624 903420716 /nfs/dbraw/zinc/42/07/16/903420716.db2.gz QVBKJUPFWGBVLD-RBUKOAKNSA-N 0 3 401.595 4.047 20 0 HIADHN C[C@H](N[C@H](Cc1ccccc1)[C@H](O)C(F)F)c1ccc(Br)c(F)c1 ZINC000489543415 903454757 /nfs/dbraw/zinc/45/47/57/903454757.db2.gz GUQAQHRVLNYKPV-JECHBYEQSA-N 0 3 402.254 4.476 20 0 HIADHN Cc1ccc(NC(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)cc1C(=O)N(C)C(C)C ZINC000489604317 903494312 /nfs/dbraw/zinc/49/43/12/903494312.db2.gz XNOJWPWUXJDJMH-QFIPXVFZSA-N 0 3 422.573 4.214 20 0 HIADHN CC(C)c1ccc(CCCNC(=O)NCc2ccccc2CN2CCC(O)CC2)cc1 ZINC000489616494 903499514 /nfs/dbraw/zinc/49/95/14/903499514.db2.gz LBWYOVKEEKIGHB-UHFFFAOYSA-N 0 3 423.601 4.199 20 0 HIADHN C[C@@H]1CN(C2CCOCC2)CCN1C(=O)Nc1cc(Cl)ccc1C(F)(F)F ZINC000489680546 903539988 /nfs/dbraw/zinc/53/99/88/903539988.db2.gz QLLHIZYWYUUCOC-GFCCVEGCSA-N 0 3 405.848 4.076 20 0 HIADHN CC(C)[C@H](c1ccccc1)N(C)C(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000489719626 903557902 /nfs/dbraw/zinc/55/79/02/903557902.db2.gz RNCJRQOQPZQRQV-XMMPIXPASA-N 0 3 409.574 4.182 20 0 HIADHN CC(C)c1ccc(CN(C)C(=O)NCc2ccccc2CN2CCC(O)CC2)cc1 ZINC000489794368 903603336 /nfs/dbraw/zinc/60/33/36/903603336.db2.gz FJTRVEKTBSBTNZ-UHFFFAOYSA-N 0 3 409.574 4.108 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)N1CCC[C@@H](c2ccccc2)CC1 ZINC000489814554 903610602 /nfs/dbraw/zinc/61/06/02/903610602.db2.gz WOSHPHMQWXRBPU-JOCHJYFZSA-N 0 3 421.585 4.123 20 0 HIADHN Cc1cccc2c1[C@H](C)C[C@H]2CC(=O)Nc1ccccc1CN1CCC[C@@H](C(N)=O)C1 ZINC000489909160 903666890 /nfs/dbraw/zinc/66/68/90/903666890.db2.gz GRQSDDFJRRSULD-NRSPTQNISA-N 0 3 419.569 4.312 20 0 HIADHN CN(c1ccccc1)C1CCN(C(=O)NC[C@@H](c2cccs2)N2CCCC2)CC1 ZINC000489911614 903668789 /nfs/dbraw/zinc/66/87/89/903668789.db2.gz LFRPOSMOBOOLFO-NRFANRHFSA-N 0 3 412.603 4.195 20 0 HIADHN CSCC[C@H](N[C@H]1CCCc2nc(-c3ccc(F)cc3)sc21)C(=O)N(C)C ZINC000489912901 903670593 /nfs/dbraw/zinc/67/05/93/903670593.db2.gz XHVYJDQYWZDRPU-RDJZCZTQSA-N 0 3 407.580 4.126 20 0 HIADHN COc1cc(Br)ccc1CNC(=O)c1oc2ccccc2c1CN(C)C ZINC000489988475 903714464 /nfs/dbraw/zinc/71/44/64/903714464.db2.gz BWFGXMAOQYQDBI-UHFFFAOYSA-N 0 3 417.303 4.196 20 0 HIADHN O=C(NCCCN[C@@H](c1ccccc1)c1ccccn1)c1cccc(Br)c1 ZINC000490129035 903782586 /nfs/dbraw/zinc/78/25/86/903782586.db2.gz BYWFZZIKKCJMIJ-NRFANRHFSA-N 0 3 424.342 4.343 20 0 HIADHN Cc1ccc([C@H](NCCN2CCCC[C@@H]2C)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000490168375 903806879 /nfs/dbraw/zinc/80/68/79/903806879.db2.gz UVUVFDRDPMREGO-GBXCKJPGSA-N 0 3 414.615 4.260 20 0 HIADHN Cc1ccc([C@H](NCCN2CCC(C)CC2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000490190239 903817116 /nfs/dbraw/zinc/81/71/16/903817116.db2.gz HIRYJYVGXWYEGG-XMMPIXPASA-N 0 3 414.615 4.118 20 0 HIADHN Cc1ccc(NC(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)cc1C(=O)N1CCCCC1 ZINC000490207626 903828899 /nfs/dbraw/zinc/82/88/99/903828899.db2.gz ZQJMUNLYQKSFJW-DHIUTWEWSA-N 0 3 420.557 4.188 20 0 HIADHN CC1CCN([C@H](CNC(=O)c2ccc(CN3CCCC3=O)cc2)c2ccccc2)CC1 ZINC000490216028 903832640 /nfs/dbraw/zinc/83/26/40/903832640.db2.gz IECXVWPLSHSALC-XMMPIXPASA-N 0 3 419.569 4.012 20 0 HIADHN COc1cc(C)ccc1Oc1ccc(NC(=O)N2CC[C@@H]3CCN(C)C[C@H]32)cc1F ZINC000490326096 903909887 /nfs/dbraw/zinc/90/98/87/903909887.db2.gz FQXZMMVGUPSTAE-QFBILLFUSA-N 0 3 413.493 4.493 20 0 HIADHN CCNC(=O)Nc1ccc(C)c(NC(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000490329805 903917495 /nfs/dbraw/zinc/91/74/95/903917495.db2.gz FJJLTQLMMOZASR-NRFANRHFSA-N 0 3 423.561 4.265 20 0 HIADHN C[C@@H]1C[C@H](CN2CCC[C@H]2c2nc(Cc3ccc(Br)cc3)no2)CCO1 ZINC000490355354 903948892 /nfs/dbraw/zinc/94/88/92/903948892.db2.gz PTNRUVIVCSDCIA-KYJSFNMBSA-N 0 3 420.351 4.375 20 0 HIADHN C[C@@H]1C[C@@H](CN2CCC[C@H]2c2nc(Cc3ccc(Br)cc3)no2)CCO1 ZINC000490355353 903948923 /nfs/dbraw/zinc/94/89/23/903948923.db2.gz PTNRUVIVCSDCIA-HFTRVMKXSA-N 0 3 420.351 4.375 20 0 HIADHN O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)Nc1ccc(-c2ccco2)cc1F ZINC000490510600 904060470 /nfs/dbraw/zinc/06/04/70/904060470.db2.gz VMYBZRZZKKQZEN-HXUWFJFHSA-N 0 3 423.488 4.498 20 0 HIADHN CC[C@@H](CNC(=O)N(Cc1ccccc1)C1CCN(C)CC1)Oc1cccc(C)c1 ZINC000490511466 904061638 /nfs/dbraw/zinc/06/16/38/904061638.db2.gz FHOHOSBXKLXRJK-QHCPKHFHSA-N 0 3 409.574 4.458 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2ccc(C(=O)NC(C)(C)C)cc2)N2CCCC2)cc1 ZINC000490644803 904152361 /nfs/dbraw/zinc/15/23/61/904152361.db2.gz MBPMYOWIBXCSOI-JOCHJYFZSA-N 0 3 422.573 4.482 20 0 HIADHN Cc1ccc(-c2nc(CCNC(=O)N[C@H]3CCN(Cc4ccccc4)[C@H]3C)co2)cc1 ZINC000490715964 904189497 /nfs/dbraw/zinc/18/94/97/904189497.db2.gz FWYUDSXHZJCPFE-CVDCTZTESA-N 0 3 418.541 4.155 20 0 HIADHN Cc1cc(C)n(-c2ccc(C(F)(F)F)cc2NC(=O)N2CC[C@@H]3CCN(C)C[C@H]32)n1 ZINC000490764219 904217010 /nfs/dbraw/zinc/21/70/10/904217010.db2.gz SKYLSDOBFKAUPC-HNAYVOBHSA-N 0 3 421.467 4.066 20 0 HIADHN CCN(CC)c1nc2sc(C(=O)NC[C@@H](c3ccccc3)N(C)C)cc2s1 ZINC000506112917 914808819 /nfs/dbraw/zinc/80/88/19/914808819.db2.gz OHNJLPVKSHFSCL-HNNXBMFYSA-N 0 3 402.589 4.237 20 0 HIADHN Cc1nn(Cc2ccc(C)cc2)c(C)c1CN1CCC(C(=O)N2CCCCC2)CC1 ZINC000506102045 914803945 /nfs/dbraw/zinc/80/39/45/914803945.db2.gz WPIVGLJKCMWZSD-UHFFFAOYSA-N 0 3 408.590 4.081 20 0 HIADHN CSc1cccc([C@H](N[C@H](C)CN2CCN(C)CC2)c2cc(F)ccc2F)c1 ZINC000491019387 904371293 /nfs/dbraw/zinc/37/12/93/904371293.db2.gz KTKQEQUOIKZYCP-ZHRRBRCNSA-N 0 3 405.558 4.002 20 0 HIADHN CCc1ccc([C@H](N[C@H](C)C[C@H]2CCCO2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000491024526 904375425 /nfs/dbraw/zinc/37/54/25/904375425.db2.gz SUCJSVQSKMOCKE-OAOOKAIFSA-N 0 3 401.572 4.289 20 0 HIADHN CCc1ccc([C@H](NCCN(C)[C@@H](C)CC)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000491054139 904396909 /nfs/dbraw/zinc/39/69/09/904396909.db2.gz PXGSPNGPHXRZSM-MBSDFSHPSA-N 0 3 402.604 4.062 20 0 HIADHN Cc1ccc([C@@H](N[C@@H]2CCN(C3CCCC3)C2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000491056490 904398272 /nfs/dbraw/zinc/39/82/72/904398272.db2.gz UZEGNLSKKOQMMY-ZJSXRUAMSA-N 0 3 412.599 4.094 20 0 HIADHN Cc1cccc2ncc(CN3CCC[C@H](c4nnc5ccc(C(F)(F)F)cn54)C3)n21 ZINC000506129284 914815201 /nfs/dbraw/zinc/81/52/01/914815201.db2.gz UXJNQWPNIXBRAV-HNNXBMFYSA-N 0 3 414.435 4.084 20 0 HIADHN O=C([C@@H]1CN(Cc2ccccc2)CCC1(F)F)N1CCC(c2ccc(O)cc2)CC1 ZINC000506127392 914814527 /nfs/dbraw/zinc/81/45/27/914814527.db2.gz YVJZWBRSLHEBOE-QFIPXVFZSA-N 0 3 414.496 4.256 20 0 HIADHN Cc1nn(-c2ccc(F)cc2F)c(C)c1CN1CCC[C@H](c2nnc3ccccn32)C1 ZINC000506129202 914815496 /nfs/dbraw/zinc/81/54/96/914815496.db2.gz SOGMVYWDIRLCMZ-KRWDZBQOSA-N 0 3 422.483 4.190 20 0 HIADHN CCN1CC[C@@H](NCc2cnnn2Cc2ccccc2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000491271196 904512922 /nfs/dbraw/zinc/51/29/22/904512922.db2.gz LZEZVMGITMMQLQ-FGZHOGPDSA-N 0 3 413.928 4.044 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](N[C@@H]2CCc3ccccc3C2)c2ccc(F)cc2)c1 ZINC000491344116 904547935 /nfs/dbraw/zinc/54/79/35/904547935.db2.gz WQGVNRNDZWZAAH-ISKFKSNPSA-N 0 3 409.526 4.466 20 0 HIADHN CC(C)N(CCN[C@@H](c1ccc(F)cc1)c1cccc(S(C)(=O)=O)c1)C(C)C ZINC000491355051 904552395 /nfs/dbraw/zinc/55/23/95/904552395.db2.gz FBWOYLAKDFNLRT-QFIPXVFZSA-N 0 3 406.567 4.027 20 0 HIADHN CC[C@@H]1CCCCN1CCNC(=O)C(=O)Nc1cccc(COC(C)(C)CC)c1C ZINC000491389746 904572118 /nfs/dbraw/zinc/57/21/18/904572118.db2.gz PLTXNZIEBHEYTE-HXUWFJFHSA-N 0 3 417.594 4.019 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1ccc2c(c1)CCCC(=O)N2)c1cccc(OC)c1 ZINC000491394316 904575780 /nfs/dbraw/zinc/57/57/80/904575780.db2.gz IMJKFUAZJHCBMD-QFIPXVFZSA-N 0 3 424.545 4.175 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1ccc2c(c1)CCCC(=O)N2)c1ccsc1 ZINC000491411145 904582523 /nfs/dbraw/zinc/58/25/23/904582523.db2.gz XOVVKPORLNQVDY-IBGZPJMESA-N 0 3 400.548 4.228 20 0 HIADHN CCc1ccc([C@@H](NC2CCN(S(C)(=O)=O)CC2)c2ccccc2Cl)cc1 ZINC000491411512 904584248 /nfs/dbraw/zinc/58/42/48/904584248.db2.gz XQEWWCHUTDVLAD-OAQYLSRUSA-N 0 3 406.979 4.005 20 0 HIADHN Cc1ccc2ncc(CN3CCC[C@@H](c4nnc5ccc(C(F)(F)F)cn54)C3)n2c1 ZINC000506149065 914825346 /nfs/dbraw/zinc/82/53/46/914825346.db2.gz VVCBCJNHFOUDPW-OAHLLOKOSA-N 0 3 414.435 4.084 20 0 HIADHN O=C(Nc1ccc(OCC(F)(F)F)cc1)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000491515813 904631471 /nfs/dbraw/zinc/63/14/71/904631471.db2.gz SRVFUJOKUUWMQH-UHFFFAOYSA-N 0 3 422.447 4.084 20 0 HIADHN O=C(Nc1ccccc1O)C1CCN(Cc2c[nH]nc2-c2cccc(Cl)c2)CC1 ZINC000506162724 914829200 /nfs/dbraw/zinc/82/92/00/914829200.db2.gz DXSOKKDKQIZLHI-UHFFFAOYSA-N 0 3 410.905 4.286 20 0 HIADHN CCCOc1ccc(CN2CCC(C(=O)Nc3ccccc3O)CC2)cc1OCC ZINC000506163425 914829933 /nfs/dbraw/zinc/82/99/33/914829933.db2.gz DPEBTXTZAKRXON-UHFFFAOYSA-N 0 3 412.530 4.430 20 0 HIADHN O=C(Nc1ccccc1NCC(F)(F)F)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000491571011 904655166 /nfs/dbraw/zinc/65/51/66/904655166.db2.gz YQJIECNOXXNCOY-UHFFFAOYSA-N 0 3 421.463 4.117 20 0 HIADHN Cc1cc(C)n(-c2ccccc2NC(=O)N(CCN(C)C)Cc2cccc(C)c2)n1 ZINC000491867210 904716648 /nfs/dbraw/zinc/71/66/48/904716648.db2.gz QTOZUAZTVIMCDO-UHFFFAOYSA-N 0 3 405.546 4.393 20 0 HIADHN CN(C)[C@H](CNC(=O)N1CCC[C@@H](c2nc3ccc(F)cc3o2)C1)Cc1ccccc1 ZINC000506183673 914837052 /nfs/dbraw/zinc/83/70/52/914837052.db2.gz NCXPLTGJGWBUCN-QUCCMNQESA-N 0 3 424.520 4.029 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)Nc2ccc(NC(=O)c3ccco3)cc2)c1 ZINC000491942552 904739817 /nfs/dbraw/zinc/73/98/17/904739817.db2.gz ZHRNQMGVBARJCN-UHFFFAOYSA-N 0 3 420.513 4.436 20 0 HIADHN O=S(=O)(Cc1ccccc1CN[C@H]1CCc2cc(Cl)ccc21)N1CCCC1 ZINC000506202693 914843541 /nfs/dbraw/zinc/84/35/41/914843541.db2.gz ILRPDBNKXHOGFY-NRFANRHFSA-N 0 3 404.963 4.043 20 0 HIADHN Cc1noc(C)c1CCN[C@H](c1cccc(S(C)(=O)=O)c1)c1ccc(C)cc1C ZINC000492100801 904799507 /nfs/dbraw/zinc/79/95/07/904799507.db2.gz QIISPTIUUKFXBY-HSZRJFAPSA-N 0 3 412.555 4.233 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)Nc3ccc(OCc4cccc(F)c4)c(F)c3)[C@@H]2C1 ZINC000492236284 904820682 /nfs/dbraw/zinc/82/06/82/904820682.db2.gz DWVCVRPTZQDQDT-OXJNMPFZSA-N 0 3 401.457 4.102 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)Nc3ccc(OCc4cccc(F)c4)c(F)c3)[C@H]2C1 ZINC000492236286 904821080 /nfs/dbraw/zinc/82/10/80/904821080.db2.gz DWVCVRPTZQDQDT-UZLBHIALSA-N 0 3 401.457 4.102 20 0 HIADHN CN(CCc1ccc(Cl)cc1)CC(=O)Nc1cccc(CN2CCSCC2)c1 ZINC000492400677 904844434 /nfs/dbraw/zinc/84/44/34/904844434.db2.gz NFJNILNDACYGKX-UHFFFAOYSA-N 0 3 418.006 4.002 20 0 HIADHN COc1ccc([C@H](CN[C@@H](C)c2ccccc2Br)N2CCOCC2)cc1 ZINC000492786036 904904870 /nfs/dbraw/zinc/90/48/70/904904870.db2.gz WWPKXUKWQABIFC-KKSFZXQISA-N 0 3 419.363 4.182 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)Nc2ccc3nc(C(F)F)sc3c2)CC1 ZINC000492877552 904936084 /nfs/dbraw/zinc/93/60/84/904936084.db2.gz IGLZTAXEHBVDTC-UHFFFAOYSA-N 0 3 412.506 4.245 20 0 HIADHN CN(C)[C@@H](CNC(=O)NCc1ccccc1OCc1ccccc1)c1ccccc1 ZINC000506237161 914857727 /nfs/dbraw/zinc/85/77/27/914857727.db2.gz AITOOQGFDVJFSK-QHCPKHFHSA-N 0 3 403.526 4.368 20 0 HIADHN CCOc1ccc([C@H](NC[C@@H]2CCCS(=O)(=O)C2)c2cccc(Cl)c2)cc1 ZINC000506248931 914862601 /nfs/dbraw/zinc/86/26/01/914862601.db2.gz ZEKNNWIAUXWBMY-KKSFZXQISA-N 0 3 407.963 4.243 20 0 HIADHN Cc1nn(-c2ccc(C(=O)N(CCN(C)C)Cc3ccccc3)cc2)c(C)c1Cl ZINC000493027395 904990828 /nfs/dbraw/zinc/99/08/28/904990828.db2.gz OUHBDWZNTKECHR-UHFFFAOYSA-N 0 3 410.949 4.347 20 0 HIADHN O=C(Nc1ncc(-c2ccccc2)s1)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000493046976 905002886 /nfs/dbraw/zinc/00/28/86/905002886.db2.gz NDYOBIZWATUBLZ-UHFFFAOYSA-N 0 3 407.539 4.267 20 0 HIADHN CCCN(C)[C@H](CNC(=O)C(=O)Nc1ccccc1SC)c1ccc(Cl)cc1 ZINC000506235318 914856557 /nfs/dbraw/zinc/85/65/57/914856557.db2.gz SSVONONJUPTRML-GOSISDBHSA-N 0 3 419.978 4.200 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3OCC(F)F)cc2)CC1 ZINC000493057718 905005544 /nfs/dbraw/zinc/00/55/44/905005544.db2.gz RKNLURYZCXCEAJ-UHFFFAOYSA-N 0 3 423.891 4.378 20 0 HIADHN Cc1ccc(NC(=O)C(C)C)cc1NC(=O)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000493095115 905017221 /nfs/dbraw/zinc/01/72/21/905017221.db2.gz CFHQXGXHRLDGMK-UHFFFAOYSA-N 0 3 423.557 4.046 20 0 HIADHN Cc1ccc([C@H](NC[C@@]2(C)CCCC[C@H]2O)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000493176853 905040380 /nfs/dbraw/zinc/04/03/80/905040380.db2.gz PIUJVDMZSXJPCL-WXFUMESZSA-N 0 3 415.599 4.327 20 0 HIADHN Fc1cccc([C@@H](NCCCO[C@H]2CCOC2)c2cccc(Br)c2)c1 ZINC000493275675 905072337 /nfs/dbraw/zinc/07/23/37/905072337.db2.gz AVSRSEONBOJSPM-PMACEKPBSA-N 0 3 408.311 4.463 20 0 HIADHN COCC(=O)N1CCC(N[C@H](c2ccccc2Cl)c2cc(C)ccc2C)CC1 ZINC000493276466 905074153 /nfs/dbraw/zinc/07/41/53/905074153.db2.gz JTIOZCMFZQXCSR-HSZRJFAPSA-N 0 3 400.950 4.273 20 0 HIADHN Cc1ccc([C@@H](NC[C@H](CCO)c2ccccc2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000493275958 905074201 /nfs/dbraw/zinc/07/42/01/905074201.db2.gz DPENNUSBMUFQHE-UKILVPOCSA-N 0 3 423.578 4.244 20 0 HIADHN Fc1cc(Br)ccc1[C@H](NCCCO[C@@H]1CCOC1)c1ccccc1 ZINC000493279081 905076244 /nfs/dbraw/zinc/07/62/44/905076244.db2.gz XBVQJFLMDKHMKA-YLJYHZDGSA-N 0 3 408.311 4.463 20 0 HIADHN Cc1cc(-c2cc(C(=O)N3CC[C@@H]4CCN(C)C[C@H]43)c3cnn(C(C)C)c3n2)c(C)o1 ZINC000493481792 905138455 /nfs/dbraw/zinc/13/84/55/905138455.db2.gz QRDYSKMUSXUDFQ-HTAPYJJXSA-N 0 3 421.545 4.055 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)CCc3c4ccccc4[nH]c3-c3ccc(F)cc3)[C@@H]2C1 ZINC000493536801 905152360 /nfs/dbraw/zinc/15/23/60/905152360.db2.gz MPJYPAWZENCHHB-GAJHUEQPSA-N 0 3 405.517 4.459 20 0 HIADHN COc1cc(-c2noc(CN[C@H]3CCC[C@@H]3Cc3ccccc3)n2)cc(OC)c1OC ZINC000493541084 905155368 /nfs/dbraw/zinc/15/53/68/905155368.db2.gz DHTDISZBHYVOKI-MJGOQNOKSA-N 0 3 423.513 4.263 20 0 HIADHN COC[C@@H](NCc1ccc(CN2C[C@@H](C)O[C@@H](C)C2)cc1)c1ccc(Cl)cc1 ZINC000493738517 905208299 /nfs/dbraw/zinc/20/82/99/905208299.db2.gz PQDODLKAAQOQGC-IEGUWTFLSA-N 0 3 402.966 4.427 20 0 HIADHN C[C@@H](NCCCS(=O)(=O)Cc1ccccc1)c1cc(Br)cs1 ZINC000493841798 905231342 /nfs/dbraw/zinc/23/13/42/905231342.db2.gz GIRNHLZSRRIPEL-CYBMUJFWSA-N 0 3 402.379 4.166 20 0 HIADHN CN1C(=O)C[C@H](NCc2cc(F)cc3cccnc32)[C@H]1c1ccc(Cl)c(F)c1 ZINC000493909550 905262209 /nfs/dbraw/zinc/26/22/09/905262209.db2.gz WBQKIFOTYKOFAE-GHTZIAJQSA-N 0 3 401.844 4.228 20 0 HIADHN O=C(CCCc1ccc(Br)s1)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000493919214 905270114 /nfs/dbraw/zinc/27/01/14/905270114.db2.gz DFCGRXCSFMILAC-INIZCTEOSA-N 0 3 407.377 4.224 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)cc1 ZINC000493936208 905287854 /nfs/dbraw/zinc/28/78/54/905287854.db2.gz XMMJLQVTMMTJGF-OAQYLSRUSA-N 0 3 406.448 4.108 20 0 HIADHN Cc1cc(F)ccc1N1CCC[C@H](N[C@H]2CCO[C@@H]2c2ccc(F)c(F)c2)C1=O ZINC000493951591 905302189 /nfs/dbraw/zinc/30/21/89/905302189.db2.gz CMYOQCCGEKEABY-IRFCIJBXSA-N 0 3 404.432 4.028 20 0 HIADHN CCOc1cc(CN2CCC[C@H](CNC(=O)C(C)C)C2)ccc1OCC(F)(F)F ZINC000512403522 921138149 /nfs/dbraw/zinc/13/81/49/921138149.db2.gz LXQYTEAZDDFENN-QGZVFWFLSA-N 0 3 416.484 4.011 20 0 HIADHN C[C@H]1[C@@H](NC(=O)c2ccc(OCc3ccccn3)cc2)CCN1Cc1ccccc1 ZINC000493999507 905342599 /nfs/dbraw/zinc/34/25/99/905342599.db2.gz JGLCWIQNPFHKGP-CYFREDJKSA-N 0 3 401.510 4.053 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)c2cn(C)nc2-c2ccc(Cl)s2)CCN1Cc1ccccc1 ZINC000494006411 905348557 /nfs/dbraw/zinc/34/85/57/905348557.db2.gz IRUYGDJFCMOXSD-PBHICJAKSA-N 0 3 414.962 4.195 20 0 HIADHN CC(C)C(=O)Nc1ccc(Cl)c(C(=O)N[C@@H]2CCN(Cc3ccccc3)[C@H]2C)c1 ZINC000494007144 905349664 /nfs/dbraw/zinc/34/96/64/905349664.db2.gz OPIBEEFYFZQLMJ-HRAATJIYSA-N 0 3 413.949 4.327 20 0 HIADHN Cc1ccc([C@@H](NCCCc2nccs2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000494019936 905359934 /nfs/dbraw/zinc/35/99/34/905359934.db2.gz KOVAFJGJFIDPFW-OAQYLSRUSA-N 0 3 400.569 4.167 20 0 HIADHN C[C@@H]1[C@H](NC(=O)c2ccc(NC(=O)c3ccccc3)cc2)CCN1Cc1ccccc1 ZINC000494061553 905399717 /nfs/dbraw/zinc/39/97/17/905399717.db2.gz XQFRAYJIXBZXPY-NTKDMRAZSA-N 0 3 413.521 4.332 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)c1ccnc(SCC(F)(F)F)c1 ZINC000494063579 905401025 /nfs/dbraw/zinc/40/10/25/905401025.db2.gz DCPDLNKIZBXHEI-UHFFFAOYSA-N 0 3 415.456 4.079 20 0 HIADHN O=C(NCc1nc(-c2ccccc2F)cs1)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000494181418 905517160 /nfs/dbraw/zinc/51/71/60/905517160.db2.gz BMBBAMZLUCNCQA-QGZVFWFLSA-N 0 3 410.518 4.023 20 0 HIADHN C[C@H](O)C[C@@H]1CCCCCN1CC(=O)N[C@H](c1cccs1)c1ccc(F)cc1 ZINC000512434420 921159133 /nfs/dbraw/zinc/15/91/33/921159133.db2.gz XJEARBHESGVQTR-BPXKWBHBSA-N 0 3 404.551 4.108 20 0 HIADHN O=C(CCN1CCC[C@@H](CNC(=O)Nc2cccc(F)c2)C1)c1ccc(F)cc1 ZINC000512438337 921162380 /nfs/dbraw/zinc/16/23/80/921162380.db2.gz CVWHTFLNENQBJH-INIZCTEOSA-N 0 3 401.457 4.071 20 0 HIADHN C[C@@H](CC(=O)NCCCN1CCN(C)C[C@@H]1c1ccccc1)c1c[nH]c2ccccc21 ZINC000494312987 905626864 /nfs/dbraw/zinc/62/68/64/905626864.db2.gz OALFDFRTKRQBGY-NBGIEHNGSA-N 0 3 418.585 4.157 20 0 HIADHN Cc1ccnc(-c2n[nH]c([C@H](C)N[C@H](C)Cc3ccc(Br)cc3F)n2)c1 ZINC000494327671 905639130 /nfs/dbraw/zinc/63/91/30/905639130.db2.gz IHENMWYFEXUVNH-OLZOCXBDSA-N 0 3 418.314 4.359 20 0 HIADHN Cc1ccnc(-c2n[nH]c([C@H](C)N[C@H](C)Cc3ccc(Br)c(F)c3)n2)c1 ZINC000494374216 905672071 /nfs/dbraw/zinc/67/20/71/905672071.db2.gz IXRZTYUKFKXPRI-OLZOCXBDSA-N 0 3 418.314 4.359 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](NCCCc2ccccn2)c2ccc(Cl)cc2)c1 ZINC000494404915 905696617 /nfs/dbraw/zinc/69/66/17/905696617.db2.gz RPRPOAQPYKZYQU-QFIPXVFZSA-N 0 3 414.958 4.450 20 0 HIADHN Cc1ccnc(-c2n[n-]c([C@H](C)N[C@H]3C[C@H]4CC[C@@H](C3)[N@H+]4Cc3ccccc3)n2)c1 ZINC000494421864 905707638 /nfs/dbraw/zinc/70/76/38/905707638.db2.gz AKFAQIAWSSAJOV-WJMWBRGCSA-N 0 3 402.546 4.021 20 0 HIADHN Cc1ccnc(-c2n[n-]c([C@H](C)N[C@H]3C[C@H]4CC[C@@H](C3)[N@@H+]4Cc3ccccc3)n2)c1 ZINC000494421864 905707652 /nfs/dbraw/zinc/70/76/52/905707652.db2.gz AKFAQIAWSSAJOV-WJMWBRGCSA-N 0 3 402.546 4.021 20 0 HIADHN C[C@H](NC(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1)c1nc(C(F)(F)F)cs1 ZINC000494429910 905716471 /nfs/dbraw/zinc/71/64/71/905716471.db2.gz LKFUZORELJSBEB-YDHLFZDLSA-N 0 3 412.481 4.358 20 0 HIADHN Cc1ccnc(-c2nnc([C@@H](C)[NH2+][C@@H](C)CCc3ccc(OC(F)F)cc3)[n-]2)c1 ZINC000494429885 905716702 /nfs/dbraw/zinc/71/67/02/905716702.db2.gz YBVABVFOHWWZKX-LSDHHAIUSA-N 0 3 401.461 4.448 20 0 HIADHN Cc1cccc(S(=O)(=O)CCCN[C@@H]2CCO[C@H]2c2ccc(Cl)c(F)c2)c1 ZINC000494477748 905759197 /nfs/dbraw/zinc/75/91/97/905759197.db2.gz ROBGSORAWDCIJZ-UXHICEINSA-N 0 3 411.926 4.071 20 0 HIADHN O=C1[C@H](N[C@@H]2CCO[C@H]2c2ccc(Cl)cc2)CCCN1Cc1ccc(F)cc1F ZINC000494481713 905763807 /nfs/dbraw/zinc/76/38/07/905763807.db2.gz BPPRGXQYVIZWRH-NJYVYQBISA-N 0 3 420.887 4.229 20 0 HIADHN Cc1ccc2nc(-c3ccc(NC(=O)CN[C@@H]4CCO[C@@H]4C4CC4)cc3)sc2c1 ZINC000494486410 905771400 /nfs/dbraw/zinc/77/14/00/905771400.db2.gz UKOSKKQXLKDANA-DENIHFKCSA-N 0 3 407.539 4.367 20 0 HIADHN O=C(Nc1ccc(Oc2ccncc2)cc1)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000494495396 905784603 /nfs/dbraw/zinc/78/46/03/905784603.db2.gz RZJFYCKDIQWADC-UHFFFAOYSA-N 0 3 417.509 4.331 20 0 HIADHN Cc1ccc(-n2cc(CN3CCC[C@H](CNC(=O)C(C)C)C3)c(C(C)(C)C)n2)cc1 ZINC000512462306 921177202 /nfs/dbraw/zinc/17/72/02/921177202.db2.gz JIALDLLRQFWDQI-HXUWFJFHSA-N 0 3 410.606 4.462 20 0 HIADHN Cc1ccc([C@H](NC(=O)CN2CCCCC[C@H]2C[C@H](C)O)c2cccs2)cc1 ZINC000512473729 921183438 /nfs/dbraw/zinc/18/34/38/921183438.db2.gz FPPAGAHJPQSFKB-LEDOBFOHSA-N 0 3 400.588 4.278 20 0 HIADHN Cc1c[nH]c(-c2ccccc2NC(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)n1 ZINC000494594699 905853564 /nfs/dbraw/zinc/85/35/64/905853564.db2.gz AIKFWXDZHFJIRZ-UHFFFAOYSA-N 0 3 403.530 4.168 20 0 HIADHN Cc1ccoc1CNC(=O)N(Cc1ccccc1Br)C1CCN(C)CC1 ZINC000494611399 905861606 /nfs/dbraw/zinc/86/16/06/905861606.db2.gz CARCIIDBSZVDCL-UHFFFAOYSA-N 0 3 420.351 4.157 20 0 HIADHN C[C@@H]1CN(C2CCOCC2)CCN1C(=O)N[C@H](CC(C)(C)C)c1ccc(F)cc1 ZINC000494660215 905888010 /nfs/dbraw/zinc/88/80/10/905888010.db2.gz FEMUWKRZWOBJOW-DYESRHJHSA-N 0 3 405.558 4.198 20 0 HIADHN COc1ccccc1SC[C@H](C)CNC(=O)N[C@H](CN(C)C)c1ccc(F)cc1 ZINC000494695575 905905397 /nfs/dbraw/zinc/90/53/97/905905397.db2.gz DPEDIPTVSRZCBH-VQIMIIECSA-N 0 3 419.566 4.165 20 0 HIADHN C[C@H](NC(=O)N[C@H](CN1CCCC1)c1ccccc1)c1nc(C(F)(F)F)cs1 ZINC000494717055 905920009 /nfs/dbraw/zinc/92/00/09/905920009.db2.gz AXKSZHYPPSUIID-DZGCQCFKSA-N 0 3 412.481 4.359 20 0 HIADHN COC[C@@H](NC(=O)N[C@H](CN1CCCC1)c1ccccc1)c1ccc(Cl)cc1 ZINC000494719177 905922654 /nfs/dbraw/zinc/92/26/54/905922654.db2.gz KQXYOEWVJMGWEA-NHCUHLMSSA-N 0 3 401.938 4.164 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](NCCc2c[nH]c3ncccc23)c2ccc(F)cc2)c1 ZINC000494747180 905945930 /nfs/dbraw/zinc/94/59/30/905945930.db2.gz QDMYRDHESZEIPB-JOCHJYFZSA-N 0 3 423.513 4.027 20 0 HIADHN CN(C)CCN(Cc1cccc(O)c1)C(=O)[C@H]1C[C@@H]1c1ccc(Cl)c(Cl)c1 ZINC000494794729 905997123 /nfs/dbraw/zinc/99/71/23/905997123.db2.gz YYXSWFXHPTYKNL-MSOLQXFVSA-N 0 3 407.341 4.393 20 0 HIADHN CCOc1cc(CNCc2ccc(C3CCC3)cc2)ccc1O[C@@H](C)C(=O)N(C)C ZINC000494841766 906031374 /nfs/dbraw/zinc/03/13/74/906031374.db2.gz GYGFWDWQPTVHIR-SFHVURJKSA-N 0 3 410.558 4.498 20 0 HIADHN COc1ccc([C@@H]2CCCCCN2C(=O)CN2CCN(C)CC23CCCCC3)cc1 ZINC000494885976 906063645 /nfs/dbraw/zinc/06/36/45/906063645.db2.gz LILIMNZQSZDYBW-QHCPKHFHSA-N 0 3 413.606 4.089 20 0 HIADHN Cc1ccccc1Oc1ccccc1CNC(=O)N1CCN(C2CCOCC2)C[C@@H]1C ZINC000494900531 906075735 /nfs/dbraw/zinc/07/57/35/906075735.db2.gz JZMLTKQKCKABNV-FQEVSTJZSA-N 0 3 423.557 4.182 20 0 HIADHN CCc1c(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2)cnn1CCC(C)C ZINC000494916674 906090593 /nfs/dbraw/zinc/09/05/93/906090593.db2.gz JJNMVGXQZWBPGY-UHFFFAOYSA-N 0 3 403.546 4.226 20 0 HIADHN COC(=O)c1csc(-c2cccc(CN[C@H](c3nnc[nH]3)C3CCCCC3)c2)n1 ZINC000494928285 906101474 /nfs/dbraw/zinc/10/14/74/906101474.db2.gz DJLCEPJNRMFKTQ-SFHVURJKSA-N 0 3 411.531 4.126 20 0 HIADHN CCN(C(=O)N[C@H](C)[C@@H]1OCCc2sccc21)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000494952342 906123451 /nfs/dbraw/zinc/12/34/51/906123451.db2.gz OVZOHHQUWVEIAI-JUXOCIIHSA-N 0 3 413.587 4.056 20 0 HIADHN O=C(CN[C@@H](C[C@@H]1CCOC1)c1ccc(F)cc1)Nc1cccc(Br)c1 ZINC000494956029 906127266 /nfs/dbraw/zinc/12/72/66/906127266.db2.gz IIDJZQGAGVJWLN-LIRRHRJNSA-N 0 3 421.310 4.284 20 0 HIADHN Cc1cc(CN[C@@H](c2nnc[nH]2)C2CCCCC2)ccc1I ZINC000494973188 906139519 /nfs/dbraw/zinc/13/95/19/906139519.db2.gz KJYXFIJVWONYTA-MRXNPFEDSA-N 0 3 410.303 4.129 20 0 HIADHN C[C@H](CNC(=O)NCc1nc(-c2ccccc2F)cs1)N(C)Cc1ccccc1 ZINC000495007889 906167832 /nfs/dbraw/zinc/16/78/32/906167832.db2.gz PZZINSOIYANPEH-MRXNPFEDSA-N 0 3 412.534 4.269 20 0 HIADHN FC(F)(F)c1ccc2nnc([C@H]3CCCN(Cc4scnc4C4CC4)C3)n2c1 ZINC000495058954 906212259 /nfs/dbraw/zinc/21/22/59/906212259.db2.gz LEGBLHSFGWQSOF-ZDUSSCGKSA-N 0 3 407.465 4.462 20 0 HIADHN CCN(C(=O)c1ccc2c(c1)C(C)(C)C(=O)N2)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000495060095 906212409 /nfs/dbraw/zinc/21/24/09/906212409.db2.gz PTPIJTLXFWMKQO-FXAWDEMLSA-N 0 3 405.542 4.214 20 0 HIADHN Brc1ccc(N2CC[C@H](N[C@H](c3nc[nH]n3)C3CCCCC3)C2)cc1 ZINC000495081641 906227786 /nfs/dbraw/zinc/22/77/86/906227786.db2.gz UHJGGSPORDTIRS-WMZOPIPTSA-N 0 3 404.356 4.057 20 0 HIADHN COCCC[C@@H](CNCc1c(Br)cnn1C)c1ccc(Cl)cc1 ZINC000512557770 921235297 /nfs/dbraw/zinc/23/52/97/921235297.db2.gz XRCNXEQYJUCCQX-AWEZNQCLSA-N 0 3 400.748 4.136 20 0 HIADHN C[C@@H](COc1ccc2cc(Br)ccc2c1)NCc1ccnc2ccnn21 ZINC000495416352 906437585 /nfs/dbraw/zinc/43/75/85/906437585.db2.gz ZECNYGVRIAEXJG-AWEZNQCLSA-N 0 3 411.303 4.202 20 0 HIADHN COCC[C@@H](N[C@H](C)CC(=O)Nc1ccc(Br)cc1)c1ccc(C)o1 ZINC000495434536 906448390 /nfs/dbraw/zinc/44/83/90/906448390.db2.gz SNDVHDIIIAUVBA-CXAGYDPISA-N 0 3 409.324 4.435 20 0 HIADHN COc1ccccc1CN1CCC(C(=O)Nc2ccc(Br)cc2)CC1 ZINC000512560145 921236721 /nfs/dbraw/zinc/23/67/21/921236721.db2.gz CATSGJPJQMCUEB-UHFFFAOYSA-N 0 3 403.320 4.308 20 0 HIADHN Cc1ccc2nc(-c3ccc(NC(=O)[C@@H](C)NCCn4cccn4)cc3)sc2c1 ZINC000495445525 906456246 /nfs/dbraw/zinc/45/62/46/906456246.db2.gz WTCBPIULVMLPJI-MRXNPFEDSA-N 0 3 405.527 4.085 20 0 HIADHN O=C(Nc1ccc(F)cc1OCC1CC1)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000495489498 906481034 /nfs/dbraw/zinc/48/10/34/906481034.db2.gz NFZOWEOUQWBKQL-UHFFFAOYSA-N 0 3 412.505 4.071 20 0 HIADHN CCN(CC)[C@H](CNc1ccc(C(=O)N2CCc3ccccc32)cn1)c1ccco1 ZINC000495490749 906483094 /nfs/dbraw/zinc/48/30/94/906483094.db2.gz MDYZKMPOLLEYKB-OAQYLSRUSA-N 0 3 404.514 4.373 20 0 HIADHN CC(C)NS(=O)(=O)c1cccc(CN[C@@H](Cc2ccccc2)c2ccccc2)c1 ZINC000495652853 906517318 /nfs/dbraw/zinc/51/73/18/906517318.db2.gz CYXJDJOYQNWCHP-DEOSSOPVSA-N 0 3 408.567 4.447 20 0 HIADHN CS[C@@H]1CN(C(=O)c2csc(-c3ccc(Cl)c(Cl)c3)n2)C[C@H]1N(C)C ZINC000495681353 906523476 /nfs/dbraw/zinc/52/34/76/906523476.db2.gz GTVCFWXIBUPXRD-HUUCEWRRSA-N 0 3 416.399 4.235 20 0 HIADHN CS[C@H]1CN(C(=O)c2csc(-c3ccc(Cl)cc3Cl)n2)C[C@@H]1N(C)C ZINC000495728401 906535567 /nfs/dbraw/zinc/53/55/67/906535567.db2.gz NNNVLPRXDWMXPA-GJZGRUSLSA-N 0 3 416.399 4.235 20 0 HIADHN O=C(Nc1ccc(O)cc1)C1CCN(Cc2ccc(OCc3ccccn3)cc2)CC1 ZINC000512590147 921251776 /nfs/dbraw/zinc/25/17/76/921251776.db2.gz JAGDHFVPMZYSLE-UHFFFAOYSA-N 0 3 417.509 4.217 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)[C@H](C)Sc1ccc(OC)cc1 ZINC000496228466 906634394 /nfs/dbraw/zinc/63/43/94/906634394.db2.gz ZDIOCBNFZFYPGL-AZUAARDMSA-N 0 3 413.587 4.084 20 0 HIADHN CCCN(CCN(C)C)C(=O)c1cnn(-c2cccc(C(F)(F)F)c2)c1C1CC1 ZINC000496322010 906657787 /nfs/dbraw/zinc/65/77/87/906657787.db2.gz NWDSNFYCVGVORM-UHFFFAOYSA-N 0 3 408.468 4.182 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(C)c1CN1CCC(C(=O)N[C@@H](C)C(C)C)CC1 ZINC000512604834 921257238 /nfs/dbraw/zinc/25/72/38/921257238.db2.gz QZKCJLKILQEJAR-INIZCTEOSA-N 0 3 400.542 4.001 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)N[C@@H]2CCOc3ccc(F)cc32)N(C)C)cc1 ZINC000496689557 906736238 /nfs/dbraw/zinc/73/62/38/906736238.db2.gz LZIIJXLAZLLTRT-RTWAWAEBSA-N 0 3 415.509 4.039 20 0 HIADHN CCN(C)C(=O)c1cccc(NC(=O)N[C@@H](CN(C)Cc2ccccc2)C(C)C)c1 ZINC000496916670 906780350 /nfs/dbraw/zinc/78/03/50/906780350.db2.gz QGMBLAKLGJXWQL-QFIPXVFZSA-N 0 3 410.562 4.057 20 0 HIADHN CCN(C)C(=O)c1cccc(NC(=O)NC[C@@H](c2ccsc2)N(CC)CC)c1 ZINC000496934281 906784346 /nfs/dbraw/zinc/78/43/46/906784346.db2.gz NJMZFNKAABSSOO-IBGZPJMESA-N 0 3 402.564 4.045 20 0 HIADHN CCN1CCC[C@@H]1CNC(=O)[C@H](C)SCc1ncc(-c2ccc(Cl)cc2)o1 ZINC000497017346 906793088 /nfs/dbraw/zinc/79/30/88/906793088.db2.gz DKZRMFOKIRCDSE-WMLDXEAASA-N 0 3 407.967 4.217 20 0 HIADHN CCN1CCN(c2ccccc2CNc2ccc(C(=O)N3CCCC[C@H]3C)cc2)CC1 ZINC000512634659 921269167 /nfs/dbraw/zinc/26/91/67/921269167.db2.gz TXMGTSGLLSLGFB-OAQYLSRUSA-N 0 3 420.601 4.455 20 0 HIADHN Cc1ccc(-c2cnc(CCC(=O)N(Cc3ccco3)C3CCN(C)CC3)o2)cc1 ZINC000497356463 906850718 /nfs/dbraw/zinc/85/07/18/906850718.db2.gz ZZHWZXTWOKWQHA-UHFFFAOYSA-N 0 3 407.514 4.299 20 0 HIADHN CC(C)(C)C(=O)NC[C@@H]1CCCN(Cc2ccc(C(=O)Nc3ccccc3)cc2)C1 ZINC000497372370 906861271 /nfs/dbraw/zinc/86/12/71/906861271.db2.gz SQPLPZOQHNTNOP-FQEVSTJZSA-N 0 3 407.558 4.313 20 0 HIADHN CCOc1cc(C(=O)NC[C@H](c2ccccc2)N(C)C)ccc1OCc1cccnc1 ZINC000497383166 906870111 /nfs/dbraw/zinc/87/01/11/906870111.db2.gz GNIVXYWSKBVAOX-JOCHJYFZSA-N 0 3 419.525 4.092 20 0 HIADHN CN1C[C@H](NC(=O)c2ccc(NC(=O)Nc3ccccc3)cc2)[C@@H](c2ccccc2)C1 ZINC000497388568 906874107 /nfs/dbraw/zinc/87/41/07/906874107.db2.gz UNBHLFMYOSHWAW-PKTZIBPZSA-N 0 3 414.509 4.158 20 0 HIADHN CCC(=O)c1ccc(OCCCCC(=O)N[C@H]2CN(C)C[C@@H]2c2ccccc2)cc1 ZINC000497435343 906908656 /nfs/dbraw/zinc/90/86/56/906908656.db2.gz OJWAMVGYNXISMS-PKTZIBPZSA-N 0 3 408.542 4.042 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)N[C@@H](c3ccccc3Cl)c3cc(F)ccc3F)[C@H]2C1 ZINC000497491235 906974411 /nfs/dbraw/zinc/97/44/11/906974411.db2.gz DDRRESJLNOAYRS-OREJSRFESA-N 0 3 419.903 4.443 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCCC1CCOCC1)c1ccc(C(F)(F)F)cc1 ZINC000512670988 921282880 /nfs/dbraw/zinc/28/28/80/921282880.db2.gz CLDZKWRJUZAICG-LJQANCHMSA-N 0 3 415.500 4.204 20 0 HIADHN Cn1c(=O)oc2cc(CN[C@H](c3cc(F)cc(Br)c3)C3CC3)ccc21 ZINC000512678862 921285185 /nfs/dbraw/zinc/28/51/85/921285185.db2.gz SWCMXOACBBLDRG-SFHVURJKSA-N 0 3 405.267 4.274 20 0 HIADHN COc1ccc(CN2CCC(C(=O)NCc3ccc(C)cc3)CC2)cc1OC(F)F ZINC000512687588 921286999 /nfs/dbraw/zinc/28/69/99/921286999.db2.gz UQRAANUQOMHBIZ-UHFFFAOYSA-N 0 3 418.484 4.133 20 0 HIADHN O[C@H](COc1ccc(Cl)cc1Cl)CN(Cc1cccs1)C[C@@H]1CCCO1 ZINC000497590202 907071233 /nfs/dbraw/zinc/07/12/33/907071233.db2.gz BVTFDONEPODFGR-HOTGVXAUSA-N 0 3 416.370 4.476 20 0 HIADHN CC(C)[C@H](c1ccccc1)N(C)C(=O)NCCCN1CCN(C)C[C@H]1c1ccccc1 ZINC000497604669 907083021 /nfs/dbraw/zinc/08/30/21/907083021.db2.gz SUXTVSNKFAITSJ-LOSJGSFVSA-N 0 3 422.617 4.404 20 0 HIADHN COc1cc(C)c([C@H](C)NC(=O)N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)cc1OC ZINC000497608897 907086698 /nfs/dbraw/zinc/08/66/98/907086698.db2.gz SJKDOLNUQNHHLI-BJLQDIEVSA-N 0 3 411.546 4.035 20 0 HIADHN CCOc1cc(CN[C@H](C)c2ccc3c(c2)OCCO3)cc(Br)c1O ZINC000497676906 907178643 /nfs/dbraw/zinc/17/86/43/907178643.db2.gz PCKLNEYHCOBAHD-GFCCVEGCSA-N 0 3 408.292 4.175 20 0 HIADHN CC(C)Cn1ncc(NC(=O)NC[C@H](c2cccs2)N2CCCC2)c1C1CC1 ZINC000497677128 907179880 /nfs/dbraw/zinc/17/98/80/907179880.db2.gz JVOOVCLHWZHSPT-GOSISDBHSA-N 0 3 401.580 4.437 20 0 HIADHN CCOc1cc(C[NH2+]C[C@H](c2cccc(F)c2)N(C)C)cc(Br)c1[O-] ZINC000497703888 907208950 /nfs/dbraw/zinc/20/89/50/907208950.db2.gz BCVRVUINYTYTGR-QGZVFWFLSA-N 0 3 411.315 4.085 20 0 HIADHN C[C@H](NC(=O)N(CCCc1ccccc1)CCN(C)C)c1nccn1-c1ccccc1 ZINC000512794041 921312734 /nfs/dbraw/zinc/31/27/34/921312734.db2.gz YPKHIKHPIJNWKZ-NRFANRHFSA-N 0 3 419.573 4.139 20 0 HIADHN CCOc1ccc(CN(C)C(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)cc1 ZINC000512801973 921314021 /nfs/dbraw/zinc/31/40/21/921314021.db2.gz JIVHTGURLWKEAG-QHCPKHFHSA-N 0 3 413.562 4.317 20 0 HIADHN CC[C@](C)(NCC1(CN[C@@](C)(CC)c2nc(C)cs2)COC1)c1nc(C)cs1 ZINC000497848762 907328095 /nfs/dbraw/zinc/32/80/95/907328095.db2.gz ZNLQJNNGTTWYDH-PMACEKPBSA-N 0 3 422.664 4.363 20 0 HIADHN CC(C)(C)c1nc(CCNC(=O)NC[C@H](c2ccccc2)N2CCCC2)cs1 ZINC000497941508 907407138 /nfs/dbraw/zinc/40/71/38/907407138.db2.gz YOEFIIIPLCXFQV-LJQANCHMSA-N 0 3 400.592 4.119 20 0 HIADHN C[C@@H](NC(=O)CC1CCCCC1)C(=O)NC[C@H](c1cccs1)N1CCC(C)CC1 ZINC000497993402 907472124 /nfs/dbraw/zinc/47/21/24/907472124.db2.gz NRIDPKUFUJUDAR-UYAOXDASSA-N 0 3 419.635 4.112 20 0 HIADHN COc1ccc([C@H](CNC(=O)CCc2ccc(OC)c(Cl)c2)N2CCCC2)cc1 ZINC000497993719 907472768 /nfs/dbraw/zinc/47/27/68/907472768.db2.gz IASAKCLQWAPKTA-NRFANRHFSA-N 0 3 416.949 4.243 20 0 HIADHN C[C@@H](SCC(=O)N(CCN(C)C)Cc1ccc(F)cc1)c1nc2ccccc2[nH]1 ZINC000498125104 907640333 /nfs/dbraw/zinc/64/03/33/907640333.db2.gz FNIZPGSCESHPGT-MRXNPFEDSA-N 0 3 414.550 4.087 20 0 HIADHN C[C@@H](Cc1ccc(Br)cc1)C(=O)N(Cc1ccco1)C1CCN(C)CC1 ZINC000498126717 907643032 /nfs/dbraw/zinc/64/30/32/907643032.db2.gz VLWMTIDMXALLJF-INIZCTEOSA-N 0 3 419.363 4.344 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCc2c(ncn2-c2ccccc2)C1)c1ccsc1 ZINC000498150433 907674768 /nfs/dbraw/zinc/67/47/68/907674768.db2.gz GCSKMIRMOGRHMG-JOCHJYFZSA-N 0 3 423.586 4.085 20 0 HIADHN C[C@@H](NC(=O)Nc1cc(Br)cc(C(F)(F)F)c1)C1=CCN(C)CC1 ZINC000512845022 921347673 /nfs/dbraw/zinc/34/76/73/921347673.db2.gz JXVBVXDKJUNJTK-SNVBAGLBSA-N 0 3 406.246 4.240 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N[C@H](c2cccc(F)c2)c2ccccn2)C1 ZINC000498238807 907771767 /nfs/dbraw/zinc/77/17/67/907771767.db2.gz KCKHWAOGOBXQSD-RVSNTGDXSA-N 0 3 418.516 4.445 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N[C@H](c2cccc(C)c2)c2ccccn2)N(C)C)cc1 ZINC000498253064 907790626 /nfs/dbraw/zinc/79/06/26/907790626.db2.gz OZKXEEOUKKKIEM-DNQXCXABSA-N 0 3 402.542 4.390 20 0 HIADHN C[C@@H](Cc1ccccc1)C(=O)NC1CCN(CCOc2ccc(Cl)cc2)CC1 ZINC000498266396 907802941 /nfs/dbraw/zinc/80/29/41/907802941.db2.gz XGIGWVCHBGUTTG-SFHVURJKSA-N 0 3 400.950 4.178 20 0 HIADHN CNC(=O)[C@H]1CCC[C@H]1NCc1cc(Br)ccc1OCc1ccccc1 ZINC000498376361 907865946 /nfs/dbraw/zinc/86/59/46/907865946.db2.gz SJVCFTYJBGDSTD-RBUKOAKNSA-N 0 3 417.347 4.032 20 0 HIADHN CCc1nc(C(=O)N2C[C@@H]3CCCN3Cc3ccccc32)nn1-c1ccccc1Cl ZINC000498391357 907876147 /nfs/dbraw/zinc/87/61/47/907876147.db2.gz XIPDMXJNJSHRBR-KRWDZBQOSA-N 0 3 421.932 4.108 20 0 HIADHN C[C@H](Oc1cccc(Cl)c1Cl)C(=O)N(Cc1ccco1)C1CCN(C)CC1 ZINC000498451950 907915265 /nfs/dbraw/zinc/91/52/65/907915265.db2.gz IRTRJCUOXCKIIL-AWEZNQCLSA-N 0 3 411.329 4.477 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)[C@H]1C[C@H]1c1ccccc1C(F)(F)F ZINC000498485504 907955195 /nfs/dbraw/zinc/95/51/95/907955195.db2.gz SAMKYUZJPSUGJP-IRXDYDNUSA-N 0 3 412.521 4.287 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)[C@@H]1C[C@@H]1c1cccc(Br)c1 ZINC000498492453 907966152 /nfs/dbraw/zinc/96/61/52/907966152.db2.gz YJLPWSUYQDYVPK-QZTJIDSGSA-N 0 3 423.420 4.030 20 0 HIADHN C[C@H](c1ccc(F)c(Cl)c1)N1CCC[C@H](CN2CCN(c3ccccn3)CC2)C1 ZINC000498559976 908020357 /nfs/dbraw/zinc/02/03/57/908020357.db2.gz LIXXFPGDLXPGGZ-RTBURBONSA-N 0 3 416.972 4.469 20 0 HIADHN CCc1ccc([C@@H]2CCCN(C(=O)NC3CCN(CCOC(C)C)CC3)C2)cc1 ZINC000498594196 908044298 /nfs/dbraw/zinc/04/42/98/908044298.db2.gz SIBCUPQKYFMWMO-JOCHJYFZSA-N 0 3 401.595 4.027 20 0 HIADHN CCCCCC(=O)NC1CCN(CCCc2nc(-c3ccc(C)c(F)c3)no2)CC1 ZINC000498663696 908099521 /nfs/dbraw/zinc/09/95/21/908099521.db2.gz POXSYAYLTXJHLO-UHFFFAOYSA-N 0 3 416.541 4.278 20 0 HIADHN COc1ccc([C@H](NC(=O)N2CCCN(C)CC2)c2ccc(C(F)(F)F)cc2)cc1 ZINC000498678315 908109239 /nfs/dbraw/zinc/10/92/39/908109239.db2.gz COHFQGCSZPVGAW-HXUWFJFHSA-N 0 3 421.463 4.151 20 0 HIADHN C[C@H](NC(=O)N[C@H]1CCN(Cc2ccccc2)[C@@H]1C)c1nc(C2CCCCC2)no1 ZINC000498705023 908128778 /nfs/dbraw/zinc/12/87/78/908128778.db2.gz CDCOFXURSSMVIM-QKLQHJQFSA-N 0 3 411.550 4.141 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)N[C@@H](C)c2ccc(-c3ccncc3)cc2)cc1 ZINC000498714794 908140074 /nfs/dbraw/zinc/14/00/74/908140074.db2.gz MIDZREMTVYABHG-UUOWRZLLSA-N 0 3 418.541 4.420 20 0 HIADHN CCc1ccc(-c2nn(-c3ccccc3)cc2C(=O)N2CCN(C)CC[C@H]2C)cc1 ZINC000498720509 908144910 /nfs/dbraw/zinc/14/49/10/908144910.db2.gz IHBKWDDNDFQOAM-LJQANCHMSA-N 0 3 402.542 4.268 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@H]2CNC(=O)N[C@@H](CN(C)C)c2ccc(F)cc2)cc1 ZINC000498724082 908149338 /nfs/dbraw/zinc/14/93/38/908149338.db2.gz ZJXHHSIPEIUWDU-PMVMPFDFSA-N 0 3 413.537 4.204 20 0 HIADHN Cc1ccc(-c2nc(C)c(C(=O)N(CCN(C)C)Cc3ccc(F)cc3)s2)o1 ZINC000498725352 908152294 /nfs/dbraw/zinc/15/22/94/908152294.db2.gz VICGOEGHKNWQCL-UHFFFAOYSA-N 0 3 401.507 4.363 20 0 HIADHN C[C@@H]1CCN(C)CCN1C(=O)c1ccc(NC(=O)c2cc(Cl)cc(Cl)c2)cc1 ZINC000498728922 908156584 /nfs/dbraw/zinc/15/65/84/908156584.db2.gz UYEQMCWXJJGWBB-CQSZACIVSA-N 0 3 420.340 4.412 20 0 HIADHN COc1ccc(-c2[nH]c3ccccc3c2CCC(=O)N2CCN(C)CC[C@H]2C)cc1 ZINC000498732335 908160796 /nfs/dbraw/zinc/16/07/96/908160796.db2.gz ADEJAQVNBNPMED-GOSISDBHSA-N 0 3 405.542 4.329 20 0 HIADHN COc1cccc(C2(NC(=O)NC[C@@H](c3ccc(OC(C)C)cc3)N(C)C)CC2)c1 ZINC000512895837 921389192 /nfs/dbraw/zinc/38/91/92/921389192.db2.gz LJCGABSAOBCULM-QFIPXVFZSA-N 0 3 411.546 4.074 20 0 HIADHN Cc1cc(C)c(NC(=O)N2CCC[C@@H](CN3CCN(c4ccccn4)CC3)C2)c(C)c1 ZINC000498834815 908242609 /nfs/dbraw/zinc/24/26/09/908242609.db2.gz DLNGSVNJHYFNOC-QFIPXVFZSA-N 0 3 421.589 4.073 20 0 HIADHN CO[C@@H](C)c1nc(CNC(=O)NC[C@@H](c2ccc(CC(C)C)cc2)N(C)C)cs1 ZINC000498899327 908305330 /nfs/dbraw/zinc/30/53/30/908305330.db2.gz FNZJGTLIPIRMMJ-JXFKEZNVSA-N 0 3 418.607 4.151 20 0 HIADHN C[C@H](NC(=O)CN1CCC[C@H](c2n[nH]c(C3CC3)n2)C1)c1ccc(Cl)cc1Cl ZINC000498915093 908324495 /nfs/dbraw/zinc/32/44/95/908324495.db2.gz FFYIROFXIWXXPE-JSGCOSHPSA-N 0 3 422.360 4.046 20 0 HIADHN CC(C)[C@@H](NCCC(=O)N(C)Cc1ccccc1Br)c1ccc(F)cn1 ZINC000498918827 908327431 /nfs/dbraw/zinc/32/74/31/908327431.db2.gz RZXKHJYONYUQAU-HXUWFJFHSA-N 0 3 422.342 4.319 20 0 HIADHN CCN(C(=O)CN1CCC[C@H](c2nc(C3CC3)n[nH]2)C1)c1cccc2ccccc21 ZINC000498921625 908331615 /nfs/dbraw/zinc/33/16/15/908331615.db2.gz GSQKICZIUKVNOJ-IBGZPJMESA-N 0 3 403.530 4.068 20 0 HIADHN CCN(C(=O)CN1CCC[C@H](c2n[nH]c(C3CC3)n2)C1)c1cccc2ccccc21 ZINC000498921625 908331630 /nfs/dbraw/zinc/33/16/30/908331630.db2.gz GSQKICZIUKVNOJ-IBGZPJMESA-N 0 3 403.530 4.068 20 0 HIADHN C[C@@H](c1nc(Cc2ccc(Cl)cc2)no1)N1CCC[C@@H](c2n[nH]c(C3CC3)n2)C1 ZINC000498936998 908346238 /nfs/dbraw/zinc/34/62/38/908346238.db2.gz PDUMGNJAUJEKJD-XJKSGUPXSA-N 0 3 412.925 4.250 20 0 HIADHN CC[C@H](C)Sc1ccc(NC(=O)C(=O)NC[C@@H](C)N2CCC(C)CC2)c(C)c1 ZINC000499000879 908379311 /nfs/dbraw/zinc/37/93/11/908379311.db2.gz OFASRZRXJRPNMF-MSOLQXFVSA-N 0 3 405.608 4.061 20 0 HIADHN FC(F)(F)c1cccc([C@H]2CCC[C@@H]2NCc2cn(Cc3cccnc3)nn2)c1 ZINC000512913316 921405968 /nfs/dbraw/zinc/40/59/68/921405968.db2.gz NQQUDSYKJAXEGX-UXHICEINSA-N 0 3 401.436 4.166 20 0 HIADHN Cc1cccc([C@H](NC(=O)N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)c2ccccn2)c1 ZINC000499030935 908406349 /nfs/dbraw/zinc/40/63/49/908406349.db2.gz VFYSDFLPADAWDO-XRODADMRSA-N 0 3 414.553 4.442 20 0 HIADHN C[C@H](c1ccc(C(F)(F)F)cc1)N(C)Cc1ccc(S(=O)(=O)N(C)C)cc1 ZINC000499064679 908431868 /nfs/dbraw/zinc/43/18/68/908431868.db2.gz LPZTWBBHZIDAQS-CQSZACIVSA-N 0 3 400.466 4.149 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cccc([C@@H]2CCCOC2)c1)c1cccc(OC)c1 ZINC000499151505 908511430 /nfs/dbraw/zinc/51/14/30/908511430.db2.gz RMHZQCPUDCVWCP-ISKFKSNPSA-N 0 3 410.558 4.402 20 0 HIADHN Cc1ccc([C@H](CNC(=O)[C@H](C)Oc2ccc(F)cc2Br)N(C)C)cc1 ZINC000499169055 908522033 /nfs/dbraw/zinc/52/20/33/908522033.db2.gz RNALEEABWGQNCO-KSSFIOAISA-N 0 3 423.326 4.083 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)NCC2(c3ccc(F)cc3Cl)CC2)CC1 ZINC000499180331 908536381 /nfs/dbraw/zinc/53/63/81/908536381.db2.gz OVXWFEHZCRRFMA-UHFFFAOYSA-N 0 3 419.928 4.410 20 0 HIADHN COc1ccc([C@H](C)NC(=O)N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)c(C)c1OC ZINC000499195976 908551474 /nfs/dbraw/zinc/55/14/74/908551474.db2.gz VAIYVXSBIVEAKE-QRFRQXIXSA-N 0 3 411.546 4.035 20 0 HIADHN Cc1oc(-c2ccco2)nc1CC(=O)N(CCN(C)C)Cc1cccc(Cl)c1 ZINC000499261475 908636658 /nfs/dbraw/zinc/63/66/58/908636658.db2.gz JXVPSRDFPFTZPS-UHFFFAOYSA-N 0 3 401.894 4.029 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)N[C@H](c2cccc(F)c2)c2ccccn2)c1 ZINC000499304282 908676632 /nfs/dbraw/zinc/67/66/32/908676632.db2.gz AKIQAROQHKWYNM-XMMPIXPASA-N 0 3 420.532 4.392 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)N[C@H](c1cccc(F)c1)c1ccccn1 ZINC000499308027 908683326 /nfs/dbraw/zinc/68/33/26/908683326.db2.gz JAGXZNUXLZSCJP-OAQYLSRUSA-N 0 3 412.534 4.145 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)NC(=O)N[C@H]2CCN(Cc3ccccc3)[C@@H]2C)cc1 ZINC000499318172 908691385 /nfs/dbraw/zinc/69/13/85/908691385.db2.gz TUJKGVWNEUBKCV-GLDPYIMESA-N 0 3 417.557 4.204 20 0 HIADHN COc1ccc(S[C@@H](C)C(=O)N(CCN(C)C)Cc2ccc(F)cc2F)cc1 ZINC000499368099 908735863 /nfs/dbraw/zinc/73/58/63/908735863.db2.gz HWEQZHPBLITGTJ-HNNXBMFYSA-N 0 3 408.514 4.044 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Cc2ccc(F)c(Br)c2)N2CCCC2)cc1 ZINC000499398478 908761055 /nfs/dbraw/zinc/76/10/55/908761055.db2.gz WWFJHZIMJLBZBS-HXUWFJFHSA-N 0 3 419.338 4.392 20 0 HIADHN CC(=O)CCc1ccc(O[C@H](C)C(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)cc1 ZINC000499401034 908763475 /nfs/dbraw/zinc/76/34/75/908763475.db2.gz RYYDEELEQYAUJL-PXDATVDWSA-N 0 3 422.569 4.237 20 0 HIADHN O=C(CCc1cc(Br)cs1)NC[C@H](c1cccs1)N1CCCC1 ZINC000499655252 908865932 /nfs/dbraw/zinc/86/59/32/908865932.db2.gz OYAKYWQEEKPTNO-OAHLLOKOSA-N 0 3 413.406 4.458 20 0 HIADHN Fc1ccc(COc2cccc(CNCc3ccc(Cn4cncn4)cc3)c2)cc1 ZINC000499686851 908877542 /nfs/dbraw/zinc/87/75/42/908877542.db2.gz NRASCSXAMBFDFY-UHFFFAOYSA-N 0 3 402.473 4.334 20 0 HIADHN O=C(CCCC1CCCCC1)N1CCC[C@H](CN2CCN(c3ccccn3)CC2)C1 ZINC000499811033 908942425 /nfs/dbraw/zinc/94/24/25/908942425.db2.gz NSRXCUVVLIOTLT-HSZRJFAPSA-N 0 3 412.622 4.193 20 0 HIADHN O=C(CCCC1CCCCC1)N1CCC[C@@H](CN2CCN(c3ccccn3)CC2)C1 ZINC000499811034 908942519 /nfs/dbraw/zinc/94/25/19/908942519.db2.gz NSRXCUVVLIOTLT-QHCPKHFHSA-N 0 3 412.622 4.193 20 0 HIADHN C[C@@H]1CCC[C@H](OCCCCCC(=O)N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)C1 ZINC000499930475 909037853 /nfs/dbraw/zinc/03/78/53/909037853.db2.gz MQLUMMSJZATFCH-SVPADUAOSA-N 0 3 422.654 4.490 20 0 HIADHN O=C(c1cccc([C@@H]2CCCOC2)c1)N1CCCN(CCCc2ccccc2)CC1 ZINC000499950027 909054087 /nfs/dbraw/zinc/05/40/87/909054087.db2.gz YPSIXOSFBZCSOJ-RUZDIDTESA-N 0 3 406.570 4.361 20 0 HIADHN C[C@@H](CNC(=O)c1oc2ccccc2c1CSc1ncccn1)N1CCC(C)CC1 ZINC000499952446 909056475 /nfs/dbraw/zinc/05/64/75/909056475.db2.gz OVRCKHXSAAUAMO-KRWDZBQOSA-N 0 3 424.570 4.365 20 0 HIADHN COc1sc(CN(C)C2CCN(C(=O)c3ccccc3)CC2)cc1Br ZINC000513028156 921488833 /nfs/dbraw/zinc/48/88/33/921488833.db2.gz WBTDZUMNUHWNSP-UHFFFAOYSA-N 0 3 423.376 4.256 20 0 HIADHN C[C@@H]1C[C@@H]1c1ccc([C@@H]2C[C@@H]2C(=O)N(CCN(C)C)Cc2ccc(F)cc2F)o1 ZINC000499976326 909420770 /nfs/dbraw/zinc/42/07/70/909420770.db2.gz JRYFPKHSGGKVTG-FDPIWHGQSA-N 0 3 402.485 4.375 20 0 HIADHN CCOc1cc2c(cc1[C@@H]1C[C@@H]1C(=O)NC[C@H](c1ccc(C)cc1)N(C)C)O[C@H](C)C2 ZINC000499976323 909422664 /nfs/dbraw/zinc/42/26/64/909422664.db2.gz JRCDBOXMSHNAAK-XEDHWARRSA-N 0 3 422.569 4.240 20 0 HIADHN CN(C)[C@H](CNC(=O)C(C)(C)c1csc(-c2cccs2)n1)Cc1ccccc1 ZINC000499987335 909436012 /nfs/dbraw/zinc/43/60/12/909436012.db2.gz FPLVRFJSGQGWHE-KRWDZBQOSA-N 0 3 413.612 4.438 20 0 HIADHN CCc1nnc(NC(=O)[C@@H](C)[C@@H](C)NCc2cc(C)c(C)cc2OC(F)F)s1 ZINC000513046132 921504909 /nfs/dbraw/zinc/50/49/09/921504909.db2.gz JJVINOGMCUHPIL-QWHCGFSZSA-N 0 3 412.506 4.072 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3ccc(F)cc3OC(C)(C)C)CC2)C[C@@H](C)O1 ZINC000500091150 909570702 /nfs/dbraw/zinc/57/07/02/909570702.db2.gz MOCCYRQLQFONQN-IAGOWNOFSA-N 0 3 421.557 4.356 20 0 HIADHN C[S@](=O)Cc1ccc(CNCc2ccc(OC(F)F)c(Br)c2)cc1 ZINC000513053566 921510915 /nfs/dbraw/zinc/51/09/15/921510915.db2.gz ZYWQEDLSQBRLSL-DEOSSOPVSA-N 0 3 418.303 4.219 20 0 HIADHN COc1ccccc1[C@H](NC(=O)N[C@H](C)[C@@H](c1ccccc1)N(C)C)c1ccco1 ZINC000500178426 909673353 /nfs/dbraw/zinc/67/33/53/909673353.db2.gz JNSKWAOFQNIUST-VSDWSMLSSA-N 0 3 407.514 4.368 20 0 HIADHN O=C(C1CC1)N1CCC(NCc2csc(-c3ccc(C(F)(F)F)cc3)n2)CC1 ZINC000500282042 909758123 /nfs/dbraw/zinc/75/81/23/909758123.db2.gz ZFYQKMLJCOARSQ-UHFFFAOYSA-N 0 3 409.477 4.320 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)CCc2c[nH]c3ccc(C)cc23)cc1 ZINC000500377425 909823994 /nfs/dbraw/zinc/82/39/94/909823994.db2.gz HBMQCSCIIAMISV-DEOSSOPVSA-N 0 3 405.542 4.371 20 0 HIADHN C[C@H](NC(=O)C(=O)Nc1cccc(CN(C)C)c1)[C@@H](C)c1ccccc1C(F)(F)F ZINC000500377085 909824157 /nfs/dbraw/zinc/82/41/57/909824157.db2.gz IDPJODBAJCTVKG-CABCVRRESA-N 0 3 421.463 4.014 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)CCc2ccc(Cl)c(OC)c2)cc1 ZINC000500409125 909841314 /nfs/dbraw/zinc/84/13/14/909841314.db2.gz LTBBBEFHHRZWAI-NRFANRHFSA-N 0 3 416.949 4.243 20 0 HIADHN CC[C@@H]1C[C@@]1(NCc1ccc(OCC(=O)N2CCCC2)c(OC)c1)c1cccc(C)c1 ZINC000500496050 909891777 /nfs/dbraw/zinc/89/17/77/909891777.db2.gz JVHVXIBUUOZDTK-RLWLMLJZSA-N 0 3 422.569 4.420 20 0 HIADHN O=C(NCc1ccccc1)C1CCN(Cc2ccccc2Oc2cccnc2)CC1 ZINC000500548292 909920365 /nfs/dbraw/zinc/92/03/65/909920365.db2.gz JDSUDIAXVOSBMQ-UHFFFAOYSA-N 0 3 401.510 4.402 20 0 HIADHN CN(C)Cc1ccc(-c2noc([C@H]3CC(=O)N(c4ccc(Cl)c(F)c4)C3)n2)cc1 ZINC000500617706 909968774 /nfs/dbraw/zinc/96/87/74/909968774.db2.gz MDGFAQVMTJGBJB-HNNXBMFYSA-N 0 3 414.868 4.111 20 0 HIADHN CCN1CCN(Cc2ccc(CNC(=O)N[C@@H](c3ccc(C)cc3)C3CC3)cc2)CC1 ZINC000500637219 909983129 /nfs/dbraw/zinc/98/31/29/909983129.db2.gz CXUCNTYPVNQBMJ-VWLOTQADSA-N 0 3 420.601 4.083 20 0 HIADHN CN(C(=O)c1ccc(Oc2cccnc2)cc1)C1CCN(CCc2ccccn2)CC1 ZINC000500744066 910054117 /nfs/dbraw/zinc/05/41/17/910054117.db2.gz DKSHMFHIODIJOM-UHFFFAOYSA-N 0 3 416.525 4.048 20 0 HIADHN Cc1ccc(OCc2ccc(C(=O)N(CCN(C)C)Cc3ccccn3)o2)c(C)c1 ZINC000500774347 910071651 /nfs/dbraw/zinc/07/16/51/910071651.db2.gz OUKHFEBPGYTEDE-UHFFFAOYSA-N 0 3 407.514 4.074 20 0 HIADHN Cc1cccc(COc2cccc(CC(=O)N(CCN(C)C)Cc3ccccn3)c2)c1 ZINC000500790840 910082790 /nfs/dbraw/zinc/08/27/90/910082790.db2.gz BDSWGCJKKWCNDO-UHFFFAOYSA-N 0 3 417.553 4.102 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)CCOc2ccccc2Br)C1 ZINC000500862490 910136319 /nfs/dbraw/zinc/13/63/19/910136319.db2.gz YSMKDEURXZLJTI-SJLPKXTDSA-N 0 3 417.347 4.170 20 0 HIADHN CCOc1cccc(CN(C)C2CCN(C(=O)c3ccccc3)CC2)c1OC(F)F ZINC000513106251 921554393 /nfs/dbraw/zinc/55/43/93/921554393.db2.gz JFLPZNKXAKQIMF-UHFFFAOYSA-N 0 3 418.484 4.423 20 0 HIADHN COc1cccc(OC)c1Oc1ccc(CN[C@@H](C)CC(=O)Nc2ccccc2)cn1 ZINC000513110257 921556999 /nfs/dbraw/zinc/55/69/99/921556999.db2.gz MDVAHPXPVDWNNL-KRWDZBQOSA-N 0 3 421.497 4.398 20 0 HIADHN C[C@H](CC(=O)N[C@H]1CCN(Cc2ccccc2)CC1(C)C)C(=O)c1cccc(F)c1 ZINC000513110541 921557341 /nfs/dbraw/zinc/55/73/41/921557341.db2.gz QEYQQHXTKZQQDO-GCJKJVERSA-N 0 3 410.533 4.452 20 0 HIADHN CN(C)[C@H](CNC(=O)NC[C@H](c1cccc(Cl)c1)N1CCCC1)c1ccccc1 ZINC000501023033 910241326 /nfs/dbraw/zinc/24/13/26/910241326.db2.gz LTSFZAAVJNLJDQ-FGZHOGPDSA-N 0 3 414.981 4.079 20 0 HIADHN C[C@@H]1Oc2ccc(C(=O)C3CCN(CCSC4CCCCC4)CC3)cc2NC1=O ZINC000501053576 910264559 /nfs/dbraw/zinc/26/45/59/910264559.db2.gz LNTOSXUHGJUOEA-INIZCTEOSA-N 0 3 416.587 4.367 20 0 HIADHN C[C@H](NC(=O)N[C@@H](c1cccc(F)c1)c1ccccn1)[C@@H](c1ccccc1)N(C)C ZINC000501093653 910291484 /nfs/dbraw/zinc/29/14/84/910291484.db2.gz ZBHBURAWOYJCLD-RTFZILSDSA-N 0 3 406.505 4.301 20 0 HIADHN COc1cc(CN2CCC3(C[C@H]3C(=O)N3CCCCC3)CC2)ccc1OC(C)C ZINC000501132837 910313143 /nfs/dbraw/zinc/31/31/43/910313143.db2.gz IITNISATTGDUGW-FQEVSTJZSA-N 0 3 400.563 4.097 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)Nc2cccc(NC(=O)c3ccoc3)c2)C1 ZINC000501148268 910322366 /nfs/dbraw/zinc/32/23/66/910322366.db2.gz LSCJMZFSUCFLTK-VGSWGCGISA-N 0 3 418.497 4.489 20 0 HIADHN CCc1nc(C(=O)N(CCN(C)C)CC2CCCCC2)nn1-c1ccccc1Cl ZINC000501256613 910417138 /nfs/dbraw/zinc/41/71/38/910417138.db2.gz HVXFESPEWDECLN-UHFFFAOYSA-N 0 3 417.985 4.067 20 0 HIADHN CC1(C)CN(Cc2ccccc2)CC[C@H]1NC(=O)CCC(=O)c1ccc(Cl)cn1 ZINC000513131570 921575245 /nfs/dbraw/zinc/57/52/45/921575245.db2.gz IPULTMACUYKPGY-OAQYLSRUSA-N 0 3 413.949 4.115 20 0 HIADHN CC[C@@H](CNC(=O)N1CCC[C@H]1c1ccc(OC)cc1)N1CCc2ccccc2C1 ZINC000501378832 910507745 /nfs/dbraw/zinc/50/77/45/910507745.db2.gz SPELEEYTRKDYEA-UPVQGACJSA-N 0 3 407.558 4.379 20 0 HIADHN CC1CCN(CCNC(=O)Nc2cc(Br)ccc2Br)CC1 ZINC000501497626 910608347 /nfs/dbraw/zinc/60/83/47/910608347.db2.gz XSKAWIQJNLJTQK-UHFFFAOYSA-N 0 3 419.161 4.065 20 0 HIADHN CCOc1ccc(NC(=O)c2ccc(NC(=O)NCCN3CCC(C)CC3)cc2)cc1 ZINC000501504966 910617660 /nfs/dbraw/zinc/61/76/60/910617660.db2.gz PAYPRZWRVXMWCB-UHFFFAOYSA-N 0 3 424.545 4.191 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1CCO[C@H]1c1ccc(Cl)c(F)c1)[C@H](c1ccccc1)N(C)C ZINC000501564191 910672133 /nfs/dbraw/zinc/67/21/33/910672133.db2.gz ACUQNXFQLUCXCY-DJJZHVJBSA-N 0 3 419.928 4.300 20 0 HIADHN C[C@H](C(=O)N(Cc1nnc(-c2ccc(Cl)cc2)o1)C1CC1)N1CCCCCC1 ZINC000501752184 910812510 /nfs/dbraw/zinc/81/25/10/910812510.db2.gz UXOQVKBEXIIWSQ-OAHLLOKOSA-N 0 3 402.926 4.146 20 0 HIADHN COc1ccc(C)cc1CN1CCC[C@@H](c2n[nH]cc2NC(=O)c2ccccc2)C1 ZINC000501774871 910829407 /nfs/dbraw/zinc/82/94/07/910829407.db2.gz VGAHPWPMIOHLMK-LJQANCHMSA-N 0 3 404.514 4.359 20 0 HIADHN C[C@@H]1CN(Cc2nc3c4ccccc4oc3c(=O)[nH]2)[C@H](C)CN1Cc1ccccc1 ZINC000501784580 910839689 /nfs/dbraw/zinc/83/96/89/910839689.db2.gz HUJGTSJXBYZWSR-IAGOWNOFSA-N 0 3 402.498 4.176 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N[C@H]1CCCc2cn(C3CCCC3)nc21)c1ccco1 ZINC000501799319 910850772 /nfs/dbraw/zinc/85/07/72/910850772.db2.gz SAPKIAJDMLMNLD-VDGAXYAQSA-N 0 3 413.566 4.397 20 0 HIADHN O=C(NCCc1ccc(Br)s1)N[C@H](CN1CCCC1)c1ccccc1 ZINC000501801791 910852130 /nfs/dbraw/zinc/85/21/30/910852130.db2.gz GLOFHMJXDLMCGN-QGZVFWFLSA-N 0 3 422.392 4.189 20 0 HIADHN COc1ccc([C@H]2CCCN2C(=O)N[C@@H](CN2CCCC2)c2ccccc2)c(OC)c1 ZINC000501806506 910858082 /nfs/dbraw/zinc/85/80/82/910858082.db2.gz XVZRERAYRBCJSH-XZOQPEGZSA-N 0 3 423.557 4.387 20 0 HIADHN CCN(Cc1ccccc1)C(=O)CN[C@]1(Cc2ccc(C(F)(F)F)cc2)CCOC1 ZINC000513196037 921616353 /nfs/dbraw/zinc/61/63/53/921616353.db2.gz LTECXVATLONLIZ-QFIPXVFZSA-N 0 3 420.475 4.045 20 0 HIADHN O=C(Nc1ccc(NC(=O)c2ccco2)cc1)N[C@H](CN1CCCC1)c1ccccc1 ZINC000501829256 910870911 /nfs/dbraw/zinc/87/09/11/910870911.db2.gz NBXQNYKYZQDFER-OAQYLSRUSA-N 0 3 418.497 4.491 20 0 HIADHN CC(C)c1ccccc1OCCC(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000501872175 910897631 /nfs/dbraw/zinc/89/76/31/910897631.db2.gz IYEUYPPUPCYRKZ-OYRHEFFESA-N 0 3 416.606 4.317 20 0 HIADHN CC(=O)Nc1cccc(NC(=O)[C@@H](C)NCC2(c3c(F)cccc3F)CCCC2)c1 ZINC000501977320 910958620 /nfs/dbraw/zinc/95/86/20/910958620.db2.gz DTDKMHUMECHCSW-OAHLLOKOSA-N 0 3 415.484 4.352 20 0 HIADHN Cc1ccc(C)c(NC(=O)CN[C@]2(Cc3ccc(C(F)(F)F)cc3)CCOC2)c1 ZINC000513210048 921626180 /nfs/dbraw/zinc/62/61/80/921626180.db2.gz NOSNBFJIFIUHIS-NRFANRHFSA-N 0 3 406.448 4.252 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)N[C@H](C)c2cc(C)cc(C)c2)CC1 ZINC000502139113 911063430 /nfs/dbraw/zinc/06/34/30/911063430.db2.gz FUAYTJMEWNNKOO-OAQYLSRUSA-N 0 3 408.590 4.001 20 0 HIADHN Cc1cc([C@@H](C)NC(=O)NCCCN2CCN(C)C[C@@H]2c2ccccc2)c(C)s1 ZINC000502191045 911128851 /nfs/dbraw/zinc/12/88/51/911128851.db2.gz YXCVALJTVPZTQB-XMSQKQJNSA-N 0 3 414.619 4.104 20 0 HIADHN CCN(CC)[C@H](CNC(=O)CCc1cc2ccccc2[nH]c1=O)c1cccc(OC)c1 ZINC000502256453 911210443 /nfs/dbraw/zinc/21/04/43/911210443.db2.gz HWHXUJYFTWAXAC-HSZRJFAPSA-N 0 3 421.541 4.081 20 0 HIADHN O=C(Cc1csc(-c2cccc(F)c2)n1)NC[C@H]1CCCN1Cc1ccccc1 ZINC000513231752 921643859 /nfs/dbraw/zinc/64/38/59/921643859.db2.gz FFZVPNKIOIHQHU-OAQYLSRUSA-N 0 3 409.530 4.273 20 0 HIADHN Cc1noc(CSc2ccc(C(=O)NC[C@H]3CCCN3Cc3ccccc3)cc2)n1 ZINC000513233427 921646819 /nfs/dbraw/zinc/64/68/19/921646819.db2.gz MCQRCTWFARBVFS-HXUWFJFHSA-N 0 3 422.554 4.065 20 0 HIADHN O=C(Nc1c[nH]nc1[C@H]1CCCN(CCCOc2ccc(F)cc2)C1)C1CCCC1 ZINC000502315933 911285496 /nfs/dbraw/zinc/28/54/96/911285496.db2.gz UGOMICZGZRTJRZ-SFHVURJKSA-N 0 3 414.525 4.326 20 0 HIADHN Cc1ccc(C)c(OCCN2CCC[C@@H](c3n[nH]cc3NC(=O)C3CCCC3)C2)c1 ZINC000502383298 911371112 /nfs/dbraw/zinc/37/11/12/911371112.db2.gz ZMSAXMAZRWTZKX-HXUWFJFHSA-N 0 3 410.562 4.414 20 0 HIADHN CCCN(CCN(C)C)C(=O)[C@@H](C)SCc1ncc(-c2ccc(Cl)cc2)o1 ZINC000502404109 911387219 /nfs/dbraw/zinc/38/72/19/911387219.db2.gz XKYYOYJGUXIIKO-OAHLLOKOSA-N 0 3 409.983 4.417 20 0 HIADHN Cc1c(C(=O)NC[C@@H]2CCCN2Cc2ccccc2)cnn1-c1ccccc1Cl ZINC000513253875 921659168 /nfs/dbraw/zinc/65/91/68/921659168.db2.gz FOTPHIGCTOTGAM-IBGZPJMESA-N 0 3 408.933 4.229 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)[C@H]1C[C@@H]1c1cccc(Br)c1 ZINC000513258237 921662757 /nfs/dbraw/zinc/66/27/57/921662757.db2.gz YDTPWENZYBOPRF-HBMCJLEFSA-N 0 3 413.359 4.333 20 0 HIADHN COc1cc(CCNC(=O)CN2C[C@@H](C)C[C@H]2c2ccccc2)ccc1OC(F)F ZINC000513259364 921664540 /nfs/dbraw/zinc/66/45/40/921664540.db2.gz AZDMTDLMGDZINQ-LPHOPBHVSA-N 0 3 418.484 4.038 20 0 HIADHN O=C(CSCc1ccncc1)N[C@@H]1CN(Cc2ccccc2)C[C@H]1c1ccccc1 ZINC000513264515 921667800 /nfs/dbraw/zinc/66/78/00/921667800.db2.gz ZQUOXHZGVWRVCM-BJKOFHAPSA-N 0 3 417.578 4.099 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Cc1ccc2c(c1)CCO2)c1ccc(C(F)(F)F)cc1 ZINC000502523080 911528278 /nfs/dbraw/zinc/52/82/78/911528278.db2.gz OVOAEBSUTARDRU-FQEVSTJZSA-N 0 3 420.475 4.382 20 0 HIADHN OCCN(CCCc1nc(-c2ccccc2)no1)Cc1ccc(Cl)c(Cl)c1 ZINC000502540135 911546627 /nfs/dbraw/zinc/54/66/27/911546627.db2.gz LFBUTTBMMVPRKB-UHFFFAOYSA-N 0 3 406.313 4.471 20 0 HIADHN O=C(NC[C@H]1CCCN1Cc1ccccc1)c1ccnc(SCC(F)(F)F)c1 ZINC000513269657 921671439 /nfs/dbraw/zinc/67/14/39/921671439.db2.gz WDRPUHZEBOSKIN-QGZVFWFLSA-N 0 3 409.477 4.130 20 0 HIADHN COc1ccc([C@H](CNC(=O)C[C@@H](C)Cc2ccccc2OC)N2CCCC2)cc1 ZINC000502612794 911636636 /nfs/dbraw/zinc/63/66/36/911636636.db2.gz UOJWOIFIEWKWAB-CVDCTZTESA-N 0 3 410.558 4.226 20 0 HIADHN COc1ccc([C@H](CNC(=O)C[C@H](C)Cc2ccccc2OC)N2CCCC2)cc1 ZINC000502612796 911636688 /nfs/dbraw/zinc/63/66/88/911636688.db2.gz UOJWOIFIEWKWAB-XXBNENTESA-N 0 3 410.558 4.226 20 0 HIADHN O=C(NC[C@H]1CCCN1Cc1ccccc1)c1cccc(OCc2cscn2)c1 ZINC000513283854 921682910 /nfs/dbraw/zinc/68/29/10/921682910.db2.gz HFJSLVVZAZBUHV-OAQYLSRUSA-N 0 3 407.539 4.117 20 0 HIADHN COc1ccc(NC(=O)[C@H](N[C@H](C)[C@H]2CCCOC2)c2ccccc2)cc1Cl ZINC000502668488 911710280 /nfs/dbraw/zinc/71/02/80/911710280.db2.gz ZRLVNKKHZRAYQH-LDBYXDLTSA-N 0 3 402.922 4.433 20 0 HIADHN Cc1noc(CSc2ccccc2C(=O)NC[C@H]2CCCN2Cc2ccccc2)n1 ZINC000513289487 921687803 /nfs/dbraw/zinc/68/78/03/921687803.db2.gz OVWQVMZCBYHPBY-LJQANCHMSA-N 0 3 422.554 4.065 20 0 HIADHN Cc1c(C(=O)NC[C@@H]2CCCN2Cc2ccccc2)cnn1-c1ccc(Cl)cc1 ZINC000513289913 921688270 /nfs/dbraw/zinc/68/82/70/921688270.db2.gz UCTKBLXOAINCHK-NRFANRHFSA-N 0 3 408.933 4.229 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)C[C@H](C)C(=O)c3cccc(F)c3)c2)CC1 ZINC000502854662 911863137 /nfs/dbraw/zinc/86/31/37/911863137.db2.gz FHKJQDHAOOZSAU-SFHVURJKSA-N 0 3 411.521 4.204 20 0 HIADHN CCCN(CC(=O)NCc1ccc(Cl)s1)[C@@H](C)CC(=O)Nc1ccccc1 ZINC000502920957 911906480 /nfs/dbraw/zinc/90/64/80/911906480.db2.gz VYYXQFXRSLYLRX-HNNXBMFYSA-N 0 3 407.967 4.147 20 0 HIADHN CCc1csc(CC(=O)NC[C@H](c2ccc(C(F)(F)F)cc2)N(CC)CC)n1 ZINC000513310490 921703083 /nfs/dbraw/zinc/70/30/83/921703083.db2.gz OVLRGNGIARHXPR-QGZVFWFLSA-N 0 3 413.509 4.466 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)C(C)(C)c2csc(-c3cccs3)n2)C[C@@H](C)O1 ZINC000503022057 911994648 /nfs/dbraw/zinc/99/46/48/911994648.db2.gz JZZCJLUXGCVKIZ-HZPDHXFCSA-N 0 3 421.632 4.155 20 0 HIADHN Cc1cc(NC(=O)N[C@H]2CCN(Cc3ccccc3)C2)ccc1NC(=O)c1ccco1 ZINC000503054341 912018828 /nfs/dbraw/zinc/01/88/28/912018828.db2.gz RZHCFHGPJSCDJE-FQEVSTJZSA-N 0 3 418.497 4.236 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)c1ccc([C@H]2CCCOC2)cc1 ZINC000503061880 912026319 /nfs/dbraw/zinc/02/63/19/912026319.db2.gz VEEABQCUBIDFMF-FQEVSTJZSA-N 0 3 402.485 4.063 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3cc(F)ccc3-n3cccn3)c(C)c2)CC1 ZINC000503171562 912144667 /nfs/dbraw/zinc/14/46/67/912144667.db2.gz SRRAZJAIUWCKLH-UHFFFAOYSA-N 0 3 422.508 4.106 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)Nc3ccccc3Cl)CC2)c1 ZINC000503201807 912180313 /nfs/dbraw/zinc/18/03/13/912180313.db2.gz FCAJBFZBWNKSIN-UHFFFAOYSA-N 0 3 400.954 4.372 20 0 HIADHN CC(C)Cc1ccc([C@H](CNC(=O)N2CCC3(CCOCC3)[C@@H]2C)N(C)C)cc1 ZINC000513340466 921725981 /nfs/dbraw/zinc/72/59/81/921725981.db2.gz KHMUOAFRNMYCBJ-UGKGYDQZSA-N 0 3 401.595 4.088 20 0 HIADHN CCN(CC)C(=O)c1ccc(NC(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)cc1 ZINC000506294341 914889489 /nfs/dbraw/zinc/88/94/89/914889489.db2.gz IVZLFEATRYMNFN-PGRDOPGGSA-N 0 3 408.546 4.126 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)Nc2cc3c(cc2Cl)OCCCO3)C1 ZINC000506294818 914890049 /nfs/dbraw/zinc/89/00/49/914890049.db2.gz LGMAWZBROYFDEE-WBVHZDCISA-N 0 3 415.921 4.458 20 0 HIADHN CCN(CC)C(=O)c1cccc(NC(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)c1 ZINC000506295238 914890961 /nfs/dbraw/zinc/89/09/61/914890961.db2.gz PGNJLWPGRMXGQY-GCJKJVERSA-N 0 3 408.546 4.126 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)Nc2ccc(C(=O)NC(C)(C)C)cc2)C1 ZINC000506310586 914900000 /nfs/dbraw/zinc/90/00/00/914900000.db2.gz SGKOSBMWVAPLBX-LAUBAEHRSA-N 0 3 408.546 4.172 20 0 HIADHN Cn1cc(CN2CC=C(c3ccc(O)cc3)CC2)c(-c2ccc3c(c2)OCCCO3)n1 ZINC000506310476 914900598 /nfs/dbraw/zinc/90/05/98/914900598.db2.gz ONVKSUQKIQBVAA-UHFFFAOYSA-N 0 3 417.509 4.243 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)N3CCC[C@H](C[N@H+]4CCCC[C@@H]4C)C3)cc2)cc(=O)[n-]1 ZINC000506314231 914906215 /nfs/dbraw/zinc/90/62/15/914906215.db2.gz JEIYVWRQTBRNBX-PKOBYXMFSA-N 0 3 423.561 4.276 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)N3CCC[C@H](C[N@@H+]4CCCC[C@@H]4C)C3)cc2)cc(=O)[n-]1 ZINC000506314231 914906233 /nfs/dbraw/zinc/90/62/33/914906233.db2.gz JEIYVWRQTBRNBX-PKOBYXMFSA-N 0 3 423.561 4.276 20 0 HIADHN COc1cc(CN2CCC[C@@H]2c2ccc(C)cc2)ccc1OCC(=O)N1CCCC1 ZINC000506324521 914928189 /nfs/dbraw/zinc/92/81/89/914928189.db2.gz JQKUWEWCIFJIJS-JOCHJYFZSA-N 0 3 408.542 4.342 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)N[C@@H]1CCCOc2ccccc21 ZINC000506531094 915175205 /nfs/dbraw/zinc/17/52/05/915175205.db2.gz FLPQCWTYIWNRNR-OAQYLSRUSA-N 0 3 411.571 4.313 20 0 HIADHN O=C(CCN1CCCN(C(=O)Nc2cccc(Cl)c2)CC1)Nc1cccc(F)c1 ZINC000506583496 915232882 /nfs/dbraw/zinc/23/28/82/915232882.db2.gz CZCQSBHHXOWYMM-UHFFFAOYSA-N 0 3 418.900 4.048 20 0 HIADHN Cc1noc(C)c1[C@H](C)CNC(=O)N[C@H](CN1CCc2ccccc2C1)C(C)(C)C ZINC000506610512 915264769 /nfs/dbraw/zinc/26/47/69/915264769.db2.gz AKIOOKBXUZTMFI-IIBYNOLFSA-N 0 3 412.578 4.167 20 0 HIADHN CC[C@@H](N[C@@H]1CCCN(Cc2ccc(F)cc2F)C1=O)c1ccc(OC)c(OC)c1 ZINC000506661032 915334187 /nfs/dbraw/zinc/33/41/87/915334187.db2.gz FDYUQEYFHIJIIV-WOJBJXKFSA-N 0 3 418.484 4.214 20 0 HIADHN CC[C@H](N[C@@H](C)C(=O)Nc1ccc(OC(F)F)cc1)c1ccc(OC)c(OC)c1 ZINC000506661783 915337306 /nfs/dbraw/zinc/33/73/06/915337306.db2.gz JLYRJDBJJOKTBQ-GUYCJALGSA-N 0 3 408.445 4.373 20 0 HIADHN CC[C@H](N[C@H](C)C(=O)NC12CC3CC(CC(C3)C1)C2)c1ccc(OC)c(OC)c1 ZINC000506662091 915337620 /nfs/dbraw/zinc/33/76/20/915337620.db2.gz KWMTWDUKFJQKSW-CZVHJPAMSA-N 0 3 400.563 4.218 20 0 HIADHN c1ccc(COc2ccccc2CN2CCC[C@@H](c3nnc4n3CCCCC4)C2)nc1 ZINC000506667247 915342393 /nfs/dbraw/zinc/34/23/93/915342393.db2.gz AUGCVAPBKHTMFS-OAQYLSRUSA-N 0 3 417.557 4.358 20 0 HIADHN COc1cccc(-c2nn(C(C)(C)C)cc2CN2CCC(CC(=O)N(C)C)CC2)c1 ZINC000513394117 921765173 /nfs/dbraw/zinc/76/51/73/921765173.db2.gz GHAKUDBNGBKLLC-UHFFFAOYSA-N 0 3 412.578 4.004 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2CN2CCC(NC(=O)C3CC3)CC2)cc1 ZINC000506690341 915369989 /nfs/dbraw/zinc/36/99/89/915369989.db2.gz PAVKNXGVIVPVPU-UHFFFAOYSA-N 0 3 414.553 4.338 20 0 HIADHN O=C(NCc1ccccc1)C1CCN(Cc2c[nH]nc2-c2cccc(Cl)c2)CC1 ZINC000506708999 915386807 /nfs/dbraw/zinc/38/68/07/915386807.db2.gz VWGATFMEKWCMFG-UHFFFAOYSA-N 0 3 408.933 4.259 20 0 HIADHN COc1cc(CN2CCC(C(=O)Nc3ccccc3)CC2)ccc1OCC(F)(F)F ZINC000506722045 915404390 /nfs/dbraw/zinc/40/43/90/915404390.db2.gz MSNIUFSZLXKYJR-UHFFFAOYSA-N 0 3 422.447 4.487 20 0 HIADHN CN(C)Cc1cccc(NC(=O)[C@@H]2CCCN2C(=O)c2cc(Cl)ccc2Cl)c1 ZINC000506782153 915507519 /nfs/dbraw/zinc/50/75/19/915507519.db2.gz VGIHDOGIKVXNJM-IBGZPJMESA-N 0 3 420.340 4.298 20 0 HIADHN CCN(C[C@@H](O)COc1ccc(C(C)=O)cc1OC)[C@H](C)c1cc2ccccc2o1 ZINC000513411078 921780822 /nfs/dbraw/zinc/78/08/22/921780822.db2.gz JKTXKVQXHNBXDD-OXQOHEQNSA-N 0 3 411.498 4.467 20 0 HIADHN CCN(C[C@H](O)COc1ccc(C(C)=O)cc1OC)[C@H](C)c1cc2ccccc2o1 ZINC000513411080 921779735 /nfs/dbraw/zinc/77/97/35/921779735.db2.gz JKTXKVQXHNBXDD-UZLBHIALSA-N 0 3 411.498 4.467 20 0 HIADHN CN(C)[C@H](CNC(=O)Nc1ccc(F)cc1OCC(F)(F)F)Cc1ccccc1 ZINC000506896801 915691712 /nfs/dbraw/zinc/69/17/12/915691712.db2.gz LTHDWOUHUWWNCT-INIZCTEOSA-N 0 3 413.415 4.061 20 0 HIADHN CC(C)n1nc(-c2ccccc2)cc1NC(=O)NC[C@@H](Cc1ccccc1)N(C)C ZINC000506901860 915701630 /nfs/dbraw/zinc/70/16/30/915701630.db2.gz ZEAYDRUBJQIKPO-OAQYLSRUSA-N 0 3 405.546 4.425 20 0 HIADHN C[C@@H]1CCc2c(sc3nc(CCC(=O)Nc4cccc(CN(C)C)c4)[nH]c(=O)c32)C1 ZINC000506903586 915703667 /nfs/dbraw/zinc/70/36/67/915703667.db2.gz PYRZKLJRPWAZCR-CQSZACIVSA-N 0 3 424.570 4.155 20 0 HIADHN CCN(CC)CCN(Cc1cccs1)C(=O)Nc1cccc2c1OCCC2=O ZINC000506983455 915792976 /nfs/dbraw/zinc/79/29/76/915792976.db2.gz IWZVHWBTGHCEKE-UHFFFAOYSA-N 0 3 401.532 4.089 20 0 HIADHN CCN(Cc1cn(C)nc1-c1ccc2c(c1)OCCCO2)Cc1ccc(OC)cc1 ZINC000506994711 915809365 /nfs/dbraw/zinc/80/93/65/915809365.db2.gz JSFZAZDOSLZZPB-UHFFFAOYSA-N 0 3 407.514 4.279 20 0 HIADHN CC(C)(C)[C@H](NCC(=O)NCCc1cnn(-c2ccccc2)c1)c1ccc(F)cc1 ZINC000507041780 915836337 /nfs/dbraw/zinc/83/63/37/915836337.db2.gz VRGCLUMULKQRSO-HSZRJFAPSA-N 0 3 408.521 4.047 20 0 HIADHN COc1cccc2c1OCC(C(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1)=C2 ZINC000513434223 921802617 /nfs/dbraw/zinc/80/26/17/921802617.db2.gz LSVYLACPKUIYPS-IBGZPJMESA-N 0 3 412.555 4.122 20 0 HIADHN CCCN(C(=O)NC[C@H](c1ccccc1)N(C)C)[C@@H](C)CC(=O)Nc1ccccc1 ZINC000507087371 915861898 /nfs/dbraw/zinc/86/18/98/915861898.db2.gz JZGYWZFAXUMPON-SIKLNZKXSA-N 0 3 410.562 4.128 20 0 HIADHN CC(C)c1ncc(Cl)c(C(=O)N2CCCN(CCCc3ccccc3)CC2)n1 ZINC000507120299 915877258 /nfs/dbraw/zinc/87/72/58/915877258.db2.gz RDSIFZJPDDUVLJ-UHFFFAOYSA-N 0 3 400.954 4.034 20 0 HIADHN COC(=O)CCn1nc(C)c(CN(Cc2ccc(Br)cc2)C(C)C)c1C ZINC000507171026 915914758 /nfs/dbraw/zinc/91/47/58/915914758.db2.gz RSNXSLKNJJBHQU-UHFFFAOYSA-N 0 3 422.367 4.236 20 0 HIADHN CCOCCCNC(=O)C1CCN(Cc2ccc(-c3ccccc3Cl)o2)CC1 ZINC000507187278 915936918 /nfs/dbraw/zinc/93/69/18/915936918.db2.gz JVBSWXVMTKUAAN-UHFFFAOYSA-N 0 3 404.938 4.355 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc2n[nH]cc2c1)C(=O)N(C)Cc1ccc(Br)cc1 ZINC000507227381 915981531 /nfs/dbraw/zinc/98/15/31/915981531.db2.gz HVXSWJVBBOQXPL-KBPBESRZSA-N 0 3 415.335 4.023 20 0 HIADHN COc1ccc(NC(=O)[C@H](NC[C@@H]2CCOC[C@H]2C)c2ccccc2)cc1Cl ZINC000507269284 916030878 /nfs/dbraw/zinc/03/08/78/916030878.db2.gz WXPMNJRCMWPMPQ-LDBYXDLTSA-N 0 3 402.922 4.291 20 0 HIADHN COc1ccc2cc(CN(C)C(=O)[C@@H](C)N[C@@H](C)c3ccc4n[nH]cc4c3)ccc2c1 ZINC000507268313 916031247 /nfs/dbraw/zinc/03/12/47/916031247.db2.gz QGSFWDRTHFXOOI-DLBZAZTESA-N 0 3 416.525 4.422 20 0 HIADHN COc1ccc(NC(=O)[C@H](NC[C@H]2CCOC[C@H]2C)c2ccccc2)cc1Cl ZINC000507269286 916032958 /nfs/dbraw/zinc/03/29/58/916032958.db2.gz WXPMNJRCMWPMPQ-QLVMHMETSA-N 0 3 402.922 4.291 20 0 HIADHN CCOC(=O)c1c(C(C)C)csc1NC(=O)N(CCN(C)C)Cc1ccccn1 ZINC000507282980 916049509 /nfs/dbraw/zinc/04/95/09/916049509.db2.gz IZUANVSBRKMNSJ-UHFFFAOYSA-N 0 3 418.563 4.039 20 0 HIADHN CCOC(=O)CC1CCN(Cc2cn(-c3ccccc3)nc2-c2cccnc2)CC1 ZINC000507309276 916071504 /nfs/dbraw/zinc/07/15/04/916071504.db2.gz BBLDIGIWIDYSHV-UHFFFAOYSA-N 0 3 404.514 4.100 20 0 HIADHN O=C(N[C@H]1CCCN(Cc2ccccc2)C1)N1CCO[C@H](c2ccccc2Cl)C1 ZINC000507317409 916078630 /nfs/dbraw/zinc/07/86/30/916078630.db2.gz JVDRSSYPXXNYSX-UGKGYDQZSA-N 0 3 413.949 4.088 20 0 HIADHN O=C1NCCCC[C@H]1N[C@H]1CCCc2nc(-c3ccc(Br)cc3)sc21 ZINC000507410662 916184044 /nfs/dbraw/zinc/18/40/44/916184044.db2.gz YZHTXYLENLQKRW-GOEBONIOSA-N 0 3 420.376 4.208 20 0 HIADHN CCc1cccnc1[C@@H](C)NCCC(=O)N(C)Cc1ccccc1Br ZINC000507517628 916280773 /nfs/dbraw/zinc/28/07/73/916280773.db2.gz YSVFHWRYFQPGDB-OAHLLOKOSA-N 0 3 404.352 4.106 20 0 HIADHN Cn1nccc1-c1ccccc1C[NH+]1CCC(C(=O)Nc2cc(Cl)ccc2[O-])CC1 ZINC000507548173 916303738 /nfs/dbraw/zinc/30/37/38/916303738.db2.gz IPPTYIAZVWDELZ-UHFFFAOYSA-N 0 3 424.932 4.297 20 0 HIADHN COC(=O)[C@H](C)Oc1ccc(CN2CCC(Oc3ccccc3Cl)CC2)cc1 ZINC000507665162 916430211 /nfs/dbraw/zinc/43/02/11/916430211.db2.gz IEHFOVZLSYSYFQ-INIZCTEOSA-N 0 3 403.906 4.324 20 0 HIADHN Cc1noc([C@H]2CCCN(C[C@H](O)CO[C@H](c3ccccc3)c3ccc(C)cc3)C2)n1 ZINC000507687119 916459159 /nfs/dbraw/zinc/45/91/59/916459159.db2.gz JEZWJMUWYXNIGM-KMDXXIMOSA-N 0 3 421.541 4.033 20 0 HIADHN CC[C@@H](C)N(CC(=O)N1CCC[C@H]1c1ccc2c(c1)OCCO2)Cc1ccccc1 ZINC000507724328 916518060 /nfs/dbraw/zinc/51/80/60/916518060.db2.gz IFSDIVCLAPEZCI-KNQAVFIVSA-N 0 3 408.542 4.422 20 0 HIADHN COc1cccc(NC(=O)[C@@H](NCCc2c[nH]c3ncccc23)c2ccccc2)c1 ZINC000507808029 916596771 /nfs/dbraw/zinc/59/67/71/916596771.db2.gz AXBRBLPVYJMLIS-QFIPXVFZSA-N 0 3 400.482 4.084 20 0 HIADHN CN1C(=O)C[C@H](NCc2ccc(OCc3ccccn3)cc2)[C@H]1c1ccc(Cl)cc1 ZINC000507834905 916639989 /nfs/dbraw/zinc/63/99/89/916639989.db2.gz VEAVPNCGETYILX-LADGPHEKSA-N 0 3 421.928 4.376 20 0 HIADHN CCNC(=O)COc1ccc(CN[C@H]2CCc3c2cc(Cl)cc3Cl)cc1OC ZINC000507839803 916648706 /nfs/dbraw/zinc/64/87/06/916648706.db2.gz CTWXOWLYQOBHFU-SFHVURJKSA-N 0 3 423.340 4.294 20 0 HIADHN CN1C(=O)C[C@H](NCc2ccc(OCc3ccncc3)cc2)[C@@H]1c1ccc(Cl)cc1 ZINC000507851027 916672848 /nfs/dbraw/zinc/67/28/48/916672848.db2.gz MPTNWHCJBAAOSH-UPVQGACJSA-N 0 3 421.928 4.376 20 0 HIADHN C[C@H](C(=O)N1CCC(n2cc(Cl)cn2)CC1)N1CCC(Cc2ccccc2)CC1 ZINC000507854059 916680680 /nfs/dbraw/zinc/68/06/80/916680680.db2.gz YBECDJFHLFFLJD-GOSISDBHSA-N 0 3 414.981 4.043 20 0 HIADHN Fc1ccc(-c2nnc3n2C[C@@H](NCc2ccc(-c4ccncc4)cc2F)CC3)cc1 ZINC000507879290 916719399 /nfs/dbraw/zinc/71/93/99/916719399.db2.gz YMTSVCUNVZTUFR-NRFANRHFSA-N 0 3 417.463 4.390 20 0 HIADHN Cc1ccc(NC(=O)[C@@H]2CCCN(Cc3cccc(OCc4ccccn4)c3)C2)nc1 ZINC000508001280 916841383 /nfs/dbraw/zinc/84/13/83/916841383.db2.gz WCOJFQVYHMEKQL-OAQYLSRUSA-N 0 3 416.525 4.215 20 0 HIADHN Cc1cccc(NC(=O)[C@@H]2CCCN(Cc3cccc(OCc4ccccn4)c3)C2)n1 ZINC000508037759 916867952 /nfs/dbraw/zinc/86/79/52/916867952.db2.gz KNHQTMQTYISHNI-OAQYLSRUSA-N 0 3 416.525 4.215 20 0 HIADHN Cc1cccc(NC(=O)[C@H]2CCCN(Cc3ccc(OCc4ccccn4)cc3)C2)n1 ZINC000508054197 916880480 /nfs/dbraw/zinc/88/04/80/916880480.db2.gz SOJMJRFOVJSKTC-NRFANRHFSA-N 0 3 416.525 4.215 20 0 HIADHN Oc1ccccc1CCNCc1cc(Br)ccc1OCc1ccccn1 ZINC000508064123 916887414 /nfs/dbraw/zinc/88/74/14/916887414.db2.gz NYTDBKLGABSQAC-UHFFFAOYSA-N 0 3 413.315 4.461 20 0 HIADHN O=C(CC1CCCC1)NCCNCc1cn(-c2ccccc2)nc1-c1ccccc1 ZINC000508076419 916896609 /nfs/dbraw/zinc/89/66/09/916896609.db2.gz CSJIUGARVGZTEL-UHFFFAOYSA-N 0 3 402.542 4.325 20 0 HIADHN COCc1c(Br)cccc1NC(=O)N1CCN(CCC(C)(C)C)CC1 ZINC000508178450 916998216 /nfs/dbraw/zinc/99/82/16/916998216.db2.gz PFKQKTRXPWNLJM-UHFFFAOYSA-N 0 3 412.372 4.181 20 0 HIADHN Cc1oc(C(C)C)nc1C(=O)N(CCN(C)C)Cc1ccc(Br)cc1 ZINC000508540416 917320889 /nfs/dbraw/zinc/32/08/89/917320889.db2.gz DBIHWPSOKHCTEZ-UHFFFAOYSA-N 0 3 408.340 4.073 20 0 HIADHN CCN1CCN([C@@H](C)CNC(=O)C(CC)(CC)c2ccc(Cl)c(Cl)c2)CC1 ZINC000508634269 917399627 /nfs/dbraw/zinc/39/96/27/917399627.db2.gz FJOKGXVSCWLAFT-INIZCTEOSA-N 0 3 414.421 4.193 20 0 HIADHN CC[C@H](C)NC(=O)[C@@H]1C[C@H](C)N(Cc2nnc(-c3ccccc3)o2)[C@H]2CCCC[C@H]12 ZINC000508655863 917421218 /nfs/dbraw/zinc/42/12/18/917421218.db2.gz OVABGAWCCIQPIL-VXCLMFOKSA-N 0 3 410.562 4.421 20 0 HIADHN Cc1ccc(-c2nn(Cc3ccccc3)cc2CN2CCC(CC(N)=O)CC2)cc1C ZINC000508676009 917439697 /nfs/dbraw/zinc/43/96/97/917439697.db2.gz BXJQXOLKJYNYRS-UHFFFAOYSA-N 0 3 416.569 4.303 20 0 HIADHN C[C@H](Oc1ccc2ccccc2c1)c1nnc(N2CCN(C3CCCC3)CC2)n1C ZINC000508690952 917452516 /nfs/dbraw/zinc/45/25/16/917452516.db2.gz ZLPFPICZVJNIRZ-SFHVURJKSA-N 0 3 405.546 4.173 20 0 HIADHN CC(C)S(=O)(=O)Cc1cccc(N[C@H](C)[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000508693755 917454691 /nfs/dbraw/zinc/45/46/91/917454691.db2.gz DTKHJFSKXKIYTR-DENIHFKCSA-N 0 3 400.588 4.332 20 0 HIADHN Brc1ccc([C@H](NCc2ccccc2Cn2cncn2)C2CC2)s1 ZINC000508734785 917495106 /nfs/dbraw/zinc/49/51/06/917495106.db2.gz SQOXPDSBUHUZPH-GOSISDBHSA-N 0 3 403.349 4.391 20 0 HIADHN CCO[C@H](C)c1nc(CN(C)C(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)cs1 ZINC000508871858 917624831 /nfs/dbraw/zinc/62/48/31/917624831.db2.gz QPJMAHBMSXVRJS-MDZRGWNJSA-N 0 3 404.580 4.073 20 0 HIADHN COc1ccc(OC)c(CN(C(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)C2CC2)c1 ZINC000508875038 917628544 /nfs/dbraw/zinc/62/85/44/917628544.db2.gz VVFQDININLOAKB-HXOBKFHXSA-N 0 3 411.546 4.069 20 0 HIADHN C[C@@H](NC(=O)Nc1ccc(Cl)c(C(=O)NC2CC2)c1)[C@H](c1ccccc1)N(C)C ZINC000508878173 917630678 /nfs/dbraw/zinc/63/06/78/917630678.db2.gz GRRXMTZXTFBZML-JLTOFOAXSA-N 0 3 414.937 4.045 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1c2ccccc2CC[C@H]1n1ccnc1)[C@@H](c1ccccc1)N(C)C ZINC000508888160 917642180 /nfs/dbraw/zinc/64/21/80/917642180.db2.gz CAQSSTHBQQEUMC-QMTRIVCPSA-N 0 3 417.557 4.102 20 0 HIADHN O=C(NCc1ccc2ccccc2n1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000508930812 917689957 /nfs/dbraw/zinc/68/99/57/917689957.db2.gz YOJNTXXVQHORSW-QFIPXVFZSA-N 0 3 413.443 4.306 20 0 HIADHN CC(=O)Nc1cc(NC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)ccc1C ZINC000508948383 917705500 /nfs/dbraw/zinc/70/55/00/917705500.db2.gz LRHNAYCKSMHRQV-OAQYLSRUSA-N 0 3 419.447 4.347 20 0 HIADHN CC[C@H](NCCCN1CCN(c2ccccc2)CC1)c1nc(C(F)(F)F)cs1 ZINC000508976993 917730688 /nfs/dbraw/zinc/73/06/88/917730688.db2.gz LPIYOMMUPQUDFR-KRWDZBQOSA-N 0 3 412.525 4.415 20 0 HIADHN COc1ccc([C@@H](C)NC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)cc1 ZINC000508996603 917749979 /nfs/dbraw/zinc/74/99/79/917749979.db2.gz ODJXHHYBJWUDEJ-IIBYNOLFSA-N 0 3 406.448 4.327 20 0 HIADHN O=C(Nc1cccc(-c2nnco2)c1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000509016227 917770715 /nfs/dbraw/zinc/77/07/15/917770715.db2.gz MXUCUYYMJAMWGD-FQEVSTJZSA-N 0 3 416.403 4.130 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)N1CCCC[C@H]1c1ncc[nH]1)c1ccc(Cl)cc1 ZINC000509033311 917789216 /nfs/dbraw/zinc/78/92/16/917789216.db2.gz RAIPXOVTIYJLDZ-OALUTQOASA-N 0 3 403.958 4.383 20 0 HIADHN COc1ccc([C@@H]2CCN(C(=O)[C@@H]3CN(Cc4ccccc4)CCC3(F)F)C2)cc1 ZINC000509072107 917816487 /nfs/dbraw/zinc/81/64/87/917816487.db2.gz WUBCGWWRJNZDLH-IRLDBZIGSA-N 0 3 414.496 4.169 20 0 HIADHN O=C(N1CC[C@@H](c2ccccc2)C1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000509142370 917868009 /nfs/dbraw/zinc/86/80/09/917868009.db2.gz VHYAYCNBXXWFOA-IRLDBZIGSA-N 0 3 402.460 4.457 20 0 HIADHN O=C(NCc1cc(-c2ccccc2)on1)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000509193868 917898473 /nfs/dbraw/zinc/89/84/73/917898473.db2.gz FRKNAXSPMOHQMZ-HXUWFJFHSA-N 0 3 411.452 4.115 20 0 HIADHN CCc1cc(C(=O)Nc2ccc(OC3CCN(C)CC3)nc2)c2c(n1)onc2C(C)C ZINC000509268135 917955269 /nfs/dbraw/zinc/95/52/69/917955269.db2.gz FCFYWJDSCKPYRO-UHFFFAOYSA-N 0 3 423.517 4.029 20 0 HIADHN Cn1cnnc1C1CCN(Cc2ccc(-c3ccc(Br)cc3)o2)CC1 ZINC000509361285 918026780 /nfs/dbraw/zinc/02/67/80/918026780.db2.gz ZZDGPAXLUBBBPZ-UHFFFAOYSA-N 0 3 401.308 4.217 20 0 HIADHN O=C(Nc1ccc(Cl)cn1)[C@H]1CCCN(Cc2c[nH]nc2-c2ccccc2F)C1 ZINC000509374054 918039149 /nfs/dbraw/zinc/03/91/49/918039149.db2.gz QEDDBXGPIYHPLT-AWEZNQCLSA-N 0 3 413.884 4.115 20 0 HIADHN Cc1nn(C(C)(C)C)c(C)c1CN1CCC[C@H](C(=O)Nc2ccc(Cl)cn2)C1 ZINC000509391014 918056614 /nfs/dbraw/zinc/05/66/14/918056614.db2.gz XLVBBBYDECOFRH-INIZCTEOSA-N 0 3 403.958 4.154 20 0 HIADHN O=C(N1CCO[C@@H](c2ccccc2)C1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000509421798 918082567 /nfs/dbraw/zinc/08/25/67/918082567.db2.gz IMLKHCKWEULBIR-IFMALSPDSA-N 0 3 418.459 4.041 20 0 HIADHN Cc1ccc(NC(=O)[C@H](NC(=O)c2ccc(Cl)s2)C(C)C)c(CN(C)C)c1 ZINC000509433837 918091849 /nfs/dbraw/zinc/09/18/49/918091849.db2.gz YVDOYZLTVNNJKO-GOSISDBHSA-N 0 3 407.967 4.165 20 0 HIADHN O=C([C@H]1CN(Cc2ccccc2)CCC1(F)F)N1CCC(OC2CCCCC2)CC1 ZINC000509489867 918136009 /nfs/dbraw/zinc/13/60/09/918136009.db2.gz SOEJLWWEOJIMNN-JOCHJYFZSA-N 0 3 420.544 4.484 20 0 HIADHN COCCSc1ccc([C@@H](C)NC(=O)N2CCN(CC3CCCCC3)CC2)cc1 ZINC000509505109 918152372 /nfs/dbraw/zinc/15/23/72/918152372.db2.gz UNNSWLUYNOYCJY-LJQANCHMSA-N 0 3 419.635 4.394 20 0 HIADHN CS(=O)(=O)c1ccc(N[C@@H]2CN(Cc3ccccc3)C[C@H]2c2ccccc2)cc1 ZINC000509532305 918179366 /nfs/dbraw/zinc/17/93/66/918179366.db2.gz JOAXDIAXJGIHLK-BJKOFHAPSA-N 0 3 406.551 4.170 20 0 HIADHN COc1ccc(CN2CCC(C(=O)N3CCC[C@@H](C)C3)CC2)cc1OCC(C)C ZINC000509533018 918181238 /nfs/dbraw/zinc/18/12/38/918181238.db2.gz OLJOCABNIOSZRA-LJQANCHMSA-N 0 3 402.579 4.201 20 0 HIADHN C[C@@H]1CCCN(C(=O)C2CCN(Cc3cccc(OCc4ccccn4)c3)CC2)C1 ZINC000509564903 918214590 /nfs/dbraw/zinc/21/45/90/918214590.db2.gz QUTNPLUBWQEXDU-HXUWFJFHSA-N 0 3 407.558 4.131 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N1CCC[C@H]1c1cccc2c1OCCO2)c1ccco1 ZINC000509565671 918215526 /nfs/dbraw/zinc/21/55/26/918215526.db2.gz AVHJHTFISPDGAE-WDSOQIARSA-N 0 3 413.518 4.027 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)c(C)c1CN1CCC(C(=O)N(C)C(C)C)CC1 ZINC000509571869 918221012 /nfs/dbraw/zinc/22/10/12/918221012.db2.gz NDWWUYLZJDJRMZ-UHFFFAOYSA-N 0 3 402.970 4.221 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N(C)[C@H](COC)c1ccc(Cl)cc1)c1ccco1 ZINC000509571026 918221202 /nfs/dbraw/zinc/22/12/02/918221202.db2.gz RNKMQYFZMLGGSM-ZYSHUDEJSA-N 0 3 407.942 4.391 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N1CCC[C@@H]1c1ccc(OC)c(OC)c1)c1ccco1 ZINC000509576274 918224409 /nfs/dbraw/zinc/22/44/09/918224409.db2.gz DUEKSKZVACLMBM-YTQUADARSA-N 0 3 415.534 4.273 20 0 HIADHN CCOc1cc(CN(CC)[C@H](C)c2cccc(O)c2)ccc1O[C@H](C)C(=O)N(C)C ZINC000509579833 918227499 /nfs/dbraw/zinc/22/74/99/918227499.db2.gz NSEZVSDRJIPDDB-QZTJIDSGSA-N 0 3 414.546 4.230 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N1CCC(Oc2ccc(F)cc2F)CC1)c1ccco1 ZINC000509580689 918229921 /nfs/dbraw/zinc/22/99/21/918229921.db2.gz ZJDSAFOILCXRQP-HNAYVOBHSA-N 0 3 421.488 4.240 20 0 HIADHN CC(C)N(C)C(=O)C1CCN(Cc2cc3ccccc3nc2N2CCCCC2)CC1 ZINC000509587346 918237653 /nfs/dbraw/zinc/23/76/53/918237653.db2.gz VQHYSFCQDWNNKO-UHFFFAOYSA-N 0 3 408.590 4.304 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)N(Cc1ccccc1)CC1CCOCC1)c1ccco1 ZINC000509595127 918243873 /nfs/dbraw/zinc/24/38/73/918243873.db2.gz GLQWMQPZMXMTOF-DENIHFKCSA-N 0 3 413.562 4.347 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)N(Cc1ccccc1)CC1CCOCC1)c1ccco1 ZINC000509595129 918244001 /nfs/dbraw/zinc/24/40/01/918244001.db2.gz GLQWMQPZMXMTOF-KNQAVFIVSA-N 0 3 413.562 4.347 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)N1CCC[C@H](OCc2ccccc2F)C1)c1ccco1 ZINC000509596161 918246887 /nfs/dbraw/zinc/24/68/87/918246887.db2.gz NPJONCVZNPSMPR-LMNJBCLMSA-N 0 3 417.525 4.239 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N(C)Cc1ccccc1OC(F)(F)F)c1ccco1 ZINC000509597718 918247796 /nfs/dbraw/zinc/24/77/96/918247796.db2.gz ALXDUFDKMFLAIV-GOEBONIOSA-N 0 3 413.440 4.449 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N1CCO[C@H](c2cccc(Cl)c2)C1)c1ccco1 ZINC000509603834 918254228 /nfs/dbraw/zinc/25/42/28/918254228.db2.gz RXWRCUVVGIJJEE-CVAIRZPRSA-N 0 3 405.926 4.145 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)CCCCc2ccc(Cl)c(Cl)c2)CC1 ZINC000509631131 918275040 /nfs/dbraw/zinc/27/50/40/918275040.db2.gz DFOSLWFOJSZROI-KRWDZBQOSA-N 0 3 414.421 4.096 20 0 HIADHN Fc1ccc([C@H](CNCc2ccc(Sc3ccccn3)o2)N2CCOCC2)cc1 ZINC000509656874 918292476 /nfs/dbraw/zinc/29/24/76/918292476.db2.gz YUXULSRHCGQSLT-FQEVSTJZSA-N 0 3 413.518 4.128 20 0 HIADHN COCCN(C)CCNC(=O)N(Cc1ccc(-c2ccccc2F)s1)C(C)C ZINC000509714115 918342821 /nfs/dbraw/zinc/34/28/21/918342821.db2.gz RMFBEPWCROBDBS-UHFFFAOYSA-N 0 3 407.555 4.052 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)Nc1ccc(I)cc1 ZINC000509756389 918372355 /nfs/dbraw/zinc/37/23/55/918372355.db2.gz RHQKDAKCFHQMPQ-UHFFFAOYSA-N 0 3 420.250 4.351 20 0 HIADHN CCOc1ccc(CCNC(=O)c2oc3ccccc3c2CN(C)C)cc1OCC ZINC000509770502 918385869 /nfs/dbraw/zinc/38/58/69/918385869.db2.gz KKTPZWQBOQDFKU-UHFFFAOYSA-N 0 3 410.514 4.264 20 0 HIADHN Cc1ccc(NC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)c2n[nH]cc21 ZINC000509926460 918526051 /nfs/dbraw/zinc/52/60/51/918526051.db2.gz QACRUJPFWGLDPI-HXUWFJFHSA-N 0 3 402.420 4.264 20 0 HIADHN CCOc1cc(CN[C@@H]2CCN(C(=O)Nc3ccccc3)C2)ccc1OC(F)F ZINC000509964759 918556180 /nfs/dbraw/zinc/55/61/80/918556180.db2.gz XNUFMRNVHDQTQW-QGZVFWFLSA-N 0 3 405.445 4.083 20 0 HIADHN C[C@H](NS(=O)(=O)c1csc2ccccc21)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000509973469 918563413 /nfs/dbraw/zinc/56/34/13/918563413.db2.gz DYJSFPKUYQYVOJ-FUHWJXTLSA-N 0 3 400.569 4.090 20 0 HIADHN CCc1cc(C(=O)N(CCN(C)C)Cc2cccs2)c2c(n1)onc2C(C)C ZINC000510163260 918715540 /nfs/dbraw/zinc/71/55/40/918715540.db2.gz AORRHUWBYBWLAY-UHFFFAOYSA-N 0 3 400.548 4.174 20 0 HIADHN CSc1cccc(S(=O)(=O)N(C)[C@H]2CCN(Cc3ccccc3)[C@H](C)C2)c1 ZINC000510180606 918730487 /nfs/dbraw/zinc/73/04/87/918730487.db2.gz KDXFEMQLEQEUOR-MJGOQNOKSA-N 0 3 404.601 4.082 20 0 HIADHN CSc1cccc(S(=O)(=O)N(C)[C@@H]2CCN(Cc3ccccc3)[C@H](C)C2)c1 ZINC000510180605 918730847 /nfs/dbraw/zinc/73/08/47/918730847.db2.gz KDXFEMQLEQEUOR-IEBWSBKVSA-N 0 3 404.601 4.082 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)c3cnn(C4CCCCC4)c3C)cc2)CC1 ZINC000510191832 918740566 /nfs/dbraw/zinc/74/05/66/918740566.db2.gz RGRQBIMXOPHWMF-UHFFFAOYSA-N 0 3 409.578 4.087 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N(C)C[C@H]1OCCc2ccccc21)c1ccsc1 ZINC000510254990 918789304 /nfs/dbraw/zinc/78/93/04/918789304.db2.gz IKJWLWAXCJLECI-LEWJYISDSA-N 0 3 401.576 4.086 20 0 HIADHN CC(C)(C)c1csc(CCNC(=O)[C@@H]2CN(Cc3ccccc3)CCC2(F)F)n1 ZINC000510298126 918814896 /nfs/dbraw/zinc/81/48/96/918814896.db2.gz MUOQFZAXQHZLSU-KRWDZBQOSA-N 0 3 421.557 4.257 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CNC(=O)c1oc2ccccc2c1CN(C)C ZINC000510331725 918836567 /nfs/dbraw/zinc/83/65/67/918836567.db2.gz GECMSPGXHOPUHT-UHFFFAOYSA-N 0 3 416.525 4.286 20 0 HIADHN COc1ccc([C@H](Cc2ccc(F)cc2)NCc2ccc3c(c2)oc(=O)n3C)cc1 ZINC000510333847 918837423 /nfs/dbraw/zinc/83/74/23/918837423.db2.gz AEPAAXWIKXQYII-NRFANRHFSA-N 0 3 406.457 4.353 20 0 HIADHN CCOc1ccc([C@H]2CCCN2C(=O)c2ccc(N3CCN(CC)CC3)cc2)cc1 ZINC000510352228 918848086 /nfs/dbraw/zinc/84/80/86/918848086.db2.gz IXYKVTHNWOJEMQ-XMMPIXPASA-N 0 3 407.558 4.205 20 0 HIADHN Cc1nc(COc2ccc(CN3CCC(OCCc4ccccc4)CC3)cc2)no1 ZINC000510374963 918860813 /nfs/dbraw/zinc/86/08/13/918860813.db2.gz KUPBTTHRXVMBRY-UHFFFAOYSA-N 0 3 407.514 4.181 20 0 HIADHN CCN1CCN(c2ccc(C(=O)NCCSc3ccc(Cl)cc3)cc2)CC1 ZINC000510385013 918865609 /nfs/dbraw/zinc/86/56/09/918865609.db2.gz QVTLMRKXMYYJML-UHFFFAOYSA-N 0 3 403.979 4.004 20 0 HIADHN O=C(N[C@H](CC(F)(F)F)c1ccc(F)cc1)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000510385814 918865808 /nfs/dbraw/zinc/86/58/08/918865808.db2.gz DJXNAPOGEPYMJF-RTBURBONSA-N 0 3 409.427 4.393 20 0 HIADHN CC1CCN(C(=O)C2CCN(Cc3c[nH]nc3-c3cccc(Cl)c3)CC2)CC1 ZINC000510398795 918873466 /nfs/dbraw/zinc/87/34/66/918873466.db2.gz YYGKXZPRVYVWHK-UHFFFAOYSA-N 0 3 400.954 4.201 20 0 HIADHN O=C(Nc1cccc(Cl)c1-n1cccn1)N[C@H](CN1CCCC1)c1ccccc1 ZINC000510480688 918933313 /nfs/dbraw/zinc/93/33/13/918933313.db2.gz UGONCWKXEJMKRT-HXUWFJFHSA-N 0 3 409.921 4.484 20 0 HIADHN C[C@@H](NC(=O)NC[C@H]1CC2c3ccccc3C1c1ccccc12)C1=CCN(C)CC1 ZINC000510485051 918936447 /nfs/dbraw/zinc/93/64/47/918936447.db2.gz YLQCNIONUXYFKC-DTAQTMAHSA-N 0 3 401.554 4.233 20 0 HIADHN CC[C@H](C)C(=O)Nc1cccc(CNC(=O)c2oc3ccccc3c2CN(C)C)c1 ZINC000510494876 918942517 /nfs/dbraw/zinc/94/25/17/918942517.db2.gz XWXPZVXZRJZFHS-INIZCTEOSA-N 0 3 407.514 4.409 20 0 HIADHN Cc1ccccc1[C@@H]1CCN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)C1 ZINC000510496733 918943242 /nfs/dbraw/zinc/94/32/42/918943242.db2.gz OUBYJHQNDGQFEE-HSZRJFAPSA-N 0 3 420.601 4.096 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)Nc1ccc2[nH]c([C@H]3CCCO3)nc2c1 ZINC000510498757 918947083 /nfs/dbraw/zinc/94/70/83/918947083.db2.gz CPMSRNKPBKQSJX-HXUWFJFHSA-N 0 3 404.470 4.475 20 0 HIADHN CCOc1ccc([C@@H](NC(=O)N[C@@H](C)C2=CCN(C)CC2)C(C)C)cc1OCC ZINC000510499593 918947887 /nfs/dbraw/zinc/94/78/87/918947887.db2.gz HCJYKOLYNMPJDQ-JTSKRJEESA-N 0 3 403.567 4.131 20 0 HIADHN Cc1n[nH]c(C)c1[C@@H]1CCCCCN1C(=O)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000510502666 918950335 /nfs/dbraw/zinc/95/03/35/918950335.db2.gz PRKTWLXWPUIXLO-VXKWHMMOSA-N 0 3 409.578 4.490 20 0 HIADHN C[C@@H](NC(=O)N[C@@H](C)C1=CCN(C)CC1)c1ccc(NC(=O)c2ccc(F)cc2)cc1 ZINC000510570701 919013661 /nfs/dbraw/zinc/01/36/61/919013661.db2.gz JZHXUKJLCIKSIJ-SJORKVTESA-N 0 3 424.520 4.089 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3ccnc(Sc4ccccn4)c3)cc2)CC1 ZINC000510629844 919070540 /nfs/dbraw/zinc/07/05/40/919070540.db2.gz LVONLYWSVYCOQI-UHFFFAOYSA-N 0 3 419.554 4.022 20 0 HIADHN CC[C@@H](CS(=O)(=O)c1ccccc1)N[C@@H]1CCc2ccc(Br)cc21 ZINC000510693947 919131733 /nfs/dbraw/zinc/13/17/33/919131733.db2.gz DZKOCHKGPGWDOG-QFBILLFUSA-N 0 3 408.361 4.279 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)Nc1ccc(C(=O)NC2CCCCC2)cc1 ZINC000510713826 919155421 /nfs/dbraw/zinc/15/54/21/919155421.db2.gz REFIBHOLWGGTPF-UHFFFAOYSA-N 0 3 422.573 4.345 20 0 HIADHN C[C@@H](NC(=O)c1cc(Oc2cccc(Br)c2)ccn1)C1=CCN(C)CC1 ZINC000510736044 919182644 /nfs/dbraw/zinc/18/26/44/919182644.db2.gz SWGAUSYWKGGHIL-CQSZACIVSA-N 0 3 416.319 4.017 20 0 HIADHN Cc1ccc([C@H](NCCCN2CCN(c3ccccc3)CC2)c2ccccn2)cc1 ZINC000510781983 919243916 /nfs/dbraw/zinc/24/39/16/919243916.db2.gz WAZFWFJJKDAYDH-SANMLTNESA-N 0 3 400.570 4.281 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)NCCc1ccccc1Br ZINC000510787250 919251483 /nfs/dbraw/zinc/25/14/83/919251483.db2.gz JSSXFWMTAINTDX-UHFFFAOYSA-N 0 3 401.304 4.229 20 0 HIADHN C[C@@H](NC(=O)Cc1csc(-c2ccc(Cl)cc2Cl)n1)C1=CCN(C)CC1 ZINC000510786792 919253149 /nfs/dbraw/zinc/25/31/49/919253149.db2.gz GSNWKBJCLFCZQH-GFCCVEGCSA-N 0 3 410.370 4.426 20 0 HIADHN CO[C@]1(C)CCCN([C@H]2CCCN(c3c(C)cc(Br)cc3C)C2=O)CC1 ZINC000510814952 919289695 /nfs/dbraw/zinc/28/96/95/919289695.db2.gz URXWLIRUUBVVLR-GHTZIAJQSA-N 0 3 423.395 4.452 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)NCCOc1ccccc1C(F)(F)F ZINC000510820832 919298394 /nfs/dbraw/zinc/29/83/94/919298394.db2.gz LEBWXBZAZXFDCM-UHFFFAOYSA-N 0 3 406.404 4.322 20 0 HIADHN O=C(N[C@@H](c1ccccc1)c1ccncc1)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000510857642 919347022 /nfs/dbraw/zinc/34/70/22/919347022.db2.gz PZUBUDFMJPOZQN-GOTSBHOMSA-N 0 3 421.491 4.445 20 0 HIADHN C[C@@H](CCc1ccc(C(F)(F)F)cc1)NCc1cc(S(C)(=O)=O)ccc1F ZINC000510964195 919508533 /nfs/dbraw/zinc/50/85/33/919508533.db2.gz CAGXGWKVFCYVFF-ZDUSSCGKSA-N 0 3 403.441 4.359 20 0 HIADHN Fc1ccc([C@@H](NCCc2nnnn2-c2ccccc2)c2cnc3ccccc3c2)cc1 ZINC000510993844 919549326 /nfs/dbraw/zinc/54/93/26/919549326.db2.gz OSTNIUAADSLFLA-RUZDIDTESA-N 0 3 424.483 4.271 20 0 HIADHN Fc1cccc([C@H](NCCc2nnnn2-c2ccccc2)c2cccc(Cl)c2)c1 ZINC000511010292 919572802 /nfs/dbraw/zinc/57/28/02/919572802.db2.gz JANYTJLIWZUWBF-JOCHJYFZSA-N 0 3 407.880 4.377 20 0 HIADHN COc1ccc([C@H](N[C@H]2CCN(C(=O)COc3ccccc3)C2)c2ccccc2)cc1 ZINC000511051158 919644951 /nfs/dbraw/zinc/64/49/51/919644951.db2.gz USVFMVWHDGMSEH-BKMJKUGQSA-N 0 3 416.521 4.054 20 0 HIADHN Cc1ccc(-n2ccnc2SCC(=O)N(CC(C)C)C2CCN(C)CC2)cc1C ZINC000511056719 919651836 /nfs/dbraw/zinc/65/18/36/919651836.db2.gz PJYSXVAAENFOLL-UHFFFAOYSA-N 0 3 414.619 4.160 20 0 HIADHN CCc1ccc([C@H](CNC(=O)Nc2ccccc2N2C[C@@H](C)O[C@@H](C)C2)N(C)C)cc1 ZINC000511085097 919686747 /nfs/dbraw/zinc/68/67/47/919686747.db2.gz IWOBMHFRBVQNML-GLDPYIMESA-N 0 3 424.589 4.287 20 0 HIADHN C[C@@H](C(=O)NC(c1ccccc1)c1ccccc1)N1CCN(CCC(C)(C)C)CC1 ZINC000511112749 919724234 /nfs/dbraw/zinc/72/42/34/919724234.db2.gz YKXKTURKQXSQPJ-NRFANRHFSA-N 0 3 407.602 4.335 20 0 HIADHN O=C(CCN(Cc1cccc(-c2cccnc2)c1)C1CC1)NCC(=O)c1ccccc1 ZINC000511150469 919770638 /nfs/dbraw/zinc/77/06/38/919770638.db2.gz OTEXGYURURMTSA-UHFFFAOYSA-N 0 3 413.521 4.102 20 0 HIADHN C[C@@H](NC(=O)N1CCCC[C@H]1c1nc(-c2cccc(F)c2)c[nH]1)C1=CCN(C)CC1 ZINC000511249866 919850602 /nfs/dbraw/zinc/85/06/02/919850602.db2.gz PYTCAOJGLKSKCY-IERDGZPVSA-N 0 3 411.525 4.103 20 0 HIADHN Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)NC(=O)N[C@@H](C)C1=CCN(C)CC1 ZINC000511271290 919868777 /nfs/dbraw/zinc/86/87/77/919868777.db2.gz VKSVDTIGVHYWGL-ZFWWWQNUSA-N 0 3 402.539 4.268 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)c1cc2c(cccc2Br)[nH]1 ZINC000511276890 919873349 /nfs/dbraw/zinc/87/33/49/919873349.db2.gz JTLPODUSYLUAMR-UHFFFAOYSA-N 0 3 412.331 4.109 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)N[C@H](C[C@@H]2CCOC2)c2ccccc2)CC1 ZINC000511363259 919956111 /nfs/dbraw/zinc/95/61/11/919956111.db2.gz NAJFQFFGIGROAY-WIOPSUGQSA-N 0 3 421.585 4.460 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)N[C@@H](C[C@H]1CCOC1)c1ccccc1 ZINC000511373123 919971009 /nfs/dbraw/zinc/97/10/09/919971009.db2.gz MTCBNAKHAYCMMF-FGCOXFRFSA-N 0 3 407.558 4.291 20 0 HIADHN CN1CCO[C@H]([C@H](NC[C@H](c2cccs2)N2CCCC2)c2ccc(Cl)cc2)C1 ZINC000511383533 919985524 /nfs/dbraw/zinc/98/55/24/919985524.db2.gz YFEQIJCLAJNZRK-RZUBCFFCSA-N 0 3 420.022 4.200 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N[C@H](C[C@@H]2CCOC2)c2ccccc2)N(C)C)cc1 ZINC000511382557 919985658 /nfs/dbraw/zinc/98/56/58/919985658.db2.gz LASQGGBWEFGUOB-ZTCOLXNVSA-N 0 3 409.574 4.319 20 0 HIADHN CN(C(=O)N[C@H](C[C@@H]1CCOC1)c1ccccc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000511398717 920011076 /nfs/dbraw/zinc/01/10/76/920011076.db2.gz NXRSXVCWFSSWCR-OEMFJLHTSA-N 0 3 407.558 4.070 20 0 HIADHN CC[C@H](NC(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F)c1nc2ccccc2[nH]1 ZINC000511493612 920104435 /nfs/dbraw/zinc/10/44/35/920104435.db2.gz MHSPBPFHWLBZQR-ROUUACIJSA-N 0 3 412.484 4.288 20 0 HIADHN Cc1nn(-c2ccc(Br)cc2)c(C)c1CN1CCC(c2cn[nH]c2)CC1 ZINC000511507016 920122998 /nfs/dbraw/zinc/12/29/98/920122998.db2.gz OZRFOKYUUXPWRF-UHFFFAOYSA-N 0 3 414.351 4.354 20 0 HIADHN COc1ccc(C[C@H](C)C(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)cc1OC ZINC000511530735 920151691 /nfs/dbraw/zinc/15/16/91/920151691.db2.gz FZHSHEXZZKFURS-SIKLNZKXSA-N 0 3 410.558 4.144 20 0 HIADHN Cc1c(C(=O)NCCCCN2CCN(c3ccccc3)CC2)cnn1C1CCCCC1 ZINC000511541642 920168299 /nfs/dbraw/zinc/16/82/99/920168299.db2.gz QBQUNLGZRLAIIW-UHFFFAOYSA-N 0 3 423.605 4.029 20 0 HIADHN CC[C@H](O)[C@H]1CCCCN1CC(=O)NC[C@H](c1c[nH]c2ccccc21)c1ccccc1 ZINC000511573979 920217431 /nfs/dbraw/zinc/21/74/31/920217431.db2.gz RMURPDOBDQDGHT-GPUOULLFSA-N 0 3 419.569 4.041 20 0 HIADHN O=C(CN[C@@H](c1cccc(OC(F)(F)F)c1)C1CC1)N1CCC[C@H](C(F)(F)F)C1 ZINC000511589224 920236456 /nfs/dbraw/zinc/23/64/56/920236456.db2.gz WUHGNPHJELWLSP-WMLDXEAASA-N 0 3 424.385 4.427 20 0 HIADHN Cn1nc(C(C)(C)C)cc1NC(=O)CN[C@H](c1cccc(OC(F)(F)F)c1)C1CC1 ZINC000511592170 920238570 /nfs/dbraw/zinc/23/85/70/920238570.db2.gz IQIRZYZIQWIYTB-IBGZPJMESA-N 0 3 424.467 4.296 20 0 HIADHN CN(Cc1ccc(OC(F)F)cc1)C[C@H](O)COc1ccc(C(F)(F)F)cc1 ZINC000511597911 920246476 /nfs/dbraw/zinc/24/64/76/920246476.db2.gz JRFGJMHSJMTQLU-HNNXBMFYSA-N 0 3 405.363 4.179 20 0 HIADHN CCCC[N@H+](C)CC1CCN(C(=O)Nc2ccc(-c3cc(=O)[n-]c(C)n3)cc2)CC1 ZINC000511619788 920273847 /nfs/dbraw/zinc/27/38/47/920273847.db2.gz DGTPFHRQNXGRBE-UHFFFAOYSA-N 0 3 411.550 4.133 20 0 HIADHN CCCC[N@@H+](C)CC1CCN(C(=O)Nc2ccc(-c3cc(=O)[n-]c(C)n3)cc2)CC1 ZINC000511619788 920273871 /nfs/dbraw/zinc/27/38/71/920273871.db2.gz DGTPFHRQNXGRBE-UHFFFAOYSA-N 0 3 411.550 4.133 20 0 HIADHN O=C1[C@H](N[C@H](c2cccc(OC(F)(F)F)c2)C2CC2)CCCN1CC(F)(F)F ZINC000511622756 920279220 /nfs/dbraw/zinc/27/92/20/920279220.db2.gz LIAYXUOKLHRADW-CABCVRRESA-N 0 3 410.358 4.179 20 0 HIADHN O=C(CN1C[C@H](c2ccccc2)[C@@H]2COCC[C@@H]21)Nc1ccc(C(F)(F)F)cc1 ZINC000511668344 920333286 /nfs/dbraw/zinc/33/32/86/920333286.db2.gz SZYLAABWJOPRAD-AABGKKOBSA-N 0 3 404.432 4.148 20 0 HIADHN Fc1ccccc1-c1nnc2ccc(N[C@H]3CCCN(Cc4ccccc4)C3)nn21 ZINC000511679960 920344291 /nfs/dbraw/zinc/34/42/91/920344291.db2.gz GITXHMPSKRNKLJ-SFHVURJKSA-N 0 3 402.477 4.007 20 0 HIADHN CN(C)[C@H]1Cc2ccccc2N(C(=O)c2cnn(-c3ccc(C(F)(F)F)cc3)c2)C1 ZINC000511711081 920377542 /nfs/dbraw/zinc/37/75/42/920377542.db2.gz FGHCYDLCDYXZIB-IBGZPJMESA-N 0 3 414.431 4.024 20 0 HIADHN O=C(CN1C[C@H](c2ccccc2)[C@H]2COCC[C@H]21)Nc1ccccc1C(F)(F)F ZINC000511757478 920439396 /nfs/dbraw/zinc/43/93/96/920439396.db2.gz PBKHXXDQPQKIJB-MBOZVWFJSA-N 0 3 404.432 4.148 20 0 HIADHN Fc1ccc([C@H]2CC[C@H](NCc3ncc(I)s3)C2)cc1 ZINC000511760179 920441413 /nfs/dbraw/zinc/44/14/13/920441413.db2.gz WBRZKMIHICOAOM-AAEUAGOBSA-N 0 3 402.276 4.313 20 0 HIADHN C[C@H](CC(=O)Nc1cc(C(F)(F)F)ccc1Cl)N[C@H](C)C(=O)N1CCCCC1 ZINC000511780461 920470584 /nfs/dbraw/zinc/47/05/84/920470584.db2.gz HXVKMKPLLGIPSG-CHWSQXEVSA-N 0 3 419.875 4.067 20 0 HIADHN OC[C@@H](CNCc1cscc1Br)Cc1cccc(Br)c1 ZINC000511785919 920479399 /nfs/dbraw/zinc/47/93/99/920479399.db2.gz LKLHOEGWYWIXHE-GFCCVEGCSA-N 0 3 419.182 4.214 20 0 HIADHN OC[C@H](CNCc1cscc1Br)Cc1ccc(Br)cc1 ZINC000511786910 920481480 /nfs/dbraw/zinc/48/14/80/920481480.db2.gz OJYZPMQIZQBLBV-LBPRGKRZSA-N 0 3 419.182 4.214 20 0 HIADHN CCN(C(=O)CN1C[C@H](c2ccccc2)[C@@H]2COCC[C@H]21)c1nc2ccccc2s1 ZINC000511795723 920489829 /nfs/dbraw/zinc/48/98/29/920489829.db2.gz XJJPAJOIAIKCLP-SVFBPWRDSA-N 0 3 421.566 4.154 20 0 HIADHN COc1ccc([C@H](NC(=O)CN2C[C@H](c3ccccc3)[C@@H]3COCC[C@H]32)C(C)C)cc1 ZINC000511795014 920489863 /nfs/dbraw/zinc/48/98/63/920489863.db2.gz HJQSLAZHDVVILS-OUJSJNLKSA-N 0 3 422.569 4.013 20 0 HIADHN Fc1ccc(-n2cc(CN3C[C@H](c4ccccc4)[C@H]4COCC[C@@H]43)nn2)cc1Cl ZINC000511798683 920492485 /nfs/dbraw/zinc/49/24/85/920492485.db2.gz XDXDSPATDHQSQE-KNKQGSTJSA-N 0 3 412.896 4.064 20 0 HIADHN CCSc1nnc(NC(=O)NC[C@@H](c2ccccc2)N2CCC(C)CC2)s1 ZINC000511808525 920504499 /nfs/dbraw/zinc/50/44/99/920504499.db2.gz PMXFTXOBFFVREQ-INIZCTEOSA-N 0 3 405.593 4.245 20 0 HIADHN CCN(c1ccc(C(=O)Nc2ccc(CCN3CCSCC3)cc2)cn1)C(C)C ZINC000512026245 920801009 /nfs/dbraw/zinc/80/10/09/920801009.db2.gz SFDKEPBYTCNZQK-UHFFFAOYSA-N 0 3 412.603 4.160 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@@H](C)c1cc(OC)c(OC)cc1F)c1ccsc1 ZINC000512040997 920812728 /nfs/dbraw/zinc/81/27/28/920812728.db2.gz KHLKRYBAXYDFDN-KBXCAEBGSA-N 0 3 423.554 4.348 20 0 HIADHN COc1ccccc1N1CC[C@@H](NCc2cnn(-c3ccc(C(F)(F)F)cc3)c2)C1 ZINC000512045232 920815392 /nfs/dbraw/zinc/81/53/92/920815392.db2.gz KXFDRDBSSAGMBW-GOSISDBHSA-N 0 3 416.447 4.268 20 0 HIADHN COc1ccc(CNCCc2nc(-c3cccc(Cl)c3)no2)c(Br)c1 ZINC000512059186 920828055 /nfs/dbraw/zinc/82/80/55/920828055.db2.gz RELGYACTUJEKOZ-UHFFFAOYSA-N 0 3 422.710 4.493 20 0 HIADHN CO[C@@H]1C[C@H](c2ccccc2)CC[C@H]1NC(=O)N(CCN(C)C)Cc1ccc(C)o1 ZINC000512065301 920832566 /nfs/dbraw/zinc/83/25/66/920832566.db2.gz XFLSVLQHJJUBSI-YMPZKCBVSA-N 0 3 413.562 4.013 20 0 HIADHN C[C@H](Cc1ccc(O)cc1)N[C@H](c1ccc(F)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000512117774 920870647 /nfs/dbraw/zinc/87/06/47/920870647.db2.gz ZVDASJRZCRVFSV-WAIKUNEKSA-N 0 3 413.514 4.245 20 0 HIADHN Cc1nn(-c2cccc(Cl)c2)c2sc(C(=O)N[C@@H](C)C3=CCN(C)CC3)cc12 ZINC000512134632 920881178 /nfs/dbraw/zinc/88/11/78/920881178.db2.gz YAWOYZSSCNSNKH-ZDUSSCGKSA-N 0 3 414.962 4.429 20 0 HIADHN CN(C)Cc1cnc(CNC[C@H](c2ccccc2)N2CCc3sccc3C2)s1 ZINC000512135360 920882823 /nfs/dbraw/zinc/88/28/23/920882823.db2.gz JAWPQHSLKZAFEU-HXUWFJFHSA-N 0 3 412.628 4.155 20 0 HIADHN CN(C)[C@H](CNC(=O)Cc1csc(Cc2cccc(Cl)c2)n1)c1ccccc1 ZINC000512143447 920887352 /nfs/dbraw/zinc/88/73/52/920887352.db2.gz RGZAOCAUGGJMFP-HXUWFJFHSA-N 0 3 413.974 4.349 20 0 HIADHN O=C(CN1CCC[C@]2(CC=CCC2)C1)NCc1cccc(COCc2ccco2)c1 ZINC000512156408 920895736 /nfs/dbraw/zinc/89/57/36/920895736.db2.gz ZJDOVMUIULEXEU-RUZDIDTESA-N 0 3 408.542 4.435 20 0 HIADHN Cc1cccc2sc(N(Cc3ccccc3)C(=O)CN[C@@H]3CSC[C@@H]3C)nc21 ZINC000512167307 920904428 /nfs/dbraw/zinc/90/44/28/920904428.db2.gz WWJYTIKLVVEMSI-FUHWJXTLSA-N 0 3 411.596 4.479 20 0 HIADHN C[C@@H]1CSC[C@@H]1NCC(=O)N1N=C(c2cc3ccccc3o2)C[C@@H]1c1ccco1 ZINC000512171842 920909347 /nfs/dbraw/zinc/90/93/47/920909347.db2.gz ZFFGVTHHSSGJAB-FHLIZLRMSA-N 0 3 409.511 4.045 20 0 HIADHN OCC[C@@H](NC[C@@H](O)COCc1ccc(Cl)cc1)c1ccc(Cl)c(Cl)c1 ZINC000512211211 920956640 /nfs/dbraw/zinc/95/66/40/920956640.db2.gz GTLZSBDZQCQTKJ-VQIMIIECSA-N 0 3 418.748 4.238 20 0 HIADHN COc1ccc(NC(=O)[C@@H](NCCc2ccc3c(c2)CCO3)c2ccccc2)cc1 ZINC000512232050 920983645 /nfs/dbraw/zinc/98/36/45/920983645.db2.gz AAXUMEBPAIPWQZ-DEOSSOPVSA-N 0 3 402.494 4.142 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)NCc1cccc(OCc2ccccc2)c1 ZINC000512245053 921002611 /nfs/dbraw/zinc/00/26/11/921002611.db2.gz RVOIPMALSAENNN-UHFFFAOYSA-N 0 3 407.514 4.132 20 0 HIADHN O=C(C1CCN(Cc2c[nH]nc2-c2ccc(F)cc2)CC1)N1CCc2ccccc21 ZINC000512276219 921031897 /nfs/dbraw/zinc/03/18/97/921031897.db2.gz KOEXQAUWLXMGFC-UHFFFAOYSA-N 0 3 404.489 4.017 20 0 HIADHN CN(C)Cc1ccc(C(=O)Nc2cc(-c3cc(F)cc(Br)c3)[nH]n2)cc1 ZINC000512315711 921066293 /nfs/dbraw/zinc/06/62/93/921066293.db2.gz KUYSTJPRSWFBRO-UHFFFAOYSA-N 0 3 417.282 4.292 20 0 HIADHN OCCCN(Cc1cn(Cc2ccccc2)nc1-c1cccnc1)Cc1ccccc1 ZINC000513450796 921816425 /nfs/dbraw/zinc/81/64/25/921816425.db2.gz MHDSKIVFKNIWPK-UHFFFAOYSA-N 0 3 412.537 4.378 20 0 HIADHN O[C@@H](Cn1c2ccccc2nc1NCc1ccccc1)CN1CCc2ccccc2C1 ZINC000513479104 921835337 /nfs/dbraw/zinc/83/53/37/921835337.db2.gz IHNMCHODYUREQC-HSZRJFAPSA-N 0 3 412.537 4.068 20 0 HIADHN O[C@@H](CN[C@@H](Cc1ccccn1)c1cccnc1)COc1cccc(Cl)c1Cl ZINC000513546439 921883887 /nfs/dbraw/zinc/88/38/87/921883887.db2.gz XWKPLYFSGBEMAP-HKUYNNGSSA-N 0 3 418.324 4.097 20 0 HIADHN CC(C)(C)n1ncc(C(=O)NC[C@H]2CCCN2Cc2ccccc2)c1C(F)(F)F ZINC000513586992 921918549 /nfs/dbraw/zinc/91/85/49/921918549.db2.gz SZLZYAXBBMTYAG-MRXNPFEDSA-N 0 3 408.468 4.051 20 0 HIADHN COc1ccccc1[C@@H]1CCN(C(=O)[C@@H]2CN(Cc3ccccc3)CCC2(F)F)C1 ZINC000513596001 921927070 /nfs/dbraw/zinc/92/70/70/921927070.db2.gz VNLXOZJBWZPHHM-CTNGQTDRSA-N 0 3 414.496 4.169 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(C)c1C(=O)NC[C@@H]1CCCN1Cc1ccccc1 ZINC000513597791 921929153 /nfs/dbraw/zinc/92/91/53/921929153.db2.gz MNJWGDGSZSZBNY-QFIPXVFZSA-N 0 3 406.505 4.023 20 0 HIADHN Cc1ccc([C@H](CNCc2cc(Br)ccc2F)N2CCOCC2)cc1 ZINC000513631742 921957819 /nfs/dbraw/zinc/95/78/19/921957819.db2.gz GRMIQOULLRDQSB-FQEVSTJZSA-N 0 3 407.327 4.060 20 0 HIADHN COc1ccc([C@@H](C)N[C@@H](C)c2ccc3c(c2)OCC(=O)N3)cc1Br ZINC000513667431 921989852 /nfs/dbraw/zinc/98/98/52/921989852.db2.gz ROIPFSWVXFPHEC-NEPJUHHUSA-N 0 3 405.292 4.200 20 0 HIADHN COc1ccc([C@@H](Cc2ccncc2)N[C@H]2CC(=O)N(c3c(F)cccc3F)C2)cc1 ZINC000513685007 922004865 /nfs/dbraw/zinc/00/48/65/922004865.db2.gz WCNDPUQVPPSQSF-PGRDOPGGSA-N 0 3 423.463 4.047 20 0 HIADHN C[C@@H](C(=O)N(C)Cc1ccccc1)N(C)CCCc1cc(-c2ccc(F)cc2)n(C)n1 ZINC000513702395 922022312 /nfs/dbraw/zinc/02/23/12/922022312.db2.gz IPYCUORXFNNVGZ-IBGZPJMESA-N 0 3 422.548 4.138 20 0 HIADHN COc1ccc(-c2nn(Cc3ccccc3)cc2CN2CCCO[C@@H](C)C2)cc1OC ZINC000513762080 922079543 /nfs/dbraw/zinc/07/95/43/922079543.db2.gz PWMTXJSWVMHWFL-IBGZPJMESA-N 0 3 421.541 4.226 20 0 HIADHN CC(C)CN(C(=O)Cc1c[nH]c2cccc(Br)c12)C1CCN(C)CC1 ZINC000513780219 922105644 /nfs/dbraw/zinc/10/56/44/922105644.db2.gz RZJWGSYNBJNMEG-UHFFFAOYSA-N 0 3 406.368 4.052 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)[C@H](NC(=O)c1ccc(Cl)s1)C(C)C ZINC000513830851 922158332 /nfs/dbraw/zinc/15/83/32/922158332.db2.gz FJBUZSSDJLFSOM-GOSISDBHSA-N 0 3 407.967 4.165 20 0 HIADHN COCCOc1ccc(CN[C@@H]2CCc3c2cccc3Br)cc1OC ZINC000513858857 922186127 /nfs/dbraw/zinc/18/61/27/922186127.db2.gz FEMIYSMIXQAHDQ-GOSISDBHSA-N 0 3 406.320 4.260 20 0 HIADHN CC(C)(C)c1nnc(NC(=O)N2CCCN(CCCc3ccccc3)CC2)s1 ZINC000513871355 922200198 /nfs/dbraw/zinc/20/01/98/922200198.db2.gz PJILQNAHMAPWEO-UHFFFAOYSA-N 0 3 401.580 4.008 20 0 HIADHN COc1cc(Cl)c(C(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)cc1OC ZINC000513946056 922264541 /nfs/dbraw/zinc/26/45/41/922264541.db2.gz GJVJNMUWSPGMHW-MRXNPFEDSA-N 0 3 402.922 4.094 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)C[C@@H](C)c1c(C)noc1C ZINC000513949157 922267256 /nfs/dbraw/zinc/26/72/56/922267256.db2.gz WJVFLEMJIWDSSY-IERDGZPVSA-N 0 3 421.545 4.376 20 0 HIADHN COc1ccc(OC)c([C@@H](C)NC(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)c1 ZINC000514069335 922394167 /nfs/dbraw/zinc/39/41/67/922394167.db2.gz ANAWYSGJDSHGRV-GCJKJVERSA-N 0 3 411.546 4.210 20 0 HIADHN COc1cc([C@H](C)NC(=O)NC[C@H](c2ccc(C)cc2)N(C)C)ccc1OC(C)C ZINC000514102238 922428274 /nfs/dbraw/zinc/42/82/74/922428274.db2.gz MQEAWLUQUGPLFF-GHTZIAJQSA-N 0 3 413.562 4.454 20 0 HIADHN CO[C@@H](C)c1nc(CN2CCCN(C[C@@H](OC)c3ccc(Cl)cc3)CC2)cs1 ZINC000514108072 922437210 /nfs/dbraw/zinc/43/72/10/922437210.db2.gz UUXRQWWQUXNRJS-OXJNMPFZSA-N 0 3 424.010 4.399 20 0 HIADHN CCCN(CC(=O)Nc1ccc(Cl)cc1)C[C@H]1CCN(C(=O)c2ccccc2)C1 ZINC000514107334 922437774 /nfs/dbraw/zinc/43/77/74/922437774.db2.gz KHUYNWBOQFEKIN-GOSISDBHSA-N 0 3 413.949 4.153 20 0 HIADHN CC(C)N(Cc1cccs1)C(=O)NCCCN1CCN(C)C[C@@H]1c1ccccc1 ZINC000514107185 922437960 /nfs/dbraw/zinc/43/79/60/922437960.db2.gz ICTAKXZLYYIUEQ-JOCHJYFZSA-N 0 3 414.619 4.047 20 0 HIADHN CCCOc1ccc([C@H](C)NC(=O)NC[C@H](c2ccc(C)cc2)N(C)C)cc1OC ZINC000514126762 922458821 /nfs/dbraw/zinc/45/88/21/922458821.db2.gz LUHYAVYJPISKIA-GHTZIAJQSA-N 0 3 413.562 4.456 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1)c1ccc(NC(=O)C2CC2)cc1 ZINC000514141071 922475075 /nfs/dbraw/zinc/47/50/75/922475075.db2.gz AVRMUYOCUOUYCV-IUKKYPGJSA-N 0 3 420.557 4.231 20 0 HIADHN C[C@@H](Cc1cccc(O)c1)NC(=O)NC[C@H](c1cccs1)N1CCC(C)CC1 ZINC000514182282 922521510 /nfs/dbraw/zinc/52/15/10/922521510.db2.gz JYHKFYWHUQQWFM-FXAWDEMLSA-N 0 3 401.576 4.157 20 0 HIADHN COc1ccc(OC)c([C@@H]2CCCN2C(=O)CN2CCC[C@H]2Cc2ccccc2C)c1 ZINC000514187653 922527248 /nfs/dbraw/zinc/52/72/48/922527248.db2.gz ZCAIDHWRQVADHS-URXFXBBRSA-N 0 3 422.569 4.383 20 0 HIADHN CC(C)[C@@H]1C[C@@H](CC(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)CCO1 ZINC000514194690 922534169 /nfs/dbraw/zinc/53/41/69/922534169.db2.gz KUTOUYWXJZQOHU-PXNSSMCTSA-N 0 3 414.512 4.437 20 0 HIADHN C[C@H](NC(=O)NC[C@@H](Cc1ccccc1)N(C)C)c1ccc(OCC(F)(F)F)cc1 ZINC000514202028 922539067 /nfs/dbraw/zinc/53/90/67/922539067.db2.gz QKWYSTGDBRMYSP-QFBILLFUSA-N 0 3 423.479 4.161 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NC[C@H]1CCN(c2ccc(F)cc2)C1)c1ccsc1 ZINC000514221617 922554950 /nfs/dbraw/zinc/55/49/50/922554950.db2.gz ISRDHXCULJECPQ-UTKZUKDTSA-N 0 3 418.582 4.096 20 0 HIADHN Cc1ccc([C@@H]2CCCN2CC(=O)N2CCC[C@H]2c2ccc3c(c2)OCCO3)cc1 ZINC000514235950 922574097 /nfs/dbraw/zinc/57/40/97/922574097.db2.gz LJMJIRACZXEETJ-VXKWHMMOSA-N 0 3 406.526 4.267 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCCc1nc2ccccc2n1CC)c1ccsc1 ZINC000514240298 922581009 /nfs/dbraw/zinc/58/10/09/922581009.db2.gz ACRIVRYROXQNNB-FQEVSTJZSA-N 0 3 413.591 4.043 20 0 HIADHN Cc1nc(C(C)C)sc1[C@@H](C)N(C)C(=O)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000514407092 922614255 /nfs/dbraw/zinc/61/42/55/922614255.db2.gz OCPOCCHISMXBPK-MJGOQNOKSA-N 0 3 400.592 4.402 20 0 HIADHN CC(=O)N1C[C@@H]2CCC[C@H](NCc3csc(Cc4ccc(Cl)cc4)n3)[C@@H]2C1 ZINC000514411497 922614530 /nfs/dbraw/zinc/61/45/30/922614530.db2.gz FKXHNSLQLIRYHH-DBVUQKKJSA-N 0 3 403.979 4.124 20 0 HIADHN CN(C)C[C@@H](NC(=O)c1ccc(-c2nc(C3CC3)no2)cc1)c1ccc(Cl)cc1 ZINC000514616328 922722794 /nfs/dbraw/zinc/72/27/94/922722794.db2.gz BBUTVSPGRWMGKS-LJQANCHMSA-N 0 3 410.905 4.300 20 0 HIADHN CN1CC[C@@H](NCC(=O)Nc2ccccc2Br)[C@@H]1c1ccc(Cl)cc1 ZINC000514693835 922760370 /nfs/dbraw/zinc/76/03/70/922760370.db2.gz ACZXLVHOIRIRCD-MJGOQNOKSA-N 0 3 422.754 4.076 20 0 HIADHN C[C@@H](N[C@@H]1c2ccccc2CC12CCOCC2)C(=O)Nc1ccc(-c2c[nH]cn2)cc1 ZINC000514694653 922762431 /nfs/dbraw/zinc/76/24/31/922762431.db2.gz GQRLGTADPPOHEW-UZUQRXQVSA-N 0 3 416.525 4.088 20 0 HIADHN COc1ccc([C@H](CNC(=O)CN(C)[C@@H](C)c2ccccc2)N2CCCCC2)cc1 ZINC000514745348 922778018 /nfs/dbraw/zinc/77/80/18/922778018.db2.gz NYCMKKATNWUKKA-RDPSFJRHSA-N 0 3 409.574 4.031 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)c1cccc(-n2ccc(C(F)(F)F)n2)c1)c1ccco1 ZINC000514750654 922782188 /nfs/dbraw/zinc/78/21/88/922782188.db2.gz ZURUBKYQOWRNGI-WMLDXEAASA-N 0 3 420.435 4.343 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)c1ccc(C)c(NC(=O)NC(C)(C)C)c1)c1ccco1 ZINC000514962440 922855057 /nfs/dbraw/zinc/85/50/57/922855057.db2.gz HJAPBVFYXAONKX-VQIMIIECSA-N 0 3 414.550 4.367 20 0 HIADHN CCOc1ccccc1NC(=O)[C@H](C)N[C@H]1CCN(C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000514976639 922862505 /nfs/dbraw/zinc/86/25/05/922862505.db2.gz WJDZEBWUXSOODW-ONTRVFCTSA-N 0 3 419.928 4.240 20 0 HIADHN O=C(Nc1ncc(Cc2cccc(F)c2)s1)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000515100911 922912704 /nfs/dbraw/zinc/91/27/04/922912704.db2.gz LLZCVHYVSXFJLY-IBGZPJMESA-N 0 3 410.518 4.269 20 0 HIADHN CCOc1cc(C[NH2+]C[C@H]2CCN(c3ccc(F)cc3)C2)cc(Br)c1[O-] ZINC000515147262 922950442 /nfs/dbraw/zinc/95/04/42/922950442.db2.gz BWFKBMHAZQAIDV-CQSZACIVSA-N 0 3 423.326 4.309 20 0 HIADHN Cc1c(C(=O)N[C@@H](CN2CCCC2)c2ccccc2)cnn1-c1ccc(F)cc1F ZINC000515206565 922992145 /nfs/dbraw/zinc/99/21/45/922992145.db2.gz KVTRNMRCAOZYEF-NRFANRHFSA-N 0 3 410.468 4.026 20 0 HIADHN CC(=O)N1C[C@@H]2CCC[C@H](N[C@H](C)c3nnc(-c4ccc(Cl)c(Cl)c4)o3)[C@@H]2C1 ZINC000515249783 923017009 /nfs/dbraw/zinc/01/70/09/923017009.db2.gz NFQPTIKCMCFHNL-OPNLHGRLSA-N 0 3 423.344 4.341 20 0 HIADHN CCN(CC)[C@H](CNC(=O)C(=O)Nc1ccc(Cl)c(Cl)c1)c1ccccc1 ZINC000515266549 923027025 /nfs/dbraw/zinc/02/70/25/923027025.db2.gz QHWJYHHENOPGEK-GOSISDBHSA-N 0 3 408.329 4.131 20 0 HIADHN COc1ccc([C@@H](CNC(=O)NCCN2CCCCC2)c2c[nH]c3ccccc32)cc1 ZINC000515289727 923038092 /nfs/dbraw/zinc/03/80/92/923038092.db2.gz IUKHZFJQZGDMDB-JOCHJYFZSA-N 0 3 420.557 4.094 20 0 HIADHN COc1ccc([C@H](CNc2nc(C)nc3sc4c(c32)CCC4)N(C)C)cc1OC ZINC000515334223 923057681 /nfs/dbraw/zinc/05/76/81/923057681.db2.gz ZEGIURXXGWEIRU-INIZCTEOSA-N 0 3 412.559 4.220 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)N1CC[C@@](F)(c2ccccc2)C1 ZINC000515436537 923099610 /nfs/dbraw/zinc/09/96/10/923099610.db2.gz QLJJYBFQQOFUFQ-QHCPKHFHSA-N 0 3 413.562 4.381 20 0 HIADHN CN(C(=O)NCCCN1CCN(C)C[C@@H]1c1ccccc1)[C@H]1CCCc2ccccc21 ZINC000515465591 923119686 /nfs/dbraw/zinc/11/96/86/923119686.db2.gz VGBQTQBRRLMEIY-LOSJGSFVSA-N 0 3 420.601 4.084 20 0 HIADHN CCN(CC(=O)Nc1ccccc1C)C1CCN(c2cc(C)nc(C(C)C)n2)CC1 ZINC000515561639 923179490 /nfs/dbraw/zinc/17/94/90/923179490.db2.gz JRLAPNBSQXQTNK-UHFFFAOYSA-N 0 3 409.578 4.146 20 0 HIADHN Cc1ccc([C@H](C)N[C@H](C)C(=O)Nc2ccc(I)cc2)cc1 ZINC000515715980 923297452 /nfs/dbraw/zinc/29/74/52/923297452.db2.gz ZGRRHOOXZMFBEL-UONOGXRCSA-N 0 3 408.283 4.277 20 0 HIADHN COc1cccc([C@H](C)N[C@H](C)C(=O)N(C)Cc2ccc(Br)cc2)c1 ZINC000515736651 923313119 /nfs/dbraw/zinc/31/31/19/923313119.db2.gz OGQAKBNILFCXAU-LSDHHAIUSA-N 0 3 405.336 4.155 20 0 HIADHN CSc1ccc(NC(=O)[C@H](C)N[C@H](C)c2ccc(NC(=O)NC3CC3)cc2)cc1 ZINC000515756241 923329764 /nfs/dbraw/zinc/32/97/64/923329764.db2.gz SNSVAFKDKZFROX-CABCVRRESA-N 0 3 412.559 4.370 20 0 HIADHN CC(C)c1ccccc1NC(=O)[C@H](C)N[C@H](C)c1ccc(OCC(=O)NC2CC2)cc1 ZINC000515759580 923333348 /nfs/dbraw/zinc/33/33/48/923333348.db2.gz PXYWGZNRODSSJR-MSOLQXFVSA-N 0 3 423.557 4.145 20 0 HIADHN COc1cccc([C@H](CNC(=O)N[C@@H](C)c2c(F)cccc2F)N2CCCC2)c1 ZINC000515821057 923373019 /nfs/dbraw/zinc/37/30/19/923373019.db2.gz HPEYMZPNZUBMHM-YWZLYKJASA-N 0 3 403.473 4.171 20 0 HIADHN C[C@@H](NC(=O)NC[C@@H](c1ccccc1)N(C)C)c1cccc(OCc2ccccn2)c1 ZINC000515854701 923395253 /nfs/dbraw/zinc/39/52/53/923395253.db2.gz CDAPSBVLVDAABU-DVECYGJZSA-N 0 3 418.541 4.324 20 0 HIADHN COc1ccc(CNC(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)c(OC)c1 ZINC000515916552 923434482 /nfs/dbraw/zinc/43/44/82/923434482.db2.gz AGEBVPBLYDXPTJ-LJQANCHMSA-N 0 3 417.575 4.038 20 0 HIADHN COC(=O)c1c(F)ccc(NC(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)c1C ZINC000515925278 923439144 /nfs/dbraw/zinc/43/91/44/923439144.db2.gz QZQRRJXCYZSFCA-SFHVURJKSA-N 0 3 413.493 4.049 20 0 HIADHN Cc1cccc(C2(CNC(=O)C(=O)Nc3cccc(CN(C)C)c3)CCCCC2)c1 ZINC000516042731 923517158 /nfs/dbraw/zinc/51/71/58/923517158.db2.gz GBZTWTVLSBHKEV-UHFFFAOYSA-N 0 3 407.558 4.013 20 0 HIADHN CO[C@H](CNC(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1)c1ccccc1 ZINC000516150694 923577377 /nfs/dbraw/zinc/57/73/77/923577377.db2.gz TUAXTLHRXQLRNN-VQTJNVASSA-N 0 3 401.576 4.208 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)NCc2ccnc(OC3CCCC3)c2)C1 ZINC000516163826 923582478 /nfs/dbraw/zinc/58/24/78/923582478.db2.gz ZFMXPJQDNOGMIU-NQIIRXRSSA-N 0 3 408.546 4.038 20 0 HIADHN CCS(=O)(=O)c1ccc([C@H](C)N[C@H](C)CC(=O)Nc2cccc(Cl)c2)cc1 ZINC000516199494 923595094 /nfs/dbraw/zinc/59/50/94/923595094.db2.gz IVKAWJWNPVPTFL-CABCVRRESA-N 0 3 408.951 4.202 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)c2cc(Cl)c3c(c2)OCCCO3)C1 ZINC000516204881 923598206 /nfs/dbraw/zinc/59/82/06/923598206.db2.gz JYQRCZKYDQLDSH-MAUKXSAKSA-N 0 3 400.906 4.067 20 0 HIADHN Cc1ccc2nc(CNC3CCN(Cc4coc(-c5ccccc5)n4)CC3)cn2c1 ZINC000516266028 923636391 /nfs/dbraw/zinc/63/63/91/923636391.db2.gz FSJDVNDUXWLJLX-UHFFFAOYSA-N 0 3 401.514 4.052 20 0 HIADHN CCc1nc2ccccc2n1C1CCN(Cc2ccc(-n3cncn3)c(F)c2)CC1 ZINC000516347584 923680037 /nfs/dbraw/zinc/68/00/37/923680037.db2.gz CQDSRVNMWTZXBG-UHFFFAOYSA-N 0 3 404.493 4.156 20 0 HIADHN CN(CCNC(=O)c1[nH]c2ccc(Br)cc2c1Cl)Cc1ccccc1 ZINC000516623169 923820593 /nfs/dbraw/zinc/82/05/93/923820593.db2.gz OGYQUEYNVIPCKL-UHFFFAOYSA-N 0 3 420.738 4.446 20 0 HIADHN C[C@H](CN1C[C@H](C)C[C@H](C)C1)NC(=O)N1CCC(C(=O)c2ccc(Cl)cc2)CC1 ZINC000516683802 923844391 /nfs/dbraw/zinc/84/43/91/923844391.db2.gz SNYZKHWEIXKWJG-FGTMMUONSA-N 0 3 419.997 4.311 20 0 HIADHN CCCN(CC(=O)Nc1cccc(N2CCCC2=O)c1)[C@H]1CCc2ccccc2C1 ZINC000516737474 923868852 /nfs/dbraw/zinc/86/88/52/923868852.db2.gz CFDPWOICJLTXSE-QFIPXVFZSA-N 0 3 405.542 4.021 20 0 HIADHN CCCN(CC(=O)Nc1cccc(N2CCCC2=O)c1)[C@@H]1CCc2ccccc2C1 ZINC000516737473 923869087 /nfs/dbraw/zinc/86/90/87/923869087.db2.gz CFDPWOICJLTXSE-JOCHJYFZSA-N 0 3 405.542 4.021 20 0 HIADHN C[C@@H](NC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1)c1ccc(NC(=O)C2CC2)cc1 ZINC000516769758 923881787 /nfs/dbraw/zinc/88/17/87/923881787.db2.gz NHSKVSBZISYJED-DYESRHJHSA-N 0 3 423.532 4.264 20 0 HIADHN Cc1nc(-c2ccccc2)oc1C(=O)NC[C@@H](c1ccc(OC(C)C)cc1)N(C)C ZINC000516888592 923927143 /nfs/dbraw/zinc/92/71/43/923927143.db2.gz ZLWFAUCWNRPIGD-NRFANRHFSA-N 0 3 407.514 4.470 20 0 HIADHN CC1CCN([C@H](CNC(=O)Nc2ccccc2N2CCCC2=O)c2ccccc2)CC1 ZINC000517315316 924097831 /nfs/dbraw/zinc/09/78/31/924097831.db2.gz LIIZVXKPCKPZEA-HSZRJFAPSA-N 0 3 420.557 4.408 20 0 HIADHN O=C(CN1CCC[C@@H](Cc2ccccc2)C1)N1CCC[C@@H]1c1ccc2c(c1)OCCO2 ZINC000517324702 924103502 /nfs/dbraw/zinc/10/35/02/924103502.db2.gz ZGCLHUNDAORIMH-JTHBVZDNSA-N 0 3 420.553 4.076 20 0 HIADHN Cc1noc(C[C@H](NC[C@H](O)CO[C@H](C)c2ccc(Cl)cc2)c2ccccc2)n1 ZINC000517476552 924217684 /nfs/dbraw/zinc/21/76/84/924217684.db2.gz DQNPCIHXQSBDNX-NQERJWCQSA-N 0 3 415.921 4.044 20 0 HIADHN O=C(NC1(c2ccc3c(c2)OCCO3)CCCC1)c1cccc(CN2CCCC2)c1 ZINC000517478381 924219053 /nfs/dbraw/zinc/21/90/53/924219053.db2.gz DLQNBMWHNOBCCR-UHFFFAOYSA-N 0 3 406.526 4.253 20 0 HIADHN COc1c(Cl)cc(Cl)cc1CNC[C@@H](c1cccs1)N1CCN(C)CC1 ZINC000517524943 924245869 /nfs/dbraw/zinc/24/58/69/924245869.db2.gz BSRDYJPSFLSWGO-KRWDZBQOSA-N 0 3 414.402 4.142 20 0 HIADHN COc1cccc(COc2cccc(Cl)c2CNCC2CCN(C(C)=O)CC2)c1 ZINC000517546065 924257466 /nfs/dbraw/zinc/25/74/66/924257466.db2.gz PDHGSVLAFXOMAE-UHFFFAOYSA-N 0 3 416.949 4.276 20 0 HIADHN Brc1ccc(C2(NCc3cnc(N4CCCC4)nc3)CCCC2)cc1 ZINC000517565983 926683862 /nfs/dbraw/zinc/68/38/62/926683862.db2.gz LOCGBWRECNXZQV-UHFFFAOYSA-N 0 3 401.352 4.398 20 0 HIADHN COCCn1ccc2ccc(NC(=O)N[C@H]3CCN(Cc4ccccc4)[C@H]3C)cc21 ZINC000517620417 926729411 /nfs/dbraw/zinc/72/94/11/926729411.db2.gz XKYCMWUEHFYNSC-AVRDEDQJSA-N 0 3 406.530 4.072 20 0 HIADHN Cc1cc(-c2cc(C(=O)N(C)[C@H]3CCN(C4CC4)C3)c3c(C)noc3n2)c(C)s1 ZINC000517648665 926755826 /nfs/dbraw/zinc/75/58/26/926755826.db2.gz PUBXRUQWZXXWRG-INIZCTEOSA-N 0 3 410.543 4.185 20 0 HIADHN C[C@H](CNC(=O)NCc1ccc(Oc2cccc(F)c2)nc1)N(C)Cc1ccccc1 ZINC000517704836 926804055 /nfs/dbraw/zinc/80/40/55/926804055.db2.gz BTBJNFRYIQTNEM-GOSISDBHSA-N 0 3 422.504 4.333 20 0 HIADHN CCC[C@H](NC(=O)NCCCCN1CCN(C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000517773675 926830827 /nfs/dbraw/zinc/83/08/27/926830827.db2.gz UOJJPTXTRNMFPV-IBGZPJMESA-N 0 3 415.409 4.161 20 0 HIADHN O=C(NC[C@H]1CCCO[C@@H]1c1ccccc1)N1CCCN(Cc2ccccc2)CC1 ZINC000517804986 926844099 /nfs/dbraw/zinc/84/40/99/926844099.db2.gz USJYEPAJVOQGOX-DNQXCXABSA-N 0 3 407.558 4.072 20 0 HIADHN C[C@@H](CN1CCC[C@@H](C)C1)NC(=O)C(=O)Nc1ccccc1Sc1ccccc1 ZINC000517816298 926849988 /nfs/dbraw/zinc/84/99/88/926849988.db2.gz WNZNMQPUVLCNKN-MSOLQXFVSA-N 0 3 411.571 4.013 20 0 HIADHN COc1ccccc1CCN(C)C(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000517857858 926865916 /nfs/dbraw/zinc/86/59/16/926865916.db2.gz OLCQOGQFIBFBHP-QFIPXVFZSA-N 0 3 420.475 4.151 20 0 HIADHN CN(C)CCN(CC1CCCCC1)C(=O)c1nn(-c2ccc(F)cc2)c2c1CCC2 ZINC000517894513 926879503 /nfs/dbraw/zinc/87/95/03/926879503.db2.gz JITIHVWBFVOFIT-UHFFFAOYSA-N 0 3 412.553 4.084 20 0 HIADHN COCc1cccc2sc(NC(=O)N[C@@H](CN3CCCC3)c3ccccc3)nc21 ZINC000517905513 926884217 /nfs/dbraw/zinc/88/42/17/926884217.db2.gz HFGUDMKXSGULMO-SFHVURJKSA-N 0 3 410.543 4.401 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)Cc2coc(-c3ccc(Cl)cc3)n2)CC1 ZINC000517926532 926892812 /nfs/dbraw/zinc/89/28/12/926892812.db2.gz DCQFVOPQSQBEBH-UHFFFAOYSA-N 0 3 413.905 4.254 20 0 HIADHN CC(C)Sc1ccc(Cl)cc1NC(=O)C(=O)NC[C@H](C)N1CCC[C@H](C)C1 ZINC000517951611 926900705 /nfs/dbraw/zinc/90/07/05/926900705.db2.gz YPNFWLRFPJPEBS-GJZGRUSLSA-N 0 3 411.999 4.016 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)NC[C@H]1CCCO[C@H]1C(C)(C)C ZINC000518002921 926942463 /nfs/dbraw/zinc/94/24/63/926942463.db2.gz QFOFXKFSUDAMRQ-FGZHOGPDSA-N 0 3 403.611 4.034 20 0 HIADHN Cc1cc(NC(=O)c2ccco2)sc1C(=O)N[C@H](C)CN(C)Cc1ccccc1 ZINC000518152555 927049823 /nfs/dbraw/zinc/04/98/23/927049823.db2.gz OSCMRWCEOXMXJG-MRXNPFEDSA-N 0 3 411.527 4.152 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)Nc2ccc(C)c(C(=O)NC(C)C)c2)c1 ZINC000518221173 927087687 /nfs/dbraw/zinc/08/76/87/927087687.db2.gz UDVUEANVEDQLQE-UHFFFAOYSA-N 0 3 410.562 4.037 20 0 HIADHN Cc1cc(NC(=O)NC[C@H](c2ccccc2)N2CCCC2)ccc1C(=O)NC(C)C ZINC000518223038 927089160 /nfs/dbraw/zinc/08/91/60/927089160.db2.gz LHGUWZWTJDXFQU-JOCHJYFZSA-N 0 3 408.546 4.092 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)c1ccnc(Oc2ccccc2)c1 ZINC000518316576 927180606 /nfs/dbraw/zinc/18/06/06/927180606.db2.gz NQMBMZBJJGYBOQ-JOCHJYFZSA-N 0 3 416.525 4.396 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)CCC(=O)c1ccc2c(c1)CCC2 ZINC000518318600 927182288 /nfs/dbraw/zinc/18/22/88/927182288.db2.gz NAUQWUHVBZSSDI-DEOSSOPVSA-N 0 3 419.569 4.046 20 0 HIADHN COc1ccc(OC(C)C)c(NC(=O)CCCN2CCN(c3ccccc3)CC2)c1 ZINC000518362024 927221275 /nfs/dbraw/zinc/22/12/75/927221275.db2.gz QFSNFYASLCTVTD-UHFFFAOYSA-N 0 3 411.546 4.023 20 0 HIADHN CC(C)[C@H](CNC(=O)c1ccc2[nH]c(C(F)F)nc2c1)N1CCc2ccccc2C1 ZINC000518392817 927238386 /nfs/dbraw/zinc/23/83/86/927238386.db2.gz YIJYYQCASLFNRR-FQEVSTJZSA-N 0 3 412.484 4.313 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N(C)Cc2ccccc2Br)C1 ZINC000518403355 927244195 /nfs/dbraw/zinc/24/41/95/927244195.db2.gz KAWZDYUXOGBMSJ-APWZRJJASA-N 0 3 416.363 4.426 20 0 HIADHN COc1cc(C(=O)N(C)[C@@H]2CN3CCC2CC3)ccc1OCc1ccc(Cl)cc1 ZINC000518434890 927268626 /nfs/dbraw/zinc/26/86/26/927268626.db2.gz URZOAECYOZHSCC-HXUWFJFHSA-N 0 3 414.933 4.094 20 0 HIADHN CCCOc1c(Br)cc(Br)cc1CNC[C@](C)(O)CC ZINC000518453110 927285471 /nfs/dbraw/zinc/28/54/71/927285471.db2.gz XGVMFEXNWSZTNU-OAHLLOKOSA-N 0 3 409.162 4.251 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)Nc2cc(-c3nc(C)no3)ccc2C)N(C)C)cc1 ZINC000518459357 927289634 /nfs/dbraw/zinc/28/96/34/927289634.db2.gz WPWIRQNQPRCYPA-OAQYLSRUSA-N 0 3 407.518 4.340 20 0 HIADHN CN(C(=O)Nc1ccc(Br)cc1)C1CCN(CCc2ccccn2)CC1 ZINC000518487331 927302976 /nfs/dbraw/zinc/30/29/76/927302976.db2.gz RDKSEEWXTQJYCJ-UHFFFAOYSA-N 0 3 417.351 4.015 20 0 HIADHN CC[C@H](Oc1ccccc1C(C)C)C(=O)NCc1ccc(CN2CCN(C)CC2)cc1 ZINC000518508807 927315956 /nfs/dbraw/zinc/31/59/56/927315956.db2.gz DLLWNXYSIMPHQY-DEOSSOPVSA-N 0 3 423.601 4.031 20 0 HIADHN COc1cccc(OC)c1OC[C@H](O)CN(C)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000518512213 927318692 /nfs/dbraw/zinc/31/86/92/927318692.db2.gz MQBIMOUKHXLAJO-WMLDXEAASA-N 0 3 413.436 4.155 20 0 HIADHN O=C(NCc1ccc(Br)cc1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000518577358 927357664 /nfs/dbraw/zinc/35/76/64/927357664.db2.gz UQAYGXFAHCSJET-QGZVFWFLSA-N 0 3 405.311 4.117 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N2CCC(OC3CCC(C)CC3)CC2)N(C)C)cc1 ZINC000518666161 927417984 /nfs/dbraw/zinc/41/79/84/927417984.db2.gz ZZKNMDLFLPFBFK-IRSIHTCSSA-N 0 3 401.595 4.367 20 0 HIADHN CCC(=O)Nc1cccc(CNCC2=Cc3cc(Br)ccc3OC2)c1 ZINC000518761223 927481906 /nfs/dbraw/zinc/48/19/06/927481906.db2.gz DSMIGROQLDSKPT-UHFFFAOYSA-N 0 3 401.304 4.363 20 0 HIADHN C[C@@H](CC(=O)Nc1cccc(N2CCCC2)c1)NCc1cnc(-c2ccccc2)nc1 ZINC000518783418 927490606 /nfs/dbraw/zinc/49/06/06/927490606.db2.gz LWAMKNTXYCWKRT-IBGZPJMESA-N 0 3 415.541 4.251 20 0 HIADHN CC(C)c1c(C(=O)NC[C@H](C)N(C)Cc2ccccc2)cnn1-c1ccc(F)cc1 ZINC000518908357 927619047 /nfs/dbraw/zinc/61/90/47/927619047.db2.gz YUVQPPHNRRXDOT-SFHVURJKSA-N 0 3 408.521 4.385 20 0 HIADHN COCCN1CCC[C@@H]1CNC(=O)Nc1ccc(Sc2nc(C)cs2)cc1C ZINC000518912880 927621811 /nfs/dbraw/zinc/62/18/11/927621811.db2.gz HUTQOEJIPYNSBH-MRXNPFEDSA-N 0 3 420.604 4.143 20 0 HIADHN COc1ccc(OCc2nc(CN[C@H]3CCN(Cc4ccccc4)[C@H]3C)cs2)cc1 ZINC000519025443 927702179 /nfs/dbraw/zinc/70/21/79/927702179.db2.gz RXBINAYUTHTOJV-MBSDFSHPSA-N 0 3 423.582 4.483 20 0 HIADHN COc1ccc2c(c1)CCCN(C(=O)NC[C@H](c1ccc(C)cc1)N1CCCC1)C2 ZINC000519031303 927707135 /nfs/dbraw/zinc/70/71/35/927707135.db2.gz XIKMHKHJIZWLNY-XMMPIXPASA-N 0 3 407.558 4.299 20 0 HIADHN CC(C)[C@H](C(=O)Nc1ccc(CC(=O)Nc2ccccc2F)cc1)N1CCCCC1 ZINC000519142474 927803187 /nfs/dbraw/zinc/80/31/87/927803187.db2.gz REWJNVHPSULTCA-HSZRJFAPSA-N 0 3 411.521 4.456 20 0 HIADHN CCN1CCCC[C@@H]1C(=O)NCc1cn(Cc2ccccc2)nc1-c1ccccc1 ZINC000519164016 927808148 /nfs/dbraw/zinc/80/81/48/927808148.db2.gz ZEOYZBRLDSPINB-HSZRJFAPSA-N 0 3 402.542 4.089 20 0 HIADHN Cc1ccc(-c2ncc(CN3CCC[C@@H](CNC(=O)CC(F)(F)F)C3)s2)cc1 ZINC000519230577 927837489 /nfs/dbraw/zinc/83/74/89/927837489.db2.gz PFOWIAQBWKFEOV-HNNXBMFYSA-N 0 3 411.493 4.399 20 0 HIADHN CN(CCNC(=O)c1ccn(-c2ccc(Cl)c(Cl)c2)n1)Cc1ccccc1 ZINC000519298470 927870266 /nfs/dbraw/zinc/87/02/66/927870266.db2.gz RFTXQEVFTDKXQR-UHFFFAOYSA-N 0 3 403.313 4.041 20 0 HIADHN C[C@H]1CCC[C@H](C)N1CCNC(=O)C(=O)Nc1ccccc1Sc1ccccc1 ZINC000519390114 927916821 /nfs/dbraw/zinc/91/68/21/927916821.db2.gz VQGGGFZPMUJWLM-ROUUACIJSA-N 0 3 411.571 4.155 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000519410619 927929620 /nfs/dbraw/zinc/92/96/20/927929620.db2.gz HUFBMMRGAQRCIC-UHFFFAOYSA-N 0 3 412.824 4.122 20 0 HIADHN CC(=O)c1ccc(-c2ccc(C(=O)N(CCN(C)C)Cc3cccc(F)c3)o2)cc1 ZINC000519413604 927932588 /nfs/dbraw/zinc/93/25/88/927932588.db2.gz OTZUTUVGSBVSEO-UHFFFAOYSA-N 0 3 408.473 4.492 20 0 HIADHN C[C@H]1C[C@@H]1C(=O)Nc1cccc(C(=O)N(CCN(C)C)Cc2cccc(Cl)c2)c1 ZINC000519418201 927934543 /nfs/dbraw/zinc/93/45/43/927934543.db2.gz JLRJKFYOWAOAEB-KKSFZXQISA-N 0 3 413.949 4.139 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)c1cccc(NC(=O)c2ccc(F)cc2)c1 ZINC000519417522 927934929 /nfs/dbraw/zinc/93/49/29/927934929.db2.gz IRMZGJZGXQLJOR-UHFFFAOYSA-N 0 3 419.500 4.282 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)NC[C@@H]1CCCO[C@H]1c1ccccc1 ZINC000519453044 927960893 /nfs/dbraw/zinc/96/08/93/927960893.db2.gz UYCOABKDSZLZRR-GMAHTHKFSA-N 0 3 413.537 4.067 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)NC[C@H]1CCCO[C@H]1c1ccccc1 ZINC000519453043 927960939 /nfs/dbraw/zinc/96/09/39/927960939.db2.gz UYCOABKDSZLZRR-GGAORHGYSA-N 0 3 413.537 4.067 20 0 HIADHN COc1cc(NC(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)c(OC)c(C)c1OC ZINC000519558296 928013986 /nfs/dbraw/zinc/01/39/86/928013986.db2.gz RNUFVNLYZFINJJ-KRWDZBQOSA-N 0 3 421.925 4.099 20 0 HIADHN COc1cc(NC(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)c(OC)c(C)c1OC ZINC000519558373 928014759 /nfs/dbraw/zinc/01/47/59/928014759.db2.gz RNUFVNLYZFINJJ-QGZVFWFLSA-N 0 3 421.925 4.099 20 0 HIADHN Cc1onc(-c2ccncc2)c1C(=O)NC[C@H](c1ccc(CC(C)C)cc1)N(C)C ZINC000519721619 928057023 /nfs/dbraw/zinc/05/70/23/928057023.db2.gz FTXIMXLZSBOZMA-OAQYLSRUSA-N 0 3 406.530 4.276 20 0 HIADHN CCOc1ccc([C@H](C)NC(=O)N(CCN(C)C)CC2CCCCC2)cc1OC ZINC000519723798 928058557 /nfs/dbraw/zinc/05/85/57/928058557.db2.gz NGONTDOZMLFJRK-SFHVURJKSA-N 0 3 405.583 4.308 20 0 HIADHN CCc1nn(-c2ccccc2)c(CC)c1CN[C@@H](C)c1cccc(-n2ccnn2)c1 ZINC000519809714 928084716 /nfs/dbraw/zinc/08/47/16/928084716.db2.gz DOTFFNBBYNYMAH-SFHVURJKSA-N 0 3 400.530 4.429 20 0 HIADHN Cc1cccc(C)c1NC(=O)CN[C@H]1CCN(C(C)C)[C@@H]1c1ccc(F)c(F)c1 ZINC000519835286 928086968 /nfs/dbraw/zinc/08/69/68/928086968.db2.gz FVVZZQLSAUFTKJ-NZQKXSOJSA-N 0 3 401.501 4.334 20 0 HIADHN O=C(Nc1nc2c(s1)CCCC2)Nc1ccc(CCN2CCSCC2)cc1 ZINC000519931009 928165400 /nfs/dbraw/zinc/16/54/00/928165400.db2.gz RTYXRJPIOPGXCQ-UHFFFAOYSA-N 0 3 402.589 4.257 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCc1nccs1)c1ccc(C(F)(F)F)cc1 ZINC000519949851 928183103 /nfs/dbraw/zinc/18/31/03/928183103.db2.gz MCXZUNMSTOQSIV-HNNXBMFYSA-N 0 3 400.470 4.044 20 0 HIADHN COc1cccc(OC)c1OC1CCN(CCC(=O)Nc2ccccc2Cl)CC1 ZINC000520042769 928267275 /nfs/dbraw/zinc/26/72/75/928267275.db2.gz DHJMXHYQYTWJAA-UHFFFAOYSA-N 0 3 418.921 4.229 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N2CCC(Oc3ccc(F)cc3F)CC2)N(C)C)cc1 ZINC000520068323 928291157 /nfs/dbraw/zinc/29/11/57/928291157.db2.gz METSFVLOGAKUSF-OAQYLSRUSA-N 0 3 417.500 4.129 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)N[C@H](C)Cc2cccc(Br)c2)o1 ZINC000520085980 928300850 /nfs/dbraw/zinc/30/08/50/928300850.db2.gz NCMLKLVEXYJSFG-OAHLLOKOSA-N 0 3 422.367 4.055 20 0 HIADHN O=C(N[C@H](c1ccccc1)c1ccccn1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000520093692 928306188 /nfs/dbraw/zinc/30/61/88/928306188.db2.gz KYXLTEKXVIVIMU-ZJSXRUAMSA-N 0 3 403.501 4.339 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)N[C@H](c1ccco1)c1ccccc1 ZINC000520127698 928325578 /nfs/dbraw/zinc/32/55/78/928325578.db2.gz VSQHDUBEGDPCSD-QFIPXVFZSA-N 0 3 413.468 4.421 20 0 HIADHN CCN(Cc1ccc(C)cc1)C(=O)NCCCCN1CCN(Cc2ccccc2)CC1 ZINC000520160176 928353117 /nfs/dbraw/zinc/35/31/17/928353117.db2.gz BSSXFZUZZLUNOR-UHFFFAOYSA-N 0 3 422.617 4.125 20 0 HIADHN CC[C@H](c1ccccc1)N(CC)CC(=O)N1CCC(C(=O)N2CCCCCC2)CC1 ZINC000520174405 928363955 /nfs/dbraw/zinc/36/39/55/928363955.db2.gz IEWSZEBXNKFWHI-HSZRJFAPSA-N 0 3 413.606 4.101 20 0 HIADHN CCN(C(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1)[C@H](C)Cc1ccc(OC)cc1 ZINC000520196966 928381967 /nfs/dbraw/zinc/38/19/67/928381967.db2.gz LVTGOSOOKWHCMD-TXTKFYIRSA-N 0 3 409.574 4.493 20 0 HIADHN COc1c(C)cnc(CN(C)C(=O)NC[C@@H](c2ccccc2)N2CCC(C)CC2)c1C ZINC000520196500 928382297 /nfs/dbraw/zinc/38/22/97/928382297.db2.gz LPJKTJSKBMKFOB-QHCPKHFHSA-N 0 3 424.589 4.322 20 0 HIADHN Clc1ccccc1[C@@H](CNCc1ccccc1OCC1CC1)N1CCOCC1 ZINC000520206708 928387405 /nfs/dbraw/zinc/38/74/05/928387405.db2.gz CPBUANSUIDHHNI-JOCHJYFZSA-N 0 3 400.950 4.292 20 0 HIADHN COc1cc(CNCc2ccc(CN3CCc4ccccc43)cc2)cc2c1OCO2 ZINC000520208784 928390026 /nfs/dbraw/zinc/39/00/26/928390026.db2.gz LAMKQABYTMCHFC-UHFFFAOYSA-N 0 3 402.494 4.276 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)N(C)[C@H](C)c3cccc(O)c3)CC2)c1 ZINC000520243143 928412129 /nfs/dbraw/zinc/41/21/29/928412129.db2.gz UCTFMKUZRYORBV-OAQYLSRUSA-N 0 3 424.589 4.005 20 0 HIADHN C[C@@H](C(=O)N1CCc2ccccc21)N(C)CCCc1cc(-c2cccc(F)c2)n[nH]1 ZINC000520264254 928428215 /nfs/dbraw/zinc/42/82/15/928428215.db2.gz BFKGSTUJQXEEAE-KRWDZBQOSA-N 0 3 406.505 4.058 20 0 HIADHN CSCc1cccc(NC(=O)NCCCN2CCN(C)C[C@H]2c2ccccc2)c1 ZINC000520282951 928445541 /nfs/dbraw/zinc/44/55/41/928445541.db2.gz BPGMWWGYZSTJDK-QFIPXVFZSA-N 0 3 412.603 4.050 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N(Cc2ccco2)C[C@@H]2CCCO2)N2CCCC2)cc1 ZINC000520285846 928448247 /nfs/dbraw/zinc/44/82/47/928448247.db2.gz WAICKNHHBJWHNT-XZOQPEGZSA-N 0 3 411.546 4.116 20 0 HIADHN C[C@H](CNC(=O)[C@@H]1C[C@H]1c1cccc(Br)c1)N(C)Cc1ccccc1 ZINC000520327477 928491035 /nfs/dbraw/zinc/49/10/35/928491035.db2.gz FNEJAJWUPZDUMO-UIAACRFSSA-N 0 3 401.348 4.189 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1ccccc1-c1nncn1CC)c1ccsc1 ZINC000520331007 928494544 /nfs/dbraw/zinc/49/45/44/928494544.db2.gz JMRLLCQPOHBLIL-IBGZPJMESA-N 0 3 412.563 4.231 20 0 HIADHN Cc1ccc(-c2cc(C(=O)N(C)[C@@H]3CN4CCC3CC4)c3cnn(C(C)C)c3n2)cc1 ZINC000520370816 928525789 /nfs/dbraw/zinc/52/57/89/928525789.db2.gz AFBMRQYRGYQKFV-HSZRJFAPSA-N 0 3 417.557 4.154 20 0 HIADHN CN(C(=O)c1ccc(CSc2nc3ccccc3[nH]2)cc1)[C@@H]1CN2CCC1CC2 ZINC000520370896 928525849 /nfs/dbraw/zinc/52/58/49/928525849.db2.gz DZKSYJPDGVYWIG-OAQYLSRUSA-N 0 3 406.555 4.021 20 0 HIADHN COCCN1CCC(NC(=O)Nc2ccc(Cc3nc4ccccc4s3)cc2)CC1 ZINC000520381976 928535069 /nfs/dbraw/zinc/53/50/69/928535069.db2.gz PLUKTISKWBEAPU-UHFFFAOYSA-N 0 3 424.570 4.119 20 0 HIADHN CN(CCNC(=O)N1CCC[C@@H](c2nc3ccccc3s2)C1)Cc1ccccc1 ZINC000520424248 928559417 /nfs/dbraw/zinc/55/94/17/928559417.db2.gz YICDSRBAKUTVHP-LJQANCHMSA-N 0 3 408.571 4.317 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N(C)C[C@@H]1CCCCO1)c1ccc(C(F)(F)F)cc1 ZINC000520474207 928587395 /nfs/dbraw/zinc/58/73/95/928587395.db2.gz WDUAQBJBQASEKZ-RBUKOAKNSA-N 0 3 415.500 4.299 20 0 HIADHN CN(C)CCN(CC1CCCCC1)C(=O)c1cnc2c(cnn2Cc2ccccc2)c1 ZINC000520515286 928612451 /nfs/dbraw/zinc/61/24/51/928612451.db2.gz QCQLAUMAOKAMJV-UHFFFAOYSA-N 0 3 419.573 4.064 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)Nc1cccc(OC[C@@H]2CCCO2)c1 ZINC000520536030 928625463 /nfs/dbraw/zinc/62/54/63/928625463.db2.gz PBGBFEYUXVVWKD-PMACEKPBSA-N 0 3 415.559 4.265 20 0 HIADHN CC[C@@H](C)NC(=O)c1ccc(NC(=O)NC[C@@H](c2ccccc2)N2CCCC2)c(C)c1 ZINC000520597847 928662289 /nfs/dbraw/zinc/66/22/89/928662289.db2.gz HQGIOBUGUAIJDI-XXBNENTESA-N 0 3 422.573 4.482 20 0 HIADHN COc1cccc([C@H]2C[C@H]2C(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)c1 ZINC000520705271 928752375 /nfs/dbraw/zinc/75/23/75/928752375.db2.gz QSAUKFJWUNLLDW-NHCUHLMSSA-N 0 3 420.475 4.408 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2cc(F)ccc2OC[C@H]2CCCO2)N(C)C)cc1 ZINC000520786769 928818281 /nfs/dbraw/zinc/81/82/81/928818281.db2.gz HGJQCOFAKNMKQO-TZIWHRDSSA-N 0 3 415.509 4.116 20 0 HIADHN O=C(c1ccc(Cl)cc1)C1CCN(CCCOc2ccc3c(c2)OCO3)CC1 ZINC000520792727 928821523 /nfs/dbraw/zinc/82/15/23/928821523.db2.gz GKENYTYCQJTOAE-UHFFFAOYSA-N 0 3 401.890 4.433 20 0 HIADHN CCCO[C@@H]1CCCN(C(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)CC1 ZINC000520825124 928834291 /nfs/dbraw/zinc/83/42/91/928834291.db2.gz XWAQUINOKSXQDO-TZIWHRDSSA-N 0 3 412.496 4.249 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2nc(CN3CCC[C@@H](C)C3)cs2)N(C)C)cc1 ZINC000520830067 928836239 /nfs/dbraw/zinc/83/62/39/928836239.db2.gz JTKWRIWZLWCXNL-XLIONFOSSA-N 0 3 415.607 4.108 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)NC[C@H](c2ccc(C)cc2)N(C)C)cc1OC ZINC000520936464 928881844 /nfs/dbraw/zinc/88/18/44/928881844.db2.gz BKEUWLCPVCZYLN-LEWJYISDSA-N 0 3 411.546 4.162 20 0 HIADHN Cc1cccc([C@H](CNCc2cc(Br)ccc2F)N2CCOCC2)c1 ZINC000520946895 928885507 /nfs/dbraw/zinc/88/55/07/928885507.db2.gz SPESYFJEGDWLGX-FQEVSTJZSA-N 0 3 407.327 4.060 20 0 HIADHN O=C(NCCc1ccccc1C(F)(F)F)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000521000964 928916965 /nfs/dbraw/zinc/91/69/65/928916965.db2.gz VXSFXAALOPQWKB-SFHVURJKSA-N 0 3 408.439 4.415 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)c1sc(CC(C)C)nc1C ZINC000521011492 928928161 /nfs/dbraw/zinc/92/81/61/928928161.db2.gz IZXQBKGPAOZPNX-IBGZPJMESA-N 0 3 400.592 4.172 20 0 HIADHN O=C(NCc1cc(F)cc(Br)c1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000521011976 928929300 /nfs/dbraw/zinc/92/93/00/928929300.db2.gz SMBJSDJEXMEDNI-MRXNPFEDSA-N 0 3 423.301 4.256 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)c1sc(CC(C)C)nc1C ZINC000521011493 928929573 /nfs/dbraw/zinc/92/95/73/928929573.db2.gz IZXQBKGPAOZPNX-LJQANCHMSA-N 0 3 400.592 4.172 20 0 HIADHN CCCn1ccc2cc(NC(=O)N3CCC(CN4C[C@H](C)O[C@@H](C)C4)CC3)ccc21 ZINC000521034038 928948951 /nfs/dbraw/zinc/94/89/51/928948951.db2.gz UOXBGLRMZYLVSD-OALUTQOASA-N 0 3 412.578 4.404 20 0 HIADHN C[C@@H](Cc1ccc(C(F)(F)F)cc1)NC(=O)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000521167575 929041134 /nfs/dbraw/zinc/04/11/34/929041134.db2.gz VOPXUSBXNKHYOT-JXFKEZNVSA-N 0 3 405.464 4.210 20 0 HIADHN COCCCN(C(=O)c1oc2c(cccc2Br)c1C)C1CCN(C)CC1 ZINC000521323273 929136108 /nfs/dbraw/zinc/13/61/08/929136108.db2.gz LAXINQHQDWPXEV-UHFFFAOYSA-N 0 3 423.351 4.077 20 0 HIADHN O=C(N[C@H]1CCN(Cc2ccccc2)C1)N[C@@H]1CCSc2ccc(Cl)cc21 ZINC000521450857 929227002 /nfs/dbraw/zinc/22/70/02/929227002.db2.gz OFCIIGMLKJIMCT-PKOBYXMFSA-N 0 3 401.963 4.451 20 0 HIADHN COc1ccc(CN(Cc2cc(OC)c(O)c(OC)c2)[C@H](C)C2CC2)c(OC)c1 ZINC000521511808 929265612 /nfs/dbraw/zinc/26/56/12/929265612.db2.gz CPQBXRKBPABYQB-OAHLLOKOSA-N 0 3 401.503 4.227 20 0 HIADHN CN(C)C(=O)c1cc(NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)ccc1Cl ZINC000521530543 929277081 /nfs/dbraw/zinc/27/70/81/929277081.db2.gz KJXGEMLPDDICTE-MRXNPFEDSA-N 0 3 417.912 4.032 20 0 HIADHN CC(=O)Nc1cc(NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)ccc1Cl ZINC000521601967 929323489 /nfs/dbraw/zinc/32/34/89/929323489.db2.gz NJCNQTJJLLSTOC-MRXNPFEDSA-N 0 3 403.885 4.288 20 0 HIADHN COc1cccc([C@@H](CNC(=O)NC(C)(C)c2nc(C)c(C)s2)N2CCCC2)c1 ZINC000521686369 929366765 /nfs/dbraw/zinc/36/67/65/929366765.db2.gz VJGHOAWXHUAIDH-LJQANCHMSA-N 0 3 416.591 4.140 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)c2cn(C)nc2-c2ccccc2Cl)C1 ZINC000521751674 929413403 /nfs/dbraw/zinc/41/34/03/929413403.db2.gz BJCPBUXIZHHWGC-WMZOPIPTSA-N 0 3 408.933 4.306 20 0 HIADHN COc1ccc(C[C@H](NCc2cnc3n[nH]c(C)c3c2)c2ccc(OC)cc2)cc1 ZINC000521820900 929477233 /nfs/dbraw/zinc/47/72/33/929477233.db2.gz QDXXSYCYJZNDGQ-QHCPKHFHSA-N 0 3 402.498 4.357 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)N3CC[C@@H](c4ccccc4)C3)CC2)c1 ZINC000521834474 929484957 /nfs/dbraw/zinc/48/49/57/929484957.db2.gz UZKZEJBILSNPPF-XMMPIXPASA-N 0 3 420.601 4.096 20 0 HIADHN CCCCOc1cccc(NC(=O)N2CCC(CN3C[C@@H](C)O[C@H](C)C3)CC2)c1 ZINC000521876640 929524082 /nfs/dbraw/zinc/52/40/82/929524082.db2.gz OBYTYGNQWMUJGW-RTBURBONSA-N 0 3 403.567 4.219 20 0 HIADHN CC(C)CCOc1cccc(NC(=O)N2CCC(CN3C[C@H](C)O[C@@H](C)C3)CC2)c1 ZINC000521876073 929524119 /nfs/dbraw/zinc/52/41/19/929524119.db2.gz ZPQMAFZQJFADLT-PMACEKPBSA-N 0 3 417.594 4.465 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)NCc1ccc(F)cc1F ZINC000521890774 929539372 /nfs/dbraw/zinc/53/93/72/929539372.db2.gz QQXLLOUTSJHHTD-UHFFFAOYSA-N 0 3 415.406 4.257 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)N[C@H]1CCSc2c(F)cccc21 ZINC000521914007 929558950 /nfs/dbraw/zinc/55/89/50/929558950.db2.gz QSKYQWJRSJZMEP-NRFANRHFSA-N 0 3 413.562 4.081 20 0 HIADHN CC(C)[C@@H](NC(=O)N(Cc1ccco1)C1CCN(C)CC1)c1nc2ccccc2[nH]1 ZINC000524527988 929665950 /nfs/dbraw/zinc/66/59/50/929665950.db2.gz NYPVAQKORCHHFM-OAQYLSRUSA-N 0 3 409.534 4.159 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3CCc4cccc(F)c4[C@@H]3C)c(C)c2)CC1 ZINC000524595320 929705477 /nfs/dbraw/zinc/70/54/77/929705477.db2.gz JAQIVUYMWJKXCV-SFHVURJKSA-N 0 3 410.537 4.427 20 0 HIADHN C[C@H](SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)NCCN1CC[C@H](C)C1 ZINC000524720406 929809349 /nfs/dbraw/zinc/80/93/49/929809349.db2.gz PCGMXINHHFSPSZ-GJZGRUSLSA-N 0 3 407.967 4.075 20 0 HIADHN C[C@@H](SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)NCCN1CC[C@H](C)C1 ZINC000524720408 929809393 /nfs/dbraw/zinc/80/93/93/929809393.db2.gz PCGMXINHHFSPSZ-LSDHHAIUSA-N 0 3 407.967 4.075 20 0 HIADHN CCN(CC(F)(F)F)C(=O)[C@@H]1CCCN(Cc2ccc(SC)c(OC)c2)C1 ZINC000524755847 929820189 /nfs/dbraw/zinc/82/01/89/929820189.db2.gz JOTAHRKIEFHZDQ-OAHLLOKOSA-N 0 3 404.498 4.040 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)CN2CCCC3(CCCCC3)C2)c(OC)c1 ZINC000524755949 929820254 /nfs/dbraw/zinc/82/02/54/929820254.db2.gz AMXBSMQZOGUGFQ-NRFANRHFSA-N 0 3 400.563 4.414 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(F)cc2)CC1)c1cc2cc(F)ccc2s1 ZINC000524813770 929840938 /nfs/dbraw/zinc/84/09/38/929840938.db2.gz SBVLKIYQYNQZGJ-UHFFFAOYSA-N 0 3 416.493 4.453 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)[C@H]1C[C@@H]1c1c(F)cccc1Cl ZINC000524833443 929851191 /nfs/dbraw/zinc/85/11/91/929851191.db2.gz CIEIQZFVDGGNIA-GJZGRUSLSA-N 0 3 410.867 4.451 20 0 HIADHN Cc1cccc(CSCC(=O)NC2CCN(CCOc3ccc(F)cc3)CC2)c1 ZINC000524835942 929852415 /nfs/dbraw/zinc/85/24/15/929852415.db2.gz TXTSRXPNWMECFK-UHFFFAOYSA-N 0 3 416.562 4.027 20 0 HIADHN COc1ccc(SCCC(=O)NC[C@H](c2cccs2)N2CCCC2)cc1OC ZINC000524855999 929860381 /nfs/dbraw/zinc/86/03/81/929860381.db2.gz GNZLGJJTUSCQJW-QGZVFWFLSA-N 0 3 420.600 4.201 20 0 HIADHN COc1ccc(CCC(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)cc1Cl ZINC000524864309 929864045 /nfs/dbraw/zinc/86/40/45/929864045.db2.gz KOOUHDDPDUGQJZ-SFHVURJKSA-N 0 3 400.950 4.404 20 0 HIADHN CCCN(Cc1nnc(-c2ccc(Br)o2)o1)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000524893039 929875744 /nfs/dbraw/zinc/87/57/44/929875744.db2.gz XJRBPEGWEGDKFM-IUIKQTSFSA-N 0 3 410.312 4.118 20 0 HIADHN O=C(CC1CCCC1)NC1CCN(CCc2nc(-c3cccc(Cl)c3)no2)CC1 ZINC000524906304 929883323 /nfs/dbraw/zinc/88/33/23/929883323.db2.gz HWHVZAVYTLPHTP-UHFFFAOYSA-N 0 3 416.953 4.093 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)N[C@H](c1ccccc1)[C@@H]1CCCO1 ZINC000524932442 929896878 /nfs/dbraw/zinc/89/68/78/929896878.db2.gz YNPNFGNFGLNZJF-FGCOXFRFSA-N 0 3 407.558 4.213 20 0 HIADHN C[C@H](CNC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C)COCc1ccccc1 ZINC000524931523 929896982 /nfs/dbraw/zinc/89/69/82/929896982.db2.gz CQUIKRXKOHHKNA-FGZHOGPDSA-N 0 3 409.574 4.145 20 0 HIADHN Cc1ccc(NC(=O)[C@H]2CCCN(Cc3cccnc3)C2)cc1OCC1CCOCC1 ZINC000524952858 929915443 /nfs/dbraw/zinc/91/54/43/929915443.db2.gz QHFSMLMVHGNBBC-QFIPXVFZSA-N 0 3 423.557 4.046 20 0 HIADHN COc1cc(CN(C)CCC(=O)NCc2ccccc2Cl)c(SC)cc1OC ZINC000525001345 929965151 /nfs/dbraw/zinc/96/51/51/929965151.db2.gz CSONVZAPSVUPRM-UHFFFAOYSA-N 0 3 422.978 4.217 20 0 HIADHN O=C(N[C@@H]1C[C@@H]1Cc1ccccc1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000525009450 929970960 /nfs/dbraw/zinc/97/09/60/929970960.db2.gz QVKOURNWHPFPCT-TUNNFDKTSA-N 0 3 402.460 4.188 20 0 HIADHN CN(C)c1nc2sc(C(=O)NC[C@H]3CCCN(C)[C@@H]3c3cccs3)cc2s1 ZINC000525057811 930008094 /nfs/dbraw/zinc/00/80/94/930008094.db2.gz TZLIVOPRNQMTSH-WBMJQRKESA-N 0 3 420.629 4.298 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)C2CC(c3cccc(F)c3)C2)cc1)[C@H]1CCCN(C)C1 ZINC000525065870 930013410 /nfs/dbraw/zinc/01/34/10/930013410.db2.gz YSDWJYVLNLJOMO-XPJNUEMQSA-N 0 3 423.532 4.124 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@H](C)N2CC[C@H](c3ccccc3)[C@H](C)C2)cc1OC ZINC000525126129 930050834 /nfs/dbraw/zinc/05/08/34/930050834.db2.gz PXLJYBQCHMJNTB-DXIQSLLYSA-N 0 3 410.558 4.176 20 0 HIADHN CC(C)c1nc(C(=O)N[C@@H](CN2CCCC2)c2ccccc2)nn1-c1ccccc1F ZINC000525162020 930072433 /nfs/dbraw/zinc/07/24/33/930072433.db2.gz WSGWJBXONMQDHP-FQEVSTJZSA-N 0 3 421.520 4.097 20 0 HIADHN COc1cccc(COc2cccc(Cl)c2CNC2CCN(C(C)=O)CC2)c1 ZINC000525180558 930077601 /nfs/dbraw/zinc/07/76/01/930077601.db2.gz CXHOXQCIUVPKCF-UHFFFAOYSA-N 0 3 402.922 4.028 20 0 HIADHN FC(F)(F)c1cnc(OCCNCc2cnc3ccc(Cl)cn23)c(Cl)c1 ZINC000525183561 930079888 /nfs/dbraw/zinc/07/98/88/930079888.db2.gz SALHSLHLOUNAJX-UHFFFAOYSA-N 0 3 405.207 4.224 20 0 HIADHN Cc1nc2cc(NC(=O)[C@]3(C(F)(F)F)CCN(Cc4ccccc4)C3)ccc2n1C ZINC000525211989 930088303 /nfs/dbraw/zinc/08/83/03/930088303.db2.gz LABJSLUMXXUHAV-NRFANRHFSA-N 0 3 416.447 4.275 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)Nc1cccc(CC(=O)OC(C)(C)C)c1 ZINC000525229202 930094853 /nfs/dbraw/zinc/09/48/53/930094853.db2.gz IBBPCAGDOUQDJN-UHFFFAOYSA-N 0 3 411.546 4.167 20 0 HIADHN C[C@H](CC(=O)c1cccc(Br)c1)C(=O)NCCN1[C@H](C)CCC[C@H]1C ZINC000525242907 930102223 /nfs/dbraw/zinc/10/22/23/930102223.db2.gz CUQWUBFRRXPEGU-BZUAXINKSA-N 0 3 409.368 4.037 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)Nc1ccc(Cl)c(C[S@](C)=O)c1 ZINC000525250451 930106103 /nfs/dbraw/zinc/10/61/03/930106103.db2.gz LPSWJOBMGQFOCS-MHZLTWQESA-N 0 3 404.919 4.279 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N2CCC(OCC3CCCCC3)CC2)N(C)C)cc1 ZINC000525254483 930108857 /nfs/dbraw/zinc/10/88/57/930108857.db2.gz XBPIMPWTWDHZGA-HSZRJFAPSA-N 0 3 401.595 4.369 20 0 HIADHN CCOC(=O)CCc1ccc(NC(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)cc1 ZINC000525343729 930180791 /nfs/dbraw/zinc/18/07/91/930180791.db2.gz XORYIGXQVHTZMR-QHCPKHFHSA-N 0 3 423.557 4.449 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)N[C@H]1C[C@@H]1c1c(F)cccc1Cl ZINC000525394453 930216153 /nfs/dbraw/zinc/21/61/53/930216153.db2.gz REEWMUMHJWNPNZ-PXNSSMCTSA-N 0 3 401.913 4.083 20 0 HIADHN C[C@@H](OCCCNC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C)c1ccccc1 ZINC000525399370 930218326 /nfs/dbraw/zinc/21/83/26/930218326.db2.gz LETLCJLYQAISDD-FCHUYYIVSA-N 0 3 409.574 4.460 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)NCCCCOc1ccc(F)cc1 ZINC000525419524 930230918 /nfs/dbraw/zinc/23/09/18/930230918.db2.gz LDFJFFNEHGINKJ-HXUWFJFHSA-N 0 3 413.537 4.291 20 0 HIADHN CCN(Cc1ccccc1NC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C)C(C)=O ZINC000525444568 930243172 /nfs/dbraw/zinc/24/31/72/930243172.db2.gz HJOMRUBYKKXJEW-FQEVSTJZSA-N 0 3 422.573 4.183 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)CCSc2ccc3c(c2)OCCCO3)N(C)C)cc1 ZINC000525476123 930265641 /nfs/dbraw/zinc/26/56/41/930265641.db2.gz HVFSXPKYRHVBEJ-HXUWFJFHSA-N 0 3 414.571 4.058 20 0 HIADHN CCOc1ccccc1Oc1ccc(CNC(=O)c2cccc(CN(C)C)c2)cn1 ZINC000525490229 930278011 /nfs/dbraw/zinc/27/80/11/930278011.db2.gz LGYLVLMAOFKLKT-UHFFFAOYSA-N 0 3 405.498 4.264 20 0 HIADHN COc1cc(CN(C)C(=O)Nc2cccc(CN(C)C)c2)c(SC)cc1OC ZINC000525491076 930278291 /nfs/dbraw/zinc/27/82/91/930278291.db2.gz BCFUMPBZLRFQIS-UHFFFAOYSA-N 0 3 403.548 4.151 20 0 HIADHN CCc1cc(CNC(=O)NC[C@H](c2ccc(C(F)(F)F)cc2)N(CC)CC)on1 ZINC000525498035 930284588 /nfs/dbraw/zinc/28/45/88/930284588.db2.gz KRYIYWKIECLIPY-GOSISDBHSA-N 0 3 412.456 4.138 20 0 HIADHN CC(C)CC(=O)Nc1ccc(Cl)c(C(=O)NCc2ccccc2CN(C)C)c1 ZINC000525575618 930340114 /nfs/dbraw/zinc/34/01/14/930340114.db2.gz LHMLIBQDKVPZGJ-UHFFFAOYSA-N 0 3 401.938 4.316 20 0 HIADHN COc1ccc(Oc2ccc(NC(=O)[C@@H]3CCCN(Cc4cccnc4)C3)cn2)cc1 ZINC000525614163 930362995 /nfs/dbraw/zinc/36/29/95/930362995.db2.gz HIFYFWABWABWDP-LJQANCHMSA-N 0 3 418.497 4.128 20 0 HIADHN Cc1c(N[C@H](C)C(C)C)cccc1C(=O)NCc1ccc(CN2CCN(C)CC2)cc1 ZINC000525620566 930367720 /nfs/dbraw/zinc/36/77/20/930367720.db2.gz ZIOAPIBDQBYQJX-OAQYLSRUSA-N 0 3 422.617 4.129 20 0 HIADHN Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)NC[C@@H](c1cccs1)N1CCOCC1 ZINC000525757084 930432417 /nfs/dbraw/zinc/43/24/17/930432417.db2.gz BJLYORWEGMTWEZ-QUCCMNQESA-N 0 3 415.603 4.170 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CCO[C@H](c2ccccc2C)C1)c1ccsc1 ZINC000525756640 930432495 /nfs/dbraw/zinc/43/24/95/930432495.db2.gz KXMABCXOWGCUCW-SFTDATJTSA-N 0 3 401.576 4.223 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3ccc(COC)cc3)c(OCC)c2)CC1 ZINC000526069614 930519316 /nfs/dbraw/zinc/51/93/16/930519316.db2.gz ZJXLFIIOFCFDEQ-UHFFFAOYSA-N 0 3 411.546 4.016 20 0 HIADHN COC(=O)c1ccsc1N1CC[C@H](N[C@@H](C)c2cc3ccccc3s2)C1=O ZINC000526944683 930554191 /nfs/dbraw/zinc/55/41/91/930554191.db2.gz UCKNZEOFICEPPN-WFASDCNBSA-N 0 3 400.525 4.206 20 0 HIADHN Cn1c(=O)sc2cc(CNCc3ccc(C(=O)Nc4ccc(F)cc4)cc3)ccc21 ZINC000526988762 930563016 /nfs/dbraw/zinc/56/30/16/930563016.db2.gz RBVMPAPKXQCNGP-UHFFFAOYSA-N 0 3 421.497 4.281 20 0 HIADHN COCC(=O)Nc1cccc(CN[C@H]2CCCc3cc(Br)ccc32)c1 ZINC000527033973 930572056 /nfs/dbraw/zinc/57/20/56/930572056.db2.gz QGZSJVVRXATIIL-IBGZPJMESA-N 0 3 403.320 4.201 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2cc(F)ccc2OCC(F)(F)F)[C@@H]1c1ccccc1 ZINC000527067001 930578770 /nfs/dbraw/zinc/57/87/70/930578770.db2.gz HHEICPHIWAZHGX-YJBOKZPZSA-N 0 3 411.399 4.334 20 0 HIADHN C[C@@H](CC(=O)Nc1ccc(Br)cc1)N[C@H]1CCOc2ccc(F)cc21 ZINC000527099697 930589043 /nfs/dbraw/zinc/58/90/43/930589043.db2.gz APKYMQAAKZNELB-SJCJKPOMSA-N 0 3 407.283 4.419 20 0 HIADHN C[C@@H](CC(=O)Nc1cccc(Br)c1)N[C@@H]1CCOc2ccc(F)cc21 ZINC000527100439 930590095 /nfs/dbraw/zinc/59/00/95/930590095.db2.gz LPQCTBOBEBYWQB-YVEFUNNKSA-N 0 3 407.283 4.419 20 0 HIADHN Cc1ccccc1[C@H]([C@@H](C)NC(=O)C(=O)Nc1cccc(Cl)c1Cl)N(C)C ZINC000527206856 930612842 /nfs/dbraw/zinc/61/28/42/930612842.db2.gz FQLBUUUZAUYCKD-ACJLOTCBSA-N 0 3 408.329 4.048 20 0 HIADHN COc1ccc([C@H](C)[C@H](C)Nc2ccc3nc(CCN4CCOCC4)[nH]c3c2)cc1 ZINC000527233214 930617278 /nfs/dbraw/zinc/61/72/78/930617278.db2.gz VXMLBFFEAMDELB-MSOLQXFVSA-N 0 3 408.546 4.050 20 0 HIADHN Cn1c(=O)sc2cc(CNCc3ccc(NC(=O)c4ccc(F)cc4)cc3)ccc21 ZINC000527523907 930673732 /nfs/dbraw/zinc/67/37/32/930673732.db2.gz GUJIUHULBSADRJ-UHFFFAOYSA-N 0 3 421.497 4.281 20 0 HIADHN CC1CCN(S(=O)(=O)Cc2ccccc2CNCc2ccc(C(F)F)cc2)CC1 ZINC000527523574 930674012 /nfs/dbraw/zinc/67/40/12/930674012.db2.gz JHCVMDHKENWIQF-UHFFFAOYSA-N 0 3 422.541 4.476 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3cccc4c3OC(C)(C)C4)CC2)C[C@@H](C)O1 ZINC000530448827 930712360 /nfs/dbraw/zinc/71/23/60/930712360.db2.gz FMHQGJZZDUVWPM-QZTJIDSGSA-N 0 3 415.578 4.143 20 0 HIADHN Cc1cc(F)c(Br)cc1NC(=O)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000530456725 930713913 /nfs/dbraw/zinc/71/39/13/930713913.db2.gz MIOFQOJMZQJVDL-HNNXBMFYSA-N 0 3 406.299 4.142 20 0 HIADHN CCC(=O)Nc1ccc(Cl)c(NC(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)c1 ZINC000530462804 930718457 /nfs/dbraw/zinc/71/84/57/930718457.db2.gz XSZZVJHJPHPIND-FXAWDEMLSA-N 0 3 400.910 4.255 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)c(C(F)(F)F)c1 ZINC000530515302 930733080 /nfs/dbraw/zinc/73/30/80/930733080.db2.gz VLMGWAUDLOZQQM-RBUKOAKNSA-N 0 3 420.435 4.231 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)CN(Cc1ccccc1)Cc1ccccc1 ZINC000530572167 930754229 /nfs/dbraw/zinc/75/42/29/930754229.db2.gz NXUWBSASOMONCU-UHFFFAOYSA-N 0 3 417.553 4.398 20 0 HIADHN CCN1CCN(CCC(=O)Nc2ccc(Oc3ccc(F)cc3)c3ccncc23)CC1 ZINC000530575735 930756339 /nfs/dbraw/zinc/75/63/39/930756339.db2.gz KOVKHBQLFXKSNQ-UHFFFAOYSA-N 0 3 422.504 4.132 20 0 HIADHN CCCC(=O)Nc1cccc(CNC(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000530587122 930760255 /nfs/dbraw/zinc/76/02/55/930760255.db2.gz JIUXEWYAEZLNHK-QHCPKHFHSA-N 0 3 422.573 4.231 20 0 HIADHN COc1cc(-c2nc(-c3ccc(CN(C)C)cc3)no2)cc(OC)c1OC(F)F ZINC000530633051 930779851 /nfs/dbraw/zinc/77/98/51/930779851.db2.gz UPCLFUXKABTLAZ-UHFFFAOYSA-N 0 3 405.401 4.084 20 0 HIADHN CN(C)Cc1ccc(-c2noc([C@H]3CC(=O)N(c4cccc5ccccc54)C3)n2)cc1 ZINC000530633276 930780403 /nfs/dbraw/zinc/78/04/03/930780403.db2.gz NAFYMPQPQCVAQO-FQEVSTJZSA-N 0 3 412.493 4.472 20 0 HIADHN CC(C)c1nc(-c2nc(-c3ccc(CN(C)C)cc3)no2)nn1-c1cccc(F)c1 ZINC000530632487 930780420 /nfs/dbraw/zinc/78/04/20/930780420.db2.gz XHQSFDIODSQLBB-UHFFFAOYSA-N 0 3 406.465 4.308 20 0 HIADHN Cc1ccc2cccc(S(=O)(=O)N(C)[C@@H]3CCN(Cc4ccccc4)[C@H](C)C3)c2n1 ZINC000530771916 930820754 /nfs/dbraw/zinc/82/07/54/930820754.db2.gz OMJSEONZFGGYSG-DENIHFKCSA-N 0 3 423.582 4.217 20 0 HIADHN Cc1ccsc1[C@H](Cc1ccccc1)NC(=O)CC1(N2CCOCC2)CCCC1 ZINC000530816994 930831097 /nfs/dbraw/zinc/83/10/97/930831097.db2.gz NICYAOGQPADUNT-NRFANRHFSA-N 0 3 412.599 4.492 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N3CCCC[C@H]3Cc3ccc(F)cc3)cc2)CC1 ZINC000530816616 930831142 /nfs/dbraw/zinc/83/11/42/930831142.db2.gz MXGQGOXCYZPRRO-DEOSSOPVSA-N 0 3 409.549 4.205 20 0 HIADHN COc1ccccc1CN(CCCc1nc(-c2ccccc2)no1)C[C@H]1CCCO1 ZINC000530866034 930843436 /nfs/dbraw/zinc/84/34/36/930843436.db2.gz AYNDWFNHAMEQOK-OAQYLSRUSA-N 0 3 407.514 4.359 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)Cc2csc(-c3ccccc3)n2)CC1 ZINC000530983631 930876233 /nfs/dbraw/zinc/87/62/33/930876233.db2.gz NWYBFCHQGHOXTB-UHFFFAOYSA-N 0 3 405.567 4.476 20 0 HIADHN CN(C)Cc1cccc(C(=O)NC2CCN(Cc3ccc(Cl)c(Cl)c3)CC2)c1 ZINC000531054211 930899299 /nfs/dbraw/zinc/89/92/99/930899299.db2.gz UCHNGPQUKSTOJQ-UHFFFAOYSA-N 0 3 420.384 4.449 20 0 HIADHN CCN(C(=O)CC1(N2CCOCC2)CCCC1)[C@H](c1ccc(C)cc1)c1cccnc1 ZINC000531055628 930899966 /nfs/dbraw/zinc/89/99/66/930899966.db2.gz PUHVVEDEZYRGLS-RUZDIDTESA-N 0 3 421.585 4.363 20 0 HIADHN CN(C(=O)c1cc(Cl)c2c(c1)OCCCO2)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000531063106 930902136 /nfs/dbraw/zinc/90/21/36/930902136.db2.gz AUOYTYZRUMHBDK-LJQANCHMSA-N 0 3 414.933 4.238 20 0 HIADHN CN(C)Cc1ccc(-c2noc(-c3csc(I)c3)n2)cc1 ZINC000531110208 930923995 /nfs/dbraw/zinc/92/39/95/930923995.db2.gz TZLGFRAIHVGTIQ-UHFFFAOYSA-N 0 3 411.268 4.131 20 0 HIADHN Cc1c(C(=O)N(Cc2ccccc2)C2CCN(C)CC2)cnn1-c1ccc(F)cc1F ZINC000531222738 930972396 /nfs/dbraw/zinc/97/23/96/930972396.db2.gz MYYVXDLWRRDRLH-UHFFFAOYSA-N 0 3 424.495 4.196 20 0 HIADHN CC[C@H](C(=O)Nc1ccc(Cl)c(C(=O)NCc2ccccc2F)c1)N(CC)CC ZINC000531289135 931003165 /nfs/dbraw/zinc/00/31/65/931003165.db2.gz ZNHDSOXGXCJMAC-HXUWFJFHSA-N 0 3 419.928 4.468 20 0 HIADHN FC(F)(F)c1ccc(-c2nc(CN3CCN(C4CCOCC4)CC3)cs2)cc1 ZINC000531342629 931024095 /nfs/dbraw/zinc/02/40/95/931024095.db2.gz AUHPRAXVSRNMEN-UHFFFAOYSA-N 0 3 411.493 4.126 20 0 HIADHN COc1cc(Cl)c(C)cc1NC(=O)CCNCc1cnn(Cc2ccccc2)c1 ZINC000531347151 931025236 /nfs/dbraw/zinc/02/52/36/931025236.db2.gz GCABQKCMZSHEOW-UHFFFAOYSA-N 0 3 412.921 4.020 20 0 HIADHN CSc1ccc(N2C[C@H](c3nc(-c4ccc(CN(C)C)cc4)no3)CC2=O)cc1 ZINC000531348420 931026251 /nfs/dbraw/zinc/02/62/51/931026251.db2.gz FLQPRJIRZTVPCZ-QGZVFWFLSA-N 0 3 408.527 4.041 20 0 HIADHN Cc1nc2ccccc2n1CC(=O)NCC1CCN(Cc2ccccc2Cl)CC1 ZINC000531361525 931031712 /nfs/dbraw/zinc/03/17/12/931031712.db2.gz VNRLCTYLNQODFE-UHFFFAOYSA-N 0 3 410.949 4.027 20 0 HIADHN FC(F)(F)c1cnc(OCCNCc2cnc(-c3ccccn3)s2)c(Cl)c1 ZINC000531479264 931071823 /nfs/dbraw/zinc/07/18/23/931071823.db2.gz RDPIBFXYSWSBMI-UHFFFAOYSA-N 0 3 414.840 4.441 20 0 HIADHN O=C([C@H]1CCCN(Cc2cccnc2)C1)N(CCc1ccc(F)cc1)C1CCCC1 ZINC000531540968 931097728 /nfs/dbraw/zinc/09/77/28/931097728.db2.gz KOPOSBNEDPLFTL-QFIPXVFZSA-N 0 3 409.549 4.447 20 0 HIADHN CC(C)N1CCN([C@@H]2CCN(C(=O)c3ccc(CSc4ccccc4)cc3)C2)CC1 ZINC000531578529 931108358 /nfs/dbraw/zinc/10/83/58/931108358.db2.gz KJAZWKFHFPUZAZ-HSZRJFAPSA-N 0 3 423.626 4.219 20 0 HIADHN CCCn1nc(C)c(CNC[C@@H](c2c(F)cccc2Cl)N2CCO[C@H](C)C2)c1C ZINC000531596554 931115349 /nfs/dbraw/zinc/11/53/49/931115349.db2.gz WYCCYZPTOTYBJB-VFNWGFHPSA-N 0 3 422.976 4.254 20 0 HIADHN O=C(NCCCOc1ccc2ccccc2c1)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000531641514 931135536 /nfs/dbraw/zinc/13/55/36/931135536.db2.gz LQFHTCYUSKTKJO-QHCPKHFHSA-N 0 3 403.526 4.032 20 0 HIADHN CN(Cc1cc(Cl)cc(Cl)c1)C(=O)CN1CCN(CCC(C)(C)C)CC1 ZINC000531642671 931136812 /nfs/dbraw/zinc/13/68/12/931136812.db2.gz SEDAVIZQHKALEP-UHFFFAOYSA-N 0 3 400.394 4.006 20 0 HIADHN C[C@@H](c1ccc(F)c(F)c1)N(C)C(=O)CN(Cc1ccccc1)CC1CCOCC1 ZINC000531650888 931140596 /nfs/dbraw/zinc/14/05/96/931140596.db2.gz MNXWOKKVLUYLTB-SFHVURJKSA-N 0 3 416.512 4.413 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@@H](C)N[C@@H]2CCCc3cc(OC)ccc32)cc1 ZINC000531676685 931147816 /nfs/dbraw/zinc/14/78/16/931147816.db2.gz IPGISOBNJHGNFW-UZUQRXQVSA-N 0 3 416.587 4.454 20 0 HIADHN CN(C)Cc1cccc(NC(=O)NCc2cccc(Cn3cnc4ccccc43)c2)c1 ZINC000531680765 931149752 /nfs/dbraw/zinc/14/97/52/931149752.db2.gz PMMKXYVYARSKQU-UHFFFAOYSA-N 0 3 413.525 4.468 20 0 HIADHN C[C@H](NCc1ccc(N2CCOCC2)nc1)c1cccc(OCc2ccccc2)c1 ZINC000531689262 931154001 /nfs/dbraw/zinc/15/40/01/931154001.db2.gz AACYYMHJEOPSNU-FQEVSTJZSA-N 0 3 403.526 4.348 20 0 HIADHN COc1cc([C@H](C)N[C@@H](C)c2ccc(NS(C)(=O)=O)cc2)ccc1OC(C)C ZINC000531689842 931155507 /nfs/dbraw/zinc/15/55/07/931155507.db2.gz UYDCHVLIKSDFQF-HOTGVXAUSA-N 0 3 406.548 4.266 20 0 HIADHN CC(C)NS(=O)(=O)Cc1ccccc1CN[C@@H](C)c1ccc(-c2ccncc2)cc1 ZINC000531702973 931165032 /nfs/dbraw/zinc/16/50/32/931165032.db2.gz YJONEOAOVKMJEG-IBGZPJMESA-N 0 3 423.582 4.427 20 0 HIADHN CC(C)NS(=O)(=O)Cc1ccccc1CN[C@H](C)c1ccc(-c2ccncc2)cc1 ZINC000531702974 931165116 /nfs/dbraw/zinc/16/51/16/931165116.db2.gz YJONEOAOVKMJEG-LJQANCHMSA-N 0 3 423.582 4.427 20 0 HIADHN COc1cc([C@H](C)NCc2ccccc2CS(=O)(=O)NC(C)C)ccc1SC ZINC000531703235 931165254 /nfs/dbraw/zinc/16/52/54/931165254.db2.gz OKWCSYFYNOPQCX-INIZCTEOSA-N 0 3 422.616 4.096 20 0 HIADHN C[C@H](NCC(=O)N1CCC(Cc2ccccc2)CC1)c1ccc(-n2ccnc2)cc1 ZINC000531737722 931179314 /nfs/dbraw/zinc/17/93/14/931179314.db2.gz JSPINIVLKNFGIU-FQEVSTJZSA-N 0 3 402.542 4.004 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)N1c2ccccc2CC[C@H]1C)c1ccc(NC(=O)C2CC2)cc1 ZINC000531752506 931183404 /nfs/dbraw/zinc/18/34/04/931183404.db2.gz JRRQXNDHDGLHHB-KURKYZTESA-N 0 3 405.542 4.442 20 0 HIADHN O=C(NCCNCc1cnc(C2CCCC2)s1)c1ccc(Br)cc1 ZINC000531754510 931184354 /nfs/dbraw/zinc/18/43/54/931184354.db2.gz WKYDXJDSSQYSNQ-UHFFFAOYSA-N 0 3 408.365 4.083 20 0 HIADHN CC(C)N1CCN([C@@H]2CCN(C(=O)N[C@H](CC(C)(C)C)c3ccc(F)cc3)C2)CC1 ZINC000531839627 931215920 /nfs/dbraw/zinc/21/59/20/931215920.db2.gz UKDLBNOOIFBBCC-FGZHOGPDSA-N 0 3 418.601 4.113 20 0 HIADHN CC(C)c1nc2ccc(NC(=O)N3CC[C@@H](N4CCN(C(C)C)CC4)C3)cc2s1 ZINC000531841087 931216675 /nfs/dbraw/zinc/21/66/75/931216675.db2.gz QVXURULQUMZCBZ-GOSISDBHSA-N 0 3 415.607 4.052 20 0 HIADHN CCN(C(=O)Nc1ncn(Cc2ccccc2)n1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000531875217 931231454 /nfs/dbraw/zinc/23/14/54/931231454.db2.gz VJHVDOBSZADXCY-UGKGYDQZSA-N 0 3 418.545 4.016 20 0 HIADHN C[C@@H](NCc1ccc(N2C[C@@H](C)O[C@@H](C)C2)nc1)c1ccc(Br)cc1 ZINC000531936281 931252881 /nfs/dbraw/zinc/25/28/81/931252881.db2.gz JGJPUCYFTNBOHQ-OWCLPIDISA-N 0 3 404.352 4.309 20 0 HIADHN COCC(=O)Nc1cccc(CN[C@@H]2C[C@H](C)c3c2cccc3Br)c1 ZINC000531943183 931256015 /nfs/dbraw/zinc/25/60/15/931256015.db2.gz WKVYQGHSCWDRAC-SCLBCKFNSA-N 0 3 403.320 4.372 20 0 HIADHN COc1ccc(-c2nc(C)c([C@@H](C)NCc3ccc(N4CCOCC4)nc3)s2)cc1 ZINC000531945266 931257878 /nfs/dbraw/zinc/25/78/78/931257878.db2.gz RPNIMLPPRSSZTF-MRXNPFEDSA-N 0 3 424.570 4.210 20 0 HIADHN Cc1cc2c(cc1C)[C@@H](NCc1ccc(CS(=O)(=O)NC(C)C)cc1)CCCO2 ZINC000531951786 931260522 /nfs/dbraw/zinc/26/05/22/931260522.db2.gz BMFFWQXPTMINGZ-QFIPXVFZSA-N 0 3 416.587 4.135 20 0 HIADHN C[C@H](N[C@H](CN1CCN(C)CC1)c1ccccc1)c1sccc1Br ZINC000531965608 931268124 /nfs/dbraw/zinc/26/81/24/931268124.db2.gz FBBAZDYNXWETSN-MAUKXSAKSA-N 0 3 408.409 4.150 20 0 HIADHN C[C@@H](N[C@H](CN1CCN(C)CC1)c1ccccc1)c1sccc1Br ZINC000531965607 931268653 /nfs/dbraw/zinc/26/86/53/931268653.db2.gz FBBAZDYNXWETSN-CRAIPNDOSA-N 0 3 408.409 4.150 20 0 HIADHN COc1ccc([C@@H](C)[C@@H](C)NCc2csc(CNC(=O)c3ccccc3)n2)cc1 ZINC000531977199 931273432 /nfs/dbraw/zinc/27/34/32/931273432.db2.gz OUSKPQLCXIWFNY-DLBZAZTESA-N 0 3 409.555 4.364 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(S(=O)(=O)N(C)C)cc1)c1ccc(-c2ccncc2)cc1 ZINC000531984718 931275681 /nfs/dbraw/zinc/27/56/81/931275681.db2.gz TYJNVYPBPJYSNS-MSOLQXFVSA-N 0 3 409.555 4.411 20 0 HIADHN C[C@H](NCc1ccc(N2CCN(C)CC2)nc1)c1ccc(Oc2ccccc2)cc1 ZINC000531989388 931278377 /nfs/dbraw/zinc/27/83/77/931278377.db2.gz USEAZALVJGXPOP-FQEVSTJZSA-N 0 3 402.542 4.477 20 0 HIADHN CC(C)N1CCN([C@@H]2CCN(C(=O)c3cc(-c4ccccc4)ccc3Cl)C2)CC1 ZINC000532088725 931307478 /nfs/dbraw/zinc/30/74/78/931307478.db2.gz GUYQGZLPKIDZKJ-OAQYLSRUSA-N 0 3 411.977 4.248 20 0 HIADHN O[C@@H](COC[C@H]1CCCO1)CN1CCC(=Cc2cc(Cl)ccc2Cl)CC1 ZINC000532165428 931334317 /nfs/dbraw/zinc/33/43/17/931334317.db2.gz ICMWJQROFADBKC-RTBURBONSA-N 0 3 400.346 4.029 20 0 HIADHN C[C@@H](CC(=O)N1CCCCCC1)NCc1cccc(NC(=O)c2cccc(F)c2)c1 ZINC000532194870 931344067 /nfs/dbraw/zinc/34/40/67/931344067.db2.gz LQNGZRABRMFWQW-SFHVURJKSA-N 0 3 411.521 4.349 20 0 HIADHN C[C@H](NCc1ccc(N2CCOCC2)nc1)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000532200349 931347301 /nfs/dbraw/zinc/34/73/01/931347301.db2.gz JVJUYLBUHVOGKE-IBGZPJMESA-N 0 3 421.516 4.487 20 0 HIADHN C[C@@H](NCc1ccc(-n2cnc3ccccc32)cc1)c1cccc(NS(C)(=O)=O)c1 ZINC000532205271 931349095 /nfs/dbraw/zinc/34/90/95/931349095.db2.gz GBJLAKYGBMVPAG-QGZVFWFLSA-N 0 3 420.538 4.248 20 0 HIADHN CC[C@H](NCc1ccc(C(=O)N2CCOCC2)cc1)c1ccc(OC(F)F)cc1 ZINC000532210321 931352956 /nfs/dbraw/zinc/35/29/56/931352956.db2.gz LZJWVJLGAHWVIZ-FQEVSTJZSA-N 0 3 404.457 4.001 20 0 HIADHN COc1ccc([C@@H](C)N[C@@H](C)c2ccc(OCC(=O)NC3CC3)cc2)cc1Cl ZINC000532211357 931353987 /nfs/dbraw/zinc/35/39/87/931353987.db2.gz QXDIRDIKWSRAHM-LSDHHAIUSA-N 0 3 402.922 4.418 20 0 HIADHN COc1ccc(CN[C@H](C)CC(=O)Nc2cccc(C(F)(F)F)c2)cc1NC(C)=O ZINC000532219431 931358406 /nfs/dbraw/zinc/35/84/06/931358406.db2.gz XDFICWFWYJVYNM-CYBMUJFWSA-N 0 3 423.435 4.179 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)N[C@H](C)c2cccc(N3CCCS3(=O)=O)c2)cc1 ZINC000532233024 931365430 /nfs/dbraw/zinc/36/54/30/931365430.db2.gz JSAYGSLCYAFPFJ-ZWKOTPCHSA-N 0 3 424.570 4.132 20 0 HIADHN Cc1cccc(COc2ccc([C@@H](C)NCc3cccc(OCC(N)=O)c3)cc2)c1 ZINC000532238092 931366331 /nfs/dbraw/zinc/36/63/31/931366331.db2.gz OGVVPFBULCHLIU-LJQANCHMSA-N 0 3 404.510 4.289 20 0 HIADHN Cc1cc(C(C)(C)C)cc2c1OCCC[C@H]2NCc1ccc(N2CCN(C)CC2)nc1 ZINC000532270746 931378735 /nfs/dbraw/zinc/37/87/35/931378735.db2.gz KFRBSJADGKFOMB-HSZRJFAPSA-N 0 3 422.617 4.443 20 0 HIADHN CC(C)N1CCN([C@H]2CCN(C(=O)C[C@H](Cc3ccccc3)c3ccccc3)C2)CC1 ZINC000532347679 931403167 /nfs/dbraw/zinc/40/31/67/931403167.db2.gz CCTVMQNIPQIPFF-UIOOFZCWSA-N 0 3 419.613 4.030 20 0 HIADHN CCc1ccc(Cl)c(CC)c1NC(=O)N1CC[C@@H](N2CCN(C(C)C)CC2)C1 ZINC000532348555 931404836 /nfs/dbraw/zinc/40/48/36/931404836.db2.gz GBNNOOLHDSRTRQ-GOSISDBHSA-N 0 3 407.002 4.097 20 0 HIADHN C[C@H](CC[S@@](C)=O)NCc1cc(Br)ccc1OCc1ccccc1 ZINC000532374740 931414957 /nfs/dbraw/zinc/41/49/57/931414957.db2.gz WCPFUNCJIGIKDQ-OYLFLEFRSA-N 0 3 410.377 4.275 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)nc2)cc1 ZINC000532446770 931438245 /nfs/dbraw/zinc/43/82/45/931438245.db2.gz XPOSRUPDMVWROA-FHWLQOOXSA-N 0 3 405.546 4.040 20 0 HIADHN CCCNC(=O)c1cccc(CN[C@@H](C)CC(=O)N(C)Cc2ccccc2Cl)c1 ZINC000532447689 931438390 /nfs/dbraw/zinc/43/83/90/931438390.db2.gz SZBHKLUSCIIRJZ-KRWDZBQOSA-N 0 3 415.965 4.007 20 0 HIADHN Cc1nc(-c2cc([C@H](C)NCc3ccc(N4CCN(C)CC4)nc3)cs2)cs1 ZINC000532451522 931439662 /nfs/dbraw/zinc/43/96/62/931439662.db2.gz BKYSIOAMRRDMDF-HNNXBMFYSA-N 0 3 413.616 4.178 20 0 HIADHN C[C@@H](NCc1ccc(N2CCN(C)CC2)nc1)c1ccc(SCC(F)F)cc1 ZINC000532452164 931440492 /nfs/dbraw/zinc/44/04/92/931440492.db2.gz YBQFWIDMGXKVAE-MRXNPFEDSA-N 0 3 406.546 4.041 20 0 HIADHN COc1ccc([C@@H](C)N[C@@H](C)c2ccc(S(=O)(=O)N3CCCCC3)cc2)cc1F ZINC000532454556 931442708 /nfs/dbraw/zinc/44/27/08/931442708.db2.gz TWTNQCSKZLOAKZ-DLBZAZTESA-N 0 3 420.550 4.421 20 0 HIADHN O[C@@H](CN[C@H]1CCSc2ccc(F)cc21)COc1cccc(C(F)(F)F)c1 ZINC000532465278 931447349 /nfs/dbraw/zinc/44/73/49/931447349.db2.gz VAEBRYSSAPAIOB-YOEHRIQHSA-N 0 3 401.425 4.411 20 0 HIADHN C[C@@H](CC(=O)N(C)Cc1ccccc1Cl)NCc1ccc(OCC2CC2)nc1 ZINC000532494055 931461105 /nfs/dbraw/zinc/46/11/05/931461105.db2.gz IUXHPWIOTSHWFL-INIZCTEOSA-N 0 3 401.938 4.051 20 0 HIADHN C[C@H]([NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1)c1sccc1Br ZINC000532494885 931461300 /nfs/dbraw/zinc/46/13/00/931461300.db2.gz WUGRZSHCKJKKFF-LBPRGKRZSA-N 0 3 409.349 4.172 20 0 HIADHN Cc1cc(NC(=O)Cc2ccc(C)c(C)c2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000532513685 931469851 /nfs/dbraw/zinc/46/98/51/931469851.db2.gz VYCCAIBDLSKEDX-QHCPKHFHSA-N 0 3 402.542 4.437 20 0 HIADHN C[C@@H](C(=O)N(c1nccs1)C1CCCCC1)N1CCN(C2CCC(C)CC2)CC1 ZINC000532572703 931535538 /nfs/dbraw/zinc/53/55/38/931535538.db2.gz VWNIJFRDDCXBHZ-GPJFCIFZSA-N 0 3 418.651 4.394 20 0 HIADHN CC(C)c1cccc2c1OCCC[C@@H]2NCc1ccc(C(=O)N2CCOCC2)cc1 ZINC000532704859 931597675 /nfs/dbraw/zinc/59/76/75/931597675.db2.gz BLHQOWZESGAEPD-QHCPKHFHSA-N 0 3 408.542 4.286 20 0 HIADHN CC(C)N(Cc1ccccc1)C(=O)CNC1(c2ccc(Cl)cc2)CCOCC1 ZINC000532714407 931604764 /nfs/dbraw/zinc/60/47/64/931604764.db2.gz LFPUPOAHGSSCPY-UHFFFAOYSA-N 0 3 400.950 4.373 20 0 HIADHN CCN(C(=O)c1cnc2c(C)cc(F)cc2c1O)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000532863927 931670780 /nfs/dbraw/zinc/67/07/80/931670780.db2.gz IWYCQHUEDFPHOM-XLIONFOSSA-N 0 3 421.516 4.273 20 0 HIADHN O=C(Nc1ccc(Oc2ccc(CO)cc2)cc1)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000532874805 931675822 /nfs/dbraw/zinc/67/58/22/931675822.db2.gz QZLGIYIRAGBRHP-NRFANRHFSA-N 0 3 417.509 4.217 20 0 HIADHN O=C(Nc1ccc(Oc2ccc(CO)cc2)cc1)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000532874806 931675933 /nfs/dbraw/zinc/67/59/33/931675933.db2.gz QZLGIYIRAGBRHP-OAQYLSRUSA-N 0 3 417.509 4.217 20 0 HIADHN C[C@H](C(=O)N(c1nccs1)C1CCCCC1)N1CCN(CC2CCCCC2)CC1 ZINC000532934950 931703840 /nfs/dbraw/zinc/70/38/40/931703840.db2.gz NCUUTVKAVVAQCJ-LJQANCHMSA-N 0 3 418.651 4.395 20 0 HIADHN O=C(Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)c1cnc2ccsc2c1 ZINC000532938575 931704455 /nfs/dbraw/zinc/70/44/55/931704455.db2.gz YRBREVUWABUONA-SFHVURJKSA-N 0 3 403.511 4.192 20 0 HIADHN C[C@@H]1CN(CC(=O)N2CCC(OCc3ccccc3)CC2)CC[C@@H]1c1ccccc1 ZINC000532972475 931721066 /nfs/dbraw/zinc/72/10/66/931721066.db2.gz KTWGGZGDGGKZGW-BWKNWUBXSA-N 0 3 406.570 4.320 20 0 HIADHN CC(C)(COc1ncccc1Br)NCc1cnc(-c2ccccc2)nc1 ZINC000532993839 931730523 /nfs/dbraw/zinc/73/05/23/931730523.db2.gz SEERWMDDJXBVIY-UHFFFAOYSA-N 0 3 413.319 4.248 20 0 HIADHN C[C@H](NCc1cnn(-c2ccc(F)cc2)c1)[C@H](OC1CCOCC1)c1ccccc1 ZINC000533007549 931733981 /nfs/dbraw/zinc/73/39/81/931733981.db2.gz HIJQBGLKKYHZLV-UUOWRZLLSA-N 0 3 409.505 4.426 20 0 HIADHN C/C=C/c1ccc(OC[C@@H](O)CN2CC=C(c3c[nH]c4ncccc34)CC2)c(OC)c1 ZINC000533022034 931741541 /nfs/dbraw/zinc/74/15/41/931741541.db2.gz AXGFERCPCGPQJR-GECPCNCSSA-N 0 3 419.525 4.134 20 0 HIADHN Cc1ccc(CN(Cc2nn3c(nc(C)cc3=O)s2)[C@@H]2CCc3ccccc32)cc1 ZINC000533028327 931745316 /nfs/dbraw/zinc/74/53/16/931745316.db2.gz SGRYRCGQQJGUHB-OAQYLSRUSA-N 0 3 416.550 4.458 20 0 HIADHN COC(=O)c1cc(CN2CCC[C@@H](c3nc(-c4ccc(Cl)cc4)no3)C2)c(C)o1 ZINC000533041965 931749184 /nfs/dbraw/zinc/74/91/84/931749184.db2.gz ADHZCDDORNEOSI-OAHLLOKOSA-N 0 3 415.877 4.458 20 0 HIADHN COc1cc(OC)c(NC(=O)CNC2(c3ccc(F)cc3)CCCC2)cc1Cl ZINC000533052632 931755193 /nfs/dbraw/zinc/75/51/93/931755193.db2.gz KHFWSZLNYDDCGS-UHFFFAOYSA-N 0 3 406.885 4.494 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)Nc1cccc(-c2ncco2)c1 ZINC000533132546 931777416 /nfs/dbraw/zinc/77/74/16/931777416.db2.gz RLYCOSJDGRGOGS-UHFFFAOYSA-N 0 3 400.429 4.216 20 0 HIADHN COc1ccc([C@H](CNC(=O)Nc2cccc(-c3ncco3)c2)N2CCCC2)cc1 ZINC000533161498 931794545 /nfs/dbraw/zinc/79/45/45/931794545.db2.gz FDJLZCMJJXZQNQ-NRFANRHFSA-N 0 3 406.486 4.309 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccnc2)C1)N1CCC[C@H](c2nc3c(s2)CCCC3)C1 ZINC000533192545 931806107 /nfs/dbraw/zinc/80/61/07/931806107.db2.gz MJQSROWTJXCYNE-VQTJNVASSA-N 0 3 424.614 4.035 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)COc1cc(C)cc(C)c1 ZINC000533232602 931815358 /nfs/dbraw/zinc/81/53/58/931815358.db2.gz DBQWPBQAOLVCSI-JOCHJYFZSA-N 0 3 418.541 4.273 20 0 HIADHN CC(C)COC1CCN(CCC(=O)Nc2ccccc2C(=O)c2ccccc2)CC1 ZINC000533250948 931819076 /nfs/dbraw/zinc/81/90/76/931819076.db2.gz IWNMTFVYXVMJNH-UHFFFAOYSA-N 0 3 408.542 4.383 20 0 HIADHN COc1ccc([C@H](CNC(=O)CN(C)CC2CCC2)c2c[nH]c3ccccc32)cc1 ZINC000533302605 931833445 /nfs/dbraw/zinc/83/34/45/931833445.db2.gz MGNUAFCWHFSGFJ-QFIPXVFZSA-N 0 3 405.542 4.157 20 0 HIADHN O=C(CCN1CCC([C@H](O)C(F)(F)F)CC1)Nc1ccccc1Oc1ccccc1 ZINC000533347349 931844663 /nfs/dbraw/zinc/84/46/63/931844663.db2.gz IISMJVUZQAHLSV-NRFANRHFSA-N 0 3 422.447 4.443 20 0 HIADHN CCN(C(=O)CN1CCC(c2c[nH]c3ncccc23)CC1)[C@H](C)c1ccc(F)cc1 ZINC000533382378 931853880 /nfs/dbraw/zinc/85/38/80/931853880.db2.gz NGCONRJNFZHKRA-QGZVFWFLSA-N 0 3 408.521 4.491 20 0 HIADHN Cc1cc(C)c(NC(=O)CNC(=O)CN[C@H](c2ccccc2)C2CCCC2)c(C)c1 ZINC000533384010 931854459 /nfs/dbraw/zinc/85/44/59/931854459.db2.gz AAEVOABQLLSSEC-RUZDIDTESA-N 0 3 407.558 4.188 20 0 HIADHN CCN(CC(=O)N[C@@H](C)c1ccccc1)C1CCN(c2cc(C)nc(C(C)C)n2)CC1 ZINC000533395373 931856674 /nfs/dbraw/zinc/85/66/74/931856674.db2.gz UECGGOFUILLLHB-FQEVSTJZSA-N 0 3 423.605 4.077 20 0 HIADHN O=C(Nc1ccc(F)cc1)NC1CCN(CCCc2nc(-c3ccccc3)no2)CC1 ZINC000533480883 931879821 /nfs/dbraw/zinc/87/98/21/931879821.db2.gz HGYMWYIZTGKJQZ-UHFFFAOYSA-N 0 3 423.492 4.094 20 0 HIADHN COC(=O)c1ccc(CNC2(c3cccc(Br)c3)CCOCC2)s1 ZINC000533486334 931882683 /nfs/dbraw/zinc/88/26/83/931882683.db2.gz QIZXMXNHYHWHQS-UHFFFAOYSA-N 0 3 410.333 4.093 20 0 HIADHN O=C(CN[C@@H](c1ccc(F)cc1)C1CCC1)Nc1cc(Cl)ccc1-n1cncn1 ZINC000533505872 931887299 /nfs/dbraw/zinc/88/72/99/931887299.db2.gz LHYOTDZSLSVZNK-OAQYLSRUSA-N 0 3 413.884 4.129 20 0 HIADHN CC(=O)Nc1ccc(OC[C@@H](O)CN2CCCC[C@@H]2c2cc3ccccc3[nH]2)cc1 ZINC000533521383 931892933 /nfs/dbraw/zinc/89/29/33/931892933.db2.gz CSSLRKOCCQNPML-GBXCKJPGSA-N 0 3 407.514 4.093 20 0 HIADHN C/C=C\c1ccc(OC[C@H](O)CN2CCC(Nc3cccc(C)c3)CC2)c(OC)c1 ZINC000533530304 931895557 /nfs/dbraw/zinc/89/55/57/931895557.db2.gz KZRWXPLPUAQDNH-GXOSZSFXSA-N 0 3 410.558 4.353 20 0 HIADHN CCc1ccc([C@H](NC(=O)CN2CC[C@H](C3CCOCC3)C2)c2cccs2)cc1 ZINC000533670330 931960637 /nfs/dbraw/zinc/96/06/37/931960637.db2.gz LBUNOMNFVJKECM-URXFXBBRSA-N 0 3 412.599 4.265 20 0 HIADHN C[C@@H]1C[C@@H](N(C)S(=O)(=O)Cc2ccc(F)c(Cl)c2)CCN1Cc1ccccc1 ZINC000533697613 931975644 /nfs/dbraw/zinc/97/56/44/931975644.db2.gz SCXVTFUDKOBNOE-APWZRJJASA-N 0 3 424.969 4.294 20 0 HIADHN C[C@H]1C[C@@H](N(C)S(=O)(=O)Cc2ccc(F)c(Cl)c2)CCN1Cc1ccccc1 ZINC000533697615 931975967 /nfs/dbraw/zinc/97/59/67/931975967.db2.gz SCXVTFUDKOBNOE-LPHOPBHVSA-N 0 3 424.969 4.294 20 0 HIADHN FC(F)(F)c1cnc(OCCNCc2cnc([C@@H]3CCCO3)s2)c(Cl)c1 ZINC000533741609 932002830 /nfs/dbraw/zinc/00/28/30/932002830.db2.gz YSXISCIVJIAWBS-ZDUSSCGKSA-N 0 3 407.845 4.230 20 0 HIADHN COc1cc(CN[C@H](C)c2ccc(-n3ccnn3)cc2)ccc1OCc1ccncc1 ZINC000533753029 932009883 /nfs/dbraw/zinc/00/98/83/932009883.db2.gz SBIPGUQKBCXRAO-GOSISDBHSA-N 0 3 415.497 4.101 20 0 HIADHN Cc1cc(C)c(CC(C(=O)Nc2cncc(-c3nncn3C)c2)C(F)(F)F)c(C)c1 ZINC000533753598 932010483 /nfs/dbraw/zinc/01/04/83/932010483.db2.gz IKDMOJBFMYVRES-GOSISDBHSA-N 0 3 417.435 4.162 20 0 HIADHN CCC(CC)(C(=O)Nc1ccc(=O)n(CCN(C)C)c1)c1ccc(Cl)c(Cl)c1 ZINC000533780493 932030005 /nfs/dbraw/zinc/03/00/05/932030005.db2.gz GUGATKPGJDHLSR-UHFFFAOYSA-N 0 3 424.372 4.413 20 0 HIADHN CCSc1ccc([C@@H](C)NCc2ccccc2OCCN2CCOCC2)cc1 ZINC000533785637 932032969 /nfs/dbraw/zinc/03/29/69/932032969.db2.gz JOYPXJYIPJGBAJ-LJQANCHMSA-N 0 3 400.588 4.360 20 0 HIADHN CC[C@@](C)(COc1ncccc1Cl)NCC(=O)Nc1ccc(F)cc1Cl ZINC000533827285 932048448 /nfs/dbraw/zinc/04/84/48/932048448.db2.gz MEBHXUMECCRXCR-SFHVURJKSA-N 0 3 400.281 4.303 20 0 HIADHN CC(C)(C)CCN1CCN(C(=O)Nc2cccc3c2CN(c2ccccn2)C3)CC1 ZINC000533879167 932077040 /nfs/dbraw/zinc/07/70/40/932077040.db2.gz IIWIFHKPDCDHEM-UHFFFAOYSA-N 0 3 407.562 4.188 20 0 HIADHN Cc1cnc(CCNCc2cc(Br)ccc2OCc2ccccc2)nc1 ZINC000533921887 932100598 /nfs/dbraw/zinc/10/05/98/932100598.db2.gz XWBBRQMIXDMNAE-UHFFFAOYSA-N 0 3 412.331 4.459 20 0 HIADHN CN(Cc1cccc(OC(F)(F)F)c1)C(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000533944382 932117696 /nfs/dbraw/zinc/11/76/96/932117696.db2.gz KBZKWGAJJZPQSD-MOPGFXCFSA-N 0 3 407.436 4.172 20 0 HIADHN CN1CC[C@H](NC(=O)N2CCC[C@@H](c3nc4ccc(F)cc4o3)C2)[C@@H]1c1ccccc1 ZINC000533949289 932122965 /nfs/dbraw/zinc/12/29/65/932122965.db2.gz OFOSIICHYDDYGV-AGHHOFFYSA-N 0 3 422.504 4.301 20 0 HIADHN CC(C)Cn1ncc(C(=O)N2CCCN(CCCc3ccccc3)CC2)c1C(F)F ZINC000533961464 932137041 /nfs/dbraw/zinc/13/70/41/932137041.db2.gz VPSJWDLZSNOLDO-UHFFFAOYSA-N 0 3 418.532 4.257 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)c2nnn(-c3ccccc3F)c2C(F)(F)F)c1 ZINC000533968451 932145791 /nfs/dbraw/zinc/14/57/91/932145791.db2.gz BMIRXYNBOZRLQM-UHFFFAOYSA-N 0 3 421.398 4.048 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)c1 ZINC000533971835 932148829 /nfs/dbraw/zinc/14/88/29/932148829.db2.gz JIRNLRSEWKOMPN-DEOSSOPVSA-N 0 3 415.537 4.036 20 0 HIADHN C[C@@H](Cc1c(Cl)cccc1Cl)NC(=O)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000534003564 932186500 /nfs/dbraw/zinc/18/65/00/932186500.db2.gz SYCRHJFGODCEOW-RDJZCZTQSA-N 0 3 406.357 4.348 20 0 HIADHN CN1CC[C@@H](NC(=O)Cc2cc(Cl)ccc2Br)[C@H]1c1ccccc1 ZINC000534019431 932201355 /nfs/dbraw/zinc/20/13/55/932201355.db2.gz QLQHAHZHINJAJI-IEBWSBKVSA-N 0 3 407.739 4.207 20 0 HIADHN CN1CC[C@H](NC(=O)Cc2ccc(NC(=O)CC(C)(C)C)cc2)[C@@H]1c1ccccc1 ZINC000534021182 932202618 /nfs/dbraw/zinc/20/26/18/932202618.db2.gz WLBYSMVSOZCVEF-URXFXBBRSA-N 0 3 407.558 4.165 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1scnc1C1CC1 ZINC000534031218 932210390 /nfs/dbraw/zinc/21/03/90/932210390.db2.gz OVZXBPVYRWCVEJ-GOSISDBHSA-N 0 3 407.543 4.225 20 0 HIADHN CCN(C(=O)c1cccc(OCC(F)F)n1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000534077619 932255809 /nfs/dbraw/zinc/25/58/09/932255809.db2.gz LCMNGJULHUVXPC-SJLPKXTDSA-N 0 3 403.473 4.023 20 0 HIADHN CC[C@H](C)n1ncc(C(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)c1C1CC1 ZINC000534112836 932285838 /nfs/dbraw/zinc/28/58/38/932285838.db2.gz AHLMFRKYYJLFSE-GBESFXJTSA-N 0 3 416.610 4.083 20 0 HIADHN O=C(N[C@H]1CCN(Cc2ccccc2)C[C@H]1CO)c1ccc(-c2ccccc2Cl)o1 ZINC000534181867 932318910 /nfs/dbraw/zinc/31/89/10/932318910.db2.gz PEIGWQFIRUAJNW-RXVVDRJESA-N 0 3 424.928 4.213 20 0 HIADHN O=C(N[C@H]1CCN(Cc2ccccc2)C[C@@H]1CO)c1ccc(-c2ccccc2Cl)o1 ZINC000534181866 932319105 /nfs/dbraw/zinc/31/91/05/932319105.db2.gz PEIGWQFIRUAJNW-NQIIRXRSSA-N 0 3 424.928 4.213 20 0 HIADHN O=C(Nc1cc(Cl)c(OCC(F)(F)F)c(Cl)c1)N1CC[C@@H](N2CC=CC2)C1 ZINC000534257508 932368698 /nfs/dbraw/zinc/36/86/98/932368698.db2.gz YAAUUNZFQUQGCB-GFCCVEGCSA-N 0 3 424.250 4.413 20 0 HIADHN Cc1c(C(=O)N2CCC(CN3C[C@H](C)O[C@@H](C)C3)CC2)cccc1-c1ccccn1 ZINC000534365404 932397444 /nfs/dbraw/zinc/39/74/44/932397444.db2.gz GPOUHOOCCKJVSD-OALUTQOASA-N 0 3 407.558 4.018 20 0 HIADHN O=C(CN1CC[C@@H](C2CCOCC2)C1)N[C@H](c1ccccc1)c1cccc(Cl)c1 ZINC000534381677 932408947 /nfs/dbraw/zinc/40/89/47/932408947.db2.gz APTZJMRVILDEQB-ZJSXRUAMSA-N 0 3 412.961 4.294 20 0 HIADHN C[C@@H](Cc1ccc(Cl)cc1)C(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000534415667 932435441 /nfs/dbraw/zinc/43/54/41/932435441.db2.gz LEBDKFMDXJVTBJ-KRWDZBQOSA-N 0 3 400.950 4.362 20 0 HIADHN O=S(=O)(Cc1ccc(F)c(Cl)c1)NC1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1 ZINC000534423141 932440053 /nfs/dbraw/zinc/44/00/53/932440053.db2.gz KDTLLTNCONBRKG-YQQQUEKLSA-N 0 3 422.953 4.094 20 0 HIADHN COc1ccc(CN[C@H](C)c2ccc(-n3ccnn3)cc2)cc1OCc1cccnc1 ZINC000534465196 932482938 /nfs/dbraw/zinc/48/29/38/932482938.db2.gz TZCDJGRJIMOVDO-GOSISDBHSA-N 0 3 415.497 4.101 20 0 HIADHN Cc1cc(NC(=O)NC[C@H](Cc2ccccc2)N(C)C)ccc1OCC(F)(F)F ZINC000534526982 932545807 /nfs/dbraw/zinc/54/58/07/932545807.db2.gz RAHPMWDNNWFAOL-SFHVURJKSA-N 0 3 409.452 4.231 20 0 HIADHN O=C(Nc1ccccc1O)C1CCN(Cc2ccccc2OCC(F)(F)F)CC1 ZINC000534658440 932627920 /nfs/dbraw/zinc/62/79/20/932627920.db2.gz LUKVVWVBWSUQKM-UHFFFAOYSA-N 0 3 408.420 4.184 20 0 HIADHN Cc1c([C@H](C)NC(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)cnn1-c1ccc(F)cc1 ZINC000534682905 932653516 /nfs/dbraw/zinc/65/35/16/932653516.db2.gz PVMFVUVLFGVQIN-FNVCAUGXSA-N 0 3 421.520 4.125 20 0 HIADHN Cc1c([C@H](C)NC(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)cnn1-c1ccc(F)cc1 ZINC000534682906 932654113 /nfs/dbraw/zinc/65/41/13/932654113.db2.gz PVMFVUVLFGVQIN-GMWOSMDTSA-N 0 3 421.520 4.125 20 0 HIADHN CN1CC[C@H](NC(=O)NC2(c3ccc(Br)cc3)CC2)[C@H]1c1ccccc1 ZINC000534719695 932687301 /nfs/dbraw/zinc/68/73/01/932687301.db2.gz CHKLYEILACEXCK-RBUKOAKNSA-N 0 3 414.347 4.183 20 0 HIADHN CN1CC[C@@H](NC(=O)c2ccccc2-c2nc(C(C)(C)C)no2)[C@@H]1c1ccccc1 ZINC000534753689 932730451 /nfs/dbraw/zinc/73/04/51/932730451.db2.gz GGBUITGOZLBSIL-UXHICEINSA-N 0 3 404.514 4.209 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3Cc4ccccc4C(C)(C)C3)c(C)c2)CC1 ZINC000534774271 932754744 /nfs/dbraw/zinc/75/47/44/932754744.db2.gz VNDGQKQKUOJDLY-UHFFFAOYSA-N 0 3 406.574 4.462 20 0 HIADHN C[C@@H](CNC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1)c1nc(-c2ccccc2)no1 ZINC000534834917 932800982 /nfs/dbraw/zinc/80/09/82/932800982.db2.gz DCQTUXSBPXUJGE-PXNSSMCTSA-N 0 3 422.504 4.008 20 0 HIADHN CN(C)[C@H](CNC(=O)Nc1cccc(C(=O)NCc2ccccc2)c1)c1ccccc1 ZINC000534959636 932860025 /nfs/dbraw/zinc/86/00/25/932860025.db2.gz DLOYPMKXRBDNEF-HSZRJFAPSA-N 0 3 416.525 4.041 20 0 HIADHN C[C@@H]1CC(NC(=O)N(CCN(C)Cc2ccccc2)Cc2ccccc2)C[C@@H](C)O1 ZINC000535064864 932896413 /nfs/dbraw/zinc/89/64/13/932896413.db2.gz AVGKMKRNUXWPCU-NHCUHLMSSA-N 0 3 409.574 4.286 20 0 HIADHN O=C(CN1CC[C@@H](C2CCOCC2)C1)N[C@@H](c1ccccc1)c1ccc(Cl)cc1 ZINC000535117671 932934526 /nfs/dbraw/zinc/93/45/26/932934526.db2.gz VIWIXDVTKANXQX-QPPBQGQZSA-N 0 3 412.961 4.294 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)c1cn(-c2ccc(Br)cc2)cn1 ZINC000535158927 932975520 /nfs/dbraw/zinc/97/55/20/932975520.db2.gz UXPSBTWWMQCJBS-UHFFFAOYSA-N 0 3 413.319 4.257 20 0 HIADHN COc1cc(Cl)c(C)cc1NC(=O)CCNCc1cnc([C@H]2CCCO2)s1 ZINC000535187024 933002429 /nfs/dbraw/zinc/00/24/29/933002429.db2.gz WXKQQTUOTWNLMC-MRXNPFEDSA-N 0 3 409.939 4.083 20 0 HIADHN CCOc1ccc(Cl)cc1CCNC(=O)N(Cc1ccco1)C1CCN(C)CC1 ZINC000535222827 933027272 /nfs/dbraw/zinc/02/72/72/933027272.db2.gz YBUWHVBDYKXCCH-UHFFFAOYSA-N 0 3 419.953 4.180 20 0 HIADHN COc1ccc(CN(C(=O)NC[C@@H](Cc2ccccc2)N(C)C)[C@@H](C)C2CC2)cc1 ZINC000535260742 933040487 /nfs/dbraw/zinc/04/04/87/933040487.db2.gz KEGOLGOGICNGDG-WMZHIEFXSA-N 0 3 409.574 4.178 20 0 HIADHN Cc1cccn2cc(COc3ccc(CN[C@H]4CN(C)Cc5ccccc54)cc3)nc12 ZINC000535264712 933042686 /nfs/dbraw/zinc/04/26/86/933042686.db2.gz HALVIVVXQJNHAC-VWLOTQADSA-N 0 3 412.537 4.498 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)N1CCN(c2ccc(F)cc2Cl)CC1 ZINC000535309616 933064982 /nfs/dbraw/zinc/06/49/82/933064982.db2.gz UZIZHIHHDLLRJM-UHFFFAOYSA-N 0 3 415.896 4.249 20 0 HIADHN C[C@H](NC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1)c1nc2ccccc2n1C(F)F ZINC000535340422 933082299 /nfs/dbraw/zinc/08/22/99/933082299.db2.gz OCCRSJSOZDHAJD-FNHZYXHNSA-N 0 3 413.472 4.237 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)[C@H]1CC(=O)N(C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000535374232 933099379 /nfs/dbraw/zinc/09/93/79/933099379.db2.gz VOOYVZFRGANGKM-KKSFZXQISA-N 0 3 417.912 4.007 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)c2cc(N3CCCC3=O)cc(C(F)(F)F)c2)c1 ZINC000535414516 933124018 /nfs/dbraw/zinc/12/40/18/933124018.db2.gz SJVAFLAEDHAYEP-UHFFFAOYSA-N 0 3 419.447 4.455 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)c2cn(-c3nc(C)cc(C)n3)nc2C(C)C)c1 ZINC000535416742 933125184 /nfs/dbraw/zinc/12/51/84/933125184.db2.gz YOFNRSCUQNNFLQ-UHFFFAOYSA-N 0 3 406.534 4.025 20 0 HIADHN CN1CC[C@@H](NC(=O)NCc2ccnc(Oc3ccc(F)cc3)c2)[C@@H]1c1ccccc1 ZINC000535432086 933131676 /nfs/dbraw/zinc/13/16/76/933131676.db2.gz HWHXGFHUHBQYPM-GGAORHGYSA-N 0 3 420.488 4.258 20 0 HIADHN CN1CC[C@H](NC(=O)N(CCc2ccccc2)Cc2ccncc2)[C@@H]1c1ccccc1 ZINC000535436652 933134705 /nfs/dbraw/zinc/13/47/05/933134705.db2.gz NXGJKZWQNBVUBM-DQEYMECFSA-N 0 3 414.553 4.281 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cc(N2CCCC2=O)ccc1Cl)c1ccsc1 ZINC000535504388 933195826 /nfs/dbraw/zinc/19/58/26/933195826.db2.gz RLNPZRZINLLOQK-IBGZPJMESA-N 0 3 419.978 4.341 20 0 HIADHN Cc1cc(C(=O)N(CCN(C)Cc2ccccc2)Cc2ccccc2)nn1C(F)F ZINC000535596611 933260534 /nfs/dbraw/zinc/26/05/34/933260534.db2.gz BSKAHBACXSXFJG-UHFFFAOYSA-N 0 3 412.484 4.361 20 0 HIADHN COc1cccc(C(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)c1F ZINC000535606694 933264598 /nfs/dbraw/zinc/26/45/98/933264598.db2.gz NEMCFPFNSIRFJN-SFHVURJKSA-N 0 3 408.477 4.039 20 0 HIADHN COc1ccc(C[C@H](C)CN(C)C(=O)NC[C@H](c2cccs2)N2CCCC2)cc1 ZINC000535625898 933273317 /nfs/dbraw/zinc/27/33/17/933273317.db2.gz JYOSJCCPWHXYOE-GHTZIAJQSA-N 0 3 415.603 4.414 20 0 HIADHN CO[C@H](C)c1noc(CN2CCCN(Cc3cccc(-c4ccccc4C)c3)CC2)n1 ZINC000535798535 933394404 /nfs/dbraw/zinc/39/44/04/933394404.db2.gz NCNTZOOODSRCSI-HXUWFJFHSA-N 0 3 420.557 4.460 20 0 HIADHN C[C@@H](C(=O)Nc1ccc2c(c1)OC1(CCCCC1)O2)N1CC[C@H](C2CCOCC2)C1 ZINC000535871352 933453722 /nfs/dbraw/zinc/45/37/22/933453722.db2.gz SQMJTQWBTZPLMJ-HKUYNNGSSA-N 0 3 414.546 4.194 20 0 HIADHN COc1ccc(C2(CN[C@@H](C)c3ncc(Br)s3)CCOCC2)cc1 ZINC000535987962 933548961 /nfs/dbraw/zinc/54/89/61/933548961.db2.gz NIIXAFUAZKEKLS-ZDUSSCGKSA-N 0 3 411.365 4.313 20 0 HIADHN CCc1ccc(-c2nc(CC(=O)NC[C@H](Cc3ccccc3)N(C)C)cs2)cc1 ZINC000536017465 933574330 /nfs/dbraw/zinc/57/43/30/933574330.db2.gz MIKSUIHVVKPOJP-QFIPXVFZSA-N 0 3 407.583 4.204 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccc(O)cc1)C(=O)c1cnc(C(C)(C)C)s1 ZINC000536034863 933583754 /nfs/dbraw/zinc/58/37/54/933583754.db2.gz IZVWNBBFXDUICK-KRWDZBQOSA-N 0 3 401.576 4.273 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccc(O)cc1)C(=O)c1cnc(C(C)(C)C)s1 ZINC000536034871 933584834 /nfs/dbraw/zinc/58/48/34/933584834.db2.gz IZVWNBBFXDUICK-QGZVFWFLSA-N 0 3 401.576 4.273 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)Cc2cccc(OCc3cccnc3)c2)c1 ZINC000536114389 933663626 /nfs/dbraw/zinc/66/36/26/933663626.db2.gz WBKNCXDBTKXDKB-UHFFFAOYSA-N 0 3 417.553 4.102 20 0 HIADHN O=C(Nc1ccc(OC(F)(F)F)cc1)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000536137945 933682683 /nfs/dbraw/zinc/68/26/83/933682683.db2.gz YDTIPQONZZKJOK-UHFFFAOYSA-N 0 3 409.408 4.186 20 0 HIADHN O=C(CN[C@@H](c1ccccc1)C1CC1)N1CCC[C@@H]1c1ccc2c(c1)OCCCO2 ZINC000537288359 933698719 /nfs/dbraw/zinc/69/87/19/933698719.db2.gz UTCCGLTUXSTUBE-BWKNWUBXSA-N 0 3 406.526 4.252 20 0 HIADHN C[C@H](N[C@H](c1ccc2c(c1)OCCO2)C1CC1)C(=O)Nc1cccc2ncccc21 ZINC000537289869 933699731 /nfs/dbraw/zinc/69/97/31/933699731.db2.gz FEWNBDDYZBZXNM-WNSKOXEYSA-N 0 3 403.482 4.074 20 0 HIADHN C[C@@H](N[C@@H](c1ccc2c(c1)OCCO2)C1CC1)C(=O)Nc1cccc2ncccc21 ZINC000537289862 933700043 /nfs/dbraw/zinc/70/00/43/933700043.db2.gz FEWNBDDYZBZXNM-IQMFZBJNSA-N 0 3 403.482 4.074 20 0 HIADHN CC[C@@H](NCc1ccc(N2CCO[C@H](C)C2)nc1)c1cc(F)cc(Br)c1 ZINC000537294933 933702369 /nfs/dbraw/zinc/70/23/69/933702369.db2.gz HGHLFGBHSIZBBU-AUUYWEPGSA-N 0 3 422.342 4.449 20 0 HIADHN COc1sc(CN[C@H](C)[C@@H](OC)c2ccc(OC)cc2)cc1Br ZINC000537344812 933726936 /nfs/dbraw/zinc/72/69/36/933726936.db2.gz SHMRWUQEXTZGTE-BDJLRTHQSA-N 0 3 400.338 4.394 20 0 HIADHN CCN1CC[C@H](NCc2c(C)nc3sc(C)nn23)[C@H]1c1ccc(Cl)c(F)c1 ZINC000537353164 933731814 /nfs/dbraw/zinc/73/18/14/933731814.db2.gz ZXODFMFWNFWNAC-FUHWJXTLSA-N 0 3 407.946 4.125 20 0 HIADHN Cc1cc(C(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)nn1C1CCCCC1 ZINC000537355977 933733300 /nfs/dbraw/zinc/73/33/00/933733300.db2.gz CQXHFKBHTXHMHP-PMACEKPBSA-N 0 3 416.610 4.048 20 0 HIADHN CCN1CCN(c2ccc(N[C@H](C)c3cccc(N4CCOCC4)c3)c(C)c2)CC1 ZINC000537406994 933762019 /nfs/dbraw/zinc/76/20/19/933762019.db2.gz IPKBVJKMKXRINA-OAQYLSRUSA-N 0 3 408.590 4.147 20 0 HIADHN CC(C)[C@H](c1ccc(F)cc1)N(C)Cc1cc(=O)n2cc(Br)ccc2n1 ZINC000562425367 945073035 /nfs/dbraw/zinc/07/30/35/945073035.db2.gz QAOJXIRPXGYJFD-HXUWFJFHSA-N 0 3 418.310 4.425 20 0 HIADHN O=c1cc(CN2CC[C@H](c3cccc(Cl)c3)C2)nc2ccc(Br)cn12 ZINC000562427749 945074663 /nfs/dbraw/zinc/07/46/63/945074663.db2.gz WCIHJFSRTIKFOB-AWEZNQCLSA-N 0 3 418.722 4.100 20 0 HIADHN CN(C)c1noc([C@@H]2CCCN(Cc3cc4ccccc4nc3N3CCCCC3)C2)n1 ZINC000562488917 945088789 /nfs/dbraw/zinc/08/87/89/945088789.db2.gz FPJXUGWUPRGOTI-LJQANCHMSA-N 0 3 420.561 4.054 20 0 HIADHN CC(=O)Nc1cc(NC(=O)NC[C@H](c2ccc(CC(C)C)cc2)N(C)C)ccc1F ZINC000562881085 945139877 /nfs/dbraw/zinc/13/98/77/945139877.db2.gz UOGJWPPPEDBQOD-JOCHJYFZSA-N 0 3 414.525 4.407 20 0 HIADHN CCO[C@H]1C[C@@H](O)C12CCN(Cc1cn(-c3ccccc3)nc1-c1cccs1)CC2 ZINC000537615009 938333134 /nfs/dbraw/zinc/33/31/34/938333134.db2.gz IAALKGOPZCVGSF-YADHBBJMSA-N 0 3 423.582 4.353 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)cc1CN1CCC(CN2CCCCC2=O)CC1 ZINC000537634250 938341913 /nfs/dbraw/zinc/34/19/13/938341913.db2.gz UWSRVLRZXRNGNO-UHFFFAOYSA-N 0 3 400.954 4.059 20 0 HIADHN CCCOc1c(Cl)cc(CN2CC[C@H](N3CCN(C(C)C)CC3)C2)cc1OCC ZINC000537660928 938348906 /nfs/dbraw/zinc/34/89/06/938348906.db2.gz JPFANGKLGGKRIW-FQEVSTJZSA-N 0 3 424.029 4.128 20 0 HIADHN Brc1ccc2c(c1)C=C(CN1CCC(OC[C@H]3CCCCO3)CC1)CO2 ZINC000537662020 938349352 /nfs/dbraw/zinc/34/93/52/938349352.db2.gz ZSVINBIYBNHVRT-HXUWFJFHSA-N 0 3 422.363 4.275 20 0 HIADHN CCOc1cc(CN2CCC[C@@H](Cn3ccnn3)C2)ccc1OCc1ccccc1 ZINC000537695775 938357493 /nfs/dbraw/zinc/35/74/93/938357493.db2.gz BLPBOLMBNYMSOC-JOCHJYFZSA-N 0 3 406.530 4.168 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)c2cc(C3CC3)n(C(C)(C)C)n2)cc1 ZINC000537730337 938364847 /nfs/dbraw/zinc/36/48/47/938364847.db2.gz MVNPZEDLZVYQTG-OAQYLSRUSA-N 0 3 410.562 4.091 20 0 HIADHN O=C(Cc1cccc(OCc2cccnc2)c1)NC[C@H](c1cccs1)N1CCCC1 ZINC000537757728 938370659 /nfs/dbraw/zinc/37/06/59/938370659.db2.gz UCFYPUKFMZDPHX-JOCHJYFZSA-N 0 3 421.566 4.218 20 0 HIADHN COc1ccc(NC(=O)[C@H](NC[C@@H]2CCO[C@H](C)C2)c2ccccc2)cc1Cl ZINC000537775787 938374353 /nfs/dbraw/zinc/37/43/53/938374353.db2.gz RAMJADYSSJJGCE-WHSLLNHNSA-N 0 3 402.922 4.433 20 0 HIADHN COc1ccc(NC(=O)[C@H](NC[C@H]2CCO[C@@H](C)C2)c2ccccc2)cc1Cl ZINC000537775784 938374384 /nfs/dbraw/zinc/37/43/84/938374384.db2.gz RAMJADYSSJJGCE-CKJXQJPGSA-N 0 3 402.922 4.433 20 0 HIADHN O=C([C@H]1CC12CCN(Cc1ccc(OCc3ccncc3)cc1)CC2)N1CCCCC1 ZINC000537847192 938389136 /nfs/dbraw/zinc/38/91/36/938389136.db2.gz RBZLWUFJZJZRPY-XMMPIXPASA-N 0 3 419.569 4.275 20 0 HIADHN CS[C@@H]1CN(C(=O)c2ccc(COc3ccc4ccccc4c3)o2)C[C@@H]1N(C)C ZINC000537924069 938415583 /nfs/dbraw/zinc/41/55/83/938415583.db2.gz MUFCTVWZESOTAR-RBBKRZOGSA-N 0 3 410.539 4.129 20 0 HIADHN CCC[C@H](NCc1ccccc1CS(=O)(=O)N1CCCC1)c1ccc(OC)cc1 ZINC000537941863 938425696 /nfs/dbraw/zinc/42/56/96/938425696.db2.gz GQRBEJBWCTVNSS-QHCPKHFHSA-N 0 3 416.587 4.252 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)N[C@@H]2CC(=O)N(C)[C@@H]2c2ccc(F)c(F)c2)cc1 ZINC000537944455 938427141 /nfs/dbraw/zinc/42/71/41/938427141.db2.gz BGMQHFSBMRUXNR-NNIZRDCOSA-N 0 3 410.468 4.082 20 0 HIADHN Cc1nc(-c2ccccc2)sc1[C@H](C)NCCNS(=O)(=O)c1ccc(C)cc1 ZINC000537945093 938427909 /nfs/dbraw/zinc/42/79/09/938427909.db2.gz AKLHNXZFTOKKTB-INIZCTEOSA-N 0 3 415.584 4.056 20 0 HIADHN COc1ccc([C@@H](C)NC(=O)NC[C@@H](c2cccs2)N2CCCC2)c(C)c1OC ZINC000563308148 945174153 /nfs/dbraw/zinc/17/41/53/945174153.db2.gz PWQLORZVUULPDB-AEFFLSMTSA-N 0 3 417.575 4.271 20 0 HIADHN CCn1cc([C@@H](C)NCCOc2ccc(Br)cc2C(F)(F)F)cn1 ZINC000537959293 938434834 /nfs/dbraw/zinc/43/48/34/938434834.db2.gz AQAFTHDXTFVOOC-LLVKDONJSA-N 0 3 406.246 4.414 20 0 HIADHN COc1ccc(OC)c(NC(=O)C[C@@H](C)N[C@H]2CC(C)(C)Oc3cc(F)ccc32)c1 ZINC000537961378 938435321 /nfs/dbraw/zinc/43/53/21/938435321.db2.gz IMPDNHBPQQFSGM-KUHUBIRLSA-N 0 3 416.493 4.452 20 0 HIADHN COc1cc([C@H](C)N[C@H](C)[C@H](OC)c2ccc(Cl)cc2)ccc1S(C)(=O)=O ZINC000537969645 938439450 /nfs/dbraw/zinc/43/94/50/938439450.db2.gz JDFYKEFYSWPVRS-MNVSYLFESA-N 0 3 411.951 4.179 20 0 HIADHN C[C@@H](NCc1ccc(OCCO)cc1)c1cccc(OCc2cn3ccccc3n2)c1 ZINC000537972875 938441444 /nfs/dbraw/zinc/44/14/44/938441444.db2.gz HARGJGLVMGFFLP-LJQANCHMSA-N 0 3 417.509 4.135 20 0 HIADHN CCc1noc(-c2ccc(CCN[C@H](C)c3nnn(-c4ccc(F)cc4)c3C)cc2)n1 ZINC000537976450 938443828 /nfs/dbraw/zinc/44/38/28/938443828.db2.gz XPTUDXQAVDVEPR-OAHLLOKOSA-N 0 3 420.492 4.221 20 0 HIADHN COC(=O)COc1cccc(CN[C@H]2CCSc3ccc(Br)cc32)c1 ZINC000537982031 938447086 /nfs/dbraw/zinc/44/70/86/938447086.db2.gz HQKSUNYCMWWMHO-KRWDZBQOSA-N 0 3 422.344 4.328 20 0 HIADHN COc1ccc(CN2CC[C@@H](N[C@H](C)c3ccc(OC)c4ccccc43)C2=O)cc1 ZINC000537983184 938447999 /nfs/dbraw/zinc/44/79/99/938447999.db2.gz BCFICYWBEUNRFG-UZUQRXQVSA-N 0 3 404.510 4.309 20 0 HIADHN C[C@H](NCc1ccccc1OCC(=O)NC[C@@H]1CCCO1)c1ccc2c(c1)CCCC2 ZINC000537991844 938453308 /nfs/dbraw/zinc/45/33/08/938453308.db2.gz TWUIYPUTDHAKRY-CYFREDJKSA-N 0 3 422.569 4.090 20 0 HIADHN C[C@H](N[C@@H]1CC(=O)N(c2cccc(C(F)(F)F)c2)C1)c1ccc2c(c1)CCC(=O)N2 ZINC000538021840 938466751 /nfs/dbraw/zinc/46/67/51/938466751.db2.gz UZZCTWLMSRTFTD-SUMWQHHRSA-N 0 3 417.431 4.046 20 0 HIADHN CC(C)[C@H](NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)nc1)c1ccc2[nH]c(=O)oc2c1 ZINC000538062030 938491209 /nfs/dbraw/zinc/49/12/09/938491209.db2.gz KLEWFIZKUFFBHJ-MCFFVMPBSA-N 0 3 410.518 4.029 20 0 HIADHN Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)N[C@@H](C)c1ccc(S(N)(=O)=O)cc1 ZINC000538101026 938502335 /nfs/dbraw/zinc/50/23/35/938502335.db2.gz ZRZMWXCCGREQEE-GJZGRUSLSA-N 0 3 415.584 4.486 20 0 HIADHN COc1ccccc1[C@@H](NCc1ccc(C(=O)N2CCOCC2)cc1)C1CCCC1 ZINC000538101170 938502413 /nfs/dbraw/zinc/50/24/13/938502413.db2.gz QXUMLLXGDYGGMR-DEOSSOPVSA-N 0 3 408.542 4.189 20 0 HIADHN COc1cc([C@@H](C)N[C@@H](C)c2ccc(S(N)(=O)=O)cc2)ccc1OCCC(C)C ZINC000538116470 938506654 /nfs/dbraw/zinc/50/66/54/938506654.db2.gz LFTCSQMWBLFRTO-DLBZAZTESA-N 0 3 420.575 4.179 20 0 HIADHN Cc1ccc2[nH]c([C@@H]3CCCN([C@@H](C)C(=O)N4CCc5ccccc5C4)C3)nc2c1 ZINC000538120071 938508989 /nfs/dbraw/zinc/50/89/89/938508989.db2.gz MNSLRSZHJVDUPZ-GHTZIAJQSA-N 0 3 402.542 4.024 20 0 HIADHN Cc1ccc2nc([C@@H]3CCCN([C@@H](C)C(=O)N4CCc5ccccc5C4)C3)[nH]c2c1 ZINC000538120071 938508994 /nfs/dbraw/zinc/50/89/94/938508994.db2.gz MNSLRSZHJVDUPZ-GHTZIAJQSA-N 0 3 402.542 4.024 20 0 HIADHN Cc1ccccc1C(=O)NC1CCN(C(=O)CN[C@H](CC(C)C)c2ccccc2)CC1 ZINC000538140414 938518130 /nfs/dbraw/zinc/51/81/30/938518130.db2.gz KWYXFWDHXZEXSY-XMMPIXPASA-N 0 3 421.585 4.093 20 0 HIADHN CC(C)(C)C[C@H](NCC(=O)Nc1cc(S(C)(=O)=O)ccc1Cl)c1ccccc1 ZINC000538155799 938526292 /nfs/dbraw/zinc/52/62/92/938526292.db2.gz POIPTBBPDMXZNO-IBGZPJMESA-N 0 3 422.978 4.449 20 0 HIADHN CNC(=O)c1cccc(CN[C@@H](Cc2ccc(OC)c(OC)c2)c2ccccc2)c1 ZINC000538158830 938528447 /nfs/dbraw/zinc/52/84/47/938528447.db2.gz YLVPOHVCWZRRKQ-QFIPXVFZSA-N 0 3 404.510 4.137 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccccc1-n1cccn1)C(=O)Nc1ccc(OC(F)(F)F)cc1 ZINC000538160473 938529243 /nfs/dbraw/zinc/52/92/43/938529243.db2.gz ZRDHYEZKYSQSIS-LSDHHAIUSA-N 0 3 418.419 4.449 20 0 HIADHN NC(=O)c1ccc(NC(=O)CCN[C@H](CC(F)(F)F)c2ccccc2)cc1Cl ZINC000538180310 938540777 /nfs/dbraw/zinc/54/07/77/938540777.db2.gz NBRXUHMYPFVDAT-MRXNPFEDSA-N 0 3 413.827 4.051 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)N[C@@H]1CCO[C@@H]1c1ccc(Cl)cc1 ZINC000538191587 938547141 /nfs/dbraw/zinc/54/71/41/938547141.db2.gz PILRWRWCQGVNJO-RTBURBONSA-N 0 3 407.967 4.005 20 0 HIADHN O=C(CN[C@H](c1ccc(Cl)cc1)C1CCC1)NC[C@@H]1CCN(c2ccccc2)C1 ZINC000538206645 938554572 /nfs/dbraw/zinc/55/45/72/938554572.db2.gz PXAPCBVPUXPSMU-UUOWRZLLSA-N 0 3 411.977 4.414 20 0 HIADHN O=C(CN[C@@H](c1ccc(F)cc1)C1CCCC1)Nc1cccc(C(=O)NC2CC2)c1 ZINC000538210826 938557716 /nfs/dbraw/zinc/55/77/16/938557716.db2.gz LWGXIJIMUVWZNO-HSZRJFAPSA-N 0 3 409.505 4.178 20 0 HIADHN CS(=O)(=O)CCCN[C@@H](Cc1ccc(Cl)cc1Cl)c1ccc(F)cc1 ZINC000538216764 938560205 /nfs/dbraw/zinc/56/02/05/938560205.db2.gz ASVYEENFMKQCBV-SFHVURJKSA-N 0 3 404.334 4.441 20 0 HIADHN O=C(CN[C@@H](c1cccs1)C1CC1)Nc1ccnn1Cc1ccccc1Cl ZINC000538262726 938577925 /nfs/dbraw/zinc/57/79/25/938577925.db2.gz HMZVMGKQFYKJDH-HXUWFJFHSA-N 0 3 400.935 4.326 20 0 HIADHN CCN(CC)C(=O)C1(NCc2cc(Br)c(OC)s2)CCCCC1 ZINC000538315499 938590814 /nfs/dbraw/zinc/59/08/14/938590814.db2.gz HQRMEQJQYZKOHQ-UHFFFAOYSA-N 0 3 403.386 4.180 20 0 HIADHN CCOc1ccc([C@@H](C)NC(=O)CN[C@@H](c2ccc(F)c(C)c2)C2CC2)cc1OC ZINC000538320747 938591576 /nfs/dbraw/zinc/59/15/76/938591576.db2.gz NOPNOQHRWMNZAX-VOIUYBSRSA-N 0 3 414.521 4.460 20 0 HIADHN COc1ccc(OC)c([C@H](C)NC(=O)CN[C@@H](c2ccc(F)c(C)c2)C2CC2)c1 ZINC000538324535 938593008 /nfs/dbraw/zinc/59/30/08/938593008.db2.gz VXDYDQSDCBUQKL-NPMXOYFQSA-N 0 3 400.494 4.069 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2ccc(-c3noc(C(F)F)n3)cc2)N(C)C)cc1 ZINC000538346438 938599615 /nfs/dbraw/zinc/59/96/15/938599615.db2.gz QWCQQTWQTURTCJ-KRWDZBQOSA-N 0 3 400.429 4.015 20 0 HIADHN CC(C)(C)[C@@H](COc1ccccc1F)NCc1cc(=O)n2cc(Cl)ccc2n1 ZINC000538392775 938609943 /nfs/dbraw/zinc/60/99/43/938609943.db2.gz MWZGFDAKPXFETB-GOSISDBHSA-N 0 3 403.885 4.070 20 0 HIADHN CC[C@H](N[C@H](C)[C@@H](OC)c1ccccc1F)c1ccccc1OCC(=O)N(C)C ZINC000538406424 938612996 /nfs/dbraw/zinc/61/29/96/938612996.db2.gz DNVNCJUGRTUDPJ-NIJIEXERSA-N 0 3 402.510 4.110 20 0 HIADHN Brc1ccc(-c2c[nH]c(CN[C@@H]3[C@@H]4CCO[C@@H]4C34CCCC4)n2)cc1 ZINC000538422886 938617011 /nfs/dbraw/zinc/61/70/11/938617011.db2.gz SCCPYBROZVWTQB-IPELMVKDSA-N 0 3 402.336 4.277 20 0 HIADHN CN(C)Cc1cccc(NC(=O)C(=O)N[C@H]2C[C@H]3CCC(C)(C)c4cccc2c43)c1 ZINC000538483232 938632069 /nfs/dbraw/zinc/63/20/69/938632069.db2.gz DYRQLKBRTNGAJD-UTKZUKDTSA-N 0 3 405.542 4.103 20 0 HIADHN Cc1nn(C)c(C)c1CNCCOc1c(Cl)cc(Br)cc1Cl ZINC000538487547 938633235 /nfs/dbraw/zinc/63/32/35/938633235.db2.gz LWYQOVJFTIUJKU-UHFFFAOYSA-N 0 3 407.139 4.275 20 0 HIADHN CCN1CCN(Cc2ccc(N[C@H](C)c3ccc(-n4ccnc4C)cc3)cc2)CC1 ZINC000538539807 938644725 /nfs/dbraw/zinc/64/47/25/938644725.db2.gz ZIWBOSNJOUVUPO-HXUWFJFHSA-N 0 3 403.574 4.491 20 0 HIADHN Cc1cc(-c2nnc(CN3CCC[C@@H](c4nc(C5CCCCC5)n[nH]4)C3)o2)c(C)o1 ZINC000538665040 938678996 /nfs/dbraw/zinc/67/89/96/938678996.db2.gz UHZREXXOTOTQKM-QGZVFWFLSA-N 0 3 410.522 4.492 20 0 HIADHN Cc1cc(-c2nnc(CN3CCC[C@@H](c4n[nH]c(C5CCCCC5)n4)C3)o2)c(C)o1 ZINC000538665040 938678998 /nfs/dbraw/zinc/67/89/98/938678998.db2.gz UHZREXXOTOTQKM-QGZVFWFLSA-N 0 3 410.522 4.492 20 0 HIADHN COCCCOC1CCN(Cc2c(C)nn(Cc3ccc(Cl)cc3)c2C)CC1 ZINC000538718821 938690320 /nfs/dbraw/zinc/69/03/20/938690320.db2.gz QAGYBHMCWAOIJF-UHFFFAOYSA-N 0 3 405.970 4.219 20 0 HIADHN CC(C)(C)c1ccc(-c2ccc(CN3CCC([C@]4(C)NC(=O)NC4=O)CC3)o2)cc1 ZINC000538722882 938691248 /nfs/dbraw/zinc/69/12/48/938691248.db2.gz WJZONVLIIQRTSG-DEOSSOPVSA-N 0 3 409.530 4.054 20 0 HIADHN CCOc1cc(CN2CC[C@H]2Cc2ccccc2)ccc1OCC(=O)N1CCCCC1 ZINC000538722377 938691391 /nfs/dbraw/zinc/69/13/91/938691391.db2.gz MVNSXLLSDMJPSG-QHCPKHFHSA-N 0 3 422.569 4.294 20 0 HIADHN COc1ccc(CN(CCO)[C@H]2CCc3ccccc32)cc1OCc1cccnc1 ZINC000538732510 938695602 /nfs/dbraw/zinc/69/56/02/938695602.db2.gz SVJMSUGVCUYYEK-QHCPKHFHSA-N 0 3 404.510 4.151 20 0 HIADHN COc1cc(N[C@@H]2CCCN(Cc3cc(OC)c(OC)cc3C)C2)cc(OC)c1 ZINC000538750824 938701626 /nfs/dbraw/zinc/70/16/26/938701626.db2.gz APNUTTZCMWUZQK-GOSISDBHSA-N 0 3 400.519 4.106 20 0 HIADHN COc1cc(CN2CC[C@@H](C3CCOCC3)C2)cc(Br)c1OC(F)F ZINC000538751105 938702206 /nfs/dbraw/zinc/70/22/06/938702206.db2.gz PNWXCJGTIWRNHL-CQSZACIVSA-N 0 3 420.294 4.308 20 0 HIADHN CCCN(C(=O)c1cccs1)C1CCN(Cc2cccc(OCCOC)c2)CC1 ZINC000538798883 938715124 /nfs/dbraw/zinc/71/51/24/938715124.db2.gz CHCHEEBYDULCHG-UHFFFAOYSA-N 0 3 416.587 4.290 20 0 HIADHN Cc1cc(N2CCN(C)CC2)ccc1NCc1ccccc1OCc1cccnc1 ZINC000538824007 938720519 /nfs/dbraw/zinc/72/05/19/938720519.db2.gz XXZJGYKTUMMLKG-UHFFFAOYSA-N 0 3 402.542 4.333 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)Cc2cccc(OCc3cccnc3)c2)C1 ZINC000538839837 938723173 /nfs/dbraw/zinc/72/31/73/938723173.db2.gz BGFFFYAPUUMQEU-RDPSFJRHSA-N 0 3 415.537 4.155 20 0 HIADHN COCCc1nc(C)c([C@@H](C)NCc2ccc(CN3C[C@@H](C)O[C@@H](C)C3)cc2)s1 ZINC000538867698 938728271 /nfs/dbraw/zinc/72/82/71/938728271.db2.gz PFXTXNFIXDWDED-FGTMMUONSA-N 0 3 417.619 4.100 20 0 HIADHN Cc1cc(NC(=O)N[C@@H]2CC23CCCCC3)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000538947555 938745296 /nfs/dbraw/zinc/74/52/96/938745296.db2.gz CUFMLBNMGKODET-NHCUHLMSSA-N 0 3 407.562 4.483 20 0 HIADHN COc1ccc(CN(CC(=O)Nc2c(C)n[nH]c2C)[C@H]2CCCC[C@H]2C)cc1OC ZINC000538955471 938748841 /nfs/dbraw/zinc/74/88/41/938748841.db2.gz HEOQVIJRVNWNOQ-BEFAXECRSA-N 0 3 414.550 4.063 20 0 HIADHN CC(C)[C@@](C)(CO)NCC(=O)Nc1nc(-c2ccc(Cl)cc2Cl)cs1 ZINC000563484217 945200913 /nfs/dbraw/zinc/20/09/13/945200913.db2.gz VNMKLRUWYZZZIM-QGZVFWFLSA-N 0 3 402.347 4.052 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)N[C@H](c1ccccc1)[C@@H]1CCOC1 ZINC000538996244 938763753 /nfs/dbraw/zinc/76/37/53/938763753.db2.gz GNLYRUZZIFWUJR-AGILITTLSA-N 0 3 407.558 4.070 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N[C@@H](c2ccccc2)[C@@H]2CCOC2)N2CCCC2)cc1 ZINC000538999441 938764865 /nfs/dbraw/zinc/76/48/65/938764865.db2.gz RIPDZCNJRAJCQU-SGNDLWITSA-N 0 3 407.558 4.209 20 0 HIADHN CCN1C[C@H](C)N(C(=O)Nc2ccc3nc(C(F)(F)C(F)(F)F)[nH]c3c2)C[C@H]1C ZINC000539010840 938768013 /nfs/dbraw/zinc/76/80/13/938768013.db2.gz MPTCWFRZELTUAF-MNOVXSKESA-N 0 3 419.398 4.163 20 0 HIADHN CCN1C[C@@H](C)N(C(=O)Nc2ccc3nc(C(F)(F)C(F)(F)F)[nH]c3c2)C[C@H]1C ZINC000539010839 938768063 /nfs/dbraw/zinc/76/80/63/938768063.db2.gz MPTCWFRZELTUAF-GHMZBOCLSA-N 0 3 419.398 4.163 20 0 HIADHN C[C@H](Cn1ncc2ccccc2c1=O)N[C@@H](C)c1ccc(Br)c(F)c1 ZINC000539040424 938777841 /nfs/dbraw/zinc/77/78/41/938777841.db2.gz AYLVLSSIGMYRIS-OLZOCXBDSA-N 0 3 404.283 4.037 20 0 HIADHN C[C@H]1CCc2c(F)cccc2[C@@H]1NCc1ccccc1CS(=O)(=O)N1CCCC1 ZINC000539043217 938779325 /nfs/dbraw/zinc/77/93/25/938779325.db2.gz GAVIHTSDXSLKIU-GAJHUEQPSA-N 0 3 416.562 4.165 20 0 HIADHN Cc1c([C@H](C)N[C@@H](C)Cn2ncc3ccccc3c2=O)cnn1-c1cccc(Cl)c1 ZINC000539044989 938780298 /nfs/dbraw/zinc/78/02/98/938780298.db2.gz XMGDJLLESGBBTL-HOTGVXAUSA-N 0 3 421.932 4.283 20 0 HIADHN C[C@H](NCc1ccccc1CS(=O)(=O)N1CCCC1)c1ccc(OC(F)F)cc1 ZINC000539044952 938780543 /nfs/dbraw/zinc/78/05/43/938780543.db2.gz ZYJMZOKIZQXMSA-INIZCTEOSA-N 0 3 424.513 4.064 20 0 HIADHN CC[C@H](NCc1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1)c1cccc(Cl)c1 ZINC000539044996 938781172 /nfs/dbraw/zinc/78/11/72/938781172.db2.gz XTJCUIHCJVZJKQ-CTNGQTDRSA-N 0 3 422.978 4.038 20 0 HIADHN C[C@H](CN[C@H](C)c1ccc(-n2cncn2)cc1Cl)c1nc(-c2ccccc2)no1 ZINC000539052052 938783811 /nfs/dbraw/zinc/78/38/11/938783811.db2.gz DUIHWIADVQTJAM-HUUCEWRRSA-N 0 3 408.893 4.425 20 0 HIADHN C[C@H](NC[C@H](CO)Cc1ccc(OC(F)(F)F)cc1)c1nc2c(s1)CCCC2 ZINC000539059632 938786930 /nfs/dbraw/zinc/78/69/30/938786930.db2.gz CWJPYPURLZKYQY-DZGCQCFKSA-N 0 3 414.493 4.422 20 0 HIADHN Cc1ccc2c(c1)OCCC[C@@H]2NC[C@@H](O)COc1ccccc1Br ZINC000539064415 938790112 /nfs/dbraw/zinc/79/01/12/938790112.db2.gz APWIRTJNSTTXTB-QAPCUYQASA-N 0 3 406.320 4.001 20 0 HIADHN Cc1ccc(C(=O)NCCN[C@H](C)c2ccc(OC[C@H]3CCCCO3)c(F)c2)cc1 ZINC000539067210 938791543 /nfs/dbraw/zinc/79/15/43/938791543.db2.gz CCBZENQIILNNKG-WIYYLYMNSA-N 0 3 414.521 4.163 20 0 HIADHN COc1cc(OC)c([C@H](C)NC[C@@H](c2ccc(OC)c(OC)c2)N(C)C)cc1Cl ZINC000539072236 938794251 /nfs/dbraw/zinc/79/42/51/938794251.db2.gz OOHYPFJWBAQWNM-KSSFIOAISA-N 0 3 422.953 4.328 20 0 HIADHN Cc1c([C@@H](C)NC2CCN(C(=O)c3ccccc3)CC2)nnn1-c1cccc(Cl)c1 ZINC000539075071 938795182 /nfs/dbraw/zinc/79/51/82/938795182.db2.gz SQLSYTBXVWSZQW-MRXNPFEDSA-N 0 3 423.948 4.185 20 0 HIADHN COCC[C@@H](NCc1cc(Br)c(OC)c(OC)c1)c1ccc(F)cc1 ZINC000539078175 938797045 /nfs/dbraw/zinc/79/70/45/938797045.db2.gz DQEUABNKRGCDEC-QGZVFWFLSA-N 0 3 412.299 4.473 20 0 HIADHN CCS(=O)(=O)Nc1ccc([C@H](C)NCc2ccc(Br)c(F)c2)cc1 ZINC000539081684 938798403 /nfs/dbraw/zinc/79/84/03/938798403.db2.gz OYZAKRAYRGTCDI-LBPRGKRZSA-N 0 3 415.328 4.201 20 0 HIADHN COc1ccc([C@H](C)NCCc2nc(-c3cccc(Cl)c3)no2)cc1NC(C)=O ZINC000539083066 938799121 /nfs/dbraw/zinc/79/91/21/938799121.db2.gz LRYCVLXSLYLVOA-ZDUSSCGKSA-N 0 3 414.893 4.250 20 0 HIADHN Clc1cc(Br)cc2c1CC[C@H]2NCc1ccc(-n2cncn2)cc1 ZINC000539087181 938800216 /nfs/dbraw/zinc/80/02/16/938800216.db2.gz FKBONXOABQBSQH-GOSISDBHSA-N 0 3 403.711 4.460 20 0 HIADHN COCCOc1ccc([C@H](C)N[C@@H](c2ccc3c(c2)OCCO3)C2CC2)cc1OC ZINC000539089751 938800493 /nfs/dbraw/zinc/80/04/93/938800493.db2.gz GIOPXHPZBPYTTA-UPCLLVRISA-N 0 3 413.514 4.294 20 0 HIADHN C[C@H](NCc1cccc(C(=O)NCc2ccco2)c1)c1ccc(-n2cccn2)cc1 ZINC000539090234 938800724 /nfs/dbraw/zinc/80/07/24/938800724.db2.gz KWVGKYFIUSLNHR-SFHVURJKSA-N 0 3 400.482 4.246 20 0 HIADHN CC[C@H](C(=O)N1CCC(NCc2ccn(-c3ccccc3)n2)CC1)c1ccccc1 ZINC000539103812 938803484 /nfs/dbraw/zinc/80/34/84/938803484.db2.gz MCJNJDFRAKXVSF-DEOSSOPVSA-N 0 3 402.542 4.147 20 0 HIADHN CCN1CC[C@@H](NC(=O)c2cccc(CN(C)C)c2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000539128278 938807625 /nfs/dbraw/zinc/80/76/25/938807625.db2.gz QMBAIBWYYYCRJB-RTWAWAEBSA-N 0 3 403.929 4.106 20 0 HIADHN CN(C(=O)Nc1ccc(F)cc1OCC(F)F)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000539153277 938812530 /nfs/dbraw/zinc/81/25/30/938812530.db2.gz PYOLFKNFUIAUIP-QGZVFWFLSA-N 0 3 407.436 4.208 20 0 HIADHN Cc1cc([C@H](NCc2ccccc2CS(=O)(=O)N2CCCC2)C2CC2)ccc1F ZINC000539217677 938820182 /nfs/dbraw/zinc/82/01/82/938820182.db2.gz ZNZGBAWAMZFLKY-HSZRJFAPSA-N 0 3 416.562 4.301 20 0 HIADHN Cc1ccccc1CCNC(=O)[C@@H](C)N[C@@H](C)c1ccc(OCc2cccnc2)cc1 ZINC000539226452 938821676 /nfs/dbraw/zinc/82/16/76/938821676.db2.gz NYZYIALBJIZLRI-LEWJYISDSA-N 0 3 417.553 4.367 20 0 HIADHN Cc1cccc(OC[C@@H](O)CN[C@@H](C)c2cccc(NC(=O)c3ccccc3)c2)c1 ZINC000539232686 938822716 /nfs/dbraw/zinc/82/27/16/938822716.db2.gz CNHTZBWKEFCHNS-CVDCTZTESA-N 0 3 404.510 4.338 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)N[C@H]1CCO[C@H]1c1ccc(Cl)cc1 ZINC000539250503 938825827 /nfs/dbraw/zinc/82/58/27/938825827.db2.gz AOHKTYWXNOWTLY-BDTNDASRSA-N 0 3 413.949 4.306 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)N[C@H]1CCO[C@@H]1c1ccc(Cl)cc1 ZINC000539250504 938825853 /nfs/dbraw/zinc/82/58/53/938825853.db2.gz AOHKTYWXNOWTLY-BHDDXSALSA-N 0 3 413.949 4.306 20 0 HIADHN COc1cc(NC(=O)CN[C@@H](CC(C)C)c2ccccc2C)cc(OC)c1OC ZINC000539259846 938828917 /nfs/dbraw/zinc/82/89/17/938828917.db2.gz ZTLDBSVTGIQKBQ-IBGZPJMESA-N 0 3 400.519 4.336 20 0 HIADHN C[C@H](C1CC1)N(Cc1ccccc1)C(=O)CN[C@@H](C)c1ccccc1-n1cccn1 ZINC000539260021 938828930 /nfs/dbraw/zinc/82/89/30/938828930.db2.gz NVEQIQNEQCFNHP-VQTJNVASSA-N 0 3 402.542 4.350 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(OCC(F)(F)F)cc1)C(=O)N[C@@H]1CCOc2ccccc21 ZINC000539265991 938830067 /nfs/dbraw/zinc/83/00/67/938830067.db2.gz XMHNLNQWJNERDZ-YZVOILCLSA-N 0 3 422.447 4.307 20 0 HIADHN COc1cc(F)c([C@H](C)NC[C@H](O)CO[C@@H](C)c2ccc(Cl)cc2)cc1OC ZINC000539286845 938833877 /nfs/dbraw/zinc/83/38/77/938833877.db2.gz OMYZZFVOQGIUGS-ZQIUZPCESA-N 0 3 411.901 4.286 20 0 HIADHN C[C@H](NCC(=O)Nc1ccc(OC(F)F)c(Cl)c1)c1cccc(-n2cccn2)c1 ZINC000539286823 938833910 /nfs/dbraw/zinc/83/39/10/938833910.db2.gz OLAJUBKMOHJVAZ-ZDUSSCGKSA-N 0 3 420.847 4.416 20 0 HIADHN COc1cc(F)c([C@H](C)NC[C@@H](O)CO[C@@H](C)c2ccc(Cl)cc2)cc1OC ZINC000539286837 938833925 /nfs/dbraw/zinc/83/39/25/938833925.db2.gz OMYZZFVOQGIUGS-GRDNDAEWSA-N 0 3 411.901 4.286 20 0 HIADHN COc1cc(F)c([C@H](C)NC[C@H](O)Cc2ccc(C(F)(F)F)cc2)cc1OC ZINC000539288725 938834115 /nfs/dbraw/zinc/83/41/15/938834115.db2.gz DUZSOWRUJJONCX-SWLSCSKDSA-N 0 3 401.400 4.116 20 0 HIADHN C[C@H](NCc1cccc(C(=O)NCc2ccco2)c1)c1cccc(-n2cccn2)c1 ZINC000539288466 938834294 /nfs/dbraw/zinc/83/42/94/938834294.db2.gz JKDQZWPVSYOIPL-SFHVURJKSA-N 0 3 400.482 4.246 20 0 HIADHN COc1ccc([C@H](NC2CCN(CC(F)(F)F)CC2)c2ccccc2OC)cc1 ZINC000539295883 938835584 /nfs/dbraw/zinc/83/55/84/938835584.db2.gz UVPHAAJBQUTNGO-NRFANRHFSA-N 0 3 408.464 4.410 20 0 HIADHN O=C(CN[C@H](c1ccccc1)[C@@H]1CCOC1)N[C@H](c1cccs1)c1ccc(F)cc1 ZINC000539297584 938835950 /nfs/dbraw/zinc/83/59/50/938835950.db2.gz HGKAKKNBWISVKQ-FOVJLYNBSA-N 0 3 424.541 4.460 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)N[C@H]1CCO[C@@H]1c1ccc(Cl)cc1 ZINC000539299895 938836497 /nfs/dbraw/zinc/83/64/97/938836497.db2.gz VFXWIGQMXPUBRM-BHDDXSALSA-N 0 3 413.949 4.306 20 0 HIADHN CC(C)COc1ccc(C(C)(C)NCC(=O)NC[C@H]2CCN(c3ccccc3)C2)cc1 ZINC000539317117 938840080 /nfs/dbraw/zinc/84/00/80/938840080.db2.gz MONRCTLXXJLGGG-OAQYLSRUSA-N 0 3 423.601 4.189 20 0 HIADHN CC(C)(C)[C@H](NCCC(=O)Nc1ccc(C(N)=O)c(Cl)c1)c1ccc(F)cc1F ZINC000539324765 938841385 /nfs/dbraw/zinc/84/13/85/938841385.db2.gz FKZIZAXIWONOKP-LJQANCHMSA-N 0 3 423.891 4.423 20 0 HIADHN CC(C)[C@@H](NCCC(=O)Nc1ccc(N2CCCC2=O)cc1)c1ccc(F)cc1F ZINC000539324997 938841663 /nfs/dbraw/zinc/84/16/63/938841663.db2.gz FFEBLDJVCMRMOG-HSZRJFAPSA-N 0 3 415.484 4.407 20 0 HIADHN C[C@@H](NCC(=O)N[C@H](C)c1ccc(Cl)c(Cl)c1)c1ccc(-n2ccnn2)cc1 ZINC000539330524 938842991 /nfs/dbraw/zinc/84/29/91/938842991.db2.gz QZCCYEPCDODZKX-ZIAGYGMSSA-N 0 3 418.328 4.102 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(-c2cccnc2)cc1)C(=O)N[C@@H]1CCOc2ccccc21 ZINC000539332286 938843216 /nfs/dbraw/zinc/84/32/16/938843216.db2.gz OYMFYBPVIPPLTL-IUKKYPGJSA-N 0 3 401.510 4.428 20 0 HIADHN COc1cc(OC)cc(N2CC[C@@H](N[C@H](C)c3ccc(-c4cccnc4)cc3)C2=O)c1 ZINC000539334725 938843600 /nfs/dbraw/zinc/84/36/00/938843600.db2.gz HKTZHKIXAMMVRM-MZNJEOGPSA-N 0 3 417.509 4.222 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(-n2cccn2)cc1)C(=O)N(C)Cc1nc2ccccc2s1 ZINC000539336346 938844060 /nfs/dbraw/zinc/84/40/60/938844060.db2.gz IGEQCDLPRAQBJD-IAGOWNOFSA-N 0 3 419.554 4.180 20 0 HIADHN C[C@@H](NCC(=O)N(Cc1ccccc1)CC(F)(F)F)c1ccc(-n2cccn2)cc1 ZINC000539337432 938844444 /nfs/dbraw/zinc/84/44/44/938844444.db2.gz RRCJNEHCEDPUSV-QGZVFWFLSA-N 0 3 416.447 4.114 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)NCC(=O)Nc2ccc(OC(F)(F)F)cc2)cc1 ZINC000539363931 938849010 /nfs/dbraw/zinc/84/90/10/938849010.db2.gz WUFBIANDXXKIDE-AWEZNQCLSA-N 0 3 418.419 4.369 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)NCCc1c[nH]c2ccccc12)c1cccc(N2CCCC2)c1 ZINC000539379932 938851874 /nfs/dbraw/zinc/85/18/74/938851874.db2.gz JRFPNDUWKIJUAA-MOPGFXCFSA-N 0 3 404.558 4.166 20 0 HIADHN CCC(CC)n1nc(C)cc1C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000539382912 938852141 /nfs/dbraw/zinc/85/21/41/938852141.db2.gz VZLXTLYLNMTMSU-OAQYLSRUSA-N 0 3 420.561 4.448 20 0 HIADHN Cc1cc(NC(=O)N(CCN(C)C)Cc2cccc(F)c2)nn1-c1ccc(C)cc1 ZINC000539425835 938858933 /nfs/dbraw/zinc/85/89/33/938858933.db2.gz ZWQHMBPLTUNXTL-UHFFFAOYSA-N 0 3 409.509 4.224 20 0 HIADHN COC(=O)[C@@H]1CCCC[C@@]1(C)NCc1ccnc(-c2ccc(Br)cc2)n1 ZINC000539479086 938866300 /nfs/dbraw/zinc/86/63/00/938866300.db2.gz FBUOSMLWVIOCCQ-FXAWDEMLSA-N 0 3 418.335 4.118 20 0 HIADHN COc1ccc([C@@H](NCC(=O)Nc2cc(C)nn2-c2ccccc2F)C2CC2)cc1 ZINC000539491908 938867904 /nfs/dbraw/zinc/86/79/04/938867904.db2.gz WTTMNJSMLFNOJP-QHCPKHFHSA-N 0 3 408.477 4.008 20 0 HIADHN CC[C@@H](NCc1ccc(CS(C)(=O)=O)cc1)c1cc(F)cc(Br)c1 ZINC000539499409 938869144 /nfs/dbraw/zinc/86/91/44/938869144.db2.gz GKILHIXWIUNSFF-GOSISDBHSA-N 0 3 414.340 4.374 20 0 HIADHN COC(=O)[C@@H](C)Oc1ccc(CN[C@@H]2CCc3c2cccc3Br)cc1 ZINC000539503547 938869731 /nfs/dbraw/zinc/86/97/31/938869731.db2.gz DIFVFICIBCOOJG-BFUOFWGJSA-N 0 3 404.304 4.167 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@H](C)N[C@H](C)[C@@H](OC)c2ccccc2F)cc1 ZINC000539507076 938870439 /nfs/dbraw/zinc/87/04/39/938870439.db2.gz QYFYQUWLPIHNGL-GSHUGGBRSA-N 0 3 422.566 4.283 20 0 HIADHN C[C@@H](NCCc1ccc(S(=O)(=O)N2CCCCC2)s1)c1cccc(F)c1F ZINC000539545575 938877575 /nfs/dbraw/zinc/87/75/75/938877575.db2.gz VJMXIABDBTUPGH-CQSZACIVSA-N 0 3 414.543 4.094 20 0 HIADHN CC(C)c1cccc(-c2ccc(C(=O)N3CC[C@@H](N4CCN(C)CC4)[C@H](C)C3)o2)c1 ZINC000539590331 938884539 /nfs/dbraw/zinc/88/45/39/938884539.db2.gz CELGBGMEKQHVRN-DENIHFKCSA-N 0 3 409.574 4.168 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)Nc1ccnc(OCC(F)(F)F)c1 ZINC000539592415 938885038 /nfs/dbraw/zinc/88/50/38/938885038.db2.gz WPUATKKSNYXBIF-CQSZACIVSA-N 0 3 414.453 4.043 20 0 HIADHN Cc1ccc(SC2CCCC2)c(C(=O)N2CC[C@H](N3CCN(C(C)C)CC3)C2)c1 ZINC000539597948 938885890 /nfs/dbraw/zinc/88/58/90/938885890.db2.gz ZXDICQMLMKBLRO-FQEVSTJZSA-N 0 3 415.647 4.270 20 0 HIADHN Fc1ccc(Br)c2c1CC[C@H]2NCCc1csc(N2CCCC2)n1 ZINC000539602741 938886654 /nfs/dbraw/zinc/88/66/54/938886654.db2.gz QTAWGDPEIDQILY-MRXNPFEDSA-N 0 3 410.356 4.465 20 0 HIADHN O=C1Nc2ccccc2C12CCC(Nc1cccc(CN3CCSCC3)c1)CC2 ZINC000539690237 938902616 /nfs/dbraw/zinc/90/26/16/938902616.db2.gz VRVHBOOEYLPDQC-UHFFFAOYSA-N 0 3 407.583 4.480 20 0 HIADHN O=C(CCN1CCC(C(=O)Nc2ccc(Br)cc2)CC1)c1ccccc1 ZINC000539720416 938912146 /nfs/dbraw/zinc/91/21/46/938912146.db2.gz RYYALIXGOWZCKC-UHFFFAOYSA-N 0 3 415.331 4.373 20 0 HIADHN Cc1nc([C@@H]2CCCN([C@H](c3nc(-c4ccccc4)no3)c3ccccc3)C2)n[nH]1 ZINC000539762788 938927375 /nfs/dbraw/zinc/92/73/75/938927375.db2.gz ABWDRUNRSYXJGS-UXHICEINSA-N 0 3 400.486 4.132 20 0 HIADHN Cc1n[nH]c([C@@H]2CCCN([C@H](c3nc(-c4ccccc4)no3)c3ccccc3)C2)n1 ZINC000539762788 938927379 /nfs/dbraw/zinc/92/73/79/938927379.db2.gz ABWDRUNRSYXJGS-UXHICEINSA-N 0 3 400.486 4.132 20 0 HIADHN Cc1nnc([C@@H]2CCCN([C@H](c3nc(-c4ccccc4)no3)c3ccccc3)C2)[nH]1 ZINC000539762788 938927385 /nfs/dbraw/zinc/92/73/85/938927385.db2.gz ABWDRUNRSYXJGS-UXHICEINSA-N 0 3 400.486 4.132 20 0 HIADHN COCCC[C@H](C)C(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1 ZINC000539798313 938936976 /nfs/dbraw/zinc/93/69/76/938936976.db2.gz CVVCRIZQCCQAHA-NRFANRHFSA-N 0 3 409.574 4.053 20 0 HIADHN CS(=O)(=O)[C@@H]1CCC[C@@H](N[C@@H](c2ccccc2)c2ccc(OC(F)F)cc2)C1 ZINC000539813195 938940561 /nfs/dbraw/zinc/94/05/61/938940561.db2.gz SWJUARCZEPFQEK-RLLQIKCJSA-N 0 3 409.498 4.323 20 0 HIADHN CC(C)(C)n1cc(CN2CCC(CCC(N)=O)CC2)c(-c2ccccc2Cl)n1 ZINC000539818175 938942264 /nfs/dbraw/zinc/94/22/64/938942264.db2.gz HPZUJYAKTFARJO-UHFFFAOYSA-N 0 3 402.970 4.436 20 0 HIADHN CNC(=O)CC1CCN(Cc2cn(Cc3ccccc3)nc2-c2ccc(C)cc2)CC1 ZINC000539818748 938942523 /nfs/dbraw/zinc/94/25/23/938942523.db2.gz JPIBEOXFHPUHGP-UHFFFAOYSA-N 0 3 416.569 4.255 20 0 HIADHN COc1ccc(-c2nn(Cc3ccccc3)cc2CN(C)CCSC)cc1OC ZINC000539827125 938948300 /nfs/dbraw/zinc/94/83/00/938948300.db2.gz AOYRHKBNJJIJPP-UHFFFAOYSA-N 0 3 411.571 4.410 20 0 HIADHN COc1cc(CN2CCC(C(=O)N(Cc3ccccc3)C3CC3)CC2)cc(OC)c1 ZINC000539838377 938953940 /nfs/dbraw/zinc/95/39/40/938953940.db2.gz UYAHLHFHGOJWAU-UHFFFAOYSA-N 0 3 408.542 4.107 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)CCn2c3ccccc3nc2C2CC2)CC1 ZINC000539843955 938955932 /nfs/dbraw/zinc/95/59/32/938955932.db2.gz MJPAVKIVSBRFIX-UHFFFAOYSA-N 0 3 406.530 4.020 20 0 HIADHN CC(=O)N1CC[C@@H](CN(C)Cc2cn(-c3ccccc3Cl)nc2C(C)(C)C)C1 ZINC000539895842 938970654 /nfs/dbraw/zinc/97/06/54/938970654.db2.gz XXMSNCXCJQKYPH-KRWDZBQOSA-N 0 3 402.970 4.123 20 0 HIADHN COC(=O)[C@@H](O)C1CCN(Cc2ccc(-c3ccc(C(F)(F)F)cc3)s2)CC1 ZINC000539902545 938974332 /nfs/dbraw/zinc/97/43/32/938974332.db2.gz SYOVWLLABNCINP-SFHVURJKSA-N 0 3 413.461 4.180 20 0 HIADHN O=C(Nc1cccc(CN2CCS[C@@H]3COCC[C@@H]32)c1)c1ccccc1Cl ZINC000539909611 938976168 /nfs/dbraw/zinc/97/61/68/938976168.db2.gz FNVWFAKRISDFTD-VQTJNVASSA-N 0 3 402.947 4.299 20 0 HIADHN O=C(Nc1cccc(CN2CCS[C@@H]3COCC[C@H]32)c1)c1ccc(Cl)cc1 ZINC000539909762 938976248 /nfs/dbraw/zinc/97/62/48/938976248.db2.gz HNIJCARFHJYBKA-WOJBJXKFSA-N 0 3 402.947 4.299 20 0 HIADHN COCCc1nc(C)c([C@@H](C)NC[C@@H](O)COc2cccc(Cl)c2Cl)s1 ZINC000539968384 938982401 /nfs/dbraw/zinc/98/24/01/938982401.db2.gz SPKTZRSTJIRAPP-DGCLKSJQSA-N 0 3 419.374 4.038 20 0 HIADHN CN(C)c1ncc(CNc2cccc(N3CCN(CCc4ccccc4)CC3)c2)s1 ZINC000539979137 939028750 /nfs/dbraw/zinc/02/87/50/939028750.db2.gz VZXCEIBRVADJPV-UHFFFAOYSA-N 0 3 421.614 4.186 20 0 HIADHN c1nc(CNc2ccc3nc(CCN4CCOCC4)[nH]c3c2)sc1-c1ccccc1 ZINC000539978445 939028781 /nfs/dbraw/zinc/02/87/81/939028781.db2.gz DDYVLFKMWQZRJF-UHFFFAOYSA-N 0 3 419.554 4.173 20 0 HIADHN Cc1cncc(C(=O)Nc2cccc(N3CCN(CCc4ccccc4)CC3)c2)c1 ZINC000540019096 939040908 /nfs/dbraw/zinc/04/09/08/939040908.db2.gz YRGMPYMLWFPRQT-UHFFFAOYSA-N 0 3 400.526 4.007 20 0 HIADHN O=C(CCc1ccccn1)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1 ZINC000540030994 939044419 /nfs/dbraw/zinc/04/44/19/939044419.db2.gz MYHZOYAPHDWDRA-UHFFFAOYSA-N 0 3 414.553 4.018 20 0 HIADHN Cc1c(F)cccc1NC(=O)CCN1CC[C@H](Oc2ccc(C(F)(F)F)cn2)C1 ZINC000540054940 939052021 /nfs/dbraw/zinc/05/20/21/939052021.db2.gz FBTOHNVMAOZNAY-HNNXBMFYSA-N 0 3 411.399 4.030 20 0 HIADHN CCc1nc2ccccc2n1C1CCN(CCCn2c3ccccc3[nH]c2=O)CC1 ZINC000540057147 939053333 /nfs/dbraw/zinc/05/33/33/939053333.db2.gz VIFHIYFHXGJSSJ-UHFFFAOYSA-N 0 3 403.530 4.381 20 0 HIADHN Brc1cc(CN[C@H](c2ccccc2)[C@H]2CCOC2)cc2c1OCCCO2 ZINC000540067904 939057165 /nfs/dbraw/zinc/05/71/65/939057165.db2.gz DNGMEVNZJSZDCM-FXAWDEMLSA-N 0 3 418.331 4.478 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2ccc3nc(C(F)F)[nH]c3c2)N2CCCC2)o1 ZINC000540079992 939061605 /nfs/dbraw/zinc/06/16/05/939061605.db2.gz MOEPHLMGEHNHNY-MRXNPFEDSA-N 0 3 403.433 4.361 20 0 HIADHN C[C@H](NC[C@H](c1ccc(Cl)cc1)N1CCOCC1)c1nc2c(s1)CCCC2 ZINC000540085231 939064491 /nfs/dbraw/zinc/06/44/91/939064491.db2.gz NKXFFENQGPXALI-HNAYVOBHSA-N 0 3 405.995 4.399 20 0 HIADHN CCCN(C(=O)N[C@@H]1CCO[C@H](C(C)C)C1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000540085314 939064621 /nfs/dbraw/zinc/06/46/21/939064621.db2.gz WKQATSNAHYSMIM-VJBWXMMDSA-N 0 3 401.595 4.276 20 0 HIADHN C[C@H](NCc1ccc(S(=O)(=O)N2CCCC2)cc1)c1ccccc1C(F)(F)F ZINC000540119483 939079761 /nfs/dbraw/zinc/07/97/61/939079761.db2.gz BYSFULXPBOGXKQ-HNNXBMFYSA-N 0 3 412.477 4.341 20 0 HIADHN C[C@@H]([NH2+]Cc1nnc(-c2ccc(Br)cc2)[n-]1)c1ccccc1N(C)C ZINC000540155408 939094316 /nfs/dbraw/zinc/09/43/16/939094316.db2.gz MCVULRFIHYHTMK-CYBMUJFWSA-N 0 3 400.324 4.151 20 0 HIADHN COCCNS(=O)(=O)c1ccc(CN[C@@H](CC(C)C)c2ccc(Cl)cc2)cc1 ZINC000540166835 939099654 /nfs/dbraw/zinc/09/96/54/939099654.db2.gz RRQPKRYWIKHEMC-NRFANRHFSA-N 0 3 424.994 4.142 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(OCCN[C@H](C)c3cnn(C(C)C)c3)c2)cc1 ZINC000540170139 939101560 /nfs/dbraw/zinc/10/15/60/939101560.db2.gz WDYMYCSKYFTNNL-GOSISDBHSA-N 0 3 422.529 4.455 20 0 HIADHN COc1ccc(OC)c([C@@H](C)NC[C@@H](c2cccc(Cl)c2)N2CCOCC2)c1 ZINC000540173433 939103647 /nfs/dbraw/zinc/10/36/47/939103647.db2.gz FBCTXCGODWYBOR-IERDGZPVSA-N 0 3 404.938 4.081 20 0 HIADHN C[C@H](NCCNC(=O)CC1CCCCC1)c1ccc(S(=O)(=O)C2CCCC2)cc1 ZINC000540180497 939107345 /nfs/dbraw/zinc/10/73/45/939107345.db2.gz CBHAATOQOQGCDD-SFHVURJKSA-N 0 3 420.619 4.140 20 0 HIADHN O=C(C1CCC1)N(CCCN[C@H]1CCc2c1c(Br)ccc2F)C1CC1 ZINC000540179880 939107626 /nfs/dbraw/zinc/10/76/26/939107626.db2.gz IXPNBAQCRUIEMI-SFHVURJKSA-N 0 3 409.343 4.346 20 0 HIADHN COc1ccc(CN2CC[C@H](N[C@H](C)c3ccc4cc(OC)ccc4c3)C2=O)cc1 ZINC000540181162 939108771 /nfs/dbraw/zinc/10/87/71/939108771.db2.gz FGNPHJMYLWSBIR-OSPHWJPCSA-N 0 3 404.510 4.309 20 0 HIADHN COc1ccc(CN2CC[C@@H](N[C@H](C)c3ccc(OCC(F)(F)F)cc3)C2=O)cc1 ZINC000540183828 939109718 /nfs/dbraw/zinc/10/97/18/939109718.db2.gz ULDXPWJAYUTCEQ-FOIQADDNSA-N 0 3 422.447 4.088 20 0 HIADHN Cc1ccc([C@H](N[C@@H]2C[C@H](C)N(C3CC3)C2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000540185733 939110514 /nfs/dbraw/zinc/11/05/14/939110514.db2.gz ZCESTBSPGAEPGB-MFSJNOQSSA-N 0 3 412.599 4.011 20 0 HIADHN Cc1ccc([C@H](N[C@@H]2C[C@@H](C)N(C3CC3)C2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000540185731 939111091 /nfs/dbraw/zinc/11/10/91/939111091.db2.gz ZCESTBSPGAEPGB-DRMXPCRNSA-N 0 3 412.599 4.011 20 0 HIADHN COc1cc(CN[C@@H](C)c2ccc(C(F)(F)F)cc2)ccc1OCC(=O)N(C)C ZINC000540192403 939117578 /nfs/dbraw/zinc/11/75/78/939117578.db2.gz KPGNYLFSAZAXNA-AWEZNQCLSA-N 0 3 410.436 4.032 20 0 HIADHN Cc1noc(C2CCC(N[C@H](C)c3nnn(-c4ccc(Cl)cc4)c3C)CC2)n1 ZINC000540222459 939138039 /nfs/dbraw/zinc/13/80/39/939138039.db2.gz QUURMOXOESXFQY-OLJMKKDRSA-N 0 3 400.914 4.298 20 0 HIADHN O=C(N[C@@H](c1ccc(Cl)c(C(F)(F)F)c1)C1CC1)N1CC[C@@H](N2CC=CC2)C1 ZINC000540309091 939189177 /nfs/dbraw/zinc/18/91/77/939189177.db2.gz QSVOAUQSYOVZFB-CRAIPNDOSA-N 0 3 413.871 4.466 20 0 HIADHN O=C(N[C@@H](c1ccc(Cl)c(C(F)(F)F)c1)C1CC1)N1CC[C@H](N2CC=CC2)C1 ZINC000540309094 939189244 /nfs/dbraw/zinc/18/92/44/939189244.db2.gz QSVOAUQSYOVZFB-MAUKXSAKSA-N 0 3 413.871 4.466 20 0 HIADHN CN(C)S(=O)(=O)c1ccc(CN[C@@H](c2ccc(Cl)c(Cl)c2)C2CC2)cc1 ZINC000540313268 939190484 /nfs/dbraw/zinc/19/04/84/939190484.db2.gz FJVAQYUIPNTFCJ-LJQANCHMSA-N 0 3 413.370 4.485 20 0 HIADHN Cc1cc([C@@H](NCc2ccc(S(=O)(=O)N3CCCC3)cc2)C2CC2)ccc1F ZINC000540317620 939192176 /nfs/dbraw/zinc/19/21/76/939192176.db2.gz YVHPCSDICLZTCR-QFIPXVFZSA-N 0 3 402.535 4.160 20 0 HIADHN COc1ccc([C@H](C)N[C@@H](C)C(=O)N(C)Cc2ccc(Br)cc2)cc1 ZINC000540331250 939197817 /nfs/dbraw/zinc/19/78/17/939197817.db2.gz RRYSAQYBSDURQN-GJZGRUSLSA-N 0 3 405.336 4.155 20 0 HIADHN CCOc1ccccc1NC(=O)[C@@H](NCCCc1c(C)nn(C)c1C)c1ccccc1 ZINC000540339740 939199653 /nfs/dbraw/zinc/19/96/53/939199653.db2.gz XILSQUVZVAXIGN-DEOSSOPVSA-N 0 3 420.557 4.338 20 0 HIADHN Cc1ccccc1[C@@H](CC(C)C)NCC(=O)NCc1ccc(C(=O)N2CCCC2)cc1 ZINC000540359675 939208837 /nfs/dbraw/zinc/20/88/37/939208837.db2.gz UBBRFDUFLXHGJQ-XMMPIXPASA-N 0 3 421.585 4.224 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)Nc1ccc(Br)cc1)c1ccccc1-n1cccn1 ZINC000540361955 939210557 /nfs/dbraw/zinc/21/05/57/939210557.db2.gz CGDKWAGZLJRPFH-CABCVRRESA-N 0 3 413.319 4.313 20 0 HIADHN Cc1cccn2c(=O)cc(CN[C@@H](c3ccc(Br)cc3)C3CCC3)nc12 ZINC000540377045 939216833 /nfs/dbraw/zinc/21/68/33/939216833.db2.gz SSRRIWZTWHZITO-HXUWFJFHSA-N 0 3 412.331 4.396 20 0 HIADHN Cc1cc2ncn(C[C@H](O)CN[C@H](CC(F)(F)F)c3ccc(F)cc3)c2cc1C ZINC000540377776 939218791 /nfs/dbraw/zinc/21/87/91/939218791.db2.gz WBVOTNDQWWAFOU-IEBWSBKVSA-N 0 3 409.427 4.436 20 0 HIADHN Cc1cccc(Cc2cnc(NC(=O)CN[C@H](c3ccccc3)[C@@H]3CCOC3)s2)c1 ZINC000540389260 939225389 /nfs/dbraw/zinc/22/53/89/939225389.db2.gz FZLDJZZWPUBGPW-NFBKMPQASA-N 0 3 421.566 4.348 20 0 HIADHN C[C@@H](NCC(=O)Nc1ccc2c(c1)OC1(CCCC1)O2)c1cccc(-n2cccn2)c1 ZINC000540389597 939228019 /nfs/dbraw/zinc/22/80/19/939228019.db2.gz PPEMTTZEMMPAQV-QGZVFWFLSA-N 0 3 418.497 4.203 20 0 HIADHN CN(Cc1ccc(Cl)c(Cl)c1)C(=O)CN[C@H](c1ccccc1)[C@H]1CCOC1 ZINC000540395388 939232789 /nfs/dbraw/zinc/23/27/89/939232789.db2.gz UZYZOBJVLXGAOK-LAUBAEHRSA-N 0 3 407.341 4.319 20 0 HIADHN CS(=O)(=O)c1ccc(NC(=O)CN[C@@H](c2ccc(Cl)cc2)C2CCCC2)cc1 ZINC000540405919 939236861 /nfs/dbraw/zinc/23/68/61/939236861.db2.gz JHDRWIIOPUJARN-OAQYLSRUSA-N 0 3 420.962 4.203 20 0 HIADHN CC(C)COc1ccc(C(C)(C)NCC(=O)N2CCC[C@@H](C(F)(F)F)C2)cc1 ZINC000540416582 939240860 /nfs/dbraw/zinc/24/08/60/939240860.db2.gz ILCCKEBDNHJJBJ-QGZVFWFLSA-N 0 3 400.485 4.347 20 0 HIADHN COCc1ccc(CNC(=O)CN[C@@H](c2ccc(C(F)(F)F)cc2)C(C)C)cc1 ZINC000540424388 939243338 /nfs/dbraw/zinc/24/33/38/939243338.db2.gz AAHZDIITCOLAHD-OAQYLSRUSA-N 0 3 408.464 4.455 20 0 HIADHN O=C(CN[C@H](c1cccc(F)c1)C1CCCC1)Nc1cccc(N2CCCC2=O)c1 ZINC000540430206 939245944 /nfs/dbraw/zinc/24/59/44/939245944.db2.gz MJOANVGYGVHAHA-DEOSSOPVSA-N 0 3 409.505 4.412 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(-c2cccnc2)cc1)C(=O)N1CCN(c2ccccc2)CC1 ZINC000540431035 939246341 /nfs/dbraw/zinc/24/63/41/939246341.db2.gz WSNSTVYRZXICTB-SFTDATJTSA-N 0 3 414.553 4.137 20 0 HIADHN COc1ccc(NC(=O)[C@@H](C)N[C@@H](C)c2ccc(-c3cccnc3)cc2)cc1OC ZINC000540433875 939247363 /nfs/dbraw/zinc/24/73/63/939247363.db2.gz ACNXSYDMIUEDMF-DLBZAZTESA-N 0 3 405.498 4.444 20 0 HIADHN CC(C)[C@@H](NC(=O)CN[C@@H](c1cccs1)C1CC1)c1ccc2c(c1)OCCCO2 ZINC000540466549 939264048 /nfs/dbraw/zinc/26/40/48/939264048.db2.gz KIPNHRHCELFMLF-DHIUTWEWSA-N 0 3 414.571 4.464 20 0 HIADHN Cc1nc(C2CCCCC2)sc1C(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000540470205 939265472 /nfs/dbraw/zinc/26/54/72/939265472.db2.gz KKZZTCKYZYAQLM-IAGOWNOFSA-N 0 3 419.635 4.461 20 0 HIADHN COc1cc(NC(=O)Nc2cccc(CN(C)C)c2)cc(OC)c1Br ZINC000540482344 939269890 /nfs/dbraw/zinc/26/98/90/939269890.db2.gz IQFYSHNTLBDVCV-UHFFFAOYSA-N 0 3 408.296 4.172 20 0 HIADHN C[C@H](CS(=O)(=O)c1ccccc1)NCCc1cc(Cl)ccc1Br ZINC000540495570 939275655 /nfs/dbraw/zinc/27/56/55/939275655.db2.gz YTLNDPRSGHSQKJ-CYBMUJFWSA-N 0 3 416.768 4.097 20 0 HIADHN C[C@H](N[C@H](c1ccc(Cl)c(C(F)(F)F)c1)C1CC1)C(=O)NC[C@H]1CCCO1 ZINC000540523265 939287818 /nfs/dbraw/zinc/28/78/18/939287818.db2.gz KJVIILWFJSWYDV-KHIZAZIESA-N 0 3 404.860 4.083 20 0 HIADHN Cc1cc(C)n2c(CNC[C@@H](c3c(F)cccc3Cl)N3CCCC3)cnc2n1 ZINC000540536821 939295016 /nfs/dbraw/zinc/29/50/16/939295016.db2.gz GNSOUJPLKOZDCE-IBGZPJMESA-N 0 3 401.917 4.065 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)c3ccccc3NC3CCCCC3)CC2)C[C@H](C)O1 ZINC000540545980 939300248 /nfs/dbraw/zinc/30/02/48/939300248.db2.gz VYLVNUVGLNAHBK-PMACEKPBSA-N 0 3 413.606 4.393 20 0 HIADHN COc1ccc(C[C@@H](NCc2cnc3nc(C)cc(C)n23)c2ccccc2)cc1OC ZINC000540592460 939313494 /nfs/dbraw/zinc/31/34/94/939313494.db2.gz SQEUFRHFYKTFCK-JOCHJYFZSA-N 0 3 416.525 4.437 20 0 HIADHN COc1cc(CNCCOc2ccc(C(F)(F)F)cn2)c(SC)cc1OC ZINC000540612915 939319932 /nfs/dbraw/zinc/31/99/32/939319932.db2.gz QPCFZOYXEPMQND-UHFFFAOYSA-N 0 3 402.438 4.008 20 0 HIADHN CC(C)[C@@H](NCc1ccc(C(=O)N2CCN(C)CC2)cc1)c1cc2ccccc2o1 ZINC000540651213 939331003 /nfs/dbraw/zinc/33/10/03/939331003.db2.gz PERSZLZDAIBKHB-XMMPIXPASA-N 0 3 405.542 4.307 20 0 HIADHN CC(C)N1CC[C@@H](NCc2cnc(N3CCCC3)nc2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000540716594 939347001 /nfs/dbraw/zinc/34/70/01/939347001.db2.gz AGKLWGJXVXKQAU-NHCUHLMSSA-N 0 3 417.960 4.183 20 0 HIADHN NC(=O)[C@H](CNCc1c(Cl)cccc1N1CCCC1)Cc1ccccc1Cl ZINC000540731897 939352142 /nfs/dbraw/zinc/35/21/42/939352142.db2.gz KBRRFKIDJPBEJU-INIZCTEOSA-N 0 3 406.357 4.027 20 0 HIADHN CC(=O)Nc1ccc([C@H](C)NCc2cccc(NC(=O)NCc3ccncc3)c2)cc1 ZINC000540988772 939425877 /nfs/dbraw/zinc/42/58/77/939425877.db2.gz OWTJDJOFUYIXOI-KRWDZBQOSA-N 0 3 417.513 4.213 20 0 HIADHN OCC[C@H](NCCCc1nc(-c2cccs2)no1)c1ccccc1Br ZINC000541021985 939432093 /nfs/dbraw/zinc/43/20/93/939432093.db2.gz RNIFRJDCSTVFPI-HNNXBMFYSA-N 0 3 422.348 4.207 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)NCC(=O)NCCSc2ccc(C)cc2)cc1 ZINC000541027224 939435260 /nfs/dbraw/zinc/43/52/60/939435260.db2.gz PILANDISQBAQOE-GOSISDBHSA-N 0 3 408.571 4.048 20 0 HIADHN CCc1ccc([C@H](C)NC(=O)[C@H](C)N2CCC(CCC(=O)N(CC)CC)CC2)cc1 ZINC000541120639 939467678 /nfs/dbraw/zinc/46/76/78/939467678.db2.gz RTIDJKFFHVKEEM-PMACEKPBSA-N 0 3 415.622 4.175 20 0 HIADHN COc1ccc(CN[C@@H](C)CC(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)cn1 ZINC000541209517 939485767 /nfs/dbraw/zinc/48/57/67/939485767.db2.gz MVPLMGKNROOTTM-NSHDSACASA-N 0 3 401.816 4.269 20 0 HIADHN COc1ccc(NC(=O)C[C@@H](C)N[C@H]2CCCOc3ccc(F)cc32)c(OC)c1 ZINC000541213780 939485941 /nfs/dbraw/zinc/48/59/41/939485941.db2.gz ZIJVBICQZMRWAZ-KDOFPFPSSA-N 0 3 402.466 4.064 20 0 HIADHN NC(=O)[C@H](Cc1ccc(C(F)(F)F)cc1)N[C@@H]1C[C@@H]1c1c(F)cccc1Cl ZINC000541301683 939490049 /nfs/dbraw/zinc/49/00/49/939490049.db2.gz KGRMHMZACZQKBO-MAZHCROVSA-N 0 3 400.803 4.040 20 0 HIADHN C[C@@H](NC[C@@H](O)COc1ccccc1C(F)(F)F)c1ccccc1OC(F)F ZINC000541325306 939490957 /nfs/dbraw/zinc/49/09/57/939490957.db2.gz KIIDWRSKXJILGT-CHWSQXEVSA-N 0 3 405.363 4.397 20 0 HIADHN Cc1cc(C)cc([C@@H]2CCN(CC(=O)N3CCC(OCc4ccccc4)CC3)C2)c1 ZINC000541389495 939503469 /nfs/dbraw/zinc/50/34/69/939503469.db2.gz PLOSROIESRBJPO-HSZRJFAPSA-N 0 3 406.570 4.301 20 0 HIADHN Cc1cc(CNCc2ccc(C(=O)N3C[C@@H](C)O[C@H](C)C3)cc2)cc2cccnc12 ZINC000541389001 939503625 /nfs/dbraw/zinc/50/36/25/939503625.db2.gz LSPQCKHQXQXTRN-RTBURBONSA-N 0 3 403.526 4.082 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)[C@H]2CCn3c(cnc3C3CCCCC3)C2)C1 ZINC000541395233 939504612 /nfs/dbraw/zinc/50/46/12/939504612.db2.gz AJDMVHMIDWEMCD-OIBXWCBGSA-N 0 3 420.601 4.445 20 0 HIADHN O=C(Cc1nc(-c2ccc(F)cc2)cs1)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000541557327 939554519 /nfs/dbraw/zinc/55/45/19/939554519.db2.gz DTTIKYPAMJREBE-FQEVSTJZSA-N 0 3 409.530 4.445 20 0 HIADHN COC[C@H](Cc1ccccc1)N[C@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O ZINC000541590491 939561827 /nfs/dbraw/zinc/56/18/27/939561827.db2.gz PJOCQZLHPZGRBK-SFTDATJTSA-N 0 3 420.475 4.044 20 0 HIADHN Cc1ccsc1[C@H](Cc1ccccc1)N[C@@H](C)C(=O)N1CC(=O)Nc2ccccc21 ZINC000541593709 939562197 /nfs/dbraw/zinc/56/21/97/939562197.db2.gz XIJNSBWWHOXQTR-PXNSSMCTSA-N 0 3 419.550 4.304 20 0 HIADHN CCCCSc1ccc(Cl)cc1C(=O)Nc1ccc(=O)n(CCN(C)C)c1 ZINC000541598576 939563532 /nfs/dbraw/zinc/56/35/32/939563532.db2.gz WRGWDBYIOHGYDE-UHFFFAOYSA-N 0 3 407.967 4.208 20 0 HIADHN C[C@H](c1ccccc1C(F)(F)F)[C@H](C)NCC(=O)Nc1nnc(-c2ccco2)o1 ZINC000541637253 939579539 /nfs/dbraw/zinc/57/95/39/939579539.db2.gz QTXBIZUGPWOYKZ-RYUDHWBXSA-N 0 3 408.380 4.069 20 0 HIADHN C[C@H](NCC(=O)Nc1ccc(NC(=O)c2cccs2)cc1)[C@@H]1COc2ccccc21 ZINC000541694995 939606930 /nfs/dbraw/zinc/60/69/30/939606930.db2.gz GNVCHFMTOQESMS-KXBFYZLASA-N 0 3 421.522 4.093 20 0 HIADHN C[C@@H](NCC(=O)NCCC(c1ccccc1)c1ccccc1)[C@@H]1COc2ccccc21 ZINC000541700550 939608569 /nfs/dbraw/zinc/60/85/69/939608569.db2.gz RJXZMCBNVCADDQ-NLFFAJNJSA-N 0 3 414.549 4.479 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@H]2CCCC[C@@H]2NCc2cccc(Cn3cccn3)c2)cc1 ZINC000541742156 939618535 /nfs/dbraw/zinc/61/85/35/939618535.db2.gz WDBCXAGIDCFEES-ZEQRLZLVSA-N 0 3 423.582 4.115 20 0 HIADHN O=C(N[C@@H]1CCO[C@H](c2ccc(F)cc2)C1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000541749473 939620227 /nfs/dbraw/zinc/62/02/27/939620227.db2.gz MFQGUPNLSJJJIP-PMOQBDJRSA-N 0 3 414.496 4.213 20 0 HIADHN C[C@H](CN[C@@H](c1ccc(F)cc1)c1cccc(S(C)(=O)=O)c1)c1nccs1 ZINC000541767373 939625302 /nfs/dbraw/zinc/62/53/02/939625302.db2.gz YSLHIGPSCVHGKS-KUHUBIRLSA-N 0 3 404.532 4.168 20 0 HIADHN CN(C(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1)[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000541825884 939643557 /nfs/dbraw/zinc/64/35/57/939643557.db2.gz PMBQZQPIOQAYOS-ACESQOTJSA-N 0 3 411.521 4.133 20 0 HIADHN C[C@@H]1C[C@@H](N[C@H](c2cccc(S(C)(=O)=O)c2)c2ccc(F)c(F)c2)C[C@H](C)O1 ZINC000541847740 939646793 /nfs/dbraw/zinc/64/67/93/939646793.db2.gz FJDHFMDPWLDBKW-AMLORBGZSA-N 0 3 409.498 4.003 20 0 HIADHN COc1ccccc1COc1cccc(NC(=O)N[C@@H](C)C2=CCN(C)CC2)c1C ZINC000541907755 939651411 /nfs/dbraw/zinc/65/14/11/939651411.db2.gz HTDWFHFLKZACIC-SFHVURJKSA-N 0 3 409.530 4.355 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@H](C)N[C@@H](C)c2ccc(NC(C)=O)cc2)cc1 ZINC000541912948 939651732 /nfs/dbraw/zinc/65/17/32/939651732.db2.gz RIMBQPOEOZLHIA-IRXDYDNUSA-N 0 3 417.575 4.087 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](N[C@H](CCO)c2ccccc2Br)C1 ZINC000541916792 939653300 /nfs/dbraw/zinc/65/33/00/939653300.db2.gz OMWYGPAUEZXAHM-HGHGUNKESA-N 0 3 403.364 4.298 20 0 HIADHN CC(C)[C@H](NC(=O)N(CCN(C)C)Cc1ccccn1)c1ccc(Cl)cc1F ZINC000541928400 939656356 /nfs/dbraw/zinc/65/63/56/939656356.db2.gz QCUAVLLTCXXGIL-FQEVSTJZSA-N 0 3 406.933 4.345 20 0 HIADHN CCOc1c(Br)cc(Cl)cc1NC(=O)N(CCN(C)C)C(C)C ZINC000541973740 939667295 /nfs/dbraw/zinc/66/72/95/939667295.db2.gz QUPXPBBKUYRNLZ-UHFFFAOYSA-N 0 3 406.752 4.305 20 0 HIADHN CC(C)S(=O)(=O)c1ccc(CNC2(c3ccc(Cl)cc3)CCOCC2)cc1 ZINC000541985214 939670517 /nfs/dbraw/zinc/67/05/17/939670517.db2.gz XCBDZCHGOCAROW-UHFFFAOYSA-N 0 3 407.963 4.318 20 0 HIADHN CCN1CC[C@H](NCc2c[nH]c(-c3ccccc3)n2)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000541992147 939672302 /nfs/dbraw/zinc/67/23/02/939672302.db2.gz PKEQXYFLNKBMPA-PZJWPPBQSA-N 0 3 400.448 4.419 20 0 HIADHN CCN1CC[C@H](NCc2cnc([C@H]3CCCO3)s2)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000542013192 939684572 /nfs/dbraw/zinc/68/45/72/939684572.db2.gz MZMGTUVATAOEAV-YQVWRLOYSA-N 0 3 411.493 4.337 20 0 HIADHN O=C(NCc1ccco1)c1cccc(CN2CCC(CCCn3ccnc3)CC2)c1 ZINC000542133484 939724112 /nfs/dbraw/zinc/72/41/12/939724112.db2.gz UUPVHFLOHDGBAO-UHFFFAOYSA-N 0 3 406.530 4.099 20 0 HIADHN CC(C)n1ccc(C[C@H](C)N[C@@H](c2ccccc2)c2cccc(S(C)(=O)=O)c2)n1 ZINC000542137179 939726944 /nfs/dbraw/zinc/72/69/44/939726944.db2.gz YYDMXGJDKLECBP-MBSDFSHPSA-N 0 3 411.571 4.178 20 0 HIADHN COC(=O)COc1ccccc1[C@@H](C)NCc1c(C)cc(Br)cc1C ZINC000542479944 939830635 /nfs/dbraw/zinc/83/06/35/939830635.db2.gz XGRNAAJWGAIGQX-OAHLLOKOSA-N 0 3 406.320 4.469 20 0 HIADHN CC(C)(C)c1nn(Cc2ccccc2)cc1CN1CCC(OC[C@H]2CCOC2)CC1 ZINC000542484941 939831559 /nfs/dbraw/zinc/83/15/59/939831559.db2.gz BBSGKZRCTDMUPX-NRFANRHFSA-N 0 3 411.590 4.246 20 0 HIADHN Cc1ccccc1[C@@H](CN1CCOCC1)NCc1cccc(COCC(F)(F)F)c1 ZINC000542493391 939832601 /nfs/dbraw/zinc/83/26/01/939832601.db2.gz KRVWLRSMTHUUBV-JOCHJYFZSA-N 0 3 422.491 4.237 20 0 HIADHN O[C@H](CN[C@H](Cn1cnc2ccccc21)c1ccc(F)cc1)COc1ccc(F)cc1 ZINC000542517984 939835968 /nfs/dbraw/zinc/83/59/68/939835968.db2.gz MDLKLZIKHCDQJQ-NFBKMPQASA-N 0 3 423.463 4.085 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)N[C@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000542547134 939841810 /nfs/dbraw/zinc/84/18/10/939841810.db2.gz WYFXNACKNIIGNL-VABKMULXSA-N 0 3 411.521 4.010 20 0 HIADHN CCOc1ccc(-c2nc(CN[C@H](CC(N)=O)C3CCCCC3)cs2)cc1OC ZINC000542560291 939843821 /nfs/dbraw/zinc/84/38/21/939843821.db2.gz CVYYXBFHWDSFSN-GOSISDBHSA-N 0 3 417.575 4.131 20 0 HIADHN CC[C@H](NCC(=O)N1N=C(c2cccs2)C[C@H]1c1cccs1)[C@@H]1CCCO1 ZINC000542566826 939844628 /nfs/dbraw/zinc/84/46/28/939844628.db2.gz NJEJQMLKHQRHPD-XIRDDKMYSA-N 0 3 403.573 4.035 20 0 HIADHN C[C@@H](NCC(=O)Nc1ccc(Br)cc1Cl)[C@H]1COc2ccccc21 ZINC000542621068 939849495 /nfs/dbraw/zinc/84/94/95/939849495.db2.gz WNHFBQQUOVYTNJ-BXUZGUMPSA-N 0 3 409.711 4.195 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)NC(c1ccccc1)c1ccccc1)[C@H]1COc2ccccc21 ZINC000542629231 939850319 /nfs/dbraw/zinc/85/03/19/939850319.db2.gz YEVCHPNCBADWIZ-SELNLUPBSA-N 0 3 400.522 4.435 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@@H]2NC[C@H](c2cccs2)N(C)C)cc1 ZINC000542671909 939853229 /nfs/dbraw/zinc/85/32/29/939853229.db2.gz VIEDUWASICFOML-QKNQBKEWSA-N 0 3 406.617 4.034 20 0 HIADHN C[C@H](NCc1cccnc1N1CCC(C(N)=O)CC1)c1ccc(-c2ccccc2)s1 ZINC000542677256 939853480 /nfs/dbraw/zinc/85/34/80/939853480.db2.gz GSIDSZYIKCKKIU-KRWDZBQOSA-N 0 3 420.582 4.363 20 0 HIADHN CNC(=O)CCOC1CCN(Cc2ccc(-c3cccc(C(F)(F)F)c3)o2)CC1 ZINC000542856834 939863535 /nfs/dbraw/zinc/86/35/35/939863535.db2.gz LXMAHALMROOBPA-UHFFFAOYSA-N 0 3 410.436 4.083 20 0 HIADHN Cc1cc(NC(=O)C[C@@H]2CCO[C@H](C(C)C)C2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000542886659 939865428 /nfs/dbraw/zinc/86/54/28/939865428.db2.gz JQMJQESAETVNES-ZLNRFVROSA-N 0 3 424.589 4.418 20 0 HIADHN CCN1CC[C@H](NC(=O)Nc2cccc(CN(C)C)c2)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000542936198 939881748 /nfs/dbraw/zinc/88/17/48/939881748.db2.gz MIXTXFLXFRQONW-PZJWPPBQSA-N 0 3 420.479 4.123 20 0 HIADHN CCN1CC[C@@H](NCc2cnc(-c3ccccc3)nc2)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000542942932 939882868 /nfs/dbraw/zinc/88/28/68/939882868.db2.gz XRBCGABBURRNTG-IRLDBZIGSA-N 0 3 412.459 4.486 20 0 HIADHN CC(=O)c1ccc(NC(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)cc1Cl ZINC000543037536 939900166 /nfs/dbraw/zinc/90/01/66/939900166.db2.gz SEJFUXILDMVJQA-HOTGVXAUSA-N 0 3 421.969 4.286 20 0 HIADHN CSc1ccc(F)cc1CN[C@@H](C)CC(=O)Nc1ccc(NC(=O)C2CC2)cc1 ZINC000543064048 939917208 /nfs/dbraw/zinc/91/72/08/939917208.db2.gz MTMURIDVEQHLSL-AWEZNQCLSA-N 0 3 415.534 4.403 20 0 HIADHN CCOC(=O)C1CCN(C(=O)C[C@@H](C)N[C@H](C)c2cccc(Cl)c2Cl)CC1 ZINC000543066974 939920380 /nfs/dbraw/zinc/92/03/80/939920380.db2.gz NOLHKLNUMZXVQL-ZIAGYGMSSA-N 0 3 415.361 4.224 20 0 HIADHN CC(C)OC(=O)C1(C(=O)OC(C)C)CC(N[C@@H](C)c2ccc(-c3cccnc3)cc2)C1 ZINC000543090027 939936549 /nfs/dbraw/zinc/93/65/49/939936549.db2.gz UQWMUXVOTMLHSE-SFHVURJKSA-N 0 3 424.541 4.451 20 0 HIADHN COc1cc(CN[C@H](C)C[S@@](C)=O)ccc1OCc1ccc(Cl)cc1Cl ZINC000543226939 940001161 /nfs/dbraw/zinc/00/11/61/940001161.db2.gz QUSMFHGDLXINEO-ZBSNKRKSSA-N 0 3 416.370 4.438 20 0 HIADHN Cc1ccc(COc2ccc(CN[C@@H]3CCCN(Cc4ccccn4)C3=O)cc2)cc1 ZINC000543242698 940006385 /nfs/dbraw/zinc/00/63/85/940006385.db2.gz AWCWTOPTDPONKC-RUZDIDTESA-N 0 3 415.537 4.250 20 0 HIADHN COc1ccc(OC)c([C@@H]2CCCN2C(=O)CN2CC[C@@H](c3ccc(C)cc3)C2)c1 ZINC000543247157 940007603 /nfs/dbraw/zinc/00/76/03/940007603.db2.gz UQKNONLJBLXZOK-OFNKIYASSA-N 0 3 408.542 4.165 20 0 HIADHN COc1ccc(OC)c([C@@H]2CCCN2C(=O)CN2CC[C@H](c3ccc(C)cc3)C2)c1 ZINC000543247159 940007621 /nfs/dbraw/zinc/00/76/21/940007621.db2.gz UQKNONLJBLXZOK-REWPJTCUSA-N 0 3 408.542 4.165 20 0 HIADHN Cc1cc(NC(=O)N(C)C[C@@H]2CC=CCC2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000543314593 940026544 /nfs/dbraw/zinc/02/65/44/940026544.db2.gz BQFCIERBTZCCFZ-IRLDBZIGSA-N 0 3 407.562 4.459 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)NCCCc1nc(-c2ccc(F)cc2)no1 ZINC000543387953 940048668 /nfs/dbraw/zinc/04/86/68/940048668.db2.gz MNAJSQGSKGAVEK-UHFFFAOYSA-N 0 3 422.460 4.046 20 0 HIADHN COC[C@@H](Cc1ccccc1)N[C@@H](CN1CCCC1=O)c1cccc(C(F)(F)F)c1 ZINC000543446610 940066236 /nfs/dbraw/zinc/06/62/36/940066236.db2.gz ISLWRYHVWPBQHB-RTWAWAEBSA-N 0 3 420.475 4.216 20 0 HIADHN O=C(Cc1cc(Cl)cc2c1OCC2)Nc1ccc(CCN2CCSCC2)cc1 ZINC000543463428 940072170 /nfs/dbraw/zinc/07/21/70/940072170.db2.gz RQTXGSMUAPFMOP-UHFFFAOYSA-N 0 3 416.974 4.047 20 0 HIADHN COC[C@H](N[C@@H](C)C(=O)N1N=C(c2ccc(Cl)cc2)C[C@@H]1c1ccco1)C1CC1 ZINC000543477711 940077695 /nfs/dbraw/zinc/07/76/95/940077695.db2.gz FAFRZKHVCVYTQV-PNHOKKKMSA-N 0 3 415.921 4.014 20 0 HIADHN COC1CCC(CCNC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)CC1 ZINC000543494959 940083850 /nfs/dbraw/zinc/08/38/50/940083850.db2.gz AWMUMGWXUQPWCW-CNBHCMJISA-N 0 3 412.496 4.153 20 0 HIADHN CC[C@@H](NCC(=O)Nc1cc(C(F)(F)F)ccc1N1CCCCC1)[C@@H]1CCCO1 ZINC000543496725 940085137 /nfs/dbraw/zinc/08/51/37/940085137.db2.gz LRRASVOKPLIGOQ-APWZRJJASA-N 0 3 413.484 4.181 20 0 HIADHN Cc1ccc(NC(=O)CN[C@H](C)[C@@H]2Oc3ccccc3[C@H]2C)c(Br)c1 ZINC000543549940 940105444 /nfs/dbraw/zinc/10/54/44/940105444.db2.gz ZJPPHAHDRMAZEN-ARGWCVDVSA-N 0 3 403.320 4.239 20 0 HIADHN C[C@H](NCC(=O)N1CCc2sccc2[C@@H]1c1ccccc1)[C@H]1COc2ccccc21 ZINC000543557439 940107701 /nfs/dbraw/zinc/10/77/01/940107701.db2.gz MGTYYQPXOPIPKF-QBFCQJJASA-N 0 3 418.562 4.377 20 0 HIADHN CCOc1ccc(CN(C)C(=O)CN(C)[C@@H]2CCO[C@H](c3ccc(F)cc3)C2)cc1 ZINC000543559836 940108226 /nfs/dbraw/zinc/10/82/26/940108226.db2.gz UGWHFUWHCVAHRX-GGAORHGYSA-N 0 3 414.521 4.035 20 0 HIADHN CS[C@@H]1CN(C(=O)c2csc(-c3cccc(Cl)c3)n2)C[C@H]1N1CCCC1 ZINC000543701428 940164773 /nfs/dbraw/zinc/16/47/73/940164773.db2.gz UMWFAMZHSKGTRY-IAGOWNOFSA-N 0 3 407.992 4.115 20 0 HIADHN C[C@H](C(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1CO)c1ccc(Cl)c(Cl)c1 ZINC000543707361 940167087 /nfs/dbraw/zinc/16/70/87/940167087.db2.gz OLZDWTWBNGIYPK-XERREHJYSA-N 0 3 421.368 4.096 20 0 HIADHN Cc1ccc(-c2nnc(SCCCN3CCN(C)CC3)n2-c2ccc(C)cc2)cc1 ZINC000543744048 940173417 /nfs/dbraw/zinc/17/34/17/940173417.db2.gz YHPVAYIPKWMELZ-UHFFFAOYSA-N 0 3 421.614 4.281 20 0 HIADHN Nc1ccc(F)c(NC(=O)CCN[C@H](Cc2ccc(Cl)cc2)c2ccccn2)c1 ZINC000543980368 940282635 /nfs/dbraw/zinc/28/26/35/940282635.db2.gz BKQBXKPWWKUBKQ-OAQYLSRUSA-N 0 3 412.896 4.359 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3CCC(c4ccc(C)nc4)CC3)c(C)c2)CC1 ZINC000543990265 940286057 /nfs/dbraw/zinc/28/60/57/940286057.db2.gz YPABOFSYDLOYOH-UHFFFAOYSA-N 0 3 421.589 4.252 20 0 HIADHN O=C(CN[C@H](c1ccc(Cl)cc1)C1CC1)N1CCO[C@H](c2ccc(F)cc2)C1 ZINC000543989714 940286885 /nfs/dbraw/zinc/28/68/85/940286885.db2.gz XAXOXWMTGNRIKO-UNMCSNQZSA-N 0 3 402.897 4.120 20 0 HIADHN C[C@H]1CCCN(C(=O)C2CCN(CCCc3ccccc3Br)CC2)C1 ZINC000544070329 940317314 /nfs/dbraw/zinc/31/73/14/940317314.db2.gz RSXZNRBIJZJLLN-KRWDZBQOSA-N 0 3 407.396 4.352 20 0 HIADHN Cc1ccc(C(=O)N2CC[C@@H](N3CCN(C)CC3)[C@@H](C)C2)c(Sc2ccccc2)c1 ZINC000544260172 940370865 /nfs/dbraw/zinc/37/08/65/940370865.db2.gz ZZEKOPNVKVEIPT-NZQKXSOJSA-N 0 3 423.626 4.244 20 0 HIADHN CSc1ccc(NC(=O)N(CCN(C)C)Cc2ccc(Br)cc2)nc1 ZINC000544272412 940375245 /nfs/dbraw/zinc/37/52/45/940375245.db2.gz BHVQIARJHGSHPW-UHFFFAOYSA-N 0 3 423.380 4.162 20 0 HIADHN C[C@H]1CCN(C(=O)c2cccc(CN(C)Cc3ccccc3)c2)C[C@H]1n1ccnc1 ZINC000544278092 940377155 /nfs/dbraw/zinc/37/71/55/940377155.db2.gz LZJXKSJCWWLBGJ-GBXCKJPGSA-N 0 3 402.542 4.238 20 0 HIADHN Cc1cc(-c2nc(C3CC3)no2)ccc1NC(=O)NC[C@H](Cc1ccccc1)N(C)C ZINC000544306674 940385428 /nfs/dbraw/zinc/38/54/28/940385428.db2.gz FKOJSFZGIXCSGI-FQEVSTJZSA-N 0 3 419.529 4.217 20 0 HIADHN c1cncc(CN2CCC[C@@H](c3nc(-c4cccnc4OC4CCCC4)no3)C2)c1 ZINC000544319853 940389544 /nfs/dbraw/zinc/38/95/44/940389544.db2.gz LQAOUSPUIXWIJZ-GOSISDBHSA-N 0 3 405.502 4.228 20 0 HIADHN CCCN(C(=O)NCC[C@@H]1CCO[C@@H](C)C1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000544330092 940392069 /nfs/dbraw/zinc/39/20/69/940392069.db2.gz RCQIHCVLNQTPIL-QZNHQXDQSA-N 0 3 401.595 4.278 20 0 HIADHN CCc1ccc([C@@H](CN2CCOCC2)NCc2ccc(OC(F)F)c(OC)c2)cc1 ZINC000544361692 940401731 /nfs/dbraw/zinc/40/17/31/940401731.db2.gz WWUDGFPCXQNVDJ-HXUWFJFHSA-N 0 3 420.500 4.022 20 0 HIADHN Cc1c2cc(C)ccc2[nH]c1-c1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1 ZINC000544368046 940403674 /nfs/dbraw/zinc/40/36/74/940403674.db2.gz QZQYFXDMXTZSOK-UHFFFAOYSA-N 0 3 402.502 4.039 20 0 HIADHN Cc1nn(-c2ccccc2)c(Oc2cccc(F)c2)c1CN1C[C@@H]2CC[C@@H](O)[C@@H]2C1 ZINC000544368152 940403729 /nfs/dbraw/zinc/40/37/29/940403729.db2.gz GSDNKIJESAEVJX-JJEOQYAHSA-N 0 3 407.489 4.315 20 0 HIADHN Cc1nn(-c2ccccc2)c(Oc2cccc(F)c2)c1CN1C[C@@H]2CC[C@@H](O)[C@H]2C1 ZINC000544368153 940403880 /nfs/dbraw/zinc/40/38/80/940403880.db2.gz GSDNKIJESAEVJX-PDIWNELESA-N 0 3 407.489 4.315 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Cc1nc(-c2ccc(F)cc2)cs1 ZINC000544378293 940406457 /nfs/dbraw/zinc/40/64/57/940406457.db2.gz JULUGYJQRDDUMI-UHFFFAOYSA-N 0 3 403.548 4.144 20 0 HIADHN CCOc1cc(Cc2noc([C@H]3CCN(C)C3)n2)cc(Cl)c1OCC(F)(F)F ZINC000544406592 940414586 /nfs/dbraw/zinc/41/45/86/940414586.db2.gz WLDJJDDRRRJSTC-LBPRGKRZSA-N 0 3 419.831 4.073 20 0 HIADHN Cc1ccsc1[C@H](Cc1ccccc1)NCC(=O)Nc1cccc(C(=O)N(C)C)c1 ZINC000544411660 940416345 /nfs/dbraw/zinc/41/63/45/940416345.db2.gz AZBATGBVCJPRNM-NRFANRHFSA-N 0 3 421.566 4.270 20 0 HIADHN COc1ccc(CN(C)C(=O)CN[C@@H](Cc2ccccc2)c2cccs2)cc1F ZINC000544415791 940417875 /nfs/dbraw/zinc/41/78/75/940417875.db2.gz TUJQQOJHXWVBJV-FQEVSTJZSA-N 0 3 412.530 4.428 20 0 HIADHN COCc1cccc(CNC(=O)CN[C@H](Cc2ccccc2)c2sccc2C)c1 ZINC000544415702 940417882 /nfs/dbraw/zinc/41/78/82/940417882.db2.gz NUMGZRYPMTZGIW-JOCHJYFZSA-N 0 3 408.567 4.393 20 0 HIADHN Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)NC[C@@H](O)COc1cc(C)ccc1Cl ZINC000544421211 940420312 /nfs/dbraw/zinc/42/03/12/940420312.db2.gz IWKWMGGQPUURAZ-SWLSCSKDSA-N 0 3 419.875 4.115 20 0 HIADHN Cc1ccc(-c2noc(-c3ccc(CN4CCSCC4)cc3)n2)c(N2CCCC2)n1 ZINC000544436050 940430213 /nfs/dbraw/zinc/43/02/13/940430213.db2.gz ACIKEPZCIRQRDX-UHFFFAOYSA-N 0 3 421.570 4.256 20 0 HIADHN CC(C)c1ccc(CCNC(=O)CN(C)[C@@H]2CCO[C@@H](c3ccc(F)cc3)C2)cc1 ZINC000544530436 940472795 /nfs/dbraw/zinc/47/27/95/940472795.db2.gz UETUZFVYTXWGMX-DNQXCXABSA-N 0 3 412.549 4.460 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@@H]2NCc2ccccc2Cn2cccn2)cc1 ZINC000544580181 940483720 /nfs/dbraw/zinc/48/37/20/940483720.db2.gz LPXDYLGDEXSMAA-BJKOFHAPSA-N 0 3 423.582 4.115 20 0 HIADHN O=C(Nc1ccc(Br)c(Cl)c1Cl)N1CC[C@@H](N2CC=CC2)C1 ZINC000544624143 940493016 /nfs/dbraw/zinc/49/30/16/940493016.db2.gz ANIFQPDABPJGSU-SNVBAGLBSA-N 0 3 405.123 4.234 20 0 HIADHN C[C@H](CNC(=O)N(C)[C@H]1CCO[C@H](c2ccc(F)cc2)C1)N(C)Cc1ccccc1 ZINC000544661619 940499783 /nfs/dbraw/zinc/49/97/83/940499783.db2.gz SCDKSCWRIPAZPK-LEOXJPRUSA-N 0 3 413.537 4.208 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N[C@H](C3CCCC3)C(F)(F)F)c(C)c2)CC1 ZINC000544786312 940513984 /nfs/dbraw/zinc/51/39/84/940513984.db2.gz XUFYDACOHQHCQG-LJQANCHMSA-N 0 3 412.500 4.380 20 0 HIADHN CC[C@H](CC(F)(F)F)NCc1cc(I)c(OC)c(OC)c1 ZINC000544838543 940518482 /nfs/dbraw/zinc/51/84/82/940518482.db2.gz ZXBJVVZMJSVYSF-SNVBAGLBSA-N 0 3 417.209 4.129 20 0 HIADHN Cc1ccc([C@H](CCn2cncn2)NCc2cccc(NC(=O)C3CCC3)c2)cc1 ZINC000545011995 940533405 /nfs/dbraw/zinc/53/34/05/940533405.db2.gz FWMGQSFTCYTHHH-QHCPKHFHSA-N 0 3 403.530 4.246 20 0 HIADHN COc1ccc2[nH]c3c(c2c1)C[C@H](N[C@H](c1nc(-c2ccncc2)no1)C(C)C)CC3 ZINC000545191335 940555289 /nfs/dbraw/zinc/55/52/89/940555289.db2.gz RBQLRAZEBQEWRE-ZHRRBRCNSA-N 0 3 417.513 4.466 20 0 HIADHN Cc1cc(C)c(NC(=O)CCCN2CCC([C@](C)(O)C(F)(F)F)CC2)c(C)c1 ZINC000545224162 940557071 /nfs/dbraw/zinc/55/70/71/940557071.db2.gz ACTGILXZGIIGHC-FQEVSTJZSA-N 0 3 400.485 4.356 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)NCc2nc3ccccc3n2C2CC2)CC1 ZINC000545448822 940570367 /nfs/dbraw/zinc/57/03/67/940570367.db2.gz BMLKGOAMWMVCIH-UHFFFAOYSA-N 0 3 417.557 4.177 20 0 HIADHN CS(=O)(=O)Cc1ccccc1CN[C@@H](Cc1cccnc1)c1ccc(Cl)cc1 ZINC000545457377 940570830 /nfs/dbraw/zinc/57/08/30/940570830.db2.gz DDGCPKYPIOXUQN-QFIPXVFZSA-N 0 3 414.958 4.353 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](NCCC[C@@H]2CCCCO2)c2ccc(F)c(F)c2)c1 ZINC000545459778 940570881 /nfs/dbraw/zinc/57/08/81/940570881.db2.gz AQPHLVRMZPGNPK-AVRDEDQJSA-N 0 3 423.525 4.397 20 0 HIADHN CCOc1c(Cl)cc(C(=O)N(CC)[C@@H]2CCN(Cc3ccccc3)C2)cc1OC ZINC000545475918 940571371 /nfs/dbraw/zinc/57/13/71/940571371.db2.gz SRHDYNQOKPOZLQ-LJQANCHMSA-N 0 3 416.949 4.484 20 0 HIADHN CCN(C(=O)c1csc(Nc2ccccn2)n1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000545492909 940571909 /nfs/dbraw/zinc/57/19/09/940571909.db2.gz XPAALRKAEKJZMZ-GOSISDBHSA-N 0 3 407.543 4.018 20 0 HIADHN COc1cc(-c2noc([C@H]3CCCN(Cc4cccnc4)C3)n2)ccc1OC(C)C ZINC000545530703 940573484 /nfs/dbraw/zinc/57/34/84/940573484.db2.gz CXMXIDKMZKMOLP-IBGZPJMESA-N 0 3 408.502 4.307 20 0 HIADHN CCO[C@@H]1C[C@H](NCc2cccc(NC(=O)c3ccc(Cl)cc3)c2)[C@@]12CCCO2 ZINC000545547906 940574262 /nfs/dbraw/zinc/57/42/62/940574262.db2.gz LCCKUBKOAXVXJJ-XJUOHMSHSA-N 0 3 414.933 4.409 20 0 HIADHN Cc1cc(C(=O)N(CCN2CCCC2)c2ccccc2)c(C)n1Cc1ccncc1 ZINC000545854110 940637895 /nfs/dbraw/zinc/63/78/95/940637895.db2.gz OERWAKQHZZCYAO-UHFFFAOYSA-N 0 3 402.542 4.291 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)c1cc(C)n(-c2ccccc2Cl)n1)c1ccco1 ZINC000563986684 945337215 /nfs/dbraw/zinc/33/72/15/945337215.db2.gz YITRQORCMVQIBC-KDOFPFPSSA-N 0 3 400.910 4.286 20 0 HIADHN COc1ccc2[nH]c3c(c2c1)C[C@@H](Nc1ccccc1CN1CCC(O)CC1)CC3 ZINC000545896943 940654660 /nfs/dbraw/zinc/65/46/60/940654660.db2.gz HRSZOVZXLLHZMN-SFHVURJKSA-N 0 3 405.542 4.103 20 0 HIADHN CCN(C(=O)[C@@H](C)Cc1ccc(OC)c(OC)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000546182658 940723387 /nfs/dbraw/zinc/72/33/87/940723387.db2.gz IXGUXRMOAHVHCL-SIKLNZKXSA-N 0 3 410.558 4.005 20 0 HIADHN CCN(C(=O)c1ccc(CNC(=O)C(C)(C)C)cc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000546185010 940724271 /nfs/dbraw/zinc/72/42/71/940724271.db2.gz SWEDITRAKIXCQE-HSZRJFAPSA-N 0 3 421.585 4.086 20 0 HIADHN CC[C@H](CC(F)(F)F)NC(=O)N(CCN(C)C)Cc1ccc(Br)cc1 ZINC000546200956 940727630 /nfs/dbraw/zinc/72/76/30/940727630.db2.gz KOBJIKJUWBPXKV-OAHLLOKOSA-N 0 3 424.305 4.253 20 0 HIADHN Fc1cc(Br)cc(-c2noc([C@@H]3CCCN(Cc4cccnc4)C3)n2)c1 ZINC000546272098 940755523 /nfs/dbraw/zinc/75/55/23/940755523.db2.gz VOMNIWLONOKCHD-CQSZACIVSA-N 0 3 417.282 4.413 20 0 HIADHN CC1CCN([C@H](CNC(=O)N2CC3(CCC3)[C@H]2[C@H]2CCCO2)c2cccs2)CC1 ZINC000564013324 945349242 /nfs/dbraw/zinc/34/92/42/945349242.db2.gz JMRVPKDRLIIBES-SFHLNBCPSA-N 0 3 417.619 4.264 20 0 HIADHN C[C@@H]1C[C@H]1c1ccc(/C=C\c2nc(-c3ccc(N4CCCN(C)CC4)nc3)no2)o1 ZINC000546368700 940803474 /nfs/dbraw/zinc/80/34/74/940803474.db2.gz HRDHAVFVBNNARW-VOFFAFHOSA-N 0 3 405.502 4.160 20 0 HIADHN CCc1cnccc1-c1noc([C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)n1 ZINC000546451884 940823543 /nfs/dbraw/zinc/82/35/43/940823543.db2.gz GGMXQSPCYRBCGD-HXUWFJFHSA-N 0 3 402.420 4.400 20 0 HIADHN Fc1cccc(CN2CCC[C@@H](c3nc(-c4ccc(OCC(F)F)nc4)no3)C2)c1 ZINC000546553354 940851112 /nfs/dbraw/zinc/85/11/12/940851112.db2.gz TXIHPSAGZFLUHS-MRXNPFEDSA-N 0 3 418.419 4.294 20 0 HIADHN Cc1cc(C(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)c(C)n1Cc1ccncc1 ZINC000546562874 940854268 /nfs/dbraw/zinc/85/42/68/940854268.db2.gz NHDGOSAMOGTOSW-FQEVSTJZSA-N 0 3 416.569 4.285 20 0 HIADHN Cc1ccc(S(=O)(=O)N2CCC(N[C@H](C)c3csc(C(C)C)n3)CC2)cc1 ZINC000546692970 940869516 /nfs/dbraw/zinc/86/95/16/940869516.db2.gz TUYXYXJTMMGSMH-MRXNPFEDSA-N 0 3 407.605 4.079 20 0 HIADHN COc1ccc(NC(=O)N(Cc2ccccc2)C2CCN(C)CC2)c2ncccc12 ZINC000546742636 940875285 /nfs/dbraw/zinc/87/52/85/940875285.db2.gz DDCMLJCUUAXMFA-UHFFFAOYSA-N 0 3 404.514 4.372 20 0 HIADHN Cc1nnc([C@H](C)NC(=O)N2CCN(Cc3ccccc3)C3(CCCCC3)C2)s1 ZINC000546843181 940893096 /nfs/dbraw/zinc/89/30/96/940893096.db2.gz UMGCVSQBBGUXSF-KRWDZBQOSA-N 0 3 413.591 4.138 20 0 HIADHN Cc1nc(C(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)c(-c2ccccc2)o1 ZINC000546853966 940895697 /nfs/dbraw/zinc/89/56/97/940895697.db2.gz WXCYRQRMRFVYCY-HDICACEKSA-N 0 3 411.546 4.002 20 0 HIADHN CCN(C(=O)c1cc(C)n(-c2cccc(F)c2)n1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000546888469 940902297 /nfs/dbraw/zinc/90/22/97/940902297.db2.gz CPUCGLVYJIQUSO-JOCHJYFZSA-N 0 3 406.505 4.056 20 0 HIADHN CCN(C(=O)c1ccc(-c2ccccc2)[nH]c1=O)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000546913385 940910548 /nfs/dbraw/zinc/91/05/48/940910548.db2.gz CKRXJDAKOQRTSA-OAQYLSRUSA-N 0 3 401.510 4.191 20 0 HIADHN C[C@H](NC(=O)N(C)C1CCN(CCc2ccccn2)CC1)c1ccc2c(c1)CCCC2 ZINC000546920971 940913525 /nfs/dbraw/zinc/91/35/25/940913525.db2.gz HNIYUJVSFVFYFP-FQEVSTJZSA-N 0 3 420.601 4.370 20 0 HIADHN CCN(C(=O)c1cc(C)n(-c2nccs2)c1C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000546977036 940934208 /nfs/dbraw/zinc/93/42/08/940934208.db2.gz NALWROGKXNJHAP-FQEVSTJZSA-N 0 3 408.571 4.287 20 0 HIADHN C[C@H](CSCc1ccccc1)c1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1 ZINC000547074354 940985272 /nfs/dbraw/zinc/98/52/72/940985272.db2.gz VVDXPNRPMDGUCN-GOSISDBHSA-N 0 3 423.586 4.310 20 0 HIADHN COCCOc1cccc(-c2noc([C@@H]3CCCN(Cc4cccc(F)c4)C3)n2)c1 ZINC000547076389 940986215 /nfs/dbraw/zinc/98/62/15/940986215.db2.gz SHKNQTXQMNKJRQ-LJQANCHMSA-N 0 3 411.477 4.281 20 0 HIADHN CN(C)[C@@H](CNC(=O)CN(Cc1cccs1)Cc1cccs1)c1ccccc1 ZINC000547786107 941075977 /nfs/dbraw/zinc/07/59/77/941075977.db2.gz MTDACVLPUMGBPS-NRFANRHFSA-N 0 3 413.612 4.231 20 0 HIADHN CC(C)N1CCN([C@H]2CCN(Cc3nc(-c4ccccc4Cl)cs3)C2)CC1 ZINC000547829541 941077620 /nfs/dbraw/zinc/07/76/20/941077620.db2.gz VMRMAERFAKNFIP-KRWDZBQOSA-N 0 3 405.011 4.064 20 0 HIADHN COc1cccc([C@@H](CNC(=O)N[C@H](C(C)(C)C)C(F)(F)F)N2CCCC2)c1 ZINC000548181042 941091038 /nfs/dbraw/zinc/09/10/38/941091038.db2.gz MUPYJISAJBTCIF-IAGOWNOFSA-N 0 3 401.473 4.108 20 0 HIADHN Cc1cc(Br)c(F)cc1NC(=O)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000548432550 941103935 /nfs/dbraw/zinc/10/39/35/941103935.db2.gz AQQWPQREIFMHPW-HNNXBMFYSA-N 0 3 406.299 4.142 20 0 HIADHN Cc1nc(N[C@@H]2CCCC23CCOCC3)cc(N[C@@H]2CCCC23CCOCC3)n1 ZINC000548822213 941125406 /nfs/dbraw/zinc/12/54/06/941125406.db2.gz BSHFJYIERUCWES-RTBURBONSA-N 0 3 400.567 4.307 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CC[C@@](F)(c4ccccc4F)C3)c2)CC1 ZINC000548977182 941137724 /nfs/dbraw/zinc/13/77/24/941137724.db2.gz OVHPQRZCWTWUDP-QHCPKHFHSA-N 0 3 414.500 4.070 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1ccc2nnc(C3CCC3)n2c1 ZINC000549002560 941141220 /nfs/dbraw/zinc/14/12/20/941141220.db2.gz IZCXEGBOVUMTPS-SFHVURJKSA-N 0 3 418.545 4.125 20 0 HIADHN COc1ccc([C@H](CNC(=O)Nc2ccc(C(F)(F)F)nc2C)N2CCCC2)cc1 ZINC000549045303 941147939 /nfs/dbraw/zinc/14/79/39/941147939.db2.gz MWHNPPUUEHNBNV-SFHVURJKSA-N 0 3 422.451 4.376 20 0 HIADHN Cc1nc2cccc(C(=O)N(CCN(C)C)Cc3ccc(C(F)(F)F)cc3)c2[nH]1 ZINC000549083416 941154469 /nfs/dbraw/zinc/15/44/69/941154469.db2.gz MTLFOPRSMVOJLA-UHFFFAOYSA-N 0 3 404.436 4.094 20 0 HIADHN CC(C)(C)N1CC[C@@H](NCc2cn3cccnc3n2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000549112766 941160952 /nfs/dbraw/zinc/16/09/52/941160952.db2.gz GMVWVVRGYWANIC-MOPGFXCFSA-N 0 3 401.917 4.226 20 0 HIADHN CCN1CC[C@H](NCC(=O)Nc2cccc(C)c2C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000549115387 941161515 /nfs/dbraw/zinc/16/15/15/941161515.db2.gz GWWGQZJGSUYFIQ-RBBKRZOGSA-N 0 3 403.929 4.460 20 0 HIADHN CN(C)c1noc([C@H]2CCCN(CCSc3ccnc4cc(Cl)ccc43)C2)n1 ZINC000549147545 941165346 /nfs/dbraw/zinc/16/53/46/941165346.db2.gz LUEUYIPKWFCJQE-AWEZNQCLSA-N 0 3 417.966 4.309 20 0 HIADHN Cc1nn(-c2ccccc2)cc1CCCNC(=O)NC[C@H](c1ccc(C)cc1)N(C)C ZINC000549205849 941170835 /nfs/dbraw/zinc/17/08/35/941170835.db2.gz FIMBWHSGWMTZIJ-XMMPIXPASA-N 0 3 419.573 4.024 20 0 HIADHN O=S1(=O)CCc2cc(CN[C@@H]3CCCCc4cc(Br)ccc43)ccc21 ZINC000549237369 941173044 /nfs/dbraw/zinc/17/30/44/941173044.db2.gz NTELTMKXJBZKNA-LJQANCHMSA-N 0 3 420.372 4.336 20 0 HIADHN O=C(Nc1ncc(C(F)(F)F)s1)N1CCCN(CCCc2ccccc2)CC1 ZINC000549271155 941175728 /nfs/dbraw/zinc/17/57/28/941175728.db2.gz GAVDZORUAZBKRR-UHFFFAOYSA-N 0 3 412.481 4.334 20 0 HIADHN CCc1ccccc1[C@@H]1C[C@H]1C(=O)Nc1ccc(C(=O)N(C)[C@@H]2CCCN(C)C2)cc1 ZINC000549295433 941177753 /nfs/dbraw/zinc/17/77/53/941177753.db2.gz RWBPJBYGXNNHRB-YFNKSVMNSA-N 0 3 419.569 4.157 20 0 HIADHN Cc1ccc(C)c(NC(=O)CN[C@@H]2CCN(C(C)C)[C@H]2c2ccc(F)c(F)c2)c1 ZINC000549469477 941193192 /nfs/dbraw/zinc/19/31/92/941193192.db2.gz UGMKOAWMDSJZHB-OFNKIYASSA-N 0 3 401.501 4.334 20 0 HIADHN CCN1CC[C@H](NCC(=O)Nc2c(C)cccc2C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000549470500 941193421 /nfs/dbraw/zinc/19/34/21/941193421.db2.gz CURJURQURTWINQ-UGKGYDQZSA-N 0 3 403.929 4.460 20 0 HIADHN C[C@H](c1ccc(F)cc1)N1CC[C@H](N[C@H]2CCO[C@H]2c2ccc(Cl)cc2)C1=O ZINC000549609838 941201222 /nfs/dbraw/zinc/20/12/22/941201222.db2.gz BZQYOMFSEMHPKU-LYARXQMPSA-N 0 3 402.897 4.261 20 0 HIADHN COc1cccc(/C=C(\CC(=O)N2CCCN(C)CC2)c2nc3ccccc3s2)c1 ZINC000549803794 941207861 /nfs/dbraw/zinc/20/78/61/941207861.db2.gz LRSIVESIHQNSFE-XDJHFCHBSA-N 0 3 421.566 4.400 20 0 HIADHN CC(C)Cn1c(Cc2c[nH]c3ccccc23)nnc1N1CCN(C2CCCC2)CC1 ZINC000549840793 941211248 /nfs/dbraw/zinc/21/12/48/941211248.db2.gz CRABHADKSQUOOL-UHFFFAOYSA-N 0 3 406.578 4.071 20 0 HIADHN CCc1nc(C(C)C)ccc1C(=O)NCCCCN1CCN(c2ccccc2)CC1 ZINC000549856789 941217812 /nfs/dbraw/zinc/21/78/12/941217812.db2.gz YRJBQIQXMUBLKB-UHFFFAOYSA-N 0 3 408.590 4.100 20 0 HIADHN CN(C(=O)c1cc(Cl)c(F)cc1Cl)C1CCN(CCc2ccccn2)CC1 ZINC000549950470 941246613 /nfs/dbraw/zinc/24/66/13/941246613.db2.gz JNWUVTANTGIFKP-UHFFFAOYSA-N 0 3 410.320 4.307 20 0 HIADHN COc1cc(-c2noc([C@@]3(C(F)(F)F)CCN(Cc4ccccc4)C3)n2)cc(C)n1 ZINC000550066156 941278293 /nfs/dbraw/zinc/27/82/93/941278293.db2.gz FWDNKTGSMIDNQP-HXUWFJFHSA-N 0 3 418.419 4.155 20 0 HIADHN Cc1ccccc1C(C)(C)NCC(=O)N1c2ccccc2NC(=O)C[C@H]1C(F)(F)F ZINC000550263508 941305876 /nfs/dbraw/zinc/30/58/76/941305876.db2.gz PFMSDIRHXHAUOC-SFHVURJKSA-N 0 3 419.447 4.126 20 0 HIADHN CCS(=O)(=O)c1ccc([C@H](C)N[C@H](C)c2ccc(NC(=O)NC3CC3)cc2)cc1 ZINC000550425724 941325322 /nfs/dbraw/zinc/32/53/22/941325322.db2.gz UFRXXOSADKOZEG-CVEARBPZSA-N 0 3 415.559 4.176 20 0 HIADHN C[C@@H](NCc1ccccc1OCC(=O)NC[C@H]1CCCO1)c1cccc(C2CC2)c1 ZINC000550618715 941346368 /nfs/dbraw/zinc/34/63/68/941346368.db2.gz FVSKDMBSEZUUMA-WZONZLPQSA-N 0 3 408.542 4.089 20 0 HIADHN NS(=O)(=O)c1ccc2c(c1)CCC[C@H]2NCc1ccccc1Oc1ccccc1 ZINC000550643893 941349127 /nfs/dbraw/zinc/34/91/27/941349127.db2.gz GUOMAJVYCJLTJA-JOCHJYFZSA-N 0 3 408.523 4.294 20 0 HIADHN C[C@@H](NC[C@H](c1ccc(C(F)(F)F)cc1)N1CCOCC1)c1cn2ccccc2n1 ZINC000550885532 941379456 /nfs/dbraw/zinc/37/94/56/941379456.db2.gz GJBIGSLGBBHGBY-OXQOHEQNSA-N 0 3 418.463 4.077 20 0 HIADHN CCO[C@@H]1C[C@H](N[C@@H]2CCSc3ccc(Br)cc32)[C@H]1n1cccn1 ZINC000550947139 941384353 /nfs/dbraw/zinc/38/43/53/941384353.db2.gz XECLUZODOLGARR-KYHPRHEASA-N 0 3 408.365 4.191 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2ccc(C(C)(F)F)cc2)cc1)[C@@H]1CCCN(C)C1 ZINC000551056400 941401830 /nfs/dbraw/zinc/40/18/30/941401830.db2.gz JOSYNZUQTMYTGA-HXUWFJFHSA-N 0 3 415.484 4.217 20 0 HIADHN Cc1ccc(-c2noc([C@@H](C)N[C@H](C)C3CCN(CC(F)(F)F)CC3)n2)cc1F ZINC000551093598 941408949 /nfs/dbraw/zinc/40/89/49/941408949.db2.gz OYMXAYGPJDTVJL-ZIAGYGMSSA-N 0 3 414.447 4.498 20 0 HIADHN C[C@H](CS(=O)(=O)c1ccccc1)NCCc1ccc(Br)cc1Cl ZINC000551307593 941448135 /nfs/dbraw/zinc/44/81/35/941448135.db2.gz SRKBXXPJTZNQIT-CYBMUJFWSA-N 0 3 416.768 4.097 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)c2ccc(OC3CCC3)cc2Cl)cc1 ZINC000551540451 941498054 /nfs/dbraw/zinc/49/80/54/941498054.db2.gz NVJFYXLMSQIZSD-OAQYLSRUSA-N 0 3 402.922 4.313 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)[C@@H]2C[C@@H]2c2ccc(C(F)(F)F)cc2)cc1 ZINC000551540913 941498139 /nfs/dbraw/zinc/49/81/39/941498139.db2.gz SMMLFSYGEBCGBJ-AQNXPRMDSA-N 0 3 406.448 4.237 20 0 HIADHN CC(C)(C)c1nn(-c2ccccc2Cl)cc1CN[C@H](CO)C[C@H](O)C(C)(C)C ZINC000551571130 941503872 /nfs/dbraw/zinc/50/38/72/941503872.db2.gz KDCIPEGRVYGYEU-LPHOPBHVSA-N 0 3 407.986 4.071 20 0 HIADHN CC[C@H](NCc1cccc(N2C(=O)N[C@@](C)(C3CC3)C2=O)c1)c1ccc(OC)cc1 ZINC000551574454 941505405 /nfs/dbraw/zinc/50/54/05/941505405.db2.gz IWJUODPNBHZYDQ-URXFXBBRSA-N 0 3 407.514 4.161 20 0 HIADHN COC(=O)c1ccccc1-c1ccc(CN[C@@H](CN(C)C)c2ccc(OC)cc2)o1 ZINC000551600091 941509660 /nfs/dbraw/zinc/50/96/60/941509660.db2.gz HQDSEXBLDAJRQV-QFIPXVFZSA-N 0 3 408.498 4.134 20 0 HIADHN COC(=O)[C@H](Cc1ccccc1)[C@H](C)N[C@H](C)C(=O)Nc1cc(Cl)ccc1Cl ZINC000551718115 941532772 /nfs/dbraw/zinc/53/27/72/941532772.db2.gz OPPBREDQUIUBSG-JJRVBVJISA-N 0 3 423.340 4.330 20 0 HIADHN Cc1nc([C@@H]2CCCOC2)sc1C(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000551740947 941536777 /nfs/dbraw/zinc/53/67/77/941536777.db2.gz ZQOCTVZZGVPLIV-LJQANCHMSA-N 0 3 413.587 4.082 20 0 HIADHN CCc1nc(C(C)C)ccc1C(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000551750543 941538714 /nfs/dbraw/zinc/53/87/14/941538714.db2.gz RYEJXQQPZZHJTB-RTBURBONSA-N 0 3 401.595 4.119 20 0 HIADHN CCOc1cc(C[NH2+]CCc2ccc(OC(F)F)cc2)cc(Br)c1[O-] ZINC000551956203 941563106 /nfs/dbraw/zinc/56/31/06/941563106.db2.gz NLRZMYGPNQLIHJ-UHFFFAOYSA-N 0 3 416.262 4.487 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccc(O)cc1)C(=O)c1sc(C(C)C)nc1C ZINC000551987595 941564752 /nfs/dbraw/zinc/56/47/52/941564752.db2.gz HLHSADWEOCXZSO-GOSISDBHSA-N 0 3 401.576 4.407 20 0 HIADHN COc1ccc2c(c1)CCCN(C(=O)[C@@H]1CN(Cc3ccccc3)CCC1(F)F)C2 ZINC000552006079 941567872 /nfs/dbraw/zinc/56/78/72/941567872.db2.gz AXFBVYISPJIUPP-QFIPXVFZSA-N 0 3 414.496 4.127 20 0 HIADHN COc1ccc2c(c1)CCCN(C(=O)[C@H]1CN(Cc3ccccc3)CCC1(F)F)C2 ZINC000552006078 941568000 /nfs/dbraw/zinc/56/80/00/941568000.db2.gz AXFBVYISPJIUPP-JOCHJYFZSA-N 0 3 414.496 4.127 20 0 HIADHN CN(C(=O)CN[C@H]1CCC[C@H]1Oc1cc(F)cc(F)c1)c1nc2ccccc2s1 ZINC000552057808 941575463 /nfs/dbraw/zinc/57/54/63/941575463.db2.gz IQKLKRMNPVKVQU-FUHWJXTLSA-N 0 3 417.481 4.127 20 0 HIADHN CC(C)(C)c1nn(-c2ccccc2Cl)cc1CN1CCN(C2CCOCC2)CC1 ZINC000552073820 941579602 /nfs/dbraw/zinc/57/96/02/941579602.db2.gz RJIWNCROOOUVHO-UHFFFAOYSA-N 0 3 416.997 4.120 20 0 HIADHN CNC(=O)COc1cccc(CN[C@@H](C)c2ccc(-c3ccccc3OC)cc2)c1 ZINC000552089622 941583259 /nfs/dbraw/zinc/58/32/59/941583259.db2.gz PVWRWXHJVRZPTR-SFHVURJKSA-N 0 3 404.510 4.338 20 0 HIADHN C[C@@H](NC[C@H](N1CCOCC1)C(F)(F)F)c1ccc(SCC(F)(F)F)cc1 ZINC000552100788 941585161 /nfs/dbraw/zinc/58/51/61/941585161.db2.gz VTBAZNUDYDUODO-DOMZBBRYSA-N 0 3 416.431 4.255 20 0 HIADHN CN(CCCN(C)C(=O)C1c2ccccc2Oc2ccccc21)Cc1ccncc1 ZINC000552112336 941586854 /nfs/dbraw/zinc/58/68/54/941586854.db2.gz YYMNPBOHJZHEHO-UHFFFAOYSA-N 0 3 401.510 4.300 20 0 HIADHN C[C@@H](Cc1cccc(C(F)(F)F)c1)C(=O)N(C)CCCN(C)Cc1ccncc1 ZINC000552112505 941587607 /nfs/dbraw/zinc/58/76/07/941587607.db2.gz GRMCFLCNHKGKRZ-KRWDZBQOSA-N 0 3 407.480 4.260 20 0 HIADHN COc1cc(OC)c(OC)cc1CNCCC(=O)Nc1cc(Cl)cc(Cl)c1 ZINC000552129992 941590202 /nfs/dbraw/zinc/59/02/02/941590202.db2.gz VGOOBFJCLWBKBG-UHFFFAOYSA-N 0 3 413.301 4.138 20 0 HIADHN CCOc1ccc2cc(C(=O)N3CCN(c4ccnc5ccccc54)CC3)[nH]c2c1 ZINC000552148410 941593869 /nfs/dbraw/zinc/59/38/69/941593869.db2.gz FWYPQOBDKIGNGY-UHFFFAOYSA-N 0 3 400.482 4.077 20 0 HIADHN C[C@H](CC(=O)Nc1cc(C(F)(F)F)ccc1Cl)NCc1cnc2n1CCCC2 ZINC000552153578 941594654 /nfs/dbraw/zinc/59/46/54/941594654.db2.gz MXRXPOKSCRNBJZ-GFCCVEGCSA-N 0 3 414.859 4.399 20 0 HIADHN O=C(NCc1nc2ccccc2n1C1CC1)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000552162754 941595612 /nfs/dbraw/zinc/59/56/12/941595612.db2.gz FYSUMPGJZZJZBX-IBGZPJMESA-N 0 3 424.495 4.145 20 0 HIADHN C[C@H](NC(=O)c1cccc(C(=O)Nc2ccccc2)c1)[C@H](c1ccccc1)N(C)C ZINC000552162745 941595629 /nfs/dbraw/zinc/59/56/29/941595629.db2.gz FPYKHRJYSMTAPK-FDDCHVKYSA-N 0 3 401.510 4.360 20 0 HIADHN COc1cccc([C@H](CNC(=O)CCc2ccc3ccccc3n2)N2CCCC2)c1 ZINC000552196091 941599875 /nfs/dbraw/zinc/59/98/75/941599875.db2.gz RIAZKVUTXWISRX-DEOSSOPVSA-N 0 3 403.526 4.129 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)[C@@H]1C[C@@H]1c1cc(Cl)cc(Cl)c1 ZINC000552200468 941601134 /nfs/dbraw/zinc/60/11/34/941601134.db2.gz FKMBUWIUNLNJRM-XUVXKRRUSA-N 0 3 405.325 4.302 20 0 HIADHN O[C@H](CN[C@H]1CCOc2c(Cl)cccc21)COc1cc(Cl)ccc1Cl ZINC000552226851 941608519 /nfs/dbraw/zinc/60/85/19/941608519.db2.gz QUHIWARAAGBHSC-WBMJQRKESA-N 0 3 402.705 4.500 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)C[C@H](NC(C)=O)c1cccs1)c1ccc(Cl)cc1 ZINC000552241159 941611009 /nfs/dbraw/zinc/61/10/09/941611009.db2.gz CJJZFAGUFQRPQK-OALUTQOASA-N 0 3 421.994 4.168 20 0 HIADHN C[C@@H](N[C@@H](c1cccc(OC(F)(F)F)c1)C1CC1)c1cccc(S(N)(=O)=O)c1 ZINC000552317743 941630040 /nfs/dbraw/zinc/63/00/40/941630040.db2.gz HEPFZNXKSPFXOH-KZULUSFZSA-N 0 3 414.449 4.035 20 0 HIADHN CC(C)N(CCc1nccs1)C(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000552367197 941646340 /nfs/dbraw/zinc/64/63/40/941646340.db2.gz DKHWFYZPQGMWKC-SFHVURJKSA-N 0 3 407.530 4.080 20 0 HIADHN O=C(N[C@@H]1CCOC2(CCCCC2)C1)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000552388647 941653188 /nfs/dbraw/zinc/65/31/88/941653188.db2.gz MPOMNLLFTOXDQB-UXHICEINSA-N 0 3 406.517 4.142 20 0 HIADHN FC(F)(F)c1ccc(Cn2cc(CN3CC4(CCOCC4)[C@H]3C3CC3)cn2)cc1 ZINC000552391869 941654550 /nfs/dbraw/zinc/65/45/50/941654550.db2.gz ACRGQEIAILQUKI-HXUWFJFHSA-N 0 3 405.464 4.341 20 0 HIADHN Cc1nn(-c2ccc(Cl)c(Cl)c2)c(C)c1CC(=O)N1[C@@H]2CC[C@H]1CCN(C)C2 ZINC000552420589 941665501 /nfs/dbraw/zinc/66/55/01/941665501.db2.gz KFAAHFKMNOQVBS-DOTOQJQBSA-N 0 3 421.372 4.034 20 0 HIADHN Cc1nc([C@H]2CCCOC2)sc1C(=O)N(CCN1CCCCCC1)C1CCC1 ZINC000552441616 941672525 /nfs/dbraw/zinc/67/25/25/941672525.db2.gz OAXWMYYRKICZEW-SFHVURJKSA-N 0 3 405.608 4.216 20 0 HIADHN C[C@@H](C(=O)NC[C@@H]1CCO[C@H]1c1ccc(F)cc1)N1CCC(Cc2ccccc2)CC1 ZINC000552485409 941685298 /nfs/dbraw/zinc/68/52/98/941685298.db2.gz XLPIZYHLDOWSJP-QXWFJRNPSA-N 0 3 424.560 4.363 20 0 HIADHN CC(C)Cn1cc(NC(=O)N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)c(C(F)F)n1 ZINC000552490398 941687029 /nfs/dbraw/zinc/68/70/29/941687029.db2.gz QNLNSORAXKLMIT-NVXWUHKLSA-N 0 3 405.493 4.261 20 0 HIADHN Cc1ccc(-n2cccn2)cc1NC(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000552493426 941687917 /nfs/dbraw/zinc/68/79/17/941687917.db2.gz PBYRUKUFYPWJHV-FQEVSTJZSA-N 0 3 410.468 4.277 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl ZINC000552516150 941691853 /nfs/dbraw/zinc/69/18/53/941691853.db2.gz JSLTWHUILPMYKT-YTQUADARSA-N 0 3 405.325 4.302 20 0 HIADHN C[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)Nc1cccc(CN2CC[C@H](O)C2)c1 ZINC000552516077 941692369 /nfs/dbraw/zinc/69/23/69/941692369.db2.gz IMMMGXYIVYHMDE-QRWLVFNGSA-N 0 3 406.448 4.089 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)[C@H]1C[C@@H]1c1ccc(Cl)cc1Cl ZINC000552516148 941692398 /nfs/dbraw/zinc/69/23/98/941692398.db2.gz JSLTWHUILPMYKT-UHOSZYNNSA-N 0 3 405.325 4.302 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)[C@@H]1C[C@@H]1c1cccc(C(F)(F)F)c1 ZINC000552514822 941692416 /nfs/dbraw/zinc/69/24/16/941692416.db2.gz OZDNCHHKPIBBLX-XUVXKRRUSA-N 0 3 404.432 4.014 20 0 HIADHN O[C@H](COc1cccc(C(F)(F)F)c1)CN1CCC(OC2CCCCC2)CC1 ZINC000552617408 941725035 /nfs/dbraw/zinc/72/50/35/941725035.db2.gz JXAAOTRSLGOXRY-KRWDZBQOSA-N 0 3 401.469 4.259 20 0 HIADHN Cc1ccc(C)c(C(=O)CCC(=O)N2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)c1 ZINC000552684852 941737533 /nfs/dbraw/zinc/73/75/33/941737533.db2.gz WCYAGYLTEDTMSG-AREMUKBSSA-N 0 3 404.554 4.391 20 0 HIADHN CO[C@H]1C[C@@H](CN2CCCC2)N(C(=O)c2ccc(Sc3ccc(Cl)cc3)o2)C1 ZINC000552693874 941739098 /nfs/dbraw/zinc/73/90/98/941739098.db2.gz RUPUOJKYXHRURT-IRXDYDNUSA-N 0 3 420.962 4.410 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)c2oc3ccc(CCC(C)=O)cc3c2C)cc1 ZINC000552815085 941773727 /nfs/dbraw/zinc/77/37/27/941773727.db2.gz CROKLZBIXYQRIR-QFIPXVFZSA-N 0 3 422.525 4.304 20 0 HIADHN O=C(Cc1cccc(O)c1)N(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000552850942 941787727 /nfs/dbraw/zinc/78/77/27/941787727.db2.gz DNTXUWQNOCFRED-DEOSSOPVSA-N 0 3 415.537 4.023 20 0 HIADHN COc1ccccc1[C@@H]1CC[C@H](C)CN1C(=O)CC1(N2CCOCC2)CCCC1 ZINC000552887971 941798518 /nfs/dbraw/zinc/79/85/18/941798518.db2.gz JJLKKJHHGGKIRN-FPOVZHCZSA-N 0 3 400.563 4.030 20 0 HIADHN CCCN(C)[C@H](CNC(=O)CSc1nc(C)cc(C)n1)c1ccc(Cl)cc1 ZINC000553027374 941819554 /nfs/dbraw/zinc/81/95/54/941819554.db2.gz XVMNJZSIHAFUTO-GOSISDBHSA-N 0 3 406.983 4.038 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(-n2cccn2)cc1)C(=O)Nc1ccccc1OC(F)F ZINC000553034436 941821040 /nfs/dbraw/zinc/82/10/40/941821040.db2.gz HDZAYHBEQIFTFE-LSDHHAIUSA-N 0 3 400.429 4.152 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccc(F)c2)C1)N1C[C@H](c2ccccc2)[C@@H]2COCC[C@@H]21 ZINC000553040812 941822647 /nfs/dbraw/zinc/82/26/47/941822647.db2.gz OOGLYGKMTHLDMA-VGCGRUFVSA-N 0 3 422.544 4.069 20 0 HIADHN CN(CCC(=O)N[C@H](c1cccs1)c1ccccc1)C[C@@H]1COc2ccccc2O1 ZINC000553063290 941826770 /nfs/dbraw/zinc/82/67/70/941826770.db2.gz JYTLBXMVDLTNHF-DVECYGJZSA-N 0 3 422.550 4.116 20 0 HIADHN CN(CCC(=O)N[C@H](c1cccs1)c1ccccc1)C[C@H]1COc2ccccc2O1 ZINC000553063289 941826801 /nfs/dbraw/zinc/82/68/01/941826801.db2.gz JYTLBXMVDLTNHF-CYFREDJKSA-N 0 3 422.550 4.116 20 0 HIADHN C[C@@H](NCc1cccc(OCc2ccccc2)c1)c1ccc(NS(C)(=O)=O)cc1 ZINC000553300884 941863404 /nfs/dbraw/zinc/86/34/04/941863404.db2.gz KPLUTUFELSEHIV-GOSISDBHSA-N 0 3 410.539 4.488 20 0 HIADHN Cc1cc(Cl)ccc1NC(=O)[C@H](C)N[C@H](c1ccc2c(c1)OCCO2)C1CC1 ZINC000553315088 941866264 /nfs/dbraw/zinc/86/62/64/941866264.db2.gz PAZCEMRBSIYJJB-QKKBWIMNSA-N 0 3 400.906 4.488 20 0 HIADHN C[C@H](Sc1ccc(Br)cc1)C(=O)N1CCN(C2CCC2)C[C@H](C)C1 ZINC000553525745 941903143 /nfs/dbraw/zinc/90/31/43/941903143.db2.gz IKGIWYOPLGVXNM-GJZGRUSLSA-N 0 3 411.409 4.263 20 0 HIADHN COCCOc1cc(C)ccc1NC(=O)NC[C@@H]1CCCCN1Cc1ccccc1 ZINC000553598206 941916999 /nfs/dbraw/zinc/91/69/99/941916999.db2.gz BBYYBYJUCKWKQC-NRFANRHFSA-N 0 3 411.546 4.196 20 0 HIADHN Cc1oc(-c2ccccc2)nc1CC(=O)NC[C@@H](c1ccc(OC(C)C)cc1)N(C)C ZINC000553694407 941945842 /nfs/dbraw/zinc/94/58/42/941945842.db2.gz KGYJWWRGNJIJPL-QHCPKHFHSA-N 0 3 421.541 4.399 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)c1ccc(OCc2ccncc2)cc1 ZINC000553820389 941977037 /nfs/dbraw/zinc/97/70/37/941977037.db2.gz YVJIYJFUMOATGG-UHFFFAOYSA-N 0 3 407.489 4.004 20 0 HIADHN C[C@H]1CN(C(=O)c2cc(-c3ccccc3C(F)(F)F)on2)CCN(C2CCC2)C1 ZINC000553862679 941986192 /nfs/dbraw/zinc/98/61/92/941986192.db2.gz FJIMLIMEAUBMEY-CQSZACIVSA-N 0 3 407.436 4.307 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)[C@@H](C)Cc3cncc4ccccc43)c2)CC1 ZINC000553978582 942012194 /nfs/dbraw/zinc/01/21/94/942012194.db2.gz VMMISEQAQLBIOG-IBGZPJMESA-N 0 3 402.542 4.194 20 0 HIADHN CN(Cc1ccc(OCC(F)(F)F)cc1)C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000553990307 942014320 /nfs/dbraw/zinc/01/43/20/942014320.db2.gz XCQYAWMYJZMITF-WOJBJXKFSA-N 0 3 421.463 4.215 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)NC[C@@H]1CCO[C@H]1c1ccccc1 ZINC000554063592 942027817 /nfs/dbraw/zinc/02/78/17/942027817.db2.gz LNMOVEQEHGRKGL-VXNXHJTFSA-N 0 3 409.574 4.220 20 0 HIADHN COC[C@@H](NC1CCN(C(=O)c2ccccc2F)CC1)c1cccc(Cl)c1F ZINC000554071677 942029617 /nfs/dbraw/zinc/02/96/17/942029617.db2.gz LUHVNEIUEIKITK-LJQANCHMSA-N 0 3 408.876 4.200 20 0 HIADHN COC1(CN[C@@H](C)CS(=O)(=O)c2ccccc2)CCC(c2ccccc2)CC1 ZINC000554087026 942034015 /nfs/dbraw/zinc/03/40/15/942034015.db2.gz SSYUXVNEVVBVRI-YGWXTMFKSA-N 0 3 401.572 4.181 20 0 HIADHN C[C@H]1C[C@@H]1N1CCN(C(=O)c2ccc(Sc3ccccc3Cl)nn2)C[C@@H](C)C1 ZINC000554132801 942045194 /nfs/dbraw/zinc/04/51/94/942045194.db2.gz VEZABZXBPQDBMA-MPGHIAIKSA-N 0 3 416.978 4.084 20 0 HIADHN O=C(CCC(=O)N1CCC2(C1)CCN(Cc1ccccc1)CC2)c1ccc(F)cc1 ZINC000554160170 942052562 /nfs/dbraw/zinc/05/25/62/942052562.db2.gz OYARAOWSCSNJKS-UHFFFAOYSA-N 0 3 408.517 4.303 20 0 HIADHN C[C@H](CN(C(=O)NC[C@H](c1cccs1)N1CCCC1)[C@@H](C)CO)c1ccccc1 ZINC000554218613 942071076 /nfs/dbraw/zinc/07/10/76/942071076.db2.gz OUTUOQIJAWNOQU-SVFBPWRDSA-N 0 3 415.603 4.081 20 0 HIADHN Cc1cc(OC[C@@H](O)CN2CC[C@H](OCc3ccncc3)C2)c(C(C)C)cc1Cl ZINC000554248144 942076974 /nfs/dbraw/zinc/07/69/74/942076974.db2.gz SCWMMWSAVYQTHL-PMACEKPBSA-N 0 3 418.965 4.198 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)Nc2ccccc2OC(F)F)N(C)C)cc1 ZINC000554348804 942109938 /nfs/dbraw/zinc/10/99/38/942109938.db2.gz MINKDNMGHCGHQE-GOSISDBHSA-N 0 3 407.461 4.500 20 0 HIADHN OC[C@@H](CN[C@@H](c1cccc(F)c1)c1cccc(Br)c1)c1cccnc1 ZINC000554404493 942129092 /nfs/dbraw/zinc/12/90/92/942129092.db2.gz ZZBSIXRSAOYQQW-WIYYLYMNSA-N 0 3 415.306 4.438 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)Nc1ccc(Oc2ncccn2)cc1C)c1ccco1 ZINC000554413834 942132854 /nfs/dbraw/zinc/13/28/54/942132854.db2.gz AXANFJBUWOVZMD-VQIMIIECSA-N 0 3 409.490 4.421 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)Nc1cccc(NC(=O)c2ccoc2)c1)c1ccco1 ZINC000554428680 942140186 /nfs/dbraw/zinc/14/01/86/942140186.db2.gz XRTTVTGXAHYXDY-BEFAXECRSA-N 0 3 410.474 4.376 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](N[C@H]2CCC23CCOCC3)c2ccc(F)c(F)c2)c1 ZINC000554558913 942167496 /nfs/dbraw/zinc/16/74/96/942167496.db2.gz NEFLKVRBJOQEPC-LEWJYISDSA-N 0 3 421.509 4.007 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)c1ccc(-c2noc(C(F)F)n2)cc1)c1ccco1 ZINC000554633720 942180828 /nfs/dbraw/zinc/18/08/28/942180828.db2.gz ZENRCLXHDPGMPZ-IUODEOHRSA-N 0 3 404.417 4.126 20 0 HIADHN CSc1ccc([C@@H](CNC(=O)Cc2nc(-c3ccccc3)oc2C)N(C)C)cc1 ZINC000554707940 942206211 /nfs/dbraw/zinc/20/62/11/942206211.db2.gz VOKIASQTROOWAH-OAQYLSRUSA-N 0 3 409.555 4.334 20 0 HIADHN COc1ccc(CN(CCCOc2ccc(S(C)(=O)=O)cc2)C(C)(C)C)cc1 ZINC000554746768 942220061 /nfs/dbraw/zinc/22/00/61/942220061.db2.gz FOPUBEWVPFPAON-UHFFFAOYSA-N 0 3 405.560 4.168 20 0 HIADHN CCOc1c(Cl)cc(CNC[C@H](O)CO[C@H]2CCCc3ccccc32)cc1OC ZINC000554831633 942270439 /nfs/dbraw/zinc/27/04/39/942270439.db2.gz WTTNSUGNQZLFRM-RXVVDRJESA-N 0 3 419.949 4.292 20 0 HIADHN CC(C)C[C@@H]([NH2+]C[C@H](C)c1ccc(C(F)(F)F)cc1)c1nc(-c2nc[n-]n2)no1 ZINC000554862747 942296524 /nfs/dbraw/zinc/29/65/24/942296524.db2.gz QNQFTDVGKVTPDM-SWLSCSKDSA-N 0 3 408.428 4.354 20 0 HIADHN CC(C)C[C@@H](NC[C@H](C)c1ccc(C(F)(F)F)cc1)c1nc(-c2nc[nH]n2)no1 ZINC000554862747 942296526 /nfs/dbraw/zinc/29/65/26/942296526.db2.gz QNQFTDVGKVTPDM-SWLSCSKDSA-N 0 3 408.428 4.354 20 0 HIADHN CC(C)(C)[C@H](CN1CCc2ccccc2C1)NC(=O)c1ncsc1C(F)(F)F ZINC000554874811 942303217 /nfs/dbraw/zinc/30/32/17/942303217.db2.gz WLDIFYBAZICMPR-HNNXBMFYSA-N 0 3 411.493 4.365 20 0 HIADHN CN(C)C[C@@H](NC(=O)Nc1ccc2c(c1)CCCC(=O)N2)c1ccc(Cl)cc1 ZINC000554905310 942313753 /nfs/dbraw/zinc/31/37/53/942313753.db2.gz PDLMGJOPTZYHDL-LJQANCHMSA-N 0 3 400.910 4.039 20 0 HIADHN Cc1ccc(Cl)cc1NC(=O)CN[C@H]1CCN(C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000554948751 942329910 /nfs/dbraw/zinc/32/99/10/942329910.db2.gz CEACFRXKUSBPHG-PXNSSMCTSA-N 0 3 410.320 4.414 20 0 HIADHN CSc1cccc(NC(=O)[C@H](C)N[C@H]2CCN(C)[C@H]2c2ccc(Cl)cc2)c1 ZINC000554950378 942330891 /nfs/dbraw/zinc/33/08/91/942330891.db2.gz YOAFWIFDLFFVRH-GKCIPKSASA-N 0 3 403.979 4.424 20 0 HIADHN CCOc1cc(CNCc2ccc3sccc3c2)ccc1O[C@@H](C)C(=O)N(C)C ZINC000554965670 942336248 /nfs/dbraw/zinc/33/62/48/942336248.db2.gz LZCAEDWTZCVUNQ-INIZCTEOSA-N 0 3 412.555 4.445 20 0 HIADHN CC(C)N1CC[C@@H](NCc2cn(C)nc2C(F)F)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000555004676 942351851 /nfs/dbraw/zinc/35/18/51/942351851.db2.gz QKFZVILWVMQCEG-AEFFLSMTSA-N 0 3 400.876 4.464 20 0 HIADHN COc1ccc(-c2ccc(C)c(NC(=O)N(CCN(C)C)Cc3ccccn3)c2)cn1 ZINC000555037919 942365820 /nfs/dbraw/zinc/36/58/20/942365820.db2.gz RVSFXWUJKRDGKG-UHFFFAOYSA-N 0 3 419.529 4.056 20 0 HIADHN CC(C)C(=O)Nc1ccc(CNC(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)cc1 ZINC000555076420 942378456 /nfs/dbraw/zinc/37/84/56/942378456.db2.gz KANVFMQVMOZEOV-FQEVSTJZSA-N 0 3 416.953 4.037 20 0 HIADHN CC(C)C(=O)Nc1ccc(CNC(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)cc1 ZINC000555076421 942378841 /nfs/dbraw/zinc/37/88/41/942378841.db2.gz KANVFMQVMOZEOV-HXUWFJFHSA-N 0 3 416.953 4.037 20 0 HIADHN O=C(c1cccc(CN2CCCC2)c1)N1CCCC[C@@H]1c1nnc(CC(F)(F)F)o1 ZINC000555106421 942387068 /nfs/dbraw/zinc/38/70/68/942387068.db2.gz UFXGUXNTDQUHFM-QGZVFWFLSA-N 0 3 422.451 4.138 20 0 HIADHN COc1cc(F)c([C@H](C)NC(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)cc1OC ZINC000555123588 942391176 /nfs/dbraw/zinc/39/11/76/942391176.db2.gz KXIBGADJCUWZRC-SCLBCKFNSA-N 0 3 423.916 4.159 20 0 HIADHN COc1cccc([C@H]2[C@@H](NCc3ccc(Oc4ccccc4)nn3)CCN2C2CC2)c1 ZINC000555128664 942394902 /nfs/dbraw/zinc/39/49/02/942394902.db2.gz KGKHFVXKGCYYCN-ZCYQVOJMSA-N 0 3 416.525 4.345 20 0 HIADHN COc1cc(C)c([C@H](C)NC(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)cc1OC ZINC000555132528 942397101 /nfs/dbraw/zinc/39/71/01/942397101.db2.gz VYKVQJBBXJPZNG-KXBFYZLASA-N 0 3 419.953 4.329 20 0 HIADHN COc1cccc([C@H]2[C@@H](NCC(=O)Nc3cc(Cl)ccc3C)CCN2C2CC2)c1 ZINC000555133535 942397409 /nfs/dbraw/zinc/39/74/09/942397409.db2.gz UJMIIZZRPYSOSV-REWPJTCUSA-N 0 3 413.949 4.163 20 0 HIADHN Cc1ncsc1CN(C)C[C@H]1CCN(c2noc3ccc(Br)cc32)C1 ZINC000555159451 942410711 /nfs/dbraw/zinc/41/07/11/942410711.db2.gz PPQVKUQNYPYLRF-CYBMUJFWSA-N 0 3 421.364 4.314 20 0 HIADHN COCCOc1ccc(CN[C@@H]2CCCCc3cc(Br)ccc32)cn1 ZINC000555163499 942412418 /nfs/dbraw/zinc/41/24/18/942412418.db2.gz KSFUNQFHPSOPON-LJQANCHMSA-N 0 3 405.336 4.427 20 0 HIADHN CC[C@@H](N[C@@H](CN(C)C)c1ccc(Cl)cc1)c1ccccc1OCC(=O)N(C)C ZINC000555226496 942437127 /nfs/dbraw/zinc/43/71/27/942437127.db2.gz SKJBHPBNECRSGV-RTWAWAEBSA-N 0 3 417.981 4.151 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@H](N[C@H](Cn2ccccc2=O)c2ccccc2)c2ccccc21 ZINC000555236106 942440448 /nfs/dbraw/zinc/44/04/48/942440448.db2.gz QWOFMHXBRYKINB-TZRRMPRUSA-N 0 3 416.521 4.361 20 0 HIADHN COc1cc2c(cc1F)CC[C@@H]2NC(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000555236341 942440648 /nfs/dbraw/zinc/44/06/48/942440648.db2.gz SKKXMOWVTNPZNQ-QFIPXVFZSA-N 0 3 411.521 4.128 20 0 HIADHN O=C(CN1CCN(C2CCCC2)CC1)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 ZINC000555422233 942525344 /nfs/dbraw/zinc/52/53/44/942525344.db2.gz OKHHZYDSPNBSJP-HXUWFJFHSA-N 0 3 410.389 4.217 20 0 HIADHN O=C(NCCN1CCCC1)c1ccc(NCc2ccc(-c3ccncc3)cc2F)cc1 ZINC000555507198 942610173 /nfs/dbraw/zinc/61/01/73/942610173.db2.gz VWGYRCVRGVAGPW-UHFFFAOYSA-N 0 3 418.516 4.325 20 0 HIADHN O=C(NCCN1CCCC1)c1ccc(NCc2cc(C(F)(F)F)ccc2F)cc1 ZINC000555507200 942611016 /nfs/dbraw/zinc/61/10/16/942611016.db2.gz VWQJVMXYPLPWRW-UHFFFAOYSA-N 0 3 409.427 4.282 20 0 HIADHN Cc1ccccc1Sc1ccc(C(=O)Nc2ccc(=O)n(CCN(C)C)c2)cc1 ZINC000555624592 942675275 /nfs/dbraw/zinc/67/52/75/942675275.db2.gz HBGVKWHACWUEDR-UHFFFAOYSA-N 0 3 407.539 4.122 20 0 HIADHN O=S(=O)(CCCNCc1ccc(Br)s1)c1ccc(Cl)cc1 ZINC000555643778 942684902 /nfs/dbraw/zinc/68/49/02/942684902.db2.gz DJESLIOJRJNEBW-UHFFFAOYSA-N 0 3 408.770 4.118 20 0 HIADHN CCN(C(=O)c1cc(Cc2ccccc2)n[nH]1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000555787889 942733276 /nfs/dbraw/zinc/73/32/76/942733276.db2.gz INNVSMMBHQWKTQ-AUSIDOKSSA-N 0 3 402.542 4.298 20 0 HIADHN NS(=O)(=O)c1ccc2c(c1)CCC[C@H]2NCc1ccc(OCc2ccccc2)cc1 ZINC000556060832 942799564 /nfs/dbraw/zinc/79/95/64/942799564.db2.gz MNWZIXKFHLKKPI-XMMPIXPASA-N 0 3 422.550 4.080 20 0 HIADHN CC[C@H](NCc1ccc(NC(=O)c2cccnc2)cc1)c1ccc(C(=O)OC)cc1 ZINC000556076283 942801979 /nfs/dbraw/zinc/80/19/79/942801979.db2.gz JQXSXZQNZILVDY-QFIPXVFZSA-N 0 3 403.482 4.361 20 0 HIADHN C[C@@H](N[C@H]1CCCc2cc(S(N)(=O)=O)ccc21)c1ccc(-c2ccncc2)cc1 ZINC000556079412 942802301 /nfs/dbraw/zinc/80/23/01/942802301.db2.gz MKKMDKNGFYBDEJ-MWTRTKDXSA-N 0 3 407.539 4.124 20 0 HIADHN CC(C)c1ccccc1NC(=O)[C@H](C)N[C@H]1CCN(C)[C@@H]1c1ccc(F)c(F)c1 ZINC000556126828 942807906 /nfs/dbraw/zinc/80/79/06/942807906.db2.gz WTVYYXRGGOEVCS-UZQPLGKSSA-N 0 3 401.501 4.450 20 0 HIADHN CS(=O)(=O)CC1CCC(NCc2nc3c(s2)C[C@@H](c2ccccc2)CC3)CC1 ZINC000556177693 942814593 /nfs/dbraw/zinc/81/45/93/942814593.db2.gz HFTLUBAICZYOPX-AVAKVYKDSA-N 0 3 418.628 4.109 20 0 HIADHN CN1CC[C@@H](NC(=O)C(C)(C)c2ccc(Br)cc2)[C@H]1c1ccccc1 ZINC000556187552 942815930 /nfs/dbraw/zinc/81/59/30/942815930.db2.gz GECAFKDBJBVVAB-RTBURBONSA-N 0 3 401.348 4.288 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)[C@@H](OC1CCOCC1)c1ccccc1 ZINC000556207806 942818995 /nfs/dbraw/zinc/81/89/95/942818995.db2.gz KQOSIHGVDQPNLS-OFVILXPXSA-N 0 3 422.569 4.046 20 0 HIADHN CCCN(CCN1CCCCCC1)C(=O)C(=O)Nc1ccc(-c2ccncc2)c(C)c1 ZINC000556251656 942826104 /nfs/dbraw/zinc/82/61/04/942826104.db2.gz CSKQXAXYEWQTOP-UHFFFAOYSA-N 0 3 422.573 4.110 20 0 HIADHN C[C@H](Cn1cc(Br)ccc1=O)N[C@@H]1CCCOc2cc(Cl)ccc21 ZINC000556264880 942828452 /nfs/dbraw/zinc/82/84/52/942828452.db2.gz WURSSSYGTBRLJZ-MLGOLLRUSA-N 0 3 411.727 4.156 20 0 HIADHN CCOc1cc(CN2CCCN(Cc3ccc(OC)cc3)CC2)cc(Cl)c1O ZINC000556276425 942831026 /nfs/dbraw/zinc/83/10/26/942831026.db2.gz XUHRYXRTJGGSKA-UHFFFAOYSA-N 0 3 404.938 4.161 20 0 HIADHN CC(C)N1CCN(CCCSc2nnc(-c3c[nH]c4ccccc34)n2C2CC2)CC1 ZINC000556325131 942841795 /nfs/dbraw/zinc/84/17/95/942841795.db2.gz WSTXVSPZNAKEPL-UHFFFAOYSA-N 0 3 424.618 4.270 20 0 HIADHN O=C1CCCN1[C@@H]1CCN(Cc2cn(-c3ccccc3)nc2-c2ccc(Cl)cc2)C1 ZINC000556379674 942852200 /nfs/dbraw/zinc/85/22/00/942852200.db2.gz OEXKTXABQOWIBK-JOCHJYFZSA-N 0 3 420.944 4.389 20 0 HIADHN O=C(Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)c1cc(F)cc2cccnc21 ZINC000556442984 942867654 /nfs/dbraw/zinc/86/76/54/942867654.db2.gz BRHLAANQWSIXRB-FQEVSTJZSA-N 0 3 415.472 4.270 20 0 HIADHN CN(C(=O)c1ccc(NCc2ccc3c(c2)COC(C)(C)O3)cc1)[C@H]1CCCN(C)C1 ZINC000556617339 942917125 /nfs/dbraw/zinc/91/71/25/942917125.db2.gz IRDLZCZGGJFWHB-QFIPXVFZSA-N 0 3 423.557 4.110 20 0 HIADHN COc1ccc(C(=O)CCC(=O)N(C)C[C@H]2CCN(Cc3ccc(C)s3)C2)cc1 ZINC000556827997 942936207 /nfs/dbraw/zinc/93/62/07/942936207.db2.gz AAIDDISJUDTOSA-GOSISDBHSA-N 0 3 414.571 4.009 20 0 HIADHN O=C(C[C@@H](c1cccs1)n1cccc1)N1CCN(c2ccnc3ccccc32)CC1 ZINC000556833437 942937584 /nfs/dbraw/zinc/93/75/84/942937584.db2.gz MGUKDFFGWZAGSG-QFIPXVFZSA-N 0 3 416.550 4.426 20 0 HIADHN CC[C@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)c1ccc(OC(F)(F)F)cc1 ZINC000556868663 942944805 /nfs/dbraw/zinc/94/48/05/942944805.db2.gz VXUCGBQPQHWAOQ-ICSRJNTNSA-N 0 3 419.447 4.465 20 0 HIADHN C[C@@H](NCc1cc2cc(Br)ccc2[nH]1)c1ccc2c(c1)OCC(=O)N2 ZINC000556889830 942953399 /nfs/dbraw/zinc/95/33/99/942953399.db2.gz GVRMQCPTYBLVPO-LLVKDONJSA-N 0 3 400.276 4.112 20 0 HIADHN O[C@@H](CN[C@@H]1CCSc2ccc(F)cc21)COc1cccc(Br)c1 ZINC000557013960 942993828 /nfs/dbraw/zinc/99/38/28/942993828.db2.gz LXSQQGDUWFMXHW-WMLDXEAASA-N 0 3 412.324 4.155 20 0 HIADHN O[C@H](CN[C@@H]1CCSc2ccc(F)cc21)COc1ccc(Br)cc1 ZINC000557014775 942994965 /nfs/dbraw/zinc/99/49/65/942994965.db2.gz XBOYVKOYDMCKAF-RHSMWYFYSA-N 0 3 412.324 4.155 20 0 HIADHN O=C(CCC(=O)N1CC[C@@]2(CCN(Cc3ccccc3)C2)C1)c1ccc2c(c1)CCC2 ZINC000557115801 943023661 /nfs/dbraw/zinc/02/36/61/943023661.db2.gz BYCZQTGZHNVJPK-HHHXNRCGSA-N 0 3 416.565 4.263 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)CCCc2ncc(-c3ccccc3)o2)cc1 ZINC000557202672 943049195 /nfs/dbraw/zinc/04/91/95/943049195.db2.gz AQTJZDOPJUCLEH-NRFANRHFSA-N 0 3 407.514 4.092 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)N[C@@H](c1ccccc1)[C@H]1CCOC1 ZINC000557228335 943056659 /nfs/dbraw/zinc/05/66/59/943056659.db2.gz RHRQFHXTCOCICR-UNMCSNQZSA-N 0 3 415.965 4.191 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)c1c(C)nn(CC(F)F)c1C)c1ccc(Cl)cc1 ZINC000557340933 943078437 /nfs/dbraw/zinc/07/84/37/943078437.db2.gz HMDLNBBNXWVRRW-KRWDZBQOSA-N 0 3 412.912 4.231 20 0 HIADHN Cc1onc(-c2ccccc2Cl)c1C(=O)Nc1cccc(CN2CC[C@H](O)C2)c1 ZINC000557399911 943103320 /nfs/dbraw/zinc/10/33/20/943103320.db2.gz ZDQGMYONUZXPCU-KRWDZBQOSA-N 0 3 411.889 4.122 20 0 HIADHN COc1ccc([C@H](Cc2ccc(F)cc2)N[C@H](C)C(=O)NCc2ccccc2)cc1 ZINC000557513041 943180327 /nfs/dbraw/zinc/18/03/27/943180327.db2.gz XSTFBNKAORMRJE-KOSHJBKYSA-N 0 3 406.501 4.413 20 0 HIADHN CC(=O)c1cccc(OC[C@H](O)CNC2(c3cccc(C(F)(F)F)c3)CCC2)c1 ZINC000557547493 943202580 /nfs/dbraw/zinc/20/25/80/943202580.db2.gz PBDYVHIEYPZPHL-LJQANCHMSA-N 0 3 407.432 4.317 20 0 HIADHN O=C(CCc1cc2ccccc2o1)N1CCC[C@H](c2n[nH]cc2CN2CCCC2)C1 ZINC000557643317 943245262 /nfs/dbraw/zinc/24/52/62/943245262.db2.gz GINFIDFMACIOMO-IBGZPJMESA-N 0 3 406.530 4.091 20 0 HIADHN CC[C@H](NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1)c1ccc(OC)c(OC)c1 ZINC000557800959 943295549 /nfs/dbraw/zinc/29/55/49/943295549.db2.gz CTTDHFDPUFFBME-RTWAWAEBSA-N 0 3 411.546 4.119 20 0 HIADHN Cc1cc(C)n(CCN(CCO)Cc2cccc(OCc3ccccc3Cl)c2)n1 ZINC000557885572 943320551 /nfs/dbraw/zinc/32/05/51/943320551.db2.gz CQNFJUMLNMOOME-UHFFFAOYSA-N 0 3 413.949 4.227 20 0 HIADHN Cc1c2ccc(F)cc2sc1C(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000557906626 943325984 /nfs/dbraw/zinc/32/59/84/943325984.db2.gz VOTYWENXCAHPET-IBGZPJMESA-N 0 3 412.530 4.370 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)c1cnn(-c2ccc(Cl)cc2)c1C)c1ccco1 ZINC000557912671 943327660 /nfs/dbraw/zinc/32/76/60/943327660.db2.gz WYHJGRRHYDEQLG-LIRRHRJNSA-N 0 3 400.910 4.286 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)Cc2csc(-c3ccoc3)n2)N(C)C)cc1 ZINC000557935556 943333830 /nfs/dbraw/zinc/33/38/30/943333830.db2.gz SQGJKPPSKUBVRO-HXUWFJFHSA-N 0 3 413.543 4.152 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)c2cnc(-c3cccnc3)s2)N(C)C)cc1 ZINC000557937504 943334687 /nfs/dbraw/zinc/33/46/87/943334687.db2.gz NGHIGGACCYBXKR-IBGZPJMESA-N 0 3 410.543 4.025 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c2sc(C(=O)N3CC[C@@H](N4CCCC4)[C@@H]3C)cc12 ZINC000558017052 943356435 /nfs/dbraw/zinc/35/64/35/943356435.db2.gz XHIPVTOYHXBQGG-HNAYVOBHSA-N 0 3 412.534 4.233 20 0 HIADHN OCC[C@H](NCc1ccc(I)cc1)c1ccc(Cl)cc1 ZINC000558147119 943396643 /nfs/dbraw/zinc/39/66/43/943396643.db2.gz SZLNSTWLPHQGBJ-INIZCTEOSA-N 0 3 401.675 4.158 20 0 HIADHN CCc1c(NC(=O)N[C@H]2CCN(Cc3ccccc3)[C@H]2C)cnn1-c1ccccc1 ZINC000558210599 943434650 /nfs/dbraw/zinc/43/46/50/943434650.db2.gz NQFJNJKGPQMGSC-RXVVDRJESA-N 0 3 403.530 4.219 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)Nc1ccc(C(=O)NC2CCCC2)cc1C ZINC000558310994 943498532 /nfs/dbraw/zinc/49/85/32/943498532.db2.gz ITAUMOXYLROXMB-UHFFFAOYSA-N 0 3 414.594 4.397 20 0 HIADHN COc1ccc([C@@H](Cc2ccccc2)NCC(=O)N2CCC[C@@H](C(F)(F)F)C2)cc1 ZINC000558487499 943572688 /nfs/dbraw/zinc/57/26/88/943572688.db2.gz BFYZIPLPYYEYMF-TZIWHRDSSA-N 0 3 420.475 4.370 20 0 HIADHN Brc1cc(CN[C@@H]2c3ccccc3CC23CCOCC3)cc2c1OCO2 ZINC000558486946 943572977 /nfs/dbraw/zinc/57/29/77/943572977.db2.gz GNKYSFXTCCXBSK-HXUWFJFHSA-N 0 3 416.315 4.362 20 0 HIADHN COc1cc(C)c(CNCc2cccc(-c3nc(CC(F)(F)F)no3)c2)c(C)n1 ZINC000558487711 943573069 /nfs/dbraw/zinc/57/30/69/943573069.db2.gz GLDPMCBFJILJFX-UHFFFAOYSA-N 0 3 406.408 4.152 20 0 HIADHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)Nc1nc(Sc2ccc(C)cc2)ns1 ZINC000558499635 943577242 /nfs/dbraw/zinc/57/72/42/943577242.db2.gz DIRDIZCTHBKQDG-CABCVRRESA-N 0 3 403.577 4.088 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(F)cc2)CC1)[C@@H]1C[C@H]1c1ccccc1Cl ZINC000558503898 943578335 /nfs/dbraw/zinc/57/83/35/943578335.db2.gz HAYGUPXPUSRKRH-LEWJYISDSA-N 0 3 416.924 4.242 20 0 HIADHN Cc1cc(NC(=O)c2cn(C)c3ccccc23)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000558531411 943590211 /nfs/dbraw/zinc/59/02/11/943590211.db2.gz CHNJQBZNRPOWLK-HXUWFJFHSA-N 0 3 413.525 4.383 20 0 HIADHN Cc1ccc(Cc2ccccn2)cc1NC(=O)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000558738387 943635812 /nfs/dbraw/zinc/63/58/12/943635812.db2.gz PQEXVXNNYCOWII-JOCHJYFZSA-N 0 3 400.526 4.227 20 0 HIADHN Cc1ccc(Cc2ccccn2)cc1NC(=O)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000558738388 943636218 /nfs/dbraw/zinc/63/62/18/943636218.db2.gz PQEXVXNNYCOWII-QFIPXVFZSA-N 0 3 400.526 4.227 20 0 HIADHN CC(C)n1ncc2cc(NC(=O)N[C@@H](CN(C)C)c3ccc(Cl)cc3)cnc21 ZINC000558756140 943647638 /nfs/dbraw/zinc/64/76/38/943647638.db2.gz WDJRRZDWOQDPOM-SFHVURJKSA-N 0 3 400.914 4.090 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)Nc1ccc2nnc(C3CCC3)n2c1 ZINC000558795496 943666139 /nfs/dbraw/zinc/66/61/39/943666139.db2.gz BSTASTPOTLIUHB-KRWDZBQOSA-N 0 3 410.547 4.017 20 0 HIADHN CCn1c(-c2ncccc2C)nnc1N1CCN(Cc2cccc3ccccc32)CC1 ZINC000558829727 943683661 /nfs/dbraw/zinc/68/36/61/943683661.db2.gz ZUWURNCAQBKKRM-UHFFFAOYSA-N 0 3 412.541 4.144 20 0 HIADHN Cc1ccc(Cc2ccccn2)cc1NC(=O)NC[C@H](Cc1ccccc1)N(C)C ZINC000558855030 943702306 /nfs/dbraw/zinc/70/23/06/943702306.db2.gz UBCKEOSYBZLOBP-QHCPKHFHSA-N 0 3 402.542 4.275 20 0 HIADHN C[C@H](NC(=O)N[C@H](CN(C)C)c1ccc(Cl)cc1)c1ccc(-n2cccn2)cc1 ZINC000558887813 943720230 /nfs/dbraw/zinc/72/02/30/943720230.db2.gz JVGJLLGRYHYYMO-HRAATJIYSA-N 0 3 411.937 4.189 20 0 HIADHN CCN1CC[C@H](NCC(=O)N[C@H](C)c2ccccc2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000558891553 943724849 /nfs/dbraw/zinc/72/48/49/943724849.db2.gz HFVYZTXXCUPGDE-UPKQVVFYSA-N 0 3 403.929 4.081 20 0 HIADHN CCc1ccccc1NC(=O)CN[C@@H]1CCN(CC)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000558897137 943731337 /nfs/dbraw/zinc/73/13/37/943731337.db2.gz PFZFXMSDRSUFKJ-IFMALSPDSA-N 0 3 403.929 4.405 20 0 HIADHN CC(C)c1noc(Cc2ccc(NC(=O)[C@H]3CCCN(Cc4cccnc4)C3)cc2)n1 ZINC000558907441 943740111 /nfs/dbraw/zinc/74/01/11/943740111.db2.gz QCFBHGQFVGNATL-FQEVSTJZSA-N 0 3 419.529 4.030 20 0 HIADHN CN(C)C[C@H](NC(=O)c1cccc(COC2CCOCC2)c1)c1ccc(Cl)cc1 ZINC000558970215 943776226 /nfs/dbraw/zinc/77/62/26/943776226.db2.gz DDTFLOOKTYTRKQ-QFIPXVFZSA-N 0 3 416.949 4.068 20 0 HIADHN Cc1cc(C(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)c(C)n1-c1nccs1 ZINC000558970726 943776366 /nfs/dbraw/zinc/77/63/66/943776366.db2.gz HAMZJDLIVDSKTN-GOSISDBHSA-N 0 3 402.951 4.237 20 0 HIADHN O=C(Nc1ccccc1)Nc1cccc2c1CCN(C[C@H](O)Cc1ccc(F)cc1)C2 ZINC000559095320 943836640 /nfs/dbraw/zinc/83/66/40/943836640.db2.gz YDMRABKNSUCQCV-JOCHJYFZSA-N 0 3 419.500 4.431 20 0 HIADHN C[C@H](c1ccc(F)cc1)N1CC[C@@H](N[C@@H](C)c2ccc(NC(=O)NC3CC3)cc2)C1=O ZINC000559148532 943853952 /nfs/dbraw/zinc/85/39/52/943853952.db2.gz ZYJHIMPMKBFJTI-WJONJSRFSA-N 0 3 424.520 4.122 20 0 HIADHN Cc1ccsc1-c1nnc(N2CCN(CC(C)C)CC2)n1Cc1cccs1 ZINC000559161959 943857050 /nfs/dbraw/zinc/85/70/50/943857050.db2.gz AKNHIEFGLPFNGU-UHFFFAOYSA-N 0 3 401.605 4.203 20 0 HIADHN COC1(CCN(C)Cc2cccc(Br)c2OC[C@H]2CCCO2)CCC1 ZINC000559187928 943865860 /nfs/dbraw/zinc/86/58/60/943865860.db2.gz QBXZYIMUYLXENH-QGZVFWFLSA-N 0 3 412.368 4.398 20 0 HIADHN C[C@H](NCc1nc2cc(Br)ccc2o1)C1CCN(CC(F)(F)F)CC1 ZINC000559231801 943881695 /nfs/dbraw/zinc/88/16/95/943881695.db2.gz ASKSJVGBJMUAHG-NSHDSACASA-N 0 3 420.273 4.343 20 0 HIADHN C[C@@H](c1ccccc1F)N1CCC[C@@H](NCc2ccc(OCC(F)F)cc2)C1=O ZINC000559323624 943896740 /nfs/dbraw/zinc/89/67/40/943896740.db2.gz ZDBFTRSNYXZXGK-MGPUTAFESA-N 0 3 406.448 4.311 20 0 HIADHN CC(C)[C@@H](CCc1ccccc1)C(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000559449973 943959667 /nfs/dbraw/zinc/95/96/67/943959667.db2.gz LEJIRHOMPYAXHM-ZFGGDYGUSA-N 0 3 400.607 4.239 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)NCc2ccc(OC3CCCC3)cc2)CC1 ZINC000559625127 944019561 /nfs/dbraw/zinc/01/95/61/944019561.db2.gz JYSBVQKPZGDRHA-UHFFFAOYSA-N 0 3 411.546 4.407 20 0 HIADHN O=C1CCCN1Cc1cccc(CN[C@@H]2CCc3sc(Br)cc32)c1 ZINC000559741392 944042416 /nfs/dbraw/zinc/04/24/16/944042416.db2.gz LMFJGHBQNHMAOW-MRXNPFEDSA-N 0 3 405.361 4.410 20 0 HIADHN CN1CC[C@H](NCc2cn3cc(Cl)cc(Cl)c3n2)[C@H]1c1ccc(F)c(F)c1 ZINC000559793638 944051951 /nfs/dbraw/zinc/05/19/51/944051951.db2.gz OITHOEDMLNTDAQ-ZWKOTPCHSA-N 0 3 411.283 4.454 20 0 HIADHN COCCOc1ccc([C@H](C)N[C@H]2CCCN([C@H](C)c3ccccc3F)C2=O)cc1 ZINC000559878869 944072885 /nfs/dbraw/zinc/07/28/85/944072885.db2.gz OKLXKHIXBOREBR-IXFSTUDKSA-N 0 3 414.521 4.254 20 0 HIADHN C[C@H](c1ccccc1F)N1CCC[C@H](N[C@@H](C)c2ccc(-n3ccnc3)cc2)C1=O ZINC000559878523 944073183 /nfs/dbraw/zinc/07/31/83/944073183.db2.gz PIGUNDXDZYGYJF-IXFSTUDKSA-N 0 3 406.505 4.414 20 0 HIADHN COc1ccc2c(c1)[C@@H](NCCCS(=O)(=O)c1ccc(Cl)cc1)CCS2 ZINC000559920035 944085504 /nfs/dbraw/zinc/08/55/04/944085504.db2.gz VRIGSFVQAQLSRN-SFHVURJKSA-N 0 3 411.976 4.339 20 0 HIADHN COc1ccc2nc(CNc3ccc(C(=O)N(C)[C@@H]4CCCN(C)C4)cc3)sc2c1 ZINC000559996427 944118415 /nfs/dbraw/zinc/11/84/15/944118415.db2.gz HDWXZEQCHKBAHO-GOSISDBHSA-N 0 3 424.570 4.083 20 0 HIADHN CN(C(=O)c1ccc(NCc2ccccc2OC(F)(F)F)cc1)[C@H]1CCCN(C)C1 ZINC000559998160 944121398 /nfs/dbraw/zinc/12/13/98/944121398.db2.gz NQRCYIFOMIIWNE-IBGZPJMESA-N 0 3 421.463 4.364 20 0 HIADHN COc1ccc(C[C@@H](C)CN(C)CC(=O)N[C@@H](c2nccs2)c2ccccc2)cc1 ZINC000560112605 944163844 /nfs/dbraw/zinc/16/38/44/944163844.db2.gz QMEGRMWYPSYCEY-WZONZLPQSA-N 0 3 423.582 4.168 20 0 HIADHN Cc1ccccc1CNC(=O)CN[C@H](c1cccc(C(F)(F)F)c1)C1CCOCC1 ZINC000560205804 944195657 /nfs/dbraw/zinc/19/56/57/944195657.db2.gz JARWDNVWYYAVJO-QFIPXVFZSA-N 0 3 420.475 4.388 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)c2ccc(Br)cc2Cl)cc1 ZINC000560246598 944206177 /nfs/dbraw/zinc/20/61/77/944206177.db2.gz FSBCHAAWHNPSTF-KRWDZBQOSA-N 0 3 411.727 4.144 20 0 HIADHN CC[C@H](N[C@H]1CCCN(Cc2ccccn2)C1=O)c1ccc(OC(F)(F)F)cc1 ZINC000560549802 944250307 /nfs/dbraw/zinc/25/03/07/944250307.db2.gz ZECZOVVDFOPAAL-OALUTQOASA-N 0 3 407.436 4.212 20 0 HIADHN C[C@H](N[C@@H](CCO)c1ccc(Cl)c(Cl)c1)c1ccc(NS(C)(=O)=O)cc1 ZINC000560584276 944263787 /nfs/dbraw/zinc/26/37/87/944263787.db2.gz ABHSVFUTUOIFNB-SGTLLEGYSA-N 0 3 417.358 4.139 20 0 HIADHN O=C([C@H]1CCCN1Cc1ccccc1)N1CCC(Cc2nc3ccccc3[nH]2)CC1 ZINC000560599742 944269608 /nfs/dbraw/zinc/26/96/08/944269608.db2.gz AWNKKESYUOOVPL-HSZRJFAPSA-N 0 3 402.542 4.009 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)c2cscc2Br)cc1 ZINC000560608258 944272401 /nfs/dbraw/zinc/27/24/01/944272401.db2.gz YHFKFYWUEWUISS-QGZVFWFLSA-N 0 3 409.349 4.086 20 0 HIADHN O=C(CCNCc1cnc([C@H]2CCCO2)s1)Nc1cc(Cl)cc(Cl)c1 ZINC000560612150 944274793 /nfs/dbraw/zinc/27/47/93/944274793.db2.gz SINFIUXXQWHMIV-OAHLLOKOSA-N 0 3 400.331 4.420 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3nc(C4CC4)oc3C)c(OCC)c2)CC1 ZINC000560662263 944286115 /nfs/dbraw/zinc/28/61/15/944286115.db2.gz RXKHUCQBBVEDSS-UHFFFAOYSA-N 0 3 412.534 4.043 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)c1cc2ccccc2c(=O)n1C)c1ccc(Cl)cc1 ZINC000560710829 944304698 /nfs/dbraw/zinc/30/46/98/944304698.db2.gz XANAWJPBOYPHEO-NRFANRHFSA-N 0 3 411.933 4.005 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)c1ccc(N(C)C(C)=O)cc1)c1ccc(Cl)cc1 ZINC000560712585 944305683 /nfs/dbraw/zinc/30/56/83/944305683.db2.gz XCKNEHMQWSIMKA-NRFANRHFSA-N 0 3 401.938 4.136 20 0 HIADHN CC(=O)c1cccc(OCc2cc(C(=O)Nc3cc(CN(C)C)ccc3C)no2)c1 ZINC000560749580 944319173 /nfs/dbraw/zinc/31/91/73/944319173.db2.gz BMWPIJJOTPIAIG-UHFFFAOYSA-N 0 3 407.470 4.079 20 0 HIADHN CCOc1ccc(C(=O)CCC(=O)N2CC[C@]3(CCN(Cc4ccccc4)C3)C2)cc1 ZINC000560758604 944322213 /nfs/dbraw/zinc/32/22/13/944322213.db2.gz LYCPGZUVAWQXGZ-SANMLTNESA-N 0 3 420.553 4.173 20 0 HIADHN COCCN(CCN(C)C)C(=O)c1oc2ccccc2c1CSc1cccs1 ZINC000560768688 944325541 /nfs/dbraw/zinc/32/55/41/944325541.db2.gz PCUKGDQTRIYXDY-UHFFFAOYSA-N 0 3 418.584 4.437 20 0 HIADHN COc1ccc(C[C@@H](NCC(=O)N(C)Cc2cccs2)c2ccc(OC)cc2)cc1 ZINC000560839437 944352891 /nfs/dbraw/zinc/35/28/91/944352891.db2.gz CFNQIXFKHKUSRZ-HSZRJFAPSA-N 0 3 424.566 4.297 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)c1cnn(C2CCOCC2)c1C)c1ccc(Cl)cc1 ZINC000560973112 944381861 /nfs/dbraw/zinc/38/18/61/944381861.db2.gz AVXPIUUWCKAXEO-NRFANRHFSA-N 0 3 418.969 4.009 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)N[C@@H]1CCC[C@H](C)[C@@H]1C)c1ccc(NC(=O)c2ccncc2)cc1 ZINC000561157401 944486459 /nfs/dbraw/zinc/48/64/59/944486459.db2.gz NSXPPDBCIGIJSI-XYLMYFKBSA-N 0 3 422.573 4.314 20 0 HIADHN C[C@H]1CCCN(C(=O)CN(C)CCCCCc2cc(-c3cccc(F)c3)n[nH]2)C1 ZINC000561170664 944495775 /nfs/dbraw/zinc/49/57/75/944495775.db2.gz MTKIBSAHMQEFAW-SFHVURJKSA-N 0 3 400.542 4.119 20 0 HIADHN O=C(CCN[C@@H]1CCSc2ccc(F)cc21)Nc1ccc(N2CCCC2=O)cc1 ZINC000561197392 944509655 /nfs/dbraw/zinc/50/96/55/944509655.db2.gz WPGFLTJYZUGDNE-LJQANCHMSA-N 0 3 413.518 4.108 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)C[C@@H](c2ncc[nH]2)c2ccccc2)N2CCCC2)cc1 ZINC000561206887 944514791 /nfs/dbraw/zinc/51/47/91/944514791.db2.gz YMTYIHKHFYXQOU-DHIUTWEWSA-N 0 3 402.542 4.193 20 0 HIADHN O=C(c1cc(F)ccc1-c1ccoc1)N1CCC[C@@H](c2n[nH]cc2CN2CCCC2)C1 ZINC000561285290 944540447 /nfs/dbraw/zinc/54/04/47/944540447.db2.gz GBHHTXQSYYQAHD-QGZVFWFLSA-N 0 3 422.504 4.424 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2ccccc2N2C[C@H](C)O[C@@H](C)C2)N(C)C)cc1 ZINC000561355765 944561743 /nfs/dbraw/zinc/56/17/43/944561743.db2.gz KLTABFPQMQARRK-YDHSSHFGSA-N 0 3 410.562 4.033 20 0 HIADHN C[C@H](N[C@H](c1ccc2c(c1)OCCO2)C1CC1)C(=O)Nc1cc(Cl)ccc1F ZINC000561402652 944580879 /nfs/dbraw/zinc/58/08/79/944580879.db2.gz RSYKWYRKPMGKOI-YUNKPMOVSA-N 0 3 404.869 4.318 20 0 HIADHN C[C@H]1CN(C(=O)c2ccc(Sc3ccccc3Cl)nn2)CCN(C2CCC2)C1 ZINC000561533052 944658594 /nfs/dbraw/zinc/65/85/94/944658594.db2.gz BGKPUVVBIYLNFP-OAHLLOKOSA-N 0 3 416.978 4.228 20 0 HIADHN CCc1cc(C(=O)N2CCN(CCCc3ccccc3)C[C@@H]2CC(C)C)cc(=O)[nH]1 ZINC000561545890 944666789 /nfs/dbraw/zinc/66/67/89/944666789.db2.gz IOYFQQFPZSXTAN-QHCPKHFHSA-N 0 3 409.574 4.155 20 0 HIADHN COc1cc(CN(Cc2ccccc2)[C@H](C)CN2CCOCC2)ccc1SC ZINC000561585338 944690029 /nfs/dbraw/zinc/69/00/29/944690029.db2.gz PJRACDGRVTXOCP-LJQANCHMSA-N 0 3 400.588 4.140 20 0 HIADHN CCOc1cc(CNCc2ccc(Cn3ccnc3)cc2)cc(Br)c1O ZINC000561593572 944694128 /nfs/dbraw/zinc/69/41/28/944694128.db2.gz SQSMIIKDLGROQH-UHFFFAOYSA-N 0 3 416.319 4.088 20 0 HIADHN CC(=O)Nc1cc(C(=O)N[C@@H]2CCN(Cc3ccccc3)[C@@H]2C)cc(C(F)(F)F)c1 ZINC000561624119 944713695 /nfs/dbraw/zinc/71/36/95/944713695.db2.gz LHADDBNBNNMOKE-JLTOFOAXSA-N 0 3 419.447 4.057 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)NC[C@H](C)c1c(C)noc1C)c1ccc(Cl)cc1 ZINC000561633828 944719312 /nfs/dbraw/zinc/71/93/12/944719312.db2.gz SWRAXAFSVVQJFB-LIRRHRJNSA-N 0 3 406.958 4.431 20 0 HIADHN CCO[C@H](C)c1ncc(C(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)s1 ZINC000561651582 944728673 /nfs/dbraw/zinc/72/86/73/944728673.db2.gz KTPDCBRRQQNDFF-QAPCUYQASA-N 0 3 405.564 4.061 20 0 HIADHN COc1cc(Cl)c(C(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)cc1OC ZINC000561657381 944733111 /nfs/dbraw/zinc/73/31/11/944733111.db2.gz MATZLLHHAKTHQV-LJQANCHMSA-N 0 3 420.937 4.177 20 0 HIADHN O=C([C@H](C1CC1)N1CCCC1)N1CCc2nc(-c3ccccc3Cl)sc2C1 ZINC000561664716 944736318 /nfs/dbraw/zinc/73/63/18/944736318.db2.gz PNMXMCNZKBDTGO-IBGZPJMESA-N 0 3 401.963 4.223 20 0 HIADHN CC(C)Cc1ccc([C@H](CNC(=O)c2ccc(C(F)(F)F)[nH]c2=O)N(C)C)cc1 ZINC000561711006 944757832 /nfs/dbraw/zinc/75/78/32/944757832.db2.gz YULADMZCGONZQS-KRWDZBQOSA-N 0 3 409.452 4.037 20 0 HIADHN C[C@H]1C[C@H]1N1CCN(C(=O)C(C)(C)c2csc(-c3ccccc3F)n2)C[C@@H](C)C1 ZINC000561761023 944783957 /nfs/dbraw/zinc/78/39/57/944783957.db2.gz KEUXCWMFVAVXEB-TXPKVOOTSA-N 0 3 415.578 4.416 20 0 HIADHN CC(C)CC(=O)Nc1ccc(Cl)c(C(=O)N2CCN([C@@H]3C[C@@H]3C)C[C@H](C)C2)c1 ZINC000561762571 944785526 /nfs/dbraw/zinc/78/55/26/944785526.db2.gz VOJXBPNSYOSEOU-TWOQFEAHSA-N 0 3 405.970 4.127 20 0 HIADHN C[C@@H]1C[C@H]1N1CCN(C(=O)c2cccnc2SCc2ccc(F)cc2)C[C@@H](C)C1 ZINC000561764412 944787076 /nfs/dbraw/zinc/78/70/76/944787076.db2.gz JYONWIDUBSJYNV-CSODHUTKSA-N 0 3 413.562 4.315 20 0 HIADHN Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)N[C@@H]1CCN(Cc2ccccc2)[C@H]1C ZINC000561798793 944801024 /nfs/dbraw/zinc/80/10/24/944801024.db2.gz HGGCIDZAJQRIKB-WMZHIEFXSA-N 0 3 420.557 4.016 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)N[C@@H]2CCN(Cc3ccccc3)[C@@H]2C)c(Cl)c1 ZINC000561800389 944802427 /nfs/dbraw/zinc/80/24/27/944802427.db2.gz TYGZASOALMUKAW-AUUYWEPGSA-N 0 3 400.910 4.083 20 0 HIADHN COc1cc(Cl)c(NC(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)cc1C ZINC000561817050 944809649 /nfs/dbraw/zinc/80/96/49/944809649.db2.gz ONKOTFVVCJIPEM-CALCHBBNSA-N 0 3 423.985 4.400 20 0 HIADHN CCCN(C)[C@H](CNC(=O)N1CCC(OCC2CC2)CC1)c1ccc(Cl)cc1 ZINC000561870330 944829059 /nfs/dbraw/zinc/82/90/59/944829059.db2.gz GVRZVSPGSANVPD-OAQYLSRUSA-N 0 3 407.986 4.324 20 0 HIADHN C[C@@H](NC(=O)NC[C@H](c1ccccc1)N1CCCC1)c1nccn1-c1ccccc1 ZINC000561995825 944889219 /nfs/dbraw/zinc/88/92/19/944889219.db2.gz PQPPKFXXBYTIFL-DENIHFKCSA-N 0 3 403.530 4.070 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)[C@H](C)N[C@@H]1CCN(C)[C@@H]1c1ccc(Cl)cc1 ZINC000562050196 944912548 /nfs/dbraw/zinc/91/25/48/944912548.db2.gz NYGPHXJBFDIJCY-WSXQUGQNSA-N 0 3 422.356 4.364 20 0 HIADHN COC[C@@H](NC1CCN(C(=O)NC2CCCCC2)CC1)c1cccc(Cl)c1F ZINC000562060240 944916551 /nfs/dbraw/zinc/91/65/51/944916551.db2.gz WGXBUHYQDSKEPT-LJQANCHMSA-N 0 3 411.949 4.263 20 0 HIADHN CC(=O)Nc1ccc(F)c(NC(=O)NC[C@H](c2ccc(CC(C)C)cc2)N(C)C)c1 ZINC000562106989 944943492 /nfs/dbraw/zinc/94/34/92/944943492.db2.gz LRFZBTXPBSSQDX-JOCHJYFZSA-N 0 3 414.525 4.407 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)Nc1ccc(C(=O)NC(C)(C)CC)cc1 ZINC000562116376 944949936 /nfs/dbraw/zinc/94/99/36/944949936.db2.gz UMEOZPKJVNHBEA-UHFFFAOYSA-N 0 3 402.583 4.335 20 0 HIADHN Cc1ccc(NC(=O)N[C@H](CN(C)C)c2ccc(F)cc2)c(OC[C@@H]2CCCO2)c1 ZINC000562155414 944983054 /nfs/dbraw/zinc/98/30/54/944983054.db2.gz BFEBTNRLFQTFIH-PZJWPPBQSA-N 0 3 415.509 4.116 20 0 HIADHN Cc1nnc([C@H]2CCCN(Cc3csc(-c4ccc(Br)cc4)n3)C2)[nH]1 ZINC000562158735 944987334 /nfs/dbraw/zinc/98/73/34/944987334.db2.gz DBTAJDUFEGFSPY-AWEZNQCLSA-N 0 3 418.364 4.379 20 0 HIADHN C[C@H](NC(=O)Nc1cc(F)ccc1OC[C@H]1CCCO1)[C@H](c1ccccc1)N(C)C ZINC000562161877 944988234 /nfs/dbraw/zinc/98/82/34/944988234.db2.gz GEYZDGZZSRFOQE-DKZVUGQWSA-N 0 3 415.509 4.196 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)Nc2ccc(-c3cc[nH]n3)cc2)N(C)C)cc1 ZINC000562170694 945000305 /nfs/dbraw/zinc/00/03/05/945000305.db2.gz OBSAQCXOEUHCQT-QFIPXVFZSA-N 0 3 407.518 4.288 20 0 HIADHN CC(C)[C@H](NC1CCC2(CC1)c1ccccc1NC2=O)c1nc(-c2ccncc2)no1 ZINC000562315994 945058904 /nfs/dbraw/zinc/05/89/04/945058904.db2.gz JBSCGBJOOBFWFU-QOALBKQRSA-N 0 3 417.513 4.251 20 0 HIADHN CC[C@H](C)n1ncc(C(=O)NC[C@H](c2ccc(SC)cc2)N(C)C)c1C1CC1 ZINC000564092500 945375254 /nfs/dbraw/zinc/37/52/54/945375254.db2.gz FXKMUDFZELMIJX-MGPUTAFESA-N 0 3 400.592 4.486 20 0 HIADHN O=C(NC[C@H]1CCCN1Cc1ccccc1)Nc1ccc(OC[C@@H]2CCCO2)cc1 ZINC000564118595 945387811 /nfs/dbraw/zinc/38/78/11/945387811.db2.gz ZZVSRKINRMUIMS-GGAORHGYSA-N 0 3 409.530 4.031 20 0 HIADHN COc1ccc2c(c1F)CC[C@H]2NC[C@@H](O)COc1cccc(Cl)c1Cl ZINC000564144474 945398142 /nfs/dbraw/zinc/39/81/42/945398142.db2.gz RZZTWGVYGNVZJY-IAQYHMDHSA-N 0 3 400.277 4.158 20 0 HIADHN COc1cc(Br)c(CN[C@H]2CCN(C)[C@@H]2c2ccccc2)cc1OC ZINC000564256045 945474556 /nfs/dbraw/zinc/47/45/56/945474556.db2.gz MHJYVVUVCSDZPZ-FXAWDEMLSA-N 0 3 405.336 4.001 20 0 HIADHN CC[C@H](NC(=O)c1ccccc1)c1noc(C2CCN(Cc3ccccc3)CC2)n1 ZINC000564287093 945499228 /nfs/dbraw/zinc/49/92/28/945499228.db2.gz ZPRVRBMDODQIFR-NRFANRHFSA-N 0 3 404.514 4.330 20 0 HIADHN COc1ccc([C@H](NCCCc2cnccc2C)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000564299793 945505861 /nfs/dbraw/zinc/50/58/61/945505861.db2.gz XUOXDCXHGTWMOC-DEOSSOPVSA-N 0 3 424.566 4.114 20 0 HIADHN C[C@@H](c1cccc(N2CCCS2(=O)=O)c1)N(C)C/C=C\c1ccc(F)c(F)c1 ZINC000564302878 945506107 /nfs/dbraw/zinc/50/61/07/945506107.db2.gz VUVQKUIDKVXCNZ-LEXSJLIMSA-N 0 3 406.498 4.211 20 0 HIADHN Cn1cc(C(F)(F)F)nc1[C@@H]1CCCN(Cc2cnn(-c3ccc(F)cc3)c2)C1 ZINC000564303195 945507761 /nfs/dbraw/zinc/50/77/61/945507761.db2.gz GHHIWYALXDVMHS-OAHLLOKOSA-N 0 3 407.415 4.143 20 0 HIADHN Clc1cc2cccnc2c(CN(CCCN2CCOCC2)Cc2ccncc2)c1 ZINC000564315820 945513300 /nfs/dbraw/zinc/51/33/00/945513300.db2.gz ZXACTTREUILPTE-UHFFFAOYSA-N 0 3 410.949 4.008 20 0 HIADHN COC(=O)c1cc(CN[C@@H]2CCCc3c4cc(Br)ccc4[nH]c32)cn1C ZINC000564324556 945516620 /nfs/dbraw/zinc/51/66/20/945516620.db2.gz WHLADEPPQMWNSO-QGZVFWFLSA-N 0 3 416.319 4.223 20 0 HIADHN COc1ccc(C[C@@](C)(O)CNCc2cc(Cl)ccc2OC(F)F)cc1OC ZINC000564416756 945570338 /nfs/dbraw/zinc/57/03/38/945570338.db2.gz DUERSRDWSPLLCD-HXUWFJFHSA-N 0 3 415.864 4.042 20 0 HIADHN NS(=O)(=O)c1ccc2c(c1)CCC[C@@H]2NCc1cccc(COc2ccccc2)c1 ZINC000564475157 945608152 /nfs/dbraw/zinc/60/81/52/945608152.db2.gz YTTKVYWQINNJQE-DEOSSOPVSA-N 0 3 422.550 4.080 20 0 HIADHN COc1ccc([C@H](C)N[C@@H]2CCCN(Cc3ccc(F)cc3F)C2=O)c(C)c1OC ZINC000564478413 945612242 /nfs/dbraw/zinc/61/22/42/945612242.db2.gz UCICJROCKAIWGQ-MGPUTAFESA-N 0 3 418.484 4.132 20 0 HIADHN CN(C)Cc1ccccc1NC(=O)[C@@H]1CCN(c2cc(Cl)ccc2Cl)C1=O ZINC000564524396 945651593 /nfs/dbraw/zinc/65/15/93/945651593.db2.gz HAJFQEMCBCRUBW-HNNXBMFYSA-N 0 3 406.313 4.047 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1ccccc1N1CCCCC1 ZINC000564663614 945721718 /nfs/dbraw/zinc/72/17/18/945721718.db2.gz HFAAQNWOKHKTQN-UHFFFAOYSA-N 0 3 409.496 4.212 20 0 HIADHN Brc1cncc(Br)c1CNC[C@H]1[C@@H]2c3ccccc3C[C@H]12 ZINC000565276256 945801447 /nfs/dbraw/zinc/80/14/47/945801447.db2.gz MLPQNEQTXNJDKX-PBFPGSCMSA-N 0 3 408.137 4.282 20 0 HIADHN Cc1cc(=O)[nH]c2cc(C(=O)NC[C@@H](C(C)C)N3CCc4ccccc4C3)ccc12 ZINC000565618189 945856076 /nfs/dbraw/zinc/85/60/76/945856076.db2.gz BANWMZWUNRPGGC-QHCPKHFHSA-N 0 3 403.526 4.062 20 0 HIADHN Fc1ccc([C@@H]2C[C@H](NCc3cn4ccc(Br)cc4n3)CCO2)cc1 ZINC000565721474 945871730 /nfs/dbraw/zinc/87/17/30/945871730.db2.gz NCUYFKKWAAGJKA-AEFFLSMTSA-N 0 3 404.283 4.246 20 0 HIADHN COCCCN(C(=O)c1ccc(OCC2CCCCC2)cc1)C1CCN(C)CC1 ZINC000565749143 945879389 /nfs/dbraw/zinc/87/93/89/945879389.db2.gz FPZMCSDINIDWRQ-UHFFFAOYSA-N 0 3 402.579 4.219 20 0 HIADHN NS(=O)(=O)c1ccc2c(c1)[C@H](NCc1ccc(COc3ccccc3)cc1)CCC2 ZINC000565979671 945959526 /nfs/dbraw/zinc/95/95/26/945959526.db2.gz ZCCAXLKGZJUUOX-XMMPIXPASA-N 0 3 422.550 4.080 20 0 HIADHN Cc1nc(-c2cccc(NC(=O)CN[C@@H]3CCN(C)[C@H]3c3ccccc3)c2)cs1 ZINC000566038299 945989041 /nfs/dbraw/zinc/98/90/41/945989041.db2.gz NIYFPQOCUHPHAY-OFNKIYASSA-N 0 3 406.555 4.092 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)[C@H]1CCn2c(cnc2C2CCCCC2)C1 ZINC000567037834 946225069 /nfs/dbraw/zinc/22/50/69/946225069.db2.gz COVISHXYKNHEGY-KNQAVFIVSA-N 0 3 408.590 4.130 20 0 HIADHN C[C@H](NCc1cccc(COCc2ccco2)c1)c1cccc(NS(C)(=O)=O)c1 ZINC000567044440 946226938 /nfs/dbraw/zinc/22/69/38/946226938.db2.gz AMQQUQFSXSJNBA-KRWDZBQOSA-N 0 3 414.527 4.219 20 0 HIADHN COCc1ccccc1/C=C(/C)CN(Cc1cncs1)C1CCN(C(C)=O)CC1 ZINC000567152720 946255690 /nfs/dbraw/zinc/25/56/90/946255690.db2.gz MSALDMUXPZGNDB-PDGQHHTCSA-N 0 3 413.587 4.206 20 0 HIADHN COCc1cccc2sc(NC(=O)N[C@H](CN(C)C)c3ccc(F)cc3)nc21 ZINC000567301088 946301800 /nfs/dbraw/zinc/30/18/00/946301800.db2.gz MMKCQPQVYSNDRC-MRXNPFEDSA-N 0 3 402.495 4.006 20 0 HIADHN CCOC(=O)c1nnc(-c2cccc(C[NH2+][C@H](C)C3CCC(C(F)(F)F)CC3)c2)[n-]1 ZINC000567312377 946308511 /nfs/dbraw/zinc/30/85/11/946308511.db2.gz PHWYECWRHMKLFT-BZOOQXSSSA-N 0 3 424.467 4.495 20 0 HIADHN CCOC(=O)c1nc(-c2cccc(C[NH2+][C@H](C)C3CCC(C(F)(F)F)CC3)c2)n[n-]1 ZINC000567312377 946308521 /nfs/dbraw/zinc/30/85/21/946308521.db2.gz PHWYECWRHMKLFT-BZOOQXSSSA-N 0 3 424.467 4.495 20 0 HIADHN COc1ccc([C@@H](C)NCc2cc(Cl)ccc2N2CCOCC2)c(C)c1OC ZINC000567339326 946313409 /nfs/dbraw/zinc/31/34/09/946313409.db2.gz NBKKKSYKJIQLJN-MRXNPFEDSA-N 0 3 404.938 4.353 20 0 HIADHN Cc1cc2ncn(C[C@@H](O)CN[C@H](C)c3ccc(Br)cc3F)c2cc1C ZINC000567958443 946430576 /nfs/dbraw/zinc/43/05/76/946430576.db2.gz MEXWKXRPHVIYBI-ZBFHGGJFSA-N 0 3 420.326 4.266 20 0 HIADHN Cc1cc2ncn(C[C@H](O)CN[C@H](C)c3ccc(Br)cc3F)c2cc1C ZINC000567958442 946431155 /nfs/dbraw/zinc/43/11/55/946431155.db2.gz MEXWKXRPHVIYBI-GDBMZVCRSA-N 0 3 420.326 4.266 20 0 HIADHN CC(C)Cc1ccc([C@@H](CNC(=O)c2ncccc2Br)N(C)C)cc1 ZINC000568049248 946450641 /nfs/dbraw/zinc/45/06/41/946450641.db2.gz YMTSHYSIJSPTFU-GOSISDBHSA-N 0 3 404.352 4.075 20 0 HIADHN O=C(CCC(F)(F)F)N1CCC[C@@H](NCc2cnc(-c3cccs3)s2)C1 ZINC000568077608 946457727 /nfs/dbraw/zinc/45/77/27/946457727.db2.gz FAGDERINIVQIRQ-GFCCVEGCSA-N 0 3 403.495 4.295 20 0 HIADHN C[C@H]1CN(C(=O)CCCC(=O)c2ccc(Br)cc2)CCN(C2CCC2)C1 ZINC000568135218 946477903 /nfs/dbraw/zinc/47/79/03/946477903.db2.gz SOQAMVQNFGIBQT-MRXNPFEDSA-N 0 3 421.379 4.135 20 0 HIADHN CC(C)Cc1ccc([C@@H](CNC(=O)c2ncsc2Br)N(C)C)cc1 ZINC000568431574 946541273 /nfs/dbraw/zinc/54/12/73/946541273.db2.gz ROSBTTLBKCQDDV-OAHLLOKOSA-N 0 3 410.381 4.137 20 0 HIADHN CCC[C@H](C(=O)NC1CCN(CCOc2ccc(Cl)cc2)CC1)c1ccccn1 ZINC000568655424 946635174 /nfs/dbraw/zinc/63/51/74/946635174.db2.gz AYVUKJUYVBKDNG-NRFANRHFSA-N 0 3 415.965 4.278 20 0 HIADHN COc1ccc(C(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)c(OC(F)F)c1 ZINC000568682611 946653310 /nfs/dbraw/zinc/65/33/10/946653310.db2.gz GYIZVYWLFSTYEF-LJQANCHMSA-N 0 3 422.472 4.117 20 0 HIADHN CC[C@H](NC(=O)c1ccccc1)c1noc([C@@H]2CCCN(Cc3cccc(F)c3)C2)n1 ZINC000568799257 946699530 /nfs/dbraw/zinc/69/95/30/946699530.db2.gz HYNBZJLTXWCCSP-CTNGQTDRSA-N 0 3 422.504 4.469 20 0 HIADHN COCCCN(C(=O)[C@H](C)Oc1ccc(-c2ccccc2)cc1)C1CCN(C)CC1 ZINC000569297895 946855381 /nfs/dbraw/zinc/85/53/81/946855381.db2.gz JFIAXNSWAAIJLK-FQEVSTJZSA-N 0 3 410.558 4.080 20 0 HIADHN CC[C@H](NCc1cccc(N2C(=O)N[C@](C)(C3CC3)C2=O)c1)c1cccc(OC)c1 ZINC000569389124 946864776 /nfs/dbraw/zinc/86/47/76/946864776.db2.gz QVWPHJVBHJAKFM-XUZZJYLKSA-N 0 3 407.514 4.161 20 0 HIADHN CNS(=O)(=O)c1ccc([C@H](C)N[C@@H](C)c2ccc(OC(C)C)c(Cl)c2)cc1 ZINC000569700884 946940893 /nfs/dbraw/zinc/94/08/93/946940893.db2.gz LGGXNYKYJYDLER-GJZGRUSLSA-N 0 3 410.967 4.447 20 0 HIADHN CCCOc1c(CN2CC[C@](CO)(Cc3ccc(F)cc3)C2)cccc1OCC ZINC000570128408 947108926 /nfs/dbraw/zinc/10/89/26/947108926.db2.gz INYITNWOOYJVDK-DEOSSOPVSA-N 0 3 401.522 4.440 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)Nc1ccccc1I ZINC000570150242 947117070 /nfs/dbraw/zinc/11/70/70/947117070.db2.gz YYIZWGZWWOPLQW-UHFFFAOYSA-N 0 3 415.319 4.021 20 0 HIADHN COCCS(=O)(=O)c1ccc(CN[C@@H]2CCCc3c4cc(C)ccc4[nH]c32)cc1 ZINC000570218879 947148658 /nfs/dbraw/zinc/14/86/58/947148658.db2.gz DJJJVYRMQXSZAZ-JOCHJYFZSA-N 0 3 412.555 4.064 20 0 HIADHN c1ccc(CN2CCCO[C@@H](CSc3nnc(-c4cccnc4)n3C3CC3)C2)cc1 ZINC000570230989 947153334 /nfs/dbraw/zinc/15/33/34/947153334.db2.gz VJZOEWKEKZNQRV-OAQYLSRUSA-N 0 3 421.570 4.058 20 0 HIADHN COc1cc(CN(CCO)[C@H]2CCCc3ccccc32)cc(OC)c1OCC(F)F ZINC000570247501 947167466 /nfs/dbraw/zinc/16/74/66/947167466.db2.gz GHNFVKNEFAPTBC-IBGZPJMESA-N 0 3 421.484 4.220 20 0 HIADHN OC[C@@H](CNCc1conc1Cc1ccccc1)Cc1ccc(C(F)(F)F)cc1 ZINC000570263216 947175333 /nfs/dbraw/zinc/17/53/33/947175333.db2.gz SOZBJNGLMAATBC-GOSISDBHSA-N 0 3 404.432 4.225 20 0 HIADHN CC(C)Cc1ccc([C@@H](CNC(=O)N[C@@H](C)c2ccc3c(c2)CC(=O)N3)N(C)C)cc1 ZINC000570304618 947186911 /nfs/dbraw/zinc/18/69/11/947186911.db2.gz GTWYTSMGPODPSD-GAJHUEQPSA-N 0 3 422.573 4.043 20 0 HIADHN Cc1cccc(C)c1[C@@H](C)NCC(=O)N1c2ccccc2NC(=O)C[C@H]1C(F)(F)F ZINC000570441365 947249555 /nfs/dbraw/zinc/24/95/55/947249555.db2.gz NKZJYIKFBBQXTM-QAPCUYQASA-N 0 3 419.447 4.260 20 0 HIADHN CC(C)Oc1ccc([C@H](C)NCc2cccnc2N2CCN(C)CC2)cc1Cl ZINC000570468254 947254147 /nfs/dbraw/zinc/25/41/47/947254147.db2.gz AMEDKEYNPRWLTG-KRWDZBQOSA-N 0 3 402.970 4.125 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)c1ccc(COc2ccc(F)cc2)o1)c1ccco1 ZINC000570476517 947259076 /nfs/dbraw/zinc/25/90/76/947259076.db2.gz JTCZNHLLEMCTIQ-HNAYVOBHSA-N 0 3 400.450 4.450 20 0 HIADHN CN(C)C[C@@H](NCc1cc(Br)c2c(c1)OCCCO2)c1ccc(F)cc1 ZINC000570963155 947401037 /nfs/dbraw/zinc/40/10/37/947401037.db2.gz FYXQYEORYFSTFW-GOSISDBHSA-N 0 3 423.326 4.142 20 0 HIADHN CN1CC[C@@H](NCC(=O)Nc2ccccc2C(C)(C)C)[C@@H]1c1ccc(F)c(F)c1 ZINC000570976496 947406748 /nfs/dbraw/zinc/40/67/48/947406748.db2.gz UZQCGCPAHHEYFV-IRLDBZIGSA-N 0 3 401.501 4.236 20 0 HIADHN COc1cc(Br)ccc1CN1C[C@H](c2ccccc2)[C@H]2COCC[C@H]21 ZINC000571412790 947636863 /nfs/dbraw/zinc/63/68/63/947636863.db2.gz AFNSEIZWSFNNTN-VAMGGRTRSA-N 0 3 402.332 4.462 20 0 HIADHN Cc1cc(F)ccc1-c1nc(C(C)(C)C(=O)N2CCCN(C(C)C)CC2)cs1 ZINC000571573117 947708861 /nfs/dbraw/zinc/70/88/61/947708861.db2.gz NZVVVXKLKPMJIN-UHFFFAOYSA-N 0 3 403.567 4.478 20 0 HIADHN CO[C@@H]1C[C@H](c2ccccc2)CC[C@@H]1N[C@H](C)C(=O)Nc1ccc(-c2c[nH]cn2)cc1 ZINC000571588823 947716576 /nfs/dbraw/zinc/71/65/76/947716576.db2.gz VIGBESNQBUQXOV-SESZIYJCSA-N 0 3 418.541 4.345 20 0 HIADHN O=C(N[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000571622391 947731595 /nfs/dbraw/zinc/73/15/95/947731595.db2.gz BVJSDTJOJJMICX-ZAAXVRCTSA-N 0 3 404.341 4.273 20 0 HIADHN CC[C@@H](C)Oc1ccc(NC(=O)N(C)C2CCN(CCc3ccccn3)CC2)cc1 ZINC000571708888 947756615 /nfs/dbraw/zinc/75/66/15/947756615.db2.gz AJCDMZBTUQSYMP-LJQANCHMSA-N 0 3 410.562 4.430 20 0 HIADHN CN1CC[C@@H](NCC(=O)Nc2cc(Cl)ccc2F)[C@H]1c1ccc(Cl)c(F)c1 ZINC000571810750 947791757 /nfs/dbraw/zinc/79/17/57/947791757.db2.gz NYOLGZXMTWSBMX-VQIMIIECSA-N 0 3 414.283 4.245 20 0 HIADHN COc1ccc([C@@H](Cc2ccccc2)NCC(=O)Nc2ccc(OC)cc2OC)cc1 ZINC000571870565 947806755 /nfs/dbraw/zinc/80/67/55/947806755.db2.gz RUNLBBAHJUQAMF-HSZRJFAPSA-N 0 3 420.509 4.225 20 0 HIADHN CC(C)NS(=O)(=O)Cc1ccccc1CN[C@@H]1CCCc2c3ccccc3[nH]c21 ZINC000572039667 947831836 /nfs/dbraw/zinc/83/18/36/947831836.db2.gz RCPRZDQROZDOOR-JOCHJYFZSA-N 0 3 411.571 4.163 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N(C)c3ccc(OC)c(Cl)c3)c(C)c2)CC1 ZINC000572102653 947845288 /nfs/dbraw/zinc/84/52/88/947845288.db2.gz HLBFFCGIWZXMPU-UHFFFAOYSA-N 0 3 416.953 4.467 20 0 HIADHN O=C(C[C@H]1CCCCO1)N(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000572192362 947859608 /nfs/dbraw/zinc/85/96/08/947859608.db2.gz CVVWCYXCEUCDIV-BJKOFHAPSA-N 0 3 407.558 4.034 20 0 HIADHN C[C@H](NC(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1)c1nccn1-c1ccccc1 ZINC000572193031 947860390 /nfs/dbraw/zinc/86/03/90/947860390.db2.gz GFENNTDILQGYFL-ZJOUEHCJSA-N 0 3 403.530 4.068 20 0 HIADHN Cc1noc(C)c1CO[C@@H]1CCN(Cc2ccc(-n3cnc4ccccc43)cc2)C1 ZINC000572324889 947884827 /nfs/dbraw/zinc/88/48/27/947884827.db2.gz LKPYRQACXNPQGH-OAQYLSRUSA-N 0 3 402.498 4.421 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cn(C)nc1C1CC1)c1ccc(C(F)(F)F)cc1 ZINC000572451198 947911788 /nfs/dbraw/zinc/91/17/88/947911788.db2.gz HUVDOEGHZBUPFY-GOSISDBHSA-N 0 3 408.468 4.129 20 0 HIADHN C[C@H](Cn1ccc2ccccc21)c1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1 ZINC000572643634 947965637 /nfs/dbraw/zinc/96/56/37/947965637.db2.gz FOYHKLNCHAEPBY-GOSISDBHSA-N 0 3 416.529 4.032 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)C2(c3cccc(Cl)c3)CC(=O)C2)CCN1Cc1ccccc1 ZINC000572654784 947969411 /nfs/dbraw/zinc/96/94/11/947969411.db2.gz MZLIESHARDQDIT-DYESRHJHSA-N 0 3 410.945 4.110 20 0 HIADHN O[C@@H](COc1ccc(Cl)cc1)CN1CCC(c2noc3cc(F)ccc32)CC1 ZINC000572767659 948005138 /nfs/dbraw/zinc/00/51/38/948005138.db2.gz RNQWVJVCMIJMFU-QGZVFWFLSA-N 0 3 404.869 4.240 20 0 HIADHN CN(C)C[C@H](NC(=O)c1cc(Cl)cc(F)c1Br)c1ccc(F)cc1 ZINC000572913151 948037819 /nfs/dbraw/zinc/03/78/19/948037819.db2.gz SHLZRKDZLSKZGG-HNNXBMFYSA-N 0 3 417.681 4.413 20 0 HIADHN COc1cccc([C@H](CNC(=O)NC[C@H]2CC[C@@H](c3ccccc3)O2)N2CCCC2)c1 ZINC000573053290 948073355 /nfs/dbraw/zinc/07/33/55/948073355.db2.gz PUFWJBGWYIIGRP-SGNDLWITSA-N 0 3 423.557 4.052 20 0 HIADHN O=C(Nc1ccc(-c2noc(C(F)F)n2)cc1)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000573109526 948079338 /nfs/dbraw/zinc/07/93/38/948079338.db2.gz AXJMINIPVHLRGO-QGZVFWFLSA-N 0 3 413.428 4.070 20 0 HIADHN CCOC(=O)c1cccc(OC[C@H](O)CN[C@@H]2CCSc3ccc(Cl)cc32)c1 ZINC000573231221 948115092 /nfs/dbraw/zinc/11/50/92/948115092.db2.gz YVRUWSNXDOKIRU-VQIMIIECSA-N 0 3 421.946 4.083 20 0 HIADHN O=c1cc(-c2noc(-c3ccc(CN4CCSCC4)cc3)n2)c2ccccc2[nH]1 ZINC000573261164 948130586 /nfs/dbraw/zinc/13/05/86/948130586.db2.gz JGUCLMQUGXSHGA-UHFFFAOYSA-N 0 3 404.495 4.206 20 0 HIADHN C[C@H]1[C@@H](NC(=O)N(Cc2ccccc2)CC2CCOCC2)CCN1Cc1ccccc1 ZINC000573398848 948184672 /nfs/dbraw/zinc/18/46/72/948184672.db2.gz VJIDDSQLJQZDDG-OFVILXPXSA-N 0 3 421.585 4.288 20 0 HIADHN CC[C@@H](N[C@@H]1c2ccccc2CC12CCOCC2)c1ccccc1OCC(=O)N(C)C ZINC000573410957 948198661 /nfs/dbraw/zinc/19/86/61/948198661.db2.gz OTBUBKUANAOZGN-RCZVLFRGSA-N 0 3 422.569 4.289 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3nc4c(s3)CCCC4(C)C)CC2)C[C@@H](C)O1 ZINC000573647552 948265888 /nfs/dbraw/zinc/26/58/88/948265888.db2.gz HKATYQOILSZYCY-HZPDHXFCSA-N 0 3 420.623 4.110 20 0 HIADHN CCn1nccc1CCN1CCc2c(cccc2NC(=O)Nc2ccc(F)cc2)C1 ZINC000573665428 948269742 /nfs/dbraw/zinc/26/97/42/948269742.db2.gz FFSVXCJORULPDO-UHFFFAOYSA-N 0 3 407.493 4.287 20 0 HIADHN CC(C)Cn1ncc(C(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)c1C1CC1 ZINC000573755123 948289949 /nfs/dbraw/zinc/28/99/49/948289949.db2.gz PDJOTXBCLDTHRK-QFIPXVFZSA-N 0 3 412.578 4.236 20 0 HIADHN Cc1ccc([C@H]2OCCC[C@H]2NCc2cn3ccc(Br)cc3n2)cc1 ZINC000573965223 948336553 /nfs/dbraw/zinc/33/65/53/948336553.db2.gz JUPCLBOPXMJLCB-UYAOXDASSA-N 0 3 400.320 4.415 20 0 HIADHN C[C@@H](Cc1cncc2ccccc21)C(=O)NCC(C)(C)N1CCc2ccccc2C1 ZINC000574062866 948355654 /nfs/dbraw/zinc/35/56/54/948355654.db2.gz DGWOCYSGBKSTCF-IBGZPJMESA-N 0 3 401.554 4.367 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)N[C@@H]1c2ccccc2CC12CCOCC2 ZINC000574093961 948363020 /nfs/dbraw/zinc/36/30/20/948363020.db2.gz UNBGLJZZMGYTCC-BJKOFHAPSA-N 0 3 419.569 4.217 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)N[C@@H]1c2ccccc2CC12CCOCC2 ZINC000574093962 948363311 /nfs/dbraw/zinc/36/33/11/948363311.db2.gz UNBGLJZZMGYTCC-DNQXCXABSA-N 0 3 419.569 4.217 20 0 HIADHN CCN(CC(=O)Nc1ccc(Br)cc1Cl)[C@H]1CCOC(C)(C)C1 ZINC000574203646 948386799 /nfs/dbraw/zinc/38/67/99/948386799.db2.gz YACSGNMCCNGZFG-ZDUSSCGKSA-N 0 3 403.748 4.321 20 0 HIADHN COc1ccc(CN2C[C@H]3CCC[N@@H+]3Cc3ccccc32)c(Br)c1[O-] ZINC000574445988 948445682 /nfs/dbraw/zinc/44/56/82/948445682.db2.gz VSPRAXPFQBFLQM-MRXNPFEDSA-N 0 3 403.320 4.148 20 0 HIADHN COc1ccc(CN2C[C@H]3CCC[N@H+]3Cc3ccccc32)c(Br)c1[O-] ZINC000574445988 948445689 /nfs/dbraw/zinc/44/56/89/948445689.db2.gz VSPRAXPFQBFLQM-MRXNPFEDSA-N 0 3 403.320 4.148 20 0 HIADHN CCOC(=O)C1CCC(N(CC)CC(=O)Nc2cc(C)c(Cl)cc2OC)CC1 ZINC000575074252 948583896 /nfs/dbraw/zinc/58/38/96/948583896.db2.gz LWFRWSJSJWFVLV-UHFFFAOYSA-N 0 3 410.942 4.039 20 0 HIADHN COCC[C@@H](Cc1cccc(Br)c1)C(=O)Nc1ccccc1CN(C)C ZINC000575223645 948636536 /nfs/dbraw/zinc/63/65/36/948636536.db2.gz BJENRZPRUJCUOP-KRWDZBQOSA-N 0 3 419.363 4.345 20 0 HIADHN CN(C)C[C@H](NC(=O)Nc1ccc2oc(C(F)(F)F)nc2c1)c1ccc(F)cc1 ZINC000575238372 948639404 /nfs/dbraw/zinc/63/94/04/948639404.db2.gz AWENRPNOVGZIDZ-HNNXBMFYSA-N 0 3 410.371 4.410 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)c2c(F)cccc2Br)N(C)C)cc1 ZINC000575828407 948728034 /nfs/dbraw/zinc/72/80/34/948728034.db2.gz PQBOMAMVMCLXNI-SFHVURJKSA-N 0 3 423.326 4.408 20 0 HIADHN OC1(CCN[C@H](Cc2ccccc2F)c2ccccc2Br)CCOCC1 ZINC000575889773 948754831 /nfs/dbraw/zinc/75/48/31/948754831.db2.gz NAGAOMYKVPKITD-HXUWFJFHSA-N 0 3 422.338 4.393 20 0 HIADHN CCc1nc(C)c([C@H](C)N(C)C(=O)N[C@@H]2CCN(Cc3ccccc3)[C@@H]2C)s1 ZINC000575928932 948784300 /nfs/dbraw/zinc/78/43/00/948784300.db2.gz FWUVICOBOYANAH-ZIFCJYIRSA-N 0 3 400.592 4.379 20 0 HIADHN CCc1nc(C)c([C@H](C)N(C)C(=O)N[C@H]2CCN(Cc3ccccc3)[C@H]2C)s1 ZINC000575928931 948784852 /nfs/dbraw/zinc/78/48/52/948784852.db2.gz FWUVICOBOYANAH-LNLFQRSKSA-N 0 3 400.592 4.379 20 0 HIADHN FC(F)(c1nc2ccc(Cl)nc2[nH]1)N1CCC[C@@H]2CN(Cc3ccccc3)C[C@@H]21 ZINC001164630420 719101831 /nfs/dbraw/zinc/10/18/31/719101831.db2.gz WGEYIZSACBSZCO-WBVHZDCISA-N 0 3 417.891 4.257 20 0 HIADHN FC(F)(c1nc2ccc(Cl)nc2[nH]1)N1CCC[C@H]2CN(Cc3ccccc3)C[C@@H]21 ZINC001164630419 719102146 /nfs/dbraw/zinc/10/21/46/719102146.db2.gz WGEYIZSACBSZCO-RDJZCZTQSA-N 0 3 417.891 4.257 20 0 HIADHN CCN1CCn2c(-c3ccccc3)cnc2C12CCN(c1cc(C)cc(C)n1)CC2 ZINC001164663809 719345825 /nfs/dbraw/zinc/34/58/25/719345825.db2.gz MLKFSFBEBONEFF-UHFFFAOYSA-N 0 3 401.558 4.393 20 0 HIADHN Cc1csc2c1nc(Cl)cc2N1CCN2C[C@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164865671 721117175 /nfs/dbraw/zinc/11/71/75/721117175.db2.gz OFQYSRISGPKJNF-IAGOWNOFSA-N 0 3 414.962 4.133 20 0 HIADHN Cn1cc(CN2CC[C@@H]3CN(c4cc(-c5ccccc5)cc(Cl)n4)C[C@H]3C2)cn1 ZINC001164772257 721127680 /nfs/dbraw/zinc/12/76/80/721127680.db2.gz UUTKCVBAHINURE-TZIWHRDSSA-N 0 3 407.949 4.094 20 0 HIADHN Cn1cc(CN2CC[C@H]3CN(c4ccc5c(Cl)ccc(Cl)c5n4)C[C@@H]3C2)cn1 ZINC001164760715 721234360 /nfs/dbraw/zinc/23/43/60/721234360.db2.gz GHPMEOIHUJUJJQ-HOTGVXAUSA-N 0 3 416.356 4.233 20 0 HIADHN Cc1cccc2ncnc(N3CCC(F)(F)[C@@]4(CCN(Cc5ccccn5)C4)C3)c12 ZINC001164904972 721708505 /nfs/dbraw/zinc/70/85/05/721708505.db2.gz GCUDAYMRGFUFOB-JOCHJYFZSA-N 0 3 409.484 4.071 20 0 HIADHN Cc1cc(Cl)c(C)nc1N1CCC(F)(F)[C@@]2(CCN(Cc3ccccn3)C2)C1 ZINC001164906661 721714525 /nfs/dbraw/zinc/71/45/25/721714525.db2.gz NOIIYRZTQZMOHK-HXUWFJFHSA-N 0 3 406.908 4.485 20 0 HIADHN COc1ccc2c(ccnc2N2CCC3(CC2)CN(Cc2ccc(C)cc2)CCO3)c1 ZINC001164940552 721923817 /nfs/dbraw/zinc/92/38/17/721923817.db2.gz TVVIXZIYQRJQLH-UHFFFAOYSA-N 0 3 417.553 4.423 20 0 HIADHN CN(Cc1ccc(N2CCN(c3ccnc4cc(Cl)ccc43)CC2)nc1)C1CC1 ZINC001165045065 721940003 /nfs/dbraw/zinc/94/00/03/721940003.db2.gz RFSZMFXJLXUWJR-UHFFFAOYSA-N 0 3 407.949 4.204 20 0 HIADHN Cc1c(Cl)cnc(Cl)c1N1CCC2(CC1)COCCN(Cc1ccncc1)C2 ZINC001164961635 722058627 /nfs/dbraw/zinc/05/86/27/722058627.db2.gz NIYCUUJIQBNGSF-UHFFFAOYSA-N 0 3 421.372 4.211 20 0 HIADHN Clc1cc(N2CC[C@@H]3CN(Cc4cccnc4)CCO[C@H]3C2)c2ccccc2n1 ZINC001164980836 722098956 /nfs/dbraw/zinc/09/89/56/722098956.db2.gz KOQXWPCJAOXQQE-GCJKJVERSA-N 0 3 408.933 4.011 20 0 HIADHN Clc1cccc2nc(N3CC[C@H]4CN(Cc5cccnc5)CCO[C@@H]4C3)ccc12 ZINC001164983716 722114300 /nfs/dbraw/zinc/11/43/00/722114300.db2.gz ZERYWFLWBZGCMM-PGRDOPGGSA-N 0 3 408.933 4.011 20 0 HIADHN Cc1ccc2c(c1)nc(Cl)cc2N1CC[C@H]2CN(Cc3cccnc3)CCO[C@@H]2C1 ZINC001164971454 722125708 /nfs/dbraw/zinc/12/57/08/722125708.db2.gz CLRIQJQOGYGQRD-WMZHIEFXSA-N 0 3 422.960 4.319 20 0 HIADHN CC(C)c1cc(N2CC[C@@H]3CN(Cc4cccnc4)CCO[C@H]3C2)nc(C(C)(C)C)n1 ZINC001164973356 722147832 /nfs/dbraw/zinc/14/78/32/722147832.db2.gz BTZRMCANCIWKJY-IRLDBZIGSA-N 0 3 423.605 4.020 20 0 HIADHN Cc1cccc2cc(Cl)nc(N3CC[C@@H]4CN(Cc5cccnc5)CCO[C@H]4C3)c12 ZINC001164971264 722153522 /nfs/dbraw/zinc/15/35/22/722153522.db2.gz BLWYYFLYNWYNLK-RTWAWAEBSA-N 0 3 422.960 4.319 20 0 HIADHN Cc1cccc2cc(Cl)nc(N3CC[C@H]4CN(Cc5cccnc5)CCO[C@H]4C3)c12 ZINC001164971267 722153679 /nfs/dbraw/zinc/15/36/79/722153679.db2.gz BLWYYFLYNWYNLK-SFTDATJTSA-N 0 3 422.960 4.319 20 0 HIADHN Cc1nc(-c2ccncc2)cc(N2CCC[C@@]3(CCN3Cc3cccc(F)c3)C2)n1 ZINC001164997292 722210257 /nfs/dbraw/zinc/21/02/57/722210257.db2.gz YQRRSYHQZWVEFD-XMMPIXPASA-N 0 3 403.505 4.231 20 0 HIADHN CN(C)CCN(C(=O)Nc1cccc(OCC(=O)Nc2ccccc2)c1)C1CCCC1 ZINC000435997030 861281258 /nfs/dbraw/zinc/28/12/58/861281258.db2.gz BKCXHJABPUYXQF-UHFFFAOYSA-N 0 3 424.545 4.042 20 0 HIADHN CN(C)Cc1ccc(-c2noc(-c3c[nH]nc3-c3cccc(OC(F)F)c3)n2)cc1 ZINC000436117177 861403275 /nfs/dbraw/zinc/40/32/75/861403275.db2.gz YPWBWXMLVAISDZ-UHFFFAOYSA-N 0 3 411.412 4.457 20 0 HIADHN COc1ccc(COC[C@@H](O)CN(C)Cc2ccc(Cl)c(Cl)c2)cc1OC ZINC000006083068 845168424 /nfs/dbraw/zinc/16/84/24/845168424.db2.gz VIFUHSQUDTZVDC-INIZCTEOSA-N 0 3 414.329 4.020 20 0 HIADHN COc1ccc(Cl)cc1N1CC[C@@H](NCc2cnn(Cc3ccc(F)cc3)c2)C1 ZINC000436236952 861545011 /nfs/dbraw/zinc/54/50/11/861545011.db2.gz BKVUNOKEACYFJS-HXUWFJFHSA-N 0 3 414.912 4.101 20 0 HIADHN Cc1cc(N2CCCC2)ccc1NC(=O)CN[C@@H]1CCCC[C@H]1OCCC(C)C ZINC000436255768 861566969 /nfs/dbraw/zinc/56/69/69/861566969.db2.gz YUYMMTACFNCKPW-DHIUTWEWSA-N 0 3 401.595 4.497 20 0 HIADHN COc1ccc(CNCCNC(=O)c2ccc(Cl)cc2)cc1OCc1ccccc1 ZINC000008165787 845482903 /nfs/dbraw/zinc/48/29/03/845482903.db2.gz MHIBOTGPYXNBMF-UHFFFAOYSA-N 0 3 424.928 4.447 20 0 HIADHN CN(C)Cc1ccccc1CNC(=O)COc1ccc(C2SCCCS2)cc1 ZINC000009917359 845603752 /nfs/dbraw/zinc/60/37/52/845603752.db2.gz BFSLBQJGASVSGY-UHFFFAOYSA-N 0 3 416.612 4.312 20 0 HIADHN CCOC(=O)c1c(NC(=O)Cc2cccs2)sc2c1CC(C)(C)NC2(C)C ZINC000010061668 845616030 /nfs/dbraw/zinc/61/60/30/845616030.db2.gz SYRFZEVBAMFONR-UHFFFAOYSA-N 0 3 406.573 4.327 20 0 HIADHN CSc1ccc(CCN[C@H](C)c2cc(S(N)(=O)=O)c(Cl)cc2Cl)cc1 ZINC000436282942 861590577 /nfs/dbraw/zinc/59/05/77/861590577.db2.gz IIOCZABOZFKTEV-LLVKDONJSA-N 0 3 419.399 4.256 20 0 HIADHN COc1ccc(CNC(=O)[C@@H](C)N[C@H](c2ccc(Cl)cc2)C(C)C)cc1OC ZINC000011103631 845754062 /nfs/dbraw/zinc/75/40/62/845754062.db2.gz GJXJBXMLBBVALQ-VFNWGFHPSA-N 0 3 404.938 4.349 20 0 HIADHN CCOC(=O)Nc1ccc2c(CN(C)CCOc3ccccc3C)cc(=O)oc2c1 ZINC000015099514 846009737 /nfs/dbraw/zinc/00/97/37/846009737.db2.gz KIXYHPIQSQIMGX-UHFFFAOYSA-N 0 3 410.470 4.181 20 0 HIADHN S=C(Nc1cccc(Br)c1)N1CCCN(Cc2ccccc2)CC1 ZINC000017517745 846255738 /nfs/dbraw/zinc/25/57/38/846255738.db2.gz VZRNCVNNIITKJH-UHFFFAOYSA-N 0 3 404.377 4.354 20 0 HIADHN COc1ccc(CNC(=O)CN(Cc2ccc(F)cc2)C2CCCCC2)cc1OC ZINC000018940382 846346599 /nfs/dbraw/zinc/34/65/99/846346599.db2.gz ZWAMCYAHTNNIMY-UHFFFAOYSA-N 0 3 414.521 4.294 20 0 HIADHN COc1ccc([C@H](CNC(=O)Cc2nc(-c3ccccc3)oc2C)N2CCCC2)cc1 ZINC000022529465 846582879 /nfs/dbraw/zinc/58/28/79/846582879.db2.gz PLEXSOHJJJCYDC-QHCPKHFHSA-N 0 3 419.525 4.154 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cnc2onc(C(C)C)c2c1)c1cccc(OC)c1 ZINC000022700998 846607142 /nfs/dbraw/zinc/60/71/42/846607142.db2.gz PALZKHJLDBMFHH-FQEVSTJZSA-N 0 3 410.518 4.168 20 0 HIADHN CCNC(=O)COc1ccc(CN[C@@H](C)c2ccc(Cl)c(Cl)c2)cc1OC ZINC000022783386 846620405 /nfs/dbraw/zinc/62/04/05/846620405.db2.gz GPQYUNXDBZGKDD-ZDUSSCGKSA-N 0 3 411.329 4.368 20 0 HIADHN Cc1ccc(CN2CCCN(CC(=O)Nc3c(Cl)cccc3Cl)CC2)cc1 ZINC000022831169 846626396 /nfs/dbraw/zinc/62/63/96/846626396.db2.gz CHJXGKBNSNVLBK-UHFFFAOYSA-N 0 3 406.357 4.448 20 0 HIADHN Cc1ccc(CN2CCCN(CC(=O)Nc3ccccc3SC(F)F)CC2)cc1 ZINC000022995574 846646787 /nfs/dbraw/zinc/64/67/87/846646787.db2.gz ORYOJZVHSAKHLJ-UHFFFAOYSA-N 0 3 419.541 4.456 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)C1CCN(c2nc3ccccc3o2)CC1 ZINC000023238280 846675724 /nfs/dbraw/zinc/67/57/24/846675724.db2.gz NLPDEMIDYUXKBI-IBGZPJMESA-N 0 3 424.570 4.059 20 0 HIADHN CN1CCC(NC(=O)c2cn(Cc3ccccc3)nc2-c2ccc(Cl)cc2)CC1 ZINC000023421752 846699862 /nfs/dbraw/zinc/69/98/62/846699862.db2.gz IDRZYKYYYALEMP-UHFFFAOYSA-N 0 3 408.933 4.076 20 0 HIADHN O=C(CN[C@H](Cc1ccccc1)c1ccccc1)Nc1ccccc1N1CCCC1=O ZINC000024734697 846860053 /nfs/dbraw/zinc/86/00/53/846860053.db2.gz ABGXPXNFCIILKX-HSZRJFAPSA-N 0 3 413.521 4.326 20 0 HIADHN O=C(NCCNCc1cn(-c2ccccc2)nc1-c1ccc(Cl)cc1)c1ccco1 ZINC000025052448 846912968 /nfs/dbraw/zinc/91/29/68/846912968.db2.gz ZJGNJRXVNYTLSV-UHFFFAOYSA-N 0 3 420.900 4.305 20 0 HIADHN COc1ccc(CN2CCCN(C(=O)c3cc(-c4ccccc4Cl)[nH]n3)CC2)cc1 ZINC000025096162 846925267 /nfs/dbraw/zinc/92/52/67/846925267.db2.gz BLDXVMKHPASLQK-UHFFFAOYSA-N 0 3 424.932 4.087 20 0 HIADHN O=C(CSc1ccncc1)Nc1ccc(N2CCN(Cc3ccccc3)CC2)cc1 ZINC000025181069 846937333 /nfs/dbraw/zinc/93/73/33/846937333.db2.gz DISPTKDHTWVZMP-UHFFFAOYSA-N 0 3 418.566 4.135 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3ccc(Br)s3)c(C)c2)CC1 ZINC000025186145 846939189 /nfs/dbraw/zinc/93/91/89/846939189.db2.gz KODXLVAZMYYGPW-UHFFFAOYSA-N 0 3 408.365 4.213 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)CCC(=O)c3cc(C)ccc3C)c(C)c2)CC1 ZINC000025185845 846939592 /nfs/dbraw/zinc/93/95/92/846939592.db2.gz XHBXWFCRZDIFHR-UHFFFAOYSA-N 0 3 407.558 4.355 20 0 HIADHN CN(C)[C@@H](CNC(=O)c1ccc(-c2ccc3c(c2)OCCO3)s1)c1ccccc1 ZINC000025420287 846975729 /nfs/dbraw/zinc/97/57/29/846975729.db2.gz HHAQDYRRKXPRAE-SFHVURJKSA-N 0 3 408.523 4.219 20 0 HIADHN Cc1oc(-c2ccccc2)nc1CC(=O)NCC(C)(C)N1CCc2ccccc2C1 ZINC000025464408 846981694 /nfs/dbraw/zinc/98/16/94/846981694.db2.gz JCVWIYOFLZBXSP-UHFFFAOYSA-N 0 3 403.526 4.146 20 0 HIADHN CC(C)[C@H](CNC(=O)c1cccc(OC[C@@H]2CCCO2)c1)N1CCc2ccccc2C1 ZINC000025540593 846996612 /nfs/dbraw/zinc/99/66/12/846996612.db2.gz LWUFOVFVLKNZAH-DQEYMECFSA-N 0 3 422.569 4.057 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1c(C)onc1-c1ccccc1)c1cccc(OC)c1 ZINC000025856716 847047445 /nfs/dbraw/zinc/04/74/45/847047445.db2.gz XQOGECUXMKHYON-OAQYLSRUSA-N 0 3 407.514 4.472 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cnn(-c2ccccc2F)c1C)c1cccc(OC)c1 ZINC000025863577 847048069 /nfs/dbraw/zinc/04/80/69/847048069.db2.gz HGLOZRBGNHXABH-QHCPKHFHSA-N 0 3 424.520 4.141 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Cc1nc(-c2ccccc2)oc1C)c1cccc(OC)c1 ZINC000025863280 847048311 /nfs/dbraw/zinc/04/83/11/847048311.db2.gz KWIYQAFEJVQRRX-HSZRJFAPSA-N 0 3 421.541 4.400 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1c[nH]nc1-c1ccc(F)cc1)c1cccc(OC)c1 ZINC000025862835 847048351 /nfs/dbraw/zinc/04/83/51/847048351.db2.gz WUMHSWUFODRGJY-OAQYLSRUSA-N 0 3 410.493 4.037 20 0 HIADHN COc1ccc(C(=O)C2CCN(CCC(=O)Nc3cccc(Cl)c3)CC2)cc1 ZINC000025947083 847061163 /nfs/dbraw/zinc/06/11/63/847061163.db2.gz DTIQBYONDDJXBU-UHFFFAOYSA-N 0 3 400.906 4.272 20 0 HIADHN COc1ccc(OC)c([C@@H](C)NC[C@@H](O)COc2cc(Cl)ccc2Cl)c1 ZINC000026715377 847189921 /nfs/dbraw/zinc/18/99/21/847189921.db2.gz PBCMBMIDUUNUNR-TZMCWYRMSA-N 0 3 400.302 4.101 20 0 HIADHN COc1ccc(OC)c([C@H](C)NC[C@@H](O)COc2ccc(-c3ccccc3)cc2)c1 ZINC000026715157 847190027 /nfs/dbraw/zinc/19/00/27/847190027.db2.gz DSFCTOMVUIIWAY-GHTZIAJQSA-N 0 3 407.510 4.461 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)c3ccc(COC(C)C)cc3)CC2)c1 ZINC000026956130 847226403 /nfs/dbraw/zinc/22/64/03/847226403.db2.gz PEQYXKUDSSGLJL-UHFFFAOYSA-N 0 3 423.601 4.252 20 0 HIADHN CCN1CCN(c2ccc(N[C@@H](C)C(=O)Nc3cccc4ncccc43)c(C)c2)CC1 ZINC000027170932 847261760 /nfs/dbraw/zinc/26/17/60/847261760.db2.gz UQHNTSHVUPYTMR-IBGZPJMESA-N 0 3 417.557 4.124 20 0 HIADHN COc1cc(CN[C@H](C)c2cc(C)sc2C)ccc1OCC(=O)N1CCCC1 ZINC000027218246 847268798 /nfs/dbraw/zinc/26/87/98/847268798.db2.gz WRROFPIRMXRPLG-MRXNPFEDSA-N 0 3 402.560 4.226 20 0 HIADHN CC1CCN([C@@H](CNC(=O)c2cccc(NC(=O)C3CC3)c2)c2cccs2)CC1 ZINC000027573457 847322102 /nfs/dbraw/zinc/32/21/02/847322102.db2.gz ZJHPMRXRHXDUPC-FQEVSTJZSA-N 0 3 411.571 4.300 20 0 HIADHN CN(C)[C@@H](CNC(=O)CCCc1ccc(Br)s1)Cc1ccccc1 ZINC000027586735 847324916 /nfs/dbraw/zinc/32/49/16/847324916.db2.gz QRTUHKUUYLESEH-MRXNPFEDSA-N 0 3 409.393 4.122 20 0 HIADHN Cc1nn(CC(C)C)c(C)c1CCC(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000027606654 847326856 /nfs/dbraw/zinc/32/68/56/847326856.db2.gz JSXQULIRGBBJFK-FQEVSTJZSA-N 0 3 402.608 4.103 20 0 HIADHN Cc1oc(-c2cccs2)nc1CC(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000027608110 847327332 /nfs/dbraw/zinc/32/73/32/847327332.db2.gz IMZPJLHHMAHJGC-MRXNPFEDSA-N 0 3 401.557 4.269 20 0 HIADHN C[C@@H](NCc1cc(=O)oc2cc3c(cc12)CCC3)c1ccc(NC(=O)C2CC2)cc1 ZINC000028347845 847409219 /nfs/dbraw/zinc/40/92/19/847409219.db2.gz ILESWJAGLYCYAU-OAHLLOKOSA-N 0 3 402.494 4.481 20 0 HIADHN CC[C@@H](CNC(=O)N[C@@H](c1ccccc1)c1ccccn1)N1CCc2ccccc2C1 ZINC000028392898 847415027 /nfs/dbraw/zinc/41/50/27/847415027.db2.gz KSXHLMOGIWPJOZ-ZCYQVOJMSA-N 0 3 414.553 4.307 20 0 HIADHN CC1CCN([C@H](CNc2ccc3nnc(C(F)(F)F)n3n2)c2cccs2)CC1 ZINC000028740055 847454406 /nfs/dbraw/zinc/45/44/06/847454406.db2.gz MXARRSGKYXNXOU-CYBMUJFWSA-N 0 3 410.469 4.090 20 0 HIADHN COc1ccc(NC(=O)[C@@H](C)N[C@@H](C)c2ccc(Br)cc2)cc1OC ZINC000028893853 847473198 /nfs/dbraw/zinc/47/31/98/847473198.db2.gz FAIVWXWBTKIXFJ-QWHCGFSZSA-N 0 3 407.308 4.144 20 0 HIADHN CC(C)(CNC(=O)/C=C/c1ccc(Br)o1)N1CCc2ccccc2C1 ZINC000029160790 847516880 /nfs/dbraw/zinc/51/68/80/847516880.db2.gz XAUJLTFJMLQIAV-CSKARUKUSA-N 0 3 403.320 4.008 20 0 HIADHN Cc1c(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)cnn1-c1ccc(Cl)cc1 ZINC000029192810 847523086 /nfs/dbraw/zinc/52/30/86/847523086.db2.gz WOAXEQYWOGJNDJ-QFIPXVFZSA-N 0 3 408.933 4.401 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Cc3c(C)nc4ccccc4c3C)c(C)c2)CC1 ZINC000029374041 847554549 /nfs/dbraw/zinc/55/45/49/847554549.db2.gz GHCMNLMZXLMFHB-UHFFFAOYSA-N 0 3 416.569 4.483 20 0 HIADHN CC(C)n1ncc2c1nc(-c1ccco1)cc2C(=O)NC[C@@H](c1ccccc1)N(C)C ZINC000029689960 847600776 /nfs/dbraw/zinc/60/07/76/847600776.db2.gz URHKDMCVEQKZQI-NRFANRHFSA-N 0 3 417.513 4.305 20 0 HIADHN O=C(Nc1ccc(-n2ccnc2)cc1)c1cc(-c2ccc(Br)cc2)n[nH]1 ZINC000029913383 847649298 /nfs/dbraw/zinc/64/92/98/847649298.db2.gz SQYKWQJRKHKIMI-UHFFFAOYSA-N 0 3 408.259 4.277 20 0 HIADHN CN(C)[C@@H](CNc1c([N+](=O)[O-])cc(C(F)(F)F)cc1[N+](=O)[O-])c1cccs1 ZINC000029915565 847649531 /nfs/dbraw/zinc/64/95/31/847649531.db2.gz HGRMWFWKBQQPBG-LBPRGKRZSA-N 0 3 404.370 4.298 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cnn(-c4ccc(F)cc4)c3C)c(C)c2)CC1 ZINC000030565420 847737302 /nfs/dbraw/zinc/73/73/02/847737302.db2.gz IOLRWBSEAXNYGL-UHFFFAOYSA-N 0 3 421.520 4.022 20 0 HIADHN COc1cc(CNCc2ccccc2Cn2ccnc2)ccc1OCc1ccncc1 ZINC000030651549 847752480 /nfs/dbraw/zinc/75/24/80/847752480.db2.gz GJHQRYGJAVEXRL-UHFFFAOYSA-N 0 3 414.509 4.204 20 0 HIADHN COc1ccc(OC)c(CCC(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)c1 ZINC000030700621 847761737 /nfs/dbraw/zinc/76/17/37/847761737.db2.gz JNJHHDBUZDQGIK-HXUWFJFHSA-N 0 3 416.587 4.287 20 0 HIADHN Cc1nn(Cc2ccccc2Cl)c(C)c1CNCc1ccccc1Cn1cncn1 ZINC000030900910 847794182 /nfs/dbraw/zinc/79/41/82/847794182.db2.gz OPHRRMAVZMWUOJ-UHFFFAOYSA-N 0 3 420.948 4.131 20 0 HIADHN COc1ccc(CNCc2cccnc2-n2ccnc2)cc1OCc1ccccc1 ZINC000030902388 847796171 /nfs/dbraw/zinc/79/61/71/847796171.db2.gz VJGHNDAUKIDREE-UHFFFAOYSA-N 0 3 400.482 4.145 20 0 HIADHN CC[C@@H](NC(=O)NCCCN1CCc2ccccc2C1)c1ccccc1OC(F)F ZINC000031123544 847825974 /nfs/dbraw/zinc/82/59/74/847825974.db2.gz WPHGCPWOCSMPOM-HXUWFJFHSA-N 0 3 417.500 4.487 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N(C)CC(=O)Nc1c(C)cccc1C)c1ccsc1 ZINC000031194732 847840813 /nfs/dbraw/zinc/84/08/13/847840813.db2.gz WTKIJQJXUQWHDB-LJQANCHMSA-N 0 3 416.591 4.028 20 0 HIADHN Cc1c(C(=O)Nc2ccccc2CN(C)C)cnn1-c1ccc(Br)cc1 ZINC000031231553 847847797 /nfs/dbraw/zinc/84/77/97/847847797.db2.gz XWRZJUFFBSQLDT-UHFFFAOYSA-N 0 3 413.319 4.257 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1[nH]c2c(c1C)C(=O)CC(C)(C)C2)Cc1ccccc1 ZINC000031657922 847924213 /nfs/dbraw/zinc/92/42/13/847924213.db2.gz KMYHUWYPRGWGCH-IBGZPJMESA-N 0 3 409.574 4.161 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1[nH]c2c(c1C)C(=O)CC(C)(C)C2)Cc1ccccc1 ZINC000031657920 847924605 /nfs/dbraw/zinc/92/46/05/847924605.db2.gz KMYHUWYPRGWGCH-LJQANCHMSA-N 0 3 409.574 4.161 20 0 HIADHN C[C@@H]1C[NH+](CC2CCN(C(=O)c3cc(Oc4ccccc4)ccc3[O-])CC2)C[C@@H](C)O1 ZINC000436547429 861845344 /nfs/dbraw/zinc/84/53/44/861845344.db2.gz XMZKYJTYWFKNDN-RTBURBONSA-N 0 3 424.541 4.146 20 0 HIADHN C[C@H]1C[NH+](CC2CCN(C(=O)c3cc(Oc4ccccc4)ccc3[O-])CC2)C[C@H](C)O1 ZINC000436547428 861845859 /nfs/dbraw/zinc/84/58/59/861845859.db2.gz XMZKYJTYWFKNDN-OALUTQOASA-N 0 3 424.541 4.146 20 0 HIADHN C[NH+]1CCC(N(Cc2ccco2)C(=O)c2cc(Cc3ccccc3)ccc2[O-])CC1 ZINC000436547078 861845915 /nfs/dbraw/zinc/84/59/15/861845915.db2.gz QEUIMFIGPGUSFP-UHFFFAOYSA-N 0 3 404.510 4.313 20 0 HIADHN Cc1ccccc1CN1CCCN(C(=O)CCc2ncc(-c3ccccc3)o2)CC1 ZINC000031765592 847944865 /nfs/dbraw/zinc/94/48/65/847944865.db2.gz QXKZJEAHQCTSKC-UHFFFAOYSA-N 0 3 403.526 4.317 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1ccccc1OC[C@@H]1CCCO1)c1ccsc1 ZINC000031984372 847974475 /nfs/dbraw/zinc/97/44/75/847974475.db2.gz YWYOQRYVITXENP-AZUAARDMSA-N 0 3 402.560 4.119 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)c1cc(Cl)ccc1Br ZINC000032401461 848019741 /nfs/dbraw/zinc/01/97/41/848019741.db2.gz UQHNNTXNQJKECC-UHFFFAOYSA-N 0 3 407.739 4.281 20 0 HIADHN CCOC(=O)c1c2c(sc1NC(=O)c1ccnn1C(C)C)C(C)(C)NC(C)(C)C2 ZINC000038506858 848178201 /nfs/dbraw/zinc/17/82/01/848178201.db2.gz ITBNXGDMQXMYCK-UHFFFAOYSA-N 0 3 418.563 4.114 20 0 HIADHN CCOC(=O)c1c2c(sc1NC(=O)c1sc(C)nc1C)C(C)(C)NC(C)(C)C2 ZINC000038806360 848180867 /nfs/dbraw/zinc/18/08/67/848180867.db2.gz BRPFLEPRRJNGMO-UHFFFAOYSA-N 0 3 421.588 4.410 20 0 HIADHN Cc1ccc(-c2cnc(CCC(=O)N3CCCN(Cc4ccccc4)CC3)o2)cc1 ZINC000039539256 848187312 /nfs/dbraw/zinc/18/73/12/848187312.db2.gz VHVGXEJKRKIYTQ-UHFFFAOYSA-N 0 3 403.526 4.317 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Cc1csc(-c2ccccn2)n1)c1ccsc1 ZINC000041441329 848215438 /nfs/dbraw/zinc/21/54/38/848215438.db2.gz LGYDPYARNRXKBM-GOSISDBHSA-N 0 3 400.573 4.008 20 0 HIADHN N#CC(C(=O)C1CCN(c2ncc(C(F)(F)F)cc2Cl)CC1)c1ccccn1 ZINC000041493736 848221189 /nfs/dbraw/zinc/22/11/89/848221189.db2.gz GFNCHNAQVXNRJW-CQSZACIVSA-N 0 3 408.811 4.242 20 0 HIADHN Cc1nn(-c2cc(C)ccc2C)c(Cl)c1CNC1CCN(C(=O)C(C)C)CC1 ZINC000042225806 848304832 /nfs/dbraw/zinc/30/48/32/848304832.db2.gz IFWBSHJRKJMVJQ-UHFFFAOYSA-N 0 3 402.970 4.188 20 0 HIADHN c1cnn(-c2ncccc2CNCc2cn(-c3ccccc3)nc2-c2cccs2)c1 ZINC000042226899 848305352 /nfs/dbraw/zinc/30/53/52/848305352.db2.gz MAVTWJVIAHWVRG-UHFFFAOYSA-N 0 3 412.522 4.471 20 0 HIADHN CC(C)c1ccc(-n2cnnc2SCC(=O)Nc2ccccc2CN(C)C)cc1 ZINC000042752666 848351327 /nfs/dbraw/zinc/35/13/27/848351327.db2.gz ATSJTOCHRROEKN-UHFFFAOYSA-N 0 3 409.559 4.183 20 0 HIADHN Cc1ccccc1CN1CCCN(C(=O)Nc2ccccc2Br)CC1 ZINC000043133055 848387202 /nfs/dbraw/zinc/38/72/02/848387202.db2.gz SKWVVUDDBNBNHG-UHFFFAOYSA-N 0 3 402.336 4.497 20 0 HIADHN COc1ccc([C@@H](CNC(=O)Nc2ccccc2Br)N2CCCC2)cc1 ZINC000043133657 848387429 /nfs/dbraw/zinc/38/74/29/848387429.db2.gz HSASZQLOSKGVNB-LJQANCHMSA-N 0 3 418.335 4.416 20 0 HIADHN CC(=O)Nc1cccc(NC(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)c1 ZINC000043656378 848446949 /nfs/dbraw/zinc/44/69/49/848446949.db2.gz YZPVHJYFPQTMER-LJQANCHMSA-N 0 3 400.548 4.301 20 0 HIADHN CCOc1cccc2cc([C@@H](C)[NH2+]C3CCN(C(=O)c4ccccc4[O-])CC3)oc21 ZINC000436717835 861905678 /nfs/dbraw/zinc/90/56/78/861905678.db2.gz XYEIHFWFJKLNHJ-MRXNPFEDSA-N 0 3 408.498 4.493 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1cccc(N2CCCC2=O)c1)c1ccsc1 ZINC000043847212 848476612 /nfs/dbraw/zinc/47/66/12/848476612.db2.gz GHIOOWXNZSDZTO-LJQANCHMSA-N 0 3 400.548 4.080 20 0 HIADHN CC(C)CC(=O)Nc1ccc(NC(=O)NCCCN2CCc3ccccc3C2)cc1 ZINC000044031283 848504417 /nfs/dbraw/zinc/50/44/17/848504417.db2.gz LEQUUKHXMHEJIN-UHFFFAOYSA-N 0 3 408.546 4.241 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)Nc1ccc(N(C)C)cc1C(F)(F)F ZINC000044368408 848551452 /nfs/dbraw/zinc/55/14/52/848551452.db2.gz OQXWHQMRTGEJBH-UHFFFAOYSA-N 0 3 408.468 4.367 20 0 HIADHN O=C(Nc1ccc(C[NH+]2CCCCCC2)cc1)[C@H]1CCCN1C(=O)c1ccccc1[O-] ZINC000436740705 861921505 /nfs/dbraw/zinc/92/15/05/861921505.db2.gz ZJRPIFUONBABHP-JOCHJYFZSA-N 0 3 421.541 4.012 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)[C@H](C)Oc3ccccc3Cl)c(C)c2)CC1 ZINC000045195940 848646166 /nfs/dbraw/zinc/64/61/66/848646166.db2.gz LUJTUMIAFXHZKG-KRWDZBQOSA-N 0 3 401.938 4.196 20 0 HIADHN CN(C)Cc1ccccc1CNC(=O)c1cc(-c2ccco2)nn1-c1ccccc1 ZINC000045677610 848712069 /nfs/dbraw/zinc/71/20/69/848712069.db2.gz MGCSIGGGSZFJKZ-UHFFFAOYSA-N 0 3 400.482 4.124 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)Nc1ccc(OC(F)F)cc1)c1ccc(NC(=O)C2CC2)cc1 ZINC000045812661 848733021 /nfs/dbraw/zinc/73/30/21/848733021.db2.gz NHDBZLLQZIIYNC-KGLIPLIRSA-N 0 3 417.456 4.314 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Cc1coc2cc(OC)ccc12)c1cccc(OC)c1 ZINC000045827589 848736413 /nfs/dbraw/zinc/73/64/13/848736413.db2.gz JHWLMBWIJVLPAA-JOCHJYFZSA-N 0 3 410.514 4.192 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N(C)Cc1ccc(Br)o1)c1ccsc1 ZINC000046253772 848812244 /nfs/dbraw/zinc/81/22/44/848812244.db2.gz WMJPKEAQUWKADT-HNNXBMFYSA-N 0 3 414.369 4.328 20 0 HIADHN COc1cc2c(cc1OC)[C@H](c1ccccc1)N(CCC(=O)N1CCCCC1)CC2 ZINC000046502746 848861678 /nfs/dbraw/zinc/86/16/78/848861678.db2.gz GCXFASROCFOABT-VWLOTQADSA-N 0 3 408.542 4.054 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3nc(-c4cccs4)oc3C)c(C)c2)CC1 ZINC000046788210 848934005 /nfs/dbraw/zinc/93/40/05/848934005.db2.gz RKTCSBKMLOTWJA-UHFFFAOYSA-N 0 3 410.543 4.414 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)N(C)[C@@H](C)c3ccccc3)CC2)c1 ZINC000046867864 848950104 /nfs/dbraw/zinc/95/01/04/848950104.db2.gz AWZVCQXPWTUYDP-QFIPXVFZSA-N 0 3 408.590 4.300 20 0 HIADHN Cc1noc(C)c1COc1cc2ccccc2cc1C(=O)NCCN1CCCCC1 ZINC000047213376 849004989 /nfs/dbraw/zinc/00/49/89/849004989.db2.gz UTXGKMQMHDIJKX-UHFFFAOYSA-N 0 3 407.514 4.239 20 0 HIADHN CCOC(=O)Nc1ccc(NC(=O)NC[C@H](CC)N2CCc3ccccc3C2)cc1 ZINC000047945924 849141999 /nfs/dbraw/zinc/14/19/99/849141999.db2.gz BCEISYSBLRKRPO-NRFANRHFSA-N 0 3 410.518 4.213 20 0 HIADHN CCC(=O)Nc1ccc(C)c(NC(=O)NC[C@@H](c2cccs2)N2CCCC2)c1 ZINC000048257161 849199570 /nfs/dbraw/zinc/19/95/70/849199570.db2.gz JFMIKFUPAKWRRI-SFHVURJKSA-N 0 3 400.548 4.364 20 0 HIADHN CCc1ccc([C@H](CNC(=O)c2cccc(NC(=O)c3ccco3)c2)N(C)C)cc1 ZINC000048381084 849214246 /nfs/dbraw/zinc/21/42/46/849214246.db2.gz BTYNWLUMTXSTFS-NRFANRHFSA-N 0 3 405.498 4.127 20 0 HIADHN O=C(Nc1cccc(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)c1)c1ccco1 ZINC000048381682 849214318 /nfs/dbraw/zinc/21/43/18/849214318.db2.gz CAWOKMNCENQNIV-NRFANRHFSA-N 0 3 403.482 4.099 20 0 HIADHN CCC(=O)Nc1ccc(NC(=O)NC[C@@H](c2cccc(OC)c2)N(CC)CC)cc1 ZINC000048393576 849216658 /nfs/dbraw/zinc/21/66/58/849216658.db2.gz YVTLZCYKRJWREC-NRFANRHFSA-N 0 3 412.534 4.248 20 0 HIADHN O=C(Nc1cccc(NC(=O)c2ccccc2)c1)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000048481404 849230432 /nfs/dbraw/zinc/23/04/32/849230432.db2.gz XSTCQEDGWCSVNM-QHCPKHFHSA-N 0 3 414.509 4.335 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@@H](C)NCc2ccc(OC(C)C)cc2)cc1 ZINC000048683620 849254798 /nfs/dbraw/zinc/25/47/98/849254798.db2.gz GBICLYDXTLIZBW-GOSISDBHSA-N 0 3 404.576 4.355 20 0 HIADHN c1cnn(-c2ccc(CNCc3ccc(OCCOc4ccccc4)nc3)cc2)c1 ZINC000048749776 849264346 /nfs/dbraw/zinc/26/43/46/849264346.db2.gz HMBSNRAAPZLAAB-UHFFFAOYSA-N 0 3 400.482 4.015 20 0 HIADHN CNC(=O)COc1cccc(CNCc2ccc(-c3ccc(Cl)cc3)s2)c1 ZINC000048778895 849267351 /nfs/dbraw/zinc/26/73/51/849267351.db2.gz VWKWXPDKLBPRJF-UHFFFAOYSA-N 0 3 400.931 4.483 20 0 HIADHN C[C@H]1CN(Cc2ccccc2CNCc2cc(Cl)c3c(c2)OCCO3)C[C@H](C)O1 ZINC000048816702 849269893 /nfs/dbraw/zinc/26/98/93/849269893.db2.gz CFLUMCQGISLKMW-IRXDYDNUSA-N 0 3 416.949 4.010 20 0 HIADHN C[C@@H](NC(=O)C(=O)Nc1cccc(CN(C)C)c1)c1cc(F)c(Cl)cc1Cl ZINC000048842712 849273972 /nfs/dbraw/zinc/27/39/72/849273972.db2.gz LKCGBUQKJGNJQM-LLVKDONJSA-N 0 3 412.292 4.010 20 0 HIADHN N#CC(C(=O)[C@H]1CCCN(C(=O)c2ccc(F)cc2)C1)c1ccc2ccccc2n1 ZINC000048855304 849275094 /nfs/dbraw/zinc/27/50/94/849275094.db2.gz FTSZWTOUBNBPKT-ICSRJNTNSA-N 0 3 401.441 4.103 20 0 HIADHN Cc1cc([C@H]2CCCN2C(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)no1 ZINC000049790416 849329975 /nfs/dbraw/zinc/32/99/75/849329975.db2.gz NNEUMGNOCLCOKU-MOPGFXCFSA-N 0 3 402.564 4.364 20 0 HIADHN CN(C)[C@@H](CNC(=O)N1CCC[C@@H]1c1nc2ccccc2s1)Cc1ccccc1 ZINC000049794797 849330227 /nfs/dbraw/zinc/33/02/27/849330227.db2.gz ASGLYQRPHPXNKT-UYAOXDASSA-N 0 3 408.571 4.316 20 0 HIADHN CC[C@@H]([NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1)c1ccc(OC(F)F)cc1 ZINC000436827433 862007745 /nfs/dbraw/zinc/00/77/45/862007745.db2.gz JTUKUPPWYVVZDU-LJQANCHMSA-N 0 3 404.457 4.339 20 0 HIADHN C[C@@H](CNC(=O)N1CCC(C(=O)c2ccc(Cl)cc2)CC1)N1CCCC[C@@H]1C ZINC000050112089 849354271 /nfs/dbraw/zinc/35/42/71/849354271.db2.gz VDVVUTYRXDMRJC-IRXDYDNUSA-N 0 3 405.970 4.207 20 0 HIADHN C[C@@H]([NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1)c1cc(Br)ccc1F ZINC000436828399 862009363 /nfs/dbraw/zinc/00/93/63/862009363.db2.gz MFBLRCIYWXHLSI-CYBMUJFWSA-N 0 3 421.310 4.249 20 0 HIADHN COc1cc([C@@H](C)[NH2+]C2CCN(C(=O)c3ccccc3[O-])CC2)ccc1SC ZINC000436833360 862012757 /nfs/dbraw/zinc/01/27/57/862012757.db2.gz YAUVKEZAGKKQDP-OAHLLOKOSA-N 0 3 400.544 4.078 20 0 HIADHN COc1cccc(CN2CCC(NC(=O)CCCOc3ccccc3Cl)CC2)c1 ZINC000050588391 849396082 /nfs/dbraw/zinc/39/60/82/849396082.db2.gz CWDPDQMVPNZUFQ-UHFFFAOYSA-N 0 3 416.949 4.288 20 0 HIADHN Cc1cccc(NC(=O)[C@@H]2CCCN(Cc3ccc(OCc4cccnc4)cc3)C2)n1 ZINC000050960661 849423210 /nfs/dbraw/zinc/42/32/10/849423210.db2.gz SGDXQYHHBFBNAV-JOCHJYFZSA-N 0 3 416.525 4.215 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2ccc(N3CCSCC3)cc2C)N(C)C)cc1 ZINC000051648734 849497852 /nfs/dbraw/zinc/49/78/52/849497852.db2.gz RBALOYWSGGFIOA-QFIPXVFZSA-N 0 3 412.603 4.281 20 0 HIADHN CC(=O)N[C@H](C(=O)C(C#N)c1nc2cc(C(F)(F)F)ccc2s1)C1CCCC1 ZINC000051677673 849503015 /nfs/dbraw/zinc/50/30/15/849503015.db2.gz RUQPRASQFCYLDH-BBRMVZONSA-N 0 3 409.433 4.186 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N(C)C[C@@H]2CCCO[C@@H]2c2ccccc2)N(C)C)cc1 ZINC000051713738 849508750 /nfs/dbraw/zinc/50/87/50/849508750.db2.gz VFGHSKRZDAOFHJ-KMDXXIMOSA-N 0 3 409.574 4.407 20 0 HIADHN [O-]c1ccc2cc(Br)ccc2c1C[NH+]1CCN(Cc2cscn2)CC1 ZINC000052083882 849550062 /nfs/dbraw/zinc/55/00/62/849550062.db2.gz HCXGOOKIJDGULJ-UHFFFAOYSA-N 0 3 418.360 4.082 20 0 HIADHN Oc1ccc2cc(Br)ccc2c1CN1CCN(Cc2cscn2)CC1 ZINC000052083882 849550069 /nfs/dbraw/zinc/55/00/69/849550069.db2.gz HCXGOOKIJDGULJ-UHFFFAOYSA-N 0 3 418.360 4.082 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@H](C)NCc2cccc(OC(C)C)c2)cc1 ZINC000052514434 849590071 /nfs/dbraw/zinc/59/00/71/849590071.db2.gz HKGLCOQAEOYIQF-SFHVURJKSA-N 0 3 404.576 4.355 20 0 HIADHN CC[C@H](CNC(=O)c1ccc(-n2cc[nH]c2=S)cc1)N1CCc2ccccc2C1 ZINC000052591427 849599932 /nfs/dbraw/zinc/59/99/32/849599932.db2.gz NHDGUVAJFHGIGQ-HXUWFJFHSA-N 0 3 406.555 4.102 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1ccc(NC(C)=O)c(SC)c1)c1ccsc1 ZINC000052877941 849637160 /nfs/dbraw/zinc/63/71/60/849637160.db2.gz KWOYWGNIRJXOIY-GOSISDBHSA-N 0 3 405.589 4.241 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1ccc(-n2cc[nH]c2=S)cc1)c1ccsc1 ZINC000052877878 849637455 /nfs/dbraw/zinc/63/74/55/849637455.db2.gz AGNGHKNDYRCACD-GOSISDBHSA-N 0 3 400.573 4.409 20 0 HIADHN Cc1ccc(-c2noc(CCCN3CCC(NC(=O)OC(C)(C)C)CC3)n2)cc1F ZINC000052909735 849641954 /nfs/dbraw/zinc/64/19/54/849641954.db2.gz GPWWTSWBNNKXTH-UHFFFAOYSA-N 0 3 418.513 4.106 20 0 HIADHN N#Cc1c2[nH]c3ccccc3n2c(=O)cc1CN1CCC[C@@H]1Cc1cccc(F)c1 ZINC000053076578 849662206 /nfs/dbraw/zinc/66/22/06/849662206.db2.gz KVNHOBFNMCDIPO-WOJBJXKFSA-N 0 3 400.457 4.070 20 0 HIADHN CC(C)CN(C(=O)CCCOc1ccccc1Br)C1CCN(C)CC1 ZINC000053232641 849682548 /nfs/dbraw/zinc/68/25/48/849682548.db2.gz CKNFGKHZOSDXKL-UHFFFAOYSA-N 0 3 411.384 4.187 20 0 HIADHN CC(C)(C)[C@H](NCC(=O)NC1CCN(C(=O)C2CCCCC2)CC1)c1ccccc1 ZINC000053616777 849737732 /nfs/dbraw/zinc/73/77/32/849737732.db2.gz ZPKJFIWIDBQBFE-HSZRJFAPSA-N 0 3 413.606 4.051 20 0 HIADHN CC(C)c1ccc2cc(C(=O)Nc3cccc(CN4CCC(C(N)=O)CC4)c3)[nH]c2c1 ZINC000053996992 849791706 /nfs/dbraw/zinc/79/17/06/849791706.db2.gz UDTBMDFUYISXIS-UHFFFAOYSA-N 0 3 418.541 4.241 20 0 HIADHN Cc1ccc(C(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)cc1NC(=O)c1ccco1 ZINC000054226077 849829210 /nfs/dbraw/zinc/82/92/10/849829210.db2.gz HQKDKNYBRGKHSW-GHTZIAJQSA-N 0 3 417.509 4.406 20 0 HIADHN Cc1ccc(C(=O)NCCN(C)Cc2ccccc2)cc1NC(=O)c1ccccc1F ZINC000054265339 849836088 /nfs/dbraw/zinc/83/60/88/849836088.db2.gz LCEFFKOUGZCVAX-UHFFFAOYSA-N 0 3 419.500 4.248 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)Nc2cccc(N3CCCCC3=O)c2)C1 ZINC000054408665 849861628 /nfs/dbraw/zinc/86/16/28/849861628.db2.gz ZAIOUQIKTPSOGT-RXVVDRJESA-N 0 3 406.530 4.161 20 0 HIADHN CC(C)c1nccn1Cc1cccc(NC(=O)NCCN(C)Cc2ccccc2)c1 ZINC000054434081 849867161 /nfs/dbraw/zinc/86/71/61/849867161.db2.gz UBLPZGYXWNQARX-UHFFFAOYSA-N 0 3 405.546 4.308 20 0 HIADHN CC(C)CNC(=O)c1ccc(NC(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)cc1 ZINC000054437113 849867438 /nfs/dbraw/zinc/86/74/38/849867438.db2.gz CWAMKEXQMIVQHO-AVRDEDQJSA-N 0 3 408.546 4.029 20 0 HIADHN Cc1ccc(NC(=O)CNC2(c3cccc(Br)c3)CCOCC2)cc1C ZINC000055055559 849965110 /nfs/dbraw/zinc/96/51/10/849965110.db2.gz AHEKEPROMFVXEE-UHFFFAOYSA-N 0 3 417.347 4.300 20 0 HIADHN COC(=O)c1ccc(CNC2(c3cccc(Br)c3)CCOCC2)cc1 ZINC000055055611 849965468 /nfs/dbraw/zinc/96/54/68/849965468.db2.gz OAXFBGDHDTZPNW-UHFFFAOYSA-N 0 3 404.304 4.031 20 0 HIADHN C[C@@H]([NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000436909839 862086195 /nfs/dbraw/zinc/08/61/95/862086195.db2.gz NYNLTGBQDJRLJJ-XOKHGSTOSA-N 0 3 404.963 4.494 20 0 HIADHN Cc1c([O-])ccc2c(CNCc3ccccc3C[N@H+]3CCCC[C@@H]3C)cc(=O)oc12 ZINC000056156212 850261828 /nfs/dbraw/zinc/26/18/28/850261828.db2.gz ZGIFKVJMSNWJOU-KRWDZBQOSA-N 0 3 406.526 4.471 20 0 HIADHN Cc1c([O-])ccc2c(CNCc3ccccc3C[N@@H+]3CCCC[C@@H]3C)cc(=O)oc12 ZINC000056156212 850261837 /nfs/dbraw/zinc/26/18/37/850261837.db2.gz ZGIFKVJMSNWJOU-KRWDZBQOSA-N 0 3 406.526 4.471 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)c2[nH]c3ccccc3c2Br)C1 ZINC000056168803 850268268 /nfs/dbraw/zinc/26/82/68/850268268.db2.gz KSCLUHLIOVTPDO-HOCLYGCPSA-N 0 3 412.331 4.496 20 0 HIADHN CCN1CCN(c2ccc(N[C@@H](C)C(=O)Nc3cccc(Cl)c3)c(C)c2)CC1 ZINC000056170174 850268814 /nfs/dbraw/zinc/26/88/14/850268814.db2.gz VMKHHHFXDXWZLK-KRWDZBQOSA-N 0 3 400.954 4.229 20 0 HIADHN O=C(Nc1ccc(F)cc1)[C@H](NC1CCN(Cc2ccncc2)CC1)c1ccccc1 ZINC000056195795 850279266 /nfs/dbraw/zinc/27/92/66/850279266.db2.gz GEPDNMDILRXRDN-XMMPIXPASA-N 0 3 418.516 4.155 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(NC(=O)c2ccc(F)cc2)cc1)C(=O)NCc1ccccc1 ZINC000056207209 850283196 /nfs/dbraw/zinc/28/31/96/850283196.db2.gz GFKKRYDRAPSQGV-ZWKOTPCHSA-N 0 3 419.500 4.434 20 0 HIADHN COc1cc([C@H](C)NC(=O)N(CCN(C)C)Cc2ccc(C)o2)ccc1OC(C)C ZINC000056867346 850506668 /nfs/dbraw/zinc/50/66/68/850506668.db2.gz RNQVXUVAZNIJAP-SFHVURJKSA-N 0 3 417.550 4.218 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)C1(c2ccc(Cl)cc2)CCOCC1 ZINC000057192605 850576662 /nfs/dbraw/zinc/57/66/62/850576662.db2.gz UTRJKWLZRNIQKM-IBGZPJMESA-N 0 3 418.990 4.403 20 0 HIADHN Cc1nc(-c2ccc(C)cc2NC(=O)CN[C@H](C)c2ccc3c(c2)CCCC3)n[nH]1 ZINC000436981266 862159578 /nfs/dbraw/zinc/15/95/78/862159578.db2.gz QJHZQBKAHZIKMK-MRXNPFEDSA-N 0 3 403.530 4.257 20 0 HIADHN Cc1cc(NC(=O)NC[C@@H](Cc2ccccc2)N(C)C)ccc1NC(=O)c1ccco1 ZINC000057793686 850717887 /nfs/dbraw/zinc/71/78/87/850717887.db2.gz ZZBGNEPGZSVJRT-HXUWFJFHSA-N 0 3 420.513 4.135 20 0 HIADHN CN1CCC[C@H](NC(=O)N[C@@H](c2ccccc2)c2ccc(Br)cc2F)C1 ZINC000057831911 850727776 /nfs/dbraw/zinc/72/77/76/850727776.db2.gz JIKQDLFSXFYAHP-LPHOPBHVSA-N 0 3 420.326 4.071 20 0 HIADHN C[C@@H]1CC[C@H](C)[N@H+]1[C@H]1CCCN(C(=O)c2cc(OCc3ccccc3)ccc2[O-])C1 ZINC000436989279 862166687 /nfs/dbraw/zinc/16/66/87/862166687.db2.gz NTPJYYDILFFCIW-ZVDOUQERSA-N 0 3 408.542 4.449 20 0 HIADHN C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(C(=O)c2cc(OCc3ccccc3)ccc2[O-])C1 ZINC000436989279 862166693 /nfs/dbraw/zinc/16/66/93/862166693.db2.gz NTPJYYDILFFCIW-ZVDOUQERSA-N 0 3 408.542 4.449 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)[C@@H]1CCCC[C@H]1C(F)(F)F ZINC000058490174 850837803 /nfs/dbraw/zinc/83/78/03/850837803.db2.gz LMYXVZYFXRLKKR-WOJBJXKFSA-N 0 3 411.512 4.074 20 0 HIADHN COc1cc(CN(C)C(=O)NCCCN2CCc3ccccc3C2)ccc1SC ZINC000058558874 850855287 /nfs/dbraw/zinc/85/52/87/850855287.db2.gz BWWCEZYYGSGDMG-UHFFFAOYSA-N 0 3 413.587 4.007 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cnn(-c2ccc(F)cc2)c1C)c1cccc(OC)c1 ZINC000058678798 850886332 /nfs/dbraw/zinc/88/63/32/850886332.db2.gz SMJYDORJFUEGIC-HSZRJFAPSA-N 0 3 424.520 4.141 20 0 HIADHN CC(=O)c1cccc(OCCCC(=O)NC[C@H](c2cccs2)N2CCCC2)c1 ZINC000058784160 850925782 /nfs/dbraw/zinc/92/57/82/850925782.db2.gz WGUUCGILKFXRPL-HXUWFJFHSA-N 0 3 400.544 4.063 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)[C@H](c1ccccc1)N1CCSCC1)c1ccsc1 ZINC000058805818 850932894 /nfs/dbraw/zinc/93/28/94/850932894.db2.gz LEKIYQZSFGMCSG-SFTDATJTSA-N 0 3 417.644 4.037 20 0 HIADHN CC[C@H](c1ccccc1)[C@@H]1CCCN1Cc1nc2cc(OC)c(OC)cc2c(=O)[nH]1 ZINC000058956299 850968005 /nfs/dbraw/zinc/96/80/05/850968005.db2.gz QHEAGEXCCDLERD-XLIONFOSSA-N 0 3 407.514 4.099 20 0 HIADHN CCN1CCN(Cc2ccc(CNC(=O)c3cc(F)c(Cl)cc3Cl)cc2)CC1 ZINC000059002340 850976899 /nfs/dbraw/zinc/97/68/99/850976899.db2.gz ZEXWODZIYHNWNI-UHFFFAOYSA-N 0 3 424.347 4.200 20 0 HIADHN CCCN1CCC(N(C)S(=O)(=O)c2ccc(OC(C)C)c3ccccc32)CC1 ZINC000059748031 851010488 /nfs/dbraw/zinc/01/04/88/851010488.db2.gz AVHLSEOMFPFAAY-UHFFFAOYSA-N 0 3 404.576 4.122 20 0 HIADHN Cc1ccccc1-n1ncc(C(=O)NC[C@@H](C)N2CCC(C)CC2)c1C(F)(F)F ZINC000060156348 851046377 /nfs/dbraw/zinc/04/63/77/851046377.db2.gz KNUBHHCCKPLFLP-MRXNPFEDSA-N 0 3 408.468 4.050 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)Cc1ccc(Cl)cc1Cl ZINC000060168031 851048449 /nfs/dbraw/zinc/04/84/49/851048449.db2.gz RCRBCNICZPBPBT-UHFFFAOYSA-N 0 3 401.284 4.405 20 0 HIADHN O=C(c1ccc(-c2ccc(Br)cc2)s1)N1CC[C@H](N2CCCC2)C1 ZINC000060373952 851082168 /nfs/dbraw/zinc/08/21/68/851082168.db2.gz IXXYHEPUZXAYJO-INIZCTEOSA-N 0 3 405.361 4.488 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)CCCOc2cccc(Br)c2)o1 ZINC000060407548 851089195 /nfs/dbraw/zinc/08/91/95/851089195.db2.gz QXOVFKZGKSLLHO-UHFFFAOYSA-N 0 3 423.351 4.100 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)c2sc(NC(=O)C(C)(C)C)cc2C)o1 ZINC000060407376 851089233 /nfs/dbraw/zinc/08/92/33/851089233.db2.gz SWIVXXJFJZREBU-UHFFFAOYSA-N 0 3 405.564 4.147 20 0 HIADHN CN1CCN(Cc2ccc(CNC(=S)Nc3ccc(Cl)cc3Cl)cc2)CC1 ZINC000060432837 851098169 /nfs/dbraw/zinc/09/81/69/851098169.db2.gz VSTQDBTWJNDVMA-UHFFFAOYSA-N 0 3 423.413 4.227 20 0 HIADHN Cc1ccc(Cn2cc(C(=O)N[C@@H]3CCN(C4CC4)C3)c(-c3ccc(C)cc3)n2)cc1 ZINC000060470385 851111357 /nfs/dbraw/zinc/11/13/57/851111357.db2.gz WEFLSABZRICBDW-JOCHJYFZSA-N 0 3 414.553 4.182 20 0 HIADHN O=C(NCCN1CCCCC1)c1ccc(NC(=O)c2cc(Cl)cc(Cl)c2)cc1 ZINC000060665509 851182981 /nfs/dbraw/zinc/18/29/81/851182981.db2.gz HBSYPHVMGVANCS-UHFFFAOYSA-N 0 3 420.340 4.461 20 0 HIADHN Cc1ccc(COc2ccc(CNCc3ccc(S(=O)(=O)N(C)C)cc3)cc2)cc1 ZINC000061045386 851281720 /nfs/dbraw/zinc/28/17/20/851281720.db2.gz QDXNNOROCSYFIR-UHFFFAOYSA-N 0 3 424.566 4.114 20 0 HIADHN CC(C)CCOc1ccc(CNCc2ccc(S(=O)(=O)N3CCCC3)cc2)cc1 ZINC000061108793 851294978 /nfs/dbraw/zinc/29/49/78/851294978.db2.gz TVCNTRALHBCOGC-UHFFFAOYSA-N 0 3 416.587 4.186 20 0 HIADHN CN(C)[C@@H](CNC(=O)NC[C@@H](c1cccc(Cl)c1)N1CCCC1)c1cccs1 ZINC000061112587 851296346 /nfs/dbraw/zinc/29/63/46/851296346.db2.gz VHWHDKJRTAOJKV-OALUTQOASA-N 0 3 421.010 4.141 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)Nc3cc(Cl)ccc3-n3cccn3)cc2)CC1 ZINC000061164675 851309165 /nfs/dbraw/zinc/30/91/65/851309165.db2.gz WXHWBUQFHHAUMY-UHFFFAOYSA-N 0 3 423.948 4.308 20 0 HIADHN COCc1ccc(CNC(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)cc1 ZINC000061191279 851313376 /nfs/dbraw/zinc/31/33/76/851313376.db2.gz NSNJHAUMPRYBOD-FQEVSTJZSA-N 0 3 401.576 4.167 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N[C@H](C)c2ccc(NC(=O)C3CC3)cc2)N(C)C)cc1 ZINC000061222995 851321404 /nfs/dbraw/zinc/32/14/04/851321404.db2.gz DAQAJKYXKMRCPC-HXOBKFHXSA-N 0 3 422.573 4.261 20 0 HIADHN COc1ccc2ccccc2c1CNC(=O)NC[C@H](c1ccccc1)N1CCCC1 ZINC000061230195 851323761 /nfs/dbraw/zinc/32/37/61/851323761.db2.gz SXSQGGIJVAMPRD-HSZRJFAPSA-N 0 3 403.526 4.485 20 0 HIADHN O=C(NCCCCOc1ccc(F)cc1)NC[C@H](c1cccs1)N1CCCC1 ZINC000061231066 851324098 /nfs/dbraw/zinc/32/40/98/851324098.db2.gz FAKYCTILELHIOL-LJQANCHMSA-N 0 3 405.539 4.183 20 0 HIADHN COc1cccc(SCC(=O)Nc2ccc(CCN3CCSCC3)cc2)c1 ZINC000061287615 851339187 /nfs/dbraw/zinc/33/91/87/851339187.db2.gz AKGSXOMHQKARSP-UHFFFAOYSA-N 0 3 402.585 4.017 20 0 HIADHN O=C(Cc1ccc(Br)cc1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000061289451 851339601 /nfs/dbraw/zinc/33/96/01/851339601.db2.gz USPWFCMVTMYZFI-UHFFFAOYSA-N 0 3 419.388 4.222 20 0 HIADHN Cc1cc(C)n(Cc2ccc(C(=O)N3CCCN(Cc4ccccc4C)CC3)cc2)n1 ZINC000061397918 851365739 /nfs/dbraw/zinc/36/57/39/851365739.db2.gz LXSXBUSDOFYZEJ-UHFFFAOYSA-N 0 3 416.569 4.205 20 0 HIADHN Cc1nn(Cc2ccccc2Cl)c(Cl)c1CNCCCOC[C@@H]1CCCO1 ZINC000061743576 851436499 /nfs/dbraw/zinc/43/64/99/851436499.db2.gz PQKUWWCGMMGMJT-KRWDZBQOSA-N 0 3 412.361 4.222 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2cccc(Cn3cccn3)c2)N2CCCC2)cc1 ZINC000061750269 851440432 /nfs/dbraw/zinc/44/04/32/851440432.db2.gz NEEONEDLODUIFN-QHCPKHFHSA-N 0 3 403.530 4.198 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2ccc(C(=O)NC(C)C)cc2)N2CCCC2)cc1 ZINC000061774465 851446276 /nfs/dbraw/zinc/44/62/76/851446276.db2.gz ZSACZUZRAQJBKW-QFIPXVFZSA-N 0 3 408.546 4.092 20 0 HIADHN COCCOc1cc(C)ccc1NC(=O)NC[C@@H](c1ccc(C)cc1)N1CCCC1 ZINC000061773865 851446527 /nfs/dbraw/zinc/44/65/27/851446527.db2.gz NSCPVIRKWQZVHT-QFIPXVFZSA-N 0 3 411.546 4.287 20 0 HIADHN O=C(NCCCOc1ccc(F)cc1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000061791700 851453636 /nfs/dbraw/zinc/45/36/36/851453636.db2.gz VQLGKMWBDZSJNG-UHFFFAOYSA-N 0 3 417.550 4.008 20 0 HIADHN CC(C)Oc1ccccc1CNC(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000061791247 851453692 /nfs/dbraw/zinc/45/36/92/851453692.db2.gz NWUFXIGZXNLCSL-UHFFFAOYSA-N 0 3 413.587 4.387 20 0 HIADHN Cc1cccc(OCCCNC(=O)Nc2ccc(CCN3CCSCC3)cc2)c1 ZINC000061790712 851454247 /nfs/dbraw/zinc/45/42/47/851454247.db2.gz VCFDZUSPZMBSHH-UHFFFAOYSA-N 0 3 413.587 4.177 20 0 HIADHN O=C(NCCc1cccc(Cl)c1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000061793289 851455260 /nfs/dbraw/zinc/45/52/60/851455260.db2.gz QFQFJDVXBAZCCZ-UHFFFAOYSA-N 0 3 403.979 4.296 20 0 HIADHN O=C(NCc1cc(Br)ccc1F)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000062009279 851491480 /nfs/dbraw/zinc/49/14/80/851491480.db2.gz CXMCISOOLYKYQR-GOSISDBHSA-N 0 3 420.326 4.052 20 0 HIADHN C[C@H](CNC(=O)C(=O)Nc1ccccc1Sc1ccccc1)N1CCCC[C@@H]1C ZINC000062120359 851502914 /nfs/dbraw/zinc/50/29/14/851502914.db2.gz DZFYQZBCAVSRRX-ZWKOTPCHSA-N 0 3 411.571 4.155 20 0 HIADHN Cc1c(C(=O)NC[C@H]2CCCCN2Cc2ccccc2)cnn1-c1ccc(F)cc1 ZINC000062228386 851510944 /nfs/dbraw/zinc/51/09/44/851510944.db2.gz NEGZSZKVLHKIPO-JOCHJYFZSA-N 0 3 406.505 4.104 20 0 HIADHN CC(C)C(=O)Nc1ccc(NC(=O)N(CCN(C)C)Cc2cccc(F)c2)cc1 ZINC000062378517 851534949 /nfs/dbraw/zinc/53/49/49/851534949.db2.gz WEUDFRNAKUEVHD-UHFFFAOYSA-N 0 3 400.498 4.016 20 0 HIADHN COc1ccc(CCNC(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)cc1 ZINC000062473725 851558848 /nfs/dbraw/zinc/55/88/48/851558848.db2.gz GNNRWZYVUFDCNF-UHFFFAOYSA-N 0 3 423.479 4.030 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)NCCc1ccc(Cl)s1 ZINC000062488453 851563940 /nfs/dbraw/zinc/56/39/40/851563940.db2.gz YTVTZRONEBQQOR-UHFFFAOYSA-N 0 3 400.375 4.371 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)N[C@@H]1CCc2c1cccc2Cl ZINC000062500885 851566537 /nfs/dbraw/zinc/56/65/37/851566537.db2.gz DVRAIAPSTAIHRG-HXUWFJFHSA-N 0 3 407.892 4.379 20 0 HIADHN CCC(=O)Nc1ccc(C)c(NC(=S)NC2CCN(Cc3ccccc3)CC2)c1 ZINC000063149111 851621192 /nfs/dbraw/zinc/62/11/92/851621192.db2.gz TZPIFDDKYSCNPT-UHFFFAOYSA-N 0 3 410.587 4.295 20 0 HIADHN COc1ccc([C@@H](NC(=S)NC2CCN(Cc3ccccc3)CC2)C2CC2)cc1 ZINC000063145973 851621410 /nfs/dbraw/zinc/62/14/10/851621410.db2.gz IPFHUUBARXDQFU-QHCPKHFHSA-N 0 3 409.599 4.275 20 0 HIADHN S=C(NCc1cccnc1OC1CCCC1)NC1CCN(Cc2ccccc2)CC1 ZINC000063148543 851621861 /nfs/dbraw/zinc/62/18/61/851621861.db2.gz SHFOAPYSPKPHCY-UHFFFAOYSA-N 0 3 424.614 4.032 20 0 HIADHN CCCOCc1ccccc1CNC(=S)NC1CCN(Cc2ccccc2)CC1 ZINC000063149638 851623563 /nfs/dbraw/zinc/62/35/63/851623563.db2.gz IATZJJZEFKEICG-UHFFFAOYSA-N 0 3 411.615 4.242 20 0 HIADHN COc1cc(C)ccc1Oc1ccc(F)cc1NC(=S)NC1CCN(C)CC1 ZINC000063173151 851626000 /nfs/dbraw/zinc/62/60/00/851626000.db2.gz CZYRBCLSEHVEJV-UHFFFAOYSA-N 0 3 403.523 4.316 20 0 HIADHN COc1ccc2ccc([O-])c(C[NH+]3CCC(C(=O)NCCc4cccs4)CC3)c2c1 ZINC000063281390 851649483 /nfs/dbraw/zinc/64/94/83/851649483.db2.gz WMWFQHDTWFXANE-UHFFFAOYSA-N 0 3 424.566 4.186 20 0 HIADHN CCN(CC)c1ccc(/C=[NH+]/CC2(c3ccc4c(c3)OCO4)CCOCC2)c([O-])c1 ZINC000063427692 851686384 /nfs/dbraw/zinc/68/63/84/851686384.db2.gz JCWSRLDIAFUJLW-MFKUBSTISA-N 0 3 410.514 4.134 20 0 HIADHN CCCCOc1ccc(CNCc2ccc(C(=O)N3C[C@@H](C)O[C@H](C)C3)cc2)cc1 ZINC000063561861 851714906 /nfs/dbraw/zinc/71/49/06/851714906.db2.gz ILVCTEIWAGTJHD-WOJBJXKFSA-N 0 3 410.558 4.405 20 0 HIADHN C[C@@H]1CN(C(=O)c2ccc(CNCc3ccc(OC(F)(F)F)cc3)cc2)C[C@@H](C)O1 ZINC000063560779 851715113 /nfs/dbraw/zinc/71/51/13/851715113.db2.gz UAHSKVGYQODQPI-HZPDHXFCSA-N 0 3 422.447 4.124 20 0 HIADHN Cc1nn(Cc2ccc(C)cc2)c(Cl)c1C(=O)N1CCCN(C(C)(C)C)CC1 ZINC000063724271 851748914 /nfs/dbraw/zinc/74/89/14/851748914.db2.gz LMSFNJBUQSUZGR-UHFFFAOYSA-N 0 3 402.970 4.148 20 0 HIADHN C[C@H]1CCCCN1CCNC(=O)c1ccccc1CSc1nc2ccccc2[nH]1 ZINC000063812605 851770466 /nfs/dbraw/zinc/77/04/66/851770466.db2.gz BYNWZJQBGCLORR-KRWDZBQOSA-N 0 3 408.571 4.459 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@H](C)NCc2ccc(SC)c(OC)c2)cc1 ZINC000063903228 851789688 /nfs/dbraw/zinc/78/96/88/851789688.db2.gz PQSKAMKSNWABLV-INIZCTEOSA-N 0 3 422.616 4.298 20 0 HIADHN C[C@H]1CN(c2ccc(NC(=O)c3cccc(CN4CCCC4)c3)cc2F)C[C@H](C)O1 ZINC000064026353 851816751 /nfs/dbraw/zinc/81/67/51/851816751.db2.gz ITKMYMBLLAWAMP-ROUUACIJSA-N 0 3 411.521 4.287 20 0 HIADHN CC1CCN(C(=O)c2ccccc2NC(=O)c2cccc(CN3CCCC3)c2)CC1 ZINC000064026945 851817420 /nfs/dbraw/zinc/81/74/20/851817420.db2.gz UTUGGXNWONDWEU-UHFFFAOYSA-N 0 3 405.542 4.407 20 0 HIADHN C[C@H](C(=O)N(C)Cc1c(F)cccc1Cl)N1CCN(CC2CCCCC2)CC1 ZINC000064130002 851833766 /nfs/dbraw/zinc/83/37/66/851833766.db2.gz WZVMNGAPMIFSNC-QGZVFWFLSA-N 0 3 409.977 4.024 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(Br)s1)c1ccc(NS(C)(=O)=O)cc1 ZINC000437098196 862288946 /nfs/dbraw/zinc/28/89/46/862288946.db2.gz OCIXPTFCUCZFKC-MNOVXSKESA-N 0 3 403.367 4.294 20 0 HIADHN Cc1cc(NC(=O)NC[C@@H](Cc2ccccc2)N(C)C)ccc1Oc1cccnc1 ZINC000064240773 851856085 /nfs/dbraw/zinc/85/60/85/851856085.db2.gz MEIPFKTZOLPVFO-OAQYLSRUSA-N 0 3 404.514 4.477 20 0 HIADHN CCc1ccc([C@H](CNC(=O)NCc2cccc(NC(=O)CC(C)C)c2)N(C)C)cc1 ZINC000064772012 851981362 /nfs/dbraw/zinc/98/13/62/851981362.db2.gz GCHAMIUWIYFLFP-QHCPKHFHSA-N 0 3 424.589 4.336 20 0 HIADHN COCCOc1ccc(CNC(=O)CN2CCC[C@H]2c2cccc3ccccc32)cc1 ZINC000064791892 851985843 /nfs/dbraw/zinc/98/58/43/851985843.db2.gz YNXILZLVPYBLAA-VWLOTQADSA-N 0 3 418.537 4.318 20 0 HIADHN O=C(CN(C1CC1)C1CCCC1)Nc1ccccc1C(=O)Nc1ccc2c(c1)OCO2 ZINC000064808321 851989280 /nfs/dbraw/zinc/98/92/80/851989280.db2.gz PWLOMCNSHFALKX-UHFFFAOYSA-N 0 3 421.497 4.013 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)NCCc2ccc(C(F)(F)F)cc2)C1 ZINC000065029071 852043561 /nfs/dbraw/zinc/04/35/61/852043561.db2.gz GBDLJXZQQKBECB-JXFKEZNVSA-N 0 3 405.464 4.383 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Cc1cccc(OC)c1)c1ccc(C(F)(F)F)cc1 ZINC000065121951 852072138 /nfs/dbraw/zinc/07/21/38/852072138.db2.gz NNZIPHDCTLSRLK-FQEVSTJZSA-N 0 3 408.464 4.456 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)c2cccc(OCc3cccnc3)c2)C1 ZINC000065140343 852076196 /nfs/dbraw/zinc/07/61/96/852076196.db2.gz KXEUIAZRDQUGAP-WMZHIEFXSA-N 0 3 401.510 4.226 20 0 HIADHN CN(C(=O)[C@@H]1CCN(Cc2ccc(N(C)c3ccccc3)nc2)C1)c1ccccc1 ZINC000437129330 862319282 /nfs/dbraw/zinc/31/92/82/862319282.db2.gz ZLQIXMMPLRQTOP-OAQYLSRUSA-N 0 3 400.526 4.334 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2cc3c(cc2Cl)OCCCO3)N(C)C)cc1 ZINC000065359827 852113302 /nfs/dbraw/zinc/11/33/02/852113302.db2.gz WOEBFLQQTGDKQF-GOSISDBHSA-N 0 3 403.910 4.234 20 0 HIADHN O=C(Nc1cc2c(cc1Cl)OCCCO2)N1CCN(CC2CCCCC2)CC1 ZINC000065359821 852113460 /nfs/dbraw/zinc/11/34/60/852113460.db2.gz ZFQGICDMVNQMEX-UHFFFAOYSA-N 0 3 407.942 4.231 20 0 HIADHN Cc1cc(N2CCSCC2)ccc1NC(=O)NCCCN1CCc2ccccc2C1 ZINC000065378219 852117705 /nfs/dbraw/zinc/11/77/05/852117705.db2.gz LQGHRNLQEYRFQZ-UHFFFAOYSA-N 0 3 424.614 4.118 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)NCCc1c[nH]c2cc(F)ccc12 ZINC000065387822 852120410 /nfs/dbraw/zinc/12/04/10/852120410.db2.gz RBIWTKFMIGCNMH-UHFFFAOYSA-N 0 3 416.928 4.276 20 0 HIADHN CCCNC(=O)c1ccc(NC(=O)N2CCN(CC3CCCCC3)CC2)cc1Cl ZINC000065416229 852124821 /nfs/dbraw/zinc/12/48/21/852124821.db2.gz GNNUDRQCJHABLC-UHFFFAOYSA-N 0 3 420.985 4.210 20 0 HIADHN CC[C@@H](C)NC(=O)c1ccc(NC(=O)N2CCN(CC3CCCCC3)CC2)c(C)c1 ZINC000065419761 852126959 /nfs/dbraw/zinc/12/69/59/852126959.db2.gz QLEVMWJLXHQCHS-LJQANCHMSA-N 0 3 414.594 4.253 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)Nc2cccc(Cl)c2-n2cccn2)C1 ZINC000065449764 852137469 /nfs/dbraw/zinc/13/74/69/852137469.db2.gz UQFGBGVLMQMYIB-AEFFLSMTSA-N 0 3 409.921 4.483 20 0 HIADHN CC[C@@H](C)NC(=O)c1ccc(NC(=O)NC[C@@H](c2ccsc2)N(CC)CC)cc1 ZINC000065458239 852141562 /nfs/dbraw/zinc/14/15/62/852141562.db2.gz GXXYOBHOHAHUJZ-UZLBHIALSA-N 0 3 416.591 4.481 20 0 HIADHN Cc1ccc([C@H](CNC(=O)NCc2cccc(COCc3ccco3)c2)N(C)C)cc1 ZINC000065469580 852144920 /nfs/dbraw/zinc/14/49/20/852144920.db2.gz LKZQZWYRISVDIW-DEOSSOPVSA-N 0 3 421.541 4.407 20 0 HIADHN CN(CCCCNC(=O)NC[C@H](c1cccs1)N1CCCC1)c1ccccc1 ZINC000065489860 852157203 /nfs/dbraw/zinc/15/72/03/852157203.db2.gz ZINVYRRPEHUNHD-HXUWFJFHSA-N 0 3 400.592 4.101 20 0 HIADHN O=C(Cc1csc(Cc2ccc(F)cc2)n1)NC[C@H](c1ccccc1)N1CCCC1 ZINC000065534595 852170519 /nfs/dbraw/zinc/17/05/19/852170519.db2.gz XMFXNAZFZFLZCY-JOCHJYFZSA-N 0 3 423.557 4.369 20 0 HIADHN C[C@@H]1CCCN(C(C)(C)CNC(=O)N2CCC(C(=O)c3ccc(Cl)cc3)CC2)C1 ZINC000065549289 852174452 /nfs/dbraw/zinc/17/44/52/852174452.db2.gz XNWHSBZBTQNFEC-QGZVFWFLSA-N 0 3 419.997 4.455 20 0 HIADHN CCOCCOCc1cccc(NC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)c1 ZINC000065872460 852294874 /nfs/dbraw/zinc/29/48/74/852294874.db2.gz ROVVGDNIZVUORA-NRFANRHFSA-N 0 3 414.521 4.230 20 0 HIADHN Cc1cc(C)cc(CNCc2ccnc(N3CCN(c4ccc(F)cc4)CC3)c2)c1 ZINC000065932238 852321768 /nfs/dbraw/zinc/32/17/68/852321768.db2.gz KTPBTARFMIAIGG-UHFFFAOYSA-N 0 3 404.533 4.454 20 0 HIADHN COc1cc(CNCc2ccccc2N2CCOCC2)ccc1OCc1cccs1 ZINC000065934823 852323339 /nfs/dbraw/zinc/32/33/39/852323339.db2.gz HOAQANSCUYPTIV-UHFFFAOYSA-N 0 3 424.566 4.462 20 0 HIADHN COc1ccc2oc(C)c(C(=O)N(CCN(C)C)Cc3ccc(F)cc3F)c2c1 ZINC000065937551 852326159 /nfs/dbraw/zinc/32/61/59/852326159.db2.gz ZCPFJGCBHYAJPB-UHFFFAOYSA-N 0 3 402.441 4.232 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)c1ccnc(OCc2ccccc2)c1 ZINC000065939293 852328178 /nfs/dbraw/zinc/32/81/78/852328178.db2.gz GUZIWJJXJOFKQA-UHFFFAOYSA-N 0 3 407.489 4.004 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)c1ccc(OCC(F)(F)F)cc1 ZINC000065938606 852328293 /nfs/dbraw/zinc/32/82/93/852328293.db2.gz RDWZPUZLHHTCQH-UHFFFAOYSA-N 0 3 416.390 4.110 20 0 HIADHN O=C(Nc1ccccc1)NC1CCN(Cc2ccc(OCc3ccccn3)cc2)CC1 ZINC000065952390 852332412 /nfs/dbraw/zinc/33/24/12/852332412.db2.gz RCNCHNQPQKMIOE-UHFFFAOYSA-N 0 3 416.525 4.447 20 0 HIADHN COc1cc(CNCC(=O)N2CCCc3ccccc32)c(-c2ccccc2)cc1OC ZINC000065976783 852337468 /nfs/dbraw/zinc/33/74/68/852337468.db2.gz ZVZXAHCRMZKVBF-UHFFFAOYSA-N 0 3 416.521 4.440 20 0 HIADHN O=C(c1ccc(CNCc2ccc(OCc3ccccn3)cc2)cc1)N1CCCC1 ZINC000065980768 852338608 /nfs/dbraw/zinc/33/86/08/852338608.db2.gz MQQZZRMLKLWTLV-UHFFFAOYSA-N 0 3 401.510 4.186 20 0 HIADHN Cc1ccc(C(=O)C2CCN(C(=O)C3CCN(Cc4ccccc4)CC3)CC2)cc1 ZINC000065992111 852344625 /nfs/dbraw/zinc/34/46/25/852344625.db2.gz SJNAZCQKXYWOIW-UHFFFAOYSA-N 0 3 404.554 4.329 20 0 HIADHN Cc1ccccc1C(=O)N[C@@H](CC(C)C)C(=O)NC[C@H](c1ccccc1)N1CCCC1 ZINC000069251082 852390074 /nfs/dbraw/zinc/39/00/74/852390074.db2.gz SHLYXCMITZGMNX-BJKOFHAPSA-N 0 3 421.585 4.093 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2C(=O)NC[C@H](c2ccccc2)N(C)C)o1 ZINC000069344211 852393494 /nfs/dbraw/zinc/39/34/94/852393494.db2.gz NURWOORKRDAAMW-JOCHJYFZSA-N 0 3 414.509 4.473 20 0 HIADHN CCN(CC)CCN(Cc1cccs1)S(=O)(=O)c1ccc(F)cc1Cl ZINC000071849094 852417811 /nfs/dbraw/zinc/41/78/11/852417811.db2.gz BBHMVLSZICWFFM-UHFFFAOYSA-N 0 3 404.960 4.073 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)N2CCC[C@H]2c2ccc3c(c2)OCCO3)N(C)C)cc1 ZINC000071923235 852432241 /nfs/dbraw/zinc/43/22/41/852432241.db2.gz AJJRWUMASWKZDC-FCHUYYIVSA-N 0 3 423.557 4.170 20 0 HIADHN Cc1nn(-c2cccc(Cl)c2)c(Cl)c1CNCCCN(C)CC(F)(F)F ZINC000071947091 852441697 /nfs/dbraw/zinc/44/16/97/852441697.db2.gz DRVXIEVNTAJKNO-UHFFFAOYSA-N 0 3 409.283 4.461 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)Cc3c(C)nc4ccccc4c3C)cc2)CC1 ZINC000071956399 852445233 /nfs/dbraw/zinc/44/52/33/852445233.db2.gz NZNBBQBMVYTVES-UHFFFAOYSA-N 0 3 416.569 4.170 20 0 HIADHN CC(C)C(=O)Nc1ccc(C(=O)NC[C@@H](c2ccccc2)N2CCC(C)CC2)cc1 ZINC000072007043 852462053 /nfs/dbraw/zinc/46/20/53/852462053.db2.gz DERCLGMTQJTEST-QHCPKHFHSA-N 0 3 407.558 4.484 20 0 HIADHN CC[C@@H](CC(=O)N1CCC[C@@H](CN2CCN(c3ccccn3)CC2)C1)c1ccccc1 ZINC000078414350 852514273 /nfs/dbraw/zinc/51/42/73/852514273.db2.gz DVAMODVHRXQQJZ-GOTSBHOMSA-N 0 3 420.601 4.026 20 0 HIADHN CCN1CCCN(C(=O)c2cn(-c3ccc(F)cc3)nc2-c2ccc(C)cc2)CC1 ZINC000078778785 852530144 /nfs/dbraw/zinc/53/01/44/852530144.db2.gz OCFWUBAFMLGDDH-UHFFFAOYSA-N 0 3 406.505 4.155 20 0 HIADHN Cc1csc(C2(NC(=O)c3ccc(N4CCN(C(C)C)CC4)cc3)CCCC2)n1 ZINC000079033694 852538463 /nfs/dbraw/zinc/53/84/63/852538463.db2.gz KTHXCBWMMQMPAN-UHFFFAOYSA-N 0 3 412.603 4.181 20 0 HIADHN C[C@@H](NC(=O)N[C@@H](CN1CCCC1)c1ccccc1)c1ccc(OC(F)F)cc1 ZINC000097204865 852588466 /nfs/dbraw/zinc/58/84/66/852588466.db2.gz ZIRSSAWPGMMPTN-UZLBHIALSA-N 0 3 403.473 4.485 20 0 HIADHN O=C(C[C@@H](c1ccccc1)C(F)(F)F)NCC1(N2CCSCC2)CCCC1 ZINC000097547166 852626468 /nfs/dbraw/zinc/62/64/68/852626468.db2.gz XECDHQCEHMREDH-KRWDZBQOSA-N 0 3 400.510 4.200 20 0 HIADHN O=C(CSc1ccccc1)NC1CCN(CCOc2ccc(Cl)cc2)CC1 ZINC000097589419 852638072 /nfs/dbraw/zinc/63/80/72/852638072.db2.gz MZOYTXMDSHXCFM-UHFFFAOYSA-N 0 3 404.963 4.092 20 0 HIADHN CC(C)c1c(C(=O)NC[C@@H](Cc2ccccc2)N(C)C)cnn1-c1ccc(F)cc1 ZINC000105867817 852734533 /nfs/dbraw/zinc/73/45/33/852734533.db2.gz AXXVHGURKIUCKE-OAQYLSRUSA-N 0 3 408.521 4.038 20 0 HIADHN CC1CCN([C@@H](CNC(=O)NCc2cnn(-c3ccccc3)c2)c2cccs2)CC1 ZINC000107695619 852787309 /nfs/dbraw/zinc/78/73/09/852787309.db2.gz KICKHHIWCYWBKL-NRFANRHFSA-N 0 3 423.586 4.206 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)NCCc1ccc(C(F)(F)F)cc1 ZINC000108405719 852846922 /nfs/dbraw/zinc/84/69/22/852846922.db2.gz IEFNSBWMMWKOEH-UHFFFAOYSA-N 0 3 411.443 4.160 20 0 HIADHN CCN1CCN(Cc2ccc(CNC(=O)c3oc4c(cccc4C)c3C)cc2)CC1 ZINC000108787535 852880128 /nfs/dbraw/zinc/88/01/28/852880128.db2.gz LMZMZMDBVOBYOB-UHFFFAOYSA-N 0 3 405.542 4.117 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)c2cccc(OCc3cscn3)c2)C1 ZINC000108817924 852882275 /nfs/dbraw/zinc/88/22/75/852882275.db2.gz SRDOVEOYYDZASV-XLIONFOSSA-N 0 3 407.539 4.287 20 0 HIADHN COc1ccc(-c2nc(C(=O)N(CCN(C)C)Cc3cccc(F)c3)cs2)cc1 ZINC000109358503 852958030 /nfs/dbraw/zinc/95/80/30/852958030.db2.gz IRCLMQNFIYGGPS-UHFFFAOYSA-N 0 3 413.518 4.162 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)c1ccc(-n2cccn2)cc1 ZINC000109357813 852958156 /nfs/dbraw/zinc/95/81/56/852958156.db2.gz YTBKSFLPWDZBCO-UHFFFAOYSA-N 0 3 416.447 4.095 20 0 HIADHN CC(=O)c1cccc(O[C@@H](C)C(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)c1 ZINC000109366398 852959722 /nfs/dbraw/zinc/95/97/22/852959722.db2.gz ZOBAFQZYOHLFFV-RXVVDRJESA-N 0 3 414.571 4.307 20 0 HIADHN O=C(N[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(N2CCc3ccccc3C2)cc1 ZINC000109416053 852967556 /nfs/dbraw/zinc/96/75/56/852967556.db2.gz NFBWNHQSDSJYDA-RUZDIDTESA-N 0 3 411.549 4.254 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2cc(F)cc3nc(C)c(C)nc32)N2CCCC2)cc1 ZINC000109504632 852978069 /nfs/dbraw/zinc/97/80/69/852978069.db2.gz IKNQCWZGQMTGMX-JOCHJYFZSA-N 0 3 406.505 4.261 20 0 HIADHN Cc1nc2c(cnn2C(C)C)cc1C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000109500656 852978225 /nfs/dbraw/zinc/97/82/25/852978225.db2.gz SVLCFIUJMUWOGQ-UHFFFAOYSA-N 0 3 423.586 4.164 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)[C@H]1C[C@@H]1c1cccc(Br)c1 ZINC000109566224 852985763 /nfs/dbraw/zinc/98/57/63/852985763.db2.gz WKJXVZRHVSTFOY-MOPGFXCFSA-N 0 3 419.338 4.282 20 0 HIADHN O=C(NC[C@@H]1CCCN(Cc2cccs2)C1)c1ccn(-c2cccc(Cl)c2)n1 ZINC000109563993 852986185 /nfs/dbraw/zinc/98/61/85/852986185.db2.gz ODJHNZHONLOQPA-INIZCTEOSA-N 0 3 414.962 4.229 20 0 HIADHN O=C(NC[C@H]1CCCN(Cc2cccs2)C1)c1ccn(-c2cccc(Cl)c2)n1 ZINC000109563994 852986310 /nfs/dbraw/zinc/98/63/10/852986310.db2.gz ODJHNZHONLOQPA-MRXNPFEDSA-N 0 3 414.962 4.229 20 0 HIADHN CCC[C@@H](C(=O)N1CCC[C@@H](CN2CCN(c3ccccn3)CC2)C1)c1ccccc1 ZINC000109649672 852994694 /nfs/dbraw/zinc/99/46/94/852994694.db2.gz ZXIFTAKHJLOXFW-LADGPHEKSA-N 0 3 420.601 4.026 20 0 HIADHN CN(C(=O)c1ccc(F)c(C(F)(F)F)c1)C1CCN(CCc2ccccn2)CC1 ZINC000109809687 853018300 /nfs/dbraw/zinc/01/83/00/853018300.db2.gz VPNAMWQDIFDYJN-UHFFFAOYSA-N 0 3 409.427 4.019 20 0 HIADHN CCN1CCC[C@@H]1CNC(=O)c1oc2ccccc2c1CSc1nnc(C)s1 ZINC000109827875 853019721 /nfs/dbraw/zinc/01/97/21/853019721.db2.gz KZEZNVNKZFWRCB-CQSZACIVSA-N 0 3 416.572 4.099 20 0 HIADHN O=C(NCCc1cc(F)cc(F)c1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000110107269 853060785 /nfs/dbraw/zinc/06/07/85/853060785.db2.gz KOJWWOPBGMCKFG-FQEVSTJZSA-N 0 3 412.402 4.078 20 0 HIADHN CCCN(CC(=O)Nc1ccc(CC)cc1)C1CCN(C(=O)c2ccccc2)CC1 ZINC000110287262 853083595 /nfs/dbraw/zinc/08/35/95/853083595.db2.gz LDYHPVPWDZQMKP-UHFFFAOYSA-N 0 3 407.558 4.204 20 0 HIADHN CCNC(=O)c1cccc(NC(=O)CNC(CC)(CC)c2ccc(Cl)cc2)c1 ZINC000110331003 853088273 /nfs/dbraw/zinc/08/82/73/853088273.db2.gz JVKMJBULOXOZSM-UHFFFAOYSA-N 0 3 401.938 4.333 20 0 HIADHN CCC(CC)(NCC(=O)Nc1ccc(N2CCOCC2)cc1)c1ccc(Cl)cc1 ZINC000110338348 853089080 /nfs/dbraw/zinc/08/90/80/853089080.db2.gz WUKYDPRUQQKPJN-UHFFFAOYSA-N 0 3 415.965 4.420 20 0 HIADHN C[C@@H](Sc1ccccc1Cl)C(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000110413478 853096678 /nfs/dbraw/zinc/09/66/78/853096678.db2.gz WUTQPLYRQPSLPO-BRWVUGGUSA-N 0 3 411.011 4.168 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)c3ccccc3COc3ccccc3)CC2)C[C@@H](C)O1 ZINC000110410083 853096859 /nfs/dbraw/zinc/09/68/59/853096859.db2.gz HWHMDHBXIDXKAD-NHCUHLMSSA-N 0 3 422.569 4.227 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)c3ccccc3CCc3ccccc3)CC2)C[C@H](C)O1 ZINC000110414414 853097763 /nfs/dbraw/zinc/09/77/63/853097763.db2.gz IXESRRFURUIGJF-SZPZYZBQSA-N 0 3 420.597 4.433 20 0 HIADHN CCCn1c(SC[C@H](O)CN(C)Cc2ccccc2)nnc1-c1cccc(C)c1 ZINC000110437310 853100391 /nfs/dbraw/zinc/10/03/91/853100391.db2.gz WEGJTCWAEBMWSE-OAQYLSRUSA-N 0 3 410.587 4.249 20 0 HIADHN C[C@@H](Sc1ccc(Cl)cc1)C(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000110456397 853102254 /nfs/dbraw/zinc/10/22/54/853102254.db2.gz OTPQADYYPKXQKG-IXDOHACOSA-N 0 3 411.011 4.168 20 0 HIADHN Fc1ccc(-c2noc([C@H]3CCCN(CCOCCOc4ccccc4)C3)n2)cc1 ZINC000110472507 853104359 /nfs/dbraw/zinc/10/43/59/853104359.db2.gz AFFWHAHLBIXBTB-IBGZPJMESA-N 0 3 411.477 4.151 20 0 HIADHN Cc1cc(NC(=O)c2ccccc2Cl)sc1C(=O)N1CC[C@@H](N2CCCC2)C1 ZINC000110522158 853112683 /nfs/dbraw/zinc/11/26/83/853112683.db2.gz LIQCUSZVLSWMNS-OAHLLOKOSA-N 0 3 417.962 4.273 20 0 HIADHN Cc1cc(NC(=O)c2ccccc2Cl)sc1C(=O)N1CC[C@H](N2CCCC2)C1 ZINC000110522155 853112729 /nfs/dbraw/zinc/11/27/29/853112729.db2.gz LIQCUSZVLSWMNS-HNNXBMFYSA-N 0 3 417.962 4.273 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3ccccc3N3CCCCC3)CC2)C[C@H](C)O1 ZINC000110720089 853143812 /nfs/dbraw/zinc/14/38/12/853143812.db2.gz FWNSGARLCHBOJK-BGYRXZFFSA-N 0 3 414.594 4.030 20 0 HIADHN Cc1cc(Br)ccc1NC(=O)N1CCC(CN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000110718392 853144177 /nfs/dbraw/zinc/14/41/77/853144177.db2.gz WCMYPSOGJQRJAD-HOTGVXAUSA-N 0 3 424.383 4.111 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2[nH]nc(C(C)C)c2Br)N2CCCC2)cc1 ZINC000111151780 853211612 /nfs/dbraw/zinc/21/16/12/853211612.db2.gz FZSXNNDMRZXVAE-MRXNPFEDSA-N 0 3 419.367 4.171 20 0 HIADHN CCN1CCN(Cc2ccccc2CNc2nc(C(F)F)nc3ccccc32)CC1 ZINC000111193037 853219290 /nfs/dbraw/zinc/21/92/90/853219290.db2.gz SYDDZQPLKDWDCI-UHFFFAOYSA-N 0 3 411.500 4.317 20 0 HIADHN C[C@@H](NC(=O)OC(C)(C)C)[C@H]1CCCCN1Cc1ccc(C(=O)N2CCCC2)cc1 ZINC000116498353 853309364 /nfs/dbraw/zinc/30/93/64/853309364.db2.gz WGACGBHUMDXMOG-WIYYLYMNSA-N 0 3 415.578 4.190 20 0 HIADHN O=C(NC1CCN(Cc2ccc(OCc3ccccn3)cc2)CC1)c1ccccc1 ZINC000139197786 853404729 /nfs/dbraw/zinc/40/47/29/853404729.db2.gz SATIUHXPYWEEKJ-UHFFFAOYSA-N 0 3 401.510 4.055 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2ccc(N3CCCC3=O)cc2)N2CCCC2)cc1 ZINC000139240059 853406014 /nfs/dbraw/zinc/40/60/14/853406014.db2.gz FFINMOSXNFNKND-JOCHJYFZSA-N 0 3 406.530 4.080 20 0 HIADHN Fc1ccccc1COc1cccc(CNCc2ccccc2Cn2cncn2)c1 ZINC000139495834 853412366 /nfs/dbraw/zinc/41/23/66/853412366.db2.gz QFXMMTXNFCMBPE-UHFFFAOYSA-N 0 3 402.473 4.334 20 0 HIADHN CCOC1CCN(C(=O)NC[C@H](c2ccc(C(F)(F)F)cc2)N(CC)CC)CC1 ZINC000139744662 853420681 /nfs/dbraw/zinc/42/06/81/853420681.db2.gz CWUABSSGOAFWHA-LJQANCHMSA-N 0 3 415.500 4.299 20 0 HIADHN Cc1c([O-])ccc2c(C[NH2+]CC3(c4cccc(Cl)c4)CCOCC3)cc(=O)oc12 ZINC000140189192 853437502 /nfs/dbraw/zinc/43/75/02/853437502.db2.gz WDFSSFPRGLFUTG-UHFFFAOYSA-N 0 3 413.901 4.298 20 0 HIADHN CC(=O)Nc1cccc([C@@H](C)NC(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)c1 ZINC000141738573 853479302 /nfs/dbraw/zinc/47/93/02/853479302.db2.gz BFYDLKDIGWXRGF-WZONZLPQSA-N 0 3 408.546 4.151 20 0 HIADHN C[C@@H](NCc1ccc(OCc2cccnc2)cc1)c1ccc(N2CCOC2=O)cc1 ZINC000142723592 853498921 /nfs/dbraw/zinc/49/89/21/853498921.db2.gz AMBJAQFWUPNGBV-GOSISDBHSA-N 0 3 403.482 4.468 20 0 HIADHN COc1cccc(C(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)c1OC(F)F ZINC000143156850 853509167 /nfs/dbraw/zinc/50/91/67/853509167.db2.gz PLYHLTLPIUFBDX-SFHVURJKSA-N 0 3 404.457 4.172 20 0 HIADHN S=C(N[C@@H](c1ccccc1)c1ccccn1)NC1CCN(Cc2ccccc2)CC1 ZINC000145489641 853551356 /nfs/dbraw/zinc/55/13/56/853551356.db2.gz SHXNCZGHELNYOL-DEOSSOPVSA-N 0 3 416.594 4.300 20 0 HIADHN CCCN(C(=O)C(=O)Nc1cccc(CN(C)C)c1)[C@H](C)c1cc2ccccc2o1 ZINC000146463492 853570667 /nfs/dbraw/zinc/57/06/67/853570667.db2.gz ZDSYUROBRJDNAY-QGZVFWFLSA-N 0 3 407.514 4.433 20 0 HIADHN Cc1cc(C(=O)C(C#N)C(=O)Nc2ccc(SC(F)F)cc2)cc([N+](=O)[O-])c1 ZINC000146871155 853577771 /nfs/dbraw/zinc/57/77/71/853577771.db2.gz BFSKYOGENXZDNX-HNNXBMFYSA-N 0 3 405.382 4.179 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3nc(C(F)(F)F)cs3)c(C)c2)CC1 ZINC000147402290 853587827 /nfs/dbraw/zinc/58/78/27/853587827.db2.gz NIGUULWPCVYXNH-UHFFFAOYSA-N 0 3 413.469 4.256 20 0 HIADHN CCCC(=O)Nc1cccc(NC(=O)NCC2(N3CCSCC3)CCCC2)c1C ZINC000148126810 853600700 /nfs/dbraw/zinc/60/07/00/853600700.db2.gz HISKCEJARQSMDE-UHFFFAOYSA-N 0 3 418.607 4.217 20 0 HIADHN COc1ccc2cc(CNCc3ccc(C(=O)N4C[C@H](C)O[C@@H](C)C4)cc3)ccc2c1 ZINC000165966605 853654239 /nfs/dbraw/zinc/65/42/39/853654239.db2.gz KWXFFLVABOKESJ-OALUTQOASA-N 0 3 418.537 4.388 20 0 HIADHN O=C(NCCCCN1CCN(Cc2ccccc2)CC1)c1csc2ccccc12 ZINC000195551343 853679448 /nfs/dbraw/zinc/67/94/48/853679448.db2.gz SQVFYCPQCKJLSD-UHFFFAOYSA-N 0 3 407.583 4.229 20 0 HIADHN C[C@@H]1CCCC[C@H]1N(C)C(=O)CNC1(c2ccc(Br)cc2)CCOCC1 ZINC000195600969 853706590 /nfs/dbraw/zinc/70/65/90/853706590.db2.gz RFMRSQGUYJSDLU-VQIMIIECSA-N 0 3 423.395 4.082 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(I)cc1)c1ccc(NC(N)=O)cc1 ZINC000195616690 853716494 /nfs/dbraw/zinc/71/64/94/853716494.db2.gz CVTUDELVNAKWNL-NWDGAFQWSA-N 0 3 409.271 4.194 20 0 HIADHN Cc1nc(COc2ccc(F)cc2)sc1C(=O)N[C@H](C)CN1C[C@H](C)C[C@H](C)C1 ZINC000195625541 853722509 /nfs/dbraw/zinc/72/25/09/853722509.db2.gz CYMJHEAAKCXRTN-OWCLPIDISA-N 0 3 419.566 4.266 20 0 HIADHN COc1cccc([C@@H](CNC(=O)N[C@H]2CCc3c2cccc3Cl)N2CCCC2)c1 ZINC000195637240 853729687 /nfs/dbraw/zinc/72/96/87/853729687.db2.gz HCAINUJFNSCEEI-FCHUYYIVSA-N 0 3 413.949 4.472 20 0 HIADHN O=C(NC[C@@H]1CCCO[C@@H]1c1ccccc1)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000195660492 853742307 /nfs/dbraw/zinc/74/23/07/853742307.db2.gz MVSXEFGARZTYNS-KMDXXIMOSA-N 0 3 407.558 4.291 20 0 HIADHN Cc1ccccc1OC[C@@H](O)CN[C@@H](C)c1cccc(NC(=O)c2ccccc2)c1 ZINC000195662316 853744445 /nfs/dbraw/zinc/74/44/45/853744445.db2.gz IAKSDTANHGWULX-CVDCTZTESA-N 0 3 404.510 4.338 20 0 HIADHN Cc1cc2oc(=O)cc(CN3CCC(C(=O)N4CCc5ccccc54)CC3)c2cc1C ZINC000195685594 853757677 /nfs/dbraw/zinc/75/76/77/853757677.db2.gz ZCALHJYYOZGPMY-UHFFFAOYSA-N 0 3 416.521 4.211 20 0 HIADHN Cc1ccc([C@H](CNC(=O)NCc2ccccc2OCC(F)(F)F)N(C)C)cc1 ZINC000195720486 853777558 /nfs/dbraw/zinc/77/75/58/853777558.db2.gz LIHNUSZOBUNUTO-SFHVURJKSA-N 0 3 409.452 4.038 20 0 HIADHN O=S(=O)(/C=C\c1ccc(Cl)cc1)NCc1ccccc1CN1CCCCC1 ZINC000212877882 853823104 /nfs/dbraw/zinc/82/31/04/853823104.db2.gz KOXUGBCBLSBJBY-QINSGFPZSA-N 0 3 404.963 4.416 20 0 HIADHN Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000216330302 853850207 /nfs/dbraw/zinc/85/02/07/853850207.db2.gz DFRWJQJHJZBMOD-OAQYLSRUSA-N 0 3 423.532 4.221 20 0 HIADHN Cc1nn(Cc2ccc(Cl)cc2)c2sc(C(=O)N(C)C3CCN(C)CC3)cc12 ZINC000216538234 853855297 /nfs/dbraw/zinc/85/52/97/853855297.db2.gz VQWLHEQXYAJAFP-UHFFFAOYSA-N 0 3 416.978 4.274 20 0 HIADHN CN(C)Cc1ccccc1NC(=O)c1ccc(I)c(Cl)c1 ZINC000226776472 853882694 /nfs/dbraw/zinc/88/26/94/853882694.db2.gz BFMQHDQXYUZGDE-UHFFFAOYSA-N 0 3 414.674 4.259 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)CCc2ncc(-c3ccccc3F)o2)C1 ZINC000227382723 853886281 /nfs/dbraw/zinc/88/62/81/853886281.db2.gz SLGRPKODHWTOPM-IEBWSBKVSA-N 0 3 407.489 4.365 20 0 HIADHN c1cnn(Cc2cccc(CNCc3cn(-c4ccccc4)nc3-c3cccnc3)c2)c1 ZINC000236583380 853899500 /nfs/dbraw/zinc/89/95/00/853899500.db2.gz PJDAXQQWXGVYDE-UHFFFAOYSA-N 0 3 420.520 4.469 20 0 HIADHN c1cn(-c2ccc(CNCc3cn(-c4ccccc4)nc3-c3cccnc3)cc2)cn1 ZINC000236583267 853899533 /nfs/dbraw/zinc/89/95/33/853899533.db2.gz CUEHZHYNRVZVIS-UHFFFAOYSA-N 0 3 406.493 4.410 20 0 HIADHN CC(C)(C)[S@@](=O)CCNCc1ccc(OC(F)(F)[C@H](F)C(F)(F)F)cc1 ZINC000236733361 853917580 /nfs/dbraw/zinc/91/75/80/853917580.db2.gz CWQDDWCEJRNAGZ-SRGMZFCMSA-N 0 3 405.404 4.195 20 0 HIADHN CC(C)(C)OC(=O)c1ccc(CNCc2c[nH]nc2-c2ccc3c(c2)OCCO3)cc1 ZINC000236811347 853925927 /nfs/dbraw/zinc/92/59/27/853925927.db2.gz BNNNLEWCSBPATK-UHFFFAOYSA-N 0 3 421.497 4.093 20 0 HIADHN CC(C)c1nn(C)c(Cl)c1CNC[C@H](c1cccc(Cl)c1)N1CCOCC1 ZINC000236846499 853929035 /nfs/dbraw/zinc/92/90/35/853929035.db2.gz TYJPCGDCLLCZNE-GOSISDBHSA-N 0 3 411.377 4.013 20 0 HIADHN CCOc1cc(CNCc2ccccc2N2CCOCC2)ccc1OCC(F)(F)F ZINC000236860928 853930016 /nfs/dbraw/zinc/93/00/16/853930016.db2.gz BEYKRYCXXRTTOP-UHFFFAOYSA-N 0 3 424.463 4.153 20 0 HIADHN CCOc1c(OC)cc(CNC[C@H](O)c2c(Cl)cccc2Cl)cc1OC ZINC000236864100 853930121 /nfs/dbraw/zinc/93/01/21/853930121.db2.gz QAURFRUNPILLJW-HNNXBMFYSA-N 0 3 400.302 4.233 20 0 HIADHN CCOc1cc(CN[C@@H](C)c2ccc(-n3cncn3)cc2)ccc1OCC(F)(F)F ZINC000236882448 853932254 /nfs/dbraw/zinc/93/22/54/853932254.db2.gz CGADLTJMHZWEPH-HNNXBMFYSA-N 0 3 420.435 4.458 20 0 HIADHN CC[C@H](NCc1ccc(OCc2c(C)noc2C)c(OC)c1)c1c(C)nn(C)c1C ZINC000236961125 853943407 /nfs/dbraw/zinc/94/34/07/853943407.db2.gz JXEKMAOUGVEFMI-FQEVSTJZSA-N 0 3 412.534 4.470 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@@H](C)NCc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000236980604 853946036 /nfs/dbraw/zinc/94/60/36/853946036.db2.gz ZEOIZOKJJSEVDL-OAHLLOKOSA-N 0 3 420.916 4.380 20 0 HIADHN CCN(CC)c1ncc(CN[C@H](C)c2cc(F)ccc2N2CCN(CC)CC2)s1 ZINC000236983083 853947231 /nfs/dbraw/zinc/94/72/31/853947231.db2.gz VVSAWGKOQHHIEE-QGZVFWFLSA-N 0 3 419.614 4.121 20 0 HIADHN CCOCc1ccccc1CNCc1cc(Br)c2c(c1)OCCCO2 ZINC000236991697 853948541 /nfs/dbraw/zinc/94/85/41/853948541.db2.gz WRMIANDEEHFARO-UHFFFAOYSA-N 0 3 406.320 4.437 20 0 HIADHN CCOc1ccc(CNCc2ccc(N(C)C(=O)c3ccncc3)cc2)cc1OC ZINC000237000385 853949387 /nfs/dbraw/zinc/94/93/87/853949387.db2.gz XINLLZFXHGMYKE-UHFFFAOYSA-N 0 3 405.498 4.055 20 0 HIADHN CCS(=O)(=O)C[C@H](C)NCc1ccc(-c2ccc(Br)cc2)s1 ZINC000237011455 853951509 /nfs/dbraw/zinc/95/15/09/853951509.db2.gz SBBMGHZEDQTUAT-LBPRGKRZSA-N 0 3 402.379 4.090 20 0 HIADHN CC[C@@H](C#N)Oc1cc(CNCc2ccc(OC)c(Br)c2)ccc1OC ZINC000237019687 853952645 /nfs/dbraw/zinc/95/26/45/853952645.db2.gz ACGPQCRMSJXLKP-INIZCTEOSA-N 0 3 419.319 4.437 20 0 HIADHN CCc1nn(C)c(Cl)c1CNC[C@@H]1CCN(c2ccc(Br)cc2)C1 ZINC000237062051 853958527 /nfs/dbraw/zinc/95/85/27/853958527.db2.gz IGIOLRLLPMABRM-ZDUSSCGKSA-N 0 3 411.775 4.015 20 0 HIADHN CCc1nn(C)c(Cl)c1CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1 ZINC000237065853 853959082 /nfs/dbraw/zinc/95/90/82/853959082.db2.gz USSYLQIGIXBMOO-OAHLLOKOSA-N 0 3 400.876 4.019 20 0 HIADHN COc1cc(OC)c(OC)cc1CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1 ZINC000237079051 853961107 /nfs/dbraw/zinc/96/11/07/853961107.db2.gz HIHLHKDUIIHWQA-SFHVURJKSA-N 0 3 424.463 4.095 20 0 HIADHN CN(C(=O)c1ccncc1)c1ccc(CNCc2ccc(Br)s2)cc1 ZINC000237094028 853963185 /nfs/dbraw/zinc/96/31/85/853963185.db2.gz RUGOBUOFTYONPO-UHFFFAOYSA-N 0 3 416.344 4.472 20 0 HIADHN COc1ccccc1-c1ccc(CNCc2cccc(CN3CCOCC3)c2)cc1 ZINC000237098568 853963935 /nfs/dbraw/zinc/96/39/35/853963935.db2.gz QQEUADHPVXMEPG-UHFFFAOYSA-N 0 3 402.538 4.484 20 0 HIADHN CCc1oc2ccccc2c1CNCc1ccccc1CS(=O)(=O)NC(C)C ZINC000237095321 853964199 /nfs/dbraw/zinc/96/41/99/853964199.db2.gz LUTLORSCEFALIB-UHFFFAOYSA-N 0 3 400.544 4.113 20 0 HIADHN CCc1ccc(-c2nn(-c3ccccc3)cc2CNCC2(CS(C)(=O)=O)CC2)cc1 ZINC000237103306 853965638 /nfs/dbraw/zinc/96/56/38/853965638.db2.gz KCVFXQIGNYJHAE-UHFFFAOYSA-N 0 3 423.582 4.016 20 0 HIADHN COc1ccc(Br)cc1CNC[C@H](O)c1cccc(C(F)(F)F)c1 ZINC000237134691 853970693 /nfs/dbraw/zinc/97/06/93/853970693.db2.gz FREFBMQHBLSVEK-HNNXBMFYSA-N 0 3 404.226 4.300 20 0 HIADHN COc1cc(CNCCC(F)(F)F)ccc1OCC(=O)Nc1ccccc1Cl ZINC000237138001 853970796 /nfs/dbraw/zinc/97/07/96/853970796.db2.gz OMALMNAFXWJIBT-UHFFFAOYSA-N 0 3 416.827 4.408 20 0 HIADHN CN(CCC#N)c1ccc(CN[C@H](Cc2ccccc2)C(=O)Nc2ccccc2)cc1 ZINC000237209926 853983273 /nfs/dbraw/zinc/98/32/73/853983273.db2.gz IDOQLNNUFAHCQY-RUZDIDTESA-N 0 3 412.537 4.376 20 0 HIADHN COCCOc1ccc(CNCc2ccc(NC(=O)c3ccc(F)cc3)cc2)cc1 ZINC000237211038 853983531 /nfs/dbraw/zinc/98/35/31/853983531.db2.gz NJLXPVMAJYWFFS-UHFFFAOYSA-N 0 3 408.473 4.393 20 0 HIADHN CN1CCN(c2cccc(Cl)c2CNCc2cc(Br)cs2)CC1 ZINC000237235609 853987778 /nfs/dbraw/zinc/98/77/78/853987778.db2.gz ZPIAHVBWLKRQOF-UHFFFAOYSA-N 0 3 414.800 4.206 20 0 HIADHN COc1cc(CNCc2ccnc(N3CCCCC3)c2)ccc1OCc1ccncc1 ZINC000237287745 853998238 /nfs/dbraw/zinc/99/82/38/853998238.db2.gz KJFDDRIBORKGAO-UHFFFAOYSA-N 0 3 418.541 4.344 20 0 HIADHN COc1cccc(N2CC[C@@H](CNCc3csc(-c4ccc5c(c4)OCO5)n3)C2)c1 ZINC000237291023 853999522 /nfs/dbraw/zinc/99/95/22/853999522.db2.gz HSUKWUGBKUPCGC-INIZCTEOSA-N 0 3 423.538 4.164 20 0 HIADHN COc1ccc(OCc2nc(CN[C@@H]3C[C@@H](C)N(Cc4ccccc4)C3)cs2)cc1 ZINC000237308582 854003644 /nfs/dbraw/zinc/00/36/44/854003644.db2.gz LNOZRXQRQLNLIQ-UYAOXDASSA-N 0 3 423.582 4.483 20 0 HIADHN CSCC[C@H](N)C(=O)NC[C@H](c1c[nH]c2ccccc21)c1ccccc1Cl ZINC000237318230 854005598 /nfs/dbraw/zinc/00/55/98/854005598.db2.gz OBDRLBAWCFHNJU-LPHOPBHVSA-N 0 3 401.963 4.150 20 0 HIADHN COc1cc(CN[C@H](c2ccc(Cl)cc2)C2CCC2)cc(Cl)c1OCC(N)=O ZINC000237334931 854008485 /nfs/dbraw/zinc/00/84/85/854008485.db2.gz SJCJWSWILYVSJV-FQEVSTJZSA-N 0 3 423.340 4.497 20 0 HIADHN COc1ccc(OC)c(CCNCc2nc(-c3cccc(Br)c3)c[nH]2)c1 ZINC000237377079 854017275 /nfs/dbraw/zinc/01/72/75/854017275.db2.gz OFFNAAGRKGKVGQ-UHFFFAOYSA-N 0 3 416.319 4.189 20 0 HIADHN COc1cc(CN[C@H](C)c2ccc(-n3cncn3)cc2)ccc1OCC(F)(F)F ZINC000237394468 854021250 /nfs/dbraw/zinc/02/12/50/854021250.db2.gz JAJHSPWVZYABFU-CQSZACIVSA-N 0 3 406.408 4.068 20 0 HIADHN COc1ccc(OC)c(NC(=O)C[C@H](C)N[C@H](c2nc3ccccc3[nH]2)C(C)C)c1 ZINC000237402277 854024426 /nfs/dbraw/zinc/02/44/26/854024426.db2.gz UMHWZTHBIQJIRT-NYHFZMIOSA-N 0 3 410.518 4.284 20 0 HIADHN COc1cc(CNCc2c[nH]nc2-c2cccnc2)ccc1OCc1ccccc1 ZINC000237470247 854038708 /nfs/dbraw/zinc/03/87/08/854038708.db2.gz MZFWECDBCZSPMT-UHFFFAOYSA-N 0 3 400.482 4.349 20 0 HIADHN Cc1cc(CN[C@H](C)c2ccc(OCC(=O)NC3CC3)cc2)ccc1Br ZINC000237469555 854039306 /nfs/dbraw/zinc/03/93/06/854039306.db2.gz IEFBDRXRRIJCMF-OAHLLOKOSA-N 0 3 417.347 4.266 20 0 HIADHN C[C@H](CC(=O)Nc1ccccc1C(F)(F)F)NCc1cnn(Cc2ccccc2)c1 ZINC000237525360 854049419 /nfs/dbraw/zinc/04/94/19/854049419.db2.gz QRQDSHIDCAFVEU-MRXNPFEDSA-N 0 3 416.447 4.457 20 0 HIADHN Cc1nccn1-c1ccc(CNCC2=Cc3cc(Cl)cc(Cl)c3OC2)cn1 ZINC000237650428 854067678 /nfs/dbraw/zinc/06/76/78/854067678.db2.gz VOMVXWIDCPQMFH-UHFFFAOYSA-N 0 3 401.297 4.448 20 0 HIADHN FC(F)(F)c1ccn(-c2ccc(CNCc3ccc4c(c3)OCCCO4)cc2)n1 ZINC000237756816 854089840 /nfs/dbraw/zinc/08/98/40/854089840.db2.gz RZEIXJXIIVZKRU-UHFFFAOYSA-N 0 3 403.404 4.342 20 0 HIADHN Fc1ccc(CNC[C@H](c2ccc(C(F)(F)F)cc2)N2CCOCC2)c(F)c1 ZINC000237774892 854094703 /nfs/dbraw/zinc/09/47/03/854094703.db2.gz RHQJZDHPSNRPTH-LJQANCHMSA-N 0 3 400.391 4.147 20 0 HIADHN NC(=O)c1ccc(CNCc2cn(-c3ccccc3)nc2-c2ccc(F)cc2)cc1 ZINC000237778638 854095913 /nfs/dbraw/zinc/09/59/13/854095913.db2.gz BBKPIJVLKAMXNU-UHFFFAOYSA-N 0 3 400.457 4.067 20 0 HIADHN Cc1cccn2cc(COc3ccc(CN[C@H](C)C(=O)N4CCCC[C@@H]4C)cc3)nc12 ZINC000237782000 854095943 /nfs/dbraw/zinc/09/59/43/854095943.db2.gz LSJFPOUMVHRZHI-VQTJNVASSA-N 0 3 420.557 4.101 20 0 HIADHN C[C@H]1CN(Cc2ccccc2CNCc2cnn(-c3ccc(Cl)cc3)c2)C[C@H](C)O1 ZINC000237779099 854096365 /nfs/dbraw/zinc/09/63/65/854096365.db2.gz DQJZBABNLLZWSZ-OALUTQOASA-N 0 3 424.976 4.425 20 0 HIADHN Cc1nn(-c2cccc(C(F)(F)F)c2)c(Cl)c1CNC[C@H]1CCC[C@@H](O)C1 ZINC000237809914 854102033 /nfs/dbraw/zinc/10/20/33/854102033.db2.gz JGARQMRDQZQMIN-XJKSGUPXSA-N 0 3 401.860 4.494 20 0 HIADHN C#CCOc1ccc(Br)cc1CNCCc1nc(C(F)(F)F)cs1 ZINC000237855774 854108492 /nfs/dbraw/zinc/10/84/92/854108492.db2.gz OSLIDDYWSQDRDI-UHFFFAOYSA-N 0 3 419.266 4.269 20 0 HIADHN Cc1nn(Cc2c(Cl)cccc2Cl)c(Cl)c1CNC[C@@]1(O)CCSC1 ZINC000237875297 854112727 /nfs/dbraw/zinc/11/27/27/854112727.db2.gz RJTFEXLHRUIUQA-KRWDZBQOSA-N 0 3 420.793 4.158 20 0 HIADHN Cc1cc([C@@](C)(O)CNCc2cccc3c2N(C(=O)OC(C)(C)C)CC3)c(C)o1 ZINC000237877594 854112820 /nfs/dbraw/zinc/11/28/20/854112820.db2.gz BWFFQIXRMJDQTN-QHCPKHFHSA-N 0 3 400.519 4.191 20 0 HIADHN Cc1cn2c(CNCCOc3ncc(C(F)(F)F)cc3Cl)c(C)nc2s1 ZINC000237890644 854115807 /nfs/dbraw/zinc/11/58/07/854115807.db2.gz ROODZUKSOCPNJZ-UHFFFAOYSA-N 0 3 404.845 4.248 20 0 HIADHN NC(=O)Nc1ccc(CNCc2cn(Cc3ccccc3)nc2-c2cccs2)cc1 ZINC000237904307 854117812 /nfs/dbraw/zinc/11/78/12/854117812.db2.gz UIILWMWIWDBYQS-UHFFFAOYSA-N 0 3 417.538 4.440 20 0 HIADHN O=C(CC1CCCCC1)NCCNCc1cn(-c2ccccc2)nc1-c1cccnc1 ZINC000238124788 854145386 /nfs/dbraw/zinc/14/53/86/854145386.db2.gz MKBJTYRZXDWMIR-UHFFFAOYSA-N 0 3 417.557 4.111 20 0 HIADHN CC(C)n1ncc2c1nc(C1CC1)cc2C(=O)N(CCN(C)C)Cc1ccccc1 ZINC000248056654 854175635 /nfs/dbraw/zinc/17/56/35/854175635.db2.gz YGNUAFKTMWVPDI-UHFFFAOYSA-N 0 3 405.546 4.094 20 0 HIADHN O[C@H](COc1cccc2ccccc21)CN1CCC[C@H]1c1ccc2c(c1)OCCO2 ZINC000250507125 854194575 /nfs/dbraw/zinc/19/45/75/854194575.db2.gz MATOZGQGACRICZ-UNMCSNQZSA-N 0 3 405.494 4.188 20 0 HIADHN Cc1c(C(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)cnn1-c1cccc(Cl)c1 ZINC000250887682 854195421 /nfs/dbraw/zinc/19/54/21/854195421.db2.gz JVFRJFYBDVJGPA-UZLBHIALSA-N 0 3 408.933 4.399 20 0 HIADHN COc1cccc([C@H](CNC(=O)/C=C/c2nc3ccccc3s2)N2CCCC2)c1 ZINC000255949730 854228311 /nfs/dbraw/zinc/22/83/11/854228311.db2.gz FPRHPIBEKNXGBM-SGWGQVFISA-N 0 3 407.539 4.271 20 0 HIADHN C[C@@H](C(=O)Nc1ccc(N2CCCCC2)cc1)N1CCN(C2CCC(C)CC2)CC1 ZINC000261404988 854251030 /nfs/dbraw/zinc/25/10/30/854251030.db2.gz APUYROFSRYWREZ-QKDPSFTKSA-N 0 3 412.622 4.200 20 0 HIADHN CCN(C(=O)CNC1(c2ccc(F)cc2)CCOCC1)[C@@H](C)c1ccc(F)cc1 ZINC000261421186 854256475 /nfs/dbraw/zinc/25/64/75/854256475.db2.gz DRLAATUEUYAHSS-KRWDZBQOSA-N 0 3 402.485 4.170 20 0 HIADHN COc1cc([C@@H](C)NC(=O)c2oc3ccccc3c2CN(C)C)cc(OC)c1OC ZINC000261487861 854278969 /nfs/dbraw/zinc/27/89/69/854278969.db2.gz VPNVYQHTRFPRKI-CQSZACIVSA-N 0 3 412.486 4.011 20 0 HIADHN CCO[C@@H]1C[C@@H](O)C12CCN(c1c(C)c(C)nc3ccc(Br)cc31)CC2 ZINC000301395278 854381723 /nfs/dbraw/zinc/38/17/23/854381723.db2.gz LHPCAMGMEBDKRC-RTBURBONSA-N 0 3 419.363 4.370 20 0 HIADHN CN(C)Cc1ccc(N2CCN(c3nc4cc(C(F)(F)F)ccc4s3)CC2)nc1 ZINC000301403478 854383265 /nfs/dbraw/zinc/38/32/65/854383265.db2.gz KDRZDKQITCUXFV-UHFFFAOYSA-N 0 3 421.492 4.098 20 0 HIADHN COc1ccccc1[C@H](CNc1ncnc2nc(SC)sc21)N1CCCC1 ZINC000301501200 854408910 /nfs/dbraw/zinc/40/89/10/854408910.db2.gz DWELBMDJMGPROL-AWEZNQCLSA-N 0 3 401.561 4.066 20 0 HIADHN Cc1nc(-c2ccc(N[C@H]3CC[N@H+](Cc4ccccc4)[C@H](C)C3)nc2)[n-]c(=O)c1C ZINC000301573216 854422859 /nfs/dbraw/zinc/42/28/59/854422859.db2.gz YWICWFKOFCSYOF-IERDGZPVSA-N 0 3 403.530 4.326 20 0 HIADHN Cc1nc(-c2ccc(N[C@H]3CC[N@@H+](Cc4ccccc4)[C@H](C)C3)nc2)[n-]c(=O)c1C ZINC000301573216 854422861 /nfs/dbraw/zinc/42/28/61/854422861.db2.gz YWICWFKOFCSYOF-IERDGZPVSA-N 0 3 403.530 4.326 20 0 HIADHN C[C@@H](NCC(=O)N(C)CC(=O)Nc1ccccc1Cl)c1cccc2ccccc21 ZINC000301577794 854423506 /nfs/dbraw/zinc/42/35/06/854423506.db2.gz BBXMGCXWMPASSE-MRXNPFEDSA-N 0 3 409.917 4.241 20 0 HIADHN O=S(=O)(c1ccccc1N1CC[C@H]2[C@@H](CCCN2Cc2ccccc2)C1)C(F)F ZINC000301706668 854448968 /nfs/dbraw/zinc/44/89/68/854448968.db2.gz ISBNBOZIAOOSMY-OALUTQOASA-N 0 3 420.525 4.174 20 0 HIADHN COCc1nc2scc(-c3ccccc3)c2c(NC2CCN([C@H]3CCOC3)CC2)n1 ZINC000301720553 854452053 /nfs/dbraw/zinc/45/20/53/854452053.db2.gz MJOWBOBKVSKJCA-SFHVURJKSA-N 0 3 424.570 4.170 20 0 HIADHN COc1cccc([C@H]2[C@H](Nc3cc(C)nc(-c4cccnc4)n3)CCN2C2CC2)c1 ZINC000302016128 854516496 /nfs/dbraw/zinc/51/64/96/854516496.db2.gz CCBWFAPKFPIRBZ-GGAORHGYSA-N 0 3 401.514 4.246 20 0 HIADHN CC(C)N1CCN(c2cccc(Nc3nn4cc(-c5cccnc5)nc4s3)c2)CC1 ZINC000302132000 854534668 /nfs/dbraw/zinc/53/46/68/854534668.db2.gz CCTHPZXVARFXAC-UHFFFAOYSA-N 0 3 419.558 4.127 20 0 HIADHN COc1ccc(OC)c([C@H](C)NC(=O)CN[C@@H](c2ccc(Cl)cc2)C2CC2)c1 ZINC000302759476 854623872 /nfs/dbraw/zinc/62/38/72/854623872.db2.gz OBTIOASLNLKDDI-RCDICMHDSA-N 0 3 402.922 4.275 20 0 HIADHN C[C@@H](N[C@@H](Cc1ccccc1)c1ccccc1)C(=O)Nc1ccc2c(c1)OCCO2 ZINC000302804738 854639524 /nfs/dbraw/zinc/63/95/24/854639524.db2.gz KDRLDMPPSVUKTH-GCJKJVERSA-N 0 3 402.494 4.358 20 0 HIADHN CCS(=O)(=O)C1CCN(c2c(C)c(C)nc3ccc(Br)cc32)CC1 ZINC000302806383 854640534 /nfs/dbraw/zinc/64/05/34/854640534.db2.gz FYJPSRBSHAFXNL-UHFFFAOYSA-N 0 3 411.365 4.018 20 0 HIADHN CN(C)[C@H](CNC(=O)CCCOc1ccccc1Br)c1ccccc1 ZINC000302935092 854686468 /nfs/dbraw/zinc/68/64/68/854686468.db2.gz ISAWJWQMPVHXDC-GOSISDBHSA-N 0 3 405.336 4.027 20 0 HIADHN CCNC(=O)c1cccc(NC(=O)CN2CCC[C@@H]2c2cccc3ccccc32)c1 ZINC000302944918 854690584 /nfs/dbraw/zinc/69/05/84/854690584.db2.gz AYNCWQISEOZBOF-HSZRJFAPSA-N 0 3 401.510 4.365 20 0 HIADHN C[C@@H](Oc1cccc(C(C)(C)C)c1)C(=O)N(C)C1CCN(CCc2ccccn2)CC1 ZINC000302989038 854712117 /nfs/dbraw/zinc/71/21/17/854712117.db2.gz FOXAVTMWFKWMSZ-HXUWFJFHSA-N 0 3 423.601 4.312 20 0 HIADHN CN1CCC[C@H]1CNC(=O)c1cn(Cc2ccccc2)nc1-c1ccc(Cl)cc1 ZINC000303005487 854719421 /nfs/dbraw/zinc/71/94/21/854719421.db2.gz LONZOUNXUXRIRC-FQEVSTJZSA-N 0 3 408.933 4.076 20 0 HIADHN CC(=O)NC[C@@H]1CCCN(Cc2c(-c3ccc(Cl)cc3)nc3sccn23)C1 ZINC000303041981 854735824 /nfs/dbraw/zinc/73/58/24/854735824.db2.gz HBBTYKPPUDUSFK-HNNXBMFYSA-N 0 3 402.951 4.064 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CC(=O)NC[C@H]1CCCCN1Cc1ccccc1 ZINC000303054462 854740536 /nfs/dbraw/zinc/74/05/36/854740536.db2.gz KBFYSHCCMUHHRN-XMMPIXPASA-N 0 3 416.569 4.203 20 0 HIADHN O=C(c1ccc(OC(F)(F)F)cc1)N1CCCN(CCCc2ccccc2)CC1 ZINC000303083839 854753473 /nfs/dbraw/zinc/75/34/73/854753473.db2.gz ALOXGKQYDZQJOF-UHFFFAOYSA-N 0 3 406.448 4.366 20 0 HIADHN Cc1cc2oc(=O)cc(CN3CCC[C@@H](CN(C)C(=O)OC(C)(C)C)C3)c2cc1C ZINC000303104170 854762388 /nfs/dbraw/zinc/76/23/88/854762388.db2.gz IZJAMEJEBYLJHJ-SFHVURJKSA-N 0 3 414.546 4.489 20 0 HIADHN Cc1ccc([C@H](CNC(=O)NC[C@@H]2CCN(c3ccc(F)cc3)C2)N2CCCC2)cc1 ZINC000303120260 854769737 /nfs/dbraw/zinc/76/97/37/854769737.db2.gz IFWIJUHAJGZTHG-RDPSFJRHSA-N 0 3 424.564 4.097 20 0 HIADHN COc1ccc(CNC(=O)NC[C@@H](c2ccc(C)cc2)N(C)C)c(C(F)(F)F)c1 ZINC000303160009 854793401 /nfs/dbraw/zinc/79/34/01/854793401.db2.gz PEUBBZDGMHGHQE-IBGZPJMESA-N 0 3 409.452 4.125 20 0 HIADHN Cc1ccc([C@H](CNC(=O)NCCc2nc(C(C)(C)C)cs2)N2CCCC2)cc1 ZINC000303175827 854801052 /nfs/dbraw/zinc/80/10/52/854801052.db2.gz CBHFSMFWOKQGKC-IBGZPJMESA-N 0 3 414.619 4.428 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)NCCc2nc(C(C)(C)C)cs2)N2CCCC2)cc1 ZINC000303175828 854801138 /nfs/dbraw/zinc/80/11/38/854801138.db2.gz CBHFSMFWOKQGKC-LJQANCHMSA-N 0 3 414.619 4.428 20 0 HIADHN COc1ccc(CNC(=O)NC[C@H](C)N(C)Cc2ccccc2)c(C(F)(F)F)c1 ZINC000303432359 854933909 /nfs/dbraw/zinc/93/39/09/854933909.db2.gz CLXWPXODGWXUNN-HNNXBMFYSA-N 0 3 409.452 4.034 20 0 HIADHN CCOc1ccc(CNC(=O)[C@H](C)N2CCC(Cc3ccccc3)CC2)cc1OC ZINC000303438492 854938391 /nfs/dbraw/zinc/93/83/91/854938391.db2.gz BKPIMSHMMWHWTD-IBGZPJMESA-N 0 3 410.558 4.053 20 0 HIADHN O=C(Nc1ccc(Oc2ccc(Cl)nn2)cc1)N1CCN(C2CCCC2)CC1 ZINC000303507967 854996301 /nfs/dbraw/zinc/99/63/01/854996301.db2.gz BCLDAQVPTYRMAN-UHFFFAOYSA-N 0 3 401.898 4.014 20 0 HIADHN Cc1cc(NC(=O)c2ccco2)sc1C(=O)NC[C@@H](C)N(C)Cc1ccccc1 ZINC000303512537 855000590 /nfs/dbraw/zinc/00/05/90/855000590.db2.gz TVSYUZCDVSVWRZ-MRXNPFEDSA-N 0 3 411.527 4.152 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)c2cccc(COc3ccc(C)nc3)c2)c1 ZINC000303597848 855069494 /nfs/dbraw/zinc/06/94/94/855069494.db2.gz WTTRXDCOFOTLDA-UHFFFAOYSA-N 0 3 417.553 4.481 20 0 HIADHN CC1CCC(N2CCN([C@H]3CCN(c4ccc(C(F)(F)F)cc4)C3=O)CC2)CC1 ZINC000303638117 855094241 /nfs/dbraw/zinc/09/42/41/855094241.db2.gz GXEYZAUCHFFPSW-NLPFYKDJSA-N 0 3 409.496 4.007 20 0 HIADHN C[C@@H](CC(=O)NCCCCN1CCN(Cc2ccccc2)CC1)c1cccc(F)c1 ZINC000303702360 855140912 /nfs/dbraw/zinc/14/09/12/855140912.db2.gz XLXYPSAMMQGZFU-NRFANRHFSA-N 0 3 411.565 4.034 20 0 HIADHN Cc1ccc(N2CCCC2)c(C(=O)Nc2ccc(CCN3CCSCC3)cc2)c1 ZINC000303709628 855144597 /nfs/dbraw/zinc/14/45/97/855144597.db2.gz YTYAROPPQVJDFV-UHFFFAOYSA-N 0 3 409.599 4.439 20 0 HIADHN CO[C@H](c1ccc(Cl)cc1)[C@@H](C)NC(=O)N1CCCN(Cc2ccccc2)CC1 ZINC000303745988 855168007 /nfs/dbraw/zinc/16/80/07/855168007.db2.gz FZWAFIXNTOKVNS-GCJKJVERSA-N 0 3 415.965 4.334 20 0 HIADHN CC[C@@H](NC(=O)c1ccc(N2CCN(C(C)C)CC2)cc1)c1cc(F)ccc1F ZINC000303786659 855197770 /nfs/dbraw/zinc/19/77/70/855197770.db2.gz DRGMHXKRCVCWFG-JOCHJYFZSA-N 0 3 401.501 4.376 20 0 HIADHN CC(=O)N1C=Cc2ccccc2[C@H]1CC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C ZINC000303944825 855308956 /nfs/dbraw/zinc/30/89/56/855308956.db2.gz ZCDYYVNKYVYPCP-CJFMBICVSA-N 0 3 417.553 4.074 20 0 HIADHN CC(C)[C@@H](Cc1ccccc1)C(=O)Nc1ccc(C(=O)N(C)[C@H]2CCCN(C)C2)cc1 ZINC000303963651 855325548 /nfs/dbraw/zinc/32/55/48/855325548.db2.gz XMDOMTIKEKPACV-BJKOFHAPSA-N 0 3 421.585 4.306 20 0 HIADHN CCN(CC(=O)Nc1c(C)cccc1C)C(=O)c1oc2ccccc2c1CN(C)C ZINC000304040019 855343112 /nfs/dbraw/zinc/34/31/12/855343112.db2.gz NTRUTLBAJXRZHE-UHFFFAOYSA-N 0 3 407.514 4.212 20 0 HIADHN COc1ccc(CN[C@@H]2CCN(C(=O)OC(C)(C)C)[C@H](C)C2)c(Br)c1 ZINC000310950891 855368843 /nfs/dbraw/zinc/36/88/43/855368843.db2.gz RCBFMAPMZNOMCF-UKRRQHHQSA-N 0 3 413.356 4.335 20 0 HIADHN COc1ccc(Br)c(C(=O)N(C)C2CCN(Cc3ccccc3)CC2)c1 ZINC000311581593 855370149 /nfs/dbraw/zinc/37/01/49/855370149.db2.gz ORBCJRJSEJLXBL-UHFFFAOYSA-N 0 3 417.347 4.194 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCN(C(=O)c2ccc(F)cc2Br)C1 ZINC000323879531 855396822 /nfs/dbraw/zinc/39/68/22/855396822.db2.gz GCMNXITZOZWVSP-HNNXBMFYSA-N 0 3 405.311 4.182 20 0 HIADHN COc1ccc(C(=O)N2CCN(Cc3ccccc3)C[C@H](C)C2)cc1Br ZINC000324070324 855397412 /nfs/dbraw/zinc/39/74/12/855397412.db2.gz XXNXLASJTQGFRJ-INIZCTEOSA-N 0 3 417.347 4.052 20 0 HIADHN C[C@@H](Cc1ccc(Br)cc1)N[C@@H]1CCS(=O)(=O)c2ccc(F)cc21 ZINC000325113479 855401667 /nfs/dbraw/zinc/40/16/67/855401667.db2.gz JBPQGYNJRQNNIC-YVEFUNNKSA-N 0 3 412.324 4.028 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)c1cnc(Cl)c(Br)c1 ZINC000326555104 855410262 /nfs/dbraw/zinc/41/02/62/855410262.db2.gz UQRNOELBPGDRBT-INIZCTEOSA-N 0 3 408.727 4.064 20 0 HIADHN CN(C)Cc1ccccc1CNC(=O)c1cc(C(F)(F)F)ccc1Br ZINC000326932954 855413035 /nfs/dbraw/zinc/41/30/35/855413035.db2.gz CVQTVXMMJRBGRZ-UHFFFAOYSA-N 0 3 415.253 4.460 20 0 HIADHN COc1ccc([C@@H](C)NCc2ccc(N3CCCC3=O)cc2)cc1Br ZINC000327025255 855414087 /nfs/dbraw/zinc/41/40/87/855414087.db2.gz UABMTMHGGVAQBY-CQSZACIVSA-N 0 3 403.320 4.435 20 0 HIADHN C[C@H](CNCc1cc(Br)ccc1OC(F)F)NC(=O)OC(C)(C)C ZINC000379786168 855427793 /nfs/dbraw/zinc/42/77/93/855427793.db2.gz IGADVGXRMCOUNR-SNVBAGLBSA-N 0 3 409.271 4.053 20 0 HIADHN CC(C)(C)OC(=O)NC[C@H](NCc1ccc(Br)cn1)C1CCCCC1 ZINC000380749201 855428882 /nfs/dbraw/zinc/42/88/82/855428882.db2.gz ZBKYBAMGWZXYHR-KRWDZBQOSA-N 0 3 412.372 4.407 20 0 HIADHN CCn1cc(Br)cc1C(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC000383052565 855435698 /nfs/dbraw/zinc/43/56/98/855435698.db2.gz KULNWBOLHGXARP-MRXNPFEDSA-N 0 3 404.352 4.007 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)c1cccc(Br)c1F ZINC000383042779 855435953 /nfs/dbraw/zinc/43/59/53/855435953.db2.gz COYZINKKRUGZRL-HNNXBMFYSA-N 0 3 405.311 4.325 20 0 HIADHN CCn1cc(Br)cc1C(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C ZINC000383049842 855436024 /nfs/dbraw/zinc/43/60/24/855436024.db2.gz HXEJQOSXVMMTEI-INIZCTEOSA-N 0 3 404.352 4.007 20 0 HIADHN Cc1ccc(Br)cc1C(=O)N1CCCN(Cc2ccccc2)C[C@H]1C ZINC000383060557 855436866 /nfs/dbraw/zinc/43/68/66/855436866.db2.gz SFECPNHPXJNPPU-QGZVFWFLSA-N 0 3 401.348 4.494 20 0 HIADHN C[C@H]1[C@H](NC(=O)c2cccc(Br)c2Cl)CCN1Cc1ccccc1 ZINC000383281694 855436882 /nfs/dbraw/zinc/43/68/82/855436882.db2.gz LDGCDQOYZQJVAV-SUMWQHHRSA-N 0 3 407.739 4.495 20 0 HIADHN Cc1ccc(Br)cc1C(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC000383064722 855437065 /nfs/dbraw/zinc/43/70/65/855437065.db2.gz WGZVOUNNLMTVHC-QGZVFWFLSA-N 0 3 401.348 4.494 20 0 HIADHN CC(C)(C)OC(=O)N1CCN(CCCNCc2cc(Cl)ccc2Cl)CC1 ZINC000388219518 855446490 /nfs/dbraw/zinc/44/64/90/855446490.db2.gz IVQYRHMYGYPUHS-UHFFFAOYSA-N 0 3 402.366 4.026 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)C2(c3cccc(Cl)c3)CCOCC2)C1 ZINC000409459953 855490247 /nfs/dbraw/zinc/49/02/47/855490247.db2.gz QWEKPFQERBXRLQ-XMSQKQJNSA-N 0 3 412.961 4.340 20 0 HIADHN Cc1ccc([C@H](CNC(=O)[C@@H]2CCO[C@H]2c2ccc(Cl)c(F)c2)N(C)C)cc1 ZINC000409587038 855554895 /nfs/dbraw/zinc/55/48/95/855554895.db2.gz NIGDEDLBBUGHRS-QMMLZNLJSA-N 0 3 404.913 4.284 20 0 HIADHN C[C@@H](C(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1)c1ccc(C(F)(F)F)cc1 ZINC000409646730 855581391 /nfs/dbraw/zinc/58/13/91/855581391.db2.gz FLFALLGRYRJBMV-IXDOHACOSA-N 0 3 412.496 4.157 20 0 HIADHN CN(CCN(Cc1ccccc1)C(=O)[C@H]1CCCc2nn(C)cc21)Cc1ccccc1 ZINC000409845498 855684425 /nfs/dbraw/zinc/68/44/25/855684425.db2.gz QUJOCPHMBNSBAO-QHCPKHFHSA-N 0 3 416.569 4.001 20 0 HIADHN C[C@@H](NC(=O)Cc1c(F)ccc(Br)c1F)[C@H](c1ccccc1)N(C)C ZINC000409946374 855738718 /nfs/dbraw/zinc/73/87/18/855738718.db2.gz HMCPZRSFKVEBGT-CWTRNNRKSA-N 0 3 411.290 4.077 20 0 HIADHN CC(C)(C)[C@@H](CN1CCc2ccccc2C1)NC(=O)c1ccc(Cn2ccnc2)cc1 ZINC000410050424 855800172 /nfs/dbraw/zinc/80/01/72/855800172.db2.gz CCJOLEZWHDTGJA-XMMPIXPASA-N 0 3 416.569 4.134 20 0 HIADHN CC1CCN([C@H](CNC(=O)N[C@H]2CCCC23CCOCC3)c2cccs2)CC1 ZINC000410091246 855814378 /nfs/dbraw/zinc/81/43/78/855814378.db2.gz YTDDCQJLHHQWEE-QUCCMNQESA-N 0 3 405.608 4.170 20 0 HIADHN CC(C)(C)[C@@H](CN1CCc2ccccc2C1)NC(=O)c1ccc(-n2ccnc2)cc1 ZINC000410109797 855824263 /nfs/dbraw/zinc/82/42/63/855824263.db2.gz YVOVBGCYEGDGSO-HSZRJFAPSA-N 0 3 402.542 4.075 20 0 HIADHN COc1ccc2ccccc2c1CNC(=O)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000410181671 855852832 /nfs/dbraw/zinc/85/28/32/855852832.db2.gz SXSQGGIJVAMPRD-QHCPKHFHSA-N 0 3 403.526 4.485 20 0 HIADHN Cc1ccc(-c2ccnn2C)cc1NC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000410194116 855856691 /nfs/dbraw/zinc/85/66/91/855856691.db2.gz JRACHQPRAWPNDX-FQEVSTJZSA-N 0 3 406.505 4.385 20 0 HIADHN C[C@@H](Cc1ccc(F)c(Br)c1)C(=O)NCc1ccccc1CN(C)C ZINC000410225451 855869178 /nfs/dbraw/zinc/86/91/78/855869178.db2.gz ULCCOXNVABVXPR-AWEZNQCLSA-N 0 3 407.327 4.145 20 0 HIADHN COc1cccc([C@@H](CNC(=O)NCc2ccc(OC(C)C)cc2)N2CCCC2)c1 ZINC000410235380 855874042 /nfs/dbraw/zinc/87/40/42/855874042.db2.gz XECGNTVDLFZGED-HSZRJFAPSA-N 0 3 411.546 4.119 20 0 HIADHN O=S(=O)(CCCN[C@H](Cc1cccnc1)c1cccc(Cl)c1)c1ccccc1 ZINC000425937415 856009373 /nfs/dbraw/zinc/00/93/73/856009373.db2.gz MAAGLKWWTHBKDG-JOCHJYFZSA-N 0 3 414.958 4.472 20 0 HIADHN COc1cc(Cl)c(NC(=O)c2ccc(CN3CCC(CO)CC3)cc2)cc1C ZINC000426021975 856051941 /nfs/dbraw/zinc/05/19/41/856051941.db2.gz KOLATDDKIWEHLA-UHFFFAOYSA-N 0 3 402.922 4.114 20 0 HIADHN C[C@H](C(=O)NCCCCN1CCN(c2ccccc2)CC1)c1ccc(Cl)s1 ZINC000426084645 856097181 /nfs/dbraw/zinc/09/71/81/856097181.db2.gz MCPXYUHATIHNMF-KRWDZBQOSA-N 0 3 405.995 4.224 20 0 HIADHN C[C@H](CCCC(F)(F)F)NC(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000426093472 856103707 /nfs/dbraw/zinc/10/37/07/856103707.db2.gz XCDMBTRVFPKGTP-ZACQAIPSSA-N 0 3 407.521 4.028 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)N(C)[C@H]3CC[C@@H](C(F)(F)F)CC3)CC2)c1 ZINC000426148808 856140344 /nfs/dbraw/zinc/14/03/44/856140344.db2.gz KOLIATAUEKHFQG-KDURUIRLSA-N 0 3 411.512 4.087 20 0 HIADHN CC(C)Sc1ccccc1NC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1CO ZINC000426153782 856142335 /nfs/dbraw/zinc/14/23/35/856142335.db2.gz ONWBOCCOELXJAB-PMACEKPBSA-N 0 3 413.587 4.192 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)C/C=C\c3ccccc3F)CC2)c1 ZINC000426180032 856158948 /nfs/dbraw/zinc/15/89/48/856158948.db2.gz WRCCNMRJKZATOC-YFHOEESVSA-N 0 3 409.549 4.256 20 0 HIADHN C[C@H]1CN(C2CCOCC2)CCN1C(=O)N[C@H]1CCc2ccc(-c3ccccc3)cc21 ZINC000426188042 856164485 /nfs/dbraw/zinc/16/44/85/856164485.db2.gz SUDCADRGXWUQFS-DFBJGRDBSA-N 0 3 419.569 4.236 20 0 HIADHN CN(C)[C@H](CNC(=O)N1CCC[C@@H](c2nc3c(s2)CCCC3)C1)c1ccccc1 ZINC000426232923 856190990 /nfs/dbraw/zinc/19/09/90/856190990.db2.gz PFFGNTGTJFJCTN-UYAOXDASSA-N 0 3 412.603 4.214 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@@H]1CCOC2(CCCCC2)C1)c1cccc(OC)c1 ZINC000426231484 856191007 /nfs/dbraw/zinc/19/10/07/856191007.db2.gz ILPHJSAVQOHNMV-IFMALSPDSA-N 0 3 417.594 4.259 20 0 HIADHN Cc1ncc([C@H](C)N[C@H](Cc2ccc(F)cc2)[C@H]2COc3ccccc3O2)c(C)n1 ZINC000426313709 856239931 /nfs/dbraw/zinc/23/99/31/856239931.db2.gz NSLAAWICTYJVKQ-VZDNWZCBSA-N 0 3 407.489 4.334 20 0 HIADHN Cc1cccc2[nH]c(Cc3noc([C@@H]4CN(C(C)(C)C)C[C@H]4C(F)(F)F)n3)nc21 ZINC000426408305 856278353 /nfs/dbraw/zinc/27/83/53/856278353.db2.gz CDCHDMKIIBVTCQ-CHWSQXEVSA-N 0 3 407.440 4.221 20 0 HIADHN O=C(Nc1cc(F)c(Cl)cc1N1CCOCC1)c1cccc(CN2CCCC2)c1 ZINC000426648266 856392091 /nfs/dbraw/zinc/39/20/91/856392091.db2.gz QKBIFAPROMRSDQ-UHFFFAOYSA-N 0 3 417.912 4.164 20 0 HIADHN COc1cccc(/C=C(\CC(=O)N(C)CCN(C)C)c2nc3ccccc3s2)c1 ZINC000426689775 856413967 /nfs/dbraw/zinc/41/39/67/856413967.db2.gz XHKUEJZBPAYGAW-NBVRZTHBSA-N 0 3 409.555 4.256 20 0 HIADHN C[C@H]1CN(CCC2CCN(Cc3nc4ccccc4n3C(F)F)CC2)C[C@H](C)O1 ZINC000426782855 856475906 /nfs/dbraw/zinc/47/59/06/856475906.db2.gz HWPIYSIEGUZDHK-IRXDYDNUSA-N 0 3 406.521 4.143 20 0 HIADHN COc1ccccc1[C@H](NC(=O)N(Cc1ccco1)C1CCN(C)CC1)c1ccco1 ZINC000426809757 856491546 /nfs/dbraw/zinc/49/15/46/856491546.db2.gz FYWFCILHGPXGKS-QHCPKHFHSA-N 0 3 423.513 4.277 20 0 HIADHN C[C@@H](NC(=O)N(CCN(C)C)Cc1ccc(F)cc1)c1nc(C(F)(F)F)cs1 ZINC000426902124 856534246 /nfs/dbraw/zinc/53/42/46/856534246.db2.gz BDXYFFCQZXDQKO-GFCCVEGCSA-N 0 3 418.460 4.135 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)N[C@@H](C)c2nc(C(F)(F)F)cs2)c1 ZINC000426906959 856536168 /nfs/dbraw/zinc/53/61/68/856536168.db2.gz KMNDKQFUCKEDEH-AWEZNQCLSA-N 0 3 414.497 4.305 20 0 HIADHN CN(C)c1nc2ccc(NC(=O)N(Cc3ccccc3)C3CCN(C)CC3)cc2o1 ZINC000426952229 856560458 /nfs/dbraw/zinc/56/04/58/856560458.db2.gz VWDJSZJDPNSCQM-UHFFFAOYSA-N 0 3 407.518 4.022 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)N[C@H]2CCC[C@@H]2OCc2ccccc2)CC1 ZINC000426963206 856565414 /nfs/dbraw/zinc/56/54/14/856565414.db2.gz GTADRSODFBZHIZ-GOTSBHOMSA-N 0 3 411.546 4.023 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)N[C@@H]2CCC[C@H]2OCc2ccccc2)CC1 ZINC000426963204 856565841 /nfs/dbraw/zinc/56/58/41/856565841.db2.gz GTADRSODFBZHIZ-DHIUTWEWSA-N 0 3 411.546 4.023 20 0 HIADHN CCc1c(C(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)cnn1-c1ccccc1 ZINC000437467046 862829237 /nfs/dbraw/zinc/82/92/37/862829237.db2.gz BRMQDNXRYLEKJD-HXUWFJFHSA-N 0 3 402.542 4.171 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)C(=O)Nc1ccc(C2CCC2)cc1 ZINC000427237292 856729569 /nfs/dbraw/zinc/72/95/69/856729569.db2.gz OCMPOYANGNMTOM-UHFFFAOYSA-N 0 3 423.582 4.123 20 0 HIADHN Cc1c(Br)cccc1C(=O)N1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000427295903 856757151 /nfs/dbraw/zinc/75/71/51/856757151.db2.gz LUNYJDOTLUZQEF-HOTGVXAUSA-N 0 3 423.395 4.109 20 0 HIADHN CCc1cccc2c(CC(=O)N3CCC(CCN4C[C@H](C)O[C@@H](C)C4)CC3)c[nH]c21 ZINC000427294725 856757283 /nfs/dbraw/zinc/75/72/83/856757283.db2.gz GQAKWZLGPVAXEP-OALUTQOASA-N 0 3 411.590 4.011 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3ccc(N4CCCCC4)cc3)CC2)C[C@H](C)O1 ZINC000427295521 856757370 /nfs/dbraw/zinc/75/73/70/856757370.db2.gz JWNQWXHVJAINMY-OYRHEFFESA-N 0 3 413.606 4.028 20 0 HIADHN C[C@H](CC(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1)Cc1cccc(F)c1 ZINC000427298503 856758850 /nfs/dbraw/zinc/75/88/50/856758850.db2.gz CXYPGVROQPTAGK-SLFFLAALSA-N 0 3 404.570 4.132 20 0 HIADHN COc1ccccc1C[C@H](C)CC(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000427330998 856775258 /nfs/dbraw/zinc/77/52/58/856775258.db2.gz OMGBASKGSWFCGL-PWRODBHTSA-N 0 3 416.606 4.002 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)CCCOc3ccc(Cl)cc3)CC2)C[C@H](C)O1 ZINC000427335659 856778495 /nfs/dbraw/zinc/77/84/95/856778495.db2.gz OBUSBWXWOIILOV-KDURUIRLSA-N 0 3 422.997 4.237 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)c3cnc(-c4ccccc4)s3)CC2)C[C@H](C)O1 ZINC000427360893 856793837 /nfs/dbraw/zinc/79/38/37/856793837.db2.gz CAEXVWKLPBDKPH-ROUUACIJSA-N 0 3 413.587 4.162 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3cnc(-c4ccccc4)s3)CC2)C[C@H](C)O1 ZINC000427360891 856794210 /nfs/dbraw/zinc/79/42/10/856794210.db2.gz CAEXVWKLPBDKPH-HDICACEKSA-N 0 3 413.587 4.162 20 0 HIADHN C[C@@]1(CNC(=O)C(=O)Nc2csc3ccccc23)CCCN1Cc1ccccc1 ZINC000427492936 856840294 /nfs/dbraw/zinc/84/02/94/856840294.db2.gz OJKBUHJTXVVROL-QHCPKHFHSA-N 0 3 407.539 4.011 20 0 HIADHN C[C@H](NCCC1CCN(CC(F)(F)F)CC1)c1ncc(Br)cc1F ZINC000427686036 856908776 /nfs/dbraw/zinc/90/87/76/856908776.db2.gz PHHOAZOVOURVTL-NSHDSACASA-N 0 3 412.269 4.298 20 0 HIADHN O[C@H](C(F)F)[C@@H](Cc1ccccc1)N[C@@H]1CCCc2ncc(C(F)(F)F)cc21 ZINC000427687335 856908809 /nfs/dbraw/zinc/90/88/09/856908809.db2.gz VJTSYQGBWOJNID-KURKYZTESA-N 0 3 400.391 4.305 20 0 HIADHN Cc1cc(C)c(CC(C(=O)Nc2cccc(N(C)C(N)=O)c2)C(F)(F)F)c(C)c1 ZINC000427955503 857022740 /nfs/dbraw/zinc/02/27/40/857022740.db2.gz DSAFGYAACGQBMZ-GOSISDBHSA-N 0 3 407.436 4.486 20 0 HIADHN COc1cc(OC)c(NC(=O)c2cccc(CN3CCCC3)c2)cc1Br ZINC000428111878 857075195 /nfs/dbraw/zinc/07/51/95/857075195.db2.gz TVONXJPAHRLSLP-UHFFFAOYSA-N 0 3 419.319 4.314 20 0 HIADHN CC(C)Cc1ccc([C@H](C)C(=O)Nc2cccc(CN3CCC(C(N)=O)CC3)c2)cc1 ZINC000428220288 857116365 /nfs/dbraw/zinc/11/63/65/857116365.db2.gz CFVIKLFIXOMEBH-IBGZPJMESA-N 0 3 421.585 4.325 20 0 HIADHN O=C(CCN1CCS[C@@H]2CCCC[C@H]21)Nc1ccc(Br)cc1F ZINC000437541437 862874951 /nfs/dbraw/zinc/87/49/51/862874951.db2.gz XATCOCATOWGGGO-HZPDHXFCSA-N 0 3 401.345 4.277 20 0 HIADHN Cc1ccc(-c2cncc(C(=O)NC[C@H]3CN(Cc4ccccc4)CCCO3)c2)cc1 ZINC000428438437 857203114 /nfs/dbraw/zinc/20/31/14/857203114.db2.gz VVPHHSXJGZDEFH-VWLOTQADSA-N 0 3 415.537 4.078 20 0 HIADHN COc1cc(CN2CC[C@H](O)[C@H](C)C2)ccc1OCCOc1ccccc1Cl ZINC000428454642 857207804 /nfs/dbraw/zinc/20/78/04/857207804.db2.gz DEVOBHDQFYIRQI-APWZRJJASA-N 0 3 405.922 4.009 20 0 HIADHN OC[C@]1(CNCc2cc(Cl)ccc2OC[C@H]2CCCO2)C[C@@H]1c1ccc(F)cc1 ZINC000428541050 857252574 /nfs/dbraw/zinc/25/25/74/857252574.db2.gz DONDNJSKQWTBFY-MQSCRBSSSA-N 0 3 419.924 4.293 20 0 HIADHN COc1cccc(Nc2ccccc2C(=O)Nc2cccc(CN3CC[C@@H](O)C3)c2)c1 ZINC000428548121 857257606 /nfs/dbraw/zinc/25/76/06/857257606.db2.gz NMSNQKPPLMKCMC-OAQYLSRUSA-N 0 3 417.509 4.258 20 0 HIADHN Cn1c(CNC[C@@]2(Cc3ccc(F)cc3)CCC[C@@H]2O)nc2cc(Cl)ccc21 ZINC000428573954 857269159 /nfs/dbraw/zinc/26/91/59/857269159.db2.gz QJIQXNXUTQWFFF-UNMCSNQZSA-N 0 3 401.913 4.229 20 0 HIADHN COc1ccc(CNC[C@@]2(Cc3ccc(F)cc3)CCC[C@@H]2O)c(Cl)c1OC ZINC000428574221 857270090 /nfs/dbraw/zinc/27/00/90/857270090.db2.gz QZGBWOOOXCYERE-UGKGYDQZSA-N 0 3 407.913 4.360 20 0 HIADHN CCSc1ccc(Cl)cc1C(=O)N(C)C[C@@]1(O)CCN(Cc2ccccc2)C1 ZINC000428704123 857303349 /nfs/dbraw/zinc/30/33/49/857303349.db2.gz ZEGGEPCIRIOPCD-QFIPXVFZSA-N 0 3 418.990 4.161 20 0 HIADHN CCN(CC)C(=O)c1ccc(NC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)cc1 ZINC000437581182 862897549 /nfs/dbraw/zinc/89/75/49/862897549.db2.gz VMOFCLROGATGSY-HXUWFJFHSA-N 0 3 422.573 4.297 20 0 HIADHN C[C@@H](CC(=O)Nc1cccc(CN2CC[C@@H](O)C2)c1)c1ccc(Br)cc1 ZINC000428821712 857359935 /nfs/dbraw/zinc/35/99/35/857359935.db2.gz LWWJAABXQVKJTA-MGPUTAFESA-N 0 3 417.347 4.148 20 0 HIADHN CCOc1ccccc1[C@H](C)NC(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000428835500 857366506 /nfs/dbraw/zinc/36/65/06/857366506.db2.gz YSXJKUCJDDSQSA-ZCNNSNEGSA-N 0 3 417.594 4.067 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)NCc3csc4ccccc34)CC2)C[C@H](C)O1 ZINC000428839875 857368563 /nfs/dbraw/zinc/36/85/63/857368563.db2.gz MSZBLNRUZOGOQN-ROUUACIJSA-N 0 3 415.603 4.322 20 0 HIADHN C[C@@H](c1ccccc1)[C@H](NCc1c(-c2ccc(Cl)cc2)nc2sccn21)C(N)=O ZINC000428866337 857378548 /nfs/dbraw/zinc/37/85/48/857378548.db2.gz YLVIDKZOTISZAO-LIRRHRJNSA-N 0 3 424.957 4.463 20 0 HIADHN C[C@@H](NC(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1)c1ccc(Cl)s1 ZINC000428912700 857410577 /nfs/dbraw/zinc/41/05/77/857410577.db2.gz KJJYVZBDYXDPKM-BZUAXINKSA-N 0 3 414.015 4.383 20 0 HIADHN C[C@H](NC(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1)c1ccc(Cl)s1 ZINC000428912704 857410752 /nfs/dbraw/zinc/41/07/52/857410752.db2.gz KJJYVZBDYXDPKM-OAGGEKHMSA-N 0 3 414.015 4.383 20 0 HIADHN CCc1ccccc1NC(=O)CN1CCN([C@H]2CC[C@](C)(c3ccccc3)C2)CC1 ZINC000437593686 862908310 /nfs/dbraw/zinc/90/83/10/862908310.db2.gz UQCJXDULJLZLIJ-OZXSUGGESA-N 0 3 405.586 4.316 20 0 HIADHN CCN(Cc1ccccc1Cl)C(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000428998068 857450038 /nfs/dbraw/zinc/45/00/38/857450038.db2.gz KAOGPHYTZUSIJM-OAQYLSRUSA-N 0 3 415.965 4.163 20 0 HIADHN CC(C)OCc1ccc(NC(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)cc1 ZINC000429028549 857464682 /nfs/dbraw/zinc/46/46/82/857464682.db2.gz KPKAKIAVADAHAG-BGYRXZFFSA-N 0 3 417.594 4.355 20 0 HIADHN CCO[C@@H]1C[C@H](O)C12CCN(Cc1cccc3c(Br)cccc13)CC2 ZINC000429046841 857474549 /nfs/dbraw/zinc/47/45/49/857474549.db2.gz JIPUSBSPBLWBRS-VQTJNVASSA-N 0 3 404.348 4.354 20 0 HIADHN CC(C)Oc1ccc(F)cc1NC(=O)N1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000429064558 857488250 /nfs/dbraw/zinc/48/82/50/857488250.db2.gz NWKBYMRAGHZQNY-ROUUACIJSA-N 0 3 421.557 4.356 20 0 HIADHN CSCCc1ccc(NC(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)cc1 ZINC000429075320 857495927 /nfs/dbraw/zinc/49/59/27/857495927.db2.gz DRYBYLKGPRNCBT-OALUTQOASA-N 0 3 419.635 4.335 20 0 HIADHN CC(C)COc1cccc(NC(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)c1 ZINC000429094146 857506476 /nfs/dbraw/zinc/50/64/76/857506476.db2.gz CSZWZPCEROASTQ-BGYRXZFFSA-N 0 3 417.594 4.465 20 0 HIADHN CC(C)Oc1ccc(NC(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)cc1 ZINC000429102076 857510068 /nfs/dbraw/zinc/51/00/68/857510068.db2.gz YNIFJRZUUUAKAX-RTBURBONSA-N 0 3 403.567 4.217 20 0 HIADHN C[C@H](NC(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1)c1ccccc1Cl ZINC000429192483 857547538 /nfs/dbraw/zinc/54/75/38/857547538.db2.gz HNYUEXVBMWWVOF-KURKYZTESA-N 0 3 407.986 4.322 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)Nc3ccccc3Br)CC2)C[C@H](C)O1 ZINC000429209265 857556269 /nfs/dbraw/zinc/55/62/69/857556269.db2.gz CQTFOUKQWLDNBA-HOTGVXAUSA-N 0 3 424.383 4.192 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)Nc3cccc(C(F)(F)F)c3)CC2)C[C@H](C)O1 ZINC000429213527 857557597 /nfs/dbraw/zinc/55/75/97/857557597.db2.gz UJCMIWVLKFCJCT-HOTGVXAUSA-N 0 3 413.484 4.449 20 0 HIADHN O=C(CN[C@@H]1Cc2cccc(O)c2C1)N[C@@H](c1ccccc1)c1cccc(Cl)c1 ZINC000429227526 857564488 /nfs/dbraw/zinc/56/44/88/857564488.db2.gz OAYNMYKUYHLSNZ-YKSBVNFPSA-N 0 3 406.913 4.008 20 0 HIADHN O=C(CN[C@H]1Cc2cccc(O)c2C1)N[C@@H](c1ccccc1)c1cccc(Cl)c1 ZINC000429227525 857564649 /nfs/dbraw/zinc/56/46/49/857564649.db2.gz OAYNMYKUYHLSNZ-RDPSFJRHSA-N 0 3 406.913 4.008 20 0 HIADHN CCCn1ccnc1CCCN(C)Cc1nnc(-c2ccccc2Br)o1 ZINC000429233363 857566741 /nfs/dbraw/zinc/56/67/41/857566741.db2.gz CVGOANDDSLOTIT-UHFFFAOYSA-N 0 3 418.339 4.170 20 0 HIADHN CSC[C@@H]1CCCN(CC(=O)N2CCc3sccc3[C@H]2c2ccccc2)C1 ZINC000429279977 857588483 /nfs/dbraw/zinc/58/84/83/857588483.db2.gz WMMXBVNEVSQSEJ-VGOFRKELSA-N 0 3 400.613 4.297 20 0 HIADHN CCC1(CC)[C@H](OC)C[C@@H]1NCC(=O)Nc1ccc(NC(=O)c2cccs2)cc1 ZINC000429303460 857597705 /nfs/dbraw/zinc/59/77/05/857597705.db2.gz WIBNXFBVSWJLTH-RBUKOAKNSA-N 0 3 415.559 4.122 20 0 HIADHN C[C@@H](N[C@H]1Cc2cccc(O)c2C1)C(=O)Nc1cccc(CSc2ccccn2)c1 ZINC000429314107 857599759 /nfs/dbraw/zinc/59/97/59/857599759.db2.gz YFXDREYDKJEEES-UZLBHIALSA-N 0 3 419.550 4.164 20 0 HIADHN CCCN(C(=O)NCC1CCC(OC)CC1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000429318876 857602263 /nfs/dbraw/zinc/60/22/63/857602263.db2.gz PJGNRKFLYDTCLF-GTMAMOSYSA-N 0 3 401.595 4.278 20 0 HIADHN Cc1cnc([C@@H](C)NC(=O)N[C@@H](CN2CCc3ccccc3C2)C(C)(C)C)s1 ZINC000429321835 857602624 /nfs/dbraw/zinc/60/26/24/857602624.db2.gz FZKJFFJWMQLIDJ-APWZRJJASA-N 0 3 400.592 4.285 20 0 HIADHN Cc1cnc([C@H](C)NC(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)s1 ZINC000429320418 857602650 /nfs/dbraw/zinc/60/26/50/857602650.db2.gz VRBCMQJBLBMQAD-AWEZNQCLSA-N 0 3 414.497 4.305 20 0 HIADHN Cn1cc([C@H](NC[C@]2(Cc3ccc(F)cc3)CCC[C@@H]2O)c2cccc(F)c2)cn1 ZINC000429453475 857678316 /nfs/dbraw/zinc/67/83/16/857678316.db2.gz OYZWZUXPCIQDNT-RBZQAINGSA-N 0 3 411.496 4.151 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)NCC(C)(C)c3cccc(F)c3)CC2)C[C@H](C)O1 ZINC000429497049 857698232 /nfs/dbraw/zinc/69/82/32/857698232.db2.gz XBLWCWNOCGYUSG-OALUTQOASA-N 0 3 419.585 4.024 20 0 HIADHN CCOc1cccc2[nH]cc(CC(=O)NC[C@H](c3cccc(OC)c3)N3CCCC3)c21 ZINC000437622911 862941501 /nfs/dbraw/zinc/94/15/01/862941501.db2.gz FNJGVSGSOZXLKY-JOCHJYFZSA-N 0 3 421.541 4.071 20 0 HIADHN COc1ccc([C@H](N[C@@H](C)CC2(OC)CCC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000429517278 857711842 /nfs/dbraw/zinc/71/18/42/857711842.db2.gz NBOWYELVIPSWFF-JTSKRJEESA-N 0 3 417.571 4.125 20 0 HIADHN Cc1noc(C[C@H](NC[C@@H](O)COc2ccc(C(C)(C)C)cc2C)c2ccccc2)n1 ZINC000429530837 857723313 /nfs/dbraw/zinc/72/33/13/857723313.db2.gz QNBYIAOENRFLKC-YADHBBJMSA-N 0 3 423.557 4.297 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)Nc1ccnn1Cc1ccc(F)cc1 ZINC000429577178 857762506 /nfs/dbraw/zinc/76/25/06/857762506.db2.gz IQWMTQONYCMJTE-UHFFFAOYSA-N 0 3 423.536 4.099 20 0 HIADHN C[C@H]1CCN(C(=O)NC[C@@H](c2ccccc2)C(C)(C)CO)CCN1Cc1ccccc1 ZINC000437628114 862950356 /nfs/dbraw/zinc/95/03/56/862950356.db2.gz QQRUUVRPLCUROC-URXFXBBRSA-N 0 3 423.601 4.095 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)c1ccccc1COC1CCOCC1 ZINC000429665724 857826928 /nfs/dbraw/zinc/82/69/28/857826928.db2.gz AKSDMZVRKDBZQV-NRFANRHFSA-N 0 3 422.569 4.119 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)c1cc(Br)c(F)cc1F ZINC000429717868 857848828 /nfs/dbraw/zinc/84/88/28/857848828.db2.gz DDPKOEGWLHQYMY-SFHVURJKSA-N 0 3 409.274 4.294 20 0 HIADHN O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)Nc1cccc(COCC2CC2)c1 ZINC000429752623 857871285 /nfs/dbraw/zinc/87/12/85/857871285.db2.gz UWUSBNQYYWECCK-XMMPIXPASA-N 0 3 423.557 4.026 20 0 HIADHN C[C@H](C(=O)N(CCN(C)C)Cc1cccc(Cl)c1)[C@H]1OCCc2sccc21 ZINC000429804520 857890576 /nfs/dbraw/zinc/89/05/76/857890576.db2.gz CZJSGNKRWLLUQW-MGPUTAFESA-N 0 3 406.979 4.242 20 0 HIADHN CCCN1c2ccc(NC(=O)N[C@H](C)[C@H](c3ccccc3)N(C)C)cc2CCC1=O ZINC000429982838 857983064 /nfs/dbraw/zinc/98/30/64/857983064.db2.gz SVUKDODKNORMRC-UZUQRXQVSA-N 0 3 408.546 4.189 20 0 HIADHN COc1ccccc1-c1ncc(CN2CCC(c3ncc4n3CCCC4)CC2)cn1 ZINC000430066278 858018895 /nfs/dbraw/zinc/01/88/95/858018895.db2.gz LYHDUSULHFCGGU-UHFFFAOYSA-N 0 3 403.530 4.065 20 0 HIADHN Cc1nnc(SC[C@@H]2CN(Cc3ccccc3)CCCO2)n1-c1ccccc1C ZINC000430102530 858033033 /nfs/dbraw/zinc/03/30/33/858033033.db2.gz QSLCUKSZWDONIE-NRFANRHFSA-N 0 3 408.571 4.267 20 0 HIADHN COc1cc(CN2CC[C@H](O)C[C@@H]2C)ccc1OCc1ccc(Br)cc1 ZINC000430112598 858036951 /nfs/dbraw/zinc/03/69/51/858036951.db2.gz DRTQAZIFHAWFNF-KXBFYZLASA-N 0 3 420.347 4.382 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)N[C@@H]2C[C@H]2c2cc(F)c(F)c(F)c2)C1 ZINC000437648953 862981190 /nfs/dbraw/zinc/98/11/90/862981190.db2.gz WFHVYAXSJHGCDN-VZYKRBATSA-N 0 3 403.448 4.095 20 0 HIADHN CC(C)c1ccc2c(c1)[C@H](NC(=O)NCc1ccccc1CN1CCC(O)CC1)CC2 ZINC000430199923 858079213 /nfs/dbraw/zinc/07/92/13/858079213.db2.gz SNPABABSYPHEAI-RUZDIDTESA-N 0 3 421.585 4.253 20 0 HIADHN COc1ccccc1-c1ncc(CN2C[C@H](C)N(Cc3ccccc3)C[C@@H]2C)cn1 ZINC000430246626 858095654 /nfs/dbraw/zinc/09/56/54/858095654.db2.gz SDAOACDWTAUJAC-PMACEKPBSA-N 0 3 402.542 4.247 20 0 HIADHN CCC[C@@H](N[C@H](C)c1ccc(Br)c(S(N)(=O)=O)c1)c1ccccc1 ZINC000430695571 858272461 /nfs/dbraw/zinc/27/24/61/858272461.db2.gz OCLYMYDZNNVBFC-CXAGYDPISA-N 0 3 411.365 4.289 20 0 HIADHN CO[C@H](C)c1nc(CN2CCCN(CCSCc3ccccc3)CC2)cs1 ZINC000430743708 858284452 /nfs/dbraw/zinc/28/44/52/858284452.db2.gz PJYNMFUEYGOMSW-GOSISDBHSA-N 0 3 405.633 4.292 20 0 HIADHN CN(C(=O)[C@H]1CCN(Cc2cn(C)nc2-c2ccccc2Cl)C1)c1ccccc1 ZINC000430865963 858344971 /nfs/dbraw/zinc/34/49/71/858344971.db2.gz PMFRWYWWXNKLEZ-KRWDZBQOSA-N 0 3 408.933 4.225 20 0 HIADHN CCN(CC)[C@@H](CN1C(=O)CN(Cc2ccc(Cl)cc2)C1=O)c1ccsc1 ZINC000430865958 858345177 /nfs/dbraw/zinc/34/51/77/858345177.db2.gz PHUYEAGUEWWQPF-SFHVURJKSA-N 0 3 405.951 4.249 20 0 HIADHN CCN(CC)[C@H](CN1C(=O)N[C@@H](c2ccc(OC(F)F)cc2)C1=O)c1ccsc1 ZINC000430869012 858347055 /nfs/dbraw/zinc/34/70/55/858347055.db2.gz PAHOEVALSYFMQW-SJORKVTESA-N 0 3 423.485 4.026 20 0 HIADHN CCOc1cc(CN2CC[C@H](C(=O)N(C)c3ccccc3)C2)ccc1OC(F)F ZINC000430873861 858349889 /nfs/dbraw/zinc/34/98/89/858349889.db2.gz AFWHECOKOCXZOZ-KRWDZBQOSA-N 0 3 404.457 4.172 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)NCc1c(F)cc(F)c(F)c1F ZINC000430962443 858384043 /nfs/dbraw/zinc/38/40/43/858384043.db2.gz QQICKFKVVNXQMP-UHFFFAOYSA-N 0 3 417.834 4.170 20 0 HIADHN O=C1N[C@H](Cc2cccc3ccccc32)C(=O)N1C[C@@H](c1cccs1)N1CCCC1 ZINC000430979729 858389665 /nfs/dbraw/zinc/38/96/65/858389665.db2.gz QDAVHQCMSSLZBZ-RTWAWAEBSA-N 0 3 419.550 4.201 20 0 HIADHN Cc1c(C(=O)N[C@H]2CCN(Cc3ccccc3)[C@@H](C)C2)[nH]c2c1C(=O)CC(C)(C)C2 ZINC000431053394 858421569 /nfs/dbraw/zinc/42/15/69/858421569.db2.gz NEFAWQZZRZWMRQ-LPHOPBHVSA-N 0 3 407.558 4.261 20 0 HIADHN COCCCOc1cccc(NC(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)c1 ZINC000431102995 858447803 /nfs/dbraw/zinc/44/78/03/858447803.db2.gz NWQRYLXQNYVUHW-HXUWFJFHSA-N 0 3 411.546 4.230 20 0 HIADHN CCOc1cccc2[nH]cc(CC(=O)NC[C@H](CC)N3CCc4ccccc4C3)c21 ZINC000437719988 863050868 /nfs/dbraw/zinc/05/08/68/863050868.db2.gz FTAPLUSRJYAPFF-NRFANRHFSA-N 0 3 405.542 4.062 20 0 HIADHN Cc1nc2sccn2c1CN(C)CC[C@@H](C)N(C)Cc1c(C)nc2sccn12 ZINC000431597959 858682352 /nfs/dbraw/zinc/68/23/52/858682352.db2.gz WFKQGVCXSPDLSE-CQSZACIVSA-N 0 3 416.620 4.064 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)C1(Cc2ccc(F)cc2)CCOCC1 ZINC000431692257 858741833 /nfs/dbraw/zinc/74/18/33/858741833.db2.gz PSZGYNLOXDEBIT-HSZRJFAPSA-N 0 3 410.533 4.118 20 0 HIADHN C[C@H]1CCc2c(F)cccc2[C@@H]1NC(=O)N(C)C1CCN(CCc2ccccn2)CC1 ZINC000431740375 858779274 /nfs/dbraw/zinc/77/92/74/858779274.db2.gz GWSIWNSBYJJOCL-MHECFPHRSA-N 0 3 424.564 4.193 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3c(Cl)cc(F)cc3Cl)CC2)C[C@@H](C)O1 ZINC000431832388 858832037 /nfs/dbraw/zinc/83/20/37/858832037.db2.gz GEBFLGVVVDQPLX-ZIAGYGMSSA-N 0 3 417.352 4.484 20 0 HIADHN COC(=O)CCn1nc(C)c(CN2CCC(F)(c3ccc(Cl)cc3)CC2)c1C ZINC000467539435 881359563 /nfs/dbraw/zinc/35/95/63/881359563.db2.gz HQYAPRIWMXQKOX-UHFFFAOYSA-N 0 3 407.917 4.177 20 0 HIADHN CCN(c1ccccc1)c1cc(N(C)C[C@@H]2CCN(C)[C@H]2c2cccnc2)ncn1 ZINC000432132761 859008293 /nfs/dbraw/zinc/00/82/93/859008293.db2.gz GSFUYZKURFPDRY-RDPSFJRHSA-N 0 3 402.546 4.159 20 0 HIADHN O=C(Nc1ccc(Oc2ccc(Cl)cn2)cc1)[C@H]1CCCN1C1CCOCC1 ZINC000432195558 859041816 /nfs/dbraw/zinc/04/18/16/859041816.db2.gz LGCNDNZPSASOMF-LJQANCHMSA-N 0 3 401.894 4.109 20 0 HIADHN COc1ccc([C@@H](CNCc2csc(Cl)c2Cl)N2CCOCC2)cc1 ZINC000432238196 859062648 /nfs/dbraw/zinc/06/26/48/859062648.db2.gz OCPLYYNRGHMONW-MRXNPFEDSA-N 0 3 401.359 4.227 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N[C@H](c3ccc(F)cc3)C(F)(F)F)cc2)CC1 ZINC000467554863 881377255 /nfs/dbraw/zinc/37/72/55/881377255.db2.gz RJWPFESOPNFZQO-LJQANCHMSA-N 0 3 409.427 4.001 20 0 HIADHN CC(F)(F)c1ccc(CNC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cc1 ZINC000432368441 859126035 /nfs/dbraw/zinc/12/60/35/859126035.db2.gz PXDVCQKMDLNQJP-UHFFFAOYSA-N 0 3 419.438 4.403 20 0 HIADHN Cc1cnc(C2CCN(C(=O)[C@H]3CCCN(Cc4cccc(F)c4)C3)CC2)s1 ZINC000432483480 859186367 /nfs/dbraw/zinc/18/63/67/859186367.db2.gz OXDZCXGKGNYODL-IBGZPJMESA-N 0 3 401.551 4.209 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)c1cncc(-c2ccc3c(c2)CCO3)c1 ZINC000432653991 859275076 /nfs/dbraw/zinc/27/50/76/859275076.db2.gz FZXOFIMHIZAKHK-UHFFFAOYSA-N 0 3 419.500 4.027 20 0 HIADHN Cc1ccc(-c2cccnc2)cc1NC(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000432792422 859362069 /nfs/dbraw/zinc/36/20/69/859362069.db2.gz KPYBFBLOXSWFNU-WOJBJXKFSA-N 0 3 422.573 4.410 20 0 HIADHN CN(CCCNC(=O)C1CCC1)Cc1cccc(NC(=O)c2ccccc2Cl)c1 ZINC000432794348 859364103 /nfs/dbraw/zinc/36/41/03/859364103.db2.gz SUEDCBLGALJKNT-UHFFFAOYSA-N 0 3 413.949 4.331 20 0 HIADHN COc1ccc(N(Cc2cccs2)S(=O)(=O)c2ccc(CN(C)C)cc2)cc1 ZINC000432941916 859440213 /nfs/dbraw/zinc/44/02/13/859440213.db2.gz ZOJOFCCTOSRCIF-UHFFFAOYSA-N 0 3 416.568 4.214 20 0 HIADHN C/C=C\c1ccc(OC[C@@H](O)CN2CCC(c3ncc(C)s3)CC2)c(OC)c1 ZINC000433146954 859540590 /nfs/dbraw/zinc/54/05/90/859540590.db2.gz BSDMWHWPXODWFR-HMECNJMJSA-N 0 3 402.560 4.113 20 0 HIADHN COC[C@@H](NCc1ccc(OCc2ccc(Cl)cc2)c(OC)c1)[C@@H]1CCCO1 ZINC000433208398 859567201 /nfs/dbraw/zinc/56/72/01/859567201.db2.gz NSRPGMBNQCPCJI-UXHICEINSA-N 0 3 405.922 4.211 20 0 HIADHN Cc1ccc(C(=O)NCC(F)(F)F)cc1NC(=O)[C@H]1CCCCN1C1CCCC1 ZINC000433306470 859628843 /nfs/dbraw/zinc/62/88/43/859628843.db2.gz SDXMKFXUAKPGTB-GOSISDBHSA-N 0 3 411.468 4.023 20 0 HIADHN C[C@@H](NCCNC(=O)CC1CCCC1)c1ccc(OC[C@@H]2CCCCO2)c(F)c1 ZINC000433369868 859661215 /nfs/dbraw/zinc/66/12/15/859661215.db2.gz ANYVRDUKKQYXCS-XLIONFOSSA-N 0 3 406.542 4.121 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)c2ccc(-c3nc(C4CC4)no3)cc2)C1 ZINC000433421126 859691534 /nfs/dbraw/zinc/69/15/34/859691534.db2.gz NLYSZUHGYHSFAO-IIBYNOLFSA-N 0 3 402.498 4.179 20 0 HIADHN CCOc1ccc2c(c1)CCN(CCC(=O)Nc1cc(OC)c(Cl)cc1OC)C2 ZINC000433449924 859707587 /nfs/dbraw/zinc/70/75/87/859707587.db2.gz JTAYZCVFOVFNBB-UHFFFAOYSA-N 0 3 418.921 4.143 20 0 HIADHN O=C(NCc1ccccc1)[C@@H](N[C@H]1CCOC2(CCSCC2)C1)c1ccccc1 ZINC000433460963 859714468 /nfs/dbraw/zinc/71/44/68/859714468.db2.gz COBRVEMJDFETBF-VXKWHMMOSA-N 0 3 410.583 4.079 20 0 HIADHN COc1ccc([C@@H](CNC(=O)Nc2c3c(ccc2Cl)OCC3)N2CCCC2)cc1 ZINC000433478198 859721686 /nfs/dbraw/zinc/72/16/86/859721686.db2.gz QPYGYOLSOWTWFW-LJQANCHMSA-N 0 3 415.921 4.242 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)Nc3ccc(Oc4ncc(Cl)cn4)c(Cl)c3)[C@@H]2C1 ZINC000433670862 859832661 /nfs/dbraw/zinc/83/26/61/859832661.db2.gz SZQCHENCLWTCFX-BLLLJJGKSA-N 0 3 422.316 4.134 20 0 HIADHN Cn1cc(-c2cc(F)ccc2NC(=O)N[C@H](CN2CCCC2)c2ccccc2)cn1 ZINC000433791423 859893968 /nfs/dbraw/zinc/89/39/68/859893968.db2.gz CVJWGZVDPXCADO-JOCHJYFZSA-N 0 3 407.493 4.185 20 0 HIADHN Cn1cc(-c2cc(F)ccc2NC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)cn1 ZINC000433800235 859898622 /nfs/dbraw/zinc/89/86/22/859898622.db2.gz VGGDEJHLXLCMHO-FQEVSTJZSA-N 0 3 407.493 4.012 20 0 HIADHN C[C@H]1C[C@H](NC(=O)Nc2ccc(F)cc2-c2cnn(C)c2)CN1Cc1ccccc1 ZINC000433803522 859899937 /nfs/dbraw/zinc/89/99/37/859899937.db2.gz UPZSFMUQFQQPQK-JXFKEZNVSA-N 0 3 407.493 4.011 20 0 HIADHN CCN(C(=O)Nc1noc(-c2ccccc2F)c1C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000433927575 859977616 /nfs/dbraw/zinc/97/76/16/859977616.db2.gz SSIUYDXGMZCUSF-IBGZPJMESA-N 0 3 422.504 4.917 20 0 HIADHN COc1ccc([C@@H](NC(=O)NC[C@@H]2CCCCN2C2CC2)c2ccccc2OC)cc1 ZINC000433942213 859989364 /nfs/dbraw/zinc/98/93/64/859989364.db2.gz PDUQXISEDSOFLN-GBXCKJPGSA-N 0 3 423.557 4.109 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1ccc(-c2nc(C3CC3)no2)cc1)c1ccsc1 ZINC000433950671 859997984 /nfs/dbraw/zinc/99/79/84/859997984.db2.gz PHCLGPOPSKRTRC-IBGZPJMESA-N 0 3 410.543 4.488 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)NC[C@@H]1CCCN(c2ccccc2)C1 ZINC000433974576 860010782 /nfs/dbraw/zinc/01/07/82/860010782.db2.gz AUYDKMTXWICTDI-PZJWPPBQSA-N 0 3 412.603 4.101 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)NC[C@H]1CCCN(c2ccccc2)C1 ZINC000433974571 860010896 /nfs/dbraw/zinc/01/08/96/860010896.db2.gz AUYDKMTXWICTDI-CTNGQTDRSA-N 0 3 412.603 4.101 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)c2cc(NC(=O)C(C)(C)C)ccc2F)CN1Cc1ccccc1 ZINC000467694736 881489056 /nfs/dbraw/zinc/48/90/56/881489056.db2.gz BTQLTBHVSBJSTN-VQIMIIECSA-N 0 3 411.521 4.203 20 0 HIADHN Cc1ccc(C(=O)N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)cc1NC(=O)NC(C)(C)C ZINC000467696677 881491132 /nfs/dbraw/zinc/49/11/32/881491132.db2.gz VYNAYGGJAYAZHJ-RXVVDRJESA-N 0 3 422.573 4.308 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)Cc2csc(Cc3ccc(F)cc3)n2)CN1Cc1ccccc1 ZINC000467696719 881491273 /nfs/dbraw/zinc/49/12/73/881491273.db2.gz JLIOHPDRNQEMPI-UTKZUKDTSA-N 0 3 423.557 4.195 20 0 HIADHN Cc1ccn(C2CCN(C(=O)NC[C@@H](c3cccs3)N3CCC(C)CC3)CC2)n1 ZINC000434005134 860033930 /nfs/dbraw/zinc/03/39/30/860033930.db2.gz VMFAIYXDRJDDQV-FQEVSTJZSA-N 0 3 415.607 4.073 20 0 HIADHN C[C@H]1C[C@H](NC(=O)c2cccc(NC(=O)c3cccs3)c2)CN1Cc1ccccc1 ZINC000467700857 881496004 /nfs/dbraw/zinc/49/60/04/881496004.db2.gz OFXINIOXJAFAEW-UWJYYQICSA-N 0 3 419.550 4.393 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)Nc1cccc(-c2noc(C3CC3)n2)c1 ZINC000434078179 860086615 /nfs/dbraw/zinc/08/66/15/860086615.db2.gz BFDIEFIDILUVKR-UHFFFAOYSA-N 0 3 405.502 4.210 20 0 HIADHN Cc1ccc(-c2ccc(Cl)cc2NC(=O)N[C@H](C)CCN2CCN(C)CC2)o1 ZINC000434220916 860206098 /nfs/dbraw/zinc/20/60/98/860206098.db2.gz QSLWJQHNRDFBMF-OAHLLOKOSA-N 0 3 404.942 4.056 20 0 HIADHN C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)c1ccc(CSc2nc3ccccc3[nH]2)cc1 ZINC000467714204 881511587 /nfs/dbraw/zinc/51/15/87/881511587.db2.gz PCWXBLFITQUPGO-QVKFZJNVSA-N 0 3 406.555 4.068 20 0 HIADHN C[C@H]1CN(C2CC2)C[C@@H]1NC(=O)c1ccccc1-c1ncc(-c2ccccc2F)o1 ZINC000467718818 881517746 /nfs/dbraw/zinc/51/77/46/881517746.db2.gz UAPIDONJHPVGDR-BTYIYWSLSA-N 0 3 405.473 4.360 20 0 HIADHN C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)c1cc(-c2ccc(F)cc2)nc2onc(C3CC3)c21 ZINC000467718119 881516976 /nfs/dbraw/zinc/51/69/76/881516976.db2.gz LBOYXXDXASIYEH-ZUOKHONESA-N 0 3 420.488 4.119 20 0 HIADHN COCc1ccc(C(=O)Nc2c(C)cnn2[C@@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000434314969 860275707 /nfs/dbraw/zinc/27/57/07/860275707.db2.gz IGHFHDYWTAKGQY-JOCHJYFZSA-N 0 3 404.514 4.037 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)[C@H](C)Oc1ccccc1F ZINC000434320438 860281219 /nfs/dbraw/zinc/28/12/19/860281219.db2.gz CESNSGDVFLCECO-ICSRJNTNSA-N 0 3 422.504 4.184 20 0 HIADHN CCCCS[C@@H](C)C(=O)Nc1c(C)cnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000434322096 860282132 /nfs/dbraw/zinc/28/21/32/860282132.db2.gz TXWNYNUWNXEMOI-ICSRJNTNSA-N 0 3 400.592 4.499 20 0 HIADHN CCSc1ccc(C(=O)Nc2c(C)cnn2[C@@H]2CCN(Cc3ccccc3)C2)cn1 ZINC000434321818 860282180 /nfs/dbraw/zinc/28/21/80/860282180.db2.gz RMDXRMRCPILYCO-HXUWFJFHSA-N 0 3 421.570 4.398 20 0 HIADHN COc1ccc(C(=O)Nc2c(C)cnn2[C@H]2CCN(Cc3ccccc3)C2)c(C)c1 ZINC000434323221 860283835 /nfs/dbraw/zinc/28/38/35/860283835.db2.gz ZPDBTDKTTWHEPZ-FQEVSTJZSA-N 0 3 404.514 4.208 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)[C@H](C)Oc1cccc(F)c1 ZINC000434323306 860284369 /nfs/dbraw/zinc/28/43/69/860284369.db2.gz HWUSNOVHYQVFHY-GHTZIAJQSA-N 0 3 422.504 4.184 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)[C@@H](C)Oc1ccc(F)cc1 ZINC000434323433 860284942 /nfs/dbraw/zinc/28/49/42/860284942.db2.gz JBZSWNKGVZCOKV-NQIIRXRSSA-N 0 3 422.504 4.184 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)[C@@H](C)Oc1cccc(F)c1 ZINC000434323309 860285189 /nfs/dbraw/zinc/28/51/89/860285189.db2.gz HWUSNOVHYQVFHY-WIYYLYMNSA-N 0 3 422.504 4.184 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1cccc2ncccc21 ZINC000434327973 860289847 /nfs/dbraw/zinc/28/98/47/860289847.db2.gz SUEDPUPGLKMARH-FQEVSTJZSA-N 0 3 411.509 4.439 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)CCOc1ccc(F)cc1 ZINC000434330057 860291716 /nfs/dbraw/zinc/29/17/16/860291716.db2.gz IHKTXVGDZBXSRD-OAQYLSRUSA-N 0 3 422.504 4.185 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)CCc1cccc(F)c1F ZINC000434330962 860293477 /nfs/dbraw/zinc/29/34/77/860293477.db2.gz UJCYFUAYXOMGKT-FQEVSTJZSA-N 0 3 424.495 4.488 20 0 HIADHN CCO[C@@H](CC(=O)Nc1c(C)cnn1[C@@H]1CCN(Cc2ccccc2)C1)C1=CCCC1 ZINC000434333132 860295494 /nfs/dbraw/zinc/29/54/94/860295494.db2.gz DKJDYFMTLLGDOU-PKTZIBPZSA-N 0 3 422.573 4.483 20 0 HIADHN CCCc1ncc(C(=O)Nc2c(C)cnn2[C@H]2CCN(Cc3ccccc3)C2)s1 ZINC000434334399 860296181 /nfs/dbraw/zinc/29/61/81/860296181.db2.gz QMGIJIUMHSXEGL-SFHVURJKSA-N 0 3 409.559 4.300 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1ccc2ccccc2n1 ZINC000434334821 860296283 /nfs/dbraw/zinc/29/62/83/860296283.db2.gz SKNSDYRYYCWPME-OAQYLSRUSA-N 0 3 411.509 4.439 20 0 HIADHN Cc1nc(CNC(=O)NC[C@H]2CCCCN2C2CC2)oc1-c1ccc(Cl)cc1 ZINC000434357162 860308795 /nfs/dbraw/zinc/30/87/95/860308795.db2.gz JZGLMQFTQFFBCS-GOSISDBHSA-N 0 3 402.926 4.120 20 0 HIADHN CCCNc1ccc(CNC(=O)NC[C@H](c2ccc(OC)cc2)N2CCCC2)cc1 ZINC000434452507 860356614 /nfs/dbraw/zinc/35/66/14/860356614.db2.gz FMEIEMIXIOOIPP-HSZRJFAPSA-N 0 3 410.562 4.153 20 0 HIADHN CCCNc1ccc(CNC(=O)N(CCN(C)C)Cc2cccc(Cl)c2)cc1 ZINC000434451734 860356967 /nfs/dbraw/zinc/35/69/67/860356967.db2.gz GWTVRCURMXIYEG-UHFFFAOYSA-N 0 3 402.970 4.435 20 0 HIADHN CCCNc1ccc(CNC(=O)NC[C@@H](c2cccc(OC)c2)N2CCCC2)cc1 ZINC000434458809 860359580 /nfs/dbraw/zinc/35/95/80/860359580.db2.gz HNZMKSVHWZMRBS-QHCPKHFHSA-N 0 3 410.562 4.153 20 0 HIADHN C[C@H](N[C@H]1CCCN(CC(F)(F)F)C1=O)c1cccc(OCc2ccccc2)c1 ZINC000434636388 860442591 /nfs/dbraw/zinc/44/25/91/860442591.db2.gz ZIOGBHXVYMDBPY-JXFKEZNVSA-N 0 3 406.448 4.470 20 0 HIADHN C[C@H](C(=O)N1CCC[C@@H]1c1cccs1)N1CCC(c2ncc3n2CCCC3)CC1 ZINC000434689001 860462084 /nfs/dbraw/zinc/46/20/84/860462084.db2.gz RUNZOBWRYFAXQN-YLJYHZDGSA-N 0 3 412.603 4.213 20 0 HIADHN C[C@H]1CN(CCCCNC(=O)c2csc(-c3ccc(Cl)s3)n2)C[C@H](C)O1 ZINC000434757044 860483320 /nfs/dbraw/zinc/48/33/20/860483320.db2.gz FCTDVCDIBPGMFZ-STQMWFEESA-N 0 3 413.996 4.144 20 0 HIADHN C[C@@H](C(=O)Nc1ccccc1C(F)(F)F)N1CCC(c2ncc3n2CCCC3)CC1 ZINC000434759392 860484380 /nfs/dbraw/zinc/48/43/80/860484380.db2.gz VZYZKZACVDRKEU-HNNXBMFYSA-N 0 3 420.479 4.445 20 0 HIADHN COc1cc(NC(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)c(C)cc1C ZINC000434897183 860542421 /nfs/dbraw/zinc/54/24/21/860542421.db2.gz SDTUXVKTHIAGMS-RTBURBONSA-N 0 3 403.567 4.055 20 0 HIADHN COc1cc(CN2CCC[C@@H](C(N)=O)C2)ccc1OCc1ccc(Cl)cc1Cl ZINC000434976551 860583071 /nfs/dbraw/zinc/58/30/71/860583071.db2.gz COSAAKAWCOGZST-OAHLLOKOSA-N 0 3 423.340 4.278 20 0 HIADHN COc1cc(Br)c(CNC[C@H]2CCCN(c3ccccc3)C2)cc1O ZINC000435036638 860609791 /nfs/dbraw/zinc/60/97/91/860609791.db2.gz TWNHFFRLIBRWRF-OAHLLOKOSA-N 0 3 405.336 4.170 20 0 HIADHN CCc1cc(C)cc(CC)c1NC(=O)NCc1ccc(CN2CCN(C)CC2)cc1 ZINC000435168635 860674865 /nfs/dbraw/zinc/67/48/65/860674865.db2.gz NECKSEUGQZKJKP-UHFFFAOYSA-N 0 3 408.590 4.189 20 0 HIADHN Cc1nc2cc(Cl)c(NC(=O)NC3CCN(CCOC(C)C)CC3)cc2s1 ZINC000435190178 860687184 /nfs/dbraw/zinc/68/71/84/860687184.db2.gz YGMLWAGGENUBKS-UHFFFAOYSA-N 0 3 410.971 4.269 20 0 HIADHN Cc1cc(NC(=O)c2cc3c(s2)CCC3)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435267028 860708472 /nfs/dbraw/zinc/70/84/72/860708472.db2.gz LERWNAMTOAMERH-IBGZPJMESA-N 0 3 406.555 4.441 20 0 HIADHN Cc1cc(NC(=O)Cc2cccc(F)c2F)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435266314 860708560 /nfs/dbraw/zinc/70/85/60/860708560.db2.gz JKTJVBQETIVDCS-IBGZPJMESA-N 0 3 410.468 4.098 20 0 HIADHN CCCCn1ncc(C(=O)Nc2c(C)cnn2[C@@H]2CCN(Cc3ccccc3)C2)c1C ZINC000435272632 860711351 /nfs/dbraw/zinc/71/13/51/860711351.db2.gz ZBKRCSPFVHITAV-OAQYLSRUSA-N 0 3 420.561 4.196 20 0 HIADHN Cc1cc(NC(=O)[C@H](C)OCc2ccccc2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435273237 860711441 /nfs/dbraw/zinc/71/14/41/860711441.db2.gz XUDYOCOTJKEASB-NZQKXSOJSA-N 0 3 418.541 4.182 20 0 HIADHN Cc1cc(NC(=O)CSc2ccccc2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435274398 860712614 /nfs/dbraw/zinc/71/26/14/860712614.db2.gz IYGOVXJEWQNMKS-FQEVSTJZSA-N 0 3 406.555 4.369 20 0 HIADHN Cc1cc(NC(=O)CCc2ccc(F)cc2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435280965 860715879 /nfs/dbraw/zinc/71/58/79/860715879.db2.gz OYZBEGNCWGVJSB-JOCHJYFZSA-N 0 3 406.505 4.349 20 0 HIADHN Cc1cc(NC(=O)c2ccc(F)c(F)c2F)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435280661 860716306 /nfs/dbraw/zinc/71/63/06/860716306.db2.gz UCWNATFCWMTAMP-INIZCTEOSA-N 0 3 414.431 4.308 20 0 HIADHN Cc1cc(NC(=O)Cc2cc(C)ccc2C)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435281912 860717268 /nfs/dbraw/zinc/71/72/68/860717268.db2.gz RATKPDNWGOOEQH-HSZRJFAPSA-N 0 3 402.542 4.437 20 0 HIADHN CC(=O)c1ccc(C(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000435286670 860720373 /nfs/dbraw/zinc/72/03/73/860720373.db2.gz XGGNBEFRXFSRSK-JOCHJYFZSA-N 0 3 402.498 4.093 20 0 HIADHN CC(=O)c1c(C)[nH]c(C(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)c1C ZINC000435292362 860722392 /nfs/dbraw/zinc/72/23/92/860722392.db2.gz YLFZFVDBQLFJAZ-HXUWFJFHSA-N 0 3 419.529 4.038 20 0 HIADHN Cc1cc(NC(=O)c2cccc(C(C)C)n2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435293261 860723280 /nfs/dbraw/zinc/72/32/80/860723280.db2.gz WUFORTSKKOUPKZ-HXUWFJFHSA-N 0 3 403.530 4.409 20 0 HIADHN COc1cc(CCC(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)ccc1Cl ZINC000435342945 860749792 /nfs/dbraw/zinc/74/97/92/860749792.db2.gz KAKYXFXNXCVKNA-ROUUACIJSA-N 0 3 422.997 4.019 20 0 HIADHN Cc1cccc(OCCCC(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000435369276 860766816 /nfs/dbraw/zinc/76/68/16/860766816.db2.gz DCQVVSKCFLKDNL-QFIPXVFZSA-N 0 3 418.541 4.436 20 0 HIADHN O=C(Cc1c[nH]c2cc(F)ccc12)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435370636 860768232 /nfs/dbraw/zinc/76/82/32/860768232.db2.gz PTLONGKEKNFVKF-FQEVSTJZSA-N 0 3 417.488 4.132 20 0 HIADHN COc1cccc(SCC(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000435370522 860768410 /nfs/dbraw/zinc/76/84/10/860768410.db2.gz JBPABLBQQRDJHJ-IBGZPJMESA-N 0 3 422.554 4.070 20 0 HIADHN Cc1ccccc1SCC(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435371322 860769617 /nfs/dbraw/zinc/76/96/17/860769617.db2.gz UMXUMBFNLZTVDC-HXUWFJFHSA-N 0 3 406.555 4.369 20 0 HIADHN O=C(CSc1ccc(F)cc1)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435372867 860770906 /nfs/dbraw/zinc/77/09/06/860770906.db2.gz SUXXPXLKOIFUFB-IBGZPJMESA-N 0 3 410.518 4.200 20 0 HIADHN Cc1ccc(C)c(OCCC(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000435373417 860771396 /nfs/dbraw/zinc/77/13/96/860771396.db2.gz URTVTUQVPODLKB-QFIPXVFZSA-N 0 3 418.541 4.355 20 0 HIADHN O=C(COc1cccc(Cl)c1)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435373970 860772010 /nfs/dbraw/zinc/77/20/10/860772010.db2.gz OPMKNRJEZFEHTJ-LJQANCHMSA-N 0 3 410.905 4.001 20 0 HIADHN Cc1cc(C(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)c2ccccc2n1 ZINC000435373326 860772026 /nfs/dbraw/zinc/77/20/26/860772026.db2.gz DOFHVVWWTPAHRK-FQEVSTJZSA-N 0 3 411.509 4.439 20 0 HIADHN O=C(CCc1cccc(C(F)(F)F)c1)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000467761716 881577982 /nfs/dbraw/zinc/57/79/82/881577982.db2.gz CLNPBUKITNVSTD-UHFFFAOYSA-N 0 3 406.448 4.233 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)[C@@H]1CSc2ccccc21 ZINC000435374199 860773081 /nfs/dbraw/zinc/77/30/81/860773081.db2.gz HSISIJSUGMRVPT-UYAOXDASSA-N 0 3 404.539 4.158 20 0 HIADHN C[C@H](OC1CCCCCC1)C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435374951 860773223 /nfs/dbraw/zinc/77/32/23/860773223.db2.gz KGZLPUNGVLQSHX-FPOVZHCZSA-N 0 3 410.562 4.397 20 0 HIADHN Cc1cc(NC(=O)N(C)[C@@H](C)c2ccncc2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435521789 860838832 /nfs/dbraw/zinc/83/88/32/860838832.db2.gz YBECLMSXJGYVLU-UGKGYDQZSA-N 0 3 418.545 4.258 20 0 HIADHN Cc1cc(NC(=O)N2CCc3ccccc32)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435522568 860840138 /nfs/dbraw/zinc/84/01/38/860840138.db2.gz NWESJTRLNMDFMW-NRFANRHFSA-N 0 3 401.514 4.233 20 0 HIADHN Cc1cc(NC(=O)NCCCC(F)(F)F)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435528316 860844631 /nfs/dbraw/zinc/84/46/31/860844631.db2.gz VLFFSZAFZYZYCX-KRWDZBQOSA-N 0 3 409.456 4.103 20 0 HIADHN Cc1cc(NC(=O)N(C)Cc2cnc(C)s2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435529119 860844843 /nfs/dbraw/zinc/84/48/43/860844843.db2.gz DZTRBIZLACTAKQ-LJQANCHMSA-N 0 3 424.574 4.067 20 0 HIADHN Cc1csc([C@@H](C)NC(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435532387 860848712 /nfs/dbraw/zinc/84/87/12/860848712.db2.gz DUKPMRHGQXVHNJ-IEBWSBKVSA-N 0 3 424.574 4.286 20 0 HIADHN Cc1cc(NC(=O)NCCc2cccc(F)c2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435533696 860849831 /nfs/dbraw/zinc/84/98/31/860849831.db2.gz KBYXJFYYZICSJT-QFIPXVFZSA-N 0 3 421.520 4.142 20 0 HIADHN Cc1cc(NC(=O)N[C@@H](C)c2ncc(C)s2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435538881 860852559 /nfs/dbraw/zinc/85/25/59/860852559.db2.gz ZNGQHRWOYZHYEC-PKOBYXMFSA-N 0 3 424.574 4.286 20 0 HIADHN Cc1cc(C)n(-c2ccc(NC(=O)N(C)[C@@H]3CCCN(Cc4ccccc4)C3)cn2)n1 ZINC000467775756 881595018 /nfs/dbraw/zinc/59/50/18/881595018.db2.gz HWEAUSNMPKBRSB-JOCHJYFZSA-N 0 3 418.545 4.012 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N(Cc2cc(F)ccc2F)C2CCCC2)CC1 ZINC000435559850 860880169 /nfs/dbraw/zinc/88/01/69/860880169.db2.gz KCBDUPIOMMPZNI-UHFFFAOYSA-N 0 3 423.548 4.308 20 0 HIADHN Cc1c(NC(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)cnn1-c1ccccc1F ZINC000435564570 860885674 /nfs/dbraw/zinc/88/56/74/860885674.db2.gz PNMDBZMWDPXNLB-HXUWFJFHSA-N 0 3 421.520 4.448 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N[C@H]3C[C@H](c4ccccc4F)C3)c(C)c2)CC1 ZINC000435731327 861013509 /nfs/dbraw/zinc/01/35/09/861013509.db2.gz JKFFKTDQGOSTLO-WGSAOQKQSA-N 0 3 410.537 4.344 20 0 HIADHN COc1cc([C@@H](C)NCc2ccc(N(C)c3ccccc3)nc2)ccc1OCCO ZINC000435776279 861051518 /nfs/dbraw/zinc/05/15/18/861051518.db2.gz CRZBCYMWOBTCGK-GOSISDBHSA-N 0 3 407.514 4.080 20 0 HIADHN C[C@H]1CN(Cc2cccc(CNCc3ccc(N(C)c4ccccc4)nc3)c2)CCO1 ZINC000435777587 861053312 /nfs/dbraw/zinc/05/33/12/861053312.db2.gz DIYONBXWDGHKSQ-NRFANRHFSA-N 0 3 416.569 4.360 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(Br)cc1)C(=O)NCCc1c[nH]c2ccccc12 ZINC000435893620 861149449 /nfs/dbraw/zinc/14/94/49/861149449.db2.gz QTUXBLYDWSXDFC-GJZGRUSLSA-N 0 3 414.347 4.328 20 0 HIADHN C[C@@H]1CCN(C(=O)Nc2ccc(OCC(F)(F)F)nc2)CCN1Cc1ccccc1 ZINC000437784706 863102426 /nfs/dbraw/zinc/10/24/26/863102426.db2.gz KIQFGQUFRNIJJC-MRXNPFEDSA-N 0 3 422.451 4.151 20 0 HIADHN Cc1noc(C)c1COc1cc2ccccc2cc1C(=O)N[C@@H]1CN(C2CC2)C[C@@H]1C ZINC000467802935 881627590 /nfs/dbraw/zinc/62/75/90/881627590.db2.gz LKQAOGGLNJWNKG-NPMXOYFQSA-N 0 3 419.525 4.236 20 0 HIADHN Cc1noc(C)c1COc1cc2ccccc2cc1C(=O)N[C@H]1CN(C2CC2)C[C@@H]1C ZINC000467802936 881628105 /nfs/dbraw/zinc/62/81/05/881628105.db2.gz LKQAOGGLNJWNKG-WNSKOXEYSA-N 0 3 419.525 4.236 20 0 HIADHN Cc1c(NC(=O)N[C@H]2CCN(Cc3ccccc3)C2)cnn1-c1cc(C)ccc1C ZINC000437806126 863130153 /nfs/dbraw/zinc/13/01/53/863130153.db2.gz XEZKMFBTJGWLIG-NRFANRHFSA-N 0 3 403.530 4.194 20 0 HIADHN C[C@H]1CCN(C(=O)Nc2ccc(-c3csnn3)cc2)CCN1Cc1ccccc1 ZINC000437826847 863173205 /nfs/dbraw/zinc/17/32/05/863173205.db2.gz YJUCLIZFWSAPEQ-KRWDZBQOSA-N 0 3 407.543 4.333 20 0 HIADHN Cc1ccc2cc(CN(C)[C@H](C)c3cccc(N4CCCS4(=O)=O)c3)ccc2n1 ZINC000437954449 863325975 /nfs/dbraw/zinc/32/59/75/863325975.db2.gz KRHTXNAUVDDQSU-GOSISDBHSA-N 0 3 409.555 4.276 20 0 HIADHN C[C@H]1CCN(C(=O)Nc2ccc3c(c2)CCCC(=O)N3)CCN1Cc1ccccc1 ZINC000438001277 863362625 /nfs/dbraw/zinc/36/26/25/863362625.db2.gz RMNLAMHRYOUFEG-SFHVURJKSA-N 0 3 406.530 4.090 20 0 HIADHN CC[C@@H](NCc1cccc(NC(=O)CCN2CCOCC2)c1)c1cccc(Cl)c1 ZINC000467837561 881672999 /nfs/dbraw/zinc/67/29/99/881672999.db2.gz CZNYENOQRQEQKB-JOCHJYFZSA-N 0 3 415.965 4.242 20 0 HIADHN Cc1cnc([C@H](NC(=O)Nc2ccc(CCN3CCSCC3)cc2)C2CC2)s1 ZINC000438108225 863524849 /nfs/dbraw/zinc/52/48/49/863524849.db2.gz YFCPQQIHXRNVJR-LJQANCHMSA-N 0 3 416.616 4.316 20 0 HIADHN C[C@@H](NCc1cccc(NC(=O)[C@@H]2CCCO2)c1)c1cccc(Br)c1 ZINC000467839676 881677930 /nfs/dbraw/zinc/67/79/30/881677930.db2.gz DYHUQTNEZPRDLF-KUHUBIRLSA-N 0 3 403.320 4.417 20 0 HIADHN C[C@H](Cc1ccccc1F)NCc1cccnc1Oc1cccc(S(C)(=O)=O)c1 ZINC000438199305 863629111 /nfs/dbraw/zinc/62/91/11/863629111.db2.gz LDSDVYWBLIOTNL-MRXNPFEDSA-N 0 3 414.502 4.137 20 0 HIADHN Cc1ccc(-c2nc3cc(F)ccc3n2C)cc1NC(=O)N1CC[C@H](N2CC=CC2)C1 ZINC000438255368 863720383 /nfs/dbraw/zinc/72/03/83/863720383.db2.gz HDXXRDQTAILYDY-IBGZPJMESA-N 0 3 419.504 4.166 20 0 HIADHN CCSc1ccc(Cl)cc1C(=O)NCc1ccc(CN2CCN(C)CC2)cc1 ZINC000438275079 863744459 /nfs/dbraw/zinc/74/44/59/863744459.db2.gz POLAXKQFZWELKB-UHFFFAOYSA-N 0 3 418.006 4.129 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Nc1cc(N2CCCC2=O)ccc1Cl ZINC000438325958 863803279 /nfs/dbraw/zinc/80/32/79/863803279.db2.gz VDCHEUMVYIRHPQ-UHFFFAOYSA-N 0 3 420.966 4.124 20 0 HIADHN CN(CCN1CCN(C(=O)Nc2ccc(OC(C)(C)C)cc2)CC1)Cc1ccccc1 ZINC000438367373 863828627 /nfs/dbraw/zinc/82/86/27/863828627.db2.gz MRZBBPAWYOAKMT-UHFFFAOYSA-N 0 3 424.589 4.145 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3ccc(OC(C)(C)C)cc3)CC2)C[C@@H](C)O1 ZINC000438390081 863842566 /nfs/dbraw/zinc/84/25/66/863842566.db2.gz GRMCDVGPESBDGW-QZTJIDSGSA-N 0 3 403.567 4.217 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)N[C@H]1C[C@H](c2cc(F)cc(F)c2)C1 ZINC000438434169 863863813 /nfs/dbraw/zinc/86/38/13/863863813.db2.gz AIMYXINGQDAONA-CYWCHRQTSA-N 0 3 405.464 4.123 20 0 HIADHN CC[C@H](CNC(=O)Nc1ccc(C(C)(C)C(=O)OC)cc1)N1CCc2ccccc2C1 ZINC000438443351 863869600 /nfs/dbraw/zinc/86/96/00/863869600.db2.gz DYZORPFVEFTYOZ-JOCHJYFZSA-N 0 3 423.557 4.096 20 0 HIADHN COC(=O)C(C)(C)c1ccc(NC(=O)NC[C@H](c2cccs2)N2CCCC2)cc1 ZINC000438448796 863874041 /nfs/dbraw/zinc/87/40/41/863874041.db2.gz BBYJBODBEPWMCM-GOSISDBHSA-N 0 3 415.559 4.157 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)[C@@H]1C[C@@H]1c1ccccc1OC(F)(F)F ZINC000438455562 863879614 /nfs/dbraw/zinc/87/96/14/863879614.db2.gz CMEWKZVDUZWSAZ-IAGOWNOFSA-N 0 3 412.477 4.341 20 0 HIADHN COC(=O)C(C)(C)c1ccc(NC(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)cc1 ZINC000438458391 863881876 /nfs/dbraw/zinc/88/18/76/863881876.db2.gz SQNMGXXIBIZOFD-LAUBAEHRSA-N 0 3 409.530 4.094 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)CCc1ncc(-c2ccc(F)cc2F)o1 ZINC000438459729 863883354 /nfs/dbraw/zinc/88/33/54/863883354.db2.gz LEAPBFYRHLTZKR-UHFFFAOYSA-N 0 3 419.497 4.204 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)Nc2cccc(CSC(C)C)c2C)CC1 ZINC000438472609 863891910 /nfs/dbraw/zinc/89/19/10/863891910.db2.gz ZAEPXLSVDGGINT-SFHVURJKSA-N 0 3 406.640 4.032 20 0 HIADHN COc1ccc([C@H](C)N[C@@H](C)c2cc(F)ccc2N2CCN(C)CC2)cc1OC ZINC000467856984 881706207 /nfs/dbraw/zinc/70/62/07/881706207.db2.gz UCHSKQQZWPQGIG-IRXDYDNUSA-N 0 3 401.526 4.007 20 0 HIADHN CCN(CC)C(=O)c1ccc(NC(=O)N(Cc2ccccc2)C2CCN(C)CC2)cc1 ZINC000438496026 863915968 /nfs/dbraw/zinc/91/59/68/863915968.db2.gz ANUMBUNTLKPALR-UHFFFAOYSA-N 0 3 422.573 4.297 20 0 HIADHN O=C(NC1CCC2(CCOCC2)CC1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000438529497 863953888 /nfs/dbraw/zinc/95/38/88/863953888.db2.gz SYSREHLJFRVUMC-JOCHJYFZSA-N 0 3 424.507 4.297 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)Nc3c(F)cc(F)cc3F)CC2)c1 ZINC000438532399 863959239 /nfs/dbraw/zinc/95/92/39/863959239.db2.gz ZUCZHCNKYRIVAK-UHFFFAOYSA-N 0 3 420.479 4.136 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)c1cccc(NC(=O)c2cccs2)c1 ZINC000438550152 863980127 /nfs/dbraw/zinc/98/01/27/863980127.db2.gz YFOBOHUCBRSLNQ-UHFFFAOYSA-N 0 3 413.568 4.266 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)Nc1ccc(F)cc1OC(F)F ZINC000438643302 864081243 /nfs/dbraw/zinc/08/12/43/864081243.db2.gz TZDJFHBOACUCHU-UHFFFAOYSA-N 0 3 417.378 4.301 20 0 HIADHN CC(=O)N(Cc1ccc(NC(=O)N(CCN(C)C)Cc2cccs2)cc1)C(C)C ZINC000438644334 864082896 /nfs/dbraw/zinc/08/28/96/864082896.db2.gz ABYRZIHTSXLXQV-UHFFFAOYSA-N 0 3 416.591 4.101 20 0 HIADHN O[C@@H](CO[C@H]1CCCc2ccccc21)CN1CC=C(c2c[nH]c3ncccc23)CC1 ZINC000438650385 864091358 /nfs/dbraw/zinc/09/13/58/864091358.db2.gz POEWPESXFYQYCQ-YKSBVNFPSA-N 0 3 403.526 4.107 20 0 HIADHN CCCOc1ccccc1NC(=O)C(=O)N(CC)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000438656525 864099599 /nfs/dbraw/zinc/09/95/99/864099599.db2.gz OMHIBVSUOOOOPZ-FPOVZHCZSA-N 0 3 423.557 4.098 20 0 HIADHN CCN(C(=O)C(=O)Nc1ccc(SC)cc1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000438656495 864100161 /nfs/dbraw/zinc/10/01/61/864100161.db2.gz PTCSCLSVSIPATM-YLJYHZDGSA-N 0 3 411.571 4.031 20 0 HIADHN COCCOc1c(Cl)cccc1NC(=O)N(CCN(C)C)Cc1cccs1 ZINC000438684328 864148374 /nfs/dbraw/zinc/14/83/74/864148374.db2.gz XNBAHDCCZRQYBZ-UHFFFAOYSA-N 0 3 411.955 4.022 20 0 HIADHN Cc1ccnc(Oc2cc(NC(=O)N(CCN(C)C)Cc3ccccn3)ccc2C)c1 ZINC000438683390 864148706 /nfs/dbraw/zinc/14/87/06/864148706.db2.gz TYENYMAWAIYQHZ-UHFFFAOYSA-N 0 3 419.529 4.481 20 0 HIADHN CC(C)(CNC(=O)Nc1ccc(F)cc1OC(F)F)N1CCc2ccccc2C1 ZINC000438687149 864152354 /nfs/dbraw/zinc/15/23/54/864152354.db2.gz ZWKLTJOQLVSPLX-UHFFFAOYSA-N 0 3 407.436 4.386 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)Nc2ccc(OCC(F)F)cc2)CC1 ZINC000438760662 864255322 /nfs/dbraw/zinc/25/53/22/864255322.db2.gz MEQRENGZUZYGHI-UHFFFAOYSA-N 0 3 403.473 4.459 20 0 HIADHN COc1cc2c(cc1OC)[C@@H](c1ccccc1)N(CCC(=O)N1CCC[C@H]1C)CC2 ZINC000438790641 864283390 /nfs/dbraw/zinc/28/33/90/864283390.db2.gz LIPMNKVNTWRMOI-IQGLISFBSA-N 0 3 408.542 4.052 20 0 HIADHN CCN1CCC[C@@H]1CNC(=O)C(=O)Nc1ccc([C@H](C)Sc2ccccc2)cc1 ZINC000438808567 864298688 /nfs/dbraw/zinc/29/86/88/864298688.db2.gz BSIVYKKYKMDOLR-FXAWDEMLSA-N 0 3 411.571 4.079 20 0 HIADHN Cc1ccsc1[C@@H]1C[C@H]1C(=O)NC1CCN(CCOc2ccc(Cl)cc2)CC1 ZINC000438841802 864334679 /nfs/dbraw/zinc/33/46/79/864334679.db2.gz MNVBCFCYCGFQHX-WOJBJXKFSA-N 0 3 418.990 4.473 20 0 HIADHN COc1ccc([C@H](CNC(=O)Cc2cccc(OC(F)(F)F)c2)N2CCCC2)cc1 ZINC000438898964 864380931 /nfs/dbraw/zinc/38/09/31/864380931.db2.gz AZLBIWXAXDIRMK-FQEVSTJZSA-N 0 3 422.447 4.090 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)C(=O)Nc1cccc2ccccc21 ZINC000439213055 864634632 /nfs/dbraw/zinc/63/46/32/864634632.db2.gz HMDJNCPAVXIVSJ-UHFFFAOYSA-N 0 3 419.550 4.008 20 0 HIADHN CC[C@@H](NC(=O)N(CCN(C)C)Cc1cccs1)c1nc(C(F)(F)F)cs1 ZINC000439274667 864691996 /nfs/dbraw/zinc/69/19/96/864691996.db2.gz NXNZLBVFSYSHRH-CYBMUJFWSA-N 0 3 420.526 4.448 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)[C@@H](CC)OC3CCCC3)c(OCC)c2)CC1 ZINC000439286652 864705973 /nfs/dbraw/zinc/70/59/73/864705973.db2.gz NMTWIVVRPGGFDZ-JOCHJYFZSA-N 0 3 417.594 4.294 20 0 HIADHN O=c1c2ccccc2ncn1CCN1CCC(c2cccc(Br)c2)CC1 ZINC000439327175 864764179 /nfs/dbraw/zinc/76/41/79/864764179.db2.gz VBJSMFGRLVTLRA-UHFFFAOYSA-N 0 3 412.331 4.039 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)N[C@H]1CCc2c1cccc2Br ZINC000439370631 864805858 /nfs/dbraw/zinc/80/58/58/864805858.db2.gz JYJCYCADCMXFTQ-SFHVURJKSA-N 0 3 422.392 4.271 20 0 HIADHN Cc1nc(-c2ccccc2)sc1CNC(=O)N(CCN(C)C)Cc1cccs1 ZINC000439378836 864810535 /nfs/dbraw/zinc/81/05/35/864810535.db2.gz YMHSPEYFRKVGEP-UHFFFAOYSA-N 0 3 414.600 4.453 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)Nc3cc(-c4ccnn4C)ccc3C)c2)CC1 ZINC000439381236 864812033 /nfs/dbraw/zinc/81/20/33/864812033.db2.gz OLSRDXDQXNCBIG-UHFFFAOYSA-N 0 3 418.545 4.181 20 0 HIADHN Cc1nc(C)c([C@H](C)N(C)C[C@@H](O)COc2cc(F)cc(Br)c2)s1 ZINC000439436469 864830464 /nfs/dbraw/zinc/83/04/64/864830464.db2.gz XAQARTLAUJSJNV-XHDPSFHLSA-N 0 3 417.344 4.094 20 0 HIADHN Cc1cccnc1[C@H](NC[C@H](O)COc1cc(F)cc(Br)c1)C(C)C ZINC000439458265 864839136 /nfs/dbraw/zinc/83/91/36/864839136.db2.gz SOFCMJHTLHZVAX-FUHWJXTLSA-N 0 3 411.315 4.018 20 0 HIADHN COc1ccccc1O[C@@H](C)CNCc1cc(Cl)ccc1OC[C@H]1CCCO1 ZINC000439467669 864842801 /nfs/dbraw/zinc/84/28/01/864842801.db2.gz JKMNFQHABFYDQC-QFBILLFUSA-N 0 3 405.922 4.464 20 0 HIADHN Clc1ccc(OC[C@H]2CCCO2)c(CNCCN2CCc3sccc3C2)c1 ZINC000439477067 864845661 /nfs/dbraw/zinc/84/56/61/864845661.db2.gz SLXNUWAZCKRRGF-LJQANCHMSA-N 0 3 406.979 4.107 20 0 HIADHN CCCCCc1ccc(NC(=O)C(=O)NC2CCN([C@H](C)c3ccncc3)CC2)cc1 ZINC000439503606 864856739 /nfs/dbraw/zinc/85/67/39/864856739.db2.gz ISSAOYLDRHYSBW-LJQANCHMSA-N 0 3 422.573 4.095 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(C(F)(F)F)cc1)C(=O)N1CCN(c2ccc(F)cc2)CC1 ZINC000439549753 864876028 /nfs/dbraw/zinc/87/60/28/864876028.db2.gz ODXKDOODIQHFPX-HOTGVXAUSA-N 0 3 423.454 4.232 20 0 HIADHN Cc1ccc(CNC(=O)[C@@H](C)NCc2ccccc2CN(C)Cc2ccco2)cc1 ZINC000439599343 864923186 /nfs/dbraw/zinc/92/31/86/864923186.db2.gz VNVRCZSZIRKBOO-HXUWFJFHSA-N 0 3 405.542 4.015 20 0 HIADHN Cc1cc(-c2cc(C(=O)N(CCN(C)C)C(C)C)c3cnn(C(C)C)c3n2)c(C)o1 ZINC000439622187 864947044 /nfs/dbraw/zinc/94/70/44/864947044.db2.gz DIKFFESYMAWWHO-UHFFFAOYSA-N 0 3 411.550 4.301 20 0 HIADHN CCO[C@@H]1C[C@H](N[C@@H](C)C(=O)Nc2ccc(C)cc2Br)C12CCCC2 ZINC000439653963 864980825 /nfs/dbraw/zinc/98/08/25/864980825.db2.gz VZWXLKBYVMDAGD-JCGIZDLHSA-N 0 3 409.368 4.412 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)CCc2ccc(Br)cc2)CC1 ZINC000439729182 865061678 /nfs/dbraw/zinc/06/16/78/865061678.db2.gz FXMNQPFZXVCXHM-MRXNPFEDSA-N 0 3 416.363 4.119 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)[C@H]2C[C@H]2c2c(F)cccc2Cl)CC1 ZINC000439749394 865079086 /nfs/dbraw/zinc/07/90/86/865079086.db2.gz YKIHRWQQSOKHIW-OLMNPRSZSA-N 0 3 401.913 4.319 20 0 HIADHN C[C@@H](C(=O)NC1CCN([C@@H](C)c2ccncc2)CC1)c1ccc(Br)s1 ZINC000439751351 865080857 /nfs/dbraw/zinc/08/08/57/865080857.db2.gz LRZLGDISHSCTGS-KGLIPLIRSA-N 0 3 422.392 4.351 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)CCCOc2ccc3c(c2)CCCC3)CC1 ZINC000439762279 865087443 /nfs/dbraw/zinc/08/74/43/865087443.db2.gz RSFZJDFYGOUDCQ-FQEVSTJZSA-N 0 3 421.585 4.461 20 0 HIADHN C[C@H](Oc1ccc(Cl)c(Cl)c1)C(=O)NC1CCN([C@@H](C)c2ccncc2)CC1 ZINC000439764206 865088829 /nfs/dbraw/zinc/08/88/29/865088829.db2.gz JPIHXLXXZPMQRE-GJZGRUSLSA-N 0 3 422.356 4.498 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)CCOc2cccc(Cl)c2Cl)CC1 ZINC000439764768 865090903 /nfs/dbraw/zinc/09/09/03/865090903.db2.gz IGROFSRSIOVFAC-HNNXBMFYSA-N 0 3 422.356 4.499 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)CCc2cc(Br)cs2)CC1 ZINC000439767504 865092795 /nfs/dbraw/zinc/09/27/95/865092795.db2.gz PMAHHBSNMKYKQM-AWEZNQCLSA-N 0 3 422.392 4.180 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)C1(Cc2ccccc2F)CC1 ZINC000467986744 881834991 /nfs/dbraw/zinc/83/49/91/881834991.db2.gz YQLZZGGKCVICNA-OAQYLSRUSA-N 0 3 418.516 4.431 20 0 HIADHN COc1ccc(CCC(=O)NC2CCN([C@@H](C)c3ccncc3)CC2)cc1Cl ZINC000439772803 865097878 /nfs/dbraw/zinc/09/78/78/865097878.db2.gz HFULXKMHOAESQM-INIZCTEOSA-N 0 3 401.938 4.018 20 0 HIADHN C[C@H](C(=O)Nc1cccc(CN2CCC(C(N)=O)CC2)c1)c1ccc2ccccc2c1 ZINC000439815596 865132781 /nfs/dbraw/zinc/13/27/81/865132781.db2.gz VQJUBWLELMVBMJ-SFHVURJKSA-N 0 3 415.537 4.279 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)C(=O)Nc1ccccc1NC(C)(C)C ZINC000439844561 865155400 /nfs/dbraw/zinc/15/54/00/865155400.db2.gz VQXYGTQFQBKTPK-QFIPXVFZSA-N 0 3 424.589 4.108 20 0 HIADHN CCN1CCN(CCC(=O)NC(c2ccc(Cl)cc2)c2ccc(Cl)cc2)CC1 ZINC000468006887 881847127 /nfs/dbraw/zinc/84/71/27/881847127.db2.gz VOQMVUCMCRKZRP-UHFFFAOYSA-N 0 3 420.384 4.227 20 0 HIADHN Cc1ccc(NC(=O)NC[C@@H]2CCCN([C@H](C)C(=O)N3[C@H](C)CCC[C@@H]3C)C2)cc1 ZINC000439885179 865197826 /nfs/dbraw/zinc/19/78/26/865197826.db2.gz CCTMAIUIKFLXNX-MHTWAQMVSA-N 0 3 414.594 4.007 20 0 HIADHN CCn1ncc(NC(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)c1C(F)(F)F ZINC000439896712 865208813 /nfs/dbraw/zinc/20/88/13/865208813.db2.gz GHZOREBAFADVDT-INIZCTEOSA-N 0 3 409.456 4.050 20 0 HIADHN Cc1ccc(-c2ccnn2C)cc1NC(=O)NC[C@H](c1ccccc1)N1CCCC1 ZINC000439954512 865248166 /nfs/dbraw/zinc/24/81/66/865248166.db2.gz UMQDOLOMOCBWNM-HSZRJFAPSA-N 0 3 403.530 4.354 20 0 HIADHN COc1ccc2c(c1)[C@@H](N[C@H](C)CC(=O)N(C)Cc1ccccc1Cl)CCO2 ZINC000468025121 881859547 /nfs/dbraw/zinc/85/95/47/881859547.db2.gz FIFVQNVQUZUVAI-QRWLVFNGSA-N 0 3 402.922 4.199 20 0 HIADHN O=C(Cc1ccc(NC(=O)[C@H]2CCCN2C2CCCC2)cc1)N1CCc2ccccc21 ZINC000440144162 865378115 /nfs/dbraw/zinc/37/81/15/865378115.db2.gz KTZZUALPAHAQKH-XMMPIXPASA-N 0 3 417.553 4.164 20 0 HIADHN COc1ccc(OC)c(NC(=O)C[C@@H](C)N[C@H](C)c2cn(C(C)(C)C)nc2C)c1 ZINC000468042247 881871596 /nfs/dbraw/zinc/87/15/96/881871596.db2.gz KNMIUUDJRYOMBO-HUUCEWRRSA-N 0 3 402.539 4.032 20 0 HIADHN CN(C(=O)NCc1cccc(-c2ccccn2)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000440249439 865488270 /nfs/dbraw/zinc/48/82/70/865488270.db2.gz YXFKYXYRGXKUGF-HSZRJFAPSA-N 0 3 400.526 4.165 20 0 HIADHN COc1ccccc1[C@@H](C)NC(=O)[C@H](C)N1CCN(C2CCC(C(C)C)CC2)CC1 ZINC000440310478 865576119 /nfs/dbraw/zinc/57/61/19/865576119.db2.gz AFILITLIILLQFV-GEOZSUPMSA-N 0 3 415.622 4.093 20 0 HIADHN CSc1ccc(CN(C)C(=O)CNC2(c3ccc(Cl)cc3)CCOCC2)cc1 ZINC000440314939 865581649 /nfs/dbraw/zinc/58/16/49/865581649.db2.gz NZBROKJVBMLZIJ-UHFFFAOYSA-N 0 3 418.990 4.316 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)C(C)(C)Cc3cccc(Cl)c3)CC2)C[C@H](C)O1 ZINC000440589903 865827554 /nfs/dbraw/zinc/82/75/54/865827554.db2.gz VUPUCYQSFQDFNZ-ROUUACIJSA-N 0 3 406.998 4.257 20 0 HIADHN CC(C)n1c2ccccc2nc1[C@H]1CCCN(C[C@H](O)COc2ccccc2F)C1 ZINC000440655018 865857949 /nfs/dbraw/zinc/85/79/49/865857949.db2.gz OIZBFGDZWNKZKQ-OALUTQOASA-N 0 3 411.521 4.376 20 0 HIADHN Cn1ccnc1CC1CCN(CC(=O)N2c3ccccc3CCc3ccccc32)CC1 ZINC000440702902 865870231 /nfs/dbraw/zinc/87/02/31/865870231.db2.gz LPKXFHPCPKGKKJ-UHFFFAOYSA-N 0 3 414.553 4.138 20 0 HIADHN Cc1ccc([C@H](CNC(=O)NCc2cccc(COCC(F)(F)F)c2)N(C)C)cc1 ZINC000440788399 865912412 /nfs/dbraw/zinc/91/24/12/865912412.db2.gz ZPWPYESGJSEISV-FQEVSTJZSA-N 0 3 423.479 4.176 20 0 HIADHN O=C(Nc1ccc(C(=O)N2CCCCC2)c(Cl)c1)[C@H]1CCCN1C1CCCC1 ZINC000440967363 866053643 /nfs/dbraw/zinc/05/36/43/866053643.db2.gz WIJQKWBLVLTJMW-HXUWFJFHSA-N 0 3 403.954 4.312 20 0 HIADHN C[C@H]1CCCN(C(=O)CNC2(c3ccc(OCc4ccccc4)cc3)CCOCC2)C1 ZINC000441001860 866075924 /nfs/dbraw/zinc/07/59/24/866075924.db2.gz IPRDWOOCCRRVHL-NRFANRHFSA-N 0 3 422.569 4.119 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)[C@H](c2c(F)cccc2Cl)N(C)C)C1 ZINC000468115489 881938636 /nfs/dbraw/zinc/93/86/36/881938636.db2.gz PNTBCSPBDWFEMP-CEQIKUNHSA-N 0 3 403.929 4.034 20 0 HIADHN C[C@@H]1[C@@H](c2ccccc2)c2ccccc2CCN1Cc1csc(CC(=O)N(C)C)n1 ZINC000441071135 866158797 /nfs/dbraw/zinc/15/87/97/866158797.db2.gz QDEOTNJNJSZBDD-CJAUYULYSA-N 0 3 419.594 4.353 20 0 HIADHN Nc1ccc(F)c(NC(=O)CCN2CCC[C@@H](c3nc(C(F)(F)F)cs3)C2)c1 ZINC000441104154 866201712 /nfs/dbraw/zinc/20/17/12/866201712.db2.gz MBSLAVUYQYDFEW-LLVKDONJSA-N 0 3 416.444 4.091 20 0 HIADHN CC(C)c1ncc(CN(C)C(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)cn1 ZINC000441219073 866293842 /nfs/dbraw/zinc/29/38/42/866293842.db2.gz VNBIRXZRAQEFRP-IBGZPJMESA-N 0 3 415.607 4.276 20 0 HIADHN COc1cc(NC2CCN(Cc3ccc(C(=O)OC(C)C)cc3)CC2)cc(OC)c1 ZINC000441250288 866323599 /nfs/dbraw/zinc/32/35/99/866323599.db2.gz YUXOFHYGLGGXEY-UHFFFAOYSA-N 0 3 412.530 4.346 20 0 HIADHN CCN(CC(F)(F)F)C(=O)[C@@H]1CCCN(Cc2cc(-c3ccc(F)cc3)no2)C1 ZINC000441348620 866419139 /nfs/dbraw/zinc/41/91/39/866419139.db2.gz RDXUBHXBGHGTAI-OAHLLOKOSA-N 0 3 413.415 4.104 20 0 HIADHN COCc1nc(CNC2CCN(C(=O)C(C)(C)C)CC2)c(-c2ccccc2)s1 ZINC000441357592 866426807 /nfs/dbraw/zinc/42/68/07/866426807.db2.gz OEFYPHNIWQTWBL-UHFFFAOYSA-N 0 3 401.576 4.083 20 0 HIADHN C[C@H](C1CC1)N(Cc1ccccc1)C(=O)CN1CC[C@@H](COCc2ccccc2)C1 ZINC000441364514 866434609 /nfs/dbraw/zinc/43/46/09/866434609.db2.gz ZFWDQAJGSZMUIG-ZJSXRUAMSA-N 0 3 406.570 4.352 20 0 HIADHN CS(=O)(=O)c1ccc(OCCN(CCc2ccc(Cl)cc2)CC2CC2)cc1 ZINC000441379257 866448374 /nfs/dbraw/zinc/44/83/74/866448374.db2.gz FMDQBVXUKRNSPB-UHFFFAOYSA-N 0 3 407.963 4.077 20 0 HIADHN Cc1ccc([C@H]2CCC[C@H]2N(C)CC(=O)NCC2(c3ccccc3)CCOCC2)cc1 ZINC000441378867 866448740 /nfs/dbraw/zinc/44/87/40/866448740.db2.gz NGCWBHNSSAMGAD-JWQCQUIFSA-N 0 3 420.597 4.428 20 0 HIADHN C[N@H+](CCc1ccc2c(c1)CCO2)Cc1cccc([N-]S(=O)(=O)c2ccccc2)c1 ZINC000441504665 866585527 /nfs/dbraw/zinc/58/55/27/866585527.db2.gz FNJQSCYUFVEMDV-UHFFFAOYSA-N 0 3 422.550 4.097 20 0 HIADHN C[N@@H+](CCc1ccc2c(c1)CCO2)Cc1cccc([N-]S(=O)(=O)c2ccccc2)c1 ZINC000441504665 866585539 /nfs/dbraw/zinc/58/55/39/866585539.db2.gz FNJQSCYUFVEMDV-UHFFFAOYSA-N 0 3 422.550 4.097 20 0 HIADHN C[C@H](c1nc2ccccc2s1)N(C)C(=O)CCN1CCN(c2ccccc2)CC1 ZINC000468140486 881994034 /nfs/dbraw/zinc/99/40/34/881994034.db2.gz PYRWOEZWHULKHW-GOSISDBHSA-N 0 3 408.571 4.028 20 0 HIADHN CCC[C@H](CNC(=O)CN1CCC2(C1)CCOCC2)c1ccc(Cl)cc1Cl ZINC000441691880 866807742 /nfs/dbraw/zinc/80/77/42/866807742.db2.gz UBDFPZVVYAVAON-MRXNPFEDSA-N 0 3 413.389 4.496 20 0 HIADHN C[C@H](NC(=O)C(=O)Nc1ccc(OC2CCCCC2)cc1)[C@H](c1ccccc1)N(C)C ZINC000441698053 866809689 /nfs/dbraw/zinc/80/96/89/866809689.db2.gz GEKVYRRBAAXVKE-FDDCHVKYSA-N 0 3 423.557 4.144 20 0 HIADHN CC(C)Sc1c(Cl)cccc1NC(=O)C(=O)NC[C@H](C)N1CCCC[C@@H]1C ZINC000441767851 866844453 /nfs/dbraw/zinc/84/44/53/866844453.db2.gz SXYSOZBMXNTBKR-GJZGRUSLSA-N 0 3 411.999 4.158 20 0 HIADHN Cc1ccc(-c2ccc(Cl)cc2NC(=O)NCCN2CCN(C)C(C)(C)C2)o1 ZINC000441773047 866848665 /nfs/dbraw/zinc/84/86/65/866848665.db2.gz DUJMWQCZAVOFMZ-UHFFFAOYSA-N 0 3 404.942 4.056 20 0 HIADHN CC(C)Sc1c(Cl)cccc1NC(=O)C(=O)NC[C@@H](C)N1CCC[C@@H](C)C1 ZINC000441777041 866851731 /nfs/dbraw/zinc/85/17/31/866851731.db2.gz OZEJOSTWWIUBKR-HUUCEWRRSA-N 0 3 411.999 4.016 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)c1cc(F)c(F)cc1Br ZINC000441825823 866886635 /nfs/dbraw/zinc/88/66/35/866886635.db2.gz WDUKRLJKBCPGBH-GOSISDBHSA-N 0 3 409.274 4.294 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3nc4c(s3)CCCCCC4)CC2)C[C@H](C)O1 ZINC000441926971 866991432 /nfs/dbraw/zinc/99/14/32/866991432.db2.gz WMHSLQPEFSZRMQ-CALCHBBNSA-N 0 3 420.623 4.155 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)Nc1cccc(CCC(F)(F)F)c1 ZINC000442014786 867066691 /nfs/dbraw/zinc/06/66/91/867066691.db2.gz UHTPBLAIDZOBGQ-UHFFFAOYSA-N 0 3 407.436 4.129 20 0 HIADHN Cc1ccc([C@@H](Cn2ccnc2)NC(=O)c2ccc(Nc3ccncc3)cc2)c(C)c1 ZINC000442185537 867208551 /nfs/dbraw/zinc/20/85/51/867208551.db2.gz FNVJZURPJKTHQF-XMMPIXPASA-N 0 3 411.509 4.232 20 0 HIADHN CCCCCN(Cc1ccc(Cl)cc1)C(=O)NCCN1CCN(C)C(C)(C)C1 ZINC000442609751 867557142 /nfs/dbraw/zinc/55/71/42/867557142.db2.gz MJWRPNCEMGABMR-UHFFFAOYSA-N 0 3 409.018 4.068 20 0 HIADHN COc1ccccc1[C@H](CNC(=O)c1cc(Cl)c([O-])c(OC)c1)[NH+]1CCCCC1 ZINC000442718587 867645745 /nfs/dbraw/zinc/64/57/45/867645745.db2.gz HMIGYVFNARRVFK-SFHVURJKSA-N 0 3 418.921 4.020 20 0 HIADHN COc1cc(Br)c(CN[C@H]2Cc3[nH]c4ccccc4c3C2)cc1OC ZINC000442865634 867704989 /nfs/dbraw/zinc/70/49/89/867704989.db2.gz FZQRHVHMIHXILK-CYBMUJFWSA-N 0 3 401.304 4.205 20 0 HIADHN CCOc1cc(CN(C)CCCO)cc(Br)c1OCc1ccccc1 ZINC000442968996 867769557 /nfs/dbraw/zinc/76/95/57/867769557.db2.gz RONSDIUQHYQKKW-UHFFFAOYSA-N 0 3 408.336 4.241 20 0 HIADHN COc1cc(C[NH2+][C@H](C)[C@H](c2ccccc2C)N(C)C)cc(Br)c1[O-] ZINC000442994938 867783926 /nfs/dbraw/zinc/78/39/26/867783926.db2.gz VHYKOKAVODZAJO-AUUYWEPGSA-N 0 3 407.352 4.253 20 0 HIADHN COc1cc(C[NH2+][C@@H](C)[C@@H](c2ccccc2C)N(C)C)cc(Br)c1[O-] ZINC000442994949 867784277 /nfs/dbraw/zinc/78/42/77/867784277.db2.gz VHYKOKAVODZAJO-LIRRHRJNSA-N 0 3 407.352 4.253 20 0 HIADHN O=C1[C@@H](NCc2ccc(Br)c3cccnc23)CCCN1C1CCCCC1 ZINC000443006368 867789473 /nfs/dbraw/zinc/78/94/73/867789473.db2.gz XFMQFYNFRDJBAK-IBGZPJMESA-N 0 3 416.363 4.411 20 0 HIADHN C[C@@H](CC(=O)N(C)c1ccccc1)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1 ZINC000443100937 867819100 /nfs/dbraw/zinc/81/91/00/867819100.db2.gz BOOCUIHWIMZCIS-GBXCKJPGSA-N 0 3 415.537 4.268 20 0 HIADHN Cc1c(Br)ccc(C(=O)NC2CCN(Cc3ccccc3)CC2)c1F ZINC000468233763 882128896 /nfs/dbraw/zinc/12/88/96/882128896.db2.gz IBUOOZFHOOZJBU-UHFFFAOYSA-N 0 3 405.311 4.291 20 0 HIADHN CSCc1cc(C(=O)NC2CCN(CCOc3ccc(F)cc3)CC2)ccc1F ZINC000443333628 867908622 /nfs/dbraw/zinc/90/86/22/867908622.db2.gz JZSJAAWWDSZDCT-UHFFFAOYSA-N 0 3 420.525 4.101 20 0 HIADHN O=C(C/C=C/c1cccc(F)c1)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000443337246 867909552 /nfs/dbraw/zinc/90/95/52/867909552.db2.gz TWSAFZSIXOIBOA-DUXPYHPUSA-N 0 3 400.469 4.028 20 0 HIADHN COc1ccccc1S(=O)(=O)CCCN[C@H](C)c1ccc(Br)s1 ZINC000443336775 867909788 /nfs/dbraw/zinc/90/97/88/867909788.db2.gz AQHLSKJRSZLATL-GFCCVEGCSA-N 0 3 418.378 4.034 20 0 HIADHN C[C@H](CC(=O)NC1CCN(CCOc2ccc(F)cc2)CC1)Cc1cccc(F)c1 ZINC000443340078 867912378 /nfs/dbraw/zinc/91/23/78/867912378.db2.gz FRBIGEYGKRNMCL-SFHVURJKSA-N 0 3 416.512 4.193 20 0 HIADHN CC[C@@]1(C)Oc2ccc(NC(=O)N(C)C3CCN(CCc4ccccn4)CC3)cc2O1 ZINC000443373086 867936199 /nfs/dbraw/zinc/93/61/99/867936199.db2.gz CDOAUVSVPFCPIH-DEOSSOPVSA-N 0 3 424.545 4.150 20 0 HIADHN CC[C@]1(C)Oc2ccc(NC(=O)N(CCN(C)C)Cc3cccc(F)c3)cc2O1 ZINC000443377162 867939261 /nfs/dbraw/zinc/93/92/61/867939261.db2.gz ZUFZFFZPVKOFTH-JOCHJYFZSA-N 0 3 401.482 4.319 20 0 HIADHN C[C@@H](NC(=O)N1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1)c1cc2ccccc2o1 ZINC000443628942 868203289 /nfs/dbraw/zinc/20/32/89/868203289.db2.gz MQGSNZLJQWATGB-GBESFXJTSA-N 0 3 413.562 4.415 20 0 HIADHN O[C@H](COc1ccc(Cl)cc1)CN1CCC[C@@H](c2nc3ccc(F)cc3o2)C1 ZINC000443636663 868218520 /nfs/dbraw/zinc/21/85/20/868218520.db2.gz FWORKTWVQJQAQZ-PBHICJAKSA-N 0 3 404.869 4.240 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)CCc2ccc(-c3ccccc3F)o2)C[C@@H](C)O1 ZINC000443651015 868244609 /nfs/dbraw/zinc/24/46/09/868244609.db2.gz IRJNIRDBEIGBHN-QZTJIDSGSA-N 0 3 402.510 4.024 20 0 HIADHN O[C@@H](COc1ccccc1Cl)CN1CCC[C@H](c2nc3ccc(F)cc3o2)C1 ZINC000443652195 868250097 /nfs/dbraw/zinc/25/00/97/868250097.db2.gz UACYNKYCRBYXBY-GOEBONIOSA-N 0 3 404.869 4.240 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)C[C@@H](Cc2ccccc2)c2ccccc2)C[C@H](C)O1 ZINC000443664746 868271534 /nfs/dbraw/zinc/27/15/34/868271534.db2.gz FPRQBNPHXQCBJC-OTNCWRBYSA-N 0 3 408.586 4.409 20 0 HIADHN Cc1ccc(OCc2ccc(C(=O)NCCCCN3C[C@@H](C)O[C@H](C)C3)o2)c(C)c1 ZINC000443666289 868272400 /nfs/dbraw/zinc/27/24/00/868272400.db2.gz LFWATCAELOOBGZ-WOJBJXKFSA-N 0 3 414.546 4.095 20 0 HIADHN COc1ccc(-c2cc(C(=O)NCCCCN3C[C@@H](C)O[C@@H](C)C3)sc2C)cc1 ZINC000443671614 868278999 /nfs/dbraw/zinc/27/89/99/868278999.db2.gz CQCBZCFILAKRTJ-CALCHBBNSA-N 0 3 416.587 4.351 20 0 HIADHN CC[C@H](C(=O)NCCCCN1C[C@@H](C)O[C@@H](C)C1)c1cccc(C(F)(F)F)c1 ZINC000443675866 868282960 /nfs/dbraw/zinc/28/29/60/868282960.db2.gz OSMBJLAVXJDKBE-FCEWJHQRSA-N 0 3 400.485 4.205 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)c2ccc(Oc3ccc(F)cc3F)cc2)C[C@H](C)O1 ZINC000443677670 868284646 /nfs/dbraw/zinc/28/46/46/868284646.db2.gz TYTPBLAFNUQDNJ-CALCHBBNSA-N 0 3 418.484 4.376 20 0 HIADHN C[C@@H](CC(=O)NCCCCN1C[C@@H](C)O[C@H](C)C1)c1ccccc1C(F)(F)F ZINC000443677754 868284873 /nfs/dbraw/zinc/28/48/73/868284873.db2.gz UGWCISGTUQBXFJ-GVDBMIGSSA-N 0 3 400.485 4.205 20 0 HIADHN CCN(C(=O)C(=O)Nc1ccc2ccoc2c1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000443694896 868293879 /nfs/dbraw/zinc/29/38/79/868293879.db2.gz URSRKJFCSCXTIN-LAUBAEHRSA-N 0 3 405.498 4.055 20 0 HIADHN CCOC(=O)c1c(NC(=O)CCC(F)(F)F)sc2c1CC(C)(C)NC2(C)C ZINC000443818782 868351232 /nfs/dbraw/zinc/35/12/32/868351232.db2.gz VOROQGYAHNHIGL-UHFFFAOYSA-N 0 3 406.470 4.365 20 0 HIADHN Cc1ccccc1[C@@H]([C@@H](C)NC(=O)C(=O)Nc1ccccc1SC(C)C)N(C)C ZINC000443834719 868366769 /nfs/dbraw/zinc/36/67/69/868366769.db2.gz NOBCRFRUUCUAMK-DYESRHJHSA-N 0 3 413.587 4.242 20 0 HIADHN CSc1ccc(Cl)cc1NC(=O)C(=O)N[C@@H](C)[C@@H](c1ccccc1C)N(C)C ZINC000443840922 868371444 /nfs/dbraw/zinc/37/14/44/868371444.db2.gz YTRRGJRZKAZZRO-LIRRHRJNSA-N 0 3 419.978 4.116 20 0 HIADHN CCCn1ccc2ccc(NC(=O)C(=O)N[C@@H](C)[C@H](c3ccccc3C)N(C)C)cc21 ZINC000443841275 868373111 /nfs/dbraw/zinc/37/31/11/868373111.db2.gz ZLOFWPTVYVZCIN-FDDCHVKYSA-N 0 3 420.557 4.106 20 0 HIADHN Cc1ccccc1[C@H]([C@@H](C)NC(=O)C(=O)Nc1ccc(C(F)(F)F)c(C)c1)N(C)C ZINC000443846504 868375220 /nfs/dbraw/zinc/37/52/20/868375220.db2.gz WAOSFULIRHOHPU-BEFAXECRSA-N 0 3 421.463 4.068 20 0 HIADHN COc1ccc(CNCCOc2ccc(F)c(F)c2)c(OCc2cccnc2)c1 ZINC000443980375 868507609 /nfs/dbraw/zinc/50/76/09/868507609.db2.gz QXWRZKCRVAXHQR-UHFFFAOYSA-N 0 3 400.425 4.116 20 0 HIADHN O=C(N[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)N1CC[C@H](N2CC=CC2)C1 ZINC000444034445 868569636 /nfs/dbraw/zinc/56/96/36/868569636.db2.gz PSPWSXKTQJFYJI-JKSUJKDBSA-N 0 3 421.385 4.355 20 0 HIADHN CCCN(CC(=O)Nc1c(C)nn(-c2ccc(C)cc2)c1C)[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000444232241 868680277 /nfs/dbraw/zinc/68/02/77/868680277.db2.gz OVAIOYOFLZWFJK-AGILITTLSA-N 0 3 424.589 4.262 20 0 HIADHN Cc1cc(NC(=O)c2noc3c2CCCCC3)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000444237488 868686048 /nfs/dbraw/zinc/68/60/48/868686048.db2.gz KWICQKPDYKHAHU-IBGZPJMESA-N 0 3 419.529 4.148 20 0 HIADHN COC(=O)c1ccc2c(c1)nc(CN(C)[C@@H]1CCC[C@H]1c1ccc(C)cc1)[nH]c2=O ZINC000444236491 868686066 /nfs/dbraw/zinc/68/60/66/868686066.db2.gz IHLHXCSLJBBBEX-GHTZIAJQSA-N 0 3 405.498 4.199 20 0 HIADHN COCc1csc(NC(=O)N2CCN(Cc3ccccc3)C3(CCCCC3)C2)n1 ZINC000444397218 868809751 /nfs/dbraw/zinc/80/97/51/868809751.db2.gz PZOKYPIKRUCJMM-UHFFFAOYSA-N 0 3 414.575 4.342 20 0 HIADHN CC(C)OCCN1CCC(Nc2cncc(OCc3cccc(Cl)c3)n2)CC1 ZINC000444426571 868824254 /nfs/dbraw/zinc/82/42/54/868824254.db2.gz SXIIZABPGNJNNK-UHFFFAOYSA-N 0 3 404.942 4.010 20 0 HIADHN CN(c1ccccc1)c1ccc(C(=O)Nc2cccc(CN3CCC(O)CC3)c2)cn1 ZINC000444449176 868833080 /nfs/dbraw/zinc/83/30/80/868833080.db2.gz FHHHQZKCTHFUFI-UHFFFAOYSA-N 0 3 416.525 4.059 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1csc(Cc2ccccc2)n1 ZINC000444539776 868874085 /nfs/dbraw/zinc/87/40/85/868874085.db2.gz GACVXOJXLURGFL-UHFFFAOYSA-N 0 3 421.566 4.191 20 0 HIADHN Cc1cc2occ(CC(=O)Nc3cccc(CN4CCC(CO)CC4)c3)c2cc1C ZINC000444554565 868880295 /nfs/dbraw/zinc/88/02/95/868880295.db2.gz RUGUTXFFDKZCND-UHFFFAOYSA-N 0 3 406.526 4.435 20 0 HIADHN CCOc1ccc2cc(C(=O)Nc3cccc(CN4CCC(CO)CC4)c3)[nH]c2c1 ZINC000444555944 868880592 /nfs/dbraw/zinc/88/05/92/868880592.db2.gz UJBCJTVAUMKSKA-UHFFFAOYSA-N 0 3 407.514 4.023 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)NCc2cccc(-c3cccnc3)c2)c1 ZINC000468316251 882245978 /nfs/dbraw/zinc/24/59/78/882245978.db2.gz KAWFWRGYBJFFBY-UHFFFAOYSA-N 0 3 402.542 4.330 20 0 HIADHN O=C(CCN1CCC[C@H]([C@@H](O)C(F)(F)F)C1)Nc1ccccc1Oc1ccccc1 ZINC000444723057 868976267 /nfs/dbraw/zinc/97/62/67/868976267.db2.gz UCEDRVKGNYUECF-HRAATJIYSA-N 0 3 422.447 4.443 20 0 HIADHN C[C@@H](c1nc(Cc2ccc(F)cc2)no1)N1CCC[C@@H](c2ncc(C(F)(F)F)[nH]2)C1 ZINC000444801367 869016214 /nfs/dbraw/zinc/01/62/14/869016214.db2.gz BQTXIOZUWVQLKA-GXTWGEPZSA-N 0 3 423.414 4.482 20 0 HIADHN CN(C(=O)Nc1cccc(C(C)(F)F)c1)C1CCN(CCc2ccccn2)CC1 ZINC000444935094 869117209 /nfs/dbraw/zinc/11/72/09/869117209.db2.gz CJAKDWXJTWFMPD-UHFFFAOYSA-N 0 3 402.489 4.364 20 0 HIADHN Cc1cc2cc[nH]c2cc1NC(=O)C(=O)NC[C@@H](c1ccccc1)N1CCC(C)CC1 ZINC000445066119 869201140 /nfs/dbraw/zinc/20/11/40/869201140.db2.gz ONMKOSWGROJUKC-QHCPKHFHSA-N 0 3 418.541 4.004 20 0 HIADHN CCOc1ccccc1NC(=O)Cc1noc(C2CCN(Cc3ccccc3)CC2)n1 ZINC000445359796 869424348 /nfs/dbraw/zinc/42/43/48/869424348.db2.gz UXKYSXPRLHSMNN-UHFFFAOYSA-N 0 3 420.513 4.029 20 0 HIADHN O=C(N1CCO[C@@H](c2ccsc2)C1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000468361515 882302806 /nfs/dbraw/zinc/30/28/06/882302806.db2.gz ZODBAHXHSVBPQN-UYAOXDASSA-N 0 3 424.488 4.103 20 0 HIADHN C[C@H](NC(=O)NCCCN1CCc2ccccc2C1)c1cccc(N2CCCC2)c1 ZINC000445487497 869557229 /nfs/dbraw/zinc/55/72/29/869557229.db2.gz FPDHWNYPMYHVPW-FQEVSTJZSA-N 0 3 406.574 4.095 20 0 HIADHN COc1cccc([C@H](CNC(=O)CCc2cn(C)c3ccccc23)N2CCCC2)c1 ZINC000445651696 869721789 /nfs/dbraw/zinc/72/17/89/869721789.db2.gz DIFAXTSPOOJEAA-DEOSSOPVSA-N 0 3 405.542 4.073 20 0 HIADHN O=C(Nc1ccccc1)C1CCN(CCOc2cc(F)cc(Br)c2)CC1 ZINC000445797859 869828491 /nfs/dbraw/zinc/82/84/91/869828491.db2.gz CVXXYUHZMLARDV-UHFFFAOYSA-N 0 3 421.310 4.318 20 0 HIADHN CC(C)(COc1ncccc1Br)NCc1cncn1Cc1ccccc1 ZINC000445807198 869833556 /nfs/dbraw/zinc/83/35/56/869833556.db2.gz GKYZLSXXNWJIHC-UHFFFAOYSA-N 0 3 415.335 4.036 20 0 HIADHN Cc1cn(-c2c(F)cccc2F)nc1C(=O)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000468402735 882344122 /nfs/dbraw/zinc/34/41/22/882344122.db2.gz LQNDFKVWRUUZPF-FQEVSTJZSA-N 0 3 410.468 4.026 20 0 HIADHN COc1ccc(Cn2nc(C)c(CN3CCCN(c4ccccc4)CC3)c2C)cc1 ZINC000468407401 882351129 /nfs/dbraw/zinc/35/11/29/882351129.db2.gz HIYMUASAHIXFKU-UHFFFAOYSA-N 0 3 404.558 4.269 20 0 HIADHN C[C@@H](C(=O)Nc1cccc(F)c1)N1CCN(CC2CCC(C(F)(F)F)CC2)CC1 ZINC000468409808 882351937 /nfs/dbraw/zinc/35/19/37/882351937.db2.gz WHWYBURRXYEAFE-GTPINHCMSA-N 0 3 415.475 4.139 20 0 HIADHN COCCN1CCC[C@@H]1CNC(=O)c1c(F)cccc1Sc1ccc(Cl)cc1 ZINC000446079549 870028653 /nfs/dbraw/zinc/02/86/53/870028653.db2.gz JGJGNLRVAUXKSB-MRXNPFEDSA-N 0 3 422.953 4.471 20 0 HIADHN Cc1c2cc(C)ccc2sc1C(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1CO ZINC000446224209 870160777 /nfs/dbraw/zinc/16/07/77/870160777.db2.gz FEGRDQHXGJDSSO-CTNGQTDRSA-N 0 3 408.567 4.131 20 0 HIADHN C[C@@H]1C[C@@H](N(C)C(=O)CCC(=O)c2ccc(F)c(F)c2)CCN1Cc1ccccc1 ZINC000446271145 870207395 /nfs/dbraw/zinc/20/73/95/870207395.db2.gz WPMYWMVRUJHKLS-XLIONFOSSA-N 0 3 414.496 4.439 20 0 HIADHN CC(C)c1noc2nc(-c3ccco3)cc(C(=O)N(CCN(C)C)Cc3ccco3)c21 ZINC000446434217 870352421 /nfs/dbraw/zinc/35/24/21/870352421.db2.gz ICZPOQYMIDJZBJ-UHFFFAOYSA-N 0 3 422.485 4.403 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N[C@@H](C)c3cccc(N4CCCC4)c3)cc2)CC1 ZINC000446488069 870400489 /nfs/dbraw/zinc/40/04/89/870400489.db2.gz IRVUSCPDFZDVRU-NRFANRHFSA-N 0 3 420.601 4.308 20 0 HIADHN COc1ccccc1-c1csc([C@@H]2CCCN(C(=O)[C@@H](C(C)C)N(C)C)C2)n1 ZINC000446489376 870402674 /nfs/dbraw/zinc/40/26/74/870402674.db2.gz YEERTFGCTBENHX-OXQOHEQNSA-N 0 3 401.576 4.111 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)N[C@@H]3CCCc4sccc43)CC2)C[C@@H](C)O1 ZINC000468465745 882411836 /nfs/dbraw/zinc/41/18/36/882411836.db2.gz HVYRXUISVXQEDU-MBOZVWFJSA-N 0 3 405.608 4.046 20 0 HIADHN CSCc1cccc(CNC(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)c1 ZINC000446616351 870516945 /nfs/dbraw/zinc/51/69/45/870516945.db2.gz YGPPPMAEKXNFEJ-UHFFFAOYSA-N 0 3 407.530 4.101 20 0 HIADHN CN(C(=O)N[C@H]1CC[C@@H](Cc2ccccc2)C1)C1CCN(CCc2ccccn2)CC1 ZINC000446634991 870542265 /nfs/dbraw/zinc/54/22/65/870542265.db2.gz QTJGEYIWELXQIC-UPVQGACJSA-N 0 3 420.601 4.141 20 0 HIADHN CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)N[C@H]1CC[C@H](Cc2ccccc2)C1 ZINC000446638734 870547732 /nfs/dbraw/zinc/54/77/32/870547732.db2.gz PFHYKKZUWIQDAJ-KAMZKSLDSA-N 0 3 406.574 4.127 20 0 HIADHN COc1ccc2c(c1)[C@@H](NCCCS(=O)(=O)Cc1ccccc1)CCCS2 ZINC000446747803 870656661 /nfs/dbraw/zinc/65/66/61/870656661.db2.gz IKIBSOXMXZWKED-FQEVSTJZSA-N 0 3 405.585 4.217 20 0 HIADHN COc1cc(CN2CCC[C@@H](c3n[nH]cc3NC(=O)c3ccccc3)C2)ccc1C ZINC000446751726 870660188 /nfs/dbraw/zinc/66/01/88/870660188.db2.gz FFKWFFJUDGMADD-HXUWFJFHSA-N 0 3 404.514 4.359 20 0 HIADHN COc1ccc([C@H](CCn2cncn2)NCc2cc(F)cc(Br)c2)cc1 ZINC000446751692 870660825 /nfs/dbraw/zinc/66/08/25/870660825.db2.gz DWUKNYXFBQZGKK-IBGZPJMESA-N 0 3 419.298 4.110 20 0 HIADHN CCN(C)c1ccc(CNC2(c3cccc(OC(F)(F)F)c3)CCOCC2)cn1 ZINC000446840589 870758613 /nfs/dbraw/zinc/75/86/13/870758613.db2.gz GYPDEWLGXBTTEA-UHFFFAOYSA-N 0 3 409.452 4.232 20 0 HIADHN FC(F)(F)c1cccc(C2(NCc3ccc(N4CCCC4)nc3)CCOCC2)c1 ZINC000446849447 870769189 /nfs/dbraw/zinc/76/91/89/870769189.db2.gz YOUGLTXFLUMXSS-UHFFFAOYSA-N 0 3 405.464 4.496 20 0 HIADHN Cn1ccnc1[C@H]1CCCN(Cc2cnn(Cc3ccc(C(F)(F)F)cc3)c2)C1 ZINC000446851803 870772779 /nfs/dbraw/zinc/77/27/79/870772779.db2.gz FNSCVVOCSTYZJW-SFHVURJKSA-N 0 3 403.452 4.063 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1cc(Cl)ccc1OC[C@@H]1CCCO1 ZINC000446912193 870828454 /nfs/dbraw/zinc/82/84/54/870828454.db2.gz WZMNKDIUACNJEH-SFHVURJKSA-N 0 3 421.925 4.087 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1cc(C(F)(F)F)ccc1N1CCCC1 ZINC000446930282 870842399 /nfs/dbraw/zinc/84/23/99/870842399.db2.gz NIUZKJBSNAWARR-UHFFFAOYSA-N 0 3 424.467 4.494 20 0 HIADHN Cc1nc(-c2ccc(C)c(NC(=O)N3CCCN(Cc4ccccc4)C[C@@H]3C)c2)n[nH]1 ZINC000447051996 870931122 /nfs/dbraw/zinc/93/11/22/870931122.db2.gz ZUHUKLSIFZYFRL-SFHVURJKSA-N 0 3 418.545 4.217 20 0 HIADHN COCCn1cc(CN2CCC[C@H](c3nc(-c4ccccc4OC)cs3)C2)cn1 ZINC000447068094 870949062 /nfs/dbraw/zinc/94/90/62/870949062.db2.gz QFXYXYUXAJWIRY-SFHVURJKSA-N 0 3 412.559 4.041 20 0 HIADHN C[C@@H](CC(=O)Nc1ccccc1)NCc1cnn(-c2ccc(Br)cc2)c1 ZINC000447089675 870982270 /nfs/dbraw/zinc/98/22/70/870982270.db2.gz JNXXMDBGFMVMCI-HNNXBMFYSA-N 0 3 413.319 4.142 20 0 HIADHN COCCO[C@@H]1C[C@@H](CO)CN(Cc2ccc(Oc3ccc(Cl)cc3C)cc2)C1 ZINC000447380111 871284147 /nfs/dbraw/zinc/28/41/47/871284147.db2.gz CWEBVDUXXSTUMN-DENIHFKCSA-N 0 3 419.949 4.287 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)NCC1(c2cccc(C(F)(F)F)c2)CC1 ZINC000447380584 871286795 /nfs/dbraw/zinc/28/67/95/871286795.db2.gz FMRSOCOKLSESCN-UHFFFAOYSA-N 0 3 409.452 4.103 20 0 HIADHN CSc1ccccc1NC(=O)CCN1CCN(c2cccc3cnccc32)C[C@@H]1C ZINC000447402456 871312016 /nfs/dbraw/zinc/31/20/16/871312016.db2.gz JNJMQCBIEVAQKX-SFHVURJKSA-N 0 3 420.582 4.496 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)Cc2nc(C(C)C)c(C)s2)cc1 ZINC000447549296 871423623 /nfs/dbraw/zinc/42/36/23/871423623.db2.gz JUNAVEMDGIRLDG-IBGZPJMESA-N 0 3 401.576 4.079 20 0 HIADHN Cc1ccc(CN[C@@H]2CCCc3ccc(Br)cc32)cc1S(C)(=O)=O ZINC000447566621 871461610 /nfs/dbraw/zinc/46/16/10/871461610.db2.gz VCNJOVUTKPHJHO-GOSISDBHSA-N 0 3 408.361 4.328 20 0 HIADHN Cn1nccc1N1CCC[C@H](N[C@H](c2ccc(F)cc2)c2cnc3ccccc3c2)C1 ZINC000447578558 871478696 /nfs/dbraw/zinc/47/86/96/871478696.db2.gz LBPJJULAFQOKDJ-WIOPSUGQSA-N 0 3 415.516 4.455 20 0 HIADHN Cc1cc([C@@H](NC[C@@H](CO)Cc2cc(F)c(F)c(F)c2)c2cccnc2)ccc1F ZINC000447607367 871516707 /nfs/dbraw/zinc/51/67/07/871516707.db2.gz RSTCNYIEPOHBOX-QMHKHESXSA-N 0 3 418.434 4.477 20 0 HIADHN COc1ccc(Cn2nc(C)c(CN3CC[C@@H](n4ncc5ccccc54)C3)c2C)cc1 ZINC000468518433 882527237 /nfs/dbraw/zinc/52/72/37/882527237.db2.gz WLVSNQFUBCQOHX-JOCHJYFZSA-N 0 3 415.541 4.354 20 0 HIADHN CC1(C)CCCN(CCNC(=O)c2cnc3ccc(Oc4ccccc4)cc3c2O)C1 ZINC000447706651 871647058 /nfs/dbraw/zinc/64/70/58/871647058.db2.gz AIXAYXWDIGAERV-UHFFFAOYSA-N 0 3 419.525 4.172 20 0 HIADHN C[C@@H]1OCC[C@@]12CN(CCC(=O)Nc1ccccc1Oc1ccccc1)C[C@@H](C)O2 ZINC000447844216 871766542 /nfs/dbraw/zinc/76/65/42/871766542.db2.gz LAKQSDXEDUBXJL-YDIMBITNSA-N 0 3 410.514 4.076 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)[C@H](C)N[C@H](C[C@H]1CCOC1)c1ccccc1 ZINC000447885538 871799476 /nfs/dbraw/zinc/79/94/76/871799476.db2.gz HXGXNDLSFWUJGJ-FRQCXROJSA-N 0 3 402.922 4.433 20 0 HIADHN CN1CCCC(C)(C)[C@@H]1CN[C@H](c1ccc(F)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000448025208 871864933 /nfs/dbraw/zinc/86/49/33/871864933.db2.gz CFAVPAXMFVQGKN-FCHUYYIVSA-N 0 3 418.578 4.029 20 0 HIADHN CCc1nc2ccccc2n1C1CCN(C(=O)NC[C@H]2N(C)CCCC2(C)C)CC1 ZINC000448028119 871867192 /nfs/dbraw/zinc/86/71/92/871867192.db2.gz BQTLRZCFIJICQX-OAQYLSRUSA-N 0 3 411.594 4.066 20 0 HIADHN CCCN(C(=O)NC[C@]1(C)CCO[C@@H]1C1CC1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000468536208 882567158 /nfs/dbraw/zinc/56/71/58/882567158.db2.gz LSSSQBHBYAQPRS-OYRHQHFDSA-N 0 3 413.606 4.278 20 0 HIADHN CC(C)[C@H]1C[C@@H](NC(=O)NCc2ccccc2CN2CCC(O)CC2)c2ccccc21 ZINC000448162273 872039453 /nfs/dbraw/zinc/03/94/53/872039453.db2.gz XVUNVDADJSKTME-JWQCQUIFSA-N 0 3 421.585 4.327 20 0 HIADHN C[C@H]1CN(CCCCNC(=O)c2ccc3cc(Br)ccc3c2)C[C@H](C)O1 ZINC000448239424 872154133 /nfs/dbraw/zinc/15/41/33/872154133.db2.gz LDNXGPLYMGDEHE-HOTGVXAUSA-N 0 3 419.363 4.222 20 0 HIADHN c1nc([C@H]2CCCO2)sc1CN(CCCOc1ccccc1)C1CCOCC1 ZINC000468548865 882592762 /nfs/dbraw/zinc/59/27/62/882592762.db2.gz QPPJZTOISCCWPC-OAQYLSRUSA-N 0 3 402.560 4.445 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N2CCCC[C@H]2c2nnc(C3CCC3)o2)C1 ZINC000460115001 872583557 /nfs/dbraw/zinc/58/35/57/872583557.db2.gz LWMYPMQMDQHHFX-UIFIKXQLSA-N 0 3 423.561 4.409 20 0 HIADHN CCN(C(=O)NC[C@H](c1ccccc1)N1CCC(C)CC1)[C@@H]1CCOC(C)(C)C1 ZINC000460119116 872588832 /nfs/dbraw/zinc/58/88/32/872588832.db2.gz XPFGGMVPDGAAIH-FGZHOGPDSA-N 0 3 401.595 4.449 20 0 HIADHN CC[C@H](C)[C@@H](C)NC(=O)N(Cc1ccccc1Br)C1CCN(C)CC1 ZINC000460121929 872592399 /nfs/dbraw/zinc/59/23/99/872592399.db2.gz VIAPPSLXDOECTC-JKSUJKDBSA-N 0 3 410.400 4.490 20 0 HIADHN CCN(C(=O)Nc1ccc(NC(=O)C(C)C)cc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000460122992 872595468 /nfs/dbraw/zinc/59/54/68/872595468.db2.gz HUYOETSZUYGFCB-JOCHJYFZSA-N 0 3 408.546 4.409 20 0 HIADHN CCN(C(=O)Nc1ccccc1OCC(F)F)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000460130246 872612428 /nfs/dbraw/zinc/61/24/28/872612428.db2.gz DIKTXQJNHYYTMA-GOSISDBHSA-N 0 3 403.473 4.459 20 0 HIADHN CCN(C(=O)Nc1ccc(C(=O)NCC(C)C)cc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000460134173 872622719 /nfs/dbraw/zinc/62/27/19/872622719.db2.gz PMCWMVJZFGWCGG-HSZRJFAPSA-N 0 3 422.573 4.201 20 0 HIADHN CCn1c(-c2ccoc2)nnc1N1CCCN(Cc2ccc(C(F)(F)F)cc2)CC1 ZINC000460288298 872878344 /nfs/dbraw/zinc/87/83/44/872878344.db2.gz GSWPNOVQZGBUAL-UHFFFAOYSA-N 0 3 419.451 4.289 20 0 HIADHN Cc1ccc(CN(CC(=O)NC[C@H](c2ccccc2)N(C)C)Cc2ccco2)s1 ZINC000460383256 873025477 /nfs/dbraw/zinc/02/54/77/873025477.db2.gz HHBGQNBCLSZTQY-JOCHJYFZSA-N 0 3 411.571 4.071 20 0 HIADHN CN(C)[C@@H](CNC(=O)CN1CCCC[C@H]1c1cc2ccccc2[nH]1)c1ccccc1 ZINC000460388255 873032247 /nfs/dbraw/zinc/03/22/47/873032247.db2.gz PSZOLBJROMUGGE-ZEQRLZLVSA-N 0 3 404.558 4.114 20 0 HIADHN CN1CC[C@H](NC(=O)N2CCCC[C@H]2c2nnc(C3CCC3)o2)[C@@H]1c1ccccc1 ZINC000460557468 873277277 /nfs/dbraw/zinc/27/72/77/873277277.db2.gz UYAFDNHQQHYCIW-UFYCRDLUSA-N 0 3 409.534 4.019 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)c3c[nH]cc3-c3ccc(F)cc3)cc2)CC1 ZINC000460711441 873498363 /nfs/dbraw/zinc/49/83/63/873498363.db2.gz XVUOQMRESVOLHC-UHFFFAOYSA-N 0 3 406.505 4.211 20 0 HIADHN C[C@@H]1CCC[C@H]1CNC(=O)N(Cc1ccccc1Br)C1CCN(C)CC1 ZINC000460772358 873621486 /nfs/dbraw/zinc/62/14/86/873621486.db2.gz XWCRFNFBUQAXMT-SJORKVTESA-N 0 3 422.411 4.491 20 0 HIADHN CCOCCCn1c(C2CCC2)nnc1N1C[C@@H](C)N(Cc2ccccc2)C[C@H]1C ZINC000460795273 873664545 /nfs/dbraw/zinc/66/45/45/873664545.db2.gz PJWFMDWVRWCLMZ-WOJBJXKFSA-N 0 3 411.594 4.071 20 0 HIADHN CC(C)c1nc(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)nn1-c1ccccc1F ZINC000460808240 873685244 /nfs/dbraw/zinc/68/52/44/873685244.db2.gz XEPZHWTVWJRGEN-NRFANRHFSA-N 0 3 421.520 4.097 20 0 HIADHN Brc1ccc(-c2noc(-c3ccc(CN4CCSCC4)cc3)n2)nc1 ZINC000460814137 873694996 /nfs/dbraw/zinc/69/49/96/873694996.db2.gz HRKSQIRZQACLCM-UHFFFAOYSA-N 0 3 417.332 4.110 20 0 HIADHN Fc1cccc(CN2CCC[C@@H](c3nc(-c4ccc(Br)cn4)no3)C2)c1 ZINC000460822648 873705946 /nfs/dbraw/zinc/70/59/46/873705946.db2.gz FUHTUBHQADTYOG-CQSZACIVSA-N 0 3 417.282 4.413 20 0 HIADHN Cc1ccc(C(=O)NC[C@@H]2CCCN2C)cc1OCc1csc(Br)c1 ZINC000460985737 873874470 /nfs/dbraw/zinc/87/44/70/873874470.db2.gz GPEFBVAHMWRGEA-INIZCTEOSA-N 0 3 423.376 4.222 20 0 HIADHN CC[C@H](C)c1nnc(N2C[C@H](C)N(Cc3ccccc3)C[C@H]2C)n1C[C@H]1CCCO1 ZINC000461073165 873968929 /nfs/dbraw/zinc/96/89/29/873968929.db2.gz ZQUFEGWWIAIIKF-ITTUMRLJSA-N 0 3 411.594 4.070 20 0 HIADHN CC[C@H](C)c1nnc(N2C[C@H](C)N(Cc3ccccc3)C[C@H]2C)n1C[C@@H]1CCCO1 ZINC000461073167 873969743 /nfs/dbraw/zinc/96/97/43/873969743.db2.gz ZQUFEGWWIAIIKF-KEZQHZCBSA-N 0 3 411.594 4.070 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)C[C@@H](Cc1ccccc1)c1ccccc1 ZINC000461113092 874035612 /nfs/dbraw/zinc/03/56/12/874035612.db2.gz ONDKTAJOOJHTAM-XMMPIXPASA-N 0 3 401.554 4.388 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)C[C@H](Cc1ccccc1)c1ccccc1 ZINC000461113091 874036222 /nfs/dbraw/zinc/03/62/22/874036222.db2.gz ONDKTAJOOJHTAM-DEOSSOPVSA-N 0 3 401.554 4.388 20 0 HIADHN O=C(Nc1ccc(NC(=O)c2ccccc2)nc1)c1cccc(CN2CCCC2)c1 ZINC000461198496 874197640 /nfs/dbraw/zinc/19/76/40/874197640.db2.gz VPSCADXFIWSVKW-UHFFFAOYSA-N 0 3 400.482 4.182 20 0 HIADHN C[C@H](NC(=O)NC[C@H](Cc1ccccc1)C(F)(F)F)[C@H](c1ccccc1)N(C)C ZINC000461214982 874217411 /nfs/dbraw/zinc/21/74/11/874217411.db2.gz AMULWBYNOTYIDG-FFZOFVMBSA-N 0 3 407.480 4.398 20 0 HIADHN C[C@H]1C[C@H](c2cccc(F)c2)N(C(=O)CCCN2CCN(c3ccccc3)CC2)C1 ZINC000461320678 874329116 /nfs/dbraw/zinc/32/91/16/874329116.db2.gz YQTARLUUGASOGJ-GBXCKJPGSA-N 0 3 409.549 4.338 20 0 HIADHN CC(C)N1CCC(N(C)c2nnc(-c3cc(Br)ccc3F)s2)CC1 ZINC000468706866 882823007 /nfs/dbraw/zinc/82/30/07/882823007.db2.gz MBIVVIWGUZZIGT-UHFFFAOYSA-N 0 3 413.360 4.416 20 0 HIADHN CO[C@@]1(CNCc2c(C)nn(-c3ccccc3)c2Oc2ccc(F)cc2)CCOC1 ZINC000461404563 874417713 /nfs/dbraw/zinc/41/77/13/874417713.db2.gz GICQLUXZTIYWRR-HSZRJFAPSA-N 0 3 411.477 4.007 20 0 HIADHN Cc1ccc(C(=O)CCC(=O)N2C[C@@H]3CCN(Cc4ccccc4)C[C@@H]3C2)cc1C ZINC000461439474 874492748 /nfs/dbraw/zinc/49/27/48/874492748.db2.gz RQMGPEOBOZRRPL-BJKOFHAPSA-N 0 3 404.554 4.247 20 0 HIADHN CC(=O)Nc1ccc(C(=O)N2CCN(Cc3ccccc3)C3(CCCCC3)C2)cc1 ZINC000461581435 874688154 /nfs/dbraw/zinc/68/81/54/874688154.db2.gz SBIPHKHGRXVFIO-UHFFFAOYSA-N 0 3 405.542 4.306 20 0 HIADHN CC(C)(C)OC1CCN(C(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)CC1 ZINC000468787576 882859829 /nfs/dbraw/zinc/85/98/29/882859829.db2.gz BMBKTYXIRRICSH-NRFANRHFSA-N 0 3 412.496 4.247 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3nc(-c4ccccc4OC)cs3)cc2)CC1 ZINC000468794242 882862617 /nfs/dbraw/zinc/86/26/17/882862617.db2.gz BNFMIIJGFSIJAT-UHFFFAOYSA-N 0 3 422.554 4.213 20 0 HIADHN C[C@@H](Cn1cc(Br)cn1)NCc1ccc(Oc2ccc(F)cc2)nc1 ZINC000468826721 882878940 /nfs/dbraw/zinc/87/89/40/882878940.db2.gz DXOLHTWRKWEPBG-ZDUSSCGKSA-N 0 3 405.271 4.150 20 0 HIADHN C[C@@H]1CN(c2nnc(C3CCC3)n2C[C@@H]2CCCCO2)[C@H](C)CN1Cc1ccccc1 ZINC000461826686 874955137 /nfs/dbraw/zinc/95/51/37/874955137.db2.gz IXDCGKNBXDAGKB-VIZSFHNOSA-N 0 3 423.605 4.214 20 0 HIADHN C[C@@H]1CN(c2nnc(C3CCC3)n2C[C@H]2CCCCO2)[C@@H](C)CN1Cc1ccccc1 ZINC000461826687 874955560 /nfs/dbraw/zinc/95/55/60/874955560.db2.gz IXDCGKNBXDAGKB-ZRCGQRJVSA-N 0 3 423.605 4.214 20 0 HIADHN CC1(C)OCc2cc(CN3CCC(C(=O)Nc4ccc(Cl)cn4)CC3)ccc2O1 ZINC000468832769 882881094 /nfs/dbraw/zinc/88/10/94/882881094.db2.gz CXTZKSPPFJOMHJ-UHFFFAOYSA-N 0 3 415.921 4.231 20 0 HIADHN CC(C)Cc1ccc([C@H](C)C(=O)Nc2ccc3oc(=O)n(CCN(C)C)c3c2)cc1 ZINC000468860786 882893943 /nfs/dbraw/zinc/89/39/43/882893943.db2.gz GSOYBPONTCNCRC-KRWDZBQOSA-N 0 3 409.530 4.097 20 0 HIADHN O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)N[C@H]1CCCc2cn(C3CCCC3)nc21 ZINC000461945573 875077943 /nfs/dbraw/zinc/07/79/43/875077943.db2.gz DQPRIXLUKVATTB-GGAORHGYSA-N 0 3 421.589 4.339 20 0 HIADHN O=C1[C@H](NCc2cc(Cl)cc3cccnc32)CCCN1Cc1ccc(F)cc1F ZINC000468864356 882896615 /nfs/dbraw/zinc/89/66/15/882896615.db2.gz FLLJSTOABDOGEB-HXUWFJFHSA-N 0 3 415.871 4.447 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N[C@@H]2CCCc3cn(C4CCCC4)nc32)N(C)C)cc1 ZINC000462007783 875128408 /nfs/dbraw/zinc/12/84/08/875128408.db2.gz NGAUCWYAMDKWCP-FGZHOGPDSA-N 0 3 409.578 4.286 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)N(C)[C@@H](C)c3cc4ccccc4o3)CC2)c1 ZINC000462023032 875139229 /nfs/dbraw/zinc/13/92/29/875139229.db2.gz IRVZTCPWFQQBTD-FQEVSTJZSA-N 0 3 405.542 4.473 20 0 HIADHN Cc1nc2ccc(Br)cc2c(N2CCN(Cc3ccncc3)CC2)c1C ZINC000462107778 875214983 /nfs/dbraw/zinc/21/49/83/875214983.db2.gz ZSHTVWUWDUUQCM-UHFFFAOYSA-N 0 3 411.347 4.331 20 0 HIADHN COc1ccc([C@@H](CNc2ncccc2C(=O)N2CCCCC2)N2CCCCC2)cc1 ZINC000462122095 875225079 /nfs/dbraw/zinc/22/50/79/875225079.db2.gz RCYGYYFWWBSVHR-HSZRJFAPSA-N 0 3 422.573 4.355 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1cnn(-c2ccccc2)c1C1CC1 ZINC000462171583 875268042 /nfs/dbraw/zinc/26/80/42/875268042.db2.gz SSVGKPZBZGJEQN-FDDCHVKYSA-N 0 3 400.526 4.000 20 0 HIADHN C[C@@H]1CCCN(c2cc(C(=O)N3CC[C@H](C)N(Cc4ccccc4)CC3)ccn2)C1 ZINC000462176248 875274710 /nfs/dbraw/zinc/27/47/10/875274710.db2.gz BWAQTHCTPURBCM-RTWAWAEBSA-N 0 3 406.574 4.055 20 0 HIADHN CSc1nc(-c2ccco2)nc(C)c1C(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C ZINC000462185714 875286822 /nfs/dbraw/zinc/28/68/22/875286822.db2.gz YWYIHEBBBHIUFD-QAPCUYQASA-N 0 3 422.554 4.017 20 0 HIADHN C[C@H](C(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C)c1ccc(Br)s1 ZINC000462194546 875302149 /nfs/dbraw/zinc/30/21/49/875302149.db2.gz IPEZIEANLRYTOP-YCPHGPKFSA-N 0 3 407.377 4.251 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Cc1csc(-c2cccc(F)c2)n1 ZINC000462194676 875303326 /nfs/dbraw/zinc/30/33/26/875303326.db2.gz IRCKJSNFQPOQCS-IIBYNOLFSA-N 0 3 409.530 4.128 20 0 HIADHN CCCN(C(=O)NCCCc1nccs1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000462222940 875331901 /nfs/dbraw/zinc/33/19/01/875331901.db2.gz ITLBCZDUYCFRBO-FQEVSTJZSA-N 0 3 400.592 4.162 20 0 HIADHN C[C@H](NC(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C)c1ncc(-c2ccccc2)o1 ZINC000462226234 875335849 /nfs/dbraw/zinc/33/58/49/875335849.db2.gz QNISYNZDDXLVMH-WFXMLNOXSA-N 0 3 404.514 4.222 20 0 HIADHN Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C ZINC000462264652 875390220 /nfs/dbraw/zinc/39/02/20/875390220.db2.gz ZGGMIFCIOGHACH-AUSIDOKSSA-N 0 3 422.573 4.023 20 0 HIADHN C[C@@H](C(=O)Nc1ccc(OC2CCN(C)CC2)nc1)c1cccc(Br)c1 ZINC000462277271 875404745 /nfs/dbraw/zinc/40/47/45/875404745.db2.gz YMAJYQLCMZJFSW-CQSZACIVSA-N 0 3 418.335 4.059 20 0 HIADHN C[C@@H]1CN(C)CC[C@H]1N(C)S(=O)(=O)c1ccc(Oc2cccc(Cl)c2)cc1 ZINC000462353361 875466164 /nfs/dbraw/zinc/46/61/64/875466164.db2.gz APPRADSMWNJGEB-FOIQADDNSA-N 0 3 408.951 4.093 20 0 HIADHN COc1ccc2cc([C@@H](C)NCc3cccc(N4CCCS4(=O)=O)c3)ccc2c1 ZINC000462356208 875469646 /nfs/dbraw/zinc/46/96/46/875469646.db2.gz JPULVHRGCFKVMZ-QGZVFWFLSA-N 0 3 410.539 4.239 20 0 HIADHN O=S1(=O)CCCN1c1cccc(CN[C@H](Cc2ccccc2)c2ccccc2)c1 ZINC000462359313 875473409 /nfs/dbraw/zinc/47/34/09/875473409.db2.gz IMUDWXBESNLWSD-XMMPIXPASA-N 0 3 406.551 4.300 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)NC[C@H]2CC[C@@H](c3ccccc3)O2)CC1 ZINC000462483072 875593643 /nfs/dbraw/zinc/59/36/43/875593643.db2.gz ZQJIUGKMMBTVDF-RPWUZVMVSA-N 0 3 407.558 4.213 20 0 HIADHN O=S1(=O)CCCN1c1cccc(CNCc2ccc(-c3ccc(F)cc3)s2)c1 ZINC000462542806 875664088 /nfs/dbraw/zinc/66/40/88/875664088.db2.gz PLHOFDQDXYMSAD-UHFFFAOYSA-N 0 3 416.543 4.384 20 0 HIADHN Cc1ccnc(-c2ccc(NC(=O)N[C@H]3CN(Cc4ccccc4)C[C@@H]3C)cc2)n1 ZINC000462556945 875683065 /nfs/dbraw/zinc/68/30/65/875683065.db2.gz GJEHTSBRQNLCJB-JTSKRJEESA-N 0 3 401.514 4.094 20 0 HIADHN Cc1ccnc(-c2cccc(NC(=O)N[C@H]3CN(Cc4ccccc4)C[C@@H]3C)c2)n1 ZINC000462557358 875683244 /nfs/dbraw/zinc/68/32/44/875683244.db2.gz LOQCBLWYOMVRSW-JTSKRJEESA-N 0 3 401.514 4.094 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)Nc1ccccc1CC(=O)OC(C)(C)C ZINC000462665221 875765576 /nfs/dbraw/zinc/76/55/76/875765576.db2.gz VZEMCAGMPVHDQA-GCJKJVERSA-N 0 3 423.557 4.213 20 0 HIADHN Cc1ccc([C@@H](CNCc2ccc(Br)cc2Cl)N2CCOCC2)o1 ZINC000462681126 875776436 /nfs/dbraw/zinc/77/64/36/875776436.db2.gz VLOILPPRADKYHS-QGZVFWFLSA-N 0 3 413.743 4.167 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Nc1c(F)cc(Br)cc1F ZINC000462684755 875778629 /nfs/dbraw/zinc/77/86/29/875778629.db2.gz UOFDFPWYVFGGMN-YVEFUNNKSA-N 0 3 424.289 4.369 20 0 HIADHN COc1cc(NC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)cc(OC)c1C(C)C ZINC000462705272 875791094 /nfs/dbraw/zinc/79/10/94/875791094.db2.gz PBSQWMZXGWJYBP-FXAWDEMLSA-N 0 3 411.546 4.469 20 0 HIADHN COc1ccc(C)nc1NC(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1 ZINC000462726665 875803524 /nfs/dbraw/zinc/80/35/24/875803524.db2.gz KADHJYRYLWBGAT-UHFFFAOYSA-N 0 3 410.440 4.013 20 0 HIADHN CCOc1c(Br)cc(Br)cc1CNCC[C@H](O)C(C)C ZINC000462729801 875805912 /nfs/dbraw/zinc/80/59/12/875805912.db2.gz CSZLYTSDALFWGZ-AWEZNQCLSA-N 0 3 409.162 4.107 20 0 HIADHN COc1ccc(F)cc1CNC[C@@H](c1ccc(C(F)(F)F)cc1)N1CCOCC1 ZINC000462780372 875836504 /nfs/dbraw/zinc/83/65/04/875836504.db2.gz VUTUDRPQWRTEPF-IBGZPJMESA-N 0 3 412.427 4.016 20 0 HIADHN COC(=O)c1cc(CN[C@@H](Cc2ccc(OC)cc2)c2ccc(OC)cc2)n(C)c1C ZINC000462784327 875838680 /nfs/dbraw/zinc/83/86/80/875838680.db2.gz DMDIEFHXSSBXGR-DEOSSOPVSA-N 0 3 422.525 4.211 20 0 HIADHN Cc1nn(C(C)C)cc1CNC[C@@H](c1c(F)cccc1Cl)N1CCO[C@@H](C)C1 ZINC000462787923 875840216 /nfs/dbraw/zinc/84/02/16/875840216.db2.gz MJPNYTISODEIAK-YWZLYKJASA-N 0 3 408.949 4.117 20 0 HIADHN CC(C)(C)OC(=O)c1ccc(CNCc2ccc(Cn3ccccc3=O)cc2)cc1 ZINC000462789222 875841667 /nfs/dbraw/zinc/84/16/67/875841667.db2.gz JGRRXDXCSBGROZ-UHFFFAOYSA-N 0 3 404.510 4.142 20 0 HIADHN Cn1cc(CNCCSCCOc2cccc(Br)c2)c(C(F)F)n1 ZINC000462788257 875841739 /nfs/dbraw/zinc/84/17/39/875841739.db2.gz GJQZINYTZPKULV-UHFFFAOYSA-N 0 3 420.323 4.022 20 0 HIADHN Cc1nc2ccc(Br)cc2c(N[C@@H]2CCc3nnc(C(C)C)n3C2)c1C ZINC000462800108 875848524 /nfs/dbraw/zinc/84/85/24/875848524.db2.gz CGJALNFTEGRIME-OAHLLOKOSA-N 0 3 414.351 4.178 20 0 HIADHN C[C@@H](NCCCN1C(=O)COc2ccccc21)c1csc(-c2ccccc2F)n1 ZINC000462806939 875853326 /nfs/dbraw/zinc/85/33/26/875853326.db2.gz QSKBDMAYSVPODS-OAHLLOKOSA-N 0 3 411.502 4.416 20 0 HIADHN CNc1cc(N2CCC[C@H]2CN[C@H](C)c2csc(-c3ccccc3F)n2)ncn1 ZINC000462817193 875859073 /nfs/dbraw/zinc/85/90/73/875859073.db2.gz NBICUBOAFPLIGE-CABCVRRESA-N 0 3 412.538 4.101 20 0 HIADHN Cc1ccc(C(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)cc1NC(=O)NC(C)(C)C ZINC000462821551 875860562 /nfs/dbraw/zinc/86/05/62/875860562.db2.gz ZPSLDIBUIQGYEZ-GCJKJVERSA-N 0 3 422.573 4.165 20 0 HIADHN Cc1ccc(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)cc1NC(=O)NC(C)(C)C ZINC000462821552 875860777 /nfs/dbraw/zinc/86/07/77/875860777.db2.gz ZPSLDIBUIQGYEZ-PGRDOPGGSA-N 0 3 422.573 4.165 20 0 HIADHN O=S1(=O)CCCN1c1cccc(CN[C@H]2CCc3c2ccc(Cl)c3Cl)c1 ZINC000462832760 875867169 /nfs/dbraw/zinc/86/71/69/875867169.db2.gz HOPOEVHDUCOFLZ-SFHVURJKSA-N 0 3 411.354 4.310 20 0 HIADHN CCOc1cc(CN(C(C)C)[C@H]2CCOC2)cc(Br)c1OC(F)F ZINC000462874011 875904731 /nfs/dbraw/zinc/90/47/31/875904731.db2.gz ZYFOLSQFQMYNSS-ZDUSSCGKSA-N 0 3 408.283 4.449 20 0 HIADHN O=C(c1cccnc1N[C@@H]1CCCN(Cc2ccccc2)C1)N1CCc2ccccc21 ZINC000462924509 875952758 /nfs/dbraw/zinc/95/27/58/875952758.db2.gz GEFDYHRDSOVFKR-JOCHJYFZSA-N 0 3 412.537 4.361 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N1CCC(C(F)(F)F)(C(F)(F)F)C1 ZINC000463011306 876028443 /nfs/dbraw/zinc/02/84/43/876028443.db2.gz LGIKRFWXHRAVIJ-HIFRSBDPSA-N 0 3 423.401 4.033 20 0 HIADHN CCN(Cc1cn(-c2ccccc2)nc1-c1cc(OC)ccc1OC)[C@@H]1CCOC1 ZINC000463030119 876049599 /nfs/dbraw/zinc/04/95/99/876049599.db2.gz HANPTFLDFRDAOI-HXUWFJFHSA-N 0 3 407.514 4.167 20 0 HIADHN COc1cc(CN2CCC[C@@](CO)(Cc3ccccc3)C2)ccc1OCC(F)(F)F ZINC000463028872 876049996 /nfs/dbraw/zinc/04/99/96/876049996.db2.gz CFDHOGJHCKGTKO-JOCHJYFZSA-N 0 3 423.475 4.454 20 0 HIADHN C[C@H](CN1CCCCC1)NC(=O)c1ccc(-c2noc(-c3ccc(F)cc3)n2)cc1 ZINC000463117744 876160272 /nfs/dbraw/zinc/16/02/72/876160272.db2.gz XOPWFMIHKBIZIZ-MRXNPFEDSA-N 0 3 408.477 4.147 20 0 HIADHN COc1cccc([C@H](CNC(=O)N[C@H]2CCO[C@@H](c3ccccc3)C2)N2CCCC2)c1 ZINC000463155972 876209375 /nfs/dbraw/zinc/20/93/75/876209375.db2.gz QEWREIXCWWMIBA-OEMFJLHTSA-N 0 3 423.557 4.052 20 0 HIADHN C[C@@H]1CC[C@H](O)[C@@H]([C@@H]2CCCCN2Cc2csc(-c3ccc(C(N)=O)cc3)n2)C1 ZINC000463196061 876256796 /nfs/dbraw/zinc/25/67/96/876256796.db2.gz ARUIQJMLZSAONC-IDCXYZFESA-N 0 3 413.587 4.061 20 0 HIADHN CCOc1ccc(NC(=O)CN2CCCC[C@@H]2[C@@H]2C[C@H](C)CC[C@@H]2O)cc1OCC ZINC000463205887 876266119 /nfs/dbraw/zinc/26/61/19/876266119.db2.gz VSZCCMAHOGGDBS-PMXSJFBMSA-N 0 3 418.578 4.074 20 0 HIADHN CCOc1ccccc1[C@H](CC)NC(=O)CN1CCCC[C@@H]1[C@H]1CCCC[C@@H]1O ZINC000463213772 876273449 /nfs/dbraw/zinc/27/34/49/876273449.db2.gz NXVSXWYCHWEZIN-MBDNFAEBSA-N 0 3 402.579 4.058 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)NCc3ccc(C(F)F)cc3)CC2)C[C@H](C)O1 ZINC000463219786 876279218 /nfs/dbraw/zinc/27/92/18/876279218.db2.gz AFRLRDNFBZMKNN-CALCHBBNSA-N 0 3 409.521 4.045 20 0 HIADHN CCc1ccc(Cl)c(CC)c1NC(=O)CCCN1CCC(F)(F)[C@@H](CO)C1 ZINC000463231738 876286295 /nfs/dbraw/zinc/28/62/95/876286295.db2.gz OWJWUIGPPGALSG-OAHLLOKOSA-N 0 3 402.913 4.133 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)NCc1ccc(-c2ccncc2)cc1 ZINC000463275482 876333271 /nfs/dbraw/zinc/33/32/71/876333271.db2.gz LGSCJIVRRUCQCO-YADARESESA-N 0 3 400.526 4.068 20 0 HIADHN CCc1nc2c(s1)[C@H](N(C)C(=O)N[C@@H]1CN(Cc3ccccc3)C[C@H]1C)CCC2 ZINC000463280081 876336322 /nfs/dbraw/zinc/33/63/22/876336322.db2.gz RANYBNIVJIEUIS-NSISKUIASA-N 0 3 412.603 4.245 20 0 HIADHN COC(=O)CCCN1CCC(Nc2cccc(OCc3cccc(F)c3)c2)CC1 ZINC000463298775 876360450 /nfs/dbraw/zinc/36/04/50/876360450.db2.gz ARKOUACUWCBWHK-UHFFFAOYSA-N 0 3 400.494 4.234 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3ccc(F)c(Br)c3)c(C)c2)CC1 ZINC000463322019 876378932 /nfs/dbraw/zinc/37/89/32/876378932.db2.gz WCOWWKGSYOSAMT-UHFFFAOYSA-N 0 3 420.326 4.291 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1Cc2ccc(O)cc2C2(CC2)C1)c1cccc(OC)c1 ZINC000463338128 876393582 /nfs/dbraw/zinc/39/35/82/876393582.db2.gz ANGWOYPHXKYIKV-HSZRJFAPSA-N 0 3 423.557 4.041 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)cc1C(=O)NC[C@H](c1ccccc1)N1CCCC1 ZINC000463432636 876489932 /nfs/dbraw/zinc/48/99/32/876489932.db2.gz APGCRRKMGYSAML-JOCHJYFZSA-N 0 3 408.933 4.401 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N[C@@H](C)c3oc4ccc(OC)cc4c3C)cc2)CC1 ZINC000468966688 883034510 /nfs/dbraw/zinc/03/45/10/883034510.db2.gz KQXXLNVAMMUSEK-SFHVURJKSA-N 0 3 421.541 4.383 20 0 HIADHN O=C([C@H](c1ccccc1)N1CCC[C@](CO)(Cc2ccccc2)C1)N1CCCCC1 ZINC000463437457 876492733 /nfs/dbraw/zinc/49/27/33/876492733.db2.gz FAAYXXDRLUQPCZ-AHWVRZQESA-N 0 3 406.570 4.057 20 0 HIADHN OC[C@]1(Cc2ccccc2)CCCN(C[C@@H](O)COc2c(Cl)cccc2Cl)C1 ZINC000463446074 876504336 /nfs/dbraw/zinc/50/43/36/876504336.db2.gz BMVITNWJEVHRPU-GCJKJVERSA-N 0 3 424.368 4.050 20 0 HIADHN CN1CCN(CCCNC(=O)c2c(Cl)cccc2Oc2ccccc2Cl)CC1 ZINC000463446861 876505685 /nfs/dbraw/zinc/50/56/85/876505685.db2.gz XXFQXXKHQABWPD-UHFFFAOYSA-N 0 3 422.356 4.153 20 0 HIADHN Cc1nn(C)c(Sc2ccccc2)c1C(=O)NCCCN1CCc2ccccc2C1 ZINC000463496906 876556249 /nfs/dbraw/zinc/55/62/49/876556249.db2.gz GRVRHPCGWXHDTN-UHFFFAOYSA-N 0 3 420.582 4.058 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)c1cc(NC(=O)C(C)(C)C)ccc1F ZINC000463509770 876572814 /nfs/dbraw/zinc/57/28/14/876572814.db2.gz RQDPLUSCSYQCQK-UHFFFAOYSA-N 0 3 417.500 4.153 20 0 HIADHN C[C@H](C(=O)N(CCN(C)C)Cc1cccc(F)c1)c1ccc(Br)s1 ZINC000463524977 876595352 /nfs/dbraw/zinc/59/53/52/876595352.db2.gz GZXHQIVYQWBUJD-ZDUSSCGKSA-N 0 3 413.356 4.344 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)[C@@H]1C[C@H]1c1cc(F)c(F)c(F)c1 ZINC000463526036 876596977 /nfs/dbraw/zinc/59/69/77/876596977.db2.gz DGIAWMQFESUOCT-LSDHHAIUSA-N 0 3 412.402 4.076 20 0 HIADHN CC(C)c1nn(C)c2sc(C(=O)N(CCN(C)C)Cc3ccc(F)c(F)c3)cc12 ZINC000463531388 876607565 /nfs/dbraw/zinc/60/75/65/876607565.db2.gz IHEJMFGVMPVICZ-UHFFFAOYSA-N 0 3 420.529 4.240 20 0 HIADHN Cc1nn(C)c(Sc2ccccc2)c1C(=O)N[C@@H]1C[C@@H](C)N(Cc2ccccc2)C1 ZINC000463576608 876674546 /nfs/dbraw/zinc/67/45/46/876674546.db2.gz ODMJIGUJEGOOSH-YLJYHZDGSA-N 0 3 420.582 4.273 20 0 HIADHN CN(C)Cc1cccc(NC(=O)Nc2ccc(Cc3nnc4n3CCCCC4)cc2)c1 ZINC000463705001 876824291 /nfs/dbraw/zinc/82/42/91/876824291.db2.gz LEPXMJJSNQEXMG-UHFFFAOYSA-N 0 3 418.545 4.301 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)[C@@H]1C[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000463709358 876827779 /nfs/dbraw/zinc/82/77/79/876827779.db2.gz KKQAEXHYWQXXGQ-QZTJIDSGSA-N 0 3 420.500 4.437 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)[C@H]1C[C@H]1c1cc(F)c(F)c(F)c1 ZINC000463709359 876828216 /nfs/dbraw/zinc/82/82/16/876828216.db2.gz KKQAEXHYWQXXGQ-ROUUACIJSA-N 0 3 420.500 4.437 20 0 HIADHN CCCCN1CCCC[C@H]1CNC(=O)c1scc(C)c1I ZINC000469001650 883069277 /nfs/dbraw/zinc/06/92/77/883069277.db2.gz QWNSLGYUWSUJEU-ZDUSSCGKSA-N 0 3 420.360 4.046 20 0 HIADHN Cn1cc(CNCc2ccc(OCc3ccccc3F)cc2)c(-c2ccncc2)n1 ZINC000463727288 876848242 /nfs/dbraw/zinc/84/82/42/876848242.db2.gz FZXSYETZTHOHRX-UHFFFAOYSA-N 0 3 402.473 4.490 20 0 HIADHN C[C@H](C(=O)NC[C@@H]1CCCN1Cc1ccccc1)c1ccc(Br)s1 ZINC000463742204 876863790 /nfs/dbraw/zinc/86/37/90/876863790.db2.gz VFGRXJCEXOPETL-HOCLYGCPSA-N 0 3 407.377 4.395 20 0 HIADHN Cc1nn(C)c(Sc2ccccc2)c1C(=O)NC[C@H]1CCCN1Cc1ccccc1 ZINC000463770860 876893101 /nfs/dbraw/zinc/89/31/01/876893101.db2.gz NYGAMKQZOWQCJX-HXUWFJFHSA-N 0 3 420.582 4.274 20 0 HIADHN C[C@H]1CC[C@@H](CC(=O)NC2CCN(CCOc3ccc(Br)cc3)CC2)C1 ZINC000469009101 883076121 /nfs/dbraw/zinc/07/61/21/883076121.db2.gz RNFCLHVMNHBHAZ-DLBZAZTESA-N 0 3 423.395 4.235 20 0 HIADHN O=C(Nc1ccc(C(=O)NCCN2CCCC2)cc1)c1cscc1-c1ccccc1 ZINC000463822297 876935477 /nfs/dbraw/zinc/93/54/77/876935477.db2.gz WCKXPHPXKWYASU-UHFFFAOYSA-N 0 3 419.550 4.493 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1ccc2c(C)nn(C)c2c1)c1cccc(OC)c1 ZINC000463845755 876968379 /nfs/dbraw/zinc/96/83/79/876968379.db2.gz IVCFXHMBJDRLOQ-JOCHJYFZSA-N 0 3 409.534 4.095 20 0 HIADHN Cn1ccc(N2CCC[C@@H](N[C@@H](Cc3ccc(Cl)cc3)c3ccccc3)C2=O)n1 ZINC000463895872 877018296 /nfs/dbraw/zinc/01/82/96/877018296.db2.gz LCOLRRPYORQQIC-RTWAWAEBSA-N 0 3 408.933 4.143 20 0 HIADHN COCCOc1ccc([C@@H](C)NCc2ccc(C)nc2-n2cc(Cl)cn2)cc1 ZINC000469031347 883099894 /nfs/dbraw/zinc/09/98/94/883099894.db2.gz SNSWRUVTVFGOIH-MRXNPFEDSA-N 0 3 400.910 4.105 20 0 HIADHN Clc1ccc(Br)c(CNC[C@H](c2ccccc2)N2CCOCC2)c1 ZINC000464047535 877189142 /nfs/dbraw/zinc/18/91/42/877189142.db2.gz ICEURGKWOKNOGX-LJQANCHMSA-N 0 3 409.755 4.266 20 0 HIADHN Cc1cc(N2CCC[C@H](N[C@@H](C)c3cccc(CO)c3)C2=O)ccc1Br ZINC000464076049 877225083 /nfs/dbraw/zinc/22/50/83/877225083.db2.gz XXQZSFFCPGOHDP-YWZLYKJASA-N 0 3 417.347 4.096 20 0 HIADHN O=C(NCc1cccc(-c2cccnc2)c1)N[C@H](CN1CCCC1)c1ccccc1 ZINC000464154027 877324051 /nfs/dbraw/zinc/32/40/51/877324051.db2.gz TUJXKFIASUPXIE-XMMPIXPASA-N 0 3 400.526 4.385 20 0 HIADHN O=C(NCc1cccc(-c2cccnc2)c1)NC[C@H](c1ccccc1)N1CCCC1 ZINC000464311715 877503004 /nfs/dbraw/zinc/50/30/04/877503004.db2.gz OKMGURAVVPHPSX-XMMPIXPASA-N 0 3 400.526 4.385 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)N2Cc3ccc(O)cc3C3(CC3)C2)N(C)C)cc1 ZINC000464394069 877595746 /nfs/dbraw/zinc/59/57/46/877595746.db2.gz VYZGEHQSQIETMO-QHCPKHFHSA-N 0 3 423.557 4.039 20 0 HIADHN CC(C)CN(C(=O)c1nc2ccccc2cc1Br)C1CCN(C)CC1 ZINC000464569011 877789622 /nfs/dbraw/zinc/78/96/22/877789622.db2.gz JNOBTSXKAAEYEZ-UHFFFAOYSA-N 0 3 404.352 4.190 20 0 HIADHN CCCN(CCc1cccs1)CC(=O)N1CCC(OCc2ccccc2)CC1 ZINC000464590597 877817077 /nfs/dbraw/zinc/81/70/77/877817077.db2.gz FTDHSUXUNPWENQ-UHFFFAOYSA-N 0 3 400.588 4.210 20 0 HIADHN Fc1cc(CN(CCCOc2ccccc2)C2CCOCC2)c2c(c1)COCO2 ZINC000464601326 877830464 /nfs/dbraw/zinc/83/04/64/877830464.db2.gz YRJGRVKVLXZQHQ-UHFFFAOYSA-N 0 3 401.478 4.142 20 0 HIADHN Cc1nn(C(C)(C)C)cc1[C@H](C)NCC(=O)Nc1ccc2nc(C(F)(F)F)[nH]c2c1 ZINC000464613949 877839128 /nfs/dbraw/zinc/83/91/28/877839128.db2.gz BRAZLBAIIYIYIX-NSHDSACASA-N 0 3 422.455 4.131 20 0 HIADHN Cc1nn(C(C)(C)C)cc1[C@@H](C)NCC(=O)Nc1ccc2nc(C(F)(F)F)[nH]c2c1 ZINC000464613948 877839377 /nfs/dbraw/zinc/83/93/77/877839377.db2.gz BRAZLBAIIYIYIX-LLVKDONJSA-N 0 3 422.455 4.131 20 0 HIADHN Cc1oc2ccccc2c1C(=O)NCCCCN1CCN(c2cccc(C)c2)CC1 ZINC000464655080 877876459 /nfs/dbraw/zinc/87/64/59/877876459.db2.gz DIFOFUGSNYPCRJ-UHFFFAOYSA-N 0 3 405.542 4.382 20 0 HIADHN COCCCN(C(=O)c1ccc(O[C@H](C)c2ccccc2)cc1)C1CCN(C)CC1 ZINC000464720538 877947614 /nfs/dbraw/zinc/94/76/14/877947614.db2.gz QDLWURAEHAQRDV-HXUWFJFHSA-N 0 3 410.558 4.400 20 0 HIADHN CCCN(CC(F)(F)F)C(=O)[C@@H]1CCCN(CCOc2ccccc2Cl)C1 ZINC000464732486 877969718 /nfs/dbraw/zinc/96/97/18/877969718.db2.gz OHGMWPADYMMFRP-OAHLLOKOSA-N 0 3 406.876 4.232 20 0 HIADHN CC(=O)Nc1ccc(OC[C@@H](O)CN2Cc3ccccc3C[C@@H]2c2ccccc2)cc1 ZINC000464739347 877974203 /nfs/dbraw/zinc/97/42/03/877974203.db2.gz PUPNOHTYVRUAHD-AZGAKELHSA-N 0 3 416.521 4.184 20 0 HIADHN O=C(CN1CC[C@H](CSc2ccccc2)C1)N1CCc2[nH]c3ccccc3c2C1 ZINC000464766029 878006173 /nfs/dbraw/zinc/00/61/73/878006173.db2.gz RVJNOIJQRVJHIS-SFHVURJKSA-N 0 3 405.567 4.167 20 0 HIADHN CC(C)[C@H](Cc1ccc(F)cc1)N(C)CC(=O)Nc1cccc(N2CCCC2=O)c1 ZINC000464789827 878035240 /nfs/dbraw/zinc/03/52/40/878035240.db2.gz OZIUFKREESIOCT-QFIPXVFZSA-N 0 3 411.521 4.090 20 0 HIADHN CC(C)[C@@H](Cc1ccc(F)cc1)N(C)CC(=O)Nc1ccnn1Cc1cccs1 ZINC000464789093 878036855 /nfs/dbraw/zinc/03/68/55/878036855.db2.gz NVYIWHKTVGKQRX-HXUWFJFHSA-N 0 3 414.550 4.270 20 0 HIADHN CCc1nsc(N2CCCN(CC/C=C/c3ccc(Br)cc3)CC2)n1 ZINC000464848514 878122653 /nfs/dbraw/zinc/12/26/53/878122653.db2.gz BZUVDQCKEDKDPJ-ZZXKWVIFSA-N 0 3 421.408 4.479 20 0 HIADHN CCc1ccc([C@@H]2C[C@H](C)CCN2C[C@H](O)COc2ccc(NC(C)=O)cc2)o1 ZINC000464856253 878137185 /nfs/dbraw/zinc/13/71/85/878137185.db2.gz UPWTUFFPBJIHDD-WVBUVRCRSA-N 0 3 400.519 4.013 20 0 HIADHN COC1CCN(C(C)(C)CNC(=O)C(C)(C)c2csc(-c3cccs3)n2)CC1 ZINC000503337599 912314984 /nfs/dbraw/zinc/31/49/84/912314984.db2.gz CLBRVUDNZCLKHI-UHFFFAOYSA-N 0 3 421.632 4.155 20 0 HIADHN COC(=O)c1cc(CN2CCC[C@@H](c3nc(-c4ccc(F)cc4)no3)C2)c(C)s1 ZINC000464864731 878148551 /nfs/dbraw/zinc/14/85/51/878148551.db2.gz RZYOAHPHJJWBAS-OAHLLOKOSA-N 0 3 415.490 4.412 20 0 HIADHN COC(=O)[C@H](C)[C@@H](NCC[S@@](=O)c1cc(Cl)ccc1Cl)c1ccccc1 ZINC000464876581 878165627 /nfs/dbraw/zinc/16/56/27/878165627.db2.gz OASAMTKCZHIDQN-YHOLXWODSA-N 0 3 414.354 4.241 20 0 HIADHN C[C@H]1CCN(C(=O)c2ccc(CNC(=O)C(C)(C)C)cc2)CCN1Cc1ccccc1 ZINC000464887994 878187493 /nfs/dbraw/zinc/18/74/93/878187493.db2.gz SFWHXFFMBJSMPF-FQEVSTJZSA-N 0 3 421.585 4.086 20 0 HIADHN C[C@@H]1CCN(C(=O)Cc2ccc(F)c(Br)c2)CCN1Cc1ccccc1 ZINC000464890041 878189150 /nfs/dbraw/zinc/18/91/50/878189150.db2.gz GSSOVEYZORDYKC-MRXNPFEDSA-N 0 3 419.338 4.254 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1C(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1 ZINC000464891061 878191869 /nfs/dbraw/zinc/19/18/69/878191869.db2.gz IVRRHIOOKLRFDP-IBGZPJMESA-N 0 3 402.542 4.226 20 0 HIADHN CC(=O)CCc1ccc(OCCC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)cc1 ZINC000464901543 878211713 /nfs/dbraw/zinc/21/17/13/878211713.db2.gz GZXGTVMCVJIDFY-NRFANRHFSA-N 0 3 422.569 4.100 20 0 HIADHN Cc1noc2nc(C3CC3)cc(C(=O)N3CC[C@@H](C)N(Cc4ccccc4)CC3)c12 ZINC000464905815 878218293 /nfs/dbraw/zinc/21/82/93/878218293.db2.gz LANKKSJOAMIMMI-MRXNPFEDSA-N 0 3 404.514 4.145 20 0 HIADHN Cc1c(C(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)cnn1-c1ccccc1C ZINC000464907797 878223565 /nfs/dbraw/zinc/22/35/65/878223565.db2.gz SDEKWPBWWWXMGD-FQEVSTJZSA-N 0 3 402.542 4.226 20 0 HIADHN O=C(NCc1ccco1)c1cccc(CN2CCC[C@H](c3ncc4n3CCCC4)C2)c1 ZINC000503369298 912345834 /nfs/dbraw/zinc/34/58/34/912345834.db2.gz BVVXLEYDZNGIHL-NRFANRHFSA-N 0 3 418.541 4.122 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)NCc2ccc(-c3ccco3)cc2F)cc1 ZINC000503390462 912373657 /nfs/dbraw/zinc/37/36/57/912373657.db2.gz LUEVWYSVFJEEOR-NRFANRHFSA-N 0 3 411.477 4.196 20 0 HIADHN CC1CCN([C@H](CNC(=O)N2CCOC[C@@H]2c2ccccc2)c2cccs2)CC1 ZINC000465423941 878852852 /nfs/dbraw/zinc/85/28/52/878852852.db2.gz SFOBGSUYVNIOQU-NHCUHLMSSA-N 0 3 413.587 4.304 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N[C@@H](c1cccc(F)c1)C1CCCC1 ZINC000465423289 878852866 /nfs/dbraw/zinc/85/28/66/878852866.db2.gz MNNABCGLWAASEJ-JOCHJYFZSA-N 0 3 411.521 4.182 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)N[C@@H](C)c2ccc(-n3cccn3)cc2)N(C)C)cc1 ZINC000465426158 878856164 /nfs/dbraw/zinc/85/61/64/878856164.db2.gz ROCJDXZNRAITGZ-FDDCHVKYSA-N 0 3 405.546 4.098 20 0 HIADHN C[C@@H]1CN(C(=O)NC[C@H](c2cccs2)N2CCCC2)C[C@H](c2ccc(F)cc2)O1 ZINC000465427665 878857952 /nfs/dbraw/zinc/85/79/52/878857952.db2.gz JRMICCJPQIYWID-NSISKUIASA-N 0 3 417.550 4.196 20 0 HIADHN CCO[C@H](C)c1nc(CN(C)C(=O)NC[C@H](c2ccc(CC)cc2)N(C)C)cs1 ZINC000465434113 878866603 /nfs/dbraw/zinc/86/66/03/878866603.db2.gz PEAKAGZISPFNRW-OXQOHEQNSA-N 0 3 418.607 4.247 20 0 HIADHN COc1cccc([C@H](CNC(=O)NC[C@H](C)Cc2cccs2)N2CCCC2)c1 ZINC000465470851 878906100 /nfs/dbraw/zinc/90/61/00/878906100.db2.gz FPAREEKFFCOPSP-UTKZUKDTSA-N 0 3 401.576 4.072 20 0 HIADHN C[C@H]1CCN(C(=O)NCc2ccc(OC3CCCC3)nc2)CCN1Cc1ccccc1 ZINC000465516373 878963372 /nfs/dbraw/zinc/96/33/72/878963372.db2.gz MBMQYNOFVHGMQR-FQEVSTJZSA-N 0 3 422.573 4.209 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NC[C@@H]1CCO[C@@H]1c1ccccc1)c1ccsc1 ZINC000465528792 878983959 /nfs/dbraw/zinc/98/39/59/878983959.db2.gz UNHDZNIVBLREPD-CEWLAPEOSA-N 0 3 401.576 4.208 20 0 HIADHN O=C(NCc1ccc(-c2cccnc2)cc1)N[C@H](CN1CCCC1)c1ccccc1 ZINC000465528612 878984040 /nfs/dbraw/zinc/98/40/40/878984040.db2.gz JXRCJXWFCFLBCM-XMMPIXPASA-N 0 3 400.526 4.385 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N(C)[C@H](C)Cc1ccccc1OC)c1ccsc1 ZINC000465537036 878996536 /nfs/dbraw/zinc/99/65/36/878996536.db2.gz GHATWUFDFQXCII-YLJYHZDGSA-N 0 3 403.592 4.412 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N(C)[C@H](C)Cc1ccccc1OC)c1ccsc1 ZINC000465537035 878996992 /nfs/dbraw/zinc/99/69/92/878996992.db2.gz GHATWUFDFQXCII-XLIONFOSSA-N 0 3 403.592 4.412 20 0 HIADHN CC(=O)Nc1cccc([C@H](C)NC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)c1 ZINC000465563375 879035415 /nfs/dbraw/zinc/03/54/15/879035415.db2.gz GQBGVYPEQVRHJD-MOPGFXCFSA-N 0 3 408.546 4.012 20 0 HIADHN C[C@@H](NC(=O)N[C@H](CN1CCCC1)c1ccccc1)c1nc(C2CCCCC2)no1 ZINC000465595591 879081535 /nfs/dbraw/zinc/08/15/35/879081535.db2.gz JACSQIAGYYNVSR-YLJYHZDGSA-N 0 3 411.550 4.315 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)N[C@@H](c2ccc(C(C)C)cc2)C(C)C)CC1 ZINC000465638359 879154481 /nfs/dbraw/zinc/15/44/81/879154481.db2.gz VCJMTPCIAGTNRT-NFBKMPQASA-N 0 3 402.627 4.080 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)N[C@@H](c2ccc(C(C)C)cc2)C(C)C)CC1 ZINC000465638360 879154724 /nfs/dbraw/zinc/15/47/24/879154724.db2.gz VCJMTPCIAGTNRT-NZQKXSOJSA-N 0 3 402.627 4.080 20 0 HIADHN CN(C)CCN(C[C@H]1CCCO1)C(=O)N[C@H](CCc1ccccc1)c1ccccc1 ZINC000465649097 879169767 /nfs/dbraw/zinc/16/97/67/879169767.db2.gz BJNDDUSTQXVPNP-DNQXCXABSA-N 0 3 409.574 4.113 20 0 HIADHN CC(C)CC[C@H](NC(=O)NC[C@H](C)CN1CCN(C)CC1)c1ccc(Cl)cc1 ZINC000465664143 879196579 /nfs/dbraw/zinc/19/65/79/879196579.db2.gz PTCKYSDTCVOMFV-RXVVDRJESA-N 0 3 409.018 4.000 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)N2C[C@@H](C)O[C@@H](c3ccc(F)cc3)C2)C1 ZINC000465741929 879327497 /nfs/dbraw/zinc/32/74/97/879327497.db2.gz ADCCJUMNJJCFCW-AAUAJYIVSA-N 0 3 411.521 4.133 20 0 HIADHN C[C@H]1CCN(C(=O)N[C@@H]2CCOc3c(Cl)cccc32)CCN1Cc1ccccc1 ZINC000465750482 879337823 /nfs/dbraw/zinc/33/78/23/879337823.db2.gz ICUSZOVJFLCWLH-LAUBAEHRSA-N 0 3 413.949 4.470 20 0 HIADHN COc1ccc(C2CCN(C(=O)N[C@@H]3CCN([C@@H](C)c4ccccc4)C3)CC2)cc1 ZINC000465766231 879365183 /nfs/dbraw/zinc/36/51/83/879365183.db2.gz ZHFJMFZKVRUOTL-WMZHIEFXSA-N 0 3 407.558 4.420 20 0 HIADHN C[C@H]1CCN(C(=O)NCc2cccc(Br)c2)CCN1Cc1ccccc1 ZINC000465768372 879368060 /nfs/dbraw/zinc/36/80/60/879368060.db2.gz BWQMGTOLVLZOMB-KRWDZBQOSA-N 0 3 416.363 4.255 20 0 HIADHN COc1ccc(C(C)(C)CNC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)cc1 ZINC000465814589 879437077 /nfs/dbraw/zinc/43/70/77/879437077.db2.gz PYCAJWPDAGONJJ-FQEVSTJZSA-N 0 3 409.574 4.279 20 0 HIADHN C[C@@H](NC(=O)N(CCN(C)C)C[C@@H]1CCCO1)c1ccc(Oc2ccccc2)cc1 ZINC000465816869 879439925 /nfs/dbraw/zinc/43/99/25/879439925.db2.gz PHORXHCADCAHOR-XXBNENTESA-N 0 3 411.546 4.292 20 0 HIADHN Cc1ccc([C@H](CNC(=O)NC[C@H]2CCO[C@H]2c2ccccc2)N2CCCC2)cc1 ZINC000465820275 879446035 /nfs/dbraw/zinc/44/60/35/879446035.db2.gz RNUIASLNAMAPGC-SGNDLWITSA-N 0 3 407.558 4.209 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)N[C@H](CC2CCCCC2)c2ccccc2)CC1 ZINC000465836394 879472613 /nfs/dbraw/zinc/47/26/13/879472613.db2.gz OTRFDEZBMOORKW-ZJSXRUAMSA-N 0 3 414.638 4.271 20 0 HIADHN C[C@@H]1CCN(C(=O)N[C@H](c2ccccc2)[C@@H]2CCCO2)CCN1Cc1ccccc1 ZINC000465839952 879477292 /nfs/dbraw/zinc/47/72/92/879477292.db2.gz JMQYNIJZTDWAPW-FGCOXFRFSA-N 0 3 407.558 4.213 20 0 HIADHN Cc1csc(CCCCNC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)n1 ZINC000465844583 879485331 /nfs/dbraw/zinc/48/53/31/879485331.db2.gz LBYIBDJMQYMDRA-LJQANCHMSA-N 0 3 400.592 4.080 20 0 HIADHN CC[C@@H](NC(=O)NC[C@H](C)N(C)Cc1ccccc1)c1nc(C(F)(F)F)cs1 ZINC000465865918 879516564 /nfs/dbraw/zinc/51/65/64/879516564.db2.gz AWLRURQPMUVLAP-DZGCQCFKSA-N 0 3 414.497 4.433 20 0 HIADHN CN(C)CCN(C[C@H]1CCCO1)C(=O)N[C@H](c1ccc(Cl)cc1)C1CCCC1 ZINC000465890266 879546489 /nfs/dbraw/zinc/54/64/89/879546489.db2.gz LMWAQTIUMDHMLY-RTWAWAEBSA-N 0 3 407.986 4.324 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)N[C@@H](c2oc3ccccc3c2C)C(C)C)CC1 ZINC000465923937 879586558 /nfs/dbraw/zinc/58/65/58/879586558.db2.gz RXBIZYCHCVKDCK-XMSQKQJNSA-N 0 3 414.594 4.011 20 0 HIADHN COc1ccc([C@@H](C)CCNC(=O)N(CCN(C)C)Cc2cccc(F)c2)cc1 ZINC000466042864 879731855 /nfs/dbraw/zinc/73/18/55/879731855.db2.gz YKSNZOMWXPUQRR-SFHVURJKSA-N 0 3 401.526 4.101 20 0 HIADHN COc1cccc([C@@H](Cc2cc(C)cc(C)c2)NC(=O)N2CC[C@H](N3CC=CC3)C2)c1 ZINC000466049618 879737837 /nfs/dbraw/zinc/73/78/37/879737837.db2.gz LOMCYKXJARRPJR-UKILVPOCSA-N 0 3 419.569 4.252 20 0 HIADHN CN(C(=O)NCc1ccccc1COc1ccccc1Cl)[C@@H]1CCN(C2CC2)C1 ZINC000466055940 879748135 /nfs/dbraw/zinc/74/81/35/879748135.db2.gz OAUQFWQXOODNIN-HXUWFJFHSA-N 0 3 413.949 4.297 20 0 HIADHN Cc1cccc(C)c1Oc1ccccc1NC(=O)NC[C@H](C)CN1CCN(C)CC1 ZINC000466130087 879841839 /nfs/dbraw/zinc/84/18/39/879841839.db2.gz IDACFJVHCIEWKR-SFHVURJKSA-N 0 3 410.562 4.101 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)N2CCC[C@@H]2c2ccc(C(C)(C)C)cc2)CC1 ZINC000466146050 879854627 /nfs/dbraw/zinc/85/46/27/879854627.db2.gz ZYVCEGRDMCNTLI-NZQKXSOJSA-N 0 3 414.638 4.104 20 0 HIADHN C[C@@H](CCc1cccn1C)NC(=O)N(CCN(C)C)Cc1ccc(C(F)(F)F)cc1 ZINC000466150673 879857496 /nfs/dbraw/zinc/85/74/96/879857496.db2.gz MDSQNMHIODJDEY-KRWDZBQOSA-N 0 3 424.511 4.138 20 0 HIADHN COc1cc(CNC(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)c2ccccc2n1 ZINC000466185993 879881149 /nfs/dbraw/zinc/88/11/49/879881149.db2.gz CHBZUIDABQLIKV-IBGZPJMESA-N 0 3 418.541 4.049 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccc(O)cc1)C(=O)c1cnc(-c2ccncc2)s1 ZINC000503472167 912507089 /nfs/dbraw/zinc/50/70/89/912507089.db2.gz JEYFZXUGYWPUQL-IBGZPJMESA-N 0 3 422.554 4.037 20 0 HIADHN COc1ccc([C@H](CNC(=O)Nc2cccc(Cl)c2OC)N2CCCC2)cc1 ZINC000503472205 912508815 /nfs/dbraw/zinc/50/88/15/912508815.db2.gz JRXTYLWYGIEPKW-IBGZPJMESA-N 0 3 403.910 4.316 20 0 HIADHN CCOc1ccc([C@H](C)NC(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)cc1OC ZINC000466217926 879913158 /nfs/dbraw/zinc/91/31/58/879913158.db2.gz METKDETXKAFYJT-BBTUJRGHSA-N 0 3 411.546 4.117 20 0 HIADHN COc1ccc(-c2cncc(C(=O)N3CCCN(Cc4ccccc4)C[C@@H]3C)c2)cc1 ZINC000466238690 879946771 /nfs/dbraw/zinc/94/67/71/879946771.db2.gz RLZSBVGHKSKAKJ-FQEVSTJZSA-N 0 3 415.537 4.494 20 0 HIADHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)[C@@H]1CCCC(F)(F)C1 ZINC000503482430 912525849 /nfs/dbraw/zinc/52/58/49/912525849.db2.gz KQPAWUPGBQRCAW-OAHLLOKOSA-N 0 3 403.311 4.165 20 0 HIADHN COc1ccc([C@@H](NC(=O)N2CCN(C)CC[C@H]2C)c2ccccc2Cl)c(C)c1 ZINC000466385238 880144668 /nfs/dbraw/zinc/14/46/68/880144668.db2.gz BWUYWFBFFVCRGI-VGOFRKELSA-N 0 3 415.965 4.482 20 0 HIADHN C[C@H](CCNC(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1)c1ccccc1 ZINC000466389848 880150472 /nfs/dbraw/zinc/15/04/72/880150472.db2.gz RSLDMWXLWOLBJV-NJYVYQBISA-N 0 3 401.595 4.101 20 0 HIADHN COc1ccc([C@@H](CNC(=O)Nc2cccc(Cl)c2N(C)C)N2CCCC2)cc1 ZINC000503490995 912537898 /nfs/dbraw/zinc/53/78/98/912537898.db2.gz FJJUTLBRFZATOT-HXUWFJFHSA-N 0 3 416.953 4.373 20 0 HIADHN C[C@H](CNC(=O)N(CCN(C)C)Cc1ccc(F)cc1F)c1ccc(F)cc1F ZINC000466428304 880202782 /nfs/dbraw/zinc/20/27/82/880202782.db2.gz KSRTVTVWJCZUCV-CQSZACIVSA-N 0 3 411.443 4.120 20 0 HIADHN CO[C@H](C)[C@H](C)N[C@@H](C)C(=O)N1N=C(c2ccc(Cl)cc2)C[C@H]1c1ccco1 ZINC000466429029 880203574 /nfs/dbraw/zinc/20/35/74/880203574.db2.gz UQKNZWADXORXEN-ZTENYAIWSA-N 0 3 403.910 4.012 20 0 HIADHN O=C1N[C@@]2(CCN(Cc3ccccc3)C2)C(=O)N1Cc1ccc(-c2ccccc2)cc1 ZINC000466478316 880259580 /nfs/dbraw/zinc/25/95/80/880259580.db2.gz ZHETXPDQXWHCNB-AREMUKBSSA-N 0 3 411.505 4.050 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)N(C)Cc2ccccc2N2CCCC2)CN1Cc1ccccc1 ZINC000466511455 880285711 /nfs/dbraw/zinc/28/57/11/880285711.db2.gz BOWCEHVCNZDACK-NZQKXSOJSA-N 0 3 406.574 4.091 20 0 HIADHN Cc1cccc(NC(=O)N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)c1C(=O)N1CCCC1 ZINC000466515773 880288699 /nfs/dbraw/zinc/28/86/99/880288699.db2.gz PHYLXHNRAVHIKK-TZIWHRDSSA-N 0 3 420.557 4.016 20 0 HIADHN CCC(=O)Nc1ccc(Cl)c(NC(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)c1 ZINC000466518400 880294159 /nfs/dbraw/zinc/29/41/59/880294159.db2.gz YTHCHNINZNMZLG-MAUKXSAKSA-N 0 3 414.937 4.473 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)N2CCC(OCc3ccccc3)CC2)CN1Cc1ccccc1 ZINC000466522170 880297899 /nfs/dbraw/zinc/29/78/99/880297899.db2.gz ZVWNLHYGGMEUMU-NFBKMPQASA-N 0 3 407.558 4.040 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)N2CCC(Nc3ccc(F)cc3)CC2)CN1Cc1ccccc1 ZINC000466534032 880308175 /nfs/dbraw/zinc/30/81/75/880308175.db2.gz MDQQJHIKRQALEG-FDDCHVKYSA-N 0 3 410.537 4.075 20 0 HIADHN Cc1ccc(CNC(=O)c2oc3ccccc3c2CN(C)C)c(OC[C@@H]2CCCO2)c1 ZINC000466644131 880419157 /nfs/dbraw/zinc/41/91/57/880419157.db2.gz HYFFQPVHNQLMSA-IBGZPJMESA-N 0 3 422.525 4.291 20 0 HIADHN C[C@H](NC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C)c1cccc(-n2cccn2)c1 ZINC000466663294 880444462 /nfs/dbraw/zinc/44/44/62/880444462.db2.gz DHRYHHCJNOYXPB-SFTDATJTSA-N 0 3 417.557 4.239 20 0 HIADHN CCc1c(NC(=O)NCCCN2CCc3ccccc3C2)cnn1-c1ccccc1 ZINC000466683845 880473738 /nfs/dbraw/zinc/47/37/38/880473738.db2.gz SAIYTDXJOQFXLM-UHFFFAOYSA-N 0 3 403.530 4.005 20 0 HIADHN O=C(Nc1cc(Br)c(F)cc1F)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000466702750 880494495 /nfs/dbraw/zinc/49/44/95/880494495.db2.gz DRKVGLPXETZILL-CYBMUJFWSA-N 0 3 410.262 4.123 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)Nc1cc(Br)c(F)cc1F ZINC000466713442 880503021 /nfs/dbraw/zinc/50/30/21/880503021.db2.gz NVXWVQPBZQKGMF-UHFFFAOYSA-N 0 3 412.278 4.323 20 0 HIADHN CCC(C)(C)c1ccc(S(=O)(=O)NCC2(N3CCC(OC)CC3)CCCC2)cc1 ZINC000466860620 880630185 /nfs/dbraw/zinc/63/01/85/880630185.db2.gz DCEHTQVHDTZBIO-UHFFFAOYSA-N 0 3 422.635 4.076 20 0 HIADHN CC(C)c1ccc(C(=O)Nc2cccc(CN3CCC(C(N)=O)CC3)c2)cc1Cl ZINC000466916592 880684757 /nfs/dbraw/zinc/68/47/57/880684757.db2.gz JMPKZCOVGRJFHD-UHFFFAOYSA-N 0 3 413.949 4.413 20 0 HIADHN C[C@H](NC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C)c1ccc(-n2cccn2)cc1 ZINC000466956924 880740853 /nfs/dbraw/zinc/74/08/53/880740853.db2.gz COLBVTROMPEALX-SFTDATJTSA-N 0 3 417.557 4.239 20 0 HIADHN C[C@H](NC(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C)c1nc(C(F)(F)F)cs1 ZINC000503546105 912610077 /nfs/dbraw/zinc/61/00/77/912610077.db2.gz FAQTZLSEVBQOQS-HUBLWGQQSA-N 0 3 400.470 4.214 20 0 HIADHN C[C@H]1C[C@H](NC(=O)CSCc2coc(-c3ccccc3)n2)CN1Cc1ccccc1 ZINC000467021875 880822945 /nfs/dbraw/zinc/82/29/45/880822945.db2.gz GRUJTESFXKJCPQ-RXVVDRJESA-N 0 3 421.566 4.354 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)CSCc2coc(-c3ccccc3)n2)CN1Cc1ccccc1 ZINC000467021874 880823213 /nfs/dbraw/zinc/82/32/13/880823213.db2.gz GRUJTESFXKJCPQ-NQIIRXRSSA-N 0 3 421.566 4.354 20 0 HIADHN C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)[C@H](Sc1ccc(F)c(F)c1)c1ccccc1 ZINC000467023324 880824943 /nfs/dbraw/zinc/82/49/43/880824943.db2.gz KPJQMDNTADMINF-PUCZYUMASA-N 0 3 402.510 4.397 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)C2(c3ccc(Cl)cc3)CCOCC2)CN1Cc1ccccc1 ZINC000467024634 880825667 /nfs/dbraw/zinc/82/56/67/880825667.db2.gz PLIPQYCEQMLARQ-PGRDOPGGSA-N 0 3 412.961 4.167 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)C2(c3ccc(Cl)cc3)CCOCC2)CN1Cc1ccccc1 ZINC000467024635 880826136 /nfs/dbraw/zinc/82/61/36/880826136.db2.gz PLIPQYCEQMLARQ-XMSQKQJNSA-N 0 3 412.961 4.167 20 0 HIADHN C[C@H]1C[C@H](NC(=O)c2cccc(OCc3cccnc3)c2)CN1Cc1ccccc1 ZINC000467030672 880829560 /nfs/dbraw/zinc/82/95/60/880829560.db2.gz CHLMGSJYEAKJCK-CVDCTZTESA-N 0 3 401.510 4.053 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)c2cccc(OCc3cccnc3)c2)CN1Cc1ccccc1 ZINC000467030676 880829756 /nfs/dbraw/zinc/82/97/56/880829756.db2.gz CHLMGSJYEAKJCK-XXBNENTESA-N 0 3 401.510 4.053 20 0 HIADHN COCc1ccc([C@@H]2CCCN2CCC(=O)Nc2cc(OC)c(Cl)cc2OC)o1 ZINC000467041329 880838294 /nfs/dbraw/zinc/83/82/94/880838294.db2.gz SPPCOAQQUIVOAX-KRWDZBQOSA-N 0 3 422.909 4.262 20 0 HIADHN C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)Cc1csc(-c2ccc(Cl)cc2Cl)n1 ZINC000467050092 880842243 /nfs/dbraw/zinc/84/22/43/880842243.db2.gz WTGHUOCNPVPRQU-DIFFPNOSSA-N 0 3 410.370 4.258 20 0 HIADHN CCN(CC)[C@H](CNC(=O)[C@H]1CCCc2n[nH]cc21)c1ccc(C(F)(F)F)cc1 ZINC000467107645 880866833 /nfs/dbraw/zinc/86/68/33/880866833.db2.gz SNGUMJLNYVHDLR-QFBILLFUSA-N 0 3 408.468 4.048 20 0 HIADHN Cc1c(NC(=O)N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)cccc1C(=O)N1CCCC1 ZINC000467118361 880875533 /nfs/dbraw/zinc/87/55/33/880875533.db2.gz WKBMAUXDTJZGGN-WIYYLYMNSA-N 0 3 420.557 4.016 20 0 HIADHN C[C@H](c1cccc(N2CCCS2(=O)=O)c1)N(C)C[C@H]1CCC2(CCCCC2)O1 ZINC000467189955 880916732 /nfs/dbraw/zinc/91/67/32/880916732.db2.gz DISPJFALWUTBAD-WIYYLYMNSA-N 0 3 406.592 4.101 20 0 HIADHN COC(=O)COc1ccc([C@@H](C)N[C@H](C)C(=O)Nc2ccc(C(C)(C)C)cc2)cc1 ZINC000467189909 880916868 /nfs/dbraw/zinc/91/68/68/880916868.db2.gz CMPPGKWRSAZDLI-IAGOWNOFSA-N 0 3 412.530 4.214 20 0 HIADHN NC(=O)c1ccccc1Oc1ccc(NC(=O)c2cccc(CN3CCCC3)c2)cc1 ZINC000467320914 881067721 /nfs/dbraw/zinc/06/77/21/881067721.db2.gz HTJCEPUFAYILKW-UHFFFAOYSA-N 0 3 415.493 4.426 20 0 HIADHN COc1cc(C)c([C@H](C)NCc2cc(Cl)ccc2N2CCOCC2)cc1OC ZINC000467380157 881158141 /nfs/dbraw/zinc/15/81/41/881158141.db2.gz CPLVKVGTRIUVCI-INIZCTEOSA-N 0 3 404.938 4.353 20 0 HIADHN CCc1ccccc1NC(=O)C[C@H](C)NCc1cc(Cl)ccc1N1CCOCC1 ZINC000467388665 881172672 /nfs/dbraw/zinc/17/26/72/881172672.db2.gz HXWWPVKSYXYSRT-KRWDZBQOSA-N 0 3 415.965 4.246 20 0 HIADHN Cc1cccnc1[C@@H]1CCC[C@H](Nc2ccc3nc(CCN4CCOCC4)[nH]c3c2)C1 ZINC000467391209 881174758 /nfs/dbraw/zinc/17/47/58/881174758.db2.gz RLLDRIGZJOJTPV-UXHICEINSA-N 0 3 419.573 4.279 20 0 HIADHN Cc1cc(C(F)(F)F)ccc1CN[C@@H](C)c1cccc(N2CCCS2(=O)=O)c1 ZINC000467408311 881195271 /nfs/dbraw/zinc/19/52/71/881195271.db2.gz ZNBNJLYDRRVUMF-HNNXBMFYSA-N 0 3 412.477 4.405 20 0 HIADHN Clc1ccc(N2CCOCC2)c(CN[C@@H](C[C@@H]2CCOC2)c2ccccc2)c1 ZINC000467410746 881197424 /nfs/dbraw/zinc/19/74/24/881197424.db2.gz KFBGQRCJRBZYCC-AVRDEDQJSA-N 0 3 400.950 4.434 20 0 HIADHN COc1ccc2c(c1)[C@H](N[C@H](C)c1cc(F)ccc1N1CCN(C)CC1)CCS2 ZINC000467422237 881211494 /nfs/dbraw/zinc/21/14/94/881211494.db2.gz ZJOVUSCPFSVAAN-IIBYNOLFSA-N 0 3 415.578 4.474 20 0 HIADHN Cc1c([C@@H](C)NCCN2CCc3ccccc3C2=O)cnn1-c1cc(C)ccc1C ZINC000467427779 881218561 /nfs/dbraw/zinc/21/85/61/881218561.db2.gz HRULWPYMNFOSTF-LJQANCHMSA-N 0 3 402.542 4.147 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)C(Cc2ccccc2)Cc2ccccc2)C[C@@H](C)O1 ZINC000467427796 881219676 /nfs/dbraw/zinc/21/96/76/881219676.db2.gz HYJWIWJFMXTGIS-FGZHOGPDSA-N 0 3 408.586 4.094 20 0 HIADHN CCN(CC)C(=O)Nc1ccc([C@H](C)N[C@@H]2CC(=O)N(Cc3ccccc3)[C@H]2C)cc1 ZINC000467433690 881228854 /nfs/dbraw/zinc/22/88/54/881228854.db2.gz KKOOXIZASPJQHV-SFYKDHMMSA-N 0 3 422.573 4.401 20 0 HIADHN CCN(CC)C(=O)Nc1ccc([C@H](C)N[C@H]2CC(=O)N(Cc3ccccc3)[C@H]2C)cc1 ZINC000467433695 881230446 /nfs/dbraw/zinc/23/04/46/881230446.db2.gz KKOOXIZASPJQHV-YDHSSHFGSA-N 0 3 422.573 4.401 20 0 HIADHN CCc1nnc(-c2ccc(NC(=O)[C@@H]3CCCN(Cc4cccc(F)c4)C3)cc2)o1 ZINC000467505077 881320089 /nfs/dbraw/zinc/32/00/89/881320089.db2.gz VFIARFSGXYGDBR-GOSISDBHSA-N 0 3 408.477 4.289 20 0 HIADHN Cc1c2cc(Cl)ccc2oc1C(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000467507559 881322748 /nfs/dbraw/zinc/32/27/48/881322748.db2.gz GGCKYOCFGHPFNA-UHFFFAOYSA-N 0 3 412.917 4.281 20 0 HIADHN CC[N@@H+]1CCC[C@@H]1CN(Cc1ccc(O)cc1)C(=O)CCCc1ccc([O-])c(F)c1 ZINC000469099275 883189258 /nfs/dbraw/zinc/18/92/58/883189258.db2.gz WOROKILLFQYRTB-HXUWFJFHSA-N 0 3 414.521 4.073 20 0 HIADHN CC[N@H+]1CCC[C@@H]1CN(Cc1ccc(O)cc1)C(=O)CCCc1ccc([O-])c(F)c1 ZINC000469099275 883189264 /nfs/dbraw/zinc/18/92/64/883189264.db2.gz WOROKILLFQYRTB-HXUWFJFHSA-N 0 3 414.521 4.073 20 0 HIADHN C[C@@H]1CC[C@@H](C)N1CC(=O)N[C@@H](c1ccc2c(c1)OCCO2)c1ccccc1Cl ZINC000469101945 883192865 /nfs/dbraw/zinc/19/28/65/883192865.db2.gz ZULSMZNBAGIHFN-LNPFQXMTSA-N 0 3 414.933 4.190 20 0 HIADHN Cc1cc(C)c(CC(C(=O)Nc2ccc3c(c2)CC(=O)N3C)C(F)(F)F)c(C)c1 ZINC000469105412 883197411 /nfs/dbraw/zinc/19/74/11/883197411.db2.gz VEYIIASKDCGEHG-GOSISDBHSA-N 0 3 404.432 4.490 20 0 HIADHN Cc1c([C@H](C)NCCC(=O)N(C)Cc2ccccc2Br)cnn1C(C)C ZINC000469114494 883205672 /nfs/dbraw/zinc/20/56/72/883205672.db2.gz OYQDSTRDVNJSEL-HNNXBMFYSA-N 0 3 421.383 4.234 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)c2cc(Br)c(F)cc2F)CC1 ZINC000469205749 883306546 /nfs/dbraw/zinc/30/65/46/883306546.db2.gz WIHKNVUBWRTTOG-UHFFFAOYSA-N 0 3 413.262 4.057 20 0 HIADHN CC[C@@H]1C[C@@H](CN[C@H](c2cccc(S(C)(=O)=O)c2)c2ccc(F)c(F)c2)CCO1 ZINC000503602014 912692609 /nfs/dbraw/zinc/69/26/09/912692609.db2.gz JRJIOERMAPRUEB-QXATTWAWSA-N 0 3 423.525 4.253 20 0 HIADHN CCOc1ccc([C@@H](C)N[C@@H]2CCCN(Cc3ccc(F)cc3F)C2=O)cc1OC ZINC000469230853 883329413 /nfs/dbraw/zinc/32/94/13/883329413.db2.gz KGQJXPBVVPJBLM-FOIQADDNSA-N 0 3 418.484 4.214 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N[C@@H]3C[C@H]3c3ccccc3C(F)(F)F)cc2)CC1 ZINC000469322861 883427543 /nfs/dbraw/zinc/42/75/43/883427543.db2.gz SBXATQKZEBZOFT-PZJWPPBQSA-N 0 3 417.475 4.133 20 0 HIADHN CN(C(=O)CCCc1nnc(-c2ccc(Cl)cc2Cl)o1)[C@H]1CCN(C2CC2)C1 ZINC000469324326 883431208 /nfs/dbraw/zinc/43/12/08/883431208.db2.gz HZTQRCFHBSTPSB-HNNXBMFYSA-N 0 3 423.344 4.061 20 0 HIADHN CC1CCN([C@H](CNC(=O)c2ccc(O[C@H]3CCOC3)cc2)c2ccccc2)CC1 ZINC000469335523 883446556 /nfs/dbraw/zinc/44/65/56/883446556.db2.gz KNKDCPBMTSGRRQ-BJKOFHAPSA-N 0 3 408.542 4.057 20 0 HIADHN C[C@H](C(=O)N1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1)N1CCCCCC1 ZINC000469394532 883552126 /nfs/dbraw/zinc/55/21/26/883552126.db2.gz AQSFLMWWMODNLC-SJLPKXTDSA-N 0 3 416.953 4.361 20 0 HIADHN C[C@@H](C(=O)N1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1)N1CCCCCC1 ZINC000469394531 883552501 /nfs/dbraw/zinc/55/25/01/883552501.db2.gz AQSFLMWWMODNLC-FUHWJXTLSA-N 0 3 416.953 4.361 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3cc4sc(C)nc4cc3OC)cc2)CC1 ZINC000469400579 883564728 /nfs/dbraw/zinc/56/47/28/883564728.db2.gz VTSBWXDAALGSLN-UHFFFAOYSA-N 0 3 410.543 4.008 20 0 HIADHN CC(=O)Nc1cccc([C@@H](C)NC(=O)N[C@H](CN(C)Cc2ccccc2)C(C)C)c1 ZINC000469420333 883596539 /nfs/dbraw/zinc/59/65/39/883596539.db2.gz OQKNPTGDFMBYNH-WZONZLPQSA-N 0 3 410.562 4.162 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)N1CCC(OC2CCCC2)CC1 ZINC000469430874 883616634 /nfs/dbraw/zinc/61/66/34/883616634.db2.gz XKASKVZTTXPMQK-HSZRJFAPSA-N 0 3 401.595 4.276 20 0 HIADHN Cc1c2cc(C)c(C)cc2sc1C(=O)N1CCN(c2ccc(CN(C)C)cn2)CC1 ZINC000469437128 883625039 /nfs/dbraw/zinc/62/50/39/883625039.db2.gz VCILVXLEIIGXNV-UHFFFAOYSA-N 0 3 422.598 4.246 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)Nc1ccc(CN2CCCC2=O)cc1 ZINC000469452498 883653288 /nfs/dbraw/zinc/65/32/88/883653288.db2.gz NZHBUWYHRWIPRK-QHCPKHFHSA-N 0 3 422.573 4.087 20 0 HIADHN COc1ccccc1COC[C@@H](O)CN1CCC(=Cc2ccc(F)c(F)c2)CC1 ZINC000469471476 883695835 /nfs/dbraw/zinc/69/58/35/883695835.db2.gz YTBHEYFPOOOXQS-FQEVSTJZSA-N 0 3 403.469 4.030 20 0 HIADHN Cc1ccc(F)c(C(=O)N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)c1Br ZINC000469584441 883823604 /nfs/dbraw/zinc/82/36/04/883823604.db2.gz GQUDRPMISOHYBT-HOCLYGCPSA-N 0 3 405.311 4.289 20 0 HIADHN CCN(CC)CC(=O)N[C@H](C)c1sc(-c2ccc(Br)cc2)nc1C ZINC000503648265 912753832 /nfs/dbraw/zinc/75/38/32/912753832.db2.gz OCDKWRLVASKYPQ-GFCCVEGCSA-N 0 3 410.381 4.400 20 0 HIADHN CCOc1cc(Cl)ccc1NC(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000469671397 883861747 /nfs/dbraw/zinc/86/17/47/883861747.db2.gz RGZFWCFNCPRDJD-IAGOWNOFSA-N 0 3 423.985 4.482 20 0 HIADHN COC(=O)c1ccccc1-c1ccccc1C(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000469687817 883871519 /nfs/dbraw/zinc/87/15/19/883871519.db2.gz OMBGGKNLNAZEPM-ZEQRLZLVSA-N 0 3 414.505 4.315 20 0 HIADHN COc1ccc([C@@H](NC[C@H](O)CC(F)(F)F)c2ccccc2)cc1Br ZINC000469712648 883883257 /nfs/dbraw/zinc/88/32/57/883883257.db2.gz JRWNGIFAPATANK-PBHICJAKSA-N 0 3 418.253 4.450 20 0 HIADHN COc1ccc([C@H](NC[C@@H](O)CC(F)(F)F)c2ccccc2)cc1Br ZINC000469712677 883883294 /nfs/dbraw/zinc/88/32/94/883883294.db2.gz JRWNGIFAPATANK-WMLDXEAASA-N 0 3 418.253 4.450 20 0 HIADHN CSC1(C(=O)Nc2cccc(N3CCN(CCc4ccccc4)CC3)c2)CCC1 ZINC000469732293 883890530 /nfs/dbraw/zinc/89/05/30/883890530.db2.gz ATTCFJJMWKPGOX-UHFFFAOYSA-N 0 3 409.599 4.276 20 0 HIADHN COC(=O)c1cccc(NC(=O)CN[C@@H](Cc2ccc(Cl)cc2)c2ccccc2)n1 ZINC000469784503 883959269 /nfs/dbraw/zinc/95/92/69/883959269.db2.gz ZJJIYTSTJQOIQA-FQEVSTJZSA-N 0 3 423.900 4.034 20 0 HIADHN Cc1c(F)c(C(F)(F)F)ccc1C(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000469833083 884013148 /nfs/dbraw/zinc/01/31/48/884013148.db2.gz ZWPKHJWZPUDVRP-KRWDZBQOSA-N 0 3 424.438 4.174 20 0 HIADHN C[C@H](NC(=O)N(CCN(C)C)Cc1ccco1)c1ccc(OCC2CC2)c(F)c1 ZINC000469834298 884015574 /nfs/dbraw/zinc/01/55/74/884015574.db2.gz MUUQGHSPLINHLB-INIZCTEOSA-N 0 3 403.498 4.042 20 0 HIADHN Cc1nc(C2CCCC2)sc1C(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000469841557 884022023 /nfs/dbraw/zinc/02/20/23/884022023.db2.gz KXXPLLWFFVLAQU-HXUWFJFHSA-N 0 3 413.587 4.130 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)Nc3ccc4c(c3)CC(C)(C)O4)CC2)C[C@H](C)O1 ZINC000469845376 884027874 /nfs/dbraw/zinc/02/78/74/884027874.db2.gz BRRXLGZINKTTOL-ROUUACIJSA-N 0 3 415.578 4.143 20 0 HIADHN CC(C)(C(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1)c1cccc(Cl)c1F ZINC000469861804 884047498 /nfs/dbraw/zinc/04/74/98/884047498.db2.gz YINIGPGRSGBKJO-GOSISDBHSA-N 0 3 418.940 4.164 20 0 HIADHN CC1CCC(N2CCN(C(=O)CCc3nnc(-c4ccc(Cl)cc4)o3)CC2)CC1 ZINC000469911198 884099991 /nfs/dbraw/zinc/09/99/91/884099991.db2.gz XKBXQXNGSSNZJR-UHFFFAOYSA-N 0 3 416.953 4.046 20 0 HIADHN CC(C)(C)C[C@@H](NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1)C(F)(F)F ZINC000469930420 884123474 /nfs/dbraw/zinc/12/34/74/884123474.db2.gz WDEOOZOVEHFQPF-JXQTWKCFSA-N 0 3 417.438 4.458 20 0 HIADHN CC(C)[C@@H](NC(=O)NC[C@@H](c1ccccc1)N1CCCC1)c1nc2ccccc2[nH]1 ZINC000503687323 912792594 /nfs/dbraw/zinc/79/25/94/912792594.db2.gz ZTHBXECOYFAIBI-FCHUYYIVSA-N 0 3 405.546 4.396 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)NCCc1nc2ccccc2n1C(F)F ZINC000469963359 884170452 /nfs/dbraw/zinc/17/04/52/884170452.db2.gz OTMBBNJNCYPFCS-UHFFFAOYSA-N 0 3 412.440 4.212 20 0 HIADHN COC(C)(C)CCN(C)Cc1cccc(Br)c1OC[C@@H]1CCCO1 ZINC000469975375 884187076 /nfs/dbraw/zinc/18/70/76/884187076.db2.gz JZJLUVWUNUWUNH-INIZCTEOSA-N 0 3 400.357 4.254 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)c3cc(C4CC4)n(C(C)(C)C)n3)c2)CC1 ZINC000503761051 912817887 /nfs/dbraw/zinc/81/78/87/912817887.db2.gz AKSLHZYGHSJZDF-UHFFFAOYSA-N 0 3 409.578 4.298 20 0 HIADHN Cc1occc1-c1cc(NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)no1 ZINC000470151882 884421344 /nfs/dbraw/zinc/42/13/44/884421344.db2.gz KJASZPVNFISNIO-UHFFFAOYSA-N 0 3 412.412 4.170 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)[C@@H](OC1CCOCC1)c1ccccc1 ZINC000470166771 884443836 /nfs/dbraw/zinc/44/38/36/884443836.db2.gz HZIBBXAZHYGJLI-RPBOFIJWSA-N 0 3 424.585 4.196 20 0 HIADHN CC[C@@H]1CN(C(=O)c2ccc(N3CCN(CC)CC3)cc2)CC[C@@H]1c1ccccc1 ZINC000470192861 884496646 /nfs/dbraw/zinc/49/66/46/884496646.db2.gz CWWSXDIUYHECBX-BWKNWUBXSA-N 0 3 405.586 4.484 20 0 HIADHN COc1ccc([C@@H](CO)N(C)Cc2cc(Br)cc3cccnc32)cc1 ZINC000470205784 884522219 /nfs/dbraw/zinc/52/22/19/884522219.db2.gz NZRHMBQVTLKFGQ-LJQANCHMSA-N 0 3 401.304 4.171 20 0 HIADHN CCc1c(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)cnn1-c1ccccc1OC ZINC000470207711 884523689 /nfs/dbraw/zinc/52/36/89/884523689.db2.gz DUYVMZAQJRFAJK-QHCPKHFHSA-N 0 3 418.541 4.010 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1ccccc1O[C@H]1CCOC1)c1ccsc1 ZINC000470300266 884674987 /nfs/dbraw/zinc/67/49/87/884674987.db2.gz YSIHAOIUAQLJMD-HKUYNNGSSA-N 0 3 403.548 4.120 20 0 HIADHN Cc1cccc([C@H](N[C@H](C)CCCOc2ccccc2C(N)=O)c2ccccn2)c1 ZINC000470306748 884682073 /nfs/dbraw/zinc/68/20/73/884682073.db2.gz HCKCDQWBDHNANU-DVECYGJZSA-N 0 3 403.526 4.416 20 0 HIADHN C[C@@H](CO)N1CCCN(C(=O)Nc2ccc(Sc3ccc(Cl)cc3)cc2)CC1 ZINC000470359836 884752060 /nfs/dbraw/zinc/75/20/60/884752060.db2.gz UPLBYSCEJWEHTO-INIZCTEOSA-N 0 3 419.978 4.412 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(Oc2ccc(Br)cc2)cc1)C(=O)NCCF ZINC000503920822 912864801 /nfs/dbraw/zinc/86/48/01/912864801.db2.gz PLPDCNGQXVZODW-KBPBESRZSA-N 0 3 409.299 4.366 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)N[C@@H]1CCSc2c(F)cccc21 ZINC000503970044 912890077 /nfs/dbraw/zinc/89/00/77/912890077.db2.gz PQXUADXQIIHYKH-QGZVFWFLSA-N 0 3 409.596 4.023 20 0 HIADHN C[C@@H]1C[C@H]1C(=O)Nc1ccc(C(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000470654552 885075615 /nfs/dbraw/zinc/07/56/15/885075615.db2.gz UIBAOPLMMWIIMP-SXSPYAJSSA-N 0 3 405.542 4.018 20 0 HIADHN Cc1cc(C(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)c2cnn(C(C)C)c2n1 ZINC000470658458 885083082 /nfs/dbraw/zinc/08/30/82/885083082.db2.gz BHPCJFGCGNYQKW-FQEVSTJZSA-N 0 3 405.546 4.057 20 0 HIADHN CC(C)N1CCC[C@H](NC(=O)c2cnn(-c3ccc(Cl)cc3)c2C(F)(F)F)C1 ZINC000470678450 885110530 /nfs/dbraw/zinc/11/05/30/885110530.db2.gz OJGAPEBQIIYEPG-AWEZNQCLSA-N 0 3 414.859 4.147 20 0 HIADHN CCc1cccc2c1OCC[C@@H]2NC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470719902 885164910 /nfs/dbraw/zinc/16/49/10/885164910.db2.gz MWFGTPFTIJPMBT-GGAORHGYSA-N 0 3 407.558 4.379 20 0 HIADHN CN(C(=O)N[C@H]1CCCOc2ccc(F)cc21)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470720282 885165105 /nfs/dbraw/zinc/16/51/05/885165105.db2.gz RWXCCCBVMOFLNT-IRLDBZIGSA-N 0 3 411.521 4.345 20 0 HIADHN CN(C(=O)NCc1coc(-c2cccs2)n1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470722339 885169066 /nfs/dbraw/zinc/16/90/66/885169066.db2.gz IZUOQVCKJYNPGU-IBGZPJMESA-N 0 3 410.543 4.209 20 0 HIADHN COc1ccc(CC[C@@H](C)NC(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000470725668 885175343 /nfs/dbraw/zinc/17/53/43/885175343.db2.gz IBNRUBKXHLXJQR-NFBKMPQASA-N 0 3 409.574 4.322 20 0 HIADHN CN(C(=O)NCc1cc(-c2ccccc2)on1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470733031 885188039 /nfs/dbraw/zinc/18/80/39/885188039.db2.gz MWMRCSNYVJPHPS-QFIPXVFZSA-N 0 3 404.514 4.148 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)CCc3cnc4ccccc4c3)c(C)c2)CC1 ZINC000470744049 885207431 /nfs/dbraw/zinc/20/74/31/885207431.db2.gz JWXNZKDWHGBLQP-UHFFFAOYSA-N 0 3 402.542 4.256 20 0 HIADHN COc1ccc(OC)c([C@H](C)NC(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000470745388 885208898 /nfs/dbraw/zinc/20/88/98/885208898.db2.gz PCZIMASQXUNWOT-ICSRJNTNSA-N 0 3 411.546 4.071 20 0 HIADHN CN(C)Cc1cnc(CN[C@H](c2cccc(C(F)(F)F)c2)C2CCOCC2)s1 ZINC000512375153 921114016 /nfs/dbraw/zinc/11/40/16/921114016.db2.gz NAEAXVYQRMCBID-IBGZPJMESA-N 0 3 413.509 4.481 20 0 HIADHN CC(C)c1cccc(S(=O)(=O)Nc2cc(Cl)ccc2N2CCN(C)CC2)c1 ZINC000470796017 885278453 /nfs/dbraw/zinc/27/84/53/885278453.db2.gz ZMNQEQJTVSUDNM-UHFFFAOYSA-N 0 3 407.967 4.016 20 0 HIADHN CN(Cc1ccccc1Oc1ccccc1)C[C@@H]1C[C@H](F)CN1Cc1ncccn1 ZINC000470805129 885293271 /nfs/dbraw/zinc/29/32/71/885293271.db2.gz XMADGJZLBDKAQE-SFTDATJTSA-N 0 3 406.505 4.313 20 0 HIADHN C[C@@H](CNC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1)c1ccc(F)cc1F ZINC000470884013 885378393 /nfs/dbraw/zinc/37/83/93/885378393.db2.gz TWBGXBGSFVCYOY-PXNSSMCTSA-N 0 3 401.501 4.374 20 0 HIADHN CN(C(=O)NCCc1nc(C(C)(C)C)cs1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470894501 885390761 /nfs/dbraw/zinc/39/07/61/885390761.db2.gz IWVWQJNUEHYISM-IBGZPJMESA-N 0 3 414.619 4.289 20 0 HIADHN Cc1cc(Br)cc(C)c1NC(=O)CCCN1C[C@@H](C2CC2)O[C@@H](C)C1 ZINC000470928745 885434492 /nfs/dbraw/zinc/43/44/92/885434492.db2.gz GXBQYJMWYOOVEP-YJBOKZPZSA-N 0 3 409.368 4.284 20 0 HIADHN Cc1nc2cc(C(=O)N(CCN(C)C)Cc3cccc(C(F)(F)F)c3)ccc2o1 ZINC000470947042 885445697 /nfs/dbraw/zinc/44/56/97/885445697.db2.gz MQYAQCLDBCKACX-UHFFFAOYSA-N 0 3 405.420 4.359 20 0 HIADHN Cc1nc2c(cccc2C(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)o1 ZINC000470950059 885449537 /nfs/dbraw/zinc/44/95/37/885449537.db2.gz YPAJPYQWEPQHPW-UHFFFAOYSA-N 0 3 405.420 4.359 20 0 HIADHN C[C@@H](NC(=O)c1ccccc1-c1nc(C(C)(C)C)no1)[C@H](c1ccccc1)N(C)C ZINC000471131990 885670881 /nfs/dbraw/zinc/67/08/81/885670881.db2.gz CLLASDNABNKMQA-OXQOHEQNSA-N 0 3 406.530 4.455 20 0 HIADHN C[C@@H](NC(=O)C1(c2ccc(Br)cc2)CC1)[C@@H](c1ccccc1)N(C)C ZINC000471137139 885677027 /nfs/dbraw/zinc/67/70/27/885677027.db2.gz NQUBEQHBWBGQCF-BEFAXECRSA-N 0 3 401.348 4.288 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)CSc3ccccc3)c(OCC)c2)CC1 ZINC000471160256 885713117 /nfs/dbraw/zinc/71/31/17/885713117.db2.gz DUGBJIXWRHRKJG-UHFFFAOYSA-N 0 3 413.587 4.348 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)[C@H](C)Oc3ccccc3)c(OCC)c2)CC1 ZINC000471161693 885715604 /nfs/dbraw/zinc/71/56/04/885715604.db2.gz PTYVCVNPCKFVPA-IBGZPJMESA-N 0 3 411.546 4.023 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3nccc4ccccc43)c(OCC)c2)CC1 ZINC000471168194 885726006 /nfs/dbraw/zinc/72/60/06/885726006.db2.gz IAHXGBHHVWEISK-UHFFFAOYSA-N 0 3 418.541 4.418 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)c1cc(C)sc1Br ZINC000471262447 885840687 /nfs/dbraw/zinc/84/06/87/885840687.db2.gz MLONASGJGREDIQ-INIZCTEOSA-N 0 3 422.392 4.341 20 0 HIADHN Cc1c(NC(=O)N[C@H](CN2CCCC2)c2ccccc2)cccc1NC(=O)N(C)C ZINC000471359639 885985309 /nfs/dbraw/zinc/98/53/09/885985309.db2.gz DBCRXQSWBAKCLF-OAQYLSRUSA-N 0 3 409.534 4.047 20 0 HIADHN COc1ccc(NC(=O)[C@@H](C(C)C)N(C)C)cc1NC(=O)c1ccc(Cl)cc1F ZINC000471382171 886029756 /nfs/dbraw/zinc/02/97/56/886029756.db2.gz OFRQMBMFFWVGIL-LJQANCHMSA-N 0 3 421.900 4.265 20 0 HIADHN O=C(Nc1cccc(OCc2cscn2)c1)N1CCN(CC2CCCCC2)CC1 ZINC000504093078 913003496 /nfs/dbraw/zinc/00/34/96/913003496.db2.gz FUVXFSPLUHEAOJ-UHFFFAOYSA-N 0 3 414.575 4.452 20 0 HIADHN CN(C)c1ccc(-c2cncc(C(=O)N(Cc3ccco3)C3CCN(C)CC3)c2)cc1 ZINC000471472562 886165836 /nfs/dbraw/zinc/16/58/36/886165836.db2.gz TXJXGXWVSYDAKE-UHFFFAOYSA-N 0 3 418.541 4.144 20 0 HIADHN C[C@@H](NC(=O)COc1ccc(Oc2ccccn2)cc1)[C@@H](c1ccccc1)N(C)C ZINC000471538066 886243532 /nfs/dbraw/zinc/24/35/32/886243532.db2.gz OEIBGTWFLLXKDV-KOSHJBKYSA-N 0 3 405.498 4.060 20 0 HIADHN Cc1nc(COc2cccc(C(=O)N[C@H](C)[C@H](c3ccccc3)N(C)C)c2)cs1 ZINC000471556059 886263821 /nfs/dbraw/zinc/26/38/21/886263821.db2.gz PCOPSMQLEVQCBT-OPAMFIHVSA-N 0 3 409.555 4.452 20 0 HIADHN Cc1ccc(C)c2c1CCC[C@@H]2NCc1ccccc1OCC(=O)NC[C@H]1CCCO1 ZINC000471576727 886288013 /nfs/dbraw/zinc/28/80/13/886288013.db2.gz DZMIQHVQYGORBB-GGAORHGYSA-N 0 3 422.569 4.145 20 0 HIADHN C[C@H](NC(=O)[C@@H]1C[C@H]1c1ccccc1OC(F)(F)F)[C@@H](c1ccccc1)N(C)C ZINC000471575711 886288306 /nfs/dbraw/zinc/28/83/06/886288306.db2.gz ZFIGMAIRZKZCKY-DEYWJSPQSA-N 0 3 406.448 4.496 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)Cc3nc(-c4cccs4)oc3C)c2)CC1 ZINC000471650066 886366262 /nfs/dbraw/zinc/36/62/62/886366262.db2.gz RUYLGBRECOCPDF-UHFFFAOYSA-N 0 3 410.543 4.035 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)CCc3ncc(-c4ccccc4F)o3)c2)CC1 ZINC000471655689 886370032 /nfs/dbraw/zinc/37/00/32/886370032.db2.gz XKIYDCPGRAFRQU-UHFFFAOYSA-N 0 3 422.504 4.194 20 0 HIADHN COCCCC[C@@H](NC(=O)NCC1(N2CCSCC2)CCCC1)c1ccccc1 ZINC000471675621 886385919 /nfs/dbraw/zinc/38/59/19/886385919.db2.gz GNQVTRNJUCITMS-OAQYLSRUSA-N 0 3 419.635 4.205 20 0 HIADHN COCCCC[C@H](NC(=O)NCC1(N2CCSCC2)CCCC1)c1ccccc1 ZINC000471675620 886386359 /nfs/dbraw/zinc/38/63/59/886386359.db2.gz GNQVTRNJUCITMS-NRFANRHFSA-N 0 3 419.635 4.205 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1cc(OC)c(OC)cc1F)c1cccc(OC)c1 ZINC000504171874 913058066 /nfs/dbraw/zinc/05/80/66/913058066.db2.gz NBZVWDXYBQUNEM-LJQANCHMSA-N 0 3 419.497 4.056 20 0 HIADHN Cc1ccccc1CC(C)(C)NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000471814010 886555052 /nfs/dbraw/zinc/55/50/52/886555052.db2.gz AQZDWZDZZLGVLI-UHFFFAOYSA-N 0 3 411.512 4.421 20 0 HIADHN O=C(NCCc1ccc(F)cc1Cl)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000471901087 886684266 /nfs/dbraw/zinc/68/42/66/886684266.db2.gz SMRNVFCXTKOHRR-UHFFFAOYSA-N 0 3 421.866 4.126 20 0 HIADHN Cc1ccc([C@H](NC(=O)NC[C@@H]2CCCN2Cc2ccccc2)c2ccccn2)cc1 ZINC000471924243 886714445 /nfs/dbraw/zinc/71/44/45/886714445.db2.gz SCVLAVWWJBKABP-ZCYQVOJMSA-N 0 3 414.553 4.443 20 0 HIADHN COc1cc(Br)cc(NC(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)c1 ZINC000471933487 886728906 /nfs/dbraw/zinc/72/89/06/886728906.db2.gz KKEXDRUBSYEBHR-ROUUACIJSA-N 0 3 404.308 4.025 20 0 HIADHN C[C@@H](C(=O)Nc1ccc2oc(=O)n(CCN(C)C)c2c1)c1ccc(Cl)c(Cl)c1 ZINC000471938404 886736699 /nfs/dbraw/zinc/73/66/99/886736699.db2.gz BIICTDIQGBBTHC-GFCCVEGCSA-N 0 3 422.312 4.205 20 0 HIADHN Cc1cc(Br)c(F)cc1NC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000471942955 886742501 /nfs/dbraw/zinc/74/25/01/886742501.db2.gz GAILAZCMBVRANX-SJLPKXTDSA-N 0 3 406.299 4.464 20 0 HIADHN COc1cccc(-c2c[nH]cc2C(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)c1 ZINC000504198676 913080222 /nfs/dbraw/zinc/08/02/22/913080222.db2.gz CKPBYHGZIDSRDS-UHFFFAOYSA-N 0 3 418.541 4.473 20 0 HIADHN CCCc1c(NC(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)cnn1-c1ccccc1 ZINC000471968988 886800242 /nfs/dbraw/zinc/80/02/42/886800242.db2.gz HYPCCPPVWNSTIS-NFBKMPQASA-N 0 3 403.530 4.392 20 0 HIADHN CC(=O)Nc1cc(C(=O)N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)cc(C(F)(F)F)c1 ZINC000471970192 886801164 /nfs/dbraw/zinc/80/11/64/886801164.db2.gz WJXUPZNVKYHBCL-XOBRGWDASA-N 0 3 419.447 4.057 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2c(F)cc(Br)cc2F)[C@H]1c1ccccc1 ZINC000471978051 886807885 /nfs/dbraw/zinc/80/78/85/886807885.db2.gz KEUYZUYFLPFKBY-DOTOQJQBSA-N 0 3 410.262 4.294 20 0 HIADHN Cc1c(NC(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)cnn1-c1cc(C)ccc1C ZINC000471980771 886809747 /nfs/dbraw/zinc/80/97/47/886809747.db2.gz SIQJTAPOZOXQAY-REWPJTCUSA-N 0 3 403.530 4.364 20 0 HIADHN Cc1ccnc(Oc2ccc(NC(=O)N[C@H]3CCN(C)[C@H]3c3ccccc3)cc2)n1 ZINC000471986628 886814498 /nfs/dbraw/zinc/81/44/98/886814498.db2.gz YJYGLBDGZXWHCZ-SFTDATJTSA-N 0 3 403.486 4.144 20 0 HIADHN CSc1cnn(-c2ccccc2)c1NC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000471996278 886822099 /nfs/dbraw/zinc/82/20/99/886822099.db2.gz VXTOCPHPJZMXSK-QUCCMNQESA-N 0 3 407.543 4.161 20 0 HIADHN CCOCCOCc1cccc(NC(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)c1C ZINC000471996691 886822938 /nfs/dbraw/zinc/82/29/38/886822938.db2.gz BLOXPCXZNOZAMQ-XZOQPEGZSA-N 0 3 411.546 4.115 20 0 HIADHN O=C(NCC1(Cc2ccccc2)CC1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472074161 886877424 /nfs/dbraw/zinc/87/74/24/886877424.db2.gz LDMVZHNAQJPLEP-UHFFFAOYSA-N 0 3 409.496 4.114 20 0 HIADHN C[C@@H](CCN1CCN(C)CC1)NC(=O)c1ccc(Oc2ccc(Cl)cc2)c(F)c1 ZINC000472096974 886890609 /nfs/dbraw/zinc/89/06/09/886890609.db2.gz VHMUEOFMSNHOCZ-INIZCTEOSA-N 0 3 419.928 4.027 20 0 HIADHN CCOc1ccc(-c2nc(CC)c(C(=O)N3CCC[C@@H](N4CCCC4)C3)s2)cc1 ZINC000472098790 886891730 /nfs/dbraw/zinc/89/17/30/886891730.db2.gz XBCGKLXHWVQNML-GOSISDBHSA-N 0 3 413.587 4.472 20 0 HIADHN Cc1cc(C)n(-c2ccccc2CNC(=O)N[C@@H](CN2CCCC2)c2ccccc2)n1 ZINC000472221866 887024518 /nfs/dbraw/zinc/02/45/18/887024518.db2.gz LNPPLGADNURWLA-QHCPKHFHSA-N 0 3 417.557 4.125 20 0 HIADHN O=C(c1ccc(-c2nnc[nH]2)cc1)N1CCN(C(c2ccccc2)c2ccccc2)CC1 ZINC000472223766 887028173 /nfs/dbraw/zinc/02/81/73/887028173.db2.gz VBEUXKRTDNSBTG-UHFFFAOYSA-N 0 3 423.520 4.019 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)N[C@H]1CCSc2ccc(Cl)cc21 ZINC000504245026 913112709 /nfs/dbraw/zinc/11/27/09/913112709.db2.gz GVQDYMQDSMEZOU-SFHVURJKSA-N 0 3 404.967 4.045 20 0 HIADHN COc1cc(-c2nnc(CN3CC[C@H](Cc4ccccc4)[C@H]3C)o2)cc(OC)c1OC ZINC000472324821 887159110 /nfs/dbraw/zinc/15/91/10/887159110.db2.gz ILXCZHJRKZSWBA-SJLPKXTDSA-N 0 3 423.513 4.216 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)c(C)c1 ZINC000472333488 887168563 /nfs/dbraw/zinc/16/85/63/887168563.db2.gz CRDDPRYUISZCLG-WTOYTKOKSA-N 0 3 408.546 4.090 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N1CCC[C@H]1Cc1ccccc1 ZINC000472449779 887302393 /nfs/dbraw/zinc/30/23/93/887302393.db2.gz GGXNYBODRKHEMZ-GPJFCIFZSA-N 0 3 409.496 4.208 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N1CCC[C@@H](Nc2ccccc2)C1 ZINC000472451201 887303765 /nfs/dbraw/zinc/30/37/65/887303765.db2.gz ADZRRUSAFHGERE-XEVCZEQESA-N 0 3 424.511 4.078 20 0 HIADHN Cn1cccc1[C@H]1CCCCN1C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472453322 887305709 /nfs/dbraw/zinc/30/57/09/887305709.db2.gz FZAONEQGTMYUEC-FAFZWHIHSA-N 0 3 412.500 4.067 20 0 HIADHN C[C@@H]1[C@@H](Cc2ccccc2)CCN1C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472456829 887311101 /nfs/dbraw/zinc/31/11/01/887311101.db2.gz PICBEBWNIAIYII-SPNPKDGLSA-N 0 3 423.523 4.454 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N1CCC(c2ccccc2)CC1 ZINC000472460071 887318446 /nfs/dbraw/zinc/31/84/46/887318446.db2.gz RTZVRYWEGYNFCJ-UHFFFAOYSA-N 0 3 409.496 4.381 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N1CCc2ccc(Cl)cc2C1 ZINC000472462434 887321606 /nfs/dbraw/zinc/32/16/06/887321606.db2.gz GYSUOUVIBNTTGK-UHFFFAOYSA-N 0 3 415.887 4.213 20 0 HIADHN CCC1(CC)CN(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)CCS1 ZINC000472463192 887322078 /nfs/dbraw/zinc/32/20/78/887322078.db2.gz DQCYLLBQGHBOON-UHFFFAOYSA-N 0 3 407.546 4.109 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)NC1(c2cccc(Cl)c2)CC1 ZINC000472465817 887326026 /nfs/dbraw/zinc/32/60/26/887326026.db2.gz SWQKETIMGMZTCF-UHFFFAOYSA-N 0 3 415.887 4.434 20 0 HIADHN COc1c(F)cc(F)cc1NC(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000472527707 887397741 /nfs/dbraw/zinc/39/77/41/887397741.db2.gz MKNXZGMMEFLUIA-LJQANCHMSA-N 0 3 414.374 4.367 20 0 HIADHN CN(C(=O)Nc1ccc(-c2csnn2)cc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000472688483 887543938 /nfs/dbraw/zinc/54/39/38/887543938.db2.gz QATVTJBCGJKTJR-FQEVSTJZSA-N 0 3 407.543 4.333 20 0 HIADHN CN(C(=O)Nc1cccc(-c2nccn2C)c1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000472736674 887582397 /nfs/dbraw/zinc/58/23/97/887582397.db2.gz SDYLNXSOSWSESI-QFIPXVFZSA-N 0 3 403.530 4.215 20 0 HIADHN CN(C(=O)Nc1ccc(NC(=O)C2CC2)cc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000472784911 887630808 /nfs/dbraw/zinc/63/08/08/887630808.db2.gz GCFSTQOZJCEMJK-JOCHJYFZSA-N 0 3 406.530 4.163 20 0 HIADHN COc1cc(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2)ccc1Br ZINC000472878516 887730958 /nfs/dbraw/zinc/73/09/58/887730958.db2.gz LSMBIRORFKHGDI-UHFFFAOYSA-N 0 3 424.314 4.193 20 0 HIADHN CC(C)(C)CCN1CCN(C(=O)Nc2ccc(F)cc2-c2nc(C3CC3)no2)CC1 ZINC000472892526 887742333 /nfs/dbraw/zinc/74/23/33/887742333.db2.gz TULVLDRXHOCOBN-UHFFFAOYSA-N 0 3 415.513 4.339 20 0 HIADHN C[C@H](CCN1CCN(C)CC1)NC(=O)N[C@H](CC(C)(C)C)c1ccc(Cl)cc1 ZINC000472903562 887750729 /nfs/dbraw/zinc/75/07/29/887750729.db2.gz KRIQBXCYJBJYGM-YLJYHZDGSA-N 0 3 409.018 4.143 20 0 HIADHN CCC[C@H](NC(=O)N[C@@H](C)CCN1CCN(C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000472909978 887755456 /nfs/dbraw/zinc/75/54/56/887755456.db2.gz YBHBWWOQFMVGEP-KXBFYZLASA-N 0 3 415.409 4.160 20 0 HIADHN C[C@H](c1cccs1)N(Cc1ccccc1)C(=O)N[C@@H](C)CCN1CCN(C)CC1 ZINC000472920181 887765675 /nfs/dbraw/zinc/76/56/75/887765675.db2.gz VEUWJDUHOIEBHL-VQTJNVASSA-N 0 3 414.619 4.047 20 0 HIADHN CN(Cc1nnc(-c2ccc(Cl)cc2)n1C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000473039192 887862210 /nfs/dbraw/zinc/86/22/10/887862210.db2.gz ZZRKMUAFUJSCJQ-NRFANRHFSA-N 0 3 409.965 4.232 20 0 HIADHN OC1(Cc2cccc(F)c2)CCN(Cc2ccccc2OCc2cccnc2)CC1 ZINC000473072712 887890103 /nfs/dbraw/zinc/89/01/03/887890103.db2.gz MZZPBELSWROQBT-UHFFFAOYSA-N 0 3 406.501 4.369 20 0 HIADHN C[C@@H](CC(=O)c1ccccc1F)C(=O)N[C@H]1[C@H](C)CN(Cc2ccccc2)C[C@@H]1C ZINC000473277007 888033424 /nfs/dbraw/zinc/03/34/24/888033424.db2.gz NAPGGLRUAOLGLY-YBJWPOLQSA-N 0 3 410.533 4.307 20 0 HIADHN C[C@H](CC(=O)c1ccccc1F)C(=O)NC1[C@@H](C)CN(Cc2ccccc2)C[C@@H]1C ZINC000473277005 888033799 /nfs/dbraw/zinc/03/37/99/888033799.db2.gz NAPGGLRUAOLGLY-QYZOEREBSA-N 0 3 410.533 4.307 20 0 HIADHN FC(F)(F)COc1ccc(CNC2(c3ccc(Cl)cc3)CCOCC2)cn1 ZINC000473278519 888035096 /nfs/dbraw/zinc/03/50/96/888035096.db2.gz FFTAUSWRMGEALY-UHFFFAOYSA-N 0 3 400.828 4.472 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)C1(c2ccccc2Br)CC1 ZINC000473392960 888107286 /nfs/dbraw/zinc/10/72/86/888107286.db2.gz VKBAHQNOJMYQFS-KRWDZBQOSA-N 0 3 419.388 4.496 20 0 HIADHN Cc1nc(-c2ccc([C@H](C)NC(=O)N(CCN(C)C)Cc3ccccn3)cc2)cs1 ZINC000504398045 913219412 /nfs/dbraw/zinc/21/94/12/913219412.db2.gz BAMMGWVJQDMJGQ-KRWDZBQOSA-N 0 3 423.586 4.348 20 0 HIADHN C[C@H](CCN1CCN(C)CC1)NC(=O)Nc1ccc(Oc2ccccc2Cl)cc1 ZINC000473502115 888228341 /nfs/dbraw/zinc/22/83/41/888228341.db2.gz IZXSQLFCNDHSDW-QGZVFWFLSA-N 0 3 416.953 4.280 20 0 HIADHN COc1ccc(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)c2ccccc12 ZINC000473516924 888248772 /nfs/dbraw/zinc/24/87/72/888248772.db2.gz FISRZVSMXXAXFP-UHFFFAOYSA-N 0 3 406.448 4.384 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1c(F)cccc1Br ZINC000473518370 888250614 /nfs/dbraw/zinc/25/06/14/888250614.db2.gz DPUDEQSMYPLMPZ-UHFFFAOYSA-N 0 3 423.248 4.123 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)[C@H]1C[C@H]1c1cccc(Cl)c1 ZINC000473527718 888264839 /nfs/dbraw/zinc/26/48/39/888264839.db2.gz RXEKGALQIZKUFF-FOIPXRHGSA-N 0 3 400.872 4.365 20 0 HIADHN CCOc1cccc2[nH]cc(CC(=O)NC3CC(N4CCC(C(F)(F)F)CC4)C3)c21 ZINC000473529290 888266599 /nfs/dbraw/zinc/26/65/99/888266599.db2.gz VSCHOWJZFNACEW-UHFFFAOYSA-N 0 3 423.479 4.031 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1ccc(Oc2ccccc2)nc1 ZINC000473531592 888268185 /nfs/dbraw/zinc/26/81/85/888268185.db2.gz ZPXIQBIRCZLWMM-UHFFFAOYSA-N 0 3 419.447 4.409 20 0 HIADHN Cc1nc(CC(C)C)sc1C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473535576 888273268 /nfs/dbraw/zinc/27/32/68/888273268.db2.gz SRFOZBXKZDBWKH-UHFFFAOYSA-N 0 3 403.514 4.185 20 0 HIADHN O=C(c1cccs1)c1ccccc1C(=O)N1C[C@H]2CN(Cc3ccccc3)C[C@H]2C1 ZINC000473574528 888316511 /nfs/dbraw/zinc/31/65/11/888316511.db2.gz FCNHHTZQOAXGPG-BGYRXZFFSA-N 0 3 416.546 4.183 20 0 HIADHN O=C(c1ccccc1)c1ccccc1C(=O)N1C[C@H]2CN(Cc3ccccc3)C[C@H]2C1 ZINC000473581170 888322253 /nfs/dbraw/zinc/32/22/53/888322253.db2.gz CIKYCGFKDRRMDY-ZRZAMGCNSA-N 0 3 410.517 4.122 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)NC3CC[NH+](C4CCCCC4)CC3)cc2)cc(=O)[n-]1 ZINC000473630647 888370842 /nfs/dbraw/zinc/37/08/42/888370842.db2.gz OPFDHGLBSUOOQK-UHFFFAOYSA-N 0 3 409.534 4.076 20 0 HIADHN CCOc1cccc2[nH]cc(CC(=O)NCC(C)(C)N3CCc4ccccc4C3)c21 ZINC000473650959 888398973 /nfs/dbraw/zinc/39/89/73/888398973.db2.gz TYLSNNRCAZFELS-UHFFFAOYSA-N 0 3 405.542 4.062 20 0 HIADHN CN1CCN(CCC(C)(C)NC(=O)Nc2cccc(COC3CCCCC3)c2)CC1 ZINC000473667370 888424119 /nfs/dbraw/zinc/42/41/19/888424119.db2.gz VQIPGQCGACXRAI-UHFFFAOYSA-N 0 3 416.610 4.074 20 0 HIADHN Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)N[C@H](C)CCN1CCN(C)CC1 ZINC000473668182 888425608 /nfs/dbraw/zinc/42/56/08/888425608.db2.gz ZQOBNFVDALLTKF-NHCUHLMSSA-N 0 3 424.589 4.283 20 0 HIADHN Cc1nc(CNC(=O)N(CCN(C)C)C2CCCC2)oc1-c1ccc(Cl)cc1 ZINC000473675099 888438214 /nfs/dbraw/zinc/43/82/14/888438214.db2.gz KJLPYZUWIDTQMT-UHFFFAOYSA-N 0 3 404.942 4.319 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3C[C@@H](c4ccc(F)cc4)C[C@@H]3C)c2)CC1 ZINC000473803714 888624488 /nfs/dbraw/zinc/62/44/88/888624488.db2.gz DYSYWAIQDAQYSS-ICSRJNTNSA-N 0 3 410.537 4.378 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N(CCOC)[C@@H](C)c3ccccc3)c2)CC1 ZINC000473820166 888650586 /nfs/dbraw/zinc/65/05/86/888650586.db2.gz UMENQJZLBJNOQE-FQEVSTJZSA-N 0 3 410.562 4.070 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@@H](c3ccccc3)c3cccnc3)c2)CC1 ZINC000473822267 888653331 /nfs/dbraw/zinc/65/33/31/888653331.db2.gz NDNBPBZZUSJJJZ-DEOSSOPVSA-N 0 3 415.541 4.135 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N(Cc3ccc(F)cc3)CC3CC3)c2)CC1 ZINC000473826574 888659767 /nfs/dbraw/zinc/65/97/67/888659767.db2.gz FOVMVXFTEMQQFK-UHFFFAOYSA-N 0 3 410.537 4.412 20 0 HIADHN CCN(Cc1c(F)cccc1F)C(=O)Nc1cccc(N2CCN(CC)CC2)c1 ZINC000473828685 888661495 /nfs/dbraw/zinc/66/14/95/888661495.db2.gz YKMXOZGDFMHWJJ-UHFFFAOYSA-N 0 3 402.489 4.161 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)NCCCO[C@@H](C)c3ccccc3)c2)CC1 ZINC000473835440 888672419 /nfs/dbraw/zinc/67/24/19/888672419.db2.gz CYSCNYJJPDFJAC-FQEVSTJZSA-N 0 3 410.562 4.118 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N(C)Cc3cc(C)c(OC)c(C)c3)c2)CC1 ZINC000473839547 888680034 /nfs/dbraw/zinc/68/00/34/888680034.db2.gz KQNFGWBOSCVZJV-UHFFFAOYSA-N 0 3 410.562 4.118 20 0 HIADHN CN(C)[C@H](CNC(=O)N[C@@H](c1cccc(Cl)c1)c1ccccn1)c1ccccc1 ZINC000473875291 888736632 /nfs/dbraw/zinc/73/66/32/888736632.db2.gz KZWDLWOPBULLFX-YADHBBJMSA-N 0 3 408.933 4.427 20 0 HIADHN CN(C)[C@H](CNC(=O)N[C@@H](c1cccc(Cl)c1)c1ccccn1)Cc1ccccc1 ZINC000473885960 888754118 /nfs/dbraw/zinc/75/41/18/888754118.db2.gz MQNMHURBGVIORY-GMAHTHKFSA-N 0 3 422.960 4.297 20 0 HIADHN CC[C@H](NCc1nc2ccc(OC)cc2s1)[C@@H](c1ccc(C)cc1)n1cncn1 ZINC000473993059 888853790 /nfs/dbraw/zinc/85/37/90/888853790.db2.gz GTFHIMNYWBFCBI-PGRDOPGGSA-N 0 3 407.543 4.363 20 0 HIADHN COc1ccc2c(c1)C(C)(C)C[C@@H]2N[C@@H](C)c1cccc(S(=O)(=O)N(C)C)c1 ZINC000474048476 888888425 /nfs/dbraw/zinc/88/84/25/888888425.db2.gz WZIXIHIFFITWOE-BTYIYWSLSA-N 0 3 402.560 4.019 20 0 HIADHN Cn1cc(CCNC(=O)N(Cc2ccccc2)C2CCN(C)CC2)c2ccc(F)cc21 ZINC000474085377 888911385 /nfs/dbraw/zinc/91/13/85/888911385.db2.gz VXBKXNRGPOPMJN-UHFFFAOYSA-N 0 3 422.548 4.166 20 0 HIADHN C[C@H](CC(=O)N(C)c1ccccc1)N[C@@H]1CCN(c2ccc(Cl)cc2Cl)C1=O ZINC000474108066 888928257 /nfs/dbraw/zinc/92/82/57/888928257.db2.gz UPRLHMBYJHZSQD-RDTXWAMCSA-N 0 3 420.340 4.130 20 0 HIADHN C[C@@H](NC(=O)c1[nH]c2ccccc2c1Br)[C@@H](c1ccccc1)N(C)C ZINC000474172218 889012246 /nfs/dbraw/zinc/01/22/46/889012246.db2.gz RNTCAFZUAGURFE-YJYMSZOUSA-N 0 3 400.320 4.352 20 0 HIADHN O=C1c2ccccc2C(=O)N1CCCCN1CCCC[C@H]1c1nc2ccccc2o1 ZINC000474208398 889046943 /nfs/dbraw/zinc/04/69/43/889046943.db2.gz DVROTAXCCKKYMP-FQEVSTJZSA-N 0 3 403.482 4.431 20 0 HIADHN C[C@@H](Oc1ccc(C(F)(F)F)cc1)C(=O)NC1CCN([C@@H](C)c2ccncc2)CC1 ZINC000474245822 889093944 /nfs/dbraw/zinc/09/39/44/889093944.db2.gz DENLWHHDQFGCCL-JKSUJKDBSA-N 0 3 421.463 4.210 20 0 HIADHN C[C@H]1C[C@H](c2ccc(C(F)(F)F)cc2)N(Cc2cnc(-c3cnn(C)c3)nc2)C1 ZINC000474260217 889117453 /nfs/dbraw/zinc/11/74/53/889117453.db2.gz QYIXZODQIKGDOE-IFXJQAMLSA-N 0 3 401.436 4.479 20 0 HIADHN COc1cccc(Cl)c1-c1noc(C)c1C(=O)NCc1ccccc1CN(C)C ZINC000474284000 889150161 /nfs/dbraw/zinc/15/01/61/889150161.db2.gz LFCZJWAYRMTFOC-UHFFFAOYSA-N 0 3 413.905 4.304 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)c3ncoc3-c3ccc(F)cc3)c2)CC1 ZINC000474372750 889249467 /nfs/dbraw/zinc/24/94/67/889249467.db2.gz QGSZBZSHKMQZBB-UHFFFAOYSA-N 0 3 408.477 4.263 20 0 HIADHN CC(C)[C@H](N[C@H]1CCN([C@@H](C(=O)OC(C)(C)C)c2ccccc2)C1=O)c1cccnc1 ZINC000474428738 889294182 /nfs/dbraw/zinc/29/41/82/889294182.db2.gz DZZJDNWSFQHIQQ-FDFHNCONSA-N 0 3 423.557 4.052 20 0 HIADHN COCCOc1c(Cl)cccc1NC(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C ZINC000474428759 889294862 /nfs/dbraw/zinc/29/48/62/889294862.db2.gz DFULEYAIGOXGTH-HNAYVOBHSA-N 0 3 405.926 4.178 20 0 HIADHN Cc1cc(NC(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)ccc1OC1CCOCC1 ZINC000474443743 889309357 /nfs/dbraw/zinc/30/93/57/889309357.db2.gz FDTZFIPPXFPVIL-MBSDFSHPSA-N 0 3 411.546 4.366 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)CNC(=O)c1sc2ccccc2c1Cl ZINC000474480592 889340503 /nfs/dbraw/zinc/34/05/03/889340503.db2.gz FBZKURFSLZTGHN-UHFFFAOYSA-N 0 3 415.946 4.293 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)C1(CCOCc2ccccc2)CC1 ZINC000474482268 889341803 /nfs/dbraw/zinc/34/18/03/889341803.db2.gz KDUILTDMQDDYBU-UHFFFAOYSA-N 0 3 422.569 4.217 20 0 HIADHN C[C@H](CCc1ccc(I)cc1)N[C@@H](C)c1nnc2ccccn21 ZINC000474484057 889345418 /nfs/dbraw/zinc/34/54/18/889345418.db2.gz DXCZJUZBOAVTFQ-KGLIPLIRSA-N 0 3 420.298 4.006 20 0 HIADHN CCN(C(=O)c1cccc(-c2n[nH]c(C)n2)c1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000474521102 889389311 /nfs/dbraw/zinc/38/93/11/889389311.db2.gz OXHYWTXVESMBEQ-HTAPYJJXSA-N 0 3 403.530 4.078 20 0 HIADHN CN1CC[C@@H](NC(=O)N[C@@H]2C[C@H]2c2ccc(Br)s2)[C@@H]1c1ccccc1 ZINC000474540409 889416155 /nfs/dbraw/zinc/41/61/55/889416155.db2.gz NVXGZMCHOVJYIZ-ADAWSYLGSA-N 0 3 420.376 4.111 20 0 HIADHN Cc1cc(Br)cc2c(C(=O)NC3CCN(CCOC(C)C)CC3)coc21 ZINC000474564132 889440266 /nfs/dbraw/zinc/44/02/66/889440266.db2.gz UKEBQQYXZVQXNN-UHFFFAOYSA-N 0 3 423.351 4.123 20 0 HIADHN CN(C(=O)Nc1cc(F)ccc1Br)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000474588881 889457809 /nfs/dbraw/zinc/45/78/09/889457809.db2.gz TXQBLRMAJYUMCW-MRXNPFEDSA-N 0 3 406.299 4.326 20 0 HIADHN CN(C(=O)Nc1ccccc1OC[C@H]1CCCCO1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000474722220 889579140 /nfs/dbraw/zinc/57/91/40/889579140.db2.gz YUCKSXUNQGDDGN-FGZHOGPDSA-N 0 3 423.557 4.373 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)c3c(C)c(F)ccc3Cl)CC2)c1 ZINC000474780672 889638852 /nfs/dbraw/zinc/63/88/52/889638852.db2.gz RJEPYSHVRNNQLU-UHFFFAOYSA-N 0 3 417.956 4.428 20 0 HIADHN COC(=O)C[C@@H]1CC[C@H](N[C@@H](c2cccc(OC)c2)c2cc(F)ccc2OC)[C@H]1C ZINC000474808504 889662244 /nfs/dbraw/zinc/66/22/44/889662244.db2.gz JZAHOOCTVKQOGW-ACVJBKQYSA-N 0 3 415.505 4.500 20 0 HIADHN COC(=O)C[C@@H]1CC[C@H](N[C@H](c2cccc(OC)c2)c2cc(F)ccc2OC)[C@H]1C ZINC000474808507 889662396 /nfs/dbraw/zinc/66/23/96/889662396.db2.gz JZAHOOCTVKQOGW-RNFQGHHASA-N 0 3 415.505 4.500 20 0 HIADHN CCN(C(=O)Nc1cc(F)ccc1-n1cccn1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475001843 889853146 /nfs/dbraw/zinc/85/31/46/889853146.db2.gz LNCUIEXHQOTGSA-FQEVSTJZSA-N 0 3 407.493 4.140 20 0 HIADHN CCN(C(=O)Nc1cc(-c2nnco2)ccc1C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475002479 889854165 /nfs/dbraw/zinc/85/41/65/889854165.db2.gz REXWQFWICDWMSA-HXUWFJFHSA-N 0 3 405.502 4.173 20 0 HIADHN C[C@H]1CCN(C(=O)Nc2ccccc2OCC(F)F)CCN1Cc1ccccc1 ZINC000475031768 889884080 /nfs/dbraw/zinc/88/40/80/889884080.db2.gz VQKYDLUPFHMJTI-KRWDZBQOSA-N 0 3 403.473 4.459 20 0 HIADHN CN(C)Cc1cccc(NC(=O)N2CCO[C@@H](c3cccc(C(F)(F)F)c3)C2)c1 ZINC000475036016 889887890 /nfs/dbraw/zinc/88/78/90/889887890.db2.gz UZHZEHOKEGDKAQ-LJQANCHMSA-N 0 3 407.436 4.372 20 0 HIADHN Cc1c(F)cccc1-c1ccc(CN(C)C[C@@H]2C[C@H](F)CN2Cc2ncccn2)o1 ZINC000475080140 889926019 /nfs/dbraw/zinc/92/60/19/889926019.db2.gz CPHVLUCLABKSNP-ROUUACIJSA-N 0 3 412.484 4.229 20 0 HIADHN Cc1ccc(CCCN(C)Cc2cccc(Br)c2OCC(C)(C)O)cn1 ZINC000475097433 889944303 /nfs/dbraw/zinc/94/43/03/889944303.db2.gz MPLLKPKQYDMZER-UHFFFAOYSA-N 0 3 421.379 4.367 20 0 HIADHN C[C@@H](NC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1)c1nc(C(C)(C)C)cs1 ZINC000475121948 889979288 /nfs/dbraw/zinc/97/92/88/889979288.db2.gz UOSSPHSJUWIGNI-AEFFLSMTSA-N 0 3 400.592 4.418 20 0 HIADHN CC[C@H](C)C(=O)Nc1cccc(CNC(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000475131506 889994050 /nfs/dbraw/zinc/99/40/50/889994050.db2.gz DFJBMQUARDIVRK-WMZHIEFXSA-N 0 3 422.573 4.087 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N(C)[C@H](C)c1ccc([S@@](C)=O)cc1)c1ccsc1 ZINC000475136904 890002064 /nfs/dbraw/zinc/00/20/64/890002064.db2.gz IVVYTRWJHYEJQW-FYOXXRTDSA-N 0 3 421.632 4.271 20 0 HIADHN C[C@@H](NC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1)c1ccc(NC(=O)C2CC2)cc1 ZINC000475137524 890003765 /nfs/dbraw/zinc/00/37/65/890003765.db2.gz KIORNQLTIPIEAR-JPYJTQIMSA-N 0 3 420.557 4.012 20 0 HIADHN C[C@H](NC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(OC(F)F)cc1 ZINC000475145429 890012181 /nfs/dbraw/zinc/01/21/81/890012181.db2.gz XIPCDQUECHIXBE-QFBILLFUSA-N 0 3 403.473 4.265 20 0 HIADHN CC(C)[C@@H](CCO)NCC(=O)Nc1nc(-c2ccc(Cl)cc2Cl)cs1 ZINC000475150054 890016938 /nfs/dbraw/zinc/01/69/38/890016938.db2.gz QYKYRKQDMDCLQR-CQSZACIVSA-N 0 3 402.347 4.052 20 0 HIADHN CCN(C(=O)N[C@H](C)c1ccccc1-n1cccn1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475162746 890026229 /nfs/dbraw/zinc/02/62/29/890026229.db2.gz DZENGFHVBCANLS-IFMALSPDSA-N 0 3 417.557 4.239 20 0 HIADHN CCCCCn1cc(CNC(=O)N(CC)[C@@H]2CCN(Cc3ccccc3)C2)c(C)n1 ZINC000475162834 890026283 /nfs/dbraw/zinc/02/62/83/890026283.db2.gz LDJQPDNUIDVRAU-HSZRJFAPSA-N 0 3 411.594 4.188 20 0 HIADHN CCN(C(=O)N[C@@H](C)c1cccc(NC(C)=O)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475162323 890026771 /nfs/dbraw/zinc/02/67/71/890026771.db2.gz KADRROWAIGCGCR-FDDCHVKYSA-N 0 3 408.546 4.012 20 0 HIADHN CC1CCN([C@H](CNC(=O)Nc2ccc(-c3ncn(C)n3)cc2)c2cccs2)CC1 ZINC000475211721 890080451 /nfs/dbraw/zinc/08/04/51/890080451.db2.gz WHVYOPAMYWPUSX-LJQANCHMSA-N 0 3 424.574 4.138 20 0 HIADHN C[C@@H](NC(=O)Nc1ncccc1OCc1cccc(Cl)c1)C1=CCN(C)CC1 ZINC000475261703 890153893 /nfs/dbraw/zinc/15/38/93/890153893.db2.gz FBEBNSOQXCZEGO-OAHLLOKOSA-N 0 3 400.910 4.086 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@H]2CNC(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000475279539 890173996 /nfs/dbraw/zinc/17/39/96/890173996.db2.gz KCSZHKNWOHUWBO-GVAUOCQISA-N 0 3 421.585 4.379 20 0 HIADHN Cc1ccccc1-n1nc(C(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)c2c1CCC2 ZINC000475297451 890204465 /nfs/dbraw/zinc/20/44/65/890204465.db2.gz NPQNQRAYRGSSAP-OAQYLSRUSA-N 0 3 414.553 4.016 20 0 HIADHN CN(C(=O)Cc1coc(-c2ccc(Cl)cc2)n1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475300026 890208588 /nfs/dbraw/zinc/20/85/88/890208588.db2.gz FWEGRYGYFPFROF-OAQYLSRUSA-N 0 3 409.917 4.270 20 0 HIADHN CN(C(=O)Cc1coc(-c2ccc(Cl)cc2)n1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475300025 890208947 /nfs/dbraw/zinc/20/89/47/890208947.db2.gz FWEGRYGYFPFROF-NRFANRHFSA-N 0 3 409.917 4.270 20 0 HIADHN CC(C)c1noc(-c2ccccc2C(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000475303387 890211291 /nfs/dbraw/zinc/21/12/91/890211291.db2.gz HVUFXYSVLGEDNO-IBGZPJMESA-N 0 3 404.514 4.207 20 0 HIADHN CN(C(=O)c1cccc(OCc2cscn2)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475302965 890212678 /nfs/dbraw/zinc/21/26/78/890212678.db2.gz GODFIVRJEBQKDV-NRFANRHFSA-N 0 3 407.539 4.069 20 0 HIADHN CN(C(=O)CCc1nnc(-c2ccc(Cl)cc2)o1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475308421 890220468 /nfs/dbraw/zinc/22/04/68/890220468.db2.gz PIXCENADKZMGBH-FQEVSTJZSA-N 0 3 424.932 4.056 20 0 HIADHN CN(C(=O)C1(c2cccc(Cl)c2)CCOCC1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475316835 890233048 /nfs/dbraw/zinc/23/30/48/890233048.db2.gz MKYVVSNEAUUAMK-QFIPXVFZSA-N 0 3 412.961 4.121 20 0 HIADHN Cc1ccc([C@@H](N[C@H](C)CCCOc2ccccc2C(N)=O)c2ccccn2)cc1 ZINC000475332502 890252848 /nfs/dbraw/zinc/25/28/48/890252848.db2.gz HKPMKPZYUBYXMZ-NTKDMRAZSA-N 0 3 403.526 4.416 20 0 HIADHN C[C@H](CNC(=O)c1cn(C)nc1-c1ccc(Cl)s1)N(C)Cc1ccccc1 ZINC000475502265 890414802 /nfs/dbraw/zinc/41/48/02/890414802.db2.gz NHTQPTMXEKPDFK-CQSZACIVSA-N 0 3 402.951 4.052 20 0 HIADHN CN(C(=O)c1cc2cc(Br)ccc2[nH]1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475542466 890466992 /nfs/dbraw/zinc/46/69/92/890466992.db2.gz WNUUYHJVCLVVLK-SFHVURJKSA-N 0 3 412.331 4.277 20 0 HIADHN CN(C)c1ccc(-c2cncc(C(=O)N(C)[C@@H]3CCN(Cc4ccccc4)C3)c2)cc1 ZINC000475562030 890491025 /nfs/dbraw/zinc/49/10/25/890491025.db2.gz SOHQOYPBOBBOFO-RUZDIDTESA-N 0 3 414.553 4.161 20 0 HIADHN CCN1CCN(c2ccccc2CNc2ccc(NC(=O)c3ccccc3)cn2)CC1 ZINC000475588653 890516908 /nfs/dbraw/zinc/51/69/08/890516908.db2.gz YSNUALSDNWOQPR-UHFFFAOYSA-N 0 3 415.541 4.088 20 0 HIADHN CC1CCN([C@@H](CNC(=O)Nc2ccc([S@](C)=O)cc2)c2cccs2)CC1 ZINC000475626028 890563227 /nfs/dbraw/zinc/56/32/27/890563227.db2.gz PSIAOKMTANIJTM-MYUZEXMDSA-N 0 3 405.589 4.080 20 0 HIADHN CC1CCN([C@H](CNC(=O)Nc2ccc([S@](C)=O)cc2)c2cccs2)CC1 ZINC000475626024 890563577 /nfs/dbraw/zinc/56/35/77/890563577.db2.gz PSIAOKMTANIJTM-CLYVBNDRSA-N 0 3 405.589 4.080 20 0 HIADHN C[C@H](CC(=O)N(C)c1ccccc1)N[C@@H](CO)c1ccc(Cl)cc1C(F)(F)F ZINC000475636322 890577239 /nfs/dbraw/zinc/57/72/39/890577239.db2.gz UXIKPKIXFGTDRS-ACJLOTCBSA-N 0 3 414.855 4.423 20 0 HIADHN C[C@@H](CC(=O)N(C)c1ccccc1)N[C@H](CO)c1ccc(Cl)cc1C(F)(F)F ZINC000475636324 890577815 /nfs/dbraw/zinc/57/78/15/890577815.db2.gz UXIKPKIXFGTDRS-SCLBCKFNSA-N 0 3 414.855 4.423 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1cc(-n2cccn2)ccc1C)c1cccc(OC)c1 ZINC000475638706 890580736 /nfs/dbraw/zinc/58/07/36/890580736.db2.gz CXRKPQYZKGJNRP-HSZRJFAPSA-N 0 3 421.545 4.394 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1cc(-n2cccn2)ccc1C)c1cccc(OC)c1 ZINC000475638707 890581321 /nfs/dbraw/zinc/58/13/21/890581321.db2.gz CXRKPQYZKGJNRP-QHCPKHFHSA-N 0 3 421.545 4.394 20 0 HIADHN C[C@@H]1CCN(C(=O)Nc2cnc(-c3ccccc3)nc2)CCN1Cc1ccccc1 ZINC000475664138 890610993 /nfs/dbraw/zinc/61/09/93/890610993.db2.gz XRUKDOXIFYCXMY-LJQANCHMSA-N 0 3 401.514 4.272 20 0 HIADHN CCc1nnc(-c2ccc(NC(=O)N[C@H]3CCN([C@@H](C)c4ccccc4)C3)cc2)o1 ZINC000475712917 890651711 /nfs/dbraw/zinc/65/17/11/890651711.db2.gz CMTMYDYLOWYIJD-JXFKEZNVSA-N 0 3 405.502 4.256 20 0 HIADHN CN(C(=O)CN1CCC[C@@]2(CCCOC2)C1)[C@@H](c1ccccc1)c1ccc(F)cc1 ZINC000475743228 890685944 /nfs/dbraw/zinc/68/59/44/890685944.db2.gz XMUFVXWVVLSJAC-LOSJGSFVSA-N 0 3 410.533 4.266 20 0 HIADHN C[C@@H](c1ccc([S@@](C)=O)cc1)N(C)CCC(=O)Nc1ccc(Br)cc1 ZINC000475745516 890689112 /nfs/dbraw/zinc/68/91/12/890689112.db2.gz DMQHGNPYHYHQTQ-HWRSSNJWSA-N 0 3 423.376 4.208 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1cn(C)nc1-c1ccc(Cl)s1 ZINC000475837211 890769116 /nfs/dbraw/zinc/76/91/16/890769116.db2.gz OQDQLVJGZLBDAE-RHSMWYFYSA-N 0 3 414.962 4.052 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCCc1ccncc1)c1ccc(C(F)(F)F)cc1 ZINC000475847079 890780749 /nfs/dbraw/zinc/78/07/49/890780749.db2.gz FODNEHLWFSFERY-IBGZPJMESA-N 0 3 408.468 4.025 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N[C@@H]2CCSc3ccc(Cl)cc32)CC1 ZINC000475908640 890838222 /nfs/dbraw/zinc/83/82/22/890838222.db2.gz WXQPAWPTGNHRMN-GOSISDBHSA-N 0 3 411.999 4.066 20 0 HIADHN COc1ccc(C(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)c(OC(F)F)c1 ZINC000475926718 890852266 /nfs/dbraw/zinc/85/22/66/890852266.db2.gz BOFFEEGRLGWMPR-MRXNPFEDSA-N 0 3 404.457 4.033 20 0 HIADHN CCN(CC)C(=O)c1ccc(NC(=O)NCC(C)(C)N2CCc3ccccc3C2)cc1 ZINC000504769900 913502427 /nfs/dbraw/zinc/50/24/27/913502427.db2.gz JQQMBEXWUPJASU-UHFFFAOYSA-N 0 3 422.573 4.127 20 0 HIADHN CCN1CCC[C@@H](CN(C)C(=O)c2c(C)c(F)ccc2Cl)[C@@H]1c1cnn(C)c1 ZINC000476011860 890940671 /nfs/dbraw/zinc/94/06/71/890940671.db2.gz OGXNTRRSERDHQH-MGPUTAFESA-N 0 3 406.933 4.066 20 0 HIADHN CCNc1ccc(Cl)cc1C(=O)N(C)C[C@@H]1CCCN(CC)[C@H]1c1cnn(C)c1 ZINC000476016364 890945773 /nfs/dbraw/zinc/94/57/73/890945773.db2.gz CKFWMMKWDFIYAM-HRAATJIYSA-N 0 3 417.985 4.051 20 0 HIADHN Cn1cc(C(=O)NC[C@@H](c2cccs2)N2CCCC2)c(-c2ccc(Cl)s2)n1 ZINC000476020544 890953442 /nfs/dbraw/zinc/95/34/42/890953442.db2.gz IJVOFTGIUWXCKN-AWEZNQCLSA-N 0 3 420.991 4.430 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N[C@@H](Cc2ccccc2)c2cccs2)CC1 ZINC000476048855 890978455 /nfs/dbraw/zinc/97/84/55/890978455.db2.gz HKVOBJOLYCWKQF-NRFANRHFSA-N 0 3 415.603 4.221 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)N[C@@H]2CCSc3ccc(Cl)cc32)cc1 ZINC000476203663 891134132 /nfs/dbraw/zinc/13/41/32/891134132.db2.gz FQVJQUPQFJWWKZ-MOPGFXCFSA-N 0 3 419.978 4.488 20 0 HIADHN CCc1onc(-c2ccccc2)c1C(=O)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000476257629 891180333 /nfs/dbraw/zinc/18/03/33/891180333.db2.gz IGRVTCYXKFWITL-UHFFFAOYSA-N 0 3 405.498 4.113 20 0 HIADHN Cc1onc(-c2ccccc2C)c1C(=O)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000476264394 891186050 /nfs/dbraw/zinc/18/60/50/891186050.db2.gz MYTXNVUYECOJNK-UHFFFAOYSA-N 0 3 405.498 4.167 20 0 HIADHN CCc1onc(-c2ccccc2Cl)c1C(=O)NCCCCN1C[C@@H](C)O[C@@H](C)C1 ZINC000476302425 891215670 /nfs/dbraw/zinc/21/56/70/891215670.db2.gz CNBRNGPEDAFRIX-IYBDPMFKSA-N 0 3 419.953 4.177 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)c2cn(C)nc2-c2ccc(Cl)s2)CN1Cc1ccccc1 ZINC000476305000 891216775 /nfs/dbraw/zinc/21/67/75/891216775.db2.gz XDQYMPQJTJBRTR-GDBMZVCRSA-N 0 3 414.962 4.195 20 0 HIADHN Cc1onc(-c2ccccc2C)c1C(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000476308362 891219870 /nfs/dbraw/zinc/21/98/70/891219870.db2.gz VMLLRUOWRFKBDS-UHFFFAOYSA-N 0 3 419.525 4.415 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)N[C@H]2CCCN(c3ccccc3F)C2)CC1 ZINC000476316106 891224117 /nfs/dbraw/zinc/22/41/17/891224117.db2.gz LRFVJSBMDCYSKP-NRFANRHFSA-N 0 3 424.564 4.101 20 0 HIADHN COc1ccc(C(=O)CCCCCC(=O)N[C@@H]2CN(C)C[C@H]2c2ccccc2)cc1 ZINC000476333168 891237660 /nfs/dbraw/zinc/23/76/60/891237660.db2.gz HMFCKRLAMQAWPP-XZOQPEGZSA-N 0 3 408.542 4.042 20 0 HIADHN O=C(Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)[C@@H]1CCCc2c(O)cccc21 ZINC000476334492 891239223 /nfs/dbraw/zinc/23/92/23/891239223.db2.gz PYCHDWWPYJUKGD-SIKLNZKXSA-N 0 3 416.525 4.094 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)Nc1c(F)cc(F)cc1Br ZINC000476370142 891281819 /nfs/dbraw/zinc/28/18/19/891281819.db2.gz OTJJQTQLVXQATF-GFCCVEGCSA-N 0 3 412.278 4.369 20 0 HIADHN CCN(Cc1ccc(Cl)c(Cl)c1)C(=O)NC1CCN(CCOC(C)C)CC1 ZINC000476435156 891348048 /nfs/dbraw/zinc/34/80/48/891348048.db2.gz MBTLYEHEAXUQMZ-UHFFFAOYSA-N 0 3 416.393 4.414 20 0 HIADHN Cc1ccc([C@H]2CCC[C@@H]2N(C)C(=O)NC2CCN(CCOC(C)C)CC2)cc1 ZINC000476456257 891367751 /nfs/dbraw/zinc/36/77/51/891367751.db2.gz YWDKEHQZXFVELN-PKTZIBPZSA-N 0 3 401.595 4.162 20 0 HIADHN C[C@H]1[C@@H](c2ccccc2)CCN1CC(=O)NCc1cccc(COCc2ccco2)c1 ZINC000476578841 891501851 /nfs/dbraw/zinc/50/18/51/891501851.db2.gz ZTSCFFYGNONVPE-CPJSRVTESA-N 0 3 418.537 4.491 20 0 HIADHN COc1c(F)cc(F)cc1NC(=O)NC[C@H](c1ccc(OC(C)C)cc1)N(C)C ZINC000476651161 891590992 /nfs/dbraw/zinc/59/09/92/891590992.db2.gz GFRYDQUPBPUOHT-LJQANCHMSA-N 0 3 407.461 4.185 20 0 HIADHN CN(C(=O)NC[C@H](c1c[nH]c2ccccc21)c1ccccc1)[C@@H]1CCN(C2CC2)C1 ZINC000476654285 891596936 /nfs/dbraw/zinc/59/69/36/891596936.db2.gz LCCUEKSIVLDFKB-IRLDBZIGSA-N 0 3 402.542 4.178 20 0 HIADHN CC(C)[C@@H](CNC(=O)Nc1cccc(N2CCCC2=O)c1)N1CCc2ccccc2C1 ZINC000504849002 913574068 /nfs/dbraw/zinc/57/40/68/913574068.db2.gz OKFGACATDQXQFG-HSZRJFAPSA-N 0 3 420.557 4.018 20 0 HIADHN CCc1onc(-c2ccccc2Cl)c1C(=O)N1C[C@@H](SC)[C@H](N2CCCC2)C1 ZINC000476670031 891620145 /nfs/dbraw/zinc/62/01/45/891620145.db2.gz AESPGQGLFBWCQA-SJLPKXTDSA-N 0 3 419.978 4.209 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)N1CCC[C@]2(C1)OCc1ccccc12 ZINC000476687714 891641455 /nfs/dbraw/zinc/64/14/55/891641455.db2.gz BAGBBVLYPOMJDJ-ILBGXUMGSA-N 0 3 405.542 4.055 20 0 HIADHN Cc1sc(CNC(=O)N(C)[C@@H]2CCN(C3CC3)C2)nc1-c1ccc(Cl)cc1 ZINC000476708431 891667928 /nfs/dbraw/zinc/66/79/28/891667928.db2.gz HEGHYUUDKMZFII-QGZVFWFLSA-N 0 3 404.967 4.150 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)N(CCCO)[C@H]1CCCc2ccccc21 ZINC000476833877 891814006 /nfs/dbraw/zinc/81/40/06/891814006.db2.gz WKHNZXMIFFOUHX-RPBOFIJWSA-N 0 3 421.585 4.295 20 0 HIADHN O=C(Nc1ccccc1C(=O)N1CCCCC1)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000504877132 913605811 /nfs/dbraw/zinc/60/58/11/913605811.db2.gz RZODRROVCHRVGX-OAQYLSRUSA-N 0 3 420.557 4.099 20 0 HIADHN O=C(Nc1ccc(OC[C@H]2CCCO2)cc1)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000504877512 913606107 /nfs/dbraw/zinc/60/61/07/913606107.db2.gz UVSRVHPLTCHFSZ-FYYLOGMGSA-N 0 3 409.530 4.031 20 0 HIADHN COc1ccc([C@H](C)NC(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)cc1F ZINC000476905751 891859610 /nfs/dbraw/zinc/85/96/10/891859610.db2.gz VIWCPFWQUVBZFQ-KKSFZXQISA-N 0 3 417.525 4.285 20 0 HIADHN CN(C)Cc1ccsc1C(=O)NC[C@@H]1CCN(C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000476984690 891910631 /nfs/dbraw/zinc/91/06/31/891910631.db2.gz YOBQVFXYBBFNJH-KSSFIOAISA-N 0 3 409.958 4.025 20 0 HIADHN C[C@H](c1ccc([S@@](C)=O)cc1)N(C)CCC(=O)Nc1cccc(Br)c1 ZINC000477056147 891987496 /nfs/dbraw/zinc/98/74/96/891987496.db2.gz JKWGZOPCFOWXJS-DLUDVSRJSA-N 0 3 423.376 4.208 20 0 HIADHN C[C@@H](c1ccc([S@](C)=O)cc1)N(C)CCC(=O)Nc1cccc(Br)c1 ZINC000477056150 891987975 /nfs/dbraw/zinc/98/79/75/891987975.db2.gz JKWGZOPCFOWXJS-SXBQZSJRSA-N 0 3 423.376 4.208 20 0 HIADHN O=C(N[C@H]1CCCN(Cc2ccccc2)C1)N1CC=C(c2c[nH]c3ncccc23)CC1 ZINC000504884234 913615688 /nfs/dbraw/zinc/61/56/88/913615688.db2.gz ZLEKBXJNRWEXNZ-NRFANRHFSA-N 0 3 415.541 4.026 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)CCc3ccsc3)c(OCC)c2)CC1 ZINC000477178270 892096539 /nfs/dbraw/zinc/09/65/39/892096539.db2.gz PRIQEKFUEGHSHB-UHFFFAOYSA-N 0 3 401.576 4.250 20 0 HIADHN C[C@@H](CNC(=O)N(CCc1ccccc1)Cc1ccncc1)N(C)Cc1ccccc1 ZINC000477336732 892306019 /nfs/dbraw/zinc/30/60/19/892306019.db2.gz BRZMTGBPKRFYPG-QFIPXVFZSA-N 0 3 416.569 4.356 20 0 HIADHN CCC(CC)[C@H]1C[C@@H](NC(=O)Nc2ccc(CCN3CCSCC3)cc2)CCO1 ZINC000477536651 892571450 /nfs/dbraw/zinc/57/14/50/892571450.db2.gz YIRRQWNXEDQUGW-FCHUYYIVSA-N 0 3 419.635 4.383 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1cccn(Cc2ccc(C)cc2)c1=O)c1ccco1 ZINC000477584391 892651029 /nfs/dbraw/zinc/65/10/29/892651029.db2.gz CQKPGZFMLGHXRV-RXVVDRJESA-N 0 3 422.529 4.049 20 0 HIADHN C[C@H](c1cc2ccccc2o1)N(C)C(=O)NCC1(N2CCSCC2)CCCC1 ZINC000504959980 913697567 /nfs/dbraw/zinc/69/75/67/913697567.db2.gz RZOIEKLXYLTMRP-QGZVFWFLSA-N 0 3 401.576 4.497 20 0 HIADHN Cc1ccc(Br)cc1C(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000477737130 892834192 /nfs/dbraw/zinc/83/41/92/892834192.db2.gz DJRUHLPYFGSCHC-UHFFFAOYSA-N 0 3 417.347 4.214 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1cccc(OC(F)(F)F)c1 ZINC000477744406 892838971 /nfs/dbraw/zinc/83/89/71/892838971.db2.gz LFDXDHAVHPQLCV-UHFFFAOYSA-N 0 3 408.420 4.042 20 0 HIADHN C[S@@](=O)c1ccc(NC(=O)N[C@H](CN2CCc3ccccc3C2)C(C)(C)C)cc1 ZINC000477779489 892862900 /nfs/dbraw/zinc/86/29/00/892862900.db2.gz NZSVAVVIURPBAP-ONOMSOESSA-N 0 3 413.587 4.019 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCc1csc(-c2ccco2)n1)c1ccsc1 ZINC000477825792 892890423 /nfs/dbraw/zinc/89/04/23/892890423.db2.gz ODIZIQWTQQOYSO-MRXNPFEDSA-N 0 3 404.561 4.347 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)NCCc1ccc(Br)s1)c1ccco1 ZINC000477844412 892902099 /nfs/dbraw/zinc/90/20/99/892902099.db2.gz MLBSRHBZAJIKQR-TZMCWYRMSA-N 0 3 414.369 4.075 20 0 HIADHN CCCCCn1cc(CNC(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)c(C)n1 ZINC000504973726 913714928 /nfs/dbraw/zinc/71/49/28/913714928.db2.gz VLTBVQGSAQMLAX-QHCPKHFHSA-N 0 3 411.594 4.188 20 0 HIADHN C[C@@H]1C[C@H]1c1ccc(CN(C(=O)NCC2(N3CCSCC3)CCCC2)C2CC2)o1 ZINC000504977457 913718470 /nfs/dbraw/zinc/71/84/70/913718470.db2.gz QYAQLIUBDCVYNZ-YLJYHZDGSA-N 0 3 417.619 4.439 20 0 HIADHN CCN(CC)C(=O)Nc1ccc([C@@H](C)N[C@@H]2CCN(Cc3ccc(C)cc3)C2=O)cc1 ZINC000477918227 893002097 /nfs/dbraw/zinc/00/20/97/893002097.db2.gz OYDLGMXVGISLDJ-AUSIDOKSSA-N 0 3 422.573 4.320 20 0 HIADHN CC(C)c1ccc(NC(=O)C[C@@H](C)N[C@H]2CCN(Cc3ccc(F)cc3)C2=O)cc1 ZINC000477920093 893005646 /nfs/dbraw/zinc/00/56/46/893005646.db2.gz UJDFNUPYLHZEJP-VGSWGCGISA-N 0 3 411.521 4.057 20 0 HIADHN Cc1cc([C@@H](NC[C@@H](CO)Cc2ccc(F)c(F)c2)c2cccnc2)ccc1F ZINC000477931254 893019602 /nfs/dbraw/zinc/01/96/02/893019602.db2.gz MOSVRMFTCSVXRX-GAJHUEQPSA-N 0 3 400.444 4.338 20 0 HIADHN CC(=O)Nc1ccc(F)c(C(=O)N(CCN2CCCC2)Cc2ccc(Cl)cc2)c1 ZINC000477984195 893083951 /nfs/dbraw/zinc/08/39/51/893083951.db2.gz NBLADOZZPIMJNB-UHFFFAOYSA-N 0 3 417.912 4.176 20 0 HIADHN CC(C)CN(CCN(C)C)C(=O)Nc1cccc(-c2cn(Cc3ccccc3)nn2)c1 ZINC000478002161 893105626 /nfs/dbraw/zinc/10/56/26/893105626.db2.gz WMYFUSVOSXVHMX-UHFFFAOYSA-N 0 3 420.561 4.045 20 0 HIADHN COc1ccc(C(=O)N(Cc2ccco2)C2CCN(C)CC2)c(OC2CCCC2)c1 ZINC000478053810 893207425 /nfs/dbraw/zinc/20/74/25/893207425.db2.gz NWVWJQSLXBWUPD-UHFFFAOYSA-N 0 3 412.530 4.346 20 0 HIADHN CCN1CCN(CCC(=O)N2CCC(=Cc3cc(Cl)ccc3Cl)CC2)CC1 ZINC000478120380 893288984 /nfs/dbraw/zinc/28/89/84/893288984.db2.gz PVQMFWGXXOXZPG-UHFFFAOYSA-N 0 3 410.389 4.027 20 0 HIADHN CCCN(C(=O)Cc1ccc(NC(C)=O)cc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000505017540 913760529 /nfs/dbraw/zinc/76/05/29/913760529.db2.gz XJIJOWCFEMTZTK-DEOSSOPVSA-N 0 3 407.558 4.091 20 0 HIADHN Cc1ccc(F)cc1CNCc1ccccc1CN1C(=O)NC2(CCCCC2)C1=O ZINC000478211125 893372655 /nfs/dbraw/zinc/37/26/55/893372655.db2.gz SAZMZQBKKXHVLL-UHFFFAOYSA-N 0 3 409.505 4.179 20 0 HIADHN CC1CCN([C@H](CNC(=O)N[C@@H]2CCO[C@H](C(C)(C)C)C2)c2cccs2)CC1 ZINC000478219856 893379716 /nfs/dbraw/zinc/37/97/16/893379716.db2.gz LKDJZZHQWRHHTE-GGPKGHCWSA-N 0 3 407.624 4.414 20 0 HIADHN Cn1cc([C@@H](NCCc2cc(Cl)c3c(c2)OCCCO3)c2ccc(F)cc2)cn1 ZINC000478330621 893565350 /nfs/dbraw/zinc/56/53/50/893565350.db2.gz OAHYHYRIELJGBW-NRFANRHFSA-N 0 3 415.896 4.296 20 0 HIADHN CN(CCCN1CCN(C)CC1)C(=O)N[C@@H]1CCCCC[C@H]1c1ccc(Cl)cc1 ZINC000505045137 913785891 /nfs/dbraw/zinc/78/58/91/913785891.db2.gz UIPUEXNLJHUYOA-FCHUYYIVSA-N 0 3 421.029 4.035 20 0 HIADHN Cc1ccc(C(=O)N[C@H]2CN(C)C[C@H]2c2ccccc2)cc1NC(=O)c1ccccc1 ZINC000478372284 893638333 /nfs/dbraw/zinc/63/83/33/893638333.db2.gz PUUPJKAJQJVZLV-UPVQGACJSA-N 0 3 413.521 4.075 20 0 HIADHN CCCN(CCN(C)C)C(=O)c1oc2ccccc2c1CSc1nnc(C)s1 ZINC000478433291 893734529 /nfs/dbraw/zinc/73/45/29/893734529.db2.gz OSSTVXXTEZOJCN-UHFFFAOYSA-N 0 3 418.588 4.299 20 0 HIADHN CN1C[C@@H](NC(=O)COC(c2ccccc2)c2ccccc2)[C@@H](c2ccccc2)C1 ZINC000478449645 893764446 /nfs/dbraw/zinc/76/44/46/893764446.db2.gz MHHJUIWCXIXCNH-DNQXCXABSA-N 0 3 400.522 4.007 20 0 HIADHN CN(C)[C@H](CNC(=O)N(CCC(F)(F)F)Cc1ccccc1)Cc1ccccc1 ZINC000478455311 893775460 /nfs/dbraw/zinc/77/54/60/893775460.db2.gz AVPXADHRKHKMSC-FQEVSTJZSA-N 0 3 407.480 4.324 20 0 HIADHN COc1cc2c(cc1OC)[C@H](c1ccccc1)N(CCC(=O)Nc1cccnc1)CC2 ZINC000478485118 893807386 /nfs/dbraw/zinc/80/73/86/893807386.db2.gz SPJTVTQFCXCUPP-VWLOTQADSA-N 0 3 417.509 4.075 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)N[C@@H](c2nc3ccccc3[nH]2)C(C)C)c1 ZINC000478491110 893810058 /nfs/dbraw/zinc/81/00/58/893810058.db2.gz LGAFQGOAQSABSN-JOCHJYFZSA-N 0 3 423.561 4.042 20 0 HIADHN Cc1ccc(I)cc1NC(=O)c1cccc(CN2CCCC2)c1 ZINC000478644560 893892718 /nfs/dbraw/zinc/89/27/18/893892718.db2.gz NYTJNBBONZJOND-UHFFFAOYSA-N 0 3 420.294 4.448 20 0 HIADHN Cc1nc(COc2ccc(F)cc2)sc1C(=O)NC[C@@H](C)N1CCCC[C@H]1C ZINC000478700559 893961771 /nfs/dbraw/zinc/96/17/71/893961771.db2.gz KREUNOMWVRHGOE-HUUCEWRRSA-N 0 3 405.539 4.162 20 0 HIADHN COc1ccc([C@@H](C)N(C)C(=O)[C@@H]2CN(Cc3ccccc3)CCC2(F)F)cc1 ZINC000505120456 913827176 /nfs/dbraw/zinc/82/71/76/913827176.db2.gz OUKGINHMXOJJRG-UTKZUKDTSA-N 0 3 402.485 4.372 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2ccc(OC(F)(F)F)cc2)c1 ZINC000478771608 894046345 /nfs/dbraw/zinc/04/63/45/894046345.db2.gz YMBNSDZUYFMIKN-UHFFFAOYSA-N 0 3 411.424 4.190 20 0 HIADHN C[C@@H](NC(=O)NCc1ccnc(OCc2ccccc2)c1)[C@H](c1ccccc1)N(C)C ZINC000478770996 894047672 /nfs/dbraw/zinc/04/76/72/894047672.db2.gz OKUZBNHSTXVBNQ-NTKDMRAZSA-N 0 3 418.541 4.151 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)N[C@H]2CCc3c2cccc3Cl)c1 ZINC000478809551 894083945 /nfs/dbraw/zinc/08/39/45/894083945.db2.gz BNNFWHIJPOWJCC-NRFANRHFSA-N 0 3 401.938 4.109 20 0 HIADHN Cc1ccccc1-c1nc(C(=O)NCc2ccccc2CN2CCC(O)CC2)cs1 ZINC000478872531 894151382 /nfs/dbraw/zinc/15/13/82/894151382.db2.gz WXFRQIDNWMTUNW-UHFFFAOYSA-N 0 3 421.566 4.005 20 0 HIADHN CN(C)C[C@H](NC(=O)Nc1cccc2c1CN(c1ccccn1)C2)c1ccc(F)cc1 ZINC000479030877 894293495 /nfs/dbraw/zinc/29/34/95/894293495.db2.gz YULUDHFQJPYKBV-QFIPXVFZSA-N 0 3 419.504 4.165 20 0 HIADHN C[C@H](CCc1ccc(O)cc1)N[C@@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479058163 894316551 /nfs/dbraw/zinc/31/65/51/894316551.db2.gz JUKMQZZDPUHJFV-NEPJUHHUSA-N 0 3 417.358 4.018 20 0 HIADHN C[C@@H](CN[C@@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl)Cc1cccs1 ZINC000479064932 894327288 /nfs/dbraw/zinc/32/72/88/894327288.db2.gz HSUVXKHTYYFQLQ-MNOVXSKESA-N 0 3 407.388 4.232 20 0 HIADHN C[C@H](CN[C@@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl)c1ccc(F)cc1F ZINC000479066753 894330480 /nfs/dbraw/zinc/33/04/80/894330480.db2.gz VCHGHGAEMOHSAL-ZJUUUORDSA-N 0 3 423.312 4.373 20 0 HIADHN CCO[C@H](CCN[C@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl)C1CCCC1 ZINC000479069875 894334894 /nfs/dbraw/zinc/33/48/94/894334894.db2.gz QCXZRZJAJWTWFY-SJKOYZFVSA-N 0 3 423.406 4.277 20 0 HIADHN Brc1ccc2c(c1)CCC[C@H]2NCc1ccccc1N1CCOCC1 ZINC000479081000 894346900 /nfs/dbraw/zinc/34/69/00/894346900.db2.gz SYBKNARODKVLEW-HXUWFJFHSA-N 0 3 401.348 4.453 20 0 HIADHN Brc1ccc2c(c1)CCC[C@@H]2NCc1ccccc1N1CCOCC1 ZINC000479080998 894347236 /nfs/dbraw/zinc/34/72/36/894347236.db2.gz SYBKNARODKVLEW-FQEVSTJZSA-N 0 3 401.348 4.453 20 0 HIADHN O=S(=O)([N-]c1cccc(CC[NH+]2CCCC2)c1)c1ccc(CC(F)(F)F)cc1 ZINC000479136335 894406766 /nfs/dbraw/zinc/40/67/66/894406766.db2.gz SHAKFWDWGIQGTQ-UHFFFAOYSA-N 0 3 412.477 4.231 20 0 HIADHN COc1cc2c(cc1OC)[C@H](NCc1cccc(NC(=O)c3ccccn3)c1)CC2 ZINC000479330415 894624064 /nfs/dbraw/zinc/62/40/64/894624064.db2.gz KITCNFGWCSUAGG-HXUWFJFHSA-N 0 3 403.482 4.128 20 0 HIADHN O=C(NCCN[C@@H](c1ccc(Br)cc1F)C1CC1)c1ccccc1F ZINC000479347589 894643418 /nfs/dbraw/zinc/64/34/18/894643418.db2.gz IGTFCMBRCFSFFR-GOSISDBHSA-N 0 3 409.274 4.198 20 0 HIADHN CO[C@H](c1ccc(Cl)cc1)[C@@H](C)N[C@@H](C)c1cc(S(N)(=O)=O)c(C)cc1C ZINC000479405181 894709733 /nfs/dbraw/zinc/70/97/33/894709733.db2.gz FPOOSFAKONBGHB-MDOVXXIYSA-N 0 3 410.967 4.031 20 0 HIADHN COc1cc2c(cc1OC)[C@@H](NCc1cc(Br)c(OC)c(OC)c1)CC2 ZINC000479413720 894722089 /nfs/dbraw/zinc/72/20/89/894722089.db2.gz WEKLDAMACIWOMK-INIZCTEOSA-N 0 3 422.319 4.261 20 0 HIADHN Cc1cc(C)c(S(N)(=O)=O)cc1[C@@H](C)N[C@@H]1CCc2c1cccc2Br ZINC000479419555 894731287 /nfs/dbraw/zinc/73/12/87/894731287.db2.gz QBCBPZNSDSOBJU-FZKQIMNGSA-N 0 3 423.376 4.051 20 0 HIADHN CCc1nc2c(s1)[C@H](N(C)C(=O)N[C@H]1CCCN(Cc3ccccc3)C1)CCC2 ZINC000479426653 894739540 /nfs/dbraw/zinc/73/95/40/894739540.db2.gz RNQDTWRWCYFZEQ-AZUAARDMSA-N 0 3 412.603 4.389 20 0 HIADHN CCN(CC)[C@H](C)CN[C@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000479469950 894793778 /nfs/dbraw/zinc/79/37/78/894793778.db2.gz JPUNSIGGLAETQA-IIBYNOLFSA-N 0 3 408.995 4.153 20 0 HIADHN COc1ccc([C@H](CCO)N[C@@H](C)c2ccc(I)cc2)cc1 ZINC000479484407 894807145 /nfs/dbraw/zinc/80/71/45/894807145.db2.gz HZCCLZCAKJRPGW-UGSOOPFHSA-N 0 3 411.283 4.074 20 0 HIADHN O=C1Nc2ccccc2C12CCC(N[C@H](CO)c1ccccc1OC(F)(F)F)CC2 ZINC000479542718 894844513 /nfs/dbraw/zinc/84/45/13/894844513.db2.gz KBVHKSGWMMBSIC-TUVDCLKLSA-N 0 3 420.431 4.041 20 0 HIADHN CCc1nc2c(s1)[C@@H](N(C)C(=O)NC[C@H]1CCCN1Cc1ccccc1)CCC2 ZINC000479547171 894847447 /nfs/dbraw/zinc/84/74/47/894847447.db2.gz XWALPSCPQKXOSF-QUCCMNQESA-N 0 3 412.603 4.389 20 0 HIADHN Cc1ccc([C@H](OC[C@@H](O)CN(C)[C@H](CO)c2ccccc2)c2ccccc2)cc1 ZINC000479669658 894946812 /nfs/dbraw/zinc/94/68/12/894946812.db2.gz ZECIANGCQAQFGV-JIMJEQGWSA-N 0 3 405.538 4.127 20 0 HIADHN COCC[C@@H](NC(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1)c1ccc(C)o1 ZINC000479680424 894964749 /nfs/dbraw/zinc/96/47/49/894964749.db2.gz XKPQQZUDWHUZHR-WIYYLYMNSA-N 0 3 424.463 4.236 20 0 HIADHN COc1ccccc1SCC(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000479696604 894987113 /nfs/dbraw/zinc/98/71/13/894987113.db2.gz YHDSFHHDAUHXTB-UHFFFAOYSA-N 0 3 402.585 4.017 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)NC[C@@H]2CCCC[C@@H]2C(F)(F)F)c1 ZINC000479708826 895004742 /nfs/dbraw/zinc/00/47/42/895004742.db2.gz XBMDXLSPQNEZCZ-HKUYNNGSSA-N 0 3 415.500 4.137 20 0 HIADHN Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)NC(=O)c1oc2ccccc2c1CN(C)C ZINC000479729417 895027569 /nfs/dbraw/zinc/02/75/69/895027569.db2.gz PTHNRKIOMOBEOI-LBPRGKRZSA-N 0 3 422.451 4.361 20 0 HIADHN C[C@H](NC(=O)NC1(c2cc(C(F)(F)F)ccc2Cl)CC1)C1=CCN(C)CC1 ZINC000479738915 895038327 /nfs/dbraw/zinc/03/83/27/895038327.db2.gz FNVKBYMXNGMRJB-LBPRGKRZSA-N 0 3 401.860 4.298 20 0 HIADHN C[C@@H](CN(C(=O)N[C@H](CN1CCCC1)c1ccccc1)[C@@H](C)CO)c1ccccc1 ZINC000479758161 895057818 /nfs/dbraw/zinc/05/78/18/895057818.db2.gz RSHJDXVGXAMOND-AWRGLXIESA-N 0 3 409.574 4.020 20 0 HIADHN Cc1ccc(-c2nnc(-c3ccc(C(=O)NCCN4CCC[C@H](C)C4)cc3)o2)cc1 ZINC000479771432 895072743 /nfs/dbraw/zinc/07/27/43/895072743.db2.gz GSLQTBWKQSAPAA-SFHVURJKSA-N 0 3 404.514 4.174 20 0 HIADHN CCCOc1ccc([C@@H](C)NC(=O)N[C@@H](CN(C)C)c2ccc(F)cc2)cc1OC ZINC000479809885 895117097 /nfs/dbraw/zinc/11/70/97/895117097.db2.gz DJVSPUDVYAZVMG-UZLBHIALSA-N 0 3 417.525 4.286 20 0 HIADHN C[C@@H](NC[C@@H](c1ccco1)N1CCCC1)c1ccccc1I ZINC000479853180 895186746 /nfs/dbraw/zinc/18/67/46/895186746.db2.gz PDIOYIHGLHPREA-PBHICJAKSA-N 0 3 410.299 4.372 20 0 HIADHN COc1ccccc1C[C@@H]1CCCN1Cc1csc(-c2ccc(C(N)=O)cc2)n1 ZINC000479863732 895201084 /nfs/dbraw/zinc/20/10/84/895201084.db2.gz KRPDSEIYPAZLFF-FQEVSTJZSA-N 0 3 407.539 4.125 20 0 HIADHN CC(C)(C)OC(=O)c1cccc(CNCc2ccc(Cn3ccccc3=O)cc2)c1 ZINC000479951759 895305500 /nfs/dbraw/zinc/30/55/00/895305500.db2.gz VJACXHKLPVYRFI-UHFFFAOYSA-N 0 3 404.510 4.142 20 0 HIADHN Cc1cccc2nc(N3CCC(C(=O)NCCN(C)Cc4ccccc4)CC3)sc21 ZINC000480015328 895364624 /nfs/dbraw/zinc/36/46/24/895364624.db2.gz NIYANXVFELUBKH-UHFFFAOYSA-N 0 3 422.598 4.069 20 0 HIADHN CC[C@@H](c1ccccc1)[C@H]1CCCN1CC(=O)NCC(=O)Nc1c(C)cc(C)cc1C ZINC000480078690 895433383 /nfs/dbraw/zinc/43/33/83/895433383.db2.gz ZEYVLBCREXEFNN-XZOQPEGZSA-N 0 3 421.585 4.325 20 0 HIADHN C[C@@H](NC[C@@H](c1ccc(F)cc1)N1CCOCC1)c1ccc(F)cc1OC(F)F ZINC000480082189 895441630 /nfs/dbraw/zinc/44/16/30/895441630.db2.gz PQHHAEUBAMNLNV-KUHUBIRLSA-N 0 3 412.427 4.290 20 0 HIADHN CCCc1c(NC(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)cnn1-c1cc(C)ccn1 ZINC000480118778 895491295 /nfs/dbraw/zinc/49/12/95/895491295.db2.gz DEAUABHHTIHYEV-FDDCHVKYSA-N 0 3 420.561 4.341 20 0 HIADHN CCCc1c(NC(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)cnn1-c1cc(C)ccn1 ZINC000480118780 895491852 /nfs/dbraw/zinc/49/18/52/895491852.db2.gz DEAUABHHTIHYEV-MBSDFSHPSA-N 0 3 420.561 4.341 20 0 HIADHN C[C@@H](CN[C@@H]1CCS(=O)(=O)c2ccc(Br)cc21)c1ccc(F)cc1 ZINC000480169552 895560688 /nfs/dbraw/zinc/56/06/88/895560688.db2.gz VKPPJQCETAJQQT-YVEFUNNKSA-N 0 3 412.324 4.200 20 0 HIADHN CC(C)[C@H](CN[C@H]1CCS(=O)(=O)c2ccc(Br)cc21)c1cccnc1 ZINC000480173096 895565159 /nfs/dbraw/zinc/56/51/59/895565159.db2.gz VFRHFIPEMFZUPJ-ROUUACIJSA-N 0 3 423.376 4.092 20 0 HIADHN CC[C@@H](CN[C@H]1CCS(=O)(=O)c2ccc(Br)cc21)c1ccccc1 ZINC000480195883 895593146 /nfs/dbraw/zinc/59/31/46/895593146.db2.gz ONGZZXUJHIPCCR-KSSFIOAISA-N 0 3 408.361 4.451 20 0 HIADHN CCS[C@@H]1CCCC[C@@H]1N[C@@H]1CCS(=O)(=O)c2ccc(Br)cc21 ZINC000480198224 895595695 /nfs/dbraw/zinc/59/56/95/895595695.db2.gz ONOHNRBPDUZDQC-OWCLPIDISA-N 0 3 418.422 4.322 20 0 HIADHN Brc1ccc([C@H](NCCc2c[nH]c3ncccc23)c2cncnc2)cc1 ZINC000480212588 895615609 /nfs/dbraw/zinc/61/56/09/895615609.db2.gz HPMJNEJTWBMOCA-IBGZPJMESA-N 0 3 408.303 4.037 20 0 HIADHN CCN(CC)C(=O)c1ccc(CN[C@@H](C)c2cc(OC)c(OC)c(OC)c2)cc1 ZINC000480218138 895623704 /nfs/dbraw/zinc/62/37/04/895623704.db2.gz NTAVFROTXHJWRA-INIZCTEOSA-N 0 3 400.519 4.045 20 0 HIADHN C[C@@H](NCc1ccc(CN2C[C@@H](C)O[C@@H](C)C2)cc1)c1cccc(N2CCCC2=O)c1 ZINC000480225432 895629486 /nfs/dbraw/zinc/62/94/86/895629486.db2.gz KMHXIVIXGVPQMC-QHAWAJNXSA-N 0 3 421.585 4.273 20 0 HIADHN O=S1(=O)CC[C@H](NCC2(c3ccccc3)CCC2)c2cc(Br)ccc21 ZINC000480231389 895636570 /nfs/dbraw/zinc/63/65/70/895636570.db2.gz XOIKGTDZZXTCSH-SFHVURJKSA-N 0 3 420.372 4.379 20 0 HIADHN CNS(=O)(=O)c1ccc([C@@H](C)N[C@@H](C)c2ccc(-c3csc(C)n3)cc2)cc1 ZINC000480235237 895641698 /nfs/dbraw/zinc/64/16/98/895641698.db2.gz YEFYRVOULOEFMK-LSDHHAIUSA-N 0 3 415.584 4.438 20 0 HIADHN COc1ccc2c(c1)[C@@H](NCc1ccc(CN3C[C@@H](C)O[C@@H](C)C3)cc1)CCCO2 ZINC000480241885 895650687 /nfs/dbraw/zinc/65/06/87/895650687.db2.gz QQJCKUBKMOBFOG-GLDPYIMESA-N 0 3 410.558 4.308 20 0 HIADHN C[C@@H](NC[C@@H](c1ccc(C(F)(F)F)cc1)N1CCOCC1)c1ccc(Cl)cn1 ZINC000480244656 895654789 /nfs/dbraw/zinc/65/47/89/895654789.db2.gz YFAXWWDWJQQADA-KUHUBIRLSA-N 0 3 413.871 4.478 20 0 HIADHN C[C@H](NC[C@@H](c1ccsc1)N(C)C)c1ccccc1I ZINC000480245445 895656264 /nfs/dbraw/zinc/65/62/64/895656264.db2.gz IQUUTZCCRHPZBB-LRDDRELGSA-N 0 3 400.329 4.306 20 0 HIADHN COCc1ccccc1CN[C@@H]1CCCOc2ccc(I)cc21 ZINC000480276535 895682765 /nfs/dbraw/zinc/68/27/65/895682765.db2.gz UHLNTCNKBGRCKY-GOSISDBHSA-N 0 3 423.294 4.441 20 0 HIADHN O=S1(=O)CC[C@@H](NC2(Cc3ccccc3)CCC2)c2cc(Br)ccc21 ZINC000480301319 895705409 /nfs/dbraw/zinc/70/54/09/895705409.db2.gz NUVFTISSGKGCRS-GOSISDBHSA-N 0 3 420.372 4.423 20 0 HIADHN Cc1cc(-c2nc(C3CC3)no2)ccc1NC(=O)N[C@H](CN(C)C)c1ccc(F)cc1 ZINC000480302691 895707186 /nfs/dbraw/zinc/70/71/86/895707186.db2.gz USECRPJGJWIQSZ-HXUWFJFHSA-N 0 3 423.492 4.486 20 0 HIADHN CCN1CC[C@@H](NCc2ccc(Br)o2)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000480304356 895708432 /nfs/dbraw/zinc/70/84/32/895708432.db2.gz ACKNIXODJAZQMV-RHSMWYFYSA-N 0 3 403.242 4.385 20 0 HIADHN CCCN(CCN1CCCC1)C(=O)Nc1cnn(-c2ccccc2)c1C(F)(F)F ZINC000480319116 895722060 /nfs/dbraw/zinc/72/20/60/895722060.db2.gz MLXOCINBWAFCJM-UHFFFAOYSA-N 0 3 409.456 4.231 20 0 HIADHN O=C(C1CCCCC1)N1CC[C@H](NCc2cc(Br)c(Cl)s2)C1 ZINC000480358417 895765029 /nfs/dbraw/zinc/76/50/29/895765029.db2.gz QLXUJZUMQWBYGC-LBPRGKRZSA-N 0 3 405.789 4.435 20 0 HIADHN Cc1nn(-c2ccccc2)cc1NC(=O)NC[C@@H](c1ccc(OC(C)C)cc1)N(C)C ZINC000480361691 895767872 /nfs/dbraw/zinc/76/78/72/895767872.db2.gz CFSCOBBQIFEUOJ-QHCPKHFHSA-N 0 3 421.545 4.392 20 0 HIADHN Brc1ccc(CN[C@H]2CCN(c3ccc(Br)cc3)C2)o1 ZINC000480362072 895769714 /nfs/dbraw/zinc/76/97/14/895769714.db2.gz XTVKGWVVTFRIQH-LBPRGKRZSA-N 0 3 400.114 4.173 20 0 HIADHN COCCN(C)c1ccc(CNCc2ccc(-c3ccc4c(c3)CCCO4)cc2)cn1 ZINC000480363670 895770402 /nfs/dbraw/zinc/77/04/02/895770402.db2.gz KWCAVOMZVXVFRU-UHFFFAOYSA-N 0 3 417.553 4.446 20 0 HIADHN Cc1cc(Br)ccc1NC(=O)CCNCc1ccc(N(C)C(C)C)nc1 ZINC000480372481 895779604 /nfs/dbraw/zinc/77/96/04/895779604.db2.gz REXZTISLOMFNSD-UHFFFAOYSA-N 0 3 419.367 4.116 20 0 HIADHN CC(C)c1cccc(C(C)C)c1NC(=O)N1CC[C@H](N2CCN(C)CC2)[C@H](C)C1 ZINC000480403905 895807042 /nfs/dbraw/zinc/80/70/42/895807042.db2.gz JVDGVLCZDAUTQH-KNQAVFIVSA-N 0 3 400.611 4.423 20 0 HIADHN COc1ccc([C@@H](C)N[C@H](CN2CCOCC2)c2ccccc2)cc1Br ZINC000480437662 895829607 /nfs/dbraw/zinc/82/96/07/895829607.db2.gz PGONZOQDTPERSP-OXQOHEQNSA-N 0 3 419.363 4.182 20 0 HIADHN COc1cc([C@H](C)N[C@@H](CN2CCOCC2)c2ccccc2)ccc1OC(F)F ZINC000480447088 895835624 /nfs/dbraw/zinc/83/56/24/895835624.db2.gz USPBNGLPPVTYES-LPHOPBHVSA-N 0 3 406.473 4.021 20 0 HIADHN COc1cc(Br)c(CNC[C@@](C)(Cc2ccccc2)[C@H](C)O)cc1OC ZINC000480448044 895836371 /nfs/dbraw/zinc/83/63/71/895836371.db2.gz VEPONCFIYAPQKI-YCRPNKLZSA-N 0 3 422.363 4.186 20 0 HIADHN C[C@H](O)[C@@](C)(CNCc1csc(-c2ccc3c(c2)OCO3)n1)Cc1ccccc1 ZINC000480448639 895837847 /nfs/dbraw/zinc/83/78/47/895837847.db2.gz YHMPCHWPJZAJOZ-QMHKHESXSA-N 0 3 410.539 4.258 20 0 HIADHN Cc1sc2nc(CN3CCN(CCCCc4ccccc4)CC3)[nH]c(=O)c2c1C ZINC000480492202 895865305 /nfs/dbraw/zinc/86/53/05/895865305.db2.gz HGNAIDQNFZYSKZ-UHFFFAOYSA-N 0 3 410.587 4.154 20 0 HIADHN C[C@@H](Oc1ccc(Cl)cc1Cl)[C@H](C)NCc1cccnc1N1CCOCC1 ZINC000480533932 895896013 /nfs/dbraw/zinc/89/60/13/895896013.db2.gz CYUCYLUPSZVMJH-LSDHHAIUSA-N 0 3 410.345 4.171 20 0 HIADHN C[C@@H](NCCCN1C(=O)NC2(CCCCC2)C1=O)c1cc(Cl)sc1Cl ZINC000480537170 895899598 /nfs/dbraw/zinc/89/95/98/895899598.db2.gz NDDJTTYTYXJEBK-LLVKDONJSA-N 0 3 404.363 4.350 20 0 HIADHN CCCOc1ccc(CN[C@H](C)c2ccc(NS(=O)(=O)CC)cc2)cc1OC ZINC000480549913 895910723 /nfs/dbraw/zinc/91/07/23/895910723.db2.gz GCFMGXCIVQRGMK-MRXNPFEDSA-N 0 3 406.548 4.096 20 0 HIADHN C[C@H](NCc1ccc(C(=O)N2CCN(C)CC2)cc1)c1cc(Cl)cc(Cl)c1 ZINC000480609454 895975633 /nfs/dbraw/zinc/97/56/33/895975633.db2.gz LERWZYKTRQBCHI-HNNXBMFYSA-N 0 3 406.357 4.232 20 0 HIADHN CC[C@@H](NCc1ccc(N2CCO[C@H](C)C2)nc1)c1cccc(Br)c1 ZINC000480619714 895988088 /nfs/dbraw/zinc/98/80/88/895988088.db2.gz XTORBYNMBRVTHI-DNVCBOLYSA-N 0 3 404.352 4.310 20 0 HIADHN CCCCOc1ccc([C@H](C)NCc2ccc(N3CCO[C@H](C)C3)nc2)cc1OC ZINC000480622267 895989303 /nfs/dbraw/zinc/98/93/03/895989303.db2.gz GDLVVKUIFUHSGF-MOPGFXCFSA-N 0 3 413.562 4.345 20 0 HIADHN CC[C@@H](NCc1ccc(N2CCO[C@@H](C)C2)nc1)c1ccc(Br)cc1 ZINC000480629215 895997411 /nfs/dbraw/zinc/99/74/11/895997411.db2.gz DKFOXWJEPMRUPF-HNAYVOBHSA-N 0 3 404.352 4.310 20 0 HIADHN COc1cccc(C[C@@H](NCc2ccc(N3CCO[C@H](C)C3)nc2)c2ccccc2)c1 ZINC000480630765 895998458 /nfs/dbraw/zinc/99/84/58/895998458.db2.gz LHMKEXSTKFDMJP-CJFMBICVSA-N 0 3 417.553 4.389 20 0 HIADHN CC(C)NC(=O)Nc1ccc([C@@H](C)NCc2ccnc(OCC(F)(F)F)c2)cc1 ZINC000480636162 896006016 /nfs/dbraw/zinc/00/60/16/896006016.db2.gz XPCLSSRDLMIGFW-CQSZACIVSA-N 0 3 410.440 4.403 20 0 HIADHN C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000480638137 896006936 /nfs/dbraw/zinc/00/69/36/896006936.db2.gz QWLWNUGOHLFSAT-CRAIPNDOSA-N 0 3 415.525 4.473 20 0 HIADHN C[C@H]1C[C@@H](N(C)S(=O)(=O)Cc2ccc(Cl)c(F)c2)CCN1Cc1ccccc1 ZINC000480639123 896008869 /nfs/dbraw/zinc/00/88/69/896008869.db2.gz KZGXFGGJSPKLEH-LPHOPBHVSA-N 0 3 424.969 4.294 20 0 HIADHN Cc1cc(NC(=O)Nc2ccc(CCN3CCSCC3)cc2)nn1[C@H](C)C1CC1 ZINC000480640974 896010908 /nfs/dbraw/zinc/01/09/08/896010908.db2.gz WPCCCERWZZCQIP-QGZVFWFLSA-N 0 3 413.591 4.398 20 0 HIADHN FC(F)(F)c1cnn(-c2cccc(NC3CCN(Cc4ccncc4)CC3)c2)c1 ZINC000480671226 896034184 /nfs/dbraw/zinc/03/41/84/896034184.db2.gz XGYLVYUKHGCVRD-UHFFFAOYSA-N 0 3 401.436 4.363 20 0 HIADHN C[C@@H](NCc1ccnc(N2CCN(C)CC2)c1)c1ccc(SCC(F)F)cc1 ZINC000480713135 896074913 /nfs/dbraw/zinc/07/49/13/896074913.db2.gz VHRPHTRBHVCYDG-MRXNPFEDSA-N 0 3 406.546 4.041 20 0 HIADHN COc1ccc2ccccc2c1-c1cc(CN2CCC[C@H](C(=O)NCC3CC3)C2)on1 ZINC000480723009 896082481 /nfs/dbraw/zinc/08/24/81/896082481.db2.gz ZPJBGUJMDLMVAV-IBGZPJMESA-N 0 3 419.525 4.242 20 0 HIADHN C[C@H](NCc1ccnc(N2CCN(C)CC2)c1)c1ccc(Oc2ccccc2)cc1 ZINC000480734488 896095966 /nfs/dbraw/zinc/09/59/66/896095966.db2.gz IRDSLXDHBDDMHD-FQEVSTJZSA-N 0 3 402.542 4.477 20 0 HIADHN Cc1ccc(C(=O)CCN2CCC(C(=O)N(Cc3ccccc3)C3CC3)CC2)cc1 ZINC000480736253 896096793 /nfs/dbraw/zinc/09/67/93/896096793.db2.gz GZASPMYYRWALAR-UHFFFAOYSA-N 0 3 404.554 4.471 20 0 HIADHN C[C@H](NCCCCN1C(=O)NC2(CCCC2)C1=O)c1nc(-c2ccccc2)cs1 ZINC000480752099 896115362 /nfs/dbraw/zinc/11/53/62/896115362.db2.gz XGKXZRIHOHBBFM-INIZCTEOSA-N 0 3 412.559 4.106 20 0 HIADHN CNS(=O)(=O)c1ccc([C@@H](C)NCc2ccc(COCc3ccccc3)cc2)cc1 ZINC000480752072 896115849 /nfs/dbraw/zinc/11/58/49/896115849.db2.gz WWQFNWZTEAQLMG-LJQANCHMSA-N 0 3 424.566 4.162 20 0 HIADHN C[C@H](N[C@H](c1cc(F)cc(Br)c1)C1CC1)c1ccc(-n2cnnn2)cc1 ZINC000480758375 896119962 /nfs/dbraw/zinc/11/99/62/896119962.db2.gz NMRQMZIORGWIEL-BUXKBTBVSA-N 0 3 416.298 4.366 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N2CCC[C@H]2c2ccc3c(c2)OCO3)N2CCCC2)cc1 ZINC000480797263 896164121 /nfs/dbraw/zinc/16/41/21/896164121.db2.gz ZVQQTNOPKIYJSL-FCHUYYIVSA-N 0 3 421.541 4.407 20 0 HIADHN C[C@@H](NCc1cccc(NC(=O)Cn2cccn2)c1)c1cccc(-c2ccncc2)c1 ZINC000480875002 896233494 /nfs/dbraw/zinc/23/34/94/896233494.db2.gz GHENAQOIYBJYLO-LJQANCHMSA-N 0 3 411.509 4.435 20 0 HIADHN COc1cccc(C[C@H](NCc2ccc(CS(C)(=O)=O)cc2)c2ccccc2)c1 ZINC000480891904 896248143 /nfs/dbraw/zinc/24/81/43/896248143.db2.gz XTMKTIUIUNRGLT-DEOSSOPVSA-N 0 3 409.551 4.313 20 0 HIADHN C[C@H](NCCCS(=O)(=O)Cc1ccccc1)c1cccc(OC(F)(F)F)c1 ZINC000480893734 896250141 /nfs/dbraw/zinc/25/01/41/896250141.db2.gz DGXOBSPNAGZAOZ-HNNXBMFYSA-N 0 3 401.450 4.241 20 0 HIADHN COc1cc(CN[C@@H](Cc2cccc(F)c2)c2cccc(F)c2)ccc1OCCO ZINC000480907062 896263270 /nfs/dbraw/zinc/26/32/70/896263270.db2.gz YSCSFXRYNMJDLG-QFIPXVFZSA-N 0 3 413.464 4.418 20 0 HIADHN CNS(=O)(=O)c1cccc(CN[C@H](Cc2ccccc2)c2sccc2C)c1 ZINC000481027542 896356753 /nfs/dbraw/zinc/35/67/53/896356753.db2.gz VVRHIQLHEUIPEU-HXUWFJFHSA-N 0 3 400.569 4.038 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)NCc1csc(Br)c1)c1ccco1 ZINC000481092814 896414070 /nfs/dbraw/zinc/41/40/70/896414070.db2.gz NISLSNZVVCNJKD-AAEUAGOBSA-N 0 3 400.342 4.032 20 0 HIADHN Cc1c([C@H](C)NC[C@H](O)COCC(C)C)cnn1-c1ccc(Cl)cc1Cl ZINC000481165187 896497660 /nfs/dbraw/zinc/49/76/60/896497660.db2.gz CWMYRWVZPKUOOB-BBRMVZONSA-N 0 3 400.350 4.172 20 0 HIADHN C[C@@H]1Cc2ccccc2[C@H]1NCc1cccc(S(=O)(=O)NCc2cccc(F)c2)c1 ZINC000481189372 896538093 /nfs/dbraw/zinc/53/80/93/896538093.db2.gz MRVJZOFGYIQOPL-OSPHWJPCSA-N 0 3 424.541 4.327 20 0 HIADHN C[C@H](NCc1ccccc1OCCN1CCOCC1)c1cc2c(s1)CCCC2 ZINC000481193227 896546241 /nfs/dbraw/zinc/54/62/41/896546241.db2.gz TZKJVUWBCPORMA-SFHVURJKSA-N 0 3 400.588 4.189 20 0 HIADHN COc1ccccc1-c1ccc([C@@H](C)NCc2cccnc2N2CCN(C)CC2)cc1 ZINC000481203706 896556299 /nfs/dbraw/zinc/55/62/99/896556299.db2.gz CBDAQLBPJDDYGB-HXUWFJFHSA-N 0 3 416.569 4.360 20 0 HIADHN CCS(=O)(=O)Nc1ccc([C@H](C)NCc2ccc(OC3CCCC3)nc2)cc1 ZINC000481310054 896658320 /nfs/dbraw/zinc/65/83/20/896658320.db2.gz PDHYLSKFMHAIKL-INIZCTEOSA-N 0 3 403.548 4.015 20 0 HIADHN Fc1ccc(N2CCN(c3cc(CN[C@@H]4CCc5cc(F)ccc54)ccn3)CC2)cc1 ZINC000481313098 896659968 /nfs/dbraw/zinc/65/99/68/896659968.db2.gz IYYLLPDFSMTCJG-XMMPIXPASA-N 0 3 420.507 4.464 20 0 HIADHN Cc1ccc(NC(=O)C(C)(C)C)cc1NC(=O)NC[C@@H](Cc1ccccc1)N(C)C ZINC000481312822 896660290 /nfs/dbraw/zinc/66/02/90/896660290.db2.gz GLFRXHBZIGMAFF-HXUWFJFHSA-N 0 3 410.562 4.274 20 0 HIADHN C[C@H](N[C@H]1CCSc2c(F)cccc21)c1ccc(OCC(=O)NC2CC2)cc1 ZINC000481313719 896661477 /nfs/dbraw/zinc/66/14/77/896661477.db2.gz SUIURCQRWIXYEL-XOBRGWDASA-N 0 3 400.519 4.371 20 0 HIADHN C[C@@H](N[C@@H]1CCSc2ccc(F)cc21)c1ccc(OCC(=O)NC2CC2)cc1 ZINC000481316549 896666840 /nfs/dbraw/zinc/66/68/40/896666840.db2.gz ANYMUPAEWSMTSB-JLTOFOAXSA-N 0 3 400.519 4.371 20 0 HIADHN Fc1ccc(N2CCN(c3cc(CN[C@@H]4CCc5c4cccc5F)ccn3)CC2)cc1 ZINC000481316463 896667679 /nfs/dbraw/zinc/66/76/79/896667679.db2.gz HHNHPSMSMBYSCF-XMMPIXPASA-N 0 3 420.507 4.464 20 0 HIADHN Fc1ccc(N2CCN(c3cc(CN[C@@H]4CCc5ccc(F)cc54)ccn3)CC2)cc1 ZINC000481325676 896680264 /nfs/dbraw/zinc/68/02/64/896680264.db2.gz WMQZEMZAMPNBOU-XMMPIXPASA-N 0 3 420.507 4.464 20 0 HIADHN CC[C@@H](N[C@H]1CCc2ccc(OC)cc21)c1ccccc1OCC(=O)N1CCCC1 ZINC000481336064 896698185 /nfs/dbraw/zinc/69/81/85/896698185.db2.gz MEXWEJCGGRSZGB-PKTZIBPZSA-N 0 3 408.542 4.425 20 0 HIADHN CC[C@H](N[C@H]1CCc2ccc(OC)cc21)c1ccccc1OCC(=O)N1CCCC1 ZINC000481336063 896698543 /nfs/dbraw/zinc/69/85/43/896698543.db2.gz MEXWEJCGGRSZGB-GOTSBHOMSA-N 0 3 408.542 4.425 20 0 HIADHN CC[C@H]1[C@@H](C)CCN1CC(=O)N(Cc1nnc(-c2ccccc2Cl)o1)C1CC1 ZINC000481374775 896768302 /nfs/dbraw/zinc/76/83/02/896768302.db2.gz OKMKPONLITVNRV-KSSFIOAISA-N 0 3 402.926 4.001 20 0 HIADHN COC(=O)[C@@H]1CCCCCC[C@H]1NCC(=O)Nc1c(Cl)cccc1C(F)(F)F ZINC000481430373 896830774 /nfs/dbraw/zinc/83/07/74/896830774.db2.gz GJRRJCZKJDKXDE-IUODEOHRSA-N 0 3 420.859 4.399 20 0 HIADHN COc1ccc([C@H](CNC(=O)Nc2ccnn2[C@@H](C)CC(C)C)N2CCCC2)cc1 ZINC000481452096 896847893 /nfs/dbraw/zinc/84/78/93/896847893.db2.gz SLMMOQZMIRTRKY-RXVVDRJESA-N 0 3 413.566 4.457 20 0 HIADHN CC(C)C[C@H](C)n1nccc1NC(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000481489524 896870151 /nfs/dbraw/zinc/87/01/51/896870151.db2.gz HTYNDKJGDCRNPE-SLFFLAALSA-N 0 3 419.614 4.233 20 0 HIADHN CC(C)N(C)S(=O)(=O)c1ccc(CN[C@@H](C)c2ccc(OC(F)F)cc2)cc1 ZINC000481539600 896898742 /nfs/dbraw/zinc/89/87/42/896898742.db2.gz DRKWYDQOCZYEHZ-HNNXBMFYSA-N 0 3 412.502 4.168 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1nnc(-c2cccc(Cl)c2)s1 ZINC000481544694 896904532 /nfs/dbraw/zinc/90/45/32/896904532.db2.gz MTAJXIHDSJBRPN-UHFFFAOYSA-N 0 3 405.911 4.047 20 0 HIADHN Cc1c([C@@H](C)NCC2(c3ccccc3C)CCOCC2)nnn1-c1ccc(F)cc1 ZINC000481548376 896912694 /nfs/dbraw/zinc/91/26/94/896912694.db2.gz UHSMBSOLFLOSGS-GOSISDBHSA-N 0 3 408.521 4.422 20 0 HIADHN COc1ccccc1NC(=O)c1ccc(NC(=O)[C@@H](C)N2CCCC[C@H](C)C2)cc1 ZINC000481579790 896959549 /nfs/dbraw/zinc/95/95/49/896959549.db2.gz IPPIUMXVNXNOBA-ZWKOTPCHSA-N 0 3 409.530 4.397 20 0 HIADHN OC1(Cc2ccc(F)cc2)CCN(Cc2ccc(OCc3ccccn3)cc2)CC1 ZINC000481589827 896968766 /nfs/dbraw/zinc/96/87/66/896968766.db2.gz BKWURAYSNZDCEA-UHFFFAOYSA-N 0 3 406.501 4.369 20 0 HIADHN Cc1cc(NC(=O)Cc2coc(-c3ccccc3)n2)cc(N2CCN(C(C)C)CC2)c1 ZINC000481664505 897048215 /nfs/dbraw/zinc/04/82/15/897048215.db2.gz BKQYMZZORIVBSE-UHFFFAOYSA-N 0 3 418.541 4.362 20 0 HIADHN CC(=O)Nc1ccc(C)c(C(=O)Nc2cc(C)cc(N3CCN(C(C)C)CC3)c2)c1 ZINC000481666616 897049866 /nfs/dbraw/zinc/04/98/66/897049866.db2.gz JFOBALHMVBTSRQ-UHFFFAOYSA-N 0 3 408.546 4.045 20 0 HIADHN Cc1cc(NC(=O)Cc2csc(-c3ccoc3)n2)cc(N2CCN(C(C)C)CC2)c1 ZINC000481669217 897053865 /nfs/dbraw/zinc/05/38/65/897053865.db2.gz NGSIDXLGTUAAKX-UHFFFAOYSA-N 0 3 424.570 4.423 20 0 HIADHN CCOC(=O)C[C@@](C)(NCC(=O)Nc1cccc(-c2csc(C)n2)c1)C(C)C ZINC000481688602 897073553 /nfs/dbraw/zinc/07/35/53/897073553.db2.gz SKTQJXUZSCUDTP-OAQYLSRUSA-N 0 3 403.548 4.015 20 0 HIADHN COc1ccc(COC[C@@H](O)CN2CC=C(c3cccc(Cl)c3)CC2)cc1OC ZINC000481781284 897164126 /nfs/dbraw/zinc/16/41/26/897164126.db2.gz BTFVZQXTWAGCJU-NRFANRHFSA-N 0 3 417.933 4.024 20 0 HIADHN C[C@@H](NC(=O)N(C)C1CCN(CCc2ccccn2)CC1)[C@H](C)C1CCCCC1 ZINC000481783496 897165718 /nfs/dbraw/zinc/16/57/18/897165718.db2.gz GEZSHFJLJRWJAF-VQTJNVASSA-N 0 3 400.611 4.335 20 0 HIADHN OC[C@H](CNCc1c(Cl)cccc1OCc1ccccc1Cl)[C@H]1CCOC1 ZINC000481815888 897189591 /nfs/dbraw/zinc/18/95/91/897189591.db2.gz PWDIZMFUWSRMIS-RDJZCZTQSA-N 0 3 410.341 4.307 20 0 HIADHN Cc1cc(CN2CCC(c3nnc4n3CCCC4)CC2)nc(-c2ccc(Cl)cc2)n1 ZINC000481826126 897197123 /nfs/dbraw/zinc/19/71/23/897197123.db2.gz UNDNRUBLCCIAAZ-UHFFFAOYSA-N 0 3 422.964 4.413 20 0 HIADHN O=C(NCC1(c2cccc(Cl)c2F)CCCC1)[C@H]1CCCN1C1CCOCC1 ZINC000481863568 897232211 /nfs/dbraw/zinc/23/22/11/897232211.db2.gz DIWGTGRJSRVFLK-LJQANCHMSA-N 0 3 408.945 4.051 20 0 HIADHN COC(=O)c1ccccc1-c1ccc(CN2CCC(C(=O)N[C@@H](C)C(C)C)CC2)o1 ZINC000481983323 897377224 /nfs/dbraw/zinc/37/72/24/897377224.db2.gz KCASMIZNLPVIIA-KRWDZBQOSA-N 0 3 412.530 4.106 20 0 HIADHN O=C1C[C@@H](N[C@H](c2cccnc2)C2CCC2)CN1Cc1ccccc1C(F)(F)F ZINC000481992027 897387767 /nfs/dbraw/zinc/38/77/67/897387767.db2.gz MWYUWZGXJHPJNE-NQIIRXRSSA-N 0 3 403.448 4.332 20 0 HIADHN O=C1C[C@H](N[C@H](c2cccnc2)C2CCC2)CN1Cc1ccccc1C(F)(F)F ZINC000481992029 897387994 /nfs/dbraw/zinc/38/79/94/897387994.db2.gz MWYUWZGXJHPJNE-RXVVDRJESA-N 0 3 403.448 4.332 20 0 HIADHN COc1ccc(-c2ccncc2)cc1CN1CCC(NC(=O)C2CCCCC2)CC1 ZINC000481995441 897392119 /nfs/dbraw/zinc/39/21/19/897392119.db2.gz XSAKUTPBTZTAPL-UHFFFAOYSA-N 0 3 407.558 4.418 20 0 HIADHN COC(=O)c1ccccc1-c1ccc(CN2CCC[C@H](CNC(=O)C(C)(C)C)C2)o1 ZINC000482005244 897402876 /nfs/dbraw/zinc/40/28/76/897402876.db2.gz JTNNDAYOWUIYDP-QGZVFWFLSA-N 0 3 412.530 4.108 20 0 HIADHN Cc1cc(NC(=O)Cc2ccc(O)cc2Cl)cc(N2CCN(C(C)C)CC2)c1 ZINC000482026537 897434354 /nfs/dbraw/zinc/43/43/54/897434354.db2.gz PKTCTQLTQCTFDF-UHFFFAOYSA-N 0 3 401.938 4.066 20 0 HIADHN CC1(C)CN(C(=O)CCCN2CCN(c3ccccc3)CC2)CC[C@H]1C(F)(F)F ZINC000482048456 897472645 /nfs/dbraw/zinc/47/26/45/897472645.db2.gz NOHSCZCPKCBEGU-LJQANCHMSA-N 0 3 411.512 4.026 20 0 HIADHN COC(=O)c1ccccc1-c1ccc(CN[C@H]2CCN(c3ncccc3Cl)C2)o1 ZINC000482057062 897485222 /nfs/dbraw/zinc/48/52/22/897485222.db2.gz SRVJVPYTNZVQQS-HNNXBMFYSA-N 0 3 411.889 4.150 20 0 HIADHN COc1cc([C@H](C)NC2CC(F)(c3cccc(Cl)c3)C2)ccc1S(C)(=O)=O ZINC000482068462 897503156 /nfs/dbraw/zinc/50/31/56/897503156.db2.gz LRJQTMFNEVIRMR-BUJKVIAWSA-N 0 3 411.926 4.430 20 0 HIADHN C[C@@H](N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)c1cccc(OC(F)(F)F)c1 ZINC000482109607 897560515 /nfs/dbraw/zinc/56/05/15/897560515.db2.gz LPOFKPSXFVHUPC-UZLBHIALSA-N 0 3 406.448 4.470 20 0 HIADHN CC[C@H](NCc1ccc(NC(=O)c2cccnc2)cc1)c1ccc2c(c1)OCCO2 ZINC000482112248 897563088 /nfs/dbraw/zinc/56/30/88/897563088.db2.gz UREGEVFTKPRHPC-NRFANRHFSA-N 0 3 403.482 4.346 20 0 HIADHN O=C(CCc1ccc(Br)cc1)NC[C@@H](c1cccs1)N1CCCC1 ZINC000482154242 897617583 /nfs/dbraw/zinc/61/75/83/897617583.db2.gz CLHYQXVKGHPVSL-KRWDZBQOSA-N 0 3 407.377 4.397 20 0 HIADHN Cn1c(CN[C@H](CN2CCc3ccccc3C2)C(C)(C)C)nnc1-c1ccccc1 ZINC000482164176 897628453 /nfs/dbraw/zinc/62/84/53/897628453.db2.gz NOECGPANGZTKMB-JOCHJYFZSA-N 0 3 403.574 4.045 20 0 HIADHN CC1(C)C[C@H](NCC(=O)N2N=C(c3cccs3)C[C@@H]2c2cccs2)C(C)(C)O1 ZINC000482165393 897629830 /nfs/dbraw/zinc/62/98/30/897629830.db2.gz RHJZNNSBOIJBQJ-QAPCUYQASA-N 0 3 417.600 4.423 20 0 HIADHN COC(=O)c1ccc(-c2ccc(CN[C@@H]3CCN(C(=O)C4CCCCC4)C3)o2)cc1 ZINC000482212184 897693175 /nfs/dbraw/zinc/69/31/75/897693175.db2.gz PRRJMHJAUPPCSO-HXUWFJFHSA-N 0 3 410.514 4.004 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)N[C@H](C3CCCCC3)C(F)(F)F)CC2)C[C@@H](C)O1 ZINC000482265736 897750539 /nfs/dbraw/zinc/75/05/39/897750539.db2.gz HAGQLTPIZZERDE-GPMSIDNRSA-N 0 3 419.532 4.028 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)CCc2ccc(Br)cc2)CC1 ZINC000482307211 897805364 /nfs/dbraw/zinc/80/53/64/897805364.db2.gz KVAMHTWHAQVPEK-UHFFFAOYSA-N 0 3 405.336 4.098 20 0 HIADHN Cc1[nH]c2c(cc(C)cc2CN[C@@H](C)c2cccc(N3CCCS3(=O)=O)c2)c1C ZINC000482336820 897843276 /nfs/dbraw/zinc/84/32/76/897843276.db2.gz STFRPWAMEOYRLS-SFHVURJKSA-N 0 3 411.571 4.484 20 0 HIADHN O=C(N[C@@H](c1cccc(F)c1F)C(F)(F)F)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000482377879 897906408 /nfs/dbraw/zinc/90/64/08/897906408.db2.gz PTKMIZJNERQEEQ-KSSFIOAISA-N 0 3 413.390 4.142 20 0 HIADHN NC(=O)C1CCN(c2ncccc2CN[C@@H]2CCCc3c4ccccc4sc32)CC1 ZINC000482436794 897996207 /nfs/dbraw/zinc/99/62/07/897996207.db2.gz CNKCKFYNJFARGA-HXUWFJFHSA-N 0 3 420.582 4.165 20 0 HIADHN Cc1cc(NC(=O)CCc2ccc(F)cc2F)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000505522133 914211720 /nfs/dbraw/zinc/21/17/20/914211720.db2.gz BOTWGZCFLUVEOH-OAQYLSRUSA-N 0 3 424.495 4.488 20 0 HIADHN Cc1cc(C)n(-c2ccc(C(=O)N[C@H]3CCN([C@H](C)c4ccccc4)C3)cc2F)n1 ZINC000482476479 898054318 /nfs/dbraw/zinc/05/43/18/898054318.db2.gz INFMTTNPCDTMFB-NQIIRXRSSA-N 0 3 406.505 4.194 20 0 HIADHN COc1ccc(-c2ccncc2)cc1CN1CCC(c2nnc3n2CCCC3)CC1 ZINC000482493063 898071756 /nfs/dbraw/zinc/07/17/56/898071756.db2.gz FFRONNOREJOMJP-UHFFFAOYSA-N 0 3 403.530 4.065 20 0 HIADHN O=C(Nc1cc(F)ccc1OCC1CC1)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000482495186 898075095 /nfs/dbraw/zinc/07/50/95/898075095.db2.gz NHTGPJVQAYNMBG-UHFFFAOYSA-N 0 3 412.505 4.071 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)[C@@H]1CCCN(C(=O)c2ccc(Cl)cc2)C1 ZINC000482602050 898203166 /nfs/dbraw/zinc/20/31/66/898203166.db2.gz YUEBVAMKZZCNRM-LJQANCHMSA-N 0 3 413.949 4.201 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)[C@@H]1CCCN(c2ncccc2C(F)(F)F)C1 ZINC000482607761 898209003 /nfs/dbraw/zinc/20/90/03/898209003.db2.gz LDFDRIZBKVWZCA-QGZVFWFLSA-N 0 3 420.479 4.326 20 0 HIADHN CCCN(C(=O)NCCn1cnc2ccccc21)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000482609867 898210659 /nfs/dbraw/zinc/21/06/59/898210659.db2.gz YYJQEHHXZUBPSY-JOCHJYFZSA-N 0 3 419.573 4.123 20 0 HIADHN CC(C)CN(C(=O)NC[C@@H](Cc1ccccc1)N(C)C)[C@@H]1CCCc2cccnc21 ZINC000482634161 898236582 /nfs/dbraw/zinc/23/65/82/898236582.db2.gz IVQUPMVDCCHGSB-DHIUTWEWSA-N 0 3 408.590 4.300 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)CSc1nncn1-c1ccc(C(C)C)cc1 ZINC000482638155 898241840 /nfs/dbraw/zinc/24/18/40/898241840.db2.gz YWGXCICTDQKCPD-UHFFFAOYSA-N 0 3 423.586 4.492 20 0 HIADHN COCCOc1ccc(Cl)cc1C(=O)N1CCCN(Cc2ccccc2)C[C@H]1C ZINC000482672367 898274612 /nfs/dbraw/zinc/27/46/12/898274612.db2.gz MDNACEBUPJQHAV-GOSISDBHSA-N 0 3 416.949 4.102 20 0 HIADHN CC(C)c1nn(-c2ccc(Br)cc2)cc1CN[C@H](C)CC[S@](C)=O ZINC000482753202 898358759 /nfs/dbraw/zinc/35/87/59/898358759.db2.gz OMDOSLRHMKQLTI-SHACYNPGSA-N 0 3 412.397 4.005 20 0 HIADHN COc1cc(CN(C)Cc2ccc(C(C)C)cc2)ccc1OCC(=O)N1CCCC1 ZINC000505553741 914256063 /nfs/dbraw/zinc/25/60/63/914256063.db2.gz PVKBLJFNDXYFOX-UHFFFAOYSA-N 0 3 410.558 4.452 20 0 HIADHN C[C@@H](NCc1cccc(COC2CCOCC2)c1)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000482888061 898504548 /nfs/dbraw/zinc/50/45/48/898504548.db2.gz QMNDCXQVUYJRQH-QGZVFWFLSA-N 0 3 408.542 4.463 20 0 HIADHN C[C@H](NCc1cccc(COC2CCOCC2)c1)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000482888060 898504904 /nfs/dbraw/zinc/50/49/04/898504904.db2.gz QMNDCXQVUYJRQH-KRWDZBQOSA-N 0 3 408.542 4.463 20 0 HIADHN C[C@H]1CN(C(=O)Nc2ccc3c(c2)oc2ccccc23)CC[C@@H]1N1CCN(C)CC1 ZINC000482908413 898527787 /nfs/dbraw/zinc/52/77/87/898527787.db2.gz PNADYJSFYAAPQM-UWJYYQICSA-N 0 3 406.530 4.076 20 0 HIADHN Cc1cccc(CC2(O)CCN(C[C@H](O)COc3cc(Cl)ccc3Cl)CC2)c1 ZINC000482926060 898546546 /nfs/dbraw/zinc/54/65/46/898546546.db2.gz YMCSUVVSFPDQLS-IBGZPJMESA-N 0 3 424.368 4.111 20 0 HIADHN C[C@@H](OC[C@H](O)CN[C@@H](C)c1ccc(Br)cn1)c1ccc(Cl)cc1 ZINC000482961254 898591821 /nfs/dbraw/zinc/59/18/21/898591821.db2.gz OEPBHHTWKRBAEC-OGHNNQOOSA-N 0 3 413.743 4.287 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(S(=O)(=O)C2CCCC2)cc1)c1ccc(NC(N)=O)cc1 ZINC000482969021 898602551 /nfs/dbraw/zinc/60/25/51/898602551.db2.gz ZWKVILBGYCESGC-CVEARBPZSA-N 0 3 415.559 4.305 20 0 HIADHN COc1ccccc1-c1csc(C2CCN(C(=O)[C@H](C(C)C)N(C)C)CC2)n1 ZINC000483054213 898728317 /nfs/dbraw/zinc/72/83/17/898728317.db2.gz JMUOCWSAEUYDQO-FQEVSTJZSA-N 0 3 401.576 4.111 20 0 HIADHN C[C@H](NC(=O)[C@H]1CCn2c(cnc2C2CCCCC2)C1)[C@H](c1ccccc1)N(C)C ZINC000505580458 914287908 /nfs/dbraw/zinc/28/79/08/914287908.db2.gz GQTGZYXWGQUTPO-AVCGJXAMSA-N 0 3 408.590 4.301 20 0 HIADHN COc1cc(F)c([C@H](C)N[C@@H]2CCN(c3ccccc3OC(F)F)C2)cc1OC ZINC000483162025 898832715 /nfs/dbraw/zinc/83/27/15/898832715.db2.gz UTZUNUABCTWLBF-UONOGXRCSA-N 0 3 410.436 4.374 20 0 HIADHN CC[C@@H]1CN(CCC(=O)Nc2ccccc2Oc2ccccc2)C[C@@]2(CCOC2)O1 ZINC000483163115 898833655 /nfs/dbraw/zinc/83/36/55/898833655.db2.gz XUFILEGHIPOFSQ-NTKDMRAZSA-N 0 3 410.514 4.077 20 0 HIADHN CCN(Cc1nc(-c2ccc(F)c(C)c2)no1)CC1CCN(c2ccccn2)CC1 ZINC000483200371 898856039 /nfs/dbraw/zinc/85/60/39/898856039.db2.gz UJGMEIORROPULY-UHFFFAOYSA-N 0 3 409.509 4.318 20 0 HIADHN CC1(C)CN(CCC(=O)Nc2ccccc2Oc2ccccc2)C[C@@]2(CCOC2)O1 ZINC000483205284 898858885 /nfs/dbraw/zinc/85/88/85/898858885.db2.gz YOGFAZDADFCMEY-XMMPIXPASA-N 0 3 410.514 4.077 20 0 HIADHN C[C@@H](NC(=O)c1ccc(C(=O)Nc2ccccc2)cc1)[C@@H](c1ccccc1)N(C)C ZINC000505587801 914293082 /nfs/dbraw/zinc/29/30/82/914293082.db2.gz OYCMSROVTPKTQF-JPYJTQIMSA-N 0 3 401.510 4.360 20 0 HIADHN Cc1nc(CCN[C@H](CO)c2ccc(Br)cc2C(F)(F)F)cs1 ZINC000483250651 898892952 /nfs/dbraw/zinc/89/29/52/898892952.db2.gz ARUDEQQDWMJVMQ-CQSZACIVSA-N 0 3 409.271 4.099 20 0 HIADHN CC(C)(O)C(C)(C)NCC(=O)Nc1nc(-c2ccc(Cl)c(Cl)c2)cs1 ZINC000505589292 914295324 /nfs/dbraw/zinc/29/53/24/914295324.db2.gz ZOCJGOPEFFLFAW-UHFFFAOYSA-N 0 3 402.347 4.195 20 0 HIADHN CCOCCOc1c(Cl)cccc1NC(=O)N1CCN(C2CCCCC2)CC1 ZINC000483321826 898950016 /nfs/dbraw/zinc/95/00/16/898950016.db2.gz JIFLWPTXTUNHST-UHFFFAOYSA-N 0 3 409.958 4.238 20 0 HIADHN O=C(Nc1ccccc1)c1ccc(NC(=O)N2CCN(C3CCCCC3)CC2)cc1 ZINC000483323486 898952283 /nfs/dbraw/zinc/95/22/83/898952283.db2.gz NEPZMJKOCBFFQZ-UHFFFAOYSA-N 0 3 406.530 4.421 20 0 HIADHN CC(C)n1ncc2c1nc(C1CC1)cc2C(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C ZINC000505601209 914306304 /nfs/dbraw/zinc/30/63/04/914306304.db2.gz CSQLAMZMTHADRL-AOMKIAJQSA-N 0 3 405.546 4.311 20 0 HIADHN CS[C@H]1CN(C(=O)c2cc3cc(C)cc(Br)c3o2)C[C@@H]1N1CCCC1 ZINC000483400073 899032645 /nfs/dbraw/zinc/03/26/45/899032645.db2.gz CNMXWAFWMLGSLF-RDJZCZTQSA-N 0 3 423.376 4.156 20 0 HIADHN CCOc1cc(CN2CCSCC[C@H]2C)ccc1OCC(=O)N(C(C)C)C(C)C ZINC000483411056 899040767 /nfs/dbraw/zinc/04/07/67/899040767.db2.gz ANUOEUUVUBBCBU-LJQANCHMSA-N 0 3 422.635 4.437 20 0 HIADHN CO[C@@H](c1ccccc1Cl)[C@@H](C)NC(=O)N(CCN(C)C)Cc1cccs1 ZINC000483415366 899044661 /nfs/dbraw/zinc/04/46/61/899044661.db2.gz WIQKHCHIGXOQGM-DNVCBOLYSA-N 0 3 409.983 4.251 20 0 HIADHN COc1ccccc1-c1nc(C2CCN(Cc3cn(C)nc3C(C)(C)C)CC2)no1 ZINC000483430913 899060862 /nfs/dbraw/zinc/06/08/62/899060862.db2.gz YLINSLSXIQYDSA-UHFFFAOYSA-N 0 3 409.534 4.156 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1cc(F)c(OC(F)F)cc1F)c1ccco1 ZINC000483448931 899085178 /nfs/dbraw/zinc/08/51/78/899085178.db2.gz RZKRIYICUKWGLN-IINYFYTJSA-N 0 3 403.376 4.410 20 0 HIADHN CC(C)c1nccn1Cc1cccc(NC(=O)NCCN(C)Cc2ccc(F)cc2)c1 ZINC000483449383 899085374 /nfs/dbraw/zinc/08/53/74/899085374.db2.gz JQYPGJXOYOIZMP-UHFFFAOYSA-N 0 3 423.536 4.447 20 0 HIADHN CCS(=O)(=O)Nc1ccc([C@H](C)NCc2ccc(C(=O)OC(C)(C)C)cc2)cc1 ZINC000483456025 899093725 /nfs/dbraw/zinc/09/37/25/899093725.db2.gz QOVKMRVSXHJYIN-INIZCTEOSA-N 0 3 418.559 4.254 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)Nc1ccc(C)c(C(=O)N(C)C(C)C)c1 ZINC000483463709 899104871 /nfs/dbraw/zinc/10/48/71/899104871.db2.gz ZCPMQRJQNFDHHE-UHFFFAOYSA-N 0 3 402.583 4.205 20 0 HIADHN O=C(CN1CCN(C2CCCCC2)CC1)N(Cc1ccc(C(F)(F)F)cc1)C1CC1 ZINC000483487488 899140702 /nfs/dbraw/zinc/14/07/02/899140702.db2.gz GDTDQTBWBHAKBA-UHFFFAOYSA-N 0 3 423.523 4.147 20 0 HIADHN O=C(NCCN1CCCC1)c1ccc(NC(=O)c2ccc(F)c3ccccc23)cc1 ZINC000483533382 899193924 /nfs/dbraw/zinc/19/39/24/899193924.db2.gz PMTDERPZLBWBOY-UHFFFAOYSA-N 0 3 405.473 4.057 20 0 HIADHN Cc1ccccc1[C@H](NC(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1)C(C)C ZINC000483601848 899252966 /nfs/dbraw/zinc/25/29/66/899252966.db2.gz OWVQPFYXHHNMGM-ZRCGQRJVSA-N 0 3 401.595 4.223 20 0 HIADHN CCCN1CCN(c2ccccc2CN[C@@H](C)c2nc(Cc3ccccc3)no2)CC1 ZINC000483647566 899303379 /nfs/dbraw/zinc/30/33/79/899303379.db2.gz SYOAJTJHKPRVID-FQEVSTJZSA-N 0 3 419.573 4.043 20 0 HIADHN CCCN(CCC)C(=O)c1cccc(C(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)c1 ZINC000505634006 914334180 /nfs/dbraw/zinc/33/41/80/914334180.db2.gz QGMXMXMTGQXMOW-XXBNENTESA-N 0 3 409.574 4.370 20 0 HIADHN C[C@@H](NC(=O)c1cccc(C(=O)N(C)c2ccccc2)c1)[C@@H](c1ccccc1)N(C)C ZINC000505635295 914336543 /nfs/dbraw/zinc/33/65/43/914336543.db2.gz SEOJJVBOIFXTDK-DVECYGJZSA-N 0 3 415.537 4.384 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2ccc(F)cc2C(F)(F)F)c1 ZINC000483678565 899338559 /nfs/dbraw/zinc/33/85/59/899338559.db2.gz CPMLWNHPYZJGHA-UHFFFAOYSA-N 0 3 413.415 4.449 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)N[C@@H]1CCCc2c(O)cccc21 ZINC000483688556 899348462 /nfs/dbraw/zinc/34/84/62/899348462.db2.gz UHCBYRSKZQSLLO-OAQYLSRUSA-N 0 3 411.571 4.183 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2cc(C(F)(F)F)ccc2F)c1 ZINC000483709701 899365740 /nfs/dbraw/zinc/36/57/40/899365740.db2.gz GIURPPMNOIZTHR-UHFFFAOYSA-N 0 3 413.415 4.449 20 0 HIADHN CO[C@@H]1CCCC[C@H]1NCC(=O)N1N=C(c2cc3ccccc3o2)C[C@@H]1c1ccco1 ZINC000483723544 899382352 /nfs/dbraw/zinc/38/23/52/899382352.db2.gz KTEHKBDQHFCWAA-YFVAEKQCSA-N 0 3 421.497 4.251 20 0 HIADHN COc1cccc2c1[C@@H](C(=O)Nc1ccnn1[C@H]1CCN(Cc3ccccc3)C1)CC2 ZINC000483794834 899466445 /nfs/dbraw/zinc/46/64/45/899466445.db2.gz CITDNFBVCSDICG-SFTDATJTSA-N 0 3 416.525 4.007 20 0 HIADHN Cc1ccc(NC(=O)N2CCC(CN3C[C@H](C)O[C@@H](C)C3)CC2)cc1-c1ncco1 ZINC000483801478 899475632 /nfs/dbraw/zinc/47/56/32/899475632.db2.gz QUKQRTGXLZRHAO-ROUUACIJSA-N 0 3 412.534 4.003 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2ccc(F)cc2OCC2CC2)c1 ZINC000483811549 899490174 /nfs/dbraw/zinc/49/01/74/899490174.db2.gz XNKCSYNXOIVTID-UHFFFAOYSA-N 0 3 415.509 4.219 20 0 HIADHN COc1cccc([C@@H](CNC(=O)NC2(c3ccc(Cl)cc3)CC2)N2CCCC2)c1 ZINC000483849598 899531039 /nfs/dbraw/zinc/53/10/39/899531039.db2.gz VFWQPWQDCPALDR-OAQYLSRUSA-N 0 3 413.949 4.474 20 0 HIADHN Cc1c([C@@H](C)NC[C@@H](CCO)CC(C)C)nnn1-c1cccc(Br)c1 ZINC000483852342 899534306 /nfs/dbraw/zinc/53/43/06/899534306.db2.gz RGRKEUCDBXVTRB-ZBFHGGJFSA-N 0 3 409.372 4.034 20 0 HIADHN CC[C@@H](N[C@H](C)c1cccc(-n2cccn2)c1)c1ccccc1OCC(=O)N(C)C ZINC000483851840 899535038 /nfs/dbraw/zinc/53/50/38/899535038.db2.gz LMUHKFPXDIOJCZ-XMSQKQJNSA-N 0 3 406.530 4.141 20 0 HIADHN Cc1cc(-n2ccnc2)ccc1C[NH+]1CCC(C(=O)Nc2cc(Cl)ccc2[O-])CC1 ZINC000483934471 899592317 /nfs/dbraw/zinc/59/23/17/899592317.db2.gz PEBBVMGWQAAKBX-UHFFFAOYSA-N 0 3 424.932 4.390 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)NCCCc1ccc(Cl)cc1Cl ZINC000483966629 899613770 /nfs/dbraw/zinc/61/37/70/899613770.db2.gz XCRDFQRZRIUCBY-UHFFFAOYSA-N 0 3 422.356 4.051 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1nnc(/C=C\c2ccco2)s1 ZINC000484004496 899641644 /nfs/dbraw/zinc/64/16/44/899641644.db2.gz JFWGQNNDQOSWQH-MQNTZWLQSA-N 0 3 423.542 4.430 20 0 HIADHN Cc1c(C(=O)NCCCN2CCN(C)C[C@@H]2c2ccccc2)sc2nccc(C)c12 ZINC000505670020 914366490 /nfs/dbraw/zinc/36/64/90/914366490.db2.gz QUOJNVINRHTYBD-HXUWFJFHSA-N 0 3 422.598 4.022 20 0 HIADHN CC[C@@H](NCc1ccc(-c2ccncc2)cc1)c1ccccc1OCC(=O)N(C)C ZINC000484146610 899766730 /nfs/dbraw/zinc/76/67/30/899766730.db2.gz QKNGTMMZPOJAFN-HSZRJFAPSA-N 0 3 403.526 4.457 20 0 HIADHN Cc1cc(NC(=O)c2ccn(C)c2C2CCC2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000484154144 899775637 /nfs/dbraw/zinc/77/56/37/899775637.db2.gz CRPRVULFCHQQFO-NRFANRHFSA-N 0 3 417.557 4.497 20 0 HIADHN O=C(Nc1nnc(/C=C\c2ccco2)s1)N[C@H](CN1CCCC1)c1ccccc1 ZINC000484160655 899780451 /nfs/dbraw/zinc/78/04/51/899780451.db2.gz HIBUZEFABRFXGK-RXQFDZFGSA-N 0 3 409.515 4.260 20 0 HIADHN C[C@H](NCCCOC[C@@H]1CCOC1)c1ccc(Br)cc1Br ZINC000484163748 899783863 /nfs/dbraw/zinc/78/38/63/899783863.db2.gz MBPHPYKGUXTCOG-STQMWFEESA-N 0 3 421.173 4.305 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N(Cc1ccc2ccccc2c1)C1CC1 ZINC000484171889 899791213 /nfs/dbraw/zinc/79/12/13/899791213.db2.gz ZOPLYPMVRRTDGP-UHFFFAOYSA-N 0 3 415.537 4.340 20 0 HIADHN CCCN(Cc1c(F)cccc1Cl)C(=O)C(=O)Nc1cc(CN(C)C)ccc1C ZINC000484201938 899811776 /nfs/dbraw/zinc/81/17/76/899811776.db2.gz CMBNZECNNAFBOI-UHFFFAOYSA-N 0 3 419.928 4.226 20 0 HIADHN COc1ccc([C@H](C)NCc2ccc(C)cc2N2CCOCC2)cc1Br ZINC000484299116 899861090 /nfs/dbraw/zinc/86/10/90/899861090.db2.gz ZVJKRIAPKDGKSA-INIZCTEOSA-N 0 3 419.363 4.454 20 0 HIADHN CC[C@H](N[C@H]1CCCc2nc(-c3ccc(Cl)cc3)sc21)C(=O)N1CCOCC1 ZINC000484314610 899873688 /nfs/dbraw/zinc/87/36/88/899873688.db2.gz XDLGWMVKACJYOL-IRXDYDNUSA-N 0 3 419.978 4.068 20 0 HIADHN CC(C)[C@](C)(N[C@H]1CCN(CC(F)(F)F)C1=O)c1ccc(Br)cc1 ZINC000484343357 899893417 /nfs/dbraw/zinc/89/34/17/899893417.db2.gz RLCNOAHPQKXCNP-HOCLYGCPSA-N 0 3 407.274 4.073 20 0 HIADHN CCC(=O)Nc1cccc(C(=O)N(c2cccc(SC)c2)C2CCN(C)CC2)c1 ZINC000484402996 899927511 /nfs/dbraw/zinc/92/75/11/899927511.db2.gz LBBLAWCCYBSNIO-UHFFFAOYSA-N 0 3 411.571 4.498 20 0 HIADHN CSc1cccc(N(C(=O)CSC[C@@H]2CCCCO2)C2CCN(C)CC2)c1 ZINC000484408916 899932249 /nfs/dbraw/zinc/93/22/49/899932249.db2.gz VJYINMRAESEAOI-IBGZPJMESA-N 0 3 408.633 4.138 20 0 HIADHN CSc1cccc(N(C(=O)Cc2c(C)nn(C(F)F)c2C)C2CCN(C)CC2)c1 ZINC000484411439 899933614 /nfs/dbraw/zinc/93/36/14/899933614.db2.gz ZYODMRXFUIUCHV-UHFFFAOYSA-N 0 3 422.545 4.287 20 0 HIADHN Cc1ccc([C@@H](CN2C(=O)[C@@H]3CC[C@@H](c4ccccc4)N3C2=O)N2CCCC2)cc1 ZINC000484442910 899948013 /nfs/dbraw/zinc/94/80/13/899948013.db2.gz GIKJCAQOHHLKFN-RJGXRXQPSA-N 0 3 403.526 4.300 20 0 HIADHN COc1cc(C[C@H](CO)CN[C@@H](C)c2nc(-c3ccccc3)cs2)cc(OC)c1 ZINC000484477520 899970090 /nfs/dbraw/zinc/97/00/90/899970090.db2.gz PWSADAIFKGSLQH-WMZOPIPTSA-N 0 3 412.555 4.329 20 0 HIADHN COc1ccc2c(c1)[C@@H](NCCC(=O)Nc1cc(C)c(Cl)cc1OC)CCCO2 ZINC000484487898 899980013 /nfs/dbraw/zinc/98/00/13/899980013.db2.gz UBAJNOANVLIENJ-SFHVURJKSA-N 0 3 418.921 4.498 20 0 HIADHN COc1cc(OC)cc(N2CC[C@H](N[C@H](C)c3ccc(F)cc3OC(F)F)C2)c1 ZINC000484491099 899983302 /nfs/dbraw/zinc/98/33/02/899983302.db2.gz JAFHVFFKSPTRBE-HIFRSBDPSA-N 0 3 410.436 4.374 20 0 HIADHN CNS(=O)(=O)c1cccc([C@@H](C)NCc2ccc(-c3ccc(OC)cc3)s2)c1 ZINC000484496711 899987265 /nfs/dbraw/zinc/98/72/65/899987265.db2.gz PGPXCUZITVLBOA-OAHLLOKOSA-N 0 3 416.568 4.183 20 0 HIADHN Cc1c([C@@H](C)NCCC2CCN(CC(F)(F)F)CC2)nnn1-c1ccc(C)cc1 ZINC000484502367 899993719 /nfs/dbraw/zinc/99/37/19/899993719.db2.gz WRGLMSJAUMAWCZ-MRXNPFEDSA-N 0 3 409.500 4.199 20 0 HIADHN C[C@@H](N[C@H]1CCN(C(=O)CCc2ccccc2)C1)c1ccc(Br)s1 ZINC000484504533 899995039 /nfs/dbraw/zinc/99/50/39/899995039.db2.gz OFSNXHKDAMYOQA-ZBFHGGJFSA-N 0 3 407.377 4.395 20 0 HIADHN OCC[C@]1(CN[C@H](Cc2ccccc2F)c2ccccc2Br)CCOC1 ZINC000484510154 900002494 /nfs/dbraw/zinc/00/24/94/900002494.db2.gz VSQWVEPLCAEZTQ-NHCUHLMSSA-N 0 3 422.338 4.251 20 0 HIADHN CC(C)([C@@H](NC[C@H](O)COc1ccccc1F)c1ccc(F)c(F)c1)N1CCCC1 ZINC000484527218 900014542 /nfs/dbraw/zinc/01/45/42/900014542.db2.gz ATXPHKJHITXFCK-JTSKRJEESA-N 0 3 422.491 4.049 20 0 HIADHN O[C@@H](CN[C@@H](Cn1cnc2ccccc21)c1ccc(F)cc1)COCc1ccccc1 ZINC000484533013 900020332 /nfs/dbraw/zinc/02/03/32/900020332.db2.gz IPEJDHKWHCVTGI-UPVQGACJSA-N 0 3 419.500 4.084 20 0 HIADHN C[C@@H](N[C@@H]1CCN(c2c(F)cccc2F)C1)c1ccc(-n2cncn2)cc1Cl ZINC000484623033 900076301 /nfs/dbraw/zinc/07/63/01/900076301.db2.gz QQNWSQRGGCBIHF-ZIAGYGMSSA-N 0 3 403.864 4.128 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N2C[C@H](c3ccccc3)[C@@H]3COCC[C@H]32)C1 ZINC000484693512 900130990 /nfs/dbraw/zinc/13/09/90/900130990.db2.gz GCEBSNOMRGENID-FRJZNQBJSA-N 0 3 419.569 4.036 20 0 HIADHN CCc1nnc(C2CCN(Cc3coc(-c4ccc(C(F)(F)F)cc4)n3)CC2)[nH]1 ZINC000484717398 900149313 /nfs/dbraw/zinc/14/93/13/900149313.db2.gz TYQSAHKPWNZWGI-UHFFFAOYSA-N 0 3 405.424 4.421 20 0 HIADHN COc1ccc([C@H](C)NC(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)c(C)c1OC ZINC000484742724 900165553 /nfs/dbraw/zinc/16/55/53/900165553.db2.gz ZCVWGHOUYGOBLQ-NLWGTHIKSA-N 0 3 411.546 4.208 20 0 HIADHN C[C@H]1Cc2ccccc2N1Cc1ccoc1C(=O)NCc1ccccc1CN(C)C ZINC000484973737 900332120 /nfs/dbraw/zinc/33/21/20/900332120.db2.gz ZLCPSDKEMZXGIQ-SFHVURJKSA-N 0 3 403.526 4.222 20 0 HIADHN CCOc1ccccc1NC(=O)CCN(C)[C@H]1c2cc(Cl)cc(Cl)c2C[C@H]1O ZINC000484988971 900343976 /nfs/dbraw/zinc/34/39/76/900343976.db2.gz UADGIRRPIZNJID-NQIIRXRSSA-N 0 3 423.340 4.311 20 0 HIADHN CCOc1cc(CN(Cc2ccccc2)CC(C)C)nc2nc(C(F)(F)F)nn21 ZINC000485052073 900383108 /nfs/dbraw/zinc/38/31/08/900383108.db2.gz IRTOQJYYNFTYQN-UHFFFAOYSA-N 0 3 407.440 4.200 20 0 HIADHN COc1cccc(-c2nc(CN[C@]3(CO)C[C@H](C)CC(C)(C)C3)cs2)c1OC ZINC000485064297 900388830 /nfs/dbraw/zinc/38/88/30/900388830.db2.gz OJUZDPDGLNYFPK-IVZQSRNASA-N 0 3 404.576 4.494 20 0 HIADHN CCOc1ccccc1NC(=O)CCN1CCC(C(=O)c2cc(F)ccc2F)CC1 ZINC000485068790 900390605 /nfs/dbraw/zinc/39/06/05/900390605.db2.gz YZPNHBIRJOEPPX-UHFFFAOYSA-N 0 3 416.468 4.287 20 0 HIADHN Cc1cc(Br)ccc1CC(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000485079846 900396539 /nfs/dbraw/zinc/39/65/39/900396539.db2.gz PRGMIBWQADVZCU-QGZVFWFLSA-N 0 3 407.377 4.315 20 0 HIADHN CC(C)c1nc(C2CCN(CCC(=O)Nc3cccc(C(F)(F)F)c3)CC2)no1 ZINC000485090809 900402853 /nfs/dbraw/zinc/40/28/53/900402853.db2.gz MTTFZOHMAWKNPW-UHFFFAOYSA-N 0 3 410.440 4.420 20 0 HIADHN COc1cccc([C@H](C)N2CCN(CCCC(=O)Nc3c(C)cccc3C)CC2)c1 ZINC000485128893 900431807 /nfs/dbraw/zinc/43/18/07/900431807.db2.gz FBNYMDRRJFWDHN-NRFANRHFSA-N 0 3 409.574 4.410 20 0 HIADHN CCCOCc1ccccc1CNC(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000505778271 914445551 /nfs/dbraw/zinc/44/55/51/914445551.db2.gz LJQPTQRGHFQCDN-HXUWFJFHSA-N 0 3 401.576 4.311 20 0 HIADHN CS[C@@H]1CN(C(=O)Nc2cnn(-c3ccc(Cl)cc3)c2C(C)C)C[C@@H]1N(C)C ZINC000485199684 900492499 /nfs/dbraw/zinc/49/24/99/900492499.db2.gz ZJYOKWXMZOBXOO-ZWKOTPCHSA-N 0 3 421.998 4.158 20 0 HIADHN Cc1nc(-c2ccccc2Br)sc1[C@@H](C)N[C@@H]1CCCN(C)C1=O ZINC000485258798 900543464 /nfs/dbraw/zinc/54/34/64/900543464.db2.gz IWOBVSOLZRPIKS-IAQYHMDHSA-N 0 3 408.365 4.152 20 0 HIADHN CCCCNc1ccccc1C(=O)Nc1ccc(C(=O)N(C)[C@H]2CCCN(C)C2)cc1 ZINC000485279654 900558187 /nfs/dbraw/zinc/55/81/87/900558187.db2.gz APGVFCBYKWRRQZ-NRFANRHFSA-N 0 3 422.573 4.317 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NC[C@H]1CCOC[C@@H]1C)c1ccc(C(F)(F)F)cc1 ZINC000485335271 900622215 /nfs/dbraw/zinc/62/22/15/900622215.db2.gz ZXAMLAOOVNNBSA-KVSKMBFKSA-N 0 3 415.500 4.060 20 0 HIADHN COc1ccc(NC(=O)CCN(C)[C@@H](C)c2ccc([S@@](C)=O)cc2)cc1Cl ZINC000485404809 900703712 /nfs/dbraw/zinc/70/37/12/900703712.db2.gz LMSWERZNKKNQRU-PGGUUEOZSA-N 0 3 408.951 4.108 20 0 HIADHN COc1ccc(NC(=O)CCN(C)[C@H](C)c2ccc([S@@](C)=O)cc2)cc1Cl ZINC000485404808 900704149 /nfs/dbraw/zinc/70/41/49/900704149.db2.gz LMSWERZNKKNQRU-LOKFHWFJSA-N 0 3 408.951 4.108 20 0 HIADHN O=C(Cc1ccc(F)cc1Br)NC[C@H](c1cccs1)N1CCCC1 ZINC000485463054 900756952 /nfs/dbraw/zinc/75/69/52/900756952.db2.gz DAQRHGVCYZBARD-MRXNPFEDSA-N 0 3 411.340 4.146 20 0 HIADHN CCCc1sc(C(=O)Nc2ccc(C(=O)NCCN3CCCC3)cc2)cc1CC ZINC000485524373 900806309 /nfs/dbraw/zinc/80/63/09/900806309.db2.gz DBNGCWQNEGDSKN-UHFFFAOYSA-N 0 3 413.587 4.341 20 0 HIADHN CC(C)Sc1ccccc1C(=O)Nc1ccc(C(=O)NCCN2CCCC2)cc1 ZINC000485529111 900809613 /nfs/dbraw/zinc/80/96/13/900809613.db2.gz QKCNDNAEVRMHLP-UHFFFAOYSA-N 0 3 411.571 4.265 20 0 HIADHN O=C(CCc1ccc2ccccc2c1)Nc1ccc(C(=O)NCCN2CCCC2)cc1 ZINC000485548293 900823606 /nfs/dbraw/zinc/82/36/06/900823606.db2.gz HFEZAOJWUDTBAB-UHFFFAOYSA-N 0 3 415.537 4.237 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)Nc2cnc(-c3ccccc3)nc2)CC1 ZINC000485589124 900852194 /nfs/dbraw/zinc/85/21/94/900852194.db2.gz LYAQVVZOXUPGMF-UHFFFAOYSA-N 0 3 401.514 4.272 20 0 HIADHN CCCN(Cc1csc(N(C)C2CC2)n1)C1CCN(c2cc(C)nc(C)n2)CC1 ZINC000485671488 900921824 /nfs/dbraw/zinc/92/18/24/900921824.db2.gz PENQWWUAJQLABA-UHFFFAOYSA-N 0 3 414.623 4.030 20 0 HIADHN Cc1cc(C)c(NC(=O)CCCN2CCCN(C(=O)CC3CCCC3)CC2)c(C)c1 ZINC000485673705 900925002 /nfs/dbraw/zinc/92/50/02/900925002.db2.gz UXDSIDHIGXJSNL-UHFFFAOYSA-N 0 3 413.606 4.445 20 0 HIADHN CCOc1cc(CN2C[C@@H](c3ccc(F)cc3)C[C@@H]2C)nc2nc(C(F)(F)F)nn21 ZINC000485685237 900935487 /nfs/dbraw/zinc/93/54/87/900935487.db2.gz OVRGGBJEXKKYHO-JSGCOSHPSA-N 0 3 423.414 4.059 20 0 HIADHN C[C@@H](Oc1ccccc1Br)C(=O)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000485706215 900955905 /nfs/dbraw/zinc/95/59/05/900955905.db2.gz HACDYJPEAKFHAO-APWZRJJASA-N 0 3 417.347 4.170 20 0 HIADHN C[C@H]1C[C@H](c2ccc(C(F)(F)F)cc2)N(CCn2cnc3ccccc3c2=O)C1 ZINC000485968636 901186277 /nfs/dbraw/zinc/18/62/77/901186277.db2.gz WCBWTNOKGXTGTL-MGPUTAFESA-N 0 3 401.432 4.498 20 0 HIADHN CC[C@@H](N[C@H](C)c1ccc(-n2cnnn2)cc1)c1cc(F)cc(Br)c1 ZINC000486093720 901281274 /nfs/dbraw/zinc/28/12/74/901281274.db2.gz UWUZYWLAXGORKS-KZULUSFZSA-N 0 3 404.287 4.366 20 0 HIADHN CN(Cc1ccco1)Cc1ccccc1CNC(=O)N1CCN(C2CCCCC2)CC1 ZINC000486111111 901298238 /nfs/dbraw/zinc/29/82/38/901298238.db2.gz TUKGSVSPIHBTOA-UHFFFAOYSA-N 0 3 424.589 4.072 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)c1cc2cc(Br)ccc2[nH]1 ZINC000486175551 901361682 /nfs/dbraw/zinc/36/16/82/901361682.db2.gz SDTNYJRYTYQISH-HXUWFJFHSA-N 0 3 412.331 4.497 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N2CCc3cc(-c4ccccc4)ccc32)CC1 ZINC000486216816 901399079 /nfs/dbraw/zinc/39/90/79/901399079.db2.gz AXAIOHMAMPENEJ-UHFFFAOYSA-N 0 3 407.558 4.315 20 0 HIADHN COc1ccc([C@H]2CCCCCN2C(=O)CN2CCN(C3CCCCC3)CC2)cc1 ZINC000486246089 901428041 /nfs/dbraw/zinc/42/80/41/901428041.db2.gz UQXZTXZFJLQKLD-XMMPIXPASA-N 0 3 413.606 4.089 20 0 HIADHN COC(=O)c1c(-c2ccccc2)csc1NC(=O)N1CCCN(C(C)C)CC1 ZINC000505900479 914542328 /nfs/dbraw/zinc/54/23/28/914542328.db2.gz ZJDAQAXQCMVWJW-UHFFFAOYSA-N 0 3 401.532 4.150 20 0 HIADHN c1nc(-c2ccccn2)sc1CN1C[C@H]2CCC[C@@]2(c2nc(CC3CC3)no2)C1 ZINC000486468907 901630015 /nfs/dbraw/zinc/63/00/15/901630015.db2.gz NKBIOBKISKUYTN-OPAMFIHVSA-N 0 3 407.543 4.094 20 0 HIADHN O=C(CCOc1ccc2ccccc2c1)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000486567924 901712452 /nfs/dbraw/zinc/71/24/52/901712452.db2.gz QQJFAVFRHHZWKJ-UHFFFAOYSA-N 0 3 404.510 4.204 20 0 HIADHN CC(C)CC[C@H]1CCCN1CC(=O)N(C)CC(=O)Nc1ccccc1C(F)(F)F ZINC000486810460 901868544 /nfs/dbraw/zinc/86/85/44/901868544.db2.gz QZFVEDPZOPMZQX-MRXNPFEDSA-N 0 3 413.484 4.003 20 0 HIADHN C[C@H](c1ccc(F)c(Cl)c1)N1C[C@H]2CCC[C@@]2(c2nc(-c3cnccn3)no2)C1 ZINC000486832660 901884265 /nfs/dbraw/zinc/88/42/65/901884265.db2.gz NOJSOQPAXFOLQS-MFLXSWDHSA-N 0 3 413.884 4.434 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2c(F)cccc2Br)N2CCCC2)cc1 ZINC000486868618 901914274 /nfs/dbraw/zinc/91/42/74/901914274.db2.gz MLUOFECFECZUKL-SFHVURJKSA-N 0 3 405.311 4.464 20 0 HIADHN CC(C)[C@H](C(=O)Nc1ccc2oc(=O)n(CCN(C)C)c2c1)c1cccc(Cl)c1 ZINC000486882670 901928534 /nfs/dbraw/zinc/92/85/34/901928534.db2.gz RLFKSZATVAFMMZ-FQEVSTJZSA-N 0 3 415.921 4.188 20 0 HIADHN CC1CCC(N2CCN(C(=O)Nc3nnc(/C=C/c4ccco4)s3)CC2)CC1 ZINC000486884592 901931592 /nfs/dbraw/zinc/93/15/92/901931592.db2.gz YGMDBCNIOCTOBG-CMDGGOBGSA-N 0 3 401.536 4.030 20 0 HIADHN COCCOc1cccc(CNCc2c[nH]nc2-c2ccc(C(F)(F)F)cc2)c1 ZINC000486979418 902002809 /nfs/dbraw/zinc/00/28/09/902002809.db2.gz DTAAXSIUZOAYST-UHFFFAOYSA-N 0 3 405.420 4.411 20 0 HIADHN CN(C(=O)Nc1ccc(C(=O)C2CCC2)cc1)C1CCN(CCc2ccccn2)CC1 ZINC000487008858 902012640 /nfs/dbraw/zinc/01/26/40/902012640.db2.gz VEYVFNVCZJZZMN-UHFFFAOYSA-N 0 3 420.557 4.235 20 0 HIADHN C[C@H](NC(=O)N(CCN(C)C)Cc1cccc(F)c1)c1ccc2ncsc2c1 ZINC000487019047 902018525 /nfs/dbraw/zinc/01/85/25/902018525.db2.gz CUMXJMVHVORVHX-HNNXBMFYSA-N 0 3 400.523 4.270 20 0 HIADHN Cc1n[nH]c(C)c1[C@H](C)C(=O)N[C@H](c1ccc(F)c(F)c1)C(C)(C)N1CCCC1 ZINC000487138209 902069795 /nfs/dbraw/zinc/06/97/95/902069795.db2.gz NAKVJKHRRUCXME-RNODOKPDSA-N 0 3 404.505 4.140 20 0 HIADHN Brc1ccc(CN[C@H]2CCN(c3cccc(Br)c3)C2)o1 ZINC000487191619 902093993 /nfs/dbraw/zinc/09/39/93/902093993.db2.gz LASBGKLERKEWLH-LBPRGKRZSA-N 0 3 400.114 4.173 20 0 HIADHN CC[C@H](C)c1nc([C@@H](C)NC(=O)NC[C@H](c2cccc(Cl)c2)N2CCCC2)n[nH]1 ZINC000487349017 902156852 /nfs/dbraw/zinc/15/68/52/902156852.db2.gz AEQJFXNCIPEGNO-HDMKZQKVSA-N 0 3 418.973 4.169 20 0 HIADHN Cc1nc(-c2ccc(C)cc2NC(=O)CN(CCc2ccccc2)CC(C)C)n[nH]1 ZINC000487414840 902196385 /nfs/dbraw/zinc/19/63/85/902196385.db2.gz QRJMXBBEJQVFDS-UHFFFAOYSA-N 0 3 405.546 4.228 20 0 HIADHN COc1cc(-c2noc(CN3CCCC[C@H]3Cc3ccccc3)n2)cc(OC)c1OC ZINC000487437171 902210600 /nfs/dbraw/zinc/21/06/00/902210600.db2.gz YQXTXNPWXZUANL-IBGZPJMESA-N 0 3 423.513 4.360 20 0 HIADHN C[C@@H](SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)N(C)CCN1CCCC1 ZINC000487626174 902258066 /nfs/dbraw/zinc/25/80/66/902258066.db2.gz SGUIXZKQGQRMSI-OAHLLOKOSA-N 0 3 407.967 4.171 20 0 HIADHN C[C@H]1CN(C2CCOCC2)CCN1C(=O)Nc1ccccc1N1CCc2ccccc21 ZINC000487874045 902419649 /nfs/dbraw/zinc/41/96/49/902419649.db2.gz PHDALWCSSTVWGH-IBGZPJMESA-N 0 3 420.557 4.098 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)NC(=O)Nc1ccccc1F)c1ccc(Oc2cccnc2)cc1 ZINC000487931376 902461937 /nfs/dbraw/zinc/46/19/37/902461937.db2.gz FBMLOHDQFAGAPU-CVEARBPZSA-N 0 3 422.460 4.400 20 0 HIADHN C[C@H]1CCN(C(=O)c2ccccc2COC2CCOCC2)CCN1Cc1ccccc1 ZINC000487963117 902488526 /nfs/dbraw/zinc/48/85/26/902488526.db2.gz PSRKVLNRKGKQNS-NRFANRHFSA-N 0 3 422.569 4.119 20 0 HIADHN CC(C)[C@@H]1CN(CC(=O)Nc2ccc(Oc3ccccc3Cl)cc2)CCN1C ZINC000487997478 902519583 /nfs/dbraw/zinc/51/95/83/902519583.db2.gz FMNCATMOCDTIJE-FQEVSTJZSA-N 0 3 401.938 4.343 20 0 HIADHN CCN(C(=O)c1cc2c(cc1F)NC(=O)CC2)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000488099043 902602742 /nfs/dbraw/zinc/60/27/42/902602742.db2.gz PURHCISXNZXXDQ-VQIMIIECSA-N 0 3 409.505 4.008 20 0 HIADHN CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)c1cnccc1Oc1ccccc1 ZINC000505978271 914641200 /nfs/dbraw/zinc/64/12/00/914641200.db2.gz AMVHEUXKSONCCC-CVDCTZTESA-N 0 3 402.498 4.034 20 0 HIADHN C[C@H]1CC[C@@H](CN2CCC(c3nc(-c4ccccc4Br)no3)CC2)O1 ZINC000488171832 902660908 /nfs/dbraw/zinc/66/09/08/902660908.db2.gz UHRNZYASFXKSBY-ZFWWWQNUSA-N 0 3 406.324 4.246 20 0 HIADHN C[C@@H](NCc1cccc(NC(=O)CCN2CCOCC2)c1)c1ccc(C(C)(C)C)cc1 ZINC000488241283 902716898 /nfs/dbraw/zinc/71/68/98/902716898.db2.gz JZMBFTUKXSPSFQ-HXUWFJFHSA-N 0 3 423.601 4.496 20 0 HIADHN C[C@H]1CN(C2CCOCC2)CCN1C(=O)Nc1cc(F)ccc1Oc1ccccc1 ZINC000488284370 902746488 /nfs/dbraw/zinc/74/64/88/902746488.db2.gz YPDTUEBVMGXSDA-KRWDZBQOSA-N 0 3 413.493 4.335 20 0 HIADHN O=C(Nc1ccc(C(=O)NCCN2CCCC2)cc1)c1cc2cc(F)ccc2s1 ZINC000488402555 902809646 /nfs/dbraw/zinc/80/96/46/902809646.db2.gz JZSONMWHZWBEHT-UHFFFAOYSA-N 0 3 411.502 4.118 20 0 HIADHN CC(C)[C@@H]1C[C@@H](N[C@@H](CN2CCCC2=O)c2cccc(C(F)(F)F)c2)CS1 ZINC000488426118 902821246 /nfs/dbraw/zinc/82/12/46/902821246.db2.gz VKHNMPBZQHOLHI-SQNIBIBYSA-N 0 3 400.510 4.489 20 0 HIADHN COCc1ccsc1C(=O)N(CCN(C)C)Cc1ccc(C(F)(F)F)cc1 ZINC000488492069 902852660 /nfs/dbraw/zinc/85/26/60/902852660.db2.gz HLIVXSUHFZRNKC-UHFFFAOYSA-N 0 3 400.466 4.117 20 0 HIADHN Cc1cccc(Oc2ccc(NC(=O)N3CCN(C4CCOCC4)C[C@@H]3C)cn2)c1C ZINC000488515546 902865144 /nfs/dbraw/zinc/86/51/44/902865144.db2.gz LBZLUOQDCQLGPR-SFHVURJKSA-N 0 3 424.545 4.208 20 0 HIADHN CCCOc1c(CN[C@H]2CCc3nnc(-c4ccc(F)cc4)n3C2)cccc1OCC ZINC000505995533 914665747 /nfs/dbraw/zinc/66/57/47/914665747.db2.gz DSLMTCYQDPXHAH-FQEVSTJZSA-N 0 3 424.520 4.376 20 0 HIADHN COc1ccc2c(c1)CCC[C@@H]2CC(=O)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000488664380 902928594 /nfs/dbraw/zinc/92/85/94/902928594.db2.gz IPBCAACIIFICSV-HXUWFJFHSA-N 0 3 408.542 4.101 20 0 HIADHN COc1ccc(C(=O)N(Cc2ccccc2)C2CCN(C)CC2)cc1Br ZINC000488670771 902931120 /nfs/dbraw/zinc/93/11/20/902931120.db2.gz BZYAGIFYNPOABR-UHFFFAOYSA-N 0 3 417.347 4.194 20 0 HIADHN Cc1cc(C)n(Cc2ccc(C(=O)N(Cc3ccccc3)C3CCN(C)CC3)cc2)n1 ZINC000488672260 902933736 /nfs/dbraw/zinc/93/37/36/902933736.db2.gz YBSJDRGSINIQKD-UHFFFAOYSA-N 0 3 416.569 4.285 20 0 HIADHN Cc1noc2nc(C3CC3)cc(C(=O)N(Cc3ccccc3)C3CCN(C)CC3)c12 ZINC000488692402 902945678 /nfs/dbraw/zinc/94/56/78/902945678.db2.gz JQTMFBKNBSBURE-UHFFFAOYSA-N 0 3 404.514 4.145 20 0 HIADHN Cc1ccccc1[C@@H](C(C)C)N(C)CC(=O)Nc1ccc(CN2CCOCC2)cc1 ZINC000488732444 902969702 /nfs/dbraw/zinc/96/97/02/902969702.db2.gz WLNUIIXPLAXBPH-RUZDIDTESA-N 0 3 409.574 4.095 20 0 HIADHN Cc1ccccc1[C@H](C(C)C)N(C)CC(=O)NCc1ccc(C(=O)N2CCCC2)cc1 ZINC000488768114 902986130 /nfs/dbraw/zinc/98/61/30/902986130.db2.gz PSGWPVSCDHRPTQ-VWLOTQADSA-N 0 3 421.585 4.176 20 0 HIADHN COc1ccc(NC(=O)[C@H](C)N[C@H](COc2ccccc2F)C(C)(C)C)c(OC)c1 ZINC000489025198 903127882 /nfs/dbraw/zinc/12/78/82/903127882.db2.gz CLDWXXWBHGUTGY-YCRPNKLZSA-N 0 3 418.509 4.253 20 0 HIADHN O[C@H](COc1cccc2[nH]ccc21)CN1CCC[C@@H](c2nc3c(s2)CCCC3)C1 ZINC000489108099 903201174 /nfs/dbraw/zinc/20/11/74/903201174.db2.gz ZBWXDZBRWHWCFT-SJORKVTESA-N 0 3 411.571 4.123 20 0 HIADHN CC(C)COC[C@@H](NC(=O)N(Cc1ccccc1)C1CCN(C)CC1)c1ccco1 ZINC000489205104 903263007 /nfs/dbraw/zinc/26/30/07/903263007.db2.gz MTKQRKHSROFZJK-JOCHJYFZSA-N 0 3 413.562 4.299 20 0 HIADHN CCC[C@@H](NC(=O)NCc1ccccc1CN1CCC(O)CC1)C1CCCCC1 ZINC000489220097 903270796 /nfs/dbraw/zinc/27/07/96/903270796.db2.gz PCYNEHVUZHRZOD-HSZRJFAPSA-N 0 3 401.595 4.192 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)NC[C@@H]2CCCO[C@H]2c2ccccc2)CC1 ZINC000489368587 903348191 /nfs/dbraw/zinc/34/81/91/903348191.db2.gz NAGQCNIBBQHRNS-ZCYQVOJMSA-N 0 3 421.585 4.460 20 0 HIADHN CCN(CC1CCN(c2ccccn2)CC1)[C@@H](C)C(=O)Nc1cc(Cl)ccc1F ZINC000489387305 903359783 /nfs/dbraw/zinc/35/97/83/903359783.db2.gz HEIUQTDWIFEQNE-INIZCTEOSA-N 0 3 418.944 4.440 20 0 HIADHN COCCN(Cc1c(-c2ccc(Cl)cc2)nc2sccn12)[C@H]1CCO[C@H]1C ZINC000489437031 903382920 /nfs/dbraw/zinc/38/29/20/903382920.db2.gz FTBZIFGLTPTFME-YOEHRIQHSA-N 0 3 405.951 4.342 20 0 HIADHN COCCN(Cc1c(-c2ccc(Cl)cc2)nc2sccn12)[C@@H]1CCO[C@@H]1C ZINC000489437029 903383622 /nfs/dbraw/zinc/38/36/22/903383622.db2.gz FTBZIFGLTPTFME-RHSMWYFYSA-N 0 3 405.951 4.342 20 0 HIADHN Cc1ccc(C(C)(C)CNC(=O)NCc2ccccc2CN2CCC(O)CC2)c(C)c1 ZINC000489497662 903423987 /nfs/dbraw/zinc/42/39/87/903423987.db2.gz NITYXEJLMRXONS-UHFFFAOYSA-N 0 3 423.601 4.037 20 0 HIADHN COCCN(CCCc1ccc(Br)cc1OC)Cc1scnc1C ZINC000489503920 903426948 /nfs/dbraw/zinc/42/69/48/903426948.db2.gz ZOSNVUHKDCQDHF-UHFFFAOYSA-N 0 3 413.381 4.304 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(F)cc2)CC1)c1cc(F)c(Cl)cc1F ZINC000489541226 903452254 /nfs/dbraw/zinc/45/22/54/903452254.db2.gz YYACEUREQUFGLV-UHFFFAOYSA-N 0 3 412.839 4.031 20 0 HIADHN C[C@@H](CCC1CCCCC1)NC(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000489554070 903459833 /nfs/dbraw/zinc/45/98/33/903459833.db2.gz FHQLJFLVFQYYKY-IBGZPJMESA-N 0 3 401.595 4.192 20 0 HIADHN C[C@@H](NCc1cccc(CN2CCOCC2)c1)c1ccc(Br)c(F)c1 ZINC000489565771 903467844 /nfs/dbraw/zinc/46/78/44/903467844.db2.gz GDFOYAXMUZFRDL-OAHLLOKOSA-N 0 3 407.327 4.271 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2cccc(NC(=O)[C@@H]3C[C@H]3C)c2)N2CCCC2)cc1 ZINC000489600056 903490253 /nfs/dbraw/zinc/49/02/53/903490253.db2.gz UATPXRXRWQVZRD-YSZBQJHXSA-N 0 3 405.542 4.156 20 0 HIADHN COc1ccc2cc(C(=O)NC[C@H](c3ccc(C)cc3)N3CCCC3)c(C)nc2c1 ZINC000489616667 903499538 /nfs/dbraw/zinc/49/95/38/903499538.db2.gz AMYVQLVKTAHEAK-XMMPIXPASA-N 0 3 403.526 4.427 20 0 HIADHN CCCCOc1ccccc1NC(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000489754378 903581154 /nfs/dbraw/zinc/58/11/54/903581154.db2.gz IQSXYSJRTVSRSM-UHFFFAOYSA-N 0 3 411.546 4.144 20 0 HIADHN Cc1ccc(NC(=O)NCc2ccccc2CN2CCC(O)CC2)cc1C(F)(F)F ZINC000489787394 903598416 /nfs/dbraw/zinc/59/84/16/903598416.db2.gz FGQHRKNYENHQNL-UHFFFAOYSA-N 0 3 421.463 4.292 20 0 HIADHN COc1ccc(-c2noc([C@@H](C)N3CC[C@@H](C)N(Cc4ccccc4)CC3)n2)cc1 ZINC000489884863 903650974 /nfs/dbraw/zinc/65/09/74/903650974.db2.gz KJQKRVMVKLKSCB-RTBURBONSA-N 0 3 406.530 4.403 20 0 HIADHN CN(c1ccccc1)C1CCN(C(=O)NC[C@H](c2cccs2)N2CCCC2)CC1 ZINC000489911617 903668532 /nfs/dbraw/zinc/66/85/32/903668532.db2.gz LFRPOSMOBOOLFO-OAQYLSRUSA-N 0 3 412.603 4.195 20 0 HIADHN CCCC(=O)Nc1ccc(CNC(=O)N(Cc2ccccc2)C2CCN(C)CC2)cc1 ZINC000489922769 903677589 /nfs/dbraw/zinc/67/75/89/903677589.db2.gz YCMZYVDSPCHMBX-UHFFFAOYSA-N 0 3 422.573 4.231 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)NC[C@@H]2SCCc3ccccc32)CC1 ZINC000489929460 903683717 /nfs/dbraw/zinc/68/37/17/903683717.db2.gz VYQYNXMJRHBHCA-QHCPKHFHSA-N 0 3 409.599 4.323 20 0 HIADHN CNS(=O)(=O)c1ccc([C@@H](C)N[C@@H](C)c2ccc(Oc3cccnc3)cc2)cc1 ZINC000489955279 903696467 /nfs/dbraw/zinc/69/64/67/903696467.db2.gz JDSFWEOSJPPYEA-DLBZAZTESA-N 0 3 411.527 4.194 20 0 HIADHN C[C@H](c1nc(-c2ccc(Cl)cc2)no1)N1CCC(CCCN2CCOCC2)CC1 ZINC000506047355 914741740 /nfs/dbraw/zinc/74/17/40/914741740.db2.gz KJFFFFCGGAYYIF-QGZVFWFLSA-N 0 3 418.969 4.275 20 0 HIADHN Cc1cc(CC(C)(C)NC(=O)N[C@@H](C)C2=CCN(C)CC2)ccc1Br ZINC000489978216 903708890 /nfs/dbraw/zinc/70/88/90/903708890.db2.gz BWUITMVBUTXIOB-HNNXBMFYSA-N 0 3 408.384 4.028 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1c2cc(Br)ccc2CC1(C)C)C1=CCN(C)CC1 ZINC000489998946 903717350 /nfs/dbraw/zinc/71/73/50/903717350.db2.gz QSDWPWHPQVSEQP-SCLBCKFNSA-N 0 3 406.368 4.022 20 0 HIADHN Cc1ccc([C@H]2C[C@@H](C)N(CC(=O)N3CCC(OCc4ccccc4)CC3)C2)cc1 ZINC000490051171 903743640 /nfs/dbraw/zinc/74/36/40/903743640.db2.gz BRDDFSCIQBJYPV-QPPBQGQZSA-N 0 3 406.570 4.381 20 0 HIADHN Cc1ccc([C@H](NCCCOCC(F)(F)F)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000490114667 903773275 /nfs/dbraw/zinc/77/32/75/903773275.db2.gz RRJFLFUACMBULV-IBGZPJMESA-N 0 3 415.477 4.047 20 0 HIADHN Cc1nn(-c2ccccc2)cc1CCCN[C@H](c1cnn(C)c1)c1cccc(F)c1 ZINC000490151150 903795250 /nfs/dbraw/zinc/79/52/50/903795250.db2.gz PLJIGVXFFUKEPZ-DEOSSOPVSA-N 0 3 403.505 4.365 20 0 HIADHN CCc1ccc([C@H](NCCN2CCC[C@H](C)C2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000490173487 903810683 /nfs/dbraw/zinc/81/06/83/903810683.db2.gz VUBAJTQQGRCTGV-CYFREDJKSA-N 0 3 414.615 4.063 20 0 HIADHN COc1cccc(CO[C@H](C)C(=O)NC[C@H](c2ccccc2)N2CCC(C)CC2)c1 ZINC000490218675 903833597 /nfs/dbraw/zinc/83/35/97/903833597.db2.gz UEVQQOLYCDLSHY-HYBUGGRVSA-N 0 3 410.558 4.190 20 0 HIADHN CCNC(=O)Nc1ccc(C)c(NC(=O)N(CCN(C)C)Cc2cccc(C)c2)c1 ZINC000490340997 903931729 /nfs/dbraw/zinc/93/17/29/903931729.db2.gz XVLVHEKZLYDVMA-UHFFFAOYSA-N 0 3 411.550 4.041 20 0 HIADHN COCCc1ccnc(NC(=O)N2CCN(Cc3ccccc3)C3(CCCCC3)C2)c1 ZINC000490375168 903968880 /nfs/dbraw/zinc/96/88/80/903968880.db2.gz UVUJBAPYVCOTLL-UHFFFAOYSA-N 0 3 422.573 4.323 20 0 HIADHN Cc1ccc(F)c(C(=O)NC2CCN(Cc3ccccc3)CC2)c1Br ZINC000490449355 904016762 /nfs/dbraw/zinc/01/67/62/904016762.db2.gz ZWGDORZGYLAGQE-UHFFFAOYSA-N 0 3 405.311 4.291 20 0 HIADHN C[C@]1(CNC(=O)c2ccc(-c3cncnc3)cc2F)CCCN1Cc1ccccc1 ZINC000490518460 904067750 /nfs/dbraw/zinc/06/77/50/904067750.db2.gz AHYJPYHCONVAHW-XMMPIXPASA-N 0 3 404.489 4.067 20 0 HIADHN Cn1nc(-c2ccc(Cl)s2)cc1NC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000490528536 904077151 /nfs/dbraw/zinc/07/71/51/904077151.db2.gz SDOIVCGJSBVCLP-KUHUBIRLSA-N 0 3 415.950 4.369 20 0 HIADHN CN(C)[C@@H](CNC(=O)Nc1cc(F)cc(Br)c1F)Cc1ccccc1 ZINC000490565606 904103423 /nfs/dbraw/zinc/10/34/23/904103423.db2.gz FJZZJTUPFBHENL-CQSZACIVSA-N 0 3 412.278 4.022 20 0 HIADHN COc1ccccc1-c1ncc(CNCCOc2ccc(C(F)(F)F)cc2)cn1 ZINC000490617441 904139154 /nfs/dbraw/zinc/13/91/54/904139154.db2.gz HHBDQOKCILXOOA-UHFFFAOYSA-N 0 3 403.404 4.340 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)NC[C@H]1CCCCC(F)(F)C1 ZINC000490651272 904155979 /nfs/dbraw/zinc/15/59/79/904155979.db2.gz XTAABZLETIHAMI-HNNXBMFYSA-N 0 3 403.464 4.254 20 0 HIADHN O=C1C[C@H]([C@H]2CCCCN2Cc2csc(-c3ccc(C(F)(F)F)cc3)n2)CN1 ZINC000490676222 904167767 /nfs/dbraw/zinc/16/77/67/904167767.db2.gz SFNXLRWXNCUQDP-WMLDXEAASA-N 0 3 409.477 4.320 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)NCC2(c3ccccc3Cl)CC2)CC1 ZINC000490744166 904203935 /nfs/dbraw/zinc/20/39/35/904203935.db2.gz HSXZZGUZWNBRCD-UHFFFAOYSA-N 0 3 401.938 4.271 20 0 HIADHN C[C@@H](NC(=O)NCCc1coc(-c2ccc(F)cc2)n1)[C@@H](c1ccccc1)N(C)C ZINC000490745968 904204877 /nfs/dbraw/zinc/20/48/77/904204877.db2.gz OAALEGAAWBFOKR-IERDGZPVSA-N 0 3 410.493 4.014 20 0 HIADHN C[C@@H](NC(=O)NCCc1coc(-c2ccc(F)cc2)n1)[C@H](c1ccccc1)N(C)C ZINC000490745969 904205486 /nfs/dbraw/zinc/20/54/86/904205486.db2.gz OAALEGAAWBFOKR-IIBYNOLFSA-N 0 3 410.493 4.014 20 0 HIADHN Cc1ccc(-c2nc(CCNC(=O)N[C@@H](C)[C@H](c3ccccc3)N(C)C)co2)cc1 ZINC000490762107 904215767 /nfs/dbraw/zinc/21/57/67/904215767.db2.gz WYLMKFRANONNLA-PGRDOPGGSA-N 0 3 406.530 4.183 20 0 HIADHN O=C(N[C@@H](c1c[nH]c2ccccc21)C(F)(F)F)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000490794652 904242883 /nfs/dbraw/zinc/24/28/83/904242883.db2.gz JPPVLXJHAIFHEO-UZLBHIALSA-N 0 3 416.447 4.345 20 0 HIADHN CCN1CCN(c2ccc(C(=O)NCC[C@H](c3ccccc3)C(F)(F)F)cc2)CC1 ZINC000490848304 904285154 /nfs/dbraw/zinc/28/51/54/904285154.db2.gz WJSVDKCTYACVMN-OAQYLSRUSA-N 0 3 419.491 4.295 20 0 HIADHN CN(CCN(Cc1ccccc1)C(=O)NCC1CC(F)(F)C1)Cc1ccccc1 ZINC000490893727 904305515 /nfs/dbraw/zinc/30/55/15/904305515.db2.gz JXLZWMJQOROMME-UHFFFAOYSA-N 0 3 401.501 4.376 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)NCc2cc(-c3ccccc3)on2)N(C)C)cc1 ZINC000490986218 904351145 /nfs/dbraw/zinc/35/11/45/904351145.db2.gz DKHPSWQTNJNGCS-QFIPXVFZSA-N 0 3 422.529 4.231 20 0 HIADHN Cc1ccc(-c2nn(Cc3ccccc3)cc2CN2CCC(C(=O)N(C)C)CC2)cc1 ZINC000506099538 914803152 /nfs/dbraw/zinc/80/31/52/914803152.db2.gz NHGMGMMYLCUGBM-UHFFFAOYSA-N 0 3 416.569 4.207 20 0 HIADHN CCN(CCN[C@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1)C(C)C ZINC000491012042 904368748 /nfs/dbraw/zinc/36/87/48/904368748.db2.gz WWUBUSUEPRYMSV-OAQYLSRUSA-N 0 3 408.995 4.153 20 0 HIADHN CCOc1ccc([C@@H](NC[C@H](C)N2CCN(C)CC2)c2ccccc2Cl)cc1 ZINC000491026861 904377717 /nfs/dbraw/zinc/37/77/17/904377717.db2.gz ZGIUYTLSCAZSDZ-FDDCHVKYSA-N 0 3 401.982 4.054 20 0 HIADHN CN(CCN[C@@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1)C1CCCC1 ZINC000491033577 904385758 /nfs/dbraw/zinc/38/57/58/904385758.db2.gz FGFJZBYJMRSHDH-QFIPXVFZSA-N 0 3 421.006 4.297 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000491114624 904437591 /nfs/dbraw/zinc/43/75/91/904437591.db2.gz AAHSKDFHMSQSLI-DEOSSOPVSA-N 0 3 416.569 4.155 20 0 HIADHN Cc1ccc([C@@H](NCCCOCC2CC2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000491269520 904510958 /nfs/dbraw/zinc/51/09/58/904510958.db2.gz BSGSQMHQMLWSHL-QHCPKHFHSA-N 0 3 401.572 4.203 20 0 HIADHN COc1cccc([C@@H](CN[C@H](c2cnn(C)c2)c2cccc(F)c2)N2CCCC2)c1 ZINC000491309888 904529392 /nfs/dbraw/zinc/52/93/92/904529392.db2.gz ZPGQOPMZJCGLSD-RPWUZVMVSA-N 0 3 408.521 4.084 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](NCCc2ccc(F)cc2)c2ccc(F)c(F)c2)c1 ZINC000491343490 904546535 /nfs/dbraw/zinc/54/65/35/904546535.db2.gz OLLBFXKRGUAAOW-JOCHJYFZSA-N 0 3 419.468 4.429 20 0 HIADHN Cc1ccc(C)c([C@@H](NC2CCN(S(C)(=O)=O)CC2)c2ccccc2Cl)c1 ZINC000491344182 904547740 /nfs/dbraw/zinc/54/77/40/904547740.db2.gz XHTYZNPPOVCTDG-NRFANRHFSA-N 0 3 406.979 4.060 20 0 HIADHN O=C1CCCN1CCCN[C@@H](c1ccccc1)c1ccc(Br)cc1F ZINC000491356981 904555410 /nfs/dbraw/zinc/55/54/10/904555410.db2.gz UIMGNHZMHBAIEG-FQEVSTJZSA-N 0 3 405.311 4.280 20 0 HIADHN COc1cccc([C@@H](CNC(=O)c2c[nH]cc2-c2ccccc2F)N2CCCC2)c1 ZINC000491399517 904578964 /nfs/dbraw/zinc/57/89/64/904578964.db2.gz IRIBCRPMUZCKCG-HSZRJFAPSA-N 0 3 407.489 4.396 20 0 HIADHN CNC(=O)c1ccc(CN(C)Cc2cc(OC)c(OC)cc2-c2ccccc2)cc1 ZINC000506154203 914826942 /nfs/dbraw/zinc/82/69/42/914826942.db2.gz XFOULGFDQORQHB-UHFFFAOYSA-N 0 3 404.510 4.362 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)Nc2ccc(OC[C@@H]3CCCO3)cc2)c1 ZINC000491522830 904636148 /nfs/dbraw/zinc/63/61/48/904636148.db2.gz AVULMDBHYLDBMA-QHCPKHFHSA-N 0 3 411.546 4.149 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)N1CCC2(CC1)OCCc1ccsc12 ZINC000491837393 904709472 /nfs/dbraw/zinc/70/94/72/904709472.db2.gz LEPWFZYGEXQBCA-UHFFFAOYSA-N 0 3 410.539 4.260 20 0 HIADHN Cc1ccc(-c2nc3cc(F)ccc3n2C)cc1NC(=O)N1CC[C@H]2CCN(C)C[C@@H]21 ZINC000492001341 904756700 /nfs/dbraw/zinc/75/67/00/904756700.db2.gz RCBUQBLQEKFPQH-ZHRRBRCNSA-N 0 3 421.520 4.246 20 0 HIADHN CC(C)c1nnc(CCNCc2cc(Br)ccc2OC(F)F)s1 ZINC000492050469 904776419 /nfs/dbraw/zinc/77/64/19/904776419.db2.gz SSWCLAJBTHBIDA-UHFFFAOYSA-N 0 3 406.296 4.358 20 0 HIADHN CCC(CC)[C@@H](O)CN[C@H](c1cccc(S(C)(=O)=O)c1)c1ccc(C)cc1C ZINC000492078364 904791258 /nfs/dbraw/zinc/79/12/58/904791258.db2.gz HHCXVUQTACGCBN-XZOQPEGZSA-N 0 3 403.588 4.183 20 0 HIADHN CCN1CCCC[C@H]1CN[C@@H](c1cccc(S(C)(=O)=O)c1)c1ccc(C)cc1C ZINC000492194770 904812920 /nfs/dbraw/zinc/81/29/20/904812920.db2.gz HGKKGADUTPWMGL-URXFXBBRSA-N 0 3 414.615 4.260 20 0 HIADHN NC(=O)[C@H]1CCCN1CCCNC(c1ccccc1Cl)c1ccccc1Cl ZINC000492198777 904813691 /nfs/dbraw/zinc/81/36/91/904813691.db2.gz ZGQZHOFPCMXDBR-LJQANCHMSA-N 0 3 406.357 4.012 20 0 HIADHN COc1ccc(OCc2ccccn2)c(CN[C@@H]2CCN(c3ccccc3F)C2)c1 ZINC000492209844 904816041 /nfs/dbraw/zinc/81/60/41/904816041.db2.gz NAZUEOLPDAOPBQ-LJQANCHMSA-N 0 3 407.489 4.177 20 0 HIADHN Cc1cc(Br)cn2c(CN[C@@H](C)[C@H]3OCCc4sccc43)cnc12 ZINC000492226896 904818716 /nfs/dbraw/zinc/81/87/16/904818716.db2.gz PUIISZPTVDOEEK-YVEFUNNKSA-N 0 3 406.349 4.259 20 0 HIADHN Cc1cc(Br)cn2c(CN[C@@H](C)[C@@H]3OCCc4sccc43)cnc12 ZINC000492226889 904819112 /nfs/dbraw/zinc/81/91/12/904819112.db2.gz PUIISZPTVDOEEK-SJCJKPOMSA-N 0 3 406.349 4.259 20 0 HIADHN FC(F)(F)c1ccn(C2CCN(Cc3ccc(OC[C@@H]4CCCO4)cc3)CC2)n1 ZINC000492274297 904827593 /nfs/dbraw/zinc/82/75/93/904827593.db2.gz VGAXEUNWGZOMKO-IBGZPJMESA-N 0 3 409.452 4.297 20 0 HIADHN COC(=O)c1scc(-c2ccc(C)cc2)c1NC(=O)N[C@@H](C)C1=CCN(C)CC1 ZINC000492289155 904828820 /nfs/dbraw/zinc/82/88/20/904828820.db2.gz HZRRNPRVDRGUOG-HNNXBMFYSA-N 0 3 413.543 4.282 20 0 HIADHN O=C(Nc1ccc(-c2nccs2)cc1)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000492876111 904933856 /nfs/dbraw/zinc/93/38/56/904933856.db2.gz OCZGBVPFTYIOMS-UHFFFAOYSA-N 0 3 407.539 4.267 20 0 HIADHN Cc1cc(C(=O)N2CCSCC2)ccc1NC(=O)c1cccc(CN2CCCC2)c1 ZINC000506237390 914858393 /nfs/dbraw/zinc/85/83/93/914858393.db2.gz COOOFMCIYYAQSF-UHFFFAOYSA-N 0 3 423.582 4.032 20 0 HIADHN CCOc1ccc([C@@H](NC[C@H]2CCCS(=O)(=O)C2)c2cccc(Cl)c2)cc1 ZINC000506248929 914862210 /nfs/dbraw/zinc/86/22/10/914862210.db2.gz ZEKNNWIAUXWBMY-IIBYNOLFSA-N 0 3 407.963 4.243 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](NCCCNc2ccccc2)c2ccc(F)cc2)c1 ZINC000493052790 905004663 /nfs/dbraw/zinc/00/46/63/905004663.db2.gz FNVXGMWVXMDDRT-QHCPKHFHSA-N 0 3 412.530 4.410 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)c1c(F)ccc(Br)c1F ZINC000493177457 905041790 /nfs/dbraw/zinc/04/17/90/905041790.db2.gz CIODFEUHVUISLZ-INIZCTEOSA-N 0 3 409.274 4.294 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1cc2n(n1)CCCC2)c1ccc(C(F)(F)F)cc1 ZINC000493231872 905057889 /nfs/dbraw/zinc/05/78/89/905057889.db2.gz RNVRTJHLCNJRLO-GOSISDBHSA-N 0 3 423.483 4.443 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1cc2n(n1)CCCC2)c1ccc(C(F)(F)F)cc1 ZINC000493231876 905058411 /nfs/dbraw/zinc/05/84/11/905058411.db2.gz RNVRTJHLCNJRLO-SFHVURJKSA-N 0 3 423.483 4.443 20 0 HIADHN CCC1(CN[C@H](c2cccc(S(C)(=O)=O)c2)c2ccc(F)c(F)c2)CCOCC1 ZINC000493231980 905059448 /nfs/dbraw/zinc/05/94/48/905059448.db2.gz RXGIQCAOFNUNNL-OAQYLSRUSA-N 0 3 423.525 4.254 20 0 HIADHN Cc1ccc([C@@H](NC[C@H](O)CC(C)(C)C)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000493236201 905059946 /nfs/dbraw/zinc/05/99/46/905059946.db2.gz ZVAQKRPMTHPETL-KNQAVFIVSA-N 0 3 403.588 4.183 20 0 HIADHN Cc1ccc([C@@H](NCCc2ccc3c(c2)CCO3)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000493253923 905068689 /nfs/dbraw/zinc/06/86/89/905068689.db2.gz ZBBSQDQDLNTRNF-RUZDIDTESA-N 0 3 421.562 4.255 20 0 HIADHN Fc1cccc([C@H](NCCCO[C@@H]2CCOC2)c2cccc(Br)c2)c1 ZINC000493275678 905072378 /nfs/dbraw/zinc/07/23/78/905072378.db2.gz AVSRSEONBOJSPM-WOJBJXKFSA-N 0 3 408.311 4.463 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N[C@@H](C)CCCC(F)(F)F)c(C)c2)CC1 ZINC000493332941 905089364 /nfs/dbraw/zinc/08/93/64/905089364.db2.gz DKMPZBXKBHKDGW-INIZCTEOSA-N 0 3 400.489 4.380 20 0 HIADHN Cc1cc(NC(=O)C2CCN(Cc3cn(-c4ccccc4)nc3C(C)(C)C)CC2)no1 ZINC000506273825 914876037 /nfs/dbraw/zinc/87/60/37/914876037.db2.gz RNMMAICPURKBJY-UHFFFAOYSA-N 0 3 421.545 4.317 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)CCc3c4cc(F)ccc4[nH]c3-c3ccccc3)[C@H]2C1 ZINC000493462432 905125796 /nfs/dbraw/zinc/12/57/96/905125796.db2.gz JFILEJBZTRKXGB-SBUREZEXSA-N 0 3 405.517 4.459 20 0 HIADHN COc1cc(C(=O)N2CC[C@H]3CCN(C)C[C@H]32)ccc1OCc1ccc(Cl)cc1 ZINC000493550919 905157664 /nfs/dbraw/zinc/15/76/64/905157664.db2.gz JEOYADMARQEDHO-YLJYHZDGSA-N 0 3 414.933 4.094 20 0 HIADHN COCCSc1ccc([C@H](C)NC(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)cc1 ZINC000493809639 905225553 /nfs/dbraw/zinc/22/55/53/905225553.db2.gz MNTZJTZQTKSLKN-SPEDKVCISA-N 0 3 415.603 4.477 20 0 HIADHN Cc1cc(Br)cc2c1[C@H](NCc1ccc(N3CCO[C@@H](C)C3)nc1)CC2 ZINC000493882184 905242098 /nfs/dbraw/zinc/24/20/98/905242098.db2.gz HVXYSUJLLVXPKS-HNAYVOBHSA-N 0 3 416.363 4.155 20 0 HIADHN O=C1[C@H](N[C@@H]2CCO[C@H]2c2ccc(F)c(F)c2)CCCN1c1ccccc1Cl ZINC000493910110 905261160 /nfs/dbraw/zinc/26/11/60/905261160.db2.gz YTEFCHBDQYPJAU-GGPKGHCWSA-N 0 3 406.860 4.233 20 0 HIADHN CCNC(=O)COc1cccc(CN[C@H]2CCc3cc(Br)cc(C)c32)c1 ZINC000493917550 905268437 /nfs/dbraw/zinc/26/84/37/905268437.db2.gz SBIVDPCVBBZKSR-IBGZPJMESA-N 0 3 417.347 4.050 20 0 HIADHN O=C(Nc1cccc(-n2cccn2)c1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000493943732 905294559 /nfs/dbraw/zinc/29/45/59/905294559.db2.gz VGAUQJSIKOLAOG-NRFANRHFSA-N 0 3 414.431 4.265 20 0 HIADHN COCCC(=O)N1CCC(N[C@@H](c2ccc(F)c(C)c2)c2ccccc2Cl)CC1 ZINC000493996486 905338915 /nfs/dbraw/zinc/33/89/15/905338915.db2.gz KPDNXIXGRRIECV-QHCPKHFHSA-N 0 3 418.940 4.494 20 0 HIADHN C[C@@H]1[C@H](NC(=O)c2ccccc2-c2nc(C(C)(C)C)no2)CCN1Cc1ccccc1 ZINC000493997774 905339920 /nfs/dbraw/zinc/33/99/20/905339920.db2.gz BIAAUNHIWSOPRL-DYESRHJHSA-N 0 3 418.541 4.427 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](N[C@@H]2CCOC3(CCC3)C2)c2ccc(F)cc2)c1 ZINC000494003655 905343217 /nfs/dbraw/zinc/34/32/17/905343217.db2.gz KRVXOMFXHMODIY-CTNGQTDRSA-N 0 3 403.519 4.010 20 0 HIADHN Cn1cc([C@H](NCCCc2nc(-c3ccncc3)cs2)c2cccc(F)c2)cn1 ZINC000494010244 905350387 /nfs/dbraw/zinc/35/03/87/905350387.db2.gz CTYPFJCZOCQXEN-JOCHJYFZSA-N 0 3 407.518 4.390 20 0 HIADHN Cc1ccc(C(=O)N[C@@H]2CCN(Cc3ccccc3)[C@@H]2C)cc1NC(=O)NC(C)(C)C ZINC000494025590 905365538 /nfs/dbraw/zinc/36/55/38/905365538.db2.gz CRRBHSVBSRXSCQ-WIYYLYMNSA-N 0 3 422.573 4.308 20 0 HIADHN C[C@H](SCC(=O)N[C@H]1CCN(Cc2ccccc2)[C@@H]1C)c1nc2ccccc2[nH]1 ZINC000494036304 905375033 /nfs/dbraw/zinc/37/50/33/905375033.db2.gz DJZDQMDXPZYMIZ-AOIWGVFYSA-N 0 3 408.571 4.136 20 0 HIADHN COc1ccc([C@@H](NC2CCC(C(N)=O)CC2)c2ccccc2Cl)cc1OC ZINC000494038634 905380447 /nfs/dbraw/zinc/38/04/47/905380447.db2.gz LSUWLMLLBODVFT-UTKRZORCSA-N 0 3 402.922 4.080 20 0 HIADHN CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NCc1ccc(Br)c(Cl)c1 ZINC000494132921 905476167 /nfs/dbraw/zinc/47/61/67/905476167.db2.gz BECIMGMPEGTJON-SFHVURJKSA-N 0 3 420.738 4.031 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)C[C@H](C)c3c[nH]c4ccccc43)cc2)CC1 ZINC000494273817 905597731 /nfs/dbraw/zinc/59/77/31/905597731.db2.gz LAIXJXOHOVDHGG-IBGZPJMESA-N 0 3 404.558 4.438 20 0 HIADHN COCCN(C)c1ccc(CN[C@H]2c3cc(Br)ccc3CC2(C)C)cn1 ZINC000494325246 905637549 /nfs/dbraw/zinc/63/75/49/905637549.db2.gz DBSOTKCYJCCGML-FQEVSTJZSA-N 0 3 418.379 4.340 20 0 HIADHN OCC1(CN[C@@H](c2cccc(F)c2)c2cccc(Br)c2)CCOCC1 ZINC000494457350 905739162 /nfs/dbraw/zinc/73/91/62/905739162.db2.gz NMQBRJDCIKYDIT-LJQANCHMSA-N 0 3 408.311 4.056 20 0 HIADHN COc1ccccc1[C@H](C)NC(=O)[C@H](C)N[C@H]1CCO[C@@H]1c1ccc(Cl)cc1 ZINC000494462728 905743175 /nfs/dbraw/zinc/74/31/75/905743175.db2.gz HDSFDLGZLCYUBI-PVLSJSCWSA-N 0 3 402.922 4.034 20 0 HIADHN Cc1cccc(S(=O)(=O)CCCN[C@@H]2CCO[C@@H]2c2ccc(Cl)c(F)c2)c1 ZINC000494477755 905759628 /nfs/dbraw/zinc/75/96/28/905759628.db2.gz ROBGSORAWDCIJZ-WOJBJXKFSA-N 0 3 411.926 4.071 20 0 HIADHN Cc1ccc(NC(=O)NC[C@H]2CCCN(Cc3ccc(N4CCCC4)nc3)C2)cc1 ZINC000512463131 921176616 /nfs/dbraw/zinc/17/66/16/921176616.db2.gz OTCYVMOYANDDHB-HXUWFJFHSA-N 0 3 407.562 4.024 20 0 HIADHN Cc1ccc(NC(=O)NC[C@@H]2CCCN(Cc3ccc(N4CCCC4)nc3)C2)cc1 ZINC000512463130 921177128 /nfs/dbraw/zinc/17/71/28/921177128.db2.gz OTCYVMOYANDDHB-FQEVSTJZSA-N 0 3 407.562 4.024 20 0 HIADHN Cc1ccc(-n2cc(CN3CCC[C@@H](CNC(=O)C(C)C)C3)c(C(C)(C)C)n2)cc1 ZINC000512462305 921177589 /nfs/dbraw/zinc/17/75/89/921177589.db2.gz JIALDLLRQFWDQI-FQEVSTJZSA-N 0 3 410.606 4.462 20 0 HIADHN CO[C@@H](c1ccccc1)[C@H](C)NCc1nnc(-c2ccc(Br)cc2)[nH]1 ZINC000494621179 905867317 /nfs/dbraw/zinc/86/73/17/905867317.db2.gz NQWZHSVZUFTFQR-SCLBCKFNSA-N 0 3 401.308 4.100 20 0 HIADHN CC1CCN(CCNC(=O)c2ccccc2SCc2cn3ccccc3n2)CC1 ZINC000512479041 921188731 /nfs/dbraw/zinc/18/87/31/921188731.db2.gz FNVITFBRIUCQBX-UHFFFAOYSA-N 0 3 408.571 4.088 20 0 HIADHN C[C@@H]1CN(C2CCOCC2)CCN1C(=O)N[C@@H](CCc1ccccc1)c1ccccc1 ZINC000494703991 905909480 /nfs/dbraw/zinc/90/94/80/905909480.db2.gz PFHLZQKDFQPEHV-BWKNWUBXSA-N 0 3 421.585 4.255 20 0 HIADHN C[C@@H](NC(=O)N[C@H](CN1CCCC1)c1ccccc1)c1nc(C(F)(F)F)cs1 ZINC000494717057 905920814 /nfs/dbraw/zinc/92/08/14/905920814.db2.gz AXKSZHYPPSUIID-UKRRQHHQSA-N 0 3 412.481 4.359 20 0 HIADHN COC[C@H](NC(=O)N[C@H](CN1CCCC1)c1ccccc1)c1ccc(Cl)cc1 ZINC000494719178 905922248 /nfs/dbraw/zinc/92/22/48/905922248.db2.gz KQXYOEWVJMGWEA-RTWAWAEBSA-N 0 3 401.938 4.164 20 0 HIADHN CCNC(=O)C(C)(C)CN[C@@H](c1cccc(F)c1)c1cccc(Br)c1 ZINC000494730345 905928939 /nfs/dbraw/zinc/92/89/39/905928939.db2.gz LJCRPGKNKYNZIH-GOSISDBHSA-N 0 3 407.327 4.430 20 0 HIADHN CC(C)Sc1ccc([C@H](C)NC(=O)N2CCN(C3CCOCC3)C[C@@H]2C)cc1 ZINC000494922835 906095409 /nfs/dbraw/zinc/09/54/09/906095409.db2.gz XXLUMUDUSKMDBJ-ROUUACIJSA-N 0 3 405.608 4.143 20 0 HIADHN CC(C)[C@@H](C)NC(=O)C1CCN(Cc2c[nH]nc2-c2ccc(C(F)(F)F)cc2)CC1 ZINC000494957971 906129314 /nfs/dbraw/zinc/12/93/14/906129314.db2.gz KUAXJSUJKAGXST-OAHLLOKOSA-N 0 3 422.495 4.468 20 0 HIADHN c1ccc(-c2noc(C3CCN(Cc4ccc(Oc5cnccn5)cc4)CC3)n2)nc1 ZINC000512512452 921208836 /nfs/dbraw/zinc/20/88/36/921208836.db2.gz VJIOMIGTBUOQBX-UHFFFAOYSA-N 0 3 414.469 4.094 20 0 HIADHN COc1ccc([C@H](NC[C@H]2C[C@@H](O)CN2Cc2ccccc2)c2ccc(F)cc2)cc1 ZINC000494971226 906139704 /nfs/dbraw/zinc/13/97/04/906139704.db2.gz PGOGMDPWMCCUSH-DGWZTRNLSA-N 0 3 420.528 4.149 20 0 HIADHN COc1cccc([C@H](NCCC2CCS(=O)(=O)CC2)c2ccccc2Cl)c1 ZINC000494989423 906153874 /nfs/dbraw/zinc/15/38/74/906153874.db2.gz SRIGKGMDQRANBF-NRFANRHFSA-N 0 3 407.963 4.243 20 0 HIADHN C[C@H](CNC(=O)N[C@@H](C)c1nc(C(F)(F)F)cs1)N(C)Cc1ccccc1 ZINC000494996484 906158828 /nfs/dbraw/zinc/15/88/28/906158828.db2.gz IPWNNJWKPUXVDB-OLZOCXBDSA-N 0 3 400.470 4.043 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(C(=O)N(C)C)cc1)c1ccc(NC(=O)c2ccncc2)cc1 ZINC000495046808 906201835 /nfs/dbraw/zinc/20/18/35/906201835.db2.gz HCOPUVAXXYEVIJ-ROUUACIJSA-N 0 3 416.525 4.448 20 0 HIADHN Brc1ccccc1N1CC[C@H](N[C@H](c2nc[nH]n2)C2CCCCC2)C1 ZINC000495074210 906222475 /nfs/dbraw/zinc/22/24/75/906222475.db2.gz ZWXGCEBUYDKOPP-YJBOKZPZSA-N 0 3 404.356 4.057 20 0 HIADHN CN(Cc1c[nH]nc1-c1ccc(C(F)(F)F)cc1)C[C@H](O)COCc1ccccc1 ZINC000495172453 906286707 /nfs/dbraw/zinc/28/67/07/906286707.db2.gz HYFBFBOIMARIQO-FQEVSTJZSA-N 0 3 419.447 4.105 20 0 HIADHN Cc1ccc([C@H](CNC(=O)NCc2ccnc(Oc3ccccc3F)c2)N(C)C)cc1 ZINC000495178191 906288820 /nfs/dbraw/zinc/28/88/20/906288820.db2.gz PQAQBFFYYUBRHO-NRFANRHFSA-N 0 3 422.504 4.424 20 0 HIADHN Clc1cccc([C@H](Cc2cccnc2)NCc2ccc(N3CCOCC3)nc2)c1 ZINC000495258314 906345694 /nfs/dbraw/zinc/34/56/94/906345694.db2.gz ALKOYIXROAHJBA-QFIPXVFZSA-N 0 3 408.933 4.040 20 0 HIADHN COc1ccc(CN(CC(=O)N2CCc3[nH]c4ccccc4c3C2)[C@@H](C)C2CC2)cc1 ZINC000512549626 921230321 /nfs/dbraw/zinc/23/03/21/921230321.db2.gz UORASYWEPRDRHA-SFHVURJKSA-N 0 3 417.553 4.362 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)c2cnc3c(F)ccc(F)c3c2)cc1 ZINC000495345849 906391365 /nfs/dbraw/zinc/39/13/65/906391365.db2.gz ZAENOIRYWKGTGQ-OAQYLSRUSA-N 0 3 411.452 4.089 20 0 HIADHN Cc1coc(-c2cccc(NC(=O)c3ccc(CN4CCC(CO)CC4)cc3)c2)n1 ZINC000495361080 906403101 /nfs/dbraw/zinc/40/31/01/906403101.db2.gz VQLNGICXGAYZRR-UHFFFAOYSA-N 0 3 405.498 4.107 20 0 HIADHN CC(C)(C)C(=O)c1ccc(NC(=O)c2ccc(CN3CCC(CO)CC3)cc2)cc1 ZINC000495408114 906432105 /nfs/dbraw/zinc/43/21/05/906432105.db2.gz MZXLGPVWRFQNLE-UHFFFAOYSA-N 0 3 408.542 4.372 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)C[C@@H](C)NCc1ccc(OC(C)(C)C)nc1 ZINC000495439614 906452213 /nfs/dbraw/zinc/45/22/13/906452213.db2.gz MNJWMQLOXQBNCT-CQSZACIVSA-N 0 3 405.926 4.428 20 0 HIADHN CC(C)(C)c1n[nH]cc1CN1CCC(C(=O)Nc2cccc(Br)c2)CC1 ZINC000512562242 921238209 /nfs/dbraw/zinc/23/82/09/921238209.db2.gz RYLQMMNSIBTLKJ-UHFFFAOYSA-N 0 3 419.367 4.320 20 0 HIADHN CS[C@@H]1CN(C(=O)c2csc(-c3ccc(Cl)cc3Cl)n2)C[C@@H]1N(C)C ZINC000495728403 906534684 /nfs/dbraw/zinc/53/46/84/906534684.db2.gz NNNVLPRXDWMXPA-LSDHHAIUSA-N 0 3 416.399 4.235 20 0 HIADHN CCCc1noc2nc(C3CC3)cc(C(=O)N(CCN(C)C)Cc3ccccc3)c12 ZINC000495917713 906577523 /nfs/dbraw/zinc/57/75/23/906577523.db2.gz PYFCWRGUGWYKTJ-UHFFFAOYSA-N 0 3 406.530 4.257 20 0 HIADHN CC(C)c1ccc(-c2noc(CCC(=O)N(CCN(C)C)Cc3ccccc3)n2)cc1 ZINC000495951649 906583796 /nfs/dbraw/zinc/58/37/96/906583796.db2.gz FNBHJNYMPOOBPL-UHFFFAOYSA-N 0 3 420.557 4.383 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)c2ccccc2NCc2ccco2)CC1 ZINC000496027758 906599883 /nfs/dbraw/zinc/59/98/83/906599883.db2.gz JASXIWPXLCICPQ-SFHVURJKSA-N 0 3 404.514 4.242 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)CCC(=O)c1ccc(C)c(C)c1 ZINC000496261423 906639992 /nfs/dbraw/zinc/63/99/92/906639992.db2.gz IBKPMZPDYUBKAM-QHCPKHFHSA-N 0 3 407.558 4.174 20 0 HIADHN COc1cc(C(=O)N(CCN(C)C)Cc2ccc(F)cc2)ccc1OCC(C)C ZINC000496262934 906642068 /nfs/dbraw/zinc/64/20/68/906642068.db2.gz MTADDFMBFXBEJQ-UHFFFAOYSA-N 0 3 402.510 4.073 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)c1cc2c(cccc2OC(F)F)[nH]1 ZINC000496264990 906642597 /nfs/dbraw/zinc/64/25/97/906642597.db2.gz ULOCLWZBNRWJJP-UHFFFAOYSA-N 0 3 405.420 4.112 20 0 HIADHN CCCN(CCN(C)C)C(=O)c1cc(Oc2cccc(Br)c2)ccn1 ZINC000496304651 906652602 /nfs/dbraw/zinc/65/26/02/906652602.db2.gz OTUZGXQSZZEXBQ-UHFFFAOYSA-N 0 3 406.324 4.050 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)c1cccc(OCc2cccnc2)c1 ZINC000496308391 906654488 /nfs/dbraw/zinc/65/44/88/906654488.db2.gz WVPVIKPNPOMHFU-UHFFFAOYSA-N 0 3 407.489 4.004 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1ncc(Cc2ccccc2F)s1 ZINC000496347650 906662723 /nfs/dbraw/zinc/66/27/23/906662723.db2.gz PFDIZZJCZOSXNQ-UHFFFAOYSA-N 0 3 402.495 4.062 20 0 HIADHN O=C(Nc1ccc(O)cc1)C1CCN(Cc2ccccc2OCc2ccccn2)CC1 ZINC000512609616 921259755 /nfs/dbraw/zinc/25/97/55/921259755.db2.gz OCYGPICIFKNVTP-UHFFFAOYSA-N 0 3 417.509 4.217 20 0 HIADHN CO[C@@H](c1ccccc1Cl)[C@H](C)NCc1ccccc1OCC(=O)N1CCCC1 ZINC000497154218 906813605 /nfs/dbraw/zinc/81/36/05/906813605.db2.gz ZVWMITAIHZJTJI-GAJHUEQPSA-N 0 3 416.949 4.207 20 0 HIADHN Cc1cc(CN(CC(C)C)C(=O)c2cccc(CN(C)C)c2)nc(N2CCCCC2)n1 ZINC000497348892 906845132 /nfs/dbraw/zinc/84/51/32/906845132.db2.gz JAUYDTBIZKBMBV-UHFFFAOYSA-N 0 3 423.605 4.135 20 0 HIADHN CCCOc1ccc(C(=O)N(Cc2ccco2)C2CCN(C)CC2)cc1OCC ZINC000497353647 906847872 /nfs/dbraw/zinc/84/78/72/906847872.db2.gz ODSBHVYHPFGQGT-UHFFFAOYSA-N 0 3 400.519 4.204 20 0 HIADHN COc1ccc(CC[C@@H]2CCCCN2Cc2ccc([S@](C)=O)cc2)cc1OC ZINC000512644039 921271975 /nfs/dbraw/zinc/27/19/75/921271975.db2.gz IHVOWBIUIJABEJ-MMTVBGGISA-N 0 3 401.572 4.429 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)N[C@H](c3ccc(F)cc3)c3ccccc3Cl)[C@@H]2C1 ZINC000497372078 906861552 /nfs/dbraw/zinc/86/15/52/906861552.db2.gz ZGOPREPFVVEVOD-IPHXSNPTSA-N 0 3 401.913 4.304 20 0 HIADHN C/C=C/c1ccc(OC[C@@H](O)CN2CCC(OC3CCCCC3)CC2)c(OC)c1 ZINC000497377259 906865508 /nfs/dbraw/zinc/86/55/08/906865508.db2.gz TYGCPQZXMAACPI-BEGIUABZSA-N 0 3 403.563 4.282 20 0 HIADHN CCC(=O)c1ccc(OCCCCC(=O)N[C@@H]2CN(C)C[C@@H]2c2ccccc2)cc1 ZINC000497435328 906908219 /nfs/dbraw/zinc/90/82/19/906908219.db2.gz OJWAMVGYNXISMS-DHIUTWEWSA-N 0 3 408.542 4.042 20 0 HIADHN COc1ccccc1[C@H](NC(=O)N1CC[C@@H]2CCN(C)C[C@@H]21)c1ccccc1Cl ZINC000497498668 906985008 /nfs/dbraw/zinc/98/50/08/906985008.db2.gz AEQLMKCPUSDJIE-XUEUYAKLSA-N 0 3 413.949 4.174 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)Cc1csc(-c2cccs2)n1 ZINC000512675702 921283907 /nfs/dbraw/zinc/28/39/07/921283907.db2.gz QGEAZCPZWFZTJQ-UHFFFAOYSA-N 0 3 403.548 4.144 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)Cc1csc(-c2cccs2)n1 ZINC000512680068 921285461 /nfs/dbraw/zinc/28/54/61/921285461.db2.gz GYSAOSVQWOGMKS-UHFFFAOYSA-N 0 3 403.548 4.144 20 0 HIADHN CN(C)C(=O)c1cccc(CN2CCCN(Cc3ccc(C(F)(F)F)cc3)CC2)c1 ZINC000497585973 907066538 /nfs/dbraw/zinc/06/65/38/907066538.db2.gz VMLOIOZLULQTQL-UHFFFAOYSA-N 0 3 419.491 4.115 20 0 HIADHN Cc1ccc(CNC(=O)C2CCN(Cc3ccc(Oc4cnccn4)cc3)CC2)cc1 ZINC000512700850 921291961 /nfs/dbraw/zinc/29/19/61/921291961.db2.gz DAMQDQCWMZLFIU-UHFFFAOYSA-N 0 3 416.525 4.106 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)N[C@@H]3CCCc4nc(-c5ccc(F)cc5)sc43)[C@H]2C1 ZINC000497645052 907132675 /nfs/dbraw/zinc/13/26/75/907132675.db2.gz YJQAZBFJFQTDSV-ZMYBRWDISA-N 0 3 414.550 4.062 20 0 HIADHN Cc1ccccc1[C@H](NC(=O)N(C)CCCN1CCN(C)CC1)[C@@H]1CCC[C@@H](C)C1 ZINC000497666833 907161234 /nfs/dbraw/zinc/16/12/34/907161234.db2.gz ABAWJVBVPIBCEP-KIFXHHALSA-N 0 3 414.638 4.141 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2cnn(CC(C)C)c2C2CC2)c1 ZINC000497666520 907162604 /nfs/dbraw/zinc/16/26/04/907162604.db2.gz SFQSMRQZJQWOBI-UHFFFAOYSA-N 0 3 413.566 4.021 20 0 HIADHN COc1cccc([C@@H](CNC(=O)Cc2cc(Cl)ccc2Cl)N2CCCC2)c1 ZINC000497703009 907207445 /nfs/dbraw/zinc/20/74/45/907207445.db2.gz WJDJXOVSWJGZAM-HXUWFJFHSA-N 0 3 407.341 4.498 20 0 HIADHN C[C@@H](NC(=O)c1oc2ccccc2c1CN(C)C)c1ccc(NC(=O)NC2CC2)cc1 ZINC000497808538 907293402 /nfs/dbraw/zinc/29/34/02/907293402.db2.gz PEHFVBCXARWZLP-OAHLLOKOSA-N 0 3 420.513 4.269 20 0 HIADHN C[C@@H]1CN(CCCN[C@@H](c2ccco2)c2ccc(Br)cc2)C[C@@H](C)O1 ZINC000497830165 907311181 /nfs/dbraw/zinc/31/11/81/907311181.db2.gz YGXNVGVFIPHVLG-JXXFODFXSA-N 0 3 407.352 4.220 20 0 HIADHN CCOc1ccc(CN(C)C(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)cc1 ZINC000512801971 921314271 /nfs/dbraw/zinc/31/42/71/921314271.db2.gz JIVHTGURLWKEAG-HSZRJFAPSA-N 0 3 413.562 4.317 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)C(=O)Nc1cc(C(F)F)ccc1Cl)c1ccccc1 ZINC000497878734 907353619 /nfs/dbraw/zinc/35/36/19/907353619.db2.gz BJVTUZHNPZFPIK-SFHVURJKSA-N 0 3 423.891 4.415 20 0 HIADHN CCOC1CC2(C1)CCN(CC(=O)N(Cc1ccc(C(F)(F)F)cc1)C1CC1)C2 ZINC000512811709 921317664 /nfs/dbraw/zinc/31/76/64/921317664.db2.gz JZCLORJIJVWMHE-UHFFFAOYSA-N 0 3 410.480 4.087 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)c1cc(=O)[nH]c2ccccc21 ZINC000497897297 907370825 /nfs/dbraw/zinc/37/08/25/907370825.db2.gz IFFJTDPKNGGSEN-UHFFFAOYSA-N 0 3 417.431 4.163 20 0 HIADHN CC(C)(C)c1nc(CCNC(=O)NC[C@@H](c2ccccc2)N2CCCC2)cs1 ZINC000497941507 907408398 /nfs/dbraw/zinc/40/83/98/907408398.db2.gz YOEFIIIPLCXFQV-IBGZPJMESA-N 0 3 400.592 4.119 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)[C@@H](C)Sc3ccccc3)CC2)c1 ZINC000497967414 907435541 /nfs/dbraw/zinc/43/55/41/907435541.db2.gz CWPFLJHDUJTDSD-OAQYLSRUSA-N 0 3 411.615 4.194 20 0 HIADHN COc1cc(CN[C@H](C)c2ccc3c(c2)OCCCO3)cc(Br)c1OC ZINC000512821064 921325272 /nfs/dbraw/zinc/32/52/72/921325272.db2.gz LSUJPEGMGYPGPH-CYBMUJFWSA-N 0 3 422.319 4.478 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)N2C[C@H](C)C[C@H]2c2cccnc2)N(C)C)cc1 ZINC000512822415 921327211 /nfs/dbraw/zinc/32/72/11/921327211.db2.gz VLQWQMPLGNHEFU-YFXJRYMSSA-N 0 3 410.562 4.264 20 0 HIADHN OCCn1nccc1C1CCN(Cc2c(OC(F)F)ccc3ccccc32)CC1 ZINC000512824159 921328439 /nfs/dbraw/zinc/32/84/39/921328439.db2.gz OSQMICWSCRFSNQ-UHFFFAOYSA-N 0 3 401.457 4.010 20 0 HIADHN CC[C@@H](CNC(=O)CCc1ccc(OC)c(Cl)c1)N1CCc2ccccc2C1 ZINC000498054343 907564651 /nfs/dbraw/zinc/56/46/51/907564651.db2.gz JCCWQIXLKPBMCE-FQEVSTJZSA-N 0 3 400.950 4.234 20 0 HIADHN CCCOc1ccc([C@H](C)NC(=O)N2CC[C@@H]3CCN(C)C[C@@H]32)cc1OCCC ZINC000498129145 907648218 /nfs/dbraw/zinc/64/82/18/907648218.db2.gz YLWUTDSPFRONAC-BJLQDIEVSA-N 0 3 403.567 4.061 20 0 HIADHN O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)[C@H]1C[C@H]1c1ccc(Br)cc1 ZINC000498161877 907688944 /nfs/dbraw/zinc/68/89/44/907688944.db2.gz HKDQYWNYDCEQEF-HKBOAZHASA-N 0 3 413.359 4.333 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N[C@@H](c2cccc(F)c2)c2ccccn2)N(C)C)cc1 ZINC000498250050 907786653 /nfs/dbraw/zinc/78/66/53/907786653.db2.gz HEWIGQIYRQXRBB-PKTZIBPZSA-N 0 3 406.505 4.221 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N[C@@H](c2cccc(F)c2)c2ccccn2)N(C)C)cc1 ZINC000498250049 907786726 /nfs/dbraw/zinc/78/67/26/907786726.db2.gz HEWIGQIYRQXRBB-GOTSBHOMSA-N 0 3 406.505 4.221 20 0 HIADHN C[C@H](NCc1ccc(OCc2c(F)cccc2Cl)cc1)C1(S(C)(=O)=O)CC1 ZINC000512852323 921357139 /nfs/dbraw/zinc/35/71/39/921357139.db2.gz ULYXYOXKIOQXHM-AWEZNQCLSA-N 0 3 411.926 4.113 20 0 HIADHN CCC(CC)[C@H]1C[C@@H](NC(=O)N(CCN(C)C)Cc2ccc(F)cc2F)CCO1 ZINC000498391369 907875952 /nfs/dbraw/zinc/87/59/52/907875952.db2.gz XJSHDLRQGAKDJD-PZJWPPBQSA-N 0 3 411.537 4.022 20 0 HIADHN O=C(NCc1ccccc1N1CCCCC1)N1CCCN(Cc2ccccc2)CC1 ZINC000498462023 907927654 /nfs/dbraw/zinc/92/76/54/907927654.db2.gz HUVUUOZUJGKKLU-UHFFFAOYSA-N 0 3 406.574 4.094 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)NCc2cc(F)c(C(F)(F)F)cc2F)o1 ZINC000512872347 921371335 /nfs/dbraw/zinc/37/13/35/921371335.db2.gz MKYFQOKTJXNKOD-UHFFFAOYSA-N 0 3 419.394 4.158 20 0 HIADHN CC(C)(CC(=O)NCCCCN1CCN(Cc2ccccc2)CC1)c1ccccc1 ZINC000498621160 908067035 /nfs/dbraw/zinc/06/70/35/908067035.db2.gz ZTHJTZNNUYIGTC-UHFFFAOYSA-N 0 3 407.602 4.069 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)N[C@H](C)c2ccc(-c3ccncc3)cc2)cc1 ZINC000498714791 908140424 /nfs/dbraw/zinc/14/04/24/908140424.db2.gz MIDZREMTVYABHG-KOSHJBKYSA-N 0 3 418.541 4.420 20 0 HIADHN Cc1ccc(-c2cc(C(=O)N3CCN(C)CC[C@@H]3C)c3cnn(C(C)C)c3n2)cc1 ZINC000498738743 908166927 /nfs/dbraw/zinc/16/69/27/908166927.db2.gz RJORDOQJJATDJG-SFHVURJKSA-N 0 3 405.546 4.154 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)NC[C@@H]1CCCO[C@@H]1c1ccc(C)cc1)c1ccco1 ZINC000498739486 908168375 /nfs/dbraw/zinc/16/83/75/908168375.db2.gz UPBJQCFBIAYSOW-VXPBHUBDSA-N 0 3 413.562 4.484 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2C(=O)N2CCN(C)CC[C@@H]2C)c(C)c1 ZINC000498741338 908170490 /nfs/dbraw/zinc/17/04/90/908170490.db2.gz YIJKPMLELOGWED-FQEVSTJZSA-N 0 3 402.542 4.322 20 0 HIADHN CN(C)Cc1cccc(C(=O)N2CCN(CCc3ccc(Cl)c(Cl)c3)CC2)c1 ZINC000498780854 908197488 /nfs/dbraw/zinc/19/74/88/908197488.db2.gz QGSPQZHAASFKRM-UHFFFAOYSA-N 0 3 420.384 4.056 20 0 HIADHN CC[C@H](NCc1cnc2ccc(Br)cn12)c1ccc(OC)c(OC)c1 ZINC000512898698 921391483 /nfs/dbraw/zinc/39/14/83/921391483.db2.gz IHRLABJSOHLEFU-INIZCTEOSA-N 0 3 404.308 4.355 20 0 HIADHN Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)NC[C@H](c1ccccc1)N1CCCC1 ZINC000498824891 908232136 /nfs/dbraw/zinc/23/21/36/908232136.db2.gz GEXSWDBVAWAVAT-HSZRJFAPSA-N 0 3 420.557 4.190 20 0 HIADHN Cc1cc(C)n(Cc2cccc(C(=O)NC[C@@H]3CCCCN3Cc3ccccc3)c2)n1 ZINC000498897278 908304009 /nfs/dbraw/zinc/30/40/09/908304009.db2.gz WAHCJBUSPNVDJW-VWLOTQADSA-N 0 3 416.569 4.333 20 0 HIADHN Cc1cc(C(=O)NC[C@@H]2CCCCN2Cc2ccccc2)c(C)n1Cc1ccccn1 ZINC000498902247 908309871 /nfs/dbraw/zinc/30/98/71/908309871.db2.gz WAKKSUNHAPXLCZ-DEOSSOPVSA-N 0 3 416.569 4.333 20 0 HIADHN CC[C@H](C)Sc1ccc(NC(=O)C(=O)NC[C@@H](C)N2CCCC[C@H]2C)c(C)c1 ZINC000498968424 908361067 /nfs/dbraw/zinc/36/10/67/908361067.db2.gz CJNCHOKCBWQUGL-KURKYZTESA-N 0 3 405.608 4.203 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)N[C@@H](c2cccc(C)c2)c2ccccn2)o1 ZINC000499000188 908378326 /nfs/dbraw/zinc/37/83/26/908378326.db2.gz PSUXFKPMTJXTKS-QHCPKHFHSA-N 0 3 406.530 4.154 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)N[C@H](c2cccc(C)c2)c2ccccn2)o1 ZINC000499000182 908378379 /nfs/dbraw/zinc/37/83/79/908378379.db2.gz PSUXFKPMTJXTKS-HSZRJFAPSA-N 0 3 406.530 4.154 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)N[C@H](c2cccc(F)c2)c2ccccn2)CN1Cc1ccccc1 ZINC000499025388 908399701 /nfs/dbraw/zinc/39/97/01/908399701.db2.gz GTUSGFHACWELIB-IHLLOCCUSA-N 0 3 418.516 4.272 20 0 HIADHN Cc1cccc([C@H](NC(=O)N(CCN(C)C)Cc2cccc(F)c2)c2ccccn2)c1 ZINC000499029175 908404423 /nfs/dbraw/zinc/40/44/23/908404423.db2.gz PVOCGOJGGVNJPT-DEOSSOPVSA-N 0 3 420.532 4.392 20 0 HIADHN Cc1cccc([C@H](NC(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)c2ccccn2)c1 ZINC000499030940 908406417 /nfs/dbraw/zinc/40/64/17/908406417.db2.gz VFYSDFLPADAWDO-ZWSUVBHBSA-N 0 3 414.553 4.442 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)N2CC[C@@H](C(F)(F)F)C2(C)C)N(C)C)cc1 ZINC000512918664 921412361 /nfs/dbraw/zinc/41/23/61/921412361.db2.gz ROJKXJJVRXHPIW-ZWKOTPCHSA-N 0 3 415.500 4.449 20 0 HIADHN Cc1ccc([C@H](CNC(=O)CSCc2coc(-c3ccccc3)n2)N(C)C)cc1 ZINC000499136559 908493373 /nfs/dbraw/zinc/49/33/73/908493373.db2.gz XCGVCGOCGVSACM-NRFANRHFSA-N 0 3 409.555 4.302 20 0 HIADHN Cc1noc(C)c1CSc1ncccc1C(=O)NC[C@H](c1ccc(C)cc1)N(C)C ZINC000499167827 908520193 /nfs/dbraw/zinc/52/01/93/908520193.db2.gz MDHQUDCMULGIJY-OAQYLSRUSA-N 0 3 424.570 4.320 20 0 HIADHN C[C@@H](C(=O)NCCCN1CCc2ccccc2C1)c1ccc(Br)cc1 ZINC000499194785 908548918 /nfs/dbraw/zinc/54/89/18/908548918.db2.gz PVHNKLPFRSYNSW-MRXNPFEDSA-N 0 3 401.348 4.117 20 0 HIADHN CCOc1cccc(CNC(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)c1OC(F)F ZINC000499210827 908565296 /nfs/dbraw/zinc/56/52/96/908565296.db2.gz LLECZORQLQXJJO-DNVCBOLYSA-N 0 3 421.488 4.177 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)c1cccc(OC[C@H]2CCCO2)c1 ZINC000499258336 908633750 /nfs/dbraw/zinc/63/37/50/908633750.db2.gz ZWQYKGTVLZKMIK-JOCHJYFZSA-N 0 3 416.949 4.102 20 0 HIADHN CN(C(=O)NCC(C)(C)C1CCCCC1)C1CCN(CCc2ccccn2)CC1 ZINC000499309840 908685201 /nfs/dbraw/zinc/68/52/01/908685201.db2.gz MMYYSCJXURCMNS-UHFFFAOYSA-N 0 3 400.611 4.336 20 0 HIADHN Cc1cccnc1[C@@H](NC(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F)C(C)C ZINC000512944574 921430487 /nfs/dbraw/zinc/43/04/87/921430487.db2.gz FHGWWBDGSNOKPT-UXHICEINSA-N 0 3 401.501 4.361 20 0 HIADHN C[C@@H](NC(=O)NCCc1csc(-c2ccccc2)n1)[C@@H](c1ccccc1)N(C)C ZINC000499333217 908708242 /nfs/dbraw/zinc/70/82/42/908708242.db2.gz CRPNIFBQYMNUER-UTKZUKDTSA-N 0 3 408.571 4.343 20 0 HIADHN O=C(NC[C@H]1CCCC(F)(F)C1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000499558946 908840282 /nfs/dbraw/zinc/84/02/82/908840282.db2.gz MGMCPHCDFAQMHA-FUHWJXTLSA-N 0 3 404.423 4.383 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)NCc2nc(C(C)C)cs2)N(C)C)cc1 ZINC000499566915 908842845 /nfs/dbraw/zinc/84/28/45/908842845.db2.gz PGEAMOOVBLHGQY-LJQANCHMSA-N 0 3 404.580 4.156 20 0 HIADHN C[C@@H]1C[C@H](NCc2nnc3c(Cl)cc(C(F)(F)F)cn23)CN1Cc1ccccc1 ZINC000499661581 908868159 /nfs/dbraw/zinc/86/81/59/908868159.db2.gz DAKUIVWVAAJCAW-CJNGLKHVSA-N 0 3 423.870 4.154 20 0 HIADHN COc1cccc2c1CC[C@@H]2NC(=O)NC[C@@H](c1ccc(OC(C)C)cc1)N(C)C ZINC000499700181 908880950 /nfs/dbraw/zinc/88/09/50/908880950.db2.gz WCARSEIWCHQXJF-VXKWHMMOSA-N 0 3 411.546 4.072 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCc1ccc(OC2CCCC2)nc1)c1ccsc1 ZINC000499750683 908898559 /nfs/dbraw/zinc/89/85/59/908898559.db2.gz SMRZAOWIKJSKGB-HXUWFJFHSA-N 0 3 416.591 4.347 20 0 HIADHN COc1ccc(-c2ccc(C)c(NC(=O)CC3(N4CCOCC4)CCCC3)c2)cn1 ZINC000512986846 921455240 /nfs/dbraw/zinc/45/52/40/921455240.db2.gz YRYUKRUUDNMVOH-UHFFFAOYSA-N 0 3 409.530 4.039 20 0 HIADHN O=C(c1cc(Cl)c[nH]1)N1CCC(NCc2csc(-c3cccs3)n2)CC1 ZINC000512989350 921457336 /nfs/dbraw/zinc/45/73/36/921457336.db2.gz SQTVCOHJGMMTAB-UHFFFAOYSA-N 0 3 406.964 4.248 20 0 HIADHN Cc1nc(-c2ccc(Cl)s2)sc1C(=O)N(CCN(C)C)C[C@H]1CCCO1 ZINC000499930837 909039016 /nfs/dbraw/zinc/03/90/16/909039016.db2.gz QBZIZTSGMUNWBW-CYBMUJFWSA-N 0 3 413.996 4.016 20 0 HIADHN C[C@@H](NCc1cc(Br)c2c(c1)OCCCO2)c1ccc2n[nH]cc2c1 ZINC000513031113 921490367 /nfs/dbraw/zinc/49/03/67/921490367.db2.gz BSJFLHHJCMGSJB-GFCCVEGCSA-N 0 3 402.292 4.338 20 0 HIADHN Cc1cc(Br)cc(C)c1N1CCC[C@H](NC/C=C/c2ccncc2)C1=O ZINC000513034780 921493649 /nfs/dbraw/zinc/49/36/49/921493649.db2.gz CXZJHTPLLPZLJP-JUGMSXHOSA-N 0 3 414.347 4.259 20 0 HIADHN CCN(C(=O)c1nnn(-c2cccc(C)c2)c1C)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000499997327 909450109 /nfs/dbraw/zinc/45/01/09/909450109.db2.gz FHQGWYVNEXJLFI-CVDCTZTESA-N 0 3 417.557 4.182 20 0 HIADHN COc1cc(CN2CCC[C@H](CNC(=O)c3ccccc3)C2)c(SC)cc1OC ZINC000513041238 921500460 /nfs/dbraw/zinc/50/04/60/921500460.db2.gz OIOAXSOFDANWDV-QGZVFWFLSA-N 0 3 414.571 4.068 20 0 HIADHN Cc1ccc(NC(=O)C2CCN(Cc3cccc(C(=O)OC(C)(C)C)c3)CC2)nc1 ZINC000500120997 909601495 /nfs/dbraw/zinc/60/14/95/909601495.db2.gz FBBCITNAAWRQFU-UHFFFAOYSA-N 0 3 409.530 4.196 20 0 HIADHN CCN(Cc1ccc(OC)c(OC)c1)C(=O)CN1CCC[C@H]1Cc1ccc(C)cc1 ZINC000500232296 909721460 /nfs/dbraw/zinc/72/14/60/909721460.db2.gz DIKDXXACRIPTSW-QFIPXVFZSA-N 0 3 410.558 4.068 20 0 HIADHN C[C@@H]1C[C@@H]1c1ccc([C@H]2C[C@H]2C(=O)N(C)C2CCN(CCc3ccccn3)CC2)o1 ZINC000500330845 909790081 /nfs/dbraw/zinc/79/00/81/909790081.db2.gz CIQVFXURLRMQSR-KDXIVRHGSA-N 0 3 407.558 4.067 20 0 HIADHN C[S@@](=O)Cc1ccc(CNCc2cn(-c3ccccc3)nc2-c2ccncc2)cc1 ZINC000513069080 921524868 /nfs/dbraw/zinc/52/48/68/921524868.db2.gz MBUIBTKBKOIDSE-SSEXGKCCSA-N 0 3 416.550 4.103 20 0 HIADHN C[C@H](NC(=O)N[C@@H](CN1CCCC1)c1ccccc1)c1ccccc1OC(F)F ZINC000500381756 909826651 /nfs/dbraw/zinc/82/66/51/909826651.db2.gz GFLTYJGQGZIDCX-LPHOPBHVSA-N 0 3 403.473 4.485 20 0 HIADHN C[C@H](NC(=O)N(Cc1ccco1)C1CCN(C)CC1)c1ccccc1OC(F)F ZINC000500386117 909827627 /nfs/dbraw/zinc/82/76/27/909827627.db2.gz SUUAWYOWLAUWTH-HNNXBMFYSA-N 0 3 407.461 4.248 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)c2cccc(OCC(F)(F)F)c2)cc1 ZINC000500410112 909842820 /nfs/dbraw/zinc/84/28/20/909842820.db2.gz RJLYIMKDTFOFEG-FQEVSTJZSA-N 0 3 422.447 4.203 20 0 HIADHN CCc1nnc(NC(=O)[C@H](C)[C@H](C)NCc2ccc(-c3ccc(F)cc3)o2)s1 ZINC000513075072 921529459 /nfs/dbraw/zinc/52/94/59/921529459.db2.gz JWXRJHSVJUIOPT-OLZOCXBDSA-N 0 3 402.495 4.253 20 0 HIADHN Cc1nc2ccccn2c1CNCc1ccc(I)c(Cl)c1 ZINC000500449018 909867450 /nfs/dbraw/zinc/86/74/50/909867450.db2.gz SVTWTHYKCKHNHA-UHFFFAOYSA-N 0 3 411.674 4.191 20 0 HIADHN CCC[C@@H](NCCC(=O)N(C)Cc1ccccc1Br)c1ccccn1 ZINC000500615667 909966870 /nfs/dbraw/zinc/96/68/70/909966870.db2.gz IDROJEYSBDZHFI-GOSISDBHSA-N 0 3 404.352 4.324 20 0 HIADHN C[S@@](=O)Cc1ccc(CNCc2c[nH]nc2-c2ccc(C(F)(F)F)cc2)cc1 ZINC000513089456 921539380 /nfs/dbraw/zinc/53/93/80/921539380.db2.gz OFOGLYPQFNFJAG-MUUNZHRXSA-N 0 3 407.461 4.264 20 0 HIADHN C[S@@](=O)Cc1ccc(CNCc2cn(-c3ccccc3)nc2-c2cccnc2)cc1 ZINC000513088939 921539494 /nfs/dbraw/zinc/53/94/94/921539494.db2.gz KLGOCULGGIYGCS-SSEXGKCCSA-N 0 3 416.550 4.103 20 0 HIADHN CCN1CCN(Cc2ccc(CNC(=O)N[C@@H](C)c3cc4ccccc4o3)cc2)CC1 ZINC000500689084 910023974 /nfs/dbraw/zinc/02/39/74/910023974.db2.gz QVPPZJDLRANKEQ-IBGZPJMESA-N 0 3 420.557 4.131 20 0 HIADHN CC[C@H](C)c1ccccc1N1C[C@H](C(=O)N(CC(C)C)C2CCN(C)CC2)CC1=O ZINC000500720045 910039410 /nfs/dbraw/zinc/03/94/10/910039410.db2.gz KKILNOKAXRRPFK-VQTJNVASSA-N 0 3 413.606 4.132 20 0 HIADHN CCc1nnc(NC(=O)[C@@H](C)[C@@H](C)NCc2ccc(-c3ccccc3F)o2)s1 ZINC000513093402 921543057 /nfs/dbraw/zinc/54/30/57/921543057.db2.gz AFVOQAGKEPNMGK-QWHCGFSZSA-N 0 3 402.495 4.253 20 0 HIADHN COc1cc(C2(C(=O)Nc3ccc(CCN4CCSCC4)cc3)CC2)ccc1C ZINC000500805584 910092018 /nfs/dbraw/zinc/09/20/18/910092018.db2.gz CHFRJTILQRFYOV-UHFFFAOYSA-N 0 3 410.583 4.265 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)CCOc2ccccc2Br)C1 ZINC000500862492 910136273 /nfs/dbraw/zinc/13/62/73/910136273.db2.gz YSMKDEURXZLJTI-WMZOPIPTSA-N 0 3 417.347 4.170 20 0 HIADHN CC1(C)CN(Cc2ccccc2)CC[C@@H]1NC(=O)CCC(=O)c1ccc(F)cc1F ZINC000513104731 921553058 /nfs/dbraw/zinc/55/30/58/921553058.db2.gz MJIZLRYXNFXUEC-QFIPXVFZSA-N 0 3 414.496 4.345 20 0 HIADHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)c1cc2ccccc2o1 ZINC000500969317 910213081 /nfs/dbraw/zinc/21/30/81/910213081.db2.gz VCVLUUDUJISJSS-UHFFFAOYSA-N 0 3 401.304 4.399 20 0 HIADHN CCOc1ccc(C(C)=O)cc1CNC(C)(C)COc1ncccc1Br ZINC000501050318 910261115 /nfs/dbraw/zinc/26/11/15/910261115.db2.gz LIHBJCYQSKIKCS-UHFFFAOYSA-N 0 3 421.335 4.393 20 0 HIADHN CC1CCN(C(=O)C2CCN(Cc3cccc(C(=O)OC(C)(C)C)c3)CC2)CC1 ZINC000501089469 910289055 /nfs/dbraw/zinc/28/90/55/910289055.db2.gz JQAGJRIRQXKJKF-UHFFFAOYSA-N 0 3 400.563 4.112 20 0 HIADHN Cc1cccc([C@H](NC(=O)N[C@@H]2CCN(Cc3ccccc3)[C@@H]2C)c2ccccn2)c1 ZINC000501090091 910289981 /nfs/dbraw/zinc/28/99/81/910289981.db2.gz RQRJDKPZQVKDAE-XRODADMRSA-N 0 3 414.553 4.442 20 0 HIADHN C[C@H](NC(=O)N[C@H](c1cccc(F)c1)c1ccccn1)[C@@H](c1ccccc1)N(C)C ZINC000501093650 910291108 /nfs/dbraw/zinc/29/11/08/910291108.db2.gz ZBHBURAWOYJCLD-IMRHEYAYSA-N 0 3 406.505 4.301 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCc1ccnc(N2CCCCC2)c1)c1ccsc1 ZINC000501110588 910299555 /nfs/dbraw/zinc/29/95/55/910299555.db2.gz VJEDUJCZNDMUCQ-HXUWFJFHSA-N 0 3 415.607 4.016 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCO[C@@H](c2ccc(F)cc2)C1)c1ccsc1 ZINC000501132737 910314302 /nfs/dbraw/zinc/31/43/02/910314302.db2.gz IOTZKODRBJKNKO-WOJBJXKFSA-N 0 3 405.539 4.053 20 0 HIADHN Cc1c(NC(=O)N[C@H](CN2CCCC2)c2ccccc2)cccc1C(=O)N1CCCC1 ZINC000501169268 910338383 /nfs/dbraw/zinc/33/83/83/910338383.db2.gz IMXLDPDYUWAZNA-HSZRJFAPSA-N 0 3 420.557 4.190 20 0 HIADHN Cc1c(NC(=O)NC[C@H](c2ccccc2)N2CCCC2)cccc1C(=O)N1CCCC1 ZINC000501172510 910341495 /nfs/dbraw/zinc/34/14/95/910341495.db2.gz YBZPWWYQQACGLP-HSZRJFAPSA-N 0 3 420.557 4.190 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2cccc(NC(=O)c3ccoc3)c2)N(C)C)cc1 ZINC000501182372 910349320 /nfs/dbraw/zinc/34/93/20/910349320.db2.gz RHQJGJNOWHGREF-OAQYLSRUSA-N 0 3 406.486 4.265 20 0 HIADHN CN(C)CCN(CC1CCCCC1)C(=O)CCc1nc(-c2ccc(Cl)cc2)no1 ZINC000501240327 910398899 /nfs/dbraw/zinc/39/88/99/910398899.db2.gz NLEVPHYWKBHXFG-UHFFFAOYSA-N 0 3 418.969 4.293 20 0 HIADHN CN(C(=O)c1ccc(-c2noc(C(F)F)n2)cc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000501282410 910444996 /nfs/dbraw/zinc/44/49/96/910444996.db2.gz XZLFEULMMIBLJY-SFHVURJKSA-N 0 3 412.440 4.021 20 0 HIADHN Cc1ccc(NC(=O)C2CCN(CCOc3ccc(C(F)(F)F)cc3)CC2)nc1 ZINC000501303939 910457304 /nfs/dbraw/zinc/45/73/04/910457304.db2.gz YYTBESUGSHWREQ-UHFFFAOYSA-N 0 3 407.436 4.138 20 0 HIADHN CC[C@H](CNC(=O)Nc1cccc(CN(CC)C(C)=O)c1)N1CCc2ccccc2C1 ZINC000501330756 910473373 /nfs/dbraw/zinc/47/33/73/910473373.db2.gz UVKFKGWMICFJCA-XMMPIXPASA-N 0 3 422.573 4.013 20 0 HIADHN CC[C@H](CNC(=O)Nc1cc2c(cc1Cl)OCCO2)N1CCc2ccccc2C1 ZINC000501346698 910484519 /nfs/dbraw/zinc/48/45/19/910484519.db2.gz GWGJDRQKHLBWRV-QGZVFWFLSA-N 0 3 415.921 4.070 20 0 HIADHN CC[C@H](CNC(=O)Nc1cccc(N2CCCCC2=O)c1)N1CCc2ccccc2C1 ZINC000501348794 910485798 /nfs/dbraw/zinc/48/57/98/910485798.db2.gz FGHRQDDIXRBRPO-JOCHJYFZSA-N 0 3 420.557 4.162 20 0 HIADHN CC[C@@H](CNC(=O)N1CCC[C@@H]1c1ccc(OC)cc1)N1CCc2ccccc2C1 ZINC000501378831 910508171 /nfs/dbraw/zinc/50/81/71/910508171.db2.gz SPELEEYTRKDYEA-LADGPHEKSA-N 0 3 407.558 4.379 20 0 HIADHN CC[C@H](C)n1ncc2c1nc(C)cc2C(=O)N(Cc1ccco1)C1CCN(C)CC1 ZINC000501379952 910510050 /nfs/dbraw/zinc/51/00/50/910510050.db2.gz AQTAPAOKOXZGOB-KRWDZBQOSA-N 0 3 409.534 4.040 20 0 HIADHN COc1cccc(CN(Cc2cc(OC)cc3c2O[C@H](C)C3)C2CCC(O)CC2)c1 ZINC000513144628 921582854 /nfs/dbraw/zinc/58/28/54/921582854.db2.gz MMHJBBBLNYQQMP-PPNDLDFTSA-N 0 3 411.542 4.333 20 0 HIADHN COc1ccc([C@H](CNC(=O)Nc2ccc(-c3ncco3)cc2)N2CCCC2)cc1 ZINC000501397666 910525527 /nfs/dbraw/zinc/52/55/27/910525527.db2.gz SWGKBLKWGYNSRJ-NRFANRHFSA-N 0 3 406.486 4.309 20 0 HIADHN CC[C@@H](CNC(=O)N1CCC(c2ccc(O)cc2)CC1)N1CCc2ccccc2C1 ZINC000501402403 910533662 /nfs/dbraw/zinc/53/36/62/910533662.db2.gz BFURWDLFCVBSCV-QHCPKHFHSA-N 0 3 407.558 4.118 20 0 HIADHN CCC(CC)[C@@H]1C[C@@H](NC(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)CCO1 ZINC000501403791 910536778 /nfs/dbraw/zinc/53/67/78/910536778.db2.gz DOTAGTJPSDTZAS-PMVMPFDFSA-N 0 3 419.610 4.360 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)C(=O)Nc1cccc2ccsc21 ZINC000501417474 910549735 /nfs/dbraw/zinc/54/97/35/910549735.db2.gz BEACBFVVXCWLHW-UHFFFAOYSA-N 0 3 415.946 4.084 20 0 HIADHN COC(=O)CCC[C@@H]1CCC[C@@H](N[C@H](C)c2nc(-c3ccccc3OC)no2)C1 ZINC000513157662 921590796 /nfs/dbraw/zinc/59/07/96/921590796.db2.gz CPZIPLHTNWCHBB-IXDOHACOSA-N 0 3 401.507 4.298 20 0 HIADHN CC(C)Cn1ncc(NC(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)c1C(C)C ZINC000501614479 910716358 /nfs/dbraw/zinc/71/63/58/910716358.db2.gz BDGAWTALZHYGSH-UHFFFAOYSA-N 0 3 411.594 4.445 20 0 HIADHN CN(C)[C@@H](CNC(=O)Nc1cc(Cl)ccc1N1CCSCC1)c1ccccc1 ZINC000501623811 910724459 /nfs/dbraw/zinc/72/44/59/910724459.db2.gz MCGOHDLBOYXRNI-FQEVSTJZSA-N 0 3 418.994 4.318 20 0 HIADHN CN(C)[C@H](CNC(=O)Nc1cc(Cl)ccc1N1CCSCC1)c1ccccc1 ZINC000501623812 910724716 /nfs/dbraw/zinc/72/47/16/910724716.db2.gz MCGOHDLBOYXRNI-HXUWFJFHSA-N 0 3 418.994 4.318 20 0 HIADHN CC(=O)Nc1ccc(CN2CCC[C@H](c3n[nH]cc3NC(=O)c3ccccc3)C2)cc1 ZINC000501713517 910781636 /nfs/dbraw/zinc/78/16/36/910781636.db2.gz LBZRIYSGYZFBDQ-FQEVSTJZSA-N 0 3 417.513 4.000 20 0 HIADHN Cc1ccc(NC(=O)NCCCN2CCc3ccccc3C2)c(Br)c1 ZINC000501775410 910829654 /nfs/dbraw/zinc/82/96/54/910829654.db2.gz KKORIMWPSYPOBL-UHFFFAOYSA-N 0 3 402.336 4.327 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)[C@@H](C)CN1Cc1nc2c3ccccc3oc2c(=O)[nH]1 ZINC000501784578 910839046 /nfs/dbraw/zinc/83/90/46/910839046.db2.gz HUJGTSJXBYZWSR-DLBZAZTESA-N 0 3 402.498 4.176 20 0 HIADHN CN(Cc1ccc(Br)cc1)C(=O)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000501795200 910847305 /nfs/dbraw/zinc/84/73/05/910847305.db2.gz DGUMGKUJXXFZHV-FQEVSTJZSA-N 0 3 416.363 4.428 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)N1CCC(OCc2ccccc2)CC1 ZINC000501802663 910853946 /nfs/dbraw/zinc/85/39/46/910853946.db2.gz NPTKSZNLNDBFQQ-XMMPIXPASA-N 0 3 407.558 4.214 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)N(Cc1cccs1)C[C@@H]1CCCO1 ZINC000501807095 910858214 /nfs/dbraw/zinc/85/82/14/910858214.db2.gz ZWSDGZXFCWTPQQ-RBBKRZOGSA-N 0 3 413.587 4.276 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)N[C@H](CN2CCCC2)c2ccccc2)cc1OC ZINC000501831863 910873935 /nfs/dbraw/zinc/87/39/35/910873935.db2.gz PFXQYBDDDYNIDF-YADHBBJMSA-N 0 3 423.557 4.387 20 0 HIADHN CCOc1cc2c(cc1CNC(=O)N[C@@H](CN1CCCC1)c1ccccc1)O[C@@H](C)C2 ZINC000501852108 910884315 /nfs/dbraw/zinc/88/43/15/910884315.db2.gz UCEIDLJJFMTFTJ-AVRDEDQJSA-N 0 3 423.557 4.045 20 0 HIADHN CC(C)c1ccccc1OCCC(=O)N1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000501872176 910897393 /nfs/dbraw/zinc/89/73/93/910897393.db2.gz IYEUYPPUPCYRKZ-SFTDATJTSA-N 0 3 416.606 4.317 20 0 HIADHN CC[C@@H](CC(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1)c1ccc(OC)cc1 ZINC000501872156 910897931 /nfs/dbraw/zinc/89/79/31/910897931.db2.gz ISMACWGWXIVLHF-VWPQPMDRSA-N 0 3 416.606 4.317 20 0 HIADHN CCN(C(=O)c1cccc(N2CCCC2=O)c1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000501947359 910933923 /nfs/dbraw/zinc/93/39/23/910933923.db2.gz NYZZDESBUGYMPX-CVDCTZTESA-N 0 3 405.542 4.111 20 0 HIADHN CCN(C(=O)c1ccc2c(c1)NC(=O)CCS2)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000501963723 910949160 /nfs/dbraw/zinc/94/91/60/910949160.db2.gz VWYVOQBUZVZTOT-FXAWDEMLSA-N 0 3 423.582 4.419 20 0 HIADHN CCN(C(=O)c1ccc2c(c1)NC(=O)CCS2)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000501963726 910950322 /nfs/dbraw/zinc/95/03/22/910950322.db2.gz VWYVOQBUZVZTOT-YLJYHZDGSA-N 0 3 423.582 4.419 20 0 HIADHN C[C@H](NC[C@@H]1CN(C(=O)c2ccccc2)[C@H]2CCN1C2)c1cc(Cl)ccc1Cl ZINC000502038251 910992706 /nfs/dbraw/zinc/99/27/06/910992706.db2.gz VKLMXLRFKMHTSX-ZYSHUDEJSA-N 0 3 418.368 4.243 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)C1(c2cccc(Cl)c2)CCOCC1 ZINC000513216835 921631789 /nfs/dbraw/zinc/63/17/89/921631789.db2.gz HKBCUQYQJSHOMX-QFIPXVFZSA-N 0 3 412.961 4.169 20 0 HIADHN CC(C)N(C(=O)[C@@H](C)NCc1ccccc1-c1ccc(Cn2cncn2)cc1)C(C)C ZINC000513217507 921633457 /nfs/dbraw/zinc/63/34/57/921633457.db2.gz HFECEQYVEYKSRW-HXUWFJFHSA-N 0 3 419.573 4.117 20 0 HIADHN O=C(Cc1csc(Cc2ccccc2)n1)NC[C@H]1CCCN1Cc1ccccc1 ZINC000513221003 921635468 /nfs/dbraw/zinc/63/54/68/921635468.db2.gz APFJZKLYFKUFOE-JOCHJYFZSA-N 0 3 405.567 4.057 20 0 HIADHN CC[C@@H](C)n1ncc2c1nc(C)cc2C(=O)NC[C@@H]1CCCN1Cc1ccccc1 ZINC000513222955 921637423 /nfs/dbraw/zinc/63/74/23/921637423.db2.gz KJTFGSSUWSSHOL-QUCCMNQESA-N 0 3 405.546 4.105 20 0 HIADHN O=C(Nc1c[nH]nc1[C@@H]1CCCN(CCCOc2ccc(F)cc2)C1)C1CCCC1 ZINC000502315932 911284230 /nfs/dbraw/zinc/28/42/30/911284230.db2.gz UGOMICZGZRTJRZ-GOSISDBHSA-N 0 3 414.525 4.326 20 0 HIADHN CCc1cccc(OCCN2CCC[C@H](c3n[nH]cc3NC(=O)c3ccccc3)C2)c1 ZINC000502320528 911293723 /nfs/dbraw/zinc/29/37/23/911293723.db2.gz SRFVEYQIGNWCGD-NRFANRHFSA-N 0 3 418.541 4.483 20 0 HIADHN C[C@@H]1CCCC[C@H]1OCCN1CCC[C@H](c2n[nH]cc2NC(=O)C2CCCC2)C1 ZINC000502339819 911319010 /nfs/dbraw/zinc/31/90/10/911319010.db2.gz OPOIZAFQXSJJMV-SLYNCCJLSA-N 0 3 402.583 4.313 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)c1cc(Br)ccc1F ZINC000502376243 911361434 /nfs/dbraw/zinc/36/14/34/911361434.db2.gz CNPOKTAOQXVTMV-UHFFFAOYSA-N 0 3 407.327 4.225 20 0 HIADHN O=C(CN[C@@H]1CCCC[C@H]1OC(F)F)Nc1cccc(CSc2ccccn2)c1 ZINC000502528905 911532241 /nfs/dbraw/zinc/53/22/41/911532241.db2.gz LXJUBUQQVZGAPT-QZTJIDSGSA-N 0 3 421.513 4.452 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Cc1ccccc1OC)c1ccc(C(F)(F)F)cc1 ZINC000502545584 911550637 /nfs/dbraw/zinc/55/06/37/911550637.db2.gz XCVTWVLTKZBTLX-LJQANCHMSA-N 0 3 408.464 4.456 20 0 HIADHN CCN(CC)[C@H](CNC(=O)[C@@H](C)c1c(C)nn(C)c1C)c1ccc(C(F)(F)F)cc1 ZINC000502545922 911551654 /nfs/dbraw/zinc/55/16/54/911551654.db2.gz YIOQKWCCBJFVCS-IFXJQAMLSA-N 0 3 424.511 4.359 20 0 HIADHN COc1ccc([C@@H](CO)N(C)C[C@@H](O)COc2cc(C)c(Cl)cc2C(C)C)cc1 ZINC000502547170 911554114 /nfs/dbraw/zinc/55/41/14/911554114.db2.gz TXMDNIUPUBDROA-XMSQKQJNSA-N 0 3 421.965 4.186 20 0 HIADHN O=C(Nc1ccc(-c2ncc[nH]2)cc1)c1cc(-c2ccc(Br)cc2)n[nH]1 ZINC000502569025 911576688 /nfs/dbraw/zinc/57/66/88/911576688.db2.gz JNOMBCGUUZUUAW-UHFFFAOYSA-N 0 3 408.259 4.482 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@H](C)N[C@@H](c2ccc(F)cc2)C(C)C)cc1OC ZINC000502581899 911587475 /nfs/dbraw/zinc/58/74/75/911587475.db2.gz NSKVBUMNHSDRFY-KSFYIVLOSA-N 0 3 402.510 4.177 20 0 HIADHN CC(C)[C@@H](NCC(=O)N1CCC[C@@H]1c1ccc2c(c1)OCCO2)c1ccc(F)cc1 ZINC000502593656 911598370 /nfs/dbraw/zinc/59/83/70/911598370.db2.gz TXBWDQSPNUPJOP-HYBUGGRVSA-N 0 3 412.505 4.247 20 0 HIADHN CC(C)[C@H](NCC(=O)N1CCC[C@@H]1c1ccc2c(c1)OCCO2)c1ccc(F)cc1 ZINC000502593658 911598830 /nfs/dbraw/zinc/59/88/30/911598830.db2.gz TXBWDQSPNUPJOP-YKSBVNFPSA-N 0 3 412.505 4.247 20 0 HIADHN COc1ccc([C@H](CNC(=O)[C@@H]2C[C@@H]2c2ccc([C@H]3C[C@@H]3C)o2)N2CCCC2)cc1 ZINC000502607556 911617760 /nfs/dbraw/zinc/61/77/60/911617760.db2.gz AQVNQUYUFNPLSY-CNFLGBHRSA-N 0 3 408.542 4.468 20 0 HIADHN COc1ccc([C@@H](CNC(=O)C[C@H](C)Cc2ccccc2OC)N2CCCC2)cc1 ZINC000502612793 911636437 /nfs/dbraw/zinc/63/64/37/911636437.db2.gz UOJWOIFIEWKWAB-AUSIDOKSSA-N 0 3 410.558 4.226 20 0 HIADHN CCN1CC[C@H]2OCCN(C(=O)c3ccc(-c4ccc(Cl)cc4)cc3F)[C@H]2C1 ZINC000502721843 911750597 /nfs/dbraw/zinc/75/05/97/911750597.db2.gz OAPBQLUVXSHSJK-LEWJYISDSA-N 0 3 402.897 4.081 20 0 HIADHN Cc1ccc(C(=O)NC[C@@H]2CCCN2Cc2ccccc2)cc1NC(=O)c1ccco1 ZINC000513295215 921691475 /nfs/dbraw/zinc/69/14/75/921691475.db2.gz WUHLDEMGOLYLAJ-NRFANRHFSA-N 0 3 417.509 4.235 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCC[C@@H](COC)C1)c1ccc(C(F)(F)F)cc1 ZINC000502844457 911854742 /nfs/dbraw/zinc/85/47/42/911854742.db2.gz ACQAOZGDIXCQJH-VQIMIIECSA-N 0 3 415.500 4.156 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)CCC(=O)c3ccc(Cl)cc3)c2)CC1 ZINC000502888183 911885455 /nfs/dbraw/zinc/88/54/55/911885455.db2.gz MHJCFKSENQSJDA-UHFFFAOYSA-N 0 3 413.949 4.472 20 0 HIADHN Cc1oc(-c2cccs2)nc1CC(=O)Nc1cccc(N2CCN(C(C)C)CC2)c1 ZINC000502891382 911886738 /nfs/dbraw/zinc/88/67/38/911886738.db2.gz WWSLRMZETZGTTQ-UHFFFAOYSA-N 0 3 424.570 4.423 20 0 HIADHN CCN1CCN([C@@H](C)CNC(=O)[C@@H](Oc2cccc(C(C)C)c2)c2ccccc2)CC1 ZINC000503010789 911984219 /nfs/dbraw/zinc/98/42/19/911984219.db2.gz BPFVDDKOEZZNRN-OFVILXPXSA-N 0 3 423.601 4.072 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)c1csc(-c2ccc(F)c(F)c2)n1 ZINC000503068925 912035572 /nfs/dbraw/zinc/03/55/72/912035572.db2.gz NZAZGWKXFZVEAV-UHFFFAOYSA-N 0 3 419.472 4.431 20 0 HIADHN Cc1nccn1CCCN(C)[C@@H](C)C(=O)Nc1cccc(CSc2ccccn2)c1 ZINC000503077324 912048028 /nfs/dbraw/zinc/04/80/28/912048028.db2.gz SJIDADFZLSQNAV-SFHVURJKSA-N 0 3 423.586 4.228 20 0 HIADHN O[C@H](CO[C@@H]1CCCc2ccccc21)CN1CCC[C@H]1c1n[nH]c(-c2ccccc2)n1 ZINC000503161380 912130361 /nfs/dbraw/zinc/13/03/61/912130361.db2.gz UHYLLQPBJDSLGN-ACIOBRDBSA-N 0 3 418.541 4.064 20 0 HIADHN O[C@H](CO[C@@H]1CCCc2ccccc21)C[N@@H+]1CCC[C@H]1c1nnc(-c2ccccc2)[n-]1 ZINC000503161380 912130371 /nfs/dbraw/zinc/13/03/71/912130371.db2.gz UHYLLQPBJDSLGN-ACIOBRDBSA-N 0 3 418.541 4.064 20 0 HIADHN O[C@H](CO[C@@H]1CCCc2ccccc21)C[N@H+]1CCC[C@H]1c1nnc(-c2ccccc2)[n-]1 ZINC000503161380 912130392 /nfs/dbraw/zinc/13/03/92/912130392.db2.gz UHYLLQPBJDSLGN-ACIOBRDBSA-N 0 3 418.541 4.064 20 0 HIADHN O[C@H](Cc1ccccc1C(F)(F)F)CN1CCC[C@@H]1c1nnc(-c2ccccc2)[nH]1 ZINC000503186724 912163874 /nfs/dbraw/zinc/16/38/74/912163874.db2.gz MPIHLISMHOWZTH-IEBWSBKVSA-N 0 3 416.447 4.231 20 0 HIADHN CC(C)Cc1ccc([C@@H](CNC(=O)N2CCC(OCC3CC3)CC2)N(C)C)cc1 ZINC000513340281 921725227 /nfs/dbraw/zinc/72/52/27/921725227.db2.gz IOWXQEDQDKEJFY-HSZRJFAPSA-N 0 3 401.595 4.088 20 0 HIADHN CCN(Cc1ccccc1C)C(=O)NCCCCN1CCN(c2cccc(C)c2)CC1 ZINC000503213196 912193848 /nfs/dbraw/zinc/19/38/48/912193848.db2.gz XAJVORHVRRPZMS-UHFFFAOYSA-N 0 3 422.617 4.437 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)Nc2cccc(C(=O)N3CCCCC3)c2)C1 ZINC000506295183 914890882 /nfs/dbraw/zinc/89/08/82/914890882.db2.gz OGAZVHTWGDQWJY-XXBNENTESA-N 0 3 420.557 4.270 20 0 HIADHN CNC(=O)C1CCN(Cc2cn(Cc3ccccc3Cl)nc2-c2ccccc2)CC1 ZINC000506294977 914890995 /nfs/dbraw/zinc/89/09/95/914890995.db2.gz MOHYBFAWHPEETJ-UHFFFAOYSA-N 0 3 422.960 4.210 20 0 HIADHN Cc1noc(C)c1C(C)(C)NC(=O)NC[C@@H](c1ccc(CC(C)C)cc1)N(C)C ZINC000513352282 921732062 /nfs/dbraw/zinc/73/20/62/921732062.db2.gz PGSZBHDDCRGJRX-FQEVSTJZSA-N 0 3 400.567 4.327 20 0 HIADHN CC(C)Cc1ccc([C@@H](CNC(=O)N(C)C[C@H](C)c2nccs2)N(C)C)cc1 ZINC000513356093 921735202 /nfs/dbraw/zinc/73/52/02/921735202.db2.gz BWNHRZAHLBTMDU-FXAWDEMLSA-N 0 3 402.608 4.389 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)Nc2cccc(CN3CCCCC3=O)c2)C1 ZINC000506488767 915096026 /nfs/dbraw/zinc/09/60/26/915096026.db2.gz SKZALVXOIQPASD-AUSIDOKSSA-N 0 3 420.557 4.156 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Cc2csc(-c3cccnc3)n2)N2CCCC2)cc1 ZINC000513371792 921745888 /nfs/dbraw/zinc/74/58/88/921745888.db2.gz NFTJPXBOTAJKED-OAQYLSRUSA-N 0 3 406.555 4.009 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)Nc2cccc(CN3CCCCC3=O)c2)N(C)C)cc1 ZINC000506502432 915121009 /nfs/dbraw/zinc/12/10/09/915121009.db2.gz LSOGSFLGQMTSNR-HSZRJFAPSA-N 0 3 422.573 4.186 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)c2cnn(-c3ccccc3)c2C2CC2)C1 ZINC000513376149 921748679 /nfs/dbraw/zinc/74/86/79/921748679.db2.gz GANKSOIWKQRXGR-GHTZIAJQSA-N 0 3 400.526 4.315 20 0 HIADHN COc1c(Br)cc(Br)cc1CN(C[C@@H]1CCOC1)C1CC1 ZINC000506581208 915229492 /nfs/dbraw/zinc/22/94/92/915229492.db2.gz XRXXVNMHPDHIEM-NSHDSACASA-N 0 3 419.157 4.221 20 0 HIADHN O=C(NC1CCN(Cc2ccc(OC(F)(F)[C@@H](F)C(F)(F)F)cc2)CC1)C1CC1 ZINC000506648035 915317046 /nfs/dbraw/zinc/31/70/46/915317046.db2.gz ZSOYSDVIQAZSCW-KRWDZBQOSA-N 0 3 424.385 4.049 20 0 HIADHN CCOc1ccc([C@@H](NC(=O)N2CCCN(C)CC2)c2cccc(Cl)c2)cc1 ZINC000506697618 915373810 /nfs/dbraw/zinc/37/38/10/915373810.db2.gz IIHFBUJQWJBJIZ-OAQYLSRUSA-N 0 3 401.938 4.175 20 0 HIADHN O=C(NCc1ccccc1)C1CCN(Cc2ccc(-c3ccncc3)cc2F)CC1 ZINC000506725407 915407406 /nfs/dbraw/zinc/40/74/06/915407406.db2.gz HPKZDMXIUWSBKR-UHFFFAOYSA-N 0 3 403.501 4.416 20 0 HIADHN CCOc1cc(CN2CCC(C(=O)NCc3ccccc3)CC2)ccc1OC(F)F ZINC000506728767 915412718 /nfs/dbraw/zinc/41/27/18/915412718.db2.gz YVGIVWDWNDQQBG-UHFFFAOYSA-N 0 3 418.484 4.215 20 0 HIADHN CN(C)Cc1cccc(NC(=O)[C@@H]2CCCN2C(=O)c2ccc(Cl)c(Cl)c2)c1 ZINC000506771874 915483568 /nfs/dbraw/zinc/48/35/68/915483568.db2.gz AKLPPCFTALARKU-IBGZPJMESA-N 0 3 420.340 4.298 20 0 HIADHN CC(C)CN(CCN(C)C)C(=O)NCc1cccc(NC(=O)Nc2ccccc2)c1 ZINC000506801129 915540876 /nfs/dbraw/zinc/54/08/76/915540876.db2.gz MHWCFFVWGIWDBI-UHFFFAOYSA-N 0 3 411.550 4.060 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3ccc(Oc4ccccn4)cc3)CC2)C[C@H](C)O1 ZINC000506860199 915644513 /nfs/dbraw/zinc/64/45/13/915644513.db2.gz QGBGAVXKODOVEQ-KDURUIRLSA-N 0 3 424.545 4.227 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)Nc3ccc(Oc4ccccn4)cc3)CC2)C[C@H](C)O1 ZINC000506860200 915644785 /nfs/dbraw/zinc/64/47/85/915644785.db2.gz QGBGAVXKODOVEQ-OALUTQOASA-N 0 3 424.545 4.227 20 0 HIADHN CC(C)OCCCNC(=O)C1CCN(Cc2ccccc2OC2CCCC2)CC1 ZINC000506877890 915670512 /nfs/dbraw/zinc/67/05/12/915670512.db2.gz WPIKDCLYVFXBTR-UHFFFAOYSA-N 0 3 402.579 4.151 20 0 HIADHN COC(=O)c1ccccc1NC(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1 ZINC000506987623 915799720 /nfs/dbraw/zinc/79/97/20/915799720.db2.gz GLDVXOOAZFYHNU-UHFFFAOYSA-N 0 3 423.435 4.088 20 0 HIADHN CCCCNC(=O)C1CCN(Cc2c(C)nn(Cc3ccc(Cl)cc3)c2C)CC1 ZINC000507021070 915826901 /nfs/dbraw/zinc/82/69/01/915826901.db2.gz LNBRPLYAFUBVAZ-UHFFFAOYSA-N 0 3 416.997 4.330 20 0 HIADHN CCCCNC(=O)C1CCN(Cc2cn(-c3ccccc3)nc2-c2cccnc2)CC1 ZINC000507023135 915827954 /nfs/dbraw/zinc/82/79/54/915827954.db2.gz UDEVMGWXZAZEMX-UHFFFAOYSA-N 0 3 417.557 4.063 20 0 HIADHN CC(C)(COCc1ccccc1)NC(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000507076034 915855768 /nfs/dbraw/zinc/85/57/68/915855768.db2.gz XMAKJPJCPDNLGQ-IBGZPJMESA-N 0 3 401.576 4.180 20 0 HIADHN O=C(c1cccc(OC[C@H]2CCCO2)c1)N1CCCN(CCCc2ccccc2)CC1 ZINC000507147991 915890290 /nfs/dbraw/zinc/89/02/90/915890290.db2.gz FMZIKAUEQHMLJU-RUZDIDTESA-N 0 3 422.569 4.025 20 0 HIADHN COc1cc(-c2nnc(CN3CC[C@H](c4ccccc4C)C3)o2)cc(OC)c1OC ZINC000507165497 915906392 /nfs/dbraw/zinc/90/63/92/915906392.db2.gz QNNXEAWKPQXWOL-INIZCTEOSA-N 0 3 409.486 4.060 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)CN2CC[C@H](c3ccccc3C)C2)c(OC)c1 ZINC000507177362 915922913 /nfs/dbraw/zinc/92/29/13/915922913.db2.gz HAVLJEGWUTZXHF-CVDCTZTESA-N 0 3 408.542 4.165 20 0 HIADHN CCc1nnc(NC(=O)[C@H](C)[C@@H](C)N[C@@H](C)c2ccccc2Br)s1 ZINC000507206811 915955289 /nfs/dbraw/zinc/95/52/89/915955289.db2.gz ANPYSEQQVIRRRK-UTUOFQBUSA-N 0 3 411.369 4.177 20 0 HIADHN COc1ccccc1C[C@H](C)N(Cc1ccccc1)Cc1cc(=O)n2ccsc2n1 ZINC000507220781 915975007 /nfs/dbraw/zinc/97/50/07/915975007.db2.gz ZWOUCVYNLLCHQA-SFHVURJKSA-N 0 3 419.550 4.398 20 0 HIADHN CCOC(=O)C1CCN(C(=O)[C@H](C)N[C@H](C)c2ccc(SC(C)C)cc2)CC1 ZINC000507487859 916254811 /nfs/dbraw/zinc/25/48/11/916254811.db2.gz SKXOZMSPAWYMAL-SJORKVTESA-N 0 3 406.592 4.028 20 0 HIADHN CCCN(CC(=O)Nc1ccc(OCC)cc1)C1CCN(C(=O)c2ccccc2)CC1 ZINC000507596566 916350452 /nfs/dbraw/zinc/35/04/52/916350452.db2.gz KCZTUCKQDNHQEA-UHFFFAOYSA-N 0 3 423.557 4.041 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3cccc4oc(C)nc43)c(OCC)c2)CC1 ZINC000507607965 916365206 /nfs/dbraw/zinc/36/52/06/916365206.db2.gz TVLQUZMDHQFJSV-UHFFFAOYSA-N 0 3 422.529 4.319 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)C[C@@H](C)c3cccnc3)c(OCC)c2)CC1 ZINC000507611290 916370829 /nfs/dbraw/zinc/37/08/29/916370829.db2.gz OUVCZZWBMWNXQF-LJQANCHMSA-N 0 3 410.562 4.145 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)c2ccccc2OCc2cscn2)C1 ZINC000507618837 916377664 /nfs/dbraw/zinc/37/76/64/916377664.db2.gz DKLQZXWLDTVSGI-HKUYNNGSSA-N 0 3 407.539 4.287 20 0 HIADHN C[C@H](NC(=O)[C@H](C)N(C)CCCc1cc(-c2ccccc2)n[nH]1)c1ccc(F)cc1 ZINC000507669103 916436151 /nfs/dbraw/zinc/43/61/51/916436151.db2.gz NISSTLMLURIJIY-ROUUACIJSA-N 0 3 408.521 4.346 20 0 HIADHN CC[C@H](C)N(CC(=O)N1CCC(C(=O)Nc2ccccc2)CC1)Cc1ccccc1 ZINC000507675803 916445509 /nfs/dbraw/zinc/44/55/09/916445509.db2.gz BEFQIXXUCASNCT-FQEVSTJZSA-N 0 3 407.558 4.164 20 0 HIADHN CC(C)(C(=O)NC[C@H]1CCCCN1C1CC1)c1csc(-c2c(F)cccc2F)n1 ZINC000507766276 916549508 /nfs/dbraw/zinc/54/95/08/916549508.db2.gz JVNXLIWTBLLBKV-OAHLLOKOSA-N 0 3 419.541 4.499 20 0 HIADHN CC(C)Sc1cc(Br)ccc1CN1CCN(C2CCOCC2)CC1 ZINC000507783188 916565668 /nfs/dbraw/zinc/56/56/68/916565668.db2.gz LWLXTLOZTCMDNK-UHFFFAOYSA-N 0 3 413.425 4.246 20 0 HIADHN CN1C(=O)C[C@@H](NCc2ccc(OCc3ccccn3)cc2)[C@@H]1c1ccc(Cl)cc1 ZINC000507834908 916640211 /nfs/dbraw/zinc/64/02/11/916640211.db2.gz VEAVPNCGETYILX-VWNXMTODSA-N 0 3 421.928 4.376 20 0 HIADHN CN1C(=O)C[C@@H](NCc2ccc(OCc3ccncc3)cc2)[C@@H]1c1ccc(Cl)cc1 ZINC000507851028 916670952 /nfs/dbraw/zinc/67/09/52/916670952.db2.gz MPTNWHCJBAAOSH-VWNXMTODSA-N 0 3 421.928 4.376 20 0 HIADHN Cc1ccn2c(CNCc3ccccc3-c3ccc(Cn4cncn4)cc3)cnc2c1 ZINC000507854371 916680332 /nfs/dbraw/zinc/68/03/32/916680332.db2.gz DSLYKCIYDQCPQB-UHFFFAOYSA-N 0 3 408.509 4.239 20 0 HIADHN COc1cccc(CNCc2ccccc2-c2ccc(Cn3cncn3)cc2)c1OC ZINC000507864415 916698164 /nfs/dbraw/zinc/69/81/64/916698164.db2.gz ZNLPKESVYPVYEP-UHFFFAOYSA-N 0 3 414.509 4.300 20 0 HIADHN Cc1ccc(NC(=O)[C@@H]2CCCN(Cc3ccccc3OCC(F)(F)F)C2)nc1 ZINC000507987311 916829651 /nfs/dbraw/zinc/82/96/51/916829651.db2.gz XOGNTIDTERQRLO-QGZVFWFLSA-N 0 3 407.436 4.182 20 0 HIADHN Cc1ccc(NC(=O)[C@H]2CCCN(Cc3cccc(OCC(F)(F)F)c3)C2)nc1 ZINC000507995791 916836845 /nfs/dbraw/zinc/83/68/45/916836845.db2.gz YPDIHLAACPCULT-KRWDZBQOSA-N 0 3 407.436 4.182 20 0 HIADHN Cc1ccc(NC(=O)[C@H]2CCCN(Cc3ccc(OCc4cccnc4)cc3)C2)nc1 ZINC000508012730 916850446 /nfs/dbraw/zinc/85/04/46/916850446.db2.gz LQYRDYXPNYASRP-QFIPXVFZSA-N 0 3 416.525 4.215 20 0 HIADHN Cc1cc(N2CCCCCC2)ccc1NS(=O)(=O)c1ccc(CN(C)C)cc1 ZINC000508068670 916890488 /nfs/dbraw/zinc/89/04/88/916890488.db2.gz NXFFPMVVDZDNNK-UHFFFAOYSA-N 0 3 401.576 4.238 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1occ2c1CCOC2)c1ccc(C(F)(F)F)cc1 ZINC000508421506 917210504 /nfs/dbraw/zinc/21/05/04/917210504.db2.gz YVARJJKAHQYZSW-SFHVURJKSA-N 0 3 410.436 4.184 20 0 HIADHN CCCN(C(=O)c1cc(C)nc2c1c(C)nn2C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000508460045 917244983 /nfs/dbraw/zinc/24/49/83/917244983.db2.gz XGDQZZBKLHZJKA-NRFANRHFSA-N 0 3 419.573 4.102 20 0 HIADHN NC(=O)CC1CCN(Cc2cn(-c3ccccc3)nc2-c2cccc(Cl)c2)CC1 ZINC000508586871 917358316 /nfs/dbraw/zinc/35/83/16/917358316.db2.gz JBZCRWVFIOOYRT-UHFFFAOYSA-N 0 3 408.933 4.280 20 0 HIADHN CN(C(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1)C1Cc2ccccc2C1 ZINC000508604991 917374784 /nfs/dbraw/zinc/37/47/84/917374784.db2.gz QHMBPLYVAWRIPM-QFIPXVFZSA-N 0 3 402.460 4.067 20 0 HIADHN CCN1CCN([C@H](C)CNC(=O)C(CC)(CC)c2ccc(Cl)c(Cl)c2)CC1 ZINC000508634273 917400009 /nfs/dbraw/zinc/40/00/09/917400009.db2.gz FJOKGXVSCWLAFT-MRXNPFEDSA-N 0 3 414.421 4.193 20 0 HIADHN NC(=O)CC1CCN(Cc2cccc(NC(=O)c3ccc(Cl)cc3Cl)c2)CC1 ZINC000508671318 917435774 /nfs/dbraw/zinc/43/57/74/917435774.db2.gz LRJHRUCHDKCIFQ-UHFFFAOYSA-N 0 3 420.340 4.333 20 0 HIADHN Cc1ccc(Cn2cc(CN3CCC(CC(N)=O)CC3)c(-c3ccc(C)cc3)n2)cc1 ZINC000508681876 917445864 /nfs/dbraw/zinc/44/58/64/917445864.db2.gz UUSKZTZXFLCNJK-UHFFFAOYSA-N 0 3 416.569 4.303 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)c2ccc([C@H]3CCCOC3)cc2)cc1 ZINC000508827315 917580456 /nfs/dbraw/zinc/58/04/56/917580456.db2.gz JMSJBCVZOUCETG-UPVQGACJSA-N 0 3 408.542 4.156 20 0 HIADHN C[C@@H](NC(=O)N(C)Cc1ccc(Br)s1)[C@@H](c1ccccc1)N(C)C ZINC000508851434 917604208 /nfs/dbraw/zinc/60/42/08/917604208.db2.gz HGJDIRRWJZRDSE-DYVFJYSZSA-N 0 3 410.381 4.343 20 0 HIADHN C[C@H](NC(=O)N(C)Cc1ccc(OCC(F)(F)F)cc1)[C@@H](c1ccccc1)N(C)C ZINC000508861842 917615227 /nfs/dbraw/zinc/61/52/27/917615227.db2.gz IKWIXIMAVFGXJZ-JXFKEZNVSA-N 0 3 423.479 4.461 20 0 HIADHN COc1ccc(OC)c(CN(C(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)C2CC2)c1 ZINC000508875035 917628567 /nfs/dbraw/zinc/62/85/67/917628567.db2.gz VVFQDININLOAKB-GAJHUEQPSA-N 0 3 411.546 4.069 20 0 HIADHN C[C@@H](NC(=O)N1CCC(c2ncccc2Cl)CC1)[C@H](c1ccccc1)N(C)C ZINC000508875215 917629163 /nfs/dbraw/zinc/62/91/63/917629163.db2.gz BQRJJOMQUYELLU-IIBYNOLFSA-N 0 3 400.954 4.315 20 0 HIADHN C[C@@H](NC(=O)N(C)Cc1ccc(Br)cc1)[C@@H](c1ccccc1)N(C)C ZINC000508891277 917645903 /nfs/dbraw/zinc/64/59/03/917645903.db2.gz BHUIDQNVDUDZJI-BEFAXECRSA-N 0 3 404.352 4.282 20 0 HIADHN C[C@H](NC(=O)N(C)Cc1csc(Br)c1)[C@@H](c1ccccc1)N(C)C ZINC000508896564 917650915 /nfs/dbraw/zinc/65/09/15/917650915.db2.gz IEERTWUQQJFQOT-GUYCJALGSA-N 0 3 410.381 4.343 20 0 HIADHN O=C(C1CCN(Cc2ccc(OC[C@H]3CCCO3)cc2)CC1)N1CCc2ccccc21 ZINC000508897390 917653047 /nfs/dbraw/zinc/65/30/47/917653047.db2.gz WXLFVXBICKBXFR-XMMPIXPASA-N 0 3 420.553 4.046 20 0 HIADHN C[C@@H](NC(=O)Nc1ccccc1I)[C@H](c1ccccc1)N(C)C ZINC000508898204 917655229 /nfs/dbraw/zinc/65/52/29/917655229.db2.gz KZOIUAJOAFIKGM-CXAGYDPISA-N 0 3 423.298 4.104 20 0 HIADHN Cc1nc2ccccc2n1C[C@@H]1CCCN1C(=O)N[C@H](C)[C@@H](c1ccccc1)N(C)C ZINC000508903801 917658432 /nfs/dbraw/zinc/65/84/32/917658432.db2.gz YDXLOFZHXYKRCR-ZHRMCQFGSA-N 0 3 419.573 4.210 20 0 HIADHN C[C@H](NC(=O)N(C)Cc1cccc(Br)c1)[C@@H](c1ccccc1)N(C)C ZINC000508905650 917661859 /nfs/dbraw/zinc/66/18/59/917661859.db2.gz MJWXOIWTUPPOMD-KXBFYZLASA-N 0 3 404.352 4.282 20 0 HIADHN Cc1ccc(NC(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)c(OC[C@@H]2CCCO2)c1 ZINC000508905444 917662029 /nfs/dbraw/zinc/66/20/29/917662029.db2.gz KWBCKWDQLUHALY-QMHWCDLVSA-N 0 3 411.546 4.366 20 0 HIADHN C[C@H](NC(=O)Nc1ccc(C(=O)N2CCC(C)CC2)cc1)[C@@H](c1ccccc1)N(C)C ZINC000508908444 917665441 /nfs/dbraw/zinc/66/54/41/917665441.db2.gz SMMNETREGFSRAL-CVDCTZTESA-N 0 3 422.573 4.372 20 0 HIADHN COCC1(C)CCN([C@H]2CCCN(c3c(C)cc(Br)cc3C)C2=O)CC1 ZINC000509027554 917781983 /nfs/dbraw/zinc/78/19/83/917781983.db2.gz FRRKNMPAYZZLJP-SFHVURJKSA-N 0 3 423.395 4.310 20 0 HIADHN COCC1(C)CCN([C@@H]2CCCN(c3c(C)cc(Br)cc3C)C2=O)CC1 ZINC000509027552 917782353 /nfs/dbraw/zinc/78/23/53/917782353.db2.gz FRRKNMPAYZZLJP-GOSISDBHSA-N 0 3 423.395 4.310 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)N1CCCC[C@H]1c1cc[nH]n1)c1ccc(Cl)cc1 ZINC000509050881 917801827 /nfs/dbraw/zinc/80/18/27/917801827.db2.gz NHNYFPFOSDCPGX-PMACEKPBSA-N 0 3 403.958 4.383 20 0 HIADHN O=C(Cc1csc(Cc2ccccc2)n1)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000509087797 917829202 /nfs/dbraw/zinc/82/92/02/917829202.db2.gz UJUWVNMEHWBPHM-QFIPXVFZSA-N 0 3 405.567 4.230 20 0 HIADHN CN(Cc1ccc(OC[C@@H]2CCCO2)cc1)[C@@H](CO)c1cccc(Br)c1 ZINC000509100468 917840099 /nfs/dbraw/zinc/84/00/99/917840099.db2.gz ZLVWTQUNYBPFOB-SFTDATJTSA-N 0 3 420.347 4.172 20 0 HIADHN COc1ccc(OC)c(-c2nn(-c3ccccc3)cc2CN2CCC[C@H](OC)C2)c1 ZINC000509157358 917875392 /nfs/dbraw/zinc/87/53/92/917875392.db2.gz YYTABTSDXKCMJV-NRFANRHFSA-N 0 3 407.514 4.167 20 0 HIADHN Cc1cccc(CCCNC(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)n1 ZINC000509201788 917906055 /nfs/dbraw/zinc/90/60/55/917906055.db2.gz YCDYKDXOZGILAK-UHFFFAOYSA-N 0 3 422.495 4.115 20 0 HIADHN Cc1cc(NC(=O)Cc2ccc(O)cc2Cl)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000509273971 917960099 /nfs/dbraw/zinc/96/00/99/917960099.db2.gz KCZQLPDRCKGTIV-LJQANCHMSA-N 0 3 424.932 4.179 20 0 HIADHN O=C(NCc1nccc2ccccc21)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000509334858 918003321 /nfs/dbraw/zinc/00/33/21/918003321.db2.gz NSBBZQGWDDWUDW-QFIPXVFZSA-N 0 3 413.443 4.306 20 0 HIADHN COCCCOc1cccc(CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)c1 ZINC000509357480 918023113 /nfs/dbraw/zinc/02/31/13/918023113.db2.gz KXIYFYUREOHBGK-UHFFFAOYSA-N 0 3 417.937 4.001 20 0 HIADHN COc1cc2c(cc1F)CC[C@H]2NCc1c(Cl)cccc1N1CCN(C)CC1 ZINC000509431522 918089357 /nfs/dbraw/zinc/08/93/57/918089357.db2.gz PVYNYADEEYEEAP-HXUWFJFHSA-N 0 3 403.929 4.017 20 0 HIADHN Cn1cc(-c2ccc(CN[C@H]3CC(=O)N(C)[C@@H]3c3ccc(Cl)c(F)c3)s2)cn1 ZINC000509479649 918127440 /nfs/dbraw/zinc/12/74/40/918127440.db2.gz ZQSJVFDJZVHXSU-FXAWDEMLSA-N 0 3 418.925 4.003 20 0 HIADHN O=C([C@@H]1CCC[C@@H]2CCCC[C@@H]12)N1CCC[C@@H](CN2CCN(c3ccccn3)CC2)C1 ZINC000509519742 918168617 /nfs/dbraw/zinc/16/86/17/918168617.db2.gz MAMMPLVTZMCIES-CJRSTVEYSA-N 0 3 424.633 4.049 20 0 HIADHN COc1ccccc1/C=C/CN1CCC(C(=O)Nc2cc(Cl)ccc2O)CC1 ZINC000509523050 918172401 /nfs/dbraw/zinc/17/24/01/918172401.db2.gz WRMCQCWWEGGVNT-GQCTYLIASA-N 0 3 400.906 4.418 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CN1CCC(C(=O)N2CCC[C@H](C)C2)CC1 ZINC000509535019 918183417 /nfs/dbraw/zinc/18/34/17/918183417.db2.gz ZMICQBGMZVBFEE-IBGZPJMESA-N 0 3 408.590 4.019 20 0 HIADHN CCCCOc1ccc(CN2CCC(C(=O)N3CCC[C@@H](C)C3)CC2)cc1OC ZINC000509544672 918194437 /nfs/dbraw/zinc/19/44/37/918194437.db2.gz QYWLJKOYJVFQKO-LJQANCHMSA-N 0 3 402.579 4.345 20 0 HIADHN Cc1nn(Cc2ccccc2Cl)c(C)c1CN1CCC(C(=O)N(C)C(C)C)CC1 ZINC000509548364 918197730 /nfs/dbraw/zinc/19/77/30/918197730.db2.gz GPNTUUAPSLITFH-UHFFFAOYSA-N 0 3 416.997 4.280 20 0 HIADHN C[C@H]1CCCN(C(=O)C2CCN(Cc3ccc(OCc4cccnc4)cc3)CC2)C1 ZINC000509557777 918206960 /nfs/dbraw/zinc/20/69/60/918206960.db2.gz NHHLCSUTEKCRKA-FQEVSTJZSA-N 0 3 407.558 4.131 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N(Cc1cccs1)C[C@@H]1CCCO1)c1ccco1 ZINC000509565767 918216202 /nfs/dbraw/zinc/21/62/02/918216202.db2.gz BCPIAMMGOSQDMF-JENIJYKNSA-N 0 3 405.564 4.161 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)N1CCC(C(F)(F)F)(C(F)(F)F)C1)c1ccco1 ZINC000509567824 918217958 /nfs/dbraw/zinc/21/79/58/918217958.db2.gz KUZKDLSVMSCNAR-NEPJUHHUSA-N 0 3 415.378 4.235 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N1CCC(Oc2ccc(F)cc2F)CC1)c1ccco1 ZINC000509580690 918229789 /nfs/dbraw/zinc/22/97/89/918229789.db2.gz ZJDSAFOILCXRQP-KXBFYZLASA-N 0 3 421.488 4.240 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N(CCCO)[C@@H]1CCCc2ccccc21)c1ccco1 ZINC000509587094 918237432 /nfs/dbraw/zinc/23/74/32/918237432.db2.gz JFLCPPNZHHGVAL-YUXAGFNASA-N 0 3 413.562 4.180 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N(Cc1cccc(F)c1)C[C@H]1CCCO1)c1ccco1 ZINC000509589141 918238238 /nfs/dbraw/zinc/23/82/38/918238238.db2.gz YNEXYZGQDBEYJZ-WMQCIHAUSA-N 0 3 417.525 4.239 20 0 HIADHN CC[NH+](CC)Cc1ccccc1CNC(=O)Nc1ccc(-c2cc(=O)[n-]c(C)n2)cc1 ZINC000509848460 918451829 /nfs/dbraw/zinc/45/18/29/918451829.db2.gz BVVDMECOOFSMHJ-UHFFFAOYSA-N 0 3 419.529 4.321 20 0 HIADHN O=C(N[C@H]1C[C@@H]1c1ccccc1C(F)(F)F)N1CCCN(Cc2ccccc2)CC1 ZINC000509900119 918502730 /nfs/dbraw/zinc/50/27/30/918502730.db2.gz GHIXNQPNDZKWBI-CTNGQTDRSA-N 0 3 417.475 4.479 20 0 HIADHN O=C(N[C@H]1C[C@H]1c1ccccc1C(F)(F)F)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000509906411 918508602 /nfs/dbraw/zinc/50/86/02/918508602.db2.gz YLJHXWAERJOCLV-KPFFTGBYSA-N 0 3 403.448 4.135 20 0 HIADHN Cc1ccc(OCc2nc(CC(=O)N(CC(C)C)C3CCN(C)CC3)cs2)cc1 ZINC000509928130 918527129 /nfs/dbraw/zinc/52/71/29/918527129.db2.gz UDDUMDIKPWPEGM-UHFFFAOYSA-N 0 3 415.603 4.152 20 0 HIADHN O=C(Cc1ccccc1)N1CCC[C@@H](NCc2ccc(-c3ccncc3)cc2F)C1 ZINC000509949933 918545513 /nfs/dbraw/zinc/54/55/13/918545513.db2.gz UMWVFCQWYIGOMH-HSZRJFAPSA-N 0 3 403.501 4.211 20 0 HIADHN CCOc1c(Cl)cc(CN[C@H]2CCN(C(=O)Nc3ccccc3)C2)cc1OC ZINC000509964865 918555615 /nfs/dbraw/zinc/55/56/15/918555615.db2.gz VOYAJNXDZZQPBQ-KRWDZBQOSA-N 0 3 403.910 4.143 20 0 HIADHN COc1ccc(-c2ccncc2)cc1CN[C@@H]1CCN(C(=O)Nc2ccccc2)C1 ZINC000509964498 918556081 /nfs/dbraw/zinc/55/60/81/918556081.db2.gz VANQXBJULKYMQO-JOCHJYFZSA-N 0 3 402.498 4.153 20 0 HIADHN Cc1cn(-c2ccc(F)cc2)nc1C(=O)NC[C@@H]1CCCN(C)[C@@H]1c1cccs1 ZINC000509977040 918566465 /nfs/dbraw/zinc/56/64/65/918566465.db2.gz KGIOJUBSWWKPCU-KKSFZXQISA-N 0 3 412.534 4.194 20 0 HIADHN Cc1ccc(C)n1-c1nc(CC(=O)N(CCCc2ccccc2)CCN(C)C)cs1 ZINC000509982436 918570834 /nfs/dbraw/zinc/57/08/34/918570834.db2.gz MFNUIUXBRJLBGW-UHFFFAOYSA-N 0 3 424.614 4.116 20 0 HIADHN O=C(Nc1ccccc1)N1CC[C@@H](NCc2ccc(OCC(F)(F)F)c(F)c2)C1 ZINC000510005758 918588811 /nfs/dbraw/zinc/58/88/11/918588811.db2.gz PELABNRCUDPWDR-MRXNPFEDSA-N 0 3 411.399 4.163 20 0 HIADHN O=C1COc2ccc(CN[C@@H](c3ccc(Br)cc3)C3CCC3)cc2N1 ZINC000510065814 918634565 /nfs/dbraw/zinc/63/45/65/918634565.db2.gz MZCQELGRDCYACA-HXUWFJFHSA-N 0 3 401.304 4.411 20 0 HIADHN CN(Cc1cc(F)cc2cccnc21)C[C@@H](O)COc1ccc(C(F)(F)F)cc1 ZINC000510224364 918767622 /nfs/dbraw/zinc/76/76/22/918767622.db2.gz UVYCOOHNZJJQGZ-GOSISDBHSA-N 0 3 408.395 4.264 20 0 HIADHN Cc1cc([C@@H](C)NCc2cccc(NS(C)(=O)=O)c2)sc1Br ZINC000510246227 918783471 /nfs/dbraw/zinc/78/34/71/918783471.db2.gz WTQYXWKOMKEVSI-LLVKDONJSA-N 0 3 403.367 4.041 20 0 HIADHN CN(C)[C@@H](CNC(=O)N[C@@H](CC(F)(F)F)c1ccc(F)cc1)Cc1ccccc1 ZINC000510350022 918846741 /nfs/dbraw/zinc/84/67/41/918846741.db2.gz FQBNGDMPWVUQQT-MOPGFXCFSA-N 0 3 411.443 4.291 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N(Cc3ccc([C@H]4C[C@H]4C)o3)C3CC3)cc2)CC1 ZINC000510383148 918864760 /nfs/dbraw/zinc/86/47/60/918864760.db2.gz CCTHWLWNRFEVBL-JPYJTQIMSA-N 0 3 407.558 4.350 20 0 HIADHN Cc1cc(C)c(NC(=O)CN(C)C(=O)c2oc3ccccc3c2CN(C)C)c(C)c1 ZINC000510384839 918866154 /nfs/dbraw/zinc/86/61/54/918866154.db2.gz ZKOCOSJFKNWNPX-UHFFFAOYSA-N 0 3 407.514 4.130 20 0 HIADHN O=C(NCc1ccco1)c1cccc(CN2CC[C@H](n3ncc4ccccc43)C2)c1 ZINC000510406874 918878267 /nfs/dbraw/zinc/87/82/67/918878267.db2.gz OALOEEKFTUXDTJ-NRFANRHFSA-N 0 3 400.482 4.006 20 0 HIADHN CCCN(CCC)C(=O)c1ccc(NC(=O)NC[C@H](c2ccccc2)N(C)C)cc1 ZINC000510408842 918879134 /nfs/dbraw/zinc/87/91/34/918879134.db2.gz SOTFHOBYFUZUQE-JOCHJYFZSA-N 0 3 410.562 4.373 20 0 HIADHN Cc1nc(COc2ccc(CN3CCC(CC(=O)N4CCCC4)CC3)cc2)cs1 ZINC000510486763 918937559 /nfs/dbraw/zinc/93/75/59/918937559.db2.gz CHTAJZXBDQUXIQ-UHFFFAOYSA-N 0 3 413.587 4.255 20 0 HIADHN Cc1cccc(Oc2ccc(S(=O)(=O)N(C)C3C[C@H]4CC[C@@H](C3)N4C)cc2)c1 ZINC000510504632 918953096 /nfs/dbraw/zinc/95/30/96/918953096.db2.gz ZXRDATSUQCWQQA-DFNIBXOVSA-N 0 3 400.544 4.033 20 0 HIADHN COc1cc([C@H](C)NC(=O)N[C@@H](C)C2=CCN(C)CC2)ccc1OCc1ccccc1 ZINC000510541907 918987148 /nfs/dbraw/zinc/98/71/48/918987148.db2.gz VPNPMZNLVMLRDA-OALUTQOASA-N 0 3 423.557 4.285 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)N[C@H](c1nccs1)c1ccccc1 ZINC000510561481 919004239 /nfs/dbraw/zinc/00/42/39/919004239.db2.gz WKLBBFVGBNWLJX-FQEVSTJZSA-N 0 3 412.534 4.145 20 0 HIADHN CCOc1cccc(NC(=O)N(CCN(C)C)Cc2ccc(Br)cc2)c1 ZINC000510591280 919033141 /nfs/dbraw/zinc/03/31/41/919033141.db2.gz LZHZOJFKJRFMKZ-UHFFFAOYSA-N 0 3 420.351 4.444 20 0 HIADHN COc1ccc(C[C@@H](NCc2ccc3c(c2)oc(=O)n3C)c2ccccc2)cc1OC ZINC000510626904 919069699 /nfs/dbraw/zinc/06/96/99/919069699.db2.gz BBIFMUIPSFLXHT-HXUWFJFHSA-N 0 3 418.493 4.222 20 0 HIADHN CCOC(=O)c1cnn(C2CCN([C@@H](C)c3ccc(OC(F)F)cc3)CC2)c1C ZINC000510642018 919082269 /nfs/dbraw/zinc/08/22/69/919082269.db2.gz XPNYDYDSLPJIRC-AWEZNQCLSA-N 0 3 407.461 4.368 20 0 HIADHN Brc1ccc2c(c1)[C@H](N[C@H](CN1CCOCC1)c1ccccc1)CC2 ZINC000510689135 919127612 /nfs/dbraw/zinc/12/76/12/919127612.db2.gz UVPMQJMQHGYFPR-NHCUHLMSSA-N 0 3 401.348 4.100 20 0 HIADHN Brc1ccc2c(c1)[C@@H](N[C@@H](CN1CCOCC1)c1ccccc1)CC2 ZINC000510689137 919127913 /nfs/dbraw/zinc/12/79/13/919127913.db2.gz UVPMQJMQHGYFPR-SFTDATJTSA-N 0 3 401.348 4.100 20 0 HIADHN COc1cc([C@@H](C)N[C@@H]2CCc3ccc(Br)cc32)ccc1OCCO ZINC000510732280 919177672 /nfs/dbraw/zinc/17/76/72/919177672.db2.gz HLEUNBCIZUWVIW-FZKQIMNGSA-N 0 3 406.320 4.167 20 0 HIADHN Cc1ccc(NC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)c(OC[C@H]2CCCO2)c1 ZINC000510736394 919182351 /nfs/dbraw/zinc/18/23/51/919182351.db2.gz PWGWATSBDAYEKM-FCHUYYIVSA-N 0 3 423.557 4.339 20 0 HIADHN O=C(Nc1ccccc1OC[C@@H]1CCCCO1)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000510739434 919185944 /nfs/dbraw/zinc/18/59/44/919185944.db2.gz WZPIEQFWQKLZDC-YADHBBJMSA-N 0 3 423.557 4.421 20 0 HIADHN O=C(Nc1ccccc1OC[C@@H]1CCCCO1)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000510739432 919186719 /nfs/dbraw/zinc/18/67/19/919186719.db2.gz WZPIEQFWQKLZDC-VXKWHMMOSA-N 0 3 423.557 4.421 20 0 HIADHN Cc1ccc(NC(=O)NCCCN2CCc3ccccc3C2)c(OC[C@H]2CCCO2)c1 ZINC000510752205 919204140 /nfs/dbraw/zinc/20/41/40/919204140.db2.gz NJHROWLQEFYMOG-JOCHJYFZSA-N 0 3 423.557 4.123 20 0 HIADHN COCc1ccccc1NC(=O)N(CCN(C)C)Cc1ccc(Br)cc1 ZINC000510764466 919219808 /nfs/dbraw/zinc/21/98/08/919219808.db2.gz NSIFDDYEWZDOOG-UHFFFAOYSA-N 0 3 420.351 4.191 20 0 HIADHN C[C@@H](C(=O)Nc1ccc(=O)n(Cc2ccc(Cl)c(Cl)c2)c1)N1CCCCCC1 ZINC000510778872 919239282 /nfs/dbraw/zinc/23/92/82/919239282.db2.gz NHWLDEMAJRONEU-HNNXBMFYSA-N 0 3 422.356 4.406 20 0 HIADHN C[C@H](CC1CCCCC1)C(=O)N1CCC[C@H](CN2CCN(c3ccccn3)CC2)C1 ZINC000510783699 919246050 /nfs/dbraw/zinc/24/60/50/919246050.db2.gz STGKSCWNFZNIOV-FYYLOGMGSA-N 0 3 412.622 4.049 20 0 HIADHN Cn1nnc2cc(CN3CCC[C@H](Cc4nc(C5CCCCCC5)no4)C3)ccc21 ZINC000510795243 919265286 /nfs/dbraw/zinc/26/52/86/919265286.db2.gz DMVDDVNTKNZLGH-QGZVFWFLSA-N 0 3 408.550 4.244 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)c3ccccc3OCC3CC3)CC2)c1 ZINC000510798714 919268906 /nfs/dbraw/zinc/26/89/06/919268906.db2.gz QJTPXJTWNXXCRU-UHFFFAOYSA-N 0 3 421.585 4.116 20 0 HIADHN Cc1cc(NC(=O)CCN2CCC[C@H](Cc3nc(C4CCCCCC4)no3)C2)no1 ZINC000510806122 919279353 /nfs/dbraw/zinc/27/93/53/919279353.db2.gz GHSIGWYZDQKRCW-QGZVFWFLSA-N 0 3 415.538 4.087 20 0 HIADHN COc1ccc(C[C@H](C)C(=O)N(Cc2ccccc2)C2CCN(C)CC2)cc1OC ZINC000510820921 919298122 /nfs/dbraw/zinc/29/81/22/919298122.db2.gz MAYKQPRYLJZYNG-IBGZPJMESA-N 0 3 410.558 4.005 20 0 HIADHN COc1ccc(C[C@@H](C)C(=O)N(Cc2ccccc2)C2CCN(C)CC2)cc1OC ZINC000510820922 919298590 /nfs/dbraw/zinc/29/85/90/919298590.db2.gz MAYKQPRYLJZYNG-LJQANCHMSA-N 0 3 410.558 4.005 20 0 HIADHN CC(C)COc1cccc(CNCc2ccc(C(=O)N3C[C@@H](C)O[C@H](C)C3)cc2)c1 ZINC000510845515 919330521 /nfs/dbraw/zinc/33/05/21/919330521.db2.gz MSEHYODLYUJNGG-WOJBJXKFSA-N 0 3 410.558 4.261 20 0 HIADHN COc1ccc(C[C@@H](NC(=O)[C@H](C)N2CCCCCC2)c2ccccc2)cc1OC ZINC000510860706 919351766 /nfs/dbraw/zinc/35/17/66/919351766.db2.gz CCCKQHNJTQSXGH-SIKLNZKXSA-N 0 3 410.558 4.368 20 0 HIADHN Cc1cc(C)n(-c2ccc(NC(=O)N[C@H]3CCN(Cc4ccccc4)C3)cc2F)n1 ZINC000510867532 919360541 /nfs/dbraw/zinc/36/05/41/919360541.db2.gz ITXGSJKIOLYSGJ-FQEVSTJZSA-N 0 3 407.493 4.024 20 0 HIADHN Cc1ccc(Cc2nnc([N-]C(=O)c3oc4ccccc4c3C[NH+](C)C)s2)cc1 ZINC000510883591 919379802 /nfs/dbraw/zinc/37/98/02/919379802.db2.gz YNBHGCLHJUKQQZ-UHFFFAOYSA-N 0 3 406.511 4.497 20 0 HIADHN O=C(NCc1ccsc1Br)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000510894295 919391302 /nfs/dbraw/zinc/39/13/02/919391302.db2.gz OJZRIYVFYPLVMR-INIZCTEOSA-N 0 3 408.365 4.147 20 0 HIADHN O=C(CC(F)(F)F)NC[C@H]1CCCN(CCCc2ccccc2Br)C1 ZINC000510919577 919434043 /nfs/dbraw/zinc/43/40/43/919434043.db2.gz JFHNUMPBILVRPW-CQSZACIVSA-N 0 3 421.301 4.162 20 0 HIADHN Cc1ccc(NC(=O)N(CCN(C)C)Cc2ccccc2)c(OC[C@@H]2CCCO2)c1 ZINC000510995596 919552508 /nfs/dbraw/zinc/55/25/08/919552508.db2.gz GVLHRTKODCFATE-NRFANRHFSA-N 0 3 411.546 4.149 20 0 HIADHN COc1cc(C(=O)N(CCN(C)C)Cc2cccc(F)c2)cc(OC)c1C(C)C ZINC000511022865 919593697 /nfs/dbraw/zinc/59/36/97/919593697.db2.gz VLUSLVNHWTVANK-UHFFFAOYSA-N 0 3 402.510 4.170 20 0 HIADHN COc1cccc(OC)c1OC[C@H](O)CN1CCC([C@@H](F)c2ccccc2F)CC1 ZINC000511090287 919693703 /nfs/dbraw/zinc/69/37/03/919693703.db2.gz MLJONZFDFOAIJQ-VGOFRKELSA-N 0 3 421.484 4.005 20 0 HIADHN COc1cccc(OC)c1OC[C@H](O)CN1CCC([C@H](F)c2ccccc2F)CC1 ZINC000511090289 919694691 /nfs/dbraw/zinc/69/46/91/919694691.db2.gz MLJONZFDFOAIJQ-VGSWGCGISA-N 0 3 421.484 4.005 20 0 HIADHN Cc1ccc2nc(CN(Cc3ccccc3C(F)(F)F)CC3CC3)cc(=O)n2c1 ZINC000511095479 919699738 /nfs/dbraw/zinc/69/97/38/919699738.db2.gz KELXMGZKXYILMR-UHFFFAOYSA-N 0 3 401.432 4.434 20 0 HIADHN CN(CCCc1cc(-c2ccc(F)cc2)n[nH]1)C(=O)[C@@H]1CCCN1Cc1ccccc1 ZINC000511105788 919712879 /nfs/dbraw/zinc/71/28/79/919712879.db2.gz KLDGMTKBVIFIHI-DEOSSOPVSA-N 0 3 420.532 4.271 20 0 HIADHN Cc1ccc(Cc2nc(C(=O)Nc3cccc(CN4CCC(O)CC4)c3)cs2)cc1 ZINC000511109733 919720759 /nfs/dbraw/zinc/72/07/59/919720759.db2.gz PFSRRGWHGHPCKK-UHFFFAOYSA-N 0 3 421.566 4.251 20 0 HIADHN CCCCc1ccc([C@@H](NC(=O)CCN2CCN(CC)CC2)c2cccs2)cc1 ZINC000511114026 919724459 /nfs/dbraw/zinc/72/44/59/919724459.db2.gz GCVOJJRNOZAVSH-XMMPIXPASA-N 0 3 413.631 4.324 20 0 HIADHN C[C@H]1CCCN(CCNC(=O)c2cccnc2Oc2cccc(Br)c2)C1 ZINC000511157873 919778192 /nfs/dbraw/zinc/77/81/92/919778192.db2.gz DIEAYHOELUOOCR-HNNXBMFYSA-N 0 3 418.335 4.098 20 0 HIADHN COc1ccc(NC(=O)C2(NCc3ccccc3SC)CCCC2)cc1OC ZINC000511158817 919778870 /nfs/dbraw/zinc/77/88/70/919778870.db2.gz XPTKAYLKPYZZSX-UHFFFAOYSA-N 0 3 400.544 4.467 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)N[C@H](c2ccccc2)C2CCC2)CC1 ZINC000511201153 919815577 /nfs/dbraw/zinc/81/55/77/919815577.db2.gz NETLUOPGGLEQCX-RUZDIDTESA-N 0 3 420.601 4.165 20 0 HIADHN CC[C@H](C)n1ncc2c1nc(C)cc2C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000511207398 919820077 /nfs/dbraw/zinc/82/00/77/919820077.db2.gz NZOJXKWDZUFYIY-AZUAARDMSA-N 0 3 405.546 4.105 20 0 HIADHN C[C@H](NC(=O)N[C@@H](C)C1=CCN(C)CC1)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000511216495 919827549 /nfs/dbraw/zinc/82/75/49/919827549.db2.gz MFBMHBPYTSOWTN-ROUUACIJSA-N 0 3 411.521 4.415 20 0 HIADHN COc1ccc(-c2nc(C)c([C@H](C)NC(=O)N[C@H](C)C3=CCN(C)CC3)s2)cc1 ZINC000511275464 919872030 /nfs/dbraw/zinc/87/20/30/919872030.db2.gz VXYQSACNSNJZNC-ZBFHGGJFSA-N 0 3 414.575 4.138 20 0 HIADHN O=C(NCc1ccc(OC(F)F)c(F)c1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000511285735 919881621 /nfs/dbraw/zinc/88/16/21/919881621.db2.gz GWOWHGYIYTZXCU-MRXNPFEDSA-N 0 3 410.411 4.095 20 0 HIADHN Cc1nc2c3ccccc3nn2c(C)c1CCC(=O)N(CCN(C)C)C1CCCCC1 ZINC000511337905 919930904 /nfs/dbraw/zinc/93/09/04/919930904.db2.gz CIHQPOHLSWSWRV-UHFFFAOYSA-N 0 3 421.589 4.155 20 0 HIADHN Cc1ccc(OCc2nc(CC(=O)N(CCN(C)C)C3CCCCC3)cs2)cc1 ZINC000511341310 919932015 /nfs/dbraw/zinc/93/20/15/919932015.db2.gz NYTVYXAGAMYDCL-UHFFFAOYSA-N 0 3 415.603 4.296 20 0 HIADHN CC[C@@H](C)n1ncc2c1nc(C)cc2C(=O)N[C@H](CN1CCCC1)c1ccccc1 ZINC000511354675 919948451 /nfs/dbraw/zinc/94/84/51/919948451.db2.gz FRSRCPUGHBUGKA-XMSQKQJNSA-N 0 3 405.546 4.278 20 0 HIADHN Cc1ccc(-c2cc(C(=O)N[C@@H](C)C3=CCN(C)CC3)c3cnn(C(C)C)c3n2)cc1 ZINC000511370739 919964170 /nfs/dbraw/zinc/96/41/70/919964170.db2.gz VAPDHGQVMSZCJQ-SFHVURJKSA-N 0 3 417.557 4.368 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)N[C@@H](C[C@H]2CCOC2)c2ccccc2)CC1 ZINC000511397859 920009679 /nfs/dbraw/zinc/00/96/79/920009679.db2.gz LIWHKKQIWMWKAN-XXBNENTESA-N 0 3 411.546 4.053 20 0 HIADHN COc1cc(CN2CCCN(c3ccccc3)CC2)ccc1OCc1ccncc1 ZINC000511464297 920074214 /nfs/dbraw/zinc/07/42/14/920074214.db2.gz YGGDVOWCVUESQH-UHFFFAOYSA-N 0 3 403.526 4.382 20 0 HIADHN Cc1csc(CCCCNC(=O)[C@@H]2CN(Cc3ccccc3)CCC2(F)F)n1 ZINC000511464691 920075360 /nfs/dbraw/zinc/07/53/60/920075360.db2.gz ZDXGFWYYLSEBFF-SFHVURJKSA-N 0 3 407.530 4.048 20 0 HIADHN CN(CCCc1cc(-c2cccc(F)c2)n[nH]1)Cc1ccc(Br)cn1 ZINC000511496512 920108745 /nfs/dbraw/zinc/10/87/45/920108745.db2.gz QVOFGIAKPVZGTI-UHFFFAOYSA-N 0 3 403.299 4.438 20 0 HIADHN CN(C)Cc1cccc(NC(=O)C(=O)N2CCC[C@H]2c2ccc(C(C)(C)C)cc2)c1 ZINC000511561271 920202383 /nfs/dbraw/zinc/20/23/83/920202383.db2.gz QPUHQRLXNRVPIF-QFIPXVFZSA-N 0 3 407.558 4.348 20 0 HIADHN Cc1cc(Cl)c(C(=O)Nc2ccc(C(=O)N(C)[C@@H]3CCCN(C)C3)cc2)cc1C ZINC000511572263 920214864 /nfs/dbraw/zinc/21/48/64/920214864.db2.gz ITOPYTPXINQZFX-LJQANCHMSA-N 0 3 413.949 4.375 20 0 HIADHN CCC1(C(=O)NC[C@H](c2ccc(C)cc2)N(C)C)CCN(C(=O)c2ccccc2)CC1 ZINC000511576978 920219581 /nfs/dbraw/zinc/21/95/81/920219581.db2.gz BWNGJRCWSVDCNU-HSZRJFAPSA-N 0 3 421.585 4.047 20 0 HIADHN CCC1(C(=O)NC[C@@H](c2ccc(C)cc2)N(C)C)CCN(C(=O)c2ccccc2)CC1 ZINC000511576980 920221060 /nfs/dbraw/zinc/22/10/60/920221060.db2.gz BWNGJRCWSVDCNU-QHCPKHFHSA-N 0 3 421.585 4.047 20 0 HIADHN COc1ccc(NC(=O)CN[C@H](c2cccc(OC(F)(F)F)c2)C2CC2)c(OC)c1 ZINC000511580601 920224728 /nfs/dbraw/zinc/22/47/28/920224728.db2.gz XTXDVCZNEHCXAB-FQEVSTJZSA-N 0 3 424.419 4.282 20 0 HIADHN COc1ccccc1CN(C)C(=O)CN[C@H](c1cccc(OC(F)(F)F)c1)C1CC1 ZINC000511599104 920245785 /nfs/dbraw/zinc/24/57/85/920245785.db2.gz YKSMKHZNRPBNOM-NRFANRHFSA-N 0 3 422.447 4.293 20 0 HIADHN CC[C@H](C)n1ncc2c1nc(C)cc2C(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000511677502 920342399 /nfs/dbraw/zinc/34/23/99/920342399.db2.gz MHKJMONIJREQKG-NLWGTHIKSA-N 0 3 405.546 4.276 20 0 HIADHN Fc1cccc([C@H]2CC[C@H](NCc3ncc(I)s3)C2)c1 ZINC000511763794 920447699 /nfs/dbraw/zinc/44/76/99/920447699.db2.gz VDWVTIZWPJWXFE-AAEUAGOBSA-N 0 3 402.276 4.313 20 0 HIADHN O=C(N[C@@H]1CN(Cc2ccccc2)C[C@H]1c1ccccc1)c1cc2c(s1)CCOC2 ZINC000511772954 920460934 /nfs/dbraw/zinc/46/09/34/920460934.db2.gz UXOBSANFKWKDEH-FCHUYYIVSA-N 0 3 418.562 4.219 20 0 HIADHN CCN1CCN(CCC(=O)N(CCC(C)C)Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000511782842 920475046 /nfs/dbraw/zinc/47/50/46/920475046.db2.gz FDDJYQCIEZTPEP-UHFFFAOYSA-N 0 3 414.421 4.396 20 0 HIADHN CCn1cccc(CN[C@H](C)CC(=O)Nc2cc(C(F)(F)F)ccc2Cl)c1=O ZINC000511791114 920484693 /nfs/dbraw/zinc/48/46/93/920484693.db2.gz JIHLSSOGOINUNB-GFCCVEGCSA-N 0 3 415.843 4.047 20 0 HIADHN CCN(CC)C(=O)c1ccc(NC(=O)CN2C[C@H](c3ccccc3)[C@@H]3CCC[C@H]32)cc1 ZINC000511842613 920557733 /nfs/dbraw/zinc/55/77/33/920557733.db2.gz KLMBITYKAMHENQ-RBZQAINGSA-N 0 3 419.569 4.375 20 0 HIADHN CCN(CC)C(=O)c1cccc(NC(=O)CN2C[C@H](c3ccccc3)[C@H]3CCC[C@@H]32)c1 ZINC000511897293 920634050 /nfs/dbraw/zinc/63/40/50/920634050.db2.gz RYOGNWMTBJQXIL-SMIHKQSGSA-N 0 3 419.569 4.375 20 0 HIADHN COc1cc(F)c([C@@H](C)NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)cc1OC ZINC000511915120 920657996 /nfs/dbraw/zinc/65/79/96/920657996.db2.gz DRKLQDUQQGOQIQ-NVXWUHKLSA-N 0 3 418.484 4.071 20 0 HIADHN Cc1ccc(Cc2cnc(NC(=O)N[C@@H](C)C3=CCN(C)CC3)s2)cc1Cl ZINC000511921798 920666309 /nfs/dbraw/zinc/66/63/09/920666309.db2.gz IHRFOVWSNAXZJP-AWEZNQCLSA-N 0 3 404.967 4.468 20 0 HIADHN COc1cc2c(cc1OC)CCN(Cc1ccccc1OCc1ccccn1)CC2 ZINC000512054527 920824318 /nfs/dbraw/zinc/82/43/18/920824318.db2.gz WDLMPYOZGPPGOF-UHFFFAOYSA-N 0 3 404.510 4.279 20 0 HIADHN COc1ccc(CNCCc2nc(-c3ccc(Cl)cc3)no2)c(Br)c1 ZINC000512068586 920835382 /nfs/dbraw/zinc/83/53/82/920835382.db2.gz RYBCGONRSKNSTK-UHFFFAOYSA-N 0 3 422.710 4.493 20 0 HIADHN O=C(NC1CCCCC1)N1CCC(NCc2cscc2Br)CC1 ZINC000512074749 920841226 /nfs/dbraw/zinc/84/12/26/920841226.db2.gz UYZKOBMVJJJHQU-UHFFFAOYSA-N 0 3 400.386 4.107 20 0 HIADHN Cc1cc([C@H](C)NCc2cccc(CS(C)(=O)=O)c2)sc1Br ZINC000512104130 920862702 /nfs/dbraw/zinc/86/27/02/920862702.db2.gz HKSRYGUCEHAYMO-LBPRGKRZSA-N 0 3 402.379 4.214 20 0 HIADHN Cc1ccccc1-c1cc(C(=O)N[C@@H](C)C2=CCN(C)CC2)c2cnn(C(C)C)c2n1 ZINC000512107727 920864861 /nfs/dbraw/zinc/86/48/61/920864861.db2.gz DDMZVJAZTDWGNH-SFHVURJKSA-N 0 3 417.557 4.368 20 0 HIADHN Cc1cc([C@H](C)NCc2ccc(CS(C)(=O)=O)cc2)sc1Br ZINC000512110170 920865782 /nfs/dbraw/zinc/86/57/82/920865782.db2.gz ZKRVBEWESLAIFF-LBPRGKRZSA-N 0 3 402.379 4.214 20 0 HIADHN CCn1cc(Br)cc1C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000512110997 920867161 /nfs/dbraw/zinc/86/71/61/920867161.db2.gz BBPQOBPTSSPLEG-UHFFFAOYSA-N 0 3 422.392 4.114 20 0 HIADHN CC(C)n1ncc2c1nc(-c1cccs1)cc2C(=O)N[C@@H](C)C1=CCN(C)CC1 ZINC000512129563 920877728 /nfs/dbraw/zinc/87/77/28/920877728.db2.gz WPACRLMGQYVJSO-HNNXBMFYSA-N 0 3 409.559 4.121 20 0 HIADHN Cc1cccc(-c2nn(-c3ccccc3)cc2C(=O)N[C@H](C)C2=CCN(C)CC2)c1 ZINC000512139820 920886064 /nfs/dbraw/zinc/88/60/64/920886064.db2.gz TUYBXSXQOWKNSI-LJQANCHMSA-N 0 3 400.526 4.228 20 0 HIADHN OCC[C@@H](NC[C@@H](O)COc1ccccc1Cl)c1ccc(Cl)c(Cl)c1 ZINC000512202458 920948670 /nfs/dbraw/zinc/94/86/70/920948670.db2.gz KMZLXRXMLWRVIZ-CXAGYDPISA-N 0 3 404.721 4.100 20 0 HIADHN CCN(CC)C(=O)C1CCN(Cc2cn(Cc3ccccc3)nc2C(C)(C)C)CC1 ZINC000512243731 921001026 /nfs/dbraw/zinc/00/10/26/921001026.db2.gz KYRQYWQAVDEPLL-UHFFFAOYSA-N 0 3 410.606 4.309 20 0 HIADHN O=C(C1CCN(Cc2ccc(OCC(F)F)cc2)CC1)N1CCc2ccccc21 ZINC000512256738 921015768 /nfs/dbraw/zinc/01/57/68/921015768.db2.gz ASKDDVBMMDMYEU-UHFFFAOYSA-N 0 3 400.469 4.132 20 0 HIADHN O=C(Cc1cccc(F)c1)N1CCCN(Cc2cccc(-c3cccnc3)c2)CC1 ZINC000512262370 921020084 /nfs/dbraw/zinc/02/00/84/921020084.db2.gz PJAFMFKYQPNIAV-UHFFFAOYSA-N 0 3 403.501 4.165 20 0 HIADHN CCCN(CC(=O)Nc1c(C)cccc1C)C1CCN(c2cc(C)nc(C)n2)CC1 ZINC000512283892 921039419 /nfs/dbraw/zinc/03/94/19/921039419.db2.gz VJXFOZADXGISHE-UHFFFAOYSA-N 0 3 409.578 4.030 20 0 HIADHN C[C@H](C(=O)Nc1ccc(CC(=O)N2CCc3ccccc32)cc1)N1[C@H](C)CC[C@H]1C ZINC000512295277 921052380 /nfs/dbraw/zinc/05/23/80/921052380.db2.gz ONDQTQSILJBKQN-GUDVDZBRSA-N 0 3 405.542 4.018 20 0 HIADHN CC(C)n1nccc1[C@H]1OCC[C@@H]1NCC1=Cc2cc(Br)ccc2OC1 ZINC000512344737 921089785 /nfs/dbraw/zinc/08/97/85/921089785.db2.gz ZOFJPXCGNKCBAD-PXNSSMCTSA-N 0 3 418.335 4.122 20 0 HIADHN CC(C)n1nccc1[C@H]1OCC[C@@H]1NCc1ccc(OCC(F)(F)F)c(F)c1 ZINC000512350059 921095255 /nfs/dbraw/zinc/09/52/55/921095255.db2.gz GKXZLZOWHGDGNG-YJBOKZPZSA-N 0 3 401.404 4.164 20 0 HIADHN CN(Cc1ccc(F)cc1)C[C@H](O)COc1ccc(Cl)cc1Br ZINC000513454926 921820822 /nfs/dbraw/zinc/82/08/22/921820822.db2.gz IWQDVMYZDYPHKN-HNNXBMFYSA-N 0 3 402.691 4.113 20 0 HIADHN CC(C)[C@@H](NC1CCN(Cc2c(F)cccc2Cl)CC1)c1nnc2ccccn21 ZINC000513484712 921840085 /nfs/dbraw/zinc/84/00/85/921840085.db2.gz OSSJWCVETCBNJE-OAQYLSRUSA-N 0 3 415.944 4.473 20 0 HIADHN Cc1ccccc1C[C@@H]1CCCN1C(=O)c1ccc(N2CCN(C(C)C)CC2)cc1 ZINC000513561351 921896155 /nfs/dbraw/zinc/89/61/55/921896155.db2.gz WCURKVIRFRKFDY-VWLOTQADSA-N 0 3 405.586 4.373 20 0 HIADHN CN(C)C[C@H](NC(=O)Cc1cscc1Br)c1ccc(Cl)cc1 ZINC000513573956 921906237 /nfs/dbraw/zinc/90/62/37/921906237.db2.gz SVEDPLSQSDOIDA-HNNXBMFYSA-N 0 3 401.757 4.126 20 0 HIADHN CC(=O)Nc1ccc(OC[C@H](O)CN(Cc2ccc(Cl)c(F)c2)C(C)C)cc1 ZINC000513655749 921977374 /nfs/dbraw/zinc/97/73/74/921977374.db2.gz OECPFPAVFBOIGV-GOSISDBHSA-N 0 3 408.901 4.088 20 0 HIADHN C[C@H](NCc1ccc(C(=O)Nc2ccc(F)cc2)cc1)c1ccc2c(c1)OCC(=O)N2 ZINC000513678445 921999732 /nfs/dbraw/zinc/99/97/32/921999732.db2.gz NEUCLMSZMUMDKA-HNNXBMFYSA-N 0 3 419.456 4.260 20 0 HIADHN CC(C)N(C(=O)[C@H](C)N(C)CCCc1cc(-c2ccc(F)cc2)n(C)n1)C(C)C ZINC000513707556 922027475 /nfs/dbraw/zinc/02/74/75/922027475.db2.gz FLBZKFRSYWQFIH-SFHVURJKSA-N 0 3 402.558 4.125 20 0 HIADHN COc1cc(OC)cc(Oc2ccc(CN3CCC(N4CCCC4=O)CC3)cc2)c1 ZINC000513728069 922048445 /nfs/dbraw/zinc/04/84/45/922048445.db2.gz DFUOVDQDRAGKHY-UHFFFAOYSA-N 0 3 410.514 4.083 20 0 HIADHN CC(=O)Nc1ccc(S(=O)(=O)CCCNC(c2ccccc2)c2ccccc2)cc1 ZINC000513734547 922055287 /nfs/dbraw/zinc/05/52/87/922055287.db2.gz BEZNWVHTRIKFGE-UHFFFAOYSA-N 0 3 422.550 4.188 20 0 HIADHN Cc1occc1C(=O)NC1CCN(Cc2ccc(-n3cnc4ccccc43)cc2)CC1 ZINC000513755411 922074263 /nfs/dbraw/zinc/07/42/63/922074263.db2.gz SJZTUZQKIWXDKC-UHFFFAOYSA-N 0 3 414.509 4.321 20 0 HIADHN C[C@H](CNC(=O)Cc1c[nH]c2cccc(Br)c12)N(C)Cc1ccccc1 ZINC000513775667 922097115 /nfs/dbraw/zinc/09/71/15/922097115.db2.gz TWTJKRSQSKNHJV-OAHLLOKOSA-N 0 3 414.347 4.110 20 0 HIADHN C[C@]1(c2ccc(CN[C@@H]3CC4(CCCCC4)Oc4ccccc43)cc2)NC(=O)NC1=O ZINC000513789262 922116209 /nfs/dbraw/zinc/11/62/09/922116209.db2.gz FLZAWKXMOLGTGI-HYBUGGRVSA-N 0 3 419.525 4.058 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)C[C@H](C)c1c(C)noc1C ZINC000513949156 922267643 /nfs/dbraw/zinc/26/76/43/922267643.db2.gz WJVFLEMJIWDSSY-HRAATJIYSA-N 0 3 421.545 4.376 20 0 HIADHN CCN(CCc1nccs1)C(=O)NC[C@H](c1ccccc1)N1CCC(C)CC1 ZINC000513998118 922322459 /nfs/dbraw/zinc/32/24/59/922322459.db2.gz ZAKMLHZNAHBJQW-HXUWFJFHSA-N 0 3 400.592 4.190 20 0 HIADHN COc1ccc2cccc(CC(=O)N3CCC(CCN4C[C@@H](C)O[C@H](C)C4)CC3)c2c1 ZINC000514011276 922335896 /nfs/dbraw/zinc/33/58/96/922335896.db2.gz MIXDSKDUBIESCP-WOJBJXKFSA-N 0 3 424.585 4.129 20 0 HIADHN CCOc1cc2c(cc1CNC(=O)N[C@@H]1CCN([C@H](C)c3ccccc3)C1)O[C@H](C)C2 ZINC000514027528 922350081 /nfs/dbraw/zinc/35/00/81/922350081.db2.gz SXYJIZYHNQOJCC-JBYIUTFZSA-N 0 3 423.557 4.043 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1nc(-c2ccccc2)cs1 ZINC000514058467 922381324 /nfs/dbraw/zinc/38/13/24/922381324.db2.gz WIHWXTJTGBGVRG-UHFFFAOYSA-N 0 3 409.477 4.345 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1ccccc1Oc1ccncc1 ZINC000514059554 922382866 /nfs/dbraw/zinc/38/28/66/922382866.db2.gz QUSQFBFYZSBOTR-UHFFFAOYSA-N 0 3 419.447 4.409 20 0 HIADHN COc1ccc([C@H](C)N[C@@H](C)c2ccc(OCC(=O)NC3CC3)cc2)c(C)c1OC ZINC000514105979 922435269 /nfs/dbraw/zinc/43/52/69/922435269.db2.gz VGDRMNOTQQBRBK-IRXDYDNUSA-N 0 3 412.530 4.081 20 0 HIADHN Cc1ccc(NC(=O)NC[C@H]2CCCN(Cc3nc4ccccc4nc3C)C2)cc1 ZINC000514106420 922435584 /nfs/dbraw/zinc/43/55/84/922435584.db2.gz XYPGNLYEFDRLDU-LJQANCHMSA-N 0 3 403.530 4.280 20 0 HIADHN O=C(NCc1sccc1Br)NC[C@@H](c1cccs1)N1CCCC1 ZINC000514144095 922477753 /nfs/dbraw/zinc/47/77/53/922477753.db2.gz BPODBNFKFVAYDE-ZDUSSCGKSA-N 0 3 414.394 4.208 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)NC[C@H](c2ccccc2Cl)N(C)C)C1 ZINC000514146200 922480990 /nfs/dbraw/zinc/48/09/90/922480990.db2.gz VBVFBVNOGYMDFL-ZWCUEREDSA-N 0 3 414.981 4.077 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)NC[C@H](c2ccccc2Cl)N(C)C)C1 ZINC000514146199 922481483 /nfs/dbraw/zinc/48/14/83/922481483.db2.gz VBVFBVNOGYMDFL-SFGWALBWSA-N 0 3 414.981 4.077 20 0 HIADHN CC[C@H](NC(=O)N[C@H]1CCN(Cc2ccccc2)C1)c1nc(-c2ccccc2)c[nH]1 ZINC000514148635 922484189 /nfs/dbraw/zinc/48/41/89/922484189.db2.gz GQEYEHOJDDXEFJ-SFTDATJTSA-N 0 3 403.530 4.102 20 0 HIADHN CCn1c2ccccc2nc1[C@@H]1CCCN1C(=O)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000514150016 922485253 /nfs/dbraw/zinc/48/52/53/922485253.db2.gz VVIPBNFXOHITQL-REWPJTCUSA-N 0 3 417.557 4.177 20 0 HIADHN Cc1ccccc1CN(Cc1cccnc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000514157822 922496946 /nfs/dbraw/zinc/49/69/46/922496946.db2.gz KFLFIBPNKCRQON-RUZDIDTESA-N 0 3 414.553 4.376 20 0 HIADHN CCOc1ccc(CNC(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)cc1 ZINC000514182458 922521495 /nfs/dbraw/zinc/52/14/95/922521495.db2.gz LICAFLRMGSNTQP-HXUWFJFHSA-N 0 3 401.576 4.419 20 0 HIADHN O=C(NCc1ccc(Oc2cccnc2)c(F)c1)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000514182707 922521591 /nfs/dbraw/zinc/52/15/91/922521591.db2.gz ONJGVUVRSDAIQW-FQEVSTJZSA-N 0 3 420.488 4.087 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N3CC[C@H](C(F)(F)F)C4(CCC4)C3)cc2)CC1 ZINC000514191103 922530950 /nfs/dbraw/zinc/53/09/50/922530950.db2.gz VLEYMSMJVILNIU-FQEVSTJZSA-N 0 3 423.523 4.412 20 0 HIADHN C[C@@H](NC(=O)N[C@@H](CN1CCCC1)c1ccccc1)c1cccc(N2CCCC2=O)c1 ZINC000514207003 922544118 /nfs/dbraw/zinc/54/41/18/922544118.db2.gz XWMBMYKGRDTMKK-XXBNENTESA-N 0 3 420.557 4.011 20 0 HIADHN CCCN(CCCS(=O)(=O)c1ccc(NC(C)=O)cc1)[C@H]1CCc2ccccc21 ZINC000514224134 922560179 /nfs/dbraw/zinc/56/01/79/922560179.db2.gz XZHSLSWLUCSUCT-QHCPKHFHSA-N 0 3 414.571 4.208 20 0 HIADHN CCCN(C(=O)NCc1cccc(COC)c1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000514247664 922590171 /nfs/dbraw/zinc/59/01/71/922590171.db2.gz DRJVEXQEFFVQCS-DEOSSOPVSA-N 0 3 409.574 4.419 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)CSc1nccn1-c1cccc(C)c1C ZINC000514398339 922612808 /nfs/dbraw/zinc/61/28/08/922612808.db2.gz JUWXAAGESCFLJN-UHFFFAOYSA-N 0 3 424.570 4.290 20 0 HIADHN O=C(CCCc1ncc(-c2ccccc2)o1)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000514408170 922614408 /nfs/dbraw/zinc/61/44/08/922614408.db2.gz ZKHTXNPVZFTLKP-JOCHJYFZSA-N 0 3 403.526 4.445 20 0 HIADHN Cc1nc(-c2ccc(CNC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)s2)cs1 ZINC000514438646 922627533 /nfs/dbraw/zinc/62/75/33/922627533.db2.gz QVQABMNAHLVWSG-QGZVFWFLSA-N 0 3 412.584 4.254 20 0 HIADHN C[C@H](NC(=O)NC[C@@H](c1ccccc1)N(C)C)c1ccc(OCc2cccnc2)cc1 ZINC000514447037 922629725 /nfs/dbraw/zinc/62/97/25/922629725.db2.gz VUUIFLUOMIWPKX-CYFREDJKSA-N 0 3 418.541 4.324 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3ccc(-c4ccccc4)[nH]c3=O)c(C)c2)CC1 ZINC000514580525 922715772 /nfs/dbraw/zinc/71/57/72/922715772.db2.gz QLUSLMYRGTZRBI-UHFFFAOYSA-N 0 3 416.525 4.157 20 0 HIADHN O=C(CCCNCc1cn2ccc(Br)cc2n1)Nc1ccc(Cl)cc1 ZINC000514929513 922846548 /nfs/dbraw/zinc/84/65/48/922846548.db2.gz QUGOCDJLBYMFKC-UHFFFAOYSA-N 0 3 421.726 4.259 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)COc1ccc(OCc2ccccc2)cc1 ZINC000515030423 922886000 /nfs/dbraw/zinc/88/60/00/922886000.db2.gz RQIXIDOKKDQPHC-UHFFFAOYSA-N 0 3 420.509 4.353 20 0 HIADHN CCOc1cc(C[NH2+]C[C@@H]2CCN(c3ccc(F)cc3)C2)cc(Br)c1[O-] ZINC000515147261 922950016 /nfs/dbraw/zinc/95/00/16/922950016.db2.gz BWFKBMHAZQAIDV-AWEZNQCLSA-N 0 3 423.326 4.309 20 0 HIADHN CCn1c2ccccc2c2cc(NC(=O)C(=O)NC[C@H](C)N3CCCC[C@@H]3C)ccc21 ZINC000515278515 923031196 /nfs/dbraw/zinc/03/11/96/923031196.db2.gz LBOBMDFXYZBNDO-ROUUACIJSA-N 0 3 420.557 4.132 20 0 HIADHN COc1ccc(Cl)cc1CN(C)C(=O)NC[C@H](c1ccccc1)N1CCCC1 ZINC000515294328 923038741 /nfs/dbraw/zinc/03/87/41/923038741.db2.gz RNCDWNMIAOMMCJ-HXUWFJFHSA-N 0 3 401.938 4.327 20 0 HIADHN CN(C)[C@@H](CNC(=O)N(C)CCCc1cc(-c2ccc(F)cc2)n[nH]1)c1ccccc1 ZINC000515295764 923039684 /nfs/dbraw/zinc/03/96/84/923039684.db2.gz FZCRIHSBPLPPFU-QHCPKHFHSA-N 0 3 423.536 4.093 20 0 HIADHN CC[C@@H](NCc1cc2c(s1)CCCC2)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000515361481 923065713 /nfs/dbraw/zinc/06/57/13/923065713.db2.gz PENFNMGFOYOEGV-QGZVFWFLSA-N 0 3 413.008 4.429 20 0 HIADHN COc1cccc(-c2nc(CN3CCN(CCC(C)(C)C)CC3)cs2)c1OC ZINC000515508416 923141319 /nfs/dbraw/zinc/14/13/19/923141319.db2.gz BEAMCQBCVDLJEV-UHFFFAOYSA-N 0 3 403.592 4.381 20 0 HIADHN CCc1ccc([C@H](C)NC(=O)[C@@H](C)N[C@H](C)c2ccc(NC(=O)NC3CC3)cc2)cc1 ZINC000515517118 923147293 /nfs/dbraw/zinc/14/72/93/923147293.db2.gz FHNHYAARYHTGCE-FGTMMUONSA-N 0 3 422.573 4.449 20 0 HIADHN O[C@H](COc1cccc2[nH]ccc21)CN1CCC(c2noc3cc(F)ccc32)CC1 ZINC000515529632 923157649 /nfs/dbraw/zinc/15/76/49/923157649.db2.gz ATKYURYHPOZHFR-KRWDZBQOSA-N 0 3 409.461 4.068 20 0 HIADHN Cn1cc(-c2ccc(CN(Cc3ccc(C(=O)NC4CC4)cc3)C3CC3)s2)cn1 ZINC000515676252 923261151 /nfs/dbraw/zinc/26/11/51/923261151.db2.gz ZTHUQCLGFNUWIA-UHFFFAOYSA-N 0 3 406.555 4.205 20 0 HIADHN CCOc1c(Cl)cc(CNC(=O)N2CCN(CCC(C)(C)C)CC2)cc1OC ZINC000515790955 923351831 /nfs/dbraw/zinc/35/18/31/923351831.db2.gz VYJMZXKIEKTPAS-UHFFFAOYSA-N 0 3 411.974 4.011 20 0 HIADHN O=C(NCc1cc(F)cc(Br)c1)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000515869207 923402186 /nfs/dbraw/zinc/40/21/86/923402186.db2.gz ZIPBZQSREOCLAF-IBGZPJMESA-N 0 3 420.326 4.225 20 0 HIADHN CC(C)NC(=O)Nc1cccc(C(=O)NC[C@H](c2ccccc2)N2CCC(C)CC2)c1 ZINC000515988118 923484094 /nfs/dbraw/zinc/48/40/94/923484094.db2.gz QHSVOLLHZBMEIV-HSZRJFAPSA-N 0 3 422.573 4.420 20 0 HIADHN CN(C)Cc1cccc(NC(=O)c2ccc(Cl)c(I)c2)c1 ZINC000516072264 923527589 /nfs/dbraw/zinc/52/75/89/923527589.db2.gz CAOKAWZNNAQQJO-UHFFFAOYSA-N 0 3 414.674 4.259 20 0 HIADHN COC(=O)c1ccc(CN[C@H]2CCO[C@H](c3ccc(F)cc3)C2)c(Br)c1 ZINC000516076570 923530290 /nfs/dbraw/zinc/53/02/90/923530290.db2.gz OFFLYBVWKWCWND-HKUYNNGSSA-N 0 3 422.294 4.385 20 0 HIADHN CO[C@@H](CNC(=O)NC[C@H](c1cccs1)N1CCC(C)CC1)c1ccccc1 ZINC000516150693 923577648 /nfs/dbraw/zinc/57/76/48/923577648.db2.gz TUAXTLHRXQLRNN-UXHICEINSA-N 0 3 401.576 4.208 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)c1cccc(-n2nccc2C(F)(F)F)c1)c1ccco1 ZINC000516335065 923671367 /nfs/dbraw/zinc/67/13/67/923671367.db2.gz ZGMMPOREUCGOQO-WMLDXEAASA-N 0 3 420.435 4.343 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)NCc2ccc(OC3CCCC3)nc2)C1 ZINC000516579374 923800046 /nfs/dbraw/zinc/80/00/46/923800046.db2.gz SFOOYVBDHVASTB-GHTZIAJQSA-N 0 3 408.546 4.038 20 0 HIADHN CC1CCN([C@H](CNC(=O)N2CC(C)(C)[C@@H]2[C@@H]2CCCO2)c2cccs2)CC1 ZINC000516610659 923815743 /nfs/dbraw/zinc/81/57/43/923815743.db2.gz ZNUPCEHSLCFQRE-HBFSDRIKSA-N 0 3 405.608 4.120 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)Nc1ncc(C(F)(F)F)s1 ZINC000516788729 923887554 /nfs/dbraw/zinc/88/75/54/923887554.db2.gz LBXWSUXIQZGCIJ-UHFFFAOYSA-N 0 3 400.470 4.190 20 0 HIADHN CC[C@H](CNC(=O)c1ccc(Oc2cccnc2)cc1)N1CCc2ccccc2C1 ZINC000516818648 923902233 /nfs/dbraw/zinc/90/22/33/923902233.db2.gz KLARORIIZOBYTE-JOCHJYFZSA-N 0 3 401.510 4.441 20 0 HIADHN COC(=O)c1cccc(NC2CCN(Cc3ccc(Oc4cnccn4)cc3)CC2)c1 ZINC000517057540 923979268 /nfs/dbraw/zinc/97/92/68/923979268.db2.gz RGKKFGRNBQFQLG-UHFFFAOYSA-N 0 3 418.497 4.132 20 0 HIADHN CC1CCN([C@@H](CNC(=O)NCCCCNc2ccccn2)c2cccs2)CC1 ZINC000517103062 923998987 /nfs/dbraw/zinc/99/89/87/923998987.db2.gz APDKBXVCNZCYBR-IBGZPJMESA-N 0 3 415.607 4.108 20 0 HIADHN CC(C)Oc1ccc(CC[C@H](C)N[C@@H](C(N)=O)c2ccc(Br)cc2)cc1 ZINC000517166578 924034650 /nfs/dbraw/zinc/03/46/50/924034650.db2.gz MLAQGSVJSKVMNZ-MGPUTAFESA-N 0 3 419.363 4.374 20 0 HIADHN CC[C@@H](c1ccccc1OC)N(C)C(=O)CCCN1CCN(c2ccccc2)CC1 ZINC000517256899 924064428 /nfs/dbraw/zinc/06/44/28/924064428.db2.gz OWETUPDEQGDZPI-QHCPKHFHSA-N 0 3 409.574 4.207 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)Cc1coc(-c2cccs2)n1 ZINC000517308488 924092849 /nfs/dbraw/zinc/09/28/49/924092849.db2.gz LRMBQZCBYFPCNJ-UHFFFAOYSA-N 0 3 403.935 4.189 20 0 HIADHN C[C@@H](NC(=O)NCCCN1CCc2ccccc2C1)c1nc(C(C)(C)C)cs1 ZINC000517335586 924109965 /nfs/dbraw/zinc/10/99/65/924109965.db2.gz SDTJYTICRINAIP-MRXNPFEDSA-N 0 3 400.592 4.249 20 0 HIADHN COc1ccc(-c2nc3c(s2)[C@@H](NCC2(S(C)(=O)=O)CCCC2)CCC3)cc1 ZINC000517344455 924116296 /nfs/dbraw/zinc/11/62/96/924116296.db2.gz HDALYQPJZVPWFY-KRWDZBQOSA-N 0 3 420.600 4.143 20 0 HIADHN NS(=O)(=O)c1ccc2c(c1)[C@H](NCCOc1ccccc1-c1ccccc1)CCC2 ZINC000517349777 924122700 /nfs/dbraw/zinc/12/27/00/924122700.db2.gz TTZMTVRNMRFRHA-HSZRJFAPSA-N 0 3 422.550 4.047 20 0 HIADHN O=S(=O)(c1c(Cl)cc(Cl)cc1Cl)N1CCCC[C@@H](N2CCCC2)C1 ZINC000517415650 924166218 /nfs/dbraw/zinc/16/62/18/924166218.db2.gz XMJMRKYCKNIFAI-CYBMUJFWSA-N 0 3 411.782 4.286 20 0 HIADHN CCCN(C(=O)NCc1csc(CC)n1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000517425961 924175721 /nfs/dbraw/zinc/17/57/21/924175721.db2.gz FHVBSGZDWSILFQ-FQEVSTJZSA-N 0 3 400.592 4.292 20 0 HIADHN CCn1ncc2c1nc(-c1ccccc1)cc2C(=O)N1CCN(CCC(C)(C)C)CC1 ZINC000517472676 924213841 /nfs/dbraw/zinc/21/38/41/924213841.db2.gz TWQBSMZOJSTXDQ-UHFFFAOYSA-N 0 3 419.573 4.312 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)NCc2cc(Br)cs2)C1 ZINC000517544831 924257012 /nfs/dbraw/zinc/25/70/12/924257012.db2.gz TYNCSWQFLLKSID-CZUORRHYSA-N 0 3 408.365 4.145 20 0 HIADHN COc1cc(Cl)c(C)cc1NC(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000517600351 926709923 /nfs/dbraw/zinc/70/99/23/926709923.db2.gz RSAVQSGKCKRFNJ-IYBDPMFKSA-N 0 3 409.958 4.010 20 0 HIADHN COc1ccccc1OCc1ccc(C(=O)NC[C@@H](C)N(C)Cc2ccccc2)o1 ZINC000517656536 926763842 /nfs/dbraw/zinc/76/38/42/926763842.db2.gz IESROGNYBIKAAU-GOSISDBHSA-N 0 3 408.498 4.118 20 0 HIADHN CN(C(=O)[C@@H](Oc1ccc(F)cc1Cl)c1ccccc1)[C@@H]1CCN(C2CC2)C1 ZINC000517697335 926800432 /nfs/dbraw/zinc/80/04/32/926800432.db2.gz ONRSCWKYDUXEMO-NQIIRXRSSA-N 0 3 402.897 4.294 20 0 HIADHN COCCN1CCC[C@@H]1CNC(=O)c1ccccc1-c1ncc(-c2ccc(C)cc2)o1 ZINC000517805299 926844390 /nfs/dbraw/zinc/84/43/90/926844390.db2.gz CKTUKIDVJUJQRM-HXUWFJFHSA-N 0 3 419.525 4.158 20 0 HIADHN CN(C)Cc1cccc(NC(=O)C(=O)N2CCC[C@H]2c2cccc3ccccc32)c1 ZINC000517818360 926850551 /nfs/dbraw/zinc/85/05/51/926850551.db2.gz VTHGOWCVHYPXFF-QHCPKHFHSA-N 0 3 401.510 4.204 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCc1ncccc1C)c1ccc(C(F)(F)F)cc1 ZINC000517887344 926875422 /nfs/dbraw/zinc/87/54/22/926875422.db2.gz LEIVQFNUTGJQQK-LJQANCHMSA-N 0 3 408.468 4.291 20 0 HIADHN CC(C)(C)c1csc(CCNC(=O)NCC(C)(C)N2CCc3ccccc3C2)n1 ZINC000517890097 926877531 /nfs/dbraw/zinc/87/75/31/926877531.db2.gz TXSMLBVLHIZNOL-UHFFFAOYSA-N 0 3 414.619 4.119 20 0 HIADHN CC[C@H](C)[C@H](C)N(CC(=O)N(C)CC(=O)Nc1ccccc1C(F)(F)F)C1CC1 ZINC000517908941 926886462 /nfs/dbraw/zinc/88/64/62/926886462.db2.gz RTVWDUXPEBMUQJ-GJZGRUSLSA-N 0 3 413.484 4.001 20 0 HIADHN CC(=O)NCC[C@@H]1CCCN(c2c(C)c(C)nc3ccc(Br)cc32)C1 ZINC000517995986 926937759 /nfs/dbraw/zinc/93/77/59/926937759.db2.gz GCOJJIUJNSCNQA-INIZCTEOSA-N 0 3 404.352 4.357 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N[C@H](C)c3nc(C(C)(C)C)cs3)cc2)CC1 ZINC000518043586 926981852 /nfs/dbraw/zinc/98/18/52/926981852.db2.gz FKNLOKLBRWACOR-QGZVFWFLSA-N 0 3 414.619 4.462 20 0 HIADHN CCCOc1ccc(CNC(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)cn1 ZINC000518083008 927012332 /nfs/dbraw/zinc/01/23/32/927012332.db2.gz HFYSYWWZKIDNQA-IBGZPJMESA-N 0 3 416.591 4.204 20 0 HIADHN COc1ccc([C@@H](CNC(=O)Nc2ccc(C(F)(F)F)nc2)N2CCCC2)cc1 ZINC000518146317 927045888 /nfs/dbraw/zinc/04/58/88/927045888.db2.gz GPBVDHKKUZJBRP-QGZVFWFLSA-N 0 3 408.424 4.068 20 0 HIADHN COc1ccc(SCCC(=O)NC[C@H](c2ccc(SC)cc2)N(C)C)cc1 ZINC000518151942 927048900 /nfs/dbraw/zinc/04/89/00/927048900.db2.gz VNCNJIILDJEHGZ-HXUWFJFHSA-N 0 3 404.601 4.318 20 0 HIADHN CC1(C)CN(C2(CNC(=O)N[C@H](c3cccs3)C3CC3)CCCCC2)CCO1 ZINC000518221134 927086896 /nfs/dbraw/zinc/08/68/96/927086896.db2.gz WSVKOAPJPMQOEN-IBGZPJMESA-N 0 3 405.608 4.312 20 0 HIADHN CN(C[C@H]1CCCN(Cc2ccc(-c3ccc(Cl)cc3)s2)C1)S(C)(=O)=O ZINC000518258835 927116412 /nfs/dbraw/zinc/11/64/12/927116412.db2.gz YLILPFGZZHGXHI-OAHLLOKOSA-N 0 3 413.008 4.172 20 0 HIADHN CCN(C(=O)c1nc(SC)ncc1Cl)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000518339966 927204261 /nfs/dbraw/zinc/20/42/61/927204261.db2.gz MKLQUTSWGBWXBW-HOCLYGCPSA-N 0 3 404.967 4.150 20 0 HIADHN Cc1ccc(Br)cc1NC(=O)CCCN1CCN(c2ccccc2)CC1 ZINC000518372547 927227026 /nfs/dbraw/zinc/22/70/26/927227026.db2.gz DALDYINTSDKYNB-UHFFFAOYSA-N 0 3 416.363 4.298 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)N(Cc1ccccc1)C[C@@H]1CCCO1 ZINC000518475403 927297059 /nfs/dbraw/zinc/29/70/59/927297059.db2.gz ZQFXDYQAHRTXRC-BJKOFHAPSA-N 0 3 407.558 4.214 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)N(Cc1ccccc1)C[C@H]1CCCO1 ZINC000518475404 927297365 /nfs/dbraw/zinc/29/73/65/927297365.db2.gz ZQFXDYQAHRTXRC-DNQXCXABSA-N 0 3 407.558 4.214 20 0 HIADHN COc1ccc([C@@H](NC(=O)NCCN(C)Cc2ccccc2)c2ccc(F)cc2)cc1 ZINC000518498275 927308890 /nfs/dbraw/zinc/30/88/90/927308890.db2.gz AFTSWULBSDKGSK-DEOSSOPVSA-N 0 3 421.516 4.355 20 0 HIADHN CC(C)[C@H](CNC(=O)Cc1coc(-c2cccs2)n1)N1CCc2ccccc2C1 ZINC000518501011 927311741 /nfs/dbraw/zinc/31/17/41/927311741.db2.gz MDVUIFJPWAOXLX-FQEVSTJZSA-N 0 3 409.555 4.145 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)NC[C@H]1CCCO[C@H]1c1ccccc1 ZINC000518521959 927324461 /nfs/dbraw/zinc/32/44/61/927324461.db2.gz UKJXHTYSJKTVLJ-OFNKIYASSA-N 0 3 413.537 4.067 20 0 HIADHN O[C@H](CN(Cc1ccc(-c2ccccc2C(F)(F)F)o1)C1CC1)Cn1cccn1 ZINC000518578201 927358940 /nfs/dbraw/zinc/35/89/40/927358940.db2.gz XAEMTBZJSBBCOI-MRXNPFEDSA-N 0 3 405.420 4.187 20 0 HIADHN COc1ccccc1[C@@H](NC(=O)[C@H]1CCCN(Cc2cccnc2)C1)c1ccccc1 ZINC000518657512 927409995 /nfs/dbraw/zinc/40/99/95/927409995.db2.gz MJYMLKMZPROLAW-DHLKQENFSA-N 0 3 415.537 4.208 20 0 HIADHN COc1cc(C(=O)NC[C@H]2CCCN2C)ccc1OCc1ccc(Cl)cc1Cl ZINC000518794074 927497261 /nfs/dbraw/zinc/49/72/61/927497261.db2.gz TYZCDHCBRLDAFH-QGZVFWFLSA-N 0 3 423.340 4.405 20 0 HIADHN O=C(c1cnc2n1CCCC2)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000518803077 927501783 /nfs/dbraw/zinc/50/17/83/927501783.db2.gz HAIVBCTWLCUIRI-UHFFFAOYSA-N 0 3 421.372 4.264 20 0 HIADHN CSc1ccc(Cl)cc1NC(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000518838700 927538621 /nfs/dbraw/zinc/53/86/21/927538621.db2.gz LHQMEZBTXYDUPX-HUUCEWRRSA-N 0 3 411.999 4.415 20 0 HIADHN CCN(C(=O)c1ccc2c(c1)SCC(=O)N2)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000518847527 927549049 /nfs/dbraw/zinc/54/90/49/927549049.db2.gz PVWLRCLRAWDRGZ-QFBILLFUSA-N 0 3 409.555 4.028 20 0 HIADHN CN(CCOc1ccccc1Cl)C(=O)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000518883030 927595316 /nfs/dbraw/zinc/59/53/16/927595316.db2.gz SZXRKSNURMLNGF-FQEVSTJZSA-N 0 3 401.938 4.197 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)NCC(C)(C)[NH+]3C[C@H](C)C[C@@H](C)C3)cc2)cc(=O)[n-]1 ZINC000518909583 927618990 /nfs/dbraw/zinc/61/89/90/927618990.db2.gz NHFKJVKTEOZWNN-HZPDHXFCSA-N 0 3 411.550 4.036 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N[C@H](CO)c1ccccc1)c1ccc(C(F)(F)F)cc1 ZINC000519020985 927697933 /nfs/dbraw/zinc/69/79/33/927697933.db2.gz FMEWKDZDDROKNX-UXHICEINSA-N 0 3 423.479 4.121 20 0 HIADHN COCCCN(C(=O)c1cc2cc(C)cc(Br)c2o1)C1CCN(C)CC1 ZINC000519042603 927719715 /nfs/dbraw/zinc/71/97/15/927719715.db2.gz MNSYULXCUDNZDY-UHFFFAOYSA-N 0 3 423.351 4.077 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)Cc1ccccc1C(F)(F)F ZINC000519098564 927768570 /nfs/dbraw/zinc/76/85/70/927768570.db2.gz QBUFQEHQCUDYJQ-UHFFFAOYSA-N 0 3 400.391 4.117 20 0 HIADHN Cc1cc(NC(=O)N(CCCc2ccccc2)CCN(C)C)n(Cc2ccccc2)n1 ZINC000519211376 927829358 /nfs/dbraw/zinc/82/93/58/927829358.db2.gz CQZQWUFVXPMTFH-UHFFFAOYSA-N 0 3 419.573 4.268 20 0 HIADHN CSc1ccc([C@H](CNC(=O)c2cc(C)n(Cc3ccncc3)c2C)N(C)C)cc1 ZINC000519219099 927833075 /nfs/dbraw/zinc/83/30/75/927833075.db2.gz HQQVWIQURIRAAW-QHCPKHFHSA-N 0 3 422.598 4.303 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2cc3c(cc2Cl)OCCCO3)N(C)C)cc1 ZINC000519262154 927854005 /nfs/dbraw/zinc/85/40/05/927854005.db2.gz WOEBFLQQTGDKQF-SFHVURJKSA-N 0 3 403.910 4.234 20 0 HIADHN CC1CCN([C@@H](CNC(=O)N2CCCC[C@@H]2c2ncc[nH]2)c2cccs2)CC1 ZINC000519293914 927866459 /nfs/dbraw/zinc/86/64/59/927866459.db2.gz XYDNPUWZRWCEEW-MSOLQXFVSA-N 0 3 401.580 4.181 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N(C)Cc2ccc(Br)cc2)N(C)C)cc1 ZINC000519295381 927867364 /nfs/dbraw/zinc/86/73/64/927867364.db2.gz WEYYAKRZRHMVFK-LJQANCHMSA-N 0 3 404.352 4.202 20 0 HIADHN COC1CCN(C(C)(C)CNC(=O)c2c(C)onc2-c2c(F)cccc2Cl)CC1 ZINC000519368320 927899531 /nfs/dbraw/zinc/89/95/31/927899531.db2.gz KWMQJZALPUCKFR-UHFFFAOYSA-N 0 3 423.916 4.062 20 0 HIADHN COc1ccc(CC[C@H](C)NC(=O)N(CCN(C)C)Cc2ccc(F)cc2F)cc1 ZINC000519449994 927957838 /nfs/dbraw/zinc/95/78/38/927957838.db2.gz SSIANNMGCCTPGC-KRWDZBQOSA-N 0 3 419.516 4.068 20 0 HIADHN CCCO[C@@H]1CCCN(C(=O)NC[C@H](c2cccc(OC)c2)N(CC)CC)CC1 ZINC000519452277 927959065 /nfs/dbraw/zinc/95/90/65/927959065.db2.gz WVDRJDAFYZUADP-IFMALSPDSA-N 0 3 405.583 4.069 20 0 HIADHN Cc1cc(N2CCCC2)ccc1NC(=O)N(CCN(C)C)Cc1ccc(F)c(F)c1 ZINC000519503341 927996968 /nfs/dbraw/zinc/99/69/68/927996968.db2.gz VWALSIFOOBVKOA-UHFFFAOYSA-N 0 3 416.516 4.469 20 0 HIADHN Cc1c(NC(=O)N[C@H]2CCN(Cc3ccccc3)[C@@H]2C)cnn1-c1ccccc1F ZINC000519551931 928011622 /nfs/dbraw/zinc/01/16/22/928011622.db2.gz CSJGWTAJPHQPAY-UZLBHIALSA-N 0 3 407.493 4.104 20 0 HIADHN CN(C(=O)CN1CCCC2(CCOCC2)C1)[C@@H](c1ccccc1)c1ccc(F)cc1 ZINC000519617767 928029293 /nfs/dbraw/zinc/02/92/93/928029293.db2.gz WCXLTRRVVZSQJP-DEOSSOPVSA-N 0 3 410.533 4.266 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N[C@@H](C)c1n[nH]c(C(C)C)n1)c1ccccc1Cl ZINC000519652295 928036879 /nfs/dbraw/zinc/03/68/79/928036879.db2.gz GKVWJIQPEWKPCH-YOEHRIQHSA-N 0 3 406.962 4.025 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1nc(-c2ccc(OC)cc2)ns1)c1ccco1 ZINC000519717453 928055695 /nfs/dbraw/zinc/05/56/95/928055695.db2.gz AURGPGYBFQLVBB-XJKSGUPXSA-N 0 3 415.519 4.058 20 0 HIADHN CC[C@@H](c1ccccc1)N(CC)C(=O)NCc1ccc(CN2CCN(C)CC2)cc1 ZINC000519896726 928130722 /nfs/dbraw/zinc/13/07/22/928130722.db2.gz CJQDACSLIFBAHS-DEOSSOPVSA-N 0 3 408.590 4.117 20 0 HIADHN CCC(=O)Nc1ccc(Cl)c(NC(=O)NC[C@H](c2ccc(C)cc2)N(C)C)c1 ZINC000520054849 928280879 /nfs/dbraw/zinc/28/08/79/928280879.db2.gz STLFVLDQRZVPQB-LJQANCHMSA-N 0 3 402.926 4.421 20 0 HIADHN CCOc1c(Cl)cc(CNC(=O)NC[C@H](c2ccc(C)cc2)N(C)C)cc1OC ZINC000520086272 928301749 /nfs/dbraw/zinc/30/17/49/928301749.db2.gz FTEXKZGKMSWHDA-LJQANCHMSA-N 0 3 419.953 4.158 20 0 HIADHN CC(=O)Nc1ccc(Cl)c(NC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)c1 ZINC000520111723 928316927 /nfs/dbraw/zinc/31/69/27/928316927.db2.gz OYRHEKZOUBJPTE-INIZCTEOSA-N 0 3 403.885 4.288 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)N[C@@H]1CCSc2ccc(F)cc21 ZINC000520128785 928327352 /nfs/dbraw/zinc/32/73/52/928327352.db2.gz NCUKUSYZTJAOLN-LJQANCHMSA-N 0 3 405.514 4.275 20 0 HIADHN CCN(CC)c1ccc(CNCC2=Cc3cc(Br)ccc3OC2)cn1 ZINC000520202507 928385840 /nfs/dbraw/zinc/38/58/40/928385840.db2.gz NAGJSXWSIHCQIG-UHFFFAOYSA-N 0 3 402.336 4.256 20 0 HIADHN COc1cccc(CNC[C@@H](c2ccccc2Cl)N2CCOCC2)c1OC(C)C ZINC000520206773 928387942 /nfs/dbraw/zinc/38/79/42/928387942.db2.gz KVRCWRILVACFAN-NRFANRHFSA-N 0 3 418.965 4.299 20 0 HIADHN CCCN(C(=O)C(=O)Nc1cc(CN(C)C)ccc1OC)[C@H](CC)c1ccccc1 ZINC000520235448 928404998 /nfs/dbraw/zinc/40/49/98/928404998.db2.gz RWJLDWLSALVGGC-OAQYLSRUSA-N 0 3 411.546 4.085 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)N(C)[C@@H](C)c3cccc(O)c3)CC2)c1 ZINC000520243142 928412382 /nfs/dbraw/zinc/41/23/82/928412382.db2.gz UCTFMKUZRYORBV-NRFANRHFSA-N 0 3 424.589 4.005 20 0 HIADHN C[C@@H]1CN(c2nnc(C3CCCC3)n2C[C@@H]2CCOC2)[C@@H](C)CN1Cc1ccccc1 ZINC000520301027 928463392 /nfs/dbraw/zinc/46/33/92/928463392.db2.gz BHCNTPRFVCEHRQ-URVUXULASA-N 0 3 423.605 4.071 20 0 HIADHN C[C@@H](CNC(=O)C1(c2cccc(Br)c2)CC1)N(C)Cc1ccccc1 ZINC000520376053 928529333 /nfs/dbraw/zinc/52/93/33/928529333.db2.gz XKLDKIHQNSWBFG-INIZCTEOSA-N 0 3 401.348 4.117 20 0 HIADHN COc1cccc(CN(C[C@H](O)COc2cccc3ccccc32)C[C@H]2CCCO2)c1 ZINC000520386902 928539227 /nfs/dbraw/zinc/53/92/27/928539227.db2.gz HTNDDFSBYDCWMR-LADGPHEKSA-N 0 3 421.537 4.269 20 0 HIADHN COc1cccc(CN(CCC(=O)N[C@@H]2CCCc3ccccc32)C[C@@H]2CCCO2)c1 ZINC000520392080 928544085 /nfs/dbraw/zinc/54/40/85/928544085.db2.gz JDSYTZKSWAVVDJ-UKILVPOCSA-N 0 3 422.569 4.260 20 0 HIADHN COc1cccc(CN(CCC(=O)N[C@H]2CCCc3ccccc32)C[C@H]2CCCO2)c1 ZINC000520392079 928544300 /nfs/dbraw/zinc/54/43/00/928544300.db2.gz JDSYTZKSWAVVDJ-NOZRDPDXSA-N 0 3 422.569 4.260 20 0 HIADHN CC(C)CC(=O)Nc1cccc(CNC(=O)N2CCCN(Cc3ccccc3)CC2)c1 ZINC000520425686 928559726 /nfs/dbraw/zinc/55/97/26/928559726.db2.gz XNNDYMKIJAKHBR-UHFFFAOYSA-N 0 3 422.573 4.089 20 0 HIADHN CCN(CC)[C@H](CNC(=O)C(=O)Nc1cc(Cl)ccc1SC)c1ccccc1 ZINC000520441560 928567367 /nfs/dbraw/zinc/56/73/67/928567367.db2.gz FOTPRVQIYCKODN-GOSISDBHSA-N 0 3 419.978 4.200 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cncnc1C(C)C)c1ccc(C(F)(F)F)cc1 ZINC000520446434 928570621 /nfs/dbraw/zinc/57/06/21/928570621.db2.gz AMJWLKBWELGKPW-GOSISDBHSA-N 0 3 408.468 4.432 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)C(=O)Nc1ccccc1C)c1ccc(C(F)(F)F)cc1 ZINC000520484433 928593789 /nfs/dbraw/zinc/59/37/89/928593789.db2.gz LQQUKMMGYQFNAZ-IBGZPJMESA-N 0 3 421.463 4.152 20 0 HIADHN COc1ccccc1COC[C@H](O)CN1CCC[C@H]1Cc1c(F)cccc1Cl ZINC000520523816 928616861 /nfs/dbraw/zinc/61/68/61/928616861.db2.gz JEUMWOPADVHHFU-ZWKOTPCHSA-N 0 3 407.913 4.072 20 0 HIADHN CC[C@@H](C)NC(=O)c1ccc(NC(=O)N(CCN(C)C)Cc2ccccc2)c(C)c1 ZINC000520598135 928662421 /nfs/dbraw/zinc/66/24/21/928662421.db2.gz UAJSKQDQJWHTAC-LJQANCHMSA-N 0 3 410.562 4.119 20 0 HIADHN O=C(N[C@H](c1ccc(F)cc1)[C@H]1CCCO1)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000520753943 928801952 /nfs/dbraw/zinc/80/19/52/928801952.db2.gz RCXSDJFNQBNBCX-DNVJHFABSA-N 0 3 411.521 4.010 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)[C@@H]3C[C@@H]3c3cccc4ccccc43)CC2)C[C@@H](C)O1 ZINC000520762370 928805916 /nfs/dbraw/zinc/80/59/16/928805916.db2.gz TVFWEEKAGBYOMO-PIYXRGFCSA-N 0 3 406.570 4.291 20 0 HIADHN CCOC(=O)c1cnn(C2CCN(C/C(C)=C\c3ccccc3COC)CC2)c1C ZINC000520855819 928846328 /nfs/dbraw/zinc/84/63/28/928846328.db2.gz KIKKHBISHZATIX-JXAWBTAJSA-N 0 3 411.546 4.255 20 0 HIADHN Clc1ccc([C@@H](CNCc2ccccc2Br)N2CCOCC2)cc1 ZINC000520965590 928892896 /nfs/dbraw/zinc/89/28/96/928892896.db2.gz KINFVNKPFNALOI-LJQANCHMSA-N 0 3 409.755 4.266 20 0 HIADHN CCCn1ccc2cc(NC(=O)N3CCC(CN4C[C@@H](C)O[C@H](C)C4)CC3)ccc21 ZINC000521034039 928949688 /nfs/dbraw/zinc/94/96/88/928949688.db2.gz UOXBGLRMZYLVSD-RTBURBONSA-N 0 3 412.578 4.404 20 0 HIADHN CC(C)N(C)c1cccc(NC(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)c1 ZINC000521035243 928949775 /nfs/dbraw/zinc/94/97/75/928949775.db2.gz SZAORSBDPBWEEX-UHFFFAOYSA-N 0 3 404.505 4.405 20 0 HIADHN C[C@@H](CNC(=O)c1cccc(-n2nccc2C(F)(F)F)c1)N(C)Cc1ccccc1 ZINC000521094651 928989971 /nfs/dbraw/zinc/98/99/71/928989971.db2.gz ARDSZFPSYWTDEV-INIZCTEOSA-N 0 3 416.447 4.141 20 0 HIADHN O=C(NCCCCN1CCN(Cc2ccccc2)CC1)c1ccc(-c2ccccc2)[nH]1 ZINC000521105541 928997804 /nfs/dbraw/zinc/99/78/04/928997804.db2.gz PVJKDJXWMOVAFS-UHFFFAOYSA-N 0 3 416.569 4.010 20 0 HIADHN C[C@H](CNC(=O)N(C)Cc1ccc(OC(F)(F)F)cc1)N(C)Cc1ccccc1 ZINC000521164355 929037363 /nfs/dbraw/zinc/03/73/63/929037363.db2.gz UJJJXCBKJOFULI-MRXNPFEDSA-N 0 3 409.452 4.247 20 0 HIADHN O=C(NCCCCCOC1CCCCC1)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000521175505 929044467 /nfs/dbraw/zinc/04/44/67/929044467.db2.gz BMXZTIFEHNMTCH-JOCHJYFZSA-N 0 3 401.595 4.470 20 0 HIADHN CN(Cc1ccccc1Br)C(=O)N[C@H](CN1CCCC1)c1ccccc1 ZINC000521183331 929049840 /nfs/dbraw/zinc/04/98/40/929049840.db2.gz RVYMFRDOSIDWGX-HXUWFJFHSA-N 0 3 416.363 4.428 20 0 HIADHN CO[C@@H](C)c1cccc(NC(=O)NCC2(N3CCOC(C)(C)C3)CCCCC2)c1 ZINC000521308115 929118860 /nfs/dbraw/zinc/11/88/60/929118860.db2.gz NVDRLMDTTZTLCN-SFHVURJKSA-N 0 3 403.567 4.329 20 0 HIADHN Cc1nc(C(F)(F)F)ccc1NC(=O)N(CCCc1ccccc1)CCN(C)C ZINC000521406458 929205594 /nfs/dbraw/zinc/20/55/94/929205594.db2.gz FRKUSMXJWIBGHB-UHFFFAOYSA-N 0 3 408.468 4.437 20 0 HIADHN O=C(N[C@H](c1ccc(F)cc1)[C@@H]1CCCO1)N[C@H](CN1CCCC1)c1ccccc1 ZINC000521456297 929229457 /nfs/dbraw/zinc/22/94/57/929229457.db2.gz ZCDYNJFJGUFDBQ-XPWALMASSA-N 0 3 411.521 4.182 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)NC[C@H](c2ccc(C)cc2)N(C)C)c(C)c1 ZINC000521466640 929233839 /nfs/dbraw/zinc/23/38/39/929233839.db2.gz GHKJBPINBXNQNP-PGRDOPGGSA-N 0 3 410.562 4.256 20 0 HIADHN C[C@H](NC(=O)CN1CCN(CC2CCCCC2)CC1)c1ccc(Cl)c(Cl)c1 ZINC000521483859 929245564 /nfs/dbraw/zinc/24/55/64/929245564.db2.gz MIQKAABEOHRTAH-INIZCTEOSA-N 0 3 412.405 4.369 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)NCc2ccnc(OCc3ccccc3)c2)N(C)C)cc1 ZINC000521509456 929261589 /nfs/dbraw/zinc/26/15/89/929261589.db2.gz FXYOHBFMHFCKJI-HSZRJFAPSA-N 0 3 418.541 4.071 20 0 HIADHN Cc1cc(N2CCCC2)ccc1NC(=O)N(C)C1CCN(CCc2ccccn2)CC1 ZINC000521561676 929297097 /nfs/dbraw/zinc/29/70/97/929297097.db2.gz OOCGNLWBYJUBBR-UHFFFAOYSA-N 0 3 421.589 4.161 20 0 HIADHN C[C@@H](CNC(=O)c1oc2ccccc2c1CSc1ncccn1)N1CCC[C@H](C)C1 ZINC000521706162 929378165 /nfs/dbraw/zinc/37/81/65/929378165.db2.gz ZLOVNRYJIYSJKW-IRXDYDNUSA-N 0 3 424.570 4.365 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)c2cn(C)nc2-c2ccccc2Cl)C1 ZINC000521751673 929413612 /nfs/dbraw/zinc/41/36/12/929413612.db2.gz BJCPBUXIZHHWGC-SJLPKXTDSA-N 0 3 408.933 4.306 20 0 HIADHN COc1ccccc1C[C@@H]1CCCN1C(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000521832017 929483921 /nfs/dbraw/zinc/48/39/21/929483921.db2.gz OEEMVSKTEPBSNA-PTUXOGIPSA-N 0 3 407.558 4.247 20 0 HIADHN COc1ccc(OC)c([C@H](C)NC(=O)[C@H](C)N[C@@H](C)c2ccc(OC(C)C)cc2)c1 ZINC000521862070 929512465 /nfs/dbraw/zinc/51/24/65/929512465.db2.gz KFCLWTYIKQPYOQ-BZSNNMDCSA-N 0 3 414.546 4.408 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3cccc(OC4CCCC4)c3)CC2)C[C@H](C)O1 ZINC000521880109 929527707 /nfs/dbraw/zinc/52/77/07/929527707.db2.gz FSJYRVXBVCVVOX-KDURUIRLSA-N 0 3 415.578 4.361 20 0 HIADHN Cc1cc(C(C)(C)N[C@H]2CCCN(CC(F)(F)F)C2=O)ccc1Br ZINC000522007601 929617563 /nfs/dbraw/zinc/61/75/63/929617563.db2.gz FROCQMKOKNJBIE-AWEZNQCLSA-N 0 3 407.274 4.136 20 0 HIADHN Cc1cccc(CN(Cc2ccccn2)C(=O)[C@@H]2CCCN(Cc3cccnc3)C2)c1 ZINC000522130932 929630322 /nfs/dbraw/zinc/63/03/22/929630322.db2.gz UMDZEGXZTCIQLH-XMMPIXPASA-N 0 3 414.553 4.226 20 0 HIADHN Cc1cc(C)n(-c2cccc(NC(=O)NC[C@@H]3CCCN3Cc3ccccc3)c2)n1 ZINC000524483275 929632349 /nfs/dbraw/zinc/63/23/49/929632349.db2.gz MIOPTXBJKOVLCW-QHCPKHFHSA-N 0 3 403.530 4.275 20 0 HIADHN CCN1CCN(C[C@@H](C)CNc2ncnc3scc(-c4ccc(C)cc4)c32)CC1 ZINC000524489961 929637652 /nfs/dbraw/zinc/63/76/52/929637652.db2.gz GIFXAASPGWOTDH-SFHVURJKSA-N 0 3 409.603 4.352 20 0 HIADHN C[S@@](=O)Cc1cc(NC(=O)[C@@H]2CCCN(Cc3ccccc3)C2)ccc1Cl ZINC000524545951 929677138 /nfs/dbraw/zinc/67/71/38/929677138.db2.gz PSLSXOYYFFRBPT-XGCWNURASA-N 0 3 404.963 4.069 20 0 HIADHN CCCN(CC(=O)Nc1cccc(NC(C)=O)c1)[C@@H]1C[C@@H](OCC)C12CCCC2 ZINC000524619707 929728009 /nfs/dbraw/zinc/72/80/09/929728009.db2.gz FVSXRFOIWWLGRA-NHCUHLMSSA-N 0 3 401.551 4.033 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1cccc(C(=O)NC(C)(C)C)c1 ZINC000524622539 929729822 /nfs/dbraw/zinc/72/98/22/929729822.db2.gz ANZGSDHQBFYSPW-LJQANCHMSA-N 0 3 422.573 4.343 20 0 HIADHN CCCN(C(=O)NC[C@H](c1cccs1)N1CCCC1)[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000524630444 929739713 /nfs/dbraw/zinc/73/97/13/929739713.db2.gz GJDAZPHPLBUBBS-HNBVOPMISA-N 0 3 405.608 4.120 20 0 HIADHN CC[C@@H](NC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C)c1ccc2c(c1)OCCO2 ZINC000524630014 929739983 /nfs/dbraw/zinc/73/99/83/929739983.db2.gz SZMPFVAUOBOHSB-SIKLNZKXSA-N 0 3 423.557 4.215 20 0 HIADHN CN(Cc1ccco1)Cc1ccccc1CNC(=O)[C@@H]1CCCN1Cc1ccccc1 ZINC000524649905 929762048 /nfs/dbraw/zinc/76/20/48/929762048.db2.gz YYWJNMIYPBMFGC-VWLOTQADSA-N 0 3 417.553 4.192 20 0 HIADHN CC[C@@H]1CCCCN1CCNC(=O)[C@@H](C)CC(=O)c1cccc(Br)c1 ZINC000524714018 929808285 /nfs/dbraw/zinc/80/82/85/929808285.db2.gz UGAOBRZEOLAHBQ-MAUKXSAKSA-N 0 3 409.368 4.039 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)c1cnn(Cc2ccccc2Cl)c1 ZINC000524864215 929863805 /nfs/dbraw/zinc/86/38/05/929863805.db2.gz FLWKVPSVUJGMDV-LJQANCHMSA-N 0 3 422.960 4.321 20 0 HIADHN COc1ccccc1C1(CNC(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)CC1 ZINC000524881534 929870344 /nfs/dbraw/zinc/87/03/44/929870344.db2.gz KURIMIGIGPNIAQ-FQEVSTJZSA-N 0 3 407.558 4.033 20 0 HIADHN CC(C)c1nc(CCNC(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)cs1 ZINC000524883318 929871081 /nfs/dbraw/zinc/87/10/81/929871081.db2.gz IYCFCJHPJDTLKG-GOSISDBHSA-N 0 3 400.592 4.115 20 0 HIADHN CCCCCC(=O)NC1CCN(CCc2nc(-c3ccc(Cl)cc3)no2)CC1 ZINC000524907343 929883732 /nfs/dbraw/zinc/88/37/32/929883732.db2.gz XTLXZILSSPMZRS-UHFFFAOYSA-N 0 3 404.942 4.093 20 0 HIADHN COc1ccc([C@@H](CNC(=O)NC2(c3cccc(Cl)c3)CC2)N2CCCC2)cc1 ZINC000524936458 929898762 /nfs/dbraw/zinc/89/87/62/929898762.db2.gz JRJXKCWCSJVVEB-OAQYLSRUSA-N 0 3 413.949 4.474 20 0 HIADHN CC1CCN([C@@H](CNC(=O)c2ccccc2Cn2cccn2)c2cccs2)CC1 ZINC000524967569 929932061 /nfs/dbraw/zinc/93/20/61/929932061.db2.gz HPOADVPLFWZQMG-NRFANRHFSA-N 0 3 408.571 4.196 20 0 HIADHN CN(C)Cc1cccc(C(=O)N2CCC[C@H]2C(=O)Nc2cc(Cl)cc(Cl)c2)c1 ZINC000524975323 929939715 /nfs/dbraw/zinc/93/97/15/929939715.db2.gz NECYLQBDXQMRKI-IBGZPJMESA-N 0 3 420.340 4.298 20 0 HIADHN COc1ccc2nc(C)cc(C(=O)N(CCN(C)C)Cc3ccc(F)cc3F)c2c1 ZINC000524983198 929947574 /nfs/dbraw/zinc/94/75/74/929947574.db2.gz PNJIJGHOZJVLEG-UHFFFAOYSA-N 0 3 413.468 4.034 20 0 HIADHN C[C@H](CNC(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1)Cc1cccs1 ZINC000525016458 929976605 /nfs/dbraw/zinc/97/66/05/929976605.db2.gz MHZSLHUXCPVHIZ-OXJNMPFZSA-N 0 3 410.505 4.498 20 0 HIADHN C[C@@H](CNCc1ccc(Br)cn1)Oc1cccc(Br)c1 ZINC000525195577 930082844 /nfs/dbraw/zinc/08/28/44/930082844.db2.gz VQTJURTXMVVPPI-NSHDSACASA-N 0 3 400.114 4.164 20 0 HIADHN O=C(Nc1ccccc1OCC(F)(F)F)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000525225653 930093047 /nfs/dbraw/zinc/09/30/47/930093047.db2.gz ITAFLKINMDCUFA-QGZVFWFLSA-N 0 3 407.436 4.414 20 0 HIADHN C[C@@H](N[C@@H](C)c1cccc2ccccc21)C(=O)NCCc1ccc2c(c1)OCCO2 ZINC000525248810 930105651 /nfs/dbraw/zinc/10/56/51/930105651.db2.gz AVQOJTNXUGGZKA-ZWKOTPCHSA-N 0 3 404.510 4.009 20 0 HIADHN CC(C)(C)C[C@@H](NC(=O)N1CCN(CC2CCOCC2)CC1)c1ccc(F)cc1 ZINC000525303937 930144101 /nfs/dbraw/zinc/14/41/01/930144101.db2.gz SMOHOQWMHQAKEG-OAQYLSRUSA-N 0 3 405.558 4.057 20 0 HIADHN CC(C)c1ccc([C@@H]2C[C@@H]2C(=O)Nc2ccccc2CN2CCC[C@H](C(N)=O)C2)cc1 ZINC000525314597 930152538 /nfs/dbraw/zinc/15/25/38/930152538.db2.gz QADOBDBGDOVCIV-VABKMULXSA-N 0 3 419.569 4.250 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(F)cc2)CC1)C1(c2cccc(Cl)c2)CC1 ZINC000525332863 930169708 /nfs/dbraw/zinc/16/97/08/930169708.db2.gz CGLSGZDPDINNCC-UHFFFAOYSA-N 0 3 416.924 4.170 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)c1cnn(-c2cccc(Cl)c2)c1 ZINC000525380629 930208283 /nfs/dbraw/zinc/20/82/83/930208283.db2.gz CJLAILBCAZSLGE-GOSISDBHSA-N 0 3 408.933 4.262 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)c1cccc(OCc2cccnc2)c1 ZINC000525382747 930208817 /nfs/dbraw/zinc/20/88/17/930208817.db2.gz BXLUMKAZHAKVAH-NRFANRHFSA-N 0 3 415.537 4.397 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1nnc(-c2ccsc2)s1 ZINC000525416199 930228581 /nfs/dbraw/zinc/22/85/81/930228581.db2.gz ICAASIMIJRRIEN-OAHLLOKOSA-N 0 3 413.572 4.395 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)N[C@@H]1C[C@H]1c1c(F)cccc1Cl ZINC000525445133 930243612 /nfs/dbraw/zinc/24/36/12/930243612.db2.gz APFWGONRIJCPQD-DNVCBOLYSA-N 0 3 407.892 4.248 20 0 HIADHN CC(C)OCc1ccccc1CNC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C ZINC000525452274 930249097 /nfs/dbraw/zinc/24/90/97/930249097.db2.gz VMKXVXXTNRBZEW-OAQYLSRUSA-N 0 3 409.574 4.418 20 0 HIADHN CN1CCN(CCCCNC(=O)Nc2cccc(CSC3CCCC3)c2)CC1 ZINC000525453063 930249827 /nfs/dbraw/zinc/24/98/27/930249827.db2.gz KHNMUBGEMKYKBC-UHFFFAOYSA-N 0 3 404.624 4.012 20 0 HIADHN CCOc1cc(CN[C@H](C)[C@@H]2CN(Cc3ccccc3)CCO2)cc(Cl)c1OC ZINC000525461662 930254688 /nfs/dbraw/zinc/25/46/88/930254688.db2.gz CUJYXSSSLVJYBI-VGSWGCGISA-N 0 3 418.965 4.126 20 0 HIADHN CC(C)(C)C[C@H](NC(=O)NC[C@]1(O)CCN(Cc2ccccc2)C1)c1ccccc1 ZINC000525507342 930291725 /nfs/dbraw/zinc/29/17/25/930291725.db2.gz FVUCWRUDADKCRF-WIOPSUGQSA-N 0 3 409.574 4.100 20 0 HIADHN CCN(CC)[C@H](CNC(=O)[C@H]1C[C@H]1c1cccc(F)c1F)c1cccc(OC)c1 ZINC000525578726 930341833 /nfs/dbraw/zinc/34/18/33/930341833.db2.gz DNAAGZVSSDVPMY-IRFCIJBXSA-N 0 3 402.485 4.276 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Cc2ccc(NC(=O)CC(C)(C)C)cc2)N(C)C)cc1 ZINC000525579841 930342655 /nfs/dbraw/zinc/34/26/55/930342655.db2.gz PAXSZXZKTCINFB-JOCHJYFZSA-N 0 3 409.574 4.331 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2csc3ccccc23)cc1)[C@@H]1CCCN(C)C1 ZINC000525580752 930343675 /nfs/dbraw/zinc/34/36/75/930343675.db2.gz MCPZDFAXGHKJHZ-GOSISDBHSA-N 0 3 407.539 4.320 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)c1cc(NC(=O)C(C)C)ccc1Cl ZINC000525581973 930344200 /nfs/dbraw/zinc/34/42/00/930344200.db2.gz ZFNLEQVXDYJXAQ-UHFFFAOYSA-N 0 3 403.910 4.257 20 0 HIADHN COc1ccc(Br)cc1C(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000525583320 930344990 /nfs/dbraw/zinc/34/49/90/930344990.db2.gz SQBKLYYGJUFDIN-WMLDXEAASA-N 0 3 403.320 4.023 20 0 HIADHN Cc1cc2[nH]c(C(=O)Nc3ccc(C(=O)N(C)[C@H]4CCCN(C)C4)cc3)cc2c(C)c1 ZINC000525614957 930363036 /nfs/dbraw/zinc/36/30/36/930363036.db2.gz UCHSGDFMILHVHJ-FQEVSTJZSA-N 0 3 418.541 4.203 20 0 HIADHN C[C@@H]1CN(Cc2cccc(NC(=O)c3oc4ccccc4c3CN(C)C)c2)C[C@@H](C)O1 ZINC000525759008 930433368 /nfs/dbraw/zinc/43/33/68/930433368.db2.gz MSXPESJOZIYTNW-QZTJIDSGSA-N 0 3 421.541 4.356 20 0 HIADHN C[C@@H]1CCN(C(=O)NCc2ncc(-c3ccccc3)o2)CCN1Cc1ccccc1 ZINC000525767296 930436909 /nfs/dbraw/zinc/43/69/09/930436909.db2.gz PUGBSWIYVKRVOZ-LJQANCHMSA-N 0 3 404.514 4.148 20 0 HIADHN COc1ccc([C@@H](CCn2cncn2)NCc2ccc(OC(F)(F)F)cc2)cc1 ZINC000525858188 930469662 /nfs/dbraw/zinc/46/96/62/930469662.db2.gz KFVDKBPMFGCVLG-LJQANCHMSA-N 0 3 406.408 4.107 20 0 HIADHN Cc1cc(NC(=O)CN[C@@H](C)c2cc3ccccc3s2)n(-c2nc(C)cc(C)n2)n1 ZINC000526944628 930554225 /nfs/dbraw/zinc/55/42/25/930554225.db2.gz HSHFEOQWKZAVCH-INIZCTEOSA-N 0 3 420.542 4.092 20 0 HIADHN CC(C)(Cc1ccc(C(F)(F)F)cc1)NC(=O)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000526951869 930556901 /nfs/dbraw/zinc/55/69/01/930556901.db2.gz XXTNWQXPAKNOEE-LJQANCHMSA-N 0 3 419.491 4.450 20 0 HIADHN COc1cc2c(cc1OC)CN(C(=O)CN[C@H](C)c1cc3ccccc3s1)CC2 ZINC000527194372 930609380 /nfs/dbraw/zinc/60/93/80/930609380.db2.gz JQNZWMPAMWCDDM-OAHLLOKOSA-N 0 3 410.539 4.154 20 0 HIADHN CC(C)[C@@H](CNC(=O)c1cc(O)ccc1C(F)(F)F)N1CCc2ccccc2C1 ZINC000527521299 930673622 /nfs/dbraw/zinc/67/36/22/930673622.db2.gz YBJNPCUUTVQFCS-HXUWFJFHSA-N 0 3 406.448 4.224 20 0 HIADHN CCCN(C(=O)c1c[nH]c(=O)c2ccccc12)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000530330905 930685595 /nfs/dbraw/zinc/68/55/95/930685595.db2.gz YBFXNKXDHRMYSW-HXUWFJFHSA-N 0 3 403.526 4.457 20 0 HIADHN Cc1ccc(NC(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)c(OC[C@@H]2CCCO2)c1 ZINC000530357007 930691677 /nfs/dbraw/zinc/69/16/77/930691677.db2.gz AQQUGBRVOSPPOT-WPYKKVEZSA-N 0 3 409.530 4.120 20 0 HIADHN CN(C)c1ccc(NC(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)c(C(F)(F)F)c1 ZINC000530357471 930694276 /nfs/dbraw/zinc/69/42/76/930694276.db2.gz ZMJWRSNAJVMRQS-MOPGFXCFSA-N 0 3 406.452 4.338 20 0 HIADHN COc1cc(Br)cc(C)c1NC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000530409446 930703595 /nfs/dbraw/zinc/70/35/95/930703595.db2.gz CZYMVVLOQBXPPX-VQIMIIECSA-N 0 3 418.335 4.333 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2cc(C3CC3)nn2-c2ccccc2)[C@@H]1c1ccccc1 ZINC000530461936 930716459 /nfs/dbraw/zinc/71/64/59/930716459.db2.gz CAKVYJMLCJEERU-OFNKIYASSA-N 0 3 401.514 4.317 20 0 HIADHN CCC(=O)Nc1ccc(Cl)c(NC(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)c1 ZINC000530462805 930719044 /nfs/dbraw/zinc/71/90/44/930719044.db2.gz XSZZVJHJPHPIND-PXNSSMCTSA-N 0 3 400.910 4.255 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2cnn(Cc3ccc(Cl)cc3)c2)[C@@H]1c1ccccc1 ZINC000530512913 930732748 /nfs/dbraw/zinc/73/27/48/930732748.db2.gz OVYFXQSNTGAXAD-SFTDATJTSA-N 0 3 409.921 4.152 20 0 HIADHN COC(=O)c1ccc(NC(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)c(F)c1 ZINC000530568709 930753170 /nfs/dbraw/zinc/75/31/70/930753170.db2.gz XOUOVBCRTDLTKF-SFHVURJKSA-N 0 3 419.522 4.269 20 0 HIADHN O=C(CC1(N2CCOCC2)CCCC1)NCc1ccccc1COCc1ccccc1 ZINC000530571949 930753903 /nfs/dbraw/zinc/75/39/03/930753903.db2.gz FQWHSEPVVCFSJC-UHFFFAOYSA-N 0 3 422.569 4.055 20 0 HIADHN CCCCOc1ccc([C@H](C)NC(=O)CC2(N3CCOCC3)CCCC2)cc1OC ZINC000530573234 930754939 /nfs/dbraw/zinc/75/49/39/930754939.db2.gz UWTACZRFNNILME-IBGZPJMESA-N 0 3 418.578 4.086 20 0 HIADHN O=C(CC1(N2CCOCC2)CCCC1)N[C@H](COCc1ccccc1)c1ccccc1 ZINC000530582528 930757975 /nfs/dbraw/zinc/75/79/75/930757975.db2.gz KWEDYDNREYZWRA-XMMPIXPASA-N 0 3 422.569 4.096 20 0 HIADHN Cc1[nH]c(=O)c(C(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)cc1-c1ccccc1 ZINC000530684512 930797352 /nfs/dbraw/zinc/79/73/52/930797352.db2.gz BJTZNISTIDUUGX-NQIIRXRSSA-N 0 3 401.510 4.328 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)c2ccc(Oc3ccccc3Cl)nc2)C[C@@H](C)O1 ZINC000530775496 930820453 /nfs/dbraw/zinc/82/04/53/930820453.db2.gz XHSAAHWVAYNERC-IAGOWNOFSA-N 0 3 417.937 4.147 20 0 HIADHN Cc1cnc(CNC(=O)N(CCN(C)Cc2ccccc2)Cc2ccccc2)s1 ZINC000530917409 930857867 /nfs/dbraw/zinc/85/78/67/930857867.db2.gz CQNIJNAVSNCTRT-UHFFFAOYSA-N 0 3 408.571 4.295 20 0 HIADHN CSCc1cccc(NC(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)c1 ZINC000530945169 930863625 /nfs/dbraw/zinc/86/36/25/930863625.db2.gz XCAGKZPJRKEBAI-HDICACEKSA-N 0 3 405.608 4.293 20 0 HIADHN COc1cc(Cl)c(C)cc1NC(=O)CCNCc1cnc(C)n1-c1ccccc1 ZINC000530974654 930873405 /nfs/dbraw/zinc/87/34/05/930873405.db2.gz WTWLECMYQPSKIQ-UHFFFAOYSA-N 0 3 412.921 4.270 20 0 HIADHN C[C@H](NC(=O)NC[C@@H](c1ccccc1)N1CCCC1)c1cccc(N2CCCC2)c1 ZINC000531027881 930889948 /nfs/dbraw/zinc/88/99/48/930889948.db2.gz FBIGDZSCRDWWFN-RDPSFJRHSA-N 0 3 406.574 4.484 20 0 HIADHN CCN1CCN(CCC(=O)N[C@H](c2ccccc2)c2cccc3ccccc32)CC1 ZINC000531057404 930899854 /nfs/dbraw/zinc/89/98/54/930899854.db2.gz URSNIYUSPUMFCF-AREMUKBSSA-N 0 3 401.554 4.073 20 0 HIADHN COc1cc(Cl)c(C)cc1NC(=O)CCNCc1cnc(-c2ccccn2)s1 ZINC000531240056 930977599 /nfs/dbraw/zinc/97/75/99/930977599.db2.gz DTMQFYYPVUCDAO-UHFFFAOYSA-N 0 3 416.934 4.294 20 0 HIADHN COc1ccc(OCc2nc(CNC3CCC(c4nc(C)no4)CC3)cs2)cc1 ZINC000531240338 930978295 /nfs/dbraw/zinc/97/82/95/930978295.db2.gz CRZFVDBDGIXXRZ-UHFFFAOYSA-N 0 3 414.531 4.238 20 0 HIADHN O=C(NCCNCc1cnc(-c2ccsc2)s1)c1ccc(Br)cc1 ZINC000531240254 930978537 /nfs/dbraw/zinc/97/85/37/930978537.db2.gz RCMQXEGAKQUAQF-UHFFFAOYSA-N 0 3 422.373 4.154 20 0 HIADHN Cc1ccc(Br)cc1NC(=O)CCNCc1c[nH]c(-c2ccccc2)n1 ZINC000531250652 930982292 /nfs/dbraw/zinc/98/22/92/930982292.db2.gz FXOZIMXNRPECHZ-UHFFFAOYSA-N 0 3 413.319 4.266 20 0 HIADHN Cc1ccc(Br)cc1NC(=O)CCNCc1cnc(-c2ccccc2)[nH]1 ZINC000531250652 930982298 /nfs/dbraw/zinc/98/22/98/930982298.db2.gz FXOZIMXNRPECHZ-UHFFFAOYSA-N 0 3 413.319 4.266 20 0 HIADHN CCN(CC)[C@H](C(=O)NC[C@H](C)Cn1ccnc1C)c1cccc(C(F)(F)F)c1 ZINC000531285126 931001360 /nfs/dbraw/zinc/00/13/60/931001360.db2.gz DAWDGTZFCYYMCJ-KXBFYZLASA-N 0 3 410.484 4.046 20 0 HIADHN CC[C@@H](C(=O)Nc1cc(Cl)c(NC(=O)c2cnccn2)c(Cl)c1)N(CC)CC ZINC000531300092 931007436 /nfs/dbraw/zinc/00/74/36/931007436.db2.gz XBODMXPJJFMMOT-INIZCTEOSA-N 0 3 424.332 4.095 20 0 HIADHN COc1ccc(C(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)c(Br)c1 ZINC000531305470 931009743 /nfs/dbraw/zinc/00/97/43/931009743.db2.gz GAQJCMBTELDTHV-KRWDZBQOSA-N 0 3 417.347 4.194 20 0 HIADHN COc1ccc2oc(C(=O)N3CCC(CCN4C[C@H](C)O[C@@H](C)C4)CC3)c(C)c2c1 ZINC000531417979 931049339 /nfs/dbraw/zinc/04/93/39/931049339.db2.gz VTLXLPBZWAXPHM-IRXDYDNUSA-N 0 3 414.546 4.101 20 0 HIADHN Cc1sc2nc(CN3CCN(CCCc4ccccc4C)CC3)[nH]c(=O)c2c1C ZINC000531479493 931071517 /nfs/dbraw/zinc/07/15/17/931071517.db2.gz NGTQUBHAVZVXMQ-UHFFFAOYSA-N 0 3 410.587 4.073 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)N[C@H](Cc1ccccc1)c1ccccc1F ZINC000531526263 931092971 /nfs/dbraw/zinc/09/29/71/931092971.db2.gz SEUBSYZFLNMQJX-HSZRJFAPSA-N 0 3 409.505 4.476 20 0 HIADHN CCOc1ccc([C@H](C)NC(=O)CCCNCc2cn3cc(Cl)ccc3n2)cc1 ZINC000531530203 931094194 /nfs/dbraw/zinc/09/41/94/931094194.db2.gz YDVIPCTVFJDAPR-INIZCTEOSA-N 0 3 414.937 4.134 20 0 HIADHN Cc1nn(C)c(OCC(F)(F)F)c1CNCCc1nc(-c2ccccc2)c(C)s1 ZINC000531582459 931109317 /nfs/dbraw/zinc/10/93/17/931109317.db2.gz WYSUPTSVJZBKSV-UHFFFAOYSA-N 0 3 424.492 4.434 20 0 HIADHN O=C(Nc1cccc(CNCCNc2cnccn2)c1)c1ccc(Cl)cc1Cl ZINC000531609142 931122629 /nfs/dbraw/zinc/12/26/29/931122629.db2.gz JWLFJJINMPOAIN-UHFFFAOYSA-N 0 3 416.312 4.237 20 0 HIADHN C[C@@H](CC(=O)Nc1cccc(C(F)(F)F)c1)NCc1cccc(N2CCCC2=O)c1 ZINC000531682275 931150600 /nfs/dbraw/zinc/15/06/00/931150600.db2.gz SZDYCWMQUHAEIX-HNNXBMFYSA-N 0 3 419.447 4.339 20 0 HIADHN Cc1ccc(S(=O)(=O)N2CCC(N[C@H](c3ccco3)c3ccccc3)CC2)cc1 ZINC000531689523 931153917 /nfs/dbraw/zinc/15/39/17/931153917.db2.gz OHCMHPQVYBAENH-QHCPKHFHSA-N 0 3 410.539 4.120 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(S(C)(=O)=O)cc1)c1ccc(OCC(F)(F)F)cc1 ZINC000531695054 931158611 /nfs/dbraw/zinc/15/86/11/931158611.db2.gz VJRXIMOCDOMSEI-KGLIPLIRSA-N 0 3 401.450 4.443 20 0 HIADHN O=C(c1ccc(CN[C@@H]2CCSc3c(Cl)cccc32)cc1)N1CCOCC1 ZINC000531697775 931161222 /nfs/dbraw/zinc/16/12/22/931161222.db2.gz CMSMFIAELUUAJL-LJQANCHMSA-N 0 3 402.947 4.139 20 0 HIADHN COc1cccc(C(=O)NCCN[C@@H](C)c2csc(-c3csc(C)n3)c2)c1 ZINC000531696781 931161401 /nfs/dbraw/zinc/16/14/01/931161401.db2.gz CFOUKAXSBXZKNJ-ZDUSSCGKSA-N 0 3 401.557 4.269 20 0 HIADHN O[C@@H](CNCc1cnc(-c2ccccc2)s1)COc1ccccc1Br ZINC000531698385 931162856 /nfs/dbraw/zinc/16/28/56/931162856.db2.gz XZVNHANIRSPOKA-HNNXBMFYSA-N 0 3 419.344 4.102 20 0 HIADHN COc1cccc(C[C@H](NCc2cccc(CS(C)(=O)=O)c2)c2ccccc2)c1 ZINC000531709463 931168821 /nfs/dbraw/zinc/16/88/21/931168821.db2.gz OCVAIZUDNMCSQW-DEOSSOPVSA-N 0 3 409.551 4.313 20 0 HIADHN CC[C@@H](N[C@H](C)c1cccc(S(=O)(=O)N(C)C)c1)c1ccc(OC(F)F)cc1 ZINC000531710176 931169280 /nfs/dbraw/zinc/16/92/80/931169280.db2.gz NHZBDXMORUTZCF-AUUYWEPGSA-N 0 3 412.502 4.340 20 0 HIADHN COc1ccc([C@@H](C)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2=O)cc1OC ZINC000531724083 931174128 /nfs/dbraw/zinc/17/41/28/931174128.db2.gz REVCEKZJTWRBHV-RDTXWAMCSA-N 0 3 420.456 4.151 20 0 HIADHN CCOc1cc(CNCc2ccc(C)cc2SC)ccc1O[C@H](C)C(=O)N(C)C ZINC000531789424 931197684 /nfs/dbraw/zinc/19/76/84/931197684.db2.gz AXYFACJHNQRBBF-QGZVFWFLSA-N 0 3 416.587 4.261 20 0 HIADHN CCC(CC)(C(=O)N1CC[C@H](N2CCN(C(C)C)CC2)C1)c1ccc(Cl)cc1 ZINC000531836894 931215206 /nfs/dbraw/zinc/21/52/06/931215206.db2.gz VGSGXUGKJFJJGJ-NRFANRHFSA-N 0 3 406.014 4.025 20 0 HIADHN CC(C)N1CCN([C@H]2CCN(C(=O)N[C@H](CC(C)(C)C)c3ccc(F)cc3)C2)CC1 ZINC000531839626 931216376 /nfs/dbraw/zinc/21/63/76/931216376.db2.gz UKDLBNOOIFBBCC-FCHUYYIVSA-N 0 3 418.601 4.113 20 0 HIADHN COc1cc(CNCCOc2ncc(Cl)cc2Cl)c(SC)cc1OC ZINC000531884529 931234224 /nfs/dbraw/zinc/23/42/24/931234224.db2.gz FQINIBSGPAAMGM-UHFFFAOYSA-N 0 3 403.331 4.296 20 0 HIADHN Cc1nc([C@H](C)N2CC[C@H](N3CCN(C(C)C)CC3)C2)oc1-c1ccc(Cl)cc1 ZINC000531912601 931244259 /nfs/dbraw/zinc/24/42/59/931244259.db2.gz KSRHYWAFFZAOLE-RXVVDRJESA-N 0 3 416.997 4.465 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)[C@@H](C)Cc1ccc(F)c(Br)c1 ZINC000531941734 931255063 /nfs/dbraw/zinc/25/50/63/931255063.db2.gz RZXAIBGVCAROBY-ZDUSSCGKSA-N 0 3 423.326 4.476 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)CCCc1ccccc1Br ZINC000531941781 931255109 /nfs/dbraw/zinc/25/51/09/931255109.db2.gz WFKDBUYCBIIGDM-UHFFFAOYSA-N 0 3 405.336 4.481 20 0 HIADHN COc1ccc([C@H](Cc2ccc(F)cc2)NCc2ccc(N3CCOCC3)nc2)cc1 ZINC000531944700 931257022 /nfs/dbraw/zinc/25/70/22/931257022.db2.gz YCSNUXZFCZMYDS-DEOSSOPVSA-N 0 3 421.516 4.140 20 0 HIADHN COc1ccccc1-c1ccc([C@H](C)NCc2ccc(N3CCOCC3)nc2)cc1 ZINC000531945412 931257674 /nfs/dbraw/zinc/25/76/74/931257674.db2.gz SSYCANOLZWAFII-IBGZPJMESA-N 0 3 403.526 4.445 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)N[C@H](CN2CCOCC2)c2ccc(C)cc2)cc1 ZINC000531945920 931258014 /nfs/dbraw/zinc/25/80/14/931258014.db2.gz YQTFSEDZZVYEAG-CJFMBICVSA-N 0 3 404.558 4.213 20 0 HIADHN CC(C)C[C@@H](N[C@H](C)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccccc1 ZINC000531947482 931259835 /nfs/dbraw/zinc/25/98/35/931259835.db2.gz OXPNCHXMNMXRMT-AUSIDOKSSA-N 0 3 416.587 4.146 20 0 HIADHN Cc1nc(-c2ccccc2)sc1[C@@H](C)NCc1ccc(N2CCN(C)CC2)nc1 ZINC000531989581 931278498 /nfs/dbraw/zinc/27/84/98/931278498.db2.gz NNJFBEHUOIVIGI-QGZVFWFLSA-N 0 3 407.587 4.116 20 0 HIADHN CC(C)N1CCN([C@@H]2CCN(C(=O)Nc3ccc(Oc4ccccc4)cc3)C2)CC1 ZINC000532094339 931310001 /nfs/dbraw/zinc/31/00/01/931310001.db2.gz DMDCQCIYMUSRCQ-OAQYLSRUSA-N 0 3 408.546 4.111 20 0 HIADHN Cc1ccc(Oc2ccccc2NC(=O)N2CC[C@@H](N3CCN(C(C)C)CC3)C2)cc1 ZINC000532096525 931310631 /nfs/dbraw/zinc/31/06/31/931310631.db2.gz FNGRUIBYHQYVRY-OAQYLSRUSA-N 0 3 422.573 4.420 20 0 HIADHN O=C([C@H]1CCCN(Cc2cccnc2)C1)N1CCCC[C@@H]1c1nc2ccccc2o1 ZINC000532153917 931329378 /nfs/dbraw/zinc/32/93/78/931329378.db2.gz WZLZGQZGMMNMGS-PZJWPPBQSA-N 0 3 404.514 4.189 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@H](C)N[C@@H]2CCc3c2cccc3OC)cc1 ZINC000532187116 931341171 /nfs/dbraw/zinc/34/11/71/931341171.db2.gz KFGMMITTWHLXKB-HRAATJIYSA-N 0 3 402.560 4.064 20 0 HIADHN C[C@@H](NC[C@H](c1c(F)cccc1Cl)N1CCCC1)c1ccc(S(C)(=O)=O)cc1 ZINC000532196081 931344898 /nfs/dbraw/zinc/34/48/98/931344898.db2.gz YGQSUITTWXPSNW-FOIQADDNSA-N 0 3 424.969 4.370 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(OC(F)F)cc1)c1cccc(N2CCCS2(=O)=O)c1 ZINC000532197683 931345285 /nfs/dbraw/zinc/34/52/85/931345285.db2.gz XFTNNIPPIBZGAE-LSDHHAIUSA-N 0 3 410.486 4.240 20 0 HIADHN Cc1nn(C)cc1[C@@H](C)N[C@H](C)CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 ZINC000532214804 931356459 /nfs/dbraw/zinc/35/64/59/931356459.db2.gz FRZKEVYSSDQGSH-GHMZBOCLSA-N 0 3 402.848 4.469 20 0 HIADHN C[C@@H](N[C@@H](CN1CCN(C)CC1)c1ccccc1)c1ccc(Br)c(F)c1 ZINC000532270444 931379058 /nfs/dbraw/zinc/37/90/58/931379058.db2.gz FGXCOATVGQMWKQ-IERDGZPVSA-N 0 3 420.370 4.228 20 0 HIADHN CC(C)N1CCN([C@@H]2CCN(C(=O)CCCc3cc(Cl)sc3Cl)C2)CC1 ZINC000532347966 931403307 /nfs/dbraw/zinc/40/33/07/931403307.db2.gz VPSAUZGNVZRGEQ-MRXNPFEDSA-N 0 3 418.434 4.005 20 0 HIADHN C[C@H](O)C[C@@H](CNCc1nc(-c2ccc(Br)cc2)c[nH]1)c1ccccc1 ZINC000532346429 931403802 /nfs/dbraw/zinc/40/38/02/931403802.db2.gz JQRCISPAMOIAIV-YJBOKZPZSA-N 0 3 414.347 4.484 20 0 HIADHN Cc1cc(C(=O)N2CC[C@H](N3CCN(C(C)C)CC3)C2)sc1-c1ccc(F)cc1 ZINC000532348461 931404337 /nfs/dbraw/zinc/40/43/37/931404337.db2.gz XVLNLZRBHTZGKR-FQEVSTJZSA-N 0 3 415.578 4.103 20 0 HIADHN CN(C(=O)Nc1cccc(CC(=O)OC(C)(C)C)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000532391190 931419860 /nfs/dbraw/zinc/41/98/60/931419860.db2.gz MWJWEYIIKPIANQ-QFIPXVFZSA-N 0 3 423.557 4.309 20 0 HIADHN FC(F)(F)c1cnc(N2CC[C@H](NCc3cnc(C4CC4)s3)C2)c(Cl)c1 ZINC000532393996 931421983 /nfs/dbraw/zinc/42/19/83/931421983.db2.gz KIJOXDOHUNKCQE-LBPRGKRZSA-N 0 3 402.873 4.456 20 0 HIADHN COc1cc(CN[C@@H](C)c2cccc(NS(C)(=O)=O)c2)ccc1OCCC(C)C ZINC000532459122 931444448 /nfs/dbraw/zinc/44/44/48/931444448.db2.gz GPIHNVHLEUZEBU-KRWDZBQOSA-N 0 3 420.575 4.342 20 0 HIADHN CC[C@H](N[C@H](C)c1ccc(S(=O)(=O)NC)cc1)c1ccc(Br)cc1 ZINC000532467993 931448424 /nfs/dbraw/zinc/44/84/24/931448424.db2.gz JRIGQEUYHHJVOU-ACJLOTCBSA-N 0 3 411.365 4.159 20 0 HIADHN CCSc1ccccc1[C@H](C)NCc1ccc(CS(=O)(=O)NC(C)C)cc1 ZINC000532467758 931448669 /nfs/dbraw/zinc/44/86/69/931448669.db2.gz ICXQORUZZAKLHY-KRWDZBQOSA-N 0 3 406.617 4.477 20 0 HIADHN CN(CC(=O)N[C@H](c1ccccc1)c1ccc2[nH]c(C(F)(F)F)nc2c1)CC1CC1 ZINC000532474100 931452390 /nfs/dbraw/zinc/45/23/90/931452390.db2.gz GMUPRPHCYWKIIO-HXUWFJFHSA-N 0 3 416.447 4.129 20 0 HIADHN CN(CC(=O)N[C@H](c1ccccc1)c1ccc2nc(C(F)(F)F)[nH]c2c1)CC1CC1 ZINC000532474100 931452396 /nfs/dbraw/zinc/45/23/96/931452396.db2.gz GMUPRPHCYWKIIO-HXUWFJFHSA-N 0 3 416.447 4.129 20 0 HIADHN Cc1cccc([C@@H]2CCCN2C(=O)Nc2ccc(CCN3CCSCC3)cc2)n1 ZINC000532502425 931464625 /nfs/dbraw/zinc/46/46/25/931464625.db2.gz HIHBIHGDQXZNQV-QFIPXVFZSA-N 0 3 410.587 4.350 20 0 HIADHN COc1ccc(S(=O)(=O)[N-]c2cccc(C[NH2+][C@@H]3CCc4ccccc43)c2)cc1 ZINC000532501206 931464854 /nfs/dbraw/zinc/46/48/54/931464854.db2.gz FMSWLSYCKZYTPV-HSZRJFAPSA-N 0 3 408.523 4.273 20 0 HIADHN C[C@H](NC[C@@H](CO)Cc1ccco1)c1ccc(Br)cc1Br ZINC000532647947 931566809 /nfs/dbraw/zinc/56/68/09/931566809.db2.gz BSWVJRHRCICVIG-RYUDHWBXSA-N 0 3 417.141 4.306 20 0 HIADHN O=C(Nc1ccc(O)cc1)C1CCN(Cc2ccccc2Oc2cccnc2)CC1 ZINC000532670199 931578189 /nfs/dbraw/zinc/57/81/89/931578189.db2.gz XGKCXUBPWDZSPU-UHFFFAOYSA-N 0 3 403.482 4.430 20 0 HIADHN CCc1ccccc1NC(=O)CN(C)C(=O)[C@H](C)N[C@@H](c1ccccc1)C1CCC1 ZINC000532686191 931584528 /nfs/dbraw/zinc/58/45/28/931584528.db2.gz DCKGFMQOOBQKDK-UUOWRZLLSA-N 0 3 407.558 4.165 20 0 HIADHN CC(C)n1ncc2cc(CN3CCC(c4nc(-c5ccccc5)n[nH]4)CC3)cnc21 ZINC000532691977 931588117 /nfs/dbraw/zinc/58/81/17/931588117.db2.gz LLVCBPHLZLUGQG-UHFFFAOYSA-N 0 3 401.518 4.177 20 0 HIADHN CC(C)[C@@H](NC(=O)CNC1(c2ccc(Cl)cc2)CCOCC1)c1ccccc1 ZINC000532714231 931603834 /nfs/dbraw/zinc/60/38/34/931603834.db2.gz HUAWJTHUWUIOET-JOCHJYFZSA-N 0 3 400.950 4.449 20 0 HIADHN O=C(CNC1(c2ccc(Cl)cc2)CCOCC1)N1CCSc2ccccc21 ZINC000532714378 931604386 /nfs/dbraw/zinc/60/43/86/931604386.db2.gz JJKKXNHGNOVIKX-UHFFFAOYSA-N 0 3 402.947 4.074 20 0 HIADHN Clc1ccc(CNc2ccc3nc(CCN4CCOCC4)[nH]c3c2)c2ncccc12 ZINC000532729556 931614453 /nfs/dbraw/zinc/61/44/53/931614453.db2.gz BXMJRTBDMKZERT-UHFFFAOYSA-N 0 3 421.932 4.251 20 0 HIADHN CC(C)CCNC(=O)C1CCN(C(=O)CN[C@H](c2ccc(Cl)cc2)C(C)C)CC1 ZINC000532770313 931627719 /nfs/dbraw/zinc/62/77/19/931627719.db2.gz CVOCEJUHAABROW-QFIPXVFZSA-N 0 3 422.013 4.028 20 0 HIADHN CCCN1CCN(c2ccccc2CNc2cccc(-c3nncn3CC)c2)CC1 ZINC000532886992 931679157 /nfs/dbraw/zinc/67/91/57/931679157.db2.gz VXZVQJZEUYGJRL-UHFFFAOYSA-N 0 3 404.562 4.109 20 0 HIADHN C[C@@H]1C[C@@H](c2ccccc2)CN1CC(=O)Nc1cccc(CN2CCSCC2)c1 ZINC000532977950 931724033 /nfs/dbraw/zinc/72/40/33/931724033.db2.gz XXSDKFSZELPPDC-DENIHFKCSA-N 0 3 409.599 4.052 20 0 HIADHN COc1cc([C@H](C)N[C@@H]2CCCN(CC(F)(F)F)C2=O)ccc1OCCC(C)C ZINC000532990077 931728682 /nfs/dbraw/zinc/72/86/82/931728682.db2.gz RBQVAZCAGRDBIW-DOTOQJQBSA-N 0 3 416.484 4.324 20 0 HIADHN CCCOc1cccc(CNC(=O)CNC2(c3ccc(Cl)cc3)CCOCC2)c1 ZINC000533064135 931760943 /nfs/dbraw/zinc/76/09/43/931760943.db2.gz YOBFCRODIZPKDO-UHFFFAOYSA-N 0 3 416.949 4.041 20 0 HIADHN COC(=O)CC1(NCc2ccnc(-c3ccc(Br)cc3)n2)CCCCC1 ZINC000533086041 931767525 /nfs/dbraw/zinc/76/75/25/931767525.db2.gz FVYLHMVQBWSGRD-UHFFFAOYSA-N 0 3 418.335 4.262 20 0 HIADHN CN1CCN(c2cc(CNCc3ccc(Sc4ccccc4)cc3)ccn2)CC1 ZINC000533149774 931787354 /nfs/dbraw/zinc/78/73/54/931787354.db2.gz OYSMAPOXDDOVPG-UHFFFAOYSA-N 0 3 404.583 4.274 20 0 HIADHN CN(C)[C@@H](CNC(=O)N1CCC(Oc2ccccc2Cl)CC1)c1ccccc1 ZINC000533163641 931795782 /nfs/dbraw/zinc/79/57/82/931795782.db2.gz UDIOTINXSYQCNO-FQEVSTJZSA-N 0 3 401.938 4.196 20 0 HIADHN c1cc(CNc2ccc3nc(CCN4CCOCC4)[nH]c3c2)cc(-c2ccncc2)c1 ZINC000533211060 931810600 /nfs/dbraw/zinc/81/06/00/931810600.db2.gz XBQFOGWYNGIJKJ-UHFFFAOYSA-N 0 3 413.525 4.112 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)CN2CCC[C@H]2Cc2ccccc2)cc1OC ZINC000533221946 931813688 /nfs/dbraw/zinc/81/36/88/931813688.db2.gz ZTCNMNWRUHRYSQ-VXKWHMMOSA-N 0 3 408.542 4.074 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)CO[C@@H]1CCC[C@H](C)C1 ZINC000533231111 931814915 /nfs/dbraw/zinc/81/49/15/931814915.db2.gz DFKXDNPKXAFCDF-VLCRHTCISA-N 0 3 410.562 4.172 20 0 HIADHN Cc1occc1C(=O)NC1CCN(Cc2c(-c3ccccc3)nc3ccccn32)CC1 ZINC000533262653 931822282 /nfs/dbraw/zinc/82/22/82/931822282.db2.gz ICRLFYMKOGJSHW-UHFFFAOYSA-N 0 3 414.509 4.297 20 0 HIADHN O=C(CCN1CCC[C@H](OCC(F)(F)F)C1)NC(c1ccccc1)c1ccccc1 ZINC000533290394 931829741 /nfs/dbraw/zinc/82/97/41/931829741.db2.gz HBIUWWMITYTBLJ-FQEVSTJZSA-N 0 3 420.475 4.326 20 0 HIADHN CCCN(CC(=O)Nc1ccc(C)cc1Br)[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC000533293761 931831490 /nfs/dbraw/zinc/83/14/90/931831490.db2.gz SJAULWWSHKDOIS-KYNGSXCRSA-N 0 3 409.368 4.222 20 0 HIADHN CCCN(CC(=O)Nc1ccc(C)cc1Br)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000533293763 931831791 /nfs/dbraw/zinc/83/17/91/931831791.db2.gz SJAULWWSHKDOIS-ZMYBRWDISA-N 0 3 409.368 4.222 20 0 HIADHN O[C@@H](CNCc1cc(F)cc(C(F)(F)F)c1)COc1ccccc1Br ZINC000533308841 931834928 /nfs/dbraw/zinc/83/49/28/931834928.db2.gz BAKLRLBHJLJPOW-AWEZNQCLSA-N 0 3 422.216 4.137 20 0 HIADHN O=C(NCc1ccc(F)cc1)C1CCN(Cc2cccc(OCC(F)(F)F)c2)CC1 ZINC000533351483 931846116 /nfs/dbraw/zinc/84/61/16/931846116.db2.gz OCCOTWJHPLQHCK-UHFFFAOYSA-N 0 3 424.438 4.295 20 0 HIADHN C/C=C\c1ccc(OC[C@H](O)CN(C)[C@@H]2CCCc3nc(C)sc32)c(OC)c1 ZINC000533386191 931854705 /nfs/dbraw/zinc/85/47/05/931854705.db2.gz FMSFMFZJTPIRAW-OLVPKOTESA-N 0 3 402.560 4.242 20 0 HIADHN CCN(CC(=O)Nc1c(C)cccc1C)C1CCN(c2cc(C)nc(C(C)C)n2)CC1 ZINC000533395819 931857462 /nfs/dbraw/zinc/85/74/62/931857462.db2.gz BOJQBRINPOIENX-UHFFFAOYSA-N 0 3 423.605 4.455 20 0 HIADHN Cc1cc(N2CCCC2)ccc1NC(=O)CN1CCCN(Cc2ccccc2)C[C@H]1C ZINC000533429648 931865373 /nfs/dbraw/zinc/86/53/73/931865373.db2.gz GEVHPORZIWJDEH-JOCHJYFZSA-N 0 3 420.601 4.130 20 0 HIADHN CCCN(CC(=O)Nc1ccc2[nH]c(C(F)(F)F)nc2c1)[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC000533430090 931866419 /nfs/dbraw/zinc/86/64/19/931866419.db2.gz WHRPKAFTJPAXRV-VHSSKADRSA-N 0 3 424.467 4.046 20 0 HIADHN COc1ccc(C(=O)C2CCN(C[C@H](O)Cc3ccc(C(F)(F)F)cc3)CC2)cc1 ZINC000533464008 931876095 /nfs/dbraw/zinc/87/60/95/931876095.db2.gz YBOLJYBMKWJEJH-HXUWFJFHSA-N 0 3 421.459 4.212 20 0 HIADHN Cc1ccc(NC(=O)NC[C@@H]2CCCN(Cc3cnc4c(cnn4C(C)C)c3)C2)cc1 ZINC000533501389 931885768 /nfs/dbraw/zinc/88/57/68/931885768.db2.gz BHKFXFPVWJSXQU-IBGZPJMESA-N 0 3 420.561 4.354 20 0 HIADHN Cc1ccc(NC(=O)NC[C@H]2CCCN(Cc3cnc4c(cnn4C(C)C)c3)C2)cc1 ZINC000533501390 931885806 /nfs/dbraw/zinc/88/58/06/931885806.db2.gz BHKFXFPVWJSXQU-LJQANCHMSA-N 0 3 420.561 4.354 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CNC(=O)CN[C@H](c1ccccc1)C1CCC1 ZINC000533513753 931890703 /nfs/dbraw/zinc/89/07/03/931890703.db2.gz QPHKILAEDMITGM-AREMUKBSSA-N 0 3 416.569 4.295 20 0 HIADHN C[C@@H](c1cccc(O)c1)N(C)C[C@H](O)COc1ccc(Cl)cc1Br ZINC000533514353 931891173 /nfs/dbraw/zinc/89/11/73/931891173.db2.gz MLKGYGSRMGYZOV-LRDDRELGSA-N 0 3 414.727 4.241 20 0 HIADHN C[C@H](c1cccc(O)c1)N(C)C[C@H](O)COc1ccc(Cl)cc1Br ZINC000533514355 931891352 /nfs/dbraw/zinc/89/13/52/931891352.db2.gz MLKGYGSRMGYZOV-WBMJQRKESA-N 0 3 414.727 4.241 20 0 HIADHN Cc1ccc([C@@H](C)NC(=O)CNC2(c3ccc(Cl)cc3)CCOCC2)cc1C ZINC000533520370 931892283 /nfs/dbraw/zinc/89/22/83/931892283.db2.gz PZNKAHFVZLBJMZ-GOSISDBHSA-N 0 3 400.950 4.430 20 0 HIADHN CC(C)(C)c1ccc(CNCc2ccccc2CS(=O)(=O)N2CCCC2)s1 ZINC000533636566 931938160 /nfs/dbraw/zinc/93/81/60/931938160.db2.gz AFGZZFWIFCDEOT-UHFFFAOYSA-N 0 3 406.617 4.261 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)c2ccc(OC)c(-c3ccccn3)c2)N(C)C)cc1 ZINC000533660701 931954584 /nfs/dbraw/zinc/95/45/84/931954584.db2.gz RRVJXXVXFOCCHW-HSZRJFAPSA-N 0 3 403.526 4.352 20 0 HIADHN C[C@@H](NCC1(N2CCSCC2)CCCCC1)c1ncc(Br)s1 ZINC000533785817 932032753 /nfs/dbraw/zinc/03/27/53/932032753.db2.gz WUDLLHDUXWKVOV-CYBMUJFWSA-N 0 3 404.443 4.308 20 0 HIADHN CN(C)[C@H](CNC(=O)c1ccc(-c2noc(CC(C)(C)C)n2)cc1)Cc1ccccc1 ZINC000533814441 932043666 /nfs/dbraw/zinc/04/36/66/932043666.db2.gz CFDPABYIVFFDRS-NRFANRHFSA-N 0 3 420.557 4.228 20 0 HIADHN CC(C)CC(=O)Nc1ccc(Cl)c(C(=O)NC[C@@H](Cc2ccccc2)N(C)C)c1 ZINC000533814466 932044069 /nfs/dbraw/zinc/04/40/69/932044069.db2.gz COYFFLKUMWCAAI-LJQANCHMSA-N 0 3 415.965 4.227 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2cnn(CC(C)C)c2C(F)F)N2CCCC2)cc1 ZINC000533903278 932091648 /nfs/dbraw/zinc/09/16/48/932091648.db2.gz HPFVQSCZLQGMCI-IBGZPJMESA-N 0 3 404.505 4.352 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)[C@@H](OC2CCOCC2)c2ccccc2)N2CCCC2)cc1 ZINC000533907152 932093740 /nfs/dbraw/zinc/09/37/40/932093740.db2.gz NUKQFQKQKNZTOV-RPBOFIJWSA-N 0 3 422.569 4.185 20 0 HIADHN CN1CC[C@H](NC(=O)NCCc2nc3cc(Cl)ccc3s2)[C@@H]1c1ccccc1 ZINC000533913778 932096275 /nfs/dbraw/zinc/09/62/75/932096275.db2.gz XLNXCOGDWRPYRO-JXFKEZNVSA-N 0 3 414.962 4.237 20 0 HIADHN CCCOc1ccc([C@H](C)NC(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)cc1OC ZINC000533929691 932106468 /nfs/dbraw/zinc/10/64/68/932106468.db2.gz LVBPSMJCDVQBIF-NYDSKATKSA-N 0 3 411.546 4.290 20 0 HIADHN CC(C)(C)[C@H](CN1CCc2ccccc2C1)NC(=O)N[C@@H](c1cccnc1)C1CC1 ZINC000533967703 932143574 /nfs/dbraw/zinc/14/35/74/932143574.db2.gz YGKZEOVLECEYNZ-XZOQPEGZSA-N 0 3 406.574 4.305 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)c2ccc(S(=O)(=O)Cc3ccccc3)cc2)c1 ZINC000533968042 932144070 /nfs/dbraw/zinc/14/40/70/932144070.db2.gz GYDHXYUNMZTODJ-UHFFFAOYSA-N 0 3 422.550 4.283 20 0 HIADHN CC(C)Cn1ncc(NC(=O)N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)c1C(F)F ZINC000534089632 932268554 /nfs/dbraw/zinc/26/85/54/932268554.db2.gz QFANRTWHWJWSFH-RDJZCZTQSA-N 0 3 405.493 4.261 20 0 HIADHN Cc1nccn1CCCN1CCc2c(cccc2NC(=O)Nc2ccccc2F)C1 ZINC000534219665 932338648 /nfs/dbraw/zinc/33/86/48/932338648.db2.gz ITUUCCBMIJMLKM-UHFFFAOYSA-N 0 3 407.493 4.423 20 0 HIADHN Cc1cc(C)c(CC(C(=O)Nc2cccc3c2oc(=O)n3C)C(F)(F)F)c(C)c1 ZINC000534465394 932483735 /nfs/dbraw/zinc/48/37/35/932483735.db2.gz PULRRZJNQAYJQW-OAHLLOKOSA-N 0 3 406.404 4.416 20 0 HIADHN CC1CCN(S(=O)(=O)Cc2ccccc2CNCc2cccc3cccnc32)CC1 ZINC000534467628 932487814 /nfs/dbraw/zinc/48/78/14/932487814.db2.gz YUZCFVXVXPHNEE-UHFFFAOYSA-N 0 3 423.582 4.086 20 0 HIADHN CC(=O)c1ccc2c(c1)CCN(C(=O)NC[C@H](c1ccc(C)cc1)N1CCCC1)CC2 ZINC000534483040 932520044 /nfs/dbraw/zinc/52/00/44/932520044.db2.gz OZUNPPTUIDZXTP-RUZDIDTESA-N 0 3 419.569 4.145 20 0 HIADHN CN(C)[C@@H](CNC(=O)Cc1csc(-c2ccc(Cl)cc2)n1)Cc1ccccc1 ZINC000534521977 932544743 /nfs/dbraw/zinc/54/47/43/932544743.db2.gz XAJADKYTYAOLTJ-HXUWFJFHSA-N 0 3 413.974 4.295 20 0 HIADHN Cc1ccc(CNC(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)c(OCC(F)(F)F)c1 ZINC000534642494 932615739 /nfs/dbraw/zinc/61/57/39/932615739.db2.gz KRDWCVLYSUGBPR-AZUAARDMSA-N 0 3 421.463 4.181 20 0 HIADHN CN(CCCc1cc(-c2ccccc2)no1)C(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000534683119 932653016 /nfs/dbraw/zinc/65/30/16/932653016.db2.gz AEUDHQCQOPDVSU-LADGPHEKSA-N 0 3 418.541 4.361 20 0 HIADHN COc1cc(C(=O)NC2CCN(CCOc3ccc(Cl)cc3)CC2)ccc1Cl ZINC000534701179 932671692 /nfs/dbraw/zinc/67/16/92/932671692.db2.gz MAXLCMQZBWWUMR-UHFFFAOYSA-N 0 3 423.340 4.275 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)[C@@H]2CCCN(C(=O)c3ccc(Cl)cc3)C2)c1 ZINC000534710761 932680306 /nfs/dbraw/zinc/68/03/06/932680306.db2.gz RJPDSBUIOCGADR-LJQANCHMSA-N 0 3 413.949 4.201 20 0 HIADHN CC[C@H](NC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1)c1nc(-c2ccccc2)c[nH]1 ZINC000534713654 932683150 /nfs/dbraw/zinc/68/31/50/932683150.db2.gz HEHUWYSKCHRSRI-ONTIZHBOSA-N 0 3 403.530 4.272 20 0 HIADHN CN1CC[C@H](NC(=O)NCCc2csc(-c3ccccc3)n2)[C@H]1c1ccccc1 ZINC000534718237 932685596 /nfs/dbraw/zinc/68/55/96/932685596.db2.gz YHBRSGSDXUQCCF-LEWJYISDSA-N 0 3 406.555 4.097 20 0 HIADHN Cc1cc(NC(=O)c2scnc2C2CC2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000534765623 932747458 /nfs/dbraw/zinc/74/74/58/932747458.db2.gz FVIACYCDNVZYFZ-SFHVURJKSA-N 0 3 407.543 4.225 20 0 HIADHN CN(C(=O)[C@@H](OC1CCOCC1)c1ccccc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000534774598 932755211 /nfs/dbraw/zinc/75/52/11/932755211.db2.gz BCDGSRLCWHTEGP-NOZRDPDXSA-N 0 3 422.569 4.046 20 0 HIADHN O=C(c1ccoc1)N1CCC(N[C@@H]2CCc3c2c(Br)ccc3F)CC1 ZINC000534794271 932775108 /nfs/dbraw/zinc/77/51/08/932775108.db2.gz PXKOWKJLTLLORC-QGZVFWFLSA-N 0 3 407.283 4.063 20 0 HIADHN COc1ccc(COCCCC(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)cc1 ZINC000534814525 932787218 /nfs/dbraw/zinc/78/72/18/932787218.db2.gz LVJMTNRXPIGFAB-NRFANRHFSA-N 0 3 410.558 4.115 20 0 HIADHN CCC(=O)c1ccc(OCCCCC(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)cc1 ZINC000534845381 932804966 /nfs/dbraw/zinc/80/49/66/932804966.db2.gz CPXYOGKDYQYEFX-DHLKQENFSA-N 0 3 408.542 4.390 20 0 HIADHN C[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)N(CCN(C)C)Cc1cccc(O)c1 ZINC000534924136 932840414 /nfs/dbraw/zinc/84/04/14/932840414.db2.gz JWFHYVCRTGUXIY-MRXNPFEDSA-N 0 3 408.464 4.180 20 0 HIADHN CC(C)Cn1cc(NC(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)c(C(F)F)n1 ZINC000534926189 932842182 /nfs/dbraw/zinc/84/21/82/932842182.db2.gz WEHGZVLYEFBORV-UHFFFAOYSA-N 0 3 419.520 4.259 20 0 HIADHN C[C@H]1CC(NC(=O)N(CCN(C)Cc2ccccc2)Cc2ccccc2)C[C@H](C)O1 ZINC000535064874 932896523 /nfs/dbraw/zinc/89/65/23/932896523.db2.gz AVGKMKRNUXWPCU-SFTDATJTSA-N 0 3 409.574 4.286 20 0 HIADHN C[C@H](O)CN(Cc1cn(Cc2ccccc2)nc1-c1cccnc1)Cc1ccccc1 ZINC000535080706 932899149 /nfs/dbraw/zinc/89/91/49/932899149.db2.gz ALSMPTNJASGJJC-NRFANRHFSA-N 0 3 412.537 4.376 20 0 HIADHN O=C1NCCN1[C@@H]1CCCN(Cc2ccc(-c3cccc(Br)c3)s2)C1 ZINC000535083197 932899552 /nfs/dbraw/zinc/89/95/52/932899552.db2.gz PWZOJXUETTYEPF-MRXNPFEDSA-N 0 3 420.376 4.167 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)c3ccc(C)cc3Br)cc2)CC1 ZINC000535107404 932925211 /nfs/dbraw/zinc/92/52/11/932925211.db2.gz SGLLMLPILFQYQY-UHFFFAOYSA-N 0 3 416.363 4.147 20 0 HIADHN COc1ccc(CN(C(=O)NC[C@@H](Cc2ccccc2)N(C)C)[C@H](C)C2CC2)cc1 ZINC000535260728 933040219 /nfs/dbraw/zinc/04/02/19/933040219.db2.gz KEGOLGOGICNGDG-AUSIDOKSSA-N 0 3 409.574 4.178 20 0 HIADHN CC1CCC(N2CCN(C(=O)Nc3cccc4c3CN(c3ccccn3)C4)CC2)CC1 ZINC000535326994 933074282 /nfs/dbraw/zinc/07/42/82/933074282.db2.gz RNXWALSAFAVHHK-UHFFFAOYSA-N 0 3 419.573 4.330 20 0 HIADHN CN(CCCc1cc(-c2ccccc2)n[nH]1)C(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000535396939 933115025 /nfs/dbraw/zinc/11/50/25/933115025.db2.gz RQGOSYHWSAHJBI-LADGPHEKSA-N 0 3 417.557 4.096 20 0 HIADHN C[C@H]1CCN(C(=O)[C@@H](OC2CCOCC2)c2ccccc2)CCN1Cc1ccccc1 ZINC000535405675 933119898 /nfs/dbraw/zinc/11/98/98/933119898.db2.gz DWEKUCPCQTVTFM-OFVILXPXSA-N 0 3 422.569 4.046 20 0 HIADHN C[C@H]1CCN(C(=O)[C@H](OC2CCOCC2)c2ccccc2)CCN1Cc1ccccc1 ZINC000535405677 933120413 /nfs/dbraw/zinc/12/04/13/933120413.db2.gz DWEKUCPCQTVTFM-SQJMNOBHSA-N 0 3 422.569 4.046 20 0 HIADHN Cc1cc([C@H](NC(=O)N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)C2CC2)ccc1F ZINC000535414967 933124051 /nfs/dbraw/zinc/12/40/51/933124051.db2.gz KXUCJIAXDPBHLE-IEGUWTFLSA-N 0 3 417.569 4.116 20 0 HIADHN CN1CC[C@H](NC(=O)NCc2csc(CCc3ccccc3)n2)[C@@H]1c1ccccc1 ZINC000535429989 933131080 /nfs/dbraw/zinc/13/10/80/933131080.db2.gz IFIVSCXVEQZJOQ-GMAHTHKFSA-N 0 3 420.582 4.173 20 0 HIADHN CN1CC[C@@H](NC(=O)N(CCc2ccccc2)Cc2ccncc2)[C@H]1c1ccccc1 ZINC000535436660 933134683 /nfs/dbraw/zinc/13/46/83/933134683.db2.gz NXGJKZWQNBVUBM-JWQCQUIFSA-N 0 3 414.553 4.281 20 0 HIADHN CN1CC[C@H](NC(=O)CCc2ncc(-c3ccc(F)cc3F)o2)[C@@H]1c1ccccc1 ZINC000535468036 933158043 /nfs/dbraw/zinc/15/80/43/933158043.db2.gz GXPROADWYIYFMX-CVDCTZTESA-N 0 3 411.452 4.114 20 0 HIADHN CCOc1cc2c(cc1[C@@H]1C[C@@H]1C(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1)O[C@@H](C)C2 ZINC000535468017 933158202 /nfs/dbraw/zinc/15/82/02/933158202.db2.gz GWXVZHXOKRZWGX-FTBXOKEUSA-N 0 3 420.553 4.074 20 0 HIADHN Cc1cc(C(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)ccc1NC(=O)c1cccs1 ZINC000535470452 933159927 /nfs/dbraw/zinc/15/99/27/933159927.db2.gz WEBOZTFHNZDTHO-RBBKRZOGSA-N 0 3 419.550 4.484 20 0 HIADHN CC[C@@H](C)n1ncc(C(=O)Nc2ccc(N3CCN(CC)CC3)cc2C)c1C1CC1 ZINC000535482117 933173228 /nfs/dbraw/zinc/17/32/28/933173228.db2.gz YICOQSSYJHXDSD-GOSISDBHSA-N 0 3 409.578 4.434 20 0 HIADHN CC[C@@H](C)n1ncc(C(=O)Nc2ccc(CN3CCN(CC)CC3)cc2)c1C1CC1 ZINC000535505284 933197248 /nfs/dbraw/zinc/19/72/48/933197248.db2.gz VWBHOLHYSIRLFB-GOSISDBHSA-N 0 3 409.578 4.121 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)c2cc3ccccc3cc2OC(F)F)CC1 ZINC000535598220 933261467 /nfs/dbraw/zinc/26/14/67/933261467.db2.gz JEOLRUWXXBWPLV-UHFFFAOYSA-N 0 3 406.473 4.060 20 0 HIADHN Cn1cc(CN(CCC(F)(F)F)CC2CC2)c(-c2ccc3c(c2)OCCCO3)n1 ZINC000535802548 933398482 /nfs/dbraw/zinc/39/84/82/933398482.db2.gz AMRIDYCWTDIEDC-UHFFFAOYSA-N 0 3 409.452 4.413 20 0 HIADHN CSc1ccc(CN(C)C(=O)CN2CCC[C@@H]2Cn2c(C)nc3ccccc32)cc1 ZINC000535965276 933527855 /nfs/dbraw/zinc/52/78/55/933527855.db2.gz YGGJQBXRKZFUEK-HXUWFJFHSA-N 0 3 422.598 4.190 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cccc(C)c3Br)c(C)c2)CC1 ZINC000535989312 933551606 /nfs/dbraw/zinc/55/16/06/933551606.db2.gz SEUNQMTXCJRSSI-UHFFFAOYSA-N 0 3 416.363 4.460 20 0 HIADHN CN1CC[C@@H](NC(=O)NCc2ccc(Oc3ccc(F)cc3)nc2)[C@H]1c1ccccc1 ZINC000536094417 933643767 /nfs/dbraw/zinc/64/37/67/933643767.db2.gz FTCRQAUMYVKATN-FYYLOGMGSA-N 0 3 420.488 4.258 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)c3ccc(OC4CCC4)cc3Cl)CC2)C[C@H](C)O1 ZINC000536108312 933659397 /nfs/dbraw/zinc/65/93/97/933659397.db2.gz LTFNFGLKHKDARF-IRXDYDNUSA-N 0 3 420.981 4.233 20 0 HIADHN COCCc1nc(C)c([C@@H](C)NCc2ccc(NC(=O)c3cccnc3)cc2)s1 ZINC000536153619 933689829 /nfs/dbraw/zinc/68/98/29/933689829.db2.gz WFQFJFDGELOMHS-OAHLLOKOSA-N 0 3 410.543 4.139 20 0 HIADHN CC(C)(C)[C@H](COc1ccccc1F)NCC(=O)Nc1ccccc1OC(F)F ZINC000537290099 933699983 /nfs/dbraw/zinc/69/99/83/933699983.db2.gz HBPGNKYRJWPDOW-SFHVURJKSA-N 0 3 410.436 4.449 20 0 HIADHN COc1ccc([C@@H](C)NC2CCN(C(=O)c3ccoc3)CC2)c(Br)c1 ZINC000537296052 933701934 /nfs/dbraw/zinc/70/19/34/933701934.db2.gz QYIOELFWNKVWTA-CYBMUJFWSA-N 0 3 407.308 4.006 20 0 HIADHN CCOc1cccc2cc([C@H](C)NCCCS(=O)(=O)Cc3ccccc3)oc21 ZINC000537296012 933702537 /nfs/dbraw/zinc/70/25/37/933702537.db2.gz RTKWLNGUMLVWOA-KRWDZBQOSA-N 0 3 401.528 4.487 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCC[C@@H]1[C@@H]1C[C@@H](C)CC[C@H]1O)c1ccsc1 ZINC000537305495 933706920 /nfs/dbraw/zinc/70/69/20/933706920.db2.gz VWPAVGDTINIMSH-AYZHRIAMSA-N 0 3 407.624 4.102 20 0 HIADHN C[C@H](COc1ccc2cc(Br)ccc2c1)NCc1ccnc(N(C)C)n1 ZINC000537306565 933707675 /nfs/dbraw/zinc/70/76/75/933707675.db2.gz KEGVVUYUSJXYIA-CQSZACIVSA-N 0 3 415.335 4.015 20 0 HIADHN COc1ccc([C@H](C)NC2CCN(C(=O)CC(F)(F)F)CC2)c(Br)c1 ZINC000537308250 933709005 /nfs/dbraw/zinc/70/90/05/933709005.db2.gz YTMREFSCNZKJMA-NSHDSACASA-N 0 3 423.273 4.052 20 0 HIADHN COc1sc(CN[C@H](C)[C@H](OC)c2ccc(OC)cc2)cc1Br ZINC000537344815 933726961 /nfs/dbraw/zinc/72/69/61/933726961.db2.gz SHMRWUQEXTZGTE-BZNIZROVSA-N 0 3 400.338 4.394 20 0 HIADHN C[C@H](N[C@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O)c1ccc2c(c1)OCO2 ZINC000537346655 933728894 /nfs/dbraw/zinc/72/88/94/933728894.db2.gz BYVDQLDLIQFVQO-KSSFIOAISA-N 0 3 420.431 4.276 20 0 HIADHN CCNC(=O)COc1ccc(CN[C@H](c2cc3ccccc3o2)C(C)C)cc1OC ZINC000537350547 933730892 /nfs/dbraw/zinc/73/08/92/933730892.db2.gz UXTQGAVIKRVUDQ-DEOSSOPVSA-N 0 3 410.514 4.443 20 0 HIADHN CC(C)(C)[C@H](CN1CCc2ccccc2C1)NC(=O)N1CCC[C@@H]1C1CCOCC1 ZINC000537527791 933800870 /nfs/dbraw/zinc/80/08/70/933800870.db2.gz OQGFHVZEZXDIIN-PKTZIBPZSA-N 0 3 413.606 4.060 20 0 HIADHN CC(C)N1CCC[C@H](NC2(c3ccc(OCc4ccccc4)cc3)CCOCC2)C1=O ZINC000562619949 945108771 /nfs/dbraw/zinc/10/87/71/945108771.db2.gz UXEHIFQXINVNPE-DEOSSOPVSA-N 0 3 422.569 4.260 20 0 HIADHN Cc1nc(CNC2CCN(C(=O)c3ccc(Br)cc3C)CC2)sc1C ZINC000562795410 945121761 /nfs/dbraw/zinc/12/17/61/945121761.db2.gz LGHVMTSYQAOMIJ-UHFFFAOYSA-N 0 3 422.392 4.225 20 0 HIADHN C[C@H](N[C@H]1CCN(C)[C@H]1c1ccc(Cl)c(F)c1)C(=O)Nc1cc(F)ccc1F ZINC000562907292 945148648 /nfs/dbraw/zinc/14/86/48/945148648.db2.gz DZXZUJFYRLAMQI-AHYKXKOGSA-N 0 3 411.855 4.119 20 0 HIADHN CC(C)n1ncc2cc(CN3CCC[C@@H](c4nc(-c5ccccc5)n[nH]4)C3)cnc21 ZINC000537560508 938324516 /nfs/dbraw/zinc/32/45/16/938324516.db2.gz GNFXZSKCOJPAQT-LJQANCHMSA-N 0 3 401.518 4.177 20 0 HIADHN COC(=O)C1CCN(CCCNC(=O)C2(c3ccc(C(C)C)cc3)CCCC2)CC1 ZINC000537569338 938326855 /nfs/dbraw/zinc/32/68/55/938326855.db2.gz JWUMXEMADVETKN-UHFFFAOYSA-N 0 3 414.590 4.013 20 0 HIADHN O=C(Nc1ccc(F)cc1)C1CCN(Cc2ccc(OC[C@H]3CCCO3)cc2)CC1 ZINC000537614408 938333324 /nfs/dbraw/zinc/33/33/24/938333324.db2.gz GKDBEWQQPVYEKF-HSZRJFAPSA-N 0 3 412.505 4.234 20 0 HIADHN CCO[C@@H]1C[C@H](O)C12CCN(Cc1ccc(-c3ccc(Br)cc3)o1)CC2 ZINC000537617128 938334636 /nfs/dbraw/zinc/33/46/36/938334636.db2.gz QIZSJUHYHYIKIK-VQTJNVASSA-N 0 3 420.347 4.461 20 0 HIADHN CCCN1CCN(c2ccccc2CN(C)Cc2nc(C(F)(F)F)cs2)CC1 ZINC000537620897 938336006 /nfs/dbraw/zinc/33/60/06/938336006.db2.gz IOZURFHSHMHESH-UHFFFAOYSA-N 0 3 412.525 4.326 20 0 HIADHN COCCOC1CCN(Cc2cn(-c3ccccc3)nc2-c2ccc(OC)cc2)CC1 ZINC000537628396 938340244 /nfs/dbraw/zinc/34/02/44/938340244.db2.gz FQTLZNQGQDWSAI-UHFFFAOYSA-N 0 3 421.541 4.175 20 0 HIADHN O=C(CCn1c2ccccc2nc1C1CC1)NC[C@H](c1cccs1)N1CCCC1 ZINC000537642957 938344570 /nfs/dbraw/zinc/34/45/70/938344570.db2.gz CNRNJNXVMWPQLD-HXUWFJFHSA-N 0 3 408.571 4.319 20 0 HIADHN CC(C)(C)OC(=O)C1CCC(NC(=O)NC[C@@H](c2cccs2)N2CCCC2)CC1 ZINC000537689732 938355165 /nfs/dbraw/zinc/35/51/65/938355165.db2.gz VVYSCMAFDGINMQ-ABHNRTSZSA-N 0 3 421.607 4.085 20 0 HIADHN c1nc(N2CCOCC2)sc1CN1CCc2ccccc2[C@@H]1Cc1ccccc1 ZINC000537702993 938359707 /nfs/dbraw/zinc/35/97/07/938359707.db2.gz YIQFITSNJFIQLE-QHCPKHFHSA-N 0 3 405.567 4.322 20 0 HIADHN COC(=O)c1ccc(CN[C@@H](C)CC(=O)Nc2ccccc2C(F)(F)F)cc1OC ZINC000537939306 938424729 /nfs/dbraw/zinc/42/47/29/938424729.db2.gz KWCQUUFDBVVPIB-ZDUSSCGKSA-N 0 3 424.419 4.008 20 0 HIADHN Cc1nc(-c2ccccc2)sc1[C@@H](C)NCCN(C)S(=O)(=O)c1cccs1 ZINC000537948319 938428589 /nfs/dbraw/zinc/42/85/89/938428589.db2.gz HNXVPFLUHOVKKK-CQSZACIVSA-N 0 3 421.613 4.151 20 0 HIADHN COc1ccc([C@H](C)NCc2ccccc2CS(=O)(=O)N2CCC(C)CC2)cc1 ZINC000537954239 938431765 /nfs/dbraw/zinc/43/17/65/938431765.db2.gz YXOXEWMLXZCBGK-IBGZPJMESA-N 0 3 416.587 4.108 20 0 HIADHN Cc1c([C@H](C)NC2CCN(C(=O)c3ccccc3)CC2)nnn1-c1ccc(Cl)cc1 ZINC000537965026 938437022 /nfs/dbraw/zinc/43/70/22/938437022.db2.gz PWNGQZHZGSRZPY-INIZCTEOSA-N 0 3 423.948 4.185 20 0 HIADHN COc1ccc(C[C@@H](NCCCS(C)(=O)=O)c2cc(Cl)ccc2Cl)cc1 ZINC000537971676 938441927 /nfs/dbraw/zinc/44/19/27/938441927.db2.gz BRPMQILMGZQAEA-LJQANCHMSA-N 0 3 416.370 4.310 20 0 HIADHN CCc1cc(N2CCC[C@@H](N[C@H](C)c3cc(Cl)c(OC)cc3OC)C2)ncn1 ZINC000537979933 938446137 /nfs/dbraw/zinc/44/61/37/938446137.db2.gz BROAIWLDUJIBNS-GDBMZVCRSA-N 0 3 404.942 4.029 20 0 HIADHN C[C@H](N[C@H]1CCN(c2ccc(Cl)cc2)C1=O)c1ccc(OCc2nccn2C)cc1 ZINC000537983015 938447540 /nfs/dbraw/zinc/44/75/40/938447540.db2.gz TWXYQEBCYGWVBU-KKSFZXQISA-N 0 3 424.932 4.109 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(Cl)cc2)CC1)[C@@H]1C[C@@H]1c1ccc(F)cc1 ZINC000537987328 938449577 /nfs/dbraw/zinc/44/95/77/938449577.db2.gz NSVRTZUVWDNOKI-FGZHOGPDSA-N 0 3 416.924 4.242 20 0 HIADHN C[C@H]1C[C@@H](NCc2ccc(S(=O)(=O)N(C)C)cc2)c2cccc(Br)c21 ZINC000537987846 938449584 /nfs/dbraw/zinc/44/95/84/938449584.db2.gz QVVWETPZHGZRBA-SCLBCKFNSA-N 0 3 423.376 4.038 20 0 HIADHN C[C@H](NCc1ccccc1OCC(=O)NC[C@@H]1CCCO1)c1ccc2ccccc2c1 ZINC000537987547 938449608 /nfs/dbraw/zinc/44/96/08/938449608.db2.gz QREGYFPYFVRMIP-CYFREDJKSA-N 0 3 418.537 4.365 20 0 HIADHN C[C@@H](NCCOc1ccccc1-c1ccccc1)c1cccc(S(=O)(=O)N(C)C)c1 ZINC000537990639 938452373 /nfs/dbraw/zinc/45/23/73/938452373.db2.gz JNLFYLVCYNVPAG-LJQANCHMSA-N 0 3 424.566 4.334 20 0 HIADHN Cn1cc(CN[C@@H]2CC(=O)N(c3cccc(C(F)(F)F)c3)C2)c(-c2cccs2)n1 ZINC000538000591 938457570 /nfs/dbraw/zinc/45/75/70/938457570.db2.gz OTWNFMJXQZFSIB-OAHLLOKOSA-N 0 3 420.460 4.063 20 0 HIADHN C[C@@H](N[C@@H]1CCCN(S(=O)(=O)c2cccs2)C1)c1ccc(F)c(Cl)c1 ZINC000563314278 945176295 /nfs/dbraw/zinc/17/62/95/945176295.db2.gz LLLKEFHFHXSINT-TZMCWYRMSA-N 0 3 402.944 4.045 20 0 HIADHN CCOc1ccc([C@H](C)[NH2+]Cc2nnc(-c3ccc(Br)cc3)[n-]2)cc1 ZINC000538017523 938463291 /nfs/dbraw/zinc/46/32/91/938463291.db2.gz FFBFJGHAIZQMSR-ZDUSSCGKSA-N 0 3 401.308 4.484 20 0 HIADHN C[C@H](NCC1(CS(C)(=O)=O)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000538019948 938464879 /nfs/dbraw/zinc/46/48/79/938464879.db2.gz RSQHWXFKSYVOSN-JTQLQIEISA-N 0 3 403.388 4.200 20 0 HIADHN COc1ccc(CN(C(=O)NC[C@H]2CCCCN2C2CC2)[C@@H](C)C2CC2)c(OC)c1 ZINC000563320633 945179211 /nfs/dbraw/zinc/17/92/11/945179211.db2.gz QNSJWJBCIRUHLX-LAUBAEHRSA-N 0 3 415.578 4.031 20 0 HIADHN COc1cc([C@@H](C)NCc2ccc3c(c2)ncn3C)ccc1OCc1ccncc1 ZINC000538119596 938508496 /nfs/dbraw/zinc/50/84/96/938508496.db2.gz DAZWAMAJPZPXCM-QGZVFWFLSA-N 0 3 402.498 4.407 20 0 HIADHN Cc1c(Br)cccc1CN[C@H](C)c1ccc(OCC(=O)NC2CC2)cc1 ZINC000538123124 938509862 /nfs/dbraw/zinc/50/98/62/938509862.db2.gz FKBNDJUHFCQRDM-OAHLLOKOSA-N 0 3 417.347 4.266 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(OCc2cccnc2)cc1)C(=O)NCCc1ccc(F)cc1 ZINC000538123132 938510289 /nfs/dbraw/zinc/51/02/89/938510289.db2.gz FMNZCPBPURTMSK-RTBURBONSA-N 0 3 421.516 4.198 20 0 HIADHN CC[C@@H](N[C@H](C)C(=O)Nc1cc(NC(C)=O)ccc1OC)c1cccc(Cl)c1 ZINC000538128889 938513335 /nfs/dbraw/zinc/51/33/35/938513335.db2.gz PHAKEUJAEDUIGE-FZKQIMNGSA-N 0 3 403.910 4.375 20 0 HIADHN CC[C@@H](N[C@@H](C)C(=O)N(C)Cc1ccc(OC)c(OC)c1)c1ccc(Cl)cc1 ZINC000538129049 938513900 /nfs/dbraw/zinc/51/39/00/938513900.db2.gz DABKHVXRWDCDSU-HNAYVOBHSA-N 0 3 404.938 4.445 20 0 HIADHN CC(C)[C@@H](NCC(=O)N(C)Cc1ccc(Cl)s1)c1ccc2c(c1)OCCO2 ZINC000538140427 938517716 /nfs/dbraw/zinc/51/77/16/938517716.db2.gz LIINZGXPRQCAMP-HXUWFJFHSA-N 0 3 408.951 4.118 20 0 HIADHN COc1ccccc1[C@H](C)NC(=O)[C@H](C)N[C@H](C)c1ccc(Br)cc1 ZINC000538143006 938519038 /nfs/dbraw/zinc/51/90/38/938519038.db2.gz DECZLVFSEXKFGA-ILXRZTDVSA-N 0 3 405.336 4.374 20 0 HIADHN CC[C@H](NCC(=O)N1CCC[C@H]1c1ccc2c(c1)OCCCO2)c1ccc(OC)cc1 ZINC000538142275 938519168 /nfs/dbraw/zinc/51/91/68/938519168.db2.gz ZYBBFVGMQSVKTK-VXKWHMMOSA-N 0 3 424.541 4.261 20 0 HIADHN CC(C)OC(=O)c1ccc(NC(=O)[C@@H](C)N[C@H](C)c2ccccc2-n2cccn2)cc1 ZINC000538159829 938529137 /nfs/dbraw/zinc/52/91/37/938529137.db2.gz IQPUAHOXMFNUHK-QZTJIDSGSA-N 0 3 420.513 4.115 20 0 HIADHN C[C@H](c1cc2ccccc2o1)N(C)C(=O)CN[C@@H](C)c1ccccc1-n1cccn1 ZINC000538159328 938529685 /nfs/dbraw/zinc/52/96/85/938529685.db2.gz BCHCGSWMCAPKGA-ZWKOTPCHSA-N 0 3 402.498 4.489 20 0 HIADHN C[C@H](N[C@@H](C)c1ccccc1-n1cccn1)C(=O)Nc1ccc(OC(F)(F)F)cc1 ZINC000538160471 938529697 /nfs/dbraw/zinc/52/96/97/938529697.db2.gz ZRDHYEZKYSQSIS-GJZGRUSLSA-N 0 3 418.419 4.449 20 0 HIADHN CC(C)[C@H](NCC(=O)Nc1ccc(C(=O)N(C)C)cc1)c1cccc(C(F)(F)F)c1 ZINC000538159740 938529782 /nfs/dbraw/zinc/52/97/82/938529782.db2.gz WTKCETWIUYYYQD-FQEVSTJZSA-N 0 3 421.463 4.333 20 0 HIADHN C[C@H](N[C@@H](C)c1cccc(-n2cccn2)c1)C(=O)N(C)Cc1c(F)cccc1Cl ZINC000538187390 938543758 /nfs/dbraw/zinc/54/37/58/938543758.db2.gz HBYRMTBQXZYGNC-HOTGVXAUSA-N 0 3 414.912 4.363 20 0 HIADHN C[C@H](N[C@H]1CCCN(c2ccccc2)C1=O)c1ccc(NC(=O)c2ccncc2)cc1 ZINC000538193733 938547783 /nfs/dbraw/zinc/54/77/83/938547783.db2.gz CKTGVOGZEWIJPN-MBSDFSHPSA-N 0 3 414.509 4.180 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CNC(=O)CN[C@H](C)c1cc(C)cc(C)c1 ZINC000538216043 938560103 /nfs/dbraw/zinc/56/01/03/938560103.db2.gz BRUNPYOFSNLZKH-LJQANCHMSA-N 0 3 404.558 4.132 20 0 HIADHN COc1ccc(CNC(=O)CNC2(c3cccc(Cl)c3)CCCC2)cc1OC ZINC000538224844 938564033 /nfs/dbraw/zinc/56/40/33/938564033.db2.gz MSSWRISTBQXKMQ-UHFFFAOYSA-N 0 3 402.922 4.033 20 0 HIADHN COc1cc(C(C)=O)ccc1OC[C@H](O)CN[C@H](c1ccc(F)cc1F)C(C)(C)C ZINC000538224199 938564410 /nfs/dbraw/zinc/56/44/10/938564410.db2.gz PSUKGGDGJRLAEQ-VGOFRKELSA-N 0 3 421.484 4.293 20 0 HIADHN Cc1cc(Br)ccc1NC(=O)CN[C@@H](C[C@H]1CCOC1)c1ccccc1 ZINC000538225604 938564823 /nfs/dbraw/zinc/56/48/23/938564823.db2.gz HJLGIMWTXHBPFT-UZLBHIALSA-N 0 3 417.347 4.454 20 0 HIADHN Cc1cc(Br)ccc1NC(=O)CN[C@H](C[C@H]1CCOC1)c1ccccc1 ZINC000538225601 938565146 /nfs/dbraw/zinc/56/51/46/938565146.db2.gz HJLGIMWTXHBPFT-OXQOHEQNSA-N 0 3 417.347 4.454 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)Nc1cccc(Cl)c1Cl)c1ccc(-n2ccnn2)cc1 ZINC000538232381 938567279 /nfs/dbraw/zinc/56/72/79/938567279.db2.gz AXZXPCHOOZWALB-OLZOCXBDSA-N 0 3 404.301 4.252 20 0 HIADHN Cn1cc(C[NH+]2CCC(C(=O)Nc3cc(Cl)ccc3[O-])CC2)c(-c2ccccc2)n1 ZINC000538305329 938588285 /nfs/dbraw/zinc/58/82/85/938588285.db2.gz OYEQOVDNQWBION-UHFFFAOYSA-N 0 3 424.932 4.297 20 0 HIADHN CCOc1ccccc1CN(CCCn1ccnc1)Cc1ccc2c(c1)ncn2C ZINC000538307531 938588650 /nfs/dbraw/zinc/58/86/50/938588650.db2.gz BGNKWFGZGWDGGM-UHFFFAOYSA-N 0 3 403.530 4.261 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)N[C@H]2CCCOc3c(Cl)cccc32)o1 ZINC000538366457 938604669 /nfs/dbraw/zinc/60/46/69/938604669.db2.gz KOSOTWOOINMBRT-IBGZPJMESA-N 0 3 405.926 4.229 20 0 HIADHN CC[C@@H]1c2ccsc2CCN1C(=O)CN[C@@H](c1ccc2c(c1)OCCO2)C1CC1 ZINC000538390186 938608746 /nfs/dbraw/zinc/60/87/46/938608746.db2.gz ODKNVKGCCBJTOP-WZONZLPQSA-N 0 3 412.555 4.096 20 0 HIADHN Cc1c(Cl)cccc1NC(=O)[C@@H](C)N[C@@H](c1ccc2c(c1)OCCO2)C1CC1 ZINC000538389846 938608801 /nfs/dbraw/zinc/60/88/01/938608801.db2.gz JMIQNGAWHGQRTJ-SPLOXXLWSA-N 0 3 400.906 4.488 20 0 HIADHN COc1ccc(C[C@H](NCc2c(C)nc3sc(C)nn23)c2ccccc2)cc1OC ZINC000538393292 938610164 /nfs/dbraw/zinc/61/01/64/938610164.db2.gz TUZDUKAHTRWECP-IBGZPJMESA-N 0 3 422.554 4.498 20 0 HIADHN COc1ccc([C@H](C)N[C@H](CO)Cc2c[nH]c3ccccc23)c(Br)c1 ZINC000538395507 938610452 /nfs/dbraw/zinc/61/04/52/938610452.db2.gz FIQHBDKQGQZIDK-ZFWWWQNUSA-N 0 3 403.320 4.193 20 0 HIADHN COc1ccc([C@@H](C)NC2CCN(c3cc(C)nc(C)n3)CC2)c(Br)c1 ZINC000538395683 938610558 /nfs/dbraw/zinc/61/05/58/938610558.db2.gz KNOOXSXEJYBIMM-CQSZACIVSA-N 0 3 419.367 4.184 20 0 HIADHN CC(C)c1ncc(CNCc2cc(C(F)(F)F)ccc2N2CCN(C)CC2)s1 ZINC000538400656 938611778 /nfs/dbraw/zinc/61/17/78/938611778.db2.gz IFAJIKGYTSLETO-UHFFFAOYSA-N 0 3 412.525 4.327 20 0 HIADHN Fc1ccc(-c2nc(CCNCc3cc4c(cc3Br)OCO4)co2)cc1 ZINC000538405471 938612979 /nfs/dbraw/zinc/61/29/79/938612979.db2.gz PMDPPOPVUHXLDN-UHFFFAOYSA-N 0 3 419.250 4.304 20 0 HIADHN NC(=O)c1cccc(CNCCOc2c(Cl)cc(Br)cc2Cl)c1 ZINC000538488701 938633377 /nfs/dbraw/zinc/63/33/77/938633377.db2.gz REXNOAYMIACBRE-UHFFFAOYSA-N 0 3 418.118 4.023 20 0 HIADHN Cc1cc(C(=O)N2CC[C@H](N3CCCCC3)C2)nn1-c1ccc(Cl)cc1Cl ZINC000538491550 938634072 /nfs/dbraw/zinc/63/40/72/938634072.db2.gz HEMMTZNLKFGUNX-INIZCTEOSA-N 0 3 407.345 4.188 20 0 HIADHN CC(C)C[C@@H]1C[C@H](NC(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)CCO1 ZINC000538518120 938639988 /nfs/dbraw/zinc/63/99/88/938639988.db2.gz LDJYJGWRZVUCIZ-VAMGGRTRSA-N 0 3 407.624 4.414 20 0 HIADHN CCNC(=O)C(C)(C)CN[C@H](C)c1ccc(Br)cc1Br ZINC000538558181 938648953 /nfs/dbraw/zinc/64/89/53/938648953.db2.gz YXCNJFUHEZFNFA-SNVBAGLBSA-N 0 3 406.162 4.025 20 0 HIADHN Cc1cc(C(=O)CN2CCC[C@H]2C2CCOCC2)c(C)n1CCc1cccs1 ZINC000538628854 938666764 /nfs/dbraw/zinc/66/67/64/938666764.db2.gz WFENOOJPFYELSW-QFIPXVFZSA-N 0 3 400.588 4.483 20 0 HIADHN COc1cc(CN2CCC23CCC3)ccc1OCC(=O)Nc1ccccc1Cl ZINC000538736522 938697246 /nfs/dbraw/zinc/69/72/46/938697246.db2.gz KRGISUHEGKGDCF-UHFFFAOYSA-N 0 3 400.906 4.495 20 0 HIADHN CCN(CC)[C@H](CNC(=O)C1C[C@H](C)O[C@@H](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000538744616 938699651 /nfs/dbraw/zinc/69/96/51/938699651.db2.gz FBVFZSYXCBIMIA-YZVOILCLSA-N 0 3 400.485 4.408 20 0 HIADHN Cc1nc(C(C)(C)c2ccccc2)sc1C(=O)N(CCN(C)C)Cc1ccccn1 ZINC000538745111 938700022 /nfs/dbraw/zinc/70/00/22/938700022.db2.gz SSXCZIJXRKFPHQ-UHFFFAOYSA-N 0 3 422.598 4.376 20 0 HIADHN c1c(CN2CCC(OCC3CC3)CC2)c(-c2cccnc2)nn1Cc1ccccc1 ZINC000538750967 938701437 /nfs/dbraw/zinc/70/14/37/938701437.db2.gz IWCLJYNCCKSCNK-UHFFFAOYSA-N 0 3 402.542 4.384 20 0 HIADHN CCCOc1cc(CN2CCC[C@H](C(=O)N(CC)CC(F)(F)F)C2)ccc1OC ZINC000538752469 938702538 /nfs/dbraw/zinc/70/25/38/938702538.db2.gz NLMXGKLIRFIQCN-KRWDZBQOSA-N 0 3 416.484 4.107 20 0 HIADHN COCCOc1ccc(CN2CCC[C@@H](c3nc4c(s3)CCCC4)C2)cc1OC ZINC000538762512 938704383 /nfs/dbraw/zinc/70/43/83/938704383.db2.gz VEBGUNCMJMPJQT-GOSISDBHSA-N 0 3 416.587 4.435 20 0 HIADHN COc1cc(OC)c(OC)cc1CN1CCC[C@@H](c2nc3ccc(F)cc3o2)C1 ZINC000538796796 938714404 /nfs/dbraw/zinc/71/44/04/938714404.db2.gz VDEFMBYTGNAZKE-CQSZACIVSA-N 0 3 400.450 4.372 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)Cc2cccc(OCc3cccnc3)c2)C1 ZINC000538839838 938723274 /nfs/dbraw/zinc/72/32/74/938723274.db2.gz BGFFFYAPUUMQEU-YKSBVNFPSA-N 0 3 415.537 4.155 20 0 HIADHN c1csc([C@H](NCc2ccccc2OCCN2CCOCC2)C2CCCC2)c1 ZINC000538985555 938759987 /nfs/dbraw/zinc/75/99/87/938759987.db2.gz XBSOWFIUECNMMP-HSZRJFAPSA-N 0 3 400.588 4.480 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(Cl)cc2)CC1)c1ccoc1C(F)(F)F ZINC000563484731 945202140 /nfs/dbraw/zinc/20/21/40/945202140.db2.gz HPVJXRHQIWJJFC-UHFFFAOYSA-N 0 3 416.827 4.225 20 0 HIADHN C[C@H]1Cc2ccc(F)cc2[C@@H]1NCc1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000539018479 938770499 /nfs/dbraw/zinc/77/04/99/938770499.db2.gz LZUXFYICPOWDOP-KSFYIVLOSA-N 0 3 402.535 4.023 20 0 HIADHN C[C@H](NCc1ccc(NS(C)(=O)=O)cc1)c1cccc(OCc2ccccc2)c1 ZINC000539020653 938771406 /nfs/dbraw/zinc/77/14/06/938771406.db2.gz HPBQFHLVDZTMIY-SFHVURJKSA-N 0 3 410.539 4.488 20 0 HIADHN C[C@@H](Cn1ncc2ccccc2c1=O)N[C@@H](C)c1ccc(Br)c(F)c1 ZINC000539040426 938778338 /nfs/dbraw/zinc/77/83/38/938778338.db2.gz AYLVLSSIGMYRIS-STQMWFEESA-N 0 3 404.283 4.037 20 0 HIADHN COc1ccc(Cc2nc(C)c([C@@H](C)NCCC(=O)NC(C)(C)C)s2)cc1OC ZINC000539075270 938795672 /nfs/dbraw/zinc/79/56/72/938795672.db2.gz BGJDICFCXYEPPF-CQSZACIVSA-N 0 3 419.591 4.015 20 0 HIADHN O=C(NCCN[C@H]1CCSc2ccc(F)cc21)c1cccc(Br)c1 ZINC000539086955 938800085 /nfs/dbraw/zinc/80/00/85/938800085.db2.gz CXQVQPBVDOEXBI-INIZCTEOSA-N 0 3 409.324 4.145 20 0 HIADHN CC[C@H](NC[C@@H](OC)c1cccc(Cl)c1)c1ccccc1OCC(=O)N(C)C ZINC000539086738 938800170 /nfs/dbraw/zinc/80/01/70/938800170.db2.gz KQZJTQLTCKEXGS-PZJWPPBQSA-N 0 3 404.938 4.235 20 0 HIADHN Cc1cc(N2CC[C@@H](N[C@H](C)c3ccc(OCc4ccccc4C)cc3)C2=O)n(C)n1 ZINC000539088543 938800234 /nfs/dbraw/zinc/80/02/34/938800234.db2.gz VDOSXZIFZBIRHL-AUSIDOKSSA-N 0 3 418.541 4.072 20 0 HIADHN C[C@H](CC(=O)Nc1ccccc1C(F)(F)F)N[C@H]1C[C@@H](C)N(c2ccccc2)C1=O ZINC000539090439 938800830 /nfs/dbraw/zinc/80/08/30/938800830.db2.gz JHCQLBVLAWAKOG-CLCXKQKWSA-N 0 3 419.447 4.206 20 0 HIADHN CCCOc1ccc([C@H](C)NCc2ccc(S(=O)(=O)N3CCCC3)cc2)cc1 ZINC000539090331 938800850 /nfs/dbraw/zinc/80/08/50/938800850.db2.gz OQPWGGBXPJDYLV-SFHVURJKSA-N 0 3 402.560 4.111 20 0 HIADHN C[C@@H](NCc1ccc(S(=O)(=O)N2CCCC2)cc1)c1ccc(C(F)(F)F)cc1 ZINC000539093415 938801685 /nfs/dbraw/zinc/80/16/85/938801685.db2.gz LFATVQXQQPGOIE-OAHLLOKOSA-N 0 3 412.477 4.341 20 0 HIADHN COCCOc1c(Cl)cc(NC(=O)[C@H]2CCCN2C2CCCC2)cc1Cl ZINC000539138569 938809717 /nfs/dbraw/zinc/80/97/17/938809717.db2.gz BKESZKZMHNYWKV-QGZVFWFLSA-N 0 3 401.334 4.364 20 0 HIADHN Brc1cccc2c1CC[C@H]2N[C@@H](CN1CCOCC1)c1ccccc1 ZINC000539164752 938814697 /nfs/dbraw/zinc/81/46/97/938814697.db2.gz XXPKPEKFFVQCDL-RTWAWAEBSA-N 0 3 401.348 4.100 20 0 HIADHN Cc1cc([C@H](NCc2ccccc2CS(=O)(=O)NC(C)C)C2CC2)ccc1F ZINC000539199974 938818462 /nfs/dbraw/zinc/81/84/62/938818462.db2.gz QPZYLCPPTUABHN-JOCHJYFZSA-N 0 3 404.551 4.203 20 0 HIADHN CCc1cnccc1[C@H](C)N[C@@H](C)c1ccc(S(=O)(=O)NCc2ccco2)cc1 ZINC000539214366 938819593 /nfs/dbraw/zinc/81/95/93/938819593.db2.gz IUEHBKQESUUHJG-IRXDYDNUSA-N 0 3 413.543 4.127 20 0 HIADHN O=S1(=O)CCc2cc(CN[C@H](c3ccc(Br)cc3)C3CC3)ccc21 ZINC000539216103 938819907 /nfs/dbraw/zinc/81/99/07/938819907.db2.gz CHPMXDUJRAYILM-IBGZPJMESA-N 0 3 406.345 4.020 20 0 HIADHN COc1ccc([C@@H](CN[C@@H](C)c2nc3ccc(Cl)cc3n2C)N(C)C)cc1OC ZINC000539217543 938820130 /nfs/dbraw/zinc/82/01/30/938820130.db2.gz XUJUKACSQKLNEH-IFXJQAMLSA-N 0 3 416.953 4.197 20 0 HIADHN COc1ccc([C@H](NCC(=O)N2CCC(OCc3ccccc3)CC2)C(C)C)cc1 ZINC000539244022 938824539 /nfs/dbraw/zinc/82/45/39/938824539.db2.gz PEGUTABUCIRIFJ-RUZDIDTESA-N 0 3 410.558 4.190 20 0 HIADHN COc1ccc(C[C@@H](NCC(=O)N2CCc3ccccc32)c2ccccc2)cc1OC ZINC000539259838 938828566 /nfs/dbraw/zinc/82/85/66/938828566.db2.gz ZMOBWDZDIUFVKD-JOCHJYFZSA-N 0 3 416.521 4.167 20 0 HIADHN C[C@H](NCC(=O)N(Cc1ccccc1)[C@@H](C)C1CC1)c1ccccc1-n1cccn1 ZINC000539260019 938828934 /nfs/dbraw/zinc/82/89/34/938828934.db2.gz NVEQIQNEQCFNHP-PMACEKPBSA-N 0 3 402.542 4.350 20 0 HIADHN COc1cccc(NC(=O)CN[C@H](Cc2ccc(OC)c(OC)c2)c2ccccc2)c1 ZINC000539262041 938829275 /nfs/dbraw/zinc/82/92/75/938829275.db2.gz XJHFFCUOKRZTHF-JOCHJYFZSA-N 0 3 420.509 4.225 20 0 HIADHN Cc1cccc([C@@H](C)NCC(=O)N2c3ccccc3NC(=O)C[C@@H]2C(F)(F)F)c1C ZINC000539286121 938833481 /nfs/dbraw/zinc/83/34/81/938833481.db2.gz COERDFODNCQTKQ-DNVCBOLYSA-N 0 3 419.447 4.260 20 0 HIADHN C[C@H](NCC(=O)Nc1ccc(OC(F)(F)F)cc1)c1cccc(-n2cccn2)c1 ZINC000539288426 938834112 /nfs/dbraw/zinc/83/41/12/938834112.db2.gz IOJUUZANQXIFQI-AWEZNQCLSA-N 0 3 404.392 4.060 20 0 HIADHN C[C@H](NC(=O)CN[C@H](c1ccccc1)[C@@H]1CCOC1)c1ccc(OC(F)(F)F)cc1 ZINC000539290368 938834373 /nfs/dbraw/zinc/83/43/73/938834373.db2.gz ZNOGULJRBIXNAQ-RRMPHLOHSA-N 0 3 422.447 4.130 20 0 HIADHN CCNC(=O)c1cccc(NC(=O)CN[C@H](CC(C)C)c2ccc(Cl)cc2)c1 ZINC000539298966 938836559 /nfs/dbraw/zinc/83/65/59/938836559.db2.gz WRTGPSJNAZZOKK-HXUWFJFHSA-N 0 3 401.938 4.405 20 0 HIADHN CC[C@@H](NCCC(=O)Nc1ccc(N2CCCC2=O)cc1)c1ccc(F)cc1F ZINC000539316199 938840134 /nfs/dbraw/zinc/84/01/34/938840134.db2.gz KUNRHYSINRLBLB-HXUWFJFHSA-N 0 3 401.457 4.161 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1NC(=O)CN[C@@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000539326905 938841971 /nfs/dbraw/zinc/84/19/71/938841971.db2.gz ZFHKHENHMXXSTF-REWPJTCUSA-N 0 3 418.541 4.185 20 0 HIADHN CC(C)[C@H](NCCC(=O)Nc1ccc(C(N)=O)c(Cl)c1)c1ccc(F)cc1F ZINC000539325864 938842018 /nfs/dbraw/zinc/84/20/18/938842018.db2.gz PMWUQLQOSXGYTC-IBGZPJMESA-N 0 3 409.864 4.033 20 0 HIADHN CC(C)(C)[C@H](NCC(=O)NCc1ccccc1Cn1cccn1)c1cccc(F)c1 ZINC000539333664 938843128 /nfs/dbraw/zinc/84/31/28/938843128.db2.gz BRZUIZUXBXEXMK-HSZRJFAPSA-N 0 3 408.521 4.064 20 0 HIADHN C[C@H](NCC(=O)N(Cc1ccco1)c1ccccc1)c1ccc(-n2cccn2)cc1 ZINC000539339460 938845028 /nfs/dbraw/zinc/84/50/28/938845028.db2.gz ZVXQVGZFSXVEBT-IBGZPJMESA-N 0 3 400.482 4.349 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)NCC(=O)N(C)[C@H]2CCCc3ccccc32)cc1 ZINC000539368648 938849865 /nfs/dbraw/zinc/84/98/65/938849865.db2.gz PLFHZVOESAHIDQ-KOSHJBKYSA-N 0 3 402.542 4.367 20 0 HIADHN O=C(CN[C@H](c1cccs1)C1CC1)N1c2ccccc2NC(=O)C[C@@H]1C(F)(F)F ZINC000539368994 938849921 /nfs/dbraw/zinc/84/99/21/938849921.db2.gz XMVSYOAAAUZRHT-APWZRJJASA-N 0 3 423.460 4.095 20 0 HIADHN C[C@@H](CS(=O)(=O)c1ccccc1)NCc1cccc(CN2CCCCCC2)c1 ZINC000539378244 938851458 /nfs/dbraw/zinc/85/14/58/938851458.db2.gz ZAKBLSHTYAVVRZ-FQEVSTJZSA-N 0 3 400.588 4.015 20 0 HIADHN Cc1ccc(NC(=O)NC(=O)[C@H](C)N[C@H](C)c2cccc(N3CCCC3)c2)c(C)c1 ZINC000539379312 938851731 /nfs/dbraw/zinc/85/17/31/938851731.db2.gz QBIXOHMIFRWFLO-MOPGFXCFSA-N 0 3 408.546 4.291 20 0 HIADHN CO[C@@H](c1ccccc1F)[C@H](C)NC(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000539470166 938865183 /nfs/dbraw/zinc/86/51/83/938865183.db2.gz IYPGXCZXLWFEPB-FDDCHVKYSA-N 0 3 413.537 4.208 20 0 HIADHN Cc1ccc(NC(=O)[C@@H](C)N[C@H](c2ccc3c(c2)OCCO3)C2CC2)c(Cl)c1 ZINC000539492369 938867884 /nfs/dbraw/zinc/86/78/84/938867884.db2.gz RLUZCMAHLGLZLL-SZNDQCEHSA-N 0 3 400.906 4.488 20 0 HIADHN C[C@@H](N[C@@H](c1ccc2c(c1)OCCO2)C1CC1)C(=O)Nc1ccccc1OC(F)F ZINC000539493033 938868193 /nfs/dbraw/zinc/86/81/93/938868193.db2.gz GPHDWGNQYSCZMT-ZUOKHONESA-N 0 3 418.440 4.127 20 0 HIADHN COC(=O)[C@H](C)Oc1ccc(CN[C@@H]2CCc3c2cccc3Br)cc1 ZINC000539503550 938869758 /nfs/dbraw/zinc/86/97/58/938869758.db2.gz DIFVFICIBCOOJG-ORAYPTAESA-N 0 3 404.304 4.167 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@H](C)N[C@H](C)[C@H](OC)c2ccccc2F)cc1 ZINC000539507078 938870502 /nfs/dbraw/zinc/87/05/02/938870502.db2.gz QYFYQUWLPIHNGL-JKSBSHDWSA-N 0 3 422.566 4.283 20 0 HIADHN CCc1cc(N2CCC[C@@H](N[C@H](C)c3ccc(OC)cc3Br)C2)ncn1 ZINC000539509058 938870707 /nfs/dbraw/zinc/87/07/07/938870707.db2.gz SLQVJLREVCOYLD-GDBMZVCRSA-N 0 3 419.367 4.130 20 0 HIADHN CCS(=O)(=O)c1ccc(N2CCC(N[C@@H](C)c3cccc(F)c3F)CC2)cc1 ZINC000539544587 938877386 /nfs/dbraw/zinc/87/73/86/938877386.db2.gz HZBCKTFAUBNRAE-HNNXBMFYSA-N 0 3 408.514 4.078 20 0 HIADHN Cc1cc(C(=O)N(Cc2ccco2)C2CCN(C)CC2)nn1-c1cccc(Cl)c1 ZINC000539600676 938886328 /nfs/dbraw/zinc/88/63/28/938886328.db2.gz MFPXDRLNRZAJPB-UHFFFAOYSA-N 0 3 412.921 4.164 20 0 HIADHN Cc1ncc(C(=O)N(CCN2CCCC2)Cc2ccc(Cl)c(Cl)c2)c(C)n1 ZINC000539622293 938889386 /nfs/dbraw/zinc/88/93/86/938889386.db2.gz XWEMGWQVTOFHSY-UHFFFAOYSA-N 0 3 407.345 4.138 20 0 HIADHN COCc1ccc(CN[C@@H]2CCCN(Cc3cccc(C(F)(F)F)c3)C2=O)cc1 ZINC000539634213 938891144 /nfs/dbraw/zinc/89/11/44/938891144.db2.gz RZNPBGDHWMBIQH-HXUWFJFHSA-N 0 3 406.448 4.133 20 0 HIADHN CC1CCN([C@H](CNC(=O)N2CCCC[C@H]2c2ccnn2C)c2ccccc2)CC1 ZINC000539712709 938909504 /nfs/dbraw/zinc/90/95/04/938909504.db2.gz MJUJVOKJRCQXDJ-XZOQPEGZSA-N 0 3 409.578 4.130 20 0 HIADHN CN(Cc1cc(Br)c2c(c1)OCCCO2)[C@@H](CCO)c1ccccc1 ZINC000539824619 938946891 /nfs/dbraw/zinc/94/68/91/938946891.db2.gz DVTAXVOZQIXHJR-SFHVURJKSA-N 0 3 406.320 4.166 20 0 HIADHN COc1cc(CN2CCC(c3c[nH]cn3)CC2)cc(OC)c1OCc1ccccc1 ZINC000539826073 938947636 /nfs/dbraw/zinc/94/76/36/938947636.db2.gz HSELPTJAULUKJY-UHFFFAOYSA-N 0 3 407.514 4.386 20 0 HIADHN C[C@H](c1ccc(-c2ccccc2)cc1)N(C)Cc1cnc(N2CCN(C)CC2)nc1 ZINC000539836168 938952918 /nfs/dbraw/zinc/95/29/18/938952918.db2.gz XNNRDYNEADBSHJ-HXUWFJFHSA-N 0 3 401.558 4.088 20 0 HIADHN CCCOc1ccc(CN2CCC[C@H](C(=O)N(CC)CC(F)(F)F)C2)cc1OC ZINC000539850779 938957656 /nfs/dbraw/zinc/95/76/56/938957656.db2.gz JRURWGMTQGSJBA-KRWDZBQOSA-N 0 3 416.484 4.107 20 0 HIADHN CCCN(CC(F)(F)F)C(=O)[C@H]1CCCN(Cc2ccc(OCC)c(OC)c2)C1 ZINC000539851068 938957831 /nfs/dbraw/zinc/95/78/31/938957831.db2.gz UDKATRBGIVVFHH-KRWDZBQOSA-N 0 3 416.484 4.107 20 0 HIADHN CCCOc1c(Br)cc(Br)cc1CN(C)C[C@H]1CCOC1 ZINC000539862165 938960342 /nfs/dbraw/zinc/96/03/42/938960342.db2.gz OUBMQGISBSHCDT-GFCCVEGCSA-N 0 3 421.173 4.469 20 0 HIADHN CCCOc1c(Br)cc(Br)cc1CN(C)C[C@@H]1CCOC1 ZINC000539862167 938960802 /nfs/dbraw/zinc/96/08/02/938960802.db2.gz OUBMQGISBSHCDT-LBPRGKRZSA-N 0 3 421.173 4.469 20 0 HIADHN CC(=O)N1CC[C@H](CN(C)Cc2cn(-c3ccccc3Cl)nc2C(C)(C)C)C1 ZINC000539895843 938970530 /nfs/dbraw/zinc/97/05/30/938970530.db2.gz XXMSNCXCJQKYPH-QGZVFWFLSA-N 0 3 402.970 4.123 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)N(CCN2CCCC2)Cc2ccc(Cl)c(Cl)c2)CCO1 ZINC000539903773 938974786 /nfs/dbraw/zinc/97/47/86/938974786.db2.gz JQRAQZHMXNDYKP-NVXWUHKLSA-N 0 3 414.377 4.168 20 0 HIADHN COc1cc(OC)cc(Oc2ccc(CN3CCS[C@@H]4COCC[C@@H]43)cc2)c1 ZINC000539911524 938977075 /nfs/dbraw/zinc/97/70/75/938977075.db2.gz NIDHNQVOOKICTQ-FCHUYYIVSA-N 0 3 401.528 4.202 20 0 HIADHN Brc1ccc2c(c1)[C@@H](NCc1ccccc1N1CCOCC1)CCC2 ZINC000539968949 938982366 /nfs/dbraw/zinc/98/23/66/938982366.db2.gz FFUINRHBNAAWJX-FQEVSTJZSA-N 0 3 401.348 4.453 20 0 HIADHN COCCn1ccc2ccc(NC(=O)N3CC[C@@H](C)N(Cc4ccccc4)CC3)cc21 ZINC000540001932 939034894 /nfs/dbraw/zinc/03/48/94/939034894.db2.gz JYROMUVYRNYVIA-HXUWFJFHSA-N 0 3 420.557 4.416 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)NCc2cc(Cl)sc2Cl)CC1 ZINC000540016625 939040608 /nfs/dbraw/zinc/04/06/08/939040608.db2.gz LPSCFWMORYZIEX-UHFFFAOYSA-N 0 3 402.347 4.454 20 0 HIADHN CCc1noc(C)c1C(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1 ZINC000540034529 939045235 /nfs/dbraw/zinc/04/52/35/939045235.db2.gz ZOCVGHQNIBPYEC-UHFFFAOYSA-N 0 3 418.541 4.162 20 0 HIADHN O[C@H](COC(c1ccc(F)cc1)c1ccc(F)cc1)CN(Cc1ccncc1)C1CC1 ZINC000540063280 939055788 /nfs/dbraw/zinc/05/57/88/939055788.db2.gz LAZYYPGBYQKDNA-DEOSSOPVSA-N 0 3 424.491 4.491 20 0 HIADHN CC(C)n1cnnc1[C@@H]1CCCN(Cc2ccc(C(=O)Nc3ccccc3)cc2)C1 ZINC000540065221 939056321 /nfs/dbraw/zinc/05/63/21/939056321.db2.gz PFGNRUJIKOEJRO-OAQYLSRUSA-N 0 3 403.530 4.491 20 0 HIADHN COc1cc(OC)cc(N2CC[C@@H](CN[C@H](C)c3nc4c(s3)CCCC4)C2)c1 ZINC000540084381 939064096 /nfs/dbraw/zinc/06/40/96/939064096.db2.gz BKWSTRHQKVSOQV-CVEARBPZSA-N 0 3 401.576 4.216 20 0 HIADHN Cc1cc2ncc([C@H](C)NCc3ccccc3CN(C)Cc3ccco3)c(C)n2n1 ZINC000540085831 939064525 /nfs/dbraw/zinc/06/45/25/939064525.db2.gz SXKWUHNJHPFKCY-SFHVURJKSA-N 0 3 403.530 4.422 20 0 HIADHN C[C@H](N[C@@H]1CCN(C)[C@H]1c1ccc(F)c(F)c1)c1ccc(-n2cncn2)cc1Cl ZINC000540144501 939089934 /nfs/dbraw/zinc/08/99/34/939089934.db2.gz YZOLBGQQZZYYOZ-DYXDTQHNSA-N 0 3 417.891 4.295 20 0 HIADHN CCCc1ccc([C@H](C)NCc2ccccc2CS(=O)(=O)N2CCCC2)cc1 ZINC000540144978 939090951 /nfs/dbraw/zinc/09/09/51/939090951.db2.gz VBYSDANPBCYNBR-IBGZPJMESA-N 0 3 400.588 4.416 20 0 HIADHN COc1cccc([C@H](C)NCc2ccccc2CS(=O)(=O)N2CCC(C)CC2)c1 ZINC000540150402 939092599 /nfs/dbraw/zinc/09/25/99/939092599.db2.gz GUXSKUWUBHOVIH-IBGZPJMESA-N 0 3 416.587 4.108 20 0 HIADHN COc1cccc([C@@H](C)NCc2ccccc2CS(=O)(=O)N2CCC(C)CC2)c1 ZINC000540150403 939092953 /nfs/dbraw/zinc/09/29/53/939092953.db2.gz GUXSKUWUBHOVIH-LJQANCHMSA-N 0 3 416.587 4.108 20 0 HIADHN Cc1ccc(-c2nc3c(s2)[C@@H](N[C@@H]2CCN(CC(F)(F)F)C2=O)CCC3)cc1 ZINC000540174628 939104893 /nfs/dbraw/zinc/10/48/93/939104893.db2.gz MQECGLQQRNASEG-GOEBONIOSA-N 0 3 409.477 4.249 20 0 HIADHN C[C@@H]1C[C@@H](NCc2cccc(NS(C)(=O)=O)c2)c2cccc(Br)c21 ZINC000540176393 939105481 /nfs/dbraw/zinc/10/54/81/939105481.db2.gz PCQMKPBTIVAUGJ-SJKOYZFVSA-N 0 3 409.349 4.159 20 0 HIADHN C[C@@H](CC(=O)N1CCCCCC1)NCc1cc(Br)ccc1OC(F)F ZINC000540176296 939105685 /nfs/dbraw/zinc/10/56/85/939105685.db2.gz AJZJTBJWIQVJLX-ZDUSSCGKSA-N 0 3 419.310 4.321 20 0 HIADHN COCCOc1ccc([C@H](C)NCc2cc(Br)c(OC)c(OC)c2)cc1 ZINC000540177693 939106796 /nfs/dbraw/zinc/10/67/96/939106796.db2.gz IWPBJRUSEHYSFV-AWEZNQCLSA-N 0 3 424.335 4.342 20 0 HIADHN CC[C@@H](N[C@H]1CCN(Cc2ccc(OC)cc2)C1=O)c1cccc(Br)c1 ZINC000540180790 939107531 /nfs/dbraw/zinc/10/75/31/939107531.db2.gz BSZGRHHAKAJTFE-UXHICEINSA-N 0 3 417.347 4.300 20 0 HIADHN COc1ccc(CN2CC[C@H](N[C@@H](C)c3cccc(-c4ccncc4)c3)C2=O)cc1 ZINC000540182765 939108314 /nfs/dbraw/zinc/10/83/14/939108314.db2.gz OLAMGVITVFGYLB-UUOWRZLLSA-N 0 3 401.510 4.209 20 0 HIADHN COCCc1nc(C)c([C@H](C)NCc2ccc(C(=O)N3CCCCC3)cc2)s1 ZINC000540189266 939113125 /nfs/dbraw/zinc/11/31/25/939113125.db2.gz PFSIQUIREUAKHX-INIZCTEOSA-N 0 3 401.576 4.117 20 0 HIADHN COCCc1nc(C)c([C@@H](C)NCc2ccc(C(=O)N3CCCCC3)cc2)s1 ZINC000540189267 939113353 /nfs/dbraw/zinc/11/33/53/939113353.db2.gz PFSIQUIREUAKHX-MRXNPFEDSA-N 0 3 401.576 4.117 20 0 HIADHN CCO[C@@H]1C[C@@H](NCc2ccc(OCc3cccs3)c(OC)c2)[C@@H]1n1cccn1 ZINC000563637710 945228744 /nfs/dbraw/zinc/22/87/44/945228744.db2.gz XWJPNKMEKRZGNA-QIJUGHKUSA-N 0 3 413.543 4.041 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)c2c[nH]c3cccc(Br)c23)CC1 ZINC000540219384 939134287 /nfs/dbraw/zinc/13/42/87/939134287.db2.gz LDBXXZMJJYOTJY-UHFFFAOYSA-N 0 3 416.319 4.260 20 0 HIADHN Cc1cc(C)cc(C(=O)N2CCCC[C@H]2C(=O)Nc2cc(CN(C)C)ccc2C)c1 ZINC000540221583 939136519 /nfs/dbraw/zinc/13/65/19/939136519.db2.gz IMYOBOKIWRIFOY-QHCPKHFHSA-N 0 3 407.558 4.307 20 0 HIADHN COC(=O)c1ccc([C@@H](C)N2CCCN(Cc3ccc(C(F)(F)F)cc3)CC2)o1 ZINC000540295784 939185875 /nfs/dbraw/zinc/18/58/75/939185875.db2.gz CHIGQAZREGKLLY-OAHLLOKOSA-N 0 3 410.436 4.354 20 0 HIADHN Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)N[C@@H](C)c1ccc(S(N)(=O)=O)cc1 ZINC000540300006 939187175 /nfs/dbraw/zinc/18/71/75/939187175.db2.gz GIXHOZJLTMTWMB-STQMWFEESA-N 0 3 419.547 4.317 20 0 HIADHN CO[C@H](c1ccc(Br)cc1)[C@H](C)N[C@H]1CC(=O)N(C)c2ccccc21 ZINC000540315950 939191329 /nfs/dbraw/zinc/19/13/29/939191329.db2.gz KWUBRUKFSWTWKX-ROOHIHILSA-N 0 3 403.320 4.223 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc(CN[C@@H](c2ccc(F)c(C)c2)C2CC2)cc1 ZINC000540315428 939191364 /nfs/dbraw/zinc/19/13/64/939191364.db2.gz GEXNNBOQIFNRFA-JOCHJYFZSA-N 0 3 404.551 4.406 20 0 HIADHN CC(=O)Nc1cc(S(=O)(=O)[N-]c2ccc(C[N@H+]3CCCC[C@H]3C)cc2)ccc1C ZINC000540330488 939196952 /nfs/dbraw/zinc/19/69/52/939196952.db2.gz ISNUJJWJYIKWGH-QGZVFWFLSA-N 0 3 415.559 4.129 20 0 HIADHN CC(=O)Nc1cc(S(=O)(=O)[N-]c2ccc(C[N@@H+]3CCCC[C@H]3C)cc2)ccc1C ZINC000540330488 939196953 /nfs/dbraw/zinc/19/69/53/939196953.db2.gz ISNUJJWJYIKWGH-QGZVFWFLSA-N 0 3 415.559 4.129 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)N[C@@H]2CCO[C@@H]2c2ccc(Cl)cc2)CC1 ZINC000540391686 939229622 /nfs/dbraw/zinc/22/96/22/939229622.db2.gz IQHQXSKZKVRSBI-NHCUHLMSSA-N 0 3 417.937 4.069 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)N[C@H]1CCO[C@@H]1c1ccc(Cl)cc1 ZINC000540390998 939230437 /nfs/dbraw/zinc/23/04/37/939230437.db2.gz POZFUQCHZUCJII-LEWJYISDSA-N 0 3 419.928 4.083 20 0 HIADHN O=C(CN[C@H](c1ccccc1)[C@H]1CCOC1)N[C@@H](c1cccs1)c1ccccc1 ZINC000540395210 939232560 /nfs/dbraw/zinc/23/25/60/939232560.db2.gz QZNCCAGOYXXYRI-TUACAJSNSA-N 0 3 406.551 4.321 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N[C@@H]1CCO[C@H]1c1ccc(Cl)cc1 ZINC000540397559 939233907 /nfs/dbraw/zinc/23/39/07/939233907.db2.gz LJYDRCKNWFOXBX-GGPKGHCWSA-N 0 3 419.978 4.368 20 0 HIADHN O=C(CN[C@H](c1ccccc1)[C@H]1CCOC1)N1CC=C(c2c[nH]c3ccccc32)CC1 ZINC000540398451 939234422 /nfs/dbraw/zinc/23/44/22/939234422.db2.gz QKWAWOJGDWFYHP-HFZDXXHNSA-N 0 3 415.537 4.151 20 0 HIADHN O=C(CN[C@H](c1ccc(F)cc1)C1CCCC1)NC[C@H]1CCN(c2ccccc2)C1 ZINC000540408308 939238199 /nfs/dbraw/zinc/23/81/99/939238199.db2.gz GMLLKCRDAUMBQW-CLOONOSVSA-N 0 3 409.549 4.289 20 0 HIADHN CC[C@@H](C)[C@H](NCC(=O)N1CCC(C(=O)N(C)C(C)C)CC1)c1ccc(Cl)cc1 ZINC000540411031 939238892 /nfs/dbraw/zinc/23/88/92/939238892.db2.gz JIYBGEMLWBSCCD-VGSWGCGISA-N 0 3 422.013 4.122 20 0 HIADHN CC[C@@H](N[C@@H](C)c1ccc(OC(F)(F)F)cc1)c1cccc(S(N)(=O)=O)c1 ZINC000540464240 939263390 /nfs/dbraw/zinc/26/33/90/939263390.db2.gz ONVGBVIXNJHEEK-YVEFUNNKSA-N 0 3 402.438 4.035 20 0 HIADHN O=C(CCCc1ccc2ccccc2c1)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1CO ZINC000540508674 939281104 /nfs/dbraw/zinc/28/11/04/939281104.db2.gz JSSYCHVJSJGWBS-CLJLJLNGSA-N 0 3 416.565 4.162 20 0 HIADHN CSc1ccc(C)c(NC(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)c1 ZINC000540520731 939285905 /nfs/dbraw/zinc/28/59/05/939285905.db2.gz QIDRVUYCCIUWMC-ROUUACIJSA-N 0 3 405.608 4.460 20 0 HIADHN C[C@H](N[C@@H](c1ccc(Cl)c(C(F)(F)F)c1)C1CC1)C(=O)NC[C@@H]1CCCO1 ZINC000540523266 939287640 /nfs/dbraw/zinc/28/76/40/939287640.db2.gz KJVIILWFJSWYDV-PZSREKOKSA-N 0 3 404.860 4.083 20 0 HIADHN COc1nc2ccccc2cc1CN[C@H](C)CC(=O)Nc1cccc(N2CCCC2)c1 ZINC000540593243 939313329 /nfs/dbraw/zinc/31/33/29/939313329.db2.gz DTHJTWMVIIQYSL-GOSISDBHSA-N 0 3 418.541 4.351 20 0 HIADHN CCc1c2cc(C)ccc2oc1[C@H](C)NCc1ccc([C@]2(C)NC(=O)NC2=O)cc1 ZINC000540593640 939313648 /nfs/dbraw/zinc/31/36/48/939313648.db2.gz IHKHCFWFLPFUIU-OWJWWREXSA-N 0 3 405.498 4.209 20 0 HIADHN CCCCOc1ccc(CNCc2ccccc2CS(=O)(=O)N2CCCC2)cc1 ZINC000540621824 939322354 /nfs/dbraw/zinc/32/23/54/939322354.db2.gz JGZUCYPCLXWKLN-UHFFFAOYSA-N 0 3 416.587 4.081 20 0 HIADHN C[C@H](N[C@H]1CCN(c2ccc(F)c(Cl)c2)C1=O)c1ccc(NC(=O)C2CC2)cc1 ZINC000540705578 939344477 /nfs/dbraw/zinc/34/44/77/939344477.db2.gz UXEQQVSWCWWVFR-RBZFPXEDSA-N 0 3 415.896 4.284 20 0 HIADHN Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)c1nc(-c2ccc(CN(C)C)cc2)no1 ZINC000540856772 939397078 /nfs/dbraw/zinc/39/70/78/939397078.db2.gz IOCIWJJJNXCQOC-LBPRGKRZSA-N 0 3 407.440 4.326 20 0 HIADHN Cc1ncc2c(n1)CC[C@@H](N[C@H](c1ccc3c(c1)OCCO3)c1ccccc1Cl)C2 ZINC000540916320 939416919 /nfs/dbraw/zinc/41/69/19/939416919.db2.gz STCBQTCTDDDIGJ-HOYKHHGWSA-N 0 3 421.928 4.446 20 0 HIADHN O=c1cc(CN2CCC[C@H]2/C=C/c2ccccc2)nc2ccc(Br)cn12 ZINC000540944607 939419486 /nfs/dbraw/zinc/41/94/86/939419486.db2.gz PZWVGHLQGLLHJM-RQMBKDMJSA-N 0 3 410.315 4.135 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)NCC(=O)N(Cc2ccc(C)cc2)C2CC2)cc1 ZINC000541027110 939434190 /nfs/dbraw/zinc/43/41/90/939434190.db2.gz MTKMQYAHRMMMSC-LJQANCHMSA-N 0 3 402.542 4.331 20 0 HIADHN Cc1ccnc(OC2CCN(C[C@H](O)CO[C@@H](C)c3ccc(Cl)cc3)CC2)c1 ZINC000541117522 939465852 /nfs/dbraw/zinc/46/58/52/939465852.db2.gz DGQIOVLFCIWUJJ-PXNSSMCTSA-N 0 3 404.938 4.025 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N2CCC(CCCn3ccnc3)CC2)N2CCCC2)cc1 ZINC000541185075 939484816 /nfs/dbraw/zinc/48/48/16/939484816.db2.gz SXJSEBDSBVJLPS-DEOSSOPVSA-N 0 3 423.605 4.230 20 0 HIADHN CC(=O)Nc1ccc(OC[C@H](O)CN2CCCCC[C@@H]2/C=C/c2cccs2)cc1 ZINC000541201031 939485274 /nfs/dbraw/zinc/48/52/74/939485274.db2.gz IJFHPMJZIPSEDR-PKGLBKFNSA-N 0 3 414.571 4.404 20 0 HIADHN Cc1cc(F)ccc1-n1ccc(C(=O)NC[C@@H]2CCCN(C)[C@H]2c2cccs2)n1 ZINC000541207057 939485575 /nfs/dbraw/zinc/48/55/75/939485575.db2.gz GZSAQNBVMIMXMT-HRAATJIYSA-N 0 3 412.534 4.194 20 0 HIADHN COC(=O)c1cccc(NC(=O)C[C@H](C)N[C@H](c2nc3ccccc3[nH]2)C(C)C)c1 ZINC000541217961 939486106 /nfs/dbraw/zinc/48/61/06/939486106.db2.gz IMDJVIIIGQUSMH-BTYIYWSLSA-N 0 3 408.502 4.054 20 0 HIADHN CS(=O)(=O)Cc1ccc(CN[C@@H]2CCCc3c(Br)cccc32)cc1 ZINC000541222273 939486351 /nfs/dbraw/zinc/48/63/51/939486351.db2.gz BCOWJPYIYGJWOY-LJQANCHMSA-N 0 3 408.361 4.161 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)N1CCCC[C@H]1c1ccccc1 ZINC000541320381 939490767 /nfs/dbraw/zinc/49/07/67/939490767.db2.gz WFXQLHBFHCSDIO-DEOSSOPVSA-N 0 3 407.558 4.080 20 0 HIADHN CO[C@H](c1ccccc1F)[C@@H](C)NCc1cnc2c(C)cc(Br)cn12 ZINC000541378027 939500979 /nfs/dbraw/zinc/50/09/79/939500979.db2.gz JAOTXOJRWWXUGG-ACJLOTCBSA-N 0 3 406.299 4.410 20 0 HIADHN CC1CCN([C@H](CNC(=O)N(C)CCc2ccccc2O)c2cccs2)CC1 ZINC000541444717 939517755 /nfs/dbraw/zinc/51/77/55/939517755.db2.gz JMBURYDAIDRQNV-LJQANCHMSA-N 0 3 401.576 4.111 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1cc(C)n([C@H](C)C2CC2)n1)c1cccc(OC)c1 ZINC000541462322 939524660 /nfs/dbraw/zinc/52/46/60/939524660.db2.gz HMQFAXBRONVFDP-DYESRHJHSA-N 0 3 413.566 4.376 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1cc(C)n([C@H](C)C2CC2)n1)c1cccc(OC)c1 ZINC000541462325 939524847 /nfs/dbraw/zinc/52/48/47/939524847.db2.gz HMQFAXBRONVFDP-UTKZUKDTSA-N 0 3 413.566 4.376 20 0 HIADHN Cc1cc([C@@H](NC[C@@H](c2ccc(F)cc2)N2CCOCC2)c2cccnc2)ccc1F ZINC000541550328 939552630 /nfs/dbraw/zinc/55/26/30/939552630.db2.gz RRAOVTPGKAMBND-LOSJGSFVSA-N 0 3 423.507 4.421 20 0 HIADHN Cc1ccccc1[C@@H](CN1CCOCC1)NCc1ccc(COCC(F)(F)F)cc1 ZINC000541551613 939552805 /nfs/dbraw/zinc/55/28/05/939552805.db2.gz PIRVQRLRFJYPMV-JOCHJYFZSA-N 0 3 422.491 4.237 20 0 HIADHN COc1cc(CN(C)CCc2ccccc2O)cc(Br)c1OC(F)F ZINC000541553745 939554015 /nfs/dbraw/zinc/55/40/15/939554015.db2.gz QANFGDLQJZMGGK-UHFFFAOYSA-N 0 3 416.262 4.439 20 0 HIADHN NC(=O)C[C@H](NCC(=O)Nc1ccccc1Sc1ccccc1)C1CCCCC1 ZINC000541636691 939579555 /nfs/dbraw/zinc/57/95/55/939579555.db2.gz GJIFADBUIZSKRJ-FQEVSTJZSA-N 0 3 411.571 4.190 20 0 HIADHN C[C@@H](NCC(=O)N(Cc1ccc(C(F)(F)F)cc1)C1CC1)[C@H]1COc2ccccc21 ZINC000541699230 939607900 /nfs/dbraw/zinc/60/79/00/939607900.db2.gz BTZZGUZDZAJIIB-FOIQADDNSA-N 0 3 418.459 4.351 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@H]2NCc2ccc(F)c(CN(C)C)c2)cc1 ZINC000541732209 939616265 /nfs/dbraw/zinc/61/62/65/939616265.db2.gz HWMIEEMFCQTEJJ-DHIUTWEWSA-N 0 3 418.578 4.070 20 0 HIADHN COc1ccc(C)cc1C1(CN[C@H](c2ccccc2)c2cncnc2)CCOCC1 ZINC000541743452 939619000 /nfs/dbraw/zinc/61/90/00/939619000.db2.gz QOSSUYDJXVSTFM-XMMPIXPASA-N 0 3 403.526 4.221 20 0 HIADHN Cc1nc(-c2ccc(CCN[C@H](C)CS(=O)(=O)c3ccccc3)s2)cs1 ZINC000541744929 939619386 /nfs/dbraw/zinc/61/93/86/939619386.db2.gz SAPIWGAXVRBLGL-CQSZACIVSA-N 0 3 406.598 4.175 20 0 HIADHN C[C@H](NCc1ccccc1CS(C)(=O)=O)c1ccc(OCC(F)(F)F)cc1 ZINC000563704292 945260587 /nfs/dbraw/zinc/26/05/87/945260587.db2.gz XSPZNCOXOVPRLX-AWEZNQCLSA-N 0 3 401.450 4.023 20 0 HIADHN C[C@H](CN[C@H](c1ccc(F)cc1)c1cccc(S(C)(=O)=O)c1)c1nccs1 ZINC000541767370 939625214 /nfs/dbraw/zinc/62/52/14/939625214.db2.gz YSLHIGPSCVHGKS-AUUYWEPGSA-N 0 3 404.532 4.168 20 0 HIADHN CS[C@@H]1CN(C(=O)c2csc(-c3ccc(Cl)cc3)n2)C[C@H]1N1CCCC1 ZINC000541844078 939646089 /nfs/dbraw/zinc/64/60/89/939646089.db2.gz YKWMUAKLNZBDGK-IAGOWNOFSA-N 0 3 407.992 4.115 20 0 HIADHN CC(C)[C@@H]1C[C@H](CC(=O)NC2CCN(CCOc3ccc(Cl)cc3)CC2)CCO1 ZINC000541961946 939663185 /nfs/dbraw/zinc/66/31/85/939663185.db2.gz QODHWBKHWIPAKO-GCJKJVERSA-N 0 3 422.997 4.141 20 0 HIADHN COc1ccc(NC(=O)N(CCN(C)C)C(C)C)cc1NC(=O)C1CCCCC1 ZINC000541970646 939665948 /nfs/dbraw/zinc/66/59/48/939665948.db2.gz SMPWZCYBGKOCQV-UHFFFAOYSA-N 0 3 404.555 4.018 20 0 HIADHN Cc1ccc([C@H](OC[C@@H](O)CN[C@H](CO)c2ccccc2C)c2ccccc2)cc1 ZINC000541983617 939669798 /nfs/dbraw/zinc/66/97/98/939669798.db2.gz KYRZLADFVHVMPT-SKBVVQJISA-N 0 3 405.538 4.094 20 0 HIADHN CCN1CC[C@H](NCc2c[nH]c(-c3ccccc3)n2)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000541992146 939671991 /nfs/dbraw/zinc/67/19/91/939671991.db2.gz PKEQXYFLNKBMPA-FPOVZHCZSA-N 0 3 400.448 4.419 20 0 HIADHN CS[C@@H]1CN(C(=O)c2nc(-c3ccc(Cl)c(Cl)c3)oc2C)C[C@H]1N(C)C ZINC000541991235 939672029 /nfs/dbraw/zinc/67/20/29/939672029.db2.gz IXDHLWPQOUGLTF-HUUCEWRRSA-N 0 3 414.358 4.074 20 0 HIADHN COCCNS(=O)(=O)c1cccc(CN[C@@H](c2ccccc2)C2CCCCC2)c1 ZINC000542089020 939706505 /nfs/dbraw/zinc/70/65/05/939706505.db2.gz WHLUADUDDOSWJY-QHCPKHFHSA-N 0 3 416.587 4.023 20 0 HIADHN CC(C)(C)N1CC[C@@H](NC(=O)c2[nH]nc3c2CCC3)[C@H]1c1ccc(Cl)c(F)c1 ZINC000542093662 939709491 /nfs/dbraw/zinc/70/94/91/939709491.db2.gz VGAAZYFNKWEAKU-IEBWSBKVSA-N 0 3 404.917 4.035 20 0 HIADHN C[C@H](NCc1cn(C)nc1-c1ccccc1)c1ccc(OCc2nccn2C)cc1 ZINC000542106430 939716353 /nfs/dbraw/zinc/71/63/53/939716353.db2.gz PUNCXELGVXQMSQ-SFHVURJKSA-N 0 3 401.514 4.250 20 0 HIADHN CCCc1c(NC(=O)N(CCN(C)C)Cc2cccs2)cnn1-c1ccccc1 ZINC000542116968 939719892 /nfs/dbraw/zinc/71/98/92/939719892.db2.gz DGODTXBZLQMASL-UHFFFAOYSA-N 0 3 411.575 4.482 20 0 HIADHN O=c1c2ccccc2ncn1CCN[C@@H](Cc1ccc(Cl)cc1)c1ccccn1 ZINC000542122875 939721350 /nfs/dbraw/zinc/72/13/50/939721350.db2.gz HVDAVPGCUYBWPI-QFIPXVFZSA-N 0 3 404.901 4.019 20 0 HIADHN Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)N[C@H]1CCCN(Cc2nccn2C)C1=O ZINC000542158308 939736574 /nfs/dbraw/zinc/73/65/74/939736574.db2.gz VSKYEMXZPRZLJH-LPHOPBHVSA-N 0 3 423.586 4.002 20 0 HIADHN C[C@H](N[C@H]1CCCN(Cc2nccn2C)C1=O)c1ccc(SC2CCCC2)cc1 ZINC000542159833 939737690 /nfs/dbraw/zinc/73/76/90/939737690.db2.gz DWZHYROLPHKJAA-UWJYYQICSA-N 0 3 412.603 4.297 20 0 HIADHN COC(=O)COc1ccc(CNC2(c3ccc(Br)cc3)CCC2)cc1 ZINC000542175677 939744874 /nfs/dbraw/zinc/74/48/74/939744874.db2.gz HYAVXSLMFQNJLS-UHFFFAOYSA-N 0 3 404.304 4.170 20 0 HIADHN Cc1nc2c(s1)[C@@H](N(C)C[C@@H](O)COc1ccccc1C(F)(F)F)CCC2 ZINC000542212004 939757926 /nfs/dbraw/zinc/75/79/26/939757926.db2.gz BDHQAUAQTIAWOG-CJNGLKHVSA-N 0 3 400.466 4.219 20 0 HIADHN C[C@@]1(NCC(=O)Nc2cc(C(F)(F)F)cc(C(F)(F)F)c2)CCO[C@@H]1C1CC1 ZINC000542309036 939794659 /nfs/dbraw/zinc/79/46/59/939794659.db2.gz DNXLOMTWLJQVLW-HZPDHXFCSA-N 0 3 410.358 4.210 20 0 HIADHN CC(C)CN(C(=O)[C@@H]1CCn2c(cnc2C2CCCCC2)C1)C1CCN(C)CC1 ZINC000542356427 939806697 /nfs/dbraw/zinc/80/66/97/939806697.db2.gz PERMBLUDXIGVRT-HXUWFJFHSA-N 0 3 400.611 4.072 20 0 HIADHN CC(C)Cc1ccc([C@@H](CNC(=O)Nc2ccc3c(c2)CCC(=O)N3)N(C)C)cc1 ZINC000563738535 945274490 /nfs/dbraw/zinc/27/44/90/945274490.db2.gz KVNNPCYNGHXTFA-JOCHJYFZSA-N 0 3 408.546 4.194 20 0 HIADHN COc1cc(CN2CC[C@@H](N[C@@H](c3ccc(F)cc3)c3cccnc3)C2)cc(OC)c1 ZINC000542474031 939829018 /nfs/dbraw/zinc/82/90/18/939829018.db2.gz YZLYJFPRWVEEFG-RDGATRHJSA-N 0 3 421.516 4.191 20 0 HIADHN Cc1ccccc1[C@@H](CN1CCOCC1)NCc1cccc(COCc2ccco2)c1 ZINC000542479360 939830240 /nfs/dbraw/zinc/83/02/40/939830240.db2.gz UOXUIKDTERHVKL-AREMUKBSSA-N 0 3 420.553 4.468 20 0 HIADHN C[C@@H](CN[C@H](c1ccc(F)cc1)c1cccnc1)N1CCN(c2ccccc2)CC1 ZINC000542480708 939830836 /nfs/dbraw/zinc/83/08/36/939830836.db2.gz JWJMFIAFEBIPIE-NBGIEHNGSA-N 0 3 404.533 4.110 20 0 HIADHN c1ccc(C(OCCN2CCN(CC[C@H]3CCCCO3)CC2)c2ccccc2)cc1 ZINC000542506218 939834269 /nfs/dbraw/zinc/83/42/69/939834269.db2.gz IIFXVDRBXHVZBH-RUZDIDTESA-N 0 3 408.586 4.369 20 0 HIADHN COC(=O)C[C@H](N[C@H](C)C(=O)N(c1nccs1)C1CCCCC1)C1CCCCC1 ZINC000542531106 939838617 /nfs/dbraw/zinc/83/86/17/939838617.db2.gz KAJBQFOPVYIDON-APWZRJJASA-N 0 3 421.607 4.299 20 0 HIADHN Cc1cnc([C@@H](C)CNC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)s1 ZINC000542572448 939845174 /nfs/dbraw/zinc/84/51/74/939845174.db2.gz GCAQYPIPSDETFJ-IFXJQAMLSA-N 0 3 411.493 4.126 20 0 HIADHN C[C@H](NCC(=O)Nc1ccc(Br)cc1Cl)[C@@H]1COc2ccccc21 ZINC000542621071 939849505 /nfs/dbraw/zinc/84/95/05/939849505.db2.gz WNHFBQQUOVYTNJ-FZMZJTMJSA-N 0 3 409.711 4.195 20 0 HIADHN Cc1ccc(CN(C(=O)CN(C)[C@H]2CCO[C@@H](c3ccc(F)cc3)C2)C2CC2)cc1 ZINC000542626255 939850081 /nfs/dbraw/zinc/85/00/81/939850081.db2.gz AELGUAMPCRTUQI-BJKOFHAPSA-N 0 3 410.533 4.477 20 0 HIADHN C[C@@H](NCc1cc2c(cc1Br)OCCCO2)[C@H]1COc2ccccc21 ZINC000542627885 939850140 /nfs/dbraw/zinc/85/01/40/939850140.db2.gz SCTYFEKDJTVVHY-CZUORRHYSA-N 0 3 404.304 4.265 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@@H]2N[C@H](CCCO)c2ccccc2)cc1 ZINC000542662901 939852415 /nfs/dbraw/zinc/85/24/15/939852415.db2.gz VJGPAXWYLVQPRD-XPWALMASSA-N 0 3 401.572 4.183 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@H]2N[C@@H](CCCO)c2ccccc2)cc1 ZINC000542662903 939852472 /nfs/dbraw/zinc/85/24/72/939852472.db2.gz VJGPAXWYLVQPRD-YTFSRNRJSA-N 0 3 401.572 4.183 20 0 HIADHN CCOCc1ccc(CN[C@@H]2CCCC[C@H]2S(=O)(=O)c2ccc(C)cc2)cc1 ZINC000542669558 939852898 /nfs/dbraw/zinc/85/28/98/939852898.db2.gz MGTQPBHHAKYLIU-DHIUTWEWSA-N 0 3 401.572 4.406 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@H]2CCCC[C@@H]2NCc2ccc(-n3cccn3)cc2)cc1 ZINC000542672228 939853245 /nfs/dbraw/zinc/85/32/45/939853245.db2.gz XCEVTQWCSORHGZ-GOTSBHOMSA-N 0 3 409.555 4.055 20 0 HIADHN C[C@@H]1CCN(C(=O)Nc2csc(-c3ccccn3)n2)CCN1Cc1ccccc1 ZINC000542687177 939854205 /nfs/dbraw/zinc/85/42/05/939854205.db2.gz ZKKVUWQKADMHIB-QGZVFWFLSA-N 0 3 407.543 4.333 20 0 HIADHN CCC(C)(C)OCc1ccccc1NC(=O)N1CC[C@@H](N2CCN(C(C)C)CC2)C1 ZINC000542717270 939856341 /nfs/dbraw/zinc/85/63/41/939856341.db2.gz FRCOVUQFHJKEMI-OAQYLSRUSA-N 0 3 416.610 4.024 20 0 HIADHN Cc1nn(-c2ccccc2)cc1NC(=O)N1CCCN(CCCc2ccccc2)CC1 ZINC000542836832 939862046 /nfs/dbraw/zinc/86/20/46/939862046.db2.gz WBOSUQMETASOFF-UHFFFAOYSA-N 0 3 417.557 4.353 20 0 HIADHN Cc1cc(NC(=O)N[C@@H](C)C2=CCN(C)CC2)nn1-c1ccc(Cl)c(Cl)c1 ZINC000542837835 939862126 /nfs/dbraw/zinc/86/21/26/939862126.db2.gz TTZCQEYYYUMPBQ-ZDUSSCGKSA-N 0 3 408.333 4.259 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCc1cn(C)nc1-c1ccccc1)c1ccsc1 ZINC000542968754 939888070 /nfs/dbraw/zinc/88/80/70/939888070.db2.gz ASRWEPIGUGNQQB-FQEVSTJZSA-N 0 3 411.575 4.031 20 0 HIADHN O[C@@H](CN[C@@H](Cc1ccc(Cl)cc1)c1ccccn1)COc1ccccc1F ZINC000543051764 939909430 /nfs/dbraw/zinc/90/94/30/939909430.db2.gz FTDLALQJSYYIRM-RXVVDRJESA-N 0 3 400.881 4.187 20 0 HIADHN CNS(=O)(=O)c1cccc([C@@H](C)N[C@H]2CCCc3c(Br)cccc32)c1 ZINC000543078842 939929953 /nfs/dbraw/zinc/92/99/53/939929953.db2.gz CEUBOUWZMDWYPI-YJYMSZOUSA-N 0 3 423.376 4.085 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)[C@@H]1CCn2c(cnc2C2CCCCC2)C1 ZINC000543268087 940013309 /nfs/dbraw/zinc/01/33/09/940013309.db2.gz MWNODGJRESGFAL-VWNXMTODSA-N 0 3 420.601 4.447 20 0 HIADHN Cc1cc(NC(=O)c2oc3ccccc3c2CN(C)C)ccc1-n1nnnc1C(C)C ZINC000543370205 940044495 /nfs/dbraw/zinc/04/44/95/940044495.db2.gz AMYUQCHRMHLBAI-UHFFFAOYSA-N 0 3 418.501 4.154 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1cn(C(C)(C)C)nc1C ZINC000543371643 940044840 /nfs/dbraw/zinc/04/48/40/940044840.db2.gz GECKQPKNZBDYTH-HXUWFJFHSA-N 0 3 420.561 4.151 20 0 HIADHN Cc1ccccc1-c1nn(-c2ccccc2)cc1CN1CCOCC2(CCOCC2)C1 ZINC000543393122 940050328 /nfs/dbraw/zinc/05/03/28/940050328.db2.gz WFCUQYWHFTXXME-UHFFFAOYSA-N 0 3 417.553 4.477 20 0 HIADHN COc1cc(OC)cc(N2CC[C@@H](CN[C@@H](c3ccc(F)cc3)c3cccnc3)C2)c1 ZINC000543404552 940053509 /nfs/dbraw/zinc/05/35/09/940053509.db2.gz IKRLJUSNRYDICA-BVZFJXPGSA-N 0 3 421.516 4.443 20 0 HIADHN C[C@@H](c1ccc(Cl)cc1)N1CCN(CC2CCN(C(=O)C(C)(C)C)CC2)CC1 ZINC000543444861 940065494 /nfs/dbraw/zinc/06/54/94/940065494.db2.gz AVHYNONBTUJQQQ-SFHVURJKSA-N 0 3 406.014 4.303 20 0 HIADHN COC[C@H](Cc1ccccc1)N[C@@H](CN1CCCC1=O)c1cccc(C(F)(F)F)c1 ZINC000543446611 940066081 /nfs/dbraw/zinc/06/60/81/940066081.db2.gz ISLWRYHVWPBQHB-SFTDATJTSA-N 0 3 420.475 4.216 20 0 HIADHN COc1ccc(C2(C(=O)N[C@@H]3CCN([C@@H](C)c4ccccc4)C3)CCC2)cc1OC ZINC000543470773 940074670 /nfs/dbraw/zinc/07/46/70/940074670.db2.gz LDZMDQSVLNEWJB-GHTZIAJQSA-N 0 3 408.542 4.077 20 0 HIADHN COC1CCC(CCNC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)CC1 ZINC000543494961 940083857 /nfs/dbraw/zinc/08/38/57/940083857.db2.gz AWMUMGWXUQPWCW-XTXLOEGASA-N 0 3 412.496 4.153 20 0 HIADHN COc1ccc([C@@H]2CCCCCN2C(=O)CN[C@H](C)[C@@H]2COc3ccccc32)cc1 ZINC000543556892 940108026 /nfs/dbraw/zinc/10/80/26/940108026.db2.gz YYTDBNAYHKUPHX-LEOXJPRUSA-N 0 3 408.542 4.293 20 0 HIADHN CC(C)CN(CC(F)(F)F)C(=O)CN(C)[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000543560659 940108558 /nfs/dbraw/zinc/10/85/58/940108558.db2.gz MWTOPCWMCIETDH-QZTJIDSGSA-N 0 3 404.448 4.025 20 0 HIADHN CCCCSc1ccc(Cl)cc1C(=O)N1CC[C@@H](N2CCN(C(C)C)CC2)C1 ZINC000543580472 940117993 /nfs/dbraw/zinc/11/79/93/940117993.db2.gz BWBWISDVVWIZAN-LJQANCHMSA-N 0 3 424.054 4.473 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@H](C)N[C@@H](C)c2ccc(-n3ccnc3C)cc2)cc1F ZINC000543813599 940194607 /nfs/dbraw/zinc/19/46/07/940194607.db2.gz ZLGGEAFQGPLGKW-IRXDYDNUSA-N 0 3 424.520 4.026 20 0 HIADHN CC(C)N(CCN(C)C)C(=O)Nc1ccc(CC(=O)N2CCCc3ccccc32)cc1 ZINC000543830791 940202546 /nfs/dbraw/zinc/20/25/46/940202546.db2.gz XMQKTCMGGNXZOD-UHFFFAOYSA-N 0 3 422.573 4.012 20 0 HIADHN O[C@H](COc1cccc2ccccc21)CN1CCC[C@@H](n2ccc(C(F)(F)F)n2)C1 ZINC000543873034 940219579 /nfs/dbraw/zinc/21/95/79/940219579.db2.gz LHPCRNCRZWXKKX-MSOLQXFVSA-N 0 3 419.447 4.132 20 0 HIADHN O[C@@H](CNCc1cccc(OC(F)(F)F)c1)COc1ccc(C(F)(F)F)cc1 ZINC000563826727 945306692 /nfs/dbraw/zinc/30/66/92/945306692.db2.gz FVBMMOAQWBQHDN-AWEZNQCLSA-N 0 3 409.326 4.134 20 0 HIADHN Nc1ccc(F)c(NC(=O)CCN[C@@H](Cc2ccc(Cl)cc2)c2ccccn2)c1 ZINC000543980367 940281913 /nfs/dbraw/zinc/28/19/13/940281913.db2.gz BKQBXKPWWKUBKQ-NRFANRHFSA-N 0 3 412.896 4.359 20 0 HIADHN C[C@H](C(=O)N[C@@H](C)c1ccc(Cl)cc1)N1CCC(CCCn2ccnc2)CC1 ZINC000543988691 940284679 /nfs/dbraw/zinc/28/46/79/940284679.db2.gz WTSFDLXSCLOQEH-ZWKOTPCHSA-N 0 3 402.970 4.295 20 0 HIADHN C[C@@H](C1CC1)N(Cc1ccccc1)C(=O)CN1CCC(CCCn2ccnc2)CC1 ZINC000543990134 940286368 /nfs/dbraw/zinc/28/63/68/940286368.db2.gz QNGHWQYCMQEKQW-NRFANRHFSA-N 0 3 408.590 4.203 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)CC3CCC(C(F)(F)F)CC3)CC2)C[C@H](C)O1 ZINC000544031098 940305253 /nfs/dbraw/zinc/30/52/53/940305253.db2.gz XHUCKRWPDDNFIZ-FWYSVENZSA-N 0 3 418.544 4.483 20 0 HIADHN Cc1nc(N(C)C[C@@H](C)c2nccs2)cc(N(C)C[C@@H](C)c2nccs2)n1 ZINC000544123107 940332239 /nfs/dbraw/zinc/33/22/39/940332239.db2.gz GXFHUVDVKXJFKC-ZIAGYGMSSA-N 0 3 402.593 4.178 20 0 HIADHN Cc1cc(CNCc2ccc(S(=O)(=O)N3CCCCC3)cc2)cc2cccnc12 ZINC000544183039 940346624 /nfs/dbraw/zinc/34/66/24/940346624.db2.gz DCJHCLIXWKIYQZ-UHFFFAOYSA-N 0 3 409.555 4.008 20 0 HIADHN Cc1cc(NC(=O)c2cn(C(C)(C)C)nc2C)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000544269577 940374473 /nfs/dbraw/zinc/37/44/73/940374473.db2.gz UMNMAMONBHLGBC-FQEVSTJZSA-N 0 3 420.561 4.151 20 0 HIADHN Cc1ccnn1-c1ccccc1NC(=O)N(CCN(C)C)Cc1ccc(F)c(F)c1 ZINC000544303442 940384993 /nfs/dbraw/zinc/38/49/93/940384993.db2.gz XNWVNEJXFMJIKK-UHFFFAOYSA-N 0 3 413.472 4.055 20 0 HIADHN CN(CCN(Cc1ccccc1)C(=O)Nc1ncn(C(C)(C)C)n1)Cc1ccccc1 ZINC000544314275 940387636 /nfs/dbraw/zinc/38/76/36/940387636.db2.gz MVZIMHRDJILXCZ-UHFFFAOYSA-N 0 3 420.561 4.199 20 0 HIADHN COc1cccc([C@@H]2C[C@H](C)CN2C(=O)CCCN2CCN(c3ccccc3)CC2)c1 ZINC000544319154 940388894 /nfs/dbraw/zinc/38/88/94/940388894.db2.gz PROFOMUNOWGTAG-OFVILXPXSA-N 0 3 421.585 4.207 20 0 HIADHN Fc1ccc([C@H](NCC2(CN3CCOCC3)CCCCC2)c2cccnc2)c(F)c1 ZINC000544355819 940399202 /nfs/dbraw/zinc/39/92/02/940399202.db2.gz PFNRWXZCNUUQHI-HSZRJFAPSA-N 0 3 415.528 4.322 20 0 HIADHN CC(C)([C@@H](NC(=O)Cn1ncc2ccccc21)c1ccc(F)c(F)c1)N1CCCC1 ZINC000544358327 940399472 /nfs/dbraw/zinc/39/94/72/940399472.db2.gz PFGMFXZRWGTGJN-QFIPXVFZSA-N 0 3 412.484 4.046 20 0 HIADHN Cn1cc(N2CCC[C@H](N[C@@H](c3ccc(F)cc3)c3cnc4ccccc4c3)C2)cn1 ZINC000544359260 940400672 /nfs/dbraw/zinc/40/06/72/940400672.db2.gz HMHMGIQQKZRFOW-DHLKQENFSA-N 0 3 415.516 4.455 20 0 HIADHN CCc1ccc([C@H](CN2CCOCC2)NCc2ccc(OC(F)F)c(OC)c2)cc1 ZINC000544361691 940401780 /nfs/dbraw/zinc/40/17/80/940401780.db2.gz WWUDGFPCXQNVDJ-FQEVSTJZSA-N 0 3 420.500 4.022 20 0 HIADHN NC(=O)C1CCN(C[C@@H](NCc2ccccc2Cl)c2ccc(Cl)cc2)CC1 ZINC000544362899 940402121 /nfs/dbraw/zinc/40/21/21/940402121.db2.gz QPTRKATVWNMZQP-HXUWFJFHSA-N 0 3 406.357 4.022 20 0 HIADHN O=C(c1ccccc1F)N1CCC(N[C@H](c2ccccc2)c2ccc(F)cn2)CC1 ZINC000544368299 940403766 /nfs/dbraw/zinc/40/37/66/940403766.db2.gz QFSAEQIASCZXNG-HSZRJFAPSA-N 0 3 407.464 4.344 20 0 HIADHN O=C(Cc1nc(-c2ccc(F)cc2)cs1)NCCCN1CCc2ccccc2C1 ZINC000544372702 940404858 /nfs/dbraw/zinc/40/48/58/940404858.db2.gz MGKDKOVCHNPXLZ-UHFFFAOYSA-N 0 3 409.530 4.056 20 0 HIADHN COc1ccc(C(=O)C[C@H](C)C(=O)N[C@H]2CCN(Cc3ccccc3)[C@H](C)C2)cc1 ZINC000544378497 940406424 /nfs/dbraw/zinc/40/64/24/940406424.db2.gz ZRHKTHCZHORHGW-JQVVWYNYSA-N 0 3 408.542 4.073 20 0 HIADHN COc1ccc(OC)c([C@H]2CCCN2C(=O)CN[C@@H](c2cccs2)C2CC2)c1 ZINC000544399373 940412440 /nfs/dbraw/zinc/41/24/40/940412440.db2.gz BRCZNISJZYJUOB-XMSQKQJNSA-N 0 3 400.544 4.170 20 0 HIADHN COCc1ccccc1CNC(=O)CN[C@H](Cc1ccccc1)c1sccc1C ZINC000544416390 940417915 /nfs/dbraw/zinc/41/79/15/940417915.db2.gz YDEXHNFFMKVXSF-JOCHJYFZSA-N 0 3 408.567 4.393 20 0 HIADHN CCc1cnccc1[C@@H](C)NC[C@H](NS(=O)(=O)c1ccc(C)cc1)c1ccccc1 ZINC000544451709 940436247 /nfs/dbraw/zinc/43/62/47/940436247.db2.gz QDAINYNQPVMNIE-DVECYGJZSA-N 0 3 423.582 4.323 20 0 HIADHN CC(C)N1CC[C@H](N[C@@H](C)C(=O)N2CCc3ccccc32)[C@H]1c1ccc(F)c(F)c1 ZINC000563901086 945320749 /nfs/dbraw/zinc/32/07/49/945320749.db2.gz QABVMMNXEXAHAK-JFJYTDJESA-N 0 3 413.512 4.056 20 0 HIADHN Cc1nn(Cc2ccccc2)c2sc(C(=O)N3CCN(C4CCC4)C[C@H](C)C3)cc12 ZINC000563906319 945322545 /nfs/dbraw/zinc/32/25/45/945322545.db2.gz NGMQMLIFRFGMDU-KRWDZBQOSA-N 0 3 422.598 4.401 20 0 HIADHN CCCOc1cccc(CNC(=O)CN(C)[C@H]2CCO[C@H](c3ccc(F)cc3)C2)c1 ZINC000544530971 940473262 /nfs/dbraw/zinc/47/32/62/940473262.db2.gz XVVLQHYFKPBGBE-GMAHTHKFSA-N 0 3 414.521 4.083 20 0 HIADHN CCC[C@H](NCc1ccc(S(=O)(=O)N2CCC[C@H](C)C2)cc1)c1cccnc1 ZINC000544580333 940483995 /nfs/dbraw/zinc/48/39/95/940483995.db2.gz RBPUONQPHZUZHN-AVRDEDQJSA-N 0 3 401.576 4.133 20 0 HIADHN O[C@@H](CNCc1cc(F)cc(F)c1)COC(c1ccc(F)cc1)c1ccc(F)cc1 ZINC000563920436 945326020 /nfs/dbraw/zinc/32/60/20/945326020.db2.gz CNOLEDFAKKEKQR-QFIPXVFZSA-N 0 3 419.418 4.500 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)N[C@H]2CCO[C@H](c3ccc(F)cc3)C2)c1 ZINC000544651861 940498847 /nfs/dbraw/zinc/49/88/47/940498847.db2.gz KXNKBNVCTKVBBY-GOTSBHOMSA-N 0 3 413.537 4.128 20 0 HIADHN C[C@H](CNC(=O)N(CCN(C)C)Cc1ccc(C(F)(F)F)cc1)c1nccs1 ZINC000544688048 940502628 /nfs/dbraw/zinc/50/26/28/940502628.db2.gz OPKUSQXXRVBGTM-CQSZACIVSA-N 0 3 414.497 4.039 20 0 HIADHN CN(C)C(=O)COc1cccc(CN[C@@H](Cc2cccnc2)c2ccc(Cl)cc2)c1 ZINC000544827471 940517777 /nfs/dbraw/zinc/51/77/77/940517777.db2.gz MNRQPWBAPFUZCG-QHCPKHFHSA-N 0 3 423.944 4.276 20 0 HIADHN CCNC(=O)COc1cccc(CN[C@@H](Cc2cccnc2)c2ccc(Cl)cc2)c1 ZINC000544827815 940517871 /nfs/dbraw/zinc/51/78/71/940517871.db2.gz ORPQWGQXBBBXCY-QHCPKHFHSA-N 0 3 423.944 4.324 20 0 HIADHN CCN(C(=O)c1ccc(Cn2nc(C)cc2C)cc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000544848317 940518984 /nfs/dbraw/zinc/51/89/84/940518984.db2.gz RSMKPFKEZYDXIS-VWLOTQADSA-N 0 3 416.569 4.285 20 0 HIADHN CCCc1c(NC(=O)NC[C@H](c2ccc(C)cc2)N(C)C)cnn1-c1cc(C)ccn1 ZINC000544886706 940521825 /nfs/dbraw/zinc/52/18/25/940521825.db2.gz IDFNWXVMEIPCQS-JOCHJYFZSA-N 0 3 420.561 4.261 20 0 HIADHN CN1CCN(c2ncccc2CN[C@H](Cc2ccc(F)cc2)c2ccccc2)CC1 ZINC000563933985 945329408 /nfs/dbraw/zinc/32/94/08/945329408.db2.gz AUPAVUUKHQXCTR-XMMPIXPASA-N 0 3 404.533 4.046 20 0 HIADHN COc1ccc2[nH]c3c(c2c1)C[C@H](N[C@@H](c1nc(-c2ccncc2)no1)C(C)C)CC3 ZINC000545191334 940555205 /nfs/dbraw/zinc/55/52/05/940555205.db2.gz RBQLRAZEBQEWRE-OPAMFIHVSA-N 0 3 417.513 4.466 20 0 HIADHN O=C(c1cccc(CN[C@@H](c2cccc(C(F)(F)F)c2)C2CC2)c1)N1CCOCC1 ZINC000545279204 940559973 /nfs/dbraw/zinc/55/99/73/940559973.db2.gz LDIGPEXHIYDWRM-OAQYLSRUSA-N 0 3 418.459 4.419 20 0 HIADHN COc1ccc(C2(C(=O)N[C@@H](CN(C)Cc3ccccc3)C(C)C)CCOCC2)cc1 ZINC000545307012 940561086 /nfs/dbraw/zinc/56/10/86/940561086.db2.gz JUBZTTXLKXYYJU-DEOSSOPVSA-N 0 3 424.585 4.016 20 0 HIADHN CN(C)CCN(CC1CCCCC1)C(=O)N[C@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000545340291 940562893 /nfs/dbraw/zinc/56/28/93/940562893.db2.gz DTHGDCFTOWHFFR-FCHUYYIVSA-N 0 3 405.558 4.199 20 0 HIADHN Cc1ccc(S(=O)(=O)N[C@H](CNC(C)(C)c2ccc(C)nc2)c2ccccc2)cc1 ZINC000545398510 940568317 /nfs/dbraw/zinc/56/83/17/940568317.db2.gz QNDYYUGOMBQLDM-HSZRJFAPSA-N 0 3 423.582 4.243 20 0 HIADHN CS[C@H]1CN(C(=O)Nc2ccc(OCc3cccc(F)c3)cc2C)C[C@H]1N(C)C ZINC000545423862 940569173 /nfs/dbraw/zinc/56/91/73/940569173.db2.gz RWIJWKWQHSRWAA-RTWAWAEBSA-N 0 3 417.550 4.222 20 0 HIADHN CS[C@@H]1CN(C(=O)Nc2ccc(OCc3cccc(F)c3)cc2C)C[C@H]1N(C)C ZINC000545423860 940569196 /nfs/dbraw/zinc/56/91/96/940569196.db2.gz RWIJWKWQHSRWAA-NHCUHLMSSA-N 0 3 417.550 4.222 20 0 HIADHN CCN(C(=O)c1csc(Cc2ccccc2)n1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000545475965 940571374 /nfs/dbraw/zinc/57/13/74/940571374.db2.gz VXTDUZKIYGPDFM-OAQYLSRUSA-N 0 3 405.567 4.471 20 0 HIADHN Cc1cccc(C)c1[C@H](C)NCC(=O)Nc1ccccc1I ZINC000545518353 940572871 /nfs/dbraw/zinc/57/28/71/940572871.db2.gz IUSJYYAOKBOMJL-AWEZNQCLSA-N 0 3 408.283 4.197 20 0 HIADHN CCN(CCC1CC1)CC(=O)N(Cc1nnc(-c2ccccc2Cl)o1)C1CC1 ZINC000545519895 940572935 /nfs/dbraw/zinc/57/29/35/940572935.db2.gz SENYOJUJRBTWSQ-UHFFFAOYSA-N 0 3 402.926 4.003 20 0 HIADHN C[C@H](NCC(=O)NCC1(c2ccccc2)CCOCC1)c1ccc2c(c1)CCCC2 ZINC000545520794 940572947 /nfs/dbraw/zinc/57/29/47/940572947.db2.gz ZRYSYXNIXKQYTH-FQEVSTJZSA-N 0 3 406.570 4.081 20 0 HIADHN Cn1ccc(CCN[C@@H](Cc2ccccc2F)c2ccccc2Br)n1 ZINC000545520423 940572977 /nfs/dbraw/zinc/57/29/77/940572977.db2.gz GIVSZMZVIGUZCC-FQEVSTJZSA-N 0 3 402.311 4.438 20 0 HIADHN Cn1ccc(CCN[C@H](Cc2ccccc2F)c2ccccc2Br)n1 ZINC000545520424 940572996 /nfs/dbraw/zinc/57/29/96/940572996.db2.gz GIVSZMZVIGUZCC-HXUWFJFHSA-N 0 3 402.311 4.438 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(CCCCCc4cccs4)n3)cn2)CC1 ZINC000545650118 940578897 /nfs/dbraw/zinc/57/88/97/940578897.db2.gz RPGGMUDZCJANRX-UHFFFAOYSA-N 0 3 411.575 4.291 20 0 HIADHN C(=C\c1ccc(OCc2cccnc2)cc1)\c1nc(CC2=N[C@@H]3CCCC[C@H]3N2)no1 ZINC000545845740 940629590 /nfs/dbraw/zinc/62/95/90/940629590.db2.gz HBVNKOUBSMNKEF-NHNJRYNSSA-N 0 3 415.497 4.069 20 0 HIADHN COc1ccc2[nH]c3c(c2c1)C[C@H](Nc1ccccc1CN1CCC(O)CC1)CC3 ZINC000545896942 940654504 /nfs/dbraw/zinc/65/45/04/940654504.db2.gz HRSZOVZXLLHZMN-GOSISDBHSA-N 0 3 405.542 4.103 20 0 HIADHN FC(F)(F)c1cnc(NCCNCc2cncc(Br)c2)c(Cl)c1 ZINC000545926263 940659220 /nfs/dbraw/zinc/65/92/20/940659220.db2.gz ZBWKWVQDCKPRLR-UHFFFAOYSA-N 0 3 409.637 4.113 20 0 HIADHN CCc1nnc(C)cc1C(=O)NC[C@H](c1ccc(C(F)(F)F)cc1)N(CC)CC ZINC000546101091 940699239 /nfs/dbraw/zinc/69/92/39/940699239.db2.gz KUJCWBCMKXSNJX-LJQANCHMSA-N 0 3 408.468 4.179 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)c3scnc3C3CCCC3)CC2)C[C@H](C)O1 ZINC000546146756 940712624 /nfs/dbraw/zinc/71/26/24/940712624.db2.gz VCQCYHWKJMUSCH-IRXDYDNUSA-N 0 3 405.608 4.152 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)NCc1nc2ccccc2n1C1CC1 ZINC000546155647 940716419 /nfs/dbraw/zinc/71/64/19/940716419.db2.gz NXBORRUVFOEESN-LJQANCHMSA-N 0 3 417.557 4.177 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](NCCC[C@H]2CCCCO2)c2ccc(F)cc2)c1 ZINC000546165891 940719177 /nfs/dbraw/zinc/71/91/77/940719177.db2.gz HAXXXJQEULSZRA-IRLDBZIGSA-N 0 3 405.535 4.258 20 0 HIADHN Cc1nn(-c2ccccc2)c(Oc2ccc(F)cc2)c1CNCCc1ccn(C)n1 ZINC000546176829 940721856 /nfs/dbraw/zinc/72/18/56/940721856.db2.gz IABNFDZEYYDASX-UHFFFAOYSA-N 0 3 405.477 4.178 20 0 HIADHN CCN(C(=O)c1cccc(COC2CCOCC2)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000546185138 940723894 /nfs/dbraw/zinc/72/38/94/940723894.db2.gz ZTTBOPIUZUGJFY-DEOSSOPVSA-N 0 3 422.569 4.119 20 0 HIADHN CCN(Cc1nc2c3ccccc3oc2c(=O)[n-]1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000546224767 940735134 /nfs/dbraw/zinc/73/51/34/940735134.db2.gz MZUUVRZNSJTSFR-GOSISDBHSA-N 0 3 402.498 4.178 20 0 HIADHN CCN(Cc1nc2c3ccccc3oc2c(=O)[n-]1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000546224767 940735138 /nfs/dbraw/zinc/73/51/38/940735138.db2.gz MZUUVRZNSJTSFR-GOSISDBHSA-N 0 3 402.498 4.178 20 0 HIADHN Fc1cccc(CN2CCC[C@@H](c3nc(-c4ccc(N5CCCC5)cn4)no3)C2)c1 ZINC000546500331 940837645 /nfs/dbraw/zinc/83/76/45/940837645.db2.gz FXMDQIPMZGQPLS-GOSISDBHSA-N 0 3 407.493 4.251 20 0 HIADHN Fc1cccc(CN2CCC[C@H](c3nc(-c4cccc(OCC(F)F)n4)no3)C2)c1 ZINC000546555092 940851603 /nfs/dbraw/zinc/85/16/03/940851603.db2.gz FRWXZZQWOOUQMX-HNNXBMFYSA-N 0 3 418.419 4.294 20 0 HIADHN CCN(C(=O)c1cc(C)n(Cc2ccncc2)c1C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000546556567 940851977 /nfs/dbraw/zinc/85/19/77/940851977.db2.gz YAZNKQRPHDIHAR-XMMPIXPASA-N 0 3 416.569 4.285 20 0 HIADHN Cc1cc(C(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)c(C)n1Cc1ccncc1 ZINC000546571416 940855832 /nfs/dbraw/zinc/85/58/32/940855832.db2.gz KOLYGFLVAMFMGN-VWLOTQADSA-N 0 3 416.569 4.424 20 0 HIADHN CC(C)(CS(C)(=O)=O)NCc1ccc(-c2ccc(Br)cc2)s1 ZINC000546582598 940857487 /nfs/dbraw/zinc/85/74/87/940857487.db2.gz LYJQSKFVRFEDMI-UHFFFAOYSA-N 0 3 402.379 4.090 20 0 HIADHN Cn1cc(C(C)(C)NC[C@H](O)COc2ccc(C(C)(C)c3ccccc3)cc2)cn1 ZINC000546705161 940871124 /nfs/dbraw/zinc/87/11/24/940871124.db2.gz MXHAJFHVGIKWHY-QFIPXVFZSA-N 0 3 407.558 4.011 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)NCc2nc3ccccc3n2C2CC2)C1 ZINC000546763162 940878477 /nfs/dbraw/zinc/87/84/77/940878477.db2.gz ZNPMGZYXGIPCCP-PKOBYXMFSA-N 0 3 403.530 4.006 20 0 HIADHN CN(Cc1ccccc1)Cc1cccc(-c2nc(CCCn3ccccc3=O)no2)c1 ZINC000547096723 940994260 /nfs/dbraw/zinc/99/42/60/940994260.db2.gz JQOYYISKJWQHHP-UHFFFAOYSA-N 0 3 414.509 4.163 20 0 HIADHN CC(C)NC(=O)Nc1cccc(-c2noc([C@@H]3CCCN(Cc4cccnc4)C3)n2)c1 ZINC000547116713 941002612 /nfs/dbraw/zinc/00/26/12/941002612.db2.gz QZGGOYFLOUYJAD-LJQANCHMSA-N 0 3 420.517 4.041 20 0 HIADHN COCCCOc1cc(C)ccc1-c1noc([C@@H]2CCCN(Cc3cccnc3)C2)n1 ZINC000547167048 941018451 /nfs/dbraw/zinc/01/84/51/941018451.db2.gz IIIUNFCEFRYQKU-HXUWFJFHSA-N 0 3 422.529 4.235 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)NC2CC(OCc3ccccc3)C2)CC1 ZINC000547358236 941058133 /nfs/dbraw/zinc/05/81/33/941058133.db2.gz OQHFSSBILJVOPS-UHFFFAOYSA-N 0 3 407.558 4.040 20 0 HIADHN CC(C)(CNC(=O)[C@H]1CCCN(Cc2cccnc2)C1)c1cccc(Cl)c1F ZINC000547426026 941062043 /nfs/dbraw/zinc/06/20/43/941062043.db2.gz AAQRTKCKFQGKQL-KRWDZBQOSA-N 0 3 403.929 4.180 20 0 HIADHN CCN(C(=O)NCc1ccccc1COC(C)C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000547465933 941064228 /nfs/dbraw/zinc/06/42/28/941064228.db2.gz ARRRUXRQRQUNGP-XMMPIXPASA-N 0 3 409.574 4.418 20 0 HIADHN COc1ccc(-c2ccncc2)cc1CNc1ccc(CN2CCN(C)CC2)cc1 ZINC000547499586 941065744 /nfs/dbraw/zinc/06/57/44/941065744.db2.gz JVQRARRVUHIXTD-UHFFFAOYSA-N 0 3 402.542 4.117 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CCO[C@@H](c2ccc(F)cc2F)C1)c1ccsc1 ZINC000547628976 941069318 /nfs/dbraw/zinc/06/93/18/941069318.db2.gz JLHDJUCQUSUQES-VQTJNVASSA-N 0 3 423.529 4.192 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1ccc(C#N)c(Cl)c1 ZINC000547636080 941069745 /nfs/dbraw/zinc/06/97/45/941069745.db2.gz AOCXIEPVDJNVHR-HXUWFJFHSA-N 0 3 419.916 4.416 20 0 HIADHN CCO[C@H](C)c1noc(CN2CCN(CC3CCC(c4ccccc4)CC3)CC2)n1 ZINC000548066076 941085155 /nfs/dbraw/zinc/08/51/55/941085155.db2.gz ALSHWKMYPJCCSN-VRKFHHGPSA-N 0 3 412.578 4.259 20 0 HIADHN CN1CCN(CCCSc2ncnc3scc(-c4ccc(F)cc4)c32)CC1 ZINC000548149027 941088760 /nfs/dbraw/zinc/08/87/60/941088760.db2.gz UGHGPZXMLGYAFC-UHFFFAOYSA-N 0 3 402.564 4.227 20 0 HIADHN COc1cccc([C@@H](CNC(=O)N[C@@H](C(C)(C)C)C(F)(F)F)N2CCCC2)c1 ZINC000548181044 941091126 /nfs/dbraw/zinc/09/11/26/941091126.db2.gz MUPYJISAJBTCIF-SJORKVTESA-N 0 3 401.473 4.108 20 0 HIADHN Cc1cccc2nc(C3CCN(C(=O)[C@@H]4CCCN(Cc5cccnc5)C4)CC3)oc21 ZINC000548385762 941098951 /nfs/dbraw/zinc/09/89/51/941098951.db2.gz HDABKHNPMALQBJ-OAQYLSRUSA-N 0 3 418.541 4.149 20 0 HIADHN O=C(N[C@@H](c1ccccc1)C(F)(F)F)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000548723305 941121579 /nfs/dbraw/zinc/12/15/79/941121579.db2.gz PYQXHLNNJDNBDJ-GPANFISMSA-N 0 3 423.401 4.395 20 0 HIADHN CCn1c(CNC2CCN(Cc3coc(-c4ccccc4)n3)CC2)nc2ccccc21 ZINC000548832583 941125993 /nfs/dbraw/zinc/12/59/93/941125993.db2.gz BFUXNUNDTCWAJG-UHFFFAOYSA-N 0 3 415.541 4.465 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](N[C@@H]2CCC23CCOCC3)c2ccc(Cl)cc2)c1 ZINC000548858642 941126943 /nfs/dbraw/zinc/12/69/43/941126943.db2.gz VUXWNVSAVGOQBQ-RTWAWAEBSA-N 0 3 419.974 4.382 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCC2(CCO2)CC1)c1ccc(C(F)(F)F)cc1 ZINC000548901380 941128317 /nfs/dbraw/zinc/12/83/17/941128317.db2.gz BHMHZHDIYCITNT-GOSISDBHSA-N 0 3 413.484 4.053 20 0 HIADHN CCc1nc2cc(CNC(=O)N[C@@H]3CCN(C)[C@H]3c3ccccc3)ccc2n1C1CC1 ZINC000548969948 941135923 /nfs/dbraw/zinc/13/59/23/941135923.db2.gz LZVAVXFETCKKOD-YKSBVNFPSA-N 0 3 417.557 4.178 20 0 HIADHN CCN1C(=O)CCc2cc(NC(=O)N[C@H](CN(C)C)c3ccc(Cl)cc3)ccc21 ZINC000548977175 941137740 /nfs/dbraw/zinc/13/77/40/941137740.db2.gz QTFPYXXNMXKSGE-LJQANCHMSA-N 0 3 414.937 4.064 20 0 HIADHN CCN(C(=O)Nc1cn(Cc2ccccc2)nn1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000548983311 941138588 /nfs/dbraw/zinc/13/85/88/941138588.db2.gz ADGZAZLIXYJOFD-DENIHFKCSA-N 0 3 418.545 4.016 20 0 HIADHN COc1cc(CN[C@@H](CN(C)C)c2ccc(Cl)cc2)cc(Br)c1O ZINC000548991209 941139762 /nfs/dbraw/zinc/13/97/62/941139762.db2.gz DMJHAUCLSOACOJ-INIZCTEOSA-N 0 3 413.743 4.209 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2ccc(NC(=O)CC(F)(F)F)cc2)[C@@H]1c1ccccc1 ZINC000549063266 941151153 /nfs/dbraw/zinc/15/11/53/941151153.db2.gz JTKZZKGEUPCLNN-MJGOQNOKSA-N 0 3 420.435 4.144 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2ccc(NC(=O)CC(F)(F)F)cc2)[C@@H]1c1ccccc1 ZINC000549063263 941151329 /nfs/dbraw/zinc/15/13/29/941151329.db2.gz JTKZZKGEUPCLNN-HKUYNNGSSA-N 0 3 420.435 4.144 20 0 HIADHN O=C(c1ccc(C[NH+]2CCCC2)cc1)N1CCC[C@@H](c2nnc(C3CCCCC3)[n-]2)C1 ZINC000549086326 941155316 /nfs/dbraw/zinc/15/53/16/941155316.db2.gz KVYLUQRUZNUBNB-JOCHJYFZSA-N 0 3 421.589 4.468 20 0 HIADHN CCc1ccccc1NC(=O)[C@H](C)N[C@H]1CCN(C2CC2)[C@H]1c1cccc(OC)c1 ZINC000549118400 941161900 /nfs/dbraw/zinc/16/19/00/941161900.db2.gz HTYBGQGXIJUNRO-DPSWKAHMSA-N 0 3 407.558 4.152 20 0 HIADHN CCOc1c(Cl)cc(CNC[C@@H](O)COc2c(C)ccc(C)c2C)cc1OC ZINC000549151689 941166004 /nfs/dbraw/zinc/16/60/04/941166004.db2.gz BTSIPGQFFLCZAV-GOSISDBHSA-N 0 3 407.938 4.202 20 0 HIADHN Cc1nc(-c2ccc(C)c(NC(=O)N[C@@H](CN(C)C)c3ccc(Cl)cc3)c2)n[nH]1 ZINC000549216189 941171583 /nfs/dbraw/zinc/17/15/83/941171583.db2.gz GFCPDULGZUZTDI-IBGZPJMESA-N 0 3 412.925 4.166 20 0 HIADHN COc1cc2c(cc1F)CC[C@@H]2NC(=O)N(CCCc1ccccc1)CCN(C)C ZINC000549236957 941173102 /nfs/dbraw/zinc/17/31/02/941173102.db2.gz RCKZGXXPPVQPPI-QFIPXVFZSA-N 0 3 413.537 4.028 20 0 HIADHN Cc1ccc(CNCc2cccc(NC(=O)c3ccccn3)c2)c(-c2cnn(C)c2)c1 ZINC000549241143 941173336 /nfs/dbraw/zinc/17/33/36/941173336.db2.gz NTXRPBLXNVPLBX-UHFFFAOYSA-N 0 3 411.509 4.333 20 0 HIADHN Cc1cn(-c2c(F)cccc2F)nc1C(=O)N[C@@H](CN(C)C)c1ccc(Cl)cc1 ZINC000549242307 941173430 /nfs/dbraw/zinc/17/34/30/941173430.db2.gz VPDBYTHJYQCKCX-SFHVURJKSA-N 0 3 418.875 4.145 20 0 HIADHN Cc1cc(Br)cn2c(CN[C@@H](CN(C)C)c3ccc(Cl)cc3)cnc12 ZINC000549266687 941175467 /nfs/dbraw/zinc/17/54/67/941175467.db2.gz CVUCCDGKRUCFKR-SFHVURJKSA-N 0 3 421.770 4.451 20 0 HIADHN COCc1ccc(CNC(=O)CN[C@@H](c2cccc(C(F)(F)F)c2)C2CC2)cc1 ZINC000549408518 941186977 /nfs/dbraw/zinc/18/69/77/941186977.db2.gz GNVWMHMFERXUAB-OAQYLSRUSA-N 0 3 406.448 4.209 20 0 HIADHN COc1ccc(CN(Cc2ccc(-n3cncn3)c(F)c2)[C@H](C)C2CC2)c(OC)c1 ZINC000549423770 941188493 /nfs/dbraw/zinc/18/84/93/941188493.db2.gz JURQSJNRLAPBAS-MRXNPFEDSA-N 0 3 410.493 4.224 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)c1cc(Cl)c(F)cc1Cl ZINC000549455488 941191893 /nfs/dbraw/zinc/19/18/93/941191893.db2.gz MZMHJIGTGFKLFJ-UHFFFAOYSA-N 0 3 424.347 4.465 20 0 HIADHN CCN1CC[C@@H](NCc2ccc(C(F)(F)F)cn2)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000549471667 941193408 /nfs/dbraw/zinc/19/34/08/941193408.db2.gz OADSEVGPRQAEIY-AEFFLSMTSA-N 0 3 403.370 4.443 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@H](NCc2ccnc(OCC(F)(F)F)c2)c2ccccc21 ZINC000549523791 941198065 /nfs/dbraw/zinc/19/80/65/941198065.db2.gz LNBJDMULYNQOTF-MSOLQXFVSA-N 0 3 408.420 4.294 20 0 HIADHN C[C@H](c1ccc(F)cc1)N1CC[C@H](N2CCC(c3c[nH]c4ncccc34)CC2)C1=O ZINC000549526846 941198090 /nfs/dbraw/zinc/19/80/90/941198090.db2.gz ATIQIZVBMKOZSQ-ZHRRBRCNSA-N 0 3 406.505 4.244 20 0 HIADHN CN(C)C[C@H](NC(=O)c1cc(COc2ccccc2F)on1)c1ccc(Cl)cc1 ZINC000549617424 941201516 /nfs/dbraw/zinc/20/15/16/941201516.db2.gz NJNGRYFOFHPGBI-IBGZPJMESA-N 0 3 417.868 4.079 20 0 HIADHN CN(C)[C@@H](CNC(=O)Nc1ccc(-c2noc(C(F)F)n2)cc1)c1ccccc1 ZINC000550196222 941296831 /nfs/dbraw/zinc/29/68/31/941296831.db2.gz AQIGIMBOSIWYCJ-INIZCTEOSA-N 0 3 401.417 4.099 20 0 HIADHN Cc1ccccc1C(C)(C)NCC(=O)N1c2ccccc2NC(=O)C[C@@H]1C(F)(F)F ZINC000550263507 941305613 /nfs/dbraw/zinc/30/56/13/941305613.db2.gz PFMSDIRHXHAUOC-GOSISDBHSA-N 0 3 419.447 4.126 20 0 HIADHN CCO[C@@H]1C[C@H](NCc2cn(-c3ccccc3)nc2-c2cccs2)[C@H]1n1cccn1 ZINC000550325514 941315051 /nfs/dbraw/zinc/31/50/51/941315051.db2.gz GVPUCGCRHIRFII-MIZPHKNDSA-N 0 3 419.554 4.306 20 0 HIADHN CC(C)(C)N1C[C@@H](C(=O)Nc2nc3cc(F)c(F)cc3s2)[C@H](C(F)(F)F)C1 ZINC000550368761 941319091 /nfs/dbraw/zinc/31/90/91/941319091.db2.gz BOGYCRXOQLNERA-RKDXNWHRSA-N 0 3 407.408 4.422 20 0 HIADHN Fc1cc(Br)cc2c1CC[C@H]2NCc1cccc(N2CCOCC2)c1 ZINC000550857696 941374982 /nfs/dbraw/zinc/37/49/82/941374982.db2.gz WHSVCJFVRPDUKV-HXUWFJFHSA-N 0 3 405.311 4.202 20 0 HIADHN CC[C@H](N[C@H]1CCCN([C@H](C)c2ccccc2F)C1=O)c1ccc2c(c1)OCCO2 ZINC000550860518 941375513 /nfs/dbraw/zinc/37/55/13/941375513.db2.gz KULLQLKOTAIAGZ-CZAAIQMYSA-N 0 3 412.505 4.390 20 0 HIADHN O=C(Nc1ccc(Oc2cccnc2)nc1)N[C@H](CN1CCCC1)c1ccccc1 ZINC000551028099 941397828 /nfs/dbraw/zinc/39/78/28/941397828.db2.gz RLUHIKYYTINUCR-OAQYLSRUSA-N 0 3 403.486 4.228 20 0 HIADHN Cc1ccc(-c2n[nH]cc2CNc2ccc(C(=O)N(C)[C@H]3CCCN(C)C3)cc2)cc1 ZINC000551091472 941407863 /nfs/dbraw/zinc/40/78/63/941407863.db2.gz LWIQHEIZGBXOQU-QHCPKHFHSA-N 0 3 417.557 4.163 20 0 HIADHN C[C@@H](NCc1coc2ccccc12)c1ccc(S(=O)(=O)NCc2ccco2)cc1 ZINC000551208703 941427915 /nfs/dbraw/zinc/42/79/15/941427915.db2.gz RRCMDOIVHVSNIR-MRXNPFEDSA-N 0 3 410.495 4.355 20 0 HIADHN CC1CCN([C@@H](CNC(=O)NCc2ccnc(OC(F)F)c2)c2cccs2)CC1 ZINC000551218520 941429896 /nfs/dbraw/zinc/42/98/96/941429896.db2.gz SLQVSRFLWLVVML-INIZCTEOSA-N 0 3 424.517 4.017 20 0 HIADHN COCC1(CCN[C@H](c2cccc(S(C)(=O)=O)c2)c2ccc(F)c(F)c2)CCC1 ZINC000551246329 941434949 /nfs/dbraw/zinc/43/49/49/941434949.db2.gz NJPDJSOKUJBTMO-OAQYLSRUSA-N 0 3 423.525 4.254 20 0 HIADHN Cc1n[nH]cc1C1CCN(C(=O)NC[C@H](c2ccccc2)N2CCC(C)CC2)CC1 ZINC000551268389 941439969 /nfs/dbraw/zinc/43/99/69/941439969.db2.gz CUNJBUHYKFPCHE-HSZRJFAPSA-N 0 3 409.578 4.080 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](NC[C@H](CO)C2CCCCC2)c2ccc(F)cc2)c1 ZINC000551272927 941441111 /nfs/dbraw/zinc/44/11/11/941441111.db2.gz RLVVSFPXPNJPTC-NFBKMPQASA-N 0 3 419.562 4.097 20 0 HIADHN CC[C@H](Cn1cncn1)N[C@@H](c1ccc(OC)cc1)c1ccc(C(F)(F)F)cc1 ZINC000551293219 941444913 /nfs/dbraw/zinc/44/49/13/941444913.db2.gz AXLSLZSUFXVEDE-UYAOXDASSA-N 0 3 404.436 4.463 20 0 HIADHN C[C@H](Cn1cc(Br)ccc1=O)NCc1cc(Cl)ccc1OC(F)F ZINC000551315404 941449481 /nfs/dbraw/zinc/44/94/81/941449481.db2.gz WTZVFUDELFUGIJ-SNVBAGLBSA-N 0 3 421.669 4.044 20 0 HIADHN COc1cc(NC(=O)CCN2CCC(CC(F)(F)F)CC2)c(OC)cc1Cl ZINC000551406028 941470852 /nfs/dbraw/zinc/47/08/52/941470852.db2.gz FUBWSEUNRZTKIK-UHFFFAOYSA-N 0 3 408.848 4.350 20 0 HIADHN CCN(Cc1ccc(OC)c(OC)c1)C(=O)CNC(C)(C)c1ccc(Cl)cc1 ZINC000551424949 941476304 /nfs/dbraw/zinc/47/63/04/941476304.db2.gz TVUHKANYHJOYTM-UHFFFAOYSA-N 0 3 404.938 4.231 20 0 HIADHN CC(C)Oc1ccc([C@H](C)NCc2ccc([C@@]3(C)NC(=O)NC3=O)cc2)cc1Cl ZINC000551533277 941496624 /nfs/dbraw/zinc/49/66/24/941496624.db2.gz JUQZTEFOWNWNHB-RCDICMHDSA-N 0 3 415.921 4.033 20 0 HIADHN Fc1ccc(C2(NCc3cccc(I)c3)CCOCC2)cc1 ZINC000551538467 941497563 /nfs/dbraw/zinc/49/75/63/941497563.db2.gz WBSGIQACRDXZIK-UHFFFAOYSA-N 0 3 411.258 4.226 20 0 HIADHN Cc1ccc(-n2cc(CN3CC[C@@H](N4CCCC4=O)C3)c(-c3ccc(F)cc3)n2)cc1 ZINC000551550418 941499863 /nfs/dbraw/zinc/49/98/63/941499863.db2.gz OCYLNEGVEXWNSD-HSZRJFAPSA-N 0 3 418.516 4.184 20 0 HIADHN COc1ccc([C@@H](CN(C)C)N[C@H](C)c2ccc(I)cc2)cc1 ZINC000551555401 941500647 /nfs/dbraw/zinc/50/06/47/941500647.db2.gz XHKOYOSHFWWOFQ-AUUYWEPGSA-N 0 3 424.326 4.253 20 0 HIADHN CC(C)(C)c1nn(-c2ccccc2Cl)cc1CN[C@H](CO)C[C@@H](O)C(C)(C)C ZINC000551571131 941504041 /nfs/dbraw/zinc/50/40/41/941504041.db2.gz KDCIPEGRVYGYEU-QFBILLFUSA-N 0 3 407.986 4.071 20 0 HIADHN COc1ccc2c(c1)CCC[C@H]2NCc1cccc(N2C(=O)N[C@@](C)(C3CC3)C2=O)c1 ZINC000551572511 941504816 /nfs/dbraw/zinc/50/48/16/941504816.db2.gz ZPTUOFNXNGHGTA-RDGATRHJSA-N 0 3 419.525 4.087 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1cccnc1OC(C)C ZINC000551648524 941518477 /nfs/dbraw/zinc/51/84/77/941518477.db2.gz XEVWOERYCRNAMK-FQEVSTJZSA-N 0 3 419.529 4.073 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)[C@H]1CCc2cccc(O)c21 ZINC000551704904 941530251 /nfs/dbraw/zinc/53/02/51/941530251.db2.gz FZDNPRZKURWHMS-SFTDATJTSA-N 0 3 416.525 4.013 20 0 HIADHN Cc1cc(NC(=O)[C@H]2CCc3cccc(O)c32)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000551712618 941531435 /nfs/dbraw/zinc/53/14/35/941531435.db2.gz VKZVPHZCNVSEHO-RTWAWAEBSA-N 0 3 416.525 4.013 20 0 HIADHN CCS(=O)(=O)c1ccc([C@H](C)NCCOc2ccc(OC(F)(F)F)cc2)cc1 ZINC000551714052 941531495 /nfs/dbraw/zinc/53/14/95/941531495.db2.gz RDAZLJSEXPALAS-AWEZNQCLSA-N 0 3 417.449 4.108 20 0 HIADHN COC(=O)c1ccc(CNC[C@@H](c2ccccc2)C(C)(C)CO)c(Br)c1 ZINC000551806123 941548883 /nfs/dbraw/zinc/54/88/83/941548883.db2.gz NLVYJJQNVRPLDL-SFHVURJKSA-N 0 3 420.347 4.128 20 0 HIADHN O[C@H](CN[C@H]1CCCOc2ccc(F)cc21)COc1cc(Cl)ccc1Cl ZINC000552029154 941570702 /nfs/dbraw/zinc/57/07/02/941570702.db2.gz LDOQXNXQKPCTJE-PBHICJAKSA-N 0 3 400.277 4.376 20 0 HIADHN CN(CCCN(C)Cc1nnc(-c2ccccc2Br)o1)Cc1ccco1 ZINC000552058418 941576276 /nfs/dbraw/zinc/57/62/76/941576276.db2.gz IKJZQQGVSGGUSO-UHFFFAOYSA-N 0 3 419.323 4.046 20 0 HIADHN c1c(CN2CCC(O[C@@H]3CCOC3)CC2)c(-c2ccccc2)nn1Cc1ccccc1 ZINC000552078254 941580537 /nfs/dbraw/zinc/58/05/37/941580537.db2.gz ONOKNLLFJJXHIL-RUZDIDTESA-N 0 3 417.553 4.368 20 0 HIADHN c1c(CN2CCC(O[C@H]3CCOC3)CC2)c(-c2ccccc2)nn1-c1ccccc1 ZINC000552080274 941581257 /nfs/dbraw/zinc/58/12/57/941581257.db2.gz ZBIGLIBMWHMYQS-DEOSSOPVSA-N 0 3 403.526 4.309 20 0 HIADHN Brc1cnn(CCN[C@H]2CCSc3ccc(Br)cc32)c1 ZINC000552098698 941584754 /nfs/dbraw/zinc/58/47/54/941584754.db2.gz LTSAPXUJDAOAAD-ZDUSSCGKSA-N 0 3 417.170 4.235 20 0 HIADHN C[C@@H]1CCc2[nH]c3ccc(C(=O)N(C)CCCN(C)Cc4ccncc4)cc3c2C1 ZINC000552112797 941587262 /nfs/dbraw/zinc/58/72/62/941587262.db2.gz VCWWCEJNBOAISQ-GOSISDBHSA-N 0 3 404.558 4.282 20 0 HIADHN C[C@H](Oc1ccc(Cl)c(Cl)c1)C(=O)N(C)CCCN(C)Cc1ccncc1 ZINC000552112713 941587287 /nfs/dbraw/zinc/58/72/87/941587287.db2.gz QJGMOCQGYGCPNZ-HNNXBMFYSA-N 0 3 410.345 4.136 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1nc(C(C)C)oc1C ZINC000552115877 941588039 /nfs/dbraw/zinc/58/80/39/941588039.db2.gz RBDHNIYLPFVSTN-LJQANCHMSA-N 0 3 407.518 4.311 20 0 HIADHN O=C(c1cnc(-c2ccsc2)s1)N1CCN(c2ccnc3ccccc32)CC1 ZINC000552147640 941593962 /nfs/dbraw/zinc/59/39/62/941593962.db2.gz SEHYQNSUSRRHCW-UHFFFAOYSA-N 0 3 406.536 4.382 20 0 HIADHN CN(c1ccccc1)c1ccccc1C(=O)Nc1cccc(CN2CC[C@@H](O)C2)c1 ZINC000552199969 941601342 /nfs/dbraw/zinc/60/13/42/941601342.db2.gz PPDZAJABENHCGS-JOCHJYFZSA-N 0 3 401.510 4.273 20 0 HIADHN O[C@H](CN[C@H]1CCOc2c(Cl)cccc21)COc1c(Cl)cccc1Cl ZINC000552226745 941608631 /nfs/dbraw/zinc/60/86/31/941608631.db2.gz OLZAUMDKFKOTSG-BZNIZROVSA-N 0 3 402.705 4.500 20 0 HIADHN CCCN(C)[C@H](CNC(=O)c1cc(NC(C)=O)ccc1F)c1ccc(Cl)cc1 ZINC000552243513 941612079 /nfs/dbraw/zinc/61/20/79/941612079.db2.gz FHJMWFJJCDTSJM-HXUWFJFHSA-N 0 3 405.901 4.250 20 0 HIADHN CCCN(C)[C@H](CNC(=O)Cc1ccc(OC)c(OC)c1)c1ccc(Cl)cc1 ZINC000552243477 941612212 /nfs/dbraw/zinc/61/22/12/941612212.db2.gz CNVLDCYIAWLKNH-LJQANCHMSA-N 0 3 404.938 4.099 20 0 HIADHN OC[C@@H](CN[C@H](c1ncc[nH]1)C1CCCCC1)Cc1cccc(OC(F)(F)F)c1 ZINC000552246404 941613083 /nfs/dbraw/zinc/61/30/83/941613083.db2.gz SZHYFMWRQJBRTE-APWZRJJASA-N 0 3 411.468 4.371 20 0 HIADHN CC[C@@H](NCC(=O)N[C@H]1CCOc2ccccc21)c1ccc(OC(F)(F)F)cc1 ZINC000552260465 941616516 /nfs/dbraw/zinc/61/65/16/941616516.db2.gz COSBYUNENHFKPZ-MSOLQXFVSA-N 0 3 408.420 4.266 20 0 HIADHN CN(CCCN(C)Cc1nc(-c2ccc(C(F)(F)F)cc2)no1)Cc1ccco1 ZINC000552269537 941618921 /nfs/dbraw/zinc/61/89/21/941618921.db2.gz FCOWNJGRXAGKRA-UHFFFAOYSA-N 0 3 408.424 4.302 20 0 HIADHN C[S@](=O)Cc1ccc(CN[C@H]2CCCOc3cc(Br)ccc32)cc1 ZINC000552317809 941630022 /nfs/dbraw/zinc/63/00/22/941630022.db2.gz IHDAVDMXCWQGEY-UUOWRZLLSA-N 0 3 408.361 4.331 20 0 HIADHN c1[nH]nc(-c2ccc3c(c2)OCO3)c1CN1CC[C@H](OCCCc2ccccc2)C1 ZINC000552326396 941632756 /nfs/dbraw/zinc/63/27/56/941632756.db2.gz PPABFTDUEZGOEM-NRFANRHFSA-N 0 3 405.498 4.029 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc2n[nH]cc2c1)c1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000552335100 941635012 /nfs/dbraw/zinc/63/50/12/941635012.db2.gz ISCAYPYQVUQIPU-IRXDYDNUSA-N 0 3 412.559 4.149 20 0 HIADHN Cc1cc(I)cc(N[C@@H]2CCN(Cc3ccccn3)C[C@@H]2C)c1 ZINC000552335340 941635237 /nfs/dbraw/zinc/63/52/37/941635237.db2.gz PAIHAQXSLMSNRH-HNAYVOBHSA-N 0 3 421.326 4.317 20 0 HIADHN Cc1nc(-c2cc([C@H](C)NC[C@H](N3CCOCC3)C(F)(F)F)cs2)cs1 ZINC000552338974 941638196 /nfs/dbraw/zinc/63/81/96/941638196.db2.gz UXYYGNCDKOJNJC-ZBEGNZNMSA-N 0 3 405.511 4.094 20 0 HIADHN CC(C)(CO)[C@H](NCc1ccc(Br)c2cccnc12)c1cccnc1 ZINC000552344746 941639576 /nfs/dbraw/zinc/63/95/76/941639576.db2.gz DQPTWTGSYYAYEM-LJQANCHMSA-N 0 3 400.320 4.242 20 0 HIADHN CN1CC[C@@H](NC(=O)C2(c3cc(F)cc(Br)c3)CC2)[C@@H]1c1ccccc1 ZINC000552397972 941657431 /nfs/dbraw/zinc/65/74/31/941657431.db2.gz SATDXFMXHVDZLN-MOPGFXCFSA-N 0 3 417.322 4.181 20 0 HIADHN COCc1ccc([C@H]2CCCN2C(=O)[C@@H]2CN(Cc3ccccc3)CCC2(F)F)o1 ZINC000552449066 941675099 /nfs/dbraw/zinc/67/50/99/941675099.db2.gz OMPCBDJLMZJURA-VQTJNVASSA-N 0 3 418.484 4.247 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)c2ccc(-c3ccc(C(C)=O)cc3)o2)cc1 ZINC000552468246 941679432 /nfs/dbraw/zinc/67/94/32/941679432.db2.gz GRTUNHSJFQEKRX-NRFANRHFSA-N 0 3 406.482 4.191 20 0 HIADHN C[C@@H](NCc1ccc(OCc2cccc(F)c2)cc1)c1ccc(-n2cnnn2)cc1 ZINC000552575895 941710538 /nfs/dbraw/zinc/71/05/38/941710538.db2.gz KMZLGIXAYGYAMT-QGZVFWFLSA-N 0 3 403.461 4.231 20 0 HIADHN CCCN(C)[C@H](CNC(=O)CCc1nc(C(C)(C)C)no1)c1ccc(Cl)cc1 ZINC000552672568 941734299 /nfs/dbraw/zinc/73/42/99/941734299.db2.gz SHQYSDKWQRQOLR-QGZVFWFLSA-N 0 3 406.958 4.152 20 0 HIADHN CN(CC(F)(F)F)C(=O)N(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000552851002 941788301 /nfs/dbraw/zinc/78/83/01/941788301.db2.gz GIJFDGVGRRSPGN-FQEVSTJZSA-N 0 3 420.479 4.162 20 0 HIADHN COc1ccccc1[C@@H]1CC[C@@H](C)CN1C(=O)CC1(N2CCOCC2)CCCC1 ZINC000552887970 941798290 /nfs/dbraw/zinc/79/82/90/941798290.db2.gz JJLKKJHHGGKIRN-CTNGQTDRSA-N 0 3 400.563 4.030 20 0 HIADHN CCN1CCN(CCC(=O)Nc2cccc(-c3ccc(Br)cc3)c2)CC1 ZINC000553060376 941826526 /nfs/dbraw/zinc/82/65/26/941826526.db2.gz IPXDKVXBMCQMAF-UHFFFAOYSA-N 0 3 416.363 4.082 20 0 HIADHN O=C(N[C@H](CCO)c1ccc(Cl)c(Cl)c1)c1cccc(CN2CCCC2)c1 ZINC000553099683 941832832 /nfs/dbraw/zinc/83/28/32/941832832.db2.gz UULIELQUBLDQQW-HXUWFJFHSA-N 0 3 407.341 4.443 20 0 HIADHN CO[C@@H]1CCCC[C@H]1C(=O)N(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000553196241 941847301 /nfs/dbraw/zinc/84/73/01/941847301.db2.gz GWMAEPOTRHNFKA-ISJGIBHGSA-N 0 3 421.585 4.280 20 0 HIADHN O=C(CCc1ccco1)N(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000553196266 941847450 /nfs/dbraw/zinc/84/74/50/941847450.db2.gz HSXOHVCJKFSOAW-QHCPKHFHSA-N 0 3 403.526 4.301 20 0 HIADHN C[C@H](NCc1ccc(I)cc1)c1ccc2c(c1)CCC(=O)N2 ZINC000553242175 941855440 /nfs/dbraw/zinc/85/54/40/941855440.db2.gz KYPMQJZUJNGGGW-LBPRGKRZSA-N 0 3 406.267 4.027 20 0 HIADHN CCN(CC(=O)N(C)[C@@H](C)c1ccc(F)c(F)c1)[C@H](C)Cc1ccc(OC)cc1 ZINC000553317486 941866446 /nfs/dbraw/zinc/86/64/46/941866446.db2.gz WCBUXJAKMGWNQM-SJORKVTESA-N 0 3 404.501 4.446 20 0 HIADHN C[C@@H]1CN(C(=O)c2cccc(CN(C)C)c2)C[C@@H](c2cccc(C(F)(F)F)c2)O1 ZINC000553382883 941877129 /nfs/dbraw/zinc/87/71/29/941877129.db2.gz XHCCLORRQQRBKP-QRWLVFNGSA-N 0 3 406.448 4.369 20 0 HIADHN C[C@@H]1C[C@@H]1[C@@H](NCC(=O)NC[C@@H]1CCN(c2ccccc2)C1)c1ccc(Cl)cc1 ZINC000553622047 941922803 /nfs/dbraw/zinc/92/28/03/941922803.db2.gz QLTMMSBZXRTRJT-WPOIJDHESA-N 0 3 411.977 4.269 20 0 HIADHN CC[C@H](C)Oc1cccc(NC(=O)N2CCC(CN3C[C@H](C)O[C@@H](C)C3)CC2)c1 ZINC000553654344 941935594 /nfs/dbraw/zinc/93/55/94/941935594.db2.gz KJAFCPJAHCRYRC-FHWLQOOXSA-N 0 3 403.567 4.217 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)c2cccc(NC(=O)[C@H]3C[C@@H]3C)c2)N(C)C)cc1 ZINC000553671052 941941072 /nfs/dbraw/zinc/94/10/72/941941072.db2.gz RPHMFNLWMMQBIW-RTFZILSDSA-N 0 3 423.557 4.101 20 0 HIADHN CC(C)Oc1cc(Br)cc(C(=O)N2CCN([C@H]3C[C@H]3C)C[C@H](C)C2)c1 ZINC000553781627 941967119 /nfs/dbraw/zinc/96/71/19/941967119.db2.gz CZDCBJPAGHUQJR-KHYOSLBOSA-N 0 3 409.368 4.039 20 0 HIADHN CC(C)Oc1cc(Br)ccc1C(=O)N1CCN([C@H]2C[C@@H]2C)C[C@H](C)C1 ZINC000553782684 941967736 /nfs/dbraw/zinc/96/77/36/941967736.db2.gz DOMDYUPDDKQSOD-MPGHIAIKSA-N 0 3 409.368 4.039 20 0 HIADHN CCN(CCN1CCCCCC1)C(=O)c1cc2sc(N3CCCC3)nc2s1 ZINC000553825318 941978536 /nfs/dbraw/zinc/97/85/36/941978536.db2.gz LFPVCDIDFXMVIW-UHFFFAOYSA-N 0 3 406.621 4.296 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)c2cccc([C@@H]3CCCOC3)c2)N(C)C)cc1 ZINC000554012835 942019075 /nfs/dbraw/zinc/01/90/75/942019075.db2.gz QKOWCDVUHJBQSP-VWNXMTODSA-N 0 3 410.558 4.401 20 0 HIADHN Cc1cc(C(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)c2cnn(C(C)C)c2n1 ZINC000554017508 942020401 /nfs/dbraw/zinc/02/04/01/942020401.db2.gz YSQUUUCQSGTIBB-JOCHJYFZSA-N 0 3 423.561 4.141 20 0 HIADHN C[C@H]1CCc2c(sc3nc(CCN4CC[C@H](Nc5ccccc5)C4)nc(N)c23)C1 ZINC000554040789 942024006 /nfs/dbraw/zinc/02/40/06/942024006.db2.gz QFBWMQBQYGDTRS-RDJZCZTQSA-N 0 3 407.587 4.127 20 0 HIADHN CCc1nc(-c2ccc(Cl)cc2)[nH]c1C(=O)N1CCN([C@@H]2C[C@H]2C)C[C@@H](C)C1 ZINC000554113344 942039589 /nfs/dbraw/zinc/03/95/89/942039589.db2.gz MMESCRWTMJPGGS-SPYBWZPUSA-N 0 3 400.954 4.095 20 0 HIADHN Cc1ccccc1-n1ncc(C(=O)N2CCN([C@@H]3C[C@@H]3C)C[C@@H](C)C2)c1C(F)(F)F ZINC000554128513 942043657 /nfs/dbraw/zinc/04/36/57/942043657.db2.gz MGTLCURHHZGVAC-SIXWZSSISA-N 0 3 420.479 4.002 20 0 HIADHN CCCN(C)[C@H](CNC(=O)N[C@@H]1CCCC12CCOCC2)c1ccc(Cl)cc1 ZINC000554164696 942054024 /nfs/dbraw/zinc/05/40/24/942054024.db2.gz FWMLRFKBQDLJNW-WOJBJXKFSA-N 0 3 407.986 4.371 20 0 HIADHN Cc1nc(-c2ccc(CNC(=O)N[C@H](CN(C)C)c3ccc(F)cc3)s2)cs1 ZINC000554275362 942087316 /nfs/dbraw/zinc/08/73/16/942087316.db2.gz UKBLRRJELBKUHW-QGZVFWFLSA-N 0 3 418.563 4.421 20 0 HIADHN C[C@H](NC(=O)Nc1nc(CN2CCC[C@@H](C)C2)cs1)[C@H](c1ccccc1)N(C)C ZINC000554385603 942121799 /nfs/dbraw/zinc/12/17/99/942121799.db2.gz FNQJGNQRNCBJIP-FUHIMQAGSA-N 0 3 415.607 4.188 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)Nc2ccc(Cn3cccn3)cc2)N(C)C)cc1 ZINC000554413130 942132409 /nfs/dbraw/zinc/13/24/09/942132409.db2.gz OVOJDCSKABHGGL-HSZRJFAPSA-N 0 3 421.545 4.143 20 0 HIADHN CCOCCOc1c(Cl)cccc1NC(=O)N[C@@H](CN(C)C)c1ccc(F)cc1 ZINC000554425416 942138080 /nfs/dbraw/zinc/13/80/80/942138080.db2.gz BHICLNORNVPSSC-IBGZPJMESA-N 0 3 423.916 4.319 20 0 HIADHN CCOC(=O)Cn1ccc2cc(NC(=O)N[C@H](C)[C@@H](c3ccccc3)N(C)C)ccc21 ZINC000554440684 942143595 /nfs/dbraw/zinc/14/35/95/942143595.db2.gz CEBDGBLIDVLQIQ-HXOBKFHXSA-N 0 3 422.529 4.017 20 0 HIADHN C[C@@H](NC(=O)Nc1ccc(OCc2ccncc2)cc1)[C@H](c1ccccc1)N(C)C ZINC000554440708 942144269 /nfs/dbraw/zinc/14/42/69/942144269.db2.gz CGEFPHMGYYCDLN-WZONZLPQSA-N 0 3 404.514 4.474 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)Nc2cnn(-c3ccccc3)c2)N(C)C)cc1 ZINC000554461515 942151788 /nfs/dbraw/zinc/15/17/88/942151788.db2.gz CJDCMTMDSPVCSI-QFIPXVFZSA-N 0 3 407.518 4.084 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)Nc1ccc(OC2CCOCC2)c(C)c1)c1ccco1 ZINC000554464472 942152062 /nfs/dbraw/zinc/15/20/62/942152062.db2.gz JWMSGYZICPPUQW-YLJYHZDGSA-N 0 3 415.534 4.397 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)NCc1c(C)nn(-c2ccccc2)c1C)c1ccco1 ZINC000554476675 942156144 /nfs/dbraw/zinc/15/61/44/942156144.db2.gz YVBZWPNASXZWPG-HRAATJIYSA-N 0 3 409.534 4.011 20 0 HIADHN CC(=O)N(C)c1cccc(NC(=O)NC[C@@H](c2ccc(CC(C)C)cc2)N(C)C)c1 ZINC000554479220 942157028 /nfs/dbraw/zinc/15/70/28/942157028.db2.gz FYBUOYHQHLXMEA-QHCPKHFHSA-N 0 3 410.562 4.292 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)c1ccc(OC2CCCC2)c(OC)c1)c1ccco1 ZINC000554634397 942181530 /nfs/dbraw/zinc/18/15/30/942181530.db2.gz YCSNDCATMYLATH-APWZRJJASA-N 0 3 400.519 4.469 20 0 HIADHN CN(C)CCN(C[C@H]1CCCO1)C(=O)Nc1ccc(F)cc1-c1ccc(F)cc1 ZINC000554783359 942235848 /nfs/dbraw/zinc/23/58/48/942235848.db2.gz QIUSUNKHLBISFP-LJQANCHMSA-N 0 3 403.473 4.206 20 0 HIADHN Cn1cc(C(F)(F)F)nc1[C@H]1CCCN(Cc2cnn(Cc3ccc(F)cc3)c2)C1 ZINC000554864208 942297904 /nfs/dbraw/zinc/29/79/04/942297904.db2.gz QJWDODOCCOIFJE-KRWDZBQOSA-N 0 3 421.442 4.202 20 0 HIADHN CN(C)C[C@@H](NC(=O)Nc1ccc(OC[C@H]2CCCO2)cc1)c1ccc(Cl)cc1 ZINC000554909505 942316214 /nfs/dbraw/zinc/31/62/14/942316214.db2.gz FHXJUPDDPQDINK-NHCUHLMSSA-N 0 3 417.937 4.322 20 0 HIADHN COC(=O)[C@H](C)Cc1ccc(NC(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)cc1 ZINC000554914990 942317735 /nfs/dbraw/zinc/31/77/35/942317735.db2.gz JHQLZIOXMVUAHC-FOIQADDNSA-N 0 3 417.937 4.116 20 0 HIADHN C[C@H](NC[C@H](Cc1ccccc1)C(F)(F)F)c1cccc(NS(C)(=O)=O)c1 ZINC000555002976 942350868 /nfs/dbraw/zinc/35/08/68/942350868.db2.gz LNDGUPGNPNHOFN-YOEHRIQHSA-N 0 3 400.466 4.130 20 0 HIADHN C[C@H](CNC(=O)Nc1ccc(Oc2ccc(Cl)cc2)cc1)CN1CCN(C)CC1 ZINC000555012438 942355919 /nfs/dbraw/zinc/35/59/19/942355919.db2.gz ZSCXXAXCOZVCBF-QGZVFWFLSA-N 0 3 416.953 4.137 20 0 HIADHN COc1ccc([C@@H](CNc2ncc(C)c(-c3ccccc3F)n2)N(C)C)cc1OC ZINC000555121930 942391003 /nfs/dbraw/zinc/39/10/03/942391003.db2.gz RGYXJHIDQXJPRT-LJQANCHMSA-N 0 3 410.493 4.323 20 0 HIADHN COc1cc(F)c([C@@H](C)NC(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)cc1OC ZINC000555123586 942391332 /nfs/dbraw/zinc/39/13/32/942391332.db2.gz KXIBGADJCUWZRC-ACJLOTCBSA-N 0 3 423.916 4.159 20 0 HIADHN COc1cccc([C@@H]2[C@@H](NCC(=O)Nc3c(C)cc(C)cc3C)CCN2C2CC2)c1 ZINC000555130087 942394889 /nfs/dbraw/zinc/39/48/89/942394889.db2.gz QIBOEEYBQFXZIC-WIOPSUGQSA-N 0 3 407.558 4.127 20 0 HIADHN CCN1CC[C@H](N[C@@H](C)C(=O)Nc2c(C)cccc2C)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000555133015 942396991 /nfs/dbraw/zinc/39/69/91/942396991.db2.gz YAPZXXHDDJXXED-WQFQCULDSA-N 0 3 419.491 4.473 20 0 HIADHN CN(C)C[C@H](NC(=O)N[C@@H]1CCO[C@@H](c2ccccc2)C1)c1ccc(Cl)cc1 ZINC000555146809 942404358 /nfs/dbraw/zinc/40/43/58/942404358.db2.gz NRSYNZXXTXOFDF-QHAWAJNXSA-N 0 3 401.938 4.162 20 0 HIADHN CN(C)C[C@H](NC(=O)NC[C@@H](c1ccccc1)C(C)(C)CO)c1ccc(Cl)cc1 ZINC000555179818 942419533 /nfs/dbraw/zinc/41/95/33/942419533.db2.gz GYAVRZBOIOVAJX-SFTDATJTSA-N 0 3 417.981 4.044 20 0 HIADHN CN(C)C[C@@H](NC(=O)NC[C@H](c1ccccc1)C(C)(C)CO)c1ccc(Cl)cc1 ZINC000555179815 942419607 /nfs/dbraw/zinc/41/96/07/942419607.db2.gz GYAVRZBOIOVAJX-NHCUHLMSSA-N 0 3 417.981 4.044 20 0 HIADHN CN(C)C[C@H](NC(=O)NC[C@H](c1ccccc1)C(C)(C)CO)c1ccc(Cl)cc1 ZINC000555179817 942419816 /nfs/dbraw/zinc/41/98/16/942419816.db2.gz GYAVRZBOIOVAJX-RTWAWAEBSA-N 0 3 417.981 4.044 20 0 HIADHN CN(C)C[C@@H](NC(=O)Cc1csc(-c2cccs2)n1)c1ccc(Cl)cc1 ZINC000555230441 942437676 /nfs/dbraw/zinc/43/76/76/942437676.db2.gz ANSHLGQHSXGTQV-MRXNPFEDSA-N 0 3 405.976 4.487 20 0 HIADHN C[C@H](SCC(=O)N[C@H](CN(C)C)c1ccc(Cl)cc1)c1nc2ccccc2[nH]1 ZINC000555229685 942437733 /nfs/dbraw/zinc/43/77/33/942437733.db2.gz DOCLMHLGBMXGAP-IFXJQAMLSA-N 0 3 416.978 4.430 20 0 HIADHN CCc1nc2cc(CN[C@H](C)c3cccc(NS(C)(=O)=O)c3)ccc2n1C1CC1 ZINC000555232612 942438597 /nfs/dbraw/zinc/43/85/97/942438597.db2.gz IVKDPMXXKIBBJH-OAHLLOKOSA-N 0 3 412.559 4.156 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@H](N[C@@H](Cn2ccccc2=O)c2ccccc2)c2ccccc21 ZINC000555236103 942440526 /nfs/dbraw/zinc/44/05/26/942440526.db2.gz QWOFMHXBRYKINB-SGNDLWITSA-N 0 3 416.521 4.361 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@@H](N[C@H](CC(C)C)C(=O)Nc2nccs2)c2ccccc21 ZINC000555236190 942440555 /nfs/dbraw/zinc/44/05/55/942440555.db2.gz RVJRIEWHOMORRP-GUDVDZBRSA-N 0 3 415.559 4.268 20 0 HIADHN CCOCCCn1c(-c2cccc(Cl)c2)nnc1N1CCN(C2CCCC2)CC1 ZINC000555312029 942472378 /nfs/dbraw/zinc/47/23/78/942472378.db2.gz QSNVXFDXLCDSDG-UHFFFAOYSA-N 0 3 417.985 4.090 20 0 HIADHN COc1ccc(C(=O)C2CCN(Cc3ccc(C)cc3-c3cnn(C)c3)CC2)cc1 ZINC000555325308 942478196 /nfs/dbraw/zinc/47/81/96/942478196.db2.gz BTUBWQKWIWWBQU-UHFFFAOYSA-N 0 3 403.526 4.499 20 0 HIADHN CC[C@H](C)c1nnc(N2CCN(Cc3ccccc3)[C@H](CC)C2)n1C[C@H]1CCCO1 ZINC000555400934 942516665 /nfs/dbraw/zinc/51/66/65/942516665.db2.gz TZIVJQYJBRZZBO-KSEOMHKRSA-N 0 3 411.594 4.071 20 0 HIADHN C[C@@H](Cc1cnc2ccccc2n1)C(=O)N(CCN(C)C)Cc1cccc(Cl)c1 ZINC000555583358 942653509 /nfs/dbraw/zinc/65/35/09/942653509.db2.gz YIYKVYNARGHJPR-KRWDZBQOSA-N 0 3 410.949 4.052 20 0 HIADHN C[C@H](Cc1cnc2ccccc2n1)C(=O)N(CCN(C)C)Cc1cccc(Cl)c1 ZINC000555583359 942654218 /nfs/dbraw/zinc/65/42/18/942654218.db2.gz YIYKVYNARGHJPR-QGZVFWFLSA-N 0 3 410.949 4.052 20 0 HIADHN CCO[C@@H]1C[C@@H](NCc2ccc(Br)cc2C(F)(F)F)[C@H]1n1cccn1 ZINC000555647447 942684894 /nfs/dbraw/zinc/68/48/94/942684894.db2.gz CCGVCJOTWIASDL-BZUAXINKSA-N 0 3 418.257 4.173 20 0 HIADHN CCN(C(=O)c1cc(Cc2ccccc2)n[nH]1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000555787893 942733190 /nfs/dbraw/zinc/73/31/90/942733190.db2.gz INNVSMMBHQWKTQ-XXBNENTESA-N 0 3 402.542 4.298 20 0 HIADHN CN(C(=O)NCCCc1cccc(Cl)c1)C1CCN(CCc2ccccn2)CC1 ZINC000555817059 942743404 /nfs/dbraw/zinc/74/34/04/942743404.db2.gz DZVYTMMMUMYRRW-UHFFFAOYSA-N 0 3 414.981 4.016 20 0 HIADHN CC(C)(CN[C@H](c1nnc[nH]1)c1ccc(F)cc1)c1ccc(Br)cc1 ZINC000556059737 942799486 /nfs/dbraw/zinc/79/94/86/942799486.db2.gz WVPJAHAHPJGIHX-KRWDZBQOSA-N 0 3 403.299 4.363 20 0 HIADHN c1c(CNCc2ccnc(N3CCCC3)c2)c(-c2cccnc2)nn1Cc1ccccc1 ZINC000556191814 942817186 /nfs/dbraw/zinc/81/71/86/942817186.db2.gz QZMISZLZJAYZNA-UHFFFAOYSA-N 0 3 424.552 4.278 20 0 HIADHN CCCOc1ccc(Oc2ncccc2CN[C@H]2CCC[C@@H](S(C)(=O)=O)C2)cc1 ZINC000556236928 942824268 /nfs/dbraw/zinc/82/42/68/942824268.db2.gz XIRGEGKGPKUHQL-GHTZIAJQSA-N 0 3 418.559 4.108 20 0 HIADHN CS(=O)(=O)[C@@H]1CCC[C@H](N[C@H](c2ccccc2)c2ccc(Br)cc2)C1 ZINC000556263949 942828108 /nfs/dbraw/zinc/82/81/08/942828108.db2.gz IGXXNIFUKUGDNC-XUVXKRRUSA-N 0 3 422.388 4.484 20 0 HIADHN COc1ccc(CNc2ccc(C(=O)N(C)[C@@H]3CCCN(C)C3)cc2)cc1Cl ZINC000556337623 942844881 /nfs/dbraw/zinc/84/48/81/942844881.db2.gz ZFVFVTKKNZVIEJ-LJQANCHMSA-N 0 3 401.938 4.127 20 0 HIADHN Cc1cc(C)c(CC(C(=O)Nc2ccc3c(c2F)CCNC3=O)C(F)(F)F)c(C)c1 ZINC000556492964 942884403 /nfs/dbraw/zinc/88/44/03/942884403.db2.gz SJDWIJWNDVAROH-KRWDZBQOSA-N 0 3 422.422 4.397 20 0 HIADHN Fc1ccc([C@@H]2CN(C[C@H]3CN(Cc4ccccc4)CCCO3)CCO2)cc1Cl ZINC000556498055 942885082 /nfs/dbraw/zinc/88/50/82/942885082.db2.gz UZGVOUNXMJEBKP-OFNKIYASSA-N 0 3 418.940 4.144 20 0 HIADHN Cc1cc(-c2noc([C@@H](C)NC[C@H]3CN(Cc4ccccc4)CCCO3)n2)ccc1F ZINC000556503013 942886397 /nfs/dbraw/zinc/88/63/97/942886397.db2.gz YUTSZASVVJJUKU-NQIIRXRSSA-N 0 3 424.520 4.126 20 0 HIADHN O=C(CN[C@@H](c1cccc(C(F)(F)F)c1)C1CCOCC1)NCC1CCCCC1 ZINC000556516124 942890069 /nfs/dbraw/zinc/89/00/69/942890069.db2.gz XVTNKXWAZIMWQU-OAQYLSRUSA-N 0 3 412.496 4.459 20 0 HIADHN C[C@H](NC[C@@H]1CN(Cc2ccccc2)CCCO1)c1nc2ccccc2n1C(F)F ZINC000556532227 942892754 /nfs/dbraw/zinc/89/27/54/942892754.db2.gz OPCHLJBNVCBVGV-PKOBYXMFSA-N 0 3 414.500 4.373 20 0 HIADHN CSc1ccc([C@H](C)NCc2cccc(N3C(=O)N[C@@](C)(C4CC4)C3=O)c2)cc1 ZINC000556607930 942913126 /nfs/dbraw/zinc/91/31/26/942913126.db2.gz IPMOGPURRLISQX-WNSKOXEYSA-N 0 3 409.555 4.484 20 0 HIADHN COC(=O)[C@@H](Cc1ccccc1)[C@H](C)NCc1nc2cc(C(F)(F)F)ccc2n1C ZINC000556610188 942915095 /nfs/dbraw/zinc/91/50/95/942915095.db2.gz VAYSRCGDAUJEAY-YOEHRIQHSA-N 0 3 419.447 4.102 20 0 HIADHN CN(C(=O)c1ccc(NCc2ccc3c(c2)COC(C)(C)O3)cc1)[C@@H]1CCCN(C)C1 ZINC000556617338 942917494 /nfs/dbraw/zinc/91/74/94/942917494.db2.gz IRDLZCZGGJFWHB-JOCHJYFZSA-N 0 3 423.557 4.110 20 0 HIADHN CN(C)Cc1ccccc1NC(=O)CSc1nnc(-c2cccs2)n1C1CC1 ZINC000556675719 942929120 /nfs/dbraw/zinc/92/91/20/942929120.db2.gz OHBPWPYWGNCAHH-UHFFFAOYSA-N 0 3 413.572 4.134 20 0 HIADHN Cc1cc([C@@H](C)NCc2ccc(C(=O)N3CCOCC3)cc2)sc1Br ZINC000556815667 942934831 /nfs/dbraw/zinc/93/48/31/942934831.db2.gz SBBNEPCEYXVISX-CQSZACIVSA-N 0 3 423.376 4.142 20 0 HIADHN CCCc1c(C(=O)N(C)C[C@H]2CCN(Cc3ccc(C)s3)C2)[nH]c(C)c1C(C)=O ZINC000556828331 942937296 /nfs/dbraw/zinc/93/72/96/942937296.db2.gz LEDRKOSZFSXSEL-GOSISDBHSA-N 0 3 415.603 4.442 20 0 HIADHN CC(C)c1ccc([C@@H](NC[C@@H](O)CN2C[C@@H](C)O[C@H](C)C2)c2cccs2)cc1 ZINC000556853788 942940747 /nfs/dbraw/zinc/94/07/47/942940747.db2.gz NXPUWPIVVHOGSL-SVVKQXANSA-N 0 3 402.604 4.021 20 0 HIADHN COc1ccc([C@H](Cc2ccncc2)NCc2cccc(N3CCCC3=O)c2)cc1 ZINC000556872959 942947038 /nfs/dbraw/zinc/94/70/38/942947038.db2.gz LZLCZDXITYCSPN-DEOSSOPVSA-N 0 3 401.510 4.291 20 0 HIADHN OC[C@H](CN[C@H](c1ncc[nH]1)C1CCCCC1)Cc1ccc(Br)cc1 ZINC000556881583 942948582 /nfs/dbraw/zinc/94/85/82/942948582.db2.gz XCWBLWKPDGSQSM-LPHOPBHVSA-N 0 3 406.368 4.234 20 0 HIADHN CO[C@@H]1C[C@H](c2ccccc2)CC[C@H]1NCC(=O)N(C)c1nc2ccccc2s1 ZINC000556881469 942948781 /nfs/dbraw/zinc/94/87/81/942948781.db2.gz SOBHVRPKMGZHJI-QWFCFKBJSA-N 0 3 409.555 4.200 20 0 HIADHN O=C(N[C@H](c1ccccc1)[C@@H]1CCOC1)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000556951467 942978319 /nfs/dbraw/zinc/97/83/19/942978319.db2.gz PCLFIGJTHPLIOS-YPAWHYETSA-N 0 3 414.496 4.038 20 0 HIADHN Cc1cc(C)c(NC(=O)CNC(C)(C)COc2ncccc2Br)c(C)c1 ZINC000557009366 942993093 /nfs/dbraw/zinc/99/30/93/942993093.db2.gz UECWJKGJAJMDTA-UHFFFAOYSA-N 0 3 420.351 4.155 20 0 HIADHN C[C@H](CC(=O)Nc1cccc(CN2CC[C@@H](O)C2)c1)c1cccc(C(F)(F)F)c1 ZINC000557021677 942996435 /nfs/dbraw/zinc/99/64/35/942996435.db2.gz AFQRBYLXPLQHJF-FOIQADDNSA-N 0 3 406.448 4.404 20 0 HIADHN Cc1cc(C)c(C(=O)CCCC(=O)Nc2cccc(CN3CC[C@H](O)C3)c2)c(C)c1 ZINC000557025356 942998188 /nfs/dbraw/zinc/99/81/88/942998188.db2.gz PAQWXUBFBZTIDK-QFIPXVFZSA-N 0 3 408.542 4.170 20 0 HIADHN Fc1ccc(CC2(NCc3ccn(-c4c(F)cccc4F)n3)CCOCC2)cc1 ZINC000557038508 943001317 /nfs/dbraw/zinc/00/13/17/943001317.db2.gz VAPXIUKPOXWPCV-UHFFFAOYSA-N 0 3 401.432 4.171 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)c2cc3cc(Br)ccc3o2)cc1 ZINC000557206290 943050931 /nfs/dbraw/zinc/05/09/31/943050931.db2.gz GMVBRGVEIXSEPX-KRWDZBQOSA-N 0 3 417.303 4.237 20 0 HIADHN C[C@H](NCc1nnc(-c2ccc(Br)cc2)[nH]1)c1ccc(-n2cccn2)cc1 ZINC000557278027 943064773 /nfs/dbraw/zinc/06/47/73/943064773.db2.gz RKEIFAQSOHIHEK-AWEZNQCLSA-N 0 3 423.318 4.271 20 0 HIADHN C[C@H]([NH2+]Cc1nnc(-c2ccc(Br)cc2)[n-]1)c1ccc(-n2cccn2)cc1 ZINC000557278027 943064781 /nfs/dbraw/zinc/06/47/81/943064781.db2.gz RKEIFAQSOHIHEK-AWEZNQCLSA-N 0 3 423.318 4.271 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)c1cc(=O)[nH]c2c(Br)cccc12 ZINC000557425475 943117764 /nfs/dbraw/zinc/11/77/64/943117764.db2.gz PNEMZAPDMKFKLY-UHFFFAOYSA-N 0 3 420.351 4.041 20 0 HIADHN Cc1nn(C(C)C)c(C)c1CC(=O)NC[C@H](c1cccs1)N1CCC(C)CC1 ZINC000557434237 943124467 /nfs/dbraw/zinc/12/44/67/943124467.db2.gz KWWSWLHIABUZSI-HXUWFJFHSA-N 0 3 402.608 4.274 20 0 HIADHN C[C@@H]1CC(C(=O)N(Cc2ccncc2)[C@H]2CCCN(Cc3ccccc3)C2)C[C@@H](C)O1 ZINC000557449435 943134774 /nfs/dbraw/zinc/13/47/74/943134774.db2.gz RXVKGRCPPAQRID-OTPAQWSUSA-N 0 3 421.585 4.278 20 0 HIADHN C[C@H](C1CC1)N(Cc1ccccc1)C(=O)CNC1(c2ccc(F)cc2)CCOCC1 ZINC000557499663 943170307 /nfs/dbraw/zinc/17/03/07/943170307.db2.gz RBAHMPFOUPAGOE-LJQANCHMSA-N 0 3 410.533 4.248 20 0 HIADHN O=C(N[C@H](c1c[nH]c2ccccc21)C(F)(F)F)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000557629703 943239144 /nfs/dbraw/zinc/23/91/44/943239144.db2.gz CMJHDAWEPSKGOT-OXQOHEQNSA-N 0 3 416.447 4.195 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)c1ccccc1OCc1csc(C)n1 ZINC000557631984 943240376 /nfs/dbraw/zinc/24/03/76/943240376.db2.gz GAFQBBKKMUJAFS-UHFFFAOYSA-N 0 3 401.576 4.369 20 0 HIADHN Cc1cc([C@H](NCC(=O)N2CCC(C(=O)Nc3ccccc3)CC2)C2CC2)ccc1F ZINC000557710193 943264895 /nfs/dbraw/zinc/26/48/95/943264895.db2.gz ROXYWDRMFORBRB-XMMPIXPASA-N 0 3 423.532 4.052 20 0 HIADHN C[C@H]1CCN(C(=O)c2ccnc(-c3ccccc3)c2N)CCN1Cc1ccccc1 ZINC000557727181 943270803 /nfs/dbraw/zinc/27/08/03/943270803.db2.gz BCAIABUPMRAFFU-IBGZPJMESA-N 0 3 400.526 4.067 20 0 HIADHN O=C(NCc1ccc(-c2ccccc2)cc1F)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000557728032 943271540 /nfs/dbraw/zinc/27/15/40/943271540.db2.gz HHVCFKQEVIMRQM-QHCPKHFHSA-N 0 3 403.501 4.416 20 0 HIADHN Cc1cc(Br)cc2cc(C(=O)N3CCN(C4CCC4)C[C@H](C)C3)oc21 ZINC000557833569 943307269 /nfs/dbraw/zinc/30/72/69/943307269.db2.gz MXCZYBSCJATUAO-ZDUSSCGKSA-N 0 3 405.336 4.450 20 0 HIADHN O[C@@H](CNCc1cn(-c2ccccc2)nc1-c1ccc(Br)cc1)C(F)F ZINC000557837901 943309172 /nfs/dbraw/zinc/30/91/72/943309172.db2.gz DQOBHYSBDBCBFX-KRWDZBQOSA-N 0 3 422.273 4.017 20 0 HIADHN O[C@H](CNCc1cn(-c2ccccc2)nc1-c1ccc(Br)cc1)C(F)F ZINC000557837903 943309231 /nfs/dbraw/zinc/30/92/31/943309231.db2.gz DQOBHYSBDBCBFX-QGZVFWFLSA-N 0 3 422.273 4.017 20 0 HIADHN COc1ccc(-c2nc(C)c(C(=O)N3CCN(C4CCC4)C[C@H](C)C3)s2)c(F)c1 ZINC000557840401 943310403 /nfs/dbraw/zinc/31/04/03/943310403.db2.gz VVODUAJIDHVBPA-AWEZNQCLSA-N 0 3 417.550 4.213 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)c1cccc(C(=O)N(C)CC(C)(C)C)c1)c1ccco1 ZINC000557916822 943328071 /nfs/dbraw/zinc/32/80/71/943328071.db2.gz SDFYPMJZBLXLIC-YLJYHZDGSA-N 0 3 413.562 4.257 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)c2cnc(-c3cccnc3)s2)N(C)C)cc1 ZINC000557937505 943334552 /nfs/dbraw/zinc/33/45/52/943334552.db2.gz NGHIGGACCYBXKR-LJQANCHMSA-N 0 3 410.543 4.025 20 0 HIADHN C[C@H]1C[C@@H]1N1CCN(C(=O)c2ncoc2-c2cccc(C(F)(F)F)c2)C[C@@H](C)C1 ZINC000558021431 943357966 /nfs/dbraw/zinc/35/79/66/943357966.db2.gz CYVUAIVXAORTIF-ZQIUZPCESA-N 0 3 407.436 4.163 20 0 HIADHN COC[C@H](N[C@@H](C)CC(=O)Nc1ccc(OC)cc1OC)c1cccc(Cl)c1 ZINC000558166556 943405511 /nfs/dbraw/zinc/40/55/11/943405511.db2.gz SEIDNSUOGLTCNR-LIRRHRJNSA-N 0 3 406.910 4.052 20 0 HIADHN Cc1cc(Oc2ncccn2)ccc1NC(=O)N[C@@H]1CCN(Cc2ccccc2)[C@@H]1C ZINC000558194534 943427151 /nfs/dbraw/zinc/42/71/51/943427151.db2.gz YRGBXYLWORBLQH-XMSQKQJNSA-N 0 3 417.513 4.362 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)Nc1cccc(OCc2cccnc2)c1 ZINC000558193874 943427377 /nfs/dbraw/zinc/42/73/77/943427377.db2.gz UPRZZEFQWWXIBN-LJQANCHMSA-N 0 3 404.514 4.303 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1cccnc1C(F)(F)F)c1cccc(OC)c1 ZINC000558204960 943431659 /nfs/dbraw/zinc/43/16/59/943431659.db2.gz DZRVKQNBFROWIE-QGZVFWFLSA-N 0 3 410.440 4.314 20 0 HIADHN CCc1c(NC(=O)N[C@@H]2CCN(Cc3ccccc3)[C@H]2C)cnn1-c1ccccc1 ZINC000558210591 943434451 /nfs/dbraw/zinc/43/44/51/943434451.db2.gz NQFJNJKGPQMGSC-GHTZIAJQSA-N 0 3 403.530 4.219 20 0 HIADHN Cc1ccc(C(=O)CCC(=O)N2CCC3(C2)CCN(Cc2ccccc2)CC3)cc1 ZINC000558305092 943495834 /nfs/dbraw/zinc/49/58/34/943495834.db2.gz XQQLRYJUYFFZGC-UHFFFAOYSA-N 0 3 404.554 4.473 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1cc(NC(=O)C(C)C)ccc1C)c1ccco1 ZINC000558310893 943498538 /nfs/dbraw/zinc/49/85/38/943498538.db2.gz GSCZVWHTQZIJOW-LPHOPBHVSA-N 0 3 400.523 4.433 20 0 HIADHN CC(C)Cc1ccc([C@H](CNC(=O)Nc2ccc(C(C)(C)C(N)=O)cc2)N(C)C)cc1 ZINC000558376637 943533463 /nfs/dbraw/zinc/53/34/63/943533463.db2.gz ZTCJNRYDZZNUGI-QFIPXVFZSA-N 0 3 424.589 4.072 20 0 HIADHN Brc1cc(CN[C@H]2c3ccccc3CC23CCOCC3)cc2c1OCO2 ZINC000558486945 943573135 /nfs/dbraw/zinc/57/31/35/943573135.db2.gz GNKYSFXTCCXBSK-FQEVSTJZSA-N 0 3 416.315 4.362 20 0 HIADHN O=C(Nc1cc(CC2CC2)nn1-c1ccccc1)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000558618812 943619128 /nfs/dbraw/zinc/61/91/28/943619128.db2.gz HEBMAXHXHXYIIM-NRFANRHFSA-N 0 3 415.541 4.071 20 0 HIADHN CCC(CC)[C@@H](NC(=O)N1CC[C@H](N2CCN(C(C)C)CC2)C1)c1cccs1 ZINC000558694541 943629471 /nfs/dbraw/zinc/62/94/71/943629471.db2.gz FBZOHRXJKCGNRE-PZJWPPBQSA-N 0 3 406.640 4.035 20 0 HIADHN COCCCn1nccc1CN[C@@H]1CCN(C(C)C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000558781072 943661258 /nfs/dbraw/zinc/66/12/58/943661258.db2.gz KDGWKMQXCGLOJG-RTWAWAEBSA-N 0 3 408.949 4.026 20 0 HIADHN COCCn1ccc2ccc(NC(=O)N[C@H](CN(C)C)c3ccc(Cl)cc3)cc21 ZINC000558785935 943662748 /nfs/dbraw/zinc/66/27/48/943662748.db2.gz USRNTRQEHBKFSN-HXUWFJFHSA-N 0 3 414.937 4.366 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N3CC[C@](F)(c4ccccc4F)C3)cc2)CC1 ZINC000558816377 943676204 /nfs/dbraw/zinc/67/62/04/943676204.db2.gz SUFTURLQHHDBDE-XMMPIXPASA-N 0 3 413.512 4.067 20 0 HIADHN C[C@@H](NC(=O)N[C@@H](CN(C)C)c1ccc(Cl)cc1)c1ccc(-n2cccn2)cc1 ZINC000558887814 943719934 /nfs/dbraw/zinc/71/99/34/943719934.db2.gz JVGJLLGRYHYYMO-IERDGZPVSA-N 0 3 411.937 4.189 20 0 HIADHN CN(C)C[C@H](NC(=O)N[C@@H](c1ccccc1)[C@H]1CCCO1)c1ccc(Cl)cc1 ZINC000558893693 943727155 /nfs/dbraw/zinc/72/71/55/943727155.db2.gz UBMIOIQBQKTFRW-HBMCJLEFSA-N 0 3 401.938 4.162 20 0 HIADHN CCN1CC[C@H](N[C@@H](C)C(=O)Nc2ccnn2C(C)C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000558896591 943730570 /nfs/dbraw/zinc/73/05/70/943730570.db2.gz QFTIZAKYOHJBFK-DCPHZVHLSA-N 0 3 421.948 4.009 20 0 HIADHN CCN1CC[C@H](N[C@H](C)C(=O)Nc2cccc(C)c2C)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000558899309 943733962 /nfs/dbraw/zinc/73/39/62/943733962.db2.gz AQASSLKYDJQFGL-PDXHDDNESA-N 0 3 419.491 4.473 20 0 HIADHN Cc1ccccc1CN(C)C(=O)CN[C@@H]1CCN(C(C)C)[C@H]1c1ccc(F)c(F)c1 ZINC000558899976 943735780 /nfs/dbraw/zinc/73/57/80/943735780.db2.gz ZIISRIQPHWRLQE-VWNXMTODSA-N 0 3 415.528 4.045 20 0 HIADHN CC(C)(C)N1CC[C@H](NCC(=O)NCc2cccs2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000558901331 943735822 /nfs/dbraw/zinc/73/58/22/943735822.db2.gz JDXKSNUBAKDKFE-AZUAARDMSA-N 0 3 423.985 4.361 20 0 HIADHN CSc1cccc(NC(=O)CN[C@H]2CCN(C(C)C)[C@H]2c2ccc(F)c(F)c2)c1 ZINC000558902640 943737524 /nfs/dbraw/zinc/73/75/24/943737524.db2.gz SRJXEXPKYYGJFP-UNMCSNQZSA-N 0 3 419.541 4.439 20 0 HIADHN CN(C)C[C@H](NC(=O)NCc1cccc(OC(C)(C)C)n1)c1ccc(Cl)cc1 ZINC000558936541 943757504 /nfs/dbraw/zinc/75/75/04/943757504.db2.gz VHCCOMHMMFYEMV-SFHVURJKSA-N 0 3 404.942 4.014 20 0 HIADHN CN(C)C[C@@H](NC(=O)c1cccc(COC2CCOCC2)c1)c1ccc(Cl)cc1 ZINC000558970214 943776066 /nfs/dbraw/zinc/77/60/66/943776066.db2.gz DDTFLOOKTYTRKQ-JOCHJYFZSA-N 0 3 416.949 4.068 20 0 HIADHN CN(C)C[C@H](NC(=O)CCCc1nc(-c2cccs2)no1)c1ccc(Cl)cc1 ZINC000558974005 943777999 /nfs/dbraw/zinc/77/79/99/943777999.db2.gz UQMUGKRQBVUCFU-INIZCTEOSA-N 0 3 418.950 4.193 20 0 HIADHN C[C@@H]1C[C@@H](N(C)S(=O)(=O)Cc2ccc(C(F)F)cc2)CCN1Cc1ccccc1 ZINC000559051735 943816017 /nfs/dbraw/zinc/81/60/17/943816017.db2.gz JHBVTZROGHLNNR-UTKZUKDTSA-N 0 3 422.541 4.439 20 0 HIADHN COCCc1ccc(OC[C@H](O)CN2CC=C(c3c(C)[nH]c4ccccc43)CC2)cc1 ZINC000559144538 943853343 /nfs/dbraw/zinc/85/33/43/943853343.db2.gz PNWRLDQSZLREAC-JOCHJYFZSA-N 0 3 420.553 4.194 20 0 HIADHN Cc1csc(CCCC(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)n1 ZINC000559265759 943887926 /nfs/dbraw/zinc/88/79/26/943887926.db2.gz OTQHGEABMBUBCR-UHFFFAOYSA-N 0 3 413.509 4.383 20 0 HIADHN CN(C)c1cc(C(=O)N2CCCN(CCCc3ccccc3)CC2)nc2ccccc21 ZINC000559269379 943888315 /nfs/dbraw/zinc/88/83/15/943888315.db2.gz AIVUVVABPKUYBC-UHFFFAOYSA-N 0 3 416.569 4.082 20 0 HIADHN Cc1cc(C(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)c2nccc(C)c2c1 ZINC000559555987 944003237 /nfs/dbraw/zinc/00/32/37/944003237.db2.gz PUQJLPVFBJTHBT-WOJBJXKFSA-N 0 3 409.574 4.203 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1cc(F)c(OC)cc1F)c1cccc(OC)c1 ZINC000559646620 944024444 /nfs/dbraw/zinc/02/44/44/944024444.db2.gz NHUFYWQZKLZPJZ-LJQANCHMSA-N 0 3 407.461 4.187 20 0 HIADHN O[C@H](CNCc1cc(F)cc(Br)c1)CO[C@H]1CCCc2ccccc21 ZINC000559739299 944041708 /nfs/dbraw/zinc/04/17/08/944041708.db2.gz DOVGRWANXANCIL-QUCCMNQESA-N 0 3 408.311 4.133 20 0 HIADHN C[C@@H](N[C@@H](C)c1cc[nH]c(=O)c1)c1cccc(S(=O)(=O)NC2CCCCCC2)c1 ZINC000559878817 944073094 /nfs/dbraw/zinc/07/30/94/944073094.db2.gz RDONPPWCXOJVBJ-SJORKVTESA-N 0 3 417.575 4.200 20 0 HIADHN COCCOc1ccc([C@H](C)N[C@@H](C)c2ccc(-n3cccn3)c(F)c2)cc1OC ZINC000559897020 944079232 /nfs/dbraw/zinc/07/92/32/944079232.db2.gz FAENORYDCUGGBB-IRXDYDNUSA-N 0 3 413.493 4.457 20 0 HIADHN CN1CCC[C@H](CNC(=O)c2ncoc2C2CC2)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000559908192 944082198 /nfs/dbraw/zinc/08/21/98/944082198.db2.gz IWFKVROXEPQDSN-QAPCUYQASA-N 0 3 407.436 4.384 20 0 HIADHN CCO[C@@H]1C[C@H](N[C@H](C)c2ccc(OC[C@@H]3CCCCO3)c(F)c2)[C@H]1n1cccn1 ZINC000559924023 944086884 /nfs/dbraw/zinc/08/68/84/944086884.db2.gz DSWBPAQPAKTGBM-VTLNNOPKSA-N 0 3 417.525 4.039 20 0 HIADHN NC(=O)[C@@H](NCCCCc1ccc(Cl)s1)c1ccc(Br)cc1 ZINC000559953738 944098694 /nfs/dbraw/zinc/09/86/94/944098694.db2.gz HLBVJOGAOBXTNE-HNNXBMFYSA-N 0 3 401.757 4.303 20 0 HIADHN CC[C@@H]1CCCN1CC(=O)NC[C@H](c1c[nH]c2ccccc21)c1ccc(OC)cc1 ZINC000559986050 944112175 /nfs/dbraw/zinc/11/21/75/944112175.db2.gz LBVAKNMKABIPOK-KNQAVFIVSA-N 0 3 405.542 4.299 20 0 HIADHN CN1CCN(CCCCNC(=O)N[C@H]2CCCCC[C@@H]2c2ccc(Cl)cc2)CC1 ZINC000560092709 944156502 /nfs/dbraw/zinc/15/65/02/944156502.db2.gz YZLYRDQRASKOIG-YADHBBJMSA-N 0 3 421.029 4.083 20 0 HIADHN Cc1ccc(S(=O)(=O)CCCN[C@@H](c2cncc(Br)c2)C2CC2)cc1 ZINC000560180145 944189302 /nfs/dbraw/zinc/18/93/02/944189302.db2.gz KXDDEABJNGKQEP-LJQANCHMSA-N 0 3 423.376 4.057 20 0 HIADHN O=C(CN[C@@H](c1cccc(C(F)(F)F)c1)C1CCOCC1)NCc1ccccc1F ZINC000560182799 944190455 /nfs/dbraw/zinc/19/04/55/944190455.db2.gz YGOSLYXABAZNNR-OAQYLSRUSA-N 0 3 424.438 4.218 20 0 HIADHN COc1ccc(C(=O)N2CCN(c3ccnc4ccccc43)CC2)cc1-c1ccccn1 ZINC000560490481 944238146 /nfs/dbraw/zinc/23/81/46/944238146.db2.gz UJCXPUNVAIQOGX-UHFFFAOYSA-N 0 3 424.504 4.268 20 0 HIADHN CCCN1CCC[C@H]1CN[C@@H](c1cccc(S(C)(=O)=O)c1)c1ccc(C)cc1C ZINC000560583462 944263037 /nfs/dbraw/zinc/26/30/37/944263037.db2.gz YMMLEDDIMSUUPB-URXFXBBRSA-N 0 3 414.615 4.260 20 0 HIADHN C[C@H](N[C@H](CCO)c1ccc(Cl)c(Cl)c1)c1ccc(NS(C)(=O)=O)cc1 ZINC000560584272 944263458 /nfs/dbraw/zinc/26/34/58/944263458.db2.gz ABHSVFUTUOIFNB-KPZWWZAWSA-N 0 3 417.358 4.139 20 0 HIADHN Cc1ccc(-c2nc(C(=O)N(C)CCCN(C)Cc3ccncc3)cs2)c(C)c1 ZINC000560596357 944268517 /nfs/dbraw/zinc/26/85/17/944268517.db2.gz YNHQXTYMCDQBKU-UHFFFAOYSA-N 0 3 408.571 4.416 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1nc(C2CC2)oc1C ZINC000560600143 944269676 /nfs/dbraw/zinc/26/96/76/944269676.db2.gz UCAGVPXZMMMIAG-LJQANCHMSA-N 0 3 405.502 4.065 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)c2cscc2Br)cc1 ZINC000560608256 944272347 /nfs/dbraw/zinc/27/23/47/944272347.db2.gz YHFKFYWUEWUISS-KRWDZBQOSA-N 0 3 409.349 4.086 20 0 HIADHN Cc1cc(NC(=O)[C@H]2CCC(=O)c3ccccc32)cc(N2CCN(C(C)C)CC2)c1 ZINC000560672347 944289360 /nfs/dbraw/zinc/28/93/60/944289360.db2.gz CPLKFEQVFQVCBD-QHCPKHFHSA-N 0 3 405.542 4.224 20 0 HIADHN CCCN(C)[C@H](CNC(=O)c1ccc2c(c1)CCN2C(C)=O)c1ccc(Cl)cc1 ZINC000560709523 944303806 /nfs/dbraw/zinc/30/38/06/944303806.db2.gz HKCAVYPDCJUVDH-JOCHJYFZSA-N 0 3 413.949 4.062 20 0 HIADHN Cn1cc(C(F)(F)F)nc1[C@H]1CCCN(C(=O)c2cccc(CN3CCCC3)c2)C1 ZINC000560855461 944359337 /nfs/dbraw/zinc/35/93/37/944359337.db2.gz LCGYARPJXADDFL-SFHVURJKSA-N 0 3 420.479 4.055 20 0 HIADHN Cc1cc(Br)ccc1NC(=O)CN[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000560890987 944365907 /nfs/dbraw/zinc/36/59/07/944365907.db2.gz HFEWZRBYIZRJML-APWZRJJASA-N 0 3 416.363 4.121 20 0 HIADHN CC(C)OCCCC(=O)N(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000561075286 944430488 /nfs/dbraw/zinc/43/04/88/944430488.db2.gz RBODLRBZHQAGNE-XMMPIXPASA-N 0 3 409.574 4.280 20 0 HIADHN O=C(CC[C@H]1CCCO1)N(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000561075660 944430531 /nfs/dbraw/zinc/43/05/31/944430531.db2.gz UEVBANLXWWGQIS-DNQXCXABSA-N 0 3 407.558 4.034 20 0 HIADHN C[C@H](NCC(=O)N(C)Cc1ccc(Cl)c(Cl)c1)c1ccccc1-n1cccn1 ZINC000561112265 944461212 /nfs/dbraw/zinc/46/12/12/944461212.db2.gz WGJHDQIISHGRMM-HNNXBMFYSA-N 0 3 417.340 4.488 20 0 HIADHN Cc1ccc2nc(C)c(C(=O)N3CCC[C@@H](c4n[nH]cc4CN4CCCC4)C3)cc2c1 ZINC000561284074 944538980 /nfs/dbraw/zinc/53/89/80/944538980.db2.gz BMIJNKFOAREZGC-LJQANCHMSA-N 0 3 417.557 4.190 20 0 HIADHN CCN(C[C@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)c1ccc(C(F)F)cc1 ZINC000561519889 944651602 /nfs/dbraw/zinc/65/16/02/944651602.db2.gz YCTJTHGOMZIHIO-SFHVURJKSA-N 0 3 408.514 4.157 20 0 HIADHN CCc1cc(C(=O)N2CCN(CCCc3ccccc3)C[C@H]2CC(C)C)cc(=O)[nH]1 ZINC000561545888 944667534 /nfs/dbraw/zinc/66/75/34/944667534.db2.gz IOYFQQFPZSXTAN-HSZRJFAPSA-N 0 3 409.574 4.155 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)CCc2cc3ccccc3[nH]c2=O)N(C)C)cc1 ZINC000561638472 944720631 /nfs/dbraw/zinc/72/06/31/944720631.db2.gz OLFFSUBSUNDMGS-HSZRJFAPSA-N 0 3 421.541 4.079 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)c2ccc(NC(=O)[C@@H]3C[C@@H]3C)cc2)N(C)C)cc1 ZINC000561653933 944730583 /nfs/dbraw/zinc/73/05/83/944730583.db2.gz WPZSZAPFEOHIPS-IMRHEYAYSA-N 0 3 423.557 4.101 20 0 HIADHN COCc1c2ccccc2oc1C(=O)NC[C@@H](c1ccc(OC(C)C)cc1)N(C)C ZINC000561676094 944741864 /nfs/dbraw/zinc/74/18/64/944741864.db2.gz ITZOWSMWXIOHKU-NRFANRHFSA-N 0 3 410.514 4.399 20 0 HIADHN C[C@H](Cc1ccccc1C(F)(F)F)N(C)C(=O)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000561740859 944773167 /nfs/dbraw/zinc/77/31/67/944773167.db2.gz PCSVOIIWBYAQQC-XLIONFOSSA-N 0 3 419.491 4.402 20 0 HIADHN COc1ccc(-c2ocnc2C(=O)N(C)C2CCN(Cc3ccccc3)CC2)cc1 ZINC000561744847 944775278 /nfs/dbraw/zinc/77/52/78/944775278.db2.gz UTAHDADSSMZBDW-UHFFFAOYSA-N 0 3 405.498 4.087 20 0 HIADHN Cc1nn(Cc2ccccc2)c2sc(C(=O)N3CC[C@@H](N4CCCC4)[C@@H]3C)cc12 ZINC000561749578 944778396 /nfs/dbraw/zinc/77/83/96/944778396.db2.gz VDOSQXBLUULQNM-FXAWDEMLSA-N 0 3 408.571 4.153 20 0 HIADHN CC(C)Oc1ccc(-c2nc(C(=O)N3CCN([C@H]4C[C@H]4C)C[C@H](C)C3)cs2)cc1 ZINC000561762240 944784682 /nfs/dbraw/zinc/78/46/82/944784682.db2.gz LOELSVJPCCQDDL-FVJLSDCUSA-N 0 3 413.587 4.400 20 0 HIADHN COc1ccc(Br)c(NC(=O)N[C@@H]2CCN(Cc3ccccc3)[C@H]2C)c1 ZINC000561799516 944801304 /nfs/dbraw/zinc/80/13/04/944801304.db2.gz NSTNGYFTUZPTKV-KBXCAEBGSA-N 0 3 418.335 4.242 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)N[C@H]2CCN(Cc3ccccc3)[C@H]2C)c(C)c1 ZINC000561802979 944803587 /nfs/dbraw/zinc/80/35/87/944803587.db2.gz CJFPVBXGGUALHH-YDHSSHFGSA-N 0 3 422.573 4.308 20 0 HIADHN CCCN(C)[C@H](CNC(=O)N1CCC(c2c[nH]nc2C)CC1)c1ccc(Cl)cc1 ZINC000561872178 944829899 /nfs/dbraw/zinc/82/98/99/944829899.db2.gz ZAAHBEOIIOTTKT-OAQYLSRUSA-N 0 3 417.985 4.344 20 0 HIADHN CCN1CCCN(C(=O)c2ccccc2Oc2cccc(Br)c2)CC1 ZINC000561945474 944869820 /nfs/dbraw/zinc/86/98/20/944869820.db2.gz RYCQKMQJIFTAPM-UHFFFAOYSA-N 0 3 403.320 4.409 20 0 HIADHN O=C(Nc1ccccc1)c1nnc(CN(CCN2CCCCCC2)C2CCC2)s1 ZINC000561945984 944870102 /nfs/dbraw/zinc/87/01/02/944870102.db2.gz BDWHZSXNIKCXIW-UHFFFAOYSA-N 0 3 413.591 4.021 20 0 HIADHN Cn1cc(C(F)(F)F)nc1[C@H]1CCCN(Cc2cnc(-c3ccccc3)nc2)C1 ZINC000561957980 944875803 /nfs/dbraw/zinc/87/58/03/944875803.db2.gz YYFGWWABXCIXTH-KRWDZBQOSA-N 0 3 401.436 4.276 20 0 HIADHN CCOC(=O)c1ccn(-c2cccc(CNCc3cc(F)cc(C(F)(F)F)c3)c2)n1 ZINC000561974717 944883060 /nfs/dbraw/zinc/88/30/60/944883060.db2.gz DEMIFMBKIUFQCA-UHFFFAOYSA-N 0 3 421.394 4.497 20 0 HIADHN CCc1nc2ccccc2n1C1CCN(Cc2cc(OC)c3c(c2)OCCO3)CC1 ZINC000561980619 944884491 /nfs/dbraw/zinc/88/44/91/944884491.db2.gz TZUSZIYZHADNRD-UHFFFAOYSA-N 0 3 407.514 4.216 20 0 HIADHN Cc1ccc(CN2CCN(c3nccc4sccc43)CC2)c(-c2cnn(C)c2)c1 ZINC000561983780 944885101 /nfs/dbraw/zinc/88/51/01/944885101.db2.gz XHSYPSPRMBLIKG-UHFFFAOYSA-N 0 3 403.555 4.327 20 0 HIADHN CN(C)[C@@H](CNC(=O)NCc1cc(F)c(C(F)(F)F)cc1F)c1ccccc1 ZINC000562009874 944893472 /nfs/dbraw/zinc/89/34/72/944893472.db2.gz WSQSEKOHZBVUTG-KRWDZBQOSA-N 0 3 401.379 4.086 20 0 HIADHN C[C@@H](CC(=O)Nc1cccc(N2CCCC2)c1)NCc1c(C2CC2)nc2sccn12 ZINC000562012254 944894384 /nfs/dbraw/zinc/89/43/84/944894384.db2.gz QQRQWILAXAUJKE-INIZCTEOSA-N 0 3 423.586 4.380 20 0 HIADHN Cc1c([C@@H](C)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)nnn1-c1ccccc1 ZINC000562056606 944914580 /nfs/dbraw/zinc/91/45/80/944914580.db2.gz BLSXRYSZONUKBC-JPYJTQIMSA-N 0 3 407.562 4.316 20 0 HIADHN C[C@@H](N[C@@H]1CCCN(S(=O)(=O)c2cccs2)C1)c1cccc(C(F)(F)F)c1 ZINC000562055351 944914791 /nfs/dbraw/zinc/91/47/91/944914791.db2.gz WBLAZPADSPSGDH-CZUORRHYSA-N 0 3 418.506 4.271 20 0 HIADHN Cc1cc(C(C)(C)NCC(=O)N[C@H]2CCOc3ccccc32)ccc1Br ZINC000562060396 944916730 /nfs/dbraw/zinc/91/67/30/944916730.db2.gz RTUUZDFQBQIYMS-SFHVURJKSA-N 0 3 417.347 4.222 20 0 HIADHN COC[C@]1(CN[C@H](C)c2cnn(-c3ccc(F)cc3)c2C)OCCc2ccccc21 ZINC000562091047 944933924 /nfs/dbraw/zinc/93/39/24/944933924.db2.gz LVFFNJPVDSLLBF-OSPHWJPCSA-N 0 3 409.505 4.085 20 0 HIADHN Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C ZINC000562141854 944970652 /nfs/dbraw/zinc/97/06/52/944970652.db2.gz GVXCKXWZGIQVJK-PGRDOPGGSA-N 0 3 410.562 4.194 20 0 HIADHN CN(C)C[C@H](NC(=O)Nc1cccc(NC(=O)c2ccoc2)c1)c1ccc(F)cc1 ZINC000562146164 944975201 /nfs/dbraw/zinc/97/52/01/944975201.db2.gz WYTSZGFSRJFJCO-FQEVSTJZSA-N 0 3 410.449 4.095 20 0 HIADHN Cc1ccc(NC(=O)N[C@@H](CN(C)C)c2ccc(F)cc2)c(OC[C@H]2CCCO2)c1 ZINC000562155412 944984067 /nfs/dbraw/zinc/98/40/67/944984067.db2.gz BFEBTNRLFQTFIH-CTNGQTDRSA-N 0 3 415.509 4.116 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1cc(-c2ccc(F)cc2F)nn1C)c1ccco1 ZINC000562276385 945052978 /nfs/dbraw/zinc/05/29/78/945052978.db2.gz DMOMOYBCVIZVMI-UGSOOPFHSA-N 0 3 417.460 4.209 20 0 HIADHN CSc1ccc([C@@H](CNC(=O)Cc2csc(-c3ccccc3)n2)N(C)C)cc1 ZINC000564092303 945376123 /nfs/dbraw/zinc/37/61/23/945376123.db2.gz GWGUBLUUWQSZCG-HXUWFJFHSA-N 0 3 411.596 4.494 20 0 HIADHN Cc1c(NC(=O)N2CCN(C3CCCCC3)CC2)cnn1-c1ccc(Cl)cc1 ZINC000564171277 945416647 /nfs/dbraw/zinc/41/66/47/945416647.db2.gz VWPPGBADPWZKDT-UHFFFAOYSA-N 0 3 401.942 4.316 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)Nc2ccc(OCc3ccncc3)cc2)CCN1Cc1ccccc1 ZINC000564217775 945437231 /nfs/dbraw/zinc/43/72/31/945437231.db2.gz UZQIBLVSUOKTJH-DVECYGJZSA-N 0 3 416.525 4.445 20 0 HIADHN C[C@H]1[C@H](NC(=O)Nc2ccc(OCc3ccncc3)cc2)CCN1Cc1ccccc1 ZINC000564217778 945437576 /nfs/dbraw/zinc/43/75/76/945437576.db2.gz UZQIBLVSUOKTJH-YADARESESA-N 0 3 416.525 4.445 20 0 HIADHN CCOc1ccc(-c2noc([C@@H]3CN(Cc4ccccc4)CCC3(F)F)n2)cn1 ZINC000564226933 945441157 /nfs/dbraw/zinc/44/11/57/945441157.db2.gz CTBWJYMVRDJJHD-KRWDZBQOSA-N 0 3 400.429 4.155 20 0 HIADHN Cc1cc(CN[C@H]2CCCN(Cc3cccc(C(F)(F)F)c3)C2=O)cc(C)c1O ZINC000564303534 945507185 /nfs/dbraw/zinc/50/71/85/945507185.db2.gz DURBBSVNHIDTQF-IBGZPJMESA-N 0 3 406.448 4.309 20 0 HIADHN CCN(Cc1cccc(-c2ccncc2)c1)Cc1ccccc1OCC(=O)N(C)C ZINC000564322437 945515011 /nfs/dbraw/zinc/51/50/11/945515011.db2.gz NQJOHKFIQSXSJB-UHFFFAOYSA-N 0 3 403.526 4.238 20 0 HIADHN OC[C@@]1(Cc2ccc(F)cc2)CCN(Cc2ccccc2OCc2ccncc2)C1 ZINC000564329937 945518262 /nfs/dbraw/zinc/51/82/62/945518262.db2.gz GFDCQFWHMUFJHT-RUZDIDTESA-N 0 3 406.501 4.227 20 0 HIADHN O[C@H]1[C@@H](CNCc2cc(C(F)(F)F)ccc2Br)CCC12CCOCC2 ZINC000564413249 945564534 /nfs/dbraw/zinc/56/45/34/945564534.db2.gz CACKQFMEZCPFEO-WBMJQRKESA-N 0 3 422.285 4.125 20 0 HIADHN COc1cc(CNCc2cccc(-c3nc(CC(F)(F)F)no3)c2)cc(OC)c1 ZINC000564412721 945565055 /nfs/dbraw/zinc/56/50/55/945565055.db2.gz ALGGLNXBACHSCS-UHFFFAOYSA-N 0 3 407.392 4.148 20 0 HIADHN COc1ccc([C@@H](Cc2ccccc2)NCC(=O)N2CCc3ccccc3C2)cc1 ZINC000564414475 945566943 /nfs/dbraw/zinc/56/69/43/945566943.db2.gz KWCUMZGILFHXMK-RUZDIDTESA-N 0 3 400.522 4.154 20 0 HIADHN C[C@]1(NCC(=O)Nc2ccccc2I)CCCc2ccccc21 ZINC000564480112 945614181 /nfs/dbraw/zinc/61/41/81/945614181.db2.gz PFDKQTHRCPYTDJ-IBGZPJMESA-N 0 3 420.294 4.071 20 0 HIADHN CCO[C@H]1C[C@@H](NCC(=O)Nc2c(C)nn(-c3ccc(C)cc3)c2C)C12CCCC2 ZINC000564496774 945625707 /nfs/dbraw/zinc/62/57/07/945625707.db2.gz NEQSJXNIPRDZEJ-RTWAWAEBSA-N 0 3 410.562 4.063 20 0 HIADHN C/C(=C/c1cccc(C(F)(F)F)c1)CNCC(=O)N[C@H]1CCOc2ccccc21 ZINC000564604889 945701892 /nfs/dbraw/zinc/70/18/92/945701892.db2.gz CODONNJQEIYJGW-HVEPWOEZSA-N 0 3 404.432 4.338 20 0 HIADHN CC(C)Oc1ccc([C@H](CNc2cnn(C(C)(C)C)c(=O)c2Cl)N(C)C)cc1 ZINC000564681010 945727573 /nfs/dbraw/zinc/72/75/73/945727573.db2.gz GQPJJQHENUCWSG-SFHVURJKSA-N 0 3 406.958 4.154 20 0 HIADHN CC(C)(CO)[C@H](NCc1cc(Br)c2c(c1)OCCCO2)c1ccccc1 ZINC000564757504 945750582 /nfs/dbraw/zinc/75/05/82/945750582.db2.gz OLMBYCYMRVGIDM-HXUWFJFHSA-N 0 3 420.347 4.460 20 0 HIADHN C[C@H](NCCCOc1ccc(C(F)(F)F)cn1)c1ccc(Br)cn1 ZINC000564783204 945757974 /nfs/dbraw/zinc/75/79/74/945757974.db2.gz CLEVEFAINJWPDJ-NSHDSACASA-N 0 3 404.230 4.378 20 0 HIADHN CC(=O)Nc1cc(C(=O)Nc2cc(C)cc(N3CCN(C(C)C)CC3)c2)ccc1C ZINC000564809679 945761200 /nfs/dbraw/zinc/76/12/00/945761200.db2.gz KHKYLDHTCKNTLV-UHFFFAOYSA-N 0 3 408.546 4.045 20 0 HIADHN CSc1cccc(N(C(=O)c2cccc(-n3cccn3)c2)C2CCN(C)CC2)c1 ZINC000565268030 945797743 /nfs/dbraw/zinc/79/77/43/945797743.db2.gz CFKQVYARWSPCIU-UHFFFAOYSA-N 0 3 406.555 4.335 20 0 HIADHN FC(F)(F)c1ccc(-c2n[nH]cc2CNCc2ccnc(N3CCCC3)c2)cc1 ZINC000565271500 945799145 /nfs/dbraw/zinc/79/91/45/945799145.db2.gz IPICZOZQDLQWDJ-UHFFFAOYSA-N 0 3 401.436 4.381 20 0 HIADHN COC[C@@H](NC(=O)NC[C@H](c1cccs1)N1CCCC1)c1cccc(Cl)c1 ZINC000565278620 945802647 /nfs/dbraw/zinc/80/26/47/945802647.db2.gz WRCCOBXJRNCSFR-QZTJIDSGSA-N 0 3 407.967 4.225 20 0 HIADHN Cc1n[nH]cc1C1CCN(C[C@@H](O)COc2cc(C)c(Cl)cc2C(C)C)CC1 ZINC000565377277 945819471 /nfs/dbraw/zinc/81/94/71/945819471.db2.gz DPMACRGDSFABFS-GOSISDBHSA-N 0 3 405.970 4.423 20 0 HIADHN O=C(Nc1cccc(-c2noc(C3CCN(C4CC4)CC3)n2)c1)c1ccccc1F ZINC000565385786 945822019 /nfs/dbraw/zinc/82/20/19/945822019.db2.gz IYQAMKSWYGOUSE-UHFFFAOYSA-N 0 3 406.461 4.470 20 0 HIADHN CN(C)C[C@H](NC(=O)[C@@H]1C[C@H]1c1ccccc1OC(F)(F)F)c1ccc(F)cc1 ZINC000565441239 945830470 /nfs/dbraw/zinc/83/04/70/945830470.db2.gz FPQLWFZCLFDYGO-KSZLIROESA-N 0 3 410.411 4.247 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)CN(C)C2CCC(F)(F)CC2)c(C(F)(F)F)c1 ZINC000566001599 945969536 /nfs/dbraw/zinc/96/95/36/945969536.db2.gz JLPLGGCPZJMTMJ-UHFFFAOYSA-N 0 3 407.383 4.112 20 0 HIADHN CN1CCN(c2cccc(Cl)c2CNCc2ccc(OC(F)F)c(F)c2)CC1 ZINC000566346334 946006624 /nfs/dbraw/zinc/00/66/24/946006624.db2.gz QMLLVQBOMVPFBC-UHFFFAOYSA-N 0 3 413.871 4.122 20 0 HIADHN Cc1nc2ccc(C(=O)NC[C@@H](c3ccc(OC(C)C)cc3)N(C)C)cc2nc1C ZINC000566520567 946027866 /nfs/dbraw/zinc/02/78/66/946027866.db2.gz UEPMENYVVNNHOH-QHCPKHFHSA-N 0 3 406.530 4.067 20 0 HIADHN CCc1ccccc1OCCC(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000566611581 946055085 /nfs/dbraw/zinc/05/50/85/946055085.db2.gz OEGNGHCKOQACLZ-JOCHJYFZSA-N 0 3 418.541 4.300 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)CSc2nc3ccccc3o2)N(C)C)cc1 ZINC000566670476 946070465 /nfs/dbraw/zinc/07/04/65/946070465.db2.gz YTZMCNMXAVQNIO-LJQANCHMSA-N 0 3 413.543 4.126 20 0 HIADHN COC(=O)[C@H](C)Oc1ccc(CN2CCC(c3noc4cc(F)ccc43)CC2)cc1 ZINC000566789675 946099650 /nfs/dbraw/zinc/09/96/50/946099650.db2.gz PGJFVPDPYSVWJT-HNNXBMFYSA-N 0 3 412.461 4.287 20 0 HIADHN O=C(CCCc1ccccc1)N[C@@H]1CCCN(Cc2cc(-n3ccnc3)cs2)C1 ZINC000567000630 946210573 /nfs/dbraw/zinc/21/05/73/946210573.db2.gz JKUUEVSIILXIEC-HXUWFJFHSA-N 0 3 408.571 4.037 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(Oc2cccnc2)cc1)C(=O)N1CCc2ccccc2C1 ZINC000567021478 946219277 /nfs/dbraw/zinc/21/92/77/946219277.db2.gz XEFADHOZFXAQOJ-RBUKOAKNSA-N 0 3 401.510 4.498 20 0 HIADHN CCC[C@H]1CN(c2nnc(C3CC3)n2C[C@@H]2CCCCO2)CCN1Cc1ccccc1 ZINC000567065283 946229880 /nfs/dbraw/zinc/22/98/80/946229880.db2.gz WIXRXHHRATWTNV-GOTSBHOMSA-N 0 3 423.605 4.216 20 0 HIADHN C[C@]1(C2CC2)NC(=O)N(c2cccc(CN[C@H]3CCc4c3cccc4Cl)c2)C1=O ZINC000567256676 946279929 /nfs/dbraw/zinc/27/99/29/946279929.db2.gz VOCOAOJDQFTJEK-NZQKXSOJSA-N 0 3 409.917 4.342 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1ccnc(Sc2ccccn2)c1)c1ccco1 ZINC000567301044 946301544 /nfs/dbraw/zinc/30/15/44/946301544.db2.gz KHAOLCKKBZHFPA-RDJZCZTQSA-N 0 3 411.531 4.472 20 0 HIADHN C[C@H](Cn1cc(Br)cn1)N[C@H](C)c1ccc(Br)cc1F ZINC000567646631 946390758 /nfs/dbraw/zinc/39/07/58/946390758.db2.gz XJMKHWNIGYROCI-NXEZZACHSA-N 0 3 405.109 4.287 20 0 HIADHN O=C(c1cccc(CN2CCN(c3ccnc4ccccc43)CC2)c1)N1CCCCC1 ZINC000567650775 946392170 /nfs/dbraw/zinc/39/21/70/946392170.db2.gz RUECLVHXXDGROQ-UHFFFAOYSA-N 0 3 414.553 4.183 20 0 HIADHN C[C@H]1[C@@H](NC(=O)c2cnn(-c3ccccc3)c2C2CC2)CCN1Cc1ccccc1 ZINC000567780745 946405673 /nfs/dbraw/zinc/40/56/73/946405673.db2.gz HOODYRKGIKNVRL-MBSDFSHPSA-N 0 3 400.526 4.143 20 0 HIADHN CC1(C)CN(c2nnc(C3CCC3)n2C[C@@H]2CCCCO2)CCN1Cc1ccccc1 ZINC000567904874 946421951 /nfs/dbraw/zinc/42/19/51/946421951.db2.gz RPKWCHXKDFEMBU-QFIPXVFZSA-N 0 3 423.605 4.216 20 0 HIADHN Fc1ccc([C@@H](NCCc2cccc(OCc3ccccc3)c2)c2c[nH]nn2)cc1 ZINC000568083029 946460177 /nfs/dbraw/zinc/46/01/77/946460177.db2.gz CSKMQOLKJGTVNH-XMMPIXPASA-N 0 3 402.473 4.445 20 0 HIADHN CS(=O)(=O)c1cccc(Br)c1NC1CCN(C2CCCCC2)CC1 ZINC000568427974 946539189 /nfs/dbraw/zinc/53/91/89/946539189.db2.gz XPVUVBDLROMPRE-UHFFFAOYSA-N 0 3 415.397 4.062 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)c1ccccc1OCc1csc(C)n1)c1ccco1 ZINC000568642150 946632180 /nfs/dbraw/zinc/63/21/80/946632180.db2.gz XZKJBUXNFGTTTE-KXBFYZLASA-N 0 3 413.543 4.483 20 0 HIADHN Cc1ccccc1[C@H](OC[C@H](O)CN1CC2(CCC2)[C@H]1[C@H]1CCCO1)c1ccccc1 ZINC000568697999 946665742 /nfs/dbraw/zinc/66/57/42/946665742.db2.gz FHHGHNFAGPFSML-VNSJUHMKSA-N 0 3 421.581 4.495 20 0 HIADHN CN(C)C[C@@H](NC(=O)Nc1ccccc1C(=O)N1CCCC1)c1ccc(Cl)cc1 ZINC000568770974 946681959 /nfs/dbraw/zinc/68/19/59/946681959.db2.gz WXFSQZBOFIANDV-HXUWFJFHSA-N 0 3 414.937 4.000 20 0 HIADHN C[C@H](c1ccc(F)cc1)N1CC[C@@H](N[C@H]2c3ccccc3CC23CCOCC3)C1=O ZINC000569007383 946796797 /nfs/dbraw/zinc/79/67/97/946796797.db2.gz WGSYVMQWFCPSKI-ZQMYSKGWSA-N 0 3 408.517 4.171 20 0 HIADHN CSc1ccc([C@H](CNC(=O)c2cnn(-c3ccccn3)c2C(C)C)N(C)C)cc1 ZINC000569285661 946849808 /nfs/dbraw/zinc/84/98/08/946849808.db2.gz WHSBUZXYOQTUHF-FQEVSTJZSA-N 0 3 423.586 4.145 20 0 HIADHN CCN1CC[C@@H](NCc2cnn(C)c2C(F)(F)F)[C@H]1c1ccc(Cl)c(F)c1 ZINC000569359148 946860392 /nfs/dbraw/zinc/86/03/92/946860392.db2.gz DINBGQSHFMQUOM-HZPDHXFCSA-N 0 3 404.839 4.157 20 0 HIADHN CN1CC[C@@H](NCC(=O)Nc2ccccc2Oc2ccccc2)[C@H]1c1ccccc1 ZINC000569386876 946863187 /nfs/dbraw/zinc/86/31/87/946863187.db2.gz POOLJSPQZCCDRV-RCZVLFRGSA-N 0 3 401.510 4.452 20 0 HIADHN CN1CC[C@H](NCC(=O)Nc2ccccc2Oc2ccccc2)[C@H]1c1ccccc1 ZINC000569386878 946863849 /nfs/dbraw/zinc/86/38/49/946863849.db2.gz POOLJSPQZCCDRV-WIOPSUGQSA-N 0 3 401.510 4.452 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)c1cnn(CCC(F)(F)F)c1)c1ccc(Cl)cc1 ZINC000569854972 947020189 /nfs/dbraw/zinc/02/01/89/947020189.db2.gz MCRRLYSZGMBFBP-KRWDZBQOSA-N 0 3 416.875 4.302 20 0 HIADHN CCOc1c(Cl)cc(CN(Cc2ccccc2)C[C@]2(O)CCO[C@H]2C)cc1OC ZINC000569968553 947056769 /nfs/dbraw/zinc/05/67/69/947056769.db2.gz IWIFEFPXEQREOW-GAJHUEQPSA-N 0 3 419.949 4.289 20 0 HIADHN COC(=O)c1cc(CN[C@H](C)c2ccc(OCc3ccccc3)c(OC)c2)cn1C ZINC000569969404 947057263 /nfs/dbraw/zinc/05/72/63/947057263.db2.gz YQWHYYHOBDRGFO-QGZVFWFLSA-N 0 3 408.498 4.250 20 0 HIADHN CC(=O)N(Cc1ccc(NC(=O)N[C@H]2CCN(Cc3ccccc3)[C@H]2C)cc1)C(C)C ZINC000570125017 947103394 /nfs/dbraw/zinc/10/33/94/947103394.db2.gz YKCVMAKHXYFQFE-CYFREDJKSA-N 0 3 422.573 4.228 20 0 HIADHN CCOC(=O)c1c(C)c(C)sc1NC(=O)C[C@@H](C)N[C@H](C)c1cnn(C(C)C)c1 ZINC000570195150 947133083 /nfs/dbraw/zinc/13/30/83/947133083.db2.gz WQPUVENMVKRGND-UKRRQHHQSA-N 0 3 420.579 4.387 20 0 HIADHN COc1cccc(C(=O)NC[C@@H](c2ccc(SC)cc2)N(C)C)c1OC(F)F ZINC000570311934 947190288 /nfs/dbraw/zinc/19/02/88/947190288.db2.gz YLOFXFXROUMHTD-INIZCTEOSA-N 0 3 410.486 4.051 20 0 HIADHN CCOc1cc(CN2CC[C@@H](C(=O)N3CCCC3)C2)ccc1OCc1ccccc1 ZINC000570703085 947330057 /nfs/dbraw/zinc/33/00/57/947330057.db2.gz HYUGRBHCGDHGPG-JOCHJYFZSA-N 0 3 408.542 4.109 20 0 HIADHN C[C@@H]1CCc2c(F)cccc2[C@H]1NCc1cccc(N2C(=O)N[C@@](C)(C3CC3)C2=O)c1 ZINC000570948149 947395821 /nfs/dbraw/zinc/39/58/21/947395821.db2.gz APHHDKSMGLFIQL-FTPHCPBZSA-N 0 3 421.516 4.464 20 0 HIADHN C[C@@H]1CCc2c(F)cccc2[C@@H]1NCc1cccc(N2C(=O)N[C@](C)(C3CC3)C2=O)c1 ZINC000570948152 947396353 /nfs/dbraw/zinc/39/63/53/947396353.db2.gz APHHDKSMGLFIQL-IWIQFXGASA-N 0 3 421.516 4.464 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)c2ccc(Nc3nc(C)cs3)cc2)cc1 ZINC000571191645 947539553 /nfs/dbraw/zinc/53/95/53/947539553.db2.gz SKGOWUWYKWXLRV-HXUWFJFHSA-N 0 3 410.543 4.236 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1ccc2nnc(C(C)C)n2c1)c1cccc(OC)c1 ZINC000571540317 947693274 /nfs/dbraw/zinc/69/32/74/947693274.db2.gz STVOQOJGPGUVFO-FQEVSTJZSA-N 0 3 424.549 4.066 20 0 HIADHN CC(C)C(=O)N1CCC(NCc2cc(C(F)(F)F)ccc2Br)CC1 ZINC000571571539 947705767 /nfs/dbraw/zinc/70/57/67/947705767.db2.gz MYJWEXBDGYUIKB-UHFFFAOYSA-N 0 3 407.274 4.205 20 0 HIADHN CCN1CC[C@H](NCC(=O)Nc2ccc(SC)cc2)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000571584457 947714299 /nfs/dbraw/zinc/71/42/99/947714299.db2.gz XBLNODVMUQKTBO-GHTZIAJQSA-N 0 3 423.504 4.189 20 0 HIADHN Cc1nc(Cc2ccccc2)sc1[C@H](C)NCCn1cc(Br)cn1 ZINC000571588332 947717098 /nfs/dbraw/zinc/71/70/98/947717098.db2.gz HOKWLSYCXWTUBG-ZDUSSCGKSA-N 0 3 405.365 4.352 20 0 HIADHN CC(C)(C)N1C[C@@H](C(=O)Nc2nc(CC(F)(F)F)cs2)[C@H](C(F)(F)F)C1 ZINC000571678144 947744367 /nfs/dbraw/zinc/74/43/67/947744367.db2.gz YMESAEXFQJTUDC-NXEZZACHSA-N 0 3 403.392 4.095 20 0 HIADHN COC(=O)c1ccccc1-c1ccc(CN[C@H]2CCN(C(=O)Nc3ccccc3)C2)o1 ZINC000571704462 947754360 /nfs/dbraw/zinc/75/43/60/947754360.db2.gz YRXQOFXNPJCWCP-SFHVURJKSA-N 0 3 419.481 4.129 20 0 HIADHN Cc1nc2ccccn2c(=O)c1CCN1CCC[C@H]1c1nc2ccccc2n1C(C)C ZINC000571723726 947763999 /nfs/dbraw/zinc/76/39/99/947763999.db2.gz CRSXLHDMWGKVED-QFIPXVFZSA-N 0 3 415.541 4.313 20 0 HIADHN C[C@H](C1CC1)N(Cc1ccccc1)C(=O)CN[C@H]1c2ccccc2CC12CCOCC2 ZINC000571930951 947814582 /nfs/dbraw/zinc/81/45/82/947814582.db2.gz QSUDDYGXUABUIS-IBVKSMDESA-N 0 3 418.581 4.498 20 0 HIADHN Cc1cc(Br)ccc1CN(C)C(=O)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000572079426 947841193 /nfs/dbraw/zinc/84/11/93/947841193.db2.gz KYJQFJUGELJZQQ-IBGZPJMESA-N 0 3 416.363 4.023 20 0 HIADHN Cc1cc(Br)ccc1CN(C)C(=O)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000572079428 947841365 /nfs/dbraw/zinc/84/13/65/947841365.db2.gz KYJQFJUGELJZQQ-LJQANCHMSA-N 0 3 416.363 4.023 20 0 HIADHN COc1ccc2ccc(C(=O)Nc3cccc(CN4CCC(CO)CC4)c3)cc2c1 ZINC000572143502 947849438 /nfs/dbraw/zinc/84/94/38/947849438.db2.gz WPVSZIGTHHNUMQ-UHFFFAOYSA-N 0 3 404.510 4.305 20 0 HIADHN CCN(CC(=O)Nc1c(C#N)c(C)c(C)n1-c1ccccc1)[C@@H]1CCOC(C)(C)C1 ZINC000572289811 947877160 /nfs/dbraw/zinc/87/71/60/947877160.db2.gz RYFVXYBAARWUBD-HXUWFJFHSA-N 0 3 408.546 4.184 20 0 HIADHN C/C(=C/c1ccccc1OC(F)F)CNCc1cccc(S(=O)(=O)NC(C)C)c1 ZINC000572327184 947885963 /nfs/dbraw/zinc/88/59/63/947885963.db2.gz ZDAASWITXIRXNH-WJDWOHSUSA-N 0 3 424.513 4.168 20 0 HIADHN COC(=O)c1csc(-c2cccc(CN[C@H](C)c3ccc4c(c3)CCC(=O)N4)c2)n1 ZINC000572427786 947899889 /nfs/dbraw/zinc/89/98/89/947899889.db2.gz VUAAMQYMCUPNIL-CQSZACIVSA-N 0 3 421.522 4.332 20 0 HIADHN C/C(=C\c1cccc(C(F)(F)F)c1)CNCc1cccnc1N1CCN(C)CC1 ZINC000572439182 947904954 /nfs/dbraw/zinc/90/49/54/947904954.db2.gz OJEOEVHOBFOJKT-GHRIWEEISA-N 0 3 404.480 4.045 20 0 HIADHN CSc1ccc(CN(C)C(=O)CN[C@@H]2c3ccccc3CC23CCOCC3)cc1 ZINC000572611588 947956435 /nfs/dbraw/zinc/95/64/35/947956435.db2.gz JAOFZABFEQYRIN-HSZRJFAPSA-N 0 3 410.583 4.051 20 0 HIADHN CCCN(C)[C@H](CNC(=O)Cc1cc2ccccc2[nH]c1=O)c1ccc(Cl)cc1 ZINC000572708392 947992071 /nfs/dbraw/zinc/99/20/71/947992071.db2.gz JOQDYOSKFMBIFJ-OAQYLSRUSA-N 0 3 411.933 4.336 20 0 HIADHN CN(C)C[C@@H](NC(=O)c1cc(Cl)cc(F)c1Br)c1ccc(F)cc1 ZINC000572913152 948038047 /nfs/dbraw/zinc/03/80/47/948038047.db2.gz SHLZRKDZLSKZGG-OAHLLOKOSA-N 0 3 417.681 4.413 20 0 HIADHN Cc1cc(NC(=O)N2CCCc3occc3C2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000572917143 948039193 /nfs/dbraw/zinc/03/91/93/948039193.db2.gz ABCIFFFJPMWQPU-OAQYLSRUSA-N 0 3 419.529 4.212 20 0 HIADHN CN(C)C[C@@H](NC(=O)c1ccc(NC(=O)c2ccccc2)cc1)c1ccc(F)cc1 ZINC000573011461 948057679 /nfs/dbraw/zinc/05/76/79/948057679.db2.gz ZKXGHGREGCDGTJ-JOCHJYFZSA-N 0 3 405.473 4.111 20 0 HIADHN Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C ZINC000573350331 948162883 /nfs/dbraw/zinc/16/28/83/948162883.db2.gz RCFZRKXTQRKVOH-MBSDFSHPSA-N 0 3 422.573 4.480 20 0 HIADHN CC[C@H](N[C@H]1c2ccccc2CC12CCOCC2)c1ccccc1OCC(=O)N(C)C ZINC000573410956 948197363 /nfs/dbraw/zinc/19/73/63/948197363.db2.gz OTBUBKUANAOZGN-DHLKQENFSA-N 0 3 422.569 4.289 20 0 HIADHN C[C@H](N[C@H]1c2ccccc2CC12CCOCC2)C(=O)Nc1cccc2ncccc21 ZINC000573490946 948217648 /nfs/dbraw/zinc/21/76/48/948217648.db2.gz UXVUDZJHRYCVIS-SBUREZEXSA-N 0 3 401.510 4.246 20 0 HIADHN CC(=O)c1oc2ccccc2c1NC(=O)[C@@H](C)N(C)CCCN(C)Cc1ccco1 ZINC000573512011 948224913 /nfs/dbraw/zinc/22/49/13/948224913.db2.gz PVGOQHAWVIDSRF-MRXNPFEDSA-N 0 3 411.502 4.009 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)c2c[nH]nc2-c2ccccc2F)N(C)C)cc1 ZINC000573671723 948272370 /nfs/dbraw/zinc/27/23/70/948272370.db2.gz ZEFPGGQVXZVFJQ-NRFANRHFSA-N 0 3 410.493 4.036 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)Nc1cc(Cl)ccc1N1CCOCC1)c1ccco1 ZINC000573751922 948288774 /nfs/dbraw/zinc/28/87/74/948288774.db2.gz OECIVWWYXDGEGB-QAPCUYQASA-N 0 3 420.941 4.021 20 0 HIADHN CN1CCO[C@@H]([C@@H](NC[C@H]2CC[C@H](c3ccccc3)O2)c2ccc(Cl)cc2)C1 ZINC000573836753 948306619 /nfs/dbraw/zinc/30/66/19/948306619.db2.gz KCLBMQBYRHMEJH-ODAXIHTASA-N 0 3 400.950 4.222 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)[C@H](C)Oc1ccc(Br)cc1)c1ccco1 ZINC000573875611 948316809 /nfs/dbraw/zinc/31/68/09/948316809.db2.gz VGKMCDHDCKPPKX-ZQIUZPCESA-N 0 3 409.324 4.055 20 0 HIADHN Cc1csc(C(=O)N2CCN(c3ccnc4ccccc43)CC2)c1Br ZINC000574081758 948360789 /nfs/dbraw/zinc/36/07/89/948360789.db2.gz LPTKCYSNXXMWOV-UHFFFAOYSA-N 0 3 416.344 4.330 20 0 HIADHN C[C@@H](NC(=O)c1nc2ccccc2cc1Br)[C@H](c1ccccc1)N(C)C ZINC000574117921 948368847 /nfs/dbraw/zinc/36/88/47/948368847.db2.gz WRBDCBIJKRDVTK-JLTOFOAXSA-N 0 3 412.331 4.419 20 0 HIADHN CCc1ccc([C@@H]2CCCN(Cc3cc(Cl)c(OCC(N)=O)c(OC)c3)C2)cc1 ZINC000574320363 948412439 /nfs/dbraw/zinc/41/24/39/948412439.db2.gz OPZRIOLCRLIGPO-LJQANCHMSA-N 0 3 416.949 4.155 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1cnn(Cc2ccc(Cl)cc2)c1)c1ccco1 ZINC000574349727 948419548 /nfs/dbraw/zinc/41/95/48/948419548.db2.gz WDPWXMXYALFURF-KXBFYZLASA-N 0 3 415.925 4.429 20 0 HIADHN COc1ccc(OC)c(-c2nn(-c3ccccc3)cc2CN(C)[C@H]2CCCOC2)c1 ZINC000574438257 948442294 /nfs/dbraw/zinc/44/22/94/948442294.db2.gz HNRLMKSIRMLIQD-FQEVSTJZSA-N 0 3 407.514 4.167 20 0 HIADHN Cc1cc(CNCc2ccccc2CN2C(=O)NC3(CCCCC3)C2=O)cc(C)c1O ZINC000574438909 948442655 /nfs/dbraw/zinc/44/26/55/948442655.db2.gz FMWJGWCDZUAGHA-UHFFFAOYSA-N 0 3 421.541 4.054 20 0 HIADHN CSc1ccc([C@@H](CNC(=O)c2cn(C)nc2C2CCCCC2)N(C)C)cc1 ZINC000574549725 948469039 /nfs/dbraw/zinc/46/90/39/948469039.db2.gz GBTSHHXCJOBHCC-HXUWFJFHSA-N 0 3 400.592 4.222 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)CCc2nc(-c3ccc(Cl)cc3)no2)CCN1Cc1ccccc1 ZINC000574716508 948510146 /nfs/dbraw/zinc/51/01/46/948510146.db2.gz BSACDGFESPLTQI-UZLBHIALSA-N 0 3 424.932 4.102 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1ccc(F)c(C(=O)OC)c1F)c1ccsc1 ZINC000574849241 948543688 /nfs/dbraw/zinc/54/36/88/948543688.db2.gz KPIOMJWTAVZUTJ-HNNXBMFYSA-N 0 3 411.474 4.018 20 0 HIADHN CN(C)C[C@H](NC(=O)Nc1ccc(-n2cccn2)c(F)c1)c1ccc(Cl)cc1 ZINC000574904743 948550299 /nfs/dbraw/zinc/55/02/99/948550299.db2.gz FYARCTJWOJCZLM-SFHVURJKSA-N 0 3 401.873 4.089 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)c1nccnc1-c1nc2ccccc2s1)c1ccco1 ZINC000575016600 948573258 /nfs/dbraw/zinc/57/32/58/948573258.db2.gz YKXVCLGIVRWKNA-ZBFHGGJFSA-N 0 3 421.526 4.206 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)c1nccnc1-c1nc2ccccc2s1)c1ccco1 ZINC000575016597 948573381 /nfs/dbraw/zinc/57/33/81/948573381.db2.gz YKXVCLGIVRWKNA-GDBMZVCRSA-N 0 3 421.526 4.206 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)c1ccc(OCc2ccncc2)cc1 ZINC000575035430 948581160 /nfs/dbraw/zinc/58/11/60/948581160.db2.gz MASAPIPHGPWYNR-OAQYLSRUSA-N 0 3 415.537 4.397 20 0 HIADHN CC[C@@H]1CC[C@@H](C)N1CC(=O)N(Cc1nnc(-c2ccccc2Cl)o1)C1CC1 ZINC000575080000 948586350 /nfs/dbraw/zinc/58/63/50/948586350.db2.gz XUVTWEMIGOHKQF-HUUCEWRRSA-N 0 3 402.926 4.144 20 0 HIADHN COc1cccc(NC2CCN(CCCC(=O)Nc3ccccc3C(C)=O)CC2)c1 ZINC000575430403 948665996 /nfs/dbraw/zinc/66/59/96/948665996.db2.gz FZJGYDKBJSKROM-UHFFFAOYSA-N 0 3 409.530 4.193 20 0 HIADHN CC(=O)N1C[C@@H]2CCC[C@H](N[C@H](C(=O)c3c[nH]c4ccccc34)c3ccccc3)[C@@H]2C1 ZINC000575903202 948766129 /nfs/dbraw/zinc/76/61/29/948766129.db2.gz SNTMZQMXJHXADS-UOYQKJQJSA-N 0 3 415.537 4.329 20 0 HIADHN C[C@@H]1CN(c2cc(-c3ccc(Cl)nc3)ccc2C2OCCCO2)[C@@H](C)CN1C ZINC001164632850 719225460 /nfs/dbraw/zinc/22/54/60/719225460.db2.gz BXRHGZXKDZARLW-CVEARBPZSA-N 0 3 401.938 4.366 20 0 HIADHN Clc1cc2c(Cl)ccnc2c(N2CC[C@@H]3[C@H]2CCN3Cc2cccnc2)n1 ZINC001164727142 720378319 /nfs/dbraw/zinc/37/83/19/720378319.db2.gz QMUUMLYTZZGYEO-IAGOWNOFSA-N 0 3 400.313 4.185 20 0 HIADHN Fc1ccc(F)c2c(N3CC[C@@H]4[C@@H]3CCN4Cc3cccnc3)cc(Cl)nc12 ZINC001164727660 720480866 /nfs/dbraw/zinc/48/08/66/720480866.db2.gz NRMYJYQHMKUHGB-SJORKVTESA-N 0 3 400.860 4.415 20 0 HIADHN FC(F)(c1cc(Cl)ncc1Cl)N1CCCn2cnc(CNC3CCC3)c2C1 ZINC001164837468 720736425 /nfs/dbraw/zinc/73/64/25/720736425.db2.gz KRKAGSDVIRYBES-UHFFFAOYSA-N 0 3 416.303 4.182 20 0 HIADHN Clc1cc(-c2ccccc2)cc(N2CCN3C[C@H](OCc4cccnc4)C[C@H]3C2)n1 ZINC001164863447 721085772 /nfs/dbraw/zinc/08/57/72/721085772.db2.gz CIFXWCIJBGOLQK-FCHUYYIVSA-N 0 3 420.944 4.277 20 0 HIADHN CN(Cc1ccc(N2CCC3(CCC(CC(=O)N4CC=CC4)CC3)CC2)nc1)C1CC1 ZINC001164778041 721328729 /nfs/dbraw/zinc/32/87/29/721328729.db2.gz TUXREUZAUCESBU-UHFFFAOYSA-N 0 3 422.617 4.241 20 0 HIADHN Cc1noc(C)c1CN1CCOC[C@@]2(CCCN(c3nc(C)cc4ccccc43)C2)C1 ZINC001164787068 721359605 /nfs/dbraw/zinc/35/96/05/721359605.db2.gz YDVCYFUVHNAKKP-VWLOTQADSA-N 0 3 420.557 4.267 20 0 HIADHN Cc1cc2c(nc(Cl)nc2N2CCN3C[C@@H](Oc4cccc(F)c4)C[C@@H]3C2)s1 ZINC001164899195 721525086 /nfs/dbraw/zinc/52/50/86/721525086.db2.gz KREHVAYGURNIQK-ZBFHGGJFSA-N 0 3 418.925 4.134 20 0 HIADHN Cc1cc(-c2cccc(F)c2)nnc1N1CCN2C[C@H](Oc3cccc(F)c3)C[C@@H]2C1 ZINC001164911671 721564188 /nfs/dbraw/zinc/56/41/88/721564188.db2.gz ZKOOGEFEHYKWIK-IFMALSPDSA-N 0 3 422.479 4.072 20 0 HIADHN Cc1cc2c(ncnc2N2CCC(F)(F)[C@]3(CCN(Cc4ccccn4)C3)C2)s1 ZINC001164903804 721583643 /nfs/dbraw/zinc/58/36/43/721583643.db2.gz NXVIEGWKKDCTLG-FQEVSTJZSA-N 0 3 415.513 4.132 20 0 HIADHN Cc1cncc(COC[C@]23CCC[C@@H]2CN(c2ccc(CN4CCCC4)cn2)C3)c1 ZINC001164804328 721601519 /nfs/dbraw/zinc/60/15/19/721601519.db2.gz YHBWPYBFWRMFIV-ILBGXUMGSA-N 0 3 406.574 4.204 20 0 HIADHN CC(C)Oc1cccc(N2CCC(F)(F)[C@@]3(CCN(Cc4ccccn4)C3)C2)n1 ZINC001164907799 721709490 /nfs/dbraw/zinc/70/94/90/721709490.db2.gz UESLJBYEVJCQDH-OAQYLSRUSA-N 0 3 402.489 4.002 20 0 HIADHN CSc1cnc(N2CCC(F)(F)[C@]3(CCN(Cc4ccccn4)C3)C2)c(C)c1 ZINC001164906102 721719884 /nfs/dbraw/zinc/71/98/84/721719884.db2.gz JYKJGYOZZDLANZ-FQEVSTJZSA-N 0 3 404.530 4.245 20 0 HIADHN CSCc1ccc(N2CCC(F)(F)[C@]3(CCN(Cc4ccccn4)C3)C2)nc1 ZINC001164911158 721730482 /nfs/dbraw/zinc/73/04/82/721730482.db2.gz IIEJTXAIEAKJOD-FQEVSTJZSA-N 0 3 404.530 4.077 20 0 HIADHN Cc1ccc2nc(Cl)cc(N3CC[C@@H]4CN(Cc5cccnc5)CCO[C@@H]4C3)c2c1 ZINC001164979812 722109628 /nfs/dbraw/zinc/10/96/28/722109628.db2.gz QFNOEGNXMHMGTB-AUSIDOKSSA-N 0 3 422.960 4.319 20 0 HIADHN Clc1cccc2nc(N3CC[C@@H]4CN(Cc5cccnc5)CCO[C@@H]4C3)ccc12 ZINC001164983718 722114497 /nfs/dbraw/zinc/11/44/97/722114497.db2.gz ZERYWFLWBZGCMM-XMSQKQJNSA-N 0 3 408.933 4.011 20 0 HIADHN CC(C)c1nc(N2CC[C@@H]3CN(Cc4cccnc4)CCO[C@H]3C2)cc(C(C)(C)C)n1 ZINC001164977986 722148089 /nfs/dbraw/zinc/14/80/89/722148089.db2.gz JBDYSLCFLXTQFF-RTWAWAEBSA-N 0 3 423.605 4.020 20 0 HIADHN COC(=O)c1ccc2c(ccnc2N2CCC[C@]3(CCN3Cc3cccc(F)c3)C2)c1 ZINC001164993634 722197935 /nfs/dbraw/zinc/19/79/35/722197935.db2.gz GAMSFXJHWKVXBH-VWLOTQADSA-N 0 3 419.500 4.405 20 0 HIADHN Cc1nc(-c2ccncc2)cc(N2CCC[C@]3(CCN3Cc3cccc(F)c3)C2)n1 ZINC001164997291 722210072 /nfs/dbraw/zinc/21/00/72/722210072.db2.gz YQRRSYHQZWVEFD-DEOSSOPVSA-N 0 3 403.505 4.231 20 0 HIADHN O=C(N[C@@H]1CCN(Cc2ccccc2)C1)C1(c2cc(F)cc(C(F)(F)F)c2)CC1 ZINC000435935160 861197560 /nfs/dbraw/zinc/19/75/60/861197560.db2.gz BUJNDCFIFVPCSO-LJQANCHMSA-N 0 3 406.423 4.267 20 0 HIADHN Cc1c(NC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)cnn1-c1ccccc1F ZINC000435983428 861254718 /nfs/dbraw/zinc/25/47/18/861254718.db2.gz YWUMLEYWYOBZIG-SFHVURJKSA-N 0 3 410.468 4.310 20 0 HIADHN CSc1c(F)cccc1C(=O)NCCCCN1CCN(c2cccc(C)c2)CC1 ZINC000436079611 861360689 /nfs/dbraw/zinc/36/06/89/861360689.db2.gz GBDISEJXPMCAJW-UHFFFAOYSA-N 0 3 415.578 4.188 20 0 HIADHN CC[C@@H](C)[C@H](NC(=O)Nc1ccc(N2CCN(CC)CC2)cc1C)C(F)(F)F ZINC000436093027 861374705 /nfs/dbraw/zinc/37/47/05/861374705.db2.gz YENYMDWFKJGAKH-KDOFPFPSSA-N 0 3 400.489 4.235 20 0 HIADHN CCn1cc(C(=O)NC[C@@H](c2ccccc2)N2CCC(C)CC2)c(C(F)(F)F)n1 ZINC000436130539 861419063 /nfs/dbraw/zinc/41/90/63/861419063.db2.gz XPJBCPYPWCURBO-SFHVURJKSA-N 0 3 408.468 4.125 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)CSc3nc4ccccc4s3)cc2)CC1 ZINC000006246612 845185474 /nfs/dbraw/zinc/18/54/74/845185474.db2.gz PIPCAPZJKMSIOQ-UHFFFAOYSA-N 0 3 412.584 4.169 20 0 HIADHN CC(C)[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)NCc1ccccc1CN(C)C ZINC000006992666 845232997 /nfs/dbraw/zinc/23/29/97/845232997.db2.gz GCOYFOCKQASPSU-QHCPKHFHSA-N 0 3 423.601 4.117 20 0 HIADHN CCc1ccc([C@@H](NCC(=O)Nc2ccc(CN3CCOCC3)cc2)C(C)C)cc1 ZINC000007873013 845437370 /nfs/dbraw/zinc/43/73/70/845437370.db2.gz HURSWIZRNKCYKQ-VWLOTQADSA-N 0 3 409.574 4.007 20 0 HIADHN O=C(CN1CCC[C@H]1C1CCC1)N(Cc1nnc(-c2ccccc2Cl)o1)C1CC1 ZINC000436259842 861571066 /nfs/dbraw/zinc/57/10/66/861571066.db2.gz LRWFKXSNSUWJCF-IBGZPJMESA-N 0 3 414.937 4.146 20 0 HIADHN C[C@@H]1CCCN(S(=O)(=O)c2ccc(CNCc3cc4c(cccc4F)[nH]3)cc2)C1 ZINC000436277623 861585114 /nfs/dbraw/zinc/58/51/14/861585114.db2.gz YNDJZVQSASMLQV-MRXNPFEDSA-N 0 3 415.534 4.017 20 0 HIADHN O=C([C@@H]1CC[C@H](N[C@@H]2CCc3c2c(Br)ccc3F)C1)N1CCCCC1 ZINC000436294276 861600494 /nfs/dbraw/zinc/60/04/94/861600494.db2.gz FHJVBITZMATGJV-QWQRMKEZSA-N 0 3 409.343 4.346 20 0 HIADHN CCN1CCN(c2ccc(NCc3cnn(Cc4ccc(F)cc4)c3)c(C)c2)CC1 ZINC000436291956 861597806 /nfs/dbraw/zinc/59/78/06/861597806.db2.gz RFPPZLPERRAIAM-UHFFFAOYSA-N 0 3 407.537 4.133 20 0 HIADHN O=C1c2ccccc2C(=O)N1C1CCC(NCc2ncoc2-c2ccccc2)CC1 ZINC000436302484 861606350 /nfs/dbraw/zinc/60/63/50/861606350.db2.gz AMICBXKKZGUJLR-UHFFFAOYSA-N 0 3 401.466 4.039 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Cc3csc(-c4cccc(C)c4)n3)cc2)CC1 ZINC000011949279 845842816 /nfs/dbraw/zinc/84/28/16/845842816.db2.gz SSEQYDDHZCHKAE-UHFFFAOYSA-N 0 3 420.582 4.442 20 0 HIADHN O=C(N[C@H]1CCN(Cc2ccccc2)C1)c1cc(-c2ccccn2)nc2ccccc21 ZINC000013049034 845903934 /nfs/dbraw/zinc/90/39/34/845903934.db2.gz OZHHOXCIDVOXOG-FQEVSTJZSA-N 0 3 408.505 4.301 20 0 HIADHN COc1ccc([C@@H](CNC(=O)c2c[nH]nc2-c2ccc(Cl)cc2)N2CCCC2)cc1 ZINC000014050932 845920936 /nfs/dbraw/zinc/92/09/36/845920936.db2.gz KBGSQOBUGCSXMT-OAQYLSRUSA-N 0 3 424.932 4.306 20 0 HIADHN Cc1nn(Cc2ccc(F)cc2)c(Cl)c1C(=O)NC[C@H](c1ccccc1)N(C)C ZINC000014061967 845921736 /nfs/dbraw/zinc/92/17/36/845921736.db2.gz METPWLAGCWSSJM-LJQANCHMSA-N 0 3 414.912 4.065 20 0 HIADHN C[C@@H]1[C@H](NC(=O)N[C@H](CC(F)(F)F)c2ccc(C(F)(F)F)cc2)CCCN1C ZINC000436326783 861630461 /nfs/dbraw/zinc/63/04/61/861630461.db2.gz FCMCVJFSBJWBBZ-KCPJHIHWSA-N 0 3 411.390 4.481 20 0 HIADHN COc1ccc(CCNCc2c(C)nn(-c3ccc(F)cc3)c2Cl)cc1OC ZINC000017310869 846243974 /nfs/dbraw/zinc/24/39/74/846243974.db2.gz RCLCBGZGYXOQJY-UHFFFAOYSA-N 0 3 403.885 4.323 20 0 HIADHN CCOc1ccc(OCC(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)cc1 ZINC000018186136 846307190 /nfs/dbraw/zinc/30/71/90/846307190.db2.gz RYOUTSLCXPJTBU-HXUWFJFHSA-N 0 3 402.560 4.115 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cnc4onc(C(C)C)c4c3)c(C)c2)CC1 ZINC000021465209 846448663 /nfs/dbraw/zinc/44/86/63/846448663.db2.gz DPZFWDLJEKOZHR-UHFFFAOYSA-N 0 3 407.518 4.049 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)c1cnn(Cc2ccccc2Cl)c1 ZINC000022464031 846574528 /nfs/dbraw/zinc/57/45/28/846574528.db2.gz OFKGZORFPPZJDH-QFIPXVFZSA-N 0 3 408.933 4.152 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Cc1cc(Cl)ccc1OC)c1cccc(OC)c1 ZINC000022700806 846606517 /nfs/dbraw/zinc/60/65/17/846606517.db2.gz VPCQVEGTZFVGRJ-FQEVSTJZSA-N 0 3 404.938 4.099 20 0 HIADHN CN(CC(=O)N(Cc1cccs1)c1ccc2c(c1)OCCO2)C1CCCCC1 ZINC000023259030 846676491 /nfs/dbraw/zinc/67/64/91/846676491.db2.gz YVYASVPXBQWZCK-UHFFFAOYSA-N 0 3 400.544 4.317 20 0 HIADHN COc1ccc(C(=O)NC[C@H](c2ccccc2)N2CCCC2)cc1Br ZINC000023739743 846744409 /nfs/dbraw/zinc/74/44/09/846744409.db2.gz MOZNODYXXRNDIQ-GOSISDBHSA-N 0 3 403.320 4.025 20 0 HIADHN COc1ccc(-c2nc(C(=O)NC[C@H](c3ccccc3)N3CCCC3)cs2)cc1 ZINC000023740476 846744733 /nfs/dbraw/zinc/74/47/33/846744733.db2.gz ASYLVUFAEVXOOP-OAQYLSRUSA-N 0 3 407.539 4.386 20 0 HIADHN C[C@@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)NC[C@H](c1ccccc1)N1CCCC1 ZINC000023737688 846744747 /nfs/dbraw/zinc/74/47/47/846744747.db2.gz LZKGZECADWEWJQ-AUSIDOKSSA-N 0 3 421.585 4.056 20 0 HIADHN O[C@@H](COc1ccc(Cl)cc1Cl)CN1CCC[C@@H]1c1ccc2c(c1)OCCO2 ZINC000025227901 846944951 /nfs/dbraw/zinc/94/49/51/846944951.db2.gz WTQNHUXGOXBNPE-SJLPKXTDSA-N 0 3 424.324 4.341 20 0 HIADHN CCN(Cc1ccc(OC)c(OC)c1)C[C@@H](O)COc1c(Cl)cccc1Cl ZINC000025234733 846945463 /nfs/dbraw/zinc/94/54/63/846945463.db2.gz RBJPTJKCHANCSD-OAHLLOKOSA-N 0 3 414.329 4.272 20 0 HIADHN CC(C)(CNC(=O)CCc1ncc(-c2ccccc2F)o1)N1CCc2ccccc2C1 ZINC000025464137 846981778 /nfs/dbraw/zinc/98/17/78/846981778.db2.gz KMASBIDMILNYNR-UHFFFAOYSA-N 0 3 421.516 4.366 20 0 HIADHN Cc1nc(-c2c[nH]c(C(=O)NC[C@@H](C(C)C)N3CCc4ccccc4C3)c2)cs1 ZINC000025538569 846995831 /nfs/dbraw/zinc/99/58/31/846995831.db2.gz OWLDMZHEACNCSR-QFIPXVFZSA-N 0 3 408.571 4.259 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cc(F)ccc1Br)c1cccc(OC)c1 ZINC000025861366 847047400 /nfs/dbraw/zinc/04/74/00/847047400.db2.gz HTARWGVCDMMTRS-LJQANCHMSA-N 0 3 423.326 4.410 20 0 HIADHN CC(C)[C@H](CNC(=O)Cc1coc(-c2ccccc2)n1)N1CCc2ccccc2C1 ZINC000025918598 847057220 /nfs/dbraw/zinc/05/72/20/847057220.db2.gz FBKZEOYKSJURFS-QHCPKHFHSA-N 0 3 403.526 4.083 20 0 HIADHN CCS(=O)(=O)c1c(Cl)cccc1CNCCc1cn(C)c2cc(C)ccc12 ZINC000436413201 861765199 /nfs/dbraw/zinc/76/51/99/861765199.db2.gz UGPQJJIJGCZFFL-UHFFFAOYSA-N 0 3 404.963 4.266 20 0 HIADHN C/C=C/c1ccc(OCC(=O)Nc2ccc(N3CCN(CC)CC3)cc2C)c(OC)c1 ZINC000026909278 847221109 /nfs/dbraw/zinc/22/11/09/847221109.db2.gz BDZKZPMDVWAHIV-FNORWQNLSA-N 0 3 423.557 4.196 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)c3cc(Cl)nc(Cl)c3)CC2)c1 ZINC000026958204 847226482 /nfs/dbraw/zinc/22/64/82/847226482.db2.gz QVGATTQTBKGSPX-UHFFFAOYSA-N 0 3 421.372 4.029 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)C3(c4ccccc4)CCC3)CC2)c1 ZINC000026961239 847226571 /nfs/dbraw/zinc/22/65/71/847226571.db2.gz OERCVUUCJFCAKD-UHFFFAOYSA-N 0 3 405.586 4.135 20 0 HIADHN O=S1(=O)CCCN1c1ccc(CNCc2cc(Cl)cc(C(F)(F)F)c2)cc1 ZINC000436414270 861767232 /nfs/dbraw/zinc/76/72/32/861767232.db2.gz RDZAXRDMISJADW-UHFFFAOYSA-N 0 3 418.868 4.189 20 0 HIADHN Cc1cc(CSc2ncccc2C(=O)NC[C@H](c2ccccc2)N2CCCC2)no1 ZINC000027602700 847325885 /nfs/dbraw/zinc/32/58/85/847325885.db2.gz WUEKAEPZRUMRNG-OAQYLSRUSA-N 0 3 422.554 4.237 20 0 HIADHN CC(C)c1c(C(=O)N[C@H](C)CN2CCCCC2)cnn1-c1ccc(C(F)(F)F)cn1 ZINC000027766697 847348537 /nfs/dbraw/zinc/34/85/37/847348537.db2.gz TVUCVEAXDHDVBS-OAHLLOKOSA-N 0 3 423.483 4.014 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cc(C4CC4)nc4onc(C)c43)c(C)c2)CC1 ZINC000028841932 847468250 /nfs/dbraw/zinc/46/82/50/847468250.db2.gz ZDGYKBSEUUCUAC-UHFFFAOYSA-N 0 3 419.529 4.111 20 0 HIADHN COc1cc(CN(C)CCC(=O)NCc2ccccc2Cl)ccc1OC(F)F ZINC000028852854 847469416 /nfs/dbraw/zinc/46/94/16/847469416.db2.gz QPEYUZMTNRUGIT-UHFFFAOYSA-N 0 3 412.864 4.088 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cc4ccc(F)cc4nc3C)c(C)c2)CC1 ZINC000028955030 847483622 /nfs/dbraw/zinc/48/36/22/847483622.db2.gz FKBGANGLFFGBKO-UHFFFAOYSA-N 0 3 406.505 4.385 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)c1ccc(-n2cnc3ccccc32)cc1 ZINC000029173875 847519095 /nfs/dbraw/zinc/51/90/95/847519095.db2.gz PJUNWPMAWDXHSZ-UHFFFAOYSA-N 0 3 400.482 4.348 20 0 HIADHN Cc1nc2c(cnn2C(C)C)cc1C(=O)NC[C@@H](C(C)C)N1CCc2ccccc2C1 ZINC000029174301 847519339 /nfs/dbraw/zinc/51/93/39/847519339.db2.gz ARVHXYBFYSCPBA-QHCPKHFHSA-N 0 3 419.573 4.133 20 0 HIADHN CC(C)n1ncc2c1nc(C1CC1)cc2C(=O)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000029178881 847520822 /nfs/dbraw/zinc/52/08/22/847520822.db2.gz DBGMHRLBUGYLDH-QHCPKHFHSA-N 0 3 417.557 4.457 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)c1cc(Cl)ccc1Br ZINC000029370464 847553846 /nfs/dbraw/zinc/55/38/46/847553846.db2.gz GYLKFESCYRUNQU-UHFFFAOYSA-N 0 3 417.800 4.194 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)c1cc(-c2ccncc2)nc2ccccc21 ZINC000029839107 847629334 /nfs/dbraw/zinc/62/93/34/847629334.db2.gz GNSGYHZKEUDWEJ-UHFFFAOYSA-N 0 3 422.532 4.475 20 0 HIADHN CC[C@H](CNC(=O)c1ccc(OCc2cccnc2)cc1)N1CCc2ccccc2C1 ZINC000029913022 847649046 /nfs/dbraw/zinc/64/90/46/847649046.db2.gz QGAGXFWSEYTRAK-XMMPIXPASA-N 0 3 415.537 4.227 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cccc(Nc2ncccn2)c1)c1cccc(OC)c1 ZINC000030622355 847746533 /nfs/dbraw/zinc/74/65/33/847746533.db2.gz SUXIFHMUFRJCFO-JOCHJYFZSA-N 0 3 419.529 4.042 20 0 HIADHN CCOCc1ccccc1CNCc1cn(C)nc1-c1ccc2c(c1)OCCCO2 ZINC000030630890 847748419 /nfs/dbraw/zinc/74/84/19/847748419.db2.gz AFFIRAKWXMQYQL-UHFFFAOYSA-N 0 3 407.514 4.075 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2ccc3c(c2)CN(CC(F)F)C3)N(C)C)cc1 ZINC000436499579 861825688 /nfs/dbraw/zinc/82/56/88/861825688.db2.gz XPZTZEHKUUPKKO-FQEVSTJZSA-N 0 3 402.489 4.000 20 0 HIADHN CNC(=O)c1ccc(CNCc2cn(Cc3ccccc3)nc2-c2cccs2)cc1 ZINC000030672013 847756187 /nfs/dbraw/zinc/75/61/87/847756187.db2.gz PNVHPPGRERTSLI-UHFFFAOYSA-N 0 3 416.550 4.309 20 0 HIADHN c1ncn(Cc2ccccc2CNCc2cn(-c3ccccc3)nc2-c2ccccc2)n1 ZINC000030900858 847794221 /nfs/dbraw/zinc/79/42/21/847794221.db2.gz QGGUKJOCRODMEM-UHFFFAOYSA-N 0 3 420.520 4.469 20 0 HIADHN O[C@H](CNCc1ccc(-c2nc3ccccc3s2)o1)CN1CCc2ccccc2C1 ZINC000030904026 847795401 /nfs/dbraw/zinc/79/54/01/847795401.db2.gz PJQSMMOBFVVICF-LJQANCHMSA-N 0 3 419.550 4.065 20 0 HIADHN c1cnn(-c2ncccc2CNCc2cn(Cc3ccccc3)nc2-c2ccccc2)c1 ZINC000030902297 847795653 /nfs/dbraw/zinc/79/56/53/847795653.db2.gz BYDKZWBWUBTBBM-UHFFFAOYSA-N 0 3 420.520 4.469 20 0 HIADHN COc1cc(CNCc2cccnc2-n2cccn2)ccc1OCc1cccs1 ZINC000030902206 847795735 /nfs/dbraw/zinc/79/57/35/847795735.db2.gz LJBZCQAMNGUPKO-UHFFFAOYSA-N 0 3 406.511 4.206 20 0 HIADHN O=C(NCc1ccc(OC(F)(F)F)cc1)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000030989057 847805702 /nfs/dbraw/zinc/80/57/02/847805702.db2.gz ZFMAFJPDJSKJLF-IBGZPJMESA-N 0 3 407.436 4.222 20 0 HIADHN COc1ccc2cc(CNC(=O)NC[C@@H](c3ccccc3)N3CCCC3)ccc2c1 ZINC000030989085 847805924 /nfs/dbraw/zinc/80/59/24/847805924.db2.gz YZRBCTCVBXJFOC-DEOSSOPVSA-N 0 3 403.526 4.485 20 0 HIADHN Cc1nc2ccccc2c(=O)n1-c1ccc(C(=O)Nc2ccccc2CN(C)C)cc1 ZINC000031232545 847848087 /nfs/dbraw/zinc/84/80/87/847848087.db2.gz QQHYHEHADLMQGZ-UHFFFAOYSA-N 0 3 412.493 4.008 20 0 HIADHN COc1ccc(C(=O)N2CCCN(Cc3ccccc3C)CC2)cc1Br ZINC000031766199 847944789 /nfs/dbraw/zinc/94/47/89/847944789.db2.gz ZVUCCGMWTIOJAE-UHFFFAOYSA-N 0 3 417.347 4.114 20 0 HIADHN Cc1ccc(-c2nc(CC(=O)NCC3(N4CCSCC4)CCCC3)cs2)cc1 ZINC000031959760 847971492 /nfs/dbraw/zinc/97/14/92/847971492.db2.gz QMILPBPXHIARHZ-UHFFFAOYSA-N 0 3 415.628 4.139 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cnn(-c2ccc(F)cc2)c1C)c1ccsc1 ZINC000031983928 847975034 /nfs/dbraw/zinc/97/50/34/847975034.db2.gz LPDMJZWVYLTMNB-FQEVSTJZSA-N 0 3 400.523 4.194 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cnn(-c2ccccn2)c1C(C)C)c1ccsc1 ZINC000031983069 847975064 /nfs/dbraw/zinc/97/50/64/847975064.db2.gz HDNWAZHEKGLWCB-IBGZPJMESA-N 0 3 411.575 4.265 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)CCc3cc4ccccc4o3)CC2)c1 ZINC000032066627 847985250 /nfs/dbraw/zinc/98/52/50/847985250.db2.gz QMVSLJGKZYVURP-UHFFFAOYSA-N 0 3 419.569 4.392 20 0 HIADHN CC[C@@H](CNC(=O)Cc1csc(-c2ccccc2)n1)N1CCc2ccccc2C1 ZINC000032446127 848028353 /nfs/dbraw/zinc/02/83/53/848028353.db2.gz XYTHUEWXZFHKNO-QFIPXVFZSA-N 0 3 405.567 4.306 20 0 HIADHN CCOc1c(Cl)cc(C(=O)NC[C@@H](c2ccc(CC)cc2)N(C)C)cc1OC ZINC000032733117 848069524 /nfs/dbraw/zinc/06/95/24/848069524.db2.gz PZDORADRMHIDFJ-IBGZPJMESA-N 0 3 404.938 4.342 20 0 HIADHN O=C(CCc1ncc(-c2ccccc2F)o1)NC[C@H](c1cccs1)N1CCCC1 ZINC000032762343 848073855 /nfs/dbraw/zinc/07/38/55/848073855.db2.gz PUTJADYWAVKBOO-GOSISDBHSA-N 0 3 413.518 4.428 20 0 HIADHN C[C@@H](Oc1ccc(Br)cc1)C(=O)NC[C@H](c1ccccc1)N1CCCC1 ZINC000036883712 848171854 /nfs/dbraw/zinc/17/18/54/848171854.db2.gz OSRAZGJCVKQBAL-OXQOHEQNSA-N 0 3 417.347 4.170 20 0 HIADHN C[C@H](NC(=O)OCc1ccccc1)C(=O)C(C#N)c1nc(-c2ccccc2)cs1 ZINC000041533243 848227696 /nfs/dbraw/zinc/22/76/96/848227696.db2.gz TUGXHNKBNVSJEW-MAUKXSAKSA-N 0 3 405.479 4.301 20 0 HIADHN C[C@H](NC(=O)OCc1ccccc1)C(=O)C(C#N)c1nc(-c2ccccc2)cs1 ZINC000041533251 848227864 /nfs/dbraw/zinc/22/78/64/848227864.db2.gz TUGXHNKBNVSJEW-YJBOKZPZSA-N 0 3 405.479 4.301 20 0 HIADHN C[C@@H](NC(=O)OC(C)(C)C)C(=O)C(C#N)c1nc2cc(C(F)(F)F)ccc2s1 ZINC000041548469 848229895 /nfs/dbraw/zinc/22/98/95/848229895.db2.gz GPLMJYVMCOJYSG-MWLCHTKSSA-N 0 3 413.421 4.405 20 0 HIADHN O=C(Nc1cccc(CNC[C@H](O)COc2ccccc2)c1)c1ccccc1Cl ZINC000042203362 848300701 /nfs/dbraw/zinc/30/07/01/848300701.db2.gz BCGZDRLHNMDAHW-IBGZPJMESA-N 0 3 410.901 4.122 20 0 HIADHN CC(C)Oc1ccc(CNCc2cn(C)nc2-c2ccc3c(c2)OCCCO3)cc1 ZINC000042225704 848304705 /nfs/dbraw/zinc/30/47/05/848304705.db2.gz SNNRXKBGSKRNRL-UHFFFAOYSA-N 0 3 407.514 4.325 20 0 HIADHN COc1ccc(NC(C)=O)cc1NC(=O)[C@@H](C)N[C@H](C)c1ccc2c(c1)CCCC2 ZINC000042636600 848335444 /nfs/dbraw/zinc/33/54/44/848335444.db2.gz KJPYDCWNHCSAIB-HZPDHXFCSA-N 0 3 409.530 4.210 20 0 HIADHN COc1ccc(NC(C)=O)cc1NC(=O)[C@H](C)N[C@@H](C)c1ccc2c(c1)CCCC2 ZINC000042636597 848335718 /nfs/dbraw/zinc/33/57/18/848335718.db2.gz KJPYDCWNHCSAIB-HOTGVXAUSA-N 0 3 409.530 4.210 20 0 HIADHN CCN(Cc1ccc(OC)c(OC)c1)C(=O)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000042813334 848356586 /nfs/dbraw/zinc/35/65/86/848356586.db2.gz VGBLKRLMXCWTDX-NRFANRHFSA-N 0 3 411.546 4.072 20 0 HIADHN CN(Cc1ccc(Br)o1)C(=O)NC[C@H](c1ccccc1)N1CCCC1 ZINC000042813799 848357012 /nfs/dbraw/zinc/35/70/12/848357012.db2.gz FVSZZICKBDBRQU-QGZVFWFLSA-N 0 3 406.324 4.021 20 0 HIADHN CN(C)Cc1cccc(NC(=O)N(C)CC(=O)Nc2ccc(Cl)c(Cl)c2)c1 ZINC000044293544 848540322 /nfs/dbraw/zinc/54/03/22/848540322.db2.gz SXPWVIWAQKPPNN-UHFFFAOYSA-N 0 3 409.317 4.157 20 0 HIADHN C[C@H](C(=O)Nc1ccc(Cl)cc1C(F)(F)F)N1CCN(C2CCCC2)CC1 ZINC000045768260 848724708 /nfs/dbraw/zinc/72/47/08/848724708.db2.gz CUWFZTJIXPYMCT-CYBMUJFWSA-N 0 3 403.876 4.246 20 0 HIADHN C[C@@H](C(=O)Nc1ccc2c(c1)OC1(CCCCC1)O2)N1CCN(C2CCCC2)CC1 ZINC000045769246 848724732 /nfs/dbraw/zinc/72/47/32/848724732.db2.gz GGHIAPBFHDEXQQ-SFHVURJKSA-N 0 3 413.562 4.005 20 0 HIADHN CCN(Cc1cc(=O)n2cc(Br)ccc2n1)[C@H](C)c1cccc(OC)c1 ZINC000045806205 848732937 /nfs/dbraw/zinc/73/29/37/848732937.db2.gz GGKCWYJNVVVWPP-CQSZACIVSA-N 0 3 416.319 4.049 20 0 HIADHN Cc1ccc(-c2csc3ncnc(NC[C@@H](C(C)C)N4CCN(C)CC4)c23)cc1 ZINC000046551947 848872528 /nfs/dbraw/zinc/87/25/28/848872528.db2.gz OYAXJTLEUSNVQP-FQEVSTJZSA-N 0 3 409.603 4.351 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)N(C)C3CCC(C)CC3)CC2)c1 ZINC000046867604 848950423 /nfs/dbraw/zinc/95/04/23/848950423.db2.gz WYVRUUPYQOZQTH-UHFFFAOYSA-N 0 3 400.611 4.117 20 0 HIADHN Cc1nn(Cc2ccc(F)cc2)c(Cl)c1C(=O)Nc1cccc(CN(C)C)c1 ZINC000047453813 849050988 /nfs/dbraw/zinc/05/09/88/849050988.db2.gz IVBYMQDDHNSUTQ-UHFFFAOYSA-N 0 3 400.885 4.346 20 0 HIADHN CN(C)[C@H](CNC(=O)Nc1cccc(COCc2ccco2)c1)Cc1ccccc1 ZINC000047602786 849082800 /nfs/dbraw/zinc/08/28/00/849082800.db2.gz UWYVRIDPSPAECM-QFIPXVFZSA-N 0 3 407.514 4.291 20 0 HIADHN COc1cc(CNCc2ccc(-n3ccnc3)c(F)c2)ccc1OCc1ccncc1 ZINC000047751869 849103958 /nfs/dbraw/zinc/10/39/58/849103958.db2.gz PQZXTXURFKKVQE-UHFFFAOYSA-N 0 3 418.472 4.284 20 0 HIADHN COc1cc(CN[C@H](C)c2ccc3c(c2)CCC(=O)N3)ccc1OCc1ccncc1 ZINC000047826672 849123593 /nfs/dbraw/zinc/12/35/93/849123593.db2.gz QQYXESNBMBEUGL-QGZVFWFLSA-N 0 3 417.509 4.405 20 0 HIADHN COc1ccc([C@H](CNC(=O)Nc2cccc(OC(F)F)c2)N2CCCC2)cc1 ZINC000047909801 849136658 /nfs/dbraw/zinc/13/66/58/849136658.db2.gz GZUYNAIGTDPEKT-IBGZPJMESA-N 0 3 405.445 4.255 20 0 HIADHN COc1ccc(OC(F)F)c(NC(=O)N2CCCN(Cc3ccccc3C)CC2)c1 ZINC000047915384 849137567 /nfs/dbraw/zinc/13/75/67/849137567.db2.gz PPALDPLEWWDXBY-UHFFFAOYSA-N 0 3 419.472 4.345 20 0 HIADHN CCCC(=O)Nc1ccc(CNC(=O)NC[C@@H](c2cccs2)N2CCCC2)cc1 ZINC000047951926 849143847 /nfs/dbraw/zinc/14/38/47/849143847.db2.gz FGTZSQQCPBKUFQ-IBGZPJMESA-N 0 3 414.575 4.123 20 0 HIADHN CN(C)Cc1ccccc1NC(=O)CSc1nnc(-c2ccc(Cl)cc2)o1 ZINC000048173972 849185675 /nfs/dbraw/zinc/18/56/75/849185675.db2.gz KUJBVZLLZQNSOQ-UHFFFAOYSA-N 0 3 402.907 4.182 20 0 HIADHN CC(=O)Nc1ccc(S[C@H](C)C(=O)NC[C@@H](c2ccccc2)N2CCCC2)cc1 ZINC000048185617 849187666 /nfs/dbraw/zinc/18/76/66/849187666.db2.gz JODSBDFBUHCQKX-VGSWGCGISA-N 0 3 411.571 4.079 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3sccc3Br)c(C)c2)CC1 ZINC000048214233 849192504 /nfs/dbraw/zinc/19/25/04/849192504.db2.gz MWNNNZUYOBEMCO-UHFFFAOYSA-N 0 3 408.365 4.213 20 0 HIADHN CCC(=O)Nc1ccc(C)c(NC(=O)NC[C@@H](CC)N2CCc3ccccc3C2)c1 ZINC000048257044 849199483 /nfs/dbraw/zinc/19/94/83/849199483.db2.gz ZUBGEEKMDUZRAC-OAQYLSRUSA-N 0 3 408.546 4.302 20 0 HIADHN COc1cc(CNCc2cn(-c3ccccc3)nc2-c2ccncc2)cc(OC)c1 ZINC000048747438 849262606 /nfs/dbraw/zinc/26/26/06/849262606.db2.gz YNMXZTWNAJQQKH-UHFFFAOYSA-N 0 3 400.482 4.241 20 0 HIADHN CC[C@H](NCc1cccc(Br)c1)c1ccccc1OCC(=O)N(C)C ZINC000048750582 849263853 /nfs/dbraw/zinc/26/38/53/849263853.db2.gz BXESJANPQUYOMO-SFHVURJKSA-N 0 3 405.336 4.157 20 0 HIADHN Cc1ccc(COc2ccc(CNCc3ccc(CS(C)(=O)=O)cc3)cc2)cc1 ZINC000048779689 849267228 /nfs/dbraw/zinc/26/72/28/849267228.db2.gz RBEIVYBZRBYBOO-UHFFFAOYSA-N 0 3 409.551 4.408 20 0 HIADHN C[C@H](SCC(=O)Nc1ccc(F)cc1)C(=O)C(C#N)c1nc2ccccc2s1 ZINC000048823181 849271533 /nfs/dbraw/zinc/27/15/33/849271533.db2.gz GSWYRTALEXPYOU-WFASDCNBSA-N 0 3 413.499 4.372 20 0 HIADHN CC(C)c1ccc(SCC(=O)C(C#N)c2nc(N)nc(Nc3ccccc3)n2)cc1 ZINC000049395324 849309465 /nfs/dbraw/zinc/30/94/65/849309465.db2.gz CTYMHCOENCIDJT-GOSISDBHSA-N 0 3 418.526 4.289 20 0 HIADHN COc1cc(CN(C)C(=O)c2cccc(CN3CCCC3)c2)ccc1OC(F)F ZINC000050024650 849342105 /nfs/dbraw/zinc/34/21/05/849342105.db2.gz ZWPOHQVXEUZESU-UHFFFAOYSA-N 0 3 404.457 4.165 20 0 HIADHN O=C(c1ccccc1[O-])N1CCC([NH2+][C@@H]2CCc3c2cccc3Br)CC1 ZINC000436835076 862014807 /nfs/dbraw/zinc/01/48/07/862014807.db2.gz TXHRWXIEMMYNLR-LJQANCHMSA-N 0 3 415.331 4.036 20 0 HIADHN O=C(NC1CCCCC1)C1CCN(Cc2ccc(OCc3cccnc3)cc2)CC1 ZINC000050963021 849423255 /nfs/dbraw/zinc/42/32/55/849423255.db2.gz QUDKIYMHSOYWFW-UHFFFAOYSA-N 0 3 407.558 4.322 20 0 HIADHN CC(=O)Nc1cccc(NC(=O)[C@H](C)N(C)C[C@@H]2CCCO[C@@H]2c2ccccc2)c1 ZINC000051132509 849434727 /nfs/dbraw/zinc/43/47/27/849434727.db2.gz DRVWQLFZQZKSPL-KPDCDPCYSA-N 0 3 409.530 4.072 20 0 HIADHN COc1ccc(C(=O)NC[C@H]2CCC[N@H+](C)[C@@H]2c2ccc(C(F)(F)F)cc2)c([O-])c1 ZINC000436848521 862024862 /nfs/dbraw/zinc/02/48/62/862024862.db2.gz AJFGZLMIEQQXSA-FOIQADDNSA-N 0 3 422.447 4.233 20 0 HIADHN COc1ccc(C(=O)NC[C@H]2CCC[N@@H+](C)[C@@H]2c2ccc(C(F)(F)F)cc2)c([O-])c1 ZINC000436848521 862024874 /nfs/dbraw/zinc/02/48/74/862024874.db2.gz AJFGZLMIEQQXSA-FOIQADDNSA-N 0 3 422.447 4.233 20 0 HIADHN COc1ccc(CN(C)C(=O)NC[C@@H](c2ccccc2)N2CCC(C)CC2)cc1O ZINC000052582057 849597162 /nfs/dbraw/zinc/59/71/62/849597162.db2.gz MWYUQNSZKWYEFM-NRFANRHFSA-N 0 3 411.546 4.015 20 0 HIADHN COc1ccc(C[N@H+](Cc2nc3c4ccccc4oc3c(=O)[n-]2)[C@H](C)C2CC2)cc1 ZINC000053098273 849665831 /nfs/dbraw/zinc/66/58/31/849665831.db2.gz LBRFKOKKBHLNDX-OAHLLOKOSA-N 0 3 403.482 4.479 20 0 HIADHN COc1ccc(C[N@@H+](Cc2nc3c4ccccc4oc3c(=O)[n-]2)[C@H](C)C2CC2)cc1 ZINC000053098273 849665839 /nfs/dbraw/zinc/66/58/39/849665839.db2.gz LBRFKOKKBHLNDX-OAHLLOKOSA-N 0 3 403.482 4.479 20 0 HIADHN CCOc1ccc(-c2nc(C(=O)N(CC(C)C)C3CCN(C)CC3)cs2)cc1 ZINC000053222456 849681606 /nfs/dbraw/zinc/68/16/06/849681606.db2.gz YELVABUZAWRCIN-UHFFFAOYSA-N 0 3 401.576 4.401 20 0 HIADHN COc1cc(NC(=O)CN[C@@H](c2ccc(F)cc2)C(C)(C)C)cc(OC)c1OC ZINC000053644337 849741999 /nfs/dbraw/zinc/74/19/99/849741999.db2.gz XGHNIMYHVCWBJQ-NRFANRHFSA-N 0 3 404.482 4.167 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N(Cc1ccccc1)C[C@H]1CCCO1 ZINC000054541892 849886344 /nfs/dbraw/zinc/88/63/44/849886344.db2.gz YLDPXGWIYAFQOI-NHCUHLMSSA-N 0 3 413.587 4.276 20 0 HIADHN O=C(Nc1ccccc1)NC1CCN(C[C@H](O)c2ccc(C(F)(F)F)cc2)CC1 ZINC000055032653 849959767 /nfs/dbraw/zinc/95/97/67/849959767.db2.gz CUTJPPLQIUZUAO-IBGZPJMESA-N 0 3 407.436 4.025 20 0 HIADHN Cc1c(C(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)cnn1-c1ccc(F)cc1F ZINC000056168571 850268076 /nfs/dbraw/zinc/26/80/76/850268076.db2.gz IYIQRIGQEAJYGW-HNAYVOBHSA-N 0 3 410.468 4.024 20 0 HIADHN COc1ccc(NC(=O)N(CCN(C)C)Cc2ccc(Br)cc2)cc1 ZINC000056515955 850381484 /nfs/dbraw/zinc/38/14/84/850381484.db2.gz DJMNLYNGCYKQQM-UHFFFAOYSA-N 0 3 406.324 4.053 20 0 HIADHN CC(C)(C)CCN1CCN(C(=O)Nc2cc(N3CCCC3=O)ccc2Cl)CC1 ZINC000056600012 850409280 /nfs/dbraw/zinc/40/92/80/850409280.db2.gz WIUWDYIQDVPHGC-UHFFFAOYSA-N 0 3 406.958 4.053 20 0 HIADHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)Nc1ccccc1N(C)C ZINC000056608972 850411704 /nfs/dbraw/zinc/41/17/04/850411704.db2.gz VAWLGDXUSCJWHA-UHFFFAOYSA-N 0 3 419.367 4.111 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N(Cc1ccco1)C[C@H]1CCCO1)c1ccsc1 ZINC000056623736 850419095 /nfs/dbraw/zinc/41/90/95/850419095.db2.gz KWVSLRFFEXBEFZ-UXHICEINSA-N 0 3 405.564 4.115 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N(Cc1ccco1)C[C@@H]1CCCO1)c1ccsc1 ZINC000056623735 850419306 /nfs/dbraw/zinc/41/93/06/850419306.db2.gz KWVSLRFFEXBEFZ-VQTJNVASSA-N 0 3 405.564 4.115 20 0 HIADHN C[C@H](CN1CCC[C@H](C)C1)NC(=O)N1CCC(C(=O)c2ccc(Cl)cc2)CC1 ZINC000056788649 850483551 /nfs/dbraw/zinc/48/35/51/850483551.db2.gz WKWJQJHMQQHIPD-DLBZAZTESA-N 0 3 405.970 4.065 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)N[C@@H](C)c2ccc(Br)cc2)o1 ZINC000056795021 850486622 /nfs/dbraw/zinc/48/66/22/850486622.db2.gz HBIARZGQKVZIBM-HNNXBMFYSA-N 0 3 408.340 4.185 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)N[C@@H]1CCOc2c(Cl)cccc21 ZINC000056806286 850490101 /nfs/dbraw/zinc/49/01/01/850490101.db2.gz WHQCNXCRMXZXIA-LJQANCHMSA-N 0 3 405.901 4.076 20 0 HIADHN C[C@@H]1C[C@H]1c1ccc(CCC(=O)NCCCCN2CCN(c3ccccc3)CC2)o1 ZINC000057113243 850548507 /nfs/dbraw/zinc/54/85/07/850548507.db2.gz GGKBICXFDLCQKE-NFBKMPQASA-N 0 3 409.574 4.054 20 0 HIADHN Cc1ccc(NC(=O)C2CC2)cc1NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000057544066 850665177 /nfs/dbraw/zinc/66/51/77/850665177.db2.gz RBGYBPGXSHBOHY-OAQYLSRUSA-N 0 3 406.530 4.130 20 0 HIADHN O=C(Nc1ccc(F)cc1Br)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000057758334 850709035 /nfs/dbraw/zinc/70/90/35/850709035.db2.gz NYPYRNFCHUOYNY-MRXNPFEDSA-N 0 3 406.299 4.374 20 0 HIADHN CC[C@@H](NC(=O)NC[C@@H](c1ccc(OC)cc1)N1CCCC1)c1ccc(OC)cc1 ZINC000057769039 850711095 /nfs/dbraw/zinc/71/10/95/850711095.db2.gz LJYXDOKMMNRPBA-PKTZIBPZSA-N 0 3 411.546 4.291 20 0 HIADHN CCc1ccc(-c2nn(-c3ccccc3C)cc2C(=O)NC2CCN(C)CC2)cc1 ZINC000057801445 850720268 /nfs/dbraw/zinc/72/02/68/850720268.db2.gz SYQAZBVQZQGVQT-UHFFFAOYSA-N 0 3 402.542 4.234 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)c1ccccc1OCc1cscn1 ZINC000057922418 850743174 /nfs/dbraw/zinc/74/31/74/850743174.db2.gz FDBGELRBBHIGFL-OAQYLSRUSA-N 0 3 407.539 4.289 20 0 HIADHN Cc1cc(C)n(-c2ccccc2NC(=O)NCCCN2CCc3ccccc3C2)n1 ZINC000058025864 850753140 /nfs/dbraw/zinc/75/31/40/850753140.db2.gz KNYAJOLMGRLGED-UHFFFAOYSA-N 0 3 403.530 4.059 20 0 HIADHN COc1cc(CN(C)C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)ccc1SC ZINC000058571183 850859400 /nfs/dbraw/zinc/85/94/00/850859400.db2.gz XMKFFRVLVXSJCG-HXUWFJFHSA-N 0 3 413.587 4.223 20 0 HIADHN Cc1ccc(-c2ccsc2C(=O)Nc2ccc3oc(=O)n(CCN(C)C)c3c2)cc1 ZINC000058739243 850909080 /nfs/dbraw/zinc/90/90/80/850909080.db2.gz XNPCTLKWZMLRDA-UHFFFAOYSA-N 0 3 421.522 4.445 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)CSc1ccc(C(F)(F)F)cn1)c1ccsc1 ZINC000058954554 850967648 /nfs/dbraw/zinc/96/76/48/850967648.db2.gz MLPIASZRGOZLAK-HNNXBMFYSA-N 0 3 417.522 4.453 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)CCCC[C@@H]3CCSS3)cc2)CC1 ZINC000058954402 850967763 /nfs/dbraw/zinc/96/77/63/850967763.db2.gz LHZMCWYMDNRFEW-HXUWFJFHSA-N 0 3 407.649 4.477 20 0 HIADHN CN(C)CCn1c(=O)oc2ccc(NC(=O)c3sccc3-c3ccccc3)cc21 ZINC000059003601 850978008 /nfs/dbraw/zinc/97/80/08/850978008.db2.gz ARUPMGZQNRRFIT-UHFFFAOYSA-N 0 3 407.495 4.137 20 0 HIADHN CC1CCN(Cc2csc(NC(=O)[C@@H]3CCCN(Cc4ccccc4)C3)n2)CC1 ZINC000059951661 851027291 /nfs/dbraw/zinc/02/72/91/851027291.db2.gz OLVBREHLUMFRHJ-HXUWFJFHSA-N 0 3 412.603 4.226 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2cc3ccc(Br)cc3[nH]2)N(C)C)cc1 ZINC000060155826 851046496 /nfs/dbraw/zinc/04/64/96/851046496.db2.gz HRMJPBDAKUVVAD-IBGZPJMESA-N 0 3 400.320 4.272 20 0 HIADHN COc1ccc(OCCCC(=O)Nc2ccc(CCN3CCSCC3)cc2)cc1 ZINC000060221160 851053418 /nfs/dbraw/zinc/05/34/18/851053418.db2.gz QFDSHNYAYSCFDD-UHFFFAOYSA-N 0 3 414.571 4.084 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2cc(Br)cnc2Cl)N2CCCC2)cc1 ZINC000060359153 851076924 /nfs/dbraw/zinc/07/69/24/851076924.db2.gz FSOTVDSDTGTLGK-KRWDZBQOSA-N 0 3 422.754 4.373 20 0 HIADHN C[C@H](CNC(=O)N1CCC(C(=O)c2ccc(Cl)cc2)CC1)N1CCCC[C@@H]1C ZINC000060610333 851166058 /nfs/dbraw/zinc/16/60/58/851166058.db2.gz VDVVUTYRXDMRJC-DLBZAZTESA-N 0 3 405.970 4.207 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N[C@@H]3CCSc4c(F)cccc43)cc2)CC1 ZINC000061134862 851301560 /nfs/dbraw/zinc/30/15/60/851301560.db2.gz MVWMVBDQIIKVGS-OAQYLSRUSA-N 0 3 413.562 4.323 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N[C@H](c3ccccc3)C(F)(F)F)cc2)CC1 ZINC000061162042 851308132 /nfs/dbraw/zinc/30/81/32/851308132.db2.gz ZNBJNZLCVIZVNU-HXUWFJFHSA-N 0 3 405.464 4.250 20 0 HIADHN O=C(NCc1ccnc(OC2CCCC2)c1)NC[C@H](c1ccccc1)N1CCCC1 ZINC000061229396 851322814 /nfs/dbraw/zinc/32/28/14/851322814.db2.gz NSQJMIAOXIKRPZ-JOCHJYFZSA-N 0 3 408.546 4.039 20 0 HIADHN O=C(NCCSCc1ccccc1F)NC[C@H](c1cccs1)N1CCCC1 ZINC000061230929 851323691 /nfs/dbraw/zinc/32/36/91/851323691.db2.gz WWUNBIZVVBGWNF-GOSISDBHSA-N 0 3 407.580 4.257 20 0 HIADHN COc1ccc([C@H](CNC(=O)Nc2ccc(N3CCCCC3)nc2)N2CCCC2)cc1 ZINC000061398936 851365934 /nfs/dbraw/zinc/36/59/34/851365934.db2.gz LAPTWUDUPAHSBZ-QFIPXVFZSA-N 0 3 423.561 4.039 20 0 HIADHN COCCn1cc(C(=O)Nc2ccc(CCN3CCSCC3)cc2)c2ccccc21 ZINC000061571985 851407530 /nfs/dbraw/zinc/40/75/30/851407530.db2.gz QZMHZYVVJLZEJL-UHFFFAOYSA-N 0 3 423.582 4.131 20 0 HIADHN O=C(CCC(=O)c1ccc(F)cc1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000061572494 851408619 /nfs/dbraw/zinc/40/86/19/851408619.db2.gz USZYGZKPMBJILR-UHFFFAOYSA-N 0 3 400.519 4.019 20 0 HIADHN O=C(Nc1cnn(Cc2ccccc2)c1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000061791766 851454489 /nfs/dbraw/zinc/45/44/89/851454489.db2.gz BJEYJMQKAAJNEU-UHFFFAOYSA-N 0 3 421.570 4.167 20 0 HIADHN Cc1ccc(Oc2ccccc2NC(=O)C(=O)NCC(C)(C)N2CCCCC2)cc1 ZINC000061866077 851463142 /nfs/dbraw/zinc/46/31/42/851463142.db2.gz FWLWFOCPQIAUCG-UHFFFAOYSA-N 0 3 409.530 4.107 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCc1csc(Br)c1)c1ccsc1 ZINC000061941753 851475564 /nfs/dbraw/zinc/47/55/64/851475564.db2.gz ARIZYBRLPACZRH-AWEZNQCLSA-N 0 3 416.410 4.454 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)Nc1ccc2c(c1)OCCCO2 ZINC000062377280 851533708 /nfs/dbraw/zinc/53/37/08/851533708.db2.gz JQGKMRFWOKECNY-UHFFFAOYSA-N 0 3 403.910 4.097 20 0 HIADHN CC(=O)Nc1cc(NC(=O)N(CCN(C)C)Cc2cccc(Cl)c2)ccc1C ZINC000062393054 851540023 /nfs/dbraw/zinc/54/00/23/851540023.db2.gz CYGXORLFKMIOQO-UHFFFAOYSA-N 0 3 402.926 4.203 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)Nc1ccc(-c2csnn2)cc1 ZINC000062410658 851546288 /nfs/dbraw/zinc/54/62/88/851546288.db2.gz BCKXQYNEEPRAMO-UHFFFAOYSA-N 0 3 415.950 4.454 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)N[C@H]1CCSc2ccc(F)cc21 ZINC000062476654 851560026 /nfs/dbraw/zinc/56/00/26/851560026.db2.gz AKUYGLVWMPHFST-IBGZPJMESA-N 0 3 423.504 4.414 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)NCc1ccc(-c2ccccc2)o1 ZINC000062498634 851566483 /nfs/dbraw/zinc/56/64/83/851566483.db2.gz XPQYBYWJAPLZDB-UHFFFAOYSA-N 0 3 413.468 4.498 20 0 HIADHN Cc1cc(CNC(=O)N(CCN2CCCC2)Cc2ccc(Cl)c(Cl)c2)no1 ZINC000062501764 851566548 /nfs/dbraw/zinc/56/65/48/851566548.db2.gz ZGFGRKRHINYSNE-UHFFFAOYSA-N 0 3 411.333 4.097 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCCc3ccccc3Cl)c(C)c2)CC1 ZINC000062648238 851585217 /nfs/dbraw/zinc/58/52/17/851585217.db2.gz PEVBXKMCZQSAIY-UHFFFAOYSA-N 0 3 400.954 4.155 20 0 HIADHN CCOc1nn(CN2CCN(Cc3cccc4ccccc43)CC2)c(=S)s1 ZINC000063123736 851618708 /nfs/dbraw/zinc/61/87/08/851618708.db2.gz KYEMWPQNQZFSGO-UHFFFAOYSA-N 0 3 400.573 4.001 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)Nc1ccnn1-c1ccc(Cl)cc1 ZINC000437072775 862267367 /nfs/dbraw/zinc/26/73/67/862267367.db2.gz DBKYWOFUAHDPIT-UHFFFAOYSA-N 0 3 423.948 4.067 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NC3(c4ccc(F)cc4)CCC3)c(C)c2)CC1 ZINC000063264844 851645439 /nfs/dbraw/zinc/64/54/39/851645439.db2.gz TWXWEOCPNXFRNI-UHFFFAOYSA-N 0 3 410.537 4.477 20 0 HIADHN Cc1cccn2cc(COc3ccc(CNCc4ccc(-n5ccnc5)nc4)cc3)nc12 ZINC000063313126 851657967 /nfs/dbraw/zinc/65/79/67/851657967.db2.gz IOZGOIOOZWILHN-UHFFFAOYSA-N 0 3 424.508 4.092 20 0 HIADHN COc1ccccc1C(C)(C)CNC(=O)N1CCCN(Cc2ccccc2C)CC1 ZINC000063334116 851664704 /nfs/dbraw/zinc/66/47/04/851664704.db2.gz NEKLGWZYVJVBIE-UHFFFAOYSA-N 0 3 409.574 4.199 20 0 HIADHN Cc1ccc(-c2ccc(CNCc3ccc(S(=O)(=O)N(C)C)cc3)s2)cc1 ZINC000063523280 851707477 /nfs/dbraw/zinc/70/74/77/851707477.db2.gz WIMVDGHCUGIGTB-UHFFFAOYSA-N 0 3 400.569 4.264 20 0 HIADHN C[C@H](CC(=O)Nc1cccc(Br)c1)N[C@@H]1CCOc2c(F)cccc21 ZINC000437084049 862276159 /nfs/dbraw/zinc/27/61/59/862276159.db2.gz KKQLJBARTOGPMC-SJKOYZFVSA-N 0 3 407.283 4.419 20 0 HIADHN O=c1[nH]c2ccc(-c3csc(NC4CCN(Cc5ccccc5)CC4)n3)cc2[nH]1 ZINC000063630545 851729641 /nfs/dbraw/zinc/72/96/41/851729641.db2.gz WPNVKHQEPIOTPG-UHFFFAOYSA-N 0 3 405.527 4.056 20 0 HIADHN CN1C[C@H](CN[C@H](c2ccc(Br)cc2)c2cncnc2)Cc2ccccc21 ZINC000437092368 862284831 /nfs/dbraw/zinc/28/48/31/862284831.db2.gz GWVYCKBTMRATJW-KSFYIVLOSA-N 0 3 423.358 4.227 20 0 HIADHN CN(C)[C@H](CNC(=O)c1ccc(N2CCc3ccccc3C2)cc1)Cc1ccccc1 ZINC000064022118 851816789 /nfs/dbraw/zinc/81/67/89/851816789.db2.gz NIVMZEOMGFQDLT-SANMLTNESA-N 0 3 413.565 4.152 20 0 HIADHN CN(Cc1ccc(Cl)c(Cl)c1)C(=O)CN1CCN(CC2CCCCC2)CC1 ZINC000064129665 851832570 /nfs/dbraw/zinc/83/25/70/851832570.db2.gz JPIFYXXWAHJZFZ-UHFFFAOYSA-N 0 3 412.405 4.150 20 0 HIADHN O=C(CN1CCN(CC2CCCCC2)CC1)Nc1nc(-c2cccs2)cs1 ZINC000064130275 851833835 /nfs/dbraw/zinc/83/38/35/851833835.db2.gz OTWFEVZFEYKNAQ-UHFFFAOYSA-N 0 3 404.605 4.008 20 0 HIADHN Cc1ccc([C@H](CNC(=O)NCc2ccccc2OC(F)F)N2CCCC2)cc1 ZINC000064237415 851855130 /nfs/dbraw/zinc/85/51/30/851855130.db2.gz HUBBKTNXHCAAJX-IBGZPJMESA-N 0 3 403.473 4.233 20 0 HIADHN Cc1ccc([C@H](CNC(=O)NCc2ccc(Br)s2)N2CCCC2)cc1 ZINC000064237082 851855407 /nfs/dbraw/zinc/85/54/07/851855407.db2.gz ISXQIZFGTMRFPA-KRWDZBQOSA-N 0 3 422.392 4.455 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)c3c[nH]c4cc(Cl)ccc34)CC2)c1 ZINC000064336475 851874605 /nfs/dbraw/zinc/87/46/05/851874605.db2.gz HQEDICKVDHXCJQ-UHFFFAOYSA-N 0 3 424.976 4.462 20 0 HIADHN O=C(NC[C@@H]1CN2CCC[C@H]2CO1)c1sc(-c2ccccc2)nc1-c1ccccc1 ZINC000064334028 851874717 /nfs/dbraw/zinc/87/47/17/851874717.db2.gz WOVIAVLRSROKGP-VQTJNVASSA-N 0 3 419.550 4.070 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)C1=Cc2ccccc2OC1 ZINC000064470698 851905459 /nfs/dbraw/zinc/90/54/59/851905459.db2.gz JTIKYEIYRXFICK-UHFFFAOYSA-N 0 3 404.432 4.072 20 0 HIADHN CCCc1nnc(NC(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)s1 ZINC000064520479 851918559 /nfs/dbraw/zinc/91/85/59/851918559.db2.gz GLCWEAXZBIQDGW-UHFFFAOYSA-N 0 3 415.485 4.105 20 0 HIADHN COc1ccc(CN[C@@H](C)c2ccc(N3CCOC3=O)cc2)cc1OCCCC#N ZINC000064614388 851940879 /nfs/dbraw/zinc/94/08/79/851940879.db2.gz OEGNBZIECABUFH-KRWDZBQOSA-N 0 3 409.486 4.185 20 0 HIADHN COc1cccc(CCNC(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)c1 ZINC000064755311 851977533 /nfs/dbraw/zinc/97/75/33/851977533.db2.gz FYOXJKWRUKJPJE-UHFFFAOYSA-N 0 3 423.479 4.030 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)NC[C@H](C)c3ccc(F)cc3F)cc2)CC1 ZINC000437121941 862308715 /nfs/dbraw/zinc/30/87/15/862308715.db2.gz YYNCTGYYMQUAHB-KRWDZBQOSA-N 0 3 401.501 4.029 20 0 HIADHN CCCn1c(SC[C@@H](O)CN2CCc3ccccc3C2)nnc1-c1cccc(C)c1 ZINC000065169932 852083784 /nfs/dbraw/zinc/08/37/84/852083784.db2.gz AXFHUPYWLDJJCE-QFIPXVFZSA-N 0 3 422.598 4.175 20 0 HIADHN CCC[C@H](C)NC(=O)[C@H]1CCCN(Cn2c3ccccc3nc2SC(F)F)C1 ZINC000065188920 852085250 /nfs/dbraw/zinc/08/52/50/852085250.db2.gz SLEJKXFPKDIUBC-GJZGRUSLSA-N 0 3 410.534 4.325 20 0 HIADHN CC(C)CC(=O)Nc1ccc(NC(=O)N2CCN(CC3CCCCC3)CC2)cc1 ZINC000065360461 852113583 /nfs/dbraw/zinc/11/35/83/852113583.db2.gz JQRHXAUWWGVHLD-UHFFFAOYSA-N 0 3 400.567 4.401 20 0 HIADHN O=C(Nc1cccc(C(=O)N2CCCCC2)c1)N1CCN(CC2CCCCC2)CC1 ZINC000065413858 852123872 /nfs/dbraw/zinc/12/38/72/852123872.db2.gz FOUYOSHZTKFUHK-UHFFFAOYSA-N 0 3 412.578 4.043 20 0 HIADHN Cc1cc(C)n(-c2ccccc2NC(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)n1 ZINC000065443621 852135232 /nfs/dbraw/zinc/13/52/32/852135232.db2.gz RTZDDBNPUTXYSU-CTNGQTDRSA-N 0 3 403.530 4.446 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)Nc2ccc(NC(=O)c3ccco3)cc2)C1 ZINC000065442294 852135386 /nfs/dbraw/zinc/13/53/86/852135386.db2.gz ADHAPCIJPDROKM-DYESRHJHSA-N 0 3 418.497 4.489 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)Nc2ccc(C(=O)NC(C)(C)C)cc2)C1 ZINC000065442595 852135439 /nfs/dbraw/zinc/13/54/39/852135439.db2.gz SGKOSBMWVAPLBX-DYESRHJHSA-N 0 3 408.546 4.172 20 0 HIADHN Cc1cc(C(=O)N2CCC(C)CC2)ccc1NC(=O)NCCN(C)Cc1ccccc1 ZINC000065450367 852138587 /nfs/dbraw/zinc/13/85/87/852138587.db2.gz RUKCZCHMYDPKBK-UHFFFAOYSA-N 0 3 422.573 4.121 20 0 HIADHN Cc1ccc([C@H](CNC(=O)NCc2ccnc(OCc3ccccc3)c2)N(C)C)cc1 ZINC000065469832 852145160 /nfs/dbraw/zinc/14/51/60/852145160.db2.gz FXYOHBFMHFCKJI-QHCPKHFHSA-N 0 3 418.541 4.071 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N(C)CCCc2cc(-c3ccccc3)n[nH]2)N(C)C)cc1 ZINC000065468430 852145503 /nfs/dbraw/zinc/14/55/03/852145503.db2.gz FWJHQXQRRRLFEX-DEOSSOPVSA-N 0 3 419.573 4.262 20 0 HIADHN Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)NC[C@@H](c1ccccc1)N(C)C ZINC000065481203 852152245 /nfs/dbraw/zinc/15/22/45/852152245.db2.gz BOENOBAPLBLJBU-QFIPXVFZSA-N 0 3 408.546 4.092 20 0 HIADHN Cc1cc(Oc2ncccn2)ccc1NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000065482298 852153785 /nfs/dbraw/zinc/15/37/85/852153785.db2.gz PVDCJWYMSNBLFZ-FQEVSTJZSA-N 0 3 417.513 4.363 20 0 HIADHN COc1cccc(CN2CCC(NC(=O)C(C)(C)c3ccc(Cl)cc3)CC2)c1 ZINC000065506694 852161173 /nfs/dbraw/zinc/16/11/73/852161173.db2.gz MQGNBZDIBJUKQW-UHFFFAOYSA-N 0 3 400.950 4.407 20 0 HIADHN COc1ccccc1C1(CNC(=O)N(CCN(C)C)Cc2ccc(C)o2)CCCC1 ZINC000065520489 852165581 /nfs/dbraw/zinc/16/55/81/852165581.db2.gz DDYPQHDGGYWSBT-UHFFFAOYSA-N 0 3 413.562 4.182 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)N(C)Cc2cc(Br)cs2)C1 ZINC000065522833 852168465 /nfs/dbraw/zinc/16/84/65/852168465.db2.gz IGDZRTNMCSHMRB-YOEHRIQHSA-N 0 3 422.392 4.488 20 0 HIADHN Cc1ccccc1-n1nc(C(=O)N(CCN(C)C)Cc2ccc(F)cc2)c2c1CCC2 ZINC000065621007 852202051 /nfs/dbraw/zinc/20/20/51/852202051.db2.gz ZISRZNQLALWECJ-UHFFFAOYSA-N 0 3 420.532 4.013 20 0 HIADHN COc1cccc(NC(=S)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)c1 ZINC000065704434 852226834 /nfs/dbraw/zinc/22/68/34/852226834.db2.gz WPQZNMUZVNOCTR-UHFFFAOYSA-N 0 3 411.493 4.475 20 0 HIADHN CN(C)CCN(C(=O)c1cccc(NC(=O)c2ccc(F)cc2)c1)C1CCCCC1 ZINC000065746570 852243546 /nfs/dbraw/zinc/24/35/46/852243546.db2.gz FDBWIZHMRBAMMU-UHFFFAOYSA-N 0 3 411.521 4.415 20 0 HIADHN Cc1cc(C(=O)NC(C)C)ccc1NC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000065876374 852297522 /nfs/dbraw/zinc/29/75/22/852297522.db2.gz BPVWKBWKHGJVFG-FQEVSTJZSA-N 0 3 411.521 4.123 20 0 HIADHN COCCOc1c(Cl)cccc1NC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000065899178 852308853 /nfs/dbraw/zinc/30/88/53/852308853.db2.gz NYKUFEWIMYZAEU-QGZVFWFLSA-N 0 3 420.912 4.355 20 0 HIADHN COc1ccc2cc(C(=O)N(CCN(C)C)Cc3ccc(C(F)(F)F)cc3)[nH]c2c1 ZINC000065936351 852325266 /nfs/dbraw/zinc/32/52/66/852325266.db2.gz MUKQMAVCYSEARB-UHFFFAOYSA-N 0 3 419.447 4.399 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)c1ccc(Br)c(F)c1 ZINC000065937532 852326217 /nfs/dbraw/zinc/32/62/17/852326217.db2.gz RIUUWOUCEYQMRD-UHFFFAOYSA-N 0 3 415.253 4.070 20 0 HIADHN Cc1sc(-c2ccco2)nc1C(=O)N(CCN(C)C)Cc1ccc(F)cc1F ZINC000065937757 852326662 /nfs/dbraw/zinc/32/66/62/852326662.db2.gz CQKXDVLASYQSQT-UHFFFAOYSA-N 0 3 405.470 4.194 20 0 HIADHN Cc1cc(C(=O)N(CCN(C)C)Cc2ccc(F)cc2F)c(C)n1Cc1ccco1 ZINC000065938075 852326927 /nfs/dbraw/zinc/32/69/27/852326927.db2.gz YDHBKADRDUEHOL-UHFFFAOYSA-N 0 3 415.484 4.228 20 0 HIADHN CCOc1ccc(SCC(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)cc1 ZINC000065938724 852328133 /nfs/dbraw/zinc/32/81/33/852328133.db2.gz AIFUIULBXYDBLA-UHFFFAOYSA-N 0 3 408.514 4.046 20 0 HIADHN O=C(NCCNCc1cccc(NC(=O)c2ccccc2Cl)c1)c1ccccc1 ZINC000065979375 852338708 /nfs/dbraw/zinc/33/87/08/852338708.db2.gz ONXHOKWXJFRASR-UHFFFAOYSA-N 0 3 407.901 4.112 20 0 HIADHN CCn1cc(NC(=O)N(CCN2CCCC2)Cc2ccc(Cl)c(Cl)c2)cn1 ZINC000065984662 852341112 /nfs/dbraw/zinc/34/11/12/852341112.db2.gz PRNAJMINGIQMQK-UHFFFAOYSA-N 0 3 410.349 4.340 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)/C=C/c3nc4ccccc4s3)c(C)c2)CC1 ZINC000069178786 852386558 /nfs/dbraw/zinc/38/65/58/852386558.db2.gz LYIOZAMUMIDQHX-ZHACJKMWSA-N 0 3 406.555 4.399 20 0 HIADHN Cc1noc(C)c1CSc1ccccc1C(=O)NC[C@H](Cc1ccccc1)N(C)C ZINC000069230952 852388759 /nfs/dbraw/zinc/38/87/59/852388759.db2.gz PSXWJPXQCYYKGV-FQEVSTJZSA-N 0 3 423.582 4.486 20 0 HIADHN O=C(COC(c1ccccc1)c1ccccc1)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000069369177 852393120 /nfs/dbraw/zinc/39/31/20/852393120.db2.gz JNRDZEIDFQOCRF-DEOSSOPVSA-N 0 3 400.522 4.183 20 0 HIADHN COCc1ccc(C(=O)Nc2ccc(N3CCN(Cc4ccccc4)CC3)cc2)cc1 ZINC000069707141 852400667 /nfs/dbraw/zinc/40/06/67/852400667.db2.gz DIJAQUNKJKQTTQ-UHFFFAOYSA-N 0 3 415.537 4.408 20 0 HIADHN CC1CCN([C@H](CNC(=O)c2ccc(Cn3cccn3)cc2)c2ccccc2)CC1 ZINC000072006804 852462287 /nfs/dbraw/zinc/46/22/87/852462287.db2.gz YVZYXSYDJGNATN-XMMPIXPASA-N 0 3 402.542 4.134 20 0 HIADHN Cc1cc2oc(=O)cc(CN3CCC[C@H](CNC(=O)OC(C)(C)C)C3)c2cc1C ZINC000072037822 852479442 /nfs/dbraw/zinc/47/94/42/852479442.db2.gz SFYMQHBGCYURRK-QGZVFWFLSA-N 0 3 400.519 4.147 20 0 HIADHN C[C@@H](NCC1(c2c(F)cccc2F)CCCC1)C(=O)Nc1ccc2c(c1)OCO2 ZINC000072057681 852489894 /nfs/dbraw/zinc/48/98/94/852489894.db2.gz AIXLKYWAQQPZAU-CQSZACIVSA-N 0 3 402.441 4.122 20 0 HIADHN COc1ccc(CCC(=O)N2CCCN(CCCOc3c(C)cccc3C)CC2)cc1 ZINC000079035079 852538855 /nfs/dbraw/zinc/53/88/55/852538855.db2.gz QIEZAFGXPUTQMQ-UHFFFAOYSA-N 0 3 424.585 4.248 20 0 HIADHN C[C@H](NC(=O)N[C@H](CN1CCCC1)c1ccccc1)c1ccc(OC(F)F)cc1 ZINC000097204866 852588701 /nfs/dbraw/zinc/58/87/01/852588701.db2.gz ZIRSSAWPGMMPTN-OXJNMPFZSA-N 0 3 403.473 4.485 20 0 HIADHN Cc1onc(-c2ccccc2Cl)c1C(=O)NCC1(N2CCSCC2)CCCC1 ZINC000097285338 852596444 /nfs/dbraw/zinc/59/64/44/852596444.db2.gz FDUOACIRDGBERC-UHFFFAOYSA-N 0 3 419.978 4.395 20 0 HIADHN CC[C@H](C)[C@@H](C(=O)Nc1cccc(CN2CCC(C(N)=O)CC2)c1)c1ccccc1 ZINC000097393400 852607055 /nfs/dbraw/zinc/60/70/55/852607055.db2.gz PEJLRFLWTYGKBK-FDDCHVKYSA-N 0 3 407.558 4.152 20 0 HIADHN O=C(Cc1c[nH]c2ccccc12)NC1CCN(CCOc2ccc(Cl)cc2)CC1 ZINC000097577256 852638257 /nfs/dbraw/zinc/63/82/57/852638257.db2.gz CXJWQSVERBVXEH-UHFFFAOYSA-N 0 3 411.933 4.023 20 0 HIADHN CCN(CC)[C@H](CNC(=O)CSc1ccc(F)c(F)c1)c1cccc(OC)c1 ZINC000105289440 852696727 /nfs/dbraw/zinc/69/67/27/852696727.db2.gz NHNWHVRFPRRJNB-HXUWFJFHSA-N 0 3 408.514 4.265 20 0 HIADHN O=C(NCCN1CCCCCC1)c1cnn(-c2ccc(Cl)cc2)c1C(F)(F)F ZINC000106001594 852745276 /nfs/dbraw/zinc/74/52/76/852745276.db2.gz MTUYDNUDNMCXFC-UHFFFAOYSA-N 0 3 414.859 4.150 20 0 HIADHN Cc1ccc2c(CN3CCC(C(=O)NCc4ccc(F)cc4)CC3)cc(=O)oc2c1C ZINC000108128871 852824651 /nfs/dbraw/zinc/82/46/51/852824651.db2.gz IGHVCFSGTWEPKK-UHFFFAOYSA-N 0 3 422.500 4.077 20 0 HIADHN CN1CCN(Cc2ccc(CNC(=O)c3sc4ccccc4c3Cl)cc2)CC1 ZINC000108137598 852824934 /nfs/dbraw/zinc/82/49/34/852824934.db2.gz CAPXUOUVUPWXGR-UHFFFAOYSA-N 0 3 413.974 4.232 20 0 HIADHN O=C(NCCCCN1CCN(Cc2ccccc2)CC1)c1cccc2ccccc21 ZINC000108485675 852855318 /nfs/dbraw/zinc/85/53/18/852855318.db2.gz QRWLRFIJDGLOTQ-UHFFFAOYSA-N 0 3 401.554 4.168 20 0 HIADHN COc1cccc(CN2CCC(NC(=O)CCc3ncc(-c4ccccc4)o3)CC2)c1 ZINC000108533263 852856872 /nfs/dbraw/zinc/85/68/72/852856872.db2.gz QFIHRTHWJAOQAE-UHFFFAOYSA-N 0 3 419.525 4.064 20 0 HIADHN Cc1c(C(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)cnn1-c1cccc(Cl)c1 ZINC000108819344 852882347 /nfs/dbraw/zinc/88/23/47/852882347.db2.gz JVFRJFYBDVJGPA-OXJNMPFZSA-N 0 3 408.933 4.399 20 0 HIADHN CN(Cc1ccc(OC(F)F)cc1)C(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000109016981 852908480 /nfs/dbraw/zinc/90/84/80/852908480.db2.gz LHWCIULJUVDIHI-GOSISDBHSA-N 0 3 406.448 4.298 20 0 HIADHN CC(C)C(=O)Nc1ccc(NC(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)cc1 ZINC000109188704 852933044 /nfs/dbraw/zinc/93/30/44/852933044.db2.gz FOXSEFRVKGANKQ-UHFFFAOYSA-N 0 3 408.546 4.064 20 0 HIADHN O=C(Nc1cc2c(cc1Cl)OCCCO2)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000109338670 852955595 /nfs/dbraw/zinc/95/55/95/852955595.db2.gz LWLJVJLPVFTFNK-INIZCTEOSA-N 0 3 418.896 4.491 20 0 HIADHN C[C@@H]1C[C@H]1C(=O)Nc1cccc(C(=O)Nc2ccc(CCN3CCSCC3)cc2)c1 ZINC000109484516 852975976 /nfs/dbraw/zinc/97/59/76/852975976.db2.gz WGWVETSMGNJVMU-VGOFRKELSA-N 0 3 423.582 4.125 20 0 HIADHN Cc1ccc(C)c(C(=O)CCC(=O)Nc2ccc(CCN3CCSCC3)cc2)c1 ZINC000109527237 852980926 /nfs/dbraw/zinc/98/09/26/852980926.db2.gz POJAXVZBDXGFDV-UHFFFAOYSA-N 0 3 410.583 4.496 20 0 HIADHN CCOCc1ccccc1CNC(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000109544413 852981763 /nfs/dbraw/zinc/98/17/63/852981763.db2.gz FIWQRLACLFROBX-QFIPXVFZSA-N 0 3 420.475 4.294 20 0 HIADHN O=C(Nc1ccc(N2CCCC2)nc1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000109547843 852982817 /nfs/dbraw/zinc/98/28/17/852982817.db2.gz HZMNQBSBRDGQOE-NRFANRHFSA-N 0 3 418.463 4.075 20 0 HIADHN O=C(CN(Cc1ccco1)C1CCCC1)Nc1cccc(CN2CCSCC2)c1 ZINC000109694615 853000522 /nfs/dbraw/zinc/00/05/22/853000522.db2.gz CMUQWIGTIWDECR-UHFFFAOYSA-N 0 3 413.587 4.212 20 0 HIADHN Cc1noc(Cl)c1CCC(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1 ZINC000109771720 853012441 /nfs/dbraw/zinc/01/24/41/853012441.db2.gz RIRGUDZOGMXTIH-UHFFFAOYSA-N 0 3 417.859 4.178 20 0 HIADHN CN(C(=O)c1ccc(SC(F)(F)F)cc1)C1CCN(CCc2ccccn2)CC1 ZINC000109796017 853015707 /nfs/dbraw/zinc/01/57/07/853015707.db2.gz JCVCJQGKLHRFOS-UHFFFAOYSA-N 0 3 423.504 4.473 20 0 HIADHN CN(C(=O)CCCc1nc2ccccc2s1)C1CCN(CCc2ccccn2)CC1 ZINC000109794605 853015766 /nfs/dbraw/zinc/01/57/66/853015766.db2.gz VUCHCAOUCLLJSV-UHFFFAOYSA-N 0 3 422.598 4.180 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N3CCC[C@H]3Cc3cccc(F)c3)cc2)CC1 ZINC000109898268 853031497 /nfs/dbraw/zinc/03/14/97/853031497.db2.gz OGUHJHSWECLDSY-DEOSSOPVSA-N 0 3 409.549 4.203 20 0 HIADHN CCCCN(CC)c1ccc(C(=O)Nc2ccc3oc(=O)n(CCN(C)C)c3c2)cc1 ZINC000110109590 853060638 /nfs/dbraw/zinc/06/06/38/853060638.db2.gz NNVDLPVXGGBXHJ-UHFFFAOYSA-N 0 3 424.545 4.035 20 0 HIADHN CCCN(CC(=O)Nc1ccc(Cl)cc1)C1CCN(C(=O)c2ccccc2)CC1 ZINC000110289482 853083763 /nfs/dbraw/zinc/08/37/63/853083763.db2.gz ZFUXOQZNVQPNJV-UHFFFAOYSA-N 0 3 413.949 4.295 20 0 HIADHN CCC(CC)(NCC(=O)Nc1ccc(C(=O)N(C)C)cc1)c1ccc(Cl)cc1 ZINC000110330265 853088470 /nfs/dbraw/zinc/08/84/70/853088470.db2.gz JHVPFTJDAIORPZ-UHFFFAOYSA-N 0 3 401.938 4.285 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)CCc3ccc(-c4ccccc4)o3)CC2)C[C@@H](C)O1 ZINC000110411514 853096339 /nfs/dbraw/zinc/09/63/39/853096339.db2.gz HUPRUJWEDDOEGC-WOJBJXKFSA-N 0 3 410.558 4.227 20 0 HIADHN Cc1c2cc(F)ccc2sc1C(=O)N1CCC(CN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000110411201 853096402 /nfs/dbraw/zinc/09/64/02/853096402.db2.gz SVLDQQKLBBOQPC-GJZGRUSLSA-N 0 3 404.551 4.310 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)c3ccccc3COc3ccccc3)CC2)C[C@H](C)O1 ZINC000110410080 853096643 /nfs/dbraw/zinc/09/66/43/853096643.db2.gz HWHMDHBXIDXKAD-SFTDATJTSA-N 0 3 422.569 4.227 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)CCCOc3cccc4ccccc43)CC2)C[C@H](C)O1 ZINC000110408976 853096833 /nfs/dbraw/zinc/09/68/33/853096833.db2.gz UVTHHVJVKPMRCS-SFTDATJTSA-N 0 3 424.585 4.347 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)CCc3ccc(C(C)(C)C)cc3)CC2)C[C@H](C)O1 ZINC000110451191 853101156 /nfs/dbraw/zinc/10/11/56/853101156.db2.gz XAEWCJKNDHIWFL-PMACEKPBSA-N 0 3 400.607 4.265 20 0 HIADHN Cc1nc(-c2ccccc2)sc1C(=O)N1CCC(CN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000110459285 853102418 /nfs/dbraw/zinc/10/24/18/853102418.db2.gz SWEWCERBLNRVEZ-IRXDYDNUSA-N 0 3 413.587 4.080 20 0 HIADHN COc1ccc2cc([C@H](C)C(=O)N3CCC(CN4C[C@H](C)O[C@@H](C)C4)CC3)ccc2c1 ZINC000110454944 853102497 /nfs/dbraw/zinc/10/24/97/853102497.db2.gz YLBCDOILDGUPPS-UFYCRDLUSA-N 0 3 424.585 4.300 20 0 HIADHN Cc1c2cccc(Cl)c2oc1C(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000110455480 853102524 /nfs/dbraw/zinc/10/25/24/853102524.db2.gz RMKJHQUYZLIBJL-GASCZTMLSA-N 0 3 404.938 4.356 20 0 HIADHN Clc1ccc(-c2nc(CN3CCC(CCN4CCOCC4)CC3)cs2)cc1 ZINC000110474264 853105310 /nfs/dbraw/zinc/10/53/10/853105310.db2.gz JMXTUDBNTYDVNC-UHFFFAOYSA-N 0 3 405.995 4.398 20 0 HIADHN Cc1nn(-c2cccc(Cl)c2)c2sc(C(=O)N3CC[C@H](N4CCCC4)C3)cc12 ZINC000110516453 853110716 /nfs/dbraw/zinc/11/07/16/853110716.db2.gz XQMKDEFPBPVKHT-KRWDZBQOSA-N 0 3 414.962 4.359 20 0 HIADHN CN(C)C(=O)c1cccc(CN(CCCO)C(c2ccccc2)c2ccccc2)c1 ZINC000110932774 853170493 /nfs/dbraw/zinc/17/04/93/853170493.db2.gz DDFIKWOMSZYDJF-UHFFFAOYSA-N 0 3 402.538 4.362 20 0 HIADHN Cc1ccc([C@H](CNC(=O)[C@H](c2ccccc2)N2CCCCC2=O)N2CCCC2)cc1 ZINC000111199204 853220349 /nfs/dbraw/zinc/22/03/49/853220349.db2.gz APQYQQWLAOTWOG-ZCYQVOJMSA-N 0 3 419.569 4.002 20 0 HIADHN O=C(Nc1cccc(-c2ncc[nH]2)c1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000112650152 853236648 /nfs/dbraw/zinc/23/66/48/853236648.db2.gz YUFZYQMAAKNJNJ-OAQYLSRUSA-N 0 3 414.431 4.470 20 0 HIADHN CCCN(C(=O)c1ccc2c(c1)NC(=O)CS2)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000116526048 853312453 /nfs/dbraw/zinc/31/24/53/853312453.db2.gz JUTUXMFTKNLINO-FQEVSTJZSA-N 0 3 423.582 4.248 20 0 HIADHN CCn1c2ccccc2nc1[C@@H]1CCCN1C(=O)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000116596172 853318677 /nfs/dbraw/zinc/31/86/77/853318677.db2.gz BOFWDOSWAHVCOO-REWPJTCUSA-N 0 3 417.557 4.027 20 0 HIADHN NC(=O)C1CCN(Cc2cccc(NC(=O)c3ccc(-c4ccccc4F)o3)c2)CC1 ZINC000117224677 853348273 /nfs/dbraw/zinc/34/82/73/853348273.db2.gz ILOWPGIRJLADLX-UHFFFAOYSA-N 0 3 421.472 4.035 20 0 HIADHN COc1cccc(CN2CCC(NC(=O)c3ccc(Oc4cccnc4)cc3)CC2)c1 ZINC000138403382 853385325 /nfs/dbraw/zinc/38/53/25/853385325.db2.gz YAYRKKGVBQIXJI-UHFFFAOYSA-N 0 3 417.509 4.277 20 0 HIADHN Cc1c(C(=O)Nc2ccc(CCN3CCSCC3)cc2)cnn1-c1ccccc1 ZINC000138693881 853394410 /nfs/dbraw/zinc/39/44/10/853394410.db2.gz YVSYDKHZYGLFLD-UHFFFAOYSA-N 0 3 406.555 4.024 20 0 HIADHN Cc1c([C@@H](C)NC(=O)c2cccc(CN3CCCC3)c2)cnn1-c1ccc(F)cc1 ZINC000139294276 853407508 /nfs/dbraw/zinc/40/75/08/853407508.db2.gz OCTZPLCGLUZROL-QGZVFWFLSA-N 0 3 406.505 4.407 20 0 HIADHN O=C(NCc1cccc(NC(=O)C2CCCC2)c1)c1cccc(CN2CCCC2)c1 ZINC000139331031 853408955 /nfs/dbraw/zinc/40/89/55/853408955.db2.gz XCTFDBKKWMVDKG-UHFFFAOYSA-N 0 3 405.542 4.341 20 0 HIADHN COCCN1CCC(NC(=O)N[C@@H](c2cccs2)c2ccc(C(C)C)cc2)CC1 ZINC000140255922 853440014 /nfs/dbraw/zinc/44/00/14/853440014.db2.gz SPEXUNDUJSHTLP-JOCHJYFZSA-N 0 3 415.603 4.371 20 0 HIADHN Cc1cc(CN[C@H](C)C(=O)NCc2ccccc2)cc(C)c1OCc1ccccn1 ZINC000140328995 853442055 /nfs/dbraw/zinc/44/20/55/853442055.db2.gz YNUADASEPOBLAZ-HXUWFJFHSA-N 0 3 403.526 4.072 20 0 HIADHN COCCN1CCC(NC(=O)N[C@H](C)c2ccc(Oc3ccccc3)c(F)c2)CC1 ZINC000140448850 853445152 /nfs/dbraw/zinc/44/51/52/853445152.db2.gz ZTGNZTHQPXTZOU-QGZVFWFLSA-N 0 3 415.509 4.089 20 0 HIADHN CCNC(=O)COc1ccc(CN[C@@H](C)c2ccccc2C(F)(F)F)cc1OC ZINC000140455931 853445256 /nfs/dbraw/zinc/44/52/56/853445256.db2.gz VLNVLWYLHZBULN-AWEZNQCLSA-N 0 3 410.436 4.080 20 0 HIADHN CCN(C[C@@H](O)COc1ccc(C(C)=O)cc1OC)[C@@H](C)c1cc2ccccc2o1 ZINC000140691044 853450559 /nfs/dbraw/zinc/45/05/59/853450559.db2.gz JKTXKVQXHNBXDD-OXJNMPFZSA-N 0 3 411.498 4.467 20 0 HIADHN CCOc1cc(CN[C@@H](C)c2ccc(N3CCOC3=O)cc2)ccc1OC(F)F ZINC000142747839 853498697 /nfs/dbraw/zinc/49/86/97/853498697.db2.gz ZPTAVBMBDPLNBA-AWEZNQCLSA-N 0 3 406.429 4.494 20 0 HIADHN C[C@@H](NCc1ccc(OCc2ccncc2)cc1)c1ccc(N2CCOC2=O)cc1 ZINC000142724506 853498947 /nfs/dbraw/zinc/49/89/47/853498947.db2.gz KTDSLHCJBMIPML-GOSISDBHSA-N 0 3 403.482 4.468 20 0 HIADHN O[C@@H](CNCc1ccccc1OCc1cccnc1)c1ccc(OC(F)(F)F)cc1 ZINC000143072812 853507181 /nfs/dbraw/zinc/50/71/81/853507181.db2.gz SRLSBFRPNVTLEN-FQEVSTJZSA-N 0 3 418.415 4.382 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)CCCc2nnc(-c3ccccc3)o2)N2CCCC2)cc1 ZINC000143090450 853507463 /nfs/dbraw/zinc/50/74/63/853507463.db2.gz OPDFNDXEQZYDSX-JOCHJYFZSA-N 0 3 418.541 4.321 20 0 HIADHN COCCCCN(Cc1ccccc1)Cc1cc(=O)n2c3ccccc3[nH]c2c1C#N ZINC000144950477 853543630 /nfs/dbraw/zinc/54/36/30/853543630.db2.gz HUJPGXZSDRBJHE-OAQYLSRUSA-N 0 3 414.509 4.152 20 0 HIADHN Cc1cc(NC(=O)c2ccccc2Cl)sc1C(=O)NC[C@@H](C)N1CCCC1 ZINC000147055493 853580870 /nfs/dbraw/zinc/58/08/70/853580870.db2.gz BQMHWELTADEFSU-CQSZACIVSA-N 0 3 405.951 4.176 20 0 HIADHN CN(C)Cc1cccc(NC(=O)N2CCO[C@H](c3ccc(Br)cc3)C2)c1 ZINC000147095588 853581899 /nfs/dbraw/zinc/58/18/99/853581899.db2.gz ZJJKSHXRVJUQRY-IBGZPJMESA-N 0 3 418.335 4.116 20 0 HIADHN O[C@@H](COc1cccc2[nH]ccc21)CN1CC=C(c2c[nH]c3cc(F)ccc32)CC1 ZINC000147328681 853586718 /nfs/dbraw/zinc/58/67/18/853586718.db2.gz STZOWYDLFCGJMH-GOSISDBHSA-N 0 3 405.473 4.317 20 0 HIADHN CCCC(=O)Nc1cccc(NC(=O)NCCCN2CCc3ccccc3C2)c1C ZINC000148112628 853600440 /nfs/dbraw/zinc/60/04/40/853600440.db2.gz ITNPGGYYINRHOW-UHFFFAOYSA-N 0 3 408.546 4.304 20 0 HIADHN CCCCCCNC(=O)C(C#N)C(=O)Cc1csc(-c2ccc(Cl)s2)n1 ZINC000148948909 853616022 /nfs/dbraw/zinc/61/60/22/853616022.db2.gz LBLTVIKLXYDWLW-ZDUSSCGKSA-N 0 3 409.964 4.473 20 0 HIADHN CCc1ccc(-c2nc(CC(=O)NCCCN3CCc4ccccc4C3)cs2)cc1 ZINC000195537389 853672470 /nfs/dbraw/zinc/67/24/70/853672470.db2.gz NGOXMQPVOYGFSD-UHFFFAOYSA-N 0 3 419.594 4.480 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)C1(c2ccccc2)CCCC1 ZINC000195586157 853698404 /nfs/dbraw/zinc/69/84/04/853698404.db2.gz RMIRPXHWCJABDH-UHFFFAOYSA-N 0 3 405.586 4.217 20 0 HIADHN CC(C)(CNC(=O)NC[C@H]1CCCO[C@@H]1c1ccccc1)N1CCc2ccccc2C1 ZINC000195660635 853742193 /nfs/dbraw/zinc/74/21/93/853742193.db2.gz JMXHTYHJVJKYRW-ISKFKSNPSA-N 0 3 421.585 4.290 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)NCc2ccccc2OCC(F)(F)F)N(C)C)cc1 ZINC000195720485 853777460 /nfs/dbraw/zinc/77/74/60/853777460.db2.gz LIHNUSZOBUNUTO-GOSISDBHSA-N 0 3 409.452 4.038 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)c1ccc(-n2cc[nH]c2=S)cc1 ZINC000195745637 853791014 /nfs/dbraw/zinc/79/10/14/853791014.db2.gz IEVLESXZHBGWFE-UHFFFAOYSA-N 0 3 424.595 4.378 20 0 HIADHN COc1ccc(/C=C\C(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)cc1OC ZINC000212525157 853821524 /nfs/dbraw/zinc/82/15/24/853821524.db2.gz QWNSYSHRIWDLRM-FUKPKEADSA-N 0 3 414.571 4.368 20 0 HIADHN O=C(Nc1ccccc1)NC1CCN(CCOc2ccccc2C(F)(F)F)CC1 ZINC000215892506 853839202 /nfs/dbraw/zinc/83/92/02/853839202.db2.gz DHMXXGRGHILJRP-UHFFFAOYSA-N 0 3 407.436 4.370 20 0 HIADHN CN(C)[C@H](CNC(=O)c1cnn(-c2ccccc2F)c1C(F)(F)F)c1ccccc1 ZINC000219393866 853868879 /nfs/dbraw/zinc/86/88/79/853868879.db2.gz BPKLDCWXQJDTRP-GOSISDBHSA-N 0 3 420.410 4.063 20 0 HIADHN C[C@H](Sc1ccccc1Cl)C(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000228904791 853890920 /nfs/dbraw/zinc/89/09/20/853890920.db2.gz WUTQPLYRQPSLPO-BBWFWOEESA-N 0 3 411.011 4.168 20 0 HIADHN Brc1cccc(-c2nc(CNCCCOC[C@@H]3CCOC3)cs2)c1 ZINC000236581486 853899470 /nfs/dbraw/zinc/89/94/70/853899470.db2.gz VATCTPDBTJMQGW-AWEZNQCLSA-N 0 3 411.365 4.105 20 0 HIADHN CC(=O)N(c1nc(CNC[C@H](C)N2CCC(C)CC2)cs1)c1ccc(F)cc1 ZINC000236649811 853907440 /nfs/dbraw/zinc/90/74/40/853907440.db2.gz LHOZZNKXZIRPMR-INIZCTEOSA-N 0 3 404.555 4.177 20 0 HIADHN CCCN1CCN(c2ccccc2CNc2cccc(CN(CC)C(C)=O)c2)CC1 ZINC000236805055 853925387 /nfs/dbraw/zinc/92/53/87/853925387.db2.gz AHUZFRUDCHVLPT-UHFFFAOYSA-N 0 3 408.590 4.199 20 0 HIADHN CC(C)n1ncc2cc(CNCCc3nc4cc(F)ccc4n3C)c(Cl)nc21 ZINC000236842203 853927843 /nfs/dbraw/zinc/92/78/43/853927843.db2.gz UBZGKMFRVVIZSC-UHFFFAOYSA-N 0 3 400.889 4.024 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@H](C)NCc2cc3ccccc3[nH]c2=O)CC1 ZINC000236852747 853928803 /nfs/dbraw/zinc/92/88/03/853928803.db2.gz DOVNOHRDVBTMJK-KRWDZBQOSA-N 0 3 408.521 4.072 20 0 HIADHN CCNC(=O)COc1ccc(CN[C@H](c2ccc(Cl)cc2)[C@H]2C[C@@H]2C)cc1OC ZINC000236909822 853935881 /nfs/dbraw/zinc/93/58/81/853935881.db2.gz QWSATINNZHVMFP-IGCHPXFFSA-N 0 3 416.949 4.350 20 0 HIADHN CCNC(=O)COc1ccc(CN[C@@H]2CCc3c2ccc(Cl)c3Cl)cc1OC ZINC000236910684 853936043 /nfs/dbraw/zinc/93/60/43/853936043.db2.gz HOQHMRLQHDWANM-QGZVFWFLSA-N 0 3 423.340 4.294 20 0 HIADHN CCNC(=O)COc1ccc(CN[C@H](C)c2ccc(-c3ccncc3)cc2)cc1OC ZINC000236911855 853936165 /nfs/dbraw/zinc/93/61/65/853936165.db2.gz RPKDCZVPGRSDOO-GOSISDBHSA-N 0 3 419.525 4.123 20 0 HIADHN CCN(CC)c1ncc(CN[C@@H](C)CC(=O)Nc2cccc(N3CCCC3)c2)s1 ZINC000236995867 853948292 /nfs/dbraw/zinc/94/82/92/853948292.db2.gz PAVSYMDXELUFER-KRWDZBQOSA-N 0 3 415.607 4.096 20 0 HIADHN CCS(=O)(=O)C[C@H](C)NCc1ccc(-c2ccccc2Br)s1 ZINC000237011621 853951578 /nfs/dbraw/zinc/95/15/78/853951578.db2.gz YMPUJAUNGUJXRR-LBPRGKRZSA-N 0 3 402.379 4.090 20 0 HIADHN CC[C@@H](NCc1ccc(OCc2c(C)noc2C)c(OC)c1)c1c(C)nn(C)c1C ZINC000237026823 853953421 /nfs/dbraw/zinc/95/34/21/853953421.db2.gz JXEKMAOUGVEFMI-HXUWFJFHSA-N 0 3 412.534 4.470 20 0 HIADHN CN(C)[C@H](CNCc1nc(-c2ccc(Br)cc2)c[nH]1)c1ccc(F)cc1 ZINC000237040052 853955577 /nfs/dbraw/zinc/95/55/77/853955577.db2.gz HVPQLDBTEPRVHA-LJQANCHMSA-N 0 3 417.326 4.371 20 0 HIADHN CNC(=O)c1cccc(CCNCc2c(C)nn(-c3cccc(Cl)c3)c2Cl)c1 ZINC000237047995 853956835 /nfs/dbraw/zinc/95/68/35/853956835.db2.gz GRJLEJUAOQNGQH-UHFFFAOYSA-N 0 3 417.340 4.179 20 0 HIADHN CN(C(=O)c1ccncc1)c1ccc(CNCc2c[nH]nc2-c2cccs2)cc1 ZINC000237095722 853963851 /nfs/dbraw/zinc/96/38/51/853963851.db2.gz ZRJZXKOUGYAZRU-UHFFFAOYSA-N 0 3 403.511 4.100 20 0 HIADHN COc1cc(CN[C@@H](C)c2ccc(NC(N)=O)cc2)ccc1OCc1c(C)noc1C ZINC000237164711 853974394 /nfs/dbraw/zinc/97/43/94/853974394.db2.gz HAQJZKOMTVSLQX-AWEZNQCLSA-N 0 3 424.501 4.220 20 0 HIADHN COc1cc(CNCCNC(=O)c2ccc(C)cc2)ccc1OCc1cccs1 ZINC000237173449 853975415 /nfs/dbraw/zinc/97/54/15/853975415.db2.gz JZFHPHAUWJNASD-UHFFFAOYSA-N 0 3 410.539 4.164 20 0 HIADHN COCCOc1ccc(CNCC2=Cc3cc(Br)ccc3OC2)cc1 ZINC000237206821 853982035 /nfs/dbraw/zinc/98/20/35/853982035.db2.gz WSWGQZXHKDXGOS-UHFFFAOYSA-N 0 3 404.304 4.040 20 0 HIADHN COc1cc(CNCc2ccc(Cn3ccnc3)cc2)ccc1OCC(F)(F)F ZINC000237246997 853990066 /nfs/dbraw/zinc/99/00/66/853990066.db2.gz NBRGEBWBYDYMRI-UHFFFAOYSA-N 0 3 405.420 4.171 20 0 HIADHN COc1ccc(NC(=O)C[C@@H](C)N[C@@H](c2nc3ccccc3[nH]2)C(C)C)c(OC)c1 ZINC000237292009 853999108 /nfs/dbraw/zinc/99/91/08/853999108.db2.gz LWCJPZLIHXKVDJ-IVZQSRNASA-N 0 3 410.518 4.284 20 0 HIADHN COc1ccc(OCc2nc(CNC[C@H]3CCCN3Cc3ccccc3)cs2)cc1 ZINC000237303569 854002700 /nfs/dbraw/zinc/00/27/00/854002700.db2.gz DEXNRUDCVHPQEO-OAQYLSRUSA-N 0 3 423.582 4.485 20 0 HIADHN COc1ccc(NC(=O)C[C@H](C)N[C@@H](c2ccccc2)c2ccncc2)c(OC)c1 ZINC000237305935 854002896 /nfs/dbraw/zinc/00/28/96/854002896.db2.gz JJKADRVLRHCYCP-XDHUDOTRSA-N 0 3 405.498 4.195 20 0 HIADHN COc1ccc(NC(=O)C[C@H](C)NCc2ccccc2OC(F)(F)F)c(OC)c1 ZINC000237321134 854005692 /nfs/dbraw/zinc/00/56/92/854005692.db2.gz BLGQBLYJAAPYAQ-ZDUSSCGKSA-N 0 3 412.408 4.109 20 0 HIADHN COc1ccc(O)c(CNCc2c(C)nn(-c3ccc(Br)cc3)c2C)c1 ZINC000237361231 854013760 /nfs/dbraw/zinc/01/37/60/854013760.db2.gz URSSEYWTJBRHNI-UHFFFAOYSA-N 0 3 416.319 4.256 20 0 HIADHN COc1cccc(CNC[C@H](c2c(F)cccc2Cl)N2CCO[C@@H](C)C2)c1OC ZINC000237379057 854018414 /nfs/dbraw/zinc/01/84/14/854018414.db2.gz RDNOZVGROFMLCT-HNAYVOBHSA-N 0 3 422.928 4.048 20 0 HIADHN COc1ccc(OC)c(CN[C@H]2CCN(c3ncc(C(F)(F)F)cc3Cl)C2)c1 ZINC000237390160 854020372 /nfs/dbraw/zinc/02/03/72/854020372.db2.gz DRQNFMUOFYZFTD-AWEZNQCLSA-N 0 3 415.843 4.140 20 0 HIADHN Cc1nn(-c2ccccc2)cc1CN[C@@H](C)CC(=O)Nc1cccc(N2CCCC2)c1 ZINC000237394383 854021386 /nfs/dbraw/zinc/02/13/86/854021386.db2.gz RXZPCOJETKFEOH-IBGZPJMESA-N 0 3 417.557 4.288 20 0 HIADHN COc1cc([C@H](C)NCc2ccc3c(c2)OCCO3)ccc1OCc1ccncc1 ZINC000237396797 854022500 /nfs/dbraw/zinc/02/25/00/854022500.db2.gz PTBBBKAWOMRIFD-KRWDZBQOSA-N 0 3 406.482 4.291 20 0 HIADHN COc1cc(C[NH2+]CCc2coc(-c3ccc(F)cc3)n2)cc(Br)c1[O-] ZINC000237415301 854027880 /nfs/dbraw/zinc/02/78/80/854027880.db2.gz JDWDBUFIEIROQO-UHFFFAOYSA-N 0 3 421.266 4.290 20 0 HIADHN C[C@@H](NCc1cn(-c2ccccc2)nc1-c1ccncc1)c1ccc(NC(N)=O)cc1 ZINC000237471039 854039862 /nfs/dbraw/zinc/03/98/62/854039862.db2.gz USOVSAPOUFPBGY-QGZVFWFLSA-N 0 3 412.497 4.276 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2CNCc2cnn(-c3ccc(Cl)cc3)c2)C[C@@H](C)O1 ZINC000237575549 854057143 /nfs/dbraw/zinc/05/71/43/854057143.db2.gz DQJZBABNLLZWSZ-RTBURBONSA-N 0 3 424.976 4.425 20 0 HIADHN Cc1nn(-c2ccc(Br)cc2)c(C)c1CNC[C@H](O)c1ccccc1C ZINC000237627612 854064664 /nfs/dbraw/zinc/06/46/64/854064664.db2.gz QJGXPRAHFUUJET-NRFANRHFSA-N 0 3 414.347 4.383 20 0 HIADHN Cc1nc(COc2ccc(CNCc3ccccc3CN3CCCC3=O)cc2)cs1 ZINC000237662466 854070884 /nfs/dbraw/zinc/07/08/84/854070884.db2.gz BKGJWAWNTOUFBG-UHFFFAOYSA-N 0 3 421.566 4.443 20 0 HIADHN Cn1ncc2c1CCC[C@@H]2NCc1ccc(OC(F)(F)[C@@H](F)C(F)(F)F)cc1 ZINC000237733556 854085754 /nfs/dbraw/zinc/08/57/54/854085754.db2.gz WXEUCUPBFWXINC-HOCLYGCPSA-N 0 3 407.358 4.459 20 0 HIADHN Cc1nn(C)c(OCC(F)(F)F)c1CNCCCO[C@@H]1CCCc2ccccc21 ZINC000237753379 854089211 /nfs/dbraw/zinc/08/92/11/854089211.db2.gz FDJDSNQKLXQGDU-LJQANCHMSA-N 0 3 411.468 4.244 20 0 HIADHN Cc1c(CNCCOc2ccccc2-c2ccccc2)c(=O)n(-c2ccccc2)n1C ZINC000237749735 854089234 /nfs/dbraw/zinc/08/92/34/854089234.db2.gz WLIXRLIPCBOMDZ-UHFFFAOYSA-N 0 3 413.521 4.320 20 0 HIADHN C[C@H]1CN(C(=O)c2ccc(CNCc3cccc(-c4ccncc4)c3)cc2)C[C@H](C)O1 ZINC000237765662 854091673 /nfs/dbraw/zinc/09/16/73/854091673.db2.gz YRPFTNQTDUQEBL-PMACEKPBSA-N 0 3 415.537 4.288 20 0 HIADHN Cc1nn(-c2ccccc2)cc1CNCc1ccccc1CN1C[C@@H](C)O[C@@H](C)C1 ZINC000237778700 854095852 /nfs/dbraw/zinc/09/58/52/854095852.db2.gz ATRDFPMDHNVDMW-BGYRXZFFSA-N 0 3 404.558 4.080 20 0 HIADHN Cn1cc(N2CC[C@@H](NCc3ccc(-c4ccc(Cl)c(Cl)c4)s3)C2=O)cn1 ZINC000237794774 854098912 /nfs/dbraw/zinc/09/89/12/854098912.db2.gz POJZWTPFMPBDQF-QGZVFWFLSA-N 0 3 421.353 4.351 20 0 HIADHN Cc1cc([C@](C)(O)CNCc2cc(Br)ccc2OC(F)F)c(C)o1 ZINC000237801521 854100283 /nfs/dbraw/zinc/10/02/83/854100283.db2.gz LOJYGXZDJXHWBV-QGZVFWFLSA-N 0 3 404.251 4.258 20 0 HIADHN Cc1nn(-c2cccc(C(F)(F)F)c2)c(Cl)c1CNC[C@@H]1CCC[C@@H](O)C1 ZINC000237809417 854101266 /nfs/dbraw/zinc/10/12/66/854101266.db2.gz JGARQMRDQZQMIN-CZUORRHYSA-N 0 3 401.860 4.494 20 0 HIADHN Cc1ccc(CNCc2ccnc(N3CCN(c4ccc(F)cc4)CC3)c2)cc1F ZINC000237882974 854113683 /nfs/dbraw/zinc/11/36/83/854113683.db2.gz QBKGHCQNJFZJIF-UHFFFAOYSA-N 0 3 408.496 4.285 20 0 HIADHN Cc1nn(Cc2ccc(Cl)cc2)c(Cl)c1CNCCCOC[C@H]1CCOC1 ZINC000237892167 854115672 /nfs/dbraw/zinc/11/56/72/854115672.db2.gz QKHSAUALNUZPIS-QGZVFWFLSA-N 0 3 412.361 4.079 20 0 HIADHN Cc1nn(Cc2ccc(Cl)cc2)c(Cl)c1CNCCCOC1CCOCC1 ZINC000237891953 854115892 /nfs/dbraw/zinc/11/58/92/854115892.db2.gz SNJWAKVYXXYWSY-UHFFFAOYSA-N 0 3 412.361 4.222 20 0 HIADHN Cc1nn(-c2ccc(Br)cc2)c(C)c1CNC[C@H](O)c1ccc(C)cc1 ZINC000237898247 854116623 /nfs/dbraw/zinc/11/66/23/854116623.db2.gz KYILJXJLRVTKTG-NRFANRHFSA-N 0 3 414.347 4.383 20 0 HIADHN O=C(CCCOc1ccccc1)Nc1ccc(CNCc2cnc3ccccn23)cc1 ZINC000238003684 854131849 /nfs/dbraw/zinc/13/18/49/854131849.db2.gz XIPOXYBCLOUQFR-UHFFFAOYSA-N 0 3 414.509 4.422 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)c1ccc(NC(=O)c2cccs2)cc1 ZINC000248048815 854175717 /nfs/dbraw/zinc/17/57/17/854175717.db2.gz XBPJNUBTJNGKGZ-UHFFFAOYSA-N 0 3 407.539 4.204 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)Cc2csc(-c3cccc(F)c3)n2)CC1 ZINC000248156317 854182890 /nfs/dbraw/zinc/18/28/90/854182890.db2.gz VUCAORSXLDGDQJ-UHFFFAOYSA-N 0 3 413.518 4.208 20 0 HIADHN Cc1ccccc1-n1nc(C(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)c2c1CCC2 ZINC000250993674 854196599 /nfs/dbraw/zinc/19/65/99/854196599.db2.gz QEYZODNMDWWFRW-CTNGQTDRSA-N 0 3 414.553 4.235 20 0 HIADHN CCN(C(=O)c1ccc(Br)cn1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000261400969 854249225 /nfs/dbraw/zinc/24/92/25/854249225.db2.gz GKBKADJQNZSJHD-YJBOKZPZSA-N 0 3 402.336 4.142 20 0 HIADHN COc1cc(C(=O)N(CC(C)C)C2CCN(C)CC2)ccc1OCc1ccccc1 ZINC000261428085 854259171 /nfs/dbraw/zinc/25/91/71/854259171.db2.gz RLMRZAPVJWJWIZ-UHFFFAOYSA-N 0 3 410.558 4.467 20 0 HIADHN C[C@@H](CNc1ccc(C(=O)N2CCc3ccccc32)cn1)N1CCc2ccccc2C1 ZINC000301261271 854342479 /nfs/dbraw/zinc/34/24/79/854342479.db2.gz VCFOHUOBKGSSCD-IBGZPJMESA-N 0 3 412.537 4.143 20 0 HIADHN Cc1cc(CN2CCN(c3c(C)c(C)nc4ccc(Br)cc43)CC2)on1 ZINC000301348715 854367135 /nfs/dbraw/zinc/36/71/35/854367135.db2.gz IZACCUILOHDWHI-UHFFFAOYSA-N 0 3 415.335 4.233 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(NC[C@@H]3CCC[N@H+](C)[C@@H]3c3cccs3)nc2)n1 ZINC000301421492 854390126 /nfs/dbraw/zinc/39/01/26/854390126.db2.gz NSQHXNCWYBWQKH-BTYIYWSLSA-N 0 3 409.559 4.363 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(NC[C@@H]3CCC[N@@H+](C)[C@@H]3c3cccs3)nc2)n1 ZINC000301421492 854390133 /nfs/dbraw/zinc/39/01/33/854390133.db2.gz NSQHXNCWYBWQKH-BTYIYWSLSA-N 0 3 409.559 4.363 20 0 HIADHN O=S(=O)(c1ccc(N2CC[C@@H]3[C@@H](CCCN3Cc3ccccc3)C2)cc1)C(F)F ZINC000301660363 854439030 /nfs/dbraw/zinc/43/90/30/854439030.db2.gz CLSBFJRUIUYFOQ-GHTZIAJQSA-N 0 3 420.525 4.174 20 0 HIADHN c1csc(CN2CCC[C@@H](CNc3nn4cc(-c5cccnc5)nc4s3)C2)c1 ZINC000302058190 854523725 /nfs/dbraw/zinc/52/37/25/854523725.db2.gz AUIWRFVQYUUIQM-HNNXBMFYSA-N 0 3 410.572 4.238 20 0 HIADHN C[C@@H]1C[C@@H](N(C)c2nn3cc(-c4cccnc4)nc3s2)CCN1Cc1ccccc1 ZINC000302152454 854538316 /nfs/dbraw/zinc/53/83/16/854538316.db2.gz HYNCJQJCXAVAQE-XLIONFOSSA-N 0 3 418.570 4.342 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CC[C@@H]1Nc1nn2cc(-c3cccnc3)nc2s1 ZINC000302193551 854547376 /nfs/dbraw/zinc/54/73/76/854547376.db2.gz RVGFXLQELTVQOC-LPHOPBHVSA-N 0 3 404.543 4.175 20 0 HIADHN COc1ccccc1[C@H](CNc1ccc2nnc(C(C)(C)C)n2n1)N1CCCCC1 ZINC000302598971 854590634 /nfs/dbraw/zinc/59/06/34/854590634.db2.gz YAVDYYGQDIKSBF-SFHVURJKSA-N 0 3 408.550 4.070 20 0 HIADHN CCS(=O)(=O)N1CCC(Nc2ccnc3ccc(Oc4ccccc4)cc32)CC1 ZINC000302768682 854628000 /nfs/dbraw/zinc/62/80/00/854628000.db2.gz BHOMTPZCHFGLKY-UHFFFAOYSA-N 0 3 411.527 4.253 20 0 HIADHN CN(C[C@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)c1cc(Cl)sc1Cl ZINC000437320834 862588221 /nfs/dbraw/zinc/58/82/21/862588221.db2.gz IMRDDPGBTGNRSL-CQSZACIVSA-N 0 3 419.399 4.198 20 0 HIADHN CN1CC[C@H](Nc2ncc(Cn3cc(Br)cn3)s2)[C@@H]1c1ccccc1 ZINC000302839122 854651752 /nfs/dbraw/zinc/65/17/52/854651752.db2.gz YYIBZSRYMBUMSB-IRXDYDNUSA-N 0 3 418.364 4.008 20 0 HIADHN COc1ccc([C@@H](CNC(=O)C2=Cc3cc(Cl)ccc3OC2)N2CCCC2)cc1 ZINC000302845623 854654853 /nfs/dbraw/zinc/65/48/53/854654853.db2.gz MVOJRGBJKBCSSA-OAQYLSRUSA-N 0 3 412.917 4.078 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cc([N+](=O)[O-])ccc1Cl)c1cccc(OC)c1 ZINC000302877187 854663838 /nfs/dbraw/zinc/66/38/38/854663838.db2.gz GDGMOGOTKVIACF-IBGZPJMESA-N 0 3 405.882 4.070 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Cc1cccc(C(F)(F)F)c1)c1cccc(OC)c1 ZINC000302878870 854665426 /nfs/dbraw/zinc/66/54/26/854665426.db2.gz MDIREOGUCSIRNW-FQEVSTJZSA-N 0 3 408.464 4.456 20 0 HIADHN CC1CCN([C@H](CNC(=O)N(C)CCOc2ccccc2)c2cccs2)CC1 ZINC000302904322 854674529 /nfs/dbraw/zinc/67/45/29/854674529.db2.gz XHKQLBVEKZRUHH-HXUWFJFHSA-N 0 3 401.576 4.242 20 0 HIADHN COc1ccc([C@@H](NCC(=O)Nc2cc3c(cc2Cl)OCCCO3)C(C)C)cc1 ZINC000302918312 854679035 /nfs/dbraw/zinc/67/90/35/854679035.db2.gz BMUBCVOZZUSGBH-QFIPXVFZSA-N 0 3 418.921 4.435 20 0 HIADHN Cc1noc2nc(C(C)C)cc(C(=O)NCC(C)(C)N3CCc4ccccc4C3)c12 ZINC000302929709 854683875 /nfs/dbraw/zinc/68/38/75/854683875.db2.gz DRFLTWLSMZVGTE-UHFFFAOYSA-N 0 3 406.530 4.221 20 0 HIADHN COCCN1CCC(NC(=O)c2cc(-c3ccc(C)cc3)nc3ccccc32)CC1 ZINC000302955172 854694395 /nfs/dbraw/zinc/69/43/95/854694395.db2.gz BHBQWZDKVRLNID-UHFFFAOYSA-N 0 3 403.526 4.051 20 0 HIADHN CC(C)N(C)CC(=O)N(C)Cc1cn(-c2ccccc2)nc1-c1ccc(Cl)cc1 ZINC000302954267 854694825 /nfs/dbraw/zinc/69/48/25/854694825.db2.gz CPPLTWXOUGWCTI-UHFFFAOYSA-N 0 3 410.949 4.491 20 0 HIADHN O=C(Nc1ccc(OCC(F)(F)F)nc1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000302958931 854696185 /nfs/dbraw/zinc/69/61/85/854696185.db2.gz FSVJGSHFTAEURB-OAHLLOKOSA-N 0 3 411.399 4.013 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3N(C)C)cc2)CC1 ZINC000303007496 854720159 /nfs/dbraw/zinc/72/01/59/854720159.db2.gz PUCXIRGTENPYCT-UHFFFAOYSA-N 0 3 400.954 4.189 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)c1ccc(SC(F)F)cc1 ZINC000303025956 854729310 /nfs/dbraw/zinc/72/93/10/854729310.db2.gz VWPMKQIKLNIMCC-UHFFFAOYSA-N 0 3 400.441 4.484 20 0 HIADHN CCn1cc(CC(=O)NC[C@H](c2cccc(OC)c2)N2CCCC2)c2ccccc21 ZINC000303050344 854739419 /nfs/dbraw/zinc/73/94/19/854739419.db2.gz RNQCHUTWISWOLR-XMMPIXPASA-N 0 3 405.542 4.166 20 0 HIADHN CCOC(=O)c1sc2ncnc(NC[C@H](c3ccco3)N(CC)CC)c2c1C ZINC000303069116 854747600 /nfs/dbraw/zinc/74/76/00/854747600.db2.gz OEQHOQVHFFLZAS-CQSZACIVSA-N 0 3 402.520 4.264 20 0 HIADHN Cc1c(C(=O)N2CCCN(CCCc3ccccc3)CC2)cnn1-c1ccccc1C ZINC000303090475 854756403 /nfs/dbraw/zinc/75/64/03/854756403.db2.gz CZDSAHGHNCEQFI-UHFFFAOYSA-N 0 3 416.569 4.270 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cc(Br)cnc1Cl)c1ccsc1 ZINC000303101412 854761196 /nfs/dbraw/zinc/76/11/96/854761196.db2.gz HVGKLERZVVENKG-CQSZACIVSA-N 0 3 416.772 4.372 20 0 HIADHN COc1ccc(CNC[C@@H](c2c(F)cccc2Cl)N2CCO[C@H](C)C2)c(OC)c1 ZINC000303228646 854826697 /nfs/dbraw/zinc/82/66/97/854826697.db2.gz XMXZAONGPBEPQQ-QRWLVFNGSA-N 0 3 422.928 4.048 20 0 HIADHN COCCN1CCC[C@@H]1CNC(=O)c1ccc(CSc2ccc(Cl)cc2)cc1 ZINC000303231742 854827682 /nfs/dbraw/zinc/82/76/82/854827682.db2.gz XZDGQUJETGYEON-HXUWFJFHSA-N 0 3 418.990 4.473 20 0 HIADHN Cc1nn(Cc2ccc(C)cc2)c(C)c1CCC(=O)NC[C@H](c1ccccc1)N(C)C ZINC000303262244 854840087 /nfs/dbraw/zinc/84/00/87/854840087.db2.gz DEBHEEKMTVJIKX-RUZDIDTESA-N 0 3 418.585 4.208 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)C1(c2ccccc2Cl)CCOCC1 ZINC000303300633 854860113 /nfs/dbraw/zinc/86/01/13/854860113.db2.gz MMYNLFXYIGMLPF-JOCHJYFZSA-N 0 3 412.961 4.342 20 0 HIADHN CCCO[C@H]1CCCN(C(=O)Nc2ccc(CCN3CCSCC3)cc2)CC1 ZINC000303352773 854887836 /nfs/dbraw/zinc/88/78/36/854887836.db2.gz FMOMBDBAFAMWLA-NRFANRHFSA-N 0 3 405.608 4.091 20 0 HIADHN O=C(NC[C@H](O)c1ccc2ccccc2c1)NC[C@@H](c1cccs1)N1CCCC1 ZINC000303354313 854888828 /nfs/dbraw/zinc/88/88/28/854888828.db2.gz GJEAOHROKUWUGD-SFTDATJTSA-N 0 3 409.555 4.071 20 0 HIADHN O=C(NC[C@H](O)c1ccc2ccccc2c1)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000303431932 854932902 /nfs/dbraw/zinc/93/29/02/854932902.db2.gz XANCLOLBKNKWMA-ZEQRLZLVSA-N 0 3 403.526 4.010 20 0 HIADHN COc1ccc([C@H]2CCCN2C(=O)NC[C@@H](C)N(C)Cc2ccccc2)c(OC)c1 ZINC000303434829 854935735 /nfs/dbraw/zinc/93/57/35/854935735.db2.gz DEPVXNTWYLEERR-XMSQKQJNSA-N 0 3 411.546 4.071 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)c1cc(F)c(Cl)nc1Cl ZINC000303451069 854950546 /nfs/dbraw/zinc/95/05/46/854950546.db2.gz CRQMLOUZOTZIPC-UHFFFAOYSA-N 0 3 406.235 4.010 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)[C@@H]1C[C@@H]1c1cccc(C(F)(F)F)c1 ZINC000303454026 854953646 /nfs/dbraw/zinc/95/36/46/854953646.db2.gz KEBKSASFZVIEEO-NHCUHLMSSA-N 0 3 402.460 4.374 20 0 HIADHN Cc1nc(COc2cccc(C(=O)NC[C@H](C)N(C)Cc3ccccc3)c2)cs1 ZINC000303494425 854983923 /nfs/dbraw/zinc/98/39/23/854983923.db2.gz QLIVIRKRBCDNGW-KRWDZBQOSA-N 0 3 409.555 4.281 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2cccc(COc3ccc(C)nc3)c2)N(C)C)cc1 ZINC000303544837 855031115 /nfs/dbraw/zinc/03/11/15/855031115.db2.gz KOBRSMMFISIOQG-XMMPIXPASA-N 0 3 403.526 4.310 20 0 HIADHN CCN(CC)[C@H](CNC(=O)[C@H]1C[C@H]1c1ccc(F)cc1F)c1cccc(OC)c1 ZINC000303554797 855036829 /nfs/dbraw/zinc/03/68/29/855036829.db2.gz WDIJHVXPVFZFJE-JAXLGGSGSA-N 0 3 402.485 4.276 20 0 HIADHN COCCOc1ccc(NC(=O)c2oc3ccccc3c2CN(C)C)cc1Cl ZINC000303558458 855038599 /nfs/dbraw/zinc/03/85/99/855038599.db2.gz MZIRQNFXMFPFQI-UHFFFAOYSA-N 0 3 402.878 4.425 20 0 HIADHN CCN1CCCC[C@@H]1CNC(=O)c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1 ZINC000303558888 855040053 /nfs/dbraw/zinc/04/00/53/855040053.db2.gz XCIOCAKKDSUQAY-QGZVFWFLSA-N 0 3 407.436 4.497 20 0 HIADHN COc1cc([C@H](C)NC(=O)[C@H](C)N2CCCCCC2)ccc1OCc1ccncc1 ZINC000303568348 855045238 /nfs/dbraw/zinc/04/52/38/855045238.db2.gz OLZKFZFAMWJTOR-OALUTQOASA-N 0 3 411.546 4.111 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)Nc3ccccc3OC(C)(C)C)CC2)C[C@H](C)O1 ZINC000303701138 855140830 /nfs/dbraw/zinc/14/08/30/855140830.db2.gz OGQJICNHTGVFMY-ROUUACIJSA-N 0 3 403.567 4.217 20 0 HIADHN CO[C@@H](c1ccc(Cl)cc1)[C@H](C)NC(=O)N1CCCN(Cc2ccccc2)CC1 ZINC000303745989 855168183 /nfs/dbraw/zinc/16/81/83/855168183.db2.gz FZWAFIXNTOKVNS-PGRDOPGGSA-N 0 3 415.965 4.334 20 0 HIADHN COc1cc(C(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)ccc1OC(F)F ZINC000303779016 855194115 /nfs/dbraw/zinc/19/41/15/855194115.db2.gz CPRDSIXBZMAERL-MRXNPFEDSA-N 0 3 404.457 4.033 20 0 HIADHN CC[C@](C)(NC(=O)Nc1ccc(CCN2CCSCC2)cc1)c1nccs1 ZINC000303782006 855195009 /nfs/dbraw/zinc/19/50/09/855195009.db2.gz GUUGIVRKHDVWSZ-FQEVSTJZSA-N 0 3 404.605 4.181 20 0 HIADHN Cc1cnc2c(cccc2S(=O)(=O)N(C)[C@@H]2CCN(Cc3ccccc3)[C@H](C)C2)c1 ZINC000303801468 855205387 /nfs/dbraw/zinc/20/53/87/855205387.db2.gz LSNNTWKSLBZNRM-DENIHFKCSA-N 0 3 423.582 4.217 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)Cc1coc(-c2ccc(F)cc2)n1 ZINC000303808533 855212460 /nfs/dbraw/zinc/21/24/60/855212460.db2.gz IAWOHFDHENRJBG-GOSISDBHSA-N 0 3 407.489 4.146 20 0 HIADHN C[C@@H]1C[C@H](N(C)S(=O)(=O)C2=Cc3ccccc3CC2)CCN1Cc1ccccc1 ZINC000303834103 855232233 /nfs/dbraw/zinc/23/22/33/855232233.db2.gz RLEBFKWLFHCPNS-AUSIDOKSSA-N 0 3 410.583 4.288 20 0 HIADHN O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)[C@@H]1C[C@@H]1c1ccccc1OC(F)(F)F ZINC000303857310 855252631 /nfs/dbraw/zinc/25/26/31/855252631.db2.gz LULPCEDQYKLEOV-MISYRCLQSA-N 0 3 418.459 4.470 20 0 HIADHN COCCCOc1ccccc1NC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C ZINC000303863144 855258017 /nfs/dbraw/zinc/25/80/17/855258017.db2.gz MUFSPOBGMCUNBA-HXUWFJFHSA-N 0 3 411.546 4.230 20 0 HIADHN CCCOCc1ccccc1CNC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C ZINC000303867039 855260459 /nfs/dbraw/zinc/26/04/59/855260459.db2.gz QDPLRADARMGXSH-NRFANRHFSA-N 0 3 409.574 4.419 20 0 HIADHN Cc1[nH]c2ccc(C(=O)Nc3ccc(C(=O)N(C)[C@H]4CCCN(C)C4)cc3)cc2c1C ZINC000303883060 855268796 /nfs/dbraw/zinc/26/87/96/855268796.db2.gz JOQASPPWFXDTTL-NRFANRHFSA-N 0 3 418.541 4.203 20 0 HIADHN Cc1ccc([C@H](CNC(=O)[C@@H]2C[C@@H]2c2ccccc2OC(F)(F)F)N(C)C)cc1 ZINC000303906906 855281645 /nfs/dbraw/zinc/28/16/45/855281645.db2.gz RBYIWETYQHCLSH-QRVBRYPASA-N 0 3 406.448 4.416 20 0 HIADHN CC(C)CNC(=O)c1ccc(NC(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)cc1 ZINC000303934876 855302173 /nfs/dbraw/zinc/30/21/73/855302173.db2.gz WFGOEMKNTUJFFL-HXUWFJFHSA-N 0 3 422.573 4.201 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)NC[C@H]1CCCO[C@@H]1c1ccccc1 ZINC000303951109 855313762 /nfs/dbraw/zinc/31/37/62/855313762.db2.gz ZWZYJRSJPBKZRS-NQHRYMMQSA-N 0 3 421.585 4.460 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2ccccc2C(F)(F)F)cc1)[C@H]1CCCN(C)C1 ZINC000303953641 855316673 /nfs/dbraw/zinc/31/66/73/855316673.db2.gz UJXAWWWMKHIGJA-KRWDZBQOSA-N 0 3 419.447 4.124 20 0 HIADHN Cc1cccc2c(CCC(=O)NCCCCN3CCN(c4ccccc4)CC3)c[nH]c21 ZINC000303962865 855324901 /nfs/dbraw/zinc/32/49/01/855324901.db2.gz XFXMSUGHWLQBJZ-UHFFFAOYSA-N 0 3 418.585 4.128 20 0 HIADHN CC(C)Cc1ccc(CC(=O)Nc2ccc(C(=O)N(C)[C@@H]3CCCN(C)C3)cc2)cc1 ZINC000303971252 855330699 /nfs/dbraw/zinc/33/06/99/855330699.db2.gz ZZIAPNSBNXHHBT-XMMPIXPASA-N 0 3 421.585 4.233 20 0 HIADHN Cn1ncc(Br)c1CNCCc1ccc(OCc2ccccc2)cc1 ZINC000311010193 855368633 /nfs/dbraw/zinc/36/86/33/855368633.db2.gz JVKNTQSZMKCERF-UHFFFAOYSA-N 0 3 400.320 4.094 20 0 HIADHN COc1ccc(Br)c(C(=O)N2CCN(Cc3ccccc3)C[C@@H](C)C2)c1 ZINC000324010989 855397517 /nfs/dbraw/zinc/39/75/17/855397517.db2.gz LIQBRVALEZCRNS-MRXNPFEDSA-N 0 3 417.347 4.052 20 0 HIADHN C[C@H](C[C@H]1COCCN1C(=O)OC(C)(C)C)NCc1ccsc1Br ZINC000388551051 855448125 /nfs/dbraw/zinc/44/81/25/855448125.db2.gz PAKDLDUZOAANDF-OCCSQVGLSA-N 0 3 419.385 4.015 20 0 HIADHN Cc1ccc(-c2noc(CCC(=O)N[C@@H]3CCN([C@@H](C)c4ccccc4)C3)n2)cc1F ZINC000409456055 855487211 /nfs/dbraw/zinc/48/72/11/855487211.db2.gz ZTSPPUHIWKKWFR-FXAWDEMLSA-N 0 3 422.504 4.068 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)C(C)(C)Cc2nc3ccccc3[nH]2)N2CCCC2)cc1 ZINC000409608877 855563169 /nfs/dbraw/zinc/56/31/69/855563169.db2.gz RWJJZHXFCMHXIG-JOCHJYFZSA-N 0 3 404.558 4.393 20 0 HIADHN O=C(c1cccc(C2CCC2)c1)N1CCC[C@@H](CN2CCN(c3ccccn3)CC2)C1 ZINC000409623433 855569986 /nfs/dbraw/zinc/56/99/86/855569986.db2.gz RQHSGVFJXAYXJW-NRFANRHFSA-N 0 3 418.585 4.024 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)N[C@@H]1CCSc2ccc(F)cc21 ZINC000409647853 855581464 /nfs/dbraw/zinc/58/14/64/855581464.db2.gz DUQFCZLQXBGOGG-OAQYLSRUSA-N 0 3 413.562 4.081 20 0 HIADHN CSc1cccc(NC(=O)NCCCCN2CCN(Cc3ccccc3)CC2)c1 ZINC000409689649 855603323 /nfs/dbraw/zinc/60/33/23/855603323.db2.gz SYXPLQGUAUWRPV-UHFFFAOYSA-N 0 3 412.603 4.128 20 0 HIADHN C[C@@H]1CCN(C(=O)c2ccc3c(c2)nc(C(F)F)n3C)CCN1Cc1ccccc1 ZINC000409752872 855636510 /nfs/dbraw/zinc/63/65/10/855636510.db2.gz JPZRGPZZAMAMBW-MRXNPFEDSA-N 0 3 412.484 4.248 20 0 HIADHN O=C(NCc1ccc2c(c1)OCO2)[C@H](NC[C@@H]1CCCC(F)(F)C1)c1ccccc1 ZINC000409865426 855694908 /nfs/dbraw/zinc/69/49/08/855694908.db2.gz FANFONVPKFOTOD-DYESRHJHSA-N 0 3 416.468 4.188 20 0 HIADHN C[C@@H](C(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1)c1ccc(C(F)(F)F)cc1 ZINC000409994996 855768768 /nfs/dbraw/zinc/76/87/68/855768768.db2.gz XUEUVRZNTBGKFW-DYESRHJHSA-N 0 3 420.475 4.216 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3cc(OC)cc(OC)c3C)c(C)c2)CC1 ZINC000410036385 855790666 /nfs/dbraw/zinc/79/06/66/855790666.db2.gz CEWWUCBHQCDTDF-UHFFFAOYSA-N 0 3 412.534 4.107 20 0 HIADHN CC(C)(C)[C@H](CN1CCc2ccccc2C1)NC(=O)c1ccc(-n2ccnc2)cc1 ZINC000410109798 855824385 /nfs/dbraw/zinc/82/43/85/855824385.db2.gz YVOVBGCYEGDGSO-QHCPKHFHSA-N 0 3 402.542 4.075 20 0 HIADHN O=C(NCc1ccc(F)cc1C(F)(F)F)NC[C@H](c1ccccc1)N1CCCC1 ZINC000410172429 855849612 /nfs/dbraw/zinc/84/96/12/855849612.db2.gz QJBCXHKBUMQDQW-LJQANCHMSA-N 0 3 409.427 4.481 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)NCc2cccc(NC(=O)C3CCC3)c2)N(C)C)cc1 ZINC000410316156 855924762 /nfs/dbraw/zinc/92/47/62/855924762.db2.gz LKPANXYKSYQDTN-HSZRJFAPSA-N 0 3 422.573 4.090 20 0 HIADHN C[C@@H](c1cc2ccccc2o1)N(C)C(=O)NCc1ccc(CN2CCN(C)CC2)cc1 ZINC000410368084 855954835 /nfs/dbraw/zinc/95/48/35/855954835.db2.gz SUFUBAPGNJOYRU-IBGZPJMESA-N 0 3 420.557 4.083 20 0 HIADHN C[C@@H]1CN(C2CCOCC2)CCN1C(=O)N[C@@H](c1cccc(Cl)c1)C1CCCC1 ZINC000425928291 856004053 /nfs/dbraw/zinc/00/40/53/856004053.db2.gz XTKMAKIJGJFOMM-VGOFRKELSA-N 0 3 419.997 4.466 20 0 HIADHN CS(=O)(=O)Cc1ccc(CN[C@@H](Cc2cccnc2)c2cccc(Cl)c2)cc1 ZINC000425952817 856014503 /nfs/dbraw/zinc/01/45/03/856014503.db2.gz UKNSTCCXPBTBKZ-QFIPXVFZSA-N 0 3 414.958 4.353 20 0 HIADHN CN1CC[C@@H](NC(=O)NCc2ccnc(Oc3ccccc3F)c2)[C@H]1c1ccccc1 ZINC000425975931 856025863 /nfs/dbraw/zinc/02/58/63/856025863.db2.gz DJADZQMRWXVWDX-NFBKMPQASA-N 0 3 420.488 4.258 20 0 HIADHN CN(C(=O)NCc1ccc(C2CCC2)cc1)C1CCN(CCc2ccccn2)CC1 ZINC000426088996 856100447 /nfs/dbraw/zinc/10/04/47/856100447.db2.gz KNJCCFLMSXTCKH-UHFFFAOYSA-N 0 3 406.574 4.198 20 0 HIADHN CCCn1ccc2cc(NC(=O)N[C@H]3CCN(Cc4ccccc4)C[C@@H]3CO)ccc21 ZINC000426106579 856111522 /nfs/dbraw/zinc/11/15/22/856111522.db2.gz PBEPPMDWLUVWQG-GGAORHGYSA-N 0 3 420.557 4.056 20 0 HIADHN O=C(NCC(F)(F)F)[C@H]1CCN(CCSc2cc(Cl)ccc2Cl)C1 ZINC000426157024 856144964 /nfs/dbraw/zinc/14/49/64/856144964.db2.gz OYXZRORRBNQKJR-JTQLQIEISA-N 0 3 401.281 4.086 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C)c1nc(C(F)(F)F)cs1 ZINC000426238912 856196671 /nfs/dbraw/zinc/19/66/71/856196671.db2.gz MJZKBJMKFNHNRC-VNHYZAJKSA-N 0 3 412.481 4.043 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)NC12CCC(C(F)(F)F)(CC1)CC2 ZINC000426246894 856200594 /nfs/dbraw/zinc/20/05/94/856200594.db2.gz WTWZJXNVMWDEOG-IWCLVNKQSA-N 0 3 409.496 4.461 20 0 HIADHN CN(C)CC1(C(=O)Nc2cccc(CS(=O)(=O)C3CCCCC3)c2)CCCCC1 ZINC000426299273 856230323 /nfs/dbraw/zinc/23/03/23/856230323.db2.gz ULHWJABTHMEDCG-UHFFFAOYSA-N 0 3 420.619 4.385 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N[C@@H]2c3ccccc3CC[C@@H]2n2ccnc2)N(C)C)cc1 ZINC000426304542 856233900 /nfs/dbraw/zinc/23/39/00/856233900.db2.gz CWACNSFDVCYYPR-KMDXXIMOSA-N 0 3 417.557 4.022 20 0 HIADHN C[C@H](CC(=O)Nc1ccccc1C(F)(F)F)NCc1cc2ccccc2n(C)c1=O ZINC000426305815 856234763 /nfs/dbraw/zinc/23/47/63/856234763.db2.gz DOMYGYLULKHFPJ-CQSZACIVSA-N 0 3 417.431 4.064 20 0 HIADHN Cc1cc(CN[C@H](C)Cc2ccc(Br)cc2F)nc(N2CCCC2)n1 ZINC000426317855 856242566 /nfs/dbraw/zinc/24/25/66/856242566.db2.gz HFQKLPJNUJFYHL-CYBMUJFWSA-N 0 3 407.331 4.008 20 0 HIADHN CN(C)[C@H]1Cc2ccccc2N(C(=O)c2cc3ccccc3n2CC(F)(F)F)C1 ZINC000426325023 856246836 /nfs/dbraw/zinc/24/68/36/856246836.db2.gz TVQMTVLMHWSGTF-KRWDZBQOSA-N 0 3 401.432 4.337 20 0 HIADHN C[C@@H](N[C@@H]1c2cccc(Br)c2CC1(C)C)c1cccc(S(N)(=O)=O)c1 ZINC000426330167 856248987 /nfs/dbraw/zinc/24/89/87/856248987.db2.gz JGMDCWCGLPBOFG-KZULUSFZSA-N 0 3 423.376 4.071 20 0 HIADHN COc1ccccc1[C@H](NC(=O)NC[C@H]1CCCN1Cc1ccccc1)c1ccco1 ZINC000426466550 856306473 /nfs/dbraw/zinc/30/64/73/856306473.db2.gz CPEHXKOTKFUMMB-YKSBVNFPSA-N 0 3 419.525 4.341 20 0 HIADHN C[C@@H](CSc1ccc(F)cc1)C(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000426656074 856397076 /nfs/dbraw/zinc/39/70/76/856397076.db2.gz WHIIPRKPPUSBCW-IPMKNSEASA-N 0 3 422.610 4.292 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3c[nH]cc3-c3ccccc3F)CC2)C[C@H](C)O1 ZINC000426667769 856403365 /nfs/dbraw/zinc/40/33/65/856403365.db2.gz ZTJWBSFCVKGDAR-HDICACEKSA-N 0 3 413.537 4.172 20 0 HIADHN COc1ccccc1[C@H](NC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1)c1ccco1 ZINC000426773747 856470116 /nfs/dbraw/zinc/47/01/16/856470116.db2.gz LIFCLLONGSTPSM-YKSBVNFPSA-N 0 3 419.525 4.294 20 0 HIADHN O=C(CN1C[C@@H]2CCCC[C@@H]2C1)N(Cc1nnc(-c2ccccc2Cl)o1)C1CC1 ZINC000426790027 856480119 /nfs/dbraw/zinc/48/01/19/856480119.db2.gz ZUDGPQSBEZXNOC-IYBDPMFKSA-N 0 3 414.937 4.003 20 0 HIADHN CN(C)C(=O)c1ccc(NC(=O)CN(Cc2ccccc2)[C@H]2CCCC2(C)C)cc1 ZINC000426832324 856504324 /nfs/dbraw/zinc/50/43/24/856504324.db2.gz ITJHSXWVBKAVEL-QFIPXVFZSA-N 0 3 407.558 4.408 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)NCc1nc(-c2ccccc2F)cs1 ZINC000426901449 856533653 /nfs/dbraw/zinc/53/36/53/856533653.db2.gz SKKIPUCVGZCRAE-UHFFFAOYSA-N 0 3 418.563 4.284 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)Nc1ccc(OCC(C)C)c(Cl)c1 ZINC000437440140 862809748 /nfs/dbraw/zinc/80/97/48/862809748.db2.gz RSAYTLFJMHANRQ-UHFFFAOYSA-N 0 3 417.937 4.322 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)C/C=C/c2ccccc2F)cc1)[C@H]1CCCN(C)C1 ZINC000426948126 856556524 /nfs/dbraw/zinc/55/65/24/856556524.db2.gz KGYSUFCOVYYYTL-FERLCFGISA-N 0 3 409.505 4.034 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)N[C@@H]2CCC[C@@H]2OCc2ccccc2)CC1 ZINC000426980078 856577410 /nfs/dbraw/zinc/57/74/10/856577410.db2.gz HUWCVMGCPQJLDU-RPBOFIJWSA-N 0 3 421.585 4.430 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)N[C@H]2CCC[C@H]2OCc2ccccc2)CC1 ZINC000426980077 856577592 /nfs/dbraw/zinc/57/75/92/856577592.db2.gz HUWCVMGCPQJLDU-LOSJGSFVSA-N 0 3 421.585 4.430 20 0 HIADHN CCc1c(C(=O)Nc2ccc(N3CCN(CC)CC3)cc2C)cnn1CCC(C)C ZINC000427117909 856649151 /nfs/dbraw/zinc/64/91/51/856649151.db2.gz QWZUGIXTBDHAEM-UHFFFAOYSA-N 0 3 411.594 4.194 20 0 HIADHN Cc1ccc(-c2c[nH]cc2C(=O)N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)s1 ZINC000427125800 856655454 /nfs/dbraw/zinc/65/54/54/856655454.db2.gz HNVGUYSMVRVELB-IYBDPMFKSA-N 0 3 401.576 4.013 20 0 HIADHN Cc1ccc(S[C@@H](C)C(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)cc1 ZINC000427286479 856751354 /nfs/dbraw/zinc/75/13/54/856751354.db2.gz GADGKTDOXFFABA-ZCNNSNEGSA-N 0 3 404.620 4.214 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3cccc(-c4cscn4)c3)CC2)C[C@@H](C)O1 ZINC000427294385 856756468 /nfs/dbraw/zinc/75/64/68/856756468.db2.gz FATPHCFEQCKFQC-QZTJIDSGSA-N 0 3 413.587 4.162 20 0 HIADHN COc1ccc(CCC(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)cc1Cl ZINC000427292513 856756519 /nfs/dbraw/zinc/75/65/19/856756519.db2.gz QWCQDQHLNMQVAD-QZTJIDSGSA-N 0 3 422.997 4.019 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3cc4cc(F)ccc4s3)CC2)C[C@H](C)O1 ZINC000427297217 856757237 /nfs/dbraw/zinc/75/72/37/856757237.db2.gz SBOCJSSZCBHAAQ-IYBDPMFKSA-N 0 3 404.551 4.392 20 0 HIADHN Cc1ccc(SCCC(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)cc1 ZINC000427300196 856759788 /nfs/dbraw/zinc/75/97/88/856759788.db2.gz SDANZFDCWSTYMD-BGYRXZFFSA-N 0 3 404.620 4.215 20 0 HIADHN Cc1ccc(C(=O)CCC(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)cc1C ZINC000427303903 856761092 /nfs/dbraw/zinc/76/10/92/856761092.db2.gz FHKVPKLBGGWTCW-OYRHEFFESA-N 0 3 414.590 4.004 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3[nH]c4ccc(F)cc4c3Cl)CC2)C[C@@H](C)O1 ZINC000427311921 856764123 /nfs/dbraw/zinc/76/41/23/856764123.db2.gz GAZJZSWQAVNFTM-HUUCEWRRSA-N 0 3 421.944 4.312 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Cc3c[nH]c4cc(Cl)ccc34)CC2)C[C@@H](C)O1 ZINC000427320955 856770289 /nfs/dbraw/zinc/77/02/89/856770289.db2.gz NVTJDWIPFBGKJG-IAGOWNOFSA-N 0 3 417.981 4.102 20 0 HIADHN C[C@H](CSc1ccccc1)C(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000427357186 856790750 /nfs/dbraw/zinc/79/07/50/856790750.db2.gz LRXKNEALRYSXQH-VAMGGRTRSA-N 0 3 404.620 4.153 20 0 HIADHN COc1ccccc1CC(C)(C)C(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000427359123 856792199 /nfs/dbraw/zinc/79/21/99/856792199.db2.gz TZLQGPDMOQXGBG-BGYRXZFFSA-N 0 3 416.606 4.002 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)c1cnc(Cc2ccccc2)s1 ZINC000427372963 856800207 /nfs/dbraw/zinc/80/02/07/856800207.db2.gz SWMDVDATFVGVLD-UHFFFAOYSA-N 0 3 415.509 4.216 20 0 HIADHN C[C@@H]1CCN(C(=O)CCCc2nc(-c3cccs3)no2)CCN1Cc1ccccc1 ZINC000437486473 862843634 /nfs/dbraw/zinc/84/36/34/862843634.db2.gz VUFNOUVEDWJJLF-GOSISDBHSA-N 0 3 424.570 4.244 20 0 HIADHN COc1cccc(N2CC[C@@H](CN[C@@H](C)c3ncc(Br)cc3F)C2)c1 ZINC000427694059 856911321 /nfs/dbraw/zinc/91/13/21/856911321.db2.gz IHIOMGNHQLDLCN-KBPBESRZSA-N 0 3 408.315 4.169 20 0 HIADHN Cc1cc2c(cc1C)[C@@H](NCc1ccc(N3CCCS3(=O)=O)c(F)c1)CCS2 ZINC000427841905 856977350 /nfs/dbraw/zinc/97/73/50/856977350.db2.gz JETUGWBJLZNASX-IBGZPJMESA-N 0 3 420.575 4.309 20 0 HIADHN C[C@@H](Cn1cc(Br)ccc1=O)N[C@H]1CCSc2ccc(Cl)cc21 ZINC000428249878 857126435 /nfs/dbraw/zinc/12/64/35/857126435.db2.gz YRPZXBQAEMAIAJ-NHYWBVRUSA-N 0 3 413.768 4.479 20 0 HIADHN O=C(CCN1CCS[C@H]2CCCC[C@H]21)Nc1ccc(Br)cc1F ZINC000437541435 862875394 /nfs/dbraw/zinc/87/53/94/862875394.db2.gz XATCOCATOWGGGO-CVEARBPZSA-N 0 3 401.345 4.277 20 0 HIADHN O=C(N1CCOc2ccc(F)cc2C1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000428442101 857205326 /nfs/dbraw/zinc/20/53/26/857205326.db2.gz ZHONATZGFLIYHN-OAQYLSRUSA-N 0 3 422.422 4.001 20 0 HIADHN COc1cc(CN2CC[C@H](O)[C@@H](C)C2)ccc1OCc1cccc(C(F)(F)F)c1 ZINC000428466507 857210892 /nfs/dbraw/zinc/21/08/92/857210892.db2.gz WYNCIVBCBYFNPN-KXBFYZLASA-N 0 3 409.448 4.496 20 0 HIADHN COc1cc(CN2CC[C@H](O)[C@H](C)C2)ccc1OCc1cccc(C(F)(F)F)c1 ZINC000428466495 857211411 /nfs/dbraw/zinc/21/14/11/857211411.db2.gz WYNCIVBCBYFNPN-BEFAXECRSA-N 0 3 409.448 4.496 20 0 HIADHN C[C@@H]1CCC[C@@H](OCCCCCC(=O)Nc2cccc(CN3CC[C@@H](O)C3)c2)C1 ZINC000428533047 857245787 /nfs/dbraw/zinc/24/57/87/857245787.db2.gz IEIUFLFTIKJTMN-UEVCKROQSA-N 0 3 402.579 4.347 20 0 HIADHN C[C@@H]1CCC[C@@H](OCCCCCC(=O)Nc2cccc(CN3CC[C@H](O)C3)c2)C1 ZINC000428533048 857246130 /nfs/dbraw/zinc/24/61/30/857246130.db2.gz IEIUFLFTIKJTMN-WTIAFYNJSA-N 0 3 402.579 4.347 20 0 HIADHN CCCCOc1ccc(C(=O)Nc2cccc(CN3CC[C@@H](O)C3)c2)c(Cl)c1 ZINC000428538129 857251657 /nfs/dbraw/zinc/25/16/57/857251657.db2.gz PPOSAEBAZVHODP-GOSISDBHSA-N 0 3 402.922 4.338 20 0 HIADHN COc1ccc2nc(CNC[C@@H](CO)Cc3ccc(Br)cc3)sc2c1 ZINC000428541532 857252340 /nfs/dbraw/zinc/25/23/40/857252340.db2.gz FBDDLTMGHOFMRL-AWEZNQCLSA-N 0 3 421.360 4.008 20 0 HIADHN CC(C)(C(=O)Nc1cccc(CN2CC[C@H](O)C2)c1)c1ccc(OC(F)(F)F)cc1 ZINC000428542501 857254376 /nfs/dbraw/zinc/25/43/76/857254376.db2.gz FYMLDZAHPDAGKN-SFHVURJKSA-N 0 3 422.447 4.068 20 0 HIADHN O=C(CCCc1ccc(Br)s1)Nc1cccc(CN2CC[C@@H](O)C2)c1 ZINC000428544434 857256830 /nfs/dbraw/zinc/25/68/30/857256830.db2.gz JQTNJVTVXAPDDS-MRXNPFEDSA-N 0 3 423.376 4.039 20 0 HIADHN CC(C)(Cc1ccc(C(F)(F)F)cc1)C(=O)Nc1cccc(CN2CC[C@H](O)C2)c1 ZINC000428554823 857263418 /nfs/dbraw/zinc/26/34/18/857263418.db2.gz UQVPMINUMTVYGX-FQEVSTJZSA-N 0 3 420.475 4.479 20 0 HIADHN Cc1csc(Nc2ccc(C(=O)Nc3cccc(CN4CC[C@H](O)C4)c3)cc2)n1 ZINC000428554496 857264313 /nfs/dbraw/zinc/26/43/13/857264313.db2.gz ZSFPQZHAZJDEHT-FQEVSTJZSA-N 0 3 408.527 4.014 20 0 HIADHN Cc1cc([C@@H](C)NC(=O)NC[C@H]2CN(Cc3ccccc3)CCCO2)c(C)s1 ZINC000428691027 857298255 /nfs/dbraw/zinc/29/82/55/857298255.db2.gz GQESOYFKULOIIV-XLIONFOSSA-N 0 3 401.576 4.016 20 0 HIADHN O=C(CN(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1)Nc1ccccc1 ZINC000428787495 857338726 /nfs/dbraw/zinc/33/87/26/857338726.db2.gz UNJKYYFTEFHYIZ-RUZDIDTESA-N 0 3 414.553 4.187 20 0 HIADHN c1c(CN(Cc2ccncc2)[C@@H]2CCCN(Cc3ccccc3)C2)nc2ccccn12 ZINC000428787579 857338830 /nfs/dbraw/zinc/33/88/30/857338830.db2.gz VBFNHEUYZYQBQY-RUZDIDTESA-N 0 3 411.553 4.396 20 0 HIADHN COc1ccnc(CN(Cc2ccncc2)[C@@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000428792818 857342845 /nfs/dbraw/zinc/34/28/45/857342845.db2.gz IJFPSJZAYREMMK-XMMPIXPASA-N 0 3 402.542 4.152 20 0 HIADHN COc1ncccc1CN(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000428813583 857357085 /nfs/dbraw/zinc/35/70/85/857357085.db2.gz QAUNGDUJROMXGU-DEOSSOPVSA-N 0 3 402.542 4.152 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)NCc3cc4ccccc4s3)CC2)C[C@H](C)O1 ZINC000428827614 857362951 /nfs/dbraw/zinc/36/29/51/857362951.db2.gz NOFUVJXINBGCDA-ROUUACIJSA-N 0 3 415.603 4.322 20 0 HIADHN CCOc1cccc([C@H](C)NC(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)c1 ZINC000428834583 857365327 /nfs/dbraw/zinc/36/53/27/857365327.db2.gz NKEUKCIEJWJCKA-ZCNNSNEGSA-N 0 3 417.594 4.067 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3ccc(C(=O)C(C)(C)C)cc3)CC2)C[C@H](C)O1 ZINC000428878586 857384455 /nfs/dbraw/zinc/38/44/55/857384455.db2.gz AKGYGBUQKWRMJH-HDICACEKSA-N 0 3 415.578 4.269 20 0 HIADHN CCCCCn1nc(C)cc1NC(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000428891358 857394739 /nfs/dbraw/zinc/39/47/39/857394739.db2.gz XNXKDYNVFGDXQS-BGYRXZFFSA-N 0 3 419.614 4.125 20 0 HIADHN CCCOc1ccc(C(F)(F)F)cc1NC(=O)N(CCN(C)C)C[C@@H]1CCCO1 ZINC000437594681 862908435 /nfs/dbraw/zinc/90/84/35/862908435.db2.gz WTXQHVDBWJIQAX-INIZCTEOSA-N 0 3 417.472 4.069 20 0 HIADHN CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)C(=O)c1sccc1-c1ccccc1 ZINC000428968229 857438710 /nfs/dbraw/zinc/43/87/10/857438710.db2.gz OJRYNRDQBMSPJC-DEOSSOPVSA-N 0 3 406.551 4.124 20 0 HIADHN C[C@H](c1cc2ccccc2o1)N(C)C(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000429013013 857455736 /nfs/dbraw/zinc/45/57/36/857455736.db2.gz VRZLQDNVCAQKOH-KNQAVFIVSA-N 0 3 421.541 4.426 20 0 HIADHN C[C@H](c1cc2ccccc2o1)N(C)C(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000429013012 857456437 /nfs/dbraw/zinc/45/64/37/857456437.db2.gz VRZLQDNVCAQKOH-DENIHFKCSA-N 0 3 421.541 4.426 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N1CCC(c2ncccc2Cl)CC1 ZINC000429013231 857458081 /nfs/dbraw/zinc/45/80/81/857458081.db2.gz WIILPWKAXSMCPU-UTKZUKDTSA-N 0 3 412.965 4.145 20 0 HIADHN CCCOc1ccccc1NC(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000429054402 857480440 /nfs/dbraw/zinc/48/04/40/857480440.db2.gz PMKXKXWZPXHOIQ-KDURUIRLSA-N 0 3 403.567 4.219 20 0 HIADHN CC(C)COc1cccc(NC(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)c1 ZINC000429094148 857506528 /nfs/dbraw/zinc/50/65/28/857506528.db2.gz CSZWZPCEROASTQ-WOJBJXKFSA-N 0 3 417.594 4.465 20 0 HIADHN CCN(Cc1ccccc1)C(=O)c1cc(NC(=O)N(C)CCN(C)C)ccc1Cl ZINC000429104241 857510668 /nfs/dbraw/zinc/51/06/68/857510668.db2.gz FCBUSCRYPGKLJI-UHFFFAOYSA-N 0 3 416.953 4.028 20 0 HIADHN CC(C)Oc1ccccc1NC(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000429106768 857512592 /nfs/dbraw/zinc/51/25/92/857512592.db2.gz MVKRLSRPQGUIJT-RTBURBONSA-N 0 3 403.567 4.217 20 0 HIADHN C[C@H](NC(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1)c1cc2ccccc2o1 ZINC000429188362 857546827 /nfs/dbraw/zinc/54/68/27/857546827.db2.gz MQGSNZLJQWATGB-OTWHNJEPSA-N 0 3 413.562 4.415 20 0 HIADHN CCCn1ccnc1CCCN(C)Cc1nc2sc3c(c2c(N)n1)CC[C@@H](C)C3 ZINC000429231985 857565350 /nfs/dbraw/zinc/56/53/50/857565350.db2.gz JBACIZQFFOBZIN-OAHLLOKOSA-N 0 3 412.607 4.069 20 0 HIADHN CCCn1ccnc1CCCN(C)Cc1nnc(-c2c(C)onc2-c2ccccc2)o1 ZINC000429230021 857565596 /nfs/dbraw/zinc/56/55/96/857565596.db2.gz VLMGBCBQPYJJFG-UHFFFAOYSA-N 0 3 420.517 4.371 20 0 HIADHN CCCn1ccnc1CCCN(C)[C@@H](C)C(=O)Nc1ccc(C)cc1Br ZINC000429237168 857567534 /nfs/dbraw/zinc/56/75/34/857567534.db2.gz KGIOEXDDWRLJOY-INIZCTEOSA-N 0 3 421.383 4.256 20 0 HIADHN CCO[C@H]1C[C@H](NCC(=O)Nc2c(F)cc(F)cc2Br)C1(CC)CC ZINC000429329636 857604766 /nfs/dbraw/zinc/60/47/66/857604766.db2.gz AYYZGRDWIWKDEQ-GJZGRUSLSA-N 0 3 419.310 4.239 20 0 HIADHN CC(C)C[C@@H]1CN(CCCc2ccccc2)CCN1CC(=O)NCc1cccs1 ZINC000429384155 857634794 /nfs/dbraw/zinc/63/47/94/857634794.db2.gz FJCQTIPFWLDJES-JOCHJYFZSA-N 0 3 413.631 4.029 20 0 HIADHN Cc1ccc(S(=O)(=O)c2ccc(CN3CCN(C4CCC4)C[C@@H](C)C3)cc2)cc1 ZINC000429395541 857640196 /nfs/dbraw/zinc/64/01/96/857640196.db2.gz UASYVDODRRQMSZ-FQEVSTJZSA-N 0 3 412.599 4.134 20 0 HIADHN COc1ccc([C@H](NC2CCN(c3cccnn3)CC2)c2ccccc2Cl)cc1 ZINC000429434479 857666159 /nfs/dbraw/zinc/66/61/59/857666159.db2.gz SBNOJBXPTFBXSD-QHCPKHFHSA-N 0 3 408.933 4.487 20 0 HIADHN Fc1ccc([C@H](NC[C@@H]2CN(Cc3ccccc3)CCCO2)c2cccnc2)cc1 ZINC000429445267 857673276 /nfs/dbraw/zinc/67/32/76/857673276.db2.gz FSBBLZKZQLRXJE-RPBOFIJWSA-N 0 3 405.517 4.191 20 0 HIADHN CC(C)(C)[C@H](CN1CCc2ccccc2C1)NC(=O)N1CCC[C@H]1c1cccnc1 ZINC000429495325 857696982 /nfs/dbraw/zinc/69/69/82/857696982.db2.gz VGLBGYOQKSEBKF-GOTSBHOMSA-N 0 3 406.574 4.401 20 0 HIADHN Cc1nc(CN(C)C(=O)N[C@H](CN2CCc3ccccc3C2)C(C)(C)C)cs1 ZINC000429496945 857698346 /nfs/dbraw/zinc/69/83/46/857698346.db2.gz WQEUIRVHJWIPSM-HXUWFJFHSA-N 0 3 400.592 4.066 20 0 HIADHN CC(C)(C)[C@H](CN1CCc2ccccc2C1)NC(=O)N1CCCC[C@@H]1c1ncc[nH]1 ZINC000429499678 857699219 /nfs/dbraw/zinc/69/92/19/857699219.db2.gz UHOOMLRFOXRCJZ-RTWAWAEBSA-N 0 3 409.578 4.119 20 0 HIADHN CN1CCN(c2cc(CN[C@@H](Cc3ccccc3F)c3ccccc3)ccn2)CC1 ZINC000429518205 857713035 /nfs/dbraw/zinc/71/30/35/857713035.db2.gz IEEFXSDIWGDYQO-DEOSSOPVSA-N 0 3 404.533 4.046 20 0 HIADHN O=C(Nc1ccnn1Cc1ccc(C(F)(F)F)cc1)N1CCN(C2CCCC2)CC1 ZINC000429522747 857715713 /nfs/dbraw/zinc/71/57/13/857715713.db2.gz UXUCTIXLEJYQSZ-UHFFFAOYSA-N 0 3 421.467 4.042 20 0 HIADHN Cc1noc(C[C@H](NCCOc2cccc(Br)c2)c2ccccc2)n1 ZINC000429544060 857735053 /nfs/dbraw/zinc/73/50/53/857735053.db2.gz ZZISOVMVHJHYER-SFHVURJKSA-N 0 3 402.292 4.093 20 0 HIADHN C[C@@H](C1CC1)n1cc(NC(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)cn1 ZINC000429637582 857812735 /nfs/dbraw/zinc/81/27/35/857812735.db2.gz SHTDOGZYBUSDMO-HNNXBMFYSA-N 0 3 423.483 4.469 20 0 HIADHN COc1ccc([C@H](NC[C@@H]2CN(Cc3ccccc3)CCCO2)C(F)(F)F)cc1 ZINC000429684818 857833524 /nfs/dbraw/zinc/83/35/24/857833524.db2.gz LEDHCKFWHPEZSG-RTWAWAEBSA-N 0 3 408.464 4.179 20 0 HIADHN CC[C@@H](NC[C@@H]1CN(Cc2ccccc2)CCCO1)c1nc(C(F)(F)F)cs1 ZINC000429683068 857833543 /nfs/dbraw/zinc/83/35/43/857833543.db2.gz PLOJAGZZYGGJAB-IAGOWNOFSA-N 0 3 413.509 4.494 20 0 HIADHN O=C(c1ccc(F)cc1)[C@H]1CCCN(C[C@H]2CN(Cc3ccccc3)CCCO2)C1 ZINC000429683748 857833554 /nfs/dbraw/zinc/83/35/54/857833554.db2.gz RFYKEWCMFPYOJA-LADGPHEKSA-N 0 3 410.533 4.012 20 0 HIADHN CSCCc1ccc(NC(=O)NC[C@@H]2CN(Cc3ccccc3)CCCO2)cc1 ZINC000429741749 857863777 /nfs/dbraw/zinc/86/37/77/857863777.db2.gz FQFNSQOFCDHEIL-JOCHJYFZSA-N 0 3 413.587 4.005 20 0 HIADHN CC(C)N1CC[C@@H](N[C@@H](C)C(=O)NCc2cccs2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000429777636 857881999 /nfs/dbraw/zinc/88/19/99/857881999.db2.gz WGIMKSWCYSQKRD-VHKYSDTDSA-N 0 3 423.985 4.359 20 0 HIADHN CC(C)N1CC[C@@H](NCC(=O)Nc2ccccc2F)[C@H]1c1ccc(Cl)c(F)c1 ZINC000429793782 857887367 /nfs/dbraw/zinc/88/73/67/857887367.db2.gz WHCWBGCWKVRUKV-TZIWHRDSSA-N 0 3 407.892 4.370 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Cc1c(C)nn(CC)c1C)c1ccc(C(F)(F)F)cc1 ZINC000429891312 857930807 /nfs/dbraw/zinc/93/08/07/857930807.db2.gz ZPFIPWAIIAKDKV-FQEVSTJZSA-N 0 3 424.511 4.280 20 0 HIADHN CN(CCSc1nnc(CN2CCCC2)n1Cc1ccccc1)Cc1ccccc1 ZINC000430094611 858029635 /nfs/dbraw/zinc/02/96/35/858029635.db2.gz MVLJAEFSFVSTCP-UHFFFAOYSA-N 0 3 421.614 4.146 20 0 HIADHN CCn1c(SC[C@@H]2CN(Cc3ccccc3)CCCO2)nnc1-c1cccs1 ZINC000430124965 858043033 /nfs/dbraw/zinc/04/30/33/858043033.db2.gz SVRFEHJDZPPVCR-SFHVURJKSA-N 0 3 414.600 4.410 20 0 HIADHN c1c(CN2CCOC[C@H](C3CCC3)C2)c(-c2cccnc2)nn1Cc1ccccc1 ZINC000430129536 858045199 /nfs/dbraw/zinc/04/51/99/858045199.db2.gz ZWYIYAJTQGWKKE-XMMPIXPASA-N 0 3 402.542 4.242 20 0 HIADHN Cc1cc(CNC(=O)N(CCN(C)C)Cc2ccccn2)ccc1-c1ccccc1 ZINC000430178200 858067528 /nfs/dbraw/zinc/06/75/28/858067528.db2.gz OAWPKPBDBVDRNU-UHFFFAOYSA-N 0 3 402.542 4.330 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)N[C@H]2C[C@@H]2c2ccccc2OC(F)F)C1 ZINC000437648572 862981680 /nfs/dbraw/zinc/98/16/80/862981680.db2.gz VPBLOTLDNPAJEN-UUXHPUJUSA-N 0 3 415.484 4.279 20 0 HIADHN CC[C@H]1CCN1Cc1ccc(OCC(=O)Nc2ccc(Cl)cc2OC)c(OC)c1 ZINC000430205842 858081599 /nfs/dbraw/zinc/08/15/99/858081599.db2.gz NPTISSFYWFBTMW-KRWDZBQOSA-N 0 3 418.921 4.359 20 0 HIADHN COc1ccc(CC[C@@H]2CCCCN2Cc2cnnn2Cc2ccccc2)cc1OC ZINC000430232147 858091326 /nfs/dbraw/zinc/09/13/26/858091326.db2.gz FHAGPOMVSUIUKD-QFIPXVFZSA-N 0 3 420.557 4.331 20 0 HIADHN COc1ccccc1-c1ncc(CN2CCN(Cc3ccccc3)C(C)(C)C2)cn1 ZINC000430245032 858094706 /nfs/dbraw/zinc/09/47/06/858094706.db2.gz ZQOHWIRLSBMFEN-UHFFFAOYSA-N 0 3 402.542 4.249 20 0 HIADHN CNC(=O)[C@@]1(C)CCN([C@@H](C)c2nc3cc(Cl)ccc3n2Cc2ccccc2)C1 ZINC000430251036 858096781 /nfs/dbraw/zinc/09/67/81/858096781.db2.gz BVUWZIDSNAPBPR-HJPURHCSSA-N 0 3 410.949 4.257 20 0 HIADHN C[C@@H]1C[C@]2(CCO1)CN(CCC(=O)Nc1ccccc1-c1ccccc1)C[C@H](C)O2 ZINC000430278484 858106387 /nfs/dbraw/zinc/10/63/87/858106387.db2.gz QDQRXESXMACRHG-OHUGHZGNSA-N 0 3 408.542 4.341 20 0 HIADHN CCC[C@H](NC(=O)[C@H](C)N1CC[C@@H](C(=O)N(C)c2ccccc2)C1)c1ccccc1 ZINC000430290349 858109512 /nfs/dbraw/zinc/10/95/12/858109512.db2.gz CCMQRJVIRZWZKX-WPYKKVEZSA-N 0 3 407.558 4.017 20 0 HIADHN CN(C(=O)[C@@H]1CCN(Cc2ccc(OCc3ccccc3F)nc2)C1)c1ccccc1 ZINC000430294674 858111615 /nfs/dbraw/zinc/11/16/15/858111615.db2.gz BIUXJRNLEYWGDI-HXUWFJFHSA-N 0 3 419.500 4.285 20 0 HIADHN Brc1cccc(OCCN(CCc2ccccn2)Cc2cccnc2)c1 ZINC000430335061 858125108 /nfs/dbraw/zinc/12/51/08/858125108.db2.gz ARHNVNCVBFNMTK-UHFFFAOYSA-N 0 3 412.331 4.363 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2ccc(OC(C)(C)C)cc2)cc1)[C@H]1CCCN(C)C1 ZINC000430596363 858231315 /nfs/dbraw/zinc/23/13/15/858231315.db2.gz WKNPGWGKGWOEHX-NRFANRHFSA-N 0 3 423.557 4.282 20 0 HIADHN C[C@H](N[C@@H]1c2ccccc2CC[C@@H]1C)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000430694101 858271368 /nfs/dbraw/zinc/27/13/68/858271368.db2.gz IYWIXECIIYCMSX-JMERFSKESA-N 0 3 423.376 4.071 20 0 HIADHN Cc1cccc([C@H](C)N[C@@H](C)c2ccc(Br)c(S(N)(=O)=O)c2)c1C ZINC000430719955 858277856 /nfs/dbraw/zinc/27/78/56/858277856.db2.gz LIVLBEYBFMUSQC-KBPBESRZSA-N 0 3 411.365 4.125 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](NC[C@@H]2CCC(F)(F)C2)c2ccc(F)c(F)c2)c1 ZINC000430739836 858282823 /nfs/dbraw/zinc/28/28/23/858282823.db2.gz FLGLLIPBAPTGES-BFUOFWGJSA-N 0 3 415.452 4.483 20 0 HIADHN COc1ccccc1-n1nccc1CNc1cc(CN2CCSCC2)ccc1C ZINC000430759211 858292380 /nfs/dbraw/zinc/29/23/80/858292380.db2.gz FGFCKCYJXSUAMB-UHFFFAOYSA-N 0 3 408.571 4.350 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)c1cccc(C(F)(F)F)c1F ZINC000430761218 858293264 /nfs/dbraw/zinc/29/32/64/858293264.db2.gz ULIJAXHETFGPQR-UHFFFAOYSA-N 0 3 423.454 4.177 20 0 HIADHN O=C1N[C@H](C[C@@H]2CCCc3ccccc32)C(=O)N1C[C@@H](c1cccs1)N1CCCC1 ZINC000430979104 858389740 /nfs/dbraw/zinc/38/97/40/858389740.db2.gz TUNRGQJEQZZXKN-TYPHKJRUSA-N 0 3 423.582 4.316 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)NCC3CC[NH+](CCC(C)C)CC3)cc2)cc(=O)[n-]1 ZINC000431076740 858437203 /nfs/dbraw/zinc/43/72/03/858437203.db2.gz LYRIEIYFTTVLMQ-UHFFFAOYSA-N 0 3 411.550 4.037 20 0 HIADHN CC[NH+](CC)C[C@H]1CCCC[C@@H]1NC(=O)Nc1ccc(-c2cc(=O)[n-]c(C)n2)cc1 ZINC000431078531 858437247 /nfs/dbraw/zinc/43/72/47/858437247.db2.gz UKDMIMYXOSQFHI-QUCCMNQESA-N 0 3 411.550 4.180 20 0 HIADHN CCc1noc(-c2ccc(C)c(NC(=O)N[C@H]3CCN(Cc4ccccc4)C3)c2)n1 ZINC000431129576 858459379 /nfs/dbraw/zinc/45/93/79/858459379.db2.gz VDTIISXAWWOIQX-IBGZPJMESA-N 0 3 405.502 4.003 20 0 HIADHN COCCCOc1cccc(NC(=O)NC[C@H](c2cccs2)N2CCCC2)c1 ZINC000431134911 858463097 /nfs/dbraw/zinc/46/30/97/858463097.db2.gz ZAXLEKNOAYUGKE-LJQANCHMSA-N 0 3 403.548 4.122 20 0 HIADHN COc1ccc([C@@H](CNC(=O)NCCC2CC(OC(C)(C)C)C2)N2CCCC2)cc1 ZINC000431205344 858501726 /nfs/dbraw/zinc/50/17/26/858501726.db2.gz ACHCMKWBQVNADP-FQUBMZHMSA-N 0 3 417.594 4.115 20 0 HIADHN Cc1cc(Cl)cc2c1OCCC[C@H]2NCc1ccc(CN2CCOCC2)cc1 ZINC000431349205 858574290 /nfs/dbraw/zinc/57/42/90/858574290.db2.gz KWTOLBNSCURMIA-JOCHJYFZSA-N 0 3 400.950 4.484 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)c2c(Cl)cc(F)cc2Cl)CC1 ZINC000431481806 858638001 /nfs/dbraw/zinc/63/80/01/858638001.db2.gz IEJZUGJMDSCAJX-UHFFFAOYSA-N 0 3 424.347 4.200 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2cccc(-c3noc(C(F)(F)F)n3)c2)N(C)C)cc1 ZINC000431777115 858806930 /nfs/dbraw/zinc/80/69/30/858806930.db2.gz WUIDQNVXTBBHFN-KRWDZBQOSA-N 0 3 418.419 4.097 20 0 HIADHN CCC(CC)n1nccc1C(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1 ZINC000431814393 858824694 /nfs/dbraw/zinc/82/46/94/858824694.db2.gz YCGWMASZTNHBCQ-UHFFFAOYSA-N 0 3 410.484 4.467 20 0 HIADHN COc1ccc2c(c1)[C@H](C(=O)Nc1ccnn1[C@@H]1CCN(Cc3ccccc3)C1)CC2 ZINC000431924848 858872839 /nfs/dbraw/zinc/87/28/39/858872839.db2.gz LRUWQNSUTVHLKD-IFMALSPDSA-N 0 3 416.525 4.007 20 0 HIADHN CN(C)C(=O)COc1ccccc1CN1CCC(F)(c2ccc(Cl)cc2)CC1 ZINC000467544849 881366252 /nfs/dbraw/zinc/36/62/52/881366252.db2.gz XXYNHLSMSUQCGM-UHFFFAOYSA-N 0 3 404.913 4.268 20 0 HIADHN Cc1cc(NC(=O)Nc2cn(C)nc2C(C)C)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000432277516 859082340 /nfs/dbraw/zinc/08/23/40/859082340.db2.gz QRTFZHSHOQKITP-LJQANCHMSA-N 0 3 421.549 4.139 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N1CCO[C@@H](c2cccc(Cl)c2)C1 ZINC000467561517 881385156 /nfs/dbraw/zinc/38/51/56/881385156.db2.gz CNMNZEGWZYXSTJ-RTBURBONSA-N 0 3 419.978 4.322 20 0 HIADHN O=C(NCC[C@@H](c1ccccc1)C(F)(F)F)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000432470916 859180065 /nfs/dbraw/zinc/18/00/65/859180065.db2.gz VVHXHGZNGFBGQT-PMACEKPBSA-N 0 3 405.464 4.296 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(F)cc2)CC1)C1(Cc2ccccc2)CCC1 ZINC000467576563 881394368 /nfs/dbraw/zinc/39/43/68/881394368.db2.gz JFOXQEQMCFNFQN-UHFFFAOYSA-N 0 3 410.533 4.198 20 0 HIADHN CC[C@H](CNC(=O)C1(Cc2cccc(F)c2)CCOCC1)N1CCc2ccccc2C1 ZINC000432501773 859196434 /nfs/dbraw/zinc/19/64/34/859196434.db2.gz MZRILSYHASFSIT-XMMPIXPASA-N 0 3 424.560 4.118 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(F)cc2)CC1)c1cncc(-c2ccccc2)c1 ZINC000467580944 881395853 /nfs/dbraw/zinc/39/58/53/881395853.db2.gz XHKWIXKBFMAJKM-UHFFFAOYSA-N 0 3 419.500 4.161 20 0 HIADHN Brc1ccccc1-c1noc([C@H]2CCCN2CCC2CCOCC2)n1 ZINC000432790654 859360748 /nfs/dbraw/zinc/36/07/48/859360748.db2.gz DBHYQVQGNMYOMG-QGZVFWFLSA-N 0 3 406.324 4.453 20 0 HIADHN Cc1ccc(CNC(=O)c2cccc(CN3CCCC3)c2)c(OC[C@@H]2CCCO2)c1 ZINC000467626300 881427247 /nfs/dbraw/zinc/42/72/47/881427247.db2.gz XCTCBCQMSAOHHT-QHCPKHFHSA-N 0 3 408.542 4.079 20 0 HIADHN CN(CCSCC(=O)N1N=C(c2ccco2)C[C@@H]1c1ccco1)Cc1ccccc1 ZINC000433041063 859495454 /nfs/dbraw/zinc/49/54/54/859495454.db2.gz VEQUGTFHLUVIAT-HXUWFJFHSA-N 0 3 423.538 4.416 20 0 HIADHN COCCN(Cc1ccnc(-c2ccc(Br)cc2)n1)[C@@H]1CCCSC1 ZINC000433177695 859556743 /nfs/dbraw/zinc/55/67/43/859556743.db2.gz DQQLHJOYLBXMAV-GOSISDBHSA-N 0 3 422.392 4.250 20 0 HIADHN CCN1CC[C@H](N[C@@H](C)c2cc(C(=O)OC)c(C)o2)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000433206555 859565850 /nfs/dbraw/zinc/56/58/50/859565850.db2.gz OBCLZNOZNOWFJE-PJFOTGOESA-N 0 3 410.436 4.278 20 0 HIADHN CN(C)Cc1ccccc1C(=O)NC[C@@H](c1c(F)cccc1Cl)N1CCCC1 ZINC000433225269 859576702 /nfs/dbraw/zinc/57/67/02/859576702.db2.gz GZGNWVCYEBWOGU-FQEVSTJZSA-N 0 3 403.929 4.108 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Cc2cscc2Br)N2CCCC2)cc1 ZINC000433241498 859586645 /nfs/dbraw/zinc/58/66/45/859586645.db2.gz BXBIFHXJBCVVDR-GOSISDBHSA-N 0 3 407.377 4.315 20 0 HIADHN C[C@@H]1CN([C@@H](CNCc2ccc(-c3cc[nH]n3)o2)c2c(F)cccc2Cl)CCO1 ZINC000433328400 859644951 /nfs/dbraw/zinc/64/49/51/859644951.db2.gz RYGRMEMAMMHMLN-KUHUBIRLSA-N 0 3 418.900 4.014 20 0 HIADHN CN(C)Cc1ccccc1C(=O)NCc1cc(Br)ccc1OC(F)F ZINC000433358676 859658031 /nfs/dbraw/zinc/65/80/31/859658031.db2.gz CUHDOQFQDCUECJ-UHFFFAOYSA-N 0 3 413.262 4.042 20 0 HIADHN C[C@H](NCc1ccc(NC(N)=O)cc1)c1ccc(OC[C@H]2CCCCO2)c(F)c1 ZINC000433395543 859674252 /nfs/dbraw/zinc/67/42/52/859674252.db2.gz ABWDDLDSCDCIAW-HNAYVOBHSA-N 0 3 401.482 4.115 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N2CC3(CCCC3)c3cccc(F)c32)CC1 ZINC000433420082 859690022 /nfs/dbraw/zinc/69/00/22/859690022.db2.gz IPVWAXDYWNVPBZ-UHFFFAOYSA-N 0 3 403.542 4.057 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)c2ccc(-c3nc(C4CC4)no3)cc2)C1 ZINC000433421128 859691355 /nfs/dbraw/zinc/69/13/55/859691355.db2.gz NLYSZUHGYHSFAO-KKSFZXQISA-N 0 3 402.498 4.179 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)NCCC1CC(OC(C)(C)C)C1 ZINC000433483051 859724939 /nfs/dbraw/zinc/72/49/39/859724939.db2.gz ISJRSVOABLCHNB-UHFFFAOYSA-N 0 3 411.537 4.022 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3c4c(ccc3Cl)OCC4)CC2)C[C@@H](C)O1 ZINC000433508448 859742662 /nfs/dbraw/zinc/74/26/62/859742662.db2.gz GEQVBWDKFKLKHC-HZPDHXFCSA-N 0 3 421.969 4.018 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)N[C@@H](c1cc(F)ccc1F)C(F)F ZINC000433611787 859808931 /nfs/dbraw/zinc/80/89/31/859808931.db2.gz FHWACMDUXWVVLL-SFHVURJKSA-N 0 3 415.406 4.184 20 0 HIADHN CN(C(=O)N[C@@H](c1cc(F)ccc1F)C(F)F)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000433657116 859826517 /nfs/dbraw/zinc/82/65/17/859826517.db2.gz UDAZOKUNNDDDHM-APWZRJJASA-N 0 3 409.427 4.187 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)Cc2cc(F)ccc2Br)C1 ZINC000433717873 859851654 /nfs/dbraw/zinc/85/16/54/859851654.db2.gz JYRBGEQOSLPVTA-KDOFPFPSSA-N 0 3 405.311 4.082 20 0 HIADHN CCNC(=O)Nc1cccc(NC(=O)N[C@H](CN2CCCC2)c2ccccc2)c1C ZINC000433724278 859854644 /nfs/dbraw/zinc/85/46/44/859854644.db2.gz MVNBZKFSXUYGAQ-OAQYLSRUSA-N 0 3 409.534 4.095 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1ccc(F)cc1-c1cnn(C)c1)c1ccsc1 ZINC000433791806 859895200 /nfs/dbraw/zinc/89/52/00/859895200.db2.gz KBMDZRDZIHACGJ-HXUWFJFHSA-N 0 3 415.538 4.492 20 0 HIADHN C[C@@H]1CCN(C(=O)Nc2ccc(F)cc2-c2cnn(C)c2)CCN1Cc1ccccc1 ZINC000433797978 859897365 /nfs/dbraw/zinc/89/73/65/859897365.db2.gz CJKVVUNNEDNJSV-GOSISDBHSA-N 0 3 421.520 4.355 20 0 HIADHN Cc1cc(NC(=O)c2noc3c2C[C@H](C)CC3)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000433862286 859939887 /nfs/dbraw/zinc/93/98/87/859939887.db2.gz KENCYXFUQCVHIP-VQIMIIECSA-N 0 3 419.529 4.004 20 0 HIADHN O=C(Cc1cc(Br)ccc1F)NC[C@H](c1cccs1)N1CCCC1 ZINC000433869637 859942850 /nfs/dbraw/zinc/94/28/50/859942850.db2.gz SVZNYBRWXBYVKC-MRXNPFEDSA-N 0 3 411.340 4.146 20 0 HIADHN CC(C)Oc1ccc2ccccc2c1CNS(=O)(=O)c1ccc(CN(C)C)cc1 ZINC000433884672 859950835 /nfs/dbraw/zinc/95/08/35/859950835.db2.gz VWRDSDDZDPIKOW-UHFFFAOYSA-N 0 3 412.555 4.167 20 0 HIADHN Cc1c(NC(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)noc1-c1ccccc1F ZINC000433921966 859973462 /nfs/dbraw/zinc/97/34/62/859973462.db2.gz KNKMHTXVAWOXBR-SJLPKXTDSA-N 0 3 408.477 4.746 20 0 HIADHN Cc1ccc(-c2nc(CC(=O)N[C@@H]3C[C@@H](C)N(Cc4ccccc4)C3)cs2)cc1 ZINC000467695370 881490405 /nfs/dbraw/zinc/49/04/05/881490405.db2.gz QXIJLWVIURGKPO-WIYYLYMNSA-N 0 3 405.567 4.440 20 0 HIADHN Cc1ccc(C(=O)N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)cc1NC(=O)NC(C)(C)C ZINC000467696676 881490679 /nfs/dbraw/zinc/49/06/79/881490679.db2.gz VYNAYGGJAYAZHJ-NQIIRXRSSA-N 0 3 422.573 4.308 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)c2ccc(OCc3ccncc3)cc2)CN1Cc1ccccc1 ZINC000467701060 881497545 /nfs/dbraw/zinc/49/75/45/881497545.db2.gz QKRDRRRIESAKEL-AUSIDOKSSA-N 0 3 401.510 4.053 20 0 HIADHN C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)CSc1ncnc2scc(-c3ccccc3)c21 ZINC000467713999 881511542 /nfs/dbraw/zinc/51/15/42/881511542.db2.gz KUJKNQJXZHCFJX-KDOFPFPSSA-N 0 3 424.595 4.049 20 0 HIADHN Cc1c(C(=O)N2CCN(C)CC[C@@H]2C)c2cc(Br)ccc2nc1C1CC1 ZINC000434268307 860242072 /nfs/dbraw/zinc/24/20/72/860242072.db2.gz ILJBJPAOFJYYIU-ZDUSSCGKSA-N 0 3 416.363 4.349 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)CCCc1csc(C)n1 ZINC000434314953 860275906 /nfs/dbraw/zinc/27/59/06/860275906.db2.gz ICHRRJHIGSWHBT-NRFANRHFSA-N 0 3 423.586 4.365 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)Cc1c(F)cccc1F ZINC000434318234 860278472 /nfs/dbraw/zinc/27/84/72/860278472.db2.gz SMMCJWJOZNPJGA-SFHVURJKSA-N 0 3 410.468 4.098 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)Cc1ccc(F)cc1F ZINC000434321979 860282237 /nfs/dbraw/zinc/28/22/37/860282237.db2.gz AOZTXNOJZOBTLO-FQEVSTJZSA-N 0 3 410.468 4.098 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)C23C[C@H]4C[C@@H](C2)CC(C(F)(F)F)(C4)C3)CC1 ZINC000434322684 860283447 /nfs/dbraw/zinc/28/34/47/860283447.db2.gz XALBPUGCZSBGJX-AGXSTUJCSA-N 0 3 416.528 4.141 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1ccc(OC(C)C)nc1 ZINC000434325178 860286278 /nfs/dbraw/zinc/28/62/78/860286278.db2.gz OWQBTRYNVVPRSG-NRFANRHFSA-N 0 3 419.529 4.073 20 0 HIADHN CCc1ccc(OCC(=O)Nc2c(C)cnn2[C@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000434328694 860290367 /nfs/dbraw/zinc/29/03/67/860290367.db2.gz VRXSSYIWKJBXOD-QFIPXVFZSA-N 0 3 418.541 4.218 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)COc1c(C)cccc1C ZINC000434330870 860293214 /nfs/dbraw/zinc/29/32/14/860293214.db2.gz SKXQQVXGSDHJDL-JOCHJYFZSA-N 0 3 418.541 4.273 20 0 HIADHN COc1ccc(C(=O)Nc2c(C)cnn2[C@@H]2CCN(Cc3ccccc3)C2)c(F)c1 ZINC000434331616 860294190 /nfs/dbraw/zinc/29/41/90/860294190.db2.gz CWMOHFKCRGTJDL-GOSISDBHSA-N 0 3 408.477 4.039 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)Cc1ccc(Cl)cc1 ZINC000434333094 860295555 /nfs/dbraw/zinc/29/55/55/860295555.db2.gz KZFUYXUWDMVCJR-NRFANRHFSA-N 0 3 408.933 4.473 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)CCO[C@H](C)CC(C)C ZINC000434335092 860297337 /nfs/dbraw/zinc/29/73/37/860297337.db2.gz UEZHYVCBNVJBPM-IRLDBZIGSA-N 0 3 412.578 4.418 20 0 HIADHN Cc1cc2sc(NC(=O)N3CCC(CN4C[C@H](C)O[C@@H](C)C4)CC3)nc2cc1F ZINC000434527631 860386956 /nfs/dbraw/zinc/38/69/56/860386956.db2.gz XVGOMVDSFMPIDX-GJZGRUSLSA-N 0 3 420.554 4.097 20 0 HIADHN COc1cc(C(C)=O)ccc1OC[C@H](O)CN(C)[C@H](c1ccc(F)cc1)C(C)C ZINC000434611779 860428489 /nfs/dbraw/zinc/42/84/89/860428489.db2.gz KUFIPCPUMFOROZ-OFNKIYASSA-N 0 3 403.494 4.106 20 0 HIADHN Cc1ccc(F)c(N2CCC[C@@H](N3CCC(c4ncc5n4CCCC5)CC3)C2=O)c1 ZINC000434689967 860462988 /nfs/dbraw/zinc/46/29/88/860462988.db2.gz YIOBLKZKWQKWLO-OAQYLSRUSA-N 0 3 410.537 4.042 20 0 HIADHN CC(=O)NC[C@H]1CCCN(Cc2ccc(OCc3c(F)cccc3Cl)cc2)C1 ZINC000434979479 860583902 /nfs/dbraw/zinc/58/39/02/860583902.db2.gz UACRUJKENZKAJR-GOSISDBHSA-N 0 3 404.913 4.406 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)c2ccc(NC(=O)N(C)C)cc2Cl)N(C)C)cc1 ZINC000435034188 860608276 /nfs/dbraw/zinc/60/82/76/860608276.db2.gz METMKVIVGCZBFL-HXUWFJFHSA-N 0 3 416.953 4.029 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CN1CCC(c2ncc3n2CCCC3)CC1 ZINC000435047070 860614134 /nfs/dbraw/zinc/61/41/34/860614134.db2.gz ARJRWOMOMNEXGX-UHFFFAOYSA-N 0 3 403.574 4.461 20 0 HIADHN CCCCN(CCC(=O)Nc1ccc(C(N)=O)c(Cl)c1)Cc1ccccc1F ZINC000435100851 860641942 /nfs/dbraw/zinc/64/19/42/860641942.db2.gz KPHOQVQQYIPJAV-UHFFFAOYSA-N 0 3 405.901 4.209 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3cnn(-c4ccccc4)c3C)c(C)c2)CC1 ZINC000435146081 860664151 /nfs/dbraw/zinc/66/41/51/860664151.db2.gz ITQZHVOWBRHOBO-UHFFFAOYSA-N 0 3 418.545 4.275 20 0 HIADHN CCc1cc(C)cc(CC)c1NC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1CO ZINC000435180131 860682020 /nfs/dbraw/zinc/68/20/20/860682020.db2.gz BWWLCDFUYOPMSY-XZOQPEGZSA-N 0 3 409.574 4.124 20 0 HIADHN Cc1cc(NC(=O)COc2ccccc2Cl)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435279914 860715202 /nfs/dbraw/zinc/71/52/02/860715202.db2.gz LSAXWYKLHWWNIU-LJQANCHMSA-N 0 3 424.932 4.309 20 0 HIADHN Cc1cc(NC(=O)Cc2cc(F)ccc2F)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435279105 860715458 /nfs/dbraw/zinc/71/54/58/860715458.db2.gz IMJSGVNDHZURMS-HXUWFJFHSA-N 0 3 410.468 4.098 20 0 HIADHN Cc1cc(NC(=O)c2ccnc3ccccc32)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435281300 860716283 /nfs/dbraw/zinc/71/62/83/860716283.db2.gz QIEBUQKNTKAULX-FQEVSTJZSA-N 0 3 411.509 4.439 20 0 HIADHN Cc1cc(NC(=O)CCO[C@H](C)CC(C)C)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435286756 860720441 /nfs/dbraw/zinc/72/04/41/860720441.db2.gz DNWBEWKVFBLECT-IFMALSPDSA-N 0 3 412.578 4.418 20 0 HIADHN COc1ccc(CCC(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000435290101 860720955 /nfs/dbraw/zinc/72/09/55/860720955.db2.gz PHMRMMSDEOCIJH-JOCHJYFZSA-N 0 3 418.541 4.218 20 0 HIADHN Cc1cc(NC(=O)Cc2cccc(Cl)c2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435289056 860721072 /nfs/dbraw/zinc/72/10/72/860721072.db2.gz LWYYGPOLMAPOCA-NRFANRHFSA-N 0 3 408.933 4.473 20 0 HIADHN Cc1cc(NC(=O)c2cnc(C)nc2C(C)C)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435291354 860722293 /nfs/dbraw/zinc/72/22/93/860722293.db2.gz OAFPMNZXAQSUGQ-HXUWFJFHSA-N 0 3 418.545 4.113 20 0 HIADHN COc1ccc(F)cc1C(=O)Nc1cc(C)nn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435296571 860724741 /nfs/dbraw/zinc/72/47/41/860724741.db2.gz FTEDEKOKNKIRBB-IBGZPJMESA-N 0 3 408.477 4.039 20 0 HIADHN Cc1cc(NC(=O)COc2cc(C)ccc2C)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435301917 860727646 /nfs/dbraw/zinc/72/76/46/860727646.db2.gz KNQZGQRSILHRSQ-JOCHJYFZSA-N 0 3 418.541 4.273 20 0 HIADHN Cc1cc(NC(=O)COc2cccc(Cl)c2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435303619 860728541 /nfs/dbraw/zinc/72/85/41/860728541.db2.gz ZPUVAEIVGGVTOJ-FQEVSTJZSA-N 0 3 424.932 4.309 20 0 HIADHN Cc1cc(NC(=O)[C@@H](C)Oc2cccc(C)c2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435303608 860728603 /nfs/dbraw/zinc/72/86/03/860728603.db2.gz ZNSWFQZAESEBCL-IRLDBZIGSA-N 0 3 418.541 4.353 20 0 HIADHN Cc1c(NC(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)cnn1-c1ccccc1F ZINC000435368235 860766021 /nfs/dbraw/zinc/76/60/21/860766021.db2.gz HDXPSGNJMSVJHM-UHFFFAOYSA-N 0 3 421.520 4.103 20 0 HIADHN O=C(CCCOCc1ccccc1)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435371383 860769680 /nfs/dbraw/zinc/76/96/80/860769680.db2.gz MORQPVYXSQCDQI-QHCPKHFHSA-N 0 3 418.541 4.266 20 0 HIADHN C[C@@H](C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(F)c(F)c1 ZINC000435372954 860770585 /nfs/dbraw/zinc/77/05/85/860770585.db2.gz CFGAFNRCZMKPCX-VQIMIIECSA-N 0 3 410.468 4.351 20 0 HIADHN C[C@@H](CCOc1ccccc1)C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435374247 860772643 /nfs/dbraw/zinc/77/26/43/860772643.db2.gz PMROWZPYDRRUCK-UNMCSNQZSA-N 0 3 418.541 4.374 20 0 HIADHN O=C(Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)c1cnc(-c2ccco2)s1 ZINC000435377152 860773705 /nfs/dbraw/zinc/77/37/05/860773705.db2.gz YMGFYAQJPFBQCP-KRWDZBQOSA-N 0 3 419.510 4.299 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)[C@@H]1SCCc2ccccc21 ZINC000435380348 860776990 /nfs/dbraw/zinc/77/69/90/860776990.db2.gz NTEKATOGOBPJND-NFBKMPQASA-N 0 3 418.566 4.299 20 0 HIADHN O=C(NC[C@@H]1CCCCN1Cc1cccc(Cl)c1)N1CCC(c2cnc[nH]2)CC1 ZINC000435501269 860824283 /nfs/dbraw/zinc/82/42/83/860824283.db2.gz OVTXETKLILPARV-FQEVSTJZSA-N 0 3 415.969 4.007 20 0 HIADHN Cc1cc(NC(=O)N(C)Cc2scnc2C)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435512232 860830530 /nfs/dbraw/zinc/83/05/30/860830530.db2.gz VNPLAOMJIPBDDY-LJQANCHMSA-N 0 3 424.574 4.067 20 0 HIADHN Cc1cc(NC(=O)N2Cc3ccccc3C2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435518336 860836122 /nfs/dbraw/zinc/83/61/22/860836122.db2.gz TVHNZSHBUWFYNK-QFIPXVFZSA-N 0 3 401.514 4.186 20 0 HIADHN Cc1cc(NC(=O)N2Cc3ccccc3C2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435518334 860836594 /nfs/dbraw/zinc/83/65/94/860836594.db2.gz TVHNZSHBUWFYNK-JOCHJYFZSA-N 0 3 401.514 4.186 20 0 HIADHN Cc1cc(NC(=O)N2CCc3sccc3C2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435520649 860837420 /nfs/dbraw/zinc/83/74/20/860837420.db2.gz SJLAGLSQXSATJV-FQEVSTJZSA-N 0 3 421.570 4.290 20 0 HIADHN Cc1cc(NC(=O)N[C@@H](C)c2cccc(O)c2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435525589 860842527 /nfs/dbraw/zinc/84/25/27/860842527.db2.gz FDQUNGHGYFWNHX-RXVVDRJESA-N 0 3 419.529 4.227 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)NCc1csc(CCc2ccccc2)n1 ZINC000435532149 860847061 /nfs/dbraw/zinc/84/70/61/860847061.db2.gz PNPFDHSPDDDJNY-UHFFFAOYSA-N 0 3 422.598 4.202 20 0 HIADHN Cc1cc(NC(=O)N2C[C@@H]3CCCC[C@H]3C2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435533044 860847963 /nfs/dbraw/zinc/84/79/63/860847963.db2.gz HBFPRVLXOKODNW-FKBYEOEOSA-N 0 3 407.562 4.292 20 0 HIADHN Cc1cc(NC(=O)Nc2cnn(CC(C)C)c2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435537367 860850940 /nfs/dbraw/zinc/85/09/40/860850940.db2.gz PGBJWFAREKVUET-OAQYLSRUSA-N 0 3 421.549 4.135 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N1CCC(OCC2CCCC2)CC1 ZINC000435577691 860893133 /nfs/dbraw/zinc/89/31/33/860893133.db2.gz KHKFFZOVPQGYND-HXUWFJFHSA-N 0 3 405.608 4.266 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N2CCC(OCC3CCCC3)CC2)N(C)C)cc1 ZINC000435585609 860898028 /nfs/dbraw/zinc/89/80/28/860898028.db2.gz VHROTCQTVLDMDJ-QHCPKHFHSA-N 0 3 401.595 4.233 20 0 HIADHN O=C(CCn1ccc2ccccc21)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435649730 860933882 /nfs/dbraw/zinc/93/38/82/860933882.db2.gz YTNYSDYNQMOSNG-JOCHJYFZSA-N 0 3 413.525 4.314 20 0 HIADHN C[C@@H]1[C@@H](C(=O)NC2CCN(CCOc3ccc(Cl)cc3)CC2)[C@@H]1c1ccccc1 ZINC000435706501 860988264 /nfs/dbraw/zinc/98/82/64/860988264.db2.gz ONKFLMQKTFYPED-PDIWNELESA-N 0 3 412.961 4.349 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)NC[C@@H]3CCC[N@@H+]3C3CCCCC3)cc2)cc(=O)[n-]1 ZINC000435730500 861013392 /nfs/dbraw/zinc/01/33/92/861013392.db2.gz HKQGKGFYFFKEAI-FQEVSTJZSA-N 0 3 409.534 4.076 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)NC[C@@H]3CCC[N@H+]3C3CCCCC3)cc2)cc(=O)[n-]1 ZINC000435730500 861013408 /nfs/dbraw/zinc/01/34/08/861013408.db2.gz HKQGKGFYFFKEAI-FQEVSTJZSA-N 0 3 409.534 4.076 20 0 HIADHN CCOc1cccc([C@@H]2C[C@H]2NC(=O)Nc2ccc(N3CCN(CC)CC3)cc2C)c1 ZINC000435733301 861014853 /nfs/dbraw/zinc/01/48/53/861014853.db2.gz UUTYKDIQKPMVQH-LADGPHEKSA-N 0 3 422.573 4.213 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N[C@@H]3C[C@H]3c3ccc(Cl)cc3)c(C)c2)CC1 ZINC000435745764 861025706 /nfs/dbraw/zinc/02/57/06/861025706.db2.gz QECGUPCSASOXGC-RBBKRZOGSA-N 0 3 412.965 4.468 20 0 HIADHN C[S@@](=O)C1(CNCc2cc(Br)ccc2OCc2ccccc2)CCC1 ZINC000435748271 861029096 /nfs/dbraw/zinc/02/90/96/861029096.db2.gz NOEYSOSNWZDMEW-RUZDIDTESA-N 0 3 422.388 4.419 20 0 HIADHN CCc1nc(CN(C(C)=O)[C@H]2CCN(Cc3cccc(-c4ccccc4C)c3)C2)no1 ZINC000435874697 861133984 /nfs/dbraw/zinc/13/39/84/861133984.db2.gz MTVPZZHXTWMJBC-QFIPXVFZSA-N 0 3 418.541 4.230 20 0 HIADHN COc1ccccc1[C@H](C)NC(=O)[C@H](C)N[C@@H](C)c1ccc(Br)cc1 ZINC000435886930 861143847 /nfs/dbraw/zinc/14/38/47/861143847.db2.gz DECZLVFSEXKFGA-KKUMJFAQSA-N 0 3 405.336 4.374 20 0 HIADHN CC(C)(O)C1CN(C[C@H](O)COC(c2ccc(Cl)cc2)c2ccc(Cl)cc2)C1 ZINC000435912674 861174457 /nfs/dbraw/zinc/17/44/57/861174457.db2.gz ZLKHQAQUXIXFLY-FQEVSTJZSA-N 0 3 424.368 4.163 20 0 HIADHN C[C@@H]1CCN(C(=O)Nc2ccc(OC[C@H]3CCCO3)cc2)CCN1Cc1ccccc1 ZINC000437742517 863068984 /nfs/dbraw/zinc/06/89/84/863068984.db2.gz GCIRORBPAUPQMQ-HYBUGGRVSA-N 0 3 423.557 4.373 20 0 HIADHN C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)[C@@](C)(Cc1nc2ccccc2s1)c1ccccc1 ZINC000467803097 881627520 /nfs/dbraw/zinc/62/75/20/881627520.db2.gz MZJPHKDNXVBNBF-SAQVGAHLSA-N 0 3 419.594 4.396 20 0 HIADHN C[C@@H]1CCN(C(=O)Nc2ccc(-c3csnn3)cc2)CCN1Cc1ccccc1 ZINC000437826848 863172968 /nfs/dbraw/zinc/17/29/68/863172968.db2.gz YJUCLIZFWSAPEQ-QGZVFWFLSA-N 0 3 407.543 4.333 20 0 HIADHN CC[C@@H](C)NC(=O)c1ccc(NC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)cc1 ZINC000437837631 863191076 /nfs/dbraw/zinc/19/10/76/863191076.db2.gz JTBJRRZANIUSKO-UXHICEINSA-N 0 3 422.573 4.343 20 0 HIADHN C[C@H]1CCN(C(=O)Nc2cccc(OC[C@H]3CCCO3)c2)CCN1Cc1ccccc1 ZINC000437911527 863287695 /nfs/dbraw/zinc/28/76/95/863287695.db2.gz OOTFYYADLHSTGV-GBXCKJPGSA-N 0 3 423.557 4.373 20 0 HIADHN CCN(Cc1cccc(NC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)c1)C(C)=O ZINC000437915367 863292740 /nfs/dbraw/zinc/29/27/40/863292740.db2.gz MKAYAGXWDUYZOE-HXUWFJFHSA-N 0 3 422.573 4.183 20 0 HIADHN CC[C@@H](c1ccc(F)cc1F)N1CCN(C(=O)Nc2cccc(CN(C)C)c2)CC1 ZINC000437930295 863307502 /nfs/dbraw/zinc/30/75/02/863307502.db2.gz DCAFKURXJQDZJX-QFIPXVFZSA-N 0 3 416.516 4.327 20 0 HIADHN Cc1ccc2cc(CN(C)[C@@H](C)c3cccc(N4CCCS4(=O)=O)c3)ccc2n1 ZINC000437954455 863326607 /nfs/dbraw/zinc/32/66/07/863326607.db2.gz KRHTXNAUVDDQSU-SFHVURJKSA-N 0 3 409.555 4.276 20 0 HIADHN Cc1csc(Sc2ccc(NC(=O)N3CC[C@@H](N4CC=CC4)C3)c(C)c2)n1 ZINC000438143062 863562854 /nfs/dbraw/zinc/56/28/54/863562854.db2.gz TYKJDRBZKOCADN-MRXNPFEDSA-N 0 3 400.573 4.389 20 0 HIADHN Cc1ccc2cc(CNCc3ccc(C(=O)N4C[C@H](C)O[C@@H](C)C4)cc3)ccc2n1 ZINC000438203213 863633490 /nfs/dbraw/zinc/63/34/90/863633490.db2.gz PIVIONHPYDWXIQ-OALUTQOASA-N 0 3 403.526 4.082 20 0 HIADHN C[C@@H]1CCN(C(=O)Nc2ccc(Cn3cccn3)cc2)CCN1Cc1ccccc1 ZINC000438224933 863661381 /nfs/dbraw/zinc/66/13/81/863661381.db2.gz LWUZIQUEENJZHV-HXUWFJFHSA-N 0 3 403.530 4.060 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Nc1ccc(OCC(F)(F)F)cc1 ZINC000438354276 863820540 /nfs/dbraw/zinc/82/05/40/863820540.db2.gz LILIZBDNKCXWPM-UHFFFAOYSA-N 0 3 401.454 4.285 20 0 HIADHN CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)N[C@@H]1C[C@H]1c1c(F)cccc1Cl ZINC000438362026 863825750 /nfs/dbraw/zinc/82/57/50/863825750.db2.gz ZNGYMFCDDOCMFG-HXQKEGBBSA-N 0 3 416.928 4.064 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)N[C@H]2C[C@H](c3cccc(Cl)c3)C2)CC1 ZINC000438436800 863865220 /nfs/dbraw/zinc/86/52/20/863865220.db2.gz QJIBPMMZZXESSN-UAPYVXQJSA-N 0 3 401.938 4.485 20 0 HIADHN C[C@H](C(=O)N(CCN(C)C)Cc1cccs1)c1ccc(Br)s1 ZINC000438454874 863878743 /nfs/dbraw/zinc/87/87/43/863878743.db2.gz BIBWLLDKKQSJTO-LBPRGKRZSA-N 0 3 401.395 4.266 20 0 HIADHN Cc1ccc(C(=O)N(CCN(C)C)Cc2cccs2)cc1NC(=O)c1ccco1 ZINC000438460538 863883035 /nfs/dbraw/zinc/88/30/35/863883035.db2.gz MNOWRJWSRARCEY-UHFFFAOYSA-N 0 3 411.527 4.106 20 0 HIADHN Cc1cc(CN(C)[C@@H]2CCOc3ccc(Br)cc32)ccc1-n1cncn1 ZINC000438478280 863895300 /nfs/dbraw/zinc/89/53/00/863895300.db2.gz LWNMISXFWFJSST-LJQANCHMSA-N 0 3 413.319 4.294 20 0 HIADHN CC(C)c1cnc(-c2ccc(NC(=O)N(CCN(C)C)Cc3ccccn3)cc2)o1 ZINC000438480857 863897704 /nfs/dbraw/zinc/89/77/04/863897704.db2.gz BQKCTNUWWGUJJZ-UHFFFAOYSA-N 0 3 407.518 4.456 20 0 HIADHN COc1ccc2nc(NC(=O)N(Cc3ccccc3)C3CCN(C)CC3)sc2c1 ZINC000438500888 863921349 /nfs/dbraw/zinc/92/13/49/863921349.db2.gz RWILQTKSTSQKKX-UHFFFAOYSA-N 0 3 410.543 4.433 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)c1cc(NC(=O)C(C)(C)C)ccc1F ZINC000438529337 863953958 /nfs/dbraw/zinc/95/39/58/863953958.db2.gz IZZZQOQNMKXKIQ-UHFFFAOYSA-N 0 3 405.539 4.076 20 0 HIADHN CC(C)CC(=O)Nc1ccc(C(=O)N(CCN(C)C)Cc2cccs2)cc1F ZINC000438537460 863963839 /nfs/dbraw/zinc/96/38/39/863963839.db2.gz RUDBDHQVBBWOJX-UHFFFAOYSA-N 0 3 405.539 4.076 20 0 HIADHN CC(C)C1CCC(N2CCN(CC(=O)N(C)c3nc4ccccc4s3)CC2)CC1 ZINC000438567332 864000425 /nfs/dbraw/zinc/00/04/25/864000425.db2.gz MQVXROWVDLFMFM-UHFFFAOYSA-N 0 3 414.619 4.092 20 0 HIADHN CN(C)[C@@H](CNC(=O)Nc1c(F)cc(Br)cc1F)Cc1ccccc1 ZINC000438642653 864079666 /nfs/dbraw/zinc/07/96/66/864079666.db2.gz RCHRQRGLORXNDY-CQSZACIVSA-N 0 3 412.278 4.022 20 0 HIADHN C[C@H](OC[C@H](O)CN1CC=C(c2c[nH]c3ncccc23)CC1)c1ccc(Cl)cc1 ZINC000438651311 864092399 /nfs/dbraw/zinc/09/23/99/864092399.db2.gz MKNASJUPYJKAOT-OXJNMPFZSA-N 0 3 411.933 4.444 20 0 HIADHN CCN(C(=O)C(=O)Nc1ccsc1Cl)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000438653460 864094149 /nfs/dbraw/zinc/09/41/49/864094149.db2.gz FKGXWGOMKGUWCU-ZBFHGGJFSA-N 0 3 405.951 4.024 20 0 HIADHN C[C@@H]1CCC[C@@H](OCc2cccc(NC(=O)C(=O)Nc3cccc(CN(C)C)c3)c2)C1 ZINC000438713203 864193937 /nfs/dbraw/zinc/19/39/37/864193937.db2.gz GCKPXJLUNAQPKE-WZONZLPQSA-N 0 3 423.557 4.421 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)c2ccc(-c3n[nH]c(C4CC4)n3)cc2)CC1 ZINC000438714669 864197122 /nfs/dbraw/zinc/19/71/22/864197122.db2.gz MCZBFSHSEQBEQX-UHFFFAOYSA-N 0 3 415.541 4.086 20 0 HIADHN O[C@H](COc1cc(F)cc(Br)c1)CN1CCC[C@H]1c1ccsc1 ZINC000438845410 864339861 /nfs/dbraw/zinc/33/98/61/864339861.db2.gz BFPZZIOBSKLBPI-RDJZCZTQSA-N 0 3 400.313 4.227 20 0 HIADHN CCOCc1ccc(NC(=O)NCCCCN2CCN(c3cccc(C)c3)CC2)cc1 ZINC000438863316 864355832 /nfs/dbraw/zinc/35/58/32/864355832.db2.gz WDCLFFPOXWNYEE-UHFFFAOYSA-N 0 3 424.589 4.255 20 0 HIADHN Cc1cc(NC(=O)NCc2ccccc2CN2CCC(O)CC2)ccc1OC(C)C ZINC000438883949 864369514 /nfs/dbraw/zinc/36/95/14/864369514.db2.gz IKUAQRRKCNPUDJ-UHFFFAOYSA-N 0 3 411.546 4.061 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)Nc1cccc(CC(F)(F)F)c1 ZINC000438882977 864370307 /nfs/dbraw/zinc/37/03/07/864370307.db2.gz GDHIBNNEAAVOJH-UHFFFAOYSA-N 0 3 421.463 4.070 20 0 HIADHN O=C(CCCC(=O)N1CCCN(C2CCCC2)CC1)c1ccc(Br)cc1 ZINC000438909740 864389495 /nfs/dbraw/zinc/38/94/95/864389495.db2.gz JXRXMHPLVSRRQY-UHFFFAOYSA-N 0 3 421.379 4.279 20 0 HIADHN Cc1cc(Br)ccc1NC(=O)CN1CCCC[C@@H]1[C@@H]1CCCC[C@@H]1O ZINC000439006051 864460135 /nfs/dbraw/zinc/46/01/35/864460135.db2.gz FVYVBDXXEQNERO-UHOSZYNNSA-N 0 3 409.368 4.102 20 0 HIADHN COC(=O)[C@@H](NC1CCN([C@@H](C)c2ccncc2)CC1)c1ccc(Cl)cc1Cl ZINC000439064381 864514702 /nfs/dbraw/zinc/51/47/02/864514702.db2.gz OXMHOGBZTAMLKN-XOBRGWDASA-N 0 3 422.356 4.418 20 0 HIADHN Cc1csc(-c2cccc(NC(=O)C(=O)Nc3cc(CN(C)C)ccc3C)c2)n1 ZINC000439090291 864535492 /nfs/dbraw/zinc/53/54/92/864535492.db2.gz KCBTZECKWOJQEN-UHFFFAOYSA-N 0 3 408.527 4.066 20 0 HIADHN CS(=O)(=O)Cc1ccccc1CN[C@@H](c1ccc(Br)s1)C1CC1 ZINC000439139335 864572754 /nfs/dbraw/zinc/57/27/54/864572754.db2.gz WWQMHJSTHGJCHX-QGZVFWFLSA-N 0 3 414.390 4.296 20 0 HIADHN CC[C@H](C)C(=O)Nc1cccc(CNC(=O)N(CCN(C)C)Cc2cccs2)c1 ZINC000439162336 864592167 /nfs/dbraw/zinc/59/21/67/864592167.db2.gz CNFFSLRHIIATSE-KRWDZBQOSA-N 0 3 416.591 4.006 20 0 HIADHN C[C@@H](Sc1ccccc1)c1ccc(NC(=O)C(=O)N(C)CCN2CCCC2)cc1 ZINC000439224538 864642671 /nfs/dbraw/zinc/64/26/71/864642671.db2.gz QCLRVKQAOIDEQN-GOSISDBHSA-N 0 3 411.571 4.033 20 0 HIADHN CCN(C[C@@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)Cc1ccccc1Cl ZINC000439227462 864645379 /nfs/dbraw/zinc/64/53/79/864645379.db2.gz DBGHKSVUMPNYIH-LJQANCHMSA-N 0 3 406.979 4.014 20 0 HIADHN COc1ccccc1[C@@H](CNCc1cc(Cl)ccc1OC[C@@H]1CCCO1)N(C)C ZINC000439475977 864844354 /nfs/dbraw/zinc/84/43/54/864844354.db2.gz GRBNOSYNDZLCPN-PZJWPPBQSA-N 0 3 418.965 4.299 20 0 HIADHN COc1cccc([C@@H](CNCc2cc(Cl)ccc2OC[C@@H]2CCCO2)N(C)C)c1 ZINC000439480608 864846651 /nfs/dbraw/zinc/84/66/51/864846651.db2.gz VLIRIAPGJPTNPI-FCHUYYIVSA-N 0 3 418.965 4.299 20 0 HIADHN CCN(C(=O)[C@@H](C)NCc1ccccc1CN(C)Cc1ccco1)c1ccccc1 ZINC000439594767 864917381 /nfs/dbraw/zinc/91/73/81/864917381.db2.gz KQRKIRCELYMDMC-HXUWFJFHSA-N 0 3 405.542 4.443 20 0 HIADHN COC(=O)[C@H](NCC1CCN(Cc2ccccc2Cl)CC1)c1ccccc1F ZINC000439601414 864922664 /nfs/dbraw/zinc/92/26/64/864922664.db2.gz AKLNKCQJGSHFHS-OAQYLSRUSA-N 0 3 404.913 4.195 20 0 HIADHN Cc1ccc(NC(=O)[C@H](NCCc2cccc(C(=O)N(C)C)c2)c2ccccc2)cc1 ZINC000439606164 864927837 /nfs/dbraw/zinc/92/78/37/864927837.db2.gz FDCGTYXEOZOTNQ-XMMPIXPASA-N 0 3 415.537 4.209 20 0 HIADHN Cc1ccn(-c2ccccc2NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)n1 ZINC000467949822 881817171 /nfs/dbraw/zinc/81/71/71/881817171.db2.gz RBYRWELGVBKCFQ-UHFFFAOYSA-N 0 3 421.467 4.108 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)NC[C@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000439623762 864946596 /nfs/dbraw/zinc/94/65/96/864946596.db2.gz KPGRHWAABDVSKP-DOTOQJQBSA-N 0 3 403.464 4.268 20 0 HIADHN C[C@@H](NCC(C)(C)c1c(F)cccc1Cl)C(=O)Nc1ccc2c(c1)OCCO2 ZINC000439636128 864963572 /nfs/dbraw/zinc/96/35/72/864963572.db2.gz BWSKTZWBKAWCEG-CYBMUJFWSA-N 0 3 406.885 4.145 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)c2ccc(OCc3ccncc3)cc2)CC1 ZINC000439729940 865062640 /nfs/dbraw/zinc/06/26/40/865062640.db2.gz DHDYGCNPJVLWMA-IBGZPJMESA-N 0 3 416.525 4.011 20 0 HIADHN Cc1cccc(-c2nc(CC(=O)NC3CCN([C@H](C)c4ccncc4)CC3)cs2)c1 ZINC000439738368 865070450 /nfs/dbraw/zinc/07/04/50/865070450.db2.gz JBSQDWRHSWSQRV-GOSISDBHSA-N 0 3 420.582 4.398 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)c2ccc(OCc3ccccn3)cc2)CC1 ZINC000439740834 865073217 /nfs/dbraw/zinc/07/32/17/865073217.db2.gz CQEJSCNBFKKXDD-IBGZPJMESA-N 0 3 416.525 4.011 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)CCOc2ccc(Cl)c(Cl)c2)CC1 ZINC000439742227 865073902 /nfs/dbraw/zinc/07/39/02/865073902.db2.gz GJZDJAXEYJQTQG-HNNXBMFYSA-N 0 3 422.356 4.499 20 0 HIADHN Cc1nn(-c2ccc(Br)cc2)cc1CN1CCC([C@H]2CCCO2)CC1 ZINC000439781926 865104165 /nfs/dbraw/zinc/10/41/65/865104165.db2.gz NRGYSPYXWQYSRC-HXUWFJFHSA-N 0 3 404.352 4.334 20 0 HIADHN Cc1ncsc1CN(C)C[C@@H]1CCN(C(=O)Nc2ccc(F)c(C3CC3)c2)C1 ZINC000439789781 865109955 /nfs/dbraw/zinc/10/99/55/865109955.db2.gz GJDPVYQVDNHLBH-HNNXBMFYSA-N 0 3 402.539 4.454 20 0 HIADHN Cc1coc(-c2cccc(NC(=O)CCCN3CCN(c4ccccc4)CC3)c2)n1 ZINC000467991183 881837550 /nfs/dbraw/zinc/83/75/50/881837550.db2.gz VJECIRVRHGJGOM-UHFFFAOYSA-N 0 3 404.514 4.191 20 0 HIADHN CCN(C(=O)c1ccc(-c2nnc(C)o2)cc1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000467991464 881837774 /nfs/dbraw/zinc/83/77/74/881837774.db2.gz ZLCRHBQNNOVDKH-VGOFRKELSA-N 0 3 404.514 4.343 20 0 HIADHN CN1CCC[C@H](CNC(=O)c2cn3ccnc3s2)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000467999382 881842378 /nfs/dbraw/zinc/84/23/78/881842378.db2.gz AXJZOGJMSFRQDG-PBHICJAKSA-N 0 3 422.476 4.228 20 0 HIADHN Cc1ccc(-c2ccnn2C)cc1NC(=O)N[C@H]1C[C@H](C)N(Cc2ccccc2)C1 ZINC000439951043 865243584 /nfs/dbraw/zinc/24/35/84/865243584.db2.gz PUZJJQURBWVOFA-RXVVDRJESA-N 0 3 403.530 4.180 20 0 HIADHN C[C@@H](NCc1ccc(OCc2ccccc2F)cc1)c1ccc(-n2cnnn2)cc1 ZINC000468031067 881863507 /nfs/dbraw/zinc/86/35/07/881863507.db2.gz OHSDZUCBLOBUGM-QGZVFWFLSA-N 0 3 403.461 4.231 20 0 HIADHN COc1ccc(NC(=O)C[C@H](C)N[C@@H](C)c2cn(C(C)(C)C)nc2C)c(OC)c1 ZINC000468040157 881869394 /nfs/dbraw/zinc/86/93/94/881869394.db2.gz DZIYAQLVOZLQMJ-GJZGRUSLSA-N 0 3 402.539 4.032 20 0 HIADHN O=C(NCc1cccc(-c2ccccn2)c1)NC[C@H](c1cccs1)N1CCCC1 ZINC000440199267 865429773 /nfs/dbraw/zinc/42/97/73/865429773.db2.gz IIISIBZWJWMJEG-OAQYLSRUSA-N 0 3 406.555 4.446 20 0 HIADHN CC(C)C1CCC(N2CCN(C(=O)N[C@@H](CCCO)c3ccccc3)CC2)CC1 ZINC000440208025 865440221 /nfs/dbraw/zinc/44/02/21/865440221.db2.gz PGQVWUWHWHJSCK-SDVLMSEASA-N 0 3 401.595 4.042 20 0 HIADHN COc1ccc(OC)c(NC(=O)C[C@H](C)N[C@@H](C)c2cn(C(C)(C)C)nc2C)c1 ZINC000468042246 881871076 /nfs/dbraw/zinc/87/10/76/881871076.db2.gz KNMIUUDJRYOMBO-GJZGRUSLSA-N 0 3 402.539 4.032 20 0 HIADHN CC(=O)Nc1ccc([C@H](C)N[C@H]2CC(=O)N(Cc3ccccc3C(F)(F)F)C2)cc1 ZINC000468051852 881877488 /nfs/dbraw/zinc/87/74/88/881877488.db2.gz XBHQVEYWEBQHLY-LIRRHRJNSA-N 0 3 419.447 4.116 20 0 HIADHN CCN1CCN(CCC(=O)N(Cc2ccc(-c3ccccc3F)s2)C(C)C)CC1 ZINC000468053284 881878515 /nfs/dbraw/zinc/87/85/15/881878515.db2.gz QDUVDIDXXUVOJN-UHFFFAOYSA-N 0 3 417.594 4.319 20 0 HIADHN CC(C)n1cnnc1-c1ccccc1NC(=O)N[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000440274848 865523593 /nfs/dbraw/zinc/52/35/93/865523593.db2.gz VDCHPHHTBLXXCS-QUCCMNQESA-N 0 3 418.545 4.483 20 0 HIADHN CC(C)n1cnnc1-c1ccccc1NC(=O)N(CCN(C)C)Cc1cccc(F)c1 ZINC000440291265 865543916 /nfs/dbraw/zinc/54/39/16/865543916.db2.gz NUYMMKGWSYGTHN-UHFFFAOYSA-N 0 3 424.524 4.261 20 0 HIADHN CC(C)n1cnnc1-c1ccccc1NC(=O)N[C@H](CN1CCCC1)c1ccccc1 ZINC000440297221 865556138 /nfs/dbraw/zinc/55/61/38/865556138.db2.gz QSHJFKNKIGIKLY-JOCHJYFZSA-N 0 3 418.545 4.485 20 0 HIADHN Cc1ccc(NC(=O)N2CCN(C3CCC(C(C)C)CC3)CC2)cc1C(=O)N(C)C ZINC000440307970 865568031 /nfs/dbraw/zinc/56/80/31/865568031.db2.gz VNBNTBZOPNCZQS-UHFFFAOYSA-N 0 3 414.594 4.061 20 0 HIADHN CCOc1ccccc1NC(=O)[C@H](C)N1CCN(C2CCC(C(C)C)CC2)CC1 ZINC000440319097 865590201 /nfs/dbraw/zinc/59/02/01/865590201.db2.gz WPWVYFQQMZWHMA-MWXLCCTBSA-N 0 3 401.595 4.245 20 0 HIADHN Cc1ccc(-c2ccc(C(=O)NC[C@@]3(O)CCN(Cc4ccccc4)C3)c(F)c2)cc1 ZINC000440526854 865805226 /nfs/dbraw/zinc/80/52/26/865805226.db2.gz YWMHWRWOGJAFFZ-SANMLTNESA-N 0 3 418.512 4.168 20 0 HIADHN C[C@H](N[C@@H]1CC(C)(C)CCc2ccccc21)C(=O)Nc1ccccc1S(C)(=O)=O ZINC000440610517 865837372 /nfs/dbraw/zinc/83/73/72/865837372.db2.gz HFQRBOJWNOXQAH-OXJNMPFZSA-N 0 3 414.571 4.111 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)c2cc(F)c(F)cc2Br)C1 ZINC000440793510 865915697 /nfs/dbraw/zinc/91/56/97/865915697.db2.gz CQTMAYXLOLOMQF-TZMCWYRMSA-N 0 3 409.274 4.293 20 0 HIADHN COc1ccc(NC(=O)C2(NCCO[C@@H]3CCCC[C@H]3C)CCCC2)cc1OC ZINC000440890038 865983840 /nfs/dbraw/zinc/98/38/40/865983840.db2.gz IOTKURUWEQBCSK-IEBWSBKVSA-N 0 3 404.551 4.140 20 0 HIADHN COc1ccc(NC(=O)C2(NCCO[C@H]3CCCC[C@H]3C)CCCC2)cc1OC ZINC000440890039 865984850 /nfs/dbraw/zinc/98/48/50/865984850.db2.gz IOTKURUWEQBCSK-MJGOQNOKSA-N 0 3 404.551 4.140 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)c2ccc(Cl)c(NC(=O)c3cccs3)c2)CN1C1CC1 ZINC000440920023 866015509 /nfs/dbraw/zinc/01/55/09/866015509.db2.gz GUBIUMLUCQCSFZ-TZMCWYRMSA-N 0 3 403.935 4.009 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)CSc2ncnc3scc(-c4ccccc4)c32)CN1C1CC1 ZINC000440922159 866018204 /nfs/dbraw/zinc/01/82/04/866018204.db2.gz NBLKTPQDKHOGGJ-GDBMZVCRSA-N 0 3 424.595 4.192 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)Cc2csc(-c3cccc(C(F)(F)F)c3)n2)CN1C1CC1 ZINC000440932685 866031223 /nfs/dbraw/zinc/03/12/23/866031223.db2.gz NIFJVZONDQCOMP-DOMZBBRYSA-N 0 3 409.477 4.113 20 0 HIADHN Cc1ccc([C@H](OC[C@@H](O)CN2CCc3ccccc3[C@H]2CO)c2ccccc2)cc1 ZINC000440935424 866033039 /nfs/dbraw/zinc/03/30/39/866033039.db2.gz KYHHWUXYGWENSQ-WYMJOSIYSA-N 0 3 417.549 4.054 20 0 HIADHN C[C@H](c1cccs1)N(Cc1ccccc1)C(=O)NCCN1CCN(C)C(C)(C)C1 ZINC000440979741 866063237 /nfs/dbraw/zinc/06/32/37/866063237.db2.gz HWKKTINUDKXXKX-LJQANCHMSA-N 0 3 414.619 4.047 20 0 HIADHN O=C(CCN1CCC[C@H](c2nc(C(F)(F)F)cs2)C1)N1CCc2ccccc21 ZINC000441105731 866202912 /nfs/dbraw/zinc/20/29/12/866202912.db2.gz PUQRPGZKGWFPLM-HNNXBMFYSA-N 0 3 409.477 4.321 20 0 HIADHN CC(C)OC(=O)c1ccc(CN2CCC(C(=O)N3CCc4ccccc43)CC2)cc1 ZINC000441163725 866248785 /nfs/dbraw/zinc/24/87/85/866248785.db2.gz GBBIVMMNKHHDJQ-UHFFFAOYSA-N 0 3 406.526 4.053 20 0 HIADHN CO[C@H]1CCCC[C@@H]1NCC(=O)N1N=C(c2cc3ccccc3o2)C[C@H]1c1ccco1 ZINC000441258980 866334910 /nfs/dbraw/zinc/33/49/10/866334910.db2.gz KTEHKBDQHFCWAA-CUWPLCDZSA-N 0 3 421.497 4.251 20 0 HIADHN CN(C(=O)CCN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1)c1ccccc1 ZINC000441269833 866344229 /nfs/dbraw/zinc/34/42/29/866344229.db2.gz SJNBZNKIIFDQON-HSZRJFAPSA-N 0 3 415.537 4.087 20 0 HIADHN CCOc1cc(CN[C@H]2C(=O)NCC[C@@H]2C)ccc1OCc1c(F)cccc1Cl ZINC000441325129 866396740 /nfs/dbraw/zinc/39/67/40/866396740.db2.gz BMFKQFQWYIASBD-LHSJRXKWSA-N 0 3 420.912 4.071 20 0 HIADHN CCOc1cc(CN[C@]2(CO)CCCc3ccccc32)ccc1OCC(F)(F)F ZINC000441344741 866415269 /nfs/dbraw/zinc/41/52/69/866415269.db2.gz FROHKHMNUMEISO-NRFANRHFSA-N 0 3 409.448 4.340 20 0 HIADHN COc1cc2c(cc1OC)CN(C(=O)CN(C)[C@@H]1CCC[C@@H]1c1ccc(C)cc1)CC2 ZINC000441352039 866422175 /nfs/dbraw/zinc/42/21/75/866422175.db2.gz JUKISXPFSAMNTG-DHIUTWEWSA-N 0 3 422.569 4.165 20 0 HIADHN OC[C@@]1(NCc2ccc(OC(F)F)c(Br)c2)CCCc2ccccc21 ZINC000441354469 866425209 /nfs/dbraw/zinc/42/52/09/866425209.db2.gz OCCVMSODSHSMRJ-IBGZPJMESA-N 0 3 412.274 4.364 20 0 HIADHN CC(C)N(Cc1cc(Br)ccc1F)C(=O)N[C@H]1C[C@H](C)N(C2CC2)C1 ZINC000441378930 866448426 /nfs/dbraw/zinc/44/84/26/866448426.db2.gz CSRPQSGYWBENHO-BBRMVZONSA-N 0 3 412.347 4.133 20 0 HIADHN Cc1ccc([C@H]2CCC[C@@H]2N(C)CC(=O)NCC2(c3ccccc3)CCOCC2)cc1 ZINC000441378869 866448705 /nfs/dbraw/zinc/44/87/05/866448705.db2.gz NGCWBHNSSAMGAD-RPBOFIJWSA-N 0 3 420.597 4.428 20 0 HIADHN C[C@H]1C[C@H](NC(=O)c2cc(F)c(F)cc2Br)CN1Cc1ccccc1 ZINC000441451202 866527422 /nfs/dbraw/zinc/52/74/22/866527422.db2.gz TWJXKNPRTVSMHF-JSGCOSHPSA-N 0 3 409.274 4.120 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)C[C@@H](C)C(=O)c3cccc(F)c3)c(C)c2)CC1 ZINC000468137958 881987048 /nfs/dbraw/zinc/98/70/48/881987048.db2.gz IIQYUWSQMKHMEE-GOSISDBHSA-N 0 3 411.521 4.124 20 0 HIADHN COc1ccc(NC(=O)[C@H](c2ccccc2)N2CC[C@@H]([C@H]3CCOC3)C2)cc1Cl ZINC000441643199 866752331 /nfs/dbraw/zinc/75/23/31/866752331.db2.gz BGFSMAWKVGASHV-FGSXEWAUSA-N 0 3 414.933 4.387 20 0 HIADHN CC(C)Cn1ccc2cc(NC(=O)C(=O)N[C@@H](C)[C@@H](c3ccccc3)N(C)C)ccc21 ZINC000441698058 866810853 /nfs/dbraw/zinc/81/08/53/866810853.db2.gz GMRVQUMSPRBESW-MBSDFSHPSA-N 0 3 420.557 4.043 20 0 HIADHN COc1cc(OC)cc(N(C)C(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)c1 ZINC000468159691 882026798 /nfs/dbraw/zinc/02/67/98/882026798.db2.gz ZMGVEAVZKSFRPR-OAQYLSRUSA-N 0 3 422.447 4.121 20 0 HIADHN CC[C@@H]1CCCCN1CCNC(=O)C(=O)Nc1cccc(Cl)c1SC(C)C ZINC000441887769 866952189 /nfs/dbraw/zinc/95/21/89/866952189.db2.gz KLMSLSVLKIJPBE-OAHLLOKOSA-N 0 3 411.999 4.160 20 0 HIADHN Cc1ccc([C@@H](Cn2ccnc2)NC(=O)c2cccc(CN3CCCC3)c2)c(C)c1 ZINC000442187629 867210021 /nfs/dbraw/zinc/21/00/21/867210021.db2.gz KSASPTVJPJRHCM-XMMPIXPASA-N 0 3 402.542 4.267 20 0 HIADHN Cc1c(NC(=O)N2CCCN(CCCc3ccccc3)CC2)cnn1CCC(C)C ZINC000442233155 867269972 /nfs/dbraw/zinc/26/99/72/867269972.db2.gz ZCNZQMJFMUFYFM-UHFFFAOYSA-N 0 3 411.594 4.410 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1ccc2c(n1)CCCC2 ZINC000442317850 867324278 /nfs/dbraw/zinc/32/42/78/867324278.db2.gz XGAJETPLMHYXKJ-NRFANRHFSA-N 0 3 415.541 4.165 20 0 HIADHN Cc1ccc(OCc2ccccc2)c(NC(=O)N(CCN(C)C)C[C@H]2CCCO2)c1 ZINC000442446799 867420831 /nfs/dbraw/zinc/42/08/31/867420831.db2.gz WEYXZIXGFOJKQW-OAQYLSRUSA-N 0 3 411.546 4.149 20 0 HIADHN COCc1nc(CNC(=O)c2cccc(CN3CCCC3)c2)c(-c2ccccc2)s1 ZINC000442833263 867692230 /nfs/dbraw/zinc/69/22/30/867692230.db2.gz HBMURBCBDNPNTI-UHFFFAOYSA-N 0 3 421.566 4.482 20 0 HIADHN CC(C)[C@H]([NH2+][C@H]1CC[C@@H](c2ccc(C(F)(F)F)cc2)C1)c1nc(-c2nc[n-]n2)no1 ZINC000442850439 867698762 /nfs/dbraw/zinc/69/87/62/867698762.db2.gz PKMGLHDLEXKHPL-KBMXLJTQSA-N 0 3 420.439 4.497 20 0 HIADHN CCO[C@H]1C[C@@H](NCc2nc(COC)sc2-c2ccccc2)C12CCOCC2 ZINC000442856510 867700552 /nfs/dbraw/zinc/70/05/52/867700552.db2.gz LPOUDRLSBNWCIA-MOPGFXCFSA-N 0 3 402.560 4.020 20 0 HIADHN O=C(NCCc1ccc2[nH]ccc2c1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000442989277 867781250 /nfs/dbraw/zinc/78/12/50/867781250.db2.gz HZZJCJLQVLMNNO-QFIPXVFZSA-N 0 3 415.459 4.281 20 0 HIADHN Cc1cc(C(F)(F)F)ccc1CNc1ccc2nc(CCN3CCOCC3)[nH]c2c1 ZINC000443011489 867791637 /nfs/dbraw/zinc/79/16/37/867791637.db2.gz GTCPTVHWNKPQCP-UHFFFAOYSA-N 0 3 418.463 4.377 20 0 HIADHN C[C@H](CC(=O)Nc1ccc(F)cc1)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1 ZINC000443091519 867816063 /nfs/dbraw/zinc/81/60/63/867816063.db2.gz DSJRHEIHGIMGGL-WZONZLPQSA-N 0 3 419.500 4.382 20 0 HIADHN COc1cc(-c2noc([C@H](C)N3[C@H](C)CC[C@@H]3C)n2)ccc1OC[C@H]1CCCO1 ZINC000443194213 867869475 /nfs/dbraw/zinc/86/94/75/867869475.db2.gz IDXTUKLXHJSZRN-UIBIWLFHSA-N 0 3 401.507 4.237 20 0 HIADHN C[C@@H](c1nc(-c2cc(C(F)(F)F)ccc2-n2cncn2)no1)N1[C@H](C)CC[C@H]1C ZINC000443213679 867878813 /nfs/dbraw/zinc/87/88/13/867878813.db2.gz RQGCQONUKSIZRZ-UPJWGTAASA-N 0 3 406.412 4.270 20 0 HIADHN Cc1cc2c(o1)c(C(=O)NCCCCN1C[C@H](C)O[C@@H](C)C1)ccc2Br ZINC000443287861 867892153 /nfs/dbraw/zinc/89/21/53/867892153.db2.gz KTQKREVVJBTHOP-GJZGRUSLSA-N 0 3 423.351 4.123 20 0 HIADHN C[C@H](C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1)c1cccc(Cl)c1 ZINC000443345481 867917116 /nfs/dbraw/zinc/91/71/16/867917116.db2.gz RLJOIDNAASTCIL-INIZCTEOSA-N 0 3 404.913 4.242 20 0 HIADHN C[C@@H](CC(=O)NC1CCN(CCOc2ccc(F)cc2)CC1)c1cccc(F)c1 ZINC000443351022 867920013 /nfs/dbraw/zinc/92/00/13/867920013.db2.gz KQCUQPAUIPWXPB-KRWDZBQOSA-N 0 3 402.485 4.118 20 0 HIADHN CC[C@@]1(C)Oc2ccc(NC(=O)N(C)C[C@@H]3CCN(C)[C@H]3c3cccnc3)cc2O1 ZINC000443389975 867950209 /nfs/dbraw/zinc/95/02/09/867950209.db2.gz SRCWHTYCKLHZGW-HYVJGQCMSA-N 0 3 410.518 4.136 20 0 HIADHN C[C@@H](CCN1CCN(C)CC1)NC(=O)Nc1ccc(Cl)cc1-c1ccccc1 ZINC000443522336 868081711 /nfs/dbraw/zinc/08/17/11/868081711.db2.gz PJOQXLYLEHSHKZ-KRWDZBQOSA-N 0 3 400.954 4.155 20 0 HIADHN CCN1CCC[C@@H](CN(C)C(=O)NCC[C@H](C)CC(C)(C)C)[C@@H]1c1cnn(C)c1 ZINC000443550124 868107204 /nfs/dbraw/zinc/10/72/04/868107204.db2.gz IGBOACNJOMPLSO-IRFCIJBXSA-N 0 3 405.631 4.297 20 0 HIADHN Cc1ccc(C(C)C)c(OCCC(=O)NCc2ccccc2CN2CCC(O)CC2)c1 ZINC000443585573 868140117 /nfs/dbraw/zinc/14/01/17/868140117.db2.gz XCZCIUKWPWQWNQ-UHFFFAOYSA-N 0 3 424.585 4.160 20 0 HIADHN Cc1cc(CN2CCC[C@H](c3nnc4n3CCC4)C2)nc(-c2ccc(Cl)cc2)n1 ZINC000443609363 868171212 /nfs/dbraw/zinc/17/12/12/868171212.db2.gz LVUHKIWGQWVIGM-KRWDZBQOSA-N 0 3 408.937 4.023 20 0 HIADHN CCCC(=O)NC[C@H]1CCCN(Cc2cc(C)nc(-c3ccc(Cl)cc3)n2)C1 ZINC000443624100 868194971 /nfs/dbraw/zinc/19/49/71/868194971.db2.gz KQVLGIVJNZJZQD-QGZVFWFLSA-N 0 3 400.954 4.234 20 0 HIADHN C[C@@H](NC(=O)N(C)C1CCN(CCc2ccccn2)CC1)c1cc2ccccc2o1 ZINC000443632313 868208663 /nfs/dbraw/zinc/20/86/63/868208663.db2.gz NWTFGPXEGWJJAU-GOSISDBHSA-N 0 3 406.530 4.237 20 0 HIADHN O=c1cc(CN2CCC[C@H](c3nc4ccc(F)cc4o3)C2)nc2ccc(Cl)cn12 ZINC000443636581 868217548 /nfs/dbraw/zinc/21/75/48/868217548.db2.gz CBLPRPUEHVCUPL-ZDUSSCGKSA-N 0 3 412.852 4.008 20 0 HIADHN C[C@H]1CN(CCCCNC(=O)c2ccccc2SCc2cscn2)C[C@H](C)O1 ZINC000443658047 868260317 /nfs/dbraw/zinc/26/03/17/868260317.db2.gz UROPVOKSUUBHBH-IRXDYDNUSA-N 0 3 419.616 4.055 20 0 HIADHN C[C@@H](Cc1ccc(Cl)cc1Cl)C(=O)NCCCCN1C[C@@H](C)O[C@H](C)C1 ZINC000443673511 868281559 /nfs/dbraw/zinc/28/15/59/868281559.db2.gz JOFNKUIMBJUFMM-ARFHVFGLSA-N 0 3 401.378 4.178 20 0 HIADHN C[C@H]1CN(CCCCNC(=O)CCCOc2ccc(Cl)cc2Cl)C[C@H](C)O1 ZINC000443675545 868283514 /nfs/dbraw/zinc/28/35/14/868283514.db2.gz NRLWLYSLAYGRSM-HOTGVXAUSA-N 0 3 417.377 4.158 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)Cc2csc(-c3ccc(Cl)cc3)n2)C[C@H](C)O1 ZINC000443684592 868289920 /nfs/dbraw/zinc/28/99/20/868289920.db2.gz TYVCWFKKCHAHTD-IYBDPMFKSA-N 0 3 421.994 4.012 20 0 HIADHN CCOC(=O)c1c(NC(=O)CC[C@H]2CC[C@@H](C)O2)sc2c1CC(C)(C)NC2(C)C ZINC000443810528 868344780 /nfs/dbraw/zinc/34/47/80/868344780.db2.gz AVTUQJQJXKQZIF-ZIAGYGMSSA-N 0 3 422.591 4.370 20 0 HIADHN Cc1ccccc1[C@H]([C@@H](C)NC(=O)C(=O)Nc1cccc(C(F)F)c1Cl)N(C)C ZINC000443836259 868367833 /nfs/dbraw/zinc/36/78/33/868367833.db2.gz GUNQSTMNMMZBMH-ACJLOTCBSA-N 0 3 423.891 4.332 20 0 HIADHN Cc1ccccc1[C@@H]([C@H](C)NC(=O)C(=O)Nc1cccc(C(F)F)c1Cl)N(C)C ZINC000443836582 868368445 /nfs/dbraw/zinc/36/84/45/868368445.db2.gz GUNQSTMNMMZBMH-SCLBCKFNSA-N 0 3 423.891 4.332 20 0 HIADHN Cc1ccccc1[C@@H]([C@@H](C)NC(=O)C(=O)Nc1cc(Cl)cc(Cl)c1)N(C)C ZINC000443840918 868370548 /nfs/dbraw/zinc/37/05/48/868370548.db2.gz JLMOEJJBCMSNKO-FZKQIMNGSA-N 0 3 408.329 4.048 20 0 HIADHN Cc1ccccc1[C@H]([C@H](C)NC(=O)C(=O)Nc1ccc(Cl)c(Cl)c1)N(C)C ZINC000443841274 868372315 /nfs/dbraw/zinc/37/23/15/868372315.db2.gz JRRAYOOEZMPFMN-UGSOOPFHSA-N 0 3 408.329 4.048 20 0 HIADHN Cc1cc(Cl)c(NC(=O)NC[C@@]2(O)CCN(Cc3ccccc3)C2)cc1Cl ZINC000443943937 868480597 /nfs/dbraw/zinc/48/05/97/868480597.db2.gz SWRNOBFJVDHZLG-FQEVSTJZSA-N 0 3 408.329 4.060 20 0 HIADHN Fc1ccc(OCCN2CCC(Nc3nc(C(F)F)nc4ccccc43)CC2)cc1 ZINC000443945451 868482591 /nfs/dbraw/zinc/48/25/91/868482591.db2.gz VSKPOTYURFALFR-UHFFFAOYSA-N 0 3 416.447 4.662 20 0 HIADHN Cc1ccc(CNCc2ccc(-n3cnc4ccccc43)cc2)cc1S(C)(=O)=O ZINC000443987033 868510515 /nfs/dbraw/zinc/51/05/15/868510515.db2.gz JMPIZKAJWPCAHV-UHFFFAOYSA-N 0 3 405.523 4.027 20 0 HIADHN OC[C@H](CNCc1cnc(C(F)(F)F)s1)Cc1ccc(OC(F)(F)F)cc1 ZINC000443996915 868517680 /nfs/dbraw/zinc/51/76/80/868517680.db2.gz LAEMEWNZURVSLT-NSHDSACASA-N 0 3 414.371 4.001 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)N[C@@H](CC(F)(F)F)c3ccc(C(F)(F)F)cc3)[C@H]2C1 ZINC000444021300 868548071 /nfs/dbraw/zinc/54/80/71/868548071.db2.gz DWWRWGJFAAQKNY-KBMXLJTQSA-N 0 3 423.401 4.435 20 0 HIADHN COc1cc(CN(C)CCC(=O)Nc2cccc(F)c2C)c(SC)cc1OC ZINC000444227380 868677324 /nfs/dbraw/zinc/67/73/24/868677324.db2.gz VIAXXQKLCDFGSY-UHFFFAOYSA-N 0 3 406.523 4.334 20 0 HIADHN COC(=O)c1ccc2c(c1)nc(CN(C)[C@@H]1CCC[C@@H]1c1ccc(C)cc1)[nH]c2=O ZINC000444236507 868685906 /nfs/dbraw/zinc/68/59/06/868685906.db2.gz IHLHXCSLJBBBEX-WIYYLYMNSA-N 0 3 405.498 4.199 20 0 HIADHN COc1cc2nc(CN(C)[C@H]3CCC[C@@H]3c3ccc(C)cc3)[nH]c(=O)c2cc1OC ZINC000444239916 868688949 /nfs/dbraw/zinc/68/89/49/868688949.db2.gz MTFJQSUUJLYUDW-XLIONFOSSA-N 0 3 407.514 4.429 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)[C@H]1C[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000444448130 868832114 /nfs/dbraw/zinc/83/21/14/868832114.db2.gz BJFCWMSLSVGWSV-RTWAWAEBSA-N 0 3 418.459 4.404 20 0 HIADHN Cc1ccc(C(=O)Nc2cccc(CN3CCC(O)CC3)c2)cc1Oc1ccncc1 ZINC000444453715 868833966 /nfs/dbraw/zinc/83/39/66/868833966.db2.gz JUMGBLQFRKXQEU-UHFFFAOYSA-N 0 3 417.509 4.391 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)NCc1cccc(-c2cccnc2)c1 ZINC000468314654 882240168 /nfs/dbraw/zinc/24/01/68/882240168.db2.gz DCWHAHGOMURESS-UHFFFAOYSA-N 0 3 406.505 4.161 20 0 HIADHN Cc1ccccc1[C@H](CC(F)(F)F)NC(=O)CCN1CCN(c2ccccc2)CC1 ZINC000444625134 868916267 /nfs/dbraw/zinc/91/62/67/868916267.db2.gz NPZPZWASTMGYPJ-NRFANRHFSA-N 0 3 419.491 4.317 20 0 HIADHN Cc1noc(C)c1C[C@@H](C)NC(=O)N1CCN(Cc2ccccc2)C2(CCCCC2)C1 ZINC000444705280 868966439 /nfs/dbraw/zinc/96/64/39/868966439.db2.gz MHTCLXURFLPPGM-LJQANCHMSA-N 0 3 424.589 4.453 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)N([C@H](C)c2ccc3ccccc3c2)C2CC2)CC1 ZINC000444717862 868973475 /nfs/dbraw/zinc/97/34/75/868973475.db2.gz TZRPYXDEZSLNBE-LEWJYISDSA-N 0 3 422.617 4.348 20 0 HIADHN O=C(CCN1CCC[C@H]([C@H](O)C(F)(F)F)C1)Nc1ccccc1Oc1ccccc1 ZINC000444723060 868977068 /nfs/dbraw/zinc/97/70/68/868977068.db2.gz UCEDRVKGNYUECF-KKSFZXQISA-N 0 3 422.447 4.443 20 0 HIADHN Cc1ccccc1[C@@H](CC(F)(F)F)NCCOc1cccc(S(C)(=O)=O)c1 ZINC000444777424 868998113 /nfs/dbraw/zinc/99/81/13/868998113.db2.gz FQUSGLLQFWDKAF-GOSISDBHSA-N 0 3 401.450 4.061 20 0 HIADHN COc1cc(NC(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)ccc1F ZINC000445015916 869167907 /nfs/dbraw/zinc/16/79/07/869167907.db2.gz CPTQVUMMKWKCSI-UHFFFAOYSA-N 0 3 413.415 4.449 20 0 HIADHN CCO[C@@H](CNC(=O)Nc1ccc(CCN2CCSCC2)cc1)c1ccccc1 ZINC000445243557 869299490 /nfs/dbraw/zinc/29/94/90/869299490.db2.gz XKZKFKPCVSKZKU-QFIPXVFZSA-N 0 3 413.587 4.177 20 0 HIADHN Ic1ccccc1-c1noc([C@H]2CCCN2C2CCCC2)n1 ZINC000445383736 869467885 /nfs/dbraw/zinc/46/78/85/869467885.db2.gz JWPMNXZACOSAPC-OAHLLOKOSA-N 0 3 409.271 4.421 20 0 HIADHN c1cc(CCc2noc(-c3ccc(CN4CCSCC4)cc3)n2)cc2c1OCC2 ZINC000445598672 869662783 /nfs/dbraw/zinc/66/27/83/869662783.db2.gz DHHOODPXKVNTAM-UHFFFAOYSA-N 0 3 407.539 4.006 20 0 HIADHN Cc1cccc(NC(=O)CN2CCN(CC3CCC(C(F)(F)F)CC3)CC2)c1C ZINC000468391942 882337056 /nfs/dbraw/zinc/33/70/56/882337056.db2.gz HQABWZUKOGHDIS-UHFFFAOYSA-N 0 3 411.512 4.228 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)c1c[nH]nc1-c1ccccc1Cl ZINC000445757080 869803518 /nfs/dbraw/zinc/80/35/18/869803518.db2.gz DWENZIQZQGPJNV-QGZVFWFLSA-N 0 3 400.935 4.359 20 0 HIADHN NC(=O)[C@H]1CCCC[C@H]1NCC(=O)Nc1ccccc1Sc1ccc(Cl)cc1 ZINC000445788031 869824864 /nfs/dbraw/zinc/82/48/64/869824864.db2.gz WSUOKXNIRQYMKV-DLBZAZTESA-N 0 3 417.962 4.063 20 0 HIADHN COc1ccc(NC(=O)CCN(C)[C@@H]2CCOc3ccc(Br)cc32)cc1 ZINC000445888145 869873174 /nfs/dbraw/zinc/87/31/74/869873174.db2.gz SWEFGUNALCDZGY-GOSISDBHSA-N 0 3 419.319 4.242 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)CCC(=O)c2ccc(F)c(F)c2)CCN1Cc1ccccc1 ZINC000445945499 869906781 /nfs/dbraw/zinc/90/67/81/869906781.db2.gz ZDSKXAGVNJFIRT-APWZRJJASA-N 0 3 400.469 4.097 20 0 HIADHN CCCN1CCC(N(C)C(=O)CCCC(=O)c2ccc(Br)cc2)CC1 ZINC000446108446 870055612 /nfs/dbraw/zinc/05/56/12/870055612.db2.gz NHLVXQHGRZRPDR-UHFFFAOYSA-N 0 3 409.368 4.135 20 0 HIADHN C[C@H](CSc1ccc(F)cc1)C(=O)N(C)C1CCN(CCc2ccccn2)CC1 ZINC000446131391 870076517 /nfs/dbraw/zinc/07/65/17/870076517.db2.gz OVEAHVPEPMZEPG-GOSISDBHSA-N 0 3 415.578 4.114 20 0 HIADHN Cc1c2cc(C)ccc2sc1C(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1CO ZINC000446224210 870160926 /nfs/dbraw/zinc/16/09/26/870160926.db2.gz FEGRDQHXGJDSSO-FPOVZHCZSA-N 0 3 408.567 4.131 20 0 HIADHN COc1cc(C)c(NC(=O)NCCCCN2CCN(Cc3ccccc3)CC2)cc1C ZINC000446371952 870282637 /nfs/dbraw/zinc/28/26/37/870282637.db2.gz SGSQZGHYUGIWCR-UHFFFAOYSA-N 0 3 424.589 4.032 20 0 HIADHN COc1ccccc1-c1csc([C@@H]2CCCN(C(=O)[C@H](C(C)C)N(C)C)C2)n1 ZINC000446489377 870402180 /nfs/dbraw/zinc/40/21/80/870402180.db2.gz YEERTFGCTBENHX-UZLBHIALSA-N 0 3 401.576 4.111 20 0 HIADHN COc1cccc([C@@H](CNC(=O)NCc2cccc(CSC)c2)N2CCCC2)c1 ZINC000446567161 870480461 /nfs/dbraw/zinc/48/04/61/870480461.db2.gz WIUOQWMOBRBGSZ-JOCHJYFZSA-N 0 3 413.587 4.195 20 0 HIADHN COc1ccc2c(c1)[C@@H](NCc1ccc(N3C[C@@H](C)O[C@@H](C)C3)nc1)CCCS2 ZINC000446746190 870653898 /nfs/dbraw/zinc/65/38/98/870653898.db2.gz SOBDRNJDBABYAV-FVJLSDCUSA-N 0 3 413.587 4.421 20 0 HIADHN CC(C)OC(=O)C[C@H]1CCCN(Cc2cn(-c3ccccc3)nc2-c2cccnc2)C1 ZINC000468475378 882434223 /nfs/dbraw/zinc/43/42/23/882434223.db2.gz OSWBVTBEKSGQRI-HXUWFJFHSA-N 0 3 418.541 4.488 20 0 HIADHN Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)N(CCN(C)C)Cc1ccco1 ZINC000446826825 870742758 /nfs/dbraw/zinc/74/27/58/870742758.db2.gz KXGGXBMWTNDTDI-UHFFFAOYSA-N 0 3 420.513 4.436 20 0 HIADHN Cc1nn(-c2ccc(Br)cc2)cc1CN1CCC[C@@H](c2nccn2C)C1 ZINC000446830855 870745974 /nfs/dbraw/zinc/74/59/74/870745974.db2.gz XOPCNYNULZWOJV-MRXNPFEDSA-N 0 3 414.351 4.056 20 0 HIADHN Cc1ccc([C@@H](CCn2cncn2)NCc2ccc(Br)c(F)c2)cc1 ZINC000446841928 870760059 /nfs/dbraw/zinc/76/00/59/870760059.db2.gz CANUNEJASNLPRS-LJQANCHMSA-N 0 3 403.299 4.409 20 0 HIADHN CCOC(=O)C1CCN(C(=O)C[C@H](C)N[C@H](C)c2ccc(Cl)cc2Cl)CC1 ZINC000446842406 870761572 /nfs/dbraw/zinc/76/15/72/870761572.db2.gz WJOLGLDEKCSXTI-UONOGXRCSA-N 0 3 415.361 4.224 20 0 HIADHN Cc1ccc([C@H](CCn2cncn2)NCc2ccc(C(=O)OC(C)(C)C)cc2)cc1 ZINC000446842840 870761849 /nfs/dbraw/zinc/76/18/49/870761849.db2.gz HXTRVOQDXCHAAC-QFIPXVFZSA-N 0 3 406.530 4.463 20 0 HIADHN CCOC(=O)C1CCN(C(=O)C[C@H](C)N[C@@H](C)c2ccc(Cl)cc2Cl)CC1 ZINC000446849170 870769171 /nfs/dbraw/zinc/76/91/71/870769171.db2.gz WJOLGLDEKCSXTI-KBPBESRZSA-N 0 3 415.361 4.224 20 0 HIADHN CSc1cc2c(cc1CN1CCC[C@H](c3nc(C(F)(F)F)c[nH]3)C1)OCCO2 ZINC000446852217 870772737 /nfs/dbraw/zinc/77/27/37/870772737.db2.gz IBLRESHVFVAKPC-LBPRGKRZSA-N 0 3 413.465 4.301 20 0 HIADHN COc1ccc(NC(=O)N(CCN(C)C)Cc2ccco2)cc1Cc1ccccc1 ZINC000446907591 870825414 /nfs/dbraw/zinc/82/54/14/870825414.db2.gz FMOBLPWYUWJMGY-UHFFFAOYSA-N 0 3 407.514 4.475 20 0 HIADHN CC[C@@H](C)C(=O)Nc1cccc(CN[C@H](CCn2cncn2)c2ccc(C)cc2)c1 ZINC000446922694 870836066 /nfs/dbraw/zinc/83/60/66/870836066.db2.gz NPMJNYIPPHSOCH-AUSIDOKSSA-N 0 3 405.546 4.492 20 0 HIADHN COc1ccc([C@H](CCn2cncn2)NCc2ccc(F)cc2CSC)cc1 ZINC000446939391 870849670 /nfs/dbraw/zinc/84/96/70/870849670.db2.gz NOCBXRJRVLZQQR-NRFANRHFSA-N 0 3 400.523 4.210 20 0 HIADHN Cc1ccc(NC(=O)CCN[C@H](C)c2cccc(NC(=O)c3ccccc3)c2)nc1 ZINC000447013215 870891328 /nfs/dbraw/zinc/89/13/28/870891328.db2.gz LCQXYTRJWNHDMG-GOSISDBHSA-N 0 3 402.498 4.322 20 0 HIADHN COCCO[C@H]1C[C@H](CO)CN(Cc2ccc(-c3cccc(Cl)c3Cl)o2)C1 ZINC000447078514 870965129 /nfs/dbraw/zinc/96/51/29/870965129.db2.gz PSLASCPVKLQFND-HOCLYGCPSA-N 0 3 414.329 4.099 20 0 HIADHN COC(=O)[C@](C)(CNCc1ccccc1OCc1ccccn1)c1ccc(F)cc1 ZINC000447085238 870975819 /nfs/dbraw/zinc/97/58/19/870975819.db2.gz HQLJHRNXJWSNDE-XMMPIXPASA-N 0 3 408.473 4.020 20 0 HIADHN COc1ccccc1-c1csc([C@@H]2CCCN(C(=O)CN3[C@@H](C)CC[C@@H]3C)C2)n1 ZINC000447149960 871049163 /nfs/dbraw/zinc/04/91/63/871049163.db2.gz COMKMXRSKGTPAG-OKZBNKHCSA-N 0 3 413.587 4.398 20 0 HIADHN C[C@H](NC(=O)N(Cc1ccco1)C1CCN(C)CC1)c1cccc(N2CCCC2)c1 ZINC000447227716 871113959 /nfs/dbraw/zinc/11/39/59/871113959.db2.gz BCSHXVXVEXECBN-IBGZPJMESA-N 0 3 410.562 4.247 20 0 HIADHN C[C@@H](NC(=O)N(Cc1ccco1)C1CCN(C)CC1)c1cccc(N2CCCC2)c1 ZINC000447227717 871114393 /nfs/dbraw/zinc/11/43/93/871114393.db2.gz BCSHXVXVEXECBN-LJQANCHMSA-N 0 3 410.562 4.247 20 0 HIADHN C[C@@H](c1nc(Cc2ccc(F)cc2)no1)N1CC[C@H](C)N(Cc2ccccc2)CC1 ZINC000447344804 871246816 /nfs/dbraw/zinc/24/68/16/871246816.db2.gz DERZBDMGOZXVSF-OALUTQOASA-N 0 3 408.521 4.457 20 0 HIADHN O=C(c1c(F)ccc(Br)c1F)N1C[C@@H]2CCCN2Cc2ccccc21 ZINC000447375630 871282583 /nfs/dbraw/zinc/28/25/83/871282583.db2.gz QMFXKXDGSPOUSC-ZDUSSCGKSA-N 0 3 407.258 4.352 20 0 HIADHN CN(Cc1cc(C(C)(C)C)[nH]n1)C[C@H](O)COC(c1ccccc1)c1ccccc1 ZINC000447404500 871314464 /nfs/dbraw/zinc/31/44/64/871314464.db2.gz KAUIGVXRJBPPKZ-QFIPXVFZSA-N 0 3 407.558 4.306 20 0 HIADHN CN1CCC(n2ccc(N[C@@H](C(=O)c3c[nH]c4ccccc34)c3ccccc3)n2)CC1 ZINC000447412903 871321096 /nfs/dbraw/zinc/32/10/96/871321096.db2.gz JKSBGZUVFYOJON-XMMPIXPASA-N 0 3 413.525 4.667 20 0 HIADHN CN1CCC2(CCN(Cc3c(-c4ccc(Cl)cc4)nc4sccn34)CC2)C1=O ZINC000447430871 871333888 /nfs/dbraw/zinc/33/38/88/871333888.db2.gz JPKZSPFRLNTVQP-UHFFFAOYSA-N 0 3 414.962 4.161 20 0 HIADHN Cc1ccc(C(=O)NC2CCN(CCOc3ccc(F)cc3)CC2)c(F)c1Cl ZINC000447505228 871380625 /nfs/dbraw/zinc/38/06/25/871380625.db2.gz CFZWVDIMJFWBSD-UHFFFAOYSA-N 0 3 408.876 4.200 20 0 HIADHN O[C@@H](CN[C@H](c1ccc(Br)cc1C(F)(F)F)C1CC1)C(F)(F)F ZINC000447528368 871393502 /nfs/dbraw/zinc/39/35/02/871393502.db2.gz IYVITORKUOBNOW-RYUDHWBXSA-N 0 3 406.164 4.432 20 0 HIADHN CC(=O)c1cc(C(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)ccc1C ZINC000447552136 871431042 /nfs/dbraw/zinc/43/10/42/871431042.db2.gz MKYNRWUGZAXPHK-OAQYLSRUSA-N 0 3 402.498 4.093 20 0 HIADHN CSc1cccc([C@@H](NCC2(N3CCOCC3)CC2)c2ccc(F)c(F)c2)c1 ZINC000447598445 871503225 /nfs/dbraw/zinc/50/32/25/871503225.db2.gz HKBNRPOWOVCWIR-OAQYLSRUSA-N 0 3 404.526 4.231 20 0 HIADHN CC(C)[C@H]1C[C@@H](NCc2ccc(N3CCCS3(=O)=O)c(F)c2)c2ccccc21 ZINC000447608827 871515713 /nfs/dbraw/zinc/51/57/13/871515713.db2.gz WKKCUIQPOKIMFU-TZIWHRDSSA-N 0 3 402.535 4.340 20 0 HIADHN COc1ccc(Cn2nc(C)c(CN3CC[C@@H](COc4ccccc4)C3)c2C)cc1 ZINC000468519226 882527315 /nfs/dbraw/zinc/52/73/15/882527315.db2.gz ZMUDIHSFGZUTLY-JOCHJYFZSA-N 0 3 405.542 4.458 20 0 HIADHN O=C(NC[C@H]1CCCN(c2ccccc2)C1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000447735228 871686515 /nfs/dbraw/zinc/68/65/15/871686515.db2.gz CGYBEVJWVHCRMI-YADHBBJMSA-N 0 3 409.549 4.071 20 0 HIADHN CCOCCCNC(=O)C1CCN(Cc2ccc(Oc3cccc(F)c3)cc2)CC1 ZINC000447794361 871731464 /nfs/dbraw/zinc/73/14/64/871731464.db2.gz DEXZQJQEQFAZJB-UHFFFAOYSA-N 0 3 414.521 4.373 20 0 HIADHN C[C@H](N[C@@H](C[C@H]1CCOC1)c1ccccc1)C(=O)Nc1ccc(OC(F)F)cc1 ZINC000447885923 871800958 /nfs/dbraw/zinc/80/09/58/871800958.db2.gz LQRLWXZXGZLILI-YRNRMSPPSA-N 0 3 404.457 4.373 20 0 HIADHN C[C@@H]1CCC[C@@H](C)N(CC(=O)N(Cc2nnc(-c3ccccc3Cl)o2)C2CC2)C1 ZINC000448023163 871865417 /nfs/dbraw/zinc/86/54/17/871865417.db2.gz RXOMYFOHQIURFB-HZPDHXFCSA-N 0 3 416.953 4.392 20 0 HIADHN CN1CCCC(C)(C)[C@H]1CNC(=O)N1CCC[C@H](c2nc(C(F)(F)F)cs2)C1 ZINC000448028221 871867390 /nfs/dbraw/zinc/86/73/90/871867390.db2.gz CNKJUVKWCFITJA-DZGCQCFKSA-N 0 3 418.529 4.171 20 0 HIADHN CO[C@H]1CCOc2c(NC(=O)N3CCCN(Cc4ccccc4)C[C@@H]3C)cccc21 ZINC000448040940 871873715 /nfs/dbraw/zinc/87/37/15/871873715.db2.gz ZEZLIOMTEACODO-AVRDEDQJSA-N 0 3 409.530 4.285 20 0 HIADHN CC1CCN([C@H](CNC(=O)Nc2cccc(N3CCC3=O)c2)c2cccs2)CC1 ZINC000448056019 871885228 /nfs/dbraw/zinc/88/52/28/871885228.db2.gz KRQZNJOTLKSZMZ-LJQANCHMSA-N 0 3 412.559 4.080 20 0 HIADHN CCOc1cc(CN2CCSC(CC)(CC)C2)ccc1O[C@H](C)C(=O)N(C)C ZINC000468541135 882578808 /nfs/dbraw/zinc/57/88/08/882578808.db2.gz JWWUVSSYATZTSI-QGZVFWFLSA-N 0 3 408.608 4.048 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)c1ccc2cc(Br)ccc2c1 ZINC000448246928 872164648 /nfs/dbraw/zinc/16/46/48/872164648.db2.gz HDICTGWQXNYNDK-UHFFFAOYSA-N 0 3 412.331 4.201 20 0 HIADHN Cc1nn(C)c2ncc(CN3CCC[C@H](Nc4cccc(Br)c4)C3)cc12 ZINC000448371995 872322238 /nfs/dbraw/zinc/32/22/38/872322238.db2.gz FWPRPKXCQWFBQS-SFHVURJKSA-N 0 3 414.351 4.116 20 0 HIADHN CC(=O)Nc1ccccc1CN1CCC[C@@H](Nc2cccc(Br)c2)C1 ZINC000448375675 872325117 /nfs/dbraw/zinc/32/51/17/872325117.db2.gz NGSWQERKTYGZDB-LJQANCHMSA-N 0 3 402.336 4.484 20 0 HIADHN C[C@@H](CC1CC1)NC(=O)N(Cc1ccccc1Br)C1CCN(C)CC1 ZINC000460240149 872828168 /nfs/dbraw/zinc/82/81/68/872828168.db2.gz RPPKNMYQZDHDNP-HNNXBMFYSA-N 0 3 408.384 4.244 20 0 HIADHN COc1ccccc1-n1c2ccccc2nc1NC(=O)c1ccc(CN(C)C)cc1 ZINC000460397960 873048122 /nfs/dbraw/zinc/04/81/22/873048122.db2.gz HAGNYFBZBOSMMK-UHFFFAOYSA-N 0 3 400.482 4.348 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)NC(=O)N[C@H](C)CN(C)Cc2ccccc2)cc1 ZINC000460476025 873161749 /nfs/dbraw/zinc/16/17/49/873161749.db2.gz MPTVKHCFUHMXBI-RTBURBONSA-N 0 3 405.546 4.061 20 0 HIADHN CCCN(CCN1CCN(CC)CC1)C(=O)N[C@@H](c1ccccc1C)C(C)(C)C ZINC000460487748 873174253 /nfs/dbraw/zinc/17/42/53/873174253.db2.gz ILVGCKRGJCINGG-QFIPXVFZSA-N 0 3 402.627 4.141 20 0 HIADHN CCN1C[C@H](C)N(c2nnc(CSc3ccccc3OC)n2CC(C)C)C[C@H]1C ZINC000460596169 873336776 /nfs/dbraw/zinc/33/67/76/873336776.db2.gz HOOXLOUFMYDWRT-MSOLQXFVSA-N 0 3 417.623 4.154 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)N1CCCC[C@@H]1c1nnc(C2CCC2)o1 ZINC000460648654 873389578 /nfs/dbraw/zinc/38/95/78/873389578.db2.gz MBJXPPMDQFGKLH-YLJYHZDGSA-N 0 3 411.550 4.094 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N[C@@H](c1ccc(F)cc1F)C(C)(C)C ZINC000468614314 882727079 /nfs/dbraw/zinc/72/70/79/882727079.db2.gz YINQYCNHEFGJQH-FQEVSTJZSA-N 0 3 417.500 4.177 20 0 HIADHN CCOCCCn1c(-c2ccoc2)nnc1N1C[C@@H](C)N(Cc2ccccc2)C[C@@H]1C ZINC000460720811 873519915 /nfs/dbraw/zinc/51/99/15/873519915.db2.gz CSWFQEZJSZAQLN-UXHICEINSA-N 0 3 423.561 4.064 20 0 HIADHN O=C(N[C@H](CN1CCCC1)c1ccccc1)c1ccc(OCc2ccccn2)cc1 ZINC000460755870 873595629 /nfs/dbraw/zinc/59/56/29/873595629.db2.gz FTIAJVWANDDFAG-XMMPIXPASA-N 0 3 401.510 4.228 20 0 HIADHN COc1cccc([C@H](CNC(=O)c2c[nH]cc2-c2ccc(F)cc2)N2CCCC2)c1 ZINC000460816845 873698707 /nfs/dbraw/zinc/69/87/07/873698707.db2.gz XJAOMJSKUUUONH-QHCPKHFHSA-N 0 3 407.489 4.396 20 0 HIADHN COc1ccc2sc(C(=O)N(C)C3CCN(CCc4ccccn4)CC3)c(C)c2c1 ZINC000460891312 873802366 /nfs/dbraw/zinc/80/23/66/873802366.db2.gz XNPCGPWTGQGQRC-UHFFFAOYSA-N 0 3 423.582 4.392 20 0 HIADHN CCCc1ncc(C(=O)NC2CCN(CCOc3ccc(Cl)cc3)CC2)s1 ZINC000461066007 873949067 /nfs/dbraw/zinc/94/90/67/873949067.db2.gz YVKPCHKGBXAGIH-UHFFFAOYSA-N 0 3 407.967 4.022 20 0 HIADHN O=S1(=O)CCCN1c1ccc(CN[C@H](c2ccccc2F)C2CCCC2)cc1 ZINC000461084421 873995588 /nfs/dbraw/zinc/99/55/88/873995588.db2.gz GDWMHBVJQIZNHB-QFIPXVFZSA-N 0 3 402.535 4.387 20 0 HIADHN Cc1nc(C(C)(C)C)sc1[C@H](C)NCc1ccc(N2CCCS2(=O)=O)cc1 ZINC000461096131 874011223 /nfs/dbraw/zinc/01/12/23/874011223.db2.gz YJEUUYRZJYBRPJ-AWEZNQCLSA-N 0 3 407.605 4.140 20 0 HIADHN COCCN1CCC[C@@H]1CNC(=O)C1(c2cccc(C(F)(F)F)c2)CCCCC1 ZINC000461108540 874031269 /nfs/dbraw/zinc/03/12/69/874031269.db2.gz NEJZNVFCWGLMMK-LJQANCHMSA-N 0 3 412.496 4.134 20 0 HIADHN C[C@H](NC(=O)N1CCCC[C@H]1c1nnc(C2CCC2)o1)[C@H](c1ccccc1)N(C)C ZINC000461208433 874210302 /nfs/dbraw/zinc/21/03/02/874210302.db2.gz JRYQVIUTHVNIIR-FFZOFVMBSA-N 0 3 411.550 4.265 20 0 HIADHN CCCN(C(=O)CCN1CCN(c2ccccc2)CC1)[C@@H](C)c1ccccc1OC ZINC000468677776 882805528 /nfs/dbraw/zinc/80/55/28/882805528.db2.gz RDTJUCBGEHZKBB-NRFANRHFSA-N 0 3 409.574 4.207 20 0 HIADHN Cc1ccccc1[C@@H]1CN(C(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)[C@H](C)CO1 ZINC000461251393 874255234 /nfs/dbraw/zinc/25/52/34/874255234.db2.gz CXDWFKHYYLXVOL-IZIIKQMZSA-N 0 3 410.533 4.335 20 0 HIADHN C[C@H]1C[C@@H](c2cccc(F)c2)N(C(=O)CCCN2CCN(c3ccccc3)CC2)C1 ZINC000461320680 874329386 /nfs/dbraw/zinc/32/93/86/874329386.db2.gz YQTARLUUGASOGJ-RDPSFJRHSA-N 0 3 409.549 4.338 20 0 HIADHN C[C@@H]1CC[C@@H](C)N1CC(=O)Nc1ccc(=O)n(Cc2ccc(Cl)c(Cl)c2)c1 ZINC000468716246 882826180 /nfs/dbraw/zinc/82/61/80/882826180.db2.gz ODBTUJKBAYKAQV-ZIAGYGMSSA-N 0 3 408.329 4.015 20 0 HIADHN C[C@@H]1CC[C@H](C)N1CC(=O)Nc1ccc(CN2C(=O)Cc3ccc(Cl)cc32)cc1 ZINC000468719078 882828334 /nfs/dbraw/zinc/82/83/34/882828334.db2.gz GWGAADYCYJYDOM-IYBDPMFKSA-N 0 3 411.933 4.241 20 0 HIADHN CCN1CCN(CCC(=O)NC(CC)(CC)c2ccc(Cl)c(Cl)c2)CC1 ZINC000468752173 882842766 /nfs/dbraw/zinc/84/27/66/882842766.db2.gz ADLPDFPBSHVBIQ-UHFFFAOYSA-N 0 3 400.394 4.153 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)c1cc(-c2cnn(C)c2)ccc1F ZINC000468759978 882846800 /nfs/dbraw/zinc/84/68/00/882846800.db2.gz AHOQUPUGBUDZBR-QHCPKHFHSA-N 0 3 408.521 4.113 20 0 HIADHN CCCN(C(=O)NCC[C@@H](OC)C(F)(F)F)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000468768620 882851304 /nfs/dbraw/zinc/85/13/04/882851304.db2.gz APZXKUJGPLKQEQ-RBUKOAKNSA-N 0 3 415.500 4.040 20 0 HIADHN CCOC(=O)[C@](C)(CN[C@@H](C)C(=O)Nc1ccccc1C(F)(F)F)c1ccccc1 ZINC000468774008 882853971 /nfs/dbraw/zinc/85/39/71/882853971.db2.gz ASJYCMLXWFZJIP-YCRPNKLZSA-N 0 3 422.447 4.143 20 0 HIADHN Cc1c([C@@H](C)NCc2cc(C(F)(F)F)ccc2N2CCN(C)CC2)cnn1C(C)C ZINC000468784284 882858430 /nfs/dbraw/zinc/85/84/30/882858430.db2.gz BKFIHHUHVIVSJS-MRXNPFEDSA-N 0 3 423.527 4.394 20 0 HIADHN CC(C)(C)OC1CCN(C(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)CC1 ZINC000468787608 882859855 /nfs/dbraw/zinc/85/98/55/882859855.db2.gz BMBKTYXIRRICSH-OAQYLSRUSA-N 0 3 412.496 4.247 20 0 HIADHN CCc1ccc(CN2CCN(C(=O)c3oc4ccccc4c3CN(C)C)CC2)s1 ZINC000468795081 882863028 /nfs/dbraw/zinc/86/30/28/882863028.db2.gz CPFKGSUGZOQIHB-UHFFFAOYSA-N 0 3 411.571 4.076 20 0 HIADHN COCCOCc1ccc(C(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)cc1 ZINC000461738134 874883001 /nfs/dbraw/zinc/88/30/01/874883001.db2.gz ROGCUTKPNXSFCA-OAQYLSRUSA-N 0 3 416.587 4.114 20 0 HIADHN CC(C)c1nnc(N2C[C@H](C)N(Cc3ccccc3)C[C@@H]2C)n1C[C@H]1CCCCO1 ZINC000461874942 875028516 /nfs/dbraw/zinc/02/85/16/875028516.db2.gz MBZSREWPJGZTMP-JAXLGGSGSA-N 0 3 411.594 4.070 20 0 HIADHN O=C(CCN1CCN(c2ccccc2)CC1)Nc1ccc(Oc2ccncc2)cc1 ZINC000461981489 875101414 /nfs/dbraw/zinc/10/14/14/875101414.db2.gz GMSUTJXXAGCIKN-UHFFFAOYSA-N 0 3 402.498 4.025 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N[C@H]2CCCc3cn(C4CCCC4)nc32)N(C)C)cc1 ZINC000462007782 875128262 /nfs/dbraw/zinc/12/82/62/875128262.db2.gz NGAUCWYAMDKWCP-FCHUYYIVSA-N 0 3 409.578 4.286 20 0 HIADHN COc1ccc([C@@H](CNC(=O)CN2[C@H](C)CC[C@@H]2C)c2c[nH]c3ccccc32)cc1 ZINC000462042503 875154470 /nfs/dbraw/zinc/15/44/70/875154470.db2.gz ZYIBSHHTPBDOFX-KGVIQGDOSA-N 0 3 405.542 4.297 20 0 HIADHN C[C@@H]1CCCN(c2cc(C(=O)N3CCCN(Cc4ccccc4)C[C@@H]3C)ccn2)C1 ZINC000462153901 875249591 /nfs/dbraw/zinc/24/95/91/875249591.db2.gz YKYHXFAQQIOAHR-RTWAWAEBSA-N 0 3 406.574 4.055 20 0 HIADHN C[C@H](NC(=O)N(CCN(C)C)Cc1ccco1)c1ccc(Br)cc1F ZINC000462163649 875258808 /nfs/dbraw/zinc/25/88/08/875258808.db2.gz WROBFUUEHNBFMU-ZDUSSCGKSA-N 0 3 412.303 4.016 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1ccccc1-c1nc(C(C)(C)C)no1 ZINC000462182544 875283603 /nfs/dbraw/zinc/28/36/03/875283603.db2.gz PPXUJUQJOSTYRW-UTKZUKDTSA-N 0 3 418.541 4.284 20 0 HIADHN CN(C(=O)NC[C@H](Cc1ccccc1)C(F)(F)F)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000462223614 875332146 /nfs/dbraw/zinc/33/21/46/875332146.db2.gz IULCTKFOOWWVAR-LEWJYISDSA-N 0 3 419.491 4.324 20 0 HIADHN Cc1cc(Oc2ncccn2)ccc1NC(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C ZINC000462250436 875369923 /nfs/dbraw/zinc/36/99/23/875369923.db2.gz ZDWVCLSHVLLVRW-XMSQKQJNSA-N 0 3 417.513 4.219 20 0 HIADHN CCC(=O)Nc1ccc(Cl)c(NC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)c1 ZINC000462254348 875377139 /nfs/dbraw/zinc/37/71/39/875377139.db2.gz JBVVRDHDIQQWCF-FOIQADDNSA-N 0 3 414.937 4.331 20 0 HIADHN CC(C)[C@@H](Oc1ccc(Cl)cc1)C(=O)NC1CCN([C@H](C)c2ccncc2)CC1 ZINC000462256922 875380621 /nfs/dbraw/zinc/38/06/21/875380621.db2.gz UTRVDGNUKLUBLP-VGOFRKELSA-N 0 3 415.965 4.480 20 0 HIADHN CC(C)n1cnnc1-c1ccccc1NC(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C ZINC000462266578 875392172 /nfs/dbraw/zinc/39/21/72/875392172.db2.gz FWURUVDWGDMFNQ-AVRDEDQJSA-N 0 3 418.545 4.168 20 0 HIADHN CC(C)n1cnnc1-c1ccccc1NC(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C ZINC000462266581 875392324 /nfs/dbraw/zinc/39/23/24/875392324.db2.gz FWURUVDWGDMFNQ-XMSQKQJNSA-N 0 3 418.545 4.168 20 0 HIADHN Cc1cc(N2CCSCC2)ccc1NC(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C ZINC000462271189 875397520 /nfs/dbraw/zinc/39/75/20/875397520.db2.gz WNGSMYGNEXYASQ-CVDCTZTESA-N 0 3 424.614 4.190 20 0 HIADHN CC(C)(C)[C@H](Cc1ccccc1C(F)(F)F)NC(=O)N1CC[C@H](N2CC=CC2)C1 ZINC000462305813 875426158 /nfs/dbraw/zinc/42/61/58/875426158.db2.gz MZEXWVQPKHPDAZ-HKUYNNGSSA-N 0 3 409.496 4.318 20 0 HIADHN COc1ccc([C@@H](Cc2ccccc2)NC(=O)N(CCN(C)C)Cc2ccco2)cc1 ZINC000462346134 875459918 /nfs/dbraw/zinc/45/99/18/875459918.db2.gz CKUSFLFOLZXFKF-XMMPIXPASA-N 0 3 421.541 4.345 20 0 HIADHN COc1ccc2cc([C@H](C)NCc3cccc(N4CCCS4(=O)=O)c3)ccc2c1 ZINC000462356207 875470393 /nfs/dbraw/zinc/47/03/93/875470393.db2.gz JPULVHRGCFKVMZ-KRWDZBQOSA-N 0 3 410.539 4.239 20 0 HIADHN CCOC(=O)C1CCN(C(=O)[C@@H](C)N[C@H](C)c2ccc(Cl)c3ccccc32)CC1 ZINC000462358420 875471476 /nfs/dbraw/zinc/47/14/76/875471476.db2.gz OZBMTCPDRQRIPL-HZPDHXFCSA-N 0 3 416.949 4.334 20 0 HIADHN O=C(N[C@@H]1CCOc2c(F)ccc(F)c21)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000462402526 875510071 /nfs/dbraw/zinc/51/00/71/875510071.db2.gz ODIGQHKIYMKHDB-CRAIPNDOSA-N 0 3 422.422 4.062 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)CCc1cncc2ccccc21)c1cccc(OC)c1 ZINC000462428822 875535090 /nfs/dbraw/zinc/53/50/90/875535090.db2.gz OQSIISRHJGQNOA-DEOSSOPVSA-N 0 3 405.542 4.375 20 0 HIADHN COC(=O)[C@](C)(CN[C@@H](C)C(=O)Nc1cccc(Cl)c1Cl)c1ccccc1 ZINC000468898499 882946707 /nfs/dbraw/zinc/94/67/07/882946707.db2.gz HXXRJIVQYZTUTQ-RNODOKPDSA-N 0 3 409.313 4.041 20 0 HIADHN CCOC(=O)c1csc(CCN[C@@H](C)c2cnn(-c3cc(C)ccc3C)c2C)n1 ZINC000468897578 882947094 /nfs/dbraw/zinc/94/70/94/882947094.db2.gz JTCJYWPXMRSDLE-INIZCTEOSA-N 0 3 412.559 4.324 20 0 HIADHN Cc1ccc(-c2cccc(CNCc3cccc(N4CCCS4(=O)=O)c3)c2)cc1 ZINC000462553149 875677803 /nfs/dbraw/zinc/67/78/03/875677803.db2.gz RPYDRJHFUKOANC-UHFFFAOYSA-N 0 3 406.551 4.492 20 0 HIADHN CCOC(=O)[C@@](C)(CN[C@H](C)C(=O)Nc1cccc(Cl)c1C)c1ccccc1 ZINC000468903666 882956887 /nfs/dbraw/zinc/95/68/87/882956887.db2.gz HRDMVWUBYWYXGT-ZHRRBRCNSA-N 0 3 402.922 4.086 20 0 HIADHN Cc1cc(NC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)ccc1OC1CCOCC1 ZINC000462671291 875769248 /nfs/dbraw/zinc/76/92/48/875769248.db2.gz BJMFMHKPAUDOSO-AUSIDOKSSA-N 0 3 423.557 4.195 20 0 HIADHN CS(=O)(=O)c1cccc([C@H](NCCc2ccc(F)c(F)c2)c2ccccc2)c1 ZINC000468908581 882964565 /nfs/dbraw/zinc/96/45/65/882964565.db2.gz JFKADQQDKWRKAG-JOCHJYFZSA-N 0 3 401.478 4.290 20 0 HIADHN COC(=O)c1cc(CN[C@@H]2c3cc(Br)ccc3SC[C@H]2C)n(C)c1C ZINC000462784320 875838807 /nfs/dbraw/zinc/83/88/07/875838807.db2.gz DJPKCNLIHXTCOE-ZMZPIMSZSA-N 0 3 423.376 4.455 20 0 HIADHN CCc1ccc([C@@H](NC[C@@](C)(OC)C2CC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000462811505 875854834 /nfs/dbraw/zinc/85/48/34/875854834.db2.gz XCSGPOLZLNTBDH-DHIUTWEWSA-N 0 3 401.572 4.147 20 0 HIADHN Cc1noc(C)c1COc1ccccc1C(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C ZINC000462812405 875855892 /nfs/dbraw/zinc/85/58/92/875855892.db2.gz NLTRRXCTDXCXPN-SBUREZEXSA-N 0 3 419.525 4.121 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@H](C)N[C@H]2CCCc3ccc(O)cc32)cc1 ZINC000462814010 875855976 /nfs/dbraw/zinc/85/59/76/875855976.db2.gz CPPRYCKZHITUDK-AOMKIAJQSA-N 0 3 402.560 4.151 20 0 HIADHN C[C@H](NC[C@H]1C[C@@H](O)CN1Cc1ccccc1)c1csc(-c2ccccc2F)n1 ZINC000462822325 875860323 /nfs/dbraw/zinc/86/03/23/875860323.db2.gz OMQOARLTTOJHLU-QXAKKESOSA-N 0 3 411.546 4.235 20 0 HIADHN Cc1nc2ccc(Br)cc2c(N2CCn3c(nnc3C(C)C)C2)c1C ZINC000462820946 875860338 /nfs/dbraw/zinc/86/03/38/875860338.db2.gz WKPJLEGTIYLJFS-UHFFFAOYSA-N 0 3 400.324 4.349 20 0 HIADHN C[C@H](NCc1cccc(N2CCCS2(=O)=O)c1)c1ccc(-c2ccncc2)cc1 ZINC000462844237 875878878 /nfs/dbraw/zinc/87/88/78/875878878.db2.gz YBWRPWJKTSZDNG-SFHVURJKSA-N 0 3 407.539 4.139 20 0 HIADHN C[C@H](NCc1cccc(N2CCCS2(=O)=O)c1)c1cccc(-c2ccncc2)c1 ZINC000462847300 875881784 /nfs/dbraw/zinc/88/17/84/875881784.db2.gz FOZIMJKXSNYZHW-SFHVURJKSA-N 0 3 407.539 4.139 20 0 HIADHN COc1cc(CN2CC[C@H](O)C2(C)C)ccc1OCCOc1ccccc1Cl ZINC000462873501 875903795 /nfs/dbraw/zinc/90/37/95/875903795.db2.gz XUUUCYYNYQHYMS-NRFANRHFSA-N 0 3 405.922 4.152 20 0 HIADHN Cn1cc(CN(Cc2cccc(Br)c2)C2CCOCC2)c(C(F)F)n1 ZINC000462914853 875941823 /nfs/dbraw/zinc/94/18/23/875941823.db2.gz SMPCXCKVKILFCJ-UHFFFAOYSA-N 0 3 414.294 4.301 20 0 HIADHN CCN(CC)[C@H](CNC(=O)C1(C2CC2)CCOCC1)c1ccc(C(F)(F)F)cc1 ZINC000462925452 875954301 /nfs/dbraw/zinc/95/43/01/875954301.db2.gz JNCAMOFHIGWFCJ-LJQANCHMSA-N 0 3 412.496 4.411 20 0 HIADHN C[C@@H](NC(=O)C(=O)Nc1cccc(CN(C)C)c1)c1ccc(Cl)c2ccccc21 ZINC000462961427 875975504 /nfs/dbraw/zinc/97/55/04/875975504.db2.gz FHIWNXVLOYVPOE-OAHLLOKOSA-N 0 3 409.917 4.371 20 0 HIADHN CC(C)C[C@H](C)C(=O)NC1CCN(CCOc2ccc(Br)cc2)CC1 ZINC000462997375 876011502 /nfs/dbraw/zinc/01/15/02/876011502.db2.gz YUKJKDFHMHPKSM-INIZCTEOSA-N 0 3 411.384 4.091 20 0 HIADHN C[C@@H]1CCN(C(=O)N[C@@H]2CCO[C@H](c3ccccc3)C2)CCN1Cc1ccccc1 ZINC000463015039 876031989 /nfs/dbraw/zinc/03/19/89/876031989.db2.gz WWOUSPZNQRSMFM-HUVFLSCGSA-N 0 3 407.558 4.213 20 0 HIADHN O=C1C[C@@H](NCc2ccc(Br)c3cccnc23)CN1c1ccccc1F ZINC000463022916 876040799 /nfs/dbraw/zinc/04/07/99/876040799.db2.gz KNVDZEJMZRBXND-CQSZACIVSA-N 0 3 414.278 4.032 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](Nc2ccnc3ccccc32)c2ccc(F)cc2)c1 ZINC000463080740 876113175 /nfs/dbraw/zinc/11/31/75/876113175.db2.gz DZUAQHVGKGHGCK-QHCPKHFHSA-N 0 3 406.482 4.401 20 0 HIADHN CC[C@H](O[C@H]1CCC[C@@H](C)C1)C(=O)Nc1ccc(CN2CCN(CC)CC2)cc1 ZINC000463106798 876144562 /nfs/dbraw/zinc/14/45/62/876144562.db2.gz BDUFKUDOBLVEBF-OIBXWCBGSA-N 0 3 401.595 4.137 20 0 HIADHN CC[C@@H](NC1CCN(Cc2ccccc2Cl)CC1)c1nnc2n1CCCCC2 ZINC000463112947 876151933 /nfs/dbraw/zinc/15/19/33/876151933.db2.gz MYZFJZIAXQVKIH-HXUWFJFHSA-N 0 3 401.986 4.363 20 0 HIADHN CC[C@H](NC1CCN(Cc2ccc(Cl)cc2)CC1)c1nnc2n1CCCCC2 ZINC000463115009 876155008 /nfs/dbraw/zinc/15/50/08/876155008.db2.gz VUXGHSCKMRUBEY-FQEVSTJZSA-N 0 3 401.986 4.363 20 0 HIADHN O=C(CCCc1ccc([O-])c(F)c1)N1CC[C@H]2[C@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000468936114 883001081 /nfs/dbraw/zinc/00/10/81/883001081.db2.gz MFDUMEDESIBZPK-GGAORHGYSA-N 0 3 410.533 4.367 20 0 HIADHN O=C(CCCc1ccc([O-])c(F)c1)N1CC[C@H]2[C@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000468936114 883001104 /nfs/dbraw/zinc/00/11/04/883001104.db2.gz MFDUMEDESIBZPK-GGAORHGYSA-N 0 3 410.533 4.367 20 0 HIADHN COc1cccc([C@@H](CNC(=O)NCc2ccc(C(F)F)cc2)N2CCCC2)c1 ZINC000463155570 876208324 /nfs/dbraw/zinc/20/83/24/876208324.db2.gz OFCBKNZHAXAKFD-HXUWFJFHSA-N 0 3 403.473 4.269 20 0 HIADHN OC[C@]1(Cc2ccccc2)CCCN1Cc1nc2ccc(Br)cc2o1 ZINC000463203450 876264033 /nfs/dbraw/zinc/26/40/33/876264033.db2.gz OQLZJMGUQZXAAF-HXUWFJFHSA-N 0 3 401.304 4.160 20 0 HIADHN Cc1ccc(-c2nc(CCNC(=O)N[C@H]3CN(Cc4ccccc4)C[C@H]3C)co2)cc1 ZINC000463204732 876266425 /nfs/dbraw/zinc/26/64/25/876266425.db2.gz OEYCZXXOOONGEC-XXBNENTESA-N 0 3 418.541 4.012 20 0 HIADHN CCOc1ccccc1[C@H](CC)NC(=O)CN1CCCC[C@@H]1[C@@H]1CCCC[C@@H]1O ZINC000463213770 876273209 /nfs/dbraw/zinc/27/32/09/876273209.db2.gz NXVSXWYCHWEZIN-KJJMTIBFSA-N 0 3 402.579 4.058 20 0 HIADHN CCOC(=O)c1ccc2c(c1)nc(CN1CCCC[C@@H]1[C@H]1CCCC[C@@H]1O)n2CC ZINC000463218324 876276009 /nfs/dbraw/zinc/27/60/09/876276009.db2.gz JUZMBDMVSMMMDO-UZKOGDIHSA-N 0 3 413.562 4.139 20 0 HIADHN COC(=O)c1ccccc1CC1CCN(Cc2cnc3c(cnn3C(C)C)c2)CC1 ZINC000463226644 876284296 /nfs/dbraw/zinc/28/42/96/876284296.db2.gz LPXLIIXPOGRGDN-UHFFFAOYSA-N 0 3 406.530 4.254 20 0 HIADHN C[C@@H]1CCCc2ccccc2[C@H]1NC(=O)N(C)C1CCN(CCc2ccccn2)CC1 ZINC000463268420 876325942 /nfs/dbraw/zinc/32/59/42/876325942.db2.gz RSXNKFXKIZVURR-NLFFAJNJSA-N 0 3 420.601 4.444 20 0 HIADHN COc1ccc(NC(=O)[C@H](C)N2[C@@H](C)CC[C@@H]2C)cc1OCc1cn2ccccc2n1 ZINC000463332605 876387980 /nfs/dbraw/zinc/38/79/80/876387980.db2.gz BTIULTGJPVQSST-BZSNNMDCSA-N 0 3 422.529 4.122 20 0 HIADHN COc1ccc(NC(=O)[C@@H](C)N2[C@H](C)CC[C@@H]2C)cc1OCc1cn2ccccc2n1 ZINC000463332606 876388207 /nfs/dbraw/zinc/38/82/07/876388207.db2.gz BTIULTGJPVQSST-FGTMMUONSA-N 0 3 422.529 4.122 20 0 HIADHN CN(CCc1cccc(Br)c1)C(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000463401316 876456635 /nfs/dbraw/zinc/45/66/35/876456635.db2.gz CESRLUUZLQHXEY-VQTJNVASSA-N 0 3 416.363 4.078 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)c1cccc(-c2noc(C3CC3)n2)c1 ZINC000463431150 876487994 /nfs/dbraw/zinc/48/79/94/876487994.db2.gz POCLZWKNPFOMOO-OAQYLSRUSA-N 0 3 402.498 4.181 20 0 HIADHN OC[C@]1(Cc2ccccc2)CCCN(C[C@@H](O)COc2cc(Cl)ccc2Cl)C1 ZINC000463453894 876514389 /nfs/dbraw/zinc/51/43/89/876514389.db2.gz WDLOTOXYJHQNPI-KNQAVFIVSA-N 0 3 424.368 4.050 20 0 HIADHN COc1ccc(-c2ncc(C(=O)N(CCN(C)C)Cc3ccc(F)cc3)s2)cc1 ZINC000463512544 876575465 /nfs/dbraw/zinc/57/54/65/876575465.db2.gz GMVIRJKNBDMZMX-UHFFFAOYSA-N 0 3 413.518 4.162 20 0 HIADHN COc1c(Br)c(C)sc1C(=O)NC[C@@H](c1ccc(C)cc1)N(C)C ZINC000463513445 876576901 /nfs/dbraw/zinc/57/69/01/876576901.db2.gz NCHHJPMWJYKSRS-AWEZNQCLSA-N 0 3 411.365 4.169 20 0 HIADHN CCOC(=O)c1csc(CCN[C@@H](C)c2ccc(Br)cc2F)n1 ZINC000468984296 883049841 /nfs/dbraw/zinc/04/98/41/883049841.db2.gz PUKRXCHHRDCHPP-JTQLQIEISA-N 0 3 401.301 4.115 20 0 HIADHN C[C@@H](C(=O)N(CCCn1ccnc1)Cc1c(F)cccc1Cl)N1CCCCCC1 ZINC000468987663 883054054 /nfs/dbraw/zinc/05/40/54/883054054.db2.gz NEGCQPZZRAPZOV-SFHVURJKSA-N 0 3 420.960 4.359 20 0 HIADHN CCN(CC)[C@H](CNC(=O)CCC1CCOCC1)c1ccc(C(F)(F)F)cc1 ZINC000463664478 876786312 /nfs/dbraw/zinc/78/63/12/876786312.db2.gz NNEDOFUDELTHEV-LJQANCHMSA-N 0 3 400.485 4.411 20 0 HIADHN CSc1cccc(N(C(=O)c2cnn(C(C)(C)C)c2C)C2CCN(C)CC2)c1 ZINC000463805647 876922509 /nfs/dbraw/zinc/92/25/09/876922509.db2.gz ACLKOLHJXKXSST-UHFFFAOYSA-N 0 3 400.592 4.409 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)C(=O)Nc1cccc(C2CCC2)c1 ZINC000463812273 876927910 /nfs/dbraw/zinc/92/79/10/876927910.db2.gz PTMPJNPSHQKBJM-UHFFFAOYSA-N 0 3 423.582 4.123 20 0 HIADHN CSCc1cccnc1C(=O)N(CCN1CCCC1)Cc1ccc(Cl)cc1 ZINC000463816656 876930523 /nfs/dbraw/zinc/93/05/23/876930523.db2.gz IPOACDOAMNLWKZ-UHFFFAOYSA-N 0 3 403.979 4.336 20 0 HIADHN CC(C)c1nn(C)c2sc(C(=O)N(Cc3ccco3)C3CCN(C)CC3)cc12 ZINC000463830508 876948460 /nfs/dbraw/zinc/94/84/60/876948460.db2.gz ZTQLGDYFGVOODP-UHFFFAOYSA-N 0 3 400.548 4.088 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCCC1)c1cccc(-c2cscn2)c1 ZINC000463835459 876955797 /nfs/dbraw/zinc/95/57/97/876955797.db2.gz OHTHJQXWDUVQGY-UHFFFAOYSA-N 0 3 401.601 4.292 20 0 HIADHN Cc1cc(N2CC[C@@H](N[C@@H](CCCc3ccccc3)c3ccccc3)C2=O)n(C)n1 ZINC000463898737 877021228 /nfs/dbraw/zinc/02/12/28/877021228.db2.gz UEWLXYNCBZWMRG-XZOQPEGZSA-N 0 3 402.542 4.188 20 0 HIADHN CCOC(=O)C1CCN(C(=O)[C@H](C)N[C@H](CC(C)(C)C)c2ccc(F)cc2)CC1 ZINC000463910212 877031280 /nfs/dbraw/zinc/03/12/80/877031280.db2.gz ISWWRVJHUABQQA-OXJNMPFZSA-N 0 3 406.542 4.083 20 0 HIADHN O=C(NCCN1CCCCC1)NCc1csc(-c2ccc(C(F)(F)F)cc2)n1 ZINC000463959718 877083573 /nfs/dbraw/zinc/08/35/73/877083573.db2.gz SEVJSZFQHMVFQZ-UHFFFAOYSA-N 0 3 412.481 4.114 20 0 HIADHN O=C(NCc1cccc(-c2cccnc2)c1)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000464154025 877324505 /nfs/dbraw/zinc/32/45/05/877324505.db2.gz TUJXKFIASUPXIE-DEOSSOPVSA-N 0 3 400.526 4.385 20 0 HIADHN CCN(C[C@@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)c1c(F)cccc1Cl ZINC000464211441 877381577 /nfs/dbraw/zinc/38/15/77/877381577.db2.gz IADAURDFSGXOJL-QGZVFWFLSA-N 0 3 410.942 4.012 20 0 HIADHN C[C@H](NC(=O)N[C@H]1CCCc2sc(-c3ccc(F)cc3)nc21)C1=CCN(C)CC1 ZINC000464308135 877498986 /nfs/dbraw/zinc/49/89/86/877498986.db2.gz OQHUHCCPOJTXCC-KSSFIOAISA-N 0 3 414.550 4.276 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N3CC[C@@H](CSc4ccccc4)C3)cc2)CC1 ZINC000464332735 877522841 /nfs/dbraw/zinc/52/28/41/877522841.db2.gz HGFDLOIDFKKPPH-OAQYLSRUSA-N 0 3 423.626 4.471 20 0 HIADHN CN1CCC[C@@H](CNC(=O)c2ccn(-c3ccc(F)cc3F)n2)[C@@H]1c1cccs1 ZINC000464338396 877529507 /nfs/dbraw/zinc/52/95/07/877529507.db2.gz FVFWONTVZYAUEU-VBKZILBWSA-N 0 3 416.497 4.025 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N(C)CCc1cccc(Br)c1)c1ccco1 ZINC000464392257 877593591 /nfs/dbraw/zinc/59/35/91/877593591.db2.gz HIIYYZSZLOISOV-MAUKXSAKSA-N 0 3 422.367 4.355 20 0 HIADHN O=c1ccccn1C[C@H](NCCOc1ccccc1Br)c1ccccc1 ZINC000503270579 912253621 /nfs/dbraw/zinc/25/36/21/912253621.db2.gz SPHVHKSRKLTOMM-IBGZPJMESA-N 0 3 413.315 4.021 20 0 HIADHN CCCN(CCc1cccs1)CC(=O)N1CCC[C@H]1c1ccc2c(c1)OCCO2 ZINC000464580646 877804735 /nfs/dbraw/zinc/80/47/35/877804735.db2.gz BDFVJXKXKDMUDA-FQEVSTJZSA-N 0 3 414.571 4.138 20 0 HIADHN CCc1cccc(C)c1NC(=O)CN(CCCOc1ccccc1)C1CCOCC1 ZINC000464588842 877813436 /nfs/dbraw/zinc/81/34/36/877813436.db2.gz TUUDDHPDZGTVJJ-UHFFFAOYSA-N 0 3 410.558 4.446 20 0 HIADHN CO[C@@H](CNC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1)c1cccc(Cl)c1 ZINC000464592208 877818134 /nfs/dbraw/zinc/81/81/34/877818134.db2.gz HWQXFUBEFYIALC-RXVVDRJESA-N 0 3 404.913 4.195 20 0 HIADHN C[C@@H](c1ccccc1)N(C)C(=O)CN(CCCOc1ccccc1)C1CCOCC1 ZINC000464594614 877821490 /nfs/dbraw/zinc/82/14/90/877821490.db2.gz QXQFFHNZEMDLKY-NRFANRHFSA-N 0 3 410.558 4.156 20 0 HIADHN O=C(CN(CCCOc1ccccc1)C1CCOCC1)Nc1ccc2c(c1)CCC2 ZINC000464597199 877824060 /nfs/dbraw/zinc/82/40/60/877824060.db2.gz GVPDNKTZOCCCQX-UHFFFAOYSA-N 0 3 408.542 4.064 20 0 HIADHN Cc1ccc(CCN(C[C@H]2CCCO2)C(=O)c2cccc(CN3CCCC3)c2)cc1 ZINC000464648532 877868784 /nfs/dbraw/zinc/86/87/84/877868784.db2.gz FIOSHIQLQKLHAW-RUZDIDTESA-N 0 3 406.570 4.455 20 0 HIADHN CC[C@@H]1CCCCN1CCNC(=O)C(=O)Nc1ccc2c(c1)c1ccccc1n2CC ZINC000503301491 912284484 /nfs/dbraw/zinc/28/44/84/912284484.db2.gz WHLTYISHCDPVOJ-LJQANCHMSA-N 0 3 420.557 4.134 20 0 HIADHN COCCCN(C(=O)C12C[C@H]3C[C@@H](C1)CC(C(F)(F)F)(C3)C2)C1CCN(C)CC1 ZINC000464714919 877940322 /nfs/dbraw/zinc/94/03/22/877940322.db2.gz SDWGRELSYCWKGA-AGXSTUJCSA-N 0 3 416.528 4.095 20 0 HIADHN CCCN(CC(F)(F)F)C(=O)[C@H]1CCCN(Cc2ccccc2OC(C)C)C1 ZINC000464726675 877960851 /nfs/dbraw/zinc/96/08/51/877960851.db2.gz AOBLCXUVZPSBPV-SFHVURJKSA-N 0 3 400.485 4.487 20 0 HIADHN CCC[C@H]1[C@H](C)CCCN1CC(=O)N(C)CC(=O)Nc1ccccc1C(F)(F)F ZINC000464731994 877967811 /nfs/dbraw/zinc/96/78/11/877967811.db2.gz HXAVICLBWRXQKL-QAPCUYQASA-N 0 3 413.484 4.003 20 0 HIADHN Cc1nsc(N2CCCN(CCC(=O)Nc3ccccc3-c3ccccc3)CC2)n1 ZINC000464765354 878006655 /nfs/dbraw/zinc/00/66/55/878006655.db2.gz LIKQMOOSYNDRII-UHFFFAOYSA-N 0 3 421.570 4.054 20 0 HIADHN COc1ccc(CN(C(=O)CN2CC[C@@H](CSc3ccccc3)C2)C2CC2)cc1 ZINC000464767545 878010845 /nfs/dbraw/zinc/01/08/45/878010845.db2.gz GLSWJIJRRXCDIU-HXUWFJFHSA-N 0 3 410.583 4.300 20 0 HIADHN Cc1nn(C)c(C)c1NC(=O)[C@@H](C)N[C@H](COc1c(C)cccc1C)C(C)(C)C ZINC000464785826 878032515 /nfs/dbraw/zinc/03/25/15/878032515.db2.gz GWRUSARDCFITHA-IEBWSBKVSA-N 0 3 400.567 4.064 20 0 HIADHN CCN(CC(=O)Nc1cc(Cl)ccc1C)CC1CCN(c2ccccn2)CC1 ZINC000464802087 878046708 /nfs/dbraw/zinc/04/67/08/878046708.db2.gz MCNUAMQANBQJHP-UHFFFAOYSA-N 0 3 400.954 4.220 20 0 HIADHN C[C@H]1CCN(C(=O)Cc2ccc(Br)s2)CCN1Cc1ccccc1 ZINC000464885760 878183083 /nfs/dbraw/zinc/18/30/83/878183083.db2.gz MZLIWJDUAHRIBM-HNNXBMFYSA-N 0 3 407.377 4.176 20 0 HIADHN COCCc1ccc(OCCCC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)cc1 ZINC000464893540 878197006 /nfs/dbraw/zinc/19/70/06/878197006.db2.gz NGKLPHNJOTUUEC-JOCHJYFZSA-N 0 3 424.585 4.158 20 0 HIADHN Cc1oc(-c2ccccc2)nc1CC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC000464894558 878198738 /nfs/dbraw/zinc/19/87/38/878198738.db2.gz OEJFJWVJRKVDJZ-LJQANCHMSA-N 0 3 403.526 4.316 20 0 HIADHN CC[C@@H](C)n1ncc2c1nc(C)cc2C(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1 ZINC000464897016 878204401 /nfs/dbraw/zinc/20/44/01/878204401.db2.gz VJBPRZXTTJKLTH-UXHICEINSA-N 0 3 419.573 4.447 20 0 HIADHN C[C@H]1CCN(C(=O)c2cc(-c3ccccc3Cl)n[nH]2)CCN1Cc1ccccc1 ZINC000464900666 878209284 /nfs/dbraw/zinc/20/92/84/878209284.db2.gz MHULYNJQMWUSJJ-KRWDZBQOSA-N 0 3 408.933 4.467 20 0 HIADHN Cc1c(C(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)cnn1-c1ccccc1F ZINC000464902392 878215388 /nfs/dbraw/zinc/21/53/88/878215388.db2.gz ZZWKKQFATRKQQC-SFHVURJKSA-N 0 3 406.505 4.056 20 0 HIADHN C[C@@H]1CCN(C(=O)c2cccc(OCc3cscn3)c2)CCN1Cc1ccccc1 ZINC000464907158 878222097 /nfs/dbraw/zinc/22/20/97/878222097.db2.gz PIGWWOJXJPBLGM-LJQANCHMSA-N 0 3 421.566 4.459 20 0 HIADHN CCN(C[C@@H]1CCN(Cc2ccccc2)C1)C(=O)CCC(=O)c1ccc(OC)cc1 ZINC000464936829 878268658 /nfs/dbraw/zinc/26/86/58/878268658.db2.gz JFSBXSRCPLXPDE-OAQYLSRUSA-N 0 3 408.542 4.029 20 0 HIADHN Cc1ccc([C@@H](NC(=O)N[C@H](CN(C)C)c2ccc(F)cc2)c2ccccn2)cc1 ZINC000503363764 912340880 /nfs/dbraw/zinc/34/08/80/912340880.db2.gz BHBJZARBFFVKCG-DHIUTWEWSA-N 0 3 406.505 4.221 20 0 HIADHN Cc1ccc([C@H](NC(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)c2ccccn2)cc1 ZINC000503372324 912353379 /nfs/dbraw/zinc/35/33/79/912353379.db2.gz JWIQCSBEAHIWRE-YGOYIFOWSA-N 0 3 402.542 4.470 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N(CCc2cccc(F)c2)C2CCCC2)CC1 ZINC000465282661 878719609 /nfs/dbraw/zinc/71/96/09/878719609.db2.gz DFKDQKJGPUBXMI-UHFFFAOYSA-N 0 3 419.585 4.212 20 0 HIADHN O=C([C@H](c1ccccc1)N1CCC[C@H](c2ncc3n2CCCC3)C1)N1CCCCC1 ZINC000503407985 912389462 /nfs/dbraw/zinc/38/94/62/912389462.db2.gz GUTGYMQDZDDFBU-GMAHTHKFSA-N 0 3 406.574 4.153 20 0 HIADHN CO[C@]1(C)C[C@@H](N[C@@H](C)C(=O)Nc2ccc(NC(=O)c3cccs3)cc2)C1(C)C ZINC000465414706 878848008 /nfs/dbraw/zinc/84/80/08/878848008.db2.gz UNCRQXLKVQGEPN-GKIWIXTESA-N 0 3 415.559 4.121 20 0 HIADHN COc1ccccc1C[C@H](C)N(C)C(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000465423566 878852836 /nfs/dbraw/zinc/85/28/36/878852836.db2.gz NHQILFASAHAICU-PKOBYXMFSA-N 0 3 401.576 4.166 20 0 HIADHN CCO[C@@H](C)c1nc(CN(C)C(=O)NC[C@H](c2ccccc2)N2CCCC2)cs1 ZINC000465436604 878869406 /nfs/dbraw/zinc/86/94/06/878869406.db2.gz AVJORTVURWGPNP-FXAWDEMLSA-N 0 3 416.591 4.219 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@H]2CNC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000465439732 878871408 /nfs/dbraw/zinc/87/14/08/878871408.db2.gz YRCDCBBARGWMPP-VXNXHJTFSA-N 0 3 407.558 4.036 20 0 HIADHN Cc1ccccc1[C@@H]1CN(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)[C@H](C)CO1 ZINC000465446348 878877548 /nfs/dbraw/zinc/87/75/48/878877548.db2.gz VYRMQLKFUNPQDU-QDSKXPNFSA-N 0 3 407.558 4.304 20 0 HIADHN CN(C)CCN(C[C@H]1CCCO1)C(=O)N[C@H](c1ccccc1)c1ccc(Cl)cc1 ZINC000465471676 878908023 /nfs/dbraw/zinc/90/80/23/878908023.db2.gz GHNZRFFGPYFTTH-FGZHOGPDSA-N 0 3 415.965 4.182 20 0 HIADHN COc1cccc([C@H](CNC(=O)NC[C@@H](C)Sc2ccccc2)N2CCCC2)c1 ZINC000465474631 878912498 /nfs/dbraw/zinc/91/24/98/878912498.db2.gz IYQPBVBPXYWVRO-GCJKJVERSA-N 0 3 413.587 4.312 20 0 HIADHN COc1cccc([C@H](CNC(=O)N[C@@H](c2ncc(C)s2)C2CC2)N2CCCC2)c1 ZINC000465477329 878916150 /nfs/dbraw/zinc/91/61/50/878916150.db2.gz LQCKETQFCQJWCK-VQTJNVASSA-N 0 3 414.575 4.048 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCc1cc(OC)nc2ccccc12)c1ccsc1 ZINC000465528237 878982675 /nfs/dbraw/zinc/98/26/75/878982675.db2.gz JMAGGQLHTVXOPR-FQEVSTJZSA-N 0 3 412.559 4.187 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)Nc2ccc(OC(C)(C)C)cc2)CC1 ZINC000465534686 878994963 /nfs/dbraw/zinc/99/49/63/878994963.db2.gz SLLIFXFPVNEPAV-UHFFFAOYSA-N 0 3 424.589 4.323 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N(C)[C@@H](C)Cc1ccccc1OC)c1ccsc1 ZINC000465537034 878996187 /nfs/dbraw/zinc/99/61/87/878996187.db2.gz GHATWUFDFQXCII-PXNSSMCTSA-N 0 3 403.592 4.412 20 0 HIADHN CC[C@H](CNC(=O)N1CC[C@@H](COCc2ccccc2)C1)N1CCc2ccccc2C1 ZINC000465537020 878996293 /nfs/dbraw/zinc/99/62/93/878996293.db2.gz GEGBEDICCGTBDA-RCZVLFRGSA-N 0 3 421.585 4.072 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)N3C[C@@H](C)[C@@H]3c3ccccc3)CC2)c1 ZINC000465538191 878998225 /nfs/dbraw/zinc/99/82/25/878998225.db2.gz ASSWTERIWUMETG-RCZVLFRGSA-N 0 3 420.601 4.300 20 0 HIADHN CC[C@H](CNC(=O)N[C@@H](C)c1ccc(-n2cccn2)cc1)N1CCc2ccccc2C1 ZINC000465538136 878999031 /nfs/dbraw/zinc/99/90/31/878999031.db2.gz GAQDKZFDRVBXIS-WMZHIEFXSA-N 0 3 417.557 4.069 20 0 HIADHN Cc1ccccc1[C@@H]1CN(C(=O)N[C@H](CN2CCCC2)c2ccccc2)[C@@H](C)CO1 ZINC000465594438 879079210 /nfs/dbraw/zinc/07/92/10/879079210.db2.gz HFWJLQNZHVXYSI-ZTCOLXNVSA-N 0 3 407.558 4.304 20 0 HIADHN C[C@H](NC(=O)N[C@@H](CN1CCCC1)c1ccccc1)c1nc(C2CCCCC2)no1 ZINC000465595585 879081717 /nfs/dbraw/zinc/08/17/17/879081717.db2.gz JACSQIAGYYNVSR-PXNSSMCTSA-N 0 3 411.550 4.315 20 0 HIADHN CO[C@@H](CNC(=O)N[C@H](CN1CCCC1)c1ccccc1)c1ccc(Cl)cc1 ZINC000465613351 879111525 /nfs/dbraw/zinc/11/15/25/879111525.db2.gz ZRZHBWUKHKMCRT-RTWAWAEBSA-N 0 3 401.938 4.164 20 0 HIADHN CN(C)CCN(C[C@@H]1CCCO1)C(=O)N[C@H](c1ccccc1)c1cccc(Cl)c1 ZINC000465623424 879131072 /nfs/dbraw/zinc/13/10/72/879131072.db2.gz CGOZCKKDPTYELO-FCHUYYIVSA-N 0 3 415.965 4.182 20 0 HIADHN CN(C)CCN(C[C@H]1CCCO1)C(=O)N[C@@H](CCc1ccccc1)c1ccccc1 ZINC000465649098 879168928 /nfs/dbraw/zinc/16/89/28/879168928.db2.gz BJNDDUSTQXVPNP-RPWUZVMVSA-N 0 3 409.574 4.113 20 0 HIADHN CC(C)(C)c1ccc(OC[C@@H](O)CN2CCC[C@@H](c3ncc4n3CCCC4)C2)cc1 ZINC000503430445 912428477 /nfs/dbraw/zinc/42/84/77/912428477.db2.gz CWATYLRZMCICNY-KNQAVFIVSA-N 0 3 411.590 4.136 20 0 HIADHN CC[C@H](NC(=O)NCCN(C)Cc1ccccc1)c1nc(C(F)(F)F)cs1 ZINC000465742088 879327013 /nfs/dbraw/zinc/32/70/13/879327013.db2.gz BOIISXSUNIXOKW-AWEZNQCLSA-N 0 3 400.470 4.044 20 0 HIADHN Cc1ccc(-c2nc(CNC(=O)N[C@@H]3CCN([C@@H](C)c4ccccc4)C3)co2)cc1 ZINC000465756529 879348076 /nfs/dbraw/zinc/34/80/76/879348076.db2.gz OAOKMNBLEVRFSS-GHTZIAJQSA-N 0 3 404.514 4.285 20 0 HIADHN C[C@H]1CCN(C(=O)NCCCCN(C)c2ccccc2)CCN1Cc1ccccc1 ZINC000465764385 879360250 /nfs/dbraw/zinc/36/02/50/879360250.db2.gz UOGIRLWSMAYPLM-QFIPXVFZSA-N 0 3 408.590 4.209 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)NCc2ccc(-c3cccnc3)cc2)C1 ZINC000465764828 879361663 /nfs/dbraw/zinc/36/16/63/879361663.db2.gz XQZKXDWAIMURJM-CYFREDJKSA-N 0 3 400.526 4.383 20 0 HIADHN CO[C@H](CNC(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1)c1ccc(Cl)cc1 ZINC000465766043 879363851 /nfs/dbraw/zinc/36/38/51/879363851.db2.gz XIMNEVGKAUERHT-ORYQWCPZSA-N 0 3 401.938 4.162 20 0 HIADHN Cc1cc(C(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)nn1-c1ccc(F)cc1F ZINC000503438686 912450201 /nfs/dbraw/zinc/45/02/01/912450201.db2.gz SMFOISDSNFEGQX-APWZRJJASA-N 0 3 410.468 4.024 20 0 HIADHN C[C@@H](CCc1ccc2c(c1)OCO2)NC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC000465792708 879402564 /nfs/dbraw/zinc/40/25/64/879402564.db2.gz YVEWLKKJXHIDIU-VQTJNVASSA-N 0 3 423.557 4.042 20 0 HIADHN C[C@H](NC(=O)N(CCN(C)C)C[C@@H]1CCCO1)c1ccccc1Oc1ccccc1 ZINC000465807148 879422987 /nfs/dbraw/zinc/42/29/87/879422987.db2.gz QXMDPLSCDWSUET-FPOVZHCZSA-N 0 3 411.546 4.292 20 0 HIADHN C[C@@H]1CCN(C(=O)NCCCCOCc2ccccc2)CCN1Cc1ccccc1 ZINC000465814501 879436716 /nfs/dbraw/zinc/43/67/16/879436716.db2.gz PKFHKIIXWPAKBV-JOCHJYFZSA-N 0 3 409.574 4.289 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N[C@@H](C)c2cccc(-n3cccn3)c2)N2CCCC2)cc1 ZINC000465819844 879446540 /nfs/dbraw/zinc/44/65/40/879446540.db2.gz WNWUDDSYTOMZOS-GBXCKJPGSA-N 0 3 417.557 4.378 20 0 HIADHN CCC[C@H](NC(=O)N(CCN(C)C)C[C@H]1CCCO1)c1cccc(C(F)(F)F)c1 ZINC000465844944 879485177 /nfs/dbraw/zinc/48/51/77/879485177.db2.gz MUHWWKUBKNQDDT-MOPGFXCFSA-N 0 3 415.500 4.299 20 0 HIADHN Cc1ccccc1Oc1ccccc1CNC(=O)N(CCN(C)C)C[C@H]1CCCO1 ZINC000465864878 879515236 /nfs/dbraw/zinc/51/52/36/879515236.db2.gz ROMDUNOYVKUADB-OAQYLSRUSA-N 0 3 411.546 4.040 20 0 HIADHN Cc1ccc(-c2nc(CNC(=O)NC[C@H]3CCCN3Cc3ccccc3)co2)cc1 ZINC000465931635 879595349 /nfs/dbraw/zinc/59/53/49/879595349.db2.gz JSOSGHLRGWTUHM-JOCHJYFZSA-N 0 3 404.514 4.114 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)N[C@H](CC(C)C)c2ccc(Cl)cc2)CC1 ZINC000465968831 879637881 /nfs/dbraw/zinc/63/78/81/879637881.db2.gz OEXPIEYKFWQLLD-WIYYLYMNSA-N 0 3 409.018 4.000 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)N[C@@H](CC(C)C)c2ccc(Cl)cc2)CC1 ZINC000465968829 879638136 /nfs/dbraw/zinc/63/81/36/879638136.db2.gz OEXPIEYKFWQLLD-NQIIRXRSSA-N 0 3 409.018 4.000 20 0 HIADHN C[C@@H]1CCN(C(=O)NC[C@@H]2CCCO[C@H]2C(C)(C)C)CCN1Cc1ccccc1 ZINC000465982282 879653646 /nfs/dbraw/zinc/65/36/46/879653646.db2.gz IEGYNCBGUANAJC-BAGYTPMASA-N 0 3 401.595 4.134 20 0 HIADHN Cc1cccc2c(CCNC(=O)N3CCCN(Cc4ccccc4)C[C@H]3C)c[nH]c21 ZINC000465990457 879664683 /nfs/dbraw/zinc/66/46/83/879664683.db2.gz DALXYZSUWYOIKU-HXUWFJFHSA-N 0 3 404.558 4.325 20 0 HIADHN Cc1cccc2c(CCNC(=O)N3CC[C@@H](C)N(Cc4ccccc4)CC3)c[nH]c21 ZINC000466006101 879686910 /nfs/dbraw/zinc/68/69/10/879686910.db2.gz HFTSCZFEYBMTRN-HXUWFJFHSA-N 0 3 404.558 4.325 20 0 HIADHN CSc1cccc([C@H](NC(=O)N[C@H]2CCN(C3CC3)C2)c2ccc(F)c(F)c2)c1 ZINC000466023455 879710290 /nfs/dbraw/zinc/71/02/90/879710290.db2.gz SVNSCDYMRBXBNE-KKSFZXQISA-N 0 3 417.525 4.312 20 0 HIADHN CSc1cccc([C@@H](NC(=O)N[C@@H]2CCN(C3CC3)C2)c2cc(F)ccc2F)c1 ZINC000466026329 879713545 /nfs/dbraw/zinc/71/35/45/879713545.db2.gz OAXADTOSXHZIMK-IIBYNOLFSA-N 0 3 417.525 4.312 20 0 HIADHN COc1ccc([C@H](C)CCNC(=O)N(CCN(C)C)Cc2ccccc2F)cc1 ZINC000466037279 879727194 /nfs/dbraw/zinc/72/71/94/879727194.db2.gz POVZZKXEYWCUNG-GOSISDBHSA-N 0 3 401.526 4.101 20 0 HIADHN CC[C@H](C)[C@H](NC(=O)NC[C@@H](C)CN1CCN(CC)CC1)c1ccc(Cl)cc1 ZINC000466085598 879805231 /nfs/dbraw/zinc/80/52/31/879805231.db2.gz MZAKKTGXUNPCHF-LQWHRVPQSA-N 0 3 409.018 4.000 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)NC3CC(c4cccc(Cl)c4)C3)CC2)C[C@H](C)O1 ZINC000466106831 879822893 /nfs/dbraw/zinc/82/28/93/879822893.db2.gz KNNWPZJVOIUUBK-RPDKDSDNSA-N 0 3 419.997 4.117 20 0 HIADHN C[C@@H]1C[C@@H]1[C@H](NC(=O)N(CCN(C)C)Cc1ccccn1)c1ccc(Cl)cc1 ZINC000466152645 879858556 /nfs/dbraw/zinc/85/85/56/879858556.db2.gz PARAPDWFIIWOBK-TYCQWZJGSA-N 0 3 400.954 4.206 20 0 HIADHN C[C@H](CNC(=O)N(CCN(C)C)Cc1ccccc1F)Oc1ccccc1Cl ZINC000466157853 879861576 /nfs/dbraw/zinc/86/15/76/879861576.db2.gz BVEPHKBMODEPJJ-MRXNPFEDSA-N 0 3 407.917 4.020 20 0 HIADHN COc1cc(CNC(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)c2ccccc2n1 ZINC000466185994 879880956 /nfs/dbraw/zinc/88/09/56/879880956.db2.gz CHBZUIDABQLIKV-LJQANCHMSA-N 0 3 418.541 4.049 20 0 HIADHN COc1ccc([C@H](CNC(=O)Nc2ccc(OC)c3ncccc23)N2CCCC2)cc1 ZINC000503475259 912513306 /nfs/dbraw/zinc/51/33/06/912513306.db2.gz SRLPJIBXUBHBSZ-NRFANRHFSA-N 0 3 420.513 4.211 20 0 HIADHN COc1ccc([C@@H](CNC(=O)NCc2ccc3ccccc3c2)N2CCCC2)cc1 ZINC000503475974 912516301 /nfs/dbraw/zinc/51/63/01/912516301.db2.gz UWDUQWIEFDKPQL-XMMPIXPASA-N 0 3 403.526 4.485 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)NC[C@H]2CCCO[C@H]2c2ccccc2)CN1Cc1ccccc1 ZINC000466258239 879983840 /nfs/dbraw/zinc/98/38/40/879983840.db2.gz KMHAOMKSZVZHEM-JFTIXFDTSA-N 0 3 407.558 4.117 20 0 HIADHN COc1ccc(-c2cncc(C(=O)N(CCN(C)C)Cc3ccccc3F)c2)cc1 ZINC000466273312 880011194 /nfs/dbraw/zinc/01/11/94/880011194.db2.gz ZEFONUJYXWWRSR-UHFFFAOYSA-N 0 3 407.489 4.100 20 0 HIADHN COc1ccc(-c2cncc(C(=O)N(C)C3CCN(Cc4ccccc4)CC3)c2)cc1 ZINC000466281256 880022284 /nfs/dbraw/zinc/02/22/84/880022284.db2.gz PTPPMPLBTIMXKK-UHFFFAOYSA-N 0 3 415.537 4.494 20 0 HIADHN CCCN(C(=O)NCCc1ncc(CC)s1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000466339829 880097116 /nfs/dbraw/zinc/09/71/16/880097116.db2.gz LKILIIUYLRBROU-HXUWFJFHSA-N 0 3 414.619 4.334 20 0 HIADHN CO[C@H](CNC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C)c1cccc(Cl)c1 ZINC000466343846 880101730 /nfs/dbraw/zinc/10/17/30/880101730.db2.gz PSKNVVLDALMJIF-PGRDOPGGSA-N 0 3 415.965 4.334 20 0 HIADHN Cc1cc(CNCc2c[nH]nc2-c2ccc(F)cc2)ccc1I ZINC000466365469 880124254 /nfs/dbraw/zinc/12/42/54/880124254.db2.gz VRSKMYQEECUILO-UHFFFAOYSA-N 0 3 421.257 4.419 20 0 HIADHN CCN1CCC[C@@H](CN(C)C(=O)N[C@H]2C[C@H](c3ccccc3C)C2)[C@@H]1c1cnn(C)c1 ZINC000466392475 880154747 /nfs/dbraw/zinc/15/47/47/880154747.db2.gz QPGTWXCJZZGWLQ-CGCKEFBRSA-N 0 3 423.605 4.089 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NC[C@H](C)c3ccc(F)cc3F)c(C)c2)CC1 ZINC000466423933 880196624 /nfs/dbraw/zinc/19/66/24/880196624.db2.gz BRNWODLXOITNMX-KRWDZBQOSA-N 0 3 416.516 4.340 20 0 HIADHN COc1ccc(C(=O)Nc2ccc(C(=O)NC[C@H](c3ccccc3)N(C)C)s2)cc1 ZINC000466426573 880200090 /nfs/dbraw/zinc/20/00/90/880200090.db2.gz RTEFATXELPENMG-LJQANCHMSA-N 0 3 423.538 4.042 20 0 HIADHN CN(Cc1ccco1)Cc1ccccc1CNCc1cncc(Br)c1 ZINC000466446369 880223265 /nfs/dbraw/zinc/22/32/65/880223265.db2.gz PICDZVAQWSOGAY-UHFFFAOYSA-N 0 3 400.320 4.359 20 0 HIADHN COc1ccc(C(=O)Nc2ccc(C(=O)NC[C@@H](C)N3CCCC[C@@H]3C)s2)cc1 ZINC000466457262 880237414 /nfs/dbraw/zinc/23/74/14/880237414.db2.gz RGMGRXBRDIVGJK-JKSUJKDBSA-N 0 3 415.559 4.002 20 0 HIADHN CN(CCC1CCOCC1)CC(=O)N[C@@H](c1ccccc1)c1ccc(Cl)cc1 ZINC000466485445 880264594 /nfs/dbraw/zinc/26/45/94/880264594.db2.gz ULFHFZUNAWOTMC-QHCPKHFHSA-N 0 3 400.950 4.294 20 0 HIADHN CSc1ccc([C@H](C)NC(=O)N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)cc1 ZINC000466496495 880272880 /nfs/dbraw/zinc/27/28/80/880272880.db2.gz TWXKRSJRCFXVRJ-KSZLIROESA-N 0 3 405.608 4.000 20 0 HIADHN CSc1ccc([C@H](C)NC(=O)N2CCC(CN3C[C@H](C)O[C@@H](C)C3)CC2)cc1 ZINC000466496494 880273254 /nfs/dbraw/zinc/27/32/54/880273254.db2.gz TWXKRSJRCFXVRJ-BZSNNMDCSA-N 0 3 405.608 4.000 20 0 HIADHN C[C@H]1C[C@H](NC(=O)NCc2ccc(-c3cccnc3)cc2)CN1Cc1ccccc1 ZINC000466511358 880286343 /nfs/dbraw/zinc/28/63/43/880286343.db2.gz AJBBJCIOHLETNX-CYFREDJKSA-N 0 3 400.526 4.211 20 0 HIADHN C[C@H]1C[C@@H](NC(=O)N(Cc2ccccc2)CC2CCOCC2)CN1Cc1ccccc1 ZINC000466514555 880289359 /nfs/dbraw/zinc/28/93/59/880289359.db2.gz LDRZUGBMGDRXBG-SQJMNOBHSA-N 0 3 421.585 4.288 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N[C@H](c1ccccc1)c1cccnc1 ZINC000503503104 912551536 /nfs/dbraw/zinc/55/15/36/912551536.db2.gz MMGFWNRYVRDXBO-IFMALSPDSA-N 0 3 406.555 4.369 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)N2CCC(Nc3ccc(F)cc3)CC2)CN1Cc1ccccc1 ZINC000466534035 880308044 /nfs/dbraw/zinc/30/80/44/880308044.db2.gz MDQQJHIKRQALEG-WZONZLPQSA-N 0 3 410.537 4.075 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)NC(=O)N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)cc1 ZINC000466541339 880315867 /nfs/dbraw/zinc/31/58/67/880315867.db2.gz QWWQBELENCXAOH-MSYCTHLASA-N 0 3 417.557 4.204 20 0 HIADHN CC[C@H](C(=O)Nc1nc(-c2ccc3c(c2)CCC(=O)N3)c(C)s1)N(CC)CC ZINC000466621983 880395002 /nfs/dbraw/zinc/39/50/02/880395002.db2.gz ALKAEHQSXSGMKQ-QGZVFWFLSA-N 0 3 400.548 4.062 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3cc(Cl)c(Cl)cn3)c(C)c2)CC1 ZINC000466657470 880436875 /nfs/dbraw/zinc/43/68/75/880436875.db2.gz CXPMQWVKEWNHPS-UHFFFAOYSA-N 0 3 408.333 4.483 20 0 HIADHN Cc1ncsc1CN(C)C[C@@H]1CCN(C(=O)Nc2cc(Cl)c(Cl)cn2)C1 ZINC000466672689 880457737 /nfs/dbraw/zinc/45/77/37/880457737.db2.gz YLIXDCUFESLGRB-LBPRGKRZSA-N 0 3 414.362 4.139 20 0 HIADHN CCc1c(NC(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)cnn1-c1ccccc1 ZINC000466716357 880506459 /nfs/dbraw/zinc/50/64/59/880506459.db2.gz HAYBYJWETSKRQQ-ICSRJNTNSA-N 0 3 403.530 4.392 20 0 HIADHN CCCN(C(=O)NCc1nc2cc(C)ccc2[nH]1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000466754661 880534946 /nfs/dbraw/zinc/53/49/46/880534946.db2.gz VCNQFQOSNSVULT-OAQYLSRUSA-N 0 3 419.573 4.458 20 0 HIADHN CCCN(C(=O)NCc1nc2ccc(C)cc2[nH]1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000466754661 880534954 /nfs/dbraw/zinc/53/49/54/880534954.db2.gz VCNQFQOSNSVULT-OAQYLSRUSA-N 0 3 419.573 4.458 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)NCc1cc(Cl)ccc1OC(F)F ZINC000466767764 880548375 /nfs/dbraw/zinc/54/83/75/880548375.db2.gz TVBMCTVLMRSOEN-UHFFFAOYSA-N 0 3 411.880 4.215 20 0 HIADHN Cc1ccccc1C[C@@H](CO)NCc1cccc(Br)c1OC(F)F ZINC000466894807 880661821 /nfs/dbraw/zinc/66/18/21/880661821.db2.gz CFENZNFIWYPMFE-HNNXBMFYSA-N 0 3 400.263 4.052 20 0 HIADHN Cc1ccccc1C[C@H](CO)NCc1cccc(Br)c1OC(F)F ZINC000466894809 880662024 /nfs/dbraw/zinc/66/20/24/880662024.db2.gz CFENZNFIWYPMFE-OAHLLOKOSA-N 0 3 400.263 4.052 20 0 HIADHN COc1ccc(N(C)C(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)cc1F ZINC000466906732 880672926 /nfs/dbraw/zinc/67/29/26/880672926.db2.gz ROIHMPWWAJTYIE-HXUWFJFHSA-N 0 3 410.411 4.252 20 0 HIADHN CC1CCN([C@H](CNC(=O)Nc2cccnc2-c2cnn(C)c2)c2cccs2)CC1 ZINC000466946711 880720830 /nfs/dbraw/zinc/72/08/30/880720830.db2.gz NCBCKRHNKLQTHN-LJQANCHMSA-N 0 3 424.574 4.138 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@@H]2CNC(=O)N2CCCN(Cc3ccccc3)CC2)cc1 ZINC000466955013 880737301 /nfs/dbraw/zinc/73/73/01/880737301.db2.gz PKHONRDYJLRUCM-RPBOFIJWSA-N 0 3 421.585 4.380 20 0 HIADHN C[C@@H](NC(=O)N[C@@H](C)c1nc(C(F)(F)F)cs1)[C@@H](c1ccccc1)N(C)C ZINC000503546108 912609803 /nfs/dbraw/zinc/60/98/03/912609803.db2.gz FAQTZLSEVBQOQS-XUJVJEKNSA-N 0 3 400.470 4.214 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)Cc2ccc(NC(=O)CC(C)(C)C)cc2)CN1Cc1ccccc1 ZINC000467040824 880837228 /nfs/dbraw/zinc/83/72/28/880837228.db2.gz NRRYFKUBQLSRCB-XXBNENTESA-N 0 3 421.585 4.383 20 0 HIADHN C[C@@H](NC(=O)N(CCN(C)C)Cc1ccccc1F)c1nc(C2CCCCC2)no1 ZINC000467053863 880844049 /nfs/dbraw/zinc/84/40/49/880844049.db2.gz NGDHAWBOAWWAJQ-MRXNPFEDSA-N 0 3 417.529 4.091 20 0 HIADHN Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)N[C@@H]1C[C@H](C)N(Cc2ccccc2)C1 ZINC000467107350 880866908 /nfs/dbraw/zinc/86/69/08/880866908.db2.gz PPQSHKIGIRBOIS-SIKLNZKXSA-N 0 3 422.573 4.165 20 0 HIADHN Cc1cc(N2CCSCC2)ccc1NC(=O)N[C@H]1C[C@H](C)N(Cc2ccccc2)C1 ZINC000467108824 880868544 /nfs/dbraw/zinc/86/85/44/880868544.db2.gz DLGFLDNVGXBNBX-FPOVZHCZSA-N 0 3 424.614 4.333 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)Nc2cccc(NC(=O)c3ccoc3)c2)CN1Cc1ccccc1 ZINC000467114007 880872964 /nfs/dbraw/zinc/87/29/64/880872964.db2.gz KBTNSVXPRLOCCT-VGOFRKELSA-N 0 3 418.497 4.316 20 0 HIADHN COC(=O)COc1ccc([C@H](C)N[C@H](C)C(=O)Nc2c(C)cccc2C(C)C)cc1 ZINC000467179759 880907731 /nfs/dbraw/zinc/90/77/31/880907731.db2.gz IXJDICZMBJNSKZ-ZWKOTPCHSA-N 0 3 412.530 4.348 20 0 HIADHN CN(C)C[C@H](NC(=O)NCc1nc(-c2ccccc2F)cs1)c1ccc(F)cc1 ZINC000503556373 912627010 /nfs/dbraw/zinc/62/70/10/912627010.db2.gz CLAZWHHIPQZQKU-SFHVURJKSA-N 0 3 416.497 4.190 20 0 HIADHN Cc1ccc(-c2cncc(C(=O)N3CCC(CN4C[C@H](C)O[C@@H](C)C4)CC3)c2)cc1 ZINC000467254973 880987977 /nfs/dbraw/zinc/98/79/77/880987977.db2.gz WYOQKNPPORLMBA-PMACEKPBSA-N 0 3 407.558 4.018 20 0 HIADHN COCCN(C)CCNC(=O)Cc1sc(-c2ccccc2)nc1-c1ccc(C)cc1 ZINC000467255829 880988798 /nfs/dbraw/zinc/98/87/98/880988798.db2.gz ICVYCGUBSXROKF-UHFFFAOYSA-N 0 3 423.582 4.022 20 0 HIADHN Cc1ccccc1CN1CCCN(C(=O)CN[C@@H](C)c2cc3ccccc3o2)CC1 ZINC000467268473 881009340 /nfs/dbraw/zinc/00/93/40/881009340.db2.gz LTYSJLJACZPKDJ-FQEVSTJZSA-N 0 3 405.542 4.126 20 0 HIADHN C[C@H](NC[C@@H](O)COc1cccc(Cl)c1Cl)c1ccnn1-c1ccccc1 ZINC000467382989 881163564 /nfs/dbraw/zinc/16/35/64/881163564.db2.gz CMCIXBUOTJPFPL-GOEBONIOSA-N 0 3 406.313 4.270 20 0 HIADHN C[C@H](N[C@@H]1CCCC12CCOCC2)c1nc(-c2ccc(Br)cc2)no1 ZINC000503571116 912650102 /nfs/dbraw/zinc/65/01/02/912650102.db2.gz MLVWFYQYWIIUAX-XJKSGUPXSA-N 0 3 406.324 4.499 20 0 HIADHN Cc1ccc(-c2nnc([C@@H](C)NCC3(N4CCSCC4)CCCC3)o2)cc1C ZINC000467401261 881185834 /nfs/dbraw/zinc/18/58/34/881185834.db2.gz CEYMELZFYUJDQI-GOSISDBHSA-N 0 3 400.592 4.366 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)Nc1ccccc1CC(=O)OC(C)(C)C ZINC000467402057 881187531 /nfs/dbraw/zinc/18/75/31/881187531.db2.gz CARNJUXHVAFILU-UHFFFAOYSA-N 0 3 411.546 4.167 20 0 HIADHN O=C(CN[C@@H](c1cccc(Br)c1)C1CCOCC1)Nc1ccc(F)cc1 ZINC000467404088 881190141 /nfs/dbraw/zinc/19/01/41/881190141.db2.gz MKLMFIGRTXHDFG-HXUWFJFHSA-N 0 3 421.310 4.284 20 0 HIADHN C[C@@H](NCC[C@H](C)c1ccccc1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000467406038 881193019 /nfs/dbraw/zinc/19/30/19/881193019.db2.gz OQQXCHJQXVNETQ-QWHCGFSZSA-N 0 3 401.359 4.485 20 0 HIADHN COc1cc(C(C)=O)ccc1OC[C@H](O)CN(C1CC1)[C@@H]1CCCc2ccccc21 ZINC000503572796 912653175 /nfs/dbraw/zinc/65/31/75/912653175.db2.gz HRKWFVJQLXBAPW-FYYLOGMGSA-N 0 3 409.526 4.180 20 0 HIADHN CCS(=O)(=O)c1cccc(CN[C@@H]2CCCc3c(Br)cccc32)c1 ZINC000467416913 881205039 /nfs/dbraw/zinc/20/50/39/881205039.db2.gz DAGXVRMWMYYRPB-LJQANCHMSA-N 0 3 408.361 4.410 20 0 HIADHN COc1ccc2c(c1)[C@@H](NC[C@@H](O)COc1cccc(C(F)(F)F)c1)CCS2 ZINC000467418420 881206275 /nfs/dbraw/zinc/20/62/75/881206275.db2.gz JYHJMUKBMABHGA-KDOFPFPSSA-N 0 3 413.461 4.280 20 0 HIADHN CC1CCC(N2CCN(C(=O)Nc3ccccc3CC(=O)OC(C)(C)C)CC2)CC1 ZINC000467421690 881211376 /nfs/dbraw/zinc/21/13/76/881211376.db2.gz YUDMURXNGRZCHW-UHFFFAOYSA-N 0 3 415.578 4.299 20 0 HIADHN Cc1nc(Cc2ccccc2)sc1[C@@H](C)NCCN1CCc2ccccc2C1=O ZINC000467426322 881216826 /nfs/dbraw/zinc/21/68/26/881216826.db2.gz BAZWSHDZXFTZHR-QGZVFWFLSA-N 0 3 405.567 4.391 20 0 HIADHN C[C@@H]1[C@H](N[C@@H]2CCCc3ncc(C(F)(F)F)cc32)CC(=O)N1Cc1ccccc1 ZINC000467436705 881235852 /nfs/dbraw/zinc/23/58/52/881235852.db2.gz ZGEDREHQPBUKKZ-JSNMRZPZSA-N 0 3 403.448 4.257 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)c(Cl)c1 ZINC000467463607 881275045 /nfs/dbraw/zinc/27/50/45/881275045.db2.gz HBEXNYANKGTGAN-RDTXWAMCSA-N 0 3 400.910 4.083 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)c1cc2c(s1)CCCCCC2 ZINC000467495549 881313133 /nfs/dbraw/zinc/31/31/33/881313133.db2.gz UEABYPLWRUBPRH-UHFFFAOYSA-N 0 3 412.599 4.294 20 0 HIADHN O=C(Cc1ccc(-c2ccccc2)cc1)NCc1ccccc1CN1CCC(O)CC1 ZINC000467496826 881313364 /nfs/dbraw/zinc/31/33/64/881313364.db2.gz TXWZINOISZLCOW-UHFFFAOYSA-N 0 3 414.549 4.169 20 0 HIADHN CCc1nnc(-c2ccc(NC(=O)[C@H]3CCCN(Cc4cccc(F)c4)C3)cc2)o1 ZINC000467505078 881319662 /nfs/dbraw/zinc/31/96/62/881319662.db2.gz VFIARFSGXYGDBR-SFHVURJKSA-N 0 3 408.477 4.289 20 0 HIADHN CN(C)CCn1c(=O)oc2ccc(NC(=O)c3cc(-c4ccc(Cl)cc4)c[nH]3)cc21 ZINC000469059604 883135332 /nfs/dbraw/zinc/13/53/32/883135332.db2.gz RFTNNMYMCUFKHH-UHFFFAOYSA-N 0 3 424.888 4.057 20 0 HIADHN CCOC(=O)c1csc(CCN[C@H](C)c2cc(Cl)ccc2OC(F)F)n1 ZINC000469059641 883135385 /nfs/dbraw/zinc/13/53/85/883135385.db2.gz VNXBWMPIISUURY-SNVBAGLBSA-N 0 3 404.866 4.468 20 0 HIADHN CC(C)Cn1ccc2c1cccc2C(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000469065842 883143344 /nfs/dbraw/zinc/14/33/44/883143344.db2.gz RTYWHIFAXANSHX-WOJBJXKFSA-N 0 3 411.590 4.259 20 0 HIADHN CCCn1c(C(=O)Nc2ccccc2CN2CCC[C@@H](C(N)=O)C2)cc2ccccc21 ZINC000469075641 883158290 /nfs/dbraw/zinc/15/82/90/883158290.db2.gz WRHKTTHHDXVKDQ-HXUWFJFHSA-N 0 3 418.541 4.001 20 0 HIADHN CSc1nc(C2CC2)nc(C)c1C(=O)NC[C@H](c1ccc(C)cc1)N1CCCC1 ZINC000469169094 883267615 /nfs/dbraw/zinc/26/76/15/883267615.db2.gz OZSOPHBSNNJWCS-LJQANCHMSA-N 0 3 410.587 4.260 20 0 HIADHN Cc1cn(-c2c(F)cccc2F)nc1C(=O)N(C)C1CCN(Cc2ccccc2)CC1 ZINC000469224751 883325006 /nfs/dbraw/zinc/32/50/06/883325006.db2.gz ZHUJSXIWJSWBCP-UHFFFAOYSA-N 0 3 424.495 4.196 20 0 HIADHN COc1cc(Br)ccc1[C@H](C)N[C@H](C)Cn1cc(Br)cn1 ZINC000469226331 883326451 /nfs/dbraw/zinc/32/64/51/883326451.db2.gz STTPGGMZULHGCM-MNOVXSKESA-N 0 3 417.145 4.156 20 0 HIADHN CCOc1ccc([C@H](C)N[C@@H]2CCCN(Cc3ccc(F)cc3F)C2=O)cc1OC ZINC000469230907 883330085 /nfs/dbraw/zinc/33/00/85/883330085.db2.gz KGQJXPBVVPJBLM-MGPUTAFESA-N 0 3 418.484 4.214 20 0 HIADHN COCc1ccc([C@@H]2CCCN2C(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)o1 ZINC000469264168 883361300 /nfs/dbraw/zinc/36/13/00/883361300.db2.gz QQVJNWNVAHUFIM-RXVVDRJESA-N 0 3 400.494 4.141 20 0 HIADHN CCN(C(=O)c1ccc(OCC(F)(F)F)cn1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000469294505 883392871 /nfs/dbraw/zinc/39/28/71/883392871.db2.gz RFBJYIMAGUUYFS-SJLPKXTDSA-N 0 3 421.463 4.320 20 0 HIADHN Cc1ccc(F)c(C(=O)NC[C@H]2CCCN2Cc2ccccc2)c1Br ZINC000469424033 883602667 /nfs/dbraw/zinc/60/26/67/883602667.db2.gz ICTHTFJOEFBDDZ-MRXNPFEDSA-N 0 3 405.311 4.291 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)N[C@@H](C)c1ccc2c(c1)CCC(=O)N2 ZINC000469423646 883602843 /nfs/dbraw/zinc/60/28/43/883602843.db2.gz CNFBTANFPLTPDA-MBSDFSHPSA-N 0 3 422.573 4.088 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)CCc1nc(-c2cccs2)no1 ZINC000469477547 883707591 /nfs/dbraw/zinc/70/75/91/883707591.db2.gz HEJOWKKVDBOGAQ-GOSISDBHSA-N 0 3 412.559 4.004 20 0 HIADHN CCc1c(NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)cnn1-c1ccccc1 ZINC000469493223 883732508 /nfs/dbraw/zinc/73/25/08/883732508.db2.gz COJQLJZOVYSJNS-LJQANCHMSA-N 0 3 406.505 4.425 20 0 HIADHN CSc1nc(C2CC2)nc(C)c1C(=O)N(C)C1CCN(Cc2ccccc2)CC1 ZINC000469494860 883737016 /nfs/dbraw/zinc/73/70/16/883737016.db2.gz YZEZPENHQJMXQF-UHFFFAOYSA-N 0 3 410.587 4.121 20 0 HIADHN CCN1CCN([C@H](C)CNC(=O)c2ccc(Oc3ccc(Cl)cc3)c(F)c2)CC1 ZINC000469504263 883750732 /nfs/dbraw/zinc/75/07/32/883750732.db2.gz BMNMIUBWHDADNQ-MRXNPFEDSA-N 0 3 419.928 4.027 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)Nc3ccc(C)c(OC(F)F)c3)CC2)c1 ZINC000469512109 883772511 /nfs/dbraw/zinc/77/25/11/883772511.db2.gz NGIIHLREDJWTRA-UHFFFAOYSA-N 0 3 403.473 4.056 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)C(=O)Nc2cccc(-c3cccs3)c2)c1 ZINC000503644440 912749112 /nfs/dbraw/zinc/74/91/12/912749112.db2.gz QRPKOLAOAMNYTP-UHFFFAOYSA-N 0 3 421.566 4.252 20 0 HIADHN CN(CCCCCc1cc(-c2ccc(F)cc2)n[nH]1)Cc1cc(-c2cnn(C)c2)no1 ZINC000469521457 883788199 /nfs/dbraw/zinc/78/81/99/883788199.db2.gz BLGLCCADZJEWJJ-UHFFFAOYSA-N 0 3 422.508 4.449 20 0 HIADHN Cc1ccc(-c2nnco2)cc1NC(=O)N[C@@H](CN(C)Cc1ccccc1)C(C)C ZINC000469674823 883863868 /nfs/dbraw/zinc/86/38/68/883863868.db2.gz LTRFYDGIXZENJL-NRFANRHFSA-N 0 3 407.518 4.323 20 0 HIADHN CCN1CCN(CCC(=O)N[C@@H](c2ccc(F)c(C)c2)c2ccccc2Cl)CC1 ZINC000469711672 883882326 /nfs/dbraw/zinc/88/23/26/883882326.db2.gz GHXQHPZJFAGDII-QHCPKHFHSA-N 0 3 417.956 4.021 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)c1cccc(NC(=O)c2ccco2)c1 ZINC000469746315 883903501 /nfs/dbraw/zinc/90/35/01/883903501.db2.gz WJTVPFDMCDMEOW-JOCHJYFZSA-N 0 3 419.525 4.418 20 0 HIADHN CN(C)[C@@H](CN[C@H](c1ccccc1)c1cncnc1)c1cccc(C(F)(F)F)c1 ZINC000469789592 883965267 /nfs/dbraw/zinc/96/52/67/883965267.db2.gz FSCOJIDZTZSQQO-LEWJYISDSA-N 0 3 400.448 4.477 20 0 HIADHN O=C(CCCc1ccc(Cl)cc1)NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000469836409 884017207 /nfs/dbraw/zinc/01/72/07/884017207.db2.gz MAIXTSDGBWIRRG-QFIPXVFZSA-N 0 3 400.950 4.070 20 0 HIADHN CCSc1ccc(Cl)cc1C(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000469837575 884018809 /nfs/dbraw/zinc/01/88/09/884018809.db2.gz BQKCEQFKRUIGDU-LJQANCHMSA-N 0 3 418.990 4.473 20 0 HIADHN COc1ccc2c(c1)[C@@H](C(=O)Nc1cc(C)cc(N3CCN(C(C)C)CC3)c1)CC2 ZINC000469850542 884033752 /nfs/dbraw/zinc/03/37/52/884033752.db2.gz DSFPBARYNAODSW-QHCPKHFHSA-N 0 3 407.558 4.203 20 0 HIADHN C[C@H](C(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1)c1ccc2ccccc2c1 ZINC000469862084 884050160 /nfs/dbraw/zinc/05/01/60/884050160.db2.gz LKIIEYCCLDZFTJ-NBGIEHNGSA-N 0 3 402.538 4.351 20 0 HIADHN Cc1ccc(Sc2ccc(NC(=O)N3CCCN([C@H](C)CO)CC3)cc2)cc1C ZINC000469909911 884098818 /nfs/dbraw/zinc/09/88/18/884098818.db2.gz UNDQUWVQKFFWGA-LJQANCHMSA-N 0 3 413.587 4.375 20 0 HIADHN Cc1nn(-c2ccccc2)cc1NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000469919091 884108971 /nfs/dbraw/zinc/10/89/71/884108971.db2.gz PVAITFJRRCREJM-UHFFFAOYSA-N 0 3 421.467 4.108 20 0 HIADHN COc1ccc(Nc2nc(C(=O)N(CCN(C)C)C3CCCCC3)cs2)cc1 ZINC000469987598 884203509 /nfs/dbraw/zinc/20/35/09/884203509.db2.gz SLCQGHJCBPXMGU-UHFFFAOYSA-N 0 3 402.564 4.232 20 0 HIADHN Cc1ccc([C@H]2OCCC[C@H]2NC(=O)N2CCCN(Cc3ccccc3)CC2)cc1 ZINC000470052603 884300522 /nfs/dbraw/zinc/30/05/22/884300522.db2.gz BZEJDJWWOBKIQG-DNQXCXABSA-N 0 3 407.558 4.133 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@@H]2NC(=O)N(CCN(C)C)Cc2cccc(C)c2)cc1 ZINC000470072548 884327605 /nfs/dbraw/zinc/32/76/05/884327605.db2.gz DDZKZKLNXGKYEM-ZEQRLZLVSA-N 0 3 409.574 4.297 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)[C@H]3SCCc4sccc43)c2)CC1 ZINC000503747639 912814661 /nfs/dbraw/zinc/81/46/61/912814661.db2.gz LUGXMSYETYIVKV-FQEVSTJZSA-N 0 3 401.601 4.248 20 0 HIADHN CCOc1cc(CN2CC[C@H](C(F)(F)F)C2(C)C)ccc1O[C@@H](C)C(=O)N(C)C ZINC000470130692 884395555 /nfs/dbraw/zinc/39/55/55/884395555.db2.gz DHOAEVPFLRSJAY-KSSFIOAISA-N 0 3 416.484 4.104 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2ccccc2O[C@H]2CCOC2)N2CCCC2)cc1 ZINC000470261853 884606490 /nfs/dbraw/zinc/60/64/90/884606490.db2.gz WMVMVUKEVZOIBR-UNMCSNQZSA-N 0 3 409.530 4.121 20 0 HIADHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)N1CCC[C@H](c2nccs2)C1 ZINC000470279145 884640374 /nfs/dbraw/zinc/64/03/74/884640374.db2.gz JDTKHPNOTLQLCN-VQTJNVASSA-N 0 3 400.592 4.189 20 0 HIADHN Cc1cccc(NC(=O)C[C@H](C)N[C@H](Cn2ccccc2=O)c2ccccc2)c1C ZINC000503927305 912868487 /nfs/dbraw/zinc/86/84/87/912868487.db2.gz PDIMCZWOSIQLED-WMZHIEFXSA-N 0 3 403.526 4.213 20 0 HIADHN Cc1cc(C(=O)Nc2ccc(C(=O)N(C)[C@@H]3CCCN(C)C3)cc2)c(Cl)cc1F ZINC000470467729 884860282 /nfs/dbraw/zinc/86/02/82/884860282.db2.gz QNNJDCXXIQZDQQ-QGZVFWFLSA-N 0 3 417.912 4.206 20 0 HIADHN C[C@H](NC(=O)N[C@H]1CCN(Cc2ccccc2)C1)c1ccc(-c2ccncc2)cc1 ZINC000470480921 884869190 /nfs/dbraw/zinc/86/91/90/884869190.db2.gz ZIYVWYUGUBNJPZ-CYFREDJKSA-N 0 3 400.526 4.383 20 0 HIADHN C/C(=C\c1ccccc1C(F)(F)F)CN(C)[C@@H](C)c1cccc(S(N)(=O)=O)c1 ZINC000503957116 912883451 /nfs/dbraw/zinc/88/34/51/912883451.db2.gz DXWXZZGHMPUEJY-GOFCXVBSSA-N 0 3 412.477 4.449 20 0 HIADHN CN(C(=O)c1cnn(-c2cccc(Cl)c2)c1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470661389 885086716 /nfs/dbraw/zinc/08/67/16/885086716.db2.gz XISAFBHGEBTWLA-JOCHJYFZSA-N 0 3 408.933 4.262 20 0 HIADHN CSc1nccn1-c1ccc(C(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000470675982 885106425 /nfs/dbraw/zinc/10/64/25/885106425.db2.gz WJPWDEUDJVDWPN-JOCHJYFZSA-N 0 3 420.582 4.331 20 0 HIADHN COc1ccc([C@H](NC(=O)NC[C@H](c2cccc(OC)c2)N2CCCC2)C2CC2)cc1 ZINC000503992960 912902256 /nfs/dbraw/zinc/90/22/56/912902256.db2.gz MQULMQXZQGZVRS-DNQXCXABSA-N 0 3 423.557 4.291 20 0 HIADHN CN(C(=O)N[C@H]1CCOc2c(Cl)cccc21)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470718865 885160433 /nfs/dbraw/zinc/16/04/33/885160433.db2.gz YMAGIXWUGYUQHX-NQIIRXRSSA-N 0 3 413.949 4.470 20 0 HIADHN CN(CCCCNC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1)c1ccccc1 ZINC000470718512 885160739 /nfs/dbraw/zinc/16/07/39/885160739.db2.gz TWCPUUYNQHVPJT-XMMPIXPASA-N 0 3 408.590 4.209 20 0 HIADHN C[C@H](OCCCNC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1)c1ccccc1 ZINC000470740440 885199973 /nfs/dbraw/zinc/19/99/73/885199973.db2.gz MEEQFUHJUOBFEO-URXFXBBRSA-N 0 3 409.574 4.460 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CC[C@H](COc2ccccc2)C1)c1ccsc1 ZINC000504010959 912916297 /nfs/dbraw/zinc/91/62/97/912916297.db2.gz XZRKLGOCXXTFHU-RXVVDRJESA-N 0 3 401.576 4.242 20 0 HIADHN CN(Cc1ccc(F)c(Br)c1)C[C@@H]1C[C@H](F)CN1Cc1nccs1 ZINC000470814228 885302167 /nfs/dbraw/zinc/30/21/67/885302167.db2.gz XAAOYEWWILHGIF-KBPBESRZSA-N 0 3 416.335 4.089 20 0 HIADHN Cc1ccc(C2(C(=O)N(C)[C@@H]3CCCN(Cc4ccccc4)C3)CCOCC2)cc1 ZINC000470812744 885302634 /nfs/dbraw/zinc/30/26/34/885302634.db2.gz NJWBBLCEWUKTAM-XMMPIXPASA-N 0 3 406.570 4.166 20 0 HIADHN CC[C@@H]1CN(C[C@H](O)COc2ccc(C(C)=O)cc2OC)CC[C@@H]1c1ccccc1 ZINC000470872745 885361001 /nfs/dbraw/zinc/36/10/01/885361001.db2.gz KPUHZAAOYUBLOS-OIBXWCBGSA-N 0 3 411.542 4.153 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)c2[nH]c3ccccc3c2Br)o1 ZINC000504025549 912929637 /nfs/dbraw/zinc/92/96/37/912929637.db2.gz MFOCSFJRWKOLDW-UHFFFAOYSA-N 0 3 404.308 4.036 20 0 HIADHN O=C(CCc1cnc2ccccc2c1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000470896459 885394994 /nfs/dbraw/zinc/39/49/94/885394994.db2.gz FROXCGKUBJJOHH-UHFFFAOYSA-N 0 3 405.567 4.397 20 0 HIADHN CN(C(=O)NCc1ccccc1OCC1CC1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470898269 885398134 /nfs/dbraw/zinc/39/81/34/885398134.db2.gz CKMYIOGLRZJZIK-QHCPKHFHSA-N 0 3 407.558 4.281 20 0 HIADHN Cc1cc(Br)cc(C)c1NC(=O)CCCN1C[C@@H](C)O[C@@H](C2CC2)C1 ZINC000470928742 885434641 /nfs/dbraw/zinc/43/46/41/885434641.db2.gz GXBQYJMWYOOVEP-CRAIPNDOSA-N 0 3 409.368 4.284 20 0 HIADHN CCOc1ccc(NC(=O)N(CCN(C)C)Cc2ccccn2)c(C(F)(F)F)c1 ZINC000504035555 912940416 /nfs/dbraw/zinc/94/04/16/912940416.db2.gz KTRKBUZIWSLTRI-UHFFFAOYSA-N 0 3 410.440 4.095 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1ccc2oc(C)nc2c1 ZINC000471048729 885560364 /nfs/dbraw/zinc/56/03/64/885560364.db2.gz WJMNCUXZROKGMP-HXUWFJFHSA-N 0 3 415.497 4.340 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)NCc2nnc(-c3ccccc3)s2)N2CCCC2)cc1 ZINC000471066815 885584031 /nfs/dbraw/zinc/58/40/31/885584031.db2.gz QXSJFXUVODXWIR-HXUWFJFHSA-N 0 3 421.570 4.150 20 0 HIADHN Cc1ccc([C@H](CNC(=O)NCc2nnc(-c3ccccc3)s2)N2CCCC2)cc1 ZINC000471066811 885584083 /nfs/dbraw/zinc/58/40/83/885584083.db2.gz QXSJFXUVODXWIR-FQEVSTJZSA-N 0 3 421.570 4.150 20 0 HIADHN O=C(Nc1ccccc1N1CCCC1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000471114398 885650604 /nfs/dbraw/zinc/65/06/04/885650604.db2.gz DSQGNKXNRGZFCX-UHFFFAOYSA-N 0 3 410.484 4.214 20 0 HIADHN CSc1nc(C(C)(C)C)nc(C)c1C(=O)N[C@H](C)[C@@H](c1ccccc1)N(C)C ZINC000471137190 885677813 /nfs/dbraw/zinc/67/78/13/885677813.db2.gz OFKKCGXGJFJBPW-QAPCUYQASA-N 0 3 400.592 4.226 20 0 HIADHN Cc1cc(CSc2ncccc2C(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)no1 ZINC000471139427 885681386 /nfs/dbraw/zinc/68/13/86/885681386.db2.gz HDPZJWLLIBRQBU-OXQOHEQNSA-N 0 3 410.543 4.092 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3ccc(F)cc3F)c(OCC)c2)CC1 ZINC000471172303 885730300 /nfs/dbraw/zinc/73/03/00/885730300.db2.gz HNLZFFIFOSWBMX-UHFFFAOYSA-N 0 3 403.473 4.148 20 0 HIADHN CC[NH+](CC)CCN(Cc1ccccc1)Cc1nc2c3ccccc3oc2c(=O)[n-]1 ZINC000471173652 885731583 /nfs/dbraw/zinc/73/15/83/885731583.db2.gz STPWZZOYKHMSER-UHFFFAOYSA-N 0 3 404.514 4.426 20 0 HIADHN CCC(CC)c1nnc(NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)s1 ZINC000471185201 885751937 /nfs/dbraw/zinc/75/19/37/885751937.db2.gz GEXJEWYEIDVUIY-UHFFFAOYSA-N 0 3 419.517 4.369 20 0 HIADHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)Nc1nnc(-c2ccc(Cl)cc2F)s1 ZINC000471304225 885892872 /nfs/dbraw/zinc/89/28/72/885892872.db2.gz NUWGECLQVKXMHB-OLZOCXBDSA-N 0 3 409.918 4.088 20 0 HIADHN C[C@@H](CNC(=O)Nc1cc(-c2ccccc2)ccc1Cl)CN1CCN(C)CC1 ZINC000471412071 886064751 /nfs/dbraw/zinc/06/47/51/886064751.db2.gz FTGCGVVYZRKTMD-KRWDZBQOSA-N 0 3 400.954 4.012 20 0 HIADHN O[C@H](COc1cccc2[nH]ccc21)CN1CCC(c2nc3ccccc3s2)CC1 ZINC000471432094 886090320 /nfs/dbraw/zinc/09/03/20/886090320.db2.gz QUJMQDKEDZXFSU-KRWDZBQOSA-N 0 3 407.539 4.397 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)N[C@H]2C[C@H](c3ccc(Cl)cc3)C2)cc1 ZINC000504104292 913014771 /nfs/dbraw/zinc/01/47/71/913014771.db2.gz PZSKKTLFAZCZRT-CUWPLCDZSA-N 0 3 401.938 4.197 20 0 HIADHN C[C@@H](NC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1)c1ccccc1-n1cccn1 ZINC000471487160 886184847 /nfs/dbraw/zinc/18/48/47/886184847.db2.gz GCWYRVSUPOSOHC-IFMALSPDSA-N 0 3 417.557 4.239 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N(C)CC1CCOCC1)c1ccc(C(F)(F)F)cc1 ZINC000504108656 913018582 /nfs/dbraw/zinc/01/85/82/913018582.db2.gz GXQLVPPUMHZSLU-IBGZPJMESA-N 0 3 415.500 4.156 20 0 HIADHN Cc1cc(NC(=O)C(C)(C)C)sc1C(=O)N[C@H](C)[C@H](c1ccccc1)N(C)C ZINC000471528062 886231421 /nfs/dbraw/zinc/23/14/21/886231421.db2.gz DEXNSGNJDANQOM-CRAIPNDOSA-N 0 3 401.576 4.462 20 0 HIADHN C[C@H](NC(=O)Cc1csc2nc(-c3ccccc3)cn12)[C@H](c1ccccc1)N(C)C ZINC000471552137 886260114 /nfs/dbraw/zinc/26/01/14/886260114.db2.gz QJZJZCSLQKKXBQ-GAJHUEQPSA-N 0 3 418.566 4.413 20 0 HIADHN C[C@@H](NC(=O)[C@H](C)Oc1ccccc1Br)[C@H](c1ccccc1)N(C)C ZINC000471569496 886279007 /nfs/dbraw/zinc/27/90/07/886279007.db2.gz HOJNGFTZORDMAN-ZRGWGRIASA-N 0 3 405.336 4.024 20 0 HIADHN C[C@H](CCCCN1C(=O)c2ccccc2C1=O)NCc1csc(-c2ccco2)n1 ZINC000471600233 886314941 /nfs/dbraw/zinc/31/49/41/886314941.db2.gz AXBGZJYDIMWXNW-OAHLLOKOSA-N 0 3 409.511 4.348 20 0 HIADHN CCN(C(=O)Nc1cccc(NC(=O)N(C)C)c1C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000471631277 886349171 /nfs/dbraw/zinc/34/91/71/886349171.db2.gz GZYGDRUANHEJKA-HXUWFJFHSA-N 0 3 423.561 4.217 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)Cc3csc(-c4ccc(C)o4)n3)c2)CC1 ZINC000471652233 886367979 /nfs/dbraw/zinc/36/79/79/886367979.db2.gz IHXAVJBJZLTLKY-UHFFFAOYSA-N 0 3 410.543 4.035 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)c3ncoc3-c3ccccc3Cl)c2)CC1 ZINC000471654853 886370228 /nfs/dbraw/zinc/37/02/28/886370228.db2.gz SYTMRAHQCXRWOR-UHFFFAOYSA-N 0 3 410.905 4.389 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCC[C@](C)(O)CC1)c1ccc(C(F)(F)F)cc1 ZINC000471721587 886434533 /nfs/dbraw/zinc/43/45/33/886434533.db2.gz WBKWOFINEYRPRT-QUCCMNQESA-N 0 3 415.500 4.035 20 0 HIADHN CC(C)(C)OCc1cc(C(=O)N[C@@H](CN2CCc3ccccc3C2)C(C)(C)C)no1 ZINC000471747764 886474182 /nfs/dbraw/zinc/47/41/82/886474182.db2.gz NAOGZJIWNFTVTB-NRFANRHFSA-N 0 3 413.562 4.193 20 0 HIADHN CSc1nc(C(C)(C)C)nc(C)c1C(=O)NC[C@H](c1ccc(C)cc1)N(C)C ZINC000471756742 886488596 /nfs/dbraw/zinc/48/85/96/886488596.db2.gz PMCGCPCBYGJBNJ-QGZVFWFLSA-N 0 3 400.592 4.146 20 0 HIADHN CCc1ccc([C@H](NCCC(O)(CC)CC)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000471796971 886532249 /nfs/dbraw/zinc/53/22/49/886532249.db2.gz FFZCXXXQCWALOA-QFIPXVFZSA-N 0 3 403.588 4.273 20 0 HIADHN COC(=O)c1cc(NC(=O)NC[C@H](c2cccs2)N2CCCC2)c(C)cc1C ZINC000471831638 886583947 /nfs/dbraw/zinc/58/39/47/886583947.db2.gz FXUFUGXAPLFGAF-GOSISDBHSA-N 0 3 401.532 4.110 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N[C@@H]1CCCOc2ccccc21 ZINC000471837642 886593979 /nfs/dbraw/zinc/59/39/79/886593979.db2.gz KIFSCIDCVVSQRZ-LEOMRAHMSA-N 0 3 411.468 4.005 20 0 HIADHN COc1ccc(OC)c(NC(=O)[C@H](C)N[C@@H]2C[C@H](OCc3ccccc3)C2(C)C)c1 ZINC000471860753 886635335 /nfs/dbraw/zinc/63/53/35/886635335.db2.gz YIWUIQZVBRMOLR-USCONSEESA-N 0 3 412.530 4.004 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)Nc1ccc(Cl)cc1-n1cccn1 ZINC000471891907 886673563 /nfs/dbraw/zinc/67/35/63/886673563.db2.gz DBCLPZKYYSNVBY-UHFFFAOYSA-N 0 3 415.900 4.261 20 0 HIADHN C[C@]1(NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)CCCc2ccccc21 ZINC000471897035 886679336 /nfs/dbraw/zinc/67/93/36/886679336.db2.gz QLXGSIPTIQVELU-NGICGMGXSA-N 0 3 409.496 4.343 20 0 HIADHN CC(C)C1CCC(N2CCN(C(=O)CCc3nnc(C4CCCC4)o3)CC2)CC1 ZINC000471902949 886684673 /nfs/dbraw/zinc/68/46/73/886684673.db2.gz OUKJMHZSQIGZOK-UHFFFAOYSA-N 0 3 402.583 4.019 20 0 HIADHN Cc1cccnc1[C@@H](NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1)C(C)C ZINC000471915553 886703519 /nfs/dbraw/zinc/70/35/19/886703519.db2.gz RCWGWCPNKTVRMQ-ABHNRTSZSA-N 0 3 412.500 4.192 20 0 HIADHN CCCc1cccc(C(C)C)c1NC(=O)N1CC[C@@H](N2CCN(C)CC2)[C@H](C)C1 ZINC000471922368 886712247 /nfs/dbraw/zinc/71/22/47/886712247.db2.gz YJGFQKZVGALEGL-DENIHFKCSA-N 0 3 400.611 4.252 20 0 HIADHN CCCc1c(NC(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)cnn1-c1cc(C)ccn1 ZINC000471955903 886768508 /nfs/dbraw/zinc/76/85/08/886768508.db2.gz SHTCWLXOGJSHQY-XXBNENTESA-N 0 3 418.545 4.095 20 0 HIADHN CN(CCNC(=O)N[C@H](c1cccc(Cl)c1)c1ccccn1)Cc1ccccc1 ZINC000471989241 886816364 /nfs/dbraw/zinc/81/63/64/886816364.db2.gz SHXWCVGXGHZLRW-JOCHJYFZSA-N 0 3 408.933 4.256 20 0 HIADHN C[C@H](CNC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1)Sc1ccccc1 ZINC000472013122 886835927 /nfs/dbraw/zinc/83/59/27/886835927.db2.gz PRZNQMAWTADFAG-ODIFPOPNSA-N 0 3 415.525 4.272 20 0 HIADHN O=C(NCc1cc(Br)ccc1F)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000504205699 913085041 /nfs/dbraw/zinc/08/50/41/913085041.db2.gz VOVRTGAHISSLGO-IBGZPJMESA-N 0 3 420.326 4.225 20 0 HIADHN Clc1cnc(CNCC2(c3ccc(Br)cc3)CCOCC2)s1 ZINC000472050461 886864291 /nfs/dbraw/zinc/86/42/91/886864291.db2.gz YYDCWQUTBSWMKC-UHFFFAOYSA-N 0 3 401.757 4.397 20 0 HIADHN COc1ccccc1[C@@H](CNCc1nc2c(s1)CN(C(C)C)CC2)OC(C)C ZINC000472076073 886878521 /nfs/dbraw/zinc/87/85/21/886878521.db2.gz TUBFIUXRWXAFEQ-HXUWFJFHSA-N 0 3 403.592 4.174 20 0 HIADHN COc1ccc([C@H](NC[C@@H](O)CCOC(C)C)c2ccccc2)cc1Br ZINC000472165004 886963188 /nfs/dbraw/zinc/96/31/88/886963188.db2.gz WOIMEINPADNOMK-GHTZIAJQSA-N 0 3 422.363 4.313 20 0 HIADHN COc1ccc(OC)c([C@@H]2C[C@@H]2C(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)c1 ZINC000472230723 887037416 /nfs/dbraw/zinc/03/74/16/887037416.db2.gz HIKCBDDRUVTHKG-PMVMPFDFSA-N 0 3 408.542 4.069 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)N[C@@H]3CC[N@@H+]([C@@H](C)c4ccccc4)C3)cc2)cc(=O)[n-]1 ZINC000504234920 913106182 /nfs/dbraw/zinc/10/61/82/913106182.db2.gz FLTGQPFWSOEDSD-HRAATJIYSA-N 0 3 417.513 4.115 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)N[C@@H]3CC[N@H+]([C@@H](C)c4ccccc4)C3)cc2)cc(=O)[n-]1 ZINC000504234920 913106185 /nfs/dbraw/zinc/10/61/85/913106185.db2.gz FLTGQPFWSOEDSD-HRAATJIYSA-N 0 3 417.513 4.115 20 0 HIADHN C[C@H](Oc1ccc2ccccc2c1)C(=O)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000472257803 887067962 /nfs/dbraw/zinc/06/79/62/887067962.db2.gz LXAMWWPOHYUHKE-SFHVURJKSA-N 0 3 404.510 4.203 20 0 HIADHN CSc1ccccc1NC(=O)CCN1CCCC[C@H]1CNC(=O)c1ccccc1 ZINC000472275142 887090466 /nfs/dbraw/zinc/09/04/66/887090466.db2.gz ISBOUSJCKPRIEH-IBGZPJMESA-N 0 3 411.571 4.022 20 0 HIADHN Cc1ccccc1C1(CNC(=O)N(CCN(C)C)Cc2ccccn2)CCCCC1 ZINC000504244374 913112576 /nfs/dbraw/zinc/11/25/76/913112576.db2.gz DRFHQIWYXDBZNM-UHFFFAOYSA-N 0 3 408.590 4.365 20 0 HIADHN CC(C)OCCOCc1cccc(NC(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)c1 ZINC000472303822 887126275 /nfs/dbraw/zinc/12/62/75/887126275.db2.gz FTHJUQJEBCSFAP-DHIUTWEWSA-N 0 3 411.546 4.195 20 0 HIADHN CCN(CC)C(=O)c1ccc(NC(=O)CN2CC[C@@H](Cc3ccccc3)[C@@H]2C)cc1 ZINC000472343435 887178249 /nfs/dbraw/zinc/17/82/49/887178249.db2.gz AHFFMPXYTAORKL-UGKGYDQZSA-N 0 3 407.558 4.060 20 0 HIADHN CC[C@@H]1CN(CCC(=O)Nc2ccccc2-c2ccccc2)[C@@H](CC)CN1C(C)=O ZINC000472344448 887178733 /nfs/dbraw/zinc/17/87/33/887178733.db2.gz TUXQIOIMQDAYHF-FCHUYYIVSA-N 0 3 407.558 4.404 20 0 HIADHN C[C@@H](Cc1ccc(Cl)cc1Cl)NC(=O)N(CCN(C)C)Cc1ccccn1 ZINC000504269689 913129047 /nfs/dbraw/zinc/12/90/47/913129047.db2.gz BZFPSYARBOKAHL-HNNXBMFYSA-N 0 3 409.361 4.093 20 0 HIADHN Cc1ccccc1[C@@H]1CCN(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)C1 ZINC000472453611 887307401 /nfs/dbraw/zinc/30/74/01/887307401.db2.gz FLGSSOFVVDEFTD-IPJUCJBFSA-N 0 3 409.496 4.299 20 0 HIADHN COCCCC[C@H](NC(=O)N1CCCN(Cc2ccccc2)CC1)c1ccccc1 ZINC000472453606 887307622 /nfs/dbraw/zinc/30/76/22/887307622.db2.gz NWKPZUYFIGAYOS-DEOSSOPVSA-N 0 3 409.574 4.462 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N1CCC[C@@H]1c1ccsc1 ZINC000472454678 887309403 /nfs/dbraw/zinc/30/94/03/887309403.db2.gz PAYZWWXPSXFHCK-OFLPRAFFSA-N 0 3 401.498 4.400 20 0 HIADHN CC1(C)CN(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)Cc2ccccc21 ZINC000472456864 887311121 /nfs/dbraw/zinc/31/11/21/887311121.db2.gz PUJKQKHKIVXMJY-UHFFFAOYSA-N 0 3 409.496 4.295 20 0 HIADHN COCCCC[C@H](NC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1)c1ccccc1 ZINC000472458989 887316509 /nfs/dbraw/zinc/31/65/09/887316509.db2.gz YWDLFSCKJWXKEK-RPWUZVMVSA-N 0 3 409.574 4.460 20 0 HIADHN Cc1ccc([C@H](NC(=O)N(CCN(C)C)Cc2ccccc2F)c2ccccn2)cc1 ZINC000472475409 887336447 /nfs/dbraw/zinc/33/64/47/887336447.db2.gz KYXKFAUORUTTCO-DEOSSOPVSA-N 0 3 420.532 4.392 20 0 HIADHN Cc1ccc([C@H](NC(=O)N2CCCN(Cc3ccccc3)CC2)c2ccccn2)cc1 ZINC000472483939 887349967 /nfs/dbraw/zinc/34/99/67/887349967.db2.gz GVCWZKUWIOPRDF-VWLOTQADSA-N 0 3 414.553 4.397 20 0 HIADHN Cc1ccc([C@@H](NC(=O)N(CCN(C)C)Cc2ccccc2)c2ccccn2)cc1 ZINC000472484366 887350171 /nfs/dbraw/zinc/35/01/71/887350171.db2.gz CWIYPNUBMYJGMF-XMMPIXPASA-N 0 3 402.542 4.253 20 0 HIADHN COc1c(F)cc(F)cc1NC(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000472527706 887398345 /nfs/dbraw/zinc/39/83/45/887398345.db2.gz MKNXZGMMEFLUIA-IBGZPJMESA-N 0 3 414.374 4.367 20 0 HIADHN CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)N[C@@H]1CC[C@@H](c2ccc(F)cc2)C1 ZINC000472527995 887399656 /nfs/dbraw/zinc/39/96/56/887399656.db2.gz NSIBRFMZMUKSND-IYSOMAHNSA-N 0 3 410.537 4.191 20 0 HIADHN Cc1cc(C)n(-c2ccccc2CNC(=O)NC[C@H](c2ccccc2)N2CCCC2)n1 ZINC000472717043 887566012 /nfs/dbraw/zinc/56/60/12/887566012.db2.gz ZLZATGLRMFKTFY-XMMPIXPASA-N 0 3 417.557 4.125 20 0 HIADHN COc1cc(NC(=O)NC[C@@H](c2cccs2)N2CCCC2)ccc1Br ZINC000472824982 887670372 /nfs/dbraw/zinc/67/03/72/887670372.db2.gz GOJYHPDKVGXYFR-HNNXBMFYSA-N 0 3 424.364 4.478 20 0 HIADHN C[C@@H](CCN1CCN(C)CC1)NC(=O)N[C@@H](CC(C)(C)C)c1ccc(Cl)cc1 ZINC000472903558 887750333 /nfs/dbraw/zinc/75/03/33/887750333.db2.gz KRIQBXCYJBJYGM-PXNSSMCTSA-N 0 3 409.018 4.143 20 0 HIADHN C[C@@H](CCN1CCN(C)CC1)NC(=O)N[C@H](c1cccc(Cl)c1)C1CCCCC1 ZINC000472905779 887752821 /nfs/dbraw/zinc/75/28/21/887752821.db2.gz WPKDMUSJJBCHCW-AVRDEDQJSA-N 0 3 421.029 4.287 20 0 HIADHN CC1CCN([C@H](CNC(=O)N2CC[C@]3(C2)OCc2ccccc23)c2ccccc2)CC1 ZINC000472924824 887771750 /nfs/dbraw/zinc/77/17/50/887771750.db2.gz HOQSDGRUNCWTIC-AOYPEHQESA-N 0 3 419.569 4.301 20 0 HIADHN CCC(=O)c1ccc(OCCCCC(=O)N2CCN(C3CCCCC3)CC2)cc1 ZINC000473086169 887899437 /nfs/dbraw/zinc/89/94/37/887899437.db2.gz NJYMCUWEUJXWSU-UHFFFAOYSA-N 0 3 400.563 4.305 20 0 HIADHN O[C@@H](COc1ccc(-c2ccccc2)cc1)CN1CC[C@]2(C1)OCc1ccccc12 ZINC000473153460 887932535 /nfs/dbraw/zinc/93/25/35/887932535.db2.gz VNDOBVYGBKIVSU-ZEQKJWHPSA-N 0 3 401.506 4.225 20 0 HIADHN O[C@H](COc1ccc(-c2ccccc2)cc1)CN1CC[C@@]2(C1)OCc1ccccc12 ZINC000473153459 887933253 /nfs/dbraw/zinc/93/32/53/887933253.db2.gz VNDOBVYGBKIVSU-OZXSUGGESA-N 0 3 401.506 4.225 20 0 HIADHN O=C(CCN1CC[C@]2(C1)OCc1ccccc12)N[C@@H](c1cccs1)c1ccccc1 ZINC000473155588 887933759 /nfs/dbraw/zinc/93/37/59/887933759.db2.gz AWBHWPFSKKEXTM-JWQCQUIFSA-N 0 3 418.562 4.475 20 0 HIADHN CCOc1ccc(C(=O)CCC(=O)NC2[C@@H](C)CN(Cc3ccccc3)C[C@@H]2C)cc1 ZINC000473284320 888040656 /nfs/dbraw/zinc/04/06/56/888040656.db2.gz QOMHMLJGODSHJA-PMACEKPBSA-N 0 3 422.569 4.321 20 0 HIADHN COc1ccc([C@@H](CNC(=O)C[C@H](c2cccs2)n2cccc2)N2CCCC2)cc1 ZINC000473291107 888044511 /nfs/dbraw/zinc/04/45/11/888044511.db2.gz JRJZHCFYOXNTQO-FGZHOGPDSA-N 0 3 423.582 4.491 20 0 HIADHN COc1c(CNC(=O)NC[C@@H](c2ccc(OC)cc2)N2CCCC2)oc2ccccc21 ZINC000473404005 888119787 /nfs/dbraw/zinc/11/97/87/888119787.db2.gz DGFNZQYYCJAIMA-FQEVSTJZSA-N 0 3 423.513 4.086 20 0 HIADHN COC(=O)C1CCN(CCCNC(=O)C(C)(C)c2ccc(-c3ccccc3)cc2)CC1 ZINC000504398035 913218949 /nfs/dbraw/zinc/21/89/49/913218949.db2.gz ASUIQXZSUUVFAY-UHFFFAOYSA-N 0 3 422.569 4.023 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1cc(Br)ccc1F ZINC000473517035 888248313 /nfs/dbraw/zinc/24/83/13/888248313.db2.gz GGZKQOKLPWSUME-UHFFFAOYSA-N 0 3 423.248 4.123 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1ccc([C@@H]2CCCOC2)cc1 ZINC000473520119 888252916 /nfs/dbraw/zinc/25/29/16/888252916.db2.gz OHWUVDWFCBSLJY-QHGAOEGBSA-N 0 3 410.480 4.116 20 0 HIADHN O=C(CCc1cncc2ccccc21)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473525182 888261600 /nfs/dbraw/zinc/26/16/00/888261600.db2.gz OWQGGKBSVAMNRU-UHFFFAOYSA-N 0 3 405.464 4.089 20 0 HIADHN O=C(CCc1ccnc2ccccc12)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473527950 888265870 /nfs/dbraw/zinc/26/58/70/888265870.db2.gz UXTWGERQPTXUQH-UHFFFAOYSA-N 0 3 405.464 4.089 20 0 HIADHN O=C(COc1cccc(C(F)(F)F)c1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473529390 888266369 /nfs/dbraw/zinc/26/63/69/888266369.db2.gz WEBFZASNJHEFOS-UHFFFAOYSA-N 0 3 424.385 4.006 20 0 HIADHN Cc1onc(-c2ccccc2)c1C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473528763 888267028 /nfs/dbraw/zinc/26/70/28/888267028.db2.gz WDNQLDYUONHLFZ-UHFFFAOYSA-N 0 3 407.436 4.185 20 0 HIADHN COc1ccc2c(c1)CCC[C@@H]2CC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473534393 888271048 /nfs/dbraw/zinc/27/10/48/888271048.db2.gz YIAYKVGPWTZZDC-IPJUCJBFSA-N 0 3 424.507 4.427 20 0 HIADHN Cc1cc2c(o1)c(C(=O)N(CCN(C)C)Cc1ccccn1)ccc2Br ZINC000473586674 888329518 /nfs/dbraw/zinc/32/95/18/888329518.db2.gz JCJOFTDNIMDGON-UHFFFAOYSA-N 0 3 416.319 4.103 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)c1noc2c1CCCCC2 ZINC000473642342 888388604 /nfs/dbraw/zinc/38/86/04/888388604.db2.gz MCJJRLULIPFMFT-UHFFFAOYSA-N 0 3 409.452 4.166 20 0 HIADHN C[C@H](N[C@H]1CCN(c2ccc(Cl)cc2Cl)C1=O)c1ccc(-n2ccnn2)cc1 ZINC000473680488 888446906 /nfs/dbraw/zinc/44/69/06/888446906.db2.gz VNUQHDOBPGPHNE-UGSOOPFHSA-N 0 3 416.312 4.030 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CCC[C@]3(C)Cc3ccccc3)c2)CC1 ZINC000473814761 888639922 /nfs/dbraw/zinc/63/99/22/888639922.db2.gz BASYQQBMMFNJIY-RUZDIDTESA-N 0 3 406.574 4.458 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)NC[C@@H](C)c3ccc(F)cc3F)c2)CC1 ZINC000473818250 888647270 /nfs/dbraw/zinc/64/72/70/888647270.db2.gz NHPAHHQBVYMDIV-MRXNPFEDSA-N 0 3 402.489 4.032 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CC[C@H](Cc4ccccc4)[C@@H]3C)c2)CC1 ZINC000473826569 888660247 /nfs/dbraw/zinc/66/02/47/888660247.db2.gz FOFGWDNJNRZKNX-RBBKRZOGSA-N 0 3 406.574 4.314 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@@H]3CCC[C@@H]3OCc3ccccc3)c2)CC1 ZINC000473830277 888663708 /nfs/dbraw/zinc/66/37/08/888663708.db2.gz PCPBGTUODIASST-RPWUZVMVSA-N 0 3 422.573 4.088 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)NCc3ccc(-c4cccnc4)cc3)c2)CC1 ZINC000473831412 888665016 /nfs/dbraw/zinc/66/50/16/888665016.db2.gz VTPKSTZWNWCOSM-UHFFFAOYSA-N 0 3 415.541 4.212 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CCSC4(CCCCC4)C3)c2)CC1 ZINC000473834481 888670016 /nfs/dbraw/zinc/67/00/16/888670016.db2.gz HJDFNQHKWXISKZ-UHFFFAOYSA-N 0 3 402.608 4.112 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CCC(Nc4cccc(C)c4)CC3)c2)CC1 ZINC000473838810 888678801 /nfs/dbraw/zinc/67/88/01/888678801.db2.gz YKTBIKZKKWUSTO-UHFFFAOYSA-N 0 3 421.589 4.245 20 0 HIADHN C[C@@H](NC(=O)NC[C@@H](c1ccccc1)N1CCCC1)c1ccc(Br)cn1 ZINC000473967424 888835397 /nfs/dbraw/zinc/83/53/97/888835397.db2.gz YLULORIHDIVEMF-BEFAXECRSA-N 0 3 417.351 4.041 20 0 HIADHN CC(=O)Nc1ccc(CN[C@H]2CCCN(c3ccc(Cl)cc3Cl)C2=O)cc1 ZINC000474008633 888866272 /nfs/dbraw/zinc/86/62/72/888866272.db2.gz HFFIIADSZALKLW-SFHVURJKSA-N 0 3 406.313 4.237 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N[C@@H](C)c2noc(-c3ccccc3)n2)N2CCCC2)cc1 ZINC000474015757 888870352 /nfs/dbraw/zinc/87/03/52/888870352.db2.gz WHWRMAJKBAHVPG-GHTZIAJQSA-N 0 3 419.529 4.242 20 0 HIADHN CC[C@H](C)[C@H](NC(=O)NC(C)(C)CCN1CCN(C)CC1)c1ccc(Cl)cc1 ZINC000474041365 888885232 /nfs/dbraw/zinc/88/52/32/888885232.db2.gz YTAYILMLCLKHKL-PXNSSMCTSA-N 0 3 409.018 4.143 20 0 HIADHN COc1ccc2c(c1)C(C)(C)C[C@@H]2NCc1ccc(S(=O)(=O)N(C)C(C)C)cc1 ZINC000474048417 888888552 /nfs/dbraw/zinc/88/85/52/888888552.db2.gz SADVEZATYNBJTC-QFIPXVFZSA-N 0 3 416.587 4.236 20 0 HIADHN COc1ccc2c(c1)C(C)(C)C[C@H]2NCc1cccc(NC(=O)Cn2cccn2)c1 ZINC000474057154 888893214 /nfs/dbraw/zinc/89/32/14/888893214.db2.gz OKHOSIJPJGHJAW-JOCHJYFZSA-N 0 3 404.514 4.043 20 0 HIADHN C[C@H](N[C@H]1CCN(c2ccc(Cl)cc2Cl)C1=O)c1ccc(-n2cncn2)cc1 ZINC000474090169 888915821 /nfs/dbraw/zinc/91/58/21/888915821.db2.gz RKBGWQCFGHMXFQ-UGSOOPFHSA-N 0 3 416.312 4.030 20 0 HIADHN O=C(c1cc(=O)[nH]c(C2CC2)c1)N1CCN(Cc2ccccc2)C2(CCCCC2)C1 ZINC000474111738 888933086 /nfs/dbraw/zinc/93/30/86/888933086.db2.gz AFEMBQGZKUUWEK-UHFFFAOYSA-N 0 3 405.542 4.326 20 0 HIADHN O=S(=O)([N-]C1CC[NH+](C2CCCCC2)CC1)c1ccc(Cl)cc1C(F)(F)F ZINC000474215986 889055166 /nfs/dbraw/zinc/05/51/66/889055166.db2.gz KYMHWKCIBHNOPA-UHFFFAOYSA-N 0 3 424.916 4.434 20 0 HIADHN CSc1nc(-c2ccco2)nc(C)c1C(=O)NC[C@H](c1ccc(C)cc1)N(C)C ZINC000474295050 889159792 /nfs/dbraw/zinc/15/97/92/889159792.db2.gz BDDJFVLIPGNCBP-QGZVFWFLSA-N 0 3 410.543 4.108 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cc(-c4ccc(F)cc4)on3)c(C)c2)CC1 ZINC000474373045 889249423 /nfs/dbraw/zinc/24/94/23/889249423.db2.gz MRUHPLWPIFNCPF-UHFFFAOYSA-N 0 3 408.477 4.183 20 0 HIADHN Cc1ccc(CN2CCSCC2)cc1NCc1ccc(Cl)cc1-n1cncn1 ZINC000474376149 889253211 /nfs/dbraw/zinc/25/32/11/889253211.db2.gz LFXZZVIAWLLBOR-UHFFFAOYSA-N 0 3 413.978 4.390 20 0 HIADHN Cc1csc(N2CCC(N[C@H]3COc4cc(F)c(Br)cc43)CC2)n1 ZINC000504556661 913329459 /nfs/dbraw/zinc/32/94/59/913329459.db2.gz WJZFNKQHCZEAIM-HNNXBMFYSA-N 0 3 412.328 4.045 20 0 HIADHN COCCOc1c(Cl)cccc1NC(=O)N[C@H](C)[C@H](c1ccccc1)N(C)C ZINC000474428757 889294598 /nfs/dbraw/zinc/29/45/98/889294598.db2.gz DFULEYAIGOXGTH-DNVCBOLYSA-N 0 3 405.926 4.178 20 0 HIADHN CCOc1cc(CNCc2ccc(Cl)cc2-n2cncn2)ccc1OC(F)F ZINC000474476646 889337210 /nfs/dbraw/zinc/33/72/10/889337210.db2.gz XCJBCGYKFMIOAH-UHFFFAOYSA-N 0 3 408.836 4.211 20 0 HIADHN CC(C)CC(=O)Nc1ccc(NC(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000474708724 889567353 /nfs/dbraw/zinc/56/73/53/889567353.db2.gz FPVJKIRIFLGNOJ-QFIPXVFZSA-N 0 3 408.546 4.409 20 0 HIADHN Cc1cc(C)n(-c2ccccc2NC(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000474716800 889574414 /nfs/dbraw/zinc/57/44/14/889574414.db2.gz ZMFTVFSGZADRLG-OAQYLSRUSA-N 0 3 403.530 4.227 20 0 HIADHN OCCOc1ccc(CNCc2ccc(Br)cc2C(F)(F)F)cc1 ZINC000474726760 889581639 /nfs/dbraw/zinc/58/16/39/889581639.db2.gz IPJWSQKRDOJGLQ-UHFFFAOYSA-N 0 3 404.226 4.129 20 0 HIADHN COc1ccc(S(=O)(=O)[N-]c2cccc(C[NH2+][C@@H](C)C3CCSCC3)c2)cc1 ZINC000474730787 889586384 /nfs/dbraw/zinc/58/63/84/889586384.db2.gz QVRLUGFFLYXXQQ-INIZCTEOSA-N 0 3 420.600 4.117 20 0 HIADHN COc1cc(Cl)c(C)cc1NC(=O)CCNCc1ccnn1-c1ccccc1C ZINC000474790178 889647335 /nfs/dbraw/zinc/64/73/35/889647335.db2.gz BSMNRBISEFKYQC-UHFFFAOYSA-N 0 3 412.921 4.270 20 0 HIADHN COc1ccc([C@H](N[C@H](C)C2CCS(=O)(=O)CC2)c2ccccc2Cl)cc1 ZINC000474797980 889652120 /nfs/dbraw/zinc/65/21/20/889652120.db2.gz WAEIYANGQXMUCI-VFNWGFHPSA-N 0 3 407.963 4.241 20 0 HIADHN Fc1ccc(I)c(F)c1CN[C@@H]1CCOC2(CCCC2)C1 ZINC000474810571 889663749 /nfs/dbraw/zinc/66/37/49/889663749.db2.gz PHJIFNVLBNDKSL-LLVKDONJSA-N 0 3 407.242 4.151 20 0 HIADHN CN1CCN(CCC(C)(C)NC(=O)c2ccc(-c3ccc(C(C)(C)C)cc3)o2)CC1 ZINC000474817272 889669273 /nfs/dbraw/zinc/66/92/73/889669273.db2.gz JFEDGHLJCXYNNR-UHFFFAOYSA-N 0 3 411.590 4.390 20 0 HIADHN Cc1cc(C(=O)NC2CCN(CCOC(C)C)CC2)sc1-c1ccc(F)cc1 ZINC000474869960 889724737 /nfs/dbraw/zinc/72/47/37/889724737.db2.gz PSNMLMGTAMXYIZ-UHFFFAOYSA-N 0 3 404.551 4.482 20 0 HIADHN Cc1ccccc1COc1cccc(CC(=O)NC2CCN(CCOC(C)C)CC2)c1 ZINC000474881488 889737274 /nfs/dbraw/zinc/73/72/74/889737274.db2.gz RQYHIRRJMKMDOT-UHFFFAOYSA-N 0 3 424.585 4.122 20 0 HIADHN CC(C)C[C@@H]([NH2+][C@@H](C)C1CCC(C(F)(F)F)CC1)c1nc(-c2nc[n-]n2)no1 ZINC000474884508 889740328 /nfs/dbraw/zinc/74/03/28/889740328.db2.gz AEDAXWPIQHFZPT-GFJIZPEISA-N 0 3 400.449 4.289 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)c1cc(I)ccc1F ZINC000474946818 889802741 /nfs/dbraw/zinc/80/27/41/889802741.db2.gz OBLVHOLQXIZSKU-UHFFFAOYSA-N 0 3 412.246 4.053 20 0 HIADHN Cc1cc(F)c(Br)cc1NC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000474949006 889805371 /nfs/dbraw/zinc/80/53/71/889805371.db2.gz ZIPHNCJBHMOYOZ-SJLPKXTDSA-N 0 3 406.299 4.464 20 0 HIADHN CCc1nnc(-c2ccc(NC(=O)N(CC)[C@@H]3CCN(Cc4ccccc4)C3)cc2)o1 ZINC000474999033 889850624 /nfs/dbraw/zinc/85/06/24/889850624.db2.gz BHKUVBOVTPSKCB-OAQYLSRUSA-N 0 3 419.529 4.427 20 0 HIADHN CCN(C(=O)N[C@H](C)c1cc(OC)ccc1OC)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475005893 889857205 /nfs/dbraw/zinc/85/72/05/889857205.db2.gz CJYZUWDQTYKJNM-UYAOXDASSA-N 0 3 411.546 4.071 20 0 HIADHN CCN(C(=O)Nc1ccc(OC[C@H]2CCCO2)cc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475008334 889862271 /nfs/dbraw/zinc/86/22/71/889862271.db2.gz FYPKTMUYBIWOFL-ISKFKSNPSA-N 0 3 423.557 4.373 20 0 HIADHN CCN(C(=O)Nc1ccc(Oc2cccnc2)nc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475014038 889866540 /nfs/dbraw/zinc/86/65/40/889866540.db2.gz GEEICKADGSPPPU-NRFANRHFSA-N 0 3 417.513 4.397 20 0 HIADHN CN(Cc1cc(Cl)cc(C(F)(F)F)c1)C[C@@H]1C[C@H](F)CN1Cc1nccn1C ZINC000475096788 889944332 /nfs/dbraw/zinc/94/43/32/889944332.db2.gz ONMSXVNXYJPGSA-IRXDYDNUSA-N 0 3 418.866 4.137 20 0 HIADHN CCN(C(=O)c1ncccc1Br)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000475105576 889953988 /nfs/dbraw/zinc/95/39/88/889953988.db2.gz DRMHQROJORRICB-RDJZCZTQSA-N 0 3 402.336 4.142 20 0 HIADHN CCN1CCN(c2cccc(NCc3nc4cc(C(F)(F)F)ccc4n3C)c2)CC1 ZINC000475112362 889962710 /nfs/dbraw/zinc/96/27/10/889962710.db2.gz WYFWBPUEMSCWGZ-UHFFFAOYSA-N 0 3 417.479 4.346 20 0 HIADHN CN(C(=O)NCc1ccc(F)cc1Br)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475134991 889999966 /nfs/dbraw/zinc/99/99/66/889999966.db2.gz DSPOBCSATWZMAJ-GOSISDBHSA-N 0 3 420.326 4.004 20 0 HIADHN C[C@H](NC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1)c1ccc(NC(=O)C2CC2)cc1 ZINC000475137529 890003515 /nfs/dbraw/zinc/00/35/15/890003515.db2.gz KIORNQLTIPIEAR-MBSDFSHPSA-N 0 3 420.557 4.012 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)NCCOc2ccc3ccccc3c2)CC1 ZINC000504664130 913404314 /nfs/dbraw/zinc/40/43/14/913404314.db2.gz ZFJYJKADBWEVQH-UHFFFAOYSA-N 0 3 407.514 4.118 20 0 HIADHN CCN(C(=O)NCc1sccc1Br)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475158990 890023446 /nfs/dbraw/zinc/02/34/46/890023446.db2.gz WVDBEACECSGWOL-MRXNPFEDSA-N 0 3 422.392 4.317 20 0 HIADHN CCN(C(=O)NCc1nc(C(C)C)c(C)s1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475162840 890026821 /nfs/dbraw/zinc/02/68/21/890026821.db2.gz LEQGFLWIDNBPFD-IBGZPJMESA-N 0 3 400.592 4.381 20 0 HIADHN CCN(C(=O)N[C@H](C)c1ccccc1-n1cccn1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475162748 890027103 /nfs/dbraw/zinc/02/71/03/890027103.db2.gz DZENGFHVBCANLS-IRLDBZIGSA-N 0 3 417.557 4.239 20 0 HIADHN CCN(C(=O)NC[C@@H]1CCCO[C@@H]1C(C)(C)C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475169617 890035821 /nfs/dbraw/zinc/03/58/21/890035821.db2.gz DGGQWQDFPUSMDM-BDTNDASRSA-N 0 3 401.595 4.134 20 0 HIADHN CCN(C(=O)NC[C@@H]1CCCO[C@@H]1C(C)(C)C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475169620 890036278 /nfs/dbraw/zinc/03/62/78/890036278.db2.gz DGGQWQDFPUSMDM-FKBYEOEOSA-N 0 3 401.595 4.134 20 0 HIADHN CN(C(=O)c1cccc(OCc2cccnc2)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475302321 890209706 /nfs/dbraw/zinc/20/97/06/890209706.db2.gz FHFBNDWVRMIXGL-HSZRJFAPSA-N 0 3 401.510 4.007 20 0 HIADHN CN(C(=O)c1ccccc1-c1nc(C(C)(C)C)no1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475303689 890212835 /nfs/dbraw/zinc/21/28/35/890212835.db2.gz JAUPFVCMJLMLPT-LJQANCHMSA-N 0 3 418.541 4.381 20 0 HIADHN C[C@H](C(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(Br)s1 ZINC000475309041 890221337 /nfs/dbraw/zinc/22/13/37/890221337.db2.gz UGILRAXTEMOPOJ-GOEBONIOSA-N 0 3 407.377 4.347 20 0 HIADHN Cc1ccc(-c2nc(CC(=O)N(C)[C@@H]3CCN(Cc4ccccc4)C3)cs2)cc1 ZINC000475309897 890222562 /nfs/dbraw/zinc/22/25/62/890222562.db2.gz ZKGKZIYSLDJKBP-JOCHJYFZSA-N 0 3 405.567 4.394 20 0 HIADHN CN(CC(C)(C)C)C(=O)c1cccc(C(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000475312289 890226409 /nfs/dbraw/zinc/22/64/09/890226409.db2.gz MENFZFGNENTHEL-HSZRJFAPSA-N 0 3 421.585 4.151 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)c2cc3sc(N4CCCC4)nc3s2)o1 ZINC000475313923 890229842 /nfs/dbraw/zinc/22/98/42/890229842.db2.gz QNTPGVLMLRZPGB-UHFFFAOYSA-N 0 3 418.588 4.063 20 0 HIADHN CN(C(=O)c1cn(C)nc1-c1ccccc1Cl)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475315369 890231691 /nfs/dbraw/zinc/23/16/91/890231691.db2.gz WUZIZBKJFPSWRN-SFHVURJKSA-N 0 3 408.933 4.087 20 0 HIADHN COc1cccc(Cl)c1-c1noc(C)c1C(=O)NC[C@H](C)N1CCC(C)CC1 ZINC000475317859 890234744 /nfs/dbraw/zinc/23/47/44/890234744.db2.gz LVLIWCXRTVRVBJ-AWEZNQCLSA-N 0 3 405.926 4.162 20 0 HIADHN CCN(C(=O)c1ccn(Cc2ccccc2)n1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000475325692 890246628 /nfs/dbraw/zinc/24/66/28/890246628.db2.gz WWWKLBFLCYACJF-REWPJTCUSA-N 0 3 402.542 4.229 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)c1csc(Br)c1C ZINC000475371982 890302266 /nfs/dbraw/zinc/30/22/66/890302266.db2.gz RAXHBEINDMYLFJ-MRXNPFEDSA-N 0 3 422.392 4.341 20 0 HIADHN CN(C(=O)[C@@H]1C[C@H]1c1ccccc1OC(F)F)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475423559 890343986 /nfs/dbraw/zinc/34/39/86/890343986.db2.gz QWOLOPVQZZXSRZ-YSIASYRMSA-N 0 3 400.469 4.124 20 0 HIADHN C[C@@H](N[C@H](C(N)=O)c1cccc(Br)c1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000475427722 890348664 /nfs/dbraw/zinc/34/86/64/890348664.db2.gz HWBFEVCTZPWXIX-VXXXEYLOSA-N 0 3 413.768 4.472 20 0 HIADHN C[C@@H](CCc1ccc(Cl)s1)N[C@@H](C(N)=O)c1cccc(Br)c1 ZINC000475438672 890357902 /nfs/dbraw/zinc/35/79/02/890357902.db2.gz HZGXCKFXQCLJLK-ZUZCIYMTSA-N 0 3 401.757 4.301 20 0 HIADHN CN(C)CCN(C(=O)[C@H]1CCCN(C(=O)c2cccc3ccccc32)C1)C1CCCC1 ZINC000475451919 890367185 /nfs/dbraw/zinc/36/71/85/890367185.db2.gz HYTOQVMCACUENR-NRFANRHFSA-N 0 3 421.585 4.025 20 0 HIADHN Cc1cc(CN2CCSCC2)ccc1NC(=O)[C@H]1CCc2nc(C(C)C)[nH]c2C1 ZINC000475463670 890373224 /nfs/dbraw/zinc/37/32/24/890373224.db2.gz WDNLZFDOKSIYSE-SFHVURJKSA-N 0 3 412.603 4.134 20 0 HIADHN Cc1cc(CN2CCSCC2)ccc1NC(=O)[C@H]1CCc2[nH]c(C(C)C)nc2C1 ZINC000475463670 890373242 /nfs/dbraw/zinc/37/32/42/890373242.db2.gz WDNLZFDOKSIYSE-SFHVURJKSA-N 0 3 412.603 4.134 20 0 HIADHN O=C1c2ccccc2C(=O)N1CCC1=CCN(Cc2ccc(F)c3cccnc23)CC1 ZINC000475494034 890402383 /nfs/dbraw/zinc/40/23/83/890402383.db2.gz QBWQXYTZRNQTNS-UHFFFAOYSA-N 0 3 415.468 4.192 20 0 HIADHN OC[C@@H](NC1CCN(c2ccc(F)cc2F)CC1)c1ccccc1OC(F)(F)F ZINC000475560689 890488640 /nfs/dbraw/zinc/48/86/40/890488640.db2.gz ORYUVIHWGINKKK-QGZVFWFLSA-N 0 3 416.390 4.155 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)Cc2nc(-c3ccc(F)cc3)cs2)C1 ZINC000475614308 890543301 /nfs/dbraw/zinc/54/33/01/890543301.db2.gz VGUZYORVCKCWQE-OXJNMPFZSA-N 0 3 409.530 4.443 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)Nc2ccc3nc(C(C)C)sc3c2)CC1 ZINC000475629714 890570465 /nfs/dbraw/zinc/57/04/65/890570465.db2.gz YEMHKQISOQTUHX-UHFFFAOYSA-N 0 3 404.580 4.431 20 0 HIADHN C[C@@H](CC(=O)N(C)c1ccccc1)N[C@@H](CO)c1ccc(Cl)cc1C(F)(F)F ZINC000475636327 890578025 /nfs/dbraw/zinc/57/80/25/890578025.db2.gz UXIKPKIXFGTDRS-UGSOOPFHSA-N 0 3 414.855 4.423 20 0 HIADHN C[C@H](CC(=O)N1CCCCCC1)N[C@H](CO)c1ccc(Cl)cc1C(F)(F)F ZINC000475638028 890579403 /nfs/dbraw/zinc/57/94/03/890579403.db2.gz NOZOXKONGVKFAJ-CXAGYDPISA-N 0 3 406.876 4.163 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)NC3CCN(CCOC(C)C)CC3)cc2)cs1 ZINC000475657786 890604376 /nfs/dbraw/zinc/60/43/76/890604376.db2.gz CELJFMXGDDNHGU-UHFFFAOYSA-N 0 3 402.564 4.129 20 0 HIADHN COc1ccc(-c2nc(CN3CCC[C@@]3(CO)Cc3ccccc3)cs2)cc1OC ZINC000475671580 890615571 /nfs/dbraw/zinc/61/55/71/890615571.db2.gz QKHXPFXWMZKNFP-DEOSSOPVSA-N 0 3 424.566 4.397 20 0 HIADHN C[C@@H](NCCC(=O)Nc1ccc(N2CCCC2=O)cc1)c1cc2cccc(F)c2o1 ZINC000475690978 890631663 /nfs/dbraw/zinc/63/16/63/890631663.db2.gz CCUSQRYJZXUPQM-OAHLLOKOSA-N 0 3 409.461 4.378 20 0 HIADHN C[C@@H](c1ccc(Cl)cc1)[C@H](C)N(C)Cc1ccc(S(=O)(=O)N2CCCC2)o1 ZINC000475729225 890666662 /nfs/dbraw/zinc/66/66/62/890666662.db2.gz DXBWVWRNXCNEIJ-CVEARBPZSA-N 0 3 410.967 4.342 20 0 HIADHN CC1CCN([C@H](CNC(=O)Nc2ccc([S@](C)=O)c(F)c2)c2cccs2)CC1 ZINC000475855376 890789977 /nfs/dbraw/zinc/78/99/77/890789977.db2.gz YKKOBFFASRMLCL-UULLZXFKSA-N 0 3 423.579 4.219 20 0 HIADHN C[C@H](NC(=O)NCC1(N2CCSCC2)CCCC1)c1ccc(-c2cccnc2)cc1 ZINC000475937782 890862171 /nfs/dbraw/zinc/86/21/71/890862171.db2.gz IAEZUDCPUFVOMX-IBGZPJMESA-N 0 3 424.614 4.470 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2cn(C)nc2-c2ccc(Cl)s2)N(C)C)cc1 ZINC000475987820 890905173 /nfs/dbraw/zinc/90/51/73/890905173.db2.gz OECGTDKBAPAYMI-INIZCTEOSA-N 0 3 402.951 4.143 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)NCC(c2ccccc2)c2ccccc2)CC1 ZINC000475988573 890906890 /nfs/dbraw/zinc/90/68/90/890906890.db2.gz YQSVFYVZWFPPGL-UHFFFAOYSA-N 0 3 409.574 4.007 20 0 HIADHN CC(C)COc1ccc(C(C)(C)NC(=O)NC2CCN(CCOC(C)C)CC2)cc1 ZINC000476042942 890974168 /nfs/dbraw/zinc/97/41/68/890974168.db2.gz QJYKIAZVBWTREN-UHFFFAOYSA-N 0 3 419.610 4.145 20 0 HIADHN Cc1nc([C@@H](C)NC(=O)N[C@H](CN2CCc3ccccc3C2)C(C)(C)C)cs1 ZINC000476052548 890982625 /nfs/dbraw/zinc/98/26/25/890982625.db2.gz UNFFOAKBXINYDL-FOIQADDNSA-N 0 3 400.592 4.285 20 0 HIADHN Cc1csc([C@H](C)NC(=O)N[C@@H](CN2CCc3ccccc3C2)C(C)(C)C)n1 ZINC000476054686 890983774 /nfs/dbraw/zinc/98/37/74/890983774.db2.gz KHLXBFFTEOIDGQ-LPHOPBHVSA-N 0 3 400.592 4.285 20 0 HIADHN CN(C)C[C@H](NC(=O)NCCc1nc2cc(Cl)ccc2s1)c1ccc(F)cc1 ZINC000476132243 891054410 /nfs/dbraw/zinc/05/44/10/891054410.db2.gz CLBRMQCKFFPPHR-KRWDZBQOSA-N 0 3 420.941 4.233 20 0 HIADHN COc1cc([C@H](C)NC(=O)N(C)[C@H]2CCN(C3CC3)C2)ccc1OCc1ccccc1 ZINC000476162783 891089386 /nfs/dbraw/zinc/08/93/86/891089386.db2.gz OSPLPFIETLGOML-AVRDEDQJSA-N 0 3 423.557 4.213 20 0 HIADHN COc1ccc(CNC(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)cc1F ZINC000504803040 913525973 /nfs/dbraw/zinc/52/59/73/913525973.db2.gz WLJWKFRLTOHDTQ-SFHVURJKSA-N 0 3 405.539 4.168 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)c2ccc(COC(F)(F)F)cc2)CC1 ZINC000476223840 891149420 /nfs/dbraw/zinc/14/94/20/891149420.db2.gz CQVFOBUKHZHLJL-UHFFFAOYSA-N 0 3 406.448 4.460 20 0 HIADHN COc1ccc(C(=O)CCCCCC(=O)N[C@@H]2CN(C)C[C@@H]2c2ccccc2)cc1 ZINC000476333165 891237572 /nfs/dbraw/zinc/23/75/72/891237572.db2.gz HMFCKRLAMQAWPP-DHIUTWEWSA-N 0 3 408.542 4.042 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccc(O)cc1)C(=O)c1sc(CC2CC2)nc1C ZINC000476335326 891240087 /nfs/dbraw/zinc/24/00/87/891240087.db2.gz SRDFXJZMXJFEDO-IBGZPJMESA-N 0 3 413.587 4.236 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)COC1CCC(C)CC1 ZINC000476406551 891322106 /nfs/dbraw/zinc/32/21/06/891322106.db2.gz DDSUZHQNTHEDKC-NFOQDIRWSA-N 0 3 410.562 4.172 20 0 HIADHN Cc1cc(NC(=O)COC2CCC(C)CC2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000476413418 891324865 /nfs/dbraw/zinc/32/48/65/891324865.db2.gz UAAADFSWBYEBMZ-QUENFVSXSA-N 0 3 410.562 4.172 20 0 HIADHN CCN(Cc1cccc(-c2ccncc2)c1)C(=O)NC1CCN(CCOC(C)C)CC1 ZINC000476437803 891349446 /nfs/dbraw/zinc/34/94/46/891349446.db2.gz PRYKRHWZQHTIOU-UHFFFAOYSA-N 0 3 424.589 4.170 20 0 HIADHN CCCSc1nsc(NC(=O)N(Cc2ccccc2)C2CCN(C)CC2)n1 ZINC000476476043 891387302 /nfs/dbraw/zinc/38/73/02/891387302.db2.gz KCGNIBVHNCZKRJ-UHFFFAOYSA-N 0 3 405.593 4.169 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)N(Cc1ccccc1)CC1CCOCC1 ZINC000476532098 891445080 /nfs/dbraw/zinc/44/50/80/891445080.db2.gz GTVKWFNZGPWKKN-VWLOTQADSA-N 0 3 421.585 4.462 20 0 HIADHN C[C@@H]1[C@H](c2ccccc2)CCN1CC(=O)NCc1cccc(COCc2ccco2)c1 ZINC000476578840 891503204 /nfs/dbraw/zinc/50/32/04/891503204.db2.gz ZTSCFFYGNONVPE-CJFMBICVSA-N 0 3 418.537 4.491 20 0 HIADHN C[C@H](c1ccc(Cl)cc1)N(C)C(=O)CN1CC[C@@H](COCc2ccccc2)C1 ZINC000476590086 891521063 /nfs/dbraw/zinc/52/10/63/891521063.db2.gz YHAAIIFQAWADGL-UYAOXDASSA-N 0 3 400.950 4.398 20 0 HIADHN Cc1nc(-c2ccc(CNC(=O)N[C@@H]3CCN(Cc4ccccc4)[C@H]3C)o2)cs1 ZINC000476736156 891702550 /nfs/dbraw/zinc/70/25/50/891702550.db2.gz KHPFKHFXLXWWOO-HNAYVOBHSA-N 0 3 410.543 4.174 20 0 HIADHN COc1ccc(Cl)cc1CN(C)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000504887075 913616854 /nfs/dbraw/zinc/61/68/54/913616854.db2.gz AAHXDXJYOVNOHN-FQEVSTJZSA-N 0 3 401.938 4.155 20 0 HIADHN CCc1noc(-c2ccc(C)c(NC(=O)NC[C@@H](N[C@@H](C)CC)c3ccco3)c2)n1 ZINC000477160112 892082087 /nfs/dbraw/zinc/08/20/87/892082087.db2.gz HQORMDNSZOSQHJ-MAUKXSAKSA-N 0 3 411.506 4.451 20 0 HIADHN COCCN1CCC[C@@H]1CNC(=O)N(Cc1ccc(Cl)c(Cl)c1)C(C)C ZINC000477162663 892084894 /nfs/dbraw/zinc/08/48/94/892084894.db2.gz ONUKWOZQNBAUNK-MRXNPFEDSA-N 0 3 402.366 4.024 20 0 HIADHN CN1CC[C@H](NC(=O)N2CCO[C@H](c3ccc(F)cc3Cl)C2)[C@@H]1c1ccccc1 ZINC000477173480 892093729 /nfs/dbraw/zinc/09/37/29/892093729.db2.gz BWYQZLDSFFUVQW-ACRUOGEOSA-N 0 3 417.912 4.007 20 0 HIADHN Cc1ccnc(Oc2ccc(NC(=O)N[C@@H](C)[C@H](c3ccccc3)N(C)C)cc2)n1 ZINC000477183887 892102445 /nfs/dbraw/zinc/10/24/45/892102445.db2.gz AJZPIBJAVFZSOY-LAUBAEHRSA-N 0 3 405.502 4.390 20 0 HIADHN Cc1ccnc(Oc2ccc(NC(=O)N[C@@H](C)[C@@H](c3ccccc3)N(C)C)cc2)n1 ZINC000477183889 892102984 /nfs/dbraw/zinc/10/29/84/892102984.db2.gz AJZPIBJAVFZSOY-UWJYYQICSA-N 0 3 405.502 4.390 20 0 HIADHN CC[C@@H](c1ccccc1)[C@@H]1CCCN1CC(=O)Nc1ccccc1N1CCCC1=O ZINC000477225346 892160815 /nfs/dbraw/zinc/16/08/15/892160815.db2.gz WTKBDSXAZMHORI-UNMCSNQZSA-N 0 3 405.542 4.410 20 0 HIADHN CC[C@H](NC(=O)NC[C@H](C)N(C)Cc1ccccc1)c1nc(-c2ccccc2)c[nH]1 ZINC000477339574 892307532 /nfs/dbraw/zinc/30/75/32/892307532.db2.gz QPKCYAHBUDRTQN-RXVVDRJESA-N 0 3 405.546 4.348 20 0 HIADHN C[C@H](CNC(=O)N1CCn2cccc2[C@@H]1c1ccccc1)N(C)Cc1ccccc1 ZINC000477397723 892353082 /nfs/dbraw/zinc/35/30/82/892353082.db2.gz XYTMHAGZCDSPGE-YKSBVNFPSA-N 0 3 402.542 4.123 20 0 HIADHN O[C@H](COc1ccc(Cl)cc1Cl)CN1CCC[C@H]1c1ccc2c(c1)OCO2 ZINC000477462768 892429867 /nfs/dbraw/zinc/42/98/67/892429867.db2.gz GCPZFHOAIOKRBE-RDJZCZTQSA-N 0 3 410.297 4.299 20 0 HIADHN O=C(CNC1(c2ccc(OCc3ccccc3)cc2)CCOCC1)NC1CCCCC1 ZINC000477676492 892806088 /nfs/dbraw/zinc/80/60/88/892806088.db2.gz YTQBNOCEBWXHCX-UHFFFAOYSA-N 0 3 422.569 4.310 20 0 HIADHN CSc1ccc(O[C@H](C)C(=O)Nc2cccc(CN3CCC(CO)CC3)c2)cc1 ZINC000477723416 892827060 /nfs/dbraw/zinc/82/70/60/892827060.db2.gz IXZRBAJKBGOPFN-QGZVFWFLSA-N 0 3 414.571 4.019 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)c1ccc(F)c(I)c1 ZINC000477725290 892827701 /nfs/dbraw/zinc/82/77/01/892827701.db2.gz YWHNEOGWMUORQX-UHFFFAOYSA-N 0 3 412.246 4.053 20 0 HIADHN CC[C@H](CNC(=O)N1CCC[C@@H]1c1ccc2c(c1)OCO2)N1CCc2ccccc2C1 ZINC000477725811 892828063 /nfs/dbraw/zinc/82/80/63/892828063.db2.gz XPMGLQHDQRWEHX-FGZHOGPDSA-N 0 3 421.541 4.099 20 0 HIADHN Cc1cc(O[C@@H](C)C(=O)Nc2cccc(CN3CCC(CO)CC3)c2)ccc1Cl ZINC000477727028 892828963 /nfs/dbraw/zinc/82/89/63/892828963.db2.gz QXTJVNNHRXHQDC-KRWDZBQOSA-N 0 3 416.949 4.259 20 0 HIADHN C[C@H]1CCc2ccccc2N1CCC(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000477739123 892835944 /nfs/dbraw/zinc/83/59/44/892835944.db2.gz LXINOCIRKGWCJQ-FQEVSTJZSA-N 0 3 421.585 4.061 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)C1(c2ccccc2F)CCCC1 ZINC000477745105 892839811 /nfs/dbraw/zinc/83/98/11/892839811.db2.gz RCPZXCVSXBWJOU-UHFFFAOYSA-N 0 3 410.533 4.481 20 0 HIADHN CCN(C[C@@H]1CCN([C@@H](C)C(=O)N[C@@H](C)c2ccc(Cl)cc2)C1)CC(F)(F)F ZINC000477760715 892850098 /nfs/dbraw/zinc/85/00/98/892850098.db2.gz QAJDYSIEXZOKNW-JYJNAYRXSA-N 0 3 419.919 4.112 20 0 HIADHN CC[C@@H](CNC(=O)N(C)Cc1nc(-c2ccccc2)c[nH]1)N1CCc2ccccc2C1 ZINC000477819136 892886750 /nfs/dbraw/zinc/88/67/50/892886750.db2.gz IKZXEEBFBORAFR-QFIPXVFZSA-N 0 3 417.557 4.055 20 0 HIADHN CN(Cc1nc(-c2ccccc2)c[nH]1)C(=O)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000477838907 892898083 /nfs/dbraw/zinc/89/80/83/892898083.db2.gz VPNOMXFJLIDTTO-QFIPXVFZSA-N 0 3 403.530 4.055 20 0 HIADHN CC(C)CC[C@@H](NCc1ccc(S(=O)(=O)CCO)cc1)c1ccc(Cl)cc1 ZINC000477914948 892995750 /nfs/dbraw/zinc/99/57/50/892995750.db2.gz HBVXSAVYYVPSEG-OAQYLSRUSA-N 0 3 409.979 4.373 20 0 HIADHN CC(C)c1ccc(NC(=O)C[C@H](C)N[C@@H]2CCN(Cc3ccc(F)cc3)C2=O)cc1 ZINC000477920090 893006232 /nfs/dbraw/zinc/00/62/32/893006232.db2.gz UJDFNUPYLHZEJP-HTAPYJJXSA-N 0 3 411.521 4.057 20 0 HIADHN CC(C)c1ccccc1NC(=O)C[C@@H](C)N[C@@H]1CCN(Cc2ccc(F)cc2)C1=O ZINC000477927284 893016558 /nfs/dbraw/zinc/01/65/58/893016558.db2.gz MXPWXDQIBMIKTK-VGOFRKELSA-N 0 3 411.521 4.057 20 0 HIADHN Cc1cc(Br)c2ccccc2c1NC(=O)N1CC[C@@H](N2CC=CC2)C1 ZINC000477976636 893073076 /nfs/dbraw/zinc/07/30/76/893073076.db2.gz IYVPWWKNUHJBHE-OAHLLOKOSA-N 0 3 400.320 4.389 20 0 HIADHN CCc1cc(Br)ccc1NC(=O)N(CCN(C)C)Cc1ccccn1 ZINC000477979371 893075802 /nfs/dbraw/zinc/07/58/02/893075802.db2.gz LLLWQFFTWXNWAL-UHFFFAOYSA-N 0 3 405.340 4.002 20 0 HIADHN CCCN(C(=O)CCc1c(C)noc1Cl)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000505005771 913747874 /nfs/dbraw/zinc/74/78/74/913747874.db2.gz NPGRGJFFSWTBRX-LJQANCHMSA-N 0 3 403.954 4.472 20 0 HIADHN CCCN(C(=O)c1ccc(N2CCCC2=O)cc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000505036255 913776759 /nfs/dbraw/zinc/77/67/59/913776759.db2.gz UUYGNEPTHPYRQG-DEOSSOPVSA-N 0 3 419.569 4.330 20 0 HIADHN C[C@H](NCc1ccc(N2CCCS2(=O)=O)c(F)c1)c1ccc(F)c(Cl)c1 ZINC000478445011 893752954 /nfs/dbraw/zinc/75/29/54/893752954.db2.gz GUITXROVHPQMAW-LBPRGKRZSA-N 0 3 400.878 4.009 20 0 HIADHN CN1C[C@H](NC(=O)COC(c2ccccc2)c2ccccc2)[C@@H](c2ccccc2)C1 ZINC000478449648 893764362 /nfs/dbraw/zinc/76/43/62/893764362.db2.gz MHHJUIWCXIXCNH-RPWUZVMVSA-N 0 3 400.522 4.007 20 0 HIADHN COc1cnccc1N1CCN(C(=O)C(C)(C)Cc2ccc(C(F)(F)F)cc2)CC1 ZINC000478453301 893772276 /nfs/dbraw/zinc/77/22/76/893772276.db2.gz CLMOTAFQUMSVOT-UHFFFAOYSA-N 0 3 421.463 4.027 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)N[C@H](c2ccco2)c2ccccc2)c1 ZINC000478471719 893800282 /nfs/dbraw/zinc/80/02/82/893800282.db2.gz XMXATCWTCGNHQV-QHCPKHFHSA-N 0 3 407.514 4.151 20 0 HIADHN Cc1nc(COc2ccc(F)cc2)sc1C(=O)NC[C@@H](C)N1CCC[C@@H](C)C1 ZINC000478487987 893808762 /nfs/dbraw/zinc/80/87/62/893808762.db2.gz PYGTYXFFEHMQAH-HUUCEWRRSA-N 0 3 405.539 4.020 20 0 HIADHN CC(C)c1csc(CNC(=O)Nc2ccc(CCN3CCSCC3)cc2)n1 ZINC000478673467 893925051 /nfs/dbraw/zinc/92/50/51/893925051.db2.gz ZTERUCPCTSZTNY-UHFFFAOYSA-N 0 3 404.605 4.180 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@@H]2CN[C@H](C(N)=O)c2cccc(Br)c2)cc1 ZINC000478799296 894073491 /nfs/dbraw/zinc/07/34/91/894073491.db2.gz ITAGELSDGZEEQR-HOJAQTOUSA-N 0 3 417.347 4.041 20 0 HIADHN CN(Cc1ccccc1)C(=O)NC1CCN(CCOc2ccc(Cl)cc2)CC1 ZINC000478903848 894183947 /nfs/dbraw/zinc/18/39/47/894183947.db2.gz VFTJFGSBUYWMOO-UHFFFAOYSA-N 0 3 401.938 4.025 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccc(F)c2)C1)N1CCO[C@@H](c2ccccc2Cl)C1 ZINC000505155408 913847211 /nfs/dbraw/zinc/84/72/11/913847211.db2.gz UBKYPEVGPDFDOF-XMSQKQJNSA-N 0 3 416.924 4.291 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1nnc(/C=C/c2ccco2)s1)c1ccco1 ZINC000479039724 894300483 /nfs/dbraw/zinc/30/04/83/894300483.db2.gz ASEKHQIJZNBMIH-QJXJPNQISA-N 0 3 401.492 4.145 20 0 HIADHN CC[C@H](C)NC(=O)[C@@H]1C[C@H](C)N(CC(=O)N[C@H](C)c2cccs2)[C@H]2CCCC[C@H]12 ZINC000479111041 894378621 /nfs/dbraw/zinc/37/86/21/894378621.db2.gz VLPYRQJLEDTQRE-XHHHBCLVSA-N 0 3 419.635 4.109 20 0 HIADHN CC[C@H](C)NC(=O)[C@@H]1C[C@H](C)N(Cc2nc(-c3ccoc3)no2)[C@H]2CCCC[C@H]12 ZINC000479116406 894385640 /nfs/dbraw/zinc/38/56/40/894385640.db2.gz QZGFTWYBCSBKTF-OBQKDBCYSA-N 0 3 400.523 4.014 20 0 HIADHN CC[C@@H](C)n1nc(C(=O)Nc2c(C)cnn2[C@@H]2CCN(Cc3ccccc3)C2)cc1C ZINC000479184275 894451202 /nfs/dbraw/zinc/45/12/02/894451202.db2.gz HZGPUDHFKIMHFW-WIYYLYMNSA-N 0 3 420.561 4.367 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)N[C@H]1CCCc2c(O)cccc21 ZINC000479204536 894468532 /nfs/dbraw/zinc/46/85/32/894468532.db2.gz BLLZGEXBJTXZTC-FQEVSTJZSA-N 0 3 401.938 4.196 20 0 HIADHN O=C(Nc1cccc(NC(=O)[C@@H]2CN(Cc3ccccc3)CCC2(F)F)c1)C1CC1 ZINC000505198682 913878030 /nfs/dbraw/zinc/87/80/30/913878030.db2.gz XPZDCMMXHQLNSG-FQEVSTJZSA-N 0 3 413.468 4.131 20 0 HIADHN CCOc1ccc([C@H](C)NC(=O)NC[C@H](c2ccccc2)N2CCCC2)cc1OC ZINC000505205966 913882797 /nfs/dbraw/zinc/88/27/97/913882797.db2.gz WAHIHAXQUGVSOC-GHTZIAJQSA-N 0 3 411.546 4.291 20 0 HIADHN COc1cc2c(cc1OC)[C@H](NCc1cccc(NC(=O)c3ccncc3)c1)CC2 ZINC000479337690 894631126 /nfs/dbraw/zinc/63/11/26/894631126.db2.gz SJEQGEDNFKXUHN-OAQYLSRUSA-N 0 3 403.482 4.128 20 0 HIADHN C[C@H]1CN(Cc2cccc(CN[C@@H]3CCCc4nn(-c5ccccc5)cc43)c2)CCO1 ZINC000479344126 894637525 /nfs/dbraw/zinc/63/75/25/894637525.db2.gz AWHJVMKLOMWVSE-NBGIEHNGSA-N 0 3 416.569 4.260 20 0 HIADHN C[C@@H](NCCc1cccc2cccnc21)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479348248 894643487 /nfs/dbraw/zinc/64/34/87/894643487.db2.gz JINCIOQUPWSDCX-GFCCVEGCSA-N 0 3 424.353 4.082 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N[C@@H](CCO)c1ccc(Cl)cc1)c1ccsc1 ZINC000479385368 894685952 /nfs/dbraw/zinc/68/59/52/894685952.db2.gz MBILSSFHSMPJPE-OALUTQOASA-N 0 3 409.983 4.207 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@@H](CCO)c1ccc(Cl)cc1)c1ccsc1 ZINC000479385369 894686303 /nfs/dbraw/zinc/68/63/03/894686303.db2.gz MBILSSFHSMPJPE-RBUKOAKNSA-N 0 3 409.983 4.207 20 0 HIADHN Cn1nc(CCNCc2nc(-c3ccc(Br)cc3)c[nH]2)c2ccccc21 ZINC000479386831 894687912 /nfs/dbraw/zinc/68/79/12/894687912.db2.gz DHPFBALIPCWHIW-UHFFFAOYSA-N 0 3 410.319 4.058 20 0 HIADHN C[C@H](NCCC1Cc2ccccc2C1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479400290 894705506 /nfs/dbraw/zinc/70/55/06/894705506.db2.gz XVGDUAYKJSGGTB-LBPRGKRZSA-N 0 3 413.370 4.097 20 0 HIADHN Cc1c(CN[C@@H]2CCCc3c(Br)cc(Br)cc32)cnn1C ZINC000479402148 894706325 /nfs/dbraw/zinc/70/63/25/894706325.db2.gz LEMHDHSQXALHTH-MRXNPFEDSA-N 0 3 413.157 4.421 20 0 HIADHN COc1cc2c(cc1OC)[C@H](N[C@@H]1CC(=O)N(C)[C@H]1c1ccc(Cl)c(F)c1)CC2 ZINC000479415391 894726065 /nfs/dbraw/zinc/72/60/65/894726065.db2.gz YHFGBZRRXVITLZ-HMFYCAOWSA-N 0 3 418.896 4.045 20 0 HIADHN Cc1cc(C)c(S(N)(=O)=O)cc1[C@@H](C)N[C@H]1CCc2c1cccc2Br ZINC000479419554 894730208 /nfs/dbraw/zinc/73/02/08/894730208.db2.gz QBCBPZNSDSOBJU-ACJLOTCBSA-N 0 3 423.376 4.051 20 0 HIADHN COc1c(Br)cccc1CNC[C@@H](C)c1nc(-c2ccccc2)no1 ZINC000479442265 894756974 /nfs/dbraw/zinc/75/69/74/894756974.db2.gz XEVATNJYBPXTJR-CYBMUJFWSA-N 0 3 402.292 4.401 20 0 HIADHN Cc1cc2[nH]c(CNCc3ccccc3CS(=O)(=O)N3CCCC3)cc2c(C)c1 ZINC000479466231 894789930 /nfs/dbraw/zinc/78/99/30/894789930.db2.gz ZKPSCRJZRFOHKF-UHFFFAOYSA-N 0 3 411.571 4.000 20 0 HIADHN COCCCC[C@H](N[C@H](C)c1cccc(S(=O)(=O)N(C)C)c1)c1ccccc1 ZINC000479487736 894809087 /nfs/dbraw/zinc/80/90/87/894809087.db2.gz GQSTXAWTDJHVFY-GCJKJVERSA-N 0 3 404.576 4.146 20 0 HIADHN Cc1c([C@H](C)NCCc2cccc(OCC(F)(F)F)c2)nnn1-c1ccccc1 ZINC000479510357 894824807 /nfs/dbraw/zinc/82/48/07/894824807.db2.gz DBMVHUCKRFZSGK-HNNXBMFYSA-N 0 3 404.436 4.410 20 0 HIADHN CCN(CC)C(=O)Nc1ccc([C@@H](C)N[C@H](C)C(=O)N2Cc3ccccc3C2)cc1 ZINC000479530750 894837426 /nfs/dbraw/zinc/83/74/26/894837426.db2.gz WRVIMJHSLAHUTL-QZTJIDSGSA-N 0 3 408.546 4.142 20 0 HIADHN COc1ccc(-c2ccncc2)cc1CNc1cccc(CN2CCN(C)CC2)c1 ZINC000479541293 894844406 /nfs/dbraw/zinc/84/44/06/894844406.db2.gz HKQDXMZSNTZKSM-UHFFFAOYSA-N 0 3 402.542 4.117 20 0 HIADHN CCN(CC)C(=O)Nc1ccc([C@H](C)N[C@@H](C)C(=O)N2Cc3ccccc3C2)cc1 ZINC000479547316 894847391 /nfs/dbraw/zinc/84/73/91/894847391.db2.gz WRVIMJHSLAHUTL-ROUUACIJSA-N 0 3 408.546 4.142 20 0 HIADHN CC[C@@H](Oc1ccccc1F)C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000479555438 894853369 /nfs/dbraw/zinc/85/33/69/894853369.db2.gz DZVYTHJMQPVJRG-HXUWFJFHSA-N 0 3 402.535 4.213 20 0 HIADHN C[C@@H]1CCN(C(=O)NCc2csc(-c3ccco3)n2)CCN1Cc1ccccc1 ZINC000479614241 894885312 /nfs/dbraw/zinc/88/53/12/894885312.db2.gz HAVCUDJPYZJZLZ-QGZVFWFLSA-N 0 3 410.543 4.209 20 0 HIADHN C[C@H](OC[C@H](O)CN1CCC[C@@H]1c1ccc2c(c1)OCO2)c1ccc(Cl)cc1 ZINC000479617289 894887272 /nfs/dbraw/zinc/88/72/72/894887272.db2.gz LOKIJIUPVNAQDT-CWFSZBLJSA-N 0 3 403.906 4.344 20 0 HIADHN Cc1nnc(-c2ccccc2C(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)o1 ZINC000479641138 894909981 /nfs/dbraw/zinc/90/99/81/894909981.db2.gz OTXUPWQICJRZEL-IBGZPJMESA-N 0 3 410.543 4.310 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)NCc2ncoc2-c2ccccc2)CC1 ZINC000479724319 895020725 /nfs/dbraw/zinc/02/07/25/895020725.db2.gz VERKKWBGGXQQPD-UHFFFAOYSA-N 0 3 404.514 4.148 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)NC[C@@H](c2ccccc2)C(F)(F)F)c1 ZINC000479739258 895039863 /nfs/dbraw/zinc/03/98/63/895039863.db2.gz DGIMFSLPXDZCKY-FQEVSTJZSA-N 0 3 423.479 4.115 20 0 HIADHN COc1cc(C)c([C@H](C)NC(=O)N[C@@H]2CCN(Cc3ccccc3)[C@@H]2C)cc1OC ZINC000479817149 895129493 /nfs/dbraw/zinc/12/94/93/895129493.db2.gz OYWLWHDOLIQTBH-WAOWUJCRSA-N 0 3 411.546 4.035 20 0 HIADHN CCN1CCN(Cc2ccc(CNC(=O)c3cccc(Cl)c3Cl)cc2)CC1 ZINC000479837076 895162621 /nfs/dbraw/zinc/16/26/21/895162621.db2.gz KICBRPBYNMPCNH-UHFFFAOYSA-N 0 3 406.357 4.061 20 0 HIADHN O=C(c1cc2c([nH]c1=O)CCCC2)N1CCN(Cc2ccccc2)C2(CCCCC2)C1 ZINC000479862894 895201898 /nfs/dbraw/zinc/20/18/98/895201898.db2.gz FNDNWLBCLJQTKF-UHFFFAOYSA-N 0 3 419.569 4.327 20 0 HIADHN CC(C)c1nnc(CCC(=O)N2CCN(Cc3ccccc3)C3(CCCCC3)C2)o1 ZINC000479866361 895206103 /nfs/dbraw/zinc/20/61/03/895206103.db2.gz YZPHTSFXVKLFPB-UHFFFAOYSA-N 0 3 410.562 4.173 20 0 HIADHN Fc1cc(Br)cc2c1CC[C@@H]2NCc1ccccc1CN1CCOCC1 ZINC000479892420 895239077 /nfs/dbraw/zinc/23/90/77/895239077.db2.gz TXYBRSKUDIHKSX-NRFANRHFSA-N 0 3 419.338 4.198 20 0 HIADHN FC(F)(F)c1cc(Br)ccc1CNCc1ccc(-n2cncn2)cc1 ZINC000479971074 895325456 /nfs/dbraw/zinc/32/54/56/895325456.db2.gz NRDIFWFQKROBPS-UHFFFAOYSA-N 0 3 411.225 4.338 20 0 HIADHN CC[C@H](c1ccccc1)[C@@H]1CCCN1Cc1nnc2n1c1ccc(C)cc1c(=O)n2C ZINC000480018195 895368137 /nfs/dbraw/zinc/36/81/37/895368137.db2.gz KXMWEKAGSDXWPI-CTNGQTDRSA-N 0 3 415.541 4.048 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1c(C)c(C(F)(F)F)nn1C)c1ccsc1 ZINC000480075985 895428322 /nfs/dbraw/zinc/42/83/22/895428322.db2.gz GGWYGOYEWXEZFS-ZDUSSCGKSA-N 0 3 403.474 4.013 20 0 HIADHN C[C@@H](NCc1ccc(OC(F)F)cc1)c1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000480079778 895436000 /nfs/dbraw/zinc/43/60/00/895436000.db2.gz DPIOJRWLOPQREK-MRXNPFEDSA-N 0 3 424.513 4.313 20 0 HIADHN CC(C)C1CCC(N[C@H]2CCS(=O)(=O)c3ccc(Br)cc32)CC1 ZINC000480187783 895583431 /nfs/dbraw/zinc/58/34/31/895583431.db2.gz CGAZWQMFSCGDLG-PGEKIEPBSA-N 0 3 400.382 4.472 20 0 HIADHN C[C@@H](NC[C@H](c1ccsc1)N(C)C)c1ccccc1I ZINC000480245446 895656017 /nfs/dbraw/zinc/65/60/17/895656017.db2.gz IQUUTZCCRHPZBB-MLGOLLRUSA-N 0 3 400.329 4.306 20 0 HIADHN C[C@@H](NC[C@@H](c1ccsc1)N(C)C)c1ccccc1I ZINC000480245449 895656768 /nfs/dbraw/zinc/65/67/68/895656768.db2.gz IQUUTZCCRHPZBB-WBMJQRKESA-N 0 3 400.329 4.306 20 0 HIADHN CC(C)(CN[C@H]1CCS(=O)(=O)c2ccc(Br)cc21)c1cccs1 ZINC000480248423 895658328 /nfs/dbraw/zinc/65/83/28/895658328.db2.gz DCYFTBGPNLTUJW-AWEZNQCLSA-N 0 3 414.390 4.297 20 0 HIADHN COc1cc(OC)c([C@H](C)NC[C@H](c2ccccc2)N2CCOCC2)cc1Cl ZINC000480251134 895662619 /nfs/dbraw/zinc/66/26/19/895662619.db2.gz GVROTDXWPVZWJJ-OXJNMPFZSA-N 0 3 404.938 4.081 20 0 HIADHN C[C@@H](NCc1ccc(Cn2cccn2)cc1)c1ccc(S(=O)(=O)C2CCCC2)cc1 ZINC000480256078 895665966 /nfs/dbraw/zinc/66/59/66/895665966.db2.gz ONDXYVJGNLBGHZ-LJQANCHMSA-N 0 3 423.582 4.499 20 0 HIADHN CN(C)C[C@H](NC(=O)Nc1cc(C(C)(C)C)nn1-c1ccccn1)c1ccc(F)cc1 ZINC000480266232 895676071 /nfs/dbraw/zinc/67/60/71/895676071.db2.gz NYTSZIFGVQBBIS-SFHVURJKSA-N 0 3 424.524 4.128 20 0 HIADHN C[C@H](Cn1ncc2ccccc2c1=O)NCc1cc(Br)c(Cl)s1 ZINC000480304607 895709452 /nfs/dbraw/zinc/70/94/52/895709452.db2.gz JMDBZOHYAPQVNQ-SNVBAGLBSA-N 0 3 412.740 4.052 20 0 HIADHN CC[C@H](C(=O)N1CCC(NCc2ccc(Br)o2)CC1)c1ccccc1 ZINC000480331450 895733768 /nfs/dbraw/zinc/73/37/68/895733768.db2.gz GUMWKJLFHLSDAQ-SFHVURJKSA-N 0 3 405.336 4.317 20 0 HIADHN COCCN(C)c1ccc(CNC2(c3ccc(Br)cc3)CCCC2)cn1 ZINC000480339418 895743136 /nfs/dbraw/zinc/74/31/36/895743136.db2.gz WMEPOZVLDZKRMA-UHFFFAOYSA-N 0 3 418.379 4.486 20 0 HIADHN O[C@H](C(F)F)[C@H](Cc1ccccc1)NCc1cc(Br)c(Cl)s1 ZINC000480343830 895749527 /nfs/dbraw/zinc/74/95/27/895749527.db2.gz OUYLNCPJMQSCSI-STQMWFEESA-N 0 3 410.711 4.491 20 0 HIADHN O=C(C1CCCCC1)N1CC[C@@H](NCc2cc(Br)c(Cl)s2)C1 ZINC000480358411 895764286 /nfs/dbraw/zinc/76/42/86/895764286.db2.gz QLXUJZUMQWBYGC-GFCCVEGCSA-N 0 3 405.789 4.435 20 0 HIADHN CC(C)c1cccc(C(C)C)c1NC(=O)N1CC[C@@H](N2CCN(C)CC2)[C@H](C)C1 ZINC000480403904 895806848 /nfs/dbraw/zinc/80/68/48/895806848.db2.gz JVDGVLCZDAUTQH-DENIHFKCSA-N 0 3 400.611 4.423 20 0 HIADHN Brc1ccc2c(c1)CC[C@H]2N[C@@H](CN1CCOCC1)c1ccccc1 ZINC000480441016 895830736 /nfs/dbraw/zinc/83/07/36/895830736.db2.gz BLDKHUIRSIFYJY-RTWAWAEBSA-N 0 3 401.348 4.100 20 0 HIADHN COC(=O)c1csc(-c2cccc(CNCc3cc(OC)c(OC)cc3C)c2)n1 ZINC000480448247 895836299 /nfs/dbraw/zinc/83/62/99/895836299.db2.gz PIRABTCTCALTBA-UHFFFAOYSA-N 0 3 412.511 4.212 20 0 HIADHN CC(C)n1ncc2c1C[C@H](NCc1nc(-c3ccc(Br)cc3)c[nH]1)CC2 ZINC000480486845 895862612 /nfs/dbraw/zinc/86/26/12/895862612.db2.gz KIXHVMOLUGUXDF-QGZVFWFLSA-N 0 3 414.351 4.264 20 0 HIADHN FC(F)(F)C1CCN(C2CC(Nc3nc(-c4ccccn4)nc4c3CCC4)C2)CC1 ZINC000480546771 895907640 /nfs/dbraw/zinc/90/76/40/895907640.db2.gz AXMVAIOIEAASKP-UHFFFAOYSA-N 0 3 417.479 4.245 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)NCc1cc(Br)ccc1F)c1ccco1 ZINC000480594533 895957600 /nfs/dbraw/zinc/95/76/00/895957600.db2.gz IHBXIYFJBIMOQO-BLLLJJGKSA-N 0 3 412.303 4.110 20 0 HIADHN C[C@H](NCc1ccnc(OCc2ccccc2)c1)c1cccc(N2CCOCC2)c1 ZINC000480607940 895973040 /nfs/dbraw/zinc/97/30/40/895973040.db2.gz JUYVELCOKAXMPB-FQEVSTJZSA-N 0 3 403.526 4.348 20 0 HIADHN C[C@@H]1CN(c2ccc(CN[C@H]3CCc4cc(Br)ccc43)cn2)C[C@@H](C)O1 ZINC000480609603 895975180 /nfs/dbraw/zinc/97/51/80/895975180.db2.gz HUHPAWFEPSIWFO-SXGZJXTBSA-N 0 3 416.363 4.235 20 0 HIADHN Cc1cc(C)n(-c2ccc(CCN[C@@H](C)c3nnn(-c4ccccc4)c3C)cc2)n1 ZINC000480615007 895980425 /nfs/dbraw/zinc/98/04/25/895980425.db2.gz UMSUKHXABWNRDL-IBGZPJMESA-N 0 3 400.530 4.272 20 0 HIADHN C[C@@H]1C[C@@H](NCc2ccc(N3CCO[C@H](C)C3)nc2)c2cccc(Br)c21 ZINC000480620600 895988056 /nfs/dbraw/zinc/98/80/56/895988056.db2.gz VNGNUKOJCSWDDC-SPYBWZPUSA-N 0 3 416.363 4.407 20 0 HIADHN C[C@H]1C[C@@H](NCc2ccc(N3CCO[C@H](C)C3)nc2)c2cccc(Br)c21 ZINC000480620597 895988168 /nfs/dbraw/zinc/98/81/68/895988168.db2.gz VNGNUKOJCSWDDC-QMTMVMCOSA-N 0 3 416.363 4.407 20 0 HIADHN COc1cccc(C[C@H](NCc2ccc(N3CCO[C@H](C)C3)nc2)c2ccccc2)c1 ZINC000480630768 895998599 /nfs/dbraw/zinc/99/85/99/895998599.db2.gz LHMKEXSTKFDMJP-NLFFAJNJSA-N 0 3 417.553 4.389 20 0 HIADHN CCCN(C[C@H]1CCCCO1)C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000480634762 896003799 /nfs/dbraw/zinc/00/37/99/896003799.db2.gz JLRCTNBAUPCLTH-OAQYLSRUSA-N 0 3 405.608 4.091 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)[C@H](C)c3c(F)cccc3F)CC2)c1 ZINC000480649669 896018859 /nfs/dbraw/zinc/01/88/59/896018859.db2.gz QGQYWACKCRBLKD-LJQANCHMSA-N 0 3 415.528 4.095 20 0 HIADHN O=S(=O)(CCCNCc1cc(Br)c(Cl)s1)c1ccccc1 ZINC000480675248 896038724 /nfs/dbraw/zinc/03/87/24/896038724.db2.gz ZWUKZCYUVZDTAG-UHFFFAOYSA-N 0 3 408.770 4.118 20 0 HIADHN Cc1onc(-c2ccccn2)c1C(=O)NC[C@@H](c1ccccc1)N1CCC(C)CC1 ZINC000480691200 896052281 /nfs/dbraw/zinc/05/22/81/896052281.db2.gz VGOIHMBTWPXJOT-NRFANRHFSA-N 0 3 404.514 4.248 20 0 HIADHN CN1CCN(c2cc(CN[C@H]3CCCc4c(Cl)sc(Cl)c43)ccn2)CC1 ZINC000480703782 896065132 /nfs/dbraw/zinc/06/51/32/896065132.db2.gz FKEGOWSPNVCTGX-HNNXBMFYSA-N 0 3 411.402 4.369 20 0 HIADHN CCNC(=O)COc1ccc(CN[C@H](C)c2cccc(-c3ccncc3)c2)cc1OC ZINC000480706502 896068639 /nfs/dbraw/zinc/06/86/39/896068639.db2.gz JHGVTUPWNISTEP-GOSISDBHSA-N 0 3 419.525 4.123 20 0 HIADHN Cc1cc(C(=O)N(CCN(C)C)Cc2cccs2)nc(-c2ccc(Cl)cc2)n1 ZINC000505371914 914034984 /nfs/dbraw/zinc/03/49/84/914034984.db2.gz XZKLCPJZLFVZBU-UHFFFAOYSA-N 0 3 414.962 4.371 20 0 HIADHN CC[C@@H](C)n1nc(NC(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)cc1C ZINC000480751366 896113630 /nfs/dbraw/zinc/11/36/30/896113630.db2.gz UHOKSZKOVASDSE-UZLBHIALSA-N 0 3 401.555 4.374 20 0 HIADHN C[C@H](N[C@H]1CCCc2c1cnn2C)c1cccc(OCc2cn3ccccc3n2)c1 ZINC000480766441 896128917 /nfs/dbraw/zinc/12/89/17/896128917.db2.gz FMVZSJIFWVJIHA-JTSKRJEESA-N 0 3 401.514 4.375 20 0 HIADHN C[C@H](NC[C@@H](c1cccc(Cl)c1)N1CCCC1)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000480774196 896138189 /nfs/dbraw/zinc/13/81/89/896138189.db2.gz VIVXZUWFYVBDIQ-YWZLYKJASA-N 0 3 424.969 4.370 20 0 HIADHN C[C@H]1CN(C(=O)Nc2ccc(SC3CCCC3)cc2)CC[C@H]1N1CCN(C)CC1 ZINC000480806644 896174205 /nfs/dbraw/zinc/17/42/05/896174205.db2.gz NGVOUVIFXSWUQV-PGRDOPGGSA-N 0 3 416.635 4.211 20 0 HIADHN Fc1cccc(F)c1-c1csc(CN2CCC[C@H](c3nc(C4CC4)n[nH]3)C2)n1 ZINC000480862870 896228598 /nfs/dbraw/zinc/22/85/98/896228598.db2.gz JOYHNHLNPOBDRP-ZDUSSCGKSA-N 0 3 401.486 4.463 20 0 HIADHN Fc1cccc(F)c1-c1csc(CN2CCC[C@H](c3n[nH]c(C4CC4)n3)C2)n1 ZINC000480862870 896228622 /nfs/dbraw/zinc/22/86/22/896228622.db2.gz JOYHNHLNPOBDRP-ZDUSSCGKSA-N 0 3 401.486 4.463 20 0 HIADHN COc1ccc([C@@H](C)NCc2ccc(CN3CCCC3=O)cc2)cc1Br ZINC000480876812 896233525 /nfs/dbraw/zinc/23/35/25/896233525.db2.gz HOCFPLXQQXHQTQ-OAHLLOKOSA-N 0 3 417.347 4.431 20 0 HIADHN CC[C@H](NCc1cccc(NC(=O)CCN2CCOCC2)c1)c1ccc(Cl)cc1 ZINC000480879390 896236234 /nfs/dbraw/zinc/23/62/34/896236234.db2.gz NWCQMGSCRYKHGH-QFIPXVFZSA-N 0 3 415.965 4.242 20 0 HIADHN COc1cc(CN[C@@H]2C[C@H](C)c3c2cccc3Br)ccc1OCCO ZINC000480887194 896243468 /nfs/dbraw/zinc/24/34/68/896243468.db2.gz DGGJLEJFUOLXNT-SUMWQHHRSA-N 0 3 406.320 4.167 20 0 HIADHN COCCOc1ccc([C@H](C)NCc2cccc(NC(=O)c3ccccn3)c2)cc1 ZINC000480887954 896244721 /nfs/dbraw/zinc/24/47/21/896244721.db2.gz GLWGPGACICJQAG-SFHVURJKSA-N 0 3 405.498 4.210 20 0 HIADHN C[C@@H](NCCNC(=O)c1ccc(Br)cc1)c1ccccc1OC(F)F ZINC000480904035 896259074 /nfs/dbraw/zinc/25/90/74/896259074.db2.gz FQDQAQYMYGKZDG-GFCCVEGCSA-N 0 3 413.262 4.131 20 0 HIADHN C[C@H](NCc1cccc(Cn2cccn2)c1)c1ccc(I)cc1 ZINC000480912050 896269231 /nfs/dbraw/zinc/26/92/31/896269231.db2.gz QTYCRBVHWYICBW-HNNXBMFYSA-N 0 3 417.294 4.387 20 0 HIADHN COc1ccc2ccccc2c1-c1cc(CN2CCC[C@@H](CN3CCOCC3)C2)on1 ZINC000481072557 896391973 /nfs/dbraw/zinc/39/19/73/896391973.db2.gz JROBJPHDHCRANW-IBGZPJMESA-N 0 3 421.541 4.048 20 0 HIADHN CCO[C@@H]1C[C@@H](O)C12CCN(Cc1cc(-c3c(OC)ccc4ccccc43)no1)CC2 ZINC000481094426 896417297 /nfs/dbraw/zinc/41/72/97/896417297.db2.gz QMFVYEXNZJHFBF-DHIUTWEWSA-N 0 3 422.525 4.255 20 0 HIADHN C[C@@H](NCc1ccccc1OCCN1CCOCC1)c1ccc(-c2ccncc2)cc1 ZINC000481196480 896550675 /nfs/dbraw/zinc/55/06/75/896550675.db2.gz ZGGZMSLXIIYQHG-OAQYLSRUSA-N 0 3 417.553 4.310 20 0 HIADHN C[C@@H](N[C@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O)c1ccc(-n2cncn2)cc1 ZINC000481235033 896585636 /nfs/dbraw/zinc/58/56/36/896585636.db2.gz JNLYMSRNAFAABZ-YJYMSZOUSA-N 0 3 416.312 4.030 20 0 HIADHN C[C@H](NCc1cccnc1N1CCN(C)CC1)c1ccc(OCc2ccccc2)cc1 ZINC000481236258 896587289 /nfs/dbraw/zinc/58/72/89/896587289.db2.gz ACJWMZBGMKUDQF-NRFANRHFSA-N 0 3 416.569 4.263 20 0 HIADHN CN(C)CCn1c(=O)oc2ccc(NC(=O)CCc3cc(Cl)cc(Cl)c3)cc21 ZINC000481241517 896591612 /nfs/dbraw/zinc/59/16/12/896591612.db2.gz KWWHXFPGUORASS-UHFFFAOYSA-N 0 3 422.312 4.034 20 0 HIADHN Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)NCc1cccnc1N1CCN(C)CC1 ZINC000481246426 896599447 /nfs/dbraw/zinc/59/94/47/896599447.db2.gz MEYRJNSFDBZOFR-SFHVURJKSA-N 0 3 421.614 4.425 20 0 HIADHN CCC[C@H](NCc1cccnc1N1CCN(C)CC1)c1cccc(C(F)(F)F)c1 ZINC000481255510 896605821 /nfs/dbraw/zinc/60/58/21/896605821.db2.gz IRASWQZDJNJPOQ-FQEVSTJZSA-N 0 3 406.496 4.483 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CCCn4c(cc5ccccc54)C3)c2)CC1 ZINC000481278144 896624781 /nfs/dbraw/zinc/62/47/81/896624781.db2.gz BMOXLMQTINUGQP-UHFFFAOYSA-N 0 3 417.557 4.221 20 0 HIADHN C[C@H]1CCCN(S(=O)(=O)c2ccc(CN[C@H]3CCc4cc(F)ccc43)cc2)C1 ZINC000481308229 896654362 /nfs/dbraw/zinc/65/43/62/896654362.db2.gz GBEKUWHHDJKYGK-AOMKIAJQSA-N 0 3 402.535 4.023 20 0 HIADHN COc1ccc(-c2nnc(NC(=O)N[C@H](C)[C@@H](c3ccccc3)N(C)C)s2)cc1 ZINC000481309597 896657001 /nfs/dbraw/zinc/65/70/01/896657001.db2.gz BVNRPIBZGNHPAS-KDOFPFPSSA-N 0 3 411.531 4.027 20 0 HIADHN CC[C@@H](N[C@@H]1CCc2c1cccc2OC)c1ccccc1OCC(=O)N1CCCC1 ZINC000481312276 896660122 /nfs/dbraw/zinc/66/01/22/896660122.db2.gz HNSDANONRDALLT-FGZHOGPDSA-N 0 3 408.542 4.425 20 0 HIADHN COc1cc([C@@H](C)N[C@H](C)c2ccc(OCC(=O)NC3CC3)cc2)ccc1SC ZINC000481317674 896670040 /nfs/dbraw/zinc/67/00/40/896670040.db2.gz YVNFEJHQEBRWSI-HZPDHXFCSA-N 0 3 414.571 4.486 20 0 HIADHN C[C@@H]1C[C@@H](NCc2cccc(OCC(=O)N(C)C)c2)c2cccc(Br)c21 ZINC000481317675 896670874 /nfs/dbraw/zinc/67/08/74/896670874.db2.gz QMBCPHOYSIUITJ-AUUYWEPGSA-N 0 3 417.347 4.254 20 0 HIADHN CN(CC(=O)Nc1ccccc1Cl)C(=O)CN[C@@H](CC1CCC1)c1ccccc1 ZINC000481328525 896685089 /nfs/dbraw/zinc/68/50/89/896685089.db2.gz CVEDXFSOPVNMKA-NRFANRHFSA-N 0 3 413.949 4.258 20 0 HIADHN Cc1nc(C(C)(C)C)sc1[C@H](C)NCc1cccc(OCCN2CCOCC2)c1 ZINC000481422700 896825109 /nfs/dbraw/zinc/82/51/09/896825109.db2.gz KXMQXWHCYTVKSU-KRWDZBQOSA-N 0 3 417.619 4.311 20 0 HIADHN O=C(Nc1cccc(CN[C@H]2CCc3ccc(OC(F)(F)F)cc32)c1)[C@H]1CCCO1 ZINC000481561605 896937962 /nfs/dbraw/zinc/93/79/62/896937962.db2.gz KOVPDWWCOUBFSZ-VQTJNVASSA-N 0 3 420.431 4.480 20 0 HIADHN CCC[C@H](NCc1ccc(S(=O)(=O)N(C)C(C)C)cc1)c1ccc(OC)cc1 ZINC000481563556 896940533 /nfs/dbraw/zinc/94/05/33/896940533.db2.gz OBJUFEFJRYABOH-QFIPXVFZSA-N 0 3 404.576 4.355 20 0 HIADHN Cn1cc(-c2cc(CN3CCC(COc4ccccc4C(F)(F)F)CC3)on2)cn1 ZINC000481613866 896994768 /nfs/dbraw/zinc/99/47/68/896994768.db2.gz PQCWWNYOIYISTC-UHFFFAOYSA-N 0 3 420.435 4.385 20 0 HIADHN CCO[C@H](C)c1ncc(C(=O)Nc2cc(C)cc(N3CCN(C(C)C)CC3)c2)s1 ZINC000481647571 897033437 /nfs/dbraw/zinc/03/34/37/897033437.db2.gz TXXHEJFMQRJEPH-QGZVFWFLSA-N 0 3 416.591 4.332 20 0 HIADHN Cc1ccc(C(=O)CCC(=O)Nc2cc(C)cc(N3CCN(C(C)C)CC3)c2)s1 ZINC000481654353 897039647 /nfs/dbraw/zinc/03/96/47/897039647.db2.gz IOMACZCSSMJPKP-UHFFFAOYSA-N 0 3 413.587 4.497 20 0 HIADHN Cc1c(C(=O)Nc2cc(C)cc(N3CCN(C(C)C)CC3)c2)cnn1-c1ccccc1 ZINC000481667132 897051298 /nfs/dbraw/zinc/05/12/98/897051298.db2.gz GODVIVGPBGRIBQ-UHFFFAOYSA-N 0 3 417.557 4.272 20 0 HIADHN CC1(C)CC[C@@H](NCc2ccccc2OCC(=O)NC[C@H]2CCCO2)c2ccccc21 ZINC000481672688 897055734 /nfs/dbraw/zinc/05/57/34/897055734.db2.gz SGRIZMLYBCNTIW-NFBKMPQASA-N 0 3 422.569 4.263 20 0 HIADHN CC(=O)N1CCC[C@H](CN[C@@H](C(=O)Nc2ccc(C)c(Cl)c2)c2ccccc2)C1 ZINC000481682358 897065456 /nfs/dbraw/zinc/06/54/56/897065456.db2.gz BCRIXSZOSRXJMX-XMSQKQJNSA-N 0 3 413.949 4.176 20 0 HIADHN CC(=O)N1CCC[C@H](CN[C@H](C(=O)Nc2ccc(C)c(Cl)c2)c2ccccc2)C1 ZINC000481682356 897065872 /nfs/dbraw/zinc/06/58/72/897065872.db2.gz BCRIXSZOSRXJMX-GCJKJVERSA-N 0 3 413.949 4.176 20 0 HIADHN NC(=O)c1ccc(NC(=O)CCN2CC=C(c3cccc(Cl)c3)CC2)cc1Cl ZINC000481770096 897155193 /nfs/dbraw/zinc/15/51/93/897155193.db2.gz RWZHANNWRBGILK-UHFFFAOYSA-N 0 3 418.324 4.210 20 0 HIADHN CCCN(C(=O)NC1CCN(CCOC(C)C)CC1)[C@@H]1C[C@H](OCC)C12CCCC2 ZINC000481788024 897168870 /nfs/dbraw/zinc/16/88/70/897168870.db2.gz YSRISVRFJOJAKK-YADHBBJMSA-N 0 3 423.642 4.035 20 0 HIADHN CC(C)[C@]1(C)C[C@@H]1C(=O)NC1CCN(CCOc2ccc(Br)cc2)CC1 ZINC000481803108 897180540 /nfs/dbraw/zinc/18/05/40/897180540.db2.gz DYFOGQMLIDCRLK-CTNGQTDRSA-N 0 3 423.395 4.091 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)C1(Cc2cccc(F)c2)CCC1 ZINC000481815231 897189105 /nfs/dbraw/zinc/18/91/05/897189105.db2.gz WKOWSDTXEQQTNP-UHFFFAOYSA-N 0 3 410.533 4.382 20 0 HIADHN CN(Cc1ccccc1)Cc1cccc(C(=O)N2CCN[C@H](c3cccc(F)c3)C2)c1 ZINC000505466423 914137421 /nfs/dbraw/zinc/13/74/21/914137421.db2.gz AICXMADGXLGIBT-VWLOTQADSA-N 0 3 417.528 4.244 20 0 HIADHN C[C@H]1CCCN(S(=O)(=O)c2ccc(CN[C@@H](c3cccnc3)C3CCC3)cc2)C1 ZINC000481915629 897299181 /nfs/dbraw/zinc/29/91/81/897299181.db2.gz MSAZHHBFDJFROV-FDDCHVKYSA-N 0 3 413.587 4.133 20 0 HIADHN COc1ccc(-c2nnc(NC(=O)N[C@H]3CCN([C@@H](C)c4ccccc4)C3)s2)cc1 ZINC000481974834 897367349 /nfs/dbraw/zinc/36/73/49/897367349.db2.gz SUHPJYQSUQJRPK-YJBOKZPZSA-N 0 3 423.542 4.171 20 0 HIADHN CC(C)C[C@H](N[C@@H](C)Cc1ccccc1C(F)(F)F)c1nc(-c2nc[nH]n2)no1 ZINC000481982369 897375428 /nfs/dbraw/zinc/37/54/28/897375428.db2.gz FPAIEDHFHOYQQC-WFASDCNBSA-N 0 3 408.428 4.182 20 0 HIADHN COC(=O)c1ccccc1-c1ccc(CN2CCC(C(=O)NC3CCCCC3)CC2)o1 ZINC000481988904 897384058 /nfs/dbraw/zinc/38/40/58/897384058.db2.gz DOBBMYFLMAISRP-UHFFFAOYSA-N 0 3 424.541 4.394 20 0 HIADHN COc1ccc(CCN[C@@H](C)c2nnn(-c3ccccc3)c2C)cc1OC(F)F ZINC000482012510 897412729 /nfs/dbraw/zinc/41/27/29/897412729.db2.gz GBYFTVXMJHEBTC-AWEZNQCLSA-N 0 3 402.445 4.079 20 0 HIADHN CC(=O)N1CCN(c2ccccc2CN[C@H]2CCc3c2ccc(Cl)c3Cl)CC1 ZINC000482032447 897443128 /nfs/dbraw/zinc/44/31/28/897443128.db2.gz LABWIBNWQUEQGW-FQEVSTJZSA-N 0 3 418.368 4.439 20 0 HIADHN CC(=O)N1CCN(c2ccccc2CN[C@@H](C)c2cccc(-c3ccncc3)c2)CC1 ZINC000482032198 897443540 /nfs/dbraw/zinc/44/35/40/897443540.db2.gz KQCRZTXREGRQRW-FQEVSTJZSA-N 0 3 414.553 4.268 20 0 HIADHN C[C@H](c1ccc(F)cc1F)N1CCN(C(=O)c2cccc(CN3CCCC3)c2)CC1 ZINC000505481896 914162640 /nfs/dbraw/zinc/16/26/40/914162640.db2.gz UQPXDWLNHHQCQV-GOSISDBHSA-N 0 3 413.512 4.080 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)Nc1cnn(-c2ccc(Cl)cc2)c1 ZINC000482063628 897496073 /nfs/dbraw/zinc/49/60/73/897496073.db2.gz URPGWBZPUJBTNL-UHFFFAOYSA-N 0 3 415.900 4.261 20 0 HIADHN Cc1nn(C(C)(C)C)c2nc(C3CC3)cc(C(=O)N3CCN(C4CCCCC4)CC3)c12 ZINC000482073760 897508843 /nfs/dbraw/zinc/50/88/43/897508843.db2.gz KKYVIXWLSOIJED-UHFFFAOYSA-N 0 3 423.605 4.463 20 0 HIADHN COc1ccc2ccccc2c1-c1cc(CNC(=O)c2cccc(CN(C)C)c2)on1 ZINC000482077058 897514519 /nfs/dbraw/zinc/51/45/19/897514519.db2.gz OFTAOJITYLSCSA-UHFFFAOYSA-N 0 3 415.493 4.495 20 0 HIADHN Cc1ccc(-n2cccn2)cc1NC(=O)NC[C@H](c1ccc(OC(C)C)cc1)N(C)C ZINC000482078928 897518229 /nfs/dbraw/zinc/51/82/29/897518229.db2.gz RBGSAIOCZHKRSG-HSZRJFAPSA-N 0 3 421.545 4.392 20 0 HIADHN Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)NC(=O)c1cccc(CN2CCCC2)c1 ZINC000482078883 897518466 /nfs/dbraw/zinc/51/84/66/897518466.db2.gz QNRBHBXVRLTCFI-AWEZNQCLSA-N 0 3 408.468 4.149 20 0 HIADHN CN(C)C[C@@H](NC(=O)Nc1ccc(Cl)cc1-n1cccn1)c1ccc(F)cc1 ZINC000482086034 897526128 /nfs/dbraw/zinc/52/61/28/897526128.db2.gz WVHMVPSVMHNBGR-GOSISDBHSA-N 0 3 401.873 4.089 20 0 HIADHN Cc1nn(Cc2ccc(Cl)cc2)c(C)c1C(=O)NC[C@H](c1ccccc1)N(C)C ZINC000482086580 897528236 /nfs/dbraw/zinc/52/82/36/897528236.db2.gz BKSQEBATVOQHHU-OAQYLSRUSA-N 0 3 410.949 4.234 20 0 HIADHN C[C@@H](NCc1ccc([C@@]2(C)NC(=O)NC2=O)cc1)c1ccc(Oc2ccccc2)cc1 ZINC000482104221 897552998 /nfs/dbraw/zinc/55/29/98/897552998.db2.gz FNVTZKFDUTWFPW-CRICUBBOSA-N 0 3 415.493 4.384 20 0 HIADHN C[C@H](NCc1ccc(NC(=O)c2cccnc2)cc1)c1cccc(N2CCCC2=O)c1 ZINC000482112504 897563148 /nfs/dbraw/zinc/56/31/48/897563148.db2.gz FPUMQQPVRAZIEX-SFHVURJKSA-N 0 3 414.509 4.312 20 0 HIADHN COc1ccccc1N1CC[C@@H](CN[C@H](C)c2nnn(-c3ccc(C)cc3)c2C)C1 ZINC000482114554 897566756 /nfs/dbraw/zinc/56/67/56/897566756.db2.gz NZSVNISKZHUGLJ-QUCCMNQESA-N 0 3 405.546 4.070 20 0 HIADHN Cc1nc(C(C)(C)C)sc1[C@H](C)NCCC(=O)N1CCN(c2ccccc2)CC1 ZINC000482115771 897567732 /nfs/dbraw/zinc/56/77/32/897567732.db2.gz SQVVAJMTONWLDH-KRWDZBQOSA-N 0 3 414.619 4.139 20 0 HIADHN COCCOc1ccc([C@@H](C)NCc2ccc(NC(=O)c3ccncc3)cc2)cc1 ZINC000482117689 897569492 /nfs/dbraw/zinc/56/94/92/897569492.db2.gz DXUSDGRVNHZMCZ-GOSISDBHSA-N 0 3 405.498 4.210 20 0 HIADHN COc1cc([C@@H](C)NCc2ccc(NC(=O)c3ccncc3)cc2)cc(OC)c1OC ZINC000482119178 897572751 /nfs/dbraw/zinc/57/27/51/897572751.db2.gz ILGLMIJFRYGMGE-MRXNPFEDSA-N 0 3 421.497 4.211 20 0 HIADHN COc1cc([C@H](C)NCc2ccc(NC(=O)c3ccncc3)cc2)cc(OC)c1OC ZINC000482119177 897572896 /nfs/dbraw/zinc/57/28/96/897572896.db2.gz ILGLMIJFRYGMGE-INIZCTEOSA-N 0 3 421.497 4.211 20 0 HIADHN C[C@H](NCc1ccc(Oc2cccc(F)c2)nc1)c1ccc(NS(C)(=O)=O)cc1 ZINC000482134655 897592197 /nfs/dbraw/zinc/59/21/97/897592197.db2.gz LOPHSHKJKTXMCK-HNNXBMFYSA-N 0 3 415.490 4.235 20 0 HIADHN Cc1nn(Cc2ccc(Cl)cc2)c(C)c1C(=O)NC[C@H](Cc1ccccc1)N(C)C ZINC000482150846 897614291 /nfs/dbraw/zinc/61/42/91/897614291.db2.gz NCPYNLODRSFRAN-QFIPXVFZSA-N 0 3 424.976 4.104 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)CSc1nccc2ccccc21 ZINC000482176217 897643294 /nfs/dbraw/zinc/64/32/94/897643294.db2.gz KUJSPWVIFTYSHI-NRFANRHFSA-N 0 3 420.582 4.235 20 0 HIADHN C[C@H]1Cc2ccccc2N1Cc1ccoc1C(=O)NC[C@@H](c1ccccc1)N(C)C ZINC000482189894 897660985 /nfs/dbraw/zinc/66/09/85/897660985.db2.gz ADYLLHZYPMHXGM-MBSDFSHPSA-N 0 3 403.526 4.264 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)N[C@H](c1ccc(F)cc1)C(F)(F)F)c1ccco1 ZINC000482207865 897687007 /nfs/dbraw/zinc/68/70/07/897687007.db2.gz IRTYYUAREQGWBX-ISTRZQFTSA-N 0 3 401.404 4.451 20 0 HIADHN COC(=O)c1ccc(COc2ccc(CNCc3ccc(F)c(C)c3)cc2OC)o1 ZINC000482225690 897704892 /nfs/dbraw/zinc/70/48/92/897704892.db2.gz LZUCMSQULNLDEA-UHFFFAOYSA-N 0 3 413.445 4.391 20 0 HIADHN CCC[C@H](N[C@H]1CCCc2nc(CC)sc21)C(=O)N1CCc2sccc2C1 ZINC000482239548 897721902 /nfs/dbraw/zinc/72/19/02/897721902.db2.gz BGGWNUGUPBJMOQ-RDJZCZTQSA-N 0 3 403.617 4.488 20 0 HIADHN Cc1c([C@H](C)NC2CCN(C(=O)c3ccc(C)cc3)CC2)nnn1-c1ccc(C)cc1 ZINC000482242001 897724057 /nfs/dbraw/zinc/72/40/57/897724057.db2.gz JDSSPNBBBKSRDH-IBGZPJMESA-N 0 3 417.557 4.148 20 0 HIADHN C[C@@H](NCc1ccc2c(c1)OCCCO2)c1ccc(I)cc1 ZINC000482246142 897727961 /nfs/dbraw/zinc/72/79/61/897727961.db2.gz KJJNZPYWAPWACG-CYBMUJFWSA-N 0 3 409.267 4.303 20 0 HIADHN COC(=O)c1ccc(Cl)c(CNC2CCN(c3nc4ccccc4s3)CC2)c1 ZINC000482247913 897729781 /nfs/dbraw/zinc/72/97/81/897729781.db2.gz WINJBIRFEJIQNX-UHFFFAOYSA-N 0 3 415.946 4.495 20 0 HIADHN C[C@H](N[C@@H](C)c1cccc(S(=O)(=O)N(C)C)c1)c1cccc(-c2ccncc2)c1 ZINC000482249025 897731488 /nfs/dbraw/zinc/73/14/88/897731488.db2.gz YEZONIFSGLHSGE-ROUUACIJSA-N 0 3 409.555 4.411 20 0 HIADHN O=C(N[C@H]1CCN(c2ccccc2C(F)(F)F)C1)c1cccc(CN2CCCC2)c1 ZINC000482259405 897742014 /nfs/dbraw/zinc/74/20/14/897742014.db2.gz DVCAJVNCROQYSL-IBGZPJMESA-N 0 3 417.475 4.310 20 0 HIADHN COc1ccc([C@H](NC(=O)N(CCN(C)C)Cc2cccs2)C(F)(F)F)cc1 ZINC000482338235 897844839 /nfs/dbraw/zinc/84/48/39/897844839.db2.gz ZACSYMZGXNHSMK-KRWDZBQOSA-N 0 3 415.481 4.134 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)c2cccc(Oc3ccncc3)c2)c1 ZINC000482353709 897867815 /nfs/dbraw/zinc/86/78/15/897867815.db2.gz CBNWKAZZGREVFN-UHFFFAOYSA-N 0 3 405.498 4.087 20 0 HIADHN C[C@@H](NC(=O)N[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)C1=CCN(C)CC1 ZINC000482355088 897870215 /nfs/dbraw/zinc/87/02/15/897870215.db2.gz UBZUTBQYFFMEMJ-IAQYHMDHSA-N 0 3 409.374 4.258 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)c2cccc(-c3ccccn3)c2C)c1 ZINC000482358288 897874853 /nfs/dbraw/zinc/87/48/53/897874853.db2.gz DLQUSIOCSYMCNA-UHFFFAOYSA-N 0 3 403.526 4.270 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)c2cnc(-c3ccsc3)s2)c1 ZINC000482364400 897883691 /nfs/dbraw/zinc/88/36/91/897883691.db2.gz VWTPEHDDSRZJGB-UHFFFAOYSA-N 0 3 401.557 4.084 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)c2csc(Br)c2C)c1 ZINC000482407820 897949917 /nfs/dbraw/zinc/94/99/17/897949917.db2.gz UNCJIIBVTFCMPB-UHFFFAOYSA-N 0 3 411.365 4.032 20 0 HIADHN COC(=O)c1ccc(C(C)C)c(NC(=O)N[C@H](CN(C)C)c2ccc(F)cc2)c1 ZINC000482419410 897969043 /nfs/dbraw/zinc/96/90/43/897969043.db2.gz FTQUSEATXAXFRK-HXUWFJFHSA-N 0 3 401.482 4.160 20 0 HIADHN Cc1cc(CN2CC(C)(C)O[C@@]3(CCCOC3)C2)cc(C)c1OCc1ccccn1 ZINC000482435558 897994088 /nfs/dbraw/zinc/99/40/88/897994088.db2.gz ATZUDGLCPOYQQL-VWLOTQADSA-N 0 3 410.558 4.437 20 0 HIADHN CCN(Cc1c(C)nn(C)c1N1CCOCC1)[C@H](C)Cc1ccccc1C(F)(F)F ZINC000482461479 898034822 /nfs/dbraw/zinc/03/48/22/898034822.db2.gz SLGOJLPPKDQYJI-MRXNPFEDSA-N 0 3 424.511 4.037 20 0 HIADHN O=C([C@H]1CCCN(Cc2cccc(F)c2)C1)N1CCC[C@@]2(C1)OCc1ccccc12 ZINC000482473117 898047748 /nfs/dbraw/zinc/04/77/48/898047748.db2.gz BFGAQQSUFVULOH-CPJSRVTESA-N 0 3 408.517 4.086 20 0 HIADHN COC(=O)COc1ccc(CN[C@H](c2cc(F)cc(Br)c2)C2CC2)cc1 ZINC000482511692 898097323 /nfs/dbraw/zinc/09/73/23/898097323.db2.gz SYWMRYHBUCKTJE-FQEVSTJZSA-N 0 3 422.294 4.381 20 0 HIADHN CC(=O)N[C@@H](C)C1CCN(Cc2cnc(-c3ccc(Br)cc3)s2)CC1 ZINC000482513675 898099792 /nfs/dbraw/zinc/09/97/92/898099792.db2.gz UWWCHKLCSKLCMY-ZDUSSCGKSA-N 0 3 422.392 4.309 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@@H](C)N[C@@H](C)c2cc(OC)ccc2OC)CC1 ZINC000482549624 898138446 /nfs/dbraw/zinc/13/84/46/898138446.db2.gz HSXDGHMNUFTWLF-MSOLQXFVSA-N 0 3 415.553 4.397 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@H](C)N[C@@H](C)c2cc(OC)ccc2OC)CC1 ZINC000482549640 898140385 /nfs/dbraw/zinc/14/03/85/898140385.db2.gz HSXDGHMNUFTWLF-ROUUACIJSA-N 0 3 415.553 4.397 20 0 HIADHN Cn1c(CNC[C@H](CO)Cc2ccc(C(F)(F)F)cc2)nc2ccc(Cl)cc21 ZINC000482576102 898171863 /nfs/dbraw/zinc/17/18/63/898171863.db2.gz CUWONCUYXMVLKI-CQSZACIVSA-N 0 3 411.855 4.186 20 0 HIADHN Cc1ccc(I)c(C(=O)Nc2cc(CN(C)C)ccc2C)c1 ZINC000482583618 898180326 /nfs/dbraw/zinc/18/03/26/898180326.db2.gz HVSFHRPQHBNVBC-UHFFFAOYSA-N 0 3 408.283 4.222 20 0 HIADHN CCc1c(C(=O)Nc2cc(CN(C)C)ccc2C)nnn1-c1ccc(OC(C)C)cc1 ZINC000482586642 898183910 /nfs/dbraw/zinc/18/39/10/898183910.db2.gz LVGIJXWXBZTULN-UHFFFAOYSA-N 0 3 421.545 4.239 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)[C@@H](CC(C)C)NC(=O)c1ccc(Cl)cc1 ZINC000482616033 898218516 /nfs/dbraw/zinc/21/85/16/898218516.db2.gz FIZOQJUYVFKONF-OAQYLSRUSA-N 0 3 415.965 4.493 20 0 HIADHN CC(C)CN(C(=O)NC[C@H](Cc1ccccc1)N(C)C)[C@@H]1CCCc2cccnc21 ZINC000482634167 898237434 /nfs/dbraw/zinc/23/74/34/898237434.db2.gz IVQUPMVDCCHGSB-XZOQPEGZSA-N 0 3 408.590 4.300 20 0 HIADHN CCc1c(NC(=O)CCCN2CCN(c3ccccc3)CC2)cnn1C(CC)CC ZINC000482695420 898294721 /nfs/dbraw/zinc/29/47/21/898294721.db2.gz PVLBXJWKWMREMT-UHFFFAOYSA-N 0 3 411.594 4.348 20 0 HIADHN O=C(Nc1cccc(NC(=O)N2CCN(C3CCCCC3)CC2)c1)c1cccs1 ZINC000482728071 898329715 /nfs/dbraw/zinc/32/97/15/898329715.db2.gz BNTNNHUEMDYKJQ-UHFFFAOYSA-N 0 3 412.559 4.483 20 0 HIADHN O=C(N[C@@H](c1nccs1)c1ccccc1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000505546015 914246072 /nfs/dbraw/zinc/24/60/72/914246072.db2.gz ATCLAFAISRWZHS-TZIWHRDSSA-N 0 3 409.530 4.400 20 0 HIADHN CC(=O)Nc1cccc(OCCNCc2cn(Cc3ccccc3)nc2C(C)(C)C)c1 ZINC000482777411 898385841 /nfs/dbraw/zinc/38/58/41/898385841.db2.gz DNXNPSVOIXYNRO-UHFFFAOYSA-N 0 3 420.557 4.356 20 0 HIADHN Cc1nc(CC(=O)N(CCN(C)Cc2ccccc2)Cc2ccccc2)c(C)s1 ZINC000482826779 898435071 /nfs/dbraw/zinc/43/50/71/898435071.db2.gz LTZAHGKWUIDULZ-UHFFFAOYSA-N 0 3 407.583 4.463 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)c2sc(C3CC3)nc2-c2ccccc2)C[C@@H](C)O1 ZINC000482835913 898443853 /nfs/dbraw/zinc/44/38/53/898443853.db2.gz LNWOHUULMLYELZ-IAGOWNOFSA-N 0 3 413.587 4.307 20 0 HIADHN COc1ccc(-c2nc(C)c([C@@H](C)N[C@@H](Cc3ccccc3)C(=O)N(C)C)s2)cc1 ZINC000482864791 898476139 /nfs/dbraw/zinc/47/61/39/898476139.db2.gz IVUAZIDTNWWMHC-IERDGZPVSA-N 0 3 423.582 4.477 20 0 HIADHN CC(C)C[C@@H](C)Oc1cc(CN[C@H](C)c2ccc(NS(C)(=O)=O)cc2)ccn1 ZINC000482888972 898506442 /nfs/dbraw/zinc/50/64/42/898506442.db2.gz NQKZEOQAYHJSAV-IAGOWNOFSA-N 0 3 405.564 4.117 20 0 HIADHN CC[C@H](C(=O)Nc1ccc(OC)cc1)N1CCC(n2c(C)nc3ccccc32)CC1 ZINC000482889852 898508347 /nfs/dbraw/zinc/50/83/47/898508347.db2.gz MDXJQCIDEQJLPG-JOCHJYFZSA-N 0 3 406.530 4.408 20 0 HIADHN COc1ccc([C@H](C)NCCC(=O)N(C)Cc2ccccc2Br)c(F)c1 ZINC000482892870 898511700 /nfs/dbraw/zinc/51/17/00/898511700.db2.gz VGDLGHUDKKBPJS-AWEZNQCLSA-N 0 3 423.326 4.296 20 0 HIADHN Cc1nc2ccccc2n1C1CCN(CC(=O)N(Cc2ccccc2)C2CC2)CC1 ZINC000482905514 898524705 /nfs/dbraw/zinc/52/47/05/898524705.db2.gz UATLJRBHTSJFPV-UHFFFAOYSA-N 0 3 402.542 4.173 20 0 HIADHN Cc1cccc(CC2(O)CCN(C[C@H](O)COc3ccc(Cl)cc3Cl)CC2)c1 ZINC000482933727 898557053 /nfs/dbraw/zinc/55/70/53/898557053.db2.gz XRYSYFVDGLZQBC-IBGZPJMESA-N 0 3 424.368 4.111 20 0 HIADHN C[C@@H](NCc1ccc(-c2nc3ccccc3[nH]2)cc1)c1ccc(NS(C)(=O)=O)cc1 ZINC000482951910 898579832 /nfs/dbraw/zinc/57/98/32/898579832.db2.gz ZLJDZFUCIVWFRS-MRXNPFEDSA-N 0 3 420.538 4.452 20 0 HIADHN COc1ccc(NC(=O)N2CCN(C3CCCCC3)CC2)cc1OCc1ccncc1 ZINC000483034629 898701240 /nfs/dbraw/zinc/70/12/40/898701240.db2.gz FHKDBINDEKAICO-UHFFFAOYSA-N 0 3 424.545 4.151 20 0 HIADHN CO[C@]1(C)CCCN(CC(=O)NC[C@H](c2c[nH]c3ccccc32)c2ccccc2)CC1 ZINC000483038489 898704599 /nfs/dbraw/zinc/70/45/99/898704599.db2.gz UQSWUXNDKTZCFE-BKMJKUGQSA-N 0 3 419.569 4.307 20 0 HIADHN Cc1ccccc1[C@H](N[C@@H](C)c1cccc(S(=O)(=O)N2CCOCC2)c1)C(C)C ZINC000483117026 898805884 /nfs/dbraw/zinc/80/58/84/898805884.db2.gz WVOIDOLKEHWULU-WMZHIEFXSA-N 0 3 416.587 4.064 20 0 HIADHN CC[C@@H]1CN(CCC(=O)Nc2ccc(Oc3ccccc3)cc2)C[C@@]2(CCOC2)O1 ZINC000483147710 898825069 /nfs/dbraw/zinc/82/50/69/898825069.db2.gz BKBJAPOXBBLVGR-HYBUGGRVSA-N 0 3 410.514 4.077 20 0 HIADHN COCCNS(=O)(=O)c1cccc(CN[C@@H](CC(C)C)c2ccc(Cl)cc2)c1 ZINC000483165213 898834617 /nfs/dbraw/zinc/83/46/17/898834617.db2.gz BINRPHDCQKNLPM-NRFANRHFSA-N 0 3 424.994 4.142 20 0 HIADHN Cc1ccc(NC(=O)N2CCN(C3CCCCC3)CC2)cc1OCC1CCOCC1 ZINC000483179162 898843507 /nfs/dbraw/zinc/84/35/07/898843507.db2.gz BJHPUFFWZSVXLL-UHFFFAOYSA-N 0 3 415.578 4.283 20 0 HIADHN CCC1(C(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)CCN(C(=O)c2ccccc2)CC1 ZINC000505585125 914291611 /nfs/dbraw/zinc/29/16/11/914291611.db2.gz DBFSDDIEUVTGEF-REWPJTCUSA-N 0 3 421.585 4.127 20 0 HIADHN OC[C@@H](NCCOc1ccccc1)c1ccc(Br)cc1C(F)(F)F ZINC000483263319 898903611 /nfs/dbraw/zinc/90/36/11/898903611.db2.gz XQHOVTHGJCQJAS-MRXNPFEDSA-N 0 3 404.226 4.170 20 0 HIADHN C[C@H](NC(=O)c1cccc(-c2noc(C(F)(F)F)n2)c1)[C@@H](c1ccccc1)N(C)C ZINC000505590132 914297396 /nfs/dbraw/zinc/29/73/96/914297396.db2.gz DXKHAQVNDOKJRM-GUYCJALGSA-N 0 3 418.419 4.177 20 0 HIADHN C[C@@H](c1cccc(N2CCCS2(=O)=O)c1)N(C)Cc1ccc(OCC2CC2)cc1 ZINC000483330436 898957903 /nfs/dbraw/zinc/95/79/03/898957903.db2.gz KXYPAJNYBLOYKZ-SFHVURJKSA-N 0 3 414.571 4.208 20 0 HIADHN C[C@@H](NC(=O)C1(c2ccccc2Br)CC1)[C@@H](c1ccccc1)N(C)C ZINC000505597201 914303615 /nfs/dbraw/zinc/30/36/15/914303615.db2.gz QTZOTKHHXCLTOX-BEFAXECRSA-N 0 3 401.348 4.288 20 0 HIADHN COc1cccc(CN(Cc2ccc(OCC(F)(F)F)nc2)C2CCC(O)CC2)c1 ZINC000483390988 899025698 /nfs/dbraw/zinc/02/56/98/899025698.db2.gz FEMGJGYXISOQGX-UHFFFAOYSA-N 0 3 424.463 4.337 20 0 HIADHN CS[C@H]1CN(C(=O)c2csc(-c3ccc(C)cc3C)n2)C[C@H]1N1CCCC1 ZINC000483392526 899026884 /nfs/dbraw/zinc/02/68/84/899026884.db2.gz IAVXJVHZEKQCRL-MOPGFXCFSA-N 0 3 401.601 4.079 20 0 HIADHN CS[C@H]1CN(C(=O)c2csc(-c3ccccc3Cl)n2)C[C@H]1N1CCCC1 ZINC000483392189 899027540 /nfs/dbraw/zinc/02/75/40/899027540.db2.gz HKFBFLAOKOVZME-SJORKVTESA-N 0 3 407.992 4.115 20 0 HIADHN COc1ccccc1-c1nc(C2CCN(Cc3cc(OC)c(OC)cc3C)CC2)no1 ZINC000483430455 899062077 /nfs/dbraw/zinc/06/20/77/899062077.db2.gz WMHULYPNJFUFSV-UHFFFAOYSA-N 0 3 423.513 4.450 20 0 HIADHN CC(C)[C@H](CNC(=O)c1cscc1Br)N1CCc2ccccc2C1 ZINC000505606733 914310836 /nfs/dbraw/zinc/31/08/36/914310836.db2.gz GRZSROXMKQBKMO-SFHVURJKSA-N 0 3 407.377 4.323 20 0 HIADHN Cc1occc1-c1cc(NC(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)no1 ZINC000483445046 899080037 /nfs/dbraw/zinc/08/00/37/899080037.db2.gz JOMKQHIJNAWKIA-LJQANCHMSA-N 0 3 412.490 4.455 20 0 HIADHN Cc1sc2ncnc(SCC(=O)N[C@@H](C)[C@@H](c3ccccc3)N(C)C)c2c1C ZINC000505609155 914314400 /nfs/dbraw/zinc/31/44/00/914314400.db2.gz KHSVJLMICLWVGT-LIRRHRJNSA-N 0 3 414.600 4.208 20 0 HIADHN Cc1ccc(OCc2nc(CC(=O)N[C@H](C)[C@H](c3ccccc3)N(C)C)cs2)cc1 ZINC000505613629 914318053 /nfs/dbraw/zinc/31/80/53/914318053.db2.gz ZTBDHVPOWIYDMY-HOYKHHGWSA-N 0 3 423.582 4.381 20 0 HIADHN COc1ccc(-c2cnc(CCC(=O)N[C@@H](C)[C@@H](c3ccccc3)N(C)C)o2)cc1 ZINC000505615867 914319660 /nfs/dbraw/zinc/31/96/60/914319660.db2.gz YZKLSJXMKNMFLG-XDHUDOTRSA-N 0 3 407.514 4.090 20 0 HIADHN C[C@@H]1CCN(C(=O)Nc2ccc(OCC(F)F)cc2)CCN1Cc1ccccc1 ZINC000483586438 899237507 /nfs/dbraw/zinc/23/75/07/899237507.db2.gz AHGDTMLCBYQNAN-QGZVFWFLSA-N 0 3 403.473 4.459 20 0 HIADHN CCN1CCN(c2ccccc2CN[C@@H](C)c2nc(-c3ccc(F)c(C)c3)no2)CC1 ZINC000483649263 899307164 /nfs/dbraw/zinc/30/71/64/899307164.db2.gz DOYAGCZEQLEQAN-SFHVURJKSA-N 0 3 423.536 4.177 20 0 HIADHN CNC(=O)[C@H](Cc1c[nH]c2ccccc12)N[C@@H]1CCc2ccc(OC(F)(F)F)cc21 ZINC000483710538 899365499 /nfs/dbraw/zinc/36/54/99/899365499.db2.gz HUVOHXLNAXFFBN-UXHICEINSA-N 0 3 417.431 4.001 20 0 HIADHN C[C@@H](N[C@H]1CCCN(c2ccccc2Cl)C1=O)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000483717444 899376201 /nfs/dbraw/zinc/37/62/01/899376201.db2.gz ZGJXYXLYYYRBLA-KUHUBIRLSA-N 0 3 411.933 4.416 20 0 HIADHN COc1ccccc1[C@@H](C)NCc1cc(C(F)(F)F)ccc1N1CCN(C)CC1 ZINC000483730883 899391567 /nfs/dbraw/zinc/39/15/67/899391567.db2.gz OUGHIAMSZUBXPO-MRXNPFEDSA-N 0 3 407.480 4.317 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2ccccc2CC(F)(F)F)c1 ZINC000483784066 899451262 /nfs/dbraw/zinc/45/12/62/899451262.db2.gz ARVLAAXFCXBIAR-UHFFFAOYSA-N 0 3 409.452 4.396 20 0 HIADHN Cc1ccc(NC(=O)[C@@H]2CCCN(C(=O)Nc3ccccc3F)C2)c(CN(C)C)c1 ZINC000505655913 914354120 /nfs/dbraw/zinc/35/41/20/914354120.db2.gz FBBHLCWOFTXRFU-QGZVFWFLSA-N 0 3 412.509 4.078 20 0 HIADHN Cc1ccc(NC(=O)[C@H](C)NC(=O)c2cccc(Cl)c2Cl)c(CN(C)C)c1 ZINC000505652770 914350255 /nfs/dbraw/zinc/35/02/55/914350255.db2.gz BAUPQIOYIJIUGN-ZDUSSCGKSA-N 0 3 408.329 4.120 20 0 HIADHN CC[C@@H]1Oc2cc([C@@H](C)N[C@H](C)c3cccc(N4CCCC4=O)c3)ccc2NC1=O ZINC000483868229 899549311 /nfs/dbraw/zinc/54/93/11/899549311.db2.gz GPTRULJKPZXURD-ZOCZFRKYSA-N 0 3 407.514 4.335 20 0 HIADHN CN(C)C[C@H](NC(=O)N[C@H](c1cc(F)ccc1F)C(F)F)c1ccc(F)cc1 ZINC000483881533 899557702 /nfs/dbraw/zinc/55/77/02/899557702.db2.gz FHOSHNUHPJCDQT-DLBZAZTESA-N 0 3 401.379 4.012 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N[C@@H](C)c1cccc(Cl)c1Cl ZINC000483908590 899577523 /nfs/dbraw/zinc/57/75/23/899577523.db2.gz CDRSXBFEZMUTMN-ZDUSSCGKSA-N 0 3 408.329 4.179 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)NC(c1cccs1)c1cccs1 ZINC000483929900 899590856 /nfs/dbraw/zinc/59/08/56/899590856.db2.gz PQHSAVFDSCAGJM-UHFFFAOYSA-N 0 3 413.568 4.024 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2cc(Cl)ccc2N(C)C)c1 ZINC000483983674 899626690 /nfs/dbraw/zinc/62/66/90/899626690.db2.gz XMHYQKZNKNZPDG-UHFFFAOYSA-N 0 3 404.942 4.010 20 0 HIADHN O=C(c1cnc(Cc2ccccc2F)s1)N1C[C@H]2CCCN2Cc2ccccc21 ZINC000484060343 899694344 /nfs/dbraw/zinc/69/43/44/899694344.db2.gz VRXZMYAIEFVUQL-GOSISDBHSA-N 0 3 407.514 4.498 20 0 HIADHN O=C(CC1CCCCC1)NC1CCC(C(=O)N2CCN(C3CCCCC3)CC2)CC1 ZINC000484107057 899732968 /nfs/dbraw/zinc/73/29/68/899732968.db2.gz GEFMESZGFMKZHN-UHFFFAOYSA-N 0 3 417.638 4.109 20 0 HIADHN CCN(C(=O)c1cnn(-c2ccccc2C)c1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000484165504 899785224 /nfs/dbraw/zinc/78/52/24/899785224.db2.gz TXLRBGAKGURMSM-REWPJTCUSA-N 0 3 402.542 4.478 20 0 HIADHN Cc1noc([C@H]2CCCCN2C(=O)NC[C@H](c2ccccc2)N2CCC(C)CC2)n1 ZINC000484165369 899785346 /nfs/dbraw/zinc/78/53/46/899785346.db2.gz SMPMVTZTWHGFCW-NHCUHLMSSA-N 0 3 411.550 4.088 20 0 HIADHN CCc1ccc([C@H](CNC(=O)Nc2ccc(C(=O)N[C@@H](C)CC)cc2)N(C)C)cc1 ZINC000505689809 914380413 /nfs/dbraw/zinc/38/04/13/914380413.db2.gz JPGLSPSNYCDWLM-JTSKRJEESA-N 0 3 410.562 4.202 20 0 HIADHN CCOc1cccc2cc([C@H](C)NC(=O)C(=O)Nc3cc(CN(C)C)ccc3C)oc21 ZINC000484200227 899810555 /nfs/dbraw/zinc/81/05/55/899810555.db2.gz LAGGVQLYKUSVEO-INIZCTEOSA-N 0 3 423.513 4.017 20 0 HIADHN CSc1cccc(N(C(=O)c2cc(C(C)(C)C)nn2C)C2CCN(C)CC2)c1 ZINC000484292824 899856504 /nfs/dbraw/zinc/85/65/04/899856504.db2.gz HARHGFICXBSOES-UHFFFAOYSA-N 0 3 400.592 4.181 20 0 HIADHN O=C1Nc2ccccc2C12CCC(NCc1nccn1CCCc1ccccc1)CC2 ZINC000484298712 899861515 /nfs/dbraw/zinc/86/15/15/899861515.db2.gz MZRIWNXKGMVUIA-UHFFFAOYSA-N 0 3 414.553 4.438 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2ccc(C(C)=O)c(Cl)c2)c1 ZINC000484341710 899891938 /nfs/dbraw/zinc/89/19/38/899891938.db2.gz QUWRBLSDAGYDST-UHFFFAOYSA-N 0 3 403.910 4.147 20 0 HIADHN CC(=O)Nc1ccc(S(=O)(=O)CCCN[C@H](C)c2oc3ccccc3c2C)cc1 ZINC000484357975 899905662 /nfs/dbraw/zinc/90/56/62/899905662.db2.gz YMAVXIHGPNCJLA-MRXNPFEDSA-N 0 3 414.527 4.214 20 0 HIADHN CSc1cccc(N(C(=O)c2nnn(-c3ccccc3)c2C)C2CCN(C)CC2)c1 ZINC000484375224 899916526 /nfs/dbraw/zinc/91/65/26/899916526.db2.gz SMYZNBBMLXZLLJ-UHFFFAOYSA-N 0 3 421.570 4.039 20 0 HIADHN Cc1cc(NC(=O)C(=O)Nc2ccccc2C(C)C)cc(N2CCN(C(C)C)CC2)c1 ZINC000484479589 899972066 /nfs/dbraw/zinc/97/20/66/899972066.db2.gz IGDQOBUUSORUMF-UHFFFAOYSA-N 0 3 422.573 4.226 20 0 HIADHN COC[C@H](N[C@@H]1CCN(c2cc(OC)cc(OC)c2)C1)c1cccc(C(F)(F)F)c1 ZINC000484485107 899977279 /nfs/dbraw/zinc/97/72/79/899977279.db2.gz IVVJTZHEHPSOTR-UTKZUKDTSA-N 0 3 424.463 4.279 20 0 HIADHN COc1ccc([C@H](C)NCCC(=O)Nc2cc(C)c(Cl)cc2OC)c(OC)c1 ZINC000484491051 899983206 /nfs/dbraw/zinc/98/32/06/899983206.db2.gz ILJXSFBNEJSVQP-AWEZNQCLSA-N 0 3 406.910 4.354 20 0 HIADHN COc1cccc2c1CC[C@H]2N[C@@H](C)c1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000484495816 899987158 /nfs/dbraw/zinc/98/71/58/899987158.db2.gz GOUBUIGCPNGFDH-HTAPYJJXSA-N 0 3 414.571 4.208 20 0 HIADHN Cc1c([C@@H](C)N[C@@H](C)Cc2ccncc2)nnn1-c1cccc(Br)c1 ZINC000484505511 899996765 /nfs/dbraw/zinc/99/67/65/899996765.db2.gz SURSFCNWLTYCTH-UONOGXRCSA-N 0 3 400.324 4.015 20 0 HIADHN O=C(C1CCCCC1)N1CC[C@H](N[C@@H]2CCCOc3c(Br)cccc32)C1 ZINC000484507103 899998017 /nfs/dbraw/zinc/99/80/17/899998017.db2.gz YMTPURFIURYRCY-QFBILLFUSA-N 0 3 421.379 4.434 20 0 HIADHN CC(C)([C@H](NC[C@H](O)COc1ccccc1F)c1ccc(F)c(F)c1)N1CCCC1 ZINC000484527216 900014393 /nfs/dbraw/zinc/01/43/93/900014393.db2.gz ATXPHKJHITXFCK-HTAPYJJXSA-N 0 3 422.491 4.049 20 0 HIADHN CCS(=O)(=O)Nc1ccc([C@@H](C)NCc2ccc(C)cc2OCC2CC2)cc1 ZINC000484608844 900067250 /nfs/dbraw/zinc/06/72/50/900067250.db2.gz ULCRDCOPPUIMAD-QGZVFWFLSA-N 0 3 402.560 4.396 20 0 HIADHN C[C@@H](NCCCO[C@H]1CCOC1)c1ccc(Br)cc1Br ZINC000484615431 900072121 /nfs/dbraw/zinc/07/21/21/900072121.db2.gz HUEZIQFPTHMHMU-YPMHNXCESA-N 0 3 407.146 4.058 20 0 HIADHN CCc1c(NC(=O)N(CCN(C)C)Cc2cccc(OC)c2)cnn1-c1ccccc1 ZINC000484660543 900104809 /nfs/dbraw/zinc/10/48/09/900104809.db2.gz XIFUSTZVNRXNJL-UHFFFAOYSA-N 0 3 421.545 4.039 20 0 HIADHN CCc1nnc(C2CCN([C@H](C)C(=O)Nc3ccccc3Cc3ccccc3)CC2)[nH]1 ZINC000484695766 900132169 /nfs/dbraw/zinc/13/21/69/900132169.db2.gz CWMYXNZTNHKBIH-GOSISDBHSA-N 0 3 417.557 4.165 20 0 HIADHN CCc1nc(C2CCN([C@H](C)C(=O)Nc3ccccc3-c3ccccc3)CC2)n[nH]1 ZINC000484700765 900135152 /nfs/dbraw/zinc/13/51/52/900135152.db2.gz RVMIKGRAWCYXPZ-QGZVFWFLSA-N 0 3 403.530 4.241 20 0 HIADHN CCc1n[nH]c(C2CCN([C@H](C)C(=O)Nc3ccccc3-c3ccccc3)CC2)n1 ZINC000484700765 900135162 /nfs/dbraw/zinc/13/51/62/900135162.db2.gz RVMIKGRAWCYXPZ-QGZVFWFLSA-N 0 3 403.530 4.241 20 0 HIADHN CCc1nnc(C2CCN([C@H](C)C(=O)Nc3ccccc3-c3ccccc3)CC2)[nH]1 ZINC000484700765 900135168 /nfs/dbraw/zinc/13/51/68/900135168.db2.gz RVMIKGRAWCYXPZ-QGZVFWFLSA-N 0 3 403.530 4.241 20 0 HIADHN CCc1nc(C2CCN(CCOc3ccc(Cl)cc3Br)CC2)n[nH]1 ZINC000484714271 900147549 /nfs/dbraw/zinc/14/75/49/900147549.db2.gz GTWFQVKPPONAOK-UHFFFAOYSA-N 0 3 413.747 4.041 20 0 HIADHN CCc1n[nH]c(C2CCN(CCOc3ccc(Cl)cc3Br)CC2)n1 ZINC000484714271 900147557 /nfs/dbraw/zinc/14/75/57/900147557.db2.gz GTWFQVKPPONAOK-UHFFFAOYSA-N 0 3 413.747 4.041 20 0 HIADHN CCc1nnc(C2CCN(CCOc3ccc(Cl)cc3Br)CC2)[nH]1 ZINC000484714271 900147564 /nfs/dbraw/zinc/14/75/64/900147564.db2.gz GTWFQVKPPONAOK-UHFFFAOYSA-N 0 3 413.747 4.041 20 0 HIADHN CCc1nc(C2CCN([C@@H](C)C(=O)N[C@@H](C)c3ccc(Cl)cc3Cl)CC2)n[nH]1 ZINC000484740633 900163666 /nfs/dbraw/zinc/16/36/66/900163666.db2.gz NUYKFAZIIJQUMP-STQMWFEESA-N 0 3 424.376 4.119 20 0 HIADHN CCc1n[nH]c(C2CCN([C@@H](C)C(=O)N[C@@H](C)c3ccc(Cl)cc3Cl)CC2)n1 ZINC000484740633 900163669 /nfs/dbraw/zinc/16/36/69/900163669.db2.gz NUYKFAZIIJQUMP-STQMWFEESA-N 0 3 424.376 4.119 20 0 HIADHN CCc1nnc(C2CCN([C@@H](C)C(=O)N[C@@H](C)c3ccc(Cl)cc3Cl)CC2)[nH]1 ZINC000484740633 900163673 /nfs/dbraw/zinc/16/36/73/900163673.db2.gz NUYKFAZIIJQUMP-STQMWFEESA-N 0 3 424.376 4.119 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)NCC1(c2ccccc2C)CCOCC1)c1ccco1 ZINC000484948936 900317141 /nfs/dbraw/zinc/31/71/41/900317141.db2.gz UQDSRPSFCPMZEG-FPOVZHCZSA-N 0 3 413.562 4.065 20 0 HIADHN CCOc1cc(CN2CCC[C@H]2CCc2ccccc2)nc2nc(C(F)(F)F)nn21 ZINC000485036456 900374857 /nfs/dbraw/zinc/37/48/57/900374857.db2.gz SWZDJQWWYBIVIE-KRWDZBQOSA-N 0 3 419.451 4.139 20 0 HIADHN Cc1noc(C2CCN(CCC(=O)Nc3ccc(OCc4ccccc4)cc3)CC2)n1 ZINC000485069476 900391897 /nfs/dbraw/zinc/39/18/97/900391897.db2.gz LAUQRKHBZIPJDX-UHFFFAOYSA-N 0 3 420.513 4.165 20 0 HIADHN Cc1cccc(C)c1NC(=O)CCCN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1 ZINC000485073180 900393260 /nfs/dbraw/zinc/39/32/60/900393260.db2.gz GZVGLQSVKKOMEN-HXUWFJFHSA-N 0 3 412.509 4.057 20 0 HIADHN CCOc1cc(CN2CCC[C@H](c3ccccc3)CC2)nc2nc(C(F)(F)F)nn21 ZINC000485085000 900399748 /nfs/dbraw/zinc/39/97/48/900399748.db2.gz JQTXGHLPJKYMDE-INIZCTEOSA-N 0 3 419.451 4.312 20 0 HIADHN CC[C@H](C)NC(=O)[C@@H]1C[C@H](C)N(Cc2csc(N(C)C3CC3)n2)[C@H]2CCCC[C@H]12 ZINC000485091335 900402750 /nfs/dbraw/zinc/40/27/50/900402750.db2.gz FYPMJIJERHKCFS-KHDMTIDOSA-N 0 3 418.651 4.426 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)Nc1ccc(-c2ccccn2)cc1 ZINC000485162773 900461577 /nfs/dbraw/zinc/46/15/77/900461577.db2.gz VIBHHGYOFSXRDD-UHFFFAOYSA-N 0 3 400.526 4.290 20 0 HIADHN CC(C)c1c(NC(=O)N2CC[C@H]3CCN(C)C[C@H]32)cnn1-c1ccc(Cl)cc1 ZINC000485199454 900490978 /nfs/dbraw/zinc/49/09/78/900490978.db2.gz ZDROOJLFJFZMTN-DNVCBOLYSA-N 0 3 401.942 4.207 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N1CCC(c2cccc(Cl)c2)CC1 ZINC000485233080 900518665 /nfs/dbraw/zinc/51/86/65/900518665.db2.gz GQOKQYLWBYWFOK-UHFFFAOYSA-N 0 3 413.949 4.055 20 0 HIADHN CCc1c(NC(=O)N2CC[C@@H]3CCN(C)C[C@@H]32)cnn1-c1cccc(C(F)(F)F)c1 ZINC000485319141 900599264 /nfs/dbraw/zinc/59/92/64/900599264.db2.gz GRCONVSMBNAGDY-LIRRHRJNSA-N 0 3 421.467 4.011 20 0 HIADHN CCc1c(NC(=O)N[C@H]2CCCN(C)[C@H]2C)cnn1-c1cccc(C(F)(F)F)c1 ZINC000485323429 900605202 /nfs/dbraw/zinc/60/52/02/900605202.db2.gz PCCVTJVAATXUQO-BBRMVZONSA-N 0 3 409.456 4.058 20 0 HIADHN CCc1c(NC(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)cnn1-c1ccccc1C ZINC000485349184 900641648 /nfs/dbraw/zinc/64/16/48/900641648.db2.gz OOVSOAGTPCQUHE-AUSIDOKSSA-N 0 3 403.530 4.310 20 0 HIADHN COC(=O)c1cc(NC(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)cc(Cl)c1F ZINC000485412632 900710604 /nfs/dbraw/zinc/71/06/04/900710604.db2.gz SWXGAVYQADWJBZ-MRXNPFEDSA-N 0 3 419.884 4.004 20 0 HIADHN O=S(=O)(Cc1ccccc1C(F)(F)F)N1C[C@H]2CCCN2Cc2ccccc21 ZINC000485448329 900743374 /nfs/dbraw/zinc/74/33/74/900743374.db2.gz XTMRBQHLFWAYDO-QGZVFWFLSA-N 0 3 410.461 4.020 20 0 HIADHN Cc1ccc2c(CC(=O)Nc3ccc(C(=O)NCCN4CCCC4)cc3)coc2c1C ZINC000485473511 900766992 /nfs/dbraw/zinc/76/69/92/900766992.db2.gz IRUBBFKWVLDFQE-UHFFFAOYSA-N 0 3 419.525 4.056 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)Cc2ccc(F)cc2Br)CC1 ZINC000485489490 900780485 /nfs/dbraw/zinc/78/04/85/900780485.db2.gz KVOMNCRWQPPYRZ-UHFFFAOYSA-N 0 3 419.338 4.254 20 0 HIADHN O=C(N[C@@H](c1ccccc1)c1cccnc1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000485604066 900863472 /nfs/dbraw/zinc/86/34/72/900863472.db2.gz UZNDENJUTZPOEA-UPVQGACJSA-N 0 3 403.501 4.339 20 0 HIADHN CCOc1cc(CN2CC[C@H](c3ccccc3)[C@@H](C)C2)nc2nc(C(F)(F)F)nn21 ZINC000485691513 900942720 /nfs/dbraw/zinc/94/27/20/900942720.db2.gz XZGWJMHKSAXICT-YOEHRIQHSA-N 0 3 419.451 4.167 20 0 HIADHN COc1ccc(CN(C)[C@H](C)c2ccc(N3CCCS3(=O)=O)cc2)cc1Cl ZINC000485705884 900955156 /nfs/dbraw/zinc/95/51/56/900955156.db2.gz QQNKTNUACZKDME-OAHLLOKOSA-N 0 3 408.951 4.082 20 0 HIADHN CN(C(=O)c1cccnc1OCc1ccccc1F)[C@H]1CCN(Cc2ccccc2)C1 ZINC000485716575 900966037 /nfs/dbraw/zinc/96/60/37/900966037.db2.gz FPEPLFWYFKVVRM-NRFANRHFSA-N 0 3 419.500 4.146 20 0 HIADHN CCN(CC)[C@H](CNc1ncc(Cn2cc(Br)cn2)s1)c1ccco1 ZINC000485845440 901089482 /nfs/dbraw/zinc/08/94/82/901089482.db2.gz QWGQBFCBRMJUIM-OAHLLOKOSA-N 0 3 424.368 4.238 20 0 HIADHN COC(=O)c1ccc2c(c1)nc(CN1C[C@H](c3ccccc3)[C@H]3CCCC[C@H]31)[nH]c2=O ZINC000485880168 901116197 /nfs/dbraw/zinc/11/61/97/901116197.db2.gz IRHKPUJVNKTOGN-SYYKKAFVSA-N 0 3 417.509 4.280 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)NC[C@H](c2ccccc2)C(F)(F)F)C1 ZINC000486141345 901328998 /nfs/dbraw/zinc/32/89/98/901328998.db2.gz CBGBTBWQWUGAEN-LSTHTHJFSA-N 0 3 405.464 4.467 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)c1cc2ccc(Br)cc2[nH]1 ZINC000486176521 901363078 /nfs/dbraw/zinc/36/30/78/901363078.db2.gz VMLSMBYEXLBPJT-FQEVSTJZSA-N 0 3 412.331 4.497 20 0 HIADHN CCc1cc(NC(=O)N(C)C[C@@H]2CCCN(CC)[C@H]2c2cnn(C)c2)ccc1F ZINC000486362421 901531407 /nfs/dbraw/zinc/53/14/07/901531407.db2.gz VZQASZUMYBBWAX-LAUBAEHRSA-N 0 3 401.530 4.059 20 0 HIADHN Fc1ccc(/C=C/CN2C[C@H]3CCC[C@@]3(c3nc(-c4cccnc4)no3)C2)c(F)c1 ZINC000486461726 901621691 /nfs/dbraw/zinc/62/16/91/901621691.db2.gz PNMYAGPDYWBJBU-ITZOUANZSA-N 0 3 408.452 4.477 20 0 HIADHN Cn1cc(CN2C[C@H]3CCC[C@@]3(c3nc(CC4CC4)no3)C2)c(C2CCCCC2)n1 ZINC000486462557 901622215 /nfs/dbraw/zinc/62/22/15/901622215.db2.gz DPIZLQGYOBSVMF-HYBUGGRVSA-N 0 3 409.578 4.357 20 0 HIADHN Cc1ccccc1C1(C(=O)NCc2ccccc2CN2CCC(O)CC2)CCCC1 ZINC000486543169 901692449 /nfs/dbraw/zinc/69/24/49/901692449.db2.gz GJWXCLQXQANVOG-UHFFFAOYSA-N 0 3 406.570 4.080 20 0 HIADHN O=C([C@H]1CCCCCC(=O)C1)N(C[C@@H]1CCN(Cc2ccccc2)C1)CC(F)(F)F ZINC000486549229 901696395 /nfs/dbraw/zinc/69/63/95/901696395.db2.gz SIBZHNAOILIGKM-UXHICEINSA-N 0 3 424.507 4.439 20 0 HIADHN CC(C)[C@@H](CNC(=O)c1c(F)cccc1Br)N1CCc2ccccc2C1 ZINC000486754391 901830474 /nfs/dbraw/zinc/83/04/74/901830474.db2.gz ZRLWUZLNBDEFER-LJQANCHMSA-N 0 3 419.338 4.401 20 0 HIADHN CC[C@@H](Cc1ccccc1)N(CC)CC(=O)Nc1cc(C)ccc1-c1n[nH]c(C)n1 ZINC000486792372 901857790 /nfs/dbraw/zinc/85/77/90/901857790.db2.gz DWUTYRHRHLLLEH-FQEVSTJZSA-N 0 3 405.546 4.370 20 0 HIADHN C[C@H](C(=O)N1[C@H](C)CCC[C@@H]1C)N1C[C@H]2CCC[C@@]2(c2nc(-c3ccccc3)no2)C1 ZINC000486829520 901881353 /nfs/dbraw/zinc/88/13/53/901881353.db2.gz XURAUWGKLOYZEP-CQVUMHHCSA-N 0 3 422.573 4.268 20 0 HIADHN CCN1CC[C@@H](NC(=O)c2ccccc2CN(C)C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000486829808 901881821 /nfs/dbraw/zinc/88/18/21/901881821.db2.gz YDLWPDWQOHIGSH-NHCUHLMSSA-N 0 3 403.929 4.106 20 0 HIADHN C[C@H](NC(=O)N(CCN(C)C)Cc1ccc(F)cc1F)c1ccc2ncsc2c1 ZINC000486888533 901934199 /nfs/dbraw/zinc/93/41/99/901934199.db2.gz SFZUOTLUMWIQCZ-AWEZNQCLSA-N 0 3 418.513 4.409 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)Nc3cc(C(C)(C)C)nn3-c3cccc(Cl)c3)[C@@H]2C1 ZINC000486895653 901938977 /nfs/dbraw/zinc/93/89/77/901938977.db2.gz OLNBKMLNXWEUOT-CRAIPNDOSA-N 0 3 415.969 4.381 20 0 HIADHN C[C@H](CCc1ccc(Br)cc1)NCc1c(Br)cnn1C ZINC000486937935 901976908 /nfs/dbraw/zinc/97/69/08/901976908.db2.gz MHDWGEQPAYKHMY-LLVKDONJSA-N 0 3 401.146 4.056 20 0 HIADHN CCC1CCC(N(CCO)C(=O)Nc2ccc(CCN3CCSCC3)cc2)CC1 ZINC000486972763 901999213 /nfs/dbraw/zinc/99/92/13/901999213.db2.gz WEPVRXRQCHWEGT-UHFFFAOYSA-N 0 3 419.635 4.073 20 0 HIADHN COc1ccccc1NCC(=O)N[C@@H](c1ccc(F)c(F)c1)C(C)(C)N1CCCC1 ZINC000487109548 902061208 /nfs/dbraw/zinc/06/12/08/902061208.db2.gz HFLOLEMNNPSGAX-QFIPXVFZSA-N 0 3 417.500 4.117 20 0 HIADHN C[C@@H]1CN(C(=O)N[C@H](CC2CCCCC2)C(C)(C)C)CC[C@@H]1N1CCN(C)CC1 ZINC000487295354 902138826 /nfs/dbraw/zinc/13/88/26/902138826.db2.gz WFGJAEJTARLYGD-BAGYTPMASA-N 0 3 406.659 4.039 20 0 HIADHN COc1ccc([C@@H](NC(=O)CN(C)C(C)C)c2ccccc2)cc1Br ZINC000487468011 902220321 /nfs/dbraw/zinc/22/03/21/902220321.db2.gz DYXPLVXJSQBNBO-FQEVSTJZSA-N 0 3 405.336 4.004 20 0 HIADHN CN(C)Cc1ccc(C(=O)Nc2nc(-c3ccc(-n4cccn4)cc3)cs2)cc1 ZINC000487513284 902229643 /nfs/dbraw/zinc/22/96/43/902229643.db2.gz JFLJPAKXDCHQRW-UHFFFAOYSA-N 0 3 403.511 4.310 20 0 HIADHN CCn1cc(NC(=O)N(CCN(C)Cc2ccccc2)Cc2ccccc2)ccc1=O ZINC000487522994 902233048 /nfs/dbraw/zinc/23/30/48/902233048.db2.gz GJYPHWHGDGENIT-UHFFFAOYSA-N 0 3 418.541 4.034 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)Cc2csc(-c3cccc(F)c3)n2)c1 ZINC000487566742 902243431 /nfs/dbraw/zinc/24/34/31/902243431.db2.gz TTXSAWYXUCQFJT-UHFFFAOYSA-N 0 3 411.546 4.391 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCCC1)c1c(F)cccc1Br ZINC000487662883 902281657 /nfs/dbraw/zinc/28/16/57/902281657.db2.gz DFWZZYPZZAWGEO-UHFFFAOYSA-N 0 3 415.372 4.070 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)c2cc(Cl)ccc2OC2CCCC2)CC1 ZINC000487789453 902366337 /nfs/dbraw/zinc/36/63/37/902366337.db2.gz VDBBCVOFGUCOJG-UHFFFAOYSA-N 0 3 408.970 4.281 20 0 HIADHN COc1ccc(CCNC(=O)[C@@H](C)N[C@H](C)c2ccc(F)c3ccccc32)cc1OC ZINC000487870994 902416806 /nfs/dbraw/zinc/41/68/06/902416806.db2.gz BMDYHKPJXHQTQG-IAGOWNOFSA-N 0 3 424.516 4.394 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3sc(-c4ccccn4)nc3C)c(C)c2)CC1 ZINC000505964867 914626022 /nfs/dbraw/zinc/62/60/22/914626022.db2.gz FUVPKGKNSHFZNS-UHFFFAOYSA-N 0 3 421.570 4.216 20 0 HIADHN CCN(C(=O)c1cc2c(cc1F)NC(=O)CC2)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000488099040 902602502 /nfs/dbraw/zinc/60/25/02/902602502.db2.gz PURHCISXNZXXDQ-QFBILLFUSA-N 0 3 409.505 4.008 20 0 HIADHN Cc1ccc(NC(=O)[C@@H]2CSCN2C(=O)c2cccc(CN3CCCC3)c2)c(C)c1 ZINC000488106280 902608136 /nfs/dbraw/zinc/60/81/36/902608136.db2.gz SFNRIZSOUTZDBA-QFIPXVFZSA-N 0 3 423.582 4.053 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)CCC(=O)c1ccc2c(c1)CCC2 ZINC000488480537 902847629 /nfs/dbraw/zinc/84/76/29/902847629.db2.gz CVSHWMXFTKDQFM-CYFREDJKSA-N 0 3 404.554 4.165 20 0 HIADHN C[C@@H](c1ccc(Br)cc1)N1CCN(CCCOCC(F)(F)F)CC1 ZINC000488488547 902851648 /nfs/dbraw/zinc/85/16/48/902851648.db2.gz IDQFGEXVTPUVSG-AWEZNQCLSA-N 0 3 409.290 4.097 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)NCCc2ccc3ccccc3n2)N(C)C)cc1 ZINC000488491787 902852893 /nfs/dbraw/zinc/85/28/93/902852893.db2.gz RQJPLAHPCYSQLG-XMMPIXPASA-N 0 3 420.557 4.167 20 0 HIADHN C[C@@H](CNCc1csc(-c2ccc3c(c2)OCO3)n1)N1CCc2ccccc2C1 ZINC000488615665 902899898 /nfs/dbraw/zinc/89/98/98/902899898.db2.gz FJMZKFVMPQZNGR-INIZCTEOSA-N 0 3 407.539 4.075 20 0 HIADHN C[C@H](Oc1ccccc1C(F)(F)F)C(=O)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000488676929 902939506 /nfs/dbraw/zinc/93/95/06/902939506.db2.gz KYXWLOVBQQNNNS-HNNXBMFYSA-N 0 3 422.447 4.068 20 0 HIADHN C[C@@H](NC(=O)Nc1ccc(F)cc1OC1CCOCC1)[C@H](c1ccccc1)N(C)C ZINC000488701731 902952176 /nfs/dbraw/zinc/95/21/76/902952176.db2.gz YPDMIWQDAATWGX-OPAMFIHVSA-N 0 3 415.509 4.196 20 0 HIADHN C[C@@H]1CN(C2CCOCC2)CCN1[C@H](c1nc(-c2ccccc2)no1)c1ccccc1 ZINC000488705379 902954710 /nfs/dbraw/zinc/95/47/10/902954710.db2.gz PFAITKMRTZKQMF-XXBNENTESA-N 0 3 418.541 4.011 20 0 HIADHN COCCN(C(=O)c1ccc(N2CCN(C(C)C)CC2)cc1)[C@H](C)c1ccccc1 ZINC000488823157 903025476 /nfs/dbraw/zinc/02/54/76/903025476.db2.gz DJZRRDCRPFKKCP-OAQYLSRUSA-N 0 3 409.574 4.067 20 0 HIADHN CC[C@@H](c1nnc(SCC(=O)NC[C@@H](c2ccccc2)N(C)C)o1)c1ccccc1 ZINC000488847440 903041357 /nfs/dbraw/zinc/04/13/57/903041357.db2.gz BPIJQOAOEMXKOW-UXHICEINSA-N 0 3 424.570 4.123 20 0 HIADHN O=S(=O)(c1ccc(F)cc1C(F)(F)F)N1CCCN(CC2CCCCC2)CC1 ZINC000488920211 903076879 /nfs/dbraw/zinc/07/68/79/903076879.db2.gz QFZZUOOHHYWJBL-UHFFFAOYSA-N 0 3 422.488 4.121 20 0 HIADHN COc1ccc([C@H](C)NC(=O)[C@H]2CN(Cc3ccccc3)CCC2(F)F)cc1F ZINC000506011092 914684853 /nfs/dbraw/zinc/68/48/53/914684853.db2.gz XHVRCOPAAWMNST-MAUKXSAKSA-N 0 3 406.448 4.169 20 0 HIADHN COc1ccccc1[C@H](C)NC(=O)[C@@H](C)N[C@H](COc1ccccc1F)C(C)(C)C ZINC000489029397 903134438 /nfs/dbraw/zinc/13/44/38/903134438.db2.gz ZICOFUKLCJFRCH-GSHUGGBRSA-N 0 3 416.537 4.483 20 0 HIADHN Cc1cccc2c1[C@H](C)C[C@H]2CC(=O)Nc1cccc(CN2CCC(C(N)=O)CC2)c1 ZINC000489069066 903171857 /nfs/dbraw/zinc/17/18/57/903171857.db2.gz GYVPGZCIBQHATC-NQIIRXRSSA-N 0 3 419.569 4.312 20 0 HIADHN COC(=O)c1c(CN2CC[C@@](O)(C3CC3)C2)nc2ccccc2c1-c1ccccc1 ZINC000489162622 903238203 /nfs/dbraw/zinc/23/82/03/903238203.db2.gz SIVSFUZJKJYHSA-VWLOTQADSA-N 0 3 402.494 4.035 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N2CCC(F)(c3cccnc3)CC2)N2CCCC2)cc1 ZINC000489197115 903257170 /nfs/dbraw/zinc/25/71/70/903257170.db2.gz MDLWUKPJCWZNJB-QFIPXVFZSA-N 0 3 410.537 4.197 20 0 HIADHN CC(C)C[C@@H](NC(=O)NCc1ccccc1CN1CCC(O)CC1)c1cccs1 ZINC000489292414 903313476 /nfs/dbraw/zinc/31/34/76/903313476.db2.gz DHIFJFKYUWDJHQ-OAQYLSRUSA-N 0 3 415.603 4.291 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)NCc2cccc(OC(F)F)c2)CC1 ZINC000489398453 903365731 /nfs/dbraw/zinc/36/57/31/903365731.db2.gz SLHCTWPJZNUHJL-UHFFFAOYSA-N 0 3 403.473 4.094 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)NC[C@H](Cc2ccccc2)c2ccccc2)CC1 ZINC000489452129 903390797 /nfs/dbraw/zinc/39/07/97/903390797.db2.gz SUWOIGFRXKHFAP-DEOSSOPVSA-N 0 3 423.601 4.202 20 0 HIADHN C[C@H](N[C@H](Cc1ccccc1)[C@@H](O)C(F)F)c1ccc(Br)c(F)c1 ZINC000489543419 903454426 /nfs/dbraw/zinc/45/44/26/903454426.db2.gz GUQAQHRVLNYKPV-YMRXKLBXSA-N 0 3 402.254 4.476 20 0 HIADHN C[C@H](CCC1CCCCC1)NC(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000489554072 903460699 /nfs/dbraw/zinc/46/06/99/903460699.db2.gz FHQLJFLVFQYYKY-LJQANCHMSA-N 0 3 401.595 4.192 20 0 HIADHN C[C@@H](NCc1ccc(CN2CCOCC2)cc1)c1ccc(Br)c(F)c1 ZINC000489565055 903468061 /nfs/dbraw/zinc/46/80/61/903468061.db2.gz TUCAPGRZJXGTLZ-OAHLLOKOSA-N 0 3 407.327 4.271 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)c2scc(C)c2Br)c1 ZINC000489578838 903476215 /nfs/dbraw/zinc/47/62/15/903476215.db2.gz FKHHLOHWCQUYBE-UHFFFAOYSA-N 0 3 411.365 4.032 20 0 HIADHN COc1cc(C)cc(NC(=O)NCCCCN2CCN(Cc3ccccc3)CC2)c1C ZINC000489755884 903582798 /nfs/dbraw/zinc/58/27/98/903582798.db2.gz VSYFNZOLINTLKN-UHFFFAOYSA-N 0 3 424.589 4.032 20 0 HIADHN Cc1ccc(COc2ccc(CN(C)[C@H](C)c3ccc(S(N)(=O)=O)cc3)cc2)cc1 ZINC000506040229 914731281 /nfs/dbraw/zinc/73/12/81/914731281.db2.gz KTKISENWMGZGEI-LJQANCHMSA-N 0 3 424.566 4.414 20 0 HIADHN Cc1cc([C@H]2CN(C(=O)NC[C@H](c3cccs3)N3CCCC3)CCO2)ccc1F ZINC000489782609 903595811 /nfs/dbraw/zinc/59/58/11/903595811.db2.gz WSHNBQQITSHSPF-WOJBJXKFSA-N 0 3 417.550 4.116 20 0 HIADHN C[C@@H](NC(=O)N(CCN(C)Cc1ccccc1)Cc1ccccc1)c1cccnc1 ZINC000489870250 903642198 /nfs/dbraw/zinc/64/21/98/903642198.db2.gz DQGWFUWRFOJYMH-OAQYLSRUSA-N 0 3 402.542 4.486 20 0 HIADHN Cc1csc(C(=O)Nc2cccc(CN3CCC(CO)CC3)c2)c1Br ZINC000489951433 903694812 /nfs/dbraw/zinc/69/48/12/903694812.db2.gz DTNLNLBGPCQWMR-UHFFFAOYSA-N 0 3 423.376 4.276 20 0 HIADHN Cc1sc(CC(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)nc1C(C)C ZINC000489954506 903696662 /nfs/dbraw/zinc/69/66/62/903696662.db2.gz PJZFQXJCONFIOL-IBGZPJMESA-N 0 3 403.592 4.324 20 0 HIADHN CNS(=O)(=O)c1ccc([C@@H](C)N[C@H](C)c2ccc(Oc3cccnc3)cc2)cc1 ZINC000489955280 903696758 /nfs/dbraw/zinc/69/67/58/903696758.db2.gz JDSFWEOSJPPYEA-IAGOWNOFSA-N 0 3 411.527 4.194 20 0 HIADHN Cn1cc([C@@H](NC2CCN(Cc3ccc(F)c(F)c3)CC2)c2cccc(F)c2)cn1 ZINC000490123823 903780292 /nfs/dbraw/zinc/78/02/92/903780292.db2.gz FSVLGUCEYQGOJG-QHCPKHFHSA-N 0 3 414.475 4.181 20 0 HIADHN Cc1ccc(C)c([C@@H](NCc2ccc([C@]3(C)NC(=O)NC3=O)cc2)c2ccccc2)c1 ZINC000490137476 903785821 /nfs/dbraw/zinc/78/58/21/903785821.db2.gz RGMSDWKFQOWEGY-OZXSUGGESA-N 0 3 413.521 4.237 20 0 HIADHN CCc1ccc([C@@H](NC[C@H](CC(C)C)N(C)C)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000490138817 903786226 /nfs/dbraw/zinc/78/62/26/903786226.db2.gz XNCNFAUJXZEXIX-LADGPHEKSA-N 0 3 416.631 4.308 20 0 HIADHN CCc1ccc([C@H](NC[C@@H](CC(C)C)N(C)C)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000490138819 903786316 /nfs/dbraw/zinc/78/63/16/903786316.db2.gz XNCNFAUJXZEXIX-VWNXMTODSA-N 0 3 416.631 4.308 20 0 HIADHN CC(F)(F)c1ccc(CNC(=O)CCCN2CCN(c3ccccc3)CC2)cc1 ZINC000490145089 903791011 /nfs/dbraw/zinc/79/10/11/903791011.db2.gz RNBFUASORVGPFN-UHFFFAOYSA-N 0 3 401.501 4.017 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2ccc(C)c(C(=O)N3CCCCC3)c2)N(C)C)cc1 ZINC000490146484 903793462 /nfs/dbraw/zinc/79/34/62/903793462.db2.gz QANIDMQONCLBFJ-QHCPKHFHSA-N 0 3 422.573 4.354 20 0 HIADHN CCN(C)[C@@H](C(=O)Nc1ccc(NC(=O)CN2CCCCCC2)cc1)c1ccccc1 ZINC000490160889 903802903 /nfs/dbraw/zinc/80/29/03/903802903.db2.gz HOCHANRGZNSLJA-XMMPIXPASA-N 0 3 422.573 4.133 20 0 HIADHN CCCS(=O)(=O)N1CCC(N[C@@H](c2ccc(F)cc2)c2ccccc2Cl)CC1 ZINC000490167992 903806324 /nfs/dbraw/zinc/80/63/24/903806324.db2.gz PZHMMPSOSFFDFY-NRFANRHFSA-N 0 3 424.969 4.362 20 0 HIADHN CCN1CCN([C@@H](C)CN[C@@H](c2ccccc2Cl)c2cc(F)ccc2F)CC1 ZINC000490168442 903806671 /nfs/dbraw/zinc/80/66/71/903806671.db2.gz VRIPSZYJSKZSFJ-AOMKIAJQSA-N 0 3 407.936 4.323 20 0 HIADHN CC[C@H](CN[C@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1)N1CCCC1 ZINC000490173518 903810293 /nfs/dbraw/zinc/81/02/93/903810293.db2.gz WAMNKSGSUHKOEZ-IFMALSPDSA-N 0 3 421.006 4.297 20 0 HIADHN CC[C@@H](CN[C@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1)N1CCCC1 ZINC000490173520 903810311 /nfs/dbraw/zinc/81/03/11/903810311.db2.gz WAMNKSGSUHKOEZ-RBBKRZOGSA-N 0 3 421.006 4.297 20 0 HIADHN CCc1ccc([C@@H](NCCN2CCC[C@@H](C)C2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000490173489 903810508 /nfs/dbraw/zinc/81/05/08/903810508.db2.gz VUBAJTQQGRCTGV-NTKDMRAZSA-N 0 3 414.615 4.063 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3cc(-c4ccoc4C)on3)c(C)c2)CC1 ZINC000490206257 903827449 /nfs/dbraw/zinc/82/74/49/903827449.db2.gz VOCHXCHFQLMRHL-UHFFFAOYSA-N 0 3 409.490 4.337 20 0 HIADHN Cc1ccc(NC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1C(=O)N1CCCCC1 ZINC000490231333 903840149 /nfs/dbraw/zinc/84/01/49/903840149.db2.gz QJSAJYXXOLATPG-JOCHJYFZSA-N 0 3 420.557 4.017 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N[C@@H](c2ccccc2)c2ccncc2)C1 ZINC000490234127 903842784 /nfs/dbraw/zinc/84/27/84/903842784.db2.gz AAMXQNBIWIHZOX-FOVJLYNBSA-N 0 3 400.526 4.306 20 0 HIADHN COc1cc(C)ccc1Oc1ccc(NC(=O)N2CC[C@H]3CCN(C)C[C@H]32)cc1F ZINC000490326097 903908756 /nfs/dbraw/zinc/90/87/56/903908756.db2.gz FQXZMMVGUPSTAE-VQIMIIECSA-N 0 3 413.493 4.493 20 0 HIADHN O=C([C@H]1CCCN(Cc2cccc(F)c2)C1)N1CCC(Cc2ccccc2CO)CC1 ZINC000490376053 903969240 /nfs/dbraw/zinc/96/92/40/903969240.db2.gz GDCXDVVCPCLQHM-QHCPKHFHSA-N 0 3 424.560 4.011 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)Nc1ccc(-c2noc(C(F)F)n2)cc1 ZINC000490411176 903994389 /nfs/dbraw/zinc/99/43/89/903994389.db2.gz CLHPBOZRJPDCBK-UHFFFAOYSA-N 0 3 421.473 4.331 20 0 HIADHN COc1ccccc1-c1ncc(CNC[C@@H](c2ccccc2OC)N2CCCC2)cn1 ZINC000490531892 904080223 /nfs/dbraw/zinc/08/02/23/904080223.db2.gz SFMVQARSBQNBNN-QFIPXVFZSA-N 0 3 418.541 4.088 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)NC[C@@H]1CCCCC(F)(F)C1 ZINC000490657870 904157922 /nfs/dbraw/zinc/15/79/22/904157922.db2.gz ODRNANPJBUUDLR-MRXNPFEDSA-N 0 3 403.464 4.254 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2ccc(NC(=O)C3CC3)cc2)N2CCCC2)cc1 ZINC000490669430 904164722 /nfs/dbraw/zinc/16/47/22/904164722.db2.gz LLXUOMIVIJTLNJ-QFIPXVFZSA-N 0 3 406.530 4.302 20 0 HIADHN O=C1C[C@@H]([C@H]2CCCCN2Cc2csc(-c3ccc(C(F)(F)F)cc3)n2)CN1 ZINC000490676221 904167551 /nfs/dbraw/zinc/16/75/51/904167551.db2.gz SFNXLRWXNCUQDP-RHSMWYFYSA-N 0 3 409.477 4.320 20 0 HIADHN COCCOc1cc(C)ccc1NC(=O)NC[C@H](c1ccc(C)cc1)N1CCCC1 ZINC000490684425 904171277 /nfs/dbraw/zinc/17/12/77/904171277.db2.gz NSCPVIRKWQZVHT-JOCHJYFZSA-N 0 3 411.546 4.287 20 0 HIADHN O=C(CC1(N2CCOCC2)CCCC1)N1CCC(c2c[nH]c3ccc(F)cc32)CC1 ZINC000490769818 904222302 /nfs/dbraw/zinc/22/23/02/904222302.db2.gz MJXFPPJPOWFQML-UHFFFAOYSA-N 0 3 413.537 4.048 20 0 HIADHN CN(C)[C@@H](CNC(=O)N[C@H](c1c[nH]c2ccccc21)C(F)(F)F)Cc1ccccc1 ZINC000490812733 904258109 /nfs/dbraw/zinc/25/81/09/904258109.db2.gz LHRXJHGJFMJMPH-OXQOHEQNSA-N 0 3 418.463 4.243 20 0 HIADHN Cc1cccc(OC[C@H](C)NC(=O)Nc2ccc(CCN3CCSCC3)cc2)c1 ZINC000490974978 904346850 /nfs/dbraw/zinc/34/68/50/904346850.db2.gz MOXSTWMDJILZFO-IBGZPJMESA-N 0 3 413.587 4.175 20 0 HIADHN COc1ccc(CN2CCC(C(=O)N3CCCCC3)CC2)cc1OCCC(C)C ZINC000506112324 914808457 /nfs/dbraw/zinc/80/84/57/914808457.db2.gz KCWVAGNUPYRWNN-UHFFFAOYSA-N 0 3 402.579 4.345 20 0 HIADHN CC(C)N(Cc1ccc([S@](C)=O)cc1)C[C@@H](O)COc1cccc2ccccc21 ZINC000506099416 914803433 /nfs/dbraw/zinc/80/34/33/914803433.db2.gz QDQZWTPPUKVOEG-PBBNMVCDSA-N 0 3 411.567 4.228 20 0 HIADHN CCc1ccc([C@@H](NC[C@@H](O)C2CCCCC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000491005393 904366289 /nfs/dbraw/zinc/36/62/89/904366289.db2.gz KQOJGSDLEITBNM-DNQXCXABSA-N 0 3 415.599 4.273 20 0 HIADHN COCCN1CCC[C@H]1CN[C@@H](c1ccc(OC)c(OC)c1)c1ccccc1Cl ZINC000491027463 904379437 /nfs/dbraw/zinc/37/94/37/904379437.db2.gz BABDXGJCLLDYAD-MBSDFSHPSA-N 0 3 418.965 4.147 20 0 HIADHN O=C(NCCCN[C@@H](c1ccccc1)c1ccccn1)c1ccc(Br)cc1 ZINC000491058371 904400039 /nfs/dbraw/zinc/40/00/39/904400039.db2.gz XUVTVBWQWSPRLU-NRFANRHFSA-N 0 3 424.342 4.343 20 0 HIADHN Cc1ccc([C@@H](N[C@H]2CCN(c3ccccc3)C2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000491062116 904405567 /nfs/dbraw/zinc/40/55/67/904405567.db2.gz USDGMVZCGGFCLS-WIOPSUGQSA-N 0 3 420.578 4.356 20 0 HIADHN CC(C)Cc1ccc([C@@H](CNC(=O)NCCc2nnc(C(C)C)s2)N(C)C)cc1 ZINC000491074983 904413073 /nfs/dbraw/zinc/41/30/73/904413073.db2.gz BEBJVCHCTLNVJA-LJQANCHMSA-N 0 3 417.623 4.005 20 0 HIADHN COc1cc(CN2CCC[C@@H](c3nnc4ccc(C(F)(F)F)cn43)C2)cc(OC)c1 ZINC000506123476 914812989 /nfs/dbraw/zinc/81/29/89/914812989.db2.gz AKTZZTJZWYKGKM-OAHLLOKOSA-N 0 3 420.435 4.145 20 0 HIADHN COc1ccccc1-c1ncc(CN[C@@H]2CCN(c3ccc(Cl)c(F)c3)C2)cn1 ZINC000491213027 904483972 /nfs/dbraw/zinc/48/39/72/904483972.db2.gz KONPOTOGLXKFML-MRXNPFEDSA-N 0 3 412.896 4.313 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)Nc3ccc(Cc4nc5ccccc5s4)cc3)[C@H]2C1 ZINC000491316253 904534085 /nfs/dbraw/zinc/53/40/85/904534085.db2.gz LCJKAKWMFQDIIO-XLIONFOSSA-N 0 3 406.555 4.445 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)Nc3ccc(Cc4nc5ccccc5s4)cc3)[C@@H]2C1 ZINC000491316255 904534571 /nfs/dbraw/zinc/53/45/71/904534571.db2.gz LCJKAKWMFQDIIO-YLJYHZDGSA-N 0 3 406.555 4.445 20 0 HIADHN CN(C)CC(C)(C)CN[C@@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000491368690 904562009 /nfs/dbraw/zinc/56/20/09/904562009.db2.gz QGIJWQDDMNPSRC-FQEVSTJZSA-N 0 3 408.995 4.010 20 0 HIADHN COc1ccccc1CCN[C@H](c1ccc(F)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000491410874 904582468 /nfs/dbraw/zinc/58/24/68/904582468.db2.gz SHXUIMMFDOFCMX-HSZRJFAPSA-N 0 3 413.514 4.160 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)cc1 ZINC000491435965 904595296 /nfs/dbraw/zinc/59/52/96/904595296.db2.gz VKKWKYZOAHTQOO-FQEVSTJZSA-N 0 3 405.420 4.038 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)Nc2ccc(Oc3ncccn3)cc2C)c1 ZINC000491502084 904626274 /nfs/dbraw/zinc/62/62/74/904626274.db2.gz HILVVBWAHLJOJR-UHFFFAOYSA-N 0 3 419.529 4.481 20 0 HIADHN CCN(CC(=O)Nc1c(Cl)cccc1Cl)C(=O)[C@@H](C(C)C)N1CCCCC1 ZINC000491502291 904627542 /nfs/dbraw/zinc/62/75/42/904627542.db2.gz LKOKSQYFHCVZNE-LJQANCHMSA-N 0 3 414.377 4.291 20 0 HIADHN COCC1(CNCc2csc(-c3ccc(C(F)(F)F)cc3)n2)CCOCC1 ZINC000491579546 904659679 /nfs/dbraw/zinc/65/96/79/904659679.db2.gz RRWQUQCNVZDRSB-UHFFFAOYSA-N 0 3 400.466 4.362 20 0 HIADHN O=C1NC2(CCCC2)C(=O)N1c1cccc(CNCc2ccc3c(c2)CCCC3)c1 ZINC000491590590 904664324 /nfs/dbraw/zinc/66/43/24/904664324.db2.gz BKEBDNPDBLCLKE-UHFFFAOYSA-N 0 3 403.526 4.224 20 0 HIADHN COc1ccccc1-c1ncc(CN[C@H]2c3ccccc3CC23CCOCC3)cn1 ZINC000491591729 904666219 /nfs/dbraw/zinc/66/62/19/904666219.db2.gz NTIHMYIZAGIIMT-QHCPKHFHSA-N 0 3 401.510 4.336 20 0 HIADHN O=C(CNC1CC(c2ccc(Br)cc2)C1)Nc1ccc(F)c(F)c1F ZINC000491845193 904709368 /nfs/dbraw/zinc/70/93/68/904709368.db2.gz HAJKVWBXYHXSLW-UHFFFAOYSA-N 0 3 413.237 4.341 20 0 HIADHN Cc1noc(C)c1[C@H](C)CNC(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1 ZINC000506182376 914837020 /nfs/dbraw/zinc/83/70/20/914837020.db2.gz FWYMONBBMOIWSN-QAPCUYQASA-N 0 3 404.580 4.229 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)Nc3ccc(Cl)c(C(=O)Nc4ccccc4)c3)[C@H]2C1 ZINC000492049101 904773935 /nfs/dbraw/zinc/77/39/35/904773935.db2.gz WXURZBOQCJGUSI-YWZLYKJASA-N 0 3 412.921 4.150 20 0 HIADHN CN(C)C(=O)c1ccc(CNC[C@@H](OCc2ccccc2)c2ccc(Cl)cc2)[nH]1 ZINC000492175929 904809683 /nfs/dbraw/zinc/80/96/83/904809683.db2.gz OFNVEMSBELXZAN-JOCHJYFZSA-N 0 3 411.933 4.418 20 0 HIADHN CCN1CCCC[C@@H]1CN[C@@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000492181565 904810959 /nfs/dbraw/zinc/81/09/59/904810959.db2.gz UGSJXFBQMNHGQS-IRLDBZIGSA-N 0 3 421.006 4.297 20 0 HIADHN COCCc1ccc(Oc2ccc(NC(=O)N3CC[C@@H]4CCN(C)C[C@H]43)cc2)cc1 ZINC000492236725 904821803 /nfs/dbraw/zinc/82/18/03/904821803.db2.gz KTKBFHMGUMLLEZ-WMZHIEFXSA-N 0 3 409.530 4.226 20 0 HIADHN CN(C)C[C@H](NC(=O)Nc1nc(C2CCOCC2)cs1)c1ccc(Cl)cc1 ZINC000492533633 904865030 /nfs/dbraw/zinc/86/50/30/904865030.db2.gz BJJSYHYWXFNOMZ-INIZCTEOSA-N 0 3 408.955 4.115 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)c1ccnc(SCC(F)(F)F)c1 ZINC000492557968 904868203 /nfs/dbraw/zinc/86/82/03/904868203.db2.gz KZEQGEJWVLTNRW-KRWDZBQOSA-N 0 3 409.477 4.303 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)NCc2sc(-c3ccccc3)nc2C)cc1 ZINC000492605058 904876837 /nfs/dbraw/zinc/87/68/37/904876837.db2.gz ZCOPTKIBUBSYBK-FQEVSTJZSA-N 0 3 424.570 4.229 20 0 HIADHN CN(C)[C@H](CNC(=O)NCc1ccccc1OCc1ccccc1)c1ccccc1 ZINC000506237159 914857749 /nfs/dbraw/zinc/85/77/49/914857749.db2.gz AITOOQGFDVJFSK-HSZRJFAPSA-N 0 3 403.526 4.368 20 0 HIADHN CO[C@@H]1C[C@@H](N[C@@H](c2cccc(S(C)(=O)=O)c2)c2ccc(C)cc2C)C1(C)C ZINC000493009055 904985441 /nfs/dbraw/zinc/98/54/41/904985441.db2.gz MBKJKAAOQUXQIZ-VSKRKVRLSA-N 0 3 401.572 4.199 20 0 HIADHN OCC[C@@]1(CN[C@@H](c2cccc(F)c2)c2cccc(Br)c2)CCOC1 ZINC000493009329 904985998 /nfs/dbraw/zinc/98/59/98/904985998.db2.gz MYQFYARUJFCMHH-UXHICEINSA-N 0 3 408.311 4.056 20 0 HIADHN COc1cc(OC)cc(N2CC[C@@H](CN[C@H](c3ccccc3)c3ccccn3)C2)c1 ZINC000493011253 904988359 /nfs/dbraw/zinc/98/83/59/904988359.db2.gz UGVUBCNWULNIES-UQBPGWFLSA-N 0 3 403.526 4.304 20 0 HIADHN C[C@@H](C(=O)N(C)[C@@H](c1ncc[nH]1)c1ccccc1)N1CCC(Cc2ccccc2)CC1 ZINC000493010013 904989661 /nfs/dbraw/zinc/98/96/61/904989661.db2.gz PGGYVRZAJKBERI-GBXCKJPGSA-N 0 3 416.569 4.301 20 0 HIADHN Cc1cc(C(=O)N(CCN(C)C)Cc2ccccc2)cc(C)c1OCc1cccnc1 ZINC000493048563 905001962 /nfs/dbraw/zinc/00/19/62/905001962.db2.gz UFEQYSVUXWKOCA-UHFFFAOYSA-N 0 3 417.553 4.481 20 0 HIADHN CCc1ccc([C@@H](NCC2(O)CCCCCC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000493076863 905009891 /nfs/dbraw/zinc/00/98/91/905009891.db2.gz FIEDXUHMGWFPJF-HSZRJFAPSA-N 0 3 415.599 4.417 20 0 HIADHN COc1ccc([C@H](NC[C@@H](C)CN2CCOCC2)c2ccccc2Cl)cc1OC ZINC000493148993 905033292 /nfs/dbraw/zinc/03/32/92/905033292.db2.gz NCCLRBBSYKNPAU-HXOBKFHXSA-N 0 3 418.965 4.005 20 0 HIADHN COC(=O)c1scc(-c2ccc(C)cc2)c1NC(=O)N1CC[C@H]2CCN(C)C[C@H]21 ZINC000493157094 905036254 /nfs/dbraw/zinc/03/62/54/905036254.db2.gz XWJWAFQKUKNTJT-SJLPKXTDSA-N 0 3 413.543 4.068 20 0 HIADHN CN(C(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1)[C@H](c1ncc[nH]1)c1ccccc1 ZINC000493206368 905050459 /nfs/dbraw/zinc/05/04/59/905050459.db2.gz QRLZMFFERYNUMX-UNMCSNQZSA-N 0 3 406.505 4.009 20 0 HIADHN CCC1(CN[C@@H](c2ccc(F)cc2)c2cccc(S(C)(=O)=O)c2)CCOCC1 ZINC000493226108 905056416 /nfs/dbraw/zinc/05/64/16/905056416.db2.gz HQZPWLQCFQFNSK-NRFANRHFSA-N 0 3 405.535 4.115 20 0 HIADHN Cc1ccc([C@H](NC[C@@H](O)CC(C)(C)C)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000493236202 905060598 /nfs/dbraw/zinc/06/05/98/905060598.db2.gz ZVAQKRPMTHPETL-SIKLNZKXSA-N 0 3 403.588 4.183 20 0 HIADHN CC(C)C[C@@H](CCO)CN[C@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000493251689 905068975 /nfs/dbraw/zinc/06/89/75/905068975.db2.gz VENHOQSFZVCXAH-VGOFRKELSA-N 0 3 424.006 4.467 20 0 HIADHN Fc1cc(Br)ccc1[C@@H](NCCCO[C@@H]1CCOC1)c1ccccc1 ZINC000493279080 905075437 /nfs/dbraw/zinc/07/54/37/905075437.db2.gz XBVQJFLMDKHMKA-XLIONFOSSA-N 0 3 408.311 4.463 20 0 HIADHN CCc1ccc([C@H](NCCCNc2ccccn2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000493277462 905076532 /nfs/dbraw/zinc/07/65/32/905076532.db2.gz QXBWVAYDYVSSGW-DEOSSOPVSA-N 0 3 423.582 4.229 20 0 HIADHN Cc1cn2c(n1)[C@H](CN[C@H](c1ccc(C)cc1)c1cccc(S(C)(=O)=O)c1)CCC2 ZINC000493306747 905081998 /nfs/dbraw/zinc/08/19/98/905081998.db2.gz UDYNAHKAULCMPK-JTHBVZDNSA-N 0 3 423.582 4.160 20 0 HIADHN Cc1nn(Cc2ccc(Cl)cc2)c(C)c1CN1CCC(C(=O)N2CCCC2)CC1 ZINC000506271172 914875622 /nfs/dbraw/zinc/87/56/22/914875622.db2.gz VPEBJHHKPHQUTC-UHFFFAOYSA-N 0 3 414.981 4.036 20 0 HIADHN Cc1cc(NC(=O)C[C@H](C)c2c(C)n[nH]c2C)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000493463559 905128441 /nfs/dbraw/zinc/12/84/41/905128441.db2.gz VSYAFGCLVMGATQ-HRAATJIYSA-N 0 3 420.561 4.111 20 0 HIADHN COc1cc(C(=O)N2CC[C@H]3CCN(C)C[C@H]32)ccc1OCc1ccccc1Cl ZINC000493556355 905160465 /nfs/dbraw/zinc/16/04/65/905160465.db2.gz PZQIHACJVIJISW-OXQOHEQNSA-N 0 3 414.933 4.094 20 0 HIADHN COc1cc(-c2noc(CN[C@H]3CCC[C@@H]3CCC(C)C)n2)cc(OC)c1OC ZINC000493570623 905163833 /nfs/dbraw/zinc/16/38/33/905163833.db2.gz ABXJPWKUWILUBL-WBVHZDCISA-N 0 3 403.523 4.457 20 0 HIADHN COc1cc([C@@H](C)N[C@@H]2CCc3cc(Br)cc(C)c32)ccc1OCCO ZINC000493819889 905227231 /nfs/dbraw/zinc/22/72/31/905227231.db2.gz NVRFLFLZOLTKNH-RDTXWAMCSA-N 0 3 420.347 4.475 20 0 HIADHN O=C1CCCN1C[C@H](N[C@@H]1CCc2ccccc2OC1)c1cccc(C(F)(F)F)c1 ZINC000493821976 905228278 /nfs/dbraw/zinc/22/82/78/905228278.db2.gz PPWXJYZYLFBQEB-UXHICEINSA-N 0 3 418.459 4.352 20 0 HIADHN Fc1ccc(OCCN2CCC[C@H](c3nnc4ccc(C(F)(F)F)cn43)C2)cc1 ZINC000493870305 905237982 /nfs/dbraw/zinc/23/79/82/905237982.db2.gz FFVUZVLNLRJHLL-AWEZNQCLSA-N 0 3 408.399 4.146 20 0 HIADHN C[C@H](N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)c1cc(Br)cs1 ZINC000493888272 905249060 /nfs/dbraw/zinc/24/90/60/905249060.db2.gz LKTLDZGDFPBPBG-YOEHRIQHSA-N 0 3 407.377 4.395 20 0 HIADHN O=C1[C@H](N[C@H]2CCO[C@@H]2c2ccc(F)c(F)c2)CCCN1c1ccccc1Cl ZINC000493910111 905262448 /nfs/dbraw/zinc/26/24/48/905262448.db2.gz YTEFCHBDQYPJAU-NLWGTHIKSA-N 0 3 406.860 4.233 20 0 HIADHN O=C(NCc1ccccc1)N(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000493915161 905265549 /nfs/dbraw/zinc/26/55/49/905265549.db2.gz COMCDNLUWGSNGQ-RUZDIDTESA-N 0 3 414.553 4.458 20 0 HIADHN CC[C@@H](NC(=O)NC[C@H](c1ccc(OC(C)C)cc1)N(C)C)c1nc(C)cs1 ZINC000493919132 905270490 /nfs/dbraw/zinc/27/04/90/905270490.db2.gz GWCYUELKZWIJDU-RTBURBONSA-N 0 3 404.580 4.292 20 0 HIADHN O=C(Nc1ccccn1)N(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000493923825 905275519 /nfs/dbraw/zinc/27/55/19/905275519.db2.gz FKOWGDBLPFJUBC-JOCHJYFZSA-N 0 3 401.514 4.175 20 0 HIADHN COCCN(C)CCOc1cccc(CNC(=O)Nc2csc3ccccc23)c1 ZINC000493931703 905284549 /nfs/dbraw/zinc/28/45/49/905284549.db2.gz JDQRJIKEBCCSBO-UHFFFAOYSA-N 0 3 413.543 4.180 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)Nc3ccc(C(F)(F)F)cc3Br)[C@H]2C1 ZINC000493936256 905288184 /nfs/dbraw/zinc/28/81/84/905288184.db2.gz XSSZCONWOKQJJR-HZMBPMFUSA-N 0 3 406.246 4.026 20 0 HIADHN CCN(C(=O)[C@H](C)Nc1ccc(N2CCN(CC)CC2)cc1C)C1CCCCC1 ZINC000493975059 905321845 /nfs/dbraw/zinc/32/18/45/905321845.db2.gz ALXLWHQCCFEAOF-FQEVSTJZSA-N 0 3 400.611 4.119 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)c2cccc(CSc3nccn3C)c2)CCN1Cc1ccccc1 ZINC000493997761 905338720 /nfs/dbraw/zinc/33/87/20/905338720.db2.gz BCVLNVPQRQHFJB-GCJKJVERSA-N 0 3 420.582 4.105 20 0 HIADHN CCc1ccc([C@@H](NCC(C)(C)C[C@H](C)O)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000494018786 905357994 /nfs/dbraw/zinc/35/79/94/905357994.db2.gz FIFOPQYDAFSQHH-HTAPYJJXSA-N 0 3 403.588 4.129 20 0 HIADHN CCc1ccc([C@H](NCCCc2nccs2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000494028204 905369060 /nfs/dbraw/zinc/36/90/60/905369060.db2.gz KLBYENSASQXJQV-QFIPXVFZSA-N 0 3 414.596 4.421 20 0 HIADHN Cc1ccc([C@@H](NCCCc2nccs2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000494030388 905371877 /nfs/dbraw/zinc/37/18/77/905371877.db2.gz VUGGGHAWIFAFRA-QFIPXVFZSA-N 0 3 414.596 4.475 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)c1ccnc(SCC(F)(F)F)c1 ZINC000494098503 905432159 /nfs/dbraw/zinc/43/21/59/905432159.db2.gz AYLKIFMXNZQLKI-QGZVFWFLSA-N 0 3 409.477 4.303 20 0 HIADHN C[C@H](O)C[C@@H]1CCCCCN1CC(=O)N[C@@H](c1cccs1)c1ccc(F)cc1 ZINC000512434423 921158855 /nfs/dbraw/zinc/15/88/55/921158855.db2.gz XJEARBHESGVQTR-XWFZLUIHSA-N 0 3 404.551 4.108 20 0 HIADHN CN1C(=O)C[C@H](NCc2ccc(Cl)c3cccnc23)[C@@H]1c1ccc(F)c(F)c1 ZINC000494277652 905602451 /nfs/dbraw/zinc/60/24/51/905602451.db2.gz SSNFZTSYOLNRKW-RXVVDRJESA-N 0 3 401.844 4.228 20 0 HIADHN Cc1ccnc(-c2n[nH]c([C@H](C)N[C@@H](C)Cc3ccc(Br)cc3F)n2)c1 ZINC000494327674 905638434 /nfs/dbraw/zinc/63/84/34/905638434.db2.gz IHENMWYFEXUVNH-STQMWFEESA-N 0 3 418.314 4.359 20 0 HIADHN OCC1(CN[C@H](c2cccc(F)c2)c2cccc(Br)c2)CCOCC1 ZINC000494457349 905739205 /nfs/dbraw/zinc/73/92/05/905739205.db2.gz NMQBRJDCIKYDIT-IBGZPJMESA-N 0 3 408.311 4.056 20 0 HIADHN COC[C@H](N[C@@H](C)CC(=O)Nc1cc(OC)ccc1OC)c1ccc(Cl)cc1 ZINC000494480508 905761626 /nfs/dbraw/zinc/76/16/26/905761626.db2.gz ZSWIKPXZNWJPPJ-LIRRHRJNSA-N 0 3 406.910 4.052 20 0 HIADHN Cc1nc(COc2ccc(CN3CCC[C@H](CNC(=O)C(C)C)C3)cc2)cs1 ZINC000512458329 921174354 /nfs/dbraw/zinc/17/43/54/921174354.db2.gz ZLBZXBAIHWVVQF-LJQANCHMSA-N 0 3 401.576 4.015 20 0 HIADHN O=C1[C@H](N[C@H]2CCO[C@@H]2c2ccc(Cl)cc2)CCCN1Cc1ccc(F)cc1F ZINC000494481714 905763863 /nfs/dbraw/zinc/76/38/63/905763863.db2.gz BPPRGXQYVIZWRH-PWRODBHTSA-N 0 3 420.887 4.229 20 0 HIADHN C[C@@H]1CCN(C(=O)Nc2nc(C3CCOCC3)cs2)CCN1Cc1ccccc1 ZINC000494485283 905768003 /nfs/dbraw/zinc/76/80/03/905768003.db2.gz KLZBCNVXZHFDKN-QGZVFWFLSA-N 0 3 414.575 4.165 20 0 HIADHN Fc1cc([C@H]2OCC[C@H]2NCc2ccc(OCC(F)(F)F)nc2)ccc1Cl ZINC000494505686 905796889 /nfs/dbraw/zinc/79/68/89/905796889.db2.gz KCACRZTZXIDBOD-NVXWUHKLSA-N 0 3 404.791 4.435 20 0 HIADHN COC[C@H](N[C@H](C)CC(=O)Nc1ccc(OC)cc1OC)c1ccc(Cl)cc1 ZINC000494510860 905801901 /nfs/dbraw/zinc/80/19/01/905801901.db2.gz PFAJOJAUWDBFNU-KUHUBIRLSA-N 0 3 406.910 4.052 20 0 HIADHN CCCC(=O)NC[C@@H]1CCCN(Cc2c(C)nn(-c3ccc(Cl)cc3)c2C)C1 ZINC000512469516 921181378 /nfs/dbraw/zinc/18/13/78/921181378.db2.gz RDLHLKOHSFLKSX-SFHVURJKSA-N 0 3 402.970 4.271 20 0 HIADHN CCCC(=O)NC[C@@H]1CCCN(Cc2c(C)nn(Cc3ccccc3Cl)c2C)C1 ZINC000512475241 921185084 /nfs/dbraw/zinc/18/50/84/921185084.db2.gz QWBPRDMJPFIBJC-IBGZPJMESA-N 0 3 416.997 4.330 20 0 HIADHN C[C@@H]1[C@H](NC(=O)N[C@@H](c2nccs2)c2ccccc2)CCN1Cc1ccccc1 ZINC000494652629 905885045 /nfs/dbraw/zinc/88/50/45/905885045.db2.gz XYMZWLUVLSGIBN-DUXKGJEZSA-N 0 3 406.555 4.195 20 0 HIADHN C[C@@H]1CN(C2CCOCC2)CCN1C(=O)N[C@H](CCc1ccccc1)c1ccccc1 ZINC000494703993 905909991 /nfs/dbraw/zinc/90/99/91/905909991.db2.gz PFHLZQKDFQPEHV-PXDATVDWSA-N 0 3 421.585 4.255 20 0 HIADHN Cc1ccc([C@@H](NCC(C)(C)[C@@H](O)C(C)C)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000494714506 905917048 /nfs/dbraw/zinc/91/70/48/905917048.db2.gz IZUZRWYFIKJIHS-YADHBBJMSA-N 0 3 403.588 4.121 20 0 HIADHN CCc1ccc([C@H](NCC(C)(C)[C@H](O)C(C)C)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000494716315 905918853 /nfs/dbraw/zinc/91/88/53/905918853.db2.gz WIOPLKOWIAGYSV-XZOQPEGZSA-N 0 3 417.615 4.375 20 0 HIADHN Cc1ccc([C@H](NCC(C)(C)[C@H](O)C(C)C)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000494715188 905919048 /nfs/dbraw/zinc/91/90/48/905919048.db2.gz MPYFWOZLFZDMMZ-DHIUTWEWSA-N 0 3 417.615 4.429 20 0 HIADHN COc1cc(C)c(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2F)c(C)c1C ZINC000494747675 905946603 /nfs/dbraw/zinc/94/66/03/905946603.db2.gz SEADFZVFQJJLQH-UHFFFAOYSA-N 0 3 405.489 4.494 20 0 HIADHN CC1CCN(CCNC(=O)c2cccnc2Oc2cccc(Br)c2)CC1 ZINC000512487093 921193767 /nfs/dbraw/zinc/19/37/67/921193767.db2.gz QARLHAOELQYTDY-UHFFFAOYSA-N 0 3 418.335 4.098 20 0 HIADHN CN(C)CCN(Cc1cccc(O)c1)C(=O)[C@@H]1C[C@@H]1c1cccc(Cl)c1Cl ZINC000494781760 905981990 /nfs/dbraw/zinc/98/19/90/905981990.db2.gz XNKYUJKVPOENNB-QZTJIDSGSA-N 0 3 407.341 4.393 20 0 HIADHN CN1CCN(CC(=O)N2Cc3ccccc3[C@@H](c3ccccc3)C2)C2(CCCCC2)C1 ZINC000494893806 906069236 /nfs/dbraw/zinc/06/92/36/906069236.db2.gz QHQKPFLDBIWURI-RUZDIDTESA-N 0 3 417.597 4.111 20 0 HIADHN O=C(Nc1cccc(CN[C@H](C[C@H]2CCOC2)c2ccc(F)cc2)c1)[C@H]1CCCO1 ZINC000494901980 906078490 /nfs/dbraw/zinc/07/84/90/906078490.db2.gz HIJILTHKFKRJRT-SXSPYAJSSA-N 0 3 412.505 4.201 20 0 HIADHN C[C@@H](NC(=O)N1CCN(C2CCOCC2)C[C@@H]1C)c1ccc(Oc2ccccc2)cc1 ZINC000494912125 906085828 /nfs/dbraw/zinc/08/58/28/906085828.db2.gz SYCGPUJHEOVLJA-VQTJNVASSA-N 0 3 423.557 4.435 20 0 HIADHN C[C@H](NC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1)[C@H]1OCCc2sccc21 ZINC000494938658 906108799 /nfs/dbraw/zinc/10/87/99/906108799.db2.gz PMJZWCZIHJRFKO-NPPFBWRTSA-N 0 3 413.587 4.056 20 0 HIADHN O=C(C1CCN(Cc2c[nH]nc2-c2ccc(C(F)(F)F)cc2)CC1)N1CCCCC1 ZINC000494968827 906137401 /nfs/dbraw/zinc/13/74/01/906137401.db2.gz DJVLOZBZBJUWCG-UHFFFAOYSA-N 0 3 420.479 4.320 20 0 HIADHN C[C@H](NC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1)[C@H]1OCCc2sccc21 ZINC000494972063 906139617 /nfs/dbraw/zinc/13/96/17/906139617.db2.gz FZMMFMJDPHOOPX-LRXVAGHRSA-N 0 3 413.587 4.056 20 0 HIADHN COc1ccc([C@H](NC[C@H]2C[C@H](O)CN2Cc2ccccc2)c2ccc(F)cc2)cc1 ZINC000494971232 906139662 /nfs/dbraw/zinc/13/96/62/906139662.db2.gz PGOGMDPWMCCUSH-RMTZWNOUSA-N 0 3 420.528 4.149 20 0 HIADHN O=C(Nc1ccccc1Br)C1CCN(C/C=C\c2ccncc2)CC1 ZINC000494982526 906146317 /nfs/dbraw/zinc/14/63/17/906146317.db2.gz YACVFBKGJXMYMW-ARJAWSKDSA-N 0 3 400.320 4.208 20 0 HIADHN C[C@H](NC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C)[C@@H]1OCCc2sccc21 ZINC000494986370 906150180 /nfs/dbraw/zinc/15/01/80/906150180.db2.gz PTRDLDBMTICCPP-SPEDKVCISA-N 0 3 413.587 4.056 20 0 HIADHN Cc1cc(C)n(-c2ccc(C(=O)NC[C@H](c3cccs3)N3CCC(C)CC3)cn2)n1 ZINC000512520493 921212800 /nfs/dbraw/zinc/21/28/00/921212800.db2.gz NWPBNDZZPUNRBN-HXUWFJFHSA-N 0 3 423.586 4.149 20 0 HIADHN CNC(=O)[C@@H]1CCC[C@H]1N[C@H](c1cccc(F)c1)c1cccc(Br)c1 ZINC000495049119 906203501 /nfs/dbraw/zinc/20/35/01/906203501.db2.gz OGNSCBYEALIHRM-QRVBRYPASA-N 0 3 405.311 4.182 20 0 HIADHN O=C1C[C@H](N[C@@H](C[C@H]2CCOC2)c2ccc(F)cc2)CN1c1ccccc1Cl ZINC000495056115 906210733 /nfs/dbraw/zinc/21/07/33/906210733.db2.gz BMJQMKBGVLZZJA-BPAFIMBUSA-N 0 3 402.897 4.342 20 0 HIADHN O=C(Nc1ccc(Br)cn1)[C@H]1CCCN(Cc2scnc2C2CC2)C1 ZINC000495142113 906268645 /nfs/dbraw/zinc/26/86/45/906268645.db2.gz RPDQXJPQCNJYHE-ZDUSSCGKSA-N 0 3 421.364 4.029 20 0 HIADHN C[C@H](NC(=O)NC[C@H]1CCCN1Cc1ccccc1)c1nc(C(F)(F)F)cs1 ZINC000495205594 906306798 /nfs/dbraw/zinc/30/67/98/906306798.db2.gz UKDZPEDHUSXLOZ-DZGCQCFKSA-N 0 3 412.481 4.187 20 0 HIADHN FC(F)(F)Cn1ccnc1CNCC1(c2ccc(Br)s2)CCC1 ZINC000512542924 921225777 /nfs/dbraw/zinc/22/57/77/921225777.db2.gz XBSPIJYTGYMFOK-UHFFFAOYSA-N 0 3 408.287 4.481 20 0 HIADHN CC(C)(C)N1C[C@@H](C(=O)Nc2nc3c(ccc(F)c3F)s2)[C@H](C(F)(F)F)C1 ZINC000495279175 906353781 /nfs/dbraw/zinc/35/37/81/906353781.db2.gz BETPIYWHMXKROZ-RKDXNWHRSA-N 0 3 407.408 4.422 20 0 HIADHN CCCNC(=O)c1ccc(NCC2CCN(Cc3ccccc3Cl)CC2)nc1 ZINC000495305269 906366500 /nfs/dbraw/zinc/36/65/00/906366500.db2.gz QDJYMVKWSUGRST-UHFFFAOYSA-N 0 3 400.954 4.199 20 0 HIADHN C[C@H]1CCCCN1CCNC(=O)c1ccc(COc2cccc(Br)c2)o1 ZINC000495329289 906379181 /nfs/dbraw/zinc/37/91/81/906379181.db2.gz IQJWNQQNEAZFQK-HNNXBMFYSA-N 0 3 421.335 4.225 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)[C@H](C)[C@H]3OCCc4sccc43)c2)CC1 ZINC000495365609 906407451 /nfs/dbraw/zinc/40/74/51/906407451.db2.gz JGUPRNIKJBWGQH-VGOFRKELSA-N 0 3 413.587 4.167 20 0 HIADHN Cc1ccc(-c2noc(CCCN[C@H](c3nnc4ccccn43)C(C)C)n2)cc1F ZINC000495373869 906413007 /nfs/dbraw/zinc/41/30/07/906413007.db2.gz JSJSCRBQQUHNJX-FQEVSTJZSA-N 0 3 408.481 4.146 20 0 HIADHN Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)NC(=O)N1CCN2CCC1CC2 ZINC000495421260 906441728 /nfs/dbraw/zinc/44/17/28/906441728.db2.gz PCELKANGQCYZOX-AWEZNQCLSA-N 0 3 404.967 4.323 20 0 HIADHN O=S(=O)(NCc1cccc(F)c1)c1cccc(CN[C@H]2CCCc3ccccc32)c1 ZINC000495513638 906493051 /nfs/dbraw/zinc/49/30/51/906493051.db2.gz IGEHWDDLGFJILA-DEOSSOPVSA-N 0 3 424.541 4.471 20 0 HIADHN COCCCOc1ccc(CNCc2cnc3c(C)cc(Br)cn23)cc1 ZINC000512569912 921242423 /nfs/dbraw/zinc/24/24/23/921242423.db2.gz RLCWYDNVHWLYAZ-UHFFFAOYSA-N 0 3 418.335 4.110 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)C(C)(C)Cc3ccccc3OC)c(C)c2)CC1 ZINC000495844693 906560322 /nfs/dbraw/zinc/56/03/22/906560322.db2.gz HBZBGJAQROWDBG-UHFFFAOYSA-N 0 3 409.574 4.353 20 0 HIADHN CCc1nc([C@@H](C)NC(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)cs1 ZINC000496165505 906618328 /nfs/dbraw/zinc/61/83/28/906618328.db2.gz HAFZICNFATULRD-DNVCBOLYSA-N 0 3 404.580 4.156 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)CSc1ccc2c(c1)CCC2 ZINC000496210598 906627583 /nfs/dbraw/zinc/62/75/83/906627583.db2.gz LAWNLBXAIVKLIR-JOCHJYFZSA-N 0 3 409.599 4.176 20 0 HIADHN O=C(Nc1ccc(O)cc1)C1CCN(Cc2ccc(OCc3cccnc3)cc2)CC1 ZINC000512591438 921252446 /nfs/dbraw/zinc/25/24/46/921252446.db2.gz XDUDTYPVRDSNDP-UHFFFAOYSA-N 0 3 417.509 4.217 20 0 HIADHN CCCN(CCN(C)C)C(=O)c1cc(-c2cc(C)sc2C)nc2onc(C)c21 ZINC000496212233 906630305 /nfs/dbraw/zinc/63/03/05/906630305.db2.gz WXGIBHCNYUIXBX-UHFFFAOYSA-N 0 3 400.548 4.290 20 0 HIADHN CCCN(CCN(C)C)C(=O)Cc1csc(-c2ccc(Cl)cc2Cl)n1 ZINC000496244872 906636594 /nfs/dbraw/zinc/63/65/94/906636594.db2.gz MYHYOUMBMOOPNK-UHFFFAOYSA-N 0 3 400.375 4.460 20 0 HIADHN Cc1cc(Cl)ccc1Cc1cnc(NC(=O)N2CC[C@@H]3CCN(C)C[C@@H]32)s1 ZINC000496445560 906681502 /nfs/dbraw/zinc/68/15/02/906681502.db2.gz AOKNLCGXEDVUOL-KSSFIOAISA-N 0 3 404.967 4.254 20 0 HIADHN CCN(C(=O)Nc1cnn(C)c1-c1ccccc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000496706671 906740310 /nfs/dbraw/zinc/74/03/10/906740310.db2.gz KIPMKBGCDUSEDZ-NRFANRHFSA-N 0 3 403.530 4.215 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1ncc(Cc2ccc(F)cc2)s1 ZINC000497216732 906822126 /nfs/dbraw/zinc/82/21/26/906822126.db2.gz YHEXJWPVZDYGTG-UHFFFAOYSA-N 0 3 402.495 4.062 20 0 HIADHN O=C(CCc1cncs1)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1 ZINC000497398978 906880400 /nfs/dbraw/zinc/88/04/00/906880400.db2.gz KUVUOLYZHPWMKV-UHFFFAOYSA-N 0 3 420.582 4.079 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)c2cc(C3CC3)nc3onc(C(C)C)c32)o1 ZINC000497399260 906880794 /nfs/dbraw/zinc/88/07/94/906880794.db2.gz ACUYALWRJTXJJA-UHFFFAOYSA-N 0 3 410.518 4.329 20 0 HIADHN Cn1cc(CN2CCC(OC3CCCC3)CC2)c(-c2ccc3c(c2)OCCCO3)n1 ZINC000512652255 921275155 /nfs/dbraw/zinc/27/51/55/921275155.db2.gz KQRKOPQIGAFALT-UHFFFAOYSA-N 0 3 411.546 4.172 20 0 HIADHN C[C@H](CC(=O)N[C@H]1CN(C)C[C@@H]1c1ccccc1)c1ccc(Br)cc1 ZINC000497413603 906889384 /nfs/dbraw/zinc/88/93/84/906889384.db2.gz BKHUQBYXGMLGLW-YSGRDPCXSA-N 0 3 401.348 4.157 20 0 HIADHN CN1C[C@@H](NC(=O)c2ccc(Oc3ccncc3)c(Cl)c2)[C@@H](c2ccccc2)C1 ZINC000497415984 906890890 /nfs/dbraw/zinc/89/08/90/906890890.db2.gz IQTQGMYMFYALMI-TZIWHRDSSA-N 0 3 407.901 4.355 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CNC(=O)CN(C)[C@H](c1ccccc1)C(C)C ZINC000497422477 906895828 /nfs/dbraw/zinc/89/58/28/906895828.db2.gz OKZGUWSJVXHACG-SANMLTNESA-N 0 3 418.585 4.494 20 0 HIADHN O=C(N[C@H]1CCN(c2ccc(Cl)c(F)c2)C1)c1cccc(CN2CCCC2)c1 ZINC000497456502 906932738 /nfs/dbraw/zinc/93/27/38/906932738.db2.gz CJGDGTCPTAKUEV-SFHVURJKSA-N 0 3 401.913 4.084 20 0 HIADHN COc1ccc(CNC(=O)C2CCN(Cc3ccc(OCC(C)C)cc3)CC2)cc1 ZINC000512672838 921282813 /nfs/dbraw/zinc/28/28/13/921282813.db2.gz LBIHIMKXSNGHSA-UHFFFAOYSA-N 0 3 410.558 4.258 20 0 HIADHN Cc1sc(CNC(=O)[C@H]2CN(Cc3ccccc3)CCC2(F)F)nc1C(C)C ZINC000512687792 921286963 /nfs/dbraw/zinc/28/69/63/921286963.db2.gz XEYHCJILQBXQDM-QGZVFWFLSA-N 0 3 407.530 4.349 20 0 HIADHN Cc1ccc(CNC(=O)C2CCN(Cc3c[nH]nc3-c3ccc(F)cc3)CC2)cc1 ZINC000512687359 921287263 /nfs/dbraw/zinc/28/72/63/921287263.db2.gz QGEMOFLMKPZAIE-UHFFFAOYSA-N 0 3 406.505 4.053 20 0 HIADHN O=C(Nc1ccccc1)C1CCN(C[C@H](O)COc2cc(Cl)ccc2Cl)CC1 ZINC000497586407 907068087 /nfs/dbraw/zinc/06/80/87/907068087.db2.gz YWIKNVCQNHINRN-SFHVURJKSA-N 0 3 423.340 4.084 20 0 HIADHN COc1cc(C)c(CN(C)C[C@H](O)COc2cc(Cl)ccc2Cl)cc1OC ZINC000497587010 907069064 /nfs/dbraw/zinc/06/90/64/907069064.db2.gz FOTITAWLUXXQGD-INIZCTEOSA-N 0 3 414.329 4.191 20 0 HIADHN COc1cc(C)c(CN(C)C[C@@H](O)COc2ccc(Cl)cc2Cl)cc1OC ZINC000497586855 907069556 /nfs/dbraw/zinc/06/95/56/907069556.db2.gz BJJYIFCNNLORKJ-MRXNPFEDSA-N 0 3 414.329 4.191 20 0 HIADHN C[C@H](NC(=O)N[C@H](CN1CCc2ccccc2C1)C(C)(C)C)c1c(F)cncc1F ZINC000497607347 907086856 /nfs/dbraw/zinc/08/68/56/907086856.db2.gz ACXSYMPGDNRBQH-MGPUTAFESA-N 0 3 416.516 4.193 20 0 HIADHN COc1cccc([C@@H]2CCCN2C[C@@H](O)COc2cccc(Br)c2)c1 ZINC000497611693 907088287 /nfs/dbraw/zinc/08/82/87/907088287.db2.gz PHAFTJCOTNMOHE-XLIONFOSSA-N 0 3 406.320 4.035 20 0 HIADHN C[C@H](NC(=O)N1CC[C@H]2CCN(C)C[C@@H]21)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000497628605 907108393 /nfs/dbraw/zinc/10/83/93/907108393.db2.gz PXZHHBMBWSZKAD-WGGBDISSSA-N 0 3 411.521 4.201 20 0 HIADHN Cc1cccc(COc2ccc([C@H](C)NC(=O)N3CC[C@@H]4CCN(C)C[C@@H]43)cc2)c1 ZINC000497627810 907108709 /nfs/dbraw/zinc/10/87/09/907108709.db2.gz NSCNFGGUDNHZKL-APTRMMRNSA-N 0 3 407.558 4.371 20 0 HIADHN CN1CCC[C@H](CNC(=O)c2occ3c2CCOC3)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000512745229 921300641 /nfs/dbraw/zinc/30/06/41/921300641.db2.gz WOCUJADMJODVSM-DNVCBOLYSA-N 0 3 422.447 4.184 20 0 HIADHN CCC[C@@H](NC(=O)N(C)CCCN1CCN(C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000497695948 907200687 /nfs/dbraw/zinc/20/06/87/907200687.db2.gz IULXCHJUPOCINB-LJQANCHMSA-N 0 3 415.409 4.114 20 0 HIADHN CCC[C@H](NC(=O)N(C)CCCN1CCN(C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000497695947 907202379 /nfs/dbraw/zinc/20/23/79/907202379.db2.gz IULXCHJUPOCINB-IBGZPJMESA-N 0 3 415.409 4.114 20 0 HIADHN COc1ccc(-c2cnc(CCC(=O)N[C@H](CN3CCCC3)c3ccccc3)o2)cc1 ZINC000497724524 907223396 /nfs/dbraw/zinc/22/33/96/907223396.db2.gz WUFBFDPJFJFGBM-JOCHJYFZSA-N 0 3 419.525 4.236 20 0 HIADHN O[C@@H](COCc1ccccc1Cl)CN(Cc1cccc(F)c1)C[C@H]1CCCO1 ZINC000497739166 907234734 /nfs/dbraw/zinc/23/47/34/907234734.db2.gz KWCIYMGFCJMSPR-NHCUHLMSSA-N 0 3 407.913 4.038 20 0 HIADHN O[C@H](CO[C@@H]1CCCc2ccccc21)CN(Cc1cccc(F)c1)C[C@H]1CCCO1 ZINC000497736170 907234956 /nfs/dbraw/zinc/23/49/56/907234956.db2.gz RPPSPFALYCTUTF-JBRSBNLGSA-N 0 3 413.533 4.262 20 0 HIADHN CCN(C(=O)N[C@@H](C)c1nccn1-c1ccccc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000512778481 921309861 /nfs/dbraw/zinc/30/98/61/921309861.db2.gz NKJNPIBPSNQKHB-REWPJTCUSA-N 0 3 417.557 4.239 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)CCc2ncc(-c3ccc(OC)cc3)o2)N(C)C)cc1 ZINC000497805991 907290489 /nfs/dbraw/zinc/29/04/89/907290489.db2.gz VQDQBLZCTLQSPV-JOCHJYFZSA-N 0 3 421.541 4.264 20 0 HIADHN Cc1c(NCC(C)(C)C)cccc1C(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1CO ZINC000497888352 907361024 /nfs/dbraw/zinc/36/10/24/907361024.db2.gz IIRLZABNURCJEG-XUZZJYLKSA-N 0 3 423.601 4.066 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)[C@H](c3ccccc3)C3CC3)CC2)c1 ZINC000497896633 907370036 /nfs/dbraw/zinc/37/00/36/907370036.db2.gz UNOYQTQSYZZJGR-RUZDIDTESA-N 0 3 405.586 4.207 20 0 HIADHN Cc1ccc(-c2nc3cc(F)ccc3n2C)cc1NC(=O)N[C@H](C)C1=CCN(C)CC1 ZINC000512821930 921325697 /nfs/dbraw/zinc/32/56/97/921325697.db2.gz SPRGIXGYHMGRLZ-MRXNPFEDSA-N 0 3 421.520 4.460 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)N2C[C@H](C)C[C@@H]2c2cccnc2)N(C)C)cc1 ZINC000512822417 921326392 /nfs/dbraw/zinc/32/63/92/921326392.db2.gz VLQWQMPLGNHEFU-YSZBQJHXSA-N 0 3 410.562 4.264 20 0 HIADHN COc1ccc([C@H](CNC(=O)C[C@H]2CCCc3cc(OC)ccc32)N2CCCC2)cc1 ZINC000497994545 907474715 /nfs/dbraw/zinc/47/47/15/907474715.db2.gz QQGAEFBHZAKOEE-BWKNWUBXSA-N 0 3 422.569 4.467 20 0 HIADHN CCN(C(=O)c1cnn(-c2ccccc2)c1C)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000498022468 907521024 /nfs/dbraw/zinc/52/10/24/907521024.db2.gz MOPDGIPKXNMDNJ-AUSIDOKSSA-N 0 3 402.542 4.478 20 0 HIADHN CN(C)Cc1ccccc1C(=O)N1CC[C@H](Cc2ccc(Br)cc2)C1 ZINC000498027206 907527794 /nfs/dbraw/zinc/52/77/94/907527794.db2.gz KBMIMIIUQLNLCE-QGZVFWFLSA-N 0 3 401.348 4.216 20 0 HIADHN O=C(CSc1cccc(C(F)(F)F)c1)NCCCN1CCc2ccccc2C1 ZINC000498038318 907542497 /nfs/dbraw/zinc/54/24/97/907542497.db2.gz LUTXUVJGRXVSLQ-UHFFFAOYSA-N 0 3 408.489 4.362 20 0 HIADHN Cc1csc([C@H](NC(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)C2CC2)n1 ZINC000498046738 907556600 /nfs/dbraw/zinc/55/66/00/907556600.db2.gz MFSDPHLMEWMFMW-VQTJNVASSA-N 0 3 416.591 4.292 20 0 HIADHN CC[C@H](CNC(=O)c1ccc(Cn2nc(C)cc2C)cc1)N1CCc2ccccc2C1 ZINC000498046498 907558482 /nfs/dbraw/zinc/55/84/82/907558482.db2.gz LIXPKTFTQDEIDZ-RUZDIDTESA-N 0 3 416.569 4.115 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)[C@@H]1C[C@@H]1c1ccc(F)cc1F ZINC000498049548 907559730 /nfs/dbraw/zinc/55/97/30/907559730.db2.gz XMFROMOTWGZXQV-WOJBJXKFSA-N 0 3 402.510 4.298 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)[C@@H]1C[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000498060818 907572900 /nfs/dbraw/zinc/57/29/00/907572900.db2.gz FDQYAHOIIRCAQX-NHCUHLMSSA-N 0 3 402.460 4.374 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)c1cc(=O)[nH]c2ccccc21 ZINC000498120772 907632488 /nfs/dbraw/zinc/63/24/88/907632488.db2.gz ILFQCJBJUZXLSZ-UHFFFAOYSA-N 0 3 417.431 4.163 20 0 HIADHN CC[C@@H](C)c1ccc([C@@H](NC(=O)N(C)CCCN2CCN(C)CC2)C(C)C)cc1 ZINC000498128230 907645561 /nfs/dbraw/zinc/64/55/61/907645561.db2.gz TVQWHKYCEHLVSY-OFNKIYASSA-N 0 3 402.627 4.176 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)[C@@H](C)Oc3ccc(F)cc3Cl)cc2)CC1 ZINC000498201495 907734885 /nfs/dbraw/zinc/73/48/85/907734885.db2.gz NJDHZRQTPVSIBD-MRXNPFEDSA-N 0 3 419.928 4.023 20 0 HIADHN C[C@H](NC(=O)Nc1cc(Br)cc(C(F)(F)F)c1)C1=CCN(C)CC1 ZINC000512845019 921347959 /nfs/dbraw/zinc/34/79/59/921347959.db2.gz JXVBVXDKJUNJTK-JTQLQIEISA-N 0 3 406.246 4.240 20 0 HIADHN O=C(N[C@@H](c1cccc(F)c1)c1ccccn1)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000498239727 907774231 /nfs/dbraw/zinc/77/42/31/907774231.db2.gz ONDAZEFIZIXKRT-VWNXMTODSA-N 0 3 418.516 4.274 20 0 HIADHN Cc1cccc([C@H](NC(=O)NC[C@@H]2CCCN2Cc2ccccc2)c2ccccn2)c1 ZINC000498244486 907781089 /nfs/dbraw/zinc/78/10/89/907781089.db2.gz UQQLZXAZLXPWEJ-ZCYQVOJMSA-N 0 3 414.553 4.443 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2CN(C)C(=O)[C@H]2CCCN2C)cc1C ZINC000498258464 907797271 /nfs/dbraw/zinc/79/72/71/907797271.db2.gz MSMYUUWERUUSTM-HSZRJFAPSA-N 0 3 402.542 4.209 20 0 HIADHN C[C@H](NC(=O)Nc1cc(Cl)ccc1-c1nc(C2CC2)no1)C1=CCN(C)CC1 ZINC000512852174 921357555 /nfs/dbraw/zinc/35/75/55/921357555.db2.gz MUUHHGYIYCFKQX-LBPRGKRZSA-N 0 3 401.898 4.039 20 0 HIADHN CCN(CC)[C@H](CNC(=O)COc1cccc(C(F)(F)F)c1)c1ccsc1 ZINC000498350003 907852417 /nfs/dbraw/zinc/85/24/17/907852417.db2.gz OAJFSWJSBUIXFE-QGZVFWFLSA-N 0 3 400.466 4.345 20 0 HIADHN CCC(CC)[C@@H]1C[C@@H](NC(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)CCO1 ZINC000498377768 907866705 /nfs/dbraw/zinc/86/67/05/907866705.db2.gz VPCOWAMAGRLZPL-RXVVDRJESA-N 0 3 411.537 4.022 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)N[C@H]2COc3c2ccc(Cl)c3Cl)cc1 ZINC000498412504 907889063 /nfs/dbraw/zinc/88/90/63/907889063.db2.gz AWWKSTICAWNNBI-SJORKVTESA-N 0 3 424.328 4.038 20 0 HIADHN CC[C@H](NCc1cc(Br)c2c(c1)OCCO2)c1ccc(OC)c(OC)c1 ZINC000512863720 921364206 /nfs/dbraw/zinc/36/42/06/921364206.db2.gz FZKXIGSIGNKSMJ-INIZCTEOSA-N 0 3 422.319 4.478 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)N[C@H](C)c2ccc(-c3cccnc3)cc2)cc1 ZINC000498608220 908057530 /nfs/dbraw/zinc/05/75/30/908057530.db2.gz UHCHXPDICADXMZ-HOYKHHGWSA-N 0 3 418.541 4.420 20 0 HIADHN Cc1cccc2cc(C(=O)NCCCCN3CCN(Cc4ccccc4)CC3)oc21 ZINC000498616594 908063054 /nfs/dbraw/zinc/06/30/54/908063054.db2.gz PDVVXJOXRWYWIK-UHFFFAOYSA-N 0 3 405.542 4.069 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)NCc1ccc(OC(C)(C)C)nc1 ZINC000498695405 908123082 /nfs/dbraw/zinc/12/30/82/908123082.db2.gz ODGGPSOXGYEQBC-UHFFFAOYSA-N 0 3 418.969 4.186 20 0 HIADHN Cc1cc(-c2cc(C(=O)N3CCN(C)CC[C@@H]3C)c3cnn(C(C)C)c3n2)c(C)o1 ZINC000498709885 908136267 /nfs/dbraw/zinc/13/62/67/908136267.db2.gz MKEOIBGSERMXFX-HNNXBMFYSA-N 0 3 409.534 4.055 20 0 HIADHN Cc1ccc2[nH]c3c(c2c1)C[C@H](NC(=O)N(Cc1ccco1)C1CCN(C)CC1)CC3 ZINC000498710829 908136956 /nfs/dbraw/zinc/13/69/56/908136956.db2.gz RKQDBMPILFYZNF-GOSISDBHSA-N 0 3 420.557 4.233 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)N[C@H](C)c2ccc(-c3ccncc3)cc2)cc1 ZINC000498714790 908139586 /nfs/dbraw/zinc/13/95/86/908139586.db2.gz MIDZREMTVYABHG-HOYKHHGWSA-N 0 3 418.541 4.420 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)NC[C@@H]1CCCO[C@@H]1c1ccc(C)cc1 ZINC000498722422 908148232 /nfs/dbraw/zinc/14/82/32/908148232.db2.gz XQXSIPDJPLQMOQ-XZOQPEGZSA-N 0 3 401.595 4.370 20 0 HIADHN C[C@H](CCn1cccn1)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1 ZINC000498753969 908178645 /nfs/dbraw/zinc/17/86/45/908178645.db2.gz PCPIHHDGJRCIOK-JOCHJYFZSA-N 0 3 403.574 4.139 20 0 HIADHN CCCc1ccccc1NC(=O)N1CCC[C@H](CN2CCN(c3ccccn3)CC2)C1 ZINC000498817494 908224922 /nfs/dbraw/zinc/22/49/22/908224922.db2.gz AUHBNGJQFDITIO-OAQYLSRUSA-N 0 3 421.589 4.100 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)N[C@@H]1CCCOc2c(F)cccc21 ZINC000498833633 908243468 /nfs/dbraw/zinc/24/34/68/908243468.db2.gz LQACLWLTEMLVGI-HXUWFJFHSA-N 0 3 421.463 4.091 20 0 HIADHN Cc1nc([C@H]2CCCN2C(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)cs1 ZINC000512902390 921394259 /nfs/dbraw/zinc/39/42/59/921394259.db2.gz NYUDTJKDHWZQHV-RTWAWAEBSA-N 0 3 416.591 4.388 20 0 HIADHN O=C(Nc1ccccc1)c1cccc(CN2CCC[C@@H](c3nnc(C4CC4)[nH]3)C2)c1 ZINC000498927671 908336720 /nfs/dbraw/zinc/33/67/20/908336720.db2.gz VEIGCXOGMHZPKE-HXUWFJFHSA-N 0 3 401.514 4.314 20 0 HIADHN CCN1C[C@@H](C)N(Cc2csc(N(C(C)=O)c3ccc(Cl)cc3)n2)C[C@@H]1C ZINC000498940305 908347945 /nfs/dbraw/zinc/34/79/45/908347945.db2.gz XLJXEASPMKXPGF-LSDHHAIUSA-N 0 3 406.983 4.396 20 0 HIADHN Cc1cccc([C@H](NC(=O)N[C@H]2CCN(Cc3ccccc3)C2)c2ccccn2)c1 ZINC000499013372 908389397 /nfs/dbraw/zinc/38/93/97/908389397.db2.gz LSRXPOUVIKVBDD-UPVQGACJSA-N 0 3 400.526 4.053 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)N2CCc3c4ccccc4[nH]c3C2)N(C)C)cc1 ZINC000512913232 921405837 /nfs/dbraw/zinc/40/58/37/921405837.db2.gz UCBHZMSKENKLDD-DEOSSOPVSA-N 0 3 420.557 4.326 20 0 HIADHN Cc1cccc([C@@H](NC(=O)N2CCCN(Cc3ccccc3)CC2)c2ccccn2)c1 ZINC000499024031 908398167 /nfs/dbraw/zinc/39/81/67/908398167.db2.gz RTXCELVYODUECV-RUZDIDTESA-N 0 3 414.553 4.397 20 0 HIADHN Cc1cc(NC(=O)C(C)(C)C)sc1C(=O)NC[C@@H](c1ccc(C)cc1)N(C)C ZINC000499132981 908489797 /nfs/dbraw/zinc/48/97/97/908489797.db2.gz BJHPFHGQEQHGSV-KRWDZBQOSA-N 0 3 401.576 4.382 20 0 HIADHN C[C@@H]1CN(C(=O)NCC2(C3CCCCC3)CCCCC2)CC[C@H]1N1CCN(C)CC1 ZINC000499148661 908507502 /nfs/dbraw/zinc/50/75/02/908507502.db2.gz FZJWWVYFDSMGKR-FYYLOGMGSA-N 0 3 418.670 4.185 20 0 HIADHN C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)N1CCc2nc(-c3ccccc3Cl)sc2C1 ZINC000499194191 908548311 /nfs/dbraw/zinc/54/83/11/908548311.db2.gz SAFMRMPPMGDYPL-ACJLOTCBSA-N 0 3 416.978 4.014 20 0 HIADHN C[C@H]1Cc2ccc(Br)cc2CN1C(=O)Nc1cccc(CN(C)C)c1 ZINC000499235353 908597096 /nfs/dbraw/zinc/59/70/96/908597096.db2.gz MEILQEGDANYENJ-AWEZNQCLSA-N 0 3 402.336 4.489 20 0 HIADHN CC(C)c1noc2ncc(C(=O)N(CCN(C)C)Cc3cccc(Cl)c3)cc21 ZINC000499251041 908624854 /nfs/dbraw/zinc/62/48/54/908624854.db2.gz WWDLMSLDESECCA-UHFFFAOYSA-N 0 3 400.910 4.204 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)Cc1cc(Cl)ccc1Cl ZINC000499357944 908727267 /nfs/dbraw/zinc/72/72/67/908727267.db2.gz JSDXPDGLJRBRRI-UHFFFAOYSA-N 0 3 401.284 4.405 20 0 HIADHN Cc1cn(-c2ccccc2Cl)nc1C(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000499369275 908737970 /nfs/dbraw/zinc/73/79/70/908737970.db2.gz OPTTUQHWPQLFHS-HKUYNNGSSA-N 0 3 408.933 4.399 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2ccc(Br)cc2F)N2CCCC2)cc1 ZINC000499396325 908757708 /nfs/dbraw/zinc/75/77/08/908757708.db2.gz FRAMSHKQLCGCBL-IBGZPJMESA-N 0 3 405.311 4.464 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)CSc2ccc(C(F)(F)F)cn2)N2CCCC2)cc1 ZINC000499398748 908760541 /nfs/dbraw/zinc/76/05/41/908760541.db2.gz ZHNYXELJCLULOE-GOSISDBHSA-N 0 3 423.504 4.454 20 0 HIADHN CC(=O)c1cc(Br)ccc1OCC(=O)Nc1ccc(C)cc1CN(C)C ZINC000512962951 921439694 /nfs/dbraw/zinc/43/96/94/921439694.db2.gz XSKNQDICRXZYDH-UHFFFAOYSA-N 0 3 419.319 4.039 20 0 HIADHN CCCN(CCc1cccc(F)c1)C(=O)c1ccc(N2CCN(C(C)C)CC2)cc1 ZINC000499476661 908810937 /nfs/dbraw/zinc/81/09/37/908810937.db2.gz WHGKQZRXVKHQOA-UHFFFAOYSA-N 0 3 411.565 4.451 20 0 HIADHN Cc1nn(-c2ccccc2)c(Oc2ccc(F)cc2)c1CN[C@H]1CCc2c[nH]nc2C1 ZINC000499681196 908875180 /nfs/dbraw/zinc/87/51/80/908875180.db2.gz HJIHZQOMXIBFSN-IBGZPJMESA-N 0 3 417.488 4.482 20 0 HIADHN O=S(=O)(CCCNCc1cccc(OCc2ccc(F)cc2)c1)c1ccccc1 ZINC000499683255 908875744 /nfs/dbraw/zinc/87/57/44/908875744.db2.gz GNXIFHKAXFGYDR-UHFFFAOYSA-N 0 3 413.514 4.358 20 0 HIADHN CC1CCN([C@@H](CNC(=O)Cc2cccc(OC(F)F)c2)c2cccs2)CC1 ZINC000499682746 908876067 /nfs/dbraw/zinc/87/60/67/908876067.db2.gz ZUYBXFGZCDJLHT-SFHVURJKSA-N 0 3 408.514 4.481 20 0 HIADHN COc1ccc(C(=O)CCCC(=O)N(C)C[C@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000499850335 908985056 /nfs/dbraw/zinc/98/50/56/908985056.db2.gz SKDMZZBOYKSVOD-OAQYLSRUSA-N 0 3 408.542 4.029 20 0 HIADHN CCOc1cc2c(cc1[C@@H]1C[C@@H]1C(=O)NC[C@@H](c1ccc(C)cc1)N(C)C)O[C@@H](C)C2 ZINC000499976321 909420656 /nfs/dbraw/zinc/42/06/56/909420656.db2.gz JRCDBOXMSHNAAK-NWZJSZKRSA-N 0 3 422.569 4.240 20 0 HIADHN O=C(NC[C@@H]1CCCN(Cc2ccc(OCc3ccncc3)cc2)C1)c1ccccc1 ZINC000513038576 921497139 /nfs/dbraw/zinc/49/71/39/921497139.db2.gz ZFTABPRDQWDTOV-QHCPKHFHSA-N 0 3 415.537 4.303 20 0 HIADHN C[S@](=O)Cc1ccc(CNCc2ccc(-n3ccc(C(F)(F)F)n3)cc2)cc1 ZINC000513040296 921499555 /nfs/dbraw/zinc/49/95/55/921499555.db2.gz HHEVGOVMRPIBRH-NDEPHWFRSA-N 0 3 407.461 4.059 20 0 HIADHN CN(C(=O)Cc1cc(Cl)ccc1Cl)C1CCN(CCc2ccccn2)CC1 ZINC000500039071 909496818 /nfs/dbraw/zinc/49/68/18/909496818.db2.gz NYOHCNMPAGVAOI-UHFFFAOYSA-N 0 3 406.357 4.096 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N[C@H](Cn1ccnc1)c1ccc(C)cc1C)c1ccco1 ZINC000500113760 909595123 /nfs/dbraw/zinc/59/51/23/909595123.db2.gz PVFBQWYWYLMJRN-ILWGZMRPSA-N 0 3 423.561 4.263 20 0 HIADHN CNC(=O)c1ccc(CN2CCC(F)(c3ccccc3OC(F)(F)F)CC2)cc1 ZINC000500121163 909601840 /nfs/dbraw/zinc/60/18/40/909601840.db2.gz FMTGNXFCIAVTJN-UHFFFAOYSA-N 0 3 410.411 4.406 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N[C@H](c1ccco1)c1ccccc1OC)c1ccco1 ZINC000500181771 909678247 /nfs/dbraw/zinc/67/82/47/909678247.db2.gz KFAGMRNPCXUWHP-CECAUBDESA-N 0 3 411.502 4.399 20 0 HIADHN O=C(NC[C@@H]1CCCN(Cc2ccccc2OCc2ccncc2)C1)c1ccccc1 ZINC000513060317 921516741 /nfs/dbraw/zinc/51/67/41/921516741.db2.gz ZNPNUFPIJMSHPN-QFIPXVFZSA-N 0 3 415.537 4.303 20 0 HIADHN COc1ccc([C@H]2CCCN2C(=O)CN2CCC[C@H](Cc3ccccc3)C2)c(OC)c1 ZINC000500220559 909713178 /nfs/dbraw/zinc/71/31/78/909713178.db2.gz SDRLQQXFNJWBRK-ZJSXRUAMSA-N 0 3 422.569 4.322 20 0 HIADHN CCc1nnc(NC(=O)[C@H](C)[C@H](C)NCc2ccc(F)c(Cl)c2Cl)s1 ZINC000513068298 921522579 /nfs/dbraw/zinc/52/25/79/921522579.db2.gz JAWWICZMGYHKRY-BDAKNGLRSA-N 0 3 405.326 4.299 20 0 HIADHN CCc1nnc(NC(=O)[C@H](C)[C@@H](C)NCc2ccc(-c3cccc(F)c3F)o2)s1 ZINC000513069681 921524962 /nfs/dbraw/zinc/52/49/62/921524962.db2.gz PGMYGRMNMICRNP-VXGBXAGGSA-N 0 3 420.485 4.392 20 0 HIADHN C[C@@H](NC(=O)C(=O)Nc1cccc(CN(C)C)c1)[C@@H](C)c1ccccc1C(F)(F)F ZINC000500377087 909824476 /nfs/dbraw/zinc/82/44/76/909824476.db2.gz IDPJODBAJCTVKG-HUUCEWRRSA-N 0 3 421.463 4.014 20 0 HIADHN C[C@@H](NC(=O)NCCCN1CCc2ccccc2C1)c1ccccc1OC(F)F ZINC000500386174 909827591 /nfs/dbraw/zinc/82/75/91/909827591.db2.gz UBGBRYIIXMXYBP-MRXNPFEDSA-N 0 3 403.473 4.097 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)CCc2ccc(Cl)c(OC)c2)cc1 ZINC000500409126 909841431 /nfs/dbraw/zinc/84/14/31/909841431.db2.gz LTBBBEFHHRZWAI-OAQYLSRUSA-N 0 3 416.949 4.243 20 0 HIADHN C[C@@H](NC(=O)NC[C@H](c1ccccc1)N1CCCC1)c1ccccc1OC(F)F ZINC000500426762 909850060 /nfs/dbraw/zinc/85/00/60/909850060.db2.gz GMLLEOJIVGODDG-VQIMIIECSA-N 0 3 403.473 4.485 20 0 HIADHN O=C(NC[C@@H]1CCCN(Cc2c[nH]nc2-c2ccc(Cl)cc2)C1)c1ccccc1 ZINC000513076152 921528806 /nfs/dbraw/zinc/52/88/06/921528806.db2.gz NRFYQMAXSGJNAL-KRWDZBQOSA-N 0 3 408.933 4.372 20 0 HIADHN COCc1ccc(CNCc2ccc(I)c(Cl)c2)cc1 ZINC000500448503 909865859 /nfs/dbraw/zinc/86/58/59/909865859.db2.gz VKEYNQLZDMDHCD-UHFFFAOYSA-N 0 3 401.675 4.381 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)N[C@H](C)c2ccc(Cl)s2)CC1 ZINC000500632012 909979657 /nfs/dbraw/zinc/97/96/57/909979657.db2.gz VNAXKIGFYCTJQI-MRXNPFEDSA-N 0 3 421.010 4.099 20 0 HIADHN COc1ccc(CNCc2ccc(C[S@@](C)=O)cc2)cc1OCc1ccccc1 ZINC000513089009 921539808 /nfs/dbraw/zinc/53/98/08/921539808.db2.gz LIBCUOFQPFGCLH-GDLZYMKVSA-N 0 3 409.551 4.443 20 0 HIADHN CC(C)CN(C(=O)CCCc1ccc(Br)s1)C1CCN(C)CC1 ZINC000500676774 910013028 /nfs/dbraw/zinc/01/30/28/910013028.db2.gz ICOCIHDTRKHRDN-UHFFFAOYSA-N 0 3 401.414 4.412 20 0 HIADHN CC[C@H](NCc1ccc(OC(F)(F)F)cc1)c1ccccc1OCC(=O)N(C)C ZINC000513109277 921555516 /nfs/dbraw/zinc/55/55/16/921555516.db2.gz ASQRKLYGQHMCQM-SFHVURJKSA-N 0 3 410.436 4.293 20 0 HIADHN NC(=O)[C@H]1CCCN(Cc2ccccc2NC(=O)CCCCCc2cccs2)C1 ZINC000500929509 910190644 /nfs/dbraw/zinc/19/06/44/910190644.db2.gz SVLPKWQSSBCVDT-IBGZPJMESA-N 0 3 413.587 4.187 20 0 HIADHN C[C@@H](CC(=O)N[C@@H]1CCN(Cc2ccccc2)CC1(C)C)C(=O)c1cccc(F)c1 ZINC000513110542 921557086 /nfs/dbraw/zinc/55/70/86/921557086.db2.gz QEYQQHXTKZQQDO-PGRDOPGGSA-N 0 3 410.533 4.452 20 0 HIADHN CN(C)[C@H](CNC(=O)NC[C@H](c1cccc(Cl)c1)N1CCCC1)c1ccsc1 ZINC000501027529 910244148 /nfs/dbraw/zinc/24/41/48/910244148.db2.gz ZVSXYUOTPCZQSP-WOJBJXKFSA-N 0 3 421.010 4.141 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1ccc2oc(C(=O)OC)cc2c1)c1ccsc1 ZINC000501076707 910278081 /nfs/dbraw/zinc/27/80/81/910278081.db2.gz GPLXXJWKEMZJMW-KRWDZBQOSA-N 0 3 415.515 4.486 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N[C@@H](c1cccc(F)c1)c1ccccn1)c1ccco1 ZINC000501087216 910285296 /nfs/dbraw/zinc/28/52/96/910285296.db2.gz LTPNKXPTJFWGAT-AQKFKSFVSA-N 0 3 410.493 4.332 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CN1CCC2(C[C@H]2C(=O)N2CCCCC2)CC1 ZINC000501130462 910312206 /nfs/dbraw/zinc/31/22/06/910312206.db2.gz JCRATODSZCQOAN-DEOSSOPVSA-N 0 3 420.601 4.163 20 0 HIADHN COCc1ccccc1/C=C(/C)CN[C@H]1CCCN(Cc2ccc(F)cc2F)C1=O ZINC000513122972 921567120 /nfs/dbraw/zinc/56/71/20/921567120.db2.gz RENZCNNPZOLKMP-ZDALTALBSA-N 0 3 414.496 4.295 20 0 HIADHN Cc1c(NC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)cccc1C(=O)N1CCCC1 ZINC000501159895 910330384 /nfs/dbraw/zinc/33/03/84/910330384.db2.gz AZFLYMAOYBZBPO-NRFANRHFSA-N 0 3 420.557 4.017 20 0 HIADHN Cc1cc(C(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)c(C)n1Cc1ccccn1 ZINC000501228573 910387877 /nfs/dbraw/zinc/38/78/77/910387877.db2.gz OAXMCYCHBYYULB-AUSIDOKSSA-N 0 3 402.542 4.114 20 0 HIADHN Cc1nc(C)c(CN2CCC(C(=O)Nc3ccccc3Br)CC2)s1 ZINC000513127283 921572096 /nfs/dbraw/zinc/57/20/96/921572096.db2.gz FZMSVSSFEVZPGY-UHFFFAOYSA-N 0 3 408.365 4.373 20 0 HIADHN Cc1cc(N(C)C)cc(C)c1NC(=O)N1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000501253784 910415163 /nfs/dbraw/zinc/41/51/63/910415163.db2.gz NJJUKOSJPBYHSV-PMACEKPBSA-N 0 3 416.610 4.113 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)c2cnn(Cc3ccccc3Cl)c2)C1 ZINC000501258913 910420353 /nfs/dbraw/zinc/42/03/53/910420353.db2.gz RFQMGJPFIMJXEI-LAUBAEHRSA-N 0 3 408.933 4.150 20 0 HIADHN CN(C(=O)c1ccnc(-c2ccc(Cl)cc2)n1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000501261156 910422238 /nfs/dbraw/zinc/42/22/38/910422238.db2.gz GSEDWLCVVBOSSL-HXUWFJFHSA-N 0 3 406.917 4.144 20 0 HIADHN CC1(C)CN(Cc2ccccc2)CC[C@@H]1NC(=O)CCC(=O)c1ccc(Cl)cn1 ZINC000513131569 921575159 /nfs/dbraw/zinc/57/51/59/921575159.db2.gz IPULTMACUYKPGY-NRFANRHFSA-N 0 3 413.949 4.115 20 0 HIADHN CC[C@@H](CNC(=O)Nc1ccc(C(=O)N(CC)CC)cc1)N1CCc2ccccc2C1 ZINC000501331714 910473300 /nfs/dbraw/zinc/47/33/00/910473300.db2.gz XACQSUWNHHRDPH-QHCPKHFHSA-N 0 3 422.573 4.127 20 0 HIADHN CC(C)c1noc2ncc(C(=O)Nc3ccc(CCN4CCSCC4)cc3)cc21 ZINC000501415054 910547119 /nfs/dbraw/zinc/54/71/19/910547119.db2.gz CBHDWRZYRLHBFA-UHFFFAOYSA-N 0 3 410.543 4.190 20 0 HIADHN COc1ccc(C(=O)Nc2ccc(CCN3CCSCC3)cc2)cc1OC(F)F ZINC000501417922 910551071 /nfs/dbraw/zinc/55/10/71/910551071.db2.gz DLIOBQPXGMKTDB-UHFFFAOYSA-N 0 3 422.497 4.140 20 0 HIADHN C[C@@H](Sc1ccc(Br)cc1)C(=O)NCCN(C)Cc1ccccc1 ZINC000501478753 910592867 /nfs/dbraw/zinc/59/28/67/910592867.db2.gz WRWDRJNALXKTGM-OAHLLOKOSA-N 0 3 407.377 4.178 20 0 HIADHN CCCc1nc(C)c(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2c2ccccc2)o1 ZINC000513161979 921593054 /nfs/dbraw/zinc/59/30/54/921593054.db2.gz VUJWKRXLLNNUTD-FCHUYYIVSA-N 0 3 403.526 4.334 20 0 HIADHN CNC(=O)CC[C@@H]1CCCCN1CC(=O)N1CCC[C@@H]1c1ccc(C(C)(C)C)cc1 ZINC000513177702 921602233 /nfs/dbraw/zinc/60/22/33/921602233.db2.gz IMGKIGLHQMMKGG-FCHUYYIVSA-N 0 3 413.606 4.028 20 0 HIADHN O=C(Nc1c[nH]nc1[C@H]1CCCN(Cc2c[nH]nc2-c2ccccc2)C1)C1CCCC1 ZINC000501711809 910780140 /nfs/dbraw/zinc/78/01/40/910780140.db2.gz FLLMZQQCLPJOJX-IBGZPJMESA-N 0 3 418.545 4.308 20 0 HIADHN Cn1cc(CN2CCC[C@@H](c3n[nH]cc3NC(=O)c3ccccc3)C2)c(C(C)(C)C)n1 ZINC000501718756 910788432 /nfs/dbraw/zinc/78/84/32/910788432.db2.gz JZHDPWQQSJBJIZ-GOSISDBHSA-N 0 3 420.561 4.073 20 0 HIADHN Cn1cc(CN2CCC[C@H](c3n[nH]cc3NC(=O)c3ccccc3)C2)c(C(C)(C)C)n1 ZINC000501718757 910789238 /nfs/dbraw/zinc/78/92/38/910789238.db2.gz JZHDPWQQSJBJIZ-SFHVURJKSA-N 0 3 420.561 4.073 20 0 HIADHN CCOc1ccc(CN2CCC[C@@H](c3n[nH]cc3NC(=O)c3ccccc3)C2)cc1 ZINC000501731802 910794708 /nfs/dbraw/zinc/79/47/08/910794708.db2.gz MZHYLXQFMNMTAS-HXUWFJFHSA-N 0 3 404.514 4.440 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)Nc2cc3c(cc2Cl)OCCO3)N(C)C)cc1 ZINC000501749988 910809036 /nfs/dbraw/zinc/80/90/36/910809036.db2.gz BPKXDWOMEOCOAW-GOSISDBHSA-N 0 3 403.910 4.098 20 0 HIADHN Cc1oc(-c2ccco2)nc1CC(=O)N[C@H](CN1CCc2ccccc2C1)C(C)(C)C ZINC000501764043 910818468 /nfs/dbraw/zinc/81/84/68/910818468.db2.gz FPOYYWWJRVWVTJ-JOCHJYFZSA-N 0 3 421.541 4.375 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)N1CCC[C@H]1c1ccc2c(c1)OCCO2 ZINC000501801625 910851595 /nfs/dbraw/zinc/85/15/95/910851595.db2.gz FVNOOBGJVCMZKG-VXKWHMMOSA-N 0 3 421.541 4.141 20 0 HIADHN CCN(CC)C(=O)c1cccc(NC(=O)N[C@H](CN2CCCC2)c2ccccc2)c1 ZINC000501802755 910854132 /nfs/dbraw/zinc/85/41/32/910854132.db2.gz IIWMYFAGEWDVIJ-JOCHJYFZSA-N 0 3 408.546 4.127 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)N[C@H](CN2CCCC2)c2ccccc2)c(OC)c1 ZINC000501806505 910857938 /nfs/dbraw/zinc/85/79/38/910857938.db2.gz XVZRERAYRBCJSH-PKTZIBPZSA-N 0 3 423.557 4.387 20 0 HIADHN COc1ccc(OC(F)F)c(NC(=O)N[C@H](CN2CCCC2)c2ccccc2)c1 ZINC000501809146 910859992 /nfs/dbraw/zinc/85/99/92/910859992.db2.gz HOZCSNHJJNRDCS-GOSISDBHSA-N 0 3 405.445 4.255 20 0 HIADHN CC(C)[C@H](NC(=O)N[C@@H](CN1CCCC1)c1ccccc1)c1ccc2c(c1)OCCO2 ZINC000501853525 910886317 /nfs/dbraw/zinc/88/63/17/910886317.db2.gz UXZKQCKVAZXCDM-URXFXBBRSA-N 0 3 423.557 4.291 20 0 HIADHN C[C@H](CC(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1)c1ccc(F)cc1F ZINC000501876376 910898999 /nfs/dbraw/zinc/89/89/99/910898999.db2.gz ZGTRMQMYWZWFNX-KURKYZTESA-N 0 3 408.533 4.196 20 0 HIADHN C[C@@H](CC(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1)c1ccc(F)cc1F ZINC000501876379 910899188 /nfs/dbraw/zinc/89/91/88/910899188.db2.gz ZGTRMQMYWZWFNX-OKZBNKHCSA-N 0 3 408.533 4.196 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)[C@@H]1C[C@@H]1c1cccc(Cl)c1 ZINC000502030209 910987818 /nfs/dbraw/zinc/98/78/18/910987818.db2.gz GCRBBAVOMJDTOJ-DHIUTWEWSA-N 0 3 411.977 4.162 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)[C@H]1C[C@@H]1c1cccc(Cl)c1 ZINC000502030211 910988567 /nfs/dbraw/zinc/98/85/67/910988567.db2.gz GCRBBAVOMJDTOJ-PKTZIBPZSA-N 0 3 411.977 4.162 20 0 HIADHN COCCN1CCC(NC(=O)c2cccc(CSc3ccc(C)cc3C)c2)CC1 ZINC000502040705 910993892 /nfs/dbraw/zinc/99/38/92/910993892.db2.gz HGLWKKOZWAOABE-UHFFFAOYSA-N 0 3 412.599 4.436 20 0 HIADHN O=C(NC[C@H]1CCCN1Cc1ccccc1)C1(c2ccc(Cl)cc2)CCOCC1 ZINC000513216337 921631544 /nfs/dbraw/zinc/63/15/44/921631544.db2.gz AJMMDZKWJVFEHQ-JOCHJYFZSA-N 0 3 412.961 4.169 20 0 HIADHN CC(C)(C)c1noc(-c2ccccc2C(=O)NC[C@H]2CCCN2Cc2ccccc2)n1 ZINC000513218046 921633434 /nfs/dbraw/zinc/63/34/34/921633434.db2.gz NAHDNJOUEWWPPE-LJQANCHMSA-N 0 3 418.541 4.429 20 0 HIADHN COc1ccccc1[C@H](CNC(=O)N[C@H](C)[C@@H](c1ccccc1)N(C)C)OC(C)C ZINC000502184501 911115785 /nfs/dbraw/zinc/11/57/85/911115785.db2.gz IDLHWVBEISYWMZ-LEOXJPRUSA-N 0 3 413.562 4.152 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)[C@H]1C[C@H]1c1ccc(Br)cc1 ZINC000513224462 921639040 /nfs/dbraw/zinc/63/90/40/921639040.db2.gz SYEXVXMNCUCYSE-ACRUOGEOSA-N 0 3 413.359 4.333 20 0 HIADHN CCc1c(C(=O)NC[C@@H](c2ccsc2)N(CC)CC)cnn1Cc1ccccc1 ZINC000513223263 921639483 /nfs/dbraw/zinc/63/94/83/921639483.db2.gz SKXAFKAZVGZAHD-QFIPXVFZSA-N 0 3 410.587 4.368 20 0 HIADHN C[C@@H](NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1)c1cccc(OC(F)F)c1 ZINC000502277277 911226764 /nfs/dbraw/zinc/22/67/64/911226764.db2.gz CDMDGBVFQRIQEH-VQIMIIECSA-N 0 3 403.473 4.313 20 0 HIADHN Cc1onc(-c2cccc(Br)c2)c1C(=O)N[C@H](C)CN1CCCCC1 ZINC000502280756 911230338 /nfs/dbraw/zinc/23/03/38/911230338.db2.gz GOVKIMPTCNMXGN-CYBMUJFWSA-N 0 3 406.324 4.017 20 0 HIADHN COc1cc(C)c([C@H](C)NC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)cc1OC ZINC000502282102 911233737 /nfs/dbraw/zinc/23/37/37/911233737.db2.gz JCMNRASKWWXQDM-ICSRJNTNSA-N 0 3 411.546 4.037 20 0 HIADHN O=C(Nc1c[nH]nc1[C@@H]1CCCN(CCCOc2ccc(F)cc2)C1)c1ccccc1 ZINC000502334905 911314777 /nfs/dbraw/zinc/31/47/77/911314777.db2.gz QFHRTFDIJDTZGG-LJQANCHMSA-N 0 3 422.504 4.450 20 0 HIADHN C/C=C/COc1ccc(CC[C@H](C)NCc2cc(S(C)(=O)=O)ccc2F)cc1 ZINC000502368823 911353704 /nfs/dbraw/zinc/35/37/04/911353704.db2.gz GPHBPDPZGFBPGV-BDUNBXCCSA-N 0 3 405.535 4.295 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)N[C@H]2CCOc3c(F)cccc32)N(C)C)cc1 ZINC000502397205 911383006 /nfs/dbraw/zinc/38/30/06/911383006.db2.gz DTGGSOIUHPNYGZ-SFTDATJTSA-N 0 3 415.509 4.039 20 0 HIADHN CCOc1c(Cl)cc(C(=O)NC[C@@H]2CCCN2Cc2ccccc2)cc1OC ZINC000513248936 921657366 /nfs/dbraw/zinc/65/73/66/921657366.db2.gz KJMVWKOSOPTQRF-SFHVURJKSA-N 0 3 402.922 4.142 20 0 HIADHN CCN(CC)[C@H](CNC(=O)CSc1ccncc1)c1ccc(C(F)(F)F)cc1 ZINC000502531549 911537318 /nfs/dbraw/zinc/53/73/18/911537318.db2.gz PLIVRNRWTSTZMF-GOSISDBHSA-N 0 3 411.493 4.392 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1noc2c1CCCC2)c1ccc(C(F)(F)F)cc1 ZINC000502535234 911542103 /nfs/dbraw/zinc/54/21/03/911542103.db2.gz WXSVOTGGBQQVTN-QGZVFWFLSA-N 0 3 409.452 4.385 20 0 HIADHN COc1ccc([C@H](CO)N(C)C[C@@H](O)COc2cc(C)c(Cl)cc2C(C)C)cc1 ZINC000502547168 911555003 /nfs/dbraw/zinc/55/50/03/911555003.db2.gz TXMDNIUPUBDROA-GCJKJVERSA-N 0 3 421.965 4.186 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)CN[C@H](c2ccc(F)cc2)C(C)C)cc1OC ZINC000502563011 911569230 /nfs/dbraw/zinc/56/92/30/911569230.db2.gz JDZFXGUQQZMFOH-RDPSFJRHSA-N 0 3 414.521 4.493 20 0 HIADHN Cc1nc2c(s1)[C@H](N[C@H]1CCCN(c3ccc(OC(F)F)cc3)C1=O)CCC2 ZINC000502597877 911603095 /nfs/dbraw/zinc/60/30/95/911603095.db2.gz VHZDFPXZPRITJZ-SJORKVTESA-N 0 3 407.486 4.216 20 0 HIADHN COc1ccc([C@@H](CNC(=O)C[C@@H](C)Cc2ccccc2OC)N2CCCC2)cc1 ZINC000502612795 911637092 /nfs/dbraw/zinc/63/70/92/911637092.db2.gz UOJWOIFIEWKWAB-WMZHIEFXSA-N 0 3 410.558 4.226 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3cccc(N4CCCC4)c3)c(C)c2)CC1 ZINC000502622460 911651115 /nfs/dbraw/zinc/65/11/15/911651115.db2.gz WMJROJONLINBJP-UHFFFAOYSA-N 0 3 407.562 4.381 20 0 HIADHN Cc1noc(CSc2ccccc2C(=O)NC[C@@H]2CCCN2Cc2ccccc2)n1 ZINC000513289486 921688364 /nfs/dbraw/zinc/68/83/64/921688364.db2.gz OVWQVMZCBYHPBY-IBGZPJMESA-N 0 3 422.554 4.065 20 0 HIADHN O=C(CCC(=O)N1CC[C@@]2(C1)CCCN(Cc1ccccc1)C2)c1cccc(F)c1 ZINC000502851348 911861363 /nfs/dbraw/zinc/86/13/63/911861363.db2.gz KNSVJEIWNWRNGZ-VWLOTQADSA-N 0 3 408.517 4.303 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)CCC(=O)c3ccc(F)cc3F)c2)CC1 ZINC000502889602 911885468 /nfs/dbraw/zinc/88/54/68/911885468.db2.gz CWKFHHHROPGVNX-UHFFFAOYSA-N 0 3 415.484 4.097 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)[C@H](C)CC(=O)c3ccccc3F)c2)CC1 ZINC000502887184 911885688 /nfs/dbraw/zinc/88/56/88/911885688.db2.gz ASOJOTORYOGYCM-GOSISDBHSA-N 0 3 411.521 4.204 20 0 HIADHN Cc1cnc([C@H](NC(=O)[C@H]2CN(Cc3ccccc3)CCC2(F)F)C2CC2)s1 ZINC000513333799 921720542 /nfs/dbraw/zinc/72/05/42/921720542.db2.gz QFGDOVDMGKKWPQ-QZTJIDSGSA-N 0 3 405.514 4.176 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)Nc2cccc(C(=O)N3CCCCC3)c2)C1 ZINC000506295181 914890424 /nfs/dbraw/zinc/89/04/24/914890424.db2.gz OGAZVHTWGDQWJY-AUSIDOKSSA-N 0 3 420.557 4.270 20 0 HIADHN CCOc1cc2c(cc1NC(=O)N[C@@H]1CCN([C@H](C)c3ccccc3)C1)O[C@@H](C)C2 ZINC000506309664 914898887 /nfs/dbraw/zinc/89/88/87/914898887.db2.gz NQOYFQHRUQUHQD-SQGPQFPESA-N 0 3 409.530 4.366 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)cc1 ZINC000506312690 914903968 /nfs/dbraw/zinc/90/39/68/914903968.db2.gz PGNGASNAIHEFII-NJNPRVFISA-N 0 3 408.546 4.172 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)N3CCC[C@@H](C[N@H+]4CCCC[C@@H]4C)C3)cc2)cc(=O)[n-]1 ZINC000506314228 914906314 /nfs/dbraw/zinc/90/63/14/914906314.db2.gz JEIYVWRQTBRNBX-HKUYNNGSSA-N 0 3 423.561 4.276 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)N3CCC[C@@H](C[N@@H+]4CCCC[C@@H]4C)C3)cc2)cc(=O)[n-]1 ZINC000506314228 914906337 /nfs/dbraw/zinc/90/63/37/914906337.db2.gz JEIYVWRQTBRNBX-HKUYNNGSSA-N 0 3 423.561 4.276 20 0 HIADHN CC(=O)Nc1cc(NC(=O)[C@H]2CN(Cc3ccccc3)CCC2(F)F)ccc1C ZINC000506342253 914958791 /nfs/dbraw/zinc/95/87/91/914958791.db2.gz MXTKJEGJDXINLZ-LJQANCHMSA-N 0 3 401.457 4.049 20 0 HIADHN COC(=O)CCn1nc(C)c(CN2Cc3ccccc3[C@H](c3ccccc3)C2)c1C ZINC000506396618 915013900 /nfs/dbraw/zinc/01/39/00/915013900.db2.gz SPKQPXHXGUKCPN-DEOSSOPVSA-N 0 3 403.526 4.211 20 0 HIADHN Cc1ccc2c(CC(=O)N(C)C3CCN(CCc4ccccn4)CC3)coc2c1C ZINC000513364795 921739209 /nfs/dbraw/zinc/73/92/09/921739209.db2.gz JKPSUYXYXGNSTD-UHFFFAOYSA-N 0 3 405.542 4.153 20 0 HIADHN COc1cc(CNC(=O)c2cccc(CN3CCCC3)c2)ccc1OCC(F)(F)F ZINC000513368580 921741896 /nfs/dbraw/zinc/74/18/96/921741896.db2.gz XEIOFNXURAARDW-UHFFFAOYSA-N 0 3 422.447 4.162 20 0 HIADHN CCc1ccc([C@H](CNC(=O)Nc2cccc(CN3CCCCC3=O)c2)N(C)C)cc1 ZINC000506502434 915123680 /nfs/dbraw/zinc/12/36/80/915123680.db2.gz LSOGSFLGQMTSNR-QHCPKHFHSA-N 0 3 422.573 4.186 20 0 HIADHN COc1ccc(Br)c(NC(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)c1 ZINC000506515318 915145601 /nfs/dbraw/zinc/14/56/01/915145601.db2.gz GUGWUVCXTQIUPQ-ZBFHGGJFSA-N 0 3 418.335 4.415 20 0 HIADHN COc1ccc([C@@H](NC(=O)N2CCN(C3CCCC3)CC2)c2ccccc2OC)cc1 ZINC000506690249 915368213 /nfs/dbraw/zinc/36/82/13/915368213.db2.gz RLLYEVVMWFTITQ-XMMPIXPASA-N 0 3 423.557 4.063 20 0 HIADHN O=C(Nc1ccc2c(c1)OCO2)C1CCN(Cc2ccccc2OCC2CC2)CC1 ZINC000506734600 915420276 /nfs/dbraw/zinc/42/02/76/915420276.db2.gz JSWMXXSNAMRDJJ-UHFFFAOYSA-N 0 3 408.498 4.055 20 0 HIADHN O=C(CN1CCN(C[C@@H]2CC=CCC2)CC1)Nc1ccc(Cl)c(C(F)(F)F)c1 ZINC000506748675 915439883 /nfs/dbraw/zinc/43/98/83/915439883.db2.gz UZJUXONDOACXQU-OAHLLOKOSA-N 0 3 415.887 4.271 20 0 HIADHN CCc1ccc([C@@H]2CCCN(C[C@@H](O)COc3ccc(C(C)=O)cc3OC)C2)cc1 ZINC000513406914 921774302 /nfs/dbraw/zinc/77/43/02/921774302.db2.gz ZEOYVBNXZHQZPY-DHIUTWEWSA-N 0 3 411.542 4.080 20 0 HIADHN COc1ccccc1O[C@H]1CCCN(CCc2nc(-c3ccc(Cl)cc3)no2)C1 ZINC000513406606 921774441 /nfs/dbraw/zinc/77/44/41/921774441.db2.gz VAAXEYPXFBVDET-SFHVURJKSA-N 0 3 413.905 4.485 20 0 HIADHN C[C@H](NCC(=O)N1CCc2sccc2[C@@H]1c1ccccc1)c1ccc2n[nH]cc2c1 ZINC000513410813 921778354 /nfs/dbraw/zinc/77/83/54/921778354.db2.gz HIOBFPCKAICBAZ-FYSMJZIKSA-N 0 3 416.550 4.449 20 0 HIADHN COc1cc(CN2CC[C@H](n3ncc4ccccc43)C2)ccc1OCc1ccncc1 ZINC000513416709 921785808 /nfs/dbraw/zinc/78/58/08/921785808.db2.gz WAQFRLPLZXALKX-QFIPXVFZSA-N 0 3 414.509 4.466 20 0 HIADHN CC(C)n1nc(-c2ccccc2)cc1NC(=O)N(CCN(C)C)Cc1ccccn1 ZINC000506862310 915648811 /nfs/dbraw/zinc/64/88/11/915648811.db2.gz GFKXZTSUQIEVFK-UHFFFAOYSA-N 0 3 406.534 4.122 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2ccc(F)cc2OCC(F)(F)F)N(C)C)cc1 ZINC000506899296 915696224 /nfs/dbraw/zinc/69/62/24/915696224.db2.gz OBEKJKQSUFWJRL-QGZVFWFLSA-N 0 3 413.415 4.500 20 0 HIADHN CC(C)N(CC(=O)Nc1cccc(CN2CCSCC2)c1)Cc1cccc(F)c1 ZINC000506944363 915749589 /nfs/dbraw/zinc/74/95/89/915749589.db2.gz CJXCMFRHGYTRSS-UHFFFAOYSA-N 0 3 415.578 4.224 20 0 HIADHN COC(=O)c1c(NC(=O)N(CCN(C)C)Cc2cccs2)sc2c1CCCC2 ZINC000506972417 915778345 /nfs/dbraw/zinc/77/83/45/915778345.db2.gz SIGCDDLGJZSUNO-UHFFFAOYSA-N 0 3 421.588 4.071 20 0 HIADHN CC1(C)CCc2cc(CN3CCC(C(=O)NCc4ccc(F)cc4)CC3)ccc2O1 ZINC000507012923 915821053 /nfs/dbraw/zinc/82/10/53/915821053.db2.gz MSAZNASVAOBLSO-UHFFFAOYSA-N 0 3 410.533 4.458 20 0 HIADHN CCCCNC(=O)C1CCN(Cc2ccc(OC)c(OCc3ccccc3)c2)CC1 ZINC000507013419 915822005 /nfs/dbraw/zinc/82/20/05/915822005.db2.gz PJELNAIHJXKNJF-UHFFFAOYSA-N 0 3 410.558 4.403 20 0 HIADHN O=C(NCCN1CCCCC1)[C@H](Oc1ccccc1Br)c1ccccc1 ZINC000507038059 915835709 /nfs/dbraw/zinc/83/57/09/915835709.db2.gz VLCURTACUOZAEB-HXUWFJFHSA-N 0 3 417.347 4.171 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2csc(-c3ncccc3F)n2)N2CCCC2)cc1 ZINC000507071850 915852578 /nfs/dbraw/zinc/85/25/78/915852578.db2.gz PDKKPDKHBMZLET-IBGZPJMESA-N 0 3 410.518 4.220 20 0 HIADHN O=C(COc1ccc(F)c(Cl)c1)N1CCCN(CCCc2ccccc2)CC1 ZINC000507112424 915875557 /nfs/dbraw/zinc/87/55/57/915875557.db2.gz NHWCAORCGAKLKZ-UHFFFAOYSA-N 0 3 404.913 4.025 20 0 HIADHN CC(C)C(=O)NC1CCN(Cc2ccc(-c3cccc(Br)c3)o2)CC1 ZINC000507115613 915876718 /nfs/dbraw/zinc/87/67/18/915876718.db2.gz KUPVHTIMYINFMF-UHFFFAOYSA-N 0 3 405.336 4.446 20 0 HIADHN COc1cc(C(=O)N2CCCN(CCCc3ccccc3)CC2)ccc1OC(F)F ZINC000507123455 915879482 /nfs/dbraw/zinc/87/94/82/915879482.db2.gz WDUXEPJJMPGMLD-UHFFFAOYSA-N 0 3 418.484 4.077 20 0 HIADHN O=C(N1CCCN(CCCc2ccccc2)CC1)C1(c2cccc(F)c2)CCOCC1 ZINC000507139813 915885854 /nfs/dbraw/zinc/88/58/54/915885854.db2.gz RCQLVCUHMWKREC-UHFFFAOYSA-N 0 3 424.560 4.041 20 0 HIADHN CC1=NN(c2ccc(C(=O)N3CCCN(CCCc4ccccc4)CC3)cc2)CC1 ZINC000507148785 915891896 /nfs/dbraw/zinc/89/18/96/915891896.db2.gz INPXJZDDSZAHSX-UHFFFAOYSA-N 0 3 404.558 4.053 20 0 HIADHN Cc1ccc(-c2cc(C(=O)N3CCCN(CCCc4ccccc4)CC3)[nH]n2)cc1 ZINC000507156427 915895682 /nfs/dbraw/zinc/89/56/82/915895682.db2.gz LJPMZNMUYMGPIL-UHFFFAOYSA-N 0 3 402.542 4.166 20 0 HIADHN Cc1ccc(CNC(=O)C2CCN(Cc3cnc(-c4ccncc4)s3)CC2)cc1F ZINC000507155837 915896189 /nfs/dbraw/zinc/89/61/89/915896189.db2.gz QWEBZDLGHOPAML-UHFFFAOYSA-N 0 3 424.545 4.181 20 0 HIADHN Cc1ccc(CNC(=O)C2CCN(Cc3c[nH]nc3-c3ccc(F)cc3)CC2)cc1F ZINC000507162842 915900163 /nfs/dbraw/zinc/90/01/63/915900163.db2.gz WMLLMUIOOLJVCD-UHFFFAOYSA-N 0 3 424.495 4.192 20 0 HIADHN Cc1cc(C(=O)N2CCCN(CCCc3ccccc3)CC2)c(C)n1-c1nccs1 ZINC000507164394 915903883 /nfs/dbraw/zinc/90/38/83/915903883.db2.gz YNGPXPJWJAHBIJ-UHFFFAOYSA-N 0 3 422.598 4.331 20 0 HIADHN CCNC(=O)COc1ccc(CN(C)[C@H](C)c2cccc(C(F)(F)F)c2)cc1OC ZINC000507214972 915965947 /nfs/dbraw/zinc/96/59/47/915965947.db2.gz RNIWTUFAGDBHII-OAHLLOKOSA-N 0 3 424.463 4.422 20 0 HIADHN CCCn1nccc1C1CCN(C(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)CC1 ZINC000507236569 915995126 /nfs/dbraw/zinc/99/51/26/915995126.db2.gz SJXOXQIUZTUEDC-XMMPIXPASA-N 0 3 423.605 4.328 20 0 HIADHN Cc1cc(NC(=O)[C@H](C)N[C@H](C)c2ccc3n[nH]cc3c2)ccc1Br ZINC000507243682 916004425 /nfs/dbraw/zinc/00/44/25/916004425.db2.gz NOZJDGXQRVKXEF-OLZOCXBDSA-N 0 3 401.308 4.312 20 0 HIADHN Cc1ccc(-n2ncc(C(=O)NCCN3CCCC[C@H]3C)c2C2CC2)cc1Cl ZINC000507337068 916093126 /nfs/dbraw/zinc/09/31/26/916093126.db2.gz BEPMZOULTXVYFZ-MRXNPFEDSA-N 0 3 400.954 4.316 20 0 HIADHN CC(C)c1c(C(=O)NCCN2CCCC[C@H]2C)cnn1-c1ccc(C(F)(F)F)cn1 ZINC000507337033 916093361 /nfs/dbraw/zinc/09/33/61/916093361.db2.gz AVHPIENZRVZLPP-OAHLLOKOSA-N 0 3 423.483 4.014 20 0 HIADHN COCCSc1ccc([C@H](C)N[C@@H](C)C(=O)N[C@H]2CCOc3ccccc32)cc1 ZINC000507449443 916219144 /nfs/dbraw/zinc/21/91/44/916219144.db2.gz HXNIWZPMBXYWEG-FIKGOQFSSA-N 0 3 414.571 4.104 20 0 HIADHN C[C@H](N[C@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1)[C@@H]1CCCOC1 ZINC000507498335 916263594 /nfs/dbraw/zinc/26/35/94/916263594.db2.gz VFDYARJXYRYPQV-RRMPHLOHSA-N 0 3 407.963 4.238 20 0 HIADHN COCCSc1ccc([C@@H](C)N[C@@H](C)C(=O)N(C)Cc2ccccc2C)cc1 ZINC000507567037 916321989 /nfs/dbraw/zinc/32/19/89/916321989.db2.gz MLZRSALVUFZWSC-MOPGFXCFSA-N 0 3 400.588 4.431 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)Cc2csc(Cc3ccccc3)n2)C1 ZINC000507578554 916332358 /nfs/dbraw/zinc/33/23/58/916332358.db2.gz GFOPGTYNMRGCFE-GHTZIAJQSA-N 0 3 405.567 4.228 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3cc(F)c(F)cc3F)c(OCC)c2)CC1 ZINC000507594296 916346887 /nfs/dbraw/zinc/34/68/87/916346887.db2.gz ZLWHYTNOTYHCFR-UHFFFAOYSA-N 0 3 421.463 4.287 20 0 HIADHN CCc1c(C(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)cnn1-c1ccc(F)cc1 ZINC000507598859 916352543 /nfs/dbraw/zinc/35/25/43/916352543.db2.gz ITUNRCVKEJECGT-YLJYHZDGSA-N 0 3 406.505 4.139 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3ccc4oc(C)nc4c3)c(OCC)c2)CC1 ZINC000507605388 916360821 /nfs/dbraw/zinc/36/08/21/916360821.db2.gz KEPLYSMXGUKHMW-UHFFFAOYSA-N 0 3 422.529 4.319 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3ccc(C4CC4)cn3)c(OCC)c2)CC1 ZINC000507608944 916366680 /nfs/dbraw/zinc/36/66/80/916366680.db2.gz BIGSPUZKRJNGBI-UHFFFAOYSA-N 0 3 408.546 4.142 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)c2nn(-c3ccccc3F)c3c2CCC3)C1 ZINC000507619334 916376963 /nfs/dbraw/zinc/37/69/63/916376963.db2.gz GLEVHMWRXLTTFX-IEBWSBKVSA-N 0 3 418.516 4.065 20 0 HIADHN Cc1noc([C@@H]2CCCN(C[C@@H](O)CO[C@H](c3ccccc3)c3ccccc3C)C2)n1 ZINC000507688168 916459052 /nfs/dbraw/zinc/45/90/52/916459052.db2.gz OXZUTCLQTXWTNJ-CQOQZXRMSA-N 0 3 421.541 4.033 20 0 HIADHN CSc1cccc(N(C(=O)c2ccc(N(C)C)cc2F)C2CCN(C)CC2)c1 ZINC000507692838 916467717 /nfs/dbraw/zinc/46/77/17/916467717.db2.gz IXPDUCCTAMJSST-UHFFFAOYSA-N 0 3 401.551 4.355 20 0 HIADHN C[C@H](OC[C@H](O)CN(Cc1ccccc1)C[C@H]1CCCO1)c1ccc(Cl)cc1 ZINC000507702020 916485277 /nfs/dbraw/zinc/48/52/77/916485277.db2.gz LVRJPJJJVIEVTO-CDNPAEQRSA-N 0 3 403.950 4.460 20 0 HIADHN CN(C)Cc1ccc(-c2noc(Cc3c(F)ccc(Br)c3F)n2)cc1 ZINC000507740077 916533066 /nfs/dbraw/zinc/53/30/66/916533066.db2.gz HXMWRFUIWILZOG-UHFFFAOYSA-N 0 3 408.246 4.430 20 0 HIADHN O=C(Nc1ccc(-n2ccnc2)c(F)c1)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000507749773 916539211 /nfs/dbraw/zinc/53/92/11/916539211.db2.gz TZTPOKZNRMWUFI-GOSISDBHSA-N 0 3 414.431 4.107 20 0 HIADHN CC[C@@H]1C[C@@H](C[N@H+](C)Cc2cccc([N-]S(=O)(=O)c3ccccc3)c2)CCO1 ZINC000507776619 916561517 /nfs/dbraw/zinc/56/15/17/916561517.db2.gz OCWCWTXLDXUVPG-PZJWPPBQSA-N 0 3 402.560 4.124 20 0 HIADHN CC[C@@H]1C[C@@H](C[N@@H+](C)Cc2cccc([N-]S(=O)(=O)c3ccccc3)c2)CCO1 ZINC000507776619 916561529 /nfs/dbraw/zinc/56/15/29/916561529.db2.gz OCWCWTXLDXUVPG-PZJWPPBQSA-N 0 3 402.560 4.124 20 0 HIADHN CN1C(=O)C[C@H](NCc2cccc(OCc3ccccn3)c2)[C@H]1c1ccc(Cl)cc1 ZINC000507818824 916613759 /nfs/dbraw/zinc/61/37/59/916613759.db2.gz JYBVIWGCHJLUDQ-LADGPHEKSA-N 0 3 421.928 4.376 20 0 HIADHN CCOc1ccc(Br)cc1CN(CCC(=O)Nc1cc(C)on1)C1CC1 ZINC000507847394 916663025 /nfs/dbraw/zinc/66/30/25/916663025.db2.gz NDIKCBPIMPREJE-UHFFFAOYSA-N 0 3 422.323 4.137 20 0 HIADHN O=C(CCN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1)Nc1cccc2ccccc21 ZINC000507878052 916718875 /nfs/dbraw/zinc/71/88/75/916718875.db2.gz XDYPDUNWVAUONE-FQEVSTJZSA-N 0 3 420.488 4.204 20 0 HIADHN Fc1ccc(-c2nnc3n2C[C@H](NCc2ccc(Br)cc2F)CC3)cc1 ZINC000507883456 916724910 /nfs/dbraw/zinc/72/49/10/916724910.db2.gz ZSCPBKKYFSZYFY-MRXNPFEDSA-N 0 3 419.273 4.090 20 0 HIADHN Cc1cccc(NC(=O)[C@H]2CCCN(Cc3cccc(OCc4ccccn4)c3)C2)n1 ZINC000508037758 916867713 /nfs/dbraw/zinc/86/77/13/916867713.db2.gz KNHQTMQTYISHNI-NRFANRHFSA-N 0 3 416.525 4.215 20 0 HIADHN COc1ccc(CN2CCC(C(=O)Nc3ccc(C)cn3)CC2)cc1OCC(C)C ZINC000508043194 916872458 /nfs/dbraw/zinc/87/24/58/916872458.db2.gz UBWIEYVIXOZRDI-UHFFFAOYSA-N 0 3 411.546 4.284 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2CNCCNC(=O)CC2CCCC2)o1 ZINC000508077348 916897797 /nfs/dbraw/zinc/89/77/97/916897797.db2.gz HUNYMRUUJCQTNY-UHFFFAOYSA-N 0 3 406.530 4.227 20 0 HIADHN Cn1c2ccc(CN3CCC[C@@H](c4nc(-c5ccc(Cl)cc5)no4)C3)cc2oc1=O ZINC000508160212 916981981 /nfs/dbraw/zinc/98/19/81/916981981.db2.gz JQWCXGITWZVNTH-MRXNPFEDSA-N 0 3 424.888 4.215 20 0 HIADHN COc1ccc(NC(=O)[C@H](C)N2[C@@H](C)CC[C@@H]2C)cc1NC(=O)c1cccc(F)c1 ZINC000508203202 917022352 /nfs/dbraw/zinc/02/23/52/917022352.db2.gz CCEVUVODXBAGJW-JYJNAYRXSA-N 0 3 413.493 4.286 20 0 HIADHN CCN(CCCN1CCCC1)C(=O)c1ccccc1C(=O)c1ccc(F)c(F)c1 ZINC000508202614 917022576 /nfs/dbraw/zinc/02/25/76/917022576.db2.gz DNQDBOQNGRRFEX-UHFFFAOYSA-N 0 3 400.469 4.144 20 0 HIADHN CCOc1cc(C[NH2+]CCn2c(C)nc3ccccc32)cc(Br)c1[O-] ZINC000508312786 917118829 /nfs/dbraw/zinc/11/88/29/917118829.db2.gz IJTRBXUSLMOFEW-UHFFFAOYSA-N 0 3 404.308 4.001 20 0 HIADHN Cc1cc(NC(=O)c2cccc(F)c2)sc1C(=O)N[C@H](C)CN1CCC[C@@H](C)C1 ZINC000508336982 917140844 /nfs/dbraw/zinc/14/08/44/917140844.db2.gz BNOREOJFFYDTPZ-GDBMZVCRSA-N 0 3 417.550 4.298 20 0 HIADHN COCCSc1ccc([C@@H](C)NC(=O)NC[C@H](c2ccccc2)N(C)C)cc1 ZINC000508547077 917325028 /nfs/dbraw/zinc/32/50/28/917325028.db2.gz AFROPYRXGNBXLT-DYESRHJHSA-N 0 3 401.576 4.088 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)c2cccc(C(=O)Nc3ccccc3)c2)o1 ZINC000508580867 917352023 /nfs/dbraw/zinc/35/20/23/917352023.db2.gz HDRVSWPSAAXMKR-UHFFFAOYSA-N 0 3 405.498 4.044 20 0 HIADHN O=C(N[C@H]1CCc2cc(F)ccc21)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000508605853 917374728 /nfs/dbraw/zinc/37/47/28/917374728.db2.gz WKKUFSUHFWVWEI-PZJWPPBQSA-N 0 3 406.423 4.384 20 0 HIADHN O=C(NCCCc1c[nH]c2ccc(F)cc12)N1CCCN(Cc2ccccc2)CC1 ZINC000508627750 917392770 /nfs/dbraw/zinc/39/27/70/917392770.db2.gz IHKFTBYKOOFGKL-UHFFFAOYSA-N 0 3 408.521 4.157 20 0 HIADHN CCCOc1c(Br)cc(CN(C)CCc2cnccn2)cc1OCC ZINC000508675392 917440145 /nfs/dbraw/zinc/44/01/45/917440145.db2.gz GFBJLBLWCPVHSU-UHFFFAOYSA-N 0 3 408.340 4.101 20 0 HIADHN O=S(=O)(NCC1CCN(Cc2cccs2)CC1)c1csc2ccccc21 ZINC000508725850 917488230 /nfs/dbraw/zinc/48/82/30/917488230.db2.gz OGHUEVDWECULMG-UHFFFAOYSA-N 0 3 406.598 4.153 20 0 HIADHN O=C(NCc1nc2ccccc2s1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000508768049 917522712 /nfs/dbraw/zinc/52/27/12/917522712.db2.gz FEYLLRKIXSXBCM-FQEVSTJZSA-N 0 3 419.472 4.367 20 0 HIADHN O=C(Nc1ccc(-n2ccnc2)cc1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000508807151 917560580 /nfs/dbraw/zinc/56/05/80/917560580.db2.gz BTVONZSLMFVSTD-NRFANRHFSA-N 0 3 414.431 4.265 20 0 HIADHN C[C@H](NC(=O)N(Cc1ccccc1)CC1CCOCC1)[C@@H](c1ccccc1)N(C)C ZINC000508852252 917606366 /nfs/dbraw/zinc/60/63/66/917606366.db2.gz JUDOEDWUMBCSQT-RDPSFJRHSA-N 0 3 409.574 4.316 20 0 HIADHN C[C@H](NC(=O)N1CCO[C@H](c2cccc(Cl)c2)C1)[C@@H](c1ccccc1)N(C)C ZINC000508878694 917632306 /nfs/dbraw/zinc/63/23/06/917632306.db2.gz IHNGJAICWGKSDX-NDXORKPFSA-N 0 3 401.938 4.114 20 0 HIADHN C[C@H](NC(=O)N1CCOC[C@@H]1c1nc2ccccc2s1)[C@@H](c1ccccc1)N(C)C ZINC000508898053 917653195 /nfs/dbraw/zinc/65/31/95/917653195.db2.gz ORENMOVVNDYGRX-SCWSEQNSSA-N 0 3 424.570 4.071 20 0 HIADHN Cc1nc2ccccc2n1C[C@@H]1CCCN1C(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C ZINC000508903796 917658848 /nfs/dbraw/zinc/65/88/48/917658848.db2.gz YDXLOFZHXYKRCR-NSXLHWASSA-N 0 3 419.573 4.210 20 0 HIADHN C[C@@H](NC(=O)Nc1ccc(C(=O)NC2CCCC2)cc1)[C@H](c1ccccc1)N(C)C ZINC000508904627 917659885 /nfs/dbraw/zinc/65/98/85/917659885.db2.gz IICBMQRMUALZOV-VGOFRKELSA-N 0 3 408.546 4.172 20 0 HIADHN Cc1nc2sccn2c(=O)c1CCN[C@H](C)c1cc(F)c(Cl)cc1Cl ZINC000509008270 917761288 /nfs/dbraw/zinc/76/12/88/917761288.db2.gz LXARVYPNJZUZOF-SECBINFHSA-N 0 3 400.306 4.404 20 0 HIADHN Cc1nc2sccn2c(=O)c1CCN[C@@H](C)c1cc(F)c(Cl)cc1Cl ZINC000509008271 917761899 /nfs/dbraw/zinc/76/18/99/917761899.db2.gz LXARVYPNJZUZOF-VIFPVBQESA-N 0 3 400.306 4.404 20 0 HIADHN Cc1ccc(S(=O)(=O)N[C@@H](CCN(C)[C@@H](C)c2ccccn2)c2ccccc2)cc1 ZINC000509020181 917775701 /nfs/dbraw/zinc/77/57/01/917775701.db2.gz CJJYWDLUMVMBCE-RDPSFJRHSA-N 0 3 423.582 4.493 20 0 HIADHN Fc1ccc([C@@H](NCCCN2CCN(c3ccccc3)CC2)c2ccccn2)cc1 ZINC000509023614 917776540 /nfs/dbraw/zinc/77/65/40/917776540.db2.gz RIFUEZAMLZBWNR-RUZDIDTESA-N 0 3 404.533 4.112 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1ccc([C@@H]2CCCOC2)cc1 ZINC000509023657 917777058 /nfs/dbraw/zinc/77/70/58/917777058.db2.gz OKPOLBKOCYVJIH-HSZRJFAPSA-N 0 3 408.542 4.037 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1ccc(NC(=O)[C@@H]2C[C@H]2C)cc1)c1cccc(OC)c1 ZINC000509111036 917849149 /nfs/dbraw/zinc/84/91/49/917849149.db2.gz GQICPRGVVDVYFQ-NLSFWIRASA-N 0 3 423.557 4.103 20 0 HIADHN O=C(Cc1ccc(Cl)s1)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000509182365 917892935 /nfs/dbraw/zinc/89/29/35/917892935.db2.gz DRKRNLPOZQMRSM-MRXNPFEDSA-N 0 3 400.935 4.226 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)N1CCO[C@H](c2ccccc2Cl)C1 ZINC000509367887 918031832 /nfs/dbraw/zinc/03/18/32/918031832.db2.gz XGQVKYXAGVLKLS-YADHBBJMSA-N 0 3 413.949 4.260 20 0 HIADHN O=C(Nc1ccc(Cl)cn1)[C@H]1CCCN(Cc2c[nH]nc2-c2cccs2)C1 ZINC000509371080 918036502 /nfs/dbraw/zinc/03/65/02/918036502.db2.gz JDGFPHCLAOMHTI-ZDUSSCGKSA-N 0 3 401.923 4.037 20 0 HIADHN COc1cccc(-c2nn(C(C)(C)C)cc2CN2CCC[C@H](c3nc(C)no3)C2)c1 ZINC000509372882 918037720 /nfs/dbraw/zinc/03/77/20/918037720.db2.gz NXZYVLNGUABQLU-SFHVURJKSA-N 0 3 409.534 4.385 20 0 HIADHN O=C(Nc1ccc(Cl)cn1)[C@H]1CCCN(Cc2c[nH]nc2-c2ccc(F)cc2)C1 ZINC000509378465 918044071 /nfs/dbraw/zinc/04/40/71/918044071.db2.gz KALWVNQKFFWJQL-HNNXBMFYSA-N 0 3 413.884 4.115 20 0 HIADHN O=C(Nc1ccc(Br)cn1)C1CCN(C/C=C\c2ccccc2)CC1 ZINC000509384930 918050361 /nfs/dbraw/zinc/05/03/61/918050361.db2.gz ILPXLEZOCOMOBG-DAXSKMNVSA-N 0 3 400.320 4.208 20 0 HIADHN O=C(Nc1ccc(Br)cn1)C1CCN(C/C=C/c2ccccc2)CC1 ZINC000509384932 918050444 /nfs/dbraw/zinc/05/04/44/918050444.db2.gz ILPXLEZOCOMOBG-QPJJXVBHSA-N 0 3 400.320 4.208 20 0 HIADHN CC(C)[C@@H](NCc1cnn([C@]2(C)CCS(=O)(=O)C2)c1)c1ccc(C(C)(C)C)cc1 ZINC000509404267 918068817 /nfs/dbraw/zinc/06/88/17/918068817.db2.gz PUAHBCDVGSDSDA-FYYLOGMGSA-N 0 3 417.619 4.201 20 0 HIADHN CC(C)[C@@H](NCc1cnn([C@@]2(C)CCS(=O)(=O)C2)c1)c1ccc(C(C)(C)C)cc1 ZINC000509404270 918069021 /nfs/dbraw/zinc/06/90/21/918069021.db2.gz PUAHBCDVGSDSDA-GGAORHGYSA-N 0 3 417.619 4.201 20 0 HIADHN COc1cc2c(cc1F)CC[C@@H]2NCc1cn(C)nc1-c1ccc2c(c1)OCCCO2 ZINC000509412106 918074238 /nfs/dbraw/zinc/07/42/38/918074238.db2.gz YTTYKIRRYJLUOV-FQEVSTJZSA-N 0 3 423.488 4.173 20 0 HIADHN CCN1CCN(CCNC(=O)c2c(Cl)cccc2Oc2ccccc2Cl)CC1 ZINC000509485457 918129981 /nfs/dbraw/zinc/12/99/81/918129981.db2.gz WAPRDJRRHFENHO-UHFFFAOYSA-N 0 3 422.356 4.153 20 0 HIADHN CCOc1ccc(CN2CCC(C(=O)Nc3cc(Cl)ccc3O)CC2)cc1OC ZINC000509521709 918170479 /nfs/dbraw/zinc/17/04/79/918170479.db2.gz AJHBABRWCLPIBX-UHFFFAOYSA-N 0 3 418.921 4.304 20 0 HIADHN CCCOc1ccc(CN2CCC(C(=O)Nc3ccccc3OC)CC2)cc1OC ZINC000509546955 918195889 /nfs/dbraw/zinc/19/58/89/918195889.db2.gz XJOIZCWLRVYBMH-UHFFFAOYSA-N 0 3 412.530 4.343 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N1CCC[C@@H]1c1ccc(OC)cc1OC)c1ccco1 ZINC000509551221 918200411 /nfs/dbraw/zinc/20/04/11/918200411.db2.gz ALVTUEAWPBYTGW-PWIZWCRZSA-N 0 3 415.534 4.273 20 0 HIADHN Cc1ccc(C)n1C1CCN(C(=O)[C@H]2CN(Cc3ccccc3)CCC2(F)F)CC1 ZINC000509550366 918201176 /nfs/dbraw/zinc/20/11/76/918201176.db2.gz VBEATIVBZYSUJY-JOCHJYFZSA-N 0 3 415.528 4.426 20 0 HIADHN COC(=O)CCn1nc(C)c(CN2CC=C(c3c[nH]c4cc(C)ccc43)CC2)c1C ZINC000509563242 918212246 /nfs/dbraw/zinc/21/22/46/918212246.db2.gz DZOZRNQIRZSLBJ-UHFFFAOYSA-N 0 3 406.530 4.142 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N1CCC[C@H]1c1cc(OC)ccc1OC)c1ccco1 ZINC000509566033 918216401 /nfs/dbraw/zinc/21/64/01/918216401.db2.gz CIBPUNKHQGFAPP-DBVUQKKJSA-N 0 3 415.534 4.273 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N(C)Cc1cccc(OC(F)(F)F)c1)c1ccco1 ZINC000509568068 918217310 /nfs/dbraw/zinc/21/73/10/918217310.db2.gz KSUQKRKJBLTEBZ-WMLDXEAASA-N 0 3 413.440 4.449 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N1CCC(c2c[nH]c3ncccc23)CC1)c1ccco1 ZINC000509568444 918218323 /nfs/dbraw/zinc/21/83/23/918218323.db2.gz LJYKROVZRDRMBY-JXFKEZNVSA-N 0 3 409.534 4.174 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N[C@H]1c2ccccc2CC[C@@H]1n1ccnc1)c1ccco1 ZINC000509569496 918219537 /nfs/dbraw/zinc/21/95/37/918219537.db2.gz NEHFWKYBBSQKIO-OOIKZJQMSA-N 0 3 421.545 4.133 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)N(Cc1ccc(F)cc1)C1CCOCC1)c1ccco1 ZINC000509574861 918225089 /nfs/dbraw/zinc/22/50/89/918225089.db2.gz UDWAVSPCXCEBSV-DYESRHJHSA-N 0 3 417.525 4.239 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)N(Cc1ccc(F)cc1)C1CCOCC1)c1ccco1 ZINC000509574865 918225451 /nfs/dbraw/zinc/22/54/51/918225451.db2.gz UDWAVSPCXCEBSV-UTKZUKDTSA-N 0 3 417.525 4.239 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N1CCC[C@@H]1c1ccc(OC)c(OC)c1)c1ccco1 ZINC000509576271 918225482 /nfs/dbraw/zinc/22/54/82/918225482.db2.gz DUEKSKZVACLMBM-QXAKKESOSA-N 0 3 415.534 4.273 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)N(C)Cc1ccc(SC)c(OC)c1)c1ccco1 ZINC000509593225 918242139 /nfs/dbraw/zinc/24/21/39/918242139.db2.gz CRGOERUUMJYHJQ-NVXWUHKLSA-N 0 3 405.564 4.281 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N[C@H](CO)c1c(Cl)cccc1Cl)c1ccco1 ZINC000509594335 918242223 /nfs/dbraw/zinc/24/22/23/918242223.db2.gz ZZYOPXALCFRSCQ-VBNZEHGJSA-N 0 3 414.333 4.048 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)N(C)Cc1cccc(Br)c1)c1ccco1 ZINC000509596591 918246211 /nfs/dbraw/zinc/24/62/11/918246211.db2.gz RZHYNYVHRCLURB-PBHICJAKSA-N 0 3 408.340 4.313 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N(C)Cc1ccc(OC(F)(F)F)cc1)c1ccco1 ZINC000509612407 918260569 /nfs/dbraw/zinc/26/05/69/918260569.db2.gz YGMVPHQNQSVUFN-WMLDXEAASA-N 0 3 413.440 4.449 20 0 HIADHN CC(C)[C@H](CNC(=O)CCCCc1ccc(Cl)c(Cl)c1)N1CCN(C)CC1 ZINC000509681912 918312914 /nfs/dbraw/zinc/31/29/14/918312914.db2.gz JQRDPFIDCZHDAV-FQEVSTJZSA-N 0 3 414.421 4.094 20 0 HIADHN CC(C)[C@@H](CNC(=O)CCCCc1ccc(Cl)c(Cl)c1)N1CCN(C)CC1 ZINC000509681915 918313205 /nfs/dbraw/zinc/31/32/05/918313205.db2.gz JQRDPFIDCZHDAV-HXUWFJFHSA-N 0 3 414.421 4.094 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)N[C@@H](C[C@H]1CCOC1)c1ccccc1 ZINC000509778069 918389363 /nfs/dbraw/zinc/38/93/63/918389363.db2.gz SMEVLDLJLXADGU-NHTMILBNSA-N 0 3 407.558 4.118 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CCO[C@@]2(CCc3ccccc32)C1)c1ccsc1 ZINC000509791054 918398508 /nfs/dbraw/zinc/39/85/08/918398508.db2.gz RWWTXIFAHJPDHU-GMAHTHKFSA-N 0 3 413.587 4.015 20 0 HIADHN Cn1c2ccc(CNCc3cn(Cc4ccccc4)nc3-c3ccccc3)cc2oc1=O ZINC000509809190 918413743 /nfs/dbraw/zinc/41/37/43/918413743.db2.gz SRMHROWNRXHTGA-UHFFFAOYSA-N 0 3 424.504 4.333 20 0 HIADHN O=C(N[C@@H]1C[C@@H]1c1ccccc1C(F)(F)F)N1CCCN(Cc2ccccc2)CC1 ZINC000509900126 918502862 /nfs/dbraw/zinc/50/28/62/918502862.db2.gz GHIXNQPNDZKWBI-TZIWHRDSSA-N 0 3 417.475 4.479 20 0 HIADHN O=C(N[C@H]1C[C@@H]1c1ccccc1C(F)(F)F)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000509906412 918508317 /nfs/dbraw/zinc/50/83/17/918508317.db2.gz YLJHXWAERJOCLV-POAQFYNOSA-N 0 3 403.448 4.135 20 0 HIADHN CC(C)Oc1ccccc1NC(=O)NCCCCN1CCN(Cc2ccccc2)CC1 ZINC000509919899 918520072 /nfs/dbraw/zinc/52/00/72/918520072.db2.gz OOGQMCDHBPCDNH-UHFFFAOYSA-N 0 3 424.589 4.193 20 0 HIADHN CC(C)CN(C(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1)C1CCN(C)CC1 ZINC000509922544 918523023 /nfs/dbraw/zinc/52/30/23/918523023.db2.gz DDZDPWLVIIVLJR-UHFFFAOYSA-N 0 3 417.557 4.127 20 0 HIADHN CCOc1cc(CN[C@H]2CCN(C(=O)Nc3ccccc3)C2)cc(Cl)c1OC ZINC000509989762 918576711 /nfs/dbraw/zinc/57/67/11/918576711.db2.gz IAMYNBWFJUDCQF-KRWDZBQOSA-N 0 3 403.910 4.143 20 0 HIADHN Cc1ccc(OCc2cccc(C(=O)NCCCN3CCc4ccccc4C3)c2)cn1 ZINC000510055975 918625856 /nfs/dbraw/zinc/62/58/56/918625856.db2.gz PQRMTHQQGDUDIY-UHFFFAOYSA-N 0 3 415.537 4.147 20 0 HIADHN CC[C@@H](NCC(=O)N1CCC(Cc2ccccc2)CC1)c1ccc(OC)c(OC)c1 ZINC000510243999 918780039 /nfs/dbraw/zinc/78/00/39/918780039.db2.gz QOKVIDWCLVSANZ-JOCHJYFZSA-N 0 3 410.558 4.226 20 0 HIADHN CC[C@@H](NCC(=O)N(C)[C@@H](C)c1ccc(F)c(F)c1)c1ccc(OC)c(OC)c1 ZINC000510244667 918781954 /nfs/dbraw/zinc/78/19/54/918781954.db2.gz VEMINAMPGYHFFU-IFXJQAMLSA-N 0 3 406.473 4.242 20 0 HIADHN O=C(NCCCCN1CCN(Cc2ccccc2)CC1)Nc1ccc2ncsc2c1 ZINC000510259369 918791983 /nfs/dbraw/zinc/79/19/83/918791983.db2.gz PKEIRJPNKLTSFB-UHFFFAOYSA-N 0 3 423.586 4.016 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCC(=O)Nc1cccc2ccccc21)c1ccsc1 ZINC000510260113 918792187 /nfs/dbraw/zinc/79/21/87/918792187.db2.gz ULVLYBFUDGLNTJ-NRFANRHFSA-N 0 3 424.570 4.222 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)Nc1ccc2c(c1)COC2 ZINC000510299388 918815816 /nfs/dbraw/zinc/81/58/16/918815816.db2.gz TXWIGHVEXJRFRX-UHFFFAOYSA-N 0 3 407.436 4.331 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)NCc1cccc(NC(=O)C2CCC2)c1 ZINC000510323889 918830978 /nfs/dbraw/zinc/83/09/78/918830978.db2.gz OHBIRKWKAJFVQP-UHFFFAOYSA-N 0 3 405.498 4.163 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N(C)Cc3ccccc3C(F)(F)F)cc2)CC1 ZINC000510332279 918836654 /nfs/dbraw/zinc/83/66/54/918836654.db2.gz IQSYARILOHUYTO-UHFFFAOYSA-N 0 3 405.464 4.120 20 0 HIADHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)Nc1ccc(F)c(F)c1 ZINC000510352164 918848064 /nfs/dbraw/zinc/84/80/64/918848064.db2.gz SSRQMNOPLXBLBU-UHFFFAOYSA-N 0 3 412.278 4.323 20 0 HIADHN CC1CCN(C(=O)C2CCN(Cc3cccc(OCc4ccccn4)c3)CC2)CC1 ZINC000510386421 918866934 /nfs/dbraw/zinc/86/69/34/918866934.db2.gz LZHIHNATEZOYJN-UHFFFAOYSA-N 0 3 407.558 4.131 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N[C@H](C)c3ccc(Br)cc3)cc2)CC1 ZINC000510399548 918873907 /nfs/dbraw/zinc/87/39/07/918873907.db2.gz ROUOBLOOXQNHPP-MRXNPFEDSA-N 0 3 416.363 4.082 20 0 HIADHN CC1CCN(C(=O)C2CCN(Cc3ccc(OCc4cccnc4)cc3)CC2)CC1 ZINC000510420315 918887601 /nfs/dbraw/zinc/88/76/01/918887601.db2.gz DCIJWTSNLZGOAE-UHFFFAOYSA-N 0 3 407.558 4.131 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)Nc1ccc(-c2n[nH]c(C3CC3)n2)cc1 ZINC000510436039 918895909 /nfs/dbraw/zinc/89/59/09/918895909.db2.gz XYPCSZSLPJCPNP-UHFFFAOYSA-N 0 3 401.470 4.409 20 0 HIADHN COCc1cccc(NC(=O)N(CCN(C)C)Cc2ccc(Br)cc2)c1 ZINC000510447577 918904980 /nfs/dbraw/zinc/90/49/80/918904980.db2.gz XTDXATZNKDEZKE-UHFFFAOYSA-N 0 3 420.351 4.191 20 0 HIADHN CCN(Cc1ccc(OCC(=O)N2CCCC2)c(OC)c1)[C@H](C)c1ccc(F)cc1 ZINC000510461434 918915393 /nfs/dbraw/zinc/91/53/93/918915393.db2.gz ZVYAGUHYRNVNCG-GOSISDBHSA-N 0 3 414.521 4.419 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)NCCOc1ccc(C(F)(F)F)cc1 ZINC000510469171 918924772 /nfs/dbraw/zinc/92/47/72/918924772.db2.gz CNEFHSVYHOLNRP-UHFFFAOYSA-N 0 3 406.404 4.322 20 0 HIADHN C[C@@H](NC(=O)N[C@@H](c1ccc(Br)cc1)C1CCC1)C1=CCN(C)CC1 ZINC000510518754 918964907 /nfs/dbraw/zinc/96/49/07/918964907.db2.gz BIUHDRHOJQDDNW-AUUYWEPGSA-N 0 3 406.368 4.240 20 0 HIADHN COc1ccc([C@@H](Cc2ccc(F)cc2)NC(=O)N[C@@H](C)C2=CCN(C)CC2)cc1 ZINC000510525999 918971215 /nfs/dbraw/zinc/97/12/15/918971215.db2.gz OJWCQSUMVRTKRC-GAJHUEQPSA-N 0 3 411.521 4.068 20 0 HIADHN COc1cc([C@@H](C)NC(=O)N[C@@H](C)C2=CCN(C)CC2)ccc1OCCC(C)C ZINC000510528532 918974306 /nfs/dbraw/zinc/97/43/06/918974306.db2.gz XJTNKGUJHZDEQS-ZWKOTPCHSA-N 0 3 403.567 4.131 20 0 HIADHN COc1cc([C@H](C)NC(=O)N[C@H](C)C2=CCN(C)CC2)ccc1OCc1ccccc1 ZINC000510541906 918986564 /nfs/dbraw/zinc/98/65/64/918986564.db2.gz VPNPMZNLVMLRDA-MOPGFXCFSA-N 0 3 423.557 4.285 20 0 HIADHN Cc1n[nH]c(C)c1[C@@H]1CCCCCN1C(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000510546730 918991039 /nfs/dbraw/zinc/99/10/39/918991039.db2.gz NOKQPAAWECJZDQ-BVSLBCMMSA-N 0 3 409.578 4.489 20 0 HIADHN COc1cc(CN2CCC(N3CCO[C@H](C)C3)CC2)ccc1OCc1cccs1 ZINC000510557769 919001158 /nfs/dbraw/zinc/00/11/58/919001158.db2.gz GIENJZAKYFKWHB-GOSISDBHSA-N 0 3 416.587 4.021 20 0 HIADHN C[C@@H](NC(=O)NCCSCc1ccc(Cl)cc1Cl)C1=CCN(C)CC1 ZINC000510582046 919024658 /nfs/dbraw/zinc/02/46/58/919024658.db2.gz UVYHIBMAZNYXDY-CYBMUJFWSA-N 0 3 402.391 4.176 20 0 HIADHN CCOC(=O)c1cnn(C2CCN(Cc3ccc(Cl)c4cccnc34)CC2)c1C ZINC000510635098 919076252 /nfs/dbraw/zinc/07/62/52/919076252.db2.gz WUZRCTIXELYBGS-UHFFFAOYSA-N 0 3 412.921 4.407 20 0 HIADHN CN(Cc1ccc(F)c2cccnc12)C[C@@H](O)COc1ccccc1C(F)(F)F ZINC000510651919 919093658 /nfs/dbraw/zinc/09/36/58/919093658.db2.gz UBFIVNGGNLFUNI-OAHLLOKOSA-N 0 3 408.395 4.264 20 0 HIADHN O=C(Nc1cccc(CN[C@@H]2CCc3ccc(Br)cc32)c1)[C@@H]1CCCO1 ZINC000510656075 919098153 /nfs/dbraw/zinc/09/81/53/919098153.db2.gz KNFOBDUPXWKNDG-UXHICEINSA-N 0 3 415.331 4.344 20 0 HIADHN CC(C)n1c2ccccc2nc1[C@@H]1CCCN(Cc2cc(=O)n3ccccc3n2)C1 ZINC000510659002 919099019 /nfs/dbraw/zinc/09/90/19/919099019.db2.gz PDGHNQMCDOPLPF-GOSISDBHSA-N 0 3 401.514 4.005 20 0 HIADHN C[C@H](N[C@H]1CCc2ccc(Br)cc21)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000510693372 919130510 /nfs/dbraw/zinc/13/05/10/919130510.db2.gz ANWWCWPQYUGWME-DJJJIMSYSA-N 0 3 423.376 4.038 20 0 HIADHN COc1ccc([C@H](NCC(=O)N(C)Cc2ccc(OC(F)F)cc2)C(C)C)cc1 ZINC000510748559 919200087 /nfs/dbraw/zinc/20/00/87/919200087.db2.gz QCBSJNCCVHNHMX-OAQYLSRUSA-N 0 3 406.473 4.242 20 0 HIADHN CC(C)S(=O)(=O)Cc1cccc(NC(=O)c2oc3ccccc3c2CN(C)C)c1 ZINC000510766603 919221780 /nfs/dbraw/zinc/22/17/80/919221780.db2.gz LLUBQYXAZJULQK-UHFFFAOYSA-N 0 3 414.527 4.070 20 0 HIADHN Cc1ccc(-n2ccnc2)c(C(=O)Nc2ccc(CCN3CCSCC3)cc2)c1 ZINC000510783929 919246350 /nfs/dbraw/zinc/24/63/50/919246350.db2.gz ZWPIXQBDQGQLGI-UHFFFAOYSA-N 0 3 406.555 4.024 20 0 HIADHN C[C@@H](C(=O)Nc1ccc(CC(=O)N2CCCc3ccccc32)cc1)N1CCCCCC1 ZINC000510800646 919272312 /nfs/dbraw/zinc/27/23/12/919272312.db2.gz QQPSXSOVUQYFJJ-FQEVSTJZSA-N 0 3 419.569 4.412 20 0 HIADHN Cc1cc(NC(=O)CCN2CCC[C@@H](Cc3nc(C4CCCCCC4)no3)C2)no1 ZINC000510806121 919279920 /nfs/dbraw/zinc/27/99/20/919279920.db2.gz GHSIGWYZDQKRCW-KRWDZBQOSA-N 0 3 415.538 4.087 20 0 HIADHN C[NH+](C)Cc1c2ccccc2oc1C(=O)[N-]c1nnc(Cc2cccc(F)c2)s1 ZINC000510892986 919389363 /nfs/dbraw/zinc/38/93/63/919389363.db2.gz JINUWADQYNQYJR-UHFFFAOYSA-N 0 3 410.474 4.328 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)N1CC[C@H](C(F)(F)F)C2(CCC2)C1 ZINC000510918004 919429363 /nfs/dbraw/zinc/42/93/63/919429363.db2.gz XTUGRRYDIVBQMQ-IBGZPJMESA-N 0 3 409.496 4.199 20 0 HIADHN Cc1nc(C(C)(C)C)sc1[C@@H](C)N[C@@H]1CCN(C(=O)COc2ccccc2)C1 ZINC000510958845 919495868 /nfs/dbraw/zinc/49/58/68/919495868.db2.gz DOSXQJNOJCWUGE-NVXWUHKLSA-N 0 3 401.576 4.080 20 0 HIADHN O=C(Nc1ccccc1)N1CC[C@H](N[C@H]2CCCc3nn(-c4ccccc4)cc32)C1 ZINC000510987537 919542704 /nfs/dbraw/zinc/54/27/04/919542704.db2.gz SGMVHJJAZCXDGE-UGKGYDQZSA-N 0 3 401.514 4.146 20 0 HIADHN COc1cc(OC)c([C@H](C)N[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)cc1Cl ZINC000511008281 919567418 /nfs/dbraw/zinc/56/74/18/919567418.db2.gz ANPMAVFWZPWLKL-FUHWJXTLSA-N 0 3 416.949 4.242 20 0 HIADHN CC[C@@H](N[C@H]1CCN(C(=O)COc2ccccc2)C1)c1ccccc1OC(F)F ZINC000511016410 919584401 /nfs/dbraw/zinc/58/44/01/919584401.db2.gz PCWDIGFCUTWQAM-QFBILLFUSA-N 0 3 404.457 4.009 20 0 HIADHN O=C(Nc1ccccc1)N1CC[C@@H](N[C@H]2CCCc3ncc(C(F)(F)F)cc32)C1 ZINC000511035186 919618364 /nfs/dbraw/zinc/61/83/64/919618364.db2.gz SRMSNBYAMRCUCE-APWZRJJASA-N 0 3 404.436 4.374 20 0 HIADHN C[C@@H](N[C@@H]1CCCN(C(=O)Cc2ccccc2)C1)c1ccc(F)cc1OC(F)F ZINC000511052978 919647355 /nfs/dbraw/zinc/64/73/55/919647355.db2.gz DBILWMCVRAHTHB-CRAIPNDOSA-N 0 3 406.448 4.311 20 0 HIADHN C[C@@H]1CN(c2ccccc2NC(=O)N2CCCN(Cc3ccccc3)CC2)C[C@@H](C)O1 ZINC000511054690 919650653 /nfs/dbraw/zinc/65/06/53/919650653.db2.gz PKLXLIIQIPVXBD-NHCUHLMSSA-N 0 3 422.573 4.040 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)c1ccc(OCc2ccccc2)nc1 ZINC000511074673 919674835 /nfs/dbraw/zinc/67/48/35/919674835.db2.gz FAUSXYGCNGSUFE-QHCPKHFHSA-N 0 3 401.510 4.228 20 0 HIADHN C[C@@H]1CN(c2ccccc2NC(=O)NC[C@@H](c2ccccc2)N2CCCC2)C[C@@H](C)O1 ZINC000511086941 919689161 /nfs/dbraw/zinc/68/91/61/919689161.db2.gz VULLMWKKUSDHML-REHUZNOOSA-N 0 3 422.573 4.259 20 0 HIADHN CCc1ccc([C@H](CNC(=O)c2cc(C)nc3c2cnn3[C@@H](C)CC)N(C)C)cc1 ZINC000511091471 919695112 /nfs/dbraw/zinc/69/51/12/919695112.db2.gz PWWFVAGWSBPKKW-JTSKRJEESA-N 0 3 407.562 4.306 20 0 HIADHN O=C(N[C@H](c1ccccc1)c1cccnc1)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000511146780 919765140 /nfs/dbraw/zinc/76/51/40/919765140.db2.gz QOAWMDWOJHWNGP-XZOQPEGZSA-N 0 3 421.491 4.445 20 0 HIADHN Cc1ccc(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2)c(Br)c1 ZINC000511191323 919808988 /nfs/dbraw/zinc/80/89/88/919808988.db2.gz QSXGNGHFJABGFE-UHFFFAOYSA-N 0 3 408.315 4.492 20 0 HIADHN CCCOc1ccc(CN(CCC)C(=O)N[C@@H](C)C2=CCN(C)CC2)cc1OC ZINC000511217073 919827487 /nfs/dbraw/zinc/82/74/87/919827487.db2.gz NWGNHMVUTFFGFT-SFHVURJKSA-N 0 3 403.567 4.056 20 0 HIADHN CC[C@@H](NC1CCC(NC(=O)COc2ccc(Cl)cc2)CC1)c1nccs1 ZINC000511218463 919828861 /nfs/dbraw/zinc/82/88/61/919828861.db2.gz UVXBUPORVKCHDA-LEOMRAHMSA-N 0 3 407.967 4.344 20 0 HIADHN C[C@H](NC(=O)N1CCc2ccccc2[C@@H](c2ccccc2)[C@H]1C)C1=CCN(C)CC1 ZINC000511232290 919835898 /nfs/dbraw/zinc/83/58/98/919835898.db2.gz JZLHQIJKAGAXFX-WZOHSFFVSA-N 0 3 403.570 4.425 20 0 HIADHN COc1cccc([C@@H](NC(=O)N[C@@H](C)C2=CCN(C)CC2)c2ccccc2Cl)c1 ZINC000511231843 919836264 /nfs/dbraw/zinc/83/62/64/919836264.db2.gz IWZWBTSZLAZUQY-KSFYIVLOSA-N 0 3 413.949 4.388 20 0 HIADHN COc1ccc2c(c1)CN(C(=O)N[C@@H](C)C1=CCN(C)CC1)[C@H](C1CCCCC1)C2 ZINC000511249824 919850530 /nfs/dbraw/zinc/85/05/30/919850530.db2.gz PLMXLFFHVFLQDH-UUOWRZLLSA-N 0 3 411.590 4.362 20 0 HIADHN COc1ccc2c(c1)CN(C(=O)N[C@H](C)C1=CCN(C)CC1)[C@@H](c1ccccc1)C2 ZINC000511296767 919893067 /nfs/dbraw/zinc/89/30/67/919893067.db2.gz ZHPHMEVOQDRLLL-HOYKHHGWSA-N 0 3 405.542 4.155 20 0 HIADHN C[C@@H]1CCCCN1C(=O)c1ccc(NC(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000511298830 919895020 /nfs/dbraw/zinc/89/50/20/919895020.db2.gz WQOPMELHXNOLMS-XXBNENTESA-N 0 3 420.557 4.097 20 0 HIADHN Cc1nc(COc2cccc(C(=O)N(CCN(C)C)C3CCCCC3)c2)cs1 ZINC000511344550 919937012 /nfs/dbraw/zinc/93/70/12/919937012.db2.gz WXTYJZXIFDXCOF-UHFFFAOYSA-N 0 3 401.576 4.367 20 0 HIADHN Cc1ccc(-c2cc(C(=O)N[C@H](C)C3=CCN(C)CC3)c3cnn(C(C)C)c3n2)cc1 ZINC000511370738 919963204 /nfs/dbraw/zinc/96/32/04/919963204.db2.gz VAPDHGQVMSZCJQ-GOSISDBHSA-N 0 3 417.557 4.368 20 0 HIADHN CC(C)[C@@H](NC1CCC(C(=O)OC(C)(C)C)CC1)c1nc(-c2cccnc2)no1 ZINC000511375363 919972921 /nfs/dbraw/zinc/97/29/21/919972921.db2.gz DKKNOARUIHRXGA-VMWRSERWSA-N 0 3 400.523 4.319 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Cc3cc4c(ccc5ccccc45)o3)CC2)C[C@H](C)O1 ZINC000511479319 920090363 /nfs/dbraw/zinc/09/03/63/920090363.db2.gz AQTIPJNCCMCSOM-KDURUIRLSA-N 0 3 420.553 4.476 20 0 HIADHN COc1ccc(CN2CCCN(c3ccccc3)CC2)cc1OCc1cccnc1 ZINC000511506199 920120977 /nfs/dbraw/zinc/12/09/77/920120977.db2.gz QAMQNBXUDQAZHL-UHFFFAOYSA-N 0 3 403.526 4.382 20 0 HIADHN CN(C)[C@H](CNC(=O)C1CCC(NC(=O)CC2CCCCC2)CC1)c1ccccc1 ZINC000511577983 920223219 /nfs/dbraw/zinc/22/32/19/920223219.db2.gz GJEOWFOBQQJKEI-XPPIMPSXSA-N 0 3 413.606 4.051 20 0 HIADHN CN(C)[C@@H](CNC(=O)Nc1cccc(C(=O)N(C)c2ccccc2)c1)c1ccccc1 ZINC000511620366 920275672 /nfs/dbraw/zinc/27/56/72/920275672.db2.gz NGBJIPRGOUIGFH-QHCPKHFHSA-N 0 3 416.525 4.388 20 0 HIADHN CC(C)n1nccc1NC(=O)[C@@H](C)N[C@H](c1cccc(OC(F)(F)F)c1)C1CC1 ZINC000511623240 920279175 /nfs/dbraw/zinc/27/91/75/920279175.db2.gz NDLLJNVNMMLZSK-ACJLOTCBSA-N 0 3 410.440 4.431 20 0 HIADHN CCOc1cc2c(cc1OCC)CN(C(=O)[C@H]1CCCN1Cc1ccccc1)CC2 ZINC000511639432 920302164 /nfs/dbraw/zinc/30/21/64/920302164.db2.gz GFRFABCKCXRYHW-JOCHJYFZSA-N 0 3 408.542 4.033 20 0 HIADHN c1[nH]nc(-c2ccc3c(c2)OCCO3)c1CN(Cc1ccccc1)C[C@H]1CCCO1 ZINC000511666673 920331728 /nfs/dbraw/zinc/33/17/28/920331728.db2.gz MTVFOIDAKWBNNJ-OAQYLSRUSA-N 0 3 405.498 4.029 20 0 HIADHN O=C(CN1C[C@H](c2ccccc2)[C@@H]2COCC[C@@H]21)Nc1ccc(OC(F)(F)F)cc1 ZINC000511766915 920451870 /nfs/dbraw/zinc/45/18/70/920451870.db2.gz ASKVGEAOKSACNN-AABGKKOBSA-N 0 3 420.431 4.028 20 0 HIADHN Cc1c(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2c2ccccc2)sc2nccn12 ZINC000511767218 920453976 /nfs/dbraw/zinc/45/39/76/920453976.db2.gz BXBDSSJMMTZDLQ-LEWJYISDSA-N 0 3 416.550 4.102 20 0 HIADHN OC[C@H](CNCc1cscc1Br)Cc1cccc(Br)c1 ZINC000511785920 920479074 /nfs/dbraw/zinc/47/90/74/920479074.db2.gz LKLHOEGWYWIXHE-LBPRGKRZSA-N 0 3 419.182 4.214 20 0 HIADHN CCn1cccc(CN[C@@H](C)CC(=O)Nc2cc(C(F)(F)F)ccc2Cl)c1=O ZINC000511791115 920483825 /nfs/dbraw/zinc/48/38/25/920483825.db2.gz JIHLSSOGOINUNB-LBPRGKRZSA-N 0 3 415.843 4.047 20 0 HIADHN C[C@@H]1CCN(C(=O)CN2C[C@H](c3ccccc3)[C@@H]3COCC[C@@H]32)c2ccccc2S1 ZINC000511794269 920488208 /nfs/dbraw/zinc/48/82/08/920488208.db2.gz SKFORIQOPRNVCM-YJMBLLCNSA-N 0 3 422.594 4.408 20 0 HIADHN CCCN(CC)C(=O)c1ccc(C(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)cc1 ZINC000511828904 920530121 /nfs/dbraw/zinc/53/01/21/920530121.db2.gz GYVDQNPIQQAWRP-CVDCTZTESA-N 0 3 407.558 4.124 20 0 HIADHN CCCN(C(=O)c1cccc(C(=O)N(C)CC)c1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000511870522 920599535 /nfs/dbraw/zinc/59/95/35/920599535.db2.gz FKADPHUZIUSJSX-XMMPIXPASA-N 0 3 421.585 4.295 20 0 HIADHN CC1=C(c2ccco2)CN(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)CC1 ZINC000511947880 920703477 /nfs/dbraw/zinc/70/34/77/920703477.db2.gz QZXZBHXVCYZZPA-UHFFFAOYSA-N 0 3 411.468 4.274 20 0 HIADHN Cc1nscc1C(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1 ZINC000512002306 920771401 /nfs/dbraw/zinc/77/14/01/920771401.db2.gz OCGQJXFHWLVLND-UHFFFAOYSA-N 0 3 406.555 4.069 20 0 HIADHN C[C@H](CNCc1ncc(CN(C)C)s1)Sc1ccc(Br)cc1 ZINC000512010606 920781786 /nfs/dbraw/zinc/78/17/86/920781786.db2.gz SQYIGYUCUSTSFG-GFCCVEGCSA-N 0 3 400.411 4.238 20 0 HIADHN C[C@H](CC(=O)Nc1cc(C(F)(F)F)ccc1Cl)N[C@@H](CO)c1ccccc1 ZINC000512031188 920803370 /nfs/dbraw/zinc/80/33/70/920803370.db2.gz OBIYIMUVRZTTHR-PXAZEXFGSA-N 0 3 400.828 4.399 20 0 HIADHN O=C(NCc1ccncc1)Nc1cccc(CNC/C=C\c2ccc(F)c(F)c2)c1 ZINC000512047415 920817799 /nfs/dbraw/zinc/81/77/99/920817799.db2.gz ZXGSQQXQBKPCFH-RQOWECAXSA-N 0 3 408.452 4.485 20 0 HIADHN CO[C@@H]1C[C@@H](c2ccccc2)CC[C@@H]1NC(=O)N(CCN(C)C)Cc1ccc(C)o1 ZINC000512065298 920832748 /nfs/dbraw/zinc/83/27/48/920832748.db2.gz XFLSVLQHJJUBSI-ACIOBRDBSA-N 0 3 413.562 4.013 20 0 HIADHN OC[C@H](CNCc1cscc1Br)Cc1ccc(C(F)(F)F)cc1 ZINC000512068782 920836129 /nfs/dbraw/zinc/83/61/29/920836129.db2.gz SJPWFNIZKYPKBD-LBPRGKRZSA-N 0 3 408.283 4.470 20 0 HIADHN C[C@@H](CC(=O)Nc1cc(C(F)(F)F)ccc1Cl)NCc1cccnc1N(C)C ZINC000512100244 920860662 /nfs/dbraw/zinc/86/06/62/920860662.db2.gz RLSAWUGCZWTBND-LBPRGKRZSA-N 0 3 414.859 4.327 20 0 HIADHN COc1ccc2c(c1)c(C(=O)N[C@@H](C)C1=CCN(C)CC1)c(C)n2Cc1ccccc1 ZINC000512142829 920887672 /nfs/dbraw/zinc/88/76/72/920887672.db2.gz NZGYIIAQYNKPRM-SFHVURJKSA-N 0 3 417.553 4.387 20 0 HIADHN OCC[C@H](NC[C@H](O)COc1ccccc1Cl)c1ccc(Cl)c(Cl)c1 ZINC000512202460 920948602 /nfs/dbraw/zinc/94/86/02/920948602.db2.gz KMZLXRXMLWRVIZ-GUYCJALGSA-N 0 3 404.721 4.100 20 0 HIADHN FC(F)(F)Oc1cccc(N2CC[C@H](NCc3cnn(-c4ccccc4)c3)C2)c1 ZINC000512232986 920986196 /nfs/dbraw/zinc/98/61/96/920986196.db2.gz FXGUSRKADDDVKN-KRWDZBQOSA-N 0 3 402.420 4.139 20 0 HIADHN CCC[C@]1(NCC(=O)N2N=C(c3cccs3)C[C@H]2c2cccs2)CCOC1 ZINC000512237669 920991721 /nfs/dbraw/zinc/99/17/21/920991721.db2.gz UWMBQRDDHIEXPQ-JXFKEZNVSA-N 0 3 403.573 4.036 20 0 HIADHN O=C(N[C@H](C[C@@H]1CCOC1)c1ccccc1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000512250150 921008528 /nfs/dbraw/zinc/00/85/28/921008528.db2.gz OOXJOBMFCPOLFU-ODGPQVTHSA-N 0 3 410.533 4.322 20 0 HIADHN COCCN1CCC(NC(=O)c2cccc(Oc3ccc(Cl)c(Cl)c3)n2)CC1 ZINC000512250320 921008943 /nfs/dbraw/zinc/00/89/43/921008943.db2.gz BCLKLOXLUXDVGJ-UHFFFAOYSA-N 0 3 424.328 4.021 20 0 HIADHN CCC(C)(C)N(C)CC(=O)Nc1cc(OC)c(NC(=O)c2ccccc2)cc1OC ZINC000512272920 921026774 /nfs/dbraw/zinc/02/67/74/921026774.db2.gz WGQSQCYMGBMDEL-UHFFFAOYSA-N 0 3 413.518 4.015 20 0 HIADHN O=c1[n-]c(CN2CC[C@@]3(CC[N@H+](Cc4ccccc4)C3)C2)nc2c3ccccc3oc21 ZINC000512292921 921048072 /nfs/dbraw/zinc/04/80/72/921048072.db2.gz QYPJOYJMAFQCSI-RUZDIDTESA-N 0 3 414.509 4.180 20 0 HIADHN O=c1[n-]c(CN2CC[C@@]3(CC[N@@H+](Cc4ccccc4)C3)C2)nc2c3ccccc3oc21 ZINC000512292921 921048083 /nfs/dbraw/zinc/04/80/83/921048083.db2.gz QYPJOYJMAFQCSI-RUZDIDTESA-N 0 3 414.509 4.180 20 0 HIADHN CCC[C@@]1(NCC(=O)N2N=C(c3cc4ccccc4o3)C[C@@H]2c2ccco2)CCOC1 ZINC000512292968 921048878 /nfs/dbraw/zinc/04/88/78/921048878.db2.gz RGWXXCDLPGUOLY-NTKDMRAZSA-N 0 3 421.497 4.252 20 0 HIADHN CS(=O)(=O)CC1(CN[C@@H](c2ccccc2)c2ccc(Br)cc2)CCC1 ZINC000512307397 921061069 /nfs/dbraw/zinc/06/10/69/921061069.db2.gz CAUCZPKASWJWAH-IBGZPJMESA-N 0 3 422.388 4.343 20 0 HIADHN C[C@@H](C(=O)Nc1ccc(CC(=O)N2CCCc3ccccc32)cc1)N1[C@H](C)CC[C@H]1C ZINC000512349583 921094223 /nfs/dbraw/zinc/09/42/23/921094223.db2.gz YBCVWHGHHPZNFN-AQNXPRMDSA-N 0 3 419.569 4.408 20 0 HIADHN O=C(NCCc1cccs1)C1CCN(Cc2cnc(-c3ccccc3)s2)CC1 ZINC000512350184 921096108 /nfs/dbraw/zinc/09/61/08/921096108.db2.gz IXYCNCZMMANFRY-UHFFFAOYSA-N 0 3 411.596 4.443 20 0 HIADHN Cc1nn(-c2ccc(Br)cc2)cc1CN1CCC(c2ncc[nH]2)CC1 ZINC000512365499 921106725 /nfs/dbraw/zinc/10/67/25/921106725.db2.gz ZOPQDSYJVWXYJS-UHFFFAOYSA-N 0 3 400.324 4.046 20 0 HIADHN Fc1cccc(Cl)c1COc1ccc(CN2CCC[C@H](n3cncn3)C2)cc1 ZINC000513484381 921839737 /nfs/dbraw/zinc/83/97/37/921839737.db2.gz JUFQGWCQAZIROZ-KRWDZBQOSA-N 0 3 400.885 4.487 20 0 HIADHN O=C1COc2ccc(CN3CCC(c4cccc(Br)c4)CC3)cc2N1 ZINC000513485443 921839971 /nfs/dbraw/zinc/83/99/71/921839971.db2.gz QJKTWYRTRGYLDO-UHFFFAOYSA-N 0 3 401.304 4.160 20 0 HIADHN CCCCCOc1ccc(CN[C@@H](C)c2ccc(S(=O)(=O)N(C)C)cc2)cc1 ZINC000513622108 921951305 /nfs/dbraw/zinc/95/13/05/921951305.db2.gz MIGIOJGKZSPCGQ-SFHVURJKSA-N 0 3 404.576 4.357 20 0 HIADHN C[C@H](CN1CCCC1=O)NCc1cccc(NC(=O)c2ccc(Cl)cc2Cl)c1 ZINC000513642021 921964958 /nfs/dbraw/zinc/96/49/58/921964958.db2.gz CQFKGKMXPOGZJO-CQSZACIVSA-N 0 3 420.340 4.346 20 0 HIADHN Cc1ccc(-n2cc(CN3CCC[C@@H](c4nnc5n4CCC5)C3)c(C(C)(C)C)n2)cc1 ZINC000513660493 921982468 /nfs/dbraw/zinc/98/24/68/921982468.db2.gz ILFQTZHDUCXHSX-LJQANCHMSA-N 0 3 418.589 4.396 20 0 HIADHN COc1ccc([C@H](C)N[C@H](C)c2ccc3c(c2)OCC(=O)N3)cc1Br ZINC000513667432 921989450 /nfs/dbraw/zinc/98/94/50/921989450.db2.gz ROIPFSWVXFPHEC-NWDGAFQWSA-N 0 3 405.292 4.200 20 0 HIADHN CC[C@@H](NCc1ccc(S(=O)(=O)N(C)C)cc1)c1ccc(OC(F)(F)F)cc1 ZINC000513666120 921989828 /nfs/dbraw/zinc/98/98/28/921989828.db2.gz JYXDGTQPCFUCEN-GOSISDBHSA-N 0 3 416.465 4.076 20 0 HIADHN COc1ccc([C@@H](C)N[C@@H](C)c2ccccc2-n2ccnn2)cc1Br ZINC000513673702 921995673 /nfs/dbraw/zinc/99/56/73/921995673.db2.gz WEGSLFZSBKPKGI-KGLIPLIRSA-N 0 3 401.308 4.450 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Cc3cccc4ccc(OC)cc43)c(C)c2)CC1 ZINC000513691752 922011718 /nfs/dbraw/zinc/01/17/18/922011718.db2.gz HAYRAMFDQNYWTE-UHFFFAOYSA-N 0 3 417.553 4.480 20 0 HIADHN O[C@@H](COc1cccc2[nH]ccc21)CN1CCC(Oc2ccccc2Cl)CC1 ZINC000513786991 922113077 /nfs/dbraw/zinc/11/30/77/922113077.db2.gz RAUUDKINXYBBKC-MRXNPFEDSA-N 0 3 400.906 4.104 20 0 HIADHN CCN1CCC[C@@H](CN(C)C(=O)c2nc(-c3ccccc3)cs2)[C@@H]1c1cnn(C)c1 ZINC000513823353 922147840 /nfs/dbraw/zinc/14/78/40/922147840.db2.gz SSQZZOFMUFAGCN-GHTZIAJQSA-N 0 3 423.586 4.089 20 0 HIADHN CC(C)(CCC(=O)Nc1ccccc1CN1CCC[C@H](C(N)=O)C1)c1ccccc1 ZINC000513829001 922156033 /nfs/dbraw/zinc/15/60/33/922156033.db2.gz UIPYBYWJOZQJHY-FQEVSTJZSA-N 0 3 407.558 4.080 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)Nc3ccc4c(c3)CCCO4)CC2)c1 ZINC000513975460 922295002 /nfs/dbraw/zinc/29/50/02/922295002.db2.gz DJCLVHLVIIPXDB-UHFFFAOYSA-N 0 3 422.573 4.044 20 0 HIADHN COc1ccc2cccc(CC(=O)NC3CCN([C@H](C)c4ccncc4)CC3)c2c1 ZINC000514044217 922364517 /nfs/dbraw/zinc/36/45/17/922364517.db2.gz GODOKVUBZUYGGC-GOSISDBHSA-N 0 3 403.526 4.128 20 0 HIADHN COc1ccc([C@H](C)N[C@H](C)c2ccc(OCC(=O)NC3CC3)cc2)c(C)c1OC ZINC000514105980 922435726 /nfs/dbraw/zinc/43/57/26/922435726.db2.gz VGDRMNOTQQBRBK-SJORKVTESA-N 0 3 412.530 4.081 20 0 HIADHN COc1cccc([C@H](CNC(=O)NCc2ccccc2C(F)(F)F)N2CCCC2)c1 ZINC000514163541 922502835 /nfs/dbraw/zinc/50/28/35/922502835.db2.gz ZFOWLKHEBYVFGD-FQEVSTJZSA-N 0 3 421.463 4.350 20 0 HIADHN O=C(NCc1ccccc1Br)NC[C@H](c1cccs1)N1CCCC1 ZINC000514180672 922520576 /nfs/dbraw/zinc/52/05/76/922520576.db2.gz UYXHVGKXUCOYKW-MRXNPFEDSA-N 0 3 408.365 4.147 20 0 HIADHN CC[C@@H](NC(=O)NCCCN1CCc2ccccc2C1)c1nc(-c2ccccc2)c[nH]1 ZINC000514206917 922544659 /nfs/dbraw/zinc/54/46/59/922544659.db2.gz WOQZAZYBHDZMJO-JOCHJYFZSA-N 0 3 417.557 4.275 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)NCc1ccc(Oc2ccccc2)nc1 ZINC000514219591 922552526 /nfs/dbraw/zinc/55/25/26/922552526.db2.gz QWGIBSBDHZGDKI-UHFFFAOYSA-N 0 3 416.525 4.122 20 0 HIADHN O=C(NCc1ccccc1Br)N[C@H](CN1CCCC1)c1ccccc1 ZINC000514222923 922558380 /nfs/dbraw/zinc/55/83/80/922558380.db2.gz RVLIUNLPWRBAHL-LJQANCHMSA-N 0 3 402.336 4.085 20 0 HIADHN CC(=O)Nc1ccc(S(=O)(=O)CCCN(C)C2CCC(C(C)(C)C)CC2)cc1 ZINC000514226819 922562295 /nfs/dbraw/zinc/56/22/95/922562295.db2.gz LUJAOEIPYKFCMA-UHFFFAOYSA-N 0 3 408.608 4.346 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCC1(c2ccccc2OC)CC1)c1ccsc1 ZINC000514233341 922570757 /nfs/dbraw/zinc/57/07/57/922570757.db2.gz YRNZENRFVXHFLZ-IBGZPJMESA-N 0 3 401.576 4.171 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)NCc1nc2cc(Cl)ccc2s1 ZINC000514232246 922570802 /nfs/dbraw/zinc/57/08/02/922570802.db2.gz JJKLUKBPDQJQMK-UHFFFAOYSA-N 0 3 414.962 4.197 20 0 HIADHN CC(C)[C@H](NC(=O)NC[C@@H](c1ccccc1)N1CCCC1)c1ccc2c(c1)OCCO2 ZINC000514442597 922629842 /nfs/dbraw/zinc/62/98/42/922629842.db2.gz CZWAFSXGABMDMR-URXFXBBRSA-N 0 3 423.557 4.291 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)NCCOc2ccc(C(C)(C)C)cc2)CC1 ZINC000514455491 922635790 /nfs/dbraw/zinc/63/57/90/922635790.db2.gz ZRVIGMPNRWMUKG-UHFFFAOYSA-N 0 3 413.562 4.262 20 0 HIADHN CN1CCCN(C(=O)NC[C@H](c2c[nH]c3ccccc32)c2ccccc2Cl)CC1 ZINC000514563884 922702413 /nfs/dbraw/zinc/70/24/13/922702413.db2.gz BHDLZVDQGJAEKG-IBGZPJMESA-N 0 3 410.949 4.300 20 0 HIADHN CN(Cc1cc(Br)cs1)C(=O)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000514566534 922704092 /nfs/dbraw/zinc/70/40/92/922704092.db2.gz GSAMMVFHTWFPQJ-SFHVURJKSA-N 0 3 422.392 4.489 20 0 HIADHN COc1ccc([C@H]2CCCN2C(=O)NC[C@H](c2ccccc2)N2CCCC2)cc1OC ZINC000514566767 922704762 /nfs/dbraw/zinc/70/47/62/922704762.db2.gz NRGSXIQHVBVJMB-FGZHOGPDSA-N 0 3 423.557 4.387 20 0 HIADHN C[C@H](N[C@@H]1c2ccccc2CC12CCOCC2)C(=O)Nc1ccc(-c2c[nH]cn2)cc1 ZINC000514694649 922761920 /nfs/dbraw/zinc/76/19/20/922761920.db2.gz GQRLGTADPPOHEW-GAJHUEQPSA-N 0 3 416.525 4.088 20 0 HIADHN COc1ccc([C@@H](CNC(=O)CN(C)[C@@H](C)c2ccccc2)N2CCCCC2)cc1 ZINC000514745346 922777650 /nfs/dbraw/zinc/77/76/50/922777650.db2.gz NYCMKKATNWUKKA-GBXCKJPGSA-N 0 3 409.574 4.031 20 0 HIADHN CC(C)c1cc(C(=O)N(Cc2ccccc2Br)C2CCN(C)CC2)no1 ZINC000514764278 922792130 /nfs/dbraw/zinc/79/21/30/922792130.db2.gz ZGIWYPFOHYOHIS-UHFFFAOYSA-N 0 3 420.351 4.297 20 0 HIADHN C[C@H](NC(=O)CNC1(c2ccccc2)CCOCC1)c1ccc(OC(F)(F)F)cc1 ZINC000514852546 922824168 /nfs/dbraw/zinc/82/41/68/922824168.db2.gz DIAIWFJCVRLLSN-INIZCTEOSA-N 0 3 422.447 4.058 20 0 HIADHN CCOC(=O)Cn1nc(C)c(CN(CC)Cc2cccc(-c3ccncc3)c2)c1C ZINC000514868566 922826403 /nfs/dbraw/zinc/82/64/03/922826403.db2.gz FGGSKEVJPWSFCE-UHFFFAOYSA-N 0 3 406.530 4.147 20 0 HIADHN COc1ccc(OC)c([C@H]2CCCN2C(=O)CN2CCC[C@H]2Cc2ccccc2)c1 ZINC000514944276 922849146 /nfs/dbraw/zinc/84/91/46/922849146.db2.gz OCFGRJWFQACGHL-NZQKXSOJSA-N 0 3 408.542 4.074 20 0 HIADHN CCCN(C)[C@H](CNC(=O)c1cn(C)c(=O)c2ccccc12)c1ccc(Cl)cc1 ZINC000514957398 922852660 /nfs/dbraw/zinc/85/26/60/922852660.db2.gz GRPQTTDYTNMIRY-OAQYLSRUSA-N 0 3 411.933 4.005 20 0 HIADHN CC(C)N(Cc1ccccc1)C(=O)[C@H](C)N[C@H]1CCN(C)[C@H]1c1ccc(F)c(F)c1 ZINC000515017679 922880032 /nfs/dbraw/zinc/88/00/32/922880032.db2.gz CUMHYCNFKMPSBK-RTFZILSDSA-N 0 3 415.528 4.125 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)c1sc(NC(=O)c2ccco2)cc1C ZINC000515030371 922885911 /nfs/dbraw/zinc/88/59/11/922885911.db2.gz JKNLEBWQGZVTAQ-UHFFFAOYSA-N 0 3 413.499 4.224 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)N[C@H](C)c1nc2ccccc2n1C(F)F ZINC000515086837 922899769 /nfs/dbraw/zinc/89/97/69/922899769.db2.gz GGYVAELALSCFNJ-HZPDHXFCSA-N 0 3 415.488 4.312 20 0 HIADHN CCSc1nnc(NC(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)s1 ZINC000515108731 922921490 /nfs/dbraw/zinc/92/14/90/922921490.db2.gz DHWQGMPUWBZCDP-CYBMUJFWSA-N 0 3 411.622 4.306 20 0 HIADHN CCc1ccc([C@H](CNC(=O)Nc2cc(OC)c(Cl)cc2OC)N(C)C)cc1 ZINC000515110965 922923063 /nfs/dbraw/zinc/92/30/63/922923063.db2.gz KNGLPNIPHYMIGN-SFHVURJKSA-N 0 3 405.926 4.344 20 0 HIADHN COc1ccc(NC(=O)NC[C@@H](c2ccccc2)N(C)C)cc1OCC(F)(F)F ZINC000515118828 922931695 /nfs/dbraw/zinc/93/16/95/922931695.db2.gz GEADMBINNXDKON-INIZCTEOSA-N 0 3 411.424 4.061 20 0 HIADHN Cc1cc(NC(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)n(-c2ccccn2)n1 ZINC000515222371 923000246 /nfs/dbraw/zinc/00/02/46/923000246.db2.gz AFEQCNRCFGDUNZ-GOSISDBHSA-N 0 3 424.574 4.232 20 0 HIADHN CCn1ncc(C(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)c1-c1ccccc1 ZINC000515396799 923079849 /nfs/dbraw/zinc/07/98/49/923079849.db2.gz VVSAOCQSRZQIEN-QHCPKHFHSA-N 0 3 420.557 4.390 20 0 HIADHN CCc1ccc([C@H](C)NC(=O)[C@@H](C)N[C@@H](C)c2ccc(NC(=O)NC3CC3)cc2)cc1 ZINC000515517119 923146865 /nfs/dbraw/zinc/14/68/65/923146865.db2.gz FHNHYAARYHTGCE-OKZBNKHCSA-N 0 3 422.573 4.449 20 0 HIADHN CC(C)(CN[C@H](C(=O)NC1CC1)c1ccccc1)c1ccc(Br)cc1 ZINC000515519929 923150881 /nfs/dbraw/zinc/15/08/81/923150881.db2.gz ZXQFKDCCBOTHFX-IBGZPJMESA-N 0 3 401.348 4.336 20 0 HIADHN COc1cccc([C@H](CNC(=O)CCOc2ccc(F)c(Cl)c2)N2CCCC2)c1 ZINC000515721746 923302903 /nfs/dbraw/zinc/30/29/03/923302903.db2.gz LOXFNEVNLLRCIB-NRFANRHFSA-N 0 3 420.912 4.210 20 0 HIADHN Cc1ccc(NC(=O)[C@H](N[C@H](Cc2ccccc2)CN(C)C)c2ccccc2)cc1 ZINC000515737742 923313166 /nfs/dbraw/zinc/31/31/66/923313166.db2.gz HIYFRRAHNAICOS-JWQCQUIFSA-N 0 3 401.554 4.437 20 0 HIADHN Cc1cccc([C@@H]2CCCN2C(=O)NCCCCN2CCN(c3ccccc3)CC2)c1 ZINC000515791303 923351971 /nfs/dbraw/zinc/35/19/71/923351971.db2.gz SEEKBKSFIXXXGG-VWLOTQADSA-N 0 3 420.601 4.444 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)c1cc(Cl)cc2cccnc21 ZINC000515809563 923365536 /nfs/dbraw/zinc/36/55/36/923365536.db2.gz GJGPGGWEIBXMRX-UHFFFAOYSA-N 0 3 422.960 4.220 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)c3[nH]c4ccccc4c3Cl)CC2)c1 ZINC000515832988 923381774 /nfs/dbraw/zinc/38/17/74/923381774.db2.gz NFNGYEKPEGYUBJ-UHFFFAOYSA-N 0 3 424.976 4.462 20 0 HIADHN CC1CCN([C@H](CNC(=O)c2cncc(Br)c2)c2ccccc2)CC1 ZINC000515978975 923474760 /nfs/dbraw/zinc/47/47/60/923474760.db2.gz XIEUILJWQWNKDH-LJQANCHMSA-N 0 3 402.336 4.047 20 0 HIADHN CC(C)NC(=O)Nc1cccc(C(=O)NC[C@@H](c2ccccc2)N2CCC(C)CC2)c1 ZINC000515988119 923484429 /nfs/dbraw/zinc/48/44/29/923484429.db2.gz QHSVOLLHZBMEIV-QHCPKHFHSA-N 0 3 422.573 4.420 20 0 HIADHN CN(C)Cc1cccc(NC(=O)C(=O)N2CCC[C@H]2c2ccc(Cl)c(Cl)c2)c1 ZINC000516024223 923507568 /nfs/dbraw/zinc/50/75/68/923507568.db2.gz KVTVPFUVKUWKBP-IBGZPJMESA-N 0 3 420.340 4.357 20 0 HIADHN COc1ccc(OC)c([C@@H]2CCCN2C(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)c1 ZINC000516163565 923582381 /nfs/dbraw/zinc/58/23/81/923582381.db2.gz HYCYWMDKVUEKJZ-NOXFTYBFSA-N 0 3 423.557 4.386 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N2CCC(COc3ccccc3)CC2)C1 ZINC000516223610 923612205 /nfs/dbraw/zinc/61/22/05/923612205.db2.gz ROHPVAOOUZRBPD-OFNKIYASSA-N 0 3 407.558 4.323 20 0 HIADHN CCO[C@@H]1C[C@H](N[C@H](C)c2cc3cc(Br)ccc3o2)[C@H]1n1cccn1 ZINC000516496788 923760637 /nfs/dbraw/zinc/76/06/37/923760637.db2.gz AJHSMTFAFNSGLE-JJYIYXIDSA-N 0 3 404.308 4.461 20 0 HIADHN C[C@H]1CCCN(C(C)(C)CNC(=O)N2CCC(C(=O)c3ccc(Cl)cc3)CC2)C1 ZINC000516584120 923802402 /nfs/dbraw/zinc/80/24/02/923802402.db2.gz XNWHSBZBTQNFEC-KRWDZBQOSA-N 0 3 419.997 4.455 20 0 HIADHN CC(C)CC(=O)Nc1ccc(NC(=O)N[C@@H]2CCN(Cc3ccccc3)[C@H]2C)cc1 ZINC000516657342 923830528 /nfs/dbraw/zinc/83/05/28/923830528.db2.gz XZMCBUSEAZIFKS-PGRDOPGGSA-N 0 3 408.546 4.456 20 0 HIADHN C[C@@H](NC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1)c1ccc(NC(=O)C2CC2)cc1 ZINC000516769760 923881807 /nfs/dbraw/zinc/88/18/07/923881807.db2.gz NHSKVSBZISYJED-UTKZUKDTSA-N 0 3 423.532 4.264 20 0 HIADHN C[C@@H](Oc1ccccc1NC(=O)N(CCN(C)C)Cc1ccccn1)C(F)(F)F ZINC000516808416 923895072 /nfs/dbraw/zinc/89/50/72/923895072.db2.gz FPVAQGVRJSTAIM-OAHLLOKOSA-N 0 3 410.440 4.007 20 0 HIADHN O=C(NCc1nc2cc(Cl)ccc2s1)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000516836549 923912604 /nfs/dbraw/zinc/91/26/04/923912604.db2.gz ZZMFTWVISHNPRM-KRWDZBQOSA-N 0 3 414.962 4.414 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)N2CCC(Nc3ccc(F)cc3)CC2)CCN1Cc1ccccc1 ZINC000516989900 923954203 /nfs/dbraw/zinc/95/42/03/923954203.db2.gz SSPLUKXPRYTSOI-JPYJTQIMSA-N 0 3 410.537 4.075 20 0 HIADHN CC(C)c1noc(-c2ccccc2C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)n1 ZINC000517163300 924033148 /nfs/dbraw/zinc/03/31/48/924033148.db2.gz UODYWNPTRRCJJF-IBGZPJMESA-N 0 3 404.514 4.254 20 0 HIADHN COc1ccc(CN(C)C(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)cc1O ZINC000517526586 924247272 /nfs/dbraw/zinc/24/72/72/924247272.db2.gz VEHRSNJCQZEGCR-GOSISDBHSA-N 0 3 417.575 4.077 20 0 HIADHN CCN(C(=O)NCCCN1CCc2ccccc2C1)[C@@H](C)Cc1ccc(OC)cc1 ZINC000517532535 924249750 /nfs/dbraw/zinc/24/97/50/924249750.db2.gz LQSMKMXCKFDDNO-FQEVSTJZSA-N 0 3 409.574 4.106 20 0 HIADHN COc1cc(CNC[C@H](c2c(F)cccc2Cl)N2CCCC2)cc2c1OCO2 ZINC000517538115 924252222 /nfs/dbraw/zinc/25/22/22/924252222.db2.gz KCXCLGGHJCSTIJ-QGZVFWFLSA-N 0 3 406.885 4.143 20 0 HIADHN C[C@@H]1CN([C@@H](CNCc2cc(F)c(F)c(F)c2)c2c(F)cccc2Cl)CCO1 ZINC000517537392 924252290 /nfs/dbraw/zinc/25/22/90/924252290.db2.gz QZKMWQRCSVNQEW-XIKOKIGWSA-N 0 3 416.846 4.448 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)NCc2cccnc2OC2CCCC2)C1 ZINC000517541774 924253708 /nfs/dbraw/zinc/25/37/08/924253708.db2.gz VULAPDLWNLCAJL-WIYYLYMNSA-N 0 3 408.546 4.038 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)N2CCC(c3nc4ccccc4[nH]3)CC2)C1 ZINC000517544707 924257251 /nfs/dbraw/zinc/25/72/51/924257251.db2.gz MQMWQCQAFUHDQK-GHTZIAJQSA-N 0 3 417.557 4.287 20 0 HIADHN COCCn1ccc2ccc(NC(=O)N[C@H]3CCN(Cc4ccccc4)[C@@H]3C)cc21 ZINC000517620422 926729100 /nfs/dbraw/zinc/72/91/00/926729100.db2.gz XKYCMWUEHFYNSC-GCJKJVERSA-N 0 3 406.530 4.072 20 0 HIADHN COc1ccc(CN2CCC[C@H](c3nc(C(F)(F)F)cn3C)C2)cc1OC(F)F ZINC000517625760 926734588 /nfs/dbraw/zinc/73/45/88/926734588.db2.gz LWBTXWJBLCWOKQ-ZDUSSCGKSA-N 0 3 419.394 4.429 20 0 HIADHN Cc1cc2occ(CC(=O)Nc3cnccc3N3CCN(C)CC3)c2cc1C(C)C ZINC000517651837 926759543 /nfs/dbraw/zinc/75/95/43/926759543.db2.gz FLIYUCLCEKMPOE-UHFFFAOYSA-N 0 3 406.530 4.193 20 0 HIADHN CCOc1cc2c(cc1[C@@H]1C[C@@H]1C(=O)NC[C@H](C)N(C)Cc1ccccc1)O[C@@H](C)C2 ZINC000517657607 926765092 /nfs/dbraw/zinc/76/50/92/926765092.db2.gz FOZABIIKOOUAJG-CFFRYYMNSA-N 0 3 422.569 4.149 20 0 HIADHN CCOc1cc2c(cc1[C@@H]1C[C@@H]1C(=O)NC[C@@H](C)N(C)Cc1ccccc1)O[C@H](C)C2 ZINC000517657609 926765227 /nfs/dbraw/zinc/76/52/27/926765227.db2.gz FOZABIIKOOUAJG-IOGOZDDNSA-N 0 3 422.569 4.149 20 0 HIADHN CCc1ccc(CNC(=O)N(CCN(C)C)Cc2ccc(Br)cc2)s1 ZINC000517679275 926784660 /nfs/dbraw/zinc/78/46/60/926784660.db2.gz RLEDYMBYCLXQNT-UHFFFAOYSA-N 0 3 424.408 4.346 20 0 HIADHN COc1cccc([C@@H](CNC(=O)Cc2ccccc2C(F)(F)F)N2CCCC2)c1 ZINC000517802145 926842070 /nfs/dbraw/zinc/84/20/70/926842070.db2.gz WJFFGCSKFWBZNC-HXUWFJFHSA-N 0 3 406.448 4.210 20 0 HIADHN Cc1cc(C)n(-c2ccc(Cl)c(C(=O)N(CCN(C)C)CC3CCCCC3)n2)n1 ZINC000517823884 926852994 /nfs/dbraw/zinc/85/29/94/926852994.db2.gz KCFALAQPNKEIJG-UHFFFAOYSA-N 0 3 417.985 4.122 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)Nc1ccc(OCc2ccncc2)cc1 ZINC000517901493 926882031 /nfs/dbraw/zinc/88/20/31/926882031.db2.gz HKGGBUWKINDEAL-UHFFFAOYSA-N 0 3 404.514 4.256 20 0 HIADHN CC[C@@H](C)[C@H](C)N(CC(=O)N(C)CC(=O)Nc1ccccc1C(F)(F)F)C1CC1 ZINC000517908940 926886206 /nfs/dbraw/zinc/88/62/06/926886206.db2.gz RTVWDUXPEBMUQJ-CABCVRRESA-N 0 3 413.484 4.001 20 0 HIADHN CC(C)(CNC(=O)CSc1nnc(-c2ccc3ccccc3c2)o1)N1CCCCC1 ZINC000517974912 926922361 /nfs/dbraw/zinc/92/23/61/926922361.db2.gz UISXNTJLTPSQPH-UHFFFAOYSA-N 0 3 424.570 4.363 20 0 HIADHN O=C(N[C@@H](COc1ccccc1)c1ccccc1)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000518070605 927005335 /nfs/dbraw/zinc/00/53/35/927005335.db2.gz IMWRQAPVHKCHMB-NOZRDPDXSA-N 0 3 415.537 4.230 20 0 HIADHN CCCOc1ccc(CNC(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)cn1 ZINC000518083009 927011653 /nfs/dbraw/zinc/01/16/53/927011653.db2.gz HFYSYWWZKIDNQA-LJQANCHMSA-N 0 3 416.591 4.204 20 0 HIADHN O=C(c1oc2ccccc2c1CSc1ncccn1)N1CC[C@H](N2CCCCC2)C1 ZINC000518087179 927014521 /nfs/dbraw/zinc/01/45/21/927014521.db2.gz PRYUFPUFDLOEBN-KRWDZBQOSA-N 0 3 422.554 4.216 20 0 HIADHN O=C(CC(F)(F)F)N1CCC(NCc2csc(-c3ccc(Cl)cc3)n2)CC1 ZINC000518275944 927132860 /nfs/dbraw/zinc/13/28/60/927132860.db2.gz YUESMFJDHQSHQB-UHFFFAOYSA-N 0 3 417.884 4.497 20 0 HIADHN Fc1cccc(N2CCCC2)c1CNC[C@@H](c1cccc(Cl)c1)N1CCOCC1 ZINC000518275363 927133376 /nfs/dbraw/zinc/13/33/76/927133376.db2.gz FVSSYOJGVCKFMO-QHCPKHFHSA-N 0 3 417.956 4.242 20 0 HIADHN CCN(CC)[C@@H](CNCc1cc(Br)c2c(c1)OCCCO2)c1ccco1 ZINC000518280587 927136732 /nfs/dbraw/zinc/13/67/32/927136732.db2.gz ZZOISPVAUBMDQK-KRWDZBQOSA-N 0 3 423.351 4.376 20 0 HIADHN FC(F)(F)CN1CC[C@H](NCc2ccc(-c3cccc(Br)c3)o2)C1 ZINC000518279836 927137231 /nfs/dbraw/zinc/13/72/31/927137231.db2.gz ARSIQCLKCRESJS-AWEZNQCLSA-N 0 3 403.242 4.435 20 0 HIADHN Cc1ccc(NC(=O)N2CCC(CN3C[C@@H](C)O[C@H](C)C3)CC2)cc1C(F)(F)F ZINC000518313744 927176552 /nfs/dbraw/zinc/17/65/52/927176552.db2.gz IHTLBXXCBCGQBC-HZPDHXFCSA-N 0 3 413.484 4.367 20 0 HIADHN CC1CCN([C@@H](CNC(=O)Nc2cccnc2N2CCCC2)c2ccccc2)CC1 ZINC000518338584 927201869 /nfs/dbraw/zinc/20/18/69/927201869.db2.gz OBDUEVIMRRXVOZ-QFIPXVFZSA-N 0 3 407.562 4.277 20 0 HIADHN NC(=O)CCN(C(=O)CN1CCC[C@H]1c1cccc2ccccc21)c1ccc(F)cc1 ZINC000518349380 927213089 /nfs/dbraw/zinc/21/30/89/927213089.db2.gz ONMUIQVALVODKH-QHCPKHFHSA-N 0 3 419.500 4.024 20 0 HIADHN COc1ccc([C@H](NC(=O)NCCN(C)Cc2ccccc2)c2ccc(F)cc2)cc1 ZINC000518498276 927308617 /nfs/dbraw/zinc/30/86/17/927308617.db2.gz AFTSWULBSDKGSK-XMMPIXPASA-N 0 3 421.516 4.355 20 0 HIADHN CC[C@H](Oc1ccccc1C(C)C)C(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000518500218 927310725 /nfs/dbraw/zinc/31/07/25/927310725.db2.gz IZWWGZZXBLWMIX-MZKRTTBSSA-N 0 3 416.606 4.315 20 0 HIADHN Cc1c(Cl)cccc1-n1ccnc1SCC(=O)N1CC[C@H](N2CCCCC2)C1 ZINC000518615829 927380826 /nfs/dbraw/zinc/38/08/26/927380826.db2.gz AAXXTCKPPDAQSW-KRWDZBQOSA-N 0 3 418.994 4.013 20 0 HIADHN O=C(C[C@H]1CCCc2ccccc21)NCCCCN1CCN(Cc2ccccc2)CC1 ZINC000518645461 927400580 /nfs/dbraw/zinc/40/05/80/927400580.db2.gz GLJHIBRKCXTUMD-RUZDIDTESA-N 0 3 419.613 4.211 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2ccc(C(=O)NC(C)C)c(C)c2)N2CCCC2)cc1 ZINC000518720129 927453431 /nfs/dbraw/zinc/45/34/31/927453431.db2.gz SFYHYCKJHYZUPX-HSZRJFAPSA-N 0 3 422.573 4.400 20 0 HIADHN CCc1c(C(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)nnn1-c1cccc(Cl)c1 ZINC000518788217 927493812 /nfs/dbraw/zinc/49/38/12/927493812.db2.gz VMYRGEDRQFVHSE-APWZRJJASA-N 0 3 423.948 4.048 20 0 HIADHN CCCCOc1ccccc1NC(=O)N1CCC(CN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000518838988 927538592 /nfs/dbraw/zinc/53/85/92/927538592.db2.gz ZVVNYDZLSDLJCF-OALUTQOASA-N 0 3 403.567 4.219 20 0 HIADHN CCN(CC)[C@H](CNc1ncc(C(=O)N2CCCCC2)cc1Cl)c1ccco1 ZINC000518842136 927541505 /nfs/dbraw/zinc/54/15/05/927541505.db2.gz IFCIRTDAWRYWCC-GOSISDBHSA-N 0 3 404.942 4.449 20 0 HIADHN CC1CCN(C(=O)CN(C)CCCCCc2cc(-c3cccc(F)c3)n[nH]2)CC1 ZINC000518842212 927542561 /nfs/dbraw/zinc/54/25/61/927542561.db2.gz MECNWTIVQNKCEC-UHFFFAOYSA-N 0 3 400.542 4.119 20 0 HIADHN CN(CCOc1ccccc1Cl)C(=O)NC[C@H](c1ccccc1)N1CCCC1 ZINC000518883031 927594846 /nfs/dbraw/zinc/59/48/46/927594846.db2.gz SZXRKSNURMLNGF-HXUWFJFHSA-N 0 3 401.938 4.197 20 0 HIADHN CN(C(=O)CCc1ncc(-c2ccc(Cl)cc2Cl)o1)[C@@H]1CCN(C2CC2)C1 ZINC000518899424 927609015 /nfs/dbraw/zinc/60/90/15/927609015.db2.gz WNHJXDLDCQNALB-OAHLLOKOSA-N 0 3 408.329 4.276 20 0 HIADHN O=C(Cc1csc(Cc2ccc(F)cc2)n1)N[C@H](CN1CCCC1)c1ccccc1 ZINC000518935175 927640277 /nfs/dbraw/zinc/64/02/77/927640277.db2.gz HMCVCQDUPFCKMV-JOCHJYFZSA-N 0 3 423.557 4.369 20 0 HIADHN CCc1ccc([C@H](CNC(=O)Nc2cccc(OC[C@H]3CCCO3)c2)N(C)C)cc1 ZINC000519011330 927691291 /nfs/dbraw/zinc/69/12/91/927691291.db2.gz YHFUNRJRAFZTGX-PKTZIBPZSA-N 0 3 411.546 4.231 20 0 HIADHN CCc1ccc([C@H](CNC(=O)Nc2cccc(OC[C@@H]3CCCO3)c2)N(C)C)cc1 ZINC000519011329 927691340 /nfs/dbraw/zinc/69/13/40/927691340.db2.gz YHFUNRJRAFZTGX-GOTSBHOMSA-N 0 3 411.546 4.231 20 0 HIADHN COc1ccc([C@H](Cc2ccc(F)cc2)N[C@H](C)C(=O)Nc2c(C)nn(C)c2C)cc1 ZINC000519064252 927743110 /nfs/dbraw/zinc/74/31/10/927743110.db2.gz PUCXLQPLFJTUDP-ZHRRBRCNSA-N 0 3 424.520 4.085 20 0 HIADHN COCc1cccc2sc(NC(=O)N[C@H]3CCN([C@@H](C)c4ccccc4)C3)nc21 ZINC000519197405 927822300 /nfs/dbraw/zinc/82/23/00/927822300.db2.gz BECMDHJXIHFANC-YJBOKZPZSA-N 0 3 410.543 4.400 20 0 HIADHN CC(C)C(=O)Nc1ccc(NC(=O)N(CCCc2ccccc2)CCN(C)C)cc1 ZINC000519221105 927834336 /nfs/dbraw/zinc/83/43/36/927834336.db2.gz LQGJUMQDYLQJMF-UHFFFAOYSA-N 0 3 410.562 4.309 20 0 HIADHN CCN(Cc1ccc(Cl)c(Cl)c1)C[C@H](O)COc1c(OC)cccc1OC ZINC000519284365 927863004 /nfs/dbraw/zinc/86/30/04/927863004.db2.gz VDUNUUIIYAZNMU-HNNXBMFYSA-N 0 3 414.329 4.272 20 0 HIADHN CC1CCN([C@@H](CNC(=O)N2CCCC[C@H]2c2ncc[nH]2)c2cccs2)CC1 ZINC000519293916 927866982 /nfs/dbraw/zinc/86/69/82/927866982.db2.gz XYDNPUWZRWCEEW-ROUUACIJSA-N 0 3 401.580 4.181 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)c2nn(-c3ccc(C)cc3C)c3c2CCC3)o1 ZINC000519295501 927867668 /nfs/dbraw/zinc/86/76/68/927867668.db2.gz BHKTYGOOOOANOD-UHFFFAOYSA-N 0 3 420.557 4.083 20 0 HIADHN CCOc1cccc2cc([C@@H](C)N[C@@H]3CCCc4cc(S(N)(=O)=O)ccc43)oc21 ZINC000519306071 927873953 /nfs/dbraw/zinc/87/39/53/927873953.db2.gz YFJAPNHASZERFJ-AUUYWEPGSA-N 0 3 414.527 4.207 20 0 HIADHN O=C(N[C@H]1CCN(C2CC2)C1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000519364842 927897957 /nfs/dbraw/zinc/89/79/57/927897957.db2.gz GZMHCTXANLHEFT-HNNXBMFYSA-N 0 3 401.850 4.007 20 0 HIADHN CCCC(=O)Nc1ccc(CNC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)cc1 ZINC000519440100 927948208 /nfs/dbraw/zinc/94/82/08/927948208.db2.gz HLRIKRAZQBWAPD-HXUWFJFHSA-N 0 3 411.521 4.093 20 0 HIADHN Cn1cc(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)c(-c2ccccc2Cl)n1 ZINC000519459667 927964445 /nfs/dbraw/zinc/96/44/45/927964445.db2.gz VLZXDDPUPGOGRD-GOSISDBHSA-N 0 3 408.933 4.135 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)Nc2ccc(C(=O)NC(C)C)c(C)c2)N(C)C)cc1 ZINC000519496910 927992321 /nfs/dbraw/zinc/99/23/21/927992321.db2.gz NXLMCYVLGXIZKH-JOCHJYFZSA-N 0 3 410.562 4.120 20 0 HIADHN Cc1ccc(NC(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)cc1C(=O)NC(C)C ZINC000519498446 927993724 /nfs/dbraw/zinc/99/37/24/927993724.db2.gz JIQLEALPYNJSCF-GHTZIAJQSA-N 0 3 408.546 4.090 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)N[C@@H]1CCSc2c(F)cccc21 ZINC000519506491 927998968 /nfs/dbraw/zinc/99/89/68/927998968.db2.gz PWYPRPFRNDSIBE-LJQANCHMSA-N 0 3 405.514 4.275 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)Nc1ccc(C(=O)N2CCCC[C@@H]2C)cc1 ZINC000519555225 928012610 /nfs/dbraw/zinc/01/26/10/928012610.db2.gz HLSUWATXGUCSIN-UXHICEINSA-N 0 3 422.573 4.343 20 0 HIADHN CN1CC[C@]2(CCN(C(=O)c3ccccc3C(=O)c3ccc(Cl)c(Cl)c3)C2)C1 ZINC000519723458 928057793 /nfs/dbraw/zinc/05/77/93/928057793.db2.gz IUAVGWLKENHHMU-QFIPXVFZSA-N 0 3 417.336 4.392 20 0 HIADHN C[C@@H]1C[C@H]1N1CCN(C(=O)c2ccccc2SCc2cscn2)C[C@@H](C)C1 ZINC000519765357 928070268 /nfs/dbraw/zinc/07/02/68/928070268.db2.gz HTIAJEVLMKQJBB-FRQCXROJSA-N 0 3 401.601 4.238 20 0 HIADHN COc1ccc(OC)c(CN(C(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)C2CC2)c1 ZINC000519811005 928083832 /nfs/dbraw/zinc/08/38/32/928083832.db2.gz GABZLBJKWVHXFQ-WIYYLYMNSA-N 0 3 423.557 4.213 20 0 HIADHN CCCN(C(=O)NCc1ccc(CN2CCN(C)CC2)cc1)[C@H]1CCc2ccccc21 ZINC000519897228 928133084 /nfs/dbraw/zinc/13/30/84/928133084.db2.gz WNSGUBLNKZEOPR-VWLOTQADSA-N 0 3 420.601 4.043 20 0 HIADHN CC(=O)Nc1ccc(OC[C@@H](O)CN(C)[C@H](C)c2cccc(C(F)(F)F)c2)cc1 ZINC000519903516 928138046 /nfs/dbraw/zinc/13/80/46/928138046.db2.gz JPBKBLCEYDJSBT-KUHUBIRLSA-N 0 3 410.436 4.097 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)c1ccc(-c2noc(C(F)(F)F)n2)cc1 ZINC000519929836 928162044 /nfs/dbraw/zinc/16/20/44/928162044.db2.gz RNZHRVWADBHASC-UHFFFAOYSA-N 0 3 420.391 4.078 20 0 HIADHN O=C(CCOc1ccc(F)c(Cl)c1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000519938242 928172284 /nfs/dbraw/zinc/17/22/84/928172284.db2.gz VEVRCPXLXSVVMM-UHFFFAOYSA-N 0 3 422.953 4.478 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)N[C@@H](c1ccccc1)c1ccccn1 ZINC000520051709 928277594 /nfs/dbraw/zinc/27/75/94/928277594.db2.gz RZKUINUCHJLOJG-VWLOTQADSA-N 0 3 416.569 4.377 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)N[C@@H](C)Cc2cccc(Br)c2)o1 ZINC000520085979 928300724 /nfs/dbraw/zinc/30/07/24/928300724.db2.gz NCMLKLVEXYJSFG-HNNXBMFYSA-N 0 3 422.367 4.055 20 0 HIADHN O=C(Nc1cccc(CNC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)c1)C1CCC1 ZINC000520092910 928304609 /nfs/dbraw/zinc/30/46/09/928304609.db2.gz MFIXEHSOKCYVBA-NRFANRHFSA-N 0 3 423.532 4.093 20 0 HIADHN COCCOc1ccc(NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)c(C)c1 ZINC000520113206 928318180 /nfs/dbraw/zinc/31/81/80/928318180.db2.gz JAENCPCMALLZRZ-LJQANCHMSA-N 0 3 400.494 4.010 20 0 HIADHN Cc1cccc(C[C@H](NCc2csc(CNC(=O)c3ccccc3)n2)C2CC2)c1 ZINC000520236317 928404776 /nfs/dbraw/zinc/40/47/76/928404776.db2.gz TYLWKZJDOUJZHG-QFIPXVFZSA-N 0 3 405.567 4.492 20 0 HIADHN Cc1cccc(OC(F)F)c1NC(=O)N(CCN(C)C)Cc1ccc(F)c(F)c1 ZINC000520264993 928429623 /nfs/dbraw/zinc/42/96/23/928429623.db2.gz GURBCCPUQPYQBX-UHFFFAOYSA-N 0 3 413.415 4.470 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N(C)CC(=O)Nc2c(C)cccc2C)N2CCCC2)cc1 ZINC000520296716 928458464 /nfs/dbraw/zinc/45/84/64/928458464.db2.gz FWTHPMYIQGRNBU-QFIPXVFZSA-N 0 3 422.573 4.029 20 0 HIADHN Cc1nc(-c2cccc(NC(=O)CCCN3CCN(c4ccccc4)CC3)c2)oc1C ZINC000520310341 928472392 /nfs/dbraw/zinc/47/23/92/928472392.db2.gz PZQIZCRTAOBTCP-UHFFFAOYSA-N 0 3 418.541 4.499 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)Nc1ccc(-n2cccn2)c(Cl)c1 ZINC000520315621 928476932 /nfs/dbraw/zinc/47/69/32/928476932.db2.gz BQALTOHRYCSERD-UHFFFAOYSA-N 0 3 423.948 4.067 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2Cl)c(C)c1CC(=O)N(C)[C@@H]1CCN(C2CC2)C1 ZINC000520318160 928480674 /nfs/dbraw/zinc/48/06/74/928480674.db2.gz AMNGRGLTELWQEO-QGZVFWFLSA-N 0 3 421.372 4.034 20 0 HIADHN C[C@H](CNC(=O)[C@H]1C[C@@H]1c1cccc(Br)c1)N(C)Cc1ccccc1 ZINC000520327479 928490918 /nfs/dbraw/zinc/49/09/18/928490918.db2.gz FNEJAJWUPZDUMO-YSGRDPCXSA-N 0 3 401.348 4.189 20 0 HIADHN Cc1ccc(-c2cc(C(=O)N(C)[C@H]3CN4CCC3CC4)c3cnn(C(C)C)c3n2)cc1 ZINC000520370817 928526428 /nfs/dbraw/zinc/52/64/28/928526428.db2.gz AFBMRQYRGYQKFV-QHCPKHFHSA-N 0 3 417.557 4.154 20 0 HIADHN Cc1c([C@@H](C)NC(=O)NC[C@@H](C)N(C)Cc2ccccc2)cnn1-c1ccc(F)cc1 ZINC000520377819 928531189 /nfs/dbraw/zinc/53/11/89/928531189.db2.gz QMTSVPKYSSFVHT-QZTJIDSGSA-N 0 3 423.536 4.201 20 0 HIADHN COc1cc(CNCc2cc(C)nc(N3CCCC3)c2)ccc1OCc1ccncc1 ZINC000520463015 928580010 /nfs/dbraw/zinc/58/00/10/928580010.db2.gz MPFYOSHEEYCZIL-UHFFFAOYSA-N 0 3 418.541 4.263 20 0 HIADHN CC(C)OCc1ccccc1CNC(=O)N(CCN(C)C)Cc1ccccc1F ZINC000520532602 928623771 /nfs/dbraw/zinc/62/37/71/928623771.db2.gz CITOQYQTKRYAFD-UHFFFAOYSA-N 0 3 401.526 4.024 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)Nc1cccc(OC[C@@H]2CCCO2)c1 ZINC000520536032 928626983 /nfs/dbraw/zinc/62/69/83/928626983.db2.gz PBGBFEYUXVVWKD-VQTJNVASSA-N 0 3 415.559 4.265 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)Nc1cccc(OC[C@H]2CCCO2)c1 ZINC000520536033 928627200 /nfs/dbraw/zinc/62/72/00/928627200.db2.gz PBGBFEYUXVVWKD-WOJBJXKFSA-N 0 3 415.559 4.265 20 0 HIADHN CN(C(=O)Nc1ccc(C(F)(F)F)cc1)C1CCN(CCc2ccccn2)CC1 ZINC000520670387 928715539 /nfs/dbraw/zinc/71/55/39/928715539.db2.gz IZLSLKWJWCCDCK-UHFFFAOYSA-N 0 3 406.452 4.271 20 0 HIADHN Cc1sc2nc(C)nc(SCC(=O)NCCN3[C@H](C)CCC[C@H]3C)c2c1C ZINC000520761911 928805193 /nfs/dbraw/zinc/80/51/93/928805193.db2.gz HMTKYXOFYWVKDL-CHWSQXEVSA-N 0 3 406.621 4.088 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)Nc1cccc(NC(=O)C2CC2)c1 ZINC000520779997 928814795 /nfs/dbraw/zinc/81/47/95/928814795.db2.gz WBKZUFQEHTVKEE-UHFFFAOYSA-N 0 3 408.546 4.063 20 0 HIADHN CCC[C@H](CNC(=O)CN(C)C[C@@H]1CCCOC1)c1ccc(Cl)cc1Cl ZINC000520783839 928815856 /nfs/dbraw/zinc/81/58/56/928815856.db2.gz VDNNXYVLKOPHFC-JKSUJKDBSA-N 0 3 401.378 4.352 20 0 HIADHN Cc1[nH]c2ccc(CNC(=O)N(CCCc3ccccc3)CCN(C)C)cc2c1C ZINC000520840104 928839286 /nfs/dbraw/zinc/83/92/86/928839286.db2.gz COBDCVIFYYGBPY-UHFFFAOYSA-N 0 3 406.574 4.491 20 0 HIADHN NC(=O)C[C@H](NCc1csc(-c2ccc(Br)cc2)n1)C1CCCCC1 ZINC000520893476 928864460 /nfs/dbraw/zinc/86/44/60/928864460.db2.gz VFXNFLZJQXYCLR-KRWDZBQOSA-N 0 3 422.392 4.487 20 0 HIADHN c1cc2c(s1)CCN([C@@H](CNCc1cccc3c1OCCO3)c1ccccc1)C2 ZINC000520949830 928885891 /nfs/dbraw/zinc/88/58/91/928885891.db2.gz SLIIJJMJIBNUGK-NRFANRHFSA-N 0 3 406.551 4.409 20 0 HIADHN O=C(N[C@H]1CCCOc2ccc(F)cc21)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000521001663 928919064 /nfs/dbraw/zinc/91/90/64/928919064.db2.gz IBOHKXMEODBYEY-UWJYYQICSA-N 0 3 400.469 4.207 20 0 HIADHN O=C(N[C@H](c1ccc2c(c1)OCCO2)C1CC1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000521011956 928928120 /nfs/dbraw/zinc/92/81/20/928928120.db2.gz RBJSRRQXUIXEOL-YKSBVNFPSA-N 0 3 424.516 4.076 20 0 HIADHN O=C(NC[C@@H]1CCCO[C@H]1c1ccccc1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000521014499 928930541 /nfs/dbraw/zinc/93/05/41/928930541.db2.gz WEZCJWAAONDNSZ-ZDXQCDESSA-N 0 3 410.533 4.322 20 0 HIADHN Cc1cc(CNC(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)ccc1F ZINC000521067529 928970292 /nfs/dbraw/zinc/97/02/92/928970292.db2.gz XXMQPLGMRBHUGT-UHFFFAOYSA-N 0 3 411.443 4.426 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)N[C@H]1CCCOc2ccc(F)cc21 ZINC000521070503 928972149 /nfs/dbraw/zinc/97/21/49/928972149.db2.gz YWKISKHJSVFVIM-FQEVSTJZSA-N 0 3 419.928 4.466 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)Nc1ccc2c(c1)CCO2 ZINC000521073044 928973523 /nfs/dbraw/zinc/97/35/23/928973523.db2.gz MMCPXJWZFSINSG-UHFFFAOYSA-N 0 3 407.436 4.236 20 0 HIADHN Cc1cccc(OC(F)F)c1NC(=O)CCCN1CCN(c2ccccc2)CC1 ZINC000521093776 928988936 /nfs/dbraw/zinc/98/89/36/928988936.db2.gz FSVPWDRSRWOIFJ-UHFFFAOYSA-N 0 3 403.473 4.137 20 0 HIADHN Cc1ccc(COc2ccc(CN3CCC(C(=O)Nc4nncs4)CC3)cc2)cc1 ZINC000521114932 929005026 /nfs/dbraw/zinc/00/50/26/929005026.db2.gz OJIANHRYUHQHIT-UHFFFAOYSA-N 0 3 422.554 4.276 20 0 HIADHN O=C(NCc1csc(Br)c1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000521125253 929009839 /nfs/dbraw/zinc/00/98/39/929009839.db2.gz CRDITAYUEKDYTJ-HNNXBMFYSA-N 0 3 411.340 4.178 20 0 HIADHN CCN1CCCC[C@@H]1CNC(=O)c1ccccc1SCc1cn2ccccc2n1 ZINC000521129770 929013622 /nfs/dbraw/zinc/01/36/22/929013622.db2.gz NMWRIFFSNIOQOA-LJQANCHMSA-N 0 3 408.571 4.231 20 0 HIADHN COCCN(C(=O)NCCN1CCC(C)CC1)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000521170796 929041892 /nfs/dbraw/zinc/04/18/92/929041892.db2.gz RBKMDXDSOSVXMM-QGZVFWFLSA-N 0 3 415.500 4.156 20 0 HIADHN COCCN(C(=O)NCCN1CCC(C)CC1)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000521170794 929042413 /nfs/dbraw/zinc/04/24/13/929042413.db2.gz RBKMDXDSOSVXMM-KRWDZBQOSA-N 0 3 415.500 4.156 20 0 HIADHN CS(=O)(=O)Nc1cccc(CNCc2cccc(OCCCc3ccccc3)c2)c1 ZINC000521172776 929043054 /nfs/dbraw/zinc/04/30/54/929043054.db2.gz DXGOXYVISBZNIP-UHFFFAOYSA-N 0 3 424.566 4.360 20 0 HIADHN Cc1ccc(-c2nn(Cc3ccccc3)cc2C(=O)N[C@@H]2CCN(C3CC3)C2)cc1C ZINC000521223600 929066436 /nfs/dbraw/zinc/06/64/36/929066436.db2.gz FYLKJYDRDLNDFL-JOCHJYFZSA-N 0 3 414.553 4.182 20 0 HIADHN C[C@@H](NC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1)c1nc(-c2ccncc2)cs1 ZINC000521357940 929178911 /nfs/dbraw/zinc/17/89/11/929178911.db2.gz DRWDLXIJKICGAV-APWZRJJASA-N 0 3 424.545 4.434 20 0 HIADHN O=C(CN1CCCCC[C@@H]1c1ccccc1)NCc1ccc(C(=O)N2CCCC2)cc1 ZINC000521425081 929216299 /nfs/dbraw/zinc/21/62/99/929216299.db2.gz HOEQLGRVIIHYTG-XMMPIXPASA-N 0 3 419.569 4.156 20 0 HIADHN CSc1cc(C(=O)NC[C@@H]2CCCCN2Cc2ccccc2)ccc1NC(C)=O ZINC000521479271 929242143 /nfs/dbraw/zinc/24/21/43/929242143.db2.gz LQQQDHPKCJWOMP-FQEVSTJZSA-N 0 3 411.571 4.151 20 0 HIADHN O=C(CC1(N2CCOCC2)CCCC1)N[C@@H](c1cccc(C(F)(F)F)c1)C1CC1 ZINC000521636839 929337714 /nfs/dbraw/zinc/33/77/14/929337714.db2.gz OGIYKTHIKSGKNC-HXUWFJFHSA-N 0 3 410.480 4.308 20 0 HIADHN COC(=O)c1c(C)c(C)sc1NC(=O)N(CCCc1ccccc1)CCN(C)C ZINC000521746389 929406312 /nfs/dbraw/zinc/40/63/12/929406312.db2.gz HCKYSVXNZCGFCA-UHFFFAOYSA-N 0 3 417.575 4.180 20 0 HIADHN CCCN(CC(=O)NCc1ccc(C(=O)N2CCCC2)cc1)[C@H](CC)c1ccccc1 ZINC000521820110 929477531 /nfs/dbraw/zinc/47/75/31/929477531.db2.gz VIGROGVSPJHPDE-XMMPIXPASA-N 0 3 421.585 4.402 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)[C@@H](c1ccccc1)N1CCSCC1)c1ccsc1 ZINC000521836574 929487908 /nfs/dbraw/zinc/48/79/08/929487908.db2.gz LEKIYQZSFGMCSG-LEWJYISDSA-N 0 3 417.644 4.037 20 0 HIADHN COc1ccc([C@@H](CNC(=O)NCc2ccccc2C(F)(F)F)N2CCCC2)cc1 ZINC000521891511 929540016 /nfs/dbraw/zinc/54/00/16/929540016.db2.gz RVEWZQSLGAFENY-HXUWFJFHSA-N 0 3 421.463 4.350 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)N(C)Cc2ccc(SC)c(OC)c2)N(C)C)cc1 ZINC000521897457 929543893 /nfs/dbraw/zinc/54/38/93/929543893.db2.gz DLUGRNSANPXYDD-HXUWFJFHSA-N 0 3 415.603 4.424 20 0 HIADHN Cc1ccc([C@H](CNC(=O)NCCc2cccc3cccnc32)N2CCCC2)cc1 ZINC000521991110 929615041 /nfs/dbraw/zinc/61/50/41/929615041.db2.gz LBJBLIWWICOVCE-QHCPKHFHSA-N 0 3 402.542 4.222 20 0 HIADHN COc1cc(NC(=O)NC[C@@H]2CCCN2Cc2ccccc2)c(OC)cc1Cl ZINC000524480934 929630587 /nfs/dbraw/zinc/63/05/87/929630587.db2.gz AMDBUVMUPWOEAD-INIZCTEOSA-N 0 3 403.910 4.143 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)N[C@@H]2CCOc3c(Cl)cccc32)c1 ZINC000524516787 929661251 /nfs/dbraw/zinc/66/12/51/929661251.db2.gz KTFOUYBCOCHKSP-HXUWFJFHSA-N 0 3 401.938 4.245 20 0 HIADHN C[S@](=O)Cc1cc(NC(=O)[C@@H]2CCCN(Cc3ccccc3)C2)ccc1Cl ZINC000524545949 929676240 /nfs/dbraw/zinc/67/62/40/929676240.db2.gz PSLSXOYYFFRBPT-CRYYWNKWSA-N 0 3 404.963 4.069 20 0 HIADHN CC(C)[C@H](C(=O)Nc1ccc(F)c(NC(=O)Cc2ccccc2)c1)N1CCCCC1 ZINC000524707460 929806427 /nfs/dbraw/zinc/80/64/27/929806427.db2.gz QRYJHAQTIZLMTG-HSZRJFAPSA-N 0 3 411.521 4.456 20 0 HIADHN COc1ccc(OC2CCN(C(=O)c3oc4ccccc4c3CN(C)C)CC2)cc1 ZINC000524713265 929807522 /nfs/dbraw/zinc/80/75/22/929807522.db2.gz DYZKPHZSYXKSHD-UHFFFAOYSA-N 0 3 408.498 4.187 20 0 HIADHN COc1ccc([C@@H](NC(=O)CC2(N3CCOCC3)CCCC2)c2ccc(C)cc2)cc1 ZINC000524723550 929810737 /nfs/dbraw/zinc/81/07/37/929810737.db2.gz NFLBPUYMGUIQAB-VWLOTQADSA-N 0 3 422.569 4.244 20 0 HIADHN COc1cccc(NC2CCN(CCOc3ccc(Br)cc3)CC2)c1 ZINC000524791685 929829961 /nfs/dbraw/zinc/82/99/61/929829961.db2.gz CBENDJXSMHZGAE-UHFFFAOYSA-N 0 3 405.336 4.413 20 0 HIADHN Cc1cccc(NC(=O)NCCCCN2CCN(c3ccccc3)CC2)c1Cl ZINC000524796222 929832201 /nfs/dbraw/zinc/83/22/01/929832201.db2.gz JUJMBSSHTVOAEH-UHFFFAOYSA-N 0 3 400.954 4.372 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2ccc(O[C@H]3CCOC3)cc2)N2CCCC2)cc1 ZINC000524799540 929834142 /nfs/dbraw/zinc/83/41/42/929834142.db2.gz HAHTUJVUWUKABU-XZOQPEGZSA-N 0 3 409.530 4.121 20 0 HIADHN O=C(CCc1ccccc1Cl)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000524817362 929841693 /nfs/dbraw/zinc/84/16/93/929841693.db2.gz WTSGXWLBBKJYKC-UHFFFAOYSA-N 0 3 404.913 4.071 20 0 HIADHN CCc1c(C(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)cnn1Cc1ccccc1 ZINC000524866600 929864616 /nfs/dbraw/zinc/86/46/16/929864616.db2.gz DYTDLZYRDLJDNA-OAQYLSRUSA-N 0 3 416.569 4.230 20 0 HIADHN Cc1[nH]c2ccccc2c1CCNC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C ZINC000524882919 929871178 /nfs/dbraw/zinc/87/11/78/929871178.db2.gz OKCKOHDKLZDUDM-LJQANCHMSA-N 0 3 404.558 4.325 20 0 HIADHN CCCN(Cc1ccc(OC)c(OC)c1Br)[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000524908108 929883993 /nfs/dbraw/zinc/88/39/93/929883993.db2.gz NHPDEAQZCHJPKN-NIKGAXFTSA-N 0 3 412.368 4.492 20 0 HIADHN CC(C)C(=O)Nc1cccc(NC(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)c1 ZINC000524928126 929894732 /nfs/dbraw/zinc/89/47/32/929894732.db2.gz LAQSESLLPLSJFW-LJQANCHMSA-N 0 3 408.546 4.409 20 0 HIADHN COc1ccc(NC(=O)[C@H](N[C@@H]2[C@H]3CCO[C@@H]3C2(C)C)c2ccccc2)cc1Cl ZINC000524944426 929906576 /nfs/dbraw/zinc/90/65/76/929906576.db2.gz FIBXPCZPRPPOLS-OTNPHJDUSA-N 0 3 414.933 4.432 20 0 HIADHN COc1ccc(C)cc1-n1ccc(C(=O)NC[C@H]2CCCN(C)[C@@H]2c2cccs2)n1 ZINC000525036016 929992895 /nfs/dbraw/zinc/99/28/95/929992895.db2.gz MRTQQGXLBXVKOX-VGSWGCGISA-N 0 3 424.570 4.064 20 0 HIADHN CC(C)CN(C(=O)c1cc(NC(=O)NC(C)(C)C)ccc1Cl)C1CCN(C)CC1 ZINC000525059563 930009959 /nfs/dbraw/zinc/00/99/59/930009959.db2.gz HBDRSMJHVWIVCF-UHFFFAOYSA-N 0 3 423.001 4.452 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1ccc(CNC(=O)C(C)(C)C)cc1)c1ccsc1 ZINC000525062730 930011448 /nfs/dbraw/zinc/01/14/48/930011448.db2.gz YJCIUOJULKKFCY-HXUWFJFHSA-N 0 3 415.603 4.223 20 0 HIADHN Cc1cc(C(=O)Nc2cccc(CN(C)C)c2)cc(C)c1OCC(=O)N1CCCCC1 ZINC000525065223 930012669 /nfs/dbraw/zinc/01/26/69/930012669.db2.gz RECYKAJBDWSNEU-UHFFFAOYSA-N 0 3 423.557 4.009 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)Cc2ccc3ccccc3c2)cc1)[C@@H]1CCCN(C)C1 ZINC000525065442 930012764 /nfs/dbraw/zinc/01/27/64/930012764.db2.gz WWQLVHYMSWCVJW-XMMPIXPASA-N 0 3 415.537 4.187 20 0 HIADHN C[C@@H]1CN(CC(=O)N(C)Cc2ccc(OC(F)F)cc2)CC[C@H]1c1ccccc1 ZINC000525121735 930048512 /nfs/dbraw/zinc/04/85/12/930048512.db2.gz BYKSBNJBSLZHCO-DYESRHJHSA-N 0 3 402.485 4.372 20 0 HIADHN CCN(Cc1ccc(OC)c(OC)c1)C(=O)CN1CC[C@@H](c2ccccc2)[C@@H](C)C1 ZINC000525122238 930048988 /nfs/dbraw/zinc/04/89/88/930048988.db2.gz BRDIZYVJZGOWHZ-SIKLNZKXSA-N 0 3 410.558 4.178 20 0 HIADHN CN1CCN(c2ccncc2NC(=O)C[C@@H](Cc2ccccc2)c2ccccc2)CC1 ZINC000525144406 930062701 /nfs/dbraw/zinc/06/27/01/930062701.db2.gz PBIUCQIXENSJRP-HSZRJFAPSA-N 0 3 414.553 4.189 20 0 HIADHN CC(C)c1nc(C(=O)N[C@H](CN2CCCC2)c2ccccc2)nn1-c1ccccc1F ZINC000525162021 930072589 /nfs/dbraw/zinc/07/25/89/930072589.db2.gz WSGWJBXONMQDHP-HXUWFJFHSA-N 0 3 421.520 4.097 20 0 HIADHN COc1cc(CNC(=O)c2oc3ccccc3c2CN(C)C)ccc1OC(F)F ZINC000525237801 930099625 /nfs/dbraw/zinc/09/96/25/930099625.db2.gz QNINFYCWSMXTJK-UHFFFAOYSA-N 0 3 404.413 4.034 20 0 HIADHN COc1cc(-c2nnc(CN3C[C@@H](c4ccccc4C)C[C@H]3C)o2)cc(OC)c1OC ZINC000525272598 930124874 /nfs/dbraw/zinc/12/48/74/930124874.db2.gz AGYKFKUJNWONRW-AEFFLSMTSA-N 0 3 423.513 4.449 20 0 HIADHN CC(C)c1ccc([C@@H]2C[C@@H]2C(=O)Nc2ccccc2CN2CCC[C@@H](C(N)=O)C2)cc1 ZINC000525314598 930152311 /nfs/dbraw/zinc/15/23/11/930152311.db2.gz QADOBDBGDOVCIV-VJBWXMMDSA-N 0 3 419.569 4.250 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)c1ccnc(SCC(F)(F)F)c1 ZINC000525383154 930210671 /nfs/dbraw/zinc/21/06/71/930210671.db2.gz YIXBTOWBNBMFMK-MRXNPFEDSA-N 0 3 423.504 4.473 20 0 HIADHN CN(Cc1ccccc1)c1ccccc1NC(=O)CC1(N2CCOCC2)CCCC1 ZINC000525385179 930210863 /nfs/dbraw/zinc/21/08/63/930210863.db2.gz SFHNCJFJSHMFNQ-UHFFFAOYSA-N 0 3 407.558 4.297 20 0 HIADHN COc1ccc(C(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)c(Br)c1 ZINC000525384930 930211715 /nfs/dbraw/zinc/21/17/15/930211715.db2.gz LXTDJBFRAAENKW-MRXNPFEDSA-N 0 3 417.347 4.194 20 0 HIADHN CCCN(C(=O)NC[C@H](CC)N1CCc2ccccc2C1)[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000525418874 930230148 /nfs/dbraw/zinc/23/01/48/930230148.db2.gz BUFJZPZSVPPNJO-WBADGQHESA-N 0 3 413.606 4.058 20 0 HIADHN CC1CCN([C@@H](CNC(=O)Nc2cnn(CC(F)(F)F)c2)c2cccs2)CC1 ZINC000525421059 930231698 /nfs/dbraw/zinc/23/16/98/930231698.db2.gz BXPHLNSOKWVOJY-HNNXBMFYSA-N 0 3 415.485 4.102 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)N[C@H]1C[C@@H]1c1c(F)cccc1Cl ZINC000525445135 930243356 /nfs/dbraw/zinc/24/33/56/930243356.db2.gz APFWGONRIJCPQD-KXBFYZLASA-N 0 3 407.892 4.248 20 0 HIADHN COc1ccc([C@@H](CNC(=O)Nc2ccccc2OCC2CC2)N2CCCC2)cc1 ZINC000525451460 930248702 /nfs/dbraw/zinc/24/87/02/930248702.db2.gz GMSOSRXJYVCMQV-JOCHJYFZSA-N 0 3 409.530 4.443 20 0 HIADHN COc1ccc([C@H](CNC(=O)Nc2ccccc2OCC2CC2)N2CCCC2)cc1 ZINC000525451461 930249014 /nfs/dbraw/zinc/24/90/14/930249014.db2.gz GMSOSRXJYVCMQV-QFIPXVFZSA-N 0 3 409.530 4.443 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)[C@H]1C[C@@H]1c1cccc(F)c1F ZINC000525542258 930315984 /nfs/dbraw/zinc/31/59/84/930315984.db2.gz HOHFPZFRDYVEPT-MOPGFXCFSA-N 0 3 402.510 4.298 20 0 HIADHN Cc1cc2[nH]c(C(=O)Nc3ccc(C(=O)N(C)[C@@H]4CCCN(C)C4)cc3)cc2c(C)c1 ZINC000525614958 930362934 /nfs/dbraw/zinc/36/29/34/930362934.db2.gz UCHSGDFMILHVHJ-HXUWFJFHSA-N 0 3 418.541 4.203 20 0 HIADHN COc1ccc(-c2ccc(CNC(=O)[C@@H]3CCCN(Cc4cccnc4)C3)cc2)cc1 ZINC000525678141 930401202 /nfs/dbraw/zinc/40/12/02/930401202.db2.gz CQDKNUYZLXRHBW-XMMPIXPASA-N 0 3 415.537 4.286 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N2CCO[C@H](c3ccccc3C)C2)N2CCCC2)cc1 ZINC000525809359 930452214 /nfs/dbraw/zinc/45/22/14/930452214.db2.gz HJBJGABPZIGGOO-ZEQRLZLVSA-N 0 3 407.558 4.223 20 0 HIADHN C[C@@H](N[C@H](CN1CCN(C)CC1)c1ccccc1)c1ccc(Br)cc1F ZINC000525857692 930469569 /nfs/dbraw/zinc/46/95/69/930469569.db2.gz SRMDYUCVMSRHHP-IIBYNOLFSA-N 0 3 420.370 4.228 20 0 HIADHN C[C@H](CN[C@H](C(N)=O)c1cccc(Br)c1)c1ccc(C(F)(F)F)cc1 ZINC000525952073 930492058 /nfs/dbraw/zinc/49/20/58/930492058.db2.gz HKEDTVIGDSDZTP-BZNIZROVSA-N 0 3 415.253 4.388 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)C(=O)Nc1ccc2c(c1)C(C)(C)CC2(C)C ZINC000526810267 930546501 /nfs/dbraw/zinc/54/65/01/930546501.db2.gz UPFRQYAKGNAHAT-UHFFFAOYSA-N 0 3 423.557 4.293 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1ccnc(Oc2ccccc2)c1 ZINC000526945619 930554484 /nfs/dbraw/zinc/55/44/84/930554484.db2.gz TZFFDPTXRQFYKL-UHFFFAOYSA-N 0 3 419.447 4.409 20 0 HIADHN CC(C)c1nc2c([nH]1)C[C@@H](C(=O)NC[C@@H](c1ccccc1Cl)N1CCCC1)CC2 ZINC000526967379 930559749 /nfs/dbraw/zinc/55/97/49/930559749.db2.gz GAMWCVKBLSPKBL-KKSFZXQISA-N 0 3 414.981 4.245 20 0 HIADHN CC(C)c1nc2c([nH]1)CC[C@H](C(=O)NC[C@@H](c1ccccc1Cl)N1CCCC1)C2 ZINC000526967379 930559755 /nfs/dbraw/zinc/55/97/55/930559755.db2.gz GAMWCVKBLSPKBL-KKSFZXQISA-N 0 3 414.981 4.245 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2cc3c(cc2Cl)OCCCO3)[C@@H]1c1ccccc1 ZINC000530409733 930703893 /nfs/dbraw/zinc/70/38/93/930703893.db2.gz IWNMHKVRHRNLNW-JXFKEZNVSA-N 0 3 401.894 4.068 20 0 HIADHN C[C@@H]1CCCCN1C(=O)c1ccc(NC(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)cc1 ZINC000530409868 930704693 /nfs/dbraw/zinc/70/46/93/930704693.db2.gz VZPAYNMUOGKDOU-SXSPYAJSSA-N 0 3 420.557 4.268 20 0 HIADHN Fc1ccccc1C[C@H](NCCc1cnccn1)c1ccccc1Br ZINC000530412670 930706006 /nfs/dbraw/zinc/70/60/06/930706006.db2.gz CZZASSHHAZMNGU-FQEVSTJZSA-N 0 3 400.295 4.494 20 0 HIADHN COc1ccc2nc(CN[C@H]3CCN(C4CC4)[C@H]3c3cccc(OC)c3)sc2c1 ZINC000530545688 930742750 /nfs/dbraw/zinc/74/27/50/930742750.db2.gz KMMVSAYHDFQHBS-REWPJTCUSA-N 0 3 409.555 4.381 20 0 HIADHN O=C(CC1(N2CCOCC2)CCCC1)N1Cc2ccccc2[C@H](c2ccccc2)C1 ZINC000530571721 930753729 /nfs/dbraw/zinc/75/37/29/930753729.db2.gz LVCJVGNTJNRJHY-DEOSSOPVSA-N 0 3 404.554 4.196 20 0 HIADHN CCOc1ccc([C@@H](NC(=O)CC2(N3CCOCC3)CCCC2)c2ccccc2)cc1 ZINC000530572153 930753963 /nfs/dbraw/zinc/75/39/63/930753963.db2.gz KYWUOKUERVAJAI-VWLOTQADSA-N 0 3 422.569 4.326 20 0 HIADHN COc1ccc(Cc2noc([C@]3(C(F)(F)F)CCN(Cc4ccccc4)C3)n2)cc1 ZINC000530640361 930784229 /nfs/dbraw/zinc/78/42/29/930784229.db2.gz AEGLPUVOMKUELK-NRFANRHFSA-N 0 3 417.431 4.375 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@H](C)NCc2c[nH]c(-c3ccccc3)n2)CC1 ZINC000530646845 930786075 /nfs/dbraw/zinc/78/60/75/930786075.db2.gz OTEBBGUMSRQCAV-SFHVURJKSA-N 0 3 407.537 4.209 20 0 HIADHN Cc1[nH]c(=O)c(C(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)cc1-c1ccccc1 ZINC000530684514 930797708 /nfs/dbraw/zinc/79/77/08/930797708.db2.gz BJTZNISTIDUUGX-WIYYLYMNSA-N 0 3 401.510 4.328 20 0 HIADHN Cc1[nH]c(=O)c(C(=O)N(CCN(C)C)Cc2ccc(F)cc2)cc1-c1ccccc1 ZINC000530697856 930800249 /nfs/dbraw/zinc/80/02/49/930800249.db2.gz RWGCXQKIQMFBDF-UHFFFAOYSA-N 0 3 407.489 4.106 20 0 HIADHN Cc1ccc2cccc(S(=O)(=O)N(C)[C@H]3CCN(Cc4ccccc4)[C@@H](C)C3)c2n1 ZINC000530771922 930820554 /nfs/dbraw/zinc/82/05/54/930820554.db2.gz OMJSEONZFGGYSG-UGKGYDQZSA-N 0 3 423.582 4.217 20 0 HIADHN Cc1ccc2cccc(S(=O)(=O)N(C)[C@H]3CCN(Cc4ccccc4)[C@H](C)C3)c2n1 ZINC000530771917 930820640 /nfs/dbraw/zinc/82/06/40/930820640.db2.gz OMJSEONZFGGYSG-KNQAVFIVSA-N 0 3 423.582 4.217 20 0 HIADHN CN(C)Cc1ccc(-c2noc(-c3ccc(=O)n(Cc4ccccc4Cl)c3)n2)cc1 ZINC000530871966 930845038 /nfs/dbraw/zinc/84/50/38/930845038.db2.gz XIGLVGYZTQKRDW-UHFFFAOYSA-N 0 3 420.900 4.329 20 0 HIADHN COc1ccc(-c2noc([C@]3(C(F)(F)F)CCN(Cc4ccccc4)C3)n2)cc1 ZINC000530879303 930847508 /nfs/dbraw/zinc/84/75/08/930847508.db2.gz SXRROYGDZKNIJO-FQEVSTJZSA-N 0 3 403.404 4.451 20 0 HIADHN O=C(CN[C@H](c1ccccc1)C(F)(F)F)N(CCN1CCCC1)c1ccccc1 ZINC000531059662 930901320 /nfs/dbraw/zinc/90/13/20/930901320.db2.gz LUKAMNKKSOFTML-OAQYLSRUSA-N 0 3 405.464 4.009 20 0 HIADHN Cc1c(C(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)cnn1-c1ccc(F)cc1F ZINC000531062685 930902974 /nfs/dbraw/zinc/90/29/74/930902974.db2.gz KRVCAAHOPWOOMX-FQEVSTJZSA-N 0 3 424.495 4.196 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)c2cc(F)ccc2Br)CC1 ZINC000531157078 930947813 /nfs/dbraw/zinc/94/78/13/930947813.db2.gz BXBCOEJXRUGYIH-UHFFFAOYSA-N 0 3 405.311 4.325 20 0 HIADHN CSc1ccc(N2C[C@@H](c3nc(-c4ccc(CN(C)C)cc4)no3)CC2=O)cc1 ZINC000531348419 931026821 /nfs/dbraw/zinc/02/68/21/931026821.db2.gz FLQPRJIRZTVPCZ-KRWDZBQOSA-N 0 3 408.527 4.041 20 0 HIADHN Cc1[nH]c(=O)c(C(=O)N(CCN(C)C)Cc2cccc(F)c2)cc1-c1ccccc1 ZINC000531414744 931048393 /nfs/dbraw/zinc/04/83/93/931048393.db2.gz RXNZQAXLJCMCLP-UHFFFAOYSA-N 0 3 407.489 4.106 20 0 HIADHN CCc1nc(CN(C)C(=O)N[C@@H](CN2CCc3ccccc3C2)C(C)(C)C)cs1 ZINC000531423975 931051678 /nfs/dbraw/zinc/05/16/78/931051678.db2.gz LIVFHGZIFSKKKW-FQEVSTJZSA-N 0 3 414.619 4.320 20 0 HIADHN c1ccc(-c2nc3c(s2)[C@H](NCc2ccc(N4CCOCC4)nc2)CCC3)cc1 ZINC000531689495 931153751 /nfs/dbraw/zinc/15/37/51/931153751.db2.gz JSUCEWDNANSFIG-LJQANCHMSA-N 0 3 406.555 4.209 20 0 HIADHN COc1cc([C@@H](C)N[C@H](C)c2ccc(NS(C)(=O)=O)cc2)ccc1OC(C)C ZINC000531689843 931155051 /nfs/dbraw/zinc/15/50/51/931155051.db2.gz UYDCHVLIKSDFQF-HZPDHXFCSA-N 0 3 406.548 4.266 20 0 HIADHN CNC(=O)c1cccc(CN[C@H]2CCCc3nc(-c4ccc(OC)cc4)sc32)c1 ZINC000531694014 931157430 /nfs/dbraw/zinc/15/74/30/931157430.db2.gz QSGHEWVDUJTWSW-IBGZPJMESA-N 0 3 407.539 4.346 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)NCc2cccc(NC(=O)[C@H]3CCCO3)c2)cc1 ZINC000531695448 931158766 /nfs/dbraw/zinc/15/87/66/931158766.db2.gz VFNIEAQNMJFGKM-UZUQRXQVSA-N 0 3 404.514 4.149 20 0 HIADHN COc1ccc(NC(=O)C[C@H](C)N[C@@H](c2ccc(F)cc2)[C@@H]2CCCO2)c(OC)c1 ZINC000531706788 931167171 /nfs/dbraw/zinc/16/71/71/931167171.db2.gz HXGOLXJTQDSJFO-RSDPBLMXSA-N 0 3 416.493 4.070 20 0 HIADHN C[C@H](CC(=O)Nc1ccccc1C(F)(F)F)N[C@H]1CCCN(c2ccccc2)C1=O ZINC000531711486 931169995 /nfs/dbraw/zinc/16/99/95/931169995.db2.gz JLQRQTMXYBNANS-BEFAXECRSA-N 0 3 419.447 4.208 20 0 HIADHN Cc1cccc([C@H]2CCCN2CCC(=O)Nc2ccc(Br)cc2F)n1 ZINC000531733575 931177349 /nfs/dbraw/zinc/17/73/49/931177349.db2.gz RHXJPRHQGAOHSO-GOSISDBHSA-N 0 3 406.299 4.457 20 0 HIADHN CC(=O)N1CCC(N[C@H](C)c2nc(-c3ccc(Br)cc3)cs2)CC1 ZINC000531733482 931177383 /nfs/dbraw/zinc/17/73/83/931177383.db2.gz YITSZZWOKJJAJJ-GFCCVEGCSA-N 0 3 408.365 4.234 20 0 HIADHN Cc1nc(-c2ccc(CNC(=O)N(CCN(C)C)Cc3ccco3)s2)cs1 ZINC000531776805 931192898 /nfs/dbraw/zinc/19/28/98/931192898.db2.gz WCFIHKZPMZCKAZ-UHFFFAOYSA-N 0 3 404.561 4.046 20 0 HIADHN Cc1noc(-c2ccc(C)c(NC(=O)N[C@@H]3C[C@@H](C)N(Cc4ccccc4)C3)c2)n1 ZINC000531812331 931206973 /nfs/dbraw/zinc/20/69/73/931206973.db2.gz JMJUCFJZKHQIJV-OXQOHEQNSA-N 0 3 405.502 4.138 20 0 HIADHN C[C@@H](NC(=O)[C@@H]1CCCN(Cc2cccnc2)C1)c1ccc(OCC2CC2)c(F)c1 ZINC000531834826 931213225 /nfs/dbraw/zinc/21/32/25/931213225.db2.gz NCGRGGSQZUURSQ-DYESRHJHSA-N 0 3 411.521 4.099 20 0 HIADHN CC(C)N1CCN([C@H]2CCN(C(=O)N[C@@H](CC(C)(C)C)c3ccc(F)cc3)C2)CC1 ZINC000531839628 931216141 /nfs/dbraw/zinc/21/61/41/931216141.db2.gz UKDLBNOOIFBBCC-VXKWHMMOSA-N 0 3 418.601 4.113 20 0 HIADHN CCCO[C@H]1CCCN(CC(=O)N[C@@H](C)c2ccc(OC(F)(F)F)cc2)CC1 ZINC000531904940 931242109 /nfs/dbraw/zinc/24/21/09/931242109.db2.gz SAKAUFWLRSXDTF-RDJZCZTQSA-N 0 3 402.457 4.044 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)N2CCC(Nc3ccc(F)cc3)CC2)C1 ZINC000531935582 931253115 /nfs/dbraw/zinc/25/31/15/931253115.db2.gz XUZXANJOTLVPOK-FDDCHVKYSA-N 0 3 410.537 4.247 20 0 HIADHN COCC(=O)Nc1cccc(CN[C@H]2C[C@H](C)c3c2cccc3Br)c1 ZINC000531943184 931256161 /nfs/dbraw/zinc/25/61/61/931256161.db2.gz WKVYQGHSCWDRAC-UGSOOPFHSA-N 0 3 403.320 4.372 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)N[C@@H](CN2CCOCC2)c2ccc(C)cc2)cc1 ZINC000531945921 931257609 /nfs/dbraw/zinc/25/76/09/931257609.db2.gz YQTFSEDZZVYEAG-CPJSRVTESA-N 0 3 404.558 4.213 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)N[C@@H](CN2CCOCC2)c2ccc(C)cc2)cc1 ZINC000531945923 931257782 /nfs/dbraw/zinc/25/77/82/931257782.db2.gz YQTFSEDZZVYEAG-NLFFAJNJSA-N 0 3 404.558 4.213 20 0 HIADHN COc1ccc(-c2nc(C)c([C@H](C)NCc3ccc(N4CCOCC4)nc3)s2)cc1 ZINC000531945265 931258116 /nfs/dbraw/zinc/25/81/16/931258116.db2.gz RPNIMLPPRSSZTF-INIZCTEOSA-N 0 3 424.570 4.210 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCC[C@@H]1c1cccc(C)n1)c1cccc(OC)c1 ZINC000531963193 931266693 /nfs/dbraw/zinc/26/66/93/931266693.db2.gz QFYNJYLNEOTDSX-DHIUTWEWSA-N 0 3 410.562 4.328 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)cc1 ZINC000531963832 931267653 /nfs/dbraw/zinc/26/76/53/931267653.db2.gz BDLBWHFBFFBUPR-DVECYGJZSA-N 0 3 402.542 4.065 20 0 HIADHN COc1ccc([C@H](C)[C@H](C)NCc2csc(CNC(=O)c3ccccc3)n2)cc1 ZINC000531977202 931273042 /nfs/dbraw/zinc/27/30/42/931273042.db2.gz OUSKPQLCXIWFNY-SJORKVTESA-N 0 3 409.555 4.364 20 0 HIADHN C[C@@H](NCC(=O)N1CCC(Cc2ccccc2)CC1)c1ccc(-n2cccn2)cc1 ZINC000531994667 931279303 /nfs/dbraw/zinc/27/93/03/931279303.db2.gz RAZQJPBYPCXZKE-HXUWFJFHSA-N 0 3 402.542 4.004 20 0 HIADHN C[C@H](NCC(=O)N1CCC(Cc2ccccc2)CC1)c1ccc(-n2cccn2)cc1 ZINC000531994666 931279690 /nfs/dbraw/zinc/27/96/90/931279690.db2.gz RAZQJPBYPCXZKE-FQEVSTJZSA-N 0 3 402.542 4.004 20 0 HIADHN CC(C)N1CCN([C@H]2CCN(C(=O)C3(Cc4cccc(Cl)c4)CCCC3)C2)CC1 ZINC000532088641 931307533 /nfs/dbraw/zinc/30/75/33/931307533.db2.gz CABZHKUXJICGOM-QFIPXVFZSA-N 0 3 418.025 4.070 20 0 HIADHN CC(C)N1CCN([C@H]2CCN(C(=O)N[C@@H](CC3CCCCC3)C(C)(C)C)C2)CC1 ZINC000532094947 931309730 /nfs/dbraw/zinc/30/97/30/931309730.db2.gz XSQVPXBFQJYALB-VXKWHMMOSA-N 0 3 406.659 4.181 20 0 HIADHN CC(C)(C)OC(=O)C[C@H]1CCCN(C(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)C1 ZINC000532126366 931322389 /nfs/dbraw/zinc/32/23/89/931322389.db2.gz BGDZHFKEGKRXMN-UXHICEINSA-N 0 3 418.553 4.008 20 0 HIADHN C[C@@H](NCc1ccc(N2CCOCC2)nc1)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000532200372 931347528 /nfs/dbraw/zinc/34/75/28/931347528.db2.gz JVJUYLBUHVOGKE-LJQANCHMSA-N 0 3 421.516 4.487 20 0 HIADHN Cc1c([C@@H](C)N[C@H](C)c2ccc(NS(C)(=O)=O)cc2)cnn1-c1ccc(F)cc1 ZINC000532217996 931357973 /nfs/dbraw/zinc/35/79/73/931357973.db2.gz KPTWKKSSUZVFTF-HUUCEWRRSA-N 0 3 416.522 4.103 20 0 HIADHN COCCOc1cccc(CNCc2ccc(C(=O)Nc3ccc(F)cc3)cc2)c1 ZINC000532374155 931414312 /nfs/dbraw/zinc/41/43/12/931414312.db2.gz JFACIWYNOIMALD-UHFFFAOYSA-N 0 3 408.473 4.393 20 0 HIADHN FC(F)(F)c1cnc(N2CC[C@@H](NCc3cnc(C4CC4)s3)C2)c(Cl)c1 ZINC000532393994 931421484 /nfs/dbraw/zinc/42/14/84/931421484.db2.gz KIJOXDOHUNKCQE-GFCCVEGCSA-N 0 3 402.873 4.456 20 0 HIADHN COc1ccc2oc(C(=O)Nc3cccc(CN4CCC(CO)CC4)c3)c(C)c2c1 ZINC000532417659 931428987 /nfs/dbraw/zinc/42/89/87/931428987.db2.gz LWEHEOSTTRCDGG-UHFFFAOYSA-N 0 3 408.498 4.206 20 0 HIADHN C[C@@H](NCc1ccc(OCC(F)(F)F)nc1)c1ccc(OCc2nccn2C)cc1 ZINC000532446289 931437545 /nfs/dbraw/zinc/43/75/45/931437545.db2.gz XVDOFRWTDXHODO-OAHLLOKOSA-N 0 3 420.435 4.186 20 0 HIADHN Cc1c([C@H](C)N[C@H](C)CC(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)cnn1C ZINC000532448013 931438297 /nfs/dbraw/zinc/43/82/97/931438297.db2.gz DKJKAOGTALZLER-MNOVXSKESA-N 0 3 402.848 4.469 20 0 HIADHN Cc1nc(-c2cc([C@@H](C)NCc3ccc(N4CCN(C)CC4)nc3)cs2)cs1 ZINC000532451523 931439475 /nfs/dbraw/zinc/43/94/75/931439475.db2.gz BKYSIOAMRRDMDF-OAHLLOKOSA-N 0 3 413.616 4.178 20 0 HIADHN C[C@H](NCc1ccc(N2CCN(C)CC2)nc1)c1ccc(SCC(F)F)cc1 ZINC000532452163 931440377 /nfs/dbraw/zinc/44/03/77/931440377.db2.gz YBQFWIDMGXKVAE-INIZCTEOSA-N 0 3 406.546 4.041 20 0 HIADHN C[C@@H](COc1ccc2cc(Br)ccc2c1)NCc1cccc(C(N)=O)c1 ZINC000532452927 931441599 /nfs/dbraw/zinc/44/15/99/931441599.db2.gz LAACOZXUTTUSGJ-AWEZNQCLSA-N 0 3 413.315 4.258 20 0 HIADHN CCN(CCCC(=O)Nc1c(C)cc(C)cc1C)CC(=O)NCc1ccc(F)cc1 ZINC000532466885 931447419 /nfs/dbraw/zinc/44/74/19/931447419.db2.gz RWZQTTUUKCMEHO-UHFFFAOYSA-N 0 3 413.537 4.108 20 0 HIADHN CC[C@@H](N[C@H](CN1CCN(C)CC1)c1ccccc1)c1ccccc1OC(F)F ZINC000532481119 931455448 /nfs/dbraw/zinc/45/54/48/931455448.db2.gz OXLKUMSYHOTUKE-NHCUHLMSSA-N 0 3 403.517 4.317 20 0 HIADHN C[C@@H](C(=O)N(c1nccs1)C1CCCCC1)N1CCN(CCC(C)(C)C)CC1 ZINC000532493217 931460436 /nfs/dbraw/zinc/46/04/36/931460436.db2.gz CBYALGJXIINTND-SFHVURJKSA-N 0 3 406.640 4.251 20 0 HIADHN Cc1cc(NC(=O)N[C@H](C)Cc2ccsc2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000532507757 931467730 /nfs/dbraw/zinc/46/77/30/931467730.db2.gz NKIODVNOFXZTPE-DYESRHJHSA-N 0 3 423.586 4.453 20 0 HIADHN Cc1cc(NC(=O)c2cc3ccccc3n2C)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000532513618 931469676 /nfs/dbraw/zinc/46/96/76/931469676.db2.gz KBBWCWRHKLVRTR-NRFANRHFSA-N 0 3 413.525 4.383 20 0 HIADHN Cc1cccc(O[C@@H]2CCCC[C@@H]2NC(=O)[C@H]2CCCN(Cc3cccnc3)C2)c1 ZINC000532516149 931470883 /nfs/dbraw/zinc/47/08/83/931470883.db2.gz ZTCQFEUXZQDFAO-OEMFJLHTSA-N 0 3 407.558 4.108 20 0 HIADHN O=C(CN1CCC[C@@H](c2ccccc2)CC1)N1CCC(OCc2ccccc2)CC1 ZINC000532519574 931472186 /nfs/dbraw/zinc/47/21/86/931472186.db2.gz SGNKQZHEMRDYKY-XMMPIXPASA-N 0 3 406.570 4.464 20 0 HIADHN C[C@H](CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)N[C@@H]1c2ccccc2C[C@H]1O ZINC000532520983 931473427 /nfs/dbraw/zinc/47/34/27/931473427.db2.gz KMQLZKWFWPUQIG-BAXPTACRSA-N 0 3 412.839 4.324 20 0 HIADHN O=C(NCCNCc1cnc(C2CCCC2)s1)c1cccc(Br)c1 ZINC000532620482 931556877 /nfs/dbraw/zinc/55/68/77/931556877.db2.gz ICDQDNPNRPDARM-UHFFFAOYSA-N 0 3 408.365 4.083 20 0 HIADHN Cn1ccnc1COc1ccc(CN2CC[C@H](OCCCc3ccccc3)C2)cc1 ZINC000532651241 931569262 /nfs/dbraw/zinc/56/92/62/931569262.db2.gz JYWCGRHCLKDRGZ-DEOSSOPVSA-N 0 3 405.542 4.223 20 0 HIADHN COc1ccc([C@@H](NCCOC[C@@H]2CCCO2)c2ccccc2)cc1Br ZINC000532697658 931592355 /nfs/dbraw/zinc/59/23/55/931592355.db2.gz LIWMOTFQERPJSI-RXVVDRJESA-N 0 3 420.347 4.332 20 0 HIADHN C[C@@H]1CC[C@@H](C)N1[C@@H]1CCCN(CCS(=O)(=O)c2cc(Cl)ccc2Cl)C1 ZINC000532700251 931593994 /nfs/dbraw/zinc/59/39/94/931593994.db2.gz NKZLUYAOJVJAFH-BFYDXBDKSA-N 0 3 419.418 4.104 20 0 HIADHN COc1ccc2cc(CN(C)C(=O)CNC3(c4ccccc4)CCOCC3)ccc2c1 ZINC000532707920 931598714 /nfs/dbraw/zinc/59/87/14/931598714.db2.gz DFYUTSSSMROPAB-UHFFFAOYSA-N 0 3 418.537 4.102 20 0 HIADHN O=C(CNC1(c2ccc(Cl)cc2)CCOCC1)N1CCc2[nH]c3ccccc3c2C1 ZINC000532714777 931604530 /nfs/dbraw/zinc/60/45/30/931604530.db2.gz NAOQBCVTIIZNDG-UHFFFAOYSA-N 0 3 423.944 4.002 20 0 HIADHN O=C(CCN1CCC(C(=O)c2ccccc2)CC1)Nc1cccc(Br)c1 ZINC000532739236 931618549 /nfs/dbraw/zinc/61/85/49/931618549.db2.gz OBRZMKLUXULOFR-UHFFFAOYSA-N 0 3 415.331 4.373 20 0 HIADHN C[C@H](c1ccccc1Br)N(C)C(=O)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000532790003 931631881 /nfs/dbraw/zinc/63/18/81/931631881.db2.gz REHRIBWDXVXHHS-SJLPKXTDSA-N 0 3 416.363 4.276 20 0 HIADHN C[C@@H](c1ccccc1Br)N(C)C(=O)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000532790002 931632142 /nfs/dbraw/zinc/63/21/42/931632142.db2.gz REHRIBWDXVXHHS-FUHWJXTLSA-N 0 3 416.363 4.276 20 0 HIADHN CCCO[C@H]1CCCN([C@@H](C)C(=O)N(C)Cc2ccc(Br)cc2)CC1 ZINC000532961013 931715165 /nfs/dbraw/zinc/71/51/65/931715165.db2.gz WYFZDIWAHXOXFC-LPHOPBHVSA-N 0 3 411.384 4.077 20 0 HIADHN COc1cc([C@H](C)N[C@H]2CCCN(CC(F)(F)F)C2=O)ccc1OCCC(C)C ZINC000532990079 931728971 /nfs/dbraw/zinc/72/89/71/931728971.db2.gz RBQVAZCAGRDBIW-RDJZCZTQSA-N 0 3 416.484 4.324 20 0 HIADHN CC(C)(C)N(Cc1ccc(F)cc1)Cc1cc(=O)n2cc(Br)ccc2n1 ZINC000533024759 931742935 /nfs/dbraw/zinc/74/29/35/931742935.db2.gz YNYBVEXQLNRLNQ-UHFFFAOYSA-N 0 3 418.310 4.397 20 0 HIADHN O=C(c1cc(-c2ccoc2)[nH]n1)N1CCN(C2c3ccccc3-c3ccccc32)CC1 ZINC000533106607 931772506 /nfs/dbraw/zinc/77/25/06/931772506.db2.gz VVCYDRSQHSWYEO-UHFFFAOYSA-N 0 3 410.477 4.198 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3cccc(-c4ncco4)c3)c(C)c2)CC1 ZINC000533132596 931777501 /nfs/dbraw/zinc/77/75/01/931777501.db2.gz VDHSXLVFMRKMOB-UHFFFAOYSA-N 0 3 405.502 4.436 20 0 HIADHN CCC[NH+](CCC)CCCC(=O)N1CCC(C(=O)Nc2cc(Cl)ccc2[O-])CC1 ZINC000533159752 931793762 /nfs/dbraw/zinc/79/37/62/931793762.db2.gz UNVQRCWTDIXBIP-UHFFFAOYSA-N 0 3 423.985 4.125 20 0 HIADHN O=S(=O)(Cc1ccccc1CNCc1cc2ccccc2s1)N1CCCC1 ZINC000533180054 931802943 /nfs/dbraw/zinc/80/29/43/931802943.db2.gz VKSRVHLVBTXCAZ-UHFFFAOYSA-N 0 3 400.569 4.117 20 0 HIADHN COc1ccc(CCC2CCN(CC(=O)N3CCC[C@H](C(F)(F)F)C3)CC2)cc1 ZINC000533235631 931815972 /nfs/dbraw/zinc/81/59/72/931815972.db2.gz CEWZHXXXTQHGRV-IBGZPJMESA-N 0 3 412.496 4.141 20 0 HIADHN C[C@@H](C(=O)N(C)Cc1ccccc1)N(C)CCCc1cc(-c2ccc(F)cc2)n[nH]1 ZINC000533266425 931823961 /nfs/dbraw/zinc/82/39/61/931823961.db2.gz DPDSBNJZMCIAQN-SFHVURJKSA-N 0 3 408.521 4.127 20 0 HIADHN COc1cccc(NC2CCN(Cc3ccc(OCc4nccn4C)cc3)CC2)c1 ZINC000533310728 931835903 /nfs/dbraw/zinc/83/59/03/931835903.db2.gz SBKFKVZJYCSAFM-UHFFFAOYSA-N 0 3 406.530 4.084 20 0 HIADHN O=C(CN[C@H](Cc1ccccc1)c1ccccc1)NCc1ccccc1Cn1cccn1 ZINC000533343325 931843096 /nfs/dbraw/zinc/84/30/96/931843096.db2.gz VDYHWDJLZMMLEU-AREMUKBSSA-N 0 3 424.548 4.121 20 0 HIADHN O[C@@H](COc1cc(Cl)ccc1Cl)CN1CC=C(c2c[nH]c3ncccc23)CC1 ZINC000533344162 931843970 /nfs/dbraw/zinc/84/39/70/931843970.db2.gz LYQVRBDQFSWXIZ-MRXNPFEDSA-N 0 3 418.324 4.399 20 0 HIADHN C/C=C/c1ccc(OC[C@H](O)CN(C)[C@@H]2CCCc3nc(C)sc32)c(OC)c1 ZINC000533386195 931854741 /nfs/dbraw/zinc/85/47/41/931854741.db2.gz FMSFMFZJTPIRAW-YVNZRUEQSA-N 0 3 402.560 4.242 20 0 HIADHN C[C@@H](c1cccc(O)c1)N(C)C[C@@H](O)COc1ccc(Cl)cc1Br ZINC000533514352 931891274 /nfs/dbraw/zinc/89/12/74/931891274.db2.gz MLKGYGSRMGYZOV-BLLLJJGKSA-N 0 3 414.727 4.241 20 0 HIADHN O=C(CNC1(c2ccccc2)CCOCC1)Nc1ccc(Br)cc1Cl ZINC000533518052 931891894 /nfs/dbraw/zinc/89/18/94/931891894.db2.gz VKTLVDIWMXXNCF-UHFFFAOYSA-N 0 3 423.738 4.337 20 0 HIADHN COc1cccc(NC(=O)[C@H](N[C@@H]2[C@H]3CCO[C@@H]3C23CCCC3)c2ccccc2)c1 ZINC000533635918 931937975 /nfs/dbraw/zinc/93/79/75/931937975.db2.gz QBABCULEWZLTCF-ODAXIHTASA-N 0 3 406.526 4.312 20 0 HIADHN C[C@@H](NCCC1CCN(CC(F)(F)F)CC1)c1ncc(Br)s1 ZINC000533786385 932032436 /nfs/dbraw/zinc/03/24/36/932032436.db2.gz NRYFJXNKNNUZIA-SNVBAGLBSA-N 0 3 400.308 4.221 20 0 HIADHN CN(C)CCn1cc(NC(=O)c2ccc(-c3nc4ccccc4s3)s2)ccc1=O ZINC000533806258 932040523 /nfs/dbraw/zinc/04/05/23/932040523.db2.gz CVFCVMXIBZZBBC-UHFFFAOYSA-N 0 3 424.551 4.000 20 0 HIADHN CN(C)[C@@H](CNC(=O)Nc1ccc(OC(F)F)c2ncccc12)Cc1ccccc1 ZINC000533810628 932042545 /nfs/dbraw/zinc/04/25/45/932042545.db2.gz RMNKOMOVRQEOQP-MRXNPFEDSA-N 0 3 414.456 4.131 20 0 HIADHN Cc1[nH]c(-c2cccc(C)c2)nc1C(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000533840781 932054836 /nfs/dbraw/zinc/05/48/36/932054836.db2.gz HIUORNVQEBYLNJ-UHFFFAOYSA-N 0 3 418.541 4.150 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)CN(Cc2ccccc2)c2ccccc2)CC1 ZINC000533849771 932060146 /nfs/dbraw/zinc/06/01/46/932060146.db2.gz HBJVUKCBWVPIST-UHFFFAOYSA-N 0 3 417.553 4.409 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)c1ccn(-c2ccc(Cl)cc2)n1 ZINC000533851702 932060917 /nfs/dbraw/zinc/06/09/17/932060917.db2.gz QVJDXWJBHIGEBK-NRFANRHFSA-N 0 3 423.948 4.047 20 0 HIADHN O=C(c1cc(Br)cc2cccnc21)N1CCN(C2CCCCC2)CC1 ZINC000533931500 932107090 /nfs/dbraw/zinc/10/70/90/932107090.db2.gz LZPUIPGIKUIDCH-UHFFFAOYSA-N 0 3 402.336 4.088 20 0 HIADHN CC(C)(C)[C@@H](CN1CCc2ccccc2C1)NC(=O)N[C@@H](c1cccnc1)C1CC1 ZINC000533967698 932141935 /nfs/dbraw/zinc/14/19/35/932141935.db2.gz YGKZEOVLECEYNZ-DHIUTWEWSA-N 0 3 406.574 4.305 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)c2cc(=O)[nH]c3ccc(Br)cc32)c1 ZINC000533968826 932144753 /nfs/dbraw/zinc/14/47/53/932144753.db2.gz NTTGXJQKXBPXHY-UHFFFAOYSA-N 0 3 414.303 4.325 20 0 HIADHN CN1CC[C@@H](NC(=O)N2CCC(Oc3ccccc3Cl)CC2)[C@@H]1c1ccccc1 ZINC000533983672 932159637 /nfs/dbraw/zinc/15/96/37/932159637.db2.gz HDEKRAZYCFHTFF-IRLDBZIGSA-N 0 3 413.949 4.338 20 0 HIADHN COc1ccccc1COc1cccc(NC(=O)N2CC[C@H](N3CC=CC3)C2)c1C ZINC000534013354 932195311 /nfs/dbraw/zinc/19/53/11/932195311.db2.gz OEOOAUBOBMRRQG-FQEVSTJZSA-N 0 3 407.514 4.061 20 0 HIADHN CC(C)n1ncc2c1nc(C1CC1)cc2C(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000534020404 932202938 /nfs/dbraw/zinc/20/29/38/932202938.db2.gz VKWVNALKCXXSIB-RBBKRZOGSA-N 0 3 403.530 4.065 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1cc2c(cc1Cl)OCO2)c1cccc(OC)c1 ZINC000534024622 932205752 /nfs/dbraw/zinc/20/57/52/932205752.db2.gz FWWJAICIIWOOCX-GOSISDBHSA-N 0 3 419.909 4.282 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1scnc1C1CC1 ZINC000534031219 932210851 /nfs/dbraw/zinc/21/08/51/932210851.db2.gz OVZXBPVYRWCVEJ-SFHVURJKSA-N 0 3 407.543 4.225 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NC[C@@H](C)Cc3ccc(OC)cc3)c(C)c2)CC1 ZINC000534041065 932217440 /nfs/dbraw/zinc/21/74/40/932217440.db2.gz PSVAJFUTVFZOLR-IBGZPJMESA-N 0 3 424.589 4.146 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)c1cc(N2CCCC2=O)ccc1Cl ZINC000534060720 932238806 /nfs/dbraw/zinc/23/88/06/932238806.db2.gz OZPBZHFEQQKCDM-NRFANRHFSA-N 0 3 411.933 4.034 20 0 HIADHN CC(C)Cn1ncc(NC(=O)N(CCN(C)C)Cc2cccc(F)c2)c1C(F)F ZINC000534089382 932268683 /nfs/dbraw/zinc/26/86/83/932268683.db2.gz GSYZZNAWQWUMTP-UHFFFAOYSA-N 0 3 411.472 4.212 20 0 HIADHN COc1ccccc1[C@H](NC(=O)c1cccc(CN2CCCC2)c1)c1ccccn1 ZINC000534104650 932280730 /nfs/dbraw/zinc/28/07/30/932280730.db2.gz PYZSBJQHKWXRIB-DEOSSOPVSA-N 0 3 401.510 4.205 20 0 HIADHN CSc1ccc(CN2CCC(C(=O)Nc3ccc(Br)cn3)CC2)cc1 ZINC000534342004 932387280 /nfs/dbraw/zinc/38/72/80/932387280.db2.gz MOOIWMPDOYRPSF-UHFFFAOYSA-N 0 3 420.376 4.417 20 0 HIADHN Brc1ccccc1N1CC[C@@H](NCc2cnc([C@@H]3CCCO3)s2)C1 ZINC000534464055 932481679 /nfs/dbraw/zinc/48/16/79/932481679.db2.gz AGHMNCOMSYLTHJ-DYVFJYSZSA-N 0 3 408.365 4.126 20 0 HIADHN Cc1cc(C)c(CC(C(=O)Nc2ccnn2-c2ccc(C)nn2)C(F)(F)F)c(C)c1 ZINC000534475093 932504701 /nfs/dbraw/zinc/50/47/01/932504701.db2.gz UGQLXYYJJXFHIR-KRWDZBQOSA-N 0 3 417.435 4.256 20 0 HIADHN Cc1nc(-c2cccc(C(F)(F)F)c2)[nH]c1C(=O)Nc1ccn(-c2ccncc2)n1 ZINC000534515358 932540618 /nfs/dbraw/zinc/54/06/18/932540618.db2.gz GDXRKEOKBHJQRW-UHFFFAOYSA-N 0 3 412.375 4.237 20 0 HIADHN CC(C)c1ccc([C@@H]2CCCN2CC(=O)N2CCC(C(=O)N(C)C(C)C)CC2)cc1 ZINC000534666857 932635746 /nfs/dbraw/zinc/63/57/46/932635746.db2.gz ZORARVLXWWRVMV-QHCPKHFHSA-N 0 3 413.606 4.052 20 0 HIADHN CN(Cc1ccc(Br)s1)C(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000534681646 932651928 /nfs/dbraw/zinc/65/19/28/932651928.db2.gz KBPKANCOFULHGF-RDJZCZTQSA-N 0 3 408.365 4.097 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)[C@@H]2C[C@H]3CCCC[C@@H]3N2C(=O)c2ccccc2)c1 ZINC000534699921 932672101 /nfs/dbraw/zinc/67/21/01/932672101.db2.gz HCKVIKDLRZXGSC-NHTMILBNSA-N 0 3 419.569 4.469 20 0 HIADHN Cc1ncsc1-c1nc2ccccc2n1CC(=O)Nc1cc(C)cc(CN(C)C)c1 ZINC000534707979 932678242 /nfs/dbraw/zinc/67/82/42/932678242.db2.gz BPGKSSUSMPXALS-UHFFFAOYSA-N 0 3 419.554 4.477 20 0 HIADHN C[C@@H](CO)CCCNC(=O)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000534717710 932685966 /nfs/dbraw/zinc/68/59/66/932685966.db2.gz VNFGLOQXLIXAHF-MRXNPFEDSA-N 0 3 416.393 4.009 20 0 HIADHN COc1ccc(C[C@H](C)C(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000534729703 932698869 /nfs/dbraw/zinc/69/88/69/932698869.db2.gz YSNSWXAGDZDYMV-UGKGYDQZSA-N 0 3 418.541 4.156 20 0 HIADHN CN1CC[C@H](NC(=O)[C@@H]2C[C@@H]2c2ccccc2OC(F)(F)F)[C@H]1c1ccccc1 ZINC000534754855 932731975 /nfs/dbraw/zinc/73/19/75/932731975.db2.gz MPMGOWSWERVIKO-FTEYMNFISA-N 0 3 404.432 4.250 20 0 HIADHN Cc1cc(C)c(CC(C(=O)N2CC[C@H](C(N)=O)c3ccccc32)C(F)(F)F)c(C)c1 ZINC000534781254 932761815 /nfs/dbraw/zinc/76/18/15/932761815.db2.gz SPXGQMDBGRYTMJ-HKUYNNGSSA-N 0 3 418.459 4.339 20 0 HIADHN CN(C(=O)c1cc(Br)cc2cccnc21)[C@H]1CCN(Cc2ccccc2)C1 ZINC000534788118 932769839 /nfs/dbraw/zinc/76/98/39/932769839.db2.gz SRTZMQFOAXRYRA-IBGZPJMESA-N 0 3 424.342 4.344 20 0 HIADHN CC(C)Cn1ncc(NC(=O)NCC(C)(C)N2CCc3ccccc3C2)c1C(F)F ZINC000534825443 932795954 /nfs/dbraw/zinc/79/59/54/932795954.db2.gz GJQFEYDAGNHEJH-UHFFFAOYSA-N 0 3 419.520 4.435 20 0 HIADHN COc1ccccc1[C@H](NC(=O)N(CCN(C)C)CC1CCCCC1)c1ccccn1 ZINC000534843014 932803275 /nfs/dbraw/zinc/80/32/75/932803275.db2.gz FOUZIYJCQBIMKN-DEOSSOPVSA-N 0 3 424.589 4.333 20 0 HIADHN C[C@H](C(=O)N1CCC[C@@H]1CN1CCCCC1)c1cccc(C(=O)c2ccccc2)c1 ZINC000534874473 932818095 /nfs/dbraw/zinc/81/80/95/932818095.db2.gz DVNCWVMIRCQOAS-GBXCKJPGSA-N 0 3 404.554 4.498 20 0 HIADHN COc1ccc(C[C@@H](C)CNC(=O)c2oc3ccccc3c2CN(C)C)cc1OC ZINC000534999558 932882451 /nfs/dbraw/zinc/88/24/51/932882451.db2.gz JWUNBDNGPOQYND-MRXNPFEDSA-N 0 3 410.514 4.120 20 0 HIADHN COc1cc(CN(C)Cc2ccc(OC[C@H]3CCCO3)cc2)ccc1OC(F)F ZINC000535066013 932896515 /nfs/dbraw/zinc/89/65/15/932896515.db2.gz ALJUPFOZJKCMAK-LJQANCHMSA-N 0 3 407.457 4.486 20 0 HIADHN CC[C@@H](NCc1ccc(OC)c(OC)c1Cl)[C@H](c1ccc(C)cc1)n1cncn1 ZINC000535185804 933001452 /nfs/dbraw/zinc/00/14/52/933001452.db2.gz MNBQVXIERAFDIF-NQIIRXRSSA-N 0 3 414.937 4.415 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)N1CCC[C@H]1Cn1cnc2ccccc21 ZINC000535216644 933021974 /nfs/dbraw/zinc/02/19/74/933021974.db2.gz QKSDOTWYQHEYOB-XUZZJYLKSA-N 0 3 417.557 4.047 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)c3ccccc3CCC(F)(F)F)CC2)C[C@H](C)O1 ZINC000535340575 933082007 /nfs/dbraw/zinc/08/20/07/933082007.db2.gz PEUSHXUTRVGEOS-CALCHBBNSA-N 0 3 412.496 4.143 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)c1ccccc1CCC(F)(F)F ZINC000535403871 933118083 /nfs/dbraw/zinc/11/80/83/933118083.db2.gz ILZJMHFCRGQVNY-UHFFFAOYSA-N 0 3 420.475 4.068 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)[C@@H](C)Oc2ccc(F)cc2Br)c1 ZINC000535419033 933126921 /nfs/dbraw/zinc/12/69/21/933126921.db2.gz KLOGFULTAGAFEO-CYBMUJFWSA-N 0 3 409.299 4.364 20 0 HIADHN CN1CC[C@H](NC(=O)NCc2csc(CCc3ccccc3)n2)[C@H]1c1ccccc1 ZINC000535429990 933131045 /nfs/dbraw/zinc/13/10/45/933131045.db2.gz IFIVSCXVEQZJOQ-JTHBVZDNSA-N 0 3 420.582 4.173 20 0 HIADHN CN1CC[C@@H](NC(=O)NCc2csc(CCc3ccccc3)n2)[C@H]1c1ccccc1 ZINC000535429987 933131146 /nfs/dbraw/zinc/13/11/46/933131146.db2.gz IFIVSCXVEQZJOQ-FYYLOGMGSA-N 0 3 420.582 4.173 20 0 HIADHN CN1CC[C@H](NC(=O)c2cccc(NC(=O)c3ccc(F)cc3)c2)[C@@H]1c1ccccc1 ZINC000535467046 933156854 /nfs/dbraw/zinc/15/68/54/933156854.db2.gz APKLOPMXHFUUAK-GOTSBHOMSA-N 0 3 417.484 4.253 20 0 HIADHN CCOc1ccc(F)c(NC(=O)Nc2ccc(N3CCN(CC)CC3)cc2C)c1F ZINC000535493670 933181726 /nfs/dbraw/zinc/18/17/26/933181726.db2.gz WCNLCOGIFARKRH-UHFFFAOYSA-N 0 3 418.488 4.458 20 0 HIADHN Cc1cc(NC(=O)C2CCC(F)(F)CC2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000535500142 933187487 /nfs/dbraw/zinc/18/74/87/933187487.db2.gz UIQLYXXWUIBHID-IBGZPJMESA-N 0 3 402.489 4.403 20 0 HIADHN OC[C@H](Cc1c[nH]c2ccccc12)N[C@H]1CCc2c1c(Br)ccc2F ZINC000535508001 933201954 /nfs/dbraw/zinc/20/19/54/933201954.db2.gz KGBWPVHUMIFSDT-DJJJIMSYSA-N 0 3 403.295 4.250 20 0 HIADHN COc1ccc(C[C@@H](C)CN(C)C(=O)NC[C@@H](c2cccs2)N2CCCC2)cc1 ZINC000535625904 933273581 /nfs/dbraw/zinc/27/35/81/933273581.db2.gz JYOSJCCPWHXYOE-NQIIRXRSSA-N 0 3 415.603 4.414 20 0 HIADHN Cc1ccc(Br)cc1NC(=O)CCNCc1cnc([C@@H]2CCCO2)s1 ZINC000535945841 933512519 /nfs/dbraw/zinc/51/25/19/933512519.db2.gz VNMRDWPCOFHANN-INIZCTEOSA-N 0 3 424.364 4.184 20 0 HIADHN Cc1nc2ccccc2n1C[C@H]1CCCN1CC(=O)N[C@H](c1ccccc1)C1CC1 ZINC000535966173 933528367 /nfs/dbraw/zinc/52/83/67/933528367.db2.gz XZDSFRYVAIIPRO-PXDATVDWSA-N 0 3 402.542 4.077 20 0 HIADHN CN1CC[C@H](NC(=O)NCc2ccc(Oc3ccc(F)cc3)nc2)[C@@H]1c1ccccc1 ZINC000536094420 933644812 /nfs/dbraw/zinc/64/48/12/933644812.db2.gz FTCRQAUMYVKATN-GMAHTHKFSA-N 0 3 420.488 4.258 20 0 HIADHN CCCN1CCN(c2ccccc2CNc2ccccc2OCCn2ccnc2)CC1 ZINC000536097686 933650606 /nfs/dbraw/zinc/65/06/06/933650606.db2.gz CEBJEBWGCFMJCH-UHFFFAOYSA-N 0 3 419.573 4.106 20 0 HIADHN COc1ccc([C@H](C)NCCc2nnc(-c3ccccc3)o2)c(Br)c1 ZINC000537308727 933708663 /nfs/dbraw/zinc/70/86/63/933708663.db2.gz VSMIYVNLSIWVLC-ZDUSSCGKSA-N 0 3 402.292 4.401 20 0 HIADHN O=C1c2ccccc2C(=O)N1[C@@H]1CCCC[C@H](NCc2nc(C(F)(F)F)cs2)C1 ZINC000537311831 933710924 /nfs/dbraw/zinc/71/09/24/933710924.db2.gz VOEYLBBADHWDGJ-QWHCGFSZSA-N 0 3 423.460 4.249 20 0 HIADHN Cc1cc(C(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)nn1C1CCCCC1 ZINC000537355970 933733219 /nfs/dbraw/zinc/73/32/19/933733219.db2.gz CQXHFKBHTXHMHP-BGYRXZFFSA-N 0 3 416.610 4.048 20 0 HIADHN CCN1CCN(Cc2ccc(N[C@H](C)c3ncc(Br)s3)cc2)CC1 ZINC000537396841 933757032 /nfs/dbraw/zinc/75/70/32/933757032.db2.gz MCMQJBFWNVWFAB-CQSZACIVSA-N 0 3 409.397 4.216 20 0 HIADHN Cc1ccc(NC(=O)c2c(F)cccc2I)c(CN(C)C)c1 ZINC000537418465 933767559 /nfs/dbraw/zinc/76/75/59/933767559.db2.gz DWCDZZDDSHZLDD-UHFFFAOYSA-N 0 3 412.246 4.053 20 0 HIADHN FC(F)n1c(CCNCc2cc3c(cc2Br)OCO3)nc2ccccc21 ZINC000537506719 933797342 /nfs/dbraw/zinc/79/73/42/933797342.db2.gz CMYWZAJGYPBIAL-UHFFFAOYSA-N 0 3 424.245 4.255 20 0 HIADHN O=C(NCCN1CCCC1)c1ccc(NCc2ccc(OC(F)F)c(Cl)c2)cc1 ZINC000562767530 945118526 /nfs/dbraw/zinc/11/85/26/945118526.db2.gz SBSHIWYVAMWAPV-UHFFFAOYSA-N 0 3 423.891 4.379 20 0 HIADHN COc1ccc([C@H](C)Nc2cccc(-n3nnnc3C)c2)cc1CN1CCCCC1 ZINC000537538751 938318411 /nfs/dbraw/zinc/31/84/11/938318411.db2.gz WWKWHFFLTZBWTH-KRWDZBQOSA-N 0 3 406.534 4.138 20 0 HIADHN COC(=O)[C@@H]1CC12CCN(Cc1cnc(-c3ccc(Br)cc3)s1)CC2 ZINC000537625184 938338163 /nfs/dbraw/zinc/33/81/63/938338163.db2.gz QPSNJNNCAVXRCE-INIZCTEOSA-N 0 3 421.360 4.348 20 0 HIADHN Cn1cc(CN[C@@H]2CCN(c3ncc(C(F)(F)F)cc3Cl)C2)c(C(C)(C)C)n1 ZINC000537655733 938348004 /nfs/dbraw/zinc/34/80/04/938348004.db2.gz HIAYRUZWAJZADG-CQSZACIVSA-N 0 3 415.891 4.153 20 0 HIADHN CSc1cccc(N(C(=O)c2ccnc(OC3CCC3)c2)C2CCN(C)CC2)c1 ZINC000537708687 938360929 /nfs/dbraw/zinc/36/09/29/938360929.db2.gz UOMJWJMGLDBBJQ-UHFFFAOYSA-N 0 3 411.571 4.476 20 0 HIADHN CCN1CCN(CCC(=O)N[C@H](C)c2ccc(-c3ccc(Cl)cc3)s2)CC1 ZINC000537791171 938376625 /nfs/dbraw/zinc/37/66/25/938376625.db2.gz SEULCPATHCWQIX-MRXNPFEDSA-N 0 3 405.995 4.273 20 0 HIADHN CS[C@@H]1CN(C(=O)c2ccc(COc3ccc4ccccc4c3)o2)C[C@H]1N(C)C ZINC000537924067 938414783 /nfs/dbraw/zinc/41/47/83/938414783.db2.gz MUFCTVWZESOTAR-IFMALSPDSA-N 0 3 410.539 4.129 20 0 HIADHN CCOc1cc(Cl)ccc1CN[C@H](C)CC(=O)Nc1cc(OC)ccc1OC ZINC000537938206 938423185 /nfs/dbraw/zinc/42/31/85/938423185.db2.gz QGIRFFUBGSDKKT-CQSZACIVSA-N 0 3 406.910 4.263 20 0 HIADHN CSc1ccc([C@H](C)NC[C@H](O)COc2ccccc2Br)cc1F ZINC000537955073 938431162 /nfs/dbraw/zinc/43/11/62/938431162.db2.gz GDFYWTBLQFMORV-JSGCOSHPSA-N 0 3 414.340 4.401 20 0 HIADHN C[C@H](CC(=O)N(C)Cc1ccccc1Cl)NCc1cccc2c1OCCCO2 ZINC000537957709 938433846 /nfs/dbraw/zinc/43/38/46/938433846.db2.gz RQLJEYIBWRMNJI-MRXNPFEDSA-N 0 3 402.922 4.028 20 0 HIADHN CCc1nc([C@H](C)N[C@@H](C)CC(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)n[nH]1 ZINC000537961405 938435702 /nfs/dbraw/zinc/43/57/02/938435702.db2.gz JFWGAIMEQACADU-UWVGGRQHSA-N 0 3 403.836 4.107 20 0 HIADHN COc1ccc([C@H](OC)[C@@H](C)N[C@@H](C)c2ccc(-n3cncn3)cc2Cl)cc1 ZINC000537964590 938437259 /nfs/dbraw/zinc/43/72/59/938437259.db2.gz WLBVWQOCKPSMMC-PDSXEYIOSA-N 0 3 400.910 4.356 20 0 HIADHN CS(=O)(=O)Nc1cccc(CN[C@H]2CCCc3nc(-c4ccccc4)sc32)c1 ZINC000537965504 938438304 /nfs/dbraw/zinc/43/83/04/938438304.db2.gz ORYJRVRPBOHGPY-SFHVURJKSA-N 0 3 413.568 4.349 20 0 HIADHN CCCCOc1ccc([C@H](C)NCc2cccc(NS(C)(=O)=O)c2)cc1OC ZINC000537972837 938441178 /nfs/dbraw/zinc/44/11/78/938441178.db2.gz DWDAHBXUZDHEKL-INIZCTEOSA-N 0 3 406.548 4.096 20 0 HIADHN C[C@@H](N[C@H]1CCc2ccc(F)cc21)c1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000537975707 938444024 /nfs/dbraw/zinc/44/40/24/938444024.db2.gz ZFQPJKFHTKAHMN-ZHRRBRCNSA-N 0 3 402.535 4.338 20 0 HIADHN O=C1[C@H](N[C@H]2CCCc3nc(-c4ccc(F)cc4)sc32)CCN1CC(F)(F)F ZINC000537978013 938444606 /nfs/dbraw/zinc/44/46/06/938444606.db2.gz DIUODQSWBWBMHX-DZGCQCFKSA-N 0 3 413.440 4.079 20 0 HIADHN COc1cc([C@@H](C)N[C@H]2CC(=O)N(c3ccccc3Cl)C2)ccc1OC(F)F ZINC000537976485 938444944 /nfs/dbraw/zinc/44/49/44/938444944.db2.gz YTOMQFCHSFHBLL-OCCSQVGLSA-N 0 3 410.848 4.406 20 0 HIADHN C[C@@H](N[C@@H]1CCN(c2ccc(Cl)cc2)C1=O)c1ccc(OCc2nccn2C)cc1 ZINC000537983014 938447177 /nfs/dbraw/zinc/44/71/77/938447177.db2.gz TWXYQEBCYGWVBU-IIBYNOLFSA-N 0 3 424.932 4.109 20 0 HIADHN CCNC(=O)COc1cccc(CN[C@H]2CCCOc3cc4c(cc32)CCCC4)c1 ZINC000538019672 938464849 /nfs/dbraw/zinc/46/48/49/938464849.db2.gz FMALFHQWYJLSJO-QHCPKHFHSA-N 0 3 408.542 4.084 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)Nc1ccc(F)cc1OCC(F)F ZINC000538022633 938467082 /nfs/dbraw/zinc/46/70/82/938467082.db2.gz YHUXUESVDFAIMQ-UHFFFAOYSA-N 0 3 413.415 4.204 20 0 HIADHN Fc1ccc([C@@H](NCCCc2ccc(Br)cc2F)c2nnc[nH]2)cc1 ZINC000563319592 945177638 /nfs/dbraw/zinc/17/76/38/945177638.db2.gz XOPWWKDLPTXWBI-QGZVFWFLSA-N 0 3 407.262 4.157 20 0 HIADHN COc1cc(CN[C@H](c2ccc(Br)cc2)C2CC2)ccc1OCCO ZINC000538058398 938489776 /nfs/dbraw/zinc/48/97/76/938489776.db2.gz APXFYJCAARPUBO-FQEVSTJZSA-N 0 3 406.320 4.070 20 0 HIADHN C[C@@H](NC[C@H](c1ccc(F)cc1)N1CCOCC1)c1nc2ccc(Cl)cc2n1C ZINC000538061176 938491287 /nfs/dbraw/zinc/49/12/87/938491287.db2.gz DYGRBKOOCRBHNN-QVKFZJNVSA-N 0 3 416.928 4.090 20 0 HIADHN COCCN(CCN(C)C)C(=O)N[C@@H](c1ccc(Cl)c(C(F)(F)F)c1)C1CC1 ZINC000538108032 938504342 /nfs/dbraw/zinc/50/43/42/938504342.db2.gz QHMWIHVXLIHRIC-QGZVFWFLSA-N 0 3 421.891 4.030 20 0 HIADHN C[C@H](NCCOc1c(Cl)cc(Cl)cc1Cl)c1cccc(S(N)(=O)=O)c1 ZINC000538115855 938506184 /nfs/dbraw/zinc/50/61/84/938506184.db2.gz CMTGBMSRVCBHJO-JTQLQIEISA-N 0 3 423.749 4.024 20 0 HIADHN COc1cc2c(cc1F)CC[C@@H]2N[C@@H]1CCCN([C@@H](C)c2ccccc2F)C1=O ZINC000563325410 945181072 /nfs/dbraw/zinc/18/10/72/945181072.db2.gz HUIPFOQMEWPRPT-SZFUDVHCSA-N 0 3 400.469 4.303 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@H](C)N[C@@H](C)c2cccc(OC(C)C)c2)cc1F ZINC000538126366 938512265 /nfs/dbraw/zinc/51/22/65/938512265.db2.gz KSBHTLDIIGKMPJ-IRXDYDNUSA-N 0 3 402.510 4.319 20 0 HIADHN Cc1ccc(OC[C@H](O)CN[C@H](C)c2cccc(NC(=O)c3ccccc3)c2)cc1 ZINC000538128952 938513323 /nfs/dbraw/zinc/51/33/23/938513323.db2.gz VZSDQGYHWNGGIN-AUSIDOKSSA-N 0 3 404.510 4.338 20 0 HIADHN CNC(=O)c1cccc(CN[C@H](Cc2ccc(OC)c(OC)c2)c2ccccc2)c1 ZINC000538158829 938528471 /nfs/dbraw/zinc/52/84/71/938528471.db2.gz YLVPOHVCWZRRKQ-JOCHJYFZSA-N 0 3 404.510 4.137 20 0 HIADHN C[C@H](NCCN1C(=O)NC2(CCCC2)C1=O)c1ccc(Oc2ccccc2)c(F)c1 ZINC000538166240 938532836 /nfs/dbraw/zinc/53/28/36/938532836.db2.gz OCQMLTLVTONFGT-INIZCTEOSA-N 0 3 411.477 4.133 20 0 HIADHN CC(C)(C)C[C@H](NCC(=O)Nc1cccc(C(=O)NC2CC2)c1)c1ccc(F)cc1 ZINC000538171406 938534403 /nfs/dbraw/zinc/53/44/03/938534403.db2.gz PJTWUEFCIXROIR-NRFANRHFSA-N 0 3 411.521 4.424 20 0 HIADHN O=C1[C@H](N[C@H](c2ccc(Br)cc2)C2CCC2)CCN1CC(F)(F)F ZINC000538177391 938537935 /nfs/dbraw/zinc/53/79/35/938537935.db2.gz UKVDTTSJNNENLH-CABCVRRESA-N 0 3 405.258 4.043 20 0 HIADHN Cc1nc(-c2ccc([C@H](C)NCc3ccc(S(=O)(=O)N(C)C)cc3)cc2)cs1 ZINC000538181651 938541000 /nfs/dbraw/zinc/54/10/00/938541000.db2.gz WUKDOBXXPZBMMJ-HNNXBMFYSA-N 0 3 415.584 4.220 20 0 HIADHN Cc1cc(N2CCCC2)ccc1NC(=O)CN[C@@H](C)c1cccc(-n2cccn2)c1 ZINC000538188781 938544809 /nfs/dbraw/zinc/54/48/09/938544809.db2.gz YNIOQIQHQYDWOT-IBGZPJMESA-N 0 3 403.530 4.070 20 0 HIADHN COC[C@@H](NC[C@@H](CO)Cc1ccc(C(F)(F)F)cc1)c1ccc(F)c(F)c1 ZINC000538194450 938548735 /nfs/dbraw/zinc/54/87/35/938548735.db2.gz KUHZIIQQDMWXDS-IFXJQAMLSA-N 0 3 403.391 4.112 20 0 HIADHN Cc1cc(NC(=O)CN[C@@H](c2ccccc2)[C@@H]2CCOC2)ccc1Br ZINC000538197056 938550222 /nfs/dbraw/zinc/55/02/22/938550222.db2.gz KGQSFCROURLSJY-UZLBHIALSA-N 0 3 403.320 4.063 20 0 HIADHN C[C@H](NC[C@@H](O)COc1c(Cl)cccc1Cl)c1cccc(N2CCCC2=O)c1 ZINC000538211332 938558187 /nfs/dbraw/zinc/55/81/87/938558187.db2.gz TZSIOUBJRUHOGU-WMLDXEAASA-N 0 3 423.340 4.211 20 0 HIADHN Cc1ccc(S(=O)(=O)CCCN[C@H](C)c2ccc(OCC3CC3)c(F)c2)cc1 ZINC000538223976 938564237 /nfs/dbraw/zinc/56/42/37/938564237.db2.gz FTPODZHKMHNRIB-QGZVFWFLSA-N 0 3 405.535 4.438 20 0 HIADHN COc1cc(C(C)=O)ccc1OC[C@H](O)CN[C@@H](c1ccc(F)cc1F)C(C)(C)C ZINC000538224200 938564355 /nfs/dbraw/zinc/56/43/55/938564355.db2.gz PSUKGGDGJRLAEQ-VGSWGCGISA-N 0 3 421.484 4.293 20 0 HIADHN Cc1cc(NC(=O)CN[C@H](C[C@@H]2CCOC2)c2ccccc2)n(-c2ccc(F)cc2)n1 ZINC000538232749 938567047 /nfs/dbraw/zinc/56/70/47/938567047.db2.gz HEAQHPDXEPWXBK-PGRDOPGGSA-N 0 3 422.504 4.016 20 0 HIADHN CCN(CC)CCN(C(=O)[C@H]1CCC(=O)[C@H](C)C1)c1cccc(Br)c1 ZINC000538256816 938576259 /nfs/dbraw/zinc/57/62/59/938576259.db2.gz QGIRKKWNDRGHIK-CVEARBPZSA-N 0 3 409.368 4.129 20 0 HIADHN CC[C@@H]1Oc2cc([C@@H](C)NCc3ccc4oc(C(=O)OC)cc4c3)ccc2NC1=O ZINC000538258465 938576796 /nfs/dbraw/zinc/57/67/96/938576796.db2.gz YXIDGQWYMIAWJB-ACJLOTCBSA-N 0 3 408.454 4.180 20 0 HIADHN C[C@H](NCC(=O)N1CCc2[nH]c3ccccc3c2C1)c1cccc(N2CCCC2)c1 ZINC000538277374 938581594 /nfs/dbraw/zinc/58/15/94/938581594.db2.gz SJLIWIQXLQGSBA-SFHVURJKSA-N 0 3 402.542 4.004 20 0 HIADHN Cn1cc(CN2CCC[C@@H](c3nnc4ccc(C(F)(F)F)cn43)C2)c(C(C)(C)C)n1 ZINC000538307455 938588704 /nfs/dbraw/zinc/58/87/04/938588704.db2.gz XSCOMVYDDZPALG-CQSZACIVSA-N 0 3 420.483 4.159 20 0 HIADHN CCOc1ccc([C@@H](C)NC(=O)CN[C@H](c2ccc(F)c(C)c2)C2CC2)cc1OC ZINC000538320744 938591645 /nfs/dbraw/zinc/59/16/45/938591645.db2.gz NOPNOQHRWMNZAX-GYCJOSAFSA-N 0 3 414.521 4.460 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)c1nnc(C(C)(C)C)s1 ZINC000538346800 938599539 /nfs/dbraw/zinc/59/95/39/938599539.db2.gz LTTCJUJCYWBTPE-UHFFFAOYSA-N 0 3 414.497 4.058 20 0 HIADHN CCO[C@@H]1C[C@@H](N[C@H](CN2CCCC2=O)c2cccc(C(F)(F)F)c2)C12CCC2 ZINC000538397137 938610591 /nfs/dbraw/zinc/61/05/91/938610591.db2.gz RGGNOLRIJTWLOH-GUDVDZBRSA-N 0 3 410.480 4.306 20 0 HIADHN CCO[C@@H]1C[C@H](N[C@H](CN2CCCC2=O)c2cccc(C(F)(F)F)c2)C12CCC2 ZINC000538397135 938610801 /nfs/dbraw/zinc/61/08/01/938610801.db2.gz RGGNOLRIJTWLOH-CEXWTWQISA-N 0 3 410.480 4.306 20 0 HIADHN CCc1c2cc(C)ccc2oc1[C@H](C)NC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2 ZINC000538396941 938610832 /nfs/dbraw/zinc/61/08/32/938610832.db2.gz JWZVHPUCRVWDJU-FUHWJXTLSA-N 0 3 422.525 4.279 20 0 HIADHN Cc1nc2c(s1)[C@H](N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1)CCC2 ZINC000538554270 938647660 /nfs/dbraw/zinc/64/76/60/938647660.db2.gz QXLVMNIIINBMGL-YADHBBJMSA-N 0 3 405.567 4.346 20 0 HIADHN COc1ccc([C@@H](C)N[C@@H](Cc2ccccc2)C(=O)NCc2ccccc2)cc1OC ZINC000538553339 938647832 /nfs/dbraw/zinc/64/78/32/938647832.db2.gz DEMRTPDYVCIAGS-XXBNENTESA-N 0 3 418.537 4.282 20 0 HIADHN O=C(CCc1ccccc1)N1CC[C@@H](N[C@H]2CCCOc3cc4c(cc32)CCC4)C1 ZINC000538560761 938649486 /nfs/dbraw/zinc/64/94/86/938649486.db2.gz VAKWTIYFWMKNKW-VWNXMTODSA-N 0 3 404.554 4.212 20 0 HIADHN Cc1c([C@@H](C)Nc2cccc(CN3CCSCC3)c2)nnn1-c1ccc(F)cc1 ZINC000538587337 938656087 /nfs/dbraw/zinc/65/60/87/938656087.db2.gz AHNJPCGURIKEFG-MRXNPFEDSA-N 0 3 411.550 4.437 20 0 HIADHN COc1cc(CN[C@@H]2C=C[C@H](CO)C2)ccc1OCc1ccc(Br)cc1 ZINC000538603267 938659558 /nfs/dbraw/zinc/65/95/58/938659558.db2.gz KJWPOUBVJWTDMY-PKOBYXMFSA-N 0 3 418.331 4.063 20 0 HIADHN c1sc(CNc2ccc3nc(CCN4CCOCC4)[nH]c3c2)nc1-c1ccccc1 ZINC000538609264 938660761 /nfs/dbraw/zinc/66/07/61/938660761.db2.gz YPXCUZCHNVQYET-UHFFFAOYSA-N 0 3 419.554 4.173 20 0 HIADHN COc1ccc([C@H](C)Nc2ccc(N3CCOCC3)nc2C)cc1CN1CCCCC1 ZINC000538639271 938670162 /nfs/dbraw/zinc/67/01/62/938670162.db2.gz UBUYUQOWTAPJEC-IBGZPJMESA-N 0 3 424.589 4.394 20 0 HIADHN CC[C@@H](C)n1nc(C(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)cc1C ZINC000538690742 938684616 /nfs/dbraw/zinc/68/46/16/938684616.db2.gz HIDUKWLQSLNZLB-OAHLLOKOSA-N 0 3 410.484 4.385 20 0 HIADHN COc1ccc(OC)c([C@@H]2CCCN2C(=O)CN[C@@]2(C)CCCc3ccccc32)c1 ZINC000538707210 938686909 /nfs/dbraw/zinc/68/69/09/938686909.db2.gz AQOQRQICHZFCAQ-DHLKQENFSA-N 0 3 408.542 4.209 20 0 HIADHN COc1ccc(OC)c([C@@H]2CCCN2C(=O)CN[C@]2(C)CCCc3ccccc32)c1 ZINC000538707213 938686971 /nfs/dbraw/zinc/68/69/71/938686971.db2.gz AQOQRQICHZFCAQ-WIOPSUGQSA-N 0 3 408.542 4.209 20 0 HIADHN CCNC(=O)COc1ccc(CN(Cc2ccoc2)C2CCCCC2)cc1OC ZINC000538716815 938689070 /nfs/dbraw/zinc/68/90/70/938689070.db2.gz DATGWZJBBMRDTO-UHFFFAOYSA-N 0 3 400.519 4.138 20 0 HIADHN COc1cc(CN2CC[C@H](Cc3cnn(C)c3)C2)cc(OC)c1OCc1ccccc1 ZINC000538729076 938694367 /nfs/dbraw/zinc/69/43/67/938694367.db2.gz PMBWJXNJRWWEIF-HXUWFJFHSA-N 0 3 421.541 4.081 20 0 HIADHN Cc1cc(NC(=O)C2CCN([C@H]3CCCc4ccc(Br)cc43)CC2)no1 ZINC000538781666 938709195 /nfs/dbraw/zinc/70/91/95/938709195.db2.gz PUTAKNYGKMCYHI-SFHVURJKSA-N 0 3 418.335 4.474 20 0 HIADHN COc1ccc(CN(C(=O)N[C@H]2CN(C3CC3)C[C@@H]2C)C2CCCCC2)cc1OC ZINC000538811844 938718889 /nfs/dbraw/zinc/71/88/89/938718889.db2.gz JPFHRQFVYROYBJ-UWJYYQICSA-N 0 3 415.578 4.031 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)[C@H]2C[C@@H]2c2cccc(F)c2F)cc1 ZINC000538830400 938721289 /nfs/dbraw/zinc/72/12/89/938721289.db2.gz MJTFNFALJDBQQY-DYXWJJEUSA-N 0 3 400.469 4.030 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)CCCc2c[nH]c3ccccc23)cc1 ZINC000538830842 938721816 /nfs/dbraw/zinc/72/18/16/938721816.db2.gz UGFHNLHNUMLPHC-DEOSSOPVSA-N 0 3 405.542 4.453 20 0 HIADHN CCc1nc2ccccc2n1C1CCN([C@H](C)C(=O)N(C)Cc2cccc(F)c2)CC1 ZINC000538956397 938749449 /nfs/dbraw/zinc/74/94/49/938749449.db2.gz VKKHEEJJCHUAFU-GOSISDBHSA-N 0 3 422.548 4.422 20 0 HIADHN CC(C)CN(C(=O)c1ccn(-c2ccc(Cl)cc2Cl)n1)C1CCN(C)CC1 ZINC000538998658 938764510 /nfs/dbraw/zinc/76/45/10/938764510.db2.gz VNSVOLOEBISCOY-UHFFFAOYSA-N 0 3 409.361 4.372 20 0 HIADHN COc1ccc(CN(C(=O)N[C@@H]2CCN(C3CC3)C2)[C@H]2CCCC[C@@H]2C)cc1OC ZINC000539017011 938769995 /nfs/dbraw/zinc/76/99/95/938769995.db2.gz XWRZEBNORXTSBZ-DSKINZAPSA-N 0 3 415.578 4.031 20 0 HIADHN CC(=O)N1CC[C@@H](N[C@H](C)c2ccc(I)cc2)c2ccccc21 ZINC000539050833 938783403 /nfs/dbraw/zinc/78/34/03/938783403.db2.gz QRCOWKVGWHTBKH-FZKQIMNGSA-N 0 3 420.294 4.440 20 0 HIADHN COc1cccc(C[C@@H](NCc2ccc3c(c2)CCS3(=O)=O)c2ccccc2)c1 ZINC000539057261 938785636 /nfs/dbraw/zinc/78/56/36/938785636.db2.gz VTNKJQLAVJPSPY-HSZRJFAPSA-N 0 3 407.535 4.099 20 0 HIADHN Cc1ccc2c(c1)OCCC[C@H]2NC[C@@H](O)COc1ccccc1Br ZINC000539064408 938789889 /nfs/dbraw/zinc/78/98/89/938789889.db2.gz APWIRTJNSTTXTB-CRAIPNDOSA-N 0 3 406.320 4.001 20 0 HIADHN CC(C)NC(=O)Nc1ccc([C@H](C)NCc2cccc(CN3CCCC3=O)c2)cc1 ZINC000539075599 938795380 /nfs/dbraw/zinc/79/53/80/938795380.db2.gz JJJGGDWCTIXOOO-SFHVURJKSA-N 0 3 408.546 4.190 20 0 HIADHN C[C@@H](NCCNC(=O)c1cccc(Br)c1)c1cnc2ccsc2c1 ZINC000539081421 938798429 /nfs/dbraw/zinc/79/84/29/938798429.db2.gz KMKGKFTYIGTOAQ-GFCCVEGCSA-N 0 3 404.333 4.139 20 0 HIADHN CCS(=O)(=O)Nc1ccc([C@@H](C)NCc2ccc(Br)c(F)c2)cc1 ZINC000539081683 938798510 /nfs/dbraw/zinc/79/85/10/938798510.db2.gz OYZAKRAYRGTCDI-GFCCVEGCSA-N 0 3 415.328 4.201 20 0 HIADHN COC(=O)COc1cccc(CN[C@@H]2CCc3c2cc(Cl)cc3Br)c1 ZINC000539084271 938798940 /nfs/dbraw/zinc/79/89/40/938798940.db2.gz NLHDQHZBNMLKBS-GOSISDBHSA-N 0 3 424.722 4.431 20 0 HIADHN O=C1c2ccccc2C(=O)N1[C@H]1CCCC[C@H](NCc2coc(-c3ccccc3)n2)C1 ZINC000539087081 938800184 /nfs/dbraw/zinc/80/01/84/938800184.db2.gz QWJMJFIZFCGKAI-ICSRJNTNSA-N 0 3 415.493 4.429 20 0 HIADHN CCN(CC)C(=O)Nc1ccc([C@H](C)N[C@H]2C[C@H](C)N(c3ccccc3)C2=O)cc1 ZINC000539090056 938800856 /nfs/dbraw/zinc/80/08/56/938800856.db2.gz YSNGKEYMHRLTKX-SPEDKVCISA-N 0 3 408.546 4.405 20 0 HIADHN COc1cc(CN[C@H](Cc2ccc(Cl)cc2)c2ccccc2)ccc1OCC(N)=O ZINC000539091189 938801060 /nfs/dbraw/zinc/80/10/60/938801060.db2.gz PYDMJDYQGYCZDN-OAQYLSRUSA-N 0 3 424.928 4.286 20 0 HIADHN CC[C@H](NCc1ccccc1OCC(=O)NC[C@H]1CCCO1)c1ccc(Cl)cc1 ZINC000539091167 938801062 /nfs/dbraw/zinc/80/10/62/938801062.db2.gz GYBKPEDFARRXFC-RTWAWAEBSA-N 0 3 416.949 4.255 20 0 HIADHN CC[C@@H](NCc1ccc(C(=O)N2C[C@@H](C)O[C@@H](C)C2)cc1)c1cc(C)ccc1OC ZINC000539093659 938801956 /nfs/dbraw/zinc/80/19/56/938801956.db2.gz PLAGBVHTKVFLSQ-SELNLUPBSA-N 0 3 410.558 4.494 20 0 HIADHN CC[C@H](NCc1ccc(C(=O)N2C[C@@H](C)O[C@H](C)C2)cc1)c1cc(C)ccc1OC ZINC000539093645 938801976 /nfs/dbraw/zinc/80/19/76/938801976.db2.gz PLAGBVHTKVFLSQ-PWHSHALESA-N 0 3 410.558 4.494 20 0 HIADHN COCCOc1c(Cl)cc(NC(=O)N(CCN(C)C)CC(C)C)cc1Cl ZINC000539130608 938808091 /nfs/dbraw/zinc/80/80/91/938808091.db2.gz FHARQGJKDRZACX-UHFFFAOYSA-N 0 3 406.354 4.070 20 0 HIADHN CCCN1c2ccc(NC(=O)N(C)[C@@H]3CCN(Cc4ccccc4)C3)cc2CCC1=O ZINC000539134630 938808945 /nfs/dbraw/zinc/80/89/45/938808945.db2.gz YNVXHBDUOONCND-JOCHJYFZSA-N 0 3 420.557 4.114 20 0 HIADHN O=C(NCCN1CCCC1)c1ccc(NCc2c[nH]nc2-c2cccc(Cl)c2)cc1 ZINC000563498615 945205824 /nfs/dbraw/zinc/20/58/24/945205824.db2.gz VPXGKTBNFHXRNU-UHFFFAOYSA-N 0 3 423.948 4.168 20 0 HIADHN O=C([C@@H](Cc1ccccc1)N[C@@H]1CCc2c1cccc2Br)N1CCCC1 ZINC000539204417 938818989 /nfs/dbraw/zinc/81/89/89/938818989.db2.gz RQHXHOLMOPMAEO-NHCUHLMSSA-N 0 3 413.359 4.260 20 0 HIADHN C[C@@H](N[C@H](c1ccc(Br)cc1)C1CCC1)c1cccc(S(N)(=O)=O)c1 ZINC000539216835 938820119 /nfs/dbraw/zinc/82/01/19/938820119.db2.gz KLNSVWKKKQUCNM-YJYMSZOUSA-N 0 3 423.376 4.289 20 0 HIADHN CC(C)[C@@H](N[C@H](C)c1cccc(S(N)(=O)=O)c1)c1ccc(C(F)(F)F)cc1 ZINC000539217394 938820135 /nfs/dbraw/zinc/82/01/35/938820135.db2.gz NUMCHEVJNGVFBL-FZKQIMNGSA-N 0 3 400.466 4.401 20 0 HIADHN COCCc1ccc(S(=O)(=O)[N-]c2ccc(C[N@@H+]3CCCC[C@H]3C)cc2)cc1 ZINC000539231115 938822297 /nfs/dbraw/zinc/82/22/97/938822297.db2.gz PYOQKLYWYPNOOU-GOSISDBHSA-N 0 3 402.560 4.051 20 0 HIADHN COCCc1ccc(S(=O)(=O)[N-]c2ccc(C[N@H+]3CCCC[C@H]3C)cc2)cc1 ZINC000539231115 938822299 /nfs/dbraw/zinc/82/22/99/938822299.db2.gz PYOQKLYWYPNOOU-GOSISDBHSA-N 0 3 402.560 4.051 20 0 HIADHN CC[C@@H](NCC(=O)N(CC)Cc1ccc(OC)c(OC)c1)c1cccc(Cl)c1 ZINC000539229370 938822356 /nfs/dbraw/zinc/82/23/56/938822356.db2.gz HBRPSTOBQBVGKM-LJQANCHMSA-N 0 3 404.938 4.447 20 0 HIADHN COc1ccc([C@@H](CCO)NCc2cc(Br)cc3cccnc32)cc1 ZINC000539234399 938822984 /nfs/dbraw/zinc/82/29/84/938822984.db2.gz QNGVZCLYJCNIJQ-LJQANCHMSA-N 0 3 401.304 4.219 20 0 HIADHN O=S(=O)(c1ccc(F)c(C(F)(F)F)c1)N1C[C@H]2CCCN2Cc2ccccc21 ZINC000539238869 938823529 /nfs/dbraw/zinc/82/35/29/938823529.db2.gz ZJLDEXKOIXDXTB-CQSZACIVSA-N 0 3 414.424 4.018 20 0 HIADHN CC[C@@H](NCC(=O)Nc1ccc(NC(C)=O)cc1C(F)(F)F)c1ccc(OC)cc1 ZINC000539242784 938824515 /nfs/dbraw/zinc/82/45/15/938824515.db2.gz BHNOTOACQUSICL-GOSISDBHSA-N 0 3 423.435 4.352 20 0 HIADHN C[C@@H](NC[C@H](O)COc1cccc(Br)c1)c1ccccc1OC(F)F ZINC000539245946 938824914 /nfs/dbraw/zinc/82/49/14/938824914.db2.gz IBLDOPAZBTUFOV-OCCSQVGLSA-N 0 3 416.262 4.141 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)N[C@@H]1CCOc2ccccc21)c1ccc(Br)cc1 ZINC000539246542 938825172 /nfs/dbraw/zinc/82/51/72/938825172.db2.gz MYTXNSTWHUBTOF-QWQRMKEZSA-N 0 3 403.320 4.128 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)N[C@H]1CCOc2ccccc21)c1ccc(Br)cc1 ZINC000539246535 938825175 /nfs/dbraw/zinc/82/51/75/938825175.db2.gz MYTXNSTWHUBTOF-GLJUWKHASA-N 0 3 403.320 4.128 20 0 HIADHN COc1cccc(NC(=O)CN[C@@H](Cc2ccc(OC)c(OC)c2)c2ccccc2)c1 ZINC000539262042 938829224 /nfs/dbraw/zinc/82/92/24/938829224.db2.gz XJHFFCUOKRZTHF-QFIPXVFZSA-N 0 3 420.509 4.225 20 0 HIADHN CCOc1cccc([C@H](C)NCC(=O)Nc2ccc3nc(C(F)(F)F)[nH]c3c2)c1 ZINC000539275382 938831464 /nfs/dbraw/zinc/83/14/64/938831464.db2.gz DECDDSHHDLUVEU-LBPRGKRZSA-N 0 3 406.408 4.270 20 0 HIADHN CC[C@H](NCC(=O)N(CC)[C@H](C)c1ccc(F)cc1)c1ccc2c(c1)OCCO2 ZINC000539278605 938832014 /nfs/dbraw/zinc/83/20/14/938832014.db2.gz DKUKBYDFRFQDFD-UZLBHIALSA-N 0 3 400.494 4.247 20 0 HIADHN CC(=O)Nc1ccc(S(=O)(=O)CCCN[C@@H](c2ccc(F)cc2F)C(C)C)cc1 ZINC000539325645 938841599 /nfs/dbraw/zinc/84/15/99/938841599.db2.gz OJQRWJWICRJIIM-OAQYLSRUSA-N 0 3 424.513 4.074 20 0 HIADHN COc1cccc(CN(C)C(=O)CN[C@H](c2cccc(F)c2)C(C)(C)C)c1OC ZINC000539329153 938842681 /nfs/dbraw/zinc/84/26/81/938842681.db2.gz DMENPEFYADTTMA-JOCHJYFZSA-N 0 3 402.510 4.178 20 0 HIADHN C[C@@H](NC(=O)CN[C@@H](C)c1ccc(-n2ccnn2)cc1)c1ccc(Cl)c(Cl)c1 ZINC000539330523 938842976 /nfs/dbraw/zinc/84/29/76/938842976.db2.gz QZCCYEPCDODZKX-UONOGXRCSA-N 0 3 418.328 4.102 20 0 HIADHN COc1cc(NC(=O)CN[C@@H](C[C@H]2CCOC2)c2ccccc2)c(OC)cc1Cl ZINC000539334510 938843570 /nfs/dbraw/zinc/84/35/70/938843570.db2.gz ZMTVDHPFIFDOHW-QAPCUYQASA-N 0 3 418.921 4.053 20 0 HIADHN Cc1cccc([C@@H](NCC(=O)NCc2ccc(C(=O)N3CCCC3)cc2)C(C)(C)C)c1 ZINC000539335580 938843738 /nfs/dbraw/zinc/84/37/38/938843738.db2.gz HJINXTLSOHSRGZ-XMMPIXPASA-N 0 3 421.585 4.224 20 0 HIADHN Cc1cccc([C@@H](NCC(=O)N2CCC(NC(=O)c3ccccc3)CC2)C(C)(C)C)c1 ZINC000539342955 938845457 /nfs/dbraw/zinc/84/54/57/938845457.db2.gz SVKFQCJYWDUGTM-XMMPIXPASA-N 0 3 421.585 4.093 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)NCC(=O)Nc2ccccc2Br)cc1 ZINC000539363515 938849068 /nfs/dbraw/zinc/84/90/68/938849068.db2.gz NOVRNOWKYSTIRE-AWEZNQCLSA-N 0 3 413.319 4.233 20 0 HIADHN Cc1nccn1-c1ccc([C@H](C)N[C@@H](C)C(=O)NC23CC4CC(CC(C4)C2)C3)cc1 ZINC000539363201 938849129 /nfs/dbraw/zinc/84/91/29/938849129.db2.gz QXNHYMJBNLANDI-SUMQHHKZSA-N 0 3 406.574 4.305 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1ccccc1OC(F)(F)F ZINC000539373533 938850628 /nfs/dbraw/zinc/85/06/28/938850628.db2.gz YLTOVSOZCZGRMX-UHFFFAOYSA-N 0 3 408.420 4.042 20 0 HIADHN CC[C@@H](N[C@H](C)Cn1ncc2ccccc2c1=O)c1cc(F)cc(Br)c1 ZINC000539507084 938870373 /nfs/dbraw/zinc/87/03/73/938870373.db2.gz CCPWATYMHLHNON-BFUOFWGJSA-N 0 3 418.310 4.428 20 0 HIADHN CCc1cc(N2CCC[C@H](N[C@H](C)c3ccc(OC)cc3Br)C2)ncn1 ZINC000539509064 938870780 /nfs/dbraw/zinc/87/07/80/938870780.db2.gz SLQVJLREVCOYLD-ZBFHGGJFSA-N 0 3 419.367 4.130 20 0 HIADHN COCC1(NCc2cc(Br)c(OCc3ccccc3)c(OC)c2)CC1 ZINC000539525381 938873236 /nfs/dbraw/zinc/87/32/36/938873236.db2.gz ODYBSFCRWVBJOE-UHFFFAOYSA-N 0 3 406.320 4.305 20 0 HIADHN CCC(CC)n1nc(C(=O)Nc2ccc(CCN3CCSCC3)cc2)cc1C ZINC000539543455 938877201 /nfs/dbraw/zinc/87/72/01/938877201.db2.gz QAYHKBGLCJSPDI-UHFFFAOYSA-N 0 3 400.592 4.396 20 0 HIADHN CCN(CC)CCN(C(=O)[C@@H]1CCC(=O)C[C@@H]1C)c1cccc(Br)c1 ZINC000539546860 938877992 /nfs/dbraw/zinc/87/79/92/938877992.db2.gz XKOCWKLDHCXXND-HNAYVOBHSA-N 0 3 409.368 4.129 20 0 HIADHN Cc1ccc(SC2CCCC2)c(C(=O)N2CC[C@@H](N3CCN(C(C)C)CC3)C2)c1 ZINC000539597949 938885806 /nfs/dbraw/zinc/88/58/06/938885806.db2.gz ZXDICQMLMKBLRO-HXUWFJFHSA-N 0 3 415.647 4.270 20 0 HIADHN CN(CCCOCc1ccccc1)C(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000539603024 938886658 /nfs/dbraw/zinc/88/66/58/938886658.db2.gz XEIJHUQHTSQCLT-FQEVSTJZSA-N 0 3 401.576 4.133 20 0 HIADHN C[C@H](CC(=O)Nc1ccccc1C(F)(F)F)NC1(c2ccc3c(c2)OCO3)CC1 ZINC000539651838 938894120 /nfs/dbraw/zinc/89/41/20/938894120.db2.gz WIBKJMXTDVGZPW-CYBMUJFWSA-N 0 3 406.404 4.430 20 0 HIADHN COCCNC(=O)[C@H](CC(C)C)N[C@H]1CCCc2nc(-c3ccc(F)cc3)sc21 ZINC000539691576 938902953 /nfs/dbraw/zinc/90/29/53/938902953.db2.gz JIRALRQFTCLVIK-HKUYNNGSSA-N 0 3 419.566 4.094 20 0 HIADHN COc1ccc(-c2nnc(CN3CCC[C@H](c4nc(C5CCCCC5)n[nH]4)C3)o2)cc1 ZINC000539765751 938930057 /nfs/dbraw/zinc/93/00/57/938930057.db2.gz ORBXCQFCQOKNNP-SFHVURJKSA-N 0 3 422.533 4.291 20 0 HIADHN COc1ccc(-c2nnc(CN3CCC[C@H](c4n[nH]c(C5CCCCC5)n4)C3)o2)cc1 ZINC000539765751 938930058 /nfs/dbraw/zinc/93/00/58/938930058.db2.gz ORBXCQFCQOKNNP-SFHVURJKSA-N 0 3 422.533 4.291 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)CN[C@@]2(C)CCCc3ccccc32)c(OC)c1 ZINC000539808180 938939154 /nfs/dbraw/zinc/93/91/54/938939154.db2.gz YRIKIWCIRUUSCM-DHLKQENFSA-N 0 3 408.542 4.209 20 0 HIADHN COCCCOC1CCN(Cc2c(C)nn(Cc3ccccc3Cl)c2C)CC1 ZINC000539821681 938945668 /nfs/dbraw/zinc/94/56/68/938945668.db2.gz AVHUTHKUOPFGAO-UHFFFAOYSA-N 0 3 405.970 4.219 20 0 HIADHN COC(=O)[C@@H]1CC12CCN(Cc1cn(-c3ccccc3)nc1-c1ccc(C)o1)CC2 ZINC000539826381 938947810 /nfs/dbraw/zinc/94/78/10/938947810.db2.gz PZAMFWDAGNAJFU-FQEVSTJZSA-N 0 3 405.498 4.216 20 0 HIADHN Cc1nc2ccccn2c1CN1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1 ZINC000539828252 938949176 /nfs/dbraw/zinc/94/91/76/938949176.db2.gz BWTBNUMERDQCCN-UHFFFAOYSA-N 0 3 400.885 4.286 20 0 HIADHN Cn1cc(CN2CCC([C@@H]3C(=O)Nc4cc(Cl)ccc43)CC2)c(-c2ccncc2)n1 ZINC000539839402 938953858 /nfs/dbraw/zinc/95/38/58/938953858.db2.gz KPNBCZXHSMHRSF-NRFANRHFSA-N 0 3 421.932 4.083 20 0 HIADHN COc1cc(N[C@H]2CCCN(Cc3c(C)nn(C(C)(C)C)c3C)C2)cc(OC)c1 ZINC000539849206 938956944 /nfs/dbraw/zinc/95/69/44/938956944.db2.gz BYLHFHJNHLEZQS-SFHVURJKSA-N 0 3 400.567 4.349 20 0 HIADHN CC[C@@H](C)[C@@H](NCc1cccc2nccn21)C(=O)Nc1cccc(N2CCCC2)c1 ZINC000539853398 938958387 /nfs/dbraw/zinc/95/83/87/938958387.db2.gz BQUBZUAHUJQLQU-WZONZLPQSA-N 0 3 405.546 4.078 20 0 HIADHN O=C(Nc1cccc(CN2CCC(Cn3ccnn3)CC2)c1)c1ccc(Cl)cc1 ZINC000539903228 938974097 /nfs/dbraw/zinc/97/40/97/938974097.db2.gz LJVABUMNOMQRLB-UHFFFAOYSA-N 0 3 409.921 4.096 20 0 HIADHN O=C(Nc1cccc(CN2CCS[C@H]3COCC[C@@H]32)c1)c1ccc(Cl)cc1 ZINC000539909759 938976181 /nfs/dbraw/zinc/97/61/81/938976181.db2.gz HNIJCARFHJYBKA-PMACEKPBSA-N 0 3 402.947 4.299 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)[C@@H]2C[C@H]2c2cc(F)ccc2F)cc1 ZINC000539931127 938978849 /nfs/dbraw/zinc/97/88/49/938978849.db2.gz VDOSHLNXNRRJCL-DWLFOUALSA-N 0 3 400.469 4.030 20 0 HIADHN CC(C)n1cnnc1[C@@H]1CCCN(C[C@H](O)COc2ccc(-c3ccccc3)cc2)C1 ZINC000540061584 939055262 /nfs/dbraw/zinc/05/52/62/939055262.db2.gz KGGVKNWKRCNPKW-PKTZIBPZSA-N 0 3 420.557 4.145 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)c1ccc(-c2noc(C(F)F)n2)cc1 ZINC000540067134 939057335 /nfs/dbraw/zinc/05/73/35/939057335.db2.gz UTVLJNGNVUCVMJ-GOSISDBHSA-N 0 3 412.440 4.241 20 0 HIADHN CCCN(C(=O)N[C@@H]1CCO[C@@H](C(C)C)C1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000540085315 939064996 /nfs/dbraw/zinc/06/49/96/939064996.db2.gz WKQATSNAHYSMIM-XPWALMASSA-N 0 3 401.595 4.276 20 0 HIADHN CCc1nc2ccccc2n1C1CCN(C(=O)[C@H]2CCCN2Cc2ccccc2)CC1 ZINC000540120553 939080359 /nfs/dbraw/zinc/08/03/59/939080359.db2.gz TVDHSVODISLQJG-XMMPIXPASA-N 0 3 416.569 4.427 20 0 HIADHN Cc1c([C@H](C)N[C@@H]2CCO[C@@H](C(C)C)C2)nnn1-c1cccc(Br)c1 ZINC000540137377 939086638 /nfs/dbraw/zinc/08/66/38/939086638.db2.gz BRUYMESWROAOCH-FDQGKXFDSA-N 0 3 407.356 4.192 20 0 HIADHN C[C@H](NCCc1nnc(-c2ccccc2)o1)c1ccccc1I ZINC000540146142 939090612 /nfs/dbraw/zinc/09/06/12/939090612.db2.gz AMIABCDFPGMYQN-ZDUSSCGKSA-N 0 3 419.266 4.235 20 0 HIADHN c1ccc(C[C@H](NCc2ccc(COC3CCOCC3)cc2)c2cccnc2)nc1 ZINC000540149279 939092390 /nfs/dbraw/zinc/09/23/90/939092390.db2.gz QXXCIYMODQMSKS-VWLOTQADSA-N 0 3 403.526 4.246 20 0 HIADHN Cc1c([C@H](C)N[C@@H]2CCOC3(CCSCC3)C2)nnn1-c1cccc(Cl)c1 ZINC000540160353 939096012 /nfs/dbraw/zinc/09/60/12/939096012.db2.gz ULCHQOLEKWYUPE-WMLDXEAASA-N 0 3 406.983 4.325 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)C[C@@H](C)NCc1cccc2c1OCCCO2 ZINC000540163419 939098265 /nfs/dbraw/zinc/09/82/65/939098265.db2.gz FIXUDGDZSZNYTC-CQSZACIVSA-N 0 3 404.894 4.017 20 0 HIADHN Cc1nc(Cc2ccccc2)sc1[C@H](C)NCCNC(=O)c1c(F)cccc1F ZINC000540179637 939107415 /nfs/dbraw/zinc/10/74/15/939107415.db2.gz ZNJLRSDYLLUGPN-AWEZNQCLSA-N 0 3 415.509 4.401 20 0 HIADHN CCNC(=O)COc1cccc(CN[C@H]2CCCc3nc(-c4ccccc4)sc32)c1 ZINC000540219994 939135584 /nfs/dbraw/zinc/13/55/84/939135584.db2.gz OMSQTTGFZWFTGO-FQEVSTJZSA-N 0 3 421.566 4.492 20 0 HIADHN CCO[C@@H]1C[C@H](NCc2ccc(OCc3cccs3)c(OC)c2)[C@@H]1n1cccn1 ZINC000563637705 945229635 /nfs/dbraw/zinc/22/96/35/945229635.db2.gz XWJPNKMEKRZGNA-BWAGFHJFSA-N 0 3 413.543 4.041 20 0 HIADHN COc1ccc(CN[C@@H](C)[C@@H](OC)c2ccc(Br)cc2)c(OC)c1OC ZINC000540223525 939139634 /nfs/dbraw/zinc/13/96/34/939139634.db2.gz LNBIOHXCSNQDNP-SCLBCKFNSA-N 0 3 424.335 4.341 20 0 HIADHN CO[C@H](c1ccc(Br)cc1)[C@@H](C)NC(=O)c1cccc(CN(C)C)c1 ZINC000540256485 939174465 /nfs/dbraw/zinc/17/44/65/939174465.db2.gz LQTZKAGANRGHHQ-KUHUBIRLSA-N 0 3 405.336 4.017 20 0 HIADHN Cc1n[nH]c(C)c1[C@H]1CCCN1C(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1 ZINC000540293277 939185074 /nfs/dbraw/zinc/18/50/74/939185074.db2.gz TXEMAIVWDIEEJD-MOPGFXCFSA-N 0 3 415.607 4.408 20 0 HIADHN CC(C)[C@@H](NCc1cccnc1N1CCN(C)CC1)c1cccc(C(F)(F)F)c1 ZINC000540302739 939187788 /nfs/dbraw/zinc/18/77/88/939187788.db2.gz SJUSDZCISMBTPP-HXUWFJFHSA-N 0 3 406.496 4.339 20 0 HIADHN CO[C@H](c1ccc(Br)cc1)[C@@H](C)N[C@H]1CC(=O)N(C)c2ccccc21 ZINC000540315951 939190992 /nfs/dbraw/zinc/19/09/92/939190992.db2.gz KWUBRUKFSWTWKX-VOWSPCBNSA-N 0 3 403.320 4.223 20 0 HIADHN COc1cccc(OCCN[C@@H](CN2CCCC2=O)c2cccc(C(F)(F)F)c2)c1 ZINC000540319067 939192838 /nfs/dbraw/zinc/19/28/38/939192838.db2.gz YCEXUIJJFCFLFH-FQEVSTJZSA-N 0 3 422.447 4.046 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)Nc1ccc2c(c1)OCO2)c1ccc(OCc2cccnc2)cc1 ZINC000540325433 939195155 /nfs/dbraw/zinc/19/51/55/939195155.db2.gz HHXXNSDKOKISPY-SJORKVTESA-N 0 3 419.481 4.067 20 0 HIADHN COc1ccc([C@H](C)NCC(=O)Nc2ccc3nc(C(F)(F)F)[nH]c3c2)cc1F ZINC000540342105 939200804 /nfs/dbraw/zinc/20/08/04/939200804.db2.gz CIPXYKIVCQMAPT-JTQLQIEISA-N 0 3 410.371 4.019 20 0 HIADHN CC(C)C[C@H](NCC(=O)N1CCC(C(=O)Nc2ccccc2)CC1)c1ccccc1 ZINC000540342778 939201056 /nfs/dbraw/zinc/20/10/56/939201056.db2.gz IRGJIAUHEKTVOW-QHCPKHFHSA-N 0 3 407.558 4.241 20 0 HIADHN CC[C@@H](C)[C@@H](NCC(=O)Nc1ccc(C(=O)N(C)C)cc1)c1ccc(Cl)cc1 ZINC000540387294 939223256 /nfs/dbraw/zinc/22/32/56/939223256.db2.gz VQABBSOWEUVAEC-QVKFZJNVSA-N 0 3 401.938 4.357 20 0 HIADHN O=C(CN[C@@H](c1ccccc1)[C@@H]1CCOC1)NCC1(c2ccc(F)cc2)CCCC1 ZINC000540389662 939227108 /nfs/dbraw/zinc/22/71/08/939227108.db2.gz GQYNZTHHXNUGMZ-YKSBVNFPSA-N 0 3 410.533 4.121 20 0 HIADHN O=C(CN[C@H](c1ccccc1)[C@H]1CCOC1)Nc1ccc2c(c1)OC1(CCCC1)O2 ZINC000540390489 939229454 /nfs/dbraw/zinc/22/94/54/939229454.db2.gz YXQDFVSCZSDUQL-FDDCHVKYSA-N 0 3 408.498 4.034 20 0 HIADHN Cc1ccccc1[C@@H](NCC(=O)N1CCN(C(=O)Nc2ccccc2)CC1)C(C)(C)C ZINC000540393510 939232187 /nfs/dbraw/zinc/23/21/87/939232187.db2.gz MIQQPVRKISWSRE-HSZRJFAPSA-N 0 3 422.573 4.048 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)CNC(C)(C)c2cccc(C)c2)c(C(F)(F)F)c1 ZINC000540415357 939240118 /nfs/dbraw/zinc/24/01/18/939240118.db2.gz OAAJUOXUEGZCSG-UHFFFAOYSA-N 0 3 407.436 4.436 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(-n2ccnn2)cc1)C(=O)Nc1cc(Cl)ccc1Cl ZINC000540429491 939245716 /nfs/dbraw/zinc/24/57/16/939245716.db2.gz IXERQSRVTFMZIM-STQMWFEESA-N 0 3 404.301 4.252 20 0 HIADHN Cc1cccc(OCCNC(=O)[C@H](C)N[C@@H](C)c2ccc(-c3ccncc3)cc2)c1 ZINC000540436422 939248659 /nfs/dbraw/zinc/24/86/59/939248659.db2.gz VOQYOBKQGDHYNA-PMACEKPBSA-N 0 3 403.526 4.291 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(-c2ccncc2)cc1)C(=O)Nc1ccc2c(c1)OCCO2 ZINC000540437958 939249643 /nfs/dbraw/zinc/24/96/43/939249643.db2.gz QEJZQYYKMGHRHL-IAGOWNOFSA-N 0 3 403.482 4.198 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(-c2ccncc2)cc1)C(=O)NC(=O)Nc1ccccc1F ZINC000540439729 939250101 /nfs/dbraw/zinc/25/01/01/939250101.db2.gz MXUBCZVHWDCKBC-JKSUJKDBSA-N 0 3 406.461 4.275 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)N[C@@H]1CCOc2ccccc21)c1ccc(-c2ccncc2)cc1 ZINC000540440705 939251327 /nfs/dbraw/zinc/25/13/27/939251327.db2.gz ZOMJLBNDOPLHGA-IEGUWTFLSA-N 0 3 401.510 4.428 20 0 HIADHN CC(C)OCc1ccc(CNC(=O)CN[C@H](C)c2cccc(N3CCCC3)c2)cc1 ZINC000540476468 939268396 /nfs/dbraw/zinc/26/83/96/939268396.db2.gz OXGPSMHATPKOLH-HXUWFJFHSA-N 0 3 409.574 4.179 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@H](C)N[C@H](C)c2cccc(N3CCCC3)c2)cc1F ZINC000540478866 939268740 /nfs/dbraw/zinc/26/87/40/939268740.db2.gz QBADKDGTQXTKOV-MSOLQXFVSA-N 0 3 413.537 4.132 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@@H]1CCO[C@@H]1c1ccc(F)c(F)c1)c1ccsc1 ZINC000540494027 939274834 /nfs/dbraw/zinc/27/48/34/939274834.db2.gz RIQXVGJGZUPCET-VAMGGRTRSA-N 0 3 423.529 4.239 20 0 HIADHN Cc1cc([C@@H](NCC(=O)Nc2cc(Cl)ccc2-n2cncn2)C2CC2)ccc1F ZINC000540523595 939287397 /nfs/dbraw/zinc/28/73/97/939287397.db2.gz WDCIVEBAGVFHKU-NRFANRHFSA-N 0 3 413.884 4.048 20 0 HIADHN Cc1ccccc1[C@@H](NCC(=O)N1CCC[C@H]1c1ccc2c(c1)OCCO2)C1CC1 ZINC000540588853 939312174 /nfs/dbraw/zinc/31/21/74/939312174.db2.gz JOKBTRQCKQQYET-OFVILXPXSA-N 0 3 406.526 4.171 20 0 HIADHN O=C(NCc1ccco1)c1cccc(CN[C@H](c2ccc3c(c2)OCCO3)C2CC2)c1 ZINC000540591123 939313175 /nfs/dbraw/zinc/31/31/75/939313175.db2.gz AQTZUECRWQGREE-DEOSSOPVSA-N 0 3 418.493 4.222 20 0 HIADHN C[C@H](N[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1=O)c1ccc(NC(=O)C2CC2)cc1 ZINC000540705579 939344670 /nfs/dbraw/zinc/34/46/70/939344670.db2.gz UXEQQVSWCWWVFR-RNODOKPDSA-N 0 3 415.896 4.284 20 0 HIADHN Cc1cc(C(=O)N(C)C2CCN(Cc3ccccc3)CC2)nn1-c1ccc(C)cc1 ZINC000540722635 939349504 /nfs/dbraw/zinc/34/95/04/939349504.db2.gz MBIPJHMZILJBSO-UHFFFAOYSA-N 0 3 402.542 4.226 20 0 HIADHN COc1ccc(OC)c(NC(=O)C[C@@H](C)N[C@H]2CCCOc3cc(F)ccc32)c1 ZINC000540780125 939370139 /nfs/dbraw/zinc/37/01/39/939370139.db2.gz WHUAUHMYIHQFFD-KDOFPFPSSA-N 0 3 402.466 4.064 20 0 HIADHN Cc1nnc([C@@H]2CCCN([C@@H](C)c3nc(-c4cccc(C(F)(F)F)c4)no3)C2)[nH]1 ZINC000540862694 939400430 /nfs/dbraw/zinc/40/04/30/939400430.db2.gz HZNDOMJKWZMVNV-SMDDNHRTSA-N 0 3 406.412 4.123 20 0 HIADHN O=c1cc(CN2CCC[C@@H]2/C=C\c2ccccc2)nc2ccc(Br)cn12 ZINC000540944604 939419585 /nfs/dbraw/zinc/41/95/85/939419585.db2.gz PZWVGHLQGLLHJM-IBHIWXBSSA-N 0 3 410.315 4.135 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc(CN[C@H](c2ccc(F)c(F)c2)C(C)C)cc1 ZINC000540990328 939426349 /nfs/dbraw/zinc/42/63/49/939426349.db2.gz MVPKBBYYZAMLLO-NRFANRHFSA-N 0 3 410.530 4.482 20 0 HIADHN OC[C@@H](NC[C@@H](O)COc1c(Cl)cccc1Cl)c1ccc(C(F)(F)F)cc1 ZINC000541023982 939433848 /nfs/dbraw/zinc/43/38/48/939433848.db2.gz UEJHFRQTLDMAIM-CZUORRHYSA-N 0 3 424.246 4.075 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)NCC(=O)N(Cc2ccco2)CC(F)(F)F)cc1 ZINC000541025732 939434421 /nfs/dbraw/zinc/43/44/21/939434421.db2.gz KGOMRAPGEYZBNU-OAHLLOKOSA-N 0 3 420.435 4.015 20 0 HIADHN CN(C)[C@@H](CNC(=O)N1CCO[C@H](c2ccccc2C(F)(F)F)C1)c1ccccc1 ZINC000541034915 939437470 /nfs/dbraw/zinc/43/74/70/939437470.db2.gz OQXSJUBDFPMZTE-PMACEKPBSA-N 0 3 421.463 4.091 20 0 HIADHN O=C(Nc1cccc(CCCO)c1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000541059173 939445119 /nfs/dbraw/zinc/44/51/19/939445119.db2.gz GLBFUDWXFBZSOT-NRFANRHFSA-N 0 3 406.448 4.005 20 0 HIADHN COC(=O)c1ccccc1OCCN1CCC[C@@H](c2nc(C(F)(F)F)cs2)C1 ZINC000541070839 939450001 /nfs/dbraw/zinc/45/00/01/939450001.db2.gz XRENQACTUQYOCM-CYBMUJFWSA-N 0 3 414.449 4.207 20 0 HIADHN CN(Cc1ccccc1NC1CCN(Cc2ccncc2)CC1)C(=O)c1cccs1 ZINC000541090155 939456355 /nfs/dbraw/zinc/45/63/55/939456355.db2.gz MGQMRIWSYXUCOV-UHFFFAOYSA-N 0 3 420.582 4.492 20 0 HIADHN COc1cccc(CN(C)C(=O)CN[C@H](c2ccc(Cl)cc2)C2CC2)c1OC ZINC000541204807 939485490 /nfs/dbraw/zinc/48/54/90/939485490.db2.gz WQIBFPARMDCTSS-NRFANRHFSA-N 0 3 402.922 4.057 20 0 HIADHN COC(=O)c1cccc(NC(=O)C[C@@H](C)N[C@H]2CCSc3c(F)cccc32)c1 ZINC000541210500 939485751 /nfs/dbraw/zinc/48/57/51/939485751.db2.gz PVCWQNFLYXFAHE-ACJLOTCBSA-N 0 3 402.491 4.156 20 0 HIADHN COC(=O)c1cccc(NC(=O)C[C@@H](C)N[C@@H](c2nc3ccccc3[nH]2)C(C)C)c1 ZINC000541217962 939486092 /nfs/dbraw/zinc/48/60/92/939486092.db2.gz IMDJVIIIGQUSMH-QVKFZJNVSA-N 0 3 408.502 4.054 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)c3ccc(-c4cccs4)o3)CC2)C[C@H](C)O1 ZINC000541252997 939487738 /nfs/dbraw/zinc/48/77/38/939487738.db2.gz NEKQFCWJVLIBTP-IRXDYDNUSA-N 0 3 402.560 4.360 20 0 HIADHN NC(=O)[C@H](Cc1ccc(C(F)(F)F)cc1)N[C@H]1C[C@@H]1c1c(F)cccc1Cl ZINC000541301684 939490039 /nfs/dbraw/zinc/49/00/39/939490039.db2.gz KGRMHMZACZQKBO-RCBQFDQVSA-N 0 3 400.803 4.040 20 0 HIADHN COc1cccc(C(NCc2cn(-c3ccncc3)nc2C)c2cccc(OC)c2)c1 ZINC000541314329 939490518 /nfs/dbraw/zinc/49/05/18/939490518.db2.gz BZFBWTVZIKUWDJ-UHFFFAOYSA-N 0 3 414.509 4.472 20 0 HIADHN O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)N[C@@H]1CCCc2cn[nH]c21 ZINC000541312840 939490553 /nfs/dbraw/zinc/49/05/53/939490553.db2.gz XQMUUZQRFPEPSP-GOSISDBHSA-N 0 3 422.360 4.058 20 0 HIADHN CCc1ccc([C@H](CNC(=O)[C@@H]2CCn3c(cnc3C3CCCCC3)C2)N(C)C)cc1 ZINC000541406710 939507488 /nfs/dbraw/zinc/50/74/88/939507488.db2.gz PBFSHVHMLZYSEN-VWNXMTODSA-N 0 3 422.617 4.475 20 0 HIADHN COC[C@@H](Cc1ccccc1)N[C@@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O ZINC000541590489 939561731 /nfs/dbraw/zinc/56/17/31/939561731.db2.gz PJOCQZLHPZGRBK-NHCUHLMSSA-N 0 3 420.475 4.044 20 0 HIADHN COc1cc(-c2nnc(CN[C@@H]3C[C@@H](C)CC[C@@H]3C(C)C)o2)cc(OC)c1OC ZINC000541611062 939569438 /nfs/dbraw/zinc/56/94/38/939569438.db2.gz FNKZWDAJWMGBOP-USXIJHARSA-N 0 3 403.523 4.313 20 0 HIADHN Cc1cccc(C)c1NC(=O)CNC(=O)[C@H](C)N[C@@H](CC(C)C)c1cccs1 ZINC000541626165 939574182 /nfs/dbraw/zinc/57/41/82/939574182.db2.gz GTZLCIARSHGLJY-ROUUACIJSA-N 0 3 401.576 4.185 20 0 HIADHN C[C@@H](N[C@@H](CC(N)=O)C1CCCCC1)C(=O)Nc1ccc(Cl)cc1C(F)(F)F ZINC000541637370 939579560 /nfs/dbraw/zinc/57/95/60/939579560.db2.gz WULAIIICUOXERM-BZNIZROVSA-N 0 3 419.875 4.100 20 0 HIADHN C[C@H](NCC(=O)NCc1ccc(-c2ccc(Cl)cc2)o1)[C@H]1COc2ccccc21 ZINC000541698323 939607933 /nfs/dbraw/zinc/60/79/33/939607933.db2.gz UWZQUAFPNABDQW-MGPUTAFESA-N 0 3 410.901 4.371 20 0 HIADHN C[C@H](NCC(=O)N1Cc2ccccc2[C@@H](c2ccccc2)C1)[C@@H]1COc2ccccc21 ZINC000541704135 939609732 /nfs/dbraw/zinc/60/97/32/939609732.db2.gz ZJTHJQKBSIHTKM-OWAUWMPXSA-N 0 3 412.533 4.315 20 0 HIADHN C[C@@H](C(=O)Nc1ccc2c(c1)OC1(CCCCC1)O2)N1CCC2(CCOCC2)[C@H]1C ZINC000541718206 939613080 /nfs/dbraw/zinc/61/30/80/939613080.db2.gz NISHPKMGQFSELJ-ZWKOTPCHSA-N 0 3 414.546 4.336 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@H]2CCCC[C@H]2NCc2ccc(Cn3ccnc3)cc2)cc1 ZINC000541744104 939618903 /nfs/dbraw/zinc/61/89/03/939618903.db2.gz BXEBEJKYGYGINM-RPWUZVMVSA-N 0 3 423.582 4.115 20 0 HIADHN COc1ccc(C)cc1C1(CN[C@@H](c2ccccc2)c2cncnc2)CCOCC1 ZINC000541743451 939618950 /nfs/dbraw/zinc/61/89/50/939618950.db2.gz QOSSUYDJXVSTFM-DEOSSOPVSA-N 0 3 403.526 4.221 20 0 HIADHN C[C@@H](CN[C@H](c1ccc(F)cc1)c1cccc(S(C)(=O)=O)c1)c1nccs1 ZINC000541767372 939625458 /nfs/dbraw/zinc/62/54/58/939625458.db2.gz YSLHIGPSCVHGKS-IFXJQAMLSA-N 0 3 404.532 4.168 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000541798036 939635565 /nfs/dbraw/zinc/63/55/65/939635565.db2.gz XVOIPJQNBCCYLW-VAMGGRTRSA-N 0 3 417.550 4.244 20 0 HIADHN Cc1ccc([C@H](NCCc2ccc(C)nc2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000541844600 939646323 /nfs/dbraw/zinc/64/63/23/939646323.db2.gz WPTIYLUWDGWPLC-XMMPIXPASA-N 0 3 408.567 4.332 20 0 HIADHN COc1ccc(C[C@H](C)N[C@@H](CCO)c2ccccc2Br)cc1OC ZINC000541916519 939653277 /nfs/dbraw/zinc/65/32/77/939653277.db2.gz JDLJERPYQGJYBR-KSSFIOAISA-N 0 3 408.336 4.111 20 0 HIADHN CC(=O)N1CCN(c2ccccc2CN[C@@H](c2ccc(F)c(F)c2)C(C)C)CC1 ZINC000541918053 939653846 /nfs/dbraw/zinc/65/38/46/939653846.db2.gz MCUIRVBZOHAXHS-HSZRJFAPSA-N 0 3 401.501 4.120 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N[C@@H](c2ccc(Cl)cc2F)C(C)C)CC1 ZINC000541919654 939654375 /nfs/dbraw/zinc/65/43/75/939654375.db2.gz RINXEIKBGQXDCX-HXUWFJFHSA-N 0 3 413.965 4.365 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N[C@H](c2ccc(Cl)cc2F)C(C)C)CC1 ZINC000541919653 939654416 /nfs/dbraw/zinc/65/44/16/939654416.db2.gz RINXEIKBGQXDCX-FQEVSTJZSA-N 0 3 413.965 4.365 20 0 HIADHN CS[C@@H]1CN(C(=O)c2nc(-c3ccc(Cl)c(Cl)c3)oc2C)C[C@@H]1N(C)C ZINC000541991236 939671864 /nfs/dbraw/zinc/67/18/64/939671864.db2.gz IXDHLWPQOUGLTF-LSDHHAIUSA-N 0 3 414.358 4.074 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N2CCC(Oc3cc(C)ccn3)CC2)N2CCCC2)cc1 ZINC000542089745 939706966 /nfs/dbraw/zinc/70/69/66/939706966.db2.gz TVTDUQRYTQRPEA-HSZRJFAPSA-N 0 3 422.573 4.088 20 0 HIADHN O[C@H](CN[C@H](Cc1ccc(Cl)cc1)c1ccccn1)COCc1cccs1 ZINC000542123327 939722067 /nfs/dbraw/zinc/72/20/67/939722067.db2.gz NVZXIILHBWCRTE-WIYYLYMNSA-N 0 3 402.947 4.248 20 0 HIADHN C[C@H](CC(=O)Nc1ccc(NC(=O)C2CC2)cc1)NCc1ccccc1OC(F)F ZINC000542141169 939728035 /nfs/dbraw/zinc/72/80/35/939728035.db2.gz DBSOOYLKKMPWLJ-CQSZACIVSA-N 0 3 417.456 4.143 20 0 HIADHN CCOC(=O)C1CCN(C(=O)C[C@H](C)N[C@H](c2ccc(F)cc2F)C(C)(C)C)CC1 ZINC000542147728 939730737 /nfs/dbraw/zinc/73/07/37/939730737.db2.gz ITORYGNURSPOFT-YCRPNKLZSA-N 0 3 424.532 4.222 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2ccc(SC3CC3)cc2)cc1)[C@H]1CCCN(C)C1 ZINC000542150612 939731681 /nfs/dbraw/zinc/73/16/81/939731681.db2.gz ZFTZEGFEFFEWNU-FQEVSTJZSA-N 0 3 423.582 4.360 20 0 HIADHN O[C@@H](COc1ccccc1C(F)(F)F)CN1CCC(OCc2ccccc2)CC1 ZINC000542210136 939757919 /nfs/dbraw/zinc/75/79/19/939757919.db2.gz NXIDSUGYFIAUTH-GOSISDBHSA-N 0 3 409.448 4.126 20 0 HIADHN Cc1nc2c(s1)[C@H](N(C)C[C@@H](O)COc1ccccc1C(F)(F)F)CCC2 ZINC000542212005 939758876 /nfs/dbraw/zinc/75/88/76/939758876.db2.gz BDHQAUAQTIAWOG-CZUORRHYSA-N 0 3 400.466 4.219 20 0 HIADHN C[C@H](N[C@@H](Cc1ccc(C(F)(F)F)cc1)C(N)=O)c1cccc(N2CCCC2)c1 ZINC000542231892 939766174 /nfs/dbraw/zinc/76/61/74/939766174.db2.gz AYPTWAYIPSULQS-YWZLYKJASA-N 0 3 405.464 4.053 20 0 HIADHN COc1cc(CN[C@@H](C)C[S@](C)=O)ccc1OCc1cccc(C(F)(F)F)c1 ZINC000542298911 939790117 /nfs/dbraw/zinc/79/01/17/939790117.db2.gz RHMXFCJHUOBPMR-POXGOYDTSA-N 0 3 415.477 4.150 20 0 HIADHN Cc1nn(-c2ccncc2)cc1CNc1cccc(NC(=O)CN2CCCCCC2)c1 ZINC000542311847 939795295 /nfs/dbraw/zinc/79/52/95/939795295.db2.gz XYPNECFQFFXIDU-UHFFFAOYSA-N 0 3 418.545 4.002 20 0 HIADHN CCN(CC)[C@@H](CNCc1cnc2c(C)cc(Br)cn12)c1ccco1 ZINC000542318895 939798461 /nfs/dbraw/zinc/79/84/61/939798461.db2.gz AXTGTCZDXAUNGK-KRWDZBQOSA-N 0 3 405.340 4.171 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)[C@@H]1CCn2c(cnc2C2CCCCC2)C1 ZINC000542335714 939802780 /nfs/dbraw/zinc/80/27/80/939802780.db2.gz CQXUVKGMWGQIFE-VWNXMTODSA-N 0 3 420.601 4.447 20 0 HIADHN O=C(c1ccccc1)N1CCC(CN[C@H](c2ccccc2)c2ccc(F)cn2)CC1 ZINC000542471602 939828616 /nfs/dbraw/zinc/82/86/16/939828616.db2.gz BMTNKLSAVIZEHB-XMMPIXPASA-N 0 3 403.501 4.452 20 0 HIADHN O=C1CC[C@@H](NCc2ccc(-n3ccc(C(F)(F)F)n3)cc2)c2ccccc2N1 ZINC000542479623 939830540 /nfs/dbraw/zinc/83/05/40/939830540.db2.gz VRKRHPNBNXLUGS-QGZVFWFLSA-N 0 3 400.404 4.454 20 0 HIADHN COC(=O)COc1ccccc1[C@H](C)NCc1c(C)cc(Br)cc1C ZINC000542479934 939830599 /nfs/dbraw/zinc/83/05/99/939830599.db2.gz XGRNAAJWGAIGQX-HNNXBMFYSA-N 0 3 406.320 4.469 20 0 HIADHN O=C1[C@H](N[C@H]2CCCc3ccc(Br)cc32)CCCN1Cc1ccccn1 ZINC000542499410 939833325 /nfs/dbraw/zinc/83/33/25/939833325.db2.gz PUFARURUSFSGDH-VQTJNVASSA-N 0 3 414.347 4.002 20 0 HIADHN O=S(=O)(CCN[C@@H](c1cccs1)C1CC1)c1cccc(Br)c1 ZINC000542511064 939835052 /nfs/dbraw/zinc/83/50/52/939835052.db2.gz FRPBTQMYCRZPLP-MRXNPFEDSA-N 0 3 400.363 4.025 20 0 HIADHN Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)NC[C@H](O)COc1ccccc1C(C)C ZINC000542534604 939839355 /nfs/dbraw/zinc/83/93/55/939839355.db2.gz YQAIBVXQHVRMJX-PBHICJAKSA-N 0 3 413.484 4.276 20 0 HIADHN C[S@](=O)C[C@@H](NCCOc1ccc(Cl)cc1Br)c1ccccc1 ZINC000542539067 939840208 /nfs/dbraw/zinc/84/02/08/939840208.db2.gz UECOYSQFGKJKFU-MWTRTKDXSA-N 0 3 416.768 4.191 20 0 HIADHN C[C@@H]1N(C(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)CCC12CCOCC2 ZINC000542554595 939842807 /nfs/dbraw/zinc/84/28/07/939842807.db2.gz OXUUTWIEGSDWHC-OALUTQOASA-N 0 3 405.608 4.122 20 0 HIADHN C[C@@H](NCc1ccc(S(=O)(=O)N2CCCC2)o1)C(c1ccccc1)c1ccccc1 ZINC000542557589 939843297 /nfs/dbraw/zinc/84/32/97/939843297.db2.gz ONEFYHYQYULXSK-LJQANCHMSA-N 0 3 424.566 4.374 20 0 HIADHN CCOc1cccc2cc([C@@H](C)NCCCS(=O)(=O)c3ccc(F)cc3)oc21 ZINC000542586874 939846659 /nfs/dbraw/zinc/84/66/59/939846659.db2.gz JRJGJUMSVRKEEQ-OAHLLOKOSA-N 0 3 405.491 4.485 20 0 HIADHN C[C@@H](NCc1cc2c(cc1Br)OCCCO2)[C@@H]1COc2ccccc21 ZINC000542627884 939850099 /nfs/dbraw/zinc/85/00/99/939850099.db2.gz SCTYFEKDJTVVHY-CJNGLKHVSA-N 0 3 404.304 4.265 20 0 HIADHN Cc1ccc(CN(C(=O)CN(C)[C@@H]2CCO[C@H](c3ccc(F)cc3)C2)C2CC2)cc1 ZINC000542626262 939850117 /nfs/dbraw/zinc/85/01/17/939850117.db2.gz AELGUAMPCRTUQI-RPWUZVMVSA-N 0 3 410.533 4.477 20 0 HIADHN CCN(Cc1cccc(F)c1)C(=O)CN(C)[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000542628143 939850268 /nfs/dbraw/zinc/85/02/68/939850268.db2.gz OMGKKESJXYFIQI-FGZHOGPDSA-N 0 3 402.485 4.165 20 0 HIADHN CN(Cc1c(F)cccc1Cl)C(=O)CN(C)[C@@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000542629053 939850277 /nfs/dbraw/zinc/85/02/77/939850277.db2.gz WUKMAXOJQDDMBP-UTKZUKDTSA-N 0 3 422.903 4.429 20 0 HIADHN CS(=O)(=O)c1ccc(-c2nc(CNC3(Cc4ccccc4)CCCC3)co2)cc1 ZINC000542628871 939850288 /nfs/dbraw/zinc/85/02/88/939850288.db2.gz VUMKOFWJFHHXEY-UHFFFAOYSA-N 0 3 410.539 4.390 20 0 HIADHN COc1ccccc1O[C@H](C)CN[C@@H]1CCCC[C@@H]1S(=O)(=O)c1ccc(C)cc1 ZINC000542664025 939852459 /nfs/dbraw/zinc/85/24/59/939852459.db2.gz CAGHSSZGIRXJCY-XQFWAAQXSA-N 0 3 417.571 4.146 20 0 HIADHN Clc1ccccc1N1CCN(CCCN[C@H](c2ccccc2)c2cncnc2)CC1 ZINC000542667981 939852909 /nfs/dbraw/zinc/85/29/09/939852909.db2.gz BTJMRRBDESSGSS-XMMPIXPASA-N 0 3 421.976 4.021 20 0 HIADHN CC[C@@H](CNC(=O)Nc1csc(-c2ccccn2)n1)N1CCc2ccccc2C1 ZINC000542686153 939854073 /nfs/dbraw/zinc/85/40/73/939854073.db2.gz HCWTVCLSCDQRBR-SFHVURJKSA-N 0 3 407.543 4.164 20 0 HIADHN Cc1ccc([C@H](NC[C@@H](C)c2nccs2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000542696846 939854903 /nfs/dbraw/zinc/85/49/03/939854903.db2.gz DHVXJDCDBRZLPH-UZLBHIALSA-N 0 3 400.569 4.338 20 0 HIADHN Cc1ccc([C@H](NC[C@H](C)c2nccs2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000542696843 939854924 /nfs/dbraw/zinc/85/49/24/939854924.db2.gz DHVXJDCDBRZLPH-JXFKEZNVSA-N 0 3 400.569 4.338 20 0 HIADHN C[C@H]1N(C(=O)N[C@@H](CN2CCc3ccccc3C2)C(C)(C)C)CCC12CCOCC2 ZINC000542744465 939858656 /nfs/dbraw/zinc/85/86/56/939858656.db2.gz DGUYCPMLLJUIEW-KNQAVFIVSA-N 0 3 413.606 4.060 20 0 HIADHN Cc1cc(NC(=O)N[C@H](C)C2=CCN(C)CC2)nn1-c1ccc(Cl)c(Cl)c1 ZINC000542837829 939862163 /nfs/dbraw/zinc/86/21/63/939862163.db2.gz TTZCQEYYYUMPBQ-CYBMUJFWSA-N 0 3 408.333 4.259 20 0 HIADHN Cc1ccc(-c2ccc(C(=O)N(C)C3CCN(CCc4ccccn4)CC3)s2)o1 ZINC000542888110 939865506 /nfs/dbraw/zinc/86/55/06/939865506.db2.gz GPCFTPWITDHTEC-UHFFFAOYSA-N 0 3 409.555 4.491 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)C[C@@H]1CCO[C@@H](C(C)C)C1 ZINC000542892671 939865772 /nfs/dbraw/zinc/86/57/72/939865772.db2.gz CXFLFUUNUNYXEX-DNVJHFABSA-N 0 3 424.589 4.418 20 0 HIADHN CC(=O)NC1CCC(N(C)CC(=O)N[C@H](c2ccc(C(C)C)cc2)C(C)C)CC1 ZINC000543171608 939984514 /nfs/dbraw/zinc/98/45/14/939984514.db2.gz DLFQPUGKYLKTDE-IWAAJCSBSA-N 0 3 401.595 4.002 20 0 HIADHN Cc1ccccc1[C@H](OC[C@H](O)CN(C)CCc1ccccc1O)c1ccccc1 ZINC000543254504 940009652 /nfs/dbraw/zinc/00/96/52/940009652.db2.gz ZHOHEFMTLMIJHR-ZEQKJWHPSA-N 0 3 405.538 4.342 20 0 HIADHN Cc1nn(-c2ccncc2)cc1CN1CCC([C@@H]2C(=O)Nc3cc(Cl)ccc32)CC1 ZINC000543393388 940050188 /nfs/dbraw/zinc/05/01/88/940050188.db2.gz CKPHKYXFWPPIJA-QFIPXVFZSA-N 0 3 421.932 4.177 20 0 HIADHN COc1cc(CN2CCC(OC[C@@H]3CCOC3)CC2)ccc1OCc1cccs1 ZINC000543415324 940057829 /nfs/dbraw/zinc/05/78/29/940057829.db2.gz PRERHCKPFFJOLZ-LJQANCHMSA-N 0 3 417.571 4.353 20 0 HIADHN CC[C@H](N[C@H]1CCCN(Cc2ccccn2)C1=O)c1cc(F)cc(Br)c1 ZINC000543426815 940060908 /nfs/dbraw/zinc/06/09/08/940060908.db2.gz KQQNEQIJWPPNFC-OALUTQOASA-N 0 3 420.326 4.215 20 0 HIADHN COC(=O)c1cc(CN[C@H](Cc2ccccc2)c2cccs2)cc(C(=O)OC)c1 ZINC000543454453 940067812 /nfs/dbraw/zinc/06/78/12/940067812.db2.gz KMMRDORWOWXXCX-HXUWFJFHSA-N 0 3 409.507 4.395 20 0 HIADHN COC[C@H](N[C@H](C)C(=O)N1N=C(c2ccc(Cl)cc2)C[C@@H]1c1ccco1)C1CC1 ZINC000543477713 940077673 /nfs/dbraw/zinc/07/76/73/940077673.db2.gz FAFRZKHVCVYTQV-VOBQZIQPSA-N 0 3 415.921 4.014 20 0 HIADHN COc1ccc(C2(C(=O)N3CC[C@@H](C)N(Cc4ccccc4)CC3)CCC2)cc1OC ZINC000543588008 940121013 /nfs/dbraw/zinc/12/10/13/940121013.db2.gz ODFPFJWGQXSVIK-HXUWFJFHSA-N 0 3 422.569 4.249 20 0 HIADHN Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@@H]2NCc2cn(C)nc2-c2ccccc2)cc1 ZINC000543598246 940125498 /nfs/dbraw/zinc/12/54/98/940125498.db2.gz UZEAFZWUBCRKQT-XZOQPEGZSA-N 0 3 423.582 4.270 20 0 HIADHN COc1cc(Br)c(CN[C@H]2CCO[C@H](c3ccc(F)cc3)C2)cc1O ZINC000543617679 940134271 /nfs/dbraw/zinc/13/42/71/940134271.db2.gz DJFNPWOYDBGBBB-YJBOKZPZSA-N 0 3 410.283 4.312 20 0 HIADHN CS[C@H]1CN(C(=O)c2ccc(-c3nc4ccccc4s3)o2)C[C@H]1N1CCCC1 ZINC000543700134 940163079 /nfs/dbraw/zinc/16/30/79/940163079.db2.gz YYAGLRPZQNZGBQ-BEFAXECRSA-N 0 3 413.568 4.208 20 0 HIADHN COc1ccc2c(c1)C[C@H](C)N(C(=O)CCCN1CCN(c3ccccc3)CC1)[C@H]2C ZINC000543789190 940187775 /nfs/dbraw/zinc/18/77/75/940187775.db2.gz YYWWCAVFMJRUSR-SFTDATJTSA-N 0 3 421.585 4.132 20 0 HIADHN CN1CC[C@H](CNCc2ncc(Br)s2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000543848972 940208032 /nfs/dbraw/zinc/20/80/32/940208032.db2.gz DKPWVABTZKBDTH-BDJLRTHQSA-N 0 3 418.763 4.481 20 0 HIADHN C[C@H](C(=O)N1CCC(F)(c2cccnc2)CC1)N1CCC(Cc2ccccc2)CC1 ZINC000563828545 945307546 /nfs/dbraw/zinc/30/75/46/945307546.db2.gz XTDDZDNBTQKNPB-HXUWFJFHSA-N 0 3 409.549 4.212 20 0 HIADHN CS(=O)(=O)c1cccc(Oc2ncccc2CNC2CC(c3ccccc3)C2)c1 ZINC000543993515 940288557 /nfs/dbraw/zinc/28/85/57/940288557.db2.gz ZTLJEWQXLVQWQO-UHFFFAOYSA-N 0 3 408.523 4.313 20 0 HIADHN C[C@H]1CN(c2ccc(CN[C@H]3CCCc4c(Br)cccc43)cn2)CCO1 ZINC000544008403 940296524 /nfs/dbraw/zinc/29/65/24/940296524.db2.gz KUMLYLWUTZVTPU-YWZLYKJASA-N 0 3 416.363 4.236 20 0 HIADHN CC(C)Oc1ccc(-c2nn(-c3ccccc3)cc2CN[C@@H](C)C[S@](C)=O)cc1 ZINC000544169171 940342575 /nfs/dbraw/zinc/34/25/75/940342575.db2.gz MGGDKENEUHGNAK-YRVHBCJASA-N 0 3 411.571 4.183 20 0 HIADHN O=S1(=O)CCCC[C@H]1CNCc1ccc(-c2ccc(Br)cc2)s1 ZINC000544180981 940346206 /nfs/dbraw/zinc/34/62/06/940346206.db2.gz JZVDNYNUUZHPEF-INIZCTEOSA-N 0 3 414.390 4.235 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)[C@H]2CCn3c(cnc3C3CCCCC3)C2)N(C)C)cc1 ZINC000544198854 940352266 /nfs/dbraw/zinc/35/22/66/940352266.db2.gz FJWKAQIXVHVXHC-JTHBVZDNSA-N 0 3 408.590 4.221 20 0 HIADHN O=C(NC[C@H]1CCCN1Cc1ccccc1)[C@H]1CCn2c(cnc2C2CCCCC2)C1 ZINC000544224208 940359476 /nfs/dbraw/zinc/35/94/76/940359476.db2.gz ASMCKAPEVDXGQI-XZOQPEGZSA-N 0 3 420.601 4.274 20 0 HIADHN NC(=O)C1CCN(C[C@@H](NCc2ccc(F)c(Cl)c2)c2ccc(Cl)cc2)CC1 ZINC000544359509 940400897 /nfs/dbraw/zinc/40/08/97/940400897.db2.gz LGDKTGXMNPRPHI-HXUWFJFHSA-N 0 3 424.347 4.161 20 0 HIADHN Fc1ccc([C@H](NCC2(c3ccc4c(c3)OCO4)CCOCC2)c2ccccn2)cc1 ZINC000544366778 940403356 /nfs/dbraw/zinc/40/33/56/940403356.db2.gz VYXDGAFELZJRFF-DEOSSOPVSA-N 0 3 420.484 4.377 20 0 HIADHN CCc1nc(Cc2noc([C@]3(C(F)(F)F)CCN(Cc4ccccc4)C3)n2)cs1 ZINC000544382463 940407143 /nfs/dbraw/zinc/40/71/43/940407143.db2.gz HTNCXNKQDOLZPY-IBGZPJMESA-N 0 3 422.476 4.385 20 0 HIADHN COc1ccc(OC)c([C@@H]2CCCN2C(=O)CN[C@@H](c2cccs2)C2CC2)c1 ZINC000544399371 940412511 /nfs/dbraw/zinc/41/25/11/940412511.db2.gz BRCZNISJZYJUOB-PGRDOPGGSA-N 0 3 400.544 4.170 20 0 HIADHN CC[C@H](C)c1ccccc1OCc1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1 ZINC000544425556 940424233 /nfs/dbraw/zinc/42/42/33/940424233.db2.gz RXPVKXDAZLEQBZ-SFHVURJKSA-N 0 3 421.545 4.366 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1C[C@@H](C)C[C@@H]1c1cccnc1)c1cccc(OC)c1 ZINC000544437587 940430703 /nfs/dbraw/zinc/43/07/03/940430703.db2.gz KCFYLDLLWMZLTO-CDNPAEQRSA-N 0 3 410.562 4.266 20 0 HIADHN CC(C)(C)[C@H]1CCN(Cc2ccnc(-c3ccc(Br)cc3)n2)C[C@@H]1O ZINC000544438949 940431311 /nfs/dbraw/zinc/43/13/11/940431311.db2.gz UADDFPFOVFGLGM-ROUUACIJSA-N 0 3 404.352 4.135 20 0 HIADHN CCc1cnccc1[C@H](C)NC[C@@H](NS(=O)(=O)c1ccc(C)cc1)c1ccccc1 ZINC000544451711 940436490 /nfs/dbraw/zinc/43/64/90/940436490.db2.gz QDAINYNQPVMNIE-YADARESESA-N 0 3 423.582 4.323 20 0 HIADHN C[C@H](N[C@H](CC(N)=O)C1CCCCC1)C(=O)Nc1ccccc1Cc1ccccc1 ZINC000544455458 940438080 /nfs/dbraw/zinc/43/80/80/940438080.db2.gz AYCRFTATCPGXMM-FDDCHVKYSA-N 0 3 407.558 4.018 20 0 HIADHN CC(C)c1ccc(CCNC(=O)CN(C)[C@H]2CCO[C@@H](c3ccc(F)cc3)C2)cc1 ZINC000544530429 940472990 /nfs/dbraw/zinc/47/29/90/940472990.db2.gz UETUZFVYTXWGMX-BJKOFHAPSA-N 0 3 412.549 4.460 20 0 HIADHN CS[C@H]1CN(C(=O)c2ccc(COc3ccc(C)cc3C)o2)C[C@@H]1N1CCCC1 ZINC000544685226 940502184 /nfs/dbraw/zinc/50/21/84/940502184.db2.gz WMXOEFPIGOWOPR-UGKGYDQZSA-N 0 3 414.571 4.127 20 0 HIADHN CCN(C(=O)CCCc1nc(-c2cccs2)no1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000544848341 940518994 /nfs/dbraw/zinc/51/89/94/940518994.db2.gz UXGPZOHGOTUSIQ-IBGZPJMESA-N 0 3 424.570 4.244 20 0 HIADHN CCCOc1ccc(-c2noc([C@H]3CCCN(Cc4cccnc4)C3)n2)cc1OC ZINC000544902222 940523238 /nfs/dbraw/zinc/52/32/38/940523238.db2.gz MEOZBMHPKRLPNU-IBGZPJMESA-N 0 3 408.502 4.309 20 0 HIADHN CO[C@@H](c1noc(-c2ccc(N3CCN(C(C)C)CC3)cc2)n1)c1ccc(F)cc1 ZINC000545091670 940541721 /nfs/dbraw/zinc/54/17/21/940541721.db2.gz YBUGRQCGXNZTFQ-OAQYLSRUSA-N 0 3 410.493 4.142 20 0 HIADHN Cc1cc(NC(=O)N2CC[C@@H](N3CCN(C(C)C)CC3)C2)ccc1-c1ccccc1 ZINC000545176147 940554457 /nfs/dbraw/zinc/55/44/57/940554457.db2.gz NMKKRVUZNXVQJB-HSZRJFAPSA-N 0 3 406.574 4.294 20 0 HIADHN COc1cc([C@H](C)N[C@H](C)[C@@H](OC)c2ccccc2Cl)ccc1S(C)(=O)=O ZINC000545460612 940570947 /nfs/dbraw/zinc/57/09/47/940570947.db2.gz RNJMFEAQFYPWTD-LRDNONRASA-N 0 3 411.951 4.179 20 0 HIADHN CCN(C(=O)c1ccc(OC)c(OC(F)F)c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000545476182 940571368 /nfs/dbraw/zinc/57/13/68/940571368.db2.gz NGZARNVVSUIXQP-SFHVURJKSA-N 0 3 404.457 4.033 20 0 HIADHN CCN(C(=O)CCc1c(C)nn(CC(C)C)c1C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000545475798 940571431 /nfs/dbraw/zinc/57/14/31/940571431.db2.gz MWFFAISAQMPXFV-QHCPKHFHSA-N 0 3 410.606 4.212 20 0 HIADHN COCCC(C)(C)CN[C@@H](c1cccc(S(C)(=O)=O)c1)c1ccc(F)c(F)c1 ZINC000545518557 940572887 /nfs/dbraw/zinc/57/28/87/940572887.db2.gz NICNEGVXEMNVBM-FQEVSTJZSA-N 0 3 411.514 4.110 20 0 HIADHN COc1ccccc1Cc1noc([C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)n1 ZINC000545553865 940574594 /nfs/dbraw/zinc/57/45/94/940574594.db2.gz RVSOZZARKMFIKW-OAQYLSRUSA-N 0 3 417.431 4.375 20 0 HIADHN Fc1cccc(CN2CCC[C@@H](c3nc(-c4cncc(Br)c4)no3)C2)c1 ZINC000545608304 940577000 /nfs/dbraw/zinc/57/70/00/940577000.db2.gz KUAQASOKWSPWPP-CQSZACIVSA-N 0 3 417.282 4.413 20 0 HIADHN C/C(=C\c1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1)c1ccccc1Cl ZINC000545656403 940579171 /nfs/dbraw/zinc/57/91/71/940579171.db2.gz LZBSEDLFGFLOSV-JQIJEIRASA-N 0 3 409.921 4.487 20 0 HIADHN C[C@@H]1CN(Cc2ccc(-c3nc(-c4ccc(F)c(CN(C)C)c4)no3)cc2)C[C@H](C)O1 ZINC000545751918 940583782 /nfs/dbraw/zinc/58/37/82/940583782.db2.gz NNEPOGLLNPEHGP-CALCHBBNSA-N 0 3 424.520 4.214 20 0 HIADHN C[C@H]1CN(Cc2ccc(-c3nc(-c4ccc(F)c(CN(C)C)c4)no3)cc2)C[C@H](C)O1 ZINC000545751926 940583822 /nfs/dbraw/zinc/58/38/22/940583822.db2.gz NNEPOGLLNPEHGP-IRXDYDNUSA-N 0 3 424.520 4.214 20 0 HIADHN Cc1ccc(C(=O)CCCCC(=O)N2CCC(CN3C[C@@H](C)O[C@H](C)C3)CC2)cc1 ZINC000546081867 940693874 /nfs/dbraw/zinc/69/38/74/940693874.db2.gz KGDJHJGKXLPNGB-NHCUHLMSSA-N 0 3 414.590 4.086 20 0 HIADHN COC1CCN(C2(CNC(=O)[C@H](C)CC(=O)c3ccc(Cl)cc3)CCCC2)CC1 ZINC000546085068 940694568 /nfs/dbraw/zinc/69/45/68/940694568.db2.gz BJYJKDFBLMQKBV-QGZVFWFLSA-N 0 3 420.981 4.089 20 0 HIADHN CCc1nccn1C[C@H]1CCCN1C(=O)c1cccc2[nH]c(-c3cccs3)nc21 ZINC000546144795 940712989 /nfs/dbraw/zinc/71/29/89/940712989.db2.gz CMXUXUSFGZMYBU-OAHLLOKOSA-N 0 3 405.527 4.355 20 0 HIADHN CCN(C(=O)Cc1nc(-c2ccccc2)oc1C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000546184782 940724233 /nfs/dbraw/zinc/72/42/33/940724233.db2.gz QPMCYMZAFUJUAT-JOCHJYFZSA-N 0 3 403.526 4.316 20 0 HIADHN CC[C@@H](CC(F)(F)F)NC(=O)Nc1cc(C)nn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000546216746 940732043 /nfs/dbraw/zinc/73/20/43/940732043.db2.gz GRVKMXXIVNCVSE-ZWKOTPCHSA-N 0 3 423.483 4.491 20 0 HIADHN CC[C@@H](CC(F)(F)F)NC(=O)Nc1cc(C)nn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000546216745 940732113 /nfs/dbraw/zinc/73/21/13/940732113.db2.gz GRVKMXXIVNCVSE-ROUUACIJSA-N 0 3 423.483 4.491 20 0 HIADHN Cc1cc(Br)cn2cc(CCN[C@@H](c3ccccc3)c3cncnc3)nc12 ZINC000546222309 940733732 /nfs/dbraw/zinc/73/37/32/940733732.db2.gz FZAOWMWKBTZUBV-FQEVSTJZSA-N 0 3 422.330 4.117 20 0 HIADHN CCN(CC(=O)Nc1ccc(N2CCCC2)cc1C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000546225742 940735251 /nfs/dbraw/zinc/73/52/51/940735251.db2.gz VQLAKRVKTOAMSR-DEOSSOPVSA-N 0 3 420.601 4.130 20 0 HIADHN COCCn1cc2c(n1)[C@H](N[C@H](C)Cc1ccc(Br)cc1F)CCC2 ZINC000546227229 940735786 /nfs/dbraw/zinc/73/57/86/940735786.db2.gz FOJZWTOXWUIJCL-FZKQIMNGSA-N 0 3 410.331 4.029 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(-c4cnc(-c5ccccc5)s4)n3)cn2)CC1 ZINC000546365785 940802754 /nfs/dbraw/zinc/80/27/54/940802754.db2.gz BGWKORFNVVEIJE-UHFFFAOYSA-N 0 3 418.526 4.064 20 0 HIADHN Fc1cccc(CN2CCC[C@@H](c3nc(-c4cccc(OCC(F)F)n4)no3)C2)c1 ZINC000546555093 940851517 /nfs/dbraw/zinc/85/15/17/940851517.db2.gz FRWXZZQWOOUQMX-OAHLLOKOSA-N 0 3 418.419 4.294 20 0 HIADHN Cc1cc(C(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)c(C)n1Cc1ccncc1 ZINC000546565004 940854694 /nfs/dbraw/zinc/85/46/94/940854694.db2.gz LZEXVZJTIRJTNF-NRFANRHFSA-N 0 3 416.569 4.285 20 0 HIADHN CC[C@H](CNC(=O)c1cc(C)n(Cc2ccncc2)c1C)N1CCc2ccccc2C1 ZINC000546583299 940857462 /nfs/dbraw/zinc/85/74/62/940857462.db2.gz MFEBAEDCJAGDMF-XMMPIXPASA-N 0 3 416.569 4.115 20 0 HIADHN C[C@@](O)(C1CCN(CCC(=O)Nc2c(Cl)cccc2Cl)CC1)C(F)(F)F ZINC000546637547 940863399 /nfs/dbraw/zinc/86/33/99/940863399.db2.gz SBONYMWKBSLZFN-MRXNPFEDSA-N 0 3 413.267 4.347 20 0 HIADHN CCCN(C(=O)NC[C@H](C)c1nccs1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000546747684 940875460 /nfs/dbraw/zinc/87/54/60/940875460.db2.gz YZMLLKYCVKDMPU-ICSRJNTNSA-N 0 3 400.592 4.333 20 0 HIADHN CC[C@H](CNC(=O)NCc1nc2ccccc2n1C1CC1)N1CCc2ccccc2C1 ZINC000546758190 940878220 /nfs/dbraw/zinc/87/82/20/940878220.db2.gz RUGINYROUXMBKD-HXUWFJFHSA-N 0 3 417.557 4.007 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1ccc2c(c1)CCC(=O)N2CC)c1ccsc1 ZINC000546843336 940893008 /nfs/dbraw/zinc/89/30/08/940893008.db2.gz YHJAGDKRGVXZIO-FQEVSTJZSA-N 0 3 414.575 4.252 20 0 HIADHN Cc1nc(C(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)c(-c2ccccc2)o1 ZINC000546853969 940895512 /nfs/dbraw/zinc/89/55/12/940895512.db2.gz WXCYRQRMRFVYCY-QZTJIDSGSA-N 0 3 411.546 4.002 20 0 HIADHN Cc1nc(C(=O)Nc2cccc(CN3CCC(CO)CC3)c2)c(-c2ccccc2)o1 ZINC000546854382 940896008 /nfs/dbraw/zinc/89/60/08/940896008.db2.gz JHMLCELNSKWMSQ-UHFFFAOYSA-N 0 3 405.498 4.107 20 0 HIADHN CCO[C@@H]1COCC[C@H]1NCc1cn(-c2ccc(Br)cc2)nc1C(C)C ZINC000546963411 940929797 /nfs/dbraw/zinc/92/97/97/940929797.db2.gz IKVJGQBBLCDHRD-RTBURBONSA-N 0 3 422.367 4.042 20 0 HIADHN CN1CCCN(c2ccc(-c3noc([C@H]4C[C@@]45CCCc4ccccc45)n3)cn2)CC1 ZINC000547067356 940981726 /nfs/dbraw/zinc/98/17/26/940981726.db2.gz CKWODHLAALBHLF-PXDATVDWSA-N 0 3 415.541 4.035 20 0 HIADHN FC(F)(F)[C@@]1(c2nc(-c3n[nH]c4ccccc43)no2)CCN(Cc2ccccc2)C1 ZINC000547122549 941003822 /nfs/dbraw/zinc/00/38/22/941003822.db2.gz VPUURZNFLRKSGG-FQEVSTJZSA-N 0 3 413.403 4.319 20 0 HIADHN O=C1C[C@@H](c2noc([C@H]3CCCN(Cc4cccc(F)c4)C3)n2)CN1c1ccccc1 ZINC000547133672 941007173 /nfs/dbraw/zinc/00/71/73/941007173.db2.gz GGZXJMAAPBURQQ-RBUKOAKNSA-N 0 3 420.488 4.109 20 0 HIADHN Cn1ccc([C@H](NC(=O)c2cccc(CN3CCCC3)c2)c2ccc(Cl)cc2)n1 ZINC000547257922 941045856 /nfs/dbraw/zinc/04/58/56/941045856.db2.gz BYJHNZOVCAZKBK-JOCHJYFZSA-N 0 3 408.933 4.189 20 0 HIADHN CCN(C(=O)Nc1ccc(-n2cccn2)c(F)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000547465097 941064087 /nfs/dbraw/zinc/06/40/87/941064087.db2.gz UATAZDLUJNEYHH-HXUWFJFHSA-N 0 3 407.493 4.140 20 0 HIADHN CCO[C@@H](C)c1noc(CN2CCN(CC3CCC(c4ccccc4)CC3)CC2)n1 ZINC000548066078 941085039 /nfs/dbraw/zinc/08/50/39/941085039.db2.gz ALSHWKMYPJCCSN-YMISUZCDSA-N 0 3 412.578 4.259 20 0 HIADHN COCCOc1ccc(C(=O)N(CCN2CCCC2)c2ccccc2)c(Cl)c1 ZINC000548108679 941087051 /nfs/dbraw/zinc/08/70/51/941087051.db2.gz UPJVBGSXLMEDEI-UHFFFAOYSA-N 0 3 402.922 4.108 20 0 HIADHN CN(C(=O)N[C@@H](c1ccccc1)C(F)(F)F)C1CCN(CCc2ccccn2)CC1 ZINC000548170713 941090409 /nfs/dbraw/zinc/09/04/09/941090409.db2.gz FRMLHXIHSWLWKG-FQEVSTJZSA-N 0 3 420.479 4.034 20 0 HIADHN CCN(C(=O)NCc1ccc(NC(=O)C(C)C)cc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000548442965 941104533 /nfs/dbraw/zinc/10/45/33/941104533.db2.gz SPGSNMMKDDASPE-HSZRJFAPSA-N 0 3 422.573 4.087 20 0 HIADHN C[C@H](c1ccccc1)n1c(SCCCN2CCN(C)CC2)nnc1-c1ccccc1 ZINC000548475857 941106720 /nfs/dbraw/zinc/10/67/20/941106720.db2.gz CDXHYKCHJFJVBN-HXUWFJFHSA-N 0 3 421.614 4.284 20 0 HIADHN CCc1ccc(CNCc2ccnc(N3CCN(c4ccc(F)cc4)CC3)c2)cc1 ZINC000548896849 941128152 /nfs/dbraw/zinc/12/81/52/941128152.db2.gz JJTJXTBLSMQSRG-UHFFFAOYSA-N 0 3 404.533 4.400 20 0 HIADHN O=C(Nc1c[nH]nc1[C@H]1CCCN(C[C@@H]2CCC3(CCCC3)O2)C1)c1ccccc1 ZINC000548916768 941128942 /nfs/dbraw/zinc/12/89/42/941128942.db2.gz MRTQRQPEWLBDLM-PMACEKPBSA-N 0 3 408.546 4.333 20 0 HIADHN O[C@H](CNCc1ccc(-c2ccccc2)o1)COc1ccc(Br)cc1 ZINC000548925424 941129739 /nfs/dbraw/zinc/12/97/39/941129739.db2.gz DLEPFPBBJXEEHH-QGZVFWFLSA-N 0 3 402.288 4.239 20 0 HIADHN COc1cc(NC(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)c(OC)cc1Cl ZINC000548947414 941132285 /nfs/dbraw/zinc/13/22/85/941132285.db2.gz YTCHCDRNSKMPNA-INIZCTEOSA-N 0 3 412.317 4.435 20 0 HIADHN CN(C)C[C@H](NC(=O)Nc1ccc(N2CCCC2=O)c(F)c1)c1ccc(Cl)cc1 ZINC000548962744 941134759 /nfs/dbraw/zinc/13/47/59/941134759.db2.gz WXLYUASWTJLJPT-SFHVURJKSA-N 0 3 418.900 4.030 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1cc(F)c(C(=O)OC)c(F)c1)c1ccsc1 ZINC000549046453 941148264 /nfs/dbraw/zinc/14/82/64/941148264.db2.gz FDDZRNCWRFTDDJ-MRXNPFEDSA-N 0 3 411.474 4.018 20 0 HIADHN Cc1ccc(Cc2ccccn2)cc1NC(=O)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000549056512 941149754 /nfs/dbraw/zinc/14/97/54/941149754.db2.gz YGFVMSUIVDDVFR-QHCPKHFHSA-N 0 3 400.526 4.377 20 0 HIADHN CN(C)C[C@@H](NC(=O)NCc1coc(-c2cccs2)n1)c1ccc(Cl)cc1 ZINC000549104188 941159487 /nfs/dbraw/zinc/15/94/87/941159487.db2.gz QNCXYCJMAJMCKE-MRXNPFEDSA-N 0 3 404.923 4.159 20 0 HIADHN COc1cccc([C@@H]2[C@@H](N[C@@H](C)C(=O)Nc3ccccc3Cl)CCN2C2CC2)c1 ZINC000549112873 941160971 /nfs/dbraw/zinc/16/09/71/941160971.db2.gz MELJHUNWBBDVIB-UZQPLGKSSA-N 0 3 413.949 4.243 20 0 HIADHN CCN1CC[C@@H](NCC(=O)Nc2ccc(Cl)cc2)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000549113799 941161146 /nfs/dbraw/zinc/16/11/46/941161146.db2.gz OEUJSPLJCRYABC-YLJYHZDGSA-N 0 3 411.855 4.121 20 0 HIADHN CCN1CC[C@@H](NCC(=O)Nc2cc(C)ccc2OC)[C@H]1c1ccc(Cl)c(F)c1 ZINC000549113497 941161161 /nfs/dbraw/zinc/16/11/61/941161161.db2.gz PZCLHWJGCDRERN-XMSQKQJNSA-N 0 3 419.928 4.160 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@H](NCc2cc(OC)c(OCC)c(OC)c2)c2ccccc21 ZINC000549118371 941161918 /nfs/dbraw/zinc/16/19/18/941161918.db2.gz GHXYCTPAJOHFMD-UXHICEINSA-N 0 3 413.514 4.374 20 0 HIADHN O=C1CCCN1C[C@H](NC[C@@H]1CCC2(CCCC2)O1)c1cccc(C(F)(F)F)c1 ZINC000549136806 941164464 /nfs/dbraw/zinc/16/44/64/941164464.db2.gz YLBZBPDOTUCOEK-OALUTQOASA-N 0 3 410.480 4.450 20 0 HIADHN Cc1ccc(NC(=O)C2CC2)cc1NC(=O)N[C@H](CN(C)C)c1ccc(Cl)cc1 ZINC000549197349 941170496 /nfs/dbraw/zinc/17/04/96/941170496.db2.gz RZBHSGQJEZQUAA-HXUWFJFHSA-N 0 3 414.937 4.421 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)cc1 ZINC000549231493 941172619 /nfs/dbraw/zinc/17/26/19/941172619.db2.gz OQYYLPLXGZWGOP-YWZLYKJASA-N 0 3 416.953 4.293 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@@H](N[C@H](Cc2nc(C)no2)c2ccccc2)c2ccccc21 ZINC000549236915 941173090 /nfs/dbraw/zinc/17/30/90/941173090.db2.gz HSYILWCHZSGBAG-YPAWHYETSA-N 0 3 405.498 4.433 20 0 HIADHN CN(C)C[C@@H](NC(=O)Cc1cccc(OCC(F)(F)F)c1)c1ccc(Cl)cc1 ZINC000549239439 941173331 /nfs/dbraw/zinc/17/33/31/941173331.db2.gz BLFAMTZBLOEERK-GOSISDBHSA-N 0 3 414.855 4.243 20 0 HIADHN CN(C)C[C@@H](NC(=O)Nc1ccc2nnc(C3CCC3)n2c1)c1ccc(Cl)cc1 ZINC000549282118 941176593 /nfs/dbraw/zinc/17/65/93/941176593.db2.gz OCUQSOLBZVTGRH-GOSISDBHSA-N 0 3 412.925 4.075 20 0 HIADHN COc1ccccc1NC(=O)CN[C@H]1CCN(C(C)C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000549345358 941181643 /nfs/dbraw/zinc/18/16/43/941181643.db2.gz NDFMXIOHQOFJMY-UGKGYDQZSA-N 0 3 419.928 4.240 20 0 HIADHN FC(F)(F)COc1ccc(CN(Cc2ccc(-n3cncn3)cc2)C2CC2)cc1 ZINC000549403904 941186631 /nfs/dbraw/zinc/18/66/31/941186631.db2.gz HYAWSVRRZPWCHR-UHFFFAOYSA-N 0 3 402.420 4.373 20 0 HIADHN COCCOc1ccc(CN2CCC(F)(c3cc(OC)cc(OC)c3)CC2)cc1 ZINC000549406621 941186790 /nfs/dbraw/zinc/18/67/90/941186790.db2.gz HSKAWSLSCAAVBV-UHFFFAOYSA-N 0 3 403.494 4.190 20 0 HIADHN COc1cccc([C@H]2[C@H](NCC(=O)Nc3ccccc3C(C)C)CCN2C2CC2)c1 ZINC000549477724 941194846 /nfs/dbraw/zinc/19/48/46/941194846.db2.gz MWQNDJJGWPNVIW-NOZRDPDXSA-N 0 3 407.558 4.325 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@H](N[C@H](CN2CCOCC2)c2ccc(C)cc2)c2ccccc21 ZINC000549527869 941198109 /nfs/dbraw/zinc/19/81/09/941198109.db2.gz OXFPFFIXZGZIEU-DSNGMDLFSA-N 0 3 422.569 4.140 20 0 HIADHN C[C@H]1C[C@@H](NS(=O)(=O)Cc2ccc(C(F)F)cc2)CCN1Cc1ccccc1 ZINC000549782408 941207284 /nfs/dbraw/zinc/20/72/84/941207284.db2.gz PUQTXQISFXMMQI-JXFKEZNVSA-N 0 3 408.514 4.097 20 0 HIADHN Fc1ccc(CC2(NCc3nn(-c4ccccc4)c4c3CCC4)CCOCC2)cc1 ZINC000549797088 941207657 /nfs/dbraw/zinc/20/76/57/941207657.db2.gz HNGHFAAJCMGUBV-UHFFFAOYSA-N 0 3 405.517 4.382 20 0 HIADHN Cc1nn(-c2ccccn2)c(C)c1CNc1cc(CN2CCSCC2)ccc1C ZINC000549808401 941208002 /nfs/dbraw/zinc/20/80/02/941208002.db2.gz PMIMYIJHIIZZHP-UHFFFAOYSA-N 0 3 407.587 4.353 20 0 HIADHN COc1ccc(CN(Cc2cn(-c3ccncc3)nc2C)[C@H](C)C2CC2)c(OC)c1 ZINC000549821456 941208545 /nfs/dbraw/zinc/20/85/45/941208545.db2.gz XAUXOXVWQIFHPJ-GOSISDBHSA-N 0 3 406.530 4.394 20 0 HIADHN CCO[C@@H]1C[C@H](NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1n1cccn1 ZINC000549942565 941243756 /nfs/dbraw/zinc/24/37/56/941243756.db2.gz XAZHJDRXSCGABE-XHSDSOJGSA-N 0 3 407.358 4.429 20 0 HIADHN CC(C)n1ccnc1CNC1(Cc2ccc(F)cc2Br)CCOCC1 ZINC000550138750 941288937 /nfs/dbraw/zinc/28/89/37/941288937.db2.gz CVQGRYLYCDKDOW-UHFFFAOYSA-N 0 3 410.331 4.247 20 0 HIADHN C[C@@H](Cc1cccc(O)c1)NC(=O)N(CCN(C)C)Cc1ccc(C(F)(F)F)cc1 ZINC000550271810 941307280 /nfs/dbraw/zinc/30/72/80/941307280.db2.gz ZZAFQPJCXNMYPB-INIZCTEOSA-N 0 3 423.479 4.115 20 0 HIADHN COc1cccc2sc(NC(=O)[C@@H]3CN(C(C)(C)C)C[C@H]3C(F)(F)F)nc21 ZINC000550634386 941348583 /nfs/dbraw/zinc/34/85/83/941348583.db2.gz MFVYSHJHDCBRPG-GHMZBOCLSA-N 0 3 401.454 4.152 20 0 HIADHN COc1ccc(C2(C[NH2+][C@H](c3cccs3)c3nnc[n-]3)CCCCC2)cc1OC ZINC000550665912 941351791 /nfs/dbraw/zinc/35/17/91/941351791.db2.gz RGKLDDCOBXCNFU-HXUWFJFHSA-N 0 3 412.559 4.465 20 0 HIADHN Cc1ccc([C@H](NC(=O)CN[C@H]2CCN(C)[C@@H]2c2ccccc2)c2cccs2)cc1 ZINC000550705458 941356723 /nfs/dbraw/zinc/35/67/23/941356723.db2.gz UAFSXUUUAAZEAM-GVXSCFBNSA-N 0 3 419.594 4.297 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)c2nnn(-c3cccc(F)c3)c2C(F)(F)F)c1 ZINC000550755830 941363061 /nfs/dbraw/zinc/36/30/61/941363061.db2.gz HKMWBGDMHBPSNQ-UHFFFAOYSA-N 0 3 421.398 4.048 20 0 HIADHN COc1cc(CNCc2cccc(I)c2)c2ccccc2n1 ZINC000551188870 941425156 /nfs/dbraw/zinc/42/51/56/941425156.db2.gz XCRUMQFWJPSHPC-UHFFFAOYSA-N 0 3 404.251 4.138 20 0 HIADHN CN(C)Cc1ccc(S(=O)(=O)N2CCCC[C@@H]2c2nc(-c3ccccc3)c[nH]2)cc1 ZINC000551204829 941426937 /nfs/dbraw/zinc/42/69/37/941426937.db2.gz CGTLXXWSBXPGSO-JOCHJYFZSA-N 0 3 424.570 4.054 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)[C@H]1CCCc2cccnc21 ZINC000551206719 941427515 /nfs/dbraw/zinc/42/75/15/941427515.db2.gz JRGDMCUJZMBNDR-IBGZPJMESA-N 0 3 405.464 4.111 20 0 HIADHN CCc1nc(C)c(C(=O)NC[C@H]2CCCN(C)[C@@H]2c2ccc(C(F)(F)F)cc2)o1 ZINC000551289673 941444543 /nfs/dbraw/zinc/44/45/43/941444543.db2.gz TZUFQZNEGYNXBW-CRAIPNDOSA-N 0 3 409.452 4.377 20 0 HIADHN Cn1c2ccccc2nc1[C@H]1CCCN1C[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000551396129 941469019 /nfs/dbraw/zinc/46/90/19/941469019.db2.gz PMUMTUNRLGVNNE-ZJSXRUAMSA-N 0 3 404.558 4.001 20 0 HIADHN Cc1nnc(SC[C@H]2CN(Cc3ccccc3)CCCO2)n1Cc1ccccc1 ZINC000551415417 941474192 /nfs/dbraw/zinc/47/41/92/941474192.db2.gz QGBYBPRNXHVCFC-JOCHJYFZSA-N 0 3 408.571 4.018 20 0 HIADHN COC1(c2nc(-c3ccccn3)no2)CCN([C@H]2CCc3ccc(Cl)cc32)CC1 ZINC000551417509 941474978 /nfs/dbraw/zinc/47/49/78/941474978.db2.gz CMLVFLVMFMIVCS-IBGZPJMESA-N 0 3 410.905 4.410 20 0 HIADHN O=C(CN[C@@H](c1cccc(C(F)(F)F)c1)C1CCOCC1)NCc1ccccc1 ZINC000551422272 941475750 /nfs/dbraw/zinc/47/57/50/941475750.db2.gz ZLQHEWCVRPJHQD-OAQYLSRUSA-N 0 3 406.448 4.079 20 0 HIADHN COc1ncc([C@H](C)NC[C@@H](O)COc2cccc(Cl)c2Cl)cc1Cl ZINC000551529889 941495919 /nfs/dbraw/zinc/49/59/19/941495919.db2.gz LFWJWIUDBMAMQN-CMPLNLGQSA-N 0 3 405.709 4.141 20 0 HIADHN Cc1ccc(-n2cc(CN3CCC(CC(N)=O)CC3)c(-c3ccc(F)cc3)n2)cc1 ZINC000551556107 941500575 /nfs/dbraw/zinc/50/05/75/941500575.db2.gz DMCMXSAVCOGENF-UHFFFAOYSA-N 0 3 406.505 4.074 20 0 HIADHN CCS(=O)(=O)c1ccc([C@H](C)N[C@@H](C)CC(=O)Nc2ccc(C)cc2C)cc1 ZINC000551564910 941502604 /nfs/dbraw/zinc/50/26/04/941502604.db2.gz RHUQNZQRFOIXMC-ROUUACIJSA-N 0 3 402.560 4.165 20 0 HIADHN C[C@@H]1CCN(C(=O)Cc2cscc2Br)CCN1Cc1ccccc1 ZINC000551598063 941509790 /nfs/dbraw/zinc/50/97/90/941509790.db2.gz LDGIZQYYHCYARP-OAHLLOKOSA-N 0 3 407.377 4.176 20 0 HIADHN Cc1nn(C)c2nc(-c3cccs3)cc(C(=O)Nc3ccccc3CN(C)C)c12 ZINC000551665160 941521484 /nfs/dbraw/zinc/52/14/84/941521484.db2.gz PUIDVCVPHMLQTC-UHFFFAOYSA-N 0 3 405.527 4.319 20 0 HIADHN Cn1c2ccccc2nc1[C@H]1CCCCN1C[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000551699448 941528610 /nfs/dbraw/zinc/52/86/10/941528610.db2.gz CHYONUTWNVLWSX-RCZVLFRGSA-N 0 3 418.585 4.391 20 0 HIADHN Cn1c2ccccc2nc1[C@@H]1CCCCN1C[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000551699445 941528637 /nfs/dbraw/zinc/52/86/37/941528637.db2.gz CHYONUTWNVLWSX-DHLKQENFSA-N 0 3 418.585 4.391 20 0 HIADHN CC(C)COc1ccccc1CN1CCC(C(=O)Nc2ccc3c(c2)OCO3)CC1 ZINC000551783508 941544369 /nfs/dbraw/zinc/54/43/69/941544369.db2.gz JLPUFAAGCBVUHA-UHFFFAOYSA-N 0 3 410.514 4.301 20 0 HIADHN CCOC(=O)c1oc2c(c1C)[C@@H](N[C@@H](CN(C)C)c1ccc(OC)cc1)CCC2 ZINC000551804433 941548013 /nfs/dbraw/zinc/54/80/13/941548013.db2.gz ZSGIOOBJEINIEB-OALUTQOASA-N 0 3 400.519 4.043 20 0 HIADHN COCC[C@@H](N[C@H](C)c1ccc(S(N)(=O)=O)cc1)c1ccc(Cl)c(Cl)c1 ZINC000551812495 941550398 /nfs/dbraw/zinc/55/03/98/941550398.db2.gz FKYBENMRGPZZFR-KZULUSFZSA-N 0 3 417.358 4.069 20 0 HIADHN C[C@H](NCc1cccc(N2C(=O)N[C@@](C)(C3CC3)C2=O)c1)c1cc2c(s1)CCC2 ZINC000551818524 941552050 /nfs/dbraw/zinc/55/20/50/941552050.db2.gz VNCIMALCTWXZNV-PSLXWICFSA-N 0 3 409.555 4.313 20 0 HIADHN CCOc1cc(C(=O)Nc2ccccc2CN(C)C)ccc1OCc1cccnc1 ZINC000551937701 941562507 /nfs/dbraw/zinc/56/25/07/941562507.db2.gz LLVWJAPYDCHIEY-UHFFFAOYSA-N 0 3 405.498 4.373 20 0 HIADHN O=C(NCc1ncc(-c2ccccc2)o1)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000552005905 941567928 /nfs/dbraw/zinc/56/79/28/941567928.db2.gz NEDGVPVKQASQFV-IBGZPJMESA-N 0 3 411.452 4.115 20 0 HIADHN CNC(=O)COc1cccc(CN[C@H](C)c2csc(-c3csc(C)n3)c2)c1 ZINC000552074401 941580209 /nfs/dbraw/zinc/58/02/09/941580209.db2.gz MSTSZIKUIICCIR-CYBMUJFWSA-N 0 3 401.557 4.156 20 0 HIADHN O=C([C@H]1CN(Cc2ccccc2)CCC1(F)F)N1CCC(OCC2CCCC2)CC1 ZINC000552077087 941580561 /nfs/dbraw/zinc/58/05/61/941580561.db2.gz WAUSYNXXRLHLNU-JOCHJYFZSA-N 0 3 420.544 4.342 20 0 HIADHN CNC(=O)COc1cccc(CN[C@@H]2CCCc3nc(-c4ccccc4)sc32)c1 ZINC000552086438 941582082 /nfs/dbraw/zinc/58/20/82/941582082.db2.gz HDTIJGTXKZSAST-LJQANCHMSA-N 0 3 407.539 4.102 20 0 HIADHN CNC(=O)COc1cccc(CN[C@H](Cc2ccc(F)cc2)c2ccc(OC)cc2)c1 ZINC000552090196 941583092 /nfs/dbraw/zinc/58/30/92/941583092.db2.gz DKPXEHOXYKOEGR-XMMPIXPASA-N 0 3 422.500 4.033 20 0 HIADHN COc1ccc([C@H](Cc2ccc(F)cc2)NCC2(S(C)(=O)=O)CCCC2)cc1 ZINC000552099528 941584881 /nfs/dbraw/zinc/58/48/81/941584881.db2.gz LOWLCPFXDZCSPK-NRFANRHFSA-N 0 3 405.535 4.065 20 0 HIADHN CCCN(C)[C@H](CNC(=O)Cc1c(C)nn(C(C)C)c1C)c1ccc(Cl)cc1 ZINC000552103240 941585687 /nfs/dbraw/zinc/58/56/87/941585687.db2.gz JHFCZSTYHZFUIG-OAQYLSRUSA-N 0 3 404.986 4.476 20 0 HIADHN O=C(c1cc(F)ccc1Br)N1CCN(c2ccnc3ccccc32)CC1 ZINC000552147730 941593956 /nfs/dbraw/zinc/59/39/56/941593956.db2.gz YIKZXZKNIFSDDN-UHFFFAOYSA-N 0 3 414.278 4.099 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)c1cccc(OCc2cccs2)c1 ZINC000552199781 941600205 /nfs/dbraw/zinc/60/02/05/941600205.db2.gz HZTDMCNKFKSLBG-FQEVSTJZSA-N 0 3 408.523 4.146 20 0 HIADHN COc1ccc(Nc2ccccc2C(=O)Nc2cccc(CN3CC[C@H](O)C3)c2)cc1 ZINC000552200696 941601189 /nfs/dbraw/zinc/60/11/89/941601189.db2.gz MNVLAEZEHVZORF-NRFANRHFSA-N 0 3 417.509 4.258 20 0 HIADHN COc1cc2c(cc1F)CC[C@@H]2NC(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000552211008 941603666 /nfs/dbraw/zinc/60/36/66/941603666.db2.gz FOGWIRNWPMHFAK-QUCCMNQESA-N 0 3 418.459 4.095 20 0 HIADHN COc1cc2c(cc1F)CC[C@@H]2NC(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000552211007 941603762 /nfs/dbraw/zinc/60/37/62/941603762.db2.gz FOGWIRNWPMHFAK-ICSRJNTNSA-N 0 3 418.459 4.095 20 0 HIADHN O=C(Nc1c[nH]nc1-c1ccccc1F)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000552216054 941605499 /nfs/dbraw/zinc/60/54/99/941605499.db2.gz VIRCTQDNLUHYGP-KRWDZBQOSA-N 0 3 414.431 4.312 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)C[C@@H](NC(C)=O)c1cccs1)c1ccc(Cl)cc1 ZINC000552241158 941610826 /nfs/dbraw/zinc/61/08/26/941610826.db2.gz CJJZFAGUFQRPQK-MOPGFXCFSA-N 0 3 421.994 4.168 20 0 HIADHN CO[C@@H]1C[C@H](c2ccccc2)CC[C@H]1NCC(=O)Nc1ccc(OC(F)F)cc1 ZINC000552268236 941618199 /nfs/dbraw/zinc/61/81/99/941618199.db2.gz BJLVYVMTGSXGEB-NSISKUIASA-N 0 3 404.457 4.167 20 0 HIADHN CO[C@@H]1C[C@H](c2ccccc2)CC[C@H]1N[C@@H](C)C(=O)Nc1ccc2c(c1)OCCCO2 ZINC000552270794 941619207 /nfs/dbraw/zinc/61/92/07/941619207.db2.gz CJXGEJGQWRKENJ-ICGULJKJSA-N 0 3 424.541 4.116 20 0 HIADHN COc1ccc([C@@H](Cc2ccncc2)N[C@H]2CCN(C(C)=O)c3ccccc32)cc1 ZINC000552277001 941621029 /nfs/dbraw/zinc/62/10/29/941621029.db2.gz ODWRRGJOQKCELA-BJKOFHAPSA-N 0 3 401.510 4.462 20 0 HIADHN COc1cc(OC)c([C@H](C)NC[C@H]2CC[C@@H](c3nc(C4CC4)no3)O2)cc1Cl ZINC000552297973 941625871 /nfs/dbraw/zinc/62/58/71/941625871.db2.gz NIUOZOVXZOMOBO-GHJWDPDVSA-N 0 3 407.898 4.189 20 0 HIADHN COC[C@H](NC[C@H]1CC[C@@H](c2nc(C3CC3)no2)O1)c1cccc(C(F)(F)F)c1 ZINC000552324021 941632252 /nfs/dbraw/zinc/63/22/52/941632252.db2.gz YIHZKFGBQJZYSW-IKGGRYGDSA-N 0 3 411.424 4.163 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(S(=O)(=O)N2CCCCC2)cc1)c1ccc2n[nH]cc2c1 ZINC000552335098 941635199 /nfs/dbraw/zinc/63/51/99/941635199.db2.gz ISCAYPYQVUQIPU-DLBZAZTESA-N 0 3 412.559 4.149 20 0 HIADHN COc1ccc(CCN(Cc2ccsc2)Cc2ccc3c(c2)nnn3C)cc1OC ZINC000552343531 941638657 /nfs/dbraw/zinc/63/86/57/941638657.db2.gz FJDXCAFARXQGTI-UHFFFAOYSA-N 0 3 422.554 4.292 20 0 HIADHN Cc1nn(C(C)(C)C)cc1[C@H](C)NC(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000552434133 941670187 /nfs/dbraw/zinc/67/01/87/941670187.db2.gz QLCTZRYIUNUUDV-OXJNMPFZSA-N 0 3 418.532 4.281 20 0 HIADHN C[C@@H](Cc1cccc(C(F)(F)F)c1)C(=O)Nc1cccc(CN2CC[C@@H](O)C2)c1 ZINC000552516471 941693269 /nfs/dbraw/zinc/69/32/69/941693269.db2.gz UKPTXJCUJLIGHF-MGPUTAFESA-N 0 3 406.448 4.089 20 0 HIADHN O[C@H](CN[C@@H]1CCSc2c(F)cccc21)COc1cccc(Br)c1 ZINC000552679914 941735789 /nfs/dbraw/zinc/73/57/89/941735789.db2.gz WTISINRMWRYJBE-CXAGYDPISA-N 0 3 412.324 4.155 20 0 HIADHN O=C(CCc1nccs1)N(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000552851051 941787484 /nfs/dbraw/zinc/78/74/84/941787484.db2.gz IKIRSPIRWSSCJV-QFIPXVFZSA-N 0 3 420.582 4.164 20 0 HIADHN O[C@@H](CNCc1cc2ccccc2o1)COc1ccc(Cl)cc1Br ZINC000552853164 941789238 /nfs/dbraw/zinc/78/92/38/941789238.db2.gz ODXQFCZRBRCULA-AWEZNQCLSA-N 0 3 410.695 4.378 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)N1[C@H](C)CCC[C@H]1C)c1ccc(NC(=O)c2ccncc2)cc1 ZINC000553002803 941814469 /nfs/dbraw/zinc/81/44/69/941814469.db2.gz KDTCOLGURVYNOU-MKXGPGLRSA-N 0 3 408.546 4.163 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)Nc1ccc(N2CCCC2=O)cc1)c1cccc(N2CCCC2)c1 ZINC000553076113 941828901 /nfs/dbraw/zinc/82/89/01/941828901.db2.gz DWODYYKXAYXSRH-MOPGFXCFSA-N 0 3 420.557 4.091 20 0 HIADHN Cc1cc(NC(=O)c2cccc(F)c2)sc1C(=O)N1C[C@H](N2CCCC2)C[C@H]1C ZINC000553102412 941833049 /nfs/dbraw/zinc/83/30/49/941833049.db2.gz PAQWRSUWBJMRGY-CRAIPNDOSA-N 0 3 415.534 4.147 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)C[C@@H](c1ncc[nH]1)c1ccccc1 ZINC000553143238 941839886 /nfs/dbraw/zinc/83/98/86/941839886.db2.gz DFLLRTJGWWBSOH-NFBKMPQASA-N 0 3 402.542 4.055 20 0 HIADHN C[C@H](C(=O)N(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1)C(C)(F)F ZINC000553196099 941847282 /nfs/dbraw/zinc/84/72/82/941847282.db2.gz CTAWYTMNHGWZSR-NQIIRXRSSA-N 0 3 401.501 4.366 20 0 HIADHN COc1ccccc1O[C@@H]1CCCN(C(=O)c2oc3ccccc3c2CN(C)C)C1 ZINC000553223207 941852379 /nfs/dbraw/zinc/85/23/79/941852379.db2.gz WSNVVJLKQJKROU-QGZVFWFLSA-N 0 3 408.498 4.187 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)CCSc3cccc(Cl)c3)CC2)C[C@H](C)O1 ZINC000553409520 941880419 /nfs/dbraw/zinc/88/04/19/941880419.db2.gz CAOOINHXFQWDMB-CALCHBBNSA-N 0 3 411.011 4.170 20 0 HIADHN CC(C)(C)N1C[C@@H](C(=O)Nc2nnc(-c3ccsc3)s2)[C@H](C(F)(F)F)C1 ZINC000553429152 941883197 /nfs/dbraw/zinc/88/31/97/941883197.db2.gz REWQEPMZRNPVPR-GHMZBOCLSA-N 0 3 404.483 4.114 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)c1nc(C)n(-c2c(Cl)cccc2Cl)n1 ZINC000553493193 941895802 /nfs/dbraw/zinc/89/58/02/941895802.db2.gz VSCDVGPLYSDTFE-UHFFFAOYSA-N 0 3 424.376 4.221 20 0 HIADHN C[C@H](CC(=O)N1CCC[C@H](c2n[nH]cc2CN2CCCC2)C1)Cc1cccc(F)c1 ZINC000553513922 941899977 /nfs/dbraw/zinc/89/99/77/941899977.db2.gz ZHXLFHBJXOYPBL-ICSRJNTNSA-N 0 3 412.553 4.120 20 0 HIADHN CCCN(C)[C@H](CNC(=O)N[C@H](C)Cc1c(C)noc1C)c1ccc(Cl)cc1 ZINC000553582455 941913987 /nfs/dbraw/zinc/91/39/87/941913987.db2.gz VQYPOBHYZJISEO-JLTOFOAXSA-N 0 3 406.958 4.258 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)N[C@@H](C)Cc1c(C)noc1C)c1ccc(Cl)cc1 ZINC000553582458 941914100 /nfs/dbraw/zinc/91/41/00/941914100.db2.gz VQYPOBHYZJISEO-XOBRGWDASA-N 0 3 406.958 4.258 20 0 HIADHN COCc1cccc(OCC2(CN3CCC([C@@H](O)C(F)(F)F)CC3)CCC2)c1 ZINC000553616018 941921957 /nfs/dbraw/zinc/92/19/57/941921957.db2.gz VUDHLUCASAASQO-LJQANCHMSA-N 0 3 401.469 4.017 20 0 HIADHN O=C1[C@@H](N2CCC(C3CCOCC3)CC2)CCCN1Cc1cccc(C(F)(F)F)c1 ZINC000553708560 941948330 /nfs/dbraw/zinc/94/83/30/941948330.db2.gz KNJVIROWUGUFMT-NRFANRHFSA-N 0 3 424.507 4.335 20 0 HIADHN CC(C)(NC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1)c1cc(C(F)(F)F)on1 ZINC000553755781 941960432 /nfs/dbraw/zinc/96/04/32/941960432.db2.gz TUXWNFXDRYAKHZ-AWEZNQCLSA-N 0 3 413.415 4.096 20 0 HIADHN CC(C)Oc1cc(Br)cc(C(=O)N2CCN([C@H]3C[C@@H]3C)C[C@H](C)C2)c1 ZINC000553781625 941967176 /nfs/dbraw/zinc/96/71/76/941967176.db2.gz CZDCBJPAGHUQJR-DOXZYTNZSA-N 0 3 409.368 4.039 20 0 HIADHN Cc1cccc(-n2ncc(C(=O)N3CCN([C@@H]4C[C@H]4C)C[C@@H](C)C3)c2C(F)(F)F)c1 ZINC000553783446 941967493 /nfs/dbraw/zinc/96/74/93/941967493.db2.gz VNBSEXNIKCWHDI-GPMSIDNRSA-N 0 3 420.479 4.002 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)c2cc(F)ccc2Br)N(C)C)cc1 ZINC000554015618 942019878 /nfs/dbraw/zinc/01/98/78/942019878.db2.gz SKFWTNVIHPGUPE-IBGZPJMESA-N 0 3 423.326 4.408 20 0 HIADHN C[C@H](NC(=O)Nc1ccccc1C(=O)N1CCCCC1)[C@@H](c1ccccc1)N(C)C ZINC000554111760 942038733 /nfs/dbraw/zinc/03/87/33/942038733.db2.gz BKVOSMVERCKRAI-AVRDEDQJSA-N 0 3 408.546 4.126 20 0 HIADHN CCCOc1ccc(-c2nc(C(=O)N3CCN([C@@H]4C[C@H]4C)C[C@@H](C)C3)cs2)cc1 ZINC000554128227 942043577 /nfs/dbraw/zinc/04/35/77/942043577.db2.gz FRSMEMJDLLYLDR-CBGDNZLLSA-N 0 3 413.587 4.401 20 0 HIADHN Cc1nn(Cc2ccccc2Cl)c(C)c1C(=O)N1CCN([C@@H]2C[C@H]2C)C[C@H](C)C1 ZINC000554132470 942045147 /nfs/dbraw/zinc/04/51/47/942045147.db2.gz UTSSONJZVAQMBB-GCKMJXCFSA-N 0 3 414.981 4.004 20 0 HIADHN CCOc1ccc(Nc2ncccc2C(=O)N2CCN([C@@H]3C[C@H]3C)C[C@H](C)C2)cc1 ZINC000554132510 942045402 /nfs/dbraw/zinc/04/54/02/942045402.db2.gz VCHYUDKKYOHMJC-NJNPRVFISA-N 0 3 408.546 4.026 20 0 HIADHN Cn1ncc(NC(=O)[C@@H]2CN(Cc3ccccc3)CCC2(F)F)c1-c1ccccc1 ZINC000554172437 942056371 /nfs/dbraw/zinc/05/63/71/942056371.db2.gz YSRMXHXLDRCONK-IBGZPJMESA-N 0 3 410.468 4.183 20 0 HIADHN C[C@H]1Oc2cc(F)ccc2[C@@H]1NC(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000554183502 942060977 /nfs/dbraw/zinc/06/09/77/942060977.db2.gz YBZBLUYUSMHUFD-QVKFZJNVSA-N 0 3 415.534 4.061 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)N1CCC([C@H]2CCCO2)CC1)c1ccc(Cl)cc1 ZINC000554248976 942078402 /nfs/dbraw/zinc/07/84/02/942078402.db2.gz AORSBMXBIKZFGT-LEWJYISDSA-N 0 3 407.986 4.324 20 0 HIADHN CCOc1ccc([C@H](C)NC(=O)N[C@@H](CN(C)C)c2ccc(F)cc2)cc1OCC ZINC000554254016 942080278 /nfs/dbraw/zinc/08/02/78/942080278.db2.gz WIUPYDHUIVCSPG-JXFKEZNVSA-N 0 3 417.525 4.286 20 0 HIADHN CC(=O)N1CCc2cc(NC(=O)NC[C@@H](c3ccc(CC(C)C)cc3)N(C)C)ccc21 ZINC000554367287 942116181 /nfs/dbraw/zinc/11/61/81/942116181.db2.gz UTHXEXLVNPGARN-DEOSSOPVSA-N 0 3 422.573 4.219 20 0 HIADHN CCOc1ccc(NC(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)cc1OC ZINC000554383255 942121055 /nfs/dbraw/zinc/12/10/55/942121055.db2.gz POGMGOPLFCNMOM-HXUWFJFHSA-N 0 3 415.534 4.306 20 0 HIADHN CN(C)C[C@@H](NC(=O)Nc1cccc(OCc2cccnc2)c1)c1ccc(F)cc1 ZINC000554398787 942125964 /nfs/dbraw/zinc/12/59/64/942125964.db2.gz BEKQTRBVPZAWHH-JOCHJYFZSA-N 0 3 408.477 4.224 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)Nc2ccc(NC(=O)C3CC3)cc2)N(C)C)cc1 ZINC000554399544 942126673 /nfs/dbraw/zinc/12/66/73/942126673.db2.gz WAXSWCFUWBFDAQ-JOCHJYFZSA-N 0 3 424.545 4.247 20 0 HIADHN Cc1nc(-c2ccc(CNC(=O)N[C@@H](CN(C)C)c3ccc(F)cc3)cc2)cs1 ZINC000554439776 942143640 /nfs/dbraw/zinc/14/36/40/942143640.db2.gz FWUWTGHKYUXXBL-FQEVSTJZSA-N 0 3 412.534 4.360 20 0 HIADHN C[C@@H](NC(=O)Nc1ccc(OCc2ccncc2)cc1)[C@@H](c1ccccc1)N(C)C ZINC000554440704 942143656 /nfs/dbraw/zinc/14/36/56/942143656.db2.gz CGEFPHMGYYCDLN-JPYJTQIMSA-N 0 3 404.514 4.474 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N2C[C@H](c3ccccc3)[C@H]3COCC[C@H]32)N(C)C)cc1 ZINC000554451523 942148266 /nfs/dbraw/zinc/14/82/66/942148266.db2.gz ZTAANGHWDCDAEC-VPBXCIAMSA-N 0 3 421.585 4.066 20 0 HIADHN Cc1cc(NC(=O)N[C@H](CN(C)C)c2ccc(F)cc2)ccc1OC1CCOCC1 ZINC000554466703 942152774 /nfs/dbraw/zinc/15/27/74/942152774.db2.gz KFQAPBXYNWSZFL-OAQYLSRUSA-N 0 3 415.509 4.116 20 0 HIADHN CC(=O)N(Cc1ccc(NC(=O)N[C@H](CN(C)C)c2ccc(F)cc2)cc1)C(C)C ZINC000554474516 942155559 /nfs/dbraw/zinc/15/55/59/942155559.db2.gz DLDBFODXLKQNFM-JOCHJYFZSA-N 0 3 414.525 4.007 20 0 HIADHN O=C(Nc1ccc([C@@H]2CCOC2)cc1)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000554620424 942177877 /nfs/dbraw/zinc/17/78/77/942177877.db2.gz YPZJKLXOPTUZMP-CTNGQTDRSA-N 0 3 400.469 4.286 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)c1nn(-c2ccccc2C)c2c1CCC2)c1ccco1 ZINC000554632021 942180671 /nfs/dbraw/zinc/18/06/71/942180671.db2.gz JNGNLOONEZHMDI-MJGOQNOKSA-N 0 3 406.530 4.122 20 0 HIADHN Cn1ncc2ccc(-c3noc([C@H]4CN(Cc5ccccc5)CCC4(F)F)n3)cc21 ZINC000554807539 942251129 /nfs/dbraw/zinc/25/11/29/942251129.db2.gz DCBYQIORNFTAEL-GOSISDBHSA-N 0 3 409.440 4.248 20 0 HIADHN COc1ccc([C@H](CNC(=O)NC(C)(C)c2nc(C)c(C)s2)N2CCCC2)cc1 ZINC000554827948 942267327 /nfs/dbraw/zinc/26/73/27/942267327.db2.gz NJCYSYBVRVAKJH-IBGZPJMESA-N 0 3 416.591 4.140 20 0 HIADHN FC(F)(F)c1cc(-c2noc(-c3ccc(CN4CCSCC4)cc3)n2)ccn1 ZINC000554845937 942283274 /nfs/dbraw/zinc/28/32/74/942283274.db2.gz UBKPPIMINMXRHE-UHFFFAOYSA-N 0 3 406.433 4.366 20 0 HIADHN CC(C)C(=O)Nc1cccc(NC(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)c1 ZINC000554862800 942296378 /nfs/dbraw/zinc/29/63/78/942296378.db2.gz ADRLURWDWLNHRB-IBGZPJMESA-N 0 3 402.926 4.359 20 0 HIADHN CN(C)C[C@H](NC(=O)Nc1ccc2c(c1)CCCC(=O)N2)c1ccc(Cl)cc1 ZINC000554905309 942313783 /nfs/dbraw/zinc/31/37/83/942313783.db2.gz PDLMGJOPTZYHDL-IBGZPJMESA-N 0 3 400.910 4.039 20 0 HIADHN CC(=O)N1CCCc2cc(NC(=O)N[C@H](CN(C)C)c3ccc(Cl)cc3)ccc21 ZINC000554907944 942314789 /nfs/dbraw/zinc/31/47/89/942314789.db2.gz FDYZYFXOPICTNA-HXUWFJFHSA-N 0 3 414.937 4.064 20 0 HIADHN Cc1ccc(CNCc2ccc(C)cc2-c2ccnn2C)c(OC[C@@H]2CCOC2)c1 ZINC000554922285 942320506 /nfs/dbraw/zinc/32/05/06/942320506.db2.gz CLFCZCIARCQQKG-HXUWFJFHSA-N 0 3 405.542 4.409 20 0 HIADHN Cc1ccc(CNCc2cc(Br)cc3c2OCC3)c(-c2ccnn2C)c1 ZINC000554923310 942321071 /nfs/dbraw/zinc/32/10/71/942321071.db2.gz UWUQBCBZYMSYQF-UHFFFAOYSA-N 0 3 412.331 4.383 20 0 HIADHN CSc1cccc(NC(=O)[C@H](C)N[C@@H]2CCN(C)[C@H]2c2ccc(Cl)cc2)c1 ZINC000554950388 942330820 /nfs/dbraw/zinc/33/08/20/942330820.db2.gz YOAFWIFDLFFVRH-KPOBHBOGSA-N 0 3 403.979 4.424 20 0 HIADHN Cc1nc(C(F)(F)F)ccc1NC(=O)N[C@@H](CN(C)C)c1ccc(Cl)cc1 ZINC000555027216 942361960 /nfs/dbraw/zinc/36/19/60/942361960.db2.gz UIJHYWZPCXXUCE-HNNXBMFYSA-N 0 3 400.832 4.487 20 0 HIADHN CCn1c(-c2sccc2C)nnc1N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000555076350 942378717 /nfs/dbraw/zinc/37/87/17/942378717.db2.gz IWYNTUMTZGAFIU-QZTJIDSGSA-N 0 3 417.623 4.051 20 0 HIADHN CC(C)N1CC[C@H](NCc2cnn(C)c2C(F)(F)F)[C@@H]1c1ccc(F)c(F)c1 ZINC000555128342 942395086 /nfs/dbraw/zinc/39/50/86/942395086.db2.gz GIVOYLVKGDPFOK-IRXDYDNUSA-N 0 3 402.411 4.031 20 0 HIADHN CCN1CC[C@@H](NCC(=O)Nc2ccc(C(C)=O)cc2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000555131655 942396370 /nfs/dbraw/zinc/39/63/70/942396370.db2.gz OSNLLCOBFSMTEH-IRLDBZIGSA-N 0 3 417.912 4.045 20 0 HIADHN CCN1CC[C@H](NCC(=O)Nc2cc(C)ccc2C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000555132451 942396437 /nfs/dbraw/zinc/39/64/37/942396437.db2.gz ISPKUBRYHFPAJD-UGKGYDQZSA-N 0 3 403.929 4.460 20 0 HIADHN CC(C)N1CC[C@@H](NCC(=O)Nc2ccccc2Cl)[C@H]1c1ccc(F)c(F)c1 ZINC000555133851 942398137 /nfs/dbraw/zinc/39/81/37/942398137.db2.gz XKRHNNQTDFABGS-TZIWHRDSSA-N 0 3 407.892 4.370 20 0 HIADHN CC(C)N1CC[C@H](NCC(=O)Nc2ccccc2Cl)[C@@H]1c1ccc(F)c(F)c1 ZINC000555133849 942398289 /nfs/dbraw/zinc/39/82/89/942398289.db2.gz XKRHNNQTDFABGS-FPOVZHCZSA-N 0 3 407.892 4.370 20 0 HIADHN Cc1ccc(CCC(=O)N(Cc2ccccc2Br)C2CCN(C)CC2)o1 ZINC000555163201 942411495 /nfs/dbraw/zinc/41/14/95/942411495.db2.gz ZOUNKXSXTKGXSS-UHFFFAOYSA-N 0 3 419.363 4.406 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@H](N[C@H](CN2CCCC2=O)c2ccccc2)c2ccccc21 ZINC000555170241 942414347 /nfs/dbraw/zinc/41/43/47/942414347.db2.gz SOTORMKPMJRZIA-XPWALMASSA-N 0 3 406.526 4.122 20 0 HIADHN CC[C@@H](N[C@H](CN(C)C)c1ccc(Cl)cc1)c1ccccc1OCC(=O)N(C)C ZINC000555226494 942436901 /nfs/dbraw/zinc/43/69/01/942436901.db2.gz SKJBHPBNECRSGV-NHCUHLMSSA-N 0 3 417.981 4.151 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@@H](N[C@H](CC)CS(=O)(=O)c2ccccc2)c2ccccc21 ZINC000555233672 942439737 /nfs/dbraw/zinc/43/97/37/942439737.db2.gz YWAHPWLHSUWOEW-ZPMCFJSWSA-N 0 3 415.555 4.010 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@H](N[C@H](CC)CS(=O)(=O)c2ccccc2)c2ccccc21 ZINC000555233671 942439860 /nfs/dbraw/zinc/43/98/60/942439860.db2.gz YWAHPWLHSUWOEW-YHYVQYDKSA-N 0 3 415.555 4.010 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)C1CCC(OC[C@@H]2CCCO2)CC1)c1ccsc1 ZINC000555297969 942465978 /nfs/dbraw/zinc/46/59/78/942465978.db2.gz CBBWHZQSMUWHRA-BOWFFMLLSA-N 0 3 408.608 4.002 20 0 HIADHN C[C@H](c1ccc(F)cc1)N1CC[C@H](N[C@@H]2CCN(C)[C@@H]2c2ccc(Cl)cc2)C1=O ZINC000555527838 942629499 /nfs/dbraw/zinc/62/94/99/942629499.db2.gz TVFJJBOFUACHAD-ZHHJKBAOSA-N 0 3 415.940 4.176 20 0 HIADHN Cc1cc(CO)oc1C(=O)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000555548824 942638171 /nfs/dbraw/zinc/63/81/71/942638171.db2.gz JIDDAVIMNXWLBB-UHFFFAOYSA-N 0 3 411.329 4.125 20 0 HIADHN C[C@@H](c1ccccc1F)N1CCC[C@H](NCc2ccc(Oc3cnccn3)cc2)C1=O ZINC000555607166 942668141 /nfs/dbraw/zinc/66/81/41/942668141.db2.gz WTRSPRYFRHBOOY-JTSKRJEESA-N 0 3 420.488 4.250 20 0 HIADHN O=c1[nH]c(CNC2(Cc3cccc(F)c3)CCOCC2)nc2cc(Cl)ccc12 ZINC000555618418 942672157 /nfs/dbraw/zinc/67/21/57/942672157.db2.gz NVJCYYGFGLXXDC-UHFFFAOYSA-N 0 3 401.869 4.009 20 0 HIADHN COc1cccc(OC)c1OC[C@H](O)CN1CCc2ccccc2[C@@H]1c1ccccc1 ZINC000555659509 942693001 /nfs/dbraw/zinc/69/30/01/942693001.db2.gz SAELONCMRSEHPN-BWKNWUBXSA-N 0 3 419.521 4.091 20 0 HIADHN O=C(Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)[C@H]1CCC(=O)c2ccccc21 ZINC000555885716 942766646 /nfs/dbraw/zinc/76/66/46/942766646.db2.gz KHYIINYRGPRVBL-UGKGYDQZSA-N 0 3 414.509 4.029 20 0 HIADHN O=C(Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1)[C@H]1CCC(=O)c2ccccc21 ZINC000555885712 942766724 /nfs/dbraw/zinc/76/67/24/942766724.db2.gz KHYIINYRGPRVBL-KNQAVFIVSA-N 0 3 414.509 4.029 20 0 HIADHN COc1cnccc1[C@H](C)NC[C@@H](O)CO[C@@H](c1ccccc1)c1ccccc1C ZINC000556018117 942786333 /nfs/dbraw/zinc/78/63/33/942786333.db2.gz GSQWMCLPIWCQPW-HWHXTQLESA-N 0 3 406.526 4.216 20 0 HIADHN FC(F)(F)c1cnc(N2CC[C@H](NCc3ccnn3-c3ccccc3)C2)c(Cl)c1 ZINC000556092886 942803946 /nfs/dbraw/zinc/80/39/46/942803946.db2.gz XTVUWYLXLNFKHL-HNNXBMFYSA-N 0 3 421.854 4.308 20 0 HIADHN NS(=O)(=O)c1ccc2c(c1)CCC[C@H]2NCc1ccc(COc2ccccc2)cc1 ZINC000556103620 942805689 /nfs/dbraw/zinc/80/56/89/942805689.db2.gz FWRUHDRPWDFMNH-XMMPIXPASA-N 0 3 422.550 4.080 20 0 HIADHN CN1CC[C@H](CN[C@@H](c2cccs2)c2nc[nH]n2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000556118948 942807708 /nfs/dbraw/zinc/80/77/08/942807708.db2.gz NRDMIHCFUCFRAJ-JEBQAFNWSA-N 0 3 405.930 4.031 20 0 HIADHN COc1ccc([C@@H](CNC(=O)Nc2ccc3nc(OC)ccc3c2)N2CCCC2)cc1 ZINC000556136530 942809739 /nfs/dbraw/zinc/80/97/39/942809739.db2.gz LHOUHCPPVPNLRV-JOCHJYFZSA-N 0 3 420.513 4.211 20 0 HIADHN Cc1cccc(C)c1OC[C@H](N[C@@H]1CCC[C@@H](S(C)(=O)=O)C1)c1ccccc1 ZINC000556263046 942827966 /nfs/dbraw/zinc/82/79/66/942827966.db2.gz XAUAYFMMBZVNCN-VSKRKVRLSA-N 0 3 401.572 4.369 20 0 HIADHN CCCn1c(=O)c2ccccc2nc1SC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000556295146 942835471 /nfs/dbraw/zinc/83/54/71/942835471.db2.gz FJCOHEOALIHIHN-FQEVSTJZSA-N 0 3 423.582 4.190 20 0 HIADHN CN(C)Cc1ccc(S(=O)(=O)N[C@@H](c2ccc(F)c(Cl)c2)C(F)(F)F)cc1 ZINC000556305997 942837005 /nfs/dbraw/zinc/83/70/05/942837005.db2.gz XSMMRCHCPWOYEG-INIZCTEOSA-N 0 3 424.847 4.123 20 0 HIADHN C[C@@H](c1ccccc1)n1cnnc1SC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000556324701 942841359 /nfs/dbraw/zinc/84/13/59/942841359.db2.gz QELQAPNOPRESLF-SIKLNZKXSA-N 0 3 408.571 4.271 20 0 HIADHN CN(C(=O)c1ccc(NCc2ccc(OCC3CC3)cc2)cc1)[C@@H]1CCCN(C)C1 ZINC000556337504 942844562 /nfs/dbraw/zinc/84/45/62/942844562.db2.gz RYCRRDAHDAGQAK-HSZRJFAPSA-N 0 3 407.558 4.254 20 0 HIADHN Cc1cccc(CNc2ccc(C(=O)N(C)[C@H]3CCCN(C)C3)cc2)c1OC(F)F ZINC000556338848 942845209 /nfs/dbraw/zinc/84/52/09/942845209.db2.gz OPXBWRMUVJLZEP-FQEVSTJZSA-N 0 3 417.500 4.375 20 0 HIADHN CC(C)[C@H](NCc1ccc(S(=O)(=O)CCO)cc1)c1ccc(C(C)(C)C)cc1 ZINC000556579349 942904683 /nfs/dbraw/zinc/90/46/83/942904683.db2.gz XABPMQPDBLJEJH-QFIPXVFZSA-N 0 3 403.588 4.237 20 0 HIADHN O[C@@H](CN[C@@H]1CCOc2c(Cl)cccc21)COc1ccc(Cl)cc1Cl ZINC000556859911 942942184 /nfs/dbraw/zinc/94/21/84/942942184.db2.gz QVOFZTVKFPCLDE-BLLLJJGKSA-N 0 3 402.705 4.500 20 0 HIADHN CC[C@@H](N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)c1ccc(OC(F)(F)F)cc1 ZINC000556868664 942944790 /nfs/dbraw/zinc/94/47/90/942944790.db2.gz VXUCGBQPQHWAOQ-QUCCMNQESA-N 0 3 419.447 4.465 20 0 HIADHN CC[C@@H](NCc1cccc(CS(C)(=O)=O)c1)c1ccc(OC(F)(F)F)cc1 ZINC000556871667 942945470 /nfs/dbraw/zinc/94/54/70/942945470.db2.gz LEVNOKOXHRBSCU-GOSISDBHSA-N 0 3 401.450 4.371 20 0 HIADHN OC[C@@H](CN[C@H](c1ncc[nH]1)C1CCCCC1)Cc1cccc(Br)c1 ZINC000556879302 942948932 /nfs/dbraw/zinc/94/89/32/942948932.db2.gz RQTBTJORULYKKA-APWZRJJASA-N 0 3 406.368 4.234 20 0 HIADHN O=C(NCc1ncoc1-c1ccccc1)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000556925427 942968887 /nfs/dbraw/zinc/96/88/87/942968887.db2.gz XKOMJXOCJZFPPR-LJQANCHMSA-N 0 3 411.452 4.115 20 0 HIADHN C[C@H](Oc1cccc(Cl)c1Cl)C(=O)N(C)CCCN(C)Cc1ccncc1 ZINC000556934852 942972586 /nfs/dbraw/zinc/97/25/86/942972586.db2.gz YZUZPPSIEAQNOC-HNNXBMFYSA-N 0 3 410.345 4.136 20 0 HIADHN CCCOc1ccc(C(=O)Nc2cccc(CN3CC[C@H](O)C3)c2)cc1OCCC ZINC000557023106 942996418 /nfs/dbraw/zinc/99/64/18/942996418.db2.gz GINGLTZEEYXTHB-NRFANRHFSA-N 0 3 412.530 4.083 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)c1cc2cnn(CC)c2nc1C)c1ccc(Cl)cc1 ZINC000557059696 943007564 /nfs/dbraw/zinc/00/75/64/943007564.db2.gz BNVWXCMQHJPDGT-FQEVSTJZSA-N 0 3 413.953 4.226 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)c1cc2c([nH]c1=O)CCCC2)c1ccc(Cl)cc1 ZINC000557336309 943076027 /nfs/dbraw/zinc/07/60/27/943076027.db2.gz BDNRVPQYNSIVPO-FQEVSTJZSA-N 0 3 401.938 4.132 20 0 HIADHN COc1cccc(C(=O)CCCC(=O)N2CC[C@]3(CCN(Cc4ccccc4)C3)C2)c1 ZINC000557395000 943099721 /nfs/dbraw/zinc/09/97/21/943099721.db2.gz IPPUTZAKLQCBRY-SANMLTNESA-N 0 3 420.553 4.173 20 0 HIADHN COc1ccc(CCCCC(=O)N2CCC[C@@H](c3n[nH]cc3CN3CCCC3)C2)cc1 ZINC000557647040 943246786 /nfs/dbraw/zinc/24/67/86/943246786.db2.gz NAFJDZZRTZNJJH-OAQYLSRUSA-N 0 3 424.589 4.133 20 0 HIADHN C[C@@H]1C[C@@H]1[C@@H](NCC(=O)Nc1cccc(C(=O)NC2CC2)c1)c1ccc(Cl)cc1 ZINC000557710282 943264643 /nfs/dbraw/zinc/26/46/43/943264643.db2.gz UIKKZEWEZMGHID-XDCJIHQESA-N 0 3 411.933 4.158 20 0 HIADHN C[C@@H]1C[C@H]1[C@H](NCC(=O)Nc1cccc(C(=O)NC2CC2)c1)c1ccc(Cl)cc1 ZINC000557710271 943264737 /nfs/dbraw/zinc/26/47/37/943264737.db2.gz UIKKZEWEZMGHID-JEWAVWJGSA-N 0 3 411.933 4.158 20 0 HIADHN COC(=O)[C@H](C)Oc1ccc(CNC2(c3ccc(Cl)cc3)CCOCC2)cc1 ZINC000557800542 943295681 /nfs/dbraw/zinc/29/56/81/943295681.db2.gz RBSZSFOTSMXODP-INIZCTEOSA-N 0 3 403.906 4.076 20 0 HIADHN CC[C@H](NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1)c1ccc(OC)c(OC)c1 ZINC000557800960 943295769 /nfs/dbraw/zinc/29/57/69/943295769.db2.gz CTTDHFDPUFFBME-SFTDATJTSA-N 0 3 411.546 4.119 20 0 HIADHN Cc1ccc(NC(=O)C2CC2)cc1NC(=O)N[C@@H]1CCN(Cc2ccccc2)[C@H]1C ZINC000557885825 943320571 /nfs/dbraw/zinc/32/05/71/943320571.db2.gz VQLSARQVHZIUMS-LAUBAEHRSA-N 0 3 406.530 4.128 20 0 HIADHN Cc1nc2c(cnn2C(C)C)cc1C(=O)NC[C@H](c1ccc(OC(C)C)cc1)N(C)C ZINC000557933411 943332427 /nfs/dbraw/zinc/33/24/27/943332427.db2.gz YXHFRWQUUUWHIZ-JOCHJYFZSA-N 0 3 423.561 4.141 20 0 HIADHN COc1cc(C(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)ccc1OC(C)C ZINC000557956341 943339734 /nfs/dbraw/zinc/33/97/34/943339734.db2.gz FMASOBFAPRTJQN-NRFANRHFSA-N 0 3 414.546 4.302 20 0 HIADHN CC(C)Cc1ccc([C@@H](CNC(=O)c2csc([C@H]3CCCO3)n2)N(C)C)cc1 ZINC000557983080 943346545 /nfs/dbraw/zinc/34/65/45/943346545.db2.gz RPZDDFSMEDEPJO-WOJBJXKFSA-N 0 3 401.576 4.226 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)N1CC[C@@H](C2CCOCC2)C1)c1ccc(Cl)cc1 ZINC000558104676 943380431 /nfs/dbraw/zinc/38/04/31/943380431.db2.gz AEOJSWVRNRTJGF-CTNGQTDRSA-N 0 3 407.986 4.181 20 0 HIADHN COc1ccc(-c2ocnc2C(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)cc1 ZINC000558147526 943396432 /nfs/dbraw/zinc/39/64/32/943396432.db2.gz QGPAXNXUVCDEOI-HXUWFJFHSA-N 0 3 405.498 4.087 20 0 HIADHN COc1cc([C@H](C)NC2CCN(Cc3ccc(Br)cc3)CC2)c(F)cn1 ZINC000558223243 943442755 /nfs/dbraw/zinc/44/27/55/943442755.db2.gz YLISGNCIVLRMGY-AWEZNQCLSA-N 0 3 422.342 4.307 20 0 HIADHN COCC(C)(C)CCCN[C@H](c1ccc(F)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000558259126 943463817 /nfs/dbraw/zinc/46/38/17/943463817.db2.gz PNVCWGQXNJDGOH-OAQYLSRUSA-N 0 3 407.551 4.361 20 0 HIADHN COCC(C)(C)CCCN[C@@H](c1ccc(F)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000558259119 943463949 /nfs/dbraw/zinc/46/39/49/943463949.db2.gz PNVCWGQXNJDGOH-NRFANRHFSA-N 0 3 407.551 4.361 20 0 HIADHN C[C@@H](N[C@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O)c1cccc(-n2ccnn2)c1 ZINC000558260072 943464774 /nfs/dbraw/zinc/46/47/74/943464774.db2.gz XEMOOASYUANYKI-YJYMSZOUSA-N 0 3 416.312 4.030 20 0 HIADHN COCc1c(Br)cccc1NC(=O)N[C@@H](CN(C)C)c1ccc(F)cc1 ZINC000558315395 943501638 /nfs/dbraw/zinc/50/16/38/943501638.db2.gz HSAPYEWKMNNKIA-SFHVURJKSA-N 0 3 424.314 4.159 20 0 HIADHN C[C@@H](NC(=O)Nc1cccc(NC(=O)c2ccoc2)c1)[C@@H](c1ccccc1)N(C)C ZINC000558315786 943502189 /nfs/dbraw/zinc/50/21/89/943502189.db2.gz MPECWLOJVPQKDE-IERDGZPVSA-N 0 3 406.486 4.345 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)NCc2ccc(OC(F)F)cc2)N(C)C)cc1 ZINC000558359859 943524553 /nfs/dbraw/zinc/52/45/53/943524553.db2.gz FLFOBXZYMDGCBF-FQEVSTJZSA-N 0 3 421.488 4.177 20 0 HIADHN C[C@H](NC(=O)Nc1ccccc1CC(=O)OC(C)(C)C)[C@H](c1ccccc1)N(C)C ZINC000558380108 943536485 /nfs/dbraw/zinc/53/64/85/943536485.db2.gz HOZZPIACKLJEHF-HTAPYJJXSA-N 0 3 411.546 4.384 20 0 HIADHN COc1cc(CN2CC[C@H](CO)C[C@@H]2C)ccc1OCCOc1ccccc1Cl ZINC000558425937 943556834 /nfs/dbraw/zinc/55/68/34/943556834.db2.gz DEKWMOYCXATMAV-HKUYNNGSSA-N 0 3 419.949 4.399 20 0 HIADHN CN(c1ccccc1)c1ccc(CN2CC[C@@](CO)(Cc3ccc(F)cc3)C2)cn1 ZINC000558428074 943556931 /nfs/dbraw/zinc/55/69/31/943556931.db2.gz ZSZSBRZJTOQBCU-RUZDIDTESA-N 0 3 405.517 4.416 20 0 HIADHN CN1CC[C@@H](NCC(=O)Nc2ccccc2C(F)(F)F)[C@H]1c1ccc(Cl)cc1 ZINC000558467129 943567550 /nfs/dbraw/zinc/56/75/50/943567550.db2.gz OFFDPHZGRLSFMT-IEBWSBKVSA-N 0 3 411.855 4.332 20 0 HIADHN COCCN(CCN(C)C)C(=O)Nc1cc(Cl)ccc1SCC(F)(F)F ZINC000558549594 943594849 /nfs/dbraw/zinc/59/48/49/943594849.db2.gz UQCZIHDBYRESBF-UHFFFAOYSA-N 0 3 413.893 4.036 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3ccc(Oc4cccnc4)cc3)cc2)CC1 ZINC000558577136 943606318 /nfs/dbraw/zinc/60/63/18/943606318.db2.gz JNAFHSJERQVARG-UHFFFAOYSA-N 0 3 402.498 4.268 20 0 HIADHN C[C@H](C(=O)NC[C@H]1CCO[C@@H]1c1ccccc1)N1CCC(Cc2ccccc2)CC1 ZINC000558597220 943613538 /nfs/dbraw/zinc/61/35/38/943613538.db2.gz QQTLCJJYLLREKJ-NIJXNBFTSA-N 0 3 406.570 4.224 20 0 HIADHN CN1CCC(N(Cc2ccccc2Br)C(=O)Cc2cccc(F)c2)CC1 ZINC000558610598 943617304 /nfs/dbraw/zinc/61/73/04/943617304.db2.gz XBEOZJPHFXVDAK-UHFFFAOYSA-N 0 3 419.338 4.254 20 0 HIADHN CCC(CC)[C@H](NC(=O)N1CC[C@H](N2CCN(C(C)C)CC2)C1)c1cccs1 ZINC000558694539 943629904 /nfs/dbraw/zinc/62/99/04/943629904.db2.gz FBZOHRXJKCGNRE-FPOVZHCZSA-N 0 3 406.640 4.035 20 0 HIADHN C[C@H](c1cccc(NC(=O)c2ccccc2)c1)N1CCC[C@H](c2nc(N(C)C)no2)C1 ZINC000558743645 943638208 /nfs/dbraw/zinc/63/82/08/943638208.db2.gz VYFBNXJCULVEMY-XLIONFOSSA-N 0 3 419.529 4.329 20 0 HIADHN COc1cc(OC)c(NC(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)cc1Cl ZINC000558749593 943640662 /nfs/dbraw/zinc/64/06/62/943640662.db2.gz SHRJVHHBYIIUFE-MRXNPFEDSA-N 0 3 412.317 4.435 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1ccc2nnc(C3CCC3)n2c1)c1ccsc1 ZINC000558799754 943668633 /nfs/dbraw/zinc/66/86/33/943668633.db2.gz ZKDXWBMNUVUMCE-GOSISDBHSA-N 0 3 412.563 4.263 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2ccc(NC(=O)CC(F)(F)F)cc2)N(C)C)cc1 ZINC000558848605 943697847 /nfs/dbraw/zinc/69/78/47/943697847.db2.gz VGVRLHVEYIRCEN-GOSISDBHSA-N 0 3 422.451 4.310 20 0 HIADHN COc1ccc(NC(=O)CN[C@@H](c2cccc(C(F)(F)F)c2)C2CC2)c(OC)c1 ZINC000558863810 943707100 /nfs/dbraw/zinc/70/71/00/943707100.db2.gz FYGFYSHRJFTODW-HXUWFJFHSA-N 0 3 408.420 4.402 20 0 HIADHN CN(C)C[C@H](NC(=O)N[C@H](c1ccccc1)[C@@H]1CCCO1)c1ccc(Cl)cc1 ZINC000558893694 943727173 /nfs/dbraw/zinc/72/71/73/943727173.db2.gz UBMIOIQBQKTFRW-PCCBWWKXSA-N 0 3 401.938 4.162 20 0 HIADHN COc1cc(OC)cc(C2(F)CCN(CCC(=O)Nc3ccccc3F)CC2)c1 ZINC000558898520 943732287 /nfs/dbraw/zinc/73/22/87/943732287.db2.gz YVRMUKBQLHMLSW-UHFFFAOYSA-N 0 3 404.457 4.132 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@@H](NCc2ccc(C)cc2O[C@H]2CCOC2)c2ccccc21 ZINC000558976317 943780793 /nfs/dbraw/zinc/78/07/93/943780793.db2.gz NNAGWDAYDOWAMI-WWPVKYPJSA-N 0 3 409.526 4.434 20 0 HIADHN CCOCCCn1c(-c2ccoc2)nnc1N1CCN(Cc2ccccc2)[C@H](CC)C1 ZINC000559058026 943818628 /nfs/dbraw/zinc/81/86/28/943818628.db2.gz CGHOAICHKCPWHT-JOCHJYFZSA-N 0 3 423.561 4.066 20 0 HIADHN COc1ccc(CCNCc2cn3ccc(Br)cc3n2)c(Cl)c1OC ZINC000559314731 943894915 /nfs/dbraw/zinc/89/49/15/943894915.db2.gz WFKVVYYDNVAYAS-UHFFFAOYSA-N 0 3 424.726 4.100 20 0 HIADHN C[C@@H](c1ccccc1F)N1CCC[C@H](NCc2ccc(OCC(F)F)cc2)C1=O ZINC000559323626 943896397 /nfs/dbraw/zinc/89/63/97/943896397.db2.gz ZDBFTRSNYXZXGK-YWZLYKJASA-N 0 3 406.448 4.311 20 0 HIADHN O=S(=O)(CCCNCc1ccc(OC(F)F)c(F)c1)c1ccc(Cl)cc1 ZINC000559357680 943907380 /nfs/dbraw/zinc/90/73/80/943907380.db2.gz CZOVCLRLOITTOC-UHFFFAOYSA-N 0 3 407.841 4.034 20 0 HIADHN CCO[C@@H]1C[C@H](NCc2cn(-c3ccccc3)nc2-c2ccc(C)o2)[C@H]1n1cccn1 ZINC000559360744 943911081 /nfs/dbraw/zinc/91/10/81/943911081.db2.gz QUPXKPYBDHJVFG-BGWNEDDSSA-N 0 3 417.513 4.146 20 0 HIADHN O=C(CSc1ncnc2scc(-c3ccccc3)c21)N1CC[C@@H](N2CCCC2)C1 ZINC000559436421 943953114 /nfs/dbraw/zinc/95/31/14/943953114.db2.gz MKEXAHQENDDDRA-QGZVFWFLSA-N 0 3 424.595 4.147 20 0 HIADHN O=C(CSc1ncnc2scc(-c3ccccc3)c21)N1CC[C@H](N2CCCC2)C1 ZINC000559436418 943953949 /nfs/dbraw/zinc/95/39/49/943953949.db2.gz MKEXAHQENDDDRA-KRWDZBQOSA-N 0 3 424.595 4.147 20 0 HIADHN CC(C)[C@@H](CCc1ccccc1)C(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000559449971 943959274 /nfs/dbraw/zinc/95/92/74/943959274.db2.gz LEJIRHOMPYAXHM-PQNGQFLHSA-N 0 3 400.607 4.239 20 0 HIADHN COC(=O)c1cccc(CN2CCC(C)(c3ccc(Br)cc3)CC2)n1 ZINC000559727300 944038248 /nfs/dbraw/zinc/03/82/48/944038248.db2.gz DLHDLEGABDEMNJ-UHFFFAOYSA-N 0 3 403.320 4.184 20 0 HIADHN NS(=O)(=O)c1ccc2c(c1)CCC[C@@H]2N[C@@H]1CC2(CCCC2)Oc2ccccc21 ZINC000559785121 944049976 /nfs/dbraw/zinc/04/99/76/944049976.db2.gz MEIXMVBDKWFBER-LEWJYISDSA-N 0 3 412.555 4.138 20 0 HIADHN COc1ccc(-c2ccc(CN[C@H]3CCCc4cc(S(N)(=O)=O)ccc43)cc2)cc1 ZINC000559786656 944050489 /nfs/dbraw/zinc/05/04/89/944050489.db2.gz KADSJPGFARWEKD-DEOSSOPVSA-N 0 3 422.550 4.177 20 0 HIADHN CN1CC[C@H](NCC(=O)Nc2c(Cl)cccc2Cl)[C@H]1c1ccc(F)c(F)c1 ZINC000559793017 944050705 /nfs/dbraw/zinc/05/07/05/944050705.db2.gz JDEMHABCQQYMDG-QFBILLFUSA-N 0 3 414.283 4.245 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(-c4cc(Cl)c(F)cc4Cl)n3)cn2)CC1 ZINC000559943370 944094818 /nfs/dbraw/zinc/09/48/18/944094818.db2.gz FEINRGHRQWELBU-UHFFFAOYSA-N 0 3 422.291 4.386 20 0 HIADHN O=C(Nc1ccc(Oc2cccnc2)nc1)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000559966661 944103701 /nfs/dbraw/zinc/10/37/01/944103701.db2.gz QIYGPOYDKGKCIE-HXUWFJFHSA-N 0 3 403.486 4.055 20 0 HIADHN Cc1ccc2snc(C(=O)Nc3ccc(C(=O)N(C)[C@H]4CCCN(C)C4)cc3)c2c1 ZINC000559982093 944109113 /nfs/dbraw/zinc/10/91/13/944109113.db2.gz ZJTLIGZCEWQRIN-SFHVURJKSA-N 0 3 422.554 4.023 20 0 HIADHN CN(C(=O)c1ccc(NCc2sccc2Br)cc1)[C@@H]1CCCN(C)C1 ZINC000559995671 944117750 /nfs/dbraw/zinc/11/77/50/944117750.db2.gz BXMDRVJKGDWGKU-MRXNPFEDSA-N 0 3 422.392 4.289 20 0 HIADHN COc1ccc2oc(CNc3ccc(C(=O)N(C)[C@@H]4CCCN(C)C4)cc3)cc2c1 ZINC000559996693 944119701 /nfs/dbraw/zinc/11/97/01/944119701.db2.gz OSTFJBYEENFVDR-HXUWFJFHSA-N 0 3 407.514 4.220 20 0 HIADHN CN1CCN(CCCCNC(=O)N[C@@H]2CCCCC[C@H]2c2ccc(Cl)cc2)CC1 ZINC000560092698 944156592 /nfs/dbraw/zinc/15/65/92/944156592.db2.gz YZLYRDQRASKOIG-FCHUYYIVSA-N 0 3 421.029 4.083 20 0 HIADHN C[C@@H]1C[C@@H](C)CN(C(=O)CN[C@H](c2cccc(C(F)(F)F)c2)C2CCOCC2)C1 ZINC000560179758 944189457 /nfs/dbraw/zinc/18/94/57/944189457.db2.gz UEEPANDIQXASKW-ZOCZFRKYSA-N 0 3 412.496 4.267 20 0 HIADHN COc1cccc2c1CCC[C@H]2NCc1cccc(N2C(=O)N[C@@](C)(C3CC3)C2=O)c1 ZINC000560265193 944211025 /nfs/dbraw/zinc/21/10/25/944211025.db2.gz GHCJPFWNGXNTGW-BWKNWUBXSA-N 0 3 419.525 4.087 20 0 HIADHN COc1ccc(S[C@@H](C)C(=O)N2CCN(c3ccnc4ccccc43)CC2)cc1 ZINC000560490035 944238398 /nfs/dbraw/zinc/23/83/98/944238398.db2.gz URAGGBMQQWPZDC-KRWDZBQOSA-N 0 3 407.539 4.073 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@H](C)N[C@H](C)c2cc(C(=O)OC)cs2)CC1 ZINC000560528252 944243079 /nfs/dbraw/zinc/24/30/79/944243079.db2.gz OJGCDKGMPGDZPA-JKSUJKDBSA-N 0 3 419.566 4.228 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)CN[C@@H]1CC[C@@H](c2ccccc2)C[C@@H]1OC ZINC000560540849 944247382 /nfs/dbraw/zinc/24/73/82/944247382.db2.gz ZIGBEJRJDBNCIA-BLIXFSHQSA-N 0 3 402.922 4.228 20 0 HIADHN CC(C)Cc1cccc([C@H](C)NCc2ccc(N3CCCS3(=O)=O)c(F)c2)c1 ZINC000560549382 944250193 /nfs/dbraw/zinc/25/01/93/944250193.db2.gz FNUUFQJLKLEZKW-KRWDZBQOSA-N 0 3 404.551 4.415 20 0 HIADHN CCc1nnc(NC(=O)[C@H](C)[C@@H](C)N[C@@H](C)c2sccc2Br)s1 ZINC000560557507 944253384 /nfs/dbraw/zinc/25/33/84/944253384.db2.gz KLGVQSCEJCBLQH-BBBLOLIVSA-N 0 3 417.398 4.238 20 0 HIADHN Brc1cccc(-c2ccc(CN3CCC(O[C@H]4CCOC4)CC3)o2)c1 ZINC000560565243 944255925 /nfs/dbraw/zinc/25/59/25/944255925.db2.gz ZJMKDADVMUDYCV-IBGZPJMESA-N 0 3 406.320 4.479 20 0 HIADHN COc1ccccc1NC(=O)C[C@@H](C)N[C@@H](CCO)c1ccc(Cl)c(Cl)c1 ZINC000560585578 944264612 /nfs/dbraw/zinc/26/46/12/944264612.db2.gz UATMESOGWFDWQV-DYVFJYSZSA-N 0 3 411.329 4.432 20 0 HIADHN CN(CCCN(C)C(=O)c1cc2cc(C(F)(F)F)ccc2n1C)Cc1ccncc1 ZINC000560594303 944266974 /nfs/dbraw/zinc/26/69/74/944266974.db2.gz HBBCOYVAYVTQFB-UHFFFAOYSA-N 0 3 418.463 4.186 20 0 HIADHN CN(CCCN(C)C(=O)[C@H]1C[C@@H]1c1ccccc1OC(F)(F)F)Cc1ccncc1 ZINC000560596294 944267850 /nfs/dbraw/zinc/26/78/50/944267850.db2.gz MSBXHNWPCGMULD-MOPGFXCFSA-N 0 3 421.463 4.064 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@@H](O)C2)c1)c1csc(-c2ccccc2Cl)n1 ZINC000560674838 944290569 /nfs/dbraw/zinc/29/05/69/944290569.db2.gz DTMOIPUMWZOXOJ-MRXNPFEDSA-N 0 3 413.930 4.282 20 0 HIADHN CCCN(C)[C@H](CNC(=O)Cc1ccccc1NC(C)=O)c1ccc(Cl)cc1 ZINC000560709740 944303555 /nfs/dbraw/zinc/30/35/55/944303555.db2.gz PYDIPDWDRDFYTF-OAQYLSRUSA-N 0 3 401.938 4.040 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)c1ccc(-n2cncn2)cc1C)c1ccc(Cl)cc1 ZINC000560975007 944382436 /nfs/dbraw/zinc/38/24/36/944382436.db2.gz LNBYDGFADYECKT-NRFANRHFSA-N 0 3 411.937 4.042 20 0 HIADHN CCc1oc(CN2C[C@H]3CCC[C@@]3(c3nc(-c4ccccc4)no3)C2)cc1C(=O)OC ZINC000561014207 944397072 /nfs/dbraw/zinc/39/70/72/944397072.db2.gz YDDRMFWYGZMXLQ-MZNJEOGPSA-N 0 3 421.497 4.232 20 0 HIADHN CCOC(=O)c1c2c(sc1NC(=O)c1cccnc1C)C(C)(C)NC(C)(C)C2 ZINC000561136306 944475068 /nfs/dbraw/zinc/47/50/68/944475068.db2.gz FVFUOCHKJSWQSF-UHFFFAOYSA-N 0 3 401.532 4.040 20 0 HIADHN O=C(CCN[C@H]1CCSc2ccc(F)cc21)Nc1ccc(N2CCCC2=O)cc1 ZINC000561197391 944509300 /nfs/dbraw/zinc/50/93/00/944509300.db2.gz WPGFLTJYZUGDNE-IBGZPJMESA-N 0 3 413.518 4.108 20 0 HIADHN Cc1c(C(=O)N2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)[nH]c2c1C(=O)CC(C)(C)C2 ZINC000561282265 944538545 /nfs/dbraw/zinc/53/85/45/944538545.db2.gz RXBBSUQESHSPHI-AREMUKBSSA-N 0 3 419.569 4.216 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N(C)Cc2ccc(OCC(F)(F)F)cc2)N(C)C)cc1 ZINC000561540378 944663014 /nfs/dbraw/zinc/66/30/14/944663014.db2.gz GDCZWFLPYXJYQS-FQEVSTJZSA-N 0 3 423.479 4.380 20 0 HIADHN FC(F)(F)c1ccn([C@@H]2CCCN(Cc3ccc(OC[C@@H]4CCCO4)cc3)C2)n1 ZINC000561625187 944715367 /nfs/dbraw/zinc/71/53/67/944715367.db2.gz CQJFFGOFLQSCQQ-MJGOQNOKSA-N 0 3 409.452 4.297 20 0 HIADHN COc1cc(C(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)ccc1OC(F)F ZINC000561651880 944728886 /nfs/dbraw/zinc/72/88/86/944728886.db2.gz UFLUUROANQTGBL-SFHVURJKSA-N 0 3 422.472 4.117 20 0 HIADHN Cc1nn(CC(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)cc1-c1ccccc1 ZINC000561657866 944733195 /nfs/dbraw/zinc/73/31/95/944733195.db2.gz QWMHDYCUHLVLMJ-XMMPIXPASA-N 0 3 420.557 4.065 20 0 HIADHN C[C@@H]1C[C@@H]1N1CCN(C(=O)c2ccoc2CN2c3ccccc3C[C@@H]2C)C[C@@H](C)C1 ZINC000561762784 944785174 /nfs/dbraw/zinc/78/51/74/944785174.db2.gz XNISRXBUDIMXEX-YWNPBTLJSA-N 0 3 407.558 4.033 20 0 HIADHN C[C@@H](NCC(=O)NCc1cnn(-c2ccccc2)c1)c1ccc(F)c2ccccc21 ZINC000561787731 944796267 /nfs/dbraw/zinc/79/62/67/944796267.db2.gz OWPPMKFFSMYPTM-QGZVFWFLSA-N 0 3 402.473 4.132 20 0 HIADHN CCCc1nc(C)c(CNC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)o1 ZINC000561795378 944799278 /nfs/dbraw/zinc/79/92/78/944799278.db2.gz DICCHAXRZRWPLN-FQEVSTJZSA-N 0 3 409.452 4.006 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)N[C@H](C)c1c(F)cncc1F)c1ccc(Cl)cc1 ZINC000561878668 944834043 /nfs/dbraw/zinc/83/40/43/944834043.db2.gz VMDLIAYHNFJADN-ACJLOTCBSA-N 0 3 410.896 4.457 20 0 HIADHN COc1ccc(Oc2cc(CN[C@H](C)c3cccc(-n4ccnn4)c3)ccn2)cc1 ZINC000562018627 944897251 /nfs/dbraw/zinc/89/72/51/944897251.db2.gz BPMJHGDMDRMPDB-QGZVFWFLSA-N 0 3 401.470 4.314 20 0 HIADHN COc1ccc(Cl)cc1NC(=O)[C@H](C)N[C@H]1CCN(C)[C@@H]1c1ccc(Cl)cc1 ZINC000562050194 944911907 /nfs/dbraw/zinc/91/19/07/944911907.db2.gz NYGPHXJBFDIJCY-QKMWGZLOSA-N 0 3 422.356 4.364 20 0 HIADHN CN1CC[C@H](NCc2cn3ccc(Br)cc3n2)[C@@H]1c1ccc(Cl)cc1 ZINC000562067926 944920702 /nfs/dbraw/zinc/92/07/02/944920702.db2.gz AJVTYDVGFIFCOB-HKUYNNGSSA-N 0 3 419.754 4.285 20 0 HIADHN CNC(=O)Cc1nc(CN[C@@H](Cc2ccccc2C(F)(F)F)C(C)(C)C)cs1 ZINC000562069777 944921000 /nfs/dbraw/zinc/92/10/00/944921000.db2.gz CYGYPCVHVDCWPN-INIZCTEOSA-N 0 3 413.509 4.197 20 0 HIADHN Cc1cc(NC(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)n(C(C)(C)C)n1 ZINC000562115261 944949028 /nfs/dbraw/zinc/94/90/28/944949028.db2.gz IVYFDGLLNIGZMY-IBGZPJMESA-N 0 3 401.555 4.158 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1ccccc1CN1CCSCC1)c1ccco1 ZINC000562123725 944955611 /nfs/dbraw/zinc/95/56/11/944955611.db2.gz FHAUSVDUEINUEW-PXNSSMCTSA-N 0 3 416.591 4.079 20 0 HIADHN COc1ccc(NC(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)cc1Br ZINC000562171848 945000922 /nfs/dbraw/zinc/00/09/22/945000922.db2.gz UCZQBKLXPICSDI-FZKQIMNGSA-N 0 3 406.324 4.271 20 0 HIADHN CSc1ccc([C@H](CNC(=O)c2ccc(OCc3ccncc3)cc2)N(C)C)cc1 ZINC000564092427 945375647 /nfs/dbraw/zinc/37/56/47/945375647.db2.gz DFWZPKJEXVMCAP-QHCPKHFHSA-N 0 3 421.566 4.415 20 0 HIADHN CN(C)C(=O)c1ccc(CN[C@H]2CCCc3c4cc(Br)ccc4[nH]c32)[nH]1 ZINC000564126906 945391257 /nfs/dbraw/zinc/39/12/57/945391257.db2.gz ICDLBNXHFIPZMJ-KRWDZBQOSA-N 0 3 415.335 4.128 20 0 HIADHN COc1ccc2c(c1F)CC[C@@H]2NC[C@H](O)COc1cccc(Cl)c1Cl ZINC000564144476 945398627 /nfs/dbraw/zinc/39/86/27/945398627.db2.gz RZZTWGVYGNVZJY-NHYWBVRUSA-N 0 3 400.277 4.158 20 0 HIADHN C[C@@H]1[C@H](NC(=O)Nc2ccc(OCc3ccncc3)cc2)CCN1Cc1ccccc1 ZINC000564217776 945437707 /nfs/dbraw/zinc/43/77/07/945437707.db2.gz UZQIBLVSUOKTJH-NTKDMRAZSA-N 0 3 416.525 4.445 20 0 HIADHN C/C(=C/c1ccccc1OC(F)F)CN(C)[C@H](C)c1ccc(S(N)(=O)=O)cc1 ZINC000564261433 945478346 /nfs/dbraw/zinc/47/83/46/945478346.db2.gz RPODXGSGUVEQNQ-IKESIWSLSA-N 0 3 410.486 4.032 20 0 HIADHN COC(=O)c1cc(CN[C@H]2CCCc3c4cc(Br)ccc4[nH]c32)cn1C ZINC000564324555 945516267 /nfs/dbraw/zinc/51/62/67/945516267.db2.gz WHLADEPPQMWNSO-KRWDZBQOSA-N 0 3 416.319 4.223 20 0 HIADHN COc1ccc([C@H](C)N[C@H]2CCCN(Cc3ccc(F)cc3F)C2=O)c(C)c1OC ZINC000564478415 945610985 /nfs/dbraw/zinc/61/09/85/945610985.db2.gz UCICJROCKAIWGQ-YWZLYKJASA-N 0 3 418.484 4.132 20 0 HIADHN C[C@H]1C[C@@H](Nc2ccc(-n3ncc(Cl)c(Cl)c3=O)cc2Cl)CN1C1CC1 ZINC000564568007 945682241 /nfs/dbraw/zinc/68/22/41/945682241.db2.gz NGRGGPPONPNLHR-WDEREUQCSA-N 0 3 413.736 4.230 20 0 HIADHN Cc1cccc(Cc2cnc(NC(=O)CN[C@H]3CCN(C)[C@@H]3c3ccccc3)s2)c1 ZINC000564688210 945731421 /nfs/dbraw/zinc/73/14/21/945731421.db2.gz BIDSMULVNOKZPC-JTHBVZDNSA-N 0 3 420.582 4.016 20 0 HIADHN CSc1ccc([C@@H](CNc2ccc(-c3nc(C)c(C)c(=O)[n-]3)cn2)[NH+](C)C)cc1 ZINC000565124471 945779635 /nfs/dbraw/zinc/77/96/35/945779635.db2.gz XHHGPHZXUPCGMJ-LJQANCHMSA-N 0 3 409.559 4.298 20 0 HIADHN CN(C)C[C@H](NC(=O)[C@H]1C[C@@H]1c1ccccc1OC(F)(F)F)c1ccc(F)cc1 ZINC000565441241 945830351 /nfs/dbraw/zinc/83/03/51/945830351.db2.gz FPQLWFZCLFDYGO-SQNIBIBYSA-N 0 3 410.411 4.247 20 0 HIADHN CC[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)N1CCN(c2ccncc2OC)CC1 ZINC000565495845 945838098 /nfs/dbraw/zinc/83/80/98/945838098.db2.gz ACRQVDXFLDDFIK-QGZVFWFLSA-N 0 3 421.463 4.027 20 0 HIADHN COCCOc1ccc(C(=O)NC[C@@H](c2ccc(SC)cc2)N(C)C)c(Cl)c1 ZINC000565678650 945864842 /nfs/dbraw/zinc/86/48/42/945864842.db2.gz OWANEEZDYDLJKE-FQEVSTJZSA-N 0 3 422.978 4.120 20 0 HIADHN COc1ccc([C@H](Cc2ccccc2)NCC(=O)N(C)Cc2cccc(OC)c2)cc1 ZINC000565803728 945887889 /nfs/dbraw/zinc/88/78/89/945887889.db2.gz MMJNQIIKUNVTPX-VWLOTQADSA-N 0 3 418.537 4.236 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)Nc2ccccc2SC2CCCC2)CC1 ZINC000566034371 945984035 /nfs/dbraw/zinc/98/40/35/945984035.db2.gz IJTXLDQOUDEPAT-SFHVURJKSA-N 0 3 404.624 4.116 20 0 HIADHN Cc1c(NC(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)cnn1-c1ccc(Cl)cc1 ZINC000566937957 946177242 /nfs/dbraw/zinc/17/72/42/946177242.db2.gz ITZDIIFICYKMRR-CTNGQTDRSA-N 0 3 409.921 4.401 20 0 HIADHN CN(C(=O)c1ccc(NCc2ccccc2OC(F)F)cc1)[C@@H]1CCCN(C)C1 ZINC000566987756 946201715 /nfs/dbraw/zinc/20/17/15/946201715.db2.gz CITKYHKFVSWVDV-LJQANCHMSA-N 0 3 403.473 4.066 20 0 HIADHN CN(C)Cc1ccc(-c2noc([C@H]3CCCN3c3ncnc4sccc43)n2)cc1 ZINC000566998943 946209256 /nfs/dbraw/zinc/20/92/56/946209256.db2.gz ZSRKIZQSQQMZKV-QGZVFWFLSA-N 0 3 406.515 4.144 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)c1ccc(C(=O)Nc2ccccc2)cc1)c1ccco1 ZINC000567016316 946217967 /nfs/dbraw/zinc/21/79/67/946217967.db2.gz UYNIKEMTPUANPD-UWJYYQICSA-N 0 3 405.498 4.391 20 0 HIADHN O=C(CN1CCN(CC23CC4CC(CC(C4)C2)C3)CC1)Nc1ccccc1Cl ZINC000567257228 946279849 /nfs/dbraw/zinc/27/98/49/946279849.db2.gz UITCKXTYBWXCSD-UHFFFAOYSA-N 0 3 401.982 4.113 20 0 HIADHN C[C@]1(C2CC2)NC(=O)N(c2cccc(CN[C@@H]3CCc4c3cccc4Cl)c2)C1=O ZINC000567256675 946280449 /nfs/dbraw/zinc/28/04/49/946280449.db2.gz VOCOAOJDQFTJEK-NFBKMPQASA-N 0 3 409.917 4.342 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)[C@H](C)c3ccc(C(=O)C(C)C)cc3)c2)CC1 ZINC000567293920 946296493 /nfs/dbraw/zinc/29/64/93/946296493.db2.gz YIZXNIWFTMUMBN-LJQANCHMSA-N 0 3 407.558 4.409 20 0 HIADHN CC(C)(C)c1ncc(C(=O)N(CCN2CCCC2)Cc2ccc(Cl)cc2)cn1 ZINC000567301813 946302399 /nfs/dbraw/zinc/30/23/99/946302399.db2.gz LGUJFVADHQALOO-UHFFFAOYSA-N 0 3 400.954 4.166 20 0 HIADHN CN(C(=O)c1ccc(NCc2ccccc2C(F)(F)F)cc1)[C@H]1CCCN(C)C1 ZINC000567359890 946314957 /nfs/dbraw/zinc/31/49/57/946314957.db2.gz CFVIYNLRSRRQJK-IBGZPJMESA-N 0 3 405.464 4.484 20 0 HIADHN CC(C)C[C@@H](NC(=O)N1CC[C@@H](N2CCN(C(C)C)CC2)C1)c1ccc(Cl)cc1 ZINC000567438538 946342247 /nfs/dbraw/zinc/34/22/47/946342247.db2.gz FHSUWOPAPOYNOX-FGZHOGPDSA-N 0 3 421.029 4.237 20 0 HIADHN COc1ccccc1OCc1ccc(C(=O)N[C@H](CN(C)C)c2ccc(F)cc2)o1 ZINC000567538838 946367233 /nfs/dbraw/zinc/36/72/33/946367233.db2.gz KQKFGRDLLMUKKX-LJQANCHMSA-N 0 3 412.461 4.039 20 0 HIADHN C[C@H](c1ccccc1)N(C)C(=O)CN[C@H]1CCN(C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000567548922 946373420 /nfs/dbraw/zinc/37/34/20/946373420.db2.gz YXAYGZXLJSWUSI-PDXHDDNESA-N 0 3 403.929 4.034 20 0 HIADHN C[C@H](c1ccccc1)N(CC(=O)Nc1ccccc1SCC(N)=O)CC1CCC1 ZINC000567550490 946373460 /nfs/dbraw/zinc/37/34/60/946373460.db2.gz HBGXFUGTFVSRHX-QGZVFWFLSA-N 0 3 411.571 4.066 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)N[C@H](C)CN(C)Cc2ccccc2)c(C)c1 ZINC000567646300 946390282 /nfs/dbraw/zinc/39/02/82/946390282.db2.gz KQJCZIJUJOJLNZ-RBUKOAKNSA-N 0 3 410.562 4.165 20 0 HIADHN Brc1ccn2cc(CNC[C@@H](c3cccs3)N3CCCC3)nc2c1 ZINC000567653130 946393498 /nfs/dbraw/zinc/39/34/98/946393498.db2.gz JIRRZRUSHSSXFY-INIZCTEOSA-N 0 3 405.365 4.085 20 0 HIADHN Brc1ccn2cc(CNC[C@H](c3cccs3)N3CCCC3)nc2c1 ZINC000567653131 946394245 /nfs/dbraw/zinc/39/42/45/946394245.db2.gz JIRRZRUSHSSXFY-MRXNPFEDSA-N 0 3 405.365 4.085 20 0 HIADHN CSc1ccc([C@@H](CNC(=O)c2cc(C3CC3)nc3onc(C)c32)N(C)C)cc1 ZINC000567784251 946407830 /nfs/dbraw/zinc/40/78/30/946407830.db2.gz AUGQFSSYWUXYFW-LJQANCHMSA-N 0 3 410.543 4.163 20 0 HIADHN CN1CCC(N(Cc2ccccc2Br)C(=O)c2cc(F)cc(F)c2)CC1 ZINC000567805242 946417298 /nfs/dbraw/zinc/41/72/98/946417298.db2.gz SXIZPHCTBRYXSN-UHFFFAOYSA-N 0 3 423.301 4.464 20 0 HIADHN O=C1CCc2cc(-c3noc([C@H]4CN(Cc5ccccc5)CCC4(F)F)n3)ccc2N1 ZINC000568326091 946508577 /nfs/dbraw/zinc/50/85/77/946508577.db2.gz KMDRNNSFYZHFHM-GOSISDBHSA-N 0 3 424.451 4.246 20 0 HIADHN COc1ccc(C[C@@](C)(O)CN[C@H](c2cccnc2)c2ccc(F)c(C)c2)cc1OC ZINC000568334167 946514315 /nfs/dbraw/zinc/51/43/15/946514315.db2.gz RTSKKMNASMUSRG-LOSJGSFVSA-N 0 3 424.516 4.219 20 0 HIADHN COc1ccc(CN(Cc2ccc(-n3cncn3)c(F)c2)CC2CCC2)c(OC)c1 ZINC000568606003 946622575 /nfs/dbraw/zinc/62/25/75/946622575.db2.gz HJXYWKKDKDBWKS-UHFFFAOYSA-N 0 3 410.493 4.226 20 0 HIADHN O=C([C@@H]1C[C@@H]1c1ccccc1Cl)N1CCC[C@@H](c2n[nH]cc2CN2CCCC2)C1 ZINC000568612346 946623579 /nfs/dbraw/zinc/62/35/79/946623579.db2.gz GZVZYXUQXHUECN-NSISKUIASA-N 0 3 412.965 4.169 20 0 HIADHN CCc1nc(C(C)C)ccc1C(=O)Nc1ccc(C(=O)N(C)[C@H]2CCCN(C)C2)cc1 ZINC000568610470 946624569 /nfs/dbraw/zinc/62/45/69/946624569.db2.gz JQHYYBQTQQZHTG-FQEVSTJZSA-N 0 3 422.573 4.186 20 0 HIADHN COc1cccc2c1CCC[C@H]2NCc1cccc(N2C(=O)NC3(CCCC3)C2=O)c1 ZINC000568615575 946627672 /nfs/dbraw/zinc/62/76/72/946627672.db2.gz VATBRMABSIQDCG-OAQYLSRUSA-N 0 3 419.525 4.231 20 0 HIADHN COc1cc(F)c(F)cc1NC(=O)N1CCCN(CCCc2ccccc2)CC1 ZINC000568818098 946715859 /nfs/dbraw/zinc/71/58/59/946715859.db2.gz LJSKGDWANRDJLF-UHFFFAOYSA-N 0 3 403.473 4.146 20 0 HIADHN COC(=O)c1cccc(NC2CCN(Cc3ccc(OC[C@H]4CCCO4)cc3)CC2)c1 ZINC000568933289 946767321 /nfs/dbraw/zinc/76/73/21/946767321.db2.gz ILFUVRRMPKLRFM-XMMPIXPASA-N 0 3 424.541 4.108 20 0 HIADHN COC(=O)c1cccc(NC2CCN(Cc3ccc(OC[C@@H]4CCCO4)cc3)CC2)c1 ZINC000568933288 946768384 /nfs/dbraw/zinc/76/83/84/946768384.db2.gz ILFUVRRMPKLRFM-DEOSSOPVSA-N 0 3 424.541 4.108 20 0 HIADHN CSc1ccc([C@@H](CNC(=O)c2ccc(-c3cncnc3)cc2F)N(C)C)cc1 ZINC000569147677 946822913 /nfs/dbraw/zinc/82/29/13/946822913.db2.gz RXLHOHCXFNASLG-OAQYLSRUSA-N 0 3 410.518 4.037 20 0 HIADHN CC(C)Cc1ccc([C@H](CNC(=O)c2ccc(Cn3ccnc3)cc2)N(C)C)cc1 ZINC000569163132 946829141 /nfs/dbraw/zinc/82/91/41/946829141.db2.gz BMXXSSCPBJOFES-DEOSSOPVSA-N 0 3 404.558 4.163 20 0 HIADHN O=C(Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1)[C@@H]1CCCSC1 ZINC000569176414 946833534 /nfs/dbraw/zinc/83/35/34/946833534.db2.gz QYTQGRHQCPBFCC-OAQYLSRUSA-N 0 3 409.599 4.133 20 0 HIADHN COc1ccc(S(=O)(=O)N(C)[C@H]2CCN(Cc3ccccc3)[C@@H](C)C2)c(Cl)c1 ZINC000569284810 946849966 /nfs/dbraw/zinc/84/99/66/946849966.db2.gz QAWLTFPXHJTTIV-WMZOPIPTSA-N 0 3 422.978 4.022 20 0 HIADHN Cc1cc(I)cc(NC2CCN(Cc3ccncc3)CC2)c1 ZINC000569349113 946859690 /nfs/dbraw/zinc/85/96/90/946859690.db2.gz ATDUDMQARUDEFV-UHFFFAOYSA-N 0 3 407.299 4.071 20 0 HIADHN C[C@@H]1CN(C(=O)c2ccc(Br)c(Cl)c2F)CCN(C2CCC2)C1 ZINC000569721801 946958265 /nfs/dbraw/zinc/95/82/65/946958265.db2.gz JENFCCJQYQOIRS-NSHDSACASA-N 0 3 403.723 4.188 20 0 HIADHN C[C@@H]1C[C@@H](N2CCCC2)CN1C(=O)c1cc2sc(Nc3ccccc3)nc2s1 ZINC000569857046 947021701 /nfs/dbraw/zinc/02/17/01/947021701.db2.gz JMJUZJIQTWLEBZ-GDBMZVCRSA-N 0 3 412.584 4.800 20 0 HIADHN Brc1cccc(-c2nc(CN[C@@H]3CCOC4(CCOCC4)C3)cs2)c1 ZINC000569952487 947051127 /nfs/dbraw/zinc/05/11/27/947051127.db2.gz MGBIUIVYWDKHOA-MRXNPFEDSA-N 0 3 423.376 4.390 20 0 HIADHN CCOc1c(Cl)cc(CN(Cc2ccccc2)C[C@@]2(O)CCO[C@@H]2C)cc1OC ZINC000569968635 947056027 /nfs/dbraw/zinc/05/60/27/947056027.db2.gz IWIFEFPXEQREOW-HXOBKFHXSA-N 0 3 419.949 4.289 20 0 HIADHN CCCOc1cc(C)ccc1NC(=O)N1CCC(CN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000569996751 947064532 /nfs/dbraw/zinc/06/45/32/947064532.db2.gz JCLHURSNJHTSJR-OALUTQOASA-N 0 3 403.567 4.137 20 0 HIADHN O=C(c1ccc(CN[C@@H](Cc2ccccc2F)c2ccccc2)cc1)N1CCOCC1 ZINC000569997329 947066724 /nfs/dbraw/zinc/06/67/24/947066724.db2.gz XAAMBHCQIIGCRE-VWLOTQADSA-N 0 3 418.512 4.372 20 0 HIADHN CSc1ccc([C@@H](CNC(=O)C(C)(C)Cc2nc3ccccc3[nH]2)N(C)C)cc1 ZINC000570073384 947084910 /nfs/dbraw/zinc/08/49/10/947084910.db2.gz DTLVMXSJHLVUHZ-HXUWFJFHSA-N 0 3 410.587 4.273 20 0 HIADHN CC[C@H](c1ccccc1)N1CC(=O)N(C2CC(N3CCC(C(F)(F)F)CC3)C2)C1=O ZINC000570116063 947099207 /nfs/dbraw/zinc/09/92/07/947099207.db2.gz ZODQNBNZTCUYOV-CTWPCTMYSA-N 0 3 423.479 4.207 20 0 HIADHN Clc1cccc(N2CCOCC2)c1CNC[C@H](c1cccs1)N1CCCC1 ZINC000570284117 947180992 /nfs/dbraw/zinc/18/09/92/947180992.db2.gz BQPWBMCXEQFTCH-HXUWFJFHSA-N 0 3 405.995 4.165 20 0 HIADHN C[C@@]1(C2CC2)NC(=O)N(c2cccc(CN[C@H](c3ccc(F)cc3)C3CC3)c2)C1=O ZINC000570299058 947181932 /nfs/dbraw/zinc/18/19/32/947181932.db2.gz CUXGZDFWVQILLO-URXFXBBRSA-N 0 3 407.489 4.292 20 0 HIADHN C[C@]1(C2CC2)NC(=O)N(c2cccc(CN[C@H](c3ccc(F)cc3)C3CC3)c2)C1=O ZINC000570299060 947181975 /nfs/dbraw/zinc/18/19/75/947181975.db2.gz CUXGZDFWVQILLO-XUZZJYLKSA-N 0 3 407.489 4.292 20 0 HIADHN COc1cc(C(C)=O)ccc1OC[C@H](O)CN1CCC[C@H](C)[C@@H]1c1ccc(C)cc1 ZINC000570319259 947199606 /nfs/dbraw/zinc/19/96/06/947199606.db2.gz OGMKJCGVWJFJKH-QRJOEMBSSA-N 0 3 411.542 4.419 20 0 HIADHN Cc1cc(CSc2ncccc2C(=O)N[C@@H]2CCN(Cc3ccccc3)[C@@H]2C)no1 ZINC000570595374 947307851 /nfs/dbraw/zinc/30/78/51/947307851.db2.gz LUHPFYHFCMPTIH-DYESRHJHSA-N 0 3 422.554 4.063 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)c1c(F)cc(Br)cc1F)c1ccco1 ZINC000570712947 947332915 /nfs/dbraw/zinc/33/29/15/947332915.db2.gz BMMAMBWWZYFDAR-YGRLFVJLSA-N 0 3 401.251 4.180 20 0 HIADHN NC(=O)[C@H](Cc1ccc(C(F)(F)F)cc1)NC[C@@H](Cc1ccccc1)C(F)(F)F ZINC000570737918 947341420 /nfs/dbraw/zinc/34/14/20/947341420.db2.gz PBLDDSBXPBRTFP-SJORKVTESA-N 0 3 418.381 4.113 20 0 HIADHN O=C(CCCc1ccccc1Cl)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000570765478 947352326 /nfs/dbraw/zinc/35/23/26/947352326.db2.gz LPZIMYKRBHMQLM-UHFFFAOYSA-N 0 3 418.940 4.461 20 0 HIADHN CSc1ccc([C@@H](CNC(=O)c2cnc(-c3ccccc3)nc2C)N(C)C)cc1 ZINC000570962522 947400086 /nfs/dbraw/zinc/40/00/86/947400086.db2.gz GVJYWLVOWKBOHA-OAQYLSRUSA-N 0 3 406.555 4.207 20 0 HIADHN Cc1cc(C)n(Cc2cccc(C(=O)N[C@@H](CN(C)C)c3ccc(Cl)cc3)c2)n1 ZINC000571108348 947504102 /nfs/dbraw/zinc/50/41/02/947504102.db2.gz PHHNMKMPAKYEEA-QFIPXVFZSA-N 0 3 410.949 4.234 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)c1cccnc1OCc1ccccc1F)c1ccco1 ZINC000571117199 947508435 /nfs/dbraw/zinc/50/84/35/947508435.db2.gz RHMMEVMSYLSPPE-OXJNMPFZSA-N 0 3 411.477 4.252 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)Nc1ccc(-n2cccn2)c(Cl)c1)c1ccco1 ZINC000571114810 947508954 /nfs/dbraw/zinc/50/89/54/947508954.db2.gz OJMOWMWLDUWCMO-PBHICJAKSA-N 0 3 401.898 4.370 20 0 HIADHN OCC1([C@@H](NCc2cc3c(c(Br)c2)OCO3)c2ccccc2)CCC1 ZINC000571187387 947535419 /nfs/dbraw/zinc/53/54/19/947535419.db2.gz GKUMZPSRCKJPMK-IBGZPJMESA-N 0 3 404.304 4.171 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Cc1cc(Cl)ccc1Br)c1ccco1 ZINC000571236886 947559930 /nfs/dbraw/zinc/55/99/30/947559930.db2.gz NDCTYCQOOZSPRX-BLLLJJGKSA-N 0 3 413.743 4.484 20 0 HIADHN O[C@H](CO[C@@H]1CCCc2ccccc21)CN1CCC(Oc2cncc(Cl)c2)CC1 ZINC000571242390 947563295 /nfs/dbraw/zinc/56/32/95/947563295.db2.gz AGFIWQGFCQVEMF-WMZHIEFXSA-N 0 3 416.949 4.033 20 0 HIADHN O=C1CC[C@@H]2CN([C@@H]3CCCc4ccc(Br)cc43)CC[C@H]2N1C1CC1 ZINC000571389939 947633279 /nfs/dbraw/zinc/63/32/79/947633279.db2.gz BQZXEYVANISSPR-CDHQVMDDSA-N 0 3 403.364 4.302 20 0 HIADHN COc1cc(Br)ccc1CN1C[C@H](c2ccccc2)[C@H]2COCC[C@@H]21 ZINC000571412788 947636114 /nfs/dbraw/zinc/63/61/14/947636114.db2.gz AFNSEIZWSFNNTN-AQNXPRMDSA-N 0 3 402.332 4.462 20 0 HIADHN CCN1CC[C@H](NCC(=O)Nc2ccccc2Cl)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000571421700 947639622 /nfs/dbraw/zinc/63/96/22/947639622.db2.gz YFEWZIPNPFWLFJ-ICSRJNTNSA-N 0 3 410.320 4.496 20 0 HIADHN O=C(c1cccc(Oc2ccncc2)c1)N1CCN(c2ccnc3ccccc32)CC1 ZINC000571469172 947662371 /nfs/dbraw/zinc/66/23/71/947662371.db2.gz IZLWAIVISYKDRR-UHFFFAOYSA-N 0 3 410.477 4.385 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@@H]3CCc4sc(Cl)cc43)c2)CC1 ZINC000571484782 947673360 /nfs/dbraw/zinc/67/33/60/947673360.db2.gz JFNWNLVIDGDXPT-QGZVFWFLSA-N 0 3 404.967 4.352 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1ccc2nnc(C(C)C)n2c1)c1cccc(OC)c1 ZINC000571540319 947693664 /nfs/dbraw/zinc/69/36/64/947693664.db2.gz STVOQOJGPGUVFO-HXUWFJFHSA-N 0 3 424.549 4.066 20 0 HIADHN COc1ccc(CN[C@@H]2CCN(C)[C@@H]2c2ccccc2)c(Br)c1OC ZINC000571690537 947748792 /nfs/dbraw/zinc/74/87/92/947748792.db2.gz FJLJQGCNTGBGCN-VQIMIIECSA-N 0 3 405.336 4.001 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)c3nc4ccccc4cc3Cl)CC2)C[C@H](C)O1 ZINC000571933673 947816092 /nfs/dbraw/zinc/81/60/92/947816092.db2.gz YXUWKICTENESDT-IRXDYDNUSA-N 0 3 415.965 4.240 20 0 HIADHN CNS(=O)(=O)c1cccc([C@@H](C)NC/C(C)=C/c2cccc(C(F)(F)F)c2)c1 ZINC000571955035 947821245 /nfs/dbraw/zinc/82/12/45/947821245.db2.gz WRJHNZOMRACECF-YVGNARHYSA-N 0 3 412.477 4.368 20 0 HIADHN Cc1ccc2c(-c3nc(-c4ccc(N5CCCN(C)CC5)nc4)no3)csc2c1 ZINC000571958541 947822151 /nfs/dbraw/zinc/82/21/51/947822151.db2.gz SNAUMANVNNEXNL-UHFFFAOYSA-N 0 3 405.527 4.464 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@H](C)N[C@@H](C)c2ccc(C(F)(F)F)cc2)cc1OC ZINC000571963013 947823144 /nfs/dbraw/zinc/82/31/44/947823144.db2.gz MPNVJJRBOOSLAR-GJZGRUSLSA-N 0 3 424.463 4.420 20 0 HIADHN Cc1ccc2ncc(-c3noc([C@H]4CN(Cc5ccccc5)CCC4(F)F)n3)n2c1 ZINC000572164647 947853756 /nfs/dbraw/zinc/85/37/56/947853756.db2.gz QUPBVYCJCUQHGW-QGZVFWFLSA-N 0 3 409.440 4.318 20 0 HIADHN C[C@H]1[C@H](NC(=O)Nc2ccc(NC(=O)c3ccco3)cc2)CCN1Cc1ccccc1 ZINC000572273126 947873199 /nfs/dbraw/zinc/87/31/99/947873199.db2.gz LBLQOXXZUKGYAT-LAUBAEHRSA-N 0 3 418.497 4.316 20 0 HIADHN CCc1ccc([C@H](CNC(=O)Nc2ccc([C@H](C)N3CCOCC3)cc2)N(C)C)cc1 ZINC000572440932 947906152 /nfs/dbraw/zinc/90/61/52/947906152.db2.gz RWQAWNGNJCDUJZ-CYFREDJKSA-N 0 3 424.589 4.067 20 0 HIADHN C[C@@H]1C[C@@H](NS(=O)(=O)Cc2ccc3ccccc3c2)CCN1Cc1ccccc1 ZINC000572528378 947930845 /nfs/dbraw/zinc/93/08/45/947930845.db2.gz OKMUWEYWVBGRHM-DVECYGJZSA-N 0 3 408.567 4.312 20 0 HIADHN C[C@@H]1C[C@H](NS(=O)(=O)Cc2ccc3ccccc3c2)CCN1Cc1ccccc1 ZINC000572528379 947931888 /nfs/dbraw/zinc/93/18/88/947931888.db2.gz OKMUWEYWVBGRHM-NTKDMRAZSA-N 0 3 408.567 4.312 20 0 HIADHN CC[C@H](C)[C@H](C)N(CC(=O)N1c2ccccc2NC(=O)C[C@H]1C(F)(F)F)C1CC1 ZINC000572626581 947960390 /nfs/dbraw/zinc/96/03/90/947960390.db2.gz QQKHEURALLMHFF-DEYYWGMASA-N 0 3 411.468 4.192 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)C(=O)Nc1cc(-c2ccc(C)o2)ccc1C ZINC000572668803 947975254 /nfs/dbraw/zinc/97/52/54/947975254.db2.gz NIEVYWXSUQZRRQ-UHFFFAOYSA-N 0 3 421.497 4.211 20 0 HIADHN C[C@@H]1[C@H](NC(=O)Nc2ccc(OCC3CCOCC3)cc2)CCN1Cc1ccccc1 ZINC000572758097 948002404 /nfs/dbraw/zinc/00/24/04/948002404.db2.gz JAAMHGSFMMBXRS-NTKDMRAZSA-N 0 3 423.557 4.277 20 0 HIADHN Cc1cnn(-c2ccc(NC(=O)NC[C@H]3CCCN3Cc3ccccc3)cc2F)c1 ZINC000572886357 948030049 /nfs/dbraw/zinc/03/00/49/948030049.db2.gz KOAZCOMPKLNFDU-HXUWFJFHSA-N 0 3 407.493 4.106 20 0 HIADHN COc1cccc([C@@H]2[C@H](N[C@H](C)C(=O)Nc3ccc(C)cc3C)CCN2C2CC2)c1 ZINC000572902581 948033559 /nfs/dbraw/zinc/03/35/59/948033559.db2.gz ITTLZGXVHIBZDZ-DQMJNTIXSA-N 0 3 407.558 4.207 20 0 HIADHN FC(F)(F)[C@@]1(c2nc(CCC3CCOCC3)no2)CCN(Cc2ccccc2)C1 ZINC000572905592 948035482 /nfs/dbraw/zinc/03/54/82/948035482.db2.gz XZJPNZZLZGPOHB-FQEVSTJZSA-N 0 3 409.452 4.135 20 0 HIADHN CN1CCN(c2ccc(CNCc3ccc(-c4ccc(Cl)cc4)cc3)cn2)CC1 ZINC000573012767 948056927 /nfs/dbraw/zinc/05/69/27/948056927.db2.gz RJSRMUFLAOLGGE-UHFFFAOYSA-N 0 3 406.961 4.444 20 0 HIADHN CN(C)C[C@H](NC(=O)c1ccc(NC(=O)c2ccccc2)cc1)c1ccc(F)cc1 ZINC000573011462 948057541 /nfs/dbraw/zinc/05/75/41/948057541.db2.gz ZKXGHGREGCDGTJ-QFIPXVFZSA-N 0 3 405.473 4.111 20 0 HIADHN CCc1ccccc1[C@@H]1C[C@H]1c1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1 ZINC000573044330 948068568 /nfs/dbraw/zinc/06/85/68/948068568.db2.gz WAOODVKMPUYPSM-LEWJYISDSA-N 0 3 403.530 4.107 20 0 HIADHN CCCN(C)[C@H](CNC(=O)c1cccc(NC(C)=O)c1C)c1ccc(Cl)cc1 ZINC000573229573 948114076 /nfs/dbraw/zinc/11/40/76/948114076.db2.gz IRZPVOLUJOKSSE-OAQYLSRUSA-N 0 3 401.938 4.420 20 0 HIADHN CCNC(=O)C[C@@H]1CCCCN1Cc1cc(-c2c(OC)ccc3ccccc32)no1 ZINC000573391458 948179830 /nfs/dbraw/zinc/17/98/30/948179830.db2.gz HSBMUZMUYCRNTK-SFHVURJKSA-N 0 3 407.514 4.384 20 0 HIADHN Cc1cc(C)c(NC(=O)CN2CCN(c3ccnc4ccccc43)CC2)c(Cl)c1 ZINC000573644976 948264339 /nfs/dbraw/zinc/26/43/39/948264339.db2.gz IZCRFVHBCKWJKF-UHFFFAOYSA-N 0 3 408.933 4.266 20 0 HIADHN CN(CCC(=O)NC(c1ccccc1)c1ccccc1)C[C@@H]1COc2ccccc2O1 ZINC000573706406 948276946 /nfs/dbraw/zinc/27/69/46/948276946.db2.gz UVUXHYHYQMTVRJ-JOCHJYFZSA-N 0 3 416.521 4.054 20 0 HIADHN COC(=O)c1cc(CN[C@H]2CCCc3c4cc(Br)ccc4[nH]c32)c[nH]1 ZINC000573719876 948281713 /nfs/dbraw/zinc/28/17/13/948281713.db2.gz DBFOBQGSTGQFCC-INIZCTEOSA-N 0 3 402.292 4.212 20 0 HIADHN O=S(=O)(Cc1ccccc1CN[C@H]1CCCc2c3ccccc3[nH]c21)N1CCCC1 ZINC000573758474 948290579 /nfs/dbraw/zinc/29/05/79/948290579.db2.gz FIVDIOKOKCLBBY-QHCPKHFHSA-N 0 3 423.582 4.261 20 0 HIADHN CN(C(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1)C1CCC(F)(F)CC1 ZINC000573841239 948308006 /nfs/dbraw/zinc/30/80/06/948308006.db2.gz CJXKKBPWDIWLGG-GOSISDBHSA-N 0 3 404.423 4.477 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)c1ccc(Oc2ccc(C(N)=O)cc2)cc1)c1ccco1 ZINC000573950580 948331404 /nfs/dbraw/zinc/33/14/04/948331404.db2.gz UWNVQJJVNVORBE-HRAATJIYSA-N 0 3 421.497 4.030 20 0 HIADHN Cc1cc(C)c(NC(=O)[C@H](C)N[C@H]2CCN(C)[C@H]2c2ccc(F)c(F)c2)c(C)c1 ZINC000574122572 948371439 /nfs/dbraw/zinc/37/14/39/948371439.db2.gz YLHWIMNODGXUIV-BUKVSMQUSA-N 0 3 401.501 4.252 20 0 HIADHN CC(C)Oc1ccc([C@@H](CN[C@@H](c2cnn(C)c2)c2cccc(F)c2)N(C)C)cc1 ZINC000574184904 948381695 /nfs/dbraw/zinc/38/16/95/948381695.db2.gz LROGEOHZQRHYAL-DNQXCXABSA-N 0 3 410.537 4.328 20 0 HIADHN CC(C)Oc1ccc([C@@H](CN[C@H](c2cnn(C)c2)c2cccc(F)c2)N(C)C)cc1 ZINC000574184905 948382347 /nfs/dbraw/zinc/38/23/47/948382347.db2.gz LROGEOHZQRHYAL-RPWUZVMVSA-N 0 3 410.537 4.328 20 0 HIADHN CC(C)N1CC[C@H](N[C@@H]2CCN(c3ccccc3F)C2=O)[C@H]1c1ccc(F)c(F)c1 ZINC000574587761 948483334 /nfs/dbraw/zinc/48/33/34/948483334.db2.gz XZOSDKQZCBUGQU-TUNNFDKTSA-N 0 3 417.475 4.023 20 0 HIADHN CC(C)N1CC[C@H](N[C@@H]2CCN(c3ccccc3F)C2=O)[C@@H]1c1ccc(F)c(F)c1 ZINC000574587764 948484219 /nfs/dbraw/zinc/48/42/19/948484219.db2.gz XZOSDKQZCBUGQU-VWPQPMDRSA-N 0 3 417.475 4.023 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NS(=O)(=O)Cc1ccc2ccccc2c1 ZINC000574606009 948490330 /nfs/dbraw/zinc/49/03/30/948490330.db2.gz AKWRJRCTXCUVOJ-DVECYGJZSA-N 0 3 408.567 4.170 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)N1CCC(OCC2CCCCC2)CC1)c1ccco1 ZINC000574783314 948524515 /nfs/dbraw/zinc/52/45/15/948524515.db2.gz QCHFWQXOKNALNT-WIYYLYMNSA-N 0 3 405.583 4.480 20 0 HIADHN COc1cc(CN2CC[C@@H](C(F)(F)F)[C@@H](CO)C2)c(-c2ccccc2)cc1OC ZINC000574844526 948542524 /nfs/dbraw/zinc/54/25/24/948542524.db2.gz LWANTBDRRBGNRU-IEBWSBKVSA-N 0 3 409.448 4.364 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1ccc(F)c(C(=O)OC)c1F)c1ccsc1 ZINC000574849242 948543802 /nfs/dbraw/zinc/54/38/02/948543802.db2.gz KPIOMJWTAVZUTJ-OAHLLOKOSA-N 0 3 411.474 4.018 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)c1nccnc1-c1nc2ccccc2s1)c1ccco1 ZINC000575016599 948573421 /nfs/dbraw/zinc/57/34/21/948573421.db2.gz YKXVCLGIVRWKNA-HOCLYGCPSA-N 0 3 421.526 4.206 20 0 HIADHN COc1cc(CN[C@H](C)c2ccc(-n3cccn3)cc2)cc(OC)c1OCC(F)F ZINC000575020198 948574888 /nfs/dbraw/zinc/57/48/88/948574888.db2.gz FYTUCDAIPRCKOT-OAHLLOKOSA-N 0 3 417.456 4.384 20 0 HIADHN COc1cc(CN(C)[C@H](C)[C@@H]2Cc3ccccc3O2)cc(OC)c1OCC(F)F ZINC000575095102 948591955 /nfs/dbraw/zinc/59/19/55/948591955.db2.gz XCMRREXSCUJOSQ-KDOFPFPSSA-N 0 3 407.457 4.172 20 0 HIADHN O=C(NC[C@@]1(O)CCN(Cc2ccccc2)C1)Nc1cccc(Oc2ccccc2)c1 ZINC000575224274 948637076 /nfs/dbraw/zinc/63/70/76/948637076.db2.gz WLRQWZOYZBBBGW-VWLOTQADSA-N 0 3 417.509 4.237 20 0 HIADHN CC[C@@]1(c2ccc(Cl)cc2)NC(=O)N(C2CCN(Cc3ccccc3)CC2)C1=O ZINC000575344742 948649739 /nfs/dbraw/zinc/64/97/39/948649739.db2.gz OLVFFIYQMWHPCT-QHCPKHFHSA-N 0 3 411.933 4.162 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)c1cn(-c2ccc(Cl)cc2)nc1C)c1ccco1 ZINC000575351702 948651871 /nfs/dbraw/zinc/65/18/71/948651871.db2.gz WQNHZBIJGMBQIE-LIRRHRJNSA-N 0 3 400.910 4.286 20 0 HIADHN NS(=O)(=O)c1ccc2c(c1)[C@@H](NCc1cccc(COc3ccccc3)c1)CCC2 ZINC000575371663 948661579 /nfs/dbraw/zinc/66/15/79/948661579.db2.gz UYMZSYKTSDCNRQ-DEOSSOPVSA-N 0 3 422.550 4.080 20 0 HIADHN COc1ccc(C[C@H](C)C(=O)NC[C@H](c2ccc(SC)cc2)N(C)C)cc1OC ZINC000575831574 948727980 /nfs/dbraw/zinc/72/79/80/948727980.db2.gz RQKSXLSKNMMLGC-OXJNMPFZSA-N 0 3 416.587 4.023 20 0 HIADHN FC(F)(c1nc2ccc(Cl)nc2[nH]1)N1CCC[C@@H]2CN(Cc3ccccc3)C[C@H]21 ZINC001164630418 719101797 /nfs/dbraw/zinc/10/17/97/719101797.db2.gz WGEYIZSACBSZCO-NVXWUHKLSA-N 0 3 417.891 4.257 20 0 HIADHN Clc1ccc2c(c1)nc(Cl)nc2N1CC[C@@H]2[C@@H]1CCN2Cc1cccnc1 ZINC001164726886 720381210 /nfs/dbraw/zinc/38/12/10/720381210.db2.gz PVCBEQYCDNNEHX-MSOLQXFVSA-N 0 3 400.313 4.185 20 0 HIADHN Cc1cncc(COC[C@@]23CCC[C@H]2CN(c2ccc(CN(C)C4CC4)cn2)C3)c1 ZINC001164797800 721601650 /nfs/dbraw/zinc/60/16/50/721601650.db2.gz CFOLESKVNGDPNL-DHLKQENFSA-N 0 3 406.574 4.203 20 0 HIADHN Cc1cc(Cl)c(C)c(N2CCC(F)(F)[C@@]3(CCN(Cc4ccccn4)C3)C2)n1 ZINC001164906791 721710065 /nfs/dbraw/zinc/71/00/65/721710065.db2.gz OHYITUHYRXDBGO-HXUWFJFHSA-N 0 3 406.908 4.485 20 0 HIADHN COc1ccc2ccnc(N3CCC(F)(F)[C@@]4(CCN(Cc5ccccn5)C4)C3)c2c1 ZINC001164904970 721716978 /nfs/dbraw/zinc/71/69/78/721716978.db2.gz GAFFYMGKCWUUHA-HSZRJFAPSA-N 0 3 424.495 4.376 20 0 HIADHN CCSc1ccnc(N2CCC(F)(F)[C@@]3(CCN(Cc4ccccn4)C3)C2)c1 ZINC001164911253 721733518 /nfs/dbraw/zinc/73/35/18/721733518.db2.gz JNTOCAOTPVZMEO-HXUWFJFHSA-N 0 3 404.530 4.326 20 0 HIADHN Clc1cc(N2CCC3(CC2)COCCN(Cc2ccncc2)C3)c2ccccc2n1 ZINC001164958740 722051569 /nfs/dbraw/zinc/05/15/69/722051569.db2.gz FYGSERGMUFKJNO-UHFFFAOYSA-N 0 3 422.960 4.402 20 0 HIADHN Clc1ccc2c(ccnc2N2CC[C@@H]3CN(Cc4cccnc4)CCO[C@H]3C2)c1 ZINC001164976554 722109593 /nfs/dbraw/zinc/10/95/93/722109593.db2.gz LSSDDMJKTCWOTE-KNQAVFIVSA-N 0 3 408.933 4.011 20 0 HIADHN Clc1cccc2nc(N3CC[C@@H]4CN(Cc5cccnc5)CCO[C@H]4C3)ccc12 ZINC001164983714 722114802 /nfs/dbraw/zinc/11/48/02/722114802.db2.gz ZERYWFLWBZGCMM-GCJKJVERSA-N 0 3 408.933 4.011 20 0 HIADHN Cc1ccc(F)c2cc(C)c(N3CC[C@@H]4CN(Cc5cccnc5)CCO[C@H]4C3)nc12 ZINC001164976449 722128448 /nfs/dbraw/zinc/12/84/48/722128448.db2.gz LOSMSEHBZJDKKZ-OFNKIYASSA-N 0 3 420.532 4.113 20 0 HIADHN CCOC(=O)c1cnc2cc(N3CCC[C@]4(CCN4Cc4cccc(F)c4)C3)[nH]cc1-2 ZINC001164993818 722207114 /nfs/dbraw/zinc/20/71/14/722207114.db2.gz BWRNZPUQFOFUCE-DEOSSOPVSA-N 0 3 422.504 4.124 20 0 HIADHN COc1cc(C)c2ncnc(N3CCC[C@]4(CCN4Cc4cccc(F)c4)C3)c2c1 ZINC001164995468 722213984 /nfs/dbraw/zinc/21/39/84/722213984.db2.gz JAJBTZADUHMSTA-DEOSSOPVSA-N 0 3 406.505 4.331 20 0 HIADHN C[C@@H]1CCCCN1C(=O)c1ccc(NC(=O)N(CCN(C)C)C2CCCC2)cc1 ZINC000436001013 861287453 /nfs/dbraw/zinc/28/74/53/861287453.db2.gz AHECWLGBUMEDSW-GOSISDBHSA-N 0 3 400.567 4.039 20 0 HIADHN CCN1CCC[C@@H](NC(=O)N[C@@H](CC(F)(F)F)c2ccc(C(F)(F)F)cc2)C1 ZINC000436034747 861327129 /nfs/dbraw/zinc/32/71/29/861327129.db2.gz OWZKFVNUALLRFF-CABCVRRESA-N 0 3 411.390 4.482 20 0 HIADHN Cc1oc(-c2ccccc2)c(C(=O)Nc2ccc3oc(=O)n(CCN(C)C)c3c2)c1C ZINC000436238606 861547443 /nfs/dbraw/zinc/54/74/43/861547443.db2.gz JUELLOZTCJJHGG-UHFFFAOYSA-N 0 3 419.481 4.285 20 0 HIADHN COc1cc(CNCCNC(=O)c2ccccc2Cl)ccc1OCc1ccccc1 ZINC000008113802 845477328 /nfs/dbraw/zinc/47/73/28/845477328.db2.gz YPCMWQVETXLHMH-UHFFFAOYSA-N 0 3 424.928 4.447 20 0 HIADHN Cc1cccc(C(=O)Nc2ccccc2C(=O)NCc2ccccc2CN(C)C)c1 ZINC000009917011 845603270 /nfs/dbraw/zinc/60/32/70/845603270.db2.gz UVYXZJFRDHGBFR-UHFFFAOYSA-N 0 3 401.510 4.239 20 0 HIADHN CCOc1ccccc1OCCCC(=O)N1c2ccc(C)cc2[C@H]2CN(C)CC[C@@H]21 ZINC000010045407 845614605 /nfs/dbraw/zinc/61/46/05/845614605.db2.gz ROWGFJWSSZWNSX-IRLDBZIGSA-N 0 3 408.542 4.387 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)COc3c(Cl)cccc3Cl)cc2)CC1 ZINC000011944436 845842872 /nfs/dbraw/zinc/84/28/72/845842872.db2.gz VMXSKLGIGFKPIX-UHFFFAOYSA-N 0 3 408.329 4.153 20 0 HIADHN O=C(Nc1ccc(-c2nc3ccccc3[nH]2)cc1)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000012433380 845870381 /nfs/dbraw/zinc/87/03/81/845870381.db2.gz ZYHDDCHCWXFARI-FQEVSTJZSA-N 0 3 411.509 4.476 20 0 HIADHN COc1ccc([C@H](CNC(=O)c2c[nH]nc2-c2ccc(Cl)cc2)N2CCCC2)cc1 ZINC000014050934 845921233 /nfs/dbraw/zinc/92/12/33/845921233.db2.gz KBGSQOBUGCSXMT-NRFANRHFSA-N 0 3 424.932 4.306 20 0 HIADHN CCOC(=O)c1sc2nc(C)nc(NC[C@@H](c3ccco3)N3CCCC3)c2c1C ZINC000015171869 846015600 /nfs/dbraw/zinc/01/56/00/846015600.db2.gz AXIUNPZLNBZYPA-HNNXBMFYSA-N 0 3 414.531 4.327 20 0 HIADHN CCOC(=O)c1sc2nc(C)nc(NC[C@@H](c3cccs3)N(C)C)c2c1C ZINC000015171313 846015634 /nfs/dbraw/zinc/01/56/34/846015634.db2.gz CVSWWDMJOPYMQH-ZDUSSCGKSA-N 0 3 404.561 4.261 20 0 HIADHN Cc1cccc(C(=O)Nc2ccccc2C(=O)NC[C@H](c2ccccc2)N(C)C)c1 ZINC000015372981 846041898 /nfs/dbraw/zinc/04/18/98/846041898.db2.gz VTTNTMYZJXUSAV-HSZRJFAPSA-N 0 3 401.510 4.280 20 0 HIADHN CCc1ccc([C@H](NCC(=O)Nc2cc(S(C)(=O)=O)ccc2Cl)C(C)C)cc1 ZINC000015522554 846058506 /nfs/dbraw/zinc/05/85/06/846058506.db2.gz UFJVYRYGWMVWLW-OAQYLSRUSA-N 0 3 422.978 4.231 20 0 HIADHN COc1ccc([C@@H](CNC(=O)CCc2ncc(-c3ccccc3)o2)N2CCCC2)cc1 ZINC000021298236 846426769 /nfs/dbraw/zinc/42/67/69/846426769.db2.gz JXNJDTLBVSCRGX-JOCHJYFZSA-N 0 3 419.525 4.236 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cc(Br)ccc3F)c(C)c2)CC1 ZINC000022508460 846580229 /nfs/dbraw/zinc/58/02/29/846580229.db2.gz WWEYVVYASUMZJM-UHFFFAOYSA-N 0 3 420.326 4.291 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1ccc(Br)cc1F)c1cccc(OC)c1 ZINC000022700804 846605892 /nfs/dbraw/zinc/60/58/92/846605892.db2.gz RYMGBZXFNHFHEQ-LJQANCHMSA-N 0 3 423.326 4.410 20 0 HIADHN CN1CCN([C@H](CNCc2csc(-c3ccc(F)cc3)n2)c2cccs2)CC1 ZINC000022742545 846613439 /nfs/dbraw/zinc/61/34/39/846613439.db2.gz QIRPRYQRYKOAJT-LJQANCHMSA-N 0 3 416.591 4.089 20 0 HIADHN Cc1c(C(=O)NC[C@@H](c2ccccc2)N(C)C)cnn1-c1cccc(C(F)(F)F)c1 ZINC000022990461 846645827 /nfs/dbraw/zinc/64/58/27/846645827.db2.gz NSEWITJYJZFENV-FQEVSTJZSA-N 0 3 416.447 4.232 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)c1ccc(OCc2cccnc2)cc1 ZINC000023114205 846660464 /nfs/dbraw/zinc/66/04/64/846660464.db2.gz ZKZODDWATUZOFY-XMMPIXPASA-N 0 3 401.510 4.228 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)[C@H](C)Oc3ccc(Cl)cc3)c(C)c2)CC1 ZINC000023295028 846682296 /nfs/dbraw/zinc/68/22/96/846682296.db2.gz QNCDXFMEIKLKMS-KRWDZBQOSA-N 0 3 401.938 4.196 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)N[C@H]1C[C@H](c2ccccc2F)C1 ZINC000436369901 861708734 /nfs/dbraw/zinc/70/87/34/861708734.db2.gz ZBFPLKCCQXGPPW-KESTWPANSA-N 0 3 413.562 4.485 20 0 HIADHN O=C(CN1CCCCCC1)Nc1cccc(NC(=O)c2c[nH]nc2-c2ccsc2)c1 ZINC000436375339 861715908 /nfs/dbraw/zinc/71/59/08/861715908.db2.gz XWYZPSLXBQSYQV-UHFFFAOYSA-N 0 3 423.542 4.205 20 0 HIADHN CC(C)C(=O)NCCNCc1cn(Cc2ccccc2)nc1-c1cc2ccccc2o1 ZINC000024082112 846786850 /nfs/dbraw/zinc/78/68/50/846786850.db2.gz HPVHNVFYVUQXKU-UHFFFAOYSA-N 0 3 416.525 4.206 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)c1ccc(OCc2cccnc2)cc1 ZINC000024556169 846837464 /nfs/dbraw/zinc/83/74/64/846837464.db2.gz YKDSVYRQHLRMFY-OAQYLSRUSA-N 0 3 407.539 4.289 20 0 HIADHN Cc1nc(Cc2ccccc2)sc1C(=O)NCCCN1CCc2ccccc2C1 ZINC000025015186 846905508 /nfs/dbraw/zinc/90/55/08/846905508.db2.gz WDHDVASFTZJYLE-UHFFFAOYSA-N 0 3 405.567 4.221 20 0 HIADHN O[C@H](COc1cccc2ccccc21)CN1CCC[C@@H]1c1ccc2c(c1)OCCO2 ZINC000025227916 846944883 /nfs/dbraw/zinc/94/48/83/846944883.db2.gz MATOZGQGACRICZ-RBBKRZOGSA-N 0 3 405.494 4.188 20 0 HIADHN CN(C)[C@@H](CNC(=O)c1cnn(-c2ccc(F)cc2)c1C(F)(F)F)c1ccccc1 ZINC000025238906 846946551 /nfs/dbraw/zinc/94/65/51/846946551.db2.gz OREMSAJRMOGJAQ-SFHVURJKSA-N 0 3 420.410 4.063 20 0 HIADHN CC(C)(CNC(=O)Cc1csc(-c2ccccc2)n1)N1CCc2ccccc2C1 ZINC000025459618 846981428 /nfs/dbraw/zinc/98/14/28/846981428.db2.gz LVNYQGOSKGZEDX-UHFFFAOYSA-N 0 3 405.567 4.306 20 0 HIADHN CC(C)(CNC(=O)Cc1csc(-c2cccs2)n1)N1CCc2ccccc2C1 ZINC000025462379 846981508 /nfs/dbraw/zinc/98/15/08/846981508.db2.gz FSCRQEACAYEGRU-UHFFFAOYSA-N 0 3 411.596 4.367 20 0 HIADHN CC(C)[C@@H](CNC(=O)c1ccc(F)cc1Br)N1CCc2ccccc2C1 ZINC000025537628 846996411 /nfs/dbraw/zinc/99/64/11/846996411.db2.gz MTZFAWCULKORTG-HXUWFJFHSA-N 0 3 419.338 4.401 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)c1cccc(NC(=O)c2ccc(F)cc2)c1 ZINC000025855947 847046695 /nfs/dbraw/zinc/04/66/95/847046695.db2.gz LKOJYSYWJVEGHU-UHFFFAOYSA-N 0 3 421.472 4.401 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1nc(-c2ccccc2)oc1C)c1cccc(OC)c1 ZINC000025858404 847047119 /nfs/dbraw/zinc/04/71/19/847047119.db2.gz ZCRMLFDUYOPZDW-OAQYLSRUSA-N 0 3 407.514 4.472 20 0 HIADHN COCc1ccccc1CNC(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1 ZINC000026146016 847096290 /nfs/dbraw/zinc/09/62/90/847096290.db2.gz ZGGLDBUMOJUGQH-FQEVSTJZSA-N 0 3 401.576 4.167 20 0 HIADHN Cc1cc(C)n(-c2ccc(CN3CCC(NC(=O)c4ccc(F)cc4)CC3)cc2)n1 ZINC000026169948 847098883 /nfs/dbraw/zinc/09/88/83/847098883.db2.gz UYNMDMACXJZECA-UHFFFAOYSA-N 0 3 406.505 4.023 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cnn(-c4ccccc4F)c3C)c(C)c2)CC1 ZINC000026251997 847112145 /nfs/dbraw/zinc/11/21/45/847112145.db2.gz PATBKWUNTOTXEM-UHFFFAOYSA-N 0 3 421.520 4.022 20 0 HIADHN COc1ccc(OC)c([C@H](C)NC[C@@H](O)COc2ccc(Cl)cc2Cl)c1 ZINC000026715109 847188912 /nfs/dbraw/zinc/18/89/12/847188912.db2.gz LKRSTEDFWBORRU-GXTWGEPZSA-N 0 3 400.302 4.101 20 0 HIADHN CC(C)N1CCc2nc(CNCCc3cn(C)c4cc(Cl)ccc34)sc2C1 ZINC000436412333 861762715 /nfs/dbraw/zinc/76/27/15/861762715.db2.gz RYBUATANYLRDOV-UHFFFAOYSA-N 0 3 402.995 4.387 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)c3c(F)cccc3Cl)CC2)c1 ZINC000026961862 847227788 /nfs/dbraw/zinc/22/77/88/847227788.db2.gz PVWADVZFTUBLOP-UHFFFAOYSA-N 0 3 403.929 4.120 20 0 HIADHN COc1cccc([C@H](CNC(=O)Cc2ccc(C(F)(F)F)cc2)N2CCCC2)c1 ZINC000027342304 847286541 /nfs/dbraw/zinc/28/65/41/847286541.db2.gz ZBPXCRLDLKXDRT-FQEVSTJZSA-N 0 3 406.448 4.210 20 0 HIADHN C[C@H](CN1CCCCC1)NC(=O)c1ccccc1SCc1cn2ccccc2n1 ZINC000027763915 847348815 /nfs/dbraw/zinc/34/88/15/847348815.db2.gz HEGSANNIRDUJMC-GOSISDBHSA-N 0 3 408.571 4.231 20 0 HIADHN CN(CCC(=O)Nc1ccc(N2CCOCC2)cc1)Cc1ccc(Cl)c(Cl)c1 ZINC000028895469 847474438 /nfs/dbraw/zinc/47/44/38/847474438.db2.gz HGCXSQRRTARPNN-UHFFFAOYSA-N 0 3 422.356 4.291 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CNC(=O)CN[C@H](c1ccc(F)cc1)C(C)C ZINC000029117411 847509348 /nfs/dbraw/zinc/50/93/48/847509348.db2.gz ZWEMHHWGYOYAGP-VWLOTQADSA-N 0 3 422.548 4.290 20 0 HIADHN CN(C)Cc1cccc(NC(=O)c2ccccc2OCc2cn3ccccc3n2)c1 ZINC000029173741 847518835 /nfs/dbraw/zinc/51/88/35/847518835.db2.gz OSRLOEYTVQFXMA-UHFFFAOYSA-N 0 3 400.482 4.227 20 0 HIADHN COc1cc(C(=O)NC[C@@H](C(C)C)N2CCc3ccccc3C2)ccc1OC(F)F ZINC000029174044 847518978 /nfs/dbraw/zinc/51/89/78/847518978.db2.gz JOMGSBDCXWNQNT-IBGZPJMESA-N 0 3 418.484 4.109 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)c1cc(Cl)c2c(c1)OCCCO2 ZINC000029178472 847520432 /nfs/dbraw/zinc/52/04/32/847520432.db2.gz UQKKYHPFYNHSAR-IBGZPJMESA-N 0 3 400.906 4.068 20 0 HIADHN O=C(CCc1nc(-c2ccc(Cl)cc2)no1)N[C@H](CN1CCCC1)c1ccccc1 ZINC000029178599 847520865 /nfs/dbraw/zinc/52/08/65/847520865.db2.gz FZFOOWKHOZEVTP-HXUWFJFHSA-N 0 3 424.932 4.276 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)c1cc2ccc(Br)cc2[nH]1 ZINC000029370472 847554473 /nfs/dbraw/zinc/55/44/73/847554473.db2.gz DRQBLNJVQFAQQE-UHFFFAOYSA-N 0 3 422.392 4.022 20 0 HIADHN COc1ccc(CCNC(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)cc1 ZINC000029655171 847598450 /nfs/dbraw/zinc/59/84/50/847598450.db2.gz BFUAHGRHQRSULV-FQEVSTJZSA-N 0 3 401.576 4.072 20 0 HIADHN CC(C)C(=O)Nc1ccc(C(=O)NC[C@H](C(C)C)N2CCc3ccccc3C2)cc1 ZINC000029666128 847599799 /nfs/dbraw/zinc/59/97/99/847599799.db2.gz JHYBUVCEYUZWOQ-HSZRJFAPSA-N 0 3 407.558 4.094 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Cc3c(C)nc4ccccc4c3C)cc2)CC1 ZINC000029798677 847621183 /nfs/dbraw/zinc/62/11/83/847621183.db2.gz VCAJEVWAKRHEQK-UHFFFAOYSA-N 0 3 402.542 4.175 20 0 HIADHN CCc1c(C(=O)Nc2ccc(N3CCN(CC)CC3)cc2)cnn1-c1ccc(C)cc1 ZINC000029799004 847621939 /nfs/dbraw/zinc/62/19/39/847621939.db2.gz UOEZXHKBBGQJJP-UHFFFAOYSA-N 0 3 417.557 4.137 20 0 HIADHN CN1CCN(CCCNC(=O)c2cccc(Cl)c2Cl)[C@@H](c2ccccc2)C1 ZINC000030000178 847667659 /nfs/dbraw/zinc/66/76/59/847667659.db2.gz KNPPNMFNYNKRRW-LJQANCHMSA-N 0 3 406.357 4.102 20 0 HIADHN Clc1cccc(N2CCOCC2)c1CN1CC[C@@H](COCc2ccccc2)C1 ZINC000436471617 861817062 /nfs/dbraw/zinc/81/70/62/861817062.db2.gz PJJIVWIOMFGWDF-HXUWFJFHSA-N 0 3 400.950 4.215 20 0 HIADHN C[C@@H](NCc1cccc(COCc2ccco2)c1)C(=O)Nc1ccc(N(C)C)cc1 ZINC000030511179 847725874 /nfs/dbraw/zinc/72/58/74/847725874.db2.gz NYCAVEZHEAXAAP-GOSISDBHSA-N 0 3 407.514 4.179 20 0 HIADHN COc1cc(CNCc2ccc(N3CCCC3=O)cc2)ccc1OCc1ccncc1 ZINC000030628567 847747578 /nfs/dbraw/zinc/74/75/78/847747578.db2.gz ZBXHNGVLJPQEHP-UHFFFAOYSA-N 0 3 417.509 4.086 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2CNCc2cccnc2-n2ccnc2)o1 ZINC000030902494 847795940 /nfs/dbraw/zinc/79/59/40/847795940.db2.gz QOQJPNHDLMCTHT-UHFFFAOYSA-N 0 3 410.481 4.311 20 0 HIADHN COc1c(Br)cc(Br)cc1CNCCc1ccc(C)o1 ZINC000030917234 847798270 /nfs/dbraw/zinc/79/82/70/847798270.db2.gz IESFKRNSBSSCGC-UHFFFAOYSA-N 0 3 403.114 4.454 20 0 HIADHN CC[C@H](NC(=O)NCCCN1CCc2ccccc2C1)c1ccccc1OC(F)F ZINC000031123546 847826441 /nfs/dbraw/zinc/82/64/41/847826441.db2.gz WPHGCPWOCSMPOM-FQEVSTJZSA-N 0 3 417.500 4.487 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)c1ccccc1COc1ccccc1 ZINC000031958073 847970701 /nfs/dbraw/zinc/97/07/01/847970701.db2.gz WDQRCNITUZIAKM-UHFFFAOYSA-N 0 3 410.583 4.357 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cccc(OC[C@@H]2CCCO2)c1)c1ccsc1 ZINC000031984517 847974683 /nfs/dbraw/zinc/97/46/83/847974683.db2.gz IMQOHKZDSFAFTM-SFTDATJTSA-N 0 3 402.560 4.119 20 0 HIADHN CCN(CC)[C@H](CNC(=O)CCc1c(C)nc(SC)nc1C)c1ccsc1 ZINC000031986416 847975599 /nfs/dbraw/zinc/97/55/99/847975599.db2.gz WMBTUFJCOKOJPF-GOSISDBHSA-N 0 3 406.621 4.009 20 0 HIADHN Cc1c2ccccc2oc1C(=O)NCCCCN1CCN(c2cccc(C)c2)CC1 ZINC000032068306 847985053 /nfs/dbraw/zinc/98/50/53/847985053.db2.gz ZMLOFNNOMJXBIW-UHFFFAOYSA-N 0 3 405.542 4.382 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)c3ccc(F)cc3Cl)CC2)c1 ZINC000032067374 847985277 /nfs/dbraw/zinc/98/52/77/847985277.db2.gz APZQFZSAKKMCEC-UHFFFAOYSA-N 0 3 403.929 4.120 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)c2ccc(C)c(NC(=O)c3ccco3)c2)N(C)C)cc1 ZINC000032246195 847994893 /nfs/dbraw/zinc/99/48/93/847994893.db2.gz VOCZUZVEYIVUOR-JOCHJYFZSA-N 0 3 419.525 4.435 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)c2ccc(Cl)c(N3CCCC3=O)c2)N(C)C)cc1 ZINC000032733593 848068989 /nfs/dbraw/zinc/06/89/89/848068989.db2.gz BUWHRSIWSPKCMI-OAQYLSRUSA-N 0 3 413.949 4.062 20 0 HIADHN CC1CCN([C@@H](CNC(=O)c2ccc(NC(=O)C3CC3)cc2)c2cccs2)CC1 ZINC000036684664 848155243 /nfs/dbraw/zinc/15/52/43/848155243.db2.gz GFFWCCOBCLVLIZ-FQEVSTJZSA-N 0 3 411.571 4.300 20 0 HIADHN CC(=O)Nc1ccc(NC(=S)NC[C@@H](c2cccs2)N2CCC(C)CC2)cc1 ZINC000041726479 848241025 /nfs/dbraw/zinc/24/10/25/848241025.db2.gz RONGOAMPCFQVMJ-IBGZPJMESA-N 0 3 416.616 4.466 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=S)Nc3ccccc3F)CC2)c1 ZINC000041741255 848242197 /nfs/dbraw/zinc/24/21/97/848242197.db2.gz RXDRLHMZGUMEPC-UHFFFAOYSA-N 0 3 400.567 4.023 20 0 HIADHN COc1ccc(C2=NN(C(=O)CN([C@H](C)C3CC3)C3CC3)[C@H](c3ccco3)C2)cc1 ZINC000042123202 848289426 /nfs/dbraw/zinc/28/94/26/848289426.db2.gz FMMUKNIZPOCJEL-ZHRRBRCNSA-N 0 3 407.514 4.229 20 0 HIADHN COc1ccc(CN[C@H](C)c2ccc3c(c2)OCCO3)cc1OCc1cccnc1 ZINC000042186438 848298533 /nfs/dbraw/zinc/29/85/33/848298533.db2.gz QVMOPYPKYGAWAX-QGZVFWFLSA-N 0 3 406.482 4.291 20 0 HIADHN Cc1ccc(C)n1-c1nc(CC(=O)NC[C@H](c2cccs2)N2CCCC2)cs1 ZINC000042378924 848322358 /nfs/dbraw/zinc/32/23/58/848322358.db2.gz YTXAUXXWKMKAPW-GOSISDBHSA-N 0 3 414.600 4.108 20 0 HIADHN CCOc1cc(NC(=O)NC[C@H](c2ccc(OC)cc2)N2CCCC2)ccc1OC ZINC000043111313 848385419 /nfs/dbraw/zinc/38/54/19/848385419.db2.gz CROUPLJARRRAOE-HXUWFJFHSA-N 0 3 413.518 4.061 20 0 HIADHN CCOc1cc(NC(=O)NC[C@@H](c2cccc(OC)c2)N2CCCC2)ccc1OC ZINC000043306871 848407816 /nfs/dbraw/zinc/40/78/16/848407816.db2.gz ZTEBMZOALHGHFV-FQEVSTJZSA-N 0 3 413.518 4.061 20 0 HIADHN CSc1ccccc1NC(=O)NCCCCN1CCN(c2cccc(C)c2)CC1 ZINC000043318274 848408810 /nfs/dbraw/zinc/40/88/10/848408810.db2.gz JZAYGIQEGXCIQT-UHFFFAOYSA-N 0 3 412.603 4.441 20 0 HIADHN Cc1c(F)cccc1-c1ccc(C[NH2+]C2CCN(C(=O)c3ccccc3[O-])CC2)o1 ZINC000436711645 861900609 /nfs/dbraw/zinc/90/06/09/861900609.db2.gz JQUGTHMQSTVQPO-UHFFFAOYSA-N 0 3 408.473 4.494 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1cc(OC)c(OC)cc1C)c1cccc(OC)c1 ZINC000043404670 848418794 /nfs/dbraw/zinc/41/87/94/848418794.db2.gz LQEDAHLBHSHWDG-FQEVSTJZSA-N 0 3 415.534 4.225 20 0 HIADHN CC1CCN([C@H](CNC(=O)Nc2ccc(C(=O)N(C)C)cc2)c2cccs2)CC1 ZINC000043487402 848429434 /nfs/dbraw/zinc/42/94/34/848429434.db2.gz JJZZTALYVPXORC-LJQANCHMSA-N 0 3 414.575 4.045 20 0 HIADHN CC(C)(CNC(=O)c1ccc(OCc2cccnc2)cc1)N1CCc2ccccc2C1 ZINC000043750914 848460376 /nfs/dbraw/zinc/46/03/76/848460376.db2.gz NOYRBDHAAQGPKA-UHFFFAOYSA-N 0 3 415.537 4.227 20 0 HIADHN Cc1ccccc1CN1CCCN(C(=O)Nc2cccc(NC(=O)C3CC3)c2)CC1 ZINC000044101809 848515081 /nfs/dbraw/zinc/51/50/81/848515081.db2.gz AGGLEUGOCFLZKZ-UHFFFAOYSA-N 0 3 406.530 4.083 20 0 HIADHN COCCOc1ccc(NC(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)cc1 ZINC000044301049 848541504 /nfs/dbraw/zinc/54/15/04/848541504.db2.gz ZQEDZQOZPZMJLA-HXUWFJFHSA-N 0 3 417.575 4.368 20 0 HIADHN CC(=O)Nc1cc(C(=O)N[C@H](CN2CCc3ccccc3C2)C(C)(C)C)ccc1C ZINC000044770438 848599765 /nfs/dbraw/zinc/59/97/65/848599765.db2.gz YIZMUNPMURILGA-HSZRJFAPSA-N 0 3 407.558 4.156 20 0 HIADHN C[C@H](c1nc2ccccc2s1)N(C)C(=O)NCCCN1CCc2ccccc2C1 ZINC000046428634 848847284 /nfs/dbraw/zinc/84/72/84/848847284.db2.gz MMJIKRWJDLCHSJ-QGZVFWFLSA-N 0 3 408.571 4.447 20 0 HIADHN CCc1ccc([C@H](CNC(=O)Cc2csc(Cc3ccccc3)n2)N(C)C)cc1 ZINC000046699507 848914369 /nfs/dbraw/zinc/91/43/69/848914369.db2.gz WHTXRUGWYQHFSU-QFIPXVFZSA-N 0 3 407.583 4.258 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1ccc2nc(C)c(C)nc2c1)c1cccc(OC)c1 ZINC000046729643 848920389 /nfs/dbraw/zinc/92/03/89/848920389.db2.gz SHEDSHVEHRGGHK-QHCPKHFHSA-N 0 3 406.530 4.068 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cnn(-c2ccccc2C)c1C)c1cccc(OC)c1 ZINC000046729560 848920755 /nfs/dbraw/zinc/92/07/55/848920755.db2.gz HOFCUEXRZMJXPA-XMMPIXPASA-N 0 3 420.557 4.311 20 0 HIADHN Cc1ccccc1CN1CCCN(C(=O)NCc2ncc(-c3ccccc3)o2)CC1 ZINC000047041862 848975814 /nfs/dbraw/zinc/97/58/14/848975814.db2.gz KHYABNROLXVTQJ-UHFFFAOYSA-N 0 3 404.514 4.068 20 0 HIADHN CC(C)n1ncc2c1nc(C1CC1)cc2C(=O)N(CCc1ccccc1)CCN(C)C ZINC000047224511 849007195 /nfs/dbraw/zinc/00/71/95/849007195.db2.gz BTJMFHZIAWMXOI-UHFFFAOYSA-N 0 3 419.573 4.136 20 0 HIADHN CC(C)(C)n1ncc(C(=O)NC2CCN(Cc3ccccc3)CC2)c1C(F)(F)F ZINC000047330705 849026795 /nfs/dbraw/zinc/02/67/95/849026795.db2.gz UYGWFQKMEUWGAP-UHFFFAOYSA-N 0 3 408.468 4.051 20 0 HIADHN O=C(c1ccccc1[O-])N1CCC([NH2+][C@H]2CCc3sc(Br)cc32)CC1 ZINC000436783264 861976094 /nfs/dbraw/zinc/97/60/94/861976094.db2.gz LNVHJULOKCKZKQ-HNNXBMFYSA-N 0 3 421.360 4.098 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1cccc(C(=O)NC(C)(C)C)c1)c1ccsc1 ZINC000047587281 849079397 /nfs/dbraw/zinc/07/93/97/849079397.db2.gz AEBWHTBKCBAJFG-LJQANCHMSA-N 0 3 416.591 4.481 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)NC[C@@H](c1ccco1)N1CCCCC1 ZINC000047777564 849109872 /nfs/dbraw/zinc/10/98/72/849109872.db2.gz PMKQBBFCPCYNNA-OALUTQOASA-N 0 3 416.591 4.004 20 0 HIADHN O=C(NC[C@H](c1ccco1)N1CCCCC1)NC[C@@H](c1cccs1)N1CCCC1 ZINC000047777563 849110001 /nfs/dbraw/zinc/11/00/01/849110001.db2.gz PMKQBBFCPCYNNA-MOPGFXCFSA-N 0 3 416.591 4.004 20 0 HIADHN COc1cc(CN[C@@H](C)c2ccc3c(c2)CCC(=O)N3)ccc1OCc1ccncc1 ZINC000047826670 849123778 /nfs/dbraw/zinc/12/37/78/849123778.db2.gz QQYXESNBMBEUGL-KRWDZBQOSA-N 0 3 417.509 4.405 20 0 HIADHN O=C(NCc1ccc(Br)s1)NC[C@@H](c1cccs1)N1CCCC1 ZINC000047956532 849143913 /nfs/dbraw/zinc/14/39/13/849143913.db2.gz ULHOXOBLWBTXSJ-ZDUSSCGKSA-N 0 3 414.394 4.208 20 0 HIADHN CCOc1ccc([C@H](C)NC(=O)NC[C@H](c2cccs2)N2CCCC2)cc1OC ZINC000047956431 849144177 /nfs/dbraw/zinc/14/41/77/849144177.db2.gz YQLGQGKLCSFWSV-FUHWJXTLSA-N 0 3 417.575 4.353 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(Cl)c1CNC1CCN(Cc2ccccn2)CC1 ZINC000048716740 849258929 /nfs/dbraw/zinc/25/89/29/849258929.db2.gz ZLSFMMUAKAXIOH-UHFFFAOYSA-N 0 3 413.928 4.122 20 0 HIADHN O=C(NCCNCc1cn(-c2ccccc2)nc1-c1cccs1)c1cccs1 ZINC000048715797 849259207 /nfs/dbraw/zinc/25/92/07/849259207.db2.gz QIIWJERCLGNIRN-UHFFFAOYSA-N 0 3 408.552 4.182 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(Cl)c1CNC1CCN(Cc2ccncc2)CC1 ZINC000048747997 849263441 /nfs/dbraw/zinc/26/34/41/849263441.db2.gz XCZVXNMCXZVGNT-UHFFFAOYSA-N 0 3 413.928 4.122 20 0 HIADHN C[C@@H](NCc1ccc(SC(F)(F)F)cc1)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000048780532 849266992 /nfs/dbraw/zinc/26/69/92/849266992.db2.gz HJXOHXAFSGYBHG-CYBMUJFWSA-N 0 3 418.506 4.400 20 0 HIADHN C[C@H](SCC(=O)Nc1ccc(F)cc1)C(=O)C(C#N)c1nc2ccccc2s1 ZINC000048823176 849271473 /nfs/dbraw/zinc/27/14/73/849271473.db2.gz GSWYRTALEXPYOU-SWLSCSKDSA-N 0 3 413.499 4.372 20 0 HIADHN Cc1cc([C@@H]2CCCN2C(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)no1 ZINC000049790415 849329686 /nfs/dbraw/zinc/32/96/86/849329686.db2.gz NNEUMGNOCLCOKU-OALUTQOASA-N 0 3 402.564 4.364 20 0 HIADHN CCOc1ccc([C@@H](C)[NH2+]C2CCN(C(=O)c3ccccc3[O-])CC2)cc1OCC ZINC000436825346 862007112 /nfs/dbraw/zinc/00/71/12/862007112.db2.gz DCTOMHUSSMSJKU-QGZVFWFLSA-N 0 3 412.530 4.145 20 0 HIADHN COc1cc(NC(=O)CN[C@H](c2ccc(Cl)cc2)C2CC2)cc(OC)c1OC ZINC000050273592 849366778 /nfs/dbraw/zinc/36/67/78/849366778.db2.gz TTWUOSICICPABV-FQEVSTJZSA-N 0 3 404.894 4.045 20 0 HIADHN O=C(c1ccccc1[O-])N1CCC([NH2+][C@@H]2CCc3ccc(OC(F)(F)F)cc32)CC1 ZINC000436831892 862012028 /nfs/dbraw/zinc/01/20/28/862012028.db2.gz UKWALSJBEPBLGS-LJQANCHMSA-N 0 3 420.431 4.173 20 0 HIADHN CCOc1ccc(CN(C)C(=O)CN(C)C[C@@H]2CCCO[C@@H]2c2ccccc2)cc1 ZINC000051133541 849435898 /nfs/dbraw/zinc/43/58/98/849435898.db2.gz SHYOISOPPDVBAA-WIOPSUGQSA-N 0 3 410.558 4.143 20 0 HIADHN CSc1ccc(CN(C)C(=O)CN(C)C[C@H]2CCCO[C@@H]2c2ccccc2)cc1 ZINC000051582028 849486159 /nfs/dbraw/zinc/48/61/59/849486159.db2.gz LKFXMENTMHHOGR-ZJSXRUAMSA-N 0 3 412.599 4.467 20 0 HIADHN N#CC(C(=O)CCCNc1ccc([N+](=O)[O-])cc1)c1nc2ccccc2n1C(F)F ZINC000051655915 849499152 /nfs/dbraw/zinc/49/91/52/849499152.db2.gz FLXXPXAHMVACFR-HNNXBMFYSA-N 0 3 413.384 4.408 20 0 HIADHN O=C(Nc1cc(Cl)ccc1[O-])C1CC[NH+](CCCOCCc2ccccc2)CC1 ZINC000053039182 849657342 /nfs/dbraw/zinc/65/73/42/849657342.db2.gz GPSGARVRLJAAFB-UHFFFAOYSA-N 0 3 416.949 4.346 20 0 HIADHN Brc1ccc([C@H](NCc2cnc(N3CCCC3)nc2)C2CCC2)cc1 ZINC000054178177 849822084 /nfs/dbraw/zinc/82/20/84/849822084.db2.gz VAMUBEYJSJMKSL-LJQANCHMSA-N 0 3 401.352 4.470 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)Cc2csc(Cc3ccccc3)n2)C1 ZINC000054223274 849829013 /nfs/dbraw/zinc/82/90/13/849829013.db2.gz GFOPGTYNMRGCFE-NQIIRXRSSA-N 0 3 405.567 4.228 20 0 HIADHN CC(=O)Nc1ccc(Cl)c(NC(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)c1 ZINC000054446259 849869191 /nfs/dbraw/zinc/86/91/91/849869191.db2.gz XZNVYPPWPOBNQA-KSSFIOAISA-N 0 3 400.910 4.255 20 0 HIADHN COCCCOc1ccccc1NC(=O)N1CCCN(Cc2ccccc2C)CC1 ZINC000054470658 849872335 /nfs/dbraw/zinc/87/23/35/849872335.db2.gz JERUHZHEHAUTMZ-UHFFFAOYSA-N 0 3 411.546 4.150 20 0 HIADHN Cc1ccc(Nc2nn(CN3CCN(CC4CC4)CC3)c(=S)s2)cc1Cl ZINC000054551327 849887298 /nfs/dbraw/zinc/88/72/98/849887298.db2.gz UCQCPRBGVGHFHQ-UHFFFAOYSA-N 0 3 410.012 4.365 20 0 HIADHN Cc1cc(NC(=O)C2CCN(Cc3c(-c4ccccc4)nc4ccccn43)CC2)no1 ZINC000054640499 849898584 /nfs/dbraw/zinc/89/85/84/849898584.db2.gz ORGZDIYQQUXQLZ-UHFFFAOYSA-N 0 3 415.497 4.148 20 0 HIADHN Cc1cc(C)cc(C(=O)N2CCC[C@@H](C(=O)C(C#N)c3nc4ccccc4o3)C2)c1 ZINC000054735690 849914874 /nfs/dbraw/zinc/91/48/74/849914874.db2.gz RMLTXMHRQSORGX-IEBWSBKVSA-N 0 3 401.466 4.173 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=S)Nc1cccc(Br)c1 ZINC000054959539 849948390 /nfs/dbraw/zinc/94/83/90/849948390.db2.gz YMADSZNQTCEFTL-UHFFFAOYSA-N 0 3 410.356 4.349 20 0 HIADHN C[N@H+](Cc1ccccc1CNC(=O)c1cc(=O)c2ccccc2[n-]1)C1CCCCC1 ZINC000056135422 850250645 /nfs/dbraw/zinc/25/06/45/850250645.db2.gz NWILDBFRBAJEMN-UHFFFAOYSA-N 0 3 403.526 4.223 20 0 HIADHN C[N@@H+](Cc1ccccc1CNC(=O)c1cc(=O)c2ccccc2[n-]1)C1CCCCC1 ZINC000056135422 850250659 /nfs/dbraw/zinc/25/06/59/850250659.db2.gz NWILDBFRBAJEMN-UHFFFAOYSA-N 0 3 403.526 4.223 20 0 HIADHN CCOc1ccc(NC(=O)[C@H](C)N[C@@H](C)c2ccc(NC(=O)NC3CC3)cc2)cc1 ZINC000056159752 850263000 /nfs/dbraw/zinc/26/30/00/850263000.db2.gz IQQJRYMCUZRKFB-HOTGVXAUSA-N 0 3 410.518 4.047 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)N2CCN(CCC(C)(C)C)CC2)c(C(F)(F)F)c1 ZINC000056586458 850402482 /nfs/dbraw/zinc/40/24/82/850402482.db2.gz LWEZUPHRDPZOMS-UHFFFAOYSA-N 0 3 414.472 4.250 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)N[C@H](c1ccccc1)c1ccccn1 ZINC000056797062 850486031 /nfs/dbraw/zinc/48/60/31/850486031.db2.gz SDXQJYJOMUKWHB-HSZRJFAPSA-N 0 3 406.505 4.084 20 0 HIADHN CN(C)Cc1cccc(NC(=O)N[C@@H](C(=O)Nc2ccccc2)c2ccccc2)c1 ZINC000057089263 850546481 /nfs/dbraw/zinc/54/64/81/850546481.db2.gz LGOMFAFXRRZGDQ-JOCHJYFZSA-N 0 3 402.498 4.250 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N[C@H](c1ccc(F)cc1)[C@@H]1CCCO1 ZINC000057197667 850577849 /nfs/dbraw/zinc/57/78/49/850577849.db2.gz KVNGTLKPYGYVPA-SVFBPWRDSA-N 0 3 417.550 4.244 20 0 HIADHN CCN1CCC[C@@H]1CNC(=O)[C@@H](C)SCc1ncc(-c2ccc(Cl)cc2)o1 ZINC000057382157 850621618 /nfs/dbraw/zinc/62/16/18/850621618.db2.gz DKZRMFOKIRCDSE-RHSMWYFYSA-N 0 3 407.967 4.217 20 0 HIADHN COc1cc(-c2nnc(SCCN(C)C)n2C2CCCCC2)cc(OC)c1OC ZINC000057502276 850654019 /nfs/dbraw/zinc/65/40/19/850654019.db2.gz SHDCXZKHBIPLQH-UHFFFAOYSA-N 0 3 420.579 4.130 20 0 HIADHN Cc1ccc(NC(=O)C2CC2)cc1NC(=O)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000057543453 850664628 /nfs/dbraw/zinc/66/46/28/850664628.db2.gz WEINREOTCFRHCY-QFIPXVFZSA-N 0 3 406.530 4.302 20 0 HIADHN CCc1ccc([C@H](CNC(=O)Nc2nnc(-c3ccsc3)s2)N(C)C)cc1 ZINC000057788893 850716987 /nfs/dbraw/zinc/71/69/87/850716987.db2.gz FNZMHEDELHCYSL-INIZCTEOSA-N 0 3 401.561 4.253 20 0 HIADHN CN(C)[C@H](CNC(=O)N(CCc1ccccc1)Cc1cccnc1)c1ccccc1 ZINC000057791406 850717526 /nfs/dbraw/zinc/71/75/26/850717526.db2.gz KCFOIYWRXPZPAI-XMMPIXPASA-N 0 3 402.542 4.139 20 0 HIADHN Cc1cccc(N2CCN(CCCNCc3csc(-c4cccs4)n3)CC2)c1 ZINC000058178958 850777527 /nfs/dbraw/zinc/77/75/27/850777527.db2.gz CBPNZUGDSZBDEF-UHFFFAOYSA-N 0 3 412.628 4.482 20 0 HIADHN CN(C)CCN(C(=O)c1cnn(-c2ccc(Cl)cc2Cl)c1)c1ccccc1 ZINC000058296893 850795187 /nfs/dbraw/zinc/79/51/87/850795187.db2.gz UICPQWTYKCRSLP-UHFFFAOYSA-N 0 3 403.313 4.388 20 0 HIADHN COc1ccc(C(=O)CCCC(=O)NC2CCN(Cc3ccccc3C)CC2)cc1 ZINC000058400410 850816170 /nfs/dbraw/zinc/81/61/70/850816170.db2.gz COPYRFUTUNNBOC-UHFFFAOYSA-N 0 3 408.542 4.137 20 0 HIADHN CCC[C@H](CNC(=O)CN(C[C@@H]1CCOC1)C1CC1)c1ccc(Cl)cc1Cl ZINC000058591963 850863550 /nfs/dbraw/zinc/86/35/50/850863550.db2.gz FWPXYTWWCRNDAJ-JKSUJKDBSA-N 0 3 413.389 4.494 20 0 HIADHN Cc1c2cc(Cl)ccc2oc1C(=O)Nc1ccc2oc(=O)n(CCN(C)C)c2c1 ZINC000058739482 850908551 /nfs/dbraw/zinc/90/85/51/850908551.db2.gz KTSLNGHKEFZRGN-UHFFFAOYSA-N 0 3 413.861 4.116 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)C(C)(C)c3ccccc3C)CC2)c1 ZINC000058797124 850929747 /nfs/dbraw/zinc/92/97/47/850929747.db2.gz WGPSUTPONDRXEK-UHFFFAOYSA-N 0 3 407.602 4.300 20 0 HIADHN Cc1ccc(-c2cnc(CCC(=O)N(CCN(C)C)Cc3ccccc3F)o2)cc1 ZINC000058991078 850975011 /nfs/dbraw/zinc/97/50/11/850975011.db2.gz NAXQRQQNOJZOSY-UHFFFAOYSA-N 0 3 409.505 4.312 20 0 HIADHN NC(=O)C1CCN(Cc2cccc(NC(=O)c3cc(F)c(Cl)cc3Cl)c2)CC1 ZINC000059257430 850989268 /nfs/dbraw/zinc/98/92/68/850989268.db2.gz TXCUNMMPLVWWCY-UHFFFAOYSA-N 0 3 424.303 4.082 20 0 HIADHN CC1CCN([C@@H](CNC(=O)N2CCC[C@H]2c2cccn2C)c2cccs2)CC1 ZINC000059264381 850989353 /nfs/dbraw/zinc/98/93/53/850989353.db2.gz YNPBKQDMAPCHSF-PMACEKPBSA-N 0 3 400.592 4.406 20 0 HIADHN O=C(CN(Cc1ccccc1)C1CCCCC1)Nc1ccc(CN2CCOCC2)cc1 ZINC000059350366 850999624 /nfs/dbraw/zinc/99/96/24/850999624.db2.gz HLUYNRCNKUXNLT-UHFFFAOYSA-N 0 3 421.585 4.292 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2cc3ccc(Br)cc3[nH]2)N(C)C)cc1 ZINC000060155824 851047235 /nfs/dbraw/zinc/04/72/35/851047235.db2.gz HRMJPBDAKUVVAD-LJQANCHMSA-N 0 3 400.320 4.272 20 0 HIADHN C[C@H](Oc1cccc(Cl)c1)C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000060221004 851053271 /nfs/dbraw/zinc/05/32/71/851053271.db2.gz NTCOYRFERRDRNP-INIZCTEOSA-N 0 3 404.963 4.337 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)[C@H]1C[C@H]1c1ccc(Br)cc1 ZINC000060300815 851060480 /nfs/dbraw/zinc/06/04/80/851060480.db2.gz UHOWWPCGVXRHMM-ROUUACIJSA-N 0 3 423.420 4.030 20 0 HIADHN CCc1c(C(=O)N2CCCN(CCCc3ccccc3)CC2)cnn1-c1ccccc1 ZINC000060355357 851075356 /nfs/dbraw/zinc/07/53/56/851075356.db2.gz DOVQMSRFQGXVOE-UHFFFAOYSA-N 0 3 416.569 4.215 20 0 HIADHN Cc1cccc(OC(F)F)c1NC(=O)c1ccc(N2CCN(C(C)C)CC2)cc1 ZINC000060365231 851079729 /nfs/dbraw/zinc/07/97/29/851079729.db2.gz SDMCTMCCMYXTPC-UHFFFAOYSA-N 0 3 403.473 4.379 20 0 HIADHN O=C(Nc1ccccc1C(=O)NCc1ccco1)c1cccc(CN2CCCC2)c1 ZINC000060551916 851144543 /nfs/dbraw/zinc/14/45/43/851144543.db2.gz WVHSHFUFRNIYES-UHFFFAOYSA-N 0 3 403.482 4.058 20 0 HIADHN O=C(c1cccc(CN2CCCC2)c1)N1CCN(Cc2c(F)cccc2Cl)CC1 ZINC000060562126 851148319 /nfs/dbraw/zinc/14/83/19/851148319.db2.gz DHSMYUMMZVLNHY-UHFFFAOYSA-N 0 3 415.940 4.033 20 0 HIADHN Cc1ccc(NC(=O)[C@H](C)N2CCN(CC3CCCCC3)CC2)c(Br)c1 ZINC000060569201 851150866 /nfs/dbraw/zinc/15/08/66/851150866.db2.gz AWJVDYYNUOYMII-KRWDZBQOSA-N 0 3 422.411 4.282 20 0 HIADHN COc1ccc(CN(C)C(=O)NC[C@H](c2ccccc2)N2CCC(C)CC2)cc1F ZINC000060630964 851173977 /nfs/dbraw/zinc/17/39/77/851173977.db2.gz XTVNZSKPIKHWKP-JOCHJYFZSA-N 0 3 413.537 4.449 20 0 HIADHN CN(C)[C@@H](CNC(=O)NCc1ccc(OCc2ccccc2)cc1)c1ccccc1 ZINC000060954481 851257653 /nfs/dbraw/zinc/25/76/53/851257653.db2.gz UKJBTZLRMZEKAQ-DEOSSOPVSA-N 0 3 403.526 4.368 20 0 HIADHN Cc1nn(-c2cccc(Cl)c2)c(Cl)c1CNC1CCN(CC(F)F)CC1 ZINC000060953625 851257874 /nfs/dbraw/zinc/25/78/74/851257874.db2.gz QGTYVYXKBNQEGN-UHFFFAOYSA-N 0 3 403.304 4.307 20 0 HIADHN Cc1ccc([C@H](CNC(=O)NCc2ccc(NC(=O)C(C)C)cc2)N2CCCC2)cc1 ZINC000060971891 851263552 /nfs/dbraw/zinc/26/35/52/851263552.db2.gz UDOFLMRPGLJADC-QHCPKHFHSA-N 0 3 422.573 4.226 20 0 HIADHN Cc1nn(Cc2ccccc2)c(Cl)c1CNC[C@@H](c1cccc(F)c1)N(C)C ZINC000061014942 851273102 /nfs/dbraw/zinc/27/31/02/851273102.db2.gz ZRHIXPLOSOTGNP-NRFANRHFSA-N 0 3 400.929 4.425 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)N3CCCCC[C@H]3c3ccncc3)cc2)CC1 ZINC000061160254 851307744 /nfs/dbraw/zinc/30/77/44/851307744.db2.gz CQDXVHHLYANCTR-DEOSSOPVSA-N 0 3 406.574 4.370 20 0 HIADHN COCc1cccc(CNC(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)c1 ZINC000061191186 851313763 /nfs/dbraw/zinc/31/37/63/851313763.db2.gz BFHQAGASUOKMCH-FQEVSTJZSA-N 0 3 401.576 4.167 20 0 HIADHN C[C@@H](NC(=O)NC[C@H](c1ccccc1)N1CCCC1)c1ccc(OC(F)F)cc1 ZINC000061229653 851323032 /nfs/dbraw/zinc/32/30/32/851323032.db2.gz GIOLKJKUEKTGSC-OXQOHEQNSA-N 0 3 403.473 4.485 20 0 HIADHN CCOC(=O)/C=C/c1ccc(NC(=O)NCC(C)(C)N2CCc3ccccc3C2)cc1 ZINC000061377066 851359792 /nfs/dbraw/zinc/35/97/92/851359792.db2.gz GZKVMNIFPWINFB-SDNWHVSQSA-N 0 3 421.541 4.221 20 0 HIADHN CC(=O)CCc1ccc(O[C@@H](C)C(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)cc1 ZINC000061502324 851390169 /nfs/dbraw/zinc/39/01/69/851390169.db2.gz RYYDEELEQYAUJL-OFVILXPXSA-N 0 3 422.569 4.237 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Cc2csc(-c3ccccn3)n2)N2CCCC2)cc1 ZINC000061503088 851390987 /nfs/dbraw/zinc/39/09/87/851390987.db2.gz QVCUPBOFLDZPLH-NRFANRHFSA-N 0 3 406.555 4.009 20 0 HIADHN CCN(CC)C(=O)c1cccc(NC(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)c1 ZINC000061747357 851437936 /nfs/dbraw/zinc/43/79/36/851437936.db2.gz LAAZNDGMEFZVEV-QHCPKHFHSA-N 0 3 422.573 4.436 20 0 HIADHN CCNC(=O)c1ccc(NC(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)c(C)c1 ZINC000061774513 851446629 /nfs/dbraw/zinc/44/66/29/851446629.db2.gz UMMANEQPBIWCIA-QFIPXVFZSA-N 0 3 408.546 4.012 20 0 HIADHN O=C(NCCCn1ccc2ccccc21)Nc1ccc(CCN2CCSCC2)cc1 ZINC000061793269 851455316 /nfs/dbraw/zinc/45/53/16/851455316.db2.gz XJORIWARZQQRHT-UHFFFAOYSA-N 0 3 422.598 4.444 20 0 HIADHN O=C(NCCCOC1CCCCC1)Nc1ccc(CCN2CCSCC2)cc1 ZINC000061792972 851455560 /nfs/dbraw/zinc/45/55/60/851455560.db2.gz VPCFYIQNMVUNPI-UHFFFAOYSA-N 0 3 405.608 4.139 20 0 HIADHN CC(C)(CNC(=O)C(=O)Nc1ccccc1Sc1ccccc1)N1CCCCC1 ZINC000061866017 851462798 /nfs/dbraw/zinc/46/27/98/851462798.db2.gz IHFWCWABURTKFF-UHFFFAOYSA-N 0 3 411.571 4.157 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)NCc3ccc(Cl)s3)CC2)c1 ZINC000061986950 851486975 /nfs/dbraw/zinc/48/69/75/851486975.db2.gz WAEMVLIUAOADIM-UHFFFAOYSA-N 0 3 421.010 4.112 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)NCc3cc4ccccc4o3)CC2)c1 ZINC000061986879 851487070 /nfs/dbraw/zinc/48/70/70/851487070.db2.gz WLVCYVAKITYGDP-UHFFFAOYSA-N 0 3 420.557 4.143 20 0 HIADHN Cc1cccc(Oc2ccc(NC(=O)C(=O)NC[C@@H](C)N3CCCC[C@@H]3C)cc2)c1 ZINC000062120432 851503372 /nfs/dbraw/zinc/50/33/72/851503372.db2.gz HQNSTPBOYJOFTL-RBUKOAKNSA-N 0 3 409.530 4.105 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)Nc1ccccc1OC(F)(F)F ZINC000062380155 851536553 /nfs/dbraw/zinc/53/65/53/851536553.db2.gz FWLBRSABGXJXNL-UHFFFAOYSA-N 0 3 417.378 4.459 20 0 HIADHN CC(C)C(=O)Nc1cccc(NC(=O)N(CCN(C)C)Cc2cccc(F)c2)c1 ZINC000062385416 851537828 /nfs/dbraw/zinc/53/78/28/851537828.db2.gz IBEJTXWKWTZSRG-UHFFFAOYSA-N 0 3 400.498 4.016 20 0 HIADHN COCc1cccc(NC(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)c1 ZINC000062388257 851538279 /nfs/dbraw/zinc/53/82/79/851538279.db2.gz LNJGYDPWVLBHMX-UHFFFAOYSA-N 0 3 409.452 4.448 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)Nc1cccc(OC(F)(F)F)c1 ZINC000062384509 851538540 /nfs/dbraw/zinc/53/85/40/851538540.db2.gz GNRYDTQHBCCEDL-UHFFFAOYSA-N 0 3 417.378 4.459 20 0 HIADHN COCCOc1c(Cl)cccc1NC(=O)N(CCN(C)C)Cc1cccc(F)c1 ZINC000062411992 851547247 /nfs/dbraw/zinc/54/72/47/851547247.db2.gz LIOAOTGUHODGFN-UHFFFAOYSA-N 0 3 423.916 4.100 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(CNCc3ccccc3-n3cccn3)c2)cc1 ZINC000062425897 851549331 /nfs/dbraw/zinc/54/93/31/851549331.db2.gz XOYNAZLTWWNPKK-UHFFFAOYSA-N 0 3 412.493 4.423 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)NCCCn1ccc2ccccc21 ZINC000062473473 851558467 /nfs/dbraw/zinc/55/84/67/851558467.db2.gz FVHPBONUBYBECR-UHFFFAOYSA-N 0 3 414.500 4.083 20 0 HIADHN CN(C)[C@@H](CNC(=O)N1CCC(c2cc3ccccc3[nH]2)CC1)Cc1ccccc1 ZINC000062474854 851558888 /nfs/dbraw/zinc/55/88/88/851558888.db2.gz JVWYWGHOCUVVQB-JOCHJYFZSA-N 0 3 404.558 4.230 20 0 HIADHN CC[C@@H](NC(=O)N(CCN(C)C)Cc1ccc(F)cc1F)c1ccccc1OC ZINC000062486229 851562625 /nfs/dbraw/zinc/56/26/25/851562625.db2.gz HASQEVFUSFKWNP-HXUWFJFHSA-N 0 3 405.489 4.198 20 0 HIADHN CCCOc1ccc(CNC(=O)N(CCN(C)C)Cc2cccc(Cl)c2)cc1 ZINC000062484856 851562844 /nfs/dbraw/zinc/56/28/44/851562844.db2.gz LJWCSCDPAVZHIC-UHFFFAOYSA-N 0 3 403.954 4.402 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)N[C@H]1CCSc2c(F)cccc21 ZINC000062486962 851563530 /nfs/dbraw/zinc/56/35/30/851563530.db2.gz CDTXUMQIVKLTFD-IBGZPJMESA-N 0 3 423.504 4.414 20 0 HIADHN S=C(NCCOc1ccc2ccccc2c1)NC1CCN(Cc2ccccc2)CC1 ZINC000063145658 851621510 /nfs/dbraw/zinc/62/15/10/851621510.db2.gz NDSSMWAMRZFFON-UHFFFAOYSA-N 0 3 419.594 4.347 20 0 HIADHN S=C(Nc1ccc(N2CCCCC2)nc1)NC1CCN(Cc2ccccc2)CC1 ZINC000063146622 851621751 /nfs/dbraw/zinc/62/17/51/851621751.db2.gz AQDNORVFENZRIA-UHFFFAOYSA-N 0 3 409.603 4.023 20 0 HIADHN Oc1ccc(C2=CCN(C(=S)NC3CCN(Cc4ccccc4)CC3)CC2)cc1 ZINC000063145878 851621987 /nfs/dbraw/zinc/62/19/87/851621987.db2.gz UDLJEUVIVHKPBD-UHFFFAOYSA-N 0 3 407.583 4.020 20 0 HIADHN Fc1cc(NC(=S)NC2CCN(Cc3ccccc3)CC2)ccc1OC(F)F ZINC000063149798 851623068 /nfs/dbraw/zinc/62/30/68/851623068.db2.gz RBCVYNIJLPCXBL-UHFFFAOYSA-N 0 3 409.477 4.378 20 0 HIADHN C[C@H](c1cc(F)ccc1F)N(C)C(=S)NC1CCN(Cc2ccccc2)CC1 ZINC000063149720 851623260 /nfs/dbraw/zinc/62/32/60/851623260.db2.gz FBDWHEBQUZTVHD-MRXNPFEDSA-N 0 3 403.542 4.497 20 0 HIADHN COc1cc(C)ccc1Oc1ccc(NC(=S)NC2CCN(C)CC2)cc1F ZINC000063173007 851625811 /nfs/dbraw/zinc/62/58/11/851625811.db2.gz DGGBEXLXWFZUJR-UHFFFAOYSA-N 0 3 403.523 4.316 20 0 HIADHN Cc1cccn2cc(COc3ccc(CNCc4ccc5c(c4)OCO5)cc3)nc12 ZINC000063312820 851657721 /nfs/dbraw/zinc/65/77/21/851657721.db2.gz PTGJUEZHEKPHIO-UHFFFAOYSA-N 0 3 401.466 4.240 20 0 HIADHN COc1cc(CNCc2ccc3c(c2)CCC3)cc(I)c1OC ZINC000063313273 851658896 /nfs/dbraw/zinc/65/88/96/851658896.db2.gz YLFDLYYTTZKBCO-UHFFFAOYSA-N 0 3 423.294 4.087 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)Cc2csc(-c3ccccc3Cl)n2)o1 ZINC000063497822 851703567 /nfs/dbraw/zinc/70/35/67/851703567.db2.gz NLNUGOAQIXXAMN-UHFFFAOYSA-N 0 3 417.962 4.498 20 0 HIADHN COc1cc(CNCc2ccc(-c3ccc(C)cc3)s2)ccc1OCC(=O)N(C)C ZINC000063521124 851707651 /nfs/dbraw/zinc/70/76/51/851707651.db2.gz NVDFFDWRMRQNBQ-UHFFFAOYSA-N 0 3 424.566 4.489 20 0 HIADHN CN(CCCCCc1cc(-c2cccc(F)c2)no1)C(=S)NC1CCN(C)CC1 ZINC000063567363 851716013 /nfs/dbraw/zinc/71/60/13/851716013.db2.gz LCKGVKYTXJSTHM-UHFFFAOYSA-N 0 3 418.582 4.094 20 0 HIADHN Cc1cc2oc(=O)cc(CN3CCC[C@@H](CNC(=O)OC(C)(C)C)C3)c2cc1C ZINC000063626445 851728911 /nfs/dbraw/zinc/72/89/11/851728911.db2.gz SFYMQHBGCYURRK-KRWDZBQOSA-N 0 3 400.519 4.147 20 0 HIADHN Brc1ccccc1-c1nnc(CN2CCN(CC3CCCCC3)CC2)o1 ZINC000064129694 851832796 /nfs/dbraw/zinc/83/27/96/851832796.db2.gz VSXYRJFFTPDYKZ-UHFFFAOYSA-N 0 3 419.367 4.197 20 0 HIADHN O=c1nc(CN2CCN(CC3CCCCC3)CC2)[nH]c2scc(-c3ccccc3)c21 ZINC000064129865 851833469 /nfs/dbraw/zinc/83/34/69/851833469.db2.gz ILXFMUZRVHQTBU-UHFFFAOYSA-N 0 3 422.598 4.350 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N2CCC[C@@H]2c2nc3cc(C)ccc3[nH]2)N(C)C)cc1 ZINC000064228620 851853110 /nfs/dbraw/zinc/85/31/10/851853110.db2.gz BQNKJELDIKLGPU-FGZHOGPDSA-N 0 3 405.546 4.329 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N2CCC[C@@H]2c2nc3ccc(C)cc3[nH]2)N(C)C)cc1 ZINC000064228620 851853111 /nfs/dbraw/zinc/85/31/11/851853111.db2.gz BQNKJELDIKLGPU-FGZHOGPDSA-N 0 3 405.546 4.329 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N(C)Cc2cnn(-c3ccccc3)c2)N2CCCC2)cc1 ZINC000064237706 851855253 /nfs/dbraw/zinc/85/52/53/851855253.db2.gz IDYJYIVVBVUKBC-DEOSSOPVSA-N 0 3 417.557 4.159 20 0 HIADHN COc1cccc(CN(CCC(=O)NCc2ccccc2Cl)C[C@@H]2CCCO2)c1 ZINC000064518510 851917651 /nfs/dbraw/zinc/91/76/51/851917651.db2.gz HNRLDKUVNABVKM-NRFANRHFSA-N 0 3 416.949 4.036 20 0 HIADHN COc1ccc([C@H](CNC(=O)Nc2cccc(-c3noc(C)n3)c2)N2CCCC2)cc1 ZINC000064544954 851925673 /nfs/dbraw/zinc/92/56/73/851925673.db2.gz CVPHFYJXAARGKT-NRFANRHFSA-N 0 3 421.501 4.012 20 0 HIADHN O=C(CCN(Cc1ccc(-c2ccccc2C(F)(F)F)o1)C1CC1)N1CCOCC1 ZINC000064632491 851943375 /nfs/dbraw/zinc/94/33/75/851943375.db2.gz NWULHMWZDQRVJW-UHFFFAOYSA-N 0 3 422.447 4.179 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)c1cnn(-c2ccccc2Cl)c1 ZINC000064666628 851950566 /nfs/dbraw/zinc/95/05/66/851950566.db2.gz GWKNIQNOQOSKHZ-UHFFFAOYSA-N 0 3 410.949 4.162 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)Cn3ccc4ccc(Cl)cc43)cc2)CC1 ZINC000064720216 851966546 /nfs/dbraw/zinc/96/65/46/851966546.db2.gz SGEGBTSASVDMKS-UHFFFAOYSA-N 0 3 410.949 4.071 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Nc1nnc(C)s1)c1ccc(C(F)(F)F)cc1 ZINC000065014913 852040441 /nfs/dbraw/zinc/04/04/41/852040441.db2.gz RLSMVAXZSYROQH-AWEZNQCLSA-N 0 3 401.458 4.070 20 0 HIADHN Cc1cc(C)c(NC(=O)[C@@H](C)N[C@H](C)c2ccc(N3CCOCC3)cc2)c(Cl)c1 ZINC000065278354 852098157 /nfs/dbraw/zinc/09/81/57/852098157.db2.gz WPFAAYSOLYIJJE-QZTJIDSGSA-N 0 3 415.965 4.471 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1cc(F)c(F)cc1F ZINC000437132774 862323955 /nfs/dbraw/zinc/32/39/55/862323955.db2.gz RCBIZMGYUWWDCO-INIZCTEOSA-N 0 3 414.431 4.308 20 0 HIADHN O=C(NCc1cccc(OCc2ccccn2)c1)N1CCN(CC2CCCCC2)CC1 ZINC000065446173 852136394 /nfs/dbraw/zinc/13/63/94/852136394.db2.gz JOYCPEPGFVWYHW-UHFFFAOYSA-N 0 3 422.573 4.068 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)Nc2ccc(C(=O)NC3CCCC3)cc2)C1 ZINC000065449930 852137494 /nfs/dbraw/zinc/13/74/94/852137494.db2.gz TYZGIIAMYCLYHW-WZONZLPQSA-N 0 3 420.557 4.316 20 0 HIADHN COc1cccc(CN2CCC(NC(=O)c3cc(C)n(Cc4ccco4)c3C)CC2)c1 ZINC000065506254 852161232 /nfs/dbraw/zinc/16/12/32/852161232.db2.gz OSCKECLDKDILRK-UHFFFAOYSA-N 0 3 421.541 4.149 20 0 HIADHN CC(C)(CNC(=O)N[C@@H]1CCCOc2ccc(F)cc21)N1CCc2ccccc2C1 ZINC000065547724 852172908 /nfs/dbraw/zinc/17/29/08/852172908.db2.gz QYARFLGWZCLCQQ-OAQYLSRUSA-N 0 3 411.521 4.176 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)Cc2csc(Cc3ccc(F)cc3)n2)C1 ZINC000065557831 852179314 /nfs/dbraw/zinc/17/93/14/852179314.db2.gz UGLSEEJKWJZCFC-UWJYYQICSA-N 0 3 423.557 4.367 20 0 HIADHN O=C(NCc1csc(Br)c1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000065866947 852291713 /nfs/dbraw/zinc/29/17/13/852291713.db2.gz CRDITAYUEKDYTJ-OAHLLOKOSA-N 0 3 411.340 4.178 20 0 HIADHN CCN(CC)C(=O)c1ccccc1NC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000065892728 852306576 /nfs/dbraw/zinc/30/65/76/852306576.db2.gz FZTANXCODNHAST-LJQANCHMSA-N 0 3 411.521 4.158 20 0 HIADHN Cc1ccc(-n2nc(C(=O)N(CCN(C)C)Cc3ccc(F)cc3)c3c2CCC3)cc1 ZINC000065931612 852321876 /nfs/dbraw/zinc/32/18/76/852321876.db2.gz NRIWHFSHCPGBHX-UHFFFAOYSA-N 0 3 420.532 4.013 20 0 HIADHN COc1cc(CNCc2ccccc2N2CCOCC2)ccc1OCc1ccccc1 ZINC000065934882 852323361 /nfs/dbraw/zinc/32/33/61/852323361.db2.gz AYULDGJHWMFNKA-UHFFFAOYSA-N 0 3 418.537 4.401 20 0 HIADHN FC(F)(F)c1ccn(-c2ccc(CNCc3ccccc3N3CCOCC3)cc2)n1 ZINC000065934763 852323440 /nfs/dbraw/zinc/32/34/40/852323440.db2.gz FPMWVIVMYHDWDI-UHFFFAOYSA-N 0 3 416.447 4.018 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)c1nn(-c2ccccc2)c2c1CCC2 ZINC000065936883 852325174 /nfs/dbraw/zinc/32/51/74/852325174.db2.gz HOGNANQKWJCYBZ-UHFFFAOYSA-N 0 3 422.960 4.218 20 0 HIADHN CCC(=O)Nc1cccc(C(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)c1 ZINC000065936335 852325404 /nfs/dbraw/zinc/32/54/04/852325404.db2.gz XGGJDZPVQOWJFD-UHFFFAOYSA-N 0 3 421.463 4.258 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)Cc1cccc(C(F)(F)F)c1 ZINC000065938168 852326697 /nfs/dbraw/zinc/32/66/97/852326697.db2.gz VXLYQLYXEGJJFC-UHFFFAOYSA-N 0 3 400.391 4.117 20 0 HIADHN CCCOc1c(Cl)cc(CNCCNC(=O)c2ccc(Cl)cc2)cc1OC ZINC000065979075 852338891 /nfs/dbraw/zinc/33/88/91/852338891.db2.gz NANCMPDYVQYMOU-UHFFFAOYSA-N 0 3 411.329 4.310 20 0 HIADHN Cc1nn(Cc2ccccc2)c(Cl)c1CNC[C@@H](c1ccc(F)cc1)N(C)C ZINC000071947187 852441742 /nfs/dbraw/zinc/44/17/42/852441742.db2.gz GJNRLGDWCWSGCJ-NRFANRHFSA-N 0 3 400.929 4.425 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1ccc(-n2ccnc2SC)cc1)c1ccsc1 ZINC000071956464 852444985 /nfs/dbraw/zinc/44/49/85/852444985.db2.gz ASGREMIIXLFZHJ-LJQANCHMSA-N 0 3 414.600 4.469 20 0 HIADHN CCc1c(C(=O)NC[C@H](c2ccccc2)N2CCC(C)CC2)cnn1-c1ccccn1 ZINC000072007056 852462310 /nfs/dbraw/zinc/46/23/10/852462310.db2.gz OPSAUQBNZIBARS-HSZRJFAPSA-N 0 3 417.557 4.033 20 0 HIADHN CC(C)COC(=O)Nc1cccc(NC(=O)N[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000072033363 852475356 /nfs/dbraw/zinc/47/53/56/852475356.db2.gz XYFFOWUUJUTCRD-NRFANRHFSA-N 0 3 410.518 4.287 20 0 HIADHN CC(C)(C)OC(=O)NC[C@H]1CCCN(Cc2cc(=O)oc3cc4c(cc23)CCC4)C1 ZINC000072037839 852480336 /nfs/dbraw/zinc/48/03/36/852480336.db2.gz GTAHDMHWQXHLOT-MRXNPFEDSA-N 0 3 412.530 4.018 20 0 HIADHN O=C(Nc1cnn(-c2ccccc2)c1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000072068970 852493831 /nfs/dbraw/zinc/49/38/31/852493831.db2.gz JMNOVNKKIMZJPZ-NRFANRHFSA-N 0 3 414.431 4.265 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cnn(-c2ccccc2C)c1)c1cccc(OC)c1 ZINC000078989485 852536640 /nfs/dbraw/zinc/53/66/40/852536640.db2.gz BWPDVCVPGROXAK-QHCPKHFHSA-N 0 3 406.530 4.002 20 0 HIADHN CCc1ccc([C@H](CNC(=O)c2c(C)nc(C(C)C)nc2SC)N(C)C)cc1 ZINC000097119532 852583684 /nfs/dbraw/zinc/58/36/84/852583684.db2.gz GGGPVSPBGACTKI-SFHVURJKSA-N 0 3 400.592 4.225 20 0 HIADHN C[C@@H](SCC(=O)N[C@@H](CN1CCCC1)c1ccccc1)c1nc2ccccc2[nH]1 ZINC000097121357 852583807 /nfs/dbraw/zinc/58/38/07/852583807.db2.gz VXVAKVJDZPVIDD-UTKZUKDTSA-N 0 3 408.571 4.310 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)c1cnc2ccccc2c1C(F)(F)F ZINC000097285345 852596455 /nfs/dbraw/zinc/59/64/55/852596455.db2.gz NIOFMZLZWJPLIS-UHFFFAOYSA-N 0 3 423.504 4.345 20 0 HIADHN CCOc1c(Br)cc(CNC[C@H](O)c2ccco2)cc1Br ZINC000097287523 852597788 /nfs/dbraw/zinc/59/77/88/852597788.db2.gz FOBMSEBLLCPBSL-ZDUSSCGKSA-N 0 3 419.113 4.027 20 0 HIADHN CCOc1c(Br)cc(CN[C@@H](C)c2ccc(NC(N)=O)cc2)cc1OC ZINC000097393848 852606783 /nfs/dbraw/zinc/60/67/83/852606783.db2.gz OUDBDRVVRATCTQ-LBPRGKRZSA-N 0 3 422.323 4.198 20 0 HIADHN CC[C@H](C(=O)NC1CCN(CCOc2ccc(Cl)cc2)CC1)c1ccccc1 ZINC000097577248 852637384 /nfs/dbraw/zinc/63/73/84/852637384.db2.gz CEKCZCOHIYHBJJ-QFIPXVFZSA-N 0 3 400.950 4.493 20 0 HIADHN CCOc1ccc(-c2nc(CC(=O)NC[C@H](c3ccccc3)N(C)C)cs2)cc1 ZINC000105817226 852730224 /nfs/dbraw/zinc/73/02/24/852730224.db2.gz VULZNKDQRXYESO-OAQYLSRUSA-N 0 3 409.555 4.170 20 0 HIADHN CCc1c(C(=O)NC[C@H](c2ccsc2)N(CC)CC)cnn1-c1ccc(F)cc1 ZINC000106172626 852759880 /nfs/dbraw/zinc/75/98/80/852759880.db2.gz IJJQFMLZVBXLSH-OAQYLSRUSA-N 0 3 414.550 4.448 20 0 HIADHN CCN1CCN(Cc2ccc(CNC(=O)c3cc(Cl)sc3Cl)cc2)CC1 ZINC000107728614 852791211 /nfs/dbraw/zinc/79/12/11/852791211.db2.gz SHILRDQUMMFVQI-UHFFFAOYSA-N 0 3 412.386 4.122 20 0 HIADHN CC[C@@H](CNC(=O)c1cccc(OCc2cccnc2)c1)N1CCc2ccccc2C1 ZINC000107857457 852803881 /nfs/dbraw/zinc/80/38/81/852803881.db2.gz PQOLPYYHIFMJKZ-DEOSSOPVSA-N 0 3 415.537 4.227 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)c1occc1-c1ccccc1 ZINC000108218488 852830036 /nfs/dbraw/zinc/83/00/36/852830036.db2.gz KPMBDIKAJUIVEX-UHFFFAOYSA-N 0 3 403.526 4.279 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)C(C)(C)c2ccc(Cl)cc2)CC1 ZINC000108268016 852833775 /nfs/dbraw/zinc/83/37/75/852833775.db2.gz OIUSYTAFJFUQEP-UHFFFAOYSA-N 0 3 413.993 4.072 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1nnn(-c2cccc(Cl)c2)c1C)c1ccsc1 ZINC000108409489 852848146 /nfs/dbraw/zinc/84/81/46/852848146.db2.gz WFOODKDGXIOLFM-GOSISDBHSA-N 0 3 417.966 4.104 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)[C@@H]1C[C@@H]1c1ccccc1Cl ZINC000108470351 852854561 /nfs/dbraw/zinc/85/45/61/852854561.db2.gz ORURXKLFGCWFNJ-FGZHOGPDSA-N 0 3 411.977 4.162 20 0 HIADHN CN(CCNC(=O)C1(c2ccc(Br)cc2)CCC1)Cc1ccccc1 ZINC000108771610 852878328 /nfs/dbraw/zinc/87/83/28/852878328.db2.gz NMYYGUHGOGTFCL-UHFFFAOYSA-N 0 3 401.348 4.119 20 0 HIADHN Cc1ccccc1-n1ccnc1SCC(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000108822400 852883109 /nfs/dbraw/zinc/88/31/09/852883109.db2.gz NMOYINQNAMIOTH-PZJWPPBQSA-N 0 3 420.582 4.225 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2ccccc2NC(=O)c2ccccc2)N(C)C)cc1 ZINC000109289385 852947380 /nfs/dbraw/zinc/94/73/80/852947380.db2.gz QRCCMTLRUSOJFK-QHCPKHFHSA-N 0 3 401.510 4.280 20 0 HIADHN CC(C)[C@@H](NCC(=O)NC1CCC2(CC1)OCCO2)c1ccc(C(C)(C)C)cc1 ZINC000109316036 852951024 /nfs/dbraw/zinc/95/10/24/852951024.db2.gz PEUDRUDTPYKHNO-JOCHJYFZSA-N 0 3 402.579 4.073 20 0 HIADHN O=C(NCc1ccc(OC2CCCC2)nc1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000109347139 852956536 /nfs/dbraw/zinc/95/65/36/852956536.db2.gz XABFVEJMMGBTMI-FQEVSTJZSA-N 0 3 411.521 4.071 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2cc(F)ccc2Br)N2CCCC2)cc1 ZINC000109503836 852978538 /nfs/dbraw/zinc/97/85/38/852978538.db2.gz SHZPEDTXWANMEG-LJQANCHMSA-N 0 3 405.311 4.464 20 0 HIADHN Cc1cc(NC(=O)c2cccc(F)c2)sc1C(=O)N1CCC[C@H]1CN1CCCC1 ZINC000109688419 852999590 /nfs/dbraw/zinc/99/95/90/852999590.db2.gz KGNXTVIRBPCTEI-SFHVURJKSA-N 0 3 415.534 4.148 20 0 HIADHN CC(C)(C)OC(=O)NCC1CCN(Cc2cc(=O)oc3cc4c(cc23)CCC4)CC1 ZINC000109805999 853017516 /nfs/dbraw/zinc/01/75/16/853017516.db2.gz WLJALIMSHFXILG-UHFFFAOYSA-N 0 3 412.530 4.018 20 0 HIADHN CN(C)[C@@H](CNC(=O)c1csc(-c2cnn(-c3ccccc3)c2)n1)c1ccccc1 ZINC000109879550 853028053 /nfs/dbraw/zinc/02/80/53/853028053.db2.gz QYFODBTYXVCDHN-NRFANRHFSA-N 0 3 417.538 4.029 20 0 HIADHN CC(=O)Nc1ccc(F)c(NC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)c1 ZINC000110126384 853064145 /nfs/dbraw/zinc/06/41/45/853064145.db2.gz ZCEMZZHANSMGHT-FQEVSTJZSA-N 0 3 423.410 4.177 20 0 HIADHN CCCCN(CC)c1ccc(C(=O)N(C)C2CCN(CCc3ccccn3)CC2)cc1 ZINC000110163626 853067445 /nfs/dbraw/zinc/06/74/45/853067445.db2.gz JETIUJVKLLDKCA-UHFFFAOYSA-N 0 3 422.617 4.487 20 0 HIADHN CCCCN(CC)c1ccc(C(=O)N2CCC(CN3C[C@@H](C)O[C@H](C)C3)CC2)cc1 ZINC000110415855 853097735 /nfs/dbraw/zinc/09/77/35/853097735.db2.gz UAXLYBOLFYYNRF-NHCUHLMSSA-N 0 3 415.622 4.274 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)c3ccccc3CCc3ccccc3)CC2)C[C@H](C)O1 ZINC000110414417 853097931 /nfs/dbraw/zinc/09/79/31/853097931.db2.gz IXESRRFURUIGJF-VXKWHMMOSA-N 0 3 420.597 4.433 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)c3ccccc3Nc3ccccc3)CC2)C[C@H](C)O1 ZINC000110417719 853098045 /nfs/dbraw/zinc/09/80/45/853098045.db2.gz QRXSTPGWBYMORZ-BGYRXZFFSA-N 0 3 407.558 4.392 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)CCc3ccc(C(C)(C)C)cc3)CC2)C[C@H](C)O1 ZINC000110451189 853101440 /nfs/dbraw/zinc/10/14/40/853101440.db2.gz XAEWCJKNDHIWFL-BGYRXZFFSA-N 0 3 400.607 4.265 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)CSc3ccc4ccccc4c3)CC2)C[C@H](C)O1 ZINC000110456270 853102171 /nfs/dbraw/zinc/10/21/71/853102171.db2.gz ISQRXWZNGYQITI-OALUTQOASA-N 0 3 412.599 4.280 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cccn3Cc3cccs3)c(C)c2)CC1 ZINC000110486937 853106727 /nfs/dbraw/zinc/10/67/27/853106727.db2.gz ZVCCZQRVFYHQKB-UHFFFAOYSA-N 0 3 408.571 4.301 20 0 HIADHN Cc1noc([C@H]2CCCN(CCC(=O)Nc3ccccc3Oc3ccccc3)C2)n1 ZINC000110985475 853179515 /nfs/dbraw/zinc/17/95/15/853179515.db2.gz BTKYYLJXIYXHRL-SFHVURJKSA-N 0 3 406.486 4.379 20 0 HIADHN CCCN(CCC(=O)Nc1cc(Cl)ccc1OC)[C@@H](C)C(=O)Nc1ccccc1 ZINC000110989159 853181195 /nfs/dbraw/zinc/18/11/95/853181195.db2.gz IRDNGQIALPYBID-INIZCTEOSA-N 0 3 417.937 4.416 20 0 HIADHN C[C@@H]([NH2+]C(C)(C)C[N-]S(=O)(=O)c1c(Cl)cccc1Cl)c1ccccc1 ZINC000111048524 853193476 /nfs/dbraw/zinc/19/34/76/853193476.db2.gz GRISWGZTNGOXMR-CYBMUJFWSA-N 0 3 401.359 4.401 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)CCCCc3ccc(OC)cc3)c(C)c2)CC1 ZINC000115777060 853264982 /nfs/dbraw/zinc/26/49/82/853264982.db2.gz LOSKKUKNXCSOLN-UHFFFAOYSA-N 0 3 409.574 4.497 20 0 HIADHN CCOC(=O)c1cnc2ccccc2c1N1CCCN(Cc2ccc(OC)cc2)CC1 ZINC000116249593 853294470 /nfs/dbraw/zinc/29/44/70/853294470.db2.gz YYYFEXSWLXBSDO-UHFFFAOYSA-N 0 3 419.525 4.132 20 0 HIADHN O=C(Nc1cccc(-c2n[nH]c(C3CC3)n2)c1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000116689328 853325802 /nfs/dbraw/zinc/32/58/02/853325802.db2.gz IRJSPTZNXTXWHW-LJQANCHMSA-N 0 3 419.504 4.339 20 0 HIADHN CC(C)c1ncc(Cl)c(C(=O)Nc2ccc(CCN3CCSCC3)cc2)n1 ZINC000138664721 853394518 /nfs/dbraw/zinc/39/45/18/853394518.db2.gz DEMMSAICWDLPHO-UHFFFAOYSA-N 0 3 404.967 4.097 20 0 HIADHN CN(Cc1ccc(OCc2ccccn2)cc1)Cc1ccc(C(=O)NC2CC2)cc1 ZINC000139226595 853406526 /nfs/dbraw/zinc/40/65/26/853406526.db2.gz YYEANAQADOAQTH-UHFFFAOYSA-N 0 3 401.510 4.185 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N(C)Cc1cc(C)on1)c1ccc(C(F)(F)F)cc1 ZINC000139744813 853420439 /nfs/dbraw/zinc/42/04/39/853420439.db2.gz ZRPYUDCMBHBLAW-SFHVURJKSA-N 0 3 412.456 4.226 20 0 HIADHN COCCN1CCC(NC(=O)N[C@H](c2cccs2)c2ccc(C(C)C)cc2)CC1 ZINC000140255760 853439795 /nfs/dbraw/zinc/43/97/95/853439795.db2.gz SPEXUNDUJSHTLP-QFIPXVFZSA-N 0 3 415.603 4.371 20 0 HIADHN CCCc1ccc([C@H](NC(=O)NC2CCN(CCOC)CC2)c2cccs2)cc1 ZINC000140252391 853439889 /nfs/dbraw/zinc/43/98/89/853439889.db2.gz KGQKHJLQXLLGML-QFIPXVFZSA-N 0 3 415.603 4.200 20 0 HIADHN CNS(=O)(=O)c1ccc([C@@H](C)NCc2ccc(OCc3ccccc3)cc2)cc1 ZINC000140317714 853442069 /nfs/dbraw/zinc/44/20/69/853442069.db2.gz MJNYSKXCGDPWOF-GOSISDBHSA-N 0 3 410.539 4.025 20 0 HIADHN COCCN1CCC(NC(=O)N[C@@H](Cc2ccc(Cl)cc2)c2ccccc2)CC1 ZINC000140465013 853445028 /nfs/dbraw/zinc/44/50/28/853445028.db2.gz MLAMBRKCXPDFIX-QFIPXVFZSA-N 0 3 415.965 4.034 20 0 HIADHN Cc1nn(-c2ccccc2)c(C)c1CNC[C@H](O)c1ccc(OC(F)(F)F)cc1 ZINC000143076472 853507509 /nfs/dbraw/zinc/50/75/09/853507509.db2.gz WBGKHRFKRWCISU-FQEVSTJZSA-N 0 3 405.420 4.211 20 0 HIADHN CN(CCCOc1ccc(F)cc1)C(=S)NC1CCN(Cc2ccccc2)CC1 ZINC000145585748 853553101 /nfs/dbraw/zinc/55/31/01/853553101.db2.gz KFUGVUXCTFWPFO-UHFFFAOYSA-N 0 3 415.578 4.066 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCCc1ccccn1)c1ccc(C(F)(F)F)cc1 ZINC000145541387 853553302 /nfs/dbraw/zinc/55/33/02/853553302.db2.gz RNVBKTDOFJZVGT-LJQANCHMSA-N 0 3 408.468 4.025 20 0 HIADHN COc1ccc(NC(=O)C(C#N)C(=O)c2sc(C(C)(C)C)nc2C)cc1Cl ZINC000147139153 853582858 /nfs/dbraw/zinc/58/28/58/853582858.db2.gz DHDOIBCWMXKFQP-LBPRGKRZSA-N 0 3 405.907 4.372 20 0 HIADHN N#CC(C(=O)Cc1csc(-c2ccc(Cl)s2)n1)C(=O)NCc1ccccc1 ZINC000149659734 853628437 /nfs/dbraw/zinc/62/84/37/853628437.db2.gz VRPXRAPZACMSJU-AWEZNQCLSA-N 0 3 415.927 4.093 20 0 HIADHN Cc1cc(CNCc2cccc(NC(=O)[C@@H]3CCCO3)c2)cc(C)c1OC(F)F ZINC000165425049 853651824 /nfs/dbraw/zinc/65/18/24/853651824.db2.gz WGRHQFOJSMASSX-IBGZPJMESA-N 0 3 404.457 4.312 20 0 HIADHN COc1ccc2cc(CNCc3ccc(C(=O)N4C[C@@H](C)O[C@H](C)C4)cc3)ccc2c1 ZINC000165966719 853653844 /nfs/dbraw/zinc/65/38/44/853653844.db2.gz KWXFFLVABOKESJ-RTBURBONSA-N 0 3 418.537 4.388 20 0 HIADHN O=C(NCc1ccc(OCC(F)(F)F)cc1)NC[C@H](c1ccccc1)N1CCCC1 ZINC000195601220 853706743 /nfs/dbraw/zinc/70/67/43/853706743.db2.gz HHXFCQZGJZCQCX-HXUWFJFHSA-N 0 3 421.463 4.264 20 0 HIADHN O=C(Nc1cccc(N2CCCCC2=O)c1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000195722629 853778601 /nfs/dbraw/zinc/77/86/01/853778601.db2.gz XSLUSDWGWLELAE-IBGZPJMESA-N 0 3 409.505 4.193 20 0 HIADHN O=C(NCc1ccc(Br)c(F)c1)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000195736312 853786667 /nfs/dbraw/zinc/78/66/67/853786667.db2.gz CCONIIHCHUGXPS-IBGZPJMESA-N 0 3 420.326 4.225 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)Nc3ccc(Cc4ccncc4)cc3)cc2)CC1 ZINC000195742367 853789276 /nfs/dbraw/zinc/78/92/76/853789276.db2.gz DJQAOZNSNOIPOQ-UHFFFAOYSA-N 0 3 414.553 4.455 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)/C=C\c3nc4ccccc4s3)c(C)c2)CC1 ZINC000212471976 853820258 /nfs/dbraw/zinc/82/02/58/853820258.db2.gz LYIOZAMUMIDQHX-KHPPLWFESA-N 0 3 406.555 4.399 20 0 HIADHN CCOc1cc2c(cc1/C=C\C(=O)N1CCCN(Cc3ccccc3)CC1)O[C@H](C)C2 ZINC000214569445 853831078 /nfs/dbraw/zinc/83/10/78/853831078.db2.gz GHGVAFRSBQKXRF-JPMGXVIASA-N 0 3 420.553 4.156 20 0 HIADHN CC[C@H](N[C@@H](C)C(=O)Nc1cccc(C(=O)N(CC)CC)c1)c1ccc(OC)cc1 ZINC000218854378 853863865 /nfs/dbraw/zinc/86/38/65/853863865.db2.gz DSOITZYPYKTVHV-JTSKRJEESA-N 0 3 411.546 4.245 20 0 HIADHN CCN(CC)C(=O)c1cccc(NC(=O)[C@H](C)N[C@H](c2ccc(OC)cc2)C2CC2)c1 ZINC000218865813 853864976 /nfs/dbraw/zinc/86/49/76/853864976.db2.gz GHHMNRARKOGERZ-SBUREZEXSA-N 0 3 423.557 4.245 20 0 HIADHN C[C@H](Sc1ccc(Cl)cc1)C(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000228965989 853890893 /nfs/dbraw/zinc/89/08/93/853890893.db2.gz OTPQADYYPKXQKG-BBWFWOEESA-N 0 3 411.011 4.168 20 0 HIADHN c1cn(Cc2ccc(CNCc3cn(-c4ccccc4)nc3-c3cccnc3)cc2)cn1 ZINC000236583117 853899520 /nfs/dbraw/zinc/89/95/20/853899520.db2.gz WINGNJGSUIDWID-UHFFFAOYSA-N 0 3 420.520 4.469 20 0 HIADHN Brc1ccc(-c2c[nH]c(CNCCc3cnn(-c4ccccc4)c3)n2)cc1 ZINC000236622084 853903474 /nfs/dbraw/zinc/90/34/74/853903474.db2.gz OVWWZBZVKLCKLW-UHFFFAOYSA-N 0 3 422.330 4.357 20 0 HIADHN Brc1ccc(-c2c[nH]c(CNC[C@H]3CCN(c4ccccc4)C3)n2)cc1 ZINC000236623075 853903867 /nfs/dbraw/zinc/90/38/67/853903867.db2.gz PBPLPVDONWEVIH-MRXNPFEDSA-N 0 3 411.347 4.455 20 0 HIADHN Brc1ccc2c(c1)C=C(CNCc1ccc(N3CCCC3)nc1)CO2 ZINC000236632718 853904630 /nfs/dbraw/zinc/90/46/30/853904630.db2.gz NTDWKAWPZDTOMD-UHFFFAOYSA-N 0 3 400.320 4.010 20 0 HIADHN Cc1nn(Cc2ccc(F)cc2)c(Cl)c1CNCCCc1nc(C(C)C)no1 ZINC000236631521 853905249 /nfs/dbraw/zinc/90/52/49/853905249.db2.gz MYAZZYFSFVWLHA-UHFFFAOYSA-N 0 3 405.905 4.261 20 0 HIADHN Cc1nn(Cc2ccc(F)cc2)c(Cl)c1CNC1CCN(C(=O)OC(C)C)CC1 ZINC000236774940 853921531 /nfs/dbraw/zinc/92/15/31/853921531.db2.gz PDUAIABVUGKEAN-UHFFFAOYSA-N 0 3 422.932 4.131 20 0 HIADHN CCCC[C@@H](NCc1ccc2c[nH]nc2c1)C(=O)Nc1cccc(N2CCCC2)c1 ZINC000236862691 853930164 /nfs/dbraw/zinc/93/01/64/853930164.db2.gz XFKHPYYSVABRHY-JOCHJYFZSA-N 0 3 405.546 4.450 20 0 HIADHN CCCOc1c(Cl)cc(CNC[C@@H](c2ccc(C)o2)N2CCOCC2)cc1OC ZINC000236908083 853936060 /nfs/dbraw/zinc/93/60/60/853936060.db2.gz JNYJWTQJALWWIU-IBGZPJMESA-N 0 3 422.953 4.202 20 0 HIADHN CCOc1cc(CNC(C)(C)c2ccc(F)c(F)c2)ccc1O[C@@H](C)C(=O)N(C)C ZINC000236909302 853936194 /nfs/dbraw/zinc/93/61/94/853936194.db2.gz VEXUJMHUEDDUFJ-HNNXBMFYSA-N 0 3 420.500 4.244 20 0 HIADHN CCCOc1ccc(CNCc2c(Cl)cccc2N2CCN(C)CC2)cc1OC ZINC000236947176 853941629 /nfs/dbraw/zinc/94/16/29/853941629.db2.gz VVDGICFPWLIBTB-UHFFFAOYSA-N 0 3 417.981 4.179 20 0 HIADHN CCNC(=O)c1ccc(CNCc2ccc(OC)c(OCc3ccccc3)c2)cc1 ZINC000236978635 853946606 /nfs/dbraw/zinc/94/66/06/853946606.db2.gz PTLITTKUTASWFF-UHFFFAOYSA-N 0 3 404.510 4.314 20 0 HIADHN Cc1cc(CN[C@H](Cc2ccccc2)C(=O)N(C)C)cc(C)c1OCc1ccccn1 ZINC000237015273 853951335 /nfs/dbraw/zinc/95/13/35/853951335.db2.gz TVNKQXIXNBSZRU-XMMPIXPASA-N 0 3 417.553 4.067 20 0 HIADHN CCc1nn(C)c(Cl)c1CNC1CCN(Cc2cccc(C(F)(F)F)c2)CC1 ZINC000237057237 853957943 /nfs/dbraw/zinc/95/79/43/853957943.db2.gz UWNWHKLFNBGZRR-UHFFFAOYSA-N 0 3 414.903 4.409 20 0 HIADHN CN(C)[C@@H](CNCc1nc(-c2ccc(Br)cc2)c[nH]1)c1ccc(F)cc1 ZINC000237178835 853976327 /nfs/dbraw/zinc/97/63/27/853976327.db2.gz HVPQLDBTEPRVHA-IBGZPJMESA-N 0 3 417.326 4.371 20 0 HIADHN C=CCc1cc(CNCc2ccc(OC)c(Br)c2)cc(OC)c1OC ZINC000237212269 853983659 /nfs/dbraw/zinc/98/36/59/853983659.db2.gz LYCFOZOOFFNQCX-UHFFFAOYSA-N 0 3 406.320 4.493 20 0 HIADHN C=CCc1cc(C[NH2+]Cc2cc(Br)cc(OC)c2[O-])cc(OC)c1OC ZINC000237214305 853984559 /nfs/dbraw/zinc/98/45/59/853984559.db2.gz VELPDDJVHPKLOP-UHFFFAOYSA-N 0 3 422.319 4.199 20 0 HIADHN CNC(=O)c1ccc(CN[C@H]2c3cc(Br)ccc3SC[C@H]2C)cc1 ZINC000237228008 853986720 /nfs/dbraw/zinc/98/67/20/853986720.db2.gz HJPREHHUGBATHE-KZULUSFZSA-N 0 3 405.361 4.381 20 0 HIADHN COc1cc(CNCc2ccnc(-n3ccnc3)c2)ccc1OCc1ccccc1 ZINC000237291183 853999093 /nfs/dbraw/zinc/99/90/93/853999093.db2.gz CGJGGKUAYSHIRW-UHFFFAOYSA-N 0 3 400.482 4.145 20 0 HIADHN COc1ccc(NC(=O)C[C@@H](C)N[C@@H]2CCSc3c(F)cccc32)c(OC)c1 ZINC000237291597 853999715 /nfs/dbraw/zinc/99/97/15/853999715.db2.gz ZEBPDDGLVSINEQ-CXAGYDPISA-N 0 3 404.507 4.387 20 0 HIADHN COc1cc(CN[C@H](c2ccc(Cl)cc2)[C@H]2C[C@@H]2C)cc(Cl)c1OCC(N)=O ZINC000237341707 854009261 /nfs/dbraw/zinc/00/92/61/854009261.db2.gz LAEVGEXAVBCNRX-SLSDUTBNSA-N 0 3 423.340 4.353 20 0 HIADHN CNS(=O)(=O)c1ccc([C@H](C)NCc2ccc(-c3ccccc3OC)cc2)cc1 ZINC000237391889 854021201 /nfs/dbraw/zinc/02/12/01/854021201.db2.gz NKWISQURBKHOFE-KRWDZBQOSA-N 0 3 410.539 4.121 20 0 HIADHN COc1ccc(OC)c(NC(=O)C[C@H](C)N[C@H]2CCOc3c(Cl)cccc32)c1 ZINC000237403313 854024311 /nfs/dbraw/zinc/02/43/11/854024311.db2.gz FWOQTBOABKGERA-GUYCJALGSA-N 0 3 404.894 4.188 20 0 HIADHN COc1cc(CN[C@@H]2c3ccccc3C[C@H]2C)cc(I)c1OC ZINC000237425402 854030806 /nfs/dbraw/zinc/03/08/06/854030806.db2.gz FSSCAPUFOZMTMV-XIKOKIGWSA-N 0 3 423.294 4.332 20 0 HIADHN COc1ccc(-c2ccc(CN[C@@H](C)[C@@H](O)c3ccc(F)cc3)o2)c([N+](=O)[O-])c1 ZINC000237437236 854033378 /nfs/dbraw/zinc/03/33/78/854033378.db2.gz VRMUOLOXURCWSN-YEJXKQKISA-N 0 3 400.406 4.214 20 0 HIADHN COc1ccc(CNCc2ccccc2CN2C[C@H](C)O[C@@H](C)C2)c(Cl)c1OC ZINC000237440833 854033722 /nfs/dbraw/zinc/03/37/22/854033722.db2.gz UZTGHOONSDUUBM-IRXDYDNUSA-N 0 3 418.965 4.256 20 0 HIADHN C[C@@](O)(CNCc1cc(Cl)ccc1OC[C@@H]1CCCO1)c1ccc(F)cc1F ZINC000237466084 854037725 /nfs/dbraw/zinc/03/77/25/854037725.db2.gz NJYSNMGGILQKOO-LAUBAEHRSA-N 0 3 411.876 4.173 20 0 HIADHN C[C@@H]1C[C@H]1c1ccc(CNCc2cc(C(F)(F)F)ccc2N2CCN(C)CC2)o1 ZINC000237467040 854038215 /nfs/dbraw/zinc/03/82/15/854038215.db2.gz LWDGTSSMWJGAFL-DNVCBOLYSA-N 0 3 407.480 4.463 20 0 HIADHN CSCC[C@@H](N)C(=O)NC[C@H](c1c[nH]c2ccccc21)c1ccccc1Cl ZINC000237519277 854048636 /nfs/dbraw/zinc/04/86/36/854048636.db2.gz OBDRLBAWCFHNJU-QFBILLFUSA-N 0 3 401.963 4.150 20 0 HIADHN C[C@@H]1CN(C(=O)c2ccc(CNCc3cc(Br)cs3)cc2)C[C@H](C)O1 ZINC000237545500 854052457 /nfs/dbraw/zinc/05/24/57/854052457.db2.gz QKIBLKFZTOCBMT-OKILXGFUSA-N 0 3 423.376 4.050 20 0 HIADHN Cc1cc(Br)ccc1NC(=O)CCNCc1cc(F)c(F)c(F)c1 ZINC000237561654 854054902 /nfs/dbraw/zinc/05/49/02/854054902.db2.gz AQUHGOJAQDLELF-UHFFFAOYSA-N 0 3 401.226 4.293 20 0 HIADHN C[C@H](CC(=O)Nc1cccc(N2CCCC2)c1)NCc1cc2ccccc2[nH]c1=O ZINC000237579251 854057488 /nfs/dbraw/zinc/05/74/88/854057488.db2.gz WCNPTKSLGCGQHM-QGZVFWFLSA-N 0 3 404.514 4.048 20 0 HIADHN Cc1nn(-c2ccc(Br)cc2)c(C)c1CNC[C@@H](O)c1ccccc1C ZINC000237675340 854072929 /nfs/dbraw/zinc/07/29/29/854072929.db2.gz QJGXPRAHFUUJET-OAQYLSRUSA-N 0 3 414.347 4.383 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2CNCC2(CS(C)(=O)=O)CC2)cc1C ZINC000237710777 854080633 /nfs/dbraw/zinc/08/06/33/854080633.db2.gz UGNDRNYCNRIYJQ-UHFFFAOYSA-N 0 3 423.582 4.071 20 0 HIADHN Cc1nn(C)c2ncc(CNCc3cn(-c4ccccc4)nc3-c3ccccc3)cc12 ZINC000237721760 854082800 /nfs/dbraw/zinc/08/28/00/854082800.db2.gz OVDPPVLLTGSOOY-UHFFFAOYSA-N 0 3 408.509 4.419 20 0 HIADHN Fc1cccc(C2(NCc3cc4c(c(Br)c3)OCO4)CCOCC2)c1 ZINC000237749655 854089065 /nfs/dbraw/zinc/08/90/65/854089065.db2.gz WPOLKRLHSYWNTM-UHFFFAOYSA-N 0 3 408.267 4.112 20 0 HIADHN Cn1cc(CNCc2ccc(F)c(Cl)c2)c(-c2ccc3c(c2)OCCCO3)n1 ZINC000237770841 854092953 /nfs/dbraw/zinc/09/29/53/854092953.db2.gz ZYEYCMBZILDSHF-UHFFFAOYSA-N 0 3 401.869 4.331 20 0 HIADHN Cc1nn(-c2ccc(F)cc2)c(Cl)c1CNCCc1nc2cc(F)ccc2n1C ZINC000237775491 854095136 /nfs/dbraw/zinc/09/51/36/854095136.db2.gz XPSSDTFXZYAIJP-UHFFFAOYSA-N 0 3 415.875 4.331 20 0 HIADHN O=[N+]([O-])c1ccc(Cl)c(CNC[C@@H](c2ccc(Cl)cc2)N2CCOCC2)c1 ZINC000237794516 854099257 /nfs/dbraw/zinc/09/92/57/854099257.db2.gz PSYFNAOGFQAEIF-IBGZPJMESA-N 0 3 410.301 4.065 20 0 HIADHN Cc1cccn2cc(COc3ccc(CNCc4ccc(NC(N)=O)cc4)cc3)nc12 ZINC000237855842 854108310 /nfs/dbraw/zinc/10/83/10/854108310.db2.gz ITHTZQLEHQBBTE-UHFFFAOYSA-N 0 3 415.497 4.002 20 0 HIADHN Cc1nn(Cc2ccc(Cl)cc2)c(C)c1CNC[C@H](O)c1c(F)cccc1F ZINC000237883499 854114782 /nfs/dbraw/zinc/11/47/82/854114782.db2.gz TZYXXEDKYGXJMC-FQEVSTJZSA-N 0 3 405.876 4.303 20 0 HIADHN O=C(CCCNCc1csc(-c2ccccc2)n1)N1CCN(c2ccccc2)CC1 ZINC000237997977 854130740 /nfs/dbraw/zinc/13/07/40/854130740.db2.gz RNXTUGZLEQCINV-UHFFFAOYSA-N 0 3 420.582 4.029 20 0 HIADHN O[C@@H](CNCc1cc(Br)ccc1OCc1ccccn1)c1ccsc1 ZINC000238026053 854135405 /nfs/dbraw/zinc/13/54/05/854135405.db2.gz YCVAYVRFXZMEKB-SFHVURJKSA-N 0 3 419.344 4.308 20 0 HIADHN S=C(NCc1ccc(Br)cc1)NC1CCN(Cc2ccccc2)CC1 ZINC000244375695 854155937 /nfs/dbraw/zinc/15/59/37/854155937.db2.gz YBMDGZBTNFOJEG-UHFFFAOYSA-N 0 3 418.404 4.078 20 0 HIADHN Cc1noc(C)c1COc1cccc(C(=O)N(CCN(C)C)Cc2ccccc2)c1 ZINC000248027685 854174593 /nfs/dbraw/zinc/17/45/93/854174593.db2.gz SMWZHAXDWOTPLD-UHFFFAOYSA-N 0 3 407.514 4.074 20 0 HIADHN Cc1cc(C)c(CCNC(=O)CNC2(c3ccc(Cl)cc3)CCOCC2)c(C)c1 ZINC000261464854 854271709 /nfs/dbraw/zinc/27/17/09/854271709.db2.gz XYWLZFWCLAQCIR-UHFFFAOYSA-N 0 3 414.977 4.219 20 0 HIADHN COc1cccc(C[C@@H](C)NC(=O)Nc2ccc(CCN3CCSCC3)cc2)c1 ZINC000261478521 854276061 /nfs/dbraw/zinc/27/60/61/854276061.db2.gz SVUSWMPLKDTGQO-GOSISDBHSA-N 0 3 413.587 4.039 20 0 HIADHN COc1ccc([C@@H](CNc2nc(C(F)(F)F)nc3nc[nH]c32)N2CCCCC2)cc1 ZINC000301100688 854295866 /nfs/dbraw/zinc/29/58/66/854295866.db2.gz PVEDQIJBFKFXST-OAHLLOKOSA-N 0 3 420.439 4.019 20 0 HIADHN COc1ccc([C@@H](CNc2ncnc3nc(SC)sc32)N2CCCC2)cc1 ZINC000301158272 854314589 /nfs/dbraw/zinc/31/45/89/854314589.db2.gz SFHAVZLAZFKLBA-OAHLLOKOSA-N 0 3 401.561 4.066 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(NC[C@H](C(C)C)[N@@H+]3CCc4ccccc4C3)nc2)n1 ZINC000301165716 854317615 /nfs/dbraw/zinc/31/76/15/854317615.db2.gz HQABBAJGEUSUHI-JOCHJYFZSA-N 0 3 417.557 4.301 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(NC[C@H](C(C)C)[N@H+]3CCc4ccccc4C3)nc2)n1 ZINC000301165716 854317623 /nfs/dbraw/zinc/31/76/23/854317623.db2.gz HQABBAJGEUSUHI-JOCHJYFZSA-N 0 3 417.557 4.301 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(NCC3CC[NH+](Cc4cccs4)CC3)nc2)n1 ZINC000301188843 854324057 /nfs/dbraw/zinc/32/40/57/854324057.db2.gz XBWPTKJWZDDPLG-UHFFFAOYSA-N 0 3 409.559 4.192 20 0 HIADHN Cc1ccc([C@@H](CNc2ncccc2C(=O)N2CCc3ccccc32)N2CCCC2)o1 ZINC000301412662 854387215 /nfs/dbraw/zinc/38/72/15/854387215.db2.gz PTYIOGLPRGKEOL-JOCHJYFZSA-N 0 3 416.525 4.435 20 0 HIADHN Cc1ccc([C@@H](CNc2nc3c(cnn3-c3ccccc3)c(=O)[nH]2)N2CCCC2)cc1 ZINC000301443859 854396197 /nfs/dbraw/zinc/39/61/97/854396197.db2.gz YSSCHZKINMQLMG-OAQYLSRUSA-N 0 3 414.513 4.079 20 0 HIADHN C[C@H]1CN(CCC2CCN(c3nc(C(F)F)nc4ccccc43)CC2)C[C@H](C)O1 ZINC000301536074 854415032 /nfs/dbraw/zinc/41/50/32/854415032.db2.gz IXBYIGNXWVZFLK-HOTGVXAUSA-N 0 3 404.505 4.283 20 0 HIADHN CCc1cc(=O)[n-]c(-c2ccc(N3CC[NH+](C4CCC(C(C)C)CC4)CC3)nc2)n1 ZINC000301553306 854418956 /nfs/dbraw/zinc/41/89/56/854418956.db2.gz HRZWKHQEXNXAQE-UHFFFAOYSA-N 0 3 409.578 4.143 20 0 HIADHN Cc1nc2ccc(Br)cc2c(N2CCC(Cn3ccnn3)CC2)c1C ZINC000301789088 854465693 /nfs/dbraw/zinc/46/56/93/854465693.db2.gz YDBWLSCMIURFFA-UHFFFAOYSA-N 0 3 400.324 4.122 20 0 HIADHN CCN1CCN([C@H](C)CNc2ccc3c(Br)ccc(Cl)c3n2)CC1 ZINC000302013129 854516397 /nfs/dbraw/zinc/51/63/97/854516397.db2.gz ZSEVCAGWVOWRNW-CYBMUJFWSA-N 0 3 411.775 4.089 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CC[C@H]1Nc1nn2cc(-c3cccnc3)nc2s1 ZINC000302193553 854546764 /nfs/dbraw/zinc/54/67/64/854546764.db2.gz RVGFXLQELTVQOC-VQIMIIECSA-N 0 3 404.543 4.175 20 0 HIADHN C[C@@H]1C[C@H](Nc2nn3cc(-c4cccnc4)nc3s2)CCN1Cc1ccccc1 ZINC000302200005 854548903 /nfs/dbraw/zinc/54/89/03/854548903.db2.gz UUDUZWVCEOHZNZ-VQIMIIECSA-N 0 3 404.543 4.318 20 0 HIADHN C[C@@H](CCN1CCN(C)CC1)Nc1ccc2c(Br)ccc(Cl)c2n1 ZINC000302261012 854558260 /nfs/dbraw/zinc/55/82/60/854558260.db2.gz PLQCFYGVQAWVBK-ZDUSSCGKSA-N 0 3 411.775 4.089 20 0 HIADHN COc1cccc([C@@H](CNc2ccc3nnc(-c4ccsc4)n3n2)N2CCCC2)c1 ZINC000302352064 854563619 /nfs/dbraw/zinc/56/36/19/854563619.db2.gz YLXUXFDPNYAQHC-LJQANCHMSA-N 0 3 420.542 4.110 20 0 HIADHN COc1ccc([C@@H](CNc2ncc(Br)cc2Cl)N(C)C)cc1OC ZINC000302711958 854610036 /nfs/dbraw/zinc/61/00/36/854610036.db2.gz IHFIDMGUEHUVEL-CQSZACIVSA-N 0 3 414.731 4.230 20 0 HIADHN C[C@H]1CN(C2CCN(c3ccnc4c(Cl)cc(Br)cc34)CC2)CCO1 ZINC000302722574 854613385 /nfs/dbraw/zinc/61/33/85/854613385.db2.gz IFVIPUOFZFZWEN-ZDUSSCGKSA-N 0 3 424.770 4.340 20 0 HIADHN COc1ccc([C@H](NCC(=O)Nc2c(C)nn(-c3ccccc3)c2C)C(C)C)cc1 ZINC000302769654 854628897 /nfs/dbraw/zinc/62/88/97/854628897.db2.gz YAGFDIXFGNJRRW-HSZRJFAPSA-N 0 3 406.530 4.423 20 0 HIADHN CCN(CC)C(=O)c1cccc(NC(=O)CN[C@@H](c2ccc(OC)cc2)C(C)C)c1 ZINC000302769667 854629219 /nfs/dbraw/zinc/62/92/19/854629219.db2.gz YGUQVDRFPOHXMX-HSZRJFAPSA-N 0 3 411.546 4.103 20 0 HIADHN C[C@H](CCN1CCN(C)CC1)Nc1ccnc2c(Cl)cc(Br)cc12 ZINC000302779312 854632959 /nfs/dbraw/zinc/63/29/59/854632959.db2.gz HQRJJRPUIMIMEW-CYBMUJFWSA-N 0 3 411.775 4.089 20 0 HIADHN COCCc1nsc(Nc2ccc(CN3CCN(c4cccc(C)c4)CC3)cc2)n1 ZINC000302824118 854646237 /nfs/dbraw/zinc/64/62/37/854646237.db2.gz LOJQSNNCRCISKD-UHFFFAOYSA-N 0 3 423.586 4.101 20 0 HIADHN COc1cccc([C@@H](CNC(=O)CCSc2ccccc2F)N2CCCC2)c1 ZINC000302849458 854655699 /nfs/dbraw/zinc/65/56/99/854655699.db2.gz IUDNUGMXFLRPSE-HXUWFJFHSA-N 0 3 402.535 4.270 20 0 HIADHN CC[C@H](NCC(=O)Nc1ccccc1C(=O)NC1CCCC1)c1ccc(OC)cc1 ZINC000302856355 854658459 /nfs/dbraw/zinc/65/84/59/854658459.db2.gz MOBPOPUJJMONJJ-NRFANRHFSA-N 0 3 409.530 4.047 20 0 HIADHN O=S(=O)(C1CC1)N1CCC(Nc2ccnc3ccc(Oc4ccccc4)cc32)CC1 ZINC000302872170 854663240 /nfs/dbraw/zinc/66/32/40/854663240.db2.gz BWVDEEPIBULQAF-UHFFFAOYSA-N 0 3 423.538 4.396 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1c(C)nn(-c2ccccc2)c1C)c1cccc(OC)c1 ZINC000302878857 854665029 /nfs/dbraw/zinc/66/50/29/854665029.db2.gz LWBJVBMWMLFCGX-QHCPKHFHSA-N 0 3 420.557 4.311 20 0 HIADHN COc1cccc([C@@H](CNC(=O)N[C@H](C)c2ccc(F)cc2F)N2CCCC2)c1 ZINC000302900659 854671739 /nfs/dbraw/zinc/67/17/39/854671739.db2.gz QIDSVSMTIAVRRJ-QVKFZJNVSA-N 0 3 403.473 4.171 20 0 HIADHN C[C@@H](NCC(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1)c1cccc2ccccc21 ZINC000302918631 854679089 /nfs/dbraw/zinc/67/90/89/854679089.db2.gz CMHFUCCRPPVZLP-CQSZACIVSA-N 0 3 418.465 4.125 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)c1cc(Br)ccc1F ZINC000302966334 854700715 /nfs/dbraw/zinc/70/07/15/854700715.db2.gz HISHQVRQSCRAAS-UHFFFAOYSA-N 0 3 415.253 4.070 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1ccc(Br)cc1OC)c1ccsc1 ZINC000302976726 854705836 /nfs/dbraw/zinc/70/58/36/854705836.db2.gz CFWGMWSQXBJUSF-MRXNPFEDSA-N 0 3 411.365 4.332 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Cc2ccc(OC(F)(F)F)cc2)N2CCCC2)cc1 ZINC000302987148 854710482 /nfs/dbraw/zinc/71/04/82/854710482.db2.gz FDQLJSFLQQATNV-FQEVSTJZSA-N 0 3 406.448 4.389 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)CCCOc3ccccc3Cl)cc2)CC1 ZINC000302988025 854710901 /nfs/dbraw/zinc/71/09/01/854710901.db2.gz FGUMGLFUYCQIKA-UHFFFAOYSA-N 0 3 415.965 4.275 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2ccccc2OC[C@@H]2CCCO2)N2CCCC2)cc1 ZINC000303048529 854738110 /nfs/dbraw/zinc/73/81/10/854738110.db2.gz RBZQCMADFCBKQF-GMAHTHKFSA-N 0 3 408.542 4.120 20 0 HIADHN Cc1cc(-n2c(C)cc(C(=O)NC[C@@H]3CCCCN3Cc3ccccc3)c2C)no1 ZINC000303054951 854741601 /nfs/dbraw/zinc/74/16/01/854741601.db2.gz KCLQFWMTCQRCPJ-NRFANRHFSA-N 0 3 406.530 4.175 20 0 HIADHN CCN(CC)CC(=O)NC[C@H](c1ccc(SC)cc1)N1CCc2sccc2C1 ZINC000303060369 854743260 /nfs/dbraw/zinc/74/32/60/854743260.db2.gz XIQYZXHTJBTEAN-HXUWFJFHSA-N 0 3 417.644 4.027 20 0 HIADHN CC1CCN([C@@H](CNC(=O)[C@@H]2CCCN2C(=O)CC(C)(C)C)c2ccccc2)CC1 ZINC000303066392 854746681 /nfs/dbraw/zinc/74/66/81/854746681.db2.gz VYYSPVUKVMLVCB-VXKWHMMOSA-N 0 3 413.606 4.003 20 0 HIADHN O=C(NC[C@H]1CCCCN1Cc1ccccc1)c1ccccc1OC[C@@H]1CCCO1 ZINC000303073514 854748439 /nfs/dbraw/zinc/74/84/39/854748439.db2.gz QDGCSRVMUHPDLK-YADHBBJMSA-N 0 3 408.542 4.029 20 0 HIADHN COc1ccc(CC2CCN([C@@H](C)C(=O)N[C@H](C)c3ccccc3OC)CC2)cc1 ZINC000303086539 854754581 /nfs/dbraw/zinc/75/45/81/854754581.db2.gz GTXHVHILPCQKJD-MOPGFXCFSA-N 0 3 410.558 4.224 20 0 HIADHN Cc1ccc2c(CN3CCC[C@H](CN(C)C(=O)OC(C)(C)C)C3)cc(=O)oc2c1C ZINC000303123982 854771529 /nfs/dbraw/zinc/77/15/29/854771529.db2.gz GLFQADXIGRZXMR-GOSISDBHSA-N 0 3 414.546 4.489 20 0 HIADHN CCN(Cc1c(F)cccc1F)C(=O)NCC(C)(C)N1CCc2ccccc2C1 ZINC000303178671 854802715 /nfs/dbraw/zinc/80/27/15/854802715.db2.gz WVNRTUWSLVJUOL-UHFFFAOYSA-N 0 3 401.501 4.333 20 0 HIADHN CCc1ccc(-n2nc(C(=O)N(CCN(C)C)Cc3ccc(C)o3)c3c2CCC3)cc1 ZINC000303288108 854853538 /nfs/dbraw/zinc/85/35/38/854853538.db2.gz LVTBLLSBLBDBCN-UHFFFAOYSA-N 0 3 420.557 4.029 20 0 HIADHN Cc1c(C(=O)Nc2cccc(CN(C)C)c2)cnn1-c1cccc(Br)c1 ZINC000303291320 854855906 /nfs/dbraw/zinc/85/59/06/854855906.db2.gz OFNZEWBNJPIKJD-UHFFFAOYSA-N 0 3 413.319 4.257 20 0 HIADHN CCc1cccc2c(CC(=O)NC[C@@H](c3ccc(OC)cc3)N3CCCC3)c[nH]c21 ZINC000303333245 854876974 /nfs/dbraw/zinc/87/69/74/854876974.db2.gz BVZLKMSXAHKLMP-QHCPKHFHSA-N 0 3 405.542 4.235 20 0 HIADHN CN(C[C@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)c1cc(Cl)cc(Cl)c1 ZINC000437345677 862620926 /nfs/dbraw/zinc/62/09/26/862620926.db2.gz PNBXYKHEWTUIEU-MRXNPFEDSA-N 0 3 413.370 4.136 20 0 HIADHN CN(C)Cc1cccc(NC(=O)CCC[S@@](=O)c2ccc(Br)cc2)c1 ZINC000303440909 854940476 /nfs/dbraw/zinc/94/04/76/854940476.db2.gz FSQOOYYCSMLQAB-RUZDIDTESA-N 0 3 423.376 4.037 20 0 HIADHN N#Cc1ccsc1NC(=O)CCN1CCC([C@@H](O)c2ccc(Cl)cc2)CC1 ZINC000303443326 854942302 /nfs/dbraw/zinc/94/23/02/854942302.db2.gz ZCFQYNBNUCJIAF-IBGZPJMESA-N 0 3 403.935 4.047 20 0 HIADHN Cc1ccc(Cl)cc1S(=O)(=O)NC1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1 ZINC000303445948 854944801 /nfs/dbraw/zinc/94/48/01/854944801.db2.gz GYJPRXSOHLBOJG-IHWFROFDSA-N 0 3 404.963 4.122 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCC1)[C@@H]1C[C@H]1c1cccc(C(F)(F)F)c1 ZINC000303450932 854949624 /nfs/dbraw/zinc/94/96/24/854949624.db2.gz JMTIKUNWARTAPG-ZWKOTPCHSA-N 0 3 412.521 4.287 20 0 HIADHN O=C(CN(Cc1ccccc1)CC1CCOCC1)Nc1ccc(N2CCCC2)cc1 ZINC000303453214 854952654 /nfs/dbraw/zinc/95/26/54/854952654.db2.gz JDMBKFCUQBLAID-UHFFFAOYSA-N 0 3 407.558 4.154 20 0 HIADHN Cc1noc(C)c1COc1ccccc1C(=O)NC[C@@H](C)N(C)Cc1ccccc1 ZINC000303458041 854958647 /nfs/dbraw/zinc/95/86/47/854958647.db2.gz GQSIDZWSDBPNCE-QGZVFWFLSA-N 0 3 407.514 4.121 20 0 HIADHN CC(=O)Nc1cc(C(=O)N(CCN2CCCC2)Cc2ccc(Cl)cc2)ccc1F ZINC000303475386 854970822 /nfs/dbraw/zinc/97/08/22/854970822.db2.gz JLYKVRNCJZSUTI-UHFFFAOYSA-N 0 3 417.912 4.176 20 0 HIADHN COc1ccc(C(C)(C)CNC(=O)c2oc3ccccc3c2CN(C)C)cc1OC ZINC000303543778 855029924 /nfs/dbraw/zinc/02/99/24/855029924.db2.gz KJQNSHRINYXHLT-UHFFFAOYSA-N 0 3 410.514 4.219 20 0 HIADHN CCOc1ccc(C(=O)CCC(=O)NC2C[C@H]3CC[C@@H](C2)N3Cc2ccccc2)cc1 ZINC000303544358 855030754 /nfs/dbraw/zinc/03/07/54/855030754.db2.gz VBXFTXQCJCYPIK-NOTZXAQLSA-N 0 3 420.553 4.360 20 0 HIADHN COc1cc(F)c([C@@H](C)NC(=O)N[C@H](CN2CCCC2)c2ccccc2)cc1OC ZINC000303586070 855059464 /nfs/dbraw/zinc/05/94/64/855059464.db2.gz QNEQMBOWWCCVHB-OXQOHEQNSA-N 0 3 415.509 4.040 20 0 HIADHN O=C(NCc1ccco1)c1cccc(CN(CCCO)[C@H]2CCc3ccccc32)c1 ZINC000303636069 855092367 /nfs/dbraw/zinc/09/23/67/855092367.db2.gz ZSPUBJRJPZUGDY-DEOSSOPVSA-N 0 3 404.510 4.082 20 0 HIADHN COc1ccc([C@@H](CNC(=O)/C=C/c2ccnc3ccccc23)N2CCCC2)cc1 ZINC000303639069 855095368 /nfs/dbraw/zinc/09/53/68/855095368.db2.gz ARZFIZBJCYNYRL-XOJVXBCLSA-N 0 3 401.510 4.210 20 0 HIADHN C[C@@H](CNC(=O)c1cc(Br)sc1Br)N1CCC(C)CC1 ZINC000303683308 855130772 /nfs/dbraw/zinc/13/07/72/855130772.db2.gz SNLLVWNNJORRBE-JTQLQIEISA-N 0 3 424.202 4.123 20 0 HIADHN C[C@@H]1C[C@@H](N(C)S(=O)(=O)c2ccc(F)cc2Cl)CCN1Cc1ccccc1 ZINC000303755868 855176706 /nfs/dbraw/zinc/17/67/06/855176706.db2.gz CYOJJYSDIUIBMF-QAPCUYQASA-N 0 3 410.942 4.153 20 0 HIADHN Cc1cc(C(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)c(C)n1-c1nccs1 ZINC000303789174 855199448 /nfs/dbraw/zinc/19/94/48/855199448.db2.gz FBWMEHWMNYHLID-GOSISDBHSA-N 0 3 408.571 4.287 20 0 HIADHN COc1cc(Br)ccc1C(=O)N1CCCN(Cc2ccccc2)C[C@H]1C ZINC000303789130 855199610 /nfs/dbraw/zinc/19/96/10/855199610.db2.gz FBILLOONFBGZCA-MRXNPFEDSA-N 0 3 417.347 4.194 20 0 HIADHN Cc1ccc(Cl)cc1S(=O)(=O)N(C)[C@@H]1CCN(Cc2ccccc2)[C@@H](C)C1 ZINC000303848715 855244917 /nfs/dbraw/zinc/24/49/17/855244917.db2.gz UQXXKYMMYIWGJI-FXAWDEMLSA-N 0 3 406.979 4.322 20 0 HIADHN O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)[C@H]1C[C@@H]1c1ccccc1OC(F)(F)F ZINC000303857311 855252788 /nfs/dbraw/zinc/25/27/88/855252788.db2.gz LULPCEDQYKLEOV-RLLQIKCJSA-N 0 3 418.459 4.470 20 0 HIADHN CCc1c(C(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)cnn1-c1ccc(F)cc1 ZINC000303867086 855260337 /nfs/dbraw/zinc/26/03/37/855260337.db2.gz QEJWTRIVCFXKRL-LJQANCHMSA-N 0 3 420.532 4.310 20 0 HIADHN CN1CCN(CCCNC(=O)c2ccc(Oc3cccc(Cl)c3Cl)cc2)CC1 ZINC000303948828 855312267 /nfs/dbraw/zinc/31/22/67/855312267.db2.gz SPJCDPPGYYQEIG-UHFFFAOYSA-N 0 3 422.356 4.153 20 0 HIADHN COc1ccc(Br)cc1CC(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000303959333 855321592 /nfs/dbraw/zinc/32/15/92/855321592.db2.gz MFEJIGJGTLLDGF-MRXNPFEDSA-N 0 3 423.376 4.015 20 0 HIADHN C[C@H]1[C@H](NC(=O)c2ccc(Cl)cc2Br)CCN1Cc1ccccc1 ZINC000310326023 855366521 /nfs/dbraw/zinc/36/65/21/855366521.db2.gz YUHJMVGFAMQKGW-SCLBCKFNSA-N 0 3 407.739 4.495 20 0 HIADHN CN(C(=O)c1cc(Cl)ncc1Br)C1CCN(Cc2ccccc2)CC1 ZINC000311001379 855368935 /nfs/dbraw/zinc/36/89/35/855368935.db2.gz NGWHUNAIYKXPLC-UHFFFAOYSA-N 0 3 422.754 4.234 20 0 HIADHN CN(C(=O)c1cccc(F)c1Br)C1CCN(Cc2ccccc2)CC1 ZINC000311160590 855369215 /nfs/dbraw/zinc/36/92/15/855369215.db2.gz YHEQAOOIRHFXFS-UHFFFAOYSA-N 0 3 405.311 4.325 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)c1cc(Cl)ncc1Br ZINC000326627251 855411084 /nfs/dbraw/zinc/41/10/84/855411084.db2.gz TUAGIFFQLGTFMD-INIZCTEOSA-N 0 3 408.727 4.064 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)c1ccc(Br)c(F)c1 ZINC000383061482 855436834 /nfs/dbraw/zinc/43/68/34/855436834.db2.gz STROVHMBHBTNLL-OAHLLOKOSA-N 0 3 405.311 4.325 20 0 HIADHN COc1ccc(Br)cc1C(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000388527409 855447601 /nfs/dbraw/zinc/44/76/01/855447601.db2.gz JYJANCGIEHREHG-GOSISDBHSA-N 0 3 417.347 4.194 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1ccc(Cl)cc1Br ZINC000389849652 855452543 /nfs/dbraw/zinc/45/25/43/855452543.db2.gz SSSKOQLJYDFQTJ-FZKQIMNGSA-N 0 3 407.739 4.353 20 0 HIADHN C[C@H](NC[C@@H]1CN(Cc2ccccc2)CCCO1)c1sccc1Br ZINC000390846069 855457334 /nfs/dbraw/zinc/45/73/34/855457334.db2.gz FLHILXJUUCWOQJ-DOTOQJQBSA-N 0 3 409.393 4.452 20 0 HIADHN CC(C)(C)OC(=O)N1CCC[C@H](N[C@H]2CCOc3ccc(Br)cc32)C1 ZINC000394130855 855469645 /nfs/dbraw/zinc/46/96/45/855469645.db2.gz VSGNRSDVSXZTLW-HOCLYGCPSA-N 0 3 411.340 4.262 20 0 HIADHN CC(C)(C)OC(=O)N1CCC[C@@H](N[C@@H]2CCOc3ccc(Br)cc32)C1 ZINC000394130847 855469944 /nfs/dbraw/zinc/46/99/44/855469944.db2.gz VSGNRSDVSXZTLW-GDBMZVCRSA-N 0 3 411.340 4.262 20 0 HIADHN C[C@@]1(CNC(=O)c2c(F)cccc2Br)CCCN1Cc1ccccc1 ZINC000397906872 855472966 /nfs/dbraw/zinc/47/29/66/855472966.db2.gz FLSAFKKSXYIGTN-FQEVSTJZSA-N 0 3 405.311 4.373 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cnn(-c2ccccc2OC)c1C)c1ccsc1 ZINC000409453523 855486525 /nfs/dbraw/zinc/48/65/25/855486525.db2.gz PEFHOBWCSXYSEU-HXUWFJFHSA-N 0 3 412.559 4.064 20 0 HIADHN C[C@@H](NC(=O)Nc1cccc(CN(C)C)c1)[C@H](OC1CCOCC1)c1ccccc1 ZINC000437383171 862694752 /nfs/dbraw/zinc/69/47/52/862694752.db2.gz GLSCKNCXPVRDMG-JPYJTQIMSA-N 0 3 411.546 4.195 20 0 HIADHN CN(C)[C@H](CNC(=O)Nc1cc(Cl)ccc1OC[C@@H]1CCCO1)c1ccccc1 ZINC000409654425 855585867 /nfs/dbraw/zinc/58/58/67/855585867.db2.gz WYVKCHYQGUNGOC-AZUAARDMSA-N 0 3 417.937 4.322 20 0 HIADHN Cc1nc2ccc(Br)cc2c(N2CCC[C@@H](S(C)(=O)=O)CC2)c1C ZINC000409672373 855595828 /nfs/dbraw/zinc/59/58/28/855595828.db2.gz HQKKWABSHNOVBT-OAHLLOKOSA-N 0 3 411.365 4.018 20 0 HIADHN O=C(NCCCCN1CCN(Cc2ccccc2)CC1)Nc1ccccc1Cl ZINC000409677607 855597444 /nfs/dbraw/zinc/59/74/44/855597444.db2.gz GTSIHDLBNFZBBQ-UHFFFAOYSA-N 0 3 400.954 4.060 20 0 HIADHN O=C(NCCCCN1CCN(Cc2ccccc2)CC1)Nc1ccc(Cl)cc1 ZINC000409682518 855599888 /nfs/dbraw/zinc/59/98/88/855599888.db2.gz APHILQFFNHJNPN-UHFFFAOYSA-N 0 3 400.954 4.060 20 0 HIADHN O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)[C@@H]1CCO[C@H]1c1ccc(Cl)c(F)c1 ZINC000409754375 855636604 /nfs/dbraw/zinc/63/66/04/855636604.db2.gz TZKHDTLSJHUVHH-KNKQGSTJSA-N 0 3 416.924 4.338 20 0 HIADHN CC(C)(CNC(=O)CCc1cc(Br)cs1)N1CCc2ccccc2C1 ZINC000409877767 855702471 /nfs/dbraw/zinc/70/24/71/855702471.db2.gz UBAFRVVQVULGIO-UHFFFAOYSA-N 0 3 421.404 4.396 20 0 HIADHN CN(C)CCN(C(=O)c1ccc(-c2noc(C(F)(F)F)n2)cc1)C1CCCCC1 ZINC000409886214 855706559 /nfs/dbraw/zinc/70/65/59/855706559.db2.gz YQCDBUQDXVOGOP-UHFFFAOYSA-N 0 3 410.440 4.092 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)[C@@H]1CCO[C@H]1c1ccc(Cl)c(F)c1 ZINC000409892314 855709176 /nfs/dbraw/zinc/70/91/76/855709176.db2.gz MFHSOVQNNGYPOQ-FPDPHYFHSA-N 0 3 404.913 4.193 20 0 HIADHN CCCc1c(C(=O)Nc2ccc(N3CCN(CC)CC3)cc2C)[nH]c(C)c1C(C)=O ZINC000409944112 855738126 /nfs/dbraw/zinc/73/81/26/855738126.db2.gz WSECMABDXJMTLL-UHFFFAOYSA-N 0 3 410.562 4.181 20 0 HIADHN C[C@@H](NC(=O)NCC1(N2CCSCC2)CCCC1)c1ccc(C(F)(F)F)cc1 ZINC000410151986 855840401 /nfs/dbraw/zinc/84/04/01/855840401.db2.gz UTMFSAALTKAHDP-OAHLLOKOSA-N 0 3 415.525 4.427 20 0 HIADHN CC(C)[C@@H](NC(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1)c1ccc(F)cc1 ZINC000410221332 855867419 /nfs/dbraw/zinc/86/74/19/855867419.db2.gz VJQUZOUSSINNAM-JBYIUTFZSA-N 0 3 405.558 4.054 20 0 HIADHN COc1ccc(OCc2ccccn2)c(CNCCc2nc3c(cccc3C)o2)c1 ZINC000410354978 855945968 /nfs/dbraw/zinc/94/59/68/855945968.db2.gz RAWXDQUEZICARG-UHFFFAOYSA-N 0 3 403.482 4.451 20 0 HIADHN CN1CCN(Cc2ccc(CNC(=O)Nc3ccc(OC4CCCC4)cc3)cc2)CC1 ZINC000410368020 855955282 /nfs/dbraw/zinc/95/52/82/855955282.db2.gz SNGVTIFGERDJSR-UHFFFAOYSA-N 0 3 422.573 4.077 20 0 HIADHN CCC(CC)[C@@H](CCNC(=O)Nc1ccc(N2CCN(CC)CC2)cc1C)OC ZINC000437400036 862746675 /nfs/dbraw/zinc/74/66/75/862746675.db2.gz GZSVAPMPCIRIFH-JOCHJYFZSA-N 0 3 404.599 4.100 20 0 HIADHN CCN1CCC[C@@H](CN(C)C(=O)NCc2ccc(C3CCC3)cc2)[C@@H]1c1cnn(C)c1 ZINC000425950821 856014728 /nfs/dbraw/zinc/01/47/28/856014728.db2.gz AZKMOVBBDJETFR-LADGPHEKSA-N 0 3 423.605 4.302 20 0 HIADHN CCCN(C(=O)c1ccc(N(C)C(C)=O)cc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000425953534 856016085 /nfs/dbraw/zinc/01/60/85/856016085.db2.gz KLPAUKSCSASXMP-DEOSSOPVSA-N 0 3 407.558 4.186 20 0 HIADHN COC[C@H](c1ccc(Cl)cc1)N(C)C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000425977893 856027677 /nfs/dbraw/zinc/02/76/77/856027677.db2.gz NEQOMHXJFVSUCE-NJDAHSKKSA-N 0 3 401.938 4.114 20 0 HIADHN COc1ccccc1[C@@H](NC(=O)NCCCN1CCc2ccccc2C1)c1ccco1 ZINC000426045962 856070396 /nfs/dbraw/zinc/07/03/96/856070396.db2.gz DAZWNBPUFBIFQU-XMMPIXPASA-N 0 3 419.525 4.125 20 0 HIADHN COc1ccc(COC[C@@H](O)CN[C@@H](C)c2cc(Cl)ccc2Cl)cc1OC ZINC000426108896 856112657 /nfs/dbraw/zinc/11/26/57/856112657.db2.gz JVFPJBIQWVLCAD-BBRMVZONSA-N 0 3 414.329 4.239 20 0 HIADHN Cc1cccc2nc(CCC(=O)NC[C@H](c3cccc(Cl)c3)N3CCCC3)[nH]c21 ZINC000426162912 856147471 /nfs/dbraw/zinc/14/74/71/856147471.db2.gz UFBPKSHEGRELQP-HXUWFJFHSA-N 0 3 410.949 4.411 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)NCc1nc(-c2ccccc2F)cs1 ZINC000426217683 856183118 /nfs/dbraw/zinc/18/31/18/856183118.db2.gz YLIMCVINUDOYJN-MRXNPFEDSA-N 0 3 412.534 4.269 20 0 HIADHN C[C@@H]1CN(C2CCOCC2)CCN1C(=O)N[C@@H]1C[C@@H]2CCC(C)(C)c3cccc1c32 ZINC000426217218 856183136 /nfs/dbraw/zinc/18/31/36/856183136.db2.gz XMMOQMIOJROZQB-KGVIQGDOSA-N 0 3 411.590 4.181 20 0 HIADHN C[C@H](Sc1ccnc2cc(Cl)ccc21)C(=O)N1CC[C@@H](N2CCCCC2)C1 ZINC000426283752 856220618 /nfs/dbraw/zinc/22/06/18/856220618.db2.gz ZOIFLTFQQAMQRI-DOTOQJQBSA-N 0 3 403.979 4.456 20 0 HIADHN C[C@H](Sc1ccnc2cc(Cl)ccc21)C(=O)N1CC[C@H](N2CCCCC2)C1 ZINC000426283754 856220924 /nfs/dbraw/zinc/22/09/24/856220924.db2.gz ZOIFLTFQQAMQRI-RDJZCZTQSA-N 0 3 403.979 4.456 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N[C@@H]2c3ccccc3CC[C@H]2n2ccnc2)N(C)C)cc1 ZINC000426304544 856233452 /nfs/dbraw/zinc/23/34/52/856233452.db2.gz CWACNSFDVCYYPR-TZRRMPRUSA-N 0 3 417.557 4.022 20 0 HIADHN C[C@H](N[C@H]1c2cc(Br)ccc2CC1(C)C)c1ccc(S(N)(=O)=O)cc1 ZINC000426333534 856249992 /nfs/dbraw/zinc/24/99/92/856249992.db2.gz IEURMXOWKLJQRZ-SGTLLEGYSA-N 0 3 423.376 4.071 20 0 HIADHN CCOc1cc(CN(C)C/C(C)=C\c2ccccc2)ccc1O[C@H](C)C(=O)N(C)C ZINC000426376020 856264507 /nfs/dbraw/zinc/26/45/07/856264507.db2.gz HWOUBHUVJJRDQJ-RMWKRFJVSA-N 0 3 410.558 4.476 20 0 HIADHN Cc1nc2ccccc2n1CCc1noc([C@@H]2CN(C(C)(C)C)C[C@H]2C(F)(F)F)n1 ZINC000426462836 856303745 /nfs/dbraw/zinc/30/37/45/856303745.db2.gz UOAGZZCEMFLORG-HUUCEWRRSA-N 0 3 421.467 4.347 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)N[C@@H]1CCCC(F)(F)C1 ZINC000426605802 856370232 /nfs/dbraw/zinc/37/02/32/856370232.db2.gz PXDZBOMQFPXZRC-MRXNPFEDSA-N 0 3 407.427 4.357 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3nc(C(C)(C)C)cs3)CC2)C[C@@H](C)O1 ZINC000426633166 856384101 /nfs/dbraw/zinc/38/41/01/856384101.db2.gz CHVLOKKNUDXSPD-HZPDHXFCSA-N 0 3 408.612 4.184 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3nc4ccccc4s3)CC2)C[C@@H](C)O1 ZINC000426633812 856384907 /nfs/dbraw/zinc/38/49/07/856384907.db2.gz JIWJMUVOXFRJHS-HZPDHXFCSA-N 0 3 402.564 4.040 20 0 HIADHN Cc1ccc(-c2cc(C(=O)Nc3ccccc3OCCn3ccnc3)[nH]n2)c(C)c1 ZINC000426649247 856393265 /nfs/dbraw/zinc/39/32/65/856393265.db2.gz WSKIALDNFQVXGZ-UHFFFAOYSA-N 0 3 401.470 4.221 20 0 HIADHN C[C@H](CSc1ccc(F)cc1)C(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000426656073 856397127 /nfs/dbraw/zinc/39/71/27/856397127.db2.gz WHIIPRKPPUSBCW-GUDVDZBRSA-N 0 3 422.610 4.292 20 0 HIADHN Cc1cc(C)c(NC(=O)CN2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)c(Cl)c1 ZINC000426777840 856473361 /nfs/dbraw/zinc/47/33/61/856473361.db2.gz RBKJNUGDUYPNMS-KDURUIRLSA-N 0 3 422.013 4.107 20 0 HIADHN C[C@H](c1cccc(N2CCCS2(=O)=O)c1)N(C)CCSc1ccccc1F ZINC000426798483 856484586 /nfs/dbraw/zinc/48/45/86/856484586.db2.gz FHZFWKVPVMPJNB-MRXNPFEDSA-N 0 3 408.564 4.151 20 0 HIADHN COc1ccccc1[C@@H](NC(=O)N(CCN(C)C)Cc1cccs1)c1ccco1 ZINC000426821378 856497715 /nfs/dbraw/zinc/49/77/15/856497715.db2.gz SCEFQXZMXMTWSG-OAQYLSRUSA-N 0 3 413.543 4.213 20 0 HIADHN C[C@H](C(=O)Nc1ccc(C(=O)N(C)[C@H]2CCCN(C)C2)cc1)c1ccc(Cl)s1 ZINC000426947409 856556601 /nfs/dbraw/zinc/55/66/01/856556601.db2.gz DYIVKKROXCDRMW-YOEHRIQHSA-N 0 3 419.978 4.310 20 0 HIADHN C[C@H](C(=O)Nc1cccc(-c2cn(Cc3ccccc3)nn2)c1)N1[C@H](C)CC[C@@H]1C ZINC000426957085 856562145 /nfs/dbraw/zinc/56/21/45/856562145.db2.gz WQZWQCXZBHWDQA-CEXWTWQISA-N 0 3 403.530 4.193 20 0 HIADHN CN1CC[C@@H](NC(=O)c2cc3ccccc3n2CC(F)(F)F)[C@@H]1c1ccccc1 ZINC000426973319 856572201 /nfs/dbraw/zinc/57/22/01/856572201.db2.gz RVGDMQLHQQTPOI-XLIONFOSSA-N 0 3 401.432 4.379 20 0 HIADHN CCOC(=O)c1cc2cc(C(=O)N3CC[C@H](C)N(Cc4ccccc4)CC3)ccc2[nH]1 ZINC000437459365 862822612 /nfs/dbraw/zinc/82/26/12/862822612.db2.gz CSKBXLKLUONDLT-SFHVURJKSA-N 0 3 419.525 4.081 20 0 HIADHN Cc1ccc(-c2cc(C(=O)N(Cc3ccccc3)C3CCN(C)CC3)[nH]n2)c(C)c1 ZINC000427180234 856694869 /nfs/dbraw/zinc/69/48/69/856694869.db2.gz VJGJCXIFCBLQOH-UHFFFAOYSA-N 0 3 402.542 4.430 20 0 HIADHN Cc1ccc(C)n1-c1nc(CC(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)cs1 ZINC000437469751 862832123 /nfs/dbraw/zinc/83/21/23/862832123.db2.gz RSHXHNXTNPGGBG-GOSISDBHSA-N 0 3 422.598 4.216 20 0 HIADHN Cc1oc(-c2ccccc2)nc1C(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000427288132 856753936 /nfs/dbraw/zinc/75/39/36/856753936.db2.gz OCRMSMHEDCSHGM-HDICACEKSA-N 0 3 411.546 4.002 20 0 HIADHN Cc1ccc2nc(C)c(C(=O)N3CCC(CCN4C[C@@H](C)O[C@@H](C)C4)CC3)cc2c1 ZINC000427291615 856755596 /nfs/dbraw/zinc/75/55/96/856755596.db2.gz IFAAUDKXHWNMDM-KDURUIRLSA-N 0 3 409.574 4.203 20 0 HIADHN C[C@H]1CN(CCC2CCN(C(=O)c3ccc4c5c(cccc53)CC4)CC2)C[C@H](C)O1 ZINC000427292676 856755895 /nfs/dbraw/zinc/75/58/95/856755895.db2.gz SOKQPXHCHCUCGO-OALUTQOASA-N 0 3 406.570 4.290 20 0 HIADHN CSc1ccc(Cl)c(C(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)c1 ZINC000427298800 856758170 /nfs/dbraw/zinc/75/81/70/856758170.db2.gz GSKSXLMUAYTSBG-IYBDPMFKSA-N 0 3 411.011 4.413 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)[C@@H]3CCCC[C@H]3C(F)(F)F)CC2)C[C@H](C)O1 ZINC000427298140 856758777 /nfs/dbraw/zinc/75/87/77/856758777.db2.gz ZUYGPSQZAVTIOG-UKBAYJJMSA-N 0 3 404.517 4.093 20 0 HIADHN Cc1c(C(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)sc2nccc(C)c12 ZINC000427304272 856761006 /nfs/dbraw/zinc/76/10/06/856761006.db2.gz ISZQPDZDQYMJEN-IAGOWNOFSA-N 0 3 415.603 4.265 20 0 HIADHN Cc1ccc(Br)cc1C(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000427303433 856761138 /nfs/dbraw/zinc/76/11/38/856761138.db2.gz ACSRAPXVKIQGFZ-IAGOWNOFSA-N 0 3 423.395 4.109 20 0 HIADHN CCc1c(C(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)cnn1-c1ccc(F)cc1 ZINC000437471413 862833423 /nfs/dbraw/zinc/83/34/23/862833423.db2.gz KQGMIILINDZTTO-IBGZPJMESA-N 0 3 420.532 4.310 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)c3[nH]c4ccc(F)cc4c3Cl)CC2)C[C@H](C)O1 ZINC000427311919 856764250 /nfs/dbraw/zinc/76/42/50/856764250.db2.gz GAZJZSWQAVNFTM-GASCZTMLSA-N 0 3 421.944 4.312 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)[C@@H]3CCSc4ccccc43)CC2)C[C@H](C)O1 ZINC000427346721 856784749 /nfs/dbraw/zinc/78/47/49/856784749.db2.gz KUSMRPHWMOWUPN-LVCYWYKZSA-N 0 3 402.604 4.004 20 0 HIADHN Cc1c2cc(F)ccc2oc1C(=O)N1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000427361653 856793880 /nfs/dbraw/zinc/79/38/80/856793880.db2.gz GKJXUQRMZGNTIP-HOTGVXAUSA-N 0 3 402.510 4.232 20 0 HIADHN COc1ccc([C@@H](CN[C@@H](C)c2ncc(Br)cc2F)N2CCCC2)cc1 ZINC000427573545 856872783 /nfs/dbraw/zinc/87/27/83/856872783.db2.gz KEWSCWZAJJIDSC-IFXJQAMLSA-N 0 3 422.342 4.480 20 0 HIADHN Cc1ccc([C@H](NCc2ccccc2OCC(=O)NC[C@@H]2CCCO2)C2CCC2)cc1 ZINC000427608274 856887199 /nfs/dbraw/zinc/88/71/99/856887199.db2.gz GAKVKWOKQNDVHT-JYFHCDHNSA-N 0 3 422.569 4.300 20 0 HIADHN O=c1ccccn1Cc1ccc(CN[C@@H]2CCCc3ncc(C(F)(F)F)cc32)cc1 ZINC000427615753 856888314 /nfs/dbraw/zinc/88/83/14/856888314.db2.gz QENQVOSMKXWDQQ-HXUWFJFHSA-N 0 3 413.443 4.478 20 0 HIADHN C[C@@H]1CN(Cc2cccc(CN[C@H]3CCCc4ncc(C(F)(F)F)cc43)c2)CCO1 ZINC000427617930 856889258 /nfs/dbraw/zinc/88/92/58/856889258.db2.gz LNHRBVDECQTQBS-IERDGZPVSA-N 0 3 419.491 4.488 20 0 HIADHN Fc1ccc(Br)cc1[C@@H](N[C@@H]1CCn2ccnc2C1)c1ccccc1 ZINC000427875401 856990487 /nfs/dbraw/zinc/99/04/87/856990487.db2.gz SZKBVPLKGVEFMX-UZLBHIALSA-N 0 3 400.295 4.479 20 0 HIADHN Cc1sc(CNC(=O)[C@@H]2CCCN2C2CCOCC2)nc1-c1ccc(Cl)cc1 ZINC000427929000 857012029 /nfs/dbraw/zinc/01/20/29/857012029.db2.gz NIJGNIYYMMCTIA-SFHVURJKSA-N 0 3 419.978 4.032 20 0 HIADHN Cc1cc(C)c(CC(C(=O)Nc2ccc3c(c2)N(C(N)=O)CC3)C(F)(F)F)c(C)c1 ZINC000428027163 857047766 /nfs/dbraw/zinc/04/77/66/857047766.db2.gz KPWGFZUDOMGVLU-SFHVURJKSA-N 0 3 419.447 4.413 20 0 HIADHN COc1cccc(C(=O)CCCC(=O)NC2CCN(Cc3ccccc3C)CC2)c1 ZINC000428176745 857098381 /nfs/dbraw/zinc/09/83/81/857098381.db2.gz NPTLCJHXMRDTSK-UHFFFAOYSA-N 0 3 408.542 4.137 20 0 HIADHN C[C@H](Cn1cc(Br)ccc1=O)N[C@H]1CCSc2ccc(Cl)cc21 ZINC000428249876 857126449 /nfs/dbraw/zinc/12/64/49/857126449.db2.gz YRPZXBQAEMAIAJ-ABAIWWIYSA-N 0 3 413.768 4.479 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cccc(Br)c3F)c(C)c2)CC1 ZINC000428332785 857157460 /nfs/dbraw/zinc/15/74/60/857157460.db2.gz SGJCRBCLCZYZGL-UHFFFAOYSA-N 0 3 420.326 4.291 20 0 HIADHN CSc1nc(C2CC2)nc(C)c1C(=O)NC[C@]1(C)CCCN1Cc1ccccc1 ZINC000428337027 857160144 /nfs/dbraw/zinc/16/01/44/857160144.db2.gz KDUIGXFGZZAEPY-QHCPKHFHSA-N 0 3 410.587 4.169 20 0 HIADHN COc1cc(Cl)c(Br)cc1C(=O)NCc1ccccc1CN(C)C ZINC000428363253 857174648 /nfs/dbraw/zinc/17/46/48/857174648.db2.gz QFBMFNFEWXBWRR-UHFFFAOYSA-N 0 3 411.727 4.103 20 0 HIADHN COc1ccc(CCC(=O)N2CCCN(C[C@H](OC(C)C)c3ccccc3)CC2)cc1 ZINC000428405273 857193613 /nfs/dbraw/zinc/19/36/13/857193613.db2.gz XEIKFBMSLAFGTA-VWLOTQADSA-N 0 3 424.585 4.328 20 0 HIADHN COc1cc(CN2CC[C@@H](O)[C@H](C)C2)ccc1OCCOc1ccccc1Cl ZINC000428454648 857207827 /nfs/dbraw/zinc/20/78/27/857207827.db2.gz DEVOBHDQFYIRQI-VQIMIIECSA-N 0 3 405.922 4.009 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@@H](O)C2)c1)c1ccc(COc2ccccc2)cc1 ZINC000428527670 857242368 /nfs/dbraw/zinc/24/23/68/857242368.db2.gz BIJWRZNGHDTHLB-HSZRJFAPSA-N 0 3 402.494 4.085 20 0 HIADHN CC(C)OCc1c2ccccc2oc1C(=O)Nc1cccc(CN2CC[C@@H](O)C2)c1 ZINC000428530850 857244514 /nfs/dbraw/zinc/24/45/14/857244514.db2.gz BYOIIZXBWFOFOB-LJQANCHMSA-N 0 3 408.498 4.177 20 0 HIADHN Fc1ccc(-c2nc(CNC[C@@H]3CN(Cc4ccccc4)CCCO3)cs2)cc1 ZINC000428543132 857253946 /nfs/dbraw/zinc/25/39/46/857253946.db2.gz GYZMHQWPVJJEQK-JOCHJYFZSA-N 0 3 411.546 4.330 20 0 HIADHN O=C(CCCc1ccc(Br)s1)Nc1cccc(CN2CC[C@H](O)C2)c1 ZINC000428544432 857256155 /nfs/dbraw/zinc/25/61/55/857256155.db2.gz JQTNJVTVXAPDDS-INIZCTEOSA-N 0 3 423.376 4.039 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)c1cc2c(cc(Cl)cc2Cl)[nH]1 ZINC000428545640 857256669 /nfs/dbraw/zinc/25/66/69/857256669.db2.gz JJZUQOBNPCTZQP-HNNXBMFYSA-N 0 3 404.297 4.294 20 0 HIADHN CC[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)Nc1cccc(CN2CC[C@H](O)C2)c1 ZINC000428555202 857263301 /nfs/dbraw/zinc/26/33/01/857263301.db2.gz XKQLIBZHLLBFNM-NQIIRXRSSA-N 0 3 420.475 4.479 20 0 HIADHN COc1ccc(Br)c(CN(C)C(=O)Nc2cccc(CN(C)C)c2)c1 ZINC000428691248 857298915 /nfs/dbraw/zinc/29/89/15/857298915.db2.gz UZWVPQVTMNYJQA-UHFFFAOYSA-N 0 3 406.324 4.183 20 0 HIADHN CCN1CCCN(C(=O)N[C@@H](C)c2ccc(OCc3ccccc3)c(OC)c2)CC1 ZINC000428712258 857306447 /nfs/dbraw/zinc/30/64/47/857306447.db2.gz PZIVTLHZVPLBFH-IBGZPJMESA-N 0 3 411.546 4.072 20 0 HIADHN CN(Cc1c[nH]nc1-c1ccsc1)C[C@H](O)COc1ccccc1C(F)(F)F ZINC000437578576 862896124 /nfs/dbraw/zinc/89/61/24/862896124.db2.gz GOOIHORFUOFKDB-HNNXBMFYSA-N 0 3 411.449 4.029 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N[C@](C)(CC)c3nc(C)cs3)c(C)c2)CC1 ZINC000437581714 862898638 /nfs/dbraw/zinc/89/86/38/862898638.db2.gz UEJHDKUMBWGPLY-JOCHJYFZSA-N 0 3 415.607 4.349 20 0 HIADHN CCCCc1nc(CN(Cc2ccncc2)[C@@H]2CCCN(Cc3ccccc3)C2)no1 ZINC000428810357 857355168 /nfs/dbraw/zinc/35/51/68/857355168.db2.gz YBUVXLIWEMESQM-HSZRJFAPSA-N 0 3 419.573 4.474 20 0 HIADHN O[C@@H](CNCc1ccc(C(F)(F)F)s1)COc1ccccc1Br ZINC000428877032 857383756 /nfs/dbraw/zinc/38/37/56/857383756.db2.gz RILFYDIFFWZNIY-JTQLQIEISA-N 0 3 410.255 4.059 20 0 HIADHN CCc1nc2cc(NC(=O)N3CCC(CCN4C[C@H](C)O[C@@H](C)C4)CC3)ccc2o1 ZINC000428889227 857393623 /nfs/dbraw/zinc/39/36/23/857393623.db2.gz VWNMZVFKTDUABZ-IRXDYDNUSA-N 0 3 414.550 4.133 20 0 HIADHN Cc1c(C(=O)N(C)C[C@]2(O)CCN(Cc3ccccc3)C2)oc2c1c(C)ccc2C ZINC000428974251 857441565 /nfs/dbraw/zinc/44/15/65/857441565.db2.gz ZBLWVKJHIACUPT-RUZDIDTESA-N 0 3 406.526 4.067 20 0 HIADHN C[C@H](c1ccccc1Cl)N(C)C(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000429007422 857455099 /nfs/dbraw/zinc/45/50/99/857455099.db2.gz KAWUTAWXDWHBFE-UYAOXDASSA-N 0 3 415.965 4.334 20 0 HIADHN C/C(=C/c1ccccc1)CN(C)C(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000429019247 857459375 /nfs/dbraw/zinc/45/93/75/857459375.db2.gz IQEXJTXBJQZRLE-RTWFUWSXSA-N 0 3 407.558 4.022 20 0 HIADHN CCOc1ccc(NC(=O)NC[C@H]2CN(Cc3ccccc3)CCCO2)cc1Cl ZINC000429045997 857474393 /nfs/dbraw/zinc/47/43/93/857474393.db2.gz UEZZRMAUCBAUQR-IBGZPJMESA-N 0 3 417.937 4.151 20 0 HIADHN CC[C@H]1c2ccsc2CCN1C(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000429053339 857479983 /nfs/dbraw/zinc/47/99/83/857479983.db2.gz MROMPOAOCAQEQS-FPOVZHCZSA-N 0 3 413.587 4.058 20 0 HIADHN CCOc1ccc(NC(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)cc1Cl ZINC000429113700 857515369 /nfs/dbraw/zinc/51/53/69/857515369.db2.gz XUCUOJLVGSWMRN-IAGOWNOFSA-N 0 3 423.985 4.482 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Nc3cccc(C(F)(F)F)c3)CC2)C[C@H](C)O1 ZINC000429213529 857557717 /nfs/dbraw/zinc/55/77/17/857557717.db2.gz UJCMIWVLKFCJCT-IYBDPMFKSA-N 0 3 413.484 4.449 20 0 HIADHN C[C@@H](NC(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1)c1ccc(Cl)cc1 ZINC000429218897 857560813 /nfs/dbraw/zinc/56/08/13/857560813.db2.gz ZWWPQRJZRVLXOV-FGTMMUONSA-N 0 3 407.986 4.322 20 0 HIADHN CCCn1ccnc1CCCN(C)CC(=O)Nc1nc(-c2ccc(F)cc2)cs1 ZINC000429228107 857564622 /nfs/dbraw/zinc/56/46/22/857564622.db2.gz QSTZGKANMVUTRI-UHFFFAOYSA-N 0 3 415.538 4.059 20 0 HIADHN CC(=O)Nc1cccc(CN[C@@H](Cc2ccc(F)cc2)[C@@H]2COc3ccccc3O2)c1 ZINC000429244417 857570610 /nfs/dbraw/zinc/57/06/10/857570610.db2.gz GFLYPWYKAGWHDB-DHLKQENFSA-N 0 3 420.484 4.325 20 0 HIADHN CCCn1ccnc1CCCN(C)CC(=O)N[C@H](C)c1ccc(Cl)cc1Cl ZINC000429246940 857572625 /nfs/dbraw/zinc/57/26/25/857572625.db2.gz UXRLXNNJYNDJEQ-OAHLLOKOSA-N 0 3 411.377 4.342 20 0 HIADHN CCCn1ccnc1CCCN(C)CC(=O)N1CC[C@H](C)Sc2ccccc21 ZINC000429247027 857572678 /nfs/dbraw/zinc/57/26/78/857572678.db2.gz VDGKGIJXXBGJQN-SFHVURJKSA-N 0 3 400.592 4.075 20 0 HIADHN CC(C)(C(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1)c1ccccc1Cl ZINC000429331966 857606136 /nfs/dbraw/zinc/60/61/36/857606136.db2.gz WKQJPOLRQLIKRJ-IBGZPJMESA-N 0 3 400.950 4.025 20 0 HIADHN C[C@H](NC[C@@H]1CN(Cc2ccccc2)CCCO1)c1nc2ccc(Cl)cc2n1C ZINC000429430454 857663398 /nfs/dbraw/zinc/66/33/98/857663398.db2.gz LVPBLSNOOGEMCX-FXAWDEMLSA-N 0 3 412.965 4.168 20 0 HIADHN COCCS(=O)(=O)c1ccc(CN[C@@H](CC2CC2)c2ccc(Cl)cc2)cc1 ZINC000429433730 857664736 /nfs/dbraw/zinc/66/47/36/857664736.db2.gz WGCPVHMVRLVLCS-NRFANRHFSA-N 0 3 407.963 4.391 20 0 HIADHN COCCS(=O)(=O)c1ccc(CN[C@H](CC2CC2)c2ccc(Cl)cc2)cc1 ZINC000429433731 857664960 /nfs/dbraw/zinc/66/49/60/857664960.db2.gz WGCPVHMVRLVLCS-OAQYLSRUSA-N 0 3 407.963 4.391 20 0 HIADHN COc1ccc([C@@H](NC2CCN(c3cccnn3)CC2)c2ccccc2Cl)cc1 ZINC000429434477 857665892 /nfs/dbraw/zinc/66/58/92/857665892.db2.gz SBNOJBXPTFBXSD-HSZRJFAPSA-N 0 3 408.933 4.487 20 0 HIADHN Cc1nc(CN(C)C(=O)N[C@@H](CN2CCc3ccccc3C2)C(C)(C)C)cs1 ZINC000429496943 857698123 /nfs/dbraw/zinc/69/81/23/857698123.db2.gz WQEUIRVHJWIPSM-FQEVSTJZSA-N 0 3 400.592 4.066 20 0 HIADHN COC1(C[C@H](C)N[C@@H](c2ccc(F)cc2)c2cccc(S(C)(=O)=O)c2)CCC1 ZINC000429526014 857717754 /nfs/dbraw/zinc/71/77/54/857717754.db2.gz HTQICUMAOPATGR-KKSFZXQISA-N 0 3 405.535 4.256 20 0 HIADHN COC1(C[C@H](C)N[C@H](c2ccc(F)cc2)c2cccc(S(C)(=O)=O)c2)CCC1 ZINC000429526011 857718408 /nfs/dbraw/zinc/71/84/08/857718408.db2.gz HTQICUMAOPATGR-HRAATJIYSA-N 0 3 405.535 4.256 20 0 HIADHN CO[C@@H]1CCCC[C@@H]1NCC(=O)N1N=C(c2cccs2)C[C@H]1c1cccs1 ZINC000429530448 857723250 /nfs/dbraw/zinc/72/32/50/857723250.db2.gz SPKKDDPYYOHUFP-BHYGNILZSA-N 0 3 403.573 4.035 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)Nc2ccnn2Cc2ccc(F)cc2)C1 ZINC000429597353 857778909 /nfs/dbraw/zinc/77/89/09/857778909.db2.gz MUCSFKGNQXLKLM-UWJYYQICSA-N 0 3 407.493 4.028 20 0 HIADHN C[C@@H]1CCN(C(=O)NC[C@H](c2ccccc2)C(C)(C)CO)CCN1Cc1ccccc1 ZINC000437628116 862951259 /nfs/dbraw/zinc/95/12/59/862951259.db2.gz QQRUUVRPLCUROC-ZJSXRUAMSA-N 0 3 423.601 4.095 20 0 HIADHN Cc1c(NC(=O)NC[C@H]2CN(Cc3ccccc3)CCCO2)cccc1C(F)(F)F ZINC000429622945 857803537 /nfs/dbraw/zinc/80/35/37/857803537.db2.gz GZDSWRILXGVTAO-SFHVURJKSA-N 0 3 421.463 4.426 20 0 HIADHN Clc1ccccc1[C@H]1CN(C[C@H]2CN(Cc3ccccc3)CCCO2)CCO1 ZINC000429685727 857834982 /nfs/dbraw/zinc/83/49/82/857834982.db2.gz XOKHXKRZDYTXHN-NFBKMPQASA-N 0 3 400.950 4.004 20 0 HIADHN Cc1ccc(NC(=O)NC[C@H]2CN(Cc3ccccc3)CCCO2)cc1OC(F)F ZINC000429753533 857872422 /nfs/dbraw/zinc/87/24/22/857872422.db2.gz RRLJFAJFEANSBI-IBGZPJMESA-N 0 3 419.472 4.009 20 0 HIADHN C[C@@H](C(=O)Nc1ccc(CCN2CCSCC2)cc1)[C@H]1OCCc2sccc21 ZINC000429890923 857929119 /nfs/dbraw/zinc/92/91/19/857929119.db2.gz PZXYEMSTIVPJAJ-IIBYNOLFSA-N 0 3 416.612 4.228 20 0 HIADHN CCN(CC)C(=O)CCC1CCN(Cc2cnc(-c3ccccc3OC)nc2)CC1 ZINC000430068526 858019114 /nfs/dbraw/zinc/01/91/14/858019114.db2.gz FVMWXIVNONCJBI-UHFFFAOYSA-N 0 3 410.562 4.013 20 0 HIADHN Cc1[nH]c2ccc(Cl)cc2c1C(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000430107206 858034015 /nfs/dbraw/zinc/03/40/15/858034015.db2.gz PPKOFGCTHLVBPM-LJQANCHMSA-N 0 3 411.933 4.151 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)NCc1c(F)cc(F)c(F)c1F)c1ccsc1 ZINC000430200291 858079391 /nfs/dbraw/zinc/07/93/91/858079391.db2.gz UHMCEXGWVHKEKU-HNNXBMFYSA-N 0 3 403.445 4.187 20 0 HIADHN CCC[C@H](NC(=O)[C@@H](C)N1CC[C@H](C(=O)N(C)c2ccccc2)C1)c1ccccc1 ZINC000430290347 858109889 /nfs/dbraw/zinc/10/98/89/858109889.db2.gz CCMQRJVIRZWZKX-NWSQWKLXSA-N 0 3 407.558 4.017 20 0 HIADHN CN(C(=O)c1cccc(CN2CCCC2)c1)[C@H]1c2cc(Cl)cc(Cl)c2C[C@@H]1O ZINC000430423429 858154570 /nfs/dbraw/zinc/15/45/70/858154570.db2.gz GCYGOBRSYGBUFY-SFTDATJTSA-N 0 3 419.352 4.320 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)NC[C@]1(Cc2ccc(F)cc2)CCC[C@H]1O ZINC000430481593 858190100 /nfs/dbraw/zinc/19/01/00/858190100.db2.gz GUNZKYUNFQNTIW-RCZVLFRGSA-N 0 3 424.516 4.137 20 0 HIADHN COc1ccccc1-n1nccc1CN1CCC[C@H]1Cn1c(C)nc2ccccc21 ZINC000430750612 858287856 /nfs/dbraw/zinc/28/78/56/858287856.db2.gz OTCVCPPWDKZGQF-IBGZPJMESA-N 0 3 401.514 4.204 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)NCc1c(F)cc(F)c(F)c1F ZINC000430936764 858374332 /nfs/dbraw/zinc/37/43/32/858374332.db2.gz WTJBWEVEAHLISR-AWEZNQCLSA-N 0 3 409.427 4.049 20 0 HIADHN O=C1N[C@@H](c2ccc3ccccc3c2)C(=O)N1C[C@@H](c1cccs1)N1CCCC1 ZINC000430971899 858387111 /nfs/dbraw/zinc/38/71/11/858387111.db2.gz NFMXAIYLJPQNLN-FPOVZHCZSA-N 0 3 405.523 4.331 20 0 HIADHN O=C1N[C@H](c2ccc(Cl)cc2Cl)C(=O)N1C[C@@H](c1cccs1)N1CCCC1 ZINC000430976218 858387892 /nfs/dbraw/zinc/38/78/92/858387892.db2.gz RDHMOKVTIMWXJC-DOTOQJQBSA-N 0 3 424.353 4.485 20 0 HIADHN CCCN(C(=O)c1cccs1)C1CCN(CCc2nc(-c3ccccc3)no2)CC1 ZINC000431155073 858474971 /nfs/dbraw/zinc/47/49/71/858474971.db2.gz BJMMUJTZBFIPSX-UHFFFAOYSA-N 0 3 424.570 4.357 20 0 HIADHN O=C1N[C@H](c2ccc(Cl)c(F)c2)C(=O)N1C[C@@H]1CCCN(Cc2cccs2)C1 ZINC000431169646 858483910 /nfs/dbraw/zinc/48/39/10/858483910.db2.gz MWAYWTFKTVYOBB-FZKQIMNGSA-N 0 3 421.925 4.046 20 0 HIADHN COC(=O)c1ccc(COc2ccccc2CN2CCC(n3ccnc3)CC2)cc1 ZINC000437693512 863030955 /nfs/dbraw/zinc/03/09/55/863030955.db2.gz ODIGKDWRZFPYAW-UHFFFAOYSA-N 0 3 405.498 4.086 20 0 HIADHN CCC(CC)n1ccc(C(=O)N(CCN(C)C)Cc2ccc(Br)cc2)n1 ZINC000431780729 858808497 /nfs/dbraw/zinc/80/84/97/858808497.db2.gz GRVFPTDWMUZVND-UHFFFAOYSA-N 0 3 421.383 4.211 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)c1c(Cl)cc(F)cc1Cl ZINC000431842220 858836269 /nfs/dbraw/zinc/83/62/69/858836269.db2.gz GUFBOTCOZBTIAM-UHFFFAOYSA-N 0 3 411.304 4.019 20 0 HIADHN COc1cnccc1N1CCN(C(=O)Nc2c(F)cc(F)cc2-c2ccccc2)CC1 ZINC000431970964 858894891 /nfs/dbraw/zinc/89/48/91/858894891.db2.gz JIQHCHPBOVREAV-UHFFFAOYSA-N 0 3 424.451 4.390 20 0 HIADHN COc1cnccc1N1CCN(C(=O)Nc2cccc(Oc3ccccc3)c2)CC1 ZINC000431977971 858898739 /nfs/dbraw/zinc/89/87/39/858898739.db2.gz RRLRCFMLVWULRI-UHFFFAOYSA-N 0 3 404.470 4.237 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)C1(Cc2ccc(F)cc2)CCOCC1)c1ccsc1 ZINC000432007784 858922537 /nfs/dbraw/zinc/92/25/37/858922537.db2.gz RULFIQYJZWDRQL-NRFANRHFSA-N 0 3 418.578 4.426 20 0 HIADHN CCc1ccc([C@H](CNC(=O)C2(Cc3cccc(F)c3)CCOCC2)N(C)C)cc1 ZINC000432055713 858954554 /nfs/dbraw/zinc/95/45/54/858954554.db2.gz TYFQGSWGVKPDRC-QHCPKHFHSA-N 0 3 412.549 4.147 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)cc1 ZINC000432329359 859105534 /nfs/dbraw/zinc/10/55/34/859105534.db2.gz OSWSOABNXOQXSU-XMSQKQJNSA-N 0 3 420.532 4.409 20 0 HIADHN O=C(NC[C@H]1CN(Cc2ccccc2)CCCO1)N1CC2(CCC2)[C@@H]1c1ccccc1 ZINC000432347377 859113600 /nfs/dbraw/zinc/11/36/00/859113600.db2.gz OWDFLOLLQSEXCJ-ZEQRLZLVSA-N 0 3 419.569 4.214 20 0 HIADHN Cc1nn(C(C)(C)C)cc1[C@@H](C)NC(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000467565349 881387755 /nfs/dbraw/zinc/38/77/55/881387755.db2.gz UMUNLAPOGDJEAU-QAPCUYQASA-N 0 3 403.596 4.205 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)C2(Cc3ccc(F)cc3)CCOCC2)C1 ZINC000432420149 859156102 /nfs/dbraw/zinc/15/61/02/859156102.db2.gz JEEOWQIMZHXYQJ-AUSIDOKSSA-N 0 3 410.533 4.117 20 0 HIADHN CN(C)CCN(C(=O)Nc1ccc(F)cc1-c1nc(C2CC2)no1)C1CCCC1 ZINC000467566617 881388690 /nfs/dbraw/zinc/38/86/90/881388690.db2.gz KDPFQABKVGSFQQ-UHFFFAOYSA-N 0 3 401.486 4.091 20 0 HIADHN CN(C(=O)c1cncc(-c2ccc3c(c2)CCO3)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000432757658 859338217 /nfs/dbraw/zinc/33/82/17/859338217.db2.gz KREMCAQGQMYWCX-XMMPIXPASA-N 0 3 413.521 4.030 20 0 HIADHN CN(C)Cc1ccc(S(=O)(=O)NC(c2ccc(F)cc2)c2ccc(F)cc2)cc1 ZINC000432854007 859389761 /nfs/dbraw/zinc/38/97/61/859389761.db2.gz WLLMWERNAXPSOG-UHFFFAOYSA-N 0 3 416.493 4.094 20 0 HIADHN Cc1cnc(C2CCN(C(=O)NCC(C)(C)N3CCc4ccccc4C3)CC2)s1 ZINC000432860108 859392267 /nfs/dbraw/zinc/39/22/67/859392267.db2.gz RCLHMUGMVZOGPU-UHFFFAOYSA-N 0 3 412.603 4.177 20 0 HIADHN Cc1nc(-c2ccc([C@H](C)NS(=O)(=O)c3ccc(CN(C)C)cc3)cc2)cs1 ZINC000432864177 859394870 /nfs/dbraw/zinc/39/48/70/859394870.db2.gz DCBSASCLKSATFB-HNNXBMFYSA-N 0 3 415.584 4.220 20 0 HIADHN C[C@@H]1C[C@H]1c1ccc(CN(CCC(=O)Nc2ccc(C(N)=O)c(Cl)c2)C2CC2)o1 ZINC000432895694 859414878 /nfs/dbraw/zinc/41/48/78/859414878.db2.gz YXCMLEXVJHJVOI-FZKQIMNGSA-N 0 3 415.921 4.149 20 0 HIADHN C[C@H]1C[C@H]1c1ccc(CN(CCC(=O)Nc2ccc(C(N)=O)c(Cl)c2)C2CC2)o1 ZINC000432895695 859415353 /nfs/dbraw/zinc/41/53/53/859415353.db2.gz YXCMLEXVJHJVOI-SCLBCKFNSA-N 0 3 415.921 4.149 20 0 HIADHN COc1cc(C)c(S(=O)(=O)[N-]c2cc(C[NH+]3CCCC3)ccc2C)cc1Cl ZINC000432964123 859452063 /nfs/dbraw/zinc/45/20/63/859452063.db2.gz DGKWCIOKQYXOCL-UHFFFAOYSA-N 0 3 408.951 4.362 20 0 HIADHN C[C@@H]1OCC[C@]1(O)CN[C@H](Cc1ccccc1F)c1ccccc1Br ZINC000433004497 859473984 /nfs/dbraw/zinc/47/39/84/859473984.db2.gz YXGFHUWBDWALDN-KPOBHBOGSA-N 0 3 408.311 4.002 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)NCCC2CC(OC(C)(C)C)C2)N2CCCC2)cc1 ZINC000433040048 859494536 /nfs/dbraw/zinc/49/45/36/859494536.db2.gz OTHRNHWZYZEBOF-KITAHSCOSA-N 0 3 401.595 4.415 20 0 HIADHN CCc1ccc([C@H]2CCN(Cc3nnc(-c4cc(OC)c(OC)c(OC)c4)o3)C2)cc1 ZINC000433044845 859497142 /nfs/dbraw/zinc/49/71/42/859497142.db2.gz KNLAIVFZQYTQDP-SFHVURJKSA-N 0 3 423.513 4.314 20 0 HIADHN O=C(CN1CCC[C@H](c2ccccc2)C1)N1CCC[C@@H]1c1ccc2c(c1)OCCO2 ZINC000433067555 859507038 /nfs/dbraw/zinc/50/70/38/859507038.db2.gz LEQDTJZJGGXTFJ-FCHUYYIVSA-N 0 3 406.526 4.001 20 0 HIADHN O=C(CN1CCC[C@@H](c2ccccc2)C1)N1CCC[C@H]1c1ccc2c(c1)OCCO2 ZINC000433067562 859507359 /nfs/dbraw/zinc/50/73/59/859507359.db2.gz LEQDTJZJGGXTFJ-YADHBBJMSA-N 0 3 406.526 4.001 20 0 HIADHN Cc1cc(C)c(CC(C(=O)Nc2n[nH]c(-c3ccncc3)n2)C(F)(F)F)c(C)c1 ZINC000433089394 859518660 /nfs/dbraw/zinc/51/86/60/859518660.db2.gz ONAWNKLPQHYHJS-INIZCTEOSA-N 0 3 403.408 4.152 20 0 HIADHN CCn1cccc(CN[C@@H](C)CC(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)c1=O ZINC000433096501 859519499 /nfs/dbraw/zinc/51/94/99/859519499.db2.gz IJPXEHFCKDKPQL-LBPRGKRZSA-N 0 3 415.843 4.047 20 0 HIADHN Cn1c2ccc(C(F)(F)F)cc2nc1CNCC1(CO)CC(c2ccccc2)C1 ZINC000433185063 859559151 /nfs/dbraw/zinc/55/91/51/859559151.db2.gz ABAXSXRWLWZKEA-UHFFFAOYSA-N 0 3 403.448 4.238 20 0 HIADHN COc1ccc(CNC[C@@H]2CCCN(c3ccccc3)C2)c(Br)c1O ZINC000433192209 859560220 /nfs/dbraw/zinc/56/02/20/859560220.db2.gz YHLVPZVOWSZCLT-HNNXBMFYSA-N 0 3 405.336 4.170 20 0 HIADHN COc1ccc(CNC[C@H]2CCCN(c3ccccc3)C2)c(Br)c1O ZINC000433192212 859560806 /nfs/dbraw/zinc/56/08/06/859560806.db2.gz YHLVPZVOWSZCLT-OAHLLOKOSA-N 0 3 405.336 4.170 20 0 HIADHN CN(C)Cc1ccccc1C(=O)N1CCO[C@H](c2cc(F)c(Cl)cc2Cl)C1 ZINC000433345194 859657310 /nfs/dbraw/zinc/65/73/10/859657310.db2.gz WTSWXNBMXQBNLK-IBGZPJMESA-N 0 3 411.304 4.408 20 0 HIADHN CCNC(=O)c1ccc(CN[C@H](C)c2ccc(OC[C@H]3CCCCO3)c(F)c2)cc1 ZINC000433371416 859661644 /nfs/dbraw/zinc/66/16/44/859661644.db2.gz AZWJSGITAVAZHP-DYESRHJHSA-N 0 3 414.521 4.374 20 0 HIADHN Cc1cccc(C(=O)NCCN[C@H](C)c2ccc(OC[C@H]3CCCCO3)c(F)c2)c1 ZINC000433391502 859671923 /nfs/dbraw/zinc/67/19/23/859671923.db2.gz RWNBMDIJWIJZOU-WIYYLYMNSA-N 0 3 414.521 4.163 20 0 HIADHN C[C@H](NC[C@@H](O)COc1ccc(F)cc1)c1ccc(OC[C@@H]2CCCCO2)c(F)c1 ZINC000433397455 859676089 /nfs/dbraw/zinc/67/60/89/859676089.db2.gz IYVQIBPDPCDQLB-SCWSEQNSSA-N 0 3 421.484 4.003 20 0 HIADHN Cc1cccc(Cl)c1NC(=O)NCCCN1CCN(C)C[C@@H]1c1ccccc1 ZINC000467661809 881456219 /nfs/dbraw/zinc/45/62/19/881456219.db2.gz JEXKTVVTVVLEBJ-HXUWFJFHSA-N 0 3 400.954 4.149 20 0 HIADHN C[C@@H]1COCC[C@H]1NC(=O)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000433453099 859709745 /nfs/dbraw/zinc/70/97/45/859709745.db2.gz YCARSFPTJMAVCG-DNVCBOLYSA-N 0 3 414.377 4.026 20 0 HIADHN CCN(C(=O)NCCC1CC(OC(C)(C)C)C1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000433485612 859727243 /nfs/dbraw/zinc/72/72/43/859727243.db2.gz HVUAKIOTGQLSFD-ATKRNPRHSA-N 0 3 401.595 4.276 20 0 HIADHN O=C(N[C@H](c1cc(F)ccc1F)C(F)F)N1CCCN(Cc2ccccc2)CC1 ZINC000433616567 859811585 /nfs/dbraw/zinc/81/15/85/859811585.db2.gz KUZMDENMRSQZLS-LJQANCHMSA-N 0 3 409.427 4.189 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N[C@@H](c2cc(F)ccc2F)C(F)F)C1 ZINC000433628207 859816732 /nfs/dbraw/zinc/81/67/32/859816732.db2.gz JIDRDSWPVKHZQU-AZOIQLNYSA-N 0 3 409.427 4.406 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)Nc3ccc(Oc4ncc(Cl)cn4)c(Cl)c3)[C@H]2C1 ZINC000433670864 859832920 /nfs/dbraw/zinc/83/29/20/859832920.db2.gz SZQCHENCLWTCFX-LRDDRELGSA-N 0 3 422.316 4.134 20 0 HIADHN CCNC(=O)Nc1cccc(NC(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)c1C ZINC000433741304 859868979 /nfs/dbraw/zinc/86/89/79/859868979.db2.gz HGYRRDDTDTZINX-QFIPXVFZSA-N 0 3 423.561 4.403 20 0 HIADHN Cc1cc(NC(=O)c2noc3c2C[C@@H](C)CC3)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000433862285 859939450 /nfs/dbraw/zinc/93/94/50/859939450.db2.gz KENCYXFUQCVHIP-QFBILLFUSA-N 0 3 419.529 4.004 20 0 HIADHN Cc1c(NC(=O)N(Cc2ccccc2)C2CCN(C)CC2)noc1-c1ccccc1F ZINC000433898036 859956484 /nfs/dbraw/zinc/95/64/84/859956484.db2.gz QTECFERNSHPVAC-UHFFFAOYSA-N 0 3 422.504 4.917 20 0 HIADHN O=C(NC[C@H]1CCCCN1C1CC1)N[C@@H](Cc1ccc(Cl)cc1)c1ccccn1 ZINC000433951729 859997809 /nfs/dbraw/zinc/99/78/09/859997809.db2.gz BPVNGRARWHPKLJ-IRLDBZIGSA-N 0 3 412.965 4.335 20 0 HIADHN Cc1ccc(-c2nc(CC(=O)N[C@H]3C[C@@H](C)N(Cc4ccccc4)C3)cs2)cc1 ZINC000467695368 881489092 /nfs/dbraw/zinc/48/90/92/881489092.db2.gz QXIJLWVIURGKPO-NQIIRXRSSA-N 0 3 405.567 4.440 20 0 HIADHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(C)c(NC(=O)c2ccccc2F)c1 ZINC000434019624 860044343 /nfs/dbraw/zinc/04/43/43/860044343.db2.gz AORCECQZRQBGGE-MOPGFXCFSA-N 0 3 409.505 4.085 20 0 HIADHN O=C(NC[C@H]1CCCN1Cc1ccccc1)Nc1cccc(-c2noc(C3CC3)n2)c1 ZINC000434060626 860071758 /nfs/dbraw/zinc/07/17/58/860071758.db2.gz ZOWNSDREYDMWHG-OAQYLSRUSA-N 0 3 417.513 4.400 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1cnn(Cc2ccccc2)c1 ZINC000467701822 881497340 /nfs/dbraw/zinc/49/73/40/881497340.db2.gz ZBDWFJWNTGXJIF-HXUWFJFHSA-N 0 3 403.530 4.060 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)N1CC[C@@H](CC(F)(F)F)C1 ZINC000434143854 860141518 /nfs/dbraw/zinc/14/15/18/860141518.db2.gz JLZZBJDURLQGHP-INIZCTEOSA-N 0 3 401.498 4.084 20 0 HIADHN C[C@H]1CN(C2CC2)C[C@H]1NC(=O)c1cc(-c2ccc(F)cc2)nc2onc(C3CC3)c21 ZINC000467718117 881516886 /nfs/dbraw/zinc/51/68/86/881516886.db2.gz LBOYXXDXASIYEH-RNODOKPDSA-N 0 3 420.488 4.119 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)[C@H](C)Oc1cccc(C)c1 ZINC000434308885 860271283 /nfs/dbraw/zinc/27/12/83/860271283.db2.gz PZTBPWFOLRFJDV-UNMCSNQZSA-N 0 3 418.541 4.353 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)Cc1c[nH]c2ccccc12 ZINC000434313946 860274341 /nfs/dbraw/zinc/27/43/41/860274341.db2.gz CEAJXTRZPDPNKQ-OAQYLSRUSA-N 0 3 413.525 4.301 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1cc(C(C)(C)C)on1 ZINC000434315686 860275449 /nfs/dbraw/zinc/27/54/49/860275449.db2.gz KHJDXTTUZJSTON-SFHVURJKSA-N 0 3 407.518 4.176 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)C[C@@H](C)c1cccnc1 ZINC000434315603 860276193 /nfs/dbraw/zinc/27/61/93/860276193.db2.gz CZWDPKXJNGTMAB-XMSQKQJNSA-N 0 3 403.530 4.166 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)[C@H](C)COc1ccccc1 ZINC000434333172 860295023 /nfs/dbraw/zinc/29/50/23/860295023.db2.gz DOKIQNXMJPJTJS-IRLDBZIGSA-N 0 3 418.541 4.292 20 0 HIADHN C[C@H]1CCN(C(=O)c2ccc(-c3nc(C4CC4)no3)cc2)CCN1Cc1ccccc1 ZINC000434351061 860306720 /nfs/dbraw/zinc/30/67/20/860306720.db2.gz IWSHZUDJGHEUNA-SFHVURJKSA-N 0 3 416.525 4.351 20 0 HIADHN O=C(NC[C@@H]1CCCCN1C1CC1)N(Cc1csc(Br)c1)C1CC1 ZINC000434355270 860308075 /nfs/dbraw/zinc/30/80/75/860308075.db2.gz MFYHIMFWSOODCD-INIZCTEOSA-N 0 3 412.397 4.202 20 0 HIADHN CC(C)n1ncc2c1nc(-c1ccco1)cc2C(=O)NC[C@H]1CCCCN1C1CC1 ZINC000434424566 860344168 /nfs/dbraw/zinc/34/41/68/860344168.db2.gz JMKHZKVELOFPCF-QGZVFWFLSA-N 0 3 407.518 4.019 20 0 HIADHN Cc1ccc(C(=O)NC[C@H]2CCCCN2C2CC2)cc1NC(=O)Nc1ccccc1 ZINC000434445142 860354517 /nfs/dbraw/zinc/35/45/17/860354517.db2.gz MYOZVBNWYIRILI-OAQYLSRUSA-N 0 3 406.530 4.386 20 0 HIADHN Cc1cc2sc(NC(=O)N3CCC(CN4C[C@@H](C)O[C@H](C)C4)CC3)nc2cc1F ZINC000434527632 860387139 /nfs/dbraw/zinc/38/71/39/860387139.db2.gz XVGOMVDSFMPIDX-HUUCEWRRSA-N 0 3 420.554 4.097 20 0 HIADHN CC[C@@H](Nc1ccccc1)C(=O)Nc1c(C)cnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000434552731 860397796 /nfs/dbraw/zinc/39/77/96/860397796.db2.gz YLCKBCJWFUTCNC-XZOQPEGZSA-N 0 3 417.557 4.468 20 0 HIADHN COc1cc(C(C)=O)ccc1OC[C@@H](O)CN(C)[C@H](c1ccc(F)cc1)C(C)C ZINC000434611780 860428710 /nfs/dbraw/zinc/42/87/10/860428710.db2.gz KUFIPCPUMFOROZ-REWPJTCUSA-N 0 3 403.494 4.106 20 0 HIADHN O=C(c1ccc(F)cc1)C1CCN(C[C@H](O)CO[C@H]2CCCc3ccccc32)CC1 ZINC000434661898 860450104 /nfs/dbraw/zinc/45/01/04/860450104.db2.gz GYEUCRDYEGPSEE-UPVQGACJSA-N 0 3 411.517 4.176 20 0 HIADHN COc1ccc(NC(=O)CCN2CCC(C(=O)c3ccc(F)cc3)CC2)cc1Cl ZINC000434667615 860452729 /nfs/dbraw/zinc/45/27/29/860452729.db2.gz XXKGSTSBYUOPND-UHFFFAOYSA-N 0 3 418.896 4.411 20 0 HIADHN O=C(CN1CCC(c2ncc3n2CCCC3)CC1)NCC1(c2ccccc2)CCCC1 ZINC000434688195 860462126 /nfs/dbraw/zinc/46/21/26/860462126.db2.gz JKNLAUDXBXLQKE-UHFFFAOYSA-N 0 3 420.601 4.027 20 0 HIADHN Clc1cc(CN2CCC(c3ncc4n3CCCC4)CC2)cc2c1OCCCO2 ZINC000434692516 860464804 /nfs/dbraw/zinc/46/48/04/860464804.db2.gz YHSNJFBHZABYMO-UHFFFAOYSA-N 0 3 401.938 4.414 20 0 HIADHN C[C@@H](Oc1ccc(-c2ccccc2)cc1)C(=O)NCCCCN1C[C@@H](C)O[C@H](C)C1 ZINC000434754613 860482291 /nfs/dbraw/zinc/48/22/91/860482291.db2.gz GKFYKKCJFXNHGW-NJDAHSKKSA-N 0 3 410.558 4.127 20 0 HIADHN CCOc1cc(CN2CC[C@@](C)(c3ccc(C)cc3)C2)nc2nc(C(F)(F)F)nn21 ZINC000434755879 860482946 /nfs/dbraw/zinc/48/29/46/860482946.db2.gz YENYTBRXXAVTGB-HXUWFJFHSA-N 0 3 419.451 4.014 20 0 HIADHN C[C@H]1CN(CCCCNC(=O)CCCCc2nc3ccccc3s2)C[C@H](C)O1 ZINC000434764875 860486990 /nfs/dbraw/zinc/48/69/90/860486990.db2.gz PJZJTCWEXMZDFG-ROUUACIJSA-N 0 3 403.592 4.015 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)c2cccc(COc3cccc(F)c3)c2)C[C@@H](C)O1 ZINC000434783165 860493704 /nfs/dbraw/zinc/49/37/04/860493704.db2.gz KMIUUBACESOBLB-RTBURBONSA-N 0 3 414.521 4.024 20 0 HIADHN CCn1nccc1C1CCN(CCc2nc3sc4c(c3c(N)n2)CC[C@H](C)C4)CC1 ZINC000434799291 860498529 /nfs/dbraw/zinc/49/85/29/860498529.db2.gz QYVPIHCNXCGHMT-HNNXBMFYSA-N 0 3 424.618 4.037 20 0 HIADHN O=C(CCN1CCC[C@H](c2nc(C(F)(F)F)cs2)C1)NCC1CCCCC1 ZINC000434883084 860533379 /nfs/dbraw/zinc/53/33/79/860533379.db2.gz LARQTWIXHHIMKG-HNNXBMFYSA-N 0 3 403.514 4.428 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)CN2CC[C@H](c3ccccc3)[C@@H]2C)cc1OC ZINC000434894734 860541539 /nfs/dbraw/zinc/54/15/39/860541539.db2.gz IJFCTVAMCJBJGO-NYVOZVTQSA-N 0 3 408.542 4.245 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Nc1cc(OC)c(OC)c(C)c1OC)c1ccsc1 ZINC000434905396 860548703 /nfs/dbraw/zinc/54/87/03/860548703.db2.gz QRQWJGFZXRNBMY-QGZVFWFLSA-N 0 3 421.563 4.287 20 0 HIADHN CN(C)CCN(Cc1cccc(O)c1)C(=O)COc1ccccc1-c1ccccc1 ZINC000434913311 860551965 /nfs/dbraw/zinc/55/19/65/860551965.db2.gz MTYHYTFNVRCQAJ-UHFFFAOYSA-N 0 3 404.510 4.028 20 0 HIADHN CN(C)C(=O)Nc1ccc(C(=O)NC[C@H](c2ccccc2)N2CCCC2)c(Cl)c1 ZINC000435050715 860616252 /nfs/dbraw/zinc/61/62/52/860616252.db2.gz MPFQAZPIUWBAKP-HXUWFJFHSA-N 0 3 414.937 4.000 20 0 HIADHN FC(F)(F)c1ccc2nnc([C@H]3CCCN(Cc4ccc(-c5cc[nH]n5)o4)C3)n2c1 ZINC000435126703 860652589 /nfs/dbraw/zinc/65/25/89/860652589.db2.gz PWXKSCPUOZKTEX-ZDUSSCGKSA-N 0 3 416.407 4.111 20 0 HIADHN Cc1cc(NC(=O)c2csc(C(C)C)n2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435268966 860709493 /nfs/dbraw/zinc/70/94/93/860709493.db2.gz QCEVMOBIWDVKRE-SFHVURJKSA-N 0 3 409.559 4.471 20 0 HIADHN Cc1cc(NC(=O)[C@@H](C)OCc2ccccc2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435273238 860711834 /nfs/dbraw/zinc/71/18/34/860711834.db2.gz XUDYOCOTJKEASB-OFNKIYASSA-N 0 3 418.541 4.182 20 0 HIADHN Cc1cc(NC(=O)[C@@H](C)Oc2ccccc2F)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435275074 860712394 /nfs/dbraw/zinc/71/23/94/860712394.db2.gz OMPJEBXCHRXBFU-UYAOXDASSA-N 0 3 422.504 4.184 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)c2ccccc2-c2nc(C(C)(C)C)no2)CN1Cc1ccccc1 ZINC000467756510 881571231 /nfs/dbraw/zinc/57/12/31/881571231.db2.gz VGNKTISRMDGRIG-MJGOQNOKSA-N 0 3 418.541 4.427 20 0 HIADHN Cc1cc(NC(=O)c2ccc(C3CC3)cn2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435279476 860715109 /nfs/dbraw/zinc/71/51/09/860715109.db2.gz JRGJMEKFEZYYKG-OAQYLSRUSA-N 0 3 401.514 4.163 20 0 HIADHN CC(=O)c1cccc(C(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000435287729 860719804 /nfs/dbraw/zinc/71/98/04/860719804.db2.gz AQKDYFOPOBSXGJ-JOCHJYFZSA-N 0 3 402.498 4.093 20 0 HIADHN Cc1cc(NC(=O)[C@H]2CSc3ccccc32)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435290700 860721040 /nfs/dbraw/zinc/72/10/40/860721040.db2.gz LHJXQXVZJXMDBH-CTNGQTDRSA-N 0 3 418.566 4.467 20 0 HIADHN Cc1cc(NC(=O)CCOc2cccc(C)c2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435290893 860721309 /nfs/dbraw/zinc/72/13/09/860721309.db2.gz SPODUXAESJESGY-QFIPXVFZSA-N 0 3 418.541 4.355 20 0 HIADHN CC(=O)c1c(C)[nH]c(C(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)c1C ZINC000435292361 860722267 /nfs/dbraw/zinc/72/22/67/860722267.db2.gz YLFZFVDBQLFJAZ-FQEVSTJZSA-N 0 3 419.529 4.038 20 0 HIADHN Cc1cc(NC(=O)c2ccc3c(c2)CCC3)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435297601 860725829 /nfs/dbraw/zinc/72/58/29/860725829.db2.gz VUZXIFPJZSQLMD-HSZRJFAPSA-N 0 3 400.526 4.380 20 0 HIADHN Cc1cc(NC(=O)c2ccc3c(c2)CCC3)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435297604 860726045 /nfs/dbraw/zinc/72/60/45/860726045.db2.gz VUZXIFPJZSQLMD-QHCPKHFHSA-N 0 3 400.526 4.380 20 0 HIADHN CCCN(C)c1ccc(C(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000435367511 860766119 /nfs/dbraw/zinc/76/61/19/860766119.db2.gz XBHUOCQUVOVTBA-QHCPKHFHSA-N 0 3 417.557 4.429 20 0 HIADHN COc1ccccc1[C@H](C)CC(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435369480 860766715 /nfs/dbraw/zinc/76/67/15/860766715.db2.gz FOGJBRQRACFRTO-TZIWHRDSSA-N 0 3 418.541 4.471 20 0 HIADHN O=C(CCOc1ccc(Cl)cc1)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 ZINC000435372637 860770637 /nfs/dbraw/zinc/77/06/37/860770637.db2.gz KRPHMKRIBGTRGM-HXUWFJFHSA-N 0 3 424.932 4.391 20 0 HIADHN C[C@H](Sc1ccccc1)C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000435374095 860771664 /nfs/dbraw/zinc/77/16/64/860771664.db2.gz WGQDNRVYRNYFSS-ICSRJNTNSA-N 0 3 406.555 4.449 20 0 HIADHN O=C(Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)c1cccc(-n2cccc2)c1 ZINC000435373156 860771873 /nfs/dbraw/zinc/77/18/73/860771873.db2.gz MHENPGVRXKGZEI-QHCPKHFHSA-N 0 3 411.509 4.373 20 0 HIADHN Cc1cc(OCC(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)ccc1Cl ZINC000435380271 860775897 /nfs/dbraw/zinc/77/58/97/860775897.db2.gz MYQLICXLNXIKKP-LJQANCHMSA-N 0 3 424.932 4.309 20 0 HIADHN Cc1cccc(OCCC(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000435382143 860777831 /nfs/dbraw/zinc/77/78/31/860777831.db2.gz XZGUKYBSAVCYKN-OAQYLSRUSA-N 0 3 404.514 4.046 20 0 HIADHN CC[C@@H](CNC(=O)N1CCC(OCC2CCCC2)CC1)N1CCc2ccccc2C1 ZINC000435402976 860785802 /nfs/dbraw/zinc/78/58/02/860785802.db2.gz SMSITLVUSLKVSA-QHCPKHFHSA-N 0 3 413.606 4.204 20 0 HIADHN C[S@](=O)c1ccc(CC(=O)N2CCN(Cc3ccccc3)C3(CCCCC3)C2)cc1 ZINC000435453060 860804237 /nfs/dbraw/zinc/80/42/37/860804237.db2.gz RJLYDVVMYKTDKB-PMERELPUSA-N 0 3 424.610 4.014 20 0 HIADHN Cc1cc(NC(=O)N[C@@H](C)c2ccc(C)o2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435511426 860829147 /nfs/dbraw/zinc/82/91/47/860829147.db2.gz NMNDPYLMQZBGHM-ICSRJNTNSA-N 0 3 407.518 4.423 20 0 HIADHN Cc1cc(NC(=O)N[C@H](C)c2ccc(C)o2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435511427 860830572 /nfs/dbraw/zinc/83/05/72/860830572.db2.gz NMNDPYLMQZBGHM-QUCCMNQESA-N 0 3 407.518 4.423 20 0 HIADHN Cc1cc(NC(=O)NCc2ccc(F)cc2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435513496 860831379 /nfs/dbraw/zinc/83/13/79/860831379.db2.gz DQQGDWRKUQCLBP-OAQYLSRUSA-N 0 3 407.493 4.099 20 0 HIADHN Cc1cc(NC(=O)NCCc2ccccc2C)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435513054 860831645 /nfs/dbraw/zinc/83/16/45/860831645.db2.gz CAZYEWNXQDZFNQ-HSZRJFAPSA-N 0 3 417.557 4.311 20 0 HIADHN Cc1cc(NC(=O)N[C@H](C)CCc2ccco2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435513663 860833074 /nfs/dbraw/zinc/83/30/74/860833074.db2.gz FDCGXLLQFOSUDT-NQIIRXRSSA-N 0 3 421.545 4.374 20 0 HIADHN Cc1cc(NC(=O)N[C@@H]2CCCC(F)(F)C2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435518892 860836574 /nfs/dbraw/zinc/83/65/74/860836574.db2.gz WILYPLMATYMILW-RTBURBONSA-N 0 3 417.504 4.338 20 0 HIADHN Cc1cc(NC(=O)NCc2ccc(C)s2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000435529283 860844823 /nfs/dbraw/zinc/84/48/23/860844823.db2.gz FNFZMDDTTDKCGF-IBGZPJMESA-N 0 3 409.559 4.330 20 0 HIADHN Cc1c(NC(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)cnn1-c1ccccc1F ZINC000435544009 860858649 /nfs/dbraw/zinc/85/86/49/860858649.db2.gz BTTARLKJOWBTOI-QFBILLFUSA-N 0 3 407.493 4.104 20 0 HIADHN Cc1c(NC(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)cnn1-c1ccccc1F ZINC000435547260 860862835 /nfs/dbraw/zinc/86/28/35/860862835.db2.gz CWNCNDFJLSYTMO-LPHOPBHVSA-N 0 3 407.493 4.277 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)N[C@@H]1[C@@H]2CCc3ccccc3[C@@H]21 ZINC000435600875 860905821 /nfs/dbraw/zinc/90/58/21/860905821.db2.gz GZRRXJWKTFHUEH-XPWALMASSA-N 0 3 407.583 4.128 20 0 HIADHN O=C(Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1)c1cc2cc(F)ccc2[nH]1 ZINC000435637685 860929374 /nfs/dbraw/zinc/92/93/74/860929374.db2.gz RKBZVTNQVOREKK-IBGZPJMESA-N 0 3 403.461 4.203 20 0 HIADHN NC(=O)[C@@H](Cc1ccc(C(F)(F)F)cc1)N[C@@H]1C[C@H]1c1c(F)cccc1Cl ZINC000435654299 860937047 /nfs/dbraw/zinc/93/70/47/860937047.db2.gz KGRMHMZACZQKBO-DAXOMENPSA-N 0 3 400.803 4.040 20 0 HIADHN Cc1ccc(NC(=O)[C@@H](N[C@H]2CC[C@@H](C(=O)N3CCCCC3)C2)c2ccccc2)cc1 ZINC000435790525 861062896 /nfs/dbraw/zinc/06/28/96/861062896.db2.gz JNDGOUGLULZVAR-NHTMILBNSA-N 0 3 419.569 4.446 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)[C@@H]3CCOc4ccccc43)c(OCC)c2)CC1 ZINC000435835055 861097396 /nfs/dbraw/zinc/09/73/96/861097396.db2.gz LLEGEBFKBRARLW-OAQYLSRUSA-N 0 3 423.557 4.122 20 0 HIADHN CC(C)(O)C1CN(C[C@@H](O)COC(c2ccc(Cl)cc2)c2ccc(Cl)cc2)C1 ZINC000435912675 861174266 /nfs/dbraw/zinc/17/42/66/861174266.db2.gz ZLKHQAQUXIXFLY-HXUWFJFHSA-N 0 3 424.368 4.163 20 0 HIADHN COCCOc1ccc(NC(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)c(C)c1 ZINC000437813732 863144975 /nfs/dbraw/zinc/14/49/75/863144975.db2.gz BZGOJJMXOMBAIQ-FQEVSTJZSA-N 0 3 411.546 4.149 20 0 HIADHN C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)c1ccccc1CSc1nc2ccccc2[nH]1 ZINC000467806993 881631187 /nfs/dbraw/zinc/63/11/87/881631187.db2.gz VNWPCVWLSZUJKZ-VFNWGFHPSA-N 0 3 406.555 4.068 20 0 HIADHN O=C(N[C@@H]1C[C@H]1c1ccc(Cl)cc1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000437876695 863239187 /nfs/dbraw/zinc/23/91/87/863239187.db2.gz XNQOMPMWFKFUJX-ZGUYJTEBSA-N 0 3 415.887 4.300 20 0 HIADHN CCO[C@@H]1C[C@H](NC(=O)Nc2ccc(CCN3CCSCC3)cc2)C12CCCC2 ZINC000438078125 863472216 /nfs/dbraw/zinc/47/22/16/863472216.db2.gz HMWONJKYWUAXKL-LEWJYISDSA-N 0 3 417.619 4.137 20 0 HIADHN Cc1ccc2cc(CNCc3ccc(S(=O)(=O)N4CCCCC4)cc3)ccc2n1 ZINC000438084254 863484190 /nfs/dbraw/zinc/48/41/90/863484190.db2.gz YAAHJOIWQYHDEA-UHFFFAOYSA-N 0 3 409.555 4.008 20 0 HIADHN C[C@H](CNC(=O)Nc1ccc(CCN2CCSCC2)cc1)Cc1cccs1 ZINC000438092561 863494321 /nfs/dbraw/zinc/49/43/21/863494321.db2.gz HHOBAYRHZUFYIS-KRWDZBQOSA-N 0 3 403.617 4.340 20 0 HIADHN C[C@H](CNC(=O)Nc1ccc(CCN2CCSCC2)cc1)Oc1ccccc1F ZINC000438095752 863502626 /nfs/dbraw/zinc/50/26/26/863502626.db2.gz HXCFOCMPFOMGSW-QGZVFWFLSA-N 0 3 417.550 4.006 20 0 HIADHN C[C@H](CNC(=O)Nc1ccc(Oc2cccc(Cl)c2)cc1)CN1CCN(C)CC1 ZINC000438100944 863513677 /nfs/dbraw/zinc/51/36/77/863513677.db2.gz DXRZRTCSQNUCJS-QGZVFWFLSA-N 0 3 416.953 4.137 20 0 HIADHN C[C@@H](NCc1cccc(OCCN2CCOCC2)c1)c1ccc(C(F)(F)F)cc1 ZINC000467843437 881685819 /nfs/dbraw/zinc/68/58/19/881685819.db2.gz ITSGQQYSUXWBOJ-QGZVFWFLSA-N 0 3 408.464 4.267 20 0 HIADHN COC(=O)[C@@H](C)Oc1ccc(CN2CCC(c3nc4cccc(C)c4o3)CC2)cc1 ZINC000438325765 863803314 /nfs/dbraw/zinc/80/33/14/863803314.db2.gz JIHMOCQFZPWTHV-QGZVFWFLSA-N 0 3 408.498 4.456 20 0 HIADHN C[C@@H](Oc1ccc(C(F)(F)F)cc1)C(=O)N(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1 ZINC000438371624 863831969 /nfs/dbraw/zinc/83/19/69/863831969.db2.gz MSUUVGDURLGVKM-SYNHAJSKSA-N 0 3 421.463 4.019 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)Nc3ccc(CC(F)(F)F)cc3)CC2)C[C@H](C)O1 ZINC000438373930 863833235 /nfs/dbraw/zinc/83/32/35/863833235.db2.gz KIYFQEQTPCQIIU-HOTGVXAUSA-N 0 3 413.484 4.145 20 0 HIADHN Cc1cccc(Oc2ccc(NC(=O)N(CCN(C)C)C[C@@H]3CCCO3)cn2)c1C ZINC000438382611 863838557 /nfs/dbraw/zinc/83/85/57/863838557.db2.gz YMFMFUJNKAVYIW-FQEVSTJZSA-N 0 3 412.534 4.065 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)c1csc(Cc2ccccc2F)n1 ZINC000438469773 863889787 /nfs/dbraw/zinc/88/97/87/863889787.db2.gz NGHMGYXUFMMUSA-UHFFFAOYSA-N 0 3 403.548 4.139 20 0 HIADHN COC(=O)C(C)(C)c1ccc(NC(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)cc1 ZINC000438471446 863890677 /nfs/dbraw/zinc/89/06/77/863890677.db2.gz SPOHFCIMBMBMGU-IBGZPJMESA-N 0 3 423.557 4.266 20 0 HIADHN CCOc1ccc(-c2nc(C(=O)N(CCN(C)C)Cc3cccs3)cs2)cc1 ZINC000438472446 863892100 /nfs/dbraw/zinc/89/21/00/863892100.db2.gz PLDYPICZICNJRO-UHFFFAOYSA-N 0 3 415.584 4.474 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)c1cccc(-n2nccc2C(F)(F)F)c1 ZINC000438526942 863951667 /nfs/dbraw/zinc/95/16/67/863951667.db2.gz AURQAESQGGRTJE-UHFFFAOYSA-N 0 3 422.476 4.157 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)c1cc2cc(Br)ccc2o1 ZINC000438528805 863953788 /nfs/dbraw/zinc/95/37/88/863953788.db2.gz CEDJLBZAUZYYAI-UHFFFAOYSA-N 0 3 407.333 4.461 20 0 HIADHN COCCO[C@H]1CCN(Cc2cn(Cc3ccccc3)nc2-c2ccc(C)cc2)C1 ZINC000438548443 863978247 /nfs/dbraw/zinc/97/82/47/863978247.db2.gz APCGLVUXSDIQNN-DEOSSOPVSA-N 0 3 405.542 4.144 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)c2ccc(OCC(F)(F)F)cc2)CC1 ZINC000438563643 863997159 /nfs/dbraw/zinc/99/71/59/863997159.db2.gz WFYKASKCFNRZSM-UHFFFAOYSA-N 0 3 406.448 4.364 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)Nc1ccc(Br)c(F)c1 ZINC000438609044 864034956 /nfs/dbraw/zinc/03/49/56/864034956.db2.gz HMBCGMRMWGCUMI-UHFFFAOYSA-N 0 3 412.278 4.323 20 0 HIADHN CN(C)Cc1cccc(C(=O)N(C)[C@H]2CCOc3ccc(Br)cc32)c1 ZINC000438629757 864058791 /nfs/dbraw/zinc/05/87/91/864058791.db2.gz VXCJUXPASUFASN-SFHVURJKSA-N 0 3 403.320 4.107 20 0 HIADHN O=C(Nc1c(F)cc(Br)cc1F)N1CCN(CC2CCCCC2)CC1 ZINC000438652963 864094907 /nfs/dbraw/zinc/09/49/07/864094907.db2.gz PYLYIIVMGJIBLK-UHFFFAOYSA-N 0 3 416.310 4.457 20 0 HIADHN CCCOc1ccc(NC(=O)C(=O)N(CC)[C@@H]2CCN([C@@H](C)c3ccccc3)C2)cc1 ZINC000438658105 864104012 /nfs/dbraw/zinc/10/40/12/864104012.db2.gz YVLBLYDEPORHBZ-SIKLNZKXSA-N 0 3 423.557 4.098 20 0 HIADHN CCN(C(=O)C(=O)Nc1cc(Cl)ccc1F)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000438661841 864111566 /nfs/dbraw/zinc/11/15/66/864111566.db2.gz VAYMXMWQAYSBAL-CRAIPNDOSA-N 0 3 417.912 4.102 20 0 HIADHN COc1ccc([C@H](CNC(=O)Nc2ccc(F)cc2OC(F)F)N2CCCC2)cc1 ZINC000438691314 864158227 /nfs/dbraw/zinc/15/82/27/864158227.db2.gz FPAKHXSLGKDKOI-SFHVURJKSA-N 0 3 423.435 4.394 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)c2ccc(C(=O)NCC(C)(C)C)cc2)CC1 ZINC000438708709 864188642 /nfs/dbraw/zinc/18/86/42/864188642.db2.gz GBZCWNLGHLEFFH-UHFFFAOYSA-N 0 3 421.585 4.199 20 0 HIADHN CN(C)c1nc2sc(C(=O)N(Cc3ccccc3)C3CCN(C)CC3)cc2s1 ZINC000438712365 864193494 /nfs/dbraw/zinc/19/34/94/864193494.db2.gz HHHYONSYPSTKIA-UHFFFAOYSA-N 0 3 414.600 4.160 20 0 HIADHN C[C@H]1CCCN1C(=O)CCN(C)Cc1cn(-c2ccccc2)nc1-c1ccccc1 ZINC000438785222 864277790 /nfs/dbraw/zinc/27/77/90/864277790.db2.gz VHQITFAYIKMAQU-FQEVSTJZSA-N 0 3 402.542 4.372 20 0 HIADHN COc1ccc(OC)c([C@H](C)NCCC(=O)Nc2cc(OC)c(Cl)cc2OC)c1 ZINC000438784219 864278200 /nfs/dbraw/zinc/27/82/00/864278200.db2.gz RUYAGJQVWSUYLM-ZDUSSCGKSA-N 0 3 422.909 4.054 20 0 HIADHN Cc1ccc2[nH]c3c(c2c1)CCC[C@H]3NCc1cccc(NC(=O)Cn2cccn2)c1 ZINC000438834311 864327505 /nfs/dbraw/zinc/32/75/05/864327505.db2.gz IAPGILVTBVNOCZ-HSZRJFAPSA-N 0 3 413.525 4.479 20 0 HIADHN COc1ccc(Cl)cc1N1CC[C@@H](N[C@H](C)c2ccc(NC(C)=O)cc2OC)C1 ZINC000438978350 864441329 /nfs/dbraw/zinc/44/13/29/864441329.db2.gz MIFLQFMPVHBDKQ-RDTXWAMCSA-N 0 3 417.937 4.245 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)Nc1ccccc1-c1ncc2n1CCCC2 ZINC000439028671 864483541 /nfs/dbraw/zinc/48/35/41/864483541.db2.gz OLSWULOJAKRSFH-UHFFFAOYSA-N 0 3 417.557 4.482 20 0 HIADHN CC[C@@H](C)[C@H]1CN(Cc2ccc(C)nc2)CCN1C(=O)Nc1cccc(CN(C)C)c1 ZINC000439074686 864526798 /nfs/dbraw/zinc/52/67/98/864526798.db2.gz YQKHTHQCDRNLRY-NTKDMRAZSA-N 0 3 423.605 4.216 20 0 HIADHN CN(C)C(=O)COc1cccc(CN[C@H](c2ccc(Br)s2)C2CC2)c1 ZINC000439129681 864564640 /nfs/dbraw/zinc/56/46/40/864564640.db2.gz KBZFJALAHHTVAI-IBGZPJMESA-N 0 3 423.376 4.219 20 0 HIADHN CCN(C[C@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)c1ccc(C)c(Cl)c1 ZINC000439228224 864645660 /nfs/dbraw/zinc/64/56/60/864645660.db2.gz FNCPNHPBMLFBDT-IBGZPJMESA-N 0 3 406.979 4.181 20 0 HIADHN C[C@@H](Cc1ccc(Br)cc1)NC(=O)N(CCN(C)C)Cc1cccs1 ZINC000439248416 864664770 /nfs/dbraw/zinc/66/47/70/864664770.db2.gz QIIVVWFVIJLUGW-HNNXBMFYSA-N 0 3 424.408 4.215 20 0 HIADHN C[C@H](NC(=O)N(CCN(C)C)Cc1cccs1)c1ccc(Br)cc1 ZINC000439262088 864680211 /nfs/dbraw/zinc/68/02/11/864680211.db2.gz XSFKYQNOVQQWTJ-AWEZNQCLSA-N 0 3 410.381 4.345 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3c(F)cccc3F)c(OCC)c2)CC1 ZINC000439299646 864726087 /nfs/dbraw/zinc/72/60/87/864726087.db2.gz VUWFNWJDPRMAFG-UHFFFAOYSA-N 0 3 403.473 4.148 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)N[C@@H]1CCc2c1cccc2Br ZINC000439370630 864805436 /nfs/dbraw/zinc/80/54/36/864805436.db2.gz JYJCYCADCMXFTQ-GOSISDBHSA-N 0 3 422.392 4.271 20 0 HIADHN CN(C)[C@H](CNCc1cc(Cl)ccc1OC[C@H]1CCCO1)c1cccc(F)c1 ZINC000439480273 864846833 /nfs/dbraw/zinc/84/68/33/864846833.db2.gz UFTCSCALKYOCNB-NHCUHLMSSA-N 0 3 406.929 4.429 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)N1CCN(c2ccc(F)cc2)CC1)c1ccc(C(F)(F)F)cc1 ZINC000439549751 864875977 /nfs/dbraw/zinc/87/59/77/864875977.db2.gz ODXKDOODIQHFPX-CVEARBPZSA-N 0 3 423.454 4.232 20 0 HIADHN C[C@@H](NCC1(N2CCSCC2)CCCCC1)c1nc(Cc2ccccc2)no1 ZINC000439593557 864914770 /nfs/dbraw/zinc/91/47/70/864914770.db2.gz WCHMUUOKRHGNLU-GOSISDBHSA-N 0 3 400.592 4.063 20 0 HIADHN C[C@H](NCc1ccccc1CN(C)Cc1ccco1)C(=O)N1c2ccccc2C[C@H]1C ZINC000439595412 864918542 /nfs/dbraw/zinc/91/85/42/864918542.db2.gz JXLQMAOBGNPIBC-UXHICEINSA-N 0 3 417.553 4.368 20 0 HIADHN C[C@H](NCc1ccccc1CN(C)Cc1ccco1)C(=O)N(C)Cc1ccccc1 ZINC000439598297 864920793 /nfs/dbraw/zinc/92/07/93/864920793.db2.gz QGRQHGWDLSYSRM-FQEVSTJZSA-N 0 3 405.542 4.048 20 0 HIADHN CC(C)(C)[C@@H](CN1CCc2ccccc2C1)NC(=O)N1CCC([C@H]2CCCO2)CC1 ZINC000439641816 864968059 /nfs/dbraw/zinc/96/80/59/864968059.db2.gz GVQKBWICPGANEQ-DHIUTWEWSA-N 0 3 413.606 4.060 20 0 HIADHN CC1(C)Cc2cc(NC(=O)NC3CC(N4CCC(C(F)(F)F)CC4)C3)ccc2O1 ZINC000467960850 881822273 /nfs/dbraw/zinc/82/22/73/881822273.db2.gz UTBYAZVHKRFTBH-UHFFFAOYSA-N 0 3 411.468 4.327 20 0 HIADHN Cc1cc2c(o1)c(C(=O)N(CCN(C)C)Cc1ccco1)ccc2Br ZINC000467962886 881823504 /nfs/dbraw/zinc/82/35/04/881823504.db2.gz JCYAGQBLZXWJTQ-UHFFFAOYSA-N 0 3 405.292 4.301 20 0 HIADHN CC1CCN([C@H](CNC(=O)c2ccccc2Cn2cccn2)c2ccccc2)CC1 ZINC000467973300 881828590 /nfs/dbraw/zinc/82/85/90/881828590.db2.gz LUVHQQSAXIBFEY-XMMPIXPASA-N 0 3 402.542 4.134 20 0 HIADHN CC1CCN([C@@H](CNC(=O)C(C)(C)NC(=O)Nc2ccccc2)c2ccccc2)CC1 ZINC000467973824 881829676 /nfs/dbraw/zinc/82/96/76/881829676.db2.gz FXRKOMWLCZMMNE-QFIPXVFZSA-N 0 3 422.573 4.176 20 0 HIADHN CC(C)(O)CN1CCc2c(cccc2NC(=O)C2(Cc3ccccc3Cl)CC2)C1 ZINC000439721522 865055093 /nfs/dbraw/zinc/05/50/93/865055093.db2.gz PQXIELLSFCKTRJ-UHFFFAOYSA-N 0 3 412.961 4.430 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)c2ccc3[nH]c4c(c3c2)CCCC4)CC1 ZINC000439736832 865068779 /nfs/dbraw/zinc/06/87/79/865068779.db2.gz FODSSUXDOSXXLM-KRWDZBQOSA-N 0 3 402.542 4.397 20 0 HIADHN COc1cc(C2(C(=O)NC3CCN([C@H](C)c4ccncc4)CC3)CCC2)ccc1C ZINC000439741285 865072717 /nfs/dbraw/zinc/07/27/17/865072717.db2.gz QZLUAPWHZXJVSQ-LJQANCHMSA-N 0 3 407.558 4.162 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)[C@@H](OC2CCCC2)c2ccccc2)CC1 ZINC000439748106 865079289 /nfs/dbraw/zinc/07/92/89/865079289.db2.gz SXLCGKLVLBNDKC-DVECYGJZSA-N 0 3 407.558 4.424 20 0 HIADHN C[C@H](C(=O)NC1CCN([C@@H](C)c2ccncc2)CC1)c1ccc(Br)s1 ZINC000439751350 865080431 /nfs/dbraw/zinc/08/04/31/865080431.db2.gz LRZLGDISHSCTGS-KBPBESRZSA-N 0 3 422.392 4.351 20 0 HIADHN C[C@H](C(=O)Nc1ccc(C(=O)NCCN2CCCC2)cc1)c1ccc2ccccc2c1 ZINC000439752965 865081946 /nfs/dbraw/zinc/08/19/46/865081946.db2.gz ZRABISIBFQXMHT-IBGZPJMESA-N 0 3 415.537 4.408 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)C(C)(C)Oc2cccc(Cl)c2)CC1 ZINC000439764793 865090345 /nfs/dbraw/zinc/09/03/45/865090345.db2.gz IPXGPDYYYJJVGH-MRXNPFEDSA-N 0 3 401.938 4.234 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)CCCOc2ccccc2Cl)CC1 ZINC000439765532 865090519 /nfs/dbraw/zinc/09/05/19/865090519.db2.gz LMSSUWDFESDABD-QGZVFWFLSA-N 0 3 401.938 4.236 20 0 HIADHN O=C(Cc1ccc(NC(=O)[C@@H]2CCCN2C2CCCC2)cc1)Nc1ccccc1F ZINC000439839476 865151297 /nfs/dbraw/zinc/15/12/97/865151297.db2.gz WGBPVWGDMZBENC-QFIPXVFZSA-N 0 3 409.505 4.352 20 0 HIADHN Cc1ccc(-c2ccnn2C)cc1NC(=O)N(CCCc1ccccc1)CCN(C)C ZINC000439962766 865254920 /nfs/dbraw/zinc/25/49/20/865254920.db2.gz QJKIYSFZOUKITF-UHFFFAOYSA-N 0 3 419.573 4.424 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)Nc3cc(Cl)c(Cl)cc3F)CC2)C[C@H](C)O1 ZINC000439967189 865259272 /nfs/dbraw/zinc/25/92/72/865259272.db2.gz WIZSUEMBEUGWBT-STQMWFEESA-N 0 3 418.340 4.486 20 0 HIADHN Cc1ccc(-c2ccnn2C)cc1NC(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000439968835 865260887 /nfs/dbraw/zinc/26/08/87/865260887.db2.gz PTUWSXRQUDADQX-RXVVDRJESA-N 0 3 403.530 4.353 20 0 HIADHN CC1CCN([C@@H](CNC(=O)Nc2ccc(N3CCC3=O)cc2)c2cccs2)CC1 ZINC000439972368 865264649 /nfs/dbraw/zinc/26/46/49/865264649.db2.gz JJGRLUBXTAQENZ-IBGZPJMESA-N 0 3 412.559 4.080 20 0 HIADHN CCN1CCN(CCC(=O)N[C@H](c2ccccc2)c2ccc(Cl)c(Cl)c2)CC1 ZINC000468019434 881855736 /nfs/dbraw/zinc/85/57/36/881855736.db2.gz ICKNIJSTMQFAEC-JOCHJYFZSA-N 0 3 420.384 4.227 20 0 HIADHN COc1cc(-c2nnc(CN[C@@H]3CCCC[C@H]3C(C)(C)C)o2)cc(OC)c1OC ZINC000440047764 865325793 /nfs/dbraw/zinc/32/57/93/865325793.db2.gz CDOKTHAGNPSXPG-HZPDHXFCSA-N 0 3 403.523 4.457 20 0 HIADHN Cc1c([C@H](C)NC[C@]2(C)CCO[C@@H]2C2CC2)nnn1-c1cccc(Br)c1 ZINC000468038660 881868189 /nfs/dbraw/zinc/86/81/89/881868189.db2.gz QJUHHSBSHHEXRT-SVIJTADQSA-N 0 3 419.367 4.194 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)NCc1cccc(-c2ccccn2)c1 ZINC000440241236 865479310 /nfs/dbraw/zinc/47/93/10/865479310.db2.gz JLTAKBSPQGTBRF-UHFFFAOYSA-N 0 3 406.505 4.161 20 0 HIADHN Cc1nc2c(s1)[C@@H](N[C@@H]1CC(=O)N(Cc3ccccc3C(F)(F)F)C1)CCC2 ZINC000468049594 881875044 /nfs/dbraw/zinc/87/50/44/881875044.db2.gz OFSCFUIVNILJSI-PBHICJAKSA-N 0 3 409.477 4.238 20 0 HIADHN CC(C)n1cnnc1-c1ccccc1NC(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000440274845 865523028 /nfs/dbraw/zinc/52/30/28/865523028.db2.gz VDCHPHHTBLXXCS-AZUAARDMSA-N 0 3 418.545 4.483 20 0 HIADHN COc1ccccc1[C@H](C)NC(=O)[C@H](C)N1CCN(C2CCC(C(C)C)CC2)CC1 ZINC000440310480 865575534 /nfs/dbraw/zinc/57/55/34/865575534.db2.gz AFILITLIILLQFV-PHZLKFDYSA-N 0 3 415.622 4.093 20 0 HIADHN CC(C)C1CCC(N2CCN(CC(=O)Nc3ccccc3Br)CC2)CC1 ZINC000440314656 865582499 /nfs/dbraw/zinc/58/24/99/865582499.db2.gz JOUNNVCSVJMFSK-UHFFFAOYSA-N 0 3 422.411 4.220 20 0 HIADHN C[C@@H](C(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1)n1ccc2ccccc2c1=O ZINC000468072770 881887911 /nfs/dbraw/zinc/88/79/11/881887911.db2.gz DTYYNIBAKNMHOI-RXVVDRJESA-N 0 3 423.582 4.213 20 0 HIADHN O[C@H](CNCc1cnc(-c2ccncc2)s1)COc1cccc(Cl)c1Cl ZINC000440332398 865611987 /nfs/dbraw/zinc/61/19/87/865611987.db2.gz AFPZWQMAJARFDE-CYBMUJFWSA-N 0 3 410.326 4.041 20 0 HIADHN O=C(Nc1ccc(CNCc2cnc(-c3ccncc3)s2)cc1)c1ccncc1 ZINC000440346849 865625183 /nfs/dbraw/zinc/62/51/83/865625183.db2.gz XXKZJUFCCOEBDB-UHFFFAOYSA-N 0 3 401.495 4.142 20 0 HIADHN Cc1ccc(C(=O)C(=O)N(C[C@H]2CCN(Cc3ccccc3)C2)CC(F)(F)F)cc1 ZINC000440419531 865719453 /nfs/dbraw/zinc/71/94/53/865719453.db2.gz JQKQRDGLYOWYAT-IBGZPJMESA-N 0 3 418.459 4.091 20 0 HIADHN CCCN(CC(=O)c1cc(C)n(CC)c1C)C1CCN(c2cc(C)nc(C)n2)CC1 ZINC000440458488 865762250 /nfs/dbraw/zinc/76/22/50/865762250.db2.gz OPGDWJCWVOIRNG-UHFFFAOYSA-N 0 3 411.594 4.095 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)C(=O)Nc3csc4ccccc34)c2)CC1 ZINC000440493342 865794866 /nfs/dbraw/zinc/79/48/66/865794866.db2.gz WFRBJBGHXWRZCW-UHFFFAOYSA-N 0 3 422.554 4.009 20 0 HIADHN COCc1ccc([C@@H]2CCCN2C(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)o1 ZINC000468101665 881911561 /nfs/dbraw/zinc/91/15/61/881911561.db2.gz KQNWGAIRFSWGOL-VXKWHMMOSA-N 0 3 411.546 4.418 20 0 HIADHN CN(C)CCn1c(=O)oc2ccc(NC(=O)Nc3ccc(Cl)cc3Cl)cc21 ZINC000440783821 865909171 /nfs/dbraw/zinc/90/91/71/865909171.db2.gz QSNFGKCRLSKOSY-UHFFFAOYSA-N 0 3 409.273 4.107 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3cnn(CCC(C)C)c3C)c(C)c2)CC1 ZINC000440879015 865975143 /nfs/dbraw/zinc/97/51/43/865975143.db2.gz OIRCEPRYHCMZGM-UHFFFAOYSA-N 0 3 412.582 4.332 20 0 HIADHN CC(C)n1ncc2c1nc(-c1ccccc1)cc2C(=O)N[C@H]1C[C@H](C)N(C2CC2)C1 ZINC000440916738 866012498 /nfs/dbraw/zinc/01/24/98/866012498.db2.gz YMJULXRHDBCQFU-WMZOPIPTSA-N 0 3 403.530 4.034 20 0 HIADHN C[C@H]1C[C@H](NC(=O)c2ccccc2-c2nc(-c3cccc(Cl)c3)no2)CN1C1CC1 ZINC000440928343 866025155 /nfs/dbraw/zinc/02/51/55/866025155.db2.gz XYBJOVHTCJFVIR-YOEHRIQHSA-N 0 3 422.916 4.412 20 0 HIADHN O=C(CCN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1)Nc1ccccc1 ZINC000440940156 866038162 /nfs/dbraw/zinc/03/81/62/866038162.db2.gz XHUIFSHJAQMFRH-HSZRJFAPSA-N 0 3 401.510 4.063 20 0 HIADHN CCC[C@H](NC(=O)NCCN1CCN(C)C(C)(C)C1)c1ccc(Cl)c(Cl)c1 ZINC000440978262 866063078 /nfs/dbraw/zinc/06/30/78/866063078.db2.gz GCOZHRCEZVCOCV-SFHVURJKSA-N 0 3 415.409 4.160 20 0 HIADHN CN(C)CCN(CC1CCCCC1)C(=O)CCc1nnc(-c2ccc(Cl)cc2)o1 ZINC000468114825 881940230 /nfs/dbraw/zinc/94/02/30/881940230.db2.gz HEMGUTLBXQPMIG-UHFFFAOYSA-N 0 3 418.969 4.293 20 0 HIADHN COc1cc(-c2nnc(CN3C[C@H](c4ccccc4)C(C)(C)C3)o2)cc(OC)c1OC ZINC000441072800 866161526 /nfs/dbraw/zinc/16/15/26/866161526.db2.gz JVWBJUQZASYMHB-GOSISDBHSA-N 0 3 423.513 4.388 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2ccc(Oc3nccc(C)n3)cc2)N(C)C)cc1 ZINC000441122204 866217146 /nfs/dbraw/zinc/21/71/46/866217146.db2.gz HEWIIFYCRNWKNG-OAQYLSRUSA-N 0 3 405.502 4.310 20 0 HIADHN CC(C)OC(=O)c1ccc(CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)cc1 ZINC000441159170 866247518 /nfs/dbraw/zinc/24/75/18/866247518.db2.gz RQBFURZJBMNUTP-UHFFFAOYSA-N 0 3 415.921 4.151 20 0 HIADHN CC(C)c1ncc(CN(C)C(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)cn1 ZINC000441219075 866292212 /nfs/dbraw/zinc/29/22/12/866292212.db2.gz VNBIRXZRAQEFRP-LJQANCHMSA-N 0 3 415.607 4.276 20 0 HIADHN COc1ccc([C@H](CNC(=O)CN(C)CCC2CC2)c2c[nH]c3ccccc32)cc1 ZINC000441262561 866336973 /nfs/dbraw/zinc/33/69/73/866336973.db2.gz OTVIYANEKHCTIY-QFIPXVFZSA-N 0 3 405.542 4.157 20 0 HIADHN Cc1cc(CN(C)C(=O)N[C@@H]2C[C@@H](C)N(C3CC3)C2)cc(C)c1OCC(F)(F)F ZINC000441280248 866354779 /nfs/dbraw/zinc/35/47/79/866354779.db2.gz CFJNJFLQWWVLGY-NVXWUHKLSA-N 0 3 413.484 4.011 20 0 HIADHN CN(C(=O)CN1CCC[C@H]([C@H]2CCOC2)C1)[C@@H](c1ccccc1)c1ccc(F)cc1 ZINC000441292605 866366087 /nfs/dbraw/zinc/36/60/87/866366087.db2.gz JWLDRGUDCXHVNY-HWBMXIPRSA-N 0 3 410.533 4.122 20 0 HIADHN CCN(CC(F)(F)F)C(=O)[C@H]1CCCN(Cc2cc(-c3ccc(C)cc3)no2)C1 ZINC000441342970 866415017 /nfs/dbraw/zinc/41/50/17/866415017.db2.gz FVOSIYDQROCCPA-KRWDZBQOSA-N 0 3 409.452 4.273 20 0 HIADHN CCN(CC(F)(F)F)C(=O)[C@@H]1CCCN(Cc2ccccc2OCC(C)C)C1 ZINC000441364492 866433959 /nfs/dbraw/zinc/43/39/59/866433959.db2.gz HQAFEJYLCFYDOM-GOSISDBHSA-N 0 3 400.485 4.344 20 0 HIADHN C[C@H](c1cccc(NC(=O)c2ccccc2)c1)N(C)C(=O)CN1CCC2(CCC2)C1 ZINC000468131392 881975810 /nfs/dbraw/zinc/97/58/10/881975810.db2.gz JRRQZPHVVTXCKQ-LJQANCHMSA-N 0 3 405.542 4.334 20 0 HIADHN OC[C@]1(NCc2ccc(-n3ccc(C(F)(F)F)n3)cc2)CCCc2ccccc21 ZINC000441374412 866442619 /nfs/dbraw/zinc/44/26/19/866442619.db2.gz FJDWRKMOUQDUNY-OAQYLSRUSA-N 0 3 401.432 4.205 20 0 HIADHN C[C@H](CCC(=O)Nc1ccc(C(=O)N(C)[C@@H]2CCCN(C)C2)cc1)c1ccccc1 ZINC000441461527 866538840 /nfs/dbraw/zinc/53/88/40/866538840.db2.gz GUWAVHSSIDJJPD-AUSIDOKSSA-N 0 3 407.558 4.375 20 0 HIADHN Cc1nccn1CCCCNC(=O)N1CCC[C@H]1c1nc2ccc(Cl)cc2[nH]1 ZINC000441492307 866576450 /nfs/dbraw/zinc/57/64/50/866576450.db2.gz PHBKNMIPLKAKPE-SFHVURJKSA-N 0 3 400.914 4.048 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)N(C)[C@@H](C)c3nc4ccccc4s3)CC2)c1 ZINC000468145957 882004781 /nfs/dbraw/zinc/00/47/81/882004781.db2.gz NDCOAGHCKWXJHG-IBGZPJMESA-N 0 3 422.598 4.336 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)NC[C@@]1(C)CCCS1 ZINC000468148469 882007751 /nfs/dbraw/zinc/00/77/51/882007751.db2.gz HWBRHVFLBUCAGM-GOSISDBHSA-N 0 3 403.514 4.064 20 0 HIADHN CC(C)c1nc2ccc(NC(=O)C(=O)N[C@@H](C)[C@H](c3ccccc3)N(C)C)cc2s1 ZINC000441694856 866808917 /nfs/dbraw/zinc/80/89/17/866808917.db2.gz QBMWVKNRUBJRTR-MGPUTAFESA-N 0 3 424.570 4.166 20 0 HIADHN CC1CCN([C@H](CNC(=O)N2CCO[C@@H](c3ccsc3)C2)c2cccs2)CC1 ZINC000468161046 882030386 /nfs/dbraw/zinc/03/03/86/882030386.db2.gz USBPQNAPZBPSFT-RTBURBONSA-N 0 3 419.616 4.366 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)N[C@@H]3CCCc4sc(-c5ccc(F)cc5)nc43)[C@@H]2C1 ZINC000468166645 882041499 /nfs/dbraw/zinc/04/14/99/882041499.db2.gz ZLLLHAVODGXPEK-ZTFGCOKTSA-N 0 3 414.550 4.062 20 0 HIADHN COCc1nc(C(=O)N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)c(-c2ccccc2)s1 ZINC000442694452 867629165 /nfs/dbraw/zinc/62/91/65/867629165.db2.gz SDIJGGGBMJCANA-YLJYHZDGSA-N 0 3 421.566 4.349 20 0 HIADHN CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)c1ccncc1Oc1ccccc1 ZINC000442745840 867661412 /nfs/dbraw/zinc/66/14/12/867661412.db2.gz KXWIHYQWTQBXFC-CVDCTZTESA-N 0 3 402.498 4.034 20 0 HIADHN CN1CCN(CCC(C)(C)NC(=O)c2[nH]ccc2-c2c(Cl)cccc2Cl)CC1 ZINC000442747685 867661709 /nfs/dbraw/zinc/66/17/09/867661709.db2.gz AJXSICHVTUAVSR-UHFFFAOYSA-N 0 3 423.388 4.134 20 0 HIADHN COCCC[C@H](NCc1cccc(NC(=O)[C@@H]2CCCO2)c1)c1ccc(F)cc1 ZINC000442789429 867675673 /nfs/dbraw/zinc/67/56/73/867675673.db2.gz GVNDQRFSXGACEM-VXKWHMMOSA-N 0 3 400.494 4.201 20 0 HIADHN CSc1cccc([C@@H](NCCN2CCN(C)C(C)(C)C2)c2cc(F)ccc2F)c1 ZINC000442891015 867723485 /nfs/dbraw/zinc/72/34/85/867723485.db2.gz QTJVWOJAOGZFCJ-JOCHJYFZSA-N 0 3 419.585 4.392 20 0 HIADHN C[C@H](CC(=O)N(C)c1ccccc1)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1 ZINC000443100938 867819430 /nfs/dbraw/zinc/81/94/30/867819430.db2.gz BOOCUIHWIMZCIS-HYBUGGRVSA-N 0 3 415.537 4.268 20 0 HIADHN C[C@H](C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1)c1ccc(Cl)s1 ZINC000443350711 867920134 /nfs/dbraw/zinc/92/01/34/867920134.db2.gz KKTMNNGCRACMIQ-AWEZNQCLSA-N 0 3 410.942 4.304 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(F)cc2)CC1)c1ccc(Oc2ccccc2)o1 ZINC000443349886 867920162 /nfs/dbraw/zinc/92/01/62/867920162.db2.gz HKYMDSVDHWIKSY-UHFFFAOYSA-N 0 3 424.472 4.484 20 0 HIADHN CCN(Cc1c[nH]c2ccccc12)C(=O)Nc1cccc(N2CCN(CC)CC2)c1 ZINC000443370088 867934201 /nfs/dbraw/zinc/93/42/01/867934201.db2.gz HZMHBWNOMYSKDS-UHFFFAOYSA-N 0 3 405.546 4.364 20 0 HIADHN C[C@H](CNC(=O)Nc1ccc(Cl)cc1-c1ccccc1)CN1CCN(C)CC1 ZINC000443530881 868088604 /nfs/dbraw/zinc/08/86/04/868088604.db2.gz OVBZPFUQEHZLMO-QGZVFWFLSA-N 0 3 400.954 4.012 20 0 HIADHN CSc1cccc(N(C(=O)c2cc3ccccc3c(=O)o2)C2CCN(C)CC2)c1 ZINC000443535891 868094266 /nfs/dbraw/zinc/09/42/66/868094266.db2.gz VOCGKHFQEKCNSE-UHFFFAOYSA-N 0 3 408.523 4.256 20 0 HIADHN O[C@@H](COc1ccccc1Cl)CN1CCC[C@@H](c2nc3ccc(F)cc3o2)C1 ZINC000443652194 868247779 /nfs/dbraw/zinc/24/77/79/868247779.db2.gz UACYNKYCRBYXBY-GDBMZVCRSA-N 0 3 404.869 4.240 20 0 HIADHN C[C@@H]1CN(CCCCNC(=O)c2occc2CSc2ccccc2)C[C@@H](C)O1 ZINC000443659152 868263982 /nfs/dbraw/zinc/26/39/82/868263982.db2.gz WWDQALFJYYOACB-QZTJIDSGSA-N 0 3 402.560 4.191 20 0 HIADHN C[C@H]1CN(CCCCNC(=O)c2occc2CSc2ccccc2)C[C@H](C)O1 ZINC000443659156 868264248 /nfs/dbraw/zinc/26/42/48/868264248.db2.gz WWDQALFJYYOACB-ROUUACIJSA-N 0 3 402.560 4.191 20 0 HIADHN C[C@@H](Cc1ccc(Cl)cc1Cl)C(=O)NCCCCN1C[C@@H](C)O[C@@H](C)C1 ZINC000443673515 868281101 /nfs/dbraw/zinc/28/11/01/868281101.db2.gz JOFNKUIMBJUFMM-HRCADAONSA-N 0 3 401.378 4.178 20 0 HIADHN Cc1oc2ccc(NC(=O)C(=O)N[C@@H](C)[C@H](c3ccccc3C)N(C)C)cc2c1C ZINC000443846734 868376839 /nfs/dbraw/zinc/37/68/39/868376839.db2.gz WNPWXZGSFWOEGJ-KSFYIVLOSA-N 0 3 407.514 4.104 20 0 HIADHN Cc1nc(CN2CCC(CCN3CCOCC3)CC2)oc1-c1ccc(Cl)cc1 ZINC000468267479 882185682 /nfs/dbraw/zinc/18/56/82/882185682.db2.gz DDXKCPOQHYHQIL-UHFFFAOYSA-N 0 3 403.954 4.238 20 0 HIADHN Cc1nc2ccc(NC(=O)Cn3c4ccccc4c4c3CCN(C(C)C)C4)cc2[nH]1 ZINC000443906038 868442173 /nfs/dbraw/zinc/44/21/73/868442173.db2.gz ICJJDCNPOPHMHI-UHFFFAOYSA-N 0 3 401.514 4.231 20 0 HIADHN COc1ccc(CNCc2ccc(CN(C)C)c(F)c2)c(OCc2cccnc2)c1 ZINC000443998566 868517957 /nfs/dbraw/zinc/51/79/57/868517957.db2.gz QJGGJPBWMSABPC-UHFFFAOYSA-N 0 3 409.505 4.160 20 0 HIADHN COc1cc(C)ccc1Oc1ccc(NC(=O)N(CCN(C)C)CC(C)C)cn1 ZINC000444037972 868574542 /nfs/dbraw/zinc/57/45/42/868574542.db2.gz XFPPNUJNBMDIAC-UHFFFAOYSA-N 0 3 400.523 4.242 20 0 HIADHN COc1ccc(C2(NCc3ccc(OC)c(Br)c3)CCOCC2)cc1F ZINC000444038115 868576242 /nfs/dbraw/zinc/57/62/42/868576242.db2.gz WFCHPNCKPOHWNT-UHFFFAOYSA-N 0 3 424.310 4.401 20 0 HIADHN CN(CCC(=O)Nc1cc(F)cc(F)c1)[C@@H]1c2cc(Cl)cc(Cl)c2C[C@H]1O ZINC000444046981 868584507 /nfs/dbraw/zinc/58/45/07/868584507.db2.gz ZXGRAUKLNQOLJD-IEBWSBKVSA-N 0 3 415.267 4.190 20 0 HIADHN COc1ccc(SCCCC(=O)Nc2cccc(CN3CCC(O)CC3)c2)cc1 ZINC000444179549 868652412 /nfs/dbraw/zinc/65/24/12/868652412.db2.gz FNLRVURAXURMEH-UHFFFAOYSA-N 0 3 414.571 4.163 20 0 HIADHN CCOc1ccc([C@H]2CCCN2C(=O)CN2CC[C@H](COCc3ccccc3)C2)cc1 ZINC000444186764 868657031 /nfs/dbraw/zinc/65/70/31/868657031.db2.gz RJWOFMXLUPQNCL-WIOPSUGQSA-N 0 3 422.569 4.288 20 0 HIADHN Cc1cc(C)c(CNC(=O)N2CCN(Cc3ccccc3)C3(CCCCC3)C2)c(=O)[nH]1 ZINC000444335265 868761873 /nfs/dbraw/zinc/76/18/73/868761873.db2.gz GHHZWVPWJDFPFT-UHFFFAOYSA-N 0 3 422.573 4.134 20 0 HIADHN C[C@H](Oc1cccc2ccccc21)C(=O)Nc1cccc2c1CCN(CC(C)(C)O)C2 ZINC000444394484 868807480 /nfs/dbraw/zinc/80/74/80/868807480.db2.gz UERHHVUNOSPHSL-SFHVURJKSA-N 0 3 418.537 4.375 20 0 HIADHN COc1ccc(CN(C)C[C@@H](O)CO[C@H](c2ccccc2)c2ccccc2C)cc1O ZINC000444404383 868813771 /nfs/dbraw/zinc/81/37/71/868813771.db2.gz SOHQAGXMQAMHAY-ATIYNZHBSA-N 0 3 421.537 4.308 20 0 HIADHN Cc1ccc(C(C)C)c(O[C@@H](C)C(=O)Nc2cccc(CN3CCC(O)CC3)c2)c1 ZINC000444448215 868832048 /nfs/dbraw/zinc/83/20/48/868832048.db2.gz BQIITHHMXIUSPL-IBGZPJMESA-N 0 3 410.558 4.481 20 0 HIADHN Cc1ccc(-c2nc(C(=O)Nc3cccc(CN4CCC(O)CC4)c3)cs2)cc1 ZINC000444454962 868834921 /nfs/dbraw/zinc/83/49/21/868834921.db2.gz QPZXZSBPLQPNFI-UHFFFAOYSA-N 0 3 407.539 4.328 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)c1ccc(Oc2ccccc2)nc1 ZINC000444454442 868834932 /nfs/dbraw/zinc/83/49/32/868834932.db2.gz NVQBDQNWXXBVOA-UHFFFAOYSA-N 0 3 403.482 4.083 20 0 HIADHN Cc1cc(O[C@@H](C)C(=O)Nc2cccc(CN3CCC(O)CC3)c2)ccc1C(C)C ZINC000444457234 868834999 /nfs/dbraw/zinc/83/49/99/868834999.db2.gz XNBNVSUYDOHZBC-IBGZPJMESA-N 0 3 410.558 4.481 20 0 HIADHN CC(C)[C@@H]1CC[C@@H](C)C[C@@H]1OCC(=O)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000444461103 868836852 /nfs/dbraw/zinc/83/68/52/868836852.db2.gz ONECUYXFJGOGCJ-LEOXJPRUSA-N 0 3 402.579 4.059 20 0 HIADHN C[C@H](Sc1ccc(Cl)cc1)C(=O)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000444462067 868837744 /nfs/dbraw/zinc/83/77/44/868837744.db2.gz UNHQKEACBDGMMJ-HNNXBMFYSA-N 0 3 404.963 4.416 20 0 HIADHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)[C@@H]1C[C@H]1c1c(F)cccc1Cl ZINC000444462756 868838181 /nfs/dbraw/zinc/83/81/81/868838181.db2.gz VVAXCTUBWRAFTM-QZTJIDSGSA-N 0 3 402.897 4.178 20 0 HIADHN CC1(C)CCCN(CCNC(=O)Cc2csc(COc3ccc(Cl)cc3)n2)C1 ZINC000444613302 868907803 /nfs/dbraw/zinc/90/78/03/868907803.db2.gz WWHYCMRQQIBGSZ-UHFFFAOYSA-N 0 3 421.994 4.156 20 0 HIADHN CN(C)CCN(C(=O)NCc1ccc(COCc2ccccc2)cc1)C1CCCC1 ZINC000468330217 882263128 /nfs/dbraw/zinc/26/31/28/882263128.db2.gz GKTKLAZZZMHABF-UHFFFAOYSA-N 0 3 409.574 4.419 20 0 HIADHN Cc1coc(-c2cccc(NC(=O)N3CCC(CN4C[C@@H](C)O[C@H](C)C4)CC3)c2)n1 ZINC000468334433 882267050 /nfs/dbraw/zinc/26/70/50/882267050.db2.gz RGMXAKSNKDJZHA-QZTJIDSGSA-N 0 3 412.534 4.003 20 0 HIADHN C[C@H](c1nc(-c2csc(I)c2)no1)N1[C@H](C)CC[C@@H]1C ZINC000445301823 869355226 /nfs/dbraw/zinc/35/52/26/869355226.db2.gz VKLODUYLLCSZDG-KXUCPTDWSA-N 0 3 403.289 4.337 20 0 HIADHN Fc1cccc(CN2CCC[C@H](c3nc(-c4ccc(-c5nnco5)cc4)no3)C2)c1 ZINC000445403895 869488116 /nfs/dbraw/zinc/48/81/16/869488116.db2.gz PBZHYXHNIKBGLY-SFHVURJKSA-N 0 3 405.433 4.305 20 0 HIADHN c1cncc(COc2cccc(-c3noc([C@@H]4CCCN4C4CCOCC4)n3)c2)c1 ZINC000445562481 869618834 /nfs/dbraw/zinc/61/88/34/869618834.db2.gz CSIZVJJSDAMTFW-NRFANRHFSA-N 0 3 406.486 4.027 20 0 HIADHN COc1ccc([C@@H](CNC(=O)CCc2cn(C)c3ccccc23)N2CCCC2)cc1 ZINC000445644580 869715566 /nfs/dbraw/zinc/71/55/66/869715566.db2.gz HRAXISSLDXSQOV-XMMPIXPASA-N 0 3 405.542 4.073 20 0 HIADHN COc1cc(OC)cc(N2CC[C@H](N(C)CC3CCC(C(F)(F)F)CC3)C2=O)c1 ZINC000468391572 882336768 /nfs/dbraw/zinc/33/67/68/882336768.db2.gz FMXPDNBVXQTNFT-ZOJXTTQQSA-N 0 3 414.468 4.110 20 0 HIADHN Fc1cccc(CN2CCC[C@H](c3nc(COCC(F)(F)C(F)F)no3)C2)c1 ZINC000445738957 869793501 /nfs/dbraw/zinc/79/35/01/869793501.db2.gz ATLNBGDXIAKGDI-ZDUSSCGKSA-N 0 3 405.367 4.005 20 0 HIADHN COc1cc(C)c(C(=O)N(c2cccc(SC)c2)C2CCN(C)CC2)cc1OC ZINC000445804262 869832112 /nfs/dbraw/zinc/83/21/12/869832112.db2.gz XYEUVSUENIMPJD-UHFFFAOYSA-N 0 3 414.571 4.475 20 0 HIADHN O=C(CN1CCN(CC2CCC(C(F)(F)F)CC2)CC1)Nc1ccc(Cl)cc1 ZINC000468402258 882343346 /nfs/dbraw/zinc/34/33/46/882343346.db2.gz IQGMRSZTJCUZJK-UHFFFAOYSA-N 0 3 417.903 4.265 20 0 HIADHN Cc1ccc(CNC(=O)c2oc3ccccc3c2CN(C)C)c(OC[C@H]2CCOC2)c1 ZINC000445954170 869920237 /nfs/dbraw/zinc/92/02/37/869920237.db2.gz YPIMPLCYFIHVDI-SFHVURJKSA-N 0 3 422.525 4.148 20 0 HIADHN Cc1ccc(CNC(=O)c2oc3ccccc3c2CN(C)C)c(OC[C@@H]2CCOC2)c1 ZINC000445954169 869920267 /nfs/dbraw/zinc/92/02/67/869920267.db2.gz YPIMPLCYFIHVDI-GOSISDBHSA-N 0 3 422.525 4.148 20 0 HIADHN CC1CCN([C@@H](CNC(=O)Nc2c[nH]nc2-c2nccs2)c2cccs2)CC1 ZINC000446395545 870298930 /nfs/dbraw/zinc/29/89/30/870298930.db2.gz XIGBTTSSIHAELS-HNNXBMFYSA-N 0 3 416.576 4.189 20 0 HIADHN C[C@H](NC(=O)CCCN1CCN(c2ccccc2)CC1)c1cccc(N2CCCC2)c1 ZINC000446489744 870402549 /nfs/dbraw/zinc/40/25/49/870402549.db2.gz COOYUFGCEBIVNY-QFIPXVFZSA-N 0 3 420.601 4.066 20 0 HIADHN CN(C)Cc1cccc(NC(=O)C(=O)N(Cc2ccc(F)cc2)C2CCCCC2)c1 ZINC000446546156 870460229 /nfs/dbraw/zinc/46/02/29/870460229.db2.gz OKIRSSKJCSHHSZ-UHFFFAOYSA-N 0 3 411.521 4.187 20 0 HIADHN Cc1ccc([C@H](CN[C@H](C)c2ccc(Br)cc2F)N2CCOCC2)o1 ZINC000446759969 870672721 /nfs/dbraw/zinc/67/27/21/870672721.db2.gz RIYWXFITMCBZDO-KDOFPFPSSA-N 0 3 411.315 4.214 20 0 HIADHN C[S@@](=O)c1ccc(CNC2(c3cccc(OC(F)(F)F)c3)CCOCC2)cc1 ZINC000446825177 870741483 /nfs/dbraw/zinc/74/14/83/870741483.db2.gz AZHQLCMARMKLBZ-MUUNZHRXSA-N 0 3 413.461 4.118 20 0 HIADHN CC(C)N1CCc2nc(CN3CCC[C@H](c4nc(C(F)(F)F)c[nH]4)C3)sc2C1 ZINC000446830651 870746324 /nfs/dbraw/zinc/74/63/24/870746324.db2.gz VJMWDCKAQRBZIW-ZDUSSCGKSA-N 0 3 413.513 4.031 20 0 HIADHN Cc1nn(CC(=O)OC(C)C)c(C)c1CN[C@H](C)c1ccc(Br)cc1 ZINC000446915487 870831504 /nfs/dbraw/zinc/83/15/04/870831504.db2.gz VTHVKKFKVDOLTH-CYBMUJFWSA-N 0 3 408.340 4.065 20 0 HIADHN COc1ccc([C@H](CCn2cncn2)Nc2cccc(CN3CCSCC3)c2)cc1 ZINC000446938205 870848214 /nfs/dbraw/zinc/84/82/14/870848214.db2.gz HMMRPKURCBAIHH-QHCPKHFHSA-N 0 3 423.586 4.079 20 0 HIADHN COC(=O)[C@@](C)(CN[C@H](C)C(=O)Nc1c(C)cccc1C(C)C)c1ccc(F)cc1 ZINC000447024400 870900546 /nfs/dbraw/zinc/90/05/46/870900546.db2.gz WUXVRCJMHZHEIN-OSPHWJPCSA-N 0 3 414.521 4.305 20 0 HIADHN CC[C@H](CNC(=O)Nc1cc(-c2n[nH]c(C)n2)ccc1C)N1CCc2ccccc2C1 ZINC000447056750 870936300 /nfs/dbraw/zinc/93/63/00/870936300.db2.gz CIUFGRSZMVCYOK-OAQYLSRUSA-N 0 3 418.545 4.047 20 0 HIADHN CN1CCC2(CCN(Cc3cnc(-c4ccc(Br)cc4)s3)CC2)C1=O ZINC000447071365 870954050 /nfs/dbraw/zinc/95/40/50/870954050.db2.gz XQBLAPBRQKKSLE-UHFFFAOYSA-N 0 3 420.376 4.017 20 0 HIADHN COc1ccc(F)c(NC(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)c1 ZINC000447136936 871036831 /nfs/dbraw/zinc/03/68/31/871036831.db2.gz RWRFNPSMGRATMW-UHFFFAOYSA-N 0 3 413.415 4.449 20 0 HIADHN Cc1ccc(CNC(=O)C(=O)Nc2cccc(CN(C)C)c2)c(Oc2ccccc2)c1 ZINC000447219591 871105966 /nfs/dbraw/zinc/10/59/66/871105966.db2.gz VGTOUOIXEXUANF-UHFFFAOYSA-N 0 3 417.509 4.104 20 0 HIADHN CC(C)[C@H](NC(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1)c1ccc(F)cc1F ZINC000468500078 882492710 /nfs/dbraw/zinc/49/27/10/882492710.db2.gz CKPKTKCNWUARHR-JKSBSHDWSA-N 0 3 423.548 4.193 20 0 HIADHN COCCO[C@@H]1C[C@H](CO)CN(Cc2ccc(Oc3ccc(Cl)cc3C)cc2)C1 ZINC000447380113 871285833 /nfs/dbraw/zinc/28/58/33/871285833.db2.gz CWEBVDUXXSTUMN-SIKLNZKXSA-N 0 3 419.949 4.287 20 0 HIADHN O[C@H](CN[C@@H](c1ccc(Br)cc1C(F)(F)F)C1CC1)C(F)(F)F ZINC000447528370 871392303 /nfs/dbraw/zinc/39/23/03/871392303.db2.gz IYVITORKUOBNOW-VXGBXAGGSA-N 0 3 406.164 4.432 20 0 HIADHN COc1ccc([C@H](N[C@H]2CCCN(c3cc(C)nn3C)C2)c2ccc(F)cc2)cc1 ZINC000447560245 871449983 /nfs/dbraw/zinc/44/99/83/871449983.db2.gz WEEYAJNSGRCHEZ-XUZZJYLKSA-N 0 3 408.521 4.224 20 0 HIADHN CN(C)[C@@H]1CCOc2c(NC(=O)[C@@H]3CCCCN3Cc3ccc(F)cc3)cccc21 ZINC000447721155 871663811 /nfs/dbraw/zinc/66/38/11/871663811.db2.gz FFZUWDUXJVVUAY-YADHBBJMSA-N 0 3 411.521 4.204 20 0 HIADHN CC(=O)N(c1nc(CNC[C@H]2N(C)CCCC2(C)C)cs1)c1ccc(F)cc1 ZINC000447895198 871807240 /nfs/dbraw/zinc/80/72/40/871807240.db2.gz ANZWUQMCLXPBMM-LJQANCHMSA-N 0 3 404.555 4.177 20 0 HIADHN CC(C)(C)c1cnc(CNC[C@@H](CO)Cc2cccc(OC(F)(F)F)c2)s1 ZINC000447936946 871818375 /nfs/dbraw/zinc/81/83/75/871818375.db2.gz TZHXGPXRPXJJPV-AWEZNQCLSA-N 0 3 402.482 4.280 20 0 HIADHN CO[C@H]1CCOc2c(NC(=O)N(CCN(C)C)Cc3cccc(Cl)c3)cccc21 ZINC000448040984 871873460 /nfs/dbraw/zinc/87/34/60/871873460.db2.gz DWEOPXJBYALUEO-FQEVSTJZSA-N 0 3 417.937 4.406 20 0 HIADHN CCN(C(=O)Nc1cccc2c1OCC[C@@H]2OC)[C@H]1CCN(Cc2ccccc2)C1 ZINC000448042049 871875067 /nfs/dbraw/zinc/87/50/67/871875067.db2.gz HQAXEOMIKNDCQV-UGKGYDQZSA-N 0 3 409.530 4.285 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1cnc(C(C)C)s1 ZINC000448247708 872164850 /nfs/dbraw/zinc/16/48/50/872164850.db2.gz GGUYGRHTMZWSRT-GOSISDBHSA-N 0 3 409.559 4.471 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)N(C)[C@H](C)c3cc(F)ccc3F)CC2)c1 ZINC000468554717 882601791 /nfs/dbraw/zinc/60/17/91/882601791.db2.gz OFMXGDRSQZCXSC-GOSISDBHSA-N 0 3 401.501 4.005 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)N(CC)[C@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000460136143 872628628 /nfs/dbraw/zinc/62/86/28/872628628.db2.gz UGOMOWIQHSFNOV-CVDCTZTESA-N 0 3 422.573 4.343 20 0 HIADHN c1cn(CCc2noc(-c3ccc(CN4CCSCC4)cc3)n2)c2ccccc12 ZINC000460149227 872667766 /nfs/dbraw/zinc/66/77/66/872667766.db2.gz NTJKMKUXWMYPNW-UHFFFAOYSA-N 0 3 404.539 4.483 20 0 HIADHN CC(C)CCCNC(=O)N(Cc1ccccc1Br)C1CCN(C)CC1 ZINC000460160804 872700853 /nfs/dbraw/zinc/70/08/53/872700853.db2.gz LSRAUTFIWGMACB-UHFFFAOYSA-N 0 3 410.400 4.491 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)[C@@H]2CCSc3ccccc32)cc1)[C@@H]1CCCN(C)C1 ZINC000460214081 872800308 /nfs/dbraw/zinc/80/03/08/872800308.db2.gz GGIGTSZOQAHZDC-TZIWHRDSSA-N 0 3 423.582 4.071 20 0 HIADHN C[C@H]1CCC[C@@H]1NC(=O)N(Cc1ccccc1Br)C1CCN(C)CC1 ZINC000460270673 872859827 /nfs/dbraw/zinc/85/98/27/872859827.db2.gz OJDSQARRXRNQRA-KXBFYZLASA-N 0 3 408.384 4.244 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)NC[C@@H](C)Oc3ccccc3Cl)cc2)CC1 ZINC000460441114 873110431 /nfs/dbraw/zinc/11/04/31/873110431.db2.gz SYPHCBULBZLCBI-GOSISDBHSA-N 0 3 415.965 4.068 20 0 HIADHN Cc1ccc(CNCc2ccc(F)c(Br)c2)c(-n2cc(Cl)cn2)n1 ZINC000468596144 882688804 /nfs/dbraw/zinc/68/88/04/882688804.db2.gz BMLCPIWBJOSXET-UHFFFAOYSA-N 0 3 409.690 4.421 20 0 HIADHN CN1CC[C@H](NC(=O)N2CCCC[C@@H]2c2nnc(C3CCC3)o2)[C@@H]1c1ccccc1 ZINC000460557470 873278694 /nfs/dbraw/zinc/27/86/94/873278694.db2.gz UYAFDNHQQHYCIW-ZCNNSNEGSA-N 0 3 409.534 4.019 20 0 HIADHN CCN1C[C@@H](C)N(c2nnc([C@H]3CCO[C@@H]3c3ccccc3)n2CC(C)C)C[C@@H]1C ZINC000460583885 873319859 /nfs/dbraw/zinc/31/98/59/873319859.db2.gz HAJURMLYBVEXGP-YUVXSKOASA-N 0 3 411.594 4.098 20 0 HIADHN CCOC(=O)c1csc(CCNCc2cc(Cl)ccc2Br)n1 ZINC000468610085 882718838 /nfs/dbraw/zinc/71/88/38/882718838.db2.gz QJHKPNCCDRQZON-UHFFFAOYSA-N 0 3 403.729 4.068 20 0 HIADHN CCOCCCn1c(-c2ccoc2)nnc1N1C[C@H](C)N(Cc2ccccc2)C[C@H]1C ZINC000460720812 873520611 /nfs/dbraw/zinc/52/06/11/873520611.db2.gz CSWFQEZJSZAQLN-VQTJNVASSA-N 0 3 423.561 4.064 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)[C@@H](C)c3ccc(F)c(F)c3)CC2)c1 ZINC000460732085 873545006 /nfs/dbraw/zinc/54/50/06/873545006.db2.gz ZLTKFHTYZGXMCL-IBGZPJMESA-N 0 3 415.528 4.095 20 0 HIADHN O=C(NC[C@H]1CCCN1Cc1ccccc1)c1ccc(OCc2ccccn2)cc1 ZINC000461062457 873942219 /nfs/dbraw/zinc/94/22/19/873942219.db2.gz FKNVALAGBTVKEA-HSZRJFAPSA-N 0 3 401.510 4.055 20 0 HIADHN CC[C@H](NC[C@@H]1CN(C(=O)c2ccccc2)[C@H]2CCN1C2)c1cccc(Cl)c1F ZINC000461101823 874019741 /nfs/dbraw/zinc/01/97/41/874019741.db2.gz FNFCJHCOWCJRQT-UEXGIBASSA-N 0 3 415.940 4.119 20 0 HIADHN C[C@H](NC(=O)NC[C@@H](Cc1ccccc1)C(F)(F)F)[C@H](c1ccccc1)N(C)C ZINC000461214985 874217665 /nfs/dbraw/zinc/21/76/65/874217665.db2.gz AMULWBYNOTYIDG-PWIZWCRZSA-N 0 3 407.480 4.398 20 0 HIADHN CCCN(C(=O)c1ccc(N2CCN(CC)CC2)cc1)[C@@H](C)c1ccccc1OC ZINC000468677740 882805683 /nfs/dbraw/zinc/80/56/83/882805683.db2.gz QVDHANUQEXCPOD-FQEVSTJZSA-N 0 3 409.574 4.451 20 0 HIADHN O=C([C@H]1CCCN(Cc2cccc(F)c2)C1)N1CC[C@H](COCc2ccccc2)C1 ZINC000461380187 874385960 /nfs/dbraw/zinc/38/59/60/874385960.db2.gz APSJLVHCTSWFNO-GOTSBHOMSA-N 0 3 410.533 4.103 20 0 HIADHN Fc1ccc(Br)cc1-c1nnc(N2CC[C@H](N3CCCCC3)C2)s1 ZINC000468706824 882822989 /nfs/dbraw/zinc/82/29/89/882822989.db2.gz QCKLBCVNXOHKBA-ZDUSSCGKSA-N 0 3 411.344 4.171 20 0 HIADHN Cc1ccc(C(=O)CCC(=O)N2C[C@@H]3CCN(Cc4ccccc4)C[C@H]3C2)cc1C ZINC000461439477 874492850 /nfs/dbraw/zinc/49/28/50/874492850.db2.gz RQMGPEOBOZRRPL-ZEQRLZLVSA-N 0 3 404.554 4.247 20 0 HIADHN COc1ccc2c(c1)C1(CC1)CN(C(=O)[C@H]1CCCN(Cc3cccc(F)c3)C1)C2 ZINC000461448256 874507900 /nfs/dbraw/zinc/50/79/00/874507900.db2.gz OCZPTYOYVACDKX-FQEVSTJZSA-N 0 3 408.517 4.120 20 0 HIADHN CCc1nc2c(s1)[C@H](N[C@H]1CCCN(Cc3ccc(F)cc3F)C1=O)CCC2 ZINC000468812318 882872076 /nfs/dbraw/zinc/87/20/76/882872076.db2.gz CFYNLJHZJFUWAV-AEFFLSMTSA-N 0 3 405.514 4.142 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)NC(C)(C)c1nc(C(F)(F)F)cs1 ZINC000461714515 874863959 /nfs/dbraw/zinc/86/39/59/874863959.db2.gz ITCXLJHQOFJJBB-CYBMUJFWSA-N 0 3 414.497 4.217 20 0 HIADHN CCN1CCN(CCC(=O)N(Cc2ccc(C(C)C)cc2)c2ccc(OC)cc2)CC1 ZINC000468815722 882873309 /nfs/dbraw/zinc/87/33/09/882873309.db2.gz DIGBGWRYOPKGMC-UHFFFAOYSA-N 0 3 423.601 4.379 20 0 HIADHN CC(C)Oc1ccc(C(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)nc1 ZINC000468825282 882878403 /nfs/dbraw/zinc/87/84/03/882878403.db2.gz FIYPMZXFAKMBTK-UHFFFAOYSA-N 0 3 409.452 4.092 20 0 HIADHN CN(C)Cc1cccc(C(=O)N[C@@H](Cn2cnc3ccccc32)c2ccc(F)cc2)c1 ZINC000461872755 875024400 /nfs/dbraw/zinc/02/44/00/875024400.db2.gz WXZYFEACRRXYQH-QHCPKHFHSA-N 0 3 416.500 4.408 20 0 HIADHN C[C@H]1CN(Cc2ccccc2NC(=O)c2ccc(Nc3ccncc3)cc2)C[C@H](C)O1 ZINC000461875334 875028832 /nfs/dbraw/zinc/02/88/32/875028832.db2.gz GJYSWMWCXNGYKR-OALUTQOASA-N 0 3 416.525 4.109 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2NC(=O)c2ccc(Nc3ccncc3)cc2)C[C@H](C)O1 ZINC000461875333 875028990 /nfs/dbraw/zinc/02/89/90/875028990.db2.gz GJYSWMWCXNGYKR-KDURUIRLSA-N 0 3 416.525 4.109 20 0 HIADHN Cc1ccc(C(=O)N2C[C@H](C)C[C@H](C)C2)cc1NC(=O)c1cccc(CN(C)C)c1 ZINC000461883746 875035463 /nfs/dbraw/zinc/03/54/63/875035463.db2.gz OHOCSXSMLDJXSC-HDICACEKSA-N 0 3 407.558 4.427 20 0 HIADHN Cc1ccc(C(=O)N2C[C@@H](C)C[C@H](C)C2)cc1NC(=O)c1cccc(CN(C)C)c1 ZINC000461883748 875035596 /nfs/dbraw/zinc/03/55/96/875035596.db2.gz OHOCSXSMLDJXSC-ROUUACIJSA-N 0 3 407.558 4.427 20 0 HIADHN CCOc1ccc([C@H]2CCCN2C(=O)CCN2CCN(c3cccc(C)c3)CC2)cc1 ZINC000462045212 875158310 /nfs/dbraw/zinc/15/83/10/875158310.db2.gz BNTSXQRGPDMJFI-RUZDIDTESA-N 0 3 421.585 4.270 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)NCc1ncc(-c2ccccc2)cn1 ZINC000462049980 875163450 /nfs/dbraw/zinc/16/34/50/875163450.db2.gz HIYFKYPMXQRTQW-UHFFFAOYSA-N 0 3 423.948 4.070 20 0 HIADHN Cc1ccccc1-c1cc(NC(=O)N[C@@H](CN2CCCC2)c2ccccc2)n(C)n1 ZINC000462086177 875194941 /nfs/dbraw/zinc/19/49/41/875194941.db2.gz WNTZXJGMWYOIAO-QFIPXVFZSA-N 0 3 403.530 4.354 20 0 HIADHN C[C@H](CC(=O)NCCCCN1CCN(c2ccccc2)CC1)c1c[nH]c2ccccc21 ZINC000468873252 882905139 /nfs/dbraw/zinc/90/51/39/882905139.db2.gz HXJLGTMQTIDKLZ-OAQYLSRUSA-N 0 3 418.585 4.380 20 0 HIADHN Cc1nc2ccc(Br)cc2c(N2CCC[C@@H](C(=O)NCC3CC3)C2)c1C ZINC000462098539 875206916 /nfs/dbraw/zinc/20/69/16/875206916.db2.gz USUPWGBJKVPPKU-MRXNPFEDSA-N 0 3 416.363 4.357 20 0 HIADHN CSc1nc(C(C)(C)C)nc(C)c1C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C ZINC000462178552 875278187 /nfs/dbraw/zinc/27/81/87/875278187.db2.gz IMMQKEFFPDPWFO-MAUKXSAKSA-N 0 3 412.603 4.055 20 0 HIADHN CC(C)C(=O)Nc1ccc(Cl)c(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)c1 ZINC000462181397 875281624 /nfs/dbraw/zinc/28/16/24/875281624.db2.gz KQQJPYAAVSDZRJ-IIBYNOLFSA-N 0 3 413.949 4.185 20 0 HIADHN CC(C)c1ccc([C@H](NCCN2C(=O)NC3(CCCC3)C2=O)c2cccs2)cc1 ZINC000462221073 875330223 /nfs/dbraw/zinc/33/02/23/875330223.db2.gz IAHZIZXZRZYGRV-FQEVSTJZSA-N 0 3 411.571 4.415 20 0 HIADHN CC(C)c1ccc([C@@H](NCCN2C(=O)NC3(CCCC3)C2=O)c2cccs2)cc1 ZINC000462221074 875330303 /nfs/dbraw/zinc/33/03/03/875330303.db2.gz IAHZIZXZRZYGRV-HXUWFJFHSA-N 0 3 411.571 4.415 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)NC[C@H](Cc2ccccc2)C(F)(F)F)CC1 ZINC000462223720 875330961 /nfs/dbraw/zinc/33/09/61/875330961.db2.gz KYHAYCSOGVCQPH-SFHVURJKSA-N 0 3 423.479 4.307 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Nc1ccc(OCc2ccncc2)cc1 ZINC000462243860 875360316 /nfs/dbraw/zinc/36/03/16/875360316.db2.gz CVARYHNQVWNRSK-NTKDMRAZSA-N 0 3 416.525 4.303 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N[C@@H]3CCO[C@@H](c4ccccc4)C3)c(C)c2)CC1 ZINC000462257153 875379795 /nfs/dbraw/zinc/37/97/95/875379795.db2.gz NDLWCEAFYQQQKJ-ZJSXRUAMSA-N 0 3 422.573 4.179 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)CN[C@H](c1ccccc1)C(F)(F)F ZINC000468887329 882928504 /nfs/dbraw/zinc/92/85/04/882928504.db2.gz GMUXQLZLMTVTBB-XMSQKQJNSA-N 0 3 419.491 4.003 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)CN[C@@H](c1ccccc1)C(F)(F)F ZINC000468886988 882928580 /nfs/dbraw/zinc/92/85/80/882928580.db2.gz GMUXQLZLMTVTBB-AVRDEDQJSA-N 0 3 419.491 4.003 20 0 HIADHN CCN1CC[C@H](N(C)S(=O)(=O)c2ccc3nc(C(C)(C)C)sc3c2)C[C@H]1C ZINC000462334377 875450906 /nfs/dbraw/zinc/45/09/06/875450906.db2.gz JMCOTVCNDRWMPN-CABCVRRESA-N 0 3 409.621 4.087 20 0 HIADHN CC(C)[C@H](C)N1Cc2cccc(NS(=O)(=O)c3ccccc3Cn3ccnc3)c2C1 ZINC000462363478 875476256 /nfs/dbraw/zinc/47/62/56/875476256.db2.gz DMCJFBRNZOJWPD-SFHVURJKSA-N 0 3 424.570 4.092 20 0 HIADHN CC(C)(C)OC1CCN(C[C@@H](O)COc2ccc(Cl)cc2Br)CC1 ZINC000468891805 882935754 /nfs/dbraw/zinc/93/57/54/882935754.db2.gz IUJPORZLXDTYFL-CQSZACIVSA-N 0 3 420.775 4.122 20 0 HIADHN Fc1ccc(-c2ccc(CNCc3cnc(N4CCOCC4)c(F)c3)s2)cc1 ZINC000462525949 875642784 /nfs/dbraw/zinc/64/27/84/875642784.db2.gz DKOIAWQODCKYAC-UHFFFAOYSA-N 0 3 401.482 4.215 20 0 HIADHN CN(C)CCN(CC1CCCCC1)C(=O)N[C@H]1c2ccccc2CC12CCOCC2 ZINC000462535815 875655321 /nfs/dbraw/zinc/65/53/21/875655321.db2.gz GTDKZMDQIXSWTL-QHCPKHFHSA-N 0 3 413.606 4.234 20 0 HIADHN O=S1(=O)CCCN1c1cccc(CNCc2ccc(F)c(-c3cccs3)c2)c1 ZINC000462548935 875672999 /nfs/dbraw/zinc/67/29/99/875672999.db2.gz VKAUVDWGXZNGOT-UHFFFAOYSA-N 0 3 416.543 4.384 20 0 HIADHN Cc1ccnc(-c2cccc(NC(=O)N[C@@H]3CN(Cc4ccccc4)C[C@H]3C)c2)n1 ZINC000462557360 875683174 /nfs/dbraw/zinc/68/31/74/875683174.db2.gz LOQCBLWYOMVRSW-VGOFRKELSA-N 0 3 401.514 4.094 20 0 HIADHN COc1cccc(Cl)c1CC(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 ZINC000462624750 875737030 /nfs/dbraw/zinc/73/70/30/875737030.db2.gz URVZYLCEFWSKCR-SFHVURJKSA-N 0 3 424.932 4.173 20 0 HIADHN Clc1cc(Br)ccc1CNC[C@@H](c1cccs1)N1CCOCC1 ZINC000462659196 875764520 /nfs/dbraw/zinc/76/45/20/875764520.db2.gz QCWFCWHCWUNHPJ-INIZCTEOSA-N 0 3 415.784 4.327 20 0 HIADHN C[C@@H](N[C@H]1CCCN(Cc2ccc(F)cc2F)C1=O)c1ccc(OC(F)F)cc1 ZINC000468906853 882961788 /nfs/dbraw/zinc/96/17/88/882961788.db2.gz HVYNVKOXQKLXPQ-YJYMSZOUSA-N 0 3 410.411 4.408 20 0 HIADHN C[C@H]1C[C@H](NCc2ccc(-n3ccc(C(F)(F)F)n3)cc2)C(=O)N1c1ccccc1 ZINC000462737758 875809826 /nfs/dbraw/zinc/80/98/26/875809826.db2.gz WNHARKFVSWOHFE-KXBFYZLASA-N 0 3 414.431 4.175 20 0 HIADHN CN(Cc1ccccc1Br)C(=O)CCNCc1cc2cc(F)ccc2o1 ZINC000462742153 875812983 /nfs/dbraw/zinc/81/29/83/875812983.db2.gz HBBHEGWYUBPENQ-UHFFFAOYSA-N 0 3 419.294 4.473 20 0 HIADHN COc1ccccc1[C@H](CNc1ncccc1C(=O)N1CCCCC1)N1CCCCC1 ZINC000462778085 875834757 /nfs/dbraw/zinc/83/47/57/875834757.db2.gz QZDHDBXOFWSOGI-QFIPXVFZSA-N 0 3 422.573 4.355 20 0 HIADHN COC(=O)c1cc(CN[C@H](Cc2ccc(F)cc2)c2ccc(OC)cc2)n(C)c1C ZINC000462782835 875837337 /nfs/dbraw/zinc/83/73/37/875837337.db2.gz GNFDIVIDJRQWJD-HSZRJFAPSA-N 0 3 410.489 4.341 20 0 HIADHN Fc1cc(CCNCc2ccc(Br)cc2Cl)c2c(c1)COCO2 ZINC000462782580 875837592 /nfs/dbraw/zinc/83/75/92/875837592.db2.gz XHBRHKGANGTWRS-UHFFFAOYSA-N 0 3 400.675 4.440 20 0 HIADHN COC(=O)c1cc(CN[C@H]2c3cc(Br)ccc3SC[C@@H]2C)n(C)c1C ZINC000462784318 875838791 /nfs/dbraw/zinc/83/87/91/875838791.db2.gz DJPKCNLIHXTCOE-BBATYDOGSA-N 0 3 423.376 4.455 20 0 HIADHN CC(C)(C)OC(=O)c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1 ZINC000462798858 875847355 /nfs/dbraw/zinc/84/73/55/875847355.db2.gz NXNHUNJJBDNCBS-UHFFFAOYSA-N 0 3 400.563 4.303 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1[nH]c2ccccc2c1Br ZINC000462823022 875862009 /nfs/dbraw/zinc/86/20/09/875862009.db2.gz RJRIIEJHJCJDIX-RDTXWAMCSA-N 0 3 412.331 4.181 20 0 HIADHN CC[C@@H](NCc1cccc(N2CCCS2(=O)=O)c1)c1ccc(OC(F)F)cc1 ZINC000462833025 875868513 /nfs/dbraw/zinc/86/85/13/875868513.db2.gz KQXFUGZCXPLRQR-LJQANCHMSA-N 0 3 410.486 4.069 20 0 HIADHN C[C@@H]1C[C@@H](NCc2cnc(N3CCOCC3)c(F)c2)c2cccc(Br)c21 ZINC000462837468 875872674 /nfs/dbraw/zinc/87/26/74/875872674.db2.gz XNKPLKVVHXGKAX-FZKQIMNGSA-N 0 3 420.326 4.158 20 0 HIADHN C[C@H](NCc1ccc(N2CCCS2(=O)=O)cc1)c1ccc(OC(C)(C)C)cc1 ZINC000462838724 875873999 /nfs/dbraw/zinc/87/39/99/875873999.db2.gz ZJBSDQINAOKTRR-KRWDZBQOSA-N 0 3 402.560 4.255 20 0 HIADHN O=S1(=O)CCCN1c1cccc(CN[C@@H]2CCCCc3ccc(Cl)cc32)c1 ZINC000462840039 875875143 /nfs/dbraw/zinc/87/51/43/875875143.db2.gz KOIPZSTZOJYZDS-OAQYLSRUSA-N 0 3 404.963 4.437 20 0 HIADHN C[C@H](NC[C@H](O)CN1CCc2ccccc2C1)c1csc(-c2ccccc2F)n1 ZINC000462885109 875912107 /nfs/dbraw/zinc/91/21/07/875912107.db2.gz UDJSVPPZJLXFBZ-LPHOPBHVSA-N 0 3 411.546 4.019 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)cc1OC ZINC000463012516 876027997 /nfs/dbraw/zinc/02/79/97/876027997.db2.gz QMBNDYAJFAXQFE-QIJUGHKUSA-N 0 3 423.557 4.071 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N1CCC(C(F)(F)F)(C(F)(F)F)C1 ZINC000463011305 876028881 /nfs/dbraw/zinc/02/88/81/876028881.db2.gz LGIKRFWXHRAVIJ-DZGCQCFKSA-N 0 3 423.401 4.033 20 0 HIADHN Cc1ccc([C@H](CNC(=O)N[C@H]2CCO[C@@H](c3ccccc3)C2)N2CCCC2)cc1 ZINC000463018252 876035876 /nfs/dbraw/zinc/03/58/76/876035876.db2.gz BXRKUXFRFAAVLO-KMDXXIMOSA-N 0 3 407.558 4.351 20 0 HIADHN CC(C)Cc1ccc([C@H](C)C(=O)Nc2ccccc2CN2CCC[C@@H](C(N)=O)C2)cc1 ZINC000468932817 882996146 /nfs/dbraw/zinc/99/61/46/882996146.db2.gz LLWMSGSGLJGEFF-WMZHIEFXSA-N 0 3 421.585 4.325 20 0 HIADHN Cc1ncsc1-c1nc2ccccc2n1CC(=O)Nc1cccc(CN(C)C)c1 ZINC000463098058 876131178 /nfs/dbraw/zinc/13/11/78/876131178.db2.gz LOJYQKDOBVEGIV-UHFFFAOYSA-N 0 3 405.527 4.169 20 0 HIADHN CCCOc1ccc(CCC(=O)Nc2ccc(CN3CCN(CC)CC3)cc2)cc1 ZINC000463108644 876148101 /nfs/dbraw/zinc/14/81/01/876148101.db2.gz PQYLVGODYSFHGX-UHFFFAOYSA-N 0 3 409.574 4.184 20 0 HIADHN CCSCc1ccccc1C(=O)NCc1ccc(CN2CCN(CC)CC2)cc1 ZINC000468934232 882999800 /nfs/dbraw/zinc/99/98/00/882999800.db2.gz KNUXUGPSZACIQT-UHFFFAOYSA-N 0 3 411.615 4.007 20 0 HIADHN C[C@H](CCc1cccc(F)c1)C(=O)NCCCCN1CCN(c2ccccc2)CC1 ZINC000463123696 876166417 /nfs/dbraw/zinc/16/64/17/876166417.db2.gz CORWJVFKWCIBIG-OAQYLSRUSA-N 0 3 411.565 4.113 20 0 HIADHN COc1cccc([C@H](CNC(=O)N[C@@H]2CCO[C@H](c3ccccc3)C2)N2CCCC2)c1 ZINC000463155971 876209117 /nfs/dbraw/zinc/20/91/17/876209117.db2.gz QEWREIXCWWMIBA-NHTMILBNSA-N 0 3 423.557 4.052 20 0 HIADHN COc1cccc([C@H](CNC(=O)N[C@@H]2CCO[C@@H](c3ccccc3)C2)N2CCCC2)c1 ZINC000463155974 876209963 /nfs/dbraw/zinc/20/99/63/876209963.db2.gz QEWREIXCWWMIBA-YFNKSVMNSA-N 0 3 423.557 4.052 20 0 HIADHN C[C@H](c1ccsc1)N1CCN(C(=O)NC[C@@H](c2cccs2)N2CCCC2)CC1 ZINC000463158132 876211454 /nfs/dbraw/zinc/21/14/54/876211454.db2.gz CJIZBDAKHXLHTM-MJGOQNOKSA-N 0 3 418.632 4.035 20 0 HIADHN O=C(CN1CCCC[C@@H]1[C@H]1CCCC[C@@H]1O)NCc1ccccc1OC1CCCC1 ZINC000463201620 876261946 /nfs/dbraw/zinc/26/19/46/876261946.db2.gz MGKQOLYYBRIDEG-ZLNRFVROSA-N 0 3 414.590 4.030 20 0 HIADHN O=C(c1ccccc1Cl)N1CCC(N[C@@H](CO)c2cccc(Cl)c2F)CC1 ZINC000463248309 876306357 /nfs/dbraw/zinc/30/63/57/876306357.db2.gz SWNZXPKFFCBXFM-SFHVURJKSA-N 0 3 411.304 4.060 20 0 HIADHN C[C@H](C(=O)N(Cc1ccco1)C1CCN(C)CC1)c1cccc(Br)c1 ZINC000463259666 876317019 /nfs/dbraw/zinc/31/70/19/876317019.db2.gz QCXGFCYAUWAEAX-HNNXBMFYSA-N 0 3 405.336 4.269 20 0 HIADHN C[C@H]1CCCc2ccccc2[C@H]1NC(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000463261721 876320730 /nfs/dbraw/zinc/32/07/30/876320730.db2.gz IRASLBWTUIWYPX-DFBJGRDBSA-N 0 3 421.585 4.156 20 0 HIADHN O=C(NCc1cc2cc(Br)ccc2[nH]1)c1cccc(CN2CCCC2)c1 ZINC000468959402 883024934 /nfs/dbraw/zinc/02/49/34/883024934.db2.gz LFEMLVIPGDIKFA-UHFFFAOYSA-N 0 3 412.331 4.456 20 0 HIADHN CC[C@H](O[C@H]1CCC[C@H](C)C1)C(=O)Nc1ccc(N2CCN(CC)CC2)cc1C ZINC000463429615 876483996 /nfs/dbraw/zinc/48/39/96/876483996.db2.gz JRGJERMXSRIWLZ-HARLFGEKSA-N 0 3 401.595 4.449 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)c1cccc(-c2noc(C3CC3)n2)c1 ZINC000463431149 876488077 /nfs/dbraw/zinc/48/80/77/876488077.db2.gz POCLZWKNPFOMOO-NRFANRHFSA-N 0 3 402.498 4.181 20 0 HIADHN O=C(c1cccc(CN2CCC[C@](CO)(Cc3ccccc3)C2)c1)N1CCCCC1 ZINC000463437145 876493523 /nfs/dbraw/zinc/49/35/23/876493523.db2.gz DIQBWYTYOFSNFW-SANMLTNESA-N 0 3 406.570 4.130 20 0 HIADHN O=C([C@@H](c1ccccc1)N1CCC[C@](CO)(Cc2ccccc2)C1)N1CCCCC1 ZINC000463437463 876493854 /nfs/dbraw/zinc/49/38/54/876493854.db2.gz FAAYXXDRLUQPCZ-RSXGOPAZSA-N 0 3 406.570 4.057 20 0 HIADHN OC[C@]1(c2ccccc2)CCN(Cc2ccnc(-c3ccc(Br)cc3)n2)C1 ZINC000463442664 876500968 /nfs/dbraw/zinc/50/09/68/876500968.db2.gz MAYVDOIRXFHNRB-QFIPXVFZSA-N 0 3 424.342 4.042 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)c2cc3cc(C(F)(F)F)ccc3n2C)o1 ZINC000463523666 876593161 /nfs/dbraw/zinc/59/31/61/876593161.db2.gz OEXHYKXMVWEYPO-UHFFFAOYSA-N 0 3 407.436 4.303 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)c2c(C)nn(C)c2Sc2ccccc2)N(C)C)cc1 ZINC000463524504 876594096 /nfs/dbraw/zinc/59/40/96/876594096.db2.gz QSHUVQDPWNYYGE-OAQYLSRUSA-N 0 3 422.598 4.475 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)N[C@@H]1CCOc2c(F)ccc(F)c21 ZINC000463610683 876729895 /nfs/dbraw/zinc/72/98/95/876729895.db2.gz HTAAWLMEXQEGEI-OXQOHEQNSA-N 0 3 415.484 4.094 20 0 HIADHN CN(CCCN(C)C(=O)Nc1cccc(-c2ncc3n2CCCC3)c1)Cc1ccco1 ZINC000463701677 876820448 /nfs/dbraw/zinc/82/04/48/876820448.db2.gz YLIVMJPZLYAKHA-UHFFFAOYSA-N 0 3 421.545 4.465 20 0 HIADHN CN(C)C(=O)N1CCC(N[C@H]2CCCc3sc(-c4ccc(F)cc4)nc32)CC1 ZINC000463716426 876835921 /nfs/dbraw/zinc/83/59/21/876835921.db2.gz LIVBMLULGTZDRN-KRWDZBQOSA-N 0 3 402.539 4.062 20 0 HIADHN O=C(NC[C@H]1CCCN1Cc1ccccc1)c1cccc(-c2noc(C3CC3)n2)c1 ZINC000463740714 876860628 /nfs/dbraw/zinc/86/06/28/876860628.db2.gz FCMGFNWZWFBCEI-OAQYLSRUSA-N 0 3 402.498 4.008 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)[C@H]1C[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000463769033 876890506 /nfs/dbraw/zinc/89/05/06/876890506.db2.gz MSGDGBSSLQJSRB-LZQZEXGQSA-N 0 3 402.460 4.330 20 0 HIADHN CN(C)[C@@H]1Cc2ccccc2N(C(=O)c2cc(-c3ccccc3C(F)(F)F)on2)C1 ZINC000463776238 876896616 /nfs/dbraw/zinc/89/66/16/876896616.db2.gz OYDOGXZKZPPMSB-OAHLLOKOSA-N 0 3 415.415 4.494 20 0 HIADHN O=C(NCCN1CCCC1)c1ccc(NC(=O)C2CCC(c3ccccc3)CC2)cc1 ZINC000463834268 876952971 /nfs/dbraw/zinc/95/29/71/876952971.db2.gz FLLWMAHGNNBDHA-UHFFFAOYSA-N 0 3 419.569 4.425 20 0 HIADHN COc1ccc([C@H](CNC(=O)N[C@H](c2nc(C)cs2)C2CC2)N2CCCC2)cc1 ZINC000463956013 877078577 /nfs/dbraw/zinc/07/85/77/877078577.db2.gz SSWKZWSJKCNEBN-PMACEKPBSA-N 0 3 414.575 4.048 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)N3CC[C@H](CSc4ccccc4)C3)CC2)c1 ZINC000469027084 883094588 /nfs/dbraw/zinc/09/45/88/883094588.db2.gz SUUDKJMMAKUVGQ-QFIPXVFZSA-N 0 3 423.626 4.148 20 0 HIADHN Cc1ccc([C@@H](Cc2ccccc2Br)NCc2ccc(C(N)=O)nc2)cc1 ZINC000464064005 877209710 /nfs/dbraw/zinc/20/97/10/877209710.db2.gz JPYHKKGFKHJJLC-OAQYLSRUSA-N 0 3 424.342 4.325 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(OCCNCc3cn(C(C)C)nc3C)c2)cc1 ZINC000464066899 877214166 /nfs/dbraw/zinc/21/41/66/877214166.db2.gz JEATVXILFFNYNG-UHFFFAOYSA-N 0 3 422.529 4.202 20 0 HIADHN Cc1c2ccc(NC(=O)NC[C@H](c3ccc(OC(C)C)cc3)N(C)C)cc2nn1C ZINC000464086589 877240214 /nfs/dbraw/zinc/24/02/14/877240214.db2.gz IWLJRBZMIMXKSJ-JOCHJYFZSA-N 0 3 409.534 4.093 20 0 HIADHN CC[C@H](CNC(=O)N[C@H](C)c1cn(C(C)(C)C)nc1C)N1CCc2ccccc2C1 ZINC000464139457 877303504 /nfs/dbraw/zinc/30/35/04/877303504.db2.gz IITBNRDYGYMKFD-DYESRHJHSA-N 0 3 411.594 4.144 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)N(Cc2ccccc2)[C@H](C)c2ccccc2)CC1 ZINC000464251950 877430544 /nfs/dbraw/zinc/43/05/44/877430544.db2.gz PZWKPKXVZTVLFX-XZOQPEGZSA-N 0 3 422.617 4.233 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)N(Cc2ccccc2)[C@H](C)c2ccccc2)CC1 ZINC000464251949 877430615 /nfs/dbraw/zinc/43/06/15/877430615.db2.gz PZWKPKXVZTVLFX-DHIUTWEWSA-N 0 3 422.617 4.233 20 0 HIADHN COc1cc(NC(=O)CCCN2CCN(c3ccccc3)CC2)ccc1OC(C)C ZINC000464452930 877671356 /nfs/dbraw/zinc/67/13/56/877671356.db2.gz MSSIPKWTFGSHMM-UHFFFAOYSA-N 0 3 411.546 4.023 20 0 HIADHN Cc1c([C@H](C)NCCCS(=O)(=O)c2cccc(C)c2)cnn1-c1ccc(F)cc1 ZINC000464479548 877699351 /nfs/dbraw/zinc/69/93/51/877699351.db2.gz ISRBWAYFGWUAMX-KRWDZBQOSA-N 0 3 415.534 4.143 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)NC[C@@H](C)Oc3ccc(Cl)cc3)cc2)CC1 ZINC000464629207 877847340 /nfs/dbraw/zinc/84/73/40/877847340.db2.gz JYMIKLUUJKYDPP-GOSISDBHSA-N 0 3 415.965 4.068 20 0 HIADHN COCCCN(C(=O)c1ccc(-c2ccc(F)cc2)cc1F)C1CCN(C)CC1 ZINC000464719200 877946182 /nfs/dbraw/zinc/94/61/82/877946182.db2.gz IWHRRLGHVNGPOT-UHFFFAOYSA-N 0 3 402.485 4.205 20 0 HIADHN C[C@H](NC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1)c1nc(C2CCCCC2)no1 ZINC000464721761 877950465 /nfs/dbraw/zinc/95/04/65/877950465.db2.gz YFJIYOIVGWCDPL-LPHOPBHVSA-N 0 3 414.525 4.346 20 0 HIADHN O=C(CN1CC[C@@H](CSc2ccccc2)C1)N1CCc2[nH]c3ccccc3c2C1 ZINC000464766028 878007517 /nfs/dbraw/zinc/00/75/17/878007517.db2.gz RVJNOIJQRVJHIS-GOSISDBHSA-N 0 3 405.567 4.167 20 0 HIADHN CCS[C@H]1CC[C@@H](N(C)CC(=O)N(C)Cc2cc(Br)cs2)C1 ZINC000464767908 878011172 /nfs/dbraw/zinc/01/11/72/878011172.db2.gz DWTPOPMBVTWTEX-KGLIPLIRSA-N 0 3 405.427 4.075 20 0 HIADHN CCS[C@@H]1CC[C@@H](N(C)CC(=O)Nc2ccc3nc(C(F)(F)F)[nH]c3c2)C1 ZINC000464780628 878024829 /nfs/dbraw/zinc/02/48/29/878024829.db2.gz VXIYHEXDUNTBHE-CHWSQXEVSA-N 0 3 400.470 4.126 20 0 HIADHN CCN(CC(=O)Nc1cccc(C(=O)N(C)C)c1)[C@@H](Cc1ccc(F)cc1)C(C)C ZINC000464791934 878037523 /nfs/dbraw/zinc/03/75/23/878037523.db2.gz TUSBMRGXJUKXEQ-QFIPXVFZSA-N 0 3 413.537 4.055 20 0 HIADHN CCOc1ccc(-c2noc(CN3CC[C@@H](C)N(Cc4ccccc4)CC3)n2)cc1 ZINC000464832540 878089771 /nfs/dbraw/zinc/08/97/71/878089771.db2.gz LWEGPAXKJQPZRB-LJQANCHMSA-N 0 3 406.530 4.232 20 0 HIADHN C[C@H]1CCN(C(=O)c2ccnc(OCc3ccccc3)c2)CCN1Cc1ccccc1 ZINC000464889261 878189056 /nfs/dbraw/zinc/18/90/56/878189056.db2.gz GHDHPEAQLAIDJX-NRFANRHFSA-N 0 3 415.537 4.397 20 0 HIADHN CC(C)C(=O)N(C)Cc1ccc(C(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)cc1 ZINC000464900890 878209859 /nfs/dbraw/zinc/20/98/59/878209859.db2.gz FDWLPYPFCMUZGO-NRFANRHFSA-N 0 3 421.585 4.038 20 0 HIADHN Cc1cc(C(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)c2cnn(C(C)C)c2n1 ZINC000464903362 878217582 /nfs/dbraw/zinc/21/75/82/878217582.db2.gz DGXNRFQCBBVJEM-LJQANCHMSA-N 0 3 405.546 4.057 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCc3ccc(C)cc3SC)c(C)c2)CC1 ZINC000464912580 878229674 /nfs/dbraw/zinc/22/96/74/878229674.db2.gz OXBWAULJGIBUIR-UHFFFAOYSA-N 0 3 412.603 4.489 20 0 HIADHN CCN(C[C@@H]1CCN(Cc2ccccc2)C1)C(=O)[C@@H](C)CC(=O)c1ccccc1F ZINC000464960541 878300570 /nfs/dbraw/zinc/30/05/70/878300570.db2.gz KRKYECMIKGXXDH-PZJWPPBQSA-N 0 3 410.533 4.405 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)N[C@H](c2ccc(C)cc2)c2ccccn2)cc1 ZINC000503374919 912355007 /nfs/dbraw/zinc/35/50/07/912355007.db2.gz VQDBWRQVMKNGOS-DNQXCXABSA-N 0 3 418.541 4.090 20 0 HIADHN CN(C)[C@@H](CNC(=O)N(Cc1ccc2c(c1)CCO2)C1CCCC1)Cc1ccccc1 ZINC000465427539 878857725 /nfs/dbraw/zinc/85/77/25/878857725.db2.gz YIEZFUVKRPEPEB-XMMPIXPASA-N 0 3 421.585 4.249 20 0 HIADHN CC[C@@H](NC(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1)c1c(C)nn(C)c1C ZINC000465427546 878858306 /nfs/dbraw/zinc/85/83/06/878858306.db2.gz YJDLLAXZYSIFHC-MOPGFXCFSA-N 0 3 417.623 4.322 20 0 HIADHN Cc1ccc(-c2nc(CNC(=O)NC[C@@H](c3cccs3)N3CCCC3)co2)cc1 ZINC000465432749 878865132 /nfs/dbraw/zinc/86/51/32/878865132.db2.gz LUMCPLHVVZJEGK-IBGZPJMESA-N 0 3 410.543 4.348 20 0 HIADHN O=C(c1cccc(CN2CCC[C@@H](c3ncc4n3CCCC4)C2)c1)N1CCCCC1 ZINC000503411209 912393092 /nfs/dbraw/zinc/39/30/92/912393092.db2.gz ZZFJAERPCDLGMF-JOCHJYFZSA-N 0 3 406.574 4.225 20 0 HIADHN O=C(NC[C@H](c1ccccc1)N1CCCC1)N1CC[C@H](COCc2ccccc2)C1 ZINC000465436976 878869510 /nfs/dbraw/zinc/86/95/10/878869510.db2.gz FBOWUBLYGSRHCW-LADGPHEKSA-N 0 3 407.558 4.072 20 0 HIADHN C[C@@H](NC(=O)NC[C@@H](c1ccccc1)N1CCCC1)c1nc(C2CCCCC2)no1 ZINC000465443415 878874407 /nfs/dbraw/zinc/87/44/07/878874407.db2.gz SXJZYBJEVUQZBZ-XLIONFOSSA-N 0 3 411.550 4.315 20 0 HIADHN COc1cccc([C@H](CNC(=O)NC[C@@H](C)Cc2cccs2)N2CCCC2)c1 ZINC000465470852 878905924 /nfs/dbraw/zinc/90/59/24/878905924.db2.gz FPAREEKFFCOPSP-UWJYYQICSA-N 0 3 401.576 4.072 20 0 HIADHN COc1cccc([C@@H](CNC(=O)NC[C@@H](C)Cc2cccs2)N2CCCC2)c1 ZINC000465470850 878906520 /nfs/dbraw/zinc/90/65/20/878906520.db2.gz FPAREEKFFCOPSP-LAUBAEHRSA-N 0 3 401.576 4.072 20 0 HIADHN COc1cccc([C@@H](CNC(=O)NCc2cc(F)ccc2SC)N2CCCC2)c1 ZINC000465472677 878910869 /nfs/dbraw/zinc/91/08/69/878910869.db2.gz HOHUGKIRHAODQM-HXUWFJFHSA-N 0 3 417.550 4.193 20 0 HIADHN CN(C)CCN(C[C@@H]1CCCO1)C(=O)N[C@@H](c1cc2ccccc2o1)c1ccccc1 ZINC000465497422 878936987 /nfs/dbraw/zinc/93/69/87/878936987.db2.gz FLCHKCBZTNTWBC-XUZZJYLKSA-N 0 3 421.541 4.274 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N(Cc1ccc(O)cc1)CC1CC1)c1ccsc1 ZINC000465521668 878972486 /nfs/dbraw/zinc/97/24/86/878972486.db2.gz ITDZXAXKQODLSC-NRFANRHFSA-N 0 3 401.576 4.458 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NC[C@H]1CCO[C@H]1c1ccccc1)c1ccsc1 ZINC000465528794 878984704 /nfs/dbraw/zinc/98/47/04/878984704.db2.gz UNHDZNIVBLREPD-NRSPTQNISA-N 0 3 401.576 4.208 20 0 HIADHN C[C@@H]1CCN(C(=O)NCCCCOc2ccc(F)cc2)CCN1Cc1ccccc1 ZINC000465589218 879069979 /nfs/dbraw/zinc/06/99/79/879069979.db2.gz CIMZCSWROODXTA-HXUWFJFHSA-N 0 3 413.537 4.291 20 0 HIADHN CCO[C@H](C)c1nc(CN(C)C(=O)N[C@@H](CN2CCCC2)c2ccccc2)cs1 ZINC000465598907 879087027 /nfs/dbraw/zinc/08/70/27/879087027.db2.gz MGASHIQVZAQGOV-XLIONFOSSA-N 0 3 416.591 4.219 20 0 HIADHN O=C(NCc1c(F)cccc1OC(F)F)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000465605933 879097561 /nfs/dbraw/zinc/09/75/61/879097561.db2.gz QFWGDMVJWZSJQY-SFHVURJKSA-N 0 3 407.436 4.063 20 0 HIADHN C[C@H](NC(=O)N[C@@H](CN1CCCC1)c1ccccc1)c1nc(-c2cccc(F)c2)no1 ZINC000465611305 879108059 /nfs/dbraw/zinc/10/80/59/879108059.db2.gz XBFVKTSILVMFHM-JXFKEZNVSA-N 0 3 423.492 4.073 20 0 HIADHN C[C@@H](NC(=O)N[C@@H](CN1CCCC1)c1ccccc1)c1nc(-c2cccc(F)c2)no1 ZINC000465611308 879108234 /nfs/dbraw/zinc/10/82/34/879108234.db2.gz XBFVKTSILVMFHM-UZLBHIALSA-N 0 3 423.492 4.073 20 0 HIADHN CO[C@H](CNC(=O)N[C@H](CN1CCCC1)c1ccccc1)c1ccc(Cl)cc1 ZINC000465613349 879112039 /nfs/dbraw/zinc/11/20/39/879112039.db2.gz ZRZHBWUKHKMCRT-NHCUHLMSSA-N 0 3 401.938 4.164 20 0 HIADHN CN(C)CCN(C[C@H]1CCCO1)C(=O)N[C@H](c1ccccc1)c1cccc(Cl)c1 ZINC000465623425 879131501 /nfs/dbraw/zinc/13/15/01/879131501.db2.gz CGOZCKKDPTYELO-FGZHOGPDSA-N 0 3 415.965 4.182 20 0 HIADHN CC(C)(CNC(=O)N1CC[C@H](COCc2ccccc2)C1)N1CCc2ccccc2C1 ZINC000465697392 879254727 /nfs/dbraw/zinc/25/47/27/879254727.db2.gz STETVMLYNPXYPP-QFIPXVFZSA-N 0 3 421.585 4.072 20 0 HIADHN Cc1ccccc1[C@@H]1CN(C(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)[C@@H](C)CO1 ZINC000465752712 879342390 /nfs/dbraw/zinc/34/23/90/879342390.db2.gz JWNDBHUJTVEDPM-IKJKNFHUSA-N 0 3 407.558 4.302 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N[C@@H](C)c2nc(C3CCCCC3)no2)C1 ZINC000465753995 879343437 /nfs/dbraw/zinc/34/34/37/879343437.db2.gz LEISNVDMDMDCQZ-SQGPQFPESA-N 0 3 411.550 4.313 20 0 HIADHN CCCn1nccc1C1CCN(CCc2nc3sc4c(c3c(N)n2)CCCC4)CC1 ZINC000503438062 912449295 /nfs/dbraw/zinc/44/92/95/912449295.db2.gz RLQQUZHODKHVFE-UHFFFAOYSA-N 0 3 424.618 4.181 20 0 HIADHN Cc1cc(C(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)nn1-c1ccc(F)cc1F ZINC000503438691 912449925 /nfs/dbraw/zinc/44/99/25/912449925.db2.gz SMFOISDSNFEGQX-QFBILLFUSA-N 0 3 410.468 4.024 20 0 HIADHN COc1ccccc1C[C@H](C)N(C)C(=O)NC[C@H](c1ccc(C)cc1)N1CCCC1 ZINC000465825672 879455444 /nfs/dbraw/zinc/45/54/44/879455444.db2.gz HLWYRLCJJDXXNT-NZQKXSOJSA-N 0 3 409.574 4.413 20 0 HIADHN CC(C)[C@H](NC(=O)N(CCN(C)C)C[C@@H]1CCCO1)c1cccc(C(F)(F)F)c1 ZINC000465830187 879463292 /nfs/dbraw/zinc/46/32/92/879463292.db2.gz HRTKUVKNRDRMDD-OALUTQOASA-N 0 3 415.500 4.155 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)N[C@@H](c2ccc(Cl)cc2)C2CCCC2)CC1 ZINC000465903912 879566091 /nfs/dbraw/zinc/56/60/91/879566091.db2.gz XURFZDGZQHBXBT-XMSQKQJNSA-N 0 3 421.029 4.144 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)N[C@H](c2oc3ccccc3c2C)C(C)C)CC1 ZINC000465923935 879586623 /nfs/dbraw/zinc/58/66/23/879586623.db2.gz RXBIZYCHCVKDCK-GCJKJVERSA-N 0 3 414.594 4.011 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)N[C@@H](c2oc3ccccc3c2C)C(C)C)CC1 ZINC000465923936 879586827 /nfs/dbraw/zinc/58/68/27/879586827.db2.gz RXBIZYCHCVKDCK-PGRDOPGGSA-N 0 3 414.594 4.011 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)N[C@@H](CC(C)(C)C)c2ccc(Cl)cc2)CC1 ZINC000465964626 879632840 /nfs/dbraw/zinc/63/28/40/879632840.db2.gz GMKBLAZGUQWWJI-RXVVDRJESA-N 0 3 423.045 4.390 20 0 HIADHN C[C@@H]1CCN(C(=O)NCc2ccccc2OCC2CC2)CCN1Cc1ccccc1 ZINC000465987003 879661051 /nfs/dbraw/zinc/66/10/51/879661051.db2.gz XCMVPMGEKJUFLM-HXUWFJFHSA-N 0 3 407.558 4.281 20 0 HIADHN COc1cccc([C@H](Cc2cc(C)cc(C)c2)NC(=O)N[C@H]2CCN(C3CC3)C2)c1 ZINC000466011098 879690327 /nfs/dbraw/zinc/69/03/27/879690327.db2.gz CBZQWCYUPNCLOA-URXFXBBRSA-N 0 3 407.558 4.132 20 0 HIADHN COc1cccc([C@@H](Cc2cc(C)cc(C)c2)NC(=O)N2CC[C@@H](N3CC=CC3)C2)c1 ZINC000466049616 879738059 /nfs/dbraw/zinc/73/80/59/879738059.db2.gz LOMCYKXJARRPJR-ILBGXUMGSA-N 0 3 419.569 4.252 20 0 HIADHN CN(C(=O)NCc1ccccc1COc1ccccc1Cl)[C@H]1CCN(C2CC2)C1 ZINC000466055939 879748344 /nfs/dbraw/zinc/74/83/44/879748344.db2.gz OAUQFWQXOODNIN-FQEVSTJZSA-N 0 3 413.949 4.297 20 0 HIADHN CC[C@@H](C)[C@H](NC(=O)N1CCN(CC2CCOCC2)CC1)c1ccc(Cl)cc1 ZINC000466062667 879760228 /nfs/dbraw/zinc/76/02/28/879760228.db2.gz CFJPJDCGQUTDDI-UTKZUKDTSA-N 0 3 407.986 4.181 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N[C@@H](c3nc(C)cs3)C3CC3)c(C)c2)CC1 ZINC000466081882 879800183 /nfs/dbraw/zinc/80/01/83/879800183.db2.gz JAEOJJKEMFMWJR-HXUWFJFHSA-N 0 3 413.591 4.175 20 0 HIADHN CO[C@H](CNC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1)c1ccc(Cl)cc1 ZINC000466092262 879810270 /nfs/dbraw/zinc/81/02/70/879810270.db2.gz NEJMIGBPEOQLRP-PGRDOPGGSA-N 0 3 415.965 4.334 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)N2CCCCC[C@@H]2c2ccc(Cl)cc2)CC1 ZINC000466132029 879844108 /nfs/dbraw/zinc/84/41/08/879844108.db2.gz MYZQQOXHXJITOM-DENIHFKCSA-N 0 3 421.029 4.240 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NC[C@H](C)Cc3cccs3)c(C)c2)CC1 ZINC000466139192 879850168 /nfs/dbraw/zinc/85/01/68/879850168.db2.gz ULAODFVQCDYRRH-QGZVFWFLSA-N 0 3 400.592 4.199 20 0 HIADHN C[C@H](CNC(=O)Nc1ccc(Oc2ccccc2Cl)cc1)CN1CCN(C)CC1 ZINC000466147997 879856367 /nfs/dbraw/zinc/85/63/67/879856367.db2.gz QXTGNULCYVLVST-QGZVFWFLSA-N 0 3 416.953 4.137 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccc(O)cc1)C(=O)CCC(=O)c1ccc(C)s1 ZINC000503470904 912504438 /nfs/dbraw/zinc/50/44/38/912504438.db2.gz PFOLMQJLGYKEDY-IBGZPJMESA-N 0 3 414.571 4.238 20 0 HIADHN COc1ccc([C@@H](CNC(=O)Nc2cccc(Br)c2)N2CCCC2)cc1 ZINC000503471233 912504933 /nfs/dbraw/zinc/50/49/33/912504933.db2.gz FTNGBRCINCOVQA-LJQANCHMSA-N 0 3 418.335 4.416 20 0 HIADHN CC(C)CC(=O)Nc1cccc(CNC(=O)N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)c1 ZINC000466245769 879960933 /nfs/dbraw/zinc/96/09/33/879960933.db2.gz BRDDOOSLBPCHPZ-XXBNENTESA-N 0 3 422.573 4.133 20 0 HIADHN COc1ccc(C(C)(C)C(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)cc1OC ZINC000466249668 879966623 /nfs/dbraw/zinc/96/66/23/879966623.db2.gz YHQPSVSAESLSIL-NRFANRHFSA-N 0 3 410.558 4.104 20 0 HIADHN COc1ccc(-c2cncc(C(=O)N(CCN(C)C)Cc3ccc(F)cc3)c2)cc1 ZINC000466271745 880007422 /nfs/dbraw/zinc/00/74/22/880007422.db2.gz VHEKQODILRUQRL-UHFFFAOYSA-N 0 3 407.489 4.100 20 0 HIADHN COc1ccc(-c2cncc(C(=O)N(CCN(C)C)Cc3cccc(F)c3)c2)cc1 ZINC000466280701 880020479 /nfs/dbraw/zinc/02/04/79/880020479.db2.gz MDFXBLMGEQJJPR-UHFFFAOYSA-N 0 3 407.489 4.100 20 0 HIADHN COc1ccc(-c2cncc(C(=O)N[C@H]3CCN([C@H](C)c4ccccc4)C3)c2)cc1 ZINC000466303862 880052418 /nfs/dbraw/zinc/05/24/18/880052418.db2.gz ZKNXUALARXZCEB-JPYJTQIMSA-N 0 3 401.510 4.323 20 0 HIADHN CO[C@H](CNC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1)c1cccc(Cl)c1 ZINC000466349796 880108213 /nfs/dbraw/zinc/10/82/13/880108213.db2.gz KNDQPARHIQZQSS-PGRDOPGGSA-N 0 3 415.965 4.334 20 0 HIADHN C[C@H](CNC(=O)N(Cc1ccco1)C1CCN(C)CC1)Oc1ccc(Cl)cc1 ZINC000466369002 880127038 /nfs/dbraw/zinc/12/70/38/880127038.db2.gz RLWTVBLSBNKSII-MRXNPFEDSA-N 0 3 405.926 4.006 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccc(O)cc1)C(=O)[C@@H]1SCCc2sccc21 ZINC000503498694 912545209 /nfs/dbraw/zinc/54/52/09/912545209.db2.gz ZKBNZEVPTWAUOL-DYESRHJHSA-N 0 3 416.612 4.297 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)cc1OC ZINC000466517008 880291316 /nfs/dbraw/zinc/29/13/16/880291316.db2.gz TYRFQJYAJIPLKZ-QIJUGHKUSA-N 0 3 423.557 4.213 20 0 HIADHN CCC(=O)Nc1ccc(Cl)c(NC(=O)N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)c1 ZINC000466518401 880293196 /nfs/dbraw/zinc/29/31/96/880293196.db2.gz YTHCHNINZNMZLG-QAPCUYQASA-N 0 3 414.937 4.473 20 0 HIADHN COc1ccc(NC(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)c(C(F)(F)F)c1 ZINC000466521206 880296690 /nfs/dbraw/zinc/29/66/90/880296690.db2.gz GRNDUOLMQBEVOF-GOEBONIOSA-N 0 3 407.436 4.499 20 0 HIADHN COCCCCN(Cc1ccccc1)C(=O)N[C@H]1C[C@@H](C)N(Cc2ccccc2)C1 ZINC000466529588 880305480 /nfs/dbraw/zinc/30/54/80/880305480.db2.gz OSFFRTHWJMJKKB-QPPBQGQZSA-N 0 3 409.574 4.288 20 0 HIADHN COCCOc1ccc(NC(=O)N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)cc1Cl ZINC000466537783 880311974 /nfs/dbraw/zinc/31/19/74/880311974.db2.gz BPNGCSUBULEHMS-APWZRJJASA-N 0 3 417.937 4.150 20 0 HIADHN CC(C)(C)Oc1ccc(CNC(=O)N2CC[C@H](N3CC=CC3)C2)c(C(F)(F)F)c1 ZINC000466589096 880361000 /nfs/dbraw/zinc/36/10/00/880361000.db2.gz VYBBNFLQDANKCY-INIZCTEOSA-N 0 3 411.468 4.038 20 0 HIADHN CCc1c(NC(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)cnn1-c1ccccc1 ZINC000466716355 880505632 /nfs/dbraw/zinc/50/56/32/880505632.db2.gz HAYBYJWETSKRQQ-AZUAARDMSA-N 0 3 403.530 4.392 20 0 HIADHN CSc1ccc(F)cc1CNC(=O)N(CCN(C)C)Cc1cccc(Cl)c1 ZINC000466809217 880586100 /nfs/dbraw/zinc/58/61/00/880586100.db2.gz MIFZPSNHVPGFEP-UHFFFAOYSA-N 0 3 409.958 4.474 20 0 HIADHN CCN(C(=O)c1ccn(-c2ccc(F)cc2F)n1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000466814156 880588663 /nfs/dbraw/zinc/58/86/63/880588663.db2.gz GPGFGEJGYZUYMN-FXAWDEMLSA-N 0 3 424.495 4.448 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)NCc1ccc(-c2cccnc2)cc1 ZINC000466941880 880712523 /nfs/dbraw/zinc/71/25/23/880712523.db2.gz GZXMDHXONFDDIF-UHFFFAOYSA-N 0 3 406.505 4.161 20 0 HIADHN O=C(NCc1ccc(-c2cccnc2)cc1)N1CCCN(Cc2ccccc2)CC1 ZINC000466954309 880735131 /nfs/dbraw/zinc/73/51/31/880735131.db2.gz LBXHXGHBEZRANC-UHFFFAOYSA-N 0 3 400.526 4.166 20 0 HIADHN Cc1nc(CCC(=O)N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)oc1-c1ccccc1 ZINC000467028897 880828483 /nfs/dbraw/zinc/82/84/83/880828483.db2.gz NTUQBJOMFPLLMP-AVRDEDQJSA-N 0 3 403.526 4.362 20 0 HIADHN COCc1ccc([C@H]2CCCN2CCC(=O)Nc2ccc(Br)cc2)o1 ZINC000467032980 880831135 /nfs/dbraw/zinc/83/11/35/880831135.db2.gz JHAKHUMIZWOPAP-QGZVFWFLSA-N 0 3 407.308 4.354 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)Cc2ccc(NC(=O)CC(C)(C)C)cc2)CN1Cc1ccccc1 ZINC000467040821 880837063 /nfs/dbraw/zinc/83/70/63/880837063.db2.gz NRRYFKUBQLSRCB-AUSIDOKSSA-N 0 3 421.585 4.383 20 0 HIADHN Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)N[C@H]1C[C@H](C)N(Cc2ccccc2)C1 ZINC000467107351 880866732 /nfs/dbraw/zinc/86/67/32/880866732.db2.gz PPQSHKIGIRBOIS-UGKGYDQZSA-N 0 3 422.573 4.165 20 0 HIADHN COc1ccc(Br)c(NC(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)c1 ZINC000467110856 880869180 /nfs/dbraw/zinc/86/91/80/880869180.db2.gz PCVYBDKPVVHSIY-GOEBONIOSA-N 0 3 418.335 4.242 20 0 HIADHN Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)N[C@H]1C[C@@H](C)N(Cc2ccccc2)C1 ZINC000467116699 880873951 /nfs/dbraw/zinc/87/39/51/880873951.db2.gz MHYJHPRYRSNPJS-KNQAVFIVSA-N 0 3 420.557 4.016 20 0 HIADHN CO[C@H](C)c1nc(CN2CCCN(C[C@H]3CCC4(CCCCC4)O3)CC2)cs1 ZINC000467200432 880929543 /nfs/dbraw/zinc/92/95/43/880929543.db2.gz HWHKBQNOMLOIHC-UYAOXDASSA-N 0 3 407.624 4.240 20 0 HIADHN Cc1nc(-c2ccc(C)cc2NC(=O)CN2CCC[C@@]2(C)Cc2ccccc2)n[nH]1 ZINC000467239355 880963630 /nfs/dbraw/zinc/96/36/30/880963630.db2.gz WFKLXVWNGQBQAL-DEOSSOPVSA-N 0 3 403.530 4.124 20 0 HIADHN Cc1nc(-c2ccc(C(=O)NC[C@@H](c3cccs3)N3CCC(C)CC3)cc2)n[nH]1 ZINC000467250465 880978095 /nfs/dbraw/zinc/97/80/95/880978095.db2.gz UFXBATPKNIMRPA-IBGZPJMESA-N 0 3 409.559 4.045 20 0 HIADHN C[C@@H](NCc1ccc(CN2C[C@@H](C)O[C@@H](C)C2)cc1)c1ccnn1-c1ccccc1 ZINC000467313044 881060422 /nfs/dbraw/zinc/06/04/22/881060422.db2.gz KZSXTRHDMBWGFB-QHAWAJNXSA-N 0 3 404.558 4.332 20 0 HIADHN C[C@H](NCc1ccc(CN2C[C@@H](C)O[C@H](C)C2)cc1)c1ccnn1-c1ccccc1 ZINC000467313043 881060500 /nfs/dbraw/zinc/06/05/00/881060500.db2.gz KZSXTRHDMBWGFB-NJYVYQBISA-N 0 3 404.558 4.332 20 0 HIADHN O=S(=O)(C[C@H](O)CN[C@@H](c1ccc(Cl)cc1)C1CCCC1)c1cccs1 ZINC000467332730 881080651 /nfs/dbraw/zinc/08/06/51/881080651.db2.gz QOYULVWSAJGBNE-IEBWSBKVSA-N 0 3 413.992 4.057 20 0 HIADHN O=S(=O)(C[C@@H](O)CN[C@H](c1ccc(Cl)cc1)C1CCCC1)c1cccs1 ZINC000467332729 881080750 /nfs/dbraw/zinc/08/07/50/881080750.db2.gz QOYULVWSAJGBNE-HKUYNNGSSA-N 0 3 413.992 4.057 20 0 HIADHN O=S(=O)(C[C@H](O)CN[C@H](c1ccc(Cl)cc1)C1CCCC1)c1cccs1 ZINC000467332731 881081288 /nfs/dbraw/zinc/08/12/88/881081288.db2.gz QOYULVWSAJGBNE-MJGOQNOKSA-N 0 3 413.992 4.057 20 0 HIADHN CN1CCN(c2ccc(C(F)(F)F)cc2CN[C@@H](c2cncc(F)c2)C2CC2)CC1 ZINC000467337867 881088954 /nfs/dbraw/zinc/08/89/54/881088954.db2.gz GFLPNELUBAPEKX-OAQYLSRUSA-N 0 3 422.470 4.232 20 0 HIADHN Cc1cccnc1[C@H]1CCC[C@H](Nc2ccc3nc(CCN4CCOCC4)[nH]c3c2)C1 ZINC000467391208 881174081 /nfs/dbraw/zinc/17/40/81/881174081.db2.gz RLLDRIGZJOJTPV-PMACEKPBSA-N 0 3 419.573 4.279 20 0 HIADHN CC[C@H](NCc1cc(Cl)ccc1N1CCOCC1)c1ccc2c(c1)OCCO2 ZINC000467407265 881191889 /nfs/dbraw/zinc/19/18/89/881191889.db2.gz SJRKCSHTYGRWKL-IBGZPJMESA-N 0 3 402.922 4.189 20 0 HIADHN CCS(=O)(=O)c1cccc(CN[C@@H](c2ccc(Br)cc2)C2CC2)c1 ZINC000467418846 881207041 /nfs/dbraw/zinc/20/70/41/881207041.db2.gz PIRDSRXSEIAHBD-LJQANCHMSA-N 0 3 408.361 4.484 20 0 HIADHN CC(=O)N(C)c1cccc(NC(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)c1 ZINC000467434706 881233108 /nfs/dbraw/zinc/23/31/08/881233108.db2.gz VZZLPHYYZQTNTN-HXUWFJFHSA-N 0 3 414.575 4.326 20 0 HIADHN Cc1ccnc(-c2cccc(NC(=O)N[C@H]3C[C@@H](C)N(Cc4ccccc4)C3)c2)n1 ZINC000467469552 881285842 /nfs/dbraw/zinc/28/58/42/881285842.db2.gz OSKPPHUVGYTBNN-GCJKJVERSA-N 0 3 401.514 4.237 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)C(c1ccccc1)c1ccccc1 ZINC000467493853 881311206 /nfs/dbraw/zinc/31/12/06/881311206.db2.gz OGLSYDRFYFSLLF-UHFFFAOYSA-N 0 3 414.549 4.092 20 0 HIADHN O=C(NCc1ccccc1CN1CCC(O)CC1)c1ccc(Oc2ccccc2)cc1 ZINC000467502170 881317954 /nfs/dbraw/zinc/31/79/54/881317954.db2.gz LKZBPVOZGSJYJW-UHFFFAOYSA-N 0 3 416.521 4.366 20 0 HIADHN O=C(CCc1ccc2ccccc2c1)NCc1ccccc1CN1CCC(O)CC1 ZINC000467503233 881318159 /nfs/dbraw/zinc/31/81/59/881318159.db2.gz NCZJEEDIUWCJOP-UHFFFAOYSA-N 0 3 402.538 4.046 20 0 HIADHN CCc1nnc(-c2ccc(NC(=O)c3ccc(N4CCN(C(C)C)CC4)cc3)cc2)o1 ZINC000467512275 881325781 /nfs/dbraw/zinc/32/57/81/881325781.db2.gz KFACJKCUVFLJOT-UHFFFAOYSA-N 0 3 419.529 4.082 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)c2cc(Br)c(F)cc2F)C1 ZINC000469052383 883125170 /nfs/dbraw/zinc/12/51/70/883125170.db2.gz SACDHTIEWSFLLU-TZMCWYRMSA-N 0 3 409.274 4.293 20 0 HIADHN COc1ccc([C@@H](N[C@@H](C)Cn2cccn2)c2ccccc2)cc1Br ZINC000469063936 883139357 /nfs/dbraw/zinc/13/93/57/883139357.db2.gz UHXTZJSOLKVAGP-YWZLYKJASA-N 0 3 400.320 4.422 20 0 HIADHN CCOC(=O)c1csc(CCN[C@@H](C)c2cc(Br)ccc2F)n1 ZINC000469066214 883143473 /nfs/dbraw/zinc/14/34/73/883143473.db2.gz VYGRWTAEDQMMHL-JTQLQIEISA-N 0 3 401.301 4.115 20 0 HIADHN COc1cc(C)c([C@@H](C)N[C@@H]2CCCN(Cc3ccc(F)cc3F)C2=O)cc1OC ZINC000469103727 883195007 /nfs/dbraw/zinc/19/50/07/883195007.db2.gz VGRCKUCOBXZWHS-FOIQADDNSA-N 0 3 418.484 4.132 20 0 HIADHN Cc1cc(C)c(CC(C(=O)Nc2ccc3c(c2)CC(=O)N3C)C(F)(F)F)c(C)c1 ZINC000469105547 883196998 /nfs/dbraw/zinc/19/69/98/883196998.db2.gz VEYIIASKDCGEHG-SFHVURJKSA-N 0 3 404.432 4.490 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)c1ccc2c(ccn2Cc2ccccc2)c1 ZINC000469107580 883198651 /nfs/dbraw/zinc/19/86/51/883198651.db2.gz WFCPPZPESLPFIB-UHFFFAOYSA-N 0 3 412.537 4.289 20 0 HIADHN Cc1nn(CC(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)cc1-c1ccccc1 ZINC000469147150 883242792 /nfs/dbraw/zinc/24/27/92/883242792.db2.gz ZMCOIMKWWNUJNY-DEOSSOPVSA-N 0 3 402.542 4.120 20 0 HIADHN CCOC(=O)[C@](C)(CN[C@@H](C)C(=O)Nc1ccc(C)cc1Cl)c1ccccc1 ZINC000469256037 883353143 /nfs/dbraw/zinc/35/31/43/883353143.db2.gz OGBLGAILLASSGX-KSFYIVLOSA-N 0 3 402.922 4.086 20 0 HIADHN Cc1nc(-c2ccccc2)oc1C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000469257314 883355529 /nfs/dbraw/zinc/35/55/29/883355529.db2.gz VEDYIOWFPULREM-UHFFFAOYSA-N 0 3 407.539 4.494 20 0 HIADHN Cc1csc(C(=O)Nc2ccc(C)cc2CN(C)C)c1I ZINC000469370453 883495478 /nfs/dbraw/zinc/49/54/78/883495478.db2.gz AFLMXAAWSUKEJD-UHFFFAOYSA-N 0 3 414.312 4.283 20 0 HIADHN CC(=O)Nc1cccc([C@H](C)NC(=O)N[C@@H](CN(C)Cc2ccccc2)C(C)C)c1 ZINC000469420332 883597412 /nfs/dbraw/zinc/59/74/12/883597412.db2.gz OQKNPTGDFMBYNH-MBSDFSHPSA-N 0 3 410.562 4.162 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)Nc1ccc2c(c1)NC(=O)CS2 ZINC000469457239 883665829 /nfs/dbraw/zinc/66/58/29/883665829.db2.gz PJNYEOBDZXDHMF-IBGZPJMESA-N 0 3 412.559 4.009 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)c1ccc2c(c1)NC(=O)CCS2 ZINC000469480943 883713383 /nfs/dbraw/zinc/71/33/83/883713383.db2.gz BAFBNNCQDWETRR-FQEVSTJZSA-N 0 3 411.571 4.007 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N3CCS[C@@H](C)[C@H]3c3ccccc3)cc2)CC1 ZINC000469552297 883811443 /nfs/dbraw/zinc/81/14/43/883811443.db2.gz QKOAEWOFNZJKHF-CVDCTZTESA-N 0 3 409.599 4.147 20 0 HIADHN CC1=CCN(CCNC(=O)CCCc2nnc(-c3ccc(Cl)cc3Cl)o2)CC1 ZINC000469556926 883813047 /nfs/dbraw/zinc/81/30/47/883813047.db2.gz RLWCIXNVTMCYME-UHFFFAOYSA-N 0 3 423.344 4.134 20 0 HIADHN Cc1cccc(N2CCN(CCC(=O)N3C[C@H](C)C[C@H]3c3cccc(F)c3)CC2)c1 ZINC000469568287 883817709 /nfs/dbraw/zinc/81/77/09/883817709.db2.gz FGJUQYSDAKTJJL-YKSBVNFPSA-N 0 3 409.549 4.256 20 0 HIADHN CCN(CC)[C@H](C(=O)NCCNc1cccc(C)n1)c1cccc(C(F)(F)F)c1 ZINC000469570828 883819337 /nfs/dbraw/zinc/81/93/37/883819337.db2.gz NBYCCBASGCKWTC-IBGZPJMESA-N 0 3 408.468 4.020 20 0 HIADHN Cc1cccc(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2)c1Br ZINC000469573342 883819381 /nfs/dbraw/zinc/81/93/81/883819381.db2.gz VOHCRNQHTSPXQB-UHFFFAOYSA-N 0 3 408.315 4.492 20 0 HIADHN CCOc1cc(Cl)ccc1NC(=O)N(C)C1CCN(CCc2ccccn2)CC1 ZINC000469630525 883841040 /nfs/dbraw/zinc/84/10/40/883841040.db2.gz ARYGLPXMZMEVIB-UHFFFAOYSA-N 0 3 416.953 4.305 20 0 HIADHN C[C@@H]1CC[C@H](C)N1CC(=O)NC1(c2ccc(OCc3ccccc3)cc2)CCOCC1 ZINC000469683375 883868329 /nfs/dbraw/zinc/86/83/29/883868329.db2.gz XNVJNRDEQFWHDL-OYRHEFFESA-N 0 3 422.569 4.260 20 0 HIADHN C[C@H]1CC[C@H](C)N1CC(=O)NC1(c2ccc(OCc3ccccc3)cc2)CCOCC1 ZINC000469683376 883868501 /nfs/dbraw/zinc/86/85/01/883868501.db2.gz XNVJNRDEQFWHDL-SFTDATJTSA-N 0 3 422.569 4.260 20 0 HIADHN COc1ccc([C@H](NC[C@H](O)CC(F)(F)F)c2ccccc2)cc1Br ZINC000469712676 883882891 /nfs/dbraw/zinc/88/28/91/883882891.db2.gz JRWNGIFAPATANK-RHSMWYFYSA-N 0 3 418.253 4.450 20 0 HIADHN COc1ccc(NC(=O)CCN[C@H](C)c2ccc(Br)cc2OC)cc1 ZINC000469739417 883896633 /nfs/dbraw/zinc/89/66/33/883896633.db2.gz JFBGUBXCUXTDEH-CYBMUJFWSA-N 0 3 407.308 4.146 20 0 HIADHN C[C@H](CN1CCCCC1)NC(=O)C(=O)Nc1ccc(F)cc1-c1ccc(Cl)cc1 ZINC000503659874 912766099 /nfs/dbraw/zinc/76/60/99/912766099.db2.gz PJJGUMXPXFFLEJ-OAHLLOKOSA-N 0 3 417.912 4.075 20 0 HIADHN CC(C)(C)OC1CCN(C(=O)N[C@@H](CN2CCc3ccccc3C2)C(C)(C)C)CC1 ZINC000469763504 883932433 /nfs/dbraw/zinc/93/24/33/883932433.db2.gz KGZDSGSFUDESNG-QFIPXVFZSA-N 0 3 415.622 4.449 20 0 HIADHN COc1ccccc1CC(=O)N1CCC(N[C@H](C)c2csc(C(C)C)n2)CC1 ZINC000469792622 883967202 /nfs/dbraw/zinc/96/72/02/883967202.db2.gz VWOGIQRKOFXXHE-MRXNPFEDSA-N 0 3 401.576 4.159 20 0 HIADHN COc1ccc([C@H](CCC(C)C)NCc2cccc(C(=O)N3CCOCC3)c2)cc1 ZINC000469807708 883982498 /nfs/dbraw/zinc/98/24/98/883982498.db2.gz IDCLNGVHMAOVPY-DEOSSOPVSA-N 0 3 410.558 4.435 20 0 HIADHN Cc1csc(-c2cccc(C(=O)NC[C@H]3CN(Cc4ccccc4)CCCO3)c2)n1 ZINC000469869765 884059488 /nfs/dbraw/zinc/05/94/88/884059488.db2.gz GHWICRYUCYMSDQ-QFIPXVFZSA-N 0 3 421.566 4.139 20 0 HIADHN O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)[C@H](OC1CCCC1)c1ccccc1 ZINC000469874527 884065229 /nfs/dbraw/zinc/06/52/29/884065229.db2.gz WGMASYBXRMBVGJ-JWQCQUIFSA-N 0 3 422.569 4.094 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N3CCSC[C@H]3c3ccc(C)cc3)cc2)CC1 ZINC000469896939 884087533 /nfs/dbraw/zinc/08/75/33/884087533.db2.gz KVZQRMQQMJXRQJ-QHCPKHFHSA-N 0 3 409.599 4.067 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N[C@@H](C)Cc3ccc(C(F)(F)F)cc3)cc2)CC1 ZINC000469984704 884200245 /nfs/dbraw/zinc/20/02/45/884200245.db2.gz LYYMSOUEJBMWER-KRWDZBQOSA-N 0 3 419.491 4.208 20 0 HIADHN CC(C)[C@@H](NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1)c1nc2ccccc2[nH]1 ZINC000503698148 912801747 /nfs/dbraw/zinc/80/17/47/912801747.db2.gz IESFMRZWRNZLQW-SIKLNZKXSA-N 0 3 405.546 4.224 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@@H]2NC(=O)NC[C@@H](c2cccs2)N2CCCC2)cc1 ZINC000470025433 884244549 /nfs/dbraw/zinc/24/45/49/884244549.db2.gz WSFKTBTTZUWXEH-ONTIZHBOSA-N 0 3 413.587 4.413 20 0 HIADHN Cc1coc(-c2ccc(C)c(NC(=O)CCCN3CCN(c4ccccc4)CC3)c2)n1 ZINC000470091749 884348330 /nfs/dbraw/zinc/34/83/30/884348330.db2.gz CUNMKCWWWAJENR-UHFFFAOYSA-N 0 3 418.541 4.499 20 0 HIADHN COc1ccc(C2(C(=O)Nc3cccc(N4CCN(C(C)C)CC4)c3)CCC2)cc1 ZINC000503762402 912817828 /nfs/dbraw/zinc/81/78/28/912817828.db2.gz DDWSZLQUFICTAO-UHFFFAOYSA-N 0 3 407.558 4.286 20 0 HIADHN CC1(c2cc(NC(=O)NC3CC(N4CCC(C(F)(F)F)CC4)C3)no2)CCCC1 ZINC000470148117 884416013 /nfs/dbraw/zinc/41/60/13/884416013.db2.gz SSBSZSMBWSINIM-UHFFFAOYSA-N 0 3 414.472 4.433 20 0 HIADHN O=C(NC[C@@H]1CCCCN1C1CC1)c1cc(Br)sc1Br ZINC000470162623 884438143 /nfs/dbraw/zinc/43/81/43/884438143.db2.gz DZMLFRXOLLZDJH-JTQLQIEISA-N 0 3 422.186 4.020 20 0 HIADHN C[C@@H](NC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C)c1ccccc1-n1cccn1 ZINC000470178243 884460737 /nfs/dbraw/zinc/46/07/37/884460737.db2.gz JFLDJZVKWFXGBS-LEWJYISDSA-N 0 3 417.557 4.239 20 0 HIADHN C[C@H](NC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1)c1ccccc1-n1cccn1 ZINC000470189825 884487133 /nfs/dbraw/zinc/48/71/33/884487133.db2.gz ZEAALIREOWFYPO-RTWAWAEBSA-N 0 3 417.557 4.239 20 0 HIADHN O=C(CN[C@@H](c1ccc(Br)cc1)C1CC1)N[C@@H]1CCOc2ccccc21 ZINC000503852869 912841204 /nfs/dbraw/zinc/84/12/04/912841204.db2.gz ANTVOLHXYRXHIJ-WIYYLYMNSA-N 0 3 415.331 4.130 20 0 HIADHN O=C(CN[C@H](c1ccc(Br)cc1)C1CC1)N[C@H]1CCOc2ccccc21 ZINC000503852868 912840741 /nfs/dbraw/zinc/84/07/41/912840741.db2.gz ANTVOLHXYRXHIJ-RXVVDRJESA-N 0 3 415.331 4.130 20 0 HIADHN CCc1ccc([C@@H](NCC2(OCCO)CCOCC2)c2ccccc2Cl)cc1 ZINC000503858811 912843979 /nfs/dbraw/zinc/84/39/79/912843979.db2.gz SFSBJAVUOXRLDA-JOCHJYFZSA-N 0 3 403.950 4.140 20 0 HIADHN Cc1ccc([C@@H]2OCCC[C@@H]2NC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)cc1 ZINC000470268594 884620935 /nfs/dbraw/zinc/62/09/35/884620935.db2.gz NHFSLNRPCWBQMZ-XWGVYQGASA-N 0 3 410.533 4.383 20 0 HIADHN COc1cccc([C@H](CNC(=O)Nc2cccc(OCCF)c2)N2CCCC2)c1 ZINC000470294001 884670987 /nfs/dbraw/zinc/67/09/87/884670987.db2.gz XGLMVTIPQYERJV-NRFANRHFSA-N 0 3 401.482 4.002 20 0 HIADHN Cc1ccc(C)c([C@H](NCC2(OCCO)CCOCC2)c2ccccc2Cl)c1 ZINC000503887208 912850947 /nfs/dbraw/zinc/85/09/47/912850947.db2.gz QQHUGYQYXCFSFY-JOCHJYFZSA-N 0 3 403.950 4.194 20 0 HIADHN O=C(CN[C@@H](c1cccc(C(F)(F)F)c1)C1CC1)N[C@@H]1CCOc2ccccc21 ZINC000503886525 912851000 /nfs/dbraw/zinc/85/10/00/912851000.db2.gz NSZFXKZKTXKATQ-WIYYLYMNSA-N 0 3 404.432 4.386 20 0 HIADHN CCCCNC(=O)[C@@H]1CCCN(Cc2cc(Br)cc3cccnc32)C1 ZINC000470360210 884755048 /nfs/dbraw/zinc/75/50/48/884755048.db2.gz YXGIDGFHPGLCGC-MRXNPFEDSA-N 0 3 404.352 4.126 20 0 HIADHN C[C@@H]1CN(C[C@H]2CCCN2Cc2cc(Br)cc3cccnc32)C[C@H](C)O1 ZINC000470369685 884764906 /nfs/dbraw/zinc/76/49/06/884764906.db2.gz PLOCEYMQYKDOGH-GQIGUUNPSA-N 0 3 418.379 4.071 20 0 HIADHN C[C@@H](Sc1ccccc1)c1ccc(NC(=O)N2CCCN([C@@H](C)CO)CC2)cc1 ZINC000470408999 884812647 /nfs/dbraw/zinc/81/26/47/884812647.db2.gz PEJRDNMSZYNVMX-RBUKOAKNSA-N 0 3 413.587 4.460 20 0 HIADHN CC(C)[C@H](NC(=O)N(CCN(C)C)Cc1ccc(C(F)(F)F)cc1)C(F)(F)F ZINC000470459532 884854039 /nfs/dbraw/zinc/85/40/39/884854039.db2.gz QKRRLLAOVJZZJI-HNNXBMFYSA-N 0 3 413.406 4.366 20 0 HIADHN O=C(Nc1nc2cc(Br)ccc2[nH]1)c1ccc(Nc2ccncc2)cc1 ZINC000470537117 884938758 /nfs/dbraw/zinc/93/87/58/884938758.db2.gz NGCZHFKMHDTFID-UHFFFAOYSA-N 0 3 408.259 4.138 20 0 HIADHN Cc1ccc2c(c1)nc(CNC1CCN(Cc3c(F)cccc3Cl)CC1)n2C ZINC000470545067 884953907 /nfs/dbraw/zinc/95/39/07/884953907.db2.gz BGSDIHARLRVHDT-UHFFFAOYSA-N 0 3 400.929 4.428 20 0 HIADHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)c1cccc(Nc2cnn(C)c2)c1 ZINC000470586191 885001584 /nfs/dbraw/zinc/00/15/84/885001584.db2.gz ANIAEGUIEJUXPG-QHCPKHFHSA-N 0 3 405.546 4.050 20 0 HIADHN CN(C(=O)Cc1ccc(OC(F)(F)F)cc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000470676124 885106363 /nfs/dbraw/zinc/10/63/63/885106363.db2.gz YALYAWDUJQXTSL-LJQANCHMSA-N 0 3 406.448 4.251 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)N1CCC[C@H](OCc2ccccc2F)C1 ZINC000470686992 885121559 /nfs/dbraw/zinc/12/15/59/885121559.db2.gz ZLJROSAHLIBTIQ-SFHVURJKSA-N 0 3 410.489 4.455 20 0 HIADHN Cc1ccc(-c2nnc(-c3ccc(C(=O)N[C@H]4CCCN(C(C)C)C4)cc3)o2)cc1 ZINC000470688605 885123315 /nfs/dbraw/zinc/12/33/15/885123315.db2.gz MRMQYTJKILJBQE-NRFANRHFSA-N 0 3 404.514 4.315 20 0 HIADHN Cc1cccc(-c2nnc(-c3ccc(C(=O)N[C@H]4CCCN(C(C)C)C4)cc3)o2)c1 ZINC000470694702 885131148 /nfs/dbraw/zinc/13/11/48/885131148.db2.gz RNEOWPSPBHUZMH-NRFANRHFSA-N 0 3 404.514 4.315 20 0 HIADHN COc1ccc([C@@H](NC(=O)NC[C@@H](c2cccc(OC)c2)N2CCCC2)C2CC2)cc1 ZINC000503992963 912902449 /nfs/dbraw/zinc/90/24/49/912902449.db2.gz MQULMQXZQGZVRS-ZEQRLZLVSA-N 0 3 423.557 4.291 20 0 HIADHN CN(C(=O)NC[C@@H](c1ccco1)N1CCCCC1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000470737113 885194111 /nfs/dbraw/zinc/19/41/11/885194111.db2.gz MVDOOOHUFUEYOI-GOTSBHOMSA-N 0 3 424.589 4.113 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)Nc1ccccc1OCCc1ccccc1 ZINC000504003420 912907988 /nfs/dbraw/zinc/90/79/88/912907988.db2.gz FLGLAQFDLIHULG-UHFFFAOYSA-N 0 3 418.541 4.299 20 0 HIADHN COc1ccc(OC)c([C@@H](C)NC(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000470745391 885208798 /nfs/dbraw/zinc/20/87/98/885208798.db2.gz PCZIMASQXUNWOT-QUCCMNQESA-N 0 3 411.546 4.071 20 0 HIADHN CSc1cccc(N(C(=O)c2ccnn2-c2ccccc2)C2CCN(C)CC2)c1 ZINC000470950539 885449173 /nfs/dbraw/zinc/44/91/73/885449173.db2.gz RQAQJELYTAQREE-UHFFFAOYSA-N 0 3 406.555 4.335 20 0 HIADHN Cc1nc2ccc(C(=O)N(CCN(C)C)Cc3cccc(C(F)(F)F)c3)cc2o1 ZINC000470951195 885449621 /nfs/dbraw/zinc/44/96/21/885449621.db2.gz XEQOHPOCBLSCJF-UHFFFAOYSA-N 0 3 405.420 4.359 20 0 HIADHN Cc1ccc([C@@H]2CCN(CC(=O)N3CCC(OCc4ccccc4)CC3)C2)c(C)c1 ZINC000471010580 885512894 /nfs/dbraw/zinc/51/28/94/885512894.db2.gz YGMYLJSFGXJAEA-HSZRJFAPSA-N 0 3 406.570 4.301 20 0 HIADHN CN1CCN(CC(=O)NCc2ccc(-c3ccc(Cl)cc3)o2)C2(CCCCC2)C1 ZINC000471038623 885546968 /nfs/dbraw/zinc/54/69/68/885546968.db2.gz QNMURZKOBIDWQZ-UHFFFAOYSA-N 0 3 415.965 4.167 20 0 HIADHN Cc1ccc([C@@H](NC(=O)CN2CCN(C)CC23CCCCC3)c2cccs2)cc1 ZINC000471037733 885547462 /nfs/dbraw/zinc/54/74/62/885547462.db2.gz GXPCMRHDCAHDTB-HSZRJFAPSA-N 0 3 411.615 4.212 20 0 HIADHN CC[C@H](c1nnc(NC(=O)N(CCN(C)C)Cc2ccccn2)s1)c1ccccc1 ZINC000504040424 912947922 /nfs/dbraw/zinc/94/79/22/912947922.db2.gz ZDSSEMLTKCNPJJ-IBGZPJMESA-N 0 3 424.574 4.071 20 0 HIADHN Cc1nc2c(cccc2C(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)o1 ZINC000471052180 885565439 /nfs/dbraw/zinc/56/54/39/885565439.db2.gz ISRSGNOILNXTTC-SFHVURJKSA-N 0 3 401.470 4.032 20 0 HIADHN Cc1nc2ccc(C(=O)Nc3ccnn3[C@H]3CCN(Cc4ccccc4)C3)cc2o1 ZINC000471053205 885567684 /nfs/dbraw/zinc/56/76/84/885567684.db2.gz QTQQVAUPRZQFLY-IBGZPJMESA-N 0 3 401.470 4.032 20 0 HIADHN C[C@H](NC(=O)C1(c2ccccc2Cl)CCOCC1)[C@@H](c1ccccc1)N(C)C ZINC000471127472 885664704 /nfs/dbraw/zinc/66/47/04/885664704.db2.gz NOTBTQXJYKAWRN-UWJYYQICSA-N 0 3 400.950 4.196 20 0 HIADHN CCCCCn1cc(CNC(=O)NC[C@@H](c2cccs2)N2CCCC2)c(C)n1 ZINC000504072152 912973756 /nfs/dbraw/zinc/97/37/56/912973756.db2.gz ZIBWKVAFUUAJJO-IBGZPJMESA-N 0 3 403.596 4.080 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)c1ccc(Cl)cc1Br ZINC000471233405 885807849 /nfs/dbraw/zinc/80/78/49/885807849.db2.gz JXPKIUINHDNZIO-UHFFFAOYSA-N 0 3 407.739 4.281 20 0 HIADHN C[C@H]1[C@H](C(F)(F)F)CCN1C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000471246773 885823026 /nfs/dbraw/zinc/82/30/26/885823026.db2.gz WPMBTZBRVYSQGV-WMLDXEAASA-N 0 3 401.498 4.083 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)c1cc(C(F)(F)F)ccc1F ZINC000471263326 885842732 /nfs/dbraw/zinc/84/27/32/885842732.db2.gz RCZBQGUWCVUXEW-QGZVFWFLSA-N 0 3 409.427 4.366 20 0 HIADHN CSCc1ccc(NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cc1 ZINC000471274613 885853499 /nfs/dbraw/zinc/85/34/99/885853499.db2.gz XDXMXEBROFSMMU-UHFFFAOYSA-N 0 3 401.498 4.476 20 0 HIADHN CC(=O)Nc1cc(C(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)cc(C(F)(F)F)c1 ZINC000471333794 885936372 /nfs/dbraw/zinc/93/63/72/885936372.db2.gz ZLVJCEVHQAMRPY-LIRRHRJNSA-N 0 3 419.447 4.229 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)Nc2cccc(NC(=O)N(C)C)c2C)N(C)C)cc1 ZINC000471360688 885987533 /nfs/dbraw/zinc/98/75/33/885987533.db2.gz RWMWWPDUNFOZHS-OAQYLSRUSA-N 0 3 411.550 4.075 20 0 HIADHN COc1cccc([C@H](CNC(=O)N[C@H]2CCSc3ccccc32)N2CCCC2)c1 ZINC000504087519 912995161 /nfs/dbraw/zinc/99/51/61/912995161.db2.gz NZAPDHKGJLXDSE-SFTDATJTSA-N 0 3 411.571 4.368 20 0 HIADHN CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)Nc1ccc(Br)cc1 ZINC000471487892 886187036 /nfs/dbraw/zinc/18/70/36/886187036.db2.gz KQLXQHGQSDXSEX-YJBOKZPZSA-N 0 3 403.324 4.001 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)NC2CC(F)(c3cccc(Cl)c3)C2)cc1 ZINC000504105602 913016512 /nfs/dbraw/zinc/01/65/12/913016512.db2.gz WCQVRABUHLMWGI-AATLZSDMSA-N 0 3 419.928 4.278 20 0 HIADHN C[C@@H](Cc1ccccc1Br)NC(=O)N(CCN(C)C)Cc1cccs1 ZINC000471540468 886246480 /nfs/dbraw/zinc/24/64/80/886246480.db2.gz ULZZEBNCDFJHHP-HNNXBMFYSA-N 0 3 424.408 4.215 20 0 HIADHN C[C@H](NC(=O)Cc1csc2nc(-c3ccccc3)cn12)[C@@H](c1ccccc1)N(C)C ZINC000471552143 886259816 /nfs/dbraw/zinc/25/98/16/886259816.db2.gz QJZJZCSLQKKXBQ-SBUREZEXSA-N 0 3 418.566 4.413 20 0 HIADHN C[C@H](NC(=O)Cc1csc(Cc2ccc(F)cc2)n1)[C@H](c1ccccc1)N(C)C ZINC000471557845 886266192 /nfs/dbraw/zinc/26/61/92/886266192.db2.gz VHQNLELCFCEUTF-QMHKHESXSA-N 0 3 411.546 4.223 20 0 HIADHN C[C@@H](NC(=O)Cc1csc(Cc2ccc(F)cc2)n1)[C@@H](c1ccccc1)N(C)C ZINC000471557844 886266488 /nfs/dbraw/zinc/26/64/88/886266488.db2.gz VHQNLELCFCEUTF-MWTRTKDXSA-N 0 3 411.546 4.223 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)c3cncc(-c4ccc(OC)cc4)c3)c2)CC1 ZINC000471619206 886335925 /nfs/dbraw/zinc/33/59/25/886335925.db2.gz NGXGXTSRQZSQKY-UHFFFAOYSA-N 0 3 416.525 4.151 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)[C@@H](C)c3ccc(Br)s3)c2)CC1 ZINC000471637129 886354757 /nfs/dbraw/zinc/35/47/57/886354757.db2.gz VKWLHQHZXQVNAO-AWEZNQCLSA-N 0 3 422.392 4.395 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)c3nn(-c4ccccc4Cl)cc3C)c2)CC1 ZINC000471646686 886362796 /nfs/dbraw/zinc/36/27/96/886362796.db2.gz WODYGGROIGSQIU-UHFFFAOYSA-N 0 3 423.948 4.228 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)c3sc(-c4ccc(C)o4)nc3C)c2)CC1 ZINC000471662784 886374732 /nfs/dbraw/zinc/37/47/32/886374732.db2.gz MYIBMWZRBITIQW-UHFFFAOYSA-N 0 3 410.543 4.414 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)c3ccn(C4CCCCC4)n3)CC2)c1 ZINC000471719843 886428676 /nfs/dbraw/zinc/42/86/76/886428676.db2.gz CJZQQBUNOHBTQA-UHFFFAOYSA-N 0 3 423.605 4.029 20 0 HIADHN Cc1cc(C(=O)NCC2(N3CCSCC3)CCCCC2)c(Br)s1 ZINC000471795938 886530082 /nfs/dbraw/zinc/53/00/82/886530082.db2.gz CEEWSMYTVFWFGW-UHFFFAOYSA-N 0 3 417.438 4.301 20 0 HIADHN CN(C)c1ncc(CNCc2ccccc2-c2ccc(Cn3ccnc3)cc2)s1 ZINC000504164596 913054384 /nfs/dbraw/zinc/05/43/84/913054384.db2.gz YDTUCANWWSHAIU-UHFFFAOYSA-N 0 3 403.555 4.411 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)Nc3cc(C(=O)OC)c(C)cc3C)c(C)c2)CC1 ZINC000471841304 886601611 /nfs/dbraw/zinc/60/16/11/886601611.db2.gz XNNPQSIOCDEMHT-UHFFFAOYSA-N 0 3 424.545 4.184 20 0 HIADHN COCCC1(CNC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)CCCC1 ZINC000471843326 886603047 /nfs/dbraw/zinc/60/30/47/886603047.db2.gz HLSAIZVMMUZFAA-NRFANRHFSA-N 0 3 412.496 4.154 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N(C)Cc2ccccc2N2CCCC2)C1 ZINC000504178289 913061143 /nfs/dbraw/zinc/06/11/43/913061143.db2.gz XUZXBJXUVMCALE-NFBKMPQASA-N 0 3 406.574 4.264 20 0 HIADHN Cc1ccc([C@@H](NC(=O)NC[C@H](C)N(C)Cc2ccccc2)c2ccccn2)cc1 ZINC000471852330 886620212 /nfs/dbraw/zinc/62/02/12/886620212.db2.gz VIOFKVIJDBCCPN-GBXCKJPGSA-N 0 3 402.542 4.299 20 0 HIADHN Cn1nc(C(F)F)c2cc(C(=O)N3CCCN(CC4CCCCC4)CC3)sc21 ZINC000471866472 886643311 /nfs/dbraw/zinc/64/33/11/886643311.db2.gz UMYMTDPPTBVJRG-UHFFFAOYSA-N 0 3 410.534 4.301 20 0 HIADHN Cc1cn([C@@H](C)c2ccccc2)nc1NC(=O)N(CCN(C)C)Cc1ccccc1 ZINC000471881718 886662936 /nfs/dbraw/zinc/66/29/36/886662936.db2.gz FCEODBIOELNVNO-FQEVSTJZSA-N 0 3 405.546 4.397 20 0 HIADHN COc1cc(Br)cc(NC(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)c1 ZINC000471933485 886728650 /nfs/dbraw/zinc/72/86/50/886728650.db2.gz KKEXDRUBSYEBHR-MSOLQXFVSA-N 0 3 404.308 4.025 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2cc(C(C)(C)C)nn2-c2ccccn2)[C@H]1c1ccccc1 ZINC000471943943 886745454 /nfs/dbraw/zinc/74/54/54/886745454.db2.gz PBKQUCCNMJMPLX-PGRDOPGGSA-N 0 3 418.545 4.132 20 0 HIADHN CN1CC[C@@H](NC(=O)Nc2cc(Br)c(F)cc2F)[C@@H]1c1ccccc1 ZINC000471964429 886791050 /nfs/dbraw/zinc/79/10/50/886791050.db2.gz IYRLVSGFIZBQQR-WBVHZDCISA-N 0 3 410.262 4.294 20 0 HIADHN CSc1nc(C(C)(C)C)nc(C)c1C(=O)N[C@@H]1C[C@H](C)N(Cc2ccccc2)C1 ZINC000471968386 886800085 /nfs/dbraw/zinc/80/00/85/886800085.db2.gz OMQWOKZZOQACHK-MAUKXSAKSA-N 0 3 412.603 4.197 20 0 HIADHN CSc1nc(C(C)(C)C)nc(C)c1C(=O)N[C@H]1C[C@H](C)N(Cc2ccccc2)C1 ZINC000471968388 886800189 /nfs/dbraw/zinc/80/01/89/886800189.db2.gz OMQWOKZZOQACHK-YJBOKZPZSA-N 0 3 412.603 4.197 20 0 HIADHN COc1cc(NC(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)ccc1Br ZINC000471983307 886810586 /nfs/dbraw/zinc/81/05/86/886810586.db2.gz HXHBVZCSJVEGEN-WMZOPIPTSA-N 0 3 404.308 4.025 20 0 HIADHN CSCc1cc(C(=O)N2CCCN(CCCc3ccccc3)CC2)ccc1F ZINC000471985169 886812965 /nfs/dbraw/zinc/81/29/65/886812965.db2.gz KIYABEXTXZYLRT-UHFFFAOYSA-N 0 3 400.563 4.469 20 0 HIADHN CCC(CC)[C@H](c1ccc(Cl)cc1)N(C)C(=O)NC[C@@H](C)CN1CCN(C)CC1 ZINC000471993363 886819390 /nfs/dbraw/zinc/81/93/90/886819390.db2.gz TUJCSNKXTAIPOU-XMSQKQJNSA-N 0 3 423.045 4.342 20 0 HIADHN CCOCCOCc1cccc(NC(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)c1C ZINC000471996689 886823393 /nfs/dbraw/zinc/82/33/93/886823393.db2.gz BLOXPCXZNOZAMQ-GOTSBHOMSA-N 0 3 411.546 4.115 20 0 HIADHN CC(C)n1cnnc1-c1ccccc1NC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000472020535 886843864 /nfs/dbraw/zinc/84/38/64/886843864.db2.gz TYAYZUAFNZIXFT-SFTDATJTSA-N 0 3 404.518 4.093 20 0 HIADHN CC(C)n1cnnc1-c1ccccc1NC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000472020533 886844200 /nfs/dbraw/zinc/84/42/00/886844200.db2.gz TYAYZUAFNZIXFT-NHCUHLMSSA-N 0 3 404.518 4.093 20 0 HIADHN Cc1ccc(NC(=O)COc2ccc(CC[NH2+]Cc3cc([O-])cc(F)c3)cc2)cc1 ZINC000472034152 886854959 /nfs/dbraw/zinc/85/49/59/886854959.db2.gz CUMAVJDUHAFFNZ-UHFFFAOYSA-N 0 3 408.473 4.190 20 0 HIADHN COc1cccc([C@H](NC(=O)c2cccc(CN(C)C)c2)c2cc(F)ccc2OC)c1 ZINC000472055467 886867247 /nfs/dbraw/zinc/86/72/47/886867247.db2.gz OCKKLOUMLYXIQH-DEOSSOPVSA-N 0 3 422.500 4.424 20 0 HIADHN COc1ccccc1[C@H](CNCc1nc2c(s1)CN(C(C)C)CC2)OC(C)C ZINC000472076072 886878330 /nfs/dbraw/zinc/87/83/30/886878330.db2.gz TUBFIUXRWXAFEQ-FQEVSTJZSA-N 0 3 403.592 4.174 20 0 HIADHN Cc1cc([C@@H](C)NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)ccc1F ZINC000472076486 886879351 /nfs/dbraw/zinc/87/93/51/886879351.db2.gz CPEXKVHIMCYMMH-NVPAJSRCSA-N 0 3 401.448 4.300 20 0 HIADHN C[C@@H](CCN1CCN(C)CC1)NC(=O)c1cc(Cl)ccc1Sc1ccccc1 ZINC000472096215 886890658 /nfs/dbraw/zinc/89/06/58/886890658.db2.gz RQAHBECZZSQDBQ-KRWDZBQOSA-N 0 3 418.006 4.247 20 0 HIADHN CCC(CC)(C(=O)N[C@H](C)CCN1CCN(C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000472119108 886904364 /nfs/dbraw/zinc/90/43/64/886904364.db2.gz AOAYVLUNCHIXEW-MRXNPFEDSA-N 0 3 414.421 4.193 20 0 HIADHN CCCc1cc(C(=O)Nc2cccc(CN3CCC(C(N)=O)CC3)c2)ccc1Cl ZINC000472129441 886921498 /nfs/dbraw/zinc/92/14/98/886921498.db2.gz BSWKPIOPFHUQHJ-UHFFFAOYSA-N 0 3 413.949 4.242 20 0 HIADHN CSc1cc(C(=O)NC2CCN(CCOC(C)C)CC2)c(Cl)cc1Cl ZINC000472169775 886969522 /nfs/dbraw/zinc/96/95/22/886969522.db2.gz IYUPUEYLWAHSAM-UHFFFAOYSA-N 0 3 405.391 4.335 20 0 HIADHN CCC(=O)c1ccc(C(=O)NC2CCN(CCOc3ccc(Cl)cc3)CC2)cc1 ZINC000472237034 887045332 /nfs/dbraw/zinc/04/53/32/887045332.db2.gz GXJVHJYGQKAEFB-UHFFFAOYSA-N 0 3 414.933 4.206 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)N[C@H]3CC[N@@H+]([C@H](C)c4ccccc4)C3)cc2)cc(=O)[n-]1 ZINC000504234921 913106558 /nfs/dbraw/zinc/10/65/58/913106558.db2.gz FLTGQPFWSOEDSD-IERDGZPVSA-N 0 3 417.513 4.115 20 0 HIADHN Cc1nc(-c2ccc(NC(=O)N[C@H]3CC[N@H+]([C@H](C)c4ccccc4)C3)cc2)cc(=O)[n-]1 ZINC000504234921 913106567 /nfs/dbraw/zinc/10/65/67/913106567.db2.gz FLTGQPFWSOEDSD-IERDGZPVSA-N 0 3 417.513 4.115 20 0 HIADHN COc1ccc(OC)c([C@@H]2C[C@H]2C(=O)N[C@H](CN(C)Cc2ccccc2)C(C)C)c1 ZINC000472253490 887062987 /nfs/dbraw/zinc/06/29/87/887062987.db2.gz DEJROKXTZAIAKG-MDNUFGMLSA-N 0 3 410.558 4.080 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)CCSCc3ccccc3)CC2)C[C@H](C)O1 ZINC000472260899 887072216 /nfs/dbraw/zinc/07/22/16/887072216.db2.gz RPWVMVAMLOTKME-BGYRXZFFSA-N 0 3 404.620 4.048 20 0 HIADHN CC(C)c1noc(-c2ccc(NC(=O)N[C@H]3CCN(C)[C@H]3c3ccccc3)cc2)n1 ZINC000472307576 887133390 /nfs/dbraw/zinc/13/33/90/887133390.db2.gz XXTHIZKISWOOIC-PMACEKPBSA-N 0 3 405.502 4.427 20 0 HIADHN Cc1c2cc(F)ccc2oc1S(=O)(=O)N(C)C[C@H]1CCN(Cc2ccccc2)C1 ZINC000472312445 887142140 /nfs/dbraw/zinc/14/21/40/887142140.db2.gz JZWVRJRWILZFRS-GOSISDBHSA-N 0 3 416.518 4.023 20 0 HIADHN Cc1cc(Br)cc2c(C(=O)N(CCN(C)C)Cc3ccco3)coc21 ZINC000472333109 887166083 /nfs/dbraw/zinc/16/60/83/887166083.db2.gz AWVTZWRPGOANCG-UHFFFAOYSA-N 0 3 405.292 4.301 20 0 HIADHN Cc1cc2c(cc1C)[C@@H](C(=O)Nc1ccnn1[C@@H]1CCN(Cc3ccccc3)C1)CO2 ZINC000472353527 887188722 /nfs/dbraw/zinc/18/87/22/887188722.db2.gz RZWNJNOIXQWOFF-IRLDBZIGSA-N 0 3 416.525 4.062 20 0 HIADHN CN(Cc1cc(Cl)ccc1F)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472453346 887307593 /nfs/dbraw/zinc/30/75/93/887307593.db2.gz ZMEFDPXWVNZOIX-UHFFFAOYSA-N 0 3 421.866 4.426 20 0 HIADHN Cc1nc(C(C)(C)NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)sc1C ZINC000472454634 887309819 /nfs/dbraw/zinc/30/98/19/887309819.db2.gz JCSZJEJMBBVCOZ-UHFFFAOYSA-N 0 3 418.529 4.100 20 0 HIADHN CN(Cc1cccc(Cl)c1)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472458960 887316805 /nfs/dbraw/zinc/31/68/05/887316805.db2.gz YQAOJLYNTZRMMW-UHFFFAOYSA-N 0 3 403.876 4.287 20 0 HIADHN Cc1ccc([C@@H](NC(=O)N(Cc2ccco2)C2CCN(C)CC2)c2ccccn2)cc1 ZINC000472483254 887348290 /nfs/dbraw/zinc/34/82/90/887348290.db2.gz ZLHITJIZCOITRQ-XMMPIXPASA-N 0 3 418.541 4.378 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)C(C)(C)c2ccccc2Cl)CC1 ZINC000504286392 913140461 /nfs/dbraw/zinc/14/04/61/913140461.db2.gz NFQVCJGFGCMFES-UHFFFAOYSA-N 0 3 413.993 4.072 20 0 HIADHN CCC(=O)Nc1ccc(C)c(NC(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000472718243 887565321 /nfs/dbraw/zinc/56/53/21/887565321.db2.gz VOZYSULUQSHPJX-NRFANRHFSA-N 0 3 408.546 4.472 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)CCCCC(=O)c3ccc(OC)cc3)c2)CC1 ZINC000472738444 887584527 /nfs/dbraw/zinc/58/45/27/887584527.db2.gz STEQTMNEDSLMIK-UHFFFAOYSA-N 0 3 423.557 4.219 20 0 HIADHN CN(C(=O)Nc1cccc(C(=O)N2CCCC2)c1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000472791518 887637886 /nfs/dbraw/zinc/63/78/86/887637886.db2.gz OORBYRBUKUMFLZ-HSZRJFAPSA-N 0 3 420.557 4.051 20 0 HIADHN Cc1c(COc2ccccc2)cccc1NC(=O)N1CCN(CC2CCOCC2)CC1 ZINC000472862286 887717597 /nfs/dbraw/zinc/71/75/97/887717597.db2.gz DPAOVSBWZPFIBJ-UHFFFAOYSA-N 0 3 423.557 4.150 20 0 HIADHN C[C@H](CCN1CCN(C)CC1)NC(=O)N[C@H](CC1CCCCC1)c1ccccc1 ZINC000472904832 887750918 /nfs/dbraw/zinc/75/09/18/887750918.db2.gz MFYOEUKYVDSALS-NFBKMPQASA-N 0 3 400.611 4.023 20 0 HIADHN C[C@@H](CCN1CCN(C)CC1)NC(=O)N(C)[C@@H](C)c1ccc(-c2ccccc2)cc1 ZINC000472913806 887758867 /nfs/dbraw/zinc/75/88/67/887758867.db2.gz KNKBVELULYTGFG-SFTDATJTSA-N 0 3 408.590 4.082 20 0 HIADHN CC1CCC(N2CCN([C@@H]3CCN(c4ccccc4C(F)(F)F)C3=O)CC2)CC1 ZINC000473053039 887874762 /nfs/dbraw/zinc/87/47/62/887874762.db2.gz RHOQNSZWBZRFEH-LBXVMSDZSA-N 0 3 409.496 4.007 20 0 HIADHN OC1(Cc2cccc(F)c2)CCN(Cc2cccc(OCc3ccccn3)c2)CC1 ZINC000473066677 887887771 /nfs/dbraw/zinc/88/77/71/887887771.db2.gz VHDIDVBMBPQSFH-UHFFFAOYSA-N 0 3 406.501 4.369 20 0 HIADHN O=C(CCN1CC[C@@]2(C1)OCc1ccccc12)N[C@H](c1cccs1)c1ccccc1 ZINC000473155587 887932593 /nfs/dbraw/zinc/93/25/93/887932593.db2.gz AWBHWPFSKKEXTM-DQEYMECFSA-N 0 3 418.562 4.475 20 0 HIADHN O[C@H](COc1ccc(-c2ccccc2)cc1)CN1CC[C@]2(C1)OCc1ccccc12 ZINC000473153457 887933657 /nfs/dbraw/zinc/93/36/57/887933657.db2.gz VNDOBVYGBKIVSU-JYFHCDHNSA-N 0 3 401.506 4.225 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3cc(F)cc(NCC(F)(F)F)c3)cc2)CC1 ZINC000473251806 888016680 /nfs/dbraw/zinc/01/66/80/888016680.db2.gz AKFUVZGELVDBDG-UHFFFAOYSA-N 0 3 424.442 4.194 20 0 HIADHN C[C@@H](Oc1ccccc1Cl)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473522308 888257251 /nfs/dbraw/zinc/25/72/51/888257251.db2.gz FFZWTDJVRINAIG-LRVUVFPRSA-N 0 3 404.860 4.029 20 0 HIADHN O=C(Cc1cc(Cl)ccc1Cl)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473524615 888260570 /nfs/dbraw/zinc/26/05/70/888260570.db2.gz ONIQGDHIJNRHDT-UHFFFAOYSA-N 0 3 409.279 4.457 20 0 HIADHN CC(C)c1cccc(O[C@@H](C)C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)c1 ZINC000473525561 888262482 /nfs/dbraw/zinc/26/24/82/888262482.db2.gz QHDDGBXDVFRPML-MNNVXMFVSA-N 0 3 412.496 4.499 20 0 HIADHN O=C(CSCc1ccc(Cl)cc1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000473527208 888265502 /nfs/dbraw/zinc/26/55/02/888265502.db2.gz ZVJCGFOSUILHIX-UHFFFAOYSA-N 0 3 420.928 4.495 20 0 HIADHN Cc1c(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cnn1-c1cccc(C)c1 ZINC000473528906 888267409 /nfs/dbraw/zinc/26/74/09/888267409.db2.gz IAHAUYFTADPKJX-UHFFFAOYSA-N 0 3 420.479 4.024 20 0 HIADHN CCc1nc2cc(CNC(=O)N[C@@H](CN(C)C)c3ccc(F)cc3)ccc2n1C1CC1 ZINC000504419659 913234093 /nfs/dbraw/zinc/23/40/93/913234093.db2.gz QCZNYGWPIJPCRC-NRFANRHFSA-N 0 3 423.536 4.175 20 0 HIADHN C[C@@H]1[C@H](C(=O)Nc2ccc(CCN3CCSCC3)cc2)CCN1c1ccccc1 ZINC000473609397 888350134 /nfs/dbraw/zinc/35/01/34/888350134.db2.gz VZAATEPJJPHJRI-AUSIDOKSSA-N 0 3 409.599 4.131 20 0 HIADHN COc1ccc(C(=O)Nc2ccc(CCN3CCSCC3)cc2)c(OC(F)F)c1 ZINC000473608382 888350622 /nfs/dbraw/zinc/35/06/22/888350622.db2.gz ROMGXBOLHVOCMW-UHFFFAOYSA-N 0 3 422.497 4.140 20 0 HIADHN CN1CCN(CCC(C)(C)NC(=O)Nc2ccc(OC3CCCC3)c(Cl)c2)CC1 ZINC000473659333 888410750 /nfs/dbraw/zinc/41/07/50/888410750.db2.gz PASBORWEVZERQV-UHFFFAOYSA-N 0 3 423.001 4.199 20 0 HIADHN CN1CCN(CCC(C)(C)NC(=O)Nc2ccc(Oc3cccc(F)c3)cc2)CC1 ZINC000473670850 888430793 /nfs/dbraw/zinc/43/07/93/888430793.db2.gz RYSPFLGMBYYRFH-UHFFFAOYSA-N 0 3 414.525 4.156 20 0 HIADHN CCN(C(=O)NCc1oc2ccccc2c1OC)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000473722069 888499126 /nfs/dbraw/zinc/49/91/26/888499126.db2.gz LCSDLYIMIVSQLW-LJQANCHMSA-N 0 3 407.514 4.247 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)CC3(CSc4ccccc4)CC3)CC2)C[C@@H](C)O1 ZINC000473722152 888499576 /nfs/dbraw/zinc/49/95/76/888499576.db2.gz DICJWROSVMBQAI-WOJBJXKFSA-N 0 3 416.631 4.297 20 0 HIADHN Cc1c(CSC(C)C)cccc1NC(=O)NC(C)(C)CCN1CCN(C)CC1 ZINC000473727159 888504836 /nfs/dbraw/zinc/50/48/36/888504836.db2.gz WLLPEXFUUCBFAM-UHFFFAOYSA-N 0 3 406.640 4.174 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1cc(=O)[nH]c(C2CC2)c1)c1ccc(C(F)(F)F)cc1 ZINC000473768872 888565309 /nfs/dbraw/zinc/56/53/09/888565309.db2.gz XMCVDINUKUENMC-LJQANCHMSA-N 0 3 421.463 4.496 20 0 HIADHN O=C(N[C@H](c1ccccc1)c1ccc2c(c1)CCCO2)N1CCN(C2CCCC2)CC1 ZINC000504449213 913258172 /nfs/dbraw/zinc/25/81/72/913258172.db2.gz QHFSHYWVZQZWKL-RUZDIDTESA-N 0 3 419.569 4.371 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CCC[C@@H]3Cc3ccc(F)cc3)c2)CC1 ZINC000473807982 888630642 /nfs/dbraw/zinc/63/06/42/888630642.db2.gz NTBHOMVLNPESKK-HSZRJFAPSA-N 0 3 410.537 4.207 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N(C)Cc3ccc(F)cc3Cl)c2)CC1 ZINC000473829530 888663289 /nfs/dbraw/zinc/66/32/89/888663289.db2.gz OAJHCBQICITKCH-UHFFFAOYSA-N 0 3 404.917 4.285 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3C[C@@H](C)C[C@H]3c3cccc(OC)c3)c2)CC1 ZINC000473831647 888666787 /nfs/dbraw/zinc/66/67/87/888666787.db2.gz WSCZQFORINCDOF-CYFREDJKSA-N 0 3 422.573 4.452 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CC[C@H](c4ccccc4)[C@@H](C)C3)c2)CC1 ZINC000473832772 888668040 /nfs/dbraw/zinc/66/80/40/888668040.db2.gz AFDVTMGMLXDLOC-RDPSFJRHSA-N 0 3 406.574 4.486 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@@H](C)c3nc(C(C)(C)C)cs3)c2)CC1 ZINC000473836984 888674417 /nfs/dbraw/zinc/67/44/17/888674417.db2.gz PAENPFSWQKLHOI-INIZCTEOSA-N 0 3 415.607 4.465 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CCC[C@H]3Cc3ccc(C)cc3)c2)CC1 ZINC000473838655 888678350 /nfs/dbraw/zinc/67/83/50/888678350.db2.gz YBLMJGMDTXICSZ-DEOSSOPVSA-N 0 3 406.574 4.376 20 0 HIADHN Cc1nc(CC(C)C)c(NC(=O)N2CCC(CN3C[C@H](C)O[C@@H](C)C3)CC2)s1 ZINC000473845208 888689580 /nfs/dbraw/zinc/68/95/80/888689580.db2.gz UYVAMRIVMWMHIB-HOTGVXAUSA-N 0 3 408.612 4.003 20 0 HIADHN COc1ccc(C(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)c(OC(F)F)c1 ZINC000473885262 888752963 /nfs/dbraw/zinc/75/29/63/888752963.db2.gz MFMIDUWYIFVNOF-INIZCTEOSA-N 0 3 404.457 4.033 20 0 HIADHN Cc1c2ccccc2oc1[C@@H](NC(=O)NC(C)(C)CCN1CCN(C)CC1)C(C)C ZINC000473911221 888790880 /nfs/dbraw/zinc/79/08/80/888790880.db2.gz JFYJIKLIPLEXIV-NRFANRHFSA-N 0 3 414.594 4.154 20 0 HIADHN Cc1cccc2c1OCC[C@H]2NC(=O)N(CCN(C)C)Cc1cccc(Cl)c1 ZINC000473979699 888843182 /nfs/dbraw/zinc/84/31/82/888843182.db2.gz VRDYQCRZXJUQNR-HXUWFJFHSA-N 0 3 401.938 4.245 20 0 HIADHN O=C1[C@H](NCc2ccc(-n3ccnc3)cc2)CCN1c1ccc(Cl)cc1Cl ZINC000473988967 888850162 /nfs/dbraw/zinc/85/01/62/888850162.db2.gz JRPIONUYBLHXDS-GOSISDBHSA-N 0 3 401.297 4.074 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3cc(-c4ccccc4)ns3)CC2)C[C@@H](C)O1 ZINC000474004386 888862751 /nfs/dbraw/zinc/86/27/51/888862751.db2.gz FXTOBNSRPSNDGO-IAGOWNOFSA-N 0 3 414.575 4.163 20 0 HIADHN Cc1[nH]nc2ncc(CN[C@@H](Cc3ccccn3)c3ccc(Br)cc3)cc12 ZINC000474010198 888867093 /nfs/dbraw/zinc/86/70/93/888867093.db2.gz PIYOIKDICVDTLJ-FQEVSTJZSA-N 0 3 422.330 4.497 20 0 HIADHN CC[C@@H](C)[C@H](NC(=O)NC(C)(C)CCN1CCN(C)CC1)c1ccc(Cl)cc1 ZINC000474041366 888885118 /nfs/dbraw/zinc/88/51/18/888885118.db2.gz YTAYILMLCLKHKL-XLIONFOSSA-N 0 3 409.018 4.143 20 0 HIADHN C[C@@H](N[C@H]1CCN(c2ccc(Cl)cc2Cl)C1=O)c1ccc(-n2cncn2)cc1 ZINC000474090162 888916886 /nfs/dbraw/zinc/91/68/86/888916886.db2.gz RKBGWQCFGHMXFQ-ACJLOTCBSA-N 0 3 416.312 4.030 20 0 HIADHN CN1CCN(CCC(C)(C)NC(=O)c2ccc(-c3ccccc3C(F)(F)F)o2)CC1 ZINC000474194075 889031804 /nfs/dbraw/zinc/03/18/04/889031804.db2.gz ZJYARNXZWMRPMX-UHFFFAOYSA-N 0 3 423.479 4.111 20 0 HIADHN Cn1c2ccc(CN3CCC[C@H](c4nc(-c5cccc(F)c5)no4)C3)cc2sc1=O ZINC000474274219 889138334 /nfs/dbraw/zinc/13/83/34/889138334.db2.gz SHFDFCJSZTUOPF-INIZCTEOSA-N 0 3 424.501 4.169 20 0 HIADHN Cc1c(N[C@@H](C)C(C)C)cccc1C(=O)Nc1ccc2oc(=O)n(CCN(C)C)c2c1 ZINC000474289102 889154831 /nfs/dbraw/zinc/15/48/31/889154831.db2.gz CZPZIIYHEKLJJN-KRWDZBQOSA-N 0 3 424.545 4.173 20 0 HIADHN COc1ccc2nc(CNCc3ccccc3CN3C[C@@H](C)O[C@H](C)C3)sc2c1 ZINC000474368049 889246210 /nfs/dbraw/zinc/24/62/10/889246210.db2.gz IZXDOVQQMOURTJ-IAGOWNOFSA-N 0 3 411.571 4.204 20 0 HIADHN COc1ccc2nc(CNC[C@H](CO)Cc3ccc(C(F)(F)F)cc3)sc2c1 ZINC000474371786 889249277 /nfs/dbraw/zinc/24/92/77/889249277.db2.gz OHQYUUQDKCTHEP-CQSZACIVSA-N 0 3 410.461 4.265 20 0 HIADHN CCOc1ccc(NC(=O)CN2CCN(C[C@H](c3ccccc3)C(C)C)CC2)cc1 ZINC000474371706 889249391 /nfs/dbraw/zinc/24/93/91/889249391.db2.gz CODQSQKVRXLJDZ-DEOSSOPVSA-N 0 3 409.574 4.081 20 0 HIADHN COc1ccc([C@H](C)N[C@@H]2CCN([C@@H](C(=O)OC(C)(C)C)c3ccccc3)C2=O)cc1 ZINC000474433818 889299013 /nfs/dbraw/zinc/29/90/13/889299013.db2.gz QQFMTPFDENZAGC-MTNREXPMSA-N 0 3 424.541 4.030 20 0 HIADHN CCc1cnc(CN(C)C(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)s1 ZINC000474463311 889329258 /nfs/dbraw/zinc/32/92/58/889329258.db2.gz YONBHLIZVMIHHD-LJQANCHMSA-N 0 3 411.493 4.119 20 0 HIADHN Cc1ccccc1-n1nccc1CNCc1ccc(CN2C[C@H](C)O[C@@H](C)C2)cc1 ZINC000474468281 889331987 /nfs/dbraw/zinc/33/19/87/889331987.db2.gz JZPXLVQBIFSGMD-SFTDATJTSA-N 0 3 404.558 4.080 20 0 HIADHN COCCOc1ccc(C(=O)N(Cc2ccccc2)C2CCN(C)CC2)c(Cl)c1 ZINC000474497184 889358929 /nfs/dbraw/zinc/35/89/29/889358929.db2.gz PEOGOFNYXAFZMZ-UHFFFAOYSA-N 0 3 416.949 4.102 20 0 HIADHN Cc1ccc(NC(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)cc1OCC(F)F ZINC000474596838 889465323 /nfs/dbraw/zinc/46/53/23/889465323.db2.gz VQJUSKZKXBAXOQ-IBGZPJMESA-N 0 3 403.473 4.377 20 0 HIADHN CCOc1c(Cl)cc(CNCc2ccc(Cl)cc2-n2cncn2)cc1OC ZINC000474606156 889473599 /nfs/dbraw/zinc/47/35/99/889473599.db2.gz KJKNNQNSVOZSLG-UHFFFAOYSA-N 0 3 407.301 4.271 20 0 HIADHN C[C@@H]1CCC[C@@H](C)N1CCNC(=O)c1ccc(NC(=O)Nc2ccccc2)s1 ZINC000474611242 889475106 /nfs/dbraw/zinc/47/51/06/889475106.db2.gz FORWYQNKJVPDHJ-HZPDHXFCSA-N 0 3 400.548 4.385 20 0 HIADHN CN(C(=O)Nc1cccc(-c2noc(C3CC3)n2)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000474617538 889482641 /nfs/dbraw/zinc/48/26/41/889482641.db2.gz GPAFONYNWVNGTA-OAQYLSRUSA-N 0 3 417.513 4.352 20 0 HIADHN COc1ccc(NC(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)cc1Br ZINC000474627153 889489516 /nfs/dbraw/zinc/48/95/16/889489516.db2.gz NPSVQYIBUBGWLP-KRWDZBQOSA-N 0 3 418.335 4.196 20 0 HIADHN CC(C)c1nc2c([nH]1)C[C@H](C(=O)NC[C@H](c1cccc(Cl)c1)N1CCCC1)CC2 ZINC000474789661 889647317 /nfs/dbraw/zinc/64/73/17/889647317.db2.gz AGNXTTWVYFMMOS-DYESRHJHSA-N 0 3 414.981 4.245 20 0 HIADHN CC(C)c1nc2c([nH]1)CC[C@@H](C(=O)NC[C@H](c1cccc(Cl)c1)N1CCCC1)C2 ZINC000474789661 889647323 /nfs/dbraw/zinc/64/73/23/889647323.db2.gz AGNXTTWVYFMMOS-DYESRHJHSA-N 0 3 414.981 4.245 20 0 HIADHN Fc1ccc(I)c(F)c1CN[C@H]1CCOC2(CCCC2)C1 ZINC000474810573 889664531 /nfs/dbraw/zinc/66/45/31/889664531.db2.gz PHJIFNVLBNDKSL-NSHDSACASA-N 0 3 407.242 4.151 20 0 HIADHN CCN1CCN(c2ccc(C(=O)N[C@H](C)c3ccc(-c4cccnc4)cc3)cc2)CC1 ZINC000474868283 889723036 /nfs/dbraw/zinc/72/30/36/889723036.db2.gz KAHVXWHORZORMF-HXUWFJFHSA-N 0 3 414.553 4.382 20 0 HIADHN C[C@@H]([NH2+][C@@H](c1nc(-c2nc[n-]n2)no1)C(C)(C)C)C1CCC(C(F)(F)F)CC1 ZINC000474882101 889736572 /nfs/dbraw/zinc/73/65/72/889736572.db2.gz KEHUCGVOLSGCPZ-XVSSEFHLSA-N 0 3 400.449 4.289 20 0 HIADHN CC(C)C[C@H]([NH2+][C@H](C)C1CCC(C(F)(F)F)CC1)c1nc(-c2nc[n-]n2)no1 ZINC000474884510 889740596 /nfs/dbraw/zinc/74/05/96/889740596.db2.gz AEDAXWPIQHFZPT-RYSNWHEDSA-N 0 3 400.449 4.289 20 0 HIADHN COCCN(CCN(C)C)C(=O)Nc1ccc(-c2ccc(Cl)cc2Cl)nc1 ZINC000474969830 889825567 /nfs/dbraw/zinc/82/55/67/889825567.db2.gz COHRQJLZBUVSDB-UHFFFAOYSA-N 0 3 411.333 4.097 20 0 HIADHN CCN(C(=O)Nc1cc(-c2n[nH]c(C)n2)ccc1C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475004940 889855560 /nfs/dbraw/zinc/85/55/60/889855560.db2.gz XKDCKQBDNYNLCC-NRFANRHFSA-N 0 3 418.545 4.217 20 0 HIADHN CCN(C(=O)Nc1nnc(/C=C\c2ccco2)s1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475006928 889858984 /nfs/dbraw/zinc/85/89/84/889858984.db2.gz BKACMQYPDLNPSI-RXQFDZFGSA-N 0 3 423.542 4.430 20 0 HIADHN CCN(C(=O)Nc1ccccc1C(=O)N1CCCC1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475007054 889859172 /nfs/dbraw/zinc/85/91/72/889859172.db2.gz GTHFHLOWAQPXIO-NRFANRHFSA-N 0 3 420.557 4.051 20 0 HIADHN CCN(C(=O)Nc1ccc2nc(N(C)C)oc2c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475009375 889862656 /nfs/dbraw/zinc/86/26/56/889862656.db2.gz YNGZHYWIAOISDJ-IBGZPJMESA-N 0 3 407.518 4.022 20 0 HIADHN CN(C(=O)N[C@H](c1ccccc1)c1ccccn1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475009977 889863935 /nfs/dbraw/zinc/86/39/35/889863935.db2.gz RGAFULAEPMIAOF-LADGPHEKSA-N 0 3 400.526 4.087 20 0 HIADHN CCN1CCN(c2cccc(NCc3ccccc3OCc3cccnc3)c2)CC1 ZINC000475087677 889934951 /nfs/dbraw/zinc/93/49/51/889934951.db2.gz KQOTZXDYKSFADA-UHFFFAOYSA-N 0 3 402.542 4.415 20 0 HIADHN COc1cccc(Cl)c1-c1noc(C)c1C(=O)NCCN(C)Cc1ccccc1 ZINC000475116438 889970795 /nfs/dbraw/zinc/97/07/95/889970795.db2.gz JTMVWIYMTXXRBN-UHFFFAOYSA-N 0 3 413.905 4.174 20 0 HIADHN CN(C(=O)NC[C@@H]1CCCO[C@H]1c1ccccc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475127336 889987135 /nfs/dbraw/zinc/98/71/35/889987135.db2.gz BFDQUHKGMZLXJB-VXNXHJTFSA-N 0 3 407.558 4.070 20 0 HIADHN CCN(C(=O)NCc1cccc(OC(F)F)c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475163898 890029377 /nfs/dbraw/zinc/02/93/77/890029377.db2.gz KRPUWQMJVRHYCE-LJQANCHMSA-N 0 3 403.473 4.094 20 0 HIADHN CCN(C(=O)N[C@@H](C)c1ccc(-n2cccn2)cc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475176127 890044160 /nfs/dbraw/zinc/04/41/60/890044160.db2.gz OIAZHGBBADAZOV-GBXCKJPGSA-N 0 3 417.557 4.239 20 0 HIADHN Cc1ccccc1-n1nccc1CN1C[C@H]2CCC[C@@]2(c2nc(CC3CC3)no2)C1 ZINC000475216312 890085097 /nfs/dbraw/zinc/08/50/97/890085097.db2.gz ODSAPIDUOSMHJL-NTKDMRAZSA-N 0 3 403.530 4.070 20 0 HIADHN CCS(=O)(=O)c1ccc(CNC2CC(c3ccc(Br)cc3)C2)s1 ZINC000475221443 890089708 /nfs/dbraw/zinc/08/97/08/890089708.db2.gz XMCYFJNCQJJMTJ-UHFFFAOYSA-N 0 3 414.390 4.340 20 0 HIADHN C[C@H](Oc1cccnc1NC(=O)N(CCN(C)C)Cc1ccccn1)c1ccccc1 ZINC000475266954 890162030 /nfs/dbraw/zinc/16/20/30/890162030.db2.gz GRSYSQAZVKXFAD-IBGZPJMESA-N 0 3 419.529 4.212 20 0 HIADHN COc1ccc([C@H](CNC(=O)[C@@H](C)c2cn(C)c3ccccc23)N2CCCC2)cc1 ZINC000475285396 890184987 /nfs/dbraw/zinc/18/49/87/890184987.db2.gz GTTSKPNLGXQEOI-UUOWRZLLSA-N 0 3 405.542 4.244 20 0 HIADHN Cc1noc(CSc2ccccc2C(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000475306117 890216819 /nfs/dbraw/zinc/21/68/19/890216819.db2.gz RCWLQMSVJSNXIL-IBGZPJMESA-N 0 3 422.554 4.017 20 0 HIADHN CN(C(=O)c1cc(C2CC2)nn1-c1ccccc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475307565 890217553 /nfs/dbraw/zinc/21/75/53/890217553.db2.gz DLDJBPHNNYLFPC-QFIPXVFZSA-N 0 3 400.526 4.096 20 0 HIADHN CO[C@H]1CCC[C@@H](CC(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)C1 ZINC000475312595 890227170 /nfs/dbraw/zinc/22/71/70/890227170.db2.gz BYHGABPYQCKCCU-MJGOQNOKSA-N 0 3 400.485 4.191 20 0 HIADHN C[C@@H](NC(=O)N(CCN(C)Cc1ccccc1)Cc1ccccc1)C1CCOCC1 ZINC000475374506 890304530 /nfs/dbraw/zinc/30/45/30/890304530.db2.gz ZFFLRRJMAGPLSA-OAQYLSRUSA-N 0 3 409.574 4.145 20 0 HIADHN Cn1c2ccc(C(F)(F)F)cc2nc1CN1CCC[C@]1(CO)Cc1ccccc1 ZINC000475375731 890306186 /nfs/dbraw/zinc/30/61/86/890306186.db2.gz QIHFOPVWJKZJTB-OAQYLSRUSA-N 0 3 403.448 4.162 20 0 HIADHN CS(=O)(=O)C1(CNCc2ccc(-c3ccccc3Br)s2)CCC1 ZINC000475425959 890346124 /nfs/dbraw/zinc/34/61/24/890346124.db2.gz AKGADOFLFXOUIW-UHFFFAOYSA-N 0 3 414.390 4.235 20 0 HIADHN CN(C)CCN(C(=O)[C@@H]1CCCN(C(=O)c2cccc3ccccc32)C1)C1CCCC1 ZINC000475451920 890367931 /nfs/dbraw/zinc/36/79/31/890367931.db2.gz HYTOQVMCACUENR-OAQYLSRUSA-N 0 3 421.585 4.025 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)Cc1cnc2ccccc2c1 ZINC000475511032 890428482 /nfs/dbraw/zinc/42/84/82/890428482.db2.gz XPBNCIMCQFEREX-UHFFFAOYSA-N 0 3 415.459 4.387 20 0 HIADHN CCOc1cc(CN[C@@H]2CCCc3ccc(F)cc32)ccc1O[C@H](C)C(=O)N(C)C ZINC000475517371 890435250 /nfs/dbraw/zinc/43/52/50/890435250.db2.gz SYCCVJAQPGFINC-IIBYNOLFSA-N 0 3 414.521 4.247 20 0 HIADHN COc1ccc(F)c2[nH]c(C(=O)N3CCCN(CCCc4ccccc4)CC3)cc21 ZINC000475526657 890449401 /nfs/dbraw/zinc/44/94/01/890449401.db2.gz YSFCHESZJDKLHL-UHFFFAOYSA-N 0 3 409.505 4.096 20 0 HIADHN CN(C(=O)c1cc2c(cccc2Br)[nH]1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475554282 890479353 /nfs/dbraw/zinc/47/93/53/890479353.db2.gz HWVRZFXUFYKIOE-INIZCTEOSA-N 0 3 412.331 4.277 20 0 HIADHN CN(C(=O)c1cc2c(cccc2Br)[nH]1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475554283 890479880 /nfs/dbraw/zinc/47/98/80/890479880.db2.gz HWVRZFXUFYKIOE-MRXNPFEDSA-N 0 3 412.331 4.277 20 0 HIADHN CCCCOc1ccc(CN2CCC[C@H](N(C)Cc3noc(C)n3)CC2)cc1OC ZINC000475627163 890565436 /nfs/dbraw/zinc/56/54/36/890565436.db2.gz OQYIXVBZOBTARM-FQEVSTJZSA-N 0 3 416.566 4.052 20 0 HIADHN Cc1nc(CN(C)[C@@H]2CCCN(Cc3cnc(-c4ccc(C)cc4)s3)CC2)no1 ZINC000475634353 890574160 /nfs/dbraw/zinc/57/41/60/890574160.db2.gz MAXIAQSCYKSQDF-LJQANCHMSA-N 0 3 411.575 4.296 20 0 HIADHN Cc1ccc(-n2cccn2)cc1NC(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000475635900 890575771 /nfs/dbraw/zinc/57/57/71/890575771.db2.gz DIZSDQFJBYNGFT-UHFFFAOYSA-N 0 3 403.530 4.309 20 0 HIADHN CCc1nnc(-c2ccc(NC(=O)N3CCCN(Cc4ccccc4)C[C@H]3C)cc2)o1 ZINC000475672245 890615089 /nfs/dbraw/zinc/61/50/89/890615089.db2.gz COVOPYCYSYEJOX-GOSISDBHSA-N 0 3 419.529 4.427 20 0 HIADHN C[C@@H](NCCC(=O)Nc1ccc(C(N)=O)c(Cl)c1)c1cc2cccc(F)c2o1 ZINC000475704803 890643358 /nfs/dbraw/zinc/64/33/58/890643358.db2.gz RYVQARRWIIXIRI-LLVKDONJSA-N 0 3 403.841 4.004 20 0 HIADHN CCc1nnc(-c2ccc(NC(=O)NC[C@H](c3cccs3)N3CCCC3)cc2)o1 ZINC000475705234 890643522 /nfs/dbraw/zinc/64/35/22/890643522.db2.gz JQFFZOQQEUWGOL-QGZVFWFLSA-N 0 3 411.531 4.319 20 0 HIADHN Cc1csc2nc(CN(Cc3cccc(Br)c3)CC3CC3)cc(=O)n12 ZINC000475736729 890676810 /nfs/dbraw/zinc/67/68/10/890676810.db2.gz IMZRYHNDJGKHTG-UHFFFAOYSA-N 0 3 418.360 4.239 20 0 HIADHN CN(C(=O)CN1CCC[C@@]2(CCCOC2)C1)[C@H](c1ccccc1)c1ccc(F)cc1 ZINC000475743227 890686180 /nfs/dbraw/zinc/68/61/80/890686180.db2.gz XMUFVXWVVLSJAC-JWQCQUIFSA-N 0 3 410.533 4.266 20 0 HIADHN CCN(C(=O)c1ccc(OC)cc1OC(F)F)[C@H]1CCN(Cc2ccccc2)C1 ZINC000475814144 890749163 /nfs/dbraw/zinc/74/91/63/890749163.db2.gz WIYFRBXGJXQVDY-KRWDZBQOSA-N 0 3 404.457 4.033 20 0 HIADHN O=C(NCCc1ccncc1)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000475845332 890779408 /nfs/dbraw/zinc/77/94/08/890779408.db2.gz HCIQGAPRSHJXPN-UHFFFAOYSA-N 0 3 421.372 4.239 20 0 HIADHN CN1CCC(Oc2ccc(NC(=O)C(C)(C)c3ccc(Cl)cc3F)cn2)CC1 ZINC000475906597 890836066 /nfs/dbraw/zinc/83/60/66/890836066.db2.gz CSDCMAPMYBSVRI-UHFFFAOYSA-N 0 3 405.901 4.263 20 0 HIADHN C[C@@H](NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(-c2cccnc2)cc1 ZINC000475947149 890869490 /nfs/dbraw/zinc/86/94/90/890869490.db2.gz SGCVMGQHSKOLCG-NTKDMRAZSA-N 0 3 400.526 4.383 20 0 HIADHN COCCN1CCC(NC(=O)Nc2ccccc2-c2cc(F)c(F)c(F)c2)CC1 ZINC000475955060 890876685 /nfs/dbraw/zinc/87/66/85/890876685.db2.gz VVBIEWIOCQJRTR-UHFFFAOYSA-N 0 3 407.436 4.003 20 0 HIADHN C[C@@H](NC(=O)NC[C@H](Cc1ccccc1)N(C)C)c1ccc(-c2cccnc2)cc1 ZINC000475972198 890889958 /nfs/dbraw/zinc/88/99/58/890889958.db2.gz CWAXXQRKMXMAGV-DVECYGJZSA-N 0 3 402.542 4.282 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N[C@H]2CCc3c2ccc(Cl)c3Cl)CC1 ZINC000476029608 890963133 /nfs/dbraw/zinc/96/31/33/890963133.db2.gz GIDDJPOLUIKMBO-SFHVURJKSA-N 0 3 414.377 4.169 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)NCc2ccc(OC3CCCCC3)cc2)CC1 ZINC000476039701 890970870 /nfs/dbraw/zinc/97/08/70/890970870.db2.gz IIGFRBQZRZSHFV-UHFFFAOYSA-N 0 3 417.594 4.087 20 0 HIADHN CN(CC[C@H]1CCCCN1C)C(=O)c1cc(F)c(F)cc1C(=O)c1ccccc1 ZINC000476102205 891023015 /nfs/dbraw/zinc/02/30/15/891023015.db2.gz XINDKFXWTMYBQS-QGZVFWFLSA-N 0 3 400.469 4.142 20 0 HIADHN CN(CC[C@@H]1CCCCN1C)C(=O)c1cc(F)c(F)cc1C(=O)c1ccccc1 ZINC000476102204 891023439 /nfs/dbraw/zinc/02/34/39/891023439.db2.gz XINDKFXWTMYBQS-KRWDZBQOSA-N 0 3 400.469 4.142 20 0 HIADHN Cc1cc(C(=O)Nc2ccc(C(=O)N(C)[C@@H]3CCCN(C)C3)cc2)c(C)cc1Cl ZINC000476129674 891052192 /nfs/dbraw/zinc/05/21/92/891052192.db2.gz BJEDHOSWDVBNLC-LJQANCHMSA-N 0 3 413.949 4.375 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)Nc1ccc(OCC2CCOCC2)cc1)c1ccco1 ZINC000476160683 891086248 /nfs/dbraw/zinc/08/62/48/891086248.db2.gz QABVSCUJTQBJFB-DYESRHJHSA-N 0 3 415.534 4.336 20 0 HIADHN CCNc1ccc(Cl)cc1C(=O)N1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000476245112 891168816 /nfs/dbraw/zinc/16/88/16/891168816.db2.gz FCAAOHJHMOGTDE-IRXDYDNUSA-N 0 3 407.986 4.123 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1ccc(COC(F)(F)F)cc1 ZINC000476302410 891215585 /nfs/dbraw/zinc/21/55/85/891215585.db2.gz IRCXOTXEZABNFE-UHFFFAOYSA-N 0 3 422.447 4.180 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)N[C@@H]2CCCN(c3ccccc3F)C2)CC1 ZINC000476316108 891223706 /nfs/dbraw/zinc/22/37/06/891223706.db2.gz LRFVJSBMDCYSKP-OAQYLSRUSA-N 0 3 424.564 4.101 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N2CCCC[C@H]2c2cc3ccccc3[nH]2)CC1 ZINC000476453262 891364640 /nfs/dbraw/zinc/36/46/40/891364640.db2.gz BZVDXBNOKRDYBH-QHCPKHFHSA-N 0 3 412.578 4.294 20 0 HIADHN Cc1ccc([C@@H]2[C@@H](C)CCCN2C(=O)NC2CCN(CCOC(C)C)CC2)cc1 ZINC000476455777 891367337 /nfs/dbraw/zinc/36/73/37/891367337.db2.gz XRHSFQJZZOCSOB-REWPJTCUSA-N 0 3 401.595 4.367 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N(CC2CCC2)[C@@H](C)c2ccccc2)CC1 ZINC000476466148 891377844 /nfs/dbraw/zinc/37/78/44/891377844.db2.gz YCHYHPZLARPXAM-FQEVSTJZSA-N 0 3 401.595 4.449 20 0 HIADHN COc1ccccc1[C@@H](C)N(C)C(=O)CN1CCN(C2CCC(C(C)C)CC2)CC1 ZINC000476537637 891450318 /nfs/dbraw/zinc/45/03/18/891450318.db2.gz CUKAPGPAIBWWOV-ITAUSPCMSA-N 0 3 415.622 4.047 20 0 HIADHN CCN1CC[C@H](N(C)C(=O)c2cn(C3CC3)c3cc(Cl)c(F)cc3c2=O)C[C@H]1C ZINC000476546374 891462365 /nfs/dbraw/zinc/46/23/65/891462365.db2.gz NZRZOUWNNLMHTG-HIFRSBDPSA-N 0 3 419.928 4.074 20 0 HIADHN CSc1cnn(-c2ccccc2)c1NC(=O)N[C@@H](CN(C)C)c1ccc(F)cc1 ZINC000476573839 891494984 /nfs/dbraw/zinc/49/49/84/891494984.db2.gz YBBLFHDYDNLQRF-SFHVURJKSA-N 0 3 413.522 4.158 20 0 HIADHN COc1cc(F)c(NC(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)cc1F ZINC000476623442 891558630 /nfs/dbraw/zinc/55/86/30/891558630.db2.gz HAMIMXDUFCCMNC-LJQANCHMSA-N 0 3 407.461 4.185 20 0 HIADHN Cc1nc2c(s1)[C@H](N(C)C(=O)NC[C@@H](c1cccs1)N1CCCC1)CCC2 ZINC000476687525 891639363 /nfs/dbraw/zinc/63/93/63/891639363.db2.gz VOVOIOSLGMLEIS-SJORKVTESA-N 0 3 404.605 4.369 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)N1CCC[C@@]2(C1)OCc1ccccc12 ZINC000476687729 891642625 /nfs/dbraw/zinc/64/26/25/891642625.db2.gz BAGBBVLYPOMJDJ-ZCYQVOJMSA-N 0 3 405.542 4.055 20 0 HIADHN COCCN1CCC(NC(=O)N[C@@H](c2ccccc2)c2cccc3ccccc32)CC1 ZINC000476738928 891705424 /nfs/dbraw/zinc/70/54/24/891705424.db2.gz YIMCTTZOJOFGKL-VWLOTQADSA-N 0 3 417.553 4.339 20 0 HIADHN CC(C)C(=O)Nc1cccc(NC(=O)NC[C@@H](C(C)C)N2CCc3ccccc3C2)c1 ZINC000504863056 913592735 /nfs/dbraw/zinc/59/27/35/913592735.db2.gz IONOGDZMXLXVFK-QHCPKHFHSA-N 0 3 422.573 4.486 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N(CCCO)[C@@H]2CCCc3ccccc32)C1 ZINC000476830695 891811866 /nfs/dbraw/zinc/81/18/66/891811866.db2.gz PKBWEQPQJPTQDF-JHMXWDHMSA-N 0 3 421.585 4.294 20 0 HIADHN O=C(Cc1nc(-c2ccc(F)cc2)cs1)NC[C@@H]1CCCN1Cc1ccccc1 ZINC000477028943 891954899 /nfs/dbraw/zinc/95/48/99/891954899.db2.gz ZXFQUQDOOZRRJY-FQEVSTJZSA-N 0 3 409.530 4.273 20 0 HIADHN O=C(Nc1cccc(OCc2cccnc2)c1)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000504881864 913611835 /nfs/dbraw/zinc/61/18/35/913611835.db2.gz KNYZMDYCRJSZJG-HSZRJFAPSA-N 0 3 416.525 4.447 20 0 HIADHN C[C@H](NC(=O)Nc1cccc(-c2noc(C3CC3)n2)c1)[C@@H](c1ccccc1)N(C)C ZINC000477071063 892004152 /nfs/dbraw/zinc/00/41/52/892004152.db2.gz RMZNXPWJIUSFAP-YWZLYKJASA-N 0 3 405.502 4.427 20 0 HIADHN COc1cccc(NC(=O)[C@@H](NCCc2ccc(OC)c(F)c2)c2ccccc2)c1 ZINC000477101278 892034277 /nfs/dbraw/zinc/03/42/77/892034277.db2.gz QCNQOMPSAPURER-QHCPKHFHSA-N 0 3 408.473 4.355 20 0 HIADHN C/C=C\c1ccc(OC[C@H](O)CN2CCC(OCc3ccccc3)CC2)c(OC)c1 ZINC000477157176 892079564 /nfs/dbraw/zinc/07/95/64/892079564.db2.gz BWMOMMVEOKQNRA-NEAHNDPRSA-N 0 3 411.542 4.149 20 0 HIADHN CCc1noc(-c2ccc(C)c(NC(=O)NC[C@H](N[C@H](C)CC)c3ccco3)c2)n1 ZINC000477160114 892081300 /nfs/dbraw/zinc/08/13/00/892081300.db2.gz HQORMDNSZOSQHJ-QAPCUYQASA-N 0 3 411.506 4.451 20 0 HIADHN Cc1cc(Br)ccc1CNC(=O)N(CCN(C)C)Cc1cccc(F)c1 ZINC000477365036 892328561 /nfs/dbraw/zinc/32/85/61/892328561.db2.gz MVESPZAHHNOQSS-UHFFFAOYSA-N 0 3 422.342 4.170 20 0 HIADHN CCSc1ccc(C(=O)NC2CCN(CCOc3ccc(F)cc3)CC2)cc1 ZINC000477367648 892330364 /nfs/dbraw/zinc/33/03/64/892330364.db2.gz XGGQJFLLEONCSP-UHFFFAOYSA-N 0 3 402.535 4.211 20 0 HIADHN Cc1nc2ccccc2n1C1CCN(C(=O)c2cccc(CN3CCCC3)c2)CC1 ZINC000477452045 892406228 /nfs/dbraw/zinc/40/62/28/892406228.db2.gz KRJLVBISMONGQB-UHFFFAOYSA-N 0 3 402.542 4.418 20 0 HIADHN CN(C(=O)N[C@@H]1CCCc2nc(-c3ccc(F)cc3)sc21)[C@@H]1CCN(C2CC2)C1 ZINC000477496932 892498355 /nfs/dbraw/zinc/49/83/55/892498355.db2.gz IANUNLUIMZLOJV-IEBWSBKVSA-N 0 3 414.550 4.205 20 0 HIADHN CCN1CCN(c2ccc(C(=O)Nc3cc(-c4cccnc4)ccc3C)cc2)CC1 ZINC000477533396 892563837 /nfs/dbraw/zinc/56/38/37/892563837.db2.gz GOAFNYMKVLIFPN-UHFFFAOYSA-N 0 3 400.526 4.451 20 0 HIADHN C[C@H](c1ccc(C(F)(F)F)cc1)N(C)S(=O)(=O)c1ccc(CN(C)C)cc1 ZINC000477537854 892575141 /nfs/dbraw/zinc/57/51/41/892575141.db2.gz SGXZRGDHVBLYPD-CQSZACIVSA-N 0 3 400.466 4.149 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)N[C@@H](C)c2ccc(C(F)(F)F)cc2)cc1 ZINC000477623188 892730058 /nfs/dbraw/zinc/73/00/58/892730058.db2.gz QPWNGUBDXMDPBI-IFXJQAMLSA-N 0 3 409.452 4.377 20 0 HIADHN COc1ccc2nc(C)cc(C(=O)Nc3cccc(CN4CCC(CO)CC4)c3)c2c1 ZINC000477716449 892824305 /nfs/dbraw/zinc/82/43/05/892824305.db2.gz LAHIVCWRYVUNOF-UHFFFAOYSA-N 0 3 419.525 4.008 20 0 HIADHN O=C(CCCCC(=O)c1ccccc1)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000477718300 892824936 /nfs/dbraw/zinc/82/49/36/892824936.db2.gz LTLPYDHXQWQLQC-UHFFFAOYSA-N 0 3 408.542 4.273 20 0 HIADHN CCN(C[C@H]1CCN([C@@H](C)C(=O)N(Cc2ccccc2)C(C)C)C1)CC(F)(F)F ZINC000477723493 892827328 /nfs/dbraw/zinc/82/73/28/892827328.db2.gz JQTQJMYWBGEGLJ-AZUAARDMSA-N 0 3 413.528 4.018 20 0 HIADHN CCN(C[C@@H]1CCN([C@H](C)C(=O)N2CCC[C@@H]2c2cccs2)C1)CC(F)(F)F ZINC000477724240 892827407 /nfs/dbraw/zinc/82/74/07/892827407.db2.gz LOLDCQMLKIMKRQ-IXDOHACOSA-N 0 3 417.541 4.006 20 0 HIADHN CC[C@H](O[C@H]1CCC[C@H](C)C1)C(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000477752906 892843954 /nfs/dbraw/zinc/84/39/54/892843954.db2.gz YAYPEFZFNXKIET-TZYHBYERSA-N 0 3 402.579 4.203 20 0 HIADHN CC[C@H](O[C@@H]1CCC[C@@H](C)C1)C(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000477752907 892844322 /nfs/dbraw/zinc/84/43/22/892844322.db2.gz YAYPEFZFNXKIET-YSZBQJHXSA-N 0 3 402.579 4.203 20 0 HIADHN CC(C)(CNC(=O)N1CCC[C@H]1c1ccc2c(c1)OCO2)N1CCc2ccccc2C1 ZINC000477755419 892846352 /nfs/dbraw/zinc/84/63/52/892846352.db2.gz SXTAJDWJPMSHDI-NRFANRHFSA-N 0 3 421.541 4.099 20 0 HIADHN CN(Cc1nc(-c2ccccc2)c[nH]1)C(=O)NCC(C)(C)N1CCc2ccccc2C1 ZINC000477809784 892881050 /nfs/dbraw/zinc/88/10/50/892881050.db2.gz AZDZGZLXKWWNFO-UHFFFAOYSA-N 0 3 417.557 4.055 20 0 HIADHN O=C(NCc1csc(-c2ccco2)n1)NC[C@@H]1CCCCN1Cc1ccccc1 ZINC000477835467 892896424 /nfs/dbraw/zinc/89/64/24/892896424.db2.gz RJYXYKCRVQJZDT-IBGZPJMESA-N 0 3 410.543 4.257 20 0 HIADHN C[C@@H](NC(=O)N[C@@H](CN(C)C)c1ccc(F)cc1)c1nc2ccccc2n1C(F)F ZINC000477849539 892909813 /nfs/dbraw/zinc/90/98/13/892909813.db2.gz TXFVDZGOGBMCSW-DYVFJYSZSA-N 0 3 419.451 4.234 20 0 HIADHN COc1cc(CN(C)C(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)ccc1SC ZINC000477879691 892942648 /nfs/dbraw/zinc/94/26/48/892942648.db2.gz OPPOOZUWBVSSSW-LJQANCHMSA-N 0 3 416.562 4.427 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)N[C@@H]1CCC[C@H]1c1ccccc1 ZINC000477903502 892973642 /nfs/dbraw/zinc/97/36/42/892973642.db2.gz CNSVQRBCWLUHMR-SIKLNZKXSA-N 0 3 401.501 4.374 20 0 HIADHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)N[C@H]1CCC[C@@H]1c1ccccc1 ZINC000477903501 892974211 /nfs/dbraw/zinc/97/42/11/892974211.db2.gz CNSVQRBCWLUHMR-KNQAVFIVSA-N 0 3 401.501 4.374 20 0 HIADHN Cc1ccc(CN2CC[C@H](N[C@@H](C)CC(=O)Nc3ccc(C(C)C)cc3)C2=O)cc1 ZINC000477917628 893002959 /nfs/dbraw/zinc/00/29/59/893002959.db2.gz NVOGZRNGVNYKLR-CVDCTZTESA-N 0 3 407.558 4.226 20 0 HIADHN C[C@@H](N[C@H]1CCN(Cc2ccc(F)cc2)C1=O)c1ccc(OCC(F)(F)F)cc1 ZINC000477924261 893011974 /nfs/dbraw/zinc/01/19/74/893011974.db2.gz YPCKPGGEKPAHFN-KUHUBIRLSA-N 0 3 410.411 4.219 20 0 HIADHN CC(C)c1ccccc1NC(=O)C[C@@H](C)N[C@H]1CCN(Cc2ccc(F)cc2)C1=O ZINC000477927286 893015060 /nfs/dbraw/zinc/01/50/60/893015060.db2.gz MXPWXDQIBMIKTK-VGSWGCGISA-N 0 3 411.521 4.057 20 0 HIADHN Cc1cc(NC(=O)NCC2(C(F)(F)F)CC2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000477936423 893026771 /nfs/dbraw/zinc/02/67/71/893026771.db2.gz HWILULROYGMYJP-QGZVFWFLSA-N 0 3 421.467 4.103 20 0 HIADHN CN(C(=O)N[C@H]1CCC[C@H]1c1ccccc1)C1CCN(CCc2ccccn2)CC1 ZINC000477947081 893037441 /nfs/dbraw/zinc/03/74/41/893037441.db2.gz ZFBHWYTWJNWSAA-ZEQRLZLVSA-N 0 3 406.574 4.066 20 0 HIADHN COCCN1CCC(NC(=O)Nc2c(C)cc(Br)c3ccccc32)CC1 ZINC000477978759 893076648 /nfs/dbraw/zinc/07/66/48/893076648.db2.gz WHLLXGLPHDVGOI-UHFFFAOYSA-N 0 3 420.351 4.143 20 0 HIADHN C[C@@H]1CN(Cc2ccc(C(=O)Nc3ccc(CN(C)C)c(Cl)c3)cc2)C[C@@H](C)O1 ZINC000478032744 893162510 /nfs/dbraw/zinc/16/25/10/893162510.db2.gz XWFUBBMJEIPBSN-IAGOWNOFSA-N 0 3 415.965 4.263 20 0 HIADHN CN(C)C[C@H](NC(=O)Nc1ccn(-c2ccccc2Cl)n1)c1ccc(F)cc1 ZINC000478046591 893191087 /nfs/dbraw/zinc/19/10/87/893191087.db2.gz LOJGFTVSNCOVQI-KRWDZBQOSA-N 0 3 401.873 4.089 20 0 HIADHN O=C(NC1CCN(Cc2ccccc2)CC1)c1cccnc1OCc1ccccc1F ZINC000478067591 893227915 /nfs/dbraw/zinc/22/79/15/893227915.db2.gz ZFVKGBHKZJZEEU-UHFFFAOYSA-N 0 3 419.500 4.194 20 0 HIADHN CCCN(C(=O)Cc1c(C)nn(C(F)F)c1C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000505005991 913749151 /nfs/dbraw/zinc/74/91/51/913749151.db2.gz PJWPVIORPKBZLN-FQEVSTJZSA-N 0 3 418.532 4.341 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1nnn(-c2ccccc2Cl)c1C)c1ccsc1 ZINC000505026702 913768794 /nfs/dbraw/zinc/76/87/94/913768794.db2.gz JYWOLMGJDAMWMD-SFHVURJKSA-N 0 3 417.966 4.104 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)N[C@H]2CCSc3ccc(F)cc32)c1 ZINC000478297661 893513369 /nfs/dbraw/zinc/51/33/69/893513369.db2.gz PQDDUCRHEWLRAU-FQEVSTJZSA-N 0 3 417.550 4.145 20 0 HIADHN CCCN(CCN(C)C)C(=O)C[C@H](NC(=O)c1ccccc1Cl)c1ccccc1 ZINC000478433489 893734692 /nfs/dbraw/zinc/73/46/92/893734692.db2.gz PMIHPXGDDFAIDX-NRFANRHFSA-N 0 3 415.965 4.001 20 0 HIADHN CN1C[C@@H](c2ccccc2)[C@H](NC(=O)CCc2ncc(-c3ccccc3Cl)o2)C1 ZINC000478453017 893770265 /nfs/dbraw/zinc/77/02/65/893770265.db2.gz SGWGSXOTWHFIFU-AZUAARDMSA-N 0 3 409.917 4.142 20 0 HIADHN CN(Cc1nc(-c2ccccc2)c[nH]1)C(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000478508828 893819878 /nfs/dbraw/zinc/81/98/78/893819878.db2.gz RNHWSMRAMYDUAP-HXUWFJFHSA-N 0 3 406.505 4.086 20 0 HIADHN O=C(NC[C@@H]1CCCCN1Cc1ccccc1)N1CC2(CCOCC2)c2ccccc21 ZINC000478528855 893832539 /nfs/dbraw/zinc/83/25/39/893832539.db2.gz LOJLHSZPPSGAER-QFIPXVFZSA-N 0 3 419.569 4.319 20 0 HIADHN CCCN(CCN(C)C)C(=O)Cc1ccc(NC(=O)c2cc3ccccc3o2)cc1 ZINC000478531966 893834574 /nfs/dbraw/zinc/83/45/74/893834574.db2.gz XONQWCAVAWWEMR-UHFFFAOYSA-N 0 3 407.514 4.028 20 0 HIADHN CCc1c(C(=O)Nc2ccc(CN3CCN(CC)CC3)cc2)cnn1C(CC)CC ZINC000478679545 893933576 /nfs/dbraw/zinc/93/35/76/893933576.db2.gz WPDMLTYSZSGPET-UHFFFAOYSA-N 0 3 411.594 4.196 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)N[C@H](C)c2cccc(OC(F)F)c2)c1 ZINC000478767097 894041791 /nfs/dbraw/zinc/04/17/91/894041791.db2.gz PHYKCTCMELVABM-MRXNPFEDSA-N 0 3 421.488 4.131 20 0 HIADHN Cc1c2ccccc2oc1[C@@H](C)NC(=O)NCc1ccc(CN2CCN(C)CC2)cc1 ZINC000478786857 894062492 /nfs/dbraw/zinc/06/24/92/894062492.db2.gz LTMCXHKDFGKZFK-LJQANCHMSA-N 0 3 420.557 4.049 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1cc(Br)cc(OC)c1)c1ccco1 ZINC000478927182 894207464 /nfs/dbraw/zinc/20/74/64/894207464.db2.gz GBTRMXVRNASPHV-LRDDRELGSA-N 0 3 410.312 4.302 20 0 HIADHN NC(=O)[C@@H](NCCCc1cccc(C(F)(F)F)c1)c1cccc(Br)c1 ZINC000479017483 894282915 /nfs/dbraw/zinc/28/29/15/894282915.db2.gz WUXXIKQPEKQTFO-INIZCTEOSA-N 0 3 415.253 4.217 20 0 HIADHN CCS[C@@H]1CCC[C@@H](N[C@H](C)c2cc(S(N)(=O)=O)c(Cl)cc2Cl)C1 ZINC000479058977 894318466 /nfs/dbraw/zinc/31/84/66/894318466.db2.gz KWYNZFPBNXTBML-IJLUTSLNSA-N 0 3 411.420 4.356 20 0 HIADHN C[C@H](NCCOc1ccccc1Br)c1ccc(Br)cn1 ZINC000479060148 894319934 /nfs/dbraw/zinc/31/99/34/894319934.db2.gz LONLXCQUOIIQDY-NSHDSACASA-N 0 3 400.114 4.336 20 0 HIADHN CCS[C@@H]1CCCC[C@H]1N[C@@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479064516 894326655 /nfs/dbraw/zinc/32/66/55/894326655.db2.gz FQHWLULFNPVDEV-COLVAYQJSA-N 0 3 411.420 4.356 20 0 HIADHN CCC[C@@H](N[C@H]1CCc2cc(OC)c(OC)cc21)C(=O)N1CCc2sccc2C1 ZINC000479065588 894328729 /nfs/dbraw/zinc/32/87/29/894328729.db2.gz UWXIWPSRVILZQD-RBUKOAKNSA-N 0 3 414.571 4.096 20 0 HIADHN CC1CCN([C@H](CNC(=O)[C@@H](CO)c2ccc(Cl)cc2)c2cccs2)CC1 ZINC000505170049 913858575 /nfs/dbraw/zinc/85/85/75/913858575.db2.gz ZCYOJLVVCQKCDY-RBUKOAKNSA-N 0 3 406.979 4.067 20 0 HIADHN Fc1cc(Br)ccc1[C@H](NCc1cccc(-n2cncn2)c1)C1CC1 ZINC000479073157 894338765 /nfs/dbraw/zinc/33/87/65/894338765.db2.gz DBSPPSHKUBALMZ-LJQANCHMSA-N 0 3 401.283 4.410 20 0 HIADHN Cc1ccc([C@H](C)CN[C@H](C)c2cc(S(N)(=O)=O)c(Cl)cc2Cl)cc1 ZINC000479077499 894342026 /nfs/dbraw/zinc/34/20/26/894342026.db2.gz MDUIHZDVBSVZJX-CHWSQXEVSA-N 0 3 401.359 4.404 20 0 HIADHN Cc1ccc(C[C@H](C)N[C@@H](C)c2cc(S(N)(=O)=O)c(Cl)cc2Cl)s1 ZINC000479078963 894343298 /nfs/dbraw/zinc/34/32/98/894343298.db2.gz OWGKFIXVIKGCTH-ONGXEEELSA-N 0 3 407.388 4.293 20 0 HIADHN Cc1ccc(C[C@H](C)N[C@H](C)c2cc(S(N)(=O)=O)c(Cl)cc2Cl)s1 ZINC000479078960 894343670 /nfs/dbraw/zinc/34/36/70/894343670.db2.gz OWGKFIXVIKGCTH-GXSJLCMTSA-N 0 3 407.388 4.293 20 0 HIADHN Cc1cc(C)c(S(N)(=O)=O)cc1[C@H](C)N[C@H](C)c1ccc(-c2ccncc2)cc1 ZINC000479079491 894346098 /nfs/dbraw/zinc/34/60/98/894346098.db2.gz QCQIUJUTHVVSOJ-MSOLQXFVSA-N 0 3 409.555 4.425 20 0 HIADHN O=C(Nc1cccc(NC(=O)[C@H]2CN(Cc3ccccc3)CCC2(F)F)c1)C1CC1 ZINC000505198683 913877726 /nfs/dbraw/zinc/87/77/26/913877726.db2.gz XPZDCMMXHQLNSG-HXUWFJFHSA-N 0 3 413.468 4.131 20 0 HIADHN C[C@@H](Cc1ccc(Br)cc1)NCc1nnc2ccc(C(F)(F)F)cn21 ZINC000479267988 894541044 /nfs/dbraw/zinc/54/10/44/894541044.db2.gz YIOHLWBKMOUNFX-NSHDSACASA-N 0 3 413.241 4.231 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)N[C@H]2C[C@@H]2c2c(F)cccc2Cl)c1 ZINC000479316962 894604776 /nfs/dbraw/zinc/60/47/76/894604776.db2.gz LXSCHYFBAUHMJR-PXNSSMCTSA-N 0 3 419.928 4.117 20 0 HIADHN Cc1c2ccccc2oc1[C@H](C)NC(=O)N1CCC(CN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000479363841 894663862 /nfs/dbraw/zinc/66/38/62/894663862.db2.gz VKNNGDNNOPXUCF-LNLFQRSKSA-N 0 3 413.562 4.333 20 0 HIADHN COC(=O)c1ccc(CN[C@@H]2CCCc3cc(Br)ccc32)cc1OC ZINC000479403046 894706709 /nfs/dbraw/zinc/70/67/09/894706709.db2.gz WWXQRHCKDUFERB-GOSISDBHSA-N 0 3 404.304 4.412 20 0 HIADHN CCCN1CCN(c2ccccc2CNCc2nc3cccc(Cl)c3n2C)CC1 ZINC000479411193 894716760 /nfs/dbraw/zinc/71/67/60/894716760.db2.gz BARNWBWLRBHKFO-UHFFFAOYSA-N 0 3 411.981 4.049 20 0 HIADHN O=C1[C@@H](N[C@@H]2CCCc3cc(Br)ccc32)CCCN1Cc1ccccn1 ZINC000479447136 894765616 /nfs/dbraw/zinc/76/56/16/894765616.db2.gz CGMYRLXUZCPLEZ-UXHICEINSA-N 0 3 414.347 4.002 20 0 HIADHN COc1ccc([C@H](CCO)N[C@H](C)c2ccc(I)cc2)cc1 ZINC000479484404 894807036 /nfs/dbraw/zinc/80/70/36/894807036.db2.gz HZCCLZCAKJRPGW-ACJLOTCBSA-N 0 3 411.283 4.074 20 0 HIADHN COC(=O)[C@H](NC1CCN([C@H](C)c2ccncc2)CC1)c1ccc(Cl)c(Cl)c1 ZINC000479487634 894809699 /nfs/dbraw/zinc/80/96/99/894809699.db2.gz HVQKOYMYCVJRFG-JLTOFOAXSA-N 0 3 422.356 4.418 20 0 HIADHN CCOC(=O)[C@@H](NC1CCN([C@@H](C)c2ccncc2)CC1)c1cccc(Cl)c1 ZINC000479492460 894812162 /nfs/dbraw/zinc/81/21/62/894812162.db2.gz VMVQFXAJTYNSCZ-KKSFZXQISA-N 0 3 401.938 4.154 20 0 HIADHN C[C@H](NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1ncc(Br)s1 ZINC000479502591 894819544 /nfs/dbraw/zinc/81/95/44/894819544.db2.gz PRTPVLCCPCGQMX-GCVQQVDUSA-N 0 3 412.319 4.362 20 0 HIADHN CCN(CC)C(=O)Nc1ccc([C@H](C)N[C@H](C)C(=O)N2Cc3ccccc3C2)cc1 ZINC000479530752 894837640 /nfs/dbraw/zinc/83/76/40/894837640.db2.gz WRVIMJHSLAHUTL-ZWKOTPCHSA-N 0 3 408.546 4.142 20 0 HIADHN CCc1nc2c(s1)[C@H](N(C)C(=O)NC[C@H]1CCCN1Cc1ccccc1)CCC2 ZINC000479547172 894847695 /nfs/dbraw/zinc/84/76/95/894847695.db2.gz XWALPSCPQKXOSF-UYAOXDASSA-N 0 3 412.603 4.389 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NC[C@@H]3CCC4(CCCCC4)O3)c(C)c2)CC1 ZINC000479574999 894867622 /nfs/dbraw/zinc/86/76/22/894867622.db2.gz BRZILFSUJBXTAA-NRFANRHFSA-N 0 3 414.594 4.140 20 0 HIADHN O=S(=O)([N-]c1ccc(CC[NH+]2CCCC2)cc1)c1ccc(CC(F)(F)F)cc1 ZINC000479601385 894879393 /nfs/dbraw/zinc/87/93/93/894879393.db2.gz UPPGJPNMQXTUQN-UHFFFAOYSA-N 0 3 412.477 4.231 20 0 HIADHN Cc1cccc2nc(CN(Cc3ccc4c(c3)OCO4)C3CCCCC3)cc(=O)n12 ZINC000479619952 894888912 /nfs/dbraw/zinc/88/89/12/894888912.db2.gz YUPKBXQAWPKRND-UHFFFAOYSA-N 0 3 405.498 4.067 20 0 HIADHN C[C@@H](CN(C(=O)N[C@@H](CN1CCCC1)c1ccccc1)[C@@H](C)CO)c1ccccc1 ZINC000479758163 895056857 /nfs/dbraw/zinc/05/68/57/895056857.db2.gz RSHJDXVGXAMOND-HFMPRLQTSA-N 0 3 409.574 4.020 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N[C@H](C)c1cc(OC)c(OC)cc1C)c1ccco1 ZINC000479778476 895080516 /nfs/dbraw/zinc/08/05/16/895080516.db2.gz BFCAWDKIXHTLIT-JZXOWHBKSA-N 0 3 403.523 4.095 20 0 HIADHN COc1ccc(CN2CCCN(Cc3cn(C)nc3-c3ccccc3Cl)CC2)cc1 ZINC000505278708 913935714 /nfs/dbraw/zinc/93/57/14/913935714.db2.gz ZFNKMCVSYRXPPI-UHFFFAOYSA-N 0 3 424.976 4.457 20 0 HIADHN C[C@H](NC(=O)N[C@H]1CCN(Cc2ccccc2)[C@@H]1C)c1ccc(NC(=O)C2CC2)cc1 ZINC000479819191 895133640 /nfs/dbraw/zinc/13/36/40/895133640.db2.gz SGORATXMNXFJMN-IXFSTUDKSA-N 0 3 420.557 4.058 20 0 HIADHN CCOC(=O)c1cc(NC[C@@H](c2ccc(OC)cc2)N2CCCC2)ncc1Cl ZINC000479849205 895181867 /nfs/dbraw/zinc/18/18/67/895181867.db2.gz PSOJMKZBKUHOLU-IBGZPJMESA-N 0 3 403.910 4.169 20 0 HIADHN C[C@@H](NCc1ccc(CN2CCOCC2)cc1)c1ccc(F)c(Br)c1 ZINC000479886683 895232897 /nfs/dbraw/zinc/23/28/97/895232897.db2.gz QDNDTQZJUJKTBM-OAHLLOKOSA-N 0 3 407.327 4.271 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCC3(CCOC)CCCCC3)c(C)c2)CC1 ZINC000479960661 895313542 /nfs/dbraw/zinc/31/35/42/895313542.db2.gz GPRTZVGBCOGSLV-UHFFFAOYSA-N 0 3 416.610 4.245 20 0 HIADHN CC[C@@H](C)n1ncc(C(=O)NC2CCN(CCOc3ccc(Cl)cc3)CC2)c1C ZINC000480005405 895357242 /nfs/dbraw/zinc/35/72/42/895357242.db2.gz HKXCYMWUODMRDK-MRXNPFEDSA-N 0 3 418.969 4.089 20 0 HIADHN CCN1CCN(C[C@@H](C)CNC(=O)C(C)(C)c2ccc(-c3ccccc3)cc2)CC1 ZINC000505303193 913962580 /nfs/dbraw/zinc/96/25/80/913962580.db2.gz FXVFODJXDLDONF-NRFANRHFSA-N 0 3 407.602 4.021 20 0 HIADHN CCCc1c(NC(=O)NC[C@H](N[C@H](C)CC)c2ccco2)cnn1-c1cc(C)ccn1 ZINC000480077481 895430390 /nfs/dbraw/zinc/43/03/90/895430390.db2.gz LETSMJKJZOLUDB-MJGOQNOKSA-N 0 3 424.549 4.372 20 0 HIADHN COc1ccc([C@@H](CN[C@H](C)c2cc(OC)c(OC)cc2F)N2CCCC2)cc1 ZINC000480087505 895448535 /nfs/dbraw/zinc/44/85/35/895448535.db2.gz XEZOSUDUUHJXDB-IIBYNOLFSA-N 0 3 402.510 4.339 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)Nc1cc2c(cc1Cl)OCCO2 ZINC000480152240 895536787 /nfs/dbraw/zinc/53/67/87/895536787.db2.gz BPUAWHVQXSRDEN-UHFFFAOYSA-N 0 3 417.937 4.140 20 0 HIADHN C[C@@H](NCc1cc(C(F)(F)F)ccc1N1CCN(C)CC1)c1ccc(Cl)cn1 ZINC000480167921 895558369 /nfs/dbraw/zinc/55/83/69/895558369.db2.gz JFPALLRSZNSENF-CQSZACIVSA-N 0 3 412.887 4.356 20 0 HIADHN C[C@@H](CN[C@H]1CCS(=O)(=O)c2ccc(Br)cc21)Cc1cccs1 ZINC000480189759 895584787 /nfs/dbraw/zinc/58/47/87/895584787.db2.gz JTKCYQQIJBBWGZ-WBMJQRKESA-N 0 3 414.390 4.198 20 0 HIADHN C[C@H](CN[C@@H]1CCS(=O)(=O)c2ccc(Br)cc21)Cc1cccs1 ZINC000480189756 895586122 /nfs/dbraw/zinc/58/61/22/895586122.db2.gz JTKCYQQIJBBWGZ-BLLLJJGKSA-N 0 3 414.390 4.198 20 0 HIADHN CCN(CC)C(=O)c1ccc(CN[C@H](C)c2cc(OC)c(OC)c(OC)c2)cc1 ZINC000480218140 895622463 /nfs/dbraw/zinc/62/24/63/895622463.db2.gz NTAVFROTXHJWRA-MRXNPFEDSA-N 0 3 400.519 4.045 20 0 HIADHN O=S1(=O)CC[C@@H](NCCc2ccccc2Cl)c2cc(Br)ccc21 ZINC000480218854 895622660 /nfs/dbraw/zinc/62/26/60/895622660.db2.gz DGBGSKZZXQLEHC-MRXNPFEDSA-N 0 3 414.752 4.153 20 0 HIADHN C[C@H](NC[C@@H](c1ccc(C(F)(F)F)cc1)N1CCOCC1)c1ccc(Cl)cn1 ZINC000480244657 895654420 /nfs/dbraw/zinc/65/44/20/895654420.db2.gz YFAXWWDWJQQADA-LIRRHRJNSA-N 0 3 413.871 4.478 20 0 HIADHN O=S1(=O)CC[C@@H](NCCCc2cccc(F)c2)c2cc(Br)ccc21 ZINC000480264771 895672337 /nfs/dbraw/zinc/67/23/37/895672337.db2.gz WWQRFNVAJFMYQT-QGZVFWFLSA-N 0 3 412.324 4.029 20 0 HIADHN O=S1(=O)CC[C@H](NCCCc2cccc(F)c2)c2cc(Br)ccc21 ZINC000480264768 895672401 /nfs/dbraw/zinc/67/24/01/895672401.db2.gz WWQRFNVAJFMYQT-KRWDZBQOSA-N 0 3 412.324 4.029 20 0 HIADHN CCCc1c(NC(=O)N[C@H](CN(C)C)c2ccc(F)cc2)cnn1-c1ccccc1 ZINC000480272697 895680998 /nfs/dbraw/zinc/68/09/98/895680998.db2.gz YHCRYVXIPHVYCH-OAQYLSRUSA-N 0 3 409.509 4.388 20 0 HIADHN COCCN(C)c1ccc(CNC2(c3ccc(Br)cc3)CCC2)cn1 ZINC000480366121 895773158 /nfs/dbraw/zinc/77/31/58/895773158.db2.gz QYVIQCMLCOHRIY-UHFFFAOYSA-N 0 3 404.352 4.096 20 0 HIADHN Cc1ccc([C@@H](CN[C@H](C)c2cc(Br)ccc2F)N2CCOCC2)o1 ZINC000480385224 895790545 /nfs/dbraw/zinc/79/05/45/895790545.db2.gz GJAFKSOJYLIDDK-RDTXWAMCSA-N 0 3 411.315 4.214 20 0 HIADHN COc1ccc(Br)c(C(=O)NCCCNCc2ccsc2Cl)c1 ZINC000480393250 895798897 /nfs/dbraw/zinc/79/88/97/895798897.db2.gz YGSMWPRSYLGIFR-UHFFFAOYSA-N 0 3 417.756 4.082 20 0 HIADHN Cc1ccc2c(c1C)OC[C@@H]2NC(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000480439769 895830314 /nfs/dbraw/zinc/83/03/14/895830314.db2.gz XJNPFPALMALHPJ-NRFANRHFSA-N 0 3 411.571 4.150 20 0 HIADHN CCCOc1ccc(C(=O)N[C@H](C)C2=CCN(C)CC2)c(OCc2ccccc2)c1 ZINC000480551064 895911735 /nfs/dbraw/zinc/91/17/35/895911735.db2.gz GTRGKMMLYDCLEC-LJQANCHMSA-N 0 3 408.542 4.435 20 0 HIADHN CC[C@@H](C)n1nc(NC(=O)Nc2ccc(CCN3CCSCC3)cc2)cc1C ZINC000480645574 896013985 /nfs/dbraw/zinc/01/39/85/896013985.db2.gz LNWWPILUGGNAAG-MRXNPFEDSA-N 0 3 401.580 4.398 20 0 HIADHN FC(F)(F)c1ccc(N2CCC(NCc3ccc(Br)o3)CC2)nc1 ZINC000480653744 896020921 /nfs/dbraw/zinc/02/09/21/896020921.db2.gz PMZDRUUUJYNSQI-UHFFFAOYSA-N 0 3 404.230 4.215 20 0 HIADHN Cn1cc([C@@H](NC2CCC3(CC2)C(=O)Nc2ccccc23)c2ccc(F)cc2)cn1 ZINC000480678498 896041318 /nfs/dbraw/zinc/04/13/18/896041318.db2.gz HQFWCVXTNJFKKB-GJFCNDCISA-N 0 3 404.489 4.071 20 0 HIADHN CC(C)[C@@H](NCc1ccc(N2CCCS2(=O)=O)c(F)c1)c1ccc(F)c(F)c1 ZINC000480690920 896053049 /nfs/dbraw/zinc/05/30/49/896053049.db2.gz DARQELDOISKCJQ-HXUWFJFHSA-N 0 3 412.477 4.131 20 0 HIADHN CN1CCN(c2cc(CN[C@@H]3CCCc4nc(-c5ccccc5)sc43)ccn2)CC1 ZINC000480691472 896054173 /nfs/dbraw/zinc/05/41/73/896054173.db2.gz BTIANDFJWLXRPN-HXUWFJFHSA-N 0 3 419.598 4.124 20 0 HIADHN CCOc1cccc(CN[C@@H](C)c2ccc(S(=O)(=O)N3CCCCC3)cc2)c1 ZINC000480702823 896063674 /nfs/dbraw/zinc/06/36/74/896063674.db2.gz XSXQLMZWFOBBRC-SFHVURJKSA-N 0 3 402.560 4.111 20 0 HIADHN COCCOc1ccc([C@H](C)N[C@H](C)c2cccc(N3CCCC3=O)c2)cc1OC ZINC000480713401 896074514 /nfs/dbraw/zinc/07/45/14/896074514.db2.gz XQXVFXVDFVKFOX-MSOLQXFVSA-N 0 3 412.530 4.259 20 0 HIADHN C[C@@H](NCc1ccc(N2CCC(C)CC2)nc1)c1ccc(NC(=O)NC2CC2)cc1 ZINC000480722305 896083571 /nfs/dbraw/zinc/08/35/71/896083571.db2.gz ORRDLIKTJSSHAQ-GOSISDBHSA-N 0 3 407.562 4.453 20 0 HIADHN COc1cc([C@H](C)N[C@H](C)c2ccc(-n3cnnn3)cc2)ccc1OC1CCCC1 ZINC000480731710 896092369 /nfs/dbraw/zinc/09/23/69/896092369.db2.gz CQNYTISMZPMSKO-SJORKVTESA-N 0 3 407.518 4.404 20 0 HIADHN CC[C@@H](NCc1ccc(N2CCN(CC)CC2)nc1)c1ccccc1Br ZINC000480735427 896095471 /nfs/dbraw/zinc/09/54/71/896095471.db2.gz FPCDGBULXCPVPZ-HXUWFJFHSA-N 0 3 417.395 4.227 20 0 HIADHN COc1cc(NC(=O)N[C@H](CN(C)C)c2ccc(F)cc2)cc(OC)c1C(C)C ZINC000480748153 896109076 /nfs/dbraw/zinc/10/90/76/896109076.db2.gz KYZROAITPWOBKH-GOSISDBHSA-N 0 3 403.498 4.391 20 0 HIADHN C[C@@H](NCc1ccc(OCc2ccccc2F)nc1)c1ccc(-n2cncn2)cc1 ZINC000480884317 896240967 /nfs/dbraw/zinc/24/09/67/896240967.db2.gz XFYBUHGPIHJRGS-QGZVFWFLSA-N 0 3 403.461 4.231 20 0 HIADHN C[C@@H](NCc1cccc(Cn2cccn2)c1)c1ccc(OCc2nccn2C)cc1 ZINC000480888204 896244780 /nfs/dbraw/zinc/24/47/80/896244780.db2.gz XDZYISSOCOGJIK-LJQANCHMSA-N 0 3 401.514 4.095 20 0 HIADHN Cc1cc(C)c([C@@H](C)NCc2cccc(NC(=O)CCN3CCOCC3)c2)cc1C ZINC000480887330 896244886 /nfs/dbraw/zinc/24/48/86/896244886.db2.gz ULGGAEFCSPGLSZ-OAQYLSRUSA-N 0 3 409.574 4.123 20 0 HIADHN C[C@H](NCCNC(=O)c1ccc(Br)cc1)c1cnc2ccsc2c1 ZINC000480907492 896263796 /nfs/dbraw/zinc/26/37/96/896263796.db2.gz GMHZZUXOTPHKSI-LBPRGKRZSA-N 0 3 404.333 4.139 20 0 HIADHN Cc1ccc(CN2CC[C@H](NCc3ccc(Br)c4cccnc34)C2=O)cc1 ZINC000480911773 896267932 /nfs/dbraw/zinc/26/79/32/896267932.db2.gz RAMSDFRCXWDXLP-FQEVSTJZSA-N 0 3 424.342 4.196 20 0 HIADHN C[C@@H](NCc1cccc(Cn2cccn2)c1)c1ccc(I)cc1 ZINC000480912051 896269851 /nfs/dbraw/zinc/26/98/51/896269851.db2.gz QTYCRBVHWYICBW-OAHLLOKOSA-N 0 3 417.294 4.387 20 0 HIADHN O=S(=O)(CCO)c1ccc(CNCc2ccc(-c3ccccc3Cl)s2)cc1 ZINC000480915250 896274426 /nfs/dbraw/zinc/27/44/26/896274426.db2.gz XNCVROWXCVINKD-UHFFFAOYSA-N 0 3 421.971 4.124 20 0 HIADHN CC(C)NC(=O)Nc1ccc(CN[C@@H](C)c2ccc(OCc3nccn3C)cc2)cc1 ZINC000480920788 896279403 /nfs/dbraw/zinc/27/94/03/896279403.db2.gz NBVUONYSABAVQR-SFHVURJKSA-N 0 3 421.545 4.380 20 0 HIADHN CNS(=O)(=O)c1cccc([C@H](C)NCCSCc2cccc3ccccc32)c1 ZINC000481032499 896358803 /nfs/dbraw/zinc/35/88/03/896358803.db2.gz FBSRNJQWGGQPNE-KRWDZBQOSA-N 0 3 414.596 4.332 20 0 HIADHN COc1ccc([C@@H](Cc2ccccc2C)N[C@H]2CCCN(C(C)C)C2=O)cc1OC ZINC000481064553 896386043 /nfs/dbraw/zinc/38/60/43/896386043.db2.gz VJBVFEPFCDODBU-FCHUYYIVSA-N 0 3 410.558 4.285 20 0 HIADHN CCCCN1Cc2cccc(N[C@H]3CCN(c4cc(OC)cc(OC)c4)C3=O)c2C1 ZINC000481080588 896401043 /nfs/dbraw/zinc/40/10/43/896401043.db2.gz YBALDVPOFOLXEV-QHCPKHFHSA-N 0 3 409.530 4.037 20 0 HIADHN CCOc1ccc([C@@H](CC)N[C@@H](C)c2ccc(S(=O)(=O)NC)cc2)cc1OCC ZINC000481182785 896525521 /nfs/dbraw/zinc/52/55/21/896525521.db2.gz QEGIIWDOQXXZJI-OXJNMPFZSA-N 0 3 420.575 4.194 20 0 HIADHN Cc1nn(C)c(=O)c(-c2nc(CN[C@@H]3CCCC[C@H]3Cc3ccccc3)cs2)c1C ZINC000481183529 896527147 /nfs/dbraw/zinc/52/71/47/896527147.db2.gz QXWYDHGZZIDDLS-PZJWPPBQSA-N 0 3 422.598 4.412 20 0 HIADHN CCOC(=O)[C@]1(Cc2ccccc2)CCCN1C(=O)c1cccc(CN2CCCC2)c1 ZINC000481185079 896530991 /nfs/dbraw/zinc/53/09/91/896530991.db2.gz DECZKEDKQOXIBM-AREMUKBSSA-N 0 3 420.553 4.063 20 0 HIADHN COc1cc([C@@H](C)N[C@H](C)c2ccc(Br)s2)ccc1OCCO ZINC000481191282 896543528 /nfs/dbraw/zinc/54/35/28/896543528.db2.gz QMDPYUZHYHNTFO-VXGBXAGGSA-N 0 3 400.338 4.302 20 0 HIADHN O=C(CN[C@@H](CC1CCC1)c1ccccc1)NCC1(c2ccccc2)CCOCC1 ZINC000481221890 896572793 /nfs/dbraw/zinc/57/27/93/896572793.db2.gz CQFGBRGODMVODK-DEOSSOPVSA-N 0 3 406.570 4.372 20 0 HIADHN C[C@@H](N[C@@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O)c1ccc(-n2cncn2)cc1 ZINC000481235029 896585302 /nfs/dbraw/zinc/58/53/02/896585302.db2.gz JNLYMSRNAFAABZ-BFUOFWGJSA-N 0 3 416.312 4.030 20 0 HIADHN Cc1nc(-c2cc([C@@H](C)NCc3cccc(OCC(=O)N(C)C)c3)cs2)cs1 ZINC000481294866 896639738 /nfs/dbraw/zinc/63/97/38/896639738.db2.gz MFVIBERPKBYCJZ-CQSZACIVSA-N 0 3 415.584 4.498 20 0 HIADHN C[C@H](N[C@@H]1CC2(CCC2)Oc2ccccc21)c1ccc(OCC(=O)NC2CC2)cc1 ZINC000481309956 896656247 /nfs/dbraw/zinc/65/62/47/896656247.db2.gz SLRGIDZHSUEHOK-HTAPYJJXSA-N 0 3 406.526 4.441 20 0 HIADHN CC[C@H](N[C@H]1CCc2c1cccc2OC)c1ccccc1OCC(=O)N1CCCC1 ZINC000481312282 896659878 /nfs/dbraw/zinc/65/98/78/896659878.db2.gz HNSDANONRDALLT-VXKWHMMOSA-N 0 3 408.542 4.425 20 0 HIADHN COc1cccc([C@@H](C)NCc2ccnc(N3CCN(c4ccc(F)cc4)CC3)c2)c1 ZINC000481314285 896662084 /nfs/dbraw/zinc/66/20/84/896662084.db2.gz BSUUMDCBSYWVFS-LJQANCHMSA-N 0 3 420.532 4.407 20 0 HIADHN CN(C)C(=O)COc1cccc(CN[C@@H]2CCCc3nc(-c4ccccc4)sc32)c1 ZINC000481320937 896675743 /nfs/dbraw/zinc/67/57/43/896675743.db2.gz NWBABRPANWAACZ-HXUWFJFHSA-N 0 3 421.566 4.444 20 0 HIADHN C[C@H](N[C@@H](C)c1cccc(OCc2ccccn2)c1)c1ccc(-n2cnnn2)cc1 ZINC000481330798 896690380 /nfs/dbraw/zinc/69/03/80/896690380.db2.gz GSLKIBGZROAOKL-ROUUACIJSA-N 0 3 400.486 4.048 20 0 HIADHN CCSc1ccccc1[C@@H](C)NCc1cccc(OCCN2CCOCC2)c1 ZINC000481404839 896811482 /nfs/dbraw/zinc/81/14/82/896811482.db2.gz ONSMXWHINBPGIS-LJQANCHMSA-N 0 3 400.588 4.360 20 0 HIADHN C[C@H](NCc1cccc(OCCN2CCOCC2)c1)c1ccc(OC(F)(F)F)cc1 ZINC000481423500 896824986 /nfs/dbraw/zinc/82/49/86/896824986.db2.gz VKNOQHTXGGTVTD-KRWDZBQOSA-N 0 3 424.463 4.147 20 0 HIADHN CC(C)C[C@H](C)n1nccc1NC(=O)N(C)C1CCN(CCc2ccccn2)CC1 ZINC000481482152 896865151 /nfs/dbraw/zinc/86/51/51/896865151.db2.gz WSDBDAOWGYIIBF-IBGZPJMESA-N 0 3 412.582 4.056 20 0 HIADHN C[C@H](COc1ccccc1C(F)(F)F)N[C@H](C)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000481542191 896902007 /nfs/dbraw/zinc/90/20/07/896902007.db2.gz JOERMQRWEHKEBQ-CHWSQXEVSA-N 0 3 419.440 4.366 20 0 HIADHN C[C@H](NC[C@H](O)COc1cccc(Cl)c1Cl)c1cccc(N2CCCC2=O)c1 ZINC000481551317 896917154 /nfs/dbraw/zinc/91/71/54/896917154.db2.gz GHCVGFAPLAOLNN-YOEHRIQHSA-N 0 3 423.340 4.211 20 0 HIADHN COC[C@H](NCc1cccc(CN2CCO[C@H](C)C2)c1)c1cccc(C(F)(F)F)c1 ZINC000481550294 896917533 /nfs/dbraw/zinc/91/75/33/896917533.db2.gz CFEYEFKOLXUEQL-VGSWGCGISA-N 0 3 422.491 4.403 20 0 HIADHN COc1ccc([C@H](C)NC[C@H](O)COc2cccc(Cl)c2Cl)c(OC)c1 ZINC000481556018 896929056 /nfs/dbraw/zinc/92/90/56/896929056.db2.gz HVHDMAGMHLBMDA-STQMWFEESA-N 0 3 400.302 4.101 20 0 HIADHN CC(C)N(C)S(=O)(=O)c1ccc(CN[C@@H]2c3cccc(F)c3CC[C@@H]2C)cc1 ZINC000481560854 896935299 /nfs/dbraw/zinc/93/52/99/896935299.db2.gz XQKUFLBFPALSIM-AOMKIAJQSA-N 0 3 404.551 4.268 20 0 HIADHN Cc1cc2cc([C@@H](C)NC[C@H](O)COc3ccc4c(c3)CCC(=O)N4)oc2cc1C ZINC000481571153 896950628 /nfs/dbraw/zinc/95/06/28/896950628.db2.gz LWOLKARBNRIWSS-APWZRJJASA-N 0 3 408.498 4.025 20 0 HIADHN CN(C)Cc1cccc(NC(=O)N[C@@H]2CCN(c3ccc(Cl)c(Cl)c3)C2)c1 ZINC000481623367 897008300 /nfs/dbraw/zinc/00/83/00/897008300.db2.gz IRHQYUJYRKVASY-MRXNPFEDSA-N 0 3 407.345 4.455 20 0 HIADHN COc1ccc2c(c1)OC[C@H]2CC(=O)Nc1cc(C)cc(N2CCN(C(C)C)CC2)c1 ZINC000481631766 897015807 /nfs/dbraw/zinc/01/58/07/897015807.db2.gz TXCVBGKMZUXHKW-LJQANCHMSA-N 0 3 423.557 4.039 20 0 HIADHN Cc1cc(NC(=O)N(C)Cc2ccccc2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000481661954 897045176 /nfs/dbraw/zinc/04/51/76/897045176.db2.gz SWTXUBFLIVLTTI-QFIPXVFZSA-N 0 3 403.530 4.302 20 0 HIADHN C[C@H](OC[C@H](O)CN1CCC[C@]2(C1)OCc1ccccc12)c1ccc(Cl)cc1 ZINC000481699421 897085809 /nfs/dbraw/zinc/08/58/09/897085809.db2.gz BEERZZPKWMAPKJ-AMHTUMDSSA-N 0 3 401.934 4.300 20 0 HIADHN Cc1nc(-c2ccc(C)cc2)c(CC(=O)N[C@H]2CN(C)C[C@@H]2c2ccccc2)s1 ZINC000481739308 897133085 /nfs/dbraw/zinc/13/30/85/897133085.db2.gz HQUUEJOPLLWGLU-RTWAWAEBSA-N 0 3 405.567 4.183 20 0 HIADHN CC(C)C[C@H]1OCCC[C@H]1NCC(=O)Nc1ccc(NC(=O)c2cccs2)cc1 ZINC000481738617 897133254 /nfs/dbraw/zinc/13/32/54/897133254.db2.gz FBXDFUCFEAJFEU-RTBURBONSA-N 0 3 415.559 4.122 20 0 HIADHN Cc1nc(-c2ccc(C)cc2)c(CC(=O)N[C@H]2CN(C)C[C@H]2c2ccccc2)s1 ZINC000481739309 897133317 /nfs/dbraw/zinc/13/33/17/897133317.db2.gz HQUUEJOPLLWGLU-SFTDATJTSA-N 0 3 405.567 4.183 20 0 HIADHN CC(C)C[C@H]1OCCC[C@H]1NCC(=O)Nc1ccc(Br)cc1Cl ZINC000481760757 897148017 /nfs/dbraw/zinc/14/80/17/897148017.db2.gz KSPDBCUKMVKZGL-HZPDHXFCSA-N 0 3 403.748 4.224 20 0 HIADHN Cc1nc(-c2ccccc2C)sc1C(=O)NCC1(N2CCCCC2)CCOCC1 ZINC000481862427 897230653 /nfs/dbraw/zinc/23/06/53/897230653.db2.gz DBYJTOQHEAJHOG-UHFFFAOYSA-N 0 3 413.587 4.192 20 0 HIADHN COC(=O)c1ccc(-c2ccc(CN3CCC(C(=O)N4CCC(C)CC4)CC3)o2)cc1 ZINC000481905463 897286416 /nfs/dbraw/zinc/28/64/16/897286416.db2.gz PFHFUUWUOBFPTQ-UHFFFAOYSA-N 0 3 424.541 4.204 20 0 HIADHN COc1ccc(-c2ccncc2)cc1CN1CCC(C(=O)N2CCC(C)CC2)CC1 ZINC000481906680 897287731 /nfs/dbraw/zinc/28/77/31/897287731.db2.gz SQUHBHSBDWNQIY-UHFFFAOYSA-N 0 3 407.558 4.228 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1nnc(-c2c(F)cccc2Cl)s1 ZINC000481906911 897289734 /nfs/dbraw/zinc/28/97/34/897289734.db2.gz SFVPRTXCSXISGQ-UHFFFAOYSA-N 0 3 423.901 4.186 20 0 HIADHN CC[C@@H](N[C@@H](CC)c1ccc(Cl)c(S(=O)(=O)NC)c1)c1ccc(OC)cc1 ZINC000481912018 897294137 /nfs/dbraw/zinc/29/41/37/897294137.db2.gz IAOKLHOEHWHJKY-MOPGFXCFSA-N 0 3 410.967 4.449 20 0 HIADHN CC[C@H](NCc1cccc2cccnc21)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000481916590 897298938 /nfs/dbraw/zinc/29/89/38/897298938.db2.gz DPIYZEYKNCOUHX-SFHVURJKSA-N 0 3 403.935 4.037 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1cccc(-n2cc(C(F)(F)F)cn2)c1 ZINC000481970934 897363174 /nfs/dbraw/zinc/36/31/74/897363174.db2.gz RIXIRFSCLBTEHO-UHFFFAOYSA-N 0 3 421.423 4.080 20 0 HIADHN CC1(C)CC[C@H](NCC2(S(C)(=O)=O)CCC2)c2cc(Br)ccc21 ZINC000481992975 897387486 /nfs/dbraw/zinc/38/74/86/897387486.db2.gz QISDJHGOTHWBCB-INIZCTEOSA-N 0 3 400.382 4.119 20 0 HIADHN CC1(C)CC[C@H](NCc2ccc(N3CCCS3(=O)=O)c(F)c2)c2ccccc21 ZINC000481997664 897393289 /nfs/dbraw/zinc/39/32/89/897393289.db2.gz GKDIRXNTEPGUFO-FQEVSTJZSA-N 0 3 402.535 4.268 20 0 HIADHN COC(=O)c1ccccc1-c1ccc(CN2CCC[C@@H](CNC(=O)C(C)(C)C)C2)o1 ZINC000482005243 897403107 /nfs/dbraw/zinc/40/31/07/897403107.db2.gz JTNNDAYOWUIYDP-KRWDZBQOSA-N 0 3 412.530 4.108 20 0 HIADHN COC(=O)c1ccc(-c2ccc(CN3CCC[C@@H](CNC(=O)C(C)(C)C)C3)o2)cc1 ZINC000482007892 897404629 /nfs/dbraw/zinc/40/46/29/897404629.db2.gz QEBMGGZQHWHHCP-KRWDZBQOSA-N 0 3 412.530 4.108 20 0 HIADHN Cc1cc(NC(=O)[C@@H](C)n2cnc3ccccc32)cc(N2CCN(C(C)C)CC2)c1 ZINC000482027060 897434222 /nfs/dbraw/zinc/43/42/22/897434222.db2.gz QXVUXRVSENPMGU-LJQANCHMSA-N 0 3 405.546 4.075 20 0 HIADHN CC1(C)CN(C(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)CC[C@H]1C(F)(F)F ZINC000482034628 897449193 /nfs/dbraw/zinc/44/91/93/897449193.db2.gz QZDRIMGZYBZUMZ-FUHWJXTLSA-N 0 3 400.460 4.475 20 0 HIADHN Cc1cc(NC(=O)c2cc3c([nH]c2=O)CCCCC3)cc(N2CCN(C(C)C)CC2)c1 ZINC000482037048 897453056 /nfs/dbraw/zinc/45/30/56/897453056.db2.gz WEIVCLFQFZSITF-UHFFFAOYSA-N 0 3 422.573 4.147 20 0 HIADHN COc1ccc(OC)c([C@@H](C)N[C@H](C)CC(=O)Nc2cccc(N3CCCC3)c2)c1 ZINC000482087673 897529976 /nfs/dbraw/zinc/52/99/76/897529976.db2.gz GKIGVVBEQTWGAP-QZTJIDSGSA-N 0 3 411.546 4.372 20 0 HIADHN CC1CCN([C@H](CNC(=O)NCc2nc(C3CC3)cs2)c2cccs2)CC1 ZINC000482102617 897551446 /nfs/dbraw/zinc/55/14/46/897551446.db2.gz UJBPXFVPEOKTHZ-QGZVFWFLSA-N 0 3 404.605 4.354 20 0 HIADHN CNS(=O)(=O)c1ccc([C@@H](C)NCc2ccc(OC3CCCCC3)cc2)cc1 ZINC000482108683 897558919 /nfs/dbraw/zinc/55/89/19/897558919.db2.gz IBNHGGXCCBRFTF-QGZVFWFLSA-N 0 3 402.560 4.157 20 0 HIADHN C[C@H](NCc1ccc(NC(=O)c2ccncc2)cc1)c1cccc(N2CCCC2=O)c1 ZINC000482124202 897580694 /nfs/dbraw/zinc/58/06/94/897580694.db2.gz QYJUCJNVVDMXFE-SFHVURJKSA-N 0 3 414.509 4.312 20 0 HIADHN CC(C)N1CCN(c2ccc(C(=O)Nc3nc(-c4ccccc4F)co3)cc2)CC1 ZINC000482128020 897585984 /nfs/dbraw/zinc/58/59/84/897585984.db2.gz QCFLGEWGRKTVKJ-UHFFFAOYSA-N 0 3 408.477 4.263 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)N[C@H](c1ccc(F)cc1)C(F)(F)F ZINC000482143115 897603804 /nfs/dbraw/zinc/60/38/04/897603804.db2.gz NDBFFLHBJFOLMC-MRXNPFEDSA-N 0 3 403.445 4.264 20 0 HIADHN CN(C)[C@@H](CNC(=O)CSc1nccn1-c1cccc(Cl)c1)c1ccccc1 ZINC000482192880 897665446 /nfs/dbraw/zinc/66/54/46/897665446.db2.gz LWQWAJUPYKTDCF-IBGZPJMESA-N 0 3 414.962 4.037 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)NC[C@@H]1CCCC[C@@H]1C(F)(F)F ZINC000482218573 897698315 /nfs/dbraw/zinc/69/83/15/897698315.db2.gz UTMOVGBPAHFMSH-ICSRJNTNSA-N 0 3 411.512 4.074 20 0 HIADHN Cc1cn([C@H](C)c2ccccc2)nc1NC(=O)N[C@H](CN(C)C)c1ccc(F)cc1 ZINC000482229585 897709846 /nfs/dbraw/zinc/70/98/46/897709846.db2.gz FWWMZCNWAKNVCK-DYESRHJHSA-N 0 3 409.509 4.364 20 0 HIADHN CCC[C@H](N[C@@H](CC)c1ccc2c(c1)OCCO2)C(=O)N1CCc2sccc2C1 ZINC000482241250 897722062 /nfs/dbraw/zinc/72/20/62/897722062.db2.gz IFDACBIDTFPWEK-OALUTQOASA-N 0 3 414.571 4.314 20 0 HIADHN CC[C@H](N[C@H](C)c1cccc(S(=O)(=O)NC)c1)c1cccc(Br)c1 ZINC000482249766 897731562 /nfs/dbraw/zinc/73/15/62/897731562.db2.gz ZZIPJDSZGLHFIP-ACJLOTCBSA-N 0 3 411.365 4.159 20 0 HIADHN CCC[C@@H](N[C@@H](C)c1ccc(-n2ccnc2)cc1)C(=O)N1CCc2sccc2C1 ZINC000482253633 897734648 /nfs/dbraw/zinc/73/46/48/897734648.db2.gz RFFUYMAYLFFBGD-LAUBAEHRSA-N 0 3 408.571 4.338 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)[C@@H](C)c2ccc(Br)cc2)c1 ZINC000482361892 897879634 /nfs/dbraw/zinc/87/96/34/897879634.db2.gz MQQYMDFTYUDNIZ-INIZCTEOSA-N 0 3 419.363 4.152 20 0 HIADHN O=C(N[C@H](c1c(F)cccc1F)C(F)(F)F)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000482421843 897974433 /nfs/dbraw/zinc/97/44/33/897974433.db2.gz CLIGHADNDRIKIJ-KBXCAEBGSA-N 0 3 413.390 4.142 20 0 HIADHN CN(C)C[C@@H](NC(=O)Nc1cccc2c1CN(CC(F)(F)F)C2)c1ccc(F)cc1 ZINC000482425352 897978827 /nfs/dbraw/zinc/97/88/27/897978827.db2.gz UKCMOTQANCOOOB-LJQANCHMSA-N 0 3 424.442 4.128 20 0 HIADHN C[C@H](C1CC1)n1nccc1NC(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1 ZINC000482451055 898016944 /nfs/dbraw/zinc/01/69/44/898016944.db2.gz KHFAMFDKCJXIEQ-OAHLLOKOSA-N 0 3 423.483 4.469 20 0 HIADHN CC(=O)N[C@@H](C)C1CCN(Cc2ccc(-c3cccc(Br)c3)o2)CC1 ZINC000482499151 898078705 /nfs/dbraw/zinc/07/87/05/898078705.db2.gz DDHDLSPYRPLVRC-AWEZNQCLSA-N 0 3 405.336 4.446 20 0 HIADHN CN(C(=O)c1ccc(Oc2ccccc2)o1)C1CCN(CCc2ccccn2)CC1 ZINC000482499587 898079429 /nfs/dbraw/zinc/07/94/29/898079429.db2.gz GCDVYYSOCDTBJH-UHFFFAOYSA-N 0 3 405.498 4.246 20 0 HIADHN CC(=O)N[C@@H](C)C1CCN(Cc2cn(Cc3ccccc3)nc2-c2cccs2)CC1 ZINC000482505978 898088550 /nfs/dbraw/zinc/08/85/50/898088550.db2.gz OREGSKZXMBKMLT-SFHVURJKSA-N 0 3 422.598 4.397 20 0 HIADHN NC(=O)[C@H]1CCCN(Cc2ccccc2NC(=O)c2ccc(Oc3ccccc3)o2)C1 ZINC000482531088 898117963 /nfs/dbraw/zinc/11/79/63/898117963.db2.gz JKKOWXKQNXCIMG-SFHVURJKSA-N 0 3 419.481 4.022 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@H](C)N[C@H](C)c2cc(OC)ccc2OC)CC1 ZINC000482549649 898140163 /nfs/dbraw/zinc/14/01/63/898140163.db2.gz HSXDGHMNUFTWLF-ZWKOTPCHSA-N 0 3 415.553 4.397 20 0 HIADHN COc1ccc([C@@H](C)N[C@@H](C)c2cc(F)ccc2N2CCN(C)CC2)c(OC)c1 ZINC000482551206 898141378 /nfs/dbraw/zinc/14/13/78/898141378.db2.gz QOSCVKHTIMUYMC-SJORKVTESA-N 0 3 401.526 4.007 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)CCOc1ccc(Br)cc1F ZINC000482599220 898201311 /nfs/dbraw/zinc/20/13/11/898201311.db2.gz SXABXHOQPZZTHN-UHFFFAOYSA-N 0 3 409.299 4.366 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)[C@H]1CCCN(C(=O)c2ccc(Cl)cc2)C1 ZINC000482602048 898203557 /nfs/dbraw/zinc/20/35/57/898203557.db2.gz YUEBVAMKZZCNRM-IBGZPJMESA-N 0 3 413.949 4.201 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)COc1ccc(Br)cc1Cl ZINC000482603962 898205576 /nfs/dbraw/zinc/20/55/76/898205576.db2.gz CGWRXAOMKJWKDX-UHFFFAOYSA-N 0 3 411.727 4.490 20 0 HIADHN CCn1c(SCC(=O)Nc2cc(CN(C)C)ccc2C)nnc1-c1cccs1 ZINC000482621646 898225289 /nfs/dbraw/zinc/22/52/89/898225289.db2.gz YLYXCQFRCZAJFS-UHFFFAOYSA-N 0 3 415.588 4.127 20 0 HIADHN CC(C)CN(C(=O)NC[C@@H](Cc1ccccc1)N(C)C)[C@H]1CCCc2cccnc21 ZINC000482634165 898237040 /nfs/dbraw/zinc/23/70/40/898237040.db2.gz IVQUPMVDCCHGSB-PKTZIBPZSA-N 0 3 408.590 4.300 20 0 HIADHN Cn1c(CNC[C@H](c2ccc(Cl)cc2)N2CCOCC2)nc2ccc(Cl)cc21 ZINC000482688152 898287552 /nfs/dbraw/zinc/28/75/52/898287552.db2.gz BVAOVMGUYIKZSY-HXUWFJFHSA-N 0 3 419.356 4.043 20 0 HIADHN CC[C@H](C)[C@@H](N[C@H](C)c1cn(C)nc1C)C(=O)N1CCC(Cc2ccccc2)CC1 ZINC000482827349 898434984 /nfs/dbraw/zinc/43/49/84/898434984.db2.gz SRCCJSPNZCVYRS-XLNZFTOWSA-N 0 3 410.606 4.275 20 0 HIADHN O=C(CCCOc1ccc2c(c1)CCCC2)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000482839543 898449074 /nfs/dbraw/zinc/44/90/74/898449074.db2.gz BSGIIZGSQIIWMZ-UHFFFAOYSA-N 0 3 422.569 4.320 20 0 HIADHN Cc1ccc(OCCCC(=O)Nc2cccc(CN3CCC(O)CC3)c2)c(Cl)c1 ZINC000482846994 898458191 /nfs/dbraw/zinc/45/81/91/898458191.db2.gz WRMYKRADSYKRDX-UHFFFAOYSA-N 0 3 416.949 4.403 20 0 HIADHN C[C@H](NCCC(=O)N(C)Cc1ccccc1Br)c1cc(F)cc(F)c1 ZINC000482888716 898506069 /nfs/dbraw/zinc/50/60/69/898506069.db2.gz KRUJORMVXGKMGD-ZDUSSCGKSA-N 0 3 411.290 4.427 20 0 HIADHN COc1ccc(C[C@H](NC[C@@H]2CN(C)CCN2C)c2cc(Cl)ccc2Cl)cc1 ZINC000482893192 898511246 /nfs/dbraw/zinc/51/12/46/898511246.db2.gz UNNORORZMQBXKZ-GCJKJVERSA-N 0 3 422.400 4.121 20 0 HIADHN COc1ccc(C[C@@H](NC[C@@H]2CN(C)CCN2C)c2cc(Cl)ccc2Cl)cc1 ZINC000482893195 898511640 /nfs/dbraw/zinc/51/16/40/898511640.db2.gz UNNORORZMQBXKZ-XMSQKQJNSA-N 0 3 422.400 4.121 20 0 HIADHN COc1ccc([C@H](C)NCc2cccc(COC3CCOCC3)c2)cc1NC(C)=O ZINC000482907780 898525957 /nfs/dbraw/zinc/52/59/57/898525957.db2.gz YWSFSUJFYKOIPW-KRWDZBQOSA-N 0 3 412.530 4.200 20 0 HIADHN COc1ccc2c(c1)[C@H](NCc1cccc(NC(=O)NCc3ccncc3)c1)CC2 ZINC000482940509 898563632 /nfs/dbraw/zinc/56/36/32/898563632.db2.gz BCWNWKFCJFUTNU-HSZRJFAPSA-N 0 3 402.498 4.189 20 0 HIADHN C[C@H](NC[C@H](O)CO[C@@H](C)c1ccc(Cl)cc1)c1ccc(Br)cn1 ZINC000482961252 898591463 /nfs/dbraw/zinc/59/14/63/898591463.db2.gz OEPBHHTWKRBAEC-DCGLDWPTSA-N 0 3 413.743 4.287 20 0 HIADHN C[C@H]1Cc2ccccc2[C@@H]1NCc1ccccc1CN1C(=O)NC2(CCCCC2)C1=O ZINC000482968011 898600175 /nfs/dbraw/zinc/60/01/75/898600175.db2.gz ZGCLXXISYNDFRV-FDDCHVKYSA-N 0 3 417.553 4.464 20 0 HIADHN CC[C@H](C)Sc1ccc(NC(=O)N2CC[C@H](N3CCN(C)CC3)[C@@H](C)C2)c(C)c1 ZINC000482990579 898633780 /nfs/dbraw/zinc/63/37/80/898633780.db2.gz JHWHKDMQJZQAKX-IPJJNNNSSA-N 0 3 418.651 4.375 20 0 HIADHN CCC(C)(C)NC(=O)c1ccc(NC(=O)N2CCN(C3CCCCC3)CC2)cc1 ZINC000483012363 898666198 /nfs/dbraw/zinc/66/61/98/898666198.db2.gz LFPFTWJYDQOISX-UHFFFAOYSA-N 0 3 400.567 4.087 20 0 HIADHN CCN1CCCC[C@@H]1C(=O)N1CCC(c2nc(-c3ccccc3OC)cs2)CC1 ZINC000483043202 898712636 /nfs/dbraw/zinc/71/26/36/898712636.db2.gz DWBYEVFNFNMAGP-HXUWFJFHSA-N 0 3 413.587 4.399 20 0 HIADHN CCOC(=O)c1c2c(sc1NC(=O)[C@@H]1CCC(F)(F)C1)C(C)(C)NC(C)(C)C2 ZINC000483055176 898727137 /nfs/dbraw/zinc/72/71/37/898727137.db2.gz XZQYNJSWFSKLMM-LLVKDONJSA-N 0 3 414.518 4.458 20 0 HIADHN C[C@@H](NC(=O)c1ccc(C(=O)N(C)c2ccccc2)cc1)[C@H](c1ccccc1)N(C)C ZINC000505576375 914282142 /nfs/dbraw/zinc/28/21/42/914282142.db2.gz XOOCKFHHQNZURQ-NTKDMRAZSA-N 0 3 415.537 4.384 20 0 HIADHN C[C@H](NC[C@@H](c1c(F)cccc1F)N(C)C)c1ccc(-n2cncn2)cc1Cl ZINC000483156695 898828806 /nfs/dbraw/zinc/82/88/06/898828806.db2.gz NSXOGINNWSAAQR-DJJJIMSYSA-N 0 3 405.880 4.152 20 0 HIADHN C[C@H](CN1CCN(c2ccccn2)CC1)N[C@H](C)c1nc(-c2ccccc2)cs1 ZINC000483160108 898831180 /nfs/dbraw/zinc/83/11/80/898831180.db2.gz PZOSXLVKVNCZNY-RTBURBONSA-N 0 3 407.587 4.066 20 0 HIADHN COCCNS(=O)(=O)c1cccc(CN[C@H](CC(C)C)c2ccc(Cl)cc2)c1 ZINC000483165215 898835035 /nfs/dbraw/zinc/83/50/35/898835035.db2.gz BINRPHDCQKNLPM-OAQYLSRUSA-N 0 3 424.994 4.142 20 0 HIADHN CCc1ccc(Cl)c(CC)c1NC(=O)CCCN1C[C@H](C)O[C@@]2(CCOC2)C1 ZINC000483172882 898840268 /nfs/dbraw/zinc/84/02/68/898840268.db2.gz LVJXYKZXLQWOJZ-AOMKIAJQSA-N 0 3 408.970 4.063 20 0 HIADHN Cc1c([C@@H](C)NC2CCN(c3cccc(C)n3)CC2)nnn1-c1ccc(Cl)cc1 ZINC000483187483 898847810 /nfs/dbraw/zinc/84/78/10/898847810.db2.gz UXXMCOMPUOGXGA-MRXNPFEDSA-N 0 3 410.953 4.252 20 0 HIADHN OC[C@H](NC[C@H](O)CC1CCCC1)c1ccc(Br)cc1C(F)(F)F ZINC000483271580 898910789 /nfs/dbraw/zinc/91/07/89/898910789.db2.gz PUEQQISWDRAUAD-CJNGLKHVSA-N 0 3 410.274 4.032 20 0 HIADHN CN(C(=O)N[C@@H](Cc1cccc(Br)c1)CC1CC1)[C@H]1CCN(C2CC2)C1 ZINC000483373365 899009833 /nfs/dbraw/zinc/00/98/33/899009833.db2.gz VVMQZCLKUPNHBW-QUCCMNQESA-N 0 3 420.395 4.038 20 0 HIADHN CS[C@H]1CN(C(=O)c2csc(-c3ccccc3Cl)n2)C[C@@H]1N1CCCC1 ZINC000483392188 899027103 /nfs/dbraw/zinc/02/71/03/899027103.db2.gz HKFBFLAOKOVZME-IRXDYDNUSA-N 0 3 407.992 4.115 20 0 HIADHN C[C@@H](NC(=O)CCc1nnc(-c2cc3ccccc3o2)o1)[C@@H](c1ccccc1)N(C)C ZINC000505608300 914312533 /nfs/dbraw/zinc/31/25/33/914312533.db2.gz MWLLVOAUIUIXOZ-MWTRTKDXSA-N 0 3 418.497 4.223 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1ccn(C)c1C1CCC1 ZINC000483473931 899118286 /nfs/dbraw/zinc/11/82/86/899118286.db2.gz WLOPVPCAZVAPAA-NRFANRHFSA-N 0 3 417.557 4.497 20 0 HIADHN C[C@H](NC(=O)c1cnn(-c2ccccc2)c1C(F)(F)F)[C@@H](c1ccccc1)N(C)C ZINC000505615408 914317903 /nfs/dbraw/zinc/31/79/03/914317903.db2.gz XNZRRLVSLMULGY-KXBFYZLASA-N 0 3 416.447 4.312 20 0 HIADHN COc1ccccc1-c1csc(C2CCN(Cc3ccc4c(c3)nnn4C)CC2)n1 ZINC000483497927 899156517 /nfs/dbraw/zinc/15/65/17/899156517.db2.gz CWOACOWJILZFJY-UHFFFAOYSA-N 0 3 419.554 4.480 20 0 HIADHN CCc1cccc(CC(=O)Nc2c(C)cnn2[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000505616641 914319854 /nfs/dbraw/zinc/31/98/54/914319854.db2.gz BLLURRABZSYWKB-HSZRJFAPSA-N 0 3 402.542 4.382 20 0 HIADHN Cc1ccc(NC(=O)[C@H](C)N2CCN(C3CCCCC3)CC2)c(Br)c1 ZINC000483504423 899165362 /nfs/dbraw/zinc/16/53/62/899165362.db2.gz XGNOZMPGKAGKOP-INIZCTEOSA-N 0 3 408.384 4.035 20 0 HIADHN CSc1cccc(N(C(=O)c2ncccc2Br)C2CCN(C)CC2)c1 ZINC000483512810 899173617 /nfs/dbraw/zinc/17/36/17/899173617.db2.gz KRKSTJCLIGOGKS-UHFFFAOYSA-N 0 3 420.376 4.307 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)CCc1ccc(F)cc1F ZINC000505626965 914326012 /nfs/dbraw/zinc/32/60/12/914326012.db2.gz YUMACQWFWFFMOQ-NRFANRHFSA-N 0 3 424.495 4.488 20 0 HIADHN CCOCCC1(CNC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)CCC1 ZINC000483575519 899228728 /nfs/dbraw/zinc/22/87/28/899228728.db2.gz QOHTZPVUXCLDQN-NRFANRHFSA-N 0 3 412.496 4.154 20 0 HIADHN COc1ccc2[nH]c3c(c2c1)C[C@@H](N[C@@H](C)c1nc(-c2cccc(OC)c2)no1)CC3 ZINC000483655340 899314942 /nfs/dbraw/zinc/31/49/42/899314942.db2.gz PRPACZLYFXTRNT-HOCLYGCPSA-N 0 3 418.497 4.443 20 0 HIADHN COc1cccc(Cl)c1CNC(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000483737569 899399883 /nfs/dbraw/zinc/39/98/83/899399883.db2.gz WKPBSPKJNOJCQJ-UHFFFAOYSA-N 0 3 419.978 4.262 20 0 HIADHN Cc1ccc(NC(=O)CSc2nncn2-c2cccc(Cl)c2)c(CN(C)C)c1 ZINC000505654590 914351648 /nfs/dbraw/zinc/35/16/48/914351648.db2.gz CBWWJSITEQPJDP-UHFFFAOYSA-N 0 3 415.950 4.022 20 0 HIADHN CCCC(=O)Nc1cccc(NC(=O)N(CCN(C)C)Cc2cccc(OC)c2)c1 ZINC000483838003 899517783 /nfs/dbraw/zinc/51/77/83/899517783.db2.gz HQODGCFLGAKJLT-UHFFFAOYSA-N 0 3 412.534 4.030 20 0 HIADHN CC[C@@H]1Oc2cc([C@@H](C)N[C@@H](C)c3cc(OC)c(OC)c(OC)c3)ccc2NC1=O ZINC000483850036 899530426 /nfs/dbraw/zinc/53/04/26/899530426.db2.gz OEMACUCIKCUYEW-GLJUWKHASA-N 0 3 414.502 4.234 20 0 HIADHN CCCN(C)[C@H](CNC(=O)Nc1cc([C@@H]2CCCO2)nn1C)c1ccc(Cl)cc1 ZINC000483862460 899545182 /nfs/dbraw/zinc/54/51/82/899545182.db2.gz ZXAIYCCLJBTXSB-MOPGFXCFSA-N 0 3 419.957 4.130 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N[C@@H](c1cc(F)ccc1F)C(F)F)c1ccco1 ZINC000483877990 899555945 /nfs/dbraw/zinc/55/59/45/899555945.db2.gz UHPYIGMRWJXNBW-CXMBCZLWSA-N 0 3 401.404 4.293 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N[C@H](c1ccc(Cl)cc1)[C@@H]1C[C@@H]1C ZINC000483978365 899620974 /nfs/dbraw/zinc/62/09/74/899620974.db2.gz KOFPPYQSIPQTII-NYSBEXSLSA-N 0 3 413.949 4.162 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2ccc(Oc3ccccn3)cc2)c1 ZINC000484001018 899640894 /nfs/dbraw/zinc/64/08/94/899640894.db2.gz JHHVOTSSRIROGO-UHFFFAOYSA-N 0 3 420.513 4.478 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)NC[C@@H]1CCCC[C@@H]1C(F)(F)F ZINC000484042587 899674038 /nfs/dbraw/zinc/67/40/38/899674038.db2.gz KSDKNQVSMYSSIB-RDJZCZTQSA-N 0 3 403.464 4.268 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)NC[C@@H]1CCCC[C@H]1C(F)(F)F ZINC000484042583 899674878 /nfs/dbraw/zinc/67/48/78/899674878.db2.gz KSDKNQVSMYSSIB-DOTOQJQBSA-N 0 3 403.464 4.268 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)NC[C@@H]1CCCC[C@H]1C(F)(F)F ZINC000484047677 899679757 /nfs/dbraw/zinc/67/97/57/899679757.db2.gz XAQQIZTVPRELOA-FUHWJXTLSA-N 0 3 403.464 4.268 20 0 HIADHN CN(C)c1nc2cc(NC(=O)N(Cc3ccccc3)C3CCN(C)CC3)ccc2o1 ZINC000484076615 899710126 /nfs/dbraw/zinc/71/01/26/899710126.db2.gz ZYMWNCJCOXESQN-UHFFFAOYSA-N 0 3 407.518 4.022 20 0 HIADHN Cc1ccc(N2CCC(N[C@@H](C)c3ccccc3I)CC2)nc1 ZINC000484125832 899747092 /nfs/dbraw/zinc/74/70/92/899747092.db2.gz CHGFIUAXEYHWTK-HNNXBMFYSA-N 0 3 421.326 4.314 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)NCc1ccccc1Oc1ccccc1 ZINC000484172352 899791084 /nfs/dbraw/zinc/79/10/84/899791084.db2.gz PHKBUWHNDJKDHG-UHFFFAOYSA-N 0 3 417.509 4.104 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N[C@@H]1CCSc2ccc(Cl)cc21 ZINC000484199559 899810217 /nfs/dbraw/zinc/81/02/17/899810217.db2.gz QKRMTWWOCPQMGP-QGZVFWFLSA-N 0 3 417.962 4.002 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N(Cc1ccc(C(C)C)cc1)C1CC1 ZINC000484214881 899817040 /nfs/dbraw/zinc/81/70/40/899817040.db2.gz WMSNKLVTIGXULR-UHFFFAOYSA-N 0 3 407.558 4.310 20 0 HIADHN COC1CCN(C2(CNC(=O)c3cnc(-c4ccsc4)s3)CCCC2)CC1 ZINC000484258391 899838131 /nfs/dbraw/zinc/83/81/31/899838131.db2.gz UIXTYQHJHASUIQ-UHFFFAOYSA-N 0 3 405.589 4.025 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)N[C@H](CC(F)(F)F)c2ccccc2)cc1 ZINC000484284475 899850984 /nfs/dbraw/zinc/85/09/84/899850984.db2.gz PDQOXQWFLUNJTF-RTBURBONSA-N 0 3 409.452 4.291 20 0 HIADHN C[C@H](N[C@@H]1c2cccc(F)c2CC[C@@H]1C)c1cccc(N2CCCS2(=O)=O)c1 ZINC000484287130 899852871 /nfs/dbraw/zinc/85/28/71/899852871.db2.gz FPOZMYRNCKPIBA-WCJKSRRJSA-N 0 3 402.535 4.340 20 0 HIADHN CC[S@](=O)[C@@H]1CCC[C@@H](N[C@H](C)c2ccccc2I)C1 ZINC000484290523 899855604 /nfs/dbraw/zinc/85/56/04/899855604.db2.gz FAZONYQRZAMTCS-AVUKIGBWSA-N 0 3 405.345 4.022 20 0 HIADHN COc1ccccc1OCCN1CCC(c2noc(-c3ccccc3OC)n2)CC1 ZINC000484327221 899881930 /nfs/dbraw/zinc/88/19/30/899881930.db2.gz RCLVIPYHWIGNRS-UHFFFAOYSA-N 0 3 409.486 4.012 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)NCc1cc(F)ccc1Br)c1ccco1 ZINC000484337967 899889806 /nfs/dbraw/zinc/88/98/06/899889806.db2.gz INVDRNPDRKJAJR-BLLLJJGKSA-N 0 3 412.303 4.110 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)N[C@H](CC(C)(C)C)C(F)(F)F)c1 ZINC000484353876 899903277 /nfs/dbraw/zinc/90/32/77/899903277.db2.gz UOUWVBSCFKCFMO-QGZVFWFLSA-N 0 3 403.489 4.136 20 0 HIADHN COc1cccc(CN(CCN(C)C)C(=O)Nc2nn(C3CCCCC3)cc2C)c1 ZINC000484359474 899907260 /nfs/dbraw/zinc/90/72/60/899907260.db2.gz KLMYAAJNEPMZBL-UHFFFAOYSA-N 0 3 413.566 4.301 20 0 HIADHN O=C1[C@@H]2CC[C@@H](c3ccccc3)N2C(=O)N1C[C@@H]1CCCN(Cc2cccs2)C1 ZINC000484436144 899944211 /nfs/dbraw/zinc/94/42/11/899944211.db2.gz USTSODAEFBTJGZ-QMMLZNLJSA-N 0 3 409.555 4.128 20 0 HIADHN O[C@H](CN[C@@H]1CCCc2nc(-c3ccc(Br)cc3)sc21)C(F)F ZINC000484469011 899962340 /nfs/dbraw/zinc/96/23/40/899962340.db2.gz CSWICZODKJGFKS-DGCLKSJQSA-N 0 3 403.292 4.166 20 0 HIADHN O[C@H](CN[C@@H]1CCCc2nc(-c3ccccc3Br)sc21)C(F)F ZINC000484473922 899967946 /nfs/dbraw/zinc/96/79/46/899967946.db2.gz JIBIBCLCYPTKJE-DGCLKSJQSA-N 0 3 403.292 4.166 20 0 HIADHN COc1cc(C[C@H](CO)CN[C@H](C)c2nc(-c3ccccc3)cs2)cc(OC)c1 ZINC000484477010 899969140 /nfs/dbraw/zinc/96/91/40/899969140.db2.gz PWSADAIFKGSLQH-AEFFLSMTSA-N 0 3 412.555 4.329 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(OCC2CC2)c(F)c1)c1ccc(NS(C)(=O)=O)cc1 ZINC000484500130 899991019 /nfs/dbraw/zinc/99/10/19/899991019.db2.gz HCANUTGUROAYMA-HUUCEWRRSA-N 0 3 406.523 4.398 20 0 HIADHN Cc1c([C@H](C)N[C@H]2CCN(C(=O)CCc3ccccc3)C2)cnn1-c1ccc(F)cc1 ZINC000484508444 899999260 /nfs/dbraw/zinc/99/92/60/899999260.db2.gz PIHREVWRHYYRGK-AVRDEDQJSA-N 0 3 420.532 4.204 20 0 HIADHN Cc1c([C@@H](C)N[C@H]2CCN(C(=O)CCc3ccccc3)C2)cnn1-c1ccc(F)cc1 ZINC000484508445 899999465 /nfs/dbraw/zinc/99/94/65/899999465.db2.gz PIHREVWRHYYRGK-GCJKJVERSA-N 0 3 420.532 4.204 20 0 HIADHN C[C@@H](N[C@@H]1CCN(C(=O)CCc2ccccc2)C1)c1ccccc1OC(F)(F)F ZINC000484509090 900000385 /nfs/dbraw/zinc/00/03/85/900000385.db2.gz YTCJZTLFZJRDIF-SJLPKXTDSA-N 0 3 406.448 4.470 20 0 HIADHN CC(C)Cc1ccc([C@@H](CNC(=O)Nc2ccc(N3CCC3=O)cc2)N(C)C)cc1 ZINC000484547036 900028358 /nfs/dbraw/zinc/02/83/58/900028358.db2.gz WKXZJQIPSXDOLZ-JOCHJYFZSA-N 0 3 408.546 4.046 20 0 HIADHN C[C@H](NCCCO[C@H]1CCOC1)c1ccc(Br)cc1Br ZINC000484615426 900071765 /nfs/dbraw/zinc/07/17/65/900071765.db2.gz HUEZIQFPTHMHMU-AAEUAGOBSA-N 0 3 407.146 4.058 20 0 HIADHN CC[C@@]1(C)Oc2ccc(NC(=O)N(CCN(C)C)Cc3cccc(OC)c3)cc2O1 ZINC000484658096 900102565 /nfs/dbraw/zinc/10/25/65/900102565.db2.gz SBEPHIDCMYDMNC-QHCPKHFHSA-N 0 3 413.518 4.188 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N3CC[C@@H](C(F)(F)F)C(C)(C)C3)c2)CC1 ZINC000484765291 900178682 /nfs/dbraw/zinc/17/86/82/900178682.db2.gz VNRFHZCHWOLDIV-GOSISDBHSA-N 0 3 412.500 4.271 20 0 HIADHN C[C@@H](NC(=O)NCc1ccc(OCc2ccccn2)cc1)[C@@H](c1ccccc1)N(C)C ZINC000484794423 900199954 /nfs/dbraw/zinc/19/99/54/900199954.db2.gz DJBXNOSESIVDRY-DVECYGJZSA-N 0 3 418.541 4.151 20 0 HIADHN C[C@H](NC(=O)NCc1ccc(OCc2ccccn2)cc1)[C@H](c1ccccc1)N(C)C ZINC000484794425 900200396 /nfs/dbraw/zinc/20/03/96/900200396.db2.gz DJBXNOSESIVDRY-YADARESESA-N 0 3 418.541 4.151 20 0 HIADHN CCc1c(NC(=O)N2CC[C@@H]3CCN(C)C[C@H]32)cnn1-c1ccc(C(F)(F)F)cc1 ZINC000484816881 900219738 /nfs/dbraw/zinc/21/97/38/900219738.db2.gz AKTGWWDYZVPGGY-IFXJQAMLSA-N 0 3 421.467 4.011 20 0 HIADHN Cc1ccccc1C1(CNC(=O)N[C@H]2CCN(Cc3ccccc3)[C@@H]2C)CCOCC1 ZINC000484893725 900277094 /nfs/dbraw/zinc/27/70/94/900277094.db2.gz WOCBUQVRZBJIME-QPPBQGQZSA-N 0 3 421.585 4.005 20 0 HIADHN CCCOc1cn(-c2ccccc2)nc1C(=O)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000484957198 900321692 /nfs/dbraw/zinc/32/16/92/900321692.db2.gz FLNWBJJPGVROFE-QFIPXVFZSA-N 0 3 418.541 4.228 20 0 HIADHN COc1ccc(NC(=O)CCN2CCC[C@H]2c2cccc3c2OCCO3)cc1Cl ZINC000485085662 900399702 /nfs/dbraw/zinc/39/97/02/900399702.db2.gz LJVPFIWAXOOYFH-SFHVURJKSA-N 0 3 416.905 4.286 20 0 HIADHN COC(=O)c1ccc(N2CCN(CCCC(=O)Nc3c(C)cccc3C)[C@@H](C)C2)cc1 ZINC000485101700 900409159 /nfs/dbraw/zinc/40/91/59/900409159.db2.gz CWFKKDAYCMBSQC-FQEVSTJZSA-N 0 3 423.557 4.019 20 0 HIADHN C[C@@H]1[C@H](NC(=O)NC[C@@H]2CCCO[C@H]2c2ccccc2)CCN1Cc1ccccc1 ZINC000485267305 900548991 /nfs/dbraw/zinc/54/89/91/900548991.db2.gz BHMOBEVZLLNAOK-GOUWZUTHSA-N 0 3 407.558 4.117 20 0 HIADHN COc1cccc(Oc2ccc(CNC(=O)N3CCN(C4CCCCC4)CC3)cn2)c1 ZINC000485306743 900584706 /nfs/dbraw/zinc/58/47/06/900584706.db2.gz LHSKLSTXBZAWGB-UHFFFAOYSA-N 0 3 424.545 4.042 20 0 HIADHN CCc1c(NC(=O)N2CC[C@H]3CCN(C)C[C@H]32)cnn1-c1cccc(C(F)(F)F)c1 ZINC000485319123 900598886 /nfs/dbraw/zinc/59/88/86/900598886.db2.gz GRCONVSMBNAGDY-AUUYWEPGSA-N 0 3 421.467 4.011 20 0 HIADHN CCc1c(NC(=O)N(CCN(C)C)Cc2ccco2)cnn1-c1ccc(Cl)cc1 ZINC000485324006 900606886 /nfs/dbraw/zinc/60/68/86/900606886.db2.gz QAQNRCAWXBBLHP-UHFFFAOYSA-N 0 3 415.925 4.277 20 0 HIADHN CCc1c(NC(=O)N2CCCN(CC)CC2)cnn1-c1cccc(C(F)(F)F)c1 ZINC000485362069 900657140 /nfs/dbraw/zinc/65/71/40/900657140.db2.gz OFDYIJKQVBKJTR-UHFFFAOYSA-N 0 3 409.456 4.013 20 0 HIADHN CCn1ccnc1[C@H]1CCCCN1C(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000485376940 900673892 /nfs/dbraw/zinc/67/38/92/900673892.db2.gz CCUIXWYJCGNOII-QZTJIDSGSA-N 0 3 401.580 4.038 20 0 HIADHN CN(C)C[C@@H](NC(=O)NCc1nc2cc(Cl)ccc2s1)c1ccc(F)cc1 ZINC000485379806 900676745 /nfs/dbraw/zinc/67/67/45/900676745.db2.gz YBIYWLGWXRKULF-MRXNPFEDSA-N 0 3 406.914 4.191 20 0 HIADHN COc1ccc2ccccc2c1-c1cc(CNC(=O)[C@H](C)N2[C@H](C)CC[C@@H]2C)on1 ZINC000485433674 900730863 /nfs/dbraw/zinc/73/08/63/900730863.db2.gz RFOXEVFDJRJRDQ-BBWFWOEESA-N 0 3 407.514 4.381 20 0 HIADHN Cc1c(C(=O)Nc2ccc(C(=O)NCCN3CCCC3)cc2)oc2c1c(C)ccc2C ZINC000485503854 900792351 /nfs/dbraw/zinc/79/23/51/900792351.db2.gz YNMOFHBSOPOOTP-UHFFFAOYSA-N 0 3 419.525 4.436 20 0 HIADHN O=C(NCCc1cccc(F)c1F)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000485505338 900793974 /nfs/dbraw/zinc/79/39/74/900793974.db2.gz OKJVFJOLUUXUEA-HXUWFJFHSA-N 0 3 412.402 4.078 20 0 HIADHN Cc1cc(C)n(-c2ccc(NC(=O)N(Cc3ccccc3)C3CCN(C)CC3)cn2)n1 ZINC000485582263 900847635 /nfs/dbraw/zinc/84/76/35/900847635.db2.gz KBOZULIEHMOMOX-UHFFFAOYSA-N 0 3 418.545 4.012 20 0 HIADHN Cc1cc(NC(=O)N(Cc2ccccc2)C2CCN(C)CC2)n(Cc2ccccc2)n1 ZINC000485592620 900854955 /nfs/dbraw/zinc/85/49/55/900854955.db2.gz WILOKIWSIUXAAU-UHFFFAOYSA-N 0 3 417.557 4.368 20 0 HIADHN CCc1ccc(Cl)c(CC)c1NC(=O)CCCN1CCCN(C(=O)C(C)C)CC1 ZINC000485675992 900926528 /nfs/dbraw/zinc/92/65/28/900926528.db2.gz VDAFRPHZHNBMBW-UHFFFAOYSA-N 0 3 422.013 4.374 20 0 HIADHN CC[C@H](NC[C@@H](O)COc1ccc(C(C)=O)cc1)c1cc(F)cc(Br)c1 ZINC000485830127 901076484 /nfs/dbraw/zinc/07/64/84/901076484.db2.gz DISZIYLACUQJER-QUCCMNQESA-N 0 3 424.310 4.271 20 0 HIADHN CCOc1ccc(Oc2cc(CNC(=O)c3ccccc3CN(C)C)ccn2)cc1 ZINC000485967348 901184369 /nfs/dbraw/zinc/18/43/69/901184369.db2.gz APQFLMNXXKAHAX-UHFFFAOYSA-N 0 3 405.498 4.264 20 0 HIADHN O=C(Nc1cccc(Br)c1)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000486012422 901221022 /nfs/dbraw/zinc/22/10/22/901221022.db2.gz ZWNMYRUPYHFPLH-UHFFFAOYSA-N 0 3 404.308 4.050 20 0 HIADHN COc1cc([C@H](C)NC[C@@H](c2ccccc2)C(F)(F)F)ccc1S(C)(=O)=O ZINC000486062859 901258291 /nfs/dbraw/zinc/25/82/91/901258291.db2.gz RUZFVWZTFQQFLM-BBRMVZONSA-N 0 3 401.450 4.095 20 0 HIADHN C[C@H]1CN(C(=O)c2cc(-c3ccccc3)ccc2Cl)CC[C@@H]1N1CCN(C)CC1 ZINC000486096744 901284615 /nfs/dbraw/zinc/28/46/15/901284615.db2.gz OZIJAJZAJDTIGB-MBSDFSHPSA-N 0 3 411.977 4.105 20 0 HIADHN CN(C)Cc1ccccc1C(=O)Nc1cccc(C(=O)Nc2ccc(Cl)cn2)c1 ZINC000486275208 901458581 /nfs/dbraw/zinc/45/85/81/901458581.db2.gz NZFFHZQGDPXBIM-UHFFFAOYSA-N 0 3 408.889 4.301 20 0 HIADHN CCCc1nc(C)c(NC(=O)Nc2ccc(N3CCN(CC)CC3)cc2C)s1 ZINC000486317085 901494803 /nfs/dbraw/zinc/49/48/03/901494803.db2.gz IKTSGMAATIHHEL-UHFFFAOYSA-N 0 3 401.580 4.498 20 0 HIADHN FC(F)(F)c1cccc(CN2C[C@H]3CCC[C@@]3(c3nc(-c4cnccn4)no3)C2)c1 ZINC000486431935 901591172 /nfs/dbraw/zinc/59/11/72/901591172.db2.gz DGIDPSBYQVRKKI-OXQOHEQNSA-N 0 3 415.419 4.099 20 0 HIADHN c1nc(-c2ccncc2)sc1CN1C[C@H]2CCC[C@@]2(c2nc(CC3CC3)no2)C1 ZINC000486453731 901613320 /nfs/dbraw/zinc/61/33/20/901613320.db2.gz VSVKFMRCZKRADS-VGOFRKELSA-N 0 3 407.543 4.094 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)N[C@H]1CC(C)(C)Oc2cc(F)ccc21 ZINC000486482242 901641115 /nfs/dbraw/zinc/64/11/15/901641115.db2.gz LTTWQDXQDPZQRD-SFHVURJKSA-N 0 3 405.539 4.263 20 0 HIADHN Fc1ccc(-c2nnc3n2C[C@H](NCc2ccc(F)cc2Br)CC3)cc1 ZINC000505913136 914556038 /nfs/dbraw/zinc/55/60/38/914556038.db2.gz PYOARCWYUDDCKG-MRXNPFEDSA-N 0 3 419.273 4.090 20 0 HIADHN CC(C)([C@@H](NC(=O)CCCOc1cccnc1)c1ccc(F)c(F)c1)N1CCCC1 ZINC000486560039 901705629 /nfs/dbraw/zinc/70/56/29/901705629.db2.gz ATWFPXFGYWSOQZ-QFIPXVFZSA-N 0 3 417.500 4.251 20 0 HIADHN Cc1noc(C)c1CCC(=O)N[C@@H](c1ccc(F)c(F)c1)C(C)(C)N1CCCC1 ZINC000486575174 901717920 /nfs/dbraw/zinc/71/79/20/901717920.db2.gz ZINFUPBHUUWHIE-NRFANRHFSA-N 0 3 405.489 4.234 20 0 HIADHN O=C(Nc1ccc(NC2CCOCC2)cc1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000486626026 901760344 /nfs/dbraw/zinc/76/03/44/901760344.db2.gz KGXOEWIFAVRHAE-IBGZPJMESA-N 0 3 411.521 4.267 20 0 HIADHN COc1ccc(NC(=O)N2CCN(C3CCOCC3)C[C@@H]2C)cc1Cc1ccccc1 ZINC000486656600 901777421 /nfs/dbraw/zinc/77/74/21/901777421.db2.gz ZRGKWPKIUGWISU-IBGZPJMESA-N 0 3 423.557 4.003 20 0 HIADHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1cc2cc(Cl)sc2[nH]1 ZINC000486724615 901815739 /nfs/dbraw/zinc/81/57/39/901815739.db2.gz USLNJGXSIWWXIK-UHFFFAOYSA-N 0 3 403.935 4.339 20 0 HIADHN CCCCC[C@H]1CCCN1CC(=O)N(C)CC(=O)Nc1ccccc1C(F)(F)F ZINC000486793364 901857643 /nfs/dbraw/zinc/85/76/43/901857643.db2.gz INLUOMWKQAYQLW-INIZCTEOSA-N 0 3 413.484 4.147 20 0 HIADHN Cc1nc(-c2ccc(C)cc2NC(=O)CNC2(c3ccccc3)CCCCC2)n[nH]1 ZINC000486795379 901858990 /nfs/dbraw/zinc/85/89/90/901858990.db2.gz BXRCWHRBCUZEQA-UHFFFAOYSA-N 0 3 403.530 4.476 20 0 HIADHN CO[C@H](c1ccc(Br)cc1)[C@H](C)NC(=O)c1ccccc1CN(C)C ZINC000486847158 901892946 /nfs/dbraw/zinc/89/29/46/901892946.db2.gz PXOBVYCPNHQHLO-LIRRHRJNSA-N 0 3 405.336 4.017 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cc(NC(C)=O)ccc1Cl)c1cccc(OC)c1 ZINC000486848633 901894081 /nfs/dbraw/zinc/89/40/81/901894081.db2.gz XRUZPKFPEIZXFB-NRFANRHFSA-N 0 3 417.937 4.120 20 0 HIADHN CN(C(=O)Nc1nnc(/C=C\c2ccco2)s1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000486851254 901896599 /nfs/dbraw/zinc/89/65/99/901896599.db2.gz KGGRKAMOGGJOIN-YUIUBULTSA-N 0 3 423.542 4.430 20 0 HIADHN C[C@@H]1C[C@H](NC(=O)Nc2nnc(/C=C\c3ccco3)s2)CN1Cc1ccccc1 ZINC000486942133 901979072 /nfs/dbraw/zinc/97/90/72/901979072.db2.gz LGTKWQHPPCLYHY-GUKXCFJFSA-N 0 3 409.515 4.086 20 0 HIADHN C[C@@H](c1ccncc1)N1CCC(NC(=O)CCOc2ccc3ccccc3c2)CC1 ZINC000486979843 902002437 /nfs/dbraw/zinc/00/24/37/902002437.db2.gz KEZHAQTVOPJKIL-IBGZPJMESA-N 0 3 403.526 4.346 20 0 HIADHN Cc1cccc(Br)c1C(=O)Nc1cccc2c1CCN(CC(C)(C)O)C2 ZINC000487015692 902015855 /nfs/dbraw/zinc/01/58/55/902015855.db2.gz QNZPJTQRHDLQPF-UHFFFAOYSA-N 0 3 417.347 4.139 20 0 HIADHN C[C@@H](NC(=O)N(CCN(C)C)Cc1ccccc1F)c1ccc2ncsc2c1 ZINC000487052662 902038986 /nfs/dbraw/zinc/03/89/86/902038986.db2.gz XVGMDASPKGSFTR-OAHLLOKOSA-N 0 3 400.523 4.270 20 0 HIADHN Cc1nc(-c2ccc(C)cc2NC(=O)CN2CCC[C@@H](c3ccccc3)CC2)n[nH]1 ZINC000487436801 902210948 /nfs/dbraw/zinc/21/09/48/902210948.db2.gz XKQMJTFBQKGTFQ-HXUWFJFHSA-N 0 3 403.530 4.297 20 0 HIADHN CCN(CC)CC(=O)N[C@@H](c1ccccc1)c1ccc(OC)c(Br)c1 ZINC000487479502 902221900 /nfs/dbraw/zinc/22/19/00/902221900.db2.gz XSKLNFFWFRYRBZ-FQEVSTJZSA-N 0 3 405.336 4.005 20 0 HIADHN Cc1cc(CN2CC[C@@H]3[C@H](CCC(=O)N3C3CC3)C2)nc(-c2ccc(Cl)cc2)n1 ZINC000487975846 902499846 /nfs/dbraw/zinc/49/98/46/902499846.db2.gz FNXNXRCZXBUNDK-DYESRHJHSA-N 0 3 410.949 4.081 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(Oc2cccnc2)cc1)C(=O)NC(=O)NC1CCCCC1 ZINC000487995798 902517259 /nfs/dbraw/zinc/51/72/59/902517259.db2.gz SBRKNXHQWCZZJY-IAGOWNOFSA-N 0 3 410.518 4.072 20 0 HIADHN CCOC(=O)CCCN1CCC(c2nc(-c3ccccc3Br)no2)CC1 ZINC000488169131 902661230 /nfs/dbraw/zinc/66/12/30/902661230.db2.gz YXYZGZYVBQXWPV-UHFFFAOYSA-N 0 3 422.323 4.022 20 0 HIADHN COc1cc(CNC(=O)NC[C@@H](c2ccccc2)N(C)C)ccc1OC1CCCC1 ZINC000505984184 914650753 /nfs/dbraw/zinc/65/07/53/914650753.db2.gz JITWGPHIIPHTKH-NRFANRHFSA-N 0 3 411.546 4.119 20 0 HIADHN Cc1ccc(-c2ncc(CN3CCC[C@@H](N(C)CC(=O)OC(C)(C)C)CC3)s2)o1 ZINC000488367127 902782168 /nfs/dbraw/zinc/78/21/68/902782168.db2.gz OEKVKRMCJPICNS-QGZVFWFLSA-N 0 3 419.591 4.340 20 0 HIADHN C[C@@H]1CN(C2CCOCC2)CCN1C(=O)Nc1c(F)cc(F)cc1-c1ccccc1 ZINC000488396615 902806400 /nfs/dbraw/zinc/80/64/00/902806400.db2.gz XTWCITUVTSAXPJ-MRXNPFEDSA-N 0 3 415.484 4.349 20 0 HIADHN CCOc1ccc(C(=O)CCC(=O)N[C@H]2CCN(Cc3ccccc3)C[C@H]2C)cc1 ZINC000488515022 902865255 /nfs/dbraw/zinc/86/52/55/902865255.db2.gz KRSJRYAZPANBNQ-XXBNENTESA-N 0 3 408.542 4.075 20 0 HIADHN CCCOc1c(CN[C@@H]2CCc3nnc(-c4ccc(F)cc4)n3C2)cccc1OCC ZINC000505995535 914665312 /nfs/dbraw/zinc/66/53/12/914665312.db2.gz DSLMTCYQDPXHAH-HXUWFJFHSA-N 0 3 424.520 4.376 20 0 HIADHN CCN(CC(=O)OC(C)(C)C)C1CCN(Cc2cnc(-c3ccsc3)s2)CC1 ZINC000488581266 902891636 /nfs/dbraw/zinc/89/16/36/902891636.db2.gz LYIWFYFDABQGBM-UHFFFAOYSA-N 0 3 421.632 4.500 20 0 HIADHN CC[C@H](C)N(CC(=O)Nc1ccccc1C(F)(F)F)C[C@H](O)Cc1ccccc1 ZINC000488616466 902902587 /nfs/dbraw/zinc/90/25/87/902902587.db2.gz HXPUVYDGUYAAOB-FUHWJXTLSA-N 0 3 408.464 4.348 20 0 HIADHN C[C@H](Oc1cccc(Cl)c1Cl)C(=O)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000488673391 902936063 /nfs/dbraw/zinc/93/60/63/902936063.db2.gz KIPOYHDEOUUCKG-AWEZNQCLSA-N 0 3 423.340 4.356 20 0 HIADHN C[C@@H](CNC(=O)Nc1ccc(F)cc1OC1CCOCC1)N(C)Cc1ccccc1 ZINC000488675693 902937863 /nfs/dbraw/zinc/93/78/63/902937863.db2.gz XFOFLYOEIOKBFT-KRWDZBQOSA-N 0 3 415.509 4.026 20 0 HIADHN O=C(CCCc1nc2ccccc2s1)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000488699213 902950994 /nfs/dbraw/zinc/95/09/94/902950994.db2.gz NYIYYMJOVWBQJD-UHFFFAOYSA-N 0 3 409.555 4.214 20 0 HIADHN C[C@@H](c1ccc(S(N)(=O)=O)cc1)N(C)Cc1cccc(OCc2ccccc2)c1 ZINC000506005301 914676423 /nfs/dbraw/zinc/67/64/23/914676423.db2.gz UAPFMHJBLUDEMW-SFHVURJKSA-N 0 3 410.539 4.106 20 0 HIADHN CCN(Cc1ccccc1)c1ccc(C(=O)N2CCN(C3CCOCC3)C[C@H]2C)cc1 ZINC000488817088 903020393 /nfs/dbraw/zinc/02/03/93/903020393.db2.gz MDGCEUCWAFZNCO-OAQYLSRUSA-N 0 3 421.585 4.038 20 0 HIADHN CSc1cccc(N(C(=O)c2cc(C)nc(C(F)(F)F)n2)C2CCN(C)CC2)c1 ZINC000488876180 903054102 /nfs/dbraw/zinc/05/41/02/903054102.db2.gz XRSVNYWCBYUPDW-UHFFFAOYSA-N 0 3 424.492 4.267 20 0 HIADHN C[C@H](N[C@H](COc1ccccc1F)C(C)(C)C)C(=O)N[C@@H]1CCOc2ccccc21 ZINC000489025280 903128906 /nfs/dbraw/zinc/12/89/06/903128906.db2.gz DATSINFKAAXSMI-DKZVUGQWSA-N 0 3 414.521 4.237 20 0 HIADHN CCCc1nc(C)c(CNC(=O)N[C@@H](CN2CCc3ccccc3C2)C(C)(C)C)o1 ZINC000489046780 903152835 /nfs/dbraw/zinc/15/28/35/903152835.db2.gz RNQUOUPWLZXKAV-NRFANRHFSA-N 0 3 412.578 4.208 20 0 HIADHN C[C@@H]1CN(C2CCOCC2)CCN1C(=O)Nc1ccc(C(C)(C)C(F)(F)F)cc1 ZINC000489080987 903183500 /nfs/dbraw/zinc/18/35/00/903183500.db2.gz RPHDQHUVSFTURU-OAHLLOKOSA-N 0 3 413.484 4.244 20 0 HIADHN Cc1ccc(NC(=O)NC[C@H](C)N(C)Cc2ccccc2)cc1C(=O)N(C)C(C)C ZINC000489120341 903211092 /nfs/dbraw/zinc/21/10/92/903211092.db2.gz ZKMRKGLZLHDPJP-IBGZPJMESA-N 0 3 410.562 4.117 20 0 HIADHN Cc1ccc(NC(=O)N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)cc1C(=O)N(C)C(C)C ZINC000489126715 903217121 /nfs/dbraw/zinc/21/71/21/903217121.db2.gz IKHKQGVECFNSFK-UGKGYDQZSA-N 0 3 422.573 4.260 20 0 HIADHN COc1cc(Cl)ccc1CNC(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000489191987 903250493 /nfs/dbraw/zinc/25/04/93/903250493.db2.gz CEPFDUMOZXGLIY-UHFFFAOYSA-N 0 3 401.938 4.155 20 0 HIADHN CCN(CCNC(=O)N(Cc1ccccc1)C1CCN(C)CC1)c1ccccc1C ZINC000489301696 903319407 /nfs/dbraw/zinc/31/94/07/903319407.db2.gz SBEIKZWUQCWHST-UHFFFAOYSA-N 0 3 408.590 4.127 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)N[C@@H]2CCCOc3ccc(F)cc32)CC1 ZINC000489317708 903327820 /nfs/dbraw/zinc/32/78/20/903327820.db2.gz NSTQNGPGAYXQRY-JOCHJYFZSA-N 0 3 411.521 4.345 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)NCCc2ccc3ccccc3n2)CC1 ZINC000489370707 903350234 /nfs/dbraw/zinc/35/02/34/903350234.db2.gz OHHWTOLATRWFII-UHFFFAOYSA-N 0 3 402.542 4.083 20 0 HIADHN Cc1cccc(C)c1OC[C@H](C)NC(=O)N(Cc1ccccc1)C1CCN(C)CC1 ZINC000489399085 903367309 /nfs/dbraw/zinc/36/73/09/903367309.db2.gz IMGIULCFDLRSBA-NRFANRHFSA-N 0 3 409.574 4.377 20 0 HIADHN Cc1cc(NC(=O)N(CCN(C)C)Cc2cccc(C)c2)n(Cc2ccccc2)n1 ZINC000489508573 903430496 /nfs/dbraw/zinc/43/04/96/903430496.db2.gz IGDSAIRQEPAEAR-UHFFFAOYSA-N 0 3 405.546 4.144 20 0 HIADHN Cc1ccc(-c2nc(CNC(=O)N(Cc3ccccc3)C3CCN(C)CC3)co2)cc1 ZINC000489521088 903436103 /nfs/dbraw/zinc/43/61/03/903436103.db2.gz JHUDYHBZWILPRK-UHFFFAOYSA-N 0 3 418.541 4.456 20 0 HIADHN Cc1ccc(NC(=O)N[C@H](C)CN(C)Cc2ccccc2)cc1C(=O)N(C)C(C)C ZINC000489549875 903457969 /nfs/dbraw/zinc/45/79/69/903457969.db2.gz OZDPSLBUDNTNNB-LJQANCHMSA-N 0 3 410.562 4.117 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)NCCc2cccc3cccnc32)CC1 ZINC000489553911 903460774 /nfs/dbraw/zinc/46/07/74/903460774.db2.gz SROFVHCVSZJXTF-UHFFFAOYSA-N 0 3 402.542 4.083 20 0 HIADHN Cc1cc(Cl)c2c(c1)[C@@H](NCCCS(=O)(=O)Cc1ccccc1)CCCO2 ZINC000489632387 903508259 /nfs/dbraw/zinc/50/82/59/903508259.db2.gz QAUINUACCFIVSS-FQEVSTJZSA-N 0 3 407.963 4.457 20 0 HIADHN COc1ccc(CNC2(C(=O)Nc3ccc(OC)c(OC)c3)CCCC2)cc1Cl ZINC000489634372 903509559 /nfs/dbraw/zinc/50/95/59/903509559.db2.gz NEMDSECSWIWKRD-UHFFFAOYSA-N 0 3 418.921 4.407 20 0 HIADHN CCN(C)[C@H](C(=O)Nc1cccc(NC(=O)CN2CCCCCC2)c1)c1ccccc1 ZINC000489901100 903661309 /nfs/dbraw/zinc/66/13/09/903661309.db2.gz QDKDSIYNZMLVAD-DEOSSOPVSA-N 0 3 422.573 4.133 20 0 HIADHN CNS(=O)(=O)c1ccc([C@H](C)N[C@@H](C)c2ccc(Oc3cccnc3)cc2)cc1 ZINC000489955281 903696017 /nfs/dbraw/zinc/69/60/17/903696017.db2.gz JDSFWEOSJPPYEA-IRXDYDNUSA-N 0 3 411.527 4.194 20 0 HIADHN Cc1ccc([C@@H]2C[C@@H](C)N(CC(=O)NCC3(c4ccccc4)CCOCC3)C2)cc1 ZINC000490060837 903749896 /nfs/dbraw/zinc/74/98/96/903749896.db2.gz JHTYRWDTZKWTML-FYYLOGMGSA-N 0 3 406.570 4.037 20 0 HIADHN Cc1ccc(C)c([C@@H](NCc2ccnc(N3CCN(C)CC3)c2)c2ccccc2)c1 ZINC000490128850 903781758 /nfs/dbraw/zinc/78/17/58/903781758.db2.gz ATUNQPQMPIMVTC-SANMLTNESA-N 0 3 400.570 4.329 20 0 HIADHN CCc1ccc([C@@H](NCCN2CCCC[C@H]2C)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000490168110 903806383 /nfs/dbraw/zinc/80/63/83/903806383.db2.gz RHQATTVXVZAAFH-NTKDMRAZSA-N 0 3 414.615 4.206 20 0 HIADHN CCc1ccc([C@H](NC[C@H](CC)N2CCCC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000490171907 903809066 /nfs/dbraw/zinc/80/90/66/903809066.db2.gz JONKECLJKPHIJQ-UPVQGACJSA-N 0 3 414.615 4.206 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)N[C@H]2CCCOc3ccccc32)N(C)C)cc1 ZINC000490195543 903820673 /nfs/dbraw/zinc/82/06/73/903820673.db2.gz BMKJAYJHPADOLK-FCHUYYIVSA-N 0 3 411.546 4.290 20 0 HIADHN CCOc1cc(CN(CC)Cc2cccc(F)c2)ccc1O[C@H](C)C(=O)N(C)C ZINC000506054890 914753504 /nfs/dbraw/zinc/75/35/04/914753504.db2.gz DXJUNTPNDAUAFH-QGZVFWFLSA-N 0 3 402.510 4.102 20 0 HIADHN O=C(Nc1ccc(C(=O)C2CCC2)cc1)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000490287508 903877226 /nfs/dbraw/zinc/87/72/26/903877226.db2.gz MKRUIRLSUDEWQY-UHFFFAOYSA-N 0 3 406.526 4.126 20 0 HIADHN CC[C@@H](CNC(=O)N[C@@H](c1ccccc1)c1ccncc1)N1CCc2ccccc2C1 ZINC000490289951 903879117 /nfs/dbraw/zinc/87/91/17/903879117.db2.gz RHTLXEJFBSUTKU-DQEYMECFSA-N 0 3 414.553 4.307 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N2CCC[C@H]2c2nc3cc(C)ccc3[nH]2)N(C)C)cc1 ZINC000490325677 903906320 /nfs/dbraw/zinc/90/63/20/903906320.db2.gz BQNKJELDIKLGPU-FCHUYYIVSA-N 0 3 405.546 4.329 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N2CCC[C@H]2c2nc3ccc(C)cc3[nH]2)N(C)C)cc1 ZINC000490325677 903906331 /nfs/dbraw/zinc/90/63/31/903906331.db2.gz BQNKJELDIKLGPU-FCHUYYIVSA-N 0 3 405.546 4.329 20 0 HIADHN CCNC(=O)Nc1ccc(C)c(NC(=O)NCC(C)(C)N2CCc3ccccc3C2)c1 ZINC000490328554 903915914 /nfs/dbraw/zinc/91/59/14/903915914.db2.gz SXFLYTGQBZFHRV-UHFFFAOYSA-N 0 3 423.561 4.095 20 0 HIADHN CCNC(=O)Nc1ccc(C)c(NC(=O)N(Cc2ccccc2)C2CCN(C)CC2)c1 ZINC000490333909 903922833 /nfs/dbraw/zinc/92/28/33/903922833.db2.gz BYQXBQUEDFTLMJ-UHFFFAOYSA-N 0 3 423.561 4.265 20 0 HIADHN COCCCOc1ccccc1NC(=O)NC[C@H](c1ccc(C)cc1)N1CCCC1 ZINC000490340051 903930423 /nfs/dbraw/zinc/93/04/23/903930423.db2.gz LTMVOVVSPPDMGH-JOCHJYFZSA-N 0 3 411.546 4.369 20 0 HIADHN CN(C)CCN(Cc1cccs1)C(=O)c1c[nH]c2cccc(Br)c12 ZINC000490340691 903932035 /nfs/dbraw/zinc/93/20/35/903932035.db2.gz BRSLASPRSHMLFU-UHFFFAOYSA-N 0 3 406.349 4.196 20 0 HIADHN CN1CC[C@@H]2CCN(C(=O)Nc3ccc(OC(F)F)c(Cc4ccccc4)c3)[C@@H]2C1 ZINC000490433717 904007153 /nfs/dbraw/zinc/00/71/53/904007153.db2.gz OHNNMSLEUCRIEW-YLJYHZDGSA-N 0 3 415.484 4.437 20 0 HIADHN CN(CCNC(=O)Nc1cccc(-c2noc(C(F)(F)F)n2)c1)Cc1ccccc1 ZINC000490441874 904013248 /nfs/dbraw/zinc/01/32/48/904013248.db2.gz RCZHWOLQFHLCNU-UHFFFAOYSA-N 0 3 419.407 4.009 20 0 HIADHN O=C(Nc1cc(F)cc(Br)c1F)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000490473439 904029626 /nfs/dbraw/zinc/02/96/26/904029626.db2.gz WIJSBZFEJWIXRC-CQSZACIVSA-N 0 3 410.262 4.123 20 0 HIADHN O=C(Nc1ccc(-c2ccco2)cc1F)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1CO ZINC000490496207 904048512 /nfs/dbraw/zinc/04/85/12/904048512.db2.gz PHEOCFPJEMEHKY-CTNGQTDRSA-N 0 3 423.488 4.090 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2cc(F)cc(Br)c2F)[C@H]1c1ccccc1 ZINC000490515320 904064408 /nfs/dbraw/zinc/06/44/08/904064408.db2.gz VHONSVHJBBYCLC-WMLDXEAASA-N 0 3 410.262 4.294 20 0 HIADHN C[C@@]1(CNC(=O)c2ccc(-c3cncnc3)cc2F)CCCN1Cc1ccccc1 ZINC000490518459 904067161 /nfs/dbraw/zinc/06/71/61/904067161.db2.gz AHYJPYHCONVAHW-DEOSSOPVSA-N 0 3 404.489 4.067 20 0 HIADHN CN(C)[C@@H](CNC(=O)Nc1cc(-c2ccc(Cl)s2)nn1C)c1ccccc1 ZINC000490566697 904105593 /nfs/dbraw/zinc/10/55/93/904105593.db2.gz HJNUANRLRSWKSO-HNNXBMFYSA-N 0 3 403.939 4.226 20 0 HIADHN CN(C(=O)c1c[nH]c2cccc(Br)c12)[C@H]1CCN(Cc2ccccc2)C1 ZINC000490612266 904135427 /nfs/dbraw/zinc/13/54/27/904135427.db2.gz VGWZSLSJNWXJMK-INIZCTEOSA-N 0 3 412.331 4.277 20 0 HIADHN O=C1C[C@@H]([C@H]2CCCCN2Cc2nc3cc(Cl)ccc3n2Cc2ccccc2)CN1 ZINC000490674250 904168022 /nfs/dbraw/zinc/16/80/22/904168022.db2.gz OLDZZZDXYCYEIB-WIYYLYMNSA-N 0 3 422.960 4.229 20 0 HIADHN CC(C)(C)[N@@H+]1C[C@@H](C(=O)Nc2cc(Br)ccc2[O-])[C@H](C(F)(F)F)C1 ZINC000490677682 904169533 /nfs/dbraw/zinc/16/95/33/904169533.db2.gz XZTHORAPLQPMDG-GHMZBOCLSA-N 0 3 409.246 4.002 20 0 HIADHN CC(C)(C)[N@H+]1C[C@@H](C(=O)Nc2cc(Br)ccc2[O-])[C@H](C(F)(F)F)C1 ZINC000490677682 904169541 /nfs/dbraw/zinc/16/95/41/904169541.db2.gz XZTHORAPLQPMDG-GHMZBOCLSA-N 0 3 409.246 4.002 20 0 HIADHN Cc1ccc(-c2nc(CCNC(=O)N[C@@H]3CCN(Cc4ccccc4)[C@@H]3C)co2)cc1 ZINC000490715961 904189696 /nfs/dbraw/zinc/18/96/96/904189696.db2.gz FWYUDSXHZJCPFE-AUSIDOKSSA-N 0 3 418.541 4.155 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)NCc1ccc(OC)cc1C(F)(F)F)c1ccco1 ZINC000490729411 904195786 /nfs/dbraw/zinc/19/57/86/904195786.db2.gz CSYPOBPQKGYWIR-SUMWQHHRSA-N 0 3 413.440 4.236 20 0 HIADHN CN(C)[C@@H](CNC(=O)N[C@@H](c1c[nH]c2ccccc21)C(F)(F)F)c1ccccc1 ZINC000490764428 904217144 /nfs/dbraw/zinc/21/71/44/904217144.db2.gz TWHJKZUSLVPGMV-OALUTQOASA-N 0 3 404.436 4.373 20 0 HIADHN O=C(N[C@@H](c1c[nH]c2ccccc21)C(F)(F)F)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000490794630 904240803 /nfs/dbraw/zinc/24/08/03/904240803.db2.gz JPPVLXJHAIFHEO-JXFKEZNVSA-N 0 3 416.447 4.345 20 0 HIADHN CCC(C)(C)OCc1cccc(NC(=O)C(=O)NC[C@@H](C)N2CCCC[C@@H]2C)c1C ZINC000490854523 904289015 /nfs/dbraw/zinc/28/90/15/904289015.db2.gz VENBUXQXSOLNJO-ZWKOTPCHSA-N 0 3 417.594 4.018 20 0 HIADHN COCCN1CCC(NC(=O)Nc2ccc(Oc3cccc(Cl)c3)cc2)CC1 ZINC000490946517 904330671 /nfs/dbraw/zinc/33/06/71/904330671.db2.gz CILSRTUHSTUJLL-UHFFFAOYSA-N 0 3 403.910 4.365 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CCC(COC)CC1)c1ccc(C(F)(F)F)cc1 ZINC000490952980 904331941 /nfs/dbraw/zinc/33/19/41/904331941.db2.gz TZMAVSNETHXVJU-IBGZPJMESA-N 0 3 415.500 4.156 20 0 HIADHN Cc1ccc([C@@H](NC[C@H](O)C2CCCCC2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000491003908 904364118 /nfs/dbraw/zinc/36/41/18/904364118.db2.gz GPFLOMIUUOCYKD-ZEQRLZLVSA-N 0 3 415.599 4.327 20 0 HIADHN CSc1cccc([C@H](NC[C@@H](C)N2CCN(C)CC2)c2cc(F)ccc2F)c1 ZINC000491036729 904388823 /nfs/dbraw/zinc/38/88/23/904388823.db2.gz ZFZHGITYTADRPI-ZHRRBRCNSA-N 0 3 405.558 4.002 20 0 HIADHN Cc1ccc([C@@H](NCCN(C)C2CCCC2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000491042930 904391817 /nfs/dbraw/zinc/39/18/17/904391817.db2.gz YLTBNCBJYSOLJC-DEOSSOPVSA-N 0 3 414.615 4.260 20 0 HIADHN C[C@@H](C1CC1)n1cc(NC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)cn1 ZINC000491068616 904408907 /nfs/dbraw/zinc/40/89/07/904408907.db2.gz NHTQTKPYXMSBAV-MGPUTAFESA-N 0 3 406.452 4.247 20 0 HIADHN C[C@@H](C1CC1)n1cc(NC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)cn1 ZINC000491068618 904409045 /nfs/dbraw/zinc/40/90/45/904409045.db2.gz NHTQTKPYXMSBAV-YWZLYKJASA-N 0 3 406.452 4.247 20 0 HIADHN CCCc1nc(C)c(CNC(=O)NC[C@@H](c2ccc(CC(C)C)cc2)N(C)C)o1 ZINC000491079185 904416689 /nfs/dbraw/zinc/41/66/89/904416689.db2.gz JJQCJQAYFPKVCA-FQEVSTJZSA-N 0 3 400.567 4.236 20 0 HIADHN O=C(C1CCN(Cc2cc3ccccc3nc2N2CCCCC2)CC1)N1CCCCC1 ZINC000506116423 914809605 /nfs/dbraw/zinc/80/96/05/914809605.db2.gz XETKJHALICIDOD-UHFFFAOYSA-N 0 3 420.601 4.450 20 0 HIADHN Cc1cccc2ncc(CN3CCC[C@@H](c4nnc5ccc(C(F)(F)F)cn54)C3)n21 ZINC000506129285 914815401 /nfs/dbraw/zinc/81/54/01/914815401.db2.gz UXJNQWPNIXBRAV-OAHLLOKOSA-N 0 3 414.435 4.084 20 0 HIADHN COc1ccc([C@H](CN[C@H](c2cnn(C)c2)c2cccc(F)c2)N2CCCC2)cc1 ZINC000491258683 904506422 /nfs/dbraw/zinc/50/64/22/904506422.db2.gz FUOMGCHXZNNNEN-ZEQRLZLVSA-N 0 3 408.521 4.084 20 0 HIADHN Clc1ccc(N2CC[C@@H](NCc3cnnn3Cc3ccccc3)C2)cc1Cl ZINC000491270374 904511799 /nfs/dbraw/zinc/51/17/99/904511799.db2.gz HQXMCZNQHMSAOA-MRXNPFEDSA-N 0 3 402.329 4.002 20 0 HIADHN CN1CC[C@H]2CCN(C(=O)Nc3ncc(Cc4ccc(C(F)(F)F)cc4)s3)[C@@H]2C1 ZINC000491304910 904525978 /nfs/dbraw/zinc/52/59/78/904525978.db2.gz LAESKIMAKNNYNL-WMLDXEAASA-N 0 3 424.492 4.311 20 0 HIADHN O=S1(=O)CC[C@@H](CN[C@@H](c2ccc(Cl)cc2)c2ccc(OC(F)F)cc2)C1 ZINC000491316821 904534768 /nfs/dbraw/zinc/53/47/68/904534768.db2.gz MTIJAXMOFVCLAF-UGSOOPFHSA-N 0 3 415.889 4.055 20 0 HIADHN NS(=O)(=O)c1ccc(CCN[C@H](c2cccc(F)c2)c2cccc(Cl)c2)cc1 ZINC000491331686 904540798 /nfs/dbraw/zinc/54/07/98/904540798.db2.gz YWRXFEXHHNWQCK-NRFANRHFSA-N 0 3 418.921 4.048 20 0 HIADHN COc1ccc([C@H](NC[C@H](c2ccc(C)o2)N2CCOCC2)c2ccc(F)cc2)cc1 ZINC000491410822 904582374 /nfs/dbraw/zinc/58/23/74/904582374.db2.gz RZZJDXYNMHAONC-ILBGXUMGSA-N 0 3 424.516 4.488 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Nc1cc(F)c(OC(F)F)cc1F ZINC000491421663 904588622 /nfs/dbraw/zinc/58/86/22/904588622.db2.gz ZBTPQHAUHCQWDB-YVEFUNNKSA-N 0 3 411.399 4.208 20 0 HIADHN CN(C)C1(CN[C@H](c2ccc(F)cc2)c2cccc(S(C)(=O)=O)c2)CCCCC1 ZINC000491425019 904590804 /nfs/dbraw/zinc/59/08/04/904590804.db2.gz YTCLOQAHYGPNNW-JOCHJYFZSA-N 0 3 418.578 4.173 20 0 HIADHN O=C(Nc1cccc(OCC(F)(F)F)c1)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000491431418 904593904 /nfs/dbraw/zinc/59/39/04/904593904.db2.gz FLKBPKCAFYBDGU-UHFFFAOYSA-N 0 3 422.447 4.084 20 0 HIADHN CC[C@@H](C)NC(=O)c1ccc(NC(=O)N(CCN(C)C)Cc2cccc(C)c2)cc1 ZINC000491467976 904610249 /nfs/dbraw/zinc/61/02/49/904610249.db2.gz LTMFXEHLFFJTOY-LJQANCHMSA-N 0 3 410.562 4.119 20 0 HIADHN CC[C@@H](C)NC(=O)c1ccc(NC(=O)N(CCN(C)C)Cc2cccc(C)c2)c(C)c1 ZINC000491479873 904617071 /nfs/dbraw/zinc/61/70/71/904617071.db2.gz NLMLNYMXVLZPLK-HXUWFJFHSA-N 0 3 424.589 4.427 20 0 HIADHN C[C@@H](c1ccccc1Br)N(C)C(=O)NC[C@H](c1ccccc1)N(C)C ZINC000506167257 914831559 /nfs/dbraw/zinc/83/15/59/914831559.db2.gz UVBYILDENVXFPD-HNAYVOBHSA-N 0 3 404.352 4.454 20 0 HIADHN CCCCc1nc2cc(NC(=O)c3ccc(CN4CCC(CO)CC4)cc3)ccc2[nH]1 ZINC000491759242 904692914 /nfs/dbraw/zinc/69/29/14/904692914.db2.gz STXRYJYZGSXDOA-UHFFFAOYSA-N 0 3 420.557 4.362 20 0 HIADHN CN(C)Cc1cccc(C(=O)Nc2cccc(S(=O)(=O)C3CCCCC3)c2)c1 ZINC000491837353 904708851 /nfs/dbraw/zinc/70/88/51/904708851.db2.gz KRIAINXRUHBSDP-UHFFFAOYSA-N 0 3 400.544 4.107 20 0 HIADHN COc1cc(NC(=O)N(CCN(C)C)Cc2cccc(C)c2)c(OC)cc1Cl ZINC000491866296 904716067 /nfs/dbraw/zinc/71/60/67/904716067.db2.gz OTEVFZWBHAHRFE-UHFFFAOYSA-N 0 3 405.926 4.261 20 0 HIADHN Cc1cccc(CN(CCN(C)C)C(=O)Nc2cccc(N3CCCCC3=O)c2)c1 ZINC000491898416 904722828 /nfs/dbraw/zinc/72/28/28/904722828.db2.gz GCVSMEJGDCCHAF-UHFFFAOYSA-N 0 3 408.546 4.108 20 0 HIADHN C[C@@H]1[C@H](NC(=O)N[C@@H](c2ccccc2)c2ccncc2)CCN1Cc1ccccc1 ZINC000491997529 904754779 /nfs/dbraw/zinc/75/47/79/904754779.db2.gz ILSFZDHVGHEDSQ-FOVJLYNBSA-N 0 3 400.526 4.133 20 0 HIADHN C[C@H](NCc1cc(Br)c2c(c1)OCCCO2)[C@@H]1OCCc2sccc21 ZINC000492021954 904762026 /nfs/dbraw/zinc/76/20/26/904762026.db2.gz HDNAHICWLRNSDU-SGTLLEGYSA-N 0 3 424.360 4.464 20 0 HIADHN C[C@@H](NCc1cnn(-c2ccc(Br)cc2)c1)[C@H]1OCCc2sccc21 ZINC000492192544 904811965 /nfs/dbraw/zinc/81/19/65/904811965.db2.gz HLRQKZOHNLXRBQ-BFUOFWGJSA-N 0 3 418.360 4.488 20 0 HIADHN C[C@H](NCc1cnn(-c2ccc(Br)cc2)c1)[C@@H]1OCCc2sccc21 ZINC000492192545 904812241 /nfs/dbraw/zinc/81/22/41/904812241.db2.gz HLRQKZOHNLXRBQ-DJJJIMSYSA-N 0 3 418.360 4.488 20 0 HIADHN COC(=O)c1cc2cc(CN3CCC(n4ccc(C(F)(F)F)n4)CC3)ccc2o1 ZINC000492348549 904836515 /nfs/dbraw/zinc/83/65/15/904836515.db2.gz CNJCZUSNFDQHTL-UHFFFAOYSA-N 0 3 407.392 4.272 20 0 HIADHN CC[C@H](CNC(=O)c1cccc(Oc2ccncc2)c1)N1CCc2ccccc2C1 ZINC000492491331 904859582 /nfs/dbraw/zinc/85/95/82/904859582.db2.gz SETAARIELIEFOV-JOCHJYFZSA-N 0 3 401.510 4.441 20 0 HIADHN COc1ccc([C@@H](N[C@H](C)CN2CCOCC2)c2ccc(C(F)(F)F)cc2)cc1 ZINC000492517444 904863928 /nfs/dbraw/zinc/86/39/28/904863928.db2.gz XLYRYBLRQLXFLH-IERDGZPVSA-N 0 3 408.464 4.114 20 0 HIADHN Cc1nc(-c2ccccc2)sc1CNC(=O)N[C@H](CN(C)C)c1ccc(F)cc1 ZINC000492599925 904874918 /nfs/dbraw/zinc/87/49/18/904874918.db2.gz FJZFESGABZPEFX-LJQANCHMSA-N 0 3 412.534 4.360 20 0 HIADHN Cc1nc(COc2ccc(CN(C)Cc3cccc(Br)c3)cc2)no1 ZINC000506236904 914857251 /nfs/dbraw/zinc/85/72/51/914857251.db2.gz UPUWZAWUPHKPEN-UHFFFAOYSA-N 0 3 402.292 4.352 20 0 HIADHN CCc1ccc([C@H](N[C@@H]2C[C@H](OC)C2(C)C)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000493011009 904989301 /nfs/dbraw/zinc/98/93/01/904989301.db2.gz SEQRPGCNPZFLSR-FSSWDIPSSA-N 0 3 401.572 4.145 20 0 HIADHN Cc1ccc([C@@H](NCCc2cscn2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000493035960 904997404 /nfs/dbraw/zinc/99/74/04/904997404.db2.gz OCTLHNJJCMIJRR-NRFANRHFSA-N 0 3 400.569 4.085 20 0 HIADHN Cc1ccc([C@H](NCC2(CCO)CCCC2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000493050456 905002646 /nfs/dbraw/zinc/00/26/46/905002646.db2.gz CCVFHPVOQSWPLX-HSZRJFAPSA-N 0 3 415.599 4.329 20 0 HIADHN O=C(Nc1ccccc1OC1CCCC1)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000493099702 905017296 /nfs/dbraw/zinc/01/72/96/905017296.db2.gz YCNMJAFVTYPWDH-UHFFFAOYSA-N 0 3 408.542 4.465 20 0 HIADHN CN(C)Cc1ccccc1CNC(=O)Cc1csc(Cc2cccc(Cl)c2)n1 ZINC000493129489 905025852 /nfs/dbraw/zinc/02/58/52/905025852.db2.gz FPMNXIHGZWIODB-UHFFFAOYSA-N 0 3 413.974 4.308 20 0 HIADHN CC(=O)N1CC[C@@H](NCc2cc(Cl)c3c(c2)OCCCO3)c2ccccc2C1 ZINC000493156042 905036471 /nfs/dbraw/zinc/03/64/71/905036471.db2.gz WOGMVZZVBKNTGO-HXUWFJFHSA-N 0 3 400.906 4.084 20 0 HIADHN Cc1ccc([C@H](NC[C@]2(C)CCCC[C@H]2O)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000493175766 905038650 /nfs/dbraw/zinc/03/86/50/905038650.db2.gz LSVSUMWKUJVZGY-VJBWXMMDSA-N 0 3 401.572 4.019 20 0 HIADHN Cc1ccc([C@H](NC[C@@]2(C)CCCC[C@H]2O)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000493175767 905039424 /nfs/dbraw/zinc/03/94/24/905039424.db2.gz LSVSUMWKUJVZGY-XPWALMASSA-N 0 3 401.572 4.019 20 0 HIADHN CCc1ccc([C@H](NC[C@@]2(C)CCCC[C@@H]2O)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000493203596 905048793 /nfs/dbraw/zinc/04/87/93/905048793.db2.gz JHABFPCSFKAIOH-KMDXXIMOSA-N 0 3 415.599 4.273 20 0 HIADHN Fc1cc(Br)ccc1[C@@H](NCCCO[C@H]1CCOC1)c1ccccc1 ZINC000493279079 905075799 /nfs/dbraw/zinc/07/57/99/905075799.db2.gz XBVQJFLMDKHMKA-PXNSSMCTSA-N 0 3 408.311 4.463 20 0 HIADHN Cc1ccc(-c2cc(C(=O)N3CC[C@H]4CCN(C)C[C@H]43)c3cnn(C(C)C)c3n2)s1 ZINC000493412190 905111578 /nfs/dbraw/zinc/11/15/78/905111578.db2.gz VDWBPCHWRBNXCX-OXQOHEQNSA-N 0 3 423.586 4.215 20 0 HIADHN COc1cc(C(=O)N2CC[C@@H]3CCN(C)C[C@H]32)ccc1OCc1ccccc1Cl ZINC000493556333 905161325 /nfs/dbraw/zinc/16/13/25/905161325.db2.gz PZQIHACJVIJISW-OXJNMPFZSA-N 0 3 414.933 4.094 20 0 HIADHN Cc1cccnc1NC(=O)N(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000493916415 905268179 /nfs/dbraw/zinc/26/81/79/905268179.db2.gz JOWMBWXFOLGKIC-QHCPKHFHSA-N 0 3 415.541 4.484 20 0 HIADHN O=[S@](CCN[C@@H]1CCO[C@@H]1c1ccc(F)c(F)c1)c1cc(Cl)ccc1Cl ZINC000493983361 905328253 /nfs/dbraw/zinc/32/82/53/905328253.db2.gz DIOAXRQCCBGCFL-LBISXTPBSA-N 0 3 420.308 4.499 20 0 HIADHN COCCC(=O)N1CCC(N[C@@H](c2ccc(F)cc2)c2ccccc2Cl)CC1 ZINC000493996007 905336575 /nfs/dbraw/zinc/33/65/75/905336575.db2.gz HPVVCFKMOQUWKL-QFIPXVFZSA-N 0 3 404.913 4.186 20 0 HIADHN CS(=O)(=O)C1CCC(N[C@H](c2ccccc2)c2ccccc2Br)CC1 ZINC000493997413 905339832 /nfs/dbraw/zinc/33/98/32/905339832.db2.gz VYFAVRRDIBVTQE-LBXVMSDZSA-N 0 3 422.388 4.484 20 0 HIADHN Cc1nc(COc2ccccc2C(=O)N[C@H]2CCN(Cc3ccccc3)[C@H]2C)cs1 ZINC000494005600 905345448 /nfs/dbraw/zinc/34/54/48/905345448.db2.gz AUEQRMBMEBQADZ-JTSKRJEESA-N 0 3 421.566 4.423 20 0 HIADHN COc1ccc([C@H](NC2CCC(C(N)=O)CC2)c2ccccc2Cl)cc1OC ZINC000494038633 905380390 /nfs/dbraw/zinc/38/03/90/905380390.db2.gz LSUWLMLLBODVFT-LGHNAOJLSA-N 0 3 402.922 4.080 20 0 HIADHN NC(=O)C1CCC(N[C@H](c2ccc(Br)cc2)c2ccccc2F)CC1 ZINC000494040411 905382677 /nfs/dbraw/zinc/38/26/77/905382677.db2.gz SOBCDMUPUYLVJW-GSQSYGFSSA-N 0 3 405.311 4.311 20 0 HIADHN O[C@H](CN[C@H](c1cccc(F)c1)c1cccc(Br)c1)C1CCOCC1 ZINC000494047021 905385708 /nfs/dbraw/zinc/38/57/08/905385708.db2.gz FZIBKPZKJNTSKY-UXHICEINSA-N 0 3 408.311 4.055 20 0 HIADHN C[C@@H]1[C@H](NC(=O)c2cc(NC(=O)C(C)(C)C)ccc2F)CCN1Cc1ccccc1 ZINC000494046242 905386214 /nfs/dbraw/zinc/38/62/14/905386214.db2.gz FFHJPOBRBQYVTG-IIBYNOLFSA-N 0 3 411.521 4.203 20 0 HIADHN C[C@H]1[C@@H](NC(=O)c2cc(NC(=O)C(C)(C)C)ccc2F)CCN1Cc1ccccc1 ZINC000494046243 905386779 /nfs/dbraw/zinc/38/67/79/905386779.db2.gz FFHJPOBRBQYVTG-KKSFZXQISA-N 0 3 411.521 4.203 20 0 HIADHN O[C@@H](CN[C@H](c1ccc(Cl)cc1)c1ccc(OC(F)F)cc1)C1CCOCC1 ZINC000494050804 905389005 /nfs/dbraw/zinc/38/90/05/905389005.db2.gz TWFSPTAKDYJCMW-VQTJNVASSA-N 0 3 411.876 4.408 20 0 HIADHN C[C@@H](NC(=O)N1CCN(C2CCOCC2)C[C@@H]1C)c1cc(F)c(Cl)cc1Cl ZINC000494238580 905563778 /nfs/dbraw/zinc/56/37/78/905563778.db2.gz RSSBEGGRZOACLF-QWHCGFSZSA-N 0 3 418.340 4.088 20 0 HIADHN C[C@H](O)C[C@H]1CCCCCN1CC(=O)N[C@@H](c1cccs1)c1ccc(F)cc1 ZINC000512434421 921158587 /nfs/dbraw/zinc/15/85/87/921158587.db2.gz XJEARBHESGVQTR-DKZVUGQWSA-N 0 3 404.551 4.108 20 0 HIADHN C[C@H](O)C[C@H]1CCCCCN1CC(=O)Nc1cccc(CSc2ccccn2)c1 ZINC000512434170 921158908 /nfs/dbraw/zinc/15/89/08/921158908.db2.gz UZLDAVXYYUWODA-GHTZIAJQSA-N 0 3 413.587 4.328 20 0 HIADHN Cc1ccnc(-c2n[nH]c([C@@H](C)N[C@@H](C)Cc3ccc(Br)c(F)c3)n2)c1 ZINC000494374217 905671073 /nfs/dbraw/zinc/67/10/73/905671073.db2.gz IXRZTYUKFKXPRI-QWHCGFSZSA-N 0 3 418.314 4.359 20 0 HIADHN OCC1(CN[C@@H](c2ccc(Cl)cc2)c2ccc(OC(F)F)cc2)CCOCC1 ZINC000494460705 905744262 /nfs/dbraw/zinc/74/42/62/905744262.db2.gz YRXBTSKHLOSXJN-IBGZPJMESA-N 0 3 411.876 4.410 20 0 HIADHN C[C@H](N[C@@H]1CCO[C@@H]1c1ccc(Cl)cc1)C(=O)N1CCSc2ccccc21 ZINC000494476177 905756990 /nfs/dbraw/zinc/75/69/90/905756990.db2.gz UYLSMIKOYBBLJB-JNAXZKDPSA-N 0 3 402.947 4.287 20 0 HIADHN COC[C@H](N[C@H](C)CC(=O)Nc1cc(OC)ccc1OC)c1ccc(Cl)cc1 ZINC000494480507 905760708 /nfs/dbraw/zinc/76/07/08/905760708.db2.gz ZSWIKPXZNWJPPJ-KUHUBIRLSA-N 0 3 406.910 4.052 20 0 HIADHN COc1ccc(CN2CCC[C@@H](CNC(=O)C(C)C)C2)cc1OCc1ccccc1 ZINC000512456820 921174858 /nfs/dbraw/zinc/17/48/58/921174858.db2.gz OSBAGPCZPQHKTK-QFIPXVFZSA-N 0 3 410.558 4.258 20 0 HIADHN Cc1ccc(NC(=O)NC(=O)[C@H](C)N[C@H]2CCO[C@@H]2c2ccc(Cl)cc2)c(C)c1 ZINC000494493171 905779068 /nfs/dbraw/zinc/77/90/68/905779068.db2.gz HZVNNNXYJPMCSD-RYGJVYDSSA-N 0 3 415.921 4.113 20 0 HIADHN O=C(Nc1cccc(CC(F)(F)F)c1)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000494646595 905880012 /nfs/dbraw/zinc/88/00/12/905880012.db2.gz HQOBCPIYNKJPSK-UHFFFAOYSA-N 0 3 406.448 4.248 20 0 HIADHN Cc1cc(NC(=O)Nc2cc(C(C)C)[nH]n2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000494649786 905882263 /nfs/dbraw/zinc/88/22/63/905882263.db2.gz NTPMGVZCJBRDBS-SFHVURJKSA-N 0 3 407.522 4.129 20 0 HIADHN C[C@@H](NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1)c1nc(C(F)(F)F)cs1 ZINC000494704754 905910258 /nfs/dbraw/zinc/91/02/58/905910258.db2.gz WRUFQRGDOJPQLH-UKRRQHHQSA-N 0 3 412.481 4.187 20 0 HIADHN C[C@@H](c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCN(C[C@@H]2CCOC2)CC1 ZINC000494705409 905912588 /nfs/dbraw/zinc/91/25/88/905912588.db2.gz ZDKWOOAYJFHCTE-KBPBESRZSA-N 0 3 410.402 4.439 20 0 HIADHN Cc1ccc([C@H](NCC(C)(C)[C@@H](O)C(C)C)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000494714505 905916734 /nfs/dbraw/zinc/91/67/34/905916734.db2.gz IZUZRWYFIKJIHS-VXKWHMMOSA-N 0 3 403.588 4.121 20 0 HIADHN CCNC(=O)C(C)(C)CN[C@H](c1cccc(F)c1)c1cccc(Br)c1 ZINC000494730346 905929184 /nfs/dbraw/zinc/92/91/84/905929184.db2.gz LJCRPGKNKYNZIH-SFHVURJKSA-N 0 3 407.327 4.430 20 0 HIADHN CSC[C@@H](O)CN[C@@H](COc1cccc(F)c1)c1cccc(C(F)(F)F)c1 ZINC000494793555 905994657 /nfs/dbraw/zinc/99/46/57/905994657.db2.gz VHLIHYOEJDTEIC-WMZOPIPTSA-N 0 3 403.441 4.278 20 0 HIADHN C[C@@H]1CN(C2CCOCC2)CCN1C(=O)N[C@@H](c1ccc(Cl)cc1)C1CCCC1 ZINC000494857943 906041242 /nfs/dbraw/zinc/04/12/42/906041242.db2.gz HXULDQWWBJKZMP-VGOFRKELSA-N 0 3 419.997 4.466 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)C(C)(C)CCCc3ccccc3)CC2)C[C@@H](C)O1 ZINC000494955306 906127297 /nfs/dbraw/zinc/12/72/97/906127297.db2.gz SKNWOXJPFGHTLB-NHCUHLMSSA-N 0 3 400.607 4.383 20 0 HIADHN C[C@H](NC(=O)N(CCN(C)C)Cc1cccc(Cl)c1)[C@H]1OCCc2sccc21 ZINC000494962289 906132147 /nfs/dbraw/zinc/13/21/47/906132147.db2.gz XEANFQPFPIECTP-MGPUTAFESA-N 0 3 421.994 4.177 20 0 HIADHN CCc1ccc([C@@H](NCC2([C@H](O)C(C)C)CC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000494966965 906135714 /nfs/dbraw/zinc/13/57/14/906135714.db2.gz CUAQPIOZUSMMGY-DHIUTWEWSA-N 0 3 415.599 4.129 20 0 HIADHN Cc1noc(C)c1[C@@H](C)CN[C@@H](c1ccc(C)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000494990953 906153925 /nfs/dbraw/zinc/15/39/25/906153925.db2.gz YGPQGHHQZOLRAY-HJPURHCSSA-N 0 3 412.555 4.486 20 0 HIADHN Fc1ccc([C@H](C[C@H]2CCOC2)NCc2cc(F)ccc2N2CCOCC2)cc1 ZINC000495041734 906198345 /nfs/dbraw/zinc/19/83/45/906198345.db2.gz VDYGRFWNFGPPKQ-VGSWGCGISA-N 0 3 402.485 4.059 20 0 HIADHN COc1cc(C)c(NC(=O)NC[C@@H]2CN(Cc3ccccc3)CCCO2)c(C)c1C ZINC000495049081 906204131 /nfs/dbraw/zinc/20/41/31/906204131.db2.gz OCVFMSPOUUIBPZ-OAQYLSRUSA-N 0 3 411.546 4.033 20 0 HIADHN CC1CCN([C@@H](CNC(=O)c2ccc3c(c2)C(C)(C)C(=O)N3)c2ccccc2)CC1 ZINC000495050838 906206160 /nfs/dbraw/zinc/20/61/60/906206160.db2.gz MVHRNODRRBLZAK-QFIPXVFZSA-N 0 3 405.542 4.119 20 0 HIADHN CC(C)(C)[C@@H](CN1CCc2ccccc2C1)NC(=O)N1CCCC2(CCOCC2)C1 ZINC000495231650 906323678 /nfs/dbraw/zinc/32/36/78/906323678.db2.gz IUPFCGIMFCKWDT-JOCHJYFZSA-N 0 3 413.606 4.062 20 0 HIADHN Cc1ccc(-c2noc(CCCN[C@@H](c3nnc4ccccn43)C(C)C)n2)cc1F ZINC000495373870 906413068 /nfs/dbraw/zinc/41/30/68/906413068.db2.gz JSJSCRBQQUHNJX-HXUWFJFHSA-N 0 3 408.481 4.146 20 0 HIADHN Cn1ncc(Br)c1CNCC1(c2ccc(Br)s2)CCC1 ZINC000512556982 921233931 /nfs/dbraw/zinc/23/39/31/921233931.db2.gz JNSZZIWTAVTHES-UHFFFAOYSA-N 0 3 419.186 4.218 20 0 HIADHN C[C@H](NCCNc1cccc(Br)c1)c1ccc(-n2cncn2)cc1Cl ZINC000495395467 906425348 /nfs/dbraw/zinc/42/53/48/906425348.db2.gz FCLWQGWHDSLUCI-ZDUSSCGKSA-N 0 3 420.742 4.446 20 0 HIADHN Cc1ccc(C(F)(F)F)cc1NC(=O)c1ccc(CN2CCC(CO)CC2)cc1 ZINC000495399118 906427429 /nfs/dbraw/zinc/42/74/29/906427429.db2.gz BSXMOXSFKRVNMD-UHFFFAOYSA-N 0 3 406.448 4.470 20 0 HIADHN CCC[C@@H](C)NC(=O)[C@@H]1CCCN(Cc2cn(C)nc2-c2ccccc2Cl)C1 ZINC000512557296 921235198 /nfs/dbraw/zinc/23/51/98/921235198.db2.gz OTVVQMROEUAFHT-IAGOWNOFSA-N 0 3 402.970 4.257 20 0 HIADHN Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)N[C@@H](C)c1cccc(N2CCOCC2)c1 ZINC000495415414 906438109 /nfs/dbraw/zinc/43/81/09/906438109.db2.gz PSVDWYKRXFHNBL-GJZGRUSLSA-N 0 3 410.484 4.311 20 0 HIADHN COc1ccc(NC(=O)C[C@H](C)N[C@@H]2CCCOc3c(F)cccc32)c(OC)c1 ZINC000495425467 906443012 /nfs/dbraw/zinc/44/30/12/906443012.db2.gz BJAMGLRGDYWFCV-KBXCAEBGSA-N 0 3 402.466 4.064 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)N[C@@H](C)c2nc(C(C)(C)C)cs2)cc1 ZINC000495455621 906461602 /nfs/dbraw/zinc/46/16/02/906461602.db2.gz PRGSJYIBJJZXDV-WMLDXEAASA-N 0 3 404.580 4.112 20 0 HIADHN Cc1ccc2nc(-c3ccc(NC(=O)[C@H](C)N[C@H](C)Cn4cccn4)cc3)sc2c1 ZINC000495470402 906470981 /nfs/dbraw/zinc/47/09/81/906470981.db2.gz NTOAFCPJMYQKNH-SJORKVTESA-N 0 3 419.554 4.474 20 0 HIADHN Cc1nn(C)c(=O)c(-c2nc(CN[C@@H](Cc3ccc(F)cc3)C(C)C)cs2)c1C ZINC000495518192 906495510 /nfs/dbraw/zinc/49/55/10/906495510.db2.gz VROHIZVPOUVWEZ-IBGZPJMESA-N 0 3 414.550 4.017 20 0 HIADHN O=C(NC[C@@]1(O)CCN(Cc2ccccc2)C1)Nc1cccc(-c2ccccc2)c1 ZINC000495560222 906502401 /nfs/dbraw/zinc/50/24/01/906502401.db2.gz DIEADRHGNVWPBQ-VWLOTQADSA-N 0 3 401.510 4.112 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)c1cc2c(cccc2Br)[nH]1 ZINC000495982558 906591338 /nfs/dbraw/zinc/59/13/38/906591338.db2.gz OYESTSJFUQHKHJ-UHFFFAOYSA-N 0 3 400.320 4.134 20 0 HIADHN CCc1ccc(C(=O)CCC(=O)N(Cc2ccncc2)C[C@H]2CCCN2CC)cc1 ZINC000496247498 906638702 /nfs/dbraw/zinc/63/87/02/906638702.db2.gz WQJIAFULPVKPGZ-HSZRJFAPSA-N 0 3 407.558 4.120 20 0 HIADHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)c1cnn(-c2cccc(Cl)c2)c1 ZINC000496262491 906642825 /nfs/dbraw/zinc/64/28/25/906642825.db2.gz LNANKLUYZFEBKH-JOCHJYFZSA-N 0 3 423.948 4.047 20 0 HIADHN COc1cc(C(=O)N(CCN(C)C)Cc2ccccc2F)ccc1OC1CCCC1 ZINC000496423933 906676186 /nfs/dbraw/zinc/67/61/86/906676186.db2.gz MTHJCUZRGBQAQD-UHFFFAOYSA-N 0 3 414.521 4.360 20 0 HIADHN O=C(c1cc2c(s1)CCOC2)N(CCN1CCCC1)Cc1ccc(Cl)cc1 ZINC000496802197 906758876 /nfs/dbraw/zinc/75/88/76/906758876.db2.gz HGQLIBLEHILSKS-UHFFFAOYSA-N 0 3 404.963 4.212 20 0 HIADHN O=C(c1ccc(N2CCCC2)nc1)N(CCN1CCCC1)Cc1ccc(Cl)cc1 ZINC000496915774 906780594 /nfs/dbraw/zinc/78/05/94/906780594.db2.gz UCPVDNHQXKXDSK-UHFFFAOYSA-N 0 3 412.965 4.073 20 0 HIADHN COc1ccc(OC(F)F)c(CNCCOc2cccc(Br)c2)c1 ZINC000497213229 906821147 /nfs/dbraw/zinc/82/11/47/906821147.db2.gz FOVKEGYMRFZNFW-UHFFFAOYSA-N 0 3 402.235 4.228 20 0 HIADHN CC(C)c1noc2nc(C3CC3)cc(C(=O)NC[C@@H](Cc3ccccc3)N(C)C)c21 ZINC000497324146 906832578 /nfs/dbraw/zinc/83/25/78/906832578.db2.gz DOWQVHOHAVPPSF-GOSISDBHSA-N 0 3 406.530 4.126 20 0 HIADHN C[C@@H](c1ccc2ccccc2c1)N1CCC(N(CC(F)(F)F)S(C)(=O)=O)CC1 ZINC000497359104 906852231 /nfs/dbraw/zinc/85/22/31/906852231.db2.gz AAKSOHOKTQNKKH-HNNXBMFYSA-N 0 3 414.493 4.189 20 0 HIADHN COc1cccc([C@@H](CNC(=O)NCC(C)(C)c2cccs2)N2CCCC2)c1 ZINC000512654841 921276386 /nfs/dbraw/zinc/27/63/86/921276386.db2.gz PEEZEQWLCAUXES-LJQANCHMSA-N 0 3 401.576 4.171 20 0 HIADHN COc1ccc([C@H](C)NC(=O)NC[C@@H]2CCCN2Cc2ccccc2)c(C)c1OC ZINC000497445276 906919116 /nfs/dbraw/zinc/91/91/16/906919116.db2.gz WNGOZJMKBAVKJY-ICSRJNTNSA-N 0 3 411.546 4.037 20 0 HIADHN O=C(Nc1cc(C(F)F)ccc1Cl)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1CO ZINC000497448109 906923570 /nfs/dbraw/zinc/92/35/70/906923570.db2.gz XVMDGDFGNQXMHY-FUHWJXTLSA-N 0 3 423.891 4.282 20 0 HIADHN CCCOc1cc(CN2CCC(C(=O)NCc3ccc(C)cc3)CC2)ccc1OC ZINC000512696780 921290901 /nfs/dbraw/zinc/29/09/01/921290901.db2.gz GLFJGDURSWVHRC-UHFFFAOYSA-N 0 3 410.558 4.321 20 0 HIADHN O[C@@H](COc1cc(Cl)ccc1Cl)CN(Cc1cccs1)C[C@H]1CCCO1 ZINC000497593371 907073996 /nfs/dbraw/zinc/07/39/96/907073996.db2.gz AQGWGJDUQTVZFY-HZPDHXFCSA-N 0 3 416.370 4.476 20 0 HIADHN O[C@@H](COc1cc(Cl)ccc1Cl)CN(Cc1cccs1)C[C@@H]1CCCO1 ZINC000497593369 907074908 /nfs/dbraw/zinc/07/49/08/907074908.db2.gz AQGWGJDUQTVZFY-CVEARBPZSA-N 0 3 416.370 4.476 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)NCc2csc(-c3ccccc3)n2)CCN1Cc1ccccc1 ZINC000497615983 907092539 /nfs/dbraw/zinc/09/25/39/907092539.db2.gz AZWDOAMBAPWSBR-UTKZUKDTSA-N 0 3 406.555 4.272 20 0 HIADHN COc1cc(CCC2CCN(Cc3cccc(C(=O)N(C)C)c3)CC2)cc(OC)c1 ZINC000497615143 907093219 /nfs/dbraw/zinc/09/32/19/907093219.db2.gz HNRCKBMOBKUVNL-UHFFFAOYSA-N 0 3 410.558 4.250 20 0 HIADHN COc1cccc([C@@H](CNC(=O)C[C@H]2CCCc3cc(OC)ccc32)N2CCCC2)c1 ZINC000497707546 907212307 /nfs/dbraw/zinc/21/23/07/907212307.db2.gz YUOCAQRGGJHAGI-CJFMBICVSA-N 0 3 422.569 4.467 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(Cl)cc2)CC1)[C@@H]1CC[C@H](C(F)(F)F)C1 ZINC000512779864 921310150 /nfs/dbraw/zinc/31/01/50/921310150.db2.gz UVJRGDRZYMVNDC-CABCVRRESA-N 0 3 418.887 4.278 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)CSc2ccc(C(F)(F)F)cn2)N(C)C)cc1 ZINC000497799113 907284535 /nfs/dbraw/zinc/28/45/35/907284535.db2.gz RBWKIWHOVABGMH-QGZVFWFLSA-N 0 3 411.493 4.174 20 0 HIADHN CCc1ccc([C@H](N[C@@H](C)CCn2cccn2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000497850955 907331534 /nfs/dbraw/zinc/33/15/34/907331534.db2.gz DKPXFALHIBRVGA-MBSDFSHPSA-N 0 3 411.571 4.007 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)c1ccc(OCc2ccccc2)nc1 ZINC000497901023 907373827 /nfs/dbraw/zinc/37/38/27/907373827.db2.gz UPTOPQUKGCCEIX-UHFFFAOYSA-N 0 3 407.489 4.004 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)[C@H](C)Cc3cccc(F)c3)CC2)c1 ZINC000497940487 907407978 /nfs/dbraw/zinc/40/79/78/907407978.db2.gz UBIWZPYBNBRWSW-OAQYLSRUSA-N 0 3 411.565 4.031 20 0 HIADHN CCOC(=O)c1c(C)[nH]c(C(=O)N(CC)[C@H]2CCN([C@H](C)c3ccccc3)C2)c1C ZINC000497956294 907427356 /nfs/dbraw/zinc/42/73/56/907427356.db2.gz ATHGBRQFTZSIPJ-QUCCMNQESA-N 0 3 411.546 4.106 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)CC(C)(C)c3ccccc3)CC2)c1 ZINC000497969922 907440381 /nfs/dbraw/zinc/44/03/81/907440381.db2.gz XXGLOWJIDKUUCP-UHFFFAOYSA-N 0 3 407.602 4.381 20 0 HIADHN CCN(C(=O)c1ccn(-c2ccc(F)cc2)n1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000498020076 907517495 /nfs/dbraw/zinc/51/74/95/907517495.db2.gz WDRUUBGOXDHXPW-XMSQKQJNSA-N 0 3 406.505 4.309 20 0 HIADHN CC[C@H](CNC(=O)CCc1ccc(OC)c(Cl)c1)N1CCc2ccccc2C1 ZINC000498054344 907564368 /nfs/dbraw/zinc/56/43/68/907564368.db2.gz JCCWQIXLKPBMCE-HXUWFJFHSA-N 0 3 400.950 4.234 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N[C@H]1CCCOc2c(F)cccc21 ZINC000498112652 907623481 /nfs/dbraw/zinc/62/34/81/907623481.db2.gz VYIRLHTZPFBAAG-ZWKOTPCHSA-N 0 3 403.523 4.237 20 0 HIADHN CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)Cc1c[nH]c2cc(F)ccc12 ZINC000498126677 907643448 /nfs/dbraw/zinc/64/34/48/907643448.db2.gz LJIVVYFNWVGIOR-UHFFFAOYSA-N 0 3 421.438 4.459 20 0 HIADHN CC[C@H](C)c1ccc([C@@H](NC(=O)N(C)CCCN2CCN(C)CC2)C(C)C)cc1 ZINC000498128231 907644229 /nfs/dbraw/zinc/64/42/29/907644229.db2.gz TVQWHKYCEHLVSY-REWPJTCUSA-N 0 3 402.627 4.176 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1ccc(-n2ncc3ccccc32)cc1 ZINC000498229264 907758589 /nfs/dbraw/zinc/75/85/89/907758589.db2.gz RTSOFBNMGBRVAC-UHFFFAOYSA-N 0 3 403.486 4.214 20 0 HIADHN Cc1cccc([C@H](NC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)c2ccccn2)c1 ZINC000498231857 907765197 /nfs/dbraw/zinc/76/51/97/907765197.db2.gz QGFWADLFZWJNDG-NOZRDPDXSA-N 0 3 414.553 4.443 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N[C@@H](c2cccc(F)c2)c2ccccn2)C1 ZINC000498238808 907772142 /nfs/dbraw/zinc/77/21/42/907772142.db2.gz KCKHWAOGOBXQSD-XANCMCCPSA-N 0 3 418.516 4.445 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)N[C@@H](c1cccc(F)c1)c1ccccn1 ZINC000498241920 907777975 /nfs/dbraw/zinc/77/79/75/907777975.db2.gz CEDZXCOQOPYJGZ-UPVQGACJSA-N 0 3 418.516 4.274 20 0 HIADHN Cc1cccc([C@@H](NC(=O)NC[C@H]2CCCN2Cc2ccccc2)c2ccccn2)c1 ZINC000498244483 907782087 /nfs/dbraw/zinc/78/20/87/907782087.db2.gz UQQLZXAZLXPWEJ-ILBGXUMGSA-N 0 3 414.553 4.443 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@H](C)NCc2nc3c(s2)C[C@H](C)CC3)CC1 ZINC000498350427 907852322 /nfs/dbraw/zinc/85/23/22/907852322.db2.gz XHISDJVWXAJZOU-SJORKVTESA-N 0 3 416.610 4.400 20 0 HIADHN CCOc1ccc(C(=O)N2CCC(NCc3nc4c(s3)C[C@H](C)CC4)CC2)cc1 ZINC000498362505 907857921 /nfs/dbraw/zinc/85/79/21/907857921.db2.gz GPTBWBBYOIXTTR-MRXNPFEDSA-N 0 3 413.587 4.061 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Cc1c(C)nn(-c2ccccc2)c1C)c1ccsc1 ZINC000498369165 907861388 /nfs/dbraw/zinc/86/13/88/907861388.db2.gz KRDTYIDQOHAMRX-QFIPXVFZSA-N 0 3 410.587 4.292 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Cc1c(C)nn(-c2ccccc2)c1C)c1ccsc1 ZINC000498369164 907861760 /nfs/dbraw/zinc/86/17/60/907861760.db2.gz KRDTYIDQOHAMRX-JOCHJYFZSA-N 0 3 410.587 4.292 20 0 HIADHN CC[C@@H](NCc1ccc(OCc2cn3cccc(C)c3n2)cc1)[C@@H](O)C(F)(F)F ZINC000498369932 907861776 /nfs/dbraw/zinc/86/17/76/907861776.db2.gz YCDRBKBWHLJFEJ-RTBURBONSA-N 0 3 407.436 4.013 20 0 HIADHN CCC(CC)[C@@H]1C[C@H](NC(=O)N(CCN(C)C)Cc2ccc(F)cc2F)CCO1 ZINC000498391366 907876313 /nfs/dbraw/zinc/87/63/13/907876313.db2.gz XJSHDLRQGAKDJD-CTNGQTDRSA-N 0 3 411.537 4.022 20 0 HIADHN CCOC(=O)[C@H](Cc1ccccc1)N(C(=O)c1cccc(CN2CCCC2)c1)C1CC1 ZINC000498402624 907883265 /nfs/dbraw/zinc/88/32/65/907883265.db2.gz DVFUHRYNTQUXAH-DEOSSOPVSA-N 0 3 420.553 4.061 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)c2ccc(COc3ccc(F)cc3)o2)CC1 ZINC000498456341 907919548 /nfs/dbraw/zinc/91/95/48/907919548.db2.gz CTEFULWTOSDFOF-UHFFFAOYSA-N 0 3 412.461 4.327 20 0 HIADHN Cc1[nH]c2ccc(Br)cc2c1CC(=O)N(CCN(C)C)C1CCCC1 ZINC000498459018 907924527 /nfs/dbraw/zinc/92/45/27/907924527.db2.gz YYCNHZSYGOPVOM-UHFFFAOYSA-N 0 3 406.368 4.114 20 0 HIADHN C[C@@H](NCc1ccc(-c2ccc(C(F)(F)F)cc2)s1)C1(S(C)(=O)=O)CC1 ZINC000512874895 921373078 /nfs/dbraw/zinc/37/30/78/921373078.db2.gz VVJQJWZVYLFFIT-GFCCVEGCSA-N 0 3 403.491 4.489 20 0 HIADHN CCN(CC(=O)Nc1c(Cl)cccc1Cl)C(=O)c1cccc(CN(C)C)c1 ZINC000498598340 908046390 /nfs/dbraw/zinc/04/63/90/908046390.db2.gz BWMTZBPSJCEOAV-UHFFFAOYSA-N 0 3 408.329 4.156 20 0 HIADHN C[C@@H]1CCN(C)CCN1C(=O)c1cccc(OCc2ccccc2Br)c1 ZINC000498708465 908134988 /nfs/dbraw/zinc/13/49/88/908134988.db2.gz UZTNUIGHTNBJFE-MRXNPFEDSA-N 0 3 417.347 4.194 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)[C@@H]1C[C@@H]1c1ccc(Br)cc1 ZINC000498709807 908136968 /nfs/dbraw/zinc/13/69/68/908136968.db2.gz BQNKHNYNGNOFND-RTBURBONSA-N 0 3 419.338 4.282 20 0 HIADHN C[C@@H]1CCN(C)CCN1C(=O)c1ccccc1-c1nc(-c2cccc(Cl)c2)no1 ZINC000498716728 908142019 /nfs/dbraw/zinc/14/20/19/908142019.db2.gz LGXDLRQEPQAEFA-OAHLLOKOSA-N 0 3 410.905 4.223 20 0 HIADHN Cc1ccc(Cn2cc(C(=O)N3CCN(C)CC[C@H]3C)c(-c3ccc(C)cc3)n2)cc1 ZINC000498720457 908145913 /nfs/dbraw/zinc/14/59/13/908145913.db2.gz SDOYPKXLMCLXKN-OAQYLSRUSA-N 0 3 416.569 4.381 20 0 HIADHN CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)c1sc(-c2ccccn2)nc1C ZINC000498720963 908147567 /nfs/dbraw/zinc/14/75/67/908147567.db2.gz RSWDIRISLDILII-IBGZPJMESA-N 0 3 421.570 4.035 20 0 HIADHN Cc1ccc(-c2nn(Cc3ccccc3)cc2C(=O)N2CCN(C)CC[C@@H]2C)cc1C ZINC000498723813 908150537 /nfs/dbraw/zinc/15/05/37/908150537.db2.gz ANQUXBZQAYIOCC-NRFANRHFSA-N 0 3 416.569 4.381 20 0 HIADHN CS(=O)(=O)C1CCC(N[C@@H](c2ccco2)c2ccc(Br)cc2)CC1 ZINC000498782457 908198560 /nfs/dbraw/zinc/19/85/60/908198560.db2.gz FPCFWAJBBJMHSS-LEOMRAHMSA-N 0 3 412.349 4.077 20 0 HIADHN CC[C@@H](NCc1cnc2ccc(Br)cn12)c1ccc(OC)c(OC)c1 ZINC000512898699 921392031 /nfs/dbraw/zinc/39/20/31/921392031.db2.gz IHRLABJSOHLEFU-MRXNPFEDSA-N 0 3 404.308 4.355 20 0 HIADHN Cc1sc2ccc(Cl)cc2c1S(=O)(=O)N(C)[C@@H](C)C1CCN(C)CC1 ZINC000498884532 908285363 /nfs/dbraw/zinc/28/53/63/908285363.db2.gz RXHULKXJLNNGHY-LBPRGKRZSA-N 0 3 400.997 4.214 20 0 HIADHN O=C(N[C@@H](c1cccc(F)c1)c1ccccn1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000498888439 908291350 /nfs/dbraw/zinc/29/13/50/908291350.db2.gz CXAPGSHXOYNNKF-YKSBVNFPSA-N 0 3 421.491 4.478 20 0 HIADHN Cc1csc(C(C)(C)NC(=O)NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)n1 ZINC000512906441 921398888 /nfs/dbraw/zinc/39/88/88/921398888.db2.gz FNZMGHHLERWLOT-SFHVURJKSA-N 0 3 404.580 4.076 20 0 HIADHN FC(F)(F)c1cccc(-c2noc(CN3CCC[C@@H](c4nc(C5CC5)n[nH]4)C3)n2)c1 ZINC000498915043 908323322 /nfs/dbraw/zinc/32/33/22/908323322.db2.gz KVMHMDRYPCFKSP-CQSZACIVSA-N 0 3 418.423 4.131 20 0 HIADHN FC(F)(F)c1cccc(-c2noc(CN3CCC[C@@H](c4n[nH]c(C5CC5)n4)C3)n2)c1 ZINC000498915043 908323337 /nfs/dbraw/zinc/32/33/37/908323337.db2.gz KVMHMDRYPCFKSP-CQSZACIVSA-N 0 3 418.423 4.131 20 0 HIADHN C[C@@H](NC(=O)CN1CCC[C@H](c2n[nH]c(C3CC3)n2)C1)c1ccc(Cl)c(Cl)c1 ZINC000498918843 908327533 /nfs/dbraw/zinc/32/75/33/908327533.db2.gz PFWKSLUNAFSGGM-DOMZBBRYSA-N 0 3 422.360 4.046 20 0 HIADHN FC(F)(F)c1cccc([C@@H]2CCC[C@H]2NCc2cn(Cc3cccnc3)nn2)c1 ZINC000512913317 921405545 /nfs/dbraw/zinc/40/55/45/921405545.db2.gz NQQUDSYKJAXEGX-VQTJNVASSA-N 0 3 401.436 4.166 20 0 HIADHN CC[C@@H](NC(=O)NC[C@@H](c1ccc(OC(C)C)cc1)N(C)C)c1nc2ccccc2[nH]1 ZINC000512913853 921407230 /nfs/dbraw/zinc/40/72/30/921407230.db2.gz XOCAQLULJUGPIY-KNQAVFIVSA-N 0 3 423.561 4.403 20 0 HIADHN Cc1nccn1CCN(CC(=O)Nc1ccc(Cl)cc1C(F)(F)F)C(C)C ZINC000499052292 908423669 /nfs/dbraw/zinc/42/36/69/908423669.db2.gz DFQUUYONKITVNX-UHFFFAOYSA-N 0 3 402.848 4.213 20 0 HIADHN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)c1cc(Br)cs1 ZINC000499255659 908631121 /nfs/dbraw/zinc/63/11/21/908631121.db2.gz MAUPYQFSHHOQCG-UHFFFAOYSA-N 0 3 401.757 4.368 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)N[C@@H](c2cccc(F)c2)c2ccccn2)CC1 ZINC000499299077 908668989 /nfs/dbraw/zinc/66/89/89/908668989.db2.gz GCQGUOBPRGDROK-QHCPKHFHSA-N 0 3 422.504 4.209 20 0 HIADHN CN(C(=O)N[C@@H](c1cccc(F)c1)c1ccccn1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000499317041 908689482 /nfs/dbraw/zinc/68/94/82/908689482.db2.gz QCIRTVZYLIRGCL-UPVQGACJSA-N 0 3 418.516 4.226 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)NCCc1csc(C(C)(C)C)n1 ZINC000499326691 908701567 /nfs/dbraw/zinc/70/15/67/908701567.db2.gz IIXZUMDAZJGGKH-UHFFFAOYSA-N 0 3 424.561 4.035 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)CCc1cccc(Br)c1 ZINC000499371312 908740528 /nfs/dbraw/zinc/74/05/28/908740528.db2.gz WTWJEZYJYUNSJD-UHFFFAOYSA-N 0 3 407.327 4.111 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)c1cc2c(cccc2OC(F)F)[nH]1 ZINC000499382910 908747273 /nfs/dbraw/zinc/74/72/73/908747273.db2.gz JUFJSFMAPWBEMM-UHFFFAOYSA-N 0 3 405.420 4.112 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)c2cc(C)nc3c2cnn3C(C)C)N2CCCC2)cc1 ZINC000499426112 908790874 /nfs/dbraw/zinc/79/08/74/908790874.db2.gz XLTOIUOYMJGRQU-JOCHJYFZSA-N 0 3 405.546 4.196 20 0 HIADHN CN(C)C(=O)COc1cccc(CNCc2cccc(OCc3ccc(F)cc3)c2)c1 ZINC000499654735 908866153 /nfs/dbraw/zinc/86/61/53/908866153.db2.gz FHZMMLGCOBIZMD-UHFFFAOYSA-N 0 3 422.500 4.162 20 0 HIADHN CCCOc1ccc(CNC(=O)NC[C@@H](c2cccc(OC)c2)N2CCCC2)cc1 ZINC000499675129 908873217 /nfs/dbraw/zinc/87/32/17/908873217.db2.gz KLGMMGZHIAAYRT-QHCPKHFHSA-N 0 3 411.546 4.120 20 0 HIADHN CSC[C@@](C)(O)CNCc1c(C)nn(-c2ccccc2)c1Oc1cccc(F)c1 ZINC000499696782 908879373 /nfs/dbraw/zinc/87/93/73/908879373.db2.gz JABZDESQRLKIQB-QFIPXVFZSA-N 0 3 415.534 4.316 20 0 HIADHN CSC[C@H](CCO)NCc1c(C)nn(-c2ccccc2)c1Oc1ccc(F)cc1 ZINC000499706495 908883854 /nfs/dbraw/zinc/88/38/54/908883854.db2.gz NZVIVXALHORXDP-SFHVURJKSA-N 0 3 415.534 4.316 20 0 HIADHN COc1ccc([C@H]2C[C@H](NC(=O)NC[C@@H](c3ccccc3)N3CCCC3)C2)cc1F ZINC000499768299 908907567 /nfs/dbraw/zinc/90/75/67/908907567.db2.gz HNPYHLMQJBHNKQ-ONTIZHBOSA-N 0 3 411.521 4.217 20 0 HIADHN C[C@@H]1C[C@@H]1c1ccc([C@H]2C[C@@H]2C(=O)N(CCN(C)C)Cc2ccc(F)cc2F)o1 ZINC000499976324 909422379 /nfs/dbraw/zinc/42/23/79/909422379.db2.gz JRYFPKHSGGKVTG-FCLVOEFKSA-N 0 3 402.485 4.375 20 0 HIADHN CCN(C(=O)c1ccn(-c2ccc(OC)cc2)n1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000500013524 909468779 /nfs/dbraw/zinc/46/87/79/909468779.db2.gz YIKLPQMOUCOEIU-KNQAVFIVSA-N 0 3 418.541 4.179 20 0 HIADHN CCc1nnc(NC(=O)[C@H](C)[C@@H](C)NCc2ccc(-c3ccncc3)cc2F)s1 ZINC000513040996 921499457 /nfs/dbraw/zinc/49/94/57/921499457.db2.gz MJEXMWNLVVHLOE-ZIAGYGMSSA-N 0 3 413.522 4.055 20 0 HIADHN CCc1nnc(NC(=O)[C@@H](C)[C@@H](C)NCc2ccc(Oc3ccccc3)o2)s1 ZINC000513041874 921501079 /nfs/dbraw/zinc/50/10/79/921501079.db2.gz SSLIGHMOYBTUME-UONOGXRCSA-N 0 3 400.504 4.239 20 0 HIADHN CCCc1nc(C(=O)N(CCN(C)C)c2ccccc2)nn1-c1ccccc1Cl ZINC000500084172 909561577 /nfs/dbraw/zinc/56/15/77/909561577.db2.gz BESMCWZNOPIMLN-UHFFFAOYSA-N 0 3 411.937 4.082 20 0 HIADHN COc1ccccc1[C@H](NC(=O)N[C@@H]1CCN(Cc2ccccc2)[C@@H]1C)c1ccco1 ZINC000500153855 909630407 /nfs/dbraw/zinc/63/04/07/909630407.db2.gz ZHCFCPHBRKOPND-JLGINSKQSA-N 0 3 419.525 4.340 20 0 HIADHN COc1cccc(C2(F)CCN(Cc3ccc(OCc4nccn4C)cc3)CC2)c1 ZINC000500155807 909636778 /nfs/dbraw/zinc/63/67/78/909636778.db2.gz PUCZZZCBCTVAMF-UHFFFAOYSA-N 0 3 409.505 4.469 20 0 HIADHN CCc1nnc(NC(=O)[C@@H](C)[C@@H](C)NCc2cc(C(F)(F)F)ccc2F)s1 ZINC000513059892 921515936 /nfs/dbraw/zinc/51/59/36/921515936.db2.gz XMVPIKMRALFAPN-VHSXEESVSA-N 0 3 404.433 4.011 20 0 HIADHN O=C(NC[C@H]1CCCN(Cc2cccs2)C1)c1nn(-c2ccccc2)c2c1CCC2 ZINC000500275963 909754745 /nfs/dbraw/zinc/75/47/45/909754745.db2.gz QSKGBVIWMAZCMY-GOSISDBHSA-N 0 3 420.582 4.065 20 0 HIADHN CCc1nnc(NC(=O)[C@@H](C)[C@H](C)NCc2ccc(F)c(Cl)c2Cl)s1 ZINC000513068301 921522818 /nfs/dbraw/zinc/52/28/18/921522818.db2.gz JAWWICZMGYHKRY-IUCAKERBSA-N 0 3 405.326 4.299 20 0 HIADHN C[C@@H]1C[C@@H]1c1ccc([C@@H]2C[C@@H]2C(=O)N(C)C2CCN(CCc3ccccn3)CC2)o1 ZINC000500330851 909789953 /nfs/dbraw/zinc/78/99/53/909789953.db2.gz CIQVFXURLRMQSR-YCZSINBZSA-N 0 3 407.558 4.067 20 0 HIADHN Cc1cc(NC(=O)CNC(C)(C)c2ccc(Br)cc2)n(C(C)(C)C)n1 ZINC000500394952 909833448 /nfs/dbraw/zinc/83/34/48/909833448.db2.gz QHZUSONQPOVNFM-UHFFFAOYSA-N 0 3 407.356 4.172 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)c2cnn(-c3cccc(C)c3)c2C)cc1 ZINC000500425551 909849826 /nfs/dbraw/zinc/84/98/26/909849826.db2.gz UETRIAXUYVIQKH-DEOSSOPVSA-N 0 3 418.541 4.065 20 0 HIADHN Cc1ccc(C(=O)CCCC(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)cc1 ZINC000500506408 909894594 /nfs/dbraw/zinc/89/45/94/909894594.db2.gz WWRXXUQZOUAFKL-OYRHEFFESA-N 0 3 414.590 4.086 20 0 HIADHN Cc1ccc(C(=O)CCCC(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)cc1 ZINC000500506407 909895040 /nfs/dbraw/zinc/89/50/40/909895040.db2.gz WWRXXUQZOUAFKL-NHCUHLMSSA-N 0 3 414.590 4.086 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)N[C@H](C)c2cc(C)sc2C)CC1 ZINC000500628831 909978010 /nfs/dbraw/zinc/97/80/10/909978010.db2.gz NVYZSOUYEBGIAT-GOSISDBHSA-N 0 3 414.619 4.063 20 0 HIADHN CCN1CCN(Cc2ccc(CNC(=O)N[C@@H](C)c3cc(C)sc3C)cc2)CC1 ZINC000500645021 909988761 /nfs/dbraw/zinc/98/87/61/909988761.db2.gz DJWIJLXNSMWRQW-SFHVURJKSA-N 0 3 414.619 4.063 20 0 HIADHN COc1ccccc1COC1CCN(Cc2ccc(Oc3cnccn3)cc2)CC1 ZINC000500697716 910029473 /nfs/dbraw/zinc/02/94/73/910029473.db2.gz MVQKHZFBFWPAPF-UHFFFAOYSA-N 0 3 405.498 4.459 20 0 HIADHN CCCOc1ccc(CN2CCC(C(=O)Nc3cccc(F)c3)CC2)cc1OC ZINC000513093541 921542608 /nfs/dbraw/zinc/54/26/08/921542608.db2.gz BYUUKPLEYJIPGG-UHFFFAOYSA-N 0 3 400.494 4.474 20 0 HIADHN CCCOc1cc(CN2CCC(C(=O)Nc3cccc(F)c3)CC2)ccc1OC ZINC000513093722 921544688 /nfs/dbraw/zinc/54/46/88/921544688.db2.gz DCSOEGCICNQIHR-UHFFFAOYSA-N 0 3 400.494 4.474 20 0 HIADHN COc1ccc(Br)cc1CN(C)C1CCN(C(=O)c2ccccc2)CC1 ZINC000513100112 921548202 /nfs/dbraw/zinc/54/82/02/921548202.db2.gz GUUZXGWZEPDIFA-UHFFFAOYSA-N 0 3 417.347 4.194 20 0 HIADHN CC[C@H]1CCCCN1CCNC(=O)N1CCC(C(=O)c2ccc(Cl)cc2)CC1 ZINC000500837383 910113243 /nfs/dbraw/zinc/11/32/43/910113243.db2.gz PHPLOAAANHPUNO-FQEVSTJZSA-N 0 3 405.970 4.209 20 0 HIADHN CCc1nc(C(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)nn1-c1ccccc1Cl ZINC000500880326 910154051 /nfs/dbraw/zinc/15/40/51/910154051.db2.gz KNQHLDYZRSJLQM-SJLPKXTDSA-N 0 3 423.948 4.048 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)N[C@@H](c1cccc(F)c1)c1ccccn1)c1ccco1 ZINC000501087218 910286079 /nfs/dbraw/zinc/28/60/79/910286079.db2.gz LTPNKXPTJFWGAT-BUKVSMQUSA-N 0 3 410.493 4.332 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)N[C@@H](c2cccc(F)c2)c2ccccn2)CCN1Cc1ccccc1 ZINC000501111213 910299916 /nfs/dbraw/zinc/29/99/16/910299916.db2.gz AEDFQHUNZLIRQH-OUOWLKGYSA-N 0 3 418.516 4.272 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)Nc1cccc(NC(=O)c2ccoc2)c1 ZINC000501185105 910351186 /nfs/dbraw/zinc/35/11/86/910351186.db2.gz YYMFIHJIEXLLFS-UHFFFAOYSA-N 0 3 424.476 4.267 20 0 HIADHN Cc1c(C(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)cnn1-c1ccc(Cl)cc1 ZINC000501228045 910387224 /nfs/dbraw/zinc/38/72/24/910387224.db2.gz OAYHANSAPRATNG-UZLBHIALSA-N 0 3 408.933 4.399 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)CCc2nc(-c3ccc(Cl)cc3)no2)C1 ZINC000501236923 910394284 /nfs/dbraw/zinc/39/42/84/910394284.db2.gz VINCCCNEJFFXLR-OXJNMPFZSA-N 0 3 424.932 4.274 20 0 HIADHN Cc1cccc2sc(N(Cc3ccccc3)C(=O)CN[C@@H](C)Cn3cccn3)nc21 ZINC000501282367 910445715 /nfs/dbraw/zinc/44/57/15/910445715.db2.gz XOEFRPWRCZLZRN-SFHVURJKSA-N 0 3 419.554 4.013 20 0 HIADHN Cc1cccn2cc(COc3ccc(CN4CCC[C@@H](n5cccn5)C4)cc3)nc12 ZINC000513145537 921584840 /nfs/dbraw/zinc/58/48/40/921584840.db2.gz UXRGVXUDQHEPBF-JOCHJYFZSA-N 0 3 401.514 4.255 20 0 HIADHN CN1CCCN(C(=O)Nc2cc(Cl)c(OCC(F)(F)F)c(Cl)c2)CC1 ZINC000501407185 910540729 /nfs/dbraw/zinc/54/07/29/910540729.db2.gz NNKUZMATZDJBCQ-UHFFFAOYSA-N 0 3 400.228 4.104 20 0 HIADHN Cc1cn(-c2ccccc2Cl)nc1C(=O)Nc1cccc(CN2CCC(O)CC2)c1 ZINC000501495532 910608642 /nfs/dbraw/zinc/60/86/42/910608642.db2.gz IJQPMVWNJBRUSU-UHFFFAOYSA-N 0 3 424.932 4.043 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)N[C@H]2CCCOc3c(Cl)cccc32)cc1 ZINC000501546254 910648685 /nfs/dbraw/zinc/64/86/85/910648685.db2.gz XREDDAVOXAHTIN-VQTJNVASSA-N 0 3 417.937 4.164 20 0 HIADHN COC(=O)CCC[C@@H]1CCC[C@@H](N[C@@H](C)c2nc(-c3cccc(OC)c3)no2)C1 ZINC000513163506 921595475 /nfs/dbraw/zinc/59/54/75/921595475.db2.gz AYDFAFNDEAOKCK-XYJFISCASA-N 0 3 401.507 4.298 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)CC1(C(F)(F)F)CC1 ZINC000501667909 910745615 /nfs/dbraw/zinc/74/56/15/910745615.db2.gz WKMACJXKKFCOTI-QGZVFWFLSA-N 0 3 406.452 4.310 20 0 HIADHN CCc1ccc([C@@H](CNC(=O)c2cccc(CSc3nccn3C)c2)N(C)C)cc1 ZINC000501689669 910759255 /nfs/dbraw/zinc/75/92/55/910759255.db2.gz PXUNOJSJPHVFLC-JOCHJYFZSA-N 0 3 422.598 4.308 20 0 HIADHN CC(C)c1ccccc1OCCC(=O)N(C)C1CCN(CCc2ccccn2)CC1 ZINC000501732118 910794562 /nfs/dbraw/zinc/79/45/62/910794562.db2.gz AABNSCNBFHKFAN-UHFFFAOYSA-N 0 3 409.574 4.139 20 0 HIADHN CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)c1cc2ccccc2c(=O)o1 ZINC000501751244 910811025 /nfs/dbraw/zinc/81/10/25/910811025.db2.gz LBIVZHKMEZBJLB-UHFFFAOYSA-N 0 3 418.415 4.016 20 0 HIADHN C[C@H](NC(=O)NCCCN1CCc2ccccc2C1)c1ccc(OC(F)F)cc1 ZINC000501758731 910815685 /nfs/dbraw/zinc/81/56/85/910815685.db2.gz ZHRFNGGWDZNTMN-INIZCTEOSA-N 0 3 403.473 4.097 20 0 HIADHN C[C@@H](Cc1cncc2ccccc21)C(=O)N(CCN(C)C)Cc1ccc(F)cc1F ZINC000501763136 910819055 /nfs/dbraw/zinc/81/90/55/910819055.db2.gz NOBWYECYOIKWHA-KRWDZBQOSA-N 0 3 411.496 4.282 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)N[C@@H](CN2CCCC2)c2ccccc2)c(OC)c1 ZINC000501806504 910858144 /nfs/dbraw/zinc/85/81/44/910858144.db2.gz XVZRERAYRBCJSH-GOTSBHOMSA-N 0 3 423.557 4.387 20 0 HIADHN O=C(CN1CCCN(Cc2ccccc2)CC1)N(Cc1ccco1)c1ccccc1 ZINC000501838581 910879396 /nfs/dbraw/zinc/87/93/96/910879396.db2.gz ZMADXAWJSSXATM-UHFFFAOYSA-N 0 3 403.526 4.021 20 0 HIADHN CC(C)OC(=O)C[C@H](NC(=O)N[C@@H](CN1CCCC1)c1ccccc1)c1ccccc1 ZINC000501849385 910882330 /nfs/dbraw/zinc/88/23/30/910882330.db2.gz JFAFRAWVZUJBIJ-GOTSBHOMSA-N 0 3 423.557 4.206 20 0 HIADHN CN(Cc1ccccc1N1CCCC1)C(=O)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000501851081 910884460 /nfs/dbraw/zinc/88/44/60/910884460.db2.gz MYBOGKYBCKMZNS-QHCPKHFHSA-N 0 3 406.574 4.265 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)c3ccc(CCC(F)(F)F)cc3)CC2)C[C@H](C)O1 ZINC000501852869 910886165 /nfs/dbraw/zinc/88/61/65/910886165.db2.gz SCYOQBDZDKSTII-IRXDYDNUSA-N 0 3 412.496 4.143 20 0 HIADHN Cc1ccc(C(C)C)c(OCCC(=O)N2CCC(CN3C[C@H](C)O[C@@H](C)C3)CC2)c1 ZINC000501852862 910886417 /nfs/dbraw/zinc/88/64/17/910886417.db2.gz SBGICMUWMCQUCK-SFTDATJTSA-N 0 3 416.606 4.235 20 0 HIADHN CN1CCN(CCCNc2ncnc3cc(-c4ccc(Cl)cc4)sc32)CC1 ZINC000501936253 910925248 /nfs/dbraw/zinc/92/52/48/910925248.db2.gz UETCBQRPVAVKNB-UHFFFAOYSA-N 0 3 401.967 4.061 20 0 HIADHN CCN(C(=O)c1ccc2c(c1)NC(=O)CCS2)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000501963725 910949724 /nfs/dbraw/zinc/94/97/24/910949724.db2.gz VWYVOQBUZVZTOT-XLIONFOSSA-N 0 3 423.582 4.419 20 0 HIADHN Cc1onc(-c2cccc(Br)c2)c1C(=O)N1CC[C@H](N2CCCCC2)C1 ZINC000502042170 910996834 /nfs/dbraw/zinc/99/68/34/910996834.db2.gz NSRLNRUHXLHPHB-KRWDZBQOSA-N 0 3 418.335 4.113 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3CC[C@H](c4ccccc4F)C3)c(C)c2)CC1 ZINC000502050730 911002568 /nfs/dbraw/zinc/00/25/68/911002568.db2.gz OZMKJYZSUXEQNZ-IBGZPJMESA-N 0 3 410.537 4.297 20 0 HIADHN O=C(Cc1coc(-c2ccc(Cl)cc2)n1)NC[C@@H]1CCCN1Cc1ccccc1 ZINC000513220261 921634801 /nfs/dbraw/zinc/63/48/01/921634801.db2.gz XCTHJKDBWHKKHR-NRFANRHFSA-N 0 3 409.917 4.318 20 0 HIADHN O=C(CSCc1coc(-c2ccccc2)n1)NC[C@H]1CCCN1Cc1ccccc1 ZINC000513221985 921637134 /nfs/dbraw/zinc/63/71/34/921637134.db2.gz FYWNRDIOBMRUDR-JOCHJYFZSA-N 0 3 421.566 4.356 20 0 HIADHN CN(C)C(=O)Nc1ccc(Cl)c(C(=O)NC[C@H](c2ccccc2)N2CCCC2)c1 ZINC000502224036 911169680 /nfs/dbraw/zinc/16/96/80/911169680.db2.gz AILZIJMEKUEHLN-HXUWFJFHSA-N 0 3 414.937 4.000 20 0 HIADHN CSc1ccc(NC(=O)CNC(C)(C)COc2ncccc2C(F)(F)F)cc1 ZINC000502223974 911169999 /nfs/dbraw/zinc/16/99/99/911169999.db2.gz RCUORWZAEIASQB-UHFFFAOYSA-N 0 3 413.465 4.208 20 0 HIADHN COc1cc(C)c(C[C@H](C)N[C@@H](CCSC)c2nnc3ccccn32)cc1OC ZINC000502280619 911230480 /nfs/dbraw/zinc/23/04/80/911230480.db2.gz WKNACZHTKZDSFL-WMZOPIPTSA-N 0 3 414.575 4.070 20 0 HIADHN CS(=O)(=O)c1ccc(F)c(CNC2CC(c3ccc(Br)cc3)C2)c1 ZINC000502306367 911269529 /nfs/dbraw/zinc/26/95/29/911269529.db2.gz ZZJVCDPZNYGEKF-UHFFFAOYSA-N 0 3 412.324 4.028 20 0 HIADHN COc1ccc(Br)c(CN2CCC[C@H](c3ncc4n3CCCC4)C2)c1 ZINC000502330241 911309816 /nfs/dbraw/zinc/30/98/16/911309816.db2.gz CYYYXSWRJLPHQJ-HNNXBMFYSA-N 0 3 404.352 4.370 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1)c1ccc(OC(F)F)cc1 ZINC000502334665 911315824 /nfs/dbraw/zinc/31/58/24/911315824.db2.gz RQCFVBZMEOEBFX-QFBILLFUSA-N 0 3 403.473 4.313 20 0 HIADHN C[C@@H](CCc1cccc(C(F)(F)F)c1)NCc1cc(S(C)(=O)=O)ccc1F ZINC000502337811 911317122 /nfs/dbraw/zinc/31/71/22/911317122.db2.gz YDPJPCNBXATQLY-ZDUSSCGKSA-N 0 3 403.441 4.359 20 0 HIADHN CCN(CCOCCO)Cc1cccc(NC(=O)c2ccc(Cl)cc2Cl)c1 ZINC000502344149 911323709 /nfs/dbraw/zinc/32/37/09/911323709.db2.gz GRIKRRFKGYUBOV-UHFFFAOYSA-N 0 3 411.329 4.077 20 0 HIADHN CN1CCN(CCCNC(=O)N2CCC[C@H]2c2ccc(F)cc2)[C@H](c2ccccc2)C1 ZINC000502353133 911335273 /nfs/dbraw/zinc/33/52/73/911335273.db2.gz JRUNURYKAMXTTK-ZEQRLZLVSA-N 0 3 424.564 4.051 20 0 HIADHN O=C(Nc1c[nH]nc1[C@H]1CCCN(CCc2ccc(F)c(F)c2)C1)c1ccccc1 ZINC000502363203 911349098 /nfs/dbraw/zinc/34/90/98/911349098.db2.gz VNQPGCGXLNBGAX-SFHVURJKSA-N 0 3 410.468 4.362 20 0 HIADHN COc1cc(C)c(C[C@H](C)N[C@H](CO)c2ccccc2OC(F)(F)F)cc1OC ZINC000502373855 911357266 /nfs/dbraw/zinc/35/72/66/911357266.db2.gz NOULOUCWEOZZBU-WMLDXEAASA-N 0 3 413.436 4.165 20 0 HIADHN CC(C)(COc1ncccc1C(F)(F)F)NCC(=O)Nc1ccc(F)cc1Cl ZINC000502377620 911364053 /nfs/dbraw/zinc/36/40/53/911364053.db2.gz JASMHFWFIZZSAU-UHFFFAOYSA-N 0 3 419.806 4.279 20 0 HIADHN Cc1oc(-c2ccccc2)nc1CC(=O)N(CCCc1ccccc1)CCN(C)C ZINC000502392942 911376852 /nfs/dbraw/zinc/37/68/52/911376852.db2.gz AJFWUTTVLMLWMC-UHFFFAOYSA-N 0 3 405.542 4.216 20 0 HIADHN CCn1ncc2ccc(NC(=O)Nc3ccc(N4CCN(CC)CC4)cc3C)cc21 ZINC000502439239 911422241 /nfs/dbraw/zinc/42/22/41/911422241.db2.gz FUKZCILPCWQEGR-UHFFFAOYSA-N 0 3 406.534 4.151 20 0 HIADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)[C@H]1C[C@H]1c1cccc(Br)c1 ZINC000513258236 921662363 /nfs/dbraw/zinc/66/23/63/921662363.db2.gz YDTPWENZYBOPRF-ACRUOGEOSA-N 0 3 413.359 4.333 20 0 HIADHN COc1cc(C)c(C[C@H](C)N[C@H](CCO)c2ccccc2Br)cc1OC ZINC000502474876 911467041 /nfs/dbraw/zinc/46/70/41/911467041.db2.gz IIOSKXBSZRPDNK-HNAYVOBHSA-N 0 3 422.363 4.419 20 0 HIADHN OC[C@H](CNCc1ccc(Sc2ccccn2)o1)Cc1cc(F)c(F)c(F)c1 ZINC000513261589 921666137 /nfs/dbraw/zinc/66/61/37/921666137.db2.gz OQWGWSOAMPUTAQ-AWEZNQCLSA-N 0 3 408.445 4.184 20 0 HIADHN CCOc1cc(C[NH2+]C[C@@H](C)N2CCc3ccccc3C2)cc(Br)c1[O-] ZINC000502516914 911521540 /nfs/dbraw/zinc/52/15/40/911521540.db2.gz FFGMIDWHRXNPSG-OAHLLOKOSA-N 0 3 419.363 4.090 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1ccc([C@H]2CCCOC2)cc1)c1cccc(OC)c1 ZINC000502526668 911529953 /nfs/dbraw/zinc/52/99/53/911529953.db2.gz NOUQSVHEHCAZOU-LADGPHEKSA-N 0 3 410.558 4.402 20 0 HIADHN CC(C)c1noc(-c2ccccc2C(=O)NC[C@H]2CCCN2Cc2ccccc2)n1 ZINC000513264243 921668573 /nfs/dbraw/zinc/66/85/73/921668573.db2.gz VOIVYOPGNBOFHN-LJQANCHMSA-N 0 3 404.514 4.254 20 0 HIADHN Cc1nnc([C@H]2CCCCN2C(=O)c2cccc(CN(C)Cc3ccccc3)c2)[nH]1 ZINC000513273040 921673776 /nfs/dbraw/zinc/67/37/76/921673776.db2.gz SMQAVFWFVSWHMW-JOCHJYFZSA-N 0 3 403.530 4.113 20 0 HIADHN CCOc1ccc([C@@H](C)NC(=O)CN[C@H](c2ccc(F)cc2)C(C)C)cc1OC ZINC000502593108 911593932 /nfs/dbraw/zinc/59/39/32/911593932.db2.gz RTIOBCVDCYVYMT-MWTRTKDXSA-N 0 3 402.510 4.397 20 0 HIADHN CCc1cccc(CC)c1NC(=O)CN[C@]1(Cc2ccc(Cl)cc2)CCOC1 ZINC000502594026 911597730 /nfs/dbraw/zinc/59/77/30/911597730.db2.gz JMDYHSDOMDSYDR-QHCPKHFHSA-N 0 3 400.950 4.395 20 0 HIADHN Cc1nc2c(s1)[C@H](N[C@@H]1CCCN(c3ccc(OC(F)F)cc3)C1=O)CCC2 ZINC000502597875 911603760 /nfs/dbraw/zinc/60/37/60/911603760.db2.gz VHZDFPXZPRITJZ-IAGOWNOFSA-N 0 3 407.486 4.216 20 0 HIADHN COc1cc([C@H](C)NC(=O)N(CCN(C)C)CC(C)C)ccc1OC1CCCC1 ZINC000502611956 911634243 /nfs/dbraw/zinc/63/42/43/911634243.db2.gz QRPJHAAEAGJDQS-SFHVURJKSA-N 0 3 405.583 4.307 20 0 HIADHN CC1CCN([C@H](CNC(=O)[C@@H](c2ccccc2)n2cccn2)c2cccs2)CC1 ZINC000513286271 921684531 /nfs/dbraw/zinc/68/45/31/921684531.db2.gz DCKGEBQMPAFCMT-IFMALSPDSA-N 0 3 408.571 4.123 20 0 HIADHN C[C@H](NC(=O)N[C@H](CN(C)C)c1ccc(F)cc1)c1ccc(Br)s1 ZINC000502679071 911720054 /nfs/dbraw/zinc/72/00/54/911720054.db2.gz JOYFHVXHQNOKCH-SMDDNHRTSA-N 0 3 414.344 4.313 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)N[C@@H](CC(F)(F)F)C(C)C)N(C)C)cc1 ZINC000502694512 911730868 /nfs/dbraw/zinc/73/08/68/911730868.db2.gz OFTNKNFSSFSCBO-ZWKOTPCHSA-N 0 3 403.489 4.353 20 0 HIADHN CCN1CCC[C@@H](CN(C)C(=O)c2cc(F)c3ccccc3c2)[C@@H]1c1cnn(C)c1 ZINC000502733636 911759335 /nfs/dbraw/zinc/75/93/35/911759335.db2.gz XNIPBMHCMCENJB-FDDCHVKYSA-N 0 3 408.521 4.258 20 0 HIADHN COCCN1CCC(NC(=O)N[C@H](c2ccccc2C)[C@@H]2CCC[C@@H](C)C2)CC1 ZINC000502811160 911828364 /nfs/dbraw/zinc/82/83/64/911828364.db2.gz BJXHOHDNBVIRAZ-XQFWAAQXSA-N 0 3 401.595 4.272 20 0 HIADHN COCCN1CCC(NC(=O)N[C@H](c2ccccc2C)[C@@H]2CCC[C@H](C)C2)CC1 ZINC000502811158 911828393 /nfs/dbraw/zinc/82/83/93/911828393.db2.gz BJXHOHDNBVIRAZ-NOXFTYBFSA-N 0 3 401.595 4.272 20 0 HIADHN CC(C)N1CCN(c2cccc(NC(=O)c3sccc3Br)c2)CC1 ZINC000502866501 911872645 /nfs/dbraw/zinc/87/26/45/911872645.db2.gz CUDIYBIOPVEFEB-UHFFFAOYSA-N 0 3 408.365 4.293 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)c1ccc([C@@H]2CCCOC2)cc1 ZINC000502935194 911921693 /nfs/dbraw/zinc/92/16/93/911921693.db2.gz OXFAYYBDTUFKPN-JOCHJYFZSA-N 0 3 410.583 4.424 20 0 HIADHN Cc1ccc(NC(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)cc1OC(F)F ZINC000513310264 921703301 /nfs/dbraw/zinc/70/33/01/921703301.db2.gz GPTJSJFTZPGHBW-UHFFFAOYSA-N 0 3 403.473 4.379 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)N[C@@H](c1ccccc1)c1ccncc1 ZINC000503014053 911987112 /nfs/dbraw/zinc/98/71/12/911987112.db2.gz GRUZXFSXDZCYAG-ZEQRLZLVSA-N 0 3 400.526 4.307 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)N[C@@H](c1ccccc1)c1ccncc1 ZINC000503040476 912009580 /nfs/dbraw/zinc/00/95/80/912009580.db2.gz AZXCTAUNSKJLBK-ZEQRLZLVSA-N 0 3 400.526 4.307 20 0 HIADHN CCC(CC)c1cc(CNC(=O)[C@H]2CN(Cc3ccccc3)CCC2(F)F)on1 ZINC000513320049 921710775 /nfs/dbraw/zinc/71/07/75/921710775.db2.gz IOGZUYZWTQTQRU-LJQANCHMSA-N 0 3 405.489 4.352 20 0 HIADHN O=C(NCC1(N2CCSCC2)CCCCC1)c1ccc([C@@H]2CCCOC2)cc1 ZINC000503125481 912087240 /nfs/dbraw/zinc/08/72/40/912087240.db2.gz IYWXWAICYSTYNM-OAQYLSRUSA-N 0 3 402.604 4.062 20 0 HIADHN CC1CCN([C@H](CNC(=O)CSc2nccn2C(C)(C)C)c2ccccc2)CC1 ZINC000503163934 912134429 /nfs/dbraw/zinc/13/44/29/912134429.db2.gz XBXHPHKRJCKFPE-HXUWFJFHSA-N 0 3 414.619 4.320 20 0 HIADHN O[C@H](Cc1ccc(C(F)(F)F)cc1)CN1CCC[C@@H]1c1nnc(-c2ccccc2)[nH]1 ZINC000503168079 912139345 /nfs/dbraw/zinc/13/93/45/912139345.db2.gz BLUXUXLBMSLOLD-RTBURBONSA-N 0 3 416.447 4.231 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)N3C[C@H](C)c4ccccc43)CC2)c1 ZINC000503203040 912182064 /nfs/dbraw/zinc/18/20/64/912182064.db2.gz APYCWJZODCCNDJ-NRFANRHFSA-N 0 3 406.574 4.231 20 0 HIADHN Cc1ccc(CN(C)C(=O)NCCCCN2CCN(c3cccc(C)c3)CC2)cc1 ZINC000503213204 912194090 /nfs/dbraw/zinc/19/40/90/912194090.db2.gz XEXOMXRYRFNZAO-UHFFFAOYSA-N 0 3 408.590 4.047 20 0 HIADHN Cc1cc(C(=O)NC(C)C)ccc1NC(=O)N[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000506283027 914882497 /nfs/dbraw/zinc/88/24/97/914882497.db2.gz QHZQYZCCSWWOEA-NQIIRXRSSA-N 0 3 408.546 4.090 20 0 HIADHN CCc1ccc([C@H](NCCc2scnc2C)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000506294830 914889918 /nfs/dbraw/zinc/88/99/18/914889918.db2.gz MMKQAJPHHUYWQO-QFIPXVFZSA-N 0 3 414.596 4.339 20 0 HIADHN Cc1cc(C)n(-c2cccc(NC(=O)N[C@H]3CCN([C@H](C)c4ccccc4)C3)c2)n1 ZINC000506296604 914891490 /nfs/dbraw/zinc/89/14/90/914891490.db2.gz BCONPMPWZCPMSI-KNQAVFIVSA-N 0 3 403.530 4.446 20 0 HIADHN CCOc1cc2c(cc1NC(=O)N[C@@H]1CCN([C@H](C)c3ccccc3)C1)O[C@H](C)C2 ZINC000506309663 914898910 /nfs/dbraw/zinc/89/89/10/914898910.db2.gz NQOYFQHRUQUHQD-MBOZVWFJSA-N 0 3 409.530 4.366 20 0 HIADHN Cc1cc(NC(=O)C2CCN(C[C@@H](C)c3cccc(Br)c3)CC2)no1 ZINC000506309197 914899287 /nfs/dbraw/zinc/89/92/87/914899287.db2.gz JYLLVKSWQFEYET-CYBMUJFWSA-N 0 3 406.324 4.200 20 0 HIADHN CCOc1cc(CN2CCC(C(=O)N3CCCC3)CC2)ccc1OCc1ccccc1 ZINC000506311964 914899981 /nfs/dbraw/zinc/89/99/81/914899981.db2.gz ZIYAYGPZWPLWCY-UHFFFAOYSA-N 0 3 422.569 4.499 20 0 HIADHN COc1ccc([C@H]2C[C@H](NC(=O)[C@@H]3CCCN(Cc4cccc(F)c4)C3)C2)cc1F ZINC000506315938 914909382 /nfs/dbraw/zinc/90/93/82/914909382.db2.gz FWILUXHLTFWUGO-SFHLNBCPSA-N 0 3 414.496 4.248 20 0 HIADHN Cc1nn(C(C)C)c(C)c1CC(=O)Nc1cc(C)cc(N2CCN(C(C)C)CC2)c1 ZINC000506341141 914960398 /nfs/dbraw/zinc/96/03/98/914960398.db2.gz OTDBGHKBUQVTSR-UHFFFAOYSA-N 0 3 411.594 4.101 20 0 HIADHN CCCOc1nc(C(=O)NC2CCN(Cc3ccccc3)CC2)cc2ccccc21 ZINC000513356747 921735524 /nfs/dbraw/zinc/73/55/24/921735524.db2.gz HWTWPUSDHNYBBI-UHFFFAOYSA-N 0 3 403.526 4.418 20 0 HIADHN C[C@@H]1C[C@@H](C)CN(C(=O)c2ccccc2NC(=O)NCCN(C)Cc2ccccc2)C1 ZINC000506367728 914992285 /nfs/dbraw/zinc/99/22/85/914992285.db2.gz FSKOCBTVOSHMDA-WOJBJXKFSA-N 0 3 422.573 4.058 20 0 HIADHN COc1ccc(OCc2nc(CN(C)[C@@H]3CCN(Cc4ccccc4)C3)cs2)cc1 ZINC000506407482 915020152 /nfs/dbraw/zinc/02/01/52/915020152.db2.gz ZLWNAVCJXRQPQO-OAQYLSRUSA-N 0 3 423.582 4.437 20 0 HIADHN Cc1noc(C2(C)CCN(Cc3ccc(-n4ccc(C(F)(F)F)n4)cc3)CC2)n1 ZINC000513365011 921740378 /nfs/dbraw/zinc/74/03/78/921740378.db2.gz PSIODNPEZQTKCG-UHFFFAOYSA-N 0 3 405.424 4.136 20 0 HIADHN Cc1cccc(C2(NCC(=O)Nc3cc(S(C)(=O)=O)ccc3Cl)CCCC2)c1 ZINC000506448191 915048914 /nfs/dbraw/zinc/04/89/14/915048914.db2.gz QYBKVKKTRXQTIP-UHFFFAOYSA-N 0 3 420.962 4.050 20 0 HIADHN COc1ccc(Br)c(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2)c1 ZINC000506498540 915114042 /nfs/dbraw/zinc/11/40/42/915114042.db2.gz FEYYWGLBDPHHEA-UHFFFAOYSA-N 0 3 424.314 4.193 20 0 HIADHN COc1ccc(Br)c(NC(=O)NC[C@H](c2ccccc2)N2CCCC2)c1 ZINC000506512915 915139381 /nfs/dbraw/zinc/13/93/81/915139381.db2.gz PFJROEOOEZNVJL-LJQANCHMSA-N 0 3 418.335 4.416 20 0 HIADHN COc1cc(Cl)c(C)cc1NC(=O)CCN[C@H](Cc1ccccn1)c1cccnc1 ZINC000513377564 921751567 /nfs/dbraw/zinc/75/15/67/921751567.db2.gz MUDPLPJXTPULEW-HXUWFJFHSA-N 0 3 424.932 4.349 20 0 HIADHN FC(F)(F)COCCCN1CCC[C@@H]1c1ccccc1I ZINC000506591161 915243036 /nfs/dbraw/zinc/24/30/36/915243036.db2.gz GELFSWJKBYXTEQ-CQSZACIVSA-N 0 3 413.221 4.397 20 0 HIADHN Cc1n[nH]c(C)c1[C@@H]1CCCN1C(=O)NC[C@H](c1ccc(CC(C)C)cc1)N(C)C ZINC000513385264 921757278 /nfs/dbraw/zinc/75/72/78/921757278.db2.gz VKMZYJMMJWLQHO-FCHUYYIVSA-N 0 3 411.594 4.374 20 0 HIADHN COc1ccc(CN2CCC[C@@H](c3nnc4n3CCCCC4)C2)cc1OCC(C)C ZINC000506622242 915283412 /nfs/dbraw/zinc/28/34/12/915283412.db2.gz BIYVBSRGQTZYGE-HXUWFJFHSA-N 0 3 412.578 4.428 20 0 HIADHN COc1ccccc1O[C@H]1CCCN(CCC(=O)Nc2ccccc2SC)C1 ZINC000513387078 921759386 /nfs/dbraw/zinc/75/93/86/921759386.db2.gz VJLBGSJYDHGZMX-KRWDZBQOSA-N 0 3 400.544 4.289 20 0 HIADHN COC(=O)c1cc2c(o1)c(OC)ccc2CN1CC=C(c2c[nH]c3ncccc23)CC1 ZINC000506633898 915302501 /nfs/dbraw/zinc/30/25/01/915302501.db2.gz YNYSFJCFTOFHBC-UHFFFAOYSA-N 0 3 417.465 4.394 20 0 HIADHN O=C(NC1CCN(Cc2cn(-c3ccccc3)nc2-c2ccc(F)cc2)CC1)C1CC1 ZINC000506649219 915319515 /nfs/dbraw/zinc/31/95/15/915319515.db2.gz RQGWIDQEUCKDGU-UHFFFAOYSA-N 0 3 418.516 4.169 20 0 HIADHN C[C@H](Cn1ccc2ccccc21)C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1 ZINC000513392614 921764047 /nfs/dbraw/zinc/76/40/47/921764047.db2.gz UQTRUEMLZBECSH-LJQANCHMSA-N 0 3 423.532 4.076 20 0 HIADHN CC(C)CCOC1CCN(C(=O)[C@H]2CN(Cc3ccccc3)CCC2(F)F)CC1 ZINC000506720511 915397925 /nfs/dbraw/zinc/39/79/25/915397925.db2.gz SVZXWIGPPAZQLA-OAQYLSRUSA-N 0 3 408.533 4.198 20 0 HIADHN COc1ccccc1O[C@H]1CCCN(CCC(=O)Nc2ccc(Cl)cc2F)C1 ZINC000513401378 921769668 /nfs/dbraw/zinc/76/96/68/921769668.db2.gz MCNSWFJUJBDVIJ-INIZCTEOSA-N 0 3 406.885 4.360 20 0 HIADHN O=C(NCc1ccccc1)C1CCN(Cc2c[nH]nc2-c2ccc(Cl)cc2)CC1 ZINC000506741592 915429129 /nfs/dbraw/zinc/42/91/29/915429129.db2.gz ASKSUAIBVOGUJR-UHFFFAOYSA-N 0 3 408.933 4.259 20 0 HIADHN CN(C)Cc1cccc(NC(=O)[C@H]2CCCN2C(=O)c2cc(Cl)ccc2Cl)c1 ZINC000506782154 915507190 /nfs/dbraw/zinc/50/71/90/915507190.db2.gz VGIHDOGIKVXNJM-LJQANCHMSA-N 0 3 420.340 4.298 20 0 HIADHN COC(=O)c1cc2c(o1)c(OC)ccc2CN1CC[C@@H](n2ncc3ccccc32)C1 ZINC000513419560 921786459 /nfs/dbraw/zinc/78/64/59/921786459.db2.gz FWCYMYXQPORDSM-QGZVFWFLSA-N 0 3 405.454 4.025 20 0 HIADHN COC(=O)c1c(C2CC2)csc1NC(=O)N(CCN(C)C)Cc1cccc(F)c1 ZINC000506869017 915657575 /nfs/dbraw/zinc/65/75/75/915657575.db2.gz PPWYWABYHPZOOW-UHFFFAOYSA-N 0 3 419.522 4.147 20 0 HIADHN O=C1C[C@@H](c2ccccc2)N(CCOC(c2ccccc2)c2ccccc2)CCN1 ZINC000506916456 915716464 /nfs/dbraw/zinc/71/64/64/915716464.db2.gz JALSIFBIZNYPNG-DEOSSOPVSA-N 0 3 400.522 4.356 20 0 HIADHN COC(=O)c1ccccc1NC(=O)N(CCN(C)C)Cc1ccc(C(F)(F)F)cc1 ZINC000506955155 915762864 /nfs/dbraw/zinc/76/28/64/915762864.db2.gz RORGTUUSTDJJIA-UHFFFAOYSA-N 0 3 423.435 4.088 20 0 HIADHN O=C(NCc1ccc(F)cc1)C1CCN(Cc2ccccc2OCC(F)(F)F)CC1 ZINC000507009623 915819884 /nfs/dbraw/zinc/81/98/84/915819884.db2.gz XIECYZOPLAYVOA-UHFFFAOYSA-N 0 3 424.438 4.295 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N1CCC(N2CCc3ccccc32)CC1 ZINC000507074068 915854077 /nfs/dbraw/zinc/85/40/77/915854077.db2.gz PVHQJAPGEKPQFX-JOCHJYFZSA-N 0 3 424.614 4.122 20 0 HIADHN COc1cc(C2(C(=O)N3CCCN(CCCc4ccccc4)CC3)CC2)ccc1C ZINC000507096383 915867708 /nfs/dbraw/zinc/86/77/08/915867708.db2.gz DPLGFLMAXVCTHF-UHFFFAOYSA-N 0 3 406.570 4.202 20 0 HIADHN O=C(c1ccc(OC[C@H]2CCCO2)cc1)N1CCCN(CCCc2ccccc2)CC1 ZINC000507115696 915876533 /nfs/dbraw/zinc/87/65/33/915876533.db2.gz ARYQYLLQIHFJHI-RUZDIDTESA-N 0 3 422.569 4.025 20 0 HIADHN COc1ccc2c(c1)CCC[C@@H]2N(C)Cc1ccccc1OCC(=O)N1CCCC1 ZINC000507161071 915899306 /nfs/dbraw/zinc/89/93/06/915899306.db2.gz OZTGGKXTUYXJBF-QHCPKHFHSA-N 0 3 408.542 4.206 20 0 HIADHN COc1cc(CN(Cc2cccc(F)c2)C(C)C)ccc1OCC(=O)N1CCCC1 ZINC000507168611 915910570 /nfs/dbraw/zinc/91/05/70/915910570.db2.gz DZEBAEITFAUQCN-UHFFFAOYSA-N 0 3 414.521 4.246 20 0 HIADHN COc1ccc([C@H]2CCCN2C(=O)CN2CC[C@@H](c3ccccc3C)C2)cc1OC ZINC000507218565 915969085 /nfs/dbraw/zinc/96/90/85/915969085.db2.gz LGOSAAXRUFFEMQ-IFMALSPDSA-N 0 3 408.542 4.165 20 0 HIADHN C[C@@H](N[C@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O)c1ccc2n[nH]cc2c1 ZINC000507225618 915979919 /nfs/dbraw/zinc/97/99/19/915979919.db2.gz AKRIITCMXNGUJD-VLIAUNLRSA-N 0 3 416.447 4.424 20 0 HIADHN O=C(Nc1cccc(Br)c1)C1CCN(CCOc2ccccc2F)CC1 ZINC000507291426 916058404 /nfs/dbraw/zinc/05/84/04/916058404.db2.gz IKWDMGVBGXVFAS-UHFFFAOYSA-N 0 3 421.310 4.318 20 0 HIADHN O=C1NCCCC[C@H]1N[C@@H]1CCCc2nc(-c3ccccc3Br)sc21 ZINC000507441556 916209933 /nfs/dbraw/zinc/20/99/33/916209933.db2.gz ICPNBVFRSXCLPI-GDBMZVCRSA-N 0 3 420.376 4.208 20 0 HIADHN COCCSc1ccc([C@H](C)N[C@H](C)C(=O)N[C@@H]2CCOc3ccccc32)cc1 ZINC000507449442 916220595 /nfs/dbraw/zinc/22/05/95/916220595.db2.gz HXNIWZPMBXYWEG-CSODHUTKSA-N 0 3 414.571 4.104 20 0 HIADHN COCCSc1ccc([C@@H](C)N[C@@H](C)C(=O)N2CCc3sccc3C2)cc1 ZINC000507458342 916225273 /nfs/dbraw/zinc/22/52/73/916225273.db2.gz FYINJPHIFYRBLZ-CVEARBPZSA-N 0 3 404.601 4.111 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3cccc(C(C)=O)c3)c(OCC)c2)CC1 ZINC000507594180 916347611 /nfs/dbraw/zinc/34/76/11/916347611.db2.gz XWEWTULHQHHDTP-UHFFFAOYSA-N 0 3 409.530 4.072 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)CO[C@@H]3CCCC[C@@H]3C)c(OCC)c2)CC1 ZINC000507605337 916361027 /nfs/dbraw/zinc/36/10/27/916361027.db2.gz JXIVYXVQADKLNK-SIKLNZKXSA-N 0 3 417.594 4.151 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)c3cn(C)c4ccccc34)c(OCC)c2)CC1 ZINC000507605746 916361958 /nfs/dbraw/zinc/36/19/58/916361958.db2.gz ZADFPKWUURHDLF-UHFFFAOYSA-N 0 3 420.557 4.361 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)[C@@H](C)c3cccc(F)c3)c(OCC)c2)CC1 ZINC000507609528 916366971 /nfs/dbraw/zinc/36/69/71/916366971.db2.gz ZTHPQQNVHALDKH-SFHVURJKSA-N 0 3 413.537 4.499 20 0 HIADHN CCCN1CCN(c2ccc(NC(=O)C[C@@H]3CCC[C@@H](OC)C3)c(OCC)c2)CC1 ZINC000507623650 916383325 /nfs/dbraw/zinc/38/33/25/916383325.db2.gz WFDSGECMONWDMN-TZIWHRDSSA-N 0 3 417.594 4.151 20 0 HIADHN C[C@@H](N[C@H]1CCc2nnc(-c3ccc(F)cc3)n2C1)c1ccc(F)cc1OC(F)F ZINC000507624578 916384904 /nfs/dbraw/zinc/38/49/04/916384904.db2.gz ZUEPXIWPPJIGJS-WBMJQRKESA-N 0 3 420.410 4.490 20 0 HIADHN C[C@H](C(=O)N(C)Cc1cccc(F)c1)N(C)CCCc1cc(-c2ccccc2)n[nH]1 ZINC000507646360 916405205 /nfs/dbraw/zinc/40/52/05/916405205.db2.gz XEBNBRSRDPUKJA-GOSISDBHSA-N 0 3 408.521 4.127 20 0 HIADHN CN(CCC1CCCCC1)CC(=O)N1CCC[C@H]1c1ccc2c(c1)OCCCO2 ZINC000507649276 916411207 /nfs/dbraw/zinc/41/12/07/916411207.db2.gz FVZSISQBAQPXRW-NRFANRHFSA-N 0 3 400.563 4.414 20 0 HIADHN O=C(Nc1ccc(-c2csnn2)cc1)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000507749900 916540464 /nfs/dbraw/zinc/54/04/64/916540464.db2.gz SLKBRVABSPWIEQ-GOSISDBHSA-N 0 3 414.481 4.301 20 0 HIADHN CC[C@H](C)NC(=O)c1ccc(NC(=O)NC[C@H](c2ccsc2)N(CC)CC)cc1 ZINC000507765849 916549364 /nfs/dbraw/zinc/54/93/64/916549364.db2.gz GXXYOBHOHAHUJZ-OXJNMPFZSA-N 0 3 416.591 4.481 20 0 HIADHN CC(C)[C@@H](CN[C@@H](c1nccn1C)c1cccc(F)c1)N1CCc2ccccc2C1 ZINC000507812979 916606805 /nfs/dbraw/zinc/60/68/05/916606805.db2.gz IXQJOKOSBRDASH-DNQXCXABSA-N 0 3 406.549 4.321 20 0 HIADHN CN1C(=O)C[C@H](NCc2ccc(OCc3cccnc3)cc2)[C@@H]1c1ccc(Cl)cc1 ZINC000507819923 916614199 /nfs/dbraw/zinc/61/41/99/916614199.db2.gz VDDFDKBZXQUWMB-UPVQGACJSA-N 0 3 421.928 4.376 20 0 HIADHN CN1C(=O)C[C@@H](NCc2ccc(OCc3ccncc3)cc2)[C@H]1c1ccc(Cl)cc1 ZINC000507851025 916671384 /nfs/dbraw/zinc/67/13/84/916671384.db2.gz MPTNWHCJBAAOSH-ISKFKSNPSA-N 0 3 421.928 4.376 20 0 HIADHN CCOC(=O)c1ccc(N2CCCN(C/C(C)=C/c3ccccc3COC)CC2)nc1 ZINC000507871480 916707490 /nfs/dbraw/zinc/70/74/90/916707490.db2.gz FRTIUJIDPQZVLK-CAPFRKAQSA-N 0 3 423.557 4.020 20 0 HIADHN COc1cc(CN2CCC[C@@H]2/C=C\c2ccccc2)ccc1OCC(=O)N1CCCC1 ZINC000507887088 916732859 /nfs/dbraw/zinc/73/28/59/916732859.db2.gz NPNCNUIJESXBOF-GQZPPLQUSA-N 0 3 420.553 4.374 20 0 HIADHN CCC(CC)(NCC(=O)N1CCC(C(=O)N(C)C(C)C)CC1)c1ccc(Cl)cc1 ZINC000507937781 916807297 /nfs/dbraw/zinc/80/72/97/916807297.db2.gz PWBZMCOHDVVNNP-UHFFFAOYSA-N 0 3 422.013 4.050 20 0 HIADHN CCCN(Cc1ccc(F)cc1C(=O)OC)C1CCN(C(=O)c2ccccc2)CC1 ZINC000507949025 916811735 /nfs/dbraw/zinc/81/17/35/916811735.db2.gz LFMHRYBAXPKGTD-UHFFFAOYSA-N 0 3 412.505 4.129 20 0 HIADHN Cc1cccc(NC(=O)[C@@H]2CCCN(Cc3ccccc3OCc3ccncc3)C2)n1 ZINC000507986939 916829828 /nfs/dbraw/zinc/82/98/28/916829828.db2.gz QURKGFGBIZNESH-JOCHJYFZSA-N 0 3 416.525 4.215 20 0 HIADHN Cc1ccc(NC(=O)C2CCN(Cc3c[nH]nc3-c3ccc(Cl)cc3)CC2)nc1 ZINC000507986603 916829873 /nfs/dbraw/zinc/82/98/73/916829873.db2.gz UQNBUVUHUYEEEM-UHFFFAOYSA-N 0 3 409.921 4.284 20 0 HIADHN Cc1ccc(NC(=O)[C@H]2CCCN(Cc3cccc(OCc4ccccn4)c3)C2)nc1 ZINC000508001279 916841443 /nfs/dbraw/zinc/84/14/43/916841443.db2.gz WCOJFQVYHMEKQL-NRFANRHFSA-N 0 3 416.525 4.215 20 0 HIADHN Cc1ccc(NC(=O)[C@H]2CCCN(Cc3ccccc3OCc3ccncc3)C2)nc1 ZINC000508016866 916853204 /nfs/dbraw/zinc/85/32/04/916853204.db2.gz ROUGNZHDMGYMOS-QFIPXVFZSA-N 0 3 416.525 4.215 20 0 HIADHN COC(=O)c1ccc(-c2noc([C@@H]3CN(Cc4ccccc4)CCC3(F)F)n2)cc1 ZINC000508055200 916882002 /nfs/dbraw/zinc/88/20/02/916882002.db2.gz SFDLWMQVUSHLRC-SFHVURJKSA-N 0 3 413.424 4.148 20 0 HIADHN CCCN(C(=O)c1cc(C)nc2c1c(C)nn2C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000508460046 917245226 /nfs/dbraw/zinc/24/52/26/917245226.db2.gz XGDQZZBKLHZJKA-OAQYLSRUSA-N 0 3 419.573 4.102 20 0 HIADHN Cc1ncccc1CC(=O)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000508580010 917351878 /nfs/dbraw/zinc/35/18/78/917351878.db2.gz DTVPQJDEGKHIIV-UHFFFAOYSA-N 0 3 406.357 4.364 20 0 HIADHN CCSc1ccc([C@H](C)NC(=O)N2CCC(CN3C[C@@H](C)O[C@H](C)C3)CC2)cc1 ZINC000508580399 917351989 /nfs/dbraw/zinc/35/19/89/917351989.db2.gz FZRLYRSPUYDHCA-QRVBRYPASA-N 0 3 419.635 4.390 20 0 HIADHN NC(=O)CC1CCN(Cc2cn(-c3ccccc3)nc2-c2cc3ccccc3o2)CC1 ZINC000508647265 917412629 /nfs/dbraw/zinc/41/26/29/917412629.db2.gz XCBKSYMDGQPULY-UHFFFAOYSA-N 0 3 414.509 4.373 20 0 HIADHN CC(C)S(=O)(=O)Cc1cccc(N[C@@H](C)[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000508693760 917454722 /nfs/dbraw/zinc/45/47/22/917454722.db2.gz DTKHJFSKXKIYTR-SIKLNZKXSA-N 0 3 400.588 4.332 20 0 HIADHN COc1ccc(Oc2ccc(CNCc3ccccc3Cn3cncn3)cc2)cc1 ZINC000508732921 917492614 /nfs/dbraw/zinc/49/26/14/917492614.db2.gz JNFYOTIFTKIURL-UHFFFAOYSA-N 0 3 400.482 4.417 20 0 HIADHN C[C@H](NC(=O)N(Cc1ccc(F)cc1)C1CCOCC1)[C@@H](c1ccccc1)N(C)C ZINC000508852266 917605916 /nfs/dbraw/zinc/60/59/16/917605916.db2.gz JWMUPDYCQHOOFR-MBSDFSHPSA-N 0 3 413.537 4.208 20 0 HIADHN COc1ccc(OC)c(CN(C(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)C2CC2)c1 ZINC000508875041 917628735 /nfs/dbraw/zinc/62/87/35/917628735.db2.gz VVFQDININLOAKB-SBUREZEXSA-N 0 3 411.546 4.069 20 0 HIADHN C[C@H](NC(=O)N[C@@H]1c2ccccc2CC[C@@H]1n1ccnc1)[C@@H](c1ccccc1)N(C)C ZINC000508888157 917641951 /nfs/dbraw/zinc/64/19/51/917641951.db2.gz CAQSSTHBQQEUMC-ABQRKTDGSA-N 0 3 417.557 4.102 20 0 HIADHN C[C@H](NC(=O)N(Cc1cccc(F)c1)C[C@@H]1CCCO1)[C@@H](c1ccccc1)N(C)C ZINC000508888650 917643765 /nfs/dbraw/zinc/64/37/65/917643765.db2.gz CNWHCJWJQBBRQL-TZYHBYERSA-N 0 3 413.537 4.208 20 0 HIADHN COCCC[C@@H](CNC(=O)N1CCN(C2CCCC2)CC1)c1ccc(Cl)cc1 ZINC000508889020 917644156 /nfs/dbraw/zinc/64/41/56/917644156.db2.gz DBTXMTRHTBDCHP-IBGZPJMESA-N 0 3 407.986 4.120 20 0 HIADHN C[C@H](NC(=O)N(C)Cc1ccc(Br)cc1)[C@H](c1ccccc1)N(C)C ZINC000508891281 917645473 /nfs/dbraw/zinc/64/54/73/917645473.db2.gz BHUIDQNVDUDZJI-HNAYVOBHSA-N 0 3 404.352 4.282 20 0 HIADHN C[C@@H](NC(=O)NCc1ccncc1OCc1ccccc1)[C@@H](c1ccccc1)N(C)C ZINC000508900188 917654864 /nfs/dbraw/zinc/65/48/64/917654864.db2.gz XEWATAUOJYEKIC-DVECYGJZSA-N 0 3 418.541 4.151 20 0 HIADHN C[C@H](NC(=O)N[C@@H](CO)c1c(Cl)cccc1Cl)[C@@H](c1ccccc1)N(C)C ZINC000508898874 917655312 /nfs/dbraw/zinc/65/53/12/917655312.db2.gz RXBPXHBKHJGOTQ-IXDGSTSKSA-N 0 3 410.345 4.017 20 0 HIADHN C[C@H](NC(=O)N1CCC(C(F)(F)F)(C(F)(F)F)C1)[C@@H](c1ccccc1)N(C)C ZINC000508909049 917665514 /nfs/dbraw/zinc/66/55/14/917665514.db2.gz UHPZSEOUTBOSDI-JSGCOSHPSA-N 0 3 411.390 4.204 20 0 HIADHN O=C(Nc1ccc2nccnc2c1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000508976789 917730440 /nfs/dbraw/zinc/73/04/40/917730440.db2.gz JDLBRQCZAOWYGV-HXUWFJFHSA-N 0 3 400.404 4.023 20 0 HIADHN CN(C(=O)c1cn2cc(Cl)cc(Cl)c2n1)C1CCN(Cc2ccccc2)CC1 ZINC000508982196 917735221 /nfs/dbraw/zinc/73/52/21/917735221.db2.gz GVYSPYCZTWOJFY-UHFFFAOYSA-N 0 3 417.340 4.378 20 0 HIADHN COc1ccc([C@H]2CCN(C(=O)[C@@H]3CN(Cc4ccccc4)CCC3(F)F)C2)cc1 ZINC000509072111 917817010 /nfs/dbraw/zinc/81/70/10/917817010.db2.gz WUBCGWWRJNZDLH-UNMCSNQZSA-N 0 3 414.496 4.169 20 0 HIADHN CCCN(C(=O)c1cc2ccccc2c(=O)n1C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000509093131 917834594 /nfs/dbraw/zinc/83/45/94/917834594.db2.gz HSYIIUJTPHPLOT-QFIPXVFZSA-N 0 3 417.553 4.055 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1ccc(NC(=O)[C@H]2C[C@H]2C)cc1)c1cccc(OC)c1 ZINC000509111035 917849307 /nfs/dbraw/zinc/84/93/07/917849307.db2.gz GQICPRGVVDVYFQ-MQNAVGNWSA-N 0 3 423.557 4.103 20 0 HIADHN COc1ccc2c(c1)CCN2C(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000509126286 917858156 /nfs/dbraw/zinc/85/81/56/917858156.db2.gz UECLHXSTOHAIPQ-NRFANRHFSA-N 0 3 404.432 4.039 20 0 HIADHN C[C@H](c1ccc(N2CCCS2(=O)=O)cc1)N(C)Cc1ccccc1C(F)(F)F ZINC000509125335 917858482 /nfs/dbraw/zinc/85/84/82/917858482.db2.gz PBDBOIUSZLEAII-OAHLLOKOSA-N 0 3 412.477 4.438 20 0 HIADHN O=C(Nc1nc(CN2CCCCC2)cs1)c1cc(-c2ccc(Cl)cc2)n[nH]1 ZINC000509236818 917932242 /nfs/dbraw/zinc/93/22/42/917932242.db2.gz UOCXPWTXPHDJKB-UHFFFAOYSA-N 0 3 401.923 4.425 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)N1CCO[C@H](c2ccccc2Cl)C1 ZINC000509365740 918029554 /nfs/dbraw/zinc/02/95/54/918029554.db2.gz LIDFKHBDZYVMSW-OALUTQOASA-N 0 3 419.978 4.322 20 0 HIADHN COc1ccc(CN2CCC(C(=O)Nc3ccc(Br)cn3)CC2)cc1C ZINC000509384421 918049962 /nfs/dbraw/zinc/04/99/62/918049962.db2.gz FDCNOWCLJDJFBT-UHFFFAOYSA-N 0 3 418.335 4.012 20 0 HIADHN Cc1cc(F)ccc1CN1CCC(C(=O)Nc2ccc(Br)cn2)CC1 ZINC000509390341 918056590 /nfs/dbraw/zinc/05/65/90/918056590.db2.gz BGIVXOKWKNPSNS-UHFFFAOYSA-N 0 3 406.299 4.142 20 0 HIADHN C[C@H](c1ccccc1)N1CCC(NS(=O)(=O)CCc2cccc(Cl)c2)CC1 ZINC000509433020 918091880 /nfs/dbraw/zinc/09/18/80/918091880.db2.gz BWWRTIBKMGAPMT-QGZVFWFLSA-N 0 3 406.979 4.028 20 0 HIADHN O=S(=O)(NC1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1)c1csc2ccccc21 ZINC000509434705 918092606 /nfs/dbraw/zinc/09/26/06/918092606.db2.gz YTHCBWYEHKDODW-YQQQUEKLSA-N 0 3 412.580 4.375 20 0 HIADHN O=C([C@@H]1CN(Cc2ccccc2)CCC1(F)F)N(Cc1ccco1)CC(F)(F)F ZINC000509508916 918155929 /nfs/dbraw/zinc/15/59/29/918155929.db2.gz OMSJAKMDBIOLPW-KRWDZBQOSA-N 0 3 416.390 4.328 20 0 HIADHN CCCCOc1cc(CN2CCC(C(=O)N3CCC[C@@H](C)C3)CC2)ccc1OC ZINC000509521616 918170955 /nfs/dbraw/zinc/17/09/55/918170955.db2.gz SPNGNNJVBAIJJE-LJQANCHMSA-N 0 3 402.579 4.345 20 0 HIADHN CCCCOc1ccc(CN2CCC(C(=O)N3CCC[C@H](C)C3)CC2)cc1OC ZINC000509544671 918194706 /nfs/dbraw/zinc/19/47/06/918194706.db2.gz QYWLJKOYJVFQKO-IBGZPJMESA-N 0 3 402.579 4.345 20 0 HIADHN C[C@@H]1CCCN(C(=O)C2CCN(Cc3ccccc3OCc3cccnc3)CC2)C1 ZINC000509547180 918197862 /nfs/dbraw/zinc/19/78/62/918197862.db2.gz XVOJIHJXPJXWKI-HXUWFJFHSA-N 0 3 407.558 4.131 20 0 HIADHN COc1ccccc1NC(=O)C1CCN(Cc2cn(-c3ccccc3)nc2C)CC1 ZINC000509558478 918208866 /nfs/dbraw/zinc/20/88/66/918208866.db2.gz ISCJRCSZDPIUPM-UHFFFAOYSA-N 0 3 404.514 4.040 20 0 HIADHN C[C@@H]1CCCN(C(=O)C2CCN(Cc3ccccc3OCc3ccncc3)CC2)C1 ZINC000509560244 918210639 /nfs/dbraw/zinc/21/06/39/918210639.db2.gz NXAOKSUHFBQOEO-HXUWFJFHSA-N 0 3 407.558 4.131 20 0 HIADHN C[C@H]1CCCN(C(=O)C2CCN(Cc3cccc(OCc4ccccn4)c3)CC2)C1 ZINC000509564901 918213821 /nfs/dbraw/zinc/21/38/21/918213821.db2.gz QUTNPLUBWQEXDU-FQEVSTJZSA-N 0 3 407.558 4.131 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N1CCC2(CC1)OCCc1ccsc12)c1ccco1 ZINC000509595987 918245756 /nfs/dbraw/zinc/24/57/56/918245756.db2.gz LYMKJMZTEIYGEY-FUHWJXTLSA-N 0 3 417.575 4.044 20 0 HIADHN CCc1nc2c(s1)[C@H](N(C)C(=O)NC[C@H](N[C@H](C)CC)c1ccco1)CCC2 ZINC000509615383 918264731 /nfs/dbraw/zinc/26/47/31/918264731.db2.gz UTNIJWTUIWWMGP-HYVNUMGLSA-N 0 3 404.580 4.447 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)N(C)[C@H]1CCO[C@H](c2ccc(F)cc2)C1)c1ccco1 ZINC000509617384 918266350 /nfs/dbraw/zinc/26/63/50/918266350.db2.gz YNANZQSMTLMDKC-IBHRTIHJSA-N 0 3 417.525 4.410 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)CCCCc2ccc(Cl)c(Cl)c2)CC1 ZINC000509631132 918274697 /nfs/dbraw/zinc/27/46/97/918274697.db2.gz DFOSLWFOJSZROI-QGZVFWFLSA-N 0 3 414.421 4.096 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)c2ccc(Cl)c(Br)c2)CC1 ZINC000509676710 918308142 /nfs/dbraw/zinc/30/81/42/918308142.db2.gz BRSKOPQUIQJHEW-UHFFFAOYSA-N 0 3 411.727 4.432 20 0 HIADHN CCOC[C@H]1CCCN([C@@H]2CCCN(c3c(C)cc(Br)cc3C)C2=O)C1 ZINC000509701119 918332945 /nfs/dbraw/zinc/33/29/45/918332945.db2.gz UULIGQCJXFWWCF-PKOBYXMFSA-N 0 3 423.395 4.310 20 0 HIADHN Cc1cccc([C@@H](CNCc2ccc(Sc3ccccn3)o2)N2CCOCC2)c1 ZINC000509863133 918465797 /nfs/dbraw/zinc/46/57/97/918465797.db2.gz HDQRVAWNWAQOJH-OAQYLSRUSA-N 0 3 409.555 4.297 20 0 HIADHN CCC(CC)[C@H](CNC(=O)Nc1ccc(-c2cc(=O)[n-]c(C)n2)cc1)[NH+]1CCCC1 ZINC000509891086 918492849 /nfs/dbraw/zinc/49/28/49/918492849.db2.gz QODNETKLYNRYPP-NRFANRHFSA-N 0 3 411.550 4.180 20 0 HIADHN COc1cccc(-c2c[nH]cc2C(=O)NC[C@H]2CCCCN2Cc2ccccc2)c1 ZINC000509942980 918539563 /nfs/dbraw/zinc/53/95/63/918539563.db2.gz MPNHNEZUQQCMOH-OAQYLSRUSA-N 0 3 403.526 4.475 20 0 HIADHN CCC(=O)Nc1ccc(Cl)c(NC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000509947317 918543129 /nfs/dbraw/zinc/54/31/29/918543129.db2.gz CGFBSNVPEZZBAO-QGZVFWFLSA-N 0 3 400.910 4.085 20 0 HIADHN Cn1cc2c(n1)CCC[C@@H]2NCc1ccc(OC(F)(F)[C@@H](F)C(F)(F)F)cc1 ZINC000509956791 918549285 /nfs/dbraw/zinc/54/92/85/918549285.db2.gz IUYJEIBWEQOAKB-HOCLYGCPSA-N 0 3 407.358 4.459 20 0 HIADHN Cc1cccc(C)c1NC(=O)CNC(=O)[C@@H](C)N1CCC[C@](C)(c2ccccc2)CC1 ZINC000510077127 918646227 /nfs/dbraw/zinc/64/62/27/918646227.db2.gz AYFHESBYAHOKMM-RLWLMLJZSA-N 0 3 421.585 4.190 20 0 HIADHN Cn1ccnc1COc1ccc(CN2CCC(OCCc3ccccc3)CC2)cc1 ZINC000510375405 918860700 /nfs/dbraw/zinc/86/07/00/918860700.db2.gz LHIDVIWVKVQNBX-UHFFFAOYSA-N 0 3 405.542 4.223 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)NCc1ccc(N2CCCCCC2)nc1 ZINC000510388497 918866847 /nfs/dbraw/zinc/86/68/47/918866847.db2.gz JFKMPPOSCWAHNG-UHFFFAOYSA-N 0 3 406.530 4.200 20 0 HIADHN CCCCOc1ccc(CN2CCC(C(=O)N3CCC(C)CC3)CC2)cc1OC ZINC000510403922 918876052 /nfs/dbraw/zinc/87/60/52/918876052.db2.gz LPIIONSUNGVTED-UHFFFAOYSA-N 0 3 402.579 4.345 20 0 HIADHN CCCCN(C)C(=O)C1CCN(CC2=Cc3cc(Br)ccc3OC2)CC1 ZINC000510425336 918889886 /nfs/dbraw/zinc/88/98/86/918889886.db2.gz BMEHDOIUAPGQMC-UHFFFAOYSA-N 0 3 421.379 4.195 20 0 HIADHN CCCN(CCC)C(=O)c1ccc(NC(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000510427149 918890487 /nfs/dbraw/zinc/89/04/87/918890487.db2.gz IPJSACMMJDACMX-QHCPKHFHSA-N 0 3 422.573 4.345 20 0 HIADHN CCCOc1ccc(CN2CCC(C(=O)N3CCC(C)CC3)CC2)cc1OCC ZINC000510426318 918890587 /nfs/dbraw/zinc/89/05/87/918890587.db2.gz CLGRGBUEOVOBFF-UHFFFAOYSA-N 0 3 402.579 4.345 20 0 HIADHN C[C@@H](c1ncc(-c2ccc(Cl)cc2Cl)o1)N1CC[C@@H](CN2CCOCC2)C1 ZINC000510431574 918893860 /nfs/dbraw/zinc/89/38/60/918893860.db2.gz WVISGHQUBCSHKR-GJZGRUSLSA-N 0 3 410.345 4.364 20 0 HIADHN CCCN(C(=O)c1ccc(N2CCN(CC)CC2)cc1)[C@H]1CCc2ccccc2C1 ZINC000510452396 918908863 /nfs/dbraw/zinc/90/88/63/918908863.db2.gz PNLKAZQCDXOBKS-VWLOTQADSA-N 0 3 405.586 4.238 20 0 HIADHN Cc1n[nH]c(C)c1[C@@H]1CCCCCN1C(=O)NCCCN1CCc2ccccc2C1 ZINC000510476332 918930484 /nfs/dbraw/zinc/93/04/84/918930484.db2.gz DDWTYSVBBJTHPX-QFIPXVFZSA-N 0 3 409.578 4.102 20 0 HIADHN CCN1CCN([C@@H]2CCN([C@@H](C)c3ncc(-c4ccc(Cl)cc4Cl)o3)C2)CC1 ZINC000510496908 918944804 /nfs/dbraw/zinc/94/48/04/918944804.db2.gz RVYHRSLAQGEWDZ-DOTOQJQBSA-N 0 3 423.388 4.421 20 0 HIADHN CCOc1c(Cl)cc(CNC(=O)c2oc3ccccc3c2CN(C)C)cc1OC ZINC000510498930 918947717 /nfs/dbraw/zinc/94/77/17/918947717.db2.gz DIEZYHZHVNOYPB-UHFFFAOYSA-N 0 3 416.905 4.485 20 0 HIADHN CCOc1ccc([C@H](NC(=O)N[C@H](C)C2=CCN(C)CC2)C(C)C)cc1OCC ZINC000510499594 918948000 /nfs/dbraw/zinc/94/80/00/918948000.db2.gz HCJYKOLYNMPJDQ-VGOFRKELSA-N 0 3 403.567 4.131 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)NCc2ccc(OCC(F)(F)F)cc2)C1 ZINC000510532656 918979144 /nfs/dbraw/zinc/97/91/44/918979144.db2.gz WBVTYMSKFCSWAK-QFBILLFUSA-N 0 3 421.463 4.262 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)N[C@H](c1nccs1)c1ccccc1 ZINC000510557361 919001202 /nfs/dbraw/zinc/00/12/02/919001202.db2.gz DFYXCRARNVZROO-QFIPXVFZSA-N 0 3 422.598 4.439 20 0 HIADHN CCCOc1ccc(Oc2ncccc2CNC(=O)N[C@@H](C)C2=CCN(C)CC2)cc1 ZINC000510559298 919002515 /nfs/dbraw/zinc/00/25/15/919002515.db2.gz FRVJVDBMBOURCZ-SFHVURJKSA-N 0 3 424.545 4.112 20 0 HIADHN C[C@@H](NC(=O)N[C@@H](C)c1ccc(NC(=O)c2ccc(F)cc2)cc1)C1=CCN(C)CC1 ZINC000510570698 919013714 /nfs/dbraw/zinc/01/37/14/919013714.db2.gz JZHXUKJLCIKSIJ-DLBZAZTESA-N 0 3 424.520 4.089 20 0 HIADHN CN(C)CCN(Cc1cccc(F)c1)C(=O)N[C@@H](c1nccs1)c1ccccc1 ZINC000510595101 919037426 /nfs/dbraw/zinc/03/74/26/919037426.db2.gz FIORACXRFWYYMC-HXUWFJFHSA-N 0 3 412.534 4.145 20 0 HIADHN CC[C@H](NCc1nc2cc(C(=O)OC)ccc2c(=O)[nH]1)C12CC3CC(CC(C3)C1)C2 ZINC000510617510 919059665 /nfs/dbraw/zinc/05/96/65/919059665.db2.gz ISCQWDYVQWPONI-JHXAUMMHSA-N 0 3 409.530 4.207 20 0 HIADHN C[C@@H]1COCC[C@@H]1CNC(=O)N(CCN(C)Cc1ccccc1)Cc1ccccc1 ZINC000510618647 919060342 /nfs/dbraw/zinc/06/03/42/919060342.db2.gz VGLRHLYUKVNGDQ-ZJSXRUAMSA-N 0 3 409.574 4.003 20 0 HIADHN COc1ccc(C[C@@H](NCc2ccc3c(c2)NC(=O)CO3)c2ccccc2)cc1OC ZINC000510626928 919069402 /nfs/dbraw/zinc/06/94/02/919069402.db2.gz BIVHDVFYKDSVDJ-HXUWFJFHSA-N 0 3 418.493 4.108 20 0 HIADHN Cn1c2ccc(CNCc3ccccc3-c3ccc(Cn4cccn4)cc3)cc2oc1=O ZINC000510633118 919075253 /nfs/dbraw/zinc/07/52/53/919075253.db2.gz JIRXEEBGXXJPET-UHFFFAOYSA-N 0 3 424.504 4.333 20 0 HIADHN CN(Cc1c[nH]nc1-c1ccc(F)cc1)C[C@@H](O)COc1ccccc1C(F)(F)F ZINC000510639183 919080855 /nfs/dbraw/zinc/08/08/55/919080855.db2.gz CCUNQKLPHJGVMG-QGZVFWFLSA-N 0 3 423.410 4.106 20 0 HIADHN CC[C@H](CNC(=O)Nc1ccc(C(=O)NCC(C)C)cc1)N1CCc2ccccc2C1 ZINC000510650936 919091877 /nfs/dbraw/zinc/09/18/77/919091877.db2.gz KUTBJCACXXDGMF-HSZRJFAPSA-N 0 3 422.573 4.031 20 0 HIADHN Cc1csc2nc(CN3CCC[C@@H](c4nc5ccccc5n4C(C)C)C3)cc(=O)n12 ZINC000510656613 919097518 /nfs/dbraw/zinc/09/75/18/919097518.db2.gz GIJWCQYXSJYTJX-QGZVFWFLSA-N 0 3 421.570 4.375 20 0 HIADHN COc1cc(C)ccc1NC(=O)N(CCN(C)C)Cc1ccc(Br)cc1 ZINC000510666465 919107404 /nfs/dbraw/zinc/10/74/04/919107404.db2.gz UNQDHWNUQOBOGB-UHFFFAOYSA-N 0 3 420.351 4.362 20 0 HIADHN COc1ccc(Cl)cc1N(C)C(=O)c1ccc(N2CCN(C(C)C)CC2)cc1 ZINC000510714085 919154983 /nfs/dbraw/zinc/15/49/83/919154983.db2.gz FKGLWYTUWOMWHE-UHFFFAOYSA-N 0 3 401.938 4.156 20 0 HIADHN C[C@H](C(=O)Nc1ccc(=O)n(Cc2ccc(Cl)c(Cl)c2)c1)N1CCCCCC1 ZINC000510778873 919237695 /nfs/dbraw/zinc/23/76/95/919237695.db2.gz NHWLDEMAJRONEU-OAHLLOKOSA-N 0 3 422.356 4.406 20 0 HIADHN CCOC(=O)Cn1ccc2cc(NC(=O)c3oc4ccccc4c3CN(C)C)ccc21 ZINC000510777640 919238686 /nfs/dbraw/zinc/23/86/86/919238686.db2.gz FNLCIYDPZSUELS-UHFFFAOYSA-N 0 3 419.481 4.265 20 0 HIADHN C[C@H](NC(=O)[C@H](Oc1ccc(F)cc1Cl)c1ccccc1)C1=CCN(C)CC1 ZINC000510787338 919252547 /nfs/dbraw/zinc/25/25/47/919252547.db2.gz KLLCTZBEZDCKDR-YCRPNKLZSA-N 0 3 402.897 4.366 20 0 HIADHN O=C([C@H]1CN(Cc2ccccc2)CCC1(F)F)N1CCC[C@@H](c2nccs2)C1 ZINC000510824591 919304898 /nfs/dbraw/zinc/30/48/98/919304898.db2.gz FHSRCMVRELNNCB-QZTJIDSGSA-N 0 3 405.514 4.007 20 0 HIADHN C[C@H](c1cccc(NC(=O)c2oc3ccccc3c2CN(C)C)c1)N1CCOCC1 ZINC000510853706 919341405 /nfs/dbraw/zinc/34/14/05/919341405.db2.gz RGBPZWAQFYQUEW-QGZVFWFLSA-N 0 3 407.514 4.140 20 0 HIADHN O=C(N[C@H](c1ccccc1)c1ccncc1)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000510857641 919347513 /nfs/dbraw/zinc/34/75/13/919347513.db2.gz PZUBUDFMJPOZQN-DHIUTWEWSA-N 0 3 421.491 4.445 20 0 HIADHN O=C(NCCCN1CCc2ccccc2C1)N1CC[C@@H](C(F)(F)F)C2(CCC2)C1 ZINC000510918005 919430557 /nfs/dbraw/zinc/43/05/57/919430557.db2.gz XTUGRRYDIVBQMQ-LJQANCHMSA-N 0 3 409.496 4.199 20 0 HIADHN O=C(Cc1ccccc1)N1CCC[C@H](N[C@@H]2CCCc3nn(-c4ccccc4)cc32)C1 ZINC000510934363 919457060 /nfs/dbraw/zinc/45/70/60/919457060.db2.gz YGBLNHFSAYOXBK-XUZZJYLKSA-N 0 3 414.553 4.073 20 0 HIADHN O=C(COc1ccccc1)N1CC[C@H](N[C@H]2CCSc3ccc(Cl)cc32)C1 ZINC000511045962 919635804 /nfs/dbraw/zinc/63/58/04/919635804.db2.gz JOODZRCPUMRFEF-LPHOPBHVSA-N 0 3 402.947 4.146 20 0 HIADHN CC(C)[C@@H](NCC(=O)N1CCC[C@@H]1c1ccc2c(c1)OCCCO2)c1ccccc1 ZINC000511047086 919637714 /nfs/dbraw/zinc/63/77/14/919637714.db2.gz TXDJFCJPXSNJHV-PXDATVDWSA-N 0 3 408.542 4.498 20 0 HIADHN COC[C@H](N[C@@H]1CCCN(C(=O)Cc2ccccc2)C1)c1cccc(C(F)(F)F)c1 ZINC000511052559 919647841 /nfs/dbraw/zinc/64/78/41/919647841.db2.gz BXXIQZMIXMCFEN-RTWAWAEBSA-N 0 3 420.475 4.216 20 0 HIADHN Cc1csc2nc(CN3CCC[C@@H](c4cccc(C(F)(F)F)c4)C3)cc(=O)n12 ZINC000511108196 919716645 /nfs/dbraw/zinc/71/66/45/919716645.db2.gz PLQWKCLCQGNIHQ-OAHLLOKOSA-N 0 3 407.461 4.463 20 0 HIADHN O=C(N[C@@H](c1ccccc1)c1cccnc1)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000511146779 919765414 /nfs/dbraw/zinc/76/54/14/919765414.db2.gz QOAWMDWOJHWNGP-PKTZIBPZSA-N 0 3 421.491 4.445 20 0 HIADHN CCOc1cc(CN(C)C(=O)[C@H]2CCCN2Cc2ccccc2)ccc1OC(F)F ZINC000511156975 919775765 /nfs/dbraw/zinc/77/57/65/919775765.db2.gz YQKQVWLQQZBJLE-LJQANCHMSA-N 0 3 418.484 4.310 20 0 HIADHN C[C@H](NC(=O)N1CCc2ccccc2[C@H](c2ccccc2)[C@H]1C)C1=CCN(C)CC1 ZINC000511232288 919836714 /nfs/dbraw/zinc/83/67/14/919836714.db2.gz JZLHQIJKAGAXFX-DFIYOIEZSA-N 0 3 403.570 4.425 20 0 HIADHN CC[C@@H](C)n1ncc2c1nc(C)cc2C(=O)NC[C@@H](CC)N1CCc2ccccc2C1 ZINC000511269017 919867300 /nfs/dbraw/zinc/86/73/00/919867300.db2.gz UAWFXPOTKTYGNE-WIYYLYMNSA-N 0 3 419.573 4.277 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)N[C@H](C[C@H]2CCOC2)c2ccccc2)CC1 ZINC000511363257 919956730 /nfs/dbraw/zinc/95/67/30/919956730.db2.gz NAJFQFFGIGROAY-RCZVLFRGSA-N 0 3 421.585 4.460 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N[C@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000511366042 919959521 /nfs/dbraw/zinc/95/95/21/919959521.db2.gz SMWPTIPZPNUSIB-CEWLAPEOSA-N 0 3 413.587 4.352 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)N[C@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000511372115 919965580 /nfs/dbraw/zinc/96/55/80/919965580.db2.gz GEWFQLWYSRXYFD-WMZHIEFXSA-N 0 3 413.537 4.067 20 0 HIADHN CC(C)[C@@H](NC1CCC(C(=O)OC(C)(C)C)CC1)c1nc(-c2ccncc2)no1 ZINC000511382230 919983755 /nfs/dbraw/zinc/98/37/55/919983755.db2.gz WDJRNLSEFJHNGG-DAWZGUTISA-N 0 3 400.523 4.319 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)N[C@@H](C[C@H]1CCOC1)c1ccccc1 ZINC000511392413 920001572 /nfs/dbraw/zinc/00/15/72/920001572.db2.gz UQPRMGGEGKWSDG-PFATUAPWSA-N 0 3 421.585 4.460 20 0 HIADHN C[C@@H]1CCN(C(=O)N[C@@H](C[C@H]2CCOC2)c2ccccc2)CCN1Cc1ccccc1 ZINC000511395192 920006749 /nfs/dbraw/zinc/00/67/49/920006749.db2.gz CFYIKUKHSZKJNB-PFATUAPWSA-N 0 3 421.585 4.460 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)N[C@H](C[C@@H]2CCOC2)c2ccccc2)CC1 ZINC000511397857 920009120 /nfs/dbraw/zinc/00/91/20/920009120.db2.gz LIWHKKQIWMWKAN-WMZHIEFXSA-N 0 3 411.546 4.053 20 0 HIADHN CC(=O)Nc1ccc(C)cc1NC(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000511444097 920054028 /nfs/dbraw/zinc/05/40/28/920054028.db2.gz JHQQBJWQQWPLNZ-SFHVURJKSA-N 0 3 401.457 4.049 20 0 HIADHN CCCN(CC)C(=O)c1ccc(C(=O)NC[C@@H](CC)N2CCc3ccccc3C2)cc1 ZINC000511509289 920127044 /nfs/dbraw/zinc/12/70/44/920127044.db2.gz VXPRXSVFOQQZKH-XMMPIXPASA-N 0 3 421.585 4.125 20 0 HIADHN COc1ccc(C[C@@H](C)C(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)cc1OC ZINC000511551533 920185089 /nfs/dbraw/zinc/18/50/89/920185089.db2.gz LNPPFTKQQIVRTR-WOJBJXKFSA-N 0 3 410.558 4.005 20 0 HIADHN Cc1ccc(NC(=O)C2CC2)cc1NC(=O)N(CCN(C)C)Cc1ccc(F)cc1 ZINC000511557837 920196171 /nfs/dbraw/zinc/19/61/71/920196171.db2.gz DJXSIYUBKVHQAX-UHFFFAOYSA-N 0 3 412.509 4.078 20 0 HIADHN O=C(CN[C@H](c1cccc(OC(F)(F)F)c1)C1CC1)Nc1ccc2c(c1)OCCO2 ZINC000511565322 920206029 /nfs/dbraw/zinc/20/60/29/920206029.db2.gz JVGCFVKPSQYCFN-FQEVSTJZSA-N 0 3 422.403 4.036 20 0 HIADHN CC[C@H](O)[C@@H]1CCCCN1CC(=O)NC[C@@H](c1c[nH]c2ccccc21)c1ccccc1 ZINC000511573988 920218308 /nfs/dbraw/zinc/21/83/08/920218308.db2.gz RMURPDOBDQDGHT-ZODMCCGTSA-N 0 3 419.569 4.041 20 0 HIADHN COc1ccccc1CN(C)C(=O)CN[C@@H](c1cccc(OC(F)(F)F)c1)C1CC1 ZINC000511599106 920245724 /nfs/dbraw/zinc/24/57/24/920245724.db2.gz YKSMKHZNRPBNOM-OAQYLSRUSA-N 0 3 422.447 4.293 20 0 HIADHN CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@@H]3CN2Cc1csc(-c2ccc(Br)cc2)n1 ZINC000511642319 920307585 /nfs/dbraw/zinc/30/75/85/920307585.db2.gz XFWDPBWGVZTHNB-KISNFGTJSA-N 0 3 405.361 4.428 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)Cc2cn3cc(Cl)cc(Cl)c3n2)C1 ZINC000511660304 920326340 /nfs/dbraw/zinc/32/63/40/920326340.db2.gz FLVVYXNLHTXSKK-PBHICJAKSA-N 0 3 417.340 4.135 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)c2ccc3c(c2)[nH]c(=O)n3C2CCCC2)C1 ZINC000511677059 920341441 /nfs/dbraw/zinc/34/14/41/920341441.db2.gz FJWOBVTZQWQLIA-YLJYHZDGSA-N 0 3 418.541 4.422 20 0 HIADHN CN(C)[C@@H]1Cc2ccccc2N(C(=O)c2cnn(-c3ccc(C(F)(F)F)cc3)c2)C1 ZINC000511711082 920377081 /nfs/dbraw/zinc/37/70/81/920377081.db2.gz FGHCYDLCDYXZIB-LJQANCHMSA-N 0 3 414.431 4.024 20 0 HIADHN CC(C)(C)[C@H](NC(=O)CN1C[C@H](c2ccccc2)[C@H]2COCC[C@H]21)c1cccs1 ZINC000511765936 920451348 /nfs/dbraw/zinc/45/13/48/920451348.db2.gz YMMGCJZKVQVANQ-GLHSZLCASA-N 0 3 412.599 4.456 20 0 HIADHN Brc1ccc2[nH]c(CN3C[C@H](c4ccccc4)[C@H]4COCC[C@H]43)nc2c1 ZINC000511775955 920464476 /nfs/dbraw/zinc/46/44/76/920464476.db2.gz JCCGHGDZQWQKEM-MBOZVWFJSA-N 0 3 412.331 4.330 20 0 HIADHN OC[C@H](CNCc1cscc1Br)Cc1ccccc1Br ZINC000511787853 920480984 /nfs/dbraw/zinc/48/09/84/920480984.db2.gz RUVBYKUUVOIURE-NSHDSACASA-N 0 3 419.182 4.214 20 0 HIADHN Cc1nn(-c2ccc(Cl)cc2)c(C)c1CC(=O)NC[C@@H](c1ccccc1)N(C)C ZINC000511802355 920496246 /nfs/dbraw/zinc/49/62/46/920496246.db2.gz OCEPEWCBFICDDH-QFIPXVFZSA-N 0 3 410.949 4.104 20 0 HIADHN CCSc1nnc(NC(=O)NC[C@H](c2ccccc2)N2CCC(C)CC2)s1 ZINC000511808526 920504744 /nfs/dbraw/zinc/50/47/44/920504744.db2.gz PMXFTXOBFFVREQ-MRXNPFEDSA-N 0 3 405.593 4.245 20 0 HIADHN COc1cc(F)c([C@H](C)NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)cc1OC ZINC000511915119 920659414 /nfs/dbraw/zinc/65/94/14/920659414.db2.gz DRKLQDUQQGOQIQ-DOTOQJQBSA-N 0 3 418.484 4.071 20 0 HIADHN FC(F)(F)[C@@H]1CCC[C@@H](CNCc2ncc(I)s2)C1 ZINC000512015927 920788269 /nfs/dbraw/zinc/78/82/69/920788269.db2.gz QNTGZAISYDSKSK-RKDXNWHRSA-N 0 3 404.239 4.206 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N[C@H](C)c1cc(OC)c(OC)cc1F)c1ccsc1 ZINC000512041001 920812951 /nfs/dbraw/zinc/81/29/51/920812951.db2.gz KHLKRYBAXYDFDN-RDTXWAMCSA-N 0 3 423.554 4.348 20 0 HIADHN C[C@H](CC(=O)Nc1cc(C(F)(F)F)ccc1Cl)NCc1cccc(N(C)C)n1 ZINC000512051145 920820120 /nfs/dbraw/zinc/82/01/20/920820120.db2.gz GGLNGAXVYYKNAH-GFCCVEGCSA-N 0 3 414.859 4.327 20 0 HIADHN CC1CCN(S(=O)(=O)Cc2ccccc2CNCc2ccc3occc3c2)CC1 ZINC000512050351 920820330 /nfs/dbraw/zinc/82/03/30/920820330.db2.gz BRDNPZOIVKNDHO-UHFFFAOYSA-N 0 3 412.555 4.284 20 0 HIADHN C[C@@H](CC(=O)Nc1cc(C(F)(F)F)ccc1Cl)NCc1cccc(N(C)C)n1 ZINC000512051146 920820350 /nfs/dbraw/zinc/82/03/50/920820350.db2.gz GGLNGAXVYYKNAH-LBPRGKRZSA-N 0 3 414.859 4.327 20 0 HIADHN FC(F)(F)[C@@H]1CCCC[C@H]1CNCc1ncc(I)s1 ZINC000512051486 920821679 /nfs/dbraw/zinc/82/16/79/920821679.db2.gz IGBHFGBGEOJUHY-DTWKUNHWSA-N 0 3 404.239 4.206 20 0 HIADHN COc1cc2c(cc1OC)CCN(Cc1ccccc1OCc1cccnc1)CC2 ZINC000512058321 920827152 /nfs/dbraw/zinc/82/71/52/920827152.db2.gz NYJYEVUOBWDASI-UHFFFAOYSA-N 0 3 404.510 4.279 20 0 HIADHN COc1cccc(COCCNCc2cnn(-c3ccc(C(F)(F)F)cc3)c2)c1 ZINC000512060618 920829459 /nfs/dbraw/zinc/82/94/59/920829459.db2.gz VYCLNUDLFISOCM-UHFFFAOYSA-N 0 3 405.420 4.206 20 0 HIADHN Cc1ccccc1-c1cc(C(=O)N[C@H](C)C2=CCN(C)CC2)c2cnn(C(C)C)c2n1 ZINC000512107726 920864363 /nfs/dbraw/zinc/86/43/63/920864363.db2.gz DDMZVJAZTDWGNH-GOSISDBHSA-N 0 3 417.557 4.368 20 0 HIADHN CN(C)Cc1cnc(CNCC2(c3cccc(C(F)(F)F)c3)CCOCC2)s1 ZINC000512120731 920872679 /nfs/dbraw/zinc/87/26/79/920872679.db2.gz GVTPDZFJMLGLOI-UHFFFAOYSA-N 0 3 413.509 4.062 20 0 HIADHN O=C(CCc1ccccc1)N1CCC(NCc2cscc2Br)CC1 ZINC000512131895 920880056 /nfs/dbraw/zinc/88/00/56/920880056.db2.gz SQZVFZONHCUYQM-UHFFFAOYSA-N 0 3 407.377 4.224 20 0 HIADHN Cc1cc([C@@H](C)NCc2ccc(N3CCO[C@H](C)C3)nc2)sc1Br ZINC000512135231 920882886 /nfs/dbraw/zinc/88/28/86/920882886.db2.gz HAIPLCXVWASXJY-ZIAGYGMSSA-N 0 3 410.381 4.290 20 0 HIADHN COc1cc2c(cc1OC)CN(C(=O)CN1C[C@H](C)CC[C@@H]1c1ccccc1)CC2 ZINC000512144072 920887696 /nfs/dbraw/zinc/88/76/96/920887696.db2.gz ALMFUCXIBNJEGQ-XMSQKQJNSA-N 0 3 408.542 4.062 20 0 HIADHN O=S(=O)(CCCN[C@H](CCO)c1ccc(Cl)c(Cl)c1)c1ccc(F)cc1 ZINC000512199018 920944922 /nfs/dbraw/zinc/94/49/22/920944922.db2.gz CJQKOLUYIPKAKL-GOSISDBHSA-N 0 3 420.333 4.010 20 0 HIADHN COc1cccc(NC(=O)[C@@H](NCCc2ccc3c(c2)CCO3)c2ccccc2)c1 ZINC000512247932 921006567 /nfs/dbraw/zinc/00/65/67/921006567.db2.gz BNRXGJLARGYKJH-DEOSSOPVSA-N 0 3 402.494 4.142 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)c3[nH]c(C)c(C(C)=O)c3C(C)C)cc2)CC1 ZINC000512269047 921025334 /nfs/dbraw/zinc/02/53/34/921025334.db2.gz HAAUVVVELBRBMV-UHFFFAOYSA-N 0 3 410.562 4.039 20 0 HIADHN O=C(C1CCN(Cc2cccc(OC(F)(F)F)c2)CC1)N1CCc2ccccc21 ZINC000512296349 921051679 /nfs/dbraw/zinc/05/16/79/921051679.db2.gz XWTYZUWWIWVWKP-UHFFFAOYSA-N 0 3 404.432 4.387 20 0 HIADHN Cc1nn(-c2ccccc2)cc1CN[C@@H](C)CC(=O)N(C)Cc1cccc(Cl)c1 ZINC000512314603 921065700 /nfs/dbraw/zinc/06/57/00/921065700.db2.gz OXLSOHZQQURXRS-KRWDZBQOSA-N 0 3 410.949 4.361 20 0 HIADHN COc1cc(CN2CCC(C(=O)NCCc3cccs3)CC2)ccc1OC(C)C ZINC000512354807 921100366 /nfs/dbraw/zinc/10/03/66/921100366.db2.gz KXYSSSJMQNCWLK-UHFFFAOYSA-N 0 3 416.587 4.115 20 0 HIADHN C[C@@H](c1ccc(F)c(F)c1)N(C)C[C@H](O)COc1ccc(Br)cc1 ZINC000513496860 921846661 /nfs/dbraw/zinc/84/66/61/921846661.db2.gz MHNYDMPBMUTNJG-WFASDCNBSA-N 0 3 400.263 4.160 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)NCc1ccc(NC(=O)c2ccco2)cc1)c1ccco1 ZINC000513502710 921852529 /nfs/dbraw/zinc/85/25/29/921852529.db2.gz DKFXDZHKOPNLIH-QFBILLFUSA-N 0 3 424.501 4.054 20 0 HIADHN COC(=O)c1cccc(-c2nc(CN3CCC[C@@H]3[C@@H]3C[C@@H](C)CC[C@H]3O)cs2)c1 ZINC000513538368 921877432 /nfs/dbraw/zinc/87/74/32/921877432.db2.gz JXXYEVJGEHETGC-JWOSDPRPSA-N 0 3 414.571 4.358 20 0 HIADHN COC(=O)c1cccc(-c2nc(CN3CCC[C@@H]3[C@@H]3C[C@@H](C)CC[C@@H]3O)cs2)c1 ZINC000513538369 921877862 /nfs/dbraw/zinc/87/78/62/921877862.db2.gz JXXYEVJGEHETGC-KQLYMOGASA-N 0 3 414.571 4.358 20 0 HIADHN COC(=O)c1cccc(-c2nc(CN3CCC[C@@H]3[C@@H]3C[C@H](C)CC[C@H]3O)cs2)c1 ZINC000513538367 921877914 /nfs/dbraw/zinc/87/79/14/921877914.db2.gz JXXYEVJGEHETGC-CGRMTHRGSA-N 0 3 414.571 4.358 20 0 HIADHN Cc1nc([C@@H]2CCCOC2)sc1C(=O)N[C@@H](CN(C)C)c1ccc(Cl)cc1 ZINC000513574368 921906806 /nfs/dbraw/zinc/90/68/06/921906806.db2.gz WIIBRTNFPOCHDC-WBVHZDCISA-N 0 3 407.967 4.032 20 0 HIADHN CC(C)[C@H](C(=O)N1CCC(C(=O)c2c(F)cc(F)cc2F)CC1)N1CCCCC1 ZINC000513580789 921911608 /nfs/dbraw/zinc/91/16/08/921911608.db2.gz RGVIZWISLRXSAX-HXUWFJFHSA-N 0 3 410.480 4.036 20 0 HIADHN COc1ccccc1[C@H]1CCN(C(=O)[C@@H]2CN(Cc3ccccc3)CCC2(F)F)C1 ZINC000513596002 921926757 /nfs/dbraw/zinc/92/67/57/921926757.db2.gz VNLXOZJBWZPHHM-FPOVZHCZSA-N 0 3 414.496 4.169 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)[C@H](NC(=O)c2ccc(Cl)s2)C(C)C)c1 ZINC000513605490 921936989 /nfs/dbraw/zinc/93/69/89/921936989.db2.gz SWDQFFUZEUZMRA-GOSISDBHSA-N 0 3 407.967 4.165 20 0 HIADHN Cc1nc(COc2ccc(CN3CCC(N(C)c4ccc(C)nn4)CC3)cc2)cs1 ZINC000513633257 921959986 /nfs/dbraw/zinc/95/99/86/921959986.db2.gz KPURRUGDINWBMN-UHFFFAOYSA-N 0 3 423.586 4.230 20 0 HIADHN Brc1ccc(-c2ccc(CN3CCCN(c4cccnn4)CC3)o2)cc1 ZINC000513643161 921967032 /nfs/dbraw/zinc/96/70/32/921967032.db2.gz RNJQWWHPHCBOHN-UHFFFAOYSA-N 0 3 413.319 4.211 20 0 HIADHN Clc1cccc([C@H](CN[C@H](c2ncc[nH]2)C2CCCCC2)N2CCOCC2)c1 ZINC000513656033 921978163 /nfs/dbraw/zinc/97/81/63/921978163.db2.gz PUWZLPJGJXKQDM-SFTDATJTSA-N 0 3 402.970 4.348 20 0 HIADHN COc1cc(CN[C@@H](C)c2ccc3c(c2)OCC(=O)N3)ccc1OCc1ccccc1 ZINC000513660485 921983351 /nfs/dbraw/zinc/98/33/51/921983351.db2.gz IJGSTYKYBJAOIV-KRWDZBQOSA-N 0 3 418.493 4.456 20 0 HIADHN CC(C)(O)CN1CCc2c(cccc2NC(=O)c2ccc(Cl)c3ncccc23)C1 ZINC000513666028 921987763 /nfs/dbraw/zinc/98/77/63/921987763.db2.gz JKZAVKZCCFVCMI-UHFFFAOYSA-N 0 3 409.917 4.270 20 0 HIADHN CC(C)(O)CN1CCc2c(cccc2NC(=O)c2nc(-c3ccccc3)cs2)C1 ZINC000513665092 921988213 /nfs/dbraw/zinc/98/82/13/921988213.db2.gz BUTVVOFYAQFXHB-UHFFFAOYSA-N 0 3 407.539 4.191 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3cc(OC)c(OC)cc3Cl)c(C)c2)CC1 ZINC000513692843 922013986 /nfs/dbraw/zinc/01/39/86/922013986.db2.gz VNYZOUCERHMFLC-UHFFFAOYSA-N 0 3 417.937 4.060 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(OCCN[C@H](C)c3cc(C)ccn3)c2)cc1 ZINC000513697316 922018974 /nfs/dbraw/zinc/01/89/74/922018974.db2.gz MBYFLTQDVYCWLY-GOSISDBHSA-N 0 3 405.498 4.381 20 0 HIADHN Cc1ccccc1-c1nn(-c2ccccc2)cc1CN1CCCN(c2cccnn2)CC1 ZINC000513708797 922028571 /nfs/dbraw/zinc/02/85/71/922028571.db2.gz XNARBKPDODXRDK-UHFFFAOYSA-N 0 3 424.552 4.350 20 0 HIADHN COc1ccc([C@H](C)NCc2cc(Br)c3c(c2)OCCO3)c(C)c1OC ZINC000513714036 922033814 /nfs/dbraw/zinc/03/38/14/922033814.db2.gz XCLQXRQGUIZNJN-ZDUSSCGKSA-N 0 3 422.319 4.397 20 0 HIADHN COc1ccccc1[C@H](C)N(C)C(=O)CN[C@H]1CCC[C@H]1Oc1cc(F)cc(F)c1 ZINC000513734052 922054111 /nfs/dbraw/zinc/05/41/11/922054111.db2.gz ZLDDSLFIIMRTLS-GJULWVSJSA-N 0 3 418.484 4.083 20 0 HIADHN CC(C)(CCC(=O)Nc1ccc(C(=O)NCCN2CCCC2)cc1)c1ccccc1 ZINC000513775349 922097037 /nfs/dbraw/zinc/09/70/37/922097037.db2.gz NUEXGCVDAUHMPX-UHFFFAOYSA-N 0 3 407.558 4.209 20 0 HIADHN CN1CCN(c2ncccc2CN[C@H]2CC3(CCCCC3)Oc3ccccc32)CC1 ZINC000513786739 922112230 /nfs/dbraw/zinc/11/22/30/922112230.db2.gz MLQKDNMBBQQGAG-QFIPXVFZSA-N 0 3 406.574 4.150 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Cc2c[nH]c3cccc(Br)c23)N(C)C)cc1 ZINC000513854805 922180384 /nfs/dbraw/zinc/18/03/84/922180384.db2.gz VOLYRPXLLYNQIG-LJQANCHMSA-N 0 3 414.347 4.200 20 0 HIADHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)N1CCC(Nc2ccc(F)cc2)CC1 ZINC000513912105 922234006 /nfs/dbraw/zinc/23/40/06/922234006.db2.gz YQIJQLQWLIZRLV-QHCPKHFHSA-N 0 3 410.537 4.249 20 0 HIADHN COc1ccc(C(=O)C[C@H](C)C(=O)N[C@@H]2CCN(Cc3ccccc3)CC2(C)C)cc1 ZINC000513921177 922244220 /nfs/dbraw/zinc/24/42/20/922244220.db2.gz YCFRHBIOHVANDE-YADARESESA-N 0 3 422.569 4.321 20 0 HIADHN CSc1cc2c(cc1NC(=O)N[C@@H]1CCN([C@H](C)c3ccccc3)C1)OCCO2 ZINC000513972395 922291054 /nfs/dbraw/zinc/29/10/54/922291054.db2.gz BPEZZEXYKGSBQN-NVXWUHKLSA-N 0 3 413.543 4.137 20 0 HIADHN COc1ccc2cccc(CC(=O)Nc3cccc(CN4CCC(CO)CC4)c3)c2c1 ZINC000514010079 922334032 /nfs/dbraw/zinc/33/40/32/922334032.db2.gz SCOYNKPNZWOIKR-UHFFFAOYSA-N 0 3 418.537 4.234 20 0 HIADHN CN1CCC(Oc2ccc(NCc3cccc(OCc4ccccn4)c3)cn2)CC1 ZINC000514065276 922389194 /nfs/dbraw/zinc/38/91/94/922389194.db2.gz RUMUBLQDAGNQDV-UHFFFAOYSA-N 0 3 404.514 4.141 20 0 HIADHN CO[C@@H](CN1CCCN(Cc2csc([C@H](C)OC)n2)CC1)c1ccc(Cl)cc1 ZINC000514108071 922436919 /nfs/dbraw/zinc/43/69/19/922436919.db2.gz UUXRQWWQUXNRJS-JXFKEZNVSA-N 0 3 424.010 4.399 20 0 HIADHN CCn1c2ccccc2nc1[C@@H]1CCCN1C(=O)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000514150015 922485723 /nfs/dbraw/zinc/48/57/23/922485723.db2.gz VVIPBNFXOHITQL-OFNKIYASSA-N 0 3 417.557 4.177 20 0 HIADHN CN(C)[C@H](CNC(=O)N(C)CCCc1cc(-c2ccccc2)no1)Cc1ccccc1 ZINC000514163192 922502731 /nfs/dbraw/zinc/50/27/31/922502731.db2.gz UWXUVAAWKZDAIG-QFIPXVFZSA-N 0 3 420.557 4.089 20 0 HIADHN COc1cccc([C@H](CNC(=O)NCc2c(F)cccc2Cl)N2CCCC2)c1 ZINC000514162777 922502948 /nfs/dbraw/zinc/50/29/48/922502948.db2.gz PKKGIOCUFKMTTJ-FQEVSTJZSA-N 0 3 405.901 4.124 20 0 HIADHN CN(CCCCNC(=O)NC[C@@H](c1cccs1)N1CCCC1)c1ccccc1 ZINC000514173886 922510762 /nfs/dbraw/zinc/51/07/62/922510762.db2.gz ZINVYRRPEHUNHD-FQEVSTJZSA-N 0 3 400.592 4.101 20 0 HIADHN CN(C)[C@@H](CNC(=O)N[C@H]1CCCc2cc(OC(F)F)ccc21)Cc1ccccc1 ZINC000514176712 922515449 /nfs/dbraw/zinc/51/54/49/922515449.db2.gz UTBICHGLNMZLSJ-NQIIRXRSSA-N 0 3 417.500 4.138 20 0 HIADHN Cc1ccc(-c2ccc(C(=O)Nc3ccc(C(=O)NCCN4CCCC4)cc3)s2)o1 ZINC000514184249 922523885 /nfs/dbraw/zinc/52/38/85/922523885.db2.gz RZJKATDCMRXVEU-UHFFFAOYSA-N 0 3 423.538 4.394 20 0 HIADHN C[C@H](NC(=O)NC[C@H](Cc1ccccc1)N(C)C)c1ccc(OCC(F)(F)F)cc1 ZINC000514202027 922539275 /nfs/dbraw/zinc/53/92/75/922539275.db2.gz QKWYSTGDBRMYSP-LPHOPBHVSA-N 0 3 423.479 4.161 20 0 HIADHN CC(C)CC(=O)Nc1cccc(CNC(=O)N[C@H](CN2CCCC2)c2ccccc2)c1 ZINC000514213729 922549612 /nfs/dbraw/zinc/54/96/12/922549612.db2.gz IHSJMHQTOCZIMZ-HSZRJFAPSA-N 0 3 422.573 4.308 20 0 HIADHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)N1CCC(Nc2ccc(F)cc2)CC1 ZINC000514223803 922558948 /nfs/dbraw/zinc/55/89/48/922558948.db2.gz ZVAKBNJOSSBTPC-QHCPKHFHSA-N 0 3 410.537 4.249 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCCc1c[nH]c2cc(F)ccc12)c1ccsc1 ZINC000514225497 922563261 /nfs/dbraw/zinc/56/32/61/922563261.db2.gz NREAMVBXUGYZEJ-HXUWFJFHSA-N 0 3 402.539 4.293 20 0 HIADHN COc1cc(Br)ccc1CNCCc1nc(-c2ccc(Cl)cc2)no1 ZINC000514231270 922568882 /nfs/dbraw/zinc/56/88/82/922568882.db2.gz VMTJOTGOFUEARZ-UHFFFAOYSA-N 0 3 422.710 4.493 20 0 HIADHN CCN(CC)[C@H](CNC(=O)NCC1(c2ccccc2OC)CC1)c1ccsc1 ZINC000514233342 922570457 /nfs/dbraw/zinc/57/04/57/922570457.db2.gz YRNZENRFVXHFLZ-LJQANCHMSA-N 0 3 401.576 4.171 20 0 HIADHN CCC[C@H](NC(=O)NC[C@H](c1ccsc1)N(CC)CC)c1nnc2ccccn21 ZINC000514242244 922581789 /nfs/dbraw/zinc/58/17/89/922581789.db2.gz QZQWKQVSDJZDDG-ZWKOTPCHSA-N 0 3 414.579 4.014 20 0 HIADHN CN(C)[C@@H](CNC(=O)CSc1nccn1-c1ccc(Cl)cc1)c1ccccc1 ZINC000514489111 922645054 /nfs/dbraw/zinc/64/50/54/922645054.db2.gz LALWAHGGLXYAEN-IBGZPJMESA-N 0 3 414.962 4.037 20 0 HIADHN COc1cccc([C@H]2CCCN2C[C@@H](O)COc2ccc(Br)cc2)c1 ZINC000514523158 922671700 /nfs/dbraw/zinc/67/17/00/922671700.db2.gz SHTXEBQPCORRFI-YLJYHZDGSA-N 0 3 406.320 4.035 20 0 HIADHN CN(C)CCN(Cc1ccccc1)C(=O)Nc1cc(C(F)(F)F)ccc1N(C)C ZINC000514543480 922691050 /nfs/dbraw/zinc/69/10/50/922691050.db2.gz VPXCWCRWEVIXGP-UHFFFAOYSA-N 0 3 408.468 4.367 20 0 HIADHN CSc1ccc([C@@H](CNC(=O)c2cc(C)n(-c3ccc(F)cc3)n2)N(C)C)cc1 ZINC000514629050 922731021 /nfs/dbraw/zinc/73/10/21/922731021.db2.gz LTLBRMKUWIIJNH-OAQYLSRUSA-N 0 3 412.534 4.074 20 0 HIADHN CCn1c2ccccc2nc1[C@@H]1CCCN1C[C@@H]1CCN(C(=O)c2ccccc2)C1 ZINC000514680158 922750853 /nfs/dbraw/zinc/75/08/53/922750853.db2.gz QIUGOPDMLFQAFE-CVDCTZTESA-N 0 3 402.542 4.355 20 0 HIADHN COc1cccc(CN(C)C(=O)CN2[C@@H]3CC[C@H]2C[C@@H](c2ccccc2)C3)c1OC ZINC000514741170 922776240 /nfs/dbraw/zinc/77/62/40/922776240.db2.gz IAYUYLALVYKZBS-KOUNCHBCSA-N 0 3 408.542 4.073 20 0 HIADHN C[C@@H]1[C@@H](NC(=O)Cc2csc(-c3cccc(F)c3)n2)CCN1Cc1ccccc1 ZINC000514810514 922809090 /nfs/dbraw/zinc/80/90/90/922809090.db2.gz QAITUDTYHGKXJJ-IERDGZPVSA-N 0 3 409.530 4.271 20 0 HIADHN COc1ccc(C[C@](C)(O)CN[C@@H](C)c2sccc2Br)cc1OC ZINC000514892755 922835254 /nfs/dbraw/zinc/83/52/54/922835254.db2.gz AVEIZRAUYIQQIE-SGTLLEGYSA-N 0 3 414.365 4.172 20 0 HIADHN COc1ccc(OC(F)F)c(NC(=O)N[C@@H]2CCN(Cc3ccccc3)[C@H]2C)c1 ZINC000514962148 922855008 /nfs/dbraw/zinc/85/50/08/922855008.db2.gz CQQACEIFFJSWBT-WMLDXEAASA-N 0 3 405.445 4.081 20 0 HIADHN COc1cc(Cl)c(C)cc1NC(=O)CN[C@@H]1c2ccccc2CC12CCOCC2 ZINC000515017962 922880103 /nfs/dbraw/zinc/88/01/03/922880103.db2.gz CFDJTDWOGILJPM-JOCHJYFZSA-N 0 3 414.933 4.279 20 0 HIADHN COc1ccc2[nH]cc(CC(=O)NC[C@@H](c3cccs3)N3CCC(C)CC3)c2c1 ZINC000515088742 922901681 /nfs/dbraw/zinc/90/16/81/922901681.db2.gz IVTXSMHTIAWVQO-NRFANRHFSA-N 0 3 411.571 4.370 20 0 HIADHN O=C(Nc1ccc(Br)cc1Cl)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000515229606 923005254 /nfs/dbraw/zinc/00/52/54/923005254.db2.gz OPRRETCJYFBODD-HNNXBMFYSA-N 0 3 408.727 4.499 20 0 HIADHN CC[C@H](NCc1cc2c(s1)CCCC2)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000515361480 923066204 /nfs/dbraw/zinc/06/62/04/923066204.db2.gz PENFNMGFOYOEGV-KRWDZBQOSA-N 0 3 413.008 4.429 20 0 HIADHN CC(C)OCc1cc(NC(=O)[C@H]2CN(Cc3ccccc3)CCC2(F)F)ccc1O ZINC000515720968 923303247 /nfs/dbraw/zinc/30/32/47/923303247.db2.gz VIRIPKUUPCLDAD-HXUWFJFHSA-N 0 3 418.484 4.413 20 0 HIADHN Cc1ccc(NC(=O)[C@@H](N[C@@H](Cc2ccccc2)CN(C)C)c2ccccc2)cc1 ZINC000515737741 923312824 /nfs/dbraw/zinc/31/28/24/923312824.db2.gz HIYFRRAHNAICOS-DQEYMECFSA-N 0 3 401.554 4.437 20 0 HIADHN O=C(CCc1ccccc1Br)N[C@H](CN1CCCC1)c1ccccc1 ZINC000515770995 923339093 /nfs/dbraw/zinc/33/90/93/923339093.db2.gz GIKCVSKSZPBLOP-HXUWFJFHSA-N 0 3 401.348 4.335 20 0 HIADHN CC1CCN(C(=O)c2ccc(NC(=O)N(CCN(C)C)Cc3ccccc3)cc2)CC1 ZINC000515795943 923354565 /nfs/dbraw/zinc/35/45/65/923354565.db2.gz QUIARYKDGKMVGG-UHFFFAOYSA-N 0 3 422.573 4.154 20 0 HIADHN O=C(NCCCCN1CCN(Cc2ccccc2)CC1)N1CCC[C@H]1c1ccccc1 ZINC000515908410 923427060 /nfs/dbraw/zinc/42/70/60/923427060.db2.gz OVRIJRZZBZERFJ-VWLOTQADSA-N 0 3 420.601 4.131 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)NCc2ccccc2OC2CCCC2)CC1 ZINC000515911179 923428898 /nfs/dbraw/zinc/42/88/98/923428898.db2.gz TVXIONLGCSJORV-UHFFFAOYSA-N 0 3 411.546 4.407 20 0 HIADHN CCOc1ccc([C@H](C)NC(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)cc1OC ZINC000516163749 923582531 /nfs/dbraw/zinc/58/25/31/923582531.db2.gz TWOGSTZPSFASTB-BBTUJRGHSA-N 0 3 411.546 4.290 20 0 HIADHN CN(CCNC(=O)N1CCC(c2nc3ccccc3s2)CC1)Cc1ccccc1 ZINC000516181145 923589413 /nfs/dbraw/zinc/58/94/13/923589413.db2.gz UDSWCKLYKXEPDM-UHFFFAOYSA-N 0 3 408.571 4.317 20 0 HIADHN COc1ccc([C@@H](CNC(=O)N[C@H]2CCc3c2cccc3Cl)N2CCCC2)cc1 ZINC000516226048 923614065 /nfs/dbraw/zinc/61/40/65/923614065.db2.gz RIJKTPWZBKKGJC-FCHUYYIVSA-N 0 3 413.949 4.472 20 0 HIADHN C[C@@H](CCc1ccco1)NC(=O)N(CCN(C)C)Cc1ccc(Br)cc1 ZINC000516235786 923620049 /nfs/dbraw/zinc/62/00/49/923620049.db2.gz TVWGJMPETHYCQI-INIZCTEOSA-N 0 3 422.367 4.137 20 0 HIADHN COc1ccc([C@@H]2CCCCCN2C(=O)[C@H]2CCCN(Cc3cccnc3)C2)cc1 ZINC000516331372 923670332 /nfs/dbraw/zinc/67/03/32/923670332.db2.gz VYLSCUDYYLLWNQ-UPVQGACJSA-N 0 3 407.558 4.446 20 0 HIADHN CC[C@H](C)C(=O)Nc1cccc(CNC(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)c1 ZINC000516578862 923800939 /nfs/dbraw/zinc/80/09/39/923800939.db2.gz UZGMCZQOLHIUGI-YCRNBWNJSA-N 0 3 422.573 4.306 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N(C)Cc2cc(Br)cs2)C1 ZINC000516581242 923802042 /nfs/dbraw/zinc/80/20/42/923802042.db2.gz IGDZRTNMCSHMRB-PBHICJAKSA-N 0 3 422.392 4.488 20 0 HIADHN c1[nH]nc(-c2ccc3c(c2)OCO3)c1CN(CCc1ccccc1)Cc1ccncc1 ZINC000516604207 923811441 /nfs/dbraw/zinc/81/14/41/923811441.db2.gz PDDIEZPRUSMTNM-UHFFFAOYSA-N 0 3 412.493 4.445 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1CN1CC[C@@](CO)(Cc2ccc(F)cc2)C1 ZINC000516604027 923811539 /nfs/dbraw/zinc/81/15/39/923811539.db2.gz LTKKXECKICELKO-RUZDIDTESA-N 0 3 407.533 4.114 20 0 HIADHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)NCc1ccccc1Cl ZINC000516657707 923831034 /nfs/dbraw/zinc/83/10/34/923831034.db2.gz NNTQRSWDBYNOKS-UHFFFAOYSA-N 0 3 424.770 4.376 20 0 HIADHN CC[C@H](CNC(=O)NC[C@@H]1CCCO[C@H]1c1ccccc1)N1CCc2ccccc2C1 ZINC000516716824 923861322 /nfs/dbraw/zinc/86/13/22/923861322.db2.gz IXHJQIQBLQRUDO-CAOCKLPOSA-N 0 3 421.585 4.290 20 0 HIADHN COc1cc(NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)c(OC)cc1Cl ZINC000516763414 923880701 /nfs/dbraw/zinc/88/07/01/923880701.db2.gz UAUIXUJJCJWXCC-OAHLLOKOSA-N 0 3 406.885 4.347 20 0 HIADHN C[C@H](Nc1cnn(-c2ccc(F)cc2F)c(=O)c1Cl)[C@@H](c1ccccc1)N(C)C ZINC000516899915 923934736 /nfs/dbraw/zinc/93/47/36/923934736.db2.gz OIELEGHRLMJRQW-RBZFPXEDSA-N 0 3 418.875 4.267 20 0 HIADHN CCN(CC)[C@H](CNC(=O)c1snnc1C1CC1)c1ccc(C(F)(F)F)cc1 ZINC000516919244 923939759 /nfs/dbraw/zinc/93/97/59/923939759.db2.gz FEYOGRRHLQWQRQ-OAHLLOKOSA-N 0 3 412.481 4.247 20 0 HIADHN CCc1cccc(C)c1NC(=O)CN[C@H]1CCN(CC)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000516982846 923951310 /nfs/dbraw/zinc/95/13/10/923951310.db2.gz UBVMMZBSUIBMMN-CVDCTZTESA-N 0 3 419.491 4.338 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2ccc(OCc3ccncc3)cc2)N(C)C)cc1 ZINC000517125076 924012855 /nfs/dbraw/zinc/01/28/55/924012855.db2.gz FJNVEXDWPPVOJQ-QHCPKHFHSA-N 0 3 404.514 4.393 20 0 HIADHN CN(C(=O)N[C@H](c1ccccc1)C1CCC1)C1CCN(CCc2ccccn2)CC1 ZINC000517144571 924022806 /nfs/dbraw/zinc/02/28/06/924022806.db2.gz OHWFRGSYFDETMI-XMMPIXPASA-N 0 3 406.574 4.271 20 0 HIADHN CC(C)Oc1ccc(CC[C@@H](C)N[C@@H](C(N)=O)c2ccc(Br)cc2)cc1 ZINC000517166577 924034411 /nfs/dbraw/zinc/03/44/11/924034411.db2.gz MLAQGSVJSKVMNZ-FOIQADDNSA-N 0 3 419.363 4.374 20 0 HIADHN C[C@@H]1[C@H](NC(=O)N(Cc2cccs2)C[C@H]2CCCO2)CCN1Cc1ccccc1 ZINC000517255492 924064411 /nfs/dbraw/zinc/06/44/11/924064411.db2.gz LUKITIPFQJFXKE-SYYKKAFVSA-N 0 3 413.587 4.102 20 0 HIADHN Cc1nn(-c2ccccn2)c(C)c1CN1CCC[C@@H](c2nc(C(F)(F)F)cn2C)C1 ZINC000517436410 924185046 /nfs/dbraw/zinc/18/50/46/924185046.db2.gz RVJLPXIGSKLHET-MRXNPFEDSA-N 0 3 418.467 4.016 20 0 HIADHN COc1ccc(OCc2ccccn2)c(CNCCN2c3ccccc3C[C@@H]2C)c1 ZINC000517552345 924261099 /nfs/dbraw/zinc/26/10/99/924261099.db2.gz IDOBIFUYHNSCJI-IBGZPJMESA-N 0 3 403.526 4.210 20 0 HIADHN COc1ccccc1[C@H](CNc1cc(C)nc(-c2ccccn2)n1)N1CCCCC1 ZINC000517605444 926712929 /nfs/dbraw/zinc/71/29/29/926712929.db2.gz ZKNMLVGYCXIQHL-NRFANRHFSA-N 0 3 403.530 4.495 20 0 HIADHN COc1ccccc1[C@@H](CNc1cc(C)nc(-c2ccccn2)n1)N1CCCCC1 ZINC000517605446 926713553 /nfs/dbraw/zinc/71/35/53/926713553.db2.gz ZKNMLVGYCXIQHL-OAQYLSRUSA-N 0 3 403.530 4.495 20 0 HIADHN CCN1CCN(Cc2ccccc2CNC(=O)Nc2cccc(CSC)c2)CC1 ZINC000517618337 926727781 /nfs/dbraw/zinc/72/77/81/926727781.db2.gz AVYXVXKCTYIFMY-UHFFFAOYSA-N 0 3 412.603 4.009 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)Nc1ccccc1N1CCCCC1 ZINC000517641192 926748626 /nfs/dbraw/zinc/74/86/26/926748626.db2.gz KTBNBPQKNCBZKO-UHFFFAOYSA-N 0 3 406.574 4.218 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)Nc1ccc2c(c1)OC1(CCCC1)O2 ZINC000517654837 926762590 /nfs/dbraw/zinc/76/25/90/926762590.db2.gz HTRHXCOFVYKEGE-UHFFFAOYSA-N 0 3 421.541 4.269 20 0 HIADHN COc1ccccc1OCc1ccc(C(=O)NC[C@H](C)N(C)Cc2ccccc2)o1 ZINC000517656537 926764178 /nfs/dbraw/zinc/76/41/78/926764178.db2.gz IESROGNYBIKAAU-SFHVURJKSA-N 0 3 408.498 4.118 20 0 HIADHN Cc1ccc(C(=O)NC[C@@H](C)N(C)Cc2ccccc2)cc1NC(=O)c1ccco1 ZINC000517658144 926765532 /nfs/dbraw/zinc/76/55/32/926765532.db2.gz BMTWHMPBDJSHAJ-GOSISDBHSA-N 0 3 405.498 4.091 20 0 HIADHN CCOc1cc2c(cc1[C@@H]1C[C@@H]1C(=O)NC[C@@H](C)N(C)Cc1ccccc1)O[C@@H](C)C2 ZINC000517657608 926765716 /nfs/dbraw/zinc/76/57/16/926765716.db2.gz FOZABIIKOOUAJG-GPFNJZLUSA-N 0 3 422.569 4.149 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)N1CCC[C@@H]1Cc1ccc(F)cc1 ZINC000517724088 926814593 /nfs/dbraw/zinc/81/45/93/926814593.db2.gz GMSVGEPRDLENAK-UXHICEINSA-N 0 3 401.551 4.441 20 0 HIADHN CCN(C(=O)C(=O)Nc1cc(CN(C)C)ccc1OC)[C@@H](C)c1cc2ccccc2o1 ZINC000517820697 926851668 /nfs/dbraw/zinc/85/16/68/926851668.db2.gz JZVBEIJHMHNMFD-INIZCTEOSA-N 0 3 423.513 4.051 20 0 HIADHN NC(=O)[C@H](NCC(c1ccccc1)c1ccccc1)c1ccc(Br)cc1 ZINC000517934526 926894824 /nfs/dbraw/zinc/89/48/24/926894824.db2.gz XCNRNDBXSDGABQ-OAQYLSRUSA-N 0 3 409.327 4.397 20 0 HIADHN CC(C)Sc1ccc(Cl)cc1NC(=O)C(=O)NCC(C)(C)N1CCCCC1 ZINC000517951380 926900445 /nfs/dbraw/zinc/90/04/45/926900445.db2.gz KZRRGVVNSLTTJI-UHFFFAOYSA-N 0 3 411.999 4.160 20 0 HIADHN CN1CCN(CCCCNC(=O)c2cc(Cl)ccc2Oc2ccc(F)cc2)CC1 ZINC000518021051 926960575 /nfs/dbraw/zinc/96/05/75/926960575.db2.gz PEDUQYKEIGSZJH-UHFFFAOYSA-N 0 3 419.928 4.029 20 0 HIADHN Cc1nn(Cc2ccccc2)c2sc(C(=O)N[C@@H]3CCN(C4CCCC4)C3)cc12 ZINC000518045784 926983996 /nfs/dbraw/zinc/98/39/96/926983996.db2.gz CIPPCTUNVFDHFR-GOSISDBHSA-N 0 3 408.571 4.201 20 0 HIADHN Cc1nc(COc2cccc(C(=O)N[C@H](CN(C)C)c3ccc(F)cc3)c2)cs1 ZINC000518353904 927217103 /nfs/dbraw/zinc/21/71/03/927217103.db2.gz QEZVXNFJDUXXBM-OAQYLSRUSA-N 0 3 413.518 4.202 20 0 HIADHN CCCOc1ccc(CNC(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)cc1OC ZINC000518402986 927243773 /nfs/dbraw/zinc/24/37/73/927243773.db2.gz XRNFJDAWBZSOFR-GHTZIAJQSA-N 0 3 411.546 4.119 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)NCc2cccc(NC(=O)C3CCC3)c2)C1 ZINC000518403887 927244703 /nfs/dbraw/zinc/24/47/03/927244703.db2.gz WPJIIASSUMHTKA-FDDCHVKYSA-N 0 3 420.557 4.060 20 0 HIADHN CC[C@H](Oc1ccccc1C(C)C)C(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000518500219 927309965 /nfs/dbraw/zinc/30/99/65/927309965.db2.gz IZWWGZZXBLWMIX-VIZSFHNOSA-N 0 3 416.606 4.315 20 0 HIADHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)N(C)Cc2cccc(Br)c2)C1 ZINC000518499809 927310897 /nfs/dbraw/zinc/31/08/97/927310897.db2.gz MCJQWLPDOVMDON-JXFKEZNVSA-N 0 3 416.363 4.426 20 0 HIADHN Cc1cccc(C(=O)N2CCCC2)c1NC(=O)N[C@@H]1CCN(Cc2ccccc2)[C@@H]1C ZINC000518506696 927316313 /nfs/dbraw/zinc/31/63/13/927316313.db2.gz JPDJNMOCYOXLFH-DENIHFKCSA-N 0 3 420.557 4.016 20 0 HIADHN COc1cccc(OC)c1OC[C@H](O)CN(C)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000518512212 927318930 /nfs/dbraw/zinc/31/89/30/927318930.db2.gz MQBIMOUKHXLAJO-RHSMWYFYSA-N 0 3 413.436 4.155 20 0 HIADHN O=C(NCc1ccc(Br)cc1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000518577357 927357402 /nfs/dbraw/zinc/35/74/02/927357402.db2.gz UQAYGXFAHCSJET-KRWDZBQOSA-N 0 3 405.311 4.117 20 0 HIADHN COc1ccc([C@H](CNC(=O)NCCCc2c[nH]c3ccccc23)N2CCCC2)cc1 ZINC000518630580 927390028 /nfs/dbraw/zinc/39/00/28/927390028.db2.gz QBDRDYNZFOYDID-DEOSSOPVSA-N 0 3 420.557 4.245 20 0 HIADHN O=C(N[C@@H]1CCN(C2CC2)C1)c1cn(-c2ccccc2)nc1-c1ccc(Cl)cc1 ZINC000518648173 927403492 /nfs/dbraw/zinc/40/34/92/927403492.db2.gz HYNMYQRVBFSYCP-GOSISDBHSA-N 0 3 406.917 4.159 20 0 HIADHN CN1CCN([C@H](CNCc2csc(-c3cccs3)n2)c2cccs2)CC1 ZINC000518748775 927473614 /nfs/dbraw/zinc/47/36/14/927473614.db2.gz BDWYVYKZXOHXRZ-MRXNPFEDSA-N 0 3 404.630 4.011 20 0 HIADHN CS(=O)(=O)c1ccc(CN[C@@H](c2ccc(Br)cc2)C2CCC2)cc1 ZINC000518764571 927483234 /nfs/dbraw/zinc/48/32/34/927483234.db2.gz TUAVWEDCXWXGRX-LJQANCHMSA-N 0 3 408.361 4.484 20 0 HIADHN COc1cc(Br)c(CN[C@@H]2CCN([C@H](C)c3ccccc3)C2)cc1OC ZINC000518774656 927485933 /nfs/dbraw/zinc/48/59/33/927485933.db2.gz ZFQITGPBUXPGDZ-CRAIPNDOSA-N 0 3 419.363 4.391 20 0 HIADHN CCn1c(CNC[C@H]2CCN(c3cccc(Br)c3)C2)nc2ccccc21 ZINC000518780048 927488867 /nfs/dbraw/zinc/48/88/67/927488867.db2.gz BPZQLNPSQNLFHV-MRXNPFEDSA-N 0 3 413.363 4.435 20 0 HIADHN COc1ccccc1CC(C)(C)C(=O)NC[C@H](c1ccc(SC)cc1)N(C)C ZINC000518825893 927521807 /nfs/dbraw/zinc/52/18/07/927521807.db2.gz MGQXQCBBMNJZIZ-HXUWFJFHSA-N 0 3 400.588 4.405 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)[C@H](C)N1CCC(Cc2ccccc2)CC1 ZINC000518923901 927631565 /nfs/dbraw/zinc/63/15/65/927631565.db2.gz AZRONABZXCWVCS-IBGZPJMESA-N 0 3 409.574 4.039 20 0 HIADHN CN(C(=O)c1cccnc1Oc1ccc(Cl)cc1Cl)[C@H]1CCN(C2CC2)C1 ZINC000518956322 927656732 /nfs/dbraw/zinc/65/67/32/927656732.db2.gz AOHJGDJPRFMWPU-HNNXBMFYSA-N 0 3 406.313 4.489 20 0 HIADHN O=C(NCCCCN1CCN(c2ccccc2)CC1)c1cc2cc(Cl)sc2[nH]1 ZINC000519042542 927719460 /nfs/dbraw/zinc/71/94/60/927719460.db2.gz JLJYZHNMQKSMLA-UHFFFAOYSA-N 0 3 416.978 4.215 20 0 HIADHN COCCN(CCN(C)C)C(=O)N[C@@H](c1ccccc1)c1ccc(Cl)c(Cl)c1 ZINC000519175808 927812877 /nfs/dbraw/zinc/81/28/77/927812877.db2.gz GFQYKAJPOVBZCD-FQEVSTJZSA-N 0 3 424.372 4.302 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)Nc1ccc(-n2cccn2)c(F)c1 ZINC000519255442 927849661 /nfs/dbraw/zinc/84/96/61/927849661.db2.gz MJKBKQXSRPFTBG-UHFFFAOYSA-N 0 3 409.509 4.040 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2cc(C3CC3)nn2-c2ccccc2)N(C)C)cc1 ZINC000519260267 927852367 /nfs/dbraw/zinc/85/23/67/927852367.db2.gz YPORCJKARLRITA-QFIPXVFZSA-N 0 3 403.530 4.483 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2ccc(NC(=O)c3ccco3)cc2)N(C)C)cc1 ZINC000519261057 927853151 /nfs/dbraw/zinc/85/31/51/927853151.db2.gz MEVSPYQQIPUVBQ-HXUWFJFHSA-N 0 3 406.486 4.265 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)Nc2ccc(C(=O)N3CCC(C)CC3)cc2)N(C)C)cc1 ZINC000519264051 927854564 /nfs/dbraw/zinc/85/45/64/927854564.db2.gz HUHWGDPQSNVXCF-HSZRJFAPSA-N 0 3 422.573 4.292 20 0 HIADHN COc1ccc(Cl)cc1CNC(=O)N(CCCc1ccccc1)CCN(C)C ZINC000519266622 927855699 /nfs/dbraw/zinc/85/56/99/927855699.db2.gz XMEGUHKFLGTKMY-UHFFFAOYSA-N 0 3 403.954 4.055 20 0 HIADHN C[C@@H]1C[C@@H]1C(=O)Nc1cccc(C(=O)NC[C@@H]2CCCCN2Cc2ccccc2)c1 ZINC000519271911 927858251 /nfs/dbraw/zinc/85/82/51/927858251.db2.gz XGFNBOOKZAURJB-LEOXJPRUSA-N 0 3 405.542 4.066 20 0 HIADHN COc1ccccc1OCc1ccc(C(=O)NC[C@@H](c2ccc(C)cc2)N(C)C)o1 ZINC000519278537 927861023 /nfs/dbraw/zinc/86/10/23/927861023.db2.gz LOUXCGHTGCKAPQ-FQEVSTJZSA-N 0 3 408.498 4.208 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2nccnc2-c2nc3ccccc3s2)N(C)C)cc1 ZINC000519279476 927861454 /nfs/dbraw/zinc/86/14/54/927861454.db2.gz UKZBKQUQSMALNZ-SFHVURJKSA-N 0 3 417.538 4.094 20 0 HIADHN CCCCN1CCCC[C@H]1CNC(=O)N1CCC(C(=O)c2cc(F)ccc2F)CC1 ZINC000519480459 927977801 /nfs/dbraw/zinc/97/78/01/927977801.db2.gz AUWFDSXAWDTUBG-IBGZPJMESA-N 0 3 421.532 4.224 20 0 HIADHN COc1ccc(CN2CC[C@H](NC/C(C)=C/c3ccccc3OC(F)F)C2=O)cc1 ZINC000519673919 928047268 /nfs/dbraw/zinc/04/72/68/928047268.db2.gz QUSZVBBAIIXWQT-YFIXDKARSA-N 0 3 416.468 4.091 20 0 HIADHN C[C@H]1C[C@@H]1N1CCN(C(=O)c2ccccc2SCc2cscn2)C[C@@H](C)C1 ZINC000519765287 928069532 /nfs/dbraw/zinc/06/95/32/928069532.db2.gz HTIAJEVLMKQJBB-BXWFABGCSA-N 0 3 401.601 4.238 20 0 HIADHN CC(=O)Nc1ccc(OC[C@@H](O)CN(C)[C@@H](C)c2cccc(C(F)(F)F)c2)cc1 ZINC000519903517 928138430 /nfs/dbraw/zinc/13/84/30/928138430.db2.gz JPBKBLCEYDJSBT-LIRRHRJNSA-N 0 3 410.436 4.097 20 0 HIADHN O=S(=O)(c1ccc(CN(CCc2ccccc2F)C2CCCC2)o1)N1CCCC1 ZINC000519904247 928138825 /nfs/dbraw/zinc/13/88/25/928138825.db2.gz AUKWTSCJOVTJLQ-UHFFFAOYSA-N 0 3 420.550 4.191 20 0 HIADHN C[C@@H](c1cccs1)N(CCOc1ccc(S(N)(=O)=O)cc1)Cc1ccccc1 ZINC000519904382 928140709 /nfs/dbraw/zinc/14/07/09/928140709.db2.gz ICJVRRIJAOXIHR-KRWDZBQOSA-N 0 3 416.568 4.038 20 0 HIADHN Cc1ccc(-c2nn(-c3ccccc3)cc2C(=O)N[C@H]2CCN(C3CC3)C2)c(C)c1 ZINC000519918957 928152059 /nfs/dbraw/zinc/15/20/59/928152059.db2.gz BSXYIEUSIXAJMF-IBGZPJMESA-N 0 3 400.526 4.123 20 0 HIADHN Cc1noc(-c2ccc(C)c(NC(=O)c3ccc(N4CCN(C(C)C)CC4)cc3)c2)n1 ZINC000519931799 928164701 /nfs/dbraw/zinc/16/47/01/928164701.db2.gz HDKJFQVYONTDEO-UHFFFAOYSA-N 0 3 419.529 4.136 20 0 HIADHN COc1ccc([C@@H](NC(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)C(C)C)cc1 ZINC000519950853 928183564 /nfs/dbraw/zinc/18/35/64/928183564.db2.gz FGDDGMDLBXROGO-DEOSSOPVSA-N 0 3 409.574 4.353 20 0 HIADHN Cc1cc(C)n(-c2ccccc2NC(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)n1 ZINC000519951230 928183743 /nfs/dbraw/zinc/18/37/43/928183743.db2.gz UAKFZMUPHAHFNE-UHFFFAOYSA-N 0 3 417.557 4.272 20 0 HIADHN Cc1cc(C(=O)N2CCCC[C@@H]2C)ccc1NC(=O)NC[C@H](c1ccccc1)N(C)C ZINC000520049640 928273380 /nfs/dbraw/zinc/27/33/80/928273380.db2.gz CFNZQPVTAGDSTM-WMZHIEFXSA-N 0 3 422.573 4.434 20 0 HIADHN CCOc1cc2c(cc1NC(=O)NC[C@@H](c1cccs1)N1CCCC1)O[C@H](C)C2 ZINC000520048881 928274327 /nfs/dbraw/zinc/27/43/27/928274327.db2.gz XIMJKQHDZLRYDG-QAPCUYQASA-N 0 3 415.559 4.429 20 0 HIADHN CCOc1ccc(NC(=O)NC[C@H](c2cccc(OC)c2)N2CCCC2)cc1OC ZINC000520051085 928275433 /nfs/dbraw/zinc/27/54/33/928275433.db2.gz VJLAXWDPEJJNGR-HXUWFJFHSA-N 0 3 413.518 4.061 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)NC[C@H]1CCCO[C@H]1c1ccccc1 ZINC000520058270 928284934 /nfs/dbraw/zinc/28/49/34/928284934.db2.gz XLWWUVCCLZHZDV-RPBOFIJWSA-N 0 3 423.601 4.360 20 0 HIADHN Cc1ccc([C@@H](CNC(=O)N[C@H](c2ccc3c(c2)OCCO3)C(C)C)N(C)C)cc1 ZINC000520067742 928292009 /nfs/dbraw/zinc/29/20/09/928292009.db2.gz FNWVBVKCZKNTMU-OFNKIYASSA-N 0 3 411.546 4.065 20 0 HIADHN CC(C)(C)NC(=O)c1cccc(NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)c1 ZINC000520112233 928317895 /nfs/dbraw/zinc/31/78/95/928317895.db2.gz PRUOFXKFWCEXMX-LJQANCHMSA-N 0 3 411.521 4.205 20 0 HIADHN Cc1noc(-c2ccc(C)c(NC(=O)N(CCN(C)C)Cc3cccc(F)c3)c2)n1 ZINC000520131462 928328708 /nfs/dbraw/zinc/32/87/08/928328708.db2.gz SRTYDCXAIVCIFY-UHFFFAOYSA-N 0 3 411.481 4.088 20 0 HIADHN CCOCCOc1c(Cl)cccc1NC(=O)NC[C@H](c1ccccc1)N(C)C ZINC000520133745 928331467 /nfs/dbraw/zinc/33/14/67/928331467.db2.gz NJPHZXHWBQXNKI-LJQANCHMSA-N 0 3 405.926 4.180 20 0 HIADHN CCN(C(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1)[C@H](C)Cc1ccc(OC)cc1 ZINC000520196967 928381311 /nfs/dbraw/zinc/38/13/11/928381311.db2.gz LVTGOSOOKWHCMD-ZRCGQRJVSA-N 0 3 409.574 4.493 20 0 HIADHN C[C@H](C(=O)N(C)C1CCCCC1)N(C)CCCc1cc(-c2cccc(F)c2)n[nH]1 ZINC000520287747 928450000 /nfs/dbraw/zinc/45/00/00/928450000.db2.gz GZUNLWRRELSXBJ-QGZVFWFLSA-N 0 3 400.542 4.260 20 0 HIADHN C[C@H]1C[C@@H]1c1ccc(CN(C(=O)CCCN2CCN(c3ccccc3)CC2)C2CC2)o1 ZINC000520306034 928468117 /nfs/dbraw/zinc/46/81/17/928468117.db2.gz LOAQTLFGJUAFMF-RDPSFJRHSA-N 0 3 421.585 4.496 20 0 HIADHN CN(C(=O)c1cnn(-c2cccc(C(F)(F)F)c2)c1C1CC1)[C@@H]1CCN(C2CC2)C1 ZINC000520367905 928524480 /nfs/dbraw/zinc/52/44/80/928524480.db2.gz HJLNHTPDLZSLCG-GOSISDBHSA-N 0 3 418.463 4.077 20 0 HIADHN C[C@H](CNC(=O)N[C@@H](C)c1nc2ccccc2n1C(F)F)N(C)Cc1ccccc1 ZINC000520380581 928533528 /nfs/dbraw/zinc/53/35/28/928533528.db2.gz BIQOVYPZVXBWRU-CVEARBPZSA-N 0 3 415.488 4.312 20 0 HIADHN CC[C@@H](C)NC(=O)c1ccc(NC(=O)N[C@@H](CN2CCCC2)c2ccccc2)c(C)c1 ZINC000520600919 928665505 /nfs/dbraw/zinc/66/55/05/928665505.db2.gz UWBVTDWAPTXEMQ-XXBNENTESA-N 0 3 422.573 4.482 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)[C@@H]3C[C@H]3c3cccc4ccccc43)CC2)C[C@H](C)O1 ZINC000520762369 928805892 /nfs/dbraw/zinc/80/58/92/928805892.db2.gz TVFWEEKAGBYOMO-BWSHLYMBSA-N 0 3 406.570 4.291 20 0 HIADHN COC1CCN(C(C)(C)CNC(=O)c2csc(-c3ccc(C)cc3C)n2)CC1 ZINC000520770311 928809235 /nfs/dbraw/zinc/80/92/35/928809235.db2.gz BQBQBUWOFVAXNB-UHFFFAOYSA-N 0 3 401.576 4.046 20 0 HIADHN O=C(Nc1cc(F)ccc1OC[C@@H]1CCCO1)N1CCN(CC2CCCCC2)CC1 ZINC000520782374 928815384 /nfs/dbraw/zinc/81/53/84/928815384.db2.gz LOHKSZLJCKOVOK-FQEVSTJZSA-N 0 3 419.541 4.113 20 0 HIADHN O=C(CN1CCCCC[C@@H]1c1ccccc1)N1CCC(C(=O)Nc2ccccc2)CC1 ZINC000520788624 928819700 /nfs/dbraw/zinc/81/97/00/928819700.db2.gz NHUIRRSPEUJZON-XMMPIXPASA-N 0 3 419.569 4.481 20 0 HIADHN CN1CCN(Cc2ccc(CNC(=O)N3CCCCC[C@H]3c3ccccc3)cc2)CC1 ZINC000520797589 928823006 /nfs/dbraw/zinc/82/30/06/928823006.db2.gz JKAIIDWKFIYVFH-VWLOTQADSA-N 0 3 420.601 4.261 20 0 HIADHN O=C(NCc1cccc(OCC(F)(F)F)c1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000520954117 928887353 /nfs/dbraw/zinc/88/73/53/928887353.db2.gz YXEKUDQNBFDDIG-GOSISDBHSA-N 0 3 424.438 4.295 20 0 HIADHN CCN1CCCC[C@H]1C(=O)N1CCc2c(cccc2NC(=O)Nc2ccc(C)cc2)C1 ZINC000521038499 928953521 /nfs/dbraw/zinc/95/35/21/928953521.db2.gz QEXPGNYCWUKWMJ-QHCPKHFHSA-N 0 3 420.557 4.398 20 0 HIADHN Cc1nc(-c2ccc(CNC(=O)NCCCN3CCc4ccccc4C3)cc2)cs1 ZINC000521047036 928959496 /nfs/dbraw/zinc/95/94/96/928959496.db2.gz HPJYZXNMKIITQS-UHFFFAOYSA-N 0 3 420.582 4.366 20 0 HIADHN C[C@H](NC(=O)N(CCN(C)C)Cc1cccc(F)c1)c1ccc(OC(F)F)cc1 ZINC000521068873 928972029 /nfs/dbraw/zinc/97/20/29/928972029.db2.gz OYGLWVQKJVRTBH-HNNXBMFYSA-N 0 3 409.452 4.262 20 0 HIADHN CC(C)Oc1ccccc1[C@@H](C)NC(=O)N(CCN(C)C)Cc1cccc(F)c1 ZINC000521070453 928972405 /nfs/dbraw/zinc/97/24/05/928972405.db2.gz VWERNCLSACIDHW-GOSISDBHSA-N 0 3 401.526 4.447 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)Nc1nc2cc(F)c(F)cc2s1 ZINC000521093778 928988619 /nfs/dbraw/zinc/98/86/19/928988619.db2.gz FUIWIMCNCILFSA-UHFFFAOYSA-N 0 3 416.497 4.115 20 0 HIADHN C[C@H](CNC(=O)N(C)Cc1cc(Br)ccc1F)N(C)Cc1ccccc1 ZINC000521162456 929035714 /nfs/dbraw/zinc/03/57/14/929035714.db2.gz PWXCFIJUNBHLOW-OAHLLOKOSA-N 0 3 422.342 4.250 20 0 HIADHN CC(C)(C)c1ccccc1OCCNCc1ccccc1OCC(=O)N1CCCC1 ZINC000521335715 929151018 /nfs/dbraw/zinc/15/10/18/929151018.db2.gz DICUYYIVUTYIAH-UHFFFAOYSA-N 0 3 410.558 4.154 20 0 HIADHN COc1ccc(C(=O)Nc2cccc(CNCCOc3ccc(F)c(F)c3)c2)cc1 ZINC000521337881 929153016 /nfs/dbraw/zinc/15/30/16/929153016.db2.gz NQVGIGFEURETPO-UHFFFAOYSA-N 0 3 412.436 4.394 20 0 HIADHN CN(C(=O)CCCN1CCN(c2ccccc2)CC1)[C@H](c1ccccc1)C(F)(F)F ZINC000521362042 929183217 /nfs/dbraw/zinc/18/32/17/929183217.db2.gz ZXXLBRWGTFIQHS-JOCHJYFZSA-N 0 3 419.491 4.351 20 0 HIADHN O=C(N[C@H]1CCN(Cc2ccccc2)C1)N[C@H]1CCSc2ccc(Cl)cc21 ZINC000521450854 929227307 /nfs/dbraw/zinc/22/73/07/929227307.db2.gz OFCIIGMLKJIMCT-HKUYNNGSSA-N 0 3 401.963 4.451 20 0 HIADHN CN(C)CCN(CCCc1ccccc1)C(=O)N[C@@H]1CCCOc2ccc(F)cc21 ZINC000521475509 929239993 /nfs/dbraw/zinc/23/99/93/929239993.db2.gz FZNNOWHEEAQABP-JOCHJYFZSA-N 0 3 413.537 4.245 20 0 HIADHN CC(C)NC(=O)Nc1ccccc1NC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000521602493 929323345 /nfs/dbraw/zinc/32/33/45/929323345.db2.gz FHEVUJJAWOFVGC-GOSISDBHSA-N 0 3 412.509 4.206 20 0 HIADHN O=C(c1ccc(N2CCCC2)c(F)c1)N1CCCN(CCCc2ccccc2)CC1 ZINC000521644705 929339879 /nfs/dbraw/zinc/33/98/79/929339879.db2.gz QEMVKFQPZRXJMD-UHFFFAOYSA-N 0 3 409.549 4.207 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)Nc1cc(F)ccc1OC[C@@H]1CCCO1 ZINC000521656187 929348576 /nfs/dbraw/zinc/34/85/76/929348576.db2.gz RJUFKHKZXBQREK-IBGZPJMESA-N 0 3 407.530 4.113 20 0 HIADHN C[C@H](CNC(=O)c1oc2ccccc2c1CSc1ncccn1)N1CCC[C@@H](C)C1 ZINC000521706161 929377973 /nfs/dbraw/zinc/37/79/73/929377973.db2.gz ZLOVNRYJIYSJKW-IAGOWNOFSA-N 0 3 424.570 4.365 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)NCc3ccccc3C(F)(F)F)c(C)c2)CC1 ZINC000521823986 929481112 /nfs/dbraw/zinc/48/11/12/929481112.db2.gz XEZXVVXJHZMIGD-UHFFFAOYSA-N 0 3 420.479 4.477 20 0 HIADHN O[C@H](CNCc1c(OC(F)F)ccc2ccccc21)COc1ccc(F)c(F)c1 ZINC000521829166 929482317 /nfs/dbraw/zinc/48/23/17/929482317.db2.gz SZKZIMBPBUVVNH-CQSZACIVSA-N 0 3 409.379 4.249 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc(CCNCc2cccc(Cl)c2Cl)s1 ZINC000521829797 929483848 /nfs/dbraw/zinc/48/38/48/929483848.db2.gz UWUDSXBBVUBSHX-UHFFFAOYSA-N 0 3 421.415 4.418 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)N(CCCc2ccccc2)CCN(C)C)c(Cl)c1 ZINC000521855277 929505083 /nfs/dbraw/zinc/50/50/83/929505083.db2.gz HKDHKGHWRMYJJL-UHFFFAOYSA-N 0 3 416.953 4.327 20 0 HIADHN Cc1ccc(Br)cc1NC(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000521879143 929527203 /nfs/dbraw/zinc/52/72/03/929527203.db2.gz XFBRQGMKYASKNS-HZPDHXFCSA-N 0 3 424.383 4.111 20 0 HIADHN C[C@H](C(=O)N[C@@H]1CCCC[C@H]1C)N(C)CCCc1cc(-c2cccc(F)c2)n[nH]1 ZINC000521902745 929547383 /nfs/dbraw/zinc/54/73/83/929547383.db2.gz NBPQDJUOYBLGJR-CBGDNZLLSA-N 0 3 400.542 4.164 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)N[C@@H]1CCSc2c(F)cccc21 ZINC000521914008 929557741 /nfs/dbraw/zinc/55/77/41/929557741.db2.gz QSKYQWJRSJZMEP-OAQYLSRUSA-N 0 3 413.562 4.081 20 0 HIADHN O=C(CCCN1CCN(c2ccccc2)CC1)Nc1ccc(OCC(F)(F)F)cc1 ZINC000521918309 929561208 /nfs/dbraw/zinc/56/12/08/929561208.db2.gz IZPBNVQHWIKLIC-UHFFFAOYSA-N 0 3 421.463 4.169 20 0 HIADHN Cc1ncc(-c2ccc(NC(=O)c3ccc(N4CCN(C(C)C)CC4)cc3)cc2)o1 ZINC000521931395 929572316 /nfs/dbraw/zinc/57/23/16/929572316.db2.gz ODKSPFWVNZCKER-UHFFFAOYSA-N 0 3 404.514 4.433 20 0 HIADHN Cc1cccc(NC(=O)NC[C@H]2CCCN2Cc2ccccc2)c1C(=O)N1CCCC1 ZINC000524481041 929630877 /nfs/dbraw/zinc/63/08/77/929630877.db2.gz GIHVLPDHUGAMCZ-OAQYLSRUSA-N 0 3 420.557 4.017 20 0 HIADHN CC(C)[C@H](NC(=O)N(CCCc1ccccc1)CCN(C)C)c1nc2ccccc2[nH]1 ZINC000524528031 929666130 /nfs/dbraw/zinc/66/61/30/929666130.db2.gz QSMICGDTHQPSEN-QHCPKHFHSA-N 0 3 421.589 4.466 20 0 HIADHN CCCN(CC(=O)Nc1cccc(NC(C)=O)c1)[C@H]1C[C@H](OCC)C12CCCC2 ZINC000524619709 929727834 /nfs/dbraw/zinc/72/78/34/929727834.db2.gz FVSXRFOIWWLGRA-SFTDATJTSA-N 0 3 401.551 4.033 20 0 HIADHN Cc1ccc([C@H](CNC(=O)c2ccc(C(=O)NCC(C)(C)C)cc2)N2CCCC2)cc1 ZINC000524647067 929759858 /nfs/dbraw/zinc/75/98/58/929759858.db2.gz OJKHSNHXXWWHCF-QHCPKHFHSA-N 0 3 421.585 4.338 20 0 HIADHN CN(Cc1ccco1)Cc1ccccc1CNC(=O)[C@H]1CCCN1Cc1ccccc1 ZINC000524649903 929762590 /nfs/dbraw/zinc/76/25/90/929762590.db2.gz YYWJNMIYPBMFGC-RUZDIDTESA-N 0 3 417.553 4.192 20 0 HIADHN C[C@@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)NCCCCN1CCN(C)CC1 ZINC000524785948 929828593 /nfs/dbraw/zinc/82/85/93/929828593.db2.gz AZUORSBTQKJINR-NRFANRHFSA-N 0 3 408.590 4.084 20 0 HIADHN COc1cccc(NC2CCN(C[C@@H](O)COc3ccc(C(C)(C)C)cc3)CC2)c1 ZINC000524791941 929829972 /nfs/dbraw/zinc/82/99/72/929829972.db2.gz FDYOMYFXDAZMCA-JOCHJYFZSA-N 0 3 412.574 4.309 20 0 HIADHN O=C(NCc1ccc(-c2ccncc2)cc1)NC[C@H](c1ccccc1)N1CCCC1 ZINC000524798591 929832876 /nfs/dbraw/zinc/83/28/76/929832876.db2.gz LFKKQFHMHWBEEO-XMMPIXPASA-N 0 3 400.526 4.385 20 0 HIADHN CC(C)C[C@@H](C(=O)Nc1ccc(C(=O)NCCN2CCCC2)cc1)c1ccccc1 ZINC000524821421 929843755 /nfs/dbraw/zinc/84/37/55/929843755.db2.gz RIVMUFIJHUBFSV-HSZRJFAPSA-N 0 3 407.558 4.281 20 0 HIADHN CCOC(=O)CCc1ccc(NC(=O)NC[C@@H](c2cccs2)N2CCCC2)cc1 ZINC000524828435 929848258 /nfs/dbraw/zinc/84/82/58/929848258.db2.gz WPFVNOFORCXHIV-IBGZPJMESA-N 0 3 415.559 4.202 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)NCc1cc(Br)cs1 ZINC000524883232 929871242 /nfs/dbraw/zinc/87/12/42/929871242.db2.gz HQHMNYDZXIQERK-HNNXBMFYSA-N 0 3 422.392 4.317 20 0 HIADHN C[C@@H]1CCC[C@H](C)N1CCNC(=O)C(=O)Nc1cccc(CSC2CCCC2)c1 ZINC000524921308 929890143 /nfs/dbraw/zinc/89/01/43/929890143.db2.gz XRFAGOYSHLKDHA-HDICACEKSA-N 0 3 417.619 4.180 20 0 HIADHN O=C(N[C@@H](COCc1ccccc1)c1ccccc1)N1CCN(C2CCCC2)CC1 ZINC000524928192 929894892 /nfs/dbraw/zinc/89/48/92/929894892.db2.gz MDEBZONTNMQGHA-DEOSSOPVSA-N 0 3 407.558 4.214 20 0 HIADHN COc1ccc([C@H](CNC(=O)NC2(c3cccc(Cl)c3)CC2)N2CCCC2)cc1 ZINC000524936457 929898475 /nfs/dbraw/zinc/89/84/75/929898475.db2.gz JRJXKCWCSJVVEB-NRFANRHFSA-N 0 3 413.949 4.474 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)Cc3c[nH]c4c3cccc4C)CC2)c1 ZINC000524957008 929919509 /nfs/dbraw/zinc/91/95/09/929919509.db2.gz VWSBMAKSANXWID-UHFFFAOYSA-N 0 3 418.585 4.046 20 0 HIADHN CN(C)Cc1cccc(C(=O)Nc2nc(-c3ccc(-n4cccn4)cc3)cs2)c1 ZINC000524978202 929943950 /nfs/dbraw/zinc/94/39/50/929943950.db2.gz FCIUPMAJCLYWOR-UHFFFAOYSA-N 0 3 403.511 4.310 20 0 HIADHN C[C@@H](O)CN(Cc1ccccc1)C(=O)NC[C@H](c1ccccc1)N1CCC(C)CC1 ZINC000524981303 929945948 /nfs/dbraw/zinc/94/59/48/929945948.db2.gz QCBWFDBAVBAJKZ-ZJSXRUAMSA-N 0 3 409.574 4.052 20 0 HIADHN COc1ccc(C[C@@H](C)NC(=O)[C@@H](C)N2CCC(Cc3ccccc3)CC2)cc1OC ZINC000525088167 930027329 /nfs/dbraw/zinc/02/73/29/930027329.db2.gz IADAMCZERDFQBJ-WOJBJXKFSA-N 0 3 424.585 4.094 20 0 HIADHN CCN(C)[C@@H](C(=O)NCc1ccccc1CN(C)Cc1ccco1)c1ccccc1 ZINC000525098177 930033630 /nfs/dbraw/zinc/03/36/30/930033630.db2.gz QGOVHFLKJGLHFL-XMMPIXPASA-N 0 3 405.542 4.221 20 0 HIADHN COc1cc(C(C)=O)ccc1OC[C@@H](O)CN(Cc1ccoc1)C1CCCCC1 ZINC000525120643 930048142 /nfs/dbraw/zinc/04/81/42/930048142.db2.gz LITNBMGEGIJXFF-NRFANRHFSA-N 0 3 401.503 4.065 20 0 HIADHN COc1ccc(OC)c([C@@H]2CCCN2C(=O)CN2CC[C@H](c3ccccc3)[C@@H](C)C2)c1 ZINC000525122298 930049056 /nfs/dbraw/zinc/04/90/56/930049056.db2.gz DKNNKMBDMFZDJO-APTRMMRNSA-N 0 3 422.569 4.493 20 0 HIADHN C[C@@H](C(=O)N(CCN(C)C)Cc1ccc(Br)cc1)c1cccc(F)c1 ZINC000525134796 930054980 /nfs/dbraw/zinc/05/49/80/930054980.db2.gz LSTSWNVMWNLIRZ-OAHLLOKOSA-N 0 3 407.327 4.282 20 0 HIADHN Cc1nn(Cc2ccccc2)c(C)c1C(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1 ZINC000525223679 930092083 /nfs/dbraw/zinc/09/20/83/930092083.db2.gz DVOLPNMMGZGHKP-HXUWFJFHSA-N 0 3 416.569 4.285 20 0 HIADHN Cc1cc(C)n(-c2ccc(CC(=O)N3CC[C@@H](C)N(Cc4ccccc4)CC3)cc2)n1 ZINC000525223713 930093221 /nfs/dbraw/zinc/09/32/21/930093221.db2.gz QFFVGVYVAAAQSN-OAQYLSRUSA-N 0 3 416.569 4.155 20 0 HIADHN C[C@@H](CC(=O)c1cccc(Br)c1)C(=O)NCCN1[C@H](C)CCC[C@@H]1C ZINC000525242908 930102131 /nfs/dbraw/zinc/10/21/31/930102131.db2.gz CUQWUBFRRXPEGU-HRCADAONSA-N 0 3 409.368 4.037 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@@H](C)N[C@H](C)c2ccc(OC(C)C)cc2)cc1OC ZINC000525244399 930103064 /nfs/dbraw/zinc/10/30/64/930103064.db2.gz SQXZXIHZDSAAHF-QZTJIDSGSA-N 0 3 414.546 4.189 20 0 HIADHN C[C@@H](N[C@H](C)c1cccc2ccccc21)C(=O)NCCc1ccc2c(c1)OCCO2 ZINC000525248808 930106421 /nfs/dbraw/zinc/10/64/21/930106421.db2.gz AVQOJTNXUGGZKA-QZTJIDSGSA-N 0 3 404.510 4.009 20 0 HIADHN COc1cc(-c2nnc(CN3C[C@@H](c4ccccc4)C[C@@H]3C)o2)cc(OC)c1OC ZINC000525273055 930124524 /nfs/dbraw/zinc/12/45/24/930124524.db2.gz OWKRBPFCGBNYDQ-YJBOKZPZSA-N 0 3 409.486 4.140 20 0 HIADHN COc1ccc(SCCC(=O)N[C@H](CN2CCCC2)c2ccccc2)cc1OC ZINC000525370100 930201332 /nfs/dbraw/zinc/20/13/32/930201332.db2.gz BUOTVGMKMQOFPL-HXUWFJFHSA-N 0 3 414.571 4.139 20 0 HIADHN CCc1c(C(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)cnn1-c1ccccc1 ZINC000525381137 930208010 /nfs/dbraw/zinc/20/80/10/930208010.db2.gz MNTRYFIGUQDEQZ-HXUWFJFHSA-N 0 3 402.542 4.171 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)Cc1ccccc1Br ZINC000525384605 930210958 /nfs/dbraw/zinc/21/09/58/930210958.db2.gz GZNBWEGVXXJSFL-QGZVFWFLSA-N 0 3 401.348 4.115 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)c1cnn(-c2ccccc2Cl)c1 ZINC000525384682 930211093 /nfs/dbraw/zinc/21/10/93/930211093.db2.gz GMXUPGCEBYEQQF-SFHVURJKSA-N 0 3 408.933 4.262 20 0 HIADHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)NC[C@@H]1CCCO[C@H]1C(C)(C)C ZINC000525394448 930215523 /nfs/dbraw/zinc/21/55/23/930215523.db2.gz QYPQOAATDXHJOB-BAGYTPMASA-N 0 3 401.595 4.134 20 0 HIADHN CCCN(Cc1cc(OC)c(OC)cc1Br)[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC000525410853 930225065 /nfs/dbraw/zinc/22/50/65/930225065.db2.gz MIZXWTAVGIGUEX-KYNGSXCRSA-N 0 3 412.368 4.492 20 0 HIADHN C[C@@H](COc1ccc(F)cc1F)NC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C ZINC000525416268 930228797 /nfs/dbraw/zinc/22/87/97/930228797.db2.gz LMUORETUDYKCEF-ZWKOTPCHSA-N 0 3 417.500 4.038 20 0 HIADHN Cc1ccc(NC(=O)[C@H]2CCN(c3cc(Cl)ccc3Cl)C2=O)c(CN(C)C)c1 ZINC000525495064 930281616 /nfs/dbraw/zinc/28/16/16/930281616.db2.gz BXBXCEFPGPIUHR-MRXNPFEDSA-N 0 3 420.340 4.355 20 0 HIADHN Cc1ccccc1[C@@H](C)CC(=O)Nc1ccc(C(=O)N(C)[C@H]2CCCN(C)C2)cc1 ZINC000525612146 930362312 /nfs/dbraw/zinc/36/23/12/930362312.db2.gz GNWHEMPZVKRUNN-UGKGYDQZSA-N 0 3 407.558 4.294 20 0 HIADHN Cc1c(N[C@H](C)C(C)C)cccc1C(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000525641865 930379079 /nfs/dbraw/zinc/37/90/79/930379079.db2.gz INUVCZYHWJLDEH-SFHLNBCPSA-N 0 3 415.622 4.413 20 0 HIADHN COc1ccc2c(c1)CCC[C@@H]2N[C@@H]1CCCN(Cc2ccc(F)cc2F)C1=O ZINC000526047972 930515206 /nfs/dbraw/zinc/51/52/06/930515206.db2.gz DRGWIMKKULWLPX-FCHUYYIVSA-N 0 3 400.469 4.132 20 0 HIADHN O=C1[C@@H](N[C@@H](c2cccnc2)C2CC2)CCCN1Cc1cccc(C(F)(F)F)c1 ZINC000526083843 930522685 /nfs/dbraw/zinc/52/26/85/930522685.db2.gz IMUMYNFMQKHULE-VQTJNVASSA-N 0 3 403.448 4.332 20 0 HIADHN C[C@H](NCC(=O)Nc1cc(Cl)ccc1-n1cncn1)c1cc2ccccc2s1 ZINC000526945055 930554858 /nfs/dbraw/zinc/55/48/58/930554858.db2.gz ZNQIOZNGKRRRHK-ZDUSSCGKSA-N 0 3 411.918 4.425 20 0 HIADHN Cc1cc(N2CCC[C@H](N[C@H](c3cccnc3)C3CC3)C2=O)ccc1Br ZINC000527326327 930634501 /nfs/dbraw/zinc/63/45/01/930634501.db2.gz YOYACJKIEVNLGX-PMACEKPBSA-N 0 3 414.347 4.389 20 0 HIADHN O=C(c1c[nH]c2ncc(Br)cc12)N(CCN1CCCC1)c1ccccc1 ZINC000527467907 930661728 /nfs/dbraw/zinc/66/17/28/930661728.db2.gz AGEJJUQKMMMGKM-UHFFFAOYSA-N 0 3 413.319 4.068 20 0 HIADHN COc1ccc(CCNC(=O)[C@@H](C)N[C@H](C)c2cc3ccccc3s2)cc1OC ZINC000527484810 930666778 /nfs/dbraw/zinc/66/67/78/930666778.db2.gz HSTVDYRSESDQPE-HZPDHXFCSA-N 0 3 412.555 4.317 20 0 HIADHN NC(=O)c1ccc(CN[C@H](Cc2ccccn2)c2ccc(Br)cc2)cc1 ZINC000530386701 930698717 /nfs/dbraw/zinc/69/87/17/930698717.db2.gz WWQWPWLWGNUDJE-HXUWFJFHSA-N 0 3 410.315 4.017 20 0 HIADHN O=C1[C@H](NCc2cccc(-n3cccn3)c2)CCN1c1ccc(Cl)cc1Cl ZINC000530440113 930708703 /nfs/dbraw/zinc/70/87/03/930708703.db2.gz LGTADGXGVVGFGO-GOSISDBHSA-N 0 3 401.297 4.074 20 0 HIADHN CCC(=O)Nc1ccc(Cl)c(NC(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)c1 ZINC000530462807 930718952 /nfs/dbraw/zinc/71/89/52/930718952.db2.gz XSZZVJHJPHPIND-YLJYHZDGSA-N 0 3 400.910 4.255 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2ccccc2OC[C@@H]2CCCCO2)[C@H]1c1ccccc1 ZINC000530462597 930719218 /nfs/dbraw/zinc/71/92/18/930719218.db2.gz PMHISMGMECXBLC-IEIRFRATSA-N 0 3 409.530 4.201 20 0 HIADHN COc1ccc(NC(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)cc1OCC(F)(F)F ZINC000530515590 930733641 /nfs/dbraw/zinc/73/36/41/930733641.db2.gz ZDESXXYAXWINRL-QFBILLFUSA-N 0 3 423.435 4.203 20 0 HIADHN CN1CC[C@H](NC(=O)Nc2cccc(OCc3cccnc3)c2)[C@H]1c1ccccc1 ZINC000530515371 930734140 /nfs/dbraw/zinc/73/41/40/930734140.db2.gz DTINRNCOYGXBDV-XZOQPEGZSA-N 0 3 402.498 4.228 20 0 HIADHN CN1CCC(N(Cc2ccccc2)C(=O)Cc2ccc(Br)cc2)CC1 ZINC000530680092 930796119 /nfs/dbraw/zinc/79/61/19/930796119.db2.gz TVWURKKGBLFYQP-UHFFFAOYSA-N 0 3 401.348 4.115 20 0 HIADHN CN(Cc1ccc(C(C)(C)C)cc1)C(=O)NCc1ccccc1CN1CCC(O)CC1 ZINC000530685315 930797770 /nfs/dbraw/zinc/79/77/70/930797770.db2.gz PDNUDXNFXCKGLP-UHFFFAOYSA-N 0 3 423.601 4.282 20 0 HIADHN O=C([C@H]1CCCN(Cc2cccnc2)C1)N1CCC[C@@]2(CCCc3ccccc32)C1 ZINC000530759223 930817930 /nfs/dbraw/zinc/81/79/30/930817930.db2.gz GTBFRSWCVQAZCG-OZXSUGGESA-N 0 3 403.570 4.190 20 0 HIADHN CCN(C[C@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)c1cccc2ccc(C)nc21 ZINC000530770886 930819951 /nfs/dbraw/zinc/81/99/51/930819951.db2.gz KNGWMIDOVQKGOJ-NRFANRHFSA-N 0 3 423.582 4.076 20 0 HIADHN Cc1nn(Cc2ccccc2Cl)c(C)c1CNCc1n[nH]c(-c2ccc(F)cc2)n1 ZINC000530780151 930821802 /nfs/dbraw/zinc/82/18/02/930821802.db2.gz XIJKLJROKDLOBY-UHFFFAOYSA-N 0 3 424.911 4.416 20 0 HIADHN COc1ccc(Nc2nc(C(=O)Nc3cc(CN(C)C)ccc3OC)cs2)cc1 ZINC000530811341 930829773 /nfs/dbraw/zinc/82/97/73/930829773.db2.gz PUFVQVASDDZLEP-UHFFFAOYSA-N 0 3 412.515 4.218 20 0 HIADHN COc1ccc(CC[N@H+](C)Cc2cccc([N-]S(=O)(=O)c3ccccc3)c2)cc1 ZINC000530867484 930844286 /nfs/dbraw/zinc/84/42/86/930844286.db2.gz ZTXAGDAKHXCORF-UHFFFAOYSA-N 0 3 410.539 4.171 20 0 HIADHN COc1ccc(CC[N@@H+](C)Cc2cccc([N-]S(=O)(=O)c3ccccc3)c2)cc1 ZINC000530867484 930844288 /nfs/dbraw/zinc/84/42/88/930844288.db2.gz ZTXAGDAKHXCORF-UHFFFAOYSA-N 0 3 410.539 4.171 20 0 HIADHN CN(C[C@H](O)COC[C@@H]1CCCO1)[C@@H](c1ccc(F)cc1)c1ccc(Cl)cc1 ZINC000530901573 930854322 /nfs/dbraw/zinc/85/43/22/930854322.db2.gz QOEKLQRUMGTWBD-FDFHNCONSA-N 0 3 407.913 4.057 20 0 HIADHN COc1ccc(CCN(Cc2ccsc2)Cc2ccc(C(N)=O)cc2)cc1OC ZINC000530926847 930860458 /nfs/dbraw/zinc/86/04/58/930860458.db2.gz FWZPOURLMIKYCA-UHFFFAOYSA-N 0 3 410.539 4.109 20 0 HIADHN Cc1[nH]c(=O)c(C(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)cc1-c1ccccc1 ZINC000530941956 930863684 /nfs/dbraw/zinc/86/36/84/930863684.db2.gz PXIWLTGQIXFHLP-LJQANCHMSA-N 0 3 415.537 4.499 20 0 HIADHN CCN1CCN(CCC(=O)N[C@@H](c2ccccc2)c2cccc3ccccc32)CC1 ZINC000531057405 930900125 /nfs/dbraw/zinc/90/01/25/930900125.db2.gz URSNIYUSPUMFCF-SANMLTNESA-N 0 3 401.554 4.073 20 0 HIADHN COC1CCN(C(C)(C)CNC(=O)c2ccc(Oc3ccccc3Cl)nc2)CC1 ZINC000531072119 930907116 /nfs/dbraw/zinc/90/71/16/930907116.db2.gz DKVWNYLOJASHBT-UHFFFAOYSA-N 0 3 417.937 4.147 20 0 HIADHN COc1cc(C[NH2+]C[C@H](OC)c2ccc(Cl)cc2)cc(Br)c1[O-] ZINC000531094223 930917996 /nfs/dbraw/zinc/91/79/96/930917996.db2.gz PDPXIHZPHHOEAK-INIZCTEOSA-N 0 3 400.700 4.294 20 0 HIADHN O=C(c1ccc(-c2n[nH]c(C3CC3)n2)cc1)N(CCN1CCCC1)c1ccccc1 ZINC000531152738 930947057 /nfs/dbraw/zinc/94/70/57/930947057.db2.gz MNTRSODHDGMCLA-UHFFFAOYSA-N 0 3 401.514 4.092 20 0 HIADHN CC[C@@H](CNC(=O)c1cc(-c2ccccc2)c(C)[nH]c1=O)N1CCc2ccccc2C1 ZINC000531163550 930949897 /nfs/dbraw/zinc/94/98/97/930949897.db2.gz GOLNAGFRBNUZLD-QFIPXVFZSA-N 0 3 415.537 4.329 20 0 HIADHN COc1cc(C)c(CNCc2cc(Br)c(OC)c(OC)c2)cc1OC ZINC000531199458 930962943 /nfs/dbraw/zinc/96/29/43/930962943.db2.gz PCMNOBUVCWGUCH-UHFFFAOYSA-N 0 3 410.308 4.082 20 0 HIADHN CN(C)Cc1ccc(-c2noc(Cn3c4ccccc4nc3C(F)(F)F)n2)cc1 ZINC000531348782 931026207 /nfs/dbraw/zinc/02/62/07/931026207.db2.gz ZQIHZSFSLWZLKN-UHFFFAOYSA-N 0 3 401.392 4.215 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C1CCN(c2ccc(C(F)(F)F)cn2)CC1 ZINC000531374973 931036438 /nfs/dbraw/zinc/03/64/38/931036438.db2.gz YRODHVAGRGWUMN-UHFFFAOYSA-N 0 3 420.479 4.326 20 0 HIADHN Cc1cc(C)n(-c2ccc(C(=O)N(Cc3ccccc3)C3CCN(C)CC3)cc2)n1 ZINC000531396023 931043059 /nfs/dbraw/zinc/04/30/59/931043059.db2.gz ATBLTNORYFYZKV-UHFFFAOYSA-N 0 3 402.542 4.226 20 0 HIADHN CN(C)[C@H](CNC(=O)NCCc1nc2cc(Cl)ccc2s1)c1ccccc1 ZINC000531523116 931091498 /nfs/dbraw/zinc/09/14/98/931091498.db2.gz ZPLFGGAPLRAOEK-QGZVFWFLSA-N 0 3 402.951 4.094 20 0 HIADHN CC(C)Sc1ccc([C@@H](C)NC(=O)N2CC[C@@H](N3CCN(C(C)C)CC3)C2)cc1 ZINC000531584359 931110148 /nfs/dbraw/zinc/11/01/48/931110148.db2.gz RVYCWQCLAOHJPX-TZIWHRDSSA-N 0 3 418.651 4.058 20 0 HIADHN C[C@@H]1CN(C(=O)c2ccc(CNCc3cc(Cl)cc4cccnc43)cc2)C[C@@H](C)O1 ZINC000531658642 931142226 /nfs/dbraw/zinc/14/22/26/931142226.db2.gz HANNUJXRMGTZLY-IAGOWNOFSA-N 0 3 423.944 4.427 20 0 HIADHN Cc1nn(C)c(C)c1CCN[C@H](C)c1ccc(Br)cc1Br ZINC000531687718 931153172 /nfs/dbraw/zinc/15/31/72/931153172.db2.gz GPLNDVUCPBVDQH-SNVBAGLBSA-N 0 3 415.173 4.455 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(S(C)(=O)=O)cc1)c1ccc(OCC(F)(F)F)cc1 ZINC000531695056 931158257 /nfs/dbraw/zinc/15/82/57/931158257.db2.gz VJRXIMOCDOMSEI-ZIAGYGMSSA-N 0 3 401.450 4.443 20 0 HIADHN CNC(=O)c1cccc(CN[C@H](CCCOC)c2ccc(Br)cc2)c1 ZINC000531700288 931163643 /nfs/dbraw/zinc/16/36/43/931163643.db2.gz FWULNAVEBQVQTJ-LJQANCHMSA-N 0 3 405.336 4.066 20 0 HIADHN CNC(=O)c1cccc(CN[C@@H](CCCOC)c2ccc(Br)cc2)c1 ZINC000531700287 931164381 /nfs/dbraw/zinc/16/43/81/931164381.db2.gz FWULNAVEBQVQTJ-IBGZPJMESA-N 0 3 405.336 4.066 20 0 HIADHN CCC[C@@H](NCc1ccccc1CS(=O)(=O)NC(C)C)c1ccc(OC)cc1 ZINC000531703320 931164915 /nfs/dbraw/zinc/16/49/15/931164915.db2.gz UACREBRTTFZGOU-JOCHJYFZSA-N 0 3 404.576 4.154 20 0 HIADHN Cc1nc(-c2cccnc2)sc1[C@@H](C)N[C@H](CN1CCN(C)CC1)c1ccccc1 ZINC000531703690 931166132 /nfs/dbraw/zinc/16/61/32/931166132.db2.gz WDPPJVWBMVZDMC-XMSQKQJNSA-N 0 3 421.614 4.153 20 0 HIADHN CCC[C@H](N[C@H](C)c1ccc2c(c1)CCC(=O)N2)C(=O)N1CCc2sccc2C1 ZINC000531710019 931168938 /nfs/dbraw/zinc/16/89/38/931168938.db2.gz IBFSNTOBNRUQBA-QRWLVFNGSA-N 0 3 411.571 4.037 20 0 HIADHN C[C@@H](N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1)c1ccc2c(c1)OCCO2 ZINC000531715519 931171746 /nfs/dbraw/zinc/17/17/46/931171746.db2.gz SLKSHHFABGCSIL-GCJKJVERSA-N 0 3 402.494 4.358 20 0 HIADHN CCOc1cc(CNCc2ccc(C)cc2SC)ccc1O[C@@H](C)C(=O)N(C)C ZINC000531789423 931197539 /nfs/dbraw/zinc/19/75/39/931197539.db2.gz AXYFACJHNQRBBF-KRWDZBQOSA-N 0 3 416.587 4.261 20 0 HIADHN Cc1nc2sc(-c3ccccc3)cc2c(N2CC[C@H](N3CCN(C(C)C)CC3)C2)n1 ZINC000531836238 931215286 /nfs/dbraw/zinc/21/52/86/931215286.db2.gz UKYBNVBYCHCEIU-FQEVSTJZSA-N 0 3 421.614 4.271 20 0 HIADHN CC(C)N1CCN([C@@H]2CCN(C(=O)N[C@@H](CC(C)(C)C)c3ccc(F)cc3)C2)CC1 ZINC000531839629 931215885 /nfs/dbraw/zinc/21/58/85/931215885.db2.gz UKDLBNOOIFBBCC-YADHBBJMSA-N 0 3 418.601 4.113 20 0 HIADHN Cc1noc(-c2ccc(C)c(NC(=O)N(C)[C@@H]3CCN(Cc4ccccc4)C3)c2)n1 ZINC000531883409 931233201 /nfs/dbraw/zinc/23/32/01/931233201.db2.gz VXZXQLSGKQPSTA-HXUWFJFHSA-N 0 3 405.502 4.092 20 0 HIADHN C[C@H](NC[C@H](c1cccs1)N1CCN(C)CC1)c1ccc(F)cc1OC(F)F ZINC000531932529 931250900 /nfs/dbraw/zinc/25/09/00/931250900.db2.gz SQVOUFXHMICSJB-WMLDXEAASA-N 0 3 413.509 4.128 20 0 HIADHN COc1ccc([C@H](C)NCc2ccccc2CN2CCCC2=O)cc1Br ZINC000531940746 931255115 /nfs/dbraw/zinc/25/51/15/931255115.db2.gz HOOSDXGEGDKDIR-HNNXBMFYSA-N 0 3 417.347 4.431 20 0 HIADHN C[C@@H](NCc1ccc(N2CCOCC2)nc1)c1ccc(SCC(F)(F)F)cc1 ZINC000531944595 931256711 /nfs/dbraw/zinc/25/67/11/931256711.db2.gz ICQVTBPEVOFPSZ-OAHLLOKOSA-N 0 3 411.493 4.423 20 0 HIADHN COc1cccc(C(=O)NCCN[C@H](C)c2sc(Cc3ccccc3)nc2C)c1 ZINC000531952483 931261838 /nfs/dbraw/zinc/26/18/38/931261838.db2.gz JNPQAVCPRIRAFV-MRXNPFEDSA-N 0 3 409.555 4.132 20 0 HIADHN C[C@@H](NCc1cccc(NC(=O)C2CCCCC2)c1)c1ccc(-n2cnnn2)cc1 ZINC000531956149 931263896 /nfs/dbraw/zinc/26/38/96/931263896.db2.gz AWYDQCAOFGPYIZ-QGZVFWFLSA-N 0 3 404.518 4.032 20 0 HIADHN CC(C)NS(=O)(=O)Cc1ccccc1CN[C@H]1c2cccc(F)c2CC[C@@H]1C ZINC000531958219 931265040 /nfs/dbraw/zinc/26/50/40/931265040.db2.gz TZEUQFLQCSVYEK-KSFYIVLOSA-N 0 3 404.551 4.067 20 0 HIADHN CCS(=O)(=O)Nc1ccc([C@@H](C)NCc2ccc(OC3CCCCC3)nc2)cc1 ZINC000531963118 931266331 /nfs/dbraw/zinc/26/63/31/931266331.db2.gz FOUHLPOUXXBKRG-QGZVFWFLSA-N 0 3 417.575 4.406 20 0 HIADHN COc1ccc(OC)c(NC(=O)C[C@H](C)N[C@H](c2ccc(F)cc2)[C@H]2CCCO2)c1 ZINC000531962330 931266377 /nfs/dbraw/zinc/26/63/77/931266377.db2.gz DRVRLVIQOXTAGY-PNDGYVOYSA-N 0 3 416.493 4.070 20 0 HIADHN Cc1c([C@H](C)N[C@H](C)Cn2cc(Br)cn2)cnn1-c1ccc(F)cc1 ZINC000531962414 931266527 /nfs/dbraw/zinc/26/65/27/931266527.db2.gz KMCUUKFMDISMCC-OLZOCXBDSA-N 0 3 406.303 4.018 20 0 HIADHN COc1ccc(OC)c(NC(=O)C[C@H](C)N[C@H](c2ccc(F)cc2)[C@@H]2CCCO2)c1 ZINC000531962331 931266635 /nfs/dbraw/zinc/26/66/35/931266635.db2.gz DRVRLVIQOXTAGY-VSUDMRMVSA-N 0 3 416.493 4.070 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)N1CCC[C@@H]1c1cccc(C)n1)c1cccc(OC)c1 ZINC000531963195 931267408 /nfs/dbraw/zinc/26/74/08/931267408.db2.gz QFYNJYLNEOTDSX-PKTZIBPZSA-N 0 3 410.562 4.328 20 0 HIADHN CC[C@@H](N[C@@H](C)c1cccc(S(=O)(=O)NC)c1)c1ccc(Br)cc1 ZINC000531965531 931268739 /nfs/dbraw/zinc/26/87/39/931268739.db2.gz HYZRVUZOCTYNAC-SCLBCKFNSA-N 0 3 411.365 4.159 20 0 HIADHN CN1CCN(c2ccc(CN[C@@H]3CCCOc4c(Cl)c(Cl)ccc43)cn2)CC1 ZINC000531989672 931278544 /nfs/dbraw/zinc/27/85/44/931278544.db2.gz NGYFRSCWPYLONJ-GOSISDBHSA-N 0 3 421.372 4.144 20 0 HIADHN COc1cc(C[C@@H](CO)CN[C@@H](C)c2sccc2Br)cc(OC)c1 ZINC000531994810 931279359 /nfs/dbraw/zinc/27/93/59/931279359.db2.gz QJZGZPVNZZWDTB-GXTWGEPZSA-N 0 3 414.365 4.030 20 0 HIADHN CC(C)N1CCN([C@H]2CCN(C(=O)Nc3ccccc3SC3CCCC3)C2)CC1 ZINC000532096677 931310701 /nfs/dbraw/zinc/31/07/01/931310701.db2.gz UJHUYFMJKZGVQI-IBGZPJMESA-N 0 3 416.635 4.354 20 0 HIADHN CN(Cc1ccccc1Br)C(=O)CCNCc1cnc(C2CCC2)s1 ZINC000532122581 931321783 /nfs/dbraw/zinc/32/17/83/931321783.db2.gz XTBWGDLOBDHASN-UHFFFAOYSA-N 0 3 422.392 4.311 20 0 HIADHN O[C@@H](COC[C@@H]1CCCO1)CN1CCC(=Cc2cc(Cl)ccc2Cl)CC1 ZINC000532165425 931334180 /nfs/dbraw/zinc/33/41/80/931334180.db2.gz ICMWJQROFADBKC-MOPGFXCFSA-N 0 3 400.346 4.029 20 0 HIADHN C[C@H](NCc1ccc(N2CCN(C)CC2)nc1)c1ccc(SCC(F)(F)F)cc1 ZINC000532197119 931345327 /nfs/dbraw/zinc/34/53/27/931345327.db2.gz GDAJMKZTQAKJAF-INIZCTEOSA-N 0 3 424.536 4.339 20 0 HIADHN CCc1nc2c(s1)[C@H](N[C@@H](C)c1ccc(S(=O)(=O)N(CC)CC)cc1)CCC2 ZINC000532203036 931348391 /nfs/dbraw/zinc/34/83/91/931348391.db2.gz CJERPEDPSVAVMN-MAUKXSAKSA-N 0 3 421.632 4.464 20 0 HIADHN CC(C)NS(=O)(=O)Cc1ccc(CN[C@H](C)c2cccc(C(F)(F)F)c2)cc1 ZINC000532206360 931350210 /nfs/dbraw/zinc/35/02/10/931350210.db2.gz JDPHIRFTLRBEKD-OAHLLOKOSA-N 0 3 414.493 4.384 20 0 HIADHN COc1ccc([C@H](C)N[C@@H](C)c2ccc(OCC(=O)NC3CC3)cc2)cc1Cl ZINC000532211355 931353972 /nfs/dbraw/zinc/35/39/72/931353972.db2.gz QXDIRDIKWSRAHM-GJZGRUSLSA-N 0 3 402.922 4.418 20 0 HIADHN Cc1nn(C)cc1[C@H](C)N[C@H](C)CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 ZINC000532214805 931355992 /nfs/dbraw/zinc/35/59/92/931355992.db2.gz FRZKEVYSSDQGSH-MNOVXSKESA-N 0 3 402.848 4.469 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)N[C@H](C)c2cccc(N3CCCS3(=O)=O)c2)cc1 ZINC000532233020 931365766 /nfs/dbraw/zinc/36/57/66/931365766.db2.gz JSAYGSLCYAFPFJ-QZTJIDSGSA-N 0 3 424.570 4.132 20 0 HIADHN CSCc1cc(F)ccc1CNC(=O)N(CCN(C)C)Cc1ccc(F)cc1 ZINC000532290876 931386400 /nfs/dbraw/zinc/38/64/00/931386400.db2.gz CQIYZOYLGVSBHM-UHFFFAOYSA-N 0 3 407.530 4.101 20 0 HIADHN COc1ccc(CN[C@H]2CCN(c3ncc(C(F)(F)F)cc3Cl)C2)c(OC)c1 ZINC000532321618 931396876 /nfs/dbraw/zinc/39/68/76/931396876.db2.gz JVFKLEQNZRLISK-AWEZNQCLSA-N 0 3 415.843 4.140 20 0 HIADHN O=C(Nc1ccc(CNCc2ccc(-n3cncn3)c(F)c2)cc1)c1ccc(F)cc1 ZINC000532328687 931398454 /nfs/dbraw/zinc/39/84/54/931398454.db2.gz HXGKQXBBEJGTBQ-UHFFFAOYSA-N 0 3 419.435 4.088 20 0 HIADHN Cc1cccc(Oc2ccccc2NC(=O)N2CC[C@@H](N3CCN(C(C)C)CC3)C2)c1 ZINC000532348241 931404410 /nfs/dbraw/zinc/40/44/10/931404410.db2.gz ANAPMQAYZFIENH-OAQYLSRUSA-N 0 3 422.573 4.420 20 0 HIADHN CCC(=O)Nc1cccc(CN[C@H](C)CC(=O)Nc2cc(Cl)ccc2OC)c1 ZINC000532448019 931438306 /nfs/dbraw/zinc/43/83/06/931438306.db2.gz MCDHSMCMNYEHOA-CQSZACIVSA-N 0 3 403.910 4.204 20 0 HIADHN C[C@@H](CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)NCc1cccnc1N(C)C ZINC000532450776 931439440 /nfs/dbraw/zinc/43/94/40/931439440.db2.gz BVBJSHXFHSSXCO-LBPRGKRZSA-N 0 3 414.859 4.327 20 0 HIADHN CC[C@@H](N[C@@H](C)c1ccc(NC(=O)C2CC2)cc1)c1ccccc1OCC(=O)N(C)C ZINC000532455180 931442633 /nfs/dbraw/zinc/44/26/33/931442633.db2.gz AUYTWERKPFVXDG-HTAPYJJXSA-N 0 3 423.557 4.304 20 0 HIADHN COc1ccc([C@H](C)N[C@@H](C)c2ccc(S(=O)(=O)N3CCCCC3)cc2)cc1F ZINC000532454558 931442973 /nfs/dbraw/zinc/44/29/73/931442973.db2.gz TWTNQCSKZLOAKZ-IRXDYDNUSA-N 0 3 420.550 4.421 20 0 HIADHN C[C@@H](NCc1cccc(NC(=O)[C@@H]2CCCO2)c1)c1ccc(Br)cc1 ZINC000532465125 931446602 /nfs/dbraw/zinc/44/66/02/931446602.db2.gz IYHWRTOWTANGAG-KUHUBIRLSA-N 0 3 403.320 4.417 20 0 HIADHN C[C@@H](NCCS(=O)(=O)c1ccccc1)[C@H](C)Oc1ccc(Cl)cc1Cl ZINC000532465012 931446646 /nfs/dbraw/zinc/44/66/46/931446646.db2.gz CXQPPJPNJHBRLK-KGLIPLIRSA-N 0 3 402.343 4.213 20 0 HIADHN CC[C@H](N[C@@H](C)c1ccc(S(=O)(=O)NC)cc1)c1ccc(Br)cc1 ZINC000532467996 931448803 /nfs/dbraw/zinc/44/88/03/931448803.db2.gz JRIGQEUYHHJVOU-UGSOOPFHSA-N 0 3 411.365 4.159 20 0 HIADHN CC(C)NS(=O)(=O)Cc1ccc(CN[C@H]2C[C@H](C)Sc3sccc32)cc1 ZINC000532468236 931449299 /nfs/dbraw/zinc/44/92/99/931449299.db2.gz ZJWHFOYSJGDLPZ-KSSFIOAISA-N 0 3 410.630 4.291 20 0 HIADHN C[C@H](NCCNS(=O)(=O)c1cccc(Cl)c1)c1cccc(-c2ccncc2)c1 ZINC000532468447 931449348 /nfs/dbraw/zinc/44/93/48/931449348.db2.gz SZBLOVJCNBYICB-INIZCTEOSA-N 0 3 415.946 4.031 20 0 HIADHN COc1cc([C@@H](C)NCc2ccc(NC(=O)c3ccco3)cc2)cc(OC)c1OC ZINC000532471589 931450336 /nfs/dbraw/zinc/45/03/36/931450336.db2.gz JHZXREYNPSLQRK-OAHLLOKOSA-N 0 3 410.470 4.409 20 0 HIADHN COc1ccsc1CNCCOc1cccc(NC(=O)c2ccc(OC)cc2)c1 ZINC000532479810 931454932 /nfs/dbraw/zinc/45/49/32/931454932.db2.gz VSMSQHJPMAGQGJ-UHFFFAOYSA-N 0 3 412.511 4.186 20 0 HIADHN Cc1cc(NC(=O)N[C@@H](C)Cc2ccsc2)n([C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000532507760 931467621 /nfs/dbraw/zinc/46/76/21/931467621.db2.gz NKIODVNOFXZTPE-UWJYYQICSA-N 0 3 423.586 4.453 20 0 HIADHN CCN1CCN(C[C@H](C)CNC(=O)Nc2ccc(SC3CCCC3)cc2)CC1 ZINC000532507880 931467931 /nfs/dbraw/zinc/46/79/31/931467931.db2.gz UZXQXOCNTINYLB-GOSISDBHSA-N 0 3 404.624 4.116 20 0 HIADHN C[C@H](CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)N[C@H]1c2ccccc2C[C@@H]1O ZINC000532520985 931473249 /nfs/dbraw/zinc/47/32/49/931473249.db2.gz KMQLZKWFWPUQIG-RDBACFOTSA-N 0 3 412.839 4.324 20 0 HIADHN C[C@@H]1CN(CC(=O)N(Cc2nnc(-c3ccccc3Cl)o2)C2CC2)C(C)(C)C1 ZINC000532568704 931531315 /nfs/dbraw/zinc/53/13/15/931531315.db2.gz VNOHRFYFJWKFHX-AWEZNQCLSA-N 0 3 402.926 4.001 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)CN2C[C@H](c3ccccc3)C[C@@H]2C)cc1OC ZINC000532582838 931540382 /nfs/dbraw/zinc/54/03/82/931540382.db2.gz YYAAPHGKCWUFHR-BWAGFHJFSA-N 0 3 408.542 4.245 20 0 HIADHN O=C(Nc1ccc(Br)c(Cl)c1)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000532595074 931549446 /nfs/dbraw/zinc/54/94/46/931549446.db2.gz KEKQUSHQNBDZRW-AWEZNQCLSA-N 0 3 408.727 4.348 20 0 HIADHN CO[C@@H](C)c1noc(CN2CCCN([C@@H](C)c3ccc(C(C)(C)C)cc3)CC2)n1 ZINC000532645366 931566409 /nfs/dbraw/zinc/56/64/09/931566409.db2.gz SGPGRPONRZXBTE-ROUUACIJSA-N 0 3 400.567 4.343 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)CN[C@@H](c2ccccc2)C2CCC2)cc1OC ZINC000532686232 931584166 /nfs/dbraw/zinc/58/41/66/931584166.db2.gz GBNORPLEWJHERT-OFVILXPXSA-N 0 3 408.542 4.498 20 0 HIADHN O=C(CNC1(c2ccccc2)CCOCC1)N[C@@H](c1ccc(F)cc1)C1CCCC1 ZINC000532708456 931601095 /nfs/dbraw/zinc/60/10/95/931601095.db2.gz AWLJKLOOKBUYPP-XMMPIXPASA-N 0 3 410.533 4.469 20 0 HIADHN CCCN1CCN(c2ccccc2CNc2cccc([C@H](C)N3CCOCC3)c2)CC1 ZINC000532736729 931618112 /nfs/dbraw/zinc/61/81/12/931618112.db2.gz XRCGJRXFVTWGCI-QFIPXVFZSA-N 0 3 422.617 4.224 20 0 HIADHN CN(C)Cc1ccc(C(N)=O)cc1NCC1=Cc2cc(Cl)cc(Cl)c2OC1 ZINC000532743596 931619409 /nfs/dbraw/zinc/61/94/09/931619409.db2.gz DSMULBYHVLWGTF-UHFFFAOYSA-N 0 3 406.313 4.042 20 0 HIADHN Cc1cc(CNc2cc(C(N)=O)ccc2CN(C)C)cc(C)c1OCc1ccccn1 ZINC000532746857 931621431 /nfs/dbraw/zinc/62/14/31/931621431.db2.gz YDMBEKOVICOAPU-UHFFFAOYSA-N 0 3 418.541 4.050 20 0 HIADHN O=C(c1cncc(-c2ccc3c(c2)CCO3)c1)N(CCN1CCCC1)c1ccccc1 ZINC000532755476 931623405 /nfs/dbraw/zinc/62/34/05/931623405.db2.gz CFBOMVMBIJRIFE-UHFFFAOYSA-N 0 3 413.521 4.426 20 0 HIADHN FC(F)(F)c1cccc(CNc2ccc3nc(CCN4CCOCC4)[nH]c3c2)c1 ZINC000532889730 931681036 /nfs/dbraw/zinc/68/10/36/931681036.db2.gz JELXWFUOYSWPQO-UHFFFAOYSA-N 0 3 404.436 4.069 20 0 HIADHN COc1ccc(C2=NN(C(=O)CN([C@@H](C)C3CC3)C3CC3)[C@@H](c3ccco3)C2)cc1 ZINC000532929534 931700332 /nfs/dbraw/zinc/70/03/32/931700332.db2.gz FMMUKNIZPOCJEL-KSFYIVLOSA-N 0 3 407.514 4.229 20 0 HIADHN Cc1cc(NC(=O)c2ccc(N(C)C)c(F)c2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000532939307 931704369 /nfs/dbraw/zinc/70/43/69/931704369.db2.gz PIHCWLKBFZGZAK-HXUWFJFHSA-N 0 3 421.520 4.096 20 0 HIADHN CC(C)(COc1ccc(C(F)(F)F)cn1)NCc1ccc(Br)cn1 ZINC000533008905 931734172 /nfs/dbraw/zinc/73/41/72/931734172.db2.gz WZIPUUPDRWAQIU-UHFFFAOYSA-N 0 3 404.230 4.205 20 0 HIADHN O=C(Nc1ccc(O)cc1)C1CCN(CCOc2ccccc2C(F)(F)F)CC1 ZINC000533038250 931748463 /nfs/dbraw/zinc/74/84/63/931748463.db2.gz KUNAWBFVAPASSS-UHFFFAOYSA-N 0 3 408.420 4.141 20 0 HIADHN CCN(CC[S@](=O)c1ccccc1)C1CCN(c2cc(C)nc(C(C)C)n2)CC1 ZINC000533073238 931763786 /nfs/dbraw/zinc/76/37/86/931763786.db2.gz MLEGTUAYFCJVPD-LJAQVGFWSA-N 0 3 414.619 4.007 20 0 HIADHN COc1ccccc1NC(=O)CN1CCN(CC2CCC(C(C)(C)C)CC2)CC1 ZINC000533086692 931767778 /nfs/dbraw/zinc/76/77/78/931767778.db2.gz VWCVYZKNNIURJV-UHFFFAOYSA-N 0 3 401.595 4.104 20 0 HIADHN Clc1ccc(CNc2ccc3nc(CCN4CCOCC4)[nH]c3c2)cc1Cl ZINC000533210690 931810041 /nfs/dbraw/zinc/81/00/41/931810041.db2.gz IRZVCWZCVXEOJX-UHFFFAOYSA-N 0 3 405.329 4.357 20 0 HIADHN CN(CC(=O)Nc1cccc(CN2CCSCC2)c1)[C@H]1CCCc2ccccc21 ZINC000533222045 931813729 /nfs/dbraw/zinc/81/37/29/931813729.db2.gz XMSKZNQRDWTKOX-QHCPKHFHSA-N 0 3 409.599 4.183 20 0 HIADHN COc1ccc([C@H](CNC(=O)CN(C(C)C)C2CC2)c2c[nH]c3ccccc32)cc1 ZINC000533251198 931819216 /nfs/dbraw/zinc/81/92/16/931819216.db2.gz PTSPERGPZTYBKN-QFIPXVFZSA-N 0 3 405.542 4.297 20 0 HIADHN CCCN(CC(=O)Nc1ccc(C)cc1Br)[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000533293762 931831640 /nfs/dbraw/zinc/83/16/40/931831640.db2.gz SJAULWWSHKDOIS-NIKGAXFTSA-N 0 3 409.368 4.222 20 0 HIADHN Clc1ccc(OCCOc2ccc(CNCc3cnc4cnccn34)cc2)cc1 ZINC000533329871 931840274 /nfs/dbraw/zinc/84/02/74/931840274.db2.gz IOLUVEYIHBTNOP-UHFFFAOYSA-N 0 3 408.889 4.130 20 0 HIADHN Clc1ccc(OC[C@@H]2CCCO2)c(CNCCc2nnc(-c3ccccc3)o2)c1 ZINC000533361112 931848158 /nfs/dbraw/zinc/84/81/58/931848158.db2.gz JZAUFCSCPBTVNI-IBGZPJMESA-N 0 3 413.905 4.280 20 0 HIADHN COc1ccc([C@H]2CCCN2C(=O)CN[C@@H](c2ccccc2)C2CCC2)c(OC)c1 ZINC000533368339 931850435 /nfs/dbraw/zinc/85/04/35/931850435.db2.gz JFAMPJMIFFUFKU-RDGATRHJSA-N 0 3 408.542 4.498 20 0 HIADHN O[C@@H](COc1c(Cl)cccc1Cl)CN1CC=C(c2c[nH]c3ncccc23)CC1 ZINC000533480695 931879863 /nfs/dbraw/zinc/87/98/63/931879863.db2.gz GIPDXKXXRSSZDD-OAHLLOKOSA-N 0 3 418.324 4.399 20 0 HIADHN C[C@@H](NC(=O)[C@H](C)N[C@H](c1ccc(F)cc1)C1CCC1)c1ccc2c(c1)OCCO2 ZINC000533504091 931886827 /nfs/dbraw/zinc/88/68/27/931886827.db2.gz VHHHOSYLHYVTOD-SYJLOODJSA-N 0 3 412.505 4.294 20 0 HIADHN Cc1ccc([C@H](C)NC(=O)CNC2(c3ccc(Cl)cc3)CCOCC2)cc1C ZINC000533520371 931892446 /nfs/dbraw/zinc/89/24/46/931892446.db2.gz PZNKAHFVZLBJMZ-SFHVURJKSA-N 0 3 400.950 4.430 20 0 HIADHN CCOC(=O)c1oc2ccccc2c1CN1CCC[C@H](c2nnc3ccccn32)C1 ZINC000533538105 931897366 /nfs/dbraw/zinc/89/73/66/931897366.db2.gz KXKVZSUAXCZXKJ-INIZCTEOSA-N 0 3 404.470 4.032 20 0 HIADHN O=C1c2ccccc2C(=O)N1[C@H]1CCCC[C@H](NCc2ncoc2-c2ccccc2)C1 ZINC000533547665 931898203 /nfs/dbraw/zinc/89/82/03/931898203.db2.gz MUUBIFYNHPJVII-OALUTQOASA-N 0 3 415.493 4.429 20 0 HIADHN O=C1c2ccccc2C(=O)N1[C@@H]1CCCC[C@@H](NCc2ncoc2-c2ccccc2)C1 ZINC000533547667 931898308 /nfs/dbraw/zinc/89/83/08/931898308.db2.gz MUUBIFYNHPJVII-RTBURBONSA-N 0 3 415.493 4.429 20 0 HIADHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)Nc1cccc(-c2ncco2)c1 ZINC000533590561 931909758 /nfs/dbraw/zinc/90/97/58/931909758.db2.gz KZDZRTFRAZDFGE-UHFFFAOYSA-N 0 3 400.429 4.216 20 0 HIADHN Clc1cccc(-n2cc(CNCCCc3nc4ccccc4[nH]3)nn2)c1Cl ZINC000533625790 931932648 /nfs/dbraw/zinc/93/26/48/931932648.db2.gz SPDXYEOGJJDWEA-UHFFFAOYSA-N 0 3 401.301 4.173 20 0 HIADHN COc1cccc(NC(=O)[C@H](N[C@@H]2[C@@H]3CCO[C@H]3C23CCCC3)c2ccccc2)c1 ZINC000533635920 931937925 /nfs/dbraw/zinc/93/79/25/931937925.db2.gz QBABCULEWZLTCF-WBADGQHESA-N 0 3 406.526 4.312 20 0 HIADHN Cc1noc(C2CCC(NCc3cn(-c4cccc(Cl)c4Cl)nn3)CC2)n1 ZINC000533636553 931938073 /nfs/dbraw/zinc/93/80/73/931938073.db2.gz FJLPJYZGJFCZAM-UHFFFAOYSA-N 0 3 407.305 4.082 20 0 HIADHN Cc1cnc(CCN(C)C(=O)N[C@@H](CN2CCc3ccccc3C2)C(C)(C)C)s1 ZINC000533661708 931955070 /nfs/dbraw/zinc/95/50/70/931955070.db2.gz NRFNAXJRKBVMLG-FQEVSTJZSA-N 0 3 414.619 4.108 20 0 HIADHN CCc1ccc([C@H](NC(=O)CN2CC[C@@H](C3CCOCC3)C2)c2cccs2)cc1 ZINC000533670329 931960691 /nfs/dbraw/zinc/96/06/91/931960691.db2.gz LBUNOMNFVJKECM-QPPBQGQZSA-N 0 3 412.599 4.265 20 0 HIADHN Cc1nc2ccccc2n1C[C@@H]1CCCN1C(=O)c1ccc(Nc2ccncc2)cc1 ZINC000533750945 932008198 /nfs/dbraw/zinc/00/81/98/932008198.db2.gz APVAFEQKKQDYBM-QFIPXVFZSA-N 0 3 411.509 4.210 20 0 HIADHN COc1ccccc1[C@H](C)N(C)C(=O)CN1CCC[C@H]1Cn1c(C)nc2ccccc21 ZINC000533758175 932013887 /nfs/dbraw/zinc/01/38/87/932013887.db2.gz BONZTNVHNRSRIW-ICSRJNTNSA-N 0 3 420.557 4.037 20 0 HIADHN COc1cccc(COc2cccc(NC(=O)N3CC[C@H](N4CC=CC4)C3)c2C)c1 ZINC000533773600 932027354 /nfs/dbraw/zinc/02/73/54/932027354.db2.gz MSXGEUBODYGZGV-FQEVSTJZSA-N 0 3 407.514 4.061 20 0 HIADHN CN(C)[C@H](CNC(=O)Nc1nnc(C(C)(C)c2ccccc2)s1)Cc1ccccc1 ZINC000533812751 932043363 /nfs/dbraw/zinc/04/33/63/932043363.db2.gz LOZXNWUROAZVIW-IBGZPJMESA-N 0 3 423.586 4.158 20 0 HIADHN CC[C@](C)(COc1ncccc1Cl)NCC(=O)Nc1ccc(F)cc1Cl ZINC000533827283 932048758 /nfs/dbraw/zinc/04/87/58/932048758.db2.gz MEBHXUMECCRXCR-GOSISDBHSA-N 0 3 400.281 4.303 20 0 HIADHN CC(C)OCCN1CCC(NC(=O)N[C@@H](C)Cc2c(Cl)cccc2Cl)CC1 ZINC000533902534 932090358 /nfs/dbraw/zinc/09/03/58/932090358.db2.gz HLRZXCCFNJIOTA-HNNXBMFYSA-N 0 3 416.393 4.113 20 0 HIADHN CN(Cc1cccc(OC(F)(F)F)c1)C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000533944388 932117680 /nfs/dbraw/zinc/11/76/80/932117680.db2.gz KBZKWGAJJZPQSD-RTBURBONSA-N 0 3 407.436 4.172 20 0 HIADHN CC(C)CN(C(=O)c1cc(Br)cc2cccnc21)C1CCN(C)CC1 ZINC000533945763 932119253 /nfs/dbraw/zinc/11/92/53/932119253.db2.gz WOAIAGYWALNDGT-UHFFFAOYSA-N 0 3 404.352 4.190 20 0 HIADHN C[C@@H](Cc1c(Cl)cccc1Cl)NC(=O)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000534003561 932186345 /nfs/dbraw/zinc/18/63/45/932186345.db2.gz SYCRHJFGODCEOW-DOTOQJQBSA-N 0 3 406.357 4.348 20 0 HIADHN CCc1ccc(-c2nc(CC(=O)N[C@H]3CCN(C)[C@@H]3c3ccccc3)cs2)cc1 ZINC000534018515 932199775 /nfs/dbraw/zinc/19/97/75/932199775.db2.gz IZZAUPFPSYMEJL-JTHBVZDNSA-N 0 3 405.567 4.477 20 0 HIADHN CN1CC[C@@H](NC(=O)c2cccc(-n3nccc3C(F)(F)F)c2)[C@@H]1c1ccccc1 ZINC000534018416 932200354 /nfs/dbraw/zinc/20/03/54/932200354.db2.gz DENPDOCUBAGLAA-QUCCMNQESA-N 0 3 414.431 4.066 20 0 HIADHN CN1CC[C@@H](NC(=O)c2cccc(-n3ccc(C(F)(F)F)n3)c2)[C@@H]1c1ccccc1 ZINC000534019278 932201331 /nfs/dbraw/zinc/20/13/31/932201331.db2.gz OQTSAIVVRHQABZ-QUCCMNQESA-N 0 3 414.431 4.066 20 0 HIADHN COC(=O)[C@@H]1CCCC[C@]1(C)NCC(=O)Nc1c(Cl)cc(Cl)cc1Cl ZINC000534019451 932201662 /nfs/dbraw/zinc/20/16/62/932201662.db2.gz QWFKWJUZRMDIDZ-GTNSWQLSSA-N 0 3 407.725 4.297 20 0 HIADHN O=C(c1ccco1)N1CCC(N[C@H]2CCc3c2c(Br)ccc3F)CC1 ZINC000534060013 932238878 /nfs/dbraw/zinc/23/88/78/932238878.db2.gz VZAPLFLRYNEAGM-INIZCTEOSA-N 0 3 407.283 4.063 20 0 HIADHN O[C@@H]1C[C@H](CNCc2ccc(-c3nc4ccccc4s3)o2)N(Cc2ccccc2)C1 ZINC000534083637 932262616 /nfs/dbraw/zinc/26/26/16/932262616.db2.gz JZUZVJMZUBVIGH-RTBURBONSA-N 0 3 419.550 4.281 20 0 HIADHN COC1CCN(C(C)(C)CNC(=O)c2cc3ccccc3cc2OC(F)F)CC1 ZINC000534173820 932315439 /nfs/dbraw/zinc/31/54/39/932315439.db2.gz PSJZWEINIGVOAX-UHFFFAOYSA-N 0 3 406.473 4.060 20 0 HIADHN CN(C)CCN(Cc1cccc(O)c1)C(=O)Cc1coc2ccc3ccccc3c12 ZINC000534188783 932322079 /nfs/dbraw/zinc/32/20/79/932322079.db2.gz QYQCZAODBBPRGE-UHFFFAOYSA-N 0 3 402.494 4.425 20 0 HIADHN Cc1cc(-c2ccccc2)ccc1NC(=O)N1CC[C@H](N2CCN(C)CC2)[C@@H](C)C1 ZINC000534266143 932372327 /nfs/dbraw/zinc/37/23/27/932372327.db2.gz JZZVMQZMMVDZLH-RDPSFJRHSA-N 0 3 406.574 4.152 20 0 HIADHN C[C@@H]1CN(C(=O)Nc2ccc3oc4ccccc4c3c2)CC[C@@H]1N1CCN(C)CC1 ZINC000534269701 932373235 /nfs/dbraw/zinc/37/32/35/932373235.db2.gz YRKLVACDVALKPG-UTKZUKDTSA-N 0 3 406.530 4.076 20 0 HIADHN C[C@@H]1CN(C(=O)Nc2ccc3oc4ccccc4c3c2)CC[C@H]1N1CCN(C)CC1 ZINC000534269693 932373486 /nfs/dbraw/zinc/37/34/86/932373486.db2.gz YRKLVACDVALKPG-DYESRHJHSA-N 0 3 406.530 4.076 20 0 HIADHN O=C(CN[C@H](C[C@H]1CCOC1)c1ccccc1)Nc1ccc(Br)cc1 ZINC000534351753 932389290 /nfs/dbraw/zinc/38/92/90/932389290.db2.gz DXZOAQYPHBZMJJ-DNVCBOLYSA-N 0 3 403.320 4.145 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)Nc3cccnc3-c3ccccc3)CC2)C[C@@H](C)O1 ZINC000534376383 932404726 /nfs/dbraw/zinc/40/47/26/932404726.db2.gz DNGCFMXSIRHKKT-RTBURBONSA-N 0 3 408.546 4.102 20 0 HIADHN COc1ccc(C)cc1NC(=O)[C@@H](c1ccccc1)N1CC[C@H](C2CCOCC2)C1 ZINC000534381742 932408887 /nfs/dbraw/zinc/40/88/87/932408887.db2.gz CWDJUYLVAKQJAS-XUZZJYLKSA-N 0 3 408.542 4.432 20 0 HIADHN CC[C@H](NCc1nc2cc(Cl)ccc2n1C)[C@@H](c1ccc(C)cc1)n1cncn1 ZINC000534453874 932468552 /nfs/dbraw/zinc/46/85/52/932468552.db2.gz UKVUQMBQCSNAOA-PGRDOPGGSA-N 0 3 408.937 4.284 20 0 HIADHN CC(=O)N1CC[C@@H](NCc2ccc(-n3ccc(C(F)(F)F)n3)cc2)c2ccccc21 ZINC000534511386 932539767 /nfs/dbraw/zinc/53/97/67/932539767.db2.gz WSDCYQNYXHJOKB-LJQANCHMSA-N 0 3 414.431 4.479 20 0 HIADHN Cc1[nH]c2ccccc2c1C1=CCN(C(=O)NC[C@H](Cc2ccccc2)N(C)C)CC1 ZINC000534524951 932545983 /nfs/dbraw/zinc/54/59/83/932545983.db2.gz PNGOLENLVFGHLX-QFIPXVFZSA-N 0 3 416.569 4.448 20 0 HIADHN O=C(Nc1ccccc1)c1cccc(CN2CCC[C@H](c3nncn3C3CC3)C2)c1 ZINC000534537695 932551081 /nfs/dbraw/zinc/55/10/81/932551081.db2.gz LNPUIGOXDZWODO-FQEVSTJZSA-N 0 3 401.514 4.245 20 0 HIADHN O=C(Nc1ccc2[nH]c(-c3ccccc3Cl)nc2c1)[C@@H]1CCCN1C1CCOCC1 ZINC000534702240 932673886 /nfs/dbraw/zinc/67/38/86/932673886.db2.gz OGXZHKAVJBORFO-NRFANRHFSA-N 0 3 424.932 4.465 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)C[C@H]2Sc3ccc(Cl)cc3NC2=O)c1 ZINC000534703737 932675321 /nfs/dbraw/zinc/67/53/21/932675321.db2.gz BLGJPGWPQOMETK-GOSISDBHSA-N 0 3 403.935 4.152 20 0 HIADHN C[C@H](c1ccncc1)N1CCC(NC(=O)CCn2ccc3cc(Cl)ccc32)CC1 ZINC000534717577 932685870 /nfs/dbraw/zinc/68/58/70/932685870.db2.gz ZAUVPDZSWDXLPC-QGZVFWFLSA-N 0 3 410.949 4.422 20 0 HIADHN COc1ccc(CN(C(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)[C@H](C)C2CC2)cc1 ZINC000534719575 932687394 /nfs/dbraw/zinc/68/73/94/932687394.db2.gz AEQFBVGJXVSWCY-QFWMQHCXSA-N 0 3 407.558 4.451 20 0 HIADHN CN1CC[C@H](NC(=O)N2CCn3cccc3[C@H]2c2ccccc2)[C@H]1c1ccccc1 ZINC000534721027 932688609 /nfs/dbraw/zinc/68/86/09/932688609.db2.gz ITTJXYBGNXTISH-QPTUXGOLSA-N 0 3 400.526 4.048 20 0 HIADHN Cc1nc(C)n(-c2ccccc2NC(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)n1 ZINC000534742452 932714088 /nfs/dbraw/zinc/71/40/88/932714088.db2.gz WTWUXCURQXJVTE-OAQYLSRUSA-N 0 3 418.545 4.012 20 0 HIADHN Cc1ccc(OCc2nc(CC(=O)N[C@H]3CCN(C)[C@@H]3c3ccccc3)cs2)cc1 ZINC000534756009 932734039 /nfs/dbraw/zinc/73/40/39/932734039.db2.gz GZQLKAUGXUJCBS-XUZZJYLKSA-N 0 3 421.566 4.135 20 0 HIADHN Cc1cc(NC(=O)NC2CCC(F)(F)CC2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000534896216 932827527 /nfs/dbraw/zinc/82/75/27/932827527.db2.gz QRXAHVPCLBBXJM-LJQANCHMSA-N 0 3 417.504 4.338 20 0 HIADHN Cc1nn(C)c2ncc(CN3CCCN(Cc4ccc(C(F)(F)F)cc4)CC3)cc12 ZINC000535068811 932896830 /nfs/dbraw/zinc/89/68/30/932896830.db2.gz AZFCIMXYZOARFK-UHFFFAOYSA-N 0 3 417.479 4.003 20 0 HIADHN CCOC(=O)c1c2c(sc1NC(=O)[C@@H](C)C1CCOCC1)C(C)(C)NC(C)(C)C2 ZINC000535169193 932985610 /nfs/dbraw/zinc/98/56/10/932985610.db2.gz XFQJMXOZNVXRSN-ZDUSSCGKSA-N 0 3 422.591 4.085 20 0 HIADHN Cc1ccc(CNCc2ccccc2CS(=O)(=O)N2CCC(C)CC2)c(C)c1 ZINC000535203792 933011626 /nfs/dbraw/zinc/01/16/26/933011626.db2.gz ZUMUIPNFTDHBHF-UHFFFAOYSA-N 0 3 400.588 4.155 20 0 HIADHN CN1CC[C@@H](NC(=O)NCc2cc(Cl)ccc2OC(F)F)[C@H]1c1ccccc1 ZINC000535358932 933091163 /nfs/dbraw/zinc/09/11/63/933091163.db2.gz WMRIPQUNUDWAQU-SJLPKXTDSA-N 0 3 409.864 4.186 20 0 HIADHN COCCSc1ccc([C@H](C)NC(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)cc1 ZINC000535364783 933094239 /nfs/dbraw/zinc/09/42/39/933094239.db2.gz MQKXMIUTTXPJGT-BULFRSBZSA-N 0 3 413.587 4.231 20 0 HIADHN CCN(C(=O)c1ccnc(OCC(F)F)c1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000535368177 933096264 /nfs/dbraw/zinc/09/62/64/933096264.db2.gz UJQSTZCKQOHQDP-VQIMIIECSA-N 0 3 403.473 4.023 20 0 HIADHN COc1ccccc1[C@H](NC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1)c1ccco1 ZINC000535429502 933130981 /nfs/dbraw/zinc/13/09/81/933130981.db2.gz HJLXWKYOFGDCRZ-OIBXWCBGSA-N 0 3 405.498 4.122 20 0 HIADHN CN1CC[C@H](NC(=O)NCc2ccc(Oc3ccccc3)nc2)[C@@H]1c1ccccc1 ZINC000535438885 933136233 /nfs/dbraw/zinc/13/62/33/933136233.db2.gz XSVYIOIVBUDBBE-GMAHTHKFSA-N 0 3 402.498 4.119 20 0 HIADHN CC(C)Cn1ncc(C(=O)N(C)C2CCN(Cc3ccccc3)CC2)c1C(F)F ZINC000535444576 933139607 /nfs/dbraw/zinc/13/96/07/933139607.db2.gz BEGJVQNTQHXHGW-UHFFFAOYSA-N 0 3 404.505 4.213 20 0 HIADHN CN1CC[C@@H](NC(=O)CCc2ncc(-c3ccc(F)cc3F)o2)[C@@H]1c1ccccc1 ZINC000535468045 933157890 /nfs/dbraw/zinc/15/78/90/933157890.db2.gz GXPROADWYIYFMX-XXBNENTESA-N 0 3 411.452 4.114 20 0 HIADHN Cc1ncc(-c2ccccc2)cc1NC(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000535538079 933231520 /nfs/dbraw/zinc/23/15/20/933231520.db2.gz LJYCQYMJRPTURD-KDURUIRLSA-N 0 3 422.573 4.410 20 0 HIADHN CCN(CC)CCN(Cc1cccs1)Cc1nc(=O)c2c(C)c(C)sc2[nH]1 ZINC000535556368 933241257 /nfs/dbraw/zinc/24/12/57/933241257.db2.gz SSIKINHRCFMSOY-UHFFFAOYSA-N 0 3 404.605 4.419 20 0 HIADHN CCN(Cc1ccncc1)C[C@@H](O)COC(c1ccc(F)cc1)c1ccc(F)cc1 ZINC000535763994 933379272 /nfs/dbraw/zinc/37/92/72/933379272.db2.gz GCVCLUGHRCMYDN-HSZRJFAPSA-N 0 3 412.480 4.349 20 0 HIADHN CO[C@@H](C)c1noc(CN2CCCN(Cc3cccc(-c4ccccc4C)c3)CC2)n1 ZINC000535798534 933394025 /nfs/dbraw/zinc/39/40/25/933394025.db2.gz NCNTZOOODSRCSI-FQEVSTJZSA-N 0 3 420.557 4.460 20 0 HIADHN Cc1c(C(=O)Nc2cccc(CN3CCC(O)CC3)c2)cccc1-c1ccccn1 ZINC000535854747 933438124 /nfs/dbraw/zinc/43/81/24/933438124.db2.gz LVQAQTVPNJPPGX-UHFFFAOYSA-N 0 3 401.510 4.266 20 0 HIADHN CC(C)(C)[C@H](CN1CCc2ccccc2C1)NC(=O)c1csc([C@@H]2CCCO2)n1 ZINC000535879447 933461192 /nfs/dbraw/zinc/46/11/92/933461192.db2.gz GPUJGKKCVJHMDS-PMACEKPBSA-N 0 3 413.587 4.197 20 0 HIADHN Cc1ccc(Br)cc1NC(=O)CCNCc1cnc([C@H]2CCCO2)s1 ZINC000535945842 933512360 /nfs/dbraw/zinc/51/23/60/933512360.db2.gz VNMRDWPCOFHANN-MRXNPFEDSA-N 0 3 424.364 4.184 20 0 HIADHN Cc1nc(-c2ccc(CNC(=O)NC[C@H](Cc3ccccc3)N(C)C)cc2)cs1 ZINC000536015017 933573096 /nfs/dbraw/zinc/57/30/96/933573096.db2.gz NZALPFDREOCCSG-NRFANRHFSA-N 0 3 408.571 4.091 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)c2cc(F)ccc2Br)cc1 ZINC000536093955 933644613 /nfs/dbraw/zinc/64/46/13/933644613.db2.gz BSJBVOCTIWTDJZ-LJQANCHMSA-N 0 3 421.310 4.164 20 0 HIADHN C[C@@H]1CN(CC2CCN(C(=O)c3ccc(OC4CCC4)cc3Cl)CC2)C[C@H](C)O1 ZINC000536108293 933660127 /nfs/dbraw/zinc/66/01/27/933660127.db2.gz LTFNFGLKHKDARF-CALCHBBNSA-N 0 3 420.981 4.233 20 0 HIADHN CN(C(=O)CN[C@@H](c1ccc2c(c1)OCCO2)C1CC1)[C@H]1CCCc2ccccc21 ZINC000537288185 933698773 /nfs/dbraw/zinc/69/87/73/933698773.db2.gz MDWIGIUIFNXSIY-SQJMNOBHSA-N 0 3 406.526 4.035 20 0 HIADHN COc1sc(CN[C@@H](C)[C@@H](OC)c2ccc(OC)cc2)cc1Br ZINC000537344819 933726778 /nfs/dbraw/zinc/72/67/78/933726778.db2.gz SHMRWUQEXTZGTE-MEDUHNTESA-N 0 3 400.338 4.394 20 0 HIADHN CCN1CC[C@@H](NCc2c(C)nc3sc(C)nn23)[C@H]1c1ccc(Cl)c(F)c1 ZINC000537353165 933731662 /nfs/dbraw/zinc/73/16/62/933731662.db2.gz ZXODFMFWNFWNAC-SJLPKXTDSA-N 0 3 407.946 4.125 20 0 HIADHN CCN1CCN(c2ccc(N[C@@H](C)c3cc(OC)c(OC)c(OC)c3)c(C)c2)CC1 ZINC000537407274 933761744 /nfs/dbraw/zinc/76/17/44/933761744.db2.gz JNPBMHVWUUDESD-SFHVURJKSA-N 0 3 413.562 4.336 20 0 HIADHN CC(C)N1CC[C@H](NC(=O)N[C@@H]2CCCc3cn[nH]c32)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000537453966 933780022 /nfs/dbraw/zinc/78/00/22/933780022.db2.gz HMTPPWVECDRUCJ-HBFSDRIKSA-N 0 3 419.932 4.103 20 0 HIADHN CCNC(=O)[C@@H](C)N[C@@H]1CCCc2nc(-c3ccccc3Br)sc21 ZINC000537519875 933799029 /nfs/dbraw/zinc/79/90/29/933799029.db2.gz KFXGZZVRBOJKBU-BXUZGUMPSA-N 0 3 408.365 4.064 20 0 HIADHN CN(CCCN(C)C(=O)[C@H]1C[C@H]1c1cc(Cl)cc(Cl)c1)Cc1ccncc1 ZINC000562857279 945128173 /nfs/dbraw/zinc/12/81/73/945128173.db2.gz OCAXNQGJIFXARP-PMACEKPBSA-N 0 3 406.357 4.472 20 0 HIADHN Cc1ccc(C(=O)Nc2cccc(CNC(=O)c3ccccc3CN(C)C)c2)cc1 ZINC000562925553 945152943 /nfs/dbraw/zinc/15/29/43/945152943.db2.gz DHKZIVNDTOFWFZ-UHFFFAOYSA-N 0 3 401.510 4.239 20 0 HIADHN CCOc1c(CN(CC)CC2CCN(c3ccccn3)CC2)c(C)nn1CC(C)C ZINC000537617685 938334733 /nfs/dbraw/zinc/33/47/33/938334733.db2.gz CKBSMHHEPYHMTC-UHFFFAOYSA-N 0 3 413.610 4.380 20 0 HIADHN FC(F)(F)Oc1cccc(CN2CCC(n3cc(Br)cn3)CC2)c1 ZINC000537627200 938339483 /nfs/dbraw/zinc/33/94/83/938339483.db2.gz QGBCPNPOQXNDBH-UHFFFAOYSA-N 0 3 404.230 4.381 20 0 HIADHN Brc1ccc(OCc2ccccn2)c(CN2CC[C@H]([C@H]3CCOC3)C2)c1 ZINC000537648008 938345777 /nfs/dbraw/zinc/34/57/77/938345777.db2.gz FZEVRYGKQQQFTQ-IRXDYDNUSA-N 0 3 417.347 4.282 20 0 HIADHN COc1cc(CN2CCc3cc(OC)c(OC)c(OC)c3CC2)ccc1OC(C)C ZINC000537660784 938349116 /nfs/dbraw/zinc/34/91/16/938349116.db2.gz IZAFYVJAHMLKJB-UHFFFAOYSA-N 0 3 415.530 4.109 20 0 HIADHN COCc1cccc(OCC2(CN(C)[C@@H](C)c3ccc([S@@](C)=O)cc3)CC2)c1 ZINC000537677763 938351871 /nfs/dbraw/zinc/35/18/71/938351871.db2.gz NFHBPDQONPUVRH-XDBZFTIUSA-N 0 3 401.572 4.422 20 0 HIADHN COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@H](C)Oc2ccccc2Cl)cc1 ZINC000537731301 938364866 /nfs/dbraw/zinc/36/48/66/938364866.db2.gz TUJGFKOUDGIWLG-OXJNMPFZSA-N 0 3 402.922 4.069 20 0 HIADHN COc1ccc(C[C@H](NCc2cccnc2-n2cccn2)c2ccc(OC)cc2)cc1 ZINC000537764102 938372388 /nfs/dbraw/zinc/37/23/88/938372388.db2.gz MKADVZYTOPFVPQ-DEOSSOPVSA-N 0 3 414.509 4.358 20 0 HIADHN C[C@@H](N[C@H]1CCN(c2cnn(C)c2)C1=O)c1ccc(-c2ccc(Cl)cc2)s1 ZINC000537774092 938373918 /nfs/dbraw/zinc/37/39/18/938373918.db2.gz LNTBCAFYMZRURK-DYVFJYSZSA-N 0 3 400.935 4.258 20 0 HIADHN C[C@H](NC(=O)N1CCO[C@@H](CN(C)C)C1)c1ccc(-c2ccc(Cl)cc2)s1 ZINC000537814607 938383316 /nfs/dbraw/zinc/38/33/16/938383316.db2.gz FGCUPTNCEFKVQO-YOEHRIQHSA-N 0 3 407.967 4.102 20 0 HIADHN O=C(CCC(F)(F)F)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1 ZINC000537815445 938383446 /nfs/dbraw/zinc/38/34/46/938383446.db2.gz JDZMKRAXNPMCAZ-UHFFFAOYSA-N 0 3 405.464 4.332 20 0 HIADHN O=S(=O)(c1ccc(CN[C@H]2CCSc3ccccc32)cc1)N1CCCCC1 ZINC000537918277 938412773 /nfs/dbraw/zinc/41/27/73/938412773.db2.gz IYDLHROAEBCZFK-FQEVSTJZSA-N 0 3 402.585 4.188 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(I)cc1)c1ccc([S@](C)=O)cc1 ZINC000537939224 938424490 /nfs/dbraw/zinc/42/44/90/938424490.db2.gz IIHBKOHHHVQNPQ-QRQYBIJMSA-N 0 3 413.324 4.440 20 0 HIADHN COCCOc1ccc([C@@H](C)NCc2cc(Br)c3c(c2)OCCO3)cc1 ZINC000537940238 938425782 /nfs/dbraw/zinc/42/57/82/938425782.db2.gz BIZDPRSWRUGZDQ-CQSZACIVSA-N 0 3 422.319 4.096 20 0 HIADHN Cc1cccc(NC(=O)C[C@H](C)N[C@@H](c2ccc(Cl)cc2)[C@@H]2CN(C)CCO2)c1 ZINC000537943242 938426046 /nfs/dbraw/zinc/42/60/46/938426046.db2.gz HIVTWFPZUKRAJG-HYVJGQCMSA-N 0 3 415.965 4.027 20 0 HIADHN C[C@H](NC[C@H]1CCCN(c2nccn3cnnc23)C1)c1cc(Cl)sc1Cl ZINC000537959437 938434593 /nfs/dbraw/zinc/43/45/93/938434593.db2.gz GVWIZCOASNIVAV-NWDGAFQWSA-N 0 3 411.362 4.060 20 0 HIADHN C[C@H](NCCc1nc2cc(F)ccc2n1C)c1ccccc1I ZINC000537968544 938439968 /nfs/dbraw/zinc/43/99/68/938439968.db2.gz LMOVOODQESWCQO-LBPRGKRZSA-N 0 3 423.273 4.210 20 0 HIADHN Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)NCc1cccc(NS(C)(=O)=O)c1 ZINC000537973127 938441212 /nfs/dbraw/zinc/44/12/12/938441212.db2.gz VMTWAMUYGBQCDM-CYBMUJFWSA-N 0 3 419.547 4.480 20 0 HIADHN COc1cc(F)c([C@H](C)NC[C@@H](c2cccc(Cl)c2)N2CCOCC2)cc1OC ZINC000537976619 938444499 /nfs/dbraw/zinc/44/44/99/938444499.db2.gz DHECJTDGADISHC-YWZLYKJASA-N 0 3 422.928 4.220 20 0 HIADHN COC[C@@H](N[C@H](C)CC(=O)Nc1cccc(Br)c1)c1ccc(F)cc1 ZINC000537986752 938450044 /nfs/dbraw/zinc/45/00/44/938450044.db2.gz JZBKIRHVKLPYRR-FZKQIMNGSA-N 0 3 409.299 4.283 20 0 HIADHN CCC[C@H](NCc1ccc(OCC(=O)N(C)C)c(OC)c1)c1ccc(Cl)cc1 ZINC000537990952 938452346 /nfs/dbraw/zinc/45/23/46/938452346.db2.gz NLZNHFPJHNOJLD-IBGZPJMESA-N 0 3 404.938 4.447 20 0 HIADHN CCCCn1cc(CNC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)c(C)n1 ZINC000537998010 938457022 /nfs/dbraw/zinc/45/70/22/938457022.db2.gz MSBJADQDOMTVGY-OAQYLSRUSA-N 0 3 422.495 4.062 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)c1c[nH]c2cccc(Br)c12 ZINC000538007355 938459454 /nfs/dbraw/zinc/45/94/54/938459454.db2.gz DWOILVYWKCGQPB-UHFFFAOYSA-N 0 3 402.292 4.253 20 0 HIADHN Fc1ccc(-c2nc(CN[C@H]3CCCOc4cc(Br)ccc43)n[nH]2)cc1 ZINC000538020178 938465257 /nfs/dbraw/zinc/46/52/57/938465257.db2.gz BDUCRDFOAINPRT-INIZCTEOSA-N 0 3 417.282 4.377 20 0 HIADHN CNS(=O)(=O)c1cccc(CN[C@@H](c2cccc(C(F)(F)F)c2)C(C)C)c1 ZINC000538060920 938490808 /nfs/dbraw/zinc/49/08/08/938490808.db2.gz ZCGATSBDPXFIDK-GOSISDBHSA-N 0 3 400.466 4.100 20 0 HIADHN COc1ccccc1[C@H](NCc1cccc(OCCN2CCOCC2)c1)C1CCCC1 ZINC000538101548 938502899 /nfs/dbraw/zinc/50/28/99/938502899.db2.gz VYWCCZIRUDWQKM-AREMUKBSSA-N 0 3 424.585 4.427 20 0 HIADHN CCCCn1cc(CN[C@H](C)CC(=O)Nc2ccc(Br)cc2)c(C)n1 ZINC000538116831 938507036 /nfs/dbraw/zinc/50/70/36/938507036.db2.gz ONBMRCGQOVOXQG-CQSZACIVSA-N 0 3 407.356 4.261 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)N(C)Cc1ccccc1)c1ccc(OCc2cccnc2)cc1 ZINC000538124810 938511199 /nfs/dbraw/zinc/51/11/99/938511199.db2.gz NYAXQGQSZVZSII-UXHICEINSA-N 0 3 403.526 4.358 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@@H](C)N[C@H](C)c2cccc(OC(C)C)c2)cc1F ZINC000538126365 938512486 /nfs/dbraw/zinc/51/24/86/938512486.db2.gz KSBHTLDIIGKMPJ-IAGOWNOFSA-N 0 3 402.510 4.319 20 0 HIADHN CC[C@@H](N[C@@H](C)C(=O)Nc1cc(NC(C)=O)ccc1OC)c1cccc(Cl)c1 ZINC000538128893 938513461 /nfs/dbraw/zinc/51/34/61/938513461.db2.gz PHAKEUJAEDUIGE-SCLBCKFNSA-N 0 3 403.910 4.375 20 0 HIADHN COc1ccc([C@H](NCC(=O)Nc2cc(C)ccc2-c2n[nH]c(C)n2)C(C)C)cc1 ZINC000538143261 938518881 /nfs/dbraw/zinc/51/88/81/938518881.db2.gz IMGLHHRISFBTML-JOCHJYFZSA-N 0 3 407.518 4.023 20 0 HIADHN CC[C@H](NCC(=O)N1c2ccccc2NC(=O)C[C@@H]1C(F)(F)F)c1ccc(C)cc1 ZINC000538155052 938526078 /nfs/dbraw/zinc/52/60/78/938526078.db2.gz IVJAYXXNKWGLSZ-QFBILLFUSA-N 0 3 419.447 4.342 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(OCC(F)(F)F)cc1)C(=O)NC(=O)Nc1ccccc1 ZINC000538163008 938530758 /nfs/dbraw/zinc/53/07/58/938530758.db2.gz HYJVXAILHLHZQE-ZIAGYGMSSA-N 0 3 409.408 4.015 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)NCCc1ccc(F)cc1)c1ccc(OCC(F)(F)F)cc1 ZINC000538164818 938531848 /nfs/dbraw/zinc/53/18/48/938531848.db2.gz XMMPOSOHFNBQKX-CABCVRRESA-N 0 3 412.427 4.165 20 0 HIADHN O=C(CN[C@H](c1ccccc1)[C@@H]1CCOC1)Nc1nc(-c2ccc(F)cc2)cs1 ZINC000538187465 938543537 /nfs/dbraw/zinc/54/35/37/938543537.db2.gz HVJIKYNJVYECEJ-DYESRHJHSA-N 0 3 411.502 4.255 20 0 HIADHN CC(C)(C)c1ccc(S(=O)(=O)CCN[C@@H](c2ccccc2)[C@H]2CCOC2)cc1 ZINC000538191263 938546548 /nfs/dbraw/zinc/54/65/48/938546548.db2.gz ROPMUDHOJJFACO-UGKGYDQZSA-N 0 3 401.572 4.125 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(NC(=O)c2ccncc2)cc1)C(=O)NCC1CCCCC1 ZINC000538195467 938548616 /nfs/dbraw/zinc/54/86/16/938548616.db2.gz UMUYYVRFRAYONE-ROUUACIJSA-N 0 3 408.546 4.070 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)N(C)Cc1ccccc1)c1ccc(NC(=O)c2ccncc2)cc1 ZINC000538194795 938548869 /nfs/dbraw/zinc/54/88/69/938548869.db2.gz LQCFEEQOUPHANB-MOPGFXCFSA-N 0 3 416.525 4.032 20 0 HIADHN C[C@@H](N[C@@H](C)c1ccc(NC(=O)c2ccncc2)cc1)C(=O)NCC1CCCCC1 ZINC000538195472 938548924 /nfs/dbraw/zinc/54/89/24/938548924.db2.gz UMUYYVRFRAYONE-ZWKOTPCHSA-N 0 3 408.546 4.070 20 0 HIADHN COc1cc(F)c([C@@H](C)NC[C@@H](O)Cc2ccccc2C(F)(F)F)cc1OC ZINC000538198466 938551117 /nfs/dbraw/zinc/55/11/17/938551117.db2.gz SIDUUFVYGVJPIV-OCCSQVGLSA-N 0 3 401.400 4.116 20 0 HIADHN CSc1cccc(NC(=O)NCCCN2CCN(Cc3ccccc3)CC2)c1C ZINC000538211236 938557856 /nfs/dbraw/zinc/55/78/56/938557856.db2.gz FJOMADWWTYMIIS-UHFFFAOYSA-N 0 3 412.603 4.046 20 0 HIADHN COc1cc(Cl)c(C)cc1NC(=O)CN[C@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000538225785 938565006 /nfs/dbraw/zinc/56/50/06/938565006.db2.gz WLMQNZOMDIFXLY-QFBILLFUSA-N 0 3 402.922 4.353 20 0 HIADHN COc1cc(NC(=O)CN[C@H](c2cccc(F)c2)C2CCCC2)cc(OC)c1OC ZINC000538232350 938567093 /nfs/dbraw/zinc/56/70/93/938567093.db2.gz ALFWQHOQMVWKGA-QFIPXVFZSA-N 0 3 416.493 4.311 20 0 HIADHN Cc1cc(NC(=O)CN[C@H](c2cccc(C)c2)C(C)(C)C)n(-c2nc(C)cc(C)n2)n1 ZINC000538234920 938568363 /nfs/dbraw/zinc/56/83/63/938568363.db2.gz MBRTWSLYDRVJSF-JOCHJYFZSA-N 0 3 420.561 4.211 20 0 HIADHN Cc1ccc(NC(=O)CN[C@@H](C[C@@H]2CCOC2)c2ccccc2)c(Br)c1 ZINC000538234604 938568430 /nfs/dbraw/zinc/56/84/30/938568430.db2.gz UBPMZUCIGJEGHX-JXFKEZNVSA-N 0 3 417.347 4.454 20 0 HIADHN Cc1cccc([C@H](NCC(=O)N2CCC(C(=O)NCCC(C)C)CC2)C(C)(C)C)c1 ZINC000538235538 938568513 /nfs/dbraw/zinc/56/85/13/938568513.db2.gz YJIUTFIKMZRKPL-QHCPKHFHSA-N 0 3 415.622 4.073 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)Nc1ccc2c(c1)OCCCO2)c1cccc(N2CCCC2)c1 ZINC000538279139 938582163 /nfs/dbraw/zinc/58/21/63/938582163.db2.gz KBUYTQHGJCSRDQ-MSOLQXFVSA-N 0 3 409.530 4.126 20 0 HIADHN C[C@H](CS(=O)(=O)c1ccccc1)NCc1ccccc1CN1CCCCCC1 ZINC000538294731 938585452 /nfs/dbraw/zinc/58/54/52/938585452.db2.gz XDOQWBCSPLZXJR-HXUWFJFHSA-N 0 3 400.588 4.015 20 0 HIADHN CN1CCC(N(Cc2ccco2)C(=O)c2ccc(-c3noc(C(F)F)n3)cc2)CC1 ZINC000538323364 938592573 /nfs/dbraw/zinc/59/25/73/938592573.db2.gz MOZZWHVHBFKFDW-UHFFFAOYSA-N 0 3 416.428 4.004 20 0 HIADHN COc1ccc(CCNC(=O)CN[C@H](c2ccc(Cl)cc2)[C@H]2C[C@H]2C)cc1OC ZINC000538324633 938593052 /nfs/dbraw/zinc/59/30/52/938593052.db2.gz BCHWAQNBLHBQCV-BIFSNJIPSA-N 0 3 416.949 4.003 20 0 HIADHN CC[C@@H](NCc1cccc(OCC(=O)N(C)C)c1)c1cc(F)cc(Br)c1 ZINC000538398149 938611393 /nfs/dbraw/zinc/61/13/93/938611393.db2.gz KVTDUYMSOWOAEO-LJQANCHMSA-N 0 3 423.326 4.296 20 0 HIADHN O=C1[C@@H](NCc2cccc3[nH]ccc32)CCCN1Cc1cccc(C(F)(F)F)c1 ZINC000538534043 938643446 /nfs/dbraw/zinc/64/34/46/938643446.db2.gz MFIZGUGHOFHMIS-FQEVSTJZSA-N 0 3 401.432 4.468 20 0 HIADHN CN(Cc1cc(F)c(F)c(F)c1)C(=O)NCC(C)(C)N1CCc2ccccc2C1 ZINC000538630057 938666931 /nfs/dbraw/zinc/66/69/31/938666931.db2.gz XHXHTAFXPPDNMI-UHFFFAOYSA-N 0 3 405.464 4.082 20 0 HIADHN CCOC(=O)c1c2c(sc1NC(=O)[C@@H](C)CCCOC)C(C)(C)NC(C)(C)C2 ZINC000538688245 938684382 /nfs/dbraw/zinc/68/43/82/938684382.db2.gz HQVSKSWJZNZAKF-ZDUSSCGKSA-N 0 3 410.580 4.085 20 0 HIADHN CC[C@H](C)n1nc(C(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)cc1C ZINC000538690741 938684656 /nfs/dbraw/zinc/68/46/56/938684656.db2.gz HIDUKWLQSLNZLB-HNNXBMFYSA-N 0 3 410.484 4.385 20 0 HIADHN O=C1CCCN1[C@H]1CCCN(Cc2cn(Cc3ccccc3)nc2-c2ccccc2)C1 ZINC000538733289 938695836 /nfs/dbraw/zinc/69/58/36/938695836.db2.gz FLSLRFVGELNFSP-DEOSSOPVSA-N 0 3 414.553 4.185 20 0 HIADHN O=C1NCCCN1C1CCN(Cc2ccc(-c3ccc(Br)cc3)o2)CC1 ZINC000538734444 938696482 /nfs/dbraw/zinc/69/64/82/938696482.db2.gz BASBBKXXXHEPDL-UHFFFAOYSA-N 0 3 418.335 4.089 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)[C@@H]1C[C@@H](C)O[C@@H](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000538744613 938699557 /nfs/dbraw/zinc/69/95/57/938699557.db2.gz FBVFZSYXCBIMIA-HIRMHNASSA-N 0 3 400.485 4.408 20 0 HIADHN CC(C)[C@](C)(CO)NCC(=O)Nc1nc(-c2ccc(Cl)cc2Cl)cs1 ZINC000563484216 945200740 /nfs/dbraw/zinc/20/07/40/945200740.db2.gz VNMKLRUWYZZZIM-KRWDZBQOSA-N 0 3 402.347 4.052 20 0 HIADHN CCCCCOc1ccc([C@H](C)NCc2ccc(S(=O)(=O)N(C)C)cc2)cc1 ZINC000539019097 938770449 /nfs/dbraw/zinc/77/04/49/938770449.db2.gz GOOFQFGQPBFLHQ-SFHVURJKSA-N 0 3 404.576 4.357 20 0 HIADHN CCc1nc2c(s1)[C@H](NCc1cc(Br)c3c(c1)OCCO3)CCC2 ZINC000539039817 938778292 /nfs/dbraw/zinc/77/82/92/938778292.db2.gz DVYKGWAKECDGFD-CYBMUJFWSA-N 0 3 409.349 4.406 20 0 HIADHN CCc1ccc([C@@H](CO)N[C@H](C)CC(=O)Nc2cccc(Br)c2)cc1 ZINC000539040082 938778333 /nfs/dbraw/zinc/77/83/33/938778333.db2.gz CDCYOPMFFAFGFG-AUUYWEPGSA-N 0 3 405.336 4.052 20 0 HIADHN COc1ccc([C@@H](NC2CCN(Cc3ccccn3)CC2)c2ccccc2OC)cc1 ZINC000539041739 938778656 /nfs/dbraw/zinc/77/86/56/938778656.db2.gz QFLCOZFTXZQDDJ-AREMUKBSSA-N 0 3 417.553 4.442 20 0 HIADHN Cc1c([C@@H](C)N[C@@H](C)Cn2ncc3ccccc3c2=O)cnn1-c1cccc(Cl)c1 ZINC000539044991 938781148 /nfs/dbraw/zinc/78/11/48/938781148.db2.gz XMGDJLLESGBBTL-JKSUJKDBSA-N 0 3 421.932 4.283 20 0 HIADHN CC1CCN(S(=O)(=O)Cc2ccccc2CN[C@@H]2CCCc3sccc32)CC1 ZINC000539052662 938783825 /nfs/dbraw/zinc/78/38/25/938783825.db2.gz KCAADYYDFFWYCX-OAQYLSRUSA-N 0 3 418.628 4.477 20 0 HIADHN Cc1ccc2c(c1)[C@@H](NCc1ccccc1CS(=O)(=O)N1CCC(C)CC1)CC2 ZINC000539054903 938785093 /nfs/dbraw/zinc/78/50/93/938785093.db2.gz WLOCESLTZQFPMP-DEOSSOPVSA-N 0 3 412.599 4.334 20 0 HIADHN C[C@H](CC(=O)N(C)Cc1cccc(Cl)c1)NCc1cccc2c1OCCCO2 ZINC000539057621 938786247 /nfs/dbraw/zinc/78/62/47/938786247.db2.gz CTSBQKSXKJYXPX-MRXNPFEDSA-N 0 3 402.922 4.028 20 0 HIADHN Fc1ccc2c(c1)CC[C@@H]2NCc1ccc(Br)cc1N1CCOCC1 ZINC000539067043 938791248 /nfs/dbraw/zinc/79/12/48/938791248.db2.gz RRSQAEFJUGQKCS-IBGZPJMESA-N 0 3 405.311 4.202 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc(CN[C@H](C)c2cccc(OC(F)F)c2)cc1 ZINC000539069408 938791828 /nfs/dbraw/zinc/79/18/28/938791828.db2.gz BAZFHYGHOVASCG-OAHLLOKOSA-N 0 3 412.502 4.169 20 0 HIADHN CCC[C@@H](NCc1ccc(S(=O)(=O)N(CC)CC)cc1)c1ccc(OC)cc1 ZINC000539073074 938794013 /nfs/dbraw/zinc/79/40/13/938794013.db2.gz XQOJKKCJTFZCBC-JOCHJYFZSA-N 0 3 404.576 4.357 20 0 HIADHN C[C@@H](NC1CCN(C(=O)CC(F)(F)F)CC1)c1ccc(F)cc1Br ZINC000539076547 938795889 /nfs/dbraw/zinc/79/58/89/938795889.db2.gz GNGOYPYROGFZAE-SNVBAGLBSA-N 0 3 411.237 4.182 20 0 HIADHN C[C@H](NC[C@@H](c1cccc(Cl)c1)N1CCOCC1)c1nc2c(s1)CCCC2 ZINC000539081338 938798259 /nfs/dbraw/zinc/79/82/59/938798259.db2.gz ZSBZJHTUOWFMAT-KXBFYZLASA-N 0 3 405.995 4.399 20 0 HIADHN COc1cc(OC)cc(N2CC[C@@H](N[C@@H](C)c3ccc(-c4ccncc4)cc3)C2=O)c1 ZINC000539085448 938799405 /nfs/dbraw/zinc/79/94/05/938799405.db2.gz OBBXPKZKUFBKRC-BXKMTCNYSA-N 0 3 417.509 4.222 20 0 HIADHN COc1cc(OC)cc(N2CC[C@@H](N[C@H](C)c3ccc(-c4ccncc4)cc3)C2=O)c1 ZINC000539085449 938799721 /nfs/dbraw/zinc/79/97/21/938799721.db2.gz OBBXPKZKUFBKRC-MZNJEOGPSA-N 0 3 417.509 4.222 20 0 HIADHN CC[C@@H](NC[C@@H](OC)c1cccc(Cl)c1)c1ccccc1OCC(=O)N(C)C ZINC000539086739 938800074 /nfs/dbraw/zinc/80/00/74/938800074.db2.gz KQZJTQLTCKEXGS-TZIWHRDSSA-N 0 3 404.938 4.235 20 0 HIADHN C[C@H](CC(=O)N1CCCCCC1)N[C@@H](Cc1ccccc1)C(=O)N(C)c1ccccc1 ZINC000539089171 938800462 /nfs/dbraw/zinc/80/04/62/938800462.db2.gz MUEWPBYZFPOBEI-QPPBQGQZSA-N 0 3 421.585 4.032 20 0 HIADHN COCCOc1ccc([C@@H](C)N[C@@H](c2ccc3c(c2)OCCO3)C2CC2)cc1OC ZINC000539089752 938800568 /nfs/dbraw/zinc/80/05/68/938800568.db2.gz GIOPXHPZBPYTTA-VOIUYBSRSA-N 0 3 413.514 4.294 20 0 HIADHN COc1ccc2c(c1)[C@H](NCc1ccc(C(=O)N3C[C@H](C)O[C@@H](C)C3)cc1)CCC2 ZINC000539091076 938801103 /nfs/dbraw/zinc/80/11/03/938801103.db2.gz FWAGTXBUDKCYIH-LLJLJFOGSA-N 0 3 408.542 4.112 20 0 HIADHN CCOc1ccc([C@@H](C)N[C@H](C)c2cccc(N3CCCS3(=O)=O)c2)cc1OC ZINC000539093979 938801891 /nfs/dbraw/zinc/80/18/91/938801891.db2.gz QPEYIKWTVWCQSU-IAGOWNOFSA-N 0 3 418.559 4.046 20 0 HIADHN COc1cc(CN[C@@H](C)c2sc(C(C)(C)C)nc2C)ccc1OCC(=O)N(C)C ZINC000539093921 938801924 /nfs/dbraw/zinc/80/19/24/938801924.db2.gz UXEWEKIQEVVJDQ-AWEZNQCLSA-N 0 3 419.591 4.075 20 0 HIADHN CCOc1ccc([C@H](C)N[C@H](C)c2cccc(N3CCCS3(=O)=O)c2)cc1OC ZINC000539093985 938801987 /nfs/dbraw/zinc/80/19/87/938801987.db2.gz QPEYIKWTVWCQSU-SJORKVTESA-N 0 3 418.559 4.046 20 0 HIADHN CCOc1ccc([C@@H](C)N[C@@H](C)c2cccc(N3CCCS3(=O)=O)c2)cc1OC ZINC000539093975 938802012 /nfs/dbraw/zinc/80/20/12/938802012.db2.gz QPEYIKWTVWCQSU-DLBZAZTESA-N 0 3 418.559 4.046 20 0 HIADHN O=C1C[C@H](NCc2c[nH]nc2-c2cccs2)CN1c1cccc(C(F)(F)F)c1 ZINC000539104059 938803803 /nfs/dbraw/zinc/80/38/03/938803803.db2.gz VMAXWECYAVYVOB-AWEZNQCLSA-N 0 3 406.433 4.052 20 0 HIADHN C[C@@H]1Cc2ccc(F)cc2[C@H]1[NH2+]Cc1nnc(-c2ccc(Br)cc2)[n-]1 ZINC000539121110 938805707 /nfs/dbraw/zinc/80/57/07/938805707.db2.gz AINSGIGKXZPQOV-ZMZPIMSZSA-N 0 3 401.283 4.396 20 0 HIADHN CN(C(=O)Nc1ccc(F)cc1OCC(F)F)[C@H]1CCN(Cc2ccccc2)C1 ZINC000539153274 938812478 /nfs/dbraw/zinc/81/24/78/938812478.db2.gz PYOLFKNFUIAUIP-KRWDZBQOSA-N 0 3 407.436 4.208 20 0 HIADHN C[C@@H]1CN(c2ccc(CN[C@H](c3ccc(Br)cc3)C3CC3)cn2)CCO1 ZINC000539159395 938813939 /nfs/dbraw/zinc/81/39/39/938813939.db2.gz PGBOCWSJLHDKCA-VFNWGFHPSA-N 0 3 416.363 4.310 20 0 HIADHN CS(=O)(=O)Cc1ccc(CN[C@H](c2ccc(Br)cc2)C2CC2)cc1 ZINC000539161121 938814244 /nfs/dbraw/zinc/81/42/44/938814244.db2.gz VDINRPQIOIEQKM-IBGZPJMESA-N 0 3 408.361 4.235 20 0 HIADHN CS(=O)(=O)Cc1ccc(CN[C@@H](c2ccc(Br)cc2)C2CC2)cc1 ZINC000539161122 938814285 /nfs/dbraw/zinc/81/42/85/938814285.db2.gz VDINRPQIOIEQKM-LJQANCHMSA-N 0 3 408.361 4.235 20 0 HIADHN O=C([C@H](Cc1ccccc1)N[C@@H]1CCc2c1cccc2Br)N1CCCC1 ZINC000539204419 938819012 /nfs/dbraw/zinc/81/90/12/938819012.db2.gz RQHXHOLMOPMAEO-RTWAWAEBSA-N 0 3 413.359 4.260 20 0 HIADHN O=C([C@@H](Cc1ccccc1)N[C@H]1CCc2c1cccc2Br)N1CCCC1 ZINC000539204415 938819123 /nfs/dbraw/zinc/81/91/23/938819123.db2.gz RQHXHOLMOPMAEO-LEWJYISDSA-N 0 3 413.359 4.260 20 0 HIADHN C[C@@H]1CCCN(S(=O)(=O)c2ccc(CN[C@@H](c3ccc(F)cc3)C3CC3)cc2)C1 ZINC000539215547 938819874 /nfs/dbraw/zinc/81/98/74/938819874.db2.gz JXROSDVGEHWMNI-UZUQRXQVSA-N 0 3 416.562 4.487 20 0 HIADHN COc1ccc([C@@H](CN[C@H](C)c2nc3ccc(Cl)cc3n2C)N(C)C)cc1OC ZINC000539217540 938820072 /nfs/dbraw/zinc/82/00/72/938820072.db2.gz XUJUKACSQKLNEH-AUUYWEPGSA-N 0 3 416.953 4.197 20 0 HIADHN COc1ccc([C@H](NCc2nnc(-c3ccc(Br)cc3)[nH]2)C2CC2)cc1 ZINC000539216354 938820219 /nfs/dbraw/zinc/82/02/19/938820219.db2.gz UTJAIQOZELGSKC-LJQANCHMSA-N 0 3 413.319 4.484 20 0 HIADHN COc1ccccc1CNC(=O)[C@@H](C)N[C@H](C)c1ccc(OCc2cccnc2)cc1 ZINC000539225235 938821528 /nfs/dbraw/zinc/82/15/28/938821528.db2.gz GUZSETJUVUNYSG-RTBURBONSA-N 0 3 419.525 4.025 20 0 HIADHN COc1ccc(NC(=O)[C@H](NC[C@H]2CCC[C@@H]2OC)c2ccccc2)cc1Cl ZINC000539239470 938823620 /nfs/dbraw/zinc/82/36/20/938823620.db2.gz OLGZXQWTJIUWSA-LKUPVBHCSA-N 0 3 402.922 4.433 20 0 HIADHN COc1ccc([C@H](NCC(=O)N[C@H](c2nccs2)c2ccccc2)C(C)C)cc1 ZINC000539242333 938824519 /nfs/dbraw/zinc/82/45/19/938824519.db2.gz GSJJOBOHACHUNO-YADHBBJMSA-N 0 3 409.555 4.344 20 0 HIADHN COc1ccc([C@H](NCC(=O)N[C@@H](c2nccs2)c2ccccc2)C(C)C)cc1 ZINC000539242331 938824532 /nfs/dbraw/zinc/82/45/32/938824532.db2.gz GSJJOBOHACHUNO-FGZHOGPDSA-N 0 3 409.555 4.344 20 0 HIADHN COc1ccc(C[C@@H](NCC(=O)N(C)c2ccccc2)c2ccccc2)cc1OC ZINC000539259171 938828631 /nfs/dbraw/zinc/82/86/31/938828631.db2.gz ONYWRJDWKUWPMR-JOCHJYFZSA-N 0 3 404.510 4.240 20 0 HIADHN COc1cc(NC(=O)CN[C@H](CC(C)C)c2ccccc2C)cc(OC)c1OC ZINC000539259847 938828836 /nfs/dbraw/zinc/82/88/36/938828836.db2.gz ZTLDBSVTGIQKBQ-LJQANCHMSA-N 0 3 400.519 4.336 20 0 HIADHN C[C@@H](N[C@H](C)c1ccccc1-n1cccn1)C(=O)N(C)Cc1c(F)cccc1Cl ZINC000539259888 938828847 /nfs/dbraw/zinc/82/88/47/938828847.db2.gz BYWSOWTZZCNSNX-HZPDHXFCSA-N 0 3 414.912 4.363 20 0 HIADHN CCOc1cc(CN[C@@H](c2ccccc2C)C(C)C)nc2nc(C(F)(F)F)nn21 ZINC000539261003 938828982 /nfs/dbraw/zinc/82/89/82/938828982.db2.gz KITSAJKGFFDVBP-QGZVFWFLSA-N 0 3 407.440 4.337 20 0 HIADHN Cc1cc(C)c(NC(=O)CNC(=O)CN[C@@H](CC(C)C)c2ccccc2C)c(C)c1 ZINC000539261316 938829116 /nfs/dbraw/zinc/82/91/16/938829116.db2.gz NRUGNZKEPOSNNE-QFIPXVFZSA-N 0 3 409.574 4.352 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)N1CCc2ccccc2C1)c1ccc(OCC(F)(F)F)cc1 ZINC000539264411 938829874 /nfs/dbraw/zinc/82/98/74/938829874.db2.gz DDXIZZKJINSQOO-CVEARBPZSA-N 0 3 406.448 4.252 20 0 HIADHN CCC(CC)[C@H](NCC(=O)N1CCC(NC(=O)c2ccccc2)CC1)c1ccccc1 ZINC000539280588 938832758 /nfs/dbraw/zinc/83/27/58/938832758.db2.gz NGHOCMJHHSMOHS-VWLOTQADSA-N 0 3 421.585 4.175 20 0 HIADHN CN(C)CCN(Cc1ccccc1F)C(=O)N[C@@H]1CCO[C@@H]1c1ccc(Cl)cc1 ZINC000539292543 938834945 /nfs/dbraw/zinc/83/49/45/938834945.db2.gz FHZDBZJECGKUOX-NHCUHLMSSA-N 0 3 419.928 4.083 20 0 HIADHN CCNC(=O)c1cccc(NC(=O)CN[C@@H](CC(C)C)c2ccc(Cl)cc2)c1 ZINC000539298961 938836581 /nfs/dbraw/zinc/83/65/81/938836581.db2.gz WRTGPSJNAZZOKK-FQEVSTJZSA-N 0 3 401.938 4.405 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)N[C@@H]1CCO[C@@H]1c1ccc(Cl)cc1 ZINC000539305537 938837710 /nfs/dbraw/zinc/83/77/10/938837710.db2.gz KKEBAIRJPDMNOD-YLJYHZDGSA-N 0 3 403.910 4.062 20 0 HIADHN COC[C@H](NCc1ccc(CN2C[C@H](C)O[C@@H](C)C2)cc1)c1ccc(F)c(F)c1 ZINC000539307814 938838197 /nfs/dbraw/zinc/83/81/97/938838197.db2.gz ALBJNBCGODYWGQ-QQMNAOGKSA-N 0 3 404.501 4.051 20 0 HIADHN CC(=O)Nc1cccc(NC(=O)[C@H](C)N[C@@H](C)c2ccc(-c3cccnc3)cc2)c1 ZINC000539327491 938842316 /nfs/dbraw/zinc/84/23/16/938842316.db2.gz YXVIXKIHVGNSDP-IRXDYDNUSA-N 0 3 402.498 4.385 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)CCc1cncc(F)c1)c1ccc(C(F)(F)F)cc1 ZINC000539335520 938843869 /nfs/dbraw/zinc/84/38/69/938843869.db2.gz NMZKNKOSMVKIIO-IBGZPJMESA-N 0 3 411.443 4.371 20 0 HIADHN C[C@H]1CN(CC2CCN(C(=O)c3ccc(C(F)(F)F)cc3Cl)CC2)C[C@H](C)O1 ZINC000539372878 938850765 /nfs/dbraw/zinc/85/07/65/938850765.db2.gz FNYZOLIWTLPAMN-KBPBESRZSA-N 0 3 418.887 4.320 20 0 HIADHN COc1cc(NC(=O)CN[C@H](c2ccc(Cl)cc2)[C@H]2C[C@@H]2C)cc(OC)c1OC ZINC000539421183 938857892 /nfs/dbraw/zinc/85/78/92/938857892.db2.gz DIUSVRVYVQDCPI-IBNJYYFUSA-N 0 3 418.921 4.291 20 0 HIADHN COc1cc(NC(=O)CN[C@H](c2ccc(Cl)cc2)[C@@H]2C[C@@H]2C)cc(OC)c1OC ZINC000539421184 938857907 /nfs/dbraw/zinc/85/79/07/938857907.db2.gz DIUSVRVYVQDCPI-KPFBPEDLSA-N 0 3 418.921 4.291 20 0 HIADHN Cc1cc([C@H](N[C@@H](C)C(=O)Nc2ccc(N3CCCC3=O)cc2)C2CC2)ccc1F ZINC000539425015 938858655 /nfs/dbraw/zinc/85/86/55/938858655.db2.gz QXZISKBCXJJENB-QMHKHESXSA-N 0 3 409.505 4.329 20 0 HIADHN Cc1cccc(N2CCN(CCCCNC(=O)Nc3cccc(N(C)C)c3C)CC2)c1 ZINC000539458204 938863819 /nfs/dbraw/zinc/86/38/19/938863819.db2.gz FIENJNKFMJPROA-UHFFFAOYSA-N 0 3 423.605 4.093 20 0 HIADHN CNC(=O)Cc1nc(CN[C@@H](Cc2ccc(Cl)cc2)C2CCCCC2)cs1 ZINC000539490744 938867647 /nfs/dbraw/zinc/86/76/47/938867647.db2.gz FGEXUQDAXWYYLK-IBGZPJMESA-N 0 3 405.995 4.366 20 0 HIADHN COc1ccc([C@H](NCC(=O)N[C@@H](c2nccs2)c2ccccc2)C2CC2)cc1 ZINC000539491738 938867930 /nfs/dbraw/zinc/86/79/30/938867930.db2.gz ZBFYPLPYGBQBBC-FGZHOGPDSA-N 0 3 407.539 4.098 20 0 HIADHN COc1cccc2cc([C@H](C)NCCNC(=O)c3cccc(Br)c3)oc21 ZINC000539510092 938871106 /nfs/dbraw/zinc/87/11/06/938871106.db2.gz YHWLADNNOUWSIK-ZDUSSCGKSA-N 0 3 417.303 4.285 20 0 HIADHN CC(C)COC1CCN([C@H]2CCCN(Cc3cccc(C(F)(F)F)c3)C2=O)CC1 ZINC000539589069 938884204 /nfs/dbraw/zinc/88/42/04/938884204.db2.gz YEIFXMKTJAPDTK-FQEVSTJZSA-N 0 3 412.496 4.333 20 0 HIADHN CC(C)c1cccc(-c2ccc(C(=O)N3CC[C@H](N4CCN(C)CC4)[C@@H](C)C3)o2)c1 ZINC000539590334 938884413 /nfs/dbraw/zinc/88/44/13/938884413.db2.gz CELGBGMEKQHVRN-UGKGYDQZSA-N 0 3 409.574 4.168 20 0 HIADHN Fc1cccnc1N1CC[C@@H](NCc2cc(Cl)ccc2OCc2cccnc2)C1 ZINC000539599673 938886175 /nfs/dbraw/zinc/88/61/75/938886175.db2.gz YJEAOYHKZLJPEC-LJQANCHMSA-N 0 3 412.896 4.217 20 0 HIADHN Cc1ccc([C@H](N[C@H]2CCO[C@@H](C(C)C)C2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000539611936 938887856 /nfs/dbraw/zinc/88/78/56/938887856.db2.gz MNYLKMSESCGYSM-WWNPGLIZSA-N 0 3 401.572 4.281 20 0 HIADHN COCc1cccc(CN[C@@H]2CCCN(Cc3cccc(C(F)(F)F)c3)C2=O)c1 ZINC000539635355 938891354 /nfs/dbraw/zinc/89/13/54/938891354.db2.gz REUWAWUBVOCKAQ-HXUWFJFHSA-N 0 3 406.448 4.133 20 0 HIADHN C[C@H]1CN(Cc2ccccn2)CC[C@H]1Nc1cccc(C(=O)NCc2ccccc2)c1 ZINC000539725731 938913925 /nfs/dbraw/zinc/91/39/25/938913925.db2.gz LYKNGULUSUDALP-NBGIEHNGSA-N 0 3 414.553 4.334 20 0 HIADHN COc1ccc([C@@H](C)Nc2cccc([C@@H]3CNC(=O)C3)c2)cc1CN1CCCCC1 ZINC000539736675 938917198 /nfs/dbraw/zinc/91/71/98/938917198.db2.gz AUNXUOLQUPHUFR-NQIIRXRSSA-N 0 3 407.558 4.458 20 0 HIADHN C[C@H](NC(=O)CN1CCC[C@@H](c2n[nH]c(C3CCCCC3)n2)C1)c1ccc(F)cc1 ZINC000539763713 938928275 /nfs/dbraw/zinc/92/82/75/938928275.db2.gz XONPUKSWGMOVDO-QFBILLFUSA-N 0 3 413.541 4.048 20 0 HIADHN CCCOc1ccc(CN2CCC(n3cc(Br)cn3)CC2)cc1OC ZINC000539830858 938950911 /nfs/dbraw/zinc/95/09/11/938950911.db2.gz LTVSCCCFBGDUSU-UHFFFAOYSA-N 0 3 408.340 4.280 20 0 HIADHN CCc1cccc(C(=O)N(C[C@H]2CC[N@H+](Cc3ccccc3)C2)CC(F)(F)F)c1[O-] ZINC000539871261 938963025 /nfs/dbraw/zinc/96/30/25/938963025.db2.gz CQXHOGNXTNRMQN-SFHVURJKSA-N 0 3 420.475 4.481 20 0 HIADHN CCc1cccc(C(=O)N(C[C@H]2CC[N@@H+](Cc3ccccc3)C2)CC(F)(F)F)c1[O-] ZINC000539871261 938963032 /nfs/dbraw/zinc/96/30/32/938963032.db2.gz CQXHOGNXTNRMQN-SFHVURJKSA-N 0 3 420.475 4.481 20 0 HIADHN CNC(=O)CCOC1CCN(Cc2ccc(-c3cccc(Cl)c3Cl)o2)CC1 ZINC000539890489 938967928 /nfs/dbraw/zinc/96/79/28/938967928.db2.gz OCDQJALCNKEOAK-UHFFFAOYSA-N 0 3 411.329 4.371 20 0 HIADHN C[C@@H]1C[C@@H](NC(=O)N(CCN2CCCC2)Cc2ccc(Cl)c(Cl)c2)CCO1 ZINC000539903776 938974844 /nfs/dbraw/zinc/97/48/44/938974844.db2.gz JQRAQZHMXNDYKP-WBVHZDCISA-N 0 3 414.377 4.168 20 0 HIADHN COc1cc(OC)cc(Oc2ccc(CN3CCS[C@H]4COCC[C@@H]43)cc2)c1 ZINC000539911526 938977035 /nfs/dbraw/zinc/97/70/35/938977035.db2.gz NIDHNQVOOKICTQ-VXKWHMMOSA-N 0 3 401.528 4.202 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)c2ccc(Oc3cccnc3)cc2)cc1 ZINC000539931255 938978784 /nfs/dbraw/zinc/97/87/84/938978784.db2.gz HZGXKOXEOOQDED-DEOSSOPVSA-N 0 3 417.509 4.449 20 0 HIADHN COc1ccc([C@H](CN2CCCC2)NC(=O)Cc2ccc(C(F)(F)F)cc2)cc1 ZINC000539931841 938978791 /nfs/dbraw/zinc/97/87/91/938978791.db2.gz MVNNWDWRUJRVIO-FQEVSTJZSA-N 0 3 406.448 4.210 20 0 HIADHN C[C@H](CC(=O)N1CCC(CN2C[C@H](C)O[C@@H](C)C2)CC1)Cc1ccc(Cl)cc1 ZINC000540054474 939051941 /nfs/dbraw/zinc/05/19/41/939051941.db2.gz RVJLSWGAXNQLGO-FHWLQOOXSA-N 0 3 406.998 4.257 20 0 HIADHN O[C@@H](COC(c1ccc(F)cc1)c1ccc(F)cc1)CN(Cc1ccncc1)C1CC1 ZINC000540063281 939055577 /nfs/dbraw/zinc/05/55/77/939055577.db2.gz LAZYYPGBYQKDNA-XMMPIXPASA-N 0 3 424.491 4.491 20 0 HIADHN CC(C)Cn1cc(NC(=O)NC[C@@H](c2ccccc2)N2CCCC2)c(C(F)F)n1 ZINC000540115399 939078157 /nfs/dbraw/zinc/07/81/57/939078157.db2.gz WILYTFGDSVCBHW-SFHVURJKSA-N 0 3 405.493 4.435 20 0 HIADHN CCOc1ccc([C@H](C)NCc2ccc(S(=O)(=O)N3CCCCC3)cc2)cc1 ZINC000540119742 939079657 /nfs/dbraw/zinc/07/96/57/939079657.db2.gz QGGCEAOJYABYNN-SFHVURJKSA-N 0 3 402.560 4.111 20 0 HIADHN COc1cccc(C[C@H](NCc2ccc(S(=O)(=O)N(C)C)cc2)c2ccccc2)c1 ZINC000540120840 939080496 /nfs/dbraw/zinc/08/04/96/939080496.db2.gz PRVGJNBLIIWVIU-DEOSSOPVSA-N 0 3 424.566 4.019 20 0 HIADHN COc1ccc([C@H](C)N[C@@H]2CC(=O)N(C)[C@H]2c2ccc(Cl)c(F)c2)cc1OC ZINC000540139078 939088030 /nfs/dbraw/zinc/08/80/30/939088030.db2.gz KEYXWLPKIYXPCG-VVUGWJFESA-N 0 3 406.885 4.119 20 0 HIADHN C[C@H](N[C@H]1CCc2cc(F)ccc21)c1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000540139334 939088070 /nfs/dbraw/zinc/08/80/70/939088070.db2.gz QYULZVXPMFBQTH-AOMKIAJQSA-N 0 3 402.535 4.338 20 0 HIADHN C[C@@H](CC(=O)Nc1cccc(Cl)c1)N[C@H](CO)c1ccc(Br)cc1 ZINC000540142026 939088570 /nfs/dbraw/zinc/08/85/70/939088570.db2.gz XJXFFYWLBSENKP-YVEFUNNKSA-N 0 3 411.727 4.143 20 0 HIADHN CN(C(=O)c1ccc(NCc2cc(O)cc(C(F)(F)F)c2)cc1)[C@H]1CCCN(C)C1 ZINC000563629528 945227025 /nfs/dbraw/zinc/22/70/25/945227025.db2.gz HQXYBLHAAVSIPX-IBGZPJMESA-N 0 3 421.463 4.189 20 0 HIADHN COc1ccc(CN2CC[C@@H](N[C@H](C)c3cccc(-c4ccncc4)c3)C2=O)cc1 ZINC000540182754 939108657 /nfs/dbraw/zinc/10/86/57/939108657.db2.gz OLAMGVITVFGYLB-HOYKHHGWSA-N 0 3 401.510 4.209 20 0 HIADHN COc1ccc(CN2CC[C@H](N[C@H](C)c3cccc(-c4ccncc4)c3)C2=O)cc1 ZINC000540182758 939108952 /nfs/dbraw/zinc/10/89/52/939108952.db2.gz OLAMGVITVFGYLB-KOSHJBKYSA-N 0 3 401.510 4.209 20 0 HIADHN C[C@@H](NCc1ccc(S(=O)(=O)N2CCCCC2)cc1)c1cccc(OC(F)F)c1 ZINC000540192348 939116942 /nfs/dbraw/zinc/11/69/42/939116942.db2.gz HQTQDYNZXAWLFI-MRXNPFEDSA-N 0 3 424.513 4.313 20 0 HIADHN CCCc1ccc([C@@H](NCc2cccnc2N2CCC(C(N)=O)CC2)C(C)C)cc1 ZINC000540300361 939187192 /nfs/dbraw/zinc/18/71/92/939187192.db2.gz BPFYWIAUXIYBQY-QHCPKHFHSA-N 0 3 408.590 4.223 20 0 HIADHN C[C@H](NCCC(=O)Nc1cc(N)ccc1F)c1cccc(NC(=O)c2ccccc2)c1 ZINC000540333154 939198480 /nfs/dbraw/zinc/19/84/80/939198480.db2.gz VXHBLWMXCUKDHJ-INIZCTEOSA-N 0 3 420.488 4.340 20 0 HIADHN O=C(CCN1CCC[C@@H](c2nncn2C2CC2)C1)Nc1c(Cl)cccc1Cl ZINC000540338394 939199702 /nfs/dbraw/zinc/19/97/02/939199702.db2.gz QXQPCTPXAKWOFO-CYBMUJFWSA-N 0 3 408.333 4.128 20 0 HIADHN CCC[C@@H](NCC(=O)N1c2ccccc2NC(=O)C[C@H]1C(F)(F)F)c1ccccc1 ZINC000540341828 939200284 /nfs/dbraw/zinc/20/02/84/939200284.db2.gz YFPOSKWCUHVMRA-APWZRJJASA-N 0 3 419.447 4.424 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@@H](C)NCc2cc(C)nc3ccccc23)cc1 ZINC000540342528 939200599 /nfs/dbraw/zinc/20/05/99/939200599.db2.gz GAVYGHODCOBAGJ-GOSISDBHSA-N 0 3 411.571 4.425 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@H](C)NCc2cc(C)nc3ccccc23)cc1 ZINC000540342529 939200885 /nfs/dbraw/zinc/20/08/85/939200885.db2.gz GAVYGHODCOBAGJ-SFHVURJKSA-N 0 3 411.571 4.425 20 0 HIADHN Cc1ccc(S(=O)(=O)CCCN(C)[C@@H]2CCN(Cc3ccccc3)[C@H](C)C2)cc1 ZINC000540345683 939201550 /nfs/dbraw/zinc/20/15/50/939201550.db2.gz DANOXGYHNJSIKS-FYYLOGMGSA-N 0 3 414.615 4.144 20 0 HIADHN O=C(CN[C@H](c1ccccc1)[C@H]1CCOC1)Nc1ccc(Br)cc1Cl ZINC000540395505 939233003 /nfs/dbraw/zinc/23/30/03/939233003.db2.gz VRGMVXQFPWKROV-IFXJQAMLSA-N 0 3 423.738 4.408 20 0 HIADHN O=C(CN[C@H](c1ccccc1)[C@@H]1CCOC1)Nc1ccc(Br)cc1Cl ZINC000540395504 939233296 /nfs/dbraw/zinc/23/32/96/939233296.db2.gz VRGMVXQFPWKROV-AUUYWEPGSA-N 0 3 423.738 4.408 20 0 HIADHN CC(C)C[C@@H](NCC(=O)Nc1cccc(C(=O)N(C)C)c1)c1ccc(Cl)cc1 ZINC000540396166 939233331 /nfs/dbraw/zinc/23/33/31/939233331.db2.gz BXZFOOYJAJDWMJ-HXUWFJFHSA-N 0 3 401.938 4.357 20 0 HIADHN O=C(CN[C@H](C[C@H]1CCOC1)c1ccccc1)Nc1ccnn1CC1CCCCC1 ZINC000540432642 939246511 /nfs/dbraw/zinc/24/65/11/939246511.db2.gz JWNBUECZVCSVFC-IFMALSPDSA-N 0 3 410.562 4.159 20 0 HIADHN COc1ccc(CNC(=O)[C@H](C)N[C@H](C)c2ccc(-c3cccnc3)cc2)cc1OC ZINC000540433470 939246770 /nfs/dbraw/zinc/24/67/70/939246770.db2.gz RTTZSUUKPZLURE-MSOLQXFVSA-N 0 3 419.525 4.121 20 0 HIADHN CCN(C(=O)CN[C@@H](C[C@@H]1CCOC1)c1ccccc1)c1nc2ccccc2s1 ZINC000540434780 939247268 /nfs/dbraw/zinc/24/72/68/939247268.db2.gz UHUQGXRDNHLKDW-PXNSSMCTSA-N 0 3 409.555 4.407 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(-n2cccn2)cc1)C(=O)Nc1ccc(Br)cc1 ZINC000540434955 939247494 /nfs/dbraw/zinc/24/74/94/939247494.db2.gz KPVXWOKVBPTDDU-GJZGRUSLSA-N 0 3 413.319 4.313 20 0 HIADHN COc1ccc(NC(=O)[C@H](C)N[C@@H](C)c2ccc(-c3cccnc3)cc2)cc1OC ZINC000540433877 939247551 /nfs/dbraw/zinc/24/75/51/939247551.db2.gz ACNXSYDMIUEDMF-IRXDYDNUSA-N 0 3 405.498 4.444 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)NC(=O)Nc1ccccc1F)c1ccc(-c2ccncc2)cc1 ZINC000540439723 939250087 /nfs/dbraw/zinc/25/00/87/939250087.db2.gz MXUBCZVHWDCKBC-CVEARBPZSA-N 0 3 406.461 4.275 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(-c2ccncc2)cc1)C(=O)N1CCN(c2ccccc2)CC1 ZINC000540439893 939250131 /nfs/dbraw/zinc/25/01/31/939250131.db2.gz OHLDBODIAPJGPV-NHCUHLMSSA-N 0 3 414.553 4.137 20 0 HIADHN COc1ccc(NC(=O)[C@@H](C)N[C@@H](C)c2ccc(-c3ccncc3)cc2)cc1OC ZINC000540440237 939251190 /nfs/dbraw/zinc/25/11/90/939251190.db2.gz RSESNVDPCYQIRY-DLBZAZTESA-N 0 3 405.498 4.444 20 0 HIADHN O=C(N[C@@H]1CCO[C@H]1c1ccc(Cl)cc1)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000540462193 939261905 /nfs/dbraw/zinc/26/19/05/939261905.db2.gz OMTSMEUWXSAPDZ-BWAGFHJFSA-N 0 3 416.924 4.338 20 0 HIADHN Cc1nc(C2CCCCC2)sc1C(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000540470204 939265713 /nfs/dbraw/zinc/26/57/13/939265713.db2.gz KKZZTCKYZYAQLM-CALCHBBNSA-N 0 3 419.635 4.461 20 0 HIADHN C[C@@H](CS(=O)(=O)c1ccccc1)NCCc1cc(Cl)ccc1Br ZINC000540495572 939275750 /nfs/dbraw/zinc/27/57/50/939275750.db2.gz YTLNDPRSGHSQKJ-ZDUSSCGKSA-N 0 3 416.768 4.097 20 0 HIADHN CC1CCN([C@@H](CNC(=O)c2cccc(Cn3ccnc3)c2)c2ccccc2)CC1 ZINC000540509644 939281644 /nfs/dbraw/zinc/28/16/44/939281644.db2.gz SFZWMVHGDVIMEL-DEOSSOPVSA-N 0 3 402.542 4.134 20 0 HIADHN Cc1cc([C@@H](N[C@@H](C)C(=O)Nc2cccc(N3CCCC3=O)c2)C2CC2)ccc1F ZINC000540521765 939286609 /nfs/dbraw/zinc/28/66/09/939286609.db2.gz VJEDJZNKBRLNLK-HJPURHCSSA-N 0 3 409.505 4.329 20 0 HIADHN CCOC(=O)c1nn(-c2ccccc2)cc1CNC[C@@H]1CCCO[C@@H]1c1ccccc1 ZINC000540570594 939308232 /nfs/dbraw/zinc/30/82/32/939308232.db2.gz FAZNXIFLXJFFNP-GBXCKJPGSA-N 0 3 419.525 4.307 20 0 HIADHN CC(C)Cc1ccc([C@H](NCC(=O)Nc2ccc(C(=O)N(C)C)cc2)C2CC2)cc1 ZINC000540589162 939312193 /nfs/dbraw/zinc/31/21/93/939312193.db2.gz PVUBFCBSYSPPDI-DEOSSOPVSA-N 0 3 407.558 4.266 20 0 HIADHN COc1cccc2cc([C@H](C)NC[C@H](O)COc3ccccc3Br)oc21 ZINC000540605124 939317620 /nfs/dbraw/zinc/31/76/20/939317620.db2.gz CJQVHQRTQAVAGY-ZFWWWQNUSA-N 0 3 420.303 4.294 20 0 HIADHN COc1cc(OC)cc(N2CC[C@H](NCc3ccccc3OCc3cccnc3)C2)c1 ZINC000540693561 939341185 /nfs/dbraw/zinc/34/11/85/939341185.db2.gz JIIDVBKSFHOPGC-NRFANRHFSA-N 0 3 419.525 4.046 20 0 HIADHN C[C@@H](N[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1=O)c1ccc(NC(=O)C2CC2)cc1 ZINC000540705581 939344444 /nfs/dbraw/zinc/34/44/44/939344444.db2.gz UXEQQVSWCWWVFR-ZUOKHONESA-N 0 3 415.896 4.284 20 0 HIADHN C[C@H](N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1)c1ccc2c(c1)COC2 ZINC000540751606 939359626 /nfs/dbraw/zinc/35/96/26/939359626.db2.gz IJWSOQSRQADSPM-UQBPGWFLSA-N 0 3 400.522 4.295 20 0 HIADHN O=C(NC1CCN(CCOc2ccc(Cl)cc2)CC1)c1c[nH]c2cc(F)ccc12 ZINC000540886359 939409939 /nfs/dbraw/zinc/40/99/39/939409939.db2.gz OTXOZQVRKWFJCA-UHFFFAOYSA-N 0 3 415.896 4.234 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)NCC(=O)N[C@H](c2ccc(C)cc2)C2CC2)cc1 ZINC000541026133 939434431 /nfs/dbraw/zinc/43/44/31/939434431.db2.gz SGFUMQGRDISFGH-IQGLISFBSA-N 0 3 402.542 4.407 20 0 HIADHN CCN1CC[C@@H](NCc2ccc(Br)cn2)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000541065664 939447527 /nfs/dbraw/zinc/44/75/27/939447527.db2.gz VSJYHEPIDZHVPL-AEFFLSMTSA-N 0 3 414.269 4.187 20 0 HIADHN COc1cc(Br)ccc1CCC(=O)Nc1cc(CN(C)C)ccc1C ZINC000541103601 939461065 /nfs/dbraw/zinc/46/10/65/939461065.db2.gz IUSOTZQCQLATTR-UHFFFAOYSA-N 0 3 405.336 4.399 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)c3ccn(-c4ccc(F)cc4C)n3)c(C)c2)CC1 ZINC000541181855 939484698 /nfs/dbraw/zinc/48/46/98/939484698.db2.gz KMVBAIMPZSEDLC-UHFFFAOYSA-N 0 3 421.520 4.022 20 0 HIADHN COc1ccc2ccccc2c1-c1cc(CNC2CCN(CC(F)F)CC2)on1 ZINC000541256241 939487969 /nfs/dbraw/zinc/48/79/69/939487969.db2.gz HAOBMPFGRXVOMV-UHFFFAOYSA-N 0 3 401.457 4.323 20 0 HIADHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)C(C)(C)Cc1nc2ccccc2[nH]1 ZINC000541256900 939488028 /nfs/dbraw/zinc/48/80/28/939488028.db2.gz QZCKFBXUCKCGSG-IBGZPJMESA-N 0 3 404.558 4.255 20 0 HIADHN CCCNC(=O)C1(NCc2ccc(Br)c3cccnc23)CCCCC1 ZINC000541280441 939489102 /nfs/dbraw/zinc/48/91/02/939489102.db2.gz AODOYXDIVWWCRU-UHFFFAOYSA-N 0 3 404.352 4.316 20 0 HIADHN CC(C)(C)OC(=O)CCCN1CCC(O)(Cc2ccc(OC(F)(F)F)cc2)CC1 ZINC000541326233 939490946 /nfs/dbraw/zinc/49/09/46/939490946.db2.gz UHLZUHFRLQLKPU-UHFFFAOYSA-N 0 3 417.468 4.077 20 0 HIADHN CCOc1cc(CN[C@@H](C)C[S@](C)=O)ccc1OCc1c(F)cccc1Cl ZINC000541371282 939499431 /nfs/dbraw/zinc/49/94/31/939499431.db2.gz VERPWQUOICHRKT-PWFNWSNSSA-N 0 3 413.942 4.313 20 0 HIADHN CCOc1cc(CN[C@@H](C)C[S@@](C)=O)ccc1OCc1c(F)cccc1Cl ZINC000541371281 939499501 /nfs/dbraw/zinc/49/95/01/939499501.db2.gz VERPWQUOICHRKT-PGGUUEOZSA-N 0 3 413.942 4.313 20 0 HIADHN Cc1nn(-c2ccncc2)cc1CNCc1ccc(C(=O)Nc2ccc(F)cc2)cc1 ZINC000541376978 939500449 /nfs/dbraw/zinc/50/04/49/939500449.db2.gz DYLNLXKOLCWTAW-UHFFFAOYSA-N 0 3 415.472 4.257 20 0 HIADHN Cc1nn(-c2ccncc2)cc1CNCc1cccc(NC(=O)c2ccc(F)cc2)c1 ZINC000541390675 939503668 /nfs/dbraw/zinc/50/36/68/939503668.db2.gz PBWPMHXNYHPIIL-UHFFFAOYSA-N 0 3 415.472 4.257 20 0 HIADHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)[C@@H]2CCn3c(cnc3C3CCCCC3)C2)C1 ZINC000541395235 939504468 /nfs/dbraw/zinc/50/44/68/939504468.db2.gz AJDMVHMIDWEMCD-UEVCKROQSA-N 0 3 420.601 4.445 20 0 HIADHN COc1ccc(S(=O)(=O)[N-]c2cccc(C[NH2+][C@@H](C)CCC(F)(F)F)c2)cc1 ZINC000541540869 939548098 /nfs/dbraw/zinc/54/80/98/939548098.db2.gz UBLDREORSBEUFI-AWEZNQCLSA-N 0 3 416.465 4.317 20 0 HIADHN COc1cc(C[C@@H](CO)CN[C@@H](c2cccnc2)c2ccc(F)c(C)c2)cc(OC)c1 ZINC000541544530 939549457 /nfs/dbraw/zinc/54/94/57/939549457.db2.gz YWWQRAJHUCGVBK-KBMIEXCESA-N 0 3 424.516 4.077 20 0 HIADHN Fc1ccc([C@H](NCCCN2CCN(c3ccccc3)CC2)c2cccnc2)c(F)c1 ZINC000541551070 939553170 /nfs/dbraw/zinc/55/31/70/939553170.db2.gz CJHHLPVOKYZWDH-RUZDIDTESA-N 0 3 422.523 4.251 20 0 HIADHN COc1cccc(S(=O)(=O)CCN[C@H](Cc2ccccc2)c2cccs2)c1 ZINC000541594879 939562605 /nfs/dbraw/zinc/56/26/05/939562605.db2.gz ICSHJRCNEHBDGM-HXUWFJFHSA-N 0 3 401.553 4.104 20 0 HIADHN Cc1cccc(Cc2cnc(NC(=O)CN[C@H](C)[C@H]3COc4ccccc43)s2)c1 ZINC000541694670 939607084 /nfs/dbraw/zinc/60/70/84/939607084.db2.gz HQSWETRDLXCZCP-OXQOHEQNSA-N 0 3 407.539 4.135 20 0 HIADHN COc1cc(-c2nnc(CNC3(Cc4ccccc4)CCCC3)o2)cc(OC)c1OC ZINC000541699662 939608074 /nfs/dbraw/zinc/60/80/74/939608074.db2.gz LADPIAOTRDZOCW-UHFFFAOYSA-N 0 3 423.513 4.408 20 0 HIADHN C[C@H](NCC(=O)NCc1ccc(-c2ccc(Cl)cc2)o1)[C@@H]1COc2ccccc21 ZINC000541698325 939608138 /nfs/dbraw/zinc/60/81/38/939608138.db2.gz UWZQUAFPNABDQW-YWZLYKJASA-N 0 3 410.901 4.371 20 0 HIADHN CC(C)NS(=O)(=O)Cc1ccccc1CN[C@H]1CCCc2c(Cl)cccc21 ZINC000541740823 939618450 /nfs/dbraw/zinc/61/84/50/939618450.db2.gz DYCRCCUCKUBUQZ-NRFANRHFSA-N 0 3 406.979 4.335 20 0 HIADHN Cc1nnc([C@H]2CCCN(Cc3csc(-c4cccc(Br)c4)n3)C2)[nH]1 ZINC000541762263 939623584 /nfs/dbraw/zinc/62/35/84/939623584.db2.gz VLHZPVPDDGBMJG-AWEZNQCLSA-N 0 3 418.364 4.379 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N[C@@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000541798035 939635502 /nfs/dbraw/zinc/63/55/02/939635502.db2.gz XVOIPJQNBCCYLW-AQNXPRMDSA-N 0 3 417.550 4.244 20 0 HIADHN COc1cc(-c2ccccc2)sc1C(=O)N1C[C@@H](SC)[C@H](N2CCCC2)C1 ZINC000541842763 939646081 /nfs/dbraw/zinc/64/60/81/939646081.db2.gz LCKODKVTPWCITD-VQIMIIECSA-N 0 3 402.585 4.076 20 0 HIADHN Cc1ccc(-n2nc(-c3ccco3)cc2NC(=O)N[C@@H](C)C2=CCN(C)CC2)cc1 ZINC000541906646 939650958 /nfs/dbraw/zinc/65/09/58/939650958.db2.gz SLLLOJIDAWXAGT-KRWDZBQOSA-N 0 3 405.502 4.213 20 0 HIADHN CC(C)[C@H](NCc1ccc([C@]2(C)NC(=O)NC2=O)cc1)c1ccc(Cl)cc1F ZINC000541917239 939653268 /nfs/dbraw/zinc/65/32/68/939653268.db2.gz HETWGXLWDYRUQG-RXVVDRJESA-N 0 3 403.885 4.021 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)NCC(=O)N(C)[C@H](C)c2ccc(F)c(F)c2)cc1 ZINC000541956156 939662641 /nfs/dbraw/zinc/66/26/41/939662641.db2.gz SFQHHHRTDGGYGH-HZPDHXFCSA-N 0 3 412.484 4.329 20 0 HIADHN CC[C@@H]1C[C@H](CC(=O)Nc2c(C)cnn2[C@H]2CCN(Cc3ccccc3)C2)CCO1 ZINC000541964663 939664556 /nfs/dbraw/zinc/66/45/56/939664556.db2.gz OGWPMDQQVITAIK-BHIFYINESA-N 0 3 410.562 4.172 20 0 HIADHN CC(C)N(CCN(C)C)C(=O)Nc1ccc(Cl)c(C(=O)Nc2ccccc2)c1 ZINC000541970361 939665726 /nfs/dbraw/zinc/66/57/26/939665726.db2.gz JESDTLUAMSADAV-UHFFFAOYSA-N 0 3 402.926 4.396 20 0 HIADHN O=C(Nc1ccc(CCN2CCSCC2)cc1)N1CC=C(c2ccccc2F)C1 ZINC000542026821 939691067 /nfs/dbraw/zinc/69/10/67/939691067.db2.gz SOEYVVMTPQKGDI-UHFFFAOYSA-N 0 3 411.546 4.348 20 0 HIADHN CCN(CC)C(=O)CCC1CCN([C@@H](C)C(=O)N(Cc2ccccc2)C(C)C)CC1 ZINC000542042589 939696866 /nfs/dbraw/zinc/69/68/66/939696866.db2.gz WKEJJRZFLCHRRU-NRFANRHFSA-N 0 3 415.622 4.173 20 0 HIADHN O[C@@H](CN[C@@H](Cc1ccc(Cl)cc1)c1ccccn1)COCc1cccs1 ZINC000542123326 939721879 /nfs/dbraw/zinc/72/18/79/939721879.db2.gz NVZXIILHBWCRTE-RXVVDRJESA-N 0 3 402.947 4.248 20 0 HIADHN CCc1cccc2c1OCC[C@H]2N[C@@H](C)CC(=O)Nc1ccc(NC(=O)C2CC2)cc1 ZINC000542143107 939729114 /nfs/dbraw/zinc/72/91/14/939729114.db2.gz GBOYULXSRVYXAV-KSFYIVLOSA-N 0 3 421.541 4.428 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1ccnc(C2CC2)c1 ZINC000542149744 939731242 /nfs/dbraw/zinc/73/12/42/939731242.db2.gz JXNUQVXSZOYIEY-NRFANRHFSA-N 0 3 401.514 4.163 20 0 HIADHN CC(C)OC(=O)C1(C(=O)OC(C)C)CC(N[C@H]2c3cccc(F)c3CC[C@H]2C)C1 ZINC000542165099 939740545 /nfs/dbraw/zinc/74/05/45/939740545.db2.gz VKSIGFPVUBALKN-FOIQADDNSA-N 0 3 405.510 4.091 20 0 HIADHN C[C@H](CC(=O)Nc1ccc(NC(=O)C2CC2)cc1)NCc1ccccc1OC1CCC1 ZINC000542186504 939749364 /nfs/dbraw/zinc/74/93/64/939749364.db2.gz UZPOYFVHNNVCKO-QGZVFWFLSA-N 0 3 421.541 4.473 20 0 HIADHN CN(C(=O)c1ccc(NC(=O)c2ccc(-c3ccccc3)o2)cc1)[C@H]1CCCN(C)C1 ZINC000542191996 939750718 /nfs/dbraw/zinc/75/07/18/939750718.db2.gz CNWXZOBQNRVQBY-NRFANRHFSA-N 0 3 417.509 4.365 20 0 HIADHN Cc1cc(NC(=O)C2CCN(CCCc3ccccc3Br)CC2)no1 ZINC000542209672 939757388 /nfs/dbraw/zinc/75/73/88/939757388.db2.gz LFEXIZFELKJMKG-UHFFFAOYSA-N 0 3 406.324 4.029 20 0 HIADHN CC[C@@H](N[C@H]1CCCN(Cc2ccccn2)C1=O)c1ccc(Br)cc1 ZINC000542209632 939757541 /nfs/dbraw/zinc/75/75/41/939757541.db2.gz UVFFMOPDYRIGDP-MOPGFXCFSA-N 0 3 402.336 4.076 20 0 HIADHN CCc1nccn1C[C@H]1CCCN1C(=O)c1cccc(CN(C)Cc2ccccc2)c1 ZINC000542402385 939815416 /nfs/dbraw/zinc/81/54/16/939815416.db2.gz MZPCPFQKAZTSPS-XMMPIXPASA-N 0 3 416.569 4.382 20 0 HIADHN CCCN(C(=O)c1cccs1)C1CCN(Cc2cn(-c3ccncc3)nc2C)CC1 ZINC000542464593 939827451 /nfs/dbraw/zinc/82/74/51/939827451.db2.gz BNQZUQLLNUAIJR-UHFFFAOYSA-N 0 3 423.586 4.154 20 0 HIADHN COc1cc(CN2CC[C@H](N[C@H](c3ccc(F)cc3)c3cccnc3)C2)cc(OC)c1 ZINC000542474032 939828964 /nfs/dbraw/zinc/82/89/64/939828964.db2.gz YZLYJFPRWVEEFG-WIOPSUGQSA-N 0 3 421.516 4.191 20 0 HIADHN O=C1[C@H](N[C@@H]2CCCc3c(Br)cccc32)CCCN1Cc1ccccn1 ZINC000542497406 939833034 /nfs/dbraw/zinc/83/30/34/939833034.db2.gz BPAAWIMOBDEDCW-WOJBJXKFSA-N 0 3 414.347 4.002 20 0 HIADHN C[C@@H]1C[C@@H](N[C@H]2CCCN(Cc3ccccn3)C2=O)c2cccc(Br)c21 ZINC000542499014 939833187 /nfs/dbraw/zinc/83/31/87/939833187.db2.gz MPIYCRFDVUVZSO-MDASCCDHSA-N 0 3 414.347 4.173 20 0 HIADHN O=C(CN[C@@H](Cc1ccccc1)c1cccs1)Nc1cccc(N2CCCC2=O)c1 ZINC000542525020 939837187 /nfs/dbraw/zinc/83/71/87/939837187.db2.gz HTFKXHMDWIJDJQ-NRFANRHFSA-N 0 3 419.550 4.387 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3C[C@@H](C)C[C@H]3c3cccnc3)c(C)c2)CC1 ZINC000542601397 939847557 /nfs/dbraw/zinc/84/75/57/939847557.db2.gz UFCMLYBRZMIEGR-MBSDFSHPSA-N 0 3 407.562 4.147 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3C[C@H](C)C[C@H]3c3cccnc3)c(C)c2)CC1 ZINC000542601395 939847587 /nfs/dbraw/zinc/84/75/87/939847587.db2.gz UFCMLYBRZMIEGR-JPYJTQIMSA-N 0 3 407.562 4.147 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)CSc1nc(-c2ccccc2)no1)c1ccsc1 ZINC000542611394 939848281 /nfs/dbraw/zinc/84/82/81/939848281.db2.gz DNJMLDUVPHWZFH-KRWDZBQOSA-N 0 3 416.572 4.090 20 0 HIADHN C[C@@H](N[C@@H](C)C(=O)Nc1nc(-c2ccc(F)cc2)cs1)[C@@H]1COc2ccccc21 ZINC000542618067 939849140 /nfs/dbraw/zinc/84/91/40/939849140.db2.gz BDZINHSCKQNKQD-GLJUWKHASA-N 0 3 411.502 4.431 20 0 HIADHN Clc1cccc2c1CCC[C@@H]2NCc1ccccc1OCCN1CCOCC1 ZINC000542677236 939853492 /nfs/dbraw/zinc/85/34/92/939853492.db2.gz GECBQLYBKYHRCH-QFIPXVFZSA-N 0 3 400.950 4.218 20 0 HIADHN Cc1csc([C@H](C)CN[C@H](c2ccc(F)cc2)c2cccc(S(C)(=O)=O)c2)n1 ZINC000542682227 939853847 /nfs/dbraw/zinc/85/38/47/939853847.db2.gz SBTPXRYBLRSBFN-JLTOFOAXSA-N 0 3 418.559 4.477 20 0 HIADHN CCOc1ccc([C@H](NCC2CCS(=O)(=O)CC2)c2ccccc2Cl)cc1 ZINC000542776972 939860334 /nfs/dbraw/zinc/86/03/34/939860334.db2.gz AIECRJXIBCXYIY-NRFANRHFSA-N 0 3 407.963 4.243 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)c1cnc(-c2ccc(F)c(F)c2)s1 ZINC000542819869 939861356 /nfs/dbraw/zinc/86/13/56/939861356.db2.gz FCZAJLASVLIXJK-UHFFFAOYSA-N 0 3 403.454 4.411 20 0 HIADHN CC(=O)Nc1ccc([C@@H](C)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2=O)cc1 ZINC000542848875 939862940 /nfs/dbraw/zinc/86/29/40/939862940.db2.gz IAZGGPYWULVTSA-VLIAUNLRSA-N 0 3 417.456 4.093 20 0 HIADHN CC[C@@H]1c2ccsc2CCN1C(=O)CN[C@H](C)c1ccc(-n2ccnc2C)cc1 ZINC000542886141 939865235 /nfs/dbraw/zinc/86/52/35/939865235.db2.gz SYNYKTPPXCMSBE-IIBYNOLFSA-N 0 3 408.571 4.429 20 0 HIADHN Cc1cc(NC(=O)C[C@@H]2CCO[C@@H](C(C)C)C2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000542886656 939865395 /nfs/dbraw/zinc/86/53/95/939865395.db2.gz JQMJQESAETVNES-DNVJHFABSA-N 0 3 424.589 4.418 20 0 HIADHN Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)C[C@H]1CCO[C@@H](C(C)C)C1 ZINC000542892672 939865813 /nfs/dbraw/zinc/86/58/13/939865813.db2.gz CXFLFUUNUNYXEX-YTFSRNRJSA-N 0 3 424.589 4.418 20 0 HIADHN COc1cccc(OC)c1OC[C@H](O)CN[C@@H](c1ccc(Cl)cc1F)C(C)C ZINC000542919177 939877631 /nfs/dbraw/zinc/87/76/31/939877631.db2.gz KZMKIGJRXJUHRU-FOIQADDNSA-N 0 3 411.901 4.223 20 0 HIADHN CCN(C(=O)CN1CCC(CCCn2ccnc2)CC1)[C@@H](C)c1ccc(F)cc1 ZINC000543060848 939914795 /nfs/dbraw/zinc/91/47/95/939914795.db2.gz NIOUSMVAHLWBPD-IBGZPJMESA-N 0 3 400.542 4.124 20 0 HIADHN Cc1ccc(C2CCN(CCc3nc4sc5c(c4c(N)n3)CCCC5)CC2)cn1 ZINC000543061560 939915761 /nfs/dbraw/zinc/91/57/61/939915761.db2.gz SILWRZPJENKXRX-UHFFFAOYSA-N 0 3 407.587 4.278 20 0 HIADHN C[C@H](CC(=O)Nc1cccc(Cl)c1)N[C@@H](CO)c1ccc(C(F)(F)F)cc1 ZINC000543072637 939924850 /nfs/dbraw/zinc/92/48/50/939924850.db2.gz MMMITJXMBDBTMR-PXAZEXFGSA-N 0 3 400.828 4.399 20 0 HIADHN COc1ccc(C(=O)N(Cc2ccco2)C2CCN(C)CC2)cc1OC1CCCC1 ZINC000543122728 939956565 /nfs/dbraw/zinc/95/65/65/939956565.db2.gz SZEURMVPPCSSIF-UHFFFAOYSA-N 0 3 412.530 4.346 20 0 HIADHN COc1ccc(C(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)cc1OC1CCCC1 ZINC000543155682 939978815 /nfs/dbraw/zinc/97/88/15/939978815.db2.gz UVRUAOWBAHPBMO-NRFANRHFSA-N 0 3 408.542 4.363 20 0 HIADHN CN(CC(=O)N(Cc1nnc(-c2ccccc2Cl)o1)C1CC1)C[C@H]1CC=CCC1 ZINC000543178860 939986824 /nfs/dbraw/zinc/98/68/24/939986824.db2.gz KHXXDYMYBBXJLM-INIZCTEOSA-N 0 3 414.937 4.169 20 0 HIADHN C[C@H](CN(C)C(=O)NC[C@H](c1cccs1)N1CCC(C)CC1)c1nccs1 ZINC000543187517 939990160 /nfs/dbraw/zinc/99/01/60/939990160.db2.gz XIDHLIYZCDBXAW-IAGOWNOFSA-N 0 3 406.621 4.423 20 0 HIADHN FC(F)(F)c1ccc([C@H]2CCC[C@@H]2NCc2cn(Cc3cccnc3)nn2)cc1 ZINC000543240395 940005088 /nfs/dbraw/zinc/00/50/88/940005088.db2.gz XOGQLMIEUZCBDY-UXHICEINSA-N 0 3 401.436 4.166 20 0 HIADHN Cc1ccc(COc2ccc(CN[C@H]3CCCN(Cc4ccccn4)C3=O)cc2)cc1 ZINC000543242704 940006428 /nfs/dbraw/zinc/00/64/28/940006428.db2.gz AWCWTOPTDPONKC-VWLOTQADSA-N 0 3 415.537 4.250 20 0 HIADHN COc1ccc([C@@H]2CCCN2C(=O)CN2CC[C@@H](c3cccc(C)c3)C2)c(OC)c1 ZINC000543253371 940008620 /nfs/dbraw/zinc/00/86/20/940008620.db2.gz PGLIPMAORLTJLB-OFNKIYASSA-N 0 3 408.542 4.165 20 0 HIADHN CN(C(=O)[C@H]1CCn2c(cnc2C2CCCCC2)C1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000543332396 940033670 /nfs/dbraw/zinc/03/36/70/940033670.db2.gz HJGGJBDOZNISLX-GOTSBHOMSA-N 0 3 420.601 4.226 20 0 HIADHN Cc1cc([C@H](NC[C@@H](c2cccs2)N2CCOCC2)c2cccnc2)ccc1F ZINC000543404439 940053408 /nfs/dbraw/zinc/05/34/08/940053408.db2.gz KSOWCHPXESEADU-GMAHTHKFSA-N 0 3 411.546 4.343 20 0 HIADHN Cc1cc([C@H](NC[C@H](c2cccs2)N2CCOCC2)c2cccnc2)ccc1F ZINC000543404438 940053735 /nfs/dbraw/zinc/05/37/35/940053735.db2.gz KSOWCHPXESEADU-GGAORHGYSA-N 0 3 411.546 4.343 20 0 HIADHN Cc1ccccc1[C@H](CN1CCOCC1)NCc1ccc(OCc2ccccn2)cc1 ZINC000543408253 940055208 /nfs/dbraw/zinc/05/52/08/940055208.db2.gz BHHXYRBZKGYULK-SANMLTNESA-N 0 3 417.553 4.132 20 0 HIADHN O=C(CN1CCC(N[C@@H](c2ccc(F)cc2)c2cccnc2)CC1)Nc1ccccc1 ZINC000543409117 940055859 /nfs/dbraw/zinc/05/58/59/940055859.db2.gz GPEDIXQCVJOWLP-VWLOTQADSA-N 0 3 418.516 4.003 20 0 HIADHN Fc1ccc([C@H](NCCCN2CCN(c3ccccc3)CC2)c2ccccc2)nc1 ZINC000543411540 940057423 /nfs/dbraw/zinc/05/74/23/940057423.db2.gz KAAGABIJSPZILL-RUZDIDTESA-N 0 3 404.533 4.112 20 0 HIADHN CCc1ccc([C@@H](CN2CCOCC2)NCc2cccc(OCC(F)F)c2)cc1 ZINC000543424409 940060871 /nfs/dbraw/zinc/06/08/71/940060871.db2.gz SDEQVUSVJQGYEL-JOCHJYFZSA-N 0 3 404.501 4.056 20 0 HIADHN CC[C@H](N[C@H]1CCCN(Cc2ccccn2)C1=O)c1cccc(Br)c1 ZINC000543427042 940061394 /nfs/dbraw/zinc/06/13/94/940061394.db2.gz QNXSPPWLUOLMQT-OALUTQOASA-N 0 3 402.336 4.076 20 0 HIADHN O=C1[C@H](N[C@@H]2CCCc3nc(-c4ccccc4)sc32)CCCN1Cc1ccccn1 ZINC000543427280 940061485 /nfs/dbraw/zinc/06/14/85/940061485.db2.gz WNBZXUVVULXMSU-TZIWHRDSSA-N 0 3 418.566 4.363 20 0 HIADHN CN(C)S(=O)(=O)c1cccc(CN[C@H](Cc2ccccc2)c2cccs2)c1 ZINC000543454948 940067681 /nfs/dbraw/zinc/06/76/81/940067681.db2.gz QVWCOZNODCAHGN-HXUWFJFHSA-N 0 3 400.569 4.072 20 0 HIADHN O=C(N[C@@H]1CCO[C@H](c2ccc(F)cc2)C1)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000543464751 940072462 /nfs/dbraw/zinc/07/24/62/940072462.db2.gz MGPHSUKXTJMCME-VJBWXMMDSA-N 0 3 411.521 4.010 20 0 HIADHN Fc1ccc([C@H]2C[C@H](NCc3cc4c(cc3Br)OCO4)CCO2)cc1 ZINC000543623404 940138667 /nfs/dbraw/zinc/13/86/67/940138667.db2.gz BMDKDFHDCIYBIO-NVXWUHKLSA-N 0 3 408.267 4.327 20 0 HIADHN Fc1ccc([C@H]2C[C@@H](NCc3cc4c(cc3Br)OCO4)CCO2)cc1 ZINC000543623401 940138784 /nfs/dbraw/zinc/13/87/84/940138784.db2.gz BMDKDFHDCIYBIO-DOTOQJQBSA-N 0 3 408.267 4.327 20 0 HIADHN CCc1ccc([C@H](CNC(=O)N[C@@H]2CCO[C@@H](c3ccc(F)cc3)C2)N(C)C)cc1 ZINC000543654659 940151084 /nfs/dbraw/zinc/15/10/84/940151084.db2.gz YAQWPBOQMUEOSW-XPWALMASSA-N 0 3 413.537 4.210 20 0 HIADHN O=C(CN[C@H](C[C@@H]1CCOC1)c1ccccc1)Nc1cccc(Br)c1 ZINC000543704927 940165746 /nfs/dbraw/zinc/16/57/46/940165746.db2.gz SZUOPLGSGLPHCR-HNAYVOBHSA-N 0 3 403.320 4.145 20 0 HIADHN COc1cc(-c2ccccc2)ccc1CN[C@H](CN1CCN(C)CC1)c1ccccc1 ZINC000543761529 940178151 /nfs/dbraw/zinc/17/81/51/940178151.db2.gz YWLGILQJNJNHMH-AREMUKBSSA-N 0 3 415.581 4.441 20 0 HIADHN Cc1nn(-c2ccccc2)cc1NC(=O)NCC(C)(C)N1CCc2ccccc2C1 ZINC000543766906 940179341 /nfs/dbraw/zinc/17/93/41/940179341.db2.gz UBOWTDVKFCWSOD-UHFFFAOYSA-N 0 3 403.530 4.139 20 0 HIADHN COc1ccc2c(c1)C[C@@H](C)N(C(=O)CCCN1CCN(c3ccccc3)CC1)[C@H]2C ZINC000543789189 940187191 /nfs/dbraw/zinc/18/71/91/940187191.db2.gz YYWWCAVFMJRUSR-RTWAWAEBSA-N 0 3 421.585 4.132 20 0 HIADHN COc1ccc(CN(C)C(=O)[C@H](C)N[C@H](C)c2ccc(-n3ccnc3C)cc2)cc1F ZINC000543813600 940194831 /nfs/dbraw/zinc/19/48/31/940194831.db2.gz ZLGGEAFQGPLGKW-SJORKVTESA-N 0 3 424.520 4.026 20 0 HIADHN Cc1nccn1-c1ccc([C@@H](C)N[C@H](C)C(=O)NC(=O)Nc2ccc(C)cc2C)cc1 ZINC000543812967 940195238 /nfs/dbraw/zinc/19/52/38/940195238.db2.gz WCTLWCVBVAZMMT-QZTJIDSGSA-N 0 3 419.529 4.185 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N[C@@H](c1ccc(Cl)cc1F)C(C)C ZINC000543825950 940199807 /nfs/dbraw/zinc/19/98/07/940199807.db2.gz LEOBISISTKMWIG-HXUWFJFHSA-N 0 3 419.928 4.301 20 0 HIADHN CCN1CC[C@@H](NCc2cnn(-c3ccccc3)c2)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000543849129 940207885 /nfs/dbraw/zinc/20/78/85/940207885.db2.gz LXZQHPMCRIKZOA-IRLDBZIGSA-N 0 3 400.448 4.215 20 0 HIADHN CCc1cnccc1[C@@H](C)NC[C@H](O)COc1ccc(Cl)cc1Br ZINC000543981169 940281997 /nfs/dbraw/zinc/28/19/97/940281997.db2.gz GQENBWLHZRLAFN-DOMZBBRYSA-N 0 3 413.743 4.150 20 0 HIADHN C[C@@H](C(=O)N1CCC[C@H]1c1cccs1)N1CCC(CCCn2ccnc2)CC1 ZINC000543987776 940284226 /nfs/dbraw/zinc/28/42/26/940284226.db2.gz INFUPFXDJIZPDD-ICSRJNTNSA-N 0 3 400.592 4.189 20 0 HIADHN C[C@H](NCCSc1cc(Cl)ccc1Cl)c1cccc(S(N)(=O)=O)c1 ZINC000543990587 940286100 /nfs/dbraw/zinc/28/61/00/940286100.db2.gz MYIGQEGPGISHAY-NSHDSACASA-N 0 3 405.372 4.084 20 0 HIADHN COc1cc(Cl)ccc1CN[C@H](C)CC(=O)Nc1ccc(NC(=O)C2CC2)cc1 ZINC000544011017 940298547 /nfs/dbraw/zinc/29/85/47/940298547.db2.gz MSYKHCMWRUMIHG-CQSZACIVSA-N 0 3 415.921 4.204 20 0 HIADHN C[C@@H](N[C@H]1CCCN(Cc2nccn2C)C1=O)c1ccc(-c2ccc(F)cc2)s1 ZINC000544014061 940299346 /nfs/dbraw/zinc/29/93/46/940299346.db2.gz JNAAZCFSGQOMEN-QAPCUYQASA-N 0 3 412.534 4.130 20 0 HIADHN CC1CCN(C(=O)C2CCN(CCCc3ccccc3Br)CC2)CC1 ZINC000544069839 940316759 /nfs/dbraw/zinc/31/67/59/940316759.db2.gz SMCFQOUHTAIIKW-UHFFFAOYSA-N 0 3 407.396 4.352 20 0 HIADHN CN(C)Cc1cccc(C(=O)NC2CCN(Cc3cc(Cl)cc(Cl)c3)CC2)c1 ZINC000544261621 940371297 /nfs/dbraw/zinc/37/12/97/940371297.db2.gz AAXBFPOYXFNMSG-UHFFFAOYSA-N 0 3 420.384 4.449 20 0 HIADHN C[C@@H]1CCN(C(=O)c2cccc(CN(C)Cc3ccccc3)c2)C[C@H]1n1ccnc1 ZINC000544278094 940377374 /nfs/dbraw/zinc/37/73/74/940377374.db2.gz LZJXKSJCWWLBGJ-HYBUGGRVSA-N 0 3 402.542 4.238 20 0 HIADHN COc1cccc([C@H]2C[C@H](C)CN2C(=O)CCCN2CCN(c3ccccc3)CC2)c1 ZINC000544319158 940389055 /nfs/dbraw/zinc/38/90/55/940389055.db2.gz PROFOMUNOWGTAG-SQJMNOBHSA-N 0 3 421.585 4.207 20 0 HIADHN CCCN(C(=O)NCC[C@@H]1CCO[C@@H](C)C1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000544330093 940392258 /nfs/dbraw/zinc/39/22/58/940392258.db2.gz RCQIHCVLNQTPIL-XJUOHMSHSA-N 0 3 401.595 4.278 20 0 HIADHN Cn1cc(CN2CCC[C@H](C(=O)Nc3ccc(Cl)cn3)C2)c(C2CCCCC2)n1 ZINC000544352582 940398125 /nfs/dbraw/zinc/39/81/25/940398125.db2.gz GIPSYKYWGXJCKX-KRWDZBQOSA-N 0 3 415.969 4.367 20 0 HIADHN CCN(CC)C(=O)CCCC(=O)N[C@@H](c1ccc(F)c(F)c1)C(C)(C)N1CCCC1 ZINC000544355720 940399292 /nfs/dbraw/zinc/39/92/92/940399292.db2.gz KPPCLVMEZBSYGT-QFIPXVFZSA-N 0 3 423.548 4.035 20 0 HIADHN Fc1ccc([C@@H](CN[C@@H](c2ccc(F)cc2)c2cccnc2)N2CCOCC2)cc1 ZINC000544363214 940402214 /nfs/dbraw/zinc/40/22/14/940402214.db2.gz UHULCCFIXUJGQR-RPWUZVMVSA-N 0 3 409.480 4.112 20 0 HIADHN CCc1nc(CC(=O)N[C@@H](c2ccc(F)c(F)c2)C(C)(C)N2CCCC2)cs1 ZINC000544364377 940402747 /nfs/dbraw/zinc/40/27/47/940402747.db2.gz SYKDCUNADSTLDJ-FQEVSTJZSA-N 0 3 407.530 4.258 20 0 HIADHN NC(=O)C1CCN(C[C@H](NCc2ccc(Cl)cc2)c2ccc(Cl)cc2)CC1 ZINC000544367679 940403700 /nfs/dbraw/zinc/40/37/00/940403700.db2.gz HNAYIUOAHUTOSD-FQEVSTJZSA-N 0 3 406.357 4.022 20 0 HIADHN CC[C@H](Oc1cccc(C)c1)c1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1 ZINC000544388345 940408661 /nfs/dbraw/zinc/40/86/61/940408661.db2.gz PKMYTLTXESLAKX-FQEVSTJZSA-N 0 3 407.518 4.112 20 0 HIADHN O[C@H](CCc1ccccc1)CN1CCN(CCc2ccc(Cl)c(Cl)c2)CC1 ZINC000544400660 940412623 /nfs/dbraw/zinc/41/26/23/940412623.db2.gz KXASWWWZYJLMCC-HXUWFJFHSA-N 0 3 407.385 4.147 20 0 HIADHN CC(=O)Nc1ccc(NC(=O)CN[C@H](c2cccs2)C2CC2)c(C(F)(F)F)c1 ZINC000544400357 940412631 /nfs/dbraw/zinc/41/26/31/940412631.db2.gz UPCOMHXJROPERS-SFHVURJKSA-N 0 3 411.449 4.405 20 0 HIADHN Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)NC[C@@H](O)COc1cccc2ccccc21 ZINC000544420865 940420400 /nfs/dbraw/zinc/42/04/00/940420400.db2.gz FEAAOMITYRGJKY-RDTXWAMCSA-N 0 3 421.463 4.306 20 0 HIADHN CC(C)(C)[C@H]1CCN(Cc2ccnc(-c3ccc(Br)cc3)n2)C[C@H]1O ZINC000544438950 940431335 /nfs/dbraw/zinc/43/13/35/940431335.db2.gz UADDFPFOVFGLGM-ZWKOTPCHSA-N 0 3 404.352 4.135 20 0 HIADHN C[C@@H](N[C@@H](CC(N)=O)C1CCCCC1)C(=O)Nc1ccc(OCc2ccccc2)cc1 ZINC000544460617 940440652 /nfs/dbraw/zinc/44/06/52/940440652.db2.gz ROVWSMXLOHTTNX-JPYJTQIMSA-N 0 3 423.557 4.007 20 0 HIADHN CC[C@H](NCC(=O)N1N=C(c2ccc(Cl)cc2)C[C@@H]1c1ccco1)[C@@H]1CCCO1 ZINC000544462435 940441688 /nfs/dbraw/zinc/44/16/88/940441688.db2.gz VMRGPMIOLYFXOE-SXLOBPIMSA-N 0 3 415.921 4.158 20 0 HIADHN CC(C)Oc1ccc([C@@H](CNC(=O)c2cn(C)nc2C2CCCCC2)N(C)C)cc1 ZINC000563908996 945322418 /nfs/dbraw/zinc/32/24/18/945322418.db2.gz JBFWFHNLRJELBI-JOCHJYFZSA-N 0 3 412.578 4.288 20 0 HIADHN Cc1ccc([C@H](CNC(=O)Nc2csc(-c3ccccn3)n2)N2CCCC2)cc1 ZINC000544595884 940486842 /nfs/dbraw/zinc/48/68/42/940486842.db2.gz HJKZDYASKWXVTO-IBGZPJMESA-N 0 3 407.543 4.472 20 0 HIADHN COC(=O)c1coc(CNc2cccc(N3CCN(CCc4ccccc4)CC3)c2)c1 ZINC000544609726 940490010 /nfs/dbraw/zinc/49/00/10/940490010.db2.gz TZGXEXQOANAPRX-UHFFFAOYSA-N 0 3 419.525 4.043 20 0 HIADHN CS[C@@H]1CN(C(=O)c2ccc(COc3ccc(C)cc3C)o2)C[C@@H]1N1CCCC1 ZINC000544685225 940502265 /nfs/dbraw/zinc/50/22/65/940502265.db2.gz WMXOEFPIGOWOPR-SIKLNZKXSA-N 0 3 414.571 4.127 20 0 HIADHN COc1ccc(C(=O)CC(C)(C)CC(=O)N2CCC[C@H]2CN2CCCCC2)cc1 ZINC000544734724 940508823 /nfs/dbraw/zinc/50/88/23/940508823.db2.gz DTFKVJLVVRQXBZ-FQEVSTJZSA-N 0 3 400.563 4.161 20 0 HIADHN CS[C@@H]1CN(C(=O)Nc2ccc(OC(C)C)cc2C(F)(F)F)C[C@H]1N(C)C ZINC000544790974 940514352 /nfs/dbraw/zinc/51/43/52/940514352.db2.gz OYOOSNBKHVPXEA-HZPDHXFCSA-N 0 3 405.486 4.002 20 0 HIADHN O=C(NCc1nc2ccccc2n1C1CC1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000544794402 940514624 /nfs/dbraw/zinc/51/46/24/940514624.db2.gz QNYRZISCEIBANS-GOSISDBHSA-N 0 3 406.505 4.039 20 0 HIADHN CCN(C(=O)c1cc(C)n(-c2ccc(F)cc2)n1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000544848025 940519009 /nfs/dbraw/zinc/51/90/09/940519009.db2.gz ZYZXDSXYPATGGZ-JOCHJYFZSA-N 0 3 406.505 4.056 20 0 HIADHN Cc1cnc([C@@H](C)NC2CCN(C(=O)c3ccc(Br)cc3C)CC2)s1 ZINC000544866075 940520299 /nfs/dbraw/zinc/52/02/99/940520299.db2.gz NWEZHPFVOQTLGH-CQSZACIVSA-N 0 3 422.392 4.478 20 0 HIADHN Cc1cnc([C@H](C)NC2CCN(C(=O)c3ccc(Br)cc3C)CC2)s1 ZINC000544866071 940520305 /nfs/dbraw/zinc/52/03/05/940520305.db2.gz NWEZHPFVOQTLGH-AWEZNQCLSA-N 0 3 422.392 4.478 20 0 HIADHN CO[C@H](C)c1nc(Cc2noc(-c3ccc(CN4CCSCC4)cc3)n2)cs1 ZINC000545119485 940544630 /nfs/dbraw/zinc/54/46/30/940544630.db2.gz LFFZMXKFMNGPNY-CQSZACIVSA-N 0 3 416.572 4.040 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)c1cc(C)n(Cc2ccncc2)c1C)c1ccsc1 ZINC000545164435 940553130 /nfs/dbraw/zinc/55/31/30/940553130.db2.gz FHYZORCQFZRWAP-QFIPXVFZSA-N 0 3 410.587 4.423 20 0 HIADHN COc1ccc2[nH]c3c(c2c1)C[C@H](N[C@@H](c1nc(-c2cccnc2)no1)C(C)C)CC3 ZINC000545191452 940555250 /nfs/dbraw/zinc/55/52/50/940555250.db2.gz LBOVQVJCTGISLJ-OPAMFIHVSA-N 0 3 417.513 4.466 20 0 HIADHN C[C@H](NC(=O)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1)c1ccon1 ZINC000545336719 940562421 /nfs/dbraw/zinc/56/24/21/940562421.db2.gz FPHQRNBEUWBXLI-AWEZNQCLSA-N 0 3 411.333 4.350 20 0 HIADHN Cc1cc(Br)cn2cc(CCNCc3cn4cc(Cl)ccc4n3)nc12 ZINC000545350453 940563816 /nfs/dbraw/zinc/56/38/16/940563816.db2.gz WUWBHRPHGLCYLC-UHFFFAOYSA-N 0 3 418.726 4.039 20 0 HIADHN CCC(CC)(C(=O)N[C@H]1CCN(Cc2ccccc2)C1)c1ccc(OC)c(OC)c1 ZINC000545360742 940565339 /nfs/dbraw/zinc/56/53/39/940565339.db2.gz WWQKAYKLNANNRN-NRFANRHFSA-N 0 3 410.558 4.152 20 0 HIADHN CCN(C(=O)c1cc(OC)c(OC)cc1Cl)[C@H]1CCN(Cc2ccccc2)C1 ZINC000545476558 940571383 /nfs/dbraw/zinc/57/13/83/940571383.db2.gz AAQJAYFHVVZVFR-KRWDZBQOSA-N 0 3 402.922 4.094 20 0 HIADHN COc1ccccc1Cc1noc([C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)n1 ZINC000545553863 940574559 /nfs/dbraw/zinc/57/45/59/940574559.db2.gz RVSOZZARKMFIKW-NRFANRHFSA-N 0 3 417.431 4.375 20 0 HIADHN C[C@@H](Cc1ccc(Cl)cc1)c1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1 ZINC000545657107 940579228 /nfs/dbraw/zinc/57/92/28/940579228.db2.gz IUTCTPPGZBXKNM-INIZCTEOSA-N 0 3 411.937 4.273 20 0 HIADHN CC(C)[C@H](Cc1ccccc1)c1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1 ZINC000545657599 940579246 /nfs/dbraw/zinc/57/92/46/940579246.db2.gz HPVIPNHLCMEPLD-NRFANRHFSA-N 0 3 405.546 4.256 20 0 HIADHN C[C@@H]1CN(Cc2ccc(-c3nc(-c4ccc(F)c(CN(C)C)c4)no3)cc2)C[C@@H](C)O1 ZINC000545751924 940583777 /nfs/dbraw/zinc/58/37/77/940583777.db2.gz NNEPOGLLNPEHGP-IAGOWNOFSA-N 0 3 424.520 4.214 20 0 HIADHN CC(C)[C@@H](NCc1ccccc1OCCN1CCOCC1)c1ccc(F)c(F)c1 ZINC000563969998 945333149 /nfs/dbraw/zinc/33/31/49/945333149.db2.gz CTZRABKVLHSSHW-HSZRJFAPSA-N 0 3 404.501 4.163 20 0 HIADHN Fc1cccc(CN2CCC[C@H](c3nc(-c4cc(OCC(F)F)ccn4)no3)C2)c1 ZINC000545845977 940630519 /nfs/dbraw/zinc/63/05/19/940630519.db2.gz MRTKKMTYRJYXFX-HNNXBMFYSA-N 0 3 418.419 4.294 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)c1ccc(NC(=O)c2cccs2)cc1)c1ccco1 ZINC000563989556 945337597 /nfs/dbraw/zinc/33/75/97/945337597.db2.gz WMRMCXHRIZNLJI-CRAIPNDOSA-N 0 3 411.527 4.453 20 0 HIADHN COc1cc(C(=O)NC2CC[NH+](Cc3ccc(Cl)cc3)CC2)cc(Cl)c1[O-] ZINC000545885670 940652702 /nfs/dbraw/zinc/65/27/02/940652702.db2.gz DBBADYFSJODCSQ-UHFFFAOYSA-N 0 3 409.313 4.102 20 0 HIADHN COc1cc(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)cc(Cl)c1O ZINC000545885670 940652705 /nfs/dbraw/zinc/65/27/05/940652705.db2.gz DBBADYFSJODCSQ-UHFFFAOYSA-N 0 3 409.313 4.102 20 0 HIADHN CCN(C(=O)c1cc(C)nc2onc(C(C)C)c21)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000546183065 940723716 /nfs/dbraw/zinc/72/37/16/940723716.db2.gz QNUMZFPBPXOCFM-LJQANCHMSA-N 0 3 406.530 4.391 20 0 HIADHN Cc1cc(Br)cn2cc(CCN[C@H](c3ccccc3)c3cncnc3)nc12 ZINC000546222310 940733684 /nfs/dbraw/zinc/73/36/84/940733684.db2.gz FZAOWMWKBTZUBV-HXUWFJFHSA-N 0 3 422.330 4.117 20 0 HIADHN Brc1cccc(OC2CCN(Cc3ccc(-n4cncn4)cc3)CC2)c1 ZINC000546268315 940753458 /nfs/dbraw/zinc/75/34/58/940753458.db2.gz VAPXAGPQYVKHGX-UHFFFAOYSA-N 0 3 413.319 4.073 20 0 HIADHN CO[C@H](C)c1nc(Cc2noc([C@@H]3CCCN(Cc4cccc(F)c4)C3)n2)cs1 ZINC000546533460 940845991 /nfs/dbraw/zinc/84/59/91/940845991.db2.gz QPBWTQZPLBQLCF-GDBMZVCRSA-N 0 3 416.522 4.343 20 0 HIADHN Cc1cc(C(=O)NC[C@H](c2cccs2)N2CCCC2)c(C)n1Cc1ccncc1 ZINC000546582220 940857554 /nfs/dbraw/zinc/85/75/54/940857554.db2.gz WPMNOIHRQUOOMO-OAQYLSRUSA-N 0 3 408.571 4.177 20 0 HIADHN CC[C@H](N[C@@H](C)CCN1C(=O)c2ccccc2C1=O)c1nc(C(F)(F)F)cs1 ZINC000546660792 940866467 /nfs/dbraw/zinc/86/64/67/940866467.db2.gz KEXIYZHBXNPNQY-FZMZJTMJSA-N 0 3 411.449 4.277 20 0 HIADHN O=C([C@@H]1CCCN(Cc2cccnc2)C1)N1CCC(F)(c2cccc(Cl)c2)CC1 ZINC000546713463 940871726 /nfs/dbraw/zinc/87/17/26/940871726.db2.gz GKMPQJOATQTVHL-LJQANCHMSA-N 0 3 415.940 4.434 20 0 HIADHN CCN1CCN(c2cccc(NC(=O)N[C@@H](C)c3ccccc3OC(C)C)c2)CC1 ZINC000546744517 940875302 /nfs/dbraw/zinc/87/53/02/940875302.db2.gz OSSDJWZFVRHPNM-IBGZPJMESA-N 0 3 410.562 4.498 20 0 HIADHN COC(=O)COc1cccc(CN[C@@H](Cc2cccnc2)c2ccc(Cl)cc2)c1 ZINC000546870626 940898818 /nfs/dbraw/zinc/89/88/18/940898818.db2.gz JVQPVMARAULFRT-QFIPXVFZSA-N 0 3 410.901 4.360 20 0 HIADHN C/C(=C\c1ccc(Cl)cc1)c1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1 ZINC000547061811 940978843 /nfs/dbraw/zinc/97/88/43/940978843.db2.gz AEAQZDJEHLODKN-JQIJEIRASA-N 0 3 409.921 4.487 20 0 HIADHN CN1CCCN(c2ccc(-c3noc(COc4ccc5ccccc5c4)n3)cn2)CC1 ZINC000547069291 940982638 /nfs/dbraw/zinc/98/26/38/940982638.db2.gz RDVGXCLZKXCGDY-UHFFFAOYSA-N 0 3 415.497 4.006 20 0 HIADHN C[C@@H](CSCc1ccccc1)c1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1 ZINC000547074355 940984774 /nfs/dbraw/zinc/98/47/74/940984774.db2.gz VVDXPNRPMDGUCN-SFHVURJKSA-N 0 3 423.586 4.310 20 0 HIADHN c1ccc(-c2ncc(-c3noc(-c4ccc(CN5CCSCC5)cc4)n3)cn2)cc1 ZINC000547085609 940989043 /nfs/dbraw/zinc/98/90/43/940989043.db2.gz XXFCFQZZVMYOEW-UHFFFAOYSA-N 0 3 415.522 4.409 20 0 HIADHN CCn1nc(-c2nc(-c3ccccc3CN3CCCCC3)no2)c(=O)c2ccccc21 ZINC000547121733 941003609 /nfs/dbraw/zinc/00/36/09/941003609.db2.gz YEROEBNWUOXUFZ-UHFFFAOYSA-N 0 3 415.497 4.119 20 0 HIADHN Cc1ccc([C@@H](NCCN2CC=C(C)CC2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000547280438 941051111 /nfs/dbraw/zinc/05/11/11/941051111.db2.gz DWQOZIONHWTMEP-DEOSSOPVSA-N 0 3 412.599 4.038 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)N1CC=C(c2c(F)cccc2F)CC1 ZINC000547448414 941063192 /nfs/dbraw/zinc/06/31/92/941063192.db2.gz JFHKJDXAPCNBII-UHFFFAOYSA-N 0 3 401.457 4.356 20 0 HIADHN COc1ccc([C@@H](CNC(=O)Nc2ccc(OC)c3cccnc23)N2CCCC2)cc1 ZINC000547453397 941063636 /nfs/dbraw/zinc/06/36/36/941063636.db2.gz RRDNIEJULWNOIW-OAQYLSRUSA-N 0 3 420.513 4.211 20 0 HIADHN CCN(CC)[C@H](CNC(=O)N1CCO[C@H](c2ccc(F)cc2F)C1)c1ccsc1 ZINC000547628974 941069333 /nfs/dbraw/zinc/06/93/33/941069333.db2.gz JLHDJUCQUSUQES-UXHICEINSA-N 0 3 423.529 4.192 20 0 HIADHN Cc1ccc(-n2c(SCCCN3CCN(C)CC3)nnc2-c2cccc(C)c2)cc1 ZINC000548148747 941088940 /nfs/dbraw/zinc/08/89/40/941088940.db2.gz FYBNTECMSYJAMO-UHFFFAOYSA-N 0 3 421.614 4.281 20 0 HIADHN O=C(NCC1(c2ccc(F)cc2F)CCCC1)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000548277478 941093141 /nfs/dbraw/zinc/09/31/41/941093141.db2.gz BTUBKMIOLLVEKI-LJQANCHMSA-N 0 3 413.512 4.200 20 0 HIADHN CCCc1nc2ccccc2n1CCC(=O)Nc1cccc(N2CCN(CC)CC2)c1 ZINC000548440322 941104164 /nfs/dbraw/zinc/10/41/64/941104164.db2.gz QNEPZYAFDSBMOK-UHFFFAOYSA-N 0 3 419.573 4.160 20 0 HIADHN O=C(N[C@@H]1CCOc2ccc(F)cc21)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000548706889 941120700 /nfs/dbraw/zinc/12/07/00/941120700.db2.gz VSJXPYPTXUHEJP-WIYYLYMNSA-N 0 3 422.422 4.220 20 0 HIADHN O=C(N[C@@H]1CCOc2ccc(F)cc21)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000548706887 941120732 /nfs/dbraw/zinc/12/07/32/941120732.db2.gz VSJXPYPTXUHEJP-NQIIRXRSSA-N 0 3 422.422 4.220 20 0 HIADHN Cc1nc(N[C@@H]2CCCC23CCOCC3)cc(N[C@H]2CCCC23CCOCC3)n1 ZINC000548822211 941125299 /nfs/dbraw/zinc/12/52/99/941125299.db2.gz BSHFJYIERUCWES-KDURUIRLSA-N 0 3 400.567 4.307 20 0 HIADHN Nc1nccc([C@@H]2CCCN(Cc3c(-c4ccc(Cl)cc4)nc4sccn34)C2)n1 ZINC000548936056 941130988 /nfs/dbraw/zinc/13/09/88/941130988.db2.gz IQRAPYDHHBDTOV-OAHLLOKOSA-N 0 3 424.961 4.468 20 0 HIADHN CCOC(=O)C1CCC(N(CC)CC(=O)Nc2cc(Cl)ccc2Cl)CC1 ZINC000548938891 941131188 /nfs/dbraw/zinc/13/11/88/941131188.db2.gz NMPWFQONYHKETK-UHFFFAOYSA-N 0 3 401.334 4.376 20 0 HIADHN CCN(C(=O)Nc1cn(Cc2ccccc2)nn1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000548983313 941138809 /nfs/dbraw/zinc/13/88/09/941138809.db2.gz ADGZAZLIXYJOFD-SIKLNZKXSA-N 0 3 418.545 4.016 20 0 HIADHN CCN1CC[C@@H](NCC(=O)Nc2cc(F)ccc2F)[C@H]1c1ccc(Cl)c(F)c1 ZINC000549111346 941160697 /nfs/dbraw/zinc/16/06/97/941160697.db2.gz PLUOQMOJIVTNAV-YLJYHZDGSA-N 0 3 411.855 4.121 20 0 HIADHN CCN1CC[C@H](NCC(=O)Nc2cc(F)ccc2F)[C@H]1c1ccc(Cl)c(F)c1 ZINC000549111327 941160780 /nfs/dbraw/zinc/16/07/80/941160780.db2.gz PLUOQMOJIVTNAV-FXAWDEMLSA-N 0 3 411.855 4.121 20 0 HIADHN CCN1CC[C@H](NCC(=O)N[C@@H](C)c2cccs2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000549111881 941160790 /nfs/dbraw/zinc/16/07/90/941160790.db2.gz DNEZIYAZFHRCNF-ROOHIHILSA-N 0 3 409.958 4.143 20 0 HIADHN CCN1CC[C@H](NCc2cc(F)cc3c2OCOC3)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000549114513 941161415 /nfs/dbraw/zinc/16/14/15/941161415.db2.gz ZECDZKHHADGEGO-AZUAARDMSA-N 0 3 410.411 4.035 20 0 HIADHN COc1cc(OC)cc(C2(F)CCN(C[C@@H](O)COc3ccccc3Cl)CC2)c1 ZINC000549117930 941161830 /nfs/dbraw/zinc/16/18/30/941161830.db2.gz YUAPZSFROMMGCD-QGZVFWFLSA-N 0 3 423.912 4.058 20 0 HIADHN CCc1ccccc1NC(=O)[C@H](C)N[C@@H]1CCN(C2CC2)[C@@H]1c1cccc(OC)c1 ZINC000549118401 941161848 /nfs/dbraw/zinc/16/18/48/941161848.db2.gz HTYBGQGXIJUNRO-PKKBDPGCSA-N 0 3 407.558 4.152 20 0 HIADHN O=C1CCCN1C[C@@H](NC[C@@H]1CCC2(CCCC2)O1)c1cccc(C(F)(F)F)c1 ZINC000549136807 941164359 /nfs/dbraw/zinc/16/43/59/941164359.db2.gz YLBZBPDOTUCOEK-RBUKOAKNSA-N 0 3 410.480 4.450 20 0 HIADHN Brc1ccc2c(c1)CCCC[C@@H]2NCc1cccnc1N1CCOCC1 ZINC000549143051 941165212 /nfs/dbraw/zinc/16/52/12/941165212.db2.gz SXXLSSKMXNFTHO-FQEVSTJZSA-N 0 3 416.363 4.238 20 0 HIADHN CCOC(=O)C1CCC(N(CC)CC(=O)N(CC)c2nc3ccccc3s2)CC1 ZINC000549186992 941169602 /nfs/dbraw/zinc/16/96/02/941169602.db2.gz CXSVNVXBPRJHSP-UHFFFAOYSA-N 0 3 417.575 4.093 20 0 HIADHN CC(=O)Nc1ccc(S[C@H](C)C(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)cc1 ZINC000549229687 941172358 /nfs/dbraw/zinc/17/23/58/941172358.db2.gz DBEANUPKYQCPBU-JLTOFOAXSA-N 0 3 419.978 4.198 20 0 HIADHN CN(C)C[C@H](NC(=O)CSc1ccc(C(F)(F)F)cn1)c1ccc(Cl)cc1 ZINC000549244458 941173569 /nfs/dbraw/zinc/17/35/69/941173569.db2.gz FGCLYBJHSDCFAF-HNNXBMFYSA-N 0 3 417.884 4.265 20 0 HIADHN Cc1ccc(-c2nc(CNC(=O)N[C@@H](CN(C)C)c3ccc(Cl)cc3)co2)cc1 ZINC000549463704 941192670 /nfs/dbraw/zinc/19/26/70/941192670.db2.gz YSTCKJWNKHMBQA-FQEVSTJZSA-N 0 3 412.921 4.406 20 0 HIADHN CN(C)C[C@H](NC(=O)NCCc1nc(C(C)(C)C)cs1)c1ccc(Cl)cc1 ZINC000549469708 941193158 /nfs/dbraw/zinc/19/31/58/941193158.db2.gz WIOSWFWTMWQCDR-INIZCTEOSA-N 0 3 408.999 4.239 20 0 HIADHN CC(C)N1CC[C@H](N[C@@H](C)C(=O)Nc2c(F)cccc2F)[C@H]1c1ccc(F)c(F)c1 ZINC000549471644 941193325 /nfs/dbraw/zinc/19/33/25/941193325.db2.gz NMAIAYMXLRYPFN-JBZDTAIVSA-N 0 3 423.454 4.384 20 0 HIADHN CC(C)N1CC[C@H](NCC(=O)NCc2ccc(Cl)cc2)[C@@H]1c1ccc(F)c(F)c1 ZINC000549472345 941193588 /nfs/dbraw/zinc/19/35/88/941193588.db2.gz MTTFFUWKVHRDSM-UNMCSNQZSA-N 0 3 421.919 4.048 20 0 HIADHN CCN1CC[C@@H](NCC(=O)Nc2cc(C)ccc2C)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000549476159 941194404 /nfs/dbraw/zinc/19/44/04/941194404.db2.gz JLZKLLWHSLRJMH-GCJKJVERSA-N 0 3 405.464 4.084 20 0 HIADHN CCN1CC[C@H](N[C@H](C)C(=O)Nc2ccc(C)cc2C)[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000549476059 941194423 /nfs/dbraw/zinc/19/44/23/941194423.db2.gz HPJMTZVLHARJHI-PDXHDDNESA-N 0 3 419.491 4.473 20 0 HIADHN C[C@H]1CCO[C@H]1c1nnc(N2CCN(C3CCC(C)CC3)CC2)n1Cc1ccccc1 ZINC000549538743 941198596 /nfs/dbraw/zinc/19/85/96/941198596.db2.gz ITNXPIYQCSYIPA-VNMGMYBJSA-N 0 3 423.605 4.125 20 0 HIADHN CN(C)C[C@H](NC(=O)Cc1csc(Cc2ccccc2)n1)c1ccc(Cl)cc1 ZINC000549617540 941201493 /nfs/dbraw/zinc/20/14/93/941201493.db2.gz UEUSJECSFDJPSE-FQEVSTJZSA-N 0 3 413.974 4.349 20 0 HIADHN CN(C)C[C@@H](NC(=O)Cc1csc(Cc2ccccc2)n1)c1ccc(Cl)cc1 ZINC000549617541 941201565 /nfs/dbraw/zinc/20/15/65/941201565.db2.gz UEUSJECSFDJPSE-HXUWFJFHSA-N 0 3 413.974 4.349 20 0 HIADHN CN(C)C[C@H](NC(=O)Cc1cccc(OCc2cccnc2)c1)c1ccc(Cl)cc1 ZINC000549618705 941201599 /nfs/dbraw/zinc/20/15/99/941201599.db2.gz VGDBRIUYCMGTQB-QHCPKHFHSA-N 0 3 423.944 4.276 20 0 HIADHN CC(C)[C@@H](CCc1ccccc1)C(=O)Nc1cccc(CN2CCC(C(N)=O)CC2)c1 ZINC000549822141 941208635 /nfs/dbraw/zinc/20/86/35/941208635.db2.gz NKBGTTKXMRJTBF-XMMPIXPASA-N 0 3 421.585 4.227 20 0 HIADHN CSc1cc(Br)ccc1CN(CCNC(C)=O)C1CCSCC1 ZINC000549850266 941214335 /nfs/dbraw/zinc/21/43/35/941214335.db2.gz RMSGRZAFAVJRTG-UHFFFAOYSA-N 0 3 417.438 4.005 20 0 HIADHN CCO[C@@H]1C[C@@H](NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1n1cccn1 ZINC000549942564 941243992 /nfs/dbraw/zinc/24/39/92/941243992.db2.gz XAZHJDRXSCGABE-OAGGEKHMSA-N 0 3 407.358 4.429 20 0 HIADHN Cc1cc(-c2noc([C@H](C)N[C@H](C)C3CCN(CC(F)(F)F)CC3)n2)ccc1F ZINC000550023996 941267540 /nfs/dbraw/zinc/26/75/40/941267540.db2.gz HZDJCUZLAQWUGO-KGLIPLIRSA-N 0 3 414.447 4.498 20 0 HIADHN CCS(=O)(=O)c1ccc([C@H](C)N[C@@H](C)c2ccc(NC(=O)NC3CC3)cc2)cc1 ZINC000550425725 941325129 /nfs/dbraw/zinc/32/51/29/941325129.db2.gz UFRXXOSADKOZEG-HOTGVXAUSA-N 0 3 415.559 4.176 20 0 HIADHN CCOc1ccc(-c2nc(CN[C@@H](C(C)C)C3(CO)CCC3)cs2)cc1OC ZINC000550462926 941329915 /nfs/dbraw/zinc/32/99/15/941329915.db2.gz GDDIARIOFFDFKZ-FQEVSTJZSA-N 0 3 404.576 4.494 20 0 HIADHN O=c1ccccn1Cc1ccc(CN[C@@H]2CCc3sc(Br)cc32)cc1 ZINC000550628138 941347674 /nfs/dbraw/zinc/34/76/74/941347674.db2.gz DUYXEOUCMNSRSY-QGZVFWFLSA-N 0 3 415.356 4.498 20 0 HIADHN CN1CCN(C[C@@H](N[C@H]2CCc3sc(Br)cc32)c2ccccc2)CC1 ZINC000550644664 941349018 /nfs/dbraw/zinc/34/90/18/941349018.db2.gz WPIABXQZWHDJTB-ZWKOTPCHSA-N 0 3 420.420 4.076 20 0 HIADHN FC(F)(F)c1cccc(C2(C[NH2+][C@@H](c3cccs3)c3nnc[n-]3)CCOCC2)c1 ZINC000551004880 941393888 /nfs/dbraw/zinc/39/38/88/941393888.db2.gz AHGNBTATOMYZCT-KRWDZBQOSA-N 0 3 422.476 4.312 20 0 HIADHN COc1ccc(C[C@@H](C)CN(C)CC(=O)Nc2cc(Cl)c(OC)cc2OC)cc1 ZINC000551305897 941447731 /nfs/dbraw/zinc/44/77/31/941447731.db2.gz VLPBLXKLVJHOHF-OAHLLOKOSA-N 0 3 420.937 4.115 20 0 HIADHN CCS(=O)(=O)c1ccc([C@H](C)NCCOc2ccccc2C(F)(F)F)cc1 ZINC000551411320 941472215 /nfs/dbraw/zinc/47/22/15/941472215.db2.gz FIRSTBGRLPLXCE-AWEZNQCLSA-N 0 3 401.450 4.229 20 0 HIADHN CC(C)c1ccccc1OC[C@@H](O)CN[C@H](c1cncc(Br)c1)C1CC1 ZINC000551419123 941474642 /nfs/dbraw/zinc/47/46/42/941474642.db2.gz TVHJFLFZAXDHAD-RXVVDRJESA-N 0 3 419.363 4.448 20 0 HIADHN CC(C)c1ccccc1OC[C@H](O)CN[C@H](c1cncc(Br)c1)C1CC1 ZINC000551419120 941474696 /nfs/dbraw/zinc/47/46/96/941474696.db2.gz TVHJFLFZAXDHAD-NQIIRXRSSA-N 0 3 419.363 4.448 20 0 HIADHN CN(C(=O)c1ccc(NCc2cccc(OC(F)F)c2)cc1)[C@H]1CCCN(C)C1 ZINC000551446261 941480742 /nfs/dbraw/zinc/48/07/42/941480742.db2.gz JFBYHEAEEOQZLB-IBGZPJMESA-N 0 3 403.473 4.066 20 0 HIADHN CCN(CC)C(=O)Cn1ccc2cc(NC(=O)Nc3cccc(CN(C)C)c3)ccc21 ZINC000551477933 941487702 /nfs/dbraw/zinc/48/77/02/941487702.db2.gz XAEYSLBQEXVDBY-UHFFFAOYSA-N 0 3 421.545 4.215 20 0 HIADHN COc1ncc([C@H](C)N[C@H](C)c2cc(F)ccc2N2CCN(C)CC2)cc1Cl ZINC000551530210 941496104 /nfs/dbraw/zinc/49/61/04/941496104.db2.gz OZEOGWWUDOGIOW-LSDHHAIUSA-N 0 3 406.933 4.046 20 0 HIADHN Cc1nccn1-c1ccc(CNCc2cccc(I)c2)cc1F ZINC000551535959 941497246 /nfs/dbraw/zinc/49/72/46/941497246.db2.gz FTIMUDHNZCLDPH-UHFFFAOYSA-N 0 3 421.257 4.214 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)c2sc(Cc3ccccc3)nc2C)cc1 ZINC000551537173 941497646 /nfs/dbraw/zinc/49/76/46/941497646.db2.gz NSMPBCMMTPLLJX-HXUWFJFHSA-N 0 3 409.555 4.084 20 0 HIADHN CC(C)Oc1ccc([C@H](C)NCc2ccc(N3CCN(C)CC3)nc2)cc1Cl ZINC000551537597 941497747 /nfs/dbraw/zinc/49/77/47/941497747.db2.gz AYKPFEIVJREZFU-KRWDZBQOSA-N 0 3 402.970 4.125 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)c2ccc(OC3CCC3)cc2Cl)cc1 ZINC000551540448 941498023 /nfs/dbraw/zinc/49/80/23/941498023.db2.gz NVJFYXLMSQIZSD-NRFANRHFSA-N 0 3 402.922 4.313 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)[C@H]2C[C@@H]2c2ccc(C(F)(F)F)cc2)cc1 ZINC000551540910 941498225 /nfs/dbraw/zinc/49/82/25/941498225.db2.gz SMMLFSYGEBCGBJ-AABGKKOBSA-N 0 3 406.448 4.237 20 0 HIADHN CCCOc1c(Cl)cc(C(=O)N[C@@H](CN(C)C)c2ccc(OC)cc2)cc1OC ZINC000551541069 941498274 /nfs/dbraw/zinc/49/82/74/941498274.db2.gz LXNMWEYCTQMOTD-IBGZPJMESA-N 0 3 420.937 4.179 20 0 HIADHN Cn1c2ccccc2nc1[C@@H]1CCCCN1C[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000551699449 941528821 /nfs/dbraw/zinc/52/88/21/941528821.db2.gz CHYONUTWNVLWSX-RDGATRHJSA-N 0 3 418.585 4.391 20 0 HIADHN Cc1ccc(CN(C)C)cc1NC(=O)c1ccn(-c2ccc(Br)cc2)n1 ZINC000551714451 941531213 /nfs/dbraw/zinc/53/12/13/941531213.db2.gz JTVIWCRWQKXTHO-UHFFFAOYSA-N 0 3 413.319 4.257 20 0 HIADHN COc1ccc([C@H](NCc2cc(C(F)(F)F)cc(S(C)(=O)=O)c2)C2CC2)cc1 ZINC000551778563 941544003 /nfs/dbraw/zinc/54/40/03/941544003.db2.gz CSZUNGQTPZJBRF-LJQANCHMSA-N 0 3 413.461 4.358 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)COc2ccccc2-c2ccccc2)cc1 ZINC000551794096 941546170 /nfs/dbraw/zinc/54/61/70/941546170.db2.gz WSNCGFHQDHNQPP-QHCPKHFHSA-N 0 3 404.510 4.160 20 0 HIADHN CCCc1noc2nc(C3CC3)cc(C(=O)N[C@H](CN(C)C)c3ccc(OC)cc3)c12 ZINC000551795691 941546308 /nfs/dbraw/zinc/54/63/08/941546308.db2.gz PXLGAMRARPMOMR-OAQYLSRUSA-N 0 3 422.529 4.094 20 0 HIADHN COC(=O)c1ccc(CNC[C@H](c2ccccc2)C(C)(C)CO)c(Br)c1 ZINC000551806122 941548596 /nfs/dbraw/zinc/54/85/96/941548596.db2.gz NLVYJJQNVRPLDL-GOSISDBHSA-N 0 3 420.347 4.128 20 0 HIADHN CN(C)Cc1ccccc1NC(=O)c1ccc(Cl)c(I)c1 ZINC000551873441 941559899 /nfs/dbraw/zinc/55/98/99/941559899.db2.gz FBUAUODLLHZHJC-UHFFFAOYSA-N 0 3 414.674 4.259 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)c1cccc(C(=O)Nc2ccccc2)c1 ZINC000552005743 941567674 /nfs/dbraw/zinc/56/76/74/941567674.db2.gz MSJWYFZMIHHJNU-UHFFFAOYSA-N 0 3 403.482 4.261 20 0 HIADHN O=C([C@@H]1CN(Cc2ccccc2)CCC1(F)F)N1CCC(OCC2CCCC2)CC1 ZINC000552077088 941580903 /nfs/dbraw/zinc/58/09/03/941580903.db2.gz WAUSYNXXRLHLNU-QFIPXVFZSA-N 0 3 420.544 4.342 20 0 HIADHN OC1(CCN[C@@H](c2cccc(F)c2)c2cccc(Br)c2)CCOCC1 ZINC000552085694 941581587 /nfs/dbraw/zinc/58/15/87/941581587.db2.gz JAJLEZWLVVOUPZ-LJQANCHMSA-N 0 3 408.311 4.199 20 0 HIADHN C[C@@H](N[C@@H](c1cccc(OC(F)(F)F)c1)C1CC1)c1ccc(S(N)(=O)=O)cc1 ZINC000552085860 941581821 /nfs/dbraw/zinc/58/18/21/941581821.db2.gz OWGXHHKMHOUZAP-KZULUSFZSA-N 0 3 414.449 4.035 20 0 HIADHN CCc1nnc(NC(=O)[C@H](C)[C@@H](C)N[C@@H](C)c2ccc(F)cc2OC(F)F)s1 ZINC000552089173 941582540 /nfs/dbraw/zinc/58/25/40/941582540.db2.gz CABYFXSIHRFORR-MXWKQRLJSA-N 0 3 416.469 4.155 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)Cc1c(C)nn(C(C)C)c1C)c1ccc(Cl)cc1 ZINC000552103239 941585697 /nfs/dbraw/zinc/58/56/97/941585697.db2.gz JHFCZSTYHZFUIG-NRFANRHFSA-N 0 3 404.986 4.476 20 0 HIADHN Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1nc(C(C)C)oc1C ZINC000552115876 941587853 /nfs/dbraw/zinc/58/78/53/941587853.db2.gz RBDHNIYLPFVSTN-IBGZPJMESA-N 0 3 407.518 4.311 20 0 HIADHN COc1cc(CN2CCC[C@H](c3nnc(C4CC4)[nH]3)C2)ccc1OCc1ccncc1 ZINC000552203269 941601910 /nfs/dbraw/zinc/60/19/10/941601910.db2.gz FSBMEPYCEKLCTC-FQEVSTJZSA-N 0 3 419.529 4.044 20 0 HIADHN CCCN(C)[C@H](CNC(=O)C[C@@H](NC(C)=O)c1cccs1)c1ccc(Cl)cc1 ZINC000552241161 941610994 /nfs/dbraw/zinc/61/09/94/941610994.db2.gz CJJZFAGUFQRPQK-RTBURBONSA-N 0 3 421.994 4.168 20 0 HIADHN OC[C@H](CN[C@@H](c1ncc[nH]1)C1CCCCC1)Cc1cccc(OC(F)(F)F)c1 ZINC000552246406 941612627 /nfs/dbraw/zinc/61/26/27/941612627.db2.gz SZHYFMWRQJBRTE-QFBILLFUSA-N 0 3 411.468 4.371 20 0 HIADHN CO[C@@H]1C[C@@H](c2ccccc2)CC[C@@H]1NCC(=O)Nc1ccc(OC(F)F)cc1 ZINC000552268229 941618374 /nfs/dbraw/zinc/61/83/74/941618374.db2.gz BJLVYVMTGSXGEB-FFZOFVMBSA-N 0 3 404.457 4.167 20 0 HIADHN CO[C@@H]1C[C@H](c2ccccc2)CC[C@H]1N[C@H](C)C(=O)Nc1ccc2c(c1)OCCCO2 ZINC000552270793 941619234 /nfs/dbraw/zinc/61/92/34/941619234.db2.gz CJXGEJGQWRKENJ-HGPLWSSJSA-N 0 3 424.541 4.116 20 0 HIADHN CO[C@@H]1C[C@H](c2ccccc2)CC[C@@H]1N[C@@H](C)C(=O)Nc1ccc2c(c1)OCCCO2 ZINC000552270795 941619397 /nfs/dbraw/zinc/61/93/97/941619397.db2.gz CJXGEJGQWRKENJ-QYAKYFNYSA-N 0 3 424.541 4.116 20 0 HIADHN COC[C@@H](NC[C@H]1CC[C@@H](c2nc(C3CC3)no2)O1)c1cccc(C(F)(F)F)c1 ZINC000552324022 941632087 /nfs/dbraw/zinc/63/20/87/941632087.db2.gz YIHZKFGBQJZYSW-ZACQAIPSSA-N 0 3 411.424 4.163 20 0 HIADHN O=C(CCC(=O)N1CC[C@]2(CCN(Cc3ccccc3)C2)C1)c1ccc(F)c(F)c1 ZINC000552350845 941641668 /nfs/dbraw/zinc/64/16/68/941641668.db2.gz HTIYJRPPOIFFBC-DEOSSOPVSA-N 0 3 412.480 4.052 20 0 HIADHN Cc1ccc(C(=O)Nc2cccc(CNC[C@@H](O)COc3c(C)cccc3C)c2)cc1 ZINC000552487299 941686323 /nfs/dbraw/zinc/68/63/23/941686323.db2.gz KMZNLIITLJBWOL-XMMPIXPASA-N 0 3 418.537 4.394 20 0 HIADHN Cc1ccc(-n2cccn2)cc1NC(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000552493427 941687606 /nfs/dbraw/zinc/68/76/06/941687606.db2.gz PBYRUKUFYPWJHV-HXUWFJFHSA-N 0 3 410.468 4.277 20 0 HIADHN Cc1cccc2c1OCC[C@H]2NC(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F ZINC000552494554 941688977 /nfs/dbraw/zinc/68/89/77/941688977.db2.gz VMQPWOLPNTXGPV-VQTJNVASSA-N 0 3 400.469 4.092 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)[C@H]1C[C@H]1c1cccc(Cl)c1Cl ZINC000552515911 941691794 /nfs/dbraw/zinc/69/17/94/941691794.db2.gz CTJJUGCPVQGGQF-SZMVWBNQSA-N 0 3 405.325 4.302 20 0 HIADHN COc1ccc(OCc2ccccn2)c(CN2CCC[C@@H](c3nnc(C4CC4)[nH]3)C2)c1 ZINC000552522713 941695173 /nfs/dbraw/zinc/69/51/73/941695173.db2.gz BMJOJJQQWPCXRW-GOSISDBHSA-N 0 3 419.529 4.044 20 0 HIADHN CCS(=O)(=O)c1ccc([C@H](C)NCCc2nc(-c3cccc(Cl)c3)no2)cc1 ZINC000552570900 941709616 /nfs/dbraw/zinc/70/96/16/941709616.db2.gz IDOFBELGYXMEHX-AWEZNQCLSA-N 0 3 419.934 4.077 20 0 HIADHN CN(C)Cc1c2ccccc2oc1C(=O)NCCc1cnc(SC2CCCC2)nc1 ZINC000552793088 941764744 /nfs/dbraw/zinc/76/47/44/941764744.db2.gz FCUFGIWPGOUXOJ-UHFFFAOYSA-N 0 3 424.570 4.292 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)c2ccc(COc3ccc(F)cc3)o2)cc1 ZINC000552817490 941775701 /nfs/dbraw/zinc/77/57/01/941775701.db2.gz QEADGRKSYIAPBG-NRFANRHFSA-N 0 3 412.461 4.039 20 0 HIADHN Cc1cnc(CC(=O)N(Cc2ccncc2)[C@@H]2CCCN(Cc3ccccc3)C2)s1 ZINC000552850897 941787297 /nfs/dbraw/zinc/78/72/97/941787297.db2.gz AYRSNMYVRQSBCR-JOCHJYFZSA-N 0 3 420.582 4.082 20 0 HIADHN Cc1cc(C(=O)N(Cc2ccncc2)[C@H]2CCCN(Cc3ccccc3)C2)c(C)n1C ZINC000552850225 941787357 /nfs/dbraw/zinc/78/73/57/941787357.db2.gz SWRGSQXEQFPTFG-DEOSSOPVSA-N 0 3 416.569 4.344 20 0 HIADHN O=C(CCCn1cccc1)N(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000552851300 941787624 /nfs/dbraw/zinc/78/76/24/941787624.db2.gz SSIBTJMIXNYLEN-RUZDIDTESA-N 0 3 416.569 4.357 20 0 HIADHN O=C(CCCn1cccc1)N(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000552851301 941788289 /nfs/dbraw/zinc/78/82/89/941788289.db2.gz SSIBTJMIXNYLEN-VWLOTQADSA-N 0 3 416.569 4.357 20 0 HIADHN C[C@H](c1ccc(Cl)cc1)N(C)C(=O)CNC1(c2ccc(F)cc2)CCOCC1 ZINC000552945286 941806245 /nfs/dbraw/zinc/80/62/45/941806245.db2.gz MDEMOKJKSGMOEG-MRXNPFEDSA-N 0 3 404.913 4.294 20 0 HIADHN C[C@@H](N[C@H](C)c1ccc(-n2cccn2)cc1)C(=O)Nc1ccccc1OC(F)F ZINC000553034435 941820987 /nfs/dbraw/zinc/82/09/87/941820987.db2.gz HDZAYHBEQIFTFE-HUUCEWRRSA-N 0 3 400.429 4.152 20 0 HIADHN O=C(N[C@@H](CCO)c1ccc(Cl)c(Cl)c1)c1cccc(CN2CCCC2)c1 ZINC000553099682 941832732 /nfs/dbraw/zinc/83/27/32/941832732.db2.gz UULIELQUBLDQQW-FQEVSTJZSA-N 0 3 407.341 4.443 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)c1ccc(SCc2nc(C)no2)cc1 ZINC000553159177 941842292 /nfs/dbraw/zinc/84/22/92/941842292.db2.gz IOHNMUMARXIRRS-UHFFFAOYSA-N 0 3 402.564 4.008 20 0 HIADHN Cc1ccc(C(=O)N(Cc2ccncc2)[C@@H]2CCCN(Cc3ccccc3)C2)n1C ZINC000553197582 941847929 /nfs/dbraw/zinc/84/79/29/941847929.db2.gz RUTWIZWPZYNIEJ-HSZRJFAPSA-N 0 3 402.542 4.036 20 0 HIADHN O=C(c1cc2[nH]cnc2cc1F)N1CCCN(Cc2ccc(C(F)(F)F)cc2)CC1 ZINC000553225868 941852745 /nfs/dbraw/zinc/85/27/45/941852745.db2.gz OEVLTPHZVFQOLW-UHFFFAOYSA-N 0 3 420.410 4.069 20 0 HIADHN COc1cc(C)c([C@H](C)NC(=O)CN[C@H](c2ccc(F)c(C)c2)C2CC2)cc1OC ZINC000553283702 941860372 /nfs/dbraw/zinc/86/03/72/941860372.db2.gz FCSLYIWANXOIAW-FYSMJZIKSA-N 0 3 414.521 4.378 20 0 HIADHN Cc1cccc(C)c1NC(=O)CNC(=O)[C@@H](C)N[C@H](c1ccc(Cl)cc1)C(C)C ZINC000553368181 941873807 /nfs/dbraw/zinc/87/38/07/941873807.db2.gz USLCTNMTQXQVLY-UTKZUKDTSA-N 0 3 415.965 4.387 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)c2cccc(NC(=O)[C@@H]3C[C@@H]3C)c2)N(C)C)cc1 ZINC000553671051 941941188 /nfs/dbraw/zinc/94/11/88/941941188.db2.gz RPHMFNLWMMQBIW-IMRHEYAYSA-N 0 3 423.557 4.101 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)CCc2ncc(-c3ccccc3)o2)N(C)C)cc1 ZINC000553673445 941941704 /nfs/dbraw/zinc/94/17/04/941941704.db2.gz UGVHWMJWLGAIJO-QFIPXVFZSA-N 0 3 421.541 4.481 20 0 HIADHN CN1CC[C@H](NC(=O)NCc2cc(F)c(C(F)(F)F)cc2F)[C@@H]1c1ccccc1 ZINC000553703894 941947461 /nfs/dbraw/zinc/94/74/61/941947461.db2.gz NCSCBGYXFMVPBH-ROUUACIJSA-N 0 3 413.390 4.228 20 0 HIADHN Cc1nn(-c2ccccc2C)c2sc(C(=O)N3CC[C@@H](N4CCCC4)[C@@H]3C)cc12 ZINC000553774391 941965022 /nfs/dbraw/zinc/96/50/22/941965022.db2.gz KZMAKQMFVUWPAJ-FXAWDEMLSA-N 0 3 408.571 4.403 20 0 HIADHN Brc1cc2c(cc1CNCCc1nc(-c3ccncc3)cs1)OCO2 ZINC000553844062 941981999 /nfs/dbraw/zinc/98/19/99/941981999.db2.gz XTWKBOOPYMZMON-UHFFFAOYSA-N 0 3 418.316 4.029 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)N(CC)CCc1nccs1)c1ccc(Cl)cc1 ZINC000553896277 941992610 /nfs/dbraw/zinc/99/26/10/941992610.db2.gz YSXOKZYMGIGVNG-SFHVURJKSA-N 0 3 408.999 4.454 20 0 HIADHN CC(C)c1nn(-c2ccc(Br)cc2)cc1CN[C@@H](C)CO[C@@H]1CCOC1 ZINC000553898980 941994175 /nfs/dbraw/zinc/99/41/75/941994175.db2.gz RDDJCQQSQJVYRW-HNAYVOBHSA-N 0 3 422.367 4.042 20 0 HIADHN OCC[C@H](NC[C@H](O)COc1ccc(Cl)cc1Cl)c1ccc(Cl)cc1 ZINC000553944194 942004370 /nfs/dbraw/zinc/00/43/70/942004370.db2.gz PUHNTQQRBNPQSX-RDJZCZTQSA-N 0 3 404.721 4.100 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)[C@H]2C[C@H]2c2c(F)cccc2F)N(C)C)cc1 ZINC000554011486 942018674 /nfs/dbraw/zinc/01/86/74/942018674.db2.gz DQNCNYGMNKFLLY-LQWHRVPQSA-N 0 3 402.485 4.275 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)Cc2coc(-c3ccccc3)n2)N(C)C)cc1 ZINC000554013574 942019446 /nfs/dbraw/zinc/01/94/46/942019446.db2.gz WBJFMWNWEDCMOH-QFIPXVFZSA-N 0 3 407.514 4.090 20 0 HIADHN C[C@@H]1CCc2c(sc3nc(CCN(C)C[C@H]4OCCc5ccccc54)nc(N)c32)C1 ZINC000554030537 942022397 /nfs/dbraw/zinc/02/23/97/942022397.db2.gz ICXGOYFZVOPCRE-DNVCBOLYSA-N 0 3 422.598 4.187 20 0 HIADHN C[C@H]1C[C@@H](N[C@@H]2CCCN(S(=O)(=O)c3cccs3)C2)c2ccsc2S1 ZINC000554089038 942034337 /nfs/dbraw/zinc/03/43/37/942034337.db2.gz PBKGJLWQQRPUIS-GZBFAFLISA-N 0 3 414.643 4.178 20 0 HIADHN C[C@H](NC(=O)Nc1cc(N2CCCC2=O)ccc1Cl)[C@@H](c1ccccc1)N(C)C ZINC000554107295 942037557 /nfs/dbraw/zinc/03/75/57/942037557.db2.gz DBFUDTRTRNGWOS-BTYIYWSLSA-N 0 3 414.937 4.280 20 0 HIADHN COc1cccc(Cl)c1-c1noc(C)c1C(=O)N1CCN([C@@H]2C[C@@H]2C)C[C@H](C)C1 ZINC000554128436 942043478 /nfs/dbraw/zinc/04/34/78/942043478.db2.gz KGRDNNNEDXTBCY-GRDNDAEWSA-N 0 3 417.937 4.114 20 0 HIADHN CCOc1ccc(Nc2ncccc2C(=O)N2CCN([C@@H]3C[C@@H]3C)C[C@H](C)C2)cc1 ZINC000554132512 942044734 /nfs/dbraw/zinc/04/47/34/942044734.db2.gz VCHYUDKKYOHMJC-NPPFBWRTSA-N 0 3 408.546 4.026 20 0 HIADHN C[C@@H]1C[C@H]1N1CCN(C(=O)c2ccc(Sc3ccccc3Cl)nn2)C[C@@H](C)C1 ZINC000554132524 942045014 /nfs/dbraw/zinc/04/50/14/942045014.db2.gz VEZABZXBPQDBMA-HDMKZQKVSA-N 0 3 416.978 4.084 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)Nc1ccc(C(=O)NCC(C)C)cc1C)c1ccco1 ZINC000554182095 942060373 /nfs/dbraw/zinc/06/03/73/942060373.db2.gz OGRASFAPIFTGCS-YLJYHZDGSA-N 0 3 414.550 4.225 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)Nc1ccccc1OC[C@H]1CCCCO1)c1ccco1 ZINC000554192920 942063305 /nfs/dbraw/zinc/06/33/05/942063305.db2.gz NLHFGNQAMSUCSY-NSHGMRRFSA-N 0 3 415.534 4.478 20 0 HIADHN Cc1csc2nc(CN(Cc3ccccc3)[C@@H]3CC(C)(C)OC3(C)C)cc(=O)n12 ZINC000554198355 942063886 /nfs/dbraw/zinc/06/38/86/942063886.db2.gz LAQFVJFNYXZZLE-LJQANCHMSA-N 0 3 411.571 4.413 20 0 HIADHN CC(=O)NCC[C@@H]1CCCN(Cc2c(-c3ccc(Cl)cc3)nc3sccn23)C1 ZINC000554290478 942092258 /nfs/dbraw/zinc/09/22/58/942092258.db2.gz RVVRJWYJHJSSPL-INIZCTEOSA-N 0 3 416.978 4.454 20 0 HIADHN CCN1CCCN(C(=O)c2ccc(OCc3ccccc3Cl)c(OC)c2)CC1 ZINC000554300689 942095338 /nfs/dbraw/zinc/09/53/38/942095338.db2.gz FQTQUQWGVWLHPW-UHFFFAOYSA-N 0 3 402.922 4.095 20 0 HIADHN COc1cc(NC(=O)CCN2CC(C)(C)[C@H]2c2cccs2)cc(OC)c1OC ZINC000554311931 942099573 /nfs/dbraw/zinc/09/95/73/942099573.db2.gz XUKUEQKOLATZJW-HXUWFJFHSA-N 0 3 404.532 4.186 20 0 HIADHN CCCNC(=O)c1ccc(NC(=O)N(CCC)CCN2CCCCC2)cc1Cl ZINC000554426351 942138714 /nfs/dbraw/zinc/13/87/14/942138714.db2.gz QIVQUQVDZPXJBX-UHFFFAOYSA-N 0 3 408.974 4.210 20 0 HIADHN COc1ccc([C@@H](CN(C)C)NC(=O)N[C@@H](c2ccc(Cl)cc2)C2CC2)cc1 ZINC000554468325 942153733 /nfs/dbraw/zinc/15/37/33/942153733.db2.gz NKQDAKAWRAMKNI-NHCUHLMSSA-N 0 3 401.938 4.402 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)NCc1c(C)nn(-c2ccccc2)c1C)c1ccco1 ZINC000554476678 942156217 /nfs/dbraw/zinc/15/62/17/942156217.db2.gz YVBZWPNASXZWPG-KKSFZXQISA-N 0 3 409.534 4.011 20 0 HIADHN CS(=O)(=O)c1cccc([C@@H](N[C@@H]2CCC23CCOCC3)c2ccc(F)c(F)c2)c1 ZINC000554558914 942167428 /nfs/dbraw/zinc/16/74/28/942167428.db2.gz NEFLKVRBJOQEPC-NHCUHLMSSA-N 0 3 421.509 4.007 20 0 HIADHN C[C@H](CN(C)Cc1ccccc1)NC(=O)N1CCC(Oc2ccc(F)cc2F)CC1 ZINC000554706423 942205982 /nfs/dbraw/zinc/20/59/82/942205982.db2.gz KSWBSHVGORLWHD-QGZVFWFLSA-N 0 3 417.500 4.038 20 0 HIADHN CCn1cccc(CN[C@H]2CCCc3c4cc(Br)ccc4[nH]c32)c1=O ZINC000554743170 942218508 /nfs/dbraw/zinc/21/85/08/942218508.db2.gz YGRFDLYKDLKYAM-SFHVURJKSA-N 0 3 400.320 4.279 20 0 HIADHN CO[C@@H](C)c1noc(CN2CCCN(C(c3ccccc3)c3ccccc3)CC2)n1 ZINC000554820320 942260489 /nfs/dbraw/zinc/26/04/89/942260489.db2.gz RXLBSRIJKJOFFU-IBGZPJMESA-N 0 3 406.530 4.074 20 0 HIADHN COc1ccc([C@@H](CNC(=O)NC(C)(C)c2nc(C)c(C)s2)N2CCCC2)cc1 ZINC000554827949 942266580 /nfs/dbraw/zinc/26/65/80/942266580.db2.gz NJCYSYBVRVAKJH-LJQANCHMSA-N 0 3 416.591 4.140 20 0 HIADHN Cc1cccc(C)c1NC(=O)CNC(=O)[C@H](C)N1[C@@H]2CC[C@H]1C[C@@H](c1ccccc1)C2 ZINC000554837689 942274864 /nfs/dbraw/zinc/27/48/64/942274864.db2.gz SKMFKIQYFODZFH-SNJCGAMXSA-N 0 3 419.569 4.157 20 0 HIADHN CCOC(=O)c1csc(C2CCN(Cc3ccc(O)c4nc(C)ccc34)CC2)n1 ZINC000554847395 942285003 /nfs/dbraw/zinc/28/50/03/942285003.db2.gz CGLFDIWXFKKMAN-UHFFFAOYSA-N 0 3 411.527 4.262 20 0 HIADHN CC(C)c1nn(-c2ccccc2)cc1CN1CCC[C@H](CNC(=O)CC(F)(F)F)C1 ZINC000554873047 942302662 /nfs/dbraw/zinc/30/26/62/942302662.db2.gz GCFFDLUNALKPHB-QGZVFWFLSA-N 0 3 422.495 4.276 20 0 HIADHN Cc1noc(-c2ccc(C)c(NC(=O)N[C@@H](CN(C)C)c3ccc(Cl)cc3)c2)n1 ZINC000554908775 942315568 /nfs/dbraw/zinc/31/55/68/942315568.db2.gz NREOASYTYNVMLQ-IBGZPJMESA-N 0 3 413.909 4.431 20 0 HIADHN CCc1nc2cc(CNC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)ccc2n1C1CC1 ZINC000554937021 942325293 /nfs/dbraw/zinc/32/52/93/942325293.db2.gz AFMRJUPIAYKWQH-HXUWFJFHSA-N 0 3 417.557 4.007 20 0 HIADHN Brc1ccc2ncc(CN[C@@H]3c4ccccc4CC34CCOCC4)n2c1 ZINC000554982080 942342088 /nfs/dbraw/zinc/34/20/88/942342088.db2.gz MDJQMTZDYOPGPI-HXUWFJFHSA-N 0 3 412.331 4.281 20 0 HIADHN C[C@@H](Cc1cnc2ccccc2n1)C(=O)NC[C@H](c1cccs1)N1CCC(C)CC1 ZINC000555031759 942363757 /nfs/dbraw/zinc/36/37/57/942363757.db2.gz GREMDDIBEQCRRZ-PGRDOPGGSA-N 0 3 422.598 4.459 20 0 HIADHN COc1cc(CN2CC[C@]3(C2)CCc2ccccc2O3)cc(OC)c1OCC(F)F ZINC000555104963 942386916 /nfs/dbraw/zinc/38/69/16/942386916.db2.gz XHTKTDAELXFIJL-QHCPKHFHSA-N 0 3 419.468 4.317 20 0 HIADHN CCN1CC[C@H](N[C@@H](C)C(=O)Nc2ccc(OC)cc2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000555125031 942391746 /nfs/dbraw/zinc/39/17/46/942391746.db2.gz BFMMRLCPZXFDRF-WVFSVQOHSA-N 0 3 419.928 4.240 20 0 HIADHN Cc1ccccc1CNC(=O)[C@H](C)N[C@@H]1CCN(C(C)C)[C@H]1c1ccc(F)c(F)c1 ZINC000555126533 942393317 /nfs/dbraw/zinc/39/33/17/942393317.db2.gz XIYINMZUKQLYSE-IMRHEYAYSA-N 0 3 415.528 4.092 20 0 HIADHN COc1cccc([C@@H]2[C@@H](N[C@H](C)C(=O)Nc3ccc(C)c(F)c3)CCN2C2CC2)c1 ZINC000555126511 942393420 /nfs/dbraw/zinc/39/34/20/942393420.db2.gz WZYLKWKZPQFZNH-UZFJHSOTSA-N 0 3 411.521 4.037 20 0 HIADHN CCOc1ccc(NC(=O)CN[C@H]2CCN(C(C)C)[C@H]2c2ccc(F)c(F)c2)cc1 ZINC000555133282 942397022 /nfs/dbraw/zinc/39/70/22/942397022.db2.gz QWVVZFOIHDFGJF-GMAHTHKFSA-N 0 3 417.500 4.116 20 0 HIADHN CN(C)C[C@H](NC(=O)N[C@H]1CCO[C@@H](c2ccccc2)C1)c1ccc(Cl)cc1 ZINC000555146808 942404583 /nfs/dbraw/zinc/40/45/83/942404583.db2.gz NRSYNZXXTXOFDF-PCCBWWKXSA-N 0 3 401.938 4.162 20 0 HIADHN COCCCN(C(=O)C[C@@H](Cc1ccccc1)c1ccccc1)C1CCN(C)CC1 ZINC000555166192 942412982 /nfs/dbraw/zinc/41/29/82/942412982.db2.gz CAVXFUGYJJEVDM-XMMPIXPASA-N 0 3 408.586 4.362 20 0 HIADHN C[C@@H](NC(=O)N[C@@H](CN(C)C)c1ccc(Cl)cc1)c1nc(C(F)(F)F)cs1 ZINC000555206532 942431939 /nfs/dbraw/zinc/43/19/39/942431939.db2.gz ISSGMICMRKMOAX-MFKMUULPSA-N 0 3 420.888 4.478 20 0 HIADHN CN(C)C[C@@H](NC(=O)c1cc(N2CCCC2=O)ccc1Cl)c1ccc(Cl)cc1 ZINC000555229902 942437960 /nfs/dbraw/zinc/43/79/60/942437960.db2.gz QIRIWHRNDZHWFQ-LJQANCHMSA-N 0 3 420.340 4.153 20 0 HIADHN Cc1c(C(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)cnn1-c1ccc(F)cc1F ZINC000555230406 942437997 /nfs/dbraw/zinc/43/79/97/942437997.db2.gz MTHLDFIWONTFEX-LJQANCHMSA-N 0 3 418.875 4.145 20 0 HIADHN CCc1nc2cc(CN[C@@H](C)c3cccc(NS(C)(=O)=O)c3)ccc2n1C1CC1 ZINC000555232611 942438816 /nfs/dbraw/zinc/43/88/16/942438816.db2.gz IVKDPMXXKIBBJH-HNNXBMFYSA-N 0 3 412.559 4.156 20 0 HIADHN COc1ccc(CN(C)C)cc1NC(=O)N[C@@H]1C[C@H]1c1ccc(OC(F)F)cc1 ZINC000555343981 942485631 /nfs/dbraw/zinc/48/56/31/942485631.db2.gz MMHZKWHOQKIWAN-DLBZAZTESA-N 0 3 405.445 4.036 20 0 HIADHN Clc1cccc(-c2n[nH]cc2CN(Cc2ccc(-n3cncn3)cc2)C2CC2)c1 ZINC000555368452 942499308 /nfs/dbraw/zinc/49/93/08/942499308.db2.gz RALMUMBFFSCHTB-UHFFFAOYSA-N 0 3 404.905 4.475 20 0 HIADHN CCC[C@@H]1CN(c2nnc(C3CCC3)n2C[C@H]2CCCO2)CCN1Cc1ccccc1 ZINC000555394868 942512214 /nfs/dbraw/zinc/51/22/14/942512214.db2.gz LXHCVNBSKOJFJI-DHIUTWEWSA-N 0 3 423.605 4.216 20 0 HIADHN O=C(NC[C@H](c1cccs1)N1CCCC1)N1CCC(OC2CCCCC2)CC1 ZINC000555618092 942671402 /nfs/dbraw/zinc/67/14/02/942671402.db2.gz HWELKBSQEGILBC-HXUWFJFHSA-N 0 3 405.608 4.408 20 0 HIADHN CCO[C@@H]1C[C@H](NCc2cc(Br)cc(C(F)(F)F)c2)[C@@H]1n1cccn1 ZINC000555648459 942687240 /nfs/dbraw/zinc/68/72/40/942687240.db2.gz NDXNJDPOYRFWOI-XHSDSOJGSA-N 0 3 418.257 4.173 20 0 HIADHN CCC[C@@H](NCc1ccc(OC(F)(F)F)cc1)C(=O)N1CCc2sccc2C1 ZINC000555779330 942729924 /nfs/dbraw/zinc/72/99/24/942729924.db2.gz SENJHUXXSNQQLZ-QGZVFWFLSA-N 0 3 412.477 4.490 20 0 HIADHN COC[C@@H](NC(=O)N(CCN(C)C)Cc1ccc(C(F)(F)F)cc1)c1ccccc1 ZINC000555802795 942738499 /nfs/dbraw/zinc/73/84/99/942738499.db2.gz SJENBROWUOXQSS-HXUWFJFHSA-N 0 3 423.479 4.166 20 0 HIADHN COCc1cccc2sc(NC(=O)[C@@H]3CN(C(C)(C)C)C[C@H]3C(F)(F)F)nc21 ZINC000555901041 942768668 /nfs/dbraw/zinc/76/86/68/942768668.db2.gz QFNCUPZQZQXBOQ-CHWSQXEVSA-N 0 3 415.481 4.290 20 0 HIADHN CCN(CC)[C@H](CNC(=O)Cc1nc(C(C)C)c(C)s1)c1cccc(OC)c1 ZINC000556067222 942800686 /nfs/dbraw/zinc/80/06/86/942800686.db2.gz FOSDOFDIPHBMCN-LJQANCHMSA-N 0 3 403.592 4.325 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)Cc1nc(C(C)C)c(C)s1)c1cccc(OC)c1 ZINC000556067219 942800815 /nfs/dbraw/zinc/80/08/15/942800815.db2.gz FOSDOFDIPHBMCN-IBGZPJMESA-N 0 3 403.592 4.325 20 0 HIADHN CN1CC[C@@H](NC(=O)C(C)(C)c2ccc(Br)cc2)[C@@H]1c1ccccc1 ZINC000556187549 942815982 /nfs/dbraw/zinc/81/59/82/942815982.db2.gz GECAFKDBJBVVAB-MOPGFXCFSA-N 0 3 401.348 4.288 20 0 HIADHN C[C@H](c1ccccc1F)N1CCC[C@H](N[C@@H](C)c2ccc3c(c2)OCCCO3)C1=O ZINC000556223966 942821450 /nfs/dbraw/zinc/82/14/50/942821450.db2.gz LVXLXFPQFFMKJK-FVJLSDCUSA-N 0 3 412.505 4.390 20 0 HIADHN CS[C@H]1CN(C(=O)c2ccccc2-c2ncc(-c3ccccc3)o2)C[C@@H]1N(C)C ZINC000556279537 942831629 /nfs/dbraw/zinc/83/16/29/942831629.db2.gz OJRZZWYDKGAPJE-FPOVZHCZSA-N 0 3 407.539 4.126 20 0 HIADHN CC[C@@H](CNC(=O)Nc1ccc(Oc2cccnc2)nc1)N1CCc2ccccc2C1 ZINC000556307289 942837152 /nfs/dbraw/zinc/83/71/52/942837152.db2.gz BLQLPZQSILHNDN-NRFANRHFSA-N 0 3 417.513 4.227 20 0 HIADHN Cc1cc(NC(=O)COc2ccsc2Cl)cc(N2CCN(C(C)C)CC2)c1 ZINC000556476543 942880068 /nfs/dbraw/zinc/88/00/68/942880068.db2.gz ODKIKEVVJLXYEZ-UHFFFAOYSA-N 0 3 407.967 4.258 20 0 HIADHN Fc1ccc([C@H]2CN(C[C@@H]3CN(Cc4ccccc4)CCCO3)CCO2)cc1Cl ZINC000556498054 942884766 /nfs/dbraw/zinc/88/47/66/942884766.db2.gz UZGVOUNXMJEBKP-NZQKXSOJSA-N 0 3 418.940 4.144 20 0 HIADHN Cc1ccc(C)c(Sc2ccc(NC(=O)CN[C@@H]3CCC(=O)N[C@H]3C3CC3)cc2)c1 ZINC000556523050 942891472 /nfs/dbraw/zinc/89/14/72/942891472.db2.gz SZKSBJSVDOBQGN-YKSBVNFPSA-N 0 3 423.582 4.040 20 0 HIADHN CCN1CCN(c2ccc(F)cc2[C@H](C)N[C@@H](C)c2cnc(OC)c(Cl)c2)CC1 ZINC000556582647 942906495 /nfs/dbraw/zinc/90/64/95/942906495.db2.gz CDAVZKPUMBMOSM-HOTGVXAUSA-N 0 3 420.960 4.436 20 0 HIADHN C[C@H](NC[C@@H](c1ccc(Cl)cc1)N1CCc2sccc2C1)c1ccc(=O)[nH]n1 ZINC000556857514 942941290 /nfs/dbraw/zinc/94/12/90/942941290.db2.gz BQGSMRXWSVNBLZ-LIRRHRJNSA-N 0 3 414.962 4.347 20 0 HIADHN Cn1nccc1-c1ccccc1CN1CCC[C@H](NC(=O)CCCc2ccccc2)C1 ZINC000556862802 942943057 /nfs/dbraw/zinc/94/30/57/942943057.db2.gz BILOOVGNZHXHQR-QHCPKHFHSA-N 0 3 416.569 4.191 20 0 HIADHN OC[C@H](CN[C@@H](c1ncc[nH]1)C1CCCCC1)Cc1cccc(Br)c1 ZINC000556879304 942948529 /nfs/dbraw/zinc/94/85/29/942948529.db2.gz RQTBTJORULYKKA-QFBILLFUSA-N 0 3 406.368 4.234 20 0 HIADHN CCOc1cc(C[NH2+]C[C@@H](C)COCc2ccccc2)cc(Br)c1[O-] ZINC000556893052 942954450 /nfs/dbraw/zinc/95/44/50/942954450.db2.gz OFLSMBYDIFKMQR-OAHLLOKOSA-N 0 3 408.336 4.496 20 0 HIADHN Cc1cc2cc(CN[C@@H](CN3CCC(C(N)=O)CC3)c3ccc(Cl)cc3)ccc2[nH]1 ZINC000556913268 942963104 /nfs/dbraw/zinc/96/31/04/942963104.db2.gz RWTJESZENNJAHV-QHCPKHFHSA-N 0 3 424.976 4.158 20 0 HIADHN CCCN(C)[C@H](CNC(=O)C12CCC(C(=O)OC)(CC1)CC2)c1ccc(Cl)cc1 ZINC000556927082 942969355 /nfs/dbraw/zinc/96/93/55/942969355.db2.gz MIYZFGGHCQECAD-YUVSOPLDSA-N 0 3 420.981 4.353 20 0 HIADHN CN(CCCN(C)C(=O)c1ccc(-n2cnc3ccccc32)cc1)Cc1ccncc1 ZINC000556933837 942972754 /nfs/dbraw/zinc/97/27/54/942972754.db2.gz QIXXIEYZITWNGY-UHFFFAOYSA-N 0 3 413.525 4.015 20 0 HIADHN O[C@@H](CN[C@H]1CCSc2ccc(F)cc21)COc1cccc(Br)c1 ZINC000557013961 942994212 /nfs/dbraw/zinc/99/42/12/942994212.db2.gz LXSQQGDUWFMXHW-YOEHRIQHSA-N 0 3 412.324 4.155 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)c1ccc2c(c1)CCC(=O)N2C)c1ccc(Cl)cc1 ZINC000557058646 943007932 /nfs/dbraw/zinc/00/79/32/943007932.db2.gz GSQOGXLCQUUWMJ-NRFANRHFSA-N 0 3 413.949 4.062 20 0 HIADHN CCOc1ccc(-c2nc(CC)c(C(=O)N3C[C@H](N4CCCC4)C[C@H]3C)s2)cc1 ZINC000557128088 943026886 /nfs/dbraw/zinc/02/68/86/943026886.db2.gz VLIDSGMRMFGAES-SJLPKXTDSA-N 0 3 413.587 4.470 20 0 HIADHN COc1ccc([C@H](CN(C)C)NC(=O)c2ccc(Sc3ccccn3)cc2)cc1 ZINC000557206655 943051096 /nfs/dbraw/zinc/05/10/96/943051096.db2.gz VWIUEQGPYGBGRF-NRFANRHFSA-N 0 3 407.539 4.274 20 0 HIADHN O[C@@H](CNCc1ccc(-n2ccnc2)c(F)c1)COc1ccc(-c2ccccc2)cc1 ZINC000557221690 943055667 /nfs/dbraw/zinc/05/56/67/943055667.db2.gz UACHIKLUIVNSHS-QFIPXVFZSA-N 0 3 417.484 4.208 20 0 HIADHN CCN1CCN(c2ccccc2N[C@H](C)c2ccc(-n3cncn3)cc2Cl)CC1 ZINC000557444627 943129550 /nfs/dbraw/zinc/12/95/50/943129550.db2.gz IAEQQCCOSYUIFD-QGZVFWFLSA-N 0 3 410.953 4.236 20 0 HIADHN C[C@@H]1C[C@@H](C(=O)N(Cc2ccncc2)[C@H]2CCCN(Cc3ccccc3)C2)C[C@H](C)O1 ZINC000557449434 943134119 /nfs/dbraw/zinc/13/41/19/943134119.db2.gz RXVKGRCPPAQRID-JQOLTRQRSA-N 0 3 421.585 4.278 20 0 HIADHN CC(C)c1ccc2occ(C(=O)NCc3ccccc3CN3CCC(O)CC3)c2c1 ZINC000557562473 943210618 /nfs/dbraw/zinc/21/06/18/943210618.db2.gz IBWUKHPDFAPHOM-UHFFFAOYSA-N 0 3 406.526 4.443 20 0 HIADHN Cc1nc(COc2ccc(Cl)cc2)sc1C(=O)N1C[C@H](N2CCCC2)C[C@@H]1C ZINC000557599703 943226639 /nfs/dbraw/zinc/22/66/39/943226639.db2.gz HZZCRTHLRZVZRN-WMLDXEAASA-N 0 3 419.978 4.383 20 0 HIADHN C[C@@H](C(=O)N1CCC[C@H](c2n[nH]cc2CN2CCCC2)C1)c1cc2ccccc2o1 ZINC000557645887 943247103 /nfs/dbraw/zinc/24/71/03/943247103.db2.gz MGOSEXHLANJQBI-MJGOQNOKSA-N 0 3 406.530 4.261 20 0 HIADHN O=S(=O)(NC1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1)c1ccc(C(F)F)cc1 ZINC000557819143 943303360 /nfs/dbraw/zinc/30/33/60/943303360.db2.gz BZSCDWOUINSGKW-YQQQUEKLSA-N 0 3 406.498 4.098 20 0 HIADHN Cc1nc(Cc2ccc(F)cc2)sc1C(=O)N1CCN(C2CCC2)C[C@@H](C)C1 ZINC000557837174 943309416 /nfs/dbraw/zinc/30/94/16/943309416.db2.gz GIKGKCAIIKRQQN-OAHLLOKOSA-N 0 3 401.551 4.128 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)C1CCC(NC(=O)CC2CCCC2)CC1)c1ccco1 ZINC000557912637 943327590 /nfs/dbraw/zinc/32/75/90/943327590.db2.gz WCWOHHIJDQCAAU-RLHVNXBHSA-N 0 3 417.594 4.080 20 0 HIADHN Cc1c(C(=O)NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)cnn1-c1ccccc1F ZINC000557936371 943333785 /nfs/dbraw/zinc/33/37/85/943333785.db2.gz DJWBRKQLZKUSDD-HSZRJFAPSA-N 0 3 424.520 4.140 20 0 HIADHN Cc1cccc(C(=O)N2CCN([C@@H]3C[C@@H]3C)C[C@H](C)C2)c1NC(=O)c1ccccc1F ZINC000558026343 943359914 /nfs/dbraw/zinc/35/99/14/943359914.db2.gz WMEHHIUIAGIYDY-SGXKBVARSA-N 0 3 423.532 4.189 20 0 HIADHN C[C@H]1C[C@@H]1N1CCN(C(=O)CCC(=O)c2cc(Cl)sc2Cl)C[C@@H](C)C1 ZINC000558025767 943359939 /nfs/dbraw/zinc/35/99/39/943359939.db2.gz PDMVSNDCDWXCDJ-OBJOEFQTSA-N 0 3 403.375 4.207 20 0 HIADHN CCN1CCN(Cc2ccccc2CN[C@@H](COC)c2cccc(Cl)c2F)CC1 ZINC000558225899 943445590 /nfs/dbraw/zinc/44/55/90/943445590.db2.gz KYJJSYXEKFVQQP-QFIPXVFZSA-N 0 3 419.972 4.094 20 0 HIADHN C[C@@H](NC(=O)Nc1cc2c(cc1Cl)OCCCO2)[C@@H](c1ccccc1)N(C)C ZINC000558244033 943454779 /nfs/dbraw/zinc/45/47/79/943454779.db2.gz NNBNOQOZSMRPDB-VLIAUNLRSA-N 0 3 403.910 4.314 20 0 HIADHN FC(F)(F)[C@@H]1C[C@@H](NCc2ccc(Cl)cc2I)CCO1 ZINC000558254169 943461365 /nfs/dbraw/zinc/46/13/65/943461365.db2.gz AVGJBWABBWIDRF-JQWIXIFHSA-N 0 3 419.612 4.144 20 0 HIADHN Cc1cccc(C(=O)N2CCCC2)c1NC(=O)N[C@H](C)[C@@H](c1ccccc1)N(C)C ZINC000558268259 943470459 /nfs/dbraw/zinc/47/04/59/943470459.db2.gz ROSXZUBNTYSBTH-GCJKJVERSA-N 0 3 408.546 4.044 20 0 HIADHN CC[C@@H](C)N[C@H](CNC(=O)Nc1ccc(C(=O)N[C@@H](C)CC)cc1C)c1ccco1 ZINC000558309770 943497375 /nfs/dbraw/zinc/49/73/75/943497375.db2.gz NLOPCQTXHXMKKK-FUHIMQAGSA-N 0 3 414.550 4.367 20 0 HIADHN Brc1ccc2[nH]cc(Cc3noc(C4CCN(C5CC5)CC4)n3)c2c1 ZINC000558336111 943514142 /nfs/dbraw/zinc/51/41/42/943514142.db2.gz RAFHARJDTIIETL-UHFFFAOYSA-N 0 3 401.308 4.246 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)Nc1ccc(OC)cc1Br)c1ccco1 ZINC000558361633 943525826 /nfs/dbraw/zinc/52/58/26/943525826.db2.gz PHTFOMOATCAALG-WBMJQRKESA-N 0 3 410.312 4.302 20 0 HIADHN O=C(NC[C@@H](c1c[nH]c2ccccc21)c1ccccc1Cl)N1CCN2CCC1CC2 ZINC000558383324 943538244 /nfs/dbraw/zinc/53/82/44/943538244.db2.gz ZGBUUMJNOHIAKR-HXUWFJFHSA-N 0 3 422.960 4.443 20 0 HIADHN Cc1ccc(CCCN(CCn2ccnc2)Cc2ccc(Br)o2)cn1 ZINC000558422180 943555928 /nfs/dbraw/zinc/55/59/28/943555928.db2.gz OWSOEMKTAGTJAH-UHFFFAOYSA-N 0 3 403.324 4.077 20 0 HIADHN CN(CCCN(C)C(=O)Nc1nc(Sc2ccccc2)ns1)Cc1ccco1 ZINC000558451828 943563215 /nfs/dbraw/zinc/56/32/15/943563215.db2.gz CGXAEFXNVAOXCU-UHFFFAOYSA-N 0 3 417.560 4.268 20 0 HIADHN CN(CCN1CCCC1)C(=O)C(C)(C)c1csc(-c2c(F)cccc2Cl)n1 ZINC000558525067 943588333 /nfs/dbraw/zinc/58/83/33/943588333.db2.gz XLFADAMSRVLKHZ-UHFFFAOYSA-N 0 3 409.958 4.434 20 0 HIADHN CCN1CCN(Cc2ccc(NC(=O)c3c(C)cccc3Br)cc2)CC1 ZINC000558601691 943614345 /nfs/dbraw/zinc/61/43/45/943614345.db2.gz KSCGRVYJDIPITL-UHFFFAOYSA-N 0 3 416.363 4.147 20 0 HIADHN C[C@H]1CC[C@@H](CCC(=O)N(Cc2ccccc2Br)C2CCN(C)CC2)O1 ZINC000558610454 943617025 /nfs/dbraw/zinc/61/70/25/943617025.db2.gz VFWDWYRIDRDYFG-LPHOPBHVSA-N 0 3 423.395 4.220 20 0 HIADHN CCCN(C(=O)Cc1cc2ccccc2[nH]c1=O)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000558639255 943623019 /nfs/dbraw/zinc/62/30/19/943623019.db2.gz IPNNJYJKHTYJRY-QHCPKHFHSA-N 0 3 417.553 4.386 20 0 HIADHN CCOC(=O)C1CCC(N(CC)Cc2csc(-c3ccc4c(c3)OCO4)n2)CC1 ZINC000558744953 943638662 /nfs/dbraw/zinc/63/86/62/943638662.db2.gz ZTWSFHQRBIJQNK-UHFFFAOYSA-N 0 3 416.543 4.483 20 0 HIADHN COCCn1ccc2ccc(NC(=O)N[C@@H](CN(C)C)c3ccc(Cl)cc3)cc21 ZINC000558785932 943662741 /nfs/dbraw/zinc/66/27/41/943662741.db2.gz USRNTRQEHBKFSN-FQEVSTJZSA-N 0 3 414.937 4.366 20 0 HIADHN CN(C)CCN(C[C@H]1CCCO1)C(=O)Nc1ccc(-c2ccc(Cl)s2)nc1 ZINC000558845175 943694421 /nfs/dbraw/zinc/69/44/21/943694421.db2.gz QJPNMZCRKMJKMJ-OAHLLOKOSA-N 0 3 408.955 4.038 20 0 HIADHN O=C(NC[C@@H](c1cccs1)N1CCCC1)N1CC[C@](F)(c2ccccc2F)C1 ZINC000558884300 943717825 /nfs/dbraw/zinc/71/78/25/943717825.db2.gz AXBMIFFNDNSHQX-GHTZIAJQSA-N 0 3 405.514 4.304 20 0 HIADHN CC(C)N1CC[C@@H](NCC(=O)N(C2CC2)C2CCCC2)[C@H]1c1ccc(F)c(F)c1 ZINC000558895643 943729296 /nfs/dbraw/zinc/72/92/96/943729296.db2.gz KRHHXHUKXACIDY-FYYLOGMGSA-N 0 3 405.533 4.012 20 0 HIADHN CC(C)N1CC[C@H](NCC(=O)N[C@@H](C)c2ccc(F)cc2)[C@H]1c1ccc(F)c(F)c1 ZINC000558895659 943729794 /nfs/dbraw/zinc/72/97/94/943729794.db2.gz LBOYSYIRZDDCHQ-VSUDMRMVSA-N 0 3 419.491 4.095 20 0 HIADHN CCN1CC[C@@H](NCC(=O)Nc2cccc(C(C)=O)c2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000558896843 943731310 /nfs/dbraw/zinc/73/13/10/943731310.db2.gz OBDDWNYLALOVHG-IFMALSPDSA-N 0 3 417.912 4.045 20 0 HIADHN CCN1CC[C@H](N[C@H](C)C(=O)Nc2cccc(C)c2C)[C@H]1c1cc(F)c(F)c(F)c1 ZINC000558899312 943734326 /nfs/dbraw/zinc/73/43/26/943734326.db2.gz AQASSLKYDJQFGL-UPKQVVFYSA-N 0 3 419.491 4.473 20 0 HIADHN CC(C)(C)N1CC[C@H](NCC(=O)Nc2nccs2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000558902138 943736446 /nfs/dbraw/zinc/73/64/46/943736446.db2.gz MVQTYXRRVDMPON-RDJZCZTQSA-N 0 3 410.946 4.078 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@H](NCc2ccc(-n3nc(C)cc3C)nc2)c2ccccc21 ZINC000558918730 943746547 /nfs/dbraw/zinc/74/65/47/943746547.db2.gz HIBSBXXGYDDLGN-YADHBBJMSA-N 0 3 404.514 4.156 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@@H](NCc2ccc(-n3nc(C)cc3C)nc2)c2ccccc21 ZINC000558918722 943746944 /nfs/dbraw/zinc/74/69/44/943746944.db2.gz HIBSBXXGYDDLGN-FGZHOGPDSA-N 0 3 404.514 4.156 20 0 HIADHN CCN(CC)[C@@H](CNC(=O)[C@@H](C)Cc1cnc2ccccc2n1)c1cccc(OC)c1 ZINC000558932143 943754259 /nfs/dbraw/zinc/75/42/59/943754259.db2.gz SYGWNENFTIEGAZ-UUOWRZLLSA-N 0 3 420.557 4.016 20 0 HIADHN CCOC(=O)[C@@H]1CC[C@H](NCc2ccc(C)cc2O[C@H]2CCOC2)c2ccccc21 ZINC000558976314 943780611 /nfs/dbraw/zinc/78/06/11/943780611.db2.gz NNAGWDAYDOWAMI-PMOQBDJRSA-N 0 3 409.526 4.434 20 0 HIADHN Cc1cc(NC(=O)CCc2ncc(C(C)(C)C)o2)cc(N2CCN(C(C)C)CC2)c1 ZINC000559043856 943813954 /nfs/dbraw/zinc/81/39/54/943813954.db2.gz QWTZBOGQENKXIP-UHFFFAOYSA-N 0 3 412.578 4.382 20 0 HIADHN C[C@H](c1ccc(F)cc1)N1CC[C@H](N[C@@H](C)c2ccc(NC(=O)C3CC3)cc2)C1=O ZINC000559147384 943853831 /nfs/dbraw/zinc/85/38/31/943853831.db2.gz WHYNRFHHXSUQEI-DMPWYTOCSA-N 0 3 409.505 4.187 20 0 HIADHN O=C(NCCN1CCCC1)c1ccc(NCc2cc(F)ccc2Br)cc1 ZINC000559226123 943879400 /nfs/dbraw/zinc/87/94/00/943879400.db2.gz IZSKDWNTPABSNL-UHFFFAOYSA-N 0 3 420.326 4.026 20 0 HIADHN Cc1cc(C[C@H](C)NCc2c(Cl)cccc2N2CCOCC2)n(-c2ccccc2)n1 ZINC000559282742 943889929 /nfs/dbraw/zinc/88/99/29/943889929.db2.gz UWYUPVGTPDCNQO-SFHVURJKSA-N 0 3 424.976 4.392 20 0 HIADHN Cn1c(CNCCc2cnc(SC3CCCC3)nc2)nc2ccc(Cl)cc21 ZINC000559352525 943904771 /nfs/dbraw/zinc/90/47/71/943904771.db2.gz QBERJBPQKIDYJO-UHFFFAOYSA-N 0 3 401.967 4.384 20 0 HIADHN CC(=O)Nc1ccc(OC[C@H](O)CN2CCc3ccccc3[C@@H]2c2ccccc2)cc1 ZINC000559368341 943913962 /nfs/dbraw/zinc/91/39/62/943913962.db2.gz BAPNEETZPAROET-BVAGGSTKSA-N 0 3 416.521 4.032 20 0 HIADHN CN1CC[C@H](NCC(=O)N[C@H](c2cccs2)c2ccc(F)cc2)[C@H]1c1ccccc1 ZINC000559777704 944049190 /nfs/dbraw/zinc/04/91/90/944049190.db2.gz TXCYHYGOLZIOEH-NKKJXINNSA-N 0 3 423.557 4.128 20 0 HIADHN Cc1cc(CN(C)C)cc(NC(=O)[C@@H](NC(=O)c2ccccc2)c2ccccc2)c1 ZINC000559814499 944059608 /nfs/dbraw/zinc/05/96/08/944059608.db2.gz NSQXCNTXVKCPGM-QHCPKHFHSA-N 0 3 401.510 4.166 20 0 HIADHN CCC(CC)(C[NH2+][C@H](c1cccs1)c1nnc[n-]1)c1ccc(OC)c(OC)c1 ZINC000559841857 944064567 /nfs/dbraw/zinc/06/45/67/944064567.db2.gz BVCKMQQIQASPPC-LJQANCHMSA-N 0 3 400.548 4.320 20 0 HIADHN Fc1ccc([C@H](NCCc2c[nH]c3cccc(Br)c23)c2nnc[nH]2)cc1 ZINC000559856836 944069078 /nfs/dbraw/zinc/06/90/78/944069078.db2.gz VQFZIJPFILPZSS-SFHVURJKSA-N 0 3 414.282 4.109 20 0 HIADHN C[C@H](N[C@@H]1CCCN([C@@H](C)c2ccccc2F)C1=O)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000559878654 944072970 /nfs/dbraw/zinc/07/29/70/944072970.db2.gz NAADDFAOPIBJFR-PONJGIIJSA-N 0 3 423.532 4.458 20 0 HIADHN C[C@@H](Cn1cc(Br)ccc1=O)NCc1ccccc1OC1CCCC1 ZINC000559893379 944077593 /nfs/dbraw/zinc/07/75/93/944077593.db2.gz JGCWGZKTCPHJSV-HNNXBMFYSA-N 0 3 405.336 4.111 20 0 HIADHN CCO[C@@H]1C[C@H](N[C@H](C)c2ccc(OC[C@H]3CCCCO3)c(F)c2)[C@@H]1n1cccn1 ZINC000559924021 944086739 /nfs/dbraw/zinc/08/67/39/944086739.db2.gz DSWBPAQPAKTGBM-DHZUNICFSA-N 0 3 417.525 4.039 20 0 HIADHN Cc1ccc(C=Cc2nc(SC[C@@H]3CN(Cc4ccccc4)CCCO3)n[nH]2)o1 ZINC000559976574 944106993 /nfs/dbraw/zinc/10/69/93/944106993.db2.gz CMWKCDGOVZGKNL-CFGKVWFZSA-N 0 3 410.543 4.260 20 0 HIADHN C[C@H]1CCN(C(=O)C2(Cc3cccc(F)c3)CCOCC2)CCN1Cc1ccccc1 ZINC000560082370 944151839 /nfs/dbraw/zinc/15/18/39/944151839.db2.gz BAOCVJYXHOEOFX-NRFANRHFSA-N 0 3 424.560 4.288 20 0 HIADHN C[C@H](CCN1CCN(C)CC1)NC(=O)N[C@H]1CCCCC[C@@H]1c1ccc(Cl)cc1 ZINC000560105297 944161544 /nfs/dbraw/zinc/16/15/44/944161544.db2.gz CATGQZFPJSQFIA-QIJUGHKUSA-N 0 3 421.029 4.082 20 0 HIADHN CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)N[C@@H]1CCN(C2CC2)C1 ZINC000560116599 944165849 /nfs/dbraw/zinc/16/58/49/944165849.db2.gz LUSCIKCURWGFAX-CQSZACIVSA-N 0 3 409.374 4.102 20 0 HIADHN CN(Cc1ccccc1)C(=O)CN[C@@H](c1cccc(C(F)(F)F)c1)C1CCOCC1 ZINC000560175768 944187124 /nfs/dbraw/zinc/18/71/24/944187124.db2.gz VWVUIHSJYLYSFW-JOCHJYFZSA-N 0 3 420.475 4.421 20 0 HIADHN O=C(CN[C@H](c1cccc(C(F)(F)F)c1)C1CCOCC1)NCc1ccccc1F ZINC000560182798 944189270 /nfs/dbraw/zinc/18/92/70/944189270.db2.gz YGOSLYXABAZNNR-NRFANRHFSA-N 0 3 424.438 4.218 20 0 HIADHN CN(C)C(=O)COc1ccccc1CN(Cc1cccs1)C1Cc2ccccc2C1 ZINC000560267018 944212008 /nfs/dbraw/zinc/21/20/08/944212008.db2.gz SWKNIYSUAQFXTJ-UHFFFAOYSA-N 0 3 420.578 4.385 20 0 HIADHN Cc1c([C@H](C)N[C@H](CO)C[C@@H](O)C(C)(C)C)cnn1-c1ccc(Cl)cc1Cl ZINC000560267441 944212953 /nfs/dbraw/zinc/21/29/53/944212953.db2.gz CRHGXOSCHHLKQC-VRHCTWJESA-N 0 3 414.377 4.296 20 0 HIADHN C[C@@]1(C2CC2)NC(=O)N(c2cccc(CN[C@@H]3CCCc4cc(F)ccc43)c2)C1=O ZINC000560267787 944213040 /nfs/dbraw/zinc/21/30/40/944213040.db2.gz GRLVRAVQFZWNMK-QPPBQGQZSA-N 0 3 407.489 4.218 20 0 HIADHN C/C=C/c1ccc(OC[C@H](O)CN[C@@H]2CCOc3c(Cl)cccc32)c(OC)c1 ZINC000560515480 944240610 /nfs/dbraw/zinc/24/06/10/944240610.db2.gz USUMLOYBJFHHDL-FIXKIMANSA-N 0 3 403.906 4.235 20 0 HIADHN COC(=O)c1ccc(C)c(NC(=O)[C@H](C)N[C@@H]2CC[C@@H](c3ccccc3)C[C@@H]2OC)c1 ZINC000560539024 944248094 /nfs/dbraw/zinc/24/80/94/944248094.db2.gz ZSORIYOMFPQMKC-GBPFJNKXSA-N 0 3 424.541 4.050 20 0 HIADHN CCc1nnc(NC(=O)[C@H](C)[C@@H](C)N[C@@H](c2ccccc2)c2ccc(OC)cc2)s1 ZINC000560571949 944257637 /nfs/dbraw/zinc/25/76/37/944257637.db2.gz OUEOFCSNMFBXLY-ZOCZFRKYSA-N 0 3 424.570 4.451 20 0 HIADHN CCN(CC)S(=O)(=O)c1ccc([C@H](C)NCc2ccc(CSC)cc2)cc1 ZINC000560580997 944262412 /nfs/dbraw/zinc/26/24/12/944262412.db2.gz BQXSKTWEFOQMHD-KRWDZBQOSA-N 0 3 406.617 4.431 20 0 HIADHN CN(CCCN(C)C(=O)[C@@H]1C[C@@H]1c1ccc(Cl)cc1Cl)Cc1ccncc1 ZINC000560594270 944266520 /nfs/dbraw/zinc/26/65/20/944266520.db2.gz FZBJHFJYZHZRMV-RTBURBONSA-N 0 3 406.357 4.472 20 0 HIADHN CC(=O)c1ccc(-c2ccc(C(=O)N(C)CCCN(C)Cc3ccncc3)o2)cc1 ZINC000560596858 944268168 /nfs/dbraw/zinc/26/81/68/944268168.db2.gz UPZZIZGRYHOOPZ-UHFFFAOYSA-N 0 3 405.498 4.138 20 0 HIADHN Brc1ccc(-n2cc(CN3CC4(CCOCC4)[C@H]3C3CC3)cn2)cc1 ZINC000560611632 944273847 /nfs/dbraw/zinc/27/38/47/944273847.db2.gz MKFIEVIYDVBZKQ-LJQANCHMSA-N 0 3 402.336 4.026 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)[C@H]1C[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000560676596 944291316 /nfs/dbraw/zinc/29/13/16/944291316.db2.gz PPRGKCQDBFRQDS-UFYCRDLUSA-N 0 3 404.432 4.014 20 0 HIADHN O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)[C@@H]1C[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000560676597 944291657 /nfs/dbraw/zinc/29/16/57/944291657.db2.gz PPRGKCQDBFRQDS-XUVXKRRUSA-N 0 3 404.432 4.014 20 0 HIADHN O=C(CCCN1CCC(C(=O)N2CCCCC2)CC1)c1ccc(Br)cc1 ZINC000560825362 944347907 /nfs/dbraw/zinc/34/79/07/944347907.db2.gz LBZIGMCPEAVYOR-UHFFFAOYSA-N 0 3 421.379 4.137 20 0 HIADHN CC(C)CCOC1CCN(CCc2nc3sc4c(c3c(N)n2)CCCC4)CC1 ZINC000560840888 944353381 /nfs/dbraw/zinc/35/33/81/944353381.db2.gz OTRGOVRZGCYQSP-UHFFFAOYSA-N 0 3 402.608 4.222 20 0 HIADHN Cc1cc(Br)ccc1NC(=O)CN[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000560890998 944365470 /nfs/dbraw/zinc/36/54/70/944365470.db2.gz HFEWZRBYIZRJML-VQIMIIECSA-N 0 3 416.363 4.121 20 0 HIADHN COC(=O)c1sc2[nH]c(CN[C@H](c3ccccc3C)C(C)(C)C)nc(=O)c2c1C ZINC000561161286 944491591 /nfs/dbraw/zinc/49/15/91/944491591.db2.gz SIXZAVODBUWKGD-GOSISDBHSA-N 0 3 413.543 4.265 20 0 HIADHN COC(=O)c1cc(NC(=O)c2cccc(CN3CCCC3)c2)ccc1Br ZINC000561190263 944508102 /nfs/dbraw/zinc/50/81/02/944508102.db2.gz LKIONSPORNMRQG-UHFFFAOYSA-N 0 3 417.303 4.084 20 0 HIADHN CN(C)C[C@H](NC(=O)[C@H]1C[C@H]1c1cccc(Br)c1)c1ccc(F)cc1 ZINC000561369550 944563662 /nfs/dbraw/zinc/56/36/62/944563662.db2.gz GYNIWMMHVDZABD-FHWLQOOXSA-N 0 3 405.311 4.111 20 0 HIADHN C[C@H]1CN(C(=O)CSCc2ccc(Br)cc2)CCN(C2CCC2)C1 ZINC000561532634 944659302 /nfs/dbraw/zinc/65/93/02/944659302.db2.gz ZUZBBGISHFMGBD-OAHLLOKOSA-N 0 3 411.409 4.015 20 0 HIADHN C[C@@H]1Cc2ccccc2N1Cc1occc1C(=O)N1CCN(C2CCC2)C[C@H](C)C1 ZINC000561533383 944659376 /nfs/dbraw/zinc/65/93/76/944659376.db2.gz SMNBPNAPTUYFCQ-RBUKOAKNSA-N 0 3 407.558 4.177 20 0 HIADHN CCCN(C)[C@H](CNC(=O)NC[C@H](C)c1c(C)noc1C)c1ccc(Cl)cc1 ZINC000561633821 944719445 /nfs/dbraw/zinc/71/94/45/944719445.db2.gz SWRAXAFSVVQJFB-IFXJQAMLSA-N 0 3 406.958 4.431 20 0 HIADHN CC(C)Oc1ccc([C@H](CNC(=O)c2ccc(-c3cncnc3)cc2F)N(C)C)cc1 ZINC000561681192 944744505 /nfs/dbraw/zinc/74/45/05/944744505.db2.gz FSVMRCCHADVWEI-QHCPKHFHSA-N 0 3 422.504 4.103 20 0 HIADHN C[C@@H](Cc1ccccc1C(F)(F)F)N(C)C(=O)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000561740858 944772608 /nfs/dbraw/zinc/77/26/08/944772608.db2.gz PCSVOIIWBYAQQC-PXNSSMCTSA-N 0 3 419.491 4.402 20 0 HIADHN Cc1oc(-c2cccc(C(F)(F)F)c2)nc1C(=O)N1CCN([C@@H]2C[C@H]2C)C[C@@H](C)C1 ZINC000561746508 944775531 /nfs/dbraw/zinc/77/55/31/944775531.db2.gz KUJJKLZJRSQVNV-HBUWYVDXSA-N 0 3 421.463 4.471 20 0 HIADHN COc1ccc(-c2ocnc2C(=O)NC[C@H]2CCCN(Cc3cccs3)C2)cc1 ZINC000561842484 944819075 /nfs/dbraw/zinc/81/90/75/944819075.db2.gz UUFLQDRXALNPLW-MRXNPFEDSA-N 0 3 411.527 4.054 20 0 HIADHN COc1nc(C)cc(C)c1CN1CCC[C@@H](c2nnc3ccc(C(F)(F)F)cn32)C1 ZINC000561861831 944825682 /nfs/dbraw/zinc/82/56/82/944825682.db2.gz SSMVVCUEBIGDBF-OAHLLOKOSA-N 0 3 419.451 4.148 20 0 HIADHN CCCN(C)[C@H](CNC(=O)N[C@@H](C)c1c(F)cncc1F)c1ccc(Cl)cc1 ZINC000561878670 944834306 /nfs/dbraw/zinc/83/43/06/944834306.db2.gz VMDLIAYHNFJADN-SCLBCKFNSA-N 0 3 410.896 4.457 20 0 HIADHN CC(C)c1nc(C2CCN(CCC(=O)Nc3cccc(Br)c3)CC2)no1 ZINC000561900041 944846249 /nfs/dbraw/zinc/84/62/49/944846249.db2.gz ZEIRJIZQARWXOH-UHFFFAOYSA-N 0 3 421.339 4.164 20 0 HIADHN CCS(=O)(=O)c1ccc(CN[C@@H](c2ccc(Br)cc2)C2CC2)cc1 ZINC000561905641 944849398 /nfs/dbraw/zinc/84/93/98/944849398.db2.gz FHSKQFAOIHWBAP-LJQANCHMSA-N 0 3 408.361 4.484 20 0 HIADHN COC(=O)c1cc(CN[C@H]2CCCc3nc(-c4ccc(OC)cc4)sc32)cn1C ZINC000561949440 944870863 /nfs/dbraw/zinc/87/08/63/944870863.db2.gz VEPJKJRYZSIHDZ-KRWDZBQOSA-N 0 3 411.527 4.111 20 0 HIADHN Cc1cc(C(C)(C)NCC(=O)N[C@@H]2CCOc3ccccc32)ccc1Br ZINC000562060394 944916198 /nfs/dbraw/zinc/91/61/98/944916198.db2.gz RTUUZDFQBQIYMS-GOSISDBHSA-N 0 3 417.347 4.222 20 0 HIADHN COC[C@H](NCCCCn1cc(Br)cn1)c1cccc(Cl)c1F ZINC000562064364 944919534 /nfs/dbraw/zinc/91/95/34/944919534.db2.gz KZCNOJPUMXCPCB-HNNXBMFYSA-N 0 3 404.711 4.196 20 0 HIADHN C[C@@H]1CCCN(CCNC(=O)C(C)(C)c2csc(-c3cc(F)ccc3F)n2)C1 ZINC000562070844 944922049 /nfs/dbraw/zinc/92/20/49/944922049.db2.gz RVXLGQAHSAKZOD-CQSZACIVSA-N 0 3 407.530 4.214 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1ccccc1CN1CCSCC1)c1ccco1 ZINC000562123724 944955263 /nfs/dbraw/zinc/95/52/63/944955263.db2.gz FHAUSVDUEINUEW-FXAWDEMLSA-N 0 3 416.591 4.079 20 0 HIADHN Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)N[C@H](C)[C@@H](c1ccccc1)N(C)C ZINC000562141852 944969579 /nfs/dbraw/zinc/96/95/79/944969579.db2.gz GVXCKXWZGIQVJK-GCJKJVERSA-N 0 3 410.562 4.194 20 0 HIADHN CN(C)[C@H](CNC(=O)N(C)Cc1ccc(OCC(F)(F)F)cc1)c1ccccc1 ZINC000562181201 945005990 /nfs/dbraw/zinc/00/59/90/945005990.db2.gz QFJXQECENQTEKS-LJQANCHMSA-N 0 3 409.452 4.072 20 0 HIADHN Fc1ccc([C@H]2C[C@H](N[C@@H](c3nnc[nH]3)c3ccccc3)C2)cc1Br ZINC000564149455 945401486 /nfs/dbraw/zinc/40/14/86/945401486.db2.gz VBAUEMDZTXVXBR-IIDMSEBBSA-N 0 3 401.283 4.332 20 0 HIADHN CN(C)CCN(Cc1ccccn1)C(=O)Nc1cc(F)ccc1SCC(F)F ZINC000564255408 945474865 /nfs/dbraw/zinc/47/48/65/945474865.db2.gz OEWGPTOOKMYALE-UHFFFAOYSA-N 0 3 412.481 4.174 20 0 HIADHN C/C(=C\c1ccccc1OC(F)F)CN(C)[C@@H](C)c1ccc(S(N)(=O)=O)cc1 ZINC000564261435 945478806 /nfs/dbraw/zinc/47/88/06/945478806.db2.gz RPODXGSGUVEQNQ-ZQHYZAEZSA-N 0 3 410.486 4.032 20 0 HIADHN CCCCO[C@@H]1C[C@@H](N[C@H](C)C(=O)Nc2c(C)nn(-c3ccccc3)c2C)C1(C)C ZINC000564293213 945502724 /nfs/dbraw/zinc/50/27/24/945502724.db2.gz BGBLWOGYJNONSW-DUXKGJEZSA-N 0 3 412.578 4.390 20 0 HIADHN CCCCO[C@@H]1C[C@H](N[C@@H](C)C(=O)Nc2c(C)nn(-c3ccccc3)c2C)C1(C)C ZINC000564293214 945502873 /nfs/dbraw/zinc/50/28/73/945502873.db2.gz BGBLWOGYJNONSW-DZFGPLHGSA-N 0 3 412.578 4.390 20 0 HIADHN C[C@H]1OCC[C@]1(O)CN(Cc1cnc(-c2ccsc2)s1)Cc1ccccc1 ZINC000564324847 945516300 /nfs/dbraw/zinc/51/63/00/945516300.db2.gz INGPXGGCCPZJIN-IERDGZPVSA-N 0 3 400.569 4.414 20 0 HIADHN Clc1ccc([C@@H](Cc2cccnc2)NCc2ccc(Cn3cncn3)cc2)cc1 ZINC000564434388 945583176 /nfs/dbraw/zinc/58/31/76/945583176.db2.gz VAKOWCZUHCMATG-HSZRJFAPSA-N 0 3 403.917 4.448 20 0 HIADHN CN(C(=O)N[C@@H]1CCc2c1cccc2Cl)C1CCN(CCc2ccccn2)CC1 ZINC000564642632 945718023 /nfs/dbraw/zinc/71/80/23/945718023.db2.gz GXUBHLBTDFOPNA-JOCHJYFZSA-N 0 3 412.965 4.071 20 0 HIADHN Cc1ccc(NC(=O)[C@H](C)N[C@@H]2CCN(C)[C@H]2c2ccc(Cl)c(F)c2)c(C)c1 ZINC000565743712 945877844 /nfs/dbraw/zinc/87/78/44/945877844.db2.gz NJUYWSMMUWUCCE-RVHYNSKXSA-N 0 3 403.929 4.458 20 0 HIADHN Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)N[C@@H]1CCCN(S(=O)(=O)C2CC2)C1 ZINC000565790674 945883602 /nfs/dbraw/zinc/88/36/02/945883602.db2.gz IOCUVICPICQCOW-MAUKXSAKSA-N 0 3 419.616 4.034 20 0 HIADHN Cc1nc2ccc(C(=O)NC[C@H](c3ccc(OC(C)C)cc3)N(C)C)cc2nc1C ZINC000566520566 946028340 /nfs/dbraw/zinc/02/83/40/946028340.db2.gz UEPMENYVVNNHOH-HSZRJFAPSA-N 0 3 406.530 4.067 20 0 HIADHN CN(C)C[C@H](NC(=O)[C@H]1CCn2c(cnc2C2CCCCC2)C1)c1ccc(F)cc1 ZINC000566523312 946029870 /nfs/dbraw/zinc/02/98/70/946029870.db2.gz NJSDCAXDNIDFBC-UGKGYDQZSA-N 0 3 412.553 4.051 20 0 HIADHN Cc1cc(NC(=O)c2ccccc2OC2CC2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000566585457 946047320 /nfs/dbraw/zinc/04/73/20/946047320.db2.gz QYEBHQWTMJFUGA-HXUWFJFHSA-N 0 3 416.525 4.432 20 0 HIADHN CCCN(CC)C[C@H](C)N[C@H](c1ccc(F)cc1)c1cccc(S(C)(=O)=O)c1 ZINC000566767677 946095242 /nfs/dbraw/zinc/09/52/42/946095242.db2.gz MKFFQXYOCSOXST-HTAPYJJXSA-N 0 3 406.567 4.029 20 0 HIADHN Cc1ccc(C[C@H](NC(=O)N2CCN(CCC(C)(C)C)CC2)c2ccccn2)cc1 ZINC000567018701 946217718 /nfs/dbraw/zinc/21/77/18/946217718.db2.gz HOLGDDBOZOBKQX-QHCPKHFHSA-N 0 3 408.590 4.437 20 0 HIADHN CC(C)Cc1ccc([C@H](CNC(=O)Cc2cncn2Cc2ccccc2)N(C)C)cc1 ZINC000567656920 946395756 /nfs/dbraw/zinc/39/57/56/946395756.db2.gz VYDWDRIQLJNEBV-VWLOTQADSA-N 0 3 418.585 4.092 20 0 HIADHN COc1cc(CN2CCC[C@@H](CCNC(C)=O)C2)ccc1OCc1ccc(F)cc1 ZINC000567720511 946399406 /nfs/dbraw/zinc/39/94/06/946399406.db2.gz LDUDFYZLIMZOCF-IBGZPJMESA-N 0 3 414.521 4.152 20 0 HIADHN COc1ccc(C(=O)N[C@@H](CN(C)C)c2ccc(F)cc2)cc1OC1CCCC1 ZINC000567780641 946405140 /nfs/dbraw/zinc/40/51/40/946405140.db2.gz DHEPBNGBJMUXPG-FQEVSTJZSA-N 0 3 400.494 4.188 20 0 HIADHN COC(=O)c1ccc(COc2ccccc2CN2CC[C@H](n3cc(C)cn3)C2)cc1 ZINC000567974302 946436385 /nfs/dbraw/zinc/43/63/85/946436385.db2.gz NTHUXQIEPCQUMQ-QFIPXVFZSA-N 0 3 405.498 4.004 20 0 HIADHN Cc1cc(CNCC2=Cc3cc(Br)ccc3OC2)cc(N2CCCC2)n1 ZINC000568569178 946606725 /nfs/dbraw/zinc/60/67/25/946606725.db2.gz HCXGDDQOKZMLSB-UHFFFAOYSA-N 0 3 414.347 4.318 20 0 HIADHN Cc1ccc(NC(=O)N(Cc2ccccc2Br)C2CCN(C)CC2)nc1 ZINC000568684711 946654642 /nfs/dbraw/zinc/65/46/42/946654642.db2.gz SMFLAJKTCDCVGB-UHFFFAOYSA-N 0 3 417.351 4.281 20 0 HIADHN C[C@H](N[C@@H](C)c1ccc(F)c2ccccc21)C(=O)N1CCN(c2ccccc2O)CC1 ZINC000568690209 946658134 /nfs/dbraw/zinc/65/81/34/946658134.db2.gz ISIJZDYRBANPNH-ROUUACIJSA-N 0 3 421.516 4.072 20 0 HIADHN COC(C)(C)c1nc(C)c(C(=O)N(C)C2CCN(Cc3ccccc3)CC2)s1 ZINC000568692144 946659053 /nfs/dbraw/zinc/65/90/53/946659053.db2.gz UIEUIUFVLREUAL-UHFFFAOYSA-N 0 3 401.576 4.070 20 0 HIADHN Cc1ccsc1CNC(=O)CN[C@@H]1CCN(C(C)C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000569005830 946792151 /nfs/dbraw/zinc/79/21/51/946792151.db2.gz BVIHEJUWEQITKP-NQIIRXRSSA-N 0 3 423.985 4.279 20 0 HIADHN Cc1cc(C)c(NC(=O)CN[C@H]2CCN(C)[C@@H]2c2ccc(Cl)c(F)c2)c(C)c1 ZINC000569293297 946853648 /nfs/dbraw/zinc/85/36/48/946853648.db2.gz YOVQRECRDHUKHV-SIKLNZKXSA-N 0 3 403.929 4.378 20 0 HIADHN C[C@H](NC[C@@]1(CO)C[C@@H]1c1ccccc1)c1ccccc1I ZINC000569397067 946866927 /nfs/dbraw/zinc/86/69/27/946866927.db2.gz ZRVJPTVZUNAXNC-POZUXBRTSA-N 0 3 407.295 4.108 20 0 HIADHN COc1ccc([C@H](C)NC[C@@H](c2c(F)cccc2Cl)N2CCO[C@H](C)C2)cc1O ZINC000569512801 946883125 /nfs/dbraw/zinc/88/31/25/946883125.db2.gz HRFBESDVEOWZSQ-VCBZYWHSSA-N 0 3 422.928 4.306 20 0 HIADHN c1cc2c(s1)CCN([C@H](CN[C@@H](c1nnc[nH]1)c1ccccc1)c1ccccc1)C2 ZINC000569617832 946897085 /nfs/dbraw/zinc/89/70/85/946897085.db2.gz ROBPFNOQKSZWRZ-FYYLOGMGSA-N 0 3 415.566 4.345 20 0 HIADHN CC(C)[C@@H]1CCCN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)CC1 ZINC000569640979 946915734 /nfs/dbraw/zinc/91/57/34/946915734.db2.gz PZTLHEIRAWTPRM-JOCHJYFZSA-N 0 3 400.611 4.057 20 0 HIADHN Cc1ccc(CN(CCN(C)C)C(=O)NCc2ccc(Oc3ccccc3)nc2)o1 ZINC000569677818 946936307 /nfs/dbraw/zinc/93/63/07/946936307.db2.gz HITRTFHKYYYAKH-UHFFFAOYSA-N 0 3 408.502 4.049 20 0 HIADHN Cc1ccnc2ccc(C(=O)Nc3ccnn3[C@H]3CCN(Cc4ccccc4)C3)cc12 ZINC000569754715 946986927 /nfs/dbraw/zinc/98/69/27/946986927.db2.gz LSPIKWDJGSXLMH-NRFANRHFSA-N 0 3 411.509 4.439 20 0 HIADHN Cc1c(F)cccc1-c1ccc(CN2CCC(C(=O)Nc3nncs3)CC2)o1 ZINC000569797671 947008376 /nfs/dbraw/zinc/00/83/76/947008376.db2.gz AALJARCUPNIULP-UHFFFAOYSA-N 0 3 400.479 4.096 20 0 HIADHN C[C@@H](N[C@H]1c2ccccc2CC12CCOCC2)C(=O)Nc1ccc(OC(F)F)cc1 ZINC000569891239 947037237 /nfs/dbraw/zinc/03/72/37/947037237.db2.gz BSYYMXNTNQSEEQ-QRWLVFNGSA-N 0 3 416.468 4.299 20 0 HIADHN CCOc1c(Cl)cc(CN(Cc2ccccc2)C[C@@]2(O)CCO[C@H]2C)cc1OC ZINC000569968636 947055726 /nfs/dbraw/zinc/05/57/26/947055726.db2.gz IWIFEFPXEQREOW-SBUREZEXSA-N 0 3 419.949 4.289 20 0 HIADHN CC1CCN([C@@H](CNC(=O)N2CCC=C(c3ccncc3)C2)c2ccccc2)CC1 ZINC000569996112 947064600 /nfs/dbraw/zinc/06/46/00/947064600.db2.gz HPXMWLXJTPQNOR-DEOSSOPVSA-N 0 3 404.558 4.354 20 0 HIADHN CC(=O)N1C[C@@H]2CCC[C@H](N[C@H](C(=O)Nc3cc(C)ccc3C)c3ccccc3)[C@@H]2C1 ZINC000570123315 947099675 /nfs/dbraw/zinc/09/96/75/947099675.db2.gz IVAPXKNEJAAPBV-AANQFLQQSA-N 0 3 419.569 4.220 20 0 HIADHN CC(=O)N1C[C@@H]2CCC[C@H](N[C@@H](C(=O)Nc3cc(C)ccc3C)c3ccccc3)[C@@H]2C1 ZINC000570123322 947100940 /nfs/dbraw/zinc/10/09/40/947100940.db2.gz IVAPXKNEJAAPBV-ONTNHIFESA-N 0 3 419.569 4.220 20 0 HIADHN COc1cc(C(C)=O)ccc1OC[C@H](O)CN1CCC[C@H](C)[C@H]1c1ccc(C)cc1 ZINC000570319257 947198993 /nfs/dbraw/zinc/19/89/93/947198993.db2.gz OGMKJCGVWJFJKH-FKRCVWNDSA-N 0 3 411.542 4.419 20 0 HIADHN CN(C)[C@@H](CNC(=O)N1CCC(c2noc3cc(F)ccc32)CC1)c1ccccc1 ZINC000570444174 947251799 /nfs/dbraw/zinc/25/17/99/947251799.db2.gz ILGBCZILFFQJMY-FQEVSTJZSA-N 0 3 410.493 4.159 20 0 HIADHN CC(C)Oc1ccc([C@@H](C)NCc2cccnc2N2CCN(C)CC2)cc1Cl ZINC000570468255 947254448 /nfs/dbraw/zinc/25/44/48/947254448.db2.gz AMEDKEYNPRWLTG-QGZVFWFLSA-N 0 3 402.970 4.125 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)N1CC[C@](F)(c2ccccc2)C1 ZINC000570828391 947363271 /nfs/dbraw/zinc/36/32/71/947363271.db2.gz JJPFXJBZZHVQLC-AFMYVXGZSA-N 0 3 413.459 4.072 20 0 HIADHN C[C@@H]1CN(CCC2CCN(C(=O)Cc3c[nH]c4cccc(Cl)c34)CC2)C[C@H](C)O1 ZINC000570949455 947395795 /nfs/dbraw/zinc/39/57/95/947395795.db2.gz XGTICMXRTSRVFF-CALCHBBNSA-N 0 3 417.981 4.102 20 0 HIADHN CC[C@H](C)N[C@@H](CNC(=O)C1(c2cc(F)cc(Br)c2)CC1)c1ccco1 ZINC000570958310 947399093 /nfs/dbraw/zinc/39/90/93/947399093.db2.gz RLEVJRCMUIVXEZ-GUYCJALGSA-N 0 3 423.326 4.458 20 0 HIADHN CSc1ccc([C@H](CNC(=O)c2cnc(-c3ccccc3)nc2C)N(C)C)cc1 ZINC000570962521 947400303 /nfs/dbraw/zinc/40/03/03/947400303.db2.gz GVJYWLVOWKBOHA-NRFANRHFSA-N 0 3 406.555 4.207 20 0 HIADHN CN1CCC(N(Cc2ccccc2Br)C(=O)c2ccc(Cl)cn2)CC1 ZINC000570984819 947411893 /nfs/dbraw/zinc/41/18/93/947411893.db2.gz MUHILRQNTLLTHA-UHFFFAOYSA-N 0 3 422.754 4.234 20 0 HIADHN CCCCO[C@@H](C)C(=O)N(Cc1ccccc1Br)C1CCN(C)CC1 ZINC000570985105 947412835 /nfs/dbraw/zinc/41/28/35/947412835.db2.gz UZRBIGSFYFDCRT-INIZCTEOSA-N 0 3 411.384 4.077 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)Nc1ccc(C(=O)NC2CCCC2)cc1 ZINC000571033223 947446195 /nfs/dbraw/zinc/44/61/95/947446195.db2.gz JIXCPMKLWQHPKQ-UHFFFAOYSA-N 0 3 400.567 4.089 20 0 HIADHN C[C@H](c1ccc(F)c(F)c1)N(C)C(=O)CN[C@@H]1c2ccccc2CC12CCOCC2 ZINC000571210509 947547436 /nfs/dbraw/zinc/54/74/36/947547436.db2.gz GMAIOBJBVSVYCW-WAIKUNEKSA-N 0 3 414.496 4.168 20 0 HIADHN CCCN(CCN1CCCCC1)C(=O)Nc1ccc(C(=O)N2CCCC[C@H]2C)cc1 ZINC000571307801 947586633 /nfs/dbraw/zinc/58/66/33/947586633.db2.gz VMWQATDLSQSBGY-HXUWFJFHSA-N 0 3 414.594 4.431 20 0 HIADHN CCOc1c(Br)cc(CN(C)[C@H]2CCCOC2)cc1Br ZINC000572407818 947896882 /nfs/dbraw/zinc/89/68/82/947896882.db2.gz GCLUZIWIEVKYRN-LBPRGKRZSA-N 0 3 407.146 4.221 20 0 HIADHN COc1ccc(C[C@H](CO)CNCc2cc(C(F)(F)F)ccc2Cl)cc1O ZINC000572526362 947931242 /nfs/dbraw/zinc/93/12/42/947931242.db2.gz DAMPUAKBNMSJRW-ZDUSSCGKSA-N 0 3 403.828 4.014 20 0 HIADHN CCN1CCN(c2ccc(NC(=O)N3CC[C@@H](c4cccc(F)c4)C3)c(C)c2)CC1 ZINC000572669231 947975278 /nfs/dbraw/zinc/97/52/78/947975278.db2.gz OYUKPALZLPKPQB-HXUWFJFHSA-N 0 3 410.537 4.297 20 0 HIADHN CC(=O)N(Cc1ccc(NC(=O)NCCCN2CCc3ccccc3C2)cc1)C(C)C ZINC000572678359 947978303 /nfs/dbraw/zinc/97/83/03/947978303.db2.gz OQRJZUXYTMBCRN-UHFFFAOYSA-N 0 3 422.573 4.013 20 0 HIADHN COc1cccc([C@@H](CNC(=O)NC[C@H]2CC[C@@H](c3ccccc3)O2)N2CCCC2)c1 ZINC000573053291 948073065 /nfs/dbraw/zinc/07/30/65/948073065.db2.gz PUFWJBGWYIIGRP-SMIHKQSGSA-N 0 3 423.557 4.052 20 0 HIADHN COc1ccc(CN(Cc2cc(OC)c(O)c(OC)c2)CC2CCC2)c(OC)c1 ZINC000573288100 948146653 /nfs/dbraw/zinc/14/66/53/948146653.db2.gz KSNKLYRTWLHYDT-UHFFFAOYSA-N 0 3 401.503 4.229 20 0 HIADHN Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)N[C@H](C)[C@@H](c1ccccc1)N(C)C ZINC000573350330 948162571 /nfs/dbraw/zinc/16/25/71/948162571.db2.gz RCFZRKXTQRKVOH-JPYJTQIMSA-N 0 3 422.573 4.480 20 0 HIADHN CSc1ccc([C@H](CNC(=O)CCc2cccc(OC(C)(C)C)n2)N(C)C)cc1 ZINC000573358578 948165327 /nfs/dbraw/zinc/16/53/27/948165327.db2.gz LJCUMQYCZVMEON-FQEVSTJZSA-N 0 3 415.603 4.333 20 0 HIADHN CCOc1ccc(CN(CCCn2ccnc2)Cc2cnc3ccc(C)cn23)cc1 ZINC000573407139 948191834 /nfs/dbraw/zinc/19/18/34/948191834.db2.gz FRZYCXIGONPGEL-UHFFFAOYSA-N 0 3 403.530 4.330 20 0 HIADHN FC(F)(F)c1ccnc(NCCNCc2cnc(-c3ccc(Cl)cc3)s2)n1 ZINC000573630022 948257041 /nfs/dbraw/zinc/25/70/41/948257041.db2.gz JSIIIDOIFZBVFD-UHFFFAOYSA-N 0 3 413.856 4.474 20 0 HIADHN O=C1CCc2cc(-c3noc([C@@H]4CCCN(Cc5cccc(F)c5)C4)n3)ccc2N1 ZINC000573737694 948285978 /nfs/dbraw/zinc/28/59/78/948285978.db2.gz RJGPVPKGXZOSMP-GOSISDBHSA-N 0 3 406.461 4.140 20 0 HIADHN CC(C)Oc1ccc([C@H](CN[C@H](c2cnn(C)c2)c2cccc(F)c2)N(C)C)cc1 ZINC000574184906 948382000 /nfs/dbraw/zinc/38/20/00/948382000.db2.gz LROGEOHZQRHYAL-ZEQRLZLVSA-N 0 3 410.537 4.328 20 0 HIADHN CSc1ccc([C@@H](CNC(=O)c2cc3sc(N(C)C)nc3s2)N(C)C)cc1 ZINC000574194512 948383406 /nfs/dbraw/zinc/38/34/06/948383406.db2.gz YBOWUINCDKWGLF-CQSZACIVSA-N 0 3 420.629 4.178 20 0 HIADHN CN(C)Cc1cccc(NC(=O)C(=O)N[C@@H](c2c(Cl)cccc2Cl)C2CC2)c1 ZINC000574206546 948386729 /nfs/dbraw/zinc/38/67/29/948386729.db2.gz GDCXXROTIQNEPF-LJQANCHMSA-N 0 3 420.340 4.261 20 0 HIADHN COc1cccc(Nc2ccccc2C(=O)N(C)CCCN(C)Cc2ccncc2)c1 ZINC000574233173 948392691 /nfs/dbraw/zinc/39/26/91/948392691.db2.gz FUXXNGVAHKFLKI-UHFFFAOYSA-N 0 3 418.541 4.428 20 0 HIADHN CC[C@H](C)N[C@H](CNC(=O)Nc1cnn(Cc2ccc(Cl)cc2)c1)c1ccco1 ZINC000574349726 948419298 /nfs/dbraw/zinc/41/92/98/948419298.db2.gz WDPWXMXYALFURF-HNAYVOBHSA-N 0 3 415.925 4.429 20 0 HIADHN CCCN(C)[C@@H](CNC(=O)Cc1cc(F)cc2c1OCOC2)c1ccc(Cl)cc1 ZINC000574421823 948434786 /nfs/dbraw/zinc/43/47/86/948434786.db2.gz GOJHGAQCUZPSRE-FQEVSTJZSA-N 0 3 420.912 4.087 20 0 HIADHN C[C@@H](N[C@H]1CCCN(Cc2nccn2C)C1=O)c1ccc(-c2c(F)cccc2F)cc1 ZINC000574490369 948457966 /nfs/dbraw/zinc/45/79/66/948457966.db2.gz PXAODIFPAJNMFX-IERDGZPVSA-N 0 3 424.495 4.207 20 0 HIADHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1ccc(Oc2ccccc2)cn1 ZINC000574534092 948464581 /nfs/dbraw/zinc/46/45/81/948464581.db2.gz VKFNAEAQUNXOMB-UHFFFAOYSA-N 0 3 419.447 4.409 20 0 HIADHN CN(C(=O)CN[C@@H]1c2ccccc2CC12CCOCC2)[C@@H]1CCCc2ccccc21 ZINC000574560905 948474868 /nfs/dbraw/zinc/47/48/68/948474868.db2.gz VDGSJCADJLXXHH-ILBGXUMGSA-N 0 3 404.554 4.206 20 0 HIADHN C[C@@H]1[C@H](NC(=O)CCc2nc(-c3ccc(Cl)cc3)no2)CCN1Cc1ccccc1 ZINC000574716507 948510846 /nfs/dbraw/zinc/51/08/46/948510846.db2.gz BSACDGFESPLTQI-OXQOHEQNSA-N 0 3 424.932 4.102 20 0 HIADHN CC[C@@H](C)N[C@@H](CNC(=O)c1cccc(C(=O)Nc2ccccc2)c1)c1ccco1 ZINC000575085410 948588423 /nfs/dbraw/zinc/58/84/23/948588423.db2.gz LYVMYBGSDFMKSM-UTKZUKDTSA-N 0 3 405.498 4.391 20 0 HIADHN CN(C)CCN(Cc1ccco1)C(=O)Nc1c(-c2cccs2)nc2ccccn21 ZINC000575370871 948661243 /nfs/dbraw/zinc/66/12/43/948661243.db2.gz QORBQTMHBJMYRS-UHFFFAOYSA-N 0 3 409.515 4.252 20 0 HIADHN O=C(CCNCc1ccccc1OC(F)(F)F)Nc1cccc(Br)c1 ZINC000575554388 948679084 /nfs/dbraw/zinc/67/90/84/948679084.db2.gz BVXGIKYBGKUPGD-UHFFFAOYSA-N 0 3 417.225 4.466 20 0 HIADHN O[C@@H](CN[C@H]1CCCOc2ccc(F)cc21)COc1ccc(Cl)cc1Cl ZINC000575735801 948689193 /nfs/dbraw/zinc/68/91/93/948689193.db2.gz OJSIYURMIJJXIX-YOEHRIQHSA-N 0 3 400.277 4.376 20 0 HIADHN COCC(C)(C)CCCNC(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000575834275 948729938 /nfs/dbraw/zinc/72/99/38/948729938.db2.gz JNBXCIGEECJQNW-HXUWFJFHSA-N 0 3 400.485 4.010 20 0 HIADHN C[C@H](N[C@@H]1CCN(c2ccc(Cl)cc2Cl)C1=O)c1ccccc1-n1ccnn1 ZINC000576017190 948810449 /nfs/dbraw/zinc/81/04/49/948810449.db2.gz ZMFHOABWNISAMG-SUMWQHHRSA-N 0 3 416.312 4.030 20 0 HIADHN COc1ccc([C@H](CNC(=O)Cc2ccc(Cl)c(Cl)c2)N2CCCC2)cc1 ZINC000009595253 571272289 /nfs/dbraw/zinc/27/22/89/571272289.db2.gz XPLBWXZVMVJLJI-FQEVSTJZSA-N 0 3 407.341 4.498 20 0 HIADHN